smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1cc([C@@H](C)[NH2+]Cc2nccs2)n(C)n1 ZINC000381279407 710615466 /nfs/dbraw/zinc/61/54/66/710615466.db2.gz XTGZKSVFRWDCSZ-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cccc(F)n2)o1 ZINC000381595075 710660223 /nfs/dbraw/zinc/66/02/23/710660223.db2.gz JIVCSUQKKYUIFS-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO CC(C)(C)c1coc(C[NH2+]C2CSC2)n1 ZINC000724382140 710739722 /nfs/dbraw/zinc/73/97/22/710739722.db2.gz RDOHSBDFENLNSI-UHFFFAOYSA-N 1 2 226.345 2.177 20 0 BEADLO Cc1ncc(NCc2c[nH+]cn2C(C)C)cn1 ZINC000384198289 710822454 /nfs/dbraw/zinc/82/24/54/710822454.db2.gz KKHSOHFCDFZZNM-UHFFFAOYSA-N 1 2 231.303 2.175 20 0 BEADLO CC[C@H](O)c1nccn1Cc1cc(C)cc(C)[nH+]1 ZINC000902733699 710886794 /nfs/dbraw/zinc/88/67/94/710886794.db2.gz FBUYCDAOIUEBNO-ZDUSSCGKSA-N 1 2 245.326 2.387 20 0 BEADLO C[C@@H]1OCC[N@H+](Cc2ccc(O)c(F)c2)[C@H]1C ZINC000380567427 712901682 /nfs/dbraw/zinc/90/16/82/712901682.db2.gz ZMAORICCVBRYEQ-UWVGGRQHSA-N 1 2 239.290 2.141 20 0 BEADLO CNc1cc(NCc2csc(C)c2C)nc[nH+]1 ZINC000399838563 710911609 /nfs/dbraw/zinc/91/16/09/710911609.db2.gz RWVYAWYALMDPGC-UHFFFAOYSA-N 1 2 248.355 2.231 20 0 BEADLO CNc1cc(NCc2csc(C)c2C)[nH+]cn1 ZINC000399838563 710911611 /nfs/dbraw/zinc/91/16/11/710911611.db2.gz RWVYAWYALMDPGC-UHFFFAOYSA-N 1 2 248.355 2.231 20 0 BEADLO C[C@@H]1OCC[N@@H+](Cc2ccc(O)c(F)c2)[C@H]1C ZINC000380567427 712901683 /nfs/dbraw/zinc/90/16/83/712901683.db2.gz ZMAORICCVBRYEQ-UWVGGRQHSA-N 1 2 239.290 2.141 20 0 BEADLO CC(C)[N@H+](CCC1OCCCO1)CC(F)F ZINC000387282480 711042889 /nfs/dbraw/zinc/04/28/89/711042889.db2.gz NJUZQYFXNSTYGJ-UHFFFAOYSA-N 1 2 237.290 2.115 20 0 BEADLO CC(C)[N@@H+](CCC1OCCCO1)CC(F)F ZINC000387282480 711042891 /nfs/dbraw/zinc/04/28/91/711042891.db2.gz NJUZQYFXNSTYGJ-UHFFFAOYSA-N 1 2 237.290 2.115 20 0 BEADLO Cc1cc(C[NH2+]Cc2nonc2C)c(C)s1 ZINC000390547772 711124413 /nfs/dbraw/zinc/12/44/13/711124413.db2.gz NLRWZDZWHQJOEC-UHFFFAOYSA-N 1 2 237.328 2.346 20 0 BEADLO O[C@H](C[NH2+][C@H]1CCCC1(F)F)c1ccccc1 ZINC000398140548 711402763 /nfs/dbraw/zinc/40/27/63/711402763.db2.gz WFUMPAXVEMOSAA-NEPJUHHUSA-N 1 2 241.281 2.497 20 0 BEADLO c1[nH]nnc1C[NH2+][C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC000398303471 711406989 /nfs/dbraw/zinc/40/69/89/711406989.db2.gz SQYQQWGQIUBXEZ-GRYCIOLGSA-N 1 2 234.347 2.253 20 0 BEADLO c1n[nH]nc1C[NH2+][C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC000398303471 711406991 /nfs/dbraw/zinc/40/69/91/711406991.db2.gz SQYQQWGQIUBXEZ-GRYCIOLGSA-N 1 2 234.347 2.253 20 0 BEADLO Cc1nonc1C[NH2+]Cc1csc(C)c1C ZINC000399797963 711435183 /nfs/dbraw/zinc/43/51/83/711435183.db2.gz FLJULJHYNVPJMA-UHFFFAOYSA-N 1 2 237.328 2.346 20 0 BEADLO CC[C@H]1CC[C@H]1[NH2+][C@@H](C)C(=O)OCC(C)C ZINC000381407770 710634117 /nfs/dbraw/zinc/63/41/17/710634117.db2.gz SVZJWMGCRWBGFO-SDDRHHMPSA-N 1 2 227.348 2.352 20 0 BEADLO CC(C)CSCCC[NH2+][C@]1(C)CCOC1=O ZINC000381463539 710640255 /nfs/dbraw/zinc/64/02/55/710640255.db2.gz KLPQVDFFTNMDAP-GFCCVEGCSA-N 1 2 245.388 2.061 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2cccc(C)c2F)[nH]1 ZINC000392367465 711144996 /nfs/dbraw/zinc/14/49/96/711144996.db2.gz IEOBQPMWDBAGFU-VIFPVBQESA-N 1 2 248.305 2.411 20 0 BEADLO FC(F)(F)[C@@H]1CCC[C@@H]([NH2+]Cc2c[nH]nn2)C1 ZINC000398352363 711407538 /nfs/dbraw/zinc/40/75/38/711407538.db2.gz GDJDYFURTRJVMM-HTQZYQBOSA-N 1 2 248.252 2.015 20 0 BEADLO FC(F)(F)[C@@H]1CCC[C@@H]([NH2+]Cc2cn[nH]n2)C1 ZINC000398352363 711407542 /nfs/dbraw/zinc/40/75/42/711407542.db2.gz GDJDYFURTRJVMM-HTQZYQBOSA-N 1 2 248.252 2.015 20 0 BEADLO COCCNc1cc(C)[nH+]c(C2CCC2)n1 ZINC000891390384 711509546 /nfs/dbraw/zinc/50/95/46/711509546.db2.gz MICNYOTYLSQDMD-UHFFFAOYSA-N 1 2 221.304 2.111 20 0 BEADLO Cn1cc(C[N@H+](Cc2ccoc2)C2CC2)cn1 ZINC000934005296 711561529 /nfs/dbraw/zinc/56/15/29/711561529.db2.gz XLOIOBXDXKJPSW-UHFFFAOYSA-N 1 2 231.299 2.178 20 0 BEADLO Cn1cc(C[N@@H+](Cc2ccoc2)C2CC2)cn1 ZINC000934005296 711561530 /nfs/dbraw/zinc/56/15/30/711561530.db2.gz XLOIOBXDXKJPSW-UHFFFAOYSA-N 1 2 231.299 2.178 20 0 BEADLO CC(C)C[C@H]1CCCN1C(=O)C[C@@H]([NH3+])C(F)F ZINC000724695152 711608992 /nfs/dbraw/zinc/60/89/92/711608992.db2.gz AXXFTHXUKJDRPC-NXEZZACHSA-N 1 2 248.317 2.006 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1CC[C@@H](C2CC2)O1 ZINC000722326656 711737880 /nfs/dbraw/zinc/73/78/80/711737880.db2.gz WKVOSMMINGEYMS-NEPJUHHUSA-N 1 2 248.326 2.460 20 0 BEADLO Cc1ncoc1C[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000894420213 711771392 /nfs/dbraw/zinc/77/13/92/711771392.db2.gz LXQACCNQJJNIIV-PSASIEDQSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1ncoc1C[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000894420213 711771393 /nfs/dbraw/zinc/77/13/93/711771393.db2.gz LXQACCNQJJNIIV-PSASIEDQSA-N 1 2 212.268 2.163 20 0 BEADLO C/C=C\C[C@@H]1CCCN(C(=O)Cc2c[nH+]c[nH]2)C1 ZINC000913354053 711821638 /nfs/dbraw/zinc/82/16/38/711821638.db2.gz YVKQFQOYLRIMEJ-ZZKXABKFSA-N 1 2 247.342 2.157 20 0 BEADLO C[C@@H]1C[N@H+](C/C(Cl)=C\Cl)CC[C@@H]1O ZINC000229571653 711838215 /nfs/dbraw/zinc/83/82/15/711838215.db2.gz MTEACHRVVGCXFZ-HFBYHIIMSA-N 1 2 224.131 2.008 20 0 BEADLO C[C@@H]1C[N@@H+](C/C(Cl)=C\Cl)CC[C@@H]1O ZINC000229571653 711838217 /nfs/dbraw/zinc/83/82/17/711838217.db2.gz MTEACHRVVGCXFZ-HFBYHIIMSA-N 1 2 224.131 2.008 20 0 BEADLO CCn1cc([C@H](C)[NH2+][C@H](C)c2ncc[nH]2)cn1 ZINC000138994678 711839610 /nfs/dbraw/zinc/83/96/10/711839610.db2.gz XFDCNVKJXGBENL-VHSXEESVSA-N 1 2 233.319 2.038 20 0 BEADLO Cc1cc(C)cc(C(=O)OCCn2cc[nH+]c2)c1 ZINC000763117217 711866064 /nfs/dbraw/zinc/86/60/64/711866064.db2.gz WQVSMTNIEFHQHV-UHFFFAOYSA-N 1 2 244.294 2.357 20 0 BEADLO CCn1cnn(C[N@H+](C)CCC(C)C)c1=S ZINC000921049397 711881919 /nfs/dbraw/zinc/88/19/19/711881919.db2.gz DAEBAIDTRPBKQG-UHFFFAOYSA-N 1 2 242.392 2.369 20 0 BEADLO CCn1cnn(C[N@@H+](C)CCC(C)C)c1=S ZINC000921049397 711881921 /nfs/dbraw/zinc/88/19/21/711881921.db2.gz DAEBAIDTRPBKQG-UHFFFAOYSA-N 1 2 242.392 2.369 20 0 BEADLO COc1c(C)c[nH+]c(CNCC(C)(F)F)c1C ZINC000700112400 711986091 /nfs/dbraw/zinc/98/60/91/711986091.db2.gz WUGCXAGOFGTYCH-UHFFFAOYSA-N 1 2 244.285 2.452 20 0 BEADLO COc1cccc(NCc2c[nH+]cn2C)c1F ZINC000701694773 712027976 /nfs/dbraw/zinc/02/79/76/712027976.db2.gz AZEYWQLULDAXNI-UHFFFAOYSA-N 1 2 235.262 2.180 20 0 BEADLO Cc1nc(NCC[C@@H]2CCSC2)cc[nH+]1 ZINC000704864074 712118918 /nfs/dbraw/zinc/11/89/18/712118918.db2.gz DIHKXPZENGJXHT-SNVBAGLBSA-N 1 2 223.345 2.340 20 0 BEADLO COC(C)(C)CC[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000707230678 712167018 /nfs/dbraw/zinc/16/70/18/712167018.db2.gz SMPANBUKCLIXHW-SNVBAGLBSA-N 1 2 245.363 2.121 20 0 BEADLO CC1(C)CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C[NH3+])O1 ZINC000714321996 712482224 /nfs/dbraw/zinc/48/22/24/712482224.db2.gz XOONDTDWMVOKRK-OLZOCXBDSA-N 1 2 240.391 2.147 20 0 BEADLO CC1(C)CCC[C@@H](C[N@H+]2CCCC[C@@H]2C[NH3+])O1 ZINC000714321996 712482225 /nfs/dbraw/zinc/48/22/25/712482225.db2.gz XOONDTDWMVOKRK-OLZOCXBDSA-N 1 2 240.391 2.147 20 0 BEADLO CC[NH2+]Cc1noc([C@H]2CCCC[C@H]2C)n1 ZINC000714453092 712490335 /nfs/dbraw/zinc/49/03/35/712490335.db2.gz YJTQPUBRYYKZRX-ZJUUUORDSA-N 1 2 223.320 2.473 20 0 BEADLO FC1(F)[C@H]2C[N@H+](Cc3ccc(Cl)nc3)C[C@H]21 ZINC000715420068 712518194 /nfs/dbraw/zinc/51/81/94/712518194.db2.gz YZPYCPPHPMVMGZ-DTORHVGOSA-N 1 2 244.672 2.432 20 0 BEADLO FC1(F)[C@H]2C[N@@H+](Cc3ccc(Cl)nc3)C[C@H]21 ZINC000715420068 712518196 /nfs/dbraw/zinc/51/81/96/712518196.db2.gz YZPYCPPHPMVMGZ-DTORHVGOSA-N 1 2 244.672 2.432 20 0 BEADLO C[C@H]([NH2+][C@H]1CCn2ccnc21)c1ccns1 ZINC000715999994 712551938 /nfs/dbraw/zinc/55/19/38/712551938.db2.gz RURRSFINIQKOLT-IUCAKERBSA-N 1 2 234.328 2.135 20 0 BEADLO Cc1ncc(C[NH2+][C@H](C)c2ccns2)o1 ZINC000716013192 712552591 /nfs/dbraw/zinc/55/25/91/712552591.db2.gz FLLUINWVTJPJAY-SSDOTTSWSA-N 1 2 223.301 2.290 20 0 BEADLO Cc1nc(C[NH2+]Cc2[nH]nc(C)c2C)cs1 ZINC000716452317 712562105 /nfs/dbraw/zinc/56/21/05/712562105.db2.gz SPMGDIFKQIKURH-UHFFFAOYSA-N 1 2 236.344 2.081 20 0 BEADLO C[C@H]1CC[C@@H](OC(=O)CCc2ccc(N)[nH+]c2)C1 ZINC000815224289 712588524 /nfs/dbraw/zinc/58/85/24/712588524.db2.gz SMORIZQOIZECFV-CMPLNLGQSA-N 1 2 248.326 2.328 20 0 BEADLO O=C1O[C@@H](Cn2cc[nH+]c2)CN1C1CCCCC1 ZINC000828021727 712593827 /nfs/dbraw/zinc/59/38/27/712593827.db2.gz ZTIGFYRCSXVWCO-LBPRGKRZSA-N 1 2 249.314 2.037 20 0 BEADLO CC[C@H](O)C[NH+]1Cc2cc(F)c(F)cc2C1 ZINC000847046349 712608442 /nfs/dbraw/zinc/60/84/42/712608442.db2.gz KEBMKTCXMQPKDQ-JTQLQIEISA-N 1 2 227.254 2.051 20 0 BEADLO c1nc([C@@H]2CCC[N@H+]2CCC2CCC2)n[nH]1 ZINC000931142085 712713584 /nfs/dbraw/zinc/71/35/84/712713584.db2.gz KSKYBNFPCOLHRO-NSHDSACASA-N 1 2 220.320 2.132 20 0 BEADLO c1nc([C@@H]2CCC[N@@H+]2CCC2CCC2)n[nH]1 ZINC000931142085 712713586 /nfs/dbraw/zinc/71/35/86/712713586.db2.gz KSKYBNFPCOLHRO-NSHDSACASA-N 1 2 220.320 2.132 20 0 BEADLO COc1ccncc1C[NH2+]Cc1cc(C)co1 ZINC000718069348 712741016 /nfs/dbraw/zinc/74/10/16/712741016.db2.gz DVGBXRHTBGFRDJ-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cnc(Cl)s2)CCO1 ZINC000720495404 712847245 /nfs/dbraw/zinc/84/72/45/712847245.db2.gz LSOWZRLJYNAQAU-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO CC1(CNc2cc[nH+]cc2F)CC(F)(F)C1 ZINC000720953607 712882350 /nfs/dbraw/zinc/88/23/50/712882350.db2.gz OWTQXWYNVWGCAM-UHFFFAOYSA-N 1 2 230.233 2.490 20 0 BEADLO Cc1nc(NC2(C)CC(F)(F)C2)cc[nH+]1 ZINC000720962648 712883759 /nfs/dbraw/zinc/88/37/59/712883759.db2.gz RVRNBOLMOQOKNJ-UHFFFAOYSA-N 1 2 213.231 2.385 20 0 BEADLO CCOC1CC2(C[C@@H]2Nc2cc[nH+]c(C)n2)C1 ZINC000721160818 712893553 /nfs/dbraw/zinc/89/35/53/712893553.db2.gz TYEGDDVAJIGODN-AKJDGMEZSA-N 1 2 233.315 2.155 20 0 BEADLO CS[C@@H](C)CC[N@@H+]1CCC[C@@H](F)C(=O)C1 ZINC001208139759 957010537 /nfs/dbraw/zinc/01/05/37/957010537.db2.gz VAMGQILSOKHHKU-VHSXEESVSA-N 1 2 233.352 2.131 20 0 BEADLO CS[C@@H](C)CC[N@H+]1CCC[C@@H](F)C(=O)C1 ZINC001208139759 957010546 /nfs/dbraw/zinc/01/05/46/957010546.db2.gz VAMGQILSOKHHKU-VHSXEESVSA-N 1 2 233.352 2.131 20 0 BEADLO Cc1n[nH]cc1C[N@@H+]1CCCC(F)(F)[C@H](F)C1 ZINC001209554071 957499818 /nfs/dbraw/zinc/49/98/18/957499818.db2.gz GLKITHOUELMHDI-SNVBAGLBSA-N 1 2 247.264 2.287 20 0 BEADLO Cc1n[nH]cc1C[N@H+]1CCCC(F)(F)[C@H](F)C1 ZINC001209554071 957499828 /nfs/dbraw/zinc/49/98/28/957499828.db2.gz GLKITHOUELMHDI-SNVBAGLBSA-N 1 2 247.264 2.287 20 0 BEADLO CC(C)(C)OC(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000692643310 960364084 /nfs/dbraw/zinc/36/40/84/960364084.db2.gz PKEGQYTWNMPCPX-UHFFFAOYSA-N 1 2 239.319 2.143 20 0 BEADLO Cc1cncc(C[N@@H+]2CCCC[C@@H](F)C2)n1 ZINC001203161264 961096473 /nfs/dbraw/zinc/09/64/73/961096473.db2.gz GTYLDEKGGOCPEY-LLVKDONJSA-N 1 2 223.295 2.109 20 0 BEADLO Cc1cncc(C[N@H+]2CCCC[C@@H](F)C2)n1 ZINC001203161264 961096490 /nfs/dbraw/zinc/09/64/90/961096490.db2.gz GTYLDEKGGOCPEY-LLVKDONJSA-N 1 2 223.295 2.109 20 0 BEADLO CC[C@H](CO)Nc1cc(C(C)C)[nH+]c(C)n1 ZINC000709786228 961562514 /nfs/dbraw/zinc/56/25/14/961562514.db2.gz UYXHARKYVPIFTG-SNVBAGLBSA-N 1 2 223.320 2.091 20 0 BEADLO COCc1cc[nH+]c(NC2CC(F)C2)c1 ZINC001154833219 962863710 /nfs/dbraw/zinc/86/37/10/962863710.db2.gz SZMSCQWTECGFAD-UHFFFAOYSA-N 1 2 210.252 2.140 20 0 BEADLO CC[C@H](C)Nc1nc(NC2CC2)c(OC)c[nH+]1 ZINC001167999967 963213483 /nfs/dbraw/zinc/21/34/83/963213483.db2.gz NUTBRZRJCHTMGT-QMMMGPOBSA-N 1 2 236.319 2.270 20 0 BEADLO c1nc(C[N@H+]2CC[C@H]3CCCO[C@@H]3C2)cs1 ZINC001137592683 963880679 /nfs/dbraw/zinc/88/06/79/963880679.db2.gz YZERJLBQTRNQIP-ZYHUDNBSSA-N 1 2 238.356 2.144 20 0 BEADLO CCN(CC)c1cc(N(C)CC(F)F)[nH+]cn1 ZINC001158927267 963961031 /nfs/dbraw/zinc/96/10/31/963961031.db2.gz YQJDTYUQWHMQBS-UHFFFAOYSA-N 1 2 244.289 2.024 20 0 BEADLO CCN(CC)c1cc(N(C)CC(F)F)nc[nH+]1 ZINC001158927267 963961034 /nfs/dbraw/zinc/96/10/34/963961034.db2.gz YQJDTYUQWHMQBS-UHFFFAOYSA-N 1 2 244.289 2.024 20 0 BEADLO Cc1nc(N2CC(C)(C)C2)c2c([nH+]1)CCC2 ZINC001163726972 965538593 /nfs/dbraw/zinc/53/85/93/965538593.db2.gz DQKHFLXBRWLMNU-UHFFFAOYSA-N 1 2 217.316 2.120 20 0 BEADLO Cc1csc(C(=O)OCCn2cc[nH+]c2)c1 ZINC000835348760 965939807 /nfs/dbraw/zinc/93/98/07/965939807.db2.gz BIGRLFSXJUVFAC-UHFFFAOYSA-N 1 2 236.296 2.110 20 0 BEADLO CCc1cn(C[C@H]2CC[C@@H](C3CC3)O2)c[nH+]1 ZINC001166822319 966427535 /nfs/dbraw/zinc/42/75/35/966427535.db2.gz KDLIQGKWEQEJBO-OLZOCXBDSA-N 1 2 220.316 2.403 20 0 BEADLO Fc1ccc(F)c(CC[NH2+]Cc2ccn[nH]2)c1 ZINC000080245897 1165795570 /nfs/dbraw/zinc/79/55/70/1165795570.db2.gz WBYILGCFVOIKPF-UHFFFAOYSA-N 1 2 237.253 2.020 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2cncnc2)c1 ZINC001203654427 966721698 /nfs/dbraw/zinc/72/16/98/966721698.db2.gz JRPMPMQUEQGQGL-UHFFFAOYSA-N 1 2 200.245 2.232 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2ccc[nH]2)C[C@@H]1F ZINC001204006856 966844880 /nfs/dbraw/zinc/84/48/80/966844880.db2.gz MKIFAJBBVOOPSJ-WDEREUQCSA-N 1 2 214.259 2.287 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2ccc[nH]2)C[C@@H]1F ZINC001204006856 966844890 /nfs/dbraw/zinc/84/48/90/966844890.db2.gz MKIFAJBBVOOPSJ-WDEREUQCSA-N 1 2 214.259 2.287 20 0 BEADLO Cc1c(C2=CCOC2)ccc2[nH+]ccn21 ZINC001239493783 966918856 /nfs/dbraw/zinc/91/88/56/966918856.db2.gz DJORJCZQJLLNIC-UHFFFAOYSA-N 1 2 200.241 2.056 20 0 BEADLO c1csc(C[N@@H+]2CC[C@H]3CCCO[C@H]3C2)n1 ZINC001204545614 967038039 /nfs/dbraw/zinc/03/80/39/967038039.db2.gz ZITLENPZDSVWMD-MNOVXSKESA-N 1 2 238.356 2.144 20 0 BEADLO c1csc(C[N@H+]2CC[C@H]3CCCO[C@H]3C2)n1 ZINC001204545614 967038049 /nfs/dbraw/zinc/03/80/49/967038049.db2.gz ZITLENPZDSVWMD-MNOVXSKESA-N 1 2 238.356 2.144 20 0 BEADLO COC(=O)CCCc1cc(C)[nH+]c(C)c1 ZINC001250144899 967432414 /nfs/dbraw/zinc/43/24/14/967432414.db2.gz CRGHQZWDTNVJHE-UHFFFAOYSA-N 1 2 207.273 2.194 20 0 BEADLO Cc1[nH+]cc(Nc2cncs2)cc1N ZINC001210287006 1165864672 /nfs/dbraw/zinc/86/46/72/1165864672.db2.gz JGIYEHLACNXCTM-UHFFFAOYSA-N 1 2 206.274 2.172 20 0 BEADLO COC(C)(C)Cc1ccn2cc[nH+]c2c1 ZINC001250353063 967752511 /nfs/dbraw/zinc/75/25/11/967752511.db2.gz ZURKXGYPLHUTHF-UHFFFAOYSA-N 1 2 204.273 2.302 20 0 BEADLO CO[C@@H]1C[N@H+](Cc2cccc(F)c2C)C[C@@H]1F ZINC001204509311 1165909996 /nfs/dbraw/zinc/90/99/96/1165909996.db2.gz YMRXWTBJVWCFOT-QWHCGFSZSA-N 1 2 241.281 2.303 20 0 BEADLO CO[C@@H]1C[N@@H+](Cc2cccc(F)c2C)C[C@@H]1F ZINC001204509311 1165910003 /nfs/dbraw/zinc/91/00/03/1165910003.db2.gz YMRXWTBJVWCFOT-QWHCGFSZSA-N 1 2 241.281 2.303 20 0 BEADLO COc1cc(Nc2ncc(F)cc2N)cc(C)[nH+]1 ZINC001210775542 1165948798 /nfs/dbraw/zinc/94/87/98/1165948798.db2.gz XGLFUUOBMSJVSA-UHFFFAOYSA-N 1 2 248.261 2.259 20 0 BEADLO Cc1ccccc1CN1CC[NH2+]CC(F)(F)C1 ZINC001210814407 1165956571 /nfs/dbraw/zinc/95/65/71/1165956571.db2.gz COYLNXSMRHJSSQ-UHFFFAOYSA-N 1 2 240.297 2.036 20 0 BEADLO CC1(C)C[N@H+](Cc2c(N)cccc2F)CCO1 ZINC000109427283 1166014886 /nfs/dbraw/zinc/01/48/86/1166014886.db2.gz MRICZGNTOVUQDT-UHFFFAOYSA-N 1 2 238.306 2.019 20 0 BEADLO CC1(C)C[N@@H+](Cc2c(N)cccc2F)CCO1 ZINC000109427283 1166014894 /nfs/dbraw/zinc/01/48/94/1166014894.db2.gz MRICZGNTOVUQDT-UHFFFAOYSA-N 1 2 238.306 2.019 20 0 BEADLO COc1ccc[nH+]c1NC[C@H](O)c1ccccc1 ZINC000127772881 1166038732 /nfs/dbraw/zinc/03/87/32/1166038732.db2.gz PRIVKFSVULDGPN-LBPRGKRZSA-N 1 2 244.294 2.236 20 0 BEADLO Cc1cc(-c2ccc(O)c(F)c2)c[nH+]c1N ZINC000082730053 1166076884 /nfs/dbraw/zinc/07/68/84/1166076884.db2.gz KNTUNEAMWSCWCH-UHFFFAOYSA-N 1 2 218.231 2.484 20 0 BEADLO OCC1CC[NH+](C/C(Cl)=C/Cl)CC1 ZINC000086001407 1166147110 /nfs/dbraw/zinc/14/71/10/1166147110.db2.gz QKYSQDDTIIXMGB-UITAMQMPSA-N 1 2 224.131 2.010 20 0 BEADLO CCC[C@@H](O)C[N@H+]1CCC[C@@H](F)C(F)(F)C1 ZINC001252779417 968953658 /nfs/dbraw/zinc/95/36/58/968953658.db2.gz QEOJHMGECKHNSO-NXEZZACHSA-N 1 2 239.281 2.217 20 0 BEADLO COc1cc(CNc2cccc[nH+]2)sn1 ZINC000399333653 1166178100 /nfs/dbraw/zinc/17/81/00/1166178100.db2.gz WDLUEAUZYWBKSM-UHFFFAOYSA-N 1 2 221.285 2.159 20 0 BEADLO CS[C@@H](C)CC[N@@H+]1CCCC(=O)[C@H](F)C1 ZINC001208138996 969055418 /nfs/dbraw/zinc/05/54/18/969055418.db2.gz OGSYBEMGBDJTIX-VHSXEESVSA-N 1 2 233.352 2.131 20 0 BEADLO CS[C@@H](C)CC[N@H+]1CCCC(=O)[C@H](F)C1 ZINC001208138996 969055426 /nfs/dbraw/zinc/05/54/26/969055426.db2.gz OGSYBEMGBDJTIX-VHSXEESVSA-N 1 2 233.352 2.131 20 0 BEADLO CC[N@H+](C[C@H](C)C(F)(F)F)[C@@H](C)C(=O)OC ZINC001208898882 969286609 /nfs/dbraw/zinc/28/66/09/969286609.db2.gz ZDEYYWOUSGBLJD-YUMQZZPRSA-N 1 2 241.253 2.068 20 0 BEADLO CC[N@@H+](C[C@H](C)C(F)(F)F)[C@@H](C)C(=O)OC ZINC001208898882 969286618 /nfs/dbraw/zinc/28/66/18/969286618.db2.gz ZDEYYWOUSGBLJD-YUMQZZPRSA-N 1 2 241.253 2.068 20 0 BEADLO C[C@@H](C[N@H+]1CCC(=O)[C@@H](F)CC1)C(F)(F)F ZINC001208896580 969286699 /nfs/dbraw/zinc/28/66/99/969286699.db2.gz XFRIYSFHKLVEKZ-YUMQZZPRSA-N 1 2 241.228 2.188 20 0 BEADLO C[C@@H](C[N@@H+]1CCC(=O)[C@@H](F)CC1)C(F)(F)F ZINC001208896580 969286703 /nfs/dbraw/zinc/28/67/03/969286703.db2.gz XFRIYSFHKLVEKZ-YUMQZZPRSA-N 1 2 241.228 2.188 20 0 BEADLO Cc1ccc(NC(=O)C[C@H]([NH3+])C(F)F)c(C)c1 ZINC000724762564 1166362068 /nfs/dbraw/zinc/36/20/68/1166362068.db2.gz QAXRXIYNPRKBEF-VIFPVBQESA-N 1 2 242.269 2.224 20 0 BEADLO Cc1cccc(C)c1NC(=O)C[C@@H]([NH3+])C(F)F ZINC000724762046 1166361410 /nfs/dbraw/zinc/36/14/10/1166361410.db2.gz LSCOXZAKTMRJEK-SECBINFHSA-N 1 2 242.269 2.224 20 0 BEADLO COC1CCC(C[NH+]2CC(C)(F)C2)CC1 ZINC001209395401 969459716 /nfs/dbraw/zinc/45/97/16/969459716.db2.gz FXTINRQLEYXLLR-UHFFFAOYSA-N 1 2 215.312 2.235 20 0 BEADLO C=Cc1ccc(NCC2(CO)CCC2)[nH+]c1 ZINC001156270679 969489737 /nfs/dbraw/zinc/48/97/37/969489737.db2.gz JBCVQSNLTYBVFR-UHFFFAOYSA-N 1 2 218.300 2.299 20 0 BEADLO Cc1c[nH+]cc(NC[C@@H](O)C(F)(F)F)c1C ZINC001169455732 969640757 /nfs/dbraw/zinc/64/07/57/969640757.db2.gz KVEUJMASZYFHTA-SECBINFHSA-N 1 2 234.221 2.034 20 0 BEADLO COC(=O)c1ccc(-c2cc[nH+]c(N)c2)cc1 ZINC000082729984 1166473073 /nfs/dbraw/zinc/47/30/73/1166473073.db2.gz JTOHCRBCTGEVPC-UHFFFAOYSA-N 1 2 228.251 2.117 20 0 BEADLO CCc1cc(C[NH2+]Cc2csc(C)n2)[nH]n1 ZINC000393791479 1166527050 /nfs/dbraw/zinc/52/70/50/1166527050.db2.gz ZLYJTEGKKYVRBV-UHFFFAOYSA-N 1 2 236.344 2.027 20 0 BEADLO CC(=O)[C@H]1CCCC[N@@H+]1Cc1oc(C)nc1C ZINC000723623156 969790157 /nfs/dbraw/zinc/79/01/57/969790157.db2.gz IRJRPAWNHBWNLV-GFCCVEGCSA-N 1 2 236.315 2.235 20 0 BEADLO CC(=O)[C@H]1CCCC[N@H+]1Cc1oc(C)nc1C ZINC000723623156 969790166 /nfs/dbraw/zinc/79/01/66/969790166.db2.gz IRJRPAWNHBWNLV-GFCCVEGCSA-N 1 2 236.315 2.235 20 0 BEADLO C[N@H+](Cc1ccccn1)Cc1c(N)cccc1F ZINC000104056490 1166533288 /nfs/dbraw/zinc/53/32/88/1166533288.db2.gz UYROGHFOBAORLF-UHFFFAOYSA-N 1 2 245.301 2.435 20 0 BEADLO C[N@@H+](Cc1ccccn1)Cc1c(N)cccc1F ZINC000104056490 1166533296 /nfs/dbraw/zinc/53/32/96/1166533296.db2.gz UYROGHFOBAORLF-UHFFFAOYSA-N 1 2 245.301 2.435 20 0 BEADLO Cc1[nH+]cc(Nc2ccc(F)nc2)cc1N ZINC001210287095 969853147 /nfs/dbraw/zinc/85/31/47/969853147.db2.gz LNMOQXHCOCZAAZ-UHFFFAOYSA-N 1 2 218.235 2.250 20 0 BEADLO CSCc1ccc(N[C@@H](C)CCO)[nH+]c1 ZINC001156452355 969897466 /nfs/dbraw/zinc/89/74/66/969897466.db2.gz SACDEXMCLBJWCF-VIFPVBQESA-N 1 2 226.345 2.127 20 0 BEADLO Cc1cnc(C[NH2+]Cc2cc(C)ccn2)s1 ZINC000394726155 1166590068 /nfs/dbraw/zinc/59/00/68/1166590068.db2.gz NYVFQMIISJQFBR-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO Cc1cccnc1C[NH2+][C@@H]1C[C@@H](C)n2ccnc21 ZINC000379004650 1166628660 /nfs/dbraw/zinc/62/86/60/1166628660.db2.gz DLSAVSCBIUGLNQ-VXGBXAGGSA-N 1 2 242.326 2.382 20 0 BEADLO Cc1c[nH+]cc(Nc2ccncn2)c1C ZINC001213523109 970343654 /nfs/dbraw/zinc/34/36/54/970343654.db2.gz LMGKCBAIJYTFGZ-UHFFFAOYSA-N 1 2 200.245 2.232 20 0 BEADLO C[C@@H](CC(F)(F)F)[N@H+](C)Cc1cnccn1 ZINC001255656727 970435011 /nfs/dbraw/zinc/43/50/11/970435011.db2.gz ADWQBGCOEGYBQU-QMMMGPOBSA-N 1 2 233.237 2.249 20 0 BEADLO C[C@@H](CC(F)(F)F)[N@@H+](C)Cc1cnccn1 ZINC001255656727 970435030 /nfs/dbraw/zinc/43/50/30/970435030.db2.gz ADWQBGCOEGYBQU-QMMMGPOBSA-N 1 2 233.237 2.249 20 0 BEADLO C[C@H](C(=O)N1C[C@@H](C)CC1(C)C)n1cc[nH+]c1 ZINC001354113319 1166741635 /nfs/dbraw/zinc/74/16/35/1166741635.db2.gz VVDVKINVYZYHKW-WDEREUQCSA-N 1 2 235.331 2.091 20 0 BEADLO Cc1[nH+]cn(-c2ccc(Cl)c(O)c2F)c1N ZINC001214796044 970539251 /nfs/dbraw/zinc/53/92/51/970539251.db2.gz FUEBGXSTJFXQLL-UHFFFAOYSA-N 1 2 241.653 2.261 20 0 BEADLO Cc1nnc(C[NH2+][C@H](C)c2cccc(F)c2)n1C ZINC000042337922 1166811333 /nfs/dbraw/zinc/81/13/33/1166811333.db2.gz CVMNLBYCYHIEHU-SECBINFHSA-N 1 2 248.305 2.113 20 0 BEADLO CCCOCCNc1cc2cc[nH]c2c[nH+]1 ZINC001167871413 1166877568 /nfs/dbraw/zinc/87/75/68/1166877568.db2.gz OGBDGHLICWEXPI-UHFFFAOYSA-N 1 2 219.288 2.401 20 0 BEADLO Cc1cc(F)ccc1C[NH2+]Cc1csnn1 ZINC000398433459 1167063406 /nfs/dbraw/zinc/06/34/06/1167063406.db2.gz UOAHDPHDBZNPTF-UHFFFAOYSA-N 1 2 237.303 2.275 20 0 BEADLO CO[C@H](C)CNc1cc2cc[nH]c2c[nH+]1 ZINC000308956701 1167228199 /nfs/dbraw/zinc/22/81/99/1167228199.db2.gz QTAWQNHAOSIEDI-MRVPVSSYSA-N 1 2 205.261 2.010 20 0 BEADLO CC(C)(CF)[NH2+]Cc1nccn1C1CC1 ZINC001335491551 977094845 /nfs/dbraw/zinc/09/48/45/977094845.db2.gz YHPAYYSKXDXBJJ-UHFFFAOYSA-N 1 2 211.284 2.056 20 0 BEADLO COc1cc(OC2C[NH+](C)C2)ccc1Cl ZINC001230980438 977408863 /nfs/dbraw/zinc/40/88/63/977408863.db2.gz DMNZNZTVFMRJNC-UHFFFAOYSA-N 1 2 227.691 2.041 20 0 BEADLO COc1ccnc(C[N@H+]2C[C@@H](F)C[C@H]2C)c1 ZINC001231966989 977815558 /nfs/dbraw/zinc/81/55/58/977815558.db2.gz OZYPMRITGNJJDV-ZJUUUORDSA-N 1 2 224.279 2.023 20 0 BEADLO C[N@@H+](Cc1ccsc1)Cc1cncc(O)c1 ZINC001232042288 977838215 /nfs/dbraw/zinc/83/82/15/977838215.db2.gz QCTBWAPJCYJYOP-UHFFFAOYSA-N 1 2 234.324 2.481 20 0 BEADLO CC[N@H+](C)Cc1c(Cl)nccc1OC ZINC001232152913 977897379 /nfs/dbraw/zinc/89/73/79/977897379.db2.gz WDTILJHJFXFEPO-UHFFFAOYSA-N 1 2 214.696 2.195 20 0 BEADLO CC[N@@H+](C)Cc1c(Cl)nccc1OC ZINC001232152913 977897385 /nfs/dbraw/zinc/89/73/85/977897385.db2.gz WDTILJHJFXFEPO-UHFFFAOYSA-N 1 2 214.696 2.195 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1cnsc1 ZINC001232225221 977949910 /nfs/dbraw/zinc/94/99/10/977949910.db2.gz XHGOXRWPSNXYGW-VXNVDRBHSA-N 1 2 200.282 2.075 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1cnsc1 ZINC001232225221 977949920 /nfs/dbraw/zinc/94/99/20/977949920.db2.gz XHGOXRWPSNXYGW-VXNVDRBHSA-N 1 2 200.282 2.075 20 0 BEADLO F[C@@H]1CSC2(C[NH+](Cc3cnsc3)C2)C1 ZINC001232230708 977962043 /nfs/dbraw/zinc/96/20/43/977962043.db2.gz TYFPJTJXUWQSSG-VIFPVBQESA-N 1 2 244.360 2.173 20 0 BEADLO CCOc1ccc(C[N@@H+]2CC[C@@H](F)C2)c(C)n1 ZINC001232307993 978001174 /nfs/dbraw/zinc/00/11/74/978001174.db2.gz LNGCJPSVWUICKB-GFCCVEGCSA-N 1 2 238.306 2.333 20 0 BEADLO CCOc1ccc(C[N@H+]2CC[C@@H](F)C2)c(C)n1 ZINC001232307993 978001187 /nfs/dbraw/zinc/00/11/87/978001187.db2.gz LNGCJPSVWUICKB-GFCCVEGCSA-N 1 2 238.306 2.333 20 0 BEADLO CCc1ccc(C[N@H+]2CCC(=O)[C@@H](C)CC2)nc1 ZINC001231637505 1167661747 /nfs/dbraw/zinc/66/17/47/1167661747.db2.gz HNTYDRLXQQIXBZ-LBPRGKRZSA-N 1 2 246.354 2.445 20 0 BEADLO CCc1ccc(C[N@@H+]2CCC(=O)[C@@H](C)CC2)nc1 ZINC001231637505 1167661751 /nfs/dbraw/zinc/66/17/51/1167661751.db2.gz HNTYDRLXQQIXBZ-LBPRGKRZSA-N 1 2 246.354 2.445 20 0 BEADLO CCc1ccc(C[N@H+]2CCC(=O)[C@H](C)CC2)nc1 ZINC001231637504 1167661835 /nfs/dbraw/zinc/66/18/35/1167661835.db2.gz HNTYDRLXQQIXBZ-GFCCVEGCSA-N 1 2 246.354 2.445 20 0 BEADLO CCc1ccc(C[N@@H+]2CCC(=O)[C@H](C)CC2)nc1 ZINC001231637504 1167661838 /nfs/dbraw/zinc/66/18/38/1167661838.db2.gz HNTYDRLXQQIXBZ-GFCCVEGCSA-N 1 2 246.354 2.445 20 0 BEADLO Cc1[nH]c(CN2CC[C@@H](CF)C(F)(F)C2)c[nH+]1 ZINC001232459303 978087088 /nfs/dbraw/zinc/08/70/88/978087088.db2.gz BTHSWSQCGMGDCZ-VIFPVBQESA-N 1 2 247.264 2.145 20 0 BEADLO Cc1[nH]cc(CN2CC[C@@H](CF)C(F)(F)C2)[nH+]1 ZINC001232459303 978087102 /nfs/dbraw/zinc/08/71/02/978087102.db2.gz BTHSWSQCGMGDCZ-VIFPVBQESA-N 1 2 247.264 2.145 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)Nc1cc(Cl)ccn1 ZINC001336968816 978089228 /nfs/dbraw/zinc/08/92/28/978089228.db2.gz DTIIHVQCDBKQDT-VIFPVBQESA-N 1 2 236.706 2.432 20 0 BEADLO Cc1[nH]c(CN2CC(F)(F)C[C@]2(C)CF)c[nH+]1 ZINC001232460417 978095340 /nfs/dbraw/zinc/09/53/40/978095340.db2.gz PWLWVLKXFMCVND-SNVBAGLBSA-N 1 2 247.264 2.287 20 0 BEADLO Cc1[nH]cc(CN2CC(F)(F)C[C@]2(C)CF)[nH+]1 ZINC001232460417 978095348 /nfs/dbraw/zinc/09/53/48/978095348.db2.gz PWLWVLKXFMCVND-SNVBAGLBSA-N 1 2 247.264 2.287 20 0 BEADLO CC[C@H](F)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC001337204188 978213512 /nfs/dbraw/zinc/21/35/12/978213512.db2.gz DDWDYVPAXPJEEL-VIFPVBQESA-N 1 2 221.235 2.021 20 0 BEADLO CNc1ccc(Nc2cncc(OC)c2)c[nH+]1 ZINC001203450254 1167719661 /nfs/dbraw/zinc/71/96/61/1167719661.db2.gz YVSZFLXTWHVTTD-UHFFFAOYSA-N 1 2 230.271 2.271 20 0 BEADLO Cc1c(Cl)nccc1C[N@H+](C)CCF ZINC001232755222 978261705 /nfs/dbraw/zinc/26/17/05/978261705.db2.gz WMDZNGBCRJONRE-UHFFFAOYSA-N 1 2 216.687 2.445 20 0 BEADLO Cc1c(Cl)nccc1C[N@@H+](C)CCF ZINC001232755222 978261717 /nfs/dbraw/zinc/26/17/17/978261717.db2.gz WMDZNGBCRJONRE-UHFFFAOYSA-N 1 2 216.687 2.445 20 0 BEADLO CCOC(=O)c1ccsc1C[NH+]1CC(C)C1 ZINC001233017922 978412530 /nfs/dbraw/zinc/41/25/30/978412530.db2.gz LOUXKMUSHTWXHJ-UHFFFAOYSA-N 1 2 239.340 2.377 20 0 BEADLO Oc1cccc(C[NH+]2CCSCC2)c1F ZINC001233051473 978447651 /nfs/dbraw/zinc/44/76/51/978447651.db2.gz NWDQKHSAUYLEBE-UHFFFAOYSA-N 1 2 227.304 2.080 20 0 BEADLO COCC1CCN(c2cc(F)cc(C)[nH+]2)CC1 ZINC001337771381 978491409 /nfs/dbraw/zinc/49/14/09/978491409.db2.gz BFPOHEICUUIHGU-UHFFFAOYSA-N 1 2 238.306 2.392 20 0 BEADLO Cc1cc(F)cc(N(C)CC2(O)CCCC2)[nH+]1 ZINC001337810540 978508496 /nfs/dbraw/zinc/50/84/96/978508496.db2.gz YSXOQHUJLBPGSG-UHFFFAOYSA-N 1 2 238.306 2.270 20 0 BEADLO Cc1cnsc1C[N@@H+](C)Cc1ccccn1 ZINC001233318209 978550710 /nfs/dbraw/zinc/55/07/10/978550710.db2.gz VEZBOXMOFGVXMV-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cnsc1C[N@H+](C)Cc1ccccn1 ZINC001233318209 978550727 /nfs/dbraw/zinc/55/07/27/978550727.db2.gz VEZBOXMOFGVXMV-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CC1C[NH+](Cc2c[nH]c(Br)c2)C1 ZINC001233434217 978601970 /nfs/dbraw/zinc/60/19/70/978601970.db2.gz GSRXSYRUBPZDBU-UHFFFAOYSA-N 1 2 229.121 2.229 20 0 BEADLO CC[NH+]1CC(Oc2cnc(C)c(Cl)c2)C1 ZINC001233934367 978735002 /nfs/dbraw/zinc/73/50/02/978735002.db2.gz ICNIMMKVVZBXQK-UHFFFAOYSA-N 1 2 226.707 2.126 20 0 BEADLO CCc1ccc(N(C)[C@H](CO)CC(C)C)[nH+]c1 ZINC001339667864 978891212 /nfs/dbraw/zinc/89/12/12/978891212.db2.gz TZXOIPGDCFBBSU-ZDUSSCGKSA-N 1 2 236.359 2.487 20 0 BEADLO CCC1CC[NH+](Cc2ncc(F)cn2)CC1 ZINC001235002536 978948364 /nfs/dbraw/zinc/94/83/64/978948364.db2.gz BHFCQIIUSPOMER-UHFFFAOYSA-N 1 2 223.295 2.238 20 0 BEADLO CCOc1cc(F)cc(C[N@H+](C)CC(C)=O)c1 ZINC001237913593 1168252783 /nfs/dbraw/zinc/25/27/83/1168252783.db2.gz PBOWCNIDYDOYRK-UHFFFAOYSA-N 1 2 239.290 2.245 20 0 BEADLO CCOc1cc(F)cc(C[N@@H+](C)CC(C)=O)c1 ZINC001237913593 1168252787 /nfs/dbraw/zinc/25/27/87/1168252787.db2.gz PBOWCNIDYDOYRK-UHFFFAOYSA-N 1 2 239.290 2.245 20 0 BEADLO Cc1cnc([C@H](C)C[NH2+]Cc2ccn[nH]2)s1 ZINC000134990078 1168255252 /nfs/dbraw/zinc/25/52/52/1168255252.db2.gz ZKMRDLQNVAVCJO-MRVPVSSYSA-N 1 2 236.344 2.068 20 0 BEADLO CCOc1ncc(C[NH+]2CC(C)(C)C2)cc1F ZINC001236691122 979694517 /nfs/dbraw/zinc/69/45/17/979694517.db2.gz QQMKKHROOKHMLV-UHFFFAOYSA-N 1 2 238.306 2.461 20 0 BEADLO CCn1cncc1C[NH+]1CC2(C1)CC(F)(F)C2 ZINC001237587080 979945784 /nfs/dbraw/zinc/94/57/84/979945784.db2.gz APSPVFMYXZXNNC-UHFFFAOYSA-N 1 2 241.285 2.134 20 0 BEADLO Cc1sccc1C[N@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001237969458 980119517 /nfs/dbraw/zinc/11/95/17/980119517.db2.gz ZGHCNYYVVGVSME-PHIMTYICSA-N 1 2 209.314 2.030 20 0 BEADLO Cc1sccc1C[N@@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001237969458 980119522 /nfs/dbraw/zinc/11/95/22/980119522.db2.gz ZGHCNYYVVGVSME-PHIMTYICSA-N 1 2 209.314 2.030 20 0 BEADLO Cc1sccc1C[N@@H+]1CCC12COC2 ZINC001237969653 980121763 /nfs/dbraw/zinc/12/17/63/980121763.db2.gz BVVKIFLJIUSTCI-UHFFFAOYSA-N 1 2 209.314 2.031 20 0 BEADLO Cc1sccc1C[N@H+]1CCC12COC2 ZINC001237969653 980121776 /nfs/dbraw/zinc/12/17/76/980121776.db2.gz BVVKIFLJIUSTCI-UHFFFAOYSA-N 1 2 209.314 2.031 20 0 BEADLO Cc1ncncc1C[N@@H+]1CCC[C@@](C)(F)C1 ZINC001238163271 980194132 /nfs/dbraw/zinc/19/41/32/980194132.db2.gz FLGVGCWEMQAYMB-GFCCVEGCSA-N 1 2 223.295 2.109 20 0 BEADLO Cc1ncncc1C[N@H+]1CCC[C@@](C)(F)C1 ZINC001238163271 980194136 /nfs/dbraw/zinc/19/41/36/980194136.db2.gz FLGVGCWEMQAYMB-GFCCVEGCSA-N 1 2 223.295 2.109 20 0 BEADLO CN(CC(F)(F)F)c1cc(N)cc(Cl)[nH+]1 ZINC000234262378 1168474222 /nfs/dbraw/zinc/47/42/22/1168474222.db2.gz ABQGARUVDSNGLQ-UHFFFAOYSA-N 1 2 239.628 2.316 20 0 BEADLO Fc1cccc2[nH]cc(C[N@H+]3C[C@H]4C[C@@H](C3)O4)c21 ZINC001136985648 1168637661 /nfs/dbraw/zinc/63/76/61/1168637661.db2.gz OZGZZXQMZDRYSS-PHIMTYICSA-N 1 2 246.285 2.280 20 0 BEADLO Fc1cccc2[nH]cc(C[N@@H+]3C[C@H]4C[C@@H](C3)O4)c21 ZINC001136985648 1168637664 /nfs/dbraw/zinc/63/76/64/1168637664.db2.gz OZGZZXQMZDRYSS-PHIMTYICSA-N 1 2 246.285 2.280 20 0 BEADLO COC(=O)/C(C)=C\Cn1c[nH+]c(C(C)(C)C)c1 ZINC001348537172 981386278 /nfs/dbraw/zinc/38/62/78/981386278.db2.gz IGBFIODYFLCVBU-POHAHGRESA-N 1 2 236.315 2.300 20 0 BEADLO Fc1c[nH+]ccc1N[C@H]1CCC[C@@H](F)C1 ZINC001349775547 981726224 /nfs/dbraw/zinc/72/62/24/981726224.db2.gz HCVUAUCXZUBBOO-BDAKNGLRSA-N 1 2 212.243 2.335 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)Nc1cccc(Cl)c1 ZINC001587135121 982054165 /nfs/dbraw/zinc/05/41/65/982054165.db2.gz UMUNUZYVVRPBBK-UHFFFAOYSA-N 1 2 235.674 2.244 20 0 BEADLO COc1ccc(-c2ccn3cc[nH+]c3c2)nc1 ZINC001240495860 1169013360 /nfs/dbraw/zinc/01/33/60/1169013360.db2.gz AAGXMYOYRSJMRU-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO CCCC[C@H](O)CNc1ccc(N(C)C)[nH+]c1 ZINC001252078809 983328842 /nfs/dbraw/zinc/32/88/42/983328842.db2.gz ZZTCNXMYAKOCJU-LBPRGKRZSA-N 1 2 237.347 2.111 20 0 BEADLO Cc1csc(C[NH+]2CC3(CC(F)C3)C2)n1 ZINC000685978968 1169093133 /nfs/dbraw/zinc/09/31/33/1169093133.db2.gz VLEBLXOLYPVRBE-UHFFFAOYSA-N 1 2 226.320 2.385 20 0 BEADLO O=C1CC[N@@H+](CCCC(F)(F)F)CC[C@H]1F ZINC001202377547 983643020 /nfs/dbraw/zinc/64/30/20/983643020.db2.gz JAEAHAJIKJRPLR-MRVPVSSYSA-N 1 2 241.228 2.332 20 0 BEADLO O=C1CC[N@H+](CCCC(F)(F)F)CC[C@H]1F ZINC001202377547 983643026 /nfs/dbraw/zinc/64/30/26/983643026.db2.gz JAEAHAJIKJRPLR-MRVPVSSYSA-N 1 2 241.228 2.332 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1cc(C)cs1 ZINC001137158428 984002005 /nfs/dbraw/zinc/00/20/05/984002005.db2.gz RYJNKZZWKMJAQI-VIFPVBQESA-N 1 2 227.329 2.050 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1cc(C)cs1 ZINC001137158428 984002014 /nfs/dbraw/zinc/00/20/14/984002014.db2.gz RYJNKZZWKMJAQI-VIFPVBQESA-N 1 2 227.329 2.050 20 0 BEADLO CCc1ccc(C)[nH+]c1Nc1cnc(N)nc1 ZINC001212958442 1169193473 /nfs/dbraw/zinc/19/34/73/1169193473.db2.gz NYHZESLKXARFDY-UHFFFAOYSA-N 1 2 229.287 2.068 20 0 BEADLO C/C=C(\C)c1cc[nH+]c(N2CCOCC2)c1 ZINC001242758750 984101847 /nfs/dbraw/zinc/10/18/47/984101847.db2.gz RZBNJUVQUDOOEP-QDEBKDIKSA-N 1 2 218.300 2.341 20 0 BEADLO CC[NH+]1CC(Oc2ccc(O)c(C)c2C)C1 ZINC001225775796 974679046 /nfs/dbraw/zinc/67/90/46/974679046.db2.gz VFASAGHEYBOJGI-UHFFFAOYSA-N 1 2 221.300 2.092 20 0 BEADLO CCCCCOC(=O)C[NH2+][C@H](C)CCOCC ZINC001172422911 974695980 /nfs/dbraw/zinc/69/59/80/974695980.db2.gz YRVYRDWCDSJBAS-GFCCVEGCSA-N 1 2 245.363 2.125 20 0 BEADLO CC(C)OCC[C@@H](C)[N@@H+]1CCC[C@H](F)C(=O)C1 ZINC001172444682 974806089 /nfs/dbraw/zinc/80/60/89/974806089.db2.gz VFDYNEHAKUWRRS-NEPJUHHUSA-N 1 2 245.338 2.193 20 0 BEADLO CC(C)OCC[C@@H](C)[N@H+]1CCC[C@H](F)C(=O)C1 ZINC001172444682 974806094 /nfs/dbraw/zinc/80/60/94/974806094.db2.gz VFDYNEHAKUWRRS-NEPJUHHUSA-N 1 2 245.338 2.193 20 0 BEADLO CC(C)COCC[C@H](C)[NH2+][C@@H]1CC1(F)F ZINC001172453707 974816311 /nfs/dbraw/zinc/81/63/11/974816311.db2.gz GJEUXTNWAVAKDG-VHSXEESVSA-N 1 2 221.291 2.435 20 0 BEADLO CC(C)[C@H]1CCC[N@H+](Cc2nnc[nH]2)CC1 ZINC001327511615 972604765 /nfs/dbraw/zinc/60/47/65/972604765.db2.gz IPUQHPYGRXEJMB-NSHDSACASA-N 1 2 222.336 2.063 20 0 BEADLO CC(C)[C@H]1CCC[N@@H+](Cc2nnc[nH]2)CC1 ZINC001327511615 972604771 /nfs/dbraw/zinc/60/47/71/972604771.db2.gz IPUQHPYGRXEJMB-NSHDSACASA-N 1 2 222.336 2.063 20 0 BEADLO CC[C@@H](C)[C@H]1CCCC[N@@H+]1Cc1nc[nH]n1 ZINC001327545036 972626256 /nfs/dbraw/zinc/62/62/56/972626256.db2.gz CZBPFXTVRGRJEA-GHMZBOCLSA-N 1 2 222.336 2.205 20 0 BEADLO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cc1nc[nH]n1 ZINC001327545036 972626259 /nfs/dbraw/zinc/62/62/59/972626259.db2.gz CZBPFXTVRGRJEA-GHMZBOCLSA-N 1 2 222.336 2.205 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2ncccc2O)C[C@H]1F ZINC001138390553 1169357230 /nfs/dbraw/zinc/35/72/30/1169357230.db2.gz ANDAWUWBNSOOTO-NEPJUHHUSA-N 1 2 242.269 2.059 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2ncccc2O)C[C@H]1F ZINC001138390553 1169357234 /nfs/dbraw/zinc/35/72/34/1169357234.db2.gz ANDAWUWBNSOOTO-NEPJUHHUSA-N 1 2 242.269 2.059 20 0 BEADLO COC(=O)[C@@H]1C[C@@H](F)C[N@@H+]1[C@@H](C)CCC(C)C ZINC001256363119 970768343 /nfs/dbraw/zinc/76/83/43/970768343.db2.gz GWQPJXMUHQVYQU-TUAOUCFPSA-N 1 2 245.338 2.397 20 0 BEADLO COC(=O)[C@@H]1C[C@@H](F)C[N@H+]1[C@@H](C)CCC(C)C ZINC001256363119 970768353 /nfs/dbraw/zinc/76/83/53/970768353.db2.gz GWQPJXMUHQVYQU-TUAOUCFPSA-N 1 2 245.338 2.397 20 0 BEADLO COc1ccc(-c2ccc[nH+]c2N)c(OC)c1F ZINC001243477367 970768464 /nfs/dbraw/zinc/76/84/64/970768464.db2.gz LQXKKTRQEMFCAL-UHFFFAOYSA-N 1 2 248.257 2.487 20 0 BEADLO CC(C)Cc1nnc([C@@H]2CC3CC[NH+]2CC3)o1 ZINC001256400445 970808553 /nfs/dbraw/zinc/80/85/53/970808553.db2.gz NFULGNCQTOMKKS-NSHDSACASA-N 1 2 235.331 2.425 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2ncccc2F)n(C)n1 ZINC000793551702 970812816 /nfs/dbraw/zinc/81/28/16/970812816.db2.gz VOUWNQGZUODMSE-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO C[C@H]1C[C@@H]1c1nnc(C[NH+]2CCCCC2)o1 ZINC001256610902 970868221 /nfs/dbraw/zinc/86/82/21/970868221.db2.gz SPFUFWMPVRQFPD-UWVGGRQHSA-N 1 2 221.304 2.179 20 0 BEADLO Cc1cc(C)c(CNC(=O)c2ccoc2)c[nH+]1 ZINC001129841669 970884202 /nfs/dbraw/zinc/88/42/02/970884202.db2.gz JTAAYZCXGBUMHJ-UHFFFAOYSA-N 1 2 230.267 2.221 20 0 BEADLO Cc1cn2cc(-c3cccc(=O)[nH]3)ccc2[nH+]1 ZINC001243737540 970897299 /nfs/dbraw/zinc/89/72/99/970897299.db2.gz HMHMJHSPWHFNPC-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO C[C@@H](Cc1ccncc1)[NH2+][C@H]1CC1(F)F ZINC001256715851 970932787 /nfs/dbraw/zinc/93/27/87/970932787.db2.gz IKNJLJPDGWGXIV-WPRPVWTQSA-N 1 2 212.243 2.010 20 0 BEADLO CCCc1ccc(C2=C[NH2+]CCC2)nn1 ZINC001243948592 971031844 /nfs/dbraw/zinc/03/18/44/971031844.db2.gz IZKMHANUTHOWGE-UHFFFAOYSA-N 1 2 203.289 2.153 20 0 BEADLO C[C@H]1CC[N@H+](CCCn2cccn2)CC1(F)F ZINC001208080649 1169502661 /nfs/dbraw/zinc/50/26/61/1169502661.db2.gz FYYDEYYAFWCHGF-NSHDSACASA-N 1 2 243.301 2.250 20 0 BEADLO C[C@H]1CC[N@@H+](CCCn2cccn2)CC1(F)F ZINC001208080649 1169502670 /nfs/dbraw/zinc/50/26/70/1169502670.db2.gz FYYDEYYAFWCHGF-NSHDSACASA-N 1 2 243.301 2.250 20 0 BEADLO c1cc(C2=C[NH2+]CCC2)nc(C2CC2)n1 ZINC001243948717 971035621 /nfs/dbraw/zinc/03/56/21/971035621.db2.gz DUTHVNFRWPAXQZ-UHFFFAOYSA-N 1 2 201.273 2.078 20 0 BEADLO c1cn(Cc2nnc(CC3CCCCC3)o2)c[nH+]1 ZINC001257000664 971060790 /nfs/dbraw/zinc/06/07/90/971060790.db2.gz VGTSAPZASTYWDC-UHFFFAOYSA-N 1 2 246.314 2.437 20 0 BEADLO C[N@@H+]1CCC12CN(CCCCc1ccccc1)C2 ZINC001276746118 971151872 /nfs/dbraw/zinc/15/18/72/971151872.db2.gz KSQBFPIOMIYLIH-UHFFFAOYSA-N 1 2 244.382 2.399 20 0 BEADLO C[N@H+]1CCC12CN(CCCCc1ccccc1)C2 ZINC001276746118 971151879 /nfs/dbraw/zinc/15/18/79/971151879.db2.gz KSQBFPIOMIYLIH-UHFFFAOYSA-N 1 2 244.382 2.399 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2ncccc2N)c1 ZINC000404548090 971169613 /nfs/dbraw/zinc/16/96/13/971169613.db2.gz VBDPVDAROYJSKC-UHFFFAOYSA-N 1 2 214.272 2.419 20 0 BEADLO OCCCCCC[N@@H+]1CCCC(F)(F)C1 ZINC000405052621 971189576 /nfs/dbraw/zinc/18/95/76/971189576.db2.gz DRJFYRODJVOYMH-UHFFFAOYSA-N 1 2 221.291 2.270 20 0 BEADLO OCCCCCC[N@H+]1CCCC(F)(F)C1 ZINC000405052621 971189579 /nfs/dbraw/zinc/18/95/79/971189579.db2.gz DRJFYRODJVOYMH-UHFFFAOYSA-N 1 2 221.291 2.270 20 0 BEADLO c1[nH]cc(CCc2nnc(C3CCCC3)o2)[nH+]1 ZINC001257518144 971441592 /nfs/dbraw/zinc/44/15/92/971441592.db2.gz LIWYLLGKYZBKBA-UHFFFAOYSA-N 1 2 232.287 2.236 20 0 BEADLO Cc1coc(C(=O)OCc2cc[nH+]c(N)c2)c1C ZINC001257546369 971448899 /nfs/dbraw/zinc/44/88/99/971448899.db2.gz RPIJIMJHTOZXOG-UHFFFAOYSA-N 1 2 246.266 2.231 20 0 BEADLO C[NH+](C)Cc1ncccc1O[C@@H]1CCCCC1=O ZINC001225281695 1169584392 /nfs/dbraw/zinc/58/43/92/1169584392.db2.gz ILBYUBJAJORWLQ-CQSZACIVSA-N 1 2 248.326 2.034 20 0 BEADLO c1nc2c(s1)C[N@@H+]([C@H]1CCCSC1)C2 ZINC001257682697 971480345 /nfs/dbraw/zinc/48/03/45/971480345.db2.gz IPDIXJDUUUZBDF-QMMMGPOBSA-N 1 2 226.370 2.354 20 0 BEADLO c1nc2c(s1)C[N@H+]([C@H]1CCCSC1)C2 ZINC001257682697 971480349 /nfs/dbraw/zinc/48/03/49/971480349.db2.gz IPDIXJDUUUZBDF-QMMMGPOBSA-N 1 2 226.370 2.354 20 0 BEADLO Sc1cccc(O[C@@H]2CCCC[NH2+]C2)c1 ZINC001217967784 971551321 /nfs/dbraw/zinc/55/13/21/971551321.db2.gz DKDWHALSXSXSNQ-LLVKDONJSA-N 1 2 223.341 2.496 20 0 BEADLO Sc1cccc(O[C@H]2CCCC[NH2+]C2)c1 ZINC001217967786 971551424 /nfs/dbraw/zinc/55/14/24/971551424.db2.gz DKDWHALSXSXSNQ-NSHDSACASA-N 1 2 223.341 2.496 20 0 BEADLO CCc1ccc(O[C@H]2CC[NH2+]CC2(F)F)nc1 ZINC001218010453 971568524 /nfs/dbraw/zinc/56/85/24/971568524.db2.gz PJBYVSZBKVFYQX-JTQLQIEISA-N 1 2 242.269 2.020 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)Cc1cccs1 ZINC001133682220 971593211 /nfs/dbraw/zinc/59/32/11/971593211.db2.gz PHTBWESQCROSFR-UHFFFAOYSA-N 1 2 246.335 2.363 20 0 BEADLO CCOC(=O)C1([NH2+][C@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170721796 971646973 /nfs/dbraw/zinc/64/69/73/971646973.db2.gz ZEZQIZILCUEQLT-JGPRNRPPSA-N 1 2 237.343 2.106 20 0 BEADLO Cc1cc(S)ccc1O[C@H]1CCC12C[NH2+]C2 ZINC001218242599 971651958 /nfs/dbraw/zinc/65/19/58/971651958.db2.gz SHERNECNDXMGDH-LBPRGKRZSA-N 1 2 235.352 2.415 20 0 BEADLO C[C@@H](Oc1cc[nH+]cc1)C1CCOCC1 ZINC001225289699 974359824 /nfs/dbraw/zinc/35/98/24/974359824.db2.gz NFPMJGDMLWMCND-SNVBAGLBSA-N 1 2 207.273 2.276 20 0 BEADLO CC1(C)CC[C@@H](COc2cc[nH+]cc2)O1 ZINC001225290187 974359162 /nfs/dbraw/zinc/35/91/62/974359162.db2.gz VYMBDPBUEWBDKO-NSHDSACASA-N 1 2 207.273 2.418 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1cnc(N)c(F)c1 ZINC001245520553 971844210 /nfs/dbraw/zinc/84/42/10/971844210.db2.gz YZQBKYZDXSMSGQ-UHFFFAOYSA-N 1 2 242.257 2.426 20 0 BEADLO COCc1ccc(-c2c[nH+]c(N)c(C)c2)nc1 ZINC001245537917 971852430 /nfs/dbraw/zinc/85/24/30/971852430.db2.gz LUEVGIBUJUYFDN-UHFFFAOYSA-N 1 2 229.283 2.181 20 0 BEADLO Cc1cc(-c2ccc(=O)n(C(C)C)c2)c[nH+]c1N ZINC001245538320 971852526 /nfs/dbraw/zinc/85/25/26/971852526.db2.gz BEYCDMSUQIIMLV-UHFFFAOYSA-N 1 2 243.310 2.382 20 0 BEADLO C[C@@H]1COCC[C@@H]1Nc1cc2cc[nH]c2c[nH+]1 ZINC001170814867 971888968 /nfs/dbraw/zinc/88/89/68/971888968.db2.gz WPCZBPHPZRYHSK-KOLCDFICSA-N 1 2 231.299 2.400 20 0 BEADLO Cn1c[nH+]cc1CC(=O)Nc1ccccc1Cl ZINC001135505173 971898991 /nfs/dbraw/zinc/89/89/91/971898991.db2.gz ZIYSKFWGWOACSA-UHFFFAOYSA-N 1 2 249.701 2.255 20 0 BEADLO CC[C@H](C)OCC[C@H](C)[N@@H+]1CCCC(=O)C1 ZINC001172343913 974611210 /nfs/dbraw/zinc/61/12/10/974611210.db2.gz WOUBMWCXJQNXLF-RYUDHWBXSA-N 1 2 227.348 2.245 20 0 BEADLO CC[C@H](C)OCC[C@H](C)[N@H+]1CCCC(=O)C1 ZINC001172343913 974611215 /nfs/dbraw/zinc/61/12/15/974611215.db2.gz WOUBMWCXJQNXLF-RYUDHWBXSA-N 1 2 227.348 2.245 20 0 BEADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccc[nH]1 ZINC000190581008 972037195 /nfs/dbraw/zinc/03/71/95/972037195.db2.gz BIUZGUCFWUHIPK-LLVKDONJSA-N 1 2 215.300 2.393 20 0 BEADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1ccc[nH]1 ZINC000190581008 972037208 /nfs/dbraw/zinc/03/72/08/972037208.db2.gz BIUZGUCFWUHIPK-LLVKDONJSA-N 1 2 215.300 2.393 20 0 BEADLO C[C@@H]1C[C@@H](c2ccccc2)[N@H+](Cc2nnc[nH]2)C1 ZINC001329895290 972090730 /nfs/dbraw/zinc/09/07/30/972090730.db2.gz ORFNCQZWFDFLSI-YPMHNXCESA-N 1 2 242.326 2.388 20 0 BEADLO C[C@@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2nnc[nH]2)C1 ZINC001329895290 972090738 /nfs/dbraw/zinc/09/07/38/972090738.db2.gz ORFNCQZWFDFLSI-YPMHNXCESA-N 1 2 242.326 2.388 20 0 BEADLO CC[NH+]1CC(Oc2c(C)cccc2C)C1 ZINC000000005492 956868361 /nfs/dbraw/zinc/86/83/61/956868361.db2.gz JCAVZPSIYJIOPO-UHFFFAOYSA-N 1 2 205.301 2.386 20 0 BEADLO F[C@@H]1C[N@H+](C[C@H]2CCCCO2)CCC1(F)F ZINC001207954759 956891230 /nfs/dbraw/zinc/89/12/30/956891230.db2.gz UEQYRCJFLSKAMG-NXEZZACHSA-N 1 2 237.265 2.235 20 0 BEADLO F[C@@H]1C[N@@H+](C[C@H]2CCCCO2)CCC1(F)F ZINC001207954759 956891232 /nfs/dbraw/zinc/89/12/32/956891232.db2.gz UEQYRCJFLSKAMG-NXEZZACHSA-N 1 2 237.265 2.235 20 0 BEADLO Fc1cccc2c1C[C@H]([N@@H+]1CCO[C@H]3C[C@H]31)CC2 ZINC001171006032 972234322 /nfs/dbraw/zinc/23/43/22/972234322.db2.gz VTEFSIPBOIZLGD-DFBGVHRSSA-N 1 2 247.313 2.156 20 0 BEADLO Fc1cccc2c1C[C@H]([N@H+]1CCO[C@H]3C[C@H]31)CC2 ZINC001171006032 972234325 /nfs/dbraw/zinc/23/43/25/972234325.db2.gz VTEFSIPBOIZLGD-DFBGVHRSSA-N 1 2 247.313 2.156 20 0 BEADLO Cc1cccc(C[N@@H+](C)C2(C)COC2)c1F ZINC001137677494 957171293 /nfs/dbraw/zinc/17/12/93/957171293.db2.gz VCSCQDCVYHBJRH-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cccc(C[N@H+](C)C2(C)COC2)c1F ZINC001137677494 957171302 /nfs/dbraw/zinc/17/13/02/957171302.db2.gz VCSCQDCVYHBJRH-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO CCN1CC[N@H+](C[C@@H](C)C(F)(F)F)C[C@H]1C ZINC001208897792 957224436 /nfs/dbraw/zinc/22/44/36/957224436.db2.gz JDEPBZPARQKLGX-NXEZZACHSA-N 1 2 238.297 2.211 20 0 BEADLO CCN1CC[N@@H+](C[C@@H](C)C(F)(F)F)C[C@H]1C ZINC001208897792 957224461 /nfs/dbraw/zinc/22/44/61/957224461.db2.gz JDEPBZPARQKLGX-NXEZZACHSA-N 1 2 238.297 2.211 20 0 BEADLO CC[N@H+](Cc1cc2ccccc2cn1)C1COC1 ZINC001139999679 957334676 /nfs/dbraw/zinc/33/46/76/957334676.db2.gz YXZWPTWCWZNFOH-UHFFFAOYSA-N 1 2 242.322 2.456 20 0 BEADLO CC[N@@H+](Cc1cc2ccccc2cn1)C1COC1 ZINC001139999679 957334687 /nfs/dbraw/zinc/33/46/87/957334687.db2.gz YXZWPTWCWZNFOH-UHFFFAOYSA-N 1 2 242.322 2.456 20 0 BEADLO c1cn(-c2cccc(NC3=CCOC3)c2)c[nH+]1 ZINC001203389045 957516971 /nfs/dbraw/zinc/51/69/71/957516971.db2.gz LQMUKFAKHTVFRT-UHFFFAOYSA-N 1 2 227.267 2.198 20 0 BEADLO CC(=O)Nc1cc(Nc2ncccc2F)cc[nH+]1 ZINC001209805722 957533751 /nfs/dbraw/zinc/53/37/51/957533751.db2.gz JMGDVWGNEZORQM-UHFFFAOYSA-N 1 2 246.245 2.318 20 0 BEADLO C1=CCC[C@H](OCC[NH+]2CCOCC2)CCC1 ZINC001210206828 957672325 /nfs/dbraw/zinc/67/23/25/957672325.db2.gz JRHVTCLTMQOHFJ-AWEZNQCLSA-N 1 2 239.359 2.224 20 0 BEADLO COC(=O)c1ccc(Nc2c[nH+]c(C)c(N)c2)o1 ZINC001210286936 957715180 /nfs/dbraw/zinc/71/51/80/957715180.db2.gz GMYDEAPCYTVRQK-UHFFFAOYSA-N 1 2 247.254 2.095 20 0 BEADLO CC1(C)C[NH+](Cc2cn3ccccc3n2)C1 ZINC001136876268 972288796 /nfs/dbraw/zinc/28/87/96/972288796.db2.gz WNGPENBTRJKOBI-UHFFFAOYSA-N 1 2 215.300 2.176 20 0 BEADLO COc1cc[nH+]c(Nc2cncc(N(C)C)c2)c1 ZINC001210471250 957759421 /nfs/dbraw/zinc/75/94/21/957759421.db2.gz NCODPVZBJZAVEV-UHFFFAOYSA-N 1 2 244.298 2.295 20 0 BEADLO Cc1c(F)cccc1C[N@@H+]1C[C@@H]2C[C@H]1CO2 ZINC001204513301 957800587 /nfs/dbraw/zinc/80/05/87/957800587.db2.gz XFXILAOKBNJOFN-RYUDHWBXSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1c(F)cccc1C[N@H+]1C[C@@H]2C[C@H]1CO2 ZINC001204513301 957800596 /nfs/dbraw/zinc/80/05/96/957800596.db2.gz XFXILAOKBNJOFN-RYUDHWBXSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1cc(NC2CC(=O)C2)ccc1[NH+](C)C ZINC001167344825 957823035 /nfs/dbraw/zinc/82/30/35/957823035.db2.gz WKEHKQMUQDMQQW-UHFFFAOYSA-N 1 2 218.300 2.204 20 0 BEADLO Cc1ccc2c(C[NH+]3CC4(CCO4)C3)c[nH]c2c1 ZINC001136974927 972306790 /nfs/dbraw/zinc/30/67/90/972306790.db2.gz RYXTYYQFAOMVEW-UHFFFAOYSA-N 1 2 242.322 2.451 20 0 BEADLO Fc1cnc(C[NH+]2CC3CC(C3)C2)c(F)c1 ZINC001207102885 958016538 /nfs/dbraw/zinc/01/65/38/958016538.db2.gz NSKPCRXNXUOUSL-UHFFFAOYSA-N 1 2 224.254 2.202 20 0 BEADLO Cc1c[nH+]c(Nc2cncc(CO)c2)c(C)c1 ZINC001211103451 958030173 /nfs/dbraw/zinc/03/01/73/958030173.db2.gz UNPQARGJGFNUJH-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO C[N@H+](CCF)Cc1cncc(Cl)c1 ZINC001136999074 972313932 /nfs/dbraw/zinc/31/39/32/972313932.db2.gz LUIBTKXFENNXJQ-UHFFFAOYSA-N 1 2 202.660 2.136 20 0 BEADLO C[N@@H+](CCF)Cc1cncc(Cl)c1 ZINC001136999074 972313939 /nfs/dbraw/zinc/31/39/39/972313939.db2.gz LUIBTKXFENNXJQ-UHFFFAOYSA-N 1 2 202.660 2.136 20 0 BEADLO CC(C)[C@](C)(Nc1ccc(C2CC2)c[nH+]1)C(N)=O ZINC001167415040 958041510 /nfs/dbraw/zinc/04/15/10/958041510.db2.gz GZQVBBZHMKXMJS-AWEZNQCLSA-N 1 2 247.342 2.271 20 0 BEADLO CCN1CC[N@H+](Cc2cc(C)c(C)o2)C[C@H]1C ZINC001204542038 958049227 /nfs/dbraw/zinc/04/92/27/958049227.db2.gz RFCVRJQEIDHOBM-GFCCVEGCSA-N 1 2 236.359 2.422 20 0 BEADLO CCN1CC[N@@H+](Cc2cc(C)c(C)o2)C[C@H]1C ZINC001204542038 958049247 /nfs/dbraw/zinc/04/92/47/958049247.db2.gz RFCVRJQEIDHOBM-GFCCVEGCSA-N 1 2 236.359 2.422 20 0 BEADLO FC(F)(F)c1cnc(C[NH+]2CC3CC(C3)C2)[nH]1 ZINC001137018701 972326889 /nfs/dbraw/zinc/32/68/89/972326889.db2.gz BCGNKGHVKPLTAE-UHFFFAOYSA-N 1 2 245.248 2.270 20 0 BEADLO Cc1c[nH+]cc(Nc2cncc(N)c2)c1C ZINC001213525380 958204109 /nfs/dbraw/zinc/20/41/09/958204109.db2.gz TUBIWJWMONXFOV-UHFFFAOYSA-N 1 2 214.272 2.419 20 0 BEADLO CC[C@@H](CC(C)C)N[C@@H]1C[NH2+]CC1(F)F ZINC001246461280 972336079 /nfs/dbraw/zinc/33/60/79/972336079.db2.gz OMBFGBZIYFMXJN-VHSXEESVSA-N 1 2 220.307 2.008 20 0 BEADLO C/C=C\COC(=O)[C@H](c1ccccc1)[NH+](C)C ZINC000588410981 958308895 /nfs/dbraw/zinc/30/88/95/958308895.db2.gz KDYNSSDEISLNCO-ZFDPJTLLSA-N 1 2 233.311 2.409 20 0 BEADLO CC[C@H](CC(C)C)N[C@H]1C[NH2+]CC1(F)F ZINC001246461281 972337840 /nfs/dbraw/zinc/33/78/40/972337840.db2.gz OMBFGBZIYFMXJN-ZJUUUORDSA-N 1 2 220.307 2.008 20 0 BEADLO C[C@@H]1CC[C@H](N[C@H]2C[NH2+]CC2(F)F)C[C@H]1C ZINC001246464580 972338791 /nfs/dbraw/zinc/33/87/91/972338791.db2.gz RXBYGJUWDLVYRA-ZNSHCXBVSA-N 1 2 232.318 2.008 20 0 BEADLO C[C@@H]1CC[C@H]([NH2+][C@H]2CNCC2(F)F)C[C@H]1C ZINC001246464580 972338795 /nfs/dbraw/zinc/33/87/95/972338795.db2.gz RXBYGJUWDLVYRA-ZNSHCXBVSA-N 1 2 232.318 2.008 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]C/C=C/Cl)no1 ZINC000308328056 958385548 /nfs/dbraw/zinc/38/55/48/958385548.db2.gz IDQLBJGLDCUQCF-MPJRPATESA-N 1 2 200.669 2.386 20 0 BEADLO CO[C@H]1CCC[N@H+](C/C(Cl)=C\Cl)C1 ZINC000308457962 958389730 /nfs/dbraw/zinc/38/97/30/958389730.db2.gz GQGLYDLGZWWYNH-QRJSTWQJSA-N 1 2 224.131 2.416 20 0 BEADLO CO[C@H]1CCC[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000308457962 958389747 /nfs/dbraw/zinc/38/97/47/958389747.db2.gz GQGLYDLGZWWYNH-QRJSTWQJSA-N 1 2 224.131 2.416 20 0 BEADLO C[C@H]([NH2+]c1cccc(=O)n1C)c1ccc(F)cn1 ZINC001167486044 958457394 /nfs/dbraw/zinc/45/73/94/958457394.db2.gz LCMXCQNXJWGUSL-VIFPVBQESA-N 1 2 247.273 2.093 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1cc(F)cc(F)c1C ZINC001143758173 972360536 /nfs/dbraw/zinc/36/05/36/972360536.db2.gz YYDZDVQPMPTRCO-UHFFFAOYSA-N 1 2 227.254 2.294 20 0 BEADLO CC(=O)C[N@H+](C)Cc1cc(F)cc(F)c1C ZINC001143758173 972360543 /nfs/dbraw/zinc/36/05/43/972360543.db2.gz YYDZDVQPMPTRCO-UHFFFAOYSA-N 1 2 227.254 2.294 20 0 BEADLO Cc1nc(N[C@H]2C[C@@H](CO)C2)cc(C(C)C)[nH+]1 ZINC000707604516 958625278 /nfs/dbraw/zinc/62/52/78/958625278.db2.gz NFTGWZTXTIAMSM-PHIMTYICSA-N 1 2 235.331 2.091 20 0 BEADLO Cc1ccc([C@H](C)OCCn2cc[nH+]c2)cn1 ZINC001222134869 972380947 /nfs/dbraw/zinc/38/09/47/972380947.db2.gz QVYKJRMXEGHMEO-LBPRGKRZSA-N 1 2 231.299 2.364 20 0 BEADLO C[C@@H](COc1ccccc1)OCCn1cc[nH+]c1 ZINC001222135574 972384461 /nfs/dbraw/zinc/38/44/61/972384461.db2.gz ZXOSKGJXKJEKJO-ZDUSSCGKSA-N 1 2 246.310 2.367 20 0 BEADLO FC1(F)CCC(OCCn2cc[nH+]c2)CC1 ZINC001222134823 972385114 /nfs/dbraw/zinc/38/51/14/972385114.db2.gz PFVYLLQVWUODPV-UHFFFAOYSA-N 1 2 230.258 2.478 20 0 BEADLO Cc1nc[nH]c1C[NH+]1Cc2ccccc2C1 ZINC001204588467 958900113 /nfs/dbraw/zinc/90/01/13/958900113.db2.gz DRGDRJWWZMUSIV-UHFFFAOYSA-N 1 2 213.284 2.234 20 0 BEADLO F[C@@H]1CCCC[C@H]1OCCn1cc[nH+]c1 ZINC001222138515 972385824 /nfs/dbraw/zinc/38/58/24/972385824.db2.gz GCAIQIGLQMMTAD-GHMZBOCLSA-N 1 2 212.268 2.180 20 0 BEADLO CCc1ccncc1NCc1cc[nH+]c(N)c1 ZINC001167616878 959084922 /nfs/dbraw/zinc/08/49/22/959084922.db2.gz RTMCSLWBVZUXPK-UHFFFAOYSA-N 1 2 228.299 2.233 20 0 BEADLO Fc1c[nH+]ccc1NCCC1SCCS1 ZINC000693845576 959428123 /nfs/dbraw/zinc/42/81/23/959428123.db2.gz CFZKLCBYYLROJV-UHFFFAOYSA-N 1 2 244.360 2.251 20 0 BEADLO Cc1ncc(C[N@@H+]2CCCC(F)(F)CC2)[nH]1 ZINC000724787249 959521961 /nfs/dbraw/zinc/52/19/61/959521961.db2.gz NFQRTILGOVAGMA-UHFFFAOYSA-N 1 2 229.274 2.339 20 0 BEADLO Cc1ncc(C[N@H+]2CCCC(F)(F)CC2)[nH]1 ZINC000724787249 959521973 /nfs/dbraw/zinc/52/19/73/959521973.db2.gz NFQRTILGOVAGMA-UHFFFAOYSA-N 1 2 229.274 2.339 20 0 BEADLO CC[C@](C)([NH2+]CC1=NOCC1)c1nccs1 ZINC001167681397 959703460 /nfs/dbraw/zinc/70/34/60/959703460.db2.gz ZEUNBDLEHLTWFY-NSHDSACASA-N 1 2 239.344 2.134 20 0 BEADLO Cc1cc(C[NH2+][C@H]2CCc3ccc(O)cc32)no1 ZINC000690792845 959839472 /nfs/dbraw/zinc/83/94/72/959839472.db2.gz UAWFWCRSFJSYQP-AWEZNQCLSA-N 1 2 244.294 2.466 20 0 BEADLO Oc1ccc(Cl)c(O[C@H]2C[NH2+]CC2(F)F)c1 ZINC001218232847 959907519 /nfs/dbraw/zinc/90/75/19/959907519.db2.gz HCNDNNCQITULSO-VIFPVBQESA-N 1 2 249.644 2.032 20 0 BEADLO CCn1c(C)nn(C[N@@H+]2CCC[C@H]2C)c1=S ZINC000173521238 960355606 /nfs/dbraw/zinc/35/56/06/960355606.db2.gz VBKKNBCNCAAXLJ-SECBINFHSA-N 1 2 240.376 2.184 20 0 BEADLO CCn1c(C)nn(C[N@H+]2CCC[C@H]2C)c1=S ZINC000173521238 960355618 /nfs/dbraw/zinc/35/56/18/960355618.db2.gz VBKKNBCNCAAXLJ-SECBINFHSA-N 1 2 240.376 2.184 20 0 BEADLO CCN(Cc1cc(F)ccc1C)C1C[NH+](C)C1 ZINC001140592612 960450767 /nfs/dbraw/zinc/45/07/67/960450767.db2.gz TXFUPHVJMZAPMQ-UHFFFAOYSA-N 1 2 236.334 2.270 20 0 BEADLO CO[C@H]1C[N@H+](Cc2ccc(F)cc2C)C[C@@H]1F ZINC001140777302 960562972 /nfs/dbraw/zinc/56/29/72/960562972.db2.gz LKWODOBDMYWRKC-STQMWFEESA-N 1 2 241.281 2.303 20 0 BEADLO CO[C@H]1C[N@@H+](Cc2ccc(F)cc2C)C[C@@H]1F ZINC001140777302 960562975 /nfs/dbraw/zinc/56/29/75/960562975.db2.gz LKWODOBDMYWRKC-STQMWFEESA-N 1 2 241.281 2.303 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+]1C[C@@H]2C[C@H]1CO2 ZINC001140782218 960569560 /nfs/dbraw/zinc/56/95/60/960569560.db2.gz NKZDMHWQTWIAOT-STQMWFEESA-N 1 2 221.275 2.107 20 0 BEADLO Cc1cc(F)ccc1C[N@H+]1C[C@@H]2C[C@H]1CO2 ZINC001140782218 960569575 /nfs/dbraw/zinc/56/95/75/960569575.db2.gz NKZDMHWQTWIAOT-STQMWFEESA-N 1 2 221.275 2.107 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1cc(O)cc(Cl)c1 ZINC001140787213 960571937 /nfs/dbraw/zinc/57/19/37/960571937.db2.gz AUBJHRZDWOGESK-UHFFFAOYSA-N 1 2 227.691 2.066 20 0 BEADLO CC(=O)C[N@H+](C)Cc1cc(O)cc(Cl)c1 ZINC001140787213 960571943 /nfs/dbraw/zinc/57/19/43/960571943.db2.gz AUBJHRZDWOGESK-UHFFFAOYSA-N 1 2 227.691 2.066 20 0 BEADLO Cc1cc(CNc2cc3cc[nH]c3c[nH+]2)nn1C ZINC001167766955 960704924 /nfs/dbraw/zinc/70/49/24/960704924.db2.gz XQMADXLAEMKYIK-UHFFFAOYSA-N 1 2 241.298 2.217 20 0 BEADLO C[N@H+](Cc1cnco1)Cc1ccc(Cl)nc1 ZINC001140932337 960712335 /nfs/dbraw/zinc/71/23/35/960712335.db2.gz KGAMNBQZMSXDPO-UHFFFAOYSA-N 1 2 237.690 2.355 20 0 BEADLO C[N@@H+](Cc1cnco1)Cc1ccc(Cl)nc1 ZINC001140932337 960712351 /nfs/dbraw/zinc/71/23/51/960712351.db2.gz KGAMNBQZMSXDPO-UHFFFAOYSA-N 1 2 237.690 2.355 20 0 BEADLO Fc1ccc2c(c1)C[N@@H+](Cc1cnco1)CC2 ZINC001140932244 960714198 /nfs/dbraw/zinc/71/41/98/960714198.db2.gz GJLWVKYSLBAMIU-UHFFFAOYSA-N 1 2 232.258 2.372 20 0 BEADLO Fc1ccc2c(c1)C[N@H+](Cc1cnco1)CC2 ZINC001140932244 960714213 /nfs/dbraw/zinc/71/42/13/960714213.db2.gz GJLWVKYSLBAMIU-UHFFFAOYSA-N 1 2 232.258 2.372 20 0 BEADLO C[N@@H+](Cc1csnn1)CC1CC(F)(F)C1 ZINC001140997066 960780923 /nfs/dbraw/zinc/78/09/23/960780923.db2.gz VFVJNHCVUJFVIE-UHFFFAOYSA-N 1 2 233.287 2.015 20 0 BEADLO C[N@H+](Cc1csnn1)CC1CC(F)(F)C1 ZINC001140997066 960780932 /nfs/dbraw/zinc/78/09/32/960780932.db2.gz VFVJNHCVUJFVIE-UHFFFAOYSA-N 1 2 233.287 2.015 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2csnn2)[C@@H](C)C1 ZINC001140997038 960790472 /nfs/dbraw/zinc/79/04/72/960790472.db2.gz SQDHKMSQHVPNCK-BDAKNGLRSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2csnn2)[C@@H](C)C1 ZINC001140997038 960790484 /nfs/dbraw/zinc/79/04/84/960790484.db2.gz SQDHKMSQHVPNCK-BDAKNGLRSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@H]1C[N@H+](Cc2ncco2)CCC1(F)F ZINC001141004339 960797204 /nfs/dbraw/zinc/79/72/04/960797204.db2.gz CCMAVFKUTDBSRH-QMMMGPOBSA-N 1 2 216.231 2.152 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ncco2)CCC1(F)F ZINC001141004339 960797205 /nfs/dbraw/zinc/79/72/05/960797205.db2.gz CCMAVFKUTDBSRH-QMMMGPOBSA-N 1 2 216.231 2.152 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2ncco2)CCC1(F)F ZINC001141005577 960803209 /nfs/dbraw/zinc/80/32/09/960803209.db2.gz MNZKHJYBWSIQNB-MRVPVSSYSA-N 1 2 234.221 2.244 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2ncco2)CCC1(F)F ZINC001141005577 960803215 /nfs/dbraw/zinc/80/32/15/960803215.db2.gz MNZKHJYBWSIQNB-MRVPVSSYSA-N 1 2 234.221 2.244 20 0 BEADLO Cc1ccncc1C[N@@H+]1CCC(=O)C(C)(C)C1 ZINC001141036352 960826262 /nfs/dbraw/zinc/82/62/62/960826262.db2.gz WLHUIGZAPOMMFX-UHFFFAOYSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1ccncc1C[N@H+]1CCC(=O)C(C)(C)C1 ZINC001141036352 960826264 /nfs/dbraw/zinc/82/62/64/960826264.db2.gz WLHUIGZAPOMMFX-UHFFFAOYSA-N 1 2 232.327 2.191 20 0 BEADLO FC1(F)CCN(Cc2ccn3cc[nH+]c3c2)C1 ZINC001141042538 960829654 /nfs/dbraw/zinc/82/96/54/960829654.db2.gz VIZXBJVXZJRLJI-UHFFFAOYSA-N 1 2 237.253 2.175 20 0 BEADLO Cc1nc2c(s1)C[N@H+](Cc1ocnc1C)CC2 ZINC001141053018 960844574 /nfs/dbraw/zinc/84/45/74/960844574.db2.gz YHTXQXWTXRGFBS-UHFFFAOYSA-N 1 2 249.339 2.306 20 0 BEADLO Cc1nc2c(s1)C[N@@H+](Cc1ocnc1C)CC2 ZINC001141053018 960844578 /nfs/dbraw/zinc/84/45/78/960844578.db2.gz YHTXQXWTXRGFBS-UHFFFAOYSA-N 1 2 249.339 2.306 20 0 BEADLO c1cn(-c2cccc(CN3CCCO3)c2)c[nH+]1 ZINC001141237998 961008353 /nfs/dbraw/zinc/00/83/53/961008353.db2.gz DTIVYCAUQMEJJV-UHFFFAOYSA-N 1 2 229.283 2.010 20 0 BEADLO Fc1c[nH+]ccc1NC[C@H]1CC[C@H](C2CC2)O1 ZINC000722321316 961013745 /nfs/dbraw/zinc/01/37/45/961013745.db2.gz MCOMLNLUJDUDOS-ZWNOBZJWSA-N 1 2 236.290 2.012 20 0 BEADLO CCCOC1C[NH+](Cc2cccc(N(C)C)c2)C1 ZINC001141266343 961031803 /nfs/dbraw/zinc/03/18/03/961031803.db2.gz MEQYGYRVMLHXQX-UHFFFAOYSA-N 1 2 248.370 2.363 20 0 BEADLO Nc1[nH+]cccc1CCOC(=O)c1ccccc1 ZINC001250213542 1169785659 /nfs/dbraw/zinc/78/56/59/1169785659.db2.gz JJTMGDBNWVLRTB-UHFFFAOYSA-N 1 2 242.278 2.063 20 0 BEADLO CCOC(=O)C(F)(F)CNc1ccc(C)c[nH+]1 ZINC001167848112 961268409 /nfs/dbraw/zinc/26/84/09/961268409.db2.gz ULNKNLYPMSJSEX-UHFFFAOYSA-N 1 2 244.241 2.000 20 0 BEADLO Cc1nc2ccc(NC=[NH2+])nc2n1C(C)C ZINC001167864532 961340571 /nfs/dbraw/zinc/34/05/71/961340571.db2.gz OEPGKMFRXNSCJR-UHFFFAOYSA-N 1 2 217.276 2.340 20 0 BEADLO CC(C)(C)OC(=O)Nc1cccc(NC=[NH2+])n1 ZINC001167869607 961373461 /nfs/dbraw/zinc/37/34/61/961373461.db2.gz YFKXIOVEUQCDKE-UHFFFAOYSA-N 1 2 236.275 2.448 20 0 BEADLO COCOCCc1[nH]c2ccc(F)c(C)c2[nH+]1 ZINC001250591569 1169788353 /nfs/dbraw/zinc/78/83/53/1169788353.db2.gz RLWIALOKCYNDFX-UHFFFAOYSA-N 1 2 238.262 2.173 20 0 BEADLO CCC(=O)N(C)Cc1ccc(-n2cc[nH+]c2)cc1 ZINC001142718808 961679221 /nfs/dbraw/zinc/67/92/21/961679221.db2.gz QVHQCUFCPVEJNY-UHFFFAOYSA-N 1 2 243.310 2.241 20 0 BEADLO Cc1nc(N2CC[C@@](C)(CO)C2)cc(C(C)C)[nH+]1 ZINC000709844353 961710161 /nfs/dbraw/zinc/71/01/61/961710161.db2.gz IHMLKYUDXHEBAB-CQSZACIVSA-N 1 2 249.358 2.117 20 0 BEADLO Cc1ccc(C[N@@H+]2CCc3cnccc3C2)nc1 ZINC001139837684 961740018 /nfs/dbraw/zinc/74/00/18/961740018.db2.gz NULAYUHKOYTHBP-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1ccc(C[N@H+]2CCc3cnccc3C2)nc1 ZINC001139837684 961740033 /nfs/dbraw/zinc/74/00/33/961740033.db2.gz NULAYUHKOYTHBP-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO CC1(C[N@@H+]2CCC[C@@H](F)C(F)(F)C2)COC1 ZINC001207790466 961810238 /nfs/dbraw/zinc/81/02/38/961810238.db2.gz BHWWGRMPPZSXKG-SECBINFHSA-N 1 2 237.265 2.092 20 0 BEADLO CC1(C[N@H+]2CCC[C@@H](F)C(F)(F)C2)COC1 ZINC001207790466 961810243 /nfs/dbraw/zinc/81/02/43/961810243.db2.gz BHWWGRMPPZSXKG-SECBINFHSA-N 1 2 237.265 2.092 20 0 BEADLO CC[NH2+]Cc1noc([C@@H](C)c2ccsc2)n1 ZINC000843144350 961876460 /nfs/dbraw/zinc/87/64/60/961876460.db2.gz AWOYZSGLKMBGTD-QMMMGPOBSA-N 1 2 237.328 2.392 20 0 BEADLO C[C@H]1C[NH+](Cc2cc3cccnc3[nH]2)C[C@H](C)O1 ZINC001143212455 961951557 /nfs/dbraw/zinc/95/15/57/961951557.db2.gz QSFWVZAFYMSADE-QWRGUYRKSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc3cccnc3[nH]2)[C@H](C)CO1 ZINC001143221754 961963284 /nfs/dbraw/zinc/96/32/84/961963284.db2.gz KFUVMOREGQUGMB-GHMZBOCLSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc3cccnc3[nH]2)[C@H](C)CO1 ZINC001143221754 961963316 /nfs/dbraw/zinc/96/33/16/961963316.db2.gz KFUVMOREGQUGMB-GHMZBOCLSA-N 1 2 245.326 2.172 20 0 BEADLO COc1c(F)ccc(C[NH+]2CCC2)c1F ZINC001143304866 962013566 /nfs/dbraw/zinc/01/35/66/962013566.db2.gz XCJWGXIINOSAQU-UHFFFAOYSA-N 1 2 213.227 2.179 20 0 BEADLO CCOC(=O)[C@@H]1CC[C@H](Oc2cc[nH+]cc2)C1 ZINC001225295670 962062567 /nfs/dbraw/zinc/06/25/67/962062567.db2.gz NHRCEHWYGRHQAX-PWSUYJOCSA-N 1 2 235.283 2.192 20 0 BEADLO CCC/C=C\C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000729371892 962186112 /nfs/dbraw/zinc/18/61/12/962186112.db2.gz NODOZTQVKLRJBR-LLPBQKLSSA-N 1 2 247.342 2.403 20 0 BEADLO CC1CC(N(C)C(=O)c2c[nH]c3cc[nH+]cc32)C1 ZINC001152971546 962511735 /nfs/dbraw/zinc/51/17/35/962511735.db2.gz MKUPWEXPDCHKFS-UHFFFAOYSA-N 1 2 243.310 2.433 20 0 BEADLO C[C@H](C(=O)Nc1ccc(F)cc1)n1cc[nH+]c1 ZINC000049247802 962580024 /nfs/dbraw/zinc/58/00/24/962580024.db2.gz IKJRNKRHAAKQRI-SECBINFHSA-N 1 2 233.246 2.222 20 0 BEADLO CN(c1ccc2c(c1)OCC2)c1[nH+]cccc1N ZINC001206648923 962620114 /nfs/dbraw/zinc/62/01/14/962620114.db2.gz NTZWIFIEARUBLM-UHFFFAOYSA-N 1 2 241.294 2.367 20 0 BEADLO COc1c[nH+]c(NC[C@@H](O)c2ccco2)c(C)c1 ZINC001154875185 962881715 /nfs/dbraw/zinc/88/17/15/962881715.db2.gz JYXUIDUHATVGMN-LLVKDONJSA-N 1 2 248.282 2.137 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](CO)CC(C)C)c1 ZINC001154957861 962922181 /nfs/dbraw/zinc/92/21/81/962922181.db2.gz XRUBYAOEZOYTEI-GFCCVEGCSA-N 1 2 238.331 2.047 20 0 BEADLO CC[C@H](C)Nc1ccn2cc(N)[nH+]c2c1 ZINC001167997984 963201832 /nfs/dbraw/zinc/20/18/32/963201832.db2.gz CPSXAGCRKKNFKT-QMMMGPOBSA-N 1 2 204.277 2.127 20 0 BEADLO CC[C@H](C)Nc1[nH+]cnc2[nH]cc(F)c21 ZINC001168000435 963219070 /nfs/dbraw/zinc/21/90/70/963219070.db2.gz QAIQJZDNEVYDEU-LURJTMIESA-N 1 2 208.240 2.307 20 0 BEADLO CC(F)(F)C(C)(C)C[NH2+]Cc1ccn[nH]1 ZINC000696614873 963288065 /nfs/dbraw/zinc/28/80/65/963288065.db2.gz KKVIEKVWMIPFME-UHFFFAOYSA-N 1 2 217.263 2.181 20 0 BEADLO Cc1cnc(NCc2cc[nH+]c(N)c2)c(F)c1 ZINC001156756212 963453800 /nfs/dbraw/zinc/45/38/00/963453800.db2.gz SKECXEOXNLKBAX-UHFFFAOYSA-N 1 2 232.262 2.118 20 0 BEADLO CCCCN(C(=O)[C@@H](C)n1cc[nH+]c1)C1CC1 ZINC000052513214 963473347 /nfs/dbraw/zinc/47/33/47/963473347.db2.gz MDUAZFOTHQBJHS-LLVKDONJSA-N 1 2 235.331 2.235 20 0 BEADLO Nc1[nH+]c(N2CC3CC(C3)C2)ccc1Cl ZINC001156910823 963492807 /nfs/dbraw/zinc/49/28/07/963492807.db2.gz VAQVBZAMCWYILY-UHFFFAOYSA-N 1 2 223.707 2.163 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H](C)C2CCC2)[nH+]c1C ZINC000896910031 963520799 /nfs/dbraw/zinc/52/07/99/963520799.db2.gz KONILMSEYGKMLH-QMMMGPOBSA-N 1 2 235.331 2.079 20 0 BEADLO COc1ccc2ccnc(NC=[NH2+])c2c1 ZINC001157078278 963524464 /nfs/dbraw/zinc/52/44/64/963524464.db2.gz KCNPGLRORCOUCQ-UHFFFAOYSA-N 1 2 201.229 2.262 20 0 BEADLO COC(=O)C[C@H](c1ccnc(NC=[NH2+])c1)C1CC1 ZINC001157079352 963525595 /nfs/dbraw/zinc/52/55/95/963525595.db2.gz YRYLDFNITJKYPU-NSHDSACASA-N 1 2 247.298 2.157 20 0 BEADLO CCN(c1ncc(Cl)cc1F)C1C[NH+](C)C1 ZINC001157455906 963615127 /nfs/dbraw/zinc/61/51/27/963615127.db2.gz XCLPYPMVDIRRLS-UHFFFAOYSA-N 1 2 243.713 2.014 20 0 BEADLO CCN(CCn1cc[nH+]c1)c1ccc(F)c(C)n1 ZINC001157461117 963619743 /nfs/dbraw/zinc/61/97/43/963619743.db2.gz ATFCGQKKFCZFMZ-UHFFFAOYSA-N 1 2 248.305 2.252 20 0 BEADLO Cc1cc(N[C@H]2C[C@@H](CO)C2)nc(C(C)(C)C)[nH+]1 ZINC001157463946 963620735 /nfs/dbraw/zinc/62/07/35/963620735.db2.gz FKDDUEPAGQWOSP-PHIMTYICSA-N 1 2 249.358 2.265 20 0 BEADLO COc1c[nH+]c(NCc2ccc(=O)[nH]c2)c(C)c1 ZINC001157511608 963640277 /nfs/dbraw/zinc/64/02/77/963640277.db2.gz AHNSEKYBAOOZEO-UHFFFAOYSA-N 1 2 245.282 2.111 20 0 BEADLO CSc1nc(NC2CSC2)cc(C)[nH+]1 ZINC001157574463 963667508 /nfs/dbraw/zinc/66/75/08/963667508.db2.gz NGNKNRXKOZZJQY-UHFFFAOYSA-N 1 2 227.358 2.034 20 0 BEADLO CSc1cc[nH+]c(NCC2CC(=O)C2)c1 ZINC001157608918 963677433 /nfs/dbraw/zinc/67/74/33/963677433.db2.gz HLMICNVHDBJQHA-UHFFFAOYSA-N 1 2 222.313 2.195 20 0 BEADLO Cc1[nH]c2ccc(OC[C@@H]3CCCO3)cc2[nH+]1 ZINC001228325497 963756901 /nfs/dbraw/zinc/75/69/01/963756901.db2.gz AAQHAPPZJDJNPV-NSHDSACASA-N 1 2 232.283 2.429 20 0 BEADLO Fc1c[nH+]ccc1NC1(c2ccccn2)CC1 ZINC001168149805 963868719 /nfs/dbraw/zinc/86/87/19/963868719.db2.gz UTRNSYXPPYXLNT-UHFFFAOYSA-N 1 2 229.258 2.139 20 0 BEADLO c1nc(C[N@@H+]2CC[C@H]3CCCO[C@@H]3C2)cs1 ZINC001137592683 963880674 /nfs/dbraw/zinc/88/06/74/963880674.db2.gz YZERJLBQTRNQIP-ZYHUDNBSSA-N 1 2 238.356 2.144 20 0 BEADLO CSCc1cc[nH+]c(N(C)[C@H]2CCOC2)c1 ZINC001158573860 963891784 /nfs/dbraw/zinc/89/17/84/963891784.db2.gz KGKFMERUTJQFAR-NSHDSACASA-N 1 2 238.356 2.170 20 0 BEADLO C[C@H](Nc1cc(N)cc(Cl)[nH+]1)c1cnccn1 ZINC001158594488 963892385 /nfs/dbraw/zinc/89/23/85/963892385.db2.gz QTNRELOEKKAMQO-ZETCQYMHSA-N 1 2 249.705 2.280 20 0 BEADLO COc1ccc[nH+]c1NCCc1cncs1 ZINC001158875616 963951950 /nfs/dbraw/zinc/95/19/50/963951950.db2.gz VLOWGTJBTZOZDD-UHFFFAOYSA-N 1 2 235.312 2.201 20 0 BEADLO CC1CCC([NH+]2CC(O)(C(F)(F)F)C2)CC1 ZINC001168210770 963987456 /nfs/dbraw/zinc/98/74/56/963987456.db2.gz ZAMDEUFZADOSPA-UHFFFAOYSA-N 1 2 237.265 2.174 20 0 BEADLO F[C@H]1C[C@H](CNc2ccn3cc[nH+]c3c2)C1 ZINC001168236624 964015713 /nfs/dbraw/zinc/01/57/13/964015713.db2.gz BMFYKCBGPHHTBG-MGCOHNPYSA-N 1 2 219.263 2.494 20 0 BEADLO CCN(C)c1cc(NC[C@H]2C[C@H](F)C2)[nH+]cn1 ZINC001168234452 964027781 /nfs/dbraw/zinc/02/77/81/964027781.db2.gz ZMHPUROHBXYPHV-MGCOHNPYSA-N 1 2 238.310 2.093 20 0 BEADLO CCN(C)c1cc(NC[C@H]2C[C@H](F)C2)nc[nH+]1 ZINC001168234452 964027791 /nfs/dbraw/zinc/02/77/91/964027791.db2.gz ZMHPUROHBXYPHV-MGCOHNPYSA-N 1 2 238.310 2.093 20 0 BEADLO CCc1ccc(C[N@@H+]2C[C@H](F)[C@@H](OC)C2)o1 ZINC001204389465 964340718 /nfs/dbraw/zinc/34/07/18/964340718.db2.gz PGKMRWDFUMHLCG-RYUDHWBXSA-N 1 2 227.279 2.011 20 0 BEADLO CCc1ccc(C[N@H+]2C[C@H](F)[C@@H](OC)C2)o1 ZINC001204389465 964340728 /nfs/dbraw/zinc/34/07/28/964340728.db2.gz PGKMRWDFUMHLCG-RYUDHWBXSA-N 1 2 227.279 2.011 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1cc(C)c(F)c(F)c1 ZINC001143597697 964364991 /nfs/dbraw/zinc/36/49/91/964364991.db2.gz UUSISHSLNNYUTF-UHFFFAOYSA-N 1 2 227.254 2.294 20 0 BEADLO CC(=O)C[N@H+](C)Cc1cc(C)c(F)c(F)c1 ZINC001143597697 964365004 /nfs/dbraw/zinc/36/50/04/964365004.db2.gz UUSISHSLNNYUTF-UHFFFAOYSA-N 1 2 227.254 2.294 20 0 BEADLO CCC1(CNc2c[nH+]c3c(c2)CCC3)COC1 ZINC001168332969 964468600 /nfs/dbraw/zinc/46/86/00/964468600.db2.gz ZWCVHTKMSQONEZ-UHFFFAOYSA-N 1 2 232.327 2.409 20 0 BEADLO CC(C)c1cnc(NCCCn2cc[nH+]c2)nc1 ZINC001161681386 964683034 /nfs/dbraw/zinc/68/30/34/964683034.db2.gz VPBIDFGVBVGQMC-UHFFFAOYSA-N 1 2 245.330 2.299 20 0 BEADLO Cc1ccncc1NCCCn1cc[nH+]c1 ZINC001161684642 964683053 /nfs/dbraw/zinc/68/30/53/964683053.db2.gz HOPNJNIBPHUMOQ-UHFFFAOYSA-N 1 2 216.288 2.089 20 0 BEADLO Nc1ccc(C2(C(F)(F)F)CC2)c[nH+]1 ZINC001161695738 964694974 /nfs/dbraw/zinc/69/49/74/964694974.db2.gz WREMDJBKVSOLJL-UHFFFAOYSA-N 1 2 202.179 2.258 20 0 BEADLO Cc1cc(N[C@@H](CO)C(C)C)c[nH+]c1C ZINC001161740917 964726495 /nfs/dbraw/zinc/72/64/95/964726495.db2.gz XRPCORKKQVEVTA-LBPRGKRZSA-N 1 2 208.305 2.127 20 0 BEADLO COc1c[nH+]c(NC2CCOCC2)c2[nH]ccc21 ZINC001161861874 964796646 /nfs/dbraw/zinc/79/66/46/964796646.db2.gz SVIWTTXHASDTKE-UHFFFAOYSA-N 1 2 247.298 2.162 20 0 BEADLO Cc1cc(NCCN2CCCCC2=O)c[nH+]c1C ZINC001161941328 964825925 /nfs/dbraw/zinc/82/59/25/964825925.db2.gz QVNYWCWYNSGESU-UHFFFAOYSA-N 1 2 247.342 2.123 20 0 BEADLO Fc1ccc(NCC2COC2)cc1-n1cc[nH+]c1 ZINC001161954647 964836525 /nfs/dbraw/zinc/83/65/25/964836525.db2.gz CWYTZFBTHJOWHJ-UHFFFAOYSA-N 1 2 247.273 2.070 20 0 BEADLO COCCOc1cc(NC2CC(F)C2)cc[nH+]1 ZINC001162213914 964877190 /nfs/dbraw/zinc/87/71/90/964877190.db2.gz IKMBSXLMTLGOHP-UHFFFAOYSA-N 1 2 240.278 2.019 20 0 BEADLO Cc1oncc1CNc1ccn2cc[nH+]c2c1 ZINC001162270114 964897117 /nfs/dbraw/zinc/89/71/17/964897117.db2.gz WRHGCKAKMHGZED-UHFFFAOYSA-N 1 2 228.255 2.243 20 0 BEADLO CC(C)COc1cc(NCc2ncon2)cc[nH+]1 ZINC001162287552 964913337 /nfs/dbraw/zinc/91/33/37/964913337.db2.gz YXESISPIFCBOBM-UHFFFAOYSA-N 1 2 248.286 2.112 20 0 BEADLO CC(C)C[C@H](CO)Nc1ccn2cc[nH+]c2c1 ZINC001162368145 964943496 /nfs/dbraw/zinc/94/34/96/964943496.db2.gz DJFWMJCYRBKOFD-GFCCVEGCSA-N 1 2 233.315 2.153 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1C[C@]12CCCOC2 ZINC001162369900 964945740 /nfs/dbraw/zinc/94/57/40/964945740.db2.gz GCCBGHOSIJZSIZ-AAEUAGOBSA-N 1 2 234.299 2.071 20 0 BEADLO CCOc1ccc[nH+]c1N[C@@H]1C[C@@]12CCCOC2 ZINC001162381038 964950426 /nfs/dbraw/zinc/95/04/26/964950426.db2.gz PECQUNAFUVIJCN-TZMCWYRMSA-N 1 2 248.326 2.461 20 0 BEADLO Cc1ccc(Nc2cc(C)c(=O)n(C)c2)[nH+]c1C ZINC001162509090 965004907 /nfs/dbraw/zinc/00/49/07/965004907.db2.gz ITOGBUFBJGXXIJ-UHFFFAOYSA-N 1 2 243.310 2.449 20 0 BEADLO CN(C)c1ccc(Nc2ccncc2Cl)c[nH+]1 ZINC001212144353 965069929 /nfs/dbraw/zinc/06/99/29/965069929.db2.gz PVWMCIHRIQBQER-UHFFFAOYSA-N 1 2 248.717 2.362 20 0 BEADLO Cc1ncc(CNc2ccn3cc[nH+]c3c2)cn1 ZINC001168387074 965114495 /nfs/dbraw/zinc/11/44/95/965114495.db2.gz QLSDVRRKNFRGQL-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO Cn1cccc1CNc1ccn2cc[nH+]c2c1 ZINC001162709695 965133238 /nfs/dbraw/zinc/13/32/38/965133238.db2.gz ZZPAGYUOXRSBSU-UHFFFAOYSA-N 1 2 226.283 2.285 20 0 BEADLO Nc1cc(N[C@@H]2CCc3sccc32)[nH+]cn1 ZINC001162767035 965165412 /nfs/dbraw/zinc/16/54/12/965165412.db2.gz ZBZFCPPMNAEYAF-MRVPVSSYSA-N 1 2 232.312 2.220 20 0 BEADLO COc1cc(C)c[nH+]c1NCC1CC(OC)C1 ZINC001162991211 965218602 /nfs/dbraw/zinc/21/86/02/965218602.db2.gz BSYCMBTWOFPFHN-UHFFFAOYSA-N 1 2 236.315 2.236 20 0 BEADLO Cc1nc(N[C@H](C)c2ccno2)c2c([nH+]1)CCC2 ZINC001163214476 965307548 /nfs/dbraw/zinc/30/75/48/965307548.db2.gz VGFMOCUJFASWGZ-MRVPVSSYSA-N 1 2 244.298 2.435 20 0 BEADLO CCCN(CCOC)c1ccc(Cl)c(N)[nH+]1 ZINC001163649546 965493245 /nfs/dbraw/zinc/49/32/45/965493245.db2.gz FUOVXBCFYVCWCS-UHFFFAOYSA-N 1 2 243.738 2.180 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H](C)C(C)C ZINC001121231073 965522954 /nfs/dbraw/zinc/52/29/54/965522954.db2.gz HOOANWVLHONDLZ-NSHDSACASA-N 1 2 220.316 2.351 20 0 BEADLO COc1cc(C)c[nH+]c1N1CC(C)(C)C1 ZINC001163727514 965543282 /nfs/dbraw/zinc/54/32/82/965543282.db2.gz WNJKLZQLOGREPR-UHFFFAOYSA-N 1 2 206.289 2.245 20 0 BEADLO CCc1ccc[nH+]c1NCCn1cc[nH+]c1C ZINC001163919497 965634458 /nfs/dbraw/zinc/63/44/58/965634458.db2.gz GCOCQRISHBNYCO-UHFFFAOYSA-N 1 2 230.315 2.261 20 0 BEADLO CCc1cccc(NCCn2cc[nH+]c2C)n1 ZINC001163929562 965640633 /nfs/dbraw/zinc/64/06/33/965640633.db2.gz QOVVUXNYPKOGPP-UHFFFAOYSA-N 1 2 230.315 2.261 20 0 BEADLO Nc1[nH+]c(N2CC(F)(C3CC3)C2)ccc1Cl ZINC001163972310 965670034 /nfs/dbraw/zinc/67/00/34/965670034.db2.gz LKQHBWMHJIRETQ-UHFFFAOYSA-N 1 2 241.697 2.256 20 0 BEADLO Cc1nonc1CNc1cc(C)c2[nH]ccc2[nH+]1 ZINC001164065995 965727376 /nfs/dbraw/zinc/72/73/76/965727376.db2.gz USKGOMLKXVPDAC-UHFFFAOYSA-N 1 2 243.270 2.175 20 0 BEADLO C[C@@]1(CO)CCN(c2cc3ccccc3c[nH+]2)C1 ZINC001164138677 965757285 /nfs/dbraw/zinc/75/72/85/965757285.db2.gz CGYZXDDZQMAYRV-OAHLLOKOSA-N 1 2 242.322 2.444 20 0 BEADLO CC[NH+]1CC(Oc2c(C)cc(OC)cc2C)C1 ZINC001234275941 965777963 /nfs/dbraw/zinc/77/79/63/965777963.db2.gz XIBAURLGJPELDK-UHFFFAOYSA-N 1 2 235.327 2.395 20 0 BEADLO Cc1c(F)cc[nH+]c1N1CCC[C@@H](O)[C@@H](C)C1 ZINC001164217038 965798918 /nfs/dbraw/zinc/79/89/18/965798918.db2.gz AFNVKTUDYRRQIM-JOYOIKCWSA-N 1 2 238.306 2.126 20 0 BEADLO Cc1cc(N2[C@@H](C)CC[C@H]2CO)nc(C(C)C)[nH+]1 ZINC001164309909 965842581 /nfs/dbraw/zinc/84/25/81/965842581.db2.gz XFEPCPIYUFABOA-RYUDHWBXSA-N 1 2 249.358 2.258 20 0 BEADLO C[C@@H](Cc1cccc(F)c1)[NH+]1CCC(=O)CC1 ZINC001168478624 965877982 /nfs/dbraw/zinc/87/79/82/965877982.db2.gz GUFDEBFQKNRTFP-NSHDSACASA-N 1 2 235.302 2.422 20 0 BEADLO CN(C)c1ccc(NC[C@@H]2CCCCO2)[nH+]c1 ZINC001165239169 966002432 /nfs/dbraw/zinc/00/24/32/966002432.db2.gz BPDBNYPRALNVOI-LBPRGKRZSA-N 1 2 235.331 2.129 20 0 BEADLO Cn1c[nH+]cc1CCCOC(=O)[C@@]1(C)C=CCC1 ZINC001122974092 966017444 /nfs/dbraw/zinc/01/74/44/966017444.db2.gz SENVIGPDBKJOMR-AWEZNQCLSA-N 1 2 248.326 2.252 20 0 BEADLO CC[C@H]1CN(Cc2ccc(S)cc2)CC[NH2+]1 ZINC001235730054 966100599 /nfs/dbraw/zinc/10/05/99/966100599.db2.gz HRFOFHJXTNDTDT-LBPRGKRZSA-N 1 2 236.384 2.159 20 0 BEADLO C[C@@H]1[C@@H](C)CCCN1c1cc(N(C)C)[nH+]cn1 ZINC001166612626 966333720 /nfs/dbraw/zinc/33/37/20/966333720.db2.gz XOSSSKZYTDKEFS-WDEREUQCSA-N 1 2 234.347 2.167 20 0 BEADLO C[C@@H]1[C@@H](C)CCCN1c1cc(N(C)C)nc[nH+]1 ZINC001166612626 966333733 /nfs/dbraw/zinc/33/37/33/966333733.db2.gz XOSSSKZYTDKEFS-WDEREUQCSA-N 1 2 234.347 2.167 20 0 BEADLO Cc1nc(N2CCCCC23COC3)c(C)c(C)[nH+]1 ZINC001166696571 966374932 /nfs/dbraw/zinc/37/49/32/966374932.db2.gz WWXUOOWWVDETJX-UHFFFAOYSA-N 1 2 247.342 2.161 20 0 BEADLO CCSc1cc[nH+]c(N2C[C@@H]3C[C@H]2CO3)c1 ZINC001166755948 966393462 /nfs/dbraw/zinc/39/34/62/966393462.db2.gz XGHSFDDLDHXQHP-UWVGGRQHSA-N 1 2 236.340 2.171 20 0 BEADLO CCc1cn(Cc2cccc(C)n2)c[nH+]1 ZINC001166823909 966427016 /nfs/dbraw/zinc/42/70/16/966427016.db2.gz ZUFGUAYWZCFEFP-UHFFFAOYSA-N 1 2 201.273 2.197 20 0 BEADLO CCN(c1cccc(C2CC2)[nH+]1)C1COC1 ZINC001166943312 966470030 /nfs/dbraw/zinc/47/00/30/966470030.db2.gz HXBTZJWZZKIWBA-UHFFFAOYSA-N 1 2 218.300 2.184 20 0 BEADLO CSc1cc[nH+]c(N2CC[C@@H](O)C[C@H]2C)c1 ZINC001166964427 966491363 /nfs/dbraw/zinc/49/13/63/966491363.db2.gz VTTJRPKDBVYJCF-NXEZZACHSA-N 1 2 238.356 2.153 20 0 BEADLO CN(c1cccc(C2CC2)[nH+]1)C1(C)COC1 ZINC001166985173 966507878 /nfs/dbraw/zinc/50/78/78/966507878.db2.gz QMSWYKYOWFXQED-UHFFFAOYSA-N 1 2 218.300 2.184 20 0 BEADLO Cc1cc(N(C)C2(C)COC2)nc(C(C)C)[nH+]1 ZINC001166986149 966508506 /nfs/dbraw/zinc/50/85/06/966508506.db2.gz WCSYLNVTOFFOOH-UHFFFAOYSA-N 1 2 235.331 2.134 20 0 BEADLO Cc1nc(N2CCOC[C@H]2C(C)C)c(C)c(C)[nH+]1 ZINC001166998875 966510620 /nfs/dbraw/zinc/51/06/20/966510620.db2.gz BHKZVUFTWSVMSN-ZDUSSCGKSA-N 1 2 249.358 2.263 20 0 BEADLO Cc1cncc(C[N@@H+](C)Cc2cccnc2C)n1 ZINC001203178005 966544750 /nfs/dbraw/zinc/54/47/50/966544750.db2.gz XQXQFRTVPPBYCC-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cncc(C[N@H+](C)Cc2cccnc2C)n1 ZINC001203178005 966544754 /nfs/dbraw/zinc/54/47/54/966544754.db2.gz XQXQFRTVPPBYCC-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccc(N(C)c2ncccc2N)c(C)[nH+]1 ZINC001203363762 966611641 /nfs/dbraw/zinc/61/16/41/966611641.db2.gz XBOLSWHCDHUIFP-UHFFFAOYSA-N 1 2 228.299 2.444 20 0 BEADLO Cc1ccc(Nc2cnccn2)c(C)[nH+]1 ZINC001203362725 966615655 /nfs/dbraw/zinc/61/56/55/966615655.db2.gz GBDBZDFLXYSMFD-UHFFFAOYSA-N 1 2 200.245 2.232 20 0 BEADLO COCCn1nccc1Nc1ccc(C)[nH+]c1C ZINC001203370249 966620486 /nfs/dbraw/zinc/62/04/86/966620486.db2.gz XYEKLMWZXPUVJZ-UHFFFAOYSA-N 1 2 246.314 2.285 20 0 BEADLO CNc1ccc(Nc2conc2C)c[nH+]1 ZINC001203449228 966648862 /nfs/dbraw/zinc/64/88/62/966648862.db2.gz CUBQVXWUYYNKSW-UHFFFAOYSA-N 1 2 204.233 2.163 20 0 BEADLO CCn1cc(Nc2ccc(NC)[nH+]c2)c(C)n1 ZINC001203448729 966650798 /nfs/dbraw/zinc/65/07/98/966650798.db2.gz HHAWKPCMBYJURP-UHFFFAOYSA-N 1 2 231.303 2.392 20 0 BEADLO CNc1ccc(Nc2ccc(CO)cc2)c[nH+]1 ZINC001203456305 966652339 /nfs/dbraw/zinc/65/23/39/966652339.db2.gz BRUBKEAPHKZDIJ-UHFFFAOYSA-N 1 2 229.283 2.359 20 0 BEADLO CNc1ccc(Nc2cnn(C(F)F)c2)c[nH+]1 ZINC001203454337 966652889 /nfs/dbraw/zinc/65/28/89/966652889.db2.gz BPRRNQHUDGVOOZ-UHFFFAOYSA-N 1 2 239.229 2.459 20 0 BEADLO CNc1ccc(Nc2cc(C)nn2CCF)c[nH+]1 ZINC001203453155 966655875 /nfs/dbraw/zinc/65/58/75/966655875.db2.gz WZJPKWBYXJBFHG-UHFFFAOYSA-N 1 2 249.293 2.341 20 0 BEADLO CNc1ccc(Nc2cnc(C)nc2C)c[nH+]1 ZINC001203450151 966657613 /nfs/dbraw/zinc/65/76/13/966657613.db2.gz WXRJJFQUTCZKDN-UHFFFAOYSA-N 1 2 229.287 2.274 20 0 BEADLO CCc1cc(Nc2ccc(NC)[nH+]c2)on1 ZINC001203449972 966658446 /nfs/dbraw/zinc/65/84/46/966658446.db2.gz PRJYATGQCJROBV-UHFFFAOYSA-N 1 2 218.260 2.417 20 0 BEADLO CCOc1ccccc1C[N@@H+]1C[C@@H]2C[C@H]1CO2 ZINC001203541313 966671650 /nfs/dbraw/zinc/67/16/50/966671650.db2.gz SSBBQCUFCNFSKE-STQMWFEESA-N 1 2 233.311 2.058 20 0 BEADLO CCOc1ccccc1C[N@H+]1C[C@@H]2C[C@H]1CO2 ZINC001203541313 966671661 /nfs/dbraw/zinc/67/16/61/966671661.db2.gz SSBBQCUFCNFSKE-STQMWFEESA-N 1 2 233.311 2.058 20 0 BEADLO CCOc1ccccc1C[N@@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001203547486 966677593 /nfs/dbraw/zinc/67/75/93/966677593.db2.gz OOEFZRSYCBTZMO-ZIAGYGMSSA-N 1 2 247.338 2.449 20 0 BEADLO CCOc1ccccc1C[N@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001203547486 966677608 /nfs/dbraw/zinc/67/76/08/966677608.db2.gz OOEFZRSYCBTZMO-ZIAGYGMSSA-N 1 2 247.338 2.449 20 0 BEADLO COc1cnc(Nc2cc(C)c[nH+]c2C)cn1 ZINC001203655817 966723598 /nfs/dbraw/zinc/72/35/98/966723598.db2.gz BRWNXRLCRQLFSA-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO COc1ccc(C[N@@H+]2CCC23COC3)c(C)c1C ZINC001203724160 966750923 /nfs/dbraw/zinc/75/09/23/966750923.db2.gz BRYWUQHIXXAYIN-UHFFFAOYSA-N 1 2 247.338 2.287 20 0 BEADLO COc1ccc(C[N@H+]2CCC23COC3)c(C)c1C ZINC001203724160 966750934 /nfs/dbraw/zinc/75/09/34/966750934.db2.gz BRYWUQHIXXAYIN-UHFFFAOYSA-N 1 2 247.338 2.287 20 0 BEADLO Cc1ccc(C[NH+]2CC(N(C)C)C2)c(C)c1 ZINC001203728750 966758016 /nfs/dbraw/zinc/75/80/16/966758016.db2.gz AYEAJYXFIXBULR-UHFFFAOYSA-N 1 2 218.344 2.049 20 0 BEADLO C[C@H](O)C[N@H+](Cc1csc(Cl)n1)C1CC1 ZINC000691315328 966810079 /nfs/dbraw/zinc/81/00/79/966810079.db2.gz VIJCGRBPQUNPMF-ZETCQYMHSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@H](O)C[N@@H+](Cc1csc(Cl)n1)C1CC1 ZINC000691315328 966810083 /nfs/dbraw/zinc/81/00/83/966810083.db2.gz VIJCGRBPQUNPMF-ZETCQYMHSA-N 1 2 246.763 2.142 20 0 BEADLO O=C1CCC2(CC1)CC[NH+](Cc1ncc[nH]1)CC2 ZINC001203980994 966839191 /nfs/dbraw/zinc/83/91/91/966839191.db2.gz XTYVHHZTPFMZQQ-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO O=C1CC[N@H+](Cc2cccnc2)[C@H]2CCCC[C@@H]12 ZINC001204068678 966874182 /nfs/dbraw/zinc/87/41/82/966874182.db2.gz DXMDBRJWIXUZLV-KGLIPLIRSA-N 1 2 244.338 2.415 20 0 BEADLO O=C1CC[N@@H+](Cc2cccnc2)[C@H]2CCCC[C@@H]12 ZINC001204068678 966874190 /nfs/dbraw/zinc/87/41/90/966874190.db2.gz DXMDBRJWIXUZLV-KGLIPLIRSA-N 1 2 244.338 2.415 20 0 BEADLO Cc1cccc(C[N@@H+]2CCc3cccnc3C2)n1 ZINC001204069939 966878761 /nfs/dbraw/zinc/87/87/61/966878761.db2.gz GARTWKLJDPCBIN-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1cccc(C[N@H+]2CCc3cccnc3C2)n1 ZINC001204069939 966878765 /nfs/dbraw/zinc/87/87/65/966878765.db2.gz GARTWKLJDPCBIN-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO CC(C)c1ccc(C[NH+]2CCN(C#N)CC2)cc1 ZINC001204169172 966913730 /nfs/dbraw/zinc/91/37/30/966913730.db2.gz IOZWRFBUIZQVOJ-UHFFFAOYSA-N 1 2 243.354 2.409 20 0 BEADLO CCOc1cc[nH+]cc1Nc1ccc(CO)nc1 ZINC001212372550 966934852 /nfs/dbraw/zinc/93/48/52/966934852.db2.gz PCOZIWPZNLBVNE-UHFFFAOYSA-N 1 2 245.282 2.111 20 0 BEADLO CC(=O)[C@H]1CCCC[N@@H+]1Cc1ccoc1 ZINC001204243741 966943817 /nfs/dbraw/zinc/94/38/17/966943817.db2.gz GYYXEHFQJRXOBB-GFCCVEGCSA-N 1 2 207.273 2.223 20 0 BEADLO CC(=O)[C@H]1CCCC[N@H+]1Cc1ccoc1 ZINC001204243741 966943827 /nfs/dbraw/zinc/94/38/27/966943827.db2.gz GYYXEHFQJRXOBB-GFCCVEGCSA-N 1 2 207.273 2.223 20 0 BEADLO Cn1cc(C[NH+]2CC3(CCO3)C2)c2ccccc21 ZINC001204326843 966969491 /nfs/dbraw/zinc/96/94/91/966969491.db2.gz XXEOSBZUWRPQAC-UHFFFAOYSA-N 1 2 242.322 2.153 20 0 BEADLO CCC[N@H+](C)[C@@H](C)c1ncc(C(=O)OC)s1 ZINC001204422080 966995657 /nfs/dbraw/zinc/99/56/57/966995657.db2.gz KAWABQOHCAGGQO-QMMMGPOBSA-N 1 2 242.344 2.333 20 0 BEADLO CCC[N@@H+](C)[C@@H](C)c1ncc(C(=O)OC)s1 ZINC001204422080 966995667 /nfs/dbraw/zinc/99/56/67/966995667.db2.gz KAWABQOHCAGGQO-QMMMGPOBSA-N 1 2 242.344 2.333 20 0 BEADLO COc1cc[nH+]cc1NC1CCC(OC)CC1 ZINC001168614689 967001643 /nfs/dbraw/zinc/00/16/43/967001643.db2.gz PDNYVOUSLCEJIW-UHFFFAOYSA-N 1 2 236.315 2.460 20 0 BEADLO Nc1[nH+]cccc1Nc1cc(Cl)c[nH]c1=O ZINC001212394060 967015981 /nfs/dbraw/zinc/01/59/81/967015981.db2.gz YQEPIBXCQNXWGX-UHFFFAOYSA-N 1 2 236.662 2.161 20 0 BEADLO COC(=O)[C@@H]1CC[N@@H+]1Cc1cc(C)cc(C)c1 ZINC001204519398 967023967 /nfs/dbraw/zinc/02/39/67/967023967.db2.gz BEUHXEMDVTXHPD-ZDUSSCGKSA-N 1 2 233.311 2.051 20 0 BEADLO COC(=O)[C@@H]1CC[N@H+]1Cc1cc(C)cc(C)c1 ZINC001204519398 967023974 /nfs/dbraw/zinc/02/39/74/967023974.db2.gz BEUHXEMDVTXHPD-ZDUSSCGKSA-N 1 2 233.311 2.051 20 0 BEADLO Cc1cc(C[NH+]2CCN(C3CC3)CC2)oc1C ZINC001204532269 967027630 /nfs/dbraw/zinc/02/76/30/967027630.db2.gz UAYMHBZKONAIAW-UHFFFAOYSA-N 1 2 234.343 2.176 20 0 BEADLO Cc1cc(C[N@@H+](C)C2(C)COC2)oc1C ZINC001204532939 967029769 /nfs/dbraw/zinc/02/97/69/967029769.db2.gz JRMPVJBJJACGAS-UHFFFAOYSA-N 1 2 209.289 2.117 20 0 BEADLO Cc1cc(C[N@H+](C)C2(C)COC2)oc1C ZINC001204532939 967029772 /nfs/dbraw/zinc/02/97/72/967029772.db2.gz JRMPVJBJJACGAS-UHFFFAOYSA-N 1 2 209.289 2.117 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H]3CC[C@@H]2CO3)oc1C ZINC001204541273 967044556 /nfs/dbraw/zinc/04/45/56/967044556.db2.gz HNJOSNQLLCXVDG-VXGBXAGGSA-N 1 2 221.300 2.260 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H]3CC[C@@H]2CO3)oc1C ZINC001204541273 967044576 /nfs/dbraw/zinc/04/45/76/967044576.db2.gz HNJOSNQLLCXVDG-VXGBXAGGSA-N 1 2 221.300 2.260 20 0 BEADLO COc1cc2[nH+]ccn2cc1-c1ccncc1 ZINC001239611429 967045487 /nfs/dbraw/zinc/04/54/87/967045487.db2.gz TXEGAOQRGAZUKP-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO Cc1[nH+]c[nH]c1CN1CC[C@@H](CF)C(F)(F)C1 ZINC001204587692 967072652 /nfs/dbraw/zinc/07/26/52/967072652.db2.gz IKSXUMUQNTUBRD-VIFPVBQESA-N 1 2 247.264 2.145 20 0 BEADLO COc1ccc2c(c1)CN(Cc1[nH]c[nH+]c1C)C2 ZINC001204590383 967080402 /nfs/dbraw/zinc/08/04/02/967080402.db2.gz OWHWRQVPAPNJPO-UHFFFAOYSA-N 1 2 243.310 2.243 20 0 BEADLO Cc1[nH+]c[nH]c1CN1CCC[C@H](F)C(F)(F)C1 ZINC001204588045 967085705 /nfs/dbraw/zinc/08/57/05/967085705.db2.gz TZALIRLIHSRWAU-JTQLQIEISA-N 1 2 247.264 2.287 20 0 BEADLO CC[N@H+](C)Cc1csc(Br)n1 ZINC000060043373 967102244 /nfs/dbraw/zinc/10/22/44/967102244.db2.gz KZLOEDMULLFKQI-UHFFFAOYSA-N 1 2 235.150 2.357 20 0 BEADLO CC[N@@H+](C)Cc1csc(Br)n1 ZINC000060043373 967102251 /nfs/dbraw/zinc/10/22/51/967102251.db2.gz KZLOEDMULLFKQI-UHFFFAOYSA-N 1 2 235.150 2.357 20 0 BEADLO COc1cccc(C(=O)Cc2ccc(N)[nH+]c2)c1 ZINC001249899434 967138209 /nfs/dbraw/zinc/13/82/09/967138209.db2.gz WQRLPMPMEAMJSV-UHFFFAOYSA-N 1 2 242.278 2.098 20 0 BEADLO CC1(C)C[NH+](Cc2nc3ccccc3[nH]2)C1 ZINC001204745393 967146935 /nfs/dbraw/zinc/14/69/35/967146935.db2.gz GHWKFFXLMPPEFM-UHFFFAOYSA-N 1 2 215.300 2.405 20 0 BEADLO COc1ccc(C[NH+]2CC(C(F)F)C2)nc1C ZINC001249912500 967150345 /nfs/dbraw/zinc/15/03/45/967150345.db2.gz KPKYALMQMXQWGO-UHFFFAOYSA-N 1 2 242.269 2.096 20 0 BEADLO Cc1ccc(-c2ccc3nonc3c2)[nH+]c1N ZINC001204925492 967239464 /nfs/dbraw/zinc/23/94/64/967239464.db2.gz JPTQTKPXYNTZOK-UHFFFAOYSA-N 1 2 226.239 2.175 20 0 BEADLO CCOc1cc(C[N@@H+]2C[C@H](F)C[C@H]2C)ccn1 ZINC001249998160 967248419 /nfs/dbraw/zinc/24/84/19/967248419.db2.gz MZZMIIKFJJLMMP-ZYHUDNBSSA-N 1 2 238.306 2.413 20 0 BEADLO CCOc1cc(C[N@H+]2C[C@H](F)C[C@H]2C)ccn1 ZINC001249998160 967248428 /nfs/dbraw/zinc/24/84/28/967248428.db2.gz MZZMIIKFJJLMMP-ZYHUDNBSSA-N 1 2 238.306 2.413 20 0 BEADLO c1cc(Nc2ccn3cc[nH+]c3c2)on1 ZINC001204951439 967251046 /nfs/dbraw/zinc/25/10/46/967251046.db2.gz RVGIQCIIRNHPEX-UHFFFAOYSA-N 1 2 200.201 2.066 20 0 BEADLO Cc1nsc(Nc2ccn3cc[nH+]c3c2)n1 ZINC001204950992 967252253 /nfs/dbraw/zinc/25/22/53/967252253.db2.gz LJBSMPBGYKEIEK-UHFFFAOYSA-N 1 2 231.284 2.238 20 0 BEADLO Cc1cccc(C)c1NC(=O)Cc1[nH]cc[nH+]1 ZINC001250004776 967265835 /nfs/dbraw/zinc/26/58/35/967265835.db2.gz SQIMEEXGAJUMQG-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO CNc1ccc(Nc2ccc(Cl)nn2)c[nH+]1 ZINC001203447611 967270221 /nfs/dbraw/zinc/27/02/21/967270221.db2.gz MMDPZDIJUWOZQT-UHFFFAOYSA-N 1 2 235.678 2.310 20 0 BEADLO CCN(CC)C(=O)Cc1ccc(C)[nH+]c1C ZINC001250011125 967270148 /nfs/dbraw/zinc/27/01/48/967270148.db2.gz OLZPPENRDNJMEN-UHFFFAOYSA-N 1 2 220.316 2.109 20 0 BEADLO Nc1ccc(CCC(=O)c2ccccc2)c[nH+]1 ZINC001250022952 967278858 /nfs/dbraw/zinc/27/88/58/967278858.db2.gz IMQSTQAECOUNDX-UHFFFAOYSA-N 1 2 226.279 2.479 20 0 BEADLO Cc1ccc(CC(=O)OC(C)C)c(C)[nH+]1 ZINC001250085833 967350323 /nfs/dbraw/zinc/35/03/23/967350323.db2.gz GIGVMCWAOVCGLF-UHFFFAOYSA-N 1 2 207.273 2.193 20 0 BEADLO Cn1ccnc1C[N@@H+]1CCC(F)(F)C(C)(C)C1 ZINC001205112020 967360761 /nfs/dbraw/zinc/36/07/61/967360761.db2.gz VGTBZUSMJXRHJR-UHFFFAOYSA-N 1 2 243.301 2.287 20 0 BEADLO Cn1ccnc1C[N@H+]1CCC(F)(F)C(C)(C)C1 ZINC001205112020 967360774 /nfs/dbraw/zinc/36/07/74/967360774.db2.gz VGTBZUSMJXRHJR-UHFFFAOYSA-N 1 2 243.301 2.287 20 0 BEADLO CC1(C)OC[C@H](Cc2ccc3[nH+]ccn3c2)O1 ZINC001250183606 967487833 /nfs/dbraw/zinc/48/78/33/967487833.db2.gz QNLMMQUCFQSWEI-NSHDSACASA-N 1 2 232.283 2.028 20 0 BEADLO Nc1ccc(CC(=O)c2ccc(F)cc2F)c[nH+]1 ZINC001250249515 967560742 /nfs/dbraw/zinc/56/07/42/967560742.db2.gz YKUPORDYSTWSND-UHFFFAOYSA-N 1 2 248.232 2.367 20 0 BEADLO Cc1c[nH+]c(C)c(CCCCCC(N)=O)c1 ZINC001250270735 967591810 /nfs/dbraw/zinc/59/18/10/967591810.db2.gz HHTUGIXCEJDNMP-UHFFFAOYSA-N 1 2 220.316 2.287 20 0 BEADLO Cc1ccc(F)cc1CC[NH+]1CCOCC1 ZINC001250275974 967603048 /nfs/dbraw/zinc/60/30/48/967603048.db2.gz RPBKFLAARBXEHT-UHFFFAOYSA-N 1 2 223.291 2.009 20 0 BEADLO c1cn(CCc2cnc3cccnc3c2)c[nH+]1 ZINC001250316540 967677476 /nfs/dbraw/zinc/67/74/76/967677476.db2.gz LTFBSNDAXOVQKB-UHFFFAOYSA-N 1 2 224.267 2.069 20 0 BEADLO CC(=O)Nc1ccc(CCn2cc[nH+]c2)cc1 ZINC001250315197 967678581 /nfs/dbraw/zinc/67/85/81/967678581.db2.gz GPIYQMIHRJHQFN-UHFFFAOYSA-N 1 2 229.283 2.084 20 0 BEADLO COc1ccc(CCn2cc[nH+]c2)cc1F ZINC001250315896 967681027 /nfs/dbraw/zinc/68/10/27/967681027.db2.gz WXBHGYIKFQZUGS-UHFFFAOYSA-N 1 2 220.247 2.274 20 0 BEADLO CCOC(=O)c1ccccc1CCn1cc[nH+]c1 ZINC001250318486 967684030 /nfs/dbraw/zinc/68/40/30/967684030.db2.gz GGPYTISVRICWGP-UHFFFAOYSA-N 1 2 244.294 2.303 20 0 BEADLO COc1c(F)cccc1CCn1cc[nH+]c1 ZINC001250318325 967686598 /nfs/dbraw/zinc/68/65/98/967686598.db2.gz CFAKGLTUEATMPJ-UHFFFAOYSA-N 1 2 220.247 2.274 20 0 BEADLO CCOC(=O)c1cccc(CCn2cc[nH+]c2)c1 ZINC001250318625 967688318 /nfs/dbraw/zinc/68/83/18/967688318.db2.gz HBYGBYBMEBFDDI-UHFFFAOYSA-N 1 2 244.294 2.303 20 0 BEADLO Nc1ccc(Cl)cc1CCn1cc[nH+]c1 ZINC001250318378 967692005 /nfs/dbraw/zinc/69/20/05/967692005.db2.gz FQBBCXHMIRFXQS-UHFFFAOYSA-N 1 2 221.691 2.361 20 0 BEADLO CN(C)c1ccccc1CCn1cc[nH+]c1 ZINC001250318927 967692750 /nfs/dbraw/zinc/69/27/50/967692750.db2.gz MQHWXFNYLQBQLD-UHFFFAOYSA-N 1 2 215.300 2.192 20 0 BEADLO Oc1ccc(CCn2cc[nH+]c2)c(F)c1F ZINC001250318670 967693706 /nfs/dbraw/zinc/69/37/06/967693706.db2.gz JZFXKSJEXWHRFJ-UHFFFAOYSA-N 1 2 224.210 2.110 20 0 BEADLO C[C@H](O)c1ccc(CCn2cc[nH+]c2)cc1 ZINC001250318932 967694128 /nfs/dbraw/zinc/69/41/28/967694128.db2.gz MSVDLCYQCIHOEP-NSHDSACASA-N 1 2 216.284 2.179 20 0 BEADLO Clc1cnccc1CCn1cc[nH+]c1 ZINC001250319394 967694686 /nfs/dbraw/zinc/69/46/86/967694686.db2.gz QPISZHOUDQVPGQ-UHFFFAOYSA-N 1 2 207.664 2.174 20 0 BEADLO COc1c(F)ccc(CCn2cc[nH+]c2)c1F ZINC001250320138 967695887 /nfs/dbraw/zinc/69/58/87/967695887.db2.gz YURSEMJRTXYQOZ-UHFFFAOYSA-N 1 2 238.237 2.413 20 0 BEADLO Cc1ccc(CCn2cc[nH+]c2)c(N)c1 ZINC001250320137 967697696 /nfs/dbraw/zinc/69/76/96/967697696.db2.gz IFTUIIFFPMHSQL-UHFFFAOYSA-N 1 2 201.273 2.016 20 0 BEADLO COc1cc(SC)c(CCn2cc[nH+]c2)cn1 ZINC001250320871 967698603 /nfs/dbraw/zinc/69/86/03/967698603.db2.gz RPBDSDYZJWDEBJ-UHFFFAOYSA-N 1 2 249.339 2.251 20 0 BEADLO Cc1ccc(F)c(C[N@@H+]2CCOC3(CC3)C2)c1 ZINC001205662027 967749794 /nfs/dbraw/zinc/74/97/94/967749794.db2.gz RSDVKDIVHRCMST-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1ccc(F)c(C[N@H+]2CCOC3(CC3)C2)c1 ZINC001205662027 967749802 /nfs/dbraw/zinc/74/98/02/967749802.db2.gz RSDVKDIVHRCMST-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO CNc1ccc(Nc2sccc2C(N)=O)c[nH+]1 ZINC001203448869 967776411 /nfs/dbraw/zinc/77/64/11/967776411.db2.gz OIKQLBRMSOBGIA-UHFFFAOYSA-N 1 2 248.311 2.027 20 0 BEADLO C[C@H]1C(=O)CC[N@H+](Cc2cnoc2)C12CCCC2 ZINC001205762410 967814442 /nfs/dbraw/zinc/81/44/42/967814442.db2.gz LVJZKRMZYIRRIP-NSHDSACASA-N 1 2 248.326 2.398 20 0 BEADLO C[C@H]1C(=O)CC[N@@H+](Cc2cnoc2)C12CCCC2 ZINC001205762410 967814445 /nfs/dbraw/zinc/81/44/45/967814445.db2.gz LVJZKRMZYIRRIP-NSHDSACASA-N 1 2 248.326 2.398 20 0 BEADLO Cc1ncc(-c2ccc3[nH+]ccn3c2C)cn1 ZINC001205875897 967869615 /nfs/dbraw/zinc/86/96/15/967869615.db2.gz WQLIMVZMHFPPOP-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1cc2cccnc2[nH]1 ZINC001143224583 967874837 /nfs/dbraw/zinc/87/48/37/967874837.db2.gz VRXAUWRMMFYSJR-CYBMUJFWSA-N 1 2 245.326 2.174 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1cc2cccnc2[nH]1 ZINC001143224583 967874840 /nfs/dbraw/zinc/87/48/40/967874840.db2.gz VRXAUWRMMFYSJR-CYBMUJFWSA-N 1 2 245.326 2.174 20 0 BEADLO C[N@H+](CCF)Cc1cccc(Br)n1 ZINC001205990377 967944393 /nfs/dbraw/zinc/94/43/93/967944393.db2.gz YBTJNYRVIGVXSD-UHFFFAOYSA-N 1 2 247.111 2.245 20 0 BEADLO C[N@@H+](CCF)Cc1cccc(Br)n1 ZINC001205990377 967944407 /nfs/dbraw/zinc/94/44/07/967944407.db2.gz YBTJNYRVIGVXSD-UHFFFAOYSA-N 1 2 247.111 2.245 20 0 BEADLO Clc1ccc(C[NH2+]Cc2cscn2)cn1 ZINC000163663686 967982013 /nfs/dbraw/zinc/98/20/13/967982013.db2.gz HEHUKZAPEJBLMG-UHFFFAOYSA-N 1 2 239.731 2.481 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@H](C(F)F)C2)co1 ZINC001206068195 968034282 /nfs/dbraw/zinc/03/42/82/968034282.db2.gz OLJLMLRWUAJPCS-VIFPVBQESA-N 1 2 230.258 2.460 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@H](C(F)F)C2)co1 ZINC001206068195 968034294 /nfs/dbraw/zinc/03/42/94/968034294.db2.gz OLJLMLRWUAJPCS-VIFPVBQESA-N 1 2 230.258 2.460 20 0 BEADLO CCCc1cc[nH+]c(Nc2ccn(C)c(=O)c2)c1 ZINC001206092018 968055907 /nfs/dbraw/zinc/05/59/07/968055907.db2.gz OYCUSVUJYRCGKM-UHFFFAOYSA-N 1 2 243.310 2.476 20 0 BEADLO CCOC(=O)[C@H]([NH2+][C@@H]1C=CCCC1)C1CC1 ZINC001118229201 968057011 /nfs/dbraw/zinc/05/70/11/968057011.db2.gz YJAPGWCLJFHVFF-VXGBXAGGSA-N 1 2 223.316 2.026 20 0 BEADLO CCN(C)c1[nH+]ccc2ccc(C(=O)OC)cc21 ZINC001163583189 968068227 /nfs/dbraw/zinc/06/82/27/968068227.db2.gz KUOYSNRZDMYZCF-UHFFFAOYSA-N 1 2 244.294 2.478 20 0 BEADLO COCOc1ccc2[nH]c(CC3CC3)[nH+]c2c1 ZINC001250573130 968093592 /nfs/dbraw/zinc/09/35/92/968093592.db2.gz UVZZTHFITKMILK-UHFFFAOYSA-N 1 2 232.283 2.498 20 0 BEADLO Cc1c[nH+]c(Nc2ccccc2O)c(N)c1 ZINC001206193071 968118470 /nfs/dbraw/zinc/11/84/70/968118470.db2.gz FDUNYIRHLLJWAO-UHFFFAOYSA-N 1 2 215.256 2.421 20 0 BEADLO CNc1ccc(Nc2ncccc2F)c[nH+]1 ZINC001203449016 968191781 /nfs/dbraw/zinc/19/17/81/968191781.db2.gz VXYMPGQPDZNKCA-UHFFFAOYSA-N 1 2 218.235 2.401 20 0 BEADLO COc1ncc(C[N@H+](C)Cc2ccsc2)cn1 ZINC001206411694 968286033 /nfs/dbraw/zinc/28/60/33/968286033.db2.gz XPRXTNIPNMSKGZ-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1ncc(C[N@@H+](C)Cc2ccsc2)cn1 ZINC001206411694 968286042 /nfs/dbraw/zinc/28/60/42/968286042.db2.gz XPRXTNIPNMSKGZ-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1cnccc1C[N@H+](C)Cc1cccnc1 ZINC001206437804 968302345 /nfs/dbraw/zinc/30/23/45/968302345.db2.gz BBZIGBWXCAAVOE-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1cnccc1C[N@@H+](C)Cc1cccnc1 ZINC001206437804 968302357 /nfs/dbraw/zinc/30/23/57/968302357.db2.gz BBZIGBWXCAAVOE-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO CC[C@@H](O)CNc1ccc(N2CCCCC2)[nH+]c1 ZINC001251757275 968313670 /nfs/dbraw/zinc/31/36/70/968313670.db2.gz YPVQYIVIIWKABL-CYBMUJFWSA-N 1 2 249.358 2.255 20 0 BEADLO CC[C@@H](O)CNc1ccc(Cn2cc[nH+]c2)cc1 ZINC001251787666 968329517 /nfs/dbraw/zinc/32/95/17/968329517.db2.gz CGSSSVCWTDYPJO-CQSZACIVSA-N 1 2 245.326 2.114 20 0 BEADLO C[C@H](O)CNc1ccc2ccc[nH+]c2c1 ZINC001251964473 968402391 /nfs/dbraw/zinc/40/23/91/968402391.db2.gz LMYLDAPMOHWFKO-VIFPVBQESA-N 1 2 202.257 2.028 20 0 BEADLO COc1cccnc1C[N@@H+]1CCC[C@](C)(F)C1 ZINC001206611024 968419916 /nfs/dbraw/zinc/41/99/16/968419916.db2.gz QFAHFROPHLRIIJ-ZDUSSCGKSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cccnc1C[N@H+]1CCC[C@](C)(F)C1 ZINC001206611024 968419920 /nfs/dbraw/zinc/41/99/20/968419920.db2.gz QFAHFROPHLRIIJ-ZDUSSCGKSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cc(C)ccc1C[N@@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001206781567 968465384 /nfs/dbraw/zinc/46/53/84/968465384.db2.gz BBXYHDUVXLQKON-ZIAGYGMSSA-N 1 2 247.338 2.367 20 0 BEADLO COc1cc(C)ccc1C[N@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001206781567 968465391 /nfs/dbraw/zinc/46/53/91/968465391.db2.gz BBXYHDUVXLQKON-ZIAGYGMSSA-N 1 2 247.338 2.367 20 0 BEADLO CC(C(=O)NCc1[nH]c(C)c(C)[nH+]1)=C1CCC1 ZINC000820537606 968475966 /nfs/dbraw/zinc/47/59/66/968475966.db2.gz FXYOROPIFIWBTO-UHFFFAOYSA-N 1 2 233.315 2.143 20 0 BEADLO CSCC[N@H+](C)Cc1ncc2ccccn21 ZINC001207054176 968586693 /nfs/dbraw/zinc/58/66/93/968586693.db2.gz HIIWIUJRUNDFGP-UHFFFAOYSA-N 1 2 235.356 2.129 20 0 BEADLO CSCC[N@@H+](C)Cc1ncc2ccccn21 ZINC001207054176 968586699 /nfs/dbraw/zinc/58/66/99/968586699.db2.gz HIIWIUJRUNDFGP-UHFFFAOYSA-N 1 2 235.356 2.129 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2cccc(=O)[nH]2)C[C@@H]1F ZINC001207065132 968595879 /nfs/dbraw/zinc/59/58/79/968595879.db2.gz IULZONLJJCPOHZ-JQWIXIFHSA-N 1 2 242.269 2.059 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2cccc(=O)[nH]2)C[C@@H]1F ZINC001207065132 968595885 /nfs/dbraw/zinc/59/58/85/968595885.db2.gz IULZONLJJCPOHZ-JQWIXIFHSA-N 1 2 242.269 2.059 20 0 BEADLO CC[N@H+](Cc1cccnc1)Cc1cnc(C)cn1 ZINC001207077355 968610691 /nfs/dbraw/zinc/61/06/91/968610691.db2.gz JQJHJYYEGCCTML-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO CC[N@@H+](Cc1cccnc1)Cc1cnc(C)cn1 ZINC001207077355 968610697 /nfs/dbraw/zinc/61/06/97/968610697.db2.gz JQJHJYYEGCCTML-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO CC[C@@]12C[C@@H](CO1)[N@H+](Cc1ccnn1C(C)C)C2 ZINC001207175019 968678562 /nfs/dbraw/zinc/67/85/62/968678562.db2.gz SEXAHVCYRBUHRP-KBPBESRZSA-N 1 2 249.358 2.217 20 0 BEADLO CC[C@@]12C[C@@H](CO1)[N@@H+](Cc1ccnn1C(C)C)C2 ZINC001207175019 968678566 /nfs/dbraw/zinc/67/85/66/968678566.db2.gz SEXAHVCYRBUHRP-KBPBESRZSA-N 1 2 249.358 2.217 20 0 BEADLO Cn1ccc2c[nH+]c(-c3ccc(O)cc3)nc21 ZINC001241061033 968883129 /nfs/dbraw/zinc/88/31/29/968883129.db2.gz SMVJOKQFRKOLJF-UHFFFAOYSA-N 1 2 225.251 2.341 20 0 BEADLO C[C@@H](CCC1CC1)NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001324037540 968886818 /nfs/dbraw/zinc/88/68/18/968886818.db2.gz JSLUIAVQURSDOF-QWRGUYRKSA-N 1 2 235.331 2.139 20 0 BEADLO CCC[C@@H](O)C[N@@H+]1CCCCC(F)(F)C1 ZINC001252771517 968936923 /nfs/dbraw/zinc/93/69/23/968936923.db2.gz KYBQKLFMOOQZQA-SNVBAGLBSA-N 1 2 221.291 2.269 20 0 BEADLO CCC[C@@H](O)C[N@H+]1CCCCC(F)(F)C1 ZINC001252771517 968936927 /nfs/dbraw/zinc/93/69/27/968936927.db2.gz KYBQKLFMOOQZQA-SNVBAGLBSA-N 1 2 221.291 2.269 20 0 BEADLO Nc1cc(-c2cccc3c2NCC3)cc[nH+]1 ZINC001241170852 968941776 /nfs/dbraw/zinc/94/17/76/968941776.db2.gz ULRRLOUIRZAWFW-UHFFFAOYSA-N 1 2 211.268 2.299 20 0 BEADLO CCC[C@@H](O)C[N@@H+]1CCC[C@@H](F)C(F)(F)C1 ZINC001252779417 968953646 /nfs/dbraw/zinc/95/36/46/968953646.db2.gz QEOJHMGECKHNSO-NXEZZACHSA-N 1 2 239.281 2.217 20 0 BEADLO Oc1ccc[nH+]c1NC[C@@H](O)c1ccc(F)cc1 ZINC001252833834 969034052 /nfs/dbraw/zinc/03/40/52/969034052.db2.gz CJYMJTVSZFVGCM-GFCCVEGCSA-N 1 2 248.257 2.072 20 0 BEADLO Cc1cc(-c2ccc(F)cn2)c[nH+]c1N ZINC001241807803 969119773 /nfs/dbraw/zinc/11/97/73/969119773.db2.gz GBYZFCIGOITRFN-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO COC(=O)/C=C/c1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001242019647 969174647 /nfs/dbraw/zinc/17/46/47/969174647.db2.gz IEOVCXGXACHJQE-QPJJXVBHSA-N 1 2 228.251 2.263 20 0 BEADLO O=C1NCCC[C@@H]1c1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001242020092 969176454 /nfs/dbraw/zinc/17/64/54/969176454.db2.gz OWDCRJDKWFWDRE-GFCCVEGCSA-N 1 2 241.294 2.070 20 0 BEADLO CC1(Nc2ccc(Cn3cncn3)c[nH+]2)CCC1 ZINC001156073716 969180193 /nfs/dbraw/zinc/18/01/93/969180193.db2.gz LXOHUYYNBMABGJ-UHFFFAOYSA-N 1 2 243.314 2.076 20 0 BEADLO CCCCC[C@@H](O)CNc1[nH+]cccc1OC ZINC001253519470 969197216 /nfs/dbraw/zinc/19/72/16/969197216.db2.gz FDVUTPPYRFKMNP-LLVKDONJSA-N 1 2 238.331 2.443 20 0 BEADLO CC/C=C\CC[N@@H+]1CC(F)(F)CC[C@H]1CO ZINC001208723595 969207284 /nfs/dbraw/zinc/20/72/84/969207284.db2.gz CQNQNZCBEDDUDN-BYCRGOAPSA-N 1 2 233.302 2.435 20 0 BEADLO CC/C=C\CC[N@H+]1CC(F)(F)CC[C@H]1CO ZINC001208723595 969207289 /nfs/dbraw/zinc/20/72/89/969207289.db2.gz CQNQNZCBEDDUDN-BYCRGOAPSA-N 1 2 233.302 2.435 20 0 BEADLO CC/C=C\CC[N@@H+]1CC(F)(F)C[C@]1(C)CO ZINC001208725545 969213782 /nfs/dbraw/zinc/21/37/82/969213782.db2.gz LIBIMVOUCBLFIX-DOGVGXBMSA-N 1 2 233.302 2.435 20 0 BEADLO CC/C=C\CC[N@H+]1CC(F)(F)C[C@]1(C)CO ZINC001208725545 969213789 /nfs/dbraw/zinc/21/37/89/969213789.db2.gz LIBIMVOUCBLFIX-DOGVGXBMSA-N 1 2 233.302 2.435 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]c2cccc(=O)n2C)nc1 ZINC001168857255 969238034 /nfs/dbraw/zinc/23/80/34/969238034.db2.gz GVVADLYOTIGMLS-LLVKDONJSA-N 1 2 243.310 2.262 20 0 BEADLO c1cc2c(cn1)C[N@H+](C[C@@H]1CCC=CO1)C2 ZINC001208879321 969266910 /nfs/dbraw/zinc/26/69/10/969266910.db2.gz CTEBTGPZUVTQHH-ZDUSSCGKSA-N 1 2 216.284 2.090 20 0 BEADLO c1cc2c(cn1)C[N@@H+](C[C@@H]1CCC=CO1)C2 ZINC001208879321 969266917 /nfs/dbraw/zinc/26/69/17/969266917.db2.gz CTEBTGPZUVTQHH-ZDUSSCGKSA-N 1 2 216.284 2.090 20 0 BEADLO C[C@H](C[N@H+]1CCC(=O)[C@H](F)CC1)C(F)(F)F ZINC001208896577 969286854 /nfs/dbraw/zinc/28/68/54/969286854.db2.gz XFRIYSFHKLVEKZ-HTQZYQBOSA-N 1 2 241.228 2.188 20 0 BEADLO C[C@H](C[N@@H+]1CCC(=O)[C@H](F)CC1)C(F)(F)F ZINC001208896577 969286860 /nfs/dbraw/zinc/28/68/60/969286860.db2.gz XFRIYSFHKLVEKZ-HTQZYQBOSA-N 1 2 241.228 2.188 20 0 BEADLO CCC(=O)C(C)(C)C[N@@H+]1Cc2cccnc2C1 ZINC001208916785 969302929 /nfs/dbraw/zinc/30/29/29/969302929.db2.gz XSCWFSVETAZYKF-UHFFFAOYSA-N 1 2 232.327 2.403 20 0 BEADLO CCC(=O)C(C)(C)C[N@H+]1Cc2cccnc2C1 ZINC001208916785 969302932 /nfs/dbraw/zinc/30/29/32/969302932.db2.gz XSCWFSVETAZYKF-UHFFFAOYSA-N 1 2 232.327 2.403 20 0 BEADLO Cc1cc(N2CCCC[C@H]2CO)nc(C2CC2)[nH+]1 ZINC000090065416 969311209 /nfs/dbraw/zinc/31/12/09/969311209.db2.gz OWDXTOPVXLUQHJ-LBPRGKRZSA-N 1 2 247.342 2.014 20 0 BEADLO Cc1cccc(-c2nnc(C[NH+]3CCC3)o2)c1 ZINC001253683423 969329720 /nfs/dbraw/zinc/32/97/20/969329720.db2.gz LGEUDTXLDDBWKC-UHFFFAOYSA-N 1 2 229.283 2.251 20 0 BEADLO CCOc1cc(NC[C@H](O)C(C)(C)C)cc[nH+]1 ZINC001253717433 969342087 /nfs/dbraw/zinc/34/20/87/969342087.db2.gz LBRQCKNOZXDXAF-NSHDSACASA-N 1 2 238.331 2.299 20 0 BEADLO CCOC(C)(C)C[N@@H+]1CCC(F)(F)C1 ZINC001209070686 969345528 /nfs/dbraw/zinc/34/55/28/969345528.db2.gz UWQWPSSBPIUJEL-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO CCOC(C)(C)C[N@H+]1CCC(F)(F)C1 ZINC001209070686 969345531 /nfs/dbraw/zinc/34/55/31/969345531.db2.gz UWQWPSSBPIUJEL-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO CC(=O)OC(C)(C)CCC[N@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001209149101 969357814 /nfs/dbraw/zinc/35/78/14/969357814.db2.gz TVKKQIRBQZWCRO-PHIMTYICSA-N 1 2 249.301 2.100 20 0 BEADLO CC(=O)OC(C)(C)CCC[N@@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001209149101 969357821 /nfs/dbraw/zinc/35/78/21/969357821.db2.gz TVKKQIRBQZWCRO-PHIMTYICSA-N 1 2 249.301 2.100 20 0 BEADLO CC(C)[C@@H](O)CNc1ccc[nH+]c1N1CCCC1 ZINC001253753736 969371903 /nfs/dbraw/zinc/37/19/03/969371903.db2.gz VCHOBNZRKGIFKN-ZDUSSCGKSA-N 1 2 249.358 2.111 20 0 BEADLO CC1(C)OCC(C[N@@H+]2CCCC(F)(F)C2)CO1 ZINC001209191806 969383141 /nfs/dbraw/zinc/38/31/41/969383141.db2.gz PFYCUOUGAPGJQL-UHFFFAOYSA-N 1 2 249.301 2.117 20 0 BEADLO CC1(C)OCC(C[N@H+]2CCCC(F)(F)C2)CO1 ZINC001209191806 969383147 /nfs/dbraw/zinc/38/31/47/969383147.db2.gz PFYCUOUGAPGJQL-UHFFFAOYSA-N 1 2 249.301 2.117 20 0 BEADLO O=C1C[C@@H](Nc2[nH+]ccc3cc(F)ccc32)CO1 ZINC001169120401 969414827 /nfs/dbraw/zinc/41/48/27/969414827.db2.gz MWTNSFMYCDIYNM-SNVBAGLBSA-N 1 2 246.241 2.101 20 0 BEADLO CCCc1nnc([C@@H]2CCCc3[nH]c[nH+]c32)o1 ZINC001253962971 969431837 /nfs/dbraw/zinc/43/18/37/969431837.db2.gz OWHAGRAQYJOARL-MRVPVSSYSA-N 1 2 232.287 2.213 20 0 BEADLO C[C@H]1CC(C[N@H+](C)CC(F)F)C[C@H](C)O1 ZINC001209393740 969460841 /nfs/dbraw/zinc/46/08/41/969460841.db2.gz SIVIOWXCYSLYSX-IUCAKERBSA-N 1 2 221.291 2.387 20 0 BEADLO C[C@H]1CC(C[N@@H+](C)CC(F)F)C[C@H](C)O1 ZINC001209393740 969460844 /nfs/dbraw/zinc/46/08/44/969460844.db2.gz SIVIOWXCYSLYSX-IUCAKERBSA-N 1 2 221.291 2.387 20 0 BEADLO COc1cc(CCNc2cccc[nH+]2)ccn1 ZINC001169220040 969489963 /nfs/dbraw/zinc/48/99/63/969489963.db2.gz GLXGKVVJRMFTBX-UHFFFAOYSA-N 1 2 229.283 2.140 20 0 BEADLO CC[NH+]1CCC([NH2+]C2(c3ccccn3)CC2)CC1 ZINC001169225344 969491837 /nfs/dbraw/zinc/49/18/37/969491837.db2.gz SZQLKGOGEVTREB-UHFFFAOYSA-N 1 2 245.370 2.145 20 0 BEADLO COc1cc(CCNc2ccc[nH+]c2C)ccn1 ZINC001169225711 969494560 /nfs/dbraw/zinc/49/45/60/969494560.db2.gz GMNZIBNFMVRZSD-UHFFFAOYSA-N 1 2 243.310 2.448 20 0 BEADLO Clc1ncc(C[N@@H+]2CC[C@H]3OCC[C@H]32)s1 ZINC001209463547 969519575 /nfs/dbraw/zinc/51/95/75/969519575.db2.gz RIVHNKJNFIJDJM-RKDXNWHRSA-N 1 2 244.747 2.160 20 0 BEADLO Clc1ncc(C[N@H+]2CC[C@H]3OCC[C@H]32)s1 ZINC001209463547 969519583 /nfs/dbraw/zinc/51/95/83/969519583.db2.gz RIVHNKJNFIJDJM-RKDXNWHRSA-N 1 2 244.747 2.160 20 0 BEADLO Fc1cccc(-c2nnc(Cc3c[nH]c[nH+]3)o2)c1 ZINC001254156189 969526798 /nfs/dbraw/zinc/52/67/98/969526798.db2.gz PVABUCXKJDAMEE-UHFFFAOYSA-N 1 2 244.229 2.190 20 0 BEADLO c1ncc(C[N@@H+]2CCc3cnccc3C2)s1 ZINC001209544695 969535753 /nfs/dbraw/zinc/53/57/53/969535753.db2.gz JSAQIWFPTPTSAL-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1ncc(C[N@H+]2CCc3cnccc3C2)s1 ZINC001209544695 969535759 /nfs/dbraw/zinc/53/57/59/969535759.db2.gz JSAQIWFPTPTSAL-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO Cc1n[nH]cc1C[N@@H+]1CCC(=O)[C@@H]2CCCC[C@@H]21 ZINC001209554908 969543390 /nfs/dbraw/zinc/54/33/90/969543390.db2.gz QQKKSUJUSBZCCN-OLZOCXBDSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1n[nH]cc1C[N@H+]1CCC(=O)[C@@H]2CCCC[C@@H]21 ZINC001209554908 969543395 /nfs/dbraw/zinc/54/33/95/969543395.db2.gz QQKKSUJUSBZCCN-OLZOCXBDSA-N 1 2 247.342 2.052 20 0 BEADLO O[C@@H]1CCC[C@H](Nc2ccn3cc[nH+]c3c2)C1 ZINC001169251673 969544343 /nfs/dbraw/zinc/54/43/43/969544343.db2.gz SNFGFKUANANVOQ-CMPLNLGQSA-N 1 2 231.299 2.050 20 0 BEADLO COc1cc(C[N@@H+]2CCc3occc3C2)ccn1 ZINC001209640525 969569648 /nfs/dbraw/zinc/56/96/48/969569648.db2.gz DZDDBKASUALUOB-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1cc(C[N@H+]2CCc3occc3C2)ccn1 ZINC001209640525 969569651 /nfs/dbraw/zinc/56/96/51/969569651.db2.gz DZDDBKASUALUOB-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO Fc1ccc2c(C[N@@H+]3CCC34COC4)c[nH]c2c1 ZINC001209691088 969574735 /nfs/dbraw/zinc/57/47/35/969574735.db2.gz CTUVAPIHVPPOFO-UHFFFAOYSA-N 1 2 246.285 2.282 20 0 BEADLO Fc1ccc2c(C[N@H+]3CCC34COC4)c[nH]c2c1 ZINC001209691088 969574740 /nfs/dbraw/zinc/57/47/40/969574740.db2.gz CTUVAPIHVPPOFO-UHFFFAOYSA-N 1 2 246.285 2.282 20 0 BEADLO Nc1ccc[nH+]c1Nc1ccc2c(c1)OCCN2 ZINC001209704877 969577042 /nfs/dbraw/zinc/57/70/42/969577042.db2.gz JWKBZPRJPJANJE-UHFFFAOYSA-N 1 2 242.282 2.212 20 0 BEADLO C[C@@H]1CC(=O)CC[N@@H+]1Cc1ccccc1N(C)C ZINC001209773931 969609384 /nfs/dbraw/zinc/60/93/84/969609384.db2.gz XEWOMYMFOJUDBX-GFCCVEGCSA-N 1 2 246.354 2.306 20 0 BEADLO C[C@@H]1CC(=O)CC[N@H+]1Cc1ccccc1N(C)C ZINC001209773931 969609393 /nfs/dbraw/zinc/60/93/93/969609393.db2.gz XEWOMYMFOJUDBX-GFCCVEGCSA-N 1 2 246.354 2.306 20 0 BEADLO COc1cncc(Nc2ccc3[nH]c[nH+]c3c2)n1 ZINC001209843051 969651172 /nfs/dbraw/zinc/65/11/72/969651172.db2.gz UOKWZYQYQJVNEN-UHFFFAOYSA-N 1 2 241.254 2.105 20 0 BEADLO Cc1cncnc1Nc1ccc2[nH]c[nH+]c2c1 ZINC001209848437 969661308 /nfs/dbraw/zinc/66/13/08/969661308.db2.gz LISLCEWOQCQLQN-UHFFFAOYSA-N 1 2 225.255 2.405 20 0 BEADLO C[NH+](C)Cc1nnc([C@H]2C[C@H]2c2ccccc2)o1 ZINC001254501734 969667944 /nfs/dbraw/zinc/66/79/44/969667944.db2.gz FKXWFAJPZUIMPS-RYUDHWBXSA-N 1 2 243.310 2.402 20 0 BEADLO C[NH+](C)Cc1nnc([C@@H]2C[C@H]2c2ccccc2)o1 ZINC001254501733 969668140 /nfs/dbraw/zinc/66/81/40/969668140.db2.gz FKXWFAJPZUIMPS-NWDGAFQWSA-N 1 2 243.310 2.402 20 0 BEADLO CNc1ccc(N[C@@H](C)c2cnccn2)c[nH+]1 ZINC001169533381 969728618 /nfs/dbraw/zinc/72/86/18/969728618.db2.gz MWZWFXIZBDYKDI-VIFPVBQESA-N 1 2 229.287 2.086 20 0 BEADLO CCCCC(=O)[C@H](C)Nc1ccc(N)[nH+]c1 ZINC001169547545 969741220 /nfs/dbraw/zinc/74/12/20/969741220.db2.gz MGPKHPBFEXQIIH-VIFPVBQESA-N 1 2 221.304 2.224 20 0 BEADLO CCOC(=O)C1(CNc2cccc[nH+]2)CCC1 ZINC001169553613 969742761 /nfs/dbraw/zinc/74/27/61/969742761.db2.gz VGTLNBHZRUTPHJ-UHFFFAOYSA-N 1 2 234.299 2.227 20 0 BEADLO Nc1cncc(Nc2ccc3c[nH+]ccc3c2)n1 ZINC001210044589 969773270 /nfs/dbraw/zinc/77/32/70/969773270.db2.gz BUIZWLCQZSKFTL-UHFFFAOYSA-N 1 2 237.266 2.351 20 0 BEADLO COc1nonc1Nc1ccc2c[nH+]ccc2c1 ZINC001210046487 969777492 /nfs/dbraw/zinc/77/74/92/969777492.db2.gz YZVKHSAYTCVEQY-UHFFFAOYSA-N 1 2 242.238 2.370 20 0 BEADLO C[C@H](C(=O)N1CC[C@@H](C)C(C)(C)C1)n1cc[nH+]c1 ZINC001254785272 969790419 /nfs/dbraw/zinc/79/04/19/969790419.db2.gz QXFALUWCTJQTPF-VXGBXAGGSA-N 1 2 249.358 2.339 20 0 BEADLO C[C@H](C(=O)N1CC[C@H](C)C(C)(C)C1)n1cc[nH+]c1 ZINC001254785270 969790955 /nfs/dbraw/zinc/79/09/55/969790955.db2.gz QXFALUWCTJQTPF-NWDGAFQWSA-N 1 2 249.358 2.339 20 0 BEADLO Cc1cc(N[C@H]2CCCOC2)[nH+]c2cc[nH]c21 ZINC001169667318 969805427 /nfs/dbraw/zinc/80/54/27/969805427.db2.gz IGXNXVHZHRKDQS-JTQLQIEISA-N 1 2 231.299 2.462 20 0 BEADLO C[C@@H]1CC[C@@H](OCC[NH+]2CCOCC2)C[C@H]1C ZINC001210209217 969832382 /nfs/dbraw/zinc/83/23/82/969832382.db2.gz YGUBQLAIHJLIDU-MGPQQGTHSA-N 1 2 241.375 2.160 20 0 BEADLO C[C@@H]1CC[C@H](OCC[NH+]2CCOCC2)C[C@H]1C ZINC001210209215 969833282 /nfs/dbraw/zinc/83/32/82/969833282.db2.gz YGUBQLAIHJLIDU-MCIONIFRSA-N 1 2 241.375 2.160 20 0 BEADLO Cc1c[nH+]cc(NCc2ncccc2O)c1C ZINC001169733351 969836541 /nfs/dbraw/zinc/83/65/41/969836541.db2.gz UTWDGZPTVWYULT-UHFFFAOYSA-N 1 2 229.283 2.411 20 0 BEADLO C[C@@H]1CCC[C@H](C)[C@H]1OCC[NH+]1CCOCC1 ZINC001210224754 969838066 /nfs/dbraw/zinc/83/80/66/969838066.db2.gz GNJJUVAAROANNU-WDNDVIMCSA-N 1 2 241.375 2.160 20 0 BEADLO Cc1[nH+]cc(Nc2ncncc2Cl)cc1N ZINC001210283943 969851646 /nfs/dbraw/zinc/85/16/46/969851646.db2.gz DECHZULGRXGAIG-UHFFFAOYSA-N 1 2 235.678 2.159 20 0 BEADLO F[C@@H]1C[NH+](C2Cc3ccccc3C2)C[C@H]1F ZINC001255020630 969851821 /nfs/dbraw/zinc/85/18/21/969851821.db2.gz XDKXMVVZNOXMJM-CHWSQXEVSA-N 1 2 223.266 2.146 20 0 BEADLO Cc1[nH+]cc(Nc2nccnc2Cl)cc1N ZINC001210285317 969852334 /nfs/dbraw/zinc/85/23/34/969852334.db2.gz OQKHKTOSRQTTQF-UHFFFAOYSA-N 1 2 235.678 2.159 20 0 BEADLO CC(=O)c1cccnc1Nc1c[nH+]c(C)c(N)c1 ZINC001210287102 969853941 /nfs/dbraw/zinc/85/39/41/969853941.db2.gz LUZWLTZOXLJDGH-UHFFFAOYSA-N 1 2 242.282 2.313 20 0 BEADLO Cc1cnc(Nc2c[nH+]c(C)c(N)c2)o1 ZINC001210286338 969855059 /nfs/dbraw/zinc/85/50/59/969855059.db2.gz ZYKWOQWMYHMXSN-UHFFFAOYSA-N 1 2 204.233 2.012 20 0 BEADLO COc1cc(Nc2c[nH+]c(C)c(N)c2)c(C)cn1 ZINC001210288334 969855937 /nfs/dbraw/zinc/85/59/37/969855937.db2.gz MPYGGTKLOJNRNS-UHFFFAOYSA-N 1 2 244.298 2.428 20 0 BEADLO Cc1[nH+]cc(Nc2cnccc2F)cc1N ZINC001210288764 969856401 /nfs/dbraw/zinc/85/64/01/969856401.db2.gz PAXLNWCRHXWXIA-UHFFFAOYSA-N 1 2 218.235 2.250 20 0 BEADLO COc1ccc(O)c(Nc2c[nH+]c(C)c(N)c2)c1 ZINC001210287974 969856421 /nfs/dbraw/zinc/85/64/21/969856421.db2.gz KGMFUUPOXZFFQR-UHFFFAOYSA-N 1 2 245.282 2.430 20 0 BEADLO Cc1[nH+]cc(Nc2cn(CC3CC3)cn2)cc1N ZINC001210288504 969856568 /nfs/dbraw/zinc/85/65/68/969856568.db2.gz KPWCFMRCDDKOMW-UHFFFAOYSA-N 1 2 243.314 2.322 20 0 BEADLO Cc1[nH+]cc(Nc2ccc(F)c(CO)c2)cc1N ZINC001210288139 969856576 /nfs/dbraw/zinc/85/65/76/969856576.db2.gz LTAHHMMFSHNHDX-UHFFFAOYSA-N 1 2 247.273 2.347 20 0 BEADLO Cc1[nH+]cc(N2CCc3cccc(N)c32)cc1N ZINC001210294488 969859604 /nfs/dbraw/zinc/85/96/04/969859604.db2.gz ZCKRKRCRJFKTFT-UHFFFAOYSA-N 1 2 240.310 2.249 20 0 BEADLO Cc1[nH+]cc(Nc2cc(N)ccc2F)cc1N ZINC001210290816 969860032 /nfs/dbraw/zinc/86/00/32/969860032.db2.gz POSHQDZGJLRCLX-UHFFFAOYSA-N 1 2 232.262 2.437 20 0 BEADLO COc1c(O)cccc1Nc1c[nH+]c(C)c(N)c1 ZINC001210294154 969860103 /nfs/dbraw/zinc/86/01/03/969860103.db2.gz TWOHXHWAABIXEF-UHFFFAOYSA-N 1 2 245.282 2.430 20 0 BEADLO Cc1c[nH+]cc(NC[C@@H]2COC(C)(C)O2)c1C ZINC001169910784 969882090 /nfs/dbraw/zinc/88/20/90/969882090.db2.gz SVNOCKBIDKTZFS-LLVKDONJSA-N 1 2 236.315 2.262 20 0 BEADLO CCOc1cc[nH+]cc1Nc1cncc(N)c1 ZINC001210437616 969888164 /nfs/dbraw/zinc/88/81/64/969888164.db2.gz LZHYAKMXXCDDCV-UHFFFAOYSA-N 1 2 230.271 2.201 20 0 BEADLO CC/C=C/CNC(=O)c1cccc2[nH+]ccn21 ZINC001129353964 969892389 /nfs/dbraw/zinc/89/23/89/969892389.db2.gz FQSAZDJLSWZYJR-ONEGZZNKSA-N 1 2 229.283 2.030 20 0 BEADLO Cc1ncc(-c2cccc3[nH+]ccn32)cc1N ZINC001242410978 969923171 /nfs/dbraw/zinc/92/31/71/969923171.db2.gz SAYNBGNRSSVNTI-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO Cc1c[nH+]c(Nc2cccc3c2OCO3)c(N)c1 ZINC001210557957 969941219 /nfs/dbraw/zinc/94/12/19/969941219.db2.gz ZDMLWECTRXTSDZ-UHFFFAOYSA-N 1 2 243.266 2.445 20 0 BEADLO COc1cc(Nc2nccnc2C)cc(C)[nH+]1 ZINC001210777428 970027784 /nfs/dbraw/zinc/02/77/84/970027784.db2.gz XTEMUZCSPJRWLJ-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO CCCOCCNc1cc(C)[nH+]c(SC)n1 ZINC001157080340 970078585 /nfs/dbraw/zinc/07/85/85/970078585.db2.gz UYUSWJVIDLAYMY-UHFFFAOYSA-N 1 2 241.360 2.345 20 0 BEADLO CCCOCCNc1cc(COC)cc[nH+]1 ZINC001157086564 970088018 /nfs/dbraw/zinc/08/80/18/970088018.db2.gz BJACBNXXMRUSEE-UHFFFAOYSA-N 1 2 224.304 2.067 20 0 BEADLO COCc1cncc(Nc2c[nH+]ccc2OC)c1 ZINC001211075691 970138313 /nfs/dbraw/zinc/13/83/13/970138313.db2.gz UBUQCIMMZRDHIN-UHFFFAOYSA-N 1 2 245.282 2.375 20 0 BEADLO CC1=CC(=N)[N@@H+](c2cc3ccccc3[nH]2)C=C1N ZINC001211307430 970229255 /nfs/dbraw/zinc/22/92/55/970229255.db2.gz WRPXPEVPYJYOKD-UHFFFAOYSA-N 1 2 238.294 2.329 20 0 BEADLO CC1=CC(=N)[N@H+](c2cc3ccccc3[nH]2)C=C1N ZINC001211307430 970229266 /nfs/dbraw/zinc/22/92/66/970229266.db2.gz WRPXPEVPYJYOKD-UHFFFAOYSA-N 1 2 238.294 2.329 20 0 BEADLO COC(=O)c1ccc(-c2c[nH+]cn2C)cc1F ZINC001243066479 970257283 /nfs/dbraw/zinc/25/72/83/970257283.db2.gz GOTBLNYUJQMNRD-UHFFFAOYSA-N 1 2 234.230 2.013 20 0 BEADLO Cc1cc2c(nccc2-c2c[nH+]cn2C)[nH]1 ZINC001243069507 970259982 /nfs/dbraw/zinc/25/99/82/970259982.db2.gz SQUPTWLXYMNTLO-UHFFFAOYSA-N 1 2 212.256 2.272 20 0 BEADLO CC(=O)Nc1cc(-c2c[nH+]cn2C)ccc1C ZINC001243070500 970268245 /nfs/dbraw/zinc/26/82/45/970268245.db2.gz GKNQNMNZZUGQKB-UHFFFAOYSA-N 1 2 229.283 2.354 20 0 BEADLO COc1cc(Nc2c[nH+]c(C)cc2C)no1 ZINC001213506007 970331359 /nfs/dbraw/zinc/33/13/59/970331359.db2.gz YDCADIGMKHMLET-UHFFFAOYSA-N 1 2 219.244 2.439 20 0 BEADLO Cc1cc(C)c(Nc2ncccc2N)c[nH+]1 ZINC001213505357 970333797 /nfs/dbraw/zinc/33/37/97/970333797.db2.gz CMSDIRIFJRMYIT-UHFFFAOYSA-N 1 2 214.272 2.419 20 0 BEADLO Cc1cc(C)c(Nc2ncccc2CO)c[nH+]1 ZINC001213508671 970334474 /nfs/dbraw/zinc/33/44/74/970334474.db2.gz YVIRTXXDGVEIAN-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO Cc1cc(C)c(Nc2ncccc2CCO)c[nH+]1 ZINC001213513620 970341180 /nfs/dbraw/zinc/34/11/80/970341180.db2.gz ZZKLYZNJXRGKDI-UHFFFAOYSA-N 1 2 243.310 2.372 20 0 BEADLO Cc1c[nH+]cc(Nc2nccnc2N(C)C)c1C ZINC001213524909 970345043 /nfs/dbraw/zinc/34/50/43/970345043.db2.gz JCVRNAPCYQRWQD-UHFFFAOYSA-N 1 2 243.314 2.298 20 0 BEADLO COCn1cc(Nc2c[nH+]cc(C)c2C)cn1 ZINC001213527704 970355305 /nfs/dbraw/zinc/35/53/05/970355305.db2.gz ZFEPLSXISHSQTJ-UHFFFAOYSA-N 1 2 232.287 2.242 20 0 BEADLO COC[C@@H](C)[N@@H+]1CCCCC(F)(F)C1 ZINC001255568687 970367170 /nfs/dbraw/zinc/36/71/70/970367170.db2.gz YIBWTLUOFOMKBK-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO COC[C@@H](C)[N@H+]1CCCCC(F)(F)C1 ZINC001255568687 970367182 /nfs/dbraw/zinc/36/71/82/970367182.db2.gz YIBWTLUOFOMKBK-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO C[C@H](CC(F)(F)F)[N@@H+]1CCOC[C@H]1C ZINC001255647520 970398277 /nfs/dbraw/zinc/39/82/77/970398277.db2.gz VRKYIKFSQXYEGE-HTQZYQBOSA-N 1 2 211.227 2.048 20 0 BEADLO C[C@H](CC(F)(F)F)[N@H+]1CCOC[C@H]1C ZINC001255647520 970398288 /nfs/dbraw/zinc/39/82/88/970398288.db2.gz VRKYIKFSQXYEGE-HTQZYQBOSA-N 1 2 211.227 2.048 20 0 BEADLO C[C@@H](CC(F)(F)F)[N@@H+]1CCOC[C@H]1C ZINC001255647521 970399353 /nfs/dbraw/zinc/39/93/53/970399353.db2.gz VRKYIKFSQXYEGE-JGVFFNPUSA-N 1 2 211.227 2.048 20 0 BEADLO C[C@@H](CC(F)(F)F)[N@H+]1CCOC[C@H]1C ZINC001255647521 970399362 /nfs/dbraw/zinc/39/93/62/970399362.db2.gz VRKYIKFSQXYEGE-JGVFFNPUSA-N 1 2 211.227 2.048 20 0 BEADLO Nc1ccc(F)cc1Nc1[nH+]cccc1N ZINC001214196588 970462797 /nfs/dbraw/zinc/46/27/97/970462797.db2.gz GCKCKRRHMBKVNJ-UHFFFAOYSA-N 1 2 218.235 2.129 20 0 BEADLO Cc1ccc(N(C)c2[nH+]cccc2N)c(CO)c1 ZINC001214448468 970498175 /nfs/dbraw/zinc/49/81/75/970498175.db2.gz DTYWVHSFJNHBJD-UHFFFAOYSA-N 1 2 243.310 2.232 20 0 BEADLO O=C1CC[N@H+](C2CCCCCC2)C[C@@H]1F ZINC001255892687 970558470 /nfs/dbraw/zinc/55/84/70/970558470.db2.gz RULREGRJABWOSJ-NSHDSACASA-N 1 2 213.296 2.322 20 0 BEADLO O=C1CC[N@@H+](C2CCCCCC2)C[C@@H]1F ZINC001255892687 970558482 /nfs/dbraw/zinc/55/84/82/970558482.db2.gz RULREGRJABWOSJ-NSHDSACASA-N 1 2 213.296 2.322 20 0 BEADLO CCCCCc1nnc(CCn2cc[nH+]c2)o1 ZINC001256085872 970653507 /nfs/dbraw/zinc/65/35/07/970653507.db2.gz PRKHRCGUWNQRMC-UHFFFAOYSA-N 1 2 234.303 2.242 20 0 BEADLO Cc1nc(C[NH2+][C@@H]2CCCc3n[nH]cc32)cs1 ZINC000401625730 970710370 /nfs/dbraw/zinc/71/03/70/970710370.db2.gz ACDCUPQQIWUFCX-LLVKDONJSA-N 1 2 248.355 2.342 20 0 BEADLO C[C@@H]1C[C@@H](Nc2ccc(N3CCCC3)[nH+]c2)CO1 ZINC000401805908 970731432 /nfs/dbraw/zinc/73/14/32/970731432.db2.gz BTSSTIPHQUYBOV-DGCLKSJQSA-N 1 2 247.342 2.271 20 0 BEADLO CC(C)(C)OCC[NH2+][C@@H]1CCCc2[nH]ncc21 ZINC000401958854 970748280 /nfs/dbraw/zinc/74/82/80/970748280.db2.gz YKXWGRALAUEXPV-LLVKDONJSA-N 1 2 237.347 2.192 20 0 BEADLO CCCC(C)(C)C(=O)NCCc1[nH]cc(C)[nH+]1 ZINC001144124059 972603072 /nfs/dbraw/zinc/60/30/72/972603072.db2.gz SDRWKMWBVGRYLI-UHFFFAOYSA-N 1 2 237.347 2.203 20 0 BEADLO CC[N@H+](C)Cc1n[nH]c2ccc(F)cc21 ZINC001144187052 972676277 /nfs/dbraw/zinc/67/62/77/972676277.db2.gz UCZHPLLFTFLXLW-UHFFFAOYSA-N 1 2 207.252 2.154 20 0 BEADLO C[NH+](C)Cc1nnc(CC(C)(C)C2CC2)o1 ZINC001327864344 972764617 /nfs/dbraw/zinc/76/46/17/972764617.db2.gz IRWHHHRUGUAFAG-UHFFFAOYSA-N 1 2 223.320 2.110 20 0 BEADLO O=C(Cc1cn2c([nH+]1)CCCC2)OCCC1CC1 ZINC000845476476 972828306 /nfs/dbraw/zinc/82/83/06/972828306.db2.gz KXQGBTHUMQMCAS-UHFFFAOYSA-N 1 2 248.326 2.105 20 0 BEADLO CC[N@H+](C)Cc1c(F)cc(O)cc1F ZINC001144542410 972860513 /nfs/dbraw/zinc/86/05/13/972860513.db2.gz WQMYXRPYNVDNQZ-UHFFFAOYSA-N 1 2 201.216 2.122 20 0 BEADLO CC[N@@H+](C)Cc1c(F)cc(O)cc1F ZINC001144542410 972860520 /nfs/dbraw/zinc/86/05/20/972860520.db2.gz WQMYXRPYNVDNQZ-UHFFFAOYSA-N 1 2 201.216 2.122 20 0 BEADLO Oc1cc(F)c(C[N@@H+]2C[C@@H]3C[C@@H]3C2)cc1F ZINC001144647449 972906113 /nfs/dbraw/zinc/90/61/13/972906113.db2.gz GCBYXOMSEZKEKP-OCAPTIKFSA-N 1 2 225.238 2.122 20 0 BEADLO Oc1cc(F)c(C[N@H+]2C[C@@H]3C[C@@H]3C2)cc1F ZINC001144647449 972906123 /nfs/dbraw/zinc/90/61/23/972906123.db2.gz GCBYXOMSEZKEKP-OCAPTIKFSA-N 1 2 225.238 2.122 20 0 BEADLO CCOC[C@H]1CCCC[N@@H+]1Cc1cc(C)[nH]n1 ZINC001328218763 972907356 /nfs/dbraw/zinc/90/73/56/972907356.db2.gz AUHZJNLBXJIQIJ-CYBMUJFWSA-N 1 2 237.347 2.109 20 0 BEADLO CCOC[C@H]1CCCC[N@H+]1Cc1cc(C)[nH]n1 ZINC001328218763 972907375 /nfs/dbraw/zinc/90/73/75/972907375.db2.gz AUHZJNLBXJIQIJ-CYBMUJFWSA-N 1 2 237.347 2.109 20 0 BEADLO C[N@H+](Cc1cc(F)c(O)cc1F)C1CC1 ZINC001144646696 972907422 /nfs/dbraw/zinc/90/74/22/972907422.db2.gz HCFDWCFXYLHBFT-UHFFFAOYSA-N 1 2 213.227 2.265 20 0 BEADLO C[N@@H+](Cc1cc(F)c(O)cc1F)C1CC1 ZINC001144646696 972907436 /nfs/dbraw/zinc/90/74/36/972907436.db2.gz HCFDWCFXYLHBFT-UHFFFAOYSA-N 1 2 213.227 2.265 20 0 BEADLO COc1c(F)ccc(F)c1C[NH+]1CC(C)C1 ZINC001144745261 972982615 /nfs/dbraw/zinc/98/26/15/972982615.db2.gz UVQAVGPSCYIYTK-UHFFFAOYSA-N 1 2 227.254 2.425 20 0 BEADLO Cc1cc(CO[C@H]2CCCOC2)cc(C)[nH+]1 ZINC001223419627 973050109 /nfs/dbraw/zinc/05/01/09/973050109.db2.gz GNLVXCSZXQYYKC-ZDUSSCGKSA-N 1 2 221.300 2.394 20 0 BEADLO Cc1ccc(Cc2nnc(C[NH+](C)C)o2)s1 ZINC001328432557 973051938 /nfs/dbraw/zinc/05/19/38/973051938.db2.gz DSIZYWYYLOXJBS-UHFFFAOYSA-N 1 2 237.328 2.092 20 0 BEADLO C=CC(=O)OC[C@@H](C)OCc1cc(C)[nH+]c(C)c1 ZINC001223418794 973052523 /nfs/dbraw/zinc/05/25/23/973052523.db2.gz AUHWDMZBMDFGNQ-GFCCVEGCSA-N 1 2 249.310 2.333 20 0 BEADLO Cc1cccc(C)c1C[N@@H+]1CCCC(=O)C1 ZINC000126205442 973077282 /nfs/dbraw/zinc/07/72/82/973077282.db2.gz COZGVROTZCFIKT-UHFFFAOYSA-N 1 2 217.312 2.468 20 0 BEADLO Cc1cccc(C)c1C[N@H+]1CCCC(=O)C1 ZINC000126205442 973077293 /nfs/dbraw/zinc/07/72/93/973077293.db2.gz COZGVROTZCFIKT-UHFFFAOYSA-N 1 2 217.312 2.468 20 0 BEADLO C[C@H]1C[C@H]([N@@H+]2CC[C@@H](N)C(F)(F)C2)C[C@@H](C)C1 ZINC001246837634 973143096 /nfs/dbraw/zinc/14/30/96/973143096.db2.gz RHMDZYPXUBKKNV-NOOOWODRSA-N 1 2 246.345 2.479 20 0 BEADLO C[C@H]1C[C@H]([N@H+]2CC[C@@H](N)C(F)(F)C2)C[C@@H](C)C1 ZINC001246837634 973143116 /nfs/dbraw/zinc/14/31/16/973143116.db2.gz RHMDZYPXUBKKNV-NOOOWODRSA-N 1 2 246.345 2.479 20 0 BEADLO CC(=O)C[N@H+]1CCC[C@H](c2cc(C(C)C)[nH]n2)C1 ZINC001330733395 1169959233 /nfs/dbraw/zinc/95/92/33/1169959233.db2.gz PVRXLGZVSCUHOK-LBPRGKRZSA-N 1 2 249.358 2.302 20 0 BEADLO CC(=O)C[N@@H+]1CCC[C@H](c2cc(C(C)C)[nH]n2)C1 ZINC001330733395 1169959237 /nfs/dbraw/zinc/95/92/37/1169959237.db2.gz PVRXLGZVSCUHOK-LBPRGKRZSA-N 1 2 249.358 2.302 20 0 BEADLO Cc1cnc(COC2C[NH+](C(C)C)C2)s1 ZINC001223859665 973309389 /nfs/dbraw/zinc/30/93/89/973309389.db2.gz KELTWKLQJCPNHP-UHFFFAOYSA-N 1 2 226.345 2.061 20 0 BEADLO CC(C)n1cc(Cn2c[nH+]c(C(C)(C)C)c2)nn1 ZINC001329271825 973620338 /nfs/dbraw/zinc/62/03/38/973620338.db2.gz DCPVQRSMWRCQAW-UHFFFAOYSA-N 1 2 247.346 2.401 20 0 BEADLO C[C@H](C(=O)NC[C@@H]1CCCC12CC2)n1cc[nH+]c1 ZINC001329280705 973637201 /nfs/dbraw/zinc/63/72/01/973637201.db2.gz JIIFIGMWYCHGGK-NEPJUHHUSA-N 1 2 247.342 2.141 20 0 BEADLO CC[C@@H]1CCCCN1c1cc(N(C)C)[nH+]cn1 ZINC000585415576 973911100 /nfs/dbraw/zinc/91/11/00/973911100.db2.gz XMSDFJBHUXFGQR-LLVKDONJSA-N 1 2 234.347 2.312 20 0 BEADLO CC[C@@H]1CCCCN1c1cc(N(C)C)nc[nH+]1 ZINC000585415576 973911113 /nfs/dbraw/zinc/91/11/13/973911113.db2.gz XMSDFJBHUXFGQR-LLVKDONJSA-N 1 2 234.347 2.312 20 0 BEADLO O=C1CC[NH+]([C@@H]2CCc3c(F)cccc3C2)CC1 ZINC001171423023 974033269 /nfs/dbraw/zinc/03/32/69/974033269.db2.gz WRLCSWMDPASMNL-GFCCVEGCSA-N 1 2 247.313 2.348 20 0 BEADLO O=C1CC[NH+]([C@H]2CCc3c(F)cccc3C2)CC1 ZINC001171423027 974035102 /nfs/dbraw/zinc/03/51/02/974035102.db2.gz WRLCSWMDPASMNL-LBPRGKRZSA-N 1 2 247.313 2.348 20 0 BEADLO CCOC(=[NH2+])CCCCOCC(=O)OC(C)C ZINC001224964323 974105973 /nfs/dbraw/zinc/10/59/73/974105973.db2.gz XAWQDJOJNYEOKY-UHFFFAOYSA-N 1 2 245.319 2.139 20 0 BEADLO C[NH+](C)Cc1nnc([C@@]2(C)CC=CCC2)o1 ZINC001330100307 974107686 /nfs/dbraw/zinc/10/76/86/974107686.db2.gz NOJXUZBSHAWPCP-LBPRGKRZSA-N 1 2 221.304 2.129 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+]1C[C@H]2CCCC[C@H]21 ZINC001171755913 974149944 /nfs/dbraw/zinc/14/99/44/974149944.db2.gz AGJRLCPKUOQOME-IQJOONFLSA-N 1 2 223.345 2.474 20 0 BEADLO C[C@@H](c1csnn1)[N@H+]1C[C@H]2CCCC[C@H]21 ZINC001171755913 974149948 /nfs/dbraw/zinc/14/99/48/974149948.db2.gz AGJRLCPKUOQOME-IQJOONFLSA-N 1 2 223.345 2.474 20 0 BEADLO C[C@@H]1CC(=O)CC[N@@H+]1[C@H]1Cc2cccc(F)c2C1 ZINC001171792659 974184134 /nfs/dbraw/zinc/18/41/34/974184134.db2.gz IDRYJYIHZSJRDE-PWSUYJOCSA-N 1 2 247.313 2.346 20 0 BEADLO C[C@@H]1CC(=O)CC[N@H+]1[C@H]1Cc2cccc(F)c2C1 ZINC001171792659 974184150 /nfs/dbraw/zinc/18/41/50/974184150.db2.gz IDRYJYIHZSJRDE-PWSUYJOCSA-N 1 2 247.313 2.346 20 0 BEADLO Fc1cccc2c1C[C@@H]([NH+]1CC3(C1)CCCO3)C2 ZINC001171797208 974193537 /nfs/dbraw/zinc/19/35/37/974193537.db2.gz UOMHVDLRGJMDBZ-LBPRGKRZSA-N 1 2 247.313 2.158 20 0 BEADLO CCc1ccc(C(C)(C)[NH2+]Cc2nnc[nH]2)cc1 ZINC001330560866 974312088 /nfs/dbraw/zinc/31/20/88/974312088.db2.gz ZJBRJXXJTAGECZ-UHFFFAOYSA-N 1 2 244.342 2.392 20 0 BEADLO C[C@H](O)[C@H](C)[NH2+]CC(F)(F)c1cccc(F)c1 ZINC001330608282 974360201 /nfs/dbraw/zinc/36/02/01/974360201.db2.gz FBRDAYHYFRFQSZ-IUCAKERBSA-N 1 2 247.260 2.276 20 0 BEADLO CCOC(=O)[C@@H]1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC001225295817 974371149 /nfs/dbraw/zinc/37/11/49/974371149.db2.gz NHRCEHWYGRHQAX-ZYHUDNBSSA-N 1 2 235.283 2.192 20 0 BEADLO COC(=O)[C@@H]1CCC[C@@H](Oc2cc[nH+]cc2)C1 ZINC001225295336 974371293 /nfs/dbraw/zinc/37/12/93/974371293.db2.gz KRDHEBHMYBHFHP-ZYHUDNBSSA-N 1 2 235.283 2.192 20 0 BEADLO c1cc(O[C@@H]2CCCC3(C2)OCCO3)cc[nH+]1 ZINC001225296212 974375198 /nfs/dbraw/zinc/37/51/98/974375198.db2.gz RAEAXIRYVDXWMP-GFCCVEGCSA-N 1 2 235.283 2.146 20 0 BEADLO C[C@@H]1CC[C@H]([N@@H+]2CCC(=O)[C@@H](F)C2)C[C@@H]1C ZINC001172374711 974573641 /nfs/dbraw/zinc/57/36/41/974573641.db2.gz AMBPSZKPZIFONI-RHYQMDGZSA-N 1 2 227.323 2.424 20 0 BEADLO C[C@@H]1CC[C@H]([N@H+]2CCC(=O)[C@@H](F)C2)C[C@@H]1C ZINC001172374711 974573648 /nfs/dbraw/zinc/57/36/48/974573648.db2.gz AMBPSZKPZIFONI-RHYQMDGZSA-N 1 2 227.323 2.424 20 0 BEADLO CC[NH+]1CC(Oc2cccc(C(F)(F)F)n2)C1 ZINC001225700549 974650592 /nfs/dbraw/zinc/65/05/92/974650592.db2.gz OTXRWKJUZVUGCH-UHFFFAOYSA-N 1 2 246.232 2.183 20 0 BEADLO Cc1c(Cl)cnn1C[N@@H+]1CCC[C@@H](CF)C1 ZINC001331478435 974736948 /nfs/dbraw/zinc/73/69/48/974736948.db2.gz QXWFIJPPLNHLDV-JTQLQIEISA-N 1 2 245.729 2.484 20 0 BEADLO Cc1c(Cl)cnn1C[N@H+]1CCC[C@@H](CF)C1 ZINC001331478435 974736955 /nfs/dbraw/zinc/73/69/55/974736955.db2.gz QXWFIJPPLNHLDV-JTQLQIEISA-N 1 2 245.729 2.484 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nnc[nH]2)[C@@H]1c1ccccc1 ZINC001331703344 974797175 /nfs/dbraw/zinc/79/71/75/974797175.db2.gz QZKFTRKANQSLEF-RISCZKNCSA-N 1 2 242.326 2.388 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nnc[nH]2)[C@@H]1c1ccccc1 ZINC001331703344 974797180 /nfs/dbraw/zinc/79/71/80/974797180.db2.gz QZKFTRKANQSLEF-RISCZKNCSA-N 1 2 242.326 2.388 20 0 BEADLO CCOC(=O)C[NH2+][C@@H](C)Cc1ccc(CC)cc1 ZINC001173244129 975080346 /nfs/dbraw/zinc/08/03/46/975080346.db2.gz MQOFLXDSCPVPKL-LBPRGKRZSA-N 1 2 249.354 2.333 20 0 BEADLO CCOC(=O)C1([NH2+][C@H]2CC[C@H](CC)C2)CC1 ZINC001173267371 975133424 /nfs/dbraw/zinc/13/34/24/975133424.db2.gz RHRJAGSBCJSORT-QWRGUYRKSA-N 1 2 225.332 2.250 20 0 BEADLO COc1cccc(C)c1OC1C[NH+](C(C)C)C1 ZINC001227165868 975301375 /nfs/dbraw/zinc/30/13/75/975301375.db2.gz SRRAHTUHSUDHHM-UHFFFAOYSA-N 1 2 235.327 2.475 20 0 BEADLO Cc1cc[nH+]c(C)c1O[C@@H]1CCOC[C@H]1F ZINC001227262675 975338402 /nfs/dbraw/zinc/33/84/02/975338402.db2.gz UVMSPBHYHWWNOZ-GHMZBOCLSA-N 1 2 225.263 2.204 20 0 BEADLO CCc1ncc(C[N@@H+]2CCO[C@](C)(CC)C2)o1 ZINC001332968471 975345449 /nfs/dbraw/zinc/34/54/49/975345449.db2.gz PIGBYLFZBORRFA-CYBMUJFWSA-N 1 2 238.331 2.238 20 0 BEADLO CCc1ncc(C[N@H+]2CCO[C@](C)(CC)C2)o1 ZINC001332968471 975345456 /nfs/dbraw/zinc/34/54/56/975345456.db2.gz PIGBYLFZBORRFA-CYBMUJFWSA-N 1 2 238.331 2.238 20 0 BEADLO CCC[C@@H](C[NH2+][C@@](C)(CCC)C(=O)OC)OC ZINC001332975751 975350023 /nfs/dbraw/zinc/35/00/23/975350023.db2.gz KPIOKYWZLXBGDS-AAEUAGOBSA-N 1 2 245.363 2.123 20 0 BEADLO CCC[C@H](C[NH2+][C@@](C)(CCC)C(=O)OC)OC ZINC001332975754 975350639 /nfs/dbraw/zinc/35/06/39/975350639.db2.gz KPIOKYWZLXBGDS-YPMHNXCESA-N 1 2 245.363 2.123 20 0 BEADLO CCn1ccc(C[N@H+](C)[C@@H](C)c2ncccn2)c1 ZINC001332981993 975357546 /nfs/dbraw/zinc/35/75/46/975357546.db2.gz LXOIXVBWRIXHPE-LBPRGKRZSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1ccc(C[N@@H+](C)[C@@H](C)c2ncccn2)c1 ZINC001332981993 975357552 /nfs/dbraw/zinc/35/75/52/975357552.db2.gz LXOIXVBWRIXHPE-LBPRGKRZSA-N 1 2 244.342 2.491 20 0 BEADLO COc1ccc(Nc2[nH+]cccc2CCO)cc1 ZINC001173804576 975687787 /nfs/dbraw/zinc/68/77/87/975687787.db2.gz HQMRHPDFOOHPKC-UHFFFAOYSA-N 1 2 244.294 2.369 20 0 BEADLO CC[NH+]1CC(Oc2cc(F)c(OC)c(F)c2)C1 ZINC001227870620 975753046 /nfs/dbraw/zinc/75/30/46/975753046.db2.gz HQEFJYPJHJYMKI-UHFFFAOYSA-N 1 2 243.253 2.056 20 0 BEADLO CN(CC1CC1)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001333458339 975792409 /nfs/dbraw/zinc/79/24/09/975792409.db2.gz NRDKJXQSNNPXMQ-UHFFFAOYSA-N 1 2 229.283 2.045 20 0 BEADLO Cc1cc(OC2C[NH+](C)C2)ccc1Cl ZINC001228068794 975888159 /nfs/dbraw/zinc/88/81/59/975888159.db2.gz OQMSFWZXRVSYNG-UHFFFAOYSA-N 1 2 211.692 2.341 20 0 BEADLO CCc1cc(N2CC[C@H](CF)C2)nc(CC)[nH+]1 ZINC001333831363 976107026 /nfs/dbraw/zinc/10/70/26/976107026.db2.gz DIEGWTXLJGRRPN-SNVBAGLBSA-N 1 2 237.322 2.397 20 0 BEADLO COc1ncc(Nc2c[nH+]c(C)cc2C)cn1 ZINC001174034106 976238033 /nfs/dbraw/zinc/23/80/33/976238033.db2.gz YXWQHHCOQGWHHG-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO Cc1cc[nH+]c(Nc2ccc(C(N)=O)cc2)c1 ZINC001174046845 976277805 /nfs/dbraw/zinc/27/78/05/976277805.db2.gz DXPNXHPTDNFNKR-UHFFFAOYSA-N 1 2 227.267 2.233 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)C[C@H]1CC=CCC1 ZINC001334112637 976311866 /nfs/dbraw/zinc/31/18/66/976311866.db2.gz ZRJWZMBQZXHNHC-STQMWFEESA-N 1 2 247.342 2.134 20 0 BEADLO CCc1cc(N2CC=CCC2)nc(CC)[nH+]1 ZINC001334198600 976366117 /nfs/dbraw/zinc/36/61/17/976366117.db2.gz PJOQRZVNHCYALR-UHFFFAOYSA-N 1 2 217.316 2.368 20 0 BEADLO Cc1n[nH]c(C)c1Nc1cccc2[nH+]ccn21 ZINC001174212921 976387432 /nfs/dbraw/zinc/38/74/32/976387432.db2.gz AAAMFQKCBVRKAO-UHFFFAOYSA-N 1 2 227.271 2.418 20 0 BEADLO c1n[nH]cc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001174294331 976471172 /nfs/dbraw/zinc/47/11/72/976471172.db2.gz BYMFGGYVNTWWLS-UHFFFAOYSA-N 1 2 229.287 2.149 20 0 BEADLO CC[NH+]1CC(Oc2ccc3cccc(F)c3n2)C1 ZINC001228747207 976480071 /nfs/dbraw/zinc/48/00/71/976480071.db2.gz JQTSANHZYWPBCJ-UHFFFAOYSA-N 1 2 246.285 2.457 20 0 BEADLO CC[NH+]1CC(Oc2cc(C)c(Cl)cn2)C1 ZINC001228745101 976480153 /nfs/dbraw/zinc/48/01/53/976480153.db2.gz IKMIQJAKSDYAMM-UHFFFAOYSA-N 1 2 226.707 2.126 20 0 BEADLO Cc1cn2c(cccc2Nc2cn(C)nc2C)[nH+]1 ZINC001174333212 976549204 /nfs/dbraw/zinc/54/92/04/976549204.db2.gz HPWZLHJIFAEVEU-UHFFFAOYSA-N 1 2 241.298 2.428 20 0 BEADLO Cc1nn(C)cc1Nc1ccc2c(c1)[nH+]cn2C ZINC001174337049 976559518 /nfs/dbraw/zinc/55/95/18/976559518.db2.gz KYVKRDQNEGPEQZ-UHFFFAOYSA-N 1 2 241.298 2.359 20 0 BEADLO Cc1cc[nH+]c(C)c1Nc1ccc(=O)n(C)c1 ZINC001174355608 976597411 /nfs/dbraw/zinc/59/74/11/976597411.db2.gz HPKMNUYFYDSKEB-UHFFFAOYSA-N 1 2 229.283 2.141 20 0 BEADLO Cc1cccc(Nc2ccc3ncnn3c2)[nH+]1 ZINC001174370959 976610927 /nfs/dbraw/zinc/61/09/27/976610927.db2.gz BLLXWKQXECWYJU-UHFFFAOYSA-N 1 2 225.255 2.176 20 0 BEADLO CCOc1cc(Nc2cncnc2)cc(C)[nH+]1 ZINC001174383448 976618997 /nfs/dbraw/zinc/61/89/97/976618997.db2.gz CRNPIGCZKMINCQ-UHFFFAOYSA-N 1 2 230.271 2.322 20 0 BEADLO Cc1cc(C)[nH+]c(Nc2cncnc2)c1 ZINC001174383942 976621367 /nfs/dbraw/zinc/62/13/67/976621367.db2.gz AMVKUDUJAWRUHW-UHFFFAOYSA-N 1 2 200.245 2.232 20 0 BEADLO c1c[nH+]c(N2CCCC2)c(Nc2cncnc2)c1 ZINC001174385323 976626758 /nfs/dbraw/zinc/62/67/58/976626758.db2.gz QLFVHOVMHNJVOL-UHFFFAOYSA-N 1 2 241.298 2.215 20 0 BEADLO O=c1cc(Nc2cc[nH+]c3[nH]ccc32)cc[nH]1 ZINC001174408927 976694053 /nfs/dbraw/zinc/69/40/53/976694053.db2.gz ALTIKNPNCAVKSE-UHFFFAOYSA-N 1 2 226.239 2.359 20 0 BEADLO C[NH+]1CC(Oc2nc3ccccc3n2C2CC2)C1 ZINC001229163148 976779496 /nfs/dbraw/zinc/77/94/96/976779496.db2.gz PZIRKSCIXMIUNE-UHFFFAOYSA-N 1 2 243.310 2.064 20 0 BEADLO CNC(=O)c1ccc(Nc2cc(C)cc[nH+]2)cc1 ZINC001174510021 976835416 /nfs/dbraw/zinc/83/54/16/976835416.db2.gz RMRXBOQOCMSIDU-UHFFFAOYSA-N 1 2 241.294 2.493 20 0 BEADLO COCCn1cc(Nc2ccc(C)[nH+]c2C)cn1 ZINC001174549313 976851771 /nfs/dbraw/zinc/85/17/71/976851771.db2.gz VBFDKUDHOWFYNJ-UHFFFAOYSA-N 1 2 246.314 2.285 20 0 BEADLO Cc1cc(O)ccc1Nc1[nH+]cccc1N ZINC001174559910 976874677 /nfs/dbraw/zinc/87/46/77/976874677.db2.gz YNEUQCJYIVFYBK-UHFFFAOYSA-N 1 2 215.256 2.421 20 0 BEADLO Cc1cc(NC2=CC=NC(Cl)C2=O)cc[nH+]1 ZINC001174653568 976937478 /nfs/dbraw/zinc/93/74/78/976937478.db2.gz RJNROIDQWZFKLT-UHFFFAOYSA-N 1 2 235.674 2.310 20 0 BEADLO CCn1cc(C[NH2+]C2(c3ccccc3)CC2)nn1 ZINC001354470027 1170011524 /nfs/dbraw/zinc/01/15/24/1170011524.db2.gz BJAJBZBFXCHVFU-UHFFFAOYSA-N 1 2 242.326 2.077 20 0 BEADLO Cc1cc2ccc(OC3C[NH+](C)C3)cc2[nH]1 ZINC001229826915 976997389 /nfs/dbraw/zinc/99/73/89/976997389.db2.gz VBZCOOFOPGUIDN-UHFFFAOYSA-N 1 2 216.284 2.169 20 0 BEADLO Cc1cc(Nc2cc(C)cc[nH+]2)n(C)n1 ZINC001174822740 977079067 /nfs/dbraw/zinc/07/90/67/977079067.db2.gz ZVBVQPIRXYLTOZ-UHFFFAOYSA-N 1 2 202.261 2.176 20 0 BEADLO C[C@@H](C(=O)NCC12CCC(CC1)C2)n1cc[nH+]c1 ZINC001335804150 977298768 /nfs/dbraw/zinc/29/87/68/977298768.db2.gz WGZDPUFMSLVNNS-DCBWTQNWSA-N 1 2 247.342 2.141 20 0 BEADLO Cc1cc(Nc2ccc(N(C)C)[nH+]c2)no1 ZINC001175337411 977382358 /nfs/dbraw/zinc/38/23/58/977382358.db2.gz GWCSFQKPXYDELR-UHFFFAOYSA-N 1 2 218.260 2.188 20 0 BEADLO CC[C@@H](COC)Oc1cc2c(cc1O)C=[NH+]CC2 ZINC001230920211 977382493 /nfs/dbraw/zinc/38/24/93/977382493.db2.gz KBDLIXIWBOQZHS-LBPRGKRZSA-N 1 2 249.310 2.171 20 0 BEADLO Oc1cc2c(cc1O[C@H]1C=CCC1)CC[NH+]=C2 ZINC001230921876 977383776 /nfs/dbraw/zinc/38/37/76/977383776.db2.gz USVIPKYWSNJVOB-LBPRGKRZSA-N 1 2 229.279 2.465 20 0 BEADLO CC[C@H](COC)Oc1cc2c(cc1O)C=[NH+]CC2 ZINC001230920210 977384330 /nfs/dbraw/zinc/38/43/30/977384330.db2.gz KBDLIXIWBOQZHS-GFCCVEGCSA-N 1 2 249.310 2.171 20 0 BEADLO CN(C)c1ccc(Nc2ncccc2F)c[nH+]1 ZINC001175339028 977386133 /nfs/dbraw/zinc/38/61/33/977386133.db2.gz ULHJDMHXIFGLSG-UHFFFAOYSA-N 1 2 232.262 2.425 20 0 BEADLO Cc1cc(O)c[nH+]c1Nc1ccc(CO)cc1 ZINC001175563546 977547401 /nfs/dbraw/zinc/54/74/01/977547401.db2.gz WOPXZTAAHXJNJU-UHFFFAOYSA-N 1 2 230.267 2.332 20 0 BEADLO C[N@H+](Cc1ccon1)Cc1c[nH]c2cccnc12 ZINC001231491368 977615478 /nfs/dbraw/zinc/61/54/78/977615478.db2.gz PBYKFBLQMCEMNX-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO C[N@@H+](Cc1ccon1)Cc1c[nH]c2cccnc12 ZINC001231491368 977615492 /nfs/dbraw/zinc/61/54/92/977615492.db2.gz PBYKFBLQMCEMNX-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO CCOc1ccc(C[N@@H+]2C[C@@H](C)[C@@H](F)C2)cn1 ZINC001231649285 977666255 /nfs/dbraw/zinc/66/62/55/977666255.db2.gz KUDHOKQWLJVGEB-PWSUYJOCSA-N 1 2 238.306 2.270 20 0 BEADLO CCOc1ccc(C[N@H+]2C[C@@H](C)[C@@H](F)C2)cn1 ZINC001231649285 977666263 /nfs/dbraw/zinc/66/62/63/977666263.db2.gz KUDHOKQWLJVGEB-PWSUYJOCSA-N 1 2 238.306 2.270 20 0 BEADLO CCc1ccc(N2CCC[C@@](C)(CO)C2)[nH+]c1 ZINC001336574740 977787617 /nfs/dbraw/zinc/78/76/17/977787617.db2.gz KYDJOASBYSVYTN-CQSZACIVSA-N 1 2 234.343 2.243 20 0 BEADLO C[C@@H]1CC(=O)CC[N@@H+]1Cc1ccc2c[nH]nc2c1 ZINC001231904999 977789109 /nfs/dbraw/zinc/78/91/09/977789109.db2.gz BSLMMZPVGDXMER-SNVBAGLBSA-N 1 2 243.310 2.116 20 0 BEADLO C[C@@H]1CC(=O)CC[N@H+]1Cc1ccc2c[nH]nc2c1 ZINC001231904999 977789114 /nfs/dbraw/zinc/78/91/14/977789114.db2.gz BSLMMZPVGDXMER-SNVBAGLBSA-N 1 2 243.310 2.116 20 0 BEADLO C[NH+](C)Cc1nc(Br)ccc1F ZINC001231945146 977811167 /nfs/dbraw/zinc/81/11/67/977811167.db2.gz HEEDQINFLDJAAV-UHFFFAOYSA-N 1 2 233.084 2.045 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@@H](F)C2)[nH+]1 ZINC001336617452 977814502 /nfs/dbraw/zinc/81/45/02/977814502.db2.gz SYLCRNVROWXZJF-SECBINFHSA-N 1 2 212.243 2.467 20 0 BEADLO COc1ccnc(C[N@@H+]2C[C@@H](F)C[C@H]2C)c1 ZINC001231966989 977815553 /nfs/dbraw/zinc/81/55/53/977815553.db2.gz OZYPMRITGNJJDV-ZJUUUORDSA-N 1 2 224.279 2.023 20 0 BEADLO Cc1ccccc1CCN(C)c1cc(N)nc[nH+]1 ZINC001336647078 977827347 /nfs/dbraw/zinc/82/73/47/977827347.db2.gz KKWMEVRIHJVXHS-UHFFFAOYSA-N 1 2 242.326 2.046 20 0 BEADLO CO[C@@H]1CCN(c2cc(F)cc(C)[nH+]2)C[C@H]1C ZINC001336649726 977830969 /nfs/dbraw/zinc/83/09/69/977830969.db2.gz WYMYMGAZDIJZNT-BXKDBHETSA-N 1 2 238.306 2.390 20 0 BEADLO C[N@H+](Cc1ccsc1)Cc1cncc(O)c1 ZINC001232042288 977838210 /nfs/dbraw/zinc/83/82/10/977838210.db2.gz QCTBWAPJCYJYOP-UHFFFAOYSA-N 1 2 234.324 2.481 20 0 BEADLO CC[N@H+](Cc1cncc(O)c1)Cc1ccccn1 ZINC001232045244 977870426 /nfs/dbraw/zinc/87/04/26/977870426.db2.gz SESOVKKFICBXCH-UHFFFAOYSA-N 1 2 243.310 2.204 20 0 BEADLO CC[N@@H+](Cc1cncc(O)c1)Cc1ccccn1 ZINC001232045244 977870427 /nfs/dbraw/zinc/87/04/27/977870427.db2.gz SESOVKKFICBXCH-UHFFFAOYSA-N 1 2 243.310 2.204 20 0 BEADLO Cc1[nH]c([C@H]2CCCN2Cc2ccno2)[nH+]c1C ZINC001176077293 977870541 /nfs/dbraw/zinc/87/05/41/977870541.db2.gz JUKIFYHFJOUXTH-GFCCVEGCSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1cc(F)cc(N2CCC([C@H](C)O)CC2)[nH+]1 ZINC001336706059 977872476 /nfs/dbraw/zinc/87/24/76/977872476.db2.gz QRSPEIGJMCDIPQ-JTQLQIEISA-N 1 2 238.306 2.126 20 0 BEADLO C[C@H]1C[NH+](Cc2cc3ccncc3[nH]2)C[C@H](C)O1 ZINC001232089107 977887875 /nfs/dbraw/zinc/88/78/75/977887875.db2.gz QIJRKUMTSJTTJB-QWRGUYRKSA-N 1 2 245.326 2.172 20 0 BEADLO Nc1cc(F)cc2c1ccn2-c1[nH]cc[nH+]1 ZINC001176085622 977890996 /nfs/dbraw/zinc/89/09/96/977890996.db2.gz MFIWNOOUUFNVJD-UHFFFAOYSA-N 1 2 216.219 2.075 20 0 BEADLO CCc1cc(N2CCC(F)(F)C2)nc(CC)[nH+]1 ZINC001336735711 977893973 /nfs/dbraw/zinc/89/39/73/977893973.db2.gz OILYSILQFVAHSV-UHFFFAOYSA-N 1 2 241.285 2.447 20 0 BEADLO Cc1scnc1C[N@H+](C)C[C@@H]1CCCCO1 ZINC001232203494 977922324 /nfs/dbraw/zinc/92/23/24/977922324.db2.gz DWJAMOBLUKIBKE-NSHDSACASA-N 1 2 240.372 2.452 20 0 BEADLO Cc1scnc1C[N@@H+](C)C[C@@H]1CCCCO1 ZINC001232203494 977922340 /nfs/dbraw/zinc/92/23/40/977922340.db2.gz DWJAMOBLUKIBKE-NSHDSACASA-N 1 2 240.372 2.452 20 0 BEADLO c1cc(N2CCCC2)[nH+]cc1NC1=CCOCC1 ZINC001176143903 977930342 /nfs/dbraw/zinc/93/03/42/977930342.db2.gz IZSSUFSADNOQMK-UHFFFAOYSA-N 1 2 245.326 2.398 20 0 BEADLO COc1cc[nH+]cc1Nc1ccccc1CO ZINC001176121381 977950748 /nfs/dbraw/zinc/95/07/48/977950748.db2.gz SOGRWMMIXZJKSH-UHFFFAOYSA-N 1 2 230.267 2.326 20 0 BEADLO COc1cc[nH+]cc1Nc1nccnc1Cl ZINC001176119246 977952632 /nfs/dbraw/zinc/95/26/32/977952632.db2.gz QCNBVUQFVMNWET-UHFFFAOYSA-N 1 2 236.662 2.277 20 0 BEADLO c1nnc(C[N@@H+]2CCC[C@@H](C3CCC3)CC2)[nH]1 ZINC001336808119 977973436 /nfs/dbraw/zinc/97/34/36/977973436.db2.gz NUWWAXLICGRTJX-GFCCVEGCSA-N 1 2 234.347 2.207 20 0 BEADLO c1nnc(C[N@H+]2CCC[C@@H](C3CCC3)CC2)[nH]1 ZINC001336808119 977973444 /nfs/dbraw/zinc/97/34/44/977973444.db2.gz NUWWAXLICGRTJX-GFCCVEGCSA-N 1 2 234.347 2.207 20 0 BEADLO O=C1CC[NH+](Cc2nccc3ccccc32)CC1 ZINC001232248055 977975672 /nfs/dbraw/zinc/97/56/72/977975672.db2.gz QCTZADHJGNYCBM-UHFFFAOYSA-N 1 2 240.306 2.400 20 0 BEADLO Cc1c[nH+]c(Nc2cnc(N(C)C)nc2)c(C)c1 ZINC001176328875 978023063 /nfs/dbraw/zinc/02/30/63/978023063.db2.gz FJJMIJPAJKGYHH-UHFFFAOYSA-N 1 2 243.314 2.298 20 0 BEADLO Cc1c(F)cc(C[NH+]2CC(C)(CO)C2)cc1F ZINC001232420252 978060338 /nfs/dbraw/zinc/06/03/38/978060338.db2.gz OREZXIICUJDHSZ-UHFFFAOYSA-N 1 2 241.281 2.087 20 0 BEADLO Cc1[nH]c(CN(C)Cc2ccsc2)c[nH+]1 ZINC001232463793 978108801 /nfs/dbraw/zinc/10/88/01/978108801.db2.gz NRLZAJUYOQXRMY-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO CCN(CC(C)(C)O)c1cc(F)cc(C)[nH+]1 ZINC001337034247 978136382 /nfs/dbraw/zinc/13/63/82/978136382.db2.gz MLGRCTJQYRCAJM-UHFFFAOYSA-N 1 2 226.295 2.126 20 0 BEADLO C[N@H+](Cc1cccnc1)Cc1cc(F)ccn1 ZINC001232489446 978139903 /nfs/dbraw/zinc/13/99/03/978139903.db2.gz CSSBYLCIIVEDKY-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[N@@H+](Cc1cccnc1)Cc1cc(F)ccn1 ZINC001232489446 978139907 /nfs/dbraw/zinc/13/99/07/978139907.db2.gz CSSBYLCIIVEDKY-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO CCc1ccc(C[NH+]2CC3(CCO3)C2)cc1 ZINC001204177720 978179319 /nfs/dbraw/zinc/17/93/19/978179319.db2.gz CCYCHCDVXCSCLH-UHFFFAOYSA-N 1 2 217.312 2.224 20 0 BEADLO Fc1nccc(Cl)c1C[NH+]1CCCC1 ZINC001232611840 978196899 /nfs/dbraw/zinc/19/68/99/978196899.db2.gz BYQGHGYXIZGFGN-UHFFFAOYSA-N 1 2 214.671 2.470 20 0 BEADLO COc1cccc(C)c1C[N@H+](C)C1(C)COC1 ZINC001232625065 978198643 /nfs/dbraw/zinc/19/86/43/978198643.db2.gz LBVFMOLHQFMVCJ-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO COc1cccc(C)c1C[N@@H+](C)C1(C)COC1 ZINC001232625065 978198649 /nfs/dbraw/zinc/19/86/49/978198649.db2.gz LBVFMOLHQFMVCJ-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)c1nccs1 ZINC001596386363 978210111 /nfs/dbraw/zinc/21/01/11/978210111.db2.gz YKAXFCUPEZSUKL-UHFFFAOYSA-N 1 2 244.279 2.043 20 0 BEADLO CCCOC1C[NH+](Cc2ccccc2NC)C1 ZINC001232670729 978224330 /nfs/dbraw/zinc/22/43/30/978224330.db2.gz GHSKKONACNBRLI-UHFFFAOYSA-N 1 2 234.343 2.339 20 0 BEADLO c1nc2cccc(C[N@@H+]3CCC34COC4)c2s1 ZINC001232732645 978249338 /nfs/dbraw/zinc/24/93/38/978249338.db2.gz JPPWFRJVSPUOFM-UHFFFAOYSA-N 1 2 246.335 2.271 20 0 BEADLO c1nc2cccc(C[N@H+]3CCC34COC4)c2s1 ZINC001232732645 978249344 /nfs/dbraw/zinc/24/93/44/978249344.db2.gz JPPWFRJVSPUOFM-UHFFFAOYSA-N 1 2 246.335 2.271 20 0 BEADLO CCc1[nH]c(CNC(=O)C2CCC=CCC2)c[nH+]1 ZINC001597258066 978306275 /nfs/dbraw/zinc/30/62/75/978306275.db2.gz SOULCOZBBMXIMA-UHFFFAOYSA-N 1 2 247.342 2.335 20 0 BEADLO CCc1[nH]cc(CNC(=O)C2CCC=CCC2)[nH+]1 ZINC001597258066 978306285 /nfs/dbraw/zinc/30/62/85/978306285.db2.gz SOULCOZBBMXIMA-UHFFFAOYSA-N 1 2 247.342 2.335 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H]2CCC[C@@H]3C[C@@H]32)c[nH+]1 ZINC001597258142 978308302 /nfs/dbraw/zinc/30/83/02/978308302.db2.gz WJPQQNOIQYNMIS-JLLWLGSASA-N 1 2 247.342 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H]2CCC[C@@H]3C[C@@H]32)[nH+]1 ZINC001597258142 978308312 /nfs/dbraw/zinc/30/83/12/978308312.db2.gz WJPQQNOIQYNMIS-JLLWLGSASA-N 1 2 247.342 2.025 20 0 BEADLO CCc1[nH]c(CNC(=O)c2ccsc2C)c[nH+]1 ZINC001597257305 978308590 /nfs/dbraw/zinc/30/85/90/978308590.db2.gz JEDBTKVMCQFNKN-UHFFFAOYSA-N 1 2 249.339 2.272 20 0 BEADLO CCc1[nH]cc(CNC(=O)c2ccsc2C)[nH+]1 ZINC001597257305 978308599 /nfs/dbraw/zinc/30/85/99/978308599.db2.gz JEDBTKVMCQFNKN-UHFFFAOYSA-N 1 2 249.339 2.272 20 0 BEADLO Oc1cc(F)c(C[NH+]2CCCC2)c(F)c1 ZINC000148989325 978313040 /nfs/dbraw/zinc/31/30/40/978313040.db2.gz DALJLSMJTLVAMW-UHFFFAOYSA-N 1 2 213.227 2.266 20 0 BEADLO Oc1c(F)ccc(C[N@@H+]2C[C@@H]3C[C@@H]3C2)c1F ZINC001232933899 978342075 /nfs/dbraw/zinc/34/20/75/978342075.db2.gz OFTGIYIAJUDOHY-DTORHVGOSA-N 1 2 225.238 2.122 20 0 BEADLO Oc1c(F)ccc(C[N@H+]2C[C@@H]3C[C@@H]3C2)c1F ZINC001232933899 978342083 /nfs/dbraw/zinc/34/20/83/978342083.db2.gz OFTGIYIAJUDOHY-DTORHVGOSA-N 1 2 225.238 2.122 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc3ncoc3c2)CCO1 ZINC001232938811 978345422 /nfs/dbraw/zinc/34/54/22/978345422.db2.gz ZUUFIOHPZZXCDE-SNVBAGLBSA-N 1 2 232.283 2.049 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc3ncoc3c2)CCO1 ZINC001232938811 978345434 /nfs/dbraw/zinc/34/54/34/978345434.db2.gz ZUUFIOHPZZXCDE-SNVBAGLBSA-N 1 2 232.283 2.049 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)C=Cc1ccco1 ZINC001597676473 978352536 /nfs/dbraw/zinc/35/25/36/978352536.db2.gz GHDKYICVXTVACT-WAYWQWQTSA-N 1 2 242.278 2.365 20 0 BEADLO c1nc2ccc(C[N@@H+]3CCOC4(CC4)C3)cc2o1 ZINC001232944192 978353083 /nfs/dbraw/zinc/35/30/83/978353083.db2.gz PLBZNQXKOWRNOI-UHFFFAOYSA-N 1 2 244.294 2.193 20 0 BEADLO c1nc2ccc(C[N@H+]3CCOC4(CC4)C3)cc2o1 ZINC001232944192 978353092 /nfs/dbraw/zinc/35/30/92/978353092.db2.gz PLBZNQXKOWRNOI-UHFFFAOYSA-N 1 2 244.294 2.193 20 0 BEADLO O=C(Cn1cc[nH+]c1)Nc1c[nH]c2ccccc12 ZINC001597761195 978365868 /nfs/dbraw/zinc/36/58/68/978365868.db2.gz ROGCOSBZAJYFSP-UHFFFAOYSA-N 1 2 240.266 2.003 20 0 BEADLO CC(C)=CC(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001597805566 978372717 /nfs/dbraw/zinc/37/27/17/978372717.db2.gz CFIJGEWIBGIMAS-UHFFFAOYSA-N 1 2 221.304 2.116 20 0 BEADLO CC(C)=CC(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001597805566 978372728 /nfs/dbraw/zinc/37/27/28/978372728.db2.gz CFIJGEWIBGIMAS-UHFFFAOYSA-N 1 2 221.304 2.116 20 0 BEADLO Cc1cc(C)c(C[N@H+](C2CC2)C2COC2)cn1 ZINC001233010239 978407856 /nfs/dbraw/zinc/40/78/56/978407856.db2.gz SSFYKMAFTKHTMD-UHFFFAOYSA-N 1 2 232.327 2.062 20 0 BEADLO Cc1cc(C)c(C[N@@H+](C2CC2)C2COC2)cn1 ZINC001233010239 978407868 /nfs/dbraw/zinc/40/78/68/978407868.db2.gz SSFYKMAFTKHTMD-UHFFFAOYSA-N 1 2 232.327 2.062 20 0 BEADLO Cc1cc(C)c(C[N@H+](C)Cc2ccncn2)cn1 ZINC001233009423 978409808 /nfs/dbraw/zinc/40/98/08/978409808.db2.gz UWWXRUAYQHMUPR-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cc(C)c(C[N@@H+](C)Cc2ccncn2)cn1 ZINC001233009423 978409814 /nfs/dbraw/zinc/40/98/14/978409814.db2.gz UWWXRUAYQHMUPR-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cccc(O)c2F)C[C@@H]1F ZINC001233049382 978440161 /nfs/dbraw/zinc/44/01/61/978440161.db2.gz DCUISJHBESXLJB-SCZZXKLOSA-N 1 2 227.254 2.321 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cccc(O)c2F)C[C@@H]1F ZINC001233049382 978440169 /nfs/dbraw/zinc/44/01/69/978440169.db2.gz DCUISJHBESXLJB-SCZZXKLOSA-N 1 2 227.254 2.321 20 0 BEADLO C[C@@H](CC(=O)N1CC[C@@H]1C(C)(C)C)n1cc[nH+]c1 ZINC001337663508 978441650 /nfs/dbraw/zinc/44/16/50/978441650.db2.gz ZIHMIEIAJPOOQS-NWDGAFQWSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(=O)[C@H](C)CC2)cnc1C ZINC001233156074 978478813 /nfs/dbraw/zinc/47/88/13/978478813.db2.gz HWUOUFVMAGHJDF-LLVKDONJSA-N 1 2 246.354 2.499 20 0 BEADLO Cc1cc(C[N@H+]2CCC(=O)[C@H](C)CC2)cnc1C ZINC001233156074 978478823 /nfs/dbraw/zinc/47/88/23/978478823.db2.gz HWUOUFVMAGHJDF-LLVKDONJSA-N 1 2 246.354 2.499 20 0 BEADLO CCc1ccc(N2CCC(CCO)CC2)[nH+]c1 ZINC001337769011 978489509 /nfs/dbraw/zinc/48/95/09/978489509.db2.gz NEXUGVWBMQZELM-UHFFFAOYSA-N 1 2 234.343 2.243 20 0 BEADLO C[C@H]1CCC[C@H](C)N1C(=O)CCc1[nH]cc[nH+]1 ZINC001177990003 978495820 /nfs/dbraw/zinc/49/58/20/978495820.db2.gz FSQZJQIMQBIDMA-QWRGUYRKSA-N 1 2 235.331 2.132 20 0 BEADLO CC(C)N(C(=O)[C@H]1CCc2[nH+]ccn2C1)C(C)C ZINC001178101549 978505273 /nfs/dbraw/zinc/50/52/73/978505273.db2.gz ZYBWEWIASBIDKJ-LBPRGKRZSA-N 1 2 249.358 2.091 20 0 BEADLO C[C@@H](C(=O)N[C@H]1CCC[C@@H](C)C1)n1cc[nH+]c1 ZINC001337861597 978532829 /nfs/dbraw/zinc/53/28/29/978532829.db2.gz CJIDSBXIVWVBEB-WOPDTQHZSA-N 1 2 235.331 2.139 20 0 BEADLO C[C@@H](C(=O)N[C@@H]1CCC[C@@H](C)C1)n1cc[nH+]c1 ZINC001337861595 978533039 /nfs/dbraw/zinc/53/30/39/978533039.db2.gz CJIDSBXIVWVBEB-GRYCIOLGSA-N 1 2 235.331 2.139 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3cnccc3C2)sn1 ZINC001233309576 978533916 /nfs/dbraw/zinc/53/39/16/978533916.db2.gz PSXPIGDOSYZVRF-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cc(C[N@H+]2CCc3cnccc3C2)sn1 ZINC001233309576 978533937 /nfs/dbraw/zinc/53/39/37/978533937.db2.gz PSXPIGDOSYZVRF-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cnsc1C[N@@H+]1CCC(=O)[C@H](C)CC1 ZINC001233318468 978548900 /nfs/dbraw/zinc/54/89/00/978548900.db2.gz DVIPRGZNWJPYGG-SECBINFHSA-N 1 2 238.356 2.253 20 0 BEADLO Cc1cnsc1C[N@H+]1CCC(=O)[C@H](C)CC1 ZINC001233318468 978548907 /nfs/dbraw/zinc/54/89/07/978548907.db2.gz DVIPRGZNWJPYGG-SECBINFHSA-N 1 2 238.356 2.253 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@H](CO)[C@@H]2C)[nH+]1 ZINC001337909544 978558991 /nfs/dbraw/zinc/55/89/91/978558991.db2.gz IIHUIOLGTDSXLT-WDEREUQCSA-N 1 2 238.306 2.126 20 0 BEADLO COc1cc(F)c(C[NH+]2CC=CC2)cc1F ZINC001233340888 978569238 /nfs/dbraw/zinc/56/92/38/978569238.db2.gz UKZFKYPMRFGVSI-UHFFFAOYSA-N 1 2 225.238 2.345 20 0 BEADLO Nc1cccc(CN2Cc3cccc(F)c3C2)[nH+]1 ZINC001233371642 978583318 /nfs/dbraw/zinc/58/33/18/978583318.db2.gz AHXBMYYMIGJEQG-UHFFFAOYSA-N 1 2 243.285 2.319 20 0 BEADLO C/C=C(C)/C=C/C(=O)NCCOc1cc[nH+]cc1 ZINC001178517414 978584054 /nfs/dbraw/zinc/58/40/54/978584054.db2.gz ZLWJQKMDQHNTBP-NPFHFJLZSA-N 1 2 246.310 2.099 20 0 BEADLO Nc1cc(F)c(F)cc1C[N@@H+]1CCC[C@@H]1CF ZINC001233382672 978594177 /nfs/dbraw/zinc/59/41/77/978594177.db2.gz DKVGKOJVKYTOLV-SECBINFHSA-N 1 2 244.260 2.481 20 0 BEADLO Nc1cc(F)c(F)cc1C[N@H+]1CCC[C@@H]1CF ZINC001233382672 978594184 /nfs/dbraw/zinc/59/41/84/978594184.db2.gz DKVGKOJVKYTOLV-SECBINFHSA-N 1 2 244.260 2.481 20 0 BEADLO CCc1[nH]c(CNC(=O)C23CCC(CC2)C3)c[nH+]1 ZINC001178669899 978605774 /nfs/dbraw/zinc/60/57/74/978605774.db2.gz QPNNUXVJWDIWEE-UHFFFAOYSA-N 1 2 247.342 2.169 20 0 BEADLO CCc1[nH]cc(CNC(=O)C23CCC(CC2)C3)[nH+]1 ZINC001178669899 978605778 /nfs/dbraw/zinc/60/57/78/978605778.db2.gz QPNNUXVJWDIWEE-UHFFFAOYSA-N 1 2 247.342 2.169 20 0 BEADLO CCc1ccc(O)c(OC2C[NH+](C(C)C)C2)c1 ZINC001233577744 978630228 /nfs/dbraw/zinc/63/02/28/978630228.db2.gz KCBRIPTXIBQMLU-UHFFFAOYSA-N 1 2 235.327 2.426 20 0 BEADLO Cc1[nH]c(CNc2cnn3ccccc23)[nH+]c1C ZINC001179266586 978683704 /nfs/dbraw/zinc/68/37/04/978683704.db2.gz RCYQZRZQACXJRX-UHFFFAOYSA-N 1 2 241.298 2.286 20 0 BEADLO Cc1cc(O[C@@H]2CCC[N@@H+](C)C2)cc2[nH]ncc21 ZINC001233739698 978684798 /nfs/dbraw/zinc/68/47/98/978684798.db2.gz RHLFABQKUUZAKS-LLVKDONJSA-N 1 2 245.326 2.344 20 0 BEADLO Cc1cc(O[C@@H]2CCC[N@H+](C)C2)cc2[nH]ncc21 ZINC001233739698 978684804 /nfs/dbraw/zinc/68/48/04/978684804.db2.gz RHLFABQKUUZAKS-LLVKDONJSA-N 1 2 245.326 2.344 20 0 BEADLO CC(C)Cc1c[nH+]c2c(c1)OCCN2C ZINC001249927009 978688173 /nfs/dbraw/zinc/68/81/73/978688173.db2.gz FYRIXNHVNBDIET-UHFFFAOYSA-N 1 2 206.289 2.109 20 0 BEADLO CC[C@@H](CO)Nc1cc(C)[nH+]c(C(C)(C)C)n1 ZINC000069697136 978747582 /nfs/dbraw/zinc/74/75/82/978747582.db2.gz HVJXLNADGRCKGC-JTQLQIEISA-N 1 2 237.347 2.265 20 0 BEADLO CC1(C)C[N@H+](Cc2nnc3n2CCCC3)C1(C)C ZINC001339329660 978837381 /nfs/dbraw/zinc/83/73/81/978837381.db2.gz FBOOELIAICOPBL-UHFFFAOYSA-N 1 2 248.374 2.235 20 0 BEADLO CC1(C)C[N@@H+](Cc2nnc3n2CCCC3)C1(C)C ZINC001339329660 978837383 /nfs/dbraw/zinc/83/73/83/978837383.db2.gz FBOOELIAICOPBL-UHFFFAOYSA-N 1 2 248.374 2.235 20 0 BEADLO CCOC(=[NH2+])c1ccc(O[C@@H](C)COC)cc1 ZINC001234584569 978865801 /nfs/dbraw/zinc/86/58/01/978865801.db2.gz FDVHXWQUZXFPII-JTQLQIEISA-N 1 2 237.299 2.462 20 0 BEADLO CCc1ccc(N2CCC[C@@H]2CC(=O)OC)[nH+]c1 ZINC001339629828 978881522 /nfs/dbraw/zinc/88/15/22/978881522.db2.gz VRVZIDUACZJKST-GFCCVEGCSA-N 1 2 248.326 2.176 20 0 BEADLO C[C@H]1CC[N@H+](Cc2ncc(F)cn2)[C@@H](C)C1 ZINC001235011785 978952325 /nfs/dbraw/zinc/95/23/25/978952325.db2.gz TVJSWZJZWLUZQW-UWVGGRQHSA-N 1 2 223.295 2.236 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2ncc(F)cn2)[C@@H](C)C1 ZINC001235011785 978952333 /nfs/dbraw/zinc/95/23/33/978952333.db2.gz TVJSWZJZWLUZQW-UWVGGRQHSA-N 1 2 223.295 2.236 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2ncc(F)cn2)[C@H](C)C1 ZINC001235011784 978953037 /nfs/dbraw/zinc/95/30/37/978953037.db2.gz TVJSWZJZWLUZQW-NXEZZACHSA-N 1 2 223.295 2.236 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2ncc(F)cn2)[C@H](C)C1 ZINC001235011784 978953039 /nfs/dbraw/zinc/95/30/39/978953039.db2.gz TVJSWZJZWLUZQW-NXEZZACHSA-N 1 2 223.295 2.236 20 0 BEADLO O=C(Nc1ccsc1)[C@H]1[NH2+]CCc2occc21 ZINC001340080057 978966585 /nfs/dbraw/zinc/96/65/85/978966585.db2.gz TXVVVUHUZHKWPC-NSHDSACASA-N 1 2 248.307 2.167 20 0 BEADLO CCc1cccc(C[N@H+]2CCOC[C@H]2CC)n1 ZINC001235262102 979012806 /nfs/dbraw/zinc/01/28/06/979012806.db2.gz WFCMIJPUFXLLRA-CQSZACIVSA-N 1 2 234.343 2.255 20 0 BEADLO CCc1cccc(C[N@@H+]2CCOC[C@H]2CC)n1 ZINC001235262102 979012812 /nfs/dbraw/zinc/01/28/12/979012812.db2.gz WFCMIJPUFXLLRA-CQSZACIVSA-N 1 2 234.343 2.255 20 0 BEADLO COc1cc(C[NH+]2CC3(CCC3)C2)c(F)cn1 ZINC001235311863 979021922 /nfs/dbraw/zinc/02/19/22/979021922.db2.gz LRNCGFQXLCMUKA-UHFFFAOYSA-N 1 2 236.290 2.215 20 0 BEADLO COc1cc(C[NH+]2CC(C)C2)cc(F)c1F ZINC001235434464 979047206 /nfs/dbraw/zinc/04/72/06/979047206.db2.gz KDVGYPFNYRMMPO-UHFFFAOYSA-N 1 2 227.254 2.425 20 0 BEADLO Cc1ccc(CC(=O)Nc2c(C)c[nH+]cc2C)o1 ZINC001340809728 979117590 /nfs/dbraw/zinc/11/75/90/979117590.db2.gz FMLHMAGPKWOLCA-UHFFFAOYSA-N 1 2 244.294 2.203 20 0 BEADLO COc1ncc(C[NH+]2CC(C)C2)cc1Cl ZINC001235696580 979125172 /nfs/dbraw/zinc/12/51/72/979125172.db2.gz GKQYPQLGSKPGDG-UHFFFAOYSA-N 1 2 226.707 2.195 20 0 BEADLO CC[C@@H]1C[NH2+]CCN1Cc1ccc(S)cc1 ZINC001235773506 979147695 /nfs/dbraw/zinc/14/76/95/979147695.db2.gz NYCWBLUGMOLJEI-GFCCVEGCSA-N 1 2 236.384 2.159 20 0 BEADLO Cc1ccc(Nc2ccnnc2)c(C)[nH+]1 ZINC001203367381 979199106 /nfs/dbraw/zinc/19/91/06/979199106.db2.gz KSWPETIGXBIZII-UHFFFAOYSA-N 1 2 200.245 2.232 20 0 BEADLO C[C@H](c1ncccn1)[N@@H+]1CCOCC2(CCC2)C1 ZINC001341095100 979233731 /nfs/dbraw/zinc/23/37/31/979233731.db2.gz UVJRIFBIVVKCBW-GFCCVEGCSA-N 1 2 247.342 2.040 20 0 BEADLO C[C@H](c1ncccn1)[N@H+]1CCOCC2(CCC2)C1 ZINC001341095100 979233743 /nfs/dbraw/zinc/23/37/43/979233743.db2.gz UVJRIFBIVVKCBW-GFCCVEGCSA-N 1 2 247.342 2.040 20 0 BEADLO C[C@@H]1C[NH2+]C[C@@H](C)N1Cc1ccc(S)cc1 ZINC001236101423 979388314 /nfs/dbraw/zinc/38/83/14/979388314.db2.gz BUXFSUXADCWEEL-GHMZBOCLSA-N 1 2 236.384 2.158 20 0 BEADLO C[N@H+](CCO)Cc1c(F)cc(Cl)cc1F ZINC001236254323 979472646 /nfs/dbraw/zinc/47/26/46/979472646.db2.gz XSQOIUIGFGBCHN-UHFFFAOYSA-N 1 2 235.661 2.042 20 0 BEADLO C[N@@H+](CCO)Cc1c(F)cc(Cl)cc1F ZINC001236254323 979472650 /nfs/dbraw/zinc/47/26/50/979472650.db2.gz XSQOIUIGFGBCHN-UHFFFAOYSA-N 1 2 235.661 2.042 20 0 BEADLO COc1nc(Cl)c(C[N@@H+]2CCC2(C)C)n1C ZINC001341568417 979474553 /nfs/dbraw/zinc/47/45/53/979474553.db2.gz WNKBNQCXIHNPSH-UHFFFAOYSA-N 1 2 243.738 2.066 20 0 BEADLO COc1nc(Cl)c(C[N@H+]2CCC2(C)C)n1C ZINC001341568417 979474562 /nfs/dbraw/zinc/47/45/62/979474562.db2.gz WNKBNQCXIHNPSH-UHFFFAOYSA-N 1 2 243.738 2.066 20 0 BEADLO CC[C@@H](Cc1nnc(C[NH+](C)C)o1)C(C)C ZINC001341627494 979497836 /nfs/dbraw/zinc/49/78/36/979497836.db2.gz OFSHYQNTOVGPOD-JTQLQIEISA-N 1 2 225.336 2.356 20 0 BEADLO COC(=O)Cc1ccc(-c2ccc(N)[nH+]c2)cc1 ZINC001236312967 979519410 /nfs/dbraw/zinc/51/94/10/979519410.db2.gz CQPAJMWDJMAPHM-UHFFFAOYSA-N 1 2 242.278 2.046 20 0 BEADLO CN1CCOc2cc(-c3ccc(N)[nH+]c3)ccc21 ZINC001236313186 979521396 /nfs/dbraw/zinc/52/13/96/979521396.db2.gz KTKHQYCVUXCRHW-UHFFFAOYSA-N 1 2 241.294 2.159 20 0 BEADLO COCOc1cc(-c2ccc(N)[nH+]c2)ccc1F ZINC001236318539 979534045 /nfs/dbraw/zinc/53/40/45/979534045.db2.gz STTNXDYPQKEKEE-UHFFFAOYSA-N 1 2 248.257 2.453 20 0 BEADLO Oc1cncc(-c2cc(-n3ccnc3)cc[nH+]2)c1 ZINC001236576781 979645601 /nfs/dbraw/zinc/64/56/01/979645601.db2.gz CATVVMVEERXUGE-UHFFFAOYSA-N 1 2 238.250 2.035 20 0 BEADLO Cc1cc(-c2cncc(O)c2)cn2cc[nH+]c12 ZINC001236582660 979662546 /nfs/dbraw/zinc/66/25/46/979662546.db2.gz LIDJPGBBVCPYQX-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)o1 ZINC001236593270 979674009 /nfs/dbraw/zinc/67/40/09/979674009.db2.gz ANLXWRPSGFOJLN-GARJFASQSA-N 1 2 224.279 2.081 20 0 BEADLO Cc1nc(C)c(C[N@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)o1 ZINC001236593270 979674016 /nfs/dbraw/zinc/67/40/16/979674016.db2.gz ANLXWRPSGFOJLN-GARJFASQSA-N 1 2 224.279 2.081 20 0 BEADLO F[C@H]1C[C@@H]2C[C@H]1C[N@@H+]2Cc1nccnc1Cl ZINC001236617480 979682124 /nfs/dbraw/zinc/68/21/24/979682124.db2.gz JDBCECDBVJFSSY-CIUDSAMLSA-N 1 2 241.697 2.062 20 0 BEADLO F[C@H]1C[C@@H]2C[C@H]1C[N@H+]2Cc1nccnc1Cl ZINC001236617480 979682130 /nfs/dbraw/zinc/68/21/30/979682130.db2.gz JDBCECDBVJFSSY-CIUDSAMLSA-N 1 2 241.697 2.062 20 0 BEADLO COCC1C[NH+](Cc2cc(Cl)cc(C)n2)C1 ZINC001236636067 979683466 /nfs/dbraw/zinc/68/34/66/979683466.db2.gz NPFBRGVNQZRITB-UHFFFAOYSA-N 1 2 240.734 2.122 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1cc(Cl)cc(C)n1 ZINC001236651965 979687700 /nfs/dbraw/zinc/68/77/00/979687700.db2.gz NFANTPGGSDNNAY-LBPRGKRZSA-N 1 2 240.734 2.264 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1cc(Cl)cc(C)n1 ZINC001236651965 979687706 /nfs/dbraw/zinc/68/77/06/979687706.db2.gz NFANTPGGSDNNAY-LBPRGKRZSA-N 1 2 240.734 2.264 20 0 BEADLO c1cc2c(cccc2C[NH+]2CC3(CCO3)C2)o1 ZINC001236741712 979724997 /nfs/dbraw/zinc/72/49/97/979724997.db2.gz ZYEAUYOPMIEVTN-UHFFFAOYSA-N 1 2 229.279 2.408 20 0 BEADLO Oc1cc2ccccc2c(C[NH+]2CCOCC2)c1 ZINC001237068899 979814235 /nfs/dbraw/zinc/81/42/35/979814235.db2.gz VMNLURNETHNONF-UHFFFAOYSA-N 1 2 243.306 2.378 20 0 BEADLO Cn1c[nH+]cc1COC(=O)C12CCC(CC1)CC2 ZINC001342724403 979879538 /nfs/dbraw/zinc/87/95/38/979879538.db2.gz GKOUYPYFMDXNCV-UHFFFAOYSA-N 1 2 248.326 2.434 20 0 BEADLO COc1c(C)cccc1C[NH+]1CC2(C1)CCCO2 ZINC001237501537 979917254 /nfs/dbraw/zinc/91/72/54/979917254.db2.gz SPFPBCUSKWSQIV-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO CCn1c[nH+]cc1CN1Cc2cnc(C)cc2C1 ZINC001237596785 979956484 /nfs/dbraw/zinc/95/64/84/979956484.db2.gz IEANSIFMHKFYOH-UHFFFAOYSA-N 1 2 242.326 2.122 20 0 BEADLO CN1CCOc2cc(CC3CCC3)c[nH+]c21 ZINC001250141633 979970491 /nfs/dbraw/zinc/97/04/91/979970491.db2.gz TUCSDPNQFBBPTP-UHFFFAOYSA-N 1 2 218.300 2.253 20 0 BEADLO Cc1coc(C[N@H+](C)CCOc2ccccc2)n1 ZINC001237644153 979992663 /nfs/dbraw/zinc/99/26/63/979992663.db2.gz JCAZIAZCPVVQSB-UHFFFAOYSA-N 1 2 246.310 2.494 20 0 BEADLO Cc1coc(C[N@@H+](C)CCOc2ccccc2)n1 ZINC001237644153 979992667 /nfs/dbraw/zinc/99/26/67/979992667.db2.gz JCAZIAZCPVVQSB-UHFFFAOYSA-N 1 2 246.310 2.494 20 0 BEADLO CCc1ncc(C[N@@H+]2CCCC23COC3)s1 ZINC001237826802 980073197 /nfs/dbraw/zinc/07/31/97/980073197.db2.gz MPCWZGBQPKSEBX-UHFFFAOYSA-N 1 2 238.356 2.070 20 0 BEADLO CCc1ncc(C[N@H+]2CCCC23COC3)s1 ZINC001237826802 980073202 /nfs/dbraw/zinc/07/32/02/980073202.db2.gz MPCWZGBQPKSEBX-UHFFFAOYSA-N 1 2 238.356 2.070 20 0 BEADLO COc1ccoc1C[N@@H+]1CCc2cnccc2C1 ZINC001237862502 980101213 /nfs/dbraw/zinc/10/12/13/980101213.db2.gz CDFAQIKTMOEIRH-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1ccoc1C[N@H+]1CCc2cnccc2C1 ZINC001237862502 980101216 /nfs/dbraw/zinc/10/12/16/980101216.db2.gz CDFAQIKTMOEIRH-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO CO[C@H]1CC[N@H+](Cc2cnc(F)cc2Cl)C1 ZINC001238019110 980123810 /nfs/dbraw/zinc/12/38/10/980123810.db2.gz ZOGJQOFZCMTSJJ-VIFPVBQESA-N 1 2 244.697 2.095 20 0 BEADLO CO[C@H]1CC[N@@H+](Cc2cnc(F)cc2Cl)C1 ZINC001238019110 980123816 /nfs/dbraw/zinc/12/38/16/980123816.db2.gz ZOGJQOFZCMTSJJ-VIFPVBQESA-N 1 2 244.697 2.095 20 0 BEADLO Cc1ccc(O)cc1C[N@H+]1CCC(=O)C[C@@H]1C ZINC001238096358 980145808 /nfs/dbraw/zinc/14/58/08/980145808.db2.gz RRGRWEYLQPDUQA-NSHDSACASA-N 1 2 233.311 2.254 20 0 BEADLO Cc1ccc(O)cc1C[N@@H+]1CCC(=O)C[C@@H]1C ZINC001238096358 980145816 /nfs/dbraw/zinc/14/58/16/980145816.db2.gz RRGRWEYLQPDUQA-NSHDSACASA-N 1 2 233.311 2.254 20 0 BEADLO Cc1ccc(O)cc1C[N@@H+]1CCOCC12CC2 ZINC001238102381 980152770 /nfs/dbraw/zinc/15/27/70/980152770.db2.gz HURJNBOTPSHJBC-UHFFFAOYSA-N 1 2 233.311 2.065 20 0 BEADLO Cc1ccc(O)cc1C[N@H+]1CCOCC12CC2 ZINC001238102381 980152773 /nfs/dbraw/zinc/15/27/73/980152773.db2.gz HURJNBOTPSHJBC-UHFFFAOYSA-N 1 2 233.311 2.065 20 0 BEADLO Cc1ccc(O)cc1C[N@H+](C)Cc1ccno1 ZINC001238108841 980160554 /nfs/dbraw/zinc/16/05/54/980160554.db2.gz FGCOBRCHCUWWDE-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO Cc1ccc(O)cc1C[N@@H+](C)Cc1ccno1 ZINC001238108841 980160570 /nfs/dbraw/zinc/16/05/70/980160570.db2.gz FGCOBRCHCUWWDE-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO Nc1ccnc(F)c1C[NH+]1CC2(C1)CCCC2 ZINC001238150949 980176296 /nfs/dbraw/zinc/17/62/96/980176296.db2.gz VSIYPBUTZLJULZ-UHFFFAOYSA-N 1 2 235.306 2.179 20 0 BEADLO C[N@H+](Cc1ccccc1)Cc1c(N)ccnc1F ZINC001238154949 980181235 /nfs/dbraw/zinc/18/12/35/980181235.db2.gz ZYGBEZLZLPKABJ-UHFFFAOYSA-N 1 2 245.301 2.435 20 0 BEADLO C[N@@H+](Cc1ccccc1)Cc1c(N)ccnc1F ZINC001238154949 980181239 /nfs/dbraw/zinc/18/12/39/980181239.db2.gz ZYGBEZLZLPKABJ-UHFFFAOYSA-N 1 2 245.301 2.435 20 0 BEADLO COc1cc(Nc2ccc(N)nc2F)cc(C)[nH+]1 ZINC001203613101 980202418 /nfs/dbraw/zinc/20/24/18/980202418.db2.gz OQYQTQPULRLQBT-UHFFFAOYSA-N 1 2 248.261 2.259 20 0 BEADLO c1ncc(C2CC2)cc1C[N@H+](C1CC1)C1COC1 ZINC001238186831 980217986 /nfs/dbraw/zinc/21/79/86/980217986.db2.gz DZZZAGCOJXRFEJ-UHFFFAOYSA-N 1 2 244.338 2.322 20 0 BEADLO c1ncc(C2CC2)cc1C[N@@H+](C1CC1)C1COC1 ZINC001238186831 980217996 /nfs/dbraw/zinc/21/79/96/980217996.db2.gz DZZZAGCOJXRFEJ-UHFFFAOYSA-N 1 2 244.338 2.322 20 0 BEADLO COc1cc(C[NH+]2CC(C)C2)c(Cl)cn1 ZINC001238358269 980243131 /nfs/dbraw/zinc/24/31/31/980243131.db2.gz BUCILFVWSRZNPO-UHFFFAOYSA-N 1 2 226.707 2.195 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2ccno2)c(C)c1 ZINC001238434362 980261166 /nfs/dbraw/zinc/26/11/66/980261166.db2.gz CMBTWGXXKOVIIM-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2ccno2)c(C)c1 ZINC001238434362 980261177 /nfs/dbraw/zinc/26/11/77/980261177.db2.gz CMBTWGXXKOVIIM-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@H](C)C2)cnc1C1CC1 ZINC001238619314 980300961 /nfs/dbraw/zinc/30/09/61/980300961.db2.gz GDNYBRWCMKARAI-GFCCVEGCSA-N 1 2 246.354 2.488 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@H](C)C2)cnc1C1CC1 ZINC001238619314 980300969 /nfs/dbraw/zinc/30/09/69/980300969.db2.gz GDNYBRWCMKARAI-GFCCVEGCSA-N 1 2 246.354 2.488 20 0 BEADLO Cc1cc(C[N@H+]2CCOC[C@H]2C)cnc1C1CC1 ZINC001238620842 980301651 /nfs/dbraw/zinc/30/16/51/980301651.db2.gz PROOHHAJDBLVIW-GFCCVEGCSA-N 1 2 246.354 2.488 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC[C@H]2C)cnc1C1CC1 ZINC001238620842 980301663 /nfs/dbraw/zinc/30/16/63/980301663.db2.gz PROOHHAJDBLVIW-GFCCVEGCSA-N 1 2 246.354 2.488 20 0 BEADLO COc1cc(C)c(C)cc1C[NH+]1CCN(C)CC1 ZINC001238760933 980319045 /nfs/dbraw/zinc/31/90/45/980319045.db2.gz YRSYRTNMORASAS-UHFFFAOYSA-N 1 2 248.370 2.059 20 0 BEADLO CC(C)(COC(=O)[C@H]1C[C@@H]1C1CC1)n1cc[nH+]c1 ZINC001344109568 980348431 /nfs/dbraw/zinc/34/84/31/980348431.db2.gz KVWDOROJBBXGPH-NEPJUHHUSA-N 1 2 248.326 2.208 20 0 BEADLO COC(C)(C)CNc1cc(N)cc(Cl)[nH+]1 ZINC000154989846 980426751 /nfs/dbraw/zinc/42/67/51/980426751.db2.gz MNIFAZYXIHAGCL-UHFFFAOYSA-N 1 2 229.711 2.154 20 0 BEADLO CC(C)(O)/C=C/c1cc[nH+]c(N2CCCC2)c1 ZINC001239151204 980467028 /nfs/dbraw/zinc/46/70/28/980467028.db2.gz MZAKKLFASNNQNL-FNORWQNLSA-N 1 2 232.327 2.466 20 0 BEADLO Cc1cc(/C=C/C(C)(C)O)c2[nH+]ccn2c1 ZINC001239156591 980467301 /nfs/dbraw/zinc/46/73/01/980467301.db2.gz ULLNNAILFRIYDU-SNAWJCMRSA-N 1 2 216.284 2.427 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2cnccn2)c1 ZINC001203654020 980476605 /nfs/dbraw/zinc/47/66/05/980476605.db2.gz AZSCAWHPBDLUIS-UHFFFAOYSA-N 1 2 200.245 2.232 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2cnn3cccnc23)c1 ZINC001203655838 980494167 /nfs/dbraw/zinc/49/41/67/980494167.db2.gz CVIZRKRMJCGSJG-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO CCC1(C(=O)OCCCc2c[nH+]cn2C)CC1 ZINC001345060795 980537936 /nfs/dbraw/zinc/53/79/36/980537936.db2.gz UVAKZIHDTPHARV-UHFFFAOYSA-N 1 2 236.315 2.086 20 0 BEADLO CN1CCOc2c1cn[nH+]c2-c1ccc(F)cc1 ZINC001239473485 980607733 /nfs/dbraw/zinc/60/77/33/980607733.db2.gz SYNJBVVNMFAULM-UHFFFAOYSA-N 1 2 245.257 2.111 20 0 BEADLO Cc1cc(C(=O)Nc2ccn3cc[nH+]c3c2)c[nH]1 ZINC001188188867 980615787 /nfs/dbraw/zinc/61/57/87/980615787.db2.gz GDNMBOYWCCROIZ-UHFFFAOYSA-N 1 2 240.266 2.223 20 0 BEADLO Cc1ccc(NC(=O)CCc2[nH+]ccn2C)cc1 ZINC001345490210 980618125 /nfs/dbraw/zinc/61/81/25/980618125.db2.gz ANSGAAVWIWDGBD-UHFFFAOYSA-N 1 2 243.310 2.300 20 0 BEADLO C[NH+](C)Cc1nnc(C2CC(C)(C)C2)o1 ZINC001345571503 980636204 /nfs/dbraw/zinc/63/62/04/980636204.db2.gz ZZQIXRLZMXMUSW-UHFFFAOYSA-N 1 2 209.293 2.035 20 0 BEADLO CC(=O)Nc1cccc(-c2ccc[nH+]c2N)c1 ZINC001239529777 980703246 /nfs/dbraw/zinc/70/32/46/980703246.db2.gz UJAYYWDZRVWBSS-UHFFFAOYSA-N 1 2 227.267 2.289 20 0 BEADLO C[C@@H](c1nnc(C[NH+](C)C)o1)C1CCCC1 ZINC001345942229 980714774 /nfs/dbraw/zinc/71/47/74/980714774.db2.gz YTUCJJCQCIVZKY-SECBINFHSA-N 1 2 223.320 2.425 20 0 BEADLO COc1cc(CCn2cc[nH+]c2)cc(F)c1F ZINC001250315554 980752806 /nfs/dbraw/zinc/75/28/06/980752806.db2.gz OOUZTCAGOPMORZ-UHFFFAOYSA-N 1 2 238.237 2.413 20 0 BEADLO OCc1ccc(CCn2cc[nH+]c2)cc1Cl ZINC001250319006 980756740 /nfs/dbraw/zinc/75/67/40/980756740.db2.gz OYHXYCAVZZTISG-UHFFFAOYSA-N 1 2 236.702 2.272 20 0 BEADLO C[C@@H](CC(=O)N1CC2CCC1CC2)n1cc[nH+]c1 ZINC001346165829 980772594 /nfs/dbraw/zinc/77/25/94/980772594.db2.gz NEVNFJLFMQMFMR-HIFPTAJRSA-N 1 2 247.342 2.235 20 0 BEADLO CCc1cn(C[C@@H]2CC(C)(C)CO2)c[nH+]1 ZINC001190103054 980845340 /nfs/dbraw/zinc/84/53/40/980845340.db2.gz FLZFVAOGPPVCCT-NSHDSACASA-N 1 2 208.305 2.261 20 0 BEADLO CC[N@H+](Cc1cccnc1)Cc1cncc(C)n1 ZINC001203170489 980858750 /nfs/dbraw/zinc/85/87/50/980858750.db2.gz KSPVVTFEYLOGAW-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO CC[N@@H+](Cc1cccnc1)Cc1cncc(C)n1 ZINC001203170489 980858754 /nfs/dbraw/zinc/85/87/54/980858754.db2.gz KSPVVTFEYLOGAW-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO CC(C)(COC(=O)C1(C)CCC1)n1cc[nH+]c1 ZINC001346608369 980869338 /nfs/dbraw/zinc/86/93/38/980869338.db2.gz IBVSMOMNINGUAN-UHFFFAOYSA-N 1 2 236.315 2.352 20 0 BEADLO NC(=O)c1ccccc1-c1ccn2cc[nH+]c2c1 ZINC001239762038 980902277 /nfs/dbraw/zinc/90/22/77/980902277.db2.gz HUSZPOWVWROQPF-UHFFFAOYSA-N 1 2 237.262 2.100 20 0 BEADLO Clc1ccc2c(c1)C[N@@H+](CCc1cn[nH]n1)C2 ZINC001347119054 980976881 /nfs/dbraw/zinc/97/68/81/980976881.db2.gz ATDDBXSYSQGNRW-UHFFFAOYSA-N 1 2 248.717 2.016 20 0 BEADLO Clc1ccc2c(c1)C[N@H+](CCc1cn[nH]n1)C2 ZINC001347119054 980976890 /nfs/dbraw/zinc/97/68/90/980976890.db2.gz ATDDBXSYSQGNRW-UHFFFAOYSA-N 1 2 248.717 2.016 20 0 BEADLO c1cn2ccc(Nc3cnoc3)cc2[nH+]1 ZINC001203236567 980990100 /nfs/dbraw/zinc/99/01/00/980990100.db2.gz CXEIAKNWKQHYGJ-UHFFFAOYSA-N 1 2 200.201 2.066 20 0 BEADLO COc1ncccc1-c1ccn2cc[nH+]c2c1 ZINC001239856968 980999022 /nfs/dbraw/zinc/99/90/22/980999022.db2.gz JJQQVVRNZCCEGG-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO CCCn1cc(-c2c[nH+]c3c(c2)CCCN3)cn1 ZINC001240133181 981136681 /nfs/dbraw/zinc/13/66/81/981136681.db2.gz FWMGEUOLFYMEKF-UHFFFAOYSA-N 1 2 242.326 2.356 20 0 BEADLO Cc1cc(C)c(-c2ccc3[nH+]ccn3c2)nn1 ZINC001240213473 981160926 /nfs/dbraw/zinc/16/09/26/981160926.db2.gz AXDWVJXIVRRRMH-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO COc1ncnc(-c2ccc3[nH+]ccn3c2)c1C ZINC001240213998 981161189 /nfs/dbraw/zinc/16/11/89/981161189.db2.gz IYGOCTOGQUCSTP-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO c1cn2cc(-c3cnc4cccnc4n3)ccc2[nH+]1 ZINC001240214200 981161591 /nfs/dbraw/zinc/16/15/91/981161591.db2.gz KXOUAKCQOBHIRO-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO Nc1cc(-c2ccc3[nH+]ccn3c2)ncc1F ZINC001240217000 981166467 /nfs/dbraw/zinc/16/64/67/981166467.db2.gz WTRPCNHEAASICH-UHFFFAOYSA-N 1 2 228.230 2.118 20 0 BEADLO CCOc1ncc(-c2ccc3[nH+]ccn3c2)cn1 ZINC001240219733 981167951 /nfs/dbraw/zinc/16/79/51/981167951.db2.gz SYEXJCRXICREHU-UHFFFAOYSA-N 1 2 240.266 2.190 20 0 BEADLO O=C1NCc2c1cccc2-c1ccc2[nH+]ccn2c1 ZINC001240217700 981168105 /nfs/dbraw/zinc/16/81/05/981168105.db2.gz MKOGNAZQIGAXNF-UHFFFAOYSA-N 1 2 249.273 2.245 20 0 BEADLO CN(C)c1cc(-c2ccc3[nH+]ccn3c2)ccn1 ZINC001240219849 981169728 /nfs/dbraw/zinc/16/97/28/981169728.db2.gz XLZXYXDBBGOYHN-UHFFFAOYSA-N 1 2 238.294 2.462 20 0 BEADLO Cc1cn2cc(-c3ccc4[nH+]ccn4c3)ncc2n1 ZINC001240219692 981170905 /nfs/dbraw/zinc/17/09/05/981170905.db2.gz ROBVYFWEDYAQKY-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO Cc1ccc(-c2ccn3cc(N)[nH+]c3c2)cn1 ZINC001240223492 981180897 /nfs/dbraw/zinc/18/08/97/981180897.db2.gz SLBOQXMBGIYBFP-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N(C)[C@H](C)C2CC2)c1 ZINC001347895273 981211587 /nfs/dbraw/zinc/21/15/87/981211587.db2.gz ZNSIUDOLUJMPBY-SNVBAGLBSA-N 1 2 248.326 2.032 20 0 BEADLO COc1cc(-c2ccn3cc[nH+]c3c2)ccn1 ZINC001240256662 981230122 /nfs/dbraw/zinc/23/01/22/981230122.db2.gz QUCWKHFFKAZONO-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO Cc1cn2cc(-c3cnn(C)c3)ccc2[nH+]1 ZINC001240295428 981246273 /nfs/dbraw/zinc/24/62/73/981246273.db2.gz SCKOCDJZAQAVEK-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO Cn1cc(-c2ccccc2Cn2cc[nH+]c2)cn1 ZINC001240296337 981248141 /nfs/dbraw/zinc/24/81/41/981248141.db2.gz LJBQXMXOYWQVQT-UHFFFAOYSA-N 1 2 238.294 2.332 20 0 BEADLO C[C@H](C(=O)N(C)C1CCC(C)CC1)n1cc[nH+]c1 ZINC000078871594 981271391 /nfs/dbraw/zinc/27/13/91/981271391.db2.gz APFYKXIPXMXWRA-OTTFEQOBSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@@H]1CN(c2cc(N)nc[nH+]2)[C@@H]2CCCC[C@@H]21 ZINC001348084414 981276468 /nfs/dbraw/zinc/27/64/68/981276468.db2.gz OJFIMZGRCOGLTM-GMTAPVOTSA-N 1 2 232.331 2.074 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc2cnn(C)c2c1 ZINC001240309317 981277522 /nfs/dbraw/zinc/27/75/22/981277522.db2.gz YZTRDQRDZQJMPT-DROBUMMNSA-N 1 2 213.284 2.449 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCC(=O)CC(C)(C)C1 ZINC001348122991 981291611 /nfs/dbraw/zinc/29/16/11/981291611.db2.gz QFASXPKJIXUVEA-UHFFFAOYSA-N 1 2 247.342 2.289 20 0 BEADLO Cn1cnc2ccc(-c3cc[nH+]c(N)c3)cc21 ZINC001240321841 981294253 /nfs/dbraw/zinc/29/42/53/981294253.db2.gz WOGZHSRMMHJRHY-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO Cc1cc(-c2ccc(=O)n(C)c2)cc(C)[nH+]1 ZINC001240333796 981304362 /nfs/dbraw/zinc/30/43/62/981304362.db2.gz ZCOZLZOQAIKNRG-UHFFFAOYSA-N 1 2 214.268 2.064 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1ccc2ncnn2c1 ZINC001240357685 981313484 /nfs/dbraw/zinc/31/34/84/981313484.db2.gz MZYHSBYMKDWKMH-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO CCc1ccc(N2CC[C@H](C(C)(C)O)C2)[nH+]c1 ZINC001348291694 981327111 /nfs/dbraw/zinc/32/71/11/981327111.db2.gz PYMJCHYGHOIRDR-LBPRGKRZSA-N 1 2 234.343 2.241 20 0 BEADLO COC(=[NH2+])c1cccc(-c2cncnc2)c1 ZINC001240376684 981328520 /nfs/dbraw/zinc/32/85/20/981328520.db2.gz CXRADZGSKBTCFE-UHFFFAOYSA-N 1 2 213.240 2.115 20 0 BEADLO Cc1c(-c2ccn3cc[nH+]c3c2)cnn1C ZINC001240380907 981337504 /nfs/dbraw/zinc/33/75/04/981337504.db2.gz LOAKHDKGXHXQOX-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO C[C@@H]1CCCC[C@@H]1NC(=O)CCc1[nH+]ccn1C ZINC001348423399 981360077 /nfs/dbraw/zinc/36/00/77/981360077.db2.gz CFVJINIKVAYPBF-NEPJUHHUSA-N 1 2 249.358 2.048 20 0 BEADLO COc1cc(C[NH2+]Cc2csnn2)ccc1C ZINC001348525481 981383304 /nfs/dbraw/zinc/38/33/04/981383304.db2.gz LUOGCGQENHSJRY-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO Cc1nn(C)c2ccc(-c3c[nH+]cn3C)cc12 ZINC001240453635 981389384 /nfs/dbraw/zinc/38/93/84/981389384.db2.gz RFZQATFJFYGMRN-UHFFFAOYSA-N 1 2 226.283 2.282 20 0 BEADLO Cc1cc2cc(-c3c[nH+]cn3C)cnc2[nH]1 ZINC001240482445 981410446 /nfs/dbraw/zinc/41/04/46/981410446.db2.gz XYETXMAXWYQYJL-UHFFFAOYSA-N 1 2 212.256 2.272 20 0 BEADLO c1cc2c(ncnc2-c2ccn3cc[nH+]c3c2)[nH]1 ZINC001240495862 981415583 /nfs/dbraw/zinc/41/55/83/981415583.db2.gz ABUACXGYTCSCCU-UHFFFAOYSA-N 1 2 235.250 2.224 20 0 BEADLO Cc1cncnc1-c1ccn2cc[nH+]c2c1 ZINC001240495980 981416176 /nfs/dbraw/zinc/41/61/76/981416176.db2.gz FFYKNBFUOKSKAI-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO CN(C)c1cccc(-c2ccn3cc[nH+]c3c2)n1 ZINC001240496908 981417291 /nfs/dbraw/zinc/41/72/91/981417291.db2.gz QYXNKSZEVXHUCB-UHFFFAOYSA-N 1 2 238.294 2.462 20 0 BEADLO Cc1cnc(-c2ccn3cc[nH+]c3c2)c(C)n1 ZINC001240497275 981417429 /nfs/dbraw/zinc/41/74/29/981417429.db2.gz UNCUDZLNXBGLGC-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO Cc1nc(-c2ccn3cc[nH+]c3c2)ncc1F ZINC001240497062 981417561 /nfs/dbraw/zinc/41/75/61/981417561.db2.gz XESJQQCDDQLXAX-UHFFFAOYSA-N 1 2 228.230 2.239 20 0 BEADLO c1cn2ccc(-c3cc4nccnc4cn3)cc2[nH+]1 ZINC001240496784 981417968 /nfs/dbraw/zinc/41/79/68/981417968.db2.gz SXVJAZRGJNVCFZ-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO c1cn2ccc(-c3ccc4nccnc4n3)cc2[nH+]1 ZINC001240497146 981418827 /nfs/dbraw/zinc/41/88/27/981418827.db2.gz ZJVHFLWEHRVUPV-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO COc1ncnc(-c2ccn3cc[nH+]c3c2)c1C ZINC001240497083 981419161 /nfs/dbraw/zinc/41/91/61/981419161.db2.gz XWONTDKFVZGSQT-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO Cc1cnc(-c2ccn3cc[nH+]c3c2)nc1C ZINC001240504027 981431075 /nfs/dbraw/zinc/43/10/75/981431075.db2.gz UVOQTMYJKKSCGP-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO c1cn2ccc(-c3cncc4nccnc43)cc2[nH+]1 ZINC001240510249 981433412 /nfs/dbraw/zinc/43/34/12/981433412.db2.gz FVCWCAWWKWMUAJ-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO Cc1cc(-c2ccn3cc[nH+]c3c2)cc(=O)o1 ZINC001240512118 981436492 /nfs/dbraw/zinc/43/64/92/981436492.db2.gz POTYWLGYDGKYJF-UHFFFAOYSA-N 1 2 226.235 2.263 20 0 BEADLO CN(C)c1ncccc1-c1ccn2cc[nH+]c2c1 ZINC001240512620 981438166 /nfs/dbraw/zinc/43/81/66/981438166.db2.gz WLDYLERLKQVQMQ-UHFFFAOYSA-N 1 2 238.294 2.462 20 0 BEADLO Cc1sccc1NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001348777482 981441742 /nfs/dbraw/zinc/44/17/42/981441742.db2.gz UBJIIWQJHUMGKZ-QMMMGPOBSA-N 1 2 235.312 2.453 20 0 BEADLO COC(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001193902230 981503771 /nfs/dbraw/zinc/50/37/71/981503771.db2.gz RBDLMWVIZKUPIE-UHFFFAOYSA-N 1 2 217.228 2.051 20 0 BEADLO COC(=O)Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001193903378 981506209 /nfs/dbraw/zinc/50/62/09/981506209.db2.gz ZFCSBSZECLRXOL-UHFFFAOYSA-N 1 2 231.255 2.110 20 0 BEADLO Cc1cc(O)ccc1-c1ccc[nH+]c1N ZINC001240643676 981538426 /nfs/dbraw/zinc/53/84/26/981538426.db2.gz MIEXCYYSRJFIFF-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO CCCCCCOC(=O)NCCn1cc[nH+]c1 ZINC001194156122 981581511 /nfs/dbraw/zinc/58/15/11/981581511.db2.gz LETISNJBUPKWHZ-UHFFFAOYSA-N 1 2 239.319 2.190 20 0 BEADLO CCn1nccc1-c1cc[nH+]c(NC)c1 ZINC001240710470 981684432 /nfs/dbraw/zinc/68/44/32/981684432.db2.gz MABDYJYVSBKASY-UHFFFAOYSA-N 1 2 202.261 2.007 20 0 BEADLO CCC=C(C)C(=O)Nc1c(C)c[nH+]cc1C ZINC001349791272 981742661 /nfs/dbraw/zinc/74/26/61/981742661.db2.gz GHDPTIYVQJTLOM-TWGQIWQCSA-N 1 2 218.300 2.415 20 0 BEADLO Cc1sccc1C(=O)Nc1cc[nH+]c(C)c1 ZINC001584004483 981850653 /nfs/dbraw/zinc/85/06/53/981850653.db2.gz DLIFNGCUYWKDNS-UHFFFAOYSA-N 1 2 232.308 2.434 20 0 BEADLO COc1cc(C)[nH+]cc1-c1cc(C)nn1C ZINC001240860002 981900937 /nfs/dbraw/zinc/90/09/37/981900937.db2.gz IGPHBLZANDRVFJ-UHFFFAOYSA-N 1 2 217.272 2.108 20 0 BEADLO C/C(Cl)=C/C(=O)Nc1ccc2[nH+]ccn2c1 ZINC001585377036 981924702 /nfs/dbraw/zinc/92/47/02/981924702.db2.gz YRIBVDUNFQHNFB-VURMDHGXSA-N 1 2 235.674 2.415 20 0 BEADLO c1cc2c[nH+]c(-c3cnn4cccnc34)cc2[nH]1 ZINC001240917861 981971846 /nfs/dbraw/zinc/97/18/46/981971846.db2.gz DSHBZGNZBYXARZ-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO C[C@@H](O)[C@@H](C)[NH2+]CC(F)(F)c1ccc(F)cc1 ZINC001350434907 981976430 /nfs/dbraw/zinc/97/64/30/981976430.db2.gz ZORYPNOILYDGOX-RKDXNWHRSA-N 1 2 247.260 2.276 20 0 BEADLO c1cn2ccc(-c3cnn4cccnc34)cc2[nH+]1 ZINC001240927976 981999102 /nfs/dbraw/zinc/99/91/02/981999102.db2.gz OQAACQNNCCKBCW-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO Cc1cn2c(cccc2-c2cnn3cccnc23)[nH+]1 ZINC001240927836 982000647 /nfs/dbraw/zinc/00/06/47/982000647.db2.gz MRXWIIABTVGEMH-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO c1cn2c(cccc2-c2cnn3cccnc23)[nH+]1 ZINC001240928548 982002521 /nfs/dbraw/zinc/00/25/21/982002521.db2.gz AHMXOBVJHWPMPS-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO Cc1c(F)cccc1NC(=O)Cc1c[nH]c[nH+]1 ZINC001586835880 982028391 /nfs/dbraw/zinc/02/83/91/982028391.db2.gz NEKKEGLCZYWIEI-UHFFFAOYSA-N 1 2 233.246 2.038 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)N1CCCC[C@H]1C1CCC1 ZINC001351044471 982184859 /nfs/dbraw/zinc/18/48/59/982184859.db2.gz OKFPSEXXOVAVPQ-LBPRGKRZSA-N 1 2 247.342 2.133 20 0 BEADLO CC[N@H+](Cc1nnc(OC)s1)C(C)(C)C ZINC001351456198 982318037 /nfs/dbraw/zinc/31/80/37/982318037.db2.gz HIKHPZNYTDQBAC-UHFFFAOYSA-N 1 2 229.349 2.167 20 0 BEADLO CC[N@@H+](Cc1nnc(OC)s1)C(C)(C)C ZINC001351456198 982318047 /nfs/dbraw/zinc/31/80/47/982318047.db2.gz HIKHPZNYTDQBAC-UHFFFAOYSA-N 1 2 229.349 2.167 20 0 BEADLO Nc1cc(-c2cc(F)c3nccnc3c2)cc[nH+]1 ZINC001241170317 982319250 /nfs/dbraw/zinc/31/92/50/982319250.db2.gz HQZCUNVSYGVVOM-UHFFFAOYSA-N 1 2 240.241 2.413 20 0 BEADLO Nc1cc(-c2ccc(OC(F)F)nc2)cc[nH+]1 ZINC001241170753 982320503 /nfs/dbraw/zinc/32/05/03/982320503.db2.gz QVQXRPVYXQKCFA-UHFFFAOYSA-N 1 2 237.209 2.327 20 0 BEADLO COCOc1cc(-c2cc[nH+]c(N)c2)ccc1F ZINC001241176313 982327919 /nfs/dbraw/zinc/32/79/19/982327919.db2.gz ZZGPUJYNRZWDPD-UHFFFAOYSA-N 1 2 248.257 2.453 20 0 BEADLO C[NH+](C)Cc1nnc([C@@H]2CCC2(C)C)o1 ZINC001351672443 982356185 /nfs/dbraw/zinc/35/61/85/982356185.db2.gz VQOVQNWAMIXNFG-QMMMGPOBSA-N 1 2 209.293 2.035 20 0 BEADLO Cc1cnc(-c2c[nH+]c(N(C)C)cc2C)c(N)c1 ZINC001241236007 982387180 /nfs/dbraw/zinc/38/71/80/982387180.db2.gz ZQVOVRJJLFKTJK-UHFFFAOYSA-N 1 2 242.326 2.409 20 0 BEADLO C[C@@H]1CCN(c2nccn3c[nH+]cc23)[C@H](C)C1 ZINC001352054648 982448022 /nfs/dbraw/zinc/44/80/22/982448022.db2.gz NRMGWZMJPLMEHS-GHMZBOCLSA-N 1 2 230.315 2.354 20 0 BEADLO C[N@H+]1CC=C(c2cc3nc[nH]c3cc2F)CC1 ZINC001241332996 982500373 /nfs/dbraw/zinc/50/03/73/982500373.db2.gz OMCIZNKYYMDVPF-UHFFFAOYSA-N 1 2 231.274 2.421 20 0 BEADLO C[N@@H+]1CC=C(c2cc3nc[nH]c3cc2F)CC1 ZINC001241332996 982500386 /nfs/dbraw/zinc/50/03/86/982500386.db2.gz OMCIZNKYYMDVPF-UHFFFAOYSA-N 1 2 231.274 2.421 20 0 BEADLO C[C@H]1[C@@H](O)CCC[N@@H+]1C/C(Cl)=C\Cl ZINC001197691765 982586439 /nfs/dbraw/zinc/58/64/39/982586439.db2.gz JQCVFKDFEPSIIH-IFPZVHCUSA-N 1 2 224.131 2.151 20 0 BEADLO C[C@H]1[C@@H](O)CCC[N@H+]1C/C(Cl)=C\Cl ZINC001197691765 982586449 /nfs/dbraw/zinc/58/64/49/982586449.db2.gz JQCVFKDFEPSIIH-IFPZVHCUSA-N 1 2 224.131 2.151 20 0 BEADLO Cc1cc(-c2ccc([S@@](C)=O)cc2)c[nH+]c1N ZINC001241485700 982639700 /nfs/dbraw/zinc/63/97/00/982639700.db2.gz JGDVBSHCYVHERG-QGZVFWFLSA-N 1 2 246.335 2.377 20 0 BEADLO Cc1cc(-c2ccc([S@](C)=O)cc2)c[nH+]c1N ZINC001241485699 982640142 /nfs/dbraw/zinc/64/01/42/982640142.db2.gz JGDVBSHCYVHERG-KRWDZBQOSA-N 1 2 246.335 2.377 20 0 BEADLO Cc1cc(-c2cccc(CO)c2)c[nH+]c1N ZINC001241510189 982668920 /nfs/dbraw/zinc/66/89/20/982668920.db2.gz GRQNDKWQRSALDB-UHFFFAOYSA-N 1 2 214.268 2.132 20 0 BEADLO CCCNc1cc(C)[nH+]c(-c2ccc(N)cc2)n1 ZINC001241537613 982706521 /nfs/dbraw/zinc/70/65/21/982706521.db2.gz AMLHWSDECWQCNS-UHFFFAOYSA-N 1 2 242.326 2.278 20 0 BEADLO Cc1cc2c[nH+]c(-c3ccc(N)cc3)nc2[nH]1 ZINC001241538145 982711669 /nfs/dbraw/zinc/71/16/69/982711669.db2.gz XTQCYIUXIYOKJF-UHFFFAOYSA-N 1 2 224.267 2.467 20 0 BEADLO Cc1cc(NC2CC2)nc(-c2ccc(N)cc2)[nH+]1 ZINC001241538117 982713799 /nfs/dbraw/zinc/71/37/99/982713799.db2.gz WLGLPIMFPSATNC-UHFFFAOYSA-N 1 2 240.310 2.030 20 0 BEADLO Cn1cc2ccc(-c3ccc[nH+]c3N)cc2n1 ZINC001241600907 982841303 /nfs/dbraw/zinc/84/13/03/982841303.db2.gz BASXCNQNVJJLPD-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO Cn1cc2cc(-c3ccc[nH+]c3N)ccc2n1 ZINC001241607742 982846508 /nfs/dbraw/zinc/84/65/08/982846508.db2.gz BYAUBVMXFGKKQE-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO CCNC(=O)c1ccc(-c2cc[nH+]c(N)c2)cc1 ZINC001241617069 982853091 /nfs/dbraw/zinc/85/30/91/982853091.db2.gz MUCXWGBWTZXOMN-UHFFFAOYSA-N 1 2 241.294 2.081 20 0 BEADLO Cc1n[nH]c2cc(-c3c[nH+]cn3C)ccc12 ZINC001241639859 982878670 /nfs/dbraw/zinc/87/86/70/982878670.db2.gz UWTYRYFWWNXMMY-UHFFFAOYSA-N 1 2 212.256 2.272 20 0 BEADLO Cc1cc(-c2cnc(C)nc2)c2[nH+]ccn2c1 ZINC001205860536 982908823 /nfs/dbraw/zinc/90/88/23/982908823.db2.gz QGQONCNOGXNCMA-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N[C@H]2C=CCCC2)c[nH+]1 ZINC001353625905 982937587 /nfs/dbraw/zinc/93/75/87/982937587.db2.gz BZROLXPTPPDOSE-LBPRGKRZSA-N 1 2 247.342 2.152 20 0 BEADLO COCCOc1ccc(-c2ccc[nH+]c2N)cc1 ZINC001241748528 983032487 /nfs/dbraw/zinc/03/24/87/983032487.db2.gz FDSCAJYFCWRPKE-UHFFFAOYSA-N 1 2 244.294 2.356 20 0 BEADLO CN(C)c1cc(-c2ccc(F)c(CO)c2)cc[nH+]1 ZINC001241788793 983048777 /nfs/dbraw/zinc/04/87/77/983048777.db2.gz BLJIQPYORAIWEQ-UHFFFAOYSA-N 1 2 246.285 2.446 20 0 BEADLO COc1cc[nH+]cc1NC[C@@H](O)c1ccccc1 ZINC001251979304 983066472 /nfs/dbraw/zinc/06/64/72/983066472.db2.gz GFEPIGKOMCXOHH-CYBMUJFWSA-N 1 2 244.294 2.236 20 0 BEADLO Nc1ccc(Nc2cnn3cc(F)ccc23)c[nH+]1 ZINC001201284171 983155716 /nfs/dbraw/zinc/15/57/16/983155716.db2.gz LWWKVORGFPZNGW-UHFFFAOYSA-N 1 2 243.245 2.194 20 0 BEADLO Cc1cc(F)nc(Nc2ccc(N)[nH+]c2)c1 ZINC001201283844 983156626 /nfs/dbraw/zinc/15/66/26/983156626.db2.gz HBZDOKNGHDVOCR-UHFFFAOYSA-N 1 2 218.235 2.250 20 0 BEADLO Nc1ccc(Nc2ncc(Cl)cc2N)c[nH+]1 ZINC001201279440 983156778 /nfs/dbraw/zinc/15/67/78/983156778.db2.gz WDKBIMYPYOJTMC-UHFFFAOYSA-N 1 2 235.678 2.038 20 0 BEADLO Nc1ccc(Nc2cn3ccccc3n2)c[nH+]1 ZINC001201280020 983157232 /nfs/dbraw/zinc/15/72/32/983157232.db2.gz XLHKDNRKXQBZMW-UHFFFAOYSA-N 1 2 225.255 2.055 20 0 BEADLO Nc1ccc(Nc2ccc3nsnc3c2)c[nH+]1 ZINC001201284110 983158648 /nfs/dbraw/zinc/15/86/48/983158648.db2.gz JOQJLBBDJIAORM-UHFFFAOYSA-N 1 2 243.295 2.412 20 0 BEADLO Nc1ccc(Nc2ccc3c(c2)COC3=O)c[nH+]1 ZINC001201286983 983163247 /nfs/dbraw/zinc/16/32/47/983163247.db2.gz MCLAOSBDAYBOHT-UHFFFAOYSA-N 1 2 241.250 2.078 20 0 BEADLO Nc1ccc(Nc2c(N)cc(F)cc2F)c[nH+]1 ZINC001201286865 983164885 /nfs/dbraw/zinc/16/48/85/983164885.db2.gz DZTDESMMMYKXFE-UHFFFAOYSA-N 1 2 236.225 2.268 20 0 BEADLO Cn1cnc2ccc(Nc3ccc(N)[nH+]c3)cc21 ZINC001201287081 983165384 /nfs/dbraw/zinc/16/53/84/983165384.db2.gz SAOPAMBRQFUPPP-UHFFFAOYSA-N 1 2 239.282 2.294 20 0 BEADLO Nc1ccc(Nc2ccc(F)c(F)c2O)c[nH+]1 ZINC001201291967 983168377 /nfs/dbraw/zinc/16/83/77/983168377.db2.gz RCOJVARKSFQKNE-UHFFFAOYSA-N 1 2 237.209 2.391 20 0 BEADLO Nc1ccc(Nc2cccc3nnsc32)c[nH+]1 ZINC001201291985 983169799 /nfs/dbraw/zinc/16/97/99/983169799.db2.gz RWUMMSATDFOFAS-UHFFFAOYSA-N 1 2 243.295 2.412 20 0 BEADLO CCc1ccc(N2CCC[C@@H]2C(C)(C)O)[nH+]c1 ZINC001354139871 983171323 /nfs/dbraw/zinc/17/13/23/983171323.db2.gz JYCNRYQHHAFHFW-GFCCVEGCSA-N 1 2 234.343 2.384 20 0 BEADLO Cc1noc(C)c1Nc1ccc(N)[nH+]c1 ZINC001201275976 983174966 /nfs/dbraw/zinc/17/49/66/983174966.db2.gz NRSNGJQSKSIDQY-UHFFFAOYSA-N 1 2 204.233 2.012 20 0 BEADLO Cc1cnc(Nc2ccc(N)[nH+]c2)c(Cl)n1 ZINC001201276600 983175611 /nfs/dbraw/zinc/17/56/11/983175611.db2.gz XHJWPDHQYLXWKA-UHFFFAOYSA-N 1 2 235.678 2.159 20 0 BEADLO COc1cncc(Nc2ccc(N)[nH+]c2)c1C ZINC001201276685 983176516 /nfs/dbraw/zinc/17/65/16/983176516.db2.gz ZODKGOPADYHUHS-UHFFFAOYSA-N 1 2 230.271 2.119 20 0 BEADLO Nc1cc2ccccc2n1-c1ccc(N)[nH+]c1 ZINC001201278174 983178395 /nfs/dbraw/zinc/17/83/95/983178395.db2.gz DEZZGCNQBMJXMU-UHFFFAOYSA-N 1 2 224.267 2.190 20 0 BEADLO Nc1ccc(Nc2cc(Cl)[nH]c(=O)c2)c[nH+]1 ZINC001201278751 983178915 /nfs/dbraw/zinc/17/89/15/983178915.db2.gz MZFCKVQLJDBXPL-UHFFFAOYSA-N 1 2 236.662 2.161 20 0 BEADLO Cc1cc2c(cccc2N)n1-c1ccc(N)[nH+]c1 ZINC001201294525 983181286 /nfs/dbraw/zinc/18/12/86/983181286.db2.gz CSPWGAGZPXMBSY-UHFFFAOYSA-N 1 2 238.294 2.498 20 0 BEADLO COC(OC)c1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001242020131 983227720 /nfs/dbraw/zinc/22/77/20/983227720.db2.gz QNEGKBBVCHXQBH-UHFFFAOYSA-N 1 2 218.256 2.368 20 0 BEADLO c1c[nH+]c(-c2ccc3c(c2)CCC32OCCO2)[nH]1 ZINC001242020112 983228816 /nfs/dbraw/zinc/22/88/16/983228816.db2.gz PQWZVSKOZYHFQJ-UHFFFAOYSA-N 1 2 242.278 2.223 20 0 BEADLO CC(C)(C)C[N@@H+]1CCC[C@@H](F)C(=O)C1 ZINC001201427265 983229341 /nfs/dbraw/zinc/22/93/41/983229341.db2.gz VVNDNILMYIUGSW-SECBINFHSA-N 1 2 201.285 2.036 20 0 BEADLO CC(C)(C)C[N@H+]1CCC[C@@H](F)C(=O)C1 ZINC001201427265 983229351 /nfs/dbraw/zinc/22/93/51/983229351.db2.gz VVNDNILMYIUGSW-SECBINFHSA-N 1 2 201.285 2.036 20 0 BEADLO CC(C)(C)C[N@@H+]1CC(F)(F)C[C@]1(C)CO ZINC001201433001 983230134 /nfs/dbraw/zinc/23/01/34/983230134.db2.gz OZVZJAPTIVKJNO-SNVBAGLBSA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)(C)C[N@H+]1CC(F)(F)C[C@]1(C)CO ZINC001201433001 983230141 /nfs/dbraw/zinc/23/01/41/983230141.db2.gz OZVZJAPTIVKJNO-SNVBAGLBSA-N 1 2 221.291 2.125 20 0 BEADLO C[C@H](C(=O)NC[C@]12C[C@H]1CCCC2)n1cc[nH+]c1 ZINC001354269561 983243116 /nfs/dbraw/zinc/24/31/16/983243116.db2.gz JQIKYWOJTYEEOO-BZPMIXESSA-N 1 2 247.342 2.141 20 0 BEADLO Cc1cn2c(cccc2-c2ccc(=O)[nH]c2)[nH+]1 ZINC001242063299 983280783 /nfs/dbraw/zinc/28/07/83/983280783.db2.gz LGQDYUBVUYWQCK-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO Cc1cc2c(ncnc2-c2c[nH+]c(N)cc2C)[nH]1 ZINC001242071070 983306158 /nfs/dbraw/zinc/30/61/58/983306158.db2.gz RTJOYXJREXEJBU-UHFFFAOYSA-N 1 2 239.282 2.219 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1ccc(OC(C)C)nn1 ZINC001242072279 983307448 /nfs/dbraw/zinc/30/74/48/983307448.db2.gz HEKGHVQGCKSDCJ-UHFFFAOYSA-N 1 2 244.298 2.216 20 0 BEADLO CSc1cnc(-c2c[nH+]c(N)cc2C)nc1 ZINC001242072845 983311458 /nfs/dbraw/zinc/31/14/58/983311458.db2.gz ROVBAVMFJDHUJF-UHFFFAOYSA-N 1 2 232.312 2.151 20 0 BEADLO CCC(CC)C[N@@H+]1C[C@H](F)C[C@H]1C(=O)OC ZINC001201523346 983322322 /nfs/dbraw/zinc/32/23/22/983322322.db2.gz IMYWMYNFHAUFSX-MNOVXSKESA-N 1 2 231.311 2.008 20 0 BEADLO CCC(CC)C[N@H+]1C[C@H](F)C[C@H]1C(=O)OC ZINC001201523346 983322326 /nfs/dbraw/zinc/32/23/26/983322326.db2.gz IMYWMYNFHAUFSX-MNOVXSKESA-N 1 2 231.311 2.008 20 0 BEADLO CCCC[C@H](O)CNc1c[nH+]ccc1OC ZINC001252078880 983331435 /nfs/dbraw/zinc/33/14/35/983331435.db2.gz CAHAMAJQFPJNEL-JTQLQIEISA-N 1 2 224.304 2.053 20 0 BEADLO Cc1noc(C)c1-c1ccn2cc(N)[nH+]c2c1 ZINC001242106105 983350734 /nfs/dbraw/zinc/35/07/34/983350734.db2.gz MYZAGGABPXYVTM-UHFFFAOYSA-N 1 2 228.255 2.188 20 0 BEADLO CC(C)CC[N@@H+]1CC(F)(F)CC[C@H]1CO ZINC001201613651 983378560 /nfs/dbraw/zinc/37/85/60/983378560.db2.gz XFFILJOXAPHARY-JTQLQIEISA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)CC[N@H+]1CC(F)(F)CC[C@H]1CO ZINC001201613651 983378567 /nfs/dbraw/zinc/37/85/67/983378567.db2.gz XFFILJOXAPHARY-JTQLQIEISA-N 1 2 221.291 2.125 20 0 BEADLO Nc1ccc(-c2ccc3c(c2)CCC3=O)c[nH+]1 ZINC001242157332 983386225 /nfs/dbraw/zinc/38/62/25/983386225.db2.gz ZOPBGPMCQQHFAJ-UHFFFAOYSA-N 1 2 224.263 2.460 20 0 BEADLO CCCCC[N@@H+]1CCCC(=O)[C@H](F)C1 ZINC001201725479 983430836 /nfs/dbraw/zinc/43/08/36/983430836.db2.gz OZEOHKZVDIWGQW-SNVBAGLBSA-N 1 2 201.285 2.180 20 0 BEADLO CCCCC[N@H+]1CCCC(=O)[C@H](F)C1 ZINC001201725479 983430839 /nfs/dbraw/zinc/43/08/39/983430839.db2.gz OZEOHKZVDIWGQW-SNVBAGLBSA-N 1 2 201.285 2.180 20 0 BEADLO CCc1cc(N[C@H](C)[C@@H]2CCOC2)nc(CC)[nH+]1 ZINC001355242597 983451542 /nfs/dbraw/zinc/45/15/42/983451542.db2.gz DKIRRCOLNMGXSZ-GHMZBOCLSA-N 1 2 249.358 2.438 20 0 BEADLO Cc1cc(-c2c[nH+]cn2C)ccc1N(C)C ZINC001242242408 983454463 /nfs/dbraw/zinc/45/44/63/983454463.db2.gz XFOYPIBUBKTYTK-UHFFFAOYSA-N 1 2 215.300 2.462 20 0 BEADLO CCCCCC[N@@H+]1Cc2cnn(C)c2C1 ZINC001201755225 983460764 /nfs/dbraw/zinc/46/07/64/983460764.db2.gz UTXCSIPXQPSUOA-UHFFFAOYSA-N 1 2 207.321 2.316 20 0 BEADLO CCCCCC[N@H+]1Cc2cnn(C)c2C1 ZINC001201755225 983460772 /nfs/dbraw/zinc/46/07/72/983460772.db2.gz UTXCSIPXQPSUOA-UHFFFAOYSA-N 1 2 207.321 2.316 20 0 BEADLO CC1(C)C[N@H+](CCC(F)(F)F)CCC1=O ZINC001202346632 983628932 /nfs/dbraw/zinc/62/89/32/983628932.db2.gz PUEFFYIRJNPHER-UHFFFAOYSA-N 1 2 223.238 2.240 20 0 BEADLO CC1(C)C[N@@H+](CCC(F)(F)F)CCC1=O ZINC001202346632 983628941 /nfs/dbraw/zinc/62/89/41/983628941.db2.gz PUEFFYIRJNPHER-UHFFFAOYSA-N 1 2 223.238 2.240 20 0 BEADLO FC1C[C@@H]2COC[C@H](C1)[N@@H+]2CCC(F)(F)F ZINC001202352826 983637766 /nfs/dbraw/zinc/63/77/66/983637766.db2.gz QLBRZXAPCOIDPK-CBLAIPOGSA-N 1 2 241.228 2.140 20 0 BEADLO FC1C[C@@H]2COC[C@H](C1)[N@H+]2CCC(F)(F)F ZINC001202352826 983637778 /nfs/dbraw/zinc/63/77/78/983637778.db2.gz QLBRZXAPCOIDPK-CBLAIPOGSA-N 1 2 241.228 2.140 20 0 BEADLO FC(F)(F)CCC[N@@H+]1CCOCC12CC2 ZINC001202433795 983674290 /nfs/dbraw/zinc/67/42/90/983674290.db2.gz VIRNGKKHIVHWGL-UHFFFAOYSA-N 1 2 223.238 2.194 20 0 BEADLO FC(F)(F)CCC[N@H+]1CCOCC12CC2 ZINC001202433795 983674300 /nfs/dbraw/zinc/67/43/00/983674300.db2.gz VIRNGKKHIVHWGL-UHFFFAOYSA-N 1 2 223.238 2.194 20 0 BEADLO CNc1cc(-c2cnc(C)c(N)c2)cc[nH+]1 ZINC001242412032 983725083 /nfs/dbraw/zinc/72/50/83/983725083.db2.gz ARBXKFBLTYLLSR-UHFFFAOYSA-N 1 2 214.272 2.076 20 0 BEADLO CNc1cc(-c2ccc(CO)c(F)c2)cc[nH+]1 ZINC001242533326 983854341 /nfs/dbraw/zinc/85/43/41/983854341.db2.gz HKSJWXNOFCVPOT-UHFFFAOYSA-N 1 2 232.258 2.422 20 0 BEADLO CCC[C@H](O)CNc1cccc(-n2cc[nH+]c2)c1 ZINC001252786478 983883870 /nfs/dbraw/zinc/88/38/70/983883870.db2.gz IATJWEKMPQTZIV-AWEZNQCLSA-N 1 2 245.326 2.445 20 0 BEADLO CC(C)Cc1ccc(N2CCOCC2)[nH+]c1 ZINC000150276609 983972022 /nfs/dbraw/zinc/97/20/22/983972022.db2.gz VWLBOUHESQPFBC-UHFFFAOYSA-N 1 2 220.316 2.117 20 0 BEADLO Cc1csc(C[N@@H+]2CCC23COC3)c1 ZINC001137156869 984000235 /nfs/dbraw/zinc/00/02/35/984000235.db2.gz BLARSOTUUUZFIL-UHFFFAOYSA-N 1 2 209.314 2.031 20 0 BEADLO Cc1csc(C[N@H+]2CCC23COC3)c1 ZINC001137156869 984000248 /nfs/dbraw/zinc/00/02/48/984000248.db2.gz BLARSOTUUUZFIL-UHFFFAOYSA-N 1 2 209.314 2.031 20 0 BEADLO CCOc1cc[nH+]cc1Nc1cccc(=O)[nH]1 ZINC001212787593 984020724 /nfs/dbraw/zinc/02/07/24/984020724.db2.gz IVUIPHBPBROYKS-UHFFFAOYSA-N 1 2 231.255 2.325 20 0 BEADLO CCCNC(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001202592726 984101397 /nfs/dbraw/zinc/10/13/97/984101397.db2.gz TVMZVOBPJZERLW-UHFFFAOYSA-N 1 2 244.298 2.404 20 0 BEADLO COc1cc(-c2c[nH+]c(N)c(C)c2)cc(C)n1 ZINC001242748083 984104551 /nfs/dbraw/zinc/10/45/51/984104551.db2.gz FQTLHKIXNDSYDN-UHFFFAOYSA-N 1 2 229.283 2.351 20 0 BEADLO COc1cc(-c2ccc[nH+]c2N)cc(C)n1 ZINC001242748125 984104825 /nfs/dbraw/zinc/10/48/25/984104825.db2.gz MDUQQLCTLBXXEP-UHFFFAOYSA-N 1 2 215.256 2.043 20 0 BEADLO Cc1nc2c(s1)C[N@H+](CC1CCOCC1)C2 ZINC001202610145 984126027 /nfs/dbraw/zinc/12/60/27/984126027.db2.gz WHHUERKSYRSCLI-UHFFFAOYSA-N 1 2 238.356 2.194 20 0 BEADLO Cc1nc2c(s1)C[N@@H+](CC1CCOCC1)C2 ZINC001202610145 984126031 /nfs/dbraw/zinc/12/60/31/984126031.db2.gz WHHUERKSYRSCLI-UHFFFAOYSA-N 1 2 238.356 2.194 20 0 BEADLO Nc1[nH+]cccc1-c1c[nH]c2ncccc12 ZINC001242861113 984200498 /nfs/dbraw/zinc/20/04/98/984200498.db2.gz RQOHRCFEOIMLHV-UHFFFAOYSA-N 1 2 210.240 2.207 20 0 BEADLO Cc1cc(C)c(NC(=O)[C@@H]2C[C@H]2F)c(C)[nH+]1 ZINC001434889429 984271271 /nfs/dbraw/zinc/27/12/71/984271271.db2.gz HFPFHHMTSGYGNP-NXEZZACHSA-N 1 2 222.263 2.303 20 0 BEADLO CS/C=C/C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001274961039 984418259 /nfs/dbraw/zinc/41/82/59/984418259.db2.gz GVPLOSYVJYSTLM-XVNBXDOJSA-N 1 2 233.296 2.150 20 0 BEADLO COc1ccc(-c2c[nH+]cn2C)c(C)c1OC ZINC001243067342 984483426 /nfs/dbraw/zinc/48/34/26/984483426.db2.gz JDQCIKOHTMZHGF-UHFFFAOYSA-N 1 2 232.283 2.413 20 0 BEADLO Cn1c[nH+]cc1-c1cccc(C2(C)OCCO2)c1 ZINC001243067930 984484785 /nfs/dbraw/zinc/48/47/85/984484785.db2.gz RBOLKGALQXDRIE-UHFFFAOYSA-N 1 2 244.294 2.307 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2c(c1)NC(=O)N(C)C2 ZINC001243070668 984492789 /nfs/dbraw/zinc/49/27/89/984492789.db2.gz VWMFQACEMLANNZ-UHFFFAOYSA-N 1 2 242.282 2.064 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2c(c1)NC(=S)C2 ZINC001243072439 984504096 /nfs/dbraw/zinc/50/40/96/984504096.db2.gz ORTAYYHLODTFGO-UHFFFAOYSA-N 1 2 229.308 2.383 20 0 BEADLO COc1cccc(-c2c[nH+]c(N)c(C)c2)n1 ZINC001243095211 984520900 /nfs/dbraw/zinc/52/09/00/984520900.db2.gz LZRMISJFRZUZJQ-UHFFFAOYSA-N 1 2 215.256 2.043 20 0 BEADLO COCOc1ccccc1-c1cc[nH+]c(N)c1 ZINC001243183699 984642822 /nfs/dbraw/zinc/64/28/22/984642822.db2.gz ZFHGHAPSORVWEQ-UHFFFAOYSA-N 1 2 230.267 2.314 20 0 BEADLO COCOc1ccc(-c2ccc[nH+]c2N)cc1 ZINC001243208473 984698546 /nfs/dbraw/zinc/69/85/46/984698546.db2.gz IPXFVWSZXUHXAO-UHFFFAOYSA-N 1 2 230.267 2.314 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1C(=O)Cc1[nH]c[nH+]c1C ZINC001446877975 984709768 /nfs/dbraw/zinc/70/97/68/984709768.db2.gz IGTRZEQNNWGYJP-GXSJLCMTSA-N 1 2 235.331 2.050 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)N[C@@H](C)c1cccs1 ZINC001447759545 984781989 /nfs/dbraw/zinc/78/19/89/984781989.db2.gz MTWHVRIBEJTKGK-UWVGGRQHSA-N 1 2 238.356 2.020 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)N[C@@H](C)c1cccs1 ZINC001447759545 984782020 /nfs/dbraw/zinc/78/20/20/984782020.db2.gz MTWHVRIBEJTKGK-UWVGGRQHSA-N 1 2 238.356 2.020 20 0 BEADLO COc1ccc(-c2c[nH+]c(N)c(C)c2)c(CO)c1 ZINC001243248955 984801653 /nfs/dbraw/zinc/80/16/53/984801653.db2.gz GLPSPECWIBVUKL-UHFFFAOYSA-N 1 2 244.294 2.140 20 0 BEADLO COc1ccc(/C(C)=C/C=C/[NH3+])c(CO)c1 ZINC001243248860 984801716 /nfs/dbraw/zinc/80/17/16/984801716.db2.gz MLOZILWHKJAJIO-DROBUMMNSA-N 1 2 219.284 2.063 20 0 BEADLO CNc1cc(-c2ccc(OC)cc2CO)cc[nH+]1 ZINC001243250197 984802209 /nfs/dbraw/zinc/80/22/09/984802209.db2.gz AHLIUILULRQLHT-UHFFFAOYSA-N 1 2 244.294 2.291 20 0 BEADLO CC[NH2+][C@@H](C)C(=O)OCc1sccc1Cl ZINC001577813913 984803359 /nfs/dbraw/zinc/80/33/59/984803359.db2.gz FQISUPZPYDMDLX-ZETCQYMHSA-N 1 2 247.747 2.443 20 0 BEADLO Cc1c(-c2ccc(CO)nc2)ccc2[nH+]ccn21 ZINC001243470512 985007666 /nfs/dbraw/zinc/00/76/66/985007666.db2.gz ZLLCFEZKMWINNM-UHFFFAOYSA-N 1 2 239.278 2.197 20 0 BEADLO Cc1cc(F)ncc1-c1ccc[nH+]c1N ZINC001243473160 985015678 /nfs/dbraw/zinc/01/56/78/985015678.db2.gz UHXMKULHZFVIIC-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO COC(=O)c1cc(-c2ccc[nH+]c2N)ccc1F ZINC001243472057 985019902 /nfs/dbraw/zinc/01/99/02/985019902.db2.gz BAAMJGVYXKDQDF-UHFFFAOYSA-N 1 2 246.241 2.257 20 0 BEADLO COC(=O)Cc1cccc(-c2ccc[nH+]c2N)c1 ZINC001243473507 985020797 /nfs/dbraw/zinc/02/07/97/985020797.db2.gz BPRJRMZRPXGUSH-UHFFFAOYSA-N 1 2 242.278 2.046 20 0 BEADLO C[N@H+](CCSC(F)(F)F)Cc1ncc[nH]1 ZINC000685979326 985020723 /nfs/dbraw/zinc/02/07/23/985020723.db2.gz QRUVOBTWTQLEIC-UHFFFAOYSA-N 1 2 239.266 2.095 20 0 BEADLO C[N@@H+](CCSC(F)(F)F)Cc1ncc[nH]1 ZINC000685979326 985020733 /nfs/dbraw/zinc/02/07/33/985020733.db2.gz QRUVOBTWTQLEIC-UHFFFAOYSA-N 1 2 239.266 2.095 20 0 BEADLO C[C@H]1c2ccc(-c3ccc[nH+]c3N)cc2NC1=O ZINC001243474004 985026387 /nfs/dbraw/zinc/02/63/87/985026387.db2.gz HIFIOFAMFAESLZ-QMMMGPOBSA-N 1 2 239.278 2.386 20 0 BEADLO Cc1ncc(-c2ccc[nH+]c2N)cc1F ZINC001243474557 985027789 /nfs/dbraw/zinc/02/77/89/985027789.db2.gz NSHXTDQBHILWFK-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO COC(=O)Cc1ccc(-c2ccc[nH+]c2N)cc1 ZINC001243475399 985028098 /nfs/dbraw/zinc/02/80/98/985028098.db2.gz YIJOGZZQMNRHGL-UHFFFAOYSA-N 1 2 242.278 2.046 20 0 BEADLO CCOc1ccc(-c2ccc[nH+]c2N)c(C)n1 ZINC001243476110 985028312 /nfs/dbraw/zinc/02/83/12/985028312.db2.gz OMIAOOQMWMSHKV-UHFFFAOYSA-N 1 2 229.283 2.433 20 0 BEADLO CCOc1ncc(-c2ccc[nH+]c2N)cc1C ZINC001243474897 985029776 /nfs/dbraw/zinc/02/97/76/985029776.db2.gz BESLFTHQWNURLE-UHFFFAOYSA-N 1 2 229.283 2.433 20 0 BEADLO COC(=O)c1cccc(C)c1-c1ccc[nH+]c1N ZINC001243475371 985031349 /nfs/dbraw/zinc/03/13/49/985031349.db2.gz XODDYILNVAEXMD-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO Nc1[nH+]cccc1-c1cc2[nH]cnc2c(F)c1 ZINC001243477178 985037076 /nfs/dbraw/zinc/03/70/76/985037076.db2.gz LBRYABZNHXUJBQ-UHFFFAOYSA-N 1 2 228.230 2.346 20 0 BEADLO Nc1[nH+]cccc1-c1cnc2c(c1)CN=N2 ZINC001243477213 985040313 /nfs/dbraw/zinc/04/03/13/985040313.db2.gz MUBWASJJRHFMRO-UHFFFAOYSA-N 1 2 211.228 2.323 20 0 BEADLO Cc1cc(N)c(F)cc1-c1ccc[nH+]c1N ZINC001243477984 985041834 /nfs/dbraw/zinc/04/18/34/985041834.db2.gz VODJPHQXAKJJKI-UHFFFAOYSA-N 1 2 217.247 2.361 20 0 BEADLO CCc1[nH]c(CNC(=O)/C=C2/CC[C@@H](C)C2)c[nH+]1 ZINC001456144738 985113055 /nfs/dbraw/zinc/11/30/55/985113055.db2.gz XPAVEMQICFXJHN-PAKSIRSJSA-N 1 2 247.342 2.335 20 0 BEADLO CCc1[nH]cc(CNC(=O)C=C2CC[C@@H](C)C2)[nH+]1 ZINC001456144738 985113074 /nfs/dbraw/zinc/11/30/74/985113074.db2.gz XPAVEMQICFXJHN-PAKSIRSJSA-N 1 2 247.342 2.335 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@H](C)C2CCCC2)c[nH+]1 ZINC001456144769 985113921 /nfs/dbraw/zinc/11/39/21/985113921.db2.gz XQPIBGRCLJZOHP-SNVBAGLBSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@H](C)C2CCCC2)[nH+]1 ZINC001456144769 985113924 /nfs/dbraw/zinc/11/39/24/985113924.db2.gz XQPIBGRCLJZOHP-SNVBAGLBSA-N 1 2 249.358 2.415 20 0 BEADLO CC/C(C)=C(\C)C(=O)NCc1c[nH+]c(CC)[nH]1 ZINC001456141481 985116239 /nfs/dbraw/zinc/11/62/39/985116239.db2.gz HZSZSGOGQGPHLE-MDZDMXLPSA-N 1 2 235.331 2.335 20 0 BEADLO CCC(C)=C(C)C(=O)NCc1c[nH]c(CC)[nH+]1 ZINC001456141481 985116243 /nfs/dbraw/zinc/11/62/43/985116243.db2.gz HZSZSGOGQGPHLE-MDZDMXLPSA-N 1 2 235.331 2.335 20 0 BEADLO CC1(CC(=O)NCc2[nH]c3c([nH+]2)CCCC3)CC1 ZINC001456237578 985129141 /nfs/dbraw/zinc/12/91/41/985129141.db2.gz DZPABDKRYXKTBF-UHFFFAOYSA-N 1 2 247.342 2.095 20 0 BEADLO CC[C@H](C)CC(=O)NCc1[nH]c2c([nH+]1)CCCC2 ZINC001456240385 985130290 /nfs/dbraw/zinc/13/02/90/985130290.db2.gz PXQNYUSECUCEGI-JTQLQIEISA-N 1 2 249.358 2.341 20 0 BEADLO Cc1cc(C(=O)N(C)C)ccc1-c1c[nH+]cn1C ZINC001243681904 985197714 /nfs/dbraw/zinc/19/77/14/985197714.db2.gz WKCKEAJILWXKBF-UHFFFAOYSA-N 1 2 243.310 2.097 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cc(F)cc(CO)c1 ZINC001243695888 985222874 /nfs/dbraw/zinc/22/28/74/985222874.db2.gz SBVRRSFJSHRSEY-QIAUARBPSA-N 1 2 207.248 2.194 20 0 BEADLO Cc1cc(-c2cc(F)cc(CO)c2)c[nH+]c1N ZINC001243699197 985234095 /nfs/dbraw/zinc/23/40/95/985234095.db2.gz WOPNJTOLMBEEOM-UHFFFAOYSA-N 1 2 232.258 2.271 20 0 BEADLO COC(=[NH2+])c1cccc(-c2cccc(=O)[nH]2)c1 ZINC001243735992 985270784 /nfs/dbraw/zinc/27/07/84/985270784.db2.gz KWEYYZVYKFWVPH-UHFFFAOYSA-N 1 2 228.251 2.426 20 0 BEADLO CCOc1ncc(/C(C)=C/C=C/[NH3+])cc1F ZINC001243772225 985303475 /nfs/dbraw/zinc/30/34/75/985303475.db2.gz CUAIDXDKATUDKE-REZHQCRGSA-N 1 2 222.263 2.495 20 0 BEADLO Cc1cnc(F)cc1-c1c[nH+]c(N)c(C)c1 ZINC001243784962 985333021 /nfs/dbraw/zinc/33/30/21/985333021.db2.gz QDJBEDSVUHXQCV-UHFFFAOYSA-N 1 2 217.247 2.482 20 0 BEADLO CCc1[nH]c(CNc2cc(C3CC3)ncn2)c[nH+]1 ZINC001458655745 985339941 /nfs/dbraw/zinc/33/99/41/985339941.db2.gz PJOGMHCXKFQXBW-UHFFFAOYSA-N 1 2 243.314 2.252 20 0 BEADLO CCc1[nH]cc(CNc2cc(C3CC3)ncn2)[nH+]1 ZINC001458655745 985339954 /nfs/dbraw/zinc/33/99/54/985339954.db2.gz PJOGMHCXKFQXBW-UHFFFAOYSA-N 1 2 243.314 2.252 20 0 BEADLO CCOC(=O)CCC[C@@H](C)[N@@H+]1CCC(F)(F)C1 ZINC001258115941 985423467 /nfs/dbraw/zinc/42/34/67/985423467.db2.gz AOIZUINBWCPOIM-SNVBAGLBSA-N 1 2 249.301 2.449 20 0 BEADLO CCOC(=O)CCC[C@@H](C)[N@H+]1CCC(F)(F)C1 ZINC001258115941 985423481 /nfs/dbraw/zinc/42/34/81/985423481.db2.gz AOIZUINBWCPOIM-SNVBAGLBSA-N 1 2 249.301 2.449 20 0 BEADLO Nc1cc(-c2ccc(CO)c(Cl)c2)cc[nH+]1 ZINC001243821484 985427772 /nfs/dbraw/zinc/42/77/72/985427772.db2.gz LEVQILJFLITPQY-UHFFFAOYSA-N 1 2 234.686 2.477 20 0 BEADLO COCCn1c[nH+]c(Cc2ccccc2OC)c1 ZINC001459299898 985436427 /nfs/dbraw/zinc/43/64/27/985436427.db2.gz GFIDVRKONZMDIA-UHFFFAOYSA-N 1 2 246.310 2.129 20 0 BEADLO c1cncc(-c2nccc(C3=C[NH2+]CCC3)n2)c1 ZINC001243949905 985645564 /nfs/dbraw/zinc/64/55/64/985645564.db2.gz UBCDZLHDMOHBSQ-UHFFFAOYSA-N 1 2 238.294 2.263 20 0 BEADLO C[C@H]([NH2+]Cc1csc(Cl)n1)c1cn[nH]c1 ZINC001459915976 985657708 /nfs/dbraw/zinc/65/77/08/985657708.db2.gz ZJJDWTJSWMNZIP-LURJTMIESA-N 1 2 242.735 2.370 20 0 BEADLO c1nc(C2=C[NH2+]CCC2)cnc1OCC1CCC1 ZINC001243952444 985660944 /nfs/dbraw/zinc/66/09/44/985660944.db2.gz PXXXJDQQHICOHF-UHFFFAOYSA-N 1 2 245.326 2.380 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc2c(c1)CCC(=O)N2C ZINC001244009341 985733812 /nfs/dbraw/zinc/73/38/12/985733812.db2.gz DYBCPIZQAYHASI-FSCUZGFYSA-N 1 2 242.322 2.471 20 0 BEADLO Nc1[nH+]cccc1-c1cc(F)c(O)c(F)c1 ZINC001244095980 985809756 /nfs/dbraw/zinc/80/97/56/985809756.db2.gz FPUTWUQLHAKQAG-UHFFFAOYSA-N 1 2 222.194 2.315 20 0 BEADLO CCn1cc(Nc2cccc(C)[nH+]2)ccc1=O ZINC001212907817 985910128 /nfs/dbraw/zinc/91/01/28/985910128.db2.gz GTSWALPDOFQVIG-UHFFFAOYSA-N 1 2 229.283 2.315 20 0 BEADLO CCc1cc(-c2ccc(N)[nH+]c2)ccc1N ZINC001244295194 985932556 /nfs/dbraw/zinc/93/25/56/985932556.db2.gz HVJAEGCTAGYEEA-UHFFFAOYSA-N 1 2 213.284 2.475 20 0 BEADLO CCOC(=O)CC[C@@H](C)[N@@H+]1C[C@@H](F)C[C@H]1CF ZINC001258490550 985950548 /nfs/dbraw/zinc/95/05/48/985950548.db2.gz YSHHEJZPLPHJEH-VWYCJHECSA-N 1 2 249.301 2.100 20 0 BEADLO CCOC(=O)CC[C@@H](C)[N@H+]1C[C@@H](F)C[C@H]1CF ZINC001258490550 985950554 /nfs/dbraw/zinc/95/05/54/985950554.db2.gz YSHHEJZPLPHJEH-VWYCJHECSA-N 1 2 249.301 2.100 20 0 BEADLO C[N@H+](CCOC(C)(C)C)Cc1ncccc1F ZINC001461848659 986204136 /nfs/dbraw/zinc/20/41/36/986204136.db2.gz FTLJPFSJNOYZLG-UHFFFAOYSA-N 1 2 240.322 2.468 20 0 BEADLO C[N@@H+](CCOC(C)(C)C)Cc1ncccc1F ZINC001461848659 986204153 /nfs/dbraw/zinc/20/41/53/986204153.db2.gz FTLJPFSJNOYZLG-UHFFFAOYSA-N 1 2 240.322 2.468 20 0 BEADLO Cc1cc(-c2ccc[nH+]c2N)cc(O)c1F ZINC001244519069 986221278 /nfs/dbraw/zinc/22/12/78/986221278.db2.gz WBWRDTXMAKYQBD-UHFFFAOYSA-N 1 2 218.231 2.484 20 0 BEADLO Cn1c[nH+]cc1-c1cccc(Cl)c1CO ZINC001244577621 986256907 /nfs/dbraw/zinc/25/69/07/986256907.db2.gz TUIHDZNEOXUDNJ-UHFFFAOYSA-N 1 2 222.675 2.233 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc(CO)cc1C ZINC001244581547 986267412 /nfs/dbraw/zinc/26/74/12/986267412.db2.gz MCRLTVFMZWZLMQ-DROBUMMNSA-N 1 2 203.285 2.363 20 0 BEADLO C[C@@H]1CCC[C@@H]([NH+]2CC(O)(C(F)(F)F)C2)C1 ZINC001258820212 986283176 /nfs/dbraw/zinc/28/31/76/986283176.db2.gz VRSQQKCHSHCKQR-RKDXNWHRSA-N 1 2 237.265 2.174 20 0 BEADLO Cc1cc(-c2c[nH+]cn2C)cc(C)c1CO ZINC001244693172 986308712 /nfs/dbraw/zinc/30/87/12/986308712.db2.gz BUOVLFOLXJNPMS-UHFFFAOYSA-N 1 2 216.284 2.196 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cccc(C(=O)N(C)C)c1F ZINC001244767783 986332538 /nfs/dbraw/zinc/33/25/38/986332538.db2.gz XYXFSBNXEGBCSF-NXZHAISVSA-N 1 2 248.301 2.403 20 0 BEADLO CC(C)(C)[C@H](O)CNc1ccn2cc[nH+]c2c1 ZINC001253720184 986343629 /nfs/dbraw/zinc/34/36/29/986343629.db2.gz PYEBNAZCVPUMAP-LLVKDONJSA-N 1 2 233.315 2.153 20 0 BEADLO CNc1cc(-c2ccnc(N(C)C)c2)cc[nH+]1 ZINC001244972617 986548871 /nfs/dbraw/zinc/54/88/71/986548871.db2.gz HQWCGJYNTRDYLM-UHFFFAOYSA-N 1 2 228.299 2.251 20 0 BEADLO CNc1cc(-c2ccc(C(N)=S)cc2)cc[nH+]1 ZINC001244975545 986559309 /nfs/dbraw/zinc/55/93/09/986559309.db2.gz GRUMMZUJXWOCSH-UHFFFAOYSA-N 1 2 243.335 2.425 20 0 BEADLO COc1c(O)cccc1-c1cc[nH+]c(N)c1 ZINC001244992070 986590428 /nfs/dbraw/zinc/59/04/28/986590428.db2.gz FDQAVVZVBNXMLE-UHFFFAOYSA-N 1 2 216.240 2.045 20 0 BEADLO COc1c(O)cccc1-c1c[nH+]c(N)c(C)c1 ZINC001244991303 986590915 /nfs/dbraw/zinc/59/09/15/986590915.db2.gz GYNHGIXTMWDFQR-UHFFFAOYSA-N 1 2 230.267 2.353 20 0 BEADLO Nc1ccc(-c2cc(Cl)cc(CO)c2)c[nH+]1 ZINC001245090909 986658313 /nfs/dbraw/zinc/65/83/13/986658313.db2.gz ZNAZLYGYTSUVFG-UHFFFAOYSA-N 1 2 234.686 2.477 20 0 BEADLO Cc1c[nH+]c(CCNc2nccc(C)n2)c(C)c1 ZINC000689485019 986676424 /nfs/dbraw/zinc/67/64/24/986676424.db2.gz FFMWPHOUJCBNAK-UHFFFAOYSA-N 1 2 242.326 2.451 20 0 BEADLO CCC1(C[NH2+]c2ccc(O)cc2)COC1 ZINC000379926642 986682892 /nfs/dbraw/zinc/68/28/92/986682892.db2.gz LUXQGAAEVSGCNL-UHFFFAOYSA-N 1 2 207.273 2.231 20 0 BEADLO Cc1cn2cc(C3=CCCOC3)ccc2[nH+]1 ZINC001245159264 986694217 /nfs/dbraw/zinc/69/42/17/986694217.db2.gz VBMLAQXENGJSAD-UHFFFAOYSA-N 1 2 214.268 2.446 20 0 BEADLO Cc1c(CN2CC(C)(F)C2)[nH+]c2ccccn12 ZINC001137267651 986702427 /nfs/dbraw/zinc/70/24/27/986702427.db2.gz FVEQPIINMZHUHE-UHFFFAOYSA-N 1 2 233.290 2.187 20 0 BEADLO C[N@H+](Cc1cnc2ccccc2c1)C1COC1 ZINC001137282213 986719249 /nfs/dbraw/zinc/71/92/49/986719249.db2.gz LEQINFZBUVAAKS-UHFFFAOYSA-N 1 2 228.295 2.065 20 0 BEADLO C[N@@H+](Cc1cnc2ccccc2c1)C1COC1 ZINC001137282213 986719257 /nfs/dbraw/zinc/71/92/57/986719257.db2.gz LEQINFZBUVAAKS-UHFFFAOYSA-N 1 2 228.295 2.065 20 0 BEADLO CC(C)CNC(=S)Nc1ccc2[nH+]ccn2c1 ZINC001245199089 986724841 /nfs/dbraw/zinc/72/48/41/986724841.db2.gz FIZXTCJHHKUAIO-UHFFFAOYSA-N 1 2 248.355 2.277 20 0 BEADLO Cc1[nH]c(CNC(=O)c2cccc(F)c2)[nH+]c1C ZINC001465747740 986739888 /nfs/dbraw/zinc/73/98/88/986739888.db2.gz KSFAZBNFGQSRFM-UHFFFAOYSA-N 1 2 247.273 2.096 20 0 BEADLO CC[C@@H]1CCN(C(=O)c2cccc3[nH+]ccn32)C1 ZINC001137324689 986776366 /nfs/dbraw/zinc/77/63/66/986776366.db2.gz IFFOHQGOJCBBBP-LLVKDONJSA-N 1 2 243.310 2.206 20 0 BEADLO COC(=[NH2+])c1cccc(-c2cc[nH]n2)c1 ZINC001245310527 986792679 /nfs/dbraw/zinc/79/26/79/986792679.db2.gz HFFRGWHRIUAYQZ-UHFFFAOYSA-N 1 2 201.229 2.048 20 0 BEADLO Cc1cc(C)c(C[N@H+](C)Cc2ccno2)[nH]1 ZINC001137332250 986795257 /nfs/dbraw/zinc/79/52/57/986795257.db2.gz MSSBROJUFTYIIO-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO Cc1cc(C)c(C[N@@H+](C)Cc2ccno2)[nH]1 ZINC001137332250 986795272 /nfs/dbraw/zinc/79/52/72/986795272.db2.gz MSSBROJUFTYIIO-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1n[nH]c2ccccc21 ZINC001137345008 986810212 /nfs/dbraw/zinc/81/02/12/986810212.db2.gz NNISRZFRTMFMLP-NXEZZACHSA-N 1 2 233.290 2.495 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1n[nH]c2ccccc21 ZINC001137345008 986810217 /nfs/dbraw/zinc/81/02/17/986810217.db2.gz NNISRZFRTMFMLP-NXEZZACHSA-N 1 2 233.290 2.495 20 0 BEADLO CC(=O)[C@@H]1CCC[N@@H+]1Cc1[nH]nc2ccccc21 ZINC001137353886 986817456 /nfs/dbraw/zinc/81/74/56/986817456.db2.gz ZJTOYOIANIBKLE-AWEZNQCLSA-N 1 2 243.310 2.116 20 0 BEADLO CC(=O)[C@@H]1CCC[N@H+]1Cc1[nH]nc2ccccc21 ZINC001137353886 986817464 /nfs/dbraw/zinc/81/74/64/986817464.db2.gz ZJTOYOIANIBKLE-AWEZNQCLSA-N 1 2 243.310 2.116 20 0 BEADLO CC(=O)[C@@H]1CCC[N@@H+]1Cc1n[nH]c2ccccc21 ZINC001137353886 986817472 /nfs/dbraw/zinc/81/74/72/986817472.db2.gz ZJTOYOIANIBKLE-AWEZNQCLSA-N 1 2 243.310 2.116 20 0 BEADLO CC(=O)[C@@H]1CCC[N@H+]1Cc1n[nH]c2ccccc21 ZINC001137353886 986817476 /nfs/dbraw/zinc/81/74/76/986817476.db2.gz ZJTOYOIANIBKLE-AWEZNQCLSA-N 1 2 243.310 2.116 20 0 BEADLO Nc1[nH+]cccc1-c1cc2cccnc2[nH]1 ZINC001245399256 986836751 /nfs/dbraw/zinc/83/67/51/986836751.db2.gz DVDLVIGYRHLVKH-UHFFFAOYSA-N 1 2 210.240 2.207 20 0 BEADLO C[C@H]1CC[N@@H+]1Cc1cncc(Br)c1 ZINC000606289562 986852283 /nfs/dbraw/zinc/85/22/83/986852283.db2.gz FTJKPCKMCADNEW-QMMMGPOBSA-N 1 2 241.132 2.438 20 0 BEADLO C[C@H]1CC[N@H+]1Cc1cncc(Br)c1 ZINC000606289562 986852288 /nfs/dbraw/zinc/85/22/88/986852288.db2.gz FTJKPCKMCADNEW-QMMMGPOBSA-N 1 2 241.132 2.438 20 0 BEADLO Cn1cc(-c2cc[nH+]c(N)c2)c2ccncc21 ZINC001245489186 986865912 /nfs/dbraw/zinc/86/59/12/986865912.db2.gz IZTYEUJRBNEFIX-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO CN(Cc1nnc(C2CCC2)o1)c1cccc[nH+]1 ZINC001255182098 986873917 /nfs/dbraw/zinc/87/39/17/986873917.db2.gz HGCXTHWPDKCMFD-UHFFFAOYSA-N 1 2 244.298 2.369 20 0 BEADLO Cc1cn2cc(-c3cnc(N)c(F)c3)ccc2[nH+]1 ZINC001245519076 986898524 /nfs/dbraw/zinc/89/85/24/986898524.db2.gz JNNCNJWEPDKEBQ-UHFFFAOYSA-N 1 2 242.257 2.426 20 0 BEADLO CCCC[C@H](C)[N@@H+]1C[C@H](F)C[C@H]1C(=O)OC ZINC001255324061 986915078 /nfs/dbraw/zinc/91/50/78/986915078.db2.gz YZPMTWKXZZURSA-AXFHLTTASA-N 1 2 231.311 2.151 20 0 BEADLO CCCC[C@H](C)[N@H+]1C[C@H](F)C[C@H]1C(=O)OC ZINC001255324061 986915090 /nfs/dbraw/zinc/91/50/90/986915090.db2.gz YZPMTWKXZZURSA-AXFHLTTASA-N 1 2 231.311 2.151 20 0 BEADLO Cc1cc(-c2cc(F)cnc2F)c[nH+]c1N ZINC001245537493 986918149 /nfs/dbraw/zinc/91/81/49/986918149.db2.gz QLZPKGMCGGABBF-UHFFFAOYSA-N 1 2 221.210 2.312 20 0 BEADLO Cc1cc(-c2ccc(C(N)=S)cc2)c[nH+]c1N ZINC001245540373 986926012 /nfs/dbraw/zinc/92/60/12/986926012.db2.gz QKQZXQFYRZWVEA-UHFFFAOYSA-N 1 2 243.335 2.273 20 0 BEADLO C=Cc1ncc(-c2c[nH+]c(N)c(C)c2)cn1 ZINC001245541201 986929112 /nfs/dbraw/zinc/92/91/12/986929112.db2.gz NINRYLZZBXDJCF-UHFFFAOYSA-N 1 2 212.256 2.072 20 0 BEADLO CNc1cc(-c2cnc(N)c(Cl)c2)cc[nH+]1 ZINC001245567793 986964790 /nfs/dbraw/zinc/96/47/90/986964790.db2.gz XQQWVJMOTNPVEC-UHFFFAOYSA-N 1 2 234.690 2.421 20 0 BEADLO COc1cc(OC)c(-c2c[nH+]c(N)c(C)c2)cn1 ZINC001245612718 986996808 /nfs/dbraw/zinc/99/68/08/986996808.db2.gz MIMRQKAVLGSAKU-UHFFFAOYSA-N 1 2 245.282 2.051 20 0 BEADLO Cc1coc(C[NH2+][C@@H](C)CC(F)(F)F)n1 ZINC001255632601 987034256 /nfs/dbraw/zinc/03/42/56/987034256.db2.gz JPQMJUMKLLXDFH-LURJTMIESA-N 1 2 222.210 2.414 20 0 BEADLO O=C1C[C@@H]2COC[C@H](C1)[N@@H+]2C1CCCCCC1 ZINC001255892859 987080269 /nfs/dbraw/zinc/08/02/69/987080269.db2.gz WIISHYUAKBQIAR-BETUJISGSA-N 1 2 237.343 2.142 20 0 BEADLO O=C1C[C@@H]2COC[C@H](C1)[N@H+]2C1CCCCCC1 ZINC001255892859 987080276 /nfs/dbraw/zinc/08/02/76/987080276.db2.gz WIISHYUAKBQIAR-BETUJISGSA-N 1 2 237.343 2.142 20 0 BEADLO CCc1[nH]c(CNC(=O)CC(C)(C)C2CC2)c[nH+]1 ZINC001472020786 987159993 /nfs/dbraw/zinc/15/99/93/987159993.db2.gz MLIVOESFIAGHFK-UHFFFAOYSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)CC(C)(C)C2CC2)[nH+]1 ZINC001472020786 987159996 /nfs/dbraw/zinc/15/99/96/987159996.db2.gz MLIVOESFIAGHFK-UHFFFAOYSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]c(CNC(=O)CC[C@H](C)CC)c[nH+]1 ZINC001472021217 987161631 /nfs/dbraw/zinc/16/16/31/987161631.db2.gz SPPGXATVQJHBEL-SNVBAGLBSA-N 1 2 237.347 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)CC[C@H](C)CC)[nH+]1 ZINC001472021217 987161636 /nfs/dbraw/zinc/16/16/36/987161636.db2.gz SPPGXATVQJHBEL-SNVBAGLBSA-N 1 2 237.347 2.415 20 0 BEADLO C[C@@H]1C[C@@H]1c1nnc(CN(C)c2cccc[nH+]2)o1 ZINC001256659978 987264264 /nfs/dbraw/zinc/26/42/64/987264264.db2.gz UQIDCRTXBCUJDT-ZJUUUORDSA-N 1 2 244.298 2.224 20 0 BEADLO CC[N@H+](CC1=NOCC1)Cc1ccccc1F ZINC001473127714 987340512 /nfs/dbraw/zinc/34/05/12/987340512.db2.gz AOFOONFTARDLHH-UHFFFAOYSA-N 1 2 236.290 2.424 20 0 BEADLO CC[N@@H+](CC1=NOCC1)Cc1ccccc1F ZINC001473127714 987340526 /nfs/dbraw/zinc/34/05/26/987340526.db2.gz AOFOONFTARDLHH-UHFFFAOYSA-N 1 2 236.290 2.424 20 0 BEADLO CSCC[C@H](C)Nc1cc[nH+]cc1F ZINC000699719346 987382059 /nfs/dbraw/zinc/38/20/59/987382059.db2.gz ZHEBMPNOZODYLW-QMMMGPOBSA-N 1 2 214.309 2.196 20 0 BEADLO Cc1cccc(C[NH2+][C@@H](CCO)c2ccco2)n1 ZINC001473412901 987429016 /nfs/dbraw/zinc/42/90/16/987429016.db2.gz QKUDSMPWMNJISN-ZDUSSCGKSA-N 1 2 246.310 2.196 20 0 BEADLO CC[C@H](C)[C@@H](C)[N@@H+]1CCOCC(F)(F)C1 ZINC001473526871 987467276 /nfs/dbraw/zinc/46/72/76/987467276.db2.gz LGGXNBUUWCHIBP-VHSXEESVSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@H](C)[C@@H](C)[N@H+]1CCOCC(F)(F)C1 ZINC001473526871 987467283 /nfs/dbraw/zinc/46/72/83/987467283.db2.gz LGGXNBUUWCHIBP-VHSXEESVSA-N 1 2 221.291 2.389 20 0 BEADLO c1ccc(N2CCCC2)c(C[NH+]2CCOCC2)c1 ZINC001116326711 987519432 /nfs/dbraw/zinc/51/94/32/987519432.db2.gz AGXKSQSZMBGKNZ-UHFFFAOYSA-N 1 2 246.354 2.119 20 0 BEADLO Cc1nnc(C[N@@H+]2CC(C)(C)C2(C)C)s1 ZINC001116461955 987588299 /nfs/dbraw/zinc/58/82/99/987588299.db2.gz CTGPIUMWTIPFMZ-UHFFFAOYSA-N 1 2 225.361 2.467 20 0 BEADLO Cc1nnc(C[N@H+]2CC(C)(C)C2(C)C)s1 ZINC001116461955 987588311 /nfs/dbraw/zinc/58/83/11/987588311.db2.gz CTGPIUMWTIPFMZ-UHFFFAOYSA-N 1 2 225.361 2.467 20 0 BEADLO C[C@H]1C[C@H](N[C@H]2C[NH2+]CC[C@H]2F)CC(C)(C)C1 ZINC001246219220 987616647 /nfs/dbraw/zinc/61/66/47/987616647.db2.gz YMLFYWLJQZYLPW-RVMXOQNASA-N 1 2 242.382 2.491 20 0 BEADLO C[C@H]1C[C@H]([NH2+][C@H]2CNCC[C@H]2F)CC(C)(C)C1 ZINC001246219220 987616653 /nfs/dbraw/zinc/61/66/53/987616653.db2.gz YMLFYWLJQZYLPW-RVMXOQNASA-N 1 2 242.382 2.491 20 0 BEADLO CC(C)[C@@H]1CCCN(C(=O)[C@H](C)n2cc[nH+]c2)C1 ZINC001116695874 987673428 /nfs/dbraw/zinc/67/34/28/987673428.db2.gz YLYRMSWFWJRHMK-QWHCGFSZSA-N 1 2 249.358 2.339 20 0 BEADLO CC(C)[C@H]1CCCN(C(=O)[C@H](C)n2cc[nH+]c2)C1 ZINC001116695875 987674929 /nfs/dbraw/zinc/67/49/29/987674929.db2.gz YLYRMSWFWJRHMK-STQMWFEESA-N 1 2 249.358 2.339 20 0 BEADLO CCC1(c2nnc(C[NH+](C)C)o2)CCCC1 ZINC001117228848 987806107 /nfs/dbraw/zinc/80/61/07/987806107.db2.gz GPNAWDSNODUOOI-UHFFFAOYSA-N 1 2 223.320 2.353 20 0 BEADLO CSC(C)(C)CC[NH2+]C1(c2ncon2)CC1 ZINC001474724446 987810561 /nfs/dbraw/zinc/81/05/61/987810561.db2.gz RHSMUDTVRDDUJR-UHFFFAOYSA-N 1 2 241.360 2.180 20 0 BEADLO CN(C)c1cc(CS[C@@H]2CCOC2)cc[nH+]1 ZINC001118037644 987992434 /nfs/dbraw/zinc/99/24/34/987992434.db2.gz IUXSLGPOKACNCG-LLVKDONJSA-N 1 2 238.356 2.170 20 0 BEADLO Cc1cc(N[C@H](C)[C@H](C)O)ccc1[NH+](C)C ZINC001118155618 988065747 /nfs/dbraw/zinc/06/57/47/988065747.db2.gz LZZBNVIONGXRRX-MNOVXSKESA-N 1 2 222.332 2.242 20 0 BEADLO C[C@@H]1CCC[C@@]1(C)c1nnc(C[NH+](C)C)o1 ZINC001118432791 988348380 /nfs/dbraw/zinc/34/83/80/988348380.db2.gz LRMCYIBLOXIDRX-BXKDBHETSA-N 1 2 223.320 2.209 20 0 BEADLO Cc1cccnc1/C=C\c1nnc(C[NH+](C)C)o1 ZINC001322677190 988360248 /nfs/dbraw/zinc/36/02/48/988360248.db2.gz HQJIBRSXHYYVNH-SREVYHEPSA-N 1 2 244.298 2.005 20 0 BEADLO C[C@H]([NH2+][C@H]1C[C@@H](C)n2ncnc21)c1cncs1 ZINC001118489107 988377777 /nfs/dbraw/zinc/37/77/77/988377777.db2.gz DHLRYYNDFLMPJR-VGMNWLOBSA-N 1 2 249.343 2.091 20 0 BEADLO CCCC1CC[NH+](Cn2ccsc2=O)CC1 ZINC001322819292 988387031 /nfs/dbraw/zinc/38/70/31/988387031.db2.gz URAXIKWUZLKBJU-UHFFFAOYSA-N 1 2 240.372 2.379 20 0 BEADLO c1nc(C[N@@H+]2CCC[C@@H]2C2CCCCC2)n[nH]1 ZINC001118557056 988428924 /nfs/dbraw/zinc/42/89/24/988428924.db2.gz BEEXQDRLLQTRFW-GFCCVEGCSA-N 1 2 234.347 2.349 20 0 BEADLO c1nc(C[N@H+]2CCC[C@@H]2C2CCCCC2)n[nH]1 ZINC001118557056 988428930 /nfs/dbraw/zinc/42/89/30/988428930.db2.gz BEEXQDRLLQTRFW-GFCCVEGCSA-N 1 2 234.347 2.349 20 0 BEADLO CC(C)OC(=O)C[N@@H+]1Cc2ccccc2C[C@@H]1C ZINC001323150897 988458223 /nfs/dbraw/zinc/45/82/23/988458223.db2.gz BTOSVNOAIXKZTJ-LBPRGKRZSA-N 1 2 247.338 2.385 20 0 BEADLO CC(C)OC(=O)C[N@H+]1Cc2ccccc2C[C@@H]1C ZINC001323150897 988458230 /nfs/dbraw/zinc/45/82/30/988458230.db2.gz BTOSVNOAIXKZTJ-LBPRGKRZSA-N 1 2 247.338 2.385 20 0 BEADLO COC(=O)C[N@@H+](Cc1occc1C)CC(C)C ZINC001323318484 988499633 /nfs/dbraw/zinc/49/96/33/988499633.db2.gz JXUQKMNCNUSEII-UHFFFAOYSA-N 1 2 239.315 2.219 20 0 BEADLO COC(=O)C[N@H+](Cc1occc1C)CC(C)C ZINC001323318484 988499643 /nfs/dbraw/zinc/49/96/43/988499643.db2.gz JXUQKMNCNUSEII-UHFFFAOYSA-N 1 2 239.315 2.219 20 0 BEADLO CN(C)c1[nH+]cccc1/C=C/c1ccncn1 ZINC001323545657 988549944 /nfs/dbraw/zinc/54/99/44/988549944.db2.gz ORSHMJLXULJAON-AATRIKPKSA-N 1 2 226.283 2.108 20 0 BEADLO CN(C)c1[nH+]cccc1/C=C\c1ccncn1 ZINC001323545663 988552194 /nfs/dbraw/zinc/55/21/94/988552194.db2.gz ORSHMJLXULJAON-WAYWQWQTSA-N 1 2 226.283 2.108 20 0 BEADLO COC[C@@H](CC(C)C)[NH2+][C@H](C)c1noc(C)n1 ZINC001324047803 988679184 /nfs/dbraw/zinc/67/91/84/988679184.db2.gz SWYXWBZDXSTEDY-MWLCHTKSSA-N 1 2 241.335 2.090 20 0 BEADLO CCCC1CC[NH+](Cc2nnc(C)[nH]2)CC1 ZINC001324102918 988701950 /nfs/dbraw/zinc/70/19/50/988701950.db2.gz UHPQYGUULOIKHX-UHFFFAOYSA-N 1 2 222.336 2.125 20 0 BEADLO Cc1cc(F)cc2[nH+]c(CCCCO)[nH]c21 ZINC001247006270 988836630 /nfs/dbraw/zinc/83/66/30/988836630.db2.gz AJNJIGYTSTYBRX-UHFFFAOYSA-N 1 2 222.263 2.325 20 0 BEADLO CCn1nc(C)c(C[N@@H+]2CC(C)(C)C2(C)C)n1 ZINC001324427093 988837542 /nfs/dbraw/zinc/83/75/42/988837542.db2.gz ZIAGYIRDNMDQQK-UHFFFAOYSA-N 1 2 236.363 2.227 20 0 BEADLO CCn1nc(C)c(C[N@H+]2CC(C)(C)C2(C)C)n1 ZINC001324427093 988837547 /nfs/dbraw/zinc/83/75/47/988837547.db2.gz ZIAGYIRDNMDQQK-UHFFFAOYSA-N 1 2 236.363 2.227 20 0 BEADLO C[C@H](C(=O)NC[C@@H]1CCCC1(C)C)n1cc[nH+]c1 ZINC001324454993 988845491 /nfs/dbraw/zinc/84/54/91/988845491.db2.gz VAZKDELTKILEET-NEPJUHHUSA-N 1 2 249.358 2.387 20 0 BEADLO CCn1c(CCCCO)[nH+]c2ccc(OC)cc21 ZINC001247037078 988848822 /nfs/dbraw/zinc/84/88/22/988848822.db2.gz OZZYXOWVXWPRJY-UHFFFAOYSA-N 1 2 248.326 2.380 20 0 BEADLO Fc1ccc(-c2noc(Cc3c[nH]c[nH+]3)n2)cc1 ZINC001247138229 988850639 /nfs/dbraw/zinc/85/06/39/988850639.db2.gz RJXSQSXUSSEOGN-UHFFFAOYSA-N 1 2 244.229 2.190 20 0 BEADLO Cc1ccccc1-c1noc(Cc2c[nH]c[nH+]2)n1 ZINC001247138160 988852753 /nfs/dbraw/zinc/85/27/53/988852753.db2.gz RFHOJFQVHRBYNI-UHFFFAOYSA-N 1 2 240.266 2.359 20 0 BEADLO Cn1c[nH+]c(Cc2nc(-c3ccccc3)no2)c1 ZINC001247242242 988856112 /nfs/dbraw/zinc/85/61/12/988856112.db2.gz ORHVFTRWOCCWQV-UHFFFAOYSA-N 1 2 240.266 2.061 20 0 BEADLO CCC1(NC(=O)[C@@H](C)n2cc[nH+]c2)CCCC1 ZINC001324542455 988869463 /nfs/dbraw/zinc/86/94/63/988869463.db2.gz LYCDDGWDGLTWAD-LLVKDONJSA-N 1 2 235.331 2.283 20 0 BEADLO CC(C)(C)ONC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001324587350 988879405 /nfs/dbraw/zinc/87/94/05/988879405.db2.gz JLXFGSNZPXVPPK-UHFFFAOYSA-N 1 2 248.286 2.186 20 0 BEADLO CC(C)C[C@H]1CCN(C(=O)[C@@H](C)n2cc[nH+]c2)C1 ZINC001324675551 988925186 /nfs/dbraw/zinc/92/51/86/988925186.db2.gz AIEGKEOVTAVYNL-CHWSQXEVSA-N 1 2 249.358 2.339 20 0 BEADLO C[C@@]1(c2ccccc2)CCC[N@@H+]1Cc1nnc[nH]1 ZINC001119325537 988948710 /nfs/dbraw/zinc/94/87/10/988948710.db2.gz NKCNQHLNQKKNTQ-AWEZNQCLSA-N 1 2 242.326 2.316 20 0 BEADLO C[C@@]1(c2ccccc2)CCC[N@H+]1Cc1nnc[nH]1 ZINC001119325537 988948721 /nfs/dbraw/zinc/94/87/21/988948721.db2.gz NKCNQHLNQKKNTQ-AWEZNQCLSA-N 1 2 242.326 2.316 20 0 BEADLO Cc1c[nH+]ccc1NC(=S)NCC(C)(C)C ZINC001247929699 989036757 /nfs/dbraw/zinc/03/67/57/989036757.db2.gz CGSICIWAUNENOV-UHFFFAOYSA-N 1 2 237.372 2.144 20 0 BEADLO CO[C@H](C)[C@H]([NH3+])c1nc(-c2cccc(C)c2)no1 ZINC001247960893 989052280 /nfs/dbraw/zinc/05/22/80/989052280.db2.gz HYURVHVGJNEOBG-KOLCDFICSA-N 1 2 247.298 2.080 20 0 BEADLO CCc1ccc(N2CCC[C@@H]2C[C@@H](C)O)[nH+]c1 ZINC001515582724 989068929 /nfs/dbraw/zinc/06/89/29/989068929.db2.gz SXDALFBAPVACBN-DGCLKSJQSA-N 1 2 234.343 2.384 20 0 BEADLO Cc1cc(C(=O)NCc2[nH]c(C)c(C)[nH+]2)oc1C ZINC001119455611 989088434 /nfs/dbraw/zinc/08/84/34/989088434.db2.gz BHNRLGPVJQIYHS-UHFFFAOYSA-N 1 2 247.298 2.166 20 0 BEADLO Cc1cccc2[nH]c([N@H+]3C(=N)SC=C3N)cc21 ZINC001248425338 989101538 /nfs/dbraw/zinc/10/15/38/989101538.db2.gz WKULYGJSBLEAFD-UHFFFAOYSA-N 1 2 244.323 2.390 20 0 BEADLO Cc1cccc2[nH]c([N@@H+]3C(=N)SC=C3N)cc21 ZINC001248425338 989101545 /nfs/dbraw/zinc/10/15/45/989101545.db2.gz WKULYGJSBLEAFD-UHFFFAOYSA-N 1 2 244.323 2.390 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+](C)CC2=CCCOC2)n1 ZINC001119516357 989119933 /nfs/dbraw/zinc/11/99/33/989119933.db2.gz VRJFUTNLIJZZAO-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+](C)CC2=CCCOC2)n1 ZINC001119516357 989119941 /nfs/dbraw/zinc/11/99/41/989119941.db2.gz VRJFUTNLIJZZAO-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO Cc1noc2ccc(C[N@H+]3CCOC[C@@H]3C)cc12 ZINC001248689891 989122944 /nfs/dbraw/zinc/12/29/44/989122944.db2.gz GFJICAUVUSWIFG-JTQLQIEISA-N 1 2 246.310 2.357 20 0 BEADLO Cc1noc2ccc(C[N@@H+]3CCOC[C@@H]3C)cc12 ZINC001248689891 989122948 /nfs/dbraw/zinc/12/29/48/989122948.db2.gz GFJICAUVUSWIFG-JTQLQIEISA-N 1 2 246.310 2.357 20 0 BEADLO C[C@@H](c1nc(CCCCF)no1)n1cc[nH+]c1 ZINC001119524199 989125791 /nfs/dbraw/zinc/12/57/91/989125791.db2.gz GJPVTXVMHJGOOO-VIFPVBQESA-N 1 2 238.266 2.168 20 0 BEADLO CC(C)[C@H](C)C(=O)OCC(C)(C)n1cc[nH+]c1 ZINC001515911845 989127116 /nfs/dbraw/zinc/12/71/16/989127116.db2.gz DFSMMDVHQXKQNU-NSHDSACASA-N 1 2 238.331 2.454 20 0 BEADLO CC(C)(COC(=O)[C@H]1CC12CCC2)n1cc[nH+]c1 ZINC001515917520 989130669 /nfs/dbraw/zinc/13/06/69/989130669.db2.gz YGOPDISUWCPHHY-LLVKDONJSA-N 1 2 248.326 2.352 20 0 BEADLO CC1C[NH+](Cc2ccc(Br)n2C)C1 ZINC001248773306 989146271 /nfs/dbraw/zinc/14/62/71/989146271.db2.gz HKROQNGCJQNHLR-UHFFFAOYSA-N 1 2 243.148 2.239 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H]3C[C@@H](C2)O3)cs1 ZINC001248803778 989149174 /nfs/dbraw/zinc/14/91/74/989149174.db2.gz QYFWSLLIZWRVOP-PHIMTYICSA-N 1 2 209.314 2.030 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H]3C[C@@H](C2)O3)cs1 ZINC001248803778 989149190 /nfs/dbraw/zinc/14/91/90/989149190.db2.gz QYFWSLLIZWRVOP-PHIMTYICSA-N 1 2 209.314 2.030 20 0 BEADLO CCN(Cc1csc(C)c1)C1C[NH+](C)C1 ZINC001248804222 989149309 /nfs/dbraw/zinc/14/93/09/989149309.db2.gz SYWIIBLDFSETQT-UHFFFAOYSA-N 1 2 224.373 2.192 20 0 BEADLO C[C@@H](C(=O)N1C[C@H](C)CC(C)(C)C1)n1cc[nH+]c1 ZINC001325298195 989151331 /nfs/dbraw/zinc/15/13/31/989151331.db2.gz BOGJLXMVCTXQRQ-NEPJUHHUSA-N 1 2 249.358 2.339 20 0 BEADLO Cc1nc(NC2([C@H]3CCCO3)CCC2)cc[nH+]1 ZINC001516470326 989154185 /nfs/dbraw/zinc/15/41/85/989154185.db2.gz IMGHLQPEMJDXLV-LLVKDONJSA-N 1 2 233.315 2.299 20 0 BEADLO COc1ccncc1CSCCn1cc[nH+]c1 ZINC001325310382 989159466 /nfs/dbraw/zinc/15/94/66/989159466.db2.gz RQVDJSZPHPKDPN-UHFFFAOYSA-N 1 2 249.339 2.220 20 0 BEADLO Fc1ccc(C[NH+]2CCOCC2)c2[nH]ccc21 ZINC001248814202 989173697 /nfs/dbraw/zinc/17/36/97/989173697.db2.gz CSMFOCVYHBFAFX-UHFFFAOYSA-N 1 2 234.274 2.139 20 0 BEADLO Cc1nc(C[N@@H+](C)C2(C)COC2)ccc1Cl ZINC001248878268 989207207 /nfs/dbraw/zinc/20/72/07/989207207.db2.gz QTHNWMUXUNJKJI-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO Cc1nc(C[N@H+](C)C2(C)COC2)ccc1Cl ZINC001248878268 989207248 /nfs/dbraw/zinc/20/72/48/989207248.db2.gz QTHNWMUXUNJKJI-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO CC[N@H+](Cc1ccc(Cl)c(C)n1)C1COC1 ZINC001248877335 989207684 /nfs/dbraw/zinc/20/76/84/989207684.db2.gz GKSWNXZFZYTRFF-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO CC[N@@H+](Cc1ccc(Cl)c(C)n1)C1COC1 ZINC001248877335 989207693 /nfs/dbraw/zinc/20/76/93/989207693.db2.gz GKSWNXZFZYTRFF-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO Cc1nc(C[N@H+](C)CCF)ccc1Cl ZINC001248873356 989209908 /nfs/dbraw/zinc/20/99/08/989209908.db2.gz DKEWUMMTVCEBLC-UHFFFAOYSA-N 1 2 216.687 2.445 20 0 BEADLO Cc1nc(C[N@@H+](C)CCF)ccc1Cl ZINC001248873356 989209923 /nfs/dbraw/zinc/20/99/23/989209923.db2.gz DKEWUMMTVCEBLC-UHFFFAOYSA-N 1 2 216.687 2.445 20 0 BEADLO COc1ccc2nc(C[N@@H+]3C[C@@H]4C[C@@H]4C3)[nH]c2c1 ZINC001249411870 989276653 /nfs/dbraw/zinc/27/66/53/989276653.db2.gz MBALRFIKMBDMBE-AOOOYVTPSA-N 1 2 243.310 2.023 20 0 BEADLO COc1ccc2nc(C[N@H+]3C[C@@H]4C[C@@H]4C3)[nH]c2c1 ZINC001249411870 989276668 /nfs/dbraw/zinc/27/66/68/989276668.db2.gz MBALRFIKMBDMBE-AOOOYVTPSA-N 1 2 243.310 2.023 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)C1CC(F)(F)C1 ZINC001518385437 989302434 /nfs/dbraw/zinc/30/24/34/989302434.db2.gz ULWAPUYGRXGUHN-UHFFFAOYSA-N 1 2 240.253 2.104 20 0 BEADLO CO[C@@H]1CCC[N@H+](Cc2cc(C)sn2)C1 ZINC001249570487 989305593 /nfs/dbraw/zinc/30/55/93/989305593.db2.gz DRBRHZWPIYEGKU-LLVKDONJSA-N 1 2 226.345 2.062 20 0 BEADLO CO[C@@H]1CCC[N@@H+](Cc2cc(C)sn2)C1 ZINC001249570487 989305599 /nfs/dbraw/zinc/30/55/99/989305599.db2.gz DRBRHZWPIYEGKU-LLVKDONJSA-N 1 2 226.345 2.062 20 0 BEADLO CCO[C@H]1CCC[N@H+](Cc2cc(C)sn2)C1 ZINC001249580897 989310719 /nfs/dbraw/zinc/31/07/19/989310719.db2.gz BXCFSWSGUKQZTQ-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO CCO[C@H]1CCC[N@@H+](Cc2cc(C)sn2)C1 ZINC001249580897 989310729 /nfs/dbraw/zinc/31/07/29/989310729.db2.gz BXCFSWSGUKQZTQ-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO CCCO[C@@H]1CC[N@H+](Cc2cc(C)sn2)C1 ZINC001249580837 989313496 /nfs/dbraw/zinc/31/34/96/989313496.db2.gz BCFJRYDFWIXDLD-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO CCCO[C@@H]1CC[N@@H+](Cc2cc(C)sn2)C1 ZINC001249580837 989313501 /nfs/dbraw/zinc/31/35/01/989313501.db2.gz BCFJRYDFWIXDLD-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO Cc1cnn(-c2cc[nH+]cc2C(F)(F)F)c1N ZINC001249583988 989318709 /nfs/dbraw/zinc/31/87/09/989318709.db2.gz NIBCHMRKTKEPGO-UHFFFAOYSA-N 1 2 242.204 2.177 20 0 BEADLO FC(F)(F)c1c[nH+]ccc1Nc1ncccn1 ZINC001249582655 989319109 /nfs/dbraw/zinc/31/91/09/989319109.db2.gz DHQUMKMCDNVWEO-UHFFFAOYSA-N 1 2 240.188 2.056 20 0 BEADLO CC(=CC(=O)Nc1cc[nH+]c(C)c1)c1ccco1 ZINC001520754941 989597324 /nfs/dbraw/zinc/59/73/24/989597324.db2.gz WLUBUEXHLIBSHR-CSKARUKUSA-N 1 2 242.278 2.447 20 0 BEADLO Cc1cscc1CNC(=O)[C@H](C)n1cc[nH+]c1 ZINC001326672347 989650414 /nfs/dbraw/zinc/65/04/14/989650414.db2.gz VSKJJJLPBNYKLI-JTQLQIEISA-N 1 2 249.339 2.130 20 0 BEADLO Cc1cc(C[N@@H+](C)C2CC(C)(C)C2)n[nH]1 ZINC001326799055 989718489 /nfs/dbraw/zinc/71/84/89/989718489.db2.gz YHXCEFRATQOSLF-UHFFFAOYSA-N 1 2 207.321 2.339 20 0 BEADLO Cc1cc(C[N@H+](C)C2CC(C)(C)C2)n[nH]1 ZINC001326799055 989718501 /nfs/dbraw/zinc/71/85/01/989718501.db2.gz YHXCEFRATQOSLF-UHFFFAOYSA-N 1 2 207.321 2.339 20 0 BEADLO CCc1ccc(N2CCC(C(=O)OC)CC2)[nH+]c1 ZINC001120793630 989885663 /nfs/dbraw/zinc/88/56/63/989885663.db2.gz QFZRMRGNXUERES-UHFFFAOYSA-N 1 2 248.326 2.033 20 0 BEADLO CO[C@H]1CCCN(c2cc(F)cc(C)[nH+]2)C1 ZINC001120811830 989894900 /nfs/dbraw/zinc/89/49/00/989894900.db2.gz CRARMXGVOWBGTO-NSHDSACASA-N 1 2 224.279 2.144 20 0 BEADLO CCc1ccc(N(C)Cc2cnccn2)[nH+]c1 ZINC001120817216 989900798 /nfs/dbraw/zinc/90/07/98/989900798.db2.gz TVFZBJKREUDSJD-UHFFFAOYSA-N 1 2 228.299 2.070 20 0 BEADLO CCc1ccc(N2CCC[C@@H]([C@@H](C)O)C2)[nH+]c1 ZINC001120828193 989907303 /nfs/dbraw/zinc/90/73/03/989907303.db2.gz PEVPBGOEHLECGL-DGCLKSJQSA-N 1 2 234.343 2.241 20 0 BEADLO CC[C@@H]1CCN(C(=O)CCCn2cc[nH+]c2)[C@@H]1C ZINC001523409307 989908863 /nfs/dbraw/zinc/90/88/63/989908863.db2.gz DYEOXHHGUJOVAO-CHWSQXEVSA-N 1 2 249.358 2.310 20 0 BEADLO CC[C@H]1CCN(C(=O)CCCn2cc[nH+]c2)[C@H]1C ZINC001523409334 989910180 /nfs/dbraw/zinc/91/01/80/989910180.db2.gz DYEOXHHGUJOVAO-STQMWFEESA-N 1 2 249.358 2.310 20 0 BEADLO CCc1ccc(N(C)[C@@H]2CC[C@@H]2OC)[nH+]c1 ZINC001120880965 989942962 /nfs/dbraw/zinc/94/29/62/989942962.db2.gz DVABYOFNVMZZOE-NEPJUHHUSA-N 1 2 220.316 2.258 20 0 BEADLO Nc1cc(N2CCC[C@@]3(CC=CCC3)C2)[nH+]cn1 ZINC001120899094 989956388 /nfs/dbraw/zinc/95/63/88/989956388.db2.gz LWTDDTDFDTUQCF-AWEZNQCLSA-N 1 2 244.342 2.386 20 0 BEADLO CC(C)C[C@H]1CCCN(c2cc(N)nc[nH+]2)C1 ZINC001120910026 989961927 /nfs/dbraw/zinc/96/19/27/989961927.db2.gz KHFAAVQMDZHGIM-LLVKDONJSA-N 1 2 234.347 2.321 20 0 BEADLO Cc1nc(NC[C@H]2OCc3ccccc32)cc[nH+]1 ZINC001120925060 989970700 /nfs/dbraw/zinc/97/07/00/989970700.db2.gz ZFFWWFDIILDAOR-CYBMUJFWSA-N 1 2 241.294 2.468 20 0 BEADLO CCc1ccc(N(C)C[C@@H](C)OC)[nH+]c1 ZINC001120931641 989975284 /nfs/dbraw/zinc/97/52/84/989975284.db2.gz JJMNEODRMMPNEP-SNVBAGLBSA-N 1 2 208.305 2.115 20 0 BEADLO Cc1cc(F)cc(N2CC[C@@H]3C[C@@H]3C2)[nH+]1 ZINC001120949324 989981745 /nfs/dbraw/zinc/98/17/45/989981745.db2.gz OFZQGTIWDGQRGZ-NXEZZACHSA-N 1 2 206.264 2.375 20 0 BEADLO CCO[C@H]1CCN(c2cc(F)cc(C)[nH+]2)C1 ZINC001120964141 989988670 /nfs/dbraw/zinc/98/86/70/989988670.db2.gz SPWVAFRTLJOOBA-NSHDSACASA-N 1 2 224.279 2.144 20 0 BEADLO C[C@@H](CC(=O)N1C[C@H]2CCCC[C@H]21)n1cc[nH+]c1 ZINC001121147245 990025291 /nfs/dbraw/zinc/02/52/91/990025291.db2.gz PMVGBSRFOWTWKL-YNEHKIRRSA-N 1 2 247.342 2.235 20 0 BEADLO C/C=C(/C)C(=O)OCC(C)(C)n1cc[nH+]c1 ZINC001526088939 990113125 /nfs/dbraw/zinc/11/31/25/990113125.db2.gz RSNPUTZOHCDJPR-YHYXMXQVSA-N 1 2 222.288 2.128 20 0 BEADLO Cc1cc(C(=O)Nc2c(C)c[nH+]cc2C)co1 ZINC001537603317 990507594 /nfs/dbraw/zinc/50/75/94/990507594.db2.gz CWCRJKZYUAHFLY-UHFFFAOYSA-N 1 2 230.267 2.274 20 0 BEADLO CC(C)(COC(=O)C1(C2CC2)CC1)n1cc[nH+]c1 ZINC001123152980 990518881 /nfs/dbraw/zinc/51/88/81/990518881.db2.gz BMMRFSQSOMARDL-UHFFFAOYSA-N 1 2 248.326 2.352 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@@H]1C[C@@H]1[C@H]1C[C@H]1C ZINC001123472533 990591785 /nfs/dbraw/zinc/59/17/85/990591785.db2.gz IBPMABYUNRZXQP-GWNIPJSYSA-N 1 2 248.326 2.238 20 0 BEADLO CCNC(=O)[C@H]1CC[C@@H](Nc2cccc[nH+]2)CC1 ZINC001540354885 990609543 /nfs/dbraw/zinc/60/95/43/990609543.db2.gz PPZATAIQZXGXHL-TXEJJXNPSA-N 1 2 247.342 2.188 20 0 BEADLO Cc1cccc(NC(=O)CCc2[nH+]ccn2C)c1 ZINC001123570277 990614961 /nfs/dbraw/zinc/61/49/61/990614961.db2.gz WFYAWYJJGBQYPQ-UHFFFAOYSA-N 1 2 243.310 2.300 20 0 BEADLO O=C(Nc1ccccc1-n1cc[nH+]c1)[C@H]1C[C@@H]1F ZINC001540721368 990642718 /nfs/dbraw/zinc/64/27/18/990642718.db2.gz ZRADVOFQUAZQLQ-UWVGGRQHSA-N 1 2 245.257 2.169 20 0 BEADLO CC[C@@H]1CCCCCN1C(=O)Cc1[nH]c[nH+]c1C ZINC001544115915 990713950 /nfs/dbraw/zinc/71/39/50/990713950.db2.gz WGJBXJHLDYEIBO-GFCCVEGCSA-N 1 2 249.358 2.442 20 0 BEADLO C[C@@H]1C[C@H](C)N(C(=O)c2cccc3[nH+]ccn32)C1 ZINC001544455988 990722682 /nfs/dbraw/zinc/72/26/82/990722682.db2.gz LQNSRYWCOHKLSK-MNOVXSKESA-N 1 2 243.310 2.205 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CCC[C@@H](C(C)C)C1 ZINC001556234271 990811888 /nfs/dbraw/zinc/81/18/88/990811888.db2.gz QVSIKFGPHUHLKS-GFCCVEGCSA-N 1 2 249.358 2.155 20 0 BEADLO CC[C@@H]1CCN(C(=O)[C@@H](C)n2cc[nH+]c2)[C@@H]1C ZINC001556273593 990816611 /nfs/dbraw/zinc/81/66/11/990816611.db2.gz ULTBDIHHELGIPX-IJLUTSLNSA-N 1 2 235.331 2.091 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(CC1CC1)C1CCC1 ZINC001556359189 990821610 /nfs/dbraw/zinc/82/16/10/990821610.db2.gz JVUIYVCECJGFEX-UHFFFAOYSA-N 1 2 247.342 2.052 20 0 BEADLO CC1C[NH+](Cc2scnc2Cl)C1 ZINC001137817176 990851850 /nfs/dbraw/zinc/85/18/50/990851850.db2.gz GDISCRDORLSTKU-UHFFFAOYSA-N 1 2 202.710 2.248 20 0 BEADLO Clc1ncsc1C[N@@H+]1C[C@@H]2CCO[C@@H]2C1 ZINC001137823442 990852189 /nfs/dbraw/zinc/85/21/89/990852189.db2.gz HJWNIWVBPVHWSD-JGVFFNPUSA-N 1 2 244.747 2.017 20 0 BEADLO Clc1ncsc1C[N@H+]1C[C@@H]2CCO[C@@H]2C1 ZINC001137823442 990852191 /nfs/dbraw/zinc/85/21/91/990852191.db2.gz HJWNIWVBPVHWSD-JGVFFNPUSA-N 1 2 244.747 2.017 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cc(O)cc(O)c2)C[C@H]1F ZINC001138323958 990913575 /nfs/dbraw/zinc/91/35/75/990913575.db2.gz FDUVRJWLRPJHRA-NOZJJQNGSA-N 1 2 239.290 2.278 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cc(O)cc(O)c2)C[C@H]1F ZINC001138323958 990913581 /nfs/dbraw/zinc/91/35/81/990913581.db2.gz FDUVRJWLRPJHRA-NOZJJQNGSA-N 1 2 239.290 2.278 20 0 BEADLO Cc1c(C[NH+]2CCOCC2)[nH]c2ccc(F)cc12 ZINC001138411078 990940939 /nfs/dbraw/zinc/94/09/39/990940939.db2.gz LGIZDXDIHHTXJE-UHFFFAOYSA-N 1 2 248.301 2.448 20 0 BEADLO CCc1[nH]c(CNC(=O)c2sccc2C)c[nH+]1 ZINC001558494064 990948553 /nfs/dbraw/zinc/94/85/53/990948553.db2.gz FLSHGDPAPMWGAW-UHFFFAOYSA-N 1 2 249.339 2.272 20 0 BEADLO CCc1[nH]cc(CNC(=O)c2sccc2C)[nH+]1 ZINC001558494064 990948562 /nfs/dbraw/zinc/94/85/62/990948562.db2.gz FLSHGDPAPMWGAW-UHFFFAOYSA-N 1 2 249.339 2.272 20 0 BEADLO CCc1[nH]c(CNC(=O)C(CC)CC)c[nH+]1 ZINC001558497302 990950312 /nfs/dbraw/zinc/95/03/12/990950312.db2.gz JGJGQONTVAKKAB-UHFFFAOYSA-N 1 2 223.320 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)C(CC)CC)[nH+]1 ZINC001558497302 990950317 /nfs/dbraw/zinc/95/03/17/990950317.db2.gz JGJGQONTVAKKAB-UHFFFAOYSA-N 1 2 223.320 2.025 20 0 BEADLO OCc1cc[nH+]c(NCc2ccc(Cl)nc2)c1 ZINC001308442782 990998568 /nfs/dbraw/zinc/99/85/68/990998568.db2.gz UNRIJHPFYLTIOW-UHFFFAOYSA-N 1 2 249.701 2.234 20 0 BEADLO C[C@@H]1CSCC[N@@H+]1Cc1cn(C2CC2)cn1 ZINC001308623650 991067881 /nfs/dbraw/zinc/06/78/81/991067881.db2.gz JAWFXTIJWKXPEF-SNVBAGLBSA-N 1 2 237.372 2.155 20 0 BEADLO C[C@@H]1CSCC[N@H+]1Cc1cn(C2CC2)cn1 ZINC001308623650 991067890 /nfs/dbraw/zinc/06/78/90/991067890.db2.gz JAWFXTIJWKXPEF-SNVBAGLBSA-N 1 2 237.372 2.155 20 0 BEADLO CCc1cn(Cc2nc(CC(C)C)no2)c[nH+]1 ZINC001559465820 991113988 /nfs/dbraw/zinc/11/39/88/991113988.db2.gz BNCJLMQXBLLHSE-UHFFFAOYSA-N 1 2 234.303 2.075 20 0 BEADLO Cc1cc(F)ncc1CNc1cc(CO)cc[nH+]1 ZINC001202891521 991135930 /nfs/dbraw/zinc/13/59/30/991135930.db2.gz DMXDUVCZULKUMW-UHFFFAOYSA-N 1 2 247.273 2.029 20 0 BEADLO c1c2ccccc2oc1C[N@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001139064813 991135944 /nfs/dbraw/zinc/13/59/44/991135944.db2.gz KKIQUYJBRQJDAF-BETUJISGSA-N 1 2 229.279 2.406 20 0 BEADLO c1c2ccccc2oc1C[N@@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001139064813 991135952 /nfs/dbraw/zinc/13/59/52/991135952.db2.gz KKIQUYJBRQJDAF-BETUJISGSA-N 1 2 229.279 2.406 20 0 BEADLO CSCC[C@@H](C)[N@@H+]1CCCC(=O)[C@H](F)C1 ZINC001258215894 991138770 /nfs/dbraw/zinc/13/87/70/991138770.db2.gz RZGXJBHEXMJPNJ-NXEZZACHSA-N 1 2 233.352 2.131 20 0 BEADLO CSCC[C@@H](C)[N@H+]1CCCC(=O)[C@H](F)C1 ZINC001258215894 991138777 /nfs/dbraw/zinc/13/87/77/991138777.db2.gz RZGXJBHEXMJPNJ-NXEZZACHSA-N 1 2 233.352 2.131 20 0 BEADLO CSCC[C@@H](C)[N@@H+]1CCC[C@H](F)C(=O)C1 ZINC001258216673 991140910 /nfs/dbraw/zinc/14/09/10/991140910.db2.gz ZQKSFIHUHDSDPL-ZJUUUORDSA-N 1 2 233.352 2.131 20 0 BEADLO CSCC[C@@H](C)[N@H+]1CCC[C@H](F)C(=O)C1 ZINC001258216673 991140917 /nfs/dbraw/zinc/14/09/17/991140917.db2.gz ZQKSFIHUHDSDPL-ZJUUUORDSA-N 1 2 233.352 2.131 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@H](C)c1ccsc1 ZINC001139132786 991153181 /nfs/dbraw/zinc/15/31/81/991153181.db2.gz OKGQMLSYILBHOQ-QMMMGPOBSA-N 1 2 249.339 2.200 20 0 BEADLO C[N@H+](CC1=NOCC1)Cc1cc(F)cc(F)c1 ZINC001559811029 991270533 /nfs/dbraw/zinc/27/05/33/991270533.db2.gz BVCPVIGYPLSKEV-UHFFFAOYSA-N 1 2 240.253 2.173 20 0 BEADLO C[N@@H+](CC1=NOCC1)Cc1cc(F)cc(F)c1 ZINC001559811029 991270546 /nfs/dbraw/zinc/27/05/46/991270546.db2.gz BVCPVIGYPLSKEV-UHFFFAOYSA-N 1 2 240.253 2.173 20 0 BEADLO CCOc1ccncc1C[N@@H+]1CCC[C@@H]1CF ZINC001139631123 991302913 /nfs/dbraw/zinc/30/29/13/991302913.db2.gz AMYNCAKRQVOUPU-GFCCVEGCSA-N 1 2 238.306 2.414 20 0 BEADLO CCOc1ccncc1C[N@H+]1CCC[C@@H]1CF ZINC001139631123 991302922 /nfs/dbraw/zinc/30/29/22/991302922.db2.gz AMYNCAKRQVOUPU-GFCCVEGCSA-N 1 2 238.306 2.414 20 0 BEADLO COc1ncc(Cl)cc1C[N@@H+]1CC[C@@H]1C ZINC001139746688 991350134 /nfs/dbraw/zinc/35/01/34/991350134.db2.gz YOBVWSOFJJBWFA-QMMMGPOBSA-N 1 2 226.707 2.338 20 0 BEADLO COc1ncc(Cl)cc1C[N@H+]1CC[C@@H]1C ZINC001139746688 991350143 /nfs/dbraw/zinc/35/01/43/991350143.db2.gz YOBVWSOFJJBWFA-QMMMGPOBSA-N 1 2 226.707 2.338 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC(=O)C(C)(C)C2)nc1 ZINC001139840102 991400681 /nfs/dbraw/zinc/40/06/81/991400681.db2.gz DOTMNJKVAWNQIK-UHFFFAOYSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1ccc(C[N@H+]2CCC(=O)C(C)(C)C2)nc1 ZINC001139840102 991400687 /nfs/dbraw/zinc/40/06/87/991400687.db2.gz DOTMNJKVAWNQIK-UHFFFAOYSA-N 1 2 232.327 2.191 20 0 BEADLO c1ccc2c(c1)cncc2C[N@@H+]1CCC12COC2 ZINC001139895442 991414007 /nfs/dbraw/zinc/41/40/07/991414007.db2.gz WQHZGVVSQKQRMN-UHFFFAOYSA-N 1 2 240.306 2.210 20 0 BEADLO c1ccc2c(c1)cncc2C[N@H+]1CCC12COC2 ZINC001139895442 991414016 /nfs/dbraw/zinc/41/40/16/991414016.db2.gz WQHZGVVSQKQRMN-UHFFFAOYSA-N 1 2 240.306 2.210 20 0 BEADLO C[N@H+](Cc1cccnc1)Cc1cnc(Cl)nc1 ZINC001139987461 991465836 /nfs/dbraw/zinc/46/58/36/991465836.db2.gz SXCDJEFAIYQVEB-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[N@@H+](Cc1cccnc1)Cc1cnc(Cl)nc1 ZINC001139987461 991465846 /nfs/dbraw/zinc/46/58/46/991465846.db2.gz SXCDJEFAIYQVEB-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[C@@H](c1nnc(Cc2cccc(F)c2)o1)[NH+](C)C ZINC001258514542 991474686 /nfs/dbraw/zinc/47/46/86/991474686.db2.gz YHUVXIOZJXCGNO-VIFPVBQESA-N 1 2 249.289 2.422 20 0 BEADLO COc1cccc2[nH]c(NC(C)C)[nH+]c21 ZINC001560577246 991509724 /nfs/dbraw/zinc/50/97/24/991509724.db2.gz VPHRDNXOXMUFMF-UHFFFAOYSA-N 1 2 205.261 2.392 20 0 BEADLO CC1(C)CC[C@H]([N@@H+]2CC[C@H](O)C(F)(F)C2)C1 ZINC001258604418 991516054 /nfs/dbraw/zinc/51/60/54/991516054.db2.gz CQZSZTHWFUVUHL-UWVGGRQHSA-N 1 2 233.302 2.267 20 0 BEADLO CC1(C)CC[C@H]([N@H+]2CC[C@H](O)C(F)(F)C2)C1 ZINC001258604418 991516066 /nfs/dbraw/zinc/51/60/66/991516066.db2.gz CQZSZTHWFUVUHL-UWVGGRQHSA-N 1 2 233.302 2.267 20 0 BEADLO CCn1ccc(C[NH2+][C@H](C)c2ncccc2C)n1 ZINC001560618790 991523988 /nfs/dbraw/zinc/52/39/88/991523988.db2.gz WNTFFMFQPJKIBY-GFCCVEGCSA-N 1 2 244.342 2.457 20 0 BEADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccncc1O ZINC001140276432 991591567 /nfs/dbraw/zinc/59/15/67/991591567.db2.gz FDEFWVPBJLEMRJ-LLVKDONJSA-N 1 2 243.310 2.166 20 0 BEADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1ccncc1O ZINC001140276432 991591576 /nfs/dbraw/zinc/59/15/76/991591576.db2.gz FDEFWVPBJLEMRJ-LLVKDONJSA-N 1 2 243.310 2.166 20 0 BEADLO Cc1ccc2[nH]nc(C[N@@H+](C)[C@@H]3CCOC3)c2c1 ZINC001140330842 991611410 /nfs/dbraw/zinc/61/14/10/991611410.db2.gz MRKUDKAAUNSQDP-LLVKDONJSA-N 1 2 245.326 2.092 20 0 BEADLO Cc1ccc2[nH]nc(C[N@H+](C)[C@@H]3CCOC3)c2c1 ZINC001140330842 991611413 /nfs/dbraw/zinc/61/14/13/991611413.db2.gz MRKUDKAAUNSQDP-LLVKDONJSA-N 1 2 245.326 2.092 20 0 BEADLO CC(C)C[C@H]1CCCN1C(=O)[C@H](C)n1cc[nH+]c1 ZINC001318080653 991621503 /nfs/dbraw/zinc/62/15/03/991621503.db2.gz RUSFCLHNLVONKM-QWHCGFSZSA-N 1 2 249.358 2.481 20 0 BEADLO CCC=CC[NH2+]Cc1n[nH]cc1Br ZINC001560849503 991622457 /nfs/dbraw/zinc/62/24/57/991622457.db2.gz UJJAKUINYCYAGJ-ONEGZZNKSA-N 1 2 244.136 2.228 20 0 BEADLO C[C@@H](C(=O)N[C@H]1CCC[C@@H](C)[C@H]1C)n1cc[nH+]c1 ZINC001318097226 991623668 /nfs/dbraw/zinc/62/36/68/991623668.db2.gz QQAWQRPCDZEROO-NDBYEHHHSA-N 1 2 249.358 2.385 20 0 BEADLO Fc1ccc2c(c1)CC[N@@H+](Cc1ccncn1)C2 ZINC001140350793 991627300 /nfs/dbraw/zinc/62/73/00/991627300.db2.gz REDOSZKTSROAFG-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1ccc2c(c1)CC[N@H+](Cc1ccncn1)C2 ZINC001140350793 991627308 /nfs/dbraw/zinc/62/73/08/991627308.db2.gz REDOSZKTSROAFG-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO CC[C@H](C[C@@H](C)CC)[NH2+]C1(C(=O)OC)CC1 ZINC001258779140 991745234 /nfs/dbraw/zinc/74/52/34/991745234.db2.gz UMYAGQWAFXJSAH-WDEREUQCSA-N 1 2 227.348 2.496 20 0 BEADLO CCOC(=O)C1([NH2+][C@@H]2CCC[C@H](C)C2)CC1 ZINC001258806977 991808932 /nfs/dbraw/zinc/80/89/32/991808932.db2.gz KHSWESQVEQOEDM-WDEREUQCSA-N 1 2 225.332 2.250 20 0 BEADLO CC[C@H](C)CN(CC)C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001319367675 991848202 /nfs/dbraw/zinc/84/82/02/991848202.db2.gz LAORMUCMUIWSSW-NWDGAFQWSA-N 1 2 237.347 2.339 20 0 BEADLO C[C@H](C(=O)N(C)C[C@@H]1CC=CCC1)n1cc[nH+]c1 ZINC001320057481 992090064 /nfs/dbraw/zinc/09/00/64/992090064.db2.gz CABKBNIURMAMIB-CHWSQXEVSA-N 1 2 247.342 2.259 20 0 BEADLO CCN(CCC1CC1)C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001320291664 992156051 /nfs/dbraw/zinc/15/60/51/992156051.db2.gz FQEOZOYQBHVTKH-LLVKDONJSA-N 1 2 235.331 2.093 20 0 BEADLO CC(C)C(C)(C)CNC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001320563825 992247724 /nfs/dbraw/zinc/24/77/24/992247724.db2.gz SPIRCGVPBLSTBQ-LLVKDONJSA-N 1 2 237.347 2.243 20 0 BEADLO CCC[C@H]1[C@H](C)CCC[N@@H+]1Cc1nc[nH]n1 ZINC001261637796 992429481 /nfs/dbraw/zinc/42/94/81/992429481.db2.gz GRCMRNQNWXVMHL-MNOVXSKESA-N 1 2 222.336 2.205 20 0 BEADLO CCC[C@H]1[C@H](C)CCC[N@H+]1Cc1nc[nH]n1 ZINC001261637796 992429483 /nfs/dbraw/zinc/42/94/83/992429483.db2.gz GRCMRNQNWXVMHL-MNOVXSKESA-N 1 2 222.336 2.205 20 0 BEADLO CCC[C@@]1(C)CCC[N@H+](Cc2nnc[nH]2)C1 ZINC001261638240 992432731 /nfs/dbraw/zinc/43/27/31/992432731.db2.gz VGIVROQJYUVRFZ-LBPRGKRZSA-N 1 2 222.336 2.207 20 0 BEADLO CCC[C@@]1(C)CCC[N@@H+](Cc2nnc[nH]2)C1 ZINC001261638240 992432737 /nfs/dbraw/zinc/43/27/37/992432737.db2.gz VGIVROQJYUVRFZ-LBPRGKRZSA-N 1 2 222.336 2.207 20 0 BEADLO CCC[C@]1(C)CCC[N@H+](Cc2nnc[nH]2)C1 ZINC001261638239 992432879 /nfs/dbraw/zinc/43/28/79/992432879.db2.gz VGIVROQJYUVRFZ-GFCCVEGCSA-N 1 2 222.336 2.207 20 0 BEADLO CCC[C@]1(C)CCC[N@@H+](Cc2nnc[nH]2)C1 ZINC001261638239 992432888 /nfs/dbraw/zinc/43/28/88/992432888.db2.gz VGIVROQJYUVRFZ-GFCCVEGCSA-N 1 2 222.336 2.207 20 0 BEADLO Cc1cccc2c1C[N@H+](CC(=O)OC(C)C)CC2 ZINC001321117069 992460949 /nfs/dbraw/zinc/46/09/49/992460949.db2.gz CRQBZHGZMZZHHL-UHFFFAOYSA-N 1 2 247.338 2.305 20 0 BEADLO Cc1cccc2c1C[N@@H+](CC(=O)OC(C)C)CC2 ZINC001321117069 992460955 /nfs/dbraw/zinc/46/09/55/992460955.db2.gz CRQBZHGZMZZHHL-UHFFFAOYSA-N 1 2 247.338 2.305 20 0 BEADLO CCc1nn(C[N@@H+]2CCC[C@@H]2C)c(=S)o1 ZINC001262050978 992635234 /nfs/dbraw/zinc/63/52/34/992635234.db2.gz ZGKWZQCSCWAKQS-QMMMGPOBSA-N 1 2 227.333 2.210 20 0 BEADLO CCc1nn(C[N@H+]2CCC[C@@H]2C)c(=S)o1 ZINC001262050978 992635247 /nfs/dbraw/zinc/63/52/47/992635247.db2.gz ZGKWZQCSCWAKQS-QMMMGPOBSA-N 1 2 227.333 2.210 20 0 BEADLO CCc1nn(C[N@@H+]2CCC[C@H]2C)c(=S)o1 ZINC001262050977 992635926 /nfs/dbraw/zinc/63/59/26/992635926.db2.gz ZGKWZQCSCWAKQS-MRVPVSSYSA-N 1 2 227.333 2.210 20 0 BEADLO CCc1nn(C[N@H+]2CCC[C@H]2C)c(=S)o1 ZINC001262050977 992635938 /nfs/dbraw/zinc/63/59/38/992635938.db2.gz ZGKWZQCSCWAKQS-MRVPVSSYSA-N 1 2 227.333 2.210 20 0 BEADLO CCc1cccc(C[NH2+]Cc2c[nH]cn2)c1 ZINC001262111805 992683554 /nfs/dbraw/zinc/68/35/54/992683554.db2.gz QDBXMSQYEMFKDR-UHFFFAOYSA-N 1 2 215.300 2.262 20 0 BEADLO C[C@@H](CNC(=O)[C@@H](C)n1cc[nH+]c1)C(C)(C)C ZINC001262126370 992690113 /nfs/dbraw/zinc/69/01/13/992690113.db2.gz CYULJRIWOJJNHG-WDEREUQCSA-N 1 2 237.347 2.243 20 0 BEADLO C[NH2+]CC(=O)O[C@H](C)c1cc(C)ccc1C ZINC001573895781 992757039 /nfs/dbraw/zinc/75/70/39/992757039.db2.gz RUHKIKWNBIYCKU-LLVKDONJSA-N 1 2 221.300 2.127 20 0 BEADLO Cc1cc(COC(=O)[C@@H]2CCCC[NH2+]2)cs1 ZINC001574133903 992810096 /nfs/dbraw/zinc/81/00/96/992810096.db2.gz HAFKTCIPHBNPMO-NSHDSACASA-N 1 2 239.340 2.242 20 0 BEADLO CC(C)[C@H]1CCN(c2cc(N(C)C)[nH+]cn2)C1 ZINC001262359615 992857852 /nfs/dbraw/zinc/85/78/52/992857852.db2.gz DXDQUDNTXOMAOS-NSHDSACASA-N 1 2 234.347 2.025 20 0 BEADLO CC(C)[C@H]1CCN(c2cc(N(C)C)nc[nH+]2)C1 ZINC001262359615 992857853 /nfs/dbraw/zinc/85/78/53/992857853.db2.gz DXDQUDNTXOMAOS-NSHDSACASA-N 1 2 234.347 2.025 20 0 BEADLO Cc1noc(NCCCc2cccc(C)[nH+]2)n1 ZINC001262695535 993035952 /nfs/dbraw/zinc/03/59/52/993035952.db2.gz FJGWRMFPLHOHJK-UHFFFAOYSA-N 1 2 232.287 2.126 20 0 BEADLO C[C@H]([NH2+]Cc1ccc2[nH]ccc2c1)c1cnn[nH]1 ZINC001575695661 993095081 /nfs/dbraw/zinc/09/50/81/993095081.db2.gz GKPPTVBYPKDYRZ-VIFPVBQESA-N 1 2 241.298 2.137 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N(C(=O)C[C@H]([NH3+])C(F)F)C1 ZINC001263085650 993105469 /nfs/dbraw/zinc/10/54/69/993105469.db2.gz HZXXCRCNQYXWJZ-BBBLOLIVSA-N 1 2 248.317 2.006 20 0 BEADLO CCOC(=O)c1csc(C[N@H+](C)C(C)C)n1 ZINC000378711003 993197819 /nfs/dbraw/zinc/19/78/19/993197819.db2.gz LDXMYQLHSVVGRR-UHFFFAOYSA-N 1 2 242.344 2.160 20 0 BEADLO CCOC(=O)c1csc(C[N@@H+](C)C(C)C)n1 ZINC000378711003 993197824 /nfs/dbraw/zinc/19/78/24/993197824.db2.gz LDXMYQLHSVVGRR-UHFFFAOYSA-N 1 2 242.344 2.160 20 0 BEADLO CC(C)(C)[NH+]1CC(Oc2ncccc2F)C1 ZINC000585654377 993285502 /nfs/dbraw/zinc/28/55/02/993285502.db2.gz QXZUTVRTYQMHGQ-UHFFFAOYSA-N 1 2 224.279 2.082 20 0 BEADLO Cn1c[nH+]cc1CCCOC(=O)C1=CCCC1 ZINC001263510136 993352220 /nfs/dbraw/zinc/35/22/20/993352220.db2.gz SEIIVFMUPANUNN-UHFFFAOYSA-N 1 2 234.299 2.006 20 0 BEADLO Cc1ccnc(C[NH2+][C@@H]2C[C@@H](C)n3ccnc32)c1 ZINC000385979378 993674662 /nfs/dbraw/zinc/67/46/62/993674662.db2.gz NWYYTBWSTFVRQS-DGCLKSJQSA-N 1 2 242.326 2.382 20 0 BEADLO N#Cc1cc(-c2ccc[nH+]c2N)ccc1F ZINC000390050447 993776624 /nfs/dbraw/zinc/77/66/24/993776624.db2.gz HFOXDGFKQDTVKM-UHFFFAOYSA-N 1 2 213.215 2.342 20 0 BEADLO C[C@H]1CC(=O)CC[N@@H+]1CCOCc1ccccc1 ZINC000390071480 993777445 /nfs/dbraw/zinc/77/74/45/993777445.db2.gz LJSRDBLFTIWASM-ZDUSSCGKSA-N 1 2 247.338 2.257 20 0 BEADLO C[C@H]1CC(=O)CC[N@H+]1CCOCc1ccccc1 ZINC000390071480 993777452 /nfs/dbraw/zinc/77/74/52/993777452.db2.gz LJSRDBLFTIWASM-ZDUSSCGKSA-N 1 2 247.338 2.257 20 0 BEADLO c1cc2cc(NC3CCOCC3)[nH+]cc2[nH]1 ZINC000390180693 993781010 /nfs/dbraw/zinc/78/10/10/993781010.db2.gz JRMIBILCGAFPJB-UHFFFAOYSA-N 1 2 217.272 2.154 20 0 BEADLO Cc1cc(C[NH2+]Cc2cc[nH]n2)cnc1Cl ZINC000390671784 993800325 /nfs/dbraw/zinc/80/03/25/993800325.db2.gz VQNWRNYGABTDEG-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO CO[C@H]1CCN(c2cc(C)[nH+]c(C3CCC3)n2)C1 ZINC001333668316 994491596 /nfs/dbraw/zinc/49/15/96/994491596.db2.gz LBPJCLBBVVJBRV-LBPRGKRZSA-N 1 2 247.342 2.278 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)c1ccns1 ZINC001297440708 994867664 /nfs/dbraw/zinc/86/76/64/994867664.db2.gz UNBQLKQTDBWBGN-UHFFFAOYSA-N 1 2 244.279 2.043 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1cccc(OC)c1C ZINC001300815845 995057575 /nfs/dbraw/zinc/05/75/75/995057575.db2.gz KZFGSOUXBDMHKJ-LBPRGKRZSA-N 1 2 248.326 2.036 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1cccc(OC)c1C ZINC001300815845 995057586 /nfs/dbraw/zinc/05/75/86/995057586.db2.gz KZFGSOUXBDMHKJ-LBPRGKRZSA-N 1 2 248.326 2.036 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)C2=CCCC2)[nH+]1 ZINC001304107832 995188973 /nfs/dbraw/zinc/18/89/73/995188973.db2.gz MBVOCXZFLSVANY-UHFFFAOYSA-N 1 2 233.315 2.260 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)C2=CCCC2)c[nH+]1 ZINC001304107832 995188978 /nfs/dbraw/zinc/18/89/78/995188978.db2.gz MBVOCXZFLSVANY-UHFFFAOYSA-N 1 2 233.315 2.260 20 0 BEADLO CN(c1ccc(O)cc1)c1[nH+]cccc1N ZINC000020317440 1170150176 /nfs/dbraw/zinc/15/01/76/1170150176.db2.gz TVBCRDQNHGDRIM-UHFFFAOYSA-N 1 2 215.256 2.137 20 0 BEADLO Cc1occc1C[NH2+][C@H](c1nncn1C)C(C)C ZINC001620932004 1170169648 /nfs/dbraw/zinc/16/96/48/1170169648.db2.gz UHBRWECIUIYREI-LBPRGKRZSA-N 1 2 248.330 2.203 20 0 BEADLO C=C=CCNC(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC001623032177 1170193852 /nfs/dbraw/zinc/19/38/52/1170193852.db2.gz IYYYRRWRCIAJAI-UHFFFAOYSA-N 1 2 242.282 2.105 20 0 BEADLO CCc1cc(N(CC)CC)nc(CC)[nH+]1 ZINC001611734042 1170444485 /nfs/dbraw/zinc/44/44/85/1170444485.db2.gz YKTUQFVRSFUNJL-UHFFFAOYSA-N 1 2 207.321 2.448 20 0 BEADLO CC[C@@H]1CCN(C(=O)[C@@H](C)Cc2c[nH]c[nH+]2)[C@@H]1C ZINC001616974294 1170574232 /nfs/dbraw/zinc/57/42/32/1170574232.db2.gz LCWLXNQAAQNFNE-QJPTWQEYSA-N 1 2 249.358 2.235 20 0 BEADLO CC[C@@H]1CCN(C(=O)[C@@H](C)Cc2c[nH+]c[nH]2)[C@@H]1C ZINC001616974294 1170574234 /nfs/dbraw/zinc/57/42/34/1170574234.db2.gz LCWLXNQAAQNFNE-QJPTWQEYSA-N 1 2 249.358 2.235 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)Nc1cccc2cc[nH]c21 ZINC001617195931 1170582432 /nfs/dbraw/zinc/58/24/32/1170582432.db2.gz KXIYSNNHSAHNIS-UHFFFAOYSA-N 1 2 240.266 2.072 20 0 BEADLO CCc1cccc(NC(=O)Cc2c[nH]c[nH+]2)c1 ZINC001618129050 1170618198 /nfs/dbraw/zinc/61/81/98/1170618198.db2.gz RLFMCBKJBOIWCU-UHFFFAOYSA-N 1 2 229.283 2.153 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1ccccc1C ZINC001618518671 1170639183 /nfs/dbraw/zinc/63/91/83/1170639183.db2.gz LVTQLCYOULZRJQ-LBPRGKRZSA-N 1 2 218.300 2.028 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1ccccc1C ZINC001618518671 1170639188 /nfs/dbraw/zinc/63/91/88/1170639188.db2.gz LVTQLCYOULZRJQ-LBPRGKRZSA-N 1 2 218.300 2.028 20 0 BEADLO CCC(=O)N[C@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC000018048087 1170663225 /nfs/dbraw/zinc/66/32/25/1170663225.db2.gz WZWRNGJYAIQIMX-LLVKDONJSA-N 1 2 243.310 2.460 20 0 BEADLO C[C@H]([NH2+]Cc1cc[nH]n1)c1cc2cnccc2o1 ZINC001620528310 1170677713 /nfs/dbraw/zinc/67/77/13/1170677713.db2.gz HYAWWXFSIYKGFG-VIFPVBQESA-N 1 2 242.282 2.402 20 0 BEADLO C[C@H](O)CCC[N@@H+]1CC(F)(F)CC[C@@H]1C ZINC001620664311 1170700291 /nfs/dbraw/zinc/70/02/91/1170700291.db2.gz CMDXKTQYZPCODZ-UWVGGRQHSA-N 1 2 221.291 2.267 20 0 BEADLO C[C@H](O)CCC[N@H+]1CC(F)(F)CC[C@@H]1C ZINC001620664311 1170700293 /nfs/dbraw/zinc/70/02/93/1170700293.db2.gz CMDXKTQYZPCODZ-UWVGGRQHSA-N 1 2 221.291 2.267 20 0 BEADLO CC(=O)N[C@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC000023563885 1170745672 /nfs/dbraw/zinc/74/56/72/1170745672.db2.gz HPQLAYZRGRDZHB-SNVBAGLBSA-N 1 2 229.283 2.069 20 0 BEADLO CCc1noc(C)c1C[NH2+]Cc1ccncc1F ZINC001621350043 1170779219 /nfs/dbraw/zinc/77/92/19/1170779219.db2.gz ZYURIVOUKZCSBS-UHFFFAOYSA-N 1 2 249.289 2.369 20 0 BEADLO Cc1ccnc(C[NH2+]Cc2ccncc2F)c1 ZINC001621503686 1170831492 /nfs/dbraw/zinc/83/14/92/1170831492.db2.gz IUKQHQDZQRGJCF-UHFFFAOYSA-N 1 2 231.274 2.214 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1cc(F)ccc1N ZINC000036322335 1170913637 /nfs/dbraw/zinc/91/36/37/1170913637.db2.gz ZKLMPOFBGGJKEK-GFCCVEGCSA-N 1 2 238.306 2.019 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1cc(F)ccc1N ZINC000036322335 1170913641 /nfs/dbraw/zinc/91/36/41/1170913641.db2.gz ZKLMPOFBGGJKEK-GFCCVEGCSA-N 1 2 238.306 2.019 20 0 BEADLO C[C@@H]1C[C@H]1c1[nH]c2cc3c(cc2[nH+]1)OCCO3 ZINC000037400494 1170941446 /nfs/dbraw/zinc/94/14/46/1170941446.db2.gz ADPKWYQMWRMXHC-HTQZYQBOSA-N 1 2 230.267 2.458 20 0 BEADLO C[C@H]1C[C@@H]1c1[nH]c2cc3c(cc2[nH+]1)OCCO3 ZINC000037400493 1170941822 /nfs/dbraw/zinc/94/18/22/1170941822.db2.gz ADPKWYQMWRMXHC-YUMQZZPRSA-N 1 2 230.267 2.458 20 0 BEADLO O=C(CCF)Nc1ccccc1-n1cc[nH+]c1 ZINC001625354203 1171097020 /nfs/dbraw/zinc/09/70/20/1171097020.db2.gz WGZOLKBTTWTWDS-UHFFFAOYSA-N 1 2 233.246 2.170 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)[C@@H]1CCC(C)(C)C1 ZINC001626777742 1171135130 /nfs/dbraw/zinc/13/51/30/1171135130.db2.gz CLKWRHIFXMQCHS-LLVKDONJSA-N 1 2 249.358 2.298 20 0 BEADLO COc1cc2[nH]c([C@@H]3CCOC3)[nH+]c2cc1OC ZINC000042173531 1171211422 /nfs/dbraw/zinc/21/14/22/1171211422.db2.gz JUWAUABNZPBJCU-MRVPVSSYSA-N 1 2 248.282 2.084 20 0 BEADLO Cc1cccc(C[N@@H+](C)CC(=O)OC(C)C)c1 ZINC000042252564 1171215510 /nfs/dbraw/zinc/21/55/10/1171215510.db2.gz IZWBODKJTKYIHT-UHFFFAOYSA-N 1 2 235.327 2.378 20 0 BEADLO Cc1cccc(C[N@H+](C)CC(=O)OC(C)C)c1 ZINC000042252564 1171215517 /nfs/dbraw/zinc/21/55/17/1171215517.db2.gz IZWBODKJTKYIHT-UHFFFAOYSA-N 1 2 235.327 2.378 20 0 BEADLO C[N@@H+](CC(=O)c1ccccc1)C[C@H]1CCCCO1 ZINC000042464985 1171230944 /nfs/dbraw/zinc/23/09/44/1171230944.db2.gz BSZNANGHZDQDKC-CQSZACIVSA-N 1 2 247.338 2.370 20 0 BEADLO C[N@H+](CC(=O)c1ccccc1)C[C@H]1CCCCO1 ZINC000042464985 1171230947 /nfs/dbraw/zinc/23/09/47/1171230947.db2.gz BSZNANGHZDQDKC-CQSZACIVSA-N 1 2 247.338 2.370 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC1C[C@@H](C)C[C@H](C)C1 ZINC001629577831 1171329609 /nfs/dbraw/zinc/32/96/09/1171329609.db2.gz RFOVLCXHLWGWIN-UWVGGRQHSA-N 1 2 249.358 2.202 20 0 BEADLO CCCCCCNC(=O)[C@H](C)n1cc[nH+]c1 ZINC000045878983 1171466046 /nfs/dbraw/zinc/46/60/46/1171466046.db2.gz VLWLCSPEADETQE-NSHDSACASA-N 1 2 223.320 2.141 20 0 BEADLO Cc1cccc(F)c1NC(=O)Cc1c[nH]c[nH+]1 ZINC001631751872 1171474429 /nfs/dbraw/zinc/47/44/29/1171474429.db2.gz QNUKORWTTWLHPA-UHFFFAOYSA-N 1 2 233.246 2.038 20 0 BEADLO C[C@H](C(=O)N1CCc2ccccc21)n1cc[nH+]c1 ZINC000049247826 1171681685 /nfs/dbraw/zinc/68/16/85/1171681685.db2.gz RSZZOLOYZJALGL-LLVKDONJSA-N 1 2 241.294 2.033 20 0 BEADLO C[C@@H](NC(=O)[C@H](C)n1cc[nH+]c1)c1ccccc1 ZINC000049215276 1171683419 /nfs/dbraw/zinc/68/34/19/1171683419.db2.gz XCGSALJTLKMEAL-NEPJUHHUSA-N 1 2 243.310 2.322 20 0 BEADLO C[C@H]1CC(=O)CC[N@@H+]1CCc1ccccc1F ZINC000049708309 1171722523 /nfs/dbraw/zinc/72/25/23/1171722523.db2.gz QFFJOTQEWXDABB-NSHDSACASA-N 1 2 235.302 2.422 20 0 BEADLO C[C@H]1CC(=O)CC[N@H+]1CCc1ccccc1F ZINC000049708309 1171722527 /nfs/dbraw/zinc/72/25/27/1171722527.db2.gz QFFJOTQEWXDABB-NSHDSACASA-N 1 2 235.302 2.422 20 0 BEADLO CCc1[nH]c(CNC(=O)C[C@@H]2CCC[C@@H]2C)c[nH+]1 ZINC001635610463 1171743192 /nfs/dbraw/zinc/74/31/92/1171743192.db2.gz MQTFXOQLTXGBAH-QWRGUYRKSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)C[C@@H]2CCC[C@@H]2C)[nH+]1 ZINC001635610463 1171743201 /nfs/dbraw/zinc/74/32/01/1171743201.db2.gz MQTFXOQLTXGBAH-QWRGUYRKSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H](C)[C@@H](C)CC)c[nH+]1 ZINC001635610303 1171743701 /nfs/dbraw/zinc/74/37/01/1171743701.db2.gz GTTRTZRBPIGHBQ-UWVGGRQHSA-N 1 2 237.347 2.271 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H](C)[C@@H](C)CC)[nH+]1 ZINC001635610303 1171743709 /nfs/dbraw/zinc/74/37/09/1171743709.db2.gz GTTRTZRBPIGHBQ-UWVGGRQHSA-N 1 2 237.347 2.271 20 0 BEADLO [NH3+][C@@H](c1nnc(C2CCC2)o1)c1ccccc1 ZINC000050284003 1171787754 /nfs/dbraw/zinc/78/77/54/1171787754.db2.gz QZDSDWSSYWNULZ-LLVKDONJSA-N 1 2 229.283 2.385 20 0 BEADLO CCCc1nnc([C@@H]([NH3+])c2ccccc2)o1 ZINC000050283997 1171788302 /nfs/dbraw/zinc/78/83/02/1171788302.db2.gz MPKKCWDHUMSIOC-NSHDSACASA-N 1 2 217.272 2.070 20 0 BEADLO CCO[C@H]1CCC[N@@H+]([C@H](C)c2csnn2)C1 ZINC000649318230 398142690 /nfs/dbraw/zinc/14/26/90/398142690.db2.gz FOLDEVCPQCPIEF-ZJUUUORDSA-N 1 2 241.360 2.100 20 0 BEADLO CCO[C@H]1CCC[N@H+]([C@H](C)c2csnn2)C1 ZINC000649318230 398142693 /nfs/dbraw/zinc/14/26/93/398142693.db2.gz FOLDEVCPQCPIEF-ZJUUUORDSA-N 1 2 241.360 2.100 20 0 BEADLO c1nn[nH]c1C[NH+]1CCC(C2CCCC2)CC1 ZINC000649325646 398145237 /nfs/dbraw/zinc/14/52/37/398145237.db2.gz PAXZIPCWIOQMKD-UHFFFAOYSA-N 1 2 234.347 2.207 20 0 BEADLO c1[nH]nnc1C[NH+]1CCC(C2CCCC2)CC1 ZINC000649325646 398145238 /nfs/dbraw/zinc/14/52/38/398145238.db2.gz PAXZIPCWIOQMKD-UHFFFAOYSA-N 1 2 234.347 2.207 20 0 BEADLO c1n[nH]nc1C[NH+]1CCC(C2CCCC2)CC1 ZINC000649325646 398145241 /nfs/dbraw/zinc/14/52/41/398145241.db2.gz PAXZIPCWIOQMKD-UHFFFAOYSA-N 1 2 234.347 2.207 20 0 BEADLO CC(C)n1cc([C@H](C)[NH2+]Cc2ncc[nH]2)cn1 ZINC000602285481 349492116 /nfs/dbraw/zinc/49/21/16/349492116.db2.gz BXMLCHOTGTUKDO-JTQLQIEISA-N 1 2 233.319 2.038 20 0 BEADLO CC(C)[N@H+](Cc1ccn(C)n1)Cc1cccnc1 ZINC000336735542 187322877 /nfs/dbraw/zinc/32/28/77/187322877.db2.gz XKIKVMNQVABIMR-UHFFFAOYSA-N 1 2 244.342 2.226 20 0 BEADLO CC(C)[N@@H+](Cc1ccn(C)n1)Cc1cccnc1 ZINC000336735542 187322878 /nfs/dbraw/zinc/32/28/78/187322878.db2.gz XKIKVMNQVABIMR-UHFFFAOYSA-N 1 2 244.342 2.226 20 0 BEADLO COc1ccc(C[NH2+][C@H](C)C(F)F)cc1O ZINC000389936636 398151185 /nfs/dbraw/zinc/15/11/85/398151185.db2.gz NDKSTLJMGZZSKT-SSDOTTSWSA-N 1 2 231.242 2.144 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3ccc(O)cc3C2)on1 ZINC000336345293 178004053 /nfs/dbraw/zinc/00/40/53/178004053.db2.gz WZOGREDZXWVAAZ-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO Cc1cc(C[N@H+]2CCc3ccc(O)cc3C2)on1 ZINC000336345293 178004055 /nfs/dbraw/zinc/00/40/55/178004055.db2.gz WZOGREDZXWVAAZ-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO CCC(CC)C(=O)N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000371044342 168335313 /nfs/dbraw/zinc/33/53/13/168335313.db2.gz OJPVBEVMKFZGEG-GFCCVEGCSA-N 1 2 249.358 2.172 20 0 BEADLO Cc1cc(NC(=O)NCC2CC(C)(C)C2)cc[nH+]1 ZINC000548407333 398168093 /nfs/dbraw/zinc/16/80/93/398168093.db2.gz AAQBDAVPPFHMDD-UHFFFAOYSA-N 1 2 247.342 2.370 20 0 BEADLO Cc1cc(C[NH2+]Cc2cc(O)cc(F)c2)on1 ZINC000184141783 178024283 /nfs/dbraw/zinc/02/42/83/178024283.db2.gz LFLULRXLWSOOBN-UHFFFAOYSA-N 1 2 236.246 2.118 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000649907989 398182892 /nfs/dbraw/zinc/18/28/92/398182892.db2.gz DNBLWHIPKNEYJO-IONNQARKSA-N 1 2 245.298 2.330 20 0 BEADLO C[C@@H](c1csnn1)[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000649907989 398182893 /nfs/dbraw/zinc/18/28/93/398182893.db2.gz DNBLWHIPKNEYJO-IONNQARKSA-N 1 2 245.298 2.330 20 0 BEADLO Cc1cc(C[NH2+]Cc2cccc(F)c2)no1 ZINC000044692177 178025950 /nfs/dbraw/zinc/02/59/50/178025950.db2.gz MJRKEGPYQXYXCI-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO Cc1cc(C[NH2+]Cc2cnc(C)s2)no1 ZINC000044693274 178026235 /nfs/dbraw/zinc/02/62/35/178026235.db2.gz PJDIKRGTEJAFOB-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2cc(C)nc(C)n2)no1 ZINC000340533979 178030468 /nfs/dbraw/zinc/03/04/68/178030468.db2.gz KPNAGPKCGYSVMZ-JTQLQIEISA-N 1 2 246.314 2.241 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ccncc2F)on1 ZINC000338341317 178030598 /nfs/dbraw/zinc/03/05/98/178030598.db2.gz GKRRMBIIYSATMY-VIFPVBQESA-N 1 2 235.262 2.368 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ncn(C)n2)ccc1F ZINC000275392754 178030816 /nfs/dbraw/zinc/03/08/16/178030816.db2.gz AZLLTLMSENAQCJ-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO Cc1cc(C[NH2+][C@@H]2COCc3ccccc32)no1 ZINC000225996405 178035839 /nfs/dbraw/zinc/03/58/39/178035839.db2.gz VLNOICKNOFFCEG-CQSZACIVSA-N 1 2 244.294 2.344 20 0 BEADLO Cc1cc(C[NH2+][C@@](C)(C(N)=O)C(C)C)no1 ZINC000330364213 178037037 /nfs/dbraw/zinc/03/70/37/178037037.db2.gz HGJLDHXBWWIJRU-LLVKDONJSA-N 1 2 225.292 2.023 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2ccccn2)on1 ZINC000044985541 178038542 /nfs/dbraw/zinc/03/85/42/178038542.db2.gz WBKFJQAPRRCOEM-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO F[C@]1(c2ccccc2)C[C@@H]1NCc1[nH]cc[nH+]1 ZINC000424204293 398174789 /nfs/dbraw/zinc/17/47/89/398174789.db2.gz VIGWXFKGHTUWLB-AAEUAGOBSA-N 1 2 231.274 2.137 20 0 BEADLO F[C@]1(c2ccccc2)C[C@@H]1[NH2+]Cc1ncc[nH]1 ZINC000424204293 398174790 /nfs/dbraw/zinc/17/47/90/398174790.db2.gz VIGWXFKGHTUWLB-AAEUAGOBSA-N 1 2 231.274 2.137 20 0 BEADLO Cc1cc(CNc2cccc[nH+]2)nc(C)n1 ZINC000309707370 178045012 /nfs/dbraw/zinc/04/50/12/178045012.db2.gz PCVSLMRTKGFCIS-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO Cc1nc(C[N@H+]2CCS[C@H](C)[C@H]2C)co1 ZINC000647964532 398177828 /nfs/dbraw/zinc/17/78/28/398177828.db2.gz NKEFLABERFUGDM-RKDXNWHRSA-N 1 2 226.345 2.309 20 0 BEADLO Cc1nc(C[N@@H+]2CCS[C@H](C)[C@H]2C)co1 ZINC000647964532 398177831 /nfs/dbraw/zinc/17/78/31/398177831.db2.gz NKEFLABERFUGDM-RKDXNWHRSA-N 1 2 226.345 2.309 20 0 BEADLO Cc1nocc1CNc1c[nH+]ccc1C ZINC000293212896 398178513 /nfs/dbraw/zinc/17/85/13/398178513.db2.gz JMEPNZGUWDCTIF-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO Cc1cc(Cl)nc(C[NH2+]Cc2cocn2)c1 ZINC000282160315 178071844 /nfs/dbraw/zinc/07/18/44/178071844.db2.gz XSRKHHFSFHTEGN-UHFFFAOYSA-N 1 2 237.690 2.321 20 0 BEADLO CCC(CC)C(=O)NCc1cn2ccccc2[nH+]1 ZINC000070754510 168338278 /nfs/dbraw/zinc/33/82/78/168338278.db2.gz HCCFIDCOPKGCKF-UHFFFAOYSA-N 1 2 245.326 2.387 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+]1CCO[C@@H](C)C1 ZINC000179865038 178085464 /nfs/dbraw/zinc/08/54/64/178085464.db2.gz WQZQNQXUBUBQQJ-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cc(F)ccc1C[N@H+]1CCO[C@@H](C)C1 ZINC000179865038 178085468 /nfs/dbraw/zinc/08/54/68/178085468.db2.gz WQZQNQXUBUBQQJ-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cc(F)ccc1C[NH2+]Cc1ccn[nH]1 ZINC000050577377 178087225 /nfs/dbraw/zinc/08/72/25/178087225.db2.gz MKNGRHYORUNNOA-UHFFFAOYSA-N 1 2 219.263 2.147 20 0 BEADLO CCC(CC)C(=O)NCc1ccn2cc[nH+]c2c1 ZINC000178366576 168338591 /nfs/dbraw/zinc/33/85/91/168338591.db2.gz QBADAACBSICEMA-UHFFFAOYSA-N 1 2 245.326 2.387 20 0 BEADLO Cc1cc(F)ccc1NCc1c[nH+]c[nH]1 ZINC000054763345 178089951 /nfs/dbraw/zinc/08/99/51/178089951.db2.gz IMSQHTHSJIVQBU-UHFFFAOYSA-N 1 2 205.236 2.469 20 0 BEADLO Cc1cc(F)ccc1NCc1c[nH]c[nH+]1 ZINC000054763345 178089952 /nfs/dbraw/zinc/08/99/52/178089952.db2.gz IMSQHTHSJIVQBU-UHFFFAOYSA-N 1 2 205.236 2.469 20 0 BEADLO Cc1cc([NH+](C)C)ccc1NCc1cc[nH]n1 ZINC000057668012 178095032 /nfs/dbraw/zinc/09/50/32/178095032.db2.gz CRMJAKDCVMPQNR-UHFFFAOYSA-N 1 2 230.315 2.396 20 0 BEADLO Cc1cc(N(C)[C@@H](C)c2ccccn2)nc[nH+]1 ZINC000301258329 178101000 /nfs/dbraw/zinc/10/10/00/178101000.db2.gz KWHHZXLXXJQOIS-NSHDSACASA-N 1 2 228.299 2.377 20 0 BEADLO CCO[C@H]1C[C@@H](Nc2cc(NC3CC3)[nH+]cn2)C1 ZINC000576248090 365536850 /nfs/dbraw/zinc/53/68/50/365536850.db2.gz HHMLNFMINCPQHL-PHIMTYICSA-N 1 2 248.330 2.030 20 0 BEADLO CCO[C@H]1C[C@@H](Nc2cc(NC3CC3)nc[nH+]2)C1 ZINC000576248090 365536853 /nfs/dbraw/zinc/53/68/53/365536853.db2.gz HHMLNFMINCPQHL-PHIMTYICSA-N 1 2 248.330 2.030 20 0 BEADLO Cc1cc(N2CCCO[C@@H](C)C2)nc(C2CC2)[nH+]1 ZINC000172014994 178115385 /nfs/dbraw/zinc/11/53/85/178115385.db2.gz ZVZCWRRHBRMADY-NSHDSACASA-N 1 2 247.342 2.278 20 0 BEADLO Cc1cc(NC(=O)NC2CC(C)C2)cc[nH+]1 ZINC000271008533 178138542 /nfs/dbraw/zinc/13/85/42/178138542.db2.gz HLXUDRMVYRTHJN-UHFFFAOYSA-N 1 2 219.288 2.310 20 0 BEADLO Cc1cc(N2CC[C@@H](CO)[C@@H]2C)nc(C(C)C)[nH+]1 ZINC000362671598 178117216 /nfs/dbraw/zinc/11/72/16/178117216.db2.gz XUVWIAMKGZGKQK-RYUDHWBXSA-N 1 2 249.358 2.116 20 0 BEADLO Cc1cc(N2CC[C@@H]([C@@H](C)O)C2)nc(C(C)C)[nH+]1 ZINC000162661329 178118053 /nfs/dbraw/zinc/11/80/53/178118053.db2.gz CXSJULJAMUMUHC-VXGBXAGGSA-N 1 2 249.358 2.116 20 0 BEADLO Cc1cc(NC(=O)C(F)(F)C(F)F)cc[nH+]1 ZINC000226643320 178125518 /nfs/dbraw/zinc/12/55/18/178125518.db2.gz BIWINGJYSAYUNB-UHFFFAOYSA-N 1 2 236.168 2.229 20 0 BEADLO Cc1cc(NC(=O)CC(F)(F)F)cc[nH+]1 ZINC000082268647 178127049 /nfs/dbraw/zinc/12/70/49/178127049.db2.gz JHNPBMXNYXHDMM-UHFFFAOYSA-N 1 2 218.178 2.281 20 0 BEADLO Cc1cc(NC(=O)C2CCSCC2)cc[nH+]1 ZINC000264831803 178127116 /nfs/dbraw/zinc/12/71/16/178127116.db2.gz AJYSVIBTALGOGQ-UHFFFAOYSA-N 1 2 236.340 2.472 20 0 BEADLO Cc1cc(NC(=O)C2[C@@H]3CCC[C@H]23)cc[nH+]1 ZINC000178090877 178127186 /nfs/dbraw/zinc/12/71/86/178127186.db2.gz RGYZYNIJOHZBBQ-FOSCPWQOSA-N 1 2 216.284 2.375 20 0 BEADLO CCc1cc(N2C[C@H](C)OC[C@@H]2CC)nc(C)[nH+]1 ZINC000272811267 538926587 /nfs/dbraw/zinc/92/65/87/538926587.db2.gz COBBIAYFYPKFOH-GWCFXTLKSA-N 1 2 249.358 2.351 20 0 BEADLO Cc1cc(NC(=O)N(C)C2CCC2)cc[nH+]1 ZINC000119820277 178135363 /nfs/dbraw/zinc/13/53/63/178135363.db2.gz BLZGDNPORLDTNJ-UHFFFAOYSA-N 1 2 219.288 2.406 20 0 BEADLO Cc1cc(NC(=O)N(C)CC2CC2)cc[nH+]1 ZINC000119764637 178135667 /nfs/dbraw/zinc/13/56/67/178135667.db2.gz KBXUDXNAODNUCB-UHFFFAOYSA-N 1 2 219.288 2.264 20 0 BEADLO CCC(CC)C(=O)Nc1ccc(N)[nH+]c1 ZINC000061680338 168341737 /nfs/dbraw/zinc/34/17/37/168341737.db2.gz HAJOLBNTNQTMPF-UHFFFAOYSA-N 1 2 207.277 2.039 20 0 BEADLO Cc1cc(NC(=O)N2CCC[C@@H]2C)cc[nH+]1 ZINC000119710532 178136868 /nfs/dbraw/zinc/13/68/68/178136868.db2.gz WTZRQQCHQDHABN-JTQLQIEISA-N 1 2 219.288 2.406 20 0 BEADLO Cc1cc(NC(=O)NCc2nccs2)cc[nH+]1 ZINC000119421264 178140232 /nfs/dbraw/zinc/14/02/32/178140232.db2.gz TTZHCZQVLRFYRJ-UHFFFAOYSA-N 1 2 248.311 2.168 20 0 BEADLO Cc1cc(NC(=O)NC[C@@H]2C[C@H]2C)cc[nH+]1 ZINC000271079476 178140627 /nfs/dbraw/zinc/14/06/27/178140627.db2.gz QGQGXSXUXUEYNW-SCZZXKLOSA-N 1 2 219.288 2.168 20 0 BEADLO Cc1cc(NC(=O)NC[C@@H]2C[C@@H]2C)cc[nH+]1 ZINC000271079482 178140663 /nfs/dbraw/zinc/14/06/63/178140663.db2.gz QGQGXSXUXUEYNW-WPRPVWTQSA-N 1 2 219.288 2.168 20 0 BEADLO CCc1cc(N[C@H](C)c2cnccn2)nc[nH+]1 ZINC000649412279 398214006 /nfs/dbraw/zinc/21/40/06/398214006.db2.gz OIMRNASSZRDHLQ-SECBINFHSA-N 1 2 229.287 2.002 20 0 BEADLO Cc1cc(NC(=O)NC[C@H]2CCCCO2)cc[nH+]1 ZINC000271158791 178140963 /nfs/dbraw/zinc/14/09/63/178140963.db2.gz VLBJGEPXUVIOAG-GFCCVEGCSA-N 1 2 249.314 2.081 20 0 BEADLO Cc1cc(NC(=O)[C@@H](C)C2CC2)cc[nH+]1 ZINC000175329621 178143194 /nfs/dbraw/zinc/14/31/94/178143194.db2.gz BXEIFRQIZJFFGJ-VIFPVBQESA-N 1 2 204.273 2.375 20 0 BEADLO Cc1cc(NCC(F)F)nc(C2CC2)[nH+]1 ZINC000173988153 178156366 /nfs/dbraw/zinc/15/63/66/178156366.db2.gz CWEXXLGSJDPAFA-UHFFFAOYSA-N 1 2 213.231 2.339 20 0 BEADLO Cc1cc(NCC(C)(C)[C@@H](O)C(C)C)nc[nH+]1 ZINC000301831301 178157086 /nfs/dbraw/zinc/15/70/86/178157086.db2.gz SOYBPAGDYAIJRO-LBPRGKRZSA-N 1 2 237.347 2.240 20 0 BEADLO Cc1cc(NC[C@@H](O)c2ccccc2F)nc[nH+]1 ZINC000301222876 178164646 /nfs/dbraw/zinc/16/46/46/178164646.db2.gz DCZAKNJZVDDJLL-GFCCVEGCSA-N 1 2 247.273 2.070 20 0 BEADLO Cc1cc(NC[C@](C)(O)c2ccccc2)nc[nH+]1 ZINC000301262426 178169979 /nfs/dbraw/zinc/16/99/79/178169979.db2.gz HDJWSZPQXBUBJK-AWEZNQCLSA-N 1 2 243.310 2.105 20 0 BEADLO Cc1cc(NCc2ncccc2C)nc[nH+]1 ZINC000070909232 178176937 /nfs/dbraw/zinc/17/69/37/178176937.db2.gz HVMZVTPWOFCOPO-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO Cc1cc(N[C@@H](C)C[C@@H]2CCCO2)nc[nH+]1 ZINC000110484402 178178554 /nfs/dbraw/zinc/17/85/54/178178554.db2.gz MWSQNYBOBPUWRT-QWRGUYRKSA-N 1 2 221.304 2.155 20 0 BEADLO Cc1cc(N[C@@H](C)[C@@H](C)CO)nc(C(C)C)[nH+]1 ZINC000134959444 178178800 /nfs/dbraw/zinc/17/88/00/178178800.db2.gz WACDQXXAEXDXDX-ONGXEEELSA-N 1 2 237.347 2.337 20 0 BEADLO Cc1cc(N[C@@H](CCO)c2cccs2)nc[nH+]1 ZINC000301382523 178180847 /nfs/dbraw/zinc/18/08/47/178180847.db2.gz ZFGXFXNJVIVXBR-JTQLQIEISA-N 1 2 249.339 2.382 20 0 BEADLO Cc1cc(N[C@@H](C)c2nc[nH]n2)nc(C(C)C)[nH+]1 ZINC000226500380 178181341 /nfs/dbraw/zinc/18/13/41/178181341.db2.gz WYIQPHUHGMJPNU-VIFPVBQESA-N 1 2 246.318 2.200 20 0 BEADLO Cc1cc(N[C@@H](C)c2nnc[nH]2)nc(C(C)C)[nH+]1 ZINC000226500380 178181343 /nfs/dbraw/zinc/18/13/43/178181343.db2.gz WYIQPHUHGMJPNU-VIFPVBQESA-N 1 2 246.318 2.200 20 0 BEADLO Cc1cc(N[C@@H]2CCCC[C@H]2CO)nc(C)[nH+]1 ZINC000132863224 178181623 /nfs/dbraw/zinc/18/16/23/178181623.db2.gz JKZQQIMMOPTDQC-NWDGAFQWSA-N 1 2 235.331 2.056 20 0 BEADLO Cc1cc(N[C@@H]2CCC[C@]2(C)CO)cc[nH+]1 ZINC000302528052 178181645 /nfs/dbraw/zinc/18/16/45/178181645.db2.gz BZBXAZYMCBHSTE-CHWSQXEVSA-N 1 2 220.316 2.353 20 0 BEADLO Cc1cc(N[C@@H]2CCOC3(CCC3)C2)nc[nH+]1 ZINC000362992131 178182788 /nfs/dbraw/zinc/18/27/88/178182788.db2.gz HDYFHPOSKKQUAF-LLVKDONJSA-N 1 2 233.315 2.299 20 0 BEADLO Cc1cc(N[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)nc[nH+]1 ZINC000301340694 178184353 /nfs/dbraw/zinc/18/43/53/178184353.db2.gz HYFQIEHTACFCKU-WCQGTBRESA-N 1 2 233.315 2.010 20 0 BEADLO Cc1cc(N[C@H](C)C[C@@H](C)O)nc(C(C)C)[nH+]1 ZINC000126931599 178185885 /nfs/dbraw/zinc/18/58/85/178185885.db2.gz GGKBLEOPLYBESA-MWLCHTKSSA-N 1 2 237.347 2.480 20 0 BEADLO Cc1cc(N[C@H](CCO)c2ccccc2)nc[nH+]1 ZINC000301370315 178187342 /nfs/dbraw/zinc/18/73/42/178187342.db2.gz SOKBQULTSHZKDM-CYBMUJFWSA-N 1 2 243.310 2.321 20 0 BEADLO O=C(CC1CCC1)Nc1cccc2[nH+]ccn21 ZINC000266633811 187332315 /nfs/dbraw/zinc/33/23/15/187332315.db2.gz JTWRICUXUBNULB-UHFFFAOYSA-N 1 2 229.283 2.463 20 0 BEADLO Cc1cc(N[C@H]2C[C@H](C)n3ccnc32)nc[nH+]1 ZINC000333742323 178192005 /nfs/dbraw/zinc/19/20/05/178192005.db2.gz WCXQNHMJBCIWFK-UWVGGRQHSA-N 1 2 229.287 2.099 20 0 BEADLO Nc1[nH+]cnc(N[C@@H]2CCC[C@H](F)C2)c1Cl ZINC000521037910 259302410 /nfs/dbraw/zinc/30/24/10/259302410.db2.gz VZCUKASTOZJNMA-NKWVEPMBSA-N 1 2 244.701 2.405 20 0 BEADLO Nc1nc[nH+]c(N[C@@H]2CCC[C@H](F)C2)c1Cl ZINC000521037910 259302412 /nfs/dbraw/zinc/30/24/12/259302412.db2.gz VZCUKASTOZJNMA-NKWVEPMBSA-N 1 2 244.701 2.405 20 0 BEADLO CC[C@@H]1C[NH+](Cc2[nH]ncc2C)C[C@@H](CC)O1 ZINC000421385472 192326425 /nfs/dbraw/zinc/32/64/25/192326425.db2.gz GMIGZEUGQAQZMN-VXGBXAGGSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H]1C[NH+](Cc2n[nH]cc2C)C[C@@H](CC)O1 ZINC000421385472 192326426 /nfs/dbraw/zinc/32/64/26/192326426.db2.gz GMIGZEUGQAQZMN-VXGBXAGGSA-N 1 2 237.347 2.108 20 0 BEADLO CC/C=C\C[NH2+]Cc1nn(C)c(C)c1Cl ZINC000421385684 192326774 /nfs/dbraw/zinc/32/67/74/192326774.db2.gz QUWFKNVKPMXRSE-WAYWQWQTSA-N 1 2 227.739 2.438 20 0 BEADLO Cn1c[nH+]cc1CNc1cc(F)cc(F)c1F ZINC000090167199 398228435 /nfs/dbraw/zinc/22/84/35/398228435.db2.gz KCEGPDUSYJFWMP-UHFFFAOYSA-N 1 2 241.216 2.450 20 0 BEADLO CC(C)CCCC(=O)N[C@H]1CCc2c[nH+]cn2C1 ZINC000650078454 398232429 /nfs/dbraw/zinc/23/24/29/398232429.db2.gz CRCGAZPNAWHJEG-LBPRGKRZSA-N 1 2 249.358 2.140 20 0 BEADLO CC(C)[C@H](C)N(C(=O)CCc1c[nH+]c[nH]1)C1CC1 ZINC000276640973 538933029 /nfs/dbraw/zinc/93/30/29/538933029.db2.gz UWYZQTPCICJZPR-NSHDSACASA-N 1 2 249.358 2.378 20 0 BEADLO CC(C)[C@H](C)N(C(=O)CCc1c[nH]c[nH+]1)C1CC1 ZINC000276640973 538933031 /nfs/dbraw/zinc/93/30/31/538933031.db2.gz UWYZQTPCICJZPR-NSHDSACASA-N 1 2 249.358 2.378 20 0 BEADLO COCc1cc(-c2c[nH]c[nH+]2)ccc1OC ZINC000649428813 398230397 /nfs/dbraw/zinc/23/03/97/398230397.db2.gz BUMKPALJRNFQJA-UHFFFAOYSA-N 1 2 218.256 2.232 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2c[nH]cn2)c(C)o1 ZINC000054765276 178228336 /nfs/dbraw/zinc/22/83/36/178228336.db2.gz RCPYOILUFNGTLP-SECBINFHSA-N 1 2 219.288 2.470 20 0 BEADLO CCC(CC)CNC(=O)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000366182518 168356808 /nfs/dbraw/zinc/35/68/08/168356808.db2.gz JTNVIASNGBSFGN-LLVKDONJSA-N 1 2 249.358 2.382 20 0 BEADLO CCC(CC)CNC(=O)[C@@H]1CCCc2[nH]c[nH+]c21 ZINC000366182518 168356809 /nfs/dbraw/zinc/35/68/09/168356809.db2.gz JTNVIASNGBSFGN-LLVKDONJSA-N 1 2 249.358 2.382 20 0 BEADLO C(c1n[nH]c(C2CC2)n1)[N@H+]1C[C@@H]2CCC[C@@H](C2)C1 ZINC000334317919 136225290 /nfs/dbraw/zinc/22/52/90/136225290.db2.gz REONGPPZHPZQFE-PHIMTYICSA-N 1 2 246.358 2.304 20 0 BEADLO C(c1n[nH]c(C2CC2)n1)[N@@H+]1C[C@@H]2CCC[C@@H](C2)C1 ZINC000334317919 136225291 /nfs/dbraw/zinc/22/52/91/136225291.db2.gz REONGPPZHPZQFE-PHIMTYICSA-N 1 2 246.358 2.304 20 0 BEADLO CC[C@@H](C)CN(CC)C(=O)CCc1c[nH+]c[nH]1 ZINC000280100040 538936503 /nfs/dbraw/zinc/93/65/03/538936503.db2.gz ZQPQXKKTKTXLHF-LLVKDONJSA-N 1 2 237.347 2.237 20 0 BEADLO CC[C@@H](C)CN(CC)C(=O)CCc1c[nH]c[nH+]1 ZINC000280100040 538936504 /nfs/dbraw/zinc/93/65/04/538936504.db2.gz ZQPQXKKTKTXLHF-LLVKDONJSA-N 1 2 237.347 2.237 20 0 BEADLO c1c[nH+]c(-c2ccccc2OC[C@@H]2CCOC2)[nH]1 ZINC000649434441 398235478 /nfs/dbraw/zinc/23/54/78/398235478.db2.gz LZFUASWEHKFCOK-LLVKDONJSA-N 1 2 244.294 2.492 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@@H](C)c2cn(C)nc2C)no1 ZINC000337568784 178253498 /nfs/dbraw/zinc/25/34/98/178253498.db2.gz ZSVNOTKVGHSNFF-ONGXEEELSA-N 1 2 248.330 2.437 20 0 BEADLO Cc1cnc(C)c(NCCc2cccc(C)[nH+]2)n1 ZINC000280409403 538937084 /nfs/dbraw/zinc/93/70/84/538937084.db2.gz JAUJXEBRSARTHU-UHFFFAOYSA-N 1 2 242.326 2.451 20 0 BEADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccn(C)n2)on1 ZINC000334149013 178240921 /nfs/dbraw/zinc/24/09/21/178240921.db2.gz DOABLHXZKOKFLF-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccn(C)n2)on1 ZINC000334149013 178240924 /nfs/dbraw/zinc/24/09/24/178240924.db2.gz DOABLHXZKOKFLF-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cnn(C)c2)no1 ZINC000368843884 178241988 /nfs/dbraw/zinc/24/19/88/178241988.db2.gz IELXYJRMXBVLPC-ZDUSSCGKSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cnn(C)c2)no1 ZINC000368843884 178241989 /nfs/dbraw/zinc/24/19/89/178241989.db2.gz IELXYJRMXBVLPC-ZDUSSCGKSA-N 1 2 246.314 2.054 20 0 BEADLO CC[C@H](C)C[C@@H](C)NC(=O)CCc1c[nH+]c[nH]1 ZINC000280313633 538937246 /nfs/dbraw/zinc/93/72/46/538937246.db2.gz YQSZDIBEIFPXNP-WDEREUQCSA-N 1 2 237.347 2.283 20 0 BEADLO CC[C@H](C)C[C@@H](C)NC(=O)CCc1c[nH]c[nH+]1 ZINC000280313633 538937248 /nfs/dbraw/zinc/93/72/48/538937248.db2.gz YQSZDIBEIFPXNP-WDEREUQCSA-N 1 2 237.347 2.283 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@H](OC)C2)cs1 ZINC000076344946 398236414 /nfs/dbraw/zinc/23/64/14/398236414.db2.gz UTAYMYYGVDKFTG-NSHDSACASA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@H](OC)C2)cs1 ZINC000076344946 398236416 /nfs/dbraw/zinc/23/64/16/398236416.db2.gz UTAYMYYGVDKFTG-NSHDSACASA-N 1 2 240.372 2.316 20 0 BEADLO CCCC[C@H]1CCC[C@H]1[NH2+]Cc1c[nH]nn1 ZINC000649430968 398233396 /nfs/dbraw/zinc/23/33/96/398233396.db2.gz HTFVPPZFYCKSLY-CMPLNLGQSA-N 1 2 222.336 2.253 20 0 BEADLO CCCC[C@H]1CCC[C@H]1[NH2+]Cc1cn[nH]n1 ZINC000649430968 398233400 /nfs/dbraw/zinc/23/34/00/398233400.db2.gz HTFVPPZFYCKSLY-CMPLNLGQSA-N 1 2 222.336 2.253 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2ccn(C)n2)oc1C ZINC000337462363 178251887 /nfs/dbraw/zinc/25/18/87/178251887.db2.gz KSJVICBLESCTJS-JTQLQIEISA-N 1 2 233.315 2.481 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2ccoc2)nn1C ZINC000282320091 178252179 /nfs/dbraw/zinc/25/21/79/178252179.db2.gz UFZALVWQJWLZPM-JTQLQIEISA-N 1 2 219.288 2.172 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@H](CO)c2ccccc2)no1 ZINC000279524017 178257713 /nfs/dbraw/zinc/25/77/13/178257713.db2.gz GHJWENRRYBWTNT-SMDDNHRTSA-N 1 2 246.310 2.367 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@H](C)c2cnn(C)c2C)no1 ZINC000337533634 178258717 /nfs/dbraw/zinc/25/87/17/178258717.db2.gz FCDJXJFRDXKBJW-ZJUUUORDSA-N 1 2 248.330 2.437 20 0 BEADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2c[nH]nc2C)no1 ZINC000371397053 178265669 /nfs/dbraw/zinc/26/56/69/178265669.db2.gz XHCSNMDHCRYCFK-CYBMUJFWSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1cc([C@H]2CCC[N@H+]2Cc2c[nH]nc2C)no1 ZINC000371397053 178265671 /nfs/dbraw/zinc/26/56/71/178265671.db2.gz XHCSNMDHCRYCFK-CYBMUJFWSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cncn2C)on1 ZINC000336397972 178267220 /nfs/dbraw/zinc/26/72/20/178267220.db2.gz DPWVOBNBMXZDBQ-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cncn2C)on1 ZINC000336397972 178267222 /nfs/dbraw/zinc/26/72/22/178267222.db2.gz DPWVOBNBMXZDBQ-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2C[C@H]2C2CC2)cc[nH+]1 ZINC000175861722 365610208 /nfs/dbraw/zinc/61/02/08/365610208.db2.gz PDQKLJIHVDHKKV-NWDGAFQWSA-N 1 2 216.284 2.375 20 0 BEADLO C[C@H](Nc1cc[nH+]c(C(C)(C)C)n1)C1CC1 ZINC000381253757 398244231 /nfs/dbraw/zinc/24/42/31/398244231.db2.gz QEHWTCHRCBLGHM-VIFPVBQESA-N 1 2 219.332 2.406 20 0 BEADLO CC[C@@H]1CCN1C(=O)c1ccn2c(C)c[nH+]c2c1 ZINC000576597385 365636653 /nfs/dbraw/zinc/63/66/53/365636653.db2.gz QTVGADDSACSMEX-GFCCVEGCSA-N 1 2 243.310 2.267 20 0 BEADLO C[C@H]([NH2+]Cc1ccon1)c1ccncc1F ZINC000336778719 398245590 /nfs/dbraw/zinc/24/55/90/398245590.db2.gz MCMCLIBMECYXLY-QMMMGPOBSA-N 1 2 221.235 2.060 20 0 BEADLO Cc1cc2[nH+]cn(CC[C@H](C)O)c2cc1C ZINC000044183878 178305645 /nfs/dbraw/zinc/30/56/45/178305645.db2.gz VTBLZDHMLBXYEG-NSHDSACASA-N 1 2 218.300 2.424 20 0 BEADLO C[C@@H](NC(=O)C[C@@H]1CCC[C@H]1C)c1[nH]cc[nH+]1 ZINC000580901945 398250792 /nfs/dbraw/zinc/25/07/92/398250792.db2.gz DDGGURZPKHQMHP-MXWKQRLJSA-N 1 2 235.331 2.413 20 0 BEADLO CCC(CC)CNc1[nH+]cnc2c1cnn2C ZINC000134375837 168366760 /nfs/dbraw/zinc/36/67/60/168366760.db2.gz RMEPPQLRMXCXRX-UHFFFAOYSA-N 1 2 233.319 2.211 20 0 BEADLO CCC[C@@](C)(CC)C(=O)NCc1c[nH+]cn1C ZINC000291328107 538947557 /nfs/dbraw/zinc/94/75/57/538947557.db2.gz VIIKPVSWCRAXNR-CYBMUJFWSA-N 1 2 237.347 2.253 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)C(C)(C)C1CCCC1 ZINC000291348055 538947734 /nfs/dbraw/zinc/94/77/34/538947734.db2.gz XGIXSZKWXGSAPZ-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO O=C(NCCC1CC1)Nc1ccn2cc[nH+]c2c1 ZINC000290605027 538947072 /nfs/dbraw/zinc/94/70/72/538947072.db2.gz HOZFFCTZUULPBF-UHFFFAOYSA-N 1 2 244.298 2.256 20 0 BEADLO C[C@@H]1CC(C(=O)NCc2c[nH+]cn2C)C[C@@H](C)C1 ZINC000291473915 538948074 /nfs/dbraw/zinc/94/80/74/538948074.db2.gz PLBXVFZHNNDVGM-QWRGUYRKSA-N 1 2 249.358 2.109 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)[C@@H]1CCCCC1(C)C ZINC000291465810 538948156 /nfs/dbraw/zinc/94/81/56/538948156.db2.gz OQDOQANPAGFAOD-LBPRGKRZSA-N 1 2 249.358 2.253 20 0 BEADLO CCc1ccccc1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000162022890 349549657 /nfs/dbraw/zinc/54/96/57/349549657.db2.gz DOPHNZWEFLFMMI-UHFFFAOYSA-N 1 2 243.310 2.244 20 0 BEADLO CC[C@H]1CCCC[C@H]1C(=O)NCc1c[nH+]cn1C ZINC000291432251 538947878 /nfs/dbraw/zinc/94/78/78/538947878.db2.gz LLXMHUYTLQULLA-WCQYABFASA-N 1 2 249.358 2.253 20 0 BEADLO CC(C)n1nccc1C[NH2+]CC(C)(F)F ZINC000378733392 346820182 /nfs/dbraw/zinc/82/01/82/346820182.db2.gz FENGREZRMDSIHN-UHFFFAOYSA-N 1 2 217.263 2.209 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)c2cccs2)c2[nH+]ccn21 ZINC000334745062 136232458 /nfs/dbraw/zinc/23/24/58/136232458.db2.gz WNBAJMISQPPDSH-DTWKUNHWSA-N 1 2 247.323 2.380 20 0 BEADLO CCC[C@H](C)NC(=O)Cc1cn2ccccc2[nH+]1 ZINC000649470076 398270592 /nfs/dbraw/zinc/27/05/92/398270592.db2.gz LHPAYEQAOSJKNH-NSHDSACASA-N 1 2 245.326 2.182 20 0 BEADLO CCC[C@@](C)([NH2+]C[C@@](C)(CC)OC)C(=O)OC ZINC000602508033 349583579 /nfs/dbraw/zinc/58/35/79/349583579.db2.gz YWJLRHMLCAAKRH-CHWSQXEVSA-N 1 2 245.363 2.123 20 0 BEADLO CC(C)n1cc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cn1 ZINC000179192099 538955198 /nfs/dbraw/zinc/95/51/98/538955198.db2.gz DSBDQGLDJZAQMS-VXGBXAGGSA-N 1 2 237.347 2.073 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cc3n(n2)CCC3)o1 ZINC000649480596 398278365 /nfs/dbraw/zinc/27/83/65/398278365.db2.gz MAEKNSNLXMGDEY-UHFFFAOYSA-N 1 2 245.326 2.363 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cc3n(n2)CCC3)o1 ZINC000649480596 398278368 /nfs/dbraw/zinc/27/83/68/398278368.db2.gz MAEKNSNLXMGDEY-UHFFFAOYSA-N 1 2 245.326 2.363 20 0 BEADLO Cc1ccc(CNc2nc(C)[nH+]cc2C)s1 ZINC000583945195 342730544 /nfs/dbraw/zinc/73/05/44/342730544.db2.gz LSKDNPCJYHFBAU-UHFFFAOYSA-N 1 2 233.340 2.497 20 0 BEADLO O=C(CCC1CCCC1)NCCCn1cc[nH+]c1 ZINC000005387774 342763032 /nfs/dbraw/zinc/76/30/32/342763032.db2.gz KRNXRFZLNATYLO-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO Cc1cc(CNC(=O)N2C[C@@H](C)[C@@H]2C)cc(C)[nH+]1 ZINC000335610658 136236835 /nfs/dbraw/zinc/23/68/35/136236835.db2.gz IQVKFUZRKWIGFY-SKDRFNHKSA-N 1 2 247.342 2.248 20 0 BEADLO C[C@]1(C(=O)Nc2ccn3cc[nH+]c3c2)C[C@@H]1F ZINC000335614409 136237560 /nfs/dbraw/zinc/23/75/60/136237560.db2.gz YSISMSBRJNWMRE-CABZTGNLSA-N 1 2 233.246 2.021 20 0 BEADLO Fc1cccc(-n2ccc(Cn3cc[nH+]c3)n2)c1 ZINC000064555927 342781354 /nfs/dbraw/zinc/78/13/54/342781354.db2.gz DZKKQAHRVVWTEC-UHFFFAOYSA-N 1 2 242.257 2.256 20 0 BEADLO Cc1cc(NCC2(CCO)CC2)nc(C2CC2)[nH+]1 ZINC000186163038 538971917 /nfs/dbraw/zinc/97/19/17/538971917.db2.gz CAKPJVPLGGSDEG-UHFFFAOYSA-N 1 2 247.342 2.237 20 0 BEADLO CCc1cc(NC[C@@H]2CCCCO2)nc[nH+]1 ZINC000042822067 342782697 /nfs/dbraw/zinc/78/26/97/342782697.db2.gz DZXXWYIVOXLIDI-NSHDSACASA-N 1 2 221.304 2.020 20 0 BEADLO CC[C@]1(C)CCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493657086 529391689 /nfs/dbraw/zinc/39/16/89/529391689.db2.gz KBIFOZUALOYETQ-GEXIGZQTSA-N 1 2 247.342 2.462 20 0 BEADLO COc1cc([C@@H](C)[NH2+]Cc2nccs2)ccn1 ZINC000347682987 398284705 /nfs/dbraw/zinc/28/47/05/398284705.db2.gz PGTZDJNEPNPVES-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO FC(F)C[N@@H+]1CCCC2(CCOCC2)C1 ZINC000607749861 342787771 /nfs/dbraw/zinc/78/77/71/342787771.db2.gz JJLVHNFJOQWTKX-UHFFFAOYSA-N 1 2 219.275 2.144 20 0 BEADLO FC(F)C[N@H+]1CCCC2(CCOCC2)C1 ZINC000607749861 342787772 /nfs/dbraw/zinc/78/77/72/342787772.db2.gz JJLVHNFJOQWTKX-UHFFFAOYSA-N 1 2 219.275 2.144 20 0 BEADLO CC(C)[C@@H]1CCCN(C(=O)CCn2cc[nH+]c2)C1 ZINC000200982866 342789920 /nfs/dbraw/zinc/78/99/20/342789920.db2.gz GGLWCQXTXKXSIP-CYBMUJFWSA-N 1 2 249.358 2.168 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+][C@H]2CCCn3nccc32)o1 ZINC000634581946 342797692 /nfs/dbraw/zinc/79/76/92/342797692.db2.gz HVMAQJYECRFCGS-MNOVXSKESA-N 1 2 246.314 2.365 20 0 BEADLO C/C=C/CNc1cc[nH+]c(C(C)(C)C)n1 ZINC000624656157 342810068 /nfs/dbraw/zinc/81/00/68/342810068.db2.gz HYVUJIBAAWKSIM-AATRIKPKSA-N 1 2 205.305 2.184 20 0 BEADLO C/C=C/CNc1nc(C2CC2)[nH+]c(C)c1OC ZINC000624656707 342810291 /nfs/dbraw/zinc/81/02/91/342810291.db2.gz ZDLMQIUAJWEZHE-SNAWJCMRSA-N 1 2 233.315 2.081 20 0 BEADLO C/C=C\CNc1cc(NC2CC2)[nH+]cn1 ZINC000624656667 342810300 /nfs/dbraw/zinc/81/03/00/342810300.db2.gz YAPJXEBTROHZCC-IHWYPQMZSA-N 1 2 204.277 2.039 20 0 BEADLO C/C=C\CNc1cc(NC2CC2)nc[nH+]1 ZINC000624656667 342810301 /nfs/dbraw/zinc/81/03/01/342810301.db2.gz YAPJXEBTROHZCC-IHWYPQMZSA-N 1 2 204.277 2.039 20 0 BEADLO CO[C@H]1C[C@H](Nc2ccc3ccccc3[nH+]2)C1 ZINC000624723432 342822376 /nfs/dbraw/zinc/82/23/76/342822376.db2.gz BLBVAJRZIUVIBS-HAQNSBGRSA-N 1 2 228.295 2.246 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2cscn2)[nH]n1 ZINC000380172861 538986770 /nfs/dbraw/zinc/98/67/70/538986770.db2.gz DXOTUDRXVBZBLZ-MRVPVSSYSA-N 1 2 222.317 2.025 20 0 BEADLO CC[C@]1(C)CCN(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493542582 529395942 /nfs/dbraw/zinc/39/59/42/529395942.db2.gz AGVHHTYRHACVCG-MUBLQREKSA-N 1 2 233.315 2.072 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N(C)[C@@H]1CC1(C)C ZINC000335681881 398292955 /nfs/dbraw/zinc/29/29/55/398292955.db2.gz UEMHQMQBLKOLKQ-LLVKDONJSA-N 1 2 233.315 2.074 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N(C)[C@H]1CC1(C)C ZINC000335681882 398293082 /nfs/dbraw/zinc/29/30/82/398293082.db2.gz UEMHQMQBLKOLKQ-NSHDSACASA-N 1 2 233.315 2.074 20 0 BEADLO COc1ccc(N[C@@H]2CSC[C@H]2C)[nH+]c1 ZINC000380322648 538989045 /nfs/dbraw/zinc/98/90/45/538989045.db2.gz KXGWLDXNQXACQD-PSASIEDQSA-N 1 2 224.329 2.254 20 0 BEADLO CCC(CC)[C@@H](C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000341697228 168396243 /nfs/dbraw/zinc/39/62/43/168396243.db2.gz SSCSRZOOFGLHQZ-SNVBAGLBSA-N 1 2 237.347 2.440 20 0 BEADLO C[C@H]1CCC[C@H](NC(=O)CCc2c[nH+]c[nH]2)C1 ZINC000189058929 538980438 /nfs/dbraw/zinc/98/04/38/538980438.db2.gz VGYZFKXWLOVFFL-QWRGUYRKSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H]1CCC[C@H](NC(=O)CCc2c[nH]c[nH+]2)C1 ZINC000189058929 538980440 /nfs/dbraw/zinc/98/04/40/538980440.db2.gz VGYZFKXWLOVFFL-QWRGUYRKSA-N 1 2 235.331 2.037 20 0 BEADLO Cc1c(F)cccc1NC(=O)CCc1c[nH+]c[nH]1 ZINC000189189546 538980795 /nfs/dbraw/zinc/98/07/95/538980795.db2.gz KBAYHIUAHONQTI-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO Cc1c(F)cccc1NC(=O)CCc1c[nH]c[nH+]1 ZINC000189189546 538980797 /nfs/dbraw/zinc/98/07/97/538980797.db2.gz KBAYHIUAHONQTI-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO Cc1cc(CNC(=O)[C@@]2(C)C[C@@H]2F)cc(C)[nH+]1 ZINC000335622998 136240403 /nfs/dbraw/zinc/24/04/03/136240403.db2.gz GHBKGHPOTMHGNX-AAEUAGOBSA-N 1 2 236.290 2.063 20 0 BEADLO CC(C)CC1(CNC(=O)CCc2c[nH+]c[nH]2)CC1 ZINC000189496346 538983180 /nfs/dbraw/zinc/98/31/80/538983180.db2.gz KRISSHJQDODRSK-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO CC(C)CC1(CNC(=O)CCc2c[nH]c[nH+]2)CC1 ZINC000189496346 538983182 /nfs/dbraw/zinc/98/31/82/538983182.db2.gz KRISSHJQDODRSK-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N1CCC[C@@H]1C1CCC1 ZINC000193137187 539002292 /nfs/dbraw/zinc/00/22/92/539002292.db2.gz YCFOGWYFHSLCLK-CYBMUJFWSA-N 1 2 247.342 2.133 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N1CCC[C@@H]1C1CCC1 ZINC000193137187 539002293 /nfs/dbraw/zinc/00/22/93/539002293.db2.gz YCFOGWYFHSLCLK-CYBMUJFWSA-N 1 2 247.342 2.133 20 0 BEADLO CCC(CC)[C@@H](C)C(=O)NCc1[nH]cc[nH+]1 ZINC000330526975 168398347 /nfs/dbraw/zinc/39/83/47/168398347.db2.gz KKOIZEOIJKDHNB-SECBINFHSA-N 1 2 223.320 2.098 20 0 BEADLO Cc1ccncc1[C@@H](C)[NH2+]Cc1cocn1 ZINC000381525375 539003335 /nfs/dbraw/zinc/00/33/35/539003335.db2.gz WJKWEIBFMUZRLJ-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO CN(CC1CCCCC1)C(=O)CCc1c[nH+]c[nH]1 ZINC000193207688 539003396 /nfs/dbraw/zinc/00/33/96/539003396.db2.gz NQPUBJBCMZDRSW-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO CN(CC1CCCCC1)C(=O)CCc1c[nH]c[nH+]1 ZINC000193207688 539003398 /nfs/dbraw/zinc/00/33/98/539003398.db2.gz NQPUBJBCMZDRSW-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO COc1ccc(N[C@@H]2CCCOCC2)[nH+]c1 ZINC000381575101 539004253 /nfs/dbraw/zinc/00/42/53/539004253.db2.gz YBCZECYSCFCVJA-SNVBAGLBSA-N 1 2 222.288 2.071 20 0 BEADLO CC1(C)CCCN(C(=O)CCc2c[nH+]c[nH]2)CC1 ZINC000193352647 539004858 /nfs/dbraw/zinc/00/48/58/539004858.db2.gz ORDKMMXVISTBIC-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO CC1(C)CCCN(C(=O)CCc2c[nH]c[nH+]2)CC1 ZINC000193352647 539004859 /nfs/dbraw/zinc/00/48/59/539004859.db2.gz ORDKMMXVISTBIC-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2c(C)noc2C)on1 ZINC000383856710 539012260 /nfs/dbraw/zinc/01/22/60/539012260.db2.gz BXSDVEQHBIVRLJ-QMMMGPOBSA-N 1 2 235.287 2.439 20 0 BEADLO C[C@@H]1CCC[C@@H](N(C)C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000192604864 538995911 /nfs/dbraw/zinc/99/59/11/538995911.db2.gz WXYSKUCXMGXIFY-DGCLKSJQSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H]1CCC[C@@H](N(C)C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000192604864 538995912 /nfs/dbraw/zinc/99/59/12/538995912.db2.gz WXYSKUCXMGXIFY-DGCLKSJQSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H](c1ccccc1)[C@@H](CO)[NH2+]CC(F)F ZINC000390211316 539020418 /nfs/dbraw/zinc/02/04/18/539020418.db2.gz VJPIACAYWGLTEN-MWLCHTKSSA-N 1 2 229.270 2.006 20 0 BEADLO CC(C)(C)c1nc(NCC2(C)CC2)cc[nH+]1 ZINC000390241144 539020592 /nfs/dbraw/zinc/02/05/92/539020592.db2.gz HSVCOXAQCVKFTN-UHFFFAOYSA-N 1 2 219.332 2.408 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2cccnc2C)s1 ZINC000391909449 539027817 /nfs/dbraw/zinc/02/78/17/539027817.db2.gz ONFRCDBBXFPKNA-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO C[C@@H]1[C@H](O)CCN1c1cc(C(F)(F)F)cc[nH+]1 ZINC000649502131 398297582 /nfs/dbraw/zinc/29/75/82/398297582.db2.gz JZDDHTBSFPPHIF-VXNVDRBHSA-N 1 2 246.232 2.060 20 0 BEADLO C[C@@H]1CCCC[C@H]1C(=O)N(C)Cc1[nH+]ccn1C ZINC000335633609 136241760 /nfs/dbraw/zinc/24/17/60/136241760.db2.gz LBWONQYOHUCNEE-VXGBXAGGSA-N 1 2 249.358 2.205 20 0 BEADLO CC=CC[NH2+][C@@H](c1cccs1)c1nnc[nH]1 ZINC000624199036 342841222 /nfs/dbraw/zinc/84/12/22/342841222.db2.gz DXPXVKCEWZTYCE-PBKGFPTLSA-N 1 2 234.328 2.121 20 0 BEADLO CCC[C@@H](C[N@H+](C)[C@@H](C)c1nc(C)no1)OC ZINC000639300295 398300697 /nfs/dbraw/zinc/30/06/97/398300697.db2.gz HRWNJMOCNULKPR-ONGXEEELSA-N 1 2 241.335 2.186 20 0 BEADLO CCC[C@@H](C[N@@H+](C)[C@@H](C)c1nc(C)no1)OC ZINC000639300295 398300699 /nfs/dbraw/zinc/30/06/99/398300699.db2.gz HRWNJMOCNULKPR-ONGXEEELSA-N 1 2 241.335 2.186 20 0 BEADLO COc1cncc(C[N@H+](C)Cc2ccc(C)o2)n1 ZINC000625058665 342846310 /nfs/dbraw/zinc/84/63/10/342846310.db2.gz CDSZFGBFRSLELG-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1cncc(C[N@@H+](C)Cc2ccc(C)o2)n1 ZINC000625058665 342846311 /nfs/dbraw/zinc/84/63/11/342846311.db2.gz CDSZFGBFRSLELG-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO CCc1cc(NCc2ccnc(OC)c2)nc[nH+]1 ZINC000062054993 398308039 /nfs/dbraw/zinc/30/80/39/398308039.db2.gz NSQXIWPKZVDHLD-UHFFFAOYSA-N 1 2 244.298 2.055 20 0 BEADLO CC(C)[NH2+]c1ccc(-n2ccnn2)cc1 ZINC000133043684 398309537 /nfs/dbraw/zinc/30/95/37/398309537.db2.gz RREVXVNNOCDPTB-UHFFFAOYSA-N 1 2 202.261 2.088 20 0 BEADLO Cc1cc(C(=O)NCCc2[nH]cc[nH+]2)c(C)s1 ZINC000134496298 342860116 /nfs/dbraw/zinc/86/01/16/342860116.db2.gz HJGMFVRKULBOIY-UHFFFAOYSA-N 1 2 249.339 2.061 20 0 BEADLO C[N@H+](Cc1cc(O)ccc1Cl)[C@H]1CCOC1 ZINC000625155705 342895762 /nfs/dbraw/zinc/89/57/62/342895762.db2.gz RMCYFEZREIOFBK-JTQLQIEISA-N 1 2 241.718 2.266 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+]Cc2cnns2)s1 ZINC000309016151 342881102 /nfs/dbraw/zinc/88/11/02/342881102.db2.gz ZPHJMJJFFONNTF-SSDOTTSWSA-N 1 2 240.357 2.154 20 0 BEADLO Cc1ccc(NC(=O)Cc2cccnc2)c(C)[nH+]1 ZINC000336478092 398319788 /nfs/dbraw/zinc/31/97/88/398319788.db2.gz GSDPSJFJUGOBDW-UHFFFAOYSA-N 1 2 241.294 2.275 20 0 BEADLO Cc1ccc(NC(=O)c2cc[nH]c2)c(C)[nH+]1 ZINC000176207273 365688452 /nfs/dbraw/zinc/68/84/52/365688452.db2.gz COWWDTWGYCZUTH-UHFFFAOYSA-N 1 2 215.256 2.279 20 0 BEADLO CC[N@H+](Cc1conc1C)Cc1ccccn1 ZINC000351567063 136246861 /nfs/dbraw/zinc/24/68/61/136246861.db2.gz GUMFZFWVSKDIIJ-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1conc1C)Cc1ccccn1 ZINC000351567063 136246862 /nfs/dbraw/zinc/24/68/62/136246862.db2.gz GUMFZFWVSKDIIJ-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000421460474 192346932 /nfs/dbraw/zinc/34/69/32/192346932.db2.gz PYEUIYOCZOHUCV-TUAOUCFPSA-N 1 2 230.311 2.187 20 0 BEADLO CC[C@@H]([NH2+][C@@H](C)C(=O)OC)c1cccs1 ZINC000037073680 342916623 /nfs/dbraw/zinc/91/66/23/342916623.db2.gz ZOSUOAUYYZFIKL-DTWKUNHWSA-N 1 2 227.329 2.350 20 0 BEADLO CC(C)(C)c1nc(NCCCn2cc[nH+]c2)no1 ZINC000302126983 398325062 /nfs/dbraw/zinc/32/50/62/398325062.db2.gz ITHSIQTXCJWSSM-UHFFFAOYSA-N 1 2 249.318 2.066 20 0 BEADLO CCC[C@@H](C)CCC[N@H+](C)Cc1nnc[nH]1 ZINC000625224384 342920793 /nfs/dbraw/zinc/92/07/93/342920793.db2.gz WYJGLWMXZQEMNG-LLVKDONJSA-N 1 2 224.352 2.453 20 0 BEADLO CCC[C@@H](C)CCC[N@@H+](C)Cc1nnc[nH]1 ZINC000625224384 342920794 /nfs/dbraw/zinc/92/07/94/342920794.db2.gz WYJGLWMXZQEMNG-LLVKDONJSA-N 1 2 224.352 2.453 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)[C@@H]1CC1(F)F)C(=O)OC(C)(C)C ZINC000602594945 349644024 /nfs/dbraw/zinc/64/40/24/349644024.db2.gz STFMTYROAOFJJK-YIZRAAEISA-N 1 2 249.301 2.350 20 0 BEADLO CC[C@@H]1C[C@H](C)CN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492856856 529437070 /nfs/dbraw/zinc/43/70/70/529437070.db2.gz CKPOSDQDLMWWGW-HDTYDHQFSA-N 1 2 233.315 2.070 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccccc1 ZINC000602645311 349657037 /nfs/dbraw/zinc/65/70/37/349657037.db2.gz RLWGYDKRNZQIQS-RFHZTLPTSA-N 1 2 247.338 2.330 20 0 BEADLO C[C@@H]1CC[C@H](CC(=O)N2CCc3[nH]c[nH+]c3C2)C1 ZINC000627368885 346889438 /nfs/dbraw/zinc/88/94/38/346889438.db2.gz FOIDQTKIFWJZFY-MNOVXSKESA-N 1 2 247.342 2.121 20 0 BEADLO C[C@@H]1CC[C@H](CC(=O)N2CCc3[nH+]c[nH]c3C2)C1 ZINC000627368885 346889439 /nfs/dbraw/zinc/88/94/39/346889439.db2.gz FOIDQTKIFWJZFY-MNOVXSKESA-N 1 2 247.342 2.121 20 0 BEADLO CC[C@@H](c1ccccc1)[N@H+](C)Cc1nnc[nH]1 ZINC000174812173 346887482 /nfs/dbraw/zinc/88/74/82/346887482.db2.gz JRBDPTSENUASIL-LBPRGKRZSA-N 1 2 230.315 2.388 20 0 BEADLO CC[C@@H](c1ccccc1)[N@@H+](C)Cc1nnc[nH]1 ZINC000174812173 346887483 /nfs/dbraw/zinc/88/74/83/346887483.db2.gz JRBDPTSENUASIL-LBPRGKRZSA-N 1 2 230.315 2.388 20 0 BEADLO FC(F)C[NH2+]Cc1ccc(-n2cccn2)cc1 ZINC000136581244 398342810 /nfs/dbraw/zinc/34/28/10/398342810.db2.gz STEJITFUEQQHSO-UHFFFAOYSA-N 1 2 237.253 2.227 20 0 BEADLO C[C@H](F)CC[N@@H+]1CCCC[C@H]1c1nnc[nH]1 ZINC000351752937 136251098 /nfs/dbraw/zinc/25/10/98/136251098.db2.gz UAJMJJMJMLVILJ-UWVGGRQHSA-N 1 2 226.299 2.080 20 0 BEADLO C[C@H](F)CC[N@H+]1CCCC[C@H]1c1nnc[nH]1 ZINC000351752937 136251099 /nfs/dbraw/zinc/25/10/99/136251099.db2.gz UAJMJJMJMLVILJ-UWVGGRQHSA-N 1 2 226.299 2.080 20 0 BEADLO C[C@H](F)CC[N@@H+]1CCCC[C@H]1c1nc[nH]n1 ZINC000351752937 136251100 /nfs/dbraw/zinc/25/11/00/136251100.db2.gz UAJMJJMJMLVILJ-UWVGGRQHSA-N 1 2 226.299 2.080 20 0 BEADLO C[C@H](F)CC[N@H+]1CCCC[C@H]1c1nc[nH]n1 ZINC000351752937 136251101 /nfs/dbraw/zinc/25/11/01/136251101.db2.gz UAJMJJMJMLVILJ-UWVGGRQHSA-N 1 2 226.299 2.080 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1C[C@@H]1C ZINC000643903115 398344453 /nfs/dbraw/zinc/34/44/53/398344453.db2.gz QMEQNVAGJDKSQO-WPRPVWTQSA-N 1 2 204.273 2.293 20 0 BEADLO Cn1ccc(CNc2ccc([NH+](C)C)cc2)n1 ZINC000149153379 398345035 /nfs/dbraw/zinc/34/50/35/398345035.db2.gz YWPGBQGCYHJKDN-UHFFFAOYSA-N 1 2 230.315 2.098 20 0 BEADLO CC(C)[C@@H](C)C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000565107864 323023276 /nfs/dbraw/zinc/02/32/76/323023276.db2.gz XMUHUXBAHJRPSP-SECBINFHSA-N 1 2 223.320 2.053 20 0 BEADLO CC(C)[N@H+](Cc1nccn1C)Cc1cccnc1 ZINC000162382614 349681060 /nfs/dbraw/zinc/68/10/60/349681060.db2.gz FPVTWZUFWJAXQX-UHFFFAOYSA-N 1 2 244.342 2.226 20 0 BEADLO CC(C)[N@@H+](Cc1nccn1C)Cc1cccnc1 ZINC000162382614 349681062 /nfs/dbraw/zinc/68/10/62/349681062.db2.gz FPVTWZUFWJAXQX-UHFFFAOYSA-N 1 2 244.342 2.226 20 0 BEADLO CC(C)N(Cc1[nH+]ccn1C)Cc1cccnc1 ZINC000162382614 349681066 /nfs/dbraw/zinc/68/10/66/349681066.db2.gz FPVTWZUFWJAXQX-UHFFFAOYSA-N 1 2 244.342 2.226 20 0 BEADLO C[C@H]1CCCCCN1C(=O)CCc1c[nH+]cn1C ZINC000334153992 187206524 /nfs/dbraw/zinc/20/65/24/187206524.db2.gz QBPDOQIZFCDGCE-LBPRGKRZSA-N 1 2 249.358 2.144 20 0 BEADLO CC(C)COCC[N@@H+]1CCC[C@@H]1C(F)F ZINC000353194148 187208273 /nfs/dbraw/zinc/20/82/73/187208273.db2.gz OLDBJVHZSCIZQA-SNVBAGLBSA-N 1 2 221.291 2.389 20 0 BEADLO CC(C)COCC[N@H+]1CCC[C@@H]1C(F)F ZINC000353194148 187208275 /nfs/dbraw/zinc/20/82/75/187208275.db2.gz OLDBJVHZSCIZQA-SNVBAGLBSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@H]([NH2+][C@@H]1CCOC1=O)c1ccccc1 ZINC000019876277 342960333 /nfs/dbraw/zinc/96/03/33/342960333.db2.gz VOTZOMCBZGJFFD-NWDGAFQWSA-N 1 2 219.284 2.043 20 0 BEADLO CC(C)(C)c1nc(N[C@@H]2C[C@H](O)C2(C)C)cc[nH+]1 ZINC000302403609 187207391 /nfs/dbraw/zinc/20/73/91/187207391.db2.gz KLLVHCCTSVMTGZ-ZJUUUORDSA-N 1 2 249.358 2.345 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)NC(C)(C)C(C)C ZINC000493865894 529552954 /nfs/dbraw/zinc/55/29/54/529552954.db2.gz AAQXPHFYLFOTMX-BQYQJAHWSA-N 1 2 249.358 2.467 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N(C)[C@@H]1CC1(C)C ZINC000492998049 529557449 /nfs/dbraw/zinc/55/74/49/529557449.db2.gz OOZNSPZTNWGDQO-JMEBYUIHSA-N 1 2 247.342 2.173 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N[C@H](C)CC(C)C ZINC000492494980 529560335 /nfs/dbraw/zinc/56/03/35/529560335.db2.gz UOCREUKISSMPIW-ZHRWSRJISA-N 1 2 249.358 2.467 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N[C@@H]1C=CCCC1 ZINC000492490614 529560557 /nfs/dbraw/zinc/56/05/57/529560557.db2.gz IFPYIQXCOQJXPW-JLVNDZCYSA-N 1 2 245.326 2.141 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N(C)CCC1CC1 ZINC000492491826 529549359 /nfs/dbraw/zinc/54/93/59/529549359.db2.gz KQLXRGZHRMWJRH-VOTSOKGWSA-N 1 2 247.342 2.175 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N(C)C(C)(C)C ZINC000493458067 529549551 /nfs/dbraw/zinc/54/95/51/529549551.db2.gz GDOLVBMGYAIKEX-BQYQJAHWSA-N 1 2 235.331 2.173 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N(C)C1CCCC1 ZINC000492528091 529549968 /nfs/dbraw/zinc/54/99/68/529549968.db2.gz FICAQRHTDIXZSR-CMDGGOBGSA-N 1 2 247.342 2.317 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N[C@H]1CCC1(C)C ZINC000492917412 529561642 /nfs/dbraw/zinc/56/16/42/529561642.db2.gz CFYPBJWNVYPNTL-GZTOBOFZSA-N 1 2 247.342 2.221 20 0 BEADLO CC(C)C[C@H](C)C(=O)N(C)Cc1[nH+]ccn1C ZINC000274030039 187336744 /nfs/dbraw/zinc/33/67/44/187336744.db2.gz AUWJOOACAQJDFA-NSHDSACASA-N 1 2 237.347 2.061 20 0 BEADLO CCN(C#N)CC[N@@H+]1Cc2ccccc2[C@H]1C ZINC000602785776 349749051 /nfs/dbraw/zinc/74/90/51/349749051.db2.gz VJNDTVWEOLDNLV-GFCCVEGCSA-N 1 2 229.327 2.366 20 0 BEADLO CCN(C#N)CC[N@H+]1Cc2ccccc2[C@H]1C ZINC000602785776 349749052 /nfs/dbraw/zinc/74/90/52/349749052.db2.gz VJNDTVWEOLDNLV-GFCCVEGCSA-N 1 2 229.327 2.366 20 0 BEADLO CC(C)(C)OC(=O)[C@H](C1CC1)[N@@H+]1CC[C@@H](F)C1 ZINC000602841586 349779545 /nfs/dbraw/zinc/77/95/45/349779545.db2.gz OLCPFERDQDZZJI-MNOVXSKESA-N 1 2 243.322 2.151 20 0 BEADLO CC(C)(C)OC(=O)[C@H](C1CC1)[N@H+]1CC[C@@H](F)C1 ZINC000602841586 349779547 /nfs/dbraw/zinc/77/95/47/349779547.db2.gz OLCPFERDQDZZJI-MNOVXSKESA-N 1 2 243.322 2.151 20 0 BEADLO COc1cc(F)cc(-c2ccc(N)[nH+]c2)c1 ZINC000312568677 343077870 /nfs/dbraw/zinc/07/78/70/343077870.db2.gz RGLUMRHCYASMIS-UHFFFAOYSA-N 1 2 218.231 2.479 20 0 BEADLO CCc1csc(NC(=O)C=Cc2c[nH]c[nH+]2)n1 ZINC000492863404 529685188 /nfs/dbraw/zinc/68/51/88/529685188.db2.gz SHIRUXDYOGVVSH-ARJAWSKDSA-N 1 2 248.311 2.081 20 0 BEADLO Cc1c[nH+]c(C)nc1NCc1ccccc1F ZINC000576868848 365709186 /nfs/dbraw/zinc/70/91/86/365709186.db2.gz GNMKTKOWDXZXLB-UHFFFAOYSA-N 1 2 231.274 2.267 20 0 BEADLO Cc1cc(CNC(=O)[C@H](C)C2CC2)cc(C)[nH+]1 ZINC000421577459 192355860 /nfs/dbraw/zinc/35/58/60/192355860.db2.gz OXLQXDIUXKMRJZ-LLVKDONJSA-N 1 2 232.327 2.361 20 0 BEADLO CC[C@H](C)[C@H](O)CNc1cc[nH+]c(C(C)C)n1 ZINC000112334459 343128830 /nfs/dbraw/zinc/12/88/30/343128830.db2.gz OZSRTNHWTYSYRU-WDEREUQCSA-N 1 2 237.347 2.419 20 0 BEADLO CC[C@@H](C)[C@H](O)CNc1cc[nH+]c(C(C)C)n1 ZINC000112334457 343129002 /nfs/dbraw/zinc/12/90/02/343129002.db2.gz OZSRTNHWTYSYRU-GHMZBOCLSA-N 1 2 237.347 2.419 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2C[C@@H]2C2CCCCC2)n1 ZINC000576959517 365734288 /nfs/dbraw/zinc/73/42/88/365734288.db2.gz ZUDDYXCYKKAOEH-GHMZBOCLSA-N 1 2 235.331 2.473 20 0 BEADLO CCC(CC)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000125407393 343173399 /nfs/dbraw/zinc/17/33/99/343173399.db2.gz OJSHJYUUJOSDSM-MRVPVSSYSA-N 1 2 209.293 2.023 20 0 BEADLO COc1c(N)[nH+]cnc1N[C@H]1CCCC[C@H]1C ZINC000134816444 343195573 /nfs/dbraw/zinc/19/55/73/343195573.db2.gz FSOXOVWWILWUAF-BDAKNGLRSA-N 1 2 236.319 2.058 20 0 BEADLO COc1c(N)nc[nH+]c1N[C@H]1CCCC[C@H]1C ZINC000134816444 343195575 /nfs/dbraw/zinc/19/55/75/343195575.db2.gz FSOXOVWWILWUAF-BDAKNGLRSA-N 1 2 236.319 2.058 20 0 BEADLO COc1c(N)[nH+]cnc1N[C@H]1CCCC[C@@H]1C ZINC000134816463 343195630 /nfs/dbraw/zinc/19/56/30/343195630.db2.gz FSOXOVWWILWUAF-IUCAKERBSA-N 1 2 236.319 2.058 20 0 BEADLO COc1c(N)nc[nH+]c1N[C@H]1CCCC[C@@H]1C ZINC000134816463 343195632 /nfs/dbraw/zinc/19/56/32/343195632.db2.gz FSOXOVWWILWUAF-IUCAKERBSA-N 1 2 236.319 2.058 20 0 BEADLO Cc1cc2ccccc2[nH+]c1N[C@H](C)CC(N)=O ZINC000133207811 343190027 /nfs/dbraw/zinc/19/00/27/343190027.db2.gz KQHAFVXHRNELJU-SNVBAGLBSA-N 1 2 243.310 2.219 20 0 BEADLO CC(C)(C)OC(=O)CC[N@@H+]1CCC[C@@H]1C(F)F ZINC000353166474 136282281 /nfs/dbraw/zinc/28/22/81/136282281.db2.gz CCJWDLRLFPCDBE-SECBINFHSA-N 1 2 249.301 2.448 20 0 BEADLO CC(C)(C)OC(=O)CC[N@H+]1CCC[C@@H]1C(F)F ZINC000353166474 136282282 /nfs/dbraw/zinc/28/22/82/136282282.db2.gz CCJWDLRLFPCDBE-SECBINFHSA-N 1 2 249.301 2.448 20 0 BEADLO CCC(C)(C)CCn1cc(Cn2cc[nH+]c2)nn1 ZINC000641050199 362158039 /nfs/dbraw/zinc/15/80/39/362158039.db2.gz WNOZCLVAMDMCEE-UHFFFAOYSA-N 1 2 247.346 2.349 20 0 BEADLO CC[C@H]([NH2+][C@@H](C)c1ccccc1)C(=O)OC ZINC000034431768 343270690 /nfs/dbraw/zinc/27/06/90/343270690.db2.gz KWPWOWNUGHMEDM-JQWIXIFHSA-N 1 2 221.300 2.289 20 0 BEADLO COC(=O)C(C)(C)[NH2+][C@@H](C)CCc1ccco1 ZINC000037085659 343333583 /nfs/dbraw/zinc/33/35/83/343333583.db2.gz BMHRFTQOJPONND-JTQLQIEISA-N 1 2 239.315 2.142 20 0 BEADLO c1ccc(NCCOC2CCCC2)[nH+]c1 ZINC000070167409 343302452 /nfs/dbraw/zinc/30/24/52/343302452.db2.gz WBXHGDOCWLCHGX-UHFFFAOYSA-N 1 2 206.289 2.453 20 0 BEADLO COC(=O)[C@H](C)[NH2+]C1CC(c2ccccc2)C1 ZINC000037074102 343332745 /nfs/dbraw/zinc/33/27/45/343332745.db2.gz RVSYRQSWRICNJQ-PKSQDBQZSA-N 1 2 233.311 2.084 20 0 BEADLO CC[C@H]([NH2+][C@@H](C)C(=O)OC)c1ccccc1 ZINC000037074062 343332769 /nfs/dbraw/zinc/33/27/69/343332769.db2.gz SFJGDLZNFIQLDR-JQWIXIFHSA-N 1 2 221.300 2.289 20 0 BEADLO Cn1c[nH+]c(Cn2cc(C3CCCCC3)nn2)c1 ZINC000641054169 362164183 /nfs/dbraw/zinc/16/41/83/362164183.db2.gz UAXCRMRMRUDEPE-UHFFFAOYSA-N 1 2 245.330 2.108 20 0 BEADLO CCc1noc(CC)c1C[NH2+]Cc1cc(C)no1 ZINC000631086684 343314898 /nfs/dbraw/zinc/31/48/98/343314898.db2.gz CXKGEWNTWUNIHI-UHFFFAOYSA-N 1 2 249.314 2.386 20 0 BEADLO COC(=O)[C@@H](Cc1ccccc1)[NH2+]C1CCCC1 ZINC000037970189 343362990 /nfs/dbraw/zinc/36/29/90/343362990.db2.gz JOYFPXGYOIROJG-CQSZACIVSA-N 1 2 247.338 2.303 20 0 BEADLO CC[C@@H](NCc1[nH]cc[nH+]1)c1nccs1 ZINC000070633908 343336477 /nfs/dbraw/zinc/33/64/77/343336477.db2.gz LSHJHGWTERSEKZ-MRVPVSSYSA-N 1 2 222.317 2.107 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)c1ccc(Cl)s1 ZINC000070651644 343337693 /nfs/dbraw/zinc/33/76/93/343337693.db2.gz QJLLBCCREZTTLJ-UHFFFAOYSA-N 1 2 241.703 2.055 20 0 BEADLO CC[C@@H]1CCCN1C(=O)c1ccc2[nH+]ccn2c1 ZINC000335669470 136312564 /nfs/dbraw/zinc/31/25/64/136312564.db2.gz OIXUYWNHPSGUAM-GFCCVEGCSA-N 1 2 243.310 2.349 20 0 BEADLO Cc1nc(C[N@@H+]2CCO[C@@H]3CCC[C@@H]32)oc1C ZINC000335669412 136312617 /nfs/dbraw/zinc/31/26/17/136312617.db2.gz ZHJBXYHIBJYMRW-NWDGAFQWSA-N 1 2 236.315 2.045 20 0 BEADLO Cc1nc(C[N@H+]2CCO[C@@H]3CCC[C@@H]32)oc1C ZINC000335669412 136312618 /nfs/dbraw/zinc/31/26/18/136312618.db2.gz ZHJBXYHIBJYMRW-NWDGAFQWSA-N 1 2 236.315 2.045 20 0 BEADLO c1cncc(C[N@@H+]2CCO[C@@H](C3CCC3)C2)c1 ZINC000335662044 136315341 /nfs/dbraw/zinc/31/53/41/136315341.db2.gz CVKWDWMSQMIRQY-CQSZACIVSA-N 1 2 232.327 2.083 20 0 BEADLO c1cncc(C[N@H+]2CCO[C@@H](C3CCC3)C2)c1 ZINC000335662044 136315342 /nfs/dbraw/zinc/31/53/42/136315342.db2.gz CVKWDWMSQMIRQY-CQSZACIVSA-N 1 2 232.327 2.083 20 0 BEADLO FC1(F)C[C@H]2CC[C@@H](C1)[N@H+]2Cc1csnn1 ZINC000625678951 344031137 /nfs/dbraw/zinc/03/11/37/344031137.db2.gz KSKBLMFBQKDNBT-DTORHVGOSA-N 1 2 245.298 2.300 20 0 BEADLO FC1(F)C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1csnn1 ZINC000625678951 344031138 /nfs/dbraw/zinc/03/11/38/344031138.db2.gz KSKBLMFBQKDNBT-DTORHVGOSA-N 1 2 245.298 2.300 20 0 BEADLO c1ccc(C[N@@H+]2CCO[C@H](C3CCC3)C2)nc1 ZINC000335664905 136316622 /nfs/dbraw/zinc/31/66/22/136316622.db2.gz XWBICTWNWBAUNU-AWEZNQCLSA-N 1 2 232.327 2.083 20 0 BEADLO c1ccc(C[N@H+]2CCO[C@H](C3CCC3)C2)nc1 ZINC000335664905 136316623 /nfs/dbraw/zinc/31/66/23/136316623.db2.gz XWBICTWNWBAUNU-AWEZNQCLSA-N 1 2 232.327 2.083 20 0 BEADLO Cc1cc(N2CCC(C(F)F)CC2)nc[nH+]1 ZINC000335691652 136325576 /nfs/dbraw/zinc/32/55/76/136325576.db2.gz PSEJNGVCVQSEHE-UHFFFAOYSA-N 1 2 227.258 2.267 20 0 BEADLO CSC1(C(=O)Nc2cccc3[nH+]ccn32)CC1 ZINC000335723442 136346429 /nfs/dbraw/zinc/34/64/29/136346429.db2.gz YHTXVEAMGYLLNP-UHFFFAOYSA-N 1 2 247.323 2.168 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)CC1CCCCC1 ZINC000042509982 343441196 /nfs/dbraw/zinc/44/11/96/343441196.db2.gz GBUCLQBPYIEPAD-GFCCVEGCSA-N 1 2 249.358 2.358 20 0 BEADLO Cc1cc(N2CCCC23CCC3)nc[nH+]1 ZINC000335731132 136348583 /nfs/dbraw/zinc/34/85/83/136348583.db2.gz IZNWOYRJRRQWDQ-UHFFFAOYSA-N 1 2 203.289 2.308 20 0 BEADLO Nc1ccc(NC(=O)[C@@H]2CC23CCCC3)c[nH+]1 ZINC000335730114 136348632 /nfs/dbraw/zinc/34/86/32/136348632.db2.gz GEBSGFLSWJFEPD-JTQLQIEISA-N 1 2 231.299 2.013 20 0 BEADLO c1cn(CCc2nc(-c3ccccc3)no2)c[nH+]1 ZINC000349860301 136352573 /nfs/dbraw/zinc/35/25/73/136352573.db2.gz OAYYGEUQMBYCMR-UHFFFAOYSA-N 1 2 240.266 2.176 20 0 BEADLO Cc1oncc1C[N@@H+]1CCOC2(CCCC2)C1 ZINC000335828931 136352767 /nfs/dbraw/zinc/35/27/67/136352767.db2.gz TXLJTCAQBRSFTJ-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO Cc1oncc1C[N@H+]1CCOC2(CCCC2)C1 ZINC000335828931 136352768 /nfs/dbraw/zinc/35/27/68/136352768.db2.gz TXLJTCAQBRSFTJ-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ncc[nH]1 ZINC000335714876 136338623 /nfs/dbraw/zinc/33/86/23/136338623.db2.gz SRKNYTQNAFUZRK-HTQZYQBOSA-N 1 2 233.237 2.182 20 0 BEADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ncc[nH]1 ZINC000335714876 136338624 /nfs/dbraw/zinc/33/86/24/136338624.db2.gz SRKNYTQNAFUZRK-HTQZYQBOSA-N 1 2 233.237 2.182 20 0 BEADLO COC(=O)[C@@H](C)[NH2+]C1CC(c2ccccc2)C1 ZINC000042304483 343434499 /nfs/dbraw/zinc/43/44/99/343434499.db2.gz RVSYRQSWRICNJQ-QFWMXSHPSA-N 1 2 233.311 2.084 20 0 BEADLO c1ccc([C@@H]2CC[N@H+]2Cc2ncccn2)cc1 ZINC000335719198 136340468 /nfs/dbraw/zinc/34/04/68/136340468.db2.gz HNEJVMNGIKXBIV-ZDUSSCGKSA-N 1 2 225.295 2.424 20 0 BEADLO c1ccc([C@@H]2CC[N@@H+]2Cc2ncccn2)cc1 ZINC000335719198 136340469 /nfs/dbraw/zinc/34/04/69/136340469.db2.gz HNEJVMNGIKXBIV-ZDUSSCGKSA-N 1 2 225.295 2.424 20 0 BEADLO C[C@H]1C[C@H]1CC(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000335842935 136354504 /nfs/dbraw/zinc/35/45/04/136354504.db2.gz FRSVHNFYJGOAIT-JQWIXIFHSA-N 1 2 247.342 2.162 20 0 BEADLO C[C@H]1C[C@H]1CC(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000335842935 136354505 /nfs/dbraw/zinc/35/45/05/136354505.db2.gz FRSVHNFYJGOAIT-JQWIXIFHSA-N 1 2 247.342 2.162 20 0 BEADLO c1ccc2c(c1)[nH]c1c2CC[N@@H+]([C@@H]2CCOC2)C1 ZINC000335896679 136359203 /nfs/dbraw/zinc/35/92/03/136359203.db2.gz UJHVWWVVQBARDO-LLVKDONJSA-N 1 2 242.322 2.315 20 0 BEADLO c1ccc2c(c1)[nH]c1c2CC[N@H+]([C@@H]2CCOC2)C1 ZINC000335896679 136359204 /nfs/dbraw/zinc/35/92/04/136359204.db2.gz UJHVWWVVQBARDO-LLVKDONJSA-N 1 2 242.322 2.315 20 0 BEADLO C[C@@H](Cc1cnn(C)c1)[NH2+]Cc1cccc(F)c1 ZINC000350550382 136361703 /nfs/dbraw/zinc/36/17/03/136361703.db2.gz APTVVDGIFXWCLY-NSHDSACASA-N 1 2 247.317 2.280 20 0 BEADLO CO[C@@H](C)C[NH2+][C@@H]1CCc2ccccc21 ZINC000167012440 136368039 /nfs/dbraw/zinc/36/80/39/136368039.db2.gz XTGIODNVNKFUTJ-GXFFZTMASA-N 1 2 205.301 2.298 20 0 BEADLO C[C@@H]([NH2+]Cc1ccc2c[nH]nc2c1)c1ccon1 ZINC000351580309 136369547 /nfs/dbraw/zinc/36/95/47/136369547.db2.gz LLCJCNGVKZBWNY-SECBINFHSA-N 1 2 242.282 2.402 20 0 BEADLO Cc1noc(C[NH2+]C(C)(C)c2ccc(C)nc2)n1 ZINC000351607761 136370019 /nfs/dbraw/zinc/37/00/19/136370019.db2.gz XPKYJOPUPMOOGH-UHFFFAOYSA-N 1 2 246.314 2.106 20 0 BEADLO CSC1CC[NH+]([C@@H](C)c2csnn2)CC1 ZINC000602921596 349811041 /nfs/dbraw/zinc/81/10/41/349811041.db2.gz USZNNYAGTGLFBH-QMMMGPOBSA-N 1 2 243.401 2.427 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1CSC1(C)C ZINC000577004513 365753955 /nfs/dbraw/zinc/75/39/55/365753955.db2.gz IKJSGYCJXMCYRM-SECBINFHSA-N 1 2 223.345 2.399 20 0 BEADLO CCc1cc(NCc2scnc2C)nc[nH+]1 ZINC000070837206 343501204 /nfs/dbraw/zinc/50/12/04/343501204.db2.gz GWNHXUVQCCWFQG-UHFFFAOYSA-N 1 2 234.328 2.416 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCC[C@@]2(CCOC2)C1 ZINC000580570855 365776742 /nfs/dbraw/zinc/77/67/42/365776742.db2.gz NXXOUKMOVIIONG-CQSZACIVSA-N 1 2 247.342 2.100 20 0 BEADLO Cc1cccc(C(=O)N(C)Cc2c[nH+]c[nH]2)c1F ZINC000622745294 343606048 /nfs/dbraw/zinc/60/60/48/343606048.db2.gz GJMCZZRSBFDRPE-UHFFFAOYSA-N 1 2 247.273 2.129 20 0 BEADLO Cc1cccc(C(=O)N(C)Cc2c[nH]c[nH+]2)c1F ZINC000622745294 343606049 /nfs/dbraw/zinc/60/60/49/343606049.db2.gz GJMCZZRSBFDRPE-UHFFFAOYSA-N 1 2 247.273 2.129 20 0 BEADLO Cc1ccc(C(=O)N(C)Cc2c[nH+]c[nH]2)cc1F ZINC000622745872 343606249 /nfs/dbraw/zinc/60/62/49/343606249.db2.gz YMZHDNSCLYRPKR-UHFFFAOYSA-N 1 2 247.273 2.129 20 0 BEADLO Cc1ccc(C(=O)N(C)Cc2c[nH]c[nH+]2)cc1F ZINC000622745872 343606251 /nfs/dbraw/zinc/60/62/51/343606251.db2.gz YMZHDNSCLYRPKR-UHFFFAOYSA-N 1 2 247.273 2.129 20 0 BEADLO COc1cc[nH+]cc1CS[C@@H](C)CCO ZINC000379879449 343647767 /nfs/dbraw/zinc/64/77/67/343647767.db2.gz UYUZICGDDFQRBS-VIFPVBQESA-N 1 2 227.329 2.094 20 0 BEADLO CCCc1ncc(CNc2nc(C)[nH+]cc2C)o1 ZINC000580580914 365790963 /nfs/dbraw/zinc/79/09/63/365790963.db2.gz FIMDSPQRYOWAHP-UHFFFAOYSA-N 1 2 246.314 2.068 20 0 BEADLO CCc1cc(NCc2cccc(CO)c2)nc[nH+]1 ZINC000071354777 343660085 /nfs/dbraw/zinc/66/00/85/343660085.db2.gz RNISKXFTHIEJBS-UHFFFAOYSA-N 1 2 243.310 2.143 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+]Cc1ccc(C)cc1C ZINC000049368876 187270077 /nfs/dbraw/zinc/27/00/77/187270077.db2.gz LHQUPBGYHZTNKR-GFCCVEGCSA-N 1 2 235.327 2.345 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)NC[C@H]1C[C@H]1C ZINC000287445145 187345789 /nfs/dbraw/zinc/34/57/89/187345789.db2.gz HRPVACGWLXRSPB-MWLCHTKSSA-N 1 2 233.315 2.476 20 0 BEADLO Cc1cc(CNC(=O)Cc2ccco2)cc(C)[nH+]1 ZINC000421573374 192364253 /nfs/dbraw/zinc/36/42/53/192364253.db2.gz AKNUMQBWTJJIHR-UHFFFAOYSA-N 1 2 244.294 2.150 20 0 BEADLO Cc1ccc(F)c(CN2CCc3[nH+]c[nH]c3C2)c1 ZINC000625434611 343735964 /nfs/dbraw/zinc/73/59/64/343735964.db2.gz COUZZESRNDCOSB-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO CC(C)N(C(=O)CCCn1cc[nH+]c1)C1CCC1 ZINC000607069170 343719229 /nfs/dbraw/zinc/71/92/29/343719229.db2.gz IPJSCUBMCNKBKW-UHFFFAOYSA-N 1 2 249.358 2.453 20 0 BEADLO CCCCc1cc(N[C@H](C)C(C)(C)O)nc[nH+]1 ZINC000631087634 343761925 /nfs/dbraw/zinc/76/19/25/343761925.db2.gz ZNHXFEBJOKNTCV-SNVBAGLBSA-N 1 2 237.347 2.391 20 0 BEADLO CN(CC1CCCCC1)C(=O)/C=C\c1[nH]cc[nH+]1 ZINC000493715075 529864087 /nfs/dbraw/zinc/86/40/87/529864087.db2.gz AGCXNQRPELWYQL-FPLPWBNLSA-N 1 2 247.342 2.462 20 0 BEADLO CC(C)(O)CNc1ccc([NH+]2CCCC2)cc1 ZINC000062996040 187273454 /nfs/dbraw/zinc/27/34/54/187273454.db2.gz ATZGPYWXKISIOH-UHFFFAOYSA-N 1 2 234.343 2.470 20 0 BEADLO CCc1cc(NC[C@H](C)SC)nc[nH+]1 ZINC000159243138 349871646 /nfs/dbraw/zinc/87/16/46/349871646.db2.gz KIWYHWXUNCUJSO-QMMMGPOBSA-N 1 2 211.334 2.202 20 0 BEADLO Cc1nn(C(C)C)cc1C[NH2+]CC(F)F ZINC000298049722 187353033 /nfs/dbraw/zinc/35/30/33/187353033.db2.gz IOEGKBNKOFKPCT-UHFFFAOYSA-N 1 2 217.263 2.127 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)NOCC1CC1 ZINC000297205567 187353152 /nfs/dbraw/zinc/35/31/52/187353152.db2.gz YEZKXFJHLYVRQY-UHFFFAOYSA-N 1 2 235.287 2.162 20 0 BEADLO CC[C@@H](NC(=O)[C@@H]1C[C@H]1CC)c1[nH]cc[nH+]1 ZINC000387668052 346996952 /nfs/dbraw/zinc/99/69/52/346996952.db2.gz KHEOBVIMNXILMS-OPRDCNLKSA-N 1 2 221.304 2.023 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1Cc1cocn1 ZINC000651913015 537827046 /nfs/dbraw/zinc/82/70/46/537827046.db2.gz KOPXMUAGJDLVDU-NEPJUHHUSA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@H+]1Cc1cocn1 ZINC000651913015 537827059 /nfs/dbraw/zinc/82/70/59/537827059.db2.gz KOPXMUAGJDLVDU-NEPJUHHUSA-N 1 2 224.304 2.064 20 0 BEADLO Cc1ccc(F)cc1C[NH+]1CCN(C2CC2)CC1 ZINC000179917240 347003397 /nfs/dbraw/zinc/00/33/97/347003397.db2.gz CNKVTLQJIWKEBW-UHFFFAOYSA-N 1 2 248.345 2.414 20 0 BEADLO O=C1CC[NH+](Cc2cc3ccccc3[nH]2)CC1 ZINC000022007609 343874430 /nfs/dbraw/zinc/87/44/30/343874430.db2.gz AKKMCPMYKZVYOF-UHFFFAOYSA-N 1 2 228.295 2.333 20 0 BEADLO C/C=C/C=C/C(=O)NCc1cn2ccccc2[nH+]1 ZINC000069097146 343932648 /nfs/dbraw/zinc/93/26/48/343932648.db2.gz FZYAQLOQOVNBTC-CRBCFSCISA-N 1 2 241.294 2.083 20 0 BEADLO COc1ccccc1CN(C)Cc1[nH]cc(C)[nH+]1 ZINC000628119558 343971505 /nfs/dbraw/zinc/97/15/05/343971505.db2.gz ZTUFGWHOCRTASG-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO CC(C)n1cc[nH+]c1CN1C[C@@H](C)O[C@@H](C)C1 ZINC000180300857 347022168 /nfs/dbraw/zinc/02/21/68/347022168.db2.gz XRTRHUUQBWXGFJ-TXEJJXNPSA-N 1 2 237.347 2.073 20 0 BEADLO Cc1nc(N2CC(C)(C)C2)c(C)c(C)[nH+]1 ZINC000683939519 488248595 /nfs/dbraw/zinc/24/85/95/488248595.db2.gz ZDYXLKZHCMVVEL-UHFFFAOYSA-N 1 2 205.305 2.248 20 0 BEADLO CC[C@@H]1CO[C@@H](C)CN1Cc1[nH]c(C)c(C)[nH+]1 ZINC000628119819 343967951 /nfs/dbraw/zinc/96/79/51/343967951.db2.gz LXZNVSKNNMWHMU-JOYOIKCWSA-N 1 2 237.347 2.026 20 0 BEADLO FC1(F)CCC[N@H+](Cc2ncc[nH]2)CC1 ZINC000625769390 344069843 /nfs/dbraw/zinc/06/98/43/344069843.db2.gz OPTIAAVFESBJLH-UHFFFAOYSA-N 1 2 215.247 2.031 20 0 BEADLO FC1(F)CCC[N@@H+](Cc2ncc[nH]2)CC1 ZINC000625769390 344069845 /nfs/dbraw/zinc/06/98/45/344069845.db2.gz OPTIAAVFESBJLH-UHFFFAOYSA-N 1 2 215.247 2.031 20 0 BEADLO OCC[C@@H]([NH2+]Cc1cscn1)c1ccccc1 ZINC000077468334 344073064 /nfs/dbraw/zinc/07/30/64/344073064.db2.gz LZAMZXLAIXTLPI-CYBMUJFWSA-N 1 2 248.351 2.356 20 0 BEADLO Cc1csc(CCNc2cc[nH+]cc2F)n1 ZINC000641281999 362343928 /nfs/dbraw/zinc/34/39/28/362343928.db2.gz XCFZNJJTWKRTJX-UHFFFAOYSA-N 1 2 237.303 2.062 20 0 BEADLO Fc1c[nH+]ccc1NCCOC1CCCCC1 ZINC000641304662 362353992 /nfs/dbraw/zinc/35/39/92/362353992.db2.gz JXJPXFYRLIWXOM-UHFFFAOYSA-N 1 2 238.306 2.404 20 0 BEADLO CCc1cc(NCC(O)(CC)CC)nc[nH+]1 ZINC000078598016 344099927 /nfs/dbraw/zinc/09/99/27/344099927.db2.gz HQKNGUGGGCJUGC-UHFFFAOYSA-N 1 2 223.320 2.002 20 0 BEADLO C[C@@H](CNc1cc(CO)cc[nH+]1)C1CC1 ZINC000641307945 362356073 /nfs/dbraw/zinc/35/60/73/362356073.db2.gz MTPSZXCMXFMSFQ-VIFPVBQESA-N 1 2 206.289 2.032 20 0 BEADLO C[C@@H]1CN(c2cc[nH+]cc2F)CC(C)(C)O1 ZINC000641312375 362358416 /nfs/dbraw/zinc/35/84/16/362358416.db2.gz WYBOWXHJKMNTQN-SECBINFHSA-N 1 2 224.279 2.224 20 0 BEADLO c1c(C[N@@H+]2CCO[C@@H]3CCC[C@@H]32)onc1C1CC1 ZINC000625854132 344125570 /nfs/dbraw/zinc/12/55/70/344125570.db2.gz XZLYJVONXKMTMA-UONOGXRCSA-N 1 2 248.326 2.305 20 0 BEADLO c1c(C[N@H+]2CCO[C@@H]3CCC[C@@H]32)onc1C1CC1 ZINC000625854132 344125572 /nfs/dbraw/zinc/12/55/72/344125572.db2.gz XZLYJVONXKMTMA-UONOGXRCSA-N 1 2 248.326 2.305 20 0 BEADLO CC(F)(F)C[NH2+]Cc1ccnn1CC1CCC1 ZINC000631142441 344154844 /nfs/dbraw/zinc/15/48/44/344154844.db2.gz GKXXFULMBRRKCT-UHFFFAOYSA-N 1 2 243.301 2.428 20 0 BEADLO Cc1ccc(NCc2c(Cl)cnn2C)c[nH+]1 ZINC000128784966 344208910 /nfs/dbraw/zinc/20/89/10/344208910.db2.gz RMXBRKPRBIIBIH-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO C[C@H](c1ccccn1)N(C)c1cc(CO)cc[nH+]1 ZINC000641339420 362369804 /nfs/dbraw/zinc/36/98/04/362369804.db2.gz NRUWMMPQVKTRSV-LLVKDONJSA-N 1 2 243.310 2.166 20 0 BEADLO CC[C@@H](O)c1ccc(OCc2c[nH+]cn2C)cc1 ZINC000091278661 344279751 /nfs/dbraw/zinc/27/97/51/344279751.db2.gz FWZZNMSZYKQYTI-CQSZACIVSA-N 1 2 246.310 2.443 20 0 BEADLO Cc1cc(N2CC(c3ccccc3)C2)nc[nH+]1 ZINC000631423402 344241455 /nfs/dbraw/zinc/24/14/55/344241455.db2.gz UCIHQCGYXZHKQF-UHFFFAOYSA-N 1 2 225.295 2.389 20 0 BEADLO Fc1c[nH+]ccc1NCCCc1nccs1 ZINC000641373556 362382025 /nfs/dbraw/zinc/38/20/25/362382025.db2.gz DPIYAWCWSRDSNT-UHFFFAOYSA-N 1 2 237.303 2.144 20 0 BEADLO COc1ccsc1C[N@@H+]1CCO[C@@H](C)[C@H]1C ZINC000093417899 344315661 /nfs/dbraw/zinc/31/56/61/344315661.db2.gz LEFQQNFFDURJHG-ZJUUUORDSA-N 1 2 241.356 2.366 20 0 BEADLO COc1ccsc1C[N@H+]1CCO[C@@H](C)[C@H]1C ZINC000093417899 344315666 /nfs/dbraw/zinc/31/56/66/344315666.db2.gz LEFQQNFFDURJHG-ZJUUUORDSA-N 1 2 241.356 2.366 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CCC[C@@H](C)C1)c1[nH+]ccn1C ZINC000620598907 344334058 /nfs/dbraw/zinc/33/40/58/344334058.db2.gz AAMWNVGMNRDFGV-IJLUTSLNSA-N 1 2 249.358 2.424 20 0 BEADLO C[C@H](NC(=O)[C@H]1CC[C@@H](C)C1)c1[nH+]ccn1C ZINC000620603062 344352657 /nfs/dbraw/zinc/35/26/57/344352657.db2.gz DTYZSWJMXLEDNX-VWYCJHECSA-N 1 2 235.331 2.034 20 0 BEADLO CC1=C(C(=O)N[C@@H](C)c2[nH+]ccn2C)CCC1 ZINC000620604031 344354733 /nfs/dbraw/zinc/35/47/33/344354733.db2.gz PREUBRYEFSHTCC-JTQLQIEISA-N 1 2 233.315 2.098 20 0 BEADLO Cc1noc(C)c1[C@@H](C)Nc1cc(CO)cc[nH+]1 ZINC000641376994 362380750 /nfs/dbraw/zinc/38/07/50/362380750.db2.gz OUJRZADRCTYJBK-MRVPVSSYSA-N 1 2 247.298 2.352 20 0 BEADLO Cc1noc(C)c1C[C@@H](C)Nc1cc[nH+]cc1F ZINC000641383122 362385916 /nfs/dbraw/zinc/38/59/16/362385916.db2.gz AWYYZVQSTVBJLF-MRVPVSSYSA-N 1 2 249.289 2.291 20 0 BEADLO Clc1cccnc1NCCn1cc[nH+]c1 ZINC000041042097 344414254 /nfs/dbraw/zinc/41/42/54/344414254.db2.gz UHPBFTSJSZHDKP-UHFFFAOYSA-N 1 2 222.679 2.044 20 0 BEADLO OCc1cc[nH+]c(NCC(C2CC2)C2CC2)c1 ZINC000641400942 362393134 /nfs/dbraw/zinc/39/31/34/362393134.db2.gz AVFPIHQOSAVBSA-UHFFFAOYSA-N 1 2 232.327 2.422 20 0 BEADLO Cc1[nH]c(C(=O)NCC2C(C)(C)C2(C)C)c[nH+]1 ZINC000408329125 344507954 /nfs/dbraw/zinc/50/79/54/344507954.db2.gz XXXHCKMBIYPTOF-UHFFFAOYSA-N 1 2 235.331 2.130 20 0 BEADLO CC(C)C[C@H](C)C(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000358174726 187291298 /nfs/dbraw/zinc/29/12/98/187291298.db2.gz YWCBOARJHPDARY-WDEREUQCSA-N 1 2 249.358 2.065 20 0 BEADLO CC(C)C[C@H](C)C(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000358174726 187291300 /nfs/dbraw/zinc/29/13/00/187291300.db2.gz YWCBOARJHPDARY-WDEREUQCSA-N 1 2 249.358 2.065 20 0 BEADLO COC(=O)[C@H]([NH2+]CCSC(C)C)C(C)(C)C ZINC000381493904 344513167 /nfs/dbraw/zinc/51/31/67/344513167.db2.gz ZLDPQNKGBOHDIX-JTQLQIEISA-N 1 2 247.404 2.305 20 0 BEADLO CO[C@H](CNc1cc(CO)cc[nH+]1)C(C)(C)C ZINC000641411273 362402803 /nfs/dbraw/zinc/40/28/03/362402803.db2.gz TVPUXOLFSGHKLX-LLVKDONJSA-N 1 2 238.331 2.047 20 0 BEADLO CCCC[C@H]([NH2+][C@@H]1CCS[C@H]1C)C(=O)OC ZINC000381551191 344520107 /nfs/dbraw/zinc/52/01/07/344520107.db2.gz MUMXOGXWTQZLRJ-AXFHLTTASA-N 1 2 245.388 2.202 20 0 BEADLO C[C@H](CC(=O)NCC1CC(C)(C)C1)n1cc[nH+]c1 ZINC000577378314 344524940 /nfs/dbraw/zinc/52/49/40/344524940.db2.gz QNFFOVBUSMEVSY-LLVKDONJSA-N 1 2 249.358 2.387 20 0 BEADLO C[C@H](Cc1ccncc1)Nc1cc(CO)cc[nH+]1 ZINC000641417832 362405432 /nfs/dbraw/zinc/40/54/32/362405432.db2.gz JBOIHIUBEULFNS-LLVKDONJSA-N 1 2 243.310 2.012 20 0 BEADLO CO[C@@H](CNc1cc(CO)cc[nH+]1)C(C)(C)C ZINC000641411649 362399107 /nfs/dbraw/zinc/39/91/07/362399107.db2.gz TVPUXOLFSGHKLX-NSHDSACASA-N 1 2 238.331 2.047 20 0 BEADLO OCc1cc[nH+]c(N[C@@H]2CCOC3(CCC3)C2)c1 ZINC000641447633 362424638 /nfs/dbraw/zinc/42/46/38/362424638.db2.gz PNGJMYRBNXRLIJ-GFCCVEGCSA-N 1 2 248.326 2.088 20 0 BEADLO CCC1(O)CCC(Nc2cc[nH+]cc2F)CC1 ZINC000641475735 362445278 /nfs/dbraw/zinc/44/52/78/362445278.db2.gz BUGSQAXZEXCAEB-UHFFFAOYSA-N 1 2 238.306 2.138 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@H]([C@H]2CCOC2)C1 ZINC000641457701 362429023 /nfs/dbraw/zinc/42/90/23/362429023.db2.gz ZGOOJUKHNZBOGD-QWRGUYRKSA-N 1 2 236.290 2.084 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@H]([C@@H]2CCOC2)C1 ZINC000641457702 362429251 /nfs/dbraw/zinc/42/92/51/362429251.db2.gz ZGOOJUKHNZBOGD-WDEREUQCSA-N 1 2 236.290 2.084 20 0 BEADLO CN(Cc1ccccc1)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492863725 529996932 /nfs/dbraw/zinc/99/69/32/529996932.db2.gz MUVHRBPVKCICKC-FPLPWBNLSA-N 1 2 241.294 2.082 20 0 BEADLO CC(=O)CSCCc1[nH]c2ccccc2[nH+]1 ZINC000603316830 349913045 /nfs/dbraw/zinc/91/30/45/349913045.db2.gz BRMYZSQVNKRUFB-UHFFFAOYSA-N 1 2 234.324 2.428 20 0 BEADLO CC(C)CSCCNc1cc(CO)cc[nH+]1 ZINC000603319426 349914011 /nfs/dbraw/zinc/91/40/11/349914011.db2.gz IMUVWXNSUSXDFQ-UHFFFAOYSA-N 1 2 240.372 2.375 20 0 BEADLO C[C@@H]1C[C@@H](Nc2cc[nH+]cc2F)C[C@H](C)O1 ZINC000641473938 362443456 /nfs/dbraw/zinc/44/34/56/362443456.db2.gz QXYNRAIYQXLLLW-ILWJIGKKSA-N 1 2 224.279 2.011 20 0 BEADLO CC[N@H+](Cc1ncc[nH]1)Cc1ccccc1 ZINC000111192287 344583273 /nfs/dbraw/zinc/58/32/73/344583273.db2.gz CVHHLBGDLNLGRB-UHFFFAOYSA-N 1 2 215.300 2.432 20 0 BEADLO CC[N@@H+](Cc1ncc[nH]1)Cc1ccccc1 ZINC000111192287 344583274 /nfs/dbraw/zinc/58/32/74/344583274.db2.gz CVHHLBGDLNLGRB-UHFFFAOYSA-N 1 2 215.300 2.432 20 0 BEADLO CC(C)CO[C@@H]1CCN(c2cc[nH+]cc2F)C1 ZINC000641435939 362416378 /nfs/dbraw/zinc/41/63/78/362416378.db2.gz YKNSOBMFFQXGKU-LLVKDONJSA-N 1 2 238.306 2.472 20 0 BEADLO Cn1cccc1C(=O)C[N@H+](C)Cc1ccsc1 ZINC000048777823 344589288 /nfs/dbraw/zinc/58/92/88/344589288.db2.gz QXBZFBXHUBPYHJ-UHFFFAOYSA-N 1 2 248.351 2.401 20 0 BEADLO Cn1cccc1C(=O)C[N@@H+](C)Cc1ccsc1 ZINC000048777823 344589290 /nfs/dbraw/zinc/58/92/90/344589290.db2.gz QXBZFBXHUBPYHJ-UHFFFAOYSA-N 1 2 248.351 2.401 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1CCC(F)(F)C1 ZINC000641437954 362418441 /nfs/dbraw/zinc/41/84/41/362418441.db2.gz ALUYKZUOYSSHKR-SSDOTTSWSA-N 1 2 216.206 2.242 20 0 BEADLO CC(C)[C@@H]1CN(c2cc[nH+]cc2F)CCO1 ZINC000641482758 362453918 /nfs/dbraw/zinc/45/39/18/362453918.db2.gz DZANRDOCXCBJAV-LBPRGKRZSA-N 1 2 224.279 2.082 20 0 BEADLO C[C@@H](CNc1cc[nH+]cc1F)c1nccs1 ZINC000641489174 362457666 /nfs/dbraw/zinc/45/76/66/362457666.db2.gz MPBUEPGULJPFHP-QMMMGPOBSA-N 1 2 237.303 2.315 20 0 BEADLO OC1CCN(c2[nH+]ccc3ccccc32)CC1 ZINC000168745206 344680128 /nfs/dbraw/zinc/68/01/28/344680128.db2.gz XWBJYALAWLILOF-UHFFFAOYSA-N 1 2 228.295 2.196 20 0 BEADLO OC[C@H]1CCCN(c2[nH+]ccc3ccccc32)C1 ZINC000168745731 344680710 /nfs/dbraw/zinc/68/07/10/344680710.db2.gz CTTVCBMKFFNHSD-LBPRGKRZSA-N 1 2 242.322 2.444 20 0 BEADLO Cc1ncc(C[N@@H+]2CCO[C@@H](CCF)C2)s1 ZINC000626002485 344663160 /nfs/dbraw/zinc/66/31/60/344663160.db2.gz OJSJXDJFKDUGEJ-JTQLQIEISA-N 1 2 244.335 2.012 20 0 BEADLO Cc1ncc(C[N@H+]2CCO[C@@H](CCF)C2)s1 ZINC000626002485 344663162 /nfs/dbraw/zinc/66/31/62/344663162.db2.gz OJSJXDJFKDUGEJ-JTQLQIEISA-N 1 2 244.335 2.012 20 0 BEADLO C[C@@H]1[C@H](C(F)(F)F)OCC[N@@H+]1CCCCF ZINC000626019177 344675043 /nfs/dbraw/zinc/67/50/43/344675043.db2.gz NQEFPVVTOGZKOU-RKDXNWHRSA-N 1 2 243.244 2.388 20 0 BEADLO C[C@@H]1[C@H](C(F)(F)F)OCC[N@H+]1CCCCF ZINC000626019177 344675044 /nfs/dbraw/zinc/67/50/44/344675044.db2.gz NQEFPVVTOGZKOU-RKDXNWHRSA-N 1 2 243.244 2.388 20 0 BEADLO CCc1noc(C[N@@H+]2CCC(F)(F)C[C@@H]2C)n1 ZINC000625979371 344644545 /nfs/dbraw/zinc/64/45/45/344644545.db2.gz ITJBDRAHSYGCNJ-QMMMGPOBSA-N 1 2 245.273 2.252 20 0 BEADLO CCc1noc(C[N@H+]2CCC(F)(F)C[C@@H]2C)n1 ZINC000625979371 344644546 /nfs/dbraw/zinc/64/45/46/344644546.db2.gz ITJBDRAHSYGCNJ-QMMMGPOBSA-N 1 2 245.273 2.252 20 0 BEADLO CCc1noc(C[N@@H+]2CCC(F)(F)C[C@H]2C)n1 ZINC000625979370 344644580 /nfs/dbraw/zinc/64/45/80/344644580.db2.gz ITJBDRAHSYGCNJ-MRVPVSSYSA-N 1 2 245.273 2.252 20 0 BEADLO CCc1noc(C[N@H+]2CCC(F)(F)C[C@H]2C)n1 ZINC000625979370 344644581 /nfs/dbraw/zinc/64/45/81/344644581.db2.gz ITJBDRAHSYGCNJ-MRVPVSSYSA-N 1 2 245.273 2.252 20 0 BEADLO Cc1ccc(NCc2cscn2)c[nH+]1 ZINC000128081548 344733061 /nfs/dbraw/zinc/73/30/61/344733061.db2.gz VVOKSYPRDHPQSU-UHFFFAOYSA-N 1 2 205.286 2.459 20 0 BEADLO CN(Cc1nccs1)c1cccc[nH+]1 ZINC000074778368 344759261 /nfs/dbraw/zinc/75/92/61/344759261.db2.gz FSOMWDAGSSJRBF-UHFFFAOYSA-N 1 2 205.286 2.175 20 0 BEADLO CC[C@@H](C)C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000075552089 344779240 /nfs/dbraw/zinc/77/92/40/344779240.db2.gz PHFPYZSOJXHNMY-GHMZBOCLSA-N 1 2 235.331 2.162 20 0 BEADLO CCCCc1cc(N[C@@H]2C=C[C@H](CO)C2)nc[nH+]1 ZINC000631144866 344803601 /nfs/dbraw/zinc/80/36/01/344803601.db2.gz UMDFPDZVVWJBPT-WCQYABFASA-N 1 2 247.342 2.168 20 0 BEADLO C[C@@H]1[C@H](C)[S@@](=O)CC[N@@H+]1Cc1ccccc1 ZINC000076825054 344806862 /nfs/dbraw/zinc/80/68/62/344806862.db2.gz CQQXJFSNNKJUHY-BFQNTYOBSA-N 1 2 237.368 2.028 20 0 BEADLO C[C@@H]1[C@H](C)[S@@](=O)CC[N@H+]1Cc1ccccc1 ZINC000076825054 344806864 /nfs/dbraw/zinc/80/68/64/344806864.db2.gz CQQXJFSNNKJUHY-BFQNTYOBSA-N 1 2 237.368 2.028 20 0 BEADLO O=C1OCC[C@H]1[N@@H+]1CCC[C@H]1c1ccsc1 ZINC000076989474 344811679 /nfs/dbraw/zinc/81/16/79/344811679.db2.gz IWGOMGDTFNTYNL-WDEREUQCSA-N 1 2 237.324 2.201 20 0 BEADLO O=C1OCC[C@H]1[N@H+]1CCC[C@H]1c1ccsc1 ZINC000076989474 344811681 /nfs/dbraw/zinc/81/16/81/344811681.db2.gz IWGOMGDTFNTYNL-WDEREUQCSA-N 1 2 237.324 2.201 20 0 BEADLO Cc1nc(NC[C@@](C)(O)c2ccccc2)cc[nH+]1 ZINC000078260769 344838290 /nfs/dbraw/zinc/83/82/90/344838290.db2.gz AQCSGXXUFXGUHP-CQSZACIVSA-N 1 2 243.310 2.105 20 0 BEADLO CC[N@@H+](Cc1nc(C)c(C)[nH]1)C[C@H]1CCCO1 ZINC000628152637 344841164 /nfs/dbraw/zinc/84/11/64/344841164.db2.gz JERRILKFOOFVHJ-GFCCVEGCSA-N 1 2 237.347 2.027 20 0 BEADLO CC[N@H+](Cc1nc(C)c(C)[nH]1)C[C@H]1CCCO1 ZINC000628152637 344841165 /nfs/dbraw/zinc/84/11/65/344841165.db2.gz JERRILKFOOFVHJ-GFCCVEGCSA-N 1 2 237.347 2.027 20 0 BEADLO CCN(Cc1[nH]c(C)c(C)[nH+]1)C[C@H]1CCCO1 ZINC000628152637 344841166 /nfs/dbraw/zinc/84/11/66/344841166.db2.gz JERRILKFOOFVHJ-GFCCVEGCSA-N 1 2 237.347 2.027 20 0 BEADLO C[C@H](CC(=O)N[C@H](C)C(C)(C)C)n1cc[nH+]c1 ZINC000577068555 365802315 /nfs/dbraw/zinc/80/23/15/365802315.db2.gz VFFZCGUYXUQKRG-GHMZBOCLSA-N 1 2 237.347 2.385 20 0 BEADLO Cc1nc(NCc2nccn2CC(C)C)cc[nH+]1 ZINC000078336815 344848341 /nfs/dbraw/zinc/84/83/41/344848341.db2.gz LEYAHBKTBAZVMA-UHFFFAOYSA-N 1 2 245.330 2.250 20 0 BEADLO Cc1c[nH]c(C[NH+]2C[C@H](C)S[C@@H](C)C2)n1 ZINC000628156357 344848708 /nfs/dbraw/zinc/84/87/08/344848708.db2.gz MEHNMQPEUQFRMF-UWVGGRQHSA-N 1 2 225.361 2.044 20 0 BEADLO Cc1nn(C)c(C)c1C[C@H](C)Nc1cccc[nH+]1 ZINC000078399269 344861325 /nfs/dbraw/zinc/86/13/25/344861325.db2.gz RWIBCBDGRJKYSY-JTQLQIEISA-N 1 2 244.342 2.475 20 0 BEADLO Cc1ncc(CN2CCCC[C@@H]2c2[nH]cc[nH+]2)o1 ZINC000628160047 344859158 /nfs/dbraw/zinc/85/91/58/344859158.db2.gz GCAJDYGDVVJLLG-GFCCVEGCSA-N 1 2 246.314 2.433 20 0 BEADLO Cc1[nH]c(CN(C)C[C@H]2CCCCO2)[nH+]c1C ZINC000628153241 344843075 /nfs/dbraw/zinc/84/30/75/344843075.db2.gz GKTPSFAKECIYOG-GFCCVEGCSA-N 1 2 237.347 2.027 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@H]2CCCCO2)[nH]c1C ZINC000628153241 344843076 /nfs/dbraw/zinc/84/30/76/344843076.db2.gz GKTPSFAKECIYOG-GFCCVEGCSA-N 1 2 237.347 2.027 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@H]2CCCCO2)[nH]c1C ZINC000628153241 344843078 /nfs/dbraw/zinc/84/30/78/344843078.db2.gz GKTPSFAKECIYOG-GFCCVEGCSA-N 1 2 237.347 2.027 20 0 BEADLO C[C@H](c1ccccc1)[C@@H](O)C[NH2+]CC(C)(F)F ZINC000563001505 323079203 /nfs/dbraw/zinc/07/92/03/323079203.db2.gz VSRCGGSSAAQLRC-PWSUYJOCSA-N 1 2 243.297 2.396 20 0 BEADLO CSCCN(C)c1cc[nH+]c(C2CC2)n1 ZINC000153438870 344876198 /nfs/dbraw/zinc/87/61/98/344876198.db2.gz VTHDZAMYOSYINZ-UHFFFAOYSA-N 1 2 223.345 2.153 20 0 BEADLO C[C@@H]1CN(c2cccc[nH+]2)C[C@H](C)S1 ZINC000078495625 344876278 /nfs/dbraw/zinc/87/62/78/344876278.db2.gz APAUQFWIEKRTMM-AOOOYVTPSA-N 1 2 208.330 2.412 20 0 BEADLO C[C@@H]1OCC[C@@H]1SCc1ccc[nH+]c1N ZINC000235323460 344886568 /nfs/dbraw/zinc/88/65/68/344886568.db2.gz KRLLODBSPHNWLA-WPRPVWTQSA-N 1 2 224.329 2.074 20 0 BEADLO C[C@@H]1CC[C@@H](NC(=O)CCc2c[nH+]c[nH]2)C[C@H]1C ZINC000249116846 537871374 /nfs/dbraw/zinc/87/13/74/537871374.db2.gz SKAXGMBKNFXYEQ-IJLUTSLNSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CC[C@@H](NC(=O)CCc2c[nH]c[nH+]2)C[C@H]1C ZINC000249116846 537871383 /nfs/dbraw/zinc/87/13/83/537871383.db2.gz SKAXGMBKNFXYEQ-IJLUTSLNSA-N 1 2 249.358 2.283 20 0 BEADLO CCCN1C(=O)C2(CCCCC2)[NH2+][C@H]1C1CC1 ZINC000078762797 344903652 /nfs/dbraw/zinc/90/36/52/344903652.db2.gz OLVZXTNRFCSVAF-GFCCVEGCSA-N 1 2 236.359 2.267 20 0 BEADLO CC[C@@H](SC)C(=O)Nc1cc[nH+]c(C)c1 ZINC000122514969 344962050 /nfs/dbraw/zinc/96/20/50/344962050.db2.gz HTOXWMUNLUFJSA-SNVBAGLBSA-N 1 2 224.329 2.470 20 0 BEADLO Cc1ncc(C[N@@H+]2CCO[C@@H](c3ccco3)C2)o1 ZINC000628187811 344940995 /nfs/dbraw/zinc/94/09/95/344940995.db2.gz AVVGCYISGKDSLB-CYBMUJFWSA-N 1 2 248.282 2.150 20 0 BEADLO Cc1ncc(C[N@H+]2CCO[C@@H](c3ccco3)C2)o1 ZINC000628187811 344940996 /nfs/dbraw/zinc/94/09/96/344940996.db2.gz AVVGCYISGKDSLB-CYBMUJFWSA-N 1 2 248.282 2.150 20 0 BEADLO CC(C)(O)CCSCc1ccc[nH+]c1N ZINC000603345956 349921536 /nfs/dbraw/zinc/92/15/36/349921536.db2.gz YPEKDZGGUGRMTN-UHFFFAOYSA-N 1 2 226.345 2.058 20 0 BEADLO COC(=O)C[N@H+](Cc1cc(C)cc(C)c1)C1CC1 ZINC000079501047 344982134 /nfs/dbraw/zinc/98/21/34/344982134.db2.gz XHPBTMDEZJCBIB-UHFFFAOYSA-N 1 2 247.338 2.441 20 0 BEADLO COC(=O)C[N@@H+](Cc1cc(C)cc(C)c1)C1CC1 ZINC000079501047 344982138 /nfs/dbraw/zinc/98/21/38/344982138.db2.gz XHPBTMDEZJCBIB-UHFFFAOYSA-N 1 2 247.338 2.441 20 0 BEADLO O[C@@H](CNc1cccc[nH+]1)c1ccc(F)cc1 ZINC000079883439 345048378 /nfs/dbraw/zinc/04/83/78/345048378.db2.gz JLYMCGALOHWXFR-LBPRGKRZSA-N 1 2 232.258 2.366 20 0 BEADLO O=C(/C=C/C1CC1)N1CCC(n2cc[nH+]c2)CC1 ZINC000079839752 345043595 /nfs/dbraw/zinc/04/35/95/345043595.db2.gz UIXRRANNLHRBCL-ONEGZZNKSA-N 1 2 245.326 2.013 20 0 BEADLO CCC[C@H]1C[C@@H]1C(=O)Nc1c[nH+]ccc1OC ZINC000079843603 345043643 /nfs/dbraw/zinc/04/36/43/345043643.db2.gz BIJVROJZRKWQPW-UWVGGRQHSA-N 1 2 234.299 2.465 20 0 BEADLO CC[C@@H](C)[C@@H](CNc1cc[nH+]cc1F)OC ZINC000641615219 362547130 /nfs/dbraw/zinc/54/71/30/362547130.db2.gz IKHFWQGYCYQIDZ-BXKDBHETSA-N 1 2 226.295 2.116 20 0 BEADLO Cc1cncnc1N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000641622372 362554178 /nfs/dbraw/zinc/55/41/78/362554178.db2.gz SYRZQIYKWWOLRJ-NXEZZACHSA-N 1 2 229.287 2.099 20 0 BEADLO CCOC1CC(N(C)c2cc[nH+]cc2F)C1 ZINC000641599612 362540126 /nfs/dbraw/zinc/54/01/26/362540126.db2.gz LWQREXBEROQVRE-UHFFFAOYSA-N 1 2 224.279 2.224 20 0 BEADLO C[C@@H]1CN(c2cc(CO)cc[nH+]2)CCC1(F)F ZINC000641602629 362540193 /nfs/dbraw/zinc/54/01/93/362540193.db2.gz XRMGJEZIXMPRTF-SECBINFHSA-N 1 2 242.269 2.055 20 0 BEADLO COCC1CCN(c2cc[nH+]cc2F)CC1 ZINC000678787176 488282643 /nfs/dbraw/zinc/28/26/43/488282643.db2.gz BEGDZHDNXDVBOX-UHFFFAOYSA-N 1 2 224.279 2.084 20 0 BEADLO CCCN(CCC)C(=O)[C@H]1CCn2cc[nH+]c2C1 ZINC000155955968 345116172 /nfs/dbraw/zinc/11/61/72/345116172.db2.gz UTIVNJARLAFPQJ-LBPRGKRZSA-N 1 2 249.358 2.094 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)/C=C/C1CC1 ZINC000080111355 345100883 /nfs/dbraw/zinc/10/08/83/345100883.db2.gz LMUQTZJTUAXOJM-SNAWJCMRSA-N 1 2 202.257 2.295 20 0 BEADLO Fc1c[nH+]ccc1NC1CC2(CCC2)C1 ZINC000641652249 362578770 /nfs/dbraw/zinc/57/87/70/362578770.db2.gz KJUTWRRCKJYHHL-UHFFFAOYSA-N 1 2 206.264 2.387 20 0 BEADLO Fc1c[nH+]ccc1N1CCC[C@@]2(CCOC2)C1 ZINC000641628228 362558136 /nfs/dbraw/zinc/55/81/36/362558136.db2.gz BQXSUYPFLLTTFG-CYBMUJFWSA-N 1 2 236.290 2.228 20 0 BEADLO CCCc1ncc(CNc2cc(CO)cc[nH+]2)o1 ZINC000641629823 362560202 /nfs/dbraw/zinc/56/02/02/362560202.db2.gz OLSHCTOSHXVMPJ-UHFFFAOYSA-N 1 2 247.298 2.127 20 0 BEADLO Fc1c[nH+]ccc1N[C@H]1CCC[C@@H]2C[C@@H]21 ZINC000641630462 362562038 /nfs/dbraw/zinc/56/20/38/362562038.db2.gz VKUPUJHAGVLFMW-YWVKMMECSA-N 1 2 206.264 2.243 20 0 BEADLO C[C@H]1CC(C)(C)CN1c1cc(CO)cc[nH+]1 ZINC000641634186 362563878 /nfs/dbraw/zinc/56/38/78/362563878.db2.gz KHVQXMGWGODMBU-JTQLQIEISA-N 1 2 220.316 2.199 20 0 BEADLO Cc1cccnc1CCCNc1cc[nH+]cc1F ZINC000641635130 362565210 /nfs/dbraw/zinc/56/52/10/362565210.db2.gz OVCWJJWEYSFIJV-UHFFFAOYSA-N 1 2 245.301 2.391 20 0 BEADLO C[C@@H](CF)[NH2+]Cc1nc2cc(F)ccc2o1 ZINC000634981048 345164419 /nfs/dbraw/zinc/16/44/19/345164419.db2.gz VRIMCSQHFDCNDU-ZETCQYMHSA-N 1 2 226.226 2.415 20 0 BEADLO Oc1ccc2c(c1)[C@@H]([NH2+]Cc1ccon1)CC2 ZINC000634986545 345166532 /nfs/dbraw/zinc/16/65/32/345166532.db2.gz YAQJFAOJLVYGKY-ZDUSSCGKSA-N 1 2 230.267 2.157 20 0 BEADLO c1cc(CNc2ccc(N3CCCC3)[nH+]c2)no1 ZINC000634971891 345150254 /nfs/dbraw/zinc/15/02/54/345150254.db2.gz IQZCIIZHQJTKOZ-UHFFFAOYSA-N 1 2 244.298 2.282 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1CC(C)(C)C[C@H]1C ZINC000579978007 345224776 /nfs/dbraw/zinc/22/47/76/345224776.db2.gz NDGGUEUEINYQEI-WDEREUQCSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1CC(C)(C)C[C@H]1C ZINC000579978007 345224778 /nfs/dbraw/zinc/22/47/78/345224778.db2.gz NDGGUEUEINYQEI-WDEREUQCSA-N 1 2 249.358 2.235 20 0 BEADLO CCc1c[nH]c(CC(=O)N(C)c2ccccc2)[nH+]1 ZINC000635059990 345230032 /nfs/dbraw/zinc/23/00/32/345230032.db2.gz XPDDCJYBUNSJEN-UHFFFAOYSA-N 1 2 243.310 2.178 20 0 BEADLO CCc1c[nH]c(CC(=O)Nc2cccc(C)c2)[nH+]1 ZINC000635057820 345231614 /nfs/dbraw/zinc/23/16/14/345231614.db2.gz AHSMJOSATPWGEG-UHFFFAOYSA-N 1 2 243.310 2.462 20 0 BEADLO O=C(NC1CCCCCC1)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635074106 345240200 /nfs/dbraw/zinc/24/02/00/345240200.db2.gz RAHYBMYFRPJUPU-VXGBXAGGSA-N 1 2 247.342 2.352 20 0 BEADLO O=C(NC1CCCCCC1)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635074106 345240202 /nfs/dbraw/zinc/24/02/02/345240202.db2.gz RAHYBMYFRPJUPU-VXGBXAGGSA-N 1 2 247.342 2.352 20 0 BEADLO CC(C)CNC(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC000635087057 345243467 /nfs/dbraw/zinc/24/34/67/345243467.db2.gz OLLCZPFKZNWNHA-LBPRGKRZSA-N 1 2 237.347 2.243 20 0 BEADLO CC(C)Cn1cc[nH+]c1CNC(=O)/C=C/C1CC1 ZINC000080462982 345223219 /nfs/dbraw/zinc/22/32/19/345223219.db2.gz VTWFCFPGOUXNPP-AATRIKPKSA-N 1 2 247.342 2.122 20 0 BEADLO CC[C@@H](SC)C(=O)Nc1cc[nH+]cc1C ZINC000130128561 345269405 /nfs/dbraw/zinc/26/94/05/345269405.db2.gz WPPBPUBNBOEYFG-SNVBAGLBSA-N 1 2 224.329 2.470 20 0 BEADLO C[C@H]1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635229351 345278986 /nfs/dbraw/zinc/27/89/86/345278986.db2.gz NKQOYEMXJWFAMT-IRCOFANPSA-N 1 2 247.342 2.208 20 0 BEADLO C[C@H]1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635229351 345278989 /nfs/dbraw/zinc/27/89/89/345278989.db2.gz NKQOYEMXJWFAMT-IRCOFANPSA-N 1 2 247.342 2.208 20 0 BEADLO CC(C)CN(C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C1CC1 ZINC000635236382 345280497 /nfs/dbraw/zinc/28/04/97/345280497.db2.gz NSSBDJXAXFMZSD-VXGBXAGGSA-N 1 2 247.342 2.160 20 0 BEADLO CC(C)CN(C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C1CC1 ZINC000635236382 345280501 /nfs/dbraw/zinc/28/05/01/345280501.db2.gz NSSBDJXAXFMZSD-VXGBXAGGSA-N 1 2 247.342 2.160 20 0 BEADLO CC(C)C[C@H](C(=O)N(C)C1CC1)n1cc[nH+]c1 ZINC000635263520 345290879 /nfs/dbraw/zinc/29/08/79/345290879.db2.gz QANDMHFQUOSHRW-GFCCVEGCSA-N 1 2 235.331 2.091 20 0 BEADLO CCc1c[nH]c(CC(=O)NCCC(C)(C)C)[nH+]1 ZINC000635270613 345291763 /nfs/dbraw/zinc/29/17/63/345291763.db2.gz PIVRPITZQNAPNH-UHFFFAOYSA-N 1 2 237.347 2.067 20 0 BEADLO CC(C)C[C@H](C(=O)NC[C@@H]1C[C@@H]1C)n1cc[nH+]c1 ZINC000635300966 345299224 /nfs/dbraw/zinc/29/92/24/345299224.db2.gz QPHCUMHDNUSUOY-RWMBFGLXSA-N 1 2 249.358 2.243 20 0 BEADLO Cc1ccncc1[C@@H](C)[NH2+]Cc1ncccn1 ZINC000562318590 345341424 /nfs/dbraw/zinc/34/14/24/345341424.db2.gz BMWJJAZLKVPHTO-LLVKDONJSA-N 1 2 228.299 2.031 20 0 BEADLO C[C@H](C(=O)N[C@H]1CCCC[C@H]1C)n1cc[nH+]c1 ZINC000053898649 1172060011 /nfs/dbraw/zinc/06/00/11/1172060011.db2.gz OCWWWLHETWDSRS-UTUOFQBUSA-N 1 2 235.331 2.139 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@H](C)[C@H](C)CC)[nH+]1 ZINC000635419789 345359811 /nfs/dbraw/zinc/35/98/11/345359811.db2.gz GXEFZSAHEVLCLD-NXEZZACHSA-N 1 2 237.347 2.065 20 0 BEADLO CCCN(C)C(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC000635447937 345375007 /nfs/dbraw/zinc/37/50/07/345375007.db2.gz ABWVDCQWEMDFTA-GFCCVEGCSA-N 1 2 237.347 2.339 20 0 BEADLO CC(C)c1nc(C[N@H+](C)C(C)(C)C)no1 ZINC000562399511 345378476 /nfs/dbraw/zinc/37/84/76/345378476.db2.gz HZGSSYUHLDTKLQ-UHFFFAOYSA-N 1 2 211.309 2.423 20 0 BEADLO CC(C)c1nc(C[N@@H+](C)C(C)(C)C)no1 ZINC000562399511 345378478 /nfs/dbraw/zinc/37/84/78/345378478.db2.gz HZGSSYUHLDTKLQ-UHFFFAOYSA-N 1 2 211.309 2.423 20 0 BEADLO CC(C)C[C@@H](C(=O)N1CC[C@@H](C)C1)n1cc[nH+]c1 ZINC000635464807 345382706 /nfs/dbraw/zinc/38/27/06/345382706.db2.gz CPCFRZUDOLOJOY-OLZOCXBDSA-N 1 2 249.358 2.339 20 0 BEADLO Cc1nc2[nH]ccc2c(N(C)CC2CC2)[nH+]1 ZINC000080785356 345447275 /nfs/dbraw/zinc/44/72/75/345447275.db2.gz ANHLBZZBHIWLQI-UHFFFAOYSA-N 1 2 216.288 2.113 20 0 BEADLO CCC(C)(C)CC(=O)NCCNc1cccc[nH+]1 ZINC000080752825 345448930 /nfs/dbraw/zinc/44/89/30/345448930.db2.gz JMGARJPMCHJEDQ-UHFFFAOYSA-N 1 2 249.358 2.436 20 0 BEADLO Cc1nc2[nH]ccc2c(NCC2CCC2)[nH+]1 ZINC000080771326 345450475 /nfs/dbraw/zinc/45/04/75/345450475.db2.gz RPPLGEJQCAXZQQ-UHFFFAOYSA-N 1 2 216.288 2.478 20 0 BEADLO CC(C)CC(=O)N[C@@H](c1[nH+]ccn1C)C1CC1 ZINC000082277303 345500436 /nfs/dbraw/zinc/50/04/36/345500436.db2.gz ZEMXASGNMZTLER-GFCCVEGCSA-N 1 2 235.331 2.034 20 0 BEADLO CC[C@H](Nc1cc(CO)cc[nH+]1)C1CC1 ZINC000641660625 362587608 /nfs/dbraw/zinc/58/76/08/362587608.db2.gz HDBVIUCFOWEROQ-NSHDSACASA-N 1 2 206.289 2.174 20 0 BEADLO CCc1cc(C)nc(NC(C)(C)c2[nH]cc[nH+]2)n1 ZINC000641664062 362589244 /nfs/dbraw/zinc/58/92/44/362589244.db2.gz CQROXJPJAFWBRV-UHFFFAOYSA-N 1 2 245.330 2.418 20 0 BEADLO CC(=CC(=O)Nc1cc[nH+]cc1C)C(C)C ZINC000635533833 345478381 /nfs/dbraw/zinc/47/83/81/345478381.db2.gz ADAMBHUADVSEQX-UHFFFAOYSA-N 1 2 218.300 2.497 20 0 BEADLO C[C@H](C(=O)N(C)C1CCCCC1)n1cc[nH+]c1 ZINC000053898569 1172061352 /nfs/dbraw/zinc/06/13/52/1172061352.db2.gz KABXAUYHRHYGOP-LLVKDONJSA-N 1 2 235.331 2.235 20 0 BEADLO C[C@@H](O)C[C@H](C)CNc1cc[nH+]c2ccncc12 ZINC000085687899 345528592 /nfs/dbraw/zinc/52/85/92/345528592.db2.gz VXEGRXGYLCSOBS-WDEREUQCSA-N 1 2 245.326 2.449 20 0 BEADLO CN(c1cc[nH+]c2ccncc21)C1CCOCC1 ZINC000085689065 345528946 /nfs/dbraw/zinc/52/89/46/345528946.db2.gz HDUKSKPUCMQBCD-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO CC(C)[N@@H+](CC1=CCCOC1)CC(F)F ZINC000092045314 345615574 /nfs/dbraw/zinc/61/55/74/345615574.db2.gz PPCQONBTGWPAEO-UHFFFAOYSA-N 1 2 219.275 2.309 20 0 BEADLO CC(C)[N@H+](CC1=CCCOC1)CC(F)F ZINC000092045314 345615575 /nfs/dbraw/zinc/61/55/75/345615575.db2.gz PPCQONBTGWPAEO-UHFFFAOYSA-N 1 2 219.275 2.309 20 0 BEADLO CCC[C@@H](C[NH2+][C@@H](C)C(=O)OC(C)(C)C)OC ZINC000378829355 345639944 /nfs/dbraw/zinc/63/99/44/345639944.db2.gz QZSMCXIDLPMIAY-QWRGUYRKSA-N 1 2 245.363 2.121 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2ncn(C)n2)cc1C ZINC000090969778 178894150 /nfs/dbraw/zinc/89/41/50/178894150.db2.gz OZASUQAPSQKBHO-LBPRGKRZSA-N 1 2 244.342 2.283 20 0 BEADLO COCC[N@H+](CC(F)F)[C@@H]1CC[C@H](C)C1 ZINC000092965783 345649921 /nfs/dbraw/zinc/64/99/21/345649921.db2.gz SQDRKOYXHJLLAI-VHSXEESVSA-N 1 2 221.291 2.389 20 0 BEADLO COCC[N@@H+](CC(F)F)[C@@H]1CC[C@H](C)C1 ZINC000092965783 345649923 /nfs/dbraw/zinc/64/99/23/345649923.db2.gz SQDRKOYXHJLLAI-VHSXEESVSA-N 1 2 221.291 2.389 20 0 BEADLO Cc1cc(N2CC[C@@H](C)[C@H](O)C2)nc(C(C)C)[nH+]1 ZINC000092978002 345650647 /nfs/dbraw/zinc/65/06/47/345650647.db2.gz OXCNAXFSWMGPOB-ZYHUDNBSSA-N 1 2 249.358 2.116 20 0 BEADLO COc1ccc[nH+]c1NCc1cccn1C ZINC000381373513 345656368 /nfs/dbraw/zinc/65/63/68/345656368.db2.gz JCEYHDSIINDWPV-UHFFFAOYSA-N 1 2 217.272 2.041 20 0 BEADLO CCc1[nH+]c(C(C)C)ccc1Cn1cncn1 ZINC000418912073 192090238 /nfs/dbraw/zinc/09/02/38/192090238.db2.gz QVMPGUMLCKWGIN-UHFFFAOYSA-N 1 2 230.315 2.407 20 0 BEADLO Cc1ncc2c(n1)CC[N@@H+](Cc1cccs1)C2 ZINC000139440597 345692313 /nfs/dbraw/zinc/69/23/13/345692313.db2.gz NXTPWTFMJMMNQE-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ncc2c(n1)CC[N@H+](Cc1cccs1)C2 ZINC000139440597 345692314 /nfs/dbraw/zinc/69/23/14/345692314.db2.gz NXTPWTFMJMMNQE-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1nc(CCn2c(C)[nH+]c3ccccc32)no1 ZINC000222306809 345747645 /nfs/dbraw/zinc/74/76/45/345747645.db2.gz WHKBRZWGAVOPGX-UHFFFAOYSA-N 1 2 242.282 2.279 20 0 BEADLO CCOc1nnc(C[N@H+](C)C2CCCC2)s1 ZINC000150323736 345738370 /nfs/dbraw/zinc/73/83/70/345738370.db2.gz LXOVUHGVVXCXNZ-UHFFFAOYSA-N 1 2 241.360 2.311 20 0 BEADLO CCOc1nnc(C[N@@H+](C)C2CCCC2)s1 ZINC000150323736 345738371 /nfs/dbraw/zinc/73/83/71/345738371.db2.gz LXOVUHGVVXCXNZ-UHFFFAOYSA-N 1 2 241.360 2.311 20 0 BEADLO C[C@@H](NC(=O)C1C(C)(C)C1(C)C)c1[nH]cc[nH+]1 ZINC000140831130 345823075 /nfs/dbraw/zinc/82/30/75/345823075.db2.gz QLXGZQHHIMKXND-MRVPVSSYSA-N 1 2 235.331 2.269 20 0 BEADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1cc(C)no1 ZINC000631151367 345813360 /nfs/dbraw/zinc/81/33/60/345813360.db2.gz HRXVWDYWJGSXIL-SNVBAGLBSA-N 1 2 234.303 2.050 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NCc1cc(C)no1 ZINC000631151367 345813361 /nfs/dbraw/zinc/81/33/61/345813361.db2.gz HRXVWDYWJGSXIL-SNVBAGLBSA-N 1 2 234.303 2.050 20 0 BEADLO Cn1c2cc(F)ccc2[nH]c1=[NH+]C[C@@H]1CC12CC2 ZINC000418983249 192090912 /nfs/dbraw/zinc/09/09/12/192090912.db2.gz SXNYHIIXLMAJMC-VIFPVBQESA-N 1 2 245.301 2.346 20 0 BEADLO Cn1c2cccc(F)c2[nH]c1=[NH+]C[C@H]1CC12CC2 ZINC000418981961 192090965 /nfs/dbraw/zinc/09/09/65/192090965.db2.gz RAEVHZKWGUWNAN-SECBINFHSA-N 1 2 245.301 2.346 20 0 BEADLO C[C@@H]1CCCCCN1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635570367 345825861 /nfs/dbraw/zinc/82/58/61/345825861.db2.gz YESVFFZJIRTUIS-IJLUTSLNSA-N 1 2 247.342 2.304 20 0 BEADLO C[C@@H]1CCCCCN1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635570367 345825863 /nfs/dbraw/zinc/82/58/63/345825863.db2.gz YESVFFZJIRTUIS-IJLUTSLNSA-N 1 2 247.342 2.304 20 0 BEADLO CCc1cnc(CNc2c[nH]c[nH+]2)s1 ZINC000307581441 345834725 /nfs/dbraw/zinc/83/47/25/345834725.db2.gz REPJVNVKRCSIOH-UHFFFAOYSA-N 1 2 208.290 2.041 20 0 BEADLO c1cc(OCCC2CCOCC2)cc[nH+]1 ZINC000418956571 192092481 /nfs/dbraw/zinc/09/24/81/192092481.db2.gz SNBOWEJDHCFFEY-UHFFFAOYSA-N 1 2 207.273 2.277 20 0 BEADLO CC(C)SCCNc1cc(CO)cc[nH+]1 ZINC000603383063 349940756 /nfs/dbraw/zinc/94/07/56/349940756.db2.gz ZYGLQRAQSTYLLS-UHFFFAOYSA-N 1 2 226.345 2.127 20 0 BEADLO CCc1c[nH]c(CC(=O)N2C[C@@H](C)C[C@H]2CC)[nH+]1 ZINC000635636170 345911093 /nfs/dbraw/zinc/91/10/93/345911093.db2.gz XXZQPUANBYZOLJ-CMPLNLGQSA-N 1 2 249.358 2.162 20 0 BEADLO CCc1c[nH]c(CC(=O)N2C[C@H](C)CC[C@@H]2C)[nH+]1 ZINC000635633292 345911474 /nfs/dbraw/zinc/91/14/74/345911474.db2.gz YZTZDUZINKOWNX-MNOVXSKESA-N 1 2 249.358 2.162 20 0 BEADLO CCc1c[nH]c(CC(=O)N2C[C@@H](C)CC[C@@H]2C)[nH+]1 ZINC000635633294 345911715 /nfs/dbraw/zinc/91/17/15/345911715.db2.gz YZTZDUZINKOWNX-QWRGUYRKSA-N 1 2 249.358 2.162 20 0 BEADLO c1nc(NC2CC2)cc(NC[C@H]2CC23CC3)[nH+]1 ZINC000418973955 192093225 /nfs/dbraw/zinc/09/32/25/192093225.db2.gz FJVYCNSOHADGAC-SECBINFHSA-N 1 2 230.315 2.263 20 0 BEADLO c1nc(NC[C@H]2CC23CC3)cc(NC2CC2)[nH+]1 ZINC000418973955 192093227 /nfs/dbraw/zinc/09/32/27/192093227.db2.gz FJVYCNSOHADGAC-SECBINFHSA-N 1 2 230.315 2.263 20 0 BEADLO CNc1cc(N2C[C@H](C)C[C@H](C)C2)nc[nH+]1 ZINC000087805635 345940945 /nfs/dbraw/zinc/94/09/45/345940945.db2.gz VPJCYVVGOPRABG-AOOOYVTPSA-N 1 2 220.320 2.001 20 0 BEADLO CNc1cc(N2C[C@H](C)C[C@H](C)C2)[nH+]cn1 ZINC000087805635 345940948 /nfs/dbraw/zinc/94/09/48/345940948.db2.gz VPJCYVVGOPRABG-AOOOYVTPSA-N 1 2 220.320 2.001 20 0 BEADLO CNc1cc(NC2CCCCC2)[nH+]cn1 ZINC000087806601 345942003 /nfs/dbraw/zinc/94/20/03/345942003.db2.gz ZPCGQJNOHRTDFB-UHFFFAOYSA-N 1 2 206.293 2.263 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@]2(C)CCC[C@@H]2C)c[nH+]1 ZINC001639097827 1172070328 /nfs/dbraw/zinc/07/03/28/1172070328.db2.gz QNMMKAWHBPZTKY-HZMBPMFUSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@]2(C)CCC[C@@H]2C)[nH+]1 ZINC001639097827 1172070340 /nfs/dbraw/zinc/07/03/40/1172070340.db2.gz QNMMKAWHBPZTKY-HZMBPMFUSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1c[nH]c(CC(=O)N2[C@H](C)CC[C@@H]2CC)[nH+]1 ZINC000635764516 346057203 /nfs/dbraw/zinc/05/72/03/346057203.db2.gz NGEMMKLRTANHQQ-PWSUYJOCSA-N 1 2 249.358 2.304 20 0 BEADLO CO[C@H](C)c1nc(C[NH2+]CC2(F)CC2)cs1 ZINC000381489714 346039906 /nfs/dbraw/zinc/03/99/06/346039906.db2.gz WWDHKSFBJGAMGZ-MRVPVSSYSA-N 1 2 244.335 2.442 20 0 BEADLO Cc1cc(N2C[C@H](C)[C@@H](C)[C@H]2C)nc[nH+]1 ZINC000419019697 192094659 /nfs/dbraw/zinc/09/46/59/192094659.db2.gz QXGQGYLUXNMWGE-JMJZKYOTSA-N 1 2 205.305 2.266 20 0 BEADLO CC(C)=C(C)CC(=O)N1CCn2cc(C)[nH+]c2C1 ZINC000635785365 346068915 /nfs/dbraw/zinc/06/89/15/346068915.db2.gz DTOOSFNWPPAGKR-UHFFFAOYSA-N 1 2 247.342 2.280 20 0 BEADLO CC[C@H]([NH2+]Cc1cccn1C)C(F)F ZINC000449361874 201884564 /nfs/dbraw/zinc/88/45/64/201884564.db2.gz LQBCNQCKOXDFFG-VIFPVBQESA-N 1 2 202.248 2.158 20 0 BEADLO C[C@H](CCC1CC1)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635810465 346074296 /nfs/dbraw/zinc/07/42/96/346074296.db2.gz XFUNLUQMIIWRKA-YUSALJHKSA-N 1 2 247.342 2.208 20 0 BEADLO C[C@H](CCC1CC1)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635810465 346074299 /nfs/dbraw/zinc/07/42/99/346074299.db2.gz XFUNLUQMIIWRKA-YUSALJHKSA-N 1 2 247.342 2.208 20 0 BEADLO CCc1c[nH]c(CC(=O)N(CC)CCC2CC2)[nH+]1 ZINC000635813538 346075361 /nfs/dbraw/zinc/07/53/61/346075361.db2.gz BUMMCKGKLNNFOY-UHFFFAOYSA-N 1 2 249.358 2.163 20 0 BEADLO CC(C)c1nc(C[N@@H+](C)C[C@H](C)O)cs1 ZINC000051822101 346081386 /nfs/dbraw/zinc/08/13/86/346081386.db2.gz ZFLZNNGCTULYQZ-VIFPVBQESA-N 1 2 228.361 2.079 20 0 BEADLO CC(C)c1nc(C[N@H+](C)C[C@H](C)O)cs1 ZINC000051822101 346081391 /nfs/dbraw/zinc/08/13/91/346081391.db2.gz ZFLZNNGCTULYQZ-VIFPVBQESA-N 1 2 228.361 2.079 20 0 BEADLO CC1=C(C)CN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)CC1 ZINC000635886168 346101996 /nfs/dbraw/zinc/10/19/96/346101996.db2.gz OAQHTXOKBFLSIO-VXGBXAGGSA-N 1 2 245.326 2.082 20 0 BEADLO CC1=C(C)CN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)CC1 ZINC000635886168 346101999 /nfs/dbraw/zinc/10/19/99/346101999.db2.gz OAQHTXOKBFLSIO-VXGBXAGGSA-N 1 2 245.326 2.082 20 0 BEADLO CCc1c[nH]c(CC(=O)N(CC)CC2CCC2)[nH+]1 ZINC000635884327 346102049 /nfs/dbraw/zinc/10/20/49/346102049.db2.gz VVCXUNGLCUEOAJ-UHFFFAOYSA-N 1 2 249.358 2.163 20 0 BEADLO CCc1c[nH]c(CC(=O)NC[C@H]2CCC[C@@H]2C)[nH+]1 ZINC000635893204 346104020 /nfs/dbraw/zinc/10/40/20/346104020.db2.gz MNKFBACTUAPSOI-WDEREUQCSA-N 1 2 249.358 2.067 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CC[C@@H](OC)C1 ZINC000234985794 323105746 /nfs/dbraw/zinc/10/57/46/323105746.db2.gz JPNLMNVCKQPZPL-VHSXEESVSA-N 1 2 222.288 2.070 20 0 BEADLO Cc1ccc(NCc2[nH+]ccn2C)cc1F ZINC000034937800 346108487 /nfs/dbraw/zinc/10/84/87/346108487.db2.gz QZQFNTYBQPKYCV-UHFFFAOYSA-N 1 2 219.263 2.480 20 0 BEADLO CC(C)C[C@H](C(=O)N[C@@H]1CC[C@@H]1C)n1cc[nH+]c1 ZINC000635926475 346116762 /nfs/dbraw/zinc/11/67/62/346116762.db2.gz SYSDKVRHQGRKKK-YNEHKIRRSA-N 1 2 249.358 2.385 20 0 BEADLO CCC1(CC)CN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635963179 346135186 /nfs/dbraw/zinc/13/51/86/346135186.db2.gz PXFBHHJARIXMIK-GHMZBOCLSA-N 1 2 247.342 2.162 20 0 BEADLO CCC1(CC)CN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635963179 346135188 /nfs/dbraw/zinc/13/51/88/346135188.db2.gz PXFBHHJARIXMIK-GHMZBOCLSA-N 1 2 247.342 2.162 20 0 BEADLO CCCC[C@@H](CC)c1nc(C[NH2+]C)no1 ZINC000051848755 346151892 /nfs/dbraw/zinc/15/18/92/346151892.db2.gz AAHXGKACETZWBG-SECBINFHSA-N 1 2 211.309 2.473 20 0 BEADLO C[C@]1(NC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)CC=CCC1 ZINC000636021197 346159140 /nfs/dbraw/zinc/15/91/40/346159140.db2.gz KVTJOAZDZAHZLL-GYSYKLTISA-N 1 2 245.326 2.128 20 0 BEADLO C[C@]1(NC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)CC=CCC1 ZINC000636021197 346159144 /nfs/dbraw/zinc/15/91/44/346159144.db2.gz KVTJOAZDZAHZLL-GYSYKLTISA-N 1 2 245.326 2.128 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CC(C)(C)C[C@@H]2C)[nH+]1 ZINC000636025374 346162561 /nfs/dbraw/zinc/16/25/61/346162561.db2.gz BPELCGWXTUXDMY-JTQLQIEISA-N 1 2 249.358 2.162 20 0 BEADLO C[C@H]1CCN(CC(F)F)C[C@H]1n1cc[nH+]c1 ZINC000245705734 537954368 /nfs/dbraw/zinc/95/43/68/537954368.db2.gz SAPZTIYBBCIJIH-VHSXEESVSA-N 1 2 229.274 2.031 20 0 BEADLO Cc1ncc(C[NH2+]Cc2nccn2CC(C)C)o1 ZINC000628233633 346192428 /nfs/dbraw/zinc/19/24/28/346192428.db2.gz NCPDEBOIAPQVPC-UHFFFAOYSA-N 1 2 248.330 2.125 20 0 BEADLO Cc1ncc(CNCc2[nH+]ccn2CC(C)C)o1 ZINC000628233633 346192432 /nfs/dbraw/zinc/19/24/32/346192432.db2.gz NCPDEBOIAPQVPC-UHFFFAOYSA-N 1 2 248.330 2.125 20 0 BEADLO Cc1[nH]c(CN(C)CCc2ccccn2)[nH+]c1C ZINC000628237205 346193345 /nfs/dbraw/zinc/19/33/45/346193345.db2.gz FQYLEOCHNVHZSU-UHFFFAOYSA-N 1 2 244.342 2.096 20 0 BEADLO CN(C[C@@H](O)C1CC1)c1cc2ccccc2c[nH+]1 ZINC000631153558 346233057 /nfs/dbraw/zinc/23/30/57/346233057.db2.gz AHKMBZVWYRAPSD-CQSZACIVSA-N 1 2 242.322 2.442 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2cnccc2C)o1 ZINC000628256223 346253447 /nfs/dbraw/zinc/25/34/47/346253447.db2.gz OELKPSKNHYFDFG-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2cnccc2C)o1 ZINC000628256223 346253451 /nfs/dbraw/zinc/25/34/51/346253451.db2.gz OELKPSKNHYFDFG-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CCN(Cc1[nH]c(C)c(C)[nH+]1)Cc1ccncc1 ZINC000628277344 346286100 /nfs/dbraw/zinc/28/61/00/346286100.db2.gz OEUJMZQKKRPUFQ-UHFFFAOYSA-N 1 2 244.342 2.444 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC[C@@H]2c2ccncc2)n1 ZINC000628277547 346286142 /nfs/dbraw/zinc/28/61/42/346286142.db2.gz XHBGWLYSERORFY-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC[C@@H]2c2ccncc2)n1 ZINC000628277547 346286143 /nfs/dbraw/zinc/28/61/43/346286143.db2.gz XHBGWLYSERORFY-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO C/C=C/C[C@H]1CCC[N@H+](CCc2cnn[nH]2)C1 ZINC000626164607 346271210 /nfs/dbraw/zinc/27/12/10/346271210.db2.gz LTIWNTKHJUZUSF-JDGPPOGSSA-N 1 2 234.347 2.025 20 0 BEADLO C/C=C/C[C@H]1CCC[N@@H+](CCc2cnn[nH]2)C1 ZINC000626164607 346271212 /nfs/dbraw/zinc/27/12/12/346271212.db2.gz LTIWNTKHJUZUSF-JDGPPOGSSA-N 1 2 234.347 2.025 20 0 BEADLO Cc1cc(C)c(C(=O)N(C)Cc2[nH]cc[nH+]2)s1 ZINC000631156585 346280849 /nfs/dbraw/zinc/28/08/49/346280849.db2.gz OMAVGAJYUWHWEP-UHFFFAOYSA-N 1 2 249.339 2.360 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)n1 ZINC000628285089 346296844 /nfs/dbraw/zinc/29/68/44/346296844.db2.gz HVWQFIGLJBDFMN-QMMMGPOBSA-N 1 2 229.274 2.195 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC(F)(F)[C@@H](C)C2)n1 ZINC000628285089 346296847 /nfs/dbraw/zinc/29/68/47/346296847.db2.gz HVWQFIGLJBDFMN-QMMMGPOBSA-N 1 2 229.274 2.195 20 0 BEADLO Cc1cccc(C)c1C[NH2+][C@@H](C)c1ncn(C)n1 ZINC000275517450 179037845 /nfs/dbraw/zinc/03/78/45/179037845.db2.gz IVCJHHYBXKWWAW-LBPRGKRZSA-N 1 2 244.342 2.283 20 0 BEADLO C=C/C=C/CC(=O)NCc1c[nH+]c(C)cc1C ZINC001639155609 1172080662 /nfs/dbraw/zinc/08/06/62/1172080662.db2.gz YUPGXBYRGFRWRC-AATRIKPKSA-N 1 2 230.311 2.447 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@](C)(CC)C2CC2)[nH+]1 ZINC000636205442 346354071 /nfs/dbraw/zinc/35/40/71/346354071.db2.gz YWSDJORLMVHJQI-CQSZACIVSA-N 1 2 249.358 2.210 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@@H](C(C)C)C2CC2)[nH+]1 ZINC000636227114 346360171 /nfs/dbraw/zinc/36/01/71/346360171.db2.gz OITRDAQVLGUHMX-AWEZNQCLSA-N 1 2 249.358 2.065 20 0 BEADLO CCc1c[nH]c(CC(=O)NC2(CC(C)C)CC2)[nH+]1 ZINC000636241711 346366221 /nfs/dbraw/zinc/36/62/21/346366221.db2.gz KZKCLQZYHUJAAG-UHFFFAOYSA-N 1 2 249.358 2.210 20 0 BEADLO C[C@@H](CC(=O)OC(C)(C)C)[NH2+][C@@H](C)C(F)F ZINC000603431478 349953231 /nfs/dbraw/zinc/95/32/31/349953231.db2.gz YCBPBMCELHSUBK-YUMQZZPRSA-N 1 2 237.290 2.350 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[NH2+]CC[C@H](C)F ZINC000419172367 192101727 /nfs/dbraw/zinc/10/17/27/192101727.db2.gz JWUXZZGTXAAVKH-WDEREUQCSA-N 1 2 233.327 2.302 20 0 BEADLO Cc1noc(C[N@@H+](C)Cc2cccc(C)c2)n1 ZINC000298731278 179068339 /nfs/dbraw/zinc/06/83/39/179068339.db2.gz SMCUHDPJEKFVKT-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1noc(C[N@H+](C)Cc2cccc(C)c2)n1 ZINC000298731278 179068340 /nfs/dbraw/zinc/06/83/40/179068340.db2.gz SMCUHDPJEKFVKT-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2ccn(C)n2)c1 ZINC000271046884 179068406 /nfs/dbraw/zinc/06/84/06/179068406.db2.gz MFJHLEWDAIBMIC-UHFFFAOYSA-N 1 2 229.327 2.361 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2ccn(C)n2)c1 ZINC000271046884 179068408 /nfs/dbraw/zinc/06/84/08/179068408.db2.gz MFJHLEWDAIBMIC-UHFFFAOYSA-N 1 2 229.327 2.361 20 0 BEADLO C[C@H]1CC[N@H+](CCOCC(F)(F)F)C[C@H]1F ZINC000679217489 488317298 /nfs/dbraw/zinc/31/72/98/488317298.db2.gz GBIOBCNKBHBZAX-DTWKUNHWSA-N 1 2 243.244 2.245 20 0 BEADLO C[C@H]1CC[N@@H+](CCOCC(F)(F)F)C[C@H]1F ZINC000679217489 488317299 /nfs/dbraw/zinc/31/72/99/488317299.db2.gz GBIOBCNKBHBZAX-DTWKUNHWSA-N 1 2 243.244 2.245 20 0 BEADLO Cc1n[nH]cc1C[N@@H+](C)Cc1cccc(C)n1 ZINC000353747132 179067094 /nfs/dbraw/zinc/06/70/94/179067094.db2.gz ODBYORBRKQNACE-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1n[nH]cc1C[N@H+](C)Cc1cccc(C)n1 ZINC000353747132 179067096 /nfs/dbraw/zinc/06/70/96/179067096.db2.gz ODBYORBRKQNACE-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Oc1ccc2c(c1)CC[N@@H+](CC(F)F)CC2 ZINC000603411628 349960473 /nfs/dbraw/zinc/96/04/73/349960473.db2.gz WFGDPDDLXHXYFM-UHFFFAOYSA-N 1 2 227.254 2.058 20 0 BEADLO Oc1ccc2c(c1)CC[N@H+](CC(F)F)CC2 ZINC000603411628 349960475 /nfs/dbraw/zinc/96/04/75/349960475.db2.gz WFGDPDDLXHXYFM-UHFFFAOYSA-N 1 2 227.254 2.058 20 0 BEADLO Cc1cccc(C[N@@H+]2CCO[C@H](C)C2)c1F ZINC000294595902 179079005 /nfs/dbraw/zinc/07/90/05/179079005.db2.gz SSWKSOBRLHXELI-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cccc(C[N@H+]2CCO[C@H](C)C2)c1F ZINC000294595902 179079009 /nfs/dbraw/zinc/07/90/09/179079009.db2.gz SSWKSOBRLHXELI-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ncncc1[C@@H](C)[NH2+][C@@H](C)C(F)F ZINC000641792575 362728017 /nfs/dbraw/zinc/72/80/17/362728017.db2.gz XJZWVEVPIWSEJQ-SFYZADRCSA-N 1 2 215.247 2.089 20 0 BEADLO Cc1n[nH]cc1[C@@H](C)[NH2+][C@H](C)C(F)F ZINC000641792288 362728253 /nfs/dbraw/zinc/72/82/53/362728253.db2.gz TXVIIAJJXUVONV-IYSWYEEDSA-N 1 2 203.236 2.022 20 0 BEADLO CC(C)n1cc[nH+]c1CN[C@@H](C)C(F)F ZINC000641795334 362737218 /nfs/dbraw/zinc/73/72/18/362737218.db2.gz XLTPLHBJFLLXBZ-QMMMGPOBSA-N 1 2 217.263 2.207 20 0 BEADLO COc1cncc(C[NH2+][C@@H](C)C(F)F)c1C ZINC000641794113 362734660 /nfs/dbraw/zinc/73/46/60/362734660.db2.gz KONLRLHHNVITBO-QMMMGPOBSA-N 1 2 230.258 2.142 20 0 BEADLO Cc1cccc2[nH+]cc(CN[C@@H](C)C(F)F)n21 ZINC000641793622 362735939 /nfs/dbraw/zinc/73/59/39/362735939.db2.gz MBTFGIXMPBHQPV-VIFPVBQESA-N 1 2 239.269 2.386 20 0 BEADLO CO[C@@H](CC(C)C)C[N@H+](C)CC(F)F ZINC000419204825 192103690 /nfs/dbraw/zinc/10/36/90/192103690.db2.gz JHICVNKQUZEBKS-VIFPVBQESA-N 1 2 209.280 2.244 20 0 BEADLO CO[C@@H](CC(C)C)C[N@@H+](C)CC(F)F ZINC000419204825 192103691 /nfs/dbraw/zinc/10/36/91/192103691.db2.gz JHICVNKQUZEBKS-VIFPVBQESA-N 1 2 209.280 2.244 20 0 BEADLO Cc1cccc(F)c1NC(=O)[C@H]1CCC[N@H+]1C ZINC000296295518 179110678 /nfs/dbraw/zinc/11/06/78/179110678.db2.gz MFVLOMBPYWNFDA-LLVKDONJSA-N 1 2 236.290 2.167 20 0 BEADLO Cc1cccc(F)c1NC(=O)[C@H]1CCC[N@@H+]1C ZINC000296295518 179110680 /nfs/dbraw/zinc/11/06/80/179110680.db2.gz MFVLOMBPYWNFDA-LLVKDONJSA-N 1 2 236.290 2.167 20 0 BEADLO Cc1cccc(N(C)CCN(C)CC(F)F)[nH+]1 ZINC000337943631 179116239 /nfs/dbraw/zinc/11/62/39/179116239.db2.gz NEFQVFQHCAWSEI-UHFFFAOYSA-N 1 2 243.301 2.023 20 0 BEADLO Cc1cc(NC(=O)[C@H](C)C2CCC2)c(C)c[nH+]1 ZINC000580163504 346586360 /nfs/dbraw/zinc/58/63/60/346586360.db2.gz XLJJEQWRSGDUAT-LLVKDONJSA-N 1 2 232.327 2.495 20 0 BEADLO CSC1CCN(c2cc[nH+]c(C)n2)CC1 ZINC000601207385 346673585 /nfs/dbraw/zinc/67/35/85/346673585.db2.gz JJAQCVFZOIHXQE-UHFFFAOYSA-N 1 2 223.345 2.117 20 0 BEADLO CC[C@@H](C)[C@@H]([NH2+]Cc1ccsc1)C(=O)OC ZINC000037102726 346675259 /nfs/dbraw/zinc/67/52/59/346675259.db2.gz ILVDZUSDPCWOLX-MWLCHTKSSA-N 1 2 241.356 2.425 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CCC(C)(C)CC1 ZINC000580213991 346693737 /nfs/dbraw/zinc/69/37/37/346693737.db2.gz ZYJPEZPZVIRNEJ-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CCC(C)(C)CC1 ZINC000580213991 346693742 /nfs/dbraw/zinc/69/37/42/346693742.db2.gz ZYJPEZPZVIRNEJ-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccc(C)cc1)C(=O)OC ZINC000168234734 346730757 /nfs/dbraw/zinc/73/07/57/346730757.db2.gz VJRIMLFIWXXRAD-GFCCVEGCSA-N 1 2 221.300 2.036 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](C)c2nccnc2C)s1 ZINC000188080879 346740989 /nfs/dbraw/zinc/74/09/89/346740989.db2.gz VQYMTLFSKMFHSM-JTQLQIEISA-N 1 2 248.355 2.401 20 0 BEADLO Cc1cc(C[NH2+]CC(F)(F)CO)ccc1Cl ZINC000183876579 347196832 /nfs/dbraw/zinc/19/68/32/347196832.db2.gz LNICJKYCSQCCPN-UHFFFAOYSA-N 1 2 249.688 2.366 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C(=O)c1ccccc1 ZINC000194277794 347209751 /nfs/dbraw/zinc/20/97/51/347209751.db2.gz CZRWRQJAWGZEDO-UHFFFAOYSA-N 1 2 240.262 2.211 20 0 BEADLO Cc1cccc([C@H](C)C(=O)NCc2[nH]cc[nH+]2)c1 ZINC000122156906 179193883 /nfs/dbraw/zinc/19/38/83/179193883.db2.gz URFSZOJIPJDNRS-NSHDSACASA-N 1 2 243.310 2.138 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2ccncn2)o1 ZINC000395803337 362799516 /nfs/dbraw/zinc/79/95/16/362799516.db2.gz AYMZIXSGUPALPE-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO Cc1ncc(C[N@@H+]2C[C@@]3(CCCO3)[C@H]2C2CC2)o1 ZINC000628297119 347244670 /nfs/dbraw/zinc/24/46/70/347244670.db2.gz KMXQKJQYNOLDCR-KGLIPLIRSA-N 1 2 248.326 2.126 20 0 BEADLO Cc1ncc(C[N@H+]2C[C@@]3(CCCO3)[C@H]2C2CC2)o1 ZINC000628297119 347244674 /nfs/dbraw/zinc/24/46/74/347244674.db2.gz KMXQKJQYNOLDCR-KGLIPLIRSA-N 1 2 248.326 2.126 20 0 BEADLO CCCC[C@@H](C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000300907390 347280465 /nfs/dbraw/zinc/28/04/65/347280465.db2.gz JPTDJBUIPVXWLT-SNVBAGLBSA-N 1 2 223.320 2.194 20 0 BEADLO Cc1ccc(C(=O)N(C)Cc2c[nH+]c[nH]2)s1 ZINC000616922277 347452551 /nfs/dbraw/zinc/45/25/51/347452551.db2.gz WMOLPHAWSLQBQE-UHFFFAOYSA-N 1 2 235.312 2.052 20 0 BEADLO Cc1ccc(C(=O)N(C)Cc2c[nH]c[nH+]2)s1 ZINC000616922277 347452552 /nfs/dbraw/zinc/45/25/52/347452552.db2.gz WMOLPHAWSLQBQE-UHFFFAOYSA-N 1 2 235.312 2.052 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)C1(C2CCC2)CCC1 ZINC000616922029 347452581 /nfs/dbraw/zinc/45/25/81/347452581.db2.gz MYSTVKTZYUAAFG-UHFFFAOYSA-N 1 2 247.342 2.339 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)C1(C2CCC2)CCC1 ZINC000616922029 347452584 /nfs/dbraw/zinc/45/25/84/347452584.db2.gz MYSTVKTZYUAAFG-UHFFFAOYSA-N 1 2 247.342 2.339 20 0 BEADLO Cc1cc(C(=O)N(C)Cc2c[nH+]c[nH]2)sc1C ZINC000616923908 347455105 /nfs/dbraw/zinc/45/51/05/347455105.db2.gz ZOSOORLCKZWOJN-UHFFFAOYSA-N 1 2 249.339 2.360 20 0 BEADLO Cc1cc(C(=O)N(C)Cc2c[nH]c[nH+]2)sc1C ZINC000616923908 347455106 /nfs/dbraw/zinc/45/51/06/347455106.db2.gz ZOSOORLCKZWOJN-UHFFFAOYSA-N 1 2 249.339 2.360 20 0 BEADLO CC(C)c1occc1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616928471 347494599 /nfs/dbraw/zinc/49/45/99/347494599.db2.gz APMPFPIPSXXQEA-UHFFFAOYSA-N 1 2 247.298 2.398 20 0 BEADLO CC(C)c1occc1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616928471 347494601 /nfs/dbraw/zinc/49/46/01/347494601.db2.gz APMPFPIPSXXQEA-UHFFFAOYSA-N 1 2 247.298 2.398 20 0 BEADLO C[C@H]1CCC[C@@]1(C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616928693 347494716 /nfs/dbraw/zinc/49/47/16/347494716.db2.gz JEQXZEAIIFMCNJ-GXFFZTMASA-N 1 2 235.331 2.194 20 0 BEADLO C[C@H]1CCC[C@@]1(C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616928693 347494718 /nfs/dbraw/zinc/49/47/18/347494718.db2.gz JEQXZEAIIFMCNJ-GXFFZTMASA-N 1 2 235.331 2.194 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616929025 347496016 /nfs/dbraw/zinc/49/60/16/347496016.db2.gz RGCZGFMGAZNRAM-PWSUYJOCSA-N 1 2 235.331 2.194 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616929025 347496017 /nfs/dbraw/zinc/49/60/17/347496017.db2.gz RGCZGFMGAZNRAM-PWSUYJOCSA-N 1 2 235.331 2.194 20 0 BEADLO CC[C@@H](C)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000590729000 347497481 /nfs/dbraw/zinc/49/74/81/347497481.db2.gz NXORRQRGTLMKQN-VXGBXAGGSA-N 1 2 235.331 2.093 20 0 BEADLO Cc1cccc(C)c1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616927030 347459271 /nfs/dbraw/zinc/45/92/71/347459271.db2.gz YTNBGTADBUIBRB-UHFFFAOYSA-N 1 2 243.310 2.299 20 0 BEADLO Cc1cccc(C)c1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616927030 347459275 /nfs/dbraw/zinc/45/92/75/347459275.db2.gz YTNBGTADBUIBRB-UHFFFAOYSA-N 1 2 243.310 2.299 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)CCCC(F)(F)F ZINC000616926785 347459896 /nfs/dbraw/zinc/45/98/96/347459896.db2.gz PYFNDWSYDPYZJN-UHFFFAOYSA-N 1 2 249.236 2.101 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)CCCC(F)(F)F ZINC000616926785 347459898 /nfs/dbraw/zinc/45/98/98/347459898.db2.gz PYFNDWSYDPYZJN-UHFFFAOYSA-N 1 2 249.236 2.101 20 0 BEADLO Cc1nnc(C[NH2+][C@H](C)c2cncs2)s1 ZINC000380105939 365882731 /nfs/dbraw/zinc/88/27/31/365882731.db2.gz NDBWHGMIAGSXGN-ZCFIWIBFSA-N 1 2 240.357 2.154 20 0 BEADLO C[C@H](N[C@H]1CCn2cc[nH+]c21)c1cscn1 ZINC000577231197 365893879 /nfs/dbraw/zinc/89/38/79/365893879.db2.gz FSYPGHWYEWZVQG-IUCAKERBSA-N 1 2 234.328 2.135 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1CC[C@@H](C)O1 ZINC000333354754 537991048 /nfs/dbraw/zinc/99/10/48/537991048.db2.gz GCOOTOHCRGLEKE-MWLCHTKSSA-N 1 2 234.299 2.204 20 0 BEADLO CC[C@H](C)N(CC)C(=O)[C@H]1CCn2cc[nH+]c2C1 ZINC000616974549 347546234 /nfs/dbraw/zinc/54/62/34/347546234.db2.gz NQFMOHGWBIICBS-RYUDHWBXSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)[C@H]1CCn2c[nH+]cc2C1 ZINC000616978945 347561808 /nfs/dbraw/zinc/56/18/08/347561808.db2.gz JUSYHCVBAORMGB-NEPJUHHUSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@H](C)N(CC)C(=O)[C@@H]1CCn2c[nH+]cc2C1 ZINC000616978946 347561840 /nfs/dbraw/zinc/56/18/40/347561840.db2.gz JUSYHCVBAORMGB-NWDGAFQWSA-N 1 2 249.358 2.093 20 0 BEADLO CC(C)[C@@H]1CCCN1C(=O)CCCn1cc[nH+]c1 ZINC000591158138 347626778 /nfs/dbraw/zinc/62/67/78/347626778.db2.gz BTPYFBBHLKWGQW-ZDUSSCGKSA-N 1 2 249.358 2.310 20 0 BEADLO Cc1cc(NC(=O)C[C@@H](C)n2cccc2)cc[nH+]1 ZINC000591421729 347657898 /nfs/dbraw/zinc/65/78/98/347657898.db2.gz NDELIACUGSWDMG-GFCCVEGCSA-N 1 2 243.310 2.203 20 0 BEADLO FC(F)(F)CN1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000591866878 347707747 /nfs/dbraw/zinc/70/77/47/347707747.db2.gz IHKCGJWJIQNOJA-SECBINFHSA-N 1 2 233.237 2.082 20 0 BEADLO O=C(N[C@@H]1C=CCCC1)c1ccc2[nH+]ccn2c1 ZINC000176825346 365907980 /nfs/dbraw/zinc/90/79/80/365907980.db2.gz SKDKVRMDQZSOQF-GFCCVEGCSA-N 1 2 241.294 2.173 20 0 BEADLO CC[N@H+](CCSC)Cc1ncnn1C(C)C ZINC000592202490 347754984 /nfs/dbraw/zinc/75/49/84/347754984.db2.gz NXEAELHXNHFUOS-UHFFFAOYSA-N 1 2 242.392 2.044 20 0 BEADLO CC[N@@H+](CCSC)Cc1ncnn1C(C)C ZINC000592202490 347754987 /nfs/dbraw/zinc/75/49/87/347754987.db2.gz NXEAELHXNHFUOS-UHFFFAOYSA-N 1 2 242.392 2.044 20 0 BEADLO Cc1ccccc1C[S@](=O)Cc1c[nH+]cn1C ZINC000268153105 179293783 /nfs/dbraw/zinc/29/37/83/179293783.db2.gz LFYGCFXLGRSRSZ-KRWDZBQOSA-N 1 2 248.351 2.177 20 0 BEADLO Cc1cc(N2CC=CC2)nc(C2CC2)[nH+]1 ZINC000577284085 365917528 /nfs/dbraw/zinc/91/75/28/365917528.db2.gz BHBQZLPIEHCVHP-UHFFFAOYSA-N 1 2 201.273 2.039 20 0 BEADLO c1nc(NCc2ccc(N3CCCC3)[nH+]c2)c[nH]1 ZINC000577336180 365926718 /nfs/dbraw/zinc/92/67/18/365926718.db2.gz XKSYRJFHYAKXHP-UHFFFAOYSA-N 1 2 243.314 2.017 20 0 BEADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1cnc(C)o1 ZINC000628300088 347847220 /nfs/dbraw/zinc/84/72/20/347847220.db2.gz OBLXLPYNZBNBLO-SECBINFHSA-N 1 2 234.303 2.050 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@@H](OC(F)F)C2)o1 ZINC000679676995 488363862 /nfs/dbraw/zinc/36/38/62/488363862.db2.gz SRYCCQLFROUNMK-SECBINFHSA-N 1 2 246.257 2.187 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@@H](OC(F)F)C2)o1 ZINC000679676995 488363863 /nfs/dbraw/zinc/36/38/63/488363863.db2.gz SRYCCQLFROUNMK-SECBINFHSA-N 1 2 246.257 2.187 20 0 BEADLO CCCCc1noc(C[N@@H+]2CC=CCC2)n1 ZINC000679322459 490113268 /nfs/dbraw/zinc/11/32/68/490113268.db2.gz KCAKYKQVKSPZRH-UHFFFAOYSA-N 1 2 221.304 2.174 20 0 BEADLO Cc1ccccc1[C@@H](C)[N@H+](C)Cc1cn(C)nn1 ZINC000341628153 179318848 /nfs/dbraw/zinc/31/88/48/179318848.db2.gz XLBJXAJQJBFFNC-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1ccccc1[C@@H](C)[N@@H+](C)Cc1cn(C)nn1 ZINC000341628153 179318850 /nfs/dbraw/zinc/31/88/50/179318850.db2.gz XLBJXAJQJBFFNC-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1ccccc1[C@@H]([NH2+][C@@H]1CCOC1=O)C1CC1 ZINC000271976052 179326526 /nfs/dbraw/zinc/32/65/26/179326526.db2.gz DBBBMNYVYKANEO-KGLIPLIRSA-N 1 2 245.322 2.351 20 0 BEADLO Cc1cccn2cc(CNc3cnccn3)[nH+]c12 ZINC000301991421 179355960 /nfs/dbraw/zinc/35/59/60/179355960.db2.gz NKOTUIAPRKJNFN-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO CCC[C@@H]([NH2+]C[C@@]1(C)CC1(F)F)C(=O)OCC ZINC000594733252 348109168 /nfs/dbraw/zinc/10/91/68/348109168.db2.gz ZZONNCMNCWMODG-MWLCHTKSSA-N 1 2 249.301 2.353 20 0 BEADLO Cc1ccccc1[S@](=O)Cc1[nH+]ccn1C ZINC000129285361 179351676 /nfs/dbraw/zinc/35/16/76/179351676.db2.gz AYVXQPDBIAKGIA-INIZCTEOSA-N 1 2 234.324 2.036 20 0 BEADLO CC(C)OC(=O)[C@H](C)[NH2+][C@@H]1CC[C@H](C)SC1 ZINC000594609966 348082218 /nfs/dbraw/zinc/08/22/18/348082218.db2.gz PFUVDEOONJDVJJ-GARJFASQSA-N 1 2 245.388 2.200 20 0 BEADLO CC(C)OC(=O)[C@H](C)[NH2+][C@H]1CC[C@@H](C)SC1 ZINC000594609968 348082482 /nfs/dbraw/zinc/08/24/82/348082482.db2.gz PFUVDEOONJDVJJ-VWYCJHECSA-N 1 2 245.388 2.200 20 0 BEADLO Cc1c[nH]cc1C(=O)Nc1c[nH+]c2n1CCCC2 ZINC000334653671 133725941 /nfs/dbraw/zinc/72/59/41/133725941.db2.gz WKWDKTQVSKZWGB-UHFFFAOYSA-N 1 2 244.298 2.108 20 0 BEADLO Cc1ccc[nH+]c1CCNc1nccnc1C ZINC000295680007 179370054 /nfs/dbraw/zinc/37/00/54/179370054.db2.gz GZSMIFRWZZPURC-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO COC(=O)[C@H](C)[NH+]1CCC(c2ccco2)CC1 ZINC000595618365 348290516 /nfs/dbraw/zinc/29/05/16/348290516.db2.gz OGKKJCKUGOFAQP-JTQLQIEISA-N 1 2 237.299 2.021 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2[nH]ncc2C)[C@H](CC)CO1 ZINC000651913302 490154982 /nfs/dbraw/zinc/15/49/82/490154982.db2.gz RYILNOSMWUTUEO-VXGBXAGGSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2[nH]ncc2C)[C@H](CC)CO1 ZINC000651913302 490154985 /nfs/dbraw/zinc/15/49/85/490154985.db2.gz RYILNOSMWUTUEO-VXGBXAGGSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2n[nH]cc2C)[C@H](CC)CO1 ZINC000651913302 490154992 /nfs/dbraw/zinc/15/49/92/490154992.db2.gz RYILNOSMWUTUEO-VXGBXAGGSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2n[nH]cc2C)[C@H](CC)CO1 ZINC000651913302 490154996 /nfs/dbraw/zinc/15/49/96/490154996.db2.gz RYILNOSMWUTUEO-VXGBXAGGSA-N 1 2 237.347 2.108 20 0 BEADLO COC(=O)[C@@](C)(CCF)[NH2+]CCC=C(C)C ZINC000595775002 348337827 /nfs/dbraw/zinc/33/78/27/348337827.db2.gz YQIONWKEDNJUCL-GFCCVEGCSA-N 1 2 231.311 2.224 20 0 BEADLO COC(=O)[C@](C)(CCF)[NH2+]CCC=C(C)C ZINC000595775003 348338125 /nfs/dbraw/zinc/33/81/25/348338125.db2.gz YQIONWKEDNJUCL-LBPRGKRZSA-N 1 2 231.311 2.224 20 0 BEADLO Cc1nnc(C[N@@H+](C)CCSC(C)C)s1 ZINC000595885898 348389329 /nfs/dbraw/zinc/38/93/29/348389329.db2.gz QAUCBVLBBKDAAA-UHFFFAOYSA-N 1 2 245.417 2.420 20 0 BEADLO Cc1nnc(C[N@H+](C)CCSC(C)C)s1 ZINC000595885898 348389330 /nfs/dbraw/zinc/38/93/30/348389330.db2.gz QAUCBVLBBKDAAA-UHFFFAOYSA-N 1 2 245.417 2.420 20 0 BEADLO CC[C@@H](C)Nc1cc(CC(=O)OC)cc[nH+]1 ZINC000596047798 348429437 /nfs/dbraw/zinc/42/94/37/348429437.db2.gz AOIUEKGSCIFQLC-SECBINFHSA-N 1 2 222.288 2.008 20 0 BEADLO CCCC[C@@H]([NH2+]CC1=CCCC1)C(=O)OC ZINC000596048922 348429460 /nfs/dbraw/zinc/42/94/60/348429460.db2.gz WWEJTMOYNMPPAX-GFCCVEGCSA-N 1 2 225.332 2.418 20 0 BEADLO CCC[C@@H]([NH2+]CC1=CCCC1)C(=O)OCC ZINC000596048338 348429534 /nfs/dbraw/zinc/42/95/34/348429534.db2.gz USIDSEAIYDBGTA-GFCCVEGCSA-N 1 2 225.332 2.418 20 0 BEADLO CCC=C(F)C(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001639427426 1172105463 /nfs/dbraw/zinc/10/54/63/1172105463.db2.gz IKCBNGFUVAXUCF-YHYXMXQVSA-N 1 2 239.294 2.413 20 0 BEADLO CC/C=C(\F)C(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001639427426 1172105468 /nfs/dbraw/zinc/10/54/68/1172105468.db2.gz IKCBNGFUVAXUCF-YHYXMXQVSA-N 1 2 239.294 2.413 20 0 BEADLO CCC[C@H](C)Nc1cc(CC(=O)OC)cc[nH+]1 ZINC000596070712 348437169 /nfs/dbraw/zinc/43/71/69/348437169.db2.gz SEXMCCAZFDNKFE-JTQLQIEISA-N 1 2 236.315 2.398 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N2[C@@H](C)CC[C@@H]2C)c1 ZINC000596162486 348459942 /nfs/dbraw/zinc/45/99/42/348459942.db2.gz LAWFJGQLTZRZBS-QWRGUYRKSA-N 1 2 248.326 2.174 20 0 BEADLO CC[C@@H]1C[C@H]1CNc1cc(CC(=O)OC)cc[nH+]1 ZINC000596255600 348476249 /nfs/dbraw/zinc/47/62/49/348476249.db2.gz UNQYLYUVBPWDNN-NEPJUHHUSA-N 1 2 248.326 2.255 20 0 BEADLO C[S@](=O)[C@@H]1CCC[C@H](Nc2cccc[nH+]2)C1 ZINC000596373145 348514387 /nfs/dbraw/zinc/51/43/87/348514387.db2.gz GUZDSWCDDZCWOO-USBNGQNGSA-N 1 2 238.356 2.183 20 0 BEADLO Cn1cccc1C[NH2+][C@@H]1CCCC1(F)F ZINC000389906555 538009105 /nfs/dbraw/zinc/00/91/05/538009105.db2.gz HFYFSARXSYRGQV-SNVBAGLBSA-N 1 2 214.259 2.303 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+][C@@H](CO)c2ccccc2)o1 ZINC000359614122 179648817 /nfs/dbraw/zinc/64/88/17/179648817.db2.gz YAPUFSWYYGJWIG-YPMHNXCESA-N 1 2 246.310 2.367 20 0 BEADLO Cc1c[nH+]c(CNc2cccc(F)c2)n1C ZINC000309714273 179612730 /nfs/dbraw/zinc/61/27/30/179612730.db2.gz SBCDLZQHSOIXEK-UHFFFAOYSA-N 1 2 219.263 2.480 20 0 BEADLO Cc1nnc(C[N@H+](C)CCc2ccccc2F)o1 ZINC000598001602 348855100 /nfs/dbraw/zinc/85/51/00/348855100.db2.gz HPWGJNAPRNOLPD-UHFFFAOYSA-N 1 2 249.289 2.192 20 0 BEADLO Cc1nnc(C[N@@H+](C)CCc2ccccc2F)o1 ZINC000598001602 348855102 /nfs/dbraw/zinc/85/51/02/348855102.db2.gz HPWGJNAPRNOLPD-UHFFFAOYSA-N 1 2 249.289 2.192 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NCCn1cccc1 ZINC000121388955 179707679 /nfs/dbraw/zinc/70/76/79/179707679.db2.gz UFJZMYQUUYCSKB-UHFFFAOYSA-N 1 2 244.298 2.013 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@H](C)C(F)(F)F ZINC000288984527 179710715 /nfs/dbraw/zinc/71/07/15/179710715.db2.gz ZJYIWFCZDHBDDA-SSDOTTSWSA-N 1 2 247.220 2.462 20 0 BEADLO COc1ccc(CSCCn2cc[nH+]c2)cn1 ZINC000598731852 349034550 /nfs/dbraw/zinc/03/45/50/349034550.db2.gz BZBRXAOSAAKMNV-UHFFFAOYSA-N 1 2 249.339 2.220 20 0 BEADLO Cc1cc(N[C@@H](C)c2nccs2)nc[nH+]1 ZINC000070621591 323205170 /nfs/dbraw/zinc/20/51/70/323205170.db2.gz DNVGWKVFZBUODV-QMMMGPOBSA-N 1 2 220.301 2.415 20 0 BEADLO COC(=O)Cc1cc[nH+]c(NCC2CC=CC2)c1 ZINC000599125682 349101916 /nfs/dbraw/zinc/10/19/16/349101916.db2.gz AEJDWBCJIVNHBF-UHFFFAOYSA-N 1 2 246.310 2.175 20 0 BEADLO CCC[C@@H](C)CCC[NH+]1CCS(=O)CC1 ZINC000599291943 349149440 /nfs/dbraw/zinc/14/94/40/349149440.db2.gz WNHHHVDBJADIRN-GFCCVEGCSA-N 1 2 231.405 2.267 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nncn2C)[C@H]1c1ccccc1 ZINC000248343456 349123480 /nfs/dbraw/zinc/12/34/80/349123480.db2.gz KIFXWGMEUVXOSB-BXUZGUMPSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nncn2C)[C@H]1c1ccccc1 ZINC000248343456 349123484 /nfs/dbraw/zinc/12/34/84/349123484.db2.gz KIFXWGMEUVXOSB-BXUZGUMPSA-N 1 2 242.326 2.008 20 0 BEADLO Cc1csc([C@@H](C)[NH2+]Cc2cnc(C)nc2)n1 ZINC000340691107 179794424 /nfs/dbraw/zinc/79/44/24/179794424.db2.gz PEISCNCQZPCDGZ-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO CCOC(=O)[C@H]1c2ccoc2CC[N@H+]1CC1CC1 ZINC000599548743 349215409 /nfs/dbraw/zinc/21/54/09/349215409.db2.gz QOWXTQNYTKOYKO-CYBMUJFWSA-N 1 2 249.310 2.152 20 0 BEADLO CCOC(=O)[C@H]1c2ccoc2CC[N@@H+]1CC1CC1 ZINC000599548743 349215412 /nfs/dbraw/zinc/21/54/12/349215412.db2.gz QOWXTQNYTKOYKO-CYBMUJFWSA-N 1 2 249.310 2.152 20 0 BEADLO CC[C@@H]1C[C@H](CNc2c[nH]c[nH+]2)CCO1 ZINC000308960379 349202727 /nfs/dbraw/zinc/20/27/27/349202727.db2.gz RTVIYUMQJHGQPJ-NXEZZACHSA-N 1 2 209.293 2.027 20 0 BEADLO c1ccc2cc(N3CCO[C@H]4C[C@H]43)[nH+]cc2c1 ZINC000631280821 349336855 /nfs/dbraw/zinc/33/68/55/349336855.db2.gz XFAQJXTWYKYNJE-OLZOCXBDSA-N 1 2 226.279 2.212 20 0 BEADLO CCCC[C@@H](C)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000300917859 349429435 /nfs/dbraw/zinc/42/94/35/349429435.db2.gz KUVXLHBRCLWYAC-NXEZZACHSA-N 1 2 223.320 2.413 20 0 BEADLO Cc1nc(CN[C@@H]2C[C@@H](C)n3cc[nH+]c32)cs1 ZINC000334190560 179972507 /nfs/dbraw/zinc/97/25/07/179972507.db2.gz HILWBYJASABZGC-LDYMZIIASA-N 1 2 248.355 2.444 20 0 BEADLO O=C(CC1CC1)Nc1ccc2[nH+]ccn2c1 ZINC000603884603 350048672 /nfs/dbraw/zinc/04/86/72/350048672.db2.gz JMXFKDUCNQSAMB-UHFFFAOYSA-N 1 2 215.256 2.073 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)CCC(C)(F)F ZINC000603910789 350050455 /nfs/dbraw/zinc/05/04/55/350050455.db2.gz KBBDSGKBVWDIMQ-UHFFFAOYSA-N 1 2 242.269 2.440 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H](CO)C(C)(C)C)[nH+]1 ZINC000358132685 180022018 /nfs/dbraw/zinc/02/20/18/180022018.db2.gz UGYPXLKYPPGECV-JTQLQIEISA-N 1 2 248.330 2.085 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2CCS[C@@H](C)CC2)no1 ZINC000336394945 180048012 /nfs/dbraw/zinc/04/80/12/180048012.db2.gz JQSCORQYDYVSAH-IUCAKERBSA-N 1 2 241.360 2.266 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2CCS[C@@H](C)CC2)no1 ZINC000336394945 180048013 /nfs/dbraw/zinc/04/80/13/180048013.db2.gz JQSCORQYDYVSAH-IUCAKERBSA-N 1 2 241.360 2.266 20 0 BEADLO Cc1nc(N[C@@H](C)[C@@H](C)CO)c2c([nH+]1)CCCC2 ZINC000272822237 180070059 /nfs/dbraw/zinc/07/00/59/180070059.db2.gz FJPQYYJRNXWPEQ-UWVGGRQHSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1nc2n(n1)CC[N@@H+]([C@@H]1/C=C/CCCCC1)C2 ZINC000336368891 180112554 /nfs/dbraw/zinc/11/25/54/180112554.db2.gz PGTJJFACTHFTMU-VUDGCMKMSA-N 1 2 246.358 2.291 20 0 BEADLO Cc1nc2n(n1)CC[N@H+]([C@@H]1/C=C/CCCCC1)C2 ZINC000336368891 180112556 /nfs/dbraw/zinc/11/25/56/180112556.db2.gz PGTJJFACTHFTMU-VUDGCMKMSA-N 1 2 246.358 2.291 20 0 BEADLO COC(=O)C1([NH2+]CCC(F)(F)F)CCCC1 ZINC000133795428 191043307 /nfs/dbraw/zinc/04/33/07/191043307.db2.gz WGAHMJJIBPWSLQ-UHFFFAOYSA-N 1 2 239.237 2.014 20 0 BEADLO Cc1ccncc1C[N@H+](C)Cc1cnc(C)nc1 ZINC000352394281 180139373 /nfs/dbraw/zinc/13/93/73/180139373.db2.gz LRJYIGFYNUFRGZ-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccncc1C[N@@H+](C)Cc1cnc(C)nc1 ZINC000352394281 180139376 /nfs/dbraw/zinc/13/93/76/180139376.db2.gz LRJYIGFYNUFRGZ-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H]1CCC[C@@H](C)C1 ZINC000336080194 180118514 /nfs/dbraw/zinc/11/85/14/180118514.db2.gz XWTPWAACUJBWFW-KOLCDFICSA-N 1 2 235.331 2.161 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1ccoc1C1CC1 ZINC000337052121 180121569 /nfs/dbraw/zinc/12/15/69/180121569.db2.gz NXHUSEVVOFWAFR-UHFFFAOYSA-N 1 2 245.282 2.119 20 0 BEADLO Cc1ncc(C[NH2+]Cc2nccs2)s1 ZINC000040444103 180155350 /nfs/dbraw/zinc/15/53/50/180155350.db2.gz PSAWPXVFZULSHU-UHFFFAOYSA-N 1 2 225.342 2.198 20 0 BEADLO Cc1ncc(CNc2ccc[nH+]c2C)cn1 ZINC000309849648 180161192 /nfs/dbraw/zinc/16/11/92/180161192.db2.gz INDZKJFRJKKSSO-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO Cc1ncc(C[N@@H+]2CCc3sccc3C2)cn1 ZINC000336325573 180145902 /nfs/dbraw/zinc/14/59/02/180145902.db2.gz LOYNPRRQWAGTIO-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ncc(C[N@H+]2CCc3sccc3C2)cn1 ZINC000336325573 180145904 /nfs/dbraw/zinc/14/59/04/180145904.db2.gz LOYNPRRQWAGTIO-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ncc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)s1 ZINC000128019672 180146697 /nfs/dbraw/zinc/14/66/97/180146697.db2.gz QTSKYPSGSHRFNB-DTORHVGOSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ncc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)s1 ZINC000128019672 180146699 /nfs/dbraw/zinc/14/66/99/180146699.db2.gz QTSKYPSGSHRFNB-DTORHVGOSA-N 1 2 226.345 2.061 20 0 BEADLO CCc1cc(NCCc2ccc(C)cc2)nc[nH+]1 ZINC000604757493 350187352 /nfs/dbraw/zinc/18/73/52/350187352.db2.gz AHUFYLWQRAZZFY-UHFFFAOYSA-N 1 2 241.338 2.424 20 0 BEADLO c1cnc(NCCc2[nH]c3ccccc3[nH+]2)nc1 ZINC000007128689 350220143 /nfs/dbraw/zinc/22/01/43/350220143.db2.gz MYSNPSVSKZMTLW-UHFFFAOYSA-N 1 2 239.282 2.008 20 0 BEADLO Cc1nc(C[NH2+]Cc2cccnc2C)cs1 ZINC000309216026 350202210 /nfs/dbraw/zinc/20/22/10/350202210.db2.gz IBBHQKNUFPDOQV-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO Cc1nc(NC[C@@H]2CCCSC2)cc[nH+]1 ZINC000288534987 180200094 /nfs/dbraw/zinc/20/00/94/180200094.db2.gz OMNZSQZCNGGUDL-JTQLQIEISA-N 1 2 223.345 2.340 20 0 BEADLO Cc1nc(NC[C@H]2CCCCS2)cc[nH+]1 ZINC000087685980 180200911 /nfs/dbraw/zinc/20/09/11/180200911.db2.gz RPIYQUBSIFNJPT-SNVBAGLBSA-N 1 2 223.345 2.483 20 0 BEADLO Cc1nc(NC[C@H]2CCO[C@@H](C)C2)cc[nH+]1 ZINC000271289126 180200967 /nfs/dbraw/zinc/20/09/67/180200967.db2.gz DQVIAQAFVXWGHI-ONGXEEELSA-N 1 2 221.304 2.012 20 0 BEADLO Cc1cccnc1CCNc1cc[nH+]c(C)n1 ZINC000295700597 180201301 /nfs/dbraw/zinc/20/13/01/180201301.db2.gz JCPVRDZXNVVJEM-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO Cc1nc(N[C@@H](C)C[C@@H]2CCCO2)cc[nH+]1 ZINC000309761120 180202896 /nfs/dbraw/zinc/20/28/96/180202896.db2.gz MOZNSBFOTDJNLX-ONGXEEELSA-N 1 2 221.304 2.155 20 0 BEADLO Cc1nc(N[C@@H](C)[C@@H]2CCCCO2)cc[nH+]1 ZINC000271915271 180203097 /nfs/dbraw/zinc/20/30/97/180203097.db2.gz BUHSMESIXWDICA-ONGXEEELSA-N 1 2 221.304 2.155 20 0 BEADLO Cc1nc(N[C@@H](C)c2ccccn2)cc[nH+]1 ZINC000054935836 180203615 /nfs/dbraw/zinc/20/36/15/180203615.db2.gz ZXSAYRQHVYWTKJ-VIFPVBQESA-N 1 2 214.272 2.353 20 0 BEADLO Cc1cccnc1CNc1cc[nH+]c(C)n1 ZINC000070909225 180203944 /nfs/dbraw/zinc/20/39/44/180203944.db2.gz ABYKOGHLFQFBQB-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO Cc1nc(N[C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)cc[nH+]1 ZINC000361118373 180204905 /nfs/dbraw/zinc/20/49/05/180204905.db2.gz UWPITSMUEXIING-UHTWSYAYSA-N 1 2 247.342 2.401 20 0 BEADLO Cc1nc(N[C@H]2CSC2(C)C)cc[nH+]1 ZINC000276572690 180206887 /nfs/dbraw/zinc/20/68/87/180206887.db2.gz NJAHGOUTUDJTOG-QMMMGPOBSA-N 1 2 209.318 2.091 20 0 BEADLO Cc1nc(N[C@H]2COc3ccc(F)cc32)cc[nH+]1 ZINC000341669926 180207273 /nfs/dbraw/zinc/20/72/73/180207273.db2.gz WMURBLWNUZPSCX-NSHDSACASA-N 1 2 245.257 2.470 20 0 BEADLO Cc1ccc(CNc2cc[nH+]c(C)n2)cc1F ZINC000361162190 180181769 /nfs/dbraw/zinc/18/17/69/180181769.db2.gz RXMADEPAVACKPI-UHFFFAOYSA-N 1 2 231.274 2.267 20 0 BEADLO Cc1nccc(C[N@@H+]2CCO[C@@H](C(C)(C)C)C2)n1 ZINC000353251255 180184568 /nfs/dbraw/zinc/18/45/68/180184568.db2.gz FNHWYHJAQOZFBP-CYBMUJFWSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1nccc(C[N@H+]2CCO[C@@H](C(C)(C)C)C2)n1 ZINC000353251255 180184571 /nfs/dbraw/zinc/18/45/71/180184571.db2.gz FNHWYHJAQOZFBP-CYBMUJFWSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1ncccc1C[N@H+](C)Cc1ccon1 ZINC000353826759 180218163 /nfs/dbraw/zinc/21/81/63/180218163.db2.gz ZQUWHMPTIQMBJG-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ncccc1C[N@@H+](C)Cc1ccon1 ZINC000353826759 180218164 /nfs/dbraw/zinc/21/81/64/180218164.db2.gz ZQUWHMPTIQMBJG-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ncccc1C[N@@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000336331296 180220041 /nfs/dbraw/zinc/22/00/41/180220041.db2.gz NVUWTCUKUQUFHS-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ncccc1C[N@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000336331296 180220042 /nfs/dbraw/zinc/22/00/42/180220042.db2.gz NVUWTCUKUQUFHS-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1[nH+]cccc1NCc1c[nH]c2nccnc12 ZINC000356109037 180226913 /nfs/dbraw/zinc/22/69/13/180226913.db2.gz PMVFMZHNFKUURJ-UHFFFAOYSA-N 1 2 239.282 2.225 20 0 BEADLO COCc1cccc(C[NH2+]CC(F)F)c1 ZINC000038010915 350296179 /nfs/dbraw/zinc/29/61/79/350296179.db2.gz IMAFKKWBUHXACH-UHFFFAOYSA-N 1 2 215.243 2.188 20 0 BEADLO Cc1conc1C(=O)Nc1c(C)cc[nH+]c1C ZINC000637243833 350342266 /nfs/dbraw/zinc/34/22/66/350342266.db2.gz YALMEBUQWHEXRD-UHFFFAOYSA-N 1 2 231.255 2.247 20 0 BEADLO CC1(C)C[C@H]1NC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606581983 350373112 /nfs/dbraw/zinc/37/31/12/350373112.db2.gz YXZSLARBMABMSH-SNVBAGLBSA-N 1 2 244.298 2.254 20 0 BEADLO C[C@H]1C[C@H]1CNC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606581123 350374193 /nfs/dbraw/zinc/37/41/93/350374193.db2.gz RCLJKWHTEDMKEO-UWVGGRQHSA-N 1 2 244.298 2.112 20 0 BEADLO CCCc1nc(C)c(Cn2cc[nH+]c2)o1 ZINC000428377852 191100796 /nfs/dbraw/zinc/10/07/96/191100796.db2.gz YGLHWTNRSOCVOH-UHFFFAOYSA-N 1 2 205.261 2.180 20 0 BEADLO CCCOc1cccc(C[NH2+]Cc2ccn[nH]2)c1 ZINC000041015683 350403947 /nfs/dbraw/zinc/40/39/47/350403947.db2.gz ZOERWMIIHKTZDM-UHFFFAOYSA-N 1 2 245.326 2.488 20 0 BEADLO CC[N@H+](Cc1csnn1)CC(C)(C)C ZINC000336676183 350437914 /nfs/dbraw/zinc/43/79/14/350437914.db2.gz CQKUINNXACNHKL-UHFFFAOYSA-N 1 2 213.350 2.406 20 0 BEADLO CC[N@@H+](Cc1csnn1)CC(C)(C)C ZINC000336676183 350437919 /nfs/dbraw/zinc/43/79/19/350437919.db2.gz CQKUINNXACNHKL-UHFFFAOYSA-N 1 2 213.350 2.406 20 0 BEADLO CCc1cc(N2[C@@H](C)C[C@@H]2C)nc(C)[nH+]1 ZINC000335206470 538092008 /nfs/dbraw/zinc/09/20/08/538092008.db2.gz IZRHQVKXXIEFSH-IUCAKERBSA-N 1 2 205.305 2.335 20 0 BEADLO CCC[C@H]([NH2+]C[C@@H]1CCCS1)C(=O)OCC ZINC000148046674 191103375 /nfs/dbraw/zinc/10/33/75/191103375.db2.gz BNLAOXWEQXQGMU-QWRGUYRKSA-N 1 2 245.388 2.203 20 0 BEADLO CC[N@H+](Cc1csc(C)n1)[C@H]1CCOC1 ZINC000336702623 350458229 /nfs/dbraw/zinc/45/82/29/350458229.db2.gz QABVACXBGGYPDI-NSHDSACASA-N 1 2 226.345 2.062 20 0 BEADLO CC[N@@H+](Cc1csc(C)n1)[C@H]1CCOC1 ZINC000336702623 350458231 /nfs/dbraw/zinc/45/82/31/350458231.db2.gz QABVACXBGGYPDI-NSHDSACASA-N 1 2 226.345 2.062 20 0 BEADLO CCC(CC)CC(=O)N[C@@H]1CCn2cc[nH+]c2C1 ZINC000427998959 191104964 /nfs/dbraw/zinc/10/49/64/191104964.db2.gz XPPJKKDPIURMED-GFCCVEGCSA-N 1 2 249.358 2.140 20 0 BEADLO CC[C@@H](N[C@H](C)c1[nH+]ccn1C)C(F)(F)F ZINC000336726469 350482326 /nfs/dbraw/zinc/48/23/26/350482326.db2.gz CACPYEXNYQVCOM-HTQZYQBOSA-N 1 2 235.253 2.412 20 0 BEADLO Cn1c[nH+]cc1COc1ccc2[nH]ccc2c1 ZINC000163162490 350507856 /nfs/dbraw/zinc/50/78/56/350507856.db2.gz PUNWIXNYGNGJFW-UHFFFAOYSA-N 1 2 227.267 2.480 20 0 BEADLO CC[C@@H]1[C@@H](C)CCN1C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000577498158 365970625 /nfs/dbraw/zinc/97/06/25/365970625.db2.gz LZXOHJRVSPLSGL-RWMBFGLXSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1CCC[C@H]1CCO ZINC000577510570 365974097 /nfs/dbraw/zinc/97/40/97/365974097.db2.gz MVSLXLRHRUCHGV-NWDGAFQWSA-N 1 2 235.331 2.056 20 0 BEADLO CCC(CC)[C@@H](O)C[NH2+][C@@H](C)c1cn[nH]c1C ZINC000305801378 490619856 /nfs/dbraw/zinc/61/98/56/490619856.db2.gz DWXXUEHYIPGVHI-ZANVPECISA-N 1 2 239.363 2.166 20 0 BEADLO CCC(CC)[C@H](O)C[NH2+][C@H](C)c1cn[nH]c1C ZINC000305801370 490619859 /nfs/dbraw/zinc/61/98/59/490619859.db2.gz DWXXUEHYIPGVHI-NOZJJQNGSA-N 1 2 239.363 2.166 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]C/C=C/Cl)s1 ZINC000273593694 180441959 /nfs/dbraw/zinc/44/19/59/180441959.db2.gz JQPOECGMTJBLQE-FCJGRKLLSA-N 1 2 217.725 2.250 20 0 BEADLO FC(F)(F)[C@H]1C[N@@H+]([C@@H]2C=CCCC2)CCO1 ZINC000606902064 350626754 /nfs/dbraw/zinc/62/67/54/350626754.db2.gz WKMSUSGGXOTWGI-NXEZZACHSA-N 1 2 235.249 2.358 20 0 BEADLO FC(F)(F)[C@H]1C[N@H+]([C@@H]2C=CCCC2)CCO1 ZINC000606902064 350626756 /nfs/dbraw/zinc/62/67/56/350626756.db2.gz WKMSUSGGXOTWGI-NXEZZACHSA-N 1 2 235.249 2.358 20 0 BEADLO FC(F)(F)[C@@H]1C[N@@H+]([C@H]2C=CCCC2)CCO1 ZINC000606902070 350627005 /nfs/dbraw/zinc/62/70/05/350627005.db2.gz WKMSUSGGXOTWGI-UWVGGRQHSA-N 1 2 235.249 2.358 20 0 BEADLO FC(F)(F)[C@@H]1C[N@H+]([C@H]2C=CCCC2)CCO1 ZINC000606902070 350627009 /nfs/dbraw/zinc/62/70/09/350627009.db2.gz WKMSUSGGXOTWGI-UWVGGRQHSA-N 1 2 235.249 2.358 20 0 BEADLO C/C=C\CNC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000637488545 350650935 /nfs/dbraw/zinc/65/09/35/350650935.db2.gz QAXCFFFLCBTDLY-OTDNITJGSA-N 1 2 248.330 2.222 20 0 BEADLO CCN(c1cc(C)[nH+]c(C(C)C)n1)[C@H](C)CO ZINC000338792410 350712806 /nfs/dbraw/zinc/71/28/06/350712806.db2.gz HIUPBYOZDJLCGX-LLVKDONJSA-N 1 2 237.347 2.116 20 0 BEADLO CC(C)CCc1noc(C[N@@H+]2C[C@H](C)[C@@H]2C)n1 ZINC000339575366 350765429 /nfs/dbraw/zinc/76/54/29/350765429.db2.gz ZCNSVEFVEZWGHU-QWRGUYRKSA-N 1 2 237.347 2.498 20 0 BEADLO CC(C)CCc1noc(C[N@H+]2C[C@H](C)[C@@H]2C)n1 ZINC000339575366 350765430 /nfs/dbraw/zinc/76/54/30/350765430.db2.gz ZCNSVEFVEZWGHU-QWRGUYRKSA-N 1 2 237.347 2.498 20 0 BEADLO COc1ncc(C[NH2+][C@@H]2CCCC2(F)F)s1 ZINC000397991117 362982157 /nfs/dbraw/zinc/98/21/57/362982157.db2.gz IMDCDRVMSKUGOC-MRVPVSSYSA-N 1 2 248.298 2.429 20 0 BEADLO Cc1[nH]c(CN2CCO[C@H](C3CCC3)C2)[nH+]c1C ZINC000628310000 350791725 /nfs/dbraw/zinc/79/17/25/350791725.db2.gz HESPEIGTXMHORW-ZDUSSCGKSA-N 1 2 249.358 2.027 20 0 BEADLO CCc1nc(N2CCC[C@@H]2C(C)(C)O)cc(C)[nH+]1 ZINC000340015131 350920577 /nfs/dbraw/zinc/92/05/77/350920577.db2.gz KRCLSPFTJUDWAD-LLVKDONJSA-N 1 2 249.358 2.087 20 0 BEADLO CC=CC[NH2+]Cc1n[nH]c2ccccc21 ZINC000623739039 350882943 /nfs/dbraw/zinc/88/29/43/350882943.db2.gz GHIRQEYHZIIUSF-IHWYPQMZSA-N 1 2 201.273 2.229 20 0 BEADLO CCCCCNC(=O)C[N@H+](C)Cc1ccoc1 ZINC000052442798 350947851 /nfs/dbraw/zinc/94/78/51/350947851.db2.gz ASLSNRWDHGHEIF-UHFFFAOYSA-N 1 2 238.331 2.018 20 0 BEADLO CCCCCNC(=O)C[N@@H+](C)Cc1ccoc1 ZINC000052442798 350947854 /nfs/dbraw/zinc/94/78/54/350947854.db2.gz ASLSNRWDHGHEIF-UHFFFAOYSA-N 1 2 238.331 2.018 20 0 BEADLO Cn1ncc2c1nc[nH+]c2NC1(C2(C)CC2)CC1 ZINC000398216830 351015188 /nfs/dbraw/zinc/01/51/88/351015188.db2.gz LZOVMGUVCAQMLD-UHFFFAOYSA-N 1 2 243.314 2.108 20 0 BEADLO CC(C)[C@H](C[NH2+]Cc1c[nH]nn1)c1ccccc1 ZINC000398364582 351122884 /nfs/dbraw/zinc/12/28/84/351122884.db2.gz ZBLLKQJLPGIMKW-AWEZNQCLSA-N 1 2 244.342 2.334 20 0 BEADLO CC(C)[C@H](C[NH2+]Cc1cn[nH]n1)c1ccccc1 ZINC000398364582 351122888 /nfs/dbraw/zinc/12/28/88/351122888.db2.gz ZBLLKQJLPGIMKW-AWEZNQCLSA-N 1 2 244.342 2.334 20 0 BEADLO CC(C)[C@@H](C[NH2+]Cc1c[nH]nn1)c1ccccc1 ZINC000398364585 351123160 /nfs/dbraw/zinc/12/31/60/351123160.db2.gz ZBLLKQJLPGIMKW-CQSZACIVSA-N 1 2 244.342 2.334 20 0 BEADLO CC(C)[C@@H](C[NH2+]Cc1cn[nH]n1)c1ccccc1 ZINC000398364585 351123163 /nfs/dbraw/zinc/12/31/63/351123163.db2.gz ZBLLKQJLPGIMKW-CQSZACIVSA-N 1 2 244.342 2.334 20 0 BEADLO CC(C)[C@@H]1CC[C@H]([NH2+]Cc2c[nH]nn2)C[C@H]1C ZINC000623577865 363009544 /nfs/dbraw/zinc/00/95/44/363009544.db2.gz JKCIJJODUJDQFY-MDZLAQPJSA-N 1 2 236.363 2.355 20 0 BEADLO CC(C)[C@@H]1CC[C@H]([NH2+]Cc2cn[nH]n2)C[C@H]1C ZINC000623577865 363009548 /nfs/dbraw/zinc/00/95/48/363009548.db2.gz JKCIJJODUJDQFY-MDZLAQPJSA-N 1 2 236.363 2.355 20 0 BEADLO CC(C)[C@@H]1CCC[C@@H]([NH2+]Cc2c[nH]nn2)C1 ZINC000398413600 351141579 /nfs/dbraw/zinc/14/15/79/351141579.db2.gz ROALTWSCYWFCSV-GHMZBOCLSA-N 1 2 222.336 2.109 20 0 BEADLO CC(C)[C@@H]1CCC[C@@H]([NH2+]Cc2cn[nH]n2)C1 ZINC000398413600 351141583 /nfs/dbraw/zinc/14/15/83/351141583.db2.gz ROALTWSCYWFCSV-GHMZBOCLSA-N 1 2 222.336 2.109 20 0 BEADLO Cc1ncc(C[N@H+]2C[C@H](C)OCC23CCC3)o1 ZINC000628325191 351251076 /nfs/dbraw/zinc/25/10/76/351251076.db2.gz BFSKHIZRWMPJHE-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO Cc1ncc(C[N@@H+]2C[C@H](C)OCC23CCC3)o1 ZINC000628325191 351251077 /nfs/dbraw/zinc/25/10/77/351251077.db2.gz BFSKHIZRWMPJHE-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO CC(C)CN(Cc1[nH+]ccn1C)CC(F)(F)F ZINC000264758119 351253971 /nfs/dbraw/zinc/25/39/71/351253971.db2.gz CJJQHXFUZRHEOI-UHFFFAOYSA-N 1 2 249.280 2.440 20 0 BEADLO Cc1[nH]c(CN2CC[C@]3(CC3(F)F)C2)[nH+]c1C ZINC000628325723 351255823 /nfs/dbraw/zinc/25/58/23/351255823.db2.gz BDJVSQHXHSFKSS-NSHDSACASA-N 1 2 241.285 2.258 20 0 BEADLO Cc1ncc(C[N@H+]2C[C@H](C)OC3(CCC3)C2)o1 ZINC000628322817 351212696 /nfs/dbraw/zinc/21/26/96/351212696.db2.gz MOTYRIVGTKHOLM-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO Cc1ncc(C[N@@H+]2C[C@H](C)OC3(CCC3)C2)o1 ZINC000628322817 351212698 /nfs/dbraw/zinc/21/26/98/351212698.db2.gz MOTYRIVGTKHOLM-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO CC[C@@H]1CCC[C@@H]1NC(=O)c1c[nH+]c(C)[nH]1 ZINC000268270901 351332697 /nfs/dbraw/zinc/33/26/97/351332697.db2.gz SNTOWPCZNLQUHL-ZJUUUORDSA-N 1 2 221.304 2.027 20 0 BEADLO COc1cc(C[NH2+][C@@H](C)C(F)F)ccc1C#N ZINC000389947978 351278198 /nfs/dbraw/zinc/27/81/98/351278198.db2.gz VIFGJMBCQILNGV-QMMMGPOBSA-N 1 2 240.253 2.310 20 0 BEADLO CC[C@@H](O)CCNc1cc(C)[nH+]c(C2CC2)n1 ZINC000268686218 351338540 /nfs/dbraw/zinc/33/85/40/351338540.db2.gz NQXLEPRCBLGNKF-LLVKDONJSA-N 1 2 235.331 2.235 20 0 BEADLO CC(C)([NH2+]Cc1ccno1)c1nccs1 ZINC000072662677 351345400 /nfs/dbraw/zinc/34/54/00/351345400.db2.gz ZOWUQLLVDZOLGL-UHFFFAOYSA-N 1 2 223.301 2.156 20 0 BEADLO Clc1cccc(NCCCn2cc[nH+]c2)n1 ZINC000082460723 180591008 /nfs/dbraw/zinc/59/10/08/180591008.db2.gz HAZZJQLLXBXIIH-UHFFFAOYSA-N 1 2 236.706 2.434 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@]1(C)CCCOC1 ZINC000272993702 351505671 /nfs/dbraw/zinc/50/56/71/351505671.db2.gz QQNCKTPDJUNVRF-AWEZNQCLSA-N 1 2 248.326 2.399 20 0 BEADLO CC(=O)N(C)c1cccc(NCc2[nH]cc[nH+]2)c1 ZINC000174141081 363056741 /nfs/dbraw/zinc/05/67/41/363056741.db2.gz KSQLTJULTXJGIE-UHFFFAOYSA-N 1 2 244.298 2.005 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H](C)c1ccco1 ZINC000607485176 351544776 /nfs/dbraw/zinc/54/47/76/351544776.db2.gz VWWMLECZVGUPCA-VIFPVBQESA-N 1 2 246.266 2.425 20 0 BEADLO C[C@@H]1[C@@H](C)CCCN1C(=O)CCCn1cc[nH+]c1 ZINC000607525496 351574220 /nfs/dbraw/zinc/57/42/20/351574220.db2.gz MIBGNYORBUJRFJ-QWHCGFSZSA-N 1 2 249.358 2.310 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000577626374 366024770 /nfs/dbraw/zinc/02/47/70/366024770.db2.gz CAQVUABFOSIRNT-PEGIJTEDSA-N 1 2 235.331 2.461 20 0 BEADLO CN(C)c1ccc(NCc2cccc(O)c2)c[nH+]1 ZINC000036988945 358465577 /nfs/dbraw/zinc/46/55/77/358465577.db2.gz DCTPHUSIZSUFGE-UHFFFAOYSA-N 1 2 243.310 2.465 20 0 BEADLO C[C@@H](N(C)C(=O)[C@@H](C)Cc1c[nH+]c[nH]1)C1(C)CC1 ZINC000577647082 366031165 /nfs/dbraw/zinc/03/11/65/366031165.db2.gz GCRYGJWPKCQDTQ-WDEREUQCSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H](N(C)C(=O)[C@@H](C)Cc1c[nH]c[nH+]1)C1(C)CC1 ZINC000577647082 366031173 /nfs/dbraw/zinc/03/11/73/366031173.db2.gz GCRYGJWPKCQDTQ-WDEREUQCSA-N 1 2 249.358 2.235 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1cc(C)ns1 ZINC000637853157 351708841 /nfs/dbraw/zinc/70/88/41/351708841.db2.gz RHGVUFSSKQKOHY-GHMZBOCLSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1cc(C)ns1 ZINC000637853157 351708842 /nfs/dbraw/zinc/70/88/42/351708842.db2.gz RHGVUFSSKQKOHY-GHMZBOCLSA-N 1 2 240.372 2.451 20 0 BEADLO c1cc(C[NH2+][C@H]2CC23CCCCC3)[nH]n1 ZINC000386953293 363089121 /nfs/dbraw/zinc/08/91/21/363089121.db2.gz XEPSYSWCCXBCNO-NSHDSACASA-N 1 2 205.305 2.222 20 0 BEADLO CC[N@H+](Cc1nncn1-c1ccccc1)C1CC1 ZINC000278280918 351755178 /nfs/dbraw/zinc/75/51/78/351755178.db2.gz ZRXANQGKDHYRSU-UHFFFAOYSA-N 1 2 242.326 2.252 20 0 BEADLO CC[N@@H+](Cc1nncn1-c1ccccc1)C1CC1 ZINC000278280918 351755182 /nfs/dbraw/zinc/75/51/82/351755182.db2.gz ZRXANQGKDHYRSU-UHFFFAOYSA-N 1 2 242.326 2.252 20 0 BEADLO Oc1ccc2c(c1)C[N@@H+](Cc1ccns1)CC2 ZINC000637945981 351821323 /nfs/dbraw/zinc/82/13/23/351821323.db2.gz DWRWNMVMSQZLNC-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO Oc1ccc2c(c1)C[N@H+](Cc1ccns1)CC2 ZINC000637945981 351821326 /nfs/dbraw/zinc/82/13/26/351821326.db2.gz DWRWNMVMSQZLNC-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO Cc1cc(NC(=O)[C@H](C)c2ccco2)cc[nH+]1 ZINC000607649512 351821847 /nfs/dbraw/zinc/82/18/47/351821847.db2.gz GSQRCHHFWYXGFM-SNVBAGLBSA-N 1 2 230.267 2.147 20 0 BEADLO CC[C@H]1COCC[N@@H+]1[C@@H](C)c1cnc(C)nc1C ZINC000637948411 351822446 /nfs/dbraw/zinc/82/24/46/351822446.db2.gz MYMASCVPVXZZSY-AAEUAGOBSA-N 1 2 249.358 2.265 20 0 BEADLO CC[C@H]1COCC[N@H+]1[C@@H](C)c1cnc(C)nc1C ZINC000637948411 351822448 /nfs/dbraw/zinc/82/24/48/351822448.db2.gz MYMASCVPVXZZSY-AAEUAGOBSA-N 1 2 249.358 2.265 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H](OC)C1CC1 ZINC000280256213 351838206 /nfs/dbraw/zinc/83/82/06/351838206.db2.gz CDUHVGGSUSPPTB-LBPRGKRZSA-N 1 2 234.299 2.008 20 0 BEADLO CC[C@@H](NC(=O)CCc1c[nH+]c[nH]1)[C@H]1CC1(C)C ZINC000577840449 366079544 /nfs/dbraw/zinc/07/95/44/366079544.db2.gz XMFMCXLBUBWTTD-VXGBXAGGSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@@H](NC(=O)CCc1c[nH]c[nH+]1)[C@H]1CC1(C)C ZINC000577840449 366079552 /nfs/dbraw/zinc/07/95/52/366079552.db2.gz XMFMCXLBUBWTTD-VXGBXAGGSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cc(C)ns2)C[C@@H](C)O1 ZINC000637970039 351845220 /nfs/dbraw/zinc/84/52/20/351845220.db2.gz APAKXFZBVCOMCT-MNOVXSKESA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cc(C)ns2)C[C@@H](C)O1 ZINC000637970039 351845222 /nfs/dbraw/zinc/84/52/22/351845222.db2.gz APAKXFZBVCOMCT-MNOVXSKESA-N 1 2 240.372 2.451 20 0 BEADLO CCC[C@@H](C[N@@H+]1CCC[C@H]1c1ncon1)OC ZINC000637997323 351874516 /nfs/dbraw/zinc/87/45/16/351874516.db2.gz ATGRFLFJIYLSNY-QWRGUYRKSA-N 1 2 239.319 2.022 20 0 BEADLO CCC[C@@H](C[N@H+]1CCC[C@H]1c1ncon1)OC ZINC000637997323 351874522 /nfs/dbraw/zinc/87/45/22/351874522.db2.gz ATGRFLFJIYLSNY-QWRGUYRKSA-N 1 2 239.319 2.022 20 0 BEADLO CCCC[C@H](C)C(=O)N(C)Cc1[nH+]ccn1C ZINC000282579220 351937153 /nfs/dbraw/zinc/93/71/53/351937153.db2.gz OYFMJGLHDRNJNI-NSHDSACASA-N 1 2 237.347 2.205 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cn[nH]c2)c(F)c1 ZINC000638082310 351956372 /nfs/dbraw/zinc/95/63/72/351956372.db2.gz DDZHIDGBYGFOOW-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cn[nH]c2)c(F)c1 ZINC000638082310 351956374 /nfs/dbraw/zinc/95/63/74/351956374.db2.gz DDZHIDGBYGFOOW-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@@H](C)[C@H]2C)sn1 ZINC000638085604 351961702 /nfs/dbraw/zinc/96/17/02/351961702.db2.gz SAQAJRDAIWQAML-ZJUUUORDSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@@H](C)[C@H]2C)sn1 ZINC000638085604 351961706 /nfs/dbraw/zinc/96/17/06/351961706.db2.gz SAQAJRDAIWQAML-ZJUUUORDSA-N 1 2 226.345 2.061 20 0 BEADLO CC(C)[C@@H](C)Nc1ccc(N2CCOCC2)[nH+]c1 ZINC000037076072 535169067 /nfs/dbraw/zinc/16/90/67/535169067.db2.gz RDVZLRWSYJCMNI-GFCCVEGCSA-N 1 2 249.358 2.375 20 0 BEADLO CCc1nc(Nc2cnn(CC)c2)cc(C)[nH+]1 ZINC000283599369 351978464 /nfs/dbraw/zinc/97/84/64/351978464.db2.gz QNQKLHOKYDQQRD-UHFFFAOYSA-N 1 2 231.303 2.307 20 0 BEADLO COC(=O)Cc1cccc(NCC2(C)CCC2)[nH+]1 ZINC000618068873 351994385 /nfs/dbraw/zinc/99/43/85/351994385.db2.gz SBTUMKKFQBDXAW-UHFFFAOYSA-N 1 2 248.326 2.399 20 0 BEADLO COc1ccc[nH+]c1N1CCC(C)(C)C1 ZINC000527907963 323717588 /nfs/dbraw/zinc/71/75/88/323717588.db2.gz CEUZSRGOJLOTFV-UHFFFAOYSA-N 1 2 206.289 2.327 20 0 BEADLO CCc1cc(C[NH2+]Cc2cc(C3CC3)no2)on1 ZINC000638275368 352109925 /nfs/dbraw/zinc/10/99/25/352109925.db2.gz WDQZNOCUMOOUOY-UHFFFAOYSA-N 1 2 247.298 2.392 20 0 BEADLO c1csc(C[NH2+]Cc2cc(C3CC3)no2)n1 ZINC000638395327 352202747 /nfs/dbraw/zinc/20/27/47/352202747.db2.gz AOWPJCRBCHHRLM-UHFFFAOYSA-N 1 2 235.312 2.298 20 0 BEADLO Cc1noc(C)c1C[NH2+]Cc1cc(C2CC2)no1 ZINC000638417376 352226639 /nfs/dbraw/zinc/22/66/39/352226639.db2.gz FLGBRROVJIHBCL-UHFFFAOYSA-N 1 2 247.298 2.447 20 0 BEADLO CC[N@H+](Cc1ccn(C)n1)[C@H](C)c1cccnc1 ZINC000290568644 352230790 /nfs/dbraw/zinc/23/07/90/352230790.db2.gz SYXUDWCQKSKTLI-GFCCVEGCSA-N 1 2 244.342 2.398 20 0 BEADLO CC[N@@H+](Cc1ccn(C)n1)[C@H](C)c1cccnc1 ZINC000290568644 352230792 /nfs/dbraw/zinc/23/07/92/352230792.db2.gz SYXUDWCQKSKTLI-GFCCVEGCSA-N 1 2 244.342 2.398 20 0 BEADLO Cc1nnc([C@H](C)[N@H+](C)Cc2ccc(F)cc2)[nH]1 ZINC000411130104 191161996 /nfs/dbraw/zinc/16/19/96/191161996.db2.gz GGEBCKPAAWPXQN-VIFPVBQESA-N 1 2 248.305 2.445 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+](C)Cc2ccc(F)cc2)[nH]1 ZINC000411130104 191161999 /nfs/dbraw/zinc/16/19/99/191161999.db2.gz GGEBCKPAAWPXQN-VIFPVBQESA-N 1 2 248.305 2.445 20 0 BEADLO C[C@H]1C[N@@H+]([C@H]2C[C@H]2c2cccc(F)c2)CCO1 ZINC000411126912 191162453 /nfs/dbraw/zinc/16/24/53/191162453.db2.gz QJECXBIHOVIFMF-BPNCWPANSA-N 1 2 235.302 2.402 20 0 BEADLO C[C@H]1C[N@H+]([C@H]2C[C@H]2c2cccc(F)c2)CCO1 ZINC000411126912 191162454 /nfs/dbraw/zinc/16/24/54/191162454.db2.gz QJECXBIHOVIFMF-BPNCWPANSA-N 1 2 235.302 2.402 20 0 BEADLO CCOC[C@@H]1CCC[N@H+](CC(F)F)C1 ZINC000072975115 363151453 /nfs/dbraw/zinc/15/14/53/363151453.db2.gz IGSPPXAEJHPITP-SECBINFHSA-N 1 2 207.264 2.000 20 0 BEADLO CCOC[C@@H]1CCC[N@@H+](CC(F)F)C1 ZINC000072975115 363151456 /nfs/dbraw/zinc/15/14/56/363151456.db2.gz IGSPPXAEJHPITP-SECBINFHSA-N 1 2 207.264 2.000 20 0 BEADLO CCOC[C@H]1CCC[N@H+](CC(F)F)C1 ZINC000072975116 363151807 /nfs/dbraw/zinc/15/18/07/363151807.db2.gz IGSPPXAEJHPITP-VIFPVBQESA-N 1 2 207.264 2.000 20 0 BEADLO CCOC[C@H]1CCC[N@@H+](CC(F)F)C1 ZINC000072975116 363151809 /nfs/dbraw/zinc/15/18/09/363151809.db2.gz IGSPPXAEJHPITP-VIFPVBQESA-N 1 2 207.264 2.000 20 0 BEADLO CCCC[C@@H](C)N(C)C(=O)CCc1[nH]cc[nH+]1 ZINC000291152476 352263777 /nfs/dbraw/zinc/26/37/77/352263777.db2.gz FYHNWDGNJQNJPX-LLVKDONJSA-N 1 2 237.347 2.379 20 0 BEADLO CC[N@H+](Cc1ccccn1)Cc1cc(C)ncn1 ZINC000292356106 352316905 /nfs/dbraw/zinc/31/69/05/352316905.db2.gz FDYBUENVUAJHGE-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO CC[N@@H+](Cc1ccccn1)Cc1cc(C)ncn1 ZINC000292356106 352316907 /nfs/dbraw/zinc/31/69/07/352316907.db2.gz FDYBUENVUAJHGE-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO CC[N@H+](Cc1[nH]ncc1C)Cc1ccncc1 ZINC000291684400 352285646 /nfs/dbraw/zinc/28/56/46/352285646.db2.gz XLSZVCANTZHNOJ-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CC[N@@H+](Cc1[nH]ncc1C)Cc1ccncc1 ZINC000291684400 352285647 /nfs/dbraw/zinc/28/56/47/352285647.db2.gz XLSZVCANTZHNOJ-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CC[N@H+](Cc1n[nH]cc1C)Cc1ccncc1 ZINC000291684400 352285648 /nfs/dbraw/zinc/28/56/48/352285648.db2.gz XLSZVCANTZHNOJ-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CC[N@@H+](Cc1n[nH]cc1C)Cc1ccncc1 ZINC000291684400 352285649 /nfs/dbraw/zinc/28/56/49/352285649.db2.gz XLSZVCANTZHNOJ-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CCCC[C@@H](C)N(C)C(=O)Cc1[nH]c[nH+]c1C ZINC000291934521 352295613 /nfs/dbraw/zinc/29/56/13/352295613.db2.gz CJBRRYBLITYSIS-SNVBAGLBSA-N 1 2 237.347 2.298 20 0 BEADLO CCc1nc(C)c(C[NH2+]Cc2conc2C)o1 ZINC000292994506 352335489 /nfs/dbraw/zinc/33/54/89/352335489.db2.gz OICQAJVKBXMVST-UHFFFAOYSA-N 1 2 235.287 2.132 20 0 BEADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1nnc(C)[nH]1 ZINC000293259185 352343646 /nfs/dbraw/zinc/34/36/46/352343646.db2.gz RWPGQABQUVISAX-LBPRGKRZSA-N 1 2 245.330 2.091 20 0 BEADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1nnc(C)[nH]1 ZINC000293259185 352343651 /nfs/dbraw/zinc/34/36/51/352343651.db2.gz RWPGQABQUVISAX-LBPRGKRZSA-N 1 2 245.330 2.091 20 0 BEADLO CC[N@H+](Cc1ccncc1)[C@@H](C)c1nnc(C)[nH]1 ZINC000411425239 191186167 /nfs/dbraw/zinc/18/61/67/191186167.db2.gz MDUDLYNVRCPXLJ-JTQLQIEISA-N 1 2 245.330 2.091 20 0 BEADLO CC[N@@H+](Cc1ccncc1)[C@@H](C)c1nnc(C)[nH]1 ZINC000411425239 191186168 /nfs/dbraw/zinc/18/61/68/191186168.db2.gz MDUDLYNVRCPXLJ-JTQLQIEISA-N 1 2 245.330 2.091 20 0 BEADLO Cc1ccc(F)c(C[NH2+][C@@H](C)c2ncnn2C)c1 ZINC000276805643 187688043 /nfs/dbraw/zinc/68/80/43/187688043.db2.gz ZOGVFYQUNDRRTA-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)NCc1[nH+]ccn1CC ZINC000295739224 352423033 /nfs/dbraw/zinc/42/30/33/352423033.db2.gz SMLFOEFJPFBKIR-VXGBXAGGSA-N 1 2 249.358 2.346 20 0 BEADLO c1cc(C[NH2+]Cc2ccc3cccnc3c2)[nH]n1 ZINC000608055819 352651818 /nfs/dbraw/zinc/65/18/18/352651818.db2.gz IDPFXBRUDCKQAA-UHFFFAOYSA-N 1 2 238.294 2.248 20 0 BEADLO C[C@H](c1cnccn1)[N@@H+]1CCO[C@H](C2CCC2)C1 ZINC000411855381 191220524 /nfs/dbraw/zinc/22/05/24/191220524.db2.gz URGNADVTIMHHAH-RISCZKNCSA-N 1 2 247.342 2.039 20 0 BEADLO C[C@H](c1cnccn1)[N@H+]1CCO[C@H](C2CCC2)C1 ZINC000411855381 191220525 /nfs/dbraw/zinc/22/05/25/191220525.db2.gz URGNADVTIMHHAH-RISCZKNCSA-N 1 2 247.342 2.039 20 0 BEADLO FC[C@@H]1C[N@H+](C/C=C\c2ccccc2)CCO1 ZINC000411852468 191221152 /nfs/dbraw/zinc/22/11/52/191221152.db2.gz KHOGMYPXRUFWIB-HJHHMULASA-N 1 2 235.302 2.370 20 0 BEADLO FC[C@@H]1C[N@@H+](C/C=C\c2ccccc2)CCO1 ZINC000411852468 191221154 /nfs/dbraw/zinc/22/11/54/191221154.db2.gz KHOGMYPXRUFWIB-HJHHMULASA-N 1 2 235.302 2.370 20 0 BEADLO CSc1ccc(NCCC[C@@H]2CCO2)[nH+]c1 ZINC000638760456 352695138 /nfs/dbraw/zinc/69/51/38/352695138.db2.gz RYMKDKMKGVAKKG-SNVBAGLBSA-N 1 2 238.356 2.206 20 0 BEADLO Fc1ccc(C[NH2+]Cc2cc(C3CC3)no2)nc1 ZINC000638763193 352698863 /nfs/dbraw/zinc/69/88/63/352698863.db2.gz VGWZRNSKTZIHTD-UHFFFAOYSA-N 1 2 247.273 2.376 20 0 BEADLO CC[C@H](C(=O)OC)[N@H+](CC)Cc1occc1C ZINC000412024476 191239413 /nfs/dbraw/zinc/23/94/13/191239413.db2.gz CDRXGXKDFWRBHG-LLVKDONJSA-N 1 2 239.315 2.362 20 0 BEADLO CC[C@H](C(=O)OC)[N@@H+](CC)Cc1occc1C ZINC000412024476 191239416 /nfs/dbraw/zinc/23/94/16/191239416.db2.gz CDRXGXKDFWRBHG-LLVKDONJSA-N 1 2 239.315 2.362 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+](CC)Cc1occc1C ZINC000412028265 191239891 /nfs/dbraw/zinc/23/98/91/191239891.db2.gz RPDRXSLUQKDUFH-NSHDSACASA-N 1 2 239.315 2.362 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+](CC)Cc1occc1C ZINC000412028265 191239892 /nfs/dbraw/zinc/23/98/92/191239892.db2.gz RPDRXSLUQKDUFH-NSHDSACASA-N 1 2 239.315 2.362 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccc(F)cn1)c1nccn1C ZINC000341833234 352728443 /nfs/dbraw/zinc/72/84/43/352728443.db2.gz LEASDBWVOTYDNO-GFCCVEGCSA-N 1 2 248.305 2.195 20 0 BEADLO Cc1nnc(C[N@H+]2CC=C(C)CC2)n1C1CC1 ZINC000334175969 352761230 /nfs/dbraw/zinc/76/12/30/352761230.db2.gz CUDBBBBQKPDYRT-UHFFFAOYSA-N 1 2 232.331 2.073 20 0 BEADLO Cc1nnc(C[N@@H+]2CC=C(C)CC2)n1C1CC1 ZINC000334175969 352761232 /nfs/dbraw/zinc/76/12/32/352761232.db2.gz CUDBBBBQKPDYRT-UHFFFAOYSA-N 1 2 232.331 2.073 20 0 BEADLO c1cc(C[N@@H+]2CC[C@H]2c2ccccc2)n[nH]1 ZINC000334183551 352772094 /nfs/dbraw/zinc/77/20/94/352772094.db2.gz AAPPYQRHYRIWEQ-ZDUSSCGKSA-N 1 2 213.284 2.357 20 0 BEADLO c1cc(C[N@H+]2CC[C@H]2c2ccccc2)n[nH]1 ZINC000334183551 352772099 /nfs/dbraw/zinc/77/20/99/352772099.db2.gz AAPPYQRHYRIWEQ-ZDUSSCGKSA-N 1 2 213.284 2.357 20 0 BEADLO CCc1nc(C[NH+]2CCC(C)(C)CC2)no1 ZINC000334192779 352784532 /nfs/dbraw/zinc/78/45/32/352784532.db2.gz JRWPZOSEOIWBLA-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO CCC(C)(C)N(C)C(=O)[C@H]1CCn2c[nH+]cc2C1 ZINC000334195301 352787744 /nfs/dbraw/zinc/78/77/44/352787744.db2.gz LTVQLXUDEVHODA-NSHDSACASA-N 1 2 249.358 2.093 20 0 BEADLO CCC(C)(C)C(=O)N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000334202836 352796354 /nfs/dbraw/zinc/79/63/54/352796354.db2.gz PHFOTWHWZQVVFK-LLVKDONJSA-N 1 2 249.358 2.172 20 0 BEADLO Cc1nc(N2CCCc3occc3C2)cc[nH+]1 ZINC000334202796 352796436 /nfs/dbraw/zinc/79/64/36/352796436.db2.gz PFQQXOBZJGSPIL-UHFFFAOYSA-N 1 2 229.283 2.331 20 0 BEADLO FC1(F)CCN(Cc2c[nH+]c3ccccn23)C1 ZINC000334205208 352800321 /nfs/dbraw/zinc/80/03/21/352800321.db2.gz XLSOVRRMTHTCKY-UHFFFAOYSA-N 1 2 237.253 2.175 20 0 BEADLO C[C@@H]1COCCN(c2[nH+]c3ccccc3n2C)C1 ZINC000334207374 352803379 /nfs/dbraw/zinc/80/33/79/352803379.db2.gz WXUIGELDQUNLOT-NSHDSACASA-N 1 2 245.326 2.046 20 0 BEADLO C[C@H](F)CC[N@H+](C)Cc1noc(C2CC2)n1 ZINC000412083363 191255578 /nfs/dbraw/zinc/25/55/78/191255578.db2.gz ZRPAKSJFNFVMQX-QMMMGPOBSA-N 1 2 227.283 2.127 20 0 BEADLO C[C@H](F)CC[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000412083363 191255580 /nfs/dbraw/zinc/25/55/80/191255580.db2.gz ZRPAKSJFNFVMQX-QMMMGPOBSA-N 1 2 227.283 2.127 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2nccs2)nc(C)n1 ZINC000342813786 352863151 /nfs/dbraw/zinc/86/31/51/352863151.db2.gz UDLGDXMJYGDILV-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO Cc1c[nH+]c(CN2CC[C@H](C)C(F)(F)C2)n1C ZINC000342853610 352876195 /nfs/dbraw/zinc/87/61/95/352876195.db2.gz OQOKLPLAWLBHRE-VIFPVBQESA-N 1 2 243.301 2.206 20 0 BEADLO C(c1noc(C2CC2)n1)[N@@H+]1CC[C@H]2CCC[C@@H]21 ZINC000334272235 352908969 /nfs/dbraw/zinc/90/89/69/352908969.db2.gz WUXGWZKHOGPJQG-KOLCDFICSA-N 1 2 233.315 2.321 20 0 BEADLO C(c1noc(C2CC2)n1)[N@H+]1CC[C@H]2CCC[C@@H]21 ZINC000334272235 352908972 /nfs/dbraw/zinc/90/89/72/352908972.db2.gz WUXGWZKHOGPJQG-KOLCDFICSA-N 1 2 233.315 2.321 20 0 BEADLO Cc1cc(N2CCC(C)(C)CC2)nc[nH+]1 ZINC000334279617 352914129 /nfs/dbraw/zinc/91/41/29/352914129.db2.gz GBXYPIXJCYKRPU-UHFFFAOYSA-N 1 2 205.305 2.411 20 0 BEADLO CCOc1cccc(C[NH2+]Cc2ccco2)n1 ZINC000342963611 352919537 /nfs/dbraw/zinc/91/95/37/352919537.db2.gz VGDXVSXGYXFEHS-UHFFFAOYSA-N 1 2 232.283 2.363 20 0 BEADLO C[C@H]1CC[N@H+](Cc2nnsc2Cl)[C@H]1C ZINC000306159311 352985011 /nfs/dbraw/zinc/98/50/11/352985011.db2.gz NOQIMBTXNZPWPQ-BQBZGAKWSA-N 1 2 231.752 2.422 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2nnsc2Cl)[C@H]1C ZINC000306159311 352985012 /nfs/dbraw/zinc/98/50/12/352985012.db2.gz NOQIMBTXNZPWPQ-BQBZGAKWSA-N 1 2 231.752 2.422 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CCC(F)(F)C2)[nH+]1 ZINC000334302626 352938606 /nfs/dbraw/zinc/93/86/06/352938606.db2.gz AHMXRRPVALOUQX-UHFFFAOYSA-N 1 2 238.241 2.112 20 0 BEADLO OCC[N@@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000334328946 352966068 /nfs/dbraw/zinc/96/60/68/352966068.db2.gz ISMYNBWMTIMYIP-GFCCVEGCSA-N 1 2 243.709 2.203 20 0 BEADLO OCC[N@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000334328946 352966072 /nfs/dbraw/zinc/96/60/72/352966072.db2.gz ISMYNBWMTIMYIP-GFCCVEGCSA-N 1 2 243.709 2.203 20 0 BEADLO CCCC(=O)NCc1ccc[nH+]c1N1CCCC1 ZINC000617479756 352966662 /nfs/dbraw/zinc/96/66/62/352966662.db2.gz YUTIEXFWAROYES-UHFFFAOYSA-N 1 2 247.342 2.098 20 0 BEADLO Cn1cc[nH+]c1[C@H](C1CC1)N1CCC(F)(F)C1 ZINC000638842661 353019036 /nfs/dbraw/zinc/01/90/36/353019036.db2.gz XSKQMROQMMMWNV-JTQLQIEISA-N 1 2 241.285 2.212 20 0 BEADLO Cc1ccoc1C[N@@H+]1CCc2nc(C)ncc2C1 ZINC000334372931 353025571 /nfs/dbraw/zinc/02/55/71/353025571.db2.gz ZCYDDKIHTGOUAD-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1ccoc1C[N@H+]1CCc2nc(C)ncc2C1 ZINC000334372931 353025573 /nfs/dbraw/zinc/02/55/73/353025573.db2.gz ZCYDDKIHTGOUAD-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO COc1ccc[nH+]c1NCCC[C@H]1CCO1 ZINC000638825096 353006016 /nfs/dbraw/zinc/00/60/16/353006016.db2.gz YQHPFISUJFXTTD-JTQLQIEISA-N 1 2 222.288 2.071 20 0 BEADLO Cc1nc(C[NH2+][C@@H]2CCC[C@@H]2F)cs1 ZINC000307360121 353070849 /nfs/dbraw/zinc/07/08/49/353070849.db2.gz DUUYKFCOZIEEMG-VHSXEESVSA-N 1 2 214.309 2.432 20 0 BEADLO COc1ncc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)s1 ZINC000638910554 353074502 /nfs/dbraw/zinc/07/45/02/353074502.db2.gz SGWDSBIETMIWOO-PSASIEDQSA-N 1 2 244.335 2.332 20 0 BEADLO COc1ncc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)s1 ZINC000638910554 353074504 /nfs/dbraw/zinc/07/45/04/353074504.db2.gz SGWDSBIETMIWOO-PSASIEDQSA-N 1 2 244.335 2.332 20 0 BEADLO Cc1cc(C[NH2+]Cc2cc(C3CC3)no2)on1 ZINC000638867144 353041259 /nfs/dbraw/zinc/04/12/59/353041259.db2.gz YLGACXCSWDCBRR-UHFFFAOYSA-N 1 2 233.271 2.138 20 0 BEADLO COCc1cccc(C[NH2+]Cc2ncc(C)o2)c1 ZINC000231788201 538107323 /nfs/dbraw/zinc/10/73/23/538107323.db2.gz HIWWFBHBSLODAO-UHFFFAOYSA-N 1 2 246.310 2.419 20 0 BEADLO COc1ccc(C[NH2+]Cc2ncc(C)o2)cc1 ZINC000231787892 538107388 /nfs/dbraw/zinc/10/73/88/538107388.db2.gz MYCJACPYEIJWMA-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC(F)(F)[C@H](C)C2)nc1 ZINC000334430545 353105555 /nfs/dbraw/zinc/10/55/55/353105555.db2.gz VGVJAXXDKXLXQO-SNVBAGLBSA-N 1 2 241.285 2.262 20 0 BEADLO Cc1cnc(C[N@H+]2CCC(F)(F)[C@H](C)C2)nc1 ZINC000334430545 353105560 /nfs/dbraw/zinc/10/55/60/353105560.db2.gz VGVJAXXDKXLXQO-SNVBAGLBSA-N 1 2 241.285 2.262 20 0 BEADLO CC(C)CNC(=O)[C@H](C)[NH+]1Cc2ccccc2C1 ZINC000155543851 187987454 /nfs/dbraw/zinc/98/74/54/187987454.db2.gz BUSXGBZYJIORKO-LBPRGKRZSA-N 1 2 246.354 2.163 20 0 BEADLO Fc1ccc(CN2CCn3cc[nH+]c3C2)c(F)c1 ZINC000334418418 353102045 /nfs/dbraw/zinc/10/20/45/353102045.db2.gz YOTFTBZSUGDZQI-UHFFFAOYSA-N 1 2 249.264 2.177 20 0 BEADLO Cc1ncc(C[N@@H+]2CCO[C@H](C(C)C)C2)s1 ZINC000334418846 353102570 /nfs/dbraw/zinc/10/25/70/353102570.db2.gz RYMPAXGIRBWPJE-LBPRGKRZSA-N 1 2 240.372 2.308 20 0 BEADLO Cc1ncc(C[N@H+]2CCO[C@H](C(C)C)C2)s1 ZINC000334418846 353102573 /nfs/dbraw/zinc/10/25/73/353102573.db2.gz RYMPAXGIRBWPJE-LBPRGKRZSA-N 1 2 240.372 2.308 20 0 BEADLO C[C@@H](Nc1cncc(Cl)n1)c1[nH]cc[nH+]1 ZINC000229339903 353126337 /nfs/dbraw/zinc/12/63/37/353126337.db2.gz YRTVMHPGSZRIEF-ZCFIWIBFSA-N 1 2 223.667 2.026 20 0 BEADLO CC(C)c1nc(N2CC([C@H]3CCOC3)C2)cc[nH+]1 ZINC000366493109 188019868 /nfs/dbraw/zinc/01/98/68/188019868.db2.gz NVFVNVOZEOWJJU-NSHDSACASA-N 1 2 247.342 2.073 20 0 BEADLO CC(C)(CCO)CNc1cc[nH+]c(C2CC2)n1 ZINC000266209380 188022754 /nfs/dbraw/zinc/02/27/54/188022754.db2.gz MEFAPTGPVVJYCU-UHFFFAOYSA-N 1 2 235.331 2.175 20 0 BEADLO C[C@H](CCC(C)(C)C)C(=O)NCc1[nH]cc[nH+]1 ZINC000273520316 188026833 /nfs/dbraw/zinc/02/68/33/188026833.db2.gz PWVILNJGLPVTMD-SNVBAGLBSA-N 1 2 237.347 2.488 20 0 BEADLO C/C=C/C=C/C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000299488342 188041849 /nfs/dbraw/zinc/04/18/49/188041849.db2.gz FFLXRUIGELHRQD-MQQKCMAXSA-N 1 2 245.326 2.179 20 0 BEADLO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2cnc[nH]2)C1 ZINC000336351804 188054882 /nfs/dbraw/zinc/05/48/82/188054882.db2.gz JGGXJIQKHOSDMJ-RISCZKNCSA-N 1 2 242.326 2.388 20 0 BEADLO Cc1cc(N(C)Cc2cc[nH]n2)nc(C2CC2)[nH+]1 ZINC000329331679 538108907 /nfs/dbraw/zinc/10/89/07/538108907.db2.gz MNFIEFLNNVUVFV-UHFFFAOYSA-N 1 2 243.314 2.022 20 0 BEADLO CC1(CNC(=O)CCc2c[nH+]c[nH]2)CCCCC1 ZINC000279705028 538110192 /nfs/dbraw/zinc/11/01/92/538110192.db2.gz ADQSGHALQRRHPX-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO CC1(CNC(=O)CCc2c[nH]c[nH+]2)CCCCC1 ZINC000279705028 538110193 /nfs/dbraw/zinc/11/01/93/538110193.db2.gz ADQSGHALQRRHPX-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO CC(C)(C)c1nc(C[NH+]2CCCCC2)no1 ZINC000058472021 323984974 /nfs/dbraw/zinc/98/49/74/323984974.db2.gz WIEGOTXSRDJCQK-UHFFFAOYSA-N 1 2 223.320 2.353 20 0 BEADLO COc1ccc[nH+]c1NCCC[C@@H]1CCOC1 ZINC000402292369 353234686 /nfs/dbraw/zinc/23/46/86/353234686.db2.gz NKEDSCWFYYGKSP-LLVKDONJSA-N 1 2 236.315 2.319 20 0 BEADLO O=C(CC1CCC1)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000608125937 353270476 /nfs/dbraw/zinc/27/04/76/353270476.db2.gz LNVKVBHEYPOPOB-ZDUSSCGKSA-N 1 2 247.342 2.237 20 0 BEADLO O=C(CC1CCC1)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000608125936 353270513 /nfs/dbraw/zinc/27/05/13/353270513.db2.gz LNVKVBHEYPOPOB-CYBMUJFWSA-N 1 2 247.342 2.237 20 0 BEADLO Cc1nc(CN(C)c2cc(C)[nH+]cn2)cs1 ZINC000301225941 188233036 /nfs/dbraw/zinc/23/30/36/188233036.db2.gz DNXAKUIHOOUQCY-UHFFFAOYSA-N 1 2 234.328 2.186 20 0 BEADLO CC(C)N(C)c1[nH+]cnc2c1cnn2C(C)(C)C ZINC000301902028 188233162 /nfs/dbraw/zinc/23/31/62/188233162.db2.gz WALMIZIHMHGUCY-UHFFFAOYSA-N 1 2 247.346 2.426 20 0 BEADLO CCOC(=O)c1coc(CNc2cccc[nH+]2)c1 ZINC000354175852 188235526 /nfs/dbraw/zinc/23/55/26/188235526.db2.gz TXRJENIAERCMCF-UHFFFAOYSA-N 1 2 246.266 2.463 20 0 BEADLO CC(C)[C@H](NC(=O)C[C@H]1C[C@H]1C)c1[nH]cc[nH+]1 ZINC000355973432 188237882 /nfs/dbraw/zinc/23/78/82/188237882.db2.gz PWLHJONPCCVBSG-FOGDFJRCSA-N 1 2 235.331 2.269 20 0 BEADLO CC1(C)CCC(C(=O)Nc2cc[nH+]cc2O)CC1 ZINC000358334904 188240412 /nfs/dbraw/zinc/24/04/12/188240412.db2.gz HZBIUGNPAHEQDJ-UHFFFAOYSA-N 1 2 248.326 2.364 20 0 BEADLO COC[C@H](Nc1ccc(OC)c[nH+]1)C(C)C ZINC000225836271 538114353 /nfs/dbraw/zinc/11/43/53/538114353.db2.gz KXNRFDOZFFAHGQ-NSHDSACASA-N 1 2 224.304 2.173 20 0 BEADLO Cc1cc(N(C)[C@@H]2CCC[C@@H]2O)nc(C(C)C)[nH+]1 ZINC000343272432 353294829 /nfs/dbraw/zinc/29/48/29/353294829.db2.gz UGHJQSIBWHLTEL-NEPJUHHUSA-N 1 2 249.358 2.258 20 0 BEADLO CC(C)[N@H+](CC(F)F)C[C@H](O)C(C)(C)C ZINC000308831231 188279519 /nfs/dbraw/zinc/27/95/19/188279519.db2.gz UCLNKYCFGSAUPV-VIFPVBQESA-N 1 2 223.307 2.369 20 0 BEADLO CC(C)[N@@H+](CC(F)F)C[C@H](O)C(C)(C)C ZINC000308831231 188279520 /nfs/dbraw/zinc/27/95/20/188279520.db2.gz UCLNKYCFGSAUPV-VIFPVBQESA-N 1 2 223.307 2.369 20 0 BEADLO CC1(C)C[C@H]1C(=O)NCCCNc1cccc[nH+]1 ZINC000152732397 188332940 /nfs/dbraw/zinc/33/29/40/188332940.db2.gz BJAKSZVOVSBZJA-NSHDSACASA-N 1 2 247.342 2.046 20 0 BEADLO Cc1cc(NCC(C)(C)CO)nc(C2CC2)[nH+]1 ZINC000135598684 538115664 /nfs/dbraw/zinc/11/56/64/538115664.db2.gz NTDVGOXPOXEYAY-UHFFFAOYSA-N 1 2 235.331 2.093 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@H](C3CC3)C2)sn1 ZINC000639060462 353373524 /nfs/dbraw/zinc/37/35/24/353373524.db2.gz HLMFOCIWXWZUQS-LBPRGKRZSA-N 1 2 238.356 2.062 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@H](C3CC3)C2)sn1 ZINC000639060462 353373526 /nfs/dbraw/zinc/37/35/26/353373526.db2.gz HLMFOCIWXWZUQS-LBPRGKRZSA-N 1 2 238.356 2.062 20 0 BEADLO CC(C)[C@@H]1C[C@H]1C(=O)Nc1ccc[nH+]c1N(C)C ZINC000186090951 188348162 /nfs/dbraw/zinc/34/81/62/188348162.db2.gz PAICNFXLRWJIEO-WDEREUQCSA-N 1 2 247.342 2.378 20 0 BEADLO C=Cn1cc(C[NH2+][C@@H](COC)c2ccco2)cn1 ZINC000194351444 188351576 /nfs/dbraw/zinc/35/15/76/188351576.db2.gz DKANCQNHJALDHL-LBPRGKRZSA-N 1 2 247.298 2.054 20 0 BEADLO CC=C(C=CC(=O)NCc1[nH]c[nH+]c1C)CC ZINC000268928994 188373830 /nfs/dbraw/zinc/37/38/30/188373830.db2.gz SGNDWDWIZXCOFW-IFQIRGPMSA-N 1 2 233.315 2.247 20 0 BEADLO Cc1ccnc(C[N@@H+](C)[C@H](C)c2ccncc2)n1 ZINC000336719299 188358983 /nfs/dbraw/zinc/35/89/83/188358983.db2.gz VSNDPZLPURFKHG-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1ccnc(C[N@H+](C)[C@H](C)c2ccncc2)n1 ZINC000336719299 188358985 /nfs/dbraw/zinc/35/89/85/188358985.db2.gz VSNDPZLPURFKHG-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO CC(C)[C@@H]1CCCN1c1nc[nH+]c(N)c1Cl ZINC000232728563 188365090 /nfs/dbraw/zinc/36/50/90/188365090.db2.gz SMXPLLQTAKVXBT-QMMMGPOBSA-N 1 2 240.738 2.337 20 0 BEADLO CC(C)[C@@H]1CCCN1c1[nH+]cnc(N)c1Cl ZINC000232728563 188365092 /nfs/dbraw/zinc/36/50/92/188365092.db2.gz SMXPLLQTAKVXBT-QMMMGPOBSA-N 1 2 240.738 2.337 20 0 BEADLO Cc1cnc([C@@H](C)Nc2cc(C)[nH+]cn2)o1 ZINC000226547946 538116602 /nfs/dbraw/zinc/11/66/02/538116602.db2.gz IRAVYVCVXJMPGA-SECBINFHSA-N 1 2 218.260 2.255 20 0 BEADLO C1=C[C@@H]([N@@H+]2CCc3n[nH]nc3C2)CCCCC1 ZINC000339118941 188367213 /nfs/dbraw/zinc/36/72/13/188367213.db2.gz NZKZPKINRMXRIO-LLVKDONJSA-N 1 2 232.331 2.052 20 0 BEADLO C1=C[C@@H]([N@H+]2CCc3n[nH]nc3C2)CCCCC1 ZINC000339118941 188367214 /nfs/dbraw/zinc/36/72/14/188367214.db2.gz NZKZPKINRMXRIO-LLVKDONJSA-N 1 2 232.331 2.052 20 0 BEADLO CC(C)[C@H](NC(=O)CC1(C)CC1)c1[nH]cc[nH+]1 ZINC000338880213 188367218 /nfs/dbraw/zinc/36/72/18/188367218.db2.gz LOIBHANUEUZOAF-NSHDSACASA-N 1 2 235.331 2.413 20 0 BEADLO C/C(=C\c1ccccc1)C[NH2+][C@]1(C)CCOC1=O ZINC000289412441 188388883 /nfs/dbraw/zinc/38/88/83/188388883.db2.gz AJTKCDHVELDQSX-HBIYDYFMSA-N 1 2 245.322 2.385 20 0 BEADLO Cc1nc(N2CC(C)(C)[C@@H]2C2CC2)cc[nH+]1 ZINC000290629393 188389201 /nfs/dbraw/zinc/38/92/01/188389201.db2.gz GYWMZUKTICUPDI-LBPRGKRZSA-N 1 2 217.316 2.410 20 0 BEADLO CC(C)(CC(=O)N1CCn2c[nH+]cc2C1)C1CC1 ZINC000294623618 188391906 /nfs/dbraw/zinc/39/19/06/188391906.db2.gz IPDJIHJLZZZUTL-UHFFFAOYSA-N 1 2 247.342 2.052 20 0 BEADLO CC(C)C1(C[N@@H+]2C[C@H](O)CC(F)(F)C2)CC1 ZINC000639095581 353475548 /nfs/dbraw/zinc/47/55/48/353475548.db2.gz QFYDNMYIFINEOA-SNVBAGLBSA-N 1 2 233.302 2.125 20 0 BEADLO CC(C)C1(C[N@H+]2C[C@H](O)CC(F)(F)C2)CC1 ZINC000639095581 353475550 /nfs/dbraw/zinc/47/55/50/353475550.db2.gz QFYDNMYIFINEOA-SNVBAGLBSA-N 1 2 233.302 2.125 20 0 BEADLO CC[C@H]([NH2+]CCC[C@@H]1CCO1)C(F)(F)F ZINC000639093781 353476546 /nfs/dbraw/zinc/47/65/46/353476546.db2.gz AMGAVNUNLROQGV-BDAKNGLRSA-N 1 2 225.254 2.486 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]CCc1ccccc1O ZINC000180391034 538117694 /nfs/dbraw/zinc/11/76/94/538117694.db2.gz KYUBSTSMCPBAIQ-JTQLQIEISA-N 1 2 245.326 2.317 20 0 BEADLO CCC[C@@H](CC)NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000577862737 366089467 /nfs/dbraw/zinc/08/94/67/366089467.db2.gz HKLVEXZLXWLDAX-WDEREUQCSA-N 1 2 237.347 2.283 20 0 BEADLO CCC[C@@H](CC)NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000577862737 366089480 /nfs/dbraw/zinc/08/94/80/366089480.db2.gz HKLVEXZLXWLDAX-WDEREUQCSA-N 1 2 237.347 2.283 20 0 BEADLO CCC[C@@H]([NH2+]Cc1c[nH]nn1)C1CCCC1 ZINC000398404683 363232447 /nfs/dbraw/zinc/23/24/47/363232447.db2.gz OKNOCTRJCOUBFN-GFCCVEGCSA-N 1 2 222.336 2.253 20 0 BEADLO CCC[C@@H]([NH2+]Cc1cn[nH]n1)C1CCCC1 ZINC000398404683 363232452 /nfs/dbraw/zinc/23/24/52/363232452.db2.gz OKNOCTRJCOUBFN-GFCCVEGCSA-N 1 2 222.336 2.253 20 0 BEADLO CO[C@@H]1CC[C@H](NC(=O)Nc2cc[nH+]c(C)c2)C1 ZINC000189754252 353534455 /nfs/dbraw/zinc/53/44/55/353534455.db2.gz YPUCUQFRVVFJDF-CMPLNLGQSA-N 1 2 249.314 2.079 20 0 BEADLO CC(C)(C)n1cc(CNc2cc[nH+]cc2F)nn1 ZINC000192150417 353545248 /nfs/dbraw/zinc/54/52/48/353545248.db2.gz OIBLBUXKGFKLRU-UHFFFAOYSA-N 1 2 249.293 2.179 20 0 BEADLO Cc1cc(N2CCC[C@](C)(O)CC2)c(C#N)c[nH+]1 ZINC000399003428 353551080 /nfs/dbraw/zinc/55/10/80/353551080.db2.gz VEGBGLBLOFIJMY-AWEZNQCLSA-N 1 2 245.326 2.003 20 0 BEADLO Cc1cnc(C[NH2+]C[C@H]2CCCCN2C2CC2)o1 ZINC000639108351 353649022 /nfs/dbraw/zinc/64/90/22/353649022.db2.gz XWZXIDHMCVFDIL-CYBMUJFWSA-N 1 2 249.358 2.090 20 0 BEADLO C[C@H](CC(=O)Nc1ccc(F)cn1)n1cc[nH+]c1 ZINC000577876337 366094304 /nfs/dbraw/zinc/09/43/04/366094304.db2.gz UVLTVCIMHNUUDN-SECBINFHSA-N 1 2 248.261 2.007 20 0 BEADLO Fc1cccc(CN2CCn3c[nH+]cc3C2)c1 ZINC000291704138 180996092 /nfs/dbraw/zinc/99/60/92/180996092.db2.gz ZGXPULQJRNDUHA-UHFFFAOYSA-N 1 2 231.274 2.038 20 0 BEADLO Fc1cccc(OCCn2cc[nH+]c2)c1 ZINC000041214509 181002533 /nfs/dbraw/zinc/00/25/33/181002533.db2.gz NTUKMSPUCUXMLV-UHFFFAOYSA-N 1 2 206.220 2.101 20 0 BEADLO Cc1cc(NC[C@H]2CC[C@H](O)C2)nc(C(C)C)[nH+]1 ZINC000232764457 353760666 /nfs/dbraw/zinc/76/06/66/353760666.db2.gz RDEQILBKHIMRNN-RYUDHWBXSA-N 1 2 249.358 2.481 20 0 BEADLO CCCN(Cc1c[nH+]cn1CC)CC(F)F ZINC000417755918 353767255 /nfs/dbraw/zinc/76/72/55/353767255.db2.gz YHFPVNOHXNZGBW-UHFFFAOYSA-N 1 2 231.290 2.380 20 0 BEADLO C[C@H]1COCCC[N@@H+]1Cc1cc(F)ccc1C#N ZINC000399071315 353825662 /nfs/dbraw/zinc/82/56/62/353825662.db2.gz IAIKGJJNFQLARC-NSHDSACASA-N 1 2 248.301 2.308 20 0 BEADLO C[C@H]1COCCC[N@H+]1Cc1cc(F)ccc1C#N ZINC000399071315 353825664 /nfs/dbraw/zinc/82/56/64/353825664.db2.gz IAIKGJJNFQLARC-NSHDSACASA-N 1 2 248.301 2.308 20 0 BEADLO Fc1c[nH+]ccc1NCc1cccnc1 ZINC000308874418 181021208 /nfs/dbraw/zinc/02/12/08/181021208.db2.gz MOUXQJKCOHPXTO-UHFFFAOYSA-N 1 2 203.220 2.228 20 0 BEADLO CO[C@H](C[NH2+]C1(C(F)F)CC1)CC(C)C ZINC000639140295 353848824 /nfs/dbraw/zinc/84/88/24/353848824.db2.gz VANVNOHSOGBNSR-VIFPVBQESA-N 1 2 221.291 2.435 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CCSC(C)(C)C2)[nH]1 ZINC000334547125 353984895 /nfs/dbraw/zinc/98/48/95/353984895.db2.gz DTZLENMOTYDQGC-QMMMGPOBSA-N 1 2 240.376 2.002 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CCSC(C)(C)C2)[nH]1 ZINC000334547125 353984898 /nfs/dbraw/zinc/98/48/98/353984898.db2.gz DTZLENMOTYDQGC-QMMMGPOBSA-N 1 2 240.376 2.002 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1ccc2c(n1)CCC2 ZINC000334552462 353993133 /nfs/dbraw/zinc/99/31/33/353993133.db2.gz BKACNECVCFBXEB-AWEZNQCLSA-N 1 2 246.354 2.181 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1ccc2c(n1)CCC2 ZINC000334552462 353993135 /nfs/dbraw/zinc/99/31/35/353993135.db2.gz BKACNECVCFBXEB-AWEZNQCLSA-N 1 2 246.354 2.181 20 0 BEADLO Cc1nc(C[N@H+]2CCO[C@@H](C)[C@@H]2C)sc1C ZINC000178585220 366143096 /nfs/dbraw/zinc/14/30/96/366143096.db2.gz ZSYNOTRUKROHLN-UWVGGRQHSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nc(C[N@@H+]2CCO[C@@H](C)[C@@H]2C)sc1C ZINC000178585220 366143100 /nfs/dbraw/zinc/14/31/00/366143100.db2.gz ZSYNOTRUKROHLN-UWVGGRQHSA-N 1 2 240.372 2.369 20 0 BEADLO C[C@H]1CC[C@@H]1Nc1cc(N2CCCC2)nc[nH+]1 ZINC000343809357 354011150 /nfs/dbraw/zinc/01/11/50/354011150.db2.gz OJFCHBKIHOBZNS-QWRGUYRKSA-N 1 2 232.331 2.287 20 0 BEADLO C[C@H]1CC[C@@H]1Nc1cc(N2CCCC2)[nH+]cn1 ZINC000343809357 354011153 /nfs/dbraw/zinc/01/11/53/354011153.db2.gz OJFCHBKIHOBZNS-QWRGUYRKSA-N 1 2 232.331 2.287 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@H]2CC=CCC2)no1 ZINC000344072957 354132691 /nfs/dbraw/zinc/13/26/91/354132691.db2.gz SNROVWXBIBTDQG-NSHDSACASA-N 1 2 221.304 2.166 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@H]2CC=CCC2)no1 ZINC000344072957 354132692 /nfs/dbraw/zinc/13/26/92/354132692.db2.gz SNROVWXBIBTDQG-NSHDSACASA-N 1 2 221.304 2.166 20 0 BEADLO CCC[C@@H](C)[N@@H+]1CCOCC(F)(F)C1 ZINC000344078013 354134529 /nfs/dbraw/zinc/13/45/29/354134529.db2.gz XDSUKUPEDQVTPW-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CCC[C@@H](C)[N@H+]1CCOCC(F)(F)C1 ZINC000344078013 354134531 /nfs/dbraw/zinc/13/45/31/354134531.db2.gz XDSUKUPEDQVTPW-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1CCO[C@H](C)C1 ZINC000334568961 354093776 /nfs/dbraw/zinc/09/37/76/354093776.db2.gz GTLMBVOZYLMINP-ZYHUDNBSSA-N 1 2 248.326 2.452 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1CCO[C@H](C)C1 ZINC000334568960 354093944 /nfs/dbraw/zinc/09/39/44/354093944.db2.gz GTLMBVOZYLMINP-PWSUYJOCSA-N 1 2 248.326 2.452 20 0 BEADLO CC(C)c1nc(N2CC(CF)C2)cc[nH+]1 ZINC000334577431 354120281 /nfs/dbraw/zinc/12/02/81/354120281.db2.gz DYRSRABWMMUBMA-UHFFFAOYSA-N 1 2 209.268 2.006 20 0 BEADLO Cc1cccc(NC(=O)CCc2[nH]cc[nH+]2)c1 ZINC000344167552 354169822 /nfs/dbraw/zinc/16/98/22/354169822.db2.gz DIJALBJXPOYZKN-UHFFFAOYSA-N 1 2 229.283 2.289 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CCC(F)(F)[C@@H](C)C2)[nH]1 ZINC000334580762 354196985 /nfs/dbraw/zinc/19/69/85/354196985.db2.gz AZGONDBBFQAAAH-JGVFFNPUSA-N 1 2 244.289 2.151 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CCC(F)(F)[C@@H](C)C2)[nH]1 ZINC000334580762 354196989 /nfs/dbraw/zinc/19/69/89/354196989.db2.gz AZGONDBBFQAAAH-JGVFFNPUSA-N 1 2 244.289 2.151 20 0 BEADLO Cc1nc(N2CC(CF)C2)c2c([nH+]1)CCCC2 ZINC000334582778 354202919 /nfs/dbraw/zinc/20/29/19/354202919.db2.gz WZEQDOGGELVGQI-UHFFFAOYSA-N 1 2 235.306 2.070 20 0 BEADLO CC1=CC[N@H+](Cc2nnc(C(C)(C)C)[nH]2)CC1 ZINC000334598952 354234602 /nfs/dbraw/zinc/23/46/02/354234602.db2.gz CTPHJXRBLHDBDY-UHFFFAOYSA-N 1 2 234.347 2.254 20 0 BEADLO CC1=CC[N@@H+](Cc2nnc(C(C)(C)C)[nH]2)CC1 ZINC000334598952 354234606 /nfs/dbraw/zinc/23/46/06/354234606.db2.gz CTPHJXRBLHDBDY-UHFFFAOYSA-N 1 2 234.347 2.254 20 0 BEADLO CCc1[nH+]c(C)ccc1OCC[C@@H](C)O ZINC000232204104 363365591 /nfs/dbraw/zinc/36/55/91/363365591.db2.gz RYACIYMUYBKWLE-SNVBAGLBSA-N 1 2 209.289 2.102 20 0 BEADLO CC[C@@]1(C)CCN(C(=O)Nc2cc[nH+]cc2C)C1 ZINC000334614167 354298950 /nfs/dbraw/zinc/29/89/50/354298950.db2.gz WYPFUTSXPXEOKR-AWEZNQCLSA-N 1 2 247.342 2.466 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CCCc3occc3C2)[nH]1 ZINC000334641616 354397151 /nfs/dbraw/zinc/39/71/51/354397151.db2.gz CZXRCWLMVMXAQX-VIFPVBQESA-N 1 2 246.314 2.216 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](Cc1cccnc1N)C2 ZINC000334623451 354361896 /nfs/dbraw/zinc/36/18/96/354361896.db2.gz NXNLPSWQMQVMNV-UHFFFAOYSA-N 1 2 239.322 2.488 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](Cc1cccnc1N)C2 ZINC000334623451 354361897 /nfs/dbraw/zinc/36/18/97/354361897.db2.gz NXNLPSWQMQVMNV-UHFFFAOYSA-N 1 2 239.322 2.488 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CCCc3occc3C2)[nH]1 ZINC000334641616 354397153 /nfs/dbraw/zinc/39/71/53/354397153.db2.gz CZXRCWLMVMXAQX-VIFPVBQESA-N 1 2 246.314 2.216 20 0 BEADLO Cc1[nH]c2ccc(NC(=O)c3cc[nH]c3)cc2[nH+]1 ZINC000344784182 354367951 /nfs/dbraw/zinc/36/79/51/354367951.db2.gz AZVQIMAEIGVFRM-UHFFFAOYSA-N 1 2 240.266 2.452 20 0 BEADLO Cc1[nH]c2cc(NC(=O)c3cc[nH]c3)ccc2[nH+]1 ZINC000344784182 354367952 /nfs/dbraw/zinc/36/79/52/354367952.db2.gz AZVQIMAEIGVFRM-UHFFFAOYSA-N 1 2 240.266 2.452 20 0 BEADLO Cc1cc(N2C[C@H](C3CC3)[C@H]2C2CC2)nc[nH+]1 ZINC000334688381 354434322 /nfs/dbraw/zinc/43/43/22/354434322.db2.gz ZUPCCPICEDMIQA-TZMCWYRMSA-N 1 2 229.327 2.410 20 0 BEADLO CC1(CO)C[NH+](Cc2cc(Cl)cs2)C1 ZINC000334643938 354401638 /nfs/dbraw/zinc/40/16/38/354401638.db2.gz BLAWDMXEFOTRLO-UHFFFAOYSA-N 1 2 231.748 2.216 20 0 BEADLO O[C@H]1C[C@H](c2ccccc2)N(c2cccc[nH+]2)C1 ZINC000334644872 354403947 /nfs/dbraw/zinc/40/39/47/354403947.db2.gz KLRFTBDXNRNTOB-UONOGXRCSA-N 1 2 240.306 2.394 20 0 BEADLO Cc1nc(C[N@@H+]2CCCO[C@@H](CF)C2)cs1 ZINC000334648287 354439674 /nfs/dbraw/zinc/43/96/74/354439674.db2.gz VHDKNYGANXTCGL-NSHDSACASA-N 1 2 244.335 2.012 20 0 BEADLO Cc1nc(C[N@H+]2CCCO[C@@H](CF)C2)cs1 ZINC000334648287 354439677 /nfs/dbraw/zinc/43/96/77/354439677.db2.gz VHDKNYGANXTCGL-NSHDSACASA-N 1 2 244.335 2.012 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCSC[C@H]1C1CC1 ZINC000334679667 354424867 /nfs/dbraw/zinc/42/48/67/354424867.db2.gz UDTOBZRRVQIKCD-LBPRGKRZSA-N 1 2 237.372 2.046 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCSC[C@H]1C1CC1 ZINC000334679667 354424869 /nfs/dbraw/zinc/42/48/69/354424869.db2.gz UDTOBZRRVQIKCD-LBPRGKRZSA-N 1 2 237.372 2.046 20 0 BEADLO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1cocn1)CO2 ZINC000578074694 366221770 /nfs/dbraw/zinc/22/17/70/366221770.db2.gz XTMVFJQGWSQHJX-LBPRGKRZSA-N 1 2 230.267 2.206 20 0 BEADLO Cc1cncc(C[N@@H+]2CCC[C@@H]2c2ncc[nH]2)c1 ZINC000334749636 354474807 /nfs/dbraw/zinc/47/48/07/354474807.db2.gz GKXMCQXAHQYTNV-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cncc(C[N@H+]2CCC[C@@H]2c2ncc[nH]2)c1 ZINC000334749636 354474808 /nfs/dbraw/zinc/47/48/08/354474808.db2.gz GKXMCQXAHQYTNV-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cc(NC(=O)N2CC[C@@H]2C(C)C)cc[nH+]1 ZINC000334692784 354483206 /nfs/dbraw/zinc/48/32/06/354483206.db2.gz CVPDRUOTHQRPKE-GFCCVEGCSA-N 1 2 233.315 2.074 20 0 BEADLO C[C@H]1C[C@H](NC(=O)C2(C)CCC2)c2[nH+]ccn21 ZINC000334752012 354483488 /nfs/dbraw/zinc/48/34/88/354483488.db2.gz OAPZMQTXAWEOPZ-UWVGGRQHSA-N 1 2 233.315 2.195 20 0 BEADLO C[C@@H]1C[C@H]1CC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000334731046 354531425 /nfs/dbraw/zinc/53/14/25/354531425.db2.gz KQLVLECBNQEZQP-ZJUUUORDSA-N 1 2 229.283 2.319 20 0 BEADLO Cc1cc(N[C@@H]2CC[C@H](F)C2)nc(C2CC2)[nH+]1 ZINC000334739067 354542301 /nfs/dbraw/zinc/54/23/01/354542301.db2.gz LATNACPYPVIYJK-WDEREUQCSA-N 1 2 235.306 2.387 20 0 BEADLO CC[C@H]1C[N@H+](Cc2nccc(C)n2)CCS1 ZINC000334699772 354491963 /nfs/dbraw/zinc/49/19/63/354491963.db2.gz STHQEHDGGGRGIM-NSHDSACASA-N 1 2 237.372 2.112 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2nccc(C)n2)CCS1 ZINC000334699772 354491964 /nfs/dbraw/zinc/49/19/64/354491964.db2.gz STHQEHDGGGRGIM-NSHDSACASA-N 1 2 237.372 2.112 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2ccncc2Cl)C1 ZINC000334700420 354492998 /nfs/dbraw/zinc/49/29/98/354492998.db2.gz IJIRLGACCYDMAY-SECBINFHSA-N 1 2 214.671 2.279 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2ccncc2Cl)C1 ZINC000334700420 354492999 /nfs/dbraw/zinc/49/29/99/354492999.db2.gz IJIRLGACCYDMAY-SECBINFHSA-N 1 2 214.671 2.279 20 0 BEADLO Cc1nc(N2CC(C)(C)C[C@H]2C)cc[nH+]1 ZINC000334714920 354513532 /nfs/dbraw/zinc/51/35/32/354513532.db2.gz JSZPCIBHVRKIMT-SECBINFHSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1cc(C(=O)N[C@@H]2C[C@H](C)n3cc[nH+]c32)co1 ZINC000334716346 354514683 /nfs/dbraw/zinc/51/46/83/354514683.db2.gz XPNPPRJFLRMILF-GZMMTYOYSA-N 1 2 245.282 2.220 20 0 BEADLO Cc1cc(C)c(CNC(=O)N2CCC[C@@H]2C)c[nH+]1 ZINC000334717914 354517009 /nfs/dbraw/zinc/51/70/09/354517009.db2.gz ASGWWXTWLVJFEY-LBPRGKRZSA-N 1 2 247.342 2.392 20 0 BEADLO CN(c1[nH+]c2ccccc2n1C)[C@H]1CCCOC1 ZINC000334797358 354551820 /nfs/dbraw/zinc/55/18/20/354551820.db2.gz XULQUDDSYHMJRD-NSHDSACASA-N 1 2 245.326 2.189 20 0 BEADLO C[C@H]1C[C@@H](Nc2cc[nH+]c3ccncc23)CS1 ZINC000334805570 354561841 /nfs/dbraw/zinc/56/18/41/354561841.db2.gz KTKGZXSVFWBZGG-VHSXEESVSA-N 1 2 245.351 2.358 20 0 BEADLO Cc1ccc(C(=O)N[C@H]2C[C@@H](C)n3cc[nH+]c32)o1 ZINC000334743779 354547662 /nfs/dbraw/zinc/54/76/62/354547662.db2.gz MUNSHDIDFZMJSO-SCZZXKLOSA-N 1 2 245.282 2.220 20 0 BEADLO CC(C)CC(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000334743791 354547756 /nfs/dbraw/zinc/54/77/56/354547756.db2.gz NADHBEBYZVILIZ-UWVGGRQHSA-N 1 2 221.304 2.051 20 0 BEADLO Cc1ccc(N[C@@H]2CCCOC2)c(C)[nH+]1 ZINC000087151756 491065980 /nfs/dbraw/zinc/06/59/80/491065980.db2.gz HZHCSDMYDWFTII-LLVKDONJSA-N 1 2 206.289 2.289 20 0 BEADLO Cc1cc(C)c(CNC(=O)[C@@]2(C)C[C@@H]2F)c[nH+]1 ZINC000335091222 354627453 /nfs/dbraw/zinc/62/74/53/354627453.db2.gz LOCGZJHRIAOVIF-AAEUAGOBSA-N 1 2 236.290 2.063 20 0 BEADLO C[C@]1(C(=O)Nc2cccc3[nH+]ccn32)C[C@H]1F ZINC000335094782 354633285 /nfs/dbraw/zinc/63/32/85/354633285.db2.gz KNBQAPABADCGSG-PELKAZGASA-N 1 2 233.246 2.021 20 0 BEADLO C[NH2+]Cc1noc([C@H]2CCCC[C@H]2C)n1 ZINC000335080472 354643202 /nfs/dbraw/zinc/64/32/02/354643202.db2.gz WWVGJFQLSLDOQI-BDAKNGLRSA-N 1 2 209.293 2.083 20 0 BEADLO Cc1scc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)c1C ZINC000639201527 354605965 /nfs/dbraw/zinc/60/59/65/354605965.db2.gz KGQYXTSJSBVQPR-NWDGAFQWSA-N 1 2 223.341 2.338 20 0 BEADLO Cc1scc(C[N@H+]2CCO[C@@H]3C[C@@H]32)c1C ZINC000639201527 354605968 /nfs/dbraw/zinc/60/59/68/354605968.db2.gz KGQYXTSJSBVQPR-NWDGAFQWSA-N 1 2 223.341 2.338 20 0 BEADLO CC1CCC(CC(=O)NCCc2[nH]cc[nH+]2)CC1 ZINC000345342270 354618866 /nfs/dbraw/zinc/61/88/66/354618866.db2.gz NLNOJMQOWOCANT-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C(=O)N1CCn2cc[nH+]c2C1 ZINC000335089480 354624164 /nfs/dbraw/zinc/62/41/64/354624164.db2.gz GUZLHUHYUMJBHI-NEPJUHHUSA-N 1 2 247.342 2.052 20 0 BEADLO C[C@@H]1CN(C(=O)CCc2[nH]cc[nH+]2)CC(C)(C)C1 ZINC000335105220 354689392 /nfs/dbraw/zinc/68/93/92/354689392.db2.gz VKGRYUWXDDCUHC-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO CC(C)n1cncc1C[N@@H+]1CCO[C@@H]2CCC[C@@H]21 ZINC000335112152 354698548 /nfs/dbraw/zinc/69/85/48/354698548.db2.gz UHIJHEQAUFGTMT-UONOGXRCSA-N 1 2 249.358 2.217 20 0 BEADLO CC(C)n1cncc1C[N@H+]1CCO[C@@H]2CCC[C@@H]21 ZINC000335112152 354698549 /nfs/dbraw/zinc/69/85/49/354698549.db2.gz UHIJHEQAUFGTMT-UONOGXRCSA-N 1 2 249.358 2.217 20 0 BEADLO CC(C)n1c[nH+]cc1CN1CCO[C@@H]2CCC[C@@H]21 ZINC000335112152 354698550 /nfs/dbraw/zinc/69/85/50/354698550.db2.gz UHIJHEQAUFGTMT-UONOGXRCSA-N 1 2 249.358 2.217 20 0 BEADLO CCC[C@@H](C)CC(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000345606342 354728456 /nfs/dbraw/zinc/72/84/56/354728456.db2.gz IRFZQJXUPNCFIC-VXGBXAGGSA-N 1 2 237.347 2.214 20 0 BEADLO CCc1noc(C)c1C[NH2+]Cc1ncc(C)o1 ZINC000639206095 354675773 /nfs/dbraw/zinc/67/57/73/354675773.db2.gz PTDUPBKRQWWZAM-UHFFFAOYSA-N 1 2 235.287 2.132 20 0 BEADLO FC1(F)CC[N@H+](CCCCCn2cccn2)C1 ZINC000345801732 354774926 /nfs/dbraw/zinc/77/49/26/354774926.db2.gz FPLQEWOZOHGDJA-UHFFFAOYSA-N 1 2 243.301 2.394 20 0 BEADLO FC1(F)CC[N@@H+](CCCCCn2cccn2)C1 ZINC000345801732 354774929 /nfs/dbraw/zinc/77/49/29/354774929.db2.gz FPLQEWOZOHGDJA-UHFFFAOYSA-N 1 2 243.301 2.394 20 0 BEADLO c1cc(C[NH2+][C@@H]2CCCNc3ccccc32)[nH]n1 ZINC000335133096 354780086 /nfs/dbraw/zinc/78/00/86/354780086.db2.gz CCGIYXTXSMMZAM-CQSZACIVSA-N 1 2 242.326 2.446 20 0 BEADLO CCc1noc([C@@H](C)[N@@H+]2CC[C@](C)(F)C2)n1 ZINC000335940436 134017434 /nfs/dbraw/zinc/01/74/34/134017434.db2.gz HPNULLPGYSWVML-KCJUWKMLSA-N 1 2 227.283 2.127 20 0 BEADLO CCc1noc([C@@H](C)[N@H+]2CC[C@](C)(F)C2)n1 ZINC000335940436 134017435 /nfs/dbraw/zinc/01/74/35/134017435.db2.gz HPNULLPGYSWVML-KCJUWKMLSA-N 1 2 227.283 2.127 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccc(CO)cc1)C(F)F ZINC000639214728 354826026 /nfs/dbraw/zinc/82/60/26/354826026.db2.gz RRSVXSXQDUWRLF-LLVKDONJSA-N 1 2 229.270 2.312 20 0 BEADLO CCc1cnc(C[N@H+](CCOC)C2CC2)s1 ZINC000346201903 354875912 /nfs/dbraw/zinc/87/59/12/354875912.db2.gz IAJVESCMUFIORV-UHFFFAOYSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1cnc(C[N@@H+](CCOC)C2CC2)s1 ZINC000346201903 354875916 /nfs/dbraw/zinc/87/59/16/354875916.db2.gz IAJVESCMUFIORV-UHFFFAOYSA-N 1 2 240.372 2.316 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)CC2CCC2)c2[nH+]ccn21 ZINC000335141166 354845239 /nfs/dbraw/zinc/84/52/39/354845239.db2.gz OZLUBJGRRRDKJF-MWLCHTKSSA-N 1 2 233.315 2.195 20 0 BEADLO CC[C@@H](C)CN(C)C(=O)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000346303774 354891484 /nfs/dbraw/zinc/89/14/84/354891484.db2.gz MJYFKESZYCPALQ-GHMZBOCLSA-N 1 2 249.358 2.334 20 0 BEADLO Cc1nc(N2CCC[C@@H]2C2CCOCC2)cc[nH+]1 ZINC000346258574 354882219 /nfs/dbraw/zinc/88/22/19/354882219.db2.gz ICANRMMXGGOXLJ-CYBMUJFWSA-N 1 2 247.342 2.180 20 0 BEADLO Fc1cccc2c1C[N@H+](CCn1cccn1)C2 ZINC000335165971 354923014 /nfs/dbraw/zinc/92/30/14/354923014.db2.gz IGAUKSMBUVLFBR-UHFFFAOYSA-N 1 2 231.274 2.038 20 0 BEADLO Fc1cccc2c1C[N@@H+](CCn1cccn1)C2 ZINC000335165971 354923018 /nfs/dbraw/zinc/92/30/18/354923018.db2.gz IGAUKSMBUVLFBR-UHFFFAOYSA-N 1 2 231.274 2.038 20 0 BEADLO Cc1cc(N2CC(C)(C)[C@H]2C2CC2)nc[nH+]1 ZINC000335166358 354924060 /nfs/dbraw/zinc/92/40/60/354924060.db2.gz MZOAPRYJDWJATQ-GFCCVEGCSA-N 1 2 217.316 2.410 20 0 BEADLO CCN(C(=O)CCc1[nH]cc[nH+]1)C1CC(C)(C)C1 ZINC000412815291 191314001 /nfs/dbraw/zinc/31/40/01/191314001.db2.gz UTNKJHTYCHQTRF-UHFFFAOYSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H]1CC=C(C(=O)N(C)Cc2[nH+]ccn2C)CC1 ZINC000335163867 354949885 /nfs/dbraw/zinc/94/98/85/354949885.db2.gz LVWJOGJXMHOYFQ-LLVKDONJSA-N 1 2 247.342 2.125 20 0 BEADLO F[C@H]1CCCN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000335206783 355042924 /nfs/dbraw/zinc/04/29/24/355042924.db2.gz KHNAOXNEXYPJCE-JTQLQIEISA-N 1 2 221.279 2.292 20 0 BEADLO CC(C)C(C)(C)c1nc(Cc2c[nH+]cn2C)no1 ZINC000346935907 355182570 /nfs/dbraw/zinc/18/25/70/355182570.db2.gz FXDGBIYVORXTIJ-UHFFFAOYSA-N 1 2 248.330 2.328 20 0 BEADLO C[C@@H]1C[C@H](C)N(c2cc(NC3CC3)[nH+]cn2)C1 ZINC000413157548 191356755 /nfs/dbraw/zinc/35/67/55/191356755.db2.gz UNHPRXMFLKZTNM-ZJUUUORDSA-N 1 2 232.331 2.286 20 0 BEADLO C[C@@H]1C[C@H](C)N(c2cc(NC3CC3)nc[nH+]2)C1 ZINC000413157548 191356756 /nfs/dbraw/zinc/35/67/56/191356756.db2.gz UNHPRXMFLKZTNM-ZJUUUORDSA-N 1 2 232.331 2.286 20 0 BEADLO CSCCCSCCn1cc[nH+]c1 ZINC000413008475 191338861 /nfs/dbraw/zinc/33/88/61/191338861.db2.gz NXQGGRICWISTAP-UHFFFAOYSA-N 1 2 216.375 2.369 20 0 BEADLO Cc1cccc([C@H](C)[N@H+](C)Cc2nncn2C)c1 ZINC000347631319 355241757 /nfs/dbraw/zinc/24/17/57/355241757.db2.gz BXBUOOYJICBWHX-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cccc([C@H](C)[N@@H+](C)Cc2nncn2C)c1 ZINC000347631319 355241759 /nfs/dbraw/zinc/24/17/59/355241759.db2.gz BXBUOOYJICBWHX-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO C[C@@H]1C[C@H]1CNc1cc(NC2CC2)nc[nH+]1 ZINC000413055403 191351056 /nfs/dbraw/zinc/35/10/56/191351056.db2.gz QUZYLLHYJOYJJV-BDAKNGLRSA-N 1 2 218.304 2.119 20 0 BEADLO C[C@@H]1C[C@H]1CNc1cc(NC2CC2)[nH+]cn1 ZINC000413055403 191351059 /nfs/dbraw/zinc/35/10/59/191351059.db2.gz QUZYLLHYJOYJJV-BDAKNGLRSA-N 1 2 218.304 2.119 20 0 BEADLO COC1([C@H](C)Nc2cc[nH+]c(C(C)C)n2)CCC1 ZINC000413554674 191395992 /nfs/dbraw/zinc/39/59/92/191395992.db2.gz CEFLYKIQOUTSJJ-NSHDSACASA-N 1 2 249.358 2.391 20 0 BEADLO c1nc(N2CC[C@@H](C3CC3)C2)cc(NC2CC2)[nH+]1 ZINC000413216369 191364301 /nfs/dbraw/zinc/36/43/01/191364301.db2.gz RNUSPYMVQOVWRM-LLVKDONJSA-N 1 2 244.342 2.287 20 0 BEADLO c1nc(NC2CC2)cc(N2CC[C@@H](C3CC3)C2)[nH+]1 ZINC000413216369 191364304 /nfs/dbraw/zinc/36/43/04/191364304.db2.gz RNUSPYMVQOVWRM-LLVKDONJSA-N 1 2 244.342 2.287 20 0 BEADLO CC1=C[C@@H](C)CN(c2cc(NC3CC3)[nH+]cn2)C1 ZINC000413278458 191365735 /nfs/dbraw/zinc/36/57/35/191365735.db2.gz YWTGEZAGLIKDNP-SNVBAGLBSA-N 1 2 244.342 2.453 20 0 BEADLO CC1=C[C@@H](C)CN(c2cc(NC3CC3)nc[nH+]2)C1 ZINC000413278458 191365737 /nfs/dbraw/zinc/36/57/37/191365737.db2.gz YWTGEZAGLIKDNP-SNVBAGLBSA-N 1 2 244.342 2.453 20 0 BEADLO CC1=CCCN(c2cc(NC3CC3)[nH+]cn2)C1 ZINC000413258424 191367172 /nfs/dbraw/zinc/36/71/72/191367172.db2.gz AEFCYLYZMLCHMM-UHFFFAOYSA-N 1 2 230.315 2.207 20 0 BEADLO CC1=CCCN(c2cc(NC3CC3)nc[nH+]2)C1 ZINC000413258424 191367175 /nfs/dbraw/zinc/36/71/75/191367175.db2.gz AEFCYLYZMLCHMM-UHFFFAOYSA-N 1 2 230.315 2.207 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@H](C)CC(F)F ZINC000413275862 191368299 /nfs/dbraw/zinc/36/82/99/191368299.db2.gz BUKHQCJWTKJISX-SSDOTTSWSA-N 1 2 244.241 2.320 20 0 BEADLO C[C@H]1CC[C@H]1Nc1cc(NC2CC2)[nH+]cn1 ZINC000413300009 191370087 /nfs/dbraw/zinc/37/00/87/191370087.db2.gz VMLAGISTFNMUGA-WCBMZHEXSA-N 1 2 218.304 2.261 20 0 BEADLO C[C@H]1CC[C@H]1Nc1cc(NC2CC2)nc[nH+]1 ZINC000413300009 191370089 /nfs/dbraw/zinc/37/00/89/191370089.db2.gz VMLAGISTFNMUGA-WCBMZHEXSA-N 1 2 218.304 2.261 20 0 BEADLO C[C@H]1CC[C@@H]1Nc1cc(NC2CC2)[nH+]cn1 ZINC000413300011 191370613 /nfs/dbraw/zinc/37/06/13/191370613.db2.gz VMLAGISTFNMUGA-WPRPVWTQSA-N 1 2 218.304 2.261 20 0 BEADLO C[C@H]1CC[C@@H]1Nc1cc(NC2CC2)nc[nH+]1 ZINC000413300011 191370616 /nfs/dbraw/zinc/37/06/16/191370616.db2.gz VMLAGISTFNMUGA-WPRPVWTQSA-N 1 2 218.304 2.261 20 0 BEADLO CC/C=C\CNc1cc(NC2CC2)[nH+]cn1 ZINC000413323519 191372495 /nfs/dbraw/zinc/37/24/95/191372495.db2.gz YKBZXMUGSVDMKT-ARJAWSKDSA-N 1 2 218.304 2.429 20 0 BEADLO CC/C=C\CNc1cc(NC2CC2)nc[nH+]1 ZINC000413323519 191372498 /nfs/dbraw/zinc/37/24/98/191372498.db2.gz YKBZXMUGSVDMKT-ARJAWSKDSA-N 1 2 218.304 2.429 20 0 BEADLO CCC(C)(C)OCCNc1cc[nH+]c(C2CC2)n1 ZINC000413378129 191377138 /nfs/dbraw/zinc/37/71/38/191377138.db2.gz YKYCGQGRLSMGIH-UHFFFAOYSA-N 1 2 249.358 2.393 20 0 BEADLO CC(C)c1nc(NC[C@H]2CC[C@@H](C)O2)cc[nH+]1 ZINC000413379417 191377286 /nfs/dbraw/zinc/37/72/86/191377286.db2.gz RMHMJENGRPGKEM-GHMZBOCLSA-N 1 2 235.331 2.001 20 0 BEADLO CC(C)O[C@H]1C[C@@H](Nc2cc[nH+]c(C3CC3)n2)C1 ZINC000413387504 191378041 /nfs/dbraw/zinc/37/80/41/191378041.db2.gz OBHRIMJZMRVLGM-TXEJJXNPSA-N 1 2 247.342 2.144 20 0 BEADLO CO[C@@H]1C[C@H](Nc2cc[nH+]c(C)n2)C12CCC2 ZINC000413435307 191380428 /nfs/dbraw/zinc/38/04/28/191380428.db2.gz FNFXCIINDVGTCO-WDEREUQCSA-N 1 2 233.315 2.155 20 0 BEADLO CO[C@H]1C[C@@H](Nc2cc[nH+]c(C)n2)C12CCC2 ZINC000413435302 191380700 /nfs/dbraw/zinc/38/07/00/191380700.db2.gz FNFXCIINDVGTCO-MNOVXSKESA-N 1 2 233.315 2.155 20 0 BEADLO Cc1ccc2cc(C[NH+]3CC(C)(O)C3)[nH]c2c1 ZINC000639253272 355290139 /nfs/dbraw/zinc/29/01/39/355290139.db2.gz CEQYZMMCVCTHSZ-UHFFFAOYSA-N 1 2 230.311 2.043 20 0 BEADLO CC(C)n1ncnc1C[NH+]1CC(C2CCCC2)C1 ZINC000639253616 355292168 /nfs/dbraw/zinc/29/21/68/355292168.db2.gz CJIUZXRXFBGJAE-UHFFFAOYSA-N 1 2 248.374 2.481 20 0 BEADLO COc1ccc[nH+]c1N[C@@H](C)[C@H]1CCCOC1 ZINC000388856713 355301914 /nfs/dbraw/zinc/30/19/14/355301914.db2.gz GRVXFGGBPBVBDB-QWRGUYRKSA-N 1 2 236.315 2.317 20 0 BEADLO CCOC1C[NH+](Cc2cc3ccccc3n2C)C1 ZINC000639249409 355278702 /nfs/dbraw/zinc/27/87/02/355278702.db2.gz AMCPSWAAGLZZOB-UHFFFAOYSA-N 1 2 244.338 2.399 20 0 BEADLO Cc1ncc([C@@H](C)[NH+]2CC(C(F)F)C2)c(C)n1 ZINC000639252940 355287034 /nfs/dbraw/zinc/28/70/34/355287034.db2.gz WLIYSRLPFYDCFL-MRVPVSSYSA-N 1 2 241.285 2.351 20 0 BEADLO FC(F)CC1C[NH+](Cc2ccns2)C1 ZINC000639278510 355363716 /nfs/dbraw/zinc/36/37/16/355363716.db2.gz LXLMQELUIIXXKX-UHFFFAOYSA-N 1 2 218.272 2.230 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)[C@@H]1CCCS1 ZINC000608363939 355379168 /nfs/dbraw/zinc/37/91/68/355379168.db2.gz KGAFXBZCMZLNAX-JTQLQIEISA-N 1 2 247.323 2.168 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3n[nH]cc3C2)ccc1F ZINC000623238002 355380156 /nfs/dbraw/zinc/38/01/56/355380156.db2.gz RAUFVZPADITZKP-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1cc(C[N@H+]2CCc3n[nH]cc3C2)ccc1F ZINC000623238002 355380158 /nfs/dbraw/zinc/38/01/58/355380158.db2.gz RAUFVZPADITZKP-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO C[C@H](N[C@@H](c1[nH+]ccn1C)C1CC1)C(F)(F)F ZINC000639276839 355353488 /nfs/dbraw/zinc/35/34/88/355353488.db2.gz GSMXOHFHYWPNAX-IONNQARKSA-N 1 2 247.264 2.412 20 0 BEADLO CC(C)c1nc(N[C@@H](C)c2csnn2)cc[nH+]1 ZINC000582168595 355410540 /nfs/dbraw/zinc/41/05/40/355410540.db2.gz JHUMEJXHAOZNLF-QMMMGPOBSA-N 1 2 249.343 2.047 20 0 BEADLO FC1(F)CCC[N@H+](CCC[C@H]2CCO2)C1 ZINC000639287912 355399023 /nfs/dbraw/zinc/39/90/23/355399023.db2.gz GESUKJXLSQSOHL-JTQLQIEISA-N 1 2 219.275 2.287 20 0 BEADLO FC1(F)CCC[N@@H+](CCC[C@H]2CCO2)C1 ZINC000639287912 355399025 /nfs/dbraw/zinc/39/90/25/355399025.db2.gz GESUKJXLSQSOHL-JTQLQIEISA-N 1 2 219.275 2.287 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCCc2c1cnn2C)c1ccon1 ZINC000349830957 355487785 /nfs/dbraw/zinc/48/77/85/355487785.db2.gz GMLSQDIPJAGAKY-SKDRFNHKSA-N 1 2 246.314 2.136 20 0 BEADLO CCn1cc([C@H](C)[NH2+][C@@H](C)c2ccon2)cn1 ZINC000349833791 355489100 /nfs/dbraw/zinc/48/91/00/355489100.db2.gz LSHSUJZLSMTJNB-UWVGGRQHSA-N 1 2 234.303 2.303 20 0 BEADLO CCc1cc[nH+]cc1N[C@@H](C)Cc1cnccn1 ZINC000639293508 355533473 /nfs/dbraw/zinc/53/34/73/355533473.db2.gz CVLFVLXXGLZWHG-NSHDSACASA-N 1 2 242.326 2.477 20 0 BEADLO CCn1cc(C[NH+]2CC3(CCC3(F)F)C2)cn1 ZINC000335821685 355541057 /nfs/dbraw/zinc/54/10/57/355541057.db2.gz AIGMPFWBXMMEIK-UHFFFAOYSA-N 1 2 241.285 2.134 20 0 BEADLO CC1(CC(=O)N2CCC[C@@H](c3[nH]cc[nH+]3)C2)CC1 ZINC000335822504 355542931 /nfs/dbraw/zinc/54/29/31/355542931.db2.gz NKZZCVQDHMZVDW-LLVKDONJSA-N 1 2 247.342 2.306 20 0 BEADLO CC(C)[C@@H]1CN(c2cc[nH+]c(C3CC3)n2)CCO1 ZINC000349884863 355518243 /nfs/dbraw/zinc/51/82/43/355518243.db2.gz XTBUDSRDNAOAMF-LBPRGKRZSA-N 1 2 247.342 2.215 20 0 BEADLO Cc1cc(NC/C=C\c2ccccc2)nc[nH+]1 ZINC000349916660 355525785 /nfs/dbraw/zinc/52/57/85/355525785.db2.gz PWVLOIDXOZMBCJ-YVMONPNESA-N 1 2 225.295 2.332 20 0 BEADLO Cc1ccnc(C[N@@H+](C)[C@H]2CC2(C)C)n1 ZINC000335848621 355592966 /nfs/dbraw/zinc/59/29/66/355592966.db2.gz YLIXABQBUQHIDZ-JTQLQIEISA-N 1 2 205.305 2.015 20 0 BEADLO Cc1ccnc(C[N@H+](C)[C@H]2CC2(C)C)n1 ZINC000335848621 355592971 /nfs/dbraw/zinc/59/29/71/355592971.db2.gz YLIXABQBUQHIDZ-JTQLQIEISA-N 1 2 205.305 2.015 20 0 BEADLO CCOC1CC(CNc2cc3cc[nH]c3c[nH+]2)C1 ZINC000639296186 355593210 /nfs/dbraw/zinc/59/32/10/355593210.db2.gz MKPKWQKBOXBLKN-UHFFFAOYSA-N 1 2 245.326 2.212 20 0 BEADLO c1nc(N[C@@H]2C[C@H]3C[C@H]3C2)cc(NC2CC2)[nH+]1 ZINC000425294553 191688067 /nfs/dbraw/zinc/68/80/67/191688067.db2.gz DFYXDPXQAMUDCX-DOFRTFSJSA-N 1 2 230.315 2.261 20 0 BEADLO c1nc(NC2CC2)cc(N[C@@H]2C[C@H]3C[C@H]3C2)[nH+]1 ZINC000425294553 191688069 /nfs/dbraw/zinc/68/80/69/191688069.db2.gz DFYXDPXQAMUDCX-DOFRTFSJSA-N 1 2 230.315 2.261 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cc(C)ns2)[C@@H](C)CO1 ZINC000639298616 355613398 /nfs/dbraw/zinc/61/33/98/355613398.db2.gz ZZHRLVSJTFKBCV-QWRGUYRKSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cc(C)ns2)[C@@H](C)CO1 ZINC000639298616 355613402 /nfs/dbraw/zinc/61/34/02/355613402.db2.gz ZZHRLVSJTFKBCV-QWRGUYRKSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1ccc(CSc2nc[nH]n2)c(C)[nH+]1 ZINC000335873177 355640783 /nfs/dbraw/zinc/64/07/83/355640783.db2.gz AEQFNMCHSZLARB-UHFFFAOYSA-N 1 2 220.301 2.109 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+]2CC[C@](C)(F)C2)cn1 ZINC000335876782 355646925 /nfs/dbraw/zinc/64/69/25/355646925.db2.gz MWAVJUVFAQITLO-PWSUYJOCSA-N 1 2 223.295 2.280 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+]2CC[C@](C)(F)C2)cn1 ZINC000335876782 355646928 /nfs/dbraw/zinc/64/69/28/355646928.db2.gz MWAVJUVFAQITLO-PWSUYJOCSA-N 1 2 223.295 2.280 20 0 BEADLO CC(C)C1(C[N@@H+]2CC[C@H](O)C(F)(F)C2)CC1 ZINC000639311692 355670969 /nfs/dbraw/zinc/67/09/69/355670969.db2.gz VLGFMHUSTIQIQY-JTQLQIEISA-N 1 2 233.302 2.125 20 0 BEADLO CC(C)C1(C[N@H+]2CC[C@H](O)C(F)(F)C2)CC1 ZINC000639311692 355670970 /nfs/dbraw/zinc/67/09/70/355670970.db2.gz VLGFMHUSTIQIQY-JTQLQIEISA-N 1 2 233.302 2.125 20 0 BEADLO NC(=O)C[NH+]1CC(c2nc3ccccc3s2)C1 ZINC000336352508 181202618 /nfs/dbraw/zinc/20/26/18/181202618.db2.gz KDTHYQIHRKTTTP-UHFFFAOYSA-N 1 2 247.323 2.231 20 0 BEADLO CCc1nocc1C[N@H+]1C[C@@H](C)OC[C@H]1CC ZINC000350240535 355654839 /nfs/dbraw/zinc/65/48/39/355654839.db2.gz LYLQYJIJTUJHII-ZYHUDNBSSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1nocc1C[N@@H+]1C[C@@H](C)OC[C@H]1CC ZINC000350240535 355654843 /nfs/dbraw/zinc/65/48/43/355654843.db2.gz LYLQYJIJTUJHII-ZYHUDNBSSA-N 1 2 238.331 2.236 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NCC1CC(C)(C)C1 ZINC000583574054 355656735 /nfs/dbraw/zinc/65/67/35/355656735.db2.gz MVJSRPDEOOPGQK-JTQLQIEISA-N 1 2 249.358 2.141 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NCC1CC(C)(C)C1 ZINC000583574054 355656737 /nfs/dbraw/zinc/65/67/37/355656737.db2.gz MVJSRPDEOOPGQK-JTQLQIEISA-N 1 2 249.358 2.141 20 0 BEADLO O=C(CC1CC1)Nc1ccc(-n2cc[nH+]c2)nc1 ZINC000029021935 355656804 /nfs/dbraw/zinc/65/68/04/355656804.db2.gz NDASFEOTOLLRJW-UHFFFAOYSA-N 1 2 242.282 2.006 20 0 BEADLO F[C@H]1CCC[N@H+](Cc2ccns2)C1 ZINC000639311748 355671982 /nfs/dbraw/zinc/67/19/82/355671982.db2.gz CSAGUIJQGQVJFX-QMMMGPOBSA-N 1 2 200.282 2.077 20 0 BEADLO F[C@H]1CCC[N@@H+](Cc2ccns2)C1 ZINC000639311748 355671984 /nfs/dbraw/zinc/67/19/84/355671984.db2.gz CSAGUIJQGQVJFX-QMMMGPOBSA-N 1 2 200.282 2.077 20 0 BEADLO Cn1ccnc1[C@@H](C1CC1)[N@@H+]1CCC[C@@H](F)C1 ZINC000639313835 355693614 /nfs/dbraw/zinc/69/36/14/355693614.db2.gz ZGQCTHURFAWDFJ-VXGBXAGGSA-N 1 2 237.322 2.305 20 0 BEADLO Cn1ccnc1[C@@H](C1CC1)[N@H+]1CCC[C@@H](F)C1 ZINC000639313835 355693617 /nfs/dbraw/zinc/69/36/17/355693617.db2.gz ZGQCTHURFAWDFJ-VXGBXAGGSA-N 1 2 237.322 2.305 20 0 BEADLO CCc1ncc(C[NH2+][C@@H](C)c2cscn2)cn1 ZINC000582192960 355695261 /nfs/dbraw/zinc/69/52/61/355695261.db2.gz YXFXMCFBVIEFPK-VIFPVBQESA-N 1 2 248.355 2.346 20 0 BEADLO NC(=O)c1cccc(C[N@@H+]2CC[C@@H](F)C2)c1 ZINC000336222792 181206858 /nfs/dbraw/zinc/20/68/58/181206858.db2.gz KQZNTQPJGKLKPU-LLVKDONJSA-N 1 2 222.263 2.114 20 0 BEADLO NC(=O)c1cccc(C[N@H+]2CC[C@@H](F)C2)c1 ZINC000336222792 181206859 /nfs/dbraw/zinc/20/68/59/181206859.db2.gz KQZNTQPJGKLKPU-LLVKDONJSA-N 1 2 222.263 2.114 20 0 BEADLO CCC[N@H+](C)Cc1nc([C@](C)(CC)OC)no1 ZINC000350427294 355703898 /nfs/dbraw/zinc/70/38/98/355703898.db2.gz CIYOWXBFMPDUKS-LBPRGKRZSA-N 1 2 241.335 2.183 20 0 BEADLO CCC[N@@H+](C)Cc1nc([C@](C)(CC)OC)no1 ZINC000350427294 355703899 /nfs/dbraw/zinc/70/38/99/355703899.db2.gz CIYOWXBFMPDUKS-LBPRGKRZSA-N 1 2 241.335 2.183 20 0 BEADLO Cn1ncc2c1C[N@H+](C[C@@]1(C)CCCS1)C2 ZINC000639319282 355711340 /nfs/dbraw/zinc/71/13/40/355711340.db2.gz FOECKGBJFJNACW-GFCCVEGCSA-N 1 2 237.372 2.021 20 0 BEADLO Cn1ncc2c1C[N@@H+](C[C@@]1(C)CCCS1)C2 ZINC000639319282 355711341 /nfs/dbraw/zinc/71/13/41/355711341.db2.gz FOECKGBJFJNACW-GFCCVEGCSA-N 1 2 237.372 2.021 20 0 BEADLO NC(=O)[C@H](c1ccccc1)[N@@H+]1CC[C@H](F)C1 ZINC000336261187 181205186 /nfs/dbraw/zinc/20/51/86/181205186.db2.gz SCPBHFKBQXDWNW-QWRGUYRKSA-N 1 2 222.263 2.307 20 0 BEADLO NC(=O)[C@H](c1ccccc1)[N@H+]1CC[C@H](F)C1 ZINC000336261187 181205188 /nfs/dbraw/zinc/20/51/88/181205188.db2.gz SCPBHFKBQXDWNW-QWRGUYRKSA-N 1 2 222.263 2.307 20 0 BEADLO C[C@@H]1C[C@H]1CC(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000336002558 134047494 /nfs/dbraw/zinc/04/74/94/134047494.db2.gz NYEXSBWJYSMMCZ-NEPJUHHUSA-N 1 2 247.342 2.093 20 0 BEADLO C[C@@H]([NH2+]Cc1ncccn1)c1cccc(O)c1 ZINC000191431878 355682598 /nfs/dbraw/zinc/68/25/98/355682598.db2.gz VZYYGRRMQQSRJF-SNVBAGLBSA-N 1 2 229.283 2.033 20 0 BEADLO COc1cc(C[N@@H+]2CCC[C@H](F)C2)sn1 ZINC000639312755 355684383 /nfs/dbraw/zinc/68/43/83/355684383.db2.gz JGDRLKPFUMZYNB-QMMMGPOBSA-N 1 2 230.308 2.086 20 0 BEADLO COc1cc(C[N@H+]2CCC[C@H](F)C2)sn1 ZINC000639312755 355684386 /nfs/dbraw/zinc/68/43/86/355684386.db2.gz JGDRLKPFUMZYNB-QMMMGPOBSA-N 1 2 230.308 2.086 20 0 BEADLO Nc1c(F)cccc1C[N@@H+]1CCC[C@H](F)C1 ZINC000639312898 355684586 /nfs/dbraw/zinc/68/45/86/355684586.db2.gz KQXRRHKVGRUGIG-JTQLQIEISA-N 1 2 226.270 2.342 20 0 BEADLO Nc1c(F)cccc1C[N@H+]1CCC[C@H](F)C1 ZINC000639312898 355684590 /nfs/dbraw/zinc/68/45/90/355684590.db2.gz KQXRRHKVGRUGIG-JTQLQIEISA-N 1 2 226.270 2.342 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@@H](CCF)C2)sn1 ZINC000639352361 355801537 /nfs/dbraw/zinc/80/15/37/355801537.db2.gz INKILBMQLZAPFW-JTQLQIEISA-N 1 2 244.335 2.012 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@@H](CCF)C2)sn1 ZINC000639352361 355801541 /nfs/dbraw/zinc/80/15/41/355801541.db2.gz INKILBMQLZAPFW-JTQLQIEISA-N 1 2 244.335 2.012 20 0 BEADLO C[C@H]1CCCC[C@@H]1CNC(=O)CCc1[nH]cc[nH+]1 ZINC000352059245 134054421 /nfs/dbraw/zinc/05/44/21/134054421.db2.gz HJZRFUOKNXPQSC-NWDGAFQWSA-N 1 2 249.358 2.285 20 0 BEADLO CCOC1CC(Nc2c[nH+]cc(N(C)C)c2)C1 ZINC000639364389 355834098 /nfs/dbraw/zinc/83/40/98/355834098.db2.gz HYSUJPUTRBYXSS-UHFFFAOYSA-N 1 2 235.331 2.127 20 0 BEADLO CC1CC(Nc2c[nH+]cc(N(C)C)c2)C1 ZINC000639364287 355834216 /nfs/dbraw/zinc/83/42/16/355834216.db2.gz HJBLTRVBIAOYKL-UHFFFAOYSA-N 1 2 205.305 2.358 20 0 BEADLO CN(C)c1c[nH+]cc(N[C@@H]2CCSC2)c1 ZINC000639364730 355836713 /nfs/dbraw/zinc/83/67/13/355836713.db2.gz IPNBZWOFPBYQAA-SECBINFHSA-N 1 2 223.345 2.065 20 0 BEADLO Cc1cc2c(c(C)c1)[C@H]([NH2+]Cc1c[nH]nn1)CC2 ZINC000628363256 355847134 /nfs/dbraw/zinc/84/71/34/355847134.db2.gz CVKDBIVDNXQGKM-CYBMUJFWSA-N 1 2 242.326 2.199 20 0 BEADLO C[C@@H]1[C@H]([NH2+]Cc2cn[nH]n2)C[C@@H]1c1ccccc1 ZINC000628363758 355850068 /nfs/dbraw/zinc/85/00/68/355850068.db2.gz XACAIWAJHNWYLU-LEWSCRJBSA-N 1 2 242.326 2.087 20 0 BEADLO Cc1cn[nH]c1C[NH+]1CC(c2ccccc2F)C1 ZINC000336031619 134058123 /nfs/dbraw/zinc/05/81/23/134058123.db2.gz BZRNJXDMZCWUDO-UHFFFAOYSA-N 1 2 245.301 2.457 20 0 BEADLO Cc1c[nH]nc1C[NH+]1CC(c2ccccc2F)C1 ZINC000336031619 134058124 /nfs/dbraw/zinc/05/81/24/134058124.db2.gz BZRNJXDMZCWUDO-UHFFFAOYSA-N 1 2 245.301 2.457 20 0 BEADLO C[C@H]1C[C@H](Nc2c[nH+]cc(N(C)C)c2)CCO1 ZINC000639364058 355832744 /nfs/dbraw/zinc/83/27/44/355832744.db2.gz GMOMQIUXXZAXTD-WDEREUQCSA-N 1 2 235.331 2.127 20 0 BEADLO CC(C)C1(CNC(=O)[C@H](C)Cc2c[nH+]c[nH]2)CC1 ZINC000583639557 355940434 /nfs/dbraw/zinc/94/04/34/355940434.db2.gz KELREHKYCLQJSI-LLVKDONJSA-N 1 2 249.358 2.141 20 0 BEADLO CC(C)C1(CNC(=O)[C@H](C)Cc2c[nH]c[nH+]2)CC1 ZINC000583639557 355940438 /nfs/dbraw/zinc/94/04/38/355940438.db2.gz KELREHKYCLQJSI-LLVKDONJSA-N 1 2 249.358 2.141 20 0 BEADLO CCC[N@H+](CCc1cnn(CC)c1)CC(F)F ZINC000351470886 355996651 /nfs/dbraw/zinc/99/66/51/355996651.db2.gz GJQPPSVLCRZURK-UHFFFAOYSA-N 1 2 245.317 2.423 20 0 BEADLO CCC[N@@H+](CCc1cnn(CC)c1)CC(F)F ZINC000351470886 355996654 /nfs/dbraw/zinc/99/66/54/355996654.db2.gz GJQPPSVLCRZURK-UHFFFAOYSA-N 1 2 245.317 2.423 20 0 BEADLO Cc1nc([C@H](C)[N@H+](C)CC2CCC2)no1 ZINC000351489874 355999625 /nfs/dbraw/zinc/99/96/25/355999625.db2.gz IKHFFPMQGBSZQR-QMMMGPOBSA-N 1 2 209.293 2.171 20 0 BEADLO Cc1nc([C@H](C)[N@@H+](C)CC2CCC2)no1 ZINC000351489874 355999631 /nfs/dbraw/zinc/99/96/31/355999631.db2.gz IKHFFPMQGBSZQR-QMMMGPOBSA-N 1 2 209.293 2.171 20 0 BEADLO Cc1nc([C@@H](C)[N@H+](C)CC2CCC2)no1 ZINC000351489873 355999878 /nfs/dbraw/zinc/99/98/78/355999878.db2.gz IKHFFPMQGBSZQR-MRVPVSSYSA-N 1 2 209.293 2.171 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+](C)CC2CCC2)no1 ZINC000351489873 355999880 /nfs/dbraw/zinc/99/98/80/355999880.db2.gz IKHFFPMQGBSZQR-MRVPVSSYSA-N 1 2 209.293 2.171 20 0 BEADLO C[C@@H](NC(=O)CC1CC(C)(C)C1)c1[nH]cc[nH+]1 ZINC000583641331 355947005 /nfs/dbraw/zinc/94/70/05/355947005.db2.gz MVIAGGAJHSUYCY-SECBINFHSA-N 1 2 235.331 2.413 20 0 BEADLO CC(C)[N@@H+]1C[C@H](C)O[C@H](C(F)(F)F)C1 ZINC000608751172 355964171 /nfs/dbraw/zinc/96/41/71/355964171.db2.gz XSCWACQSHFYURQ-YUMQZZPRSA-N 1 2 211.227 2.046 20 0 BEADLO CC(C)[N@H+]1C[C@H](C)O[C@H](C(F)(F)F)C1 ZINC000608751172 355964173 /nfs/dbraw/zinc/96/41/73/355964173.db2.gz XSCWACQSHFYURQ-YUMQZZPRSA-N 1 2 211.227 2.046 20 0 BEADLO COc1cc(C[NH+]2CC(C(F)(F)F)C2)ccn1 ZINC000582222225 355965007 /nfs/dbraw/zinc/96/50/07/355965007.db2.gz QOBMBSQYWMXAQG-UHFFFAOYSA-N 1 2 246.232 2.084 20 0 BEADLO Cc1nnc(C[N@@H+]2CC[C@H](CC(F)(F)F)C2)o1 ZINC000351635137 356038315 /nfs/dbraw/zinc/03/83/15/356038315.db2.gz OSYBCCNIAMZUIG-MRVPVSSYSA-N 1 2 249.236 2.152 20 0 BEADLO Cc1nnc(C[N@H+]2CC[C@H](CC(F)(F)F)C2)o1 ZINC000351635137 356038317 /nfs/dbraw/zinc/03/83/17/356038317.db2.gz OSYBCCNIAMZUIG-MRVPVSSYSA-N 1 2 249.236 2.152 20 0 BEADLO CC(C)n1cc(C[NH+]2CCC(C)(F)CC2)nn1 ZINC000639389209 356011758 /nfs/dbraw/zinc/01/17/58/356011758.db2.gz UIFXRJRBJHXLIC-UHFFFAOYSA-N 1 2 240.326 2.183 20 0 BEADLO CCC(C)(C)[C@@H](C)NC(=O)CCc1[nH]cc[nH+]1 ZINC000617568517 356123714 /nfs/dbraw/zinc/12/37/14/356123714.db2.gz DVQLVIFLERAZAV-SNVBAGLBSA-N 1 2 237.347 2.283 20 0 BEADLO O=C(CCCn1cc[nH+]c1)NCc1ccsc1 ZINC000623258661 356080403 /nfs/dbraw/zinc/08/04/03/356080403.db2.gz WVRGQHYJXMTUFA-UHFFFAOYSA-N 1 2 249.339 2.041 20 0 BEADLO CC[N@H+](Cc1cnc(C)nc1)Cc1ccccn1 ZINC000351864666 356100846 /nfs/dbraw/zinc/10/08/46/356100846.db2.gz SSTIKISEOJOQJI-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO CC[N@@H+](Cc1cnc(C)nc1)Cc1ccccn1 ZINC000351864666 356100850 /nfs/dbraw/zinc/10/08/50/356100850.db2.gz SSTIKISEOJOQJI-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO CCc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cn1 ZINC000335916428 356157605 /nfs/dbraw/zinc/15/76/05/356157605.db2.gz YJCSYCAPWPSVEP-VXGBXAGGSA-N 1 2 234.343 2.253 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccsc2)C[C@H](C)[S@@]1=O ZINC000336089303 134077929 /nfs/dbraw/zinc/07/79/29/134077929.db2.gz YJKDWADJQZINSX-KEODLESXSA-N 1 2 243.397 2.089 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccsc2)C[C@H](C)[S@@]1=O ZINC000336089303 134077930 /nfs/dbraw/zinc/07/79/30/134077930.db2.gz YJKDWADJQZINSX-KEODLESXSA-N 1 2 243.397 2.089 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]CCC(F)(F)F ZINC000134579076 491087569 /nfs/dbraw/zinc/08/75/69/491087569.db2.gz WODRNMKJXCJMCY-ZCFIWIBFSA-N 1 2 221.226 2.321 20 0 BEADLO Cc1c(C[N@@H+]2CCn3cccc3[C@@H]2C)cnn1C ZINC000335918829 356165641 /nfs/dbraw/zinc/16/56/41/356165641.db2.gz BCFOFILXQQYLEC-LBPRGKRZSA-N 1 2 244.342 2.107 20 0 BEADLO Cc1c(C[N@H+]2CCn3cccc3[C@@H]2C)cnn1C ZINC000335918829 356165642 /nfs/dbraw/zinc/16/56/42/356165642.db2.gz BCFOFILXQQYLEC-LBPRGKRZSA-N 1 2 244.342 2.107 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](Cc1cncn1C)C2 ZINC000336086412 134076570 /nfs/dbraw/zinc/07/65/70/134076570.db2.gz ZUANTLWOASKSSI-UHFFFAOYSA-N 1 2 227.311 2.244 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](Cc1cncn1C)C2 ZINC000336086412 134076571 /nfs/dbraw/zinc/07/65/71/134076571.db2.gz ZUANTLWOASKSSI-UHFFFAOYSA-N 1 2 227.311 2.244 20 0 BEADLO Cc1ccc2c(c1)CN(Cc1c[nH+]cn1C)C2 ZINC000336086412 134076572 /nfs/dbraw/zinc/07/65/72/134076572.db2.gz ZUANTLWOASKSSI-UHFFFAOYSA-N 1 2 227.311 2.244 20 0 BEADLO COCC[N@H+](Cc1ncc(Cl)s1)C1CC1 ZINC000351888720 356150627 /nfs/dbraw/zinc/15/06/27/356150627.db2.gz XHOUAMKOOGTCIK-UHFFFAOYSA-N 1 2 246.763 2.407 20 0 BEADLO COCC[N@@H+](Cc1ncc(Cl)s1)C1CC1 ZINC000351888720 356150630 /nfs/dbraw/zinc/15/06/30/356150630.db2.gz XHOUAMKOOGTCIK-UHFFFAOYSA-N 1 2 246.763 2.407 20 0 BEADLO CC(=O)C[N@H+](Cc1ccccc1F)C1CC1 ZINC000639434265 356211853 /nfs/dbraw/zinc/21/18/53/356211853.db2.gz HNOPSWRNVRORRL-UHFFFAOYSA-N 1 2 221.275 2.379 20 0 BEADLO CC(=O)C[N@@H+](Cc1ccccc1F)C1CC1 ZINC000639434265 356211855 /nfs/dbraw/zinc/21/18/55/356211855.db2.gz HNOPSWRNVRORRL-UHFFFAOYSA-N 1 2 221.275 2.379 20 0 BEADLO Cc1nnc(C[N@H+]2Cc3ccccc3C[C@@H]2C)[nH]1 ZINC000336111042 134086429 /nfs/dbraw/zinc/08/64/29/134086429.db2.gz NDUILHVIBBFRMG-JTQLQIEISA-N 1 2 242.326 2.060 20 0 BEADLO Cc1nnc(C[N@@H+]2Cc3ccccc3C[C@@H]2C)[nH]1 ZINC000336111042 134086430 /nfs/dbraw/zinc/08/64/30/134086430.db2.gz NDUILHVIBBFRMG-JTQLQIEISA-N 1 2 242.326 2.060 20 0 BEADLO CC[C@H](C)CCNC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000617643207 356258588 /nfs/dbraw/zinc/25/85/88/356258588.db2.gz OUYWXXRNUQELDO-QWRGUYRKSA-N 1 2 237.347 2.141 20 0 BEADLO CC[C@H](C)CCNC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000617643207 356258591 /nfs/dbraw/zinc/25/85/91/356258591.db2.gz OUYWXXRNUQELDO-QWRGUYRKSA-N 1 2 237.347 2.141 20 0 BEADLO CCOCC[N@H+](CC)CC(F)(F)CC ZINC000639482160 356297348 /nfs/dbraw/zinc/29/73/48/356297348.db2.gz JCFSHKXOFUGSCU-UHFFFAOYSA-N 1 2 209.280 2.390 20 0 BEADLO CCOCC[N@@H+](CC)CC(F)(F)CC ZINC000639482160 356297350 /nfs/dbraw/zinc/29/73/50/356297350.db2.gz JCFSHKXOFUGSCU-UHFFFAOYSA-N 1 2 209.280 2.390 20 0 BEADLO CC(=O)C[N@@H+]1CCc2c(Cl)cccc2C1 ZINC000639494149 356317857 /nfs/dbraw/zinc/31/78/57/356317857.db2.gz GCKVMTANLFKRMA-UHFFFAOYSA-N 1 2 223.703 2.287 20 0 BEADLO CC(=O)C[N@H+]1CCc2c(Cl)cccc2C1 ZINC000639494149 356317859 /nfs/dbraw/zinc/31/78/59/356317859.db2.gz GCKVMTANLFKRMA-UHFFFAOYSA-N 1 2 223.703 2.287 20 0 BEADLO C[N@@H+](Cc1nccs1)C[C@H]1CC(C)(C)CO1 ZINC000639507249 356334959 /nfs/dbraw/zinc/33/49/59/356334959.db2.gz KLUBXDSPRWYQQK-SNVBAGLBSA-N 1 2 240.372 2.390 20 0 BEADLO C[N@H+](Cc1nccs1)C[C@H]1CC(C)(C)CO1 ZINC000639507249 356334961 /nfs/dbraw/zinc/33/49/61/356334961.db2.gz KLUBXDSPRWYQQK-SNVBAGLBSA-N 1 2 240.372 2.390 20 0 BEADLO CC(=O)C[N@@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000639511353 356346084 /nfs/dbraw/zinc/34/60/84/356346084.db2.gz PGXKQFSGANSWFI-GFCCVEGCSA-N 1 2 207.248 2.162 20 0 BEADLO CC(=O)C[N@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000639511353 356346088 /nfs/dbraw/zinc/34/60/88/356346088.db2.gz PGXKQFSGANSWFI-GFCCVEGCSA-N 1 2 207.248 2.162 20 0 BEADLO CCC(F)(F)C[N@H+](C)CC(C)(C)OC ZINC000639517479 356358939 /nfs/dbraw/zinc/35/89/39/356358939.db2.gz VKSQHXMIQBFDAG-UHFFFAOYSA-N 1 2 209.280 2.389 20 0 BEADLO CCC(F)(F)C[N@@H+](C)CC(C)(C)OC ZINC000639517479 356358943 /nfs/dbraw/zinc/35/89/43/356358943.db2.gz VKSQHXMIQBFDAG-UHFFFAOYSA-N 1 2 209.280 2.389 20 0 BEADLO CC(=O)C[N@@H+]1CCOC2(C1)CCCCCC2 ZINC000639518233 356361305 /nfs/dbraw/zinc/36/13/05/356361305.db2.gz CHRJQYNSFFXWOK-UHFFFAOYSA-N 1 2 225.332 2.001 20 0 BEADLO CC(=O)C[N@H+]1CCOC2(C1)CCCCCC2 ZINC000639518233 356361309 /nfs/dbraw/zinc/36/13/09/356361309.db2.gz CHRJQYNSFFXWOK-UHFFFAOYSA-N 1 2 225.332 2.001 20 0 BEADLO CC(=O)C[N@@H+](C)[C@H]1CCCc2nc(C)sc21 ZINC000639529111 356377797 /nfs/dbraw/zinc/37/77/97/356377797.db2.gz JBJZXZSGHHCVJV-NSHDSACASA-N 1 2 238.356 2.350 20 0 BEADLO CC(=O)C[N@H+](C)[C@H]1CCCc2nc(C)sc21 ZINC000639529111 356377799 /nfs/dbraw/zinc/37/77/99/356377799.db2.gz JBJZXZSGHHCVJV-NSHDSACASA-N 1 2 238.356 2.350 20 0 BEADLO CC1(C)C[N@H+](Cc2csnn2)[C@@H]1C1CC1 ZINC000336561866 356392243 /nfs/dbraw/zinc/39/22/43/356392243.db2.gz IQRAIXUSLKSIJI-SNVBAGLBSA-N 1 2 223.345 2.159 20 0 BEADLO CC1(C)C[N@@H+](Cc2csnn2)[C@@H]1C1CC1 ZINC000336561866 356392248 /nfs/dbraw/zinc/39/22/48/356392248.db2.gz IQRAIXUSLKSIJI-SNVBAGLBSA-N 1 2 223.345 2.159 20 0 BEADLO CCC(F)(F)CN(C)CCCn1cc[nH+]c1 ZINC000639550718 356427294 /nfs/dbraw/zinc/42/72/94/356427294.db2.gz AYJGIIOLSFGESZ-UHFFFAOYSA-N 1 2 231.290 2.250 20 0 BEADLO Fc1cccc(Cl)c1C[NH2+]Cc1cc[nH]n1 ZINC000041014442 358505062 /nfs/dbraw/zinc/50/50/62/358505062.db2.gz ZLQZLIFKRSISHV-UHFFFAOYSA-N 1 2 239.681 2.492 20 0 BEADLO CC[C@@H]1C[C@H](Nc2cc[nH+]c(C3CC3)n2)CCO1 ZINC000420623534 192250570 /nfs/dbraw/zinc/25/05/70/192250570.db2.gz VGBWUKMAWWPCCN-VXGBXAGGSA-N 1 2 247.342 2.145 20 0 BEADLO Cc1cc(=O)[nH]c(C(C)(C)[NH2+]Cc2ccco2)n1 ZINC000628374268 356455324 /nfs/dbraw/zinc/45/53/24/356455324.db2.gz AURJASDOKGBAOL-UHFFFAOYSA-N 1 2 247.298 2.109 20 0 BEADLO FC1(F)CC2(C[NH+](Cc3ccns3)C2)C1 ZINC000639556057 356459484 /nfs/dbraw/zinc/45/94/84/356459484.db2.gz SFOFTOKVYMEUDU-UHFFFAOYSA-N 1 2 230.283 2.374 20 0 BEADLO Cc1cc(CNC(=O)N[C@H](C)C2CC2)cc(C)[nH+]1 ZINC000420770906 192259180 /nfs/dbraw/zinc/25/91/80/192259180.db2.gz KODKHQVRESXLHP-LLVKDONJSA-N 1 2 247.342 2.296 20 0 BEADLO CCCCNC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000420771036 192259686 /nfs/dbraw/zinc/25/96/86/192259686.db2.gz KZTNVRSHXRXQME-UHFFFAOYSA-N 1 2 235.331 2.298 20 0 BEADLO Cc1cc(CNC(=O)NCC2CCC2)cc(C)[nH+]1 ZINC000420795245 192261290 /nfs/dbraw/zinc/26/12/90/192261290.db2.gz LCFDSUKYKMHFIW-UHFFFAOYSA-N 1 2 247.342 2.298 20 0 BEADLO Cc1cc(CNC(=O)NC[C@H]2C[C@H]2C)cc(C)[nH+]1 ZINC000420812041 192262168 /nfs/dbraw/zinc/26/21/68/192262168.db2.gz WTQZRKBMNSWRJK-NOZJJQNGSA-N 1 2 247.342 2.154 20 0 BEADLO O=C(CCCn1cc[nH+]c1)NC[C@@H]1CC=CCC1 ZINC000623284727 356477129 /nfs/dbraw/zinc/47/71/29/356477129.db2.gz CYSRHCKEMPYACX-CYBMUJFWSA-N 1 2 247.342 2.136 20 0 BEADLO O=C(CCCn1cc[nH+]c1)NC[C@H]1CC=CCC1 ZINC000623284728 356477194 /nfs/dbraw/zinc/47/71/94/356477194.db2.gz CYSRHCKEMPYACX-ZDUSSCGKSA-N 1 2 247.342 2.136 20 0 BEADLO Cc1cc(NC(=O)NC2CC=CC2)cc[nH+]1 ZINC000119938770 491093670 /nfs/dbraw/zinc/09/36/70/491093670.db2.gz RTSLABYNMOEDNG-UHFFFAOYSA-N 1 2 217.272 2.230 20 0 BEADLO CCC(F)(F)C[NH+]1[C@H](C)CC(O)C[C@H]1C ZINC000639601090 356520390 /nfs/dbraw/zinc/52/03/90/356520390.db2.gz NVGOZPOEKXLDKM-RKDXNWHRSA-N 1 2 221.291 2.265 20 0 BEADLO CCC(F)(F)C[N@@H+]1CC[C@@H](C)[C@@H](OC)C1 ZINC000639603947 356524765 /nfs/dbraw/zinc/52/47/65/356524765.db2.gz IOOPELUITKHNCA-ZJUUUORDSA-N 1 2 221.291 2.389 20 0 BEADLO CCC(F)(F)C[N@H+]1CC[C@@H](C)[C@@H](OC)C1 ZINC000639603947 356524767 /nfs/dbraw/zinc/52/47/67/356524767.db2.gz IOOPELUITKHNCA-ZJUUUORDSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@@H]1C[NH+](Cc2cc(C)ncn2)C[C@@H](CC)O1 ZINC000420959665 192281834 /nfs/dbraw/zinc/28/18/34/192281834.db2.gz QLPSUXVDLLYDEP-ZIAGYGMSSA-N 1 2 249.358 2.174 20 0 BEADLO CCC(F)(F)C[NH2+][C@H]1Cc2cccc(O)c2C1 ZINC000639614258 356532186 /nfs/dbraw/zinc/53/21/86/356532186.db2.gz YNWXDPZULWYWQT-JTQLQIEISA-N 1 2 241.281 2.494 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+]1CCS[C@H](C)C1 ZINC000336187624 134122083 /nfs/dbraw/zinc/12/20/83/134122083.db2.gz MZEPGJURNMYPIL-SFYZADRCSA-N 1 2 229.374 2.036 20 0 BEADLO C[C@@H](c1csnn1)[N@H+]1CCS[C@H](C)C1 ZINC000336187624 134122084 /nfs/dbraw/zinc/12/20/84/134122084.db2.gz MZEPGJURNMYPIL-SFYZADRCSA-N 1 2 229.374 2.036 20 0 BEADLO COc1ccccc1C[N@H+](C)Cc1cc[nH]n1 ZINC000179589618 366273484 /nfs/dbraw/zinc/27/34/84/366273484.db2.gz RRZYTABFGXAGLH-UHFFFAOYSA-N 1 2 231.299 2.050 20 0 BEADLO COc1ccccc1C[N@@H+](C)Cc1cc[nH]n1 ZINC000179589618 366273490 /nfs/dbraw/zinc/27/34/90/366273490.db2.gz RRZYTABFGXAGLH-UHFFFAOYSA-N 1 2 231.299 2.050 20 0 BEADLO CC1=C[C@@H](C)C[N@H+](Cc2nc(CC3CC3)no2)C1 ZINC000639624840 356538629 /nfs/dbraw/zinc/53/86/29/356538629.db2.gz WZHAIYPSFWWXMU-SNVBAGLBSA-N 1 2 247.342 2.420 20 0 BEADLO CC1=C[C@@H](C)C[N@@H+](Cc2nc(CC3CC3)no2)C1 ZINC000639624840 356538635 /nfs/dbraw/zinc/53/86/35/356538635.db2.gz WZHAIYPSFWWXMU-SNVBAGLBSA-N 1 2 247.342 2.420 20 0 BEADLO CC1=CCC[N@H+](Cc2nc(C3CCC3)no2)C1 ZINC000639622606 356541753 /nfs/dbraw/zinc/54/17/53/356541753.db2.gz DIWRQDITLZOMKI-UHFFFAOYSA-N 1 2 233.315 2.489 20 0 BEADLO CC1=CCC[N@@H+](Cc2nc(C3CCC3)no2)C1 ZINC000639622606 356541757 /nfs/dbraw/zinc/54/17/57/356541757.db2.gz DIWRQDITLZOMKI-UHFFFAOYSA-N 1 2 233.315 2.489 20 0 BEADLO CC(=O)C[N@@H+]1CC[C@](F)(c2ccccc2C)C1 ZINC000639627290 356548603 /nfs/dbraw/zinc/54/86/03/356548603.db2.gz HKWAFXYMDBDUIX-CQSZACIVSA-N 1 2 235.302 2.455 20 0 BEADLO CC(=O)C[N@H+]1CC[C@](F)(c2ccccc2C)C1 ZINC000639627290 356548606 /nfs/dbraw/zinc/54/86/06/356548606.db2.gz HKWAFXYMDBDUIX-CQSZACIVSA-N 1 2 235.302 2.455 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@]23CCOC3)sc1C ZINC000421012782 192302092 /nfs/dbraw/zinc/30/20/92/192302092.db2.gz FSXRRIKWFGPNGQ-LBPRGKRZSA-N 1 2 238.356 2.125 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@]23CCOC3)sc1C ZINC000421012782 192302094 /nfs/dbraw/zinc/30/20/94/192302094.db2.gz FSXRRIKWFGPNGQ-LBPRGKRZSA-N 1 2 238.356 2.125 20 0 BEADLO CCCC(C)(C)C(=O)N[C@H]1CCn2c[nH+]cc2C1 ZINC000623297768 356550768 /nfs/dbraw/zinc/55/07/68/356550768.db2.gz MSJPDOBDHCHIFI-NSHDSACASA-N 1 2 249.358 2.140 20 0 BEADLO Fc1ccc(C[N@@H+]2CC[C@@]23CCOC3)cc1F ZINC000421030672 192308674 /nfs/dbraw/zinc/30/86/74/192308674.db2.gz YZTHRMMFZULTIN-ZDUSSCGKSA-N 1 2 239.265 2.330 20 0 BEADLO Fc1ccc(C[N@H+]2CC[C@@]23CCOC3)cc1F ZINC000421030672 192308677 /nfs/dbraw/zinc/30/86/77/192308677.db2.gz YZTHRMMFZULTIN-ZDUSSCGKSA-N 1 2 239.265 2.330 20 0 BEADLO c1ccc2oc(C[N@@H+]3CC[C@@]34CCOC4)nc2c1 ZINC000421028028 192309082 /nfs/dbraw/zinc/30/90/82/192309082.db2.gz HDNMYUYMSBIMNU-AWEZNQCLSA-N 1 2 244.294 2.193 20 0 BEADLO c1ccc2oc(C[N@H+]3CC[C@@]34CCOC4)nc2c1 ZINC000421028028 192309085 /nfs/dbraw/zinc/30/90/85/192309085.db2.gz HDNMYUYMSBIMNU-AWEZNQCLSA-N 1 2 244.294 2.193 20 0 BEADLO C[C@@H]1C[N@H+](CC(=O)c2ccccc2F)[C@H]1C ZINC000639654701 356560180 /nfs/dbraw/zinc/56/01/80/356560180.db2.gz GDNCHPJRTRZFOZ-ZJUUUORDSA-N 1 2 221.275 2.349 20 0 BEADLO C[C@@H]1C[N@@H+](CC(=O)c2ccccc2F)[C@H]1C ZINC000639654701 356560183 /nfs/dbraw/zinc/56/01/83/356560183.db2.gz GDNCHPJRTRZFOZ-ZJUUUORDSA-N 1 2 221.275 2.349 20 0 BEADLO Cc1c(Cl)c(C[NH2+]C(C)(C)CF)nn1C ZINC000421338781 192318782 /nfs/dbraw/zinc/31/87/82/192318782.db2.gz FRUULVXYITUNDO-UHFFFAOYSA-N 1 2 233.718 2.220 20 0 BEADLO Cc1cccc(C[N@@H+]2C[C@H](F)C[C@H]2CO)c1F ZINC000336213134 134135527 /nfs/dbraw/zinc/13/55/27/134135527.db2.gz FSTXNBMFEGZBAT-NEPJUHHUSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cccc(C[N@H+]2C[C@H](F)C[C@H]2CO)c1F ZINC000336213134 134135528 /nfs/dbraw/zinc/13/55/28/134135528.db2.gz FSTXNBMFEGZBAT-NEPJUHHUSA-N 1 2 241.281 2.039 20 0 BEADLO CC(C)CCCC(=O)N[C@@H]1CCn2c[nH+]cc2C1 ZINC000623300592 356569095 /nfs/dbraw/zinc/56/90/95/356569095.db2.gz VVVFFCIATYWEAG-GFCCVEGCSA-N 1 2 249.358 2.140 20 0 BEADLO CC(C)n1cc[nH+]c1CN1C[C@@H](C)OC[C@@H]1C ZINC000336208976 134134026 /nfs/dbraw/zinc/13/40/26/134134026.db2.gz VGSITOOHKNKRIO-NWDGAFQWSA-N 1 2 237.347 2.073 20 0 BEADLO CCC(F)(F)C[N@@H+]1CC[C@@H](OC)[C@@H](C)C1 ZINC000639661908 356575959 /nfs/dbraw/zinc/57/59/59/356575959.db2.gz BPJZUCXINASALZ-VHSXEESVSA-N 1 2 221.291 2.389 20 0 BEADLO CCC(F)(F)C[N@H+]1CC[C@@H](OC)[C@@H](C)C1 ZINC000639661908 356575961 /nfs/dbraw/zinc/57/59/61/356575961.db2.gz BPJZUCXINASALZ-VHSXEESVSA-N 1 2 221.291 2.389 20 0 BEADLO CCC(CC)CC(=O)N[C@@H]1CCn2c[nH+]cc2C1 ZINC000623307689 356611603 /nfs/dbraw/zinc/61/16/03/356611603.db2.gz MTPMMTMCGFZJLI-GFCCVEGCSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@@H](C)C(C)(C)C)no1 ZINC000613599256 363530929 /nfs/dbraw/zinc/53/09/29/363530929.db2.gz MYDNACLLKSPJJW-QMMMGPOBSA-N 1 2 211.309 2.244 20 0 BEADLO Cc1nc(C[N@H+](C)[C@@H](C)C(C)(C)C)no1 ZINC000613599256 363530931 /nfs/dbraw/zinc/53/09/31/363530931.db2.gz MYDNACLLKSPJJW-QMMMGPOBSA-N 1 2 211.309 2.244 20 0 BEADLO CC(C)CCCC(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000450177389 202091168 /nfs/dbraw/zinc/09/11/68/202091168.db2.gz WUGZSENAQGYFED-LLVKDONJSA-N 1 2 249.358 2.210 20 0 BEADLO CC(C)CCCC(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000450177389 202091172 /nfs/dbraw/zinc/09/11/72/202091172.db2.gz WUGZSENAQGYFED-LLVKDONJSA-N 1 2 249.358 2.210 20 0 BEADLO Cc1cc(N[C@H]2CCCC2(F)F)nc[nH+]1 ZINC000379926043 538462660 /nfs/dbraw/zinc/46/26/60/538462660.db2.gz LICJZTSQJVBWNP-QMMMGPOBSA-N 1 2 213.231 2.385 20 0 BEADLO C[C@@H](NC(=O)C(C)(C)C1CCC1)c1[nH]cc[nH+]1 ZINC000322917382 363550144 /nfs/dbraw/zinc/55/01/44/363550144.db2.gz HDIBVXYCQNYWMI-SECBINFHSA-N 1 2 235.331 2.413 20 0 BEADLO COC(=O)C(C)(C)[NH2+]C[C@H]1CCCCC1(F)F ZINC000450351999 202140910 /nfs/dbraw/zinc/14/09/10/202140910.db2.gz VCQRUGPHJCFKLO-SECBINFHSA-N 1 2 249.301 2.353 20 0 BEADLO COC(=O)C(C)(C)[NH2+]C[C@@H]1CCCCC1(F)F ZINC000450352000 202141288 /nfs/dbraw/zinc/14/12/88/202141288.db2.gz VCQRUGPHJCFKLO-VIFPVBQESA-N 1 2 249.301 2.353 20 0 BEADLO CNc1nc(N(C)C2CCC2)[nH+]c2ccccc21 ZINC000450358785 202142936 /nfs/dbraw/zinc/14/29/36/202142936.db2.gz SYLANUOILXHETJ-UHFFFAOYSA-N 1 2 242.326 2.082 20 0 BEADLO C[C@H]([NH2+][C@@H]1C[C@@H](C)N(C2CC2)C1)C(C)(F)F ZINC000389480477 356688029 /nfs/dbraw/zinc/68/80/29/356688029.db2.gz FIZTZDAVBNZPMT-KXUCPTDWSA-N 1 2 232.318 2.245 20 0 BEADLO Cc1nn(C)cc1[C@H](C)[NH2+][C@@H](C)C(C)(F)F ZINC000389494194 356694625 /nfs/dbraw/zinc/69/46/25/356694625.db2.gz WODFLWPUHXDPLG-CBAPKCEASA-N 1 2 231.290 2.423 20 0 BEADLO CCn1c[nH+]cc1CN[C@@H](C)C(C)(F)F ZINC000389462798 356681503 /nfs/dbraw/zinc/68/15/03/356681503.db2.gz HJGRDHSYKKRLRK-QMMMGPOBSA-N 1 2 217.263 2.036 20 0 BEADLO CCn1cc(C[NH2+][C@H](C)C(C)(F)F)cn1 ZINC000389475591 356684623 /nfs/dbraw/zinc/68/46/23/356684623.db2.gz YVJBQRLWCOYMLY-MRVPVSSYSA-N 1 2 217.263 2.036 20 0 BEADLO c1cc(N[C@@H]2CCCOC2)[nH+]cc1N1CCCC1 ZINC000346463495 538532824 /nfs/dbraw/zinc/53/28/24/538532824.db2.gz RGEDWMPKUZSZIA-GFCCVEGCSA-N 1 2 247.342 2.273 20 0 BEADLO c1csc(C[N@@H+]2CCC[C@@H]2c2cn[nH]c2)n1 ZINC000639776500 356718289 /nfs/dbraw/zinc/71/82/89/356718289.db2.gz BFYDPQMRIWSXTI-SNVBAGLBSA-N 1 2 234.328 2.203 20 0 BEADLO c1csc(C[N@H+]2CCC[C@@H]2c2cn[nH]c2)n1 ZINC000639776500 356718294 /nfs/dbraw/zinc/71/82/94/356718294.db2.gz BFYDPQMRIWSXTI-SNVBAGLBSA-N 1 2 234.328 2.203 20 0 BEADLO CC(=O)Nc1cccc(COCc2[nH]cc[nH+]2)c1 ZINC000180038036 366361890 /nfs/dbraw/zinc/36/18/90/366361890.db2.gz UHALECLIRREGOV-UHFFFAOYSA-N 1 2 245.282 2.085 20 0 BEADLO CCc1cnc(C[N@@H+]2CCC[C@@H]2c2cn[nH]c2)o1 ZINC000639778301 356723135 /nfs/dbraw/zinc/72/31/35/356723135.db2.gz LEFWKLZZUUISJN-GFCCVEGCSA-N 1 2 246.314 2.297 20 0 BEADLO CCc1cnc(C[N@H+]2CCC[C@@H]2c2cn[nH]c2)o1 ZINC000639778301 356723138 /nfs/dbraw/zinc/72/31/38/356723138.db2.gz LEFWKLZZUUISJN-GFCCVEGCSA-N 1 2 246.314 2.297 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@@H]2c2cn[nH]c2)c(C)o1 ZINC000639776630 356717032 /nfs/dbraw/zinc/71/70/32/356717032.db2.gz OBOKZNXKNAUZAX-CYBMUJFWSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@@H]2c2cn[nH]c2)c(C)o1 ZINC000639776630 356717034 /nfs/dbraw/zinc/71/70/34/356717034.db2.gz OBOKZNXKNAUZAX-CYBMUJFWSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@H]2c2cn[nH]c2)o1 ZINC000639775937 356717067 /nfs/dbraw/zinc/71/70/67/356717067.db2.gz HVEKAZQBMTXQMQ-NSHDSACASA-N 1 2 232.287 2.043 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@H]2c2cn[nH]c2)o1 ZINC000639775937 356717069 /nfs/dbraw/zinc/71/70/69/356717069.db2.gz HVEKAZQBMTXQMQ-NSHDSACASA-N 1 2 232.287 2.043 20 0 BEADLO Cc1ccc(NC(=O)N[C@@H](C)C(F)F)c(C)[nH+]1 ZINC000639796510 356752912 /nfs/dbraw/zinc/75/29/12/356752912.db2.gz UGIDOVZEWCHOKP-QMMMGPOBSA-N 1 2 243.257 2.474 20 0 BEADLO CCCC[N@H+](Cc1noc(CC)n1)C1CC1 ZINC000054316939 363566862 /nfs/dbraw/zinc/56/68/62/363566862.db2.gz UUPIFPIVKXQWPR-UHFFFAOYSA-N 1 2 223.320 2.397 20 0 BEADLO CCCC[N@@H+](Cc1noc(CC)n1)C1CC1 ZINC000054316939 363566865 /nfs/dbraw/zinc/56/68/65/363566865.db2.gz UUPIFPIVKXQWPR-UHFFFAOYSA-N 1 2 223.320 2.397 20 0 BEADLO COc1cc(C[N@H+](C)Cc2ccns2)ccn1 ZINC000639806671 356773641 /nfs/dbraw/zinc/77/36/41/356773641.db2.gz DNRNCOWXQFLWFG-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2ccns2)ccn1 ZINC000639806671 356773643 /nfs/dbraw/zinc/77/36/43/356773643.db2.gz DNRNCOWXQFLWFG-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO C[NH+](Cc1ccns1)Cc1ccns1 ZINC000639806674 356774549 /nfs/dbraw/zinc/77/45/49/356774549.db2.gz DONLQLQSPCZCAU-UHFFFAOYSA-N 1 2 225.342 2.232 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)C[C@H]1CCCCC1(F)F ZINC000450478933 202179484 /nfs/dbraw/zinc/17/94/84/202179484.db2.gz KFGBWZJDPOJAEY-SECBINFHSA-N 1 2 244.289 2.062 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)C[C@H]1CCCCC1(F)F ZINC000450478933 202179486 /nfs/dbraw/zinc/17/94/86/202179486.db2.gz KFGBWZJDPOJAEY-SECBINFHSA-N 1 2 244.289 2.062 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1[C@H](C)CCC[C@@H]1C ZINC000654713900 538696814 /nfs/dbraw/zinc/69/68/14/538696814.db2.gz XKCWYFJMEHMHSJ-UTUOFQBUSA-N 1 2 249.358 2.378 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1[C@H](C)CCC[C@@H]1C ZINC000654713900 538696830 /nfs/dbraw/zinc/69/68/30/538696830.db2.gz XKCWYFJMEHMHSJ-UTUOFQBUSA-N 1 2 249.358 2.378 20 0 BEADLO C[C@H](c1ccccc1)[C@@H](O)Cn1cc[nH+]c1 ZINC000450512917 202188250 /nfs/dbraw/zinc/18/82/50/202188250.db2.gz VLSJAQWJEJWZGN-YPMHNXCESA-N 1 2 216.284 2.048 20 0 BEADLO CCC[C@@H](CC)NC(=O)CCc1c[nH+]c[nH]1 ZINC000352540474 538723676 /nfs/dbraw/zinc/72/36/76/538723676.db2.gz LNVBHEKPZZCQKX-SNVBAGLBSA-N 1 2 223.320 2.037 20 0 BEADLO CCC[C@@H](CC)NC(=O)CCc1c[nH]c[nH+]1 ZINC000352540474 538723687 /nfs/dbraw/zinc/72/36/87/538723687.db2.gz LNVBHEKPZZCQKX-SNVBAGLBSA-N 1 2 223.320 2.037 20 0 BEADLO CCc1cnccc1[C@H](C)[NH2+]Cc1nnc(C)o1 ZINC000361133701 356918184 /nfs/dbraw/zinc/91/81/84/356918184.db2.gz ZANGZPKKPYUOFC-VIFPVBQESA-N 1 2 246.314 2.186 20 0 BEADLO COC1(CNc2cc[nH+]c(C(C)C)n2)CCCC1 ZINC000450546033 202195141 /nfs/dbraw/zinc/19/51/41/202195141.db2.gz DEDVQVABDXSRIY-UHFFFAOYSA-N 1 2 249.358 2.393 20 0 BEADLO COc1cnccc1[C@@H](C)[NH2+][C@@H](C)c1ncc[nH]1 ZINC000353668995 538755289 /nfs/dbraw/zinc/75/52/89/538755289.db2.gz HGWTXKQVASXEQV-ZJUUUORDSA-N 1 2 246.314 2.225 20 0 BEADLO CCc1nc(N2CCC23CCOCC3)cc(C)[nH+]1 ZINC000367420488 356954416 /nfs/dbraw/zinc/95/44/16/356954416.db2.gz RQVXABWUWOPELU-UHFFFAOYSA-N 1 2 247.342 2.107 20 0 BEADLO C[C@@H](C(=O)NC(C)(C)C)[N@H+](C)Cc1ccco1 ZINC000016381252 356955394 /nfs/dbraw/zinc/95/53/94/356955394.db2.gz BQRBGXZQTLEUIF-JTQLQIEISA-N 1 2 238.331 2.015 20 0 BEADLO C[C@@H](C(=O)NC(C)(C)C)[N@@H+](C)Cc1ccco1 ZINC000016381252 356955397 /nfs/dbraw/zinc/95/53/97/356955397.db2.gz BQRBGXZQTLEUIF-JTQLQIEISA-N 1 2 238.331 2.015 20 0 BEADLO Cc1cc(CNc2cc[nH+]c(C3CC3)n2)ccn1 ZINC000450615415 202210678 /nfs/dbraw/zinc/21/06/78/202210678.db2.gz CDXLQBYQQHHMQO-UHFFFAOYSA-N 1 2 240.310 2.091 20 0 BEADLO C[C@H](c1csnn1)[N@H+](C)CCc1ccccn1 ZINC000450620431 202212861 /nfs/dbraw/zinc/21/28/61/202212861.db2.gz CQITWPIBVFZJBS-SNVBAGLBSA-N 1 2 248.355 2.169 20 0 BEADLO C[C@H](c1csnn1)[N@@H+](C)CCc1ccccn1 ZINC000450620431 202212864 /nfs/dbraw/zinc/21/28/64/202212864.db2.gz CQITWPIBVFZJBS-SNVBAGLBSA-N 1 2 248.355 2.169 20 0 BEADLO COc1ccc[nH+]c1N[C@@H](C)COC(C)C ZINC000390673395 357111270 /nfs/dbraw/zinc/11/12/70/357111270.db2.gz WEURLUPYZQJIPG-JTQLQIEISA-N 1 2 224.304 2.316 20 0 BEADLO C[C@H](CC(C)(C)C)C(=O)NCc1c[nH+]cn1C ZINC000355252141 538792314 /nfs/dbraw/zinc/79/23/14/538792314.db2.gz KTWJSFUIWHKBRZ-SNVBAGLBSA-N 1 2 237.347 2.109 20 0 BEADLO C[C@H]1CCC[C@@H](CC(=O)NCc2c[nH+]cn2C)C1 ZINC000355258158 538792494 /nfs/dbraw/zinc/79/24/94/538792494.db2.gz RXMGCEMHUYIUMY-NWDGAFQWSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2ccncc2C)s1 ZINC000391874599 357135065 /nfs/dbraw/zinc/13/50/65/357135065.db2.gz NRNOQDPNCWOESS-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO Cc1cc(F)ccc1C[NH2+][C@H](C)c1ncn(C)n1 ZINC000391877643 357135396 /nfs/dbraw/zinc/13/53/96/357135396.db2.gz RRSJYAUWXFVTSM-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO CCOc1ccc2[nH]c(CCCCO)[nH+]c2c1 ZINC000026462169 357135682 /nfs/dbraw/zinc/13/56/82/357135682.db2.gz KEJPDNFWUGFNKP-UHFFFAOYSA-N 1 2 234.299 2.277 20 0 BEADLO CN(C[C@H]1CC=CCC1)C(=O)CCc1c[nH+]c[nH]1 ZINC000355928502 538805052 /nfs/dbraw/zinc/80/50/52/538805052.db2.gz YAUGQJRAUUNZAY-LBPRGKRZSA-N 1 2 247.342 2.157 20 0 BEADLO CN(C[C@H]1CC=CCC1)C(=O)CCc1c[nH]c[nH+]1 ZINC000355928502 538805056 /nfs/dbraw/zinc/80/50/56/538805056.db2.gz YAUGQJRAUUNZAY-LBPRGKRZSA-N 1 2 247.342 2.157 20 0 BEADLO CC(C)N(C(=O)CCc1c[nH+]c[nH]1)C1CCC1 ZINC000356144373 538806749 /nfs/dbraw/zinc/80/67/49/538806749.db2.gz FESVMODFZJPYCI-UHFFFAOYSA-N 1 2 235.331 2.132 20 0 BEADLO CC(C)N(C(=O)CCc1c[nH]c[nH+]1)C1CCC1 ZINC000356144373 538806752 /nfs/dbraw/zinc/80/67/52/538806752.db2.gz FESVMODFZJPYCI-UHFFFAOYSA-N 1 2 235.331 2.132 20 0 BEADLO CCc1nc(C[N@@H+]2C[C@H]3CCCC[C@H]32)no1 ZINC000377769935 357238352 /nfs/dbraw/zinc/23/83/52/357238352.db2.gz PNOQRCAWOWUOHF-NXEZZACHSA-N 1 2 221.304 2.006 20 0 BEADLO CCc1nc(C[N@H+]2C[C@H]3CCCC[C@H]32)no1 ZINC000377769935 357238354 /nfs/dbraw/zinc/23/83/54/357238354.db2.gz PNOQRCAWOWUOHF-NXEZZACHSA-N 1 2 221.304 2.006 20 0 BEADLO c1nnsc1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC000582467508 357293439 /nfs/dbraw/zinc/29/34/39/357293439.db2.gz FAWPWUVIZCLDOC-LBPRGKRZSA-N 1 2 246.339 2.270 20 0 BEADLO c1nnsc1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000582467508 357293440 /nfs/dbraw/zinc/29/34/40/357293440.db2.gz FAWPWUVIZCLDOC-LBPRGKRZSA-N 1 2 246.339 2.270 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2cc[nH]n2)oc1C ZINC000393736841 357294727 /nfs/dbraw/zinc/29/47/27/357294727.db2.gz CGBGBWWBESORPJ-VIFPVBQESA-N 1 2 219.288 2.470 20 0 BEADLO CC[C@@H]([NH2+]C1CC(C)C1)C(=O)OC(C)(C)C ZINC000393744713 357295403 /nfs/dbraw/zinc/29/54/03/357295403.db2.gz KPKFIQBHHUWCMC-VQXHTEKXSA-N 1 2 227.348 2.495 20 0 BEADLO CC(C)(C)c1nnc(C[NH2+]CC2(F)CC2)s1 ZINC000393778313 357298608 /nfs/dbraw/zinc/29/86/08/357298608.db2.gz MHDIJOFFRYVFPA-UHFFFAOYSA-N 1 2 243.351 2.427 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCCC(F)(F)CC2)n1 ZINC000628422479 357245446 /nfs/dbraw/zinc/24/54/46/357245446.db2.gz LTRHFLPBGRLKAM-UHFFFAOYSA-N 1 2 229.274 2.339 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCCC(F)(F)CC2)n1 ZINC000628422479 357245448 /nfs/dbraw/zinc/24/54/48/357245448.db2.gz LTRHFLPBGRLKAM-UHFFFAOYSA-N 1 2 229.274 2.339 20 0 BEADLO c1csc(C[NH+]2CC3(C2)CCCO3)c1 ZINC000628426645 357255123 /nfs/dbraw/zinc/25/51/23/357255123.db2.gz CTMULYWBHKTAHM-UHFFFAOYSA-N 1 2 209.314 2.113 20 0 BEADLO Cc1ccc(F)cc1C[NH+]1CC2(C1)CCCO2 ZINC000628427248 357257178 /nfs/dbraw/zinc/25/71/78/357257178.db2.gz OYGUVXNZFYHZNH-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO COc1cccc(C[NH+]2CC3(C2)CCCO3)c1 ZINC000628426896 357257411 /nfs/dbraw/zinc/25/74/11/357257411.db2.gz SYDMRHSCZKKZFZ-UHFFFAOYSA-N 1 2 233.311 2.060 20 0 BEADLO Cc1cc(NCC(C)(F)F)nc(C2CC2)[nH+]1 ZINC000393279113 357280484 /nfs/dbraw/zinc/28/04/84/357280484.db2.gz PFLPIGPCMKVACQ-UHFFFAOYSA-N 1 2 227.258 2.151 20 0 BEADLO Cc1cnc(C[NH2+]Cc2cccc(C)n2)s1 ZINC000394730825 357371658 /nfs/dbraw/zinc/37/16/58/357371658.db2.gz RJUIWOFGKFVHBE-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO COCCSCCc1cccc(C)[nH+]1 ZINC000582724653 357372666 /nfs/dbraw/zinc/37/26/66/357372666.db2.gz AGBKMCWBQVULFN-UHFFFAOYSA-N 1 2 211.330 2.312 20 0 BEADLO CC(C)[N@H+](C)Cc1nc([C@@H]2CCCS2)no1 ZINC000357092735 538826389 /nfs/dbraw/zinc/82/63/89/538826389.db2.gz XJTFQBROBKPNBW-VIFPVBQESA-N 1 2 241.360 2.478 20 0 BEADLO CC(C)[N@@H+](C)Cc1nc([C@@H]2CCCS2)no1 ZINC000357092735 538826395 /nfs/dbraw/zinc/82/63/95/538826395.db2.gz XJTFQBROBKPNBW-VIFPVBQESA-N 1 2 241.360 2.478 20 0 BEADLO Cc1cc(NC(=O)N[C@@]23C[C@@H]2CCCC3)cc[nH+]1 ZINC000639900178 357312625 /nfs/dbraw/zinc/31/26/25/357312625.db2.gz JHZLHLZUXUYSNB-FZMZJTMJSA-N 1 2 245.326 2.266 20 0 BEADLO CC1=C(C)C[C@@H](C(=O)NCCc2[nH]cc[nH+]2)CC1 ZINC000582547924 357332906 /nfs/dbraw/zinc/33/29/06/357332906.db2.gz PPWFOHICRRSCIS-LBPRGKRZSA-N 1 2 247.342 2.205 20 0 BEADLO COc1c(C)[nH+]c(C2CC2)nc1N1CCCC1 ZINC000582637234 357355387 /nfs/dbraw/zinc/35/53/87/357355387.db2.gz XHDACEUQLQOEQX-UHFFFAOYSA-N 1 2 233.315 2.271 20 0 BEADLO c1c[nH]c(C[N@@H+]2CCC=C(c3ccccn3)C2)n1 ZINC000582794482 357399301 /nfs/dbraw/zinc/39/93/01/357399301.db2.gz KWUXCPFBSJXHLT-UHFFFAOYSA-N 1 2 240.310 2.094 20 0 BEADLO c1c[nH]c(C[N@H+]2CCC=C(c3ccccn3)C2)n1 ZINC000582794482 357399302 /nfs/dbraw/zinc/39/93/02/357399302.db2.gz KWUXCPFBSJXHLT-UHFFFAOYSA-N 1 2 240.310 2.094 20 0 BEADLO CCC(CC)(CC)CNC(=O)Cn1cc[nH+]c1 ZINC000583058308 357469620 /nfs/dbraw/zinc/46/96/20/357469620.db2.gz ZFNKRSZOVHHWTL-UHFFFAOYSA-N 1 2 237.347 2.216 20 0 BEADLO CCc1cc(N2CCOC(C)(C)[C@@H]2C)nc(C)[nH+]1 ZINC000359723569 538857192 /nfs/dbraw/zinc/85/71/92/538857192.db2.gz CVNYHSVGNROYGZ-JTQLQIEISA-N 1 2 249.358 2.351 20 0 BEADLO COC(=O)c1coc(CNc2c[nH+]cc(C)c2)c1 ZINC000230685172 357549457 /nfs/dbraw/zinc/54/94/57/357549457.db2.gz FHAHMXLFSNQNDX-UHFFFAOYSA-N 1 2 246.266 2.382 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1C[C@H]2C[C@H]2C1 ZINC000397643116 357618306 /nfs/dbraw/zinc/61/83/06/357618306.db2.gz BLFMPOKIRIXGBU-ILWJIGKKSA-N 1 2 204.273 2.301 20 0 BEADLO CCc1cc(N2CC(C)(C)OC[C@@H]2C)nc(C)[nH+]1 ZINC000487114852 538885359 /nfs/dbraw/zinc/88/53/59/538885359.db2.gz OECKUSYABWQIJJ-JTQLQIEISA-N 1 2 249.358 2.351 20 0 BEADLO Cc1cc(NCc2cccnn2)nc(C(C)C)[nH+]1 ZINC000232764708 357680579 /nfs/dbraw/zinc/68/05/79/357680579.db2.gz LYRYXJPYXCCXNN-UHFFFAOYSA-N 1 2 243.314 2.311 20 0 BEADLO CCC(=O)CC[N@@H+]1CCO[C@H](c2ccco2)C1 ZINC000190272847 357697607 /nfs/dbraw/zinc/69/76/07/357697607.db2.gz VAPVCAPDPBAKFK-ZDUSSCGKSA-N 1 2 237.299 2.022 20 0 BEADLO CCC(=O)CC[N@H+]1CCO[C@H](c2ccco2)C1 ZINC000190272847 357697611 /nfs/dbraw/zinc/69/76/11/357697611.db2.gz VAPVCAPDPBAKFK-ZDUSSCGKSA-N 1 2 237.299 2.022 20 0 BEADLO Cc1cnccc1C[NH2+]CC(C)(F)F ZINC000583243997 357705273 /nfs/dbraw/zinc/70/52/73/357705273.db2.gz HGYMFOZBHNPLQZ-UHFFFAOYSA-N 1 2 200.232 2.135 20 0 BEADLO COC(=O)C[N@@H+]1CCc2c(cccc2C(C)C)C1 ZINC000191894306 357802967 /nfs/dbraw/zinc/80/29/67/357802967.db2.gz LTDSZNNQLJACII-UHFFFAOYSA-N 1 2 247.338 2.341 20 0 BEADLO COC(=O)C[N@H+]1CCc2c(cccc2C(C)C)C1 ZINC000191894306 357802969 /nfs/dbraw/zinc/80/29/69/357802969.db2.gz LTDSZNNQLJACII-UHFFFAOYSA-N 1 2 247.338 2.341 20 0 BEADLO CSCCC[N@@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000610369854 357810625 /nfs/dbraw/zinc/81/06/25/357810625.db2.gz VITGRIQNNRPLMI-MRVPVSSYSA-N 1 2 243.294 2.003 20 0 BEADLO CSCCC[N@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000610369854 357810628 /nfs/dbraw/zinc/81/06/28/357810628.db2.gz VITGRIQNNRPLMI-MRVPVSSYSA-N 1 2 243.294 2.003 20 0 BEADLO COc1cccc2c1cc[nH+]c2NC[C@@H](C)O ZINC000234912969 357836463 /nfs/dbraw/zinc/83/64/63/357836463.db2.gz BBXDJHOMYCPGNS-SECBINFHSA-N 1 2 232.283 2.036 20 0 BEADLO COc1cccc2c1cc[nH+]c2N(C)[C@H](C)CO ZINC000234905764 357836764 /nfs/dbraw/zinc/83/67/64/357836764.db2.gz FZUNNCGZQLYTOD-SNVBAGLBSA-N 1 2 246.310 2.060 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1CC[C@@H](C)O1 ZINC000398118547 357842754 /nfs/dbraw/zinc/84/27/54/357842754.db2.gz VVTWNPAKCXEFGD-ZJUUUORDSA-N 1 2 222.288 2.070 20 0 BEADLO C[C@@H]1CCC[C@]1(C)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000584391556 357883476 /nfs/dbraw/zinc/88/34/76/357883476.db2.gz YEVWTKYTBLDQCK-RISCZKNCSA-N 1 2 247.342 2.093 20 0 BEADLO CSCC[N@H+]1C[C@H](C(F)(F)F)O[C@@H](C)C1 ZINC000610409993 357916673 /nfs/dbraw/zinc/91/66/73/357916673.db2.gz AXTZLCXFZJRYRD-JGVFFNPUSA-N 1 2 243.294 2.001 20 0 BEADLO CSCC[N@@H+]1C[C@H](C(F)(F)F)O[C@@H](C)C1 ZINC000610409993 357916676 /nfs/dbraw/zinc/91/66/76/357916676.db2.gz AXTZLCXFZJRYRD-JGVFFNPUSA-N 1 2 243.294 2.001 20 0 BEADLO CSCC[N@@H+]1C[C@H](C)O[C@H](C(F)(F)F)C1 ZINC000610409995 357916693 /nfs/dbraw/zinc/91/66/93/357916693.db2.gz AXTZLCXFZJRYRD-YUMQZZPRSA-N 1 2 243.294 2.001 20 0 BEADLO CSCC[N@H+]1C[C@H](C)O[C@H](C(F)(F)F)C1 ZINC000610409995 357916696 /nfs/dbraw/zinc/91/66/96/357916696.db2.gz AXTZLCXFZJRYRD-YUMQZZPRSA-N 1 2 243.294 2.001 20 0 BEADLO COC(=O)[C@@H]([NH2+]Cc1cccc(C)c1)C(C)C ZINC000035085060 357963397 /nfs/dbraw/zinc/96/33/97/357963397.db2.gz IVIPTDZRTDMUDQ-ZDUSSCGKSA-N 1 2 235.327 2.282 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@H](CCF)C2)o1 ZINC000628457997 358017790 /nfs/dbraw/zinc/01/77/90/358017790.db2.gz YUWDIIKUBAMHPB-LLVKDONJSA-N 1 2 227.279 2.148 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@H](CCF)C2)o1 ZINC000628457997 358017792 /nfs/dbraw/zinc/01/77/92/358017792.db2.gz YUWDIIKUBAMHPB-LLVKDONJSA-N 1 2 227.279 2.148 20 0 BEADLO Cc1n[nH]cc1C[N@@H+](C)Cc1cc(C)ccn1 ZINC000639970119 358022992 /nfs/dbraw/zinc/02/29/92/358022992.db2.gz BRHUMJFIZJDITK-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1n[nH]cc1C[N@H+](C)Cc1cc(C)ccn1 ZINC000639970119 358022995 /nfs/dbraw/zinc/02/29/95/358022995.db2.gz BRHUMJFIZJDITK-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO CCc1nnc([C@@H](C)[NH+]2CCC(C)(F)CC2)[nH]1 ZINC000640071927 358161043 /nfs/dbraw/zinc/16/10/43/358161043.db2.gz BKCAAHSASPRJIJ-SECBINFHSA-N 1 2 240.326 2.252 20 0 BEADLO Cc1[nH]c(CNc2cnn(CC(C)C)c2)[nH+]c1C ZINC000584732936 358164937 /nfs/dbraw/zinc/16/49/37/358164937.db2.gz UJGNZAMRYOBZEY-UHFFFAOYSA-N 1 2 247.346 2.491 20 0 BEADLO C[C@@H](CC(=O)N1CCCC[C@@H](C)C1)n1cc[nH+]c1 ZINC000584783329 358176975 /nfs/dbraw/zinc/17/69/75/358176975.db2.gz BCTZVAFTYXXPSJ-OLZOCXBDSA-N 1 2 249.358 2.483 20 0 BEADLO COc1ccc(CNc2c[nH]c[nH+]2)cc1OC ZINC000584877593 358211712 /nfs/dbraw/zinc/21/17/12/358211712.db2.gz GLPXBSPUYDBGMB-UHFFFAOYSA-N 1 2 233.271 2.039 20 0 BEADLO CCn1ccnc1C[N@H+](C)Cc1ccc(O)cc1 ZINC000583899264 358226939 /nfs/dbraw/zinc/22/69/39/358226939.db2.gz IAXCCAUXNPBLDM-UHFFFAOYSA-N 1 2 245.326 2.241 20 0 BEADLO CCn1ccnc1C[N@@H+](C)Cc1ccc(O)cc1 ZINC000583899264 358226943 /nfs/dbraw/zinc/22/69/43/358226943.db2.gz IAXCCAUXNPBLDM-UHFFFAOYSA-N 1 2 245.326 2.241 20 0 BEADLO CC/C=C\CNc1cc(C)[nH+]c(C2CC2)n1 ZINC000450688160 202234070 /nfs/dbraw/zinc/23/40/70/202234070.db2.gz BYQZVCUCCPEUMJ-PLNGDYQASA-N 1 2 217.316 2.462 20 0 BEADLO O[C@@H]1CCC[C@@H]1[C@@H]1CCCN1c1cccc[nH+]1 ZINC000450706321 202239590 /nfs/dbraw/zinc/23/95/90/202239590.db2.gz OPKAWDNQBBSHKO-FRRDWIJNSA-N 1 2 232.327 2.211 20 0 BEADLO CO[C@H]1CCN(c2cc[nH+]c(C(C)C)n2)C[C@H]1C ZINC000450764331 202257430 /nfs/dbraw/zinc/25/74/30/202257430.db2.gz BYFXHUSAJNYPDC-NEPJUHHUSA-N 1 2 249.358 2.461 20 0 BEADLO CC(C)[C@H]1C[N@H+](Cc2csnn2)CCS1 ZINC000180246076 366403047 /nfs/dbraw/zinc/40/30/47/366403047.db2.gz FAXRDEIBEWOOCU-SNVBAGLBSA-N 1 2 243.401 2.112 20 0 BEADLO CC(C)[C@H]1C[N@@H+](Cc2csnn2)CCS1 ZINC000180246076 366403051 /nfs/dbraw/zinc/40/30/51/366403051.db2.gz FAXRDEIBEWOOCU-SNVBAGLBSA-N 1 2 243.401 2.112 20 0 BEADLO C[C@@H](NC(=O)[C@@H](C)c1ccccc1)c1[nH]cc[nH+]1 ZINC000227874083 358364184 /nfs/dbraw/zinc/36/41/84/358364184.db2.gz MBSIYQIZOMFBQJ-WDEREUQCSA-N 1 2 243.310 2.391 20 0 BEADLO CCc1cc(NC[C@@H]2CC[C@H]3C[C@H]3C2)nc[nH+]1 ZINC000403335279 358629025 /nfs/dbraw/zinc/62/90/25/358629025.db2.gz DZPFCYLRXOPTOD-GRYCIOLGSA-N 1 2 231.343 2.309 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@H]1CCC[C@@H]1c1ccccc1 ZINC000133766146 358766799 /nfs/dbraw/zinc/76/67/99/358766799.db2.gz TXFCNABDHJUTLC-YUTCNCBUSA-N 1 2 247.338 2.474 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1ccc(C)c(C)c1 ZINC000050066513 358711615 /nfs/dbraw/zinc/71/16/15/358711615.db2.gz QMYHURBTXXHPEW-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1ccc(C)c(C)c1 ZINC000050066513 358711617 /nfs/dbraw/zinc/71/16/17/358711617.db2.gz QMYHURBTXXHPEW-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1nncn1C)c1ccsc1 ZINC000050341743 358724892 /nfs/dbraw/zinc/72/48/92/358724892.db2.gz DDUIHKREWQQAOS-BDAKNGLRSA-N 1 2 236.344 2.288 20 0 BEADLO FC(F)Oc1cccc(C[NH+]2CCOCC2)c1 ZINC000050958359 358739452 /nfs/dbraw/zinc/73/94/52/358739452.db2.gz WDPXIBDOBKWCID-UHFFFAOYSA-N 1 2 243.253 2.120 20 0 BEADLO FCC[NH2+]Cc1nc2c(s1)CCCC2 ZINC000308517910 491136813 /nfs/dbraw/zinc/13/68/13/491136813.db2.gz OZTCPKLJPDQNER-UHFFFAOYSA-N 1 2 214.309 2.081 20 0 BEADLO COC(=O)C[N@@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000052455728 358783064 /nfs/dbraw/zinc/78/30/64/358783064.db2.gz GSWKRPQYPJBVLB-LBPRGKRZSA-N 1 2 237.274 2.136 20 0 BEADLO COC(=O)C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000052455728 358783067 /nfs/dbraw/zinc/78/30/67/358783067.db2.gz GSWKRPQYPJBVLB-LBPRGKRZSA-N 1 2 237.274 2.136 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCCSC1)C(=O)OC(C)(C)C ZINC000134814717 358807944 /nfs/dbraw/zinc/80/79/44/358807944.db2.gz NOHWSLQSQZDZAU-ZJUUUORDSA-N 1 2 245.388 2.202 20 0 BEADLO CCc1nc(C[N@H+]([C@H](C)C2CC2)C2CC2)no1 ZINC000054317068 358859330 /nfs/dbraw/zinc/85/93/30/358859330.db2.gz LBNOQMOQLTVJFP-SECBINFHSA-N 1 2 235.331 2.395 20 0 BEADLO CCc1nc(C[N@@H+]([C@H](C)C2CC2)C2CC2)no1 ZINC000054317068 358859333 /nfs/dbraw/zinc/85/93/33/358859333.db2.gz LBNOQMOQLTVJFP-SECBINFHSA-N 1 2 235.331 2.395 20 0 BEADLO C[C@@H]1C[C@@H](C)C[NH+](Cc2noc(C3CC3)n2)C1 ZINC000053602348 358835515 /nfs/dbraw/zinc/83/55/15/358835515.db2.gz VDSOVKWJOPEXIC-NXEZZACHSA-N 1 2 235.331 2.425 20 0 BEADLO COc1ccc(NC[C@@H]2CC[C@@H]3C[C@@H]3C2)[nH+]c1 ZINC000403376451 358900442 /nfs/dbraw/zinc/90/04/42/358900442.db2.gz NPMMYHINSKPMEL-UTUOFQBUSA-N 1 2 232.327 2.360 20 0 BEADLO CC[C@H](NC(=O)CCc1ccco1)c1[nH]cc[nH+]1 ZINC000140472635 358922368 /nfs/dbraw/zinc/92/23/68/358922368.db2.gz NLRARMSJIBCAFA-NSHDSACASA-N 1 2 247.298 2.203 20 0 BEADLO CC[C@@H](NC(=O)c1ccccc1)c1[nH]cc[nH+]1 ZINC000140444517 358922729 /nfs/dbraw/zinc/92/27/29/358922729.db2.gz YPQGBWIPAWYGOW-LLVKDONJSA-N 1 2 229.283 2.291 20 0 BEADLO CC[C@@H](NC(=O)Cc1cccs1)c1[nH]cc[nH+]1 ZINC000140676601 358924739 /nfs/dbraw/zinc/92/47/39/358924739.db2.gz BNEJAQMDYXVKDH-SNVBAGLBSA-N 1 2 249.339 2.281 20 0 BEADLO CC(C)c1nc(C[N@H+]2CC[C@@H](C)[C@H]2C)no1 ZINC000177908980 134301598 /nfs/dbraw/zinc/30/15/98/134301598.db2.gz YBZCKQUNLGUXEN-NXEZZACHSA-N 1 2 223.320 2.423 20 0 BEADLO FC(F)(F)CC[N@@H+]1OC2CCC1CC2 ZINC000640232178 358951297 /nfs/dbraw/zinc/95/12/97/358951297.db2.gz ZCPZIXNHWLZODM-UHFFFAOYSA-N 1 2 209.211 2.497 20 0 BEADLO FC(F)(F)CC[N@H+]1OC2CCC1CC2 ZINC000640232178 358951299 /nfs/dbraw/zinc/95/12/99/358951299.db2.gz ZCPZIXNHWLZODM-UHFFFAOYSA-N 1 2 209.211 2.497 20 0 BEADLO CCC[C@@H](CCO)CNc1cc(CC)[nH+]cn1 ZINC000231151710 359009026 /nfs/dbraw/zinc/00/90/26/359009026.db2.gz QFUVFHGMNACEHS-NSHDSACASA-N 1 2 237.347 2.250 20 0 BEADLO C[C@@H](C[C@H]1CCOC1)Nc1cccc[nH+]1 ZINC000308844347 491138767 /nfs/dbraw/zinc/13/87/67/491138767.db2.gz LMLXGKGLOHSKBH-WDEREUQCSA-N 1 2 206.289 2.309 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)CCC1CCCC1 ZINC000070979208 359067898 /nfs/dbraw/zinc/06/78/98/359067898.db2.gz FYJUOURXLXJNJK-UHFFFAOYSA-N 1 2 235.331 2.339 20 0 BEADLO CC(C)(C(=O)NCc1[nH]cc[nH+]1)c1ccccc1 ZINC000070990097 359068986 /nfs/dbraw/zinc/06/89/86/359068986.db2.gz BNXXWBJNXIYEKU-UHFFFAOYSA-N 1 2 243.310 2.004 20 0 BEADLO Cc1ccc(C(=O)NCc2[nH]cc[nH+]2)cc1Cl ZINC000070991205 359069999 /nfs/dbraw/zinc/06/99/99/359069999.db2.gz PKIOWVVPTIBHCF-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO COC[C@@H](C)[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000246456257 359099189 /nfs/dbraw/zinc/09/91/89/359099189.db2.gz FLTUANGAYMEDCW-ZYHUDNBSSA-N 1 2 241.356 2.156 20 0 BEADLO COC[C@@H](C)[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000246456257 359099191 /nfs/dbraw/zinc/09/91/91/359099191.db2.gz FLTUANGAYMEDCW-ZYHUDNBSSA-N 1 2 241.356 2.156 20 0 BEADLO Cc1ncc(C[N@H+]2CCO[C@@H](C)[C@H]2C)s1 ZINC000248183227 359258986 /nfs/dbraw/zinc/25/89/86/359258986.db2.gz WVCTWPLEMJIOPS-BDAKNGLRSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ncc(C[N@@H+]2CCO[C@@H](C)[C@H]2C)s1 ZINC000248183227 359258987 /nfs/dbraw/zinc/25/89/87/359258987.db2.gz WVCTWPLEMJIOPS-BDAKNGLRSA-N 1 2 226.345 2.061 20 0 BEADLO CC[C@H](C)C(=O)N1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000247685567 359240541 /nfs/dbraw/zinc/24/05/41/359240541.db2.gz SBYAQSCPLYVKQA-XQQFMLRXSA-N 1 2 249.358 2.339 20 0 BEADLO FC(F)C1(NCc2[nH]cc[nH+]2)CCCC1 ZINC000308883608 491139629 /nfs/dbraw/zinc/13/96/29/491139629.db2.gz RIDMYUYFSVMDAY-UHFFFAOYSA-N 1 2 215.247 2.077 20 0 BEADLO COC(=O)C(C)(C)[C@@H]1CCC[N@H+](CC(F)F)C1 ZINC000611321178 359312726 /nfs/dbraw/zinc/31/27/26/359312726.db2.gz IGNBQBURGYVCJP-SECBINFHSA-N 1 2 249.301 2.163 20 0 BEADLO COC(=O)C(C)(C)[C@@H]1CCC[N@@H+](CC(F)F)C1 ZINC000611321178 359312731 /nfs/dbraw/zinc/31/27/31/359312731.db2.gz IGNBQBURGYVCJP-SECBINFHSA-N 1 2 249.301 2.163 20 0 BEADLO Cc1cn[nH]c1C[NH+]1CC(Cc2cccs2)C1 ZINC000628479655 359314725 /nfs/dbraw/zinc/31/47/25/359314725.db2.gz WISTYTCQPIRCOR-UHFFFAOYSA-N 1 2 247.367 2.454 20 0 BEADLO Cc1c[nH]c(C[NH+]2CC(Cc3cccs3)C2)n1 ZINC000628479176 359315054 /nfs/dbraw/zinc/31/50/54/359315054.db2.gz BUQGNNOXSPEQKV-UHFFFAOYSA-N 1 2 247.367 2.454 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H]1[C@@H]2CCC[C@@H]21 ZINC000248370636 359272499 /nfs/dbraw/zinc/27/24/99/359272499.db2.gz XTCGYTZUGPGOIX-IAZYJMLFSA-N 1 2 216.284 2.375 20 0 BEADLO COC(=O)C[NH2+][C@@H](CC1CC1)c1ccccc1 ZINC000611395922 359358624 /nfs/dbraw/zinc/35/86/24/359358624.db2.gz ZBALAZAMMAYOGR-ZDUSSCGKSA-N 1 2 233.311 2.290 20 0 BEADLO CSc1ccncc1NCc1[nH]cc[nH+]1 ZINC000308904397 491140006 /nfs/dbraw/zinc/14/00/06/491140006.db2.gz CCOBGKWSYQAMGT-UHFFFAOYSA-N 1 2 220.301 2.139 20 0 BEADLO c1cn(CCSCc2ccccn2)c[nH+]1 ZINC000611470623 359376528 /nfs/dbraw/zinc/37/65/28/359376528.db2.gz VFOJUMZNMDYFJA-UHFFFAOYSA-N 1 2 219.313 2.212 20 0 BEADLO Cc1nn(C)c(C)c1C[C@@H](C)Nc1cccc[nH+]1 ZINC000078399265 359325905 /nfs/dbraw/zinc/32/59/05/359325905.db2.gz RWIBCBDGRJKYSY-SNVBAGLBSA-N 1 2 244.342 2.475 20 0 BEADLO CCOC(=O)[C@H](CC)[N@@H+]1CC[C@H](C)[C@H](F)C1 ZINC000611502434 359384682 /nfs/dbraw/zinc/38/46/82/359384682.db2.gz SGPQOYNWENQQBC-AXFHLTTASA-N 1 2 231.311 2.008 20 0 BEADLO CCOC(=O)[C@H](CC)[N@H+]1CC[C@H](C)[C@H](F)C1 ZINC000611502434 359384687 /nfs/dbraw/zinc/38/46/87/359384687.db2.gz SGPQOYNWENQQBC-AXFHLTTASA-N 1 2 231.311 2.008 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@]1(C)CC=C(C)CC1 ZINC000611796368 359452562 /nfs/dbraw/zinc/45/25/62/359452562.db2.gz YJBDRSXHLWXMBZ-AWEZNQCLSA-N 1 2 247.342 2.471 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@]1(C)CC=C(C)CC1 ZINC000611796376 359452940 /nfs/dbraw/zinc/45/29/40/359452940.db2.gz YJBDRSXHLWXMBZ-CQSZACIVSA-N 1 2 247.342 2.471 20 0 BEADLO CCc1nn(C)cc1Nc1cc(C)[nH+]c(CC)n1 ZINC000286592225 359536189 /nfs/dbraw/zinc/53/61/89/359536189.db2.gz UELHNQTXWSSDNF-UHFFFAOYSA-N 1 2 245.330 2.387 20 0 BEADLO CC(C)n1cc([C@@H](C)[NH2+]CC(F)F)cn1 ZINC000309011277 491142382 /nfs/dbraw/zinc/14/23/82/491142382.db2.gz RXGKIWOIEMQCRX-MRVPVSSYSA-N 1 2 217.263 2.380 20 0 BEADLO CCc1cc(NC(C)(C)C(F)F)nc[nH+]1 ZINC000309045138 491143319 /nfs/dbraw/zinc/14/33/19/491143319.db2.gz NYQYZHBTGRWIRM-UHFFFAOYSA-N 1 2 215.247 2.495 20 0 BEADLO CN(c1cccc[nH+]1)[C@@H](CO)CC(C)(C)C ZINC000450830795 202280970 /nfs/dbraw/zinc/28/09/70/202280970.db2.gz FAQHTYDJTIBQJL-LLVKDONJSA-N 1 2 222.332 2.315 20 0 BEADLO C[C@H]1c2nncn2CC[N@H+]1CC12CCC(CC1)C2 ZINC000450842574 202285523 /nfs/dbraw/zinc/28/55/23/202285523.db2.gz MRUQMKMXYPPGEI-DCBWTQNWSA-N 1 2 246.358 2.235 20 0 BEADLO C[C@H]1c2nncn2CC[N@@H+]1CC12CCC(CC1)C2 ZINC000450842574 202285527 /nfs/dbraw/zinc/28/55/27/202285527.db2.gz MRUQMKMXYPPGEI-DCBWTQNWSA-N 1 2 246.358 2.235 20 0 BEADLO CC[C@@H](O)[C@@H](CC)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000450866587 202293307 /nfs/dbraw/zinc/29/33/07/202293307.db2.gz XIZRLYRSVUULFE-GHMZBOCLSA-N 1 2 248.330 2.228 20 0 BEADLO CCO[C@@H]1CCC[C@H]1Nc1cc[nH+]c(C(C)C)n1 ZINC000450944529 202317109 /nfs/dbraw/zinc/31/71/09/202317109.db2.gz ULVPTHWTMYJJLI-VXGBXAGGSA-N 1 2 249.358 2.391 20 0 BEADLO CCC[C@H](C)N(C)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000578364813 366539787 /nfs/dbraw/zinc/53/97/87/366539787.db2.gz JHTGPAFHLDTWTQ-RYUDHWBXSA-N 1 2 237.347 2.481 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000578364811 366540470 /nfs/dbraw/zinc/54/04/70/366540470.db2.gz JHTGPAFHLDTWTQ-NEPJUHHUSA-N 1 2 237.347 2.481 20 0 BEADLO Cc1nc(N2CC[C@@H](CCCO)C2)c(C)c(C)[nH+]1 ZINC000450955053 202320047 /nfs/dbraw/zinc/32/00/47/202320047.db2.gz OZDVFSYNVHZCCM-CYBMUJFWSA-N 1 2 249.358 2.001 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2C[C@H]2C(C)C)c(C)c[nH+]1 ZINC000578419695 366563549 /nfs/dbraw/zinc/56/35/49/366563549.db2.gz RHYSKERFPLDRLO-WCQYABFASA-N 1 2 247.342 2.286 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@](C)(F)C2)nn1C ZINC000451110031 202355278 /nfs/dbraw/zinc/35/52/78/202355278.db2.gz BLAXVOGQEVGIRT-GFCCVEGCSA-N 1 2 225.311 2.053 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@](C)(F)C2)nn1C ZINC000451110031 202355281 /nfs/dbraw/zinc/35/52/81/202355281.db2.gz BLAXVOGQEVGIRT-GFCCVEGCSA-N 1 2 225.311 2.053 20 0 BEADLO CCOC(=O)[C@H](CC)[N@@H+]1CCC[C@@](C)(F)C1 ZINC000451118401 202357795 /nfs/dbraw/zinc/35/77/95/202357795.db2.gz XTBBPAYCMRLJOQ-CMPLNLGQSA-N 1 2 231.311 2.152 20 0 BEADLO CCOC(=O)[C@H](CC)[N@H+]1CCC[C@@](C)(F)C1 ZINC000451118401 202357798 /nfs/dbraw/zinc/35/77/98/202357798.db2.gz XTBBPAYCMRLJOQ-CMPLNLGQSA-N 1 2 231.311 2.152 20 0 BEADLO CCc1noc(C)c1C[N@H+](C(C)C)C1COC1 ZINC000451122377 202357897 /nfs/dbraw/zinc/35/78/97/202357897.db2.gz YFBYZXZDFMDOGD-UHFFFAOYSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1noc(C)c1C[N@@H+](C(C)C)C1COC1 ZINC000451122377 202357898 /nfs/dbraw/zinc/35/78/98/202357898.db2.gz YFBYZXZDFMDOGD-UHFFFAOYSA-N 1 2 238.331 2.155 20 0 BEADLO CCC(C)(C)CNC(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000613995361 363697138 /nfs/dbraw/zinc/69/71/38/363697138.db2.gz ZAWZLNWPVAVFCZ-SNVBAGLBSA-N 1 2 249.358 2.067 20 0 BEADLO CCC(C)(C)CNC(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000613995361 363697140 /nfs/dbraw/zinc/69/71/40/363697140.db2.gz ZAWZLNWPVAVFCZ-SNVBAGLBSA-N 1 2 249.358 2.067 20 0 BEADLO FC(F)(F)c1cc[nH+]c(N[C@H]2CCOC2)c1 ZINC000087787955 359929562 /nfs/dbraw/zinc/92/95/62/359929562.db2.gz YEKNDBXBUTZOHU-QMMMGPOBSA-N 1 2 232.205 2.301 20 0 BEADLO c1ccc2[nH+]c(N[C@H]3CCOC3)ccc2c1 ZINC000087787983 359929852 /nfs/dbraw/zinc/92/98/52/359929852.db2.gz YYHFQLXVVIHOQL-NSHDSACASA-N 1 2 214.268 2.436 20 0 BEADLO CCSCC[N@H+](C)[C@@H](C)c1nc(C)no1 ZINC000578664590 366623217 /nfs/dbraw/zinc/62/32/17/366623217.db2.gz RUAZMUISODOSOX-QMMMGPOBSA-N 1 2 229.349 2.124 20 0 BEADLO CCSCC[N@@H+](C)[C@@H](C)c1nc(C)no1 ZINC000578664590 366623219 /nfs/dbraw/zinc/62/32/19/366623219.db2.gz RUAZMUISODOSOX-QMMMGPOBSA-N 1 2 229.349 2.124 20 0 BEADLO CCCCOCCCNc1nc(C)[nH+]cc1C ZINC000578765596 366644024 /nfs/dbraw/zinc/64/40/24/366644024.db2.gz HOGIBHQRBYACHE-UHFFFAOYSA-N 1 2 237.347 2.134 20 0 BEADLO Cc1cnc([C@H](C)[NH2+]Cc2cn[nH]c2)s1 ZINC000309162130 491146035 /nfs/dbraw/zinc/14/60/35/491146035.db2.gz ZMFOBQQYJXVAJA-QMMMGPOBSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)C[C@H]2C[C@@H]2C)[nH+]1 ZINC000578875835 366665002 /nfs/dbraw/zinc/66/50/02/366665002.db2.gz YJVOTMMGVWFQDT-WCBMZHEXSA-N 1 2 235.331 2.116 20 0 BEADLO CC[C@]1(C)CCN(C(=O)[C@H](C)Cc2c[nH+]c[nH]2)C1 ZINC000578905797 366672686 /nfs/dbraw/zinc/67/26/86/366672686.db2.gz JNGCDLKDAVEXAB-BXUZGUMPSA-N 1 2 249.358 2.237 20 0 BEADLO CC[C@]1(C)CCN(C(=O)[C@H](C)Cc2c[nH]c[nH+]2)C1 ZINC000578905797 366672691 /nfs/dbraw/zinc/67/26/91/366672691.db2.gz JNGCDLKDAVEXAB-BXUZGUMPSA-N 1 2 249.358 2.237 20 0 BEADLO O=C(NCc1c[nH+]c[nH]1)c1cc2ccccc2o1 ZINC000088759343 359977670 /nfs/dbraw/zinc/97/76/70/359977670.db2.gz HYOFNMUVPNEQET-UHFFFAOYSA-N 1 2 241.250 2.086 20 0 BEADLO O=C(NCc1c[nH]c[nH+]1)c1cc2ccccc2o1 ZINC000088759343 359977671 /nfs/dbraw/zinc/97/76/71/359977671.db2.gz HYOFNMUVPNEQET-UHFFFAOYSA-N 1 2 241.250 2.086 20 0 BEADLO Cc1c[nH+]c(C)nc1NCc1cc(F)cc(F)c1 ZINC000578941953 366677653 /nfs/dbraw/zinc/67/76/53/366677653.db2.gz DSHUNNWEPKSROL-UHFFFAOYSA-N 1 2 249.264 2.406 20 0 BEADLO COc1cc(C)ccc1NCc1c[nH+]cn1C ZINC000090167061 360060050 /nfs/dbraw/zinc/06/00/50/360060050.db2.gz YPGFWXIPYRJXRR-UHFFFAOYSA-N 1 2 231.299 2.349 20 0 BEADLO COc1ncccc1NCc1c[nH+]cn1C(C)C ZINC000090208126 360064368 /nfs/dbraw/zinc/06/43/68/360064368.db2.gz LYHMWOSDMKRKTM-UHFFFAOYSA-N 1 2 246.314 2.480 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1scnc1C ZINC000091981892 360140152 /nfs/dbraw/zinc/14/01/52/360140152.db2.gz LKHDURASHLLJNA-JTQLQIEISA-N 1 2 226.345 2.062 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1scnc1C ZINC000091981892 360140155 /nfs/dbraw/zinc/14/01/55/360140155.db2.gz LKHDURASHLLJNA-JTQLQIEISA-N 1 2 226.345 2.062 20 0 BEADLO Cc1nc(NC2CC2)c(Br)c(C)[nH+]1 ZINC000306480422 360121202 /nfs/dbraw/zinc/12/12/02/360121202.db2.gz CGDCXIIBHMAKPN-UHFFFAOYSA-N 1 2 242.120 2.430 20 0 BEADLO CCCC[N@H+](CC(N)=O)Cc1ccc(Cl)o1 ZINC000091950212 360137413 /nfs/dbraw/zinc/13/74/13/360137413.db2.gz UYPJREMTDPWPHL-UHFFFAOYSA-N 1 2 244.722 2.020 20 0 BEADLO CCCC[N@@H+](CC(N)=O)Cc1ccc(Cl)o1 ZINC000091950212 360137420 /nfs/dbraw/zinc/13/74/20/360137420.db2.gz UYPJREMTDPWPHL-UHFFFAOYSA-N 1 2 244.722 2.020 20 0 BEADLO CC[C@@H](C)[N@H+](C)Cc1ncn(-c2ccccc2)n1 ZINC000092803602 360199731 /nfs/dbraw/zinc/19/97/31/360199731.db2.gz XEOUHCSXNJDMEQ-GFCCVEGCSA-N 1 2 244.342 2.498 20 0 BEADLO CC[C@@H](C)[N@@H+](C)Cc1ncn(-c2ccccc2)n1 ZINC000092803602 360199733 /nfs/dbraw/zinc/19/97/33/360199733.db2.gz XEOUHCSXNJDMEQ-GFCCVEGCSA-N 1 2 244.342 2.498 20 0 BEADLO COCc1ccc(C[N@@H+]2CCO[C@@H](C)[C@H]2C)o1 ZINC000093417710 360241666 /nfs/dbraw/zinc/24/16/66/360241666.db2.gz CZHDEFIIGZSDLM-MNOVXSKESA-N 1 2 239.315 2.035 20 0 BEADLO COCc1ccc(C[N@H+]2CCO[C@@H](C)[C@H]2C)o1 ZINC000093417710 360241667 /nfs/dbraw/zinc/24/16/67/360241667.db2.gz CZHDEFIIGZSDLM-MNOVXSKESA-N 1 2 239.315 2.035 20 0 BEADLO Cc1ccc(C(=O)N(C)Cc2[nH]cc[nH+]2)c(F)c1 ZINC000094216748 360300745 /nfs/dbraw/zinc/30/07/45/360300745.db2.gz QVQIBTQNLRTDAS-UHFFFAOYSA-N 1 2 247.273 2.129 20 0 BEADLO c1coc(C[N@@H+]2CCO[C@@H](c3ccco3)C2)c1 ZINC000093841153 360283415 /nfs/dbraw/zinc/28/34/15/360283415.db2.gz ARMDJZXRAJMLJU-CYBMUJFWSA-N 1 2 233.267 2.446 20 0 BEADLO c1coc(C[N@H+]2CCO[C@@H](c3ccco3)C2)c1 ZINC000093841153 360283418 /nfs/dbraw/zinc/28/34/18/360283418.db2.gz ARMDJZXRAJMLJU-CYBMUJFWSA-N 1 2 233.267 2.446 20 0 BEADLO O=C(Nc1ccccc1)[C@@H]1CCn2cc[nH+]c2C1 ZINC000096642056 360351166 /nfs/dbraw/zinc/35/11/66/360351166.db2.gz RHCLZLYAAIEWHY-LLVKDONJSA-N 1 2 241.294 2.084 20 0 BEADLO CC(C)c1nsc(N(C)Cc2[nH]cc[nH+]2)n1 ZINC000537833483 360398066 /nfs/dbraw/zinc/39/80/66/360398066.db2.gz FOKMCLNHNMSYAW-UHFFFAOYSA-N 1 2 237.332 2.021 20 0 BEADLO CCc1nc(C[N@H+](C)CCC(C)C)no1 ZINC000054337561 360482383 /nfs/dbraw/zinc/48/23/83/360482383.db2.gz YCHPPNFIJQXSJH-UHFFFAOYSA-N 1 2 211.309 2.110 20 0 BEADLO CCc1nc(C[N@@H+](C)CCC(C)C)no1 ZINC000054337561 360482387 /nfs/dbraw/zinc/48/23/87/360482387.db2.gz YCHPPNFIJQXSJH-UHFFFAOYSA-N 1 2 211.309 2.110 20 0 BEADLO Cc1nc(NC(=O)C[C@H](C)n2cc[nH+]c2)oc1C ZINC001641739929 1172286259 /nfs/dbraw/zinc/28/62/59/1172286259.db2.gz GCMUUHHIYIPPPB-QMMMGPOBSA-N 1 2 248.286 2.078 20 0 BEADLO Cn1cc[nH+]c1CNC1(C(F)F)CCCC1 ZINC000309609114 491152335 /nfs/dbraw/zinc/15/23/35/491152335.db2.gz YXVMPCGTQODSME-UHFFFAOYSA-N 1 2 229.274 2.088 20 0 BEADLO CCc1cc(N)nc(SC[C@@H]2C[C@@H]2C)[nH+]1 ZINC000629178770 360926548 /nfs/dbraw/zinc/92/65/48/360926548.db2.gz JHFBUXFYZRKASS-YUMQZZPRSA-N 1 2 223.345 2.200 20 0 BEADLO CC[C@H]1CCC[C@@H]1CNC(=O)CCn1cc[nH+]c1 ZINC000452523545 200776616 /nfs/dbraw/zinc/77/66/16/200776616.db2.gz GGGLLQAQLURPSZ-QWHCGFSZSA-N 1 2 249.358 2.216 20 0 BEADLO CCN(CC1CC1)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000579013391 366695972 /nfs/dbraw/zinc/69/59/72/366695972.db2.gz BBGWINYOMIOFSI-NSHDSACASA-N 1 2 235.331 2.093 20 0 BEADLO c1cnn(Cc2[nH+]ccn2-c2ccccc2)c1 ZINC000429248368 201083004 /nfs/dbraw/zinc/08/30/04/201083004.db2.gz YYYUKTJZHPDVIN-UHFFFAOYSA-N 1 2 224.267 2.117 20 0 BEADLO CC[C@@H]1CC[N@@H+]1Cc1cn(-c2ccccc2)nn1 ZINC000429298584 201098573 /nfs/dbraw/zinc/09/85/73/201098573.db2.gz WMSXHWMENGOGAO-CYBMUJFWSA-N 1 2 242.326 2.252 20 0 BEADLO CC[C@@H]1CC[N@H+]1Cc1cn(-c2ccccc2)nn1 ZINC000429298584 201098575 /nfs/dbraw/zinc/09/85/75/201098575.db2.gz WMSXHWMENGOGAO-CYBMUJFWSA-N 1 2 242.326 2.252 20 0 BEADLO C[N@H+](Cc1nnc(C(C)(C)C)[nH]1)[C@@H]1CC1(C)C ZINC000433188113 201166237 /nfs/dbraw/zinc/16/62/37/201166237.db2.gz LGFXOFKXVQSCDT-SECBINFHSA-N 1 2 236.363 2.333 20 0 BEADLO C[N@@H+](Cc1nnc(C(C)(C)C)[nH]1)[C@@H]1CC1(C)C ZINC000433188113 201166241 /nfs/dbraw/zinc/16/62/41/201166241.db2.gz LGFXOFKXVQSCDT-SECBINFHSA-N 1 2 236.363 2.333 20 0 BEADLO CCOCCN(CC)c1[nH+]c(C)nc2[nH]ccc21 ZINC000433792961 201192802 /nfs/dbraw/zinc/19/28/02/201192802.db2.gz PYOLKQPQNMJNFO-UHFFFAOYSA-N 1 2 248.330 2.129 20 0 BEADLO Cc1[nH]cc(-c2ccccc2N(C)C)[nH+]1 ZINC000629696894 361627267 /nfs/dbraw/zinc/62/72/67/361627267.db2.gz MLOPIXQIJJOVJR-UHFFFAOYSA-N 1 2 201.273 2.451 20 0 BEADLO CNc1ccc(-c2ccc(C(C)=O)cc2)c[nH+]1 ZINC000629692837 361620498 /nfs/dbraw/zinc/62/04/98/361620498.db2.gz WMIWMADMJATUOY-UHFFFAOYSA-N 1 2 226.279 2.415 20 0 BEADLO OCCCCNc1ccc(-c2ccccc2)c[nH+]1 ZINC000629689854 361623860 /nfs/dbraw/zinc/62/38/60/361623860.db2.gz CLKWVTGOQLSJSU-UHFFFAOYSA-N 1 2 242.322 2.355 20 0 BEADLO COCCN(C)c1ccc(-c2cccnc2)c[nH+]1 ZINC000629711672 361647588 /nfs/dbraw/zinc/64/75/88/361647588.db2.gz GDWKAVXLCGCHOB-UHFFFAOYSA-N 1 2 243.310 2.226 20 0 BEADLO CN1CC[NH+](Cc2cc3cc(F)ccc3o2)CC1 ZINC000154412838 201277743 /nfs/dbraw/zinc/27/77/43/201277743.db2.gz FKGYEPJCAASWFV-UHFFFAOYSA-N 1 2 248.301 2.319 20 0 BEADLO CC(C)Nc1ccc(-c2cncnc2)c[nH+]1 ZINC000629714165 361655820 /nfs/dbraw/zinc/65/58/20/361655820.db2.gz YHUYFADYQZGSCU-UHFFFAOYSA-N 1 2 214.272 2.359 20 0 BEADLO CC[C@H]1CCC[C@@H]1C(=O)NCCCn1cc[nH+]c1 ZINC000448565631 201290320 /nfs/dbraw/zinc/29/03/20/201290320.db2.gz MQFORUIHWXGIPT-STQMWFEESA-N 1 2 249.358 2.216 20 0 BEADLO CCNc1ccc(-c2ccc(C)cc2CO)c[nH+]1 ZINC000629740755 361678556 /nfs/dbraw/zinc/67/85/56/361678556.db2.gz LQXDZJQFDNMCGP-UHFFFAOYSA-N 1 2 242.322 2.403 20 0 BEADLO Cc1[nH]cc(-c2cc(C(F)(F)F)[nH]n2)[nH+]1 ZINC000629730435 361670143 /nfs/dbraw/zinc/67/01/43/361670143.db2.gz YEBHVBQSORNTJJ-UHFFFAOYSA-N 1 2 216.166 2.127 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC[C@H]1CC[C@@H](C)C1 ZINC000432269223 192938370 /nfs/dbraw/zinc/93/83/70/192938370.db2.gz JEBLKUYUDSXJGD-PWSUYJOCSA-N 1 2 247.342 2.370 20 0 BEADLO CCc1cc(N[C@@H]2C[C@H]2C(F)(F)F)nc[nH+]1 ZINC000381976638 487528072 /nfs/dbraw/zinc/52/80/72/487528072.db2.gz DFSXZFJRBTXAKQ-HTQZYQBOSA-N 1 2 231.221 2.402 20 0 BEADLO CCCCc1csc([C@@H]2COCC[NH2+]2)n1 ZINC000630381437 364096500 /nfs/dbraw/zinc/09/65/00/364096500.db2.gz PWSLGHNYHSNDKD-JTQLQIEISA-N 1 2 226.345 2.147 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)CCC(F)F ZINC000622083748 370699416 /nfs/dbraw/zinc/69/94/16/370699416.db2.gz LIJNGWBTFFNVGJ-QMMMGPOBSA-N 1 2 245.273 2.126 20 0 BEADLO Cc1csc(C(C)(C)[NH2+]Cc2ccno2)n1 ZINC000072663084 364199757 /nfs/dbraw/zinc/19/97/57/364199757.db2.gz INJPFPVXKWCVDA-UHFFFAOYSA-N 1 2 237.328 2.464 20 0 BEADLO CCc1cc(N[C@@H](CC)c2[nH]cc[nH+]2)ncn1 ZINC000139841149 541345161 /nfs/dbraw/zinc/34/51/61/541345161.db2.gz WCNHLXUNJZGJKF-JTQLQIEISA-N 1 2 231.303 2.325 20 0 BEADLO CCn1cc(OCc2ccc(C)[nH+]c2C)cn1 ZINC000432673280 192953305 /nfs/dbraw/zinc/95/33/05/192953305.db2.gz WLFMCNNXSFSVKP-UHFFFAOYSA-N 1 2 231.299 2.494 20 0 BEADLO Cc1cc(NC(=O)[C@@H](C)OCC2CC2)cc[nH+]1 ZINC000068350178 370780473 /nfs/dbraw/zinc/78/04/73/370780473.db2.gz HBOSBOONDHCMBT-SNVBAGLBSA-N 1 2 234.299 2.144 20 0 BEADLO C=C/C=C\CC(=O)Nc1ccc2[nH+]ccn2c1 ZINC001642038963 1172319458 /nfs/dbraw/zinc/31/94/58/1172319458.db2.gz IWVCLMXMEJSCDD-ARJAWSKDSA-N 1 2 227.267 2.405 20 0 BEADLO CCc1nnc(C[NH2+][C@@H](C)c2ccc(F)cc2)[nH]1 ZINC000274667461 364757927 /nfs/dbraw/zinc/75/79/27/364757927.db2.gz RKWMPOSSBDQNBK-VIFPVBQESA-N 1 2 248.305 2.357 20 0 BEADLO C[C@H](CC(=O)NCCC1(C)CC1)n1cc[nH+]c1 ZINC000573568423 364864375 /nfs/dbraw/zinc/86/43/75/364864375.db2.gz WIZDACYBAODMIU-LLVKDONJSA-N 1 2 235.331 2.141 20 0 BEADLO CC(C)(CC(=O)N1CC(n2cc[nH+]c2)C1)C1CC1 ZINC000573985673 364961652 /nfs/dbraw/zinc/96/16/52/364961652.db2.gz CAXZSJFJZHODIZ-UHFFFAOYSA-N 1 2 247.342 2.093 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1CCO[C@@H](C)C1 ZINC000574170079 365002594 /nfs/dbraw/zinc/00/25/94/365002594.db2.gz JPWGMCAHWYBXBR-GXSJLCMTSA-N 1 2 221.304 2.073 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)CCCOC(C)C ZINC000574170647 365002636 /nfs/dbraw/zinc/00/26/36/365002636.db2.gz PLUOQIOFCIJHKR-UHFFFAOYSA-N 1 2 237.347 2.345 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1CCO[C@H](C)C1 ZINC000574170081 365002990 /nfs/dbraw/zinc/00/29/90/365002990.db2.gz JPWGMCAHWYBXBR-MWLCHTKSSA-N 1 2 221.304 2.073 20 0 BEADLO O[C@@H]1CCCN(c2[nH+]ccc3ccccc32)C1 ZINC000168745098 364995469 /nfs/dbraw/zinc/99/54/69/364995469.db2.gz MPMOENFXMBNRCV-GFCCVEGCSA-N 1 2 228.295 2.196 20 0 BEADLO C[C@@H](NC(=O)C(C)(C)CC(F)F)c1[nH]cc[nH+]1 ZINC000574339094 365041123 /nfs/dbraw/zinc/04/11/23/365041123.db2.gz MAQSFCNEOJYERN-SSDOTTSWSA-N 1 2 245.273 2.268 20 0 BEADLO C[C@H](C[S@@](C)=O)Nc1[nH+]ccc2ccccc21 ZINC000169068527 365068349 /nfs/dbraw/zinc/06/83/49/365068349.db2.gz BWSFCUKPECDVLV-QGHHPUGFSA-N 1 2 248.351 2.414 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC[C@@H](F)C2)nc1 ZINC000574578764 365095240 /nfs/dbraw/zinc/09/52/40/365095240.db2.gz TYOLRGSYIHUMEK-LLVKDONJSA-N 1 2 208.280 2.324 20 0 BEADLO Cc1ccc(C[N@H+]2CCC[C@@H](F)C2)nc1 ZINC000574578764 365095247 /nfs/dbraw/zinc/09/52/47/365095247.db2.gz TYOLRGSYIHUMEK-LLVKDONJSA-N 1 2 208.280 2.324 20 0 BEADLO CC[C@H](NC(=O)[C@H]1C[C@@]1(C)CC)c1[nH]cc[nH+]1 ZINC000442814513 192994386 /nfs/dbraw/zinc/99/43/86/192994386.db2.gz VAEYBUFQMCZHEV-GBIKHYSHSA-N 1 2 235.331 2.413 20 0 BEADLO CC(C)C[C@@]1(C)CCCN1C(=O)Cn1cc[nH+]c1 ZINC000574845186 365159210 /nfs/dbraw/zinc/15/92/10/365159210.db2.gz FBBAJUTWICWCND-CQSZACIVSA-N 1 2 249.358 2.310 20 0 BEADLO OC1(CCSc2[nH+]cc3ccccn32)CC1 ZINC000442898368 193003089 /nfs/dbraw/zinc/00/30/89/193003089.db2.gz BTTYVEMICAJSPL-UHFFFAOYSA-N 1 2 234.324 2.341 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1CCCCC[C@H]1C ZINC000574769073 365140852 /nfs/dbraw/zinc/14/08/52/365140852.db2.gz RTLZOXVDPJGNCS-NWDGAFQWSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1CCCCC[C@H]1C ZINC000574769073 365140856 /nfs/dbraw/zinc/14/08/56/365140856.db2.gz RTLZOXVDPJGNCS-NWDGAFQWSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CCCCC[C@@H]1C ZINC000574769072 365141868 /nfs/dbraw/zinc/14/18/68/365141868.db2.gz RTLZOXVDPJGNCS-NEPJUHHUSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CCCCC[C@@H]1C ZINC000574769072 365141875 /nfs/dbraw/zinc/14/18/75/365141875.db2.gz RTLZOXVDPJGNCS-NEPJUHHUSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)Nc1ccccc1 ZINC000622272731 370813162 /nfs/dbraw/zinc/81/31/62/370813162.db2.gz FUBOQGWTALNTDY-JTQLQIEISA-N 1 2 229.283 2.227 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)Nc1ccccc1 ZINC000622272731 370813164 /nfs/dbraw/zinc/81/31/64/370813164.db2.gz FUBOQGWTALNTDY-JTQLQIEISA-N 1 2 229.283 2.227 20 0 BEADLO CC[C@H](NCc1[nH]c(C)c(C)[nH+]1)C(F)(F)F ZINC000575196425 365238443 /nfs/dbraw/zinc/23/84/43/365238443.db2.gz LZOVCHZCYWNDMN-QMMMGPOBSA-N 1 2 235.253 2.457 20 0 BEADLO C[NH2+]Cc1noc([C@H]2CCC[C@H](C)C2)n1 ZINC000334554818 365238778 /nfs/dbraw/zinc/23/87/78/365238778.db2.gz DGSOUBBAFSULBF-IUCAKERBSA-N 1 2 209.293 2.083 20 0 BEADLO CC[N@H+](Cc1ccc(OC)cc1F)C1COC1 ZINC000575412095 365314252 /nfs/dbraw/zinc/31/42/52/365314252.db2.gz MGORVMCHOPKOEK-UHFFFAOYSA-N 1 2 239.290 2.055 20 0 BEADLO CC[N@@H+](Cc1ccc(OC)cc1F)C1COC1 ZINC000575412095 365314258 /nfs/dbraw/zinc/31/42/58/365314258.db2.gz MGORVMCHOPKOEK-UHFFFAOYSA-N 1 2 239.290 2.055 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1ncc(F)cc1F ZINC000192287645 365315372 /nfs/dbraw/zinc/31/53/72/365315372.db2.gz YCFNIWZHKREAEC-UHFFFAOYSA-N 1 2 249.220 2.316 20 0 BEADLO CC[C@H]([NH2+]C/C=C\c1ccccc1)C(=O)OC ZINC000336720377 365362511 /nfs/dbraw/zinc/36/25/11/365362511.db2.gz WNODKHWMYPYSNS-SZNGSJQDSA-N 1 2 233.311 2.241 20 0 BEADLO Cc1cc(CNc2nc(C)ncc2C)cc(C)[nH+]1 ZINC000575881442 365403182 /nfs/dbraw/zinc/40/31/82/365403182.db2.gz QWUSQYODFZOBFA-UHFFFAOYSA-N 1 2 242.326 2.139 20 0 BEADLO Cn1ccnc1C[NH2+]C1(c2cccc(F)c2)CC1 ZINC000172674177 365371826 /nfs/dbraw/zinc/37/18/26/365371826.db2.gz LZLWDSKJKLWZKV-UHFFFAOYSA-N 1 2 245.301 2.338 20 0 BEADLO CC(C)[C@@H]1C[C@H]1CNC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000579599023 366899621 /nfs/dbraw/zinc/89/96/21/366899621.db2.gz WCLSJKZNOTTYBZ-AVGNSLFASA-N 1 2 249.358 2.243 20 0 BEADLO CC[C@H]([NH2+]Cc1cccc(C)n1)c1nccn1C ZINC000182524483 366914007 /nfs/dbraw/zinc/91/40/07/366914007.db2.gz OZSNINWXVADWNW-ZDUSSCGKSA-N 1 2 244.342 2.364 20 0 BEADLO CC[C@H](C)Nc1ccc(N2CCOCC2)c[nH+]1 ZINC000182874664 366954750 /nfs/dbraw/zinc/95/47/50/366954750.db2.gz JNMIHEBMNCIBPI-NSHDSACASA-N 1 2 235.331 2.129 20 0 BEADLO CC[C@@H](C)CN(C)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000579718405 366990696 /nfs/dbraw/zinc/99/06/96/366990696.db2.gz HSFUDNODANJIRV-NEPJUHHUSA-N 1 2 237.347 2.339 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@H]1CCC[C@@H]2C[C@@H]21 ZINC000579805647 367013956 /nfs/dbraw/zinc/01/39/56/367013956.db2.gz HWXHVLQEEURDOT-MDZLAQPJSA-N 1 2 245.326 2.122 20 0 BEADLO CCCCNC(=O)c1ccn2c(C)c[nH+]c2c1 ZINC000579855541 367054534 /nfs/dbraw/zinc/05/45/34/367054534.db2.gz BTQPPRRXSXXOOK-UHFFFAOYSA-N 1 2 231.299 2.173 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CC(C)(C)C[C@H]1C ZINC000579978004 367114024 /nfs/dbraw/zinc/11/40/24/367114024.db2.gz NDGGUEUEINYQEI-GHMZBOCLSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CC(C)(C)C[C@H]1C ZINC000579978004 367114027 /nfs/dbraw/zinc/11/40/27/367114027.db2.gz NDGGUEUEINYQEI-GHMZBOCLSA-N 1 2 249.358 2.235 20 0 BEADLO CC[C@H]1CCCN(C(=O)[C@H](C)Cc2c[nH+]c[nH]2)C1 ZINC000580842308 367185755 /nfs/dbraw/zinc/18/57/55/367185755.db2.gz CGZUHBQHIMUGOZ-NEPJUHHUSA-N 1 2 249.358 2.237 20 0 BEADLO CC[C@H]1CCCN(C(=O)[C@H](C)Cc2c[nH]c[nH+]2)C1 ZINC000580842308 367185760 /nfs/dbraw/zinc/18/57/60/367185760.db2.gz CGZUHBQHIMUGOZ-NEPJUHHUSA-N 1 2 249.358 2.237 20 0 BEADLO Cn1c[nH+]cc1CCNC(=O)CC1(C)CCCC1 ZINC000580860982 367190191 /nfs/dbraw/zinc/19/01/91/367190191.db2.gz PZDFTOPOXXUUKF-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO Cc1nnc([C@H](C)[N@H+](C)Cc2cccc(O)c2)[nH]1 ZINC000581296720 367325346 /nfs/dbraw/zinc/32/53/46/367325346.db2.gz XFUCFOITAOCZOR-VIFPVBQESA-N 1 2 246.314 2.012 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+](C)Cc2cccc(O)c2)[nH]1 ZINC000581296720 367325350 /nfs/dbraw/zinc/32/53/50/367325350.db2.gz XFUCFOITAOCZOR-VIFPVBQESA-N 1 2 246.314 2.012 20 0 BEADLO Cn1c(C[N@H+](C)C2CC2)nnc1-c1ccccc1 ZINC000195514539 367366321 /nfs/dbraw/zinc/36/63/21/367366321.db2.gz AYIKKNIECZAYQI-UHFFFAOYSA-N 1 2 242.326 2.076 20 0 BEADLO Cn1c(C[N@@H+](C)C2CC2)nnc1-c1ccccc1 ZINC000195514539 367366325 /nfs/dbraw/zinc/36/63/25/367366325.db2.gz AYIKKNIECZAYQI-UHFFFAOYSA-N 1 2 242.326 2.076 20 0 BEADLO Cc1ncsc1C[NH2+]CC(C)(F)F ZINC000382147888 367490597 /nfs/dbraw/zinc/49/05/97/367490597.db2.gz OMQYXIYHZTWRAY-UHFFFAOYSA-N 1 2 206.261 2.196 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CCC[C@H](C)[C@H]1C ZINC000581616753 367636002 /nfs/dbraw/zinc/63/60/02/367636002.db2.gz XHGPFHHRZGBKRC-QJPTWQEYSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CCC[C@H](C)[C@H]1C ZINC000581616753 367636004 /nfs/dbraw/zinc/63/60/04/367636004.db2.gz XHGPFHHRZGBKRC-QJPTWQEYSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H](NC(=O)C1=CC[C@H](C)CC1)c1[nH]cc[nH+]1 ZINC000581618075 367638358 /nfs/dbraw/zinc/63/83/58/367638358.db2.gz PCUHLMKRYQQAPN-VHSXEESVSA-N 1 2 233.315 2.333 20 0 BEADLO Cc1cc(N2CCC[C@H](O)[C@H]2C)nc(C(C)C)[nH+]1 ZINC000385016697 367772083 /nfs/dbraw/zinc/77/20/83/367772083.db2.gz NXROFOLQDGRRMB-NEPJUHHUSA-N 1 2 249.358 2.258 20 0 BEADLO C[C@@H](CC(=O)N1CC[C@@H](C)[C@H](C)C1)n1cc[nH+]c1 ZINC000581888951 367878035 /nfs/dbraw/zinc/87/80/35/367878035.db2.gz ZXWIGIOXQYZLGN-UPJWGTAASA-N 1 2 249.358 2.339 20 0 BEADLO C[C@H](CC(=O)N(C)[C@H](C)C1CC1)n1cc[nH+]c1 ZINC000581827493 367834081 /nfs/dbraw/zinc/83/40/81/367834081.db2.gz TWPXBLBNKJIUPU-GHMZBOCLSA-N 1 2 235.331 2.091 20 0 BEADLO C[C@@H](CC(=O)N(C)[C@@H](C)C1CC1)n1cc[nH+]c1 ZINC000581827495 367835040 /nfs/dbraw/zinc/83/50/40/367835040.db2.gz TWPXBLBNKJIUPU-QWRGUYRKSA-N 1 2 235.331 2.091 20 0 BEADLO Cc1cc([NH2+]CC2(C)CC2)ccc1-n1cnnn1 ZINC000581860024 367846278 /nfs/dbraw/zinc/84/62/78/367846278.db2.gz ZAQGRXNZGZXLRY-UHFFFAOYSA-N 1 2 243.314 2.183 20 0 BEADLO CCn1cc(C[N@H+](C)Cc2ccncc2F)cn1 ZINC000581924682 367938387 /nfs/dbraw/zinc/93/83/87/367938387.db2.gz WGXHVXMSCHREEE-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO CCn1cc(C[N@@H+](C)Cc2ccncc2F)cn1 ZINC000581924682 367938392 /nfs/dbraw/zinc/93/83/92/367938392.db2.gz WGXHVXMSCHREEE-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO CC[C@@]1(C)CCN(c2cc(CO)cc[nH+]2)C1 ZINC000399268362 368061886 /nfs/dbraw/zinc/06/18/86/368061886.db2.gz GJEIEQIJEJHFBD-ZDUSSCGKSA-N 1 2 220.316 2.200 20 0 BEADLO CN(C)c1c[nH+]cc(NCc2ccco2)c1 ZINC000630957299 368155424 /nfs/dbraw/zinc/15/54/24/368155424.db2.gz PZHAPNBHQWHOGP-UHFFFAOYSA-N 1 2 217.272 2.353 20 0 BEADLO CCN(Cc1cc(OC)cc[nH+]1)CC(F)(F)F ZINC000269491638 169904545 /nfs/dbraw/zinc/90/45/45/169904545.db2.gz ZAUOCYSVJPKLGO-UHFFFAOYSA-N 1 2 248.248 2.474 20 0 BEADLO CCc1nocc1CNc1c[nH+]cc(N(C)C)c1 ZINC000630956830 368152828 /nfs/dbraw/zinc/15/28/28/368152828.db2.gz WXRNXIOFQJFDMW-UHFFFAOYSA-N 1 2 246.314 2.310 20 0 BEADLO COc1ccc(C)cc1C[N@@H+]1CCOC[C@H]1C ZINC000046774886 368449816 /nfs/dbraw/zinc/44/98/16/368449816.db2.gz AWNUKZWAGWXLDG-GFCCVEGCSA-N 1 2 235.327 2.224 20 0 BEADLO COc1ccc(C)cc1C[N@H+]1CCOC[C@H]1C ZINC000046774886 368449821 /nfs/dbraw/zinc/44/98/21/368449821.db2.gz AWNUKZWAGWXLDG-GFCCVEGCSA-N 1 2 235.327 2.224 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccc(F)cc2)CCO1 ZINC000045751978 368430277 /nfs/dbraw/zinc/43/02/77/368430277.db2.gz AGFSMBLHQFXCTP-CYBMUJFWSA-N 1 2 223.291 2.437 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccc(F)cc2)CCO1 ZINC000045751978 368430281 /nfs/dbraw/zinc/43/02/81/368430281.db2.gz AGFSMBLHQFXCTP-CYBMUJFWSA-N 1 2 223.291 2.437 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)C1=CC[C@H](C)CC1 ZINC000454747769 202842357 /nfs/dbraw/zinc/84/23/57/202842357.db2.gz CJJCZFRWDYVHOR-RYUDHWBXSA-N 1 2 247.342 2.134 20 0 BEADLO Cc1cccc(C(=O)N(C)Cc2[nH+]ccn2C)c1 ZINC000061512772 368564069 /nfs/dbraw/zinc/56/40/69/368564069.db2.gz HHLHQOQHBBIZJP-UHFFFAOYSA-N 1 2 243.310 2.001 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)N[C@H]2C[C@@H](C)n3cc[nH+]c32)C1 ZINC000456437199 202944163 /nfs/dbraw/zinc/94/41/63/202944163.db2.gz WVLSDEDTCNZLJM-WYUUTHIRSA-N 1 2 247.342 2.441 20 0 BEADLO O=C(CC1CCCC1)NCCNc1cccc[nH+]1 ZINC000063707132 368592731 /nfs/dbraw/zinc/59/27/31/368592731.db2.gz PIJHBZYMENLFOG-UHFFFAOYSA-N 1 2 247.342 2.190 20 0 BEADLO Cc1ccc2c(c1C)OC[C@H]2[NH2+]Cc1ncc[nH]1 ZINC000066594058 368655168 /nfs/dbraw/zinc/65/51/68/368655168.db2.gz RGLAQGFJUTWTIF-GFCCVEGCSA-N 1 2 243.310 2.250 20 0 BEADLO C[C@H]1CCCC[C@]1(C)NC(=O)CCc1[nH]cc[nH+]1 ZINC000457237414 203023521 /nfs/dbraw/zinc/02/35/21/203023521.db2.gz CMKFOWOZUSVZPB-FZMZJTMJSA-N 1 2 249.358 2.427 20 0 BEADLO Cn1ccnc1C[N@H+](C)Cc1ccccc1 ZINC000070923610 368766891 /nfs/dbraw/zinc/76/68/91/368766891.db2.gz UUFZNGNJMKMALR-UHFFFAOYSA-N 1 2 215.300 2.052 20 0 BEADLO Cn1ccnc1C[N@@H+](C)Cc1ccccc1 ZINC000070923610 368766895 /nfs/dbraw/zinc/76/68/95/368766895.db2.gz UUFZNGNJMKMALR-UHFFFAOYSA-N 1 2 215.300 2.052 20 0 BEADLO CC(C)[C@H](C)CC(=O)NCCCn1cc[nH+]c1 ZINC000069367674 368752812 /nfs/dbraw/zinc/75/28/12/368752812.db2.gz IPPQFPPQUIDHHG-GFCCVEGCSA-N 1 2 237.347 2.072 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)C1C(C)(C)C1(C)C ZINC000073352744 368803138 /nfs/dbraw/zinc/80/31/38/368803138.db2.gz SJBRDFDNMHXFHZ-UHFFFAOYSA-N 1 2 249.358 2.061 20 0 BEADLO CC(C)[C@H]1CCC[C@H](NC(=O)Cn2cc[nH+]c2)C1 ZINC000073387418 368804220 /nfs/dbraw/zinc/80/42/20/368804220.db2.gz LVUOJJRDPYZFOD-STQMWFEESA-N 1 2 249.358 2.214 20 0 BEADLO CCC[C@@]1(C)CCCN(C(=O)Cn2cc[nH+]c2)C1 ZINC000074195113 368833075 /nfs/dbraw/zinc/83/30/75/368833075.db2.gz MGGQDOMLFPAWKG-AWEZNQCLSA-N 1 2 249.358 2.312 20 0 BEADLO O=C(Cn1cc[nH+]c1)N1CCC[C@@H]1C1CCCC1 ZINC000073016635 368790247 /nfs/dbraw/zinc/79/02/47/368790247.db2.gz FRDJEWKAXFGHAV-CYBMUJFWSA-N 1 2 247.342 2.064 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)C1CC2(CC2)C1 ZINC000615960202 368791388 /nfs/dbraw/zinc/79/13/88/368791388.db2.gz KDSVSWJDHDMKRK-SNVBAGLBSA-N 1 2 247.342 2.270 20 0 BEADLO CCOc1ccccc1C[NH2+]Cc1ccn(C)n1 ZINC000112342264 368870784 /nfs/dbraw/zinc/87/07/84/368870784.db2.gz KHCJFEBVTJAPRA-UHFFFAOYSA-N 1 2 245.326 2.109 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1[C@H](C)CCC1(C)C ZINC000616164547 368999347 /nfs/dbraw/zinc/99/93/47/368999347.db2.gz FDHMVANATMPWSC-SECBINFHSA-N 1 2 235.331 2.050 20 0 BEADLO CC(C)(C)C1CC(C(=O)NCCn2cc[nH+]c2)C1 ZINC000457436981 203063176 /nfs/dbraw/zinc/06/31/76/203063176.db2.gz HZHZNLIEOMEYAP-UHFFFAOYSA-N 1 2 249.358 2.072 20 0 BEADLO CCC1(CC)CCCN(C(=O)Cn2cc[nH+]c2)C1 ZINC000618668626 369193990 /nfs/dbraw/zinc/19/39/90/369193990.db2.gz WPEAXZCAFNYAII-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO CCC[C@@H](NC(=O)CCc1[nH]cc[nH+]1)C1CCC1 ZINC000458300474 203157597 /nfs/dbraw/zinc/15/75/97/203157597.db2.gz BVRFUQQUPFWISV-GFCCVEGCSA-N 1 2 249.358 2.427 20 0 BEADLO Cc1cccn2c(NC(=O)[C@@H]3C[C@@H]3C)c[nH+]c12 ZINC000619011127 369257498 /nfs/dbraw/zinc/25/74/98/369257498.db2.gz PYNNQQILRPFYOK-VHSXEESVSA-N 1 2 229.283 2.237 20 0 BEADLO Cc1cccn2c(NC(=O)[C@H]3C[C@@H]3C)c[nH+]c12 ZINC000619011126 369257583 /nfs/dbraw/zinc/25/75/83/369257583.db2.gz PYNNQQILRPFYOK-UWVGGRQHSA-N 1 2 229.283 2.237 20 0 BEADLO COC1C[NH+](Cc2ccc3c(c2)CCCC3)C1 ZINC000459584015 203306375 /nfs/dbraw/zinc/30/63/75/203306375.db2.gz QPSJRDULNAUFHI-UHFFFAOYSA-N 1 2 231.339 2.396 20 0 BEADLO COc1ccc(C[NH+]2CC(C)(OC)C2)cc1C ZINC000459589802 203310448 /nfs/dbraw/zinc/31/04/48/203310448.db2.gz RHOPXZLLEPJEMB-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO CCOC1(C)C[NH+](Cc2cccc(F)c2)C1 ZINC000459605696 203314189 /nfs/dbraw/zinc/31/41/89/203314189.db2.gz DLAFGILWIZKWRY-UHFFFAOYSA-N 1 2 223.291 2.437 20 0 BEADLO C[C@H]([NH2+]Cc1cnc(C2CC2)nc1)C(C)(F)F ZINC000459572996 203303580 /nfs/dbraw/zinc/30/35/80/203303580.db2.gz REWYTCGILHPBRZ-QMMMGPOBSA-N 1 2 241.285 2.487 20 0 BEADLO CCC(F)(F)C[NH2+]Cc1ccc(OC)nc1 ZINC000623679215 369379161 /nfs/dbraw/zinc/37/91/61/369379161.db2.gz MMFQIMGBWARWNI-UHFFFAOYSA-N 1 2 230.258 2.225 20 0 BEADLO CCOC1(C)C[NH+](Cc2ccc(CC)o2)C1 ZINC000459616478 203315804 /nfs/dbraw/zinc/31/58/04/203315804.db2.gz GIYZQAPMLNBYPW-UHFFFAOYSA-N 1 2 223.316 2.453 20 0 BEADLO COCC1(C)C[NH+](Cc2cc(F)cc(F)c2)C1 ZINC000459618511 203317995 /nfs/dbraw/zinc/31/79/95/203317995.db2.gz CCUVABGYSGQWCV-UHFFFAOYSA-N 1 2 241.281 2.433 20 0 BEADLO CCOC1(C)C[NH+](Cc2ccc(C)cn2)C1 ZINC000459618416 203319947 /nfs/dbraw/zinc/31/99/47/203319947.db2.gz IMDKTPPQQCUCGQ-UHFFFAOYSA-N 1 2 220.316 2.001 20 0 BEADLO CCOC1(C)C[NH+](Cc2ccccc2F)C1 ZINC000459625001 203320842 /nfs/dbraw/zinc/32/08/42/203320842.db2.gz SFLFQEOOKARDBQ-UHFFFAOYSA-N 1 2 223.291 2.437 20 0 BEADLO Cn1cc(C[NH+]2CC(C)(CC(F)(F)F)C2)cn1 ZINC000459632804 203325082 /nfs/dbraw/zinc/32/50/82/203325082.db2.gz FPVAOADJTHVUET-UHFFFAOYSA-N 1 2 247.264 2.194 20 0 BEADLO Cc1n[nH]cc1C[NH+]1CC(C)(CC(F)(F)F)C1 ZINC000459644657 203328370 /nfs/dbraw/zinc/32/83/70/203328370.db2.gz XCZSWMAUOVJDRS-UHFFFAOYSA-N 1 2 247.264 2.492 20 0 BEADLO C[C@@H](NC(=O)C(C)(C)C(C)(F)F)c1[nH]cc[nH+]1 ZINC000406002895 369483881 /nfs/dbraw/zinc/48/38/81/369483881.db2.gz ZQIRHKOAXNFAND-SSDOTTSWSA-N 1 2 245.273 2.268 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@@H+]1C[C@H](C)CC(C)C ZINC000619621711 369497396 /nfs/dbraw/zinc/49/73/96/369497396.db2.gz DYPXETFYFBCTJG-WOPDTQHZSA-N 1 2 245.338 2.254 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@H+]1C[C@H](C)CC(C)C ZINC000619621711 369497401 /nfs/dbraw/zinc/49/74/01/369497401.db2.gz DYPXETFYFBCTJG-WOPDTQHZSA-N 1 2 245.338 2.254 20 0 BEADLO O=C(NCC1=CCCC1)c1ccc2[nH+]ccn2c1 ZINC000620006147 369661827 /nfs/dbraw/zinc/66/18/27/369661827.db2.gz WEUBTMAFEQBVCY-UHFFFAOYSA-N 1 2 241.294 2.174 20 0 BEADLO CC[C@@](C)(O)CNc1cc[nH+]c(C(C)C)n1 ZINC000110473758 369833409 /nfs/dbraw/zinc/83/34/09/369833409.db2.gz AJUXUVPPRRIIJE-GFCCVEGCSA-N 1 2 223.320 2.173 20 0 BEADLO CC[C@](C)(O)CNc1cc[nH+]c(C(C)C)n1 ZINC000110473756 369834151 /nfs/dbraw/zinc/83/41/51/369834151.db2.gz AJUXUVPPRRIIJE-LBPRGKRZSA-N 1 2 223.320 2.173 20 0 BEADLO CCC[C@H](C)N(C)C(=O)CCCn1cc[nH+]c1 ZINC000620500184 369896687 /nfs/dbraw/zinc/89/66/87/369896687.db2.gz YTZJLXRAPPYYRG-LBPRGKRZSA-N 1 2 237.347 2.310 20 0 BEADLO CCC(CC)CC(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620602908 369950590 /nfs/dbraw/zinc/95/05/90/369950590.db2.gz FVQNLWVSHOSZFJ-SNVBAGLBSA-N 1 2 237.347 2.424 20 0 BEADLO C[C@H](NC(=O)[C@H]1CC12CCCC2)c1[nH+]ccn1C ZINC000620603907 369951879 /nfs/dbraw/zinc/95/18/79/369951879.db2.gz OLLLUOGYFIXHCO-WDEREUQCSA-N 1 2 247.342 2.178 20 0 BEADLO C[C@@H](NC(=O)C[C@@H]1C=CCCC1)c1[nH+]ccn1C ZINC000620604573 369953059 /nfs/dbraw/zinc/95/30/59/369953059.db2.gz SQIDQDPBXYDDDL-VXGBXAGGSA-N 1 2 247.342 2.344 20 0 BEADLO Cc1cc(C)c(C(=O)N[C@H](C)c2[nH+]ccn2C)o1 ZINC000620604459 369953361 /nfs/dbraw/zinc/95/33/61/369953361.db2.gz TZMTYHSMBKTAMR-SNVBAGLBSA-N 1 2 247.298 2.121 20 0 BEADLO CCCC[C@@H](C)C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620606490 369953929 /nfs/dbraw/zinc/95/39/29/369953929.db2.gz UQKZMVSXJPDUEJ-GHMZBOCLSA-N 1 2 237.347 2.424 20 0 BEADLO CC[C@@H](C)CCC(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620607560 369955443 /nfs/dbraw/zinc/95/54/43/369955443.db2.gz IHZPSSYDJXRJEE-GHMZBOCLSA-N 1 2 237.347 2.424 20 0 BEADLO C[C@H](NC(=O)CCCC1CC1)c1[nH+]ccn1C ZINC000620606873 369956169 /nfs/dbraw/zinc/95/61/69/369956169.db2.gz ANQOJERYDLQQEO-JTQLQIEISA-N 1 2 235.331 2.178 20 0 BEADLO C[C@@H](NC(=O)CC1CC(C)(C)C1)c1[nH+]ccn1C ZINC000620608301 369956553 /nfs/dbraw/zinc/95/65/53/369956553.db2.gz NJXSTOPMFQUACR-SNVBAGLBSA-N 1 2 249.358 2.424 20 0 BEADLO C[C@H](NC(=O)[C@]1(C)CC=CCC1)c1[nH+]ccn1C ZINC000620609017 369956577 /nfs/dbraw/zinc/95/65/77/369956577.db2.gz AKHQLZPQTTZRFC-SMDDNHRTSA-N 1 2 247.342 2.344 20 0 BEADLO C[C@H](NC(=O)C[C@@H]1CC[C@H]2C[C@H]21)c1[nH+]ccn1C ZINC000620609557 369957098 /nfs/dbraw/zinc/95/70/98/369957098.db2.gz SOYZXWBRFOIANK-FIQHERPVSA-N 1 2 247.342 2.034 20 0 BEADLO C[C@H](NC(=O)[C@@]1(C)CCC[C@@H]1C)c1[nH+]ccn1C ZINC000620611179 369957862 /nfs/dbraw/zinc/95/78/62/369957862.db2.gz ZXKBGYWEZMEIAU-MJVIPROJSA-N 1 2 249.358 2.424 20 0 BEADLO C[C@H](NC(=O)[C@@H]1CC[C@@H](C)CC1)c1[nH+]ccn1C ZINC000620612068 369958070 /nfs/dbraw/zinc/95/80/70/369958070.db2.gz QOJGGUUJPDGWTJ-SRVKXCTJSA-N 1 2 249.358 2.424 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CCC1(C)C)c1[nH+]ccn1C ZINC000620612247 369958172 /nfs/dbraw/zinc/95/81/72/369958172.db2.gz SIHOPELHCRGUQD-ZJUUUORDSA-N 1 2 235.331 2.034 20 0 BEADLO CC[C@@H](OC)C(=O)Nc1ccn2cc(C)[nH+]c2c1 ZINC000620648884 369972005 /nfs/dbraw/zinc/97/20/05/369972005.db2.gz NPOZTRZJIWJHHT-LLVKDONJSA-N 1 2 247.298 2.006 20 0 BEADLO Cc1cn2ccc(NC(=O)CCCF)cc2[nH+]1 ZINC000620647929 369972652 /nfs/dbraw/zinc/97/26/52/369972652.db2.gz OCMYFJNYVRRCGU-UHFFFAOYSA-N 1 2 235.262 2.331 20 0 BEADLO CCC(CC)C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620596385 369947199 /nfs/dbraw/zinc/94/71/99/369947199.db2.gz OGPQIPVBXIMDFX-SECBINFHSA-N 1 2 223.320 2.034 20 0 BEADLO CN(C[C@@H]1CC1(C)C)C(=O)C(C)(C)c1c[nH+]c[nH]1 ZINC000621045179 370079706 /nfs/dbraw/zinc/07/97/06/370079706.db2.gz VVMBFGHKNHWOLO-JTQLQIEISA-N 1 2 249.358 2.192 20 0 BEADLO C[C@H](CC(=O)N(C)C[C@@H]1CC1(C)C)n1cc[nH+]c1 ZINC000621045615 370080971 /nfs/dbraw/zinc/08/09/71/370080971.db2.gz SNOWQLJHSSVJDL-NEPJUHHUSA-N 1 2 249.358 2.339 20 0 BEADLO C[C@@H](CC(=O)N(C)C[C@@H]1CC1(C)C)n1cc[nH+]c1 ZINC000621045617 370081024 /nfs/dbraw/zinc/08/10/24/370081024.db2.gz SNOWQLJHSSVJDL-RYUDHWBXSA-N 1 2 249.358 2.339 20 0 BEADLO CCc1cc(NCCOC2CCCC2)nc[nH+]1 ZINC000111639176 370169117 /nfs/dbraw/zinc/16/91/17/370169117.db2.gz KKLIMZCIUSLTTN-UHFFFAOYSA-N 1 2 235.331 2.410 20 0 BEADLO Cc1noc([C@H](C)[NH+]2C[C@@H](C)S[C@H](C)C2)n1 ZINC000075892764 370180000 /nfs/dbraw/zinc/18/00/00/370180000.db2.gz AWJXIDOXQPHVTA-HLTSFMKQSA-N 1 2 241.360 2.265 20 0 BEADLO Clc1cncc(C[NH+]2CCSCC2)c1 ZINC000621247812 370182002 /nfs/dbraw/zinc/18/20/02/370182002.db2.gz JNQVGDLXVINSKA-UHFFFAOYSA-N 1 2 228.748 2.284 20 0 BEADLO Clc1cncc(C[N@H+](C2CC2)C2COC2)c1 ZINC000621298460 370226125 /nfs/dbraw/zinc/22/61/25/370226125.db2.gz XVMQGIMXXFMJSD-UHFFFAOYSA-N 1 2 238.718 2.098 20 0 BEADLO Clc1cncc(C[N@@H+](C2CC2)C2COC2)c1 ZINC000621298460 370226129 /nfs/dbraw/zinc/22/61/29/370226129.db2.gz XVMQGIMXXFMJSD-UHFFFAOYSA-N 1 2 238.718 2.098 20 0 BEADLO COc1cc(CNc2cc(C)[nH+]cn2)ccc1O ZINC000112514032 370316580 /nfs/dbraw/zinc/31/65/80/370316580.db2.gz PCMMDLMHYNGJTI-UHFFFAOYSA-N 1 2 245.282 2.111 20 0 BEADLO CCOc1cncc(C[NH2+]Cc2cc(C)on2)c1 ZINC000621330925 370263607 /nfs/dbraw/zinc/26/36/07/370263607.db2.gz KDRNTLDMRICYPB-UHFFFAOYSA-N 1 2 247.298 2.067 20 0 BEADLO Cc1nccnc1C[NH2+]C(C)(C)c1nccs1 ZINC000621336338 370269868 /nfs/dbraw/zinc/26/98/68/370269868.db2.gz UGYVCSVEJZZQHP-UHFFFAOYSA-N 1 2 248.355 2.266 20 0 BEADLO CC[C@@H]([NH2+]Cc1nccnc1C)c1nccs1 ZINC000621336864 370271176 /nfs/dbraw/zinc/27/11/76/370271176.db2.gz BOGMNXSFTPSKCP-SNVBAGLBSA-N 1 2 248.355 2.482 20 0 BEADLO CCCc1ccc(C[NH2+]CC(F)(F)CO)s1 ZINC000621344656 370277498 /nfs/dbraw/zinc/27/74/98/370277498.db2.gz OUZZGQNFJFFDAF-UHFFFAOYSA-N 1 2 249.326 2.418 20 0 BEADLO FC1(F)C[C@@H]1CCNc1cc[nH+]c(C2CC2)n1 ZINC000621345777 370280092 /nfs/dbraw/zinc/28/00/92/370280092.db2.gz WKHGMGIWWKQJCT-VIFPVBQESA-N 1 2 239.269 2.233 20 0 BEADLO CCc1cc(NC[C@H]2CC2(C)C)nc[nH+]1 ZINC000226531270 370368119 /nfs/dbraw/zinc/36/81/19/370368119.db2.gz GSBFVKHVHSNNGC-SECBINFHSA-N 1 2 205.305 2.497 20 0 BEADLO CC1(C)CCC[N@@H+]1Cc1noc(C2CC2)n1 ZINC000077383076 370414638 /nfs/dbraw/zinc/41/46/38/370414638.db2.gz HXBFWPFUYWRXRP-UHFFFAOYSA-N 1 2 221.304 2.321 20 0 BEADLO CC1(C)CCC[N@H+]1Cc1noc(C2CC2)n1 ZINC000077383076 370414643 /nfs/dbraw/zinc/41/46/43/370414643.db2.gz HXBFWPFUYWRXRP-UHFFFAOYSA-N 1 2 221.304 2.321 20 0 BEADLO CCc1cc(NCc2ccc(O)c(F)c2)nc[nH+]1 ZINC000078020217 370516174 /nfs/dbraw/zinc/51/61/74/370516174.db2.gz HAALISJZXQTOOY-UHFFFAOYSA-N 1 2 247.273 2.496 20 0 BEADLO CC1(c2ccccc2)C[NH+](Cc2cocn2)C1 ZINC000621735455 370493608 /nfs/dbraw/zinc/49/36/08/370493608.db2.gz JRBFEESGOGNAJZ-UHFFFAOYSA-N 1 2 228.295 2.448 20 0 BEADLO c1nc(C[NH+]2CC(CC3CC3)C2)cs1 ZINC000621740562 370499336 /nfs/dbraw/zinc/49/93/36/370499336.db2.gz WSAHONPAYBZRFE-UHFFFAOYSA-N 1 2 208.330 2.375 20 0 BEADLO C[C@@H](c1ccco1)c1noc(Cn2cc[nH+]c2)n1 ZINC000621794421 370541936 /nfs/dbraw/zinc/54/19/36/370541936.db2.gz SYQPCFCDRHCJRF-VIFPVBQESA-N 1 2 244.254 2.059 20 0 BEADLO CC(C)=C[C@@H]1[C@@H](C(=O)NCc2[nH]cc[nH+]2)C1(C)C ZINC000114336443 370553908 /nfs/dbraw/zinc/55/39/08/370553908.db2.gz JTYMFIOIKZLSMB-PWSUYJOCSA-N 1 2 247.342 2.264 20 0 BEADLO CC[C@]1(C)CCN(C(=O)C(C)(C)c2c[nH+]c[nH]2)C1 ZINC000621911999 370595121 /nfs/dbraw/zinc/59/51/21/370595121.db2.gz WPCSICLEWHCDCL-CQSZACIVSA-N 1 2 249.358 2.336 20 0 BEADLO CCCC1(CNC(=O)C(C)(C)c2c[nH]c[nH+]2)CC1 ZINC000621913294 370596024 /nfs/dbraw/zinc/59/60/24/370596024.db2.gz JBFYPCBQEWNPNU-UHFFFAOYSA-N 1 2 249.358 2.384 20 0 BEADLO CCc1cc(NCc2c(C)nn(C)c2C)nc[nH+]1 ZINC000078598044 370580197 /nfs/dbraw/zinc/58/01/97/370580197.db2.gz KKXNPJXBXWMNPX-UHFFFAOYSA-N 1 2 245.330 2.001 20 0 BEADLO C[C@@H]1CCN(C(=O)C(C)(C)c2c[nH+]c[nH]2)C[C@@H]1C ZINC000621938465 370609847 /nfs/dbraw/zinc/60/98/47/370609847.db2.gz BQQLIFMIDCMNSQ-MNOVXSKESA-N 1 2 249.358 2.192 20 0 BEADLO CCc1cc(NC2CCSCC2)nc[nH+]1 ZINC000123468111 371072292 /nfs/dbraw/zinc/07/22/92/371072292.db2.gz CMGTWMADVLEBRJ-UHFFFAOYSA-N 1 2 223.345 2.347 20 0 BEADLO c1cc2c(nc(C3CC3)[nH+]c2NCC2CC2)[nH]1 ZINC000631049944 371095773 /nfs/dbraw/zinc/09/57/73/371095773.db2.gz OZYFWUCHGSIMAW-UHFFFAOYSA-N 1 2 228.299 2.079 20 0 BEADLO COc1ccc[nH+]c1NC[C@H](C)Cn1cccn1 ZINC000623865669 371132780 /nfs/dbraw/zinc/13/27/80/371132780.db2.gz ZARVLICRAKZSKS-NSHDSACASA-N 1 2 246.314 2.035 20 0 BEADLO C[C@@H]1CN(c2cc3ccccc3c[nH+]2)CCO1 ZINC000631053721 371135970 /nfs/dbraw/zinc/13/59/70/371135970.db2.gz ZTMGOYJRNIPGJA-LLVKDONJSA-N 1 2 228.295 2.460 20 0 BEADLO c1cc(C[NH2+][C@@H]2CCCc3scnc32)n[nH]1 ZINC000623889514 371141471 /nfs/dbraw/zinc/14/14/71/371141471.db2.gz ORQSMYWFUCATBZ-SECBINFHSA-N 1 2 234.328 2.033 20 0 BEADLO Cn1nccc1C[NH2+][C@H]1CCCc2scnc21 ZINC000623861496 371128855 /nfs/dbraw/zinc/12/88/55/371128855.db2.gz ZLGUTOMGILNLCU-JTQLQIEISA-N 1 2 248.355 2.044 20 0 BEADLO CCCN(CC)C(=O)[C@H]1CCn2cc(C)[nH+]c2C1 ZINC000623931858 371160860 /nfs/dbraw/zinc/16/08/60/371160860.db2.gz NMHQQRFDNPPJMJ-LBPRGKRZSA-N 1 2 249.358 2.012 20 0 BEADLO C[C@H]([NH2+]C1(C(F)F)CC1)[C@@H]1CCCCO1 ZINC000623979135 371213457 /nfs/dbraw/zinc/21/34/57/371213457.db2.gz RECWLTWGYBTOBR-IUCAKERBSA-N 1 2 219.275 2.331 20 0 BEADLO CCCCc1cc(NCc2nccs2)nc[nH+]1 ZINC000631062578 371222499 /nfs/dbraw/zinc/22/24/99/371222499.db2.gz QSZBRBIXVPQUGG-UHFFFAOYSA-N 1 2 248.355 2.310 20 0 BEADLO COCCN(C)c1[nH+]c(C(C)C)nc2[nH]ccc21 ZINC000631068067 371283254 /nfs/dbraw/zinc/28/32/54/371283254.db2.gz LRDQTHBSYYYXEN-UHFFFAOYSA-N 1 2 248.330 2.164 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cocn2)c(F)c1 ZINC000631069764 371299095 /nfs/dbraw/zinc/29/90/95/371299095.db2.gz XIFDFJVGIQMZGF-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO Cc1cc(C[NH2+]Cc2cc(C(C)C)no2)on1 ZINC000631071967 371336369 /nfs/dbraw/zinc/33/63/69/371336369.db2.gz QFGAFLUMBRUFHT-UHFFFAOYSA-N 1 2 235.287 2.384 20 0 BEADLO CCCCc1cc(NC[C@H]2CCCCO2)nc[nH+]1 ZINC000631072243 371336965 /nfs/dbraw/zinc/33/69/65/371336965.db2.gz CVPGELULAIIZGT-CYBMUJFWSA-N 1 2 249.358 2.222 20 0 BEADLO CCC(F)(F)C[NH2+][C@H](C)c1cn(C)nc1C ZINC000624147856 371343040 /nfs/dbraw/zinc/34/30/40/371343040.db2.gz NDNFZSYCZPECDN-MRVPVSSYSA-N 1 2 231.290 2.424 20 0 BEADLO CCC(F)(F)C[NH2+][C@@H](C)c1ccnn1C ZINC000624148911 371345392 /nfs/dbraw/zinc/34/53/92/371345392.db2.gz QXWHWPSOYBZNTR-QMMMGPOBSA-N 1 2 217.263 2.116 20 0 BEADLO CCC(F)(F)C[NH2+][C@H](C)c1cn[nH]c1 ZINC000624148709 371346359 /nfs/dbraw/zinc/34/63/59/371346359.db2.gz LVOLKNHIEQMAKB-SSDOTTSWSA-N 1 2 203.236 2.106 20 0 BEADLO COc1ccc[nH+]c1N(C)Cc1ccc(C)cn1 ZINC000624151880 371348713 /nfs/dbraw/zinc/34/87/13/371348713.db2.gz DWFCROOBBXVRRH-UHFFFAOYSA-N 1 2 243.310 2.430 20 0 BEADLO COc1ccc[nH+]c1N1CC[C@@]2(C1)CCCOC2 ZINC000624192508 371380382 /nfs/dbraw/zinc/38/03/82/371380382.db2.gz ZRQRSYUKHFMNSH-CQSZACIVSA-N 1 2 248.326 2.097 20 0 BEADLO CCc1cc(N2CCC(=O)CC(C)(C)C2)nc[nH+]1 ZINC000624529400 371533097 /nfs/dbraw/zinc/53/30/97/371533097.db2.gz SQHYDPBNQBDEPP-UHFFFAOYSA-N 1 2 247.342 2.235 20 0 BEADLO COc1ccc[nH+]c1N1CCO[C@@](C)(C2CC2)C1 ZINC000624385385 371496841 /nfs/dbraw/zinc/49/68/41/371496841.db2.gz BCEFTROWCAWLBF-CQSZACIVSA-N 1 2 248.326 2.096 20 0 BEADLO C[C@H]1CCC[C@@H]1CC(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627369737 371588318 /nfs/dbraw/zinc/58/83/18/371588318.db2.gz BKGHDRCUANAILV-WDEREUQCSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@H]1CCC[C@@H]1CC(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627369737 371588324 /nfs/dbraw/zinc/58/83/24/371588324.db2.gz BKGHDRCUANAILV-WDEREUQCSA-N 1 2 247.342 2.121 20 0 BEADLO COC(=O)[C@@H]([NH2+][C@@H]1CCc2ccccc21)C1CC1 ZINC000227768043 371933190 /nfs/dbraw/zinc/93/31/90/371933190.db2.gz RAAAGDAEZDQPCU-KGLIPLIRSA-N 1 2 245.322 2.215 20 0 BEADLO COCc1nc(C[NH2+]Cc2ccoc2)cs1 ZINC000164443712 372149653 /nfs/dbraw/zinc/14/96/53/372149653.db2.gz DJQLVDJFIGSMPU-UHFFFAOYSA-N 1 2 238.312 2.172 20 0 BEADLO Cn1nc2c(c1C[NH2+]CC(C)(F)F)CCCC2 ZINC000631144003 372208344 /nfs/dbraw/zinc/20/83/44/372208344.db2.gz XOAHEYKBZGRTEM-UHFFFAOYSA-N 1 2 243.301 2.044 20 0 BEADLO CCCCc1cc(N(C)Cc2[nH]cc[nH+]2)ncn1 ZINC000631121324 372203265 /nfs/dbraw/zinc/20/32/65/372203265.db2.gz QERNPAUHGLRWLZ-UHFFFAOYSA-N 1 2 245.330 2.179 20 0 BEADLO O=C(CC1=CCCCC1)NC1=[NH+]CCS1 ZINC000106591194 181884302 /nfs/dbraw/zinc/88/43/02/181884302.db2.gz QAGPRCWIQKYJEL-UHFFFAOYSA-N 1 2 224.329 2.096 20 0 BEADLO Cc1[nH]c(CN[C@@H]2C[C@H]2C(F)(F)F)[nH+]c1C ZINC000631261665 372266900 /nfs/dbraw/zinc/26/69/00/372266900.db2.gz JOEWCTFBSRIQHM-HTQZYQBOSA-N 1 2 233.237 2.067 20 0 BEADLO CCCCc1cc(N[C@H](CO)C2CCC2)nc[nH+]1 ZINC000631350908 372307685 /nfs/dbraw/zinc/30/76/85/372307685.db2.gz HTVDIKFEMKRSOS-CYBMUJFWSA-N 1 2 249.358 2.392 20 0 BEADLO Cc1cc(Nc2cncc(N(C)C)c2)nc(C)[nH+]1 ZINC000631432376 372360102 /nfs/dbraw/zinc/36/01/02/372360102.db2.gz NQLPSOCJTRDVBZ-UHFFFAOYSA-N 1 2 243.314 2.298 20 0 BEADLO CC(C)(F)CNc1cc(NC2CC2)nc[nH+]1 ZINC000631406187 372340397 /nfs/dbraw/zinc/34/03/97/372340397.db2.gz HRQWCHSNRMMAPB-UHFFFAOYSA-N 1 2 224.283 2.211 20 0 BEADLO CC(C)(F)CNc1cc(NC2CC2)[nH+]cn1 ZINC000631406187 372340400 /nfs/dbraw/zinc/34/04/00/372340400.db2.gz HRQWCHSNRMMAPB-UHFFFAOYSA-N 1 2 224.283 2.211 20 0 BEADLO CC(C)(F)CNc1[nH+]c(C2CC2)nc2[nH]ccc21 ZINC000631407064 372341278 /nfs/dbraw/zinc/34/12/78/372341278.db2.gz ZBXCCPZOLVLKDR-UHFFFAOYSA-N 1 2 248.305 2.417 20 0 BEADLO CCC[C@H](CCO)Nc1cc(CC)[nH+]cn1 ZINC000631425289 372354808 /nfs/dbraw/zinc/35/48/08/372354808.db2.gz BALXDNQZJCLVNS-LLVKDONJSA-N 1 2 223.320 2.002 20 0 BEADLO CCC[C@@H](CCO)Nc1cc(CC)[nH+]cn1 ZINC000631425290 372355126 /nfs/dbraw/zinc/35/51/26/372355126.db2.gz BALXDNQZJCLVNS-NSHDSACASA-N 1 2 223.320 2.002 20 0 BEADLO CC[C@@]1(O)CCCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000631485245 372388685 /nfs/dbraw/zinc/38/86/85/372388685.db2.gz AFKMVTVWYPLBND-CQSZACIVSA-N 1 2 245.326 2.304 20 0 BEADLO COc1ccc2c(c1)CC[C@H]2[NH2+]Cc1ccn[nH]1 ZINC000631579592 372439103 /nfs/dbraw/zinc/43/91/03/372439103.db2.gz HZKVLHHYPXTTLA-CQSZACIVSA-N 1 2 243.310 2.195 20 0 BEADLO CC[C@H](CO)Nc1ccc2cc(OC)ccc2[nH+]1 ZINC000172971898 373113160 /nfs/dbraw/zinc/11/31/60/373113160.db2.gz SOJLOIXLKMJUOS-LLVKDONJSA-N 1 2 246.310 2.426 20 0 BEADLO O=C(NCCCCNc1cccc[nH+]1)C1CCC1 ZINC000264098115 182164264 /nfs/dbraw/zinc/16/42/64/182164264.db2.gz BRCLEZMBTWXYGT-UHFFFAOYSA-N 1 2 247.342 2.190 20 0 BEADLO O=C(CCCn1cc[nH+]c1)N[C@@]12C[C@@H]1CCCC2 ZINC000634079999 373943570 /nfs/dbraw/zinc/94/35/70/373943570.db2.gz KDNRGVDVXCDXGO-JSGCOSHPSA-N 1 2 247.342 2.112 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@]12C[C@@H]1CCCC2 ZINC000634086317 373953731 /nfs/dbraw/zinc/95/37/31/373953731.db2.gz MUKDCSFMEDGAII-SUNKGSAMSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@]12C[C@@H]1CCCC2 ZINC000634086317 373953736 /nfs/dbraw/zinc/95/37/36/373953736.db2.gz MUKDCSFMEDGAII-SUNKGSAMSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H](CC(=O)N[C@@]12C[C@@H]1CCCC2)n1cc[nH+]c1 ZINC000634087460 373955010 /nfs/dbraw/zinc/95/50/10/373955010.db2.gz ROCATORUPNRALA-DYEKYZERSA-N 1 2 247.342 2.283 20 0 BEADLO COC(=O)[C@@H]([NH2+]Cc1ccccc1)C(C)(C)C ZINC000041121198 374112765 /nfs/dbraw/zinc/11/27/65/374112765.db2.gz MOGFCNWFZDTSOT-GFCCVEGCSA-N 1 2 235.327 2.364 20 0 BEADLO Cc1nc(C)c(C[NH2+]Cc2nccs2)o1 ZINC000381873951 374149406 /nfs/dbraw/zinc/14/94/06/374149406.db2.gz LQHFPPYYGWVYLG-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO CC[C@H]([NH2+]CCCSCC(C)C)C(=O)OC ZINC000192861036 205969508 /nfs/dbraw/zinc/96/95/08/205969508.db2.gz PTJPAVVBHWYNCT-NSHDSACASA-N 1 2 247.404 2.307 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)[C@H]1C[C@@H]1C1CCCCC1 ZINC000120139370 182273210 /nfs/dbraw/zinc/27/32/10/182273210.db2.gz JYUANKFQPHLDHH-NEPJUHHUSA-N 1 2 247.342 2.242 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)C(C1CCC1)C1CCC1 ZINC000286210686 182271270 /nfs/dbraw/zinc/27/12/70/182271270.db2.gz YHMPEWCLAPBEMU-UHFFFAOYSA-N 1 2 247.342 2.242 20 0 BEADLO CC[C@H](F)C[NH2+][C@@H](CO)c1c(F)cccc1F ZINC000440482854 206078226 /nfs/dbraw/zinc/07/82/26/206078226.db2.gz DRUSTEDNRTVSOP-KWQFWETISA-N 1 2 247.260 2.336 20 0 BEADLO CC[N@H+](Cc1cc(F)c(F)c(F)c1)C1COC1 ZINC000449425440 206097405 /nfs/dbraw/zinc/09/74/05/206097405.db2.gz MSOQWCUKOCGFSI-UHFFFAOYSA-N 1 2 245.244 2.325 20 0 BEADLO CC[N@@H+](Cc1cc(F)c(F)c(F)c1)C1COC1 ZINC000449425440 206097409 /nfs/dbraw/zinc/09/74/09/206097409.db2.gz MSOQWCUKOCGFSI-UHFFFAOYSA-N 1 2 245.244 2.325 20 0 BEADLO CC(C)n1ccc(C[C@H](C)[NH2+]CC(F)F)n1 ZINC000459545481 206133043 /nfs/dbraw/zinc/13/30/43/206133043.db2.gz LUZVDDKBEDKFNG-VIFPVBQESA-N 1 2 231.290 2.250 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)c1cscn1 ZINC000355308633 182384997 /nfs/dbraw/zinc/38/49/97/182384997.db2.gz KPIJASIXHQOWSP-UHFFFAOYSA-N 1 2 244.279 2.043 20 0 BEADLO O=C(Nc1cc[nH+]cc1O)c1cccc(F)c1 ZINC000109890434 182387939 /nfs/dbraw/zinc/38/79/39/182387939.db2.gz BVBWHZVKAWTEJG-UHFFFAOYSA-N 1 2 232.214 2.179 20 0 BEADLO Cc1csc(C[NH2+][C@H](C)c2cncnc2C)n1 ZINC000522013433 259582304 /nfs/dbraw/zinc/58/23/04/259582304.db2.gz GSWPODPYPNLYEH-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO CCOCCC[N@H+](CC(F)F)C1CC1 ZINC000119387558 170371955 /nfs/dbraw/zinc/37/19/55/170371955.db2.gz VSZPAQVPFNHROV-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO CCOCCC[N@@H+](CC(F)F)C1CC1 ZINC000119387558 170371956 /nfs/dbraw/zinc/37/19/56/170371956.db2.gz VSZPAQVPFNHROV-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO OC1(CNc2cccc[nH+]2)Cc2ccccc2C1 ZINC000371714048 183021345 /nfs/dbraw/zinc/02/13/45/183021345.db2.gz RAEKHROYOHGBNT-UHFFFAOYSA-N 1 2 240.306 2.023 20 0 BEADLO CCCC[C@H]([NH2+]CC1(C(F)F)CC1)C(=O)OC ZINC000360619167 169011996 /nfs/dbraw/zinc/01/19/96/169011996.db2.gz LDCSKJXVMMXHAO-VIFPVBQESA-N 1 2 249.301 2.353 20 0 BEADLO CCCC[C@H]([NH2+][C@H]1CSC1(C)C)C(=O)OC ZINC000310038177 169013314 /nfs/dbraw/zinc/01/33/14/169013314.db2.gz VVSGGUDIACYOGI-UWVGGRQHSA-N 1 2 245.388 2.202 20 0 BEADLO O[C@@H](CNc1cccc[nH+]1)c1ccccc1F ZINC000301499968 183181544 /nfs/dbraw/zinc/18/15/44/183181544.db2.gz DFMITXFNRABPQH-LBPRGKRZSA-N 1 2 232.258 2.366 20 0 BEADLO OCc1cccc(NCc2ccccc2)[nH+]1 ZINC000307699466 183168120 /nfs/dbraw/zinc/16/81/20/183168120.db2.gz OQEHZSWZAMJHSF-UHFFFAOYSA-N 1 2 214.268 2.186 20 0 BEADLO O[C@@H](CCn1cc[nH+]c1)c1ccccc1 ZINC000034061517 183175030 /nfs/dbraw/zinc/17/50/30/183175030.db2.gz WNXUJXHLJQCNMZ-LBPRGKRZSA-N 1 2 202.257 2.007 20 0 BEADLO O[C@@]1(CNc2cccc[nH+]2)CCc2ccccc21 ZINC000377135660 183216054 /nfs/dbraw/zinc/21/60/54/183216054.db2.gz FTHJXXFMJXCEIP-OAHLLOKOSA-N 1 2 240.306 2.328 20 0 BEADLO O[C@H]1CCN(c2cc[nH+]c3c(Cl)cccc23)C1 ZINC000287723793 183240750 /nfs/dbraw/zinc/24/07/50/183240750.db2.gz FZJJIOBBBWYFEK-VIFPVBQESA-N 1 2 248.713 2.459 20 0 BEADLO O[C@H]1C[C@@H](Nc2cc(C(F)(F)F)cc[nH+]2)C1 ZINC000295493487 183247588 /nfs/dbraw/zinc/24/75/88/183247588.db2.gz ZONUJHKMPFVBPJ-OCAPTIKFSA-N 1 2 232.205 2.036 20 0 BEADLO O[C@H]1CCCC[C@H]1CNc1cc[nH+]c(C2CC2)n1 ZINC000156858466 183232505 /nfs/dbraw/zinc/23/25/05/183232505.db2.gz SUOZBZORQZQEIM-RYUDHWBXSA-N 1 2 247.342 2.317 20 0 BEADLO CCCN(CC1CC1)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000276675488 169133310 /nfs/dbraw/zinc/13/33/10/169133310.db2.gz ODWCMSSOFIJKEI-AATRIKPKSA-N 1 2 233.315 2.072 20 0 BEADLO CCC[N@H+](CCC[C@@H](C)O)CC(F)F ZINC000308566300 169155689 /nfs/dbraw/zinc/15/56/89/169155689.db2.gz HUXTYCSOTPIHJE-SECBINFHSA-N 1 2 209.280 2.125 20 0 BEADLO CCC[N@@H+](CCC[C@@H](C)O)CC(F)F ZINC000308566300 169155691 /nfs/dbraw/zinc/15/56/91/169155691.db2.gz HUXTYCSOTPIHJE-SECBINFHSA-N 1 2 209.280 2.125 20 0 BEADLO Oc1cccc2c1CC[C@H]2[NH2+]Cc1csnn1 ZINC000271890314 183296992 /nfs/dbraw/zinc/29/69/92/183296992.db2.gz RVBKQSNIAULVBH-LLVKDONJSA-N 1 2 247.323 2.021 20 0 BEADLO CCC[N@@H+]1CCOC[C@H]1c1nc(C)cs1 ZINC000189271099 169205483 /nfs/dbraw/zinc/20/54/83/169205483.db2.gz RNGREBKUEFPRFL-JTQLQIEISA-N 1 2 226.345 2.235 20 0 BEADLO CCC[N@H+]1CCOC[C@H]1c1nc(C)cs1 ZINC000189271099 169205485 /nfs/dbraw/zinc/20/54/85/169205485.db2.gz RNGREBKUEFPRFL-JTQLQIEISA-N 1 2 226.345 2.235 20 0 BEADLO c1cc(C[N@H+](Cc2ccncc2)C2CC2)on1 ZINC000272897000 183340713 /nfs/dbraw/zinc/34/07/13/183340713.db2.gz KZBAWNNSFAZNRL-UHFFFAOYSA-N 1 2 229.283 2.234 20 0 BEADLO c1cc(C[N@@H+](Cc2ccncc2)C2CC2)on1 ZINC000272897000 183340714 /nfs/dbraw/zinc/34/07/14/183340714.db2.gz KZBAWNNSFAZNRL-UHFFFAOYSA-N 1 2 229.283 2.234 20 0 BEADLO c1c[nH+]c(CNc2cccc(-c3nnco3)c2)[nH]1 ZINC000049714748 183359266 /nfs/dbraw/zinc/35/92/66/183359266.db2.gz RCEMJNNRIASHCY-UHFFFAOYSA-N 1 2 241.254 2.072 20 0 BEADLO c1cc(C[N@@H+]2CCOCC23CC3)cs1 ZINC000335904386 183344508 /nfs/dbraw/zinc/34/45/08/183344508.db2.gz MGPSHYVEFXTPOQ-UHFFFAOYSA-N 1 2 209.314 2.113 20 0 BEADLO c1cc(C[N@H+]2CCOCC23CC3)cs1 ZINC000335904386 183344510 /nfs/dbraw/zinc/34/45/10/183344510.db2.gz MGPSHYVEFXTPOQ-UHFFFAOYSA-N 1 2 209.314 2.113 20 0 BEADLO c1ncc(C[N@@H+]2CCC[C@H]2c2ccncc2)[nH]1 ZINC000188239874 183359573 /nfs/dbraw/zinc/35/95/73/183359573.db2.gz DCMGMQCYHJBEJE-ZDUSSCGKSA-N 1 2 228.299 2.142 20 0 BEADLO c1ncc(C[N@H+]2CCC[C@H]2c2ccncc2)[nH]1 ZINC000188239874 183359576 /nfs/dbraw/zinc/35/95/76/183359576.db2.gz DCMGMQCYHJBEJE-ZDUSSCGKSA-N 1 2 228.299 2.142 20 0 BEADLO c1ccc(-c2noc([C@@H]3CSC[NH2+]3)n2)cc1 ZINC000229002681 183385556 /nfs/dbraw/zinc/38/55/56/183385556.db2.gz QEVUCQYUKRIQSM-VIFPVBQESA-N 1 2 233.296 2.072 20 0 BEADLO c1cc2cc(C[NH+]3CCOCC3)ccc2o1 ZINC000289159727 183374316 /nfs/dbraw/zinc/37/43/16/183374316.db2.gz QZQPMDUZIUDRCY-UHFFFAOYSA-N 1 2 217.268 2.265 20 0 BEADLO c1cn(Cc2cnc(-c3ccccc3)nc2)c[nH+]1 ZINC000096282879 183383931 /nfs/dbraw/zinc/38/39/31/183383931.db2.gz CDVPUTZXLIZUCS-UHFFFAOYSA-N 1 2 236.278 2.388 20 0 BEADLO c1cnn(-c2ccccc2NCc2[nH]cc[nH+]2)c1 ZINC000049715111 183386719 /nfs/dbraw/zinc/38/67/19/183386719.db2.gz JZQRNKICSSGVFP-UHFFFAOYSA-N 1 2 239.282 2.208 20 0 BEADLO CCC[NH2+][C@@H](Cc1ccccc1)C(=O)OCC ZINC000037513689 169279793 /nfs/dbraw/zinc/27/97/93/169279793.db2.gz KVVJYJGMSQBLSK-ZDUSSCGKSA-N 1 2 235.327 2.160 20 0 BEADLO CCCSCC(=O)Nc1cc[nH+]c(C)c1 ZINC000069533539 169338393 /nfs/dbraw/zinc/33/83/93/169338393.db2.gz CQCOPTQLQXKQQX-UHFFFAOYSA-N 1 2 224.329 2.472 20 0 BEADLO CCC[C@@H](C)C(=O)NCCNc1cccc[nH+]1 ZINC000265059274 169350538 /nfs/dbraw/zinc/35/05/38/169350538.db2.gz LLWWYTGFZJMDSY-LLVKDONJSA-N 1 2 235.331 2.046 20 0 BEADLO CCC[C@@H](C)C(=O)NC[C@H](C)Cn1cc[nH+]c1 ZINC000265778302 169350922 /nfs/dbraw/zinc/35/09/22/169350922.db2.gz GJHHEENMRVXIDS-NWDGAFQWSA-N 1 2 237.347 2.072 20 0 BEADLO CCC[C@@H](C)C(=O)Nc1ccc(N)[nH+]c1 ZINC000061680561 169353354 /nfs/dbraw/zinc/35/33/54/169353354.db2.gz ALLCVJJHOBHKMV-MRVPVSSYSA-N 1 2 207.277 2.039 20 0 BEADLO CCC[C@@H](C)C[NH2+][C@H](CC(F)F)C(=O)OC ZINC000336670217 169360609 /nfs/dbraw/zinc/36/06/09/169360609.db2.gz ABNUUWBJQXHXAU-RKDXNWHRSA-N 1 2 237.290 2.209 20 0 BEADLO CCC[C@@H](C)CNc1ccc(CO)c[nH+]1 ZINC000291625147 169360756 /nfs/dbraw/zinc/36/07/56/169360756.db2.gz RYIQWWDKHRUVHA-SNVBAGLBSA-N 1 2 208.305 2.422 20 0 BEADLO CCC[C@H]([NH2+]Cc1ccccc1C)C(=O)OC ZINC000354976952 169511773 /nfs/dbraw/zinc/51/17/73/169511773.db2.gz HVFUNCMDXWDLAU-ZDUSSCGKSA-N 1 2 235.327 2.426 20 0 BEADLO CC[C@@H](CC(=O)N1CC(n2cc[nH+]c2)C1)C(C)C ZINC000522258534 259625088 /nfs/dbraw/zinc/62/50/88/259625088.db2.gz KWVURFCOAZWWLY-LBPRGKRZSA-N 1 2 249.358 2.339 20 0 BEADLO Cc1cnc([C@H](C)[NH2+]Cc2c(C)nn(C)c2C)o1 ZINC000220931817 383826756 /nfs/dbraw/zinc/82/67/56/383826756.db2.gz SYTXRDJIINMSGI-JTQLQIEISA-N 1 2 248.330 2.184 20 0 BEADLO Cc1c[nH+]cc(N[C@@H]2C[C@@H](C)O[C@@H]2C)c1 ZINC000295863666 383867203 /nfs/dbraw/zinc/86/72/03/383867203.db2.gz WYORFOFJIGZRDH-CKYFFXLPSA-N 1 2 206.289 2.368 20 0 BEADLO CC(C)(C)c1csc(C[N@@H+]2CC[C@@H](O)C2)n1 ZINC000087371186 383833506 /nfs/dbraw/zinc/83/35/06/383833506.db2.gz LSLGMRQZNLOVAU-SECBINFHSA-N 1 2 240.372 2.007 20 0 BEADLO CC(C)(C)c1csc(C[N@H+]2CC[C@@H](O)C2)n1 ZINC000087371186 383833510 /nfs/dbraw/zinc/83/35/10/383833510.db2.gz LSLGMRQZNLOVAU-SECBINFHSA-N 1 2 240.372 2.007 20 0 BEADLO CCN(CC)c1ccc(NCc2cc[nH]n2)c[nH+]1 ZINC000037003740 383927667 /nfs/dbraw/zinc/92/76/67/383927667.db2.gz CDYCFOKWGHDPHH-UHFFFAOYSA-N 1 2 245.330 2.263 20 0 BEADLO CCc1ccc([C@@H](C)[NH2+][C@@H](C)C(=O)OC)cc1 ZINC000037073940 383934114 /nfs/dbraw/zinc/93/41/14/383934114.db2.gz PNSZGMKLSPPBTQ-MNOVXSKESA-N 1 2 235.327 2.461 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1C[NH2+]Cc1c[nH]nn1 ZINC000401762705 383958209 /nfs/dbraw/zinc/95/82/09/383958209.db2.gz SPXBMEJJQIBSAI-GHMZBOCLSA-N 1 2 222.336 2.111 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1C[NH2+]Cc1cn[nH]n1 ZINC000401762705 383958215 /nfs/dbraw/zinc/95/82/15/383958215.db2.gz SPXBMEJJQIBSAI-GHMZBOCLSA-N 1 2 222.336 2.111 20 0 BEADLO CCOCc1ccccc1C[NH2+]Cc1ccn[nH]1 ZINC000037762307 384010315 /nfs/dbraw/zinc/01/03/15/384010315.db2.gz NFOMFURHVJCQEL-UHFFFAOYSA-N 1 2 245.326 2.236 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CCS[C@H](C)C2)s1 ZINC000335852591 384012391 /nfs/dbraw/zinc/01/23/91/384012391.db2.gz UHHQLHSAIFBNHZ-HTQZYQBOSA-N 1 2 243.401 2.345 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CCS[C@H](C)C2)s1 ZINC000335852591 384012393 /nfs/dbraw/zinc/01/23/93/384012393.db2.gz UHHQLHSAIFBNHZ-HTQZYQBOSA-N 1 2 243.401 2.345 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCc1ccccc1 ZINC000558511621 384051074 /nfs/dbraw/zinc/05/10/74/384051074.db2.gz NZUJRBMDLGWZTL-UHFFFAOYSA-N 1 2 227.311 2.170 20 0 BEADLO CC(C)n1cc([C@@H](C)[NH2+]Cc2ccn(C)n2)cn1 ZINC000558467981 384028594 /nfs/dbraw/zinc/02/85/94/384028594.db2.gz MQKGZVAUBHWZSU-LLVKDONJSA-N 1 2 247.346 2.048 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@](C)(F)C2)oc1C ZINC000334340683 384030771 /nfs/dbraw/zinc/03/07/71/384030771.db2.gz NFRRBNNRJMJCKB-LLVKDONJSA-N 1 2 212.268 2.225 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@](C)(F)C2)oc1C ZINC000334340683 384030778 /nfs/dbraw/zinc/03/07/78/384030778.db2.gz NFRRBNNRJMJCKB-LLVKDONJSA-N 1 2 212.268 2.225 20 0 BEADLO Cc1ncc(C[NH2+]Cc2ccnn2CC(C)C)o1 ZINC000647217202 384036566 /nfs/dbraw/zinc/03/65/66/384036566.db2.gz DPTPRMRGJQXOLL-UHFFFAOYSA-N 1 2 248.330 2.125 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)Cc1ccc(F)c(F)c1 ZINC000114461150 384037899 /nfs/dbraw/zinc/03/78/99/384037899.db2.gz XUNNXFRVGWJRTM-UHFFFAOYSA-N 1 2 237.253 2.320 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)Cc1ccc(F)c(F)c1 ZINC000114461150 384037905 /nfs/dbraw/zinc/03/79/05/384037905.db2.gz XUNNXFRVGWJRTM-UHFFFAOYSA-N 1 2 237.253 2.320 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2ncn(C)n2)s1 ZINC000090969798 384086456 /nfs/dbraw/zinc/08/64/56/384086456.db2.gz KNKYIXIPNMPXNB-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1cccc(Cl)c1 ZINC000049956425 384069613 /nfs/dbraw/zinc/06/96/13/384069613.db2.gz KRDVIHULWGECEE-SECBINFHSA-N 1 2 241.718 2.333 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1cccc(Cl)c1 ZINC000049956425 384069619 /nfs/dbraw/zinc/06/96/19/384069619.db2.gz KRDVIHULWGECEE-SECBINFHSA-N 1 2 241.718 2.333 20 0 BEADLO Cc1cccc(C(=O)Nc2cc(C)[nH+]cc2C)n1 ZINC000560377861 384101392 /nfs/dbraw/zinc/10/13/92/384101392.db2.gz OOIFQTCDKSVAKT-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO C[N@H+](Cc1ncc[nH]1)Cc1ccccc1 ZINC000039435659 384115195 /nfs/dbraw/zinc/11/51/95/384115195.db2.gz ODVUKJWFZTWGGP-UHFFFAOYSA-N 1 2 201.273 2.042 20 0 BEADLO C[N@@H+](Cc1ncc[nH]1)Cc1ccccc1 ZINC000039435659 384115198 /nfs/dbraw/zinc/11/51/98/384115198.db2.gz ODVUKJWFZTWGGP-UHFFFAOYSA-N 1 2 201.273 2.042 20 0 BEADLO CC[C@@H](Cc1ccccc1)[NH2+][C@@H](C)C(=O)OC ZINC000116384500 384131054 /nfs/dbraw/zinc/13/10/54/384131054.db2.gz HTEJEKCFBZISRP-AAEUAGOBSA-N 1 2 235.327 2.159 20 0 BEADLO CCCCNC(=O)Cn1c(C)[nH+]c2ccccc21 ZINC000040295777 384131255 /nfs/dbraw/zinc/13/12/55/384131255.db2.gz WNCDWHJHLZGPTG-UHFFFAOYSA-N 1 2 245.326 2.261 20 0 BEADLO O=C(CCCc1ccccc1)NCc1[nH]cc[nH+]1 ZINC000070990285 384146207 /nfs/dbraw/zinc/14/62/07/384146207.db2.gz YNYUDLSIHCUCNE-UHFFFAOYSA-N 1 2 243.310 2.049 20 0 BEADLO Cc1ccc(C[N@H+]2CCOC[C@H]2C)cc1F ZINC000091815124 384148280 /nfs/dbraw/zinc/14/82/80/384148280.db2.gz OWJYBDWLFZRIRN-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ccc(C[N@@H+]2CCOC[C@H]2C)cc1F ZINC000091815124 384148286 /nfs/dbraw/zinc/14/82/86/384148286.db2.gz OWJYBDWLFZRIRN-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO CC[C@H]1CC[C@H](C)N1c1nc(C)[nH+]c(N(C)C)n1 ZINC000357297049 384149175 /nfs/dbraw/zinc/14/91/75/384149175.db2.gz YXEXSHQOSFVOSN-ONGXEEELSA-N 1 2 249.362 2.013 20 0 BEADLO CC[C@H]1CC[C@H](C)N1c1nc(N(C)C)nc(C)[nH+]1 ZINC000357297049 384149178 /nfs/dbraw/zinc/14/91/78/384149178.db2.gz YXEXSHQOSFVOSN-ONGXEEELSA-N 1 2 249.362 2.013 20 0 BEADLO Fc1ccc2c(c1)CCN(Cc1[nH]cc[nH+]1)C2 ZINC000091890542 384149459 /nfs/dbraw/zinc/14/94/59/384149459.db2.gz JEHMRNWYNOAUMN-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO Cn1cc(Cl)cc1C[N@H+](C)Cc1cc[nH]n1 ZINC000091931472 384153053 /nfs/dbraw/zinc/15/30/53/384153053.db2.gz XAJVRVBDUOCNGJ-UHFFFAOYSA-N 1 2 238.722 2.034 20 0 BEADLO Cn1cc(Cl)cc1C[N@@H+](C)Cc1cc[nH]n1 ZINC000091931472 384153056 /nfs/dbraw/zinc/15/30/56/384153056.db2.gz XAJVRVBDUOCNGJ-UHFFFAOYSA-N 1 2 238.722 2.034 20 0 BEADLO C[N@H+](CCOCc1ccccc1)Cc1cc[nH]n1 ZINC000091937129 384154532 /nfs/dbraw/zinc/15/45/32/384154532.db2.gz USDVPXGKDLPXES-UHFFFAOYSA-N 1 2 245.326 2.058 20 0 BEADLO C[N@@H+](CCOCc1ccccc1)Cc1cc[nH]n1 ZINC000091937129 384154536 /nfs/dbraw/zinc/15/45/36/384154536.db2.gz USDVPXGKDLPXES-UHFFFAOYSA-N 1 2 245.326 2.058 20 0 BEADLO O=C(CCCc1cccs1)NCc1[nH]cc[nH+]1 ZINC000070991180 384145552 /nfs/dbraw/zinc/14/55/52/384145552.db2.gz FICXNLQTULFUOT-UHFFFAOYSA-N 1 2 249.339 2.110 20 0 BEADLO CC[C@H]1CC[C@@H]1[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000309620893 384165524 /nfs/dbraw/zinc/16/55/24/384165524.db2.gz DFUSKTLBWFSTHX-VWYCJHECSA-N 1 2 227.348 2.495 20 0 BEADLO Cc1ncc(C[N@@H+]2CCOCC23CCC3)s1 ZINC000135531952 384166663 /nfs/dbraw/zinc/16/66/63/384166663.db2.gz SYJAVOFRCPMTAH-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO Cc1ncc(C[N@H+]2CCOCC23CCC3)s1 ZINC000135531952 384166667 /nfs/dbraw/zinc/16/66/67/384166667.db2.gz SYJAVOFRCPMTAH-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO Cc1ccnc(C[N@H+](C)Cc2cccc(O)c2)n1 ZINC000533759424 384178207 /nfs/dbraw/zinc/17/82/07/384178207.db2.gz SXFATGMOMZTWMH-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO Cc1ccnc(C[N@@H+](C)Cc2cccc(O)c2)n1 ZINC000533759424 384178211 /nfs/dbraw/zinc/17/82/11/384178211.db2.gz SXFATGMOMZTWMH-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO Cn1ncc2c1nc[nH+]c2NC1(C)CCCC1 ZINC000042187774 384205507 /nfs/dbraw/zinc/20/55/07/384205507.db2.gz ZTFJNVVFPRIHHP-UHFFFAOYSA-N 1 2 231.303 2.108 20 0 BEADLO CO[C@H]1CCCC[C@@H]1Nc1cc[nH+]c(C(C)C)n1 ZINC000361137795 384232296 /nfs/dbraw/zinc/23/22/96/384232296.db2.gz AZCCOXOIMBWVJY-RYUDHWBXSA-N 1 2 249.358 2.391 20 0 BEADLO Cc1n[nH]cc1C[N@@H+]1CCc2cccc(F)c2C1 ZINC000093454339 384238920 /nfs/dbraw/zinc/23/89/20/384238920.db2.gz QINFXJIBWOJXEF-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1n[nH]cc1C[N@H+]1CCc2cccc(F)c2C1 ZINC000093454339 384238924 /nfs/dbraw/zinc/23/89/24/384238924.db2.gz QINFXJIBWOJXEF-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2CCC[C@@H]3C[C@@H]32)cc[nH+]1 ZINC000518715736 384211259 /nfs/dbraw/zinc/21/12/59/384211259.db2.gz NZZKMSLVQKJSHC-WXHSDQCUSA-N 1 2 245.326 2.122 20 0 BEADLO CCc1cc(N[C@@H]2[C@H](C)O[C@H](C)[C@H]2C)nc[nH+]1 ZINC000624635068 384221436 /nfs/dbraw/zinc/22/14/36/384221436.db2.gz ZTDPNDDMCRQTDQ-DNJQJEMRSA-N 1 2 235.331 2.263 20 0 BEADLO CC[NH+](CC)[C@H](C(=O)OC)c1ccccc1F ZINC000072557601 384225616 /nfs/dbraw/zinc/22/56/16/384225616.db2.gz CURFDWUNYDHOAY-LBPRGKRZSA-N 1 2 239.290 2.382 20 0 BEADLO Cc1ccc(C(=O)N[C@H](C)Cn2cc[nH+]c2)cc1 ZINC000042511627 384226983 /nfs/dbraw/zinc/22/69/83/384226983.db2.gz LIZRITPHAANGIV-GFCCVEGCSA-N 1 2 243.310 2.010 20 0 BEADLO Cc1ccc(NCc2c[nH+]cn2C)cc1 ZINC000082416856 384227088 /nfs/dbraw/zinc/22/70/88/384227088.db2.gz GDDCIEJDTGPEEX-UHFFFAOYSA-N 1 2 201.273 2.341 20 0 BEADLO CC(C)OC(=O)[C@@H]1CCC[N@@H+]1Cc1ccco1 ZINC000093535754 384248706 /nfs/dbraw/zinc/24/87/06/384248706.db2.gz CPHCYOMZWMQJSG-LBPRGKRZSA-N 1 2 237.299 2.196 20 0 BEADLO CC(C)OC(=O)[C@@H]1CCC[N@H+]1Cc1ccco1 ZINC000093535754 384248710 /nfs/dbraw/zinc/24/87/10/384248710.db2.gz CPHCYOMZWMQJSG-LBPRGKRZSA-N 1 2 237.299 2.196 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCS[C@H](C(C)C)C1 ZINC000093869367 384277314 /nfs/dbraw/zinc/27/73/14/384277314.db2.gz CFVGVGSWPLJWSC-LBPRGKRZSA-N 1 2 239.388 2.292 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCS[C@H](C(C)C)C1 ZINC000093869367 384277322 /nfs/dbraw/zinc/27/73/22/384277322.db2.gz CFVGVGSWPLJWSC-LBPRGKRZSA-N 1 2 239.388 2.292 20 0 BEADLO CS[C@@H](C)CC(=O)Nc1cc[nH+]cc1C ZINC000119275642 384253415 /nfs/dbraw/zinc/25/34/15/384253415.db2.gz IBECCFCQRBIJOQ-VIFPVBQESA-N 1 2 224.329 2.470 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2C[C@H]3CC[C@@H]2O3)c(C)[nH+]1 ZINC000119354858 384261700 /nfs/dbraw/zinc/26/17/00/384261700.db2.gz WBZLITRSUZYCIO-MDZLAQPJSA-N 1 2 246.310 2.204 20 0 BEADLO Cn1cnnc1[C@H]1CCC[N@@H+]1Cc1ccsc1 ZINC000093810430 384272327 /nfs/dbraw/zinc/27/23/27/384272327.db2.gz OYISDGQSISPPJI-LLVKDONJSA-N 1 2 248.355 2.214 20 0 BEADLO Cn1cnnc1[C@H]1CCC[N@H+]1Cc1ccsc1 ZINC000093810430 384272333 /nfs/dbraw/zinc/27/23/33/384272333.db2.gz OYISDGQSISPPJI-LLVKDONJSA-N 1 2 248.355 2.214 20 0 BEADLO Cc1ccc(CCC(=O)N[C@H](C)c2[nH]cc[nH+]2)o1 ZINC000560698695 384305597 /nfs/dbraw/zinc/30/55/97/384305597.db2.gz RDDVVLFRMBZOIS-SNVBAGLBSA-N 1 2 247.298 2.121 20 0 BEADLO O=C1OCC[C@H]1[NH2+][C@@H]1CCC[C@@H]1c1ccccc1 ZINC000133841165 384313977 /nfs/dbraw/zinc/31/39/77/384313977.db2.gz RXOBDHXPNJRYJJ-MGPQQGTHSA-N 1 2 245.322 2.228 20 0 BEADLO Cn1c[nH+]cc1CN1CCc2ccc(F)cc2C1 ZINC000133856368 384317763 /nfs/dbraw/zinc/31/77/63/384317763.db2.gz DOCKAQHLEWIOHE-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1cncc1C[N@@H+]1CCc2ccc(F)cc2C1 ZINC000133856368 384317767 /nfs/dbraw/zinc/31/77/67/384317767.db2.gz DOCKAQHLEWIOHE-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1cncc1C[N@H+]1CCc2ccc(F)cc2C1 ZINC000133856368 384317774 /nfs/dbraw/zinc/31/77/74/384317774.db2.gz DOCKAQHLEWIOHE-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO CSC[C@H]1CCCN1c1cc[nH+]c(C)n1 ZINC000133322832 384285030 /nfs/dbraw/zinc/28/50/30/384285030.db2.gz JBEKVMSRDIJVLW-SNVBAGLBSA-N 1 2 223.345 2.117 20 0 BEADLO Cc1c[nH+]cc(NCc2ccc(CO)o2)c1 ZINC000119582890 384287265 /nfs/dbraw/zinc/28/72/65/384287265.db2.gz UEZBISLUQQZAFE-UHFFFAOYSA-N 1 2 218.256 2.087 20 0 BEADLO CCOc1ccccc1N(C)Cc1c[nH+]cn1C ZINC000159318048 384321763 /nfs/dbraw/zinc/32/17/63/384321763.db2.gz FIFRDPSYAYERCK-UHFFFAOYSA-N 1 2 245.326 2.455 20 0 BEADLO C[C@H]([NH2+]Cc1cnc(N(C)C)s1)C(C)(F)F ZINC000449416087 384302047 /nfs/dbraw/zinc/30/20/47/384302047.db2.gz RVMKPDRTHFKLDG-ZETCQYMHSA-N 1 2 249.330 2.342 20 0 BEADLO Cc1ccc(O)c(C[N@H+](C)Cc2cscn2)n1 ZINC000120211644 384339083 /nfs/dbraw/zinc/33/90/83/384339083.db2.gz DFRGRQLNLGPRDU-UHFFFAOYSA-N 1 2 249.339 2.184 20 0 BEADLO Cc1ccc(O)c(C[N@@H+](C)Cc2cscn2)n1 ZINC000120211644 384339089 /nfs/dbraw/zinc/33/90/89/384339089.db2.gz DFRGRQLNLGPRDU-UHFFFAOYSA-N 1 2 249.339 2.184 20 0 BEADLO CC[C@](C)(CNc1ccc(N(C)C)[nH+]c1)OC ZINC000319690459 384358083 /nfs/dbraw/zinc/35/80/83/384358083.db2.gz QXJPQIZUZIQHEB-CYBMUJFWSA-N 1 2 237.347 2.375 20 0 BEADLO C[C@H]1C[NH+](Cc2cnns2)C[C@H](C)C1(F)F ZINC000625652356 384366586 /nfs/dbraw/zinc/36/65/86/384366586.db2.gz IYTGDKRVBXZDSY-YUMQZZPRSA-N 1 2 247.314 2.261 20 0 BEADLO Cc1n[nH]c(C)c1NC(=O)Nc1cc[nH+]cc1C ZINC000120663976 384370690 /nfs/dbraw/zinc/37/06/90/384370690.db2.gz UHVKMAYCGOLQFC-UHFFFAOYSA-N 1 2 245.286 2.374 20 0 BEADLO Cc1nc(CNc2cc[nH+]cc2F)cs1 ZINC000335600024 384370814 /nfs/dbraw/zinc/37/08/14/384370814.db2.gz ZGFCYSNSIRFJKT-UHFFFAOYSA-N 1 2 223.276 2.020 20 0 BEADLO C[C@@H]1SCC[N@H+](Cc2ccon2)[C@H]1C ZINC000077317997 384402440 /nfs/dbraw/zinc/40/24/40/384402440.db2.gz SNTWSEGQJTZTGX-IUCAKERBSA-N 1 2 212.318 2.000 20 0 BEADLO C[C@@H]1SCC[N@@H+](Cc2ccon2)[C@H]1C ZINC000077317997 384402442 /nfs/dbraw/zinc/40/24/42/384402442.db2.gz SNTWSEGQJTZTGX-IUCAKERBSA-N 1 2 212.318 2.000 20 0 BEADLO c1ccc(N[C@@H]2CC23CCOCC3)[nH+]c1 ZINC000335647830 384425452 /nfs/dbraw/zinc/42/54/52/384425452.db2.gz DQKBPDRXYQLQMT-SNVBAGLBSA-N 1 2 204.273 2.063 20 0 BEADLO CC(C)c1nc(N[C@H]2CC[C@@H](F)C2)cc[nH+]1 ZINC000335607884 384386423 /nfs/dbraw/zinc/38/64/23/384386423.db2.gz KKHTUJSWKMPSRG-ZJUUUORDSA-N 1 2 223.295 2.324 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NCCC1CC1 ZINC000120859718 384386810 /nfs/dbraw/zinc/38/68/10/384386810.db2.gz PXJMRLCKIQIGIT-UHFFFAOYSA-N 1 2 219.288 2.312 20 0 BEADLO C[C@H]1C[NH+](Cc2cocn2)C[C@H](C)S1 ZINC000530516519 384389843 /nfs/dbraw/zinc/38/98/43/384389843.db2.gz RCVJCSCNVFWGLI-IUCAKERBSA-N 1 2 212.318 2.000 20 0 BEADLO CO[C@H](C)c1noc(C[NH+]2CCC(C)CC2)n1 ZINC000175062720 384390186 /nfs/dbraw/zinc/39/01/86/384390186.db2.gz ALZRTJIELKVHAF-SNVBAGLBSA-N 1 2 239.319 2.009 20 0 BEADLO F[C@@H]1CCC[C@@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000334351843 384446088 /nfs/dbraw/zinc/44/60/88/384446088.db2.gz GYHMHLRNXPEAFB-ZJUUUORDSA-N 1 2 221.279 2.078 20 0 BEADLO Cc1ccc(NC(=O)NCc2[nH]cc[nH+]2)c(F)c1 ZINC000119413226 384439563 /nfs/dbraw/zinc/43/95/63/384439563.db2.gz YLDKDJLLPREVNP-UHFFFAOYSA-N 1 2 248.261 2.179 20 0 BEADLO Cc1csc(SCCn2cc[nH+]c2)n1 ZINC000121854048 384442888 /nfs/dbraw/zinc/44/28/88/384442888.db2.gz AWURJUOMITXWKZ-UHFFFAOYSA-N 1 2 225.342 2.440 20 0 BEADLO CCC[C@H](C(=O)NCCn1cc[nH+]c1)C(C)C ZINC000135883249 384466808 /nfs/dbraw/zinc/46/68/08/384466808.db2.gz LKFSMWGRGATUBW-LBPRGKRZSA-N 1 2 237.347 2.072 20 0 BEADLO CCCC[NH2+][C@@H](C(=O)OC)c1ccccc1 ZINC000047979068 384471033 /nfs/dbraw/zinc/47/10/33/384471033.db2.gz FYQPIKBXSWVXMT-GFCCVEGCSA-N 1 2 221.300 2.290 20 0 BEADLO OCCNc1cc[nH+]c2c(Cl)cccc12 ZINC000238707760 384485988 /nfs/dbraw/zinc/48/59/88/384485988.db2.gz UIBPAIXPRVAYMY-UHFFFAOYSA-N 1 2 222.675 2.292 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1c(C)cccc1C ZINC000096811166 384480560 /nfs/dbraw/zinc/48/05/60/384480560.db2.gz LNFHNPQBLRKUFU-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1c(C)cccc1C ZINC000096811166 384480563 /nfs/dbraw/zinc/48/05/63/384480563.db2.gz LNFHNPQBLRKUFU-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO Cn1c2ccccc2[nH+]c1N[C@@H]1CCCC[C@@H]1O ZINC000079046760 384481429 /nfs/dbraw/zinc/48/14/29/384481429.db2.gz FXYMPIBUTNZUKB-YPMHNXCESA-N 1 2 245.326 2.289 20 0 BEADLO Cn1c2ccccc2[nH+]c1N[C@@H]1CCCOC1 ZINC000079047239 384482498 /nfs/dbraw/zinc/48/24/98/384482498.db2.gz WOBDBPRDYFNZLH-SNVBAGLBSA-N 1 2 231.299 2.164 20 0 BEADLO CCCc1nc(C[N@@H+]2CC[C@@H](C3CC3)C2)no1 ZINC000363491103 384484846 /nfs/dbraw/zinc/48/48/46/384484846.db2.gz SFTJBCKITFLDQX-LLVKDONJSA-N 1 2 235.331 2.254 20 0 BEADLO CCCc1nc(C[N@H+]2CC[C@@H](C3CC3)C2)no1 ZINC000363491103 384484855 /nfs/dbraw/zinc/48/48/55/384484855.db2.gz SFTJBCKITFLDQX-LLVKDONJSA-N 1 2 235.331 2.254 20 0 BEADLO COC(=O)[C@@H]([NH2+]CC1CCC1)c1ccccc1 ZINC000079619063 384506701 /nfs/dbraw/zinc/50/67/01/384506701.db2.gz NRHJUHSZEJJRKN-ZDUSSCGKSA-N 1 2 233.311 2.290 20 0 BEADLO C[N@H+](Cc1csc(C2CC2)n1)[C@@H]1CCOC1 ZINC000161713925 384519023 /nfs/dbraw/zinc/51/90/23/384519023.db2.gz NFWAPGHIIWRRHM-LLVKDONJSA-N 1 2 238.356 2.241 20 0 BEADLO C[N@@H+](Cc1csc(C2CC2)n1)[C@@H]1CCOC1 ZINC000161713925 384519026 /nfs/dbraw/zinc/51/90/26/384519026.db2.gz NFWAPGHIIWRRHM-LLVKDONJSA-N 1 2 238.356 2.241 20 0 BEADLO CCOc1ccccc1NCc1[nH]cc[nH+]1 ZINC000049714482 384557887 /nfs/dbraw/zinc/55/78/87/384557887.db2.gz ODRLTEWUHMXUJJ-UHFFFAOYSA-N 1 2 217.272 2.421 20 0 BEADLO c1c[nH]c(C[NH2+][C@@H]2CCOc3ccccc32)n1 ZINC000049715215 384559742 /nfs/dbraw/zinc/55/97/42/384559742.db2.gz FXYJGRDQFPLICO-LLVKDONJSA-N 1 2 229.283 2.023 20 0 BEADLO COCc1ccccc1NCc1[nH]cc[nH+]1 ZINC000049714934 384560157 /nfs/dbraw/zinc/56/01/57/384560157.db2.gz JULOSDQVRXORLB-UHFFFAOYSA-N 1 2 217.272 2.168 20 0 BEADLO CS[C@H]1CC[N@H+](Cc2ccn(C(F)F)n2)C1 ZINC000449446828 384561025 /nfs/dbraw/zinc/56/10/25/384561025.db2.gz UMTCXLKHHJNQRK-VIFPVBQESA-N 1 2 247.314 2.216 20 0 BEADLO CS[C@H]1CC[N@@H+](Cc2ccn(C(F)F)n2)C1 ZINC000449446828 384561030 /nfs/dbraw/zinc/56/10/30/384561030.db2.gz UMTCXLKHHJNQRK-VIFPVBQESA-N 1 2 247.314 2.216 20 0 BEADLO COC[C@@H]([NH2+]Cc1ccco1)c1ccco1 ZINC000080239042 384539570 /nfs/dbraw/zinc/53/95/70/384539570.db2.gz VUHJKGSMUUHLAY-LLVKDONJSA-N 1 2 221.256 2.350 20 0 BEADLO C[C@H]1CSCCN1c1cc[nH+]c(C2CC2)n1 ZINC000172374832 384576478 /nfs/dbraw/zinc/57/64/78/384576478.db2.gz KGHWGRGGAWJADK-VIFPVBQESA-N 1 2 235.356 2.296 20 0 BEADLO COC(=O)[C@H]1CCC[N@@H+]1C/C=C/c1ccccc1 ZINC000050048795 384585668 /nfs/dbraw/zinc/58/56/68/384585668.db2.gz IOAVDOFCHUVINQ-VZUFXWRPSA-N 1 2 245.322 2.337 20 0 BEADLO COC(=O)[C@H]1CCC[N@H+]1C/C=C/c1ccccc1 ZINC000050048795 384585679 /nfs/dbraw/zinc/58/56/79/384585679.db2.gz IOAVDOFCHUVINQ-VZUFXWRPSA-N 1 2 245.322 2.337 20 0 BEADLO CCN(CC1CCC1)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000517942485 384585646 /nfs/dbraw/zinc/58/56/46/384585646.db2.gz KJLMNKCFXHYWFJ-LBPRGKRZSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1ccncc1C[NH2+][C@@H](C)c1ccon1 ZINC000309788621 384606320 /nfs/dbraw/zinc/60/63/20/384606320.db2.gz OQEVBOSJRIFJTK-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccncc2F)[C@@H](C)[C@H](C)O1 ZINC000449264563 384607592 /nfs/dbraw/zinc/60/75/92/384607592.db2.gz MQZGPEOUPCNDBB-VWYCJHECSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccncc2F)[C@@H](C)[C@H](C)O1 ZINC000449264563 384607602 /nfs/dbraw/zinc/60/76/02/384607602.db2.gz MQZGPEOUPCNDBB-VWYCJHECSA-N 1 2 238.306 2.218 20 0 BEADLO CC(C)n1ccc(C[N@@H+]2CCSC[C@@H]2C)n1 ZINC000172589612 384607963 /nfs/dbraw/zinc/60/79/63/384607963.db2.gz XLSZLJIRFGBLMA-NSHDSACASA-N 1 2 239.388 2.401 20 0 BEADLO CC(C)n1ccc(C[N@H+]2CCSC[C@@H]2C)n1 ZINC000172589612 384607973 /nfs/dbraw/zinc/60/79/73/384607973.db2.gz XLSZLJIRFGBLMA-NSHDSACASA-N 1 2 239.388 2.401 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+]2C[C@@H](C)OC(C)(C)C2)cn1 ZINC000428460147 384614782 /nfs/dbraw/zinc/61/47/82/384614782.db2.gz GGWJOAUYVCAXNI-VXGBXAGGSA-N 1 2 249.358 2.345 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+]2C[C@@H](C)OC(C)(C)C2)cn1 ZINC000428460147 384614793 /nfs/dbraw/zinc/61/47/93/384614793.db2.gz GGWJOAUYVCAXNI-VXGBXAGGSA-N 1 2 249.358 2.345 20 0 BEADLO c1ccc(NCCCNc2cccc[nH+]2)nc1 ZINC000100675082 384616949 /nfs/dbraw/zinc/61/69/49/384616949.db2.gz ZGQURGSYHDCUQZ-UHFFFAOYSA-N 1 2 228.299 2.391 20 0 BEADLO FC(F)C1([NH2+]C/C=C\c2ccncc2)CC1 ZINC000309609908 384640161 /nfs/dbraw/zinc/64/01/61/384640161.db2.gz ZDWJLVQNWKAADI-UPHRSURJSA-N 1 2 224.254 2.482 20 0 BEADLO C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]CC(F)(F)CO ZINC000184713740 384640584 /nfs/dbraw/zinc/64/05/84/384640584.db2.gz GVPRFYPLZUSAKU-BXKDBHETSA-N 1 2 241.281 2.137 20 0 BEADLO Cc1cnc(NCCCNc2cccc[nH+]2)nc1 ZINC000124535484 384649876 /nfs/dbraw/zinc/64/98/76/384649876.db2.gz BSBQVVIHEBCLQF-UHFFFAOYSA-N 1 2 243.314 2.094 20 0 BEADLO Cc1nc(C[NH2+][C@@H](C)c2cn[nH]c2)c(C)s1 ZINC000309835086 384653984 /nfs/dbraw/zinc/65/39/84/384653984.db2.gz ZYGWMSOOHPGFCA-ZETCQYMHSA-N 1 2 236.344 2.334 20 0 BEADLO O=C(c1ccco1)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000082277783 384660120 /nfs/dbraw/zinc/66/01/20/384660120.db2.gz YSACLTZOBSWQGO-SNVBAGLBSA-N 1 2 245.282 2.023 20 0 BEADLO CCC[C@@](C)([NH2+][C@H]1C=CCCC1)C(=O)OC ZINC000171935992 384677870 /nfs/dbraw/zinc/67/78/70/384677870.db2.gz XHVCHALBRJSTDO-WCQYABFASA-N 1 2 225.332 2.417 20 0 BEADLO Cc1c([C@@H](C)[NH2+]Cc2nccs2)cnn1C ZINC000082394229 384678209 /nfs/dbraw/zinc/67/82/09/384678209.db2.gz KBVYEBUBDSEINA-MRVPVSSYSA-N 1 2 236.344 2.036 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)NC1=[NH+]CCS1 ZINC000185064500 384680888 /nfs/dbraw/zinc/68/08/88/384680888.db2.gz XCHRLOAWXOITCD-BQYQJAHWSA-N 1 2 226.345 2.198 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1CC2CCC1CC2 ZINC000380193159 384684893 /nfs/dbraw/zinc/68/48/93/384684893.db2.gz XVLFJJAVNCISBA-HTAVTVPLSA-N 1 2 247.342 2.161 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1C(=O)NCCCn1cc[nH+]c1 ZINC000185168694 384687603 /nfs/dbraw/zinc/68/76/03/384687603.db2.gz SQZJNYBUXJDMEX-OCCSQVGLSA-N 1 2 249.358 2.072 20 0 BEADLO C[C@@H]([NH2+]C1CC(C)(C)C1)C(=O)OC(C)(C)C ZINC000309888921 384687962 /nfs/dbraw/zinc/68/79/62/384687962.db2.gz ZLMFBIPRUKXHCH-SECBINFHSA-N 1 2 227.348 2.495 20 0 BEADLO c1cn(CCCSC2=NCCS2)c[nH+]1 ZINC000185394483 384714164 /nfs/dbraw/zinc/71/41/64/384714164.db2.gz DCRXFFILRJZNBR-UHFFFAOYSA-N 1 2 227.358 2.109 20 0 BEADLO CC[C@@H](C)C(=O)N1CC[C@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000125556673 384730413 /nfs/dbraw/zinc/73/04/13/384730413.db2.gz SBYAQSCPLYVKQA-FRRDWIJNSA-N 1 2 249.358 2.339 20 0 BEADLO Cc1ccc(C[NH2+]Cc2ncccn2)s1 ZINC000054459711 384734923 /nfs/dbraw/zinc/73/49/23/384734923.db2.gz IQRBHCXLTWVYES-UHFFFAOYSA-N 1 2 219.313 2.136 20 0 BEADLO Cc1cnc(C[N@@H+]2CCO[C@H]3CCC[C@H]32)s1 ZINC000271441204 384736999 /nfs/dbraw/zinc/73/69/99/384736999.db2.gz CPICJAGEHMJOJJ-MNOVXSKESA-N 1 2 238.356 2.205 20 0 BEADLO Cc1cnc(C[N@H+]2CCO[C@H]3CCC[C@H]32)s1 ZINC000271441204 384737007 /nfs/dbraw/zinc/73/70/07/384737007.db2.gz CPICJAGEHMJOJJ-MNOVXSKESA-N 1 2 238.356 2.205 20 0 BEADLO C[C@H]1OCC[C@H]1SCCCn1cc[nH+]c1 ZINC000185635222 384752714 /nfs/dbraw/zinc/75/27/14/384752714.db2.gz NOFSLMDLGNYFAU-GHMZBOCLSA-N 1 2 226.345 2.184 20 0 BEADLO COC(=O)c1ccc(C[NH2+]Cc2ccc(C)o2)o1 ZINC000053036707 384759604 /nfs/dbraw/zinc/75/96/04/384759604.db2.gz OYPALFPNSLIBOG-UHFFFAOYSA-N 1 2 249.266 2.257 20 0 BEADLO Clc1cccc(C[NH2+]Cc2csnn2)c1 ZINC000053147918 384766763 /nfs/dbraw/zinc/76/67/63/384766763.db2.gz SMYYMLPFBLXEJL-UHFFFAOYSA-N 1 2 239.731 2.481 20 0 BEADLO CC(C)[C@H]1C[C@@H]1C(=O)N(C)CCCn1cc[nH+]c1 ZINC000185754731 384767270 /nfs/dbraw/zinc/76/72/70/384767270.db2.gz ZAJMFSCOPIOEQP-OLZOCXBDSA-N 1 2 249.358 2.024 20 0 BEADLO COC[C@H](C)Nc1ccc(N2CCCC2)[nH+]c1 ZINC000053173423 384770196 /nfs/dbraw/zinc/77/01/96/384770196.db2.gz ZZWFCAKFFFTGMV-NSHDSACASA-N 1 2 235.331 2.129 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2ccon2)nc1 ZINC000309778056 384824695 /nfs/dbraw/zinc/82/46/95/384824695.db2.gz MDGDWMIEUMBHLG-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO Cc1cc(C)c(CNC(=O)C(C)(C)C)c[nH+]1 ZINC000335057687 384789362 /nfs/dbraw/zinc/78/93/62/384789362.db2.gz KZAKQTKPSMOIBK-UHFFFAOYSA-N 1 2 220.316 2.361 20 0 BEADLO Cc1cc(C)c(CNC(=O)c2cscn2)c[nH+]1 ZINC000335060791 384793026 /nfs/dbraw/zinc/79/30/26/384793026.db2.gz ZFKJTNIOPNQBQA-UHFFFAOYSA-N 1 2 247.323 2.085 20 0 BEADLO CC(C)CCC[C@@H](C)NC(=O)Cn1cc[nH+]c1 ZINC000174532612 384804458 /nfs/dbraw/zinc/80/44/58/384804458.db2.gz DXFAFOULTASGDB-GFCCVEGCSA-N 1 2 237.347 2.214 20 0 BEADLO FC(F)(F)C[NH2+]C1(C2CC2)CCOCC1 ZINC000375702885 384806066 /nfs/dbraw/zinc/80/60/66/384806066.db2.gz VEVHDQDPHOHLMG-UHFFFAOYSA-N 1 2 223.238 2.098 20 0 BEADLO c1c(Cn2nnc3ccccc32)[nH+]c2ccccn12 ZINC000005635601 384871490 /nfs/dbraw/zinc/87/14/90/384871490.db2.gz QMZXLNRAYOBDNR-UHFFFAOYSA-N 1 2 249.277 2.127 20 0 BEADLO CCCC(CCC)C(=O)NCCn1cc[nH+]c1 ZINC000163881396 384872432 /nfs/dbraw/zinc/87/24/32/384872432.db2.gz SMLAUPDDGZOXNH-UHFFFAOYSA-N 1 2 237.347 2.216 20 0 BEADLO CO[C@H](CNc1cc(C)[nH+]cn1)C(C)(C)C ZINC000301414540 384875004 /nfs/dbraw/zinc/87/50/04/384875004.db2.gz DRMXBMHXNQJPGS-SNVBAGLBSA-N 1 2 223.320 2.258 20 0 BEADLO CN(C)c1ccc(NCc2ccn(C)c2)[nH+]c1 ZINC000126880572 384839271 /nfs/dbraw/zinc/83/92/71/384839271.db2.gz KGVIHYNKSWQQAG-UHFFFAOYSA-N 1 2 230.315 2.098 20 0 BEADLO CN(C)c1ccc(NCc2cncs2)c[nH+]1 ZINC000054770748 384854492 /nfs/dbraw/zinc/85/44/92/384854492.db2.gz PRIBQDQAQMLOEL-UHFFFAOYSA-N 1 2 234.328 2.216 20 0 BEADLO CC(C)([NH2+]Cc1ccn[nH]1)c1ccccc1 ZINC000163809594 384863852 /nfs/dbraw/zinc/86/38/52/384863852.db2.gz UZIGBXKXEKBVPO-UHFFFAOYSA-N 1 2 215.300 2.435 20 0 BEADLO CCS[C@H](C)c1noc(C[NH+]2CCCC2)n1 ZINC000119697105 384952035 /nfs/dbraw/zinc/95/20/35/384952035.db2.gz KSWCEVZHILIYPP-SECBINFHSA-N 1 2 241.360 2.480 20 0 BEADLO Cc1[nH]c(C(=O)NC23CCC(CC2)CC3)c[nH+]1 ZINC000518324258 384957235 /nfs/dbraw/zinc/95/72/35/384957235.db2.gz CAZPXHWRGNFCQG-UHFFFAOYSA-N 1 2 233.315 2.171 20 0 BEADLO Cc1csc(C[NH2+][C@H]2C[C@H](C)n3ccnc32)n1 ZINC000294134571 384957069 /nfs/dbraw/zinc/95/70/69/384957069.db2.gz OWRJVXGCPQUGFP-UWVGGRQHSA-N 1 2 248.355 2.444 20 0 BEADLO Cn1ccnc1C[N@H+](C)Cc1ccc(F)cc1 ZINC000057593468 384957412 /nfs/dbraw/zinc/95/74/12/384957412.db2.gz OAJPBTOAPDXJPW-UHFFFAOYSA-N 1 2 233.290 2.191 20 0 BEADLO Cn1ccnc1C[N@@H+](C)Cc1ccc(F)cc1 ZINC000057593468 384957417 /nfs/dbraw/zinc/95/74/17/384957417.db2.gz OAJPBTOAPDXJPW-UHFFFAOYSA-N 1 2 233.290 2.191 20 0 BEADLO CN(Cc1[nH+]ccn1C)Cc1ccc(F)cc1 ZINC000057593468 384957424 /nfs/dbraw/zinc/95/74/24/384957424.db2.gz OAJPBTOAPDXJPW-UHFFFAOYSA-N 1 2 233.290 2.191 20 0 BEADLO COC(=O)C[NH+]1CCC(c2ccsc2)CC1 ZINC000186938829 384898848 /nfs/dbraw/zinc/89/88/48/384898848.db2.gz LXHNYGMJBIFKQV-UHFFFAOYSA-N 1 2 239.340 2.101 20 0 BEADLO C[C@@H](CF)[NH2+]Cc1csc(C2CC2)n1 ZINC000308667753 384906745 /nfs/dbraw/zinc/90/67/45/384906745.db2.gz UAKRBZKEVSOLBW-ZETCQYMHSA-N 1 2 214.309 2.468 20 0 BEADLO Cc1c[nH+]cc(NCc2cc(C(N)=O)cs2)c1 ZINC000119622072 384907444 /nfs/dbraw/zinc/90/74/44/384907444.db2.gz NQQKQEWIGDDIOC-UHFFFAOYSA-N 1 2 247.323 2.163 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OCc1ccc(Cl)s1 ZINC000747868495 583401410 /nfs/dbraw/zinc/40/14/10/583401410.db2.gz XFJVJXXTAHIHML-ZCFIWIBFSA-N 1 2 248.735 2.435 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2C[C@H]2C2CCC2)cc[nH+]1 ZINC000518367240 384991149 /nfs/dbraw/zinc/99/11/49/384991149.db2.gz VAKUPUKPFBTKSV-QWHCGFSZSA-N 1 2 245.326 2.122 20 0 BEADLO c1ccc(N[C@@H]2C[C@@H]3OCCC[C@H]23)[nH+]c1 ZINC000302441875 384992068 /nfs/dbraw/zinc/99/20/68/384992068.db2.gz NFZQQCQQPNMXBT-MXWKQRLJSA-N 1 2 204.273 2.061 20 0 BEADLO CO[C@]1(C)C[C@H](N(C)c2cc[nH+]c(C)n2)C1(C)C ZINC000086186940 384995267 /nfs/dbraw/zinc/99/52/67/384995267.db2.gz JOJQOOIWPMBIRE-SMDDNHRTSA-N 1 2 249.358 2.425 20 0 BEADLO CS[C@@H](C)C(=O)Nc1cc[nH+]cc1C ZINC000107291708 384962310 /nfs/dbraw/zinc/96/23/10/384962310.db2.gz AWYQZKXMWINTHG-QMMMGPOBSA-N 1 2 210.302 2.080 20 0 BEADLO CC[C@H](O)CNc1[nH+]ccc(C)c1Cl ZINC000306517675 385051368 /nfs/dbraw/zinc/05/13/68/385051368.db2.gz HUJWZJQJTPTRIB-QMMMGPOBSA-N 1 2 214.696 2.226 20 0 BEADLO CN(CC1(CO)CC1)c1ccc2ccccc2[nH+]1 ZINC000188462190 385056449 /nfs/dbraw/zinc/05/64/49/385056449.db2.gz SWEPFSFLHYDHMM-UHFFFAOYSA-N 1 2 242.322 2.444 20 0 BEADLO C[C@@H]1c2cccn2CC[N@H+]1CCOCC(F)F ZINC000188642368 385070642 /nfs/dbraw/zinc/07/06/42/385070642.db2.gz RPBIDBYUGACHLV-SNVBAGLBSA-N 1 2 244.285 2.146 20 0 BEADLO C[C@@H]1c2cccn2CC[N@@H+]1CCOCC(F)F ZINC000188642368 385070649 /nfs/dbraw/zinc/07/06/49/385070649.db2.gz RPBIDBYUGACHLV-SNVBAGLBSA-N 1 2 244.285 2.146 20 0 BEADLO Cc1ccc(NCc2ccnn2C)c(C)[nH+]1 ZINC000087151806 385077337 /nfs/dbraw/zinc/07/73/37/385077337.db2.gz QVHUQLXQYQJDEJ-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO Cc1nnc(C[N@@H+]2CCCc3sccc3C2)[nH]1 ZINC000644668232 385082391 /nfs/dbraw/zinc/08/23/91/385082391.db2.gz JCACAMCNMHFLDX-UHFFFAOYSA-N 1 2 248.355 2.123 20 0 BEADLO Cc1nnc(C[N@H+]2CCCc3sccc3C2)[nH]1 ZINC000644668232 385082400 /nfs/dbraw/zinc/08/24/00/385082400.db2.gz JCACAMCNMHFLDX-UHFFFAOYSA-N 1 2 248.355 2.123 20 0 BEADLO COc1cc(C[NH2+][C@H](C)c2nccs2)ccn1 ZINC000086510394 385024042 /nfs/dbraw/zinc/02/40/42/385024042.db2.gz XAPRBXRBNSEGQF-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1cnc[nH]1 ZINC000188240261 385027701 /nfs/dbraw/zinc/02/77/01/385027701.db2.gz ZLHVPTHCLABRJC-CYBMUJFWSA-N 1 2 230.315 2.388 20 0 BEADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1cnc[nH]1 ZINC000188240261 385027710 /nfs/dbraw/zinc/02/77/10/385027710.db2.gz ZLHVPTHCLABRJC-CYBMUJFWSA-N 1 2 230.315 2.388 20 0 BEADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1c[nH]cn1 ZINC000188240261 385027719 /nfs/dbraw/zinc/02/77/19/385027719.db2.gz ZLHVPTHCLABRJC-CYBMUJFWSA-N 1 2 230.315 2.388 20 0 BEADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1c[nH]cn1 ZINC000188240261 385027727 /nfs/dbraw/zinc/02/77/27/385027727.db2.gz ZLHVPTHCLABRJC-CYBMUJFWSA-N 1 2 230.315 2.388 20 0 BEADLO CCc1ccccc1CC(=O)NC1=[NH+]CCS1 ZINC000188231258 385028096 /nfs/dbraw/zinc/02/80/96/385028096.db2.gz AOEIHXFQCZBYIX-UHFFFAOYSA-N 1 2 248.351 2.011 20 0 BEADLO c1[nH+]c(S[C@H]2CCOC2)n2ccccc12 ZINC000188256221 385030363 /nfs/dbraw/zinc/03/03/63/385030363.db2.gz ZMEKMMOJXSYIBI-JTQLQIEISA-N 1 2 220.297 2.215 20 0 BEADLO Cc1ccc(NC(=O)C(C)(C)F)c(C)[nH+]1 ZINC000130407823 385032320 /nfs/dbraw/zinc/03/23/20/385032320.db2.gz JPJHKURUSIRBHU-UHFFFAOYSA-N 1 2 210.252 2.385 20 0 BEADLO Cc1ccc(NC(=O)C[C@H]2CCCO2)c(C)[nH+]1 ZINC000176186024 385034216 /nfs/dbraw/zinc/03/42/16/385034216.db2.gz OWBMWSWTXSQMNQ-LLVKDONJSA-N 1 2 234.299 2.206 20 0 BEADLO Cc1nnsc1CNc1cc(C)c[nH+]c1C ZINC000404573101 385035202 /nfs/dbraw/zinc/03/52/02/385035202.db2.gz DJUGTSUVMJAJOG-UHFFFAOYSA-N 1 2 234.328 2.470 20 0 BEADLO Cc1ccc([S@@](=O)Cc2[nH+]ccn2C)cc1 ZINC000129231345 385122856 /nfs/dbraw/zinc/12/28/56/385122856.db2.gz TUMCNMZOCJISES-MRXNPFEDSA-N 1 2 234.324 2.036 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)[C@@H]2C[C@H]2C(C)C)[nH+]1 ZINC000516657465 385124117 /nfs/dbraw/zinc/12/41/17/385124117.db2.gz ZOYVMRCKPDZZBE-WDEREUQCSA-N 1 2 249.358 2.362 20 0 BEADLO FC(F)(F)C(F)(F)COCCn1cc[nH+]c1 ZINC000189114363 385125021 /nfs/dbraw/zinc/12/50/21/385125021.db2.gz MHQAHSHDYGIIRK-UHFFFAOYSA-N 1 2 244.163 2.097 20 0 BEADLO Cc1cc[nH+]c(N[C@@H](C)CCO)c1Cl ZINC000306612996 385127845 /nfs/dbraw/zinc/12/78/45/385127845.db2.gz JSNAAUAKKDIQRU-QMMMGPOBSA-N 1 2 214.696 2.226 20 0 BEADLO Cc1c[nH+]cc(NCC2=CCCOC2)c1 ZINC000119596966 385130876 /nfs/dbraw/zinc/13/08/76/385130876.db2.gz VWXGVHVUGKQNLQ-UHFFFAOYSA-N 1 2 204.273 2.149 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)Cc1ccccc1 ZINC000109063809 385131036 /nfs/dbraw/zinc/13/10/36/385131036.db2.gz VIZCGMJBHPLNAE-UHFFFAOYSA-N 1 2 201.273 2.042 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)Cc1ccccc1 ZINC000109063809 385131043 /nfs/dbraw/zinc/13/10/43/385131043.db2.gz VIZCGMJBHPLNAE-UHFFFAOYSA-N 1 2 201.273 2.042 20 0 BEADLO c1cnc2ccc(C[N@@H+]3CCO[C@@H]4C[C@@H]43)cc2c1 ZINC000644716264 385133641 /nfs/dbraw/zinc/13/36/41/385133641.db2.gz NLNYZLILLCHQOB-LSDHHAIUSA-N 1 2 240.306 2.208 20 0 BEADLO c1cnc2ccc(C[N@H+]3CCO[C@@H]4C[C@@H]43)cc2c1 ZINC000644716264 385133643 /nfs/dbraw/zinc/13/36/43/385133643.db2.gz NLNYZLILLCHQOB-LSDHHAIUSA-N 1 2 240.306 2.208 20 0 BEADLO CCCOc1ccc(C[N@@H+]2CCO[C@H]3C[C@H]32)cc1 ZINC000644717485 385136496 /nfs/dbraw/zinc/13/64/96/385136496.db2.gz UAZLPXLTFTVSIH-CABCVRRESA-N 1 2 247.338 2.449 20 0 BEADLO CCCOc1ccc(C[N@H+]2CCO[C@H]3C[C@H]32)cc1 ZINC000644717485 385136500 /nfs/dbraw/zinc/13/65/00/385136500.db2.gz UAZLPXLTFTVSIH-CABCVRRESA-N 1 2 247.338 2.449 20 0 BEADLO Cc1csc([C@H]2COCC[N@H+]2CC(C)C)n1 ZINC000189301148 385143651 /nfs/dbraw/zinc/14/36/51/385143651.db2.gz WAMDURBZBYIZFA-LLVKDONJSA-N 1 2 240.372 2.481 20 0 BEADLO Cc1csc([C@H]2COCC[N@@H+]2CC(C)C)n1 ZINC000189301148 385143656 /nfs/dbraw/zinc/14/36/56/385143656.db2.gz WAMDURBZBYIZFA-LLVKDONJSA-N 1 2 240.372 2.481 20 0 BEADLO Cc1nc(CSCCn2cc[nH+]c2)co1 ZINC000516663396 385151351 /nfs/dbraw/zinc/15/13/51/385151351.db2.gz NTIBFZUZLZPFAF-UHFFFAOYSA-N 1 2 223.301 2.113 20 0 BEADLO CC[N@@H+]1CCc2nc(Br)sc2C1 ZINC000156824886 385162277 /nfs/dbraw/zinc/16/22/77/385162277.db2.gz UQHZEPOTNHISEU-UHFFFAOYSA-N 1 2 247.161 2.284 20 0 BEADLO CC[N@H+]1CCc2nc(Br)sc2C1 ZINC000156824886 385162283 /nfs/dbraw/zinc/16/22/83/385162283.db2.gz UQHZEPOTNHISEU-UHFFFAOYSA-N 1 2 247.161 2.284 20 0 BEADLO CN(Cc1c[nH+]cn1C)Cc1cccc(F)c1 ZINC000176984088 385164431 /nfs/dbraw/zinc/16/44/31/385164431.db2.gz WXKLDIYNVCVZED-UHFFFAOYSA-N 1 2 233.290 2.191 20 0 BEADLO Cc1nnc(C[NH2+][C@@H](C)c2ccccc2)o1 ZINC000062639331 385178733 /nfs/dbraw/zinc/17/87/33/385178733.db2.gz FCTVCQWIHRDGTB-VIFPVBQESA-N 1 2 217.272 2.229 20 0 BEADLO CCc1ccc(C[N@@H+]2CCC[C@@]23CCOC3=O)o1 ZINC000190030628 385206900 /nfs/dbraw/zinc/20/69/00/385206900.db2.gz BQOBCLDKWNZXPF-AWEZNQCLSA-N 1 2 249.310 2.124 20 0 BEADLO CCc1ccc(C[N@H+]2CCC[C@@]23CCOC3=O)o1 ZINC000190030628 385206906 /nfs/dbraw/zinc/20/69/06/385206906.db2.gz BQOBCLDKWNZXPF-AWEZNQCLSA-N 1 2 249.310 2.124 20 0 BEADLO c1cn(CCSCC[C@@H]2CCCO2)c[nH+]1 ZINC000190163623 385214493 /nfs/dbraw/zinc/21/44/93/385214493.db2.gz SIKJKPHEEUZUAN-NSHDSACASA-N 1 2 226.345 2.185 20 0 BEADLO Cc1ccc(OCc2c[nH+]cn2C)cc1 ZINC000090233672 385217391 /nfs/dbraw/zinc/21/73/91/385217391.db2.gz GXFFFPLIOZQVID-UHFFFAOYSA-N 1 2 202.257 2.308 20 0 BEADLO CC[C@H]([NH2+]Cc1ccc(C)cc1C)C(=O)OC ZINC000190197178 385219678 /nfs/dbraw/zinc/21/96/78/385219678.db2.gz IUWWXJULMSMLEG-ZDUSSCGKSA-N 1 2 235.327 2.345 20 0 BEADLO FC(F)(F)[C@H]([NH2+]C1CCOCC1)C1CC1 ZINC000308865293 385231259 /nfs/dbraw/zinc/23/12/59/385231259.db2.gz FBTHDQDQIFSQOX-SECBINFHSA-N 1 2 223.238 2.096 20 0 BEADLO Cn1nccc1C[N@@H+]1CCc2ccc(F)cc2C1 ZINC000130341062 385241259 /nfs/dbraw/zinc/24/12/59/385241259.db2.gz NTZONGTZVRNAJY-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1nccc1C[N@H+]1CCc2ccc(F)cc2C1 ZINC000130341062 385241266 /nfs/dbraw/zinc/24/12/66/385241266.db2.gz NTZONGTZVRNAJY-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1nccc1C[N@@H+]1CCc2c(F)cccc2C1 ZINC000130413735 385247791 /nfs/dbraw/zinc/24/77/91/385247791.db2.gz BORXLLCIPJCWCP-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1nccc1C[N@H+]1CCc2c(F)cccc2C1 ZINC000130413735 385247796 /nfs/dbraw/zinc/24/77/96/385247796.db2.gz BORXLLCIPJCWCP-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2ncnn2C)cc1 ZINC000157694997 385251513 /nfs/dbraw/zinc/25/15/13/385251513.db2.gz ZHTJMGKQKBOPEA-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2ncnn2C)cc1 ZINC000157694997 385251517 /nfs/dbraw/zinc/25/15/17/385251517.db2.gz ZHTJMGKQKBOPEA-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2ccnc(Cl)c2)[C@H]1C ZINC000178585907 385302554 /nfs/dbraw/zinc/30/25/54/385302554.db2.gz SKNSRIUESXBNIW-VHSXEESVSA-N 1 2 240.734 2.344 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2ccnc(Cl)c2)[C@H]1C ZINC000178585907 385302556 /nfs/dbraw/zinc/30/25/56/385302556.db2.gz SKNSRIUESXBNIW-VHSXEESVSA-N 1 2 240.734 2.344 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2ccncc2)CCO1 ZINC000131233287 385318397 /nfs/dbraw/zinc/31/83/97/385318397.db2.gz BLLIYRGTTJDSHN-ZDUSSCGKSA-N 1 2 220.316 2.083 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2ccncc2)CCO1 ZINC000131233287 385318404 /nfs/dbraw/zinc/31/84/04/385318404.db2.gz BLLIYRGTTJDSHN-ZDUSSCGKSA-N 1 2 220.316 2.083 20 0 BEADLO C[C@H](CO)Nc1[nH+]ccc2ccc(F)cc21 ZINC000336357424 385258754 /nfs/dbraw/zinc/25/87/54/385258754.db2.gz MHQZKABUMNUFLB-MRVPVSSYSA-N 1 2 220.247 2.167 20 0 BEADLO CC[C@@H](NC(=O)CCC1CC1)c1[nH]cc[nH+]1 ZINC000331475686 385258968 /nfs/dbraw/zinc/25/89/68/385258968.db2.gz NCCJJRPWSGJPIC-SNVBAGLBSA-N 1 2 221.304 2.167 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2cccnc2)CCO1 ZINC000131248469 385322223 /nfs/dbraw/zinc/32/22/23/385322223.db2.gz KGIZXYZMONCLKN-CYBMUJFWSA-N 1 2 220.316 2.083 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2cccnc2)CCO1 ZINC000131248469 385322227 /nfs/dbraw/zinc/32/22/27/385322227.db2.gz KGIZXYZMONCLKN-CYBMUJFWSA-N 1 2 220.316 2.083 20 0 BEADLO Fc1ccc2c(c1)[C@@H]([NH+]1CCOCC1)CC2 ZINC000177666465 385271381 /nfs/dbraw/zinc/27/13/81/385271381.db2.gz FCSCQYSQHAGTTH-ZDUSSCGKSA-N 1 2 221.275 2.145 20 0 BEADLO C[N@@H+](Cc1nccs1)C[C@H]1CCC=CO1 ZINC000191082327 385280655 /nfs/dbraw/zinc/28/06/55/385280655.db2.gz WTCGFNQBDFZLTB-SNVBAGLBSA-N 1 2 224.329 2.268 20 0 BEADLO C[N@H+](Cc1nccs1)C[C@H]1CCC=CO1 ZINC000191082327 385280662 /nfs/dbraw/zinc/28/06/62/385280662.db2.gz WTCGFNQBDFZLTB-SNVBAGLBSA-N 1 2 224.329 2.268 20 0 BEADLO CCc1ccc(C[N@@H+]2CCOCC2(C)C)o1 ZINC000130880694 385292718 /nfs/dbraw/zinc/29/27/18/385292718.db2.gz GYFFTJAGSRQYRY-UHFFFAOYSA-N 1 2 223.316 2.453 20 0 BEADLO CCc1ccc(C[N@H+]2CCOCC2(C)C)o1 ZINC000130880694 385292724 /nfs/dbraw/zinc/29/27/24/385292724.db2.gz GYFFTJAGSRQYRY-UHFFFAOYSA-N 1 2 223.316 2.453 20 0 BEADLO COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@@H+]1C/C=C/Cl ZINC000191215127 385293531 /nfs/dbraw/zinc/29/35/31/385293531.db2.gz REYZKIKEAIZFSI-BCZGSGNNSA-N 1 2 243.734 2.012 20 0 BEADLO COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1C/C=C/Cl ZINC000191215127 385293533 /nfs/dbraw/zinc/29/35/33/385293533.db2.gz REYZKIKEAIZFSI-BCZGSGNNSA-N 1 2 243.734 2.012 20 0 BEADLO COC(=O)C[NH2+][C@H]1CCC[C@H]1Cc1ccccc1 ZINC000191354322 385300640 /nfs/dbraw/zinc/30/06/40/385300640.db2.gz IUZKEDLDHDIWRM-KBPBESRZSA-N 1 2 247.338 2.160 20 0 BEADLO Cc1c(C[NH2+][C@@H](C)c2cscn2)cnn1C ZINC000131563570 385344678 /nfs/dbraw/zinc/34/46/78/385344678.db2.gz DQQUAUJEGXKYNC-QMMMGPOBSA-N 1 2 236.344 2.036 20 0 BEADLO C[C@H]1CCC[C@@H](C(=O)NCCCn2cc[nH+]c2)C1 ZINC000158190642 385363274 /nfs/dbraw/zinc/36/32/74/385363274.db2.gz FLCRTWCYYCZCNI-QWHCGFSZSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1cc[nH+]c(N[C@H](C)[C@@H](C)CO)c1Cl ZINC000309019111 385373618 /nfs/dbraw/zinc/37/36/18/385373618.db2.gz VXUPLFAVLNYDIR-DTWKUNHWSA-N 1 2 228.723 2.472 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)c1ccsc1 ZINC000155097096 385375539 /nfs/dbraw/zinc/37/55/39/385375539.db2.gz YQQCALJGFAUXOE-UHFFFAOYSA-N 1 2 249.339 2.107 20 0 BEADLO COC(=O)C1([NH2+][C@@H]2C=CCCC2)CCCC1 ZINC000179527329 385376947 /nfs/dbraw/zinc/37/69/47/385376947.db2.gz NDSJEHNXXZNGGN-LLVKDONJSA-N 1 2 223.316 2.171 20 0 BEADLO CC[C@H]([NH2+][C@@H]1CCOC[C@H]1C)C(F)(F)F ZINC000309064200 385390770 /nfs/dbraw/zinc/39/07/70/385390770.db2.gz YIZDSNFDOGUDQA-HLTSFMKQSA-N 1 2 225.254 2.342 20 0 BEADLO Cl/C=C(\Cl)COCc1[nH]cc[nH+]1 ZINC000180050768 385383741 /nfs/dbraw/zinc/38/37/41/385383741.db2.gz NRUCYUWHPVLTNI-UTCJRWHESA-N 1 2 207.060 2.245 20 0 BEADLO CCCCNC(=O)[C@@H](C)[NH+]1Cc2ccccc2C1 ZINC000155466077 385391811 /nfs/dbraw/zinc/39/18/11/385391811.db2.gz WHZVNUIUFKUBQP-GFCCVEGCSA-N 1 2 246.354 2.307 20 0 BEADLO C[C@@H]([N@H+](C)Cc1csnn1)C1(C)CC1 ZINC000180534934 385392633 /nfs/dbraw/zinc/39/26/33/385392633.db2.gz ZVHZCNMEUCUBRU-MRVPVSSYSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]([N@@H+](C)Cc1csnn1)C1(C)CC1 ZINC000180534934 385392636 /nfs/dbraw/zinc/39/26/36/385392636.db2.gz ZVHZCNMEUCUBRU-MRVPVSSYSA-N 1 2 211.334 2.159 20 0 BEADLO Cc1[nH]c2ccc(NC(=O)[C@H]3C[C@H]3C)cc2[nH+]1 ZINC000647661119 385399527 /nfs/dbraw/zinc/39/95/27/385399527.db2.gz RZVPMFZJIKFQEW-XCBNKYQSSA-N 1 2 229.283 2.466 20 0 BEADLO Cc1[nH]c2ccc(NC(=O)[C@@H]3C[C@@H]3C)cc2[nH+]1 ZINC000647661118 385399786 /nfs/dbraw/zinc/39/97/86/385399786.db2.gz RZVPMFZJIKFQEW-OIBJUYFYSA-N 1 2 229.283 2.466 20 0 BEADLO CN(C)c1ccc(NC[C@@H]2CCC=CO2)[nH+]c1 ZINC000194515214 385439412 /nfs/dbraw/zinc/43/94/12/385439412.db2.gz MPNMHMLKCWPFDV-LBPRGKRZSA-N 1 2 233.315 2.252 20 0 BEADLO CCSCCCNc1nc[nH+]c(N)c1Cl ZINC000281771992 385448478 /nfs/dbraw/zinc/44/84/78/385448478.db2.gz DFOMSYFOAUSFIC-UHFFFAOYSA-N 1 2 246.767 2.267 20 0 BEADLO CCSCCCNc1[nH+]cnc(N)c1Cl ZINC000281771992 385448483 /nfs/dbraw/zinc/44/84/83/385448483.db2.gz DFOMSYFOAUSFIC-UHFFFAOYSA-N 1 2 246.767 2.267 20 0 BEADLO C[C@H]1OCCN(c2[nH+]c3ccccc3n2C)[C@H]1C ZINC000179317385 385458466 /nfs/dbraw/zinc/45/84/66/385458466.db2.gz JAXXBSPLXPIBJM-WDEREUQCSA-N 1 2 245.326 2.187 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)/C=C/C(C)(C)C ZINC000492801637 385437465 /nfs/dbraw/zinc/43/74/65/385437465.db2.gz RARKANBMRQBBFT-FNORWQNLSA-N 1 2 248.326 2.309 20 0 BEADLO CC[C@H]1CC[N@@H+]([C@H](C(=O)OC)c2cccnc2)C1 ZINC000156771099 385469431 /nfs/dbraw/zinc/46/94/31/385469431.db2.gz MLVYJQSPTYQPRT-AAEUAGOBSA-N 1 2 248.326 2.028 20 0 BEADLO CC[C@H]1CC[N@H+]([C@H](C(=O)OC)c2cccnc2)C1 ZINC000156771099 385469434 /nfs/dbraw/zinc/46/94/34/385469434.db2.gz MLVYJQSPTYQPRT-AAEUAGOBSA-N 1 2 248.326 2.028 20 0 BEADLO COc1cc(F)cc(C[N@@H+]2CCOC[C@@H]2C)c1 ZINC000336213916 385473785 /nfs/dbraw/zinc/47/37/85/385473785.db2.gz YIOHJXOHQTVTSD-JTQLQIEISA-N 1 2 239.290 2.055 20 0 BEADLO COc1cc(F)cc(C[N@H+]2CCOC[C@@H]2C)c1 ZINC000336213916 385473791 /nfs/dbraw/zinc/47/37/91/385473791.db2.gz YIOHJXOHQTVTSD-JTQLQIEISA-N 1 2 239.290 2.055 20 0 BEADLO C[C@@H]1[C@H](C)OCCN1c1[nH+]c2ccccc2n1C ZINC000179317362 385459183 /nfs/dbraw/zinc/45/91/83/385459183.db2.gz JAXXBSPLXPIBJM-MNOVXSKESA-N 1 2 245.326 2.187 20 0 BEADLO O=C(CCc1ccccc1)Nc1cc[nH+]cc1O ZINC000109888989 385491055 /nfs/dbraw/zinc/49/10/55/385491055.db2.gz SWMWGJNSMBQOOD-UHFFFAOYSA-N 1 2 242.278 2.359 20 0 BEADLO Cc1cn[nH]c1C[NH2+]C(C)(C)c1nccs1 ZINC000289434390 385492112 /nfs/dbraw/zinc/49/21/12/385492112.db2.gz FFLIHDVBWDNTCF-UHFFFAOYSA-N 1 2 236.344 2.200 20 0 BEADLO Cc1c[nH]nc1C[NH2+]C(C)(C)c1nccs1 ZINC000289434390 385492115 /nfs/dbraw/zinc/49/21/15/385492115.db2.gz FFLIHDVBWDNTCF-UHFFFAOYSA-N 1 2 236.344 2.200 20 0 BEADLO Cc1cc[nH+]c(NC[C@@H](O)C2CC2)c1Cl ZINC000309229643 385492801 /nfs/dbraw/zinc/49/28/01/385492801.db2.gz WNQQJQLQTGUILG-SECBINFHSA-N 1 2 226.707 2.226 20 0 BEADLO Clc1ncc(COCc2[nH]cc[nH+]2)s1 ZINC000180043383 385503935 /nfs/dbraw/zinc/50/39/35/385503935.db2.gz IXZKKFNISHUMFH-UHFFFAOYSA-N 1 2 229.692 2.236 20 0 BEADLO CC(C)n1ccnc1C[N@@H+]1CCS[C@H](C)C1 ZINC000171686236 385507312 /nfs/dbraw/zinc/50/73/12/385507312.db2.gz BCFXQLBSCOZEEA-LLVKDONJSA-N 1 2 239.388 2.401 20 0 BEADLO CC(C)n1ccnc1C[N@H+]1CCS[C@H](C)C1 ZINC000171686236 385507316 /nfs/dbraw/zinc/50/73/16/385507316.db2.gz BCFXQLBSCOZEEA-LLVKDONJSA-N 1 2 239.388 2.401 20 0 BEADLO CC[C@@H](C)[C@H](C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616927889 385489189 /nfs/dbraw/zinc/48/91/89/385489189.db2.gz SGWYIFWZTMRTSM-ZJUUUORDSA-N 1 2 223.320 2.050 20 0 BEADLO CC[C@@H](C)[C@H](C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616927889 385489194 /nfs/dbraw/zinc/48/91/94/385489194.db2.gz SGWYIFWZTMRTSM-ZJUUUORDSA-N 1 2 223.320 2.050 20 0 BEADLO c1csc(C2([NH2+]Cc3cnc[nH]3)CCCC2)n1 ZINC000172077074 385546584 /nfs/dbraw/zinc/54/65/84/385546584.db2.gz YXQLDFOTASRKSF-UHFFFAOYSA-N 1 2 248.355 2.425 20 0 BEADLO Cc1nnc(NCCCNc2cccc[nH+]2)s1 ZINC000180408518 385521466 /nfs/dbraw/zinc/52/14/66/385521466.db2.gz DLPZDDBZWSBKFE-UHFFFAOYSA-N 1 2 249.343 2.156 20 0 BEADLO Cc1cnc(C[N@H+]2C[C@@H](C)OC(C)(C)C2)s1 ZINC000180447977 385523381 /nfs/dbraw/zinc/52/33/81/385523381.db2.gz RYVHYBDIMHPOEA-SECBINFHSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1cnc(C[N@@H+]2C[C@@H](C)OC(C)(C)C2)s1 ZINC000180447977 385523385 /nfs/dbraw/zinc/52/33/85/385523385.db2.gz RYVHYBDIMHPOEA-SECBINFHSA-N 1 2 240.372 2.451 20 0 BEADLO CC(C)CCC[N@@H+]1CC(F)(F)C[C@@H]1CO ZINC000364844335 385526384 /nfs/dbraw/zinc/52/63/84/385526384.db2.gz NGRODYYQURWYKM-SNVBAGLBSA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)CCC[N@H+]1CC(F)(F)C[C@@H]1CO ZINC000364844335 385526389 /nfs/dbraw/zinc/52/63/89/385526389.db2.gz NGRODYYQURWYKM-SNVBAGLBSA-N 1 2 221.291 2.125 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1ccccc1O ZINC000107038865 385552798 /nfs/dbraw/zinc/55/27/98/385552798.db2.gz GGEGJZXOYCSZBG-UHFFFAOYSA-N 1 2 228.251 2.348 20 0 BEADLO Cn1cccc1[C@H]1CCC[N@H+]1Cc1nccn1C ZINC000181103264 385564428 /nfs/dbraw/zinc/56/44/28/385564428.db2.gz SQVDHJYESBKARW-CYBMUJFWSA-N 1 2 244.342 2.096 20 0 BEADLO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1nccn1C ZINC000181103264 385564430 /nfs/dbraw/zinc/56/44/30/385564430.db2.gz SQVDHJYESBKARW-CYBMUJFWSA-N 1 2 244.342 2.096 20 0 BEADLO COC[C@H]([NH2+]Cc1cc(C)on1)c1ccccc1 ZINC000181684884 385593513 /nfs/dbraw/zinc/59/35/13/385593513.db2.gz MLCKDLLRTDSPDS-AWEZNQCLSA-N 1 2 246.310 2.460 20 0 BEADLO COC[C@@H]([NH2+]Cc1ccon1)c1ccccc1 ZINC000181679729 385593675 /nfs/dbraw/zinc/59/36/75/385593675.db2.gz IXWSHFPORBOEBO-CYBMUJFWSA-N 1 2 232.283 2.152 20 0 BEADLO Cc1cc[nH+]c(NC[C@H](CO)C2CC2)c1Cl ZINC000336675763 385600367 /nfs/dbraw/zinc/60/03/67/385600367.db2.gz BOUIVDGSKZZMNA-SNVBAGLBSA-N 1 2 240.734 2.474 20 0 BEADLO Cn1c[nH+]cc1CNc1nnc(CC(C)(C)C)o1 ZINC000181778560 385602569 /nfs/dbraw/zinc/60/25/69/385602569.db2.gz PHSQSCNWVCFRDY-UHFFFAOYSA-N 1 2 249.318 2.004 20 0 BEADLO COC(=O)c1ccoc1C[N@@H+]1CCC=C(C)C1 ZINC000280797422 385603100 /nfs/dbraw/zinc/60/31/00/385603100.db2.gz KFRFYGIVOPPJFW-UHFFFAOYSA-N 1 2 235.283 2.218 20 0 BEADLO COC(=O)c1ccoc1C[N@H+]1CCC=C(C)C1 ZINC000280797422 385603110 /nfs/dbraw/zinc/60/31/10/385603110.db2.gz KFRFYGIVOPPJFW-UHFFFAOYSA-N 1 2 235.283 2.218 20 0 BEADLO CC(C)c1ccc([C@H](C)[N@@H+]2CCNC(=O)C2)cc1 ZINC000181510610 385581728 /nfs/dbraw/zinc/58/17/28/385581728.db2.gz SJHWLDBNQLKNFL-LBPRGKRZSA-N 1 2 246.354 2.303 20 0 BEADLO CC(C)c1ccc([C@H](C)[N@H+]2CCNC(=O)C2)cc1 ZINC000181510610 385581731 /nfs/dbraw/zinc/58/17/31/385581731.db2.gz SJHWLDBNQLKNFL-LBPRGKRZSA-N 1 2 246.354 2.303 20 0 BEADLO CC[C@@H](F)C[NH2+][C@H](C)c1nnc(C)s1 ZINC000336649058 385586933 /nfs/dbraw/zinc/58/69/33/385586933.db2.gz HIQVOWZAMVZQDI-HTRCEHHLSA-N 1 2 217.313 2.245 20 0 BEADLO CC(C)N(CC1CC1)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493647724 385587751 /nfs/dbraw/zinc/58/77/51/385587751.db2.gz IWKMSWBQSCMPLT-AATRIKPKSA-N 1 2 233.315 2.070 20 0 BEADLO COC[C@H](C)Nc1cc[nH+]c2ccncc12 ZINC000309455816 385588258 /nfs/dbraw/zinc/58/82/58/385588258.db2.gz MILRSQPPEUTOLF-VIFPVBQESA-N 1 2 217.272 2.077 20 0 BEADLO CCN(CCC1CC1)c1cc(C)[nH+]cn1 ZINC000354597469 385588313 /nfs/dbraw/zinc/58/83/13/385588313.db2.gz PRYDQVIZXKANCV-UHFFFAOYSA-N 1 2 205.305 2.411 20 0 BEADLO O=C(c1cccc(-n2cc[nH+]c2)c1)N1CCCC1 ZINC000117741575 385614652 /nfs/dbraw/zinc/61/46/52/385614652.db2.gz BAEOASIMFFXTNR-UHFFFAOYSA-N 1 2 241.294 2.108 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1cccnc1C ZINC000108279246 385629082 /nfs/dbraw/zinc/62/90/82/385629082.db2.gz QJJJAASIPOSPDF-UHFFFAOYSA-N 1 2 227.267 2.346 20 0 BEADLO COCc1cccc(Cn2cc[nH+]c2)c1 ZINC000269720782 385630171 /nfs/dbraw/zinc/63/01/71/385630171.db2.gz UFBZGLKRARJFRQ-UHFFFAOYSA-N 1 2 202.257 2.078 20 0 BEADLO Cc1[nH]ncc1C[NH2+]CC(C)(C)OCC1CC1 ZINC000414513702 385635182 /nfs/dbraw/zinc/63/51/82/385635182.db2.gz GOZVRSSMOKKDPL-UHFFFAOYSA-N 1 2 237.347 2.013 20 0 BEADLO CCCCC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000280858229 385611800 /nfs/dbraw/zinc/61/18/00/385611800.db2.gz XFEILVQDEFRYMI-UHFFFAOYSA-N 1 2 217.272 2.463 20 0 BEADLO COC(=O)[C@H](CC(F)F)[NH2+]CCCC(C)C ZINC000309501925 385639870 /nfs/dbraw/zinc/63/98/70/385639870.db2.gz AAYSINIWYJKZMF-VIFPVBQESA-N 1 2 237.290 2.209 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@H](C)c1cccs1 ZINC000281209068 385643666 /nfs/dbraw/zinc/64/36/66/385643666.db2.gz LNVMBUQHGZBDBX-SECBINFHSA-N 1 2 249.339 2.200 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@H](C)c1cccs1 ZINC000281209068 385643668 /nfs/dbraw/zinc/64/36/68/385643668.db2.gz LNVMBUQHGZBDBX-SECBINFHSA-N 1 2 249.339 2.200 20 0 BEADLO CO[C@@H](C)C[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000182230363 385647652 /nfs/dbraw/zinc/64/76/52/385647652.db2.gz NSUZWRLHICRHAT-JQWIXIFHSA-N 1 2 241.356 2.156 20 0 BEADLO CO[C@@H](C)C[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000182230363 385647657 /nfs/dbraw/zinc/64/76/57/385647657.db2.gz NSUZWRLHICRHAT-JQWIXIFHSA-N 1 2 241.356 2.156 20 0 BEADLO FC(F)[C@H]1CCCCN1CCCn1cc[nH+]c1 ZINC000337407921 385650600 /nfs/dbraw/zinc/65/06/00/385650600.db2.gz NOVZBQDSPGBKLU-LLVKDONJSA-N 1 2 243.301 2.393 20 0 BEADLO CC[N@H+](CC(F)F)CC1(SC)CC1 ZINC000336653133 385655563 /nfs/dbraw/zinc/65/55/63/385655563.db2.gz LWWOHRNIJOEJMT-UHFFFAOYSA-N 1 2 209.305 2.469 20 0 BEADLO CC[N@@H+](CC(F)F)CC1(SC)CC1 ZINC000336653133 385655566 /nfs/dbraw/zinc/65/55/66/385655566.db2.gz LWWOHRNIJOEJMT-UHFFFAOYSA-N 1 2 209.305 2.469 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1cn(C(C)C)cn1 ZINC000281338025 385658163 /nfs/dbraw/zinc/65/81/63/385658163.db2.gz SNMFUCYYUFLSFO-UHFFFAOYSA-N 1 2 244.298 2.420 20 0 BEADLO Cc1nc(N(C)C[C@H](C)c2nccs2)cc[nH+]1 ZINC000182355236 385661114 /nfs/dbraw/zinc/66/11/14/385661114.db2.gz NJMKMKIDLWHDJN-VIFPVBQESA-N 1 2 248.355 2.481 20 0 BEADLO Clc1cnc(C[NH+]2CCCC2)s1 ZINC000307168024 385661912 /nfs/dbraw/zinc/66/19/12/385661912.db2.gz TYOXBEQKRJFRIF-UHFFFAOYSA-N 1 2 202.710 2.392 20 0 BEADLO C[C@H]([NH2+]Cc1nnc2n1CCCC2)c1ccco1 ZINC000182620351 385689873 /nfs/dbraw/zinc/68/98/73/385689873.db2.gz LZXBTUAWYORQJY-JTQLQIEISA-N 1 2 246.314 2.058 20 0 BEADLO CN(c1cc(NCC2CC2)[nH+]cn1)C1CCC1 ZINC000270240834 385690059 /nfs/dbraw/zinc/69/00/59/385690059.db2.gz REMGWWZHLPCXNG-UHFFFAOYSA-N 1 2 232.331 2.287 20 0 BEADLO CN(c1cc(NCC2CC2)nc[nH+]1)C1CCC1 ZINC000270240834 385690062 /nfs/dbraw/zinc/69/00/62/385690062.db2.gz REMGWWZHLPCXNG-UHFFFAOYSA-N 1 2 232.331 2.287 20 0 BEADLO C[C@H](CO)CCCNc1cc[nH+]c2ccncc12 ZINC000270286216 385694440 /nfs/dbraw/zinc/69/44/40/385694440.db2.gz NEKTZWBNVZEIOX-NSHDSACASA-N 1 2 245.326 2.450 20 0 BEADLO COC(=O)c1ccoc1C[N@H+]1CC=C(C)CC1 ZINC000270314443 385697229 /nfs/dbraw/zinc/69/72/29/385697229.db2.gz JIAGTSXCZRXWHB-UHFFFAOYSA-N 1 2 235.283 2.218 20 0 BEADLO COC(=O)c1ccoc1C[N@@H+]1CC=C(C)CC1 ZINC000270314443 385697236 /nfs/dbraw/zinc/69/72/36/385697236.db2.gz JIAGTSXCZRXWHB-UHFFFAOYSA-N 1 2 235.283 2.218 20 0 BEADLO CO[C@@H](C)C[N@@H+]1CCCC[C@H]1C(F)F ZINC000337515292 385699612 /nfs/dbraw/zinc/69/96/12/385699612.db2.gz LLHSKDQHQMOGJV-IUCAKERBSA-N 1 2 207.264 2.141 20 0 BEADLO CO[C@@H](C)C[N@H+]1CCCC[C@H]1C(F)F ZINC000337515292 385699616 /nfs/dbraw/zinc/69/96/16/385699616.db2.gz LLHSKDQHQMOGJV-IUCAKERBSA-N 1 2 207.264 2.141 20 0 BEADLO Cn1c[nH+]cc1C[S@@](=O)CCCC(C)(C)C ZINC000281805668 385702458 /nfs/dbraw/zinc/70/24/58/385702458.db2.gz ISGNXLPVVRJRQE-INIZCTEOSA-N 1 2 242.388 2.495 20 0 BEADLO C[C@@H](CC(=O)OC(C)(C)C)[NH2+]C1(C(F)F)CC1 ZINC000337549668 385706618 /nfs/dbraw/zinc/70/66/18/385706618.db2.gz NPCSMPBFPCUBET-QMMMGPOBSA-N 1 2 249.301 2.494 20 0 BEADLO CCSCC[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000336684099 385668266 /nfs/dbraw/zinc/66/82/66/385668266.db2.gz JZBZOLSHCDVMJH-SECBINFHSA-N 1 2 233.377 2.059 20 0 BEADLO c1cn(Cc2nc(C3CC3)cs2)c[nH+]1 ZINC000307616736 385736449 /nfs/dbraw/zinc/73/64/49/385736449.db2.gz UHAGVHZSVMRYRE-UHFFFAOYSA-N 1 2 205.286 2.265 20 0 BEADLO COC(=O)C[NH2+][C@@H](c1ccccc1C)C(C)C ZINC000183230267 385744924 /nfs/dbraw/zinc/74/49/24/385744924.db2.gz SIXIFSLPQKLSTJ-CQSZACIVSA-N 1 2 235.327 2.455 20 0 BEADLO CCCc1cnc(NCc2c[nH+]cn2C)s1 ZINC000185978682 385745177 /nfs/dbraw/zinc/74/51/77/385745177.db2.gz ZQGWBHDDACVEOD-UHFFFAOYSA-N 1 2 236.344 2.441 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CC(C)(C)[C@H]1C(C)C ZINC000293957817 385775423 /nfs/dbraw/zinc/77/54/23/385775423.db2.gz PMGIMBSGEPATQW-CYBMUJFWSA-N 1 2 249.358 2.154 20 0 BEADLO C[C@H](O)C[C@@H]1CCCN1c1[nH]c2ccccc2[nH+]1 ZINC000270589917 385722445 /nfs/dbraw/zinc/72/24/45/385722445.db2.gz SKYJPDIXDXGPDL-QWRGUYRKSA-N 1 2 245.326 2.303 20 0 BEADLO CC(C)c1cc(N2CC(CO)C2)nc(C(C)C)[nH+]1 ZINC000182943813 385723342 /nfs/dbraw/zinc/72/33/42/385723342.db2.gz ZPPKLYHRCJABRM-UHFFFAOYSA-N 1 2 249.358 2.152 20 0 BEADLO CC[N@H+](CCOC)Cc1ncc(C2CC2)o1 ZINC000270643636 385726956 /nfs/dbraw/zinc/72/69/56/385726956.db2.gz SDHRUCFQYXCODK-UHFFFAOYSA-N 1 2 224.304 2.020 20 0 BEADLO CC[N@@H+](CCOC)Cc1ncc(C2CC2)o1 ZINC000270643636 385726965 /nfs/dbraw/zinc/72/69/65/385726965.db2.gz SDHRUCFQYXCODK-UHFFFAOYSA-N 1 2 224.304 2.020 20 0 BEADLO Cc1ccc(C[NH2+]CC(F)(F)CO)c(C)c1 ZINC000183877162 385801587 /nfs/dbraw/zinc/80/15/87/385801587.db2.gz BLJIRCAPSSQSDM-UHFFFAOYSA-N 1 2 229.270 2.021 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1cscn1)c1cnn(C)c1 ZINC000271195480 385802592 /nfs/dbraw/zinc/80/25/92/385802592.db2.gz YIKHFRINQRJCCH-IUCAKERBSA-N 1 2 236.344 2.288 20 0 BEADLO Cc1cnc(C[NH2+]Cc2ccoc2C)o1 ZINC000321345759 385808749 /nfs/dbraw/zinc/80/87/49/385808749.db2.gz CABMVBUGYGFHLI-UHFFFAOYSA-N 1 2 206.245 2.174 20 0 BEADLO Cc1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)c(F)c1 ZINC000638087459 385815897 /nfs/dbraw/zinc/81/58/97/385815897.db2.gz ASIFSMDCBWUAMX-BETUJISGSA-N 1 2 235.302 2.497 20 0 BEADLO Cc1ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c(F)c1 ZINC000638087459 385815899 /nfs/dbraw/zinc/81/58/99/385815899.db2.gz ASIFSMDCBWUAMX-BETUJISGSA-N 1 2 235.302 2.497 20 0 BEADLO c1cc(C[NH2+]Cc2cc3ccccc3[nH]2)[nH]n1 ZINC000340173122 385820086 /nfs/dbraw/zinc/82/00/86/385820086.db2.gz XRAIDUDBEUWHLO-UHFFFAOYSA-N 1 2 226.283 2.181 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@H]1CCO[C@H](C)C1 ZINC000271417422 385825819 /nfs/dbraw/zinc/82/58/19/385825819.db2.gz OLDJZMKWGJFESK-GHMZBOCLSA-N 1 2 249.314 2.079 20 0 BEADLO C[C@H](F)CC[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000340457305 385836182 /nfs/dbraw/zinc/83/61/82/385836182.db2.gz CPFPOKREWZGBJL-CMPLNLGQSA-N 1 2 248.305 2.232 20 0 BEADLO C[C@H](F)CC[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000340457306 385836596 /nfs/dbraw/zinc/83/65/96/385836596.db2.gz CPFPOKREWZGBJL-JQWIXIFHSA-N 1 2 248.305 2.232 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)Nc1ccnc(C2CC2)n1 ZINC000271621533 385841054 /nfs/dbraw/zinc/84/10/54/385841054.db2.gz MENKSGGVKKIXBS-JTQLQIEISA-N 1 2 243.314 2.051 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCc2ccccc2C1 ZINC000283923070 385841341 /nfs/dbraw/zinc/84/13/41/385841341.db2.gz HBTUCYREJZBMDZ-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCc2ccccc2C1 ZINC000283923070 385841347 /nfs/dbraw/zinc/84/13/47/385841347.db2.gz HBTUCYREJZBMDZ-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO CC[C@H](Cc1ccc(C)cc1)[NH2+][C@@H](C)C(=O)OC ZINC000271846453 385855581 /nfs/dbraw/zinc/85/55/81/385855581.db2.gz UZRQTGSJAUPMRA-GXTWGEPZSA-N 1 2 249.354 2.467 20 0 BEADLO Cc1ccoc1C[N@H+](C)Cc1ccon1 ZINC000271167605 385795987 /nfs/dbraw/zinc/79/59/87/385795987.db2.gz COOQLLGBTRBEAB-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO Cc1ccoc1C[N@@H+](C)Cc1ccon1 ZINC000271167605 385795992 /nfs/dbraw/zinc/79/59/92/385795992.db2.gz COOQLLGBTRBEAB-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO CN(c1nc[nH+]c2c1OCCN2)C1CCCCC1 ZINC000647844808 385894687 /nfs/dbraw/zinc/89/46/87/385894687.db2.gz YMAQFXKLHYDXIG-UHFFFAOYSA-N 1 2 248.330 2.050 20 0 BEADLO CN(c1[nH+]cnc2c1OCCN2)C1CCCCC1 ZINC000647844808 385894690 /nfs/dbraw/zinc/89/46/90/385894690.db2.gz YMAQFXKLHYDXIG-UHFFFAOYSA-N 1 2 248.330 2.050 20 0 BEADLO CC(C)(C)CCc1noc(CCn2cc[nH+]c2)n1 ZINC000285046355 385895100 /nfs/dbraw/zinc/89/51/00/385895100.db2.gz HEYIVUTWVCCXGJ-UHFFFAOYSA-N 1 2 248.330 2.488 20 0 BEADLO Fc1ccc(C[NH2+]Cc2nnc(C3CC3)[nH]2)cc1 ZINC000294830054 385901685 /nfs/dbraw/zinc/90/16/85/385901685.db2.gz PXOQAPGQWNRFBX-UHFFFAOYSA-N 1 2 246.289 2.111 20 0 BEADLO CC(C)c1nnc([C@H](C)[NH2+][C@@H](C)c2cn[nH]c2)[nH]1 ZINC000285157027 385903172 /nfs/dbraw/zinc/90/31/72/385903172.db2.gz MKVAZYHBDDOOSG-IUCAKERBSA-N 1 2 248.334 2.063 20 0 BEADLO Cc1cn[nH]c1CNc1ccc2c([nH+]1)CCC2 ZINC000294850862 385903733 /nfs/dbraw/zinc/90/37/33/385903733.db2.gz NMFFBUGVANMWLH-UHFFFAOYSA-N 1 2 228.299 2.214 20 0 BEADLO FC1=CCCN(Cc2cn3ccccc3[nH+]2)C1 ZINC000272495445 385906092 /nfs/dbraw/zinc/90/60/92/385906092.db2.gz NKQBAVFMFXUCDC-UHFFFAOYSA-N 1 2 231.274 2.393 20 0 BEADLO Cc1ccncc1C[N@@H+]1CCC=C(F)C1 ZINC000272564507 385912265 /nfs/dbraw/zinc/91/22/65/385912265.db2.gz UPSXDZPRNKLPCV-UHFFFAOYSA-N 1 2 206.264 2.449 20 0 BEADLO Cc1ccncc1C[N@H+]1CCC=C(F)C1 ZINC000272564507 385912271 /nfs/dbraw/zinc/91/22/71/385912271.db2.gz UPSXDZPRNKLPCV-UHFFFAOYSA-N 1 2 206.264 2.449 20 0 BEADLO Cc1noc(C[N@@H+]2CCC=C(c3ccco3)C2)n1 ZINC000285313775 385912854 /nfs/dbraw/zinc/91/28/54/385912854.db2.gz MIRXVMRDWCAVBO-UHFFFAOYSA-N 1 2 245.282 2.260 20 0 BEADLO Cc1noc(C[N@H+]2CCC=C(c3ccco3)C2)n1 ZINC000285313775 385912856 /nfs/dbraw/zinc/91/28/56/385912856.db2.gz MIRXVMRDWCAVBO-UHFFFAOYSA-N 1 2 245.282 2.260 20 0 BEADLO Cc1nonc1C[N@@H+]1CCC=C(c2ccco2)C1 ZINC000285301884 385913651 /nfs/dbraw/zinc/91/36/51/385913651.db2.gz LGXUIFXIYDDWMD-UHFFFAOYSA-N 1 2 245.282 2.260 20 0 BEADLO Cc1nonc1C[N@H+]1CCC=C(c2ccco2)C1 ZINC000285301884 385913657 /nfs/dbraw/zinc/91/36/57/385913657.db2.gz LGXUIFXIYDDWMD-UHFFFAOYSA-N 1 2 245.282 2.260 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCC=C(F)C1 ZINC000272605819 385916899 /nfs/dbraw/zinc/91/68/99/385916899.db2.gz ZCSHIPWNGVVEKI-UHFFFAOYSA-N 1 2 210.252 2.351 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCC=C(F)C1 ZINC000272605819 385916905 /nfs/dbraw/zinc/91/69/05/385916905.db2.gz ZCSHIPWNGVVEKI-UHFFFAOYSA-N 1 2 210.252 2.351 20 0 BEADLO COCc1cccc(COCc2[nH]cc[nH+]2)c1 ZINC000272024115 385869331 /nfs/dbraw/zinc/86/93/31/385869331.db2.gz IJMRKOFGDWOTHK-UHFFFAOYSA-N 1 2 232.283 2.273 20 0 BEADLO CC/C(C)=C/C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000294669775 385879868 /nfs/dbraw/zinc/87/98/68/385879868.db2.gz SLWALBBHIBNZER-LMMOQWNQSA-N 1 2 247.342 2.472 20 0 BEADLO CCc1ccc(C[NH2+]Cc2nnc(C3CC3)[nH]2)o1 ZINC000294664436 385880695 /nfs/dbraw/zinc/88/06/95/385880695.db2.gz AJONMHMHYHWWQD-UHFFFAOYSA-N 1 2 246.314 2.127 20 0 BEADLO CC/C(C)=C/C(=O)Nc1c[nH+]ccc1OC ZINC000294688672 385882626 /nfs/dbraw/zinc/88/26/26/385882626.db2.gz XFJHCDOYXSPWDX-VQHVLOKHSA-N 1 2 220.272 2.385 20 0 BEADLO CC[C@H]([NH2+]C[C@@H](SC)C(C)(C)C)C(=O)OC ZINC000336747642 385978208 /nfs/dbraw/zinc/97/82/08/385978208.db2.gz XKQJGFHQKBLNAZ-VHSXEESVSA-N 1 2 247.404 2.305 20 0 BEADLO COC(=O)c1ccc(C[N@H+](C)Cc2ccoc2)o1 ZINC000345093117 385995406 /nfs/dbraw/zinc/99/54/06/385995406.db2.gz SRHZGPFVDRXQGN-UHFFFAOYSA-N 1 2 249.266 2.291 20 0 BEADLO Fc1ccc(CN2CCn3cc[nH+]c3C2)cc1F ZINC000334320998 385985689 /nfs/dbraw/zinc/98/56/89/385985689.db2.gz HLXNZLMJDPEOAT-UHFFFAOYSA-N 1 2 249.264 2.177 20 0 BEADLO COC[C@@H]([NH2+]Cc1ccno1)c1ccc(C)o1 ZINC000273335082 385990145 /nfs/dbraw/zinc/99/01/45/385990145.db2.gz DAKULQWKBPRYQY-LLVKDONJSA-N 1 2 236.271 2.053 20 0 BEADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1cc[nH]n1 ZINC000285530421 385938442 /nfs/dbraw/zinc/93/84/42/385938442.db2.gz PSFGLSGTILQWCQ-UHFFFAOYSA-N 1 2 234.303 2.039 20 0 BEADLO CC[C@@H]1CCC[N@@H+]1Cc1nc(C(F)F)no1 ZINC000425392460 385941372 /nfs/dbraw/zinc/94/13/72/385941372.db2.gz GWFDSONKUQXPJR-SSDOTTSWSA-N 1 2 231.246 2.382 20 0 BEADLO CC[C@@H]1CCC[N@H+]1Cc1nc(C(F)F)no1 ZINC000425392460 385941379 /nfs/dbraw/zinc/94/13/79/385941379.db2.gz GWFDSONKUQXPJR-SSDOTTSWSA-N 1 2 231.246 2.382 20 0 BEADLO CCC[N@H+](CC(F)F)C[C@H](OC)C1CC1 ZINC000425391684 385943711 /nfs/dbraw/zinc/94/37/11/385943711.db2.gz DYDCRCIZLORCER-JTQLQIEISA-N 1 2 221.291 2.389 20 0 BEADLO CCC[N@@H+](CC(F)F)C[C@H](OC)C1CC1 ZINC000425391684 385943716 /nfs/dbraw/zinc/94/37/16/385943716.db2.gz DYDCRCIZLORCER-JTQLQIEISA-N 1 2 221.291 2.389 20 0 BEADLO C[C@@H](CCCO)CNc1cc[nH+]c2ccncc12 ZINC000295016847 385944351 /nfs/dbraw/zinc/94/43/51/385944351.db2.gz UAZPTOJJXVHMET-NSHDSACASA-N 1 2 245.326 2.450 20 0 BEADLO CO[C@@H]1CCC[N@@H+]([C@H](C)c2nnc(C)s2)C1 ZINC000338284541 385947614 /nfs/dbraw/zinc/94/76/14/385947614.db2.gz QXSGUBLOYGBFGF-PSASIEDQSA-N 1 2 241.360 2.018 20 0 BEADLO CO[C@@H]1CCC[N@H+]([C@H](C)c2nnc(C)s2)C1 ZINC000338284541 385947618 /nfs/dbraw/zinc/94/76/18/385947618.db2.gz QXSGUBLOYGBFGF-PSASIEDQSA-N 1 2 241.360 2.018 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@]1(C)CCCOC1 ZINC000272920131 385950260 /nfs/dbraw/zinc/95/02/60/385950260.db2.gz GOKIEHPOYGBNRV-ZDUSSCGKSA-N 1 2 234.299 2.145 20 0 BEADLO c1cc([NH2+]C2CCOCC2)cc2c1NCC2 ZINC000335055860 385955636 /nfs/dbraw/zinc/95/56/36/385955636.db2.gz RADJEPATDALRLK-UHFFFAOYSA-N 1 2 218.300 2.246 20 0 BEADLO c1cc(NC2CCOCC2)cc2c1[NH2+]CC2 ZINC000335055860 385955642 /nfs/dbraw/zinc/95/56/42/385955642.db2.gz RADJEPATDALRLK-UHFFFAOYSA-N 1 2 218.300 2.246 20 0 BEADLO C[C@@H](CF)[NH2+]Cc1nccn1Cc1ccccc1 ZINC000342211634 385960091 /nfs/dbraw/zinc/96/00/91/385960091.db2.gz ZTBUTGBIAPTBFJ-LBPRGKRZSA-N 1 2 247.317 2.379 20 0 BEADLO C[C@@H](CF)[NH2+]Cc1nccn1-c1ccccc1 ZINC000342208919 385960873 /nfs/dbraw/zinc/96/08/73/385960873.db2.gz VSMNIURNUREVBV-NSHDSACASA-N 1 2 233.290 2.320 20 0 BEADLO COC(=O)c1ccc(C[N@@H+](C)Cc2ccoc2)o1 ZINC000345093117 385995411 /nfs/dbraw/zinc/99/54/11/385995411.db2.gz SRHZGPFVDRXQGN-UHFFFAOYSA-N 1 2 249.266 2.291 20 0 BEADLO CC[C@@H]1CCC[C@H]1CNC(=O)Cc1[nH]c[nH+]c1C ZINC000452992921 385999148 /nfs/dbraw/zinc/99/91/48/385999148.db2.gz CWHJCSZPMNASSP-NEPJUHHUSA-N 1 2 249.358 2.203 20 0 BEADLO CC[C@@H]1CCC[C@H]1CNC(=O)Cc1[nH+]c[nH]c1C ZINC000452992921 385999159 /nfs/dbraw/zinc/99/91/59/385999159.db2.gz CWHJCSZPMNASSP-NEPJUHHUSA-N 1 2 249.358 2.203 20 0 BEADLO COC(=O)c1oc(COc2cc[nH+]cc2)cc1C ZINC000356100383 386001752 /nfs/dbraw/zinc/00/17/52/386001752.db2.gz SIPKQAORBRRNBX-UHFFFAOYSA-N 1 2 247.250 2.349 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2CCCC3(CC3)C2)no1 ZINC000334434683 386055818 /nfs/dbraw/zinc/05/58/18/386055818.db2.gz YNMYNWVEPGEOBN-SECBINFHSA-N 1 2 221.304 2.315 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2CCCC3(CC3)C2)no1 ZINC000334434683 386055824 /nfs/dbraw/zinc/05/58/24/386055824.db2.gz YNMYNWVEPGEOBN-SECBINFHSA-N 1 2 221.304 2.315 20 0 BEADLO Cc1cc[nH+]c(NC[C@@H](O)C(C)C)c1Cl ZINC000336752821 386018487 /nfs/dbraw/zinc/01/84/87/386018487.db2.gz HFKBBSONCWBLSY-SECBINFHSA-N 1 2 228.723 2.472 20 0 BEADLO c1ccc(N2CCC[C@@H]2[C@@H]2CCCO2)[nH+]c1 ZINC000286290334 386019281 /nfs/dbraw/zinc/01/92/81/386019281.db2.gz DAOIPICLHIIWKX-NEPJUHHUSA-N 1 2 218.300 2.229 20 0 BEADLO CC[C@H](F)C[NH2+][C@H](COC)c1ccco1 ZINC000336771041 386024635 /nfs/dbraw/zinc/02/46/35/386024635.db2.gz WFFFHNKHVNPVHK-VHSXEESVSA-N 1 2 215.268 2.305 20 0 BEADLO Cc1cc(CNC(=O)OC2CCC2)cc(C)[nH+]1 ZINC000496911122 386024775 /nfs/dbraw/zinc/02/47/75/386024775.db2.gz VRFVRVNVXGWBFX-UHFFFAOYSA-N 1 2 234.299 2.477 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1ccsc1C ZINC000295395910 386027430 /nfs/dbraw/zinc/02/74/30/386027430.db2.gz QEUAORNVTMBOHB-UHFFFAOYSA-N 1 2 227.329 2.051 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1ccsc1C ZINC000295395910 386027434 /nfs/dbraw/zinc/02/74/34/386027434.db2.gz QEUAORNVTMBOHB-UHFFFAOYSA-N 1 2 227.329 2.051 20 0 BEADLO CO[C@H](C)CN(C)c1nc(C)[nH+]c2c1CCCC2 ZINC000286374102 386031503 /nfs/dbraw/zinc/03/15/03/386031503.db2.gz LPFSFOSAUXPOAN-SNVBAGLBSA-N 1 2 249.358 2.135 20 0 BEADLO CO[C@@H](C)CN(C)c1[nH]c2ccccc2[nH+]1 ZINC000286413917 386034608 /nfs/dbraw/zinc/03/46/08/386034608.db2.gz ODFFXNHYCYDODM-VIFPVBQESA-N 1 2 219.288 2.034 20 0 BEADLO CO[C@H]1C[C@@H](N(C)c2[nH]c3ccccc3[nH+]2)C1 ZINC000286420546 386037162 /nfs/dbraw/zinc/03/71/62/386037162.db2.gz QYSWDXKQTISKIT-AOOOYVTPSA-N 1 2 231.299 2.177 20 0 BEADLO Cc1cc(CNC(=O)C2(C)CC2)cc(C)[nH+]1 ZINC000335073794 386037289 /nfs/dbraw/zinc/03/72/89/386037289.db2.gz NBCUAQIQGWEDOV-UHFFFAOYSA-N 1 2 218.300 2.115 20 0 BEADLO CCCCC[N@@H+]1CC(=O)N[C@]12CC[C@H](C)C2 ZINC000414200800 386038730 /nfs/dbraw/zinc/03/87/30/386038730.db2.gz DLQTUOQOTUPHDP-WCQYABFASA-N 1 2 224.348 2.125 20 0 BEADLO CCCCC[N@H+]1CC(=O)N[C@]12CC[C@H](C)C2 ZINC000414200800 386038733 /nfs/dbraw/zinc/03/87/33/386038733.db2.gz DLQTUOQOTUPHDP-WCQYABFASA-N 1 2 224.348 2.125 20 0 BEADLO CO[C@@H](C[N@H+](C)Cc1ccon1)c1ccccc1 ZINC000338548312 386041828 /nfs/dbraw/zinc/04/18/28/386041828.db2.gz SJKNPLMWWLTMKG-AWEZNQCLSA-N 1 2 246.310 2.494 20 0 BEADLO CO[C@@H](C[N@@H+](C)Cc1ccon1)c1ccccc1 ZINC000338548312 386041833 /nfs/dbraw/zinc/04/18/33/386041833.db2.gz SJKNPLMWWLTMKG-AWEZNQCLSA-N 1 2 246.310 2.494 20 0 BEADLO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2cn[nH]c2)o1 ZINC000303741080 386045592 /nfs/dbraw/zinc/04/55/92/386045592.db2.gz HDOCNZKAGWOYBE-IUCAKERBSA-N 1 2 220.276 2.118 20 0 BEADLO CSCCc1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000273856549 386046095 /nfs/dbraw/zinc/04/60/95/386046095.db2.gz DDADCZZTSMEMBJ-UHFFFAOYSA-N 1 2 249.339 2.269 20 0 BEADLO C[NH2+]Cc1noc(/C(C)=C\C(C)(C)C)n1 ZINC000414645027 386049211 /nfs/dbraw/zinc/04/92/11/386049211.db2.gz PRXOPOAVVXASGI-VURMDHGXSA-N 1 2 209.293 2.238 20 0 BEADLO CCO[C@H](C)c1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000273885188 386049334 /nfs/dbraw/zinc/04/93/34/386049334.db2.gz HISYFNJCRUPBRB-SNVBAGLBSA-N 1 2 247.298 2.461 20 0 BEADLO Cc1ccc(Cc2noc([C@@]3(C)C[C@H]3F)n2)c[nH+]1 ZINC000335078656 386051657 /nfs/dbraw/zinc/05/16/57/386051657.db2.gz RILKLVBBSPABKF-MFKMUULPSA-N 1 2 247.273 2.363 20 0 BEADLO Cn1cccc1C(=O)C[N@@H+]1CCC[C@](C)(F)C1 ZINC000295571917 386051762 /nfs/dbraw/zinc/05/17/62/386051762.db2.gz YWRYQGICVFVWJU-ZDUSSCGKSA-N 1 2 238.306 2.032 20 0 BEADLO Cn1cccc1C(=O)C[N@H+]1CCC[C@](C)(F)C1 ZINC000295571917 386051768 /nfs/dbraw/zinc/05/17/68/386051768.db2.gz YWRYQGICVFVWJU-ZDUSSCGKSA-N 1 2 238.306 2.032 20 0 BEADLO CO[C@H](C)CN(C)c1cc[nH+]c2ccncc21 ZINC000286584081 386055077 /nfs/dbraw/zinc/05/50/77/386055077.db2.gz RFQQXSRQYWPOSA-SNVBAGLBSA-N 1 2 231.299 2.101 20 0 BEADLO CC[C@@H](C)C(=O)N1CC(C)(C)[C@@H]1c1[nH+]ccn1C ZINC000295988038 386119274 /nfs/dbraw/zinc/11/92/74/386119274.db2.gz UMKMDNYQAWBIBJ-MNOVXSKESA-N 1 2 249.358 2.376 20 0 BEADLO CCCC1(C(=O)NCCCn2cc[nH+]c2)CCC1 ZINC000345210793 386061143 /nfs/dbraw/zinc/06/11/43/386061143.db2.gz GMJKWHJAXPTSNR-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@]12CCC(C)(C)C2 ZINC000414210998 386064611 /nfs/dbraw/zinc/06/46/11/386064611.db2.gz VAKNHAKSYHDVJC-CYBMUJFWSA-N 1 2 224.348 2.123 20 0 BEADLO Cc1csc(C[N@@H+]2CCOC(C)(C)C2)n1 ZINC000334441636 386073561 /nfs/dbraw/zinc/07/35/61/386073561.db2.gz BUNSKNKGRDAVNQ-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1csc(C[N@H+]2CCOC(C)(C)C2)n1 ZINC000334441636 386073565 /nfs/dbraw/zinc/07/35/65/386073565.db2.gz BUNSKNKGRDAVNQ-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO C[C@H](O)C[N@@H+]1Cc2cccc(Cl)c2C1 ZINC000287425190 386122387 /nfs/dbraw/zinc/12/23/87/386122387.db2.gz PFIFLJVCOYYICN-QMMMGPOBSA-N 1 2 211.692 2.036 20 0 BEADLO C[C@H](O)C[N@H+]1Cc2cccc(Cl)c2C1 ZINC000287425190 386122392 /nfs/dbraw/zinc/12/23/92/386122392.db2.gz PFIFLJVCOYYICN-QMMMGPOBSA-N 1 2 211.692 2.036 20 0 BEADLO Cc1c(Cl)c(C[NH+]2CC(C(C)C)C2)nn1C ZINC000643293345 386080139 /nfs/dbraw/zinc/08/01/39/386080139.db2.gz XPMOREULACOLQV-UHFFFAOYSA-N 1 2 241.766 2.470 20 0 BEADLO COc1cc(C[NH2+][C@H](C)c2cscn2)ccn1 ZINC000162350338 386085990 /nfs/dbraw/zinc/08/59/90/386085990.db2.gz VUHNFBXJVWXSBV-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO Cc1cc(CNc2ccc(C)[nH+]c2)nn1C ZINC000414288926 386098135 /nfs/dbraw/zinc/09/81/35/386098135.db2.gz HGWFXHAXMHGAFI-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO Cn1c2ccccc2[nH+]c1N[C@H]1CCC[C@H]1F ZINC000338824403 386147337 /nfs/dbraw/zinc/14/73/37/386147337.db2.gz NSDQNEMIBGLITL-ZJUUUORDSA-N 1 2 233.290 2.298 20 0 BEADLO CCOC(=O)C[N@H+](Cc1ccoc1C)C(C)C ZINC000414367936 386154889 /nfs/dbraw/zinc/15/48/89/386154889.db2.gz FUEZIOGKVFAQKY-UHFFFAOYSA-N 1 2 239.315 2.362 20 0 BEADLO CCOC(=O)C[N@@H+](Cc1ccoc1C)C(C)C ZINC000414367936 386154892 /nfs/dbraw/zinc/15/48/92/386154892.db2.gz FUEZIOGKVFAQKY-UHFFFAOYSA-N 1 2 239.315 2.362 20 0 BEADLO CCc1nnc([C@@H](C)[NH2+]Cc2ccoc2C)[nH]1 ZINC000414368847 386155579 /nfs/dbraw/zinc/15/55/79/386155579.db2.gz TVIWXFXSLVOALU-MRVPVSSYSA-N 1 2 234.303 2.119 20 0 BEADLO Cc1cc(N[C@@H]2CCC[C@H]2F)nc(C2CC2)[nH+]1 ZINC000338844828 386157841 /nfs/dbraw/zinc/15/78/41/386157841.db2.gz SECHXDBHDTXWET-GHMZBOCLSA-N 1 2 235.306 2.387 20 0 BEADLO CC1(C)CCCC[C@H]1NC(=O)CCc1[nH]cc[nH+]1 ZINC000288270358 386180345 /nfs/dbraw/zinc/18/03/45/386180345.db2.gz GGWSCBYFCVSKLW-LLVKDONJSA-N 1 2 249.358 2.427 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ccco2)nn1 ZINC000414374437 386182008 /nfs/dbraw/zinc/18/20/08/386182008.db2.gz VRQYSGCIINEVGO-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ccco2)nn1 ZINC000414374437 386182015 /nfs/dbraw/zinc/18/20/15/386182015.db2.gz VRQYSGCIINEVGO-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cncc(F)c2)C[C@@H](C)O1 ZINC000275121094 386183431 /nfs/dbraw/zinc/18/34/31/386183431.db2.gz JDQOSLBKVXKGAX-MFKMUULPSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cncc(F)c2)C[C@@H](C)O1 ZINC000275121094 386183434 /nfs/dbraw/zinc/18/34/34/386183434.db2.gz JDQOSLBKVXKGAX-MFKMUULPSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]([NH2+][C@@H](C)C(F)(F)F)[C@H]1CCOC1 ZINC000336773645 386126568 /nfs/dbraw/zinc/12/65/68/386126568.db2.gz YXRRZJRIKGWTKO-CIUDSAMLSA-N 1 2 225.254 2.342 20 0 BEADLO F[C@@H]1CCCN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000335206784 386128629 /nfs/dbraw/zinc/12/86/29/386128629.db2.gz KHNAOXNEXYPJCE-SNVBAGLBSA-N 1 2 221.279 2.292 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1csc(C)c1 ZINC000296887279 386208784 /nfs/dbraw/zinc/20/87/84/386208784.db2.gz QDYIRSZHLVRPIO-SECBINFHSA-N 1 2 227.329 2.050 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1csc(C)c1 ZINC000296887279 386208791 /nfs/dbraw/zinc/20/87/91/386208791.db2.gz QDYIRSZHLVRPIO-SECBINFHSA-N 1 2 227.329 2.050 20 0 BEADLO CC[C@H](NC(=O)CCn1cc[nH+]c1)[C@@H]1CC1(C)C ZINC000416072959 386214684 /nfs/dbraw/zinc/21/46/84/386214684.db2.gz FVQBBQNCOQKXLE-RYUDHWBXSA-N 1 2 249.358 2.214 20 0 BEADLO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1cocn1 ZINC000288555638 386215633 /nfs/dbraw/zinc/21/56/33/386215633.db2.gz LXTQSENDIJMBEL-NOZJJQNGSA-N 1 2 230.267 2.286 20 0 BEADLO CC[C@H]1CC[C@H](C)N1C(=O)CCc1[nH]cc[nH+]1 ZINC000288608805 386219502 /nfs/dbraw/zinc/21/95/02/386219502.db2.gz UUWFSOFVRJXZJM-QWRGUYRKSA-N 1 2 235.331 2.132 20 0 BEADLO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1nccn1C ZINC000288625740 386222278 /nfs/dbraw/zinc/22/22/78/386222278.db2.gz SEJQCGMLZCYDGI-IINYFYTJSA-N 1 2 243.310 2.032 20 0 BEADLO Cc1cnc([C@H](C)NCc2[nH]cc[nH+]2)s1 ZINC000125188167 386226494 /nfs/dbraw/zinc/22/64/94/386226494.db2.gz LVAUQTJUSSWUHO-QMMMGPOBSA-N 1 2 222.317 2.025 20 0 BEADLO CC[C@H]1CCC[C@H]1CNC(=O)CCn1cc[nH+]c1 ZINC000452523546 386230950 /nfs/dbraw/zinc/23/09/50/386230950.db2.gz GGGLLQAQLURPSZ-STQMWFEESA-N 1 2 249.358 2.216 20 0 BEADLO FC(F)(F)[C@H](N[C@@H]1CCn2cc[nH+]c21)C1CC1 ZINC000297239843 386235241 /nfs/dbraw/zinc/23/52/41/386235241.db2.gz ILVWAKZIRCCXTL-RKDXNWHRSA-N 1 2 245.248 2.258 20 0 BEADLO CCC1(CC)C[NH+](Cc2cn[nH]c2C)C1 ZINC000297301847 386242067 /nfs/dbraw/zinc/24/20/67/386242067.db2.gz BIGFUYWJOLLGJZ-UHFFFAOYSA-N 1 2 207.321 2.340 20 0 BEADLO c1nnc([C@@H]([NH2+]CC2CCC2)c2ccccc2)[nH]1 ZINC000275822892 386244277 /nfs/dbraw/zinc/24/42/77/386244277.db2.gz KFXXXYFVCPHOQZ-ZDUSSCGKSA-N 1 2 242.326 2.284 20 0 BEADLO COCc1cc(CNc2c[nH+]cc(C)c2)no1 ZINC000297322963 386245263 /nfs/dbraw/zinc/24/52/63/386245263.db2.gz CKNYBCYOVWDEHU-UHFFFAOYSA-N 1 2 233.271 2.137 20 0 BEADLO CC(C)C(C)(C)C(=O)NCCNc1cccc[nH+]1 ZINC000275854333 386247025 /nfs/dbraw/zinc/24/70/25/386247025.db2.gz FCMFIAOJXPYYBX-UHFFFAOYSA-N 1 2 249.358 2.292 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2c(C)cnn2C)o1 ZINC000289047995 386254140 /nfs/dbraw/zinc/25/41/40/386254140.db2.gz IDZWHPFANRLYLC-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2c(C)cnn2C)o1 ZINC000289047995 386254146 /nfs/dbraw/zinc/25/41/46/386254146.db2.gz IDZWHPFANRLYLC-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO Cc1cnn(C)c1C[N@H+](C)Cc1ccccc1F ZINC000289061059 386256003 /nfs/dbraw/zinc/25/60/03/386256003.db2.gz JDAXKWKQZQCGJQ-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1cnn(C)c1C[N@@H+](C)Cc1ccccc1F ZINC000289061059 386256010 /nfs/dbraw/zinc/25/60/10/386256010.db2.gz JDAXKWKQZQCGJQ-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO CC[C@H](NC(=O)CCc1[nH]cc[nH+]1)[C@H]1CC1(C)C ZINC000416279135 386257023 /nfs/dbraw/zinc/25/70/23/386257023.db2.gz SSZMTQUYBTUFSF-MNOVXSKESA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)c1nnc(Cn2c[nH+]c3c2CCCC3)[nH]1 ZINC000296661445 386192656 /nfs/dbraw/zinc/19/26/56/386192656.db2.gz JXWZYWRQKWTVGT-UHFFFAOYSA-N 1 2 245.330 2.052 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cccc(C)n2)nn1 ZINC000414397727 386286305 /nfs/dbraw/zinc/28/63/05/386286305.db2.gz PRDSIHNQRQQGTN-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cccc(C)n2)nn1 ZINC000414397727 386286307 /nfs/dbraw/zinc/28/63/07/386286307.db2.gz PRDSIHNQRQQGTN-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@@H]2CC[C@H](C)O2)cs1 ZINC000336667651 386295227 /nfs/dbraw/zinc/29/52/27/386295227.db2.gz MPCMMISPRXNHOX-CABZTGNLSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@@H]2CC[C@H](C)O2)cs1 ZINC000336667651 386295235 /nfs/dbraw/zinc/29/52/35/386295235.db2.gz MPCMMISPRXNHOX-CABZTGNLSA-N 1 2 240.372 2.451 20 0 BEADLO C[N@H+](Cc1cocn1)[C@@H](CCO)c1ccccc1 ZINC000276284161 386295396 /nfs/dbraw/zinc/29/53/96/386295396.db2.gz FUMVDIREBSAYCJ-AWEZNQCLSA-N 1 2 246.310 2.230 20 0 BEADLO C[N@@H+](Cc1cocn1)[C@@H](CCO)c1ccccc1 ZINC000276284161 386295401 /nfs/dbraw/zinc/29/54/01/386295401.db2.gz FUMVDIREBSAYCJ-AWEZNQCLSA-N 1 2 246.310 2.230 20 0 BEADLO CCC[N@H+](CCC(C)(C)O)CC(F)F ZINC000347296216 386298369 /nfs/dbraw/zinc/29/83/69/386298369.db2.gz DFIXAUQBGDQQRL-UHFFFAOYSA-N 1 2 209.280 2.125 20 0 BEADLO CCC[N@@H+](CCC(C)(C)O)CC(F)F ZINC000347296216 386298373 /nfs/dbraw/zinc/29/83/73/386298373.db2.gz DFIXAUQBGDQQRL-UHFFFAOYSA-N 1 2 209.280 2.125 20 0 BEADLO CCn1c[nH+]cc1CNc1cccc(SC)n1 ZINC000416426187 386300891 /nfs/dbraw/zinc/30/08/91/386300891.db2.gz HVSRXCRMNDBKFZ-UHFFFAOYSA-N 1 2 248.355 2.054 20 0 BEADLO Cc1cc[nH+]c(NC[C@H]2CCOC2)c1Cl ZINC000336731532 386324890 /nfs/dbraw/zinc/32/48/90/386324890.db2.gz KTVHWWVYJYITID-SECBINFHSA-N 1 2 226.707 2.492 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CC[C@@H](C)C[C@H]2C)c[nH+]1 ZINC000265086697 386303924 /nfs/dbraw/zinc/30/39/24/386303924.db2.gz RYMUVXGOFNHNAK-FXPVBKGRSA-N 1 2 235.331 2.273 20 0 BEADLO Cc1nonc1C[N@@H+]1CCc2ccccc2[C@@H]1C ZINC000265137026 386310507 /nfs/dbraw/zinc/31/05/07/386310507.db2.gz OWTSPYYYIQWBFX-NSHDSACASA-N 1 2 243.310 2.497 20 0 BEADLO Cc1nonc1C[N@H+]1CCc2ccccc2[C@@H]1C ZINC000265137026 386310509 /nfs/dbraw/zinc/31/05/09/386310509.db2.gz OWTSPYYYIQWBFX-NSHDSACASA-N 1 2 243.310 2.497 20 0 BEADLO COC[C@H]([NH2+]Cc1[nH]ncc1C)c1ccc(C)o1 ZINC000289470209 386310783 /nfs/dbraw/zinc/31/07/83/386310783.db2.gz JADOEFIASARVBH-LBPRGKRZSA-N 1 2 249.314 2.097 20 0 BEADLO COC[C@H]([NH2+]Cc1n[nH]cc1C)c1ccc(C)o1 ZINC000289470209 386310788 /nfs/dbraw/zinc/31/07/88/386310788.db2.gz JADOEFIASARVBH-LBPRGKRZSA-N 1 2 249.314 2.097 20 0 BEADLO CC[N@H+](C)[C@@H](c1nc(C)no1)c1ccccc1 ZINC000276366430 386311930 /nfs/dbraw/zinc/31/19/30/386311930.db2.gz NFLGYZKFMSXDOO-GFCCVEGCSA-N 1 2 231.299 2.419 20 0 BEADLO CC[N@@H+](C)[C@@H](c1nc(C)no1)c1ccccc1 ZINC000276366430 386311932 /nfs/dbraw/zinc/31/19/32/386311932.db2.gz NFLGYZKFMSXDOO-GFCCVEGCSA-N 1 2 231.299 2.419 20 0 BEADLO Cc1nonc1C[N@H+]1CCC[C@@H]1c1cccn1C ZINC000265162090 386313212 /nfs/dbraw/zinc/31/32/12/386313212.db2.gz WFGNXMSKIIGQMY-CYBMUJFWSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1nonc1C[N@@H+]1CCC[C@@H]1c1cccn1C ZINC000265162090 386313218 /nfs/dbraw/zinc/31/32/18/386313218.db2.gz WFGNXMSKIIGQMY-CYBMUJFWSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cn[nH]c1C[NH2+]Cc1nc(C2CC2)cs1 ZINC000289498237 386315762 /nfs/dbraw/zinc/31/57/62/386315762.db2.gz LQVRZTQQODNCCV-UHFFFAOYSA-N 1 2 248.355 2.342 20 0 BEADLO Cc1c[nH]nc1C[NH2+]Cc1nc(C2CC2)cs1 ZINC000289498237 386315770 /nfs/dbraw/zinc/31/57/70/386315770.db2.gz LQVRZTQQODNCCV-UHFFFAOYSA-N 1 2 248.355 2.342 20 0 BEADLO C[C@H](C[NH2+][C@]1(C)CCOC1=O)c1ccccc1 ZINC000289502256 386316691 /nfs/dbraw/zinc/31/66/91/386316691.db2.gz JYKBRGXDLCEPKV-BXUZGUMPSA-N 1 2 233.311 2.085 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@H]1CCOC1(C)C ZINC000297636600 386268933 /nfs/dbraw/zinc/26/89/33/386268933.db2.gz CSVHEFMXNQXSIX-LLVKDONJSA-N 1 2 249.314 2.079 20 0 BEADLO CCN(CCC1CC1)C(=O)CCc1c[nH+]cn1C ZINC000339164403 386269002 /nfs/dbraw/zinc/26/90/02/386269002.db2.gz RMSPYPAWGQJGSF-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO COC(=O)C[N@H+](C)Cc1ccc2occc2c1 ZINC000289191861 386273291 /nfs/dbraw/zinc/27/32/91/386273291.db2.gz UMKQJCNJQHJCRR-UHFFFAOYSA-N 1 2 233.267 2.038 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1ccc2occc2c1 ZINC000289191861 386273294 /nfs/dbraw/zinc/27/32/94/386273294.db2.gz UMKQJCNJQHJCRR-UHFFFAOYSA-N 1 2 233.267 2.038 20 0 BEADLO CC[C@H]1CCCC[C@H]1NC(=O)c1c[nH+]c(C)[nH]1 ZINC000264855534 386276021 /nfs/dbraw/zinc/27/60/21/386276021.db2.gz NZPMJQOICSLNBE-WDEREUQCSA-N 1 2 235.331 2.417 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@@H]2CCCC[C@@H]2C)c[nH+]1 ZINC000264864161 386277993 /nfs/dbraw/zinc/27/79/93/386277993.db2.gz PYWSSWJRPBNLGS-ONGXEEELSA-N 1 2 235.331 2.274 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@@H]2CCCC[C@H]2C)c[nH+]1 ZINC000264864159 386279446 /nfs/dbraw/zinc/27/94/46/386279446.db2.gz PYWSSWJRPBNLGS-KOLCDFICSA-N 1 2 235.331 2.274 20 0 BEADLO CC(C)c1noc(NCCNc2cccc[nH+]2)n1 ZINC000265452433 386339602 /nfs/dbraw/zinc/33/96/02/386339602.db2.gz UODKGEAQLBBLIL-UHFFFAOYSA-N 1 2 247.302 2.112 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ncnn2C)o1 ZINC000276535122 386341572 /nfs/dbraw/zinc/34/15/72/386341572.db2.gz DABDLHLDDAXBGK-ZJUUUORDSA-N 1 2 234.303 2.128 20 0 BEADLO CC(C)C[C@H]1CCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000276538857 386341808 /nfs/dbraw/zinc/34/18/08/386341808.db2.gz FZSAMCMQTMQCBE-AAOUONPWSA-N 1 2 247.342 2.318 20 0 BEADLO CC(C)CC(=O)N[C@@H](c1[nH]cc[nH+]1)C(C)C ZINC000276549420 386344887 /nfs/dbraw/zinc/34/48/87/386344887.db2.gz GAAYFUPYISXHON-LLVKDONJSA-N 1 2 223.320 2.269 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)C=Cc2c[nH]c[nH+]2)[C@H]1C ZINC000276567264 386346811 /nfs/dbraw/zinc/34/68/11/386346811.db2.gz KUPIRCTWBQHRLC-DNAZMEGNSA-N 1 2 247.342 2.364 20 0 BEADLO Cc1[nH+]cccc1Cc1nc([C@@H]2C[C@H]2C)no1 ZINC000334491685 386347879 /nfs/dbraw/zinc/34/78/79/386347879.db2.gz JIYBESACRWDCRA-LDYMZIIASA-N 1 2 229.283 2.487 20 0 BEADLO CC(C)[C@@H](NC(=O)C1CCC1)c1[nH]cc[nH+]1 ZINC000276610941 386354390 /nfs/dbraw/zinc/35/43/90/386354390.db2.gz MSYKEHBAQBZBKV-SNVBAGLBSA-N 1 2 221.304 2.023 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1ccc2occc2c1 ZINC000289777455 386355502 /nfs/dbraw/zinc/35/55/02/386355502.db2.gz REEXJQDLBRGKCO-SNVBAGLBSA-N 1 2 247.294 2.426 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1ccc2occc2c1 ZINC000289777455 386355510 /nfs/dbraw/zinc/35/55/10/386355510.db2.gz REEXJQDLBRGKCO-SNVBAGLBSA-N 1 2 247.294 2.426 20 0 BEADLO Cc1nc(C[NH2+][C@@H](CCO)c2ccccc2)co1 ZINC000647970165 386355482 /nfs/dbraw/zinc/35/54/82/386355482.db2.gz FWKDBYIIYUGLRC-AWEZNQCLSA-N 1 2 246.310 2.196 20 0 BEADLO CC(C)[C@@H](NC(=O)C1CC=CC1)c1[nH]cc[nH+]1 ZINC000276666004 386362733 /nfs/dbraw/zinc/36/27/33/386362733.db2.gz UJCPUCJHAJWDDU-LLVKDONJSA-N 1 2 233.315 2.189 20 0 BEADLO CCC[C@H](C)C(=O)NC[C@@H](C)Cn1cc[nH+]c1 ZINC000265778300 386369869 /nfs/dbraw/zinc/36/98/69/386369869.db2.gz GJHHEENMRVXIDS-NEPJUHHUSA-N 1 2 237.347 2.072 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CCc3ccccc3C2)o1 ZINC000298687193 386370564 /nfs/dbraw/zinc/37/05/64/386370564.db2.gz MJJUTWKXQZAJGD-JTQLQIEISA-N 1 2 243.310 2.497 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CCc3ccccc3C2)o1 ZINC000298687193 386370569 /nfs/dbraw/zinc/37/05/69/386370569.db2.gz MJJUTWKXQZAJGD-JTQLQIEISA-N 1 2 243.310 2.497 20 0 BEADLO CCCc1nc(C[N@@H+]2C[C@H](C)C[C@@H]2C)no1 ZINC000336690365 386371655 /nfs/dbraw/zinc/37/16/55/386371655.db2.gz AUHQGUKYCWSVRN-ZJUUUORDSA-N 1 2 223.320 2.252 20 0 BEADLO CCCc1nc(C[N@H+]2C[C@H](C)C[C@@H]2C)no1 ZINC000336690365 386371659 /nfs/dbraw/zinc/37/16/59/386371659.db2.gz AUHQGUKYCWSVRN-ZJUUUORDSA-N 1 2 223.320 2.252 20 0 BEADLO CCCN(CCC)C(=O)C[N@@H+]1CC[C@@](C)(F)C1 ZINC000347380881 386374148 /nfs/dbraw/zinc/37/41/48/386374148.db2.gz NDSHKQGHSUPUOC-CYBMUJFWSA-N 1 2 244.354 2.069 20 0 BEADLO CCCN(CCC)C(=O)C[N@H+]1CC[C@@](C)(F)C1 ZINC000347380881 386374154 /nfs/dbraw/zinc/37/41/54/386374154.db2.gz NDSHKQGHSUPUOC-CYBMUJFWSA-N 1 2 244.354 2.069 20 0 BEADLO Cc1cc(C)c(C[NH2+][C@@]2(C)CCOC2=O)cc1C ZINC000289960463 386376959 /nfs/dbraw/zinc/37/69/59/386376959.db2.gz YEZUAUBFMPEPIZ-HNNXBMFYSA-N 1 2 247.338 2.407 20 0 BEADLO CCC1CC[NH+](Cc2nnc(C3CC3)[nH]2)CC1 ZINC000347391801 386378197 /nfs/dbraw/zinc/37/81/97/386378197.db2.gz KAYSYULHFVVSGL-UHFFFAOYSA-N 1 2 234.347 2.304 20 0 BEADLO COC(=O)c1occc1C[N@@H+]1CC[C@](C)(F)C1 ZINC000347392703 386380240 /nfs/dbraw/zinc/38/02/40/386380240.db2.gz UHJBQJJSYYYFPV-LBPRGKRZSA-N 1 2 241.262 2.000 20 0 BEADLO COC(=O)c1occc1C[N@H+]1CC[C@](C)(F)C1 ZINC000347392703 386380246 /nfs/dbraw/zinc/38/02/46/386380246.db2.gz UHJBQJJSYYYFPV-LBPRGKRZSA-N 1 2 241.262 2.000 20 0 BEADLO CN(CC(F)F)c1cc[nH+]c(C2CC2)n1 ZINC000112966362 386381045 /nfs/dbraw/zinc/38/10/45/386381045.db2.gz SUTWXLBVUWHTAH-UHFFFAOYSA-N 1 2 213.231 2.055 20 0 BEADLO FC(F)C[NH2+]Cc1ccc(N2CCCC2)nc1 ZINC000290008647 386382911 /nfs/dbraw/zinc/38/29/11/386382911.db2.gz GICBEPLADDCYCR-UHFFFAOYSA-N 1 2 241.285 2.037 20 0 BEADLO COC(=O)c1ccc(CNc2ccc(C)[nH+]c2)o1 ZINC000164839701 386331982 /nfs/dbraw/zinc/33/19/82/386331982.db2.gz OKMSBOHFVMDVCK-UHFFFAOYSA-N 1 2 246.266 2.382 20 0 BEADLO Cc1ccc(CCC[NH2+][C@@]2(C)CCOC2=O)cc1 ZINC000289588163 386332276 /nfs/dbraw/zinc/33/22/76/386332276.db2.gz PNWZTNOTPHJAKQ-HNNXBMFYSA-N 1 2 247.338 2.223 20 0 BEADLO CC[C@@H](C)C[NH2+][C@@H](Cc1ccccc1)C(=O)OC ZINC000276493661 386333161 /nfs/dbraw/zinc/33/31/61/386333161.db2.gz QMMOVPDDAZYCNY-OCCSQVGLSA-N 1 2 249.354 2.406 20 0 BEADLO CC[C@@H](C)[C@H](O)CNc1cc(C)[nH+]c(C2CC2)n1 ZINC000265389741 386333725 /nfs/dbraw/zinc/33/37/25/386333725.db2.gz UCLGFOPIBVQEJU-BXKDBHETSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1ccsc1C[N@@H+](C)Cc1ccn(C)n1 ZINC000336681567 386336038 /nfs/dbraw/zinc/33/60/38/386336038.db2.gz QUGOYLXDKVRENK-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1ccsc1C[N@H+](C)Cc1ccn(C)n1 ZINC000336681567 386336047 /nfs/dbraw/zinc/33/60/47/386336047.db2.gz QUGOYLXDKVRENK-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO CCC[C@H](C)C(=O)N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000339472424 386436970 /nfs/dbraw/zinc/43/69/70/386436970.db2.gz YMGDRPZMQPHWAM-RYUDHWBXSA-N 1 2 249.358 2.172 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CC=C(C(F)(F)F)CC1 ZINC000290460090 386439347 /nfs/dbraw/zinc/43/93/47/386439347.db2.gz PJFVFSLRMNVBBI-UHFFFAOYSA-N 1 2 245.248 2.413 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000290460090 386439353 /nfs/dbraw/zinc/43/93/53/386439353.db2.gz PJFVFSLRMNVBBI-UHFFFAOYSA-N 1 2 245.248 2.413 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+][C@H](C)c1cc[nH]c(=O)c1 ZINC000645485615 386439460 /nfs/dbraw/zinc/43/94/60/386439460.db2.gz JHPYSICEEGGEBC-RKDXNWHRSA-N 1 2 246.314 2.231 20 0 BEADLO CC[C@H](NCc1[nH+]cc(C)n1C)C(F)(F)F ZINC000336777797 386440384 /nfs/dbraw/zinc/44/03/84/386440384.db2.gz JOOODGMBQGJLHI-QMMMGPOBSA-N 1 2 235.253 2.159 20 0 BEADLO COc1cc([C@H](C)[NH2+]Cc2cscn2)ccn1 ZINC000347551041 386446596 /nfs/dbraw/zinc/44/65/96/386446596.db2.gz AUQYOCDDNDSZCM-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO COc1cc([C@@H](C)[NH2+]Cc2cscn2)ccn1 ZINC000347551040 386448321 /nfs/dbraw/zinc/44/83/21/386448321.db2.gz AUQYOCDDNDSZCM-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2n[nH]cc2C)o1 ZINC000290534420 386448528 /nfs/dbraw/zinc/44/85/28/386448528.db2.gz VMQHQMAFAYUQIR-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2n[nH]cc2C)o1 ZINC000290534420 386448533 /nfs/dbraw/zinc/44/85/33/386448533.db2.gz VMQHQMAFAYUQIR-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@H]2Cc2ccccc2)no1 ZINC000336703926 386392712 /nfs/dbraw/zinc/39/27/12/386392712.db2.gz ISVHNWNSWVDOAX-CYBMUJFWSA-N 1 2 243.310 2.195 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@H]2Cc2ccccc2)no1 ZINC000336703926 386392716 /nfs/dbraw/zinc/39/27/16/386392716.db2.gz ISVHNWNSWVDOAX-CYBMUJFWSA-N 1 2 243.310 2.195 20 0 BEADLO Cc1ccnc(C[N@H+]2CCOC[C@H]2CC(C)C)n1 ZINC000336704190 386393999 /nfs/dbraw/zinc/39/39/99/386393999.db2.gz IVNUKURRDRZASW-CYBMUJFWSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCOC[C@H]2CC(C)C)n1 ZINC000336704190 386394003 /nfs/dbraw/zinc/39/40/03/386394003.db2.gz IVNUKURRDRZASW-CYBMUJFWSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1cc(C)c(CNC(=O)N[C@H]2CC2(C)C)c[nH+]1 ZINC000334497735 386394177 /nfs/dbraw/zinc/39/41/77/386394177.db2.gz JHMJWEBIALBZMP-LBPRGKRZSA-N 1 2 247.342 2.296 20 0 BEADLO Cc1nc(C[NH2+][C@@H](C)c2cccnc2)co1 ZINC000647970543 386394674 /nfs/dbraw/zinc/39/46/74/386394674.db2.gz WMXWOOZXFOEVCQ-VIFPVBQESA-N 1 2 217.272 2.229 20 0 BEADLO Cc1ccc2[nH+]c(CNC(=O)CC3CC3)cn2c1 ZINC000298898482 386396840 /nfs/dbraw/zinc/39/68/40/386396840.db2.gz AVBNEGVVECESFY-UHFFFAOYSA-N 1 2 243.310 2.059 20 0 BEADLO CCSc1cc(C[NH2+]Cc2cocn2)ccn1 ZINC000277024597 386400072 /nfs/dbraw/zinc/40/00/72/386400072.db2.gz NEGLPJNAYSVHCH-UHFFFAOYSA-N 1 2 249.339 2.471 20 0 BEADLO CC[C@@H](C)C(=O)NCc1cn2cc(C)ccc2[nH+]1 ZINC000298990898 386402369 /nfs/dbraw/zinc/40/23/69/386402369.db2.gz PAAGBMHDNQWQDS-LLVKDONJSA-N 1 2 245.326 2.305 20 0 BEADLO C[C@@H]([NH2+]Cc1cncc(F)c1)c1ccon1 ZINC000336776930 386409167 /nfs/dbraw/zinc/40/91/67/386409167.db2.gz GYHDQZKURHEPMH-MRVPVSSYSA-N 1 2 221.235 2.060 20 0 BEADLO Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1Cc1cocn1 ZINC000290318793 386420109 /nfs/dbraw/zinc/42/01/09/386420109.db2.gz CTYPIWZOMUPFRI-LBPRGKRZSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1Cc1cocn1 ZINC000290318793 386420114 /nfs/dbraw/zinc/42/01/14/386420114.db2.gz CTYPIWZOMUPFRI-LBPRGKRZSA-N 1 2 246.314 2.352 20 0 BEADLO CC(C)C[C@H](C)CC(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000347493591 386422380 /nfs/dbraw/zinc/42/23/80/386422380.db2.gz HELFACOMVITLDK-NSHDSACASA-N 1 2 237.347 2.440 20 0 BEADLO CC[C@@H](C)C[C@H](C)NC(=O)CCn1cc[nH+]c1 ZINC000266339598 386428974 /nfs/dbraw/zinc/42/89/74/386428974.db2.gz LWJVYTRLYBHRTQ-NEPJUHHUSA-N 1 2 237.347 2.214 20 0 BEADLO CC[C@H](CSC)[N@H+](C)Cc1cn[nH]c1C ZINC000290450265 386435034 /nfs/dbraw/zinc/43/50/34/386435034.db2.gz MHYHFMPOVWEGSC-LLVKDONJSA-N 1 2 227.377 2.292 20 0 BEADLO CC[C@H](CSC)[N@@H+](C)Cc1cn[nH]c1C ZINC000290450265 386435039 /nfs/dbraw/zinc/43/50/39/386435039.db2.gz MHYHFMPOVWEGSC-LLVKDONJSA-N 1 2 227.377 2.292 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H]1CCC[C@H]1c1ccccc1 ZINC000277856331 386470740 /nfs/dbraw/zinc/47/07/40/386470740.db2.gz TXFCNABDHJUTLC-KWCYVHTRSA-N 1 2 247.338 2.474 20 0 BEADLO CS[C@H](C)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000299617220 386472205 /nfs/dbraw/zinc/47/22/05/386472205.db2.gz IFMGXAVFJWTUJI-SECBINFHSA-N 1 2 249.339 2.333 20 0 BEADLO Cc1nc(C[NH2+]C(C)(C)c2ccccc2)no1 ZINC000299609753 386472941 /nfs/dbraw/zinc/47/29/41/386472941.db2.gz MTOLPJKSNSCURO-UHFFFAOYSA-N 1 2 231.299 2.403 20 0 BEADLO CO[C@H](C)[C@@H](C)Nc1nc(C)[nH+]c2c1CCCC2 ZINC000290766527 386473137 /nfs/dbraw/zinc/47/31/37/386473137.db2.gz UXZUVVGRHKENKH-NXEZZACHSA-N 1 2 249.358 2.499 20 0 BEADLO C[C@H](CC[NH2+][C@]1(C)CCOC1=O)c1ccccc1 ZINC000290779292 386474862 /nfs/dbraw/zinc/47/48/62/386474862.db2.gz CTTMCVBGAQZEPM-IUODEOHRSA-N 1 2 247.338 2.475 20 0 BEADLO CO[C@@H](C)[C@@H](C)Nc1cc[nH+]c2ccncc12 ZINC000290807738 386478693 /nfs/dbraw/zinc/47/86/93/386478693.db2.gz ZIMPCGQLTXZSNW-ZJUUUORDSA-N 1 2 231.299 2.465 20 0 BEADLO CC(C)[C@@H](NCc1c[nH+]cn1C)C(F)(F)F ZINC000336742504 386480964 /nfs/dbraw/zinc/48/09/64/386480964.db2.gz OGICUFSAWMEBDG-SECBINFHSA-N 1 2 235.253 2.097 20 0 BEADLO CC[C@@H](C)[N@H+](CC(=O)OC)Cc1ccoc1C ZINC000414443083 386483755 /nfs/dbraw/zinc/48/37/55/386483755.db2.gz ICOZWWRDYFHBBH-SNVBAGLBSA-N 1 2 239.315 2.362 20 0 BEADLO CC[C@@H](C)[N@@H+](CC(=O)OC)Cc1ccoc1C ZINC000414443083 386483759 /nfs/dbraw/zinc/48/37/59/386483759.db2.gz ICOZWWRDYFHBBH-SNVBAGLBSA-N 1 2 239.315 2.362 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccc(O)cc2)nn1C ZINC000414444938 386491557 /nfs/dbraw/zinc/49/15/57/386491557.db2.gz QYDWPOMAJCOKCY-UHFFFAOYSA-N 1 2 245.326 2.066 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccc(O)cc2)nn1C ZINC000414444938 386491565 /nfs/dbraw/zinc/49/15/65/386491565.db2.gz QYDWPOMAJCOKCY-UHFFFAOYSA-N 1 2 245.326 2.066 20 0 BEADLO CN(Cc1c[nH+]cn1C)c1ccc(F)cc1 ZINC000267058772 386492404 /nfs/dbraw/zinc/49/24/04/386492404.db2.gz LTMKZDLEZFVHFH-UHFFFAOYSA-N 1 2 219.263 2.196 20 0 BEADLO CC(C)[C@@H]([NH2+]C1CCC(O)CC1)C(F)(F)F ZINC000336756910 386493338 /nfs/dbraw/zinc/49/33/38/386493338.db2.gz YSJKMHVKWQWERZ-UDNWOFFPSA-N 1 2 239.281 2.466 20 0 BEADLO CC[C@H](CC(=O)N1CCn2c[nH+]cc2C1)C(C)C ZINC000290978749 386494793 /nfs/dbraw/zinc/49/47/93/386494793.db2.gz VEFPIDMZZURZQV-GFCCVEGCSA-N 1 2 249.358 2.298 20 0 BEADLO C[C@H](CO)[N@H+](C)Cc1ccnc(Cl)c1Cl ZINC000290997359 386496675 /nfs/dbraw/zinc/49/66/75/386496675.db2.gz AOALGYKSIVSBJZ-SSDOTTSWSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@H](CO)[N@@H+](C)Cc1ccnc(Cl)c1Cl ZINC000290997359 386496678 /nfs/dbraw/zinc/49/66/78/386496678.db2.gz AOALGYKSIVSBJZ-SSDOTTSWSA-N 1 2 249.141 2.201 20 0 BEADLO CCOc1cccc(C[N@@H+]2CCC[C@H]2CF)n1 ZINC000339664595 386510649 /nfs/dbraw/zinc/51/06/49/386510649.db2.gz LQMMHVJELWEJDW-LBPRGKRZSA-N 1 2 238.306 2.414 20 0 BEADLO CCOc1cccc(C[N@H+]2CCC[C@H]2CF)n1 ZINC000339664595 386510653 /nfs/dbraw/zinc/51/06/53/386510653.db2.gz LQMMHVJELWEJDW-LBPRGKRZSA-N 1 2 238.306 2.414 20 0 BEADLO CCOc1cccc(C[N@@H+]2CCC[C@@H]2CF)n1 ZINC000339664594 386512790 /nfs/dbraw/zinc/51/27/90/386512790.db2.gz LQMMHVJELWEJDW-GFCCVEGCSA-N 1 2 238.306 2.414 20 0 BEADLO CCOc1cccc(C[N@H+]2CCC[C@@H]2CF)n1 ZINC000339664594 386512793 /nfs/dbraw/zinc/51/27/93/386512793.db2.gz LQMMHVJELWEJDW-GFCCVEGCSA-N 1 2 238.306 2.414 20 0 BEADLO CCc1ccccc1C[NH2+][C@@H](C(=O)OC)C1CC1 ZINC000227770474 386514622 /nfs/dbraw/zinc/51/46/22/386514622.db2.gz ZGDYNIUNYBGVKF-CQSZACIVSA-N 1 2 247.338 2.290 20 0 BEADLO C[C@H]([NH2+]Cc1cccc(O)c1)c1ccon1 ZINC000336779722 386514610 /nfs/dbraw/zinc/51/46/10/386514610.db2.gz PIIZHZFZPADURV-VIFPVBQESA-N 1 2 218.256 2.231 20 0 BEADLO C[C@H]1C[N@H+](Cc2cncs2)CC2(CCC2)O1 ZINC000335448891 386517584 /nfs/dbraw/zinc/51/75/84/386517584.db2.gz GYYUYNMVHVRHKN-JTQLQIEISA-N 1 2 238.356 2.287 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cncs2)CC2(CCC2)O1 ZINC000335448891 386517588 /nfs/dbraw/zinc/51/75/88/386517588.db2.gz GYYUYNMVHVRHKN-JTQLQIEISA-N 1 2 238.356 2.287 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccc(F)nc2C)CCO1 ZINC000278368846 386518061 /nfs/dbraw/zinc/51/80/61/386518061.db2.gz BPADCJJVQVYDAV-LBPRGKRZSA-N 1 2 238.306 2.140 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccc(F)nc2C)CCO1 ZINC000278368846 386518064 /nfs/dbraw/zinc/51/80/64/386518064.db2.gz BPADCJJVQVYDAV-LBPRGKRZSA-N 1 2 238.306 2.140 20 0 BEADLO OC[C@H]1CCN(c2[nH+]ccc3ccc(F)cc32)C1 ZINC000335452112 386523657 /nfs/dbraw/zinc/52/36/57/386523657.db2.gz VKBMHKLBTLEOJC-JTQLQIEISA-N 1 2 246.285 2.193 20 0 BEADLO CC1(C(=O)NCCCNc2cccc[nH+]2)CCC1 ZINC000267345477 386530482 /nfs/dbraw/zinc/53/04/82/386530482.db2.gz DKYSYRCNWYPBAH-UHFFFAOYSA-N 1 2 247.342 2.190 20 0 BEADLO CC(C)[N@H+](Cc1cscn1)[C@@H]1CCOC1 ZINC000291236770 386525508 /nfs/dbraw/zinc/52/55/08/386525508.db2.gz KVVWWXXVNKIODX-LLVKDONJSA-N 1 2 226.345 2.142 20 0 BEADLO CC(C)[N@@H+](Cc1cscn1)[C@@H]1CCOC1 ZINC000291236770 386525514 /nfs/dbraw/zinc/52/55/14/386525514.db2.gz KVVWWXXVNKIODX-LLVKDONJSA-N 1 2 226.345 2.142 20 0 BEADLO CCCCC[C@H](C)NC(=O)CCn1cc[nH+]c1 ZINC000072619754 386527185 /nfs/dbraw/zinc/52/71/85/386527185.db2.gz SCCHIZKXFHXTHM-LBPRGKRZSA-N 1 2 237.347 2.358 20 0 BEADLO CO[C@@H](C)C[N@H+](C)Cc1ncc(C(C)(C)C)o1 ZINC000336720373 386453967 /nfs/dbraw/zinc/45/39/67/386453967.db2.gz WNJNEEVLOOMYGI-JTQLQIEISA-N 1 2 240.347 2.439 20 0 BEADLO CO[C@@H](C)C[N@@H+](C)Cc1ncc(C(C)(C)C)o1 ZINC000336720373 386453970 /nfs/dbraw/zinc/45/39/70/386453970.db2.gz WNJNEEVLOOMYGI-JTQLQIEISA-N 1 2 240.347 2.439 20 0 BEADLO CO[C@H](C)C[N@H+](C)Cc1ncc(C(C)(C)C)o1 ZINC000336720374 386454455 /nfs/dbraw/zinc/45/44/55/386454455.db2.gz WNJNEEVLOOMYGI-SNVBAGLBSA-N 1 2 240.347 2.439 20 0 BEADLO CO[C@H](C)C[N@@H+](C)Cc1ncc(C(C)(C)C)o1 ZINC000336720374 386454459 /nfs/dbraw/zinc/45/44/59/386454459.db2.gz WNJNEEVLOOMYGI-SNVBAGLBSA-N 1 2 240.347 2.439 20 0 BEADLO C[C@@H]1C[C@H]1CNC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000290592755 386455666 /nfs/dbraw/zinc/45/56/66/386455666.db2.gz GQMUPRUGFHOFCV-ZJUUUORDSA-N 1 2 244.298 2.112 20 0 BEADLO CC(C)CCC(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000299476846 386456336 /nfs/dbraw/zinc/45/63/36/386456336.db2.gz BVFITQCDGVZQDT-UHFFFAOYSA-N 1 2 249.358 2.483 20 0 BEADLO CO[C@H](CNc1cc[nH+]c(C2CC2)n1)C(C)C ZINC000266725904 386464453 /nfs/dbraw/zinc/46/44/53/386464453.db2.gz MYKVNRNCGVKSRW-LLVKDONJSA-N 1 2 235.331 2.437 20 0 BEADLO C[C@@H](CNC(=O)C(C)(C)C1CC1)Cn1cc[nH+]c1 ZINC000291737558 386577196 /nfs/dbraw/zinc/57/71/96/386577196.db2.gz CQUXFIUDEKXCOS-NSHDSACASA-N 1 2 249.358 2.072 20 0 BEADLO Cl/C=C(\Cl)C[N@@H+]1CC[C@H](n2cccn2)C1 ZINC000291756936 386579250 /nfs/dbraw/zinc/57/92/50/386579250.db2.gz KYTRUWPHPLMTBU-MBACFSSFSA-N 1 2 246.141 2.449 20 0 BEADLO Cl/C=C(\Cl)C[N@H+]1CC[C@H](n2cccn2)C1 ZINC000291756936 386579254 /nfs/dbraw/zinc/57/92/54/386579254.db2.gz KYTRUWPHPLMTBU-MBACFSSFSA-N 1 2 246.141 2.449 20 0 BEADLO Cc1nc(C[N@@H+]2CCOC(C)(C)[C@@H]2C)cs1 ZINC000335418848 386586036 /nfs/dbraw/zinc/58/60/36/386586036.db2.gz DYZJPRDANKNEBR-VIFPVBQESA-N 1 2 240.372 2.451 20 0 BEADLO Cc1nc(C[N@H+]2CCOC(C)(C)[C@@H]2C)cs1 ZINC000335418848 386586041 /nfs/dbraw/zinc/58/60/41/386586041.db2.gz DYZJPRDANKNEBR-VIFPVBQESA-N 1 2 240.372 2.451 20 0 BEADLO Cn1c[nH+]cc1COc1ccc2c(c1)CCC2 ZINC000267803202 386587030 /nfs/dbraw/zinc/58/70/30/386587030.db2.gz QQXCALAQUJDELG-UHFFFAOYSA-N 1 2 228.295 2.488 20 0 BEADLO Cc1cnc(C[N@H+]2C[C@@H](C)OC3(CCC3)C2)o1 ZINC000335460651 386539711 /nfs/dbraw/zinc/53/97/11/386539711.db2.gz AQLCGEOWCRYRHW-LLVKDONJSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1cnc(C[N@@H+]2C[C@@H](C)OC3(CCC3)C2)o1 ZINC000335460651 386539718 /nfs/dbraw/zinc/53/97/18/386539718.db2.gz AQLCGEOWCRYRHW-LLVKDONJSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1cnc(C[N@H+]2C[C@H](C)OC3(CCC3)C2)o1 ZINC000335460652 386540970 /nfs/dbraw/zinc/54/09/70/386540970.db2.gz AQLCGEOWCRYRHW-NSHDSACASA-N 1 2 236.315 2.126 20 0 BEADLO Cc1cnc(C[N@@H+]2C[C@H](C)OC3(CCC3)C2)o1 ZINC000335460652 386540974 /nfs/dbraw/zinc/54/09/74/386540974.db2.gz AQLCGEOWCRYRHW-NSHDSACASA-N 1 2 236.315 2.126 20 0 BEADLO Clc1cccc(CC[NH+]2CCOCC2)c1 ZINC000291409825 386543940 /nfs/dbraw/zinc/54/39/40/386543940.db2.gz GEXFWALZUNUANV-UHFFFAOYSA-N 1 2 225.719 2.215 20 0 BEADLO CC1(C(=O)Nc2cccc3[nH+]ccn32)CCC1 ZINC000267552390 386554081 /nfs/dbraw/zinc/55/40/81/386554081.db2.gz YFOTWYVNBHZQNY-UHFFFAOYSA-N 1 2 229.283 2.463 20 0 BEADLO c1cc2[nH+]ccc(N[C@@H]3C[C@H]4C[C@H]4C3)c2cn1 ZINC000425311715 386554714 /nfs/dbraw/zinc/55/47/14/386554714.db2.gz YKSDZOKENRQXGX-JGPRNRPPSA-N 1 2 225.295 2.262 20 0 BEADLO Cc1cc(NC[C@@H]2CCCC(F)(F)C2)nc[nH+]1 ZINC000336915655 386556805 /nfs/dbraw/zinc/55/68/05/386556805.db2.gz BJTVFRBDHPNPHK-SNVBAGLBSA-N 1 2 241.285 2.444 20 0 BEADLO Fc1ccc(CN2CCn3c[nH+]cc3C2)cc1F ZINC000291631353 386560303 /nfs/dbraw/zinc/56/03/03/386560303.db2.gz SJVOEZYDGJJTAR-UHFFFAOYSA-N 1 2 249.264 2.177 20 0 BEADLO CCOC1(C)C[NH+](Cc2ccoc2C)C1 ZINC000414456104 386564845 /nfs/dbraw/zinc/56/48/45/386564845.db2.gz GWAIMDPKWRIIGR-UHFFFAOYSA-N 1 2 209.289 2.199 20 0 BEADLO COc1ccc(F)cc1C[N@@H+]1CC[C@@H](F)C1 ZINC000335406883 386566846 /nfs/dbraw/zinc/56/68/46/386566846.db2.gz QWLBYTGBGBYDSJ-LLVKDONJSA-N 1 2 227.254 2.378 20 0 BEADLO COc1ccc(F)cc1C[N@H+]1CC[C@@H](F)C1 ZINC000335406883 386566848 /nfs/dbraw/zinc/56/68/48/386566848.db2.gz QWLBYTGBGBYDSJ-LLVKDONJSA-N 1 2 227.254 2.378 20 0 BEADLO F[C@H]1CC[N@H+](Cc2ccn(-c3ccccc3)n2)C1 ZINC000335408168 386568800 /nfs/dbraw/zinc/56/88/00/386568800.db2.gz WLQQRQHVCABZSQ-LBPRGKRZSA-N 1 2 245.301 2.416 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2ccn(-c3ccccc3)n2)C1 ZINC000335408168 386568806 /nfs/dbraw/zinc/56/88/06/386568806.db2.gz WLQQRQHVCABZSQ-LBPRGKRZSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1cccc2ncc(C[N@@H+]3CC[C@H](F)C3)n21 ZINC000335409579 386570742 /nfs/dbraw/zinc/57/07/42/386570742.db2.gz MBVCKIHFLRIQPX-NSHDSACASA-N 1 2 233.290 2.187 20 0 BEADLO Cc1cccc2ncc(C[N@H+]3CC[C@H](F)C3)n21 ZINC000335409579 386570748 /nfs/dbraw/zinc/57/07/48/386570748.db2.gz MBVCKIHFLRIQPX-NSHDSACASA-N 1 2 233.290 2.187 20 0 BEADLO Cc1ccn2c(C[N@@H+]3CC[C@@H](F)C3)cnc2c1 ZINC000335410518 386573388 /nfs/dbraw/zinc/57/33/88/386573388.db2.gz UTIDKZGRJPUAGG-LLVKDONJSA-N 1 2 233.290 2.187 20 0 BEADLO Cc1ccn2c(C[N@H+]3CC[C@@H](F)C3)cnc2c1 ZINC000335410518 386573391 /nfs/dbraw/zinc/57/33/91/386573391.db2.gz UTIDKZGRJPUAGG-LLVKDONJSA-N 1 2 233.290 2.187 20 0 BEADLO CC(C)CC1(CNC(=O)CCc2[nH]cc[nH+]2)CC1 ZINC000279140884 386637025 /nfs/dbraw/zinc/63/70/25/386637025.db2.gz GGUQKSQZLBTYSO-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO CCC1(CNC(=O)CCc2[nH]cc[nH+]2)CCC1 ZINC000279123280 386637114 /nfs/dbraw/zinc/63/71/14/386637114.db2.gz DAHWXLWVEOMYSX-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO C[N@H+](CCF)Cc1cnn(Cc2ccccc2)c1 ZINC000268299255 386640568 /nfs/dbraw/zinc/64/05/68/386640568.db2.gz LXOZCXSWDVRHDT-UHFFFAOYSA-N 1 2 247.317 2.333 20 0 BEADLO C[N@@H+](CCF)Cc1cnn(Cc2ccccc2)c1 ZINC000268299255 386640574 /nfs/dbraw/zinc/64/05/74/386640574.db2.gz LXOZCXSWDVRHDT-UHFFFAOYSA-N 1 2 247.317 2.333 20 0 BEADLO CCc1cc(N[C@@H](CO)C[C@@H](C)CC)nc[nH+]1 ZINC000645355000 386642900 /nfs/dbraw/zinc/64/29/00/386642900.db2.gz FOOYZLPSTZDCHJ-CMPLNLGQSA-N 1 2 237.347 2.248 20 0 BEADLO Cc1nnc(C[N@@H+](C)[C@@H](C)c2cccs2)[nH]1 ZINC000292280925 386644745 /nfs/dbraw/zinc/64/47/45/386644745.db2.gz XVJRFOIZFNMOLR-QMMMGPOBSA-N 1 2 236.344 2.368 20 0 BEADLO Cc1nnc(C[N@H+](C)[C@@H](C)c2cccs2)[nH]1 ZINC000292280925 386644751 /nfs/dbraw/zinc/64/47/51/386644751.db2.gz XVJRFOIZFNMOLR-QMMMGPOBSA-N 1 2 236.344 2.368 20 0 BEADLO Cc1cc2[nH+]cn(C[C@H]3C[C@@H](O)C3)c2cc1C ZINC000335514056 386649804 /nfs/dbraw/zinc/64/98/04/386649804.db2.gz YXSRMGAVIZQHKB-TXEJJXNPSA-N 1 2 230.311 2.424 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)[C@@H]1CCCC[C@H]1C ZINC000279237068 386653910 /nfs/dbraw/zinc/65/39/10/386653910.db2.gz PTBNOEVVXHCEKB-ZWNOBZJWSA-N 1 2 249.358 2.298 20 0 BEADLO C[C@@H](Nc1cc[nH+]c2ccncc12)[C@@H]1CCOC1 ZINC000278874570 386600415 /nfs/dbraw/zinc/60/04/15/386600415.db2.gz ZRWROKHHAFBPDX-GHMZBOCLSA-N 1 2 243.310 2.467 20 0 BEADLO C[C@H](Nc1cc[nH+]c2ccncc12)[C@H]1CCOC1 ZINC000278874576 386600672 /nfs/dbraw/zinc/60/06/72/386600672.db2.gz ZRWROKHHAFBPDX-QWRGUYRKSA-N 1 2 243.310 2.467 20 0 BEADLO COC[C@H](C)CNc1cc[nH+]c2ccncc12 ZINC000267946356 386600943 /nfs/dbraw/zinc/60/09/43/386600943.db2.gz IMTPEOWAZFQPCK-SNVBAGLBSA-N 1 2 231.299 2.324 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccnn2C(C)C)CCO1 ZINC000337127741 386614340 /nfs/dbraw/zinc/61/43/40/386614340.db2.gz HNCNHIHDSZTOCY-ZDUSSCGKSA-N 1 2 237.347 2.075 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccnn2C(C)C)CCO1 ZINC000337127741 386614345 /nfs/dbraw/zinc/61/43/45/386614345.db2.gz HNCNHIHDSZTOCY-ZDUSSCGKSA-N 1 2 237.347 2.075 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1CO[C@@H](C)C1 ZINC000335527348 386672439 /nfs/dbraw/zinc/67/24/39/386672439.db2.gz IBTNEKXJPGWHIW-ONGXEEELSA-N 1 2 234.299 2.062 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H](C)n1cccn1 ZINC000335531565 386680882 /nfs/dbraw/zinc/68/08/82/386680882.db2.gz SPKVAWADEOVEFP-NSHDSACASA-N 1 2 244.298 2.095 20 0 BEADLO C[C@H]1[C@@H](O)CCC[N@@H+]1Cc1csc(Cl)n1 ZINC000296061718 386709819 /nfs/dbraw/zinc/70/98/19/386709819.db2.gz GEHPNYQHXNYFMI-CBAPKCEASA-N 1 2 246.763 2.142 20 0 BEADLO C[C@H]1[C@@H](O)CCC[N@H+]1Cc1csc(Cl)n1 ZINC000296061718 386709826 /nfs/dbraw/zinc/70/98/26/386709826.db2.gz GEHPNYQHXNYFMI-CBAPKCEASA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)[C@H]1CCC[C@@H](C)C1 ZINC000357018790 386688553 /nfs/dbraw/zinc/68/85/53/386688553.db2.gz MKVRYQLDGOODDY-AGIUHOORSA-N 1 2 249.358 2.214 20 0 BEADLO O=C(c1ccoc1)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000335474023 386695517 /nfs/dbraw/zinc/69/55/17/386695517.db2.gz BWGTXKBDGXPIJI-UHFFFAOYSA-N 1 2 245.282 2.023 20 0 BEADLO O=C(c1ccoc1)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000335474023 386695523 /nfs/dbraw/zinc/69/55/23/386695523.db2.gz BWGTXKBDGXPIJI-UHFFFAOYSA-N 1 2 245.282 2.023 20 0 BEADLO CCc1cc(CCCOCc2[nH]cc[nH+]2)on1 ZINC000645077171 386704146 /nfs/dbraw/zinc/70/41/46/386704146.db2.gz GQCIKARCZCFBEW-UHFFFAOYSA-N 1 2 235.287 2.110 20 0 BEADLO Cc1cc(C)n(CC[N@H+](CC(F)F)C(C)C)n1 ZINC000269017886 386738537 /nfs/dbraw/zinc/73/85/37/386738537.db2.gz XMORXCCDEDCEHH-UHFFFAOYSA-N 1 2 245.317 2.475 20 0 BEADLO Cc1cc(C)n(CC[N@@H+](CC(F)F)C(C)C)n1 ZINC000269017886 386738544 /nfs/dbraw/zinc/73/85/44/386738544.db2.gz XMORXCCDEDCEHH-UHFFFAOYSA-N 1 2 245.317 2.475 20 0 BEADLO COC(=O)[C@@H](CC1CC1)[NH2+]Cc1cccc(C)c1 ZINC000414490509 386716668 /nfs/dbraw/zinc/71/66/68/386716668.db2.gz OJCFGIZJTURFAH-CQSZACIVSA-N 1 2 247.338 2.426 20 0 BEADLO C[C@H]1SCC[N@H+](Cc2cocn2)[C@@H]1C ZINC000191944171 386719244 /nfs/dbraw/zinc/71/92/44/386719244.db2.gz UHOPXDJURMDRCM-RKDXNWHRSA-N 1 2 212.318 2.000 20 0 BEADLO C[C@H]1SCC[N@@H+](Cc2cocn2)[C@@H]1C ZINC000191944171 386719249 /nfs/dbraw/zinc/71/92/49/386719249.db2.gz UHOPXDJURMDRCM-RKDXNWHRSA-N 1 2 212.318 2.000 20 0 BEADLO CCn1c[nH+]cc1CN(CC(F)F)C(C)C ZINC000417790094 386724681 /nfs/dbraw/zinc/72/46/81/386724681.db2.gz HKWGORXSDLDZNB-UHFFFAOYSA-N 1 2 231.290 2.379 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@H](C(C)(C)C)C2)ncn1 ZINC000292788443 386727151 /nfs/dbraw/zinc/72/71/51/386727151.db2.gz JVVNJNAJYQGQNQ-ZDUSSCGKSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@H](C(C)(C)C)C2)ncn1 ZINC000292788443 386727155 /nfs/dbraw/zinc/72/71/55/386727155.db2.gz JVVNJNAJYQGQNQ-ZDUSSCGKSA-N 1 2 249.358 2.032 20 0 BEADLO C[C@@H]1CCC[N@H+](Cc2nn(C)cc2Cl)C1 ZINC000335545048 386729732 /nfs/dbraw/zinc/72/97/32/386729732.db2.gz RFSRCFQSZUVZGT-SECBINFHSA-N 1 2 227.739 2.305 20 0 BEADLO C[C@@H]1CCC[N@@H+](Cc2nn(C)cc2Cl)C1 ZINC000335545048 386729734 /nfs/dbraw/zinc/72/97/34/386729734.db2.gz RFSRCFQSZUVZGT-SECBINFHSA-N 1 2 227.739 2.305 20 0 BEADLO CN(Cc1ccc(Cl)o1)Cc1[nH+]ccn1C ZINC000357241545 386746126 /nfs/dbraw/zinc/74/61/26/386746126.db2.gz XTCOYJXUXPCTEG-UHFFFAOYSA-N 1 2 239.706 2.299 20 0 BEADLO CC[C@](C)([NH2+]CCc1ccc(C)cc1)C(=O)OC ZINC000293032795 386769508 /nfs/dbraw/zinc/76/95/08/386769508.db2.gz DIJWGRFLHDNZDB-HNNXBMFYSA-N 1 2 249.354 2.469 20 0 BEADLO CCC[C@H](CC)[S@@](=O)Cc1[nH+]ccn1C ZINC000279913516 386755223 /nfs/dbraw/zinc/75/52/23/386755223.db2.gz DOHVPSGTBAXRNY-BONVTDFDSA-N 1 2 228.361 2.248 20 0 BEADLO CCN(CC(C)(C)O)c1cc[nH+]c(C(C)C)n1 ZINC000114450471 386761640 /nfs/dbraw/zinc/76/16/40/386761640.db2.gz PBEFUESAZPPHTO-UHFFFAOYSA-N 1 2 237.347 2.197 20 0 BEADLO Cn1ccc(C[NH2+]Cc2ccsc2Cl)n1 ZINC000336664427 386765869 /nfs/dbraw/zinc/76/58/69/386765869.db2.gz CREIJZSUYMITPI-UHFFFAOYSA-N 1 2 241.747 2.425 20 0 BEADLO CC[C@@H](NC(=O)CC(C)(C)C)c1[nH]cc[nH+]1 ZINC000125324578 386793286 /nfs/dbraw/zinc/79/32/86/386793286.db2.gz IBZVDMCJQASUMJ-SECBINFHSA-N 1 2 223.320 2.413 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2cc[nH]n2)cc1F ZINC000114461019 386773016 /nfs/dbraw/zinc/77/30/16/386773016.db2.gz XLYRHBNLAJIKSD-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2cc[nH]n2)cc1F ZINC000114461019 386773018 /nfs/dbraw/zinc/77/30/18/386773018.db2.gz XLYRHBNLAJIKSD-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO CC(C)[N@@H+](Cc1n[nH]c(=O)[nH]1)C1CCCCC1 ZINC000340842132 386774815 /nfs/dbraw/zinc/77/48/15/386774815.db2.gz UZDSOWCNXSZMRO-UHFFFAOYSA-N 1 2 238.335 2.053 20 0 BEADLO CCCCc1noc(C[NH+]2CCCCC2)n1 ZINC000192497331 386777939 /nfs/dbraw/zinc/77/79/39/386777939.db2.gz MNYYHRKOSMWKSW-UHFFFAOYSA-N 1 2 223.320 2.398 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C[C@H]1CCC(=O)[C@H]1C ZINC000280104815 386778545 /nfs/dbraw/zinc/77/85/45/386778545.db2.gz CGUBLMPTIJBZDF-WDEREUQCSA-N 1 2 246.310 2.334 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@@H]2CCC(C)(C)C2)no1 ZINC000334639634 386781735 /nfs/dbraw/zinc/78/17/35/386781735.db2.gz ZHJSUVXDTMALAI-SNVBAGLBSA-N 1 2 223.320 2.389 20 0 BEADLO Cc1nc(C[N@H+](C)[C@@H]2CCC(C)(C)C2)no1 ZINC000334639634 386781743 /nfs/dbraw/zinc/78/17/43/386781743.db2.gz ZHJSUVXDTMALAI-SNVBAGLBSA-N 1 2 223.320 2.389 20 0 BEADLO C[C@@H]([NH2+]CC(F)(F)CN)[C@@H](C)c1ccccc1 ZINC000414933419 386783342 /nfs/dbraw/zinc/78/33/42/386783342.db2.gz UDSUBCUZMOAQTQ-GHMZBOCLSA-N 1 2 242.313 2.362 20 0 BEADLO C[C@]1(O)CCCN(c2cc[nH+]c(C3CC3)n2)CC1 ZINC000280160265 386784530 /nfs/dbraw/zinc/78/45/30/386784530.db2.gz CVJGWUKZYSPBPJ-AWEZNQCLSA-N 1 2 247.342 2.095 20 0 BEADLO CC[C@@H](OC1CCCC1)c1nc(C[NH2+]C)no1 ZINC000414506467 386785348 /nfs/dbraw/zinc/78/53/48/386785348.db2.gz WNZAUPZMQCZTLO-SNVBAGLBSA-N 1 2 239.319 2.199 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@@H](C)c2cccnc2)n(C)n1 ZINC000418001324 386817930 /nfs/dbraw/zinc/81/79/30/386817930.db2.gz KRRIABFTFSSCCW-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cc(C[N@H+](C)[C@@H](C)c2cccnc2)n(C)n1 ZINC000418001324 386817932 /nfs/dbraw/zinc/81/79/32/386817932.db2.gz KRRIABFTFSSCCW-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@H](C)c2cccnc2)n(C)n1 ZINC000418001323 386818509 /nfs/dbraw/zinc/81/85/09/386818509.db2.gz KRRIABFTFSSCCW-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cc(C[N@H+](C)[C@H](C)c2cccnc2)n(C)n1 ZINC000418001323 386818511 /nfs/dbraw/zinc/81/85/11/386818511.db2.gz KRRIABFTFSSCCW-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2ccccn2)[nH]1 ZINC000293283565 386797150 /nfs/dbraw/zinc/79/71/50/386797150.db2.gz UACJQWBVAAYPJR-JTQLQIEISA-N 1 2 245.330 2.174 20 0 BEADLO CC[C@H](NC(=O)[C@@H](C)C1CC1)c1[nH]cc[nH+]1 ZINC000125329489 386797687 /nfs/dbraw/zinc/79/76/87/386797687.db2.gz UJJVGHUCUCBPNO-WPRPVWTQSA-N 1 2 221.304 2.023 20 0 BEADLO CC(C)(C)c1noc([C@@H]([NH3+])c2ccccc2)n1 ZINC000020556901 386797988 /nfs/dbraw/zinc/79/79/88/386797988.db2.gz BGLIERZEGBHYCC-JTQLQIEISA-N 1 2 231.299 2.415 20 0 BEADLO C[C@@H](c1ccccc1)[N@@H+]1CCn2cncc2C1 ZINC000647939105 386804235 /nfs/dbraw/zinc/80/42/35/386804235.db2.gz AZZWOEGGMFOYRA-LBPRGKRZSA-N 1 2 227.311 2.460 20 0 BEADLO C[C@@H](c1ccccc1)[N@H+]1CCn2cncc2C1 ZINC000647939105 386804238 /nfs/dbraw/zinc/80/42/38/386804238.db2.gz AZZWOEGGMFOYRA-LBPRGKRZSA-N 1 2 227.311 2.460 20 0 BEADLO C[C@@H](c1ccccc1)N1CCn2c[nH+]cc2C1 ZINC000647939105 386804241 /nfs/dbraw/zinc/80/42/41/386804241.db2.gz AZZWOEGGMFOYRA-LBPRGKRZSA-N 1 2 227.311 2.460 20 0 BEADLO COc1ccc(F)c(C[NH2+]Cc2ccon2)c1 ZINC000645160881 386806937 /nfs/dbraw/zinc/80/69/37/386806937.db2.gz IKZUFYYHDXZMKR-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO C[C@@H]1C[N@H+](CCOCC2CCCC2)CCC1=O ZINC000314622409 386811314 /nfs/dbraw/zinc/81/13/14/386811314.db2.gz ZSRKPKNCYJNCIY-GFCCVEGCSA-N 1 2 239.359 2.104 20 0 BEADLO C[C@@H]1C[N@@H+](CCOCC2CCCC2)CCC1=O ZINC000314622409 386811317 /nfs/dbraw/zinc/81/13/17/386811317.db2.gz ZSRKPKNCYJNCIY-GFCCVEGCSA-N 1 2 239.359 2.104 20 0 BEADLO CO[C@H]1CCC[N@H+](Cc2ncc(C3CC3)o2)C1 ZINC000340915151 386811564 /nfs/dbraw/zinc/81/15/64/386811564.db2.gz XPZUTXAOOLGMRT-NSHDSACASA-N 1 2 236.315 2.163 20 0 BEADLO CO[C@H]1CCC[N@@H+](Cc2ncc(C3CC3)o2)C1 ZINC000340915151 386811571 /nfs/dbraw/zinc/81/15/71/386811571.db2.gz XPZUTXAOOLGMRT-NSHDSACASA-N 1 2 236.315 2.163 20 0 BEADLO CCC[C@](C)(CC)C(=O)NCc1[nH+]ccn1C ZINC000280590968 386824724 /nfs/dbraw/zinc/82/47/24/386824724.db2.gz SXUIGIYEUXBZKQ-ZDUSSCGKSA-N 1 2 237.347 2.253 20 0 BEADLO CC(C)[C@@H]1CCCC[C@H]1[NH2+]Cc1c[nH]nn1 ZINC000398367672 386815478 /nfs/dbraw/zinc/81/54/78/386815478.db2.gz BVBKXFBKLQYUPJ-NWDGAFQWSA-N 1 2 222.336 2.109 20 0 BEADLO CC(C)[C@@H]1CCCC[C@H]1[NH2+]Cc1cn[nH]n1 ZINC000398367672 386815482 /nfs/dbraw/zinc/81/54/82/386815482.db2.gz BVBKXFBKLQYUPJ-NWDGAFQWSA-N 1 2 222.336 2.109 20 0 BEADLO Cc1cc(N(C)Cc2ccc(Cl)nc2)nc[nH+]1 ZINC000301244046 386829305 /nfs/dbraw/zinc/82/93/05/386829305.db2.gz NJLGFMSBKULTNQ-UHFFFAOYSA-N 1 2 248.717 2.470 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1cc(F)c(F)cc1F ZINC000293555175 386835761 /nfs/dbraw/zinc/83/57/61/386835761.db2.gz FJTNILPVMONNPL-SECBINFHSA-N 1 2 245.244 2.325 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1cc(F)c(F)cc1F ZINC000293555175 386835766 /nfs/dbraw/zinc/83/57/66/386835766.db2.gz FJTNILPVMONNPL-SECBINFHSA-N 1 2 245.244 2.325 20 0 BEADLO COc1ccc(CNc2cc[nH+]c(C)n2)cc1O ZINC000301351881 386836363 /nfs/dbraw/zinc/83/63/63/386836363.db2.gz KLYRZZCEPQEXEK-UHFFFAOYSA-N 1 2 245.282 2.111 20 0 BEADLO CC(C)c1occc1C(=O)NCc1[nH]cc[nH+]1 ZINC000280731254 386839601 /nfs/dbraw/zinc/83/96/01/386839601.db2.gz NIUCOHQPIYNXCM-UHFFFAOYSA-N 1 2 233.271 2.056 20 0 BEADLO Cc1ccc([C@H](C)NCc2[nH+]cc(C)n2C)o1 ZINC000341110799 386839915 /nfs/dbraw/zinc/83/99/15/386839915.db2.gz OSKPGGYQGZDRTO-NSHDSACASA-N 1 2 233.315 2.481 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2ncc(C)n2C)o1 ZINC000341110799 386839922 /nfs/dbraw/zinc/83/99/22/386839922.db2.gz OSKPGGYQGZDRTO-NSHDSACASA-N 1 2 233.315 2.481 20 0 BEADLO Cc1nc(N(C)C[C@@H]2CCCCO2)c(C)c(C)[nH+]1 ZINC000301423691 386842751 /nfs/dbraw/zinc/84/27/51/386842751.db2.gz AUBQNWMXUHHNOU-ZDUSSCGKSA-N 1 2 249.358 2.407 20 0 BEADLO CO[C@@]1(C)C[C@H](N(C)c2cc(C)[nH+]cn2)C1(C)C ZINC000301550164 386854060 /nfs/dbraw/zinc/85/40/60/386854060.db2.gz GMGKETULRRRCEF-FZMZJTMJSA-N 1 2 249.358 2.425 20 0 BEADLO Cn1nccc1CNc1cc[nH+]c(C(C)(C)C)n1 ZINC000301532528 386854286 /nfs/dbraw/zinc/85/42/86/386854286.db2.gz PYGDBJUHEYKNJM-UHFFFAOYSA-N 1 2 245.330 2.120 20 0 BEADLO c1ccn(CCNc2cc[nH+]c(C3CC3)n2)c1 ZINC000301600724 386857711 /nfs/dbraw/zinc/85/77/11/386857711.db2.gz VBRVJPVAGWQCKX-UHFFFAOYSA-N 1 2 228.299 2.268 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc3c(n2)CCC3)[C@@H](C)CO1 ZINC000334791906 386857774 /nfs/dbraw/zinc/85/77/74/386857774.db2.gz DXOPUUQDRXPNIQ-NWDGAFQWSA-N 1 2 246.354 2.180 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc3c(n2)CCC3)[C@@H](C)CO1 ZINC000334791906 386857776 /nfs/dbraw/zinc/85/77/76/386857776.db2.gz DXOPUUQDRXPNIQ-NWDGAFQWSA-N 1 2 246.354 2.180 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+]2CCOC(C)(C)C2)o1 ZINC000335742367 386859094 /nfs/dbraw/zinc/85/90/94/386859094.db2.gz ANQZVSCXDLSGHT-SNVBAGLBSA-N 1 2 224.304 2.155 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+]2CCOC(C)(C)C2)o1 ZINC000335742367 386859098 /nfs/dbraw/zinc/85/90/98/386859098.db2.gz ANQZVSCXDLSGHT-SNVBAGLBSA-N 1 2 224.304 2.155 20 0 BEADLO Cn1c[nH+]cc1CN(C#N)c1cccc(F)c1 ZINC000335742353 386859522 /nfs/dbraw/zinc/85/95/22/386859522.db2.gz YZTURMZLJLFQOR-UHFFFAOYSA-N 1 2 230.246 2.047 20 0 BEADLO Cc1nsc(NCc2ccn3cc[nH+]c3c2)n1 ZINC000301950438 386894140 /nfs/dbraw/zinc/89/41/40/386894140.db2.gz GPIQUJLMZUFQLW-UHFFFAOYSA-N 1 2 245.311 2.106 20 0 BEADLO O[C@@H]1CCN(c2cccc[nH+]2)C[C@H]1C1CCCC1 ZINC000334827563 386862493 /nfs/dbraw/zinc/86/24/93/386862493.db2.gz LGYHIACBMUPWIR-UONOGXRCSA-N 1 2 246.354 2.459 20 0 BEADLO Cc1c(NCc2c[nH+]cn2C)cnn1CC(C)C ZINC000341253959 386867673 /nfs/dbraw/zinc/86/76/73/386867673.db2.gz DIGNGEWJEZGQGR-UHFFFAOYSA-N 1 2 247.346 2.193 20 0 BEADLO Cc1noc(C(C)(C)[NH2+]Cc2cccnc2C)n1 ZINC000341253149 386867952 /nfs/dbraw/zinc/86/79/52/386867952.db2.gz KIJBLSMZZAPNBU-UHFFFAOYSA-N 1 2 246.314 2.106 20 0 BEADLO Cc1c[nH+]c(CNc2ccccc2N(C)C)n1C ZINC000341256240 386868492 /nfs/dbraw/zinc/86/84/92/386868492.db2.gz GSWQIILDGMWYQS-UHFFFAOYSA-N 1 2 244.342 2.407 20 0 BEADLO CC[C@@H](c1nc(C[NH2+]C)no1)c1ccccc1 ZINC000051848694 386873015 /nfs/dbraw/zinc/87/30/15/386873015.db2.gz VYVQDRGVWTYLOH-LLVKDONJSA-N 1 2 231.299 2.331 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CC[C@@H](C(F)(F)F)[C@@H]1C ZINC000334845821 386894625 /nfs/dbraw/zinc/89/46/25/386894625.db2.gz UELOLKWQBFXFLH-DTWKUNHWSA-N 1 2 247.264 2.491 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CC[C@@H](C(F)(F)F)[C@@H]1C ZINC000334845821 386894629 /nfs/dbraw/zinc/89/46/29/386894629.db2.gz UELOLKWQBFXFLH-DTWKUNHWSA-N 1 2 247.264 2.491 20 0 BEADLO CO[C@@H](C)C[N@H+](C)Cc1c(F)ccc(O)c1F ZINC000293793381 386880140 /nfs/dbraw/zinc/88/01/40/386880140.db2.gz CRNGGGYUWBFGAF-QMMMGPOBSA-N 1 2 245.269 2.137 20 0 BEADLO CO[C@@H](C)C[N@@H+](C)Cc1c(F)ccc(O)c1F ZINC000293793381 386880143 /nfs/dbraw/zinc/88/01/43/386880143.db2.gz CRNGGGYUWBFGAF-QMMMGPOBSA-N 1 2 245.269 2.137 20 0 BEADLO CSCCCNc1nc(N)c2ccccc2[nH+]1 ZINC000301855427 386885420 /nfs/dbraw/zinc/88/54/20/386885420.db2.gz ATBWCASSBLQEAK-UHFFFAOYSA-N 1 2 248.355 2.377 20 0 BEADLO Cc1cccc2[nH+]c(C[S@](=O)C3CCC3)cn21 ZINC000334855566 386906124 /nfs/dbraw/zinc/90/61/24/386906124.db2.gz IOBPUOSVSDFNTN-KRWDZBQOSA-N 1 2 248.351 2.444 20 0 BEADLO C[C@@H]1CC[C@@H]([N@H+](C)Cc2csnn2)C1 ZINC000334863661 386919796 /nfs/dbraw/zinc/91/97/96/386919796.db2.gz JNQFGQRKHACMFH-PSASIEDQSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]1CC[C@@H]([N@@H+](C)Cc2csnn2)C1 ZINC000334863661 386919800 /nfs/dbraw/zinc/91/98/00/386919800.db2.gz JNQFGQRKHACMFH-PSASIEDQSA-N 1 2 211.334 2.159 20 0 BEADLO Cc1cncc(NCCc2cc[nH+]cc2C)n1 ZINC000302148745 386907229 /nfs/dbraw/zinc/90/72/29/386907229.db2.gz KOWSYLGXGYVSTC-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@H](CF)C2)cs1 ZINC000334858531 386910326 /nfs/dbraw/zinc/91/03/26/386910326.db2.gz DIXMKUWGXDOGTQ-LLVKDONJSA-N 1 2 229.320 2.227 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@H](CF)C2)cs1 ZINC000334858531 386910330 /nfs/dbraw/zinc/91/03/30/386910330.db2.gz DIXMKUWGXDOGTQ-LLVKDONJSA-N 1 2 229.320 2.227 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)c1occc1C ZINC000456399919 386911015 /nfs/dbraw/zinc/91/10/15/386911015.db2.gz USXSQGMMITWREP-SNVBAGLBSA-N 1 2 247.298 2.295 20 0 BEADLO c1ccc(N2CCOCC3(CCCC3)C2)[nH+]c1 ZINC000302421812 386922430 /nfs/dbraw/zinc/92/24/30/386922430.db2.gz OIDKQVCGTHBMMB-UHFFFAOYSA-N 1 2 232.327 2.479 20 0 BEADLO CC[C@@H](C)[C@H](C)NC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000330940863 386926104 /nfs/dbraw/zinc/92/61/04/386926104.db2.gz CQEORQFWNAJBSE-ZJUUUORDSA-N 1 2 237.347 2.238 20 0 BEADLO CCCCC[N@@H+]1CCOCC(F)(F)C1 ZINC000367986967 386926769 /nfs/dbraw/zinc/92/67/69/386926769.db2.gz CUGHAWMMKFKESH-UHFFFAOYSA-N 1 2 207.264 2.144 20 0 BEADLO CCCCC[N@H+]1CCOCC(F)(F)C1 ZINC000367986967 386926773 /nfs/dbraw/zinc/92/67/73/386926773.db2.gz CUGHAWMMKFKESH-UHFFFAOYSA-N 1 2 207.264 2.144 20 0 BEADLO CC(C)c1nc(NC[C@@H]2CC[C@H](O)C2)cc[nH+]1 ZINC000302673477 386929641 /nfs/dbraw/zinc/92/96/41/386929641.db2.gz LORWPWPXMPEHGY-MNOVXSKESA-N 1 2 235.331 2.173 20 0 BEADLO CCn1cc(C[N@H+](C)C/C=C(/C)Cl)cn1 ZINC000528384857 386953867 /nfs/dbraw/zinc/95/38/67/386953867.db2.gz XWGXBAGGKFPNTM-YHYXMXQVSA-N 1 2 227.739 2.477 20 0 BEADLO CCn1cc(C[N@@H+](C)C/C=C(/C)Cl)cn1 ZINC000528384857 386953871 /nfs/dbraw/zinc/95/38/71/386953871.db2.gz XWGXBAGGKFPNTM-YHYXMXQVSA-N 1 2 227.739 2.477 20 0 BEADLO Cn1c(Cl)cnc1C[N@@H+]1C[C@H]2CCCC[C@H]21 ZINC000368259058 386954600 /nfs/dbraw/zinc/95/46/00/386954600.db2.gz NZGRELWALVUTJR-NXEZZACHSA-N 1 2 239.750 2.448 20 0 BEADLO Cn1c(Cl)cnc1C[N@H+]1C[C@H]2CCCC[C@H]21 ZINC000368259058 386954604 /nfs/dbraw/zinc/95/46/04/386954604.db2.gz NZGRELWALVUTJR-NXEZZACHSA-N 1 2 239.750 2.448 20 0 BEADLO CCC(CC)[C@H](C)C(=O)NCCn1cc[nH+]c1 ZINC000341718261 386955315 /nfs/dbraw/zinc/95/53/15/386955315.db2.gz XSMZZTHMRQYRQW-NSHDSACASA-N 1 2 237.347 2.072 20 0 BEADLO CS[C@H](C)CCC(=O)Nc1cc[nH+]c(C)c1 ZINC000358419544 386955365 /nfs/dbraw/zinc/95/53/65/386955365.db2.gz WPIPLNJXYBYWSL-SNVBAGLBSA-N 1 2 238.356 2.282 20 0 BEADLO c1ccc(CSCC[N@@H+]2CCO[C@@H]3C[C@@H]32)cc1 ZINC000368326497 386959894 /nfs/dbraw/zinc/95/98/94/386959894.db2.gz ADGIRTYCXBWVCC-UONOGXRCSA-N 1 2 249.379 2.393 20 0 BEADLO c1ccc(CSCC[N@H+]2CCO[C@@H]3C[C@@H]32)cc1 ZINC000368326497 386959898 /nfs/dbraw/zinc/95/98/98/386959898.db2.gz ADGIRTYCXBWVCC-UONOGXRCSA-N 1 2 249.379 2.393 20 0 BEADLO CCC(=O)N1CC[N@H+](Cc2cc(C)cc(C)c2)C1 ZINC000425351769 386961054 /nfs/dbraw/zinc/96/10/54/386961054.db2.gz VTWPJANRAWUXRW-UHFFFAOYSA-N 1 2 246.354 2.315 20 0 BEADLO CCC(=O)N1CC[N@@H+](Cc2cc(C)cc(C)c2)C1 ZINC000425351769 386961059 /nfs/dbraw/zinc/96/10/59/386961059.db2.gz VTWPJANRAWUXRW-UHFFFAOYSA-N 1 2 246.354 2.315 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@H]3C[C@H]32)c(C)s1 ZINC000368331192 386961874 /nfs/dbraw/zinc/96/18/74/386961874.db2.gz NDKVJSDFSXYKCW-NEPJUHHUSA-N 1 2 223.341 2.338 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@H]3C[C@H]32)c(C)s1 ZINC000368331192 386961879 /nfs/dbraw/zinc/96/18/79/386961879.db2.gz NDKVJSDFSXYKCW-NEPJUHHUSA-N 1 2 223.341 2.338 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)c(C)s1 ZINC000368331193 386962327 /nfs/dbraw/zinc/96/23/27/386962327.db2.gz NDKVJSDFSXYKCW-NWDGAFQWSA-N 1 2 223.341 2.338 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@@H]3C[C@@H]32)c(C)s1 ZINC000368331193 386962331 /nfs/dbraw/zinc/96/23/31/386962331.db2.gz NDKVJSDFSXYKCW-NWDGAFQWSA-N 1 2 223.341 2.338 20 0 BEADLO Cc1cccc(C[NH+]2CC(O)(C(F)F)C2)c1C ZINC000425353004 386962775 /nfs/dbraw/zinc/96/27/75/386962775.db2.gz YNGNMJTYFOPJTK-UHFFFAOYSA-N 1 2 241.281 2.115 20 0 BEADLO CO[C@@H](C(=O)Nc1c(C)cc(C)[nH+]c1C)C1CC1 ZINC000332210766 386966167 /nfs/dbraw/zinc/96/61/67/386966167.db2.gz VPRQYHMNOTWKIY-CYBMUJFWSA-N 1 2 248.326 2.370 20 0 BEADLO CC1CC[NH+](Cc2nc(C3(C)CC3)no2)CC1 ZINC000334894420 386966766 /nfs/dbraw/zinc/96/67/66/386966766.db2.gz BQDVYKTVMXXDAL-UHFFFAOYSA-N 1 2 235.331 2.353 20 0 BEADLO CC[C@H]([NH2+]Cc1ccc(F)cn1)c1nccn1C ZINC000341833235 386972059 /nfs/dbraw/zinc/97/20/59/386972059.db2.gz LEASDBWVOTYDNO-LBPRGKRZSA-N 1 2 248.305 2.195 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nc(-c3ccoc3)no2)[C@H]1C ZINC000334919065 386995706 /nfs/dbraw/zinc/99/57/06/386995706.db2.gz BFRXJNRCQOUPOQ-BDAKNGLRSA-N 1 2 233.271 2.170 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nc(-c3ccoc3)no2)[C@H]1C ZINC000334919065 386995710 /nfs/dbraw/zinc/99/57/10/386995710.db2.gz BFRXJNRCQOUPOQ-BDAKNGLRSA-N 1 2 233.271 2.170 20 0 BEADLO CO[C@H](C)CCC(=O)Nc1c(C)cc[nH+]c1C ZINC000331234012 386995946 /nfs/dbraw/zinc/99/59/46/386995946.db2.gz CIYFGSLBDFIZRF-SNVBAGLBSA-N 1 2 236.315 2.452 20 0 BEADLO Cc1ccccc1/C=C/C(=O)NC1=[NH+]CCS1 ZINC000095771510 387001341 /nfs/dbraw/zinc/00/13/41/387001341.db2.gz KGYFISFZRIISIM-VOTSOKGWSA-N 1 2 246.335 2.227 20 0 BEADLO C[C@H]1CN(C(=O)CCn2cc[nH+]c2)CC(C)(C)C1 ZINC000334929037 387005139 /nfs/dbraw/zinc/00/51/39/387005139.db2.gz FHWKXQXFELMGLO-GFCCVEGCSA-N 1 2 249.358 2.168 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1C[C@@]12CCOC2 ZINC000333361279 387030419 /nfs/dbraw/zinc/03/04/19/387030419.db2.gz HHPZSGGRYGWVSY-BXUZGUMPSA-N 1 2 246.310 2.064 20 0 BEADLO CN(C(=O)Nc1ccn2cc[nH+]c2c1)C1CCC1 ZINC000334956787 387035950 /nfs/dbraw/zinc/03/59/50/387035950.db2.gz GECMRAFXMAPRSV-UHFFFAOYSA-N 1 2 244.298 2.351 20 0 BEADLO CC[C@@H](C)CC(=O)N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000358940728 387035914 /nfs/dbraw/zinc/03/59/14/387035914.db2.gz WXCZDIOEIYXFSW-NEPJUHHUSA-N 1 2 249.358 2.172 20 0 BEADLO CCn1c[nH+]cc1CN1CCOCC12CCCC2 ZINC000334960203 387039061 /nfs/dbraw/zinc/03/90/61/387039061.db2.gz GXIRHZSXIXFTJF-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CC[C@H](NC(=O)C1=C(C)CCC1)c1[nH]cc[nH+]1 ZINC000333574477 387043994 /nfs/dbraw/zinc/04/39/94/387043994.db2.gz URYXUUUJCOMBEN-NSHDSACASA-N 1 2 233.315 2.477 20 0 BEADLO Cc1nc(NC[C@@H]2CC23CCSCC3)cc[nH+]1 ZINC000334971805 387056101 /nfs/dbraw/zinc/05/61/01/387056101.db2.gz BTYBJFNRECPKBX-NSHDSACASA-N 1 2 249.383 2.152 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1ncnn1-c1ccccc1 ZINC000334975420 387061076 /nfs/dbraw/zinc/06/10/76/387061076.db2.gz JRXBCISOYLDCCU-TXEJJXNPSA-N 1 2 242.326 2.250 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1ncnn1-c1ccccc1 ZINC000334975420 387061079 /nfs/dbraw/zinc/06/10/79/387061079.db2.gz JRXBCISOYLDCCU-TXEJJXNPSA-N 1 2 242.326 2.250 20 0 BEADLO CC[C@H](NC(=O)C[C@@H](C)SC)c1[nH]cc[nH+]1 ZINC000331291781 387010091 /nfs/dbraw/zinc/01/00/91/387010091.db2.gz WTYFZJRAKQPPHW-BDAKNGLRSA-N 1 2 241.360 2.119 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)CC1CCOCC1 ZINC000117255442 387013927 /nfs/dbraw/zinc/01/39/27/387013927.db2.gz CYACTUWMNKRLGZ-UHFFFAOYSA-N 1 2 234.299 2.145 20 0 BEADLO COC(=O)[C@H]([NH2+][C@H]1CCCC(F)(F)C1)C1CC1 ZINC000358844629 387022543 /nfs/dbraw/zinc/02/25/43/387022543.db2.gz DLYRMPWFOJPRSF-VHSXEESVSA-N 1 2 247.285 2.106 20 0 BEADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccn(C)n1 ZINC000336224742 387066098 /nfs/dbraw/zinc/06/60/98/387066098.db2.gz OMCYYCRGLSLBAF-PSASIEDQSA-N 1 2 247.264 2.193 20 0 BEADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ccn(C)n1 ZINC000336224742 387066101 /nfs/dbraw/zinc/06/61/01/387066101.db2.gz OMCYYCRGLSLBAF-PSASIEDQSA-N 1 2 247.264 2.193 20 0 BEADLO Cn1ncc(Cl)c1C[N@@H+]1CCC12CCC2 ZINC000334985408 387073251 /nfs/dbraw/zinc/07/32/51/387073251.db2.gz YWTSROUTNJWNAW-UHFFFAOYSA-N 1 2 225.723 2.202 20 0 BEADLO Cn1ncc(Cl)c1C[N@H+]1CCC12CCC2 ZINC000334985408 387073257 /nfs/dbraw/zinc/07/32/57/387073257.db2.gz YWTSROUTNJWNAW-UHFFFAOYSA-N 1 2 225.723 2.202 20 0 BEADLO Cn1cc[nH+]c1CN1CCc2cccc(F)c21 ZINC000334988330 387076626 /nfs/dbraw/zinc/07/66/26/387076626.db2.gz KHYFDFAFUDGPTL-UHFFFAOYSA-N 1 2 231.274 2.122 20 0 BEADLO CC(=O)c1cc(C[N@@H+]2CCCC3(CC3)C2)on1 ZINC000565161121 387077681 /nfs/dbraw/zinc/07/76/81/387077681.db2.gz DLYVVXVJNYXLGT-UHFFFAOYSA-N 1 2 234.299 2.253 20 0 BEADLO CC(=O)c1cc(C[N@H+]2CCCC3(CC3)C2)on1 ZINC000565161121 387077685 /nfs/dbraw/zinc/07/76/85/387077685.db2.gz DLYVVXVJNYXLGT-UHFFFAOYSA-N 1 2 234.299 2.253 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2nc3ccccc3o2)C1 ZINC000336259452 387090913 /nfs/dbraw/zinc/09/09/13/387090913.db2.gz BWILOKCVENNFFW-SECBINFHSA-N 1 2 220.247 2.372 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2nc3ccccc3o2)C1 ZINC000336259452 387090915 /nfs/dbraw/zinc/09/09/15/387090915.db2.gz BWILOKCVENNFFW-SECBINFHSA-N 1 2 220.247 2.372 20 0 BEADLO Cc1cccc2[nH+]c(CNC(=O)C(C)(C)C)cn21 ZINC000068570647 387104026 /nfs/dbraw/zinc/10/40/26/387104026.db2.gz LXNIHJKTIPBAJR-UHFFFAOYSA-N 1 2 245.326 2.305 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@@H](C)CC2)no1 ZINC000068830373 387107135 /nfs/dbraw/zinc/10/71/35/387107135.db2.gz FXPONUGFUGKFEH-SECBINFHSA-N 1 2 209.293 2.000 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@@H](C)CC2)no1 ZINC000068830373 387107141 /nfs/dbraw/zinc/10/71/41/387107141.db2.gz FXPONUGFUGKFEH-SECBINFHSA-N 1 2 209.293 2.000 20 0 BEADLO Cc1ccc(CS[C@@H](C)CO)c(C)[nH+]1 ZINC000186624229 387116538 /nfs/dbraw/zinc/11/65/38/387116538.db2.gz LIRRIBPOGWENEW-VIFPVBQESA-N 1 2 211.330 2.312 20 0 BEADLO Clc1cccc2c1OC[C@H]2[NH2+]Cc1cc[nH]n1 ZINC000370462224 387119641 /nfs/dbraw/zinc/11/96/41/387119641.db2.gz GCLICORWLZPQMB-LLVKDONJSA-N 1 2 249.701 2.286 20 0 BEADLO Cc1cnc(C[N@@H+]2CCSC[C@@H]2C2CC2)nc1 ZINC000336291560 387124508 /nfs/dbraw/zinc/12/45/08/387124508.db2.gz KCZSYSGKWUHART-GFCCVEGCSA-N 1 2 249.383 2.112 20 0 BEADLO Cc1cnc(C[N@H+]2CCSC[C@@H]2C2CC2)nc1 ZINC000336291560 387124511 /nfs/dbraw/zinc/12/45/11/387124511.db2.gz KCZSYSGKWUHART-GFCCVEGCSA-N 1 2 249.383 2.112 20 0 BEADLO Fc1ccc2oc(NCCn3cc[nH+]c3)nc2c1 ZINC000114446325 387125301 /nfs/dbraw/zinc/12/53/01/387125301.db2.gz KMQHVDMKNYCPMJ-UHFFFAOYSA-N 1 2 246.245 2.276 20 0 BEADLO CC(C)[C@@H]([NH2+]Cc1ccn[nH]1)c1cccnc1 ZINC000536999573 387141757 /nfs/dbraw/zinc/14/17/57/387141757.db2.gz UGLWRHDJGFVPGB-CYBMUJFWSA-N 1 2 230.315 2.292 20 0 BEADLO CCCc1cccc(C[N@H+](C)CC(=O)OC)c1 ZINC000186899208 387149507 /nfs/dbraw/zinc/14/95/07/387149507.db2.gz STOYDMQLIKUTCJ-UHFFFAOYSA-N 1 2 235.327 2.244 20 0 BEADLO CCCc1cccc(C[N@@H+](C)CC(=O)OC)c1 ZINC000186899208 387149512 /nfs/dbraw/zinc/14/95/12/387149512.db2.gz STOYDMQLIKUTCJ-UHFFFAOYSA-N 1 2 235.327 2.244 20 0 BEADLO CCCCNC(=O)CC[N@@H+]1CCC[C@@H]1C(F)F ZINC000353175454 387150699 /nfs/dbraw/zinc/15/06/99/387150699.db2.gz SBZAHYBJQPRGKJ-SNVBAGLBSA-N 1 2 248.317 2.022 20 0 BEADLO CCCCNC(=O)CC[N@H+]1CCC[C@@H]1C(F)F ZINC000353175454 387150710 /nfs/dbraw/zinc/15/07/10/387150710.db2.gz SBZAHYBJQPRGKJ-SNVBAGLBSA-N 1 2 248.317 2.022 20 0 BEADLO Cn1cc[nH+]c1CN1CCc2c1c(F)ccc2F ZINC000336326099 387154748 /nfs/dbraw/zinc/15/47/48/387154748.db2.gz NBXJSWYRYINESE-UHFFFAOYSA-N 1 2 249.264 2.261 20 0 BEADLO Cc1ccc(C[N@@H+]2CC[C@@](F)(CO)C2)cc1F ZINC000336332109 387159157 /nfs/dbraw/zinc/15/91/57/387159157.db2.gz PIEIGRUDBYGHTN-ZDUSSCGKSA-N 1 2 241.281 2.040 20 0 BEADLO Cc1ccc(C[N@H+]2CC[C@@](F)(CO)C2)cc1F ZINC000336332109 387159159 /nfs/dbraw/zinc/15/91/59/387159159.db2.gz PIEIGRUDBYGHTN-ZDUSSCGKSA-N 1 2 241.281 2.040 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1nn(C)cc1Cl ZINC000393323036 387159449 /nfs/dbraw/zinc/15/94/49/387159449.db2.gz KBBQEEJTVISTIQ-UHFFFAOYSA-N 1 2 239.706 2.265 20 0 BEADLO FC(F)[C@@H]1CCCC[N@@H+]1CC1=CCCOC1 ZINC000336335667 387161561 /nfs/dbraw/zinc/16/15/61/387161561.db2.gz JOMFDDPOWUXTGV-NSHDSACASA-N 1 2 231.286 2.453 20 0 BEADLO FC(F)[C@@H]1CCCC[N@H+]1CC1=CCCOC1 ZINC000336335667 387161565 /nfs/dbraw/zinc/16/15/65/387161565.db2.gz JOMFDDPOWUXTGV-NSHDSACASA-N 1 2 231.286 2.453 20 0 BEADLO CSCc1cnc(C[NH+]2CC(C)C2)s1 ZINC000353256997 387166717 /nfs/dbraw/zinc/16/67/17/387166717.db2.gz HISIIWURDUDVKN-UHFFFAOYSA-N 1 2 228.386 2.458 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1ccc(C)cc1C ZINC000353283809 387171449 /nfs/dbraw/zinc/17/14/49/387171449.db2.gz SCIUTUZBOLOQON-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1ccc(C)cc1C ZINC000353283809 387171452 /nfs/dbraw/zinc/17/14/52/387171452.db2.gz SCIUTUZBOLOQON-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO COc1cc(C[N@@H+]2CCOCC23CC3)ccc1C ZINC000336341366 387171874 /nfs/dbraw/zinc/17/18/74/387171874.db2.gz VBIXRFQTBWIDNQ-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO COc1cc(C[N@H+]2CCOCC23CC3)ccc1C ZINC000336341366 387171879 /nfs/dbraw/zinc/17/18/79/387171879.db2.gz VBIXRFQTBWIDNQ-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO CO[C@H](C)C[N@H+](C)[C@@H](C)c1nc(C(C)C)no1 ZINC000353318713 387180357 /nfs/dbraw/zinc/18/03/57/387180357.db2.gz UDJWISYURDWPRJ-ZJUUUORDSA-N 1 2 241.335 2.221 20 0 BEADLO CO[C@H](C)C[N@@H+](C)[C@@H](C)c1nc(C(C)C)no1 ZINC000353318713 387180361 /nfs/dbraw/zinc/18/03/61/387180361.db2.gz UDJWISYURDWPRJ-ZJUUUORDSA-N 1 2 241.335 2.221 20 0 BEADLO CCN(C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21)C1CC1 ZINC000334074419 387180657 /nfs/dbraw/zinc/18/06/57/387180657.db2.gz JFUIOKVDBAXAQF-GXSJLCMTSA-N 1 2 248.330 2.083 20 0 BEADLO Cc1cn2c([nH+]1)[C@H](CNC(=O)CC(C)C)CCC2 ZINC000371254869 387181914 /nfs/dbraw/zinc/18/19/14/387181914.db2.gz APETZTRFQBUYDD-LBPRGKRZSA-N 1 2 249.358 2.231 20 0 BEADLO CCc1cccc(F)c1C[NH+]1CCOCC1 ZINC000353359683 387188428 /nfs/dbraw/zinc/18/84/28/387188428.db2.gz VZPLERONZKSHPQ-UHFFFAOYSA-N 1 2 223.291 2.220 20 0 BEADLO COc1cc(C)[nH+]c(CS[C@H](C)[C@@H](C)O)c1 ZINC000229863390 387213020 /nfs/dbraw/zinc/21/30/20/387213020.db2.gz PIRZBKQAHRMIDM-NXEZZACHSA-N 1 2 241.356 2.401 20 0 BEADLO C[C@H](c1nccc(N)n1)[N@H+](C)Cc1ccccc1 ZINC000571980566 387214154 /nfs/dbraw/zinc/21/41/54/387214154.db2.gz QCKPSGQVPXXLHK-LLVKDONJSA-N 1 2 242.326 2.082 20 0 BEADLO C[C@H](c1nccc(N)n1)[N@@H+](C)Cc1ccccc1 ZINC000571980566 387214160 /nfs/dbraw/zinc/21/41/60/387214160.db2.gz QCKPSGQVPXXLHK-LLVKDONJSA-N 1 2 242.326 2.082 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1nc(C)sc1C ZINC000336388014 387217696 /nfs/dbraw/zinc/21/76/96/387217696.db2.gz UYFYLPYUDCVLJI-NSHDSACASA-N 1 2 240.372 2.371 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1nc(C)sc1C ZINC000336388014 387217703 /nfs/dbraw/zinc/21/77/03/387217703.db2.gz UYFYLPYUDCVLJI-NSHDSACASA-N 1 2 240.372 2.371 20 0 BEADLO CCN(CC1CCC1)c1cc(C)[nH+]cn1 ZINC000360062228 387222315 /nfs/dbraw/zinc/22/23/15/387222315.db2.gz FLHGJFGWFATQFW-UHFFFAOYSA-N 1 2 205.305 2.411 20 0 BEADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1ncccn1 ZINC000353541825 387224967 /nfs/dbraw/zinc/22/49/67/387224967.db2.gz IVZVFHCUIDUVBC-UHFFFAOYSA-N 1 2 246.314 2.106 20 0 BEADLO O=C(c1ccco1)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000336423621 387253538 /nfs/dbraw/zinc/25/35/38/387253538.db2.gz YSQNUKJZPDMIAG-UHFFFAOYSA-N 1 2 245.282 2.023 20 0 BEADLO O=C(c1ccco1)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000336423621 387253539 /nfs/dbraw/zinc/25/35/39/387253539.db2.gz YSQNUKJZPDMIAG-UHFFFAOYSA-N 1 2 245.282 2.023 20 0 BEADLO Cc1cnn(C)c1CNc1ccc(C)[nH+]c1C ZINC000285224696 387253708 /nfs/dbraw/zinc/25/37/08/387253708.db2.gz VBCNCWKJZLRPRW-UHFFFAOYSA-N 1 2 230.315 2.352 20 0 BEADLO CCN(C[C@@H](C)OC)c1cc[nH+]c(C(C)C)n1 ZINC000360238576 387248251 /nfs/dbraw/zinc/24/82/51/387248251.db2.gz NJWIZBAJPOBTQD-LLVKDONJSA-N 1 2 237.347 2.461 20 0 BEADLO CCCC[C@H](C)[C@@H](C)NCC(F)(F)C[NH3+] ZINC000423349642 387200749 /nfs/dbraw/zinc/20/07/49/387200749.db2.gz XGTGIQKQGSGSDK-VHSXEESVSA-N 1 2 222.323 2.385 20 0 BEADLO CC(=O)c1ccsc1NCc1c[nH+]cn1C ZINC000292075592 387254932 /nfs/dbraw/zinc/25/49/32/387254932.db2.gz LVGBXTSTHJNHSP-UHFFFAOYSA-N 1 2 235.312 2.296 20 0 BEADLO CSCC(=O)Nc1ccc2c(c1)[nH+]c(C)n2C ZINC000336433091 387258012 /nfs/dbraw/zinc/25/80/12/387258012.db2.gz FHSLZYMRJFUEKP-UHFFFAOYSA-N 1 2 249.339 2.183 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)N(C)CCCn1cc[nH+]c1 ZINC000360375495 387273804 /nfs/dbraw/zinc/27/38/04/387273804.db2.gz KIALSBCOLSEZFK-CHWSQXEVSA-N 1 2 249.358 2.168 20 0 BEADLO CO[C@@H](C)C[N@H+](C)C/C(Cl)=C/Cl ZINC000285736199 387284244 /nfs/dbraw/zinc/28/42/44/387284244.db2.gz QDYQIFJGWQAGGM-OJKBXMANSA-N 1 2 212.120 2.272 20 0 BEADLO CO[C@@H](C)C[N@@H+](C)C/C(Cl)=C/Cl ZINC000285736199 387284250 /nfs/dbraw/zinc/28/42/50/387284250.db2.gz QDYQIFJGWQAGGM-OJKBXMANSA-N 1 2 212.120 2.272 20 0 BEADLO CC(C)(C(=O)Nc1ccc(O)cc1)c1c[nH+]c[nH]1 ZINC000336460614 387290117 /nfs/dbraw/zinc/29/01/17/387290117.db2.gz LVOHHMJFBGFUEG-UHFFFAOYSA-N 1 2 245.282 2.032 20 0 BEADLO CC(C)(C(=O)Nc1ccc(O)cc1)c1c[nH]c[nH+]1 ZINC000336460614 387290121 /nfs/dbraw/zinc/29/01/21/387290121.db2.gz LVOHHMJFBGFUEG-UHFFFAOYSA-N 1 2 245.282 2.032 20 0 BEADLO COC[C@@H](C)N(C)c1cc(C)[nH+]c(C(C)C)n1 ZINC000354039095 387318349 /nfs/dbraw/zinc/31/83/49/387318349.db2.gz PFZLRIDAXMYGPT-LLVKDONJSA-N 1 2 237.347 2.380 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1ncccc1Cl ZINC000336470053 387299864 /nfs/dbraw/zinc/29/98/64/387299864.db2.gz RUQRRJRSLFPTRN-UHFFFAOYSA-N 1 2 247.685 2.113 20 0 BEADLO Cc1nc(N(C)CCC(F)(F)F)cc[nH+]1 ZINC000360532586 387304039 /nfs/dbraw/zinc/30/40/39/387304039.db2.gz ZEAXYDRLLOEJBF-UHFFFAOYSA-N 1 2 219.210 2.174 20 0 BEADLO CO[C@H]1CCC[N@H+](Cc2cnc(Cl)s2)C1 ZINC000079320135 387354317 /nfs/dbraw/zinc/35/43/17/387354317.db2.gz XMDDKSVIFIXRAT-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO CO[C@H]1CCC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC000079320135 387354322 /nfs/dbraw/zinc/35/43/22/387354322.db2.gz XMDDKSVIFIXRAT-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO CC(=O)c1ccsc1NCc1[nH+]ccn1C ZINC000292160471 387358295 /nfs/dbraw/zinc/35/82/95/387358295.db2.gz WCOOFUBXVSDPMB-UHFFFAOYSA-N 1 2 235.312 2.296 20 0 BEADLO C[C@H](CC(C)(C)C)C(=O)NCCn1cc[nH+]c1 ZINC000360976611 387378377 /nfs/dbraw/zinc/37/83/77/387378377.db2.gz YEXNBABUOSVRDV-LLVKDONJSA-N 1 2 237.347 2.072 20 0 BEADLO COc1ccc(N[C@@H]2C[C@@H](C)O[C@@H](C)C2)[nH+]c1 ZINC000648481682 387378659 /nfs/dbraw/zinc/37/86/59/387378659.db2.gz AXTVYNLTSPIWHS-JGPRNRPPSA-N 1 2 236.315 2.458 20 0 BEADLO CC1(CNC(=O)Nc2ccn3cc[nH+]c3c2)CC1 ZINC000515018383 387324224 /nfs/dbraw/zinc/32/42/24/387324224.db2.gz DMWFTNQSWXEPAM-UHFFFAOYSA-N 1 2 244.298 2.256 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2CO[C@@H](C)C2)c(C)[nH+]1 ZINC000336502371 387326979 /nfs/dbraw/zinc/32/69/79/387326979.db2.gz BETSMAVZQSCZPF-ONGXEEELSA-N 1 2 234.299 2.062 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000360651217 387328069 /nfs/dbraw/zinc/32/80/69/387328069.db2.gz GGABPVLCXRTWCZ-GMTAPVOTSA-N 1 2 235.331 2.413 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)[C@@H]1CCC(C)(C)C1 ZINC000336559020 387383017 /nfs/dbraw/zinc/38/30/17/387383017.db2.gz DJFFDCVBWUOSQZ-SNVBAGLBSA-N 1 2 235.331 2.194 20 0 BEADLO COc1cc(C)nc(C[N@@H+]2CC[C@@](C)(F)C2)c1 ZINC000336511838 387336539 /nfs/dbraw/zinc/33/65/39/387336539.db2.gz SSOINLHMVHKRLX-CYBMUJFWSA-N 1 2 238.306 2.333 20 0 BEADLO COc1cc(C)nc(C[N@H+]2CC[C@@](C)(F)C2)c1 ZINC000336511838 387336546 /nfs/dbraw/zinc/33/65/46/387336546.db2.gz SSOINLHMVHKRLX-CYBMUJFWSA-N 1 2 238.306 2.333 20 0 BEADLO C[C@@H](CF)[NH2+]Cc1cccc(O)c1Cl ZINC000292963262 387337127 /nfs/dbraw/zinc/33/71/27/387337127.db2.gz LPTCBDBIPZIRQJ-ZETCQYMHSA-N 1 2 217.671 2.493 20 0 BEADLO F[C@H]1CC[C@H](Nc2cc[nH+]c3ccncc23)C1 ZINC000336514194 387337231 /nfs/dbraw/zinc/33/72/31/387337231.db2.gz WMVCERWUKGHHEN-UWVGGRQHSA-N 1 2 231.274 2.354 20 0 BEADLO Cn1c[nH+]cc1CSc1ncc2ccccn21 ZINC000360724895 387341661 /nfs/dbraw/zinc/34/16/61/387341661.db2.gz GJMLNDDWVDOIGV-UHFFFAOYSA-N 1 2 244.323 2.360 20 0 BEADLO CCC[C@@H]1C[C@H]1c1nc(Cc2c[nH+]cn2C)no1 ZINC000361260859 387426742 /nfs/dbraw/zinc/42/67/42/387426742.db2.gz HTEJIKGBASUNOL-MWLCHTKSSA-N 1 2 246.314 2.298 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1CCCO[C@@H]1C ZINC000191457366 387428543 /nfs/dbraw/zinc/42/85/43/387428543.db2.gz WXSSCWZXRVJWNW-GHMZBOCLSA-N 1 2 234.299 2.144 20 0 BEADLO CCCc1[nH]ccc1C(=O)Nc1cc[nH+]cc1C ZINC000421771470 387428817 /nfs/dbraw/zinc/42/88/17/387428817.db2.gz WYJWLKQMXFVZIA-UHFFFAOYSA-N 1 2 243.310 2.345 20 0 BEADLO c1csc([C@H]2CCC[N@H+]2Cc2cncnc2)n1 ZINC000374302422 387440952 /nfs/dbraw/zinc/44/09/52/387440952.db2.gz OVAFWDMYEZRWNJ-LLVKDONJSA-N 1 2 246.339 2.270 20 0 BEADLO c1csc([C@H]2CCC[N@@H+]2Cc2cncnc2)n1 ZINC000374302422 387440957 /nfs/dbraw/zinc/44/09/57/387440957.db2.gz OVAFWDMYEZRWNJ-LLVKDONJSA-N 1 2 246.339 2.270 20 0 BEADLO CCCCC(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000374507002 387461879 /nfs/dbraw/zinc/46/18/79/387461879.db2.gz QXTGIOBYWADDGQ-SNVBAGLBSA-N 1 2 221.304 2.263 20 0 BEADLO CCCCCC(=O)N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000374381450 387448650 /nfs/dbraw/zinc/44/86/50/387448650.db2.gz URFQHYFRSCLYOB-LBPRGKRZSA-N 1 2 249.358 2.316 20 0 BEADLO CC(C)[C@H]1C[N@@H+]([C@@H](C)c2cccnc2)CCN1C ZINC000336605967 387449764 /nfs/dbraw/zinc/44/97/64/387449764.db2.gz KUQKYRCKGYQJOM-DZGCQCFKSA-N 1 2 247.386 2.415 20 0 BEADLO CC(C)[C@H]1C[N@H+]([C@@H](C)c2cccnc2)CCN1C ZINC000336605967 387449769 /nfs/dbraw/zinc/44/97/69/387449769.db2.gz KUQKYRCKGYQJOM-DZGCQCFKSA-N 1 2 247.386 2.415 20 0 BEADLO Cn1c[nH+]c2c1CCN(Cc1ccsc1)C2 ZINC000374418251 387452526 /nfs/dbraw/zinc/45/25/26/387452526.db2.gz CZMIQUYTEQKSGO-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO C[N@H+](Cc1ncc(Cl)s1)[C@@H]1CCCOC1 ZINC000336614270 387455056 /nfs/dbraw/zinc/45/50/56/387455056.db2.gz LOSAAPRLLBXSHX-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO C[N@@H+](Cc1ncc(Cl)s1)[C@@H]1CCCOC1 ZINC000336614270 387455059 /nfs/dbraw/zinc/45/50/59/387455059.db2.gz LOSAAPRLLBXSHX-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO Cn1cc[nH+]c1CN1CCc2cc(F)c(F)cc21 ZINC000336612308 387455601 /nfs/dbraw/zinc/45/56/01/387455601.db2.gz AZDAKOFBSZSKFS-UHFFFAOYSA-N 1 2 249.264 2.261 20 0 BEADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ncccn1 ZINC000336615894 387456566 /nfs/dbraw/zinc/45/65/66/387456566.db2.gz OREQRIGCCAUVQN-IUCAKERBSA-N 1 2 245.248 2.249 20 0 BEADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ncccn1 ZINC000336615894 387456567 /nfs/dbraw/zinc/45/65/67/387456567.db2.gz OREQRIGCCAUVQN-IUCAKERBSA-N 1 2 245.248 2.249 20 0 BEADLO C[C@H]1CSC[C@H]1Nc1cc[nH+]c2ccncc12 ZINC000336617584 387459385 /nfs/dbraw/zinc/45/93/85/387459385.db2.gz VWLOAPYPNOFDIM-TVQRCGJNSA-N 1 2 245.351 2.215 20 0 BEADLO CC/C=C\CNC(=O)c1ccn2c(C)c[nH+]c2c1 ZINC000515497710 387391239 /nfs/dbraw/zinc/39/12/39/387391239.db2.gz ATNXIDPSRCQCHM-PLNGDYQASA-N 1 2 243.310 2.339 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@H](C3CC3)C2)nc1 ZINC000336571757 387395201 /nfs/dbraw/zinc/39/52/01/387395201.db2.gz XRCSVZKIQMLKQB-AWEZNQCLSA-N 1 2 232.327 2.001 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@H](C3CC3)C2)nc1 ZINC000336571757 387395203 /nfs/dbraw/zinc/39/52/03/387395203.db2.gz XRCSVZKIQMLKQB-AWEZNQCLSA-N 1 2 232.327 2.001 20 0 BEADLO CC(C)(C)OC(=O)C[N@@H+]1CCSC(C)(C)C1 ZINC000083417243 387415555 /nfs/dbraw/zinc/41/55/55/387415555.db2.gz DEFMMDDSMFKCRA-UHFFFAOYSA-N 1 2 245.388 2.156 20 0 BEADLO CC(C)(C)OC(=O)C[N@H+]1CCSC(C)(C)C1 ZINC000083417243 387415560 /nfs/dbraw/zinc/41/55/60/387415560.db2.gz DEFMMDDSMFKCRA-UHFFFAOYSA-N 1 2 245.388 2.156 20 0 BEADLO CC(C)Cn1cc[nH+]c1CNC(=O)C[C@@H]1C[C@@H]1C ZINC000354706893 387419875 /nfs/dbraw/zinc/41/98/75/387419875.db2.gz HQHCBZNVKZAXTA-RYUDHWBXSA-N 1 2 249.358 2.201 20 0 BEADLO CCCC[NH2+]c1ccc(-n2cnnn2)c(C)c1 ZINC000037104092 387420424 /nfs/dbraw/zinc/42/04/24/387420424.db2.gz LMIMHPJOVNTGMQ-UHFFFAOYSA-N 1 2 231.303 2.183 20 0 BEADLO CC(C)n1ccc(C[N@@H+]2CC[C@](C)(F)C2)n1 ZINC000336595138 387420828 /nfs/dbraw/zinc/42/08/28/387420828.db2.gz FNFMURIPQDZPEJ-LBPRGKRZSA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1ccc(C[N@H+]2CC[C@](C)(F)C2)n1 ZINC000336595138 387420835 /nfs/dbraw/zinc/42/08/35/387420835.db2.gz FNFMURIPQDZPEJ-LBPRGKRZSA-N 1 2 225.311 2.398 20 0 BEADLO C[C@@H]1C[C@H]1CC(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000355499161 387542920 /nfs/dbraw/zinc/54/29/20/387542920.db2.gz AYOSRZJPNGSJOI-VWYCJHECSA-N 1 2 233.315 2.119 20 0 BEADLO C[N@H+](Cc1cccs1)Cc1ncccn1 ZINC000361689500 387521918 /nfs/dbraw/zinc/52/19/18/387521918.db2.gz MLGUISPRWFJIRS-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO C[N@@H+](Cc1cccs1)Cc1ncccn1 ZINC000361689500 387521925 /nfs/dbraw/zinc/52/19/25/387521925.db2.gz MLGUISPRWFJIRS-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO COc1ccnc(NCc2c[nH+]c(C)cc2C)n1 ZINC000396983309 387527055 /nfs/dbraw/zinc/52/70/55/387527055.db2.gz PKVUTOMZTKGTIJ-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H](C)C(F)(F)F ZINC000361795895 387535865 /nfs/dbraw/zinc/53/58/65/387535865.db2.gz MJBIMBDSYQVMRM-ZETCQYMHSA-N 1 2 246.232 2.203 20 0 BEADLO C[C@@H](CO)CSCc1c[nH+]c2ccccn12 ZINC000305064036 387544660 /nfs/dbraw/zinc/54/46/60/387544660.db2.gz HHOUMAUJDJGREK-JTQLQIEISA-N 1 2 236.340 2.196 20 0 BEADLO F[C@@]1(c2ccccc2)CCN(Cc2[nH]cc[nH+]2)C1 ZINC000374534332 387464883 /nfs/dbraw/zinc/46/48/83/387464883.db2.gz DJHZIXANOZGTSP-AWEZNQCLSA-N 1 2 245.301 2.480 20 0 BEADLO Cc1cn2c([nH+]1)CN(Cc1cccc(F)c1)CC2 ZINC000374692912 387482167 /nfs/dbraw/zinc/48/21/67/387482167.db2.gz JAJAIONYEVRZHW-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO C[C@@H]1C[C@H]1CC(=O)Nc1ccc[nH+]c1N(C)C ZINC000361551857 387486429 /nfs/dbraw/zinc/48/64/29/387486429.db2.gz QVKCFADRUUFQDW-ZJUUUORDSA-N 1 2 233.315 2.132 20 0 BEADLO C[N@H+](CCC1CCCCC1)Cc1nnc[nH]1 ZINC000361551460 387488317 /nfs/dbraw/zinc/48/83/17/387488317.db2.gz JXFCJWGRWVFFPB-UHFFFAOYSA-N 1 2 222.336 2.207 20 0 BEADLO C[N@@H+](CCC1CCCCC1)Cc1nnc[nH]1 ZINC000361551460 387488323 /nfs/dbraw/zinc/48/83/23/387488323.db2.gz JXFCJWGRWVFFPB-UHFFFAOYSA-N 1 2 222.336 2.207 20 0 BEADLO CC[N@H+](C[C@H](C)OC)[C@H](C)c1nnc(C)s1 ZINC000361559210 387491053 /nfs/dbraw/zinc/49/10/53/387491053.db2.gz NWKWBMOXIOXIKJ-DTWKUNHWSA-N 1 2 243.376 2.264 20 0 BEADLO CC[N@@H+](C[C@H](C)OC)[C@H](C)c1nnc(C)s1 ZINC000361559210 387491055 /nfs/dbraw/zinc/49/10/55/387491055.db2.gz NWKWBMOXIOXIKJ-DTWKUNHWSA-N 1 2 243.376 2.264 20 0 BEADLO CCOc1ccccc1C[NH+]1CC(C)(OC)C1 ZINC000362325671 387596924 /nfs/dbraw/zinc/59/69/24/387596924.db2.gz TYRXXLVRWBJTHY-UHFFFAOYSA-N 1 2 235.327 2.306 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1C[C@@H]1C(C)C ZINC000356221103 387628780 /nfs/dbraw/zinc/62/87/80/387628780.db2.gz OLWIXIGNWRAQMO-VXGBXAGGSA-N 1 2 232.327 2.297 20 0 BEADLO c1ccc(NCc2cccc3c2OCO3)[nH+]c1 ZINC000041654395 387606516 /nfs/dbraw/zinc/60/65/16/387606516.db2.gz DZACVFLHJWYAAX-UHFFFAOYSA-N 1 2 228.251 2.422 20 0 BEADLO CCSCC[C@@H](C)[N@H+](C)Cc1noc(C)n1 ZINC000362456451 387614268 /nfs/dbraw/zinc/61/42/68/387614268.db2.gz VWUGAHIMGNBXLD-SECBINFHSA-N 1 2 243.376 2.342 20 0 BEADLO CCSCC[C@@H](C)[N@@H+](C)Cc1noc(C)n1 ZINC000362456451 387614270 /nfs/dbraw/zinc/61/42/70/387614270.db2.gz VWUGAHIMGNBXLD-SECBINFHSA-N 1 2 243.376 2.342 20 0 BEADLO C[C@H](CC(C)(C)C)C(=O)NCc1[nH]cc[nH+]1 ZINC000356098239 387615405 /nfs/dbraw/zinc/61/54/05/387615405.db2.gz VQDVVEFWJCLFJS-SECBINFHSA-N 1 2 223.320 2.098 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@H](C3CC3)C2)o1 ZINC000362516831 387622742 /nfs/dbraw/zinc/62/27/42/387622742.db2.gz SZZBHTCKQJODAW-AWEZNQCLSA-N 1 2 235.327 2.453 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@H](C3CC3)C2)o1 ZINC000362516831 387622746 /nfs/dbraw/zinc/62/27/46/387622746.db2.gz SZZBHTCKQJODAW-AWEZNQCLSA-N 1 2 235.327 2.453 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCC(=O)[C@H](C)C2)s1 ZINC000283286684 387577315 /nfs/dbraw/zinc/57/73/15/387577315.db2.gz WNWPQGRPBOGTSO-MRVPVSSYSA-N 1 2 238.356 2.171 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCC(=O)[C@H](C)C2)s1 ZINC000283286684 387577320 /nfs/dbraw/zinc/57/73/20/387577320.db2.gz WNWPQGRPBOGTSO-MRVPVSSYSA-N 1 2 238.356 2.171 20 0 BEADLO CC[C@@H](F)C[N@H+](C)[C@@H](C)C(=O)OC(C)C ZINC000440778418 387694296 /nfs/dbraw/zinc/69/42/96/387694296.db2.gz KLCXSIPRCAFWHP-VHSXEESVSA-N 1 2 219.300 2.006 20 0 BEADLO CC[C@@H](F)C[N@@H+](C)[C@@H](C)C(=O)OC(C)C ZINC000440778418 387694301 /nfs/dbraw/zinc/69/43/01/387694301.db2.gz KLCXSIPRCAFWHP-VHSXEESVSA-N 1 2 219.300 2.006 20 0 BEADLO CC[C@H](F)C[N@H+](C)[C@@H](C)C(=O)OC(C)C ZINC000440778417 387694443 /nfs/dbraw/zinc/69/44/43/387694443.db2.gz KLCXSIPRCAFWHP-UWVGGRQHSA-N 1 2 219.300 2.006 20 0 BEADLO CC[C@H](F)C[N@@H+](C)[C@@H](C)C(=O)OC(C)C ZINC000440778417 387694450 /nfs/dbraw/zinc/69/44/50/387694450.db2.gz KLCXSIPRCAFWHP-UWVGGRQHSA-N 1 2 219.300 2.006 20 0 BEADLO C[C@@H]1CC[C@H](C)[N@H+]1Cc1noc(C2CC2)n1 ZINC000123053491 387640667 /nfs/dbraw/zinc/64/06/67/387640667.db2.gz GRGACPZIPRQOQK-DTORHVGOSA-N 1 2 221.304 2.320 20 0 BEADLO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1noc(C2CC2)n1 ZINC000123053491 387640672 /nfs/dbraw/zinc/64/06/72/387640672.db2.gz GRGACPZIPRQOQK-DTORHVGOSA-N 1 2 221.304 2.320 20 0 BEADLO Cn1cccc1CNc1[nH]c2cc(F)ccc2[nH+]1 ZINC000362626277 387641844 /nfs/dbraw/zinc/64/18/44/387641844.db2.gz GODPBBBAWLLEML-UHFFFAOYSA-N 1 2 244.273 2.075 20 0 BEADLO CC[C@H](Nc1cc[nH+]c(C)n1)c1ncc[nH]1 ZINC000125232189 387649686 /nfs/dbraw/zinc/64/96/86/387649686.db2.gz VCJBSVWPIUPWCW-VIFPVBQESA-N 1 2 217.276 2.071 20 0 BEADLO Cc1cc(CNc2ccc(N(C)C)[nH+]c2)ccn1 ZINC000527675554 387656861 /nfs/dbraw/zinc/65/68/61/387656861.db2.gz OBANKIAFTXVLDX-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO CN(C)c1ccccc1CNc1cc[nH+]cc1F ZINC000362800443 387660713 /nfs/dbraw/zinc/66/07/13/387660713.db2.gz GDAZEEUQSIDZIK-UHFFFAOYSA-N 1 2 245.301 2.321 20 0 BEADLO CCC[C@@H]1C[C@@H]1C(=O)NC[C@H](C)Cn1cc[nH+]c1 ZINC000362821080 387662398 /nfs/dbraw/zinc/66/23/98/387662398.db2.gz UWUBHNOLHWKVFF-XQQFMLRXSA-N 1 2 249.358 2.072 20 0 BEADLO C[C@H]1C[C@H]1C[NH+]=c1[nH]c2ccc(F)cc2n1C ZINC000431015464 387669964 /nfs/dbraw/zinc/66/99/64/387669964.db2.gz PBRWSIBXQPQIKM-IUCAKERBSA-N 1 2 233.290 2.202 20 0 BEADLO Cc1nc(C[NH2+]Cc2cncc(C)c2)cs1 ZINC000123228395 387670674 /nfs/dbraw/zinc/67/06/74/387670674.db2.gz XQBAJORNKKJDLR-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO CC[C@@H](F)C[N@H+](C)[C@H](C)C(=O)OC(C)C ZINC000440778415 387693969 /nfs/dbraw/zinc/69/39/69/387693969.db2.gz KLCXSIPRCAFWHP-NXEZZACHSA-N 1 2 219.300 2.006 20 0 BEADLO CC[C@@H](F)C[N@@H+](C)[C@H](C)C(=O)OC(C)C ZINC000440778415 387693975 /nfs/dbraw/zinc/69/39/75/387693975.db2.gz KLCXSIPRCAFWHP-NXEZZACHSA-N 1 2 219.300 2.006 20 0 BEADLO Cc1nocc1C[NH2+][C@@H](C)c1ncccc1F ZINC000527827764 387748240 /nfs/dbraw/zinc/74/82/40/387748240.db2.gz IYNZVUKEBRDOLP-VIFPVBQESA-N 1 2 235.262 2.368 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ncccc2F)nn1C ZINC000527828382 387748990 /nfs/dbraw/zinc/74/89/90/387748990.db2.gz SQXHCEQHGBFIPX-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NC[C@@H]1CC[C@@H](C)C1 ZINC000521459024 387750683 /nfs/dbraw/zinc/75/06/83/387750683.db2.gz PZAYMWGBYMXXDH-GRYCIOLGSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NC[C@@H]1CC[C@@H](C)C1 ZINC000521459024 387750689 /nfs/dbraw/zinc/75/06/89/387750689.db2.gz PZAYMWGBYMXXDH-GRYCIOLGSA-N 1 2 249.358 2.141 20 0 BEADLO CC[C@@H](F)CN1CC[N@H+](C[C@H](F)CC)C[C@@H]1C ZINC000440788692 387698943 /nfs/dbraw/zinc/69/89/43/387698943.db2.gz ZXLIGMBOLTUARW-YNEHKIRRSA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@@H](F)CN1CC[N@@H+](C[C@H](F)CC)C[C@@H]1C ZINC000440788692 387698947 /nfs/dbraw/zinc/69/89/47/387698947.db2.gz ZXLIGMBOLTUARW-YNEHKIRRSA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@@H](F)CN1CC[N@H+](C[C@H](F)CC)[C@@H](C)C1 ZINC000440788692 387698953 /nfs/dbraw/zinc/69/89/53/387698953.db2.gz ZXLIGMBOLTUARW-YNEHKIRRSA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@@H](F)CN1CC[N@@H+](C[C@H](F)CC)[C@@H](C)C1 ZINC000440788692 387698954 /nfs/dbraw/zinc/69/89/54/387698954.db2.gz ZXLIGMBOLTUARW-YNEHKIRRSA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@@H](F)C[N@H+](CC(=O)OC)C1CCCC1 ZINC000440795633 387703263 /nfs/dbraw/zinc/70/32/63/387703263.db2.gz FBYXRGNQWLYMSV-SNVBAGLBSA-N 1 2 231.311 2.152 20 0 BEADLO CC[C@@H](F)C[N@@H+](CC(=O)OC)C1CCCC1 ZINC000440795633 387703266 /nfs/dbraw/zinc/70/32/66/387703266.db2.gz FBYXRGNQWLYMSV-SNVBAGLBSA-N 1 2 231.311 2.152 20 0 BEADLO C[N@H+](CCCO)Cc1ncc(Cl)cc1Cl ZINC000440942390 387714116 /nfs/dbraw/zinc/71/41/16/387714116.db2.gz FPDZVCZCUDKLTM-UHFFFAOYSA-N 1 2 249.141 2.203 20 0 BEADLO C[N@@H+](CCCO)Cc1ncc(Cl)cc1Cl ZINC000440942390 387714121 /nfs/dbraw/zinc/71/41/21/387714121.db2.gz FPDZVCZCUDKLTM-UHFFFAOYSA-N 1 2 249.141 2.203 20 0 BEADLO CC(C)c1nc(NC[C@H]2CCO[C@H](C)C2)cc[nH+]1 ZINC000356802190 387725158 /nfs/dbraw/zinc/72/51/58/387725158.db2.gz YUEJGRORCDQOKP-NEPJUHHUSA-N 1 2 249.358 2.249 20 0 BEADLO Cc1noc([C@@H](C)[NH2+]Cc2ccccc2F)n1 ZINC000356871419 387736128 /nfs/dbraw/zinc/73/61/28/387736128.db2.gz UYSLZZBLNGXGLF-MRVPVSSYSA-N 1 2 235.262 2.368 20 0 BEADLO CC[C@@H](COC)Nc1cc[nH+]c(C2CC2)n1 ZINC000150916433 387782115 /nfs/dbraw/zinc/78/21/15/387782115.db2.gz NQODFCDOTKZFRV-JTQLQIEISA-N 1 2 221.304 2.191 20 0 BEADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cocn2)on1 ZINC000432744921 387812744 /nfs/dbraw/zinc/81/27/44/387812744.db2.gz OPTLKDXSTWTYBZ-LLVKDONJSA-N 1 2 233.271 2.308 20 0 BEADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cocn2)on1 ZINC000432744921 387812746 /nfs/dbraw/zinc/81/27/46/387812746.db2.gz OPTLKDXSTWTYBZ-LLVKDONJSA-N 1 2 233.271 2.308 20 0 BEADLO C/C(=C\C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1)C1CC1 ZINC000378520146 387789039 /nfs/dbraw/zinc/78/90/39/387789039.db2.gz RYMNWBGDEGWYFN-BZYZDCJZSA-N 1 2 245.326 2.430 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCCC[C@H]1CNC(C)=O ZINC000639896208 387810170 /nfs/dbraw/zinc/81/01/70/387810170.db2.gz AQFKHPFCDGUTGV-NSHDSACASA-N 1 2 248.317 2.022 20 0 BEADLO CCC(F)(F)C[N@H+]1CCCC[C@H]1CNC(C)=O ZINC000639896208 387810177 /nfs/dbraw/zinc/81/01/77/387810177.db2.gz AQFKHPFCDGUTGV-NSHDSACASA-N 1 2 248.317 2.022 20 0 BEADLO CSc1ccc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)cc1 ZINC000367831861 387758210 /nfs/dbraw/zinc/75/82/10/387758210.db2.gz KPIPLAIBUVTUOI-QWHCGFSZSA-N 1 2 235.352 2.382 20 0 BEADLO CSc1ccc(C[N@H+]2CCO[C@@H]3C[C@@H]32)cc1 ZINC000367831861 387758214 /nfs/dbraw/zinc/75/82/14/387758214.db2.gz KPIPLAIBUVTUOI-QWHCGFSZSA-N 1 2 235.352 2.382 20 0 BEADLO COc1ccc[nH+]c1N(C)Cc1cnc(C)s1 ZINC000527852906 387758599 /nfs/dbraw/zinc/75/85/99/387758599.db2.gz PHKBSJAKPDDAME-UHFFFAOYSA-N 1 2 249.339 2.492 20 0 BEADLO CC[C@H](NC(=O)[C@H]1CC[C@@H](C)C1)c1[nH]cc[nH+]1 ZINC000442809938 387846365 /nfs/dbraw/zinc/84/63/65/387846365.db2.gz LGRYJCZXIAJIDP-VWYCJHECSA-N 1 2 235.331 2.413 20 0 BEADLO C1=CCC(CNc2cc(N3CCCC3)nc[nH+]2)C1 ZINC000528115400 387849001 /nfs/dbraw/zinc/84/90/01/387849001.db2.gz QGOCVVGJWDWDBM-UHFFFAOYSA-N 1 2 244.342 2.455 20 0 BEADLO C1=CCC(CNc2cc(N3CCCC3)[nH+]cn2)C1 ZINC000528115400 387849003 /nfs/dbraw/zinc/84/90/03/387849003.db2.gz QGOCVVGJWDWDBM-UHFFFAOYSA-N 1 2 244.342 2.455 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C(C)(C)C1CCC1 ZINC000452573125 387861699 /nfs/dbraw/zinc/86/16/99/387861699.db2.gz VKNSTVPWVUZPRA-UHFFFAOYSA-N 1 2 249.358 2.346 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C1(CC)CCC1 ZINC000452573113 387862194 /nfs/dbraw/zinc/86/21/94/387862194.db2.gz VGRWPGZHAWDWPL-UHFFFAOYSA-N 1 2 235.331 2.100 20 0 BEADLO COc1ccnc(C[NH2+]Cc2sccc2C)n1 ZINC000424171550 387862597 /nfs/dbraw/zinc/86/25/97/387862597.db2.gz LVDQBOZFSDLDRM-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO CC[NH+](CC)Cc1nc([C@H]2CC[C@@H](C)O2)no1 ZINC000528234463 387885532 /nfs/dbraw/zinc/88/55/32/387885532.db2.gz KMWYRVRMLSWLAT-NXEZZACHSA-N 1 2 239.319 2.151 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H]1[C@H](C)[C@H]1C1CC1 ZINC000528321321 387901360 /nfs/dbraw/zinc/90/13/60/387901360.db2.gz YJWAMONFDPWPRH-OXHMUOHRSA-N 1 2 246.310 2.321 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1CCOCC1(C)C ZINC000528361006 387911781 /nfs/dbraw/zinc/91/17/81/387911781.db2.gz XAQPPVKFWYDJFC-RUDMXATFSA-N 1 2 203.713 2.240 20 0 BEADLO C/C(Cl)=C\C[N@H+]1CCOCC1(C)C ZINC000528361006 387911787 /nfs/dbraw/zinc/91/17/87/387911787.db2.gz XAQPPVKFWYDJFC-RUDMXATFSA-N 1 2 203.713 2.240 20 0 BEADLO Cc1cc(C)cc(C[N@@H+](C)Cc2cn(C)nn2)c1 ZINC000444713107 387914848 /nfs/dbraw/zinc/91/48/48/387914848.db2.gz FKFLUEHJACTEDK-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cc(C)cc(C[N@H+](C)Cc2cn(C)nn2)c1 ZINC000444713107 387914852 /nfs/dbraw/zinc/91/48/52/387914852.db2.gz FKFLUEHJACTEDK-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO c1ncc(C[N@@H+]2CCc3ncsc3C2)s1 ZINC000438375013 387930748 /nfs/dbraw/zinc/93/07/48/387930748.db2.gz PZPHPSKPAFPCST-UHFFFAOYSA-N 1 2 237.353 2.158 20 0 BEADLO c1ncc(C[N@H+]2CCc3ncsc3C2)s1 ZINC000438375013 387930752 /nfs/dbraw/zinc/93/07/52/387930752.db2.gz PZPHPSKPAFPCST-UHFFFAOYSA-N 1 2 237.353 2.158 20 0 BEADLO CC[C@H](CSC)Nc1cc[nH+]c(C)n1 ZINC000162134342 387938015 /nfs/dbraw/zinc/93/80/15/387938015.db2.gz FOFGQDXSWLLGBB-SECBINFHSA-N 1 2 211.334 2.339 20 0 BEADLO C[C@H](N[C@H]1C[C@H](C)n2cc[nH+]c21)C(F)(F)F ZINC000424324608 387970807 /nfs/dbraw/zinc/97/08/07/387970807.db2.gz NDSFRHZLKQQPOE-FXQIFTODSA-N 1 2 233.237 2.429 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ncc(C)s2)C[C@@H](C)O1 ZINC000245541723 387957435 /nfs/dbraw/zinc/95/74/35/387957435.db2.gz QRBCMLPLNSDVGY-KOLCDFICSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ncc(C)s2)C[C@@H](C)O1 ZINC000245541723 387957436 /nfs/dbraw/zinc/95/74/36/387957436.db2.gz QRBCMLPLNSDVGY-KOLCDFICSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]([NH2+][C@H](C)C(F)(F)F)[C@H]1CCOC1 ZINC000424334657 387979335 /nfs/dbraw/zinc/97/93/35/387979335.db2.gz YXRRZJRIKGWTKO-HRDYMLBCSA-N 1 2 225.254 2.342 20 0 BEADLO Cc1cc(N2CCC[C@@H]([C@H]3CCOC3)C2)nc[nH+]1 ZINC000439082638 387977460 /nfs/dbraw/zinc/97/74/60/387977460.db2.gz DRXJBEFFUAMATM-OLZOCXBDSA-N 1 2 247.342 2.038 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)oc1C ZINC000446071239 387992993 /nfs/dbraw/zinc/99/29/93/387992993.db2.gz IXGLHXDSITVMKB-PTOFAABTSA-N 1 2 238.331 2.289 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)oc1C ZINC000446071239 387992997 /nfs/dbraw/zinc/99/29/97/387992997.db2.gz IXGLHXDSITVMKB-PTOFAABTSA-N 1 2 238.331 2.289 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)oc1C ZINC000446071240 387993121 /nfs/dbraw/zinc/99/31/21/387993121.db2.gz IXGLHXDSITVMKB-XRNSZHNASA-N 1 2 238.331 2.289 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)oc1C ZINC000446071240 387993122 /nfs/dbraw/zinc/99/31/22/387993122.db2.gz IXGLHXDSITVMKB-XRNSZHNASA-N 1 2 238.331 2.289 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2C[C@@H]2c2ccc(C)cc2)n1 ZINC000424342057 387982506 /nfs/dbraw/zinc/98/25/06/387982506.db2.gz WSCCLWIBEJCMIU-VXGBXAGGSA-N 1 2 243.310 2.369 20 0 BEADLO Cc1cnc(C[N@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)s1 ZINC000446083995 387997604 /nfs/dbraw/zinc/99/76/04/387997604.db2.gz STTVPYPEMJUVGI-GDPRMGEGSA-N 1 2 240.372 2.449 20 0 BEADLO Cc1cnc(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)s1 ZINC000446083995 387997619 /nfs/dbraw/zinc/99/76/19/387997619.db2.gz STTVPYPEMJUVGI-GDPRMGEGSA-N 1 2 240.372 2.449 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC[C@@H]1CCC[C@@H]1C ZINC000439431109 387998767 /nfs/dbraw/zinc/99/87/67/387998767.db2.gz LPJKKGXOQFWIER-JQWIXIFHSA-N 1 2 247.342 2.370 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ncnn2C)[C@H]1c1ccccc1 ZINC000246108644 388010132 /nfs/dbraw/zinc/01/01/32/388010132.db2.gz BUZVLPAHPMFRHG-BXUZGUMPSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ncnn2C)[C@H]1c1ccccc1 ZINC000246108644 388010136 /nfs/dbraw/zinc/01/01/36/388010136.db2.gz BUZVLPAHPMFRHG-BXUZGUMPSA-N 1 2 242.326 2.008 20 0 BEADLO CC[C@H]([NH2+][C@H]1CCCc2nn(C)cc21)C(F)F ZINC000453246140 388024151 /nfs/dbraw/zinc/02/41/51/388024151.db2.gz MJHRAUIZPLTEIQ-UWVGGRQHSA-N 1 2 243.301 2.431 20 0 BEADLO CC[C@@H]([NH2+][C@@H](C)c1ccnn1C)C(F)F ZINC000453243635 388012466 /nfs/dbraw/zinc/01/24/66/388012466.db2.gz JAKRNFNHDXCZCQ-JGVFFNPUSA-N 1 2 217.263 2.114 20 0 BEADLO CO[C@H]1C[C@@H](Nc2cc[nH+]c(C(C)C)n2)C1(C)C ZINC000440190584 388035549 /nfs/dbraw/zinc/03/55/49/388035549.db2.gz SKVFJYLGCMZEPN-MNOVXSKESA-N 1 2 249.358 2.247 20 0 BEADLO CC[N@H+](Cc1cnc(C2CC2)s1)C1COC1 ZINC000648698689 388043664 /nfs/dbraw/zinc/04/36/64/388043664.db2.gz JLHWVGBKOLDNRL-UHFFFAOYSA-N 1 2 238.356 2.241 20 0 BEADLO CC[N@@H+](Cc1cnc(C2CC2)s1)C1COC1 ZINC000648698689 388043667 /nfs/dbraw/zinc/04/36/67/388043667.db2.gz JLHWVGBKOLDNRL-UHFFFAOYSA-N 1 2 238.356 2.241 20 0 BEADLO Cc1nccnc1[C@@H](C)[NH2+][C@H](C)c1ccon1 ZINC000446890300 388044112 /nfs/dbraw/zinc/04/41/12/388044112.db2.gz IYIUSNLMYMBWFL-PSASIEDQSA-N 1 2 232.287 2.185 20 0 BEADLO CCCCOCC[NH2+]C(C)(C)c1noc(C)n1 ZINC000440029638 388028617 /nfs/dbraw/zinc/02/86/17/388028617.db2.gz RIOXRYBDURJUKC-UHFFFAOYSA-N 1 2 241.335 2.019 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCC[C@H](c2n[nH]c(C)n2)C1 ZINC000440518097 388051481 /nfs/dbraw/zinc/05/14/81/388051481.db2.gz JHJJCJYEMDMSAI-WDEREUQCSA-N 1 2 240.326 2.041 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCC[C@H](c2n[nH]c(C)n2)C1 ZINC000440518097 388051483 /nfs/dbraw/zinc/05/14/83/388051483.db2.gz JHJJCJYEMDMSAI-WDEREUQCSA-N 1 2 240.326 2.041 20 0 BEADLO CC[C@@](C)(O)CNc1cc(C)[nH+]c(C(C)C)n1 ZINC000083421416 388051923 /nfs/dbraw/zinc/05/19/23/388051923.db2.gz HSOFRVQCTSLLQD-CYBMUJFWSA-N 1 2 237.347 2.481 20 0 BEADLO CC[C@H](F)C[N@@H+]1CC[C@H](C)C[C@H]1C(=O)OC ZINC000440533335 388052924 /nfs/dbraw/zinc/05/29/24/388052924.db2.gz QMWUGLOKWBALAP-DCAQKATOSA-N 1 2 231.311 2.008 20 0 BEADLO CC[C@H](F)C[N@H+]1CC[C@H](C)C[C@H]1C(=O)OC ZINC000440533335 388052928 /nfs/dbraw/zinc/05/29/28/388052928.db2.gz QMWUGLOKWBALAP-DCAQKATOSA-N 1 2 231.311 2.008 20 0 BEADLO CCC[N@@H+](CC(=O)OCC)C[C@@H](F)CC ZINC000440693049 388067454 /nfs/dbraw/zinc/06/74/54/388067454.db2.gz LZCODAKBXBNOIO-JTQLQIEISA-N 1 2 219.300 2.010 20 0 BEADLO CCC[N@H+](CC(=O)OCC)C[C@@H](F)CC ZINC000440693049 388067458 /nfs/dbraw/zinc/06/74/58/388067458.db2.gz LZCODAKBXBNOIO-JTQLQIEISA-N 1 2 219.300 2.010 20 0 BEADLO Cc1cc(NCc2c[nH+]cn2C)ccc1F ZINC000085169543 388084260 /nfs/dbraw/zinc/08/42/60/388084260.db2.gz AKHRRYVYFQZEGY-UHFFFAOYSA-N 1 2 219.263 2.480 20 0 BEADLO Cc1ccccc1C1([NH2+]Cc2c[nH]cn2)CC1 ZINC000645980776 388115090 /nfs/dbraw/zinc/11/50/90/388115090.db2.gz JXGBPXYXYDMUBE-UHFFFAOYSA-N 1 2 227.311 2.497 20 0 BEADLO COc1cc(C[N@H+](C)Cc2cc[nH]n2)ccc1C ZINC000447744308 388090229 /nfs/dbraw/zinc/09/02/29/388090229.db2.gz XLOONJLCCKNOQA-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2cc[nH]n2)ccc1C ZINC000447744308 388090232 /nfs/dbraw/zinc/09/02/32/388090232.db2.gz XLOONJLCCKNOQA-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C(=O)NCCCn1cc[nH+]c1 ZINC000424532688 388098069 /nfs/dbraw/zinc/09/80/69/388098069.db2.gz XOPSZRZEQWLPCS-OLZOCXBDSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1noc(C[NH2+]C2(c3ccccc3C)CC2)n1 ZINC000645979610 388113875 /nfs/dbraw/zinc/11/38/75/388113875.db2.gz YHBGDKLDEHLZFQ-UHFFFAOYSA-N 1 2 243.310 2.465 20 0 BEADLO Fc1cccc(C[NH2+][C@H]2CCn3ccnc32)c1F ZINC000648628016 388045897 /nfs/dbraw/zinc/04/58/97/388045897.db2.gz JNJVUPULMDMJIW-NSHDSACASA-N 1 2 249.264 2.396 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+](C[C@H](F)CC)C1CC1 ZINC000440512671 388046806 /nfs/dbraw/zinc/04/68/06/388046806.db2.gz NIATVKDLZLPVPD-VHSXEESVSA-N 1 2 231.311 2.151 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+](C[C@H](F)CC)C1CC1 ZINC000440512671 388046810 /nfs/dbraw/zinc/04/68/10/388046810.db2.gz NIATVKDLZLPVPD-VHSXEESVSA-N 1 2 231.311 2.151 20 0 BEADLO CC/C=C/CNC(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000455342057 388156796 /nfs/dbraw/zinc/15/67/96/388156796.db2.gz VGQLLAKALBALNJ-BXXZLRJFSA-N 1 2 248.330 2.154 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2ccncc2)s1 ZINC000449238361 388160802 /nfs/dbraw/zinc/16/08/02/388160802.db2.gz GATWNNYPLOYJTB-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2ccncc2)s1 ZINC000449238361 388160804 /nfs/dbraw/zinc/16/08/04/388160804.db2.gz GATWNNYPLOYJTB-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)C1(C2CCC2)CCC1 ZINC000455510660 388162238 /nfs/dbraw/zinc/16/22/38/388162238.db2.gz GYNJYTHQQVWOAR-UHFFFAOYSA-N 1 2 247.342 2.339 20 0 BEADLO COC[C@@H](Cc1ccccc1)[NH2+]C(CF)CF ZINC000449379884 388187948 /nfs/dbraw/zinc/18/79/48/388187948.db2.gz KMMDLONXFXKFAS-GFCCVEGCSA-N 1 2 243.297 2.141 20 0 BEADLO C[C@H]1CCC[C@H](C(=O)N2CCc3[nH]c[nH+]c3C2)C1 ZINC000646260689 388171741 /nfs/dbraw/zinc/17/17/41/388171741.db2.gz ZRTHBNPCXUZQTL-QWRGUYRKSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@H]1CCC[C@H](C(=O)N2CCc3[nH+]c[nH]c3C2)C1 ZINC000646260689 388171744 /nfs/dbraw/zinc/17/17/44/388171744.db2.gz ZRTHBNPCXUZQTL-QWRGUYRKSA-N 1 2 247.342 2.121 20 0 BEADLO COCc1cccc(C[NH2+]C(CF)CF)c1 ZINC000449380528 388188791 /nfs/dbraw/zinc/18/87/91/388188791.db2.gz NQZMFZIMJFPKQL-UHFFFAOYSA-N 1 2 229.270 2.230 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@@]1(C)CCC[C@@H]1C ZINC000456112424 388178648 /nfs/dbraw/zinc/17/86/48/388178648.db2.gz PNBRUPXWOASXRP-FZMZJTMJSA-N 1 2 249.358 2.346 20 0 BEADLO CCc1ncc(C[N@H+](C(C)C)C2COC2)s1 ZINC000449352725 388179946 /nfs/dbraw/zinc/17/99/46/388179946.db2.gz YDRRHIFMMKSFSS-UHFFFAOYSA-N 1 2 240.372 2.315 20 0 BEADLO CCc1ncc(C[N@@H+](C(C)C)C2COC2)s1 ZINC000449352725 388179947 /nfs/dbraw/zinc/17/99/47/388179947.db2.gz YDRRHIFMMKSFSS-UHFFFAOYSA-N 1 2 240.372 2.315 20 0 BEADLO CC[C@H]([NH2+]Cc1ccn(C)c1)C(F)F ZINC000449360975 388181274 /nfs/dbraw/zinc/18/12/74/388181274.db2.gz KDKOXNKAQZFHSP-VIFPVBQESA-N 1 2 202.248 2.158 20 0 BEADLO COC(=O)[C@H]([NH2+]C[C@H]1C[C@H]1C)c1ccccc1 ZINC000488509128 388183243 /nfs/dbraw/zinc/18/32/43/388183243.db2.gz CJMGKXWXJUEKFH-RAIGVLPGSA-N 1 2 233.311 2.146 20 0 BEADLO Cn1c[nH+]cc1CCC(=O)NC(C)(C)C1CCC1 ZINC000456172918 388183324 /nfs/dbraw/zinc/18/33/24/388183324.db2.gz SVKVUBYLFQXKPY-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CC[C@H](NCc1cccc2[nH+]ccn21)C(F)F ZINC000449366229 388183338 /nfs/dbraw/zinc/18/33/38/388183338.db2.gz YCVIWTQBJYKEFR-JTQLQIEISA-N 1 2 239.269 2.468 20 0 BEADLO COC(=O)[C@H]([NH2+]C[C@@H]1C[C@H]1C)c1ccccc1 ZINC000488509127 388183454 /nfs/dbraw/zinc/18/34/54/388183454.db2.gz CJMGKXWXJUEKFH-KGYLQXTDSA-N 1 2 233.311 2.146 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000448937797 388121208 /nfs/dbraw/zinc/12/12/08/388121208.db2.gz RJRHQAVLEDSKCO-GHMZBOCLSA-N 1 2 235.331 2.194 20 0 BEADLO COc1ccccc1C1([NH2+]Cc2ccon2)CC1 ZINC000646000244 388122403 /nfs/dbraw/zinc/12/24/03/388122403.db2.gz CQUHCIZIJMLQKL-UHFFFAOYSA-N 1 2 244.294 2.462 20 0 BEADLO C[N@H+](CCC(C)(C)C)Cc1csnn1 ZINC000646029053 388129263 /nfs/dbraw/zinc/12/92/63/388129263.db2.gz YOMFANCXBPZWHY-UHFFFAOYSA-N 1 2 213.350 2.406 20 0 BEADLO C[N@@H+](CCC(C)(C)C)Cc1csnn1 ZINC000646029053 388129264 /nfs/dbraw/zinc/12/92/64/388129264.db2.gz YOMFANCXBPZWHY-UHFFFAOYSA-N 1 2 213.350 2.406 20 0 BEADLO COc1cc(C)ccc1C[N@@H+]1CCN(C)C[C@@H]1C ZINC000449034801 388132741 /nfs/dbraw/zinc/13/27/41/388132741.db2.gz KZMQNWUEGNOYSR-ZDUSSCGKSA-N 1 2 248.370 2.140 20 0 BEADLO COc1cc(C)ccc1C[N@H+]1CCN(C)C[C@@H]1C ZINC000449034801 388132743 /nfs/dbraw/zinc/13/27/43/388132743.db2.gz KZMQNWUEGNOYSR-ZDUSSCGKSA-N 1 2 248.370 2.140 20 0 BEADLO CC[C@@H]([NH2+]Cc1cnn[nH]1)c1csc(C)c1 ZINC000646126877 388148260 /nfs/dbraw/zinc/14/82/60/388148260.db2.gz GEVFSXTYPPSQEY-LLVKDONJSA-N 1 2 236.344 2.416 20 0 BEADLO CC[C@@H]([NH2+]Cc1c[nH]nn1)c1csc(C)c1 ZINC000646126877 388148262 /nfs/dbraw/zinc/14/82/62/388148262.db2.gz GEVFSXTYPPSQEY-LLVKDONJSA-N 1 2 236.344 2.416 20 0 BEADLO CC[C@@H]([NH2+]Cc1cn[nH]n1)c1csc(C)c1 ZINC000646126877 388148265 /nfs/dbraw/zinc/14/82/65/388148265.db2.gz GEVFSXTYPPSQEY-LLVKDONJSA-N 1 2 236.344 2.416 20 0 BEADLO CCCC[C@H](COC)[NH2+][C@@H](C)C(=O)OC(C)C ZINC000449662663 388250796 /nfs/dbraw/zinc/25/07/96/388250796.db2.gz MLTHAVZYCJTVRS-NWDGAFQWSA-N 1 2 245.363 2.121 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2cccnc2)n[nH]1 ZINC000065288495 388255692 /nfs/dbraw/zinc/25/56/92/388255692.db2.gz MBFWEDYPTWGKCU-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2cccnc2)n[nH]1 ZINC000065288495 388255695 /nfs/dbraw/zinc/25/56/95/388255695.db2.gz MBFWEDYPTWGKCU-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@@H](F)C2)c(OC)c1 ZINC000449384266 388190199 /nfs/dbraw/zinc/19/01/99/388190199.db2.gz AQWLQVLUUDQULW-LLVKDONJSA-N 1 2 239.290 2.248 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@@H](F)C2)c(OC)c1 ZINC000449384266 388190203 /nfs/dbraw/zinc/19/02/03/388190203.db2.gz AQWLQVLUUDQULW-LLVKDONJSA-N 1 2 239.290 2.248 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)[C@@H](C)C1CC1 ZINC000456340645 388195684 /nfs/dbraw/zinc/19/56/84/388195684.db2.gz CRIFZCAYVYYOMK-VHSXEESVSA-N 1 2 235.331 2.126 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)C[C@@H]1C[C@@H]1C ZINC000456350475 388196284 /nfs/dbraw/zinc/19/62/84/388196284.db2.gz KBUQQABCTHJMNO-DCAQKATOSA-N 1 2 235.331 2.126 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)[C@@H]1CC1(C)C ZINC000456361232 388196310 /nfs/dbraw/zinc/19/63/10/388196310.db2.gz RWDLRXHRUSXPLX-ZJUUUORDSA-N 1 2 235.331 2.126 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@H]1C[C@@H]1C(C)C ZINC000456349810 388196442 /nfs/dbraw/zinc/19/64/42/388196442.db2.gz JMLDFPAHMXXGPT-TUAOUCFPSA-N 1 2 249.358 2.372 20 0 BEADLO CC(C)CCC(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456355611 388196586 /nfs/dbraw/zinc/19/65/86/388196586.db2.gz ATQIIZANFIMPBR-QWRGUYRKSA-N 1 2 235.331 2.441 20 0 BEADLO CC(C)CCC(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456355613 388196754 /nfs/dbraw/zinc/19/67/54/388196754.db2.gz ATQIIZANFIMPBR-WDEREUQCSA-N 1 2 235.331 2.441 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)CC1(C)CC1 ZINC000456348962 388196939 /nfs/dbraw/zinc/19/69/39/388196939.db2.gz IVOLGKDICCMJFP-SNVBAGLBSA-N 1 2 235.331 2.270 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@H]1C[C@@H]1C1CC1 ZINC000456356443 388197086 /nfs/dbraw/zinc/19/70/86/388197086.db2.gz OVYHROFOJNUUIO-WCQGTBRESA-N 1 2 247.342 2.126 20 0 BEADLO CCC(CC)C(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456362318 388197327 /nfs/dbraw/zinc/19/73/27/388197327.db2.gz DXBJPEAJODJZCT-KOLCDFICSA-N 1 2 235.331 2.441 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)C[C@@H]2C=CCC2)c2[nH+]ccn21 ZINC000456372333 388197778 /nfs/dbraw/zinc/19/77/78/388197778.db2.gz IUUNZPRFNGUZTD-IJLUTSLNSA-N 1 2 245.326 2.361 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)C[C@H]2C=CCC2)c2[nH+]ccn21 ZINC000456372335 388197811 /nfs/dbraw/zinc/19/78/11/388197811.db2.gz IUUNZPRFNGUZTD-WOPDTQHZSA-N 1 2 245.326 2.361 20 0 BEADLO CC(C)[C@H](C)C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456409270 388199252 /nfs/dbraw/zinc/19/92/52/388199252.db2.gz ZNATZOKCEXXILA-GARJFASQSA-N 1 2 235.331 2.297 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)[C@H]2CC=CCC2)c2[nH+]ccn21 ZINC000456408592 388199297 /nfs/dbraw/zinc/19/92/97/388199297.db2.gz ZEPBFELIRXKVRA-GRYCIOLGSA-N 1 2 245.326 2.361 20 0 BEADLO CC[C@@H](C)C(=O)N[C@H](C)c1[nH+]ccn1CC ZINC000456404012 388199384 /nfs/dbraw/zinc/19/93/84/388199384.db2.gz WYOXHLWCOPASFL-NXEZZACHSA-N 1 2 223.320 2.126 20 0 BEADLO CC[C@]1(C)C[C@@H]1C(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456419148 388200543 /nfs/dbraw/zinc/20/05/43/388200543.db2.gz LMMCJPJLDJYPCY-BBGACYKPSA-N 1 2 247.342 2.441 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)N[C@H]2C[C@H](C)n3cc[nH+]c32)C1 ZINC000456437197 388200950 /nfs/dbraw/zinc/20/09/50/388200950.db2.gz WVLSDEDTCNZLJM-RHYQMDGZSA-N 1 2 247.342 2.441 20 0 BEADLO C[C@@H]1C[C@@H]1CC(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456431509 388201141 /nfs/dbraw/zinc/20/11/41/388201141.db2.gz SOAXCVLHSMQMPP-GWOFURMSSA-N 1 2 233.315 2.051 20 0 BEADLO CC[N@H+](Cc1cccc(F)c1F)C1COC1 ZINC000449423127 388202027 /nfs/dbraw/zinc/20/20/27/388202027.db2.gz GMETXJNPLFYJRV-UHFFFAOYSA-N 1 2 227.254 2.186 20 0 BEADLO CC[N@@H+](Cc1cccc(F)c1F)C1COC1 ZINC000449423127 388202028 /nfs/dbraw/zinc/20/20/28/388202028.db2.gz GMETXJNPLFYJRV-UHFFFAOYSA-N 1 2 227.254 2.186 20 0 BEADLO CC[C@@H](NC(=O)CCc1[nH]cc[nH+]1)C1CCCC1 ZINC000456665162 388214241 /nfs/dbraw/zinc/21/42/41/388214241.db2.gz RUMFODGJFQMHLE-GFCCVEGCSA-N 1 2 249.358 2.427 20 0 BEADLO Cc1cc(C)c(CNC(=O)[C@H](C)C2CC2)c[nH+]1 ZINC000456852853 388228370 /nfs/dbraw/zinc/22/83/70/388228370.db2.gz XLCOULSUIHPCGA-LLVKDONJSA-N 1 2 232.327 2.361 20 0 BEADLO CN(c1cc[nH+]c(C2CC2)n1)[C@@H]1CCCC[C@H]1O ZINC000490008523 388230795 /nfs/dbraw/zinc/23/07/95/388230795.db2.gz DQGAACGMFKRQAG-VXGBXAGGSA-N 1 2 247.342 2.094 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2CC[C@H]3C[C@H]3C2)cc[nH+]1 ZINC000646328568 388233689 /nfs/dbraw/zinc/23/36/89/388233689.db2.gz MLONNAGUDOFJEF-SDDRHHMPSA-N 1 2 245.326 2.122 20 0 BEADLO C[C@@H](CNC(=O)/C=C\C(C)(C)C)Cn1cc[nH+]c1 ZINC000492038660 388332423 /nfs/dbraw/zinc/33/24/23/388332423.db2.gz HGNIXQVJDVBNOW-FJOGCWAESA-N 1 2 249.358 2.238 20 0 BEADLO CC[C@H]1CCN(C(=O)/C=C\c2[nH+]ccn2CC)C1 ZINC000492411047 388343758 /nfs/dbraw/zinc/34/37/58/388343758.db2.gz SCKXQCWOUVGURC-FJOGCWAESA-N 1 2 247.342 2.175 20 0 BEADLO CC[C@@H](C)CN(C)c1nc[nH+]c(N)c1Cl ZINC000233850830 388349662 /nfs/dbraw/zinc/34/96/62/388349662.db2.gz RZZLVYLIQDTCBO-SSDOTTSWSA-N 1 2 228.727 2.195 20 0 BEADLO CC[C@@H](C)CN(C)c1[nH+]cnc(N)c1Cl ZINC000233850830 388349665 /nfs/dbraw/zinc/34/96/65/388349665.db2.gz RZZLVYLIQDTCBO-SSDOTTSWSA-N 1 2 228.727 2.195 20 0 BEADLO C[C@@H](NCc1cn2ccccc2[nH+]1)C(F)(F)F ZINC000277236207 388353280 /nfs/dbraw/zinc/35/32/80/388353280.db2.gz PELAOVKPAKTREO-MRVPVSSYSA-N 1 2 243.232 2.375 20 0 BEADLO COc1ccc2[nH+]c(NCCCO)ccc2c1 ZINC000193523023 388366465 /nfs/dbraw/zinc/36/64/65/388366465.db2.gz IWDCAQUWIJLUKE-UHFFFAOYSA-N 1 2 232.283 2.038 20 0 BEADLO CN(c1nc[nH+]c(N)c1Cl)C1CCCCC1 ZINC000227840522 388371851 /nfs/dbraw/zinc/37/18/51/388371851.db2.gz GAEIAPLIGUQQQN-UHFFFAOYSA-N 1 2 240.738 2.481 20 0 BEADLO CN(c1[nH+]cnc(N)c1Cl)C1CCCCC1 ZINC000227840522 388371854 /nfs/dbraw/zinc/37/18/54/388371854.db2.gz GAEIAPLIGUQQQN-UHFFFAOYSA-N 1 2 240.738 2.481 20 0 BEADLO Cn1ccc(C[NH2+]CC(F)(F)C(F)F)c1 ZINC000236077451 388377409 /nfs/dbraw/zinc/37/74/09/388377409.db2.gz AAGDMDHKNPOONJ-UHFFFAOYSA-N 1 2 224.201 2.015 20 0 BEADLO CCc1cc(C[NH2+]Cc2ccc(C)o2)on1 ZINC000164378680 388377591 /nfs/dbraw/zinc/37/75/91/388377591.db2.gz LVFLIRHNLYJFLG-UHFFFAOYSA-N 1 2 220.272 2.428 20 0 BEADLO C[NH2+]Cc1noc([C@H]2C[C@@H]2c2ccccc2)n1 ZINC000164563512 388380828 /nfs/dbraw/zinc/38/08/28/388380828.db2.gz LXHNIMOQDUNLAV-MNOVXSKESA-N 1 2 229.283 2.060 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CCCC[C@H]1C)c1[nH]cc[nH+]1 ZINC000572854952 388381661 /nfs/dbraw/zinc/38/16/61/388381661.db2.gz SBAJCIIQILXPBK-GMTAPVOTSA-N 1 2 235.331 2.413 20 0 BEADLO C[C@@H](CC(=O)NCC1CCCC1)n1cc[nH+]c1 ZINC000572885605 388384361 /nfs/dbraw/zinc/38/43/61/388384361.db2.gz GYZLYEAABJWHKP-NSHDSACASA-N 1 2 235.331 2.141 20 0 BEADLO CC[C@H]([NH3+])C(=O)N[C@H](C)c1cc(C)cc(C)c1 ZINC000236939135 388386446 /nfs/dbraw/zinc/38/64/46/388386446.db2.gz UATXKMYHVDCYHA-YPMHNXCESA-N 1 2 234.343 2.218 20 0 BEADLO CC[C@H]([NH3+])C(=O)N[C@@H]1CCC[C@@H]1CCC(C)C ZINC000236933715 388386531 /nfs/dbraw/zinc/38/65/31/388386531.db2.gz BJFPJMBDDOXXSU-FRRDWIJNSA-N 1 2 240.391 2.445 20 0 BEADLO Cc1cnc(C[NH2+]Cc2ccccn2)s1 ZINC000164843585 388387176 /nfs/dbraw/zinc/38/71/76/388387176.db2.gz KVKRLAQZGDBGQR-UHFFFAOYSA-N 1 2 219.313 2.136 20 0 BEADLO CC(C)(C(=O)NCC1CCCCC1)c1c[nH]c[nH+]1 ZINC000646578515 388389101 /nfs/dbraw/zinc/38/91/01/388389101.db2.gz ZLADAAUTYBPFPO-UHFFFAOYSA-N 1 2 249.358 2.384 20 0 BEADLO Cn1cc(Cl)c(C[NH2+]Cc2cccs2)n1 ZINC000393374887 388401096 /nfs/dbraw/zinc/40/10/96/388401096.db2.gz RJCXBEZVSFXGQB-UHFFFAOYSA-N 1 2 241.747 2.425 20 0 BEADLO Cc1cccc([C@H](C)[N@@H+]2CCn3nncc3C2)c1 ZINC000572972221 388401354 /nfs/dbraw/zinc/40/13/54/388401354.db2.gz RWGOETORGCMOPQ-LBPRGKRZSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1cccc([C@H](C)[N@H+]2CCn3nncc3C2)c1 ZINC000572972221 388401356 /nfs/dbraw/zinc/40/13/56/388401356.db2.gz RWGOETORGCMOPQ-LBPRGKRZSA-N 1 2 242.326 2.163 20 0 BEADLO C/C=C(/C=C\C(=O)N(C)Cc1[nH]cc[nH+]1)CC ZINC000492152085 388336657 /nfs/dbraw/zinc/33/66/57/388336657.db2.gz BWJPCFHSKAYVAH-BJNIYONUSA-N 1 2 233.315 2.281 20 0 BEADLO C/C=C(/C=C/C(=O)NC1=[NH+]CCS1)CC ZINC000492171474 388337249 /nfs/dbraw/zinc/33/72/49/388337249.db2.gz SBPZBTQTZUXDKS-XPVIYQEVSA-N 1 2 224.329 2.118 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N[C@@H]1CCC[C@@H]1C ZINC000492274551 388340105 /nfs/dbraw/zinc/34/01/05/388340105.db2.gz JQVBOTGJCRXPPS-FUMJMOHISA-N 1 2 247.342 2.221 20 0 BEADLO CCCC[C@@H]([NH2+]C[C@@](C)(CC)OC)C(=O)OC ZINC000322616366 388440825 /nfs/dbraw/zinc/44/08/25/388440825.db2.gz MHXXDHJCFJXVTB-DGCLKSJQSA-N 1 2 245.363 2.123 20 0 BEADLO CC(C)([NH2+]Cc1cnns1)c1nccs1 ZINC000330363411 388443750 /nfs/dbraw/zinc/44/37/50/388443750.db2.gz BWKDVMLRNVJGTL-UHFFFAOYSA-N 1 2 240.357 2.020 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)CC[C@@H]1CCOC1 ZINC000176025471 388449509 /nfs/dbraw/zinc/44/95/09/388449509.db2.gz KBPSATLPNLQYLN-LLVKDONJSA-N 1 2 234.299 2.145 20 0 BEADLO C/C(Cl)=C\C[NH+]1CCN(CC(F)F)CC1 ZINC000528367502 388451421 /nfs/dbraw/zinc/45/14/21/388451421.db2.gz RECYYALNVJULGM-XNWCZRBMSA-N 1 2 238.709 2.012 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1ncncc1Cl ZINC000176310085 388451442 /nfs/dbraw/zinc/45/14/42/388451442.db2.gz VKIZPSMSDLQJBA-UHFFFAOYSA-N 1 2 248.673 2.086 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)[C@@H]1C[C@H]1C1CC1 ZINC000176707583 388458820 /nfs/dbraw/zinc/45/88/20/388458820.db2.gz VVOCIMXEJRMQBO-WDEREUQCSA-N 1 2 245.326 2.132 20 0 BEADLO C[C@@H]1CCCN(C(=O)c2ccc3[nH+]ccn3c2)C1 ZINC000068368566 388459568 /nfs/dbraw/zinc/45/95/68/388459568.db2.gz ADPPDYBVJTWMPG-LLVKDONJSA-N 1 2 243.310 2.206 20 0 BEADLO COCc1cnc(C[NH2+]Cc2ccco2)s1 ZINC000336655812 388459688 /nfs/dbraw/zinc/45/96/88/388459688.db2.gz AECDCPLDPQBAKI-UHFFFAOYSA-N 1 2 238.312 2.172 20 0 BEADLO c1nc(NC2CC2)cc(NC2CCCC2)[nH+]1 ZINC000243502710 388481462 /nfs/dbraw/zinc/48/14/62/388481462.db2.gz NWILHJHNIXZKGO-UHFFFAOYSA-N 1 2 218.304 2.405 20 0 BEADLO c1nc(NC2CCCC2)cc(NC2CC2)[nH+]1 ZINC000243502710 388481464 /nfs/dbraw/zinc/48/14/64/388481464.db2.gz NWILHJHNIXZKGO-UHFFFAOYSA-N 1 2 218.304 2.405 20 0 BEADLO CC[C@H](C)Nc1cc(NC2CC2)nc[nH+]1 ZINC000243011325 388476555 /nfs/dbraw/zinc/47/65/55/388476555.db2.gz HWDBABXTPCPCEP-QMMMGPOBSA-N 1 2 206.293 2.261 20 0 BEADLO CC[C@H](C)Nc1cc(NC2CC2)[nH+]cn1 ZINC000243011325 388476557 /nfs/dbraw/zinc/47/65/57/388476557.db2.gz HWDBABXTPCPCEP-QMMMGPOBSA-N 1 2 206.293 2.261 20 0 BEADLO Cc1noc([C@@H](C)[N@H+](C)CCC(F)(F)F)n1 ZINC000573031697 388409020 /nfs/dbraw/zinc/40/90/20/388409020.db2.gz ROBVIYVOQKUOLY-ZCFIWIBFSA-N 1 2 237.225 2.323 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+](C)CCC(F)(F)F)n1 ZINC000573031697 388409022 /nfs/dbraw/zinc/40/90/22/388409022.db2.gz ROBVIYVOQKUOLY-ZCFIWIBFSA-N 1 2 237.225 2.323 20 0 BEADLO CC[C@H](CC(C)C)C(=O)NCc1[nH]c[nH+]c1C ZINC000308086340 388431193 /nfs/dbraw/zinc/43/11/93/388431193.db2.gz ILNBXDBBNRFMQU-LLVKDONJSA-N 1 2 237.347 2.407 20 0 BEADLO COCC1(C)C[NH+](Cc2cccc(F)c2F)C1 ZINC000573210988 388432232 /nfs/dbraw/zinc/43/22/32/388432232.db2.gz UEXIRBMDOGZTJY-UHFFFAOYSA-N 1 2 241.281 2.433 20 0 BEADLO O=C(C[C@@H]1C=CCCC1)N1CC(n2cc[nH+]c2)C1 ZINC000548634530 388550459 /nfs/dbraw/zinc/55/04/59/388550459.db2.gz IUSSLIKYIHJGBX-GFCCVEGCSA-N 1 2 245.326 2.013 20 0 BEADLO C[C@H](CC(=O)N1CCCC[C@@H]1C)n1cc[nH+]c1 ZINC000517154936 388539263 /nfs/dbraw/zinc/53/92/63/388539263.db2.gz TZLJGLHLTAXVAP-NWDGAFQWSA-N 1 2 235.331 2.235 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1CC[S@@](=O)C(C)(C)CC1 ZINC000528520202 388540884 /nfs/dbraw/zinc/54/08/84/388540884.db2.gz PKTGNRHAMNONKB-GSDOMDMQSA-N 1 2 249.807 2.362 20 0 BEADLO C/C(Cl)=C\C[N@H+]1CC[S@@](=O)C(C)(C)CC1 ZINC000528520202 388540886 /nfs/dbraw/zinc/54/08/86/388540886.db2.gz PKTGNRHAMNONKB-GSDOMDMQSA-N 1 2 249.807 2.362 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2[C@@H](C)[C@@H]2C2CC2)cc[nH+]1 ZINC000528533346 388544157 /nfs/dbraw/zinc/54/41/57/388544157.db2.gz JHFQRZNXLDPORT-ZWKOPEQDSA-N 1 2 230.311 2.043 20 0 BEADLO C/C(Cl)=C/C[NH2+][C@@H](C)c1csnn1 ZINC000528529348 388544168 /nfs/dbraw/zinc/54/41/68/388544168.db2.gz ZYGGHKSKEVSLOP-NFNQMPKISA-N 1 2 217.725 2.331 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H](C)c1cccc(O)c1 ZINC000517247832 388545542 /nfs/dbraw/zinc/54/55/42/388545542.db2.gz VVULKKVUWFTDHW-SNVBAGLBSA-N 1 2 243.310 2.394 20 0 BEADLO c1ccc(CNc2cc(NC3CC3)[nH+]cn2)nc1 ZINC000244018105 388486182 /nfs/dbraw/zinc/48/61/82/388486182.db2.gz SOVVANOAWZYJDS-UHFFFAOYSA-N 1 2 241.298 2.058 20 0 BEADLO c1ccc(CNc2cc(NC3CC3)nc[nH+]2)nc1 ZINC000244018105 388486186 /nfs/dbraw/zinc/48/61/86/388486186.db2.gz SOVVANOAWZYJDS-UHFFFAOYSA-N 1 2 241.298 2.058 20 0 BEADLO CO[C@H](C)c1noc(C[N@@H+]2CCC(C)(C)C2)n1 ZINC000175281671 388495142 /nfs/dbraw/zinc/49/51/42/388495142.db2.gz XGHYMCJKSBKRCT-SECBINFHSA-N 1 2 239.319 2.009 20 0 BEADLO CO[C@H](C)c1noc(C[N@H+]2CCC(C)(C)C2)n1 ZINC000175281671 388495144 /nfs/dbraw/zinc/49/51/44/388495144.db2.gz XGHYMCJKSBKRCT-SECBINFHSA-N 1 2 239.319 2.009 20 0 BEADLO CCO[C@H](C)c1noc(C[N@H+]2[C@H](C)C[C@@H]2C)n1 ZINC000548096223 388510470 /nfs/dbraw/zinc/51/04/70/388510470.db2.gz IRXCMXUIRFZVQC-KXUCPTDWSA-N 1 2 239.319 2.150 20 0 BEADLO CCO[C@H](C)c1noc(C[N@@H+]2[C@H](C)C[C@@H]2C)n1 ZINC000548096223 388510472 /nfs/dbraw/zinc/51/04/72/388510472.db2.gz IRXCMXUIRFZVQC-KXUCPTDWSA-N 1 2 239.319 2.150 20 0 BEADLO COC(=O)[C@H](c1ccccc1)[NH+]1[C@@H](C)C[C@@H]1C ZINC000548097105 388510737 /nfs/dbraw/zinc/51/07/37/388510737.db2.gz GDCPVRIVLAAYHA-GVXVVHGQSA-N 1 2 233.311 2.383 20 0 BEADLO Cc1cc(NC(=O)[C@H]2C[C@@H]2C(C)C)c(C)c[nH+]1 ZINC000548192485 388520504 /nfs/dbraw/zinc/52/05/04/388520504.db2.gz ZPMKVVOTLNHBID-NEPJUHHUSA-N 1 2 232.327 2.351 20 0 BEADLO C/C(Cl)=C\C[N@H+]1CCO[C@H](C)[C@@H]1C ZINC000528404845 388521174 /nfs/dbraw/zinc/52/11/74/388521174.db2.gz OCWQMYIRGNMTGE-GNKRQNHBSA-N 1 2 203.713 2.238 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1CCO[C@H](C)[C@@H]1C ZINC000528404845 388521177 /nfs/dbraw/zinc/52/11/77/388521177.db2.gz OCWQMYIRGNMTGE-GNKRQNHBSA-N 1 2 203.713 2.238 20 0 BEADLO C[C@H](O)[C@H](C)SCc1cn2ccccc2[nH+]1 ZINC000079039991 388522494 /nfs/dbraw/zinc/52/24/94/388522494.db2.gz SPWLZJXOCODYPQ-UWVGGRQHSA-N 1 2 236.340 2.337 20 0 BEADLO Cc1[nH]c(CNCc2ccsc2)[nH+]c1C ZINC000516878655 388522538 /nfs/dbraw/zinc/52/25/38/388522538.db2.gz RXTQGPZQRPFMLW-UHFFFAOYSA-N 1 2 221.329 2.378 20 0 BEADLO CCCN1CCC[N@H+](C/C=C(\C)Cl)CC1=O ZINC000528472243 388531477 /nfs/dbraw/zinc/53/14/77/388531477.db2.gz KSTWKWZLNGXODS-VZUCSPMQSA-N 1 2 244.766 2.073 20 0 BEADLO CCCN1CCC[N@@H+](C/C=C(\C)Cl)CC1=O ZINC000528472243 388531479 /nfs/dbraw/zinc/53/14/79/388531479.db2.gz KSTWKWZLNGXODS-VZUCSPMQSA-N 1 2 244.766 2.073 20 0 BEADLO Cc1cnccc1C[N@@H+]1Cc2cccnc2C1 ZINC000528496826 388534786 /nfs/dbraw/zinc/53/47/86/388534786.db2.gz OUDKXSUZDMGBTJ-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO Cc1cnccc1C[N@H+]1Cc2cccnc2C1 ZINC000528496826 388534787 /nfs/dbraw/zinc/53/47/87/388534787.db2.gz OUDKXSUZDMGBTJ-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1CCOC[C@@H]1CC(F)F ZINC000528502934 388536527 /nfs/dbraw/zinc/53/65/27/388536527.db2.gz JJQVPSRBQGCNDF-JWNFGPPVSA-N 1 2 239.693 2.485 20 0 BEADLO C/C(Cl)=C/C[N@H+]1CCOC[C@@H]1CC(F)F ZINC000528502934 388536530 /nfs/dbraw/zinc/53/65/30/388536530.db2.gz JJQVPSRBQGCNDF-JWNFGPPVSA-N 1 2 239.693 2.485 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1CCOC[C@H]1CC(F)F ZINC000528502932 388536943 /nfs/dbraw/zinc/53/69/43/388536943.db2.gz JJQVPSRBQGCNDF-GNJCPQTGSA-N 1 2 239.693 2.485 20 0 BEADLO C/C(Cl)=C/C[N@H+]1CCOC[C@H]1CC(F)F ZINC000528502932 388536945 /nfs/dbraw/zinc/53/69/45/388536945.db2.gz JJQVPSRBQGCNDF-GNJCPQTGSA-N 1 2 239.693 2.485 20 0 BEADLO CC(C)[C@@H](NC(=O)C1CC(C)C1)c1[nH]cc[nH+]1 ZINC000549751593 388589854 /nfs/dbraw/zinc/58/98/54/388589854.db2.gz AUXGIXZREMPLAO-VQXHTEKXSA-N 1 2 235.331 2.269 20 0 BEADLO O[C@@H](CC1CCCC1)C[N@@H+]1Cc2cccnc2C1 ZINC000550653400 388612410 /nfs/dbraw/zinc/61/24/10/388612410.db2.gz BOFFYTLYLJMFHI-AWEZNQCLSA-N 1 2 246.354 2.338 20 0 BEADLO O[C@@H](CC1CCCC1)C[N@H+]1Cc2cccnc2C1 ZINC000550653400 388612411 /nfs/dbraw/zinc/61/24/11/388612411.db2.gz BOFFYTLYLJMFHI-AWEZNQCLSA-N 1 2 246.354 2.338 20 0 BEADLO CC(C)=CC[N@@H+]1CC2CC1(c1nc(C)no1)C2 ZINC000528618384 388552828 /nfs/dbraw/zinc/55/28/28/388552828.db2.gz SZELVUPJYKLZFO-UHFFFAOYSA-N 1 2 233.315 2.265 20 0 BEADLO CC(C)=CC[N@H+]1CC2CC1(c1nc(C)no1)C2 ZINC000528618384 388552830 /nfs/dbraw/zinc/55/28/30/388552830.db2.gz SZELVUPJYKLZFO-UHFFFAOYSA-N 1 2 233.315 2.265 20 0 BEADLO c1nc(C[NH2+][C@H](c2ccccn2)C2CCC2)c[nH]1 ZINC000528656762 388555832 /nfs/dbraw/zinc/55/58/32/388555832.db2.gz HHPWRSSPVYBUKT-AWEZNQCLSA-N 1 2 242.326 2.436 20 0 BEADLO CO[C@@]1(C)C[C@H](N(C)c2cc[nH+]c(C)n2)C1(C)C ZINC000246075613 388615691 /nfs/dbraw/zinc/61/56/91/388615691.db2.gz JOJQOOIWPMBIRE-FZMZJTMJSA-N 1 2 249.358 2.425 20 0 BEADLO Cc1cnc(C[N@@H+]2CC[C@H](OC(F)F)C2)s1 ZINC000549082440 388572378 /nfs/dbraw/zinc/57/23/78/388572378.db2.gz RQFILRHHRRLKHV-QMMMGPOBSA-N 1 2 248.298 2.265 20 0 BEADLO Cc1cnc(C[N@H+]2CC[C@H](OC(F)F)C2)s1 ZINC000549082440 388572381 /nfs/dbraw/zinc/57/23/81/388572381.db2.gz RQFILRHHRRLKHV-QMMMGPOBSA-N 1 2 248.298 2.265 20 0 BEADLO C[C@H]([NH2+]Cc1ccno1)c1ncccc1F ZINC000528825211 388576673 /nfs/dbraw/zinc/57/66/73/388576673.db2.gz PTIIATUDEIKMQZ-QMMMGPOBSA-N 1 2 221.235 2.060 20 0 BEADLO C[C@@H](CC(=O)N[C@@H]1CC12CCCC2)n1cc[nH+]c1 ZINC000521055103 256834434 /nfs/dbraw/zinc/83/44/34/256834434.db2.gz WFBOPMUHWGFGOU-NWDGAFQWSA-N 1 2 247.342 2.283 20 0 BEADLO CCC[C@@H](C)[N@@H+]1CCC(C)(C)S(=O)(=O)CC1 ZINC000192850226 388686690 /nfs/dbraw/zinc/68/66/90/388686690.db2.gz BCBYAVROVJPQRW-LLVKDONJSA-N 1 2 247.404 2.074 20 0 BEADLO CCC[C@@H](C)[N@H+]1CCC(C)(C)S(=O)(=O)CC1 ZINC000192850226 388686692 /nfs/dbraw/zinc/68/66/92/388686692.db2.gz BCBYAVROVJPQRW-LLVKDONJSA-N 1 2 247.404 2.074 20 0 BEADLO C[C@@H](C1CC1)n1cc(NCc2c[nH+]cn2C)cn1 ZINC000189242026 388627709 /nfs/dbraw/zinc/62/77/09/388627709.db2.gz IFDLRLSCYUXQLE-JTQLQIEISA-N 1 2 245.330 2.200 20 0 BEADLO COC(=O)[C@@H](c1cccnc1)[N@@H+]1CCC[C@@H](C)C1 ZINC000246406772 388635694 /nfs/dbraw/zinc/63/56/94/388635694.db2.gz KOYMGDWDHNZTHE-DGCLKSJQSA-N 1 2 248.326 2.028 20 0 BEADLO COC(=O)[C@@H](c1cccnc1)[N@H+]1CCC[C@@H](C)C1 ZINC000246406772 388635696 /nfs/dbraw/zinc/63/56/96/388635696.db2.gz KOYMGDWDHNZTHE-DGCLKSJQSA-N 1 2 248.326 2.028 20 0 BEADLO O=C(CCCn1cc[nH+]c1)NC1CCCCC1 ZINC000620409430 388646628 /nfs/dbraw/zinc/64/66/28/388646628.db2.gz KBERLALQIJCDAZ-UHFFFAOYSA-N 1 2 235.331 2.112 20 0 BEADLO O=C(CCCn1cc[nH+]c1)NCc1cccs1 ZINC000620409610 388646974 /nfs/dbraw/zinc/64/69/74/388646974.db2.gz CKHJMMGUJCRTIX-UHFFFAOYSA-N 1 2 249.339 2.041 20 0 BEADLO Cc1nc(N2CCCSCC2)c(C)c(C)[nH+]1 ZINC000301671453 388663814 /nfs/dbraw/zinc/66/38/14/388663814.db2.gz FNXKFZLEUPQOPP-UHFFFAOYSA-N 1 2 237.372 2.345 20 0 BEADLO CCC[C@@H]([NH2+][C@@H](C)CSC)C(=O)OCC ZINC000128047430 388737301 /nfs/dbraw/zinc/73/73/01/388737301.db2.gz YPAJEHPQQSIEJP-VHSXEESVSA-N 1 2 233.377 2.059 20 0 BEADLO COc1cc[nH+]cc1NC(=O)Cc1ccsc1 ZINC000194735724 388742469 /nfs/dbraw/zinc/74/24/69/388742469.db2.gz BEFAYPHIKRLVKB-UHFFFAOYSA-N 1 2 248.307 2.333 20 0 BEADLO CCC(CC)[C@@H](O)CNc1cccc[nH+]1 ZINC000225745827 388689349 /nfs/dbraw/zinc/68/93/49/388689349.db2.gz QLUDUQFFAZXNHP-NSHDSACASA-N 1 2 208.305 2.291 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@@H]2CCCCO2)cs1 ZINC000065300654 388689669 /nfs/dbraw/zinc/68/96/69/388689669.db2.gz KLDFVCCMDWTQAC-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@@H]2CCCCO2)cs1 ZINC000065300654 388689672 /nfs/dbraw/zinc/68/96/72/388689672.db2.gz KLDFVCCMDWTQAC-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO CC[C@@H](C(=O)OC)[N@@H+]1CCc2sccc2C1 ZINC000193050870 388691416 /nfs/dbraw/zinc/69/14/16/388691416.db2.gz PXFKEBCSVVRHIK-JTQLQIEISA-N 1 2 239.340 2.058 20 0 BEADLO CC[C@@H](C(=O)OC)[N@H+]1CCc2sccc2C1 ZINC000193050870 388691419 /nfs/dbraw/zinc/69/14/19/388691419.db2.gz PXFKEBCSVVRHIK-JTQLQIEISA-N 1 2 239.340 2.058 20 0 BEADLO CC[C@]1(C)C[N@@H+]([C@H](C)c2cnccn2)CCO1 ZINC000248983974 388702012 /nfs/dbraw/zinc/70/20/12/388702012.db2.gz VYLOUJBCLOCHJX-DGCLKSJQSA-N 1 2 235.331 2.039 20 0 BEADLO CC[C@]1(C)C[N@H+]([C@H](C)c2cnccn2)CCO1 ZINC000248983974 388702015 /nfs/dbraw/zinc/70/20/15/388702015.db2.gz VYLOUJBCLOCHJX-DGCLKSJQSA-N 1 2 235.331 2.039 20 0 BEADLO CC[C@@H]1CN(C)CC[N@@H+]1Cc1cccc(F)c1 ZINC000552406867 388703761 /nfs/dbraw/zinc/70/37/61/388703761.db2.gz UIEHMSAVJUFQFK-CQSZACIVSA-N 1 2 236.334 2.352 20 0 BEADLO CC[C@@H]1CN(C)CC[N@H+]1Cc1cccc(F)c1 ZINC000552406867 388703763 /nfs/dbraw/zinc/70/37/63/388703763.db2.gz UIEHMSAVJUFQFK-CQSZACIVSA-N 1 2 236.334 2.352 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CCCCS2)cc[nH+]1 ZINC000336357494 177706051 /nfs/dbraw/zinc/70/60/51/177706051.db2.gz JJSZUNOIPFMVKP-LLVKDONJSA-N 1 2 236.340 2.036 20 0 BEADLO Cc1nc(C[NH2+][C@@H](C)c2cn[nH]c2)cs1 ZINC000229882070 388802824 /nfs/dbraw/zinc/80/28/24/388802824.db2.gz CXWHSJSJJWZMRU-ZETCQYMHSA-N 1 2 222.317 2.025 20 0 BEADLO CSCC[C@H](C)[N@H+](C)Cc1csnn1 ZINC000129022844 388811339 /nfs/dbraw/zinc/81/13/39/388811339.db2.gz DAUMYADDILHNBL-QMMMGPOBSA-N 1 2 231.390 2.112 20 0 BEADLO CSCC[C@H](C)[N@@H+](C)Cc1csnn1 ZINC000129022844 388811341 /nfs/dbraw/zinc/81/13/41/388811341.db2.gz DAUMYADDILHNBL-QMMMGPOBSA-N 1 2 231.390 2.112 20 0 BEADLO Cc1cc(N[C@H]2CCCOCC2)nc(C(C)C)[nH+]1 ZINC000336796273 177709602 /nfs/dbraw/zinc/70/96/02/177709602.db2.gz RCAPPAPVJNTUJF-LBPRGKRZSA-N 1 2 249.358 2.311 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccc(O)c2)ncn1 ZINC000564515136 388876847 /nfs/dbraw/zinc/87/68/47/388876847.db2.gz CYPYLRWAOMBXIX-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccc(O)c2)ncn1 ZINC000564515136 388876851 /nfs/dbraw/zinc/87/68/51/388876851.db2.gz CYPYLRWAOMBXIX-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO Oc1cccc(C[NH2+]Cc2cscn2)c1 ZINC000070167439 388877486 /nfs/dbraw/zinc/87/74/86/388877486.db2.gz HNWARUHRHFRLJD-UHFFFAOYSA-N 1 2 220.297 2.139 20 0 BEADLO Cc1nsc(C)c1C[N@H+](C1CC1)C1COC1 ZINC000565175690 388922108 /nfs/dbraw/zinc/92/21/08/388922108.db2.gz WTXSBBJYHZGZFG-UHFFFAOYSA-N 1 2 238.356 2.123 20 0 BEADLO Cc1nsc(C)c1C[N@@H+](C1CC1)C1COC1 ZINC000565175690 388922110 /nfs/dbraw/zinc/92/21/10/388922110.db2.gz WTXSBBJYHZGZFG-UHFFFAOYSA-N 1 2 238.356 2.123 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1CS[C@@H](C)C1 ZINC000565225202 388928864 /nfs/dbraw/zinc/92/88/64/388928864.db2.gz BYXNOMRCXHLPQX-WPRPVWTQSA-N 1 2 223.345 2.399 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1CS[C@H](C)C1 ZINC000565225200 388928878 /nfs/dbraw/zinc/92/88/78/388928878.db2.gz BYXNOMRCXHLPQX-SCZZXKLOSA-N 1 2 223.345 2.399 20 0 BEADLO Cc1ccc(CNc2nc(C)[nH+]cc2C)nc1C ZINC000565227257 388929973 /nfs/dbraw/zinc/92/99/73/388929973.db2.gz XEGTZVGWQNKXDQ-UHFFFAOYSA-N 1 2 242.326 2.139 20 0 BEADLO F[C@]1(c2ccccc2)C[C@H]1[NH2+]Cc1cnccn1 ZINC000565418272 388943554 /nfs/dbraw/zinc/94/35/54/388943554.db2.gz ODZMRCZQSYEZQO-KGLIPLIRSA-N 1 2 243.285 2.204 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1nccn1C(F)F ZINC000266188147 388995535 /nfs/dbraw/zinc/99/55/35/388995535.db2.gz HYTJXSGZRXTFHV-UHFFFAOYSA-N 1 2 241.241 2.469 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)CCC1CCCC1 ZINC000266965375 388998189 /nfs/dbraw/zinc/99/81/89/388998189.db2.gz JIOVDGXFCFVBOA-UHFFFAOYSA-N 1 2 235.331 2.305 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)CC1=CCCCC1 ZINC000267226553 388999760 /nfs/dbraw/zinc/99/97/60/388999760.db2.gz OTKMROSLEMVMHW-UHFFFAOYSA-N 1 2 233.315 2.225 20 0 BEADLO CC(C)c1cc(NCc2c[nH+]cn2C)no1 ZINC000272300235 389031432 /nfs/dbraw/zinc/03/14/32/389031432.db2.gz WMWAUPOPMRDDPI-UHFFFAOYSA-N 1 2 220.276 2.144 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H](C)c1ccccc1 ZINC000273248478 389038858 /nfs/dbraw/zinc/03/88/58/389038858.db2.gz RGGZTQYGCCWDFX-JTQLQIEISA-N 1 2 243.310 2.138 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]C/C=C/Cl)s1 ZINC000273593696 389042160 /nfs/dbraw/zinc/04/21/60/389042160.db2.gz JQPOECGMTJBLQE-YUDCMIJISA-N 1 2 217.725 2.250 20 0 BEADLO C[C@@H](C1CC1)N(C(=O)/C=C/c1[nH]cc[nH+]1)C1CC1 ZINC000493582706 533364031 /nfs/dbraw/zinc/36/40/31/533364031.db2.gz LCUALPLFILTQOK-FGEFZZPRSA-N 1 2 245.326 2.212 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCCc2nn(C)cc21)c1ccon1 ZINC000530518754 322823366 /nfs/dbraw/zinc/82/33/66/322823366.db2.gz WVQIBEFALBGEKJ-BXKDBHETSA-N 1 2 246.314 2.136 20 0 BEADLO C[C@@H](O)CCC[N@@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000494229613 533589986 /nfs/dbraw/zinc/58/99/86/533589986.db2.gz DNHBZKXOEJUNOS-NXEZZACHSA-N 1 2 221.291 2.125 20 0 BEADLO C[C@@H](O)CCC[N@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000494229613 533589989 /nfs/dbraw/zinc/58/99/89/533589989.db2.gz DNHBZKXOEJUNOS-NXEZZACHSA-N 1 2 221.291 2.125 20 0 BEADLO c1nc(N2CCCCC2)cc(NC2CCC2)[nH+]1 ZINC000264555912 132179041 /nfs/dbraw/zinc/17/90/41/132179041.db2.gz SSRGALABIKHLHQ-UHFFFAOYSA-N 1 2 232.331 2.431 20 0 BEADLO c1nc(NC2CCC2)cc(N2CCCCC2)[nH+]1 ZINC000264555912 132179043 /nfs/dbraw/zinc/17/90/43/132179043.db2.gz SSRGALABIKHLHQ-UHFFFAOYSA-N 1 2 232.331 2.431 20 0 BEADLO C[C@H]1CN(c2cc[nH+]c3ccncc32)C[C@H](C)O1 ZINC000267196075 132188640 /nfs/dbraw/zinc/18/86/40/132188640.db2.gz IHOCYCSZORLJLU-QWRGUYRKSA-N 1 2 243.310 2.243 20 0 BEADLO C[C@@H]1COc2ccccc2N1Cc1c[nH+]cn1C ZINC000267651404 132190731 /nfs/dbraw/zinc/19/07/31/132190731.db2.gz XQVIZOIRNKVKNL-LLVKDONJSA-N 1 2 243.310 2.208 20 0 BEADLO C[C@H]1OCCN(c2cc[nH+]c3ccncc32)[C@H]1C ZINC000268782818 132193054 /nfs/dbraw/zinc/19/30/54/132193054.db2.gz CQHKCARZCPKMEF-WDEREUQCSA-N 1 2 243.310 2.243 20 0 BEADLO Fc1cnc(N2CCCC[C@@H]2c2[nH]cc[nH+]2)nc1 ZINC000269465223 132194616 /nfs/dbraw/zinc/19/46/16/132194616.db2.gz IAQXJLHFTBIBFT-SNVBAGLBSA-N 1 2 247.277 2.070 20 0 BEADLO CC1([C@H]2CCCN(c3cccc[nH+]3)C2)OCCO1 ZINC000273022020 132201392 /nfs/dbraw/zinc/20/13/92/132201392.db2.gz CBFZVXBAVWLVEO-LBPRGKRZSA-N 1 2 248.326 2.061 20 0 BEADLO C[C@@H]1CN(c2cccc[nH+]2)C[C@H](C2CC2)O1 ZINC000280132575 132209896 /nfs/dbraw/zinc/20/98/96/132209896.db2.gz BFWVDCLDTOTPNB-ZYHUDNBSSA-N 1 2 218.300 2.085 20 0 BEADLO CCc1nc(N2CCO[C@H]3CCC[C@H]32)cc(C)[nH+]1 ZINC000287581019 132216108 /nfs/dbraw/zinc/21/61/08/132216108.db2.gz DNTCNSBJAVPHCQ-NEPJUHHUSA-N 1 2 247.342 2.105 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CCC[C@@H](F)C2)[nH+]1 ZINC000336324530 132246346 /nfs/dbraw/zinc/24/63/46/132246346.db2.gz VXXLIDKURRLTAP-SECBINFHSA-N 1 2 234.278 2.205 20 0 BEADLO CC1=C[C@@H](C)CN(c2cc[nH+]c(C)n2)C1 ZINC000336526221 132248329 /nfs/dbraw/zinc/24/83/29/132248329.db2.gz YHCCMSDZCSSSII-SECBINFHSA-N 1 2 203.289 2.187 20 0 BEADLO Cc1nc(N2CCC[C@H](F)C2)c(C)c(C)[nH+]1 ZINC000336571395 132248659 /nfs/dbraw/zinc/24/86/59/132248659.db2.gz WKQPPXOTUHSSGU-NSHDSACASA-N 1 2 223.295 2.340 20 0 BEADLO Cc1cc(N2C[C@H](C)CC[C@H]2C)nc[nH+]1 ZINC000301425134 132253482 /nfs/dbraw/zinc/25/34/82/132253482.db2.gz GNVIWIVTZKSGPL-MWLCHTKSSA-N 1 2 205.305 2.410 20 0 BEADLO COC(=O)CCC1CCN(c2cccc[nH+]2)CC1 ZINC000301556655 132254841 /nfs/dbraw/zinc/25/48/41/132254841.db2.gz IRUQTRONPWUMAC-UHFFFAOYSA-N 1 2 248.326 2.251 20 0 BEADLO Cc1cc(N2CCCC[C@@H]2c2[nH]cc[nH+]2)ncn1 ZINC000301565233 132255025 /nfs/dbraw/zinc/25/50/25/132255025.db2.gz LXUOFQCLWSAUCC-LLVKDONJSA-N 1 2 243.314 2.240 20 0 BEADLO c1ccc(N2CC[C@@H]3OCCC[C@H]3C2)[nH+]c1 ZINC000301731032 132256777 /nfs/dbraw/zinc/25/67/77/132256777.db2.gz SKZXBTOAAZCYIY-RYUDHWBXSA-N 1 2 218.300 2.087 20 0 BEADLO c1ccc(N2CCC([C@@H]3CCCO3)CC2)[nH+]c1 ZINC000302583324 132264708 /nfs/dbraw/zinc/26/47/08/132264708.db2.gz UMVPYQZHQLWSOS-ZDUSSCGKSA-N 1 2 232.327 2.477 20 0 BEADLO C[C@H]1N(c2cc[nH+]c(C3CC3)n2)CCOC1(C)C ZINC000357164114 132272812 /nfs/dbraw/zinc/27/28/12/132272812.db2.gz AUJVHIPBCWWVCT-SNVBAGLBSA-N 1 2 247.342 2.358 20 0 BEADLO Cc1nc(N2CCC(C3CC3)CC2)cc[nH+]1 ZINC000368019920 132282612 /nfs/dbraw/zinc/28/26/12/132282612.db2.gz KIPWJZMSDUXEDQ-UHFFFAOYSA-N 1 2 217.316 2.411 20 0 BEADLO c1nc(N2CCCCC2)cc(N2CCCCC2)[nH+]1 ZINC000032252111 132335089 /nfs/dbraw/zinc/33/50/89/132335089.db2.gz CRLZJHWOSCMCDU-UHFFFAOYSA-N 1 2 246.358 2.457 20 0 BEADLO Cc1cc(N2CCC[C@@](CO)(C(C)C)C2)nc[nH+]1 ZINC000338810782 132457047 /nfs/dbraw/zinc/45/70/47/132457047.db2.gz QNVCDKLKAUULCX-CQSZACIVSA-N 1 2 249.358 2.020 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H](C)n1cccn1 ZINC000335531564 133877007 /nfs/dbraw/zinc/87/70/07/133877007.db2.gz SPKVAWADEOVEFP-LLVKDONJSA-N 1 2 244.298 2.095 20 0 BEADLO Cc1nn(C)cc1[C@H](C)[NH2+][C@H](C)c1ccon1 ZINC000349857042 133920703 /nfs/dbraw/zinc/92/07/03/133920703.db2.gz ITWWNASFYVXQIC-WCBMZHEXSA-N 1 2 234.303 2.128 20 0 BEADLO CCc1ccc(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)nc1 ZINC000335929999 134010296 /nfs/dbraw/zinc/01/02/96/134010296.db2.gz ATXVKSXJHREOBZ-NWDGAFQWSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1ccc(C[N@H+]2C[C@@H](C)OC[C@@H]2C)nc1 ZINC000335929999 134010297 /nfs/dbraw/zinc/01/02/97/134010297.db2.gz ATXVKSXJHREOBZ-NWDGAFQWSA-N 1 2 234.343 2.253 20 0 BEADLO O=C(CC1CCC1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000335957512 134023491 /nfs/dbraw/zinc/02/34/91/134023491.db2.gz CNDOQTBZTMBHIL-NSHDSACASA-N 1 2 233.315 2.263 20 0 BEADLO Clc1ccc(C[NH+]2CCSCC2)nc1 ZINC000335965007 134027962 /nfs/dbraw/zinc/02/79/62/134027962.db2.gz XQESMDPKPKRLEJ-UHFFFAOYSA-N 1 2 228.748 2.284 20 0 BEADLO c1csc(CN2CCC[C@@H]2c2[nH]cc[nH+]2)n1 ZINC000335966216 134028407 /nfs/dbraw/zinc/02/84/07/134028407.db2.gz XTNZAYFZIZMJCB-SECBINFHSA-N 1 2 234.328 2.203 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1ccoc1C ZINC000335976559 134031543 /nfs/dbraw/zinc/03/15/43/134031543.db2.gz ACRRJSJIWUTNCW-UHFFFAOYSA-N 1 2 230.267 2.220 20 0 BEADLO Cc1nc(C[N@H+]2C[C@@H](C)CC(C)(C)C2)no1 ZINC000335992437 134041290 /nfs/dbraw/zinc/04/12/90/134041290.db2.gz CVFDZSJXPSRFMH-VIFPVBQESA-N 1 2 223.320 2.246 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@@H](C)CC(C)(C)C2)no1 ZINC000335992437 134041291 /nfs/dbraw/zinc/04/12/91/134041291.db2.gz CVFDZSJXPSRFMH-VIFPVBQESA-N 1 2 223.320 2.246 20 0 BEADLO C[C@H](CC(C)(C)C)C(=O)N1CCn2c[nH+]cc2C1 ZINC000336022299 134055907 /nfs/dbraw/zinc/05/59/07/134055907.db2.gz MMBNUDQBCQWRAR-LLVKDONJSA-N 1 2 249.358 2.298 20 0 BEADLO O=C(C1=CCCC1)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000336054144 134065540 /nfs/dbraw/zinc/06/55/40/134065540.db2.gz IUNHHFRZVURSPL-LBPRGKRZSA-N 1 2 245.326 2.226 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1nnc(C2CCC2)n1C ZINC000336056033 134066463 /nfs/dbraw/zinc/06/64/63/134066463.db2.gz RBRXMZGTLCZMBA-AOOOYVTPSA-N 1 2 234.347 2.065 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1nnc(C2CCC2)n1C ZINC000336056033 134066464 /nfs/dbraw/zinc/06/64/64/134066464.db2.gz RBRXMZGTLCZMBA-AOOOYVTPSA-N 1 2 234.347 2.065 20 0 BEADLO Cc1cc(N2CC[C@H]3CCC[C@H]32)nc[nH+]1 ZINC000336091215 134078612 /nfs/dbraw/zinc/07/86/12/134078612.db2.gz WFDCFXKWYIJSAX-GHMZBOCLSA-N 1 2 203.289 2.164 20 0 BEADLO C[C@H](F)CC[N@H+](C)CC(=O)OC(C)(C)C ZINC000352132118 134080748 /nfs/dbraw/zinc/08/07/48/134080748.db2.gz ZDHKFNZZVDSWTB-VIFPVBQESA-N 1 2 219.300 2.008 20 0 BEADLO C[C@H](F)CC[N@@H+](C)CC(=O)OC(C)(C)C ZINC000352132118 134080749 /nfs/dbraw/zinc/08/07/49/134080749.db2.gz ZDHKFNZZVDSWTB-VIFPVBQESA-N 1 2 219.300 2.008 20 0 BEADLO CC1(CC(=O)N2CCC(c3[nH]cc[nH+]3)CC2)CC1 ZINC000336121701 134091453 /nfs/dbraw/zinc/09/14/53/134091453.db2.gz SIHQGIUBFGDQFN-UHFFFAOYSA-N 1 2 247.342 2.306 20 0 BEADLO Cc1cc(C)c(NC(=O)NC2CC2)c(C)[nH+]1 ZINC000336145352 134101799 /nfs/dbraw/zinc/10/17/99/134101799.db2.gz GSKJTQGYYJMOBA-UHFFFAOYSA-N 1 2 219.288 2.291 20 0 BEADLO OC[C@@H]1C[C@@H](F)C[N@@H+]1Cc1ccc(Cl)cc1 ZINC000336156404 134105976 /nfs/dbraw/zinc/10/59/76/134105976.db2.gz NMAXHSXFGMUVNW-NEPJUHHUSA-N 1 2 243.709 2.245 20 0 BEADLO OC[C@@H]1C[C@@H](F)C[N@H+]1Cc1ccc(Cl)cc1 ZINC000336156404 134105977 /nfs/dbraw/zinc/10/59/77/134105977.db2.gz NMAXHSXFGMUVNW-NEPJUHHUSA-N 1 2 243.709 2.245 20 0 BEADLO CC1CCC(c2noc(C[NH+](C)C)n2)CC1 ZINC000336181471 134118723 /nfs/dbraw/zinc/11/87/23/134118723.db2.gz GQHIYLCOIVVEGY-UHFFFAOYSA-N 1 2 223.320 2.425 20 0 BEADLO F[C@H]1CCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000336189471 134123061 /nfs/dbraw/zinc/12/30/61/134123061.db2.gz WRWNGRMMWUOHBF-QMMMGPOBSA-N 1 2 205.236 2.111 20 0 BEADLO COc1cc(C)ccc1C[N@@H+]1CCOC[C@@H]1C ZINC000336213794 134135822 /nfs/dbraw/zinc/13/58/22/134135822.db2.gz HXDZDIUFQJCTNI-LBPRGKRZSA-N 1 2 235.327 2.224 20 0 BEADLO COc1cc(C)ccc1C[N@H+]1CCOC[C@@H]1C ZINC000336213794 134135823 /nfs/dbraw/zinc/13/58/23/134135823.db2.gz HXDZDIUFQJCTNI-LBPRGKRZSA-N 1 2 235.327 2.224 20 0 BEADLO COC1C[NH+](C/C=C/c2ccccc2)C1 ZINC000358927533 134193153 /nfs/dbraw/zinc/19/31/53/134193153.db2.gz SAOLQIRWQAWNKC-VMPITWQZSA-N 1 2 203.285 2.030 20 0 BEADLO C[C@@H]([NH2+]Cc1ccn[nH]1)[C@@H]1COc2ccccc21 ZINC000169170702 134249224 /nfs/dbraw/zinc/24/92/24/134249224.db2.gz PWSWMOVKRFJDGN-MFKMUULPSA-N 1 2 243.310 2.064 20 0 BEADLO CCC[N@H+](Cc1noc(CC)n1)C1CC1 ZINC000170900734 134254707 /nfs/dbraw/zinc/25/47/07/134254707.db2.gz GXGCOFNEGYAIIX-UHFFFAOYSA-N 1 2 209.293 2.006 20 0 BEADLO CCC[N@@H+](Cc1noc(CC)n1)C1CC1 ZINC000170900734 134254708 /nfs/dbraw/zinc/25/47/08/134254708.db2.gz GXGCOFNEGYAIIX-UHFFFAOYSA-N 1 2 209.293 2.006 20 0 BEADLO CC[C@@H]1CN(c2nc(C)[nH+]c(C)c2C)CCO1 ZINC000177809690 134300348 /nfs/dbraw/zinc/30/03/48/134300348.db2.gz XUHACKGLKWWDCA-GFCCVEGCSA-N 1 2 235.331 2.017 20 0 BEADLO CC(C)c1nc(C[N@@H+]2CC[C@@H](C)[C@H]2C)no1 ZINC000177908980 134301597 /nfs/dbraw/zinc/30/15/97/134301597.db2.gz YBZCKQUNLGUXEN-NXEZZACHSA-N 1 2 223.320 2.423 20 0 BEADLO C[C@@H]1CCC[C@H](C[N@H+](C)Cc2nnc[nH]2)C1 ZINC000179359556 134316591 /nfs/dbraw/zinc/31/65/91/134316591.db2.gz JOPSJYNUIQJZES-MNOVXSKESA-N 1 2 222.336 2.063 20 0 BEADLO C[C@@H]1CCC[C@H](C[N@@H+](C)Cc2nnc[nH]2)C1 ZINC000179359556 134316592 /nfs/dbraw/zinc/31/65/92/134316592.db2.gz JOPSJYNUIQJZES-MNOVXSKESA-N 1 2 222.336 2.063 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CCCO[C@H](C)C1 ZINC000179860351 134324269 /nfs/dbraw/zinc/32/42/69/134324269.db2.gz VIUPNKWYCQSOGH-LLVKDONJSA-N 1 2 249.314 2.033 20 0 BEADLO C[N@H+](Cc1nnc(C2CC2)[nH]1)Cc1ccccc1 ZINC000180404742 134327377 /nfs/dbraw/zinc/32/73/77/134327377.db2.gz IVGKNADLIWELAP-UHFFFAOYSA-N 1 2 242.326 2.314 20 0 BEADLO C[N@@H+](Cc1nnc(C2CC2)[nH]1)Cc1ccccc1 ZINC000180404742 134327378 /nfs/dbraw/zinc/32/73/78/134327378.db2.gz IVGKNADLIWELAP-UHFFFAOYSA-N 1 2 242.326 2.314 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](C)c2cccnc2)o1 ZINC000182891048 134349547 /nfs/dbraw/zinc/34/95/47/134349547.db2.gz WCYRTMGHPFNKCF-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO COC(=O)c1ccc(CNc2c[nH+]cc(C)c2)o1 ZINC000224917415 134352487 /nfs/dbraw/zinc/35/24/87/134352487.db2.gz QXFBCZRUDJHGGI-UHFFFAOYSA-N 1 2 246.266 2.382 20 0 BEADLO Cc1c[nH+]cc(N[C@H]2CCCOCC2)c1 ZINC000225853129 134356034 /nfs/dbraw/zinc/35/60/34/134356034.db2.gz PWDQZVUPRDZZTE-NSHDSACASA-N 1 2 206.289 2.371 20 0 BEADLO Cc1cc(N2CC[C@H](C)[C@@H]2CO)nc(C(C)C)[nH+]1 ZINC000227168239 134374627 /nfs/dbraw/zinc/37/46/27/134374627.db2.gz KXKQZSBDAKTQRB-JQWIXIFHSA-N 1 2 249.358 2.116 20 0 BEADLO CO[C@H]1C[C@H](Nc2cc[nH+]c(C)n2)C1(C)C ZINC000227822096 134389201 /nfs/dbraw/zinc/38/92/01/134389201.db2.gz XCCHEVWFOSUXCP-UWVGGRQHSA-N 1 2 221.304 2.010 20 0 BEADLO COC(=O)[C@@H]([NH2+]CCc1ccccc1C)C1CC1 ZINC000227767717 134392938 /nfs/dbraw/zinc/39/29/38/134392938.db2.gz QLSHLWXTCRJUCK-AWEZNQCLSA-N 1 2 247.338 2.079 20 0 BEADLO Cc1cc(N[C@@H]2CCCc3c2cnn3C)nc[nH+]1 ZINC000408124981 134397673 /nfs/dbraw/zinc/39/76/73/134397673.db2.gz XWPWXJVGEBGJBO-LLVKDONJSA-N 1 2 243.314 2.008 20 0 BEADLO Cc1[nH+]cccc1N[C@H]1CCCOCC1 ZINC000085726849 134515608 /nfs/dbraw/zinc/51/56/08/134515608.db2.gz YDLGPAKEIWQPAX-NSHDSACASA-N 1 2 206.289 2.371 20 0 BEADLO Cc1cccc(C(=O)N(C)Cc2[nH]cc[nH+]2)c1C ZINC000070979376 134927242 /nfs/dbraw/zinc/92/72/42/134927242.db2.gz NBKQRENZPSGJMU-UHFFFAOYSA-N 1 2 243.310 2.299 20 0 BEADLO Cc1csc([C@H](C)NCc2[nH+]ccn2C)n1 ZINC000070650133 135004060 /nfs/dbraw/zinc/00/40/60/135004060.db2.gz HNPMFDYQBUSJKQ-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO Cc1csc([C@H](C)[NH2+]Cc2nccn2C)n1 ZINC000070650133 135004061 /nfs/dbraw/zinc/00/40/61/135004061.db2.gz HNPMFDYQBUSJKQ-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO CC[C@H](Nc1ncncc1Cl)c1[nH]cc[nH+]1 ZINC000163656602 135036539 /nfs/dbraw/zinc/03/65/39/135036539.db2.gz HVUBGABRCWDAQV-QMMMGPOBSA-N 1 2 237.694 2.416 20 0 BEADLO Cc1cscc1C[NH2+]Cc1cn[nH]c1C ZINC000087309609 135122718 /nfs/dbraw/zinc/12/27/18/135122718.db2.gz UQALFAKQSHNSRH-UHFFFAOYSA-N 1 2 221.329 2.378 20 0 BEADLO COc1ccccc1/C=C\C[N@@H+]1CCO[C@H](C)C1 ZINC000255324710 135129495 /nfs/dbraw/zinc/12/94/95/135129495.db2.gz WYQFVWNMHCKAIH-SCXUMTSISA-N 1 2 247.338 2.429 20 0 BEADLO COc1ccccc1/C=C\C[N@H+]1CCO[C@H](C)C1 ZINC000255324710 135129497 /nfs/dbraw/zinc/12/94/97/135129497.db2.gz WYQFVWNMHCKAIH-SCXUMTSISA-N 1 2 247.338 2.429 20 0 BEADLO CCCC1(c2nc(C[NH2+]C)no2)CCC1 ZINC000261542661 135183154 /nfs/dbraw/zinc/18/31/54/135183154.db2.gz HCIPYCXCFIXWTC-UHFFFAOYSA-N 1 2 209.293 2.011 20 0 BEADLO C[NH2+]Cc1noc([C@H](C)c2ccsc2)n1 ZINC000261553469 135192990 /nfs/dbraw/zinc/19/29/90/135192990.db2.gz SMZDQBLJKIMZRI-SSDOTTSWSA-N 1 2 223.301 2.002 20 0 BEADLO Cc1cc2[nH+]cn(Cc3ccn(C)n3)c2cc1C ZINC000163948009 135211086 /nfs/dbraw/zinc/21/10/86/135211086.db2.gz KHDUPSUEWHNIAN-UHFFFAOYSA-N 1 2 240.310 2.435 20 0 BEADLO CCCC[N@@H+]1CC(=O)N[C@@H]1[C@@H]1CCCC[C@@H]1C ZINC000342256388 135258902 /nfs/dbraw/zinc/25/89/02/135258902.db2.gz ZSEOFMNTTOGRNP-SCRDCRAPSA-N 1 2 238.375 2.371 20 0 BEADLO CCCC[N@H+]1CC(=O)N[C@@H]1[C@@H]1CCCC[C@@H]1C ZINC000342256388 135258903 /nfs/dbraw/zinc/25/89/03/135258903.db2.gz ZSEOFMNTTOGRNP-SCRDCRAPSA-N 1 2 238.375 2.371 20 0 BEADLO CCCC[N@@H+]1CC(=O)N[C@]12CC[C@@H](C)[C@H](C)C2 ZINC000342453583 135276032 /nfs/dbraw/zinc/27/60/32/135276032.db2.gz NAXJAILDDZCEGY-YRGRVCCFSA-N 1 2 238.375 2.371 20 0 BEADLO CCCC[N@H+]1CC(=O)N[C@]12CC[C@@H](C)[C@H](C)C2 ZINC000342453583 135276034 /nfs/dbraw/zinc/27/60/34/135276034.db2.gz NAXJAILDDZCEGY-YRGRVCCFSA-N 1 2 238.375 2.371 20 0 BEADLO C[C@@H]1CC[C@H](C)N1c1cc(N2CCCC2)[nH+]cn1 ZINC000342556541 135287824 /nfs/dbraw/zinc/28/78/24/135287824.db2.gz XSQDVSFMGFHZRE-TXEJJXNPSA-N 1 2 246.358 2.454 20 0 BEADLO C[C@@H]1CC[C@H](C)N1c1cc(N2CCCC2)nc[nH+]1 ZINC000342556541 135287825 /nfs/dbraw/zinc/28/78/25/135287825.db2.gz XSQDVSFMGFHZRE-TXEJJXNPSA-N 1 2 246.358 2.454 20 0 BEADLO CC[C@H](C)NC(=O)[C@H](C)[N@H+](C)Cc1ccoc1 ZINC000342635431 135298760 /nfs/dbraw/zinc/29/87/60/135298760.db2.gz KMUKYNQBNLUFRY-QWRGUYRKSA-N 1 2 238.331 2.015 20 0 BEADLO CC[C@H](C)NC(=O)[C@H](C)[N@@H+](C)Cc1ccoc1 ZINC000342635431 135298761 /nfs/dbraw/zinc/29/87/61/135298761.db2.gz KMUKYNQBNLUFRY-QWRGUYRKSA-N 1 2 238.331 2.015 20 0 BEADLO Cc1[nH]c2ccc(CS[C@H](C)CO)cc2[nH+]1 ZINC000342662978 135308906 /nfs/dbraw/zinc/30/89/06/135308906.db2.gz MOSGBJHDRVHHDN-MRVPVSSYSA-N 1 2 236.340 2.485 20 0 BEADLO Cc1[nH]c2cc(CS[C@H](C)CO)ccc2[nH+]1 ZINC000342662978 135308908 /nfs/dbraw/zinc/30/89/08/135308908.db2.gz MOSGBJHDRVHHDN-MRVPVSSYSA-N 1 2 236.340 2.485 20 0 BEADLO Cc1c[nH+]c(CN2CCn3cccc3[C@@H]2C)n1C ZINC000342779398 135317859 /nfs/dbraw/zinc/31/78/59/135317859.db2.gz LJVMVURBPJIPLO-LBPRGKRZSA-N 1 2 244.342 2.107 20 0 BEADLO Cc1cc(N[C@@H](C)c2nnc(C(C)C)[nH]2)nc[nH+]1 ZINC000342784726 135318466 /nfs/dbraw/zinc/31/84/66/135318466.db2.gz WCFYGTXFXSNLRH-VIFPVBQESA-N 1 2 246.318 2.200 20 0 BEADLO Cc1c[nH+]c(CN2CCc3ccsc3C2)n1C ZINC000342786745 135318896 /nfs/dbraw/zinc/31/88/96/135318896.db2.gz SXIDEQRUJRXEBD-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1cnc(C[N@@H+]2CCc3ccsc3C2)n1C ZINC000342786745 135318898 /nfs/dbraw/zinc/31/88/98/135318898.db2.gz SXIDEQRUJRXEBD-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1cnc(C[N@H+]2CCc3ccsc3C2)n1C ZINC000342786745 135318899 /nfs/dbraw/zinc/31/88/99/135318899.db2.gz SXIDEQRUJRXEBD-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO OC[C@@H]1C[C@H](F)C[N@@H+]1Cc1ccc(Cl)s1 ZINC000334168966 135325082 /nfs/dbraw/zinc/32/50/82/135325082.db2.gz BBGIWLSCLHWMPT-YUMQZZPRSA-N 1 2 249.738 2.306 20 0 BEADLO OC[C@@H]1C[C@H](F)C[N@H+]1Cc1ccc(Cl)s1 ZINC000334168966 135325084 /nfs/dbraw/zinc/32/50/84/135325084.db2.gz BBGIWLSCLHWMPT-YUMQZZPRSA-N 1 2 249.738 2.306 20 0 BEADLO Cc1c[nH+]c(CN2CCc3c2cccc3F)n1C ZINC000342770439 135326078 /nfs/dbraw/zinc/32/60/78/135326078.db2.gz XRRDNQLELPFLCX-UHFFFAOYSA-N 1 2 245.301 2.430 20 0 BEADLO CCCN(Cc1[nH+]cc(C)n1C)CC(F)F ZINC000342774141 135327708 /nfs/dbraw/zinc/32/77/08/135327708.db2.gz CVCMMDFUJDDYNB-UHFFFAOYSA-N 1 2 231.290 2.206 20 0 BEADLO Cc1cc(NCC2(O)CCCCCC2)nc[nH+]1 ZINC000079618185 135342114 /nfs/dbraw/zinc/34/21/14/135342114.db2.gz OOSWBLVUCQHVIJ-UHFFFAOYSA-N 1 2 235.331 2.282 20 0 BEADLO CC(C)[C@H]1C[N@H+](Cc2cncc(F)c2)CCO1 ZINC000334312493 135351870 /nfs/dbraw/zinc/35/18/70/135351870.db2.gz KXWXBNAIGGFGJO-CYBMUJFWSA-N 1 2 238.306 2.078 20 0 BEADLO CC(C)[C@H]1C[N@@H+](Cc2cncc(F)c2)CCO1 ZINC000334312493 135351872 /nfs/dbraw/zinc/35/18/72/135351872.db2.gz KXWXBNAIGGFGJO-CYBMUJFWSA-N 1 2 238.306 2.078 20 0 BEADLO CC1=CC[N@H+](CC(=O)Nc2ccccc2F)CC1 ZINC000334342953 135364547 /nfs/dbraw/zinc/36/45/47/135364547.db2.gz LJKOBECPEVADMG-UHFFFAOYSA-N 1 2 248.301 2.416 20 0 BEADLO CC1=CC[N@@H+](CC(=O)Nc2ccccc2F)CC1 ZINC000334342953 135364548 /nfs/dbraw/zinc/36/45/48/135364548.db2.gz LJKOBECPEVADMG-UHFFFAOYSA-N 1 2 248.301 2.416 20 0 BEADLO CCC1CC([NH2+][C@H]2CCO[C@]3(CCOC3)C2)C1 ZINC000334354039 135370393 /nfs/dbraw/zinc/37/03/93/135370393.db2.gz YWCRPMRNSSIYHM-GNRIBBGQSA-N 1 2 239.359 2.103 20 0 BEADLO C[C@H]1CC[N@@H+](CCC(C)(C)C)CC[S@]1=O ZINC000334357763 135370398 /nfs/dbraw/zinc/37/03/98/135370398.db2.gz QTSLBQWKGDXDOS-XHDPSFHLSA-N 1 2 231.405 2.266 20 0 BEADLO Cc1cc(NC(=O)c2ccco2)cc[nH+]1 ZINC000072672334 135389197 /nfs/dbraw/zinc/38/91/97/135389197.db2.gz JSZCXOIAQMLFDM-UHFFFAOYSA-N 1 2 202.213 2.235 20 0 BEADLO Fc1cc(F)c2c(c1)C[N@H+]([C@H]1CCOC1)CC2 ZINC000334400903 135389951 /nfs/dbraw/zinc/38/99/51/135389951.db2.gz YRKYIMWOENPALG-NSHDSACASA-N 1 2 239.265 2.112 20 0 BEADLO Fc1cc(F)c2c(c1)C[N@@H+]([C@H]1CCOC1)CC2 ZINC000334400903 135389952 /nfs/dbraw/zinc/38/99/52/135389952.db2.gz YRKYIMWOENPALG-NSHDSACASA-N 1 2 239.265 2.112 20 0 BEADLO O[C@@H]1CCC[C@@H](CNc2cccc[nH+]2)C1 ZINC000078305049 135393360 /nfs/dbraw/zinc/39/33/60/135393360.db2.gz WWHSLRQDUWSZGY-GHMZBOCLSA-N 1 2 206.289 2.045 20 0 BEADLO CC1(C)C[N@H+](Cc2ccon2)[C@@H]1[C@H]1CCCO1 ZINC000334406765 135393826 /nfs/dbraw/zinc/39/38/26/135393826.db2.gz HYYHAVPIBRDMNG-VXGBXAGGSA-N 1 2 236.315 2.064 20 0 BEADLO CC1(C)C[N@@H+](Cc2ccon2)[C@@H]1[C@H]1CCCO1 ZINC000334406765 135393828 /nfs/dbraw/zinc/39/38/28/135393828.db2.gz HYYHAVPIBRDMNG-VXGBXAGGSA-N 1 2 236.315 2.064 20 0 BEADLO C[C@@H]1CCC[C@@H](C(=O)N(C)Cc2[nH+]ccn2C)C1 ZINC000334418941 135399651 /nfs/dbraw/zinc/39/96/51/135399651.db2.gz PWGSZDYVCAXGMR-VXGBXAGGSA-N 1 2 249.358 2.205 20 0 BEADLO CO[C@H](C)CN(C)c1[nH+]c2ccccc2n1C ZINC000343816460 135700505 /nfs/dbraw/zinc/70/05/05/135700505.db2.gz SXIUANBUGSJHKW-SNVBAGLBSA-N 1 2 233.315 2.044 20 0 BEADLO Cc1cn2cc(NC(=O)C3(C)CC3)ccc2[nH+]1 ZINC000334628547 135797627 /nfs/dbraw/zinc/79/76/27/135797627.db2.gz CLFBENSWFVCORK-UHFFFAOYSA-N 1 2 229.283 2.381 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CC[C@H](C)C2)cc[nH+]1 ZINC000334886221 135835073 /nfs/dbraw/zinc/83/50/73/135835073.db2.gz OJPMPJLIEZFDES-GXSJLCMTSA-N 1 2 218.300 2.187 20 0 BEADLO Cc1cc(C)c(CNC(=O)[C@H]2CC23CC3)c[nH+]1 ZINC000335021206 135879114 /nfs/dbraw/zinc/87/91/14/135879114.db2.gz LKDYOFPWHAJNOK-GFCCVEGCSA-N 1 2 230.311 2.115 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)C1CC=CC1 ZINC000335235511 135969291 /nfs/dbraw/zinc/96/92/91/135969291.db2.gz KOSXTMVKIOAHPJ-UHFFFAOYSA-N 1 2 227.267 2.239 20 0 BEADLO CCn1c[nH+]cc1CN1CC[C@@H](C)C(F)(F)C1 ZINC000335295437 136005746 /nfs/dbraw/zinc/00/57/46/136005746.db2.gz KWHLJRKTGIWUFZ-SNVBAGLBSA-N 1 2 243.301 2.380 20 0 BEADLO FC(F)n1ccc(C[N@@H+]2C[C@H]3CCC[C@H]32)n1 ZINC000347701422 136007323 /nfs/dbraw/zinc/00/73/23/136007323.db2.gz LERNRVOACPRJDB-PSASIEDQSA-N 1 2 227.258 2.263 20 0 BEADLO FC(F)n1ccc(C[N@H+]2C[C@H]3CCC[C@H]32)n1 ZINC000347701422 136007324 /nfs/dbraw/zinc/00/73/24/136007324.db2.gz LERNRVOACPRJDB-PSASIEDQSA-N 1 2 227.258 2.263 20 0 BEADLO O=S1CC[NH+](CCCC2CCCCC2)CC1 ZINC000347770377 136008868 /nfs/dbraw/zinc/00/88/68/136008868.db2.gz AXGVLYUJQYQPNH-UHFFFAOYSA-N 1 2 243.416 2.411 20 0 BEADLO c1cn(-c2cccc(OC[C@@H]3CCCO3)c2)c[nH+]1 ZINC000347867468 136016745 /nfs/dbraw/zinc/01/67/45/136016745.db2.gz SLAISZWAUYBRKT-AWEZNQCLSA-N 1 2 244.294 2.430 20 0 BEADLO Cc1cccnc1C[N@@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000335312882 136030436 /nfs/dbraw/zinc/03/04/36/136030436.db2.gz DEZREIPZSABCJK-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccnc1C[N@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000335312882 136030437 /nfs/dbraw/zinc/03/04/37/136030437.db2.gz DEZREIPZSABCJK-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO C[C@@H]1CC[C@@H](NC(=O)CCn2cc[nH+]c2)C[C@@H]1C ZINC000348083382 136034751 /nfs/dbraw/zinc/03/47/51/136034751.db2.gz WYCSRORCQNWGPL-FRRDWIJNSA-N 1 2 249.358 2.214 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)CCn2cc[nH+]c2)C[C@@H]1C ZINC000348083379 136034775 /nfs/dbraw/zinc/03/47/75/136034775.db2.gz WYCSRORCQNWGPL-AGIUHOORSA-N 1 2 249.358 2.214 20 0 BEADLO CC[N@H+](CCCNC(C)=O)c1cccc(C)c1 ZINC000348160778 136041118 /nfs/dbraw/zinc/04/11/18/136041118.db2.gz ZQTHEBCARPXXAT-UHFFFAOYSA-N 1 2 234.343 2.348 20 0 BEADLO CC[N@@H+](CCCNC(C)=O)c1cccc(C)c1 ZINC000348160778 136041119 /nfs/dbraw/zinc/04/11/19/136041119.db2.gz ZQTHEBCARPXXAT-UHFFFAOYSA-N 1 2 234.343 2.348 20 0 BEADLO C[C@@H](c1cnccn1)[N@@H+]1C[C@@H](C)O[C@H](C2CC2)C1 ZINC000348206467 136054191 /nfs/dbraw/zinc/05/41/91/136054191.db2.gz PGJUOJNNQQJIEG-SUNKGSAMSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@@H](c1cnccn1)[N@H+]1C[C@@H](C)O[C@H](C2CC2)C1 ZINC000348206467 136054192 /nfs/dbraw/zinc/05/41/92/136054192.db2.gz PGJUOJNNQQJIEG-SUNKGSAMSA-N 1 2 247.342 2.037 20 0 BEADLO CC1=C(C)C[N@H+](Cc2nc(C3CC3)nn2C)CC1 ZINC000335367004 136081991 /nfs/dbraw/zinc/08/19/91/136081991.db2.gz QXNMFKYHBMFRSA-UHFFFAOYSA-N 1 2 246.358 2.235 20 0 BEADLO CC1=C(C)C[N@@H+](Cc2nc(C3CC3)nn2C)CC1 ZINC000335367004 136081992 /nfs/dbraw/zinc/08/19/92/136081992.db2.gz QXNMFKYHBMFRSA-UHFFFAOYSA-N 1 2 246.358 2.235 20 0 BEADLO Cc1noc(C[N@H+]2Cc3ccccc3C[C@@H]2C)n1 ZINC000335370074 136082996 /nfs/dbraw/zinc/08/29/96/136082996.db2.gz AONHLGBLLZEDAY-JTQLQIEISA-N 1 2 243.310 2.325 20 0 BEADLO Cc1noc(C[N@@H+]2Cc3ccccc3C[C@@H]2C)n1 ZINC000335370074 136082997 /nfs/dbraw/zinc/08/29/97/136082997.db2.gz AONHLGBLLZEDAY-JTQLQIEISA-N 1 2 243.310 2.325 20 0 BEADLO c1ccc(N2CCC[C@H]2[C@@H]2CCCOC2)[nH+]c1 ZINC000335379021 136086552 /nfs/dbraw/zinc/08/65/52/136086552.db2.gz VWLDGSALMVEUJG-OLZOCXBDSA-N 1 2 232.327 2.477 20 0 BEADLO CC1(C(N)=O)C[NH+](Cc2cc(F)ccc2F)C1 ZINC000335387406 136089175 /nfs/dbraw/zinc/08/91/75/136089175.db2.gz ATAXQTBCMZXQKR-UHFFFAOYSA-N 1 2 240.253 2.322 20 0 BEADLO CCn1ccc(C(=O)Nc2ccc(C)[nH+]c2C)n1 ZINC000335391943 136090990 /nfs/dbraw/zinc/09/09/90/136090990.db2.gz GQAMJDIPFVQTAD-UHFFFAOYSA-N 1 2 244.298 2.167 20 0 BEADLO CC1(C(N)=O)C[NH+](Cc2ccc(Cl)cn2)C1 ZINC000335395378 136092187 /nfs/dbraw/zinc/09/21/87/136092187.db2.gz KUPLWIBOCVJCAV-UHFFFAOYSA-N 1 2 239.706 2.092 20 0 BEADLO Cc1[nH+]c(C(C)C)ccc1Cn1cncn1 ZINC000335596135 136105264 /nfs/dbraw/zinc/10/52/64/136105264.db2.gz OLHKCVXHDVQWRH-UHFFFAOYSA-N 1 2 216.288 2.153 20 0 BEADLO CC[C@@H]1CN(c2cccc[nH+]2)C[C@@H](CC)O1 ZINC000335567494 136108426 /nfs/dbraw/zinc/10/84/26/136108426.db2.gz IYKAXPFWJDOLMD-VXGBXAGGSA-N 1 2 220.316 2.475 20 0 BEADLO Cc1cc(C(=O)C[N@@H+]2CC[C@](C)(F)C2)c(C)[nH]1 ZINC000335568936 136108695 /nfs/dbraw/zinc/10/86/95/136108695.db2.gz HHTPKMQMFVRYOG-ZDUSSCGKSA-N 1 2 238.306 2.248 20 0 BEADLO Cc1cc(C(=O)C[N@H+]2CC[C@](C)(F)C2)c(C)[nH]1 ZINC000335568936 136108696 /nfs/dbraw/zinc/10/86/96/136108696.db2.gz HHTPKMQMFVRYOG-ZDUSSCGKSA-N 1 2 238.306 2.248 20 0 BEADLO Cc1cc(C)c(CNC(=O)N2[C@H](C)C[C@H]2C)c[nH+]1 ZINC000335576066 136111013 /nfs/dbraw/zinc/11/10/13/136111013.db2.gz DADJVJHCTPWHRM-VXGBXAGGSA-N 1 2 247.342 2.391 20 0 BEADLO Cc1cc(C)c(CNC(=O)N2C[C@H](C)[C@H]2C)c[nH+]1 ZINC000335579460 136111859 /nfs/dbraw/zinc/11/18/59/136111859.db2.gz KBMBAWYWYDKHRX-CMPLNLGQSA-N 1 2 247.342 2.248 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@H]2[C@@H]3CCCC[C@@H]32)c[nH+]1 ZINC001646325256 1172731743 /nfs/dbraw/zinc/73/17/43/1172731743.db2.gz JZFZLVLUEITILG-PJXYFTJBSA-N 1 2 247.342 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@H]2[C@@H]3CCCC[C@@H]32)[nH+]1 ZINC001646325256 1172731745 /nfs/dbraw/zinc/73/17/45/1172731745.db2.gz JZFZLVLUEITILG-PJXYFTJBSA-N 1 2 247.342 2.025 20 0 BEADLO O=C(C=C1CCC1)NCc1[nH]c2c([nH+]1)CCCC2 ZINC001647340543 1172756631 /nfs/dbraw/zinc/75/66/31/1172756631.db2.gz BUXPPBHWCQJRTE-UHFFFAOYSA-N 1 2 245.326 2.015 20 0 BEADLO CCc1nnc(C[N@H+](C)C2CCC2)s1 ZINC000680054787 487528774 /nfs/dbraw/zinc/52/87/74/487528774.db2.gz LVOSKRFYNFDAQF-UHFFFAOYSA-N 1 2 211.334 2.085 20 0 BEADLO CCc1nnc(C[N@@H+](C)C2CCC2)s1 ZINC000680054787 487528781 /nfs/dbraw/zinc/52/87/81/487528781.db2.gz LVOSKRFYNFDAQF-UHFFFAOYSA-N 1 2 211.334 2.085 20 0 BEADLO Cc1ccc(N[C@H](C)c2cn[nH]c2)c[nH+]1 ZINC000281087380 397751726 /nfs/dbraw/zinc/75/17/26/397751726.db2.gz VAAVVLUWJBATNS-SECBINFHSA-N 1 2 202.261 2.286 20 0 BEADLO CN(C[C@H]1CCOC1)c1[nH+]c2ccccc2n1C ZINC000178813682 397847970 /nfs/dbraw/zinc/84/79/70/397847970.db2.gz RCFNSCIDPKHTAP-LLVKDONJSA-N 1 2 245.326 2.046 20 0 BEADLO CC(C)[C@H]1C[C@@H]1C(=O)Nc1ccc[nH+]c1N(C)C ZINC000186090935 397876513 /nfs/dbraw/zinc/87/65/13/397876513.db2.gz PAICNFXLRWJIEO-MNOVXSKESA-N 1 2 247.342 2.378 20 0 BEADLO Cc1sccc1C[NH2+]Cc1cocn1 ZINC000382317606 397934210 /nfs/dbraw/zinc/93/42/10/397934210.db2.gz SBGOYRPOEJEXHK-UHFFFAOYSA-N 1 2 208.286 2.334 20 0 BEADLO C[C@H](CC(=O)N[C@@H]1CC[C@H]2C[C@H]2C1)n1cc[nH+]c1 ZINC000650127640 397938351 /nfs/dbraw/zinc/93/83/51/397938351.db2.gz UMSDGOFCDQEUIG-MROQNXINSA-N 1 2 247.342 2.139 20 0 BEADLO C[N@@H+](Cc1cc2n(n1)CCCC2)Cc1ccc[nH]1 ZINC000649547530 397939105 /nfs/dbraw/zinc/93/91/05/397939105.db2.gz URTPZXPDUJONRN-UHFFFAOYSA-N 1 2 244.342 2.180 20 0 BEADLO C[N@H+](Cc1cc2n(n1)CCCC2)Cc1ccc[nH]1 ZINC000649547530 397939114 /nfs/dbraw/zinc/93/91/14/397939114.db2.gz URTPZXPDUJONRN-UHFFFAOYSA-N 1 2 244.342 2.180 20 0 BEADLO COC(=O)C(C)(C)[N@H+](C)Cc1csc(C)c1 ZINC000449021199 397950823 /nfs/dbraw/zinc/95/08/23/397950823.db2.gz YJFFDVJWCUQFMR-UHFFFAOYSA-N 1 2 241.356 2.440 20 0 BEADLO COC(=O)C(C)(C)[N@@H+](C)Cc1csc(C)c1 ZINC000449021199 397950825 /nfs/dbraw/zinc/95/08/25/397950825.db2.gz YJFFDVJWCUQFMR-UHFFFAOYSA-N 1 2 241.356 2.440 20 0 BEADLO C[C@@H]([NH2+]Cc1nnc2n1CCC2)c1ccsc1 ZINC000268771407 397953917 /nfs/dbraw/zinc/95/39/17/397953917.db2.gz QASYBTYXZLCNET-SECBINFHSA-N 1 2 248.355 2.137 20 0 BEADLO CCc1cc(N[C@H](C)[C@H](OC)C2CC2)nc[nH+]1 ZINC000388245882 397955000 /nfs/dbraw/zinc/95/50/00/397955000.db2.gz SUJRXCUTCQENMX-RNCFNFMXSA-N 1 2 235.331 2.264 20 0 BEADLO CCCCCCNC(=O)[C@H]1CCc2[nH+]ccn2C1 ZINC000368797551 397918919 /nfs/dbraw/zinc/91/89/19/397918919.db2.gz LCNKEHWHCUOQDC-LBPRGKRZSA-N 1 2 249.358 2.142 20 0 BEADLO CC(F)(F)C[NH2+]Cc1cccc2c[nH]nc21 ZINC000382201711 397920818 /nfs/dbraw/zinc/92/08/18/397920818.db2.gz FFHJGDADVGEVLG-UHFFFAOYSA-N 1 2 225.242 2.308 20 0 BEADLO C[C@H](CC(=O)N1CC(C)(C)C[C@H]1C)n1cc[nH+]c1 ZINC000650098569 397920919 /nfs/dbraw/zinc/92/09/19/397920919.db2.gz JIKDYAGSMGJHTA-VXGBXAGGSA-N 1 2 249.358 2.481 20 0 BEADLO CCc1nocc1CNc1cc(COC)cc[nH+]1 ZINC000650243960 398006734 /nfs/dbraw/zinc/00/67/34/398006734.db2.gz WYFXQFWXFFXKNO-UHFFFAOYSA-N 1 2 247.298 2.391 20 0 BEADLO COC(=O)[C@H]1C[C@H](C)CC[N@@H+]1Cc1ccco1 ZINC000274969441 398017655 /nfs/dbraw/zinc/01/76/55/398017655.db2.gz VZEWQDPQOPOZLD-ZYHUDNBSSA-N 1 2 237.299 2.053 20 0 BEADLO COC(=O)[C@H]1C[C@H](C)CC[N@H+]1Cc1ccco1 ZINC000274969441 398017656 /nfs/dbraw/zinc/01/76/56/398017656.db2.gz VZEWQDPQOPOZLD-ZYHUDNBSSA-N 1 2 237.299 2.053 20 0 BEADLO CSCCC(=O)Nc1c[nH+]c2c(C)cccn12 ZINC000598264517 398029400 /nfs/dbraw/zinc/02/94/00/398029400.db2.gz XPBKVPYEAJSFNE-UHFFFAOYSA-N 1 2 249.339 2.334 20 0 BEADLO FC1(F)CCC[N@H+](C[C@@H]2CCCCO2)C1 ZINC000649691757 398038423 /nfs/dbraw/zinc/03/84/23/398038423.db2.gz RCTUEXZARGLMBD-JTQLQIEISA-N 1 2 219.275 2.287 20 0 BEADLO FC1(F)CCC[N@@H+](C[C@@H]2CCCCO2)C1 ZINC000649691757 398038427 /nfs/dbraw/zinc/03/84/27/398038427.db2.gz RCTUEXZARGLMBD-JTQLQIEISA-N 1 2 219.275 2.287 20 0 BEADLO CCOc1ccc(CNc2c[nH]c[nH+]2)cc1OC ZINC000582638311 398041440 /nfs/dbraw/zinc/04/14/40/398041440.db2.gz YVEQNKAEAJKYMB-UHFFFAOYSA-N 1 2 247.298 2.429 20 0 BEADLO Cc1noc(C[NH2+]C2(c3cccc(F)c3)CC2)n1 ZINC000271756971 397973475 /nfs/dbraw/zinc/97/34/75/397973475.db2.gz GYXAUWLCTWUJKW-UHFFFAOYSA-N 1 2 247.273 2.296 20 0 BEADLO FC1(F)CCC[N@H+](CC[C@@H]2CCCO2)C1 ZINC000649694987 398043118 /nfs/dbraw/zinc/04/31/18/398043118.db2.gz CROCRFCHMRGJFF-JTQLQIEISA-N 1 2 219.275 2.287 20 0 BEADLO FC1(F)CCC[N@@H+](CC[C@@H]2CCCO2)C1 ZINC000649694987 398043120 /nfs/dbraw/zinc/04/31/20/398043120.db2.gz CROCRFCHMRGJFF-JTQLQIEISA-N 1 2 219.275 2.287 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H]1C[C@H](C)C[C@H](C)C1 ZINC000272670067 397983101 /nfs/dbraw/zinc/98/31/01/397983101.db2.gz KLRQTTYOGZMKLT-IAZYJMLFSA-N 1 2 249.358 2.407 20 0 BEADLO CC[C@@H](C[N@@H+]1CCCC(F)(F)C1)OC ZINC000649695650 398044091 /nfs/dbraw/zinc/04/40/91/398044091.db2.gz CVMNOPDMHBUZEK-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CC[C@@H](C[N@H+]1CCCC(F)(F)C1)OC ZINC000649695650 398044094 /nfs/dbraw/zinc/04/40/94/398044094.db2.gz CVMNOPDMHBUZEK-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccon2)[C@@H](CC)CO1 ZINC000649717799 398059370 /nfs/dbraw/zinc/05/93/70/398059370.db2.gz MNANRGNGRNRBDB-NWDGAFQWSA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccon2)[C@@H](CC)CO1 ZINC000649717799 398059372 /nfs/dbraw/zinc/05/93/72/398059372.db2.gz MNANRGNGRNRBDB-NWDGAFQWSA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cnc(C)nc2)[C@@H](CC)CO1 ZINC000649718652 398060155 /nfs/dbraw/zinc/06/01/55/398060155.db2.gz DFJFNTWXUFBKRD-UONOGXRCSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cnc(C)nc2)[C@@H](CC)CO1 ZINC000649718652 398060157 /nfs/dbraw/zinc/06/01/57/398060157.db2.gz DFJFNTWXUFBKRD-UONOGXRCSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1Cc1ncc(C)o1 ZINC000649721246 398064975 /nfs/dbraw/zinc/06/49/75/398064975.db2.gz VAYIZQJWFBERGZ-NEPJUHHUSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@H+]1Cc1ncc(C)o1 ZINC000649721246 398064977 /nfs/dbraw/zinc/06/49/77/398064977.db2.gz VAYIZQJWFBERGZ-NEPJUHHUSA-N 1 2 238.331 2.372 20 0 BEADLO CC(C)COCC[N@H+](C)Cc1nccs1 ZINC000283263287 398071490 /nfs/dbraw/zinc/07/14/90/398071490.db2.gz KRJAPBHKOUKIIN-UHFFFAOYSA-N 1 2 228.361 2.248 20 0 BEADLO CC(C)COCC[N@@H+](C)Cc1nccs1 ZINC000283263287 398071495 /nfs/dbraw/zinc/07/14/95/398071495.db2.gz KRJAPBHKOUKIIN-UHFFFAOYSA-N 1 2 228.361 2.248 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cncc(F)c2)[C@H](C)CO1 ZINC000649736175 398077443 /nfs/dbraw/zinc/07/74/43/398077443.db2.gz XJSBDGBSLOQQLL-ZWNOBZJWSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cncc(F)c2)[C@H](C)CO1 ZINC000649736175 398077445 /nfs/dbraw/zinc/07/74/45/398077445.db2.gz XJSBDGBSLOQQLL-ZWNOBZJWSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cncc(F)c2)[C@@H](C)CO1 ZINC000649736172 398078128 /nfs/dbraw/zinc/07/81/28/398078128.db2.gz XJSBDGBSLOQQLL-GWCFXTLKSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cncc(F)c2)[C@@H](C)CO1 ZINC000649736172 398078131 /nfs/dbraw/zinc/07/81/31/398078131.db2.gz XJSBDGBSLOQQLL-GWCFXTLKSA-N 1 2 238.306 2.220 20 0 BEADLO Cc1cnn([C@H]2CC[N@H+](Cc3nccs3)C2)c1 ZINC000290035763 398087059 /nfs/dbraw/zinc/08/70/59/398087059.db2.gz WDZDIAMZYSUGGL-NSHDSACASA-N 1 2 248.355 2.095 20 0 BEADLO Cc1cnn([C@H]2CC[N@@H+](Cc3nccs3)C2)c1 ZINC000290035763 398087063 /nfs/dbraw/zinc/08/70/63/398087063.db2.gz WDZDIAMZYSUGGL-NSHDSACASA-N 1 2 248.355 2.095 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C)no2)[C@@H](CC)CO1 ZINC000649717768 398059255 /nfs/dbraw/zinc/05/92/55/398059255.db2.gz MEONBTUOTZSPLV-NWDGAFQWSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C)no2)[C@@H](CC)CO1 ZINC000649717768 398059257 /nfs/dbraw/zinc/05/92/57/398059257.db2.gz MEONBTUOTZSPLV-NWDGAFQWSA-N 1 2 238.331 2.372 20 0 BEADLO CO[C@@](C)(C(=O)Nc1cc[nH+]cc1C)C1CC1 ZINC000291706694 398099334 /nfs/dbraw/zinc/09/93/34/398099334.db2.gz OCTOFQBWMVMZKK-CYBMUJFWSA-N 1 2 234.299 2.144 20 0 BEADLO Cc1ccc(NC(=O)Nc2cc[nH]n2)c(C)[nH+]1 ZINC000192278657 398107989 /nfs/dbraw/zinc/10/79/89/398107989.db2.gz QAVHOZOBLNWFEC-UHFFFAOYSA-N 1 2 231.259 2.066 20 0 BEADLO C[C@H]1C[N@H+](Cc2nccs2)C2(CCC2)CO1 ZINC000649822526 398124334 /nfs/dbraw/zinc/12/43/34/398124334.db2.gz JIEFSAMORRSNLF-JTQLQIEISA-N 1 2 238.356 2.287 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nccs2)C2(CCC2)CO1 ZINC000649822526 398124337 /nfs/dbraw/zinc/12/43/37/398124337.db2.gz JIEFSAMORRSNLF-JTQLQIEISA-N 1 2 238.356 2.287 20 0 BEADLO Cc1sccc1C(=O)N(C)Cc1[nH+]ccn1C ZINC000294331924 398125301 /nfs/dbraw/zinc/12/53/01/398125301.db2.gz IBLMDSHLWATDQK-UHFFFAOYSA-N 1 2 249.339 2.062 20 0 BEADLO FC(F)n1cc[nH+]c1Cn1cc(C2CC2)cn1 ZINC000650344135 398131415 /nfs/dbraw/zinc/13/14/15/398131415.db2.gz XAYIBJVJVKLTNE-UHFFFAOYSA-N 1 2 238.241 2.400 20 0 BEADLO Cc1nc(C)c(CNc2nc(C)[nH+]cc2C)s1 ZINC000558529017 398123058 /nfs/dbraw/zinc/12/30/58/398123058.db2.gz QXLMEKIEAGYYFH-UHFFFAOYSA-N 1 2 248.355 2.201 20 0 BEADLO C[N@@H+](Cc1ncccn1)C[C@H]1CCC2(CCC2)O1 ZINC001648162170 1172806351 /nfs/dbraw/zinc/80/63/51/1172806351.db2.gz UFEAZQPGROVFDM-GFCCVEGCSA-N 1 2 247.342 2.010 20 0 BEADLO C[N@H+](Cc1ncccn1)C[C@H]1CCC2(CCC2)O1 ZINC001648162170 1172806355 /nfs/dbraw/zinc/80/63/55/1172806355.db2.gz UFEAZQPGROVFDM-GFCCVEGCSA-N 1 2 247.342 2.010 20 0 BEADLO CCc1ncnc(N[C@H](C)c2[nH]cc[nH+]2)c1F ZINC000227831125 487560198 /nfs/dbraw/zinc/56/01/98/487560198.db2.gz AFSASCLFSOVZKR-SSDOTTSWSA-N 1 2 235.266 2.074 20 0 BEADLO CCn1c[nH+]cc1CN(C)c1cccc(O)c1 ZINC000668802500 487566470 /nfs/dbraw/zinc/56/64/70/487566470.db2.gz PLPBNSNXWBVYSA-UHFFFAOYSA-N 1 2 231.299 2.245 20 0 BEADLO c1n[nH]c2c1CCC[C@H]2[NH2+]Cc1cnsc1 ZINC001650685266 1172891336 /nfs/dbraw/zinc/89/13/36/1172891336.db2.gz RXDKBFMCMNSSOJ-SNVBAGLBSA-N 1 2 234.328 2.033 20 0 BEADLO c1nscc1C[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC001650685266 1172891343 /nfs/dbraw/zinc/89/13/43/1172891343.db2.gz RXDKBFMCMNSSOJ-SNVBAGLBSA-N 1 2 234.328 2.033 20 0 BEADLO CC(C)OC1CC[NH+](Cc2ccon2)CC1 ZINC000530925425 322899010 /nfs/dbraw/zinc/89/90/10/322899010.db2.gz ZJZBIJDJVRWMRU-UHFFFAOYSA-N 1 2 224.304 2.064 20 0 BEADLO FC(F)C1C[NH+](Cc2ccncc2Cl)C1 ZINC000680363713 487575374 /nfs/dbraw/zinc/57/53/74/487575374.db2.gz GPKAABSIIJCVNR-UHFFFAOYSA-N 1 2 232.661 2.432 20 0 BEADLO CC(C)OCC[N@@H+]1CCO[C@H](c2ccco2)C1 ZINC000121246892 167235773 /nfs/dbraw/zinc/23/57/73/167235773.db2.gz USZYKZPBIYYWTO-ZDUSSCGKSA-N 1 2 239.315 2.078 20 0 BEADLO CC(C)OCC[N@H+]1CCO[C@H](c2ccco2)C1 ZINC000121246892 167235775 /nfs/dbraw/zinc/23/57/75/167235775.db2.gz USZYKZPBIYYWTO-ZDUSSCGKSA-N 1 2 239.315 2.078 20 0 BEADLO O=C(Cn1cc[nH+]c1)Nc1cscc1Cl ZINC001651292706 1172940438 /nfs/dbraw/zinc/94/04/38/1172940438.db2.gz HJMMTSSOYCGMJC-UHFFFAOYSA-N 1 2 241.703 2.237 20 0 BEADLO CCn1ccc(C[N@H+](C)Cc2[nH]ncc2C)c1 ZINC000685844493 487586588 /nfs/dbraw/zinc/58/65/88/487586588.db2.gz JLZCNEGJMIMSFL-UHFFFAOYSA-N 1 2 232.331 2.172 20 0 BEADLO CCn1ccc(C[N@@H+](C)Cc2[nH]ncc2C)c1 ZINC000685844493 487586593 /nfs/dbraw/zinc/58/65/93/487586593.db2.gz JLZCNEGJMIMSFL-UHFFFAOYSA-N 1 2 232.331 2.172 20 0 BEADLO CCn1ccc(C[N@H+](C)Cc2n[nH]cc2C)c1 ZINC000685844493 487586596 /nfs/dbraw/zinc/58/65/96/487586596.db2.gz JLZCNEGJMIMSFL-UHFFFAOYSA-N 1 2 232.331 2.172 20 0 BEADLO CCn1ccc(C[N@@H+](C)Cc2n[nH]cc2C)c1 ZINC000685844493 487586600 /nfs/dbraw/zinc/58/66/00/487586600.db2.gz JLZCNEGJMIMSFL-UHFFFAOYSA-N 1 2 232.331 2.172 20 0 BEADLO c1cc2cc(NCC[C@@H]3CCOC3)[nH+]cc2[nH]1 ZINC000672250691 487591536 /nfs/dbraw/zinc/59/15/36/487591536.db2.gz ABKRJAKBFBNVEF-SNVBAGLBSA-N 1 2 231.299 2.401 20 0 BEADLO CCC(CC)C[N@@H+]1CC[C@H](O)C(F)(F)C1 ZINC000661412061 487597285 /nfs/dbraw/zinc/59/72/85/487597285.db2.gz CJPNQNLZKLWWNB-JTQLQIEISA-N 1 2 221.291 2.125 20 0 BEADLO CCC(CC)C[N@H+]1CC[C@H](O)C(F)(F)C1 ZINC000661412061 487597289 /nfs/dbraw/zinc/59/72/89/487597289.db2.gz CJPNQNLZKLWWNB-JTQLQIEISA-N 1 2 221.291 2.125 20 0 BEADLO Cc1ccoc1C[N@@H+]1CCO[C@](C)(C(F)F)C1 ZINC000668824038 487606944 /nfs/dbraw/zinc/60/69/44/487606944.db2.gz DSLOYLFQUONTEL-LBPRGKRZSA-N 1 2 245.269 2.444 20 0 BEADLO Cc1ccoc1C[N@H+]1CCO[C@](C)(C(F)F)C1 ZINC000668824038 487606949 /nfs/dbraw/zinc/60/69/49/487606949.db2.gz DSLOYLFQUONTEL-LBPRGKRZSA-N 1 2 245.269 2.444 20 0 BEADLO Cc1nc(C[N@H+](C)CC2=CCSC2)c(C)o1 ZINC000662267336 409569620 /nfs/dbraw/zinc/56/96/20/409569620.db2.gz TYRFNROPNJRAHQ-UHFFFAOYSA-N 1 2 238.356 2.396 20 0 BEADLO Cc1nc(C[N@@H+](C)CC2=CCSC2)c(C)o1 ZINC000662267336 409569624 /nfs/dbraw/zinc/56/96/24/409569624.db2.gz TYRFNROPNJRAHQ-UHFFFAOYSA-N 1 2 238.356 2.396 20 0 BEADLO CC[C@@H]([NH2+]Cc1cnn[nH]1)c1ccccc1F ZINC000398297037 487611083 /nfs/dbraw/zinc/61/10/83/487611083.db2.gz OVXRGAPGJVKRCM-GFCCVEGCSA-N 1 2 234.278 2.185 20 0 BEADLO Cc1ccccc1[C@H](C)[N@H+](C)Cc1n[nH]c(=O)o1 ZINC000660848904 409859726 /nfs/dbraw/zinc/85/97/26/409859726.db2.gz RNNXFGGTCMOLFR-JTQLQIEISA-N 1 2 247.298 2.277 20 0 BEADLO Cc1ccccc1[C@H](C)[N@@H+](C)Cc1n[nH]c(=O)o1 ZINC000660848904 409859733 /nfs/dbraw/zinc/85/97/33/409859733.db2.gz RNNXFGGTCMOLFR-JTQLQIEISA-N 1 2 247.298 2.277 20 0 BEADLO CCn1cc(C[N@@H+]2C[C@H](C)OCC23CCC3)cn1 ZINC000651975442 409967166 /nfs/dbraw/zinc/96/71/66/409967166.db2.gz DCTIKJKWRHFZPH-LBPRGKRZSA-N 1 2 249.358 2.046 20 0 BEADLO CCn1cc(C[N@H+]2C[C@H](C)OCC23CCC3)cn1 ZINC000651975442 409967172 /nfs/dbraw/zinc/96/71/72/409967172.db2.gz DCTIKJKWRHFZPH-LBPRGKRZSA-N 1 2 249.358 2.046 20 0 BEADLO c1nn[nH]c1CC[N@@H+]1CCC[C@H]1CC1CCCC1 ZINC000660925597 409971822 /nfs/dbraw/zinc/97/18/22/409971822.db2.gz CKPOHLLCHFBFGC-AWEZNQCLSA-N 1 2 248.374 2.392 20 0 BEADLO c1nn[nH]c1CC[N@H+]1CCC[C@H]1CC1CCCC1 ZINC000660925597 409971827 /nfs/dbraw/zinc/97/18/27/409971827.db2.gz CKPOHLLCHFBFGC-AWEZNQCLSA-N 1 2 248.374 2.392 20 0 BEADLO CCOCn1c[nH+]c2c1C[C@@H](C)[C@@H](C)C2 ZINC000308951982 410073512 /nfs/dbraw/zinc/07/35/12/410073512.db2.gz VLZYVGVZEWBRQF-VHSXEESVSA-N 1 2 208.305 2.248 20 0 BEADLO COc1ccncc1C[N@@H+]1CCC[C@H]1CF ZINC000293088560 410075764 /nfs/dbraw/zinc/07/57/64/410075764.db2.gz PJKANTGKYAVIHX-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO COc1ccncc1C[N@H+]1CCC[C@H]1CF ZINC000293088560 410075773 /nfs/dbraw/zinc/07/57/73/410075773.db2.gz PJKANTGKYAVIHX-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2C[C@H]2C2CC2)c(C)c[nH+]1 ZINC000559406801 410172843 /nfs/dbraw/zinc/17/28/43/410172843.db2.gz BZPCREOCFONNHF-WCQYABFASA-N 1 2 245.326 2.040 20 0 BEADLO CN(CC(C)(C)C)c1cc(CO)cc[nH+]1 ZINC000045086247 410205879 /nfs/dbraw/zinc/20/58/79/410205879.db2.gz KYXVHWGAHRIOGQ-UHFFFAOYSA-N 1 2 208.305 2.056 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1C[C@H]1C1CCCC1)c1[nH]cc[nH+]1 ZINC000655402739 410209008 /nfs/dbraw/zinc/20/90/08/410209008.db2.gz PIWNMOXDFYZQCC-ADEWGFFLSA-N 1 2 247.342 2.413 20 0 BEADLO CC(C)c1nc(N(C)CC(F)F)cc[nH+]1 ZINC000112966360 410247701 /nfs/dbraw/zinc/24/77/01/410247701.db2.gz MCZCOVGOHUXSFJ-UHFFFAOYSA-N 1 2 215.247 2.301 20 0 BEADLO CCc1nc(C[N@@H+](CC)[C@H](C)CC)no1 ZINC000661108728 410260613 /nfs/dbraw/zinc/26/06/13/410260613.db2.gz NSASSKCJSMNSEK-SECBINFHSA-N 1 2 211.309 2.252 20 0 BEADLO CCc1nc(C[N@H+](CC)[C@H](C)CC)no1 ZINC000661108728 410260618 /nfs/dbraw/zinc/26/06/18/410260618.db2.gz NSASSKCJSMNSEK-SECBINFHSA-N 1 2 211.309 2.252 20 0 BEADLO Cc1nc(N2C[C@@H](C)[C@@H]2C)c(C)c(C)[nH+]1 ZINC000663948433 410396836 /nfs/dbraw/zinc/39/68/36/410396836.db2.gz YVTJXRPWCQWKAU-XCBNKYQSSA-N 1 2 205.305 2.246 20 0 BEADLO C(=C/c1cccc2[nH+]ccn21)\c1ccncn1 ZINC000354257164 166226816 /nfs/dbraw/zinc/22/68/16/166226816.db2.gz XRYQQQCJINLHDJ-SNAWJCMRSA-N 1 2 222.251 2.295 20 0 BEADLO Cc1cc(NC[C@]2(C)CC2(F)F)nc[nH+]1 ZINC000664398564 410577849 /nfs/dbraw/zinc/57/78/49/410577849.db2.gz PDYWFSGNPBTODA-VIFPVBQESA-N 1 2 213.231 2.242 20 0 BEADLO O[C@H]1C[C@H](Nc2cc[nH+]c(C3CC3)n2)C12CCC2 ZINC000664465148 410586884 /nfs/dbraw/zinc/58/68/84/410586884.db2.gz GKEJQRHRQDILDQ-QWRGUYRKSA-N 1 2 245.326 2.069 20 0 BEADLO CCCC(C)(C)C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000651111472 410811373 /nfs/dbraw/zinc/81/13/73/410811373.db2.gz GEWLHQKDIWOSIK-LLVKDONJSA-N 1 2 237.347 2.214 20 0 BEADLO C[C@H](c1ccccc1)[C@H](O)C[NH+]1CC(C)(F)C1 ZINC000651136248 410831523 /nfs/dbraw/zinc/83/15/23/410831523.db2.gz UAOXWQMHTICURL-DGCLKSJQSA-N 1 2 237.318 2.195 20 0 BEADLO CC(C)[C@@H](C)N(C)c1cc(CO)cc[nH+]1 ZINC000040878262 410894038 /nfs/dbraw/zinc/89/40/38/410894038.db2.gz UDHXKNQPSCDALS-SNVBAGLBSA-N 1 2 208.305 2.055 20 0 BEADLO CC(C)C[NH2+]c1ccc(NS(C)(=O)=O)cc1 ZINC000037076984 167016601 /nfs/dbraw/zinc/01/66/01/167016601.db2.gz GSHKKBJDOUQETH-UHFFFAOYSA-N 1 2 242.344 2.126 20 0 BEADLO Cc1[nH+]cccc1N[C@@H](C)Cc1cnccn1 ZINC000651300946 410908840 /nfs/dbraw/zinc/90/88/40/410908840.db2.gz UKIUXYGYTLUSJF-JTQLQIEISA-N 1 2 228.299 2.223 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CSC[C@@H]1C ZINC000397949632 410938312 /nfs/dbraw/zinc/93/83/12/410938312.db2.gz WAAXOWTYQFMSHD-IUCAKERBSA-N 1 2 224.329 2.254 20 0 BEADLO CC(C)[C@@H](C)C(=O)NCc1ccn2cc[nH+]c2c1 ZINC000178360473 167351676 /nfs/dbraw/zinc/35/16/76/167351676.db2.gz ALVKLKDSJXLJDQ-LLVKDONJSA-N 1 2 245.326 2.243 20 0 BEADLO CC(C)[C@@H](C)NC(=O)C[NH+]1Cc2ccccc2C1 ZINC000106306125 167373806 /nfs/dbraw/zinc/37/38/06/167373806.db2.gz FFGNYQLFVDNCCY-GFCCVEGCSA-N 1 2 246.354 2.163 20 0 BEADLO FC1(F)CCC[C@H]1N[C@H]1CCn2cc[nH+]c21 ZINC000398068929 410940893 /nfs/dbraw/zinc/94/08/93/410940893.db2.gz DCHXUSZJONNXSS-DTWKUNHWSA-N 1 2 227.258 2.105 20 0 BEADLO CC[C@@H]([NH2+][C@H](C)c1c[nH]nc1C)C(F)F ZINC000651364344 410952650 /nfs/dbraw/zinc/95/26/50/410952650.db2.gz KTHKWVMQFVNELQ-HZGVNTEJSA-N 1 2 217.263 2.412 20 0 BEADLO CC[C@@H]1COC(C)(C)CN1c1cc(C)[nH+]cn1 ZINC000651396862 410977651 /nfs/dbraw/zinc/97/76/51/410977651.db2.gz FMOCKJCPIXHWLW-LLVKDONJSA-N 1 2 235.331 2.179 20 0 BEADLO CC[C@H]1CN(c2cc[nH+]c(C3CC3)n2)[C@H](C)CO1 ZINC000651405342 410986563 /nfs/dbraw/zinc/98/65/63/410986563.db2.gz OFAPGABJAVICHN-PWSUYJOCSA-N 1 2 247.342 2.358 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H]1C[C@@H]1C1CCCC1 ZINC000651427300 411014951 /nfs/dbraw/zinc/01/49/51/411014951.db2.gz SIRYVZARLGPJAM-NEPJUHHUSA-N 1 2 247.342 2.161 20 0 BEADLO C[C@](O)(C[NH2+][C@H]1CCCC1(F)F)C(F)(F)F ZINC000398168679 410946005 /nfs/dbraw/zinc/94/60/05/410946005.db2.gz FANNZRUGMDPPQA-BQBZGAKWSA-N 1 2 247.207 2.077 20 0 BEADLO CCC1C[NH+](Cc2cn3cccc(F)c3n2)C1 ZINC000651610218 411129917 /nfs/dbraw/zinc/12/99/17/411129917.db2.gz FNVRAJWJXBDQIR-UHFFFAOYSA-N 1 2 233.290 2.315 20 0 BEADLO Cc1nc(C[N@@H+](C)CC2=CCCOC2)oc1C ZINC000661653591 411132059 /nfs/dbraw/zinc/13/20/59/411132059.db2.gz AHBRLZOEDGOYDH-UHFFFAOYSA-N 1 2 236.315 2.070 20 0 BEADLO Cc1nc(C[N@H+](C)CC2=CCCOC2)oc1C ZINC000661653591 411132061 /nfs/dbraw/zinc/13/20/61/411132061.db2.gz AHBRLZOEDGOYDH-UHFFFAOYSA-N 1 2 236.315 2.070 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CCC(F)(F)C1)c1[nH]cc[nH+]1 ZINC000302518042 411138046 /nfs/dbraw/zinc/13/80/46/411138046.db2.gz VXYMCHMUBWQPTP-SFYZADRCSA-N 1 2 243.257 2.022 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@@H](OC(C)C)C1 ZINC000651897378 411149310 /nfs/dbraw/zinc/14/93/10/411149310.db2.gz ZPYHTMYOQWUCRV-CYBMUJFWSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@@H](OC(C)C)C1 ZINC000651897378 411149311 /nfs/dbraw/zinc/14/93/11/411149311.db2.gz ZPYHTMYOQWUCRV-CYBMUJFWSA-N 1 2 237.347 2.108 20 0 BEADLO COCc1cc[nH+]c(N[C@H](C)C2CC2)c1 ZINC000652068096 411104973 /nfs/dbraw/zinc/10/49/73/411104973.db2.gz RIPQENBKGYROGF-SECBINFHSA-N 1 2 206.289 2.438 20 0 BEADLO CO[C@@H](C[N@H+](C)CC(F)F)C1CCCC1 ZINC000659878145 411170282 /nfs/dbraw/zinc/17/02/82/411170282.db2.gz ITZQWZIHYLRZLO-JTQLQIEISA-N 1 2 221.291 2.389 20 0 BEADLO CO[C@@H](C[N@@H+](C)CC(F)F)C1CCCC1 ZINC000659878145 411170285 /nfs/dbraw/zinc/17/02/85/411170285.db2.gz ITZQWZIHYLRZLO-JTQLQIEISA-N 1 2 221.291 2.389 20 0 BEADLO C[NH+](C)Cc1nc([C@@H]2CCC[C@@H]3C[C@@H]32)no1 ZINC000656049220 411170769 /nfs/dbraw/zinc/17/07/69/411170769.db2.gz LJAXDERNVWKCJL-BBBLOLIVSA-N 1 2 221.304 2.035 20 0 BEADLO c1cn(Cc2nc([C@@H]3CCC[C@H]4C[C@H]43)no2)c[nH+]1 ZINC000656049261 411170847 /nfs/dbraw/zinc/17/08/47/411170847.db2.gz LWURJNBNRUXJJO-HBNTYKKESA-N 1 2 244.298 2.218 20 0 BEADLO CCc1nnc([C@@H](C)[N@@H+]2CCC=C(C)C2)[nH]1 ZINC000660462756 411172946 /nfs/dbraw/zinc/17/29/46/411172946.db2.gz SULMMNKFFAYFTH-SNVBAGLBSA-N 1 2 220.320 2.080 20 0 BEADLO CCc1nnc([C@@H](C)[N@H+]2CCC=C(C)C2)[nH]1 ZINC000660462756 411172949 /nfs/dbraw/zinc/17/29/49/411172949.db2.gz SULMMNKFFAYFTH-SNVBAGLBSA-N 1 2 220.320 2.080 20 0 BEADLO COc1c(C)[nH+]cnc1N1C[C@H](C)C[C@H](C)C1 ZINC000656103709 411178855 /nfs/dbraw/zinc/17/88/55/411178855.db2.gz AHAJEYFQDFSUEI-AOOOYVTPSA-N 1 2 235.331 2.276 20 0 BEADLO CCCCCNc1nc[nH+]c(C)c1OC ZINC000656103942 411178866 /nfs/dbraw/zinc/17/88/66/411178866.db2.gz UOBRUPHRDRYEON-UHFFFAOYSA-N 1 2 209.293 2.396 20 0 BEADLO COc1c(C)[nH+]cnc1NCCC(C)C ZINC000656103813 411178974 /nfs/dbraw/zinc/17/89/74/411178974.db2.gz JZSXWUVATDKGOT-UHFFFAOYSA-N 1 2 209.293 2.252 20 0 BEADLO Cc1c[nH+]c(C)nc1NC[C@H](O)CC(C)(C)C ZINC000656126981 411183460 /nfs/dbraw/zinc/18/34/60/411183460.db2.gz GCYLCLWPPMNIKJ-LLVKDONJSA-N 1 2 237.347 2.302 20 0 BEADLO CCC[C@H](NC(=O)Cn1cc[nH+]c1)C(C)(C)C ZINC000653798532 411183748 /nfs/dbraw/zinc/18/37/48/411183748.db2.gz UKVJMEYMFIZASR-NSHDSACASA-N 1 2 237.347 2.214 20 0 BEADLO CO[C@@H]1C[C@H](Nc2nc(C)[nH+]cc2C)C1(C)C ZINC000656142223 411185234 /nfs/dbraw/zinc/18/52/34/411185234.db2.gz SQNZLNWWJYBMOI-WDEREUQCSA-N 1 2 235.331 2.319 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1CCCSC1 ZINC000656137416 411185423 /nfs/dbraw/zinc/18/54/23/411185423.db2.gz FHRYGFODIVWQBW-SECBINFHSA-N 1 2 239.344 2.101 20 0 BEADLO COc1c(C)[nH+]cnc1N1CC[C@H](C)[C@@H](C)C1 ZINC000656152040 411186975 /nfs/dbraw/zinc/18/69/75/411186975.db2.gz CYPLTCRLIOQUBW-UWVGGRQHSA-N 1 2 235.331 2.276 20 0 BEADLO COc1c(C)[nH+]c(C2CC2)nc1N1CC=CCC1 ZINC000656152946 411188698 /nfs/dbraw/zinc/18/86/98/411188698.db2.gz CQYLPYCKZFVJDG-UHFFFAOYSA-N 1 2 245.326 2.437 20 0 BEADLO COc1c(C)[nH+]cnc1NCC1(C(F)F)CC1 ZINC000656184389 411195895 /nfs/dbraw/zinc/19/58/95/411195895.db2.gz QQTJCSOTNJRFIT-UHFFFAOYSA-N 1 2 243.257 2.251 20 0 BEADLO Cc1ccncc1CNc1nc(C)[nH+]cc1C ZINC000656195714 411201075 /nfs/dbraw/zinc/20/10/75/411201075.db2.gz DAHFBMNYCGNDAN-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](C)c2cnn(C)c2)c1 ZINC000652330452 411202376 /nfs/dbraw/zinc/20/23/76/411202376.db2.gz GSKNKOBZLPIVFI-JTQLQIEISA-N 1 2 246.314 2.135 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](COC)C2CC2)c1 ZINC000652330437 411202505 /nfs/dbraw/zinc/20/25/05/411202505.db2.gz GECMARYQHGDFNC-LBPRGKRZSA-N 1 2 236.315 2.065 20 0 BEADLO COCc1cc[nH+]c(N[C@H](C)c2nccn2C)c1 ZINC000652330850 411202523 /nfs/dbraw/zinc/20/25/23/411202523.db2.gz QSSQVNMWYGSMOX-SNVBAGLBSA-N 1 2 246.314 2.135 20 0 BEADLO COc1c(C)[nH+]cnc1NC[C@@H]1C[C@H]1C1CC1 ZINC000656198037 411203515 /nfs/dbraw/zinc/20/35/15/411203515.db2.gz CLDRDVWYYAAKMN-QWRGUYRKSA-N 1 2 233.315 2.252 20 0 BEADLO CO[C@@](C)(CO)CNc1ccc2ccccc2[nH+]1 ZINC000656205555 411208066 /nfs/dbraw/zinc/20/80/66/411208066.db2.gz IWCNVBPGCXYNDG-CQSZACIVSA-N 1 2 246.310 2.044 20 0 BEADLO C[C@@H]1C[C@@H]1C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000048698141 411209020 /nfs/dbraw/zinc/20/90/20/411209020.db2.gz MOPBISHXAQHSDD-MNOVXSKESA-N 1 2 241.294 2.467 20 0 BEADLO C[C@H](O)C[N@H+](Cc1ncc(Cl)s1)C1CC1 ZINC000653901836 411215711 /nfs/dbraw/zinc/21/57/11/411215711.db2.gz FEVVUADWLKYINR-ZETCQYMHSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@H](O)C[N@@H+](Cc1ncc(Cl)s1)C1CC1 ZINC000653901836 411215714 /nfs/dbraw/zinc/21/57/14/411215714.db2.gz FEVVUADWLKYINR-ZETCQYMHSA-N 1 2 246.763 2.142 20 0 BEADLO c1nc(C[N@@H+]2CCC[C@H](OC3CCC3)C2)co1 ZINC000656272147 411222503 /nfs/dbraw/zinc/22/25/03/411222503.db2.gz PPGWFHVHWIQOEQ-ZDUSSCGKSA-N 1 2 236.315 2.208 20 0 BEADLO c1nc(C[N@H+]2CCC[C@H](OC3CCC3)C2)co1 ZINC000656272147 411222504 /nfs/dbraw/zinc/22/25/04/411222504.db2.gz PPGWFHVHWIQOEQ-ZDUSSCGKSA-N 1 2 236.315 2.208 20 0 BEADLO Cc1noc(C[N@@H+](C)Cc2ccsc2C)n1 ZINC000656279439 411228633 /nfs/dbraw/zinc/22/86/33/411228633.db2.gz SLIZNAHNQDPOBD-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1noc(C[N@H+](C)Cc2ccsc2C)n1 ZINC000656279439 411228634 /nfs/dbraw/zinc/22/86/34/411228634.db2.gz SLIZNAHNQDPOBD-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO CC(C)(NC(=O)CCCC1CC1)c1[nH]cc[nH+]1 ZINC000652413269 411234144 /nfs/dbraw/zinc/23/41/44/411234144.db2.gz KEYCTAUOYMSQEB-UHFFFAOYSA-N 1 2 235.331 2.341 20 0 BEADLO Cn1cc[nH+]c1-c1cccc2c1OCC2 ZINC000656371234 411236686 /nfs/dbraw/zinc/23/66/86/411236686.db2.gz AGLDIWWRBWRPCB-UHFFFAOYSA-N 1 2 200.241 2.022 20 0 BEADLO Cn1cc[nH+]c1-c1ccc(C[C@@H](O)C2CC2)cc1 ZINC000656371736 411238110 /nfs/dbraw/zinc/23/81/10/411238110.db2.gz REHQYRWMZQWPBU-CQSZACIVSA-N 1 2 242.322 2.401 20 0 BEADLO Fc1ccc(C[NH2+]Cc2cn(C3CC3)nn2)cc1 ZINC000656455758 411264681 /nfs/dbraw/zinc/26/46/81/411264681.db2.gz JRMPEEAYECLGSA-UHFFFAOYSA-N 1 2 246.289 2.042 20 0 BEADLO Cc1nc(C[NH2+][C@@H](CO)c2ccccc2)c(C)o1 ZINC000660177001 411283778 /nfs/dbraw/zinc/28/37/78/411283778.db2.gz ATPHQZBDNDHGAM-AWEZNQCLSA-N 1 2 246.310 2.115 20 0 BEADLO Cc1cnn(C)c1C[NH+]1CC(CC(F)(F)F)C1 ZINC000656688115 411328990 /nfs/dbraw/zinc/32/89/90/411328990.db2.gz HRTDISSPSTXZPO-UHFFFAOYSA-N 1 2 247.264 2.113 20 0 BEADLO CC(C)n1cc(C[NH+]2CC(C(F)F)C2)cn1 ZINC000656690994 411330570 /nfs/dbraw/zinc/33/05/70/411330570.db2.gz SRMVGQXWBSOUOC-UHFFFAOYSA-N 1 2 229.274 2.161 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc(C3CC3)no2)[C@H](C)CO1 ZINC000659822554 411305441 /nfs/dbraw/zinc/30/54/41/411305441.db2.gz OGUDZIGCQOKBGI-NXEZZACHSA-N 1 2 236.315 2.161 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc(C3CC3)no2)[C@H](C)CO1 ZINC000659822554 411305444 /nfs/dbraw/zinc/30/54/44/411305444.db2.gz OGUDZIGCQOKBGI-NXEZZACHSA-N 1 2 236.315 2.161 20 0 BEADLO Cc1ncc([C@H](C)[NH2+]Cc2ncccn2)s1 ZINC000658278322 411319409 /nfs/dbraw/zinc/31/94/09/411319409.db2.gz DQKVXGQLZJQFPD-QMMMGPOBSA-N 1 2 234.328 2.092 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC1(C)CC=CC1 ZINC000654025784 411319638 /nfs/dbraw/zinc/31/96/38/411319638.db2.gz ORALERJQGDONJX-UHFFFAOYSA-N 1 2 231.299 2.042 20 0 BEADLO c1cc([C@H]2CCC[N@H+]2CCc2cnn[nH]2)cs1 ZINC000659839276 411321165 /nfs/dbraw/zinc/32/11/65/411321165.db2.gz PUWJIVYMHMIZGL-GFCCVEGCSA-N 1 2 248.355 2.246 20 0 BEADLO c1cc([C@H]2CCC[N@@H+]2CCc2cnn[nH]2)cs1 ZINC000659839276 411321167 /nfs/dbraw/zinc/32/11/67/411321167.db2.gz PUWJIVYMHMIZGL-GFCCVEGCSA-N 1 2 248.355 2.246 20 0 BEADLO CCCN(C(=O)C[C@@H](C)n1cc[nH+]c1)C(C)C ZINC000654043164 411323673 /nfs/dbraw/zinc/32/36/73/411323673.db2.gz XUGTXQVSIUIJSC-GFCCVEGCSA-N 1 2 237.347 2.481 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cccc(F)c2)CCO1 ZINC000045752500 411248928 /nfs/dbraw/zinc/24/89/28/411248928.db2.gz FEXCJIDRXFHPLL-CYBMUJFWSA-N 1 2 223.291 2.437 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cccc(F)c2)CCO1 ZINC000045752500 411248931 /nfs/dbraw/zinc/24/89/31/411248931.db2.gz FEXCJIDRXFHPLL-CYBMUJFWSA-N 1 2 223.291 2.437 20 0 BEADLO C[C@@H](N[C@@H]1CCCn2cc[nH+]c21)C(F)(F)F ZINC000655767497 411249876 /nfs/dbraw/zinc/24/98/76/411249876.db2.gz GMASQPCKJZLBNG-HTQZYQBOSA-N 1 2 233.237 2.258 20 0 BEADLO Cc1noc(C)c1C[NH2+][C@@H]1CCCn2ccnc21 ZINC000655700505 411250621 /nfs/dbraw/zinc/25/06/21/411250621.db2.gz LKZUGOSDNQFWKV-GFCCVEGCSA-N 1 2 246.314 2.113 20 0 BEADLO CC(=O)C[N@H+](Cc1cccs1)C1CC1 ZINC000050154754 411254105 /nfs/dbraw/zinc/25/41/05/411254105.db2.gz BTHJVUKJFZWDGC-UHFFFAOYSA-N 1 2 209.314 2.302 20 0 BEADLO CC(=O)C[N@@H+](Cc1cccs1)C1CC1 ZINC000050154754 411254107 /nfs/dbraw/zinc/25/41/07/411254107.db2.gz BTHJVUKJFZWDGC-UHFFFAOYSA-N 1 2 209.314 2.302 20 0 BEADLO Cc1ncncc1[C@@H](C)[NH2+]Cc1cscn1 ZINC000655704124 411254579 /nfs/dbraw/zinc/25/45/79/411254579.db2.gz QDWSPEBMZBUJEX-MRVPVSSYSA-N 1 2 234.328 2.092 20 0 BEADLO Cc1cc[nH+]cc1Cc1nc([C@H]2CCCO2)no1 ZINC000656752824 411349453 /nfs/dbraw/zinc/34/94/53/411349453.db2.gz WHYZVLDUOLCXEH-LLVKDONJSA-N 1 2 245.282 2.215 20 0 BEADLO CCc1nnc(NCc2[nH+]ccn2C(C)C)o1 ZINC000656777075 411355855 /nfs/dbraw/zinc/35/58/55/411355855.db2.gz UZOFUPUJBZNFFQ-UHFFFAOYSA-N 1 2 235.291 2.022 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cn(C)cn2)s1 ZINC000659876248 411359811 /nfs/dbraw/zinc/35/98/11/411359811.db2.gz ZMYMJEAOPACQTG-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cn(C)cn2)s1 ZINC000659876248 411359815 /nfs/dbraw/zinc/35/98/15/411359815.db2.gz ZMYMJEAOPACQTG-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO C[N@H+](Cc1cnc[nH]1)Cc1cccc2c1NCC2 ZINC000656785193 411362041 /nfs/dbraw/zinc/36/20/41/411362041.db2.gz FPYGEBBTKMPVKG-UHFFFAOYSA-N 1 2 242.326 2.010 20 0 BEADLO C[N@@H+](Cc1cnc[nH]1)Cc1cccc2c1NCC2 ZINC000656785193 411362045 /nfs/dbraw/zinc/36/20/45/411362045.db2.gz FPYGEBBTKMPVKG-UHFFFAOYSA-N 1 2 242.326 2.010 20 0 BEADLO C[N@H+](Cc1c[nH]cn1)Cc1cccc2c1NCC2 ZINC000656785193 411362048 /nfs/dbraw/zinc/36/20/48/411362048.db2.gz FPYGEBBTKMPVKG-UHFFFAOYSA-N 1 2 242.326 2.010 20 0 BEADLO C[N@@H+](Cc1c[nH]cn1)Cc1cccc2c1NCC2 ZINC000656785193 411362052 /nfs/dbraw/zinc/36/20/52/411362052.db2.gz FPYGEBBTKMPVKG-UHFFFAOYSA-N 1 2 242.326 2.010 20 0 BEADLO COc1ncccc1NCc1[nH+]ccn1C(C)C ZINC000656770994 411362849 /nfs/dbraw/zinc/36/28/49/411362849.db2.gz AOZSFDMVRMCFLK-UHFFFAOYSA-N 1 2 246.314 2.480 20 0 BEADLO Cc1cc[nH+]cc1NCc1cc2n(n1)CCC2 ZINC000656771594 411364435 /nfs/dbraw/zinc/36/44/35/411364435.db2.gz VUDKINNKNBAUOH-UHFFFAOYSA-N 1 2 228.299 2.145 20 0 BEADLO CC1(CC(=O)NCCCn2cc[nH+]c2)CCCC1 ZINC000289954477 168016949 /nfs/dbraw/zinc/01/69/49/168016949.db2.gz PQFXXAKXFRXLIV-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO CC1(CNC(=O)CCc2c[nH+]c[nH]2)CCCC1 ZINC000188964102 168030291 /nfs/dbraw/zinc/03/02/91/168030291.db2.gz GVJHRYUKWCIGSC-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO CC1(CNC(=O)CCc2c[nH]c[nH+]2)CCCC1 ZINC000188964102 168030294 /nfs/dbraw/zinc/03/02/94/168030294.db2.gz GVJHRYUKWCIGSC-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO CC1(NC(=O)CCn2cc[nH+]c2)CCCCC1 ZINC000299626548 168054341 /nfs/dbraw/zinc/05/43/41/168054341.db2.gz FVOPDJLTGAESRC-UHFFFAOYSA-N 1 2 235.331 2.112 20 0 BEADLO CC1=C(C)C[N@H+]([C@@H](C)c2nnnn2C2CC2)CC1 ZINC000361612996 168085385 /nfs/dbraw/zinc/08/53/85/168085385.db2.gz WJSIBSAVLRARLR-NSHDSACASA-N 1 2 247.346 2.111 20 0 BEADLO CC1=C(C)C[N@@H+]([C@@H](C)c2nnnn2C2CC2)CC1 ZINC000361612996 168085388 /nfs/dbraw/zinc/08/53/88/168085388.db2.gz WJSIBSAVLRARLR-NSHDSACASA-N 1 2 247.346 2.111 20 0 BEADLO CC1=CCC[N@H+](Cc2nc(C3CC3)no2)C1 ZINC000280695052 168099345 /nfs/dbraw/zinc/09/93/45/168099345.db2.gz BQPKIMCMNIOPKM-UHFFFAOYSA-N 1 2 219.288 2.099 20 0 BEADLO CC1=CCC[N@@H+](Cc2nc(C3CC3)no2)C1 ZINC000280695052 168099348 /nfs/dbraw/zinc/09/93/48/168099348.db2.gz BQPKIMCMNIOPKM-UHFFFAOYSA-N 1 2 219.288 2.099 20 0 BEADLO CC1=CCN(C(=O)c2ccc3[nH+]ccn3c2)CC1 ZINC000270135620 168108961 /nfs/dbraw/zinc/10/89/61/168108961.db2.gz QEOJYAMKCKJVEJ-UHFFFAOYSA-N 1 2 241.294 2.127 20 0 BEADLO CC1=CC[N@H+](Cc2nc(C(C)C)no2)CC1 ZINC000270120981 168115621 /nfs/dbraw/zinc/11/56/21/168115621.db2.gz FUPHASHTKDJKFZ-UHFFFAOYSA-N 1 2 221.304 2.345 20 0 BEADLO CC1=CC[N@@H+](Cc2nc(C(C)C)no2)CC1 ZINC000270120981 168115624 /nfs/dbraw/zinc/11/56/24/168115624.db2.gz FUPHASHTKDJKFZ-UHFFFAOYSA-N 1 2 221.304 2.345 20 0 BEADLO CC1=CC[N@H+](Cc2nnc3n2CCCCC3)CC1 ZINC000270367041 168115832 /nfs/dbraw/zinc/11/58/32/168115832.db2.gz SPIMYIIDNQNYNU-UHFFFAOYSA-N 1 2 246.358 2.157 20 0 BEADLO CC1=CC[N@@H+](Cc2nnc3n2CCCCC3)CC1 ZINC000270367041 168115834 /nfs/dbraw/zinc/11/58/34/168115834.db2.gz SPIMYIIDNQNYNU-UHFFFAOYSA-N 1 2 246.358 2.157 20 0 BEADLO CCC(=O)CCC[N@H+](C)Cc1cc(C)on1 ZINC000289582629 168198942 /nfs/dbraw/zinc/19/89/42/168198942.db2.gz HLGVREOEGWNAMS-UHFFFAOYSA-N 1 2 224.304 2.174 20 0 BEADLO CCC(=O)CCC[N@@H+](C)Cc1cc(C)on1 ZINC000289582629 168198944 /nfs/dbraw/zinc/19/89/44/168198944.db2.gz HLGVREOEGWNAMS-UHFFFAOYSA-N 1 2 224.304 2.174 20 0 BEADLO CCC(=O)CC[N@@H+]1CCOC[C@H]1c1ccco1 ZINC000364606926 168203581 /nfs/dbraw/zinc/20/35/81/168203581.db2.gz MTQFGQKBBSNKDA-LBPRGKRZSA-N 1 2 237.299 2.022 20 0 BEADLO CCC(=O)CC[N@H+]1CCOC[C@H]1c1ccco1 ZINC000364606926 168203583 /nfs/dbraw/zinc/20/35/83/168203583.db2.gz MTQFGQKBBSNKDA-LBPRGKRZSA-N 1 2 237.299 2.022 20 0 BEADLO CCc1cn(C[C@@H](COC)C(C)C)c[nH+]1 ZINC001652207990 1173040736 /nfs/dbraw/zinc/04/07/36/1173040736.db2.gz MINOVCUWRXAYER-NSHDSACASA-N 1 2 210.321 2.364 20 0 BEADLO CCC(C)(C)Cc1nc(Cc2c[nH+]cn2C)no1 ZINC000357932435 168283940 /nfs/dbraw/zinc/28/39/40/168283940.db2.gz IHZVHPWHTSAIGO-UHFFFAOYSA-N 1 2 248.330 2.373 20 0 BEADLO CCC(C)(C)N(C)C(=O)[C@@H]1CCc2[nH+]ccn2C1 ZINC000364958683 168284903 /nfs/dbraw/zinc/28/49/03/168284903.db2.gz QVMQLLVZWDZNSU-LLVKDONJSA-N 1 2 249.358 2.093 20 0 BEADLO CCC(C)(CC)NC(=O)CCc1c[nH+]cn1C ZINC000276526914 168306856 /nfs/dbraw/zinc/30/68/56/168306856.db2.gz DEXUBHCNYQFAEA-UHFFFAOYSA-N 1 2 237.347 2.048 20 0 BEADLO Cc1cccc(C[NH2+]Cc2nccn2C(C)C)n1 ZINC000657319023 411460814 /nfs/dbraw/zinc/46/08/14/411460814.db2.gz ZVEDEKNOZAPWQI-UHFFFAOYSA-N 1 2 244.342 2.457 20 0 BEADLO COc1cc(NCc2[nH]cc(C)[nH+]2)cc(OC)c1 ZINC000657321040 411461403 /nfs/dbraw/zinc/46/14/03/411461403.db2.gz MNSIOZSJAWPWCQ-UHFFFAOYSA-N 1 2 247.298 2.347 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@@H]3COC[C@@H]32)cs1 ZINC000657208788 411419133 /nfs/dbraw/zinc/41/91/33/411419133.db2.gz AWIAYTMLMCSQTO-PWSUYJOCSA-N 1 2 238.356 2.062 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@@H]3COC[C@@H]32)cs1 ZINC000657208788 411419137 /nfs/dbraw/zinc/41/91/37/411419137.db2.gz AWIAYTMLMCSQTO-PWSUYJOCSA-N 1 2 238.356 2.062 20 0 BEADLO CC(C)CC1(C(=O)NCc2[nH+]ccn2C)CCC1 ZINC000268207763 411422938 /nfs/dbraw/zinc/42/29/38/411422938.db2.gz VAIPFUVYUSVMSG-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO c1c[nH+]c(COC[C@@H]2CC[C@@H]3C[C@@H]3C2)[nH]1 ZINC000657254647 411435913 /nfs/dbraw/zinc/43/59/13/411435913.db2.gz BILURTLIZLNEKG-MXWKQRLJSA-N 1 2 206.289 2.363 20 0 BEADLO CC(C)n1cc(C[N@H+](C)Cc2ccccn2)cn1 ZINC000273347589 411436862 /nfs/dbraw/zinc/43/68/62/411436862.db2.gz AJKRPSMWENTBAG-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO CC(C)n1cc(C[N@@H+](C)Cc2ccccn2)cn1 ZINC000273347589 411436866 /nfs/dbraw/zinc/43/68/66/411436866.db2.gz AJKRPSMWENTBAG-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO Cc1nc(COc2cc[nH+]cc2)oc1C ZINC000276423920 411441644 /nfs/dbraw/zinc/44/16/44/411441644.db2.gz HUPMYJXYJVPRHK-UHFFFAOYSA-N 1 2 204.229 2.265 20 0 BEADLO Cc1[nH]c(CN[C@H](C)c2ccccn2)[nH+]c1C ZINC000657287257 411446883 /nfs/dbraw/zinc/44/68/83/411446883.db2.gz JTOIWCJXTBWVPU-LLVKDONJSA-N 1 2 230.315 2.272 20 0 BEADLO Cc1nc(C[NH2+][C@H](C)c2ccccn2)[nH]c1C ZINC000657287257 411446885 /nfs/dbraw/zinc/44/68/85/411446885.db2.gz JTOIWCJXTBWVPU-LLVKDONJSA-N 1 2 230.315 2.272 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)NCCC3CC3)ccn12 ZINC000654839934 411453380 /nfs/dbraw/zinc/45/33/80/411453380.db2.gz CKJGDLJTFLOBJK-UHFFFAOYSA-N 1 2 243.310 2.173 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1O[C@H](C)C[C@H]1C ZINC000281832365 411454228 /nfs/dbraw/zinc/45/42/28/411454228.db2.gz IIUZZNZLOUFYDT-GIPNMCIBSA-N 1 2 248.326 2.396 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1nc(C)oc1C ZINC000659841326 411472700 /nfs/dbraw/zinc/47/27/00/411472700.db2.gz QIDTYIJOUHQPDR-BXKDBHETSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1nc(C)oc1C ZINC000659841326 411472702 /nfs/dbraw/zinc/47/27/02/411472702.db2.gz QIDTYIJOUHQPDR-BXKDBHETSA-N 1 2 238.331 2.291 20 0 BEADLO CCCn1nccc1C[NH2+]Cc1cc(CC)no1 ZINC000657374976 411482844 /nfs/dbraw/zinc/48/28/44/411482844.db2.gz UJTMYEAAIPNQQG-UHFFFAOYSA-N 1 2 248.330 2.133 20 0 BEADLO COCC[N@H+](CCC1CCC1)CC(F)F ZINC000659879811 411488548 /nfs/dbraw/zinc/48/85/48/411488548.db2.gz XRLFFOYHBPLLBU-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO COCC[N@@H+](CCC1CCC1)CC(F)F ZINC000659879811 411488551 /nfs/dbraw/zinc/48/85/51/411488551.db2.gz XRLFFOYHBPLLBU-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO Cc1c[nH]c(CNCc2nc(C)c(C)s2)[nH+]1 ZINC000657385509 411489415 /nfs/dbraw/zinc/48/94/15/411489415.db2.gz RFLLLHJOXBOTOB-UHFFFAOYSA-N 1 2 236.344 2.081 20 0 BEADLO Cc1c[nH]c(C[NH2+]Cc2nc(C)c(C)s2)n1 ZINC000657385509 411489417 /nfs/dbraw/zinc/48/94/17/411489417.db2.gz RFLLLHJOXBOTOB-UHFFFAOYSA-N 1 2 236.344 2.081 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@@H]2COc3ccc(C)cc32)n1 ZINC000657398999 411495286 /nfs/dbraw/zinc/49/52/86/411495286.db2.gz QTTQAQSVQIUSHC-GFCCVEGCSA-N 1 2 243.310 2.250 20 0 BEADLO COc1ncc(C)cc1NCc1[nH]cc(C)[nH+]1 ZINC000657412891 411498591 /nfs/dbraw/zinc/49/85/91/411498591.db2.gz JNYJQCCWHRSVNR-UHFFFAOYSA-N 1 2 232.287 2.042 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1C[C@H](C)[C@H](C)[C@@H]1C ZINC000655150396 411505852 /nfs/dbraw/zinc/50/58/52/411505852.db2.gz MCIXTSAOBWENEX-RHYQMDGZSA-N 1 2 249.358 2.091 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1C[C@H](C)[C@H](C)[C@@H]1C ZINC000655150396 411505855 /nfs/dbraw/zinc/50/58/55/411505855.db2.gz MCIXTSAOBWENEX-RHYQMDGZSA-N 1 2 249.358 2.091 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1C[C@H](C)[C@H](C)[C@H]1C ZINC000655150395 411505912 /nfs/dbraw/zinc/50/59/12/411505912.db2.gz MCIXTSAOBWENEX-NOOOWODRSA-N 1 2 249.358 2.091 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1C[C@H](C)[C@H](C)[C@H]1C ZINC000655150395 411505915 /nfs/dbraw/zinc/50/59/15/411505915.db2.gz MCIXTSAOBWENEX-NOOOWODRSA-N 1 2 249.358 2.091 20 0 BEADLO Cc1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)cc1F ZINC000334196196 411506907 /nfs/dbraw/zinc/50/69/07/411506907.db2.gz YRJQWVDMHVRSNF-BETUJISGSA-N 1 2 235.302 2.497 20 0 BEADLO Cc1ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)cc1F ZINC000334196196 411506910 /nfs/dbraw/zinc/50/69/10/411506910.db2.gz YRJQWVDMHVRSNF-BETUJISGSA-N 1 2 235.302 2.497 20 0 BEADLO Cc1[nH]c(CNC(C)(C)C(F)F)[nH+]c1C ZINC000657453447 411515313 /nfs/dbraw/zinc/51/53/13/411515313.db2.gz YOJFLDPUBHEQFR-UHFFFAOYSA-N 1 2 217.263 2.160 20 0 BEADLO FC1(F)CCC[C@H]1[NH2+]Cc1cnn2c1CCC2 ZINC000657467316 411520819 /nfs/dbraw/zinc/52/08/19/411520819.db2.gz IUKDVAWLRKESOC-LLVKDONJSA-N 1 2 241.285 2.107 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1cc2n(n1)CCC2 ZINC000657471709 411523254 /nfs/dbraw/zinc/52/32/54/411523254.db2.gz DVJPVWODBFEGIO-UHFFFAOYSA-N 1 2 231.299 2.021 20 0 BEADLO Cc1c[nH]c(CNC2(C(F)F)CCCC2)[nH+]1 ZINC000657467939 411523531 /nfs/dbraw/zinc/52/35/31/411523531.db2.gz FNNIRMDXXLPDIJ-UHFFFAOYSA-N 1 2 229.274 2.386 20 0 BEADLO Cc1[nH]c(CNc2cccc(CCO)c2)[nH+]c1C ZINC000657486627 411531259 /nfs/dbraw/zinc/53/12/59/411531259.db2.gz GMSBUPKGSVJHEE-UHFFFAOYSA-N 1 2 245.326 2.173 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2cn(C)cn2)c1 ZINC000659826231 411465740 /nfs/dbraw/zinc/46/57/40/411465740.db2.gz KALWTFBYHRCVQV-UHFFFAOYSA-N 1 2 245.326 2.061 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2cn(C)cn2)c1 ZINC000659826231 411465743 /nfs/dbraw/zinc/46/57/43/411465743.db2.gz KALWTFBYHRCVQV-UHFFFAOYSA-N 1 2 245.326 2.061 20 0 BEADLO c1cc(C[N@@H+]2CCc3n[nH]cc3C2)cs1 ZINC000660136028 411542754 /nfs/dbraw/zinc/54/27/54/411542754.db2.gz GVWFHQVEHTYKDQ-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO c1cc(C[N@H+]2CCc3n[nH]cc3C2)cs1 ZINC000660136028 411542755 /nfs/dbraw/zinc/54/27/55/411542755.db2.gz GVWFHQVEHTYKDQ-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO CCNC(=O)C[C@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000340951255 170069843 /nfs/dbraw/zinc/06/98/43/170069843.db2.gz NRFKOAKOZHPFJB-LBPRGKRZSA-N 1 2 243.310 2.068 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)nc(C)n1 ZINC000660220436 411555538 /nfs/dbraw/zinc/55/55/38/411555538.db2.gz IKLMVONHSAFLAV-RNCFNFMXSA-N 1 2 237.322 2.273 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)nc(C)n1 ZINC000660220436 411555539 /nfs/dbraw/zinc/55/55/39/411555539.db2.gz IKLMVONHSAFLAV-RNCFNFMXSA-N 1 2 237.322 2.273 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)c(C)o1 ZINC000660222099 411556138 /nfs/dbraw/zinc/55/61/38/411556138.db2.gz TUBBPFQVAZMETJ-KCJUWKMLSA-N 1 2 226.295 2.471 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)c(C)o1 ZINC000660222099 411556140 /nfs/dbraw/zinc/55/61/40/411556140.db2.gz TUBBPFQVAZMETJ-KCJUWKMLSA-N 1 2 226.295 2.471 20 0 BEADLO CO[C@@H](C[N@H+](C)Cc1ncc[nH]1)C1CCCC1 ZINC000660142475 411545083 /nfs/dbraw/zinc/54/50/83/411545083.db2.gz ZQZJFGJLTAERFM-LBPRGKRZSA-N 1 2 237.347 2.047 20 0 BEADLO CO[C@@H](C[N@@H+](C)Cc1ncc[nH]1)C1CCCC1 ZINC000660142475 411545085 /nfs/dbraw/zinc/54/50/85/411545085.db2.gz ZQZJFGJLTAERFM-LBPRGKRZSA-N 1 2 237.347 2.047 20 0 BEADLO FC1(F)CC2(C[NH+](Cc3cncs3)C2)C1 ZINC000660146479 411545724 /nfs/dbraw/zinc/54/57/24/411545724.db2.gz GQELEJPTSGFUBM-UHFFFAOYSA-N 1 2 230.283 2.374 20 0 BEADLO Cc1nocc1C[NH+]1CC2(C1)CC(F)(F)C2 ZINC000660147729 411545986 /nfs/dbraw/zinc/54/59/86/411545986.db2.gz PNRNATXCSAMXBD-UHFFFAOYSA-N 1 2 228.242 2.214 20 0 BEADLO CC[NH2+]c1ccc(O[C@@H]2CCOC2)cc1 ZINC000133505005 170174280 /nfs/dbraw/zinc/17/42/80/170174280.db2.gz PVNPJOQHKMVANE-GFCCVEGCSA-N 1 2 207.273 2.286 20 0 BEADLO CCNc1[nH+]cnc2c1cnn2C(C)(C)C ZINC000062366823 170178661 /nfs/dbraw/zinc/17/86/61/170178661.db2.gz MXHRLDWFTRATLW-UHFFFAOYSA-N 1 2 219.292 2.013 20 0 BEADLO CC[N@H+](Cc1cc(OC)no1)Cc1ccncc1 ZINC000660160631 411548819 /nfs/dbraw/zinc/54/88/19/411548819.db2.gz BMAKCOBDYCRGNR-UHFFFAOYSA-N 1 2 247.298 2.100 20 0 BEADLO CC[N@@H+](Cc1cc(OC)no1)Cc1ccncc1 ZINC000660160631 411548820 /nfs/dbraw/zinc/54/88/20/411548820.db2.gz BMAKCOBDYCRGNR-UHFFFAOYSA-N 1 2 247.298 2.100 20 0 BEADLO CCOC(=O)C(C)(C)[NH2+][C@@H]1C=CCCC1 ZINC000172825989 170187500 /nfs/dbraw/zinc/18/75/00/170187500.db2.gz AWBISXCKRYFKLF-SNVBAGLBSA-N 1 2 211.305 2.026 20 0 BEADLO CCOC(=O)C(CC)(CC)[NH2+]CCSC ZINC000336753488 170188122 /nfs/dbraw/zinc/18/81/22/170188122.db2.gz GSXPMUGOZCPPDG-UHFFFAOYSA-N 1 2 233.377 2.061 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1ccc(C)s1 ZINC000102794342 170214496 /nfs/dbraw/zinc/21/44/96/170214496.db2.gz SMDUXIQKGQQCJK-UHFFFAOYSA-N 1 2 227.329 2.051 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1ccc(C)s1 ZINC000102794342 170214497 /nfs/dbraw/zinc/21/44/97/170214497.db2.gz SMDUXIQKGQQCJK-UHFFFAOYSA-N 1 2 227.329 2.051 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1c(C)cccc1C ZINC000096811135 170215146 /nfs/dbraw/zinc/21/51/46/170215146.db2.gz RPBDLYMRYBSIPI-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1c(C)cccc1C ZINC000096811135 170215148 /nfs/dbraw/zinc/21/51/48/170215148.db2.gz RPBDLYMRYBSIPI-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO CCOC(=O)C[N@@H+]1C[C@H](C)[C@@H]1c1ccccc1 ZINC000081579110 170221791 /nfs/dbraw/zinc/22/17/91/170221791.db2.gz JBRBGILTPHFWDM-SMDDNHRTSA-N 1 2 233.311 2.243 20 0 BEADLO CCOC(=O)C[N@H+]1C[C@H](C)[C@@H]1c1ccccc1 ZINC000081579110 170221793 /nfs/dbraw/zinc/22/17/93/170221793.db2.gz JBRBGILTPHFWDM-SMDDNHRTSA-N 1 2 233.311 2.243 20 0 BEADLO CCOC(=O)C[NH2+][C@H](C)[C@@H](C)c1ccccc1 ZINC000181524343 170226362 /nfs/dbraw/zinc/22/63/62/170226362.db2.gz CJCKNWFPYLUOGW-VXGBXAGGSA-N 1 2 235.327 2.331 20 0 BEADLO CCOC(=O)C[NH2+][C@H](C)[C@H](C)c1ccccc1 ZINC000181524374 170226637 /nfs/dbraw/zinc/22/66/37/170226637.db2.gz CJCKNWFPYLUOGW-NWDGAFQWSA-N 1 2 235.327 2.331 20 0 BEADLO CCOC(=O)C[NH2+][C@H](c1ccccc1)C1CC1 ZINC000041064383 170227035 /nfs/dbraw/zinc/22/70/35/170227035.db2.gz WIUZISCQNQLYQA-CQSZACIVSA-N 1 2 233.311 2.290 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@H](OC(F)F)C2)co1 ZINC000660235529 411556990 /nfs/dbraw/zinc/55/69/90/411556990.db2.gz GUEPHSOZXFQBFL-JTQLQIEISA-N 1 2 246.257 2.187 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@H](OC(F)F)C2)co1 ZINC000660235529 411556992 /nfs/dbraw/zinc/55/69/92/411556992.db2.gz GUEPHSOZXFQBFL-JTQLQIEISA-N 1 2 246.257 2.187 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+](C)Cc1ccsc1 ZINC000043638578 170247240 /nfs/dbraw/zinc/24/72/40/170247240.db2.gz IMJQBKDRSNVRSX-SECBINFHSA-N 1 2 227.329 2.132 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+](C)Cc1ccsc1 ZINC000043638578 170247241 /nfs/dbraw/zinc/24/72/41/170247241.db2.gz IMJQBKDRSNVRSX-SECBINFHSA-N 1 2 227.329 2.132 20 0 BEADLO Cc1c[nH]c(CN[C@H](C)c2cscn2)[nH+]1 ZINC000657601001 411558481 /nfs/dbraw/zinc/55/84/81/411558481.db2.gz XFMPSKZPGCOJNX-MRVPVSSYSA-N 1 2 222.317 2.025 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+](C)Cc1ccc(C)cc1 ZINC000043638509 170265894 /nfs/dbraw/zinc/26/58/94/170265894.db2.gz BEBOSHIKJIULRQ-LBPRGKRZSA-N 1 2 235.327 2.378 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+](C)Cc1ccc(C)cc1 ZINC000043638509 170265895 /nfs/dbraw/zinc/26/58/95/170265895.db2.gz BEBOSHIKJIULRQ-LBPRGKRZSA-N 1 2 235.327 2.378 20 0 BEADLO CCOC(=O)[C@H](CC)[N@H+](C)Cc1ccc(C)o1 ZINC000077901421 170271107 /nfs/dbraw/zinc/27/11/07/170271107.db2.gz HCOIHRVXZZDRMO-LBPRGKRZSA-N 1 2 239.315 2.362 20 0 BEADLO CCOC(=O)[C@H](CC)[N@@H+](C)Cc1ccc(C)o1 ZINC000077901421 170271108 /nfs/dbraw/zinc/27/11/08/170271108.db2.gz HCOIHRVXZZDRMO-LBPRGKRZSA-N 1 2 239.315 2.362 20 0 BEADLO CCOC1CC(C(=O)Nc2cc[nH+]c(C)c2)C1 ZINC000289039030 170322457 /nfs/dbraw/zinc/32/24/57/170322457.db2.gz JYJVDUGYQMXFKQ-UHFFFAOYSA-N 1 2 234.299 2.144 20 0 BEADLO CCOC1CC(CSCCn2cc[nH+]c2)C1 ZINC000285196807 170326283 /nfs/dbraw/zinc/32/62/83/170326283.db2.gz VUACEGAFIOCCKD-UHFFFAOYSA-N 1 2 240.372 2.431 20 0 BEADLO CCOC1CC2(C1)CCN(c1cccc[nH+]1)C2 ZINC000286188651 170333125 /nfs/dbraw/zinc/33/31/25/170333125.db2.gz AHPWTQPJOHEAJG-UHFFFAOYSA-N 1 2 232.327 2.477 20 0 BEADLO CCOC1C[NH+](Cc2csc(C)c2)C1 ZINC000297367774 170336414 /nfs/dbraw/zinc/33/64/14/170336414.db2.gz HJGOTEXESKXQCM-UHFFFAOYSA-N 1 2 211.330 2.277 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)nc(C)n1 ZINC000660375748 411574852 /nfs/dbraw/zinc/57/48/52/411574852.db2.gz XMYDHIHJPVHVFA-SDDRHHMPSA-N 1 2 249.358 2.091 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)nc(C)n1 ZINC000660375748 411574853 /nfs/dbraw/zinc/57/48/53/411574853.db2.gz XMYDHIHJPVHVFA-SDDRHHMPSA-N 1 2 249.358 2.091 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)nc(C)n1 ZINC000660375749 411575061 /nfs/dbraw/zinc/57/50/61/411575061.db2.gz XMYDHIHJPVHVFA-SRVKXCTJSA-N 1 2 249.358 2.091 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)nc(C)n1 ZINC000660375749 411575062 /nfs/dbraw/zinc/57/50/62/411575062.db2.gz XMYDHIHJPVHVFA-SRVKXCTJSA-N 1 2 249.358 2.091 20 0 BEADLO CCOCCCCNc1cc[nH+]c(C)n1 ZINC000266329843 170370073 /nfs/dbraw/zinc/37/00/73/170370073.db2.gz GRQHVASGWSDTDU-UHFFFAOYSA-N 1 2 209.293 2.014 20 0 BEADLO O[C@@H]1C[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC(F)(F)C1 ZINC000660391401 411578711 /nfs/dbraw/zinc/57/87/11/411578711.db2.gz HVIVIUSYYIETLF-WYUUTHIRSA-N 1 2 245.313 2.125 20 0 BEADLO O[C@@H]1C[N@@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC(F)(F)C1 ZINC000660391401 411578713 /nfs/dbraw/zinc/57/87/13/411578713.db2.gz HVIVIUSYYIETLF-WYUUTHIRSA-N 1 2 245.313 2.125 20 0 BEADLO Cc1nc(C[N@@H+](C)Cc2cnccc2C)co1 ZINC000660451350 411586236 /nfs/dbraw/zinc/58/62/36/411586236.db2.gz SBZVYXJGGZRRMA-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1nc(C[N@H+](C)Cc2cnccc2C)co1 ZINC000660451350 411586237 /nfs/dbraw/zinc/58/62/37/411586237.db2.gz SBZVYXJGGZRRMA-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cn1c[nH+]cc1CNCC(F)(F)C(C)(C)C ZINC000657792345 411598127 /nfs/dbraw/zinc/59/81/27/411598127.db2.gz CDPMGPZCHBSYOR-UHFFFAOYSA-N 1 2 231.290 2.191 20 0 BEADLO Cc1c[nH]c(CNCC(F)(F)C(C)(C)C)[nH+]1 ZINC000657793080 411598853 /nfs/dbraw/zinc/59/88/53/411598853.db2.gz PTNWZHCCLKWERT-UHFFFAOYSA-N 1 2 231.290 2.489 20 0 BEADLO COc1cc(C[N@H+](C)Cc2ccc(C)cn2)on1 ZINC000660684132 411617315 /nfs/dbraw/zinc/61/73/15/411617315.db2.gz PHBBANNTFWOKLP-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2ccc(C)cn2)on1 ZINC000660684132 411617316 /nfs/dbraw/zinc/61/73/16/411617316.db2.gz PHBBANNTFWOKLP-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO F[C@H]1CC[N@H+](Cc2cnc3ccccc3n2)C1 ZINC000660692831 411618020 /nfs/dbraw/zinc/61/80/20/411618020.db2.gz SOIBYDGKFIKXLH-JTQLQIEISA-N 1 2 231.274 2.174 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2cnc3ccccc3n2)C1 ZINC000660692831 411618021 /nfs/dbraw/zinc/61/80/21/411618021.db2.gz SOIBYDGKFIKXLH-JTQLQIEISA-N 1 2 231.274 2.174 20 0 BEADLO CC[C@@H]1C[NH+](Cc2coc(C)n2)C[C@@H](CC)O1 ZINC000660834604 411651704 /nfs/dbraw/zinc/65/17/04/411651704.db2.gz ZLTYBPRYGOZCBD-CHWSQXEVSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cc(C)nc(C)n2)[C@@H](C)CO1 ZINC000660912631 411668735 /nfs/dbraw/zinc/66/87/35/411668735.db2.gz LNYXKKWBJVVPLU-FZMZJTMJSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cc(C)nc(C)n2)[C@@H](C)CO1 ZINC000660912631 411668739 /nfs/dbraw/zinc/66/87/39/411668739.db2.gz LNYXKKWBJVVPLU-FZMZJTMJSA-N 1 2 249.358 2.093 20 0 BEADLO CC1(C)C[C@@H]([N@@H+]2CCCC(F)(F)C2)CO1 ZINC000660911026 411669036 /nfs/dbraw/zinc/66/90/36/411669036.db2.gz DSQQPIUOGSZZON-SECBINFHSA-N 1 2 219.275 2.285 20 0 BEADLO CC1(C)C[C@@H]([N@H+]2CCCC(F)(F)C2)CO1 ZINC000660911026 411669040 /nfs/dbraw/zinc/66/90/40/411669040.db2.gz DSQQPIUOGSZZON-SECBINFHSA-N 1 2 219.275 2.285 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C)nc(C)n2)[C@@H](C)CO1 ZINC000660912634 411669382 /nfs/dbraw/zinc/66/93/82/411669382.db2.gz LNYXKKWBJVVPLU-SMDDNHRTSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C)nc(C)n2)[C@@H](C)CO1 ZINC000660912634 411669386 /nfs/dbraw/zinc/66/93/86/411669386.db2.gz LNYXKKWBJVVPLU-SMDDNHRTSA-N 1 2 249.358 2.093 20 0 BEADLO CCOc1ccc(C[NH+]2CCOCC2)cc1F ZINC000279485312 170543237 /nfs/dbraw/zinc/54/32/37/170543237.db2.gz LDTVYEYSJNEURN-UHFFFAOYSA-N 1 2 239.290 2.057 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)Cc1ccncc1Cl ZINC000661084408 411697627 /nfs/dbraw/zinc/69/76/27/411697627.db2.gz FJGBKYQYXYLSJI-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)Cc1ccncc1Cl ZINC000661084408 411697629 /nfs/dbraw/zinc/69/76/29/411697629.db2.gz FJGBKYQYXYLSJI-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO Cc1nsc(C)c1CN(C)Cc1c[nH+]c[nH]1 ZINC000661091413 411701489 /nfs/dbraw/zinc/70/14/89/411701489.db2.gz YHYZPTSEGBMUDT-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO CC(C)C[C@@H](C)C[N@@H+]1CC[C@H](O)C(F)(F)C1 ZINC000661406158 411768849 /nfs/dbraw/zinc/76/88/49/411768849.db2.gz INPAQYKNHWWMLC-MNOVXSKESA-N 1 2 235.318 2.371 20 0 BEADLO CC(C)C[C@@H](C)C[N@H+]1CC[C@H](O)C(F)(F)C1 ZINC000661406158 411768853 /nfs/dbraw/zinc/76/88/53/411768853.db2.gz INPAQYKNHWWMLC-MNOVXSKESA-N 1 2 235.318 2.371 20 0 BEADLO C[C@@H]1COC2(CCC2)C[N@@H+]1Cc1cncs1 ZINC000661461314 411779521 /nfs/dbraw/zinc/77/95/21/411779521.db2.gz CBRNKLISIKBTJM-SNVBAGLBSA-N 1 2 238.356 2.287 20 0 BEADLO C[C@@H]1COC2(CCC2)C[N@H+]1Cc1cncs1 ZINC000661461314 411779525 /nfs/dbraw/zinc/77/95/25/411779525.db2.gz CBRNKLISIKBTJM-SNVBAGLBSA-N 1 2 238.356 2.287 20 0 BEADLO Cc1cc(C[N@H+]2CC3(CCC3)OC[C@H]2C)on1 ZINC000661462805 411780436 /nfs/dbraw/zinc/78/04/36/411780436.db2.gz KJMGRLGGDMPQSF-LLVKDONJSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1cc(C[N@@H+]2CC3(CCC3)OC[C@H]2C)on1 ZINC000661462805 411780439 /nfs/dbraw/zinc/78/04/39/411780439.db2.gz KJMGRLGGDMPQSF-LLVKDONJSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1nocc1C[N@H+]1CC2(CCC2)OC[C@H]1C ZINC000661464044 411782356 /nfs/dbraw/zinc/78/23/56/411782356.db2.gz XEEATVFOAJFIFP-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1nocc1C[N@@H+]1CC2(CCC2)OC[C@H]1C ZINC000661464044 411782358 /nfs/dbraw/zinc/78/23/58/411782358.db2.gz XEEATVFOAJFIFP-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1cnc(C[N@H+]2CC3(CCC3)OC[C@@H]2C)o1 ZINC000661464967 411782685 /nfs/dbraw/zinc/78/26/85/411782685.db2.gz CUSSESTWCJEUKK-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO Cc1cnc(C[N@@H+]2CC3(CCC3)OC[C@@H]2C)o1 ZINC000661464967 411782688 /nfs/dbraw/zinc/78/26/88/411782688.db2.gz CUSSESTWCJEUKK-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO C[C@@H]1CN(c2cc[nH+]c(C3CC3)n2)[C@@H]1C ZINC000663946698 411786281 /nfs/dbraw/zinc/78/62/81/411786281.db2.gz LNKQVORRGQQBQR-RKDXNWHRSA-N 1 2 203.289 2.199 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)Nc1ccc(C)nn1 ZINC000663972900 411796809 /nfs/dbraw/zinc/79/68/09/411796809.db2.gz BBQZQIKMEIBRPM-SNVBAGLBSA-N 1 2 231.303 2.175 20 0 BEADLO Cc1cnc(N[C@@H]2C[C@@H](C)n3cc[nH+]c32)nc1 ZINC000663973012 411796989 /nfs/dbraw/zinc/79/69/89/411796989.db2.gz DGUPEMNKGZZGQB-NXEZZACHSA-N 1 2 229.287 2.099 20 0 BEADLO Cc1ncccc1C[NH+]1C[C@@H](C)C(=O)[C@H](C)C1 ZINC000661540318 411799273 /nfs/dbraw/zinc/79/92/73/411799273.db2.gz ZHMKMXIFZTXPIX-GHMZBOCLSA-N 1 2 232.327 2.047 20 0 BEADLO Cc1[nH+]c2cc(OCC[C@@H](C)O)ccc2n1C ZINC000664046408 411826904 /nfs/dbraw/zinc/82/69/04/411826904.db2.gz CYODHCFLXFWKAK-SECBINFHSA-N 1 2 234.299 2.031 20 0 BEADLO Cc1[nH+]c2cc(OC[C@H]3CCCO3)ccc2n1C ZINC000664046753 411827098 /nfs/dbraw/zinc/82/70/98/411827098.db2.gz ONZDPYIWXFWORU-GFCCVEGCSA-N 1 2 246.310 2.440 20 0 BEADLO CO[C@H](C)COc1ccc2c(c1)[nH+]c(C)n2C ZINC000664046529 411827289 /nfs/dbraw/zinc/82/72/89/411827289.db2.gz FWVNHFPKFBVSEY-SECBINFHSA-N 1 2 234.299 2.295 20 0 BEADLO Cc1cc(N2C[C@@H]3CCCC[C@@H]32)nc[nH+]1 ZINC000664082864 411845287 /nfs/dbraw/zinc/84/52/87/411845287.db2.gz LDEWNNLCDZPLNI-QWRGUYRKSA-N 1 2 203.289 2.164 20 0 BEADLO CC[C@@H](C)CCNc1nc(N(C)C)nc(C)[nH+]1 ZINC000664229821 411891019 /nfs/dbraw/zinc/89/10/19/411891019.db2.gz HYJBBYJJCXQTPM-SECBINFHSA-N 1 2 237.351 2.094 20 0 BEADLO CC[C@@H](C)CCNc1nc(C)[nH+]c(N(C)C)n1 ZINC000664229821 411891021 /nfs/dbraw/zinc/89/10/21/411891021.db2.gz HYJBBYJJCXQTPM-SECBINFHSA-N 1 2 237.351 2.094 20 0 BEADLO C[C@H]1COC2(CCC2)CN1c1cccc[nH+]1 ZINC000664277861 411910346 /nfs/dbraw/zinc/91/03/46/411910346.db2.gz IIIXQKUWFDDCET-NSHDSACASA-N 1 2 218.300 2.229 20 0 BEADLO CCO[C@H]1C[C@H](Nc2cc[nH+]c3ccncc23)C1 ZINC000664281002 411912095 /nfs/dbraw/zinc/91/20/95/411912095.db2.gz YIESQEYLKYLAPU-XYPYZODXSA-N 1 2 243.310 2.031 20 0 BEADLO O=C1CCCC12CC[NH+](Cc1ccon1)CC2 ZINC000661956331 411920791 /nfs/dbraw/zinc/92/07/91/411920791.db2.gz YQTKMJGDFITBTE-UHFFFAOYSA-N 1 2 234.299 2.010 20 0 BEADLO Cc1nc(C[NH+]2CCC3(CCCC3=O)CC2)co1 ZINC000661962800 411921622 /nfs/dbraw/zinc/92/16/22/411921622.db2.gz XYGRJELPKWHOTG-UHFFFAOYSA-N 1 2 248.326 2.318 20 0 BEADLO C[C@H]1COC2(CCCC2)C[N@@H+]1Cc1ncccn1 ZINC000661978084 411934507 /nfs/dbraw/zinc/93/45/07/411934507.db2.gz GEUYBQAHPZINTJ-LBPRGKRZSA-N 1 2 247.342 2.010 20 0 BEADLO C[C@H]1COC2(CCCC2)C[N@H+]1Cc1ncccn1 ZINC000661978084 411934510 /nfs/dbraw/zinc/93/45/10/411934510.db2.gz GEUYBQAHPZINTJ-LBPRGKRZSA-N 1 2 247.342 2.010 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@H]2COC(C)(C)C2)[nH+]1 ZINC000664144489 411870756 /nfs/dbraw/zinc/87/07/56/411870756.db2.gz LRKKFZQUAIWUAP-SECBINFHSA-N 1 2 246.314 2.246 20 0 BEADLO Cc1nc(NC[C@H]2CCC[C@H](C)O2)cc[nH+]1 ZINC000664393784 411941611 /nfs/dbraw/zinc/94/16/11/411941611.db2.gz HSNIEZBNYFYSQI-GXSJLCMTSA-N 1 2 221.304 2.155 20 0 BEADLO C[C@H](Nc1ncncc1Cl)c1[nH+]ccn1C ZINC000664608700 411998645 /nfs/dbraw/zinc/99/86/45/411998645.db2.gz JXQMYGUDTMPDFM-ZETCQYMHSA-N 1 2 237.694 2.037 20 0 BEADLO Cc1cc(N[C@@H](c2ccccc2)[C@H](C)O)nc[nH+]1 ZINC000664653744 412006388 /nfs/dbraw/zinc/00/63/88/412006388.db2.gz CAGHESHDQKFRLE-SMDDNHRTSA-N 1 2 243.310 2.319 20 0 BEADLO Cc1cc(NCCOCCF)nc(C2CC2)[nH+]1 ZINC000664674122 412007981 /nfs/dbraw/zinc/00/79/81/412007981.db2.gz COQLUXBZRKTSDG-UHFFFAOYSA-N 1 2 239.294 2.060 20 0 BEADLO CCc1cc(N2CC3CC2(C)C3)nc(C)[nH+]1 ZINC000664692811 412010642 /nfs/dbraw/zinc/01/06/42/412010642.db2.gz DMHJPVHPWBPWJT-UHFFFAOYSA-N 1 2 217.316 2.336 20 0 BEADLO C[C@]12COC[C@H]1CN(c1[nH]c3ccccc3[nH+]1)C2 ZINC000664421422 411950996 /nfs/dbraw/zinc/95/09/96/411950996.db2.gz JZSFKMUBFVYWGO-YGRLFVJLSA-N 1 2 243.310 2.036 20 0 BEADLO CC1(C)CN(Cc2c[nH+]c[nH]2)[C@@H]1c1cccnc1 ZINC000664821595 412027800 /nfs/dbraw/zinc/02/78/00/412027800.db2.gz FECLVKBYACVSLU-CYBMUJFWSA-N 1 2 242.326 2.388 20 0 BEADLO Cc1cc[nH+]cc1Cc1noc(C2CC2)n1 ZINC000664979470 412055654 /nfs/dbraw/zinc/05/56/54/412055654.db2.gz GKYVOXGTCBAQDC-UHFFFAOYSA-N 1 2 215.256 2.241 20 0 BEADLO CC[C@@H]1CCC[C@H]1c1nc(C[NH2+]C)no1 ZINC000332365745 171002432 /nfs/dbraw/zinc/00/24/32/171002432.db2.gz KOKUJKBYFWIHAB-RKDXNWHRSA-N 1 2 209.293 2.083 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1C(=O)CCn1cc[nH+]c1 ZINC000357175322 171051195 /nfs/dbraw/zinc/05/11/95/171051195.db2.gz LTXNTKVOSLGASE-NWDGAFQWSA-N 1 2 235.331 2.063 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cn[nH]c2C)CCS1 ZINC000093502436 171088317 /nfs/dbraw/zinc/08/83/17/171088317.db2.gz DCBWGRSPDPYPOX-LLVKDONJSA-N 1 2 225.361 2.046 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cn[nH]c2C)CCS1 ZINC000093502436 171088318 /nfs/dbraw/zinc/08/83/18/171088318.db2.gz DCBWGRSPDPYPOX-LLVKDONJSA-N 1 2 225.361 2.046 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(O)cc(F)c2)CCO1 ZINC000184147924 171088718 /nfs/dbraw/zinc/08/87/18/171088718.db2.gz IZECISLLFCHBJY-CYBMUJFWSA-N 1 2 239.290 2.142 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(O)cc(F)c2)CCO1 ZINC000184147924 171088721 /nfs/dbraw/zinc/08/87/21/171088721.db2.gz IZECISLLFCHBJY-CYBMUJFWSA-N 1 2 239.290 2.142 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cocn2)CCS1 ZINC000191944189 171090740 /nfs/dbraw/zinc/09/07/40/171090740.db2.gz YITHSTWWJCNWMJ-SNVBAGLBSA-N 1 2 212.318 2.002 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cocn2)CCS1 ZINC000191944189 171090742 /nfs/dbraw/zinc/09/07/42/171090742.db2.gz YITHSTWWJCNWMJ-SNVBAGLBSA-N 1 2 212.318 2.002 20 0 BEADLO CC[C@@H]1COCCN1C(=O)Nc1cc[nH+]c(C)c1 ZINC000119493550 171104504 /nfs/dbraw/zinc/10/45/04/171104504.db2.gz HVBRGGDIJUXRRR-GFCCVEGCSA-N 1 2 249.314 2.033 20 0 BEADLO CC[C@@H]1C[C@@H](C[NH2+]CC(F)(F)F)CCO1 ZINC000336744067 171119046 /nfs/dbraw/zinc/11/90/46/171119046.db2.gz YVTXFYKADOTOJM-DTWKUNHWSA-N 1 2 225.254 2.344 20 0 BEADLO CC[C@@H]1C[C@@H]1Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000348188180 171121403 /nfs/dbraw/zinc/12/14/03/171121403.db2.gz UXACNTHHNCOEEF-KOLCDFICSA-N 1 2 217.316 2.295 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)Nc1c[nH+]c2n1CCCC2 ZINC000336304851 171131261 /nfs/dbraw/zinc/13/12/61/171131261.db2.gz LNIUYIQFEBSQCD-NXEZZACHSA-N 1 2 233.315 2.204 20 0 BEADLO CC[C@@H]1C[C@H]1NC(=O)Nc1cc[nH+]c(C)c1 ZINC000280808423 171138458 /nfs/dbraw/zinc/13/84/58/171138458.db2.gz ZCLATAJMPIFYKB-MWLCHTKSSA-N 1 2 219.288 2.310 20 0 BEADLO Cc1ccc2nc(C[NH+]3CC4(CC4)C3)cn2c1 ZINC000335376834 487621788 /nfs/dbraw/zinc/62/17/88/487621788.db2.gz XZIMPAZHHJAMCW-UHFFFAOYSA-N 1 2 227.311 2.239 20 0 BEADLO CC[C@@H]1[C@@H](C)CCN1c1cc[nH+]c(C)n1 ZINC000185929221 171157645 /nfs/dbraw/zinc/15/76/45/171157645.db2.gz KRPYEIDGSGLRSF-GXSJLCMTSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1ccc2[nH+]c(CN3CC4(CC4)C3)cn2c1 ZINC000335376834 487621791 /nfs/dbraw/zinc/62/17/91/487621791.db2.gz XZIMPAZHHJAMCW-UHFFFAOYSA-N 1 2 227.311 2.239 20 0 BEADLO CC[C@@](C)(OC)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000297811619 171191285 /nfs/dbraw/zinc/19/12/85/171191285.db2.gz PJFJJDKGOWYNEJ-CYBMUJFWSA-N 1 2 247.298 2.088 20 0 BEADLO CC[C@H](C)C(=O)N1CC(C)(C)[C@H]1c1[nH+]ccn1C ZINC000295988043 171247251 /nfs/dbraw/zinc/24/72/51/171247251.db2.gz UMKMDNYQAWBIBJ-WDEREUQCSA-N 1 2 249.358 2.376 20 0 BEADLO CC[C@H](C)C(=O)N1CC[C@H](Oc2cc[nH+]cc2)C1 ZINC000120896764 171249074 /nfs/dbraw/zinc/24/90/74/171249074.db2.gz KGWAIDHJWZTTPJ-AAEUAGOBSA-N 1 2 248.326 2.107 20 0 BEADLO CC[C@H](C)CC(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000190793018 171258049 /nfs/dbraw/zinc/25/80/49/171258049.db2.gz JCJLMZCTLGRHKQ-LBPRGKRZSA-N 1 2 249.358 2.483 20 0 BEADLO CC[C@H](C)CC(=O)N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000358940729 171258765 /nfs/dbraw/zinc/25/87/65/171258765.db2.gz WXCZDIOEIYXFSW-NWDGAFQWSA-N 1 2 249.358 2.172 20 0 BEADLO CC[C@H](C)CN(CC)C(=O)CCc1[nH]cc[nH+]1 ZINC000289202107 171276760 /nfs/dbraw/zinc/27/67/60/171276760.db2.gz MEOLHYJHSNFDPN-NSHDSACASA-N 1 2 237.347 2.237 20 0 BEADLO CC[C@H](C)[N@H+](CC(=O)OC)Cc1ccco1 ZINC000299356022 171311765 /nfs/dbraw/zinc/31/17/65/171311765.db2.gz CVVRQPYKGZEZLH-JTQLQIEISA-N 1 2 225.288 2.053 20 0 BEADLO CC[C@H](C)[N@@H+](CC(=O)OC)Cc1ccco1 ZINC000299356022 171311767 /nfs/dbraw/zinc/31/17/67/171311767.db2.gz CVVRQPYKGZEZLH-JTQLQIEISA-N 1 2 225.288 2.053 20 0 BEADLO CC[C@H](C)[NH+]=c1[nH]c2c(cccc2F)n1C ZINC000336723171 171319833 /nfs/dbraw/zinc/31/98/33/171319833.db2.gz DXFFLWDPTNLAMG-QMMMGPOBSA-N 1 2 221.279 2.345 20 0 BEADLO CC[C@H](C)[NH+]=c1[nH]c2cccc(F)c2n1C ZINC000336747584 171320888 /nfs/dbraw/zinc/32/08/88/171320888.db2.gz XHMPKLADKCKVDS-QMMMGPOBSA-N 1 2 221.279 2.345 20 0 BEADLO CC[C@H](C)NC(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000117559589 171337281 /nfs/dbraw/zinc/33/72/81/171337281.db2.gz XTDAZQZMBFLVFR-NSHDSACASA-N 1 2 243.310 2.401 20 0 BEADLO CC[C@H](C)OCC(=O)Nc1cc[nH+]cc1C ZINC000127700550 171354809 /nfs/dbraw/zinc/35/48/09/171354809.db2.gz OZQRYLALDCZUEA-JTQLQIEISA-N 1 2 222.288 2.144 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000330944732 171363637 /nfs/dbraw/zinc/36/36/37/171363637.db2.gz GMRYTUWBHXSLRZ-AXFHLTTASA-N 1 2 249.358 2.380 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)[C@H]1CCCc2[nH]c[nH+]c21 ZINC000330944732 171363638 /nfs/dbraw/zinc/36/36/38/171363638.db2.gz GMRYTUWBHXSLRZ-AXFHLTTASA-N 1 2 249.358 2.380 20 0 BEADLO CCCN(CCC)C(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000665101989 412094791 /nfs/dbraw/zinc/09/47/91/412094791.db2.gz JVBNDDRAHKUVEM-VXGBXAGGSA-N 1 2 249.358 2.172 20 0 BEADLO Cc1nnc([C@H](C)[N@H+](C)Cc2ccsc2)[nH]1 ZINC000662344062 412114191 /nfs/dbraw/zinc/11/41/91/412114191.db2.gz DFNLCPORRPMXDI-QMMMGPOBSA-N 1 2 236.344 2.368 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+](C)Cc2ccsc2)[nH]1 ZINC000662344062 412114194 /nfs/dbraw/zinc/11/41/94/412114194.db2.gz DFNLCPORRPMXDI-QMMMGPOBSA-N 1 2 236.344 2.368 20 0 BEADLO CCCCN(CC)C(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000665168372 412119024 /nfs/dbraw/zinc/11/90/24/412119024.db2.gz FMBOAVXQXZTBOK-VXGBXAGGSA-N 1 2 249.358 2.172 20 0 BEADLO Cn1cc[nH+]c1-c1cccc2c1COCC2 ZINC000665180421 412120750 /nfs/dbraw/zinc/12/07/50/412120750.db2.gz DDXDZESVCUPBCD-UHFFFAOYSA-N 1 2 214.268 2.160 20 0 BEADLO CC[C@H]([NH2+]Cc1cc[nH]n1)c1c(C)noc1C ZINC000121193841 171530372 /nfs/dbraw/zinc/53/03/72/171530372.db2.gz UFTNEIKNAAHSCK-NSHDSACASA-N 1 2 234.303 2.255 20 0 BEADLO c1cn(Cc2nc(C3CCOCC3)cs2)c[nH+]1 ZINC000663220021 412394580 /nfs/dbraw/zinc/39/45/80/412394580.db2.gz MMJYIDRFFMLKHE-UHFFFAOYSA-N 1 2 249.339 2.282 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C1CCOCC1 ZINC000265003152 171924039 /nfs/dbraw/zinc/92/40/39/171924039.db2.gz MMUISGUEZKOKTG-UHFFFAOYSA-N 1 2 234.299 2.009 20 0 BEADLO CCc1nc([C@@H]2CCCC[N@H+]2CC)no1 ZINC000377430710 172004261 /nfs/dbraw/zinc/00/42/61/172004261.db2.gz UZFUKQNQPCIRTR-VIFPVBQESA-N 1 2 209.293 2.179 20 0 BEADLO CCc1nc([C@@H]2CCCC[N@@H+]2CC)no1 ZINC000377430710 172004263 /nfs/dbraw/zinc/00/42/63/172004263.db2.gz UZFUKQNQPCIRTR-VIFPVBQESA-N 1 2 209.293 2.179 20 0 BEADLO CCc1ccc(C[NH2+][C@@H](C)c2nnc(CC)[nH]2)o1 ZINC000270620984 172005596 /nfs/dbraw/zinc/00/55/96/172005596.db2.gz CFXNHNLJKNWGNO-VIFPVBQESA-N 1 2 248.330 2.373 20 0 BEADLO CCc1[nH+]c2ccccc2n1C[C@@H](O)CC ZINC000062807772 172014008 /nfs/dbraw/zinc/01/40/08/172014008.db2.gz MTOPYAGDFIIZDD-JTQLQIEISA-N 1 2 218.300 2.370 20 0 BEADLO CCc1nnc(C[NH2+][C@@H](C)c2cccc(O)c2)o1 ZINC000181485055 172053474 /nfs/dbraw/zinc/05/34/74/172053474.db2.gz KLFOHQUOQBFPLW-VIFPVBQESA-N 1 2 247.298 2.188 20 0 BEADLO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2cccnc2)o1 ZINC000361099273 172064665 /nfs/dbraw/zinc/06/46/65/172064665.db2.gz ZMTRYUFOJKKXCV-NXEZZACHSA-N 1 2 246.314 2.439 20 0 BEADLO CCc1noc(CC)c1C[NH2+]Cc1[nH]ncc1C ZINC000289609340 172083723 /nfs/dbraw/zinc/08/37/23/172083723.db2.gz VOMQZSQNWBBINY-UHFFFAOYSA-N 1 2 248.330 2.121 20 0 BEADLO CCc1noc(CC)c1C[NH2+]Cc1n[nH]cc1C ZINC000289609340 172083724 /nfs/dbraw/zinc/08/37/24/172083724.db2.gz VOMQZSQNWBBINY-UHFFFAOYSA-N 1 2 248.330 2.121 20 0 BEADLO CCc1noc([C@H](C)[NH2+][C@@H](C)c2cccnc2)n1 ZINC000182885664 172092322 /nfs/dbraw/zinc/09/23/22/172092322.db2.gz RIRIZYIRFIJLIO-UWVGGRQHSA-N 1 2 246.314 2.439 20 0 BEADLO CCc1nocc1C[N@H+](C)[C@H](C)c1cnccn1 ZINC000293386540 172094841 /nfs/dbraw/zinc/09/48/41/172094841.db2.gz KHPLDEYORNLFAD-SNVBAGLBSA-N 1 2 246.314 2.220 20 0 BEADLO CCc1nocc1C[N@@H+](C)[C@H](C)c1cnccn1 ZINC000293386540 172094843 /nfs/dbraw/zinc/09/48/43/172094843.db2.gz KHPLDEYORNLFAD-SNVBAGLBSA-N 1 2 246.314 2.220 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1ccncc1 ZINC000293456282 172095550 /nfs/dbraw/zinc/09/55/50/172095550.db2.gz PUYCPUVJVLCNIK-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1ccncc1 ZINC000293456282 172095552 /nfs/dbraw/zinc/09/55/52/172095552.db2.gz PUYCPUVJVLCNIK-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1nocc1C[NH+](C)Cc1conc1CC ZINC000354356284 172096117 /nfs/dbraw/zinc/09/61/17/172096117.db2.gz QBQHTBZADPYJDY-UHFFFAOYSA-N 1 2 249.314 2.419 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1cnn(CC)c1 ZINC000295489921 172096720 /nfs/dbraw/zinc/09/67/20/172096720.db2.gz XPQCEPBUNOVLDS-UHFFFAOYSA-N 1 2 248.330 2.085 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1cnn(CC)c1 ZINC000295489921 172096724 /nfs/dbraw/zinc/09/67/24/172096724.db2.gz XPQCEPBUNOVLDS-UHFFFAOYSA-N 1 2 248.330 2.085 20 0 BEADLO CCc1nocc1C[N@@H+]1CC[C@](C)(F)C1 ZINC000336603843 172097435 /nfs/dbraw/zinc/09/74/35/172097435.db2.gz IRXFEYJZUOBIPA-NSHDSACASA-N 1 2 212.268 2.171 20 0 BEADLO CCc1nocc1C[N@H+]1CC[C@](C)(F)C1 ZINC000336603843 172097436 /nfs/dbraw/zinc/09/74/36/172097436.db2.gz IRXFEYJZUOBIPA-NSHDSACASA-N 1 2 212.268 2.171 20 0 BEADLO CCn1cc[nH+]c1CN(C)CCC(F)(F)F ZINC000336683046 172217512 /nfs/dbraw/zinc/21/75/12/172217512.db2.gz SBORALJKZFPOMI-UHFFFAOYSA-N 1 2 235.253 2.287 20 0 BEADLO CCn1cc[nH+]c1CNc1ccn(C(C)C)n1 ZINC000305894323 172226685 /nfs/dbraw/zinc/22/66/85/172226685.db2.gz XRLHHDIPWWYIKE-UHFFFAOYSA-N 1 2 233.319 2.293 20 0 BEADLO CCn1cc[nH+]c1CNc1ccc2n[nH]cc2c1 ZINC000032597839 172226768 /nfs/dbraw/zinc/22/67/68/172226768.db2.gz IPQCHHNIGVIIHY-UHFFFAOYSA-N 1 2 241.298 2.391 20 0 BEADLO CCn1ccnc1[C@H](C)[NH2+]Cc1ccco1 ZINC000295224066 172229811 /nfs/dbraw/zinc/22/98/11/172229811.db2.gz NALRMIFVAFXBRN-JTQLQIEISA-N 1 2 219.288 2.347 20 0 BEADLO CCn1cnnc1C[NH2+][C@H](C)c1cc(C)oc1C ZINC000219256948 172237364 /nfs/dbraw/zinc/23/73/64/172237364.db2.gz CKHJJJYQNCTOIU-SNVBAGLBSA-N 1 2 248.330 2.359 20 0 BEADLO CCn1nccc1C[N@H+](C)Cc1cnccc1C ZINC000352368476 172265037 /nfs/dbraw/zinc/26/50/37/172265037.db2.gz IKCATMSHPQBNFA-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1nccc1C[N@@H+](C)Cc1cnccc1C ZINC000352368476 172265039 /nfs/dbraw/zinc/26/50/39/172265039.db2.gz IKCATMSHPQBNFA-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1ncnc1C[NH2+][C@@H](C)c1ccc(C)o1 ZINC000088589961 172281621 /nfs/dbraw/zinc/28/16/21/172281621.db2.gz CTGFLWIRSUWRDZ-JTQLQIEISA-N 1 2 234.303 2.050 20 0 BEADLO CN(C(=O)C(C)(C)c1c[nH+]c[nH]1)C1CCCCC1 ZINC000335756777 172296226 /nfs/dbraw/zinc/29/62/26/172296226.db2.gz GUHDXOHFHOANQG-UHFFFAOYSA-N 1 2 249.358 2.478 20 0 BEADLO Cn1ncc(Cl)c1C[N@H+](C)C1CCC1 ZINC000275680058 172837451 /nfs/dbraw/zinc/83/74/51/172837451.db2.gz HJMAOGUQVSDVOL-UHFFFAOYSA-N 1 2 213.712 2.058 20 0 BEADLO Cn1ncc(Cl)c1C[N@@H+](C)C1CCC1 ZINC000275680058 172837454 /nfs/dbraw/zinc/83/74/54/172837454.db2.gz HJMAOGUQVSDVOL-UHFFFAOYSA-N 1 2 213.712 2.058 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)Cc1c[nH]nc1C(C)(C)C ZINC000353531086 172845482 /nfs/dbraw/zinc/84/54/82/172845482.db2.gz UCXWUELROHXSDA-UHFFFAOYSA-N 1 2 247.346 2.062 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)Cc1c[nH]nc1C(C)(C)C ZINC000353531086 172845485 /nfs/dbraw/zinc/84/54/85/172845485.db2.gz UCXWUELROHXSDA-UHFFFAOYSA-N 1 2 247.346 2.062 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)Cc1ccc(Cl)nc1 ZINC000114188248 172851274 /nfs/dbraw/zinc/85/12/74/172851274.db2.gz XVEUGBHJBPEJCM-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)Cc1ccc(Cl)nc1 ZINC000114188248 172851277 /nfs/dbraw/zinc/85/12/77/172851277.db2.gz XVEUGBHJBPEJCM-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2CCC[C@H](C)C2)n1 ZINC000334554815 173399967 /nfs/dbraw/zinc/39/99/67/173399967.db2.gz DGSOUBBAFSULBF-DTWKUNHWSA-N 1 2 209.293 2.083 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H]1CC[C@@H](c2ccccc2)C1 ZINC000271257311 173786608 /nfs/dbraw/zinc/78/66/08/173786608.db2.gz HKZUHFGFKZOVNM-IACUBPJLSA-N 1 2 247.338 2.474 20 0 BEADLO COC(=O)[C@H]([NH2+]Cc1ccc(C)s1)C1CC1 ZINC000227768741 173804323 /nfs/dbraw/zinc/80/43/23/173804323.db2.gz ZMUVKACBYVDULO-LLVKDONJSA-N 1 2 239.340 2.098 20 0 BEADLO COC(=O)[C@H]([NH2+]Cc1ccc(F)cc1)C(C)C ZINC000068740500 173804619 /nfs/dbraw/zinc/80/46/19/173804619.db2.gz IPEMWZNKZWNGCP-GFCCVEGCSA-N 1 2 239.290 2.113 20 0 BEADLO COC1CCN(C(=O)Nc2cc[nH+]cc2C)CC1 ZINC000271136920 174026688 /nfs/dbraw/zinc/02/66/88/174026688.db2.gz OWYNNQBYYHPFFJ-UHFFFAOYSA-N 1 2 249.314 2.033 20 0 BEADLO COCC1=CC[N@H+](Cc2ncc(C3CC3)o2)CC1 ZINC000274993979 174116733 /nfs/dbraw/zinc/11/67/33/174116733.db2.gz OHWKIMGRPAEOIH-UHFFFAOYSA-N 1 2 248.326 2.331 20 0 BEADLO COCC1=CC[N@@H+](Cc2ncc(C3CC3)o2)CC1 ZINC000274993979 174116734 /nfs/dbraw/zinc/11/67/34/174116734.db2.gz OHWKIMGRPAEOIH-UHFFFAOYSA-N 1 2 248.326 2.331 20 0 BEADLO COCCCCCNc1cc(C)[nH+]cn1 ZINC000225732485 174184071 /nfs/dbraw/zinc/18/40/71/174184071.db2.gz UUWPCXOEYKETRK-UHFFFAOYSA-N 1 2 209.293 2.014 20 0 BEADLO COCCC[N@@H+]1CCn2c(cc3ccccc32)C1 ZINC000361563435 174235082 /nfs/dbraw/zinc/23/50/82/174235082.db2.gz IIUQIIWEHJBNMV-UHFFFAOYSA-N 1 2 244.338 2.493 20 0 BEADLO COCCC[N@H+]1CCn2c(cc3ccccc32)C1 ZINC000361563435 174235084 /nfs/dbraw/zinc/23/50/84/174235084.db2.gz IIUQIIWEHJBNMV-UHFFFAOYSA-N 1 2 244.338 2.493 20 0 BEADLO COCCC[N@@H+]1Cc2ccc(C(C)=O)cc2C1 ZINC000058011769 174235682 /nfs/dbraw/zinc/23/56/82/174235682.db2.gz MYJZNFKABFLPMZ-UHFFFAOYSA-N 1 2 233.311 2.241 20 0 BEADLO COCCC[N@H+]1Cc2ccc(C(C)=O)cc2C1 ZINC000058011769 174235685 /nfs/dbraw/zinc/23/56/85/174235685.db2.gz MYJZNFKABFLPMZ-UHFFFAOYSA-N 1 2 233.311 2.241 20 0 BEADLO COCCN(c1cc(C)[nH+]cn1)[C@H]1CC[C@@H](C)C1 ZINC000302731827 174301862 /nfs/dbraw/zinc/30/18/62/174301862.db2.gz TUPSTPPBPJNNOS-YPMHNXCESA-N 1 2 249.358 2.426 20 0 BEADLO COCCN(c1cc(C)[nH+]cn1)[C@@H]1CC[C@@H](C)C1 ZINC000302731825 174302458 /nfs/dbraw/zinc/30/24/58/174302458.db2.gz TUPSTPPBPJNNOS-DGCLKSJQSA-N 1 2 249.358 2.426 20 0 BEADLO COCC[N@@H+]1C[C@H](C)O[C@@H](c2ccsc2)C1 ZINC000120819614 174317991 /nfs/dbraw/zinc/31/79/91/174317991.db2.gz FIRSGEGUMGLERD-CMPLNLGQSA-N 1 2 241.356 2.156 20 0 BEADLO COCC[N@H+]1C[C@H](C)O[C@@H](c2ccsc2)C1 ZINC000120819614 174317993 /nfs/dbraw/zinc/31/79/93/174317993.db2.gz FIRSGEGUMGLERD-CMPLNLGQSA-N 1 2 241.356 2.156 20 0 BEADLO COCC[C@@H](C)Nc1nc(N)c2ccccc2[nH+]1 ZINC000301873974 174387409 /nfs/dbraw/zinc/38/74/09/174387409.db2.gz JSJAKGJUEKNHNI-SECBINFHSA-N 1 2 246.314 2.049 20 0 BEADLO C[C@H](COc1ccccc1F)[NH2+]Cc1ccn[nH]1 ZINC000066989334 1173065119 /nfs/dbraw/zinc/06/51/19/1173065119.db2.gz QLJVNNZBMNFTII-SNVBAGLBSA-N 1 2 249.289 2.106 20 0 BEADLO COc1cc([NH2+]C[C@H]2CCCOC2)ccc1N ZINC000104252286 175002610 /nfs/dbraw/zinc/00/26/10/175002610.db2.gz HNTOUPHQISQSTH-SNVBAGLBSA-N 1 2 236.315 2.116 20 0 BEADLO COc1cc(NCc2[nH]cc[nH+]2)ccc1F ZINC000083351061 175003807 /nfs/dbraw/zinc/00/38/07/175003807.db2.gz XONVQATXLQQIPT-UHFFFAOYSA-N 1 2 221.235 2.170 20 0 BEADLO COc1cc([C@H](C)Nc2cc(C)[nH+]cn2)ccn1 ZINC000340934385 175015745 /nfs/dbraw/zinc/01/57/45/175015745.db2.gz GUJHEEMUUZFXJY-JTQLQIEISA-N 1 2 244.298 2.362 20 0 BEADLO C[C@@H](COc1ccccc1F)[NH2+]Cc1ccn[nH]1 ZINC000066989333 1173065576 /nfs/dbraw/zinc/06/55/76/1173065576.db2.gz QLJVNNZBMNFTII-JTQLQIEISA-N 1 2 249.289 2.106 20 0 BEADLO Cc1cc(C)cc(OCC[NH2+]Cc2ccn[nH]2)c1 ZINC000066990414 1173065713 /nfs/dbraw/zinc/06/57/13/1173065713.db2.gz YEJRLEKMWYGHPZ-UHFFFAOYSA-N 1 2 245.326 2.195 20 0 BEADLO COc1ccc(C[N@H+](C)[C@@H](C)c2ccco2)nn1 ZINC000338239158 175096444 /nfs/dbraw/zinc/09/64/44/175096444.db2.gz ZTEMWEIXKNIUSQ-JTQLQIEISA-N 1 2 247.298 2.271 20 0 BEADLO COc1ccc(C[N@@H+](C)[C@@H](C)c2ccco2)nn1 ZINC000338239158 175096446 /nfs/dbraw/zinc/09/64/46/175096446.db2.gz ZTEMWEIXKNIUSQ-JTQLQIEISA-N 1 2 247.298 2.271 20 0 BEADLO COc1ccc(C[NH2+]Cc2cn[nH]c2C)cc1F ZINC000037989151 175108791 /nfs/dbraw/zinc/10/87/91/175108791.db2.gz APFRJJNOWAQSCI-UHFFFAOYSA-N 1 2 249.289 2.156 20 0 BEADLO F[C@@H]1CCC[N@H+](Cc2ccnn2CC2CC2)C1 ZINC000668292838 487630058 /nfs/dbraw/zinc/63/00/58/487630058.db2.gz POOCMBHASQIKJO-GFCCVEGCSA-N 1 2 237.322 2.227 20 0 BEADLO COc1ccc([C@H](C)[NH2+]Cc2csnn2)cc1 ZINC000090339920 175189469 /nfs/dbraw/zinc/18/94/69/175189469.db2.gz SZSLNXUITZMLKO-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO F[C@@H]1CCC[N@@H+](Cc2ccnn2CC2CC2)C1 ZINC000668292838 487630063 /nfs/dbraw/zinc/63/00/63/487630063.db2.gz POOCMBHASQIKJO-GFCCVEGCSA-N 1 2 237.322 2.227 20 0 BEADLO CCCn1nccc1C[N@@H+]1CCC[C@H](F)C1 ZINC000668292832 487630121 /nfs/dbraw/zinc/63/01/21/487630121.db2.gz PNPIQDACPSIYKF-NSHDSACASA-N 1 2 225.311 2.227 20 0 BEADLO CCCn1nccc1C[N@H+]1CCC[C@H](F)C1 ZINC000668292832 487630125 /nfs/dbraw/zinc/63/01/25/487630125.db2.gz PNPIQDACPSIYKF-NSHDSACASA-N 1 2 225.311 2.227 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2nonc2C)c1 ZINC000265007682 175255830 /nfs/dbraw/zinc/25/58/30/175255830.db2.gz GOFWIKBZWGTBJI-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2nonc2C)c1 ZINC000265007682 175255832 /nfs/dbraw/zinc/25/58/32/175255832.db2.gz GOFWIKBZWGTBJI-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2ccon2)c1 ZINC000265426317 175255919 /nfs/dbraw/zinc/25/59/19/175255919.db2.gz LHGZUZZUAWBNJU-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2ccon2)c1 ZINC000265426317 175255920 /nfs/dbraw/zinc/25/59/20/175255920.db2.gz LHGZUZZUAWBNJU-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1cccc([C@@H](C)[NH2+]Cc2csnn2)c1 ZINC000037771546 175287993 /nfs/dbraw/zinc/28/79/93/175287993.db2.gz VIUCPAFYZRZGBW-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO COc1cccc2c(NC[C@@H](C)CO)cc[nH+]c12 ZINC000275507227 175300067 /nfs/dbraw/zinc/30/00/67/175300067.db2.gz MURRKWJNBSWFEK-SNVBAGLBSA-N 1 2 246.310 2.284 20 0 BEADLO COc1ccccc1CCNc1cc(C)[nH+]cn1 ZINC000225685087 175323560 /nfs/dbraw/zinc/32/35/60/175323560.db2.gz POQXAAPUPCNIER-UHFFFAOYSA-N 1 2 243.310 2.448 20 0 BEADLO COc1ccccc1CN(C)Cc1[nH]cc[nH+]1 ZINC000171911938 175326092 /nfs/dbraw/zinc/32/60/92/175326092.db2.gz WYXCKMWLWJTRFG-UHFFFAOYSA-N 1 2 231.299 2.050 20 0 BEADLO COc1ccccc1C[N@@H+]1CCC(=O)C[C@H]1C ZINC000049708121 175326219 /nfs/dbraw/zinc/32/62/19/175326219.db2.gz KSOUDCHMNMMDLE-LLVKDONJSA-N 1 2 233.311 2.249 20 0 BEADLO COc1ccccc1C[N@H+]1CCC(=O)C[C@H]1C ZINC000049708121 175326221 /nfs/dbraw/zinc/32/62/21/175326221.db2.gz KSOUDCHMNMMDLE-LLVKDONJSA-N 1 2 233.311 2.249 20 0 BEADLO COc1ccccc1C[NH2+]Cc1ncc(C)n1C ZINC000341073008 175329784 /nfs/dbraw/zinc/32/97/84/175329784.db2.gz APHYNROEONXWSO-UHFFFAOYSA-N 1 2 245.326 2.027 20 0 BEADLO COc1ccccc1CNCc1[nH+]cc(C)n1C ZINC000341073008 175329785 /nfs/dbraw/zinc/32/97/85/175329785.db2.gz APHYNROEONXWSO-UHFFFAOYSA-N 1 2 245.326 2.027 20 0 BEADLO COc1ccccc1NCc1[nH]cc[nH+]1 ZINC000049714473 175337538 /nfs/dbraw/zinc/33/75/38/175337538.db2.gz RFVFOXRZJGADKR-UHFFFAOYSA-N 1 2 203.245 2.030 20 0 BEADLO COc1ccccc1[C@H](C)[NH2+]Cc1cc[nH]n1 ZINC000036900114 175351811 /nfs/dbraw/zinc/35/18/11/175351811.db2.gz GGWGGKALLFBHED-JTQLQIEISA-N 1 2 231.299 2.269 20 0 BEADLO COc1ccnc(C[N@H+](C)Cc2ccco2)c1 ZINC000106859460 175357672 /nfs/dbraw/zinc/35/76/72/175357672.db2.gz NGEOSPVSCRLSEH-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1ccnc(C[N@@H+](C)Cc2ccco2)c1 ZINC000106859460 175357674 /nfs/dbraw/zinc/35/76/74/175357674.db2.gz NGEOSPVSCRLSEH-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1cc[nH+]c(CN(C)Cc2ccco2)c1 ZINC000106859460 175357676 /nfs/dbraw/zinc/35/76/76/175357676.db2.gz NGEOSPVSCRLSEH-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)C[C@H]1C=CCC1 ZINC000294619093 175369973 /nfs/dbraw/zinc/36/99/73/175369973.db2.gz OMPIUVNFNNEVPP-NSHDSACASA-N 1 2 246.310 2.063 20 0 BEADLO COc1ccncc1C[N@@H+]1CCC[C@](C)(F)C1 ZINC000295498959 175369997 /nfs/dbraw/zinc/36/99/97/175369997.db2.gz SKHFXNYDEGKHCU-ZDUSSCGKSA-N 1 2 238.306 2.414 20 0 BEADLO COc1ccncc1C[N@H+]1CCC[C@](C)(F)C1 ZINC000295498959 175370000 /nfs/dbraw/zinc/37/00/00/175370000.db2.gz SKHFXNYDEGKHCU-ZDUSSCGKSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cc[nH+]cc1COC(=O)C=C1CCC1 ZINC000286880173 175372841 /nfs/dbraw/zinc/37/28/41/175372841.db2.gz FDJUDKLNMJRPPK-UHFFFAOYSA-N 1 2 233.267 2.244 20 0 BEADLO COc1cc[nH+]cc1COC(=O)CC(F)(F)F ZINC000290192671 175372872 /nfs/dbraw/zinc/37/28/72/175372872.db2.gz UBABUNDEEZDKAI-UHFFFAOYSA-N 1 2 249.188 2.086 20 0 BEADLO COc1cc[nH+]cc1COc1cccnc1OC ZINC000341390165 175373487 /nfs/dbraw/zinc/37/34/87/175373487.db2.gz KZCFNYLMVYYQGN-UHFFFAOYSA-N 1 2 246.266 2.073 20 0 BEADLO COc1cc[nH+]cc1CSCc1ccnn1C ZINC000289311001 175373499 /nfs/dbraw/zinc/37/34/99/175373499.db2.gz ANBICTONFOOSIP-UHFFFAOYSA-N 1 2 249.339 2.257 20 0 BEADLO COc1ccncc1C[NH2+][C@H](C)c1cscn1 ZINC000294097533 175373735 /nfs/dbraw/zinc/37/37/35/175373735.db2.gz JDYJPQXIXMRMBQ-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO COc1cc[nH+]cc1Cn1cnc2ccccc21 ZINC000336792056 175374202 /nfs/dbraw/zinc/37/42/02/175374202.db2.gz QGLMPVUTUKTPKB-UHFFFAOYSA-N 1 2 239.278 2.488 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C[C@H]1C[C@H]1C ZINC000355257998 175375279 /nfs/dbraw/zinc/37/52/79/175375279.db2.gz UTOZDXAYQSNJED-RKDXNWHRSA-N 1 2 220.272 2.075 20 0 BEADLO COc1ccsc1C[N@@H+]1CCOCC1(C)C ZINC000271138347 175378322 /nfs/dbraw/zinc/37/83/22/175378322.db2.gz NTXYULMQMDFNDC-UHFFFAOYSA-N 1 2 241.356 2.368 20 0 BEADLO COc1ccsc1C[N@H+]1CCOCC1(C)C ZINC000271138347 175378323 /nfs/dbraw/zinc/37/83/23/175378323.db2.gz NTXYULMQMDFNDC-UHFFFAOYSA-N 1 2 241.356 2.368 20 0 BEADLO CSC1(C(=O)Nc2ccn3cc[nH+]c3c2)CC1 ZINC000336398030 175445963 /nfs/dbraw/zinc/44/59/63/175445963.db2.gz WZRRIQPWCDQZBQ-UHFFFAOYSA-N 1 2 247.323 2.168 20 0 BEADLO CC[N@H+](Cc1nccn1C)[C@H](C)c1cccnc1 ZINC000270656678 487631209 /nfs/dbraw/zinc/63/12/09/487631209.db2.gz NIMFTIZJYSFUMY-GFCCVEGCSA-N 1 2 244.342 2.398 20 0 BEADLO CC[N@@H+](Cc1nccn1C)[C@H](C)c1cccnc1 ZINC000270656678 487631216 /nfs/dbraw/zinc/63/12/16/487631216.db2.gz NIMFTIZJYSFUMY-GFCCVEGCSA-N 1 2 244.342 2.398 20 0 BEADLO CCN(Cc1[nH+]ccn1C)[C@H](C)c1cccnc1 ZINC000270656678 487631227 /nfs/dbraw/zinc/63/12/27/487631227.db2.gz NIMFTIZJYSFUMY-GFCCVEGCSA-N 1 2 244.342 2.398 20 0 BEADLO C[C@@H](CO)CNc1[nH+]ccc2ccc(F)cc21 ZINC000354574146 175744560 /nfs/dbraw/zinc/74/45/60/175744560.db2.gz VCUCYHDASOPEEL-SECBINFHSA-N 1 2 234.274 2.414 20 0 BEADLO C[C@@H](N[C@H](C)C(F)(F)F)c1[nH+]ccn1C ZINC000336760636 175919792 /nfs/dbraw/zinc/91/97/92/175919792.db2.gz MHFPHCRKIMMLMQ-RNFRBKRXSA-N 1 2 221.226 2.022 20 0 BEADLO C[C@@H](Nc1cc(N2CCCC2)nc[nH+]1)C1CC1 ZINC000285983538 175929614 /nfs/dbraw/zinc/92/96/14/175929614.db2.gz CEGYKQFOJUBPMI-SNVBAGLBSA-N 1 2 232.331 2.287 20 0 BEADLO C[C@@H](Nc1cc(N2CCCC2)[nH+]cn1)C1CC1 ZINC000285983538 175929616 /nfs/dbraw/zinc/92/96/16/175929616.db2.gz CEGYKQFOJUBPMI-SNVBAGLBSA-N 1 2 232.331 2.287 20 0 BEADLO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1cnn(C)n1 ZINC000289755598 176015664 /nfs/dbraw/zinc/01/56/64/176015664.db2.gz JGAVFIVBSYSBFG-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1cnn(C)n1 ZINC000289755598 176015665 /nfs/dbraw/zinc/01/56/65/176015665.db2.gz JGAVFIVBSYSBFG-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO C[C@@H](c1ccccc1)[S@](=O)Cc1c[nH+]cn1C ZINC000268201191 176023081 /nfs/dbraw/zinc/02/30/81/176023081.db2.gz YSJMPQLTZKLPDC-APPDUMDISA-N 1 2 248.351 2.430 20 0 BEADLO C[C@@H]([NH2+]Cc1c[nH]nn1)[C@@H](C)c1ccccc1 ZINC000283618753 176023359 /nfs/dbraw/zinc/02/33/59/176023359.db2.gz AMBTXVAMYGTJIE-GHMZBOCLSA-N 1 2 230.315 2.087 20 0 BEADLO C[C@@H]([NH2+]Cc1cn[nH]n1)[C@@H](C)c1ccccc1 ZINC000283618753 176023360 /nfs/dbraw/zinc/02/33/60/176023360.db2.gz AMBTXVAMYGTJIE-GHMZBOCLSA-N 1 2 230.315 2.087 20 0 BEADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1ccno1 ZINC000271090964 176026287 /nfs/dbraw/zinc/02/62/87/176026287.db2.gz TYPPKWUTHIYVEI-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1ccno1 ZINC000271090964 176026288 /nfs/dbraw/zinc/02/62/88/176026288.db2.gz TYPPKWUTHIYVEI-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@@H](c1nncn1C)[N@H+](C)Cc1cccc(F)c1 ZINC000287323132 176039274 /nfs/dbraw/zinc/03/92/74/176039274.db2.gz NRPJFTKYHOTZNX-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO C[C@@H](c1nncn1C)[N@@H+](C)Cc1cccc(F)c1 ZINC000287323132 176039276 /nfs/dbraw/zinc/03/92/76/176039276.db2.gz NRPJFTKYHOTZNX-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO C[C@@H]1CCCN1C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000333227588 176105436 /nfs/dbraw/zinc/10/54/36/176105436.db2.gz XKCJOXFVAUJZFD-GMTAPVOTSA-N 1 2 248.330 2.083 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000283958578 176114715 /nfs/dbraw/zinc/11/47/15/176114715.db2.gz LRRMSHUDTDXJJW-AFPRHGJPSA-N 1 2 233.315 2.212 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N(C(=O)CCn2cc[nH+]c2)C1 ZINC000336578795 176114961 /nfs/dbraw/zinc/11/49/61/176114961.db2.gz GLRBTIKCVMYFNC-CHWSQXEVSA-N 1 2 249.358 2.310 20 0 BEADLO C[C@@H]1CCC[C@@H](CC(=O)NCc2[nH]cc[nH+]2)C1 ZINC000114335524 176116581 /nfs/dbraw/zinc/11/65/81/176116581.db2.gz IHWNKGJJVBFPSL-GHMZBOCLSA-N 1 2 235.331 2.242 20 0 BEADLO C[C@@H]1CCC[C@@H](N(C)C(=O)CCn2cc[nH+]c2)C1 ZINC000299633002 176119609 /nfs/dbraw/zinc/11/96/09/176119609.db2.gz SRGCTSBROQERQY-CHWSQXEVSA-N 1 2 249.358 2.310 20 0 BEADLO C[C@@H]1CCC[C@@H]1CC(=O)N(C)Cc1[nH+]ccn1C ZINC000274382239 176126773 /nfs/dbraw/zinc/12/67/73/176126773.db2.gz AJMRYJMLTJVPFU-VXGBXAGGSA-N 1 2 249.358 2.205 20 0 BEADLO C[C@@H]1CCC[C@@H]1NC(=O)c1ccc2[nH+]ccn2c1 ZINC000264394444 176130920 /nfs/dbraw/zinc/13/09/20/176130920.db2.gz TWQPTLJNNGKWCQ-PWSUYJOCSA-N 1 2 243.310 2.253 20 0 BEADLO C[C@@H]1CCC[C@@]1(C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000336245407 176133397 /nfs/dbraw/zinc/13/33/97/176133397.db2.gz AVSNPGAWEXZLMH-ZWNOBZJWSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@@H]1CCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000270602751 176182273 /nfs/dbraw/zinc/18/22/73/176182273.db2.gz WFMVJQJPUHDIKR-SECBINFHSA-N 1 2 201.273 2.409 20 0 BEADLO C[C@@H]1CC[C@@H](C[N@H+](C)Cc2cscn2)O1 ZINC000188541664 176202294 /nfs/dbraw/zinc/20/22/94/176202294.db2.gz IJNHERDFHXTFQN-KOLCDFICSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@@H]1CC[C@@H](C[N@@H+](C)Cc2cscn2)O1 ZINC000188541664 176202296 /nfs/dbraw/zinc/20/22/96/176202296.db2.gz IJNHERDFHXTFQN-KOLCDFICSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@H]1CC[C@H](NC(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000283898404 176209997 /nfs/dbraw/zinc/20/99/97/176209997.db2.gz IZMPQNJXJOEVPU-GLJYJBGDSA-N 1 2 233.315 2.118 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)CCc2[nH]cc[nH+]2)C[C@H]1C ZINC000356005498 176231721 /nfs/dbraw/zinc/23/17/21/176231721.db2.gz FVWCNHJEYUUMOZ-UTUOFQBUSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cscn2)CC2(CCC2)O1 ZINC000335462092 176310058 /nfs/dbraw/zinc/31/00/58/176310058.db2.gz KRZDJZPNFVVQPE-SNVBAGLBSA-N 1 2 238.356 2.287 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cscn2)CC2(CCC2)O1 ZINC000335462092 176310059 /nfs/dbraw/zinc/31/00/59/176310059.db2.gz KRZDJZPNFVVQPE-SNVBAGLBSA-N 1 2 238.356 2.287 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nnc(C3CC3)s2)[C@@H]1C ZINC000336266935 176313556 /nfs/dbraw/zinc/31/35/56/176313556.db2.gz OAGIXCRHOHDBLS-HTQZYQBOSA-N 1 2 223.345 2.256 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nnc(C3CC3)s2)[C@@H]1C ZINC000336266935 176313558 /nfs/dbraw/zinc/31/35/58/176313558.db2.gz OAGIXCRHOHDBLS-HTQZYQBOSA-N 1 2 223.345 2.256 20 0 BEADLO C[C@@H]1COCC[N@@H+]1Cc1ccc(F)cc1 ZINC000046773838 176337757 /nfs/dbraw/zinc/33/77/57/176337757.db2.gz BSGPDMSJULZFQO-SNVBAGLBSA-N 1 2 209.264 2.046 20 0 BEADLO C[C@@H]1COCC[N@H+]1Cc1ccc(F)cc1 ZINC000046773838 176337759 /nfs/dbraw/zinc/33/77/59/176337759.db2.gz BSGPDMSJULZFQO-SNVBAGLBSA-N 1 2 209.264 2.046 20 0 BEADLO C[C@@H]1COCC[C@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000277754724 176346101 /nfs/dbraw/zinc/34/61/01/176346101.db2.gz VDSKDRLTJNENMM-MWLCHTKSSA-N 1 2 233.315 2.191 20 0 BEADLO C[C@@H]1CSC(SCCCn2cc[nH+]c2)=N1 ZINC000185637981 176349534 /nfs/dbraw/zinc/34/95/34/176349534.db2.gz SPLSYMZLPCKUTC-SECBINFHSA-N 1 2 241.385 2.498 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+]1CCSC[C@@H](C)C1 ZINC000336259157 176350301 /nfs/dbraw/zinc/35/03/01/176350301.db2.gz PORDQFHJOKBCHC-IUCAKERBSA-N 1 2 243.401 2.284 20 0 BEADLO C[C@@H](c1csnn1)[N@H+]1CCSC[C@@H](C)C1 ZINC000336259157 176350302 /nfs/dbraw/zinc/35/03/02/176350302.db2.gz PORDQFHJOKBCHC-IUCAKERBSA-N 1 2 243.401 2.284 20 0 BEADLO C[C@@H]1CSC[C@@H]1Nc1cc[nH+]c2ccncc12 ZINC000336617583 176351457 /nfs/dbraw/zinc/35/14/57/176351457.db2.gz VWLOAPYPNOFDIM-RNCFNFMXSA-N 1 2 245.351 2.215 20 0 BEADLO C[C@@H]1C[C@@H](C)CN(C(=O)C(C)(C)c2c[nH+]c[nH]2)C1 ZINC000336404337 176359730 /nfs/dbraw/zinc/35/97/30/176359730.db2.gz ZOSYUYZXXSIBGB-GHMZBOCLSA-N 1 2 249.358 2.192 20 0 BEADLO C[C@@H](N[C@@H]1C[C@@H](C)n2cc[nH+]c21)C(F)(F)F ZINC000295225088 176378883 /nfs/dbraw/zinc/37/88/83/176378883.db2.gz NDSFRHZLKQQPOE-BWZBUEFSSA-N 1 2 233.237 2.429 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1cccs1)c1ncn(C)n1 ZINC000275663341 176889673 /nfs/dbraw/zinc/88/96/73/176889673.db2.gz GFWODZBTKLHJKA-IUCAKERBSA-N 1 2 236.344 2.288 20 0 BEADLO C[C@H](Nc1cc[nH+]c(C2CC2)n1)c1cnn(C)c1 ZINC000266193625 176937408 /nfs/dbraw/zinc/93/74/08/176937408.db2.gz BYBBZPLGKFHPKS-VIFPVBQESA-N 1 2 243.314 2.261 20 0 BEADLO C[C@H](O)[C@H]1CCCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000301882494 177014592 /nfs/dbraw/zinc/01/45/92/177014592.db2.gz MXWDVJXPQPHCRR-QWRGUYRKSA-N 1 2 245.326 2.160 20 0 BEADLO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1cn(C)nn1 ZINC000336784184 177033872 /nfs/dbraw/zinc/03/38/72/177033872.db2.gz YVMHISMNJBFDAR-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1cn(C)nn1 ZINC000336784184 177033875 /nfs/dbraw/zinc/03/38/75/177033875.db2.gz YVMHISMNJBFDAR-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1ccn(C)n1 ZINC000270755027 177037684 /nfs/dbraw/zinc/03/76/84/177037684.db2.gz DDPICKCARBINTO-LLVKDONJSA-N 1 2 245.326 2.319 20 0 BEADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1ccn(C)n1 ZINC000270755027 177037686 /nfs/dbraw/zinc/03/76/86/177037686.db2.gz DDPICKCARBINTO-LLVKDONJSA-N 1 2 245.326 2.319 20 0 BEADLO C[C@H](c1ccccc1)[N@H+](C)Cc1ncnn1C ZINC000157422410 177038912 /nfs/dbraw/zinc/03/89/12/177038912.db2.gz UZEDDWRAFNEVJJ-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1ccccc1)[N@@H+](C)Cc1ncnn1C ZINC000157422410 177038913 /nfs/dbraw/zinc/03/89/13/177038913.db2.gz UZEDDWRAFNEVJJ-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1cccnc1)[N@H+](C)Cc1ccn(C)n1 ZINC000271996834 177045170 /nfs/dbraw/zinc/04/51/70/177045170.db2.gz HHVDIOPICSBJRH-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1ccn(C)n1 ZINC000271996834 177045171 /nfs/dbraw/zinc/04/51/71/177045171.db2.gz HHVDIOPICSBJRH-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CC[C@@H](O)C1 ZINC000304489790 177054080 /nfs/dbraw/zinc/05/40/80/177054080.db2.gz LIPPDCODHRWWAT-NXEZZACHSA-N 1 2 238.331 2.100 20 0 BEADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC[C@@H](O)C1 ZINC000304489790 177054082 /nfs/dbraw/zinc/05/40/82/177054082.db2.gz LIPPDCODHRWWAT-NXEZZACHSA-N 1 2 238.331 2.100 20 0 BEADLO C[C@H]1CCC[C@@H](NC(=O)CCc2[nH]cc[nH+]2)C1 ZINC000279289521 177121213 /nfs/dbraw/zinc/12/12/13/177121213.db2.gz YNCXMXCWEUWYMQ-WDEREUQCSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H]1CCC[C@H](CNc2ccc(CO)c[nH+]2)C1 ZINC000356311103 177133289 /nfs/dbraw/zinc/13/32/89/177133289.db2.gz WAEIDMRLLHFEBM-RYUDHWBXSA-N 1 2 234.343 2.234 20 0 BEADLO C[C@H]1CCC[C@H](N(C)C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000287550808 177134519 /nfs/dbraw/zinc/13/45/19/177134519.db2.gz LUQJUQMITXSZPR-RYUDHWBXSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H]1CCC[C@H]1CC(=O)NCCCn1cc[nH+]c1 ZINC000185864701 177139825 /nfs/dbraw/zinc/13/98/25/177139825.db2.gz QOGFFTWEUIPSHD-STQMWFEESA-N 1 2 249.358 2.216 20 0 BEADLO C[C@H]1CCC[C@H]1Nc1nc[nH+]c(N)c1Cl ZINC000235586777 177143054 /nfs/dbraw/zinc/14/30/54/177143054.db2.gz RIHYDDFAFVJAFV-NKWVEPMBSA-N 1 2 226.711 2.313 20 0 BEADLO C[C@H]1CCC[C@H]1Nc1[nH+]cnc(N)c1Cl ZINC000235586777 177143055 /nfs/dbraw/zinc/14/30/55/177143055.db2.gz RIHYDDFAFVJAFV-NKWVEPMBSA-N 1 2 226.711 2.313 20 0 BEADLO C[C@H]1CCC[C@]1(C)C(=O)N(C)Cc1[nH+]ccn1C ZINC000336236288 177143428 /nfs/dbraw/zinc/14/34/28/177143428.db2.gz ACCIHBZVCBHKCH-FZMZJTMJSA-N 1 2 249.358 2.205 20 0 BEADLO C[C@H]1C[N@@H+](Cc2noc(C3CC3)n2)CC[C@@H]1C ZINC000122807540 177168605 /nfs/dbraw/zinc/16/86/05/177168605.db2.gz LRWVULBAIMGASU-UWVGGRQHSA-N 1 2 235.331 2.425 20 0 BEADLO C[C@H]1C[N@H+](Cc2noc(C3CC3)n2)CC[C@@H]1C ZINC000122807540 177168608 /nfs/dbraw/zinc/16/86/08/177168608.db2.gz LRWVULBAIMGASU-UWVGGRQHSA-N 1 2 235.331 2.425 20 0 BEADLO C[C@H]1CCN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000264646941 177171804 /nfs/dbraw/zinc/17/18/04/177171804.db2.gz HOBOOLYJUIVOTG-VIFPVBQESA-N 1 2 203.289 2.200 20 0 BEADLO C[C@H]1CC[C@@H](CC(=O)Nc2ccc(N)[nH+]c2)C1 ZINC000151668331 177188136 /nfs/dbraw/zinc/18/81/36/177188136.db2.gz PHSWGSGRLYPDBR-VHSXEESVSA-N 1 2 233.315 2.429 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2N)C[C@H](C)O1 ZINC000035308374 177260051 /nfs/dbraw/zinc/26/00/51/177260051.db2.gz HWDNYEQOKDIPSH-AOOOYVTPSA-N 1 2 238.306 2.017 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc(F)ccc2N)C[C@H](C)O1 ZINC000035308374 177260053 /nfs/dbraw/zinc/26/00/53/177260053.db2.gz HWDNYEQOKDIPSH-AOOOYVTPSA-N 1 2 238.306 2.017 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1ccnc(Cl)c1 ZINC000050166129 177268051 /nfs/dbraw/zinc/26/80/51/177268051.db2.gz RGDSORGSEBUQAI-ZJUUUORDSA-N 1 2 240.734 2.344 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccnc(Cl)c1 ZINC000050166129 177268053 /nfs/dbraw/zinc/26/80/53/177268053.db2.gz RGDSORGSEBUQAI-ZJUUUORDSA-N 1 2 240.734 2.344 20 0 BEADLO C[C@H]1C[N@H+](Cc2cncs2)C[C@@H](C2CC2)O1 ZINC000280646237 177269504 /nfs/dbraw/zinc/26/95/04/177269504.db2.gz RRQNGXDFCMGPDX-CABZTGNLSA-N 1 2 238.356 2.142 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cncs2)C[C@@H](C2CC2)O1 ZINC000280646237 177269505 /nfs/dbraw/zinc/26/95/05/177269505.db2.gz RRQNGXDFCMGPDX-CABZTGNLSA-N 1 2 238.356 2.142 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1nccn1C(F)F ZINC000292936464 177271505 /nfs/dbraw/zinc/27/15/05/177271505.db2.gz HLMNQDKIDZVXFL-JGVFFNPUSA-N 1 2 215.247 2.118 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1nccn1C(F)F ZINC000292936464 177271506 /nfs/dbraw/zinc/27/15/06/177271506.db2.gz HLMNQDKIDZVXFL-JGVFFNPUSA-N 1 2 215.247 2.118 20 0 BEADLO C[C@H]1COCC[N@@H+]1Cc1ccc(N)cc1Cl ZINC000049963024 177292321 /nfs/dbraw/zinc/29/23/21/177292321.db2.gz JMSMMYWJYGCDQM-VIFPVBQESA-N 1 2 240.734 2.143 20 0 BEADLO C[C@H]1COCC[N@H+]1Cc1ccc(N)cc1Cl ZINC000049963024 177292322 /nfs/dbraw/zinc/29/23/22/177292322.db2.gz JMSMMYWJYGCDQM-VIFPVBQESA-N 1 2 240.734 2.143 20 0 BEADLO C[C@H]1COCC[C@@H]1CNc1cc[nH+]c(C2CC2)n1 ZINC000286326762 177294177 /nfs/dbraw/zinc/29/41/77/177294177.db2.gz KBPSKSRTYVKJEF-CMPLNLGQSA-N 1 2 247.342 2.439 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)NCCn2cc[nH+]c2)C[C@@H]1C ZINC000294559515 177308915 /nfs/dbraw/zinc/30/89/15/177308915.db2.gz ROLAOOQVISMKFG-AGIUHOORSA-N 1 2 249.358 2.072 20 0 BEADLO C[C@H]1C[C@H](NC(=O)C=Cc2c[nH]c[nH+]2)C[C@@H](C)C1 ZINC000284172180 177318207 /nfs/dbraw/zinc/31/82/07/177318207.db2.gz XVKDBZJRDJEBBY-RSXAGADTSA-N 1 2 247.342 2.364 20 0 BEADLO C[C@@H]1Cc2c(ncn2Cc2c[nH+]cn2C)C[C@@H]1C ZINC000295082470 177391314 /nfs/dbraw/zinc/39/13/14/177391314.db2.gz DMTKQODXQGAPLA-WDEREUQCSA-N 1 2 244.342 2.036 20 0 BEADLO C[C@]12CC[N@H+](Cc3cnns3)C[C@H]1C2(F)F ZINC000336275313 177484049 /nfs/dbraw/zinc/48/40/49/177484049.db2.gz NKGSPZVTZCNCAH-BDAKNGLRSA-N 1 2 245.298 2.015 20 0 BEADLO C[C@]12CC[N@@H+](Cc3cnns3)C[C@H]1C2(F)F ZINC000336275313 177484052 /nfs/dbraw/zinc/48/40/52/177484052.db2.gz NKGSPZVTZCNCAH-BDAKNGLRSA-N 1 2 245.298 2.015 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C[C@H]1CC[C@@H](C)C1 ZINC000268301469 177530300 /nfs/dbraw/zinc/53/03/00/177530300.db2.gz YFCXYLDKHORQSN-KOLCDFICSA-N 1 2 235.331 2.161 20 0 BEADLO CC(C)(C)c1nc(NCCC2CC(O)C2)cc[nH+]1 ZINC000683353205 487642362 /nfs/dbraw/zinc/64/23/62/487642362.db2.gz CZOYPVBCIKPBGU-UHFFFAOYSA-N 1 2 249.358 2.347 20 0 BEADLO C[C@H]1C[C@@H]1c1noc(CCCn2cc[nH+]c2)n1 ZINC000680773952 487646128 /nfs/dbraw/zinc/64/61/28/487646128.db2.gz PAVHUBYECCDAEZ-UWVGGRQHSA-N 1 2 232.287 2.022 20 0 BEADLO C[C@@H]1C[C@H]1c1noc(CCCn2cc[nH+]c2)n1 ZINC000680773950 487646188 /nfs/dbraw/zinc/64/61/88/487646188.db2.gz PAVHUBYECCDAEZ-NXEZZACHSA-N 1 2 232.287 2.022 20 0 BEADLO CCO[C@@H]1C[C@H](Nc2cccc[nH+]2)[C@]12CCCO2 ZINC000272669832 487648207 /nfs/dbraw/zinc/64/82/07/487648207.db2.gz KDKVYUSQQRVWNJ-OUCADQQQSA-N 1 2 248.326 2.220 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)C=Cc2c[nH]c[nH+]2)C[C@H]1C ZINC000492809067 226056784 /nfs/dbraw/zinc/05/67/84/226056784.db2.gz FLIARZJWXUCGPF-RRZDQKFSSA-N 1 2 247.342 2.364 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)NC1CCC2(CC2)CC1 ZINC000492862368 226069636 /nfs/dbraw/zinc/06/96/36/226069636.db2.gz KOCDGSGSHXPUOH-UPHRSURJSA-N 1 2 245.326 2.262 20 0 BEADLO C[C@@H]1CCCC[C@@H]1N(C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492889078 226075267 /nfs/dbraw/zinc/07/52/67/226075267.db2.gz AGGYOLFAXFJBAJ-RHZMEEDWSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@H]1CC(NC(=O)/C=C/c2[nH]cc[nH+]2)C[C@@H](C)C1 ZINC000493075682 226119530 /nfs/dbraw/zinc/11/95/30/226119530.db2.gz WTTCDTSKXOBWCN-GZXMXEMNSA-N 1 2 247.342 2.364 20 0 BEADLO Cc1ccc(NC(=O)/C=C\[C@H]2CCOC2)c(C)[nH+]1 ZINC000493111985 226129559 /nfs/dbraw/zinc/12/95/59/226129559.db2.gz CUULOAVDVNXVLD-RNZFLTOJSA-N 1 2 246.310 2.230 20 0 BEADLO Cc1ccc(NC(=O)/C=C/[C@H]2CCOC2)c(C)[nH+]1 ZINC000493111983 226130091 /nfs/dbraw/zinc/13/00/91/226130091.db2.gz CUULOAVDVNXVLD-FUEXJSSKSA-N 1 2 246.310 2.230 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)Nc1ccccc1F ZINC000493167780 226144741 /nfs/dbraw/zinc/14/47/41/226144741.db2.gz QHEVQYWYWRSYJG-AATRIKPKSA-N 1 2 231.230 2.201 20 0 BEADLO C[C@H]1CCN(C(=O)/C=C/c2[nH]cc[nH+]2)CC1(C)C ZINC000493223430 226159334 /nfs/dbraw/zinc/15/93/34/226159334.db2.gz CFBJVQAMAUMIEG-ZWNMCFTASA-N 1 2 247.342 2.318 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)/C=C\C1CCCC1 ZINC000493238941 226164017 /nfs/dbraw/zinc/16/40/17/226164017.db2.gz YCTOCVJJRLBOHT-ZHRWSRJISA-N 1 2 247.342 2.134 20 0 BEADLO C[C@@H]1CC[C@@H](N(C)C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493384243 226201306 /nfs/dbraw/zinc/20/13/06/226201306.db2.gz IVCVVOAFFXSXMV-XIJCSBCJSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@H](c1ccco1)N(C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493448199 226217856 /nfs/dbraw/zinc/21/78/56/226217856.db2.gz HZPQICBNVCTHJB-WWQCOOJYSA-N 1 2 245.282 2.236 20 0 BEADLO Cc1ccc(NC(=O)C=Cc2c[nH]c[nH+]2)cc1 ZINC000493564668 226243754 /nfs/dbraw/zinc/24/37/54/226243754.db2.gz WHZIHQIFQCANCE-SREVYHEPSA-N 1 2 227.267 2.370 20 0 BEADLO C[C@H](NC(=O)C=Cc1c[nH]c[nH+]1)c1ccccc1 ZINC000493612223 226245915 /nfs/dbraw/zinc/24/59/15/226245915.db2.gz NLRDQPWBXISNQK-AEZGRPFRSA-N 1 2 241.294 2.300 20 0 BEADLO C[C@@H]1CCCCN(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493785213 226253950 /nfs/dbraw/zinc/25/39/50/226253950.db2.gz IKQWOMPZMAWENJ-MVIFTORASA-N 1 2 233.315 2.072 20 0 BEADLO CN(C(=O)C=Cc1c[nH]c[nH+]1)[C@@H]1CCC(C)(C)C1 ZINC000493812183 226255084 /nfs/dbraw/zinc/25/50/84/226255084.db2.gz BORONPAHVIKSIM-QMAVJUDZSA-N 1 2 247.342 2.460 20 0 BEADLO Cc1cc(C)c(CNC(=O)/C=C\C2CC2)c[nH+]1 ZINC000493820808 226255884 /nfs/dbraw/zinc/25/58/84/226255884.db2.gz LARJXLLSDWVBKF-WAYWQWQTSA-N 1 2 230.311 2.281 20 0 BEADLO COCCC[N@@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000494223085 226262307 /nfs/dbraw/zinc/26/23/07/226262307.db2.gz KGJCFNWODGTJPW-SECBINFHSA-N 1 2 207.264 2.000 20 0 BEADLO COCCC[N@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000494223085 226262308 /nfs/dbraw/zinc/26/23/08/226262308.db2.gz KGJCFNWODGTJPW-SECBINFHSA-N 1 2 207.264 2.000 20 0 BEADLO C[C@H]1CC[N@H+](CCCCCO)CC1(F)F ZINC000494221859 226262383 /nfs/dbraw/zinc/26/23/83/226262383.db2.gz AOHLWYUZRWOSNX-JTQLQIEISA-N 1 2 221.291 2.126 20 0 BEADLO C[C@H]1CC[N@@H+](CCCCCO)CC1(F)F ZINC000494221859 226262384 /nfs/dbraw/zinc/26/23/84/226262384.db2.gz AOHLWYUZRWOSNX-JTQLQIEISA-N 1 2 221.291 2.126 20 0 BEADLO CCOc1ccc(C[N@H+](C)Cc2cnc[nH]2)cc1 ZINC000505636104 226357902 /nfs/dbraw/zinc/35/79/02/226357902.db2.gz QAEOXPSTLJPGOQ-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO CCOc1ccc(C[N@@H+](C)Cc2cnc[nH]2)cc1 ZINC000505636104 226357903 /nfs/dbraw/zinc/35/79/03/226357903.db2.gz QAEOXPSTLJPGOQ-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO CCOc1ccc(C[N@H+](C)Cc2c[nH]cn2)cc1 ZINC000505636104 226357904 /nfs/dbraw/zinc/35/79/04/226357904.db2.gz QAEOXPSTLJPGOQ-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO CCOc1ccc(C[N@@H+](C)Cc2c[nH]cn2)cc1 ZINC000505636104 226357905 /nfs/dbraw/zinc/35/79/05/226357905.db2.gz QAEOXPSTLJPGOQ-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO Cc1cc(N2C[C@H](O)C[C@H](C)C2)nc(C(C)C)[nH+]1 ZINC000401792363 226362012 /nfs/dbraw/zinc/36/20/12/226362012.db2.gz GSUKQPNWAPFZTQ-CMPLNLGQSA-N 1 2 249.358 2.116 20 0 BEADLO O=C(OC1CCC1)N1CCC(n2cc[nH+]c2)CC1 ZINC000495913332 226291999 /nfs/dbraw/zinc/29/19/99/226291999.db2.gz IWIOVJADTBEHEF-UHFFFAOYSA-N 1 2 249.314 2.209 20 0 BEADLO Cc1ccc[nH+]c1CCc1noc(C2CC2)n1 ZINC000351134131 487653550 /nfs/dbraw/zinc/65/35/50/487653550.db2.gz VFDLFCCAWSKXHE-UHFFFAOYSA-N 1 2 229.283 2.436 20 0 BEADLO CCc1cc(N[C@H]2CC[C@@H](CO)CC2)nc[nH+]1 ZINC000675120003 487670509 /nfs/dbraw/zinc/67/05/09/487670509.db2.gz MGFFWPYLUTTXOV-KLPPZKSPSA-N 1 2 235.331 2.002 20 0 BEADLO COc1ccc(C[NH2+]Cc2ccon2)c(F)c1 ZINC000228599833 487688656 /nfs/dbraw/zinc/68/86/56/487688656.db2.gz SVNOJNKDGFBANY-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO Cc1cc([C@H](C)N[C@@H](C)c2[nH+]ccn2C)no1 ZINC000669706427 487706231 /nfs/dbraw/zinc/70/62/31/487706231.db2.gz DOBFMRWUEPTSTL-UWVGGRQHSA-N 1 2 234.303 2.128 20 0 BEADLO CC[C@H]([NH2+]Cc1cn(C)cn1)c1c(C)noc1C ZINC000683900483 487711663 /nfs/dbraw/zinc/71/16/63/487711663.db2.gz WVHXIGCIIBDZTL-LBPRGKRZSA-N 1 2 248.330 2.266 20 0 BEADLO CCc1cc(N2C[C@H](CC)OC[C@H]2C)nc(C)[nH+]1 ZINC000651405109 487727668 /nfs/dbraw/zinc/72/76/68/487727668.db2.gz JRHURKNQDFYOKE-MFKMUULPSA-N 1 2 249.358 2.351 20 0 BEADLO COC[C@@H]1CCC[N@@H+]1Cc1ncc(Cl)s1 ZINC000681166809 487741082 /nfs/dbraw/zinc/74/10/82/487741082.db2.gz WBKSVGLQUXNUED-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO COC[C@@H]1CCC[N@H+]1Cc1ncc(Cl)s1 ZINC000681166809 487741084 /nfs/dbraw/zinc/74/10/84/487741084.db2.gz WBKSVGLQUXNUED-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO CC(C)n1cc[nH+]c1CN(C)Cc1cccn1C ZINC000675506145 487743313 /nfs/dbraw/zinc/74/33/13/487743313.db2.gz RSFBMDPYRNIBCH-UHFFFAOYSA-N 1 2 246.358 2.435 20 0 BEADLO CC(C)N(C)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000675531760 487744975 /nfs/dbraw/zinc/74/49/75/487744975.db2.gz CEGVRWUWWSNYQI-UHFFFAOYSA-N 1 2 232.287 2.206 20 0 BEADLO CCc1cc(NC[C@@H]2C[C@H](C)O[C@@H]2C)nc[nH+]1 ZINC000665747390 487749237 /nfs/dbraw/zinc/74/92/37/487749237.db2.gz OFBJQJLZXMQUDM-AXFHLTTASA-N 1 2 235.331 2.264 20 0 BEADLO c1[nH+]cc(NC2CSC2)c2c1CCCC2 ZINC000668439747 487757896 /nfs/dbraw/zinc/75/78/96/487757896.db2.gz DIYQFOQZOAHRQI-UHFFFAOYSA-N 1 2 220.341 2.488 20 0 BEADLO Cc1nc(N2CC[C@@H](C3CCC3)C2)cc[nH+]1 ZINC000665755896 487766820 /nfs/dbraw/zinc/76/68/20/487766820.db2.gz WWWYXXQCZCNRQL-GFCCVEGCSA-N 1 2 217.316 2.411 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CC[C@H](C)[C@H](F)C2)[nH+]1 ZINC000679193927 487776364 /nfs/dbraw/zinc/77/63/64/487776364.db2.gz ZEFRGSXYCYFWNU-GZMMTYOYSA-N 1 2 248.305 2.451 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CC[C@@H](C)[C@@H](F)C2)[nH+]1 ZINC000679193928 487776780 /nfs/dbraw/zinc/77/67/80/487776780.db2.gz ZEFRGSXYCYFWNU-KCJUWKMLSA-N 1 2 248.305 2.451 20 0 BEADLO Cc1cnc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)o1 ZINC000679225721 487788713 /nfs/dbraw/zinc/78/87/13/487788713.db2.gz RCAWAHRDOSGHHS-SCZZXKLOSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1cnc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)o1 ZINC000679225721 487788716 /nfs/dbraw/zinc/78/87/16/487788716.db2.gz RCAWAHRDOSGHHS-SCZZXKLOSA-N 1 2 212.268 2.163 20 0 BEADLO CCc1ncc(C[NH2+][C@@H]2CCCC2(F)F)cn1 ZINC000666375850 487795449 /nfs/dbraw/zinc/79/54/49/487795449.db2.gz HIOHRIHDONCUNU-SNVBAGLBSA-N 1 2 241.285 2.316 20 0 BEADLO CCc1cnc(C[NH+]2CC(CCOC)C2)s1 ZINC000668472492 487797359 /nfs/dbraw/zinc/79/73/59/487797359.db2.gz AFEDSVDJIPVHCV-UHFFFAOYSA-N 1 2 240.372 2.174 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc3cnccc3o2)CCO1 ZINC000651611885 487798425 /nfs/dbraw/zinc/79/84/25/487798425.db2.gz QKEFCFWCCZCCHR-GFCCVEGCSA-N 1 2 246.310 2.439 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc3cnccc3o2)CCO1 ZINC000651611885 487798429 /nfs/dbraw/zinc/79/84/29/487798429.db2.gz QKEFCFWCCZCCHR-GFCCVEGCSA-N 1 2 246.310 2.439 20 0 BEADLO Cc1nc(N(C)CCOC(C)(C)C)cc[nH+]1 ZINC000676030285 487801028 /nfs/dbraw/zinc/80/10/28/487801028.db2.gz GDGNLGJZDLRUNY-UHFFFAOYSA-N 1 2 223.320 2.036 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccsc2)nn1C ZINC000676039208 487802849 /nfs/dbraw/zinc/80/28/49/487802849.db2.gz XODUIGKRTCKMHQ-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccsc2)nn1C ZINC000676039208 487802857 /nfs/dbraw/zinc/80/28/57/487802857.db2.gz XODUIGKRTCKMHQ-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1cc(NC(=O)NCC2=CCCC2)cc[nH+]1 ZINC000666489405 487815186 /nfs/dbraw/zinc/81/51/86/487815186.db2.gz DNMNCHQTZIARGT-UHFFFAOYSA-N 1 2 231.299 2.044 20 0 BEADLO COc1ccc(NCc2c(C)n[nH]c2C)[nH+]c1 ZINC000676201038 487819355 /nfs/dbraw/zinc/81/93/55/487819355.db2.gz FYYBRWFIRKGALO-UHFFFAOYSA-N 1 2 232.287 2.042 20 0 BEADLO Cc1cc(NC(=O)N[C@]2(C)CC2(C)C)cc[nH+]1 ZINC000666490214 487820805 /nfs/dbraw/zinc/82/08/05/487820805.db2.gz NFKYAKLBGLSPHI-CYBMUJFWSA-N 1 2 233.315 2.122 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC1CC(C)(C)C1 ZINC000666493688 487821607 /nfs/dbraw/zinc/82/16/07/487821607.db2.gz MOCRJOUCSYNQTQ-UHFFFAOYSA-N 1 2 233.315 2.122 20 0 BEADLO CC=CC=CC(=O)Nc1cc[nH+]cc1CC ZINC000491847281 527578705 /nfs/dbraw/zinc/57/87/05/527578705.db2.gz OIQUUYKOYHDJLP-TWTPFVCWSA-N 1 2 216.284 2.137 20 0 BEADLO CCC1CCC(N(C)C(=O)Cn2cc[nH+]c2)CC1 ZINC000558068894 322945679 /nfs/dbraw/zinc/94/56/79/322945679.db2.gz FSADCIHYYHLBFB-UHFFFAOYSA-N 1 2 249.358 2.310 20 0 BEADLO C/C=C/C=C\C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000309077137 527607252 /nfs/dbraw/zinc/60/72/52/527607252.db2.gz JZQUDTGHBWLTMH-CMVRVGPPSA-N 1 2 219.288 2.109 20 0 BEADLO C/C=C/C=C\C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000309077138 527610463 /nfs/dbraw/zinc/61/04/63/527610463.db2.gz JZQUDTGHBWLTMH-JNVSLHFASA-N 1 2 219.288 2.109 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1cc(C(F)(F)F)nn1C ZINC000668090549 487834487 /nfs/dbraw/zinc/83/44/87/487834487.db2.gz NDKKRCKIKYPOIK-YUMQZZPRSA-N 1 2 247.264 2.422 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1cc(C(F)(F)F)nn1C ZINC000668090548 487834856 /nfs/dbraw/zinc/83/48/56/487834856.db2.gz NDKKRCKIKYPOIK-OCAPTIKFSA-N 1 2 247.264 2.422 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1cc(C(F)(F)F)nn1C ZINC000668090548 487834862 /nfs/dbraw/zinc/83/48/62/487834862.db2.gz NDKKRCKIKYPOIK-OCAPTIKFSA-N 1 2 247.264 2.422 20 0 BEADLO C[C@@H]1OCC[N@H+](CC2(Br)CC2)[C@H]1C ZINC000846817837 588291040 /nfs/dbraw/zinc/29/10/40/588291040.db2.gz OXRWJPJSVHQBOG-IUCAKERBSA-N 1 2 248.164 2.023 20 0 BEADLO C[C@@H]1OCC[N@@H+](CC2(Br)CC2)[C@H]1C ZINC000846817837 588291041 /nfs/dbraw/zinc/29/10/41/588291041.db2.gz OXRWJPJSVHQBOG-IUCAKERBSA-N 1 2 248.164 2.023 20 0 BEADLO CCC(CC)N(CC)C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493193918 528771336 /nfs/dbraw/zinc/77/13/36/528771336.db2.gz TVQGHNZHCJPFKP-BQYQJAHWSA-N 1 2 235.331 2.460 20 0 BEADLO Cc1ccoc1C[NH2+][C@H](C)c1ncc[nH]1 ZINC000124702358 487848084 /nfs/dbraw/zinc/84/80/84/487848084.db2.gz YKWKLVHMZGFCOB-SECBINFHSA-N 1 2 205.261 2.162 20 0 BEADLO CCC[C@H](C)C[N@@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000668499834 487856092 /nfs/dbraw/zinc/85/60/92/487856092.db2.gz MSDFRIVYWZKKLY-VHSXEESVSA-N 1 2 221.291 2.125 20 0 BEADLO CCC[C@H](C)C[N@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000668499834 487856101 /nfs/dbraw/zinc/85/61/01/487856101.db2.gz MSDFRIVYWZKKLY-VHSXEESVSA-N 1 2 221.291 2.125 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@@H]2CCCCO2)c(C)o1 ZINC000659853108 487864931 /nfs/dbraw/zinc/86/49/31/487864931.db2.gz RSOQUMNRISLWIW-LBPRGKRZSA-N 1 2 238.331 2.292 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@@H]2CCCCO2)c(C)o1 ZINC000659853108 487864936 /nfs/dbraw/zinc/86/49/36/487864936.db2.gz RSOQUMNRISLWIW-LBPRGKRZSA-N 1 2 238.331 2.292 20 0 BEADLO C[C@H](Cc1nc(C2CCC2)no1)n1cc[nH+]c1 ZINC000650534997 487875765 /nfs/dbraw/zinc/87/57/65/487875765.db2.gz KFMZHFRPODXTNT-SECBINFHSA-N 1 2 232.287 2.337 20 0 BEADLO O=C(NCCc1[nH]cc[nH+]1)C1CCC2(CC2)CC1 ZINC000668535766 487898803 /nfs/dbraw/zinc/89/88/03/487898803.db2.gz LBYATOMYAYOJDD-UHFFFAOYSA-N 1 2 247.342 2.039 20 0 BEADLO C[C@H](c1nc(C2CC2)no1)[N@H+]1CC=CCC1 ZINC000679324371 487906298 /nfs/dbraw/zinc/90/62/98/487906298.db2.gz QMSPYKHKQKOASH-SECBINFHSA-N 1 2 219.288 2.270 20 0 BEADLO C[C@H](c1nc(C2CC2)no1)[N@@H+]1CC=CCC1 ZINC000679324371 487906302 /nfs/dbraw/zinc/90/63/02/487906302.db2.gz QMSPYKHKQKOASH-SECBINFHSA-N 1 2 219.288 2.270 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)C1CC2(CC2)C1 ZINC000667000830 487925999 /nfs/dbraw/zinc/92/59/99/487925999.db2.gz QKMLQSNKMSEPNE-UHFFFAOYSA-N 1 2 245.326 2.276 20 0 BEADLO CCn1cc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)cn1 ZINC000679357784 487931818 /nfs/dbraw/zinc/93/18/18/487931818.db2.gz AZVCYFUGFNMEDH-ZYHUDNBSSA-N 1 2 225.311 2.083 20 0 BEADLO CCn1cc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)cn1 ZINC000679357784 487931821 /nfs/dbraw/zinc/93/18/21/487931821.db2.gz AZVCYFUGFNMEDH-ZYHUDNBSSA-N 1 2 225.311 2.083 20 0 BEADLO CCn1cc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)cn1 ZINC000679357782 487932070 /nfs/dbraw/zinc/93/20/70/487932070.db2.gz AZVCYFUGFNMEDH-JQWIXIFHSA-N 1 2 225.311 2.083 20 0 BEADLO CCn1cc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)cn1 ZINC000679357782 487932073 /nfs/dbraw/zinc/93/20/73/487932073.db2.gz AZVCYFUGFNMEDH-JQWIXIFHSA-N 1 2 225.311 2.083 20 0 BEADLO C/C=C(\CC)C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000365127345 487944102 /nfs/dbraw/zinc/94/41/02/487944102.db2.gz UITUSLBDZAUIFO-QDEBKDIKSA-N 1 2 247.342 2.472 20 0 BEADLO C/C=C(\CC)C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000365127345 487944103 /nfs/dbraw/zinc/94/41/03/487944103.db2.gz UITUSLBDZAUIFO-QDEBKDIKSA-N 1 2 247.342 2.472 20 0 BEADLO CCc1cc(NCc2ccc(CO)cc2)nc[nH+]1 ZINC000227491979 487947833 /nfs/dbraw/zinc/94/78/33/487947833.db2.gz QCXVWAVCMSFNLA-UHFFFAOYSA-N 1 2 243.310 2.143 20 0 BEADLO CCC[C@H](C)N(C)C(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000666351928 487956286 /nfs/dbraw/zinc/95/62/86/487956286.db2.gz LRSCKOOCCHFFCJ-WDEREUQCSA-N 1 2 249.358 2.162 20 0 BEADLO CCC[C@H](C)N(C)C(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000666351928 487956290 /nfs/dbraw/zinc/95/62/90/487956290.db2.gz LRSCKOOCCHFFCJ-WDEREUQCSA-N 1 2 249.358 2.162 20 0 BEADLO Cc1[nH]c(CN[C@@H](C2CC2)C(F)(F)F)[nH+]c1C ZINC000566499522 323003513 /nfs/dbraw/zinc/00/35/13/323003513.db2.gz WRPABAIZDZOJMW-JTQLQIEISA-N 1 2 247.264 2.457 20 0 BEADLO C[C@@H](CC(=O)NC1C(C)(C)C1(C)C)n1cc[nH+]c1 ZINC000565046036 323005872 /nfs/dbraw/zinc/00/58/72/323005872.db2.gz HWMNWUYHCAGLDU-JTQLQIEISA-N 1 2 249.358 2.385 20 0 BEADLO C[C@@H](CC(=O)N1CC[C@@H](C2CC2)C1)n1cc[nH+]c1 ZINC000565046015 323005892 /nfs/dbraw/zinc/00/58/92/323005892.db2.gz HRMHSDAPEHNZEX-WCQYABFASA-N 1 2 247.342 2.093 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@H]2CCCCO2)cs1 ZINC000128522425 323007315 /nfs/dbraw/zinc/00/73/15/323007315.db2.gz KLDFVCCMDWTQAC-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@H]2CCCCO2)cs1 ZINC000128522425 323007316 /nfs/dbraw/zinc/00/73/16/323007316.db2.gz KLDFVCCMDWTQAC-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO Cc1oncc1C[N@@H+](C)Cc1cccnc1 ZINC000129409177 323008685 /nfs/dbraw/zinc/00/86/85/323008685.db2.gz GFHFAZPESTWOJM-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1oncc1C[N@H+](C)Cc1cccnc1 ZINC000129409177 323008686 /nfs/dbraw/zinc/00/86/86/323008686.db2.gz GFHFAZPESTWOJM-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1cc(NC(=O)N2CC[C@@H]2C(C)C)c(C)c[nH+]1 ZINC000562596184 323025358 /nfs/dbraw/zinc/02/53/58/323025358.db2.gz LIDFEKOYKBWYGR-CYBMUJFWSA-N 1 2 247.342 2.383 20 0 BEADLO Cc1cc(NC(=O)N2CC[C@H]2C(C)C)c(C)c[nH+]1 ZINC000562596188 323025462 /nfs/dbraw/zinc/02/54/62/323025462.db2.gz LIDFEKOYKBWYGR-ZDUSSCGKSA-N 1 2 247.342 2.383 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1NC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000562657563 323026765 /nfs/dbraw/zinc/02/67/65/323026765.db2.gz GHYUTOFXLWGZPR-HZMBPMFUSA-N 1 2 249.358 2.238 20 0 BEADLO Fc1ccc([C@@H]([NH2+]C2CCC2)c2cnn[nH]2)cc1 ZINC000562779584 323030528 /nfs/dbraw/zinc/03/05/28/323030528.db2.gz DLNCNTRRTWFFAX-CYBMUJFWSA-N 1 2 246.289 2.175 20 0 BEADLO Fc1ccc([C@@H]([NH2+]C2CCC2)c2cn[nH]n2)cc1 ZINC000562779584 323030529 /nfs/dbraw/zinc/03/05/29/323030529.db2.gz DLNCNTRRTWFFAX-CYBMUJFWSA-N 1 2 246.289 2.175 20 0 BEADLO CC1CN(c2nc(C3CC3)[nH+]c3c2CCC3)C1 ZINC000567011708 323031024 /nfs/dbraw/zinc/03/10/24/323031024.db2.gz UBZBSEZHSJZQII-UHFFFAOYSA-N 1 2 229.327 2.299 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1CCC[C@H](C)CC1 ZINC000569707245 323037865 /nfs/dbraw/zinc/03/78/65/323037865.db2.gz WRPMAAMQMRJQBJ-RYUDHWBXSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1CCC[C@H](C)CC1 ZINC000569707245 323037866 /nfs/dbraw/zinc/03/78/66/323037866.db2.gz WRPMAAMQMRJQBJ-RYUDHWBXSA-N 1 2 249.358 2.237 20 0 BEADLO CCN(CC)C(=O)c1ccn2c(C)c[nH+]c2c1 ZINC000570057057 323048794 /nfs/dbraw/zinc/04/87/94/323048794.db2.gz RQXIUMJEMVKNMS-UHFFFAOYSA-N 1 2 231.299 2.125 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@]1(C)CC=CCC1 ZINC000570460352 323060486 /nfs/dbraw/zinc/06/04/86/323060486.db2.gz SEHBLGVHILZSQL-RISCZKNCSA-N 1 2 247.342 2.203 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@]1(C)CC=CCC1 ZINC000570460352 323060487 /nfs/dbraw/zinc/06/04/87/323060487.db2.gz SEHBLGVHILZSQL-RISCZKNCSA-N 1 2 247.342 2.203 20 0 BEADLO Cc1nsc(C)c1C[N@@H+]1CCc2n[nH]cc2C1 ZINC000570525687 323062224 /nfs/dbraw/zinc/06/22/24/323062224.db2.gz TYGZTRDWDWWQJR-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO Cc1nsc(C)c1C[N@H+]1CCc2n[nH]cc2C1 ZINC000570525687 323062225 /nfs/dbraw/zinc/06/22/25/323062225.db2.gz TYGZTRDWDWWQJR-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO CC(C)[C@H]1CN(C(=O)Cn2cc[nH+]c2)[C@H]1C(C)C ZINC000570533427 323062366 /nfs/dbraw/zinc/06/23/66/323062366.db2.gz OWGOPCBJHDJZSX-OCCSQVGLSA-N 1 2 249.358 2.022 20 0 BEADLO Cc1cscc1NC(=O)[C@H](C)[NH+]1CC(C)C1 ZINC000570643010 323065863 /nfs/dbraw/zinc/06/58/63/323065863.db2.gz JOOZVOOGMBPNIV-JTQLQIEISA-N 1 2 238.356 2.335 20 0 BEADLO C[C@H]1CC[C@H]1NC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000570733285 323068842 /nfs/dbraw/zinc/06/88/42/323068842.db2.gz KILYZNYJQSCAJM-GXSJLCMTSA-N 1 2 244.298 2.254 20 0 BEADLO C[C@@H]1CC[C@H]1NC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000570733287 323069060 /nfs/dbraw/zinc/06/90/60/323069060.db2.gz KILYZNYJQSCAJM-MWLCHTKSSA-N 1 2 244.298 2.254 20 0 BEADLO CC(C)CC1(C(=O)N[C@H](C)c2[nH]cc[nH+]2)CC1 ZINC000570739740 323069170 /nfs/dbraw/zinc/06/91/70/323069170.db2.gz YHCUZEMMAYDKQW-SNVBAGLBSA-N 1 2 235.331 2.413 20 0 BEADLO C1=CCN(c2nc(C3CC3)[nH+]c3c2CCC3)C1 ZINC000572781198 323069662 /nfs/dbraw/zinc/06/96/62/323069662.db2.gz FKNPXUYAQPFADC-UHFFFAOYSA-N 1 2 227.311 2.219 20 0 BEADLO Cc1ccoc1CNc1nc(C)[nH+]cc1C ZINC000570865413 323073075 /nfs/dbraw/zinc/07/30/75/323073075.db2.gz AVBGDCSZFFCVPC-UHFFFAOYSA-N 1 2 217.272 2.029 20 0 BEADLO Cc1cc(CN(C)c2nc(C)[nH+]cc2C)no1 ZINC000570891732 323073439 /nfs/dbraw/zinc/07/34/39/323073439.db2.gz CMIHCVVMXOEGCI-UHFFFAOYSA-N 1 2 232.287 2.026 20 0 BEADLO Cc1nc(N[C@@H]2CO[C@H](C)C2)c2c([nH+]1)CCCC2 ZINC000563053027 323082914 /nfs/dbraw/zinc/08/29/14/323082914.db2.gz UGKAYNGMYSXSCK-KOLCDFICSA-N 1 2 247.342 2.253 20 0 BEADLO C[C@H]1CCCC[C@H]1CC(=O)NCCc1[nH]cc[nH+]1 ZINC000531287294 323087073 /nfs/dbraw/zinc/08/70/73/323087073.db2.gz QIBSJHMMRAFJIO-RYUDHWBXSA-N 1 2 249.358 2.285 20 0 BEADLO CCCC[C@H]([NH2+][C@@H]1CS[C@H](C)C1)C(=O)OC ZINC000397919705 323101157 /nfs/dbraw/zinc/10/11/57/323101157.db2.gz GRTHWKLMRFTCLZ-VWYCJHECSA-N 1 2 245.388 2.202 20 0 BEADLO C[C@H](CC(=O)N1C[C@@H]2CCC[C@H]2C1)n1cc[nH+]c1 ZINC000563216444 323103153 /nfs/dbraw/zinc/10/31/53/323103153.db2.gz GTZJFBOWVANDME-AGIUHOORSA-N 1 2 247.342 2.093 20 0 BEADLO CC(C)n1ccc(C[NH2+][C@@H](C)c2ccnn2C)n1 ZINC000571030590 323104000 /nfs/dbraw/zinc/10/40/00/323104000.db2.gz TVCPTCNIKQDJEP-NSHDSACASA-N 1 2 247.346 2.048 20 0 BEADLO CCC1CCN(C(=O)C[C@@H](C)n2cc[nH+]c2)CC1 ZINC000563237048 323105835 /nfs/dbraw/zinc/10/58/35/323105835.db2.gz DHROSVICFIRRMG-GFCCVEGCSA-N 1 2 249.358 2.483 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@H]1CCCC[C@@H]1C ZINC000565434098 323107075 /nfs/dbraw/zinc/10/70/75/323107075.db2.gz SVSZOBQJUSYBQL-LOWVWBTDSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@H]1CCCC[C@@H]1C ZINC000565434098 323107076 /nfs/dbraw/zinc/10/70/76/323107076.db2.gz SVSZOBQJUSYBQL-LOWVWBTDSA-N 1 2 249.358 2.283 20 0 BEADLO OC1(COc2cccc(-n3cc[nH+]c3)c2)CCC1 ZINC000339331702 323107505 /nfs/dbraw/zinc/10/75/05/323107505.db2.gz KOKLAWDRVWWOOV-UHFFFAOYSA-N 1 2 244.294 2.166 20 0 BEADLO C/C=C/C=C/C(=O)Nc1ccc[nH+]c1N(C)C ZINC000047976175 323112995 /nfs/dbraw/zinc/11/29/95/323112995.db2.gz AHJAXVKWSYXPQI-HSKKLARCSA-N 1 2 231.299 2.218 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)C[C@H]1C=CCC1 ZINC000047975902 323113052 /nfs/dbraw/zinc/11/30/52/323113052.db2.gz JEPCWEGSNYXSEZ-NSHDSACASA-N 1 2 245.326 2.442 20 0 BEADLO C[C@H]1C[C@H](C)N(c2nc(N)c3ccccc3[nH+]2)C1 ZINC000534272774 323115331 /nfs/dbraw/zinc/11/53/31/323115331.db2.gz YIRZTOFQZYJYTI-UWVGGRQHSA-N 1 2 242.326 2.277 20 0 BEADLO Cc1ncsc1C(=O)Nc1cc(C)[nH+]cc1C ZINC000534299231 323115780 /nfs/dbraw/zinc/11/57/80/323115780.db2.gz XYKBOWHTSVAANT-UHFFFAOYSA-N 1 2 247.323 2.138 20 0 BEADLO CC(C)CN(C(=O)[C@H](C)Cc1c[nH+]c[nH]1)C1CC1 ZINC000563372090 323121821 /nfs/dbraw/zinc/12/18/21/323121821.db2.gz UVTIKYLRNJWAJB-LLVKDONJSA-N 1 2 249.358 2.235 20 0 BEADLO CC(C)CN(C(=O)[C@H](C)Cc1c[nH]c[nH+]1)C1CC1 ZINC000563372090 323121822 /nfs/dbraw/zinc/12/18/22/323121822.db2.gz UVTIKYLRNJWAJB-LLVKDONJSA-N 1 2 249.358 2.235 20 0 BEADLO CO[C@H]1C[C@H](Nc2nc(C)[nH+]cc2C)C12CCC2 ZINC000563423770 323124421 /nfs/dbraw/zinc/12/44/21/323124421.db2.gz JGCAPUVPXRHIQZ-RYUDHWBXSA-N 1 2 247.342 2.463 20 0 BEADLO CC[C@@H](C)[NH2+]Cc1[nH]ncc1Br ZINC000307998784 323127707 /nfs/dbraw/zinc/12/77/07/323127707.db2.gz XYYDQLIRFPXPHN-ZCFIWIBFSA-N 1 2 232.125 2.060 20 0 BEADLO Cc1ccc(NC(=O)NCC2CC2)c(C)[nH+]1 ZINC000152267989 323134596 /nfs/dbraw/zinc/13/45/96/323134596.db2.gz KUNFMSSYQXCGGM-UHFFFAOYSA-N 1 2 219.288 2.230 20 0 BEADLO CN(C(=O)Cn1cc[nH+]c1)C1CCCCCC1 ZINC000571135362 323136354 /nfs/dbraw/zinc/13/63/54/323136354.db2.gz WJQRORUUQACNMN-UHFFFAOYSA-N 1 2 235.331 2.064 20 0 BEADLO FC1(C[NH2+]Cc2nnc(C3CC3)s2)CC1 ZINC000571145615 323136460 /nfs/dbraw/zinc/13/64/60/323136460.db2.gz ISEONTBYBTWVOT-UHFFFAOYSA-N 1 2 227.308 2.007 20 0 BEADLO CC1(C)C[C@@H]1[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000571412574 323144152 /nfs/dbraw/zinc/14/41/52/323144152.db2.gz BVMSZFXLQAFGBB-NWDGAFQWSA-N 1 2 242.326 2.282 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1C[C@H](OC)C1(C)C ZINC000300624107 323152937 /nfs/dbraw/zinc/15/29/37/323152937.db2.gz DQVAFXRGJBCMLV-MNOVXSKESA-N 1 2 236.315 2.316 20 0 BEADLO CCc1cnc(C[N@@H+]2CCOC(C)(C)[C@H]2C)o1 ZINC000531910468 323153606 /nfs/dbraw/zinc/15/36/06/323153606.db2.gz MIPNGQGGHMJLHG-SNVBAGLBSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1cnc(C[N@H+]2CCOC(C)(C)[C@H]2C)o1 ZINC000531910468 323153607 /nfs/dbraw/zinc/15/36/07/323153607.db2.gz MIPNGQGGHMJLHG-SNVBAGLBSA-N 1 2 238.331 2.236 20 0 BEADLO c1cnn(CCSc2[nH+]cc3ccccn32)c1 ZINC000049517096 323161826 /nfs/dbraw/zinc/16/18/26/323161826.db2.gz GVAMEFYFKIDBFA-UHFFFAOYSA-N 1 2 244.323 2.323 20 0 BEADLO Cc1cc(NC(=O)N(C)CC(C)C)c(C)c[nH+]1 ZINC000535061777 323164884 /nfs/dbraw/zinc/16/48/84/323164884.db2.gz PNMFTXOEZXRLMB-UHFFFAOYSA-N 1 2 235.331 2.240 20 0 BEADLO Cc1cc(NC(=O)N2CCC(C)(C)C2)c(C)c[nH+]1 ZINC000535061683 323164895 /nfs/dbraw/zinc/16/48/95/323164895.db2.gz BHELVIVLCRUNGZ-UHFFFAOYSA-N 1 2 247.342 2.384 20 0 BEADLO c1cc(C[N@@H+]2CCC[C@@H]2c2ccccn2)n[nH]1 ZINC000535067656 323165064 /nfs/dbraw/zinc/16/50/64/323165064.db2.gz WLFLHVSZIVHVNJ-CYBMUJFWSA-N 1 2 228.299 2.142 20 0 BEADLO c1cc(C[N@H+]2CCC[C@@H]2c2ccccn2)n[nH]1 ZINC000535067656 323165065 /nfs/dbraw/zinc/16/50/65/323165065.db2.gz WLFLHVSZIVHVNJ-CYBMUJFWSA-N 1 2 228.299 2.142 20 0 BEADLO Cc1cc(NC(=O)/C=C/C2CCOCC2)cc[nH+]1 ZINC000112298534 323168808 /nfs/dbraw/zinc/16/88/08/323168808.db2.gz DREBLHCBCKFCQP-NSCUHMNNSA-N 1 2 246.310 2.311 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCC1=CCCC1 ZINC000563729811 323176275 /nfs/dbraw/zinc/17/62/75/323176275.db2.gz HJEDJDPHCIIXDJ-UHFFFAOYSA-N 1 2 217.316 2.428 20 0 BEADLO CC[C@H](F)C[N@H+](C)Cc1cnn(CC)c1 ZINC000563775939 323177398 /nfs/dbraw/zinc/17/73/98/323177398.db2.gz ZMJOVEYAVNWMGG-NSHDSACASA-N 1 2 213.300 2.083 20 0 BEADLO CC[C@H](F)C[N@@H+](C)Cc1cnn(CC)c1 ZINC000563775939 323177399 /nfs/dbraw/zinc/17/73/99/323177399.db2.gz ZMJOVEYAVNWMGG-NSHDSACASA-N 1 2 213.300 2.083 20 0 BEADLO CCOCC(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000070249004 323181574 /nfs/dbraw/zinc/18/15/74/323181574.db2.gz AECPCIRLHSMAFO-UHFFFAOYSA-N 1 2 245.282 2.052 20 0 BEADLO Cc1cc(C)cc(C[NH2+][C@@H](C)c2ncn(C)n2)c1 ZINC000391843670 323183358 /nfs/dbraw/zinc/18/33/58/323183358.db2.gz NLIMTBAICODDJM-LBPRGKRZSA-N 1 2 244.342 2.283 20 0 BEADLO Fc1ccc(/C=C\C[NH+]2CCOCC2)cc1 ZINC000535778363 323191010 /nfs/dbraw/zinc/19/10/10/323191010.db2.gz OIZDOINUSQSPAS-UPHRSURJSA-N 1 2 221.275 2.171 20 0 BEADLO CCOc1ncccc1NCc1[nH+]ccn1CC ZINC000051922312 323191902 /nfs/dbraw/zinc/19/19/02/323191902.db2.gz WSUUPIZJWWUVSR-UHFFFAOYSA-N 1 2 246.314 2.309 20 0 BEADLO CC[C@H]1CC[C@@H](C(=O)Nc2cc(C)[nH+]cc2C)O1 ZINC000536574368 323197911 /nfs/dbraw/zinc/19/79/11/323197911.db2.gz SCFYAGFISHQQGB-AAEUAGOBSA-N 1 2 248.326 2.016 20 0 BEADLO CCC(C)(C)NC(=O)Nc1cc(C)[nH+]cc1C ZINC000536619148 323198718 /nfs/dbraw/zinc/19/87/18/323198718.db2.gz DEUGVKZDSQGVKU-UHFFFAOYSA-N 1 2 235.331 2.430 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2CCC[C@H]2C)c(C)c[nH+]1 ZINC000536619807 323198789 /nfs/dbraw/zinc/19/87/89/323198789.db2.gz CXLMLMSDYDMVRD-BXKDBHETSA-N 1 2 247.342 2.430 20 0 BEADLO CCOC[C@@H](C)[NH2+][C@H](CC)C(=O)OC(C)(C)C ZINC000571676636 323324572 /nfs/dbraw/zinc/32/45/72/323324572.db2.gz GJZOCKZYDZXSFF-GHMZBOCLSA-N 1 2 245.363 2.121 20 0 BEADLO CCOC(=O)C[NH2+]C(C)(C)Cc1ccc(C)cc1 ZINC000418099141 323349894 /nfs/dbraw/zinc/34/98/94/323349894.db2.gz BNBJZHXPVYTPQN-UHFFFAOYSA-N 1 2 249.354 2.469 20 0 BEADLO CCC[C@](C)(O)CNc1[nH+]cccc1OC ZINC000230684277 323433825 /nfs/dbraw/zinc/43/38/25/323433825.db2.gz APNGTNKNNURGQT-LBPRGKRZSA-N 1 2 224.304 2.053 20 0 BEADLO C[C@H]1CCCC[C@]1(C)NC(=O)Cc1c[nH+]cn1C ZINC000572095628 323537310 /nfs/dbraw/zinc/53/73/10/323537310.db2.gz KSKPVUMLTIUOFR-FZMZJTMJSA-N 1 2 249.358 2.048 20 0 BEADLO O=[S@@]1CC[C@@H](Nc2[nH+]ccc3ccccc32)C1 ZINC000527908677 323717843 /nfs/dbraw/zinc/71/78/43/323717843.db2.gz FYMSBVXMZFVUOH-PIGZYNQJSA-N 1 2 246.335 2.168 20 0 BEADLO COc1ccc[nH+]c1N1CC[C@H](C)[C@@H]1C ZINC000527909559 323719024 /nfs/dbraw/zinc/71/90/24/323719024.db2.gz CBCKRFMIAPAWRJ-UWVGGRQHSA-N 1 2 206.289 2.325 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ncccc1F)c1cnn(C)c1 ZINC000528035199 323744031 /nfs/dbraw/zinc/74/40/31/323744031.db2.gz FGJCHMAKECHXBM-ZJUUUORDSA-N 1 2 248.305 2.366 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1C[C@@H](OC)C1(C)C ZINC000234761659 324116760 /nfs/dbraw/zinc/11/67/60/324116760.db2.gz DQVAFXRGJBCMLV-GHMZBOCLSA-N 1 2 236.315 2.316 20 0 BEADLO CC[C@@H](NC(=O)c1cocc1C)c1[nH]cc[nH+]1 ZINC000529055844 324239008 /nfs/dbraw/zinc/23/90/08/324239008.db2.gz NNNOVUHRYUWRJF-SNVBAGLBSA-N 1 2 233.271 2.192 20 0 BEADLO Cc1cocc1C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000529457829 324304877 /nfs/dbraw/zinc/30/48/77/324304877.db2.gz MDAXUQMJPODNEP-MWLCHTKSSA-N 1 2 245.282 2.220 20 0 BEADLO CCC(C)(C)OC1C[NH+](Cc2ccn(C)c2)C1 ZINC000529643366 324370539 /nfs/dbraw/zinc/37/05/39/324370539.db2.gz ZGXDFQFENHCRLL-UHFFFAOYSA-N 1 2 236.359 2.415 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CCOC(C)(C)C1 ZINC000128238905 324813843 /nfs/dbraw/zinc/81/38/43/324813843.db2.gz URGITEOHZHTNJY-JTQLQIEISA-N 1 2 236.315 2.460 20 0 BEADLO CC(C)c1nc(N(CCCCO)C2CC2)cc[nH+]1 ZINC000128673669 324869709 /nfs/dbraw/zinc/86/97/09/324869709.db2.gz HFLWXKJLAYWGAY-UHFFFAOYSA-N 1 2 249.358 2.341 20 0 BEADLO Cn1ccc(CNc2c[nH+]c3c(c2)CCCC3)n1 ZINC000543868041 325120155 /nfs/dbraw/zinc/12/01/55/325120155.db2.gz ZCZSZLVPIRXIBS-UHFFFAOYSA-N 1 2 242.326 2.306 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccc(F)cc2)o1 ZINC000544515405 325145710 /nfs/dbraw/zinc/14/57/10/325145710.db2.gz IWLKBWOQYDFIMB-MRVPVSSYSA-N 1 2 235.262 2.368 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC[C@@H]2CC(C)C)on1 ZINC000072980019 325183940 /nfs/dbraw/zinc/18/39/40/325183940.db2.gz NQIQZECROCFITM-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cc(C[N@H+]2CCOC[C@@H]2CC(C)C)on1 ZINC000072980019 325183937 /nfs/dbraw/zinc/18/39/37/325183937.db2.gz NQIQZECROCFITM-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)Cc1ccc(O)cc1 ZINC000133690233 325310024 /nfs/dbraw/zinc/31/00/24/325310024.db2.gz ODIHZXVVEXTAST-UHFFFAOYSA-N 1 2 242.278 2.277 20 0 BEADLO CC[C@H]1C[N@H+](Cc2nccn2CC)CCS1 ZINC000076072380 325329111 /nfs/dbraw/zinc/32/91/11/325329111.db2.gz HHRIPTAEIWVBJO-NSHDSACASA-N 1 2 239.388 2.230 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2nccn2CC)CCS1 ZINC000076072380 325329113 /nfs/dbraw/zinc/32/91/13/325329113.db2.gz HHRIPTAEIWVBJO-NSHDSACASA-N 1 2 239.388 2.230 20 0 BEADLO C[C@@H]1CC[C@@H](c2nc(Cc3c[nH+]cn3C)no2)C1 ZINC000547257102 325334311 /nfs/dbraw/zinc/33/43/11/325334311.db2.gz KHVGBYPXCMTGJI-NXEZZACHSA-N 1 2 246.314 2.298 20 0 BEADLO CCc1ccsc1C(=O)NCCc1[nH]cc[nH+]1 ZINC000134492862 325361165 /nfs/dbraw/zinc/36/11/65/325361165.db2.gz FKYFPRJAOUEIQU-UHFFFAOYSA-N 1 2 249.339 2.006 20 0 BEADLO CCCC[C@@H]([NH2+]C[C@H](C)SC)C(=O)OC ZINC000135256033 325403341 /nfs/dbraw/zinc/40/33/41/325403341.db2.gz LWNNMTMICGMTQR-VHSXEESVSA-N 1 2 233.377 2.059 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)C1(C)CCCCC1 ZINC000548361695 325450385 /nfs/dbraw/zinc/45/03/85/325450385.db2.gz FSTDHYVKZZNRDS-GFCCVEGCSA-N 1 2 249.358 2.358 20 0 BEADLO COc1ccccc1NC(=O)C[NH+]1[C@H](C)C[C@H]1C ZINC000548754367 325479293 /nfs/dbraw/zinc/47/92/93/325479293.db2.gz BATDCUHZLDRFBF-GHMZBOCLSA-N 1 2 248.326 2.116 20 0 BEADLO CC(C)(CNC(=O)Cn1cc[nH+]c1)C1CCCC1 ZINC000548896133 325492070 /nfs/dbraw/zinc/49/20/70/325492070.db2.gz WIGCXSJEINHJLW-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO CC(C)[C@H](NC(=O)C1CC(C)C1)c1[nH]cc[nH+]1 ZINC000549751565 325514279 /nfs/dbraw/zinc/51/42/79/325514279.db2.gz AUXGIXZREMPLAO-ILDUYXDCSA-N 1 2 235.331 2.269 20 0 BEADLO C[C@@H](Cc1ccc(O)cc1)Nc1c[nH]c[nH+]1 ZINC000552214810 325610171 /nfs/dbraw/zinc/61/01/71/325610171.db2.gz LVJRLDUQMRRXNX-VIFPVBQESA-N 1 2 217.272 2.158 20 0 BEADLO C[C@@H]1CN(c2[nH+]ccc3ccccc32)CC[C@H]1O ZINC000253171317 325712412 /nfs/dbraw/zinc/71/24/12/325712412.db2.gz AICDUZRHWPLHLW-BXUZGUMPSA-N 1 2 242.322 2.442 20 0 BEADLO CC[C@H]1CN(c2nc(C)[nH+]cc2C)C[C@H](CC)O1 ZINC000565435145 325911159 /nfs/dbraw/zinc/91/11/59/325911159.db2.gz YMOMBEWYTBTFOX-STQMWFEESA-N 1 2 249.358 2.487 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@H]1CCC[C@@H](C)C1 ZINC000566432735 326046453 /nfs/dbraw/zinc/04/64/53/326046453.db2.gz IFTSMDJXQQCSJU-GRYCIOLGSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@H]1CCC[C@@H](C)C1 ZINC000566432735 326046455 /nfs/dbraw/zinc/04/64/55/326046455.db2.gz IFTSMDJXQQCSJU-GRYCIOLGSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@H]1CCC[C@@H](C)C1 ZINC000566432740 326046497 /nfs/dbraw/zinc/04/64/97/326046497.db2.gz IFTSMDJXQQCSJU-IJLUTSLNSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@H]1CCC[C@@H](C)C1 ZINC000566432740 326046499 /nfs/dbraw/zinc/04/64/99/326046499.db2.gz IFTSMDJXQQCSJU-IJLUTSLNSA-N 1 2 249.358 2.283 20 0 BEADLO Cc1c[nH+]c(C)nc1N1C[C@H](C)[C@H](C)C1 ZINC000566478413 326055148 /nfs/dbraw/zinc/05/51/48/326055148.db2.gz GIFIUKNCGUFZHI-AOOOYVTPSA-N 1 2 205.305 2.186 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1C[C@H]2OCCC[C@@H]12 ZINC000566484921 326056789 /nfs/dbraw/zinc/05/67/89/326056789.db2.gz UAGJJNRIGALENN-QJPTWQEYSA-N 1 2 233.315 2.073 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C1=CCCC1 ZINC000154092217 326130622 /nfs/dbraw/zinc/13/06/22/326130622.db2.gz WVQDTCOCVUGJNS-UHFFFAOYSA-N 1 2 202.257 2.439 20 0 BEADLO CC1(C(=O)NCCCCNc2cccc[nH+]2)CC1 ZINC000155420309 326195254 /nfs/dbraw/zinc/19/52/54/326195254.db2.gz OGDMKDXLQURGQO-UHFFFAOYSA-N 1 2 247.342 2.190 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CCO[C@@H](C)[C@@H]1C ZINC000155956781 326216144 /nfs/dbraw/zinc/21/61/44/326216144.db2.gz FZSDLRLXMSWISA-RYUDHWBXSA-N 1 2 237.347 2.073 20 0 BEADLO Cc1ncc(C[NH2+][C@@H](C)c2cscn2)cn1 ZINC000567627870 326232186 /nfs/dbraw/zinc/23/21/86/326232186.db2.gz CLOPJPSQEAICQK-QMMMGPOBSA-N 1 2 234.328 2.092 20 0 BEADLO CC(C)[C@@H]1CCCN1C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000568014603 326296198 /nfs/dbraw/zinc/29/61/98/326296198.db2.gz GSZNZAYZEQRDIX-OLZOCXBDSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@H](CC(=O)N1C[C@@H](C)CC1(C)C)n1cc[nH+]c1 ZINC000568021437 326297144 /nfs/dbraw/zinc/29/71/44/326297144.db2.gz UHCMTHMSQXNRNG-NWDGAFQWSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)NCC3CCC3)ccn12 ZINC000568194571 326324475 /nfs/dbraw/zinc/32/44/75/326324475.db2.gz MFDONZRPYQPVBR-UHFFFAOYSA-N 1 2 243.310 2.173 20 0 BEADLO CCC1(NC(=O)[C@H](C)Cc2c[nH+]c[nH]2)CCCC1 ZINC000568228441 326329686 /nfs/dbraw/zinc/32/96/86/326329686.db2.gz ZXHPXSQJQZEBBX-LLVKDONJSA-N 1 2 249.358 2.427 20 0 BEADLO CCC1(NC(=O)[C@H](C)Cc2c[nH]c[nH+]2)CCCC1 ZINC000568228441 326329688 /nfs/dbraw/zinc/32/96/88/326329688.db2.gz ZXHPXSQJQZEBBX-LLVKDONJSA-N 1 2 249.358 2.427 20 0 BEADLO Cc1cnc(C[NH2+][C@H](C)c2cncnc2C)s1 ZINC000568238543 326332340 /nfs/dbraw/zinc/33/23/40/326332340.db2.gz XHGLUSBUYGZNAZ-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO Cc1noc([C@H](C)[N@H+](C)Cc2cccc(N)c2)n1 ZINC000568294770 326342521 /nfs/dbraw/zinc/34/25/21/326342521.db2.gz BLCAHMHGSZLHPA-VIFPVBQESA-N 1 2 246.314 2.153 20 0 BEADLO Cc1noc([C@H](C)[N@@H+](C)Cc2cccc(N)c2)n1 ZINC000568294770 326342522 /nfs/dbraw/zinc/34/25/22/326342522.db2.gz BLCAHMHGSZLHPA-VIFPVBQESA-N 1 2 246.314 2.153 20 0 BEADLO C[C@@H]1C[C@H](C)N1C(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000568363260 326349833 /nfs/dbraw/zinc/34/98/33/326349833.db2.gz CNDWZUBAZGGBCE-ZNSHCXBVSA-N 1 2 248.330 2.081 20 0 BEADLO C[C@H](O)CCCOc1ccccc1-n1cc[nH+]c1 ZINC000568491463 326359274 /nfs/dbraw/zinc/35/92/74/326359274.db2.gz VMVIJFYYQCTGLW-LBPRGKRZSA-N 1 2 246.310 2.412 20 0 BEADLO CC[C@@H]1C[C@H](C)CN1C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000568519455 326362169 /nfs/dbraw/zinc/36/21/69/326362169.db2.gz GTGFDYRQNVCJCP-YNEHKIRRSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1ccncc1C[N@@H+]1CCC(=O)CC12CCC2 ZINC000568530347 326363538 /nfs/dbraw/zinc/36/35/38/326363538.db2.gz VKMMLJYNAIIJTI-UHFFFAOYSA-N 1 2 244.338 2.478 20 0 BEADLO Cc1ccncc1C[N@H+]1CCC(=O)CC12CCC2 ZINC000568530347 326363541 /nfs/dbraw/zinc/36/35/41/326363541.db2.gz VKMMLJYNAIIJTI-UHFFFAOYSA-N 1 2 244.338 2.478 20 0 BEADLO CCc1nc(C)c(C[NH2+][C@H](C)c2ccon2)o1 ZINC000569066030 326388178 /nfs/dbraw/zinc/38/81/78/326388178.db2.gz KJFSKGIUIGBQHO-MRVPVSSYSA-N 1 2 235.287 2.384 20 0 BEADLO CC1=C(C(=O)NC(C)(C)c2[nH]cc[nH+]2)CCC1 ZINC000569230746 326396606 /nfs/dbraw/zinc/39/66/06/326396606.db2.gz WDKIQMHPUOLLNM-UHFFFAOYSA-N 1 2 233.315 2.261 20 0 BEADLO CCC1(NC(=O)c2ccn3c(C)c[nH+]c3c2)CC1 ZINC000573107584 326429904 /nfs/dbraw/zinc/42/99/04/326429904.db2.gz YRCFBOXPJQRBQT-UHFFFAOYSA-N 1 2 243.310 2.315 20 0 BEADLO COCC1(Nc2cc(C)[nH+]c(C3CC3)n2)CC1 ZINC000573146883 326432228 /nfs/dbraw/zinc/43/22/28/326432228.db2.gz DVTIBGXPHISYOP-UHFFFAOYSA-N 1 2 233.315 2.253 20 0 BEADLO CC(C)N(CC1CC1)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000573254901 326438205 /nfs/dbraw/zinc/43/82/05/326438205.db2.gz CEKDGGDIKVBOGU-GFCCVEGCSA-N 1 2 249.358 2.481 20 0 BEADLO CCc1cc(N(C)CCc2nccs2)nc[nH+]1 ZINC000677125999 487977466 /nfs/dbraw/zinc/97/74/66/487977466.db2.gz NMQPUMNFKPXRIA-UHFFFAOYSA-N 1 2 248.355 2.174 20 0 BEADLO CC(C)CCC[N@@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000682559340 487979798 /nfs/dbraw/zinc/97/97/98/487979798.db2.gz TZVMVGRTEKWYDX-JTQLQIEISA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)CCC[N@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000682559340 487979801 /nfs/dbraw/zinc/97/98/01/487979801.db2.gz TZVMVGRTEKWYDX-JTQLQIEISA-N 1 2 221.291 2.125 20 0 BEADLO CC/C=C/CC[N@@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000682546798 487984928 /nfs/dbraw/zinc/98/49/28/487984928.db2.gz OFSYFNGKIXIPTJ-FSIBCCDJSA-N 1 2 219.275 2.045 20 0 BEADLO CC/C=C/CC[N@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000682546798 487984933 /nfs/dbraw/zinc/98/49/33/487984933.db2.gz OFSYFNGKIXIPTJ-FSIBCCDJSA-N 1 2 219.275 2.045 20 0 BEADLO CC1=CC[C@@](C)(C(=O)NCCn2cc[nH+]c2)CC1 ZINC000666353230 487984359 /nfs/dbraw/zinc/98/43/59/487984359.db2.gz QEPKBYFDALVFRK-CQSZACIVSA-N 1 2 247.342 2.136 20 0 BEADLO CC[C@H]1CC[C@@H]1Nc1ccc(N(C)CCO)c[nH+]1 ZINC000672606828 488013983 /nfs/dbraw/zinc/01/39/83/488013983.db2.gz FKKHVGKMSWRJRP-AAEUAGOBSA-N 1 2 249.358 2.111 20 0 BEADLO CCc1noc(COc2ccc(C)[nH+]c2CC)n1 ZINC000682706577 488024422 /nfs/dbraw/zinc/02/44/22/488024422.db2.gz CBSJMTBCLITWQA-UHFFFAOYSA-N 1 2 247.298 2.477 20 0 BEADLO CC[N@H+](C)Cc1c(F)cncc1Br ZINC000667495489 488027356 /nfs/dbraw/zinc/02/73/56/488027356.db2.gz LNUGWEWMUQJDBX-UHFFFAOYSA-N 1 2 247.111 2.435 20 0 BEADLO CC[N@@H+](C)Cc1c(F)cncc1Br ZINC000667495489 488027358 /nfs/dbraw/zinc/02/73/58/488027358.db2.gz LNUGWEWMUQJDBX-UHFFFAOYSA-N 1 2 247.111 2.435 20 0 BEADLO Cc1cc(C[NH2+]Cc2cc(F)ccc2F)ncn1 ZINC000677425165 488034023 /nfs/dbraw/zinc/03/40/23/488034023.db2.gz IJRHARYILNBUTH-UHFFFAOYSA-N 1 2 249.264 2.353 20 0 BEADLO Cc1cnc(C[NH2+]Cc2ccccc2N(C)C)o1 ZINC000682781047 488040907 /nfs/dbraw/zinc/04/09/07/488040907.db2.gz SUSWPESZSOCZDI-UHFFFAOYSA-N 1 2 245.326 2.339 20 0 BEADLO COc1c(C)[nH+]cnc1NCc1ncccc1C ZINC000656119221 488051113 /nfs/dbraw/zinc/05/11/13/488051113.db2.gz AXYZREGDXHLLEV-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO CCO[C@H]1C[C@@H](Nc2nc(C)[nH+]cc2C)C1 ZINC000656200632 488066380 /nfs/dbraw/zinc/06/63/80/488066380.db2.gz SNZLQJBUBXUFDK-PHIMTYICSA-N 1 2 221.304 2.073 20 0 BEADLO C[C@@]1(O)CC[N@H+](Cc2ccc(F)c(F)c2F)C1 ZINC000667688545 488087373 /nfs/dbraw/zinc/08/73/73/488087373.db2.gz WNBFFYJBOCNVRS-GFCCVEGCSA-N 1 2 245.244 2.061 20 0 BEADLO C[C@@]1(O)CC[N@@H+](Cc2ccc(F)c(F)c2F)C1 ZINC000667688545 488087378 /nfs/dbraw/zinc/08/73/78/488087378.db2.gz WNBFFYJBOCNVRS-GFCCVEGCSA-N 1 2 245.244 2.061 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@@H](CC)C2)cn1 ZINC000347682569 488088517 /nfs/dbraw/zinc/08/85/17/488088517.db2.gz YMPGLWOUARJZAC-AWEZNQCLSA-N 1 2 234.343 2.255 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@@H](CC)C2)cn1 ZINC000347682569 488088519 /nfs/dbraw/zinc/08/85/19/488088519.db2.gz YMPGLWOUARJZAC-AWEZNQCLSA-N 1 2 234.343 2.255 20 0 BEADLO CCn1cc(C[N@H+](C)Cc2cc(C)ccn2)cn1 ZINC000683009247 488089599 /nfs/dbraw/zinc/08/95/99/488089599.db2.gz KWAWISSRLBXWJL-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1cc(C[N@@H+](C)Cc2cc(C)ccn2)cn1 ZINC000683009247 488089604 /nfs/dbraw/zinc/08/96/04/488089604.db2.gz KWAWISSRLBXWJL-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO Cc1ccnc(C[NH+](C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC000683010615 488090341 /nfs/dbraw/zinc/09/03/41/488090341.db2.gz CIFDNNGOQCENOW-DZGCQCFKSA-N 1 2 247.386 2.305 20 0 BEADLO Cc1ccnc(C[NH+](C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC000683010615 488090344 /nfs/dbraw/zinc/09/03/44/488090344.db2.gz CIFDNNGOQCENOW-DZGCQCFKSA-N 1 2 247.386 2.305 20 0 BEADLO Cn1nc(C(F)(F)F)cc1C[NH+]1CCCCC1 ZINC000667712476 488096955 /nfs/dbraw/zinc/09/69/55/488096955.db2.gz HCIMIXSRYOROCA-UHFFFAOYSA-N 1 2 247.264 2.425 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+]2CC[C@H](C(F)(F)F)C2)n1 ZINC000677714021 488097567 /nfs/dbraw/zinc/09/75/67/488097567.db2.gz NZTIEHLVIGBEOQ-SVRRBLITSA-N 1 2 249.236 2.323 20 0 BEADLO Cc1noc([C@@H](C)[N@H+]2CC[C@H](C(F)(F)F)C2)n1 ZINC000677714021 488097569 /nfs/dbraw/zinc/09/75/69/488097569.db2.gz NZTIEHLVIGBEOQ-SVRRBLITSA-N 1 2 249.236 2.323 20 0 BEADLO CCn1ccc(C[N@H+](C)Cc2cc(C)n(C)n2)c1 ZINC000683031666 488101768 /nfs/dbraw/zinc/10/17/68/488101768.db2.gz YIEYHUOXGFCEQS-UHFFFAOYSA-N 1 2 246.358 2.182 20 0 BEADLO CCn1ccc(C[N@@H+](C)Cc2cc(C)n(C)n2)c1 ZINC000683031666 488101773 /nfs/dbraw/zinc/10/17/73/488101773.db2.gz YIEYHUOXGFCEQS-UHFFFAOYSA-N 1 2 246.358 2.182 20 0 BEADLO C[C@H](CO)c1ccc(-c2[nH+]ccn2C)cc1 ZINC000258147471 488103106 /nfs/dbraw/zinc/10/31/06/488103106.db2.gz KJHUYODWMSZOLU-SNVBAGLBSA-N 1 2 216.284 2.183 20 0 BEADLO FC(F)[C@H]1CC[N@H+](Cc2nnc(C3CC3)o2)C1 ZINC000677736584 488115343 /nfs/dbraw/zinc/11/53/43/488115343.db2.gz UGUGFADHASPTLL-QMMMGPOBSA-N 1 2 243.257 2.034 20 0 BEADLO FC(F)[C@H]1CC[N@@H+](Cc2nnc(C3CC3)o2)C1 ZINC000677736584 488115348 /nfs/dbraw/zinc/11/53/48/488115348.db2.gz UGUGFADHASPTLL-QMMMGPOBSA-N 1 2 243.257 2.034 20 0 BEADLO CCC(CC)CNC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000517390452 488121834 /nfs/dbraw/zinc/12/18/34/488121834.db2.gz DJSRLBXDPHVUHI-JTQLQIEISA-N 1 2 237.347 2.141 20 0 BEADLO CCC(CC)CNC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000517390452 488121839 /nfs/dbraw/zinc/12/18/39/488121839.db2.gz DJSRLBXDPHVUHI-JTQLQIEISA-N 1 2 237.347 2.141 20 0 BEADLO Cn1c2ccccc2[nH+]c1N[C@@H](CO)CC1CC1 ZINC000677811027 488128599 /nfs/dbraw/zinc/12/85/99/488128599.db2.gz VWYFOVNTDJAQMI-LLVKDONJSA-N 1 2 245.326 2.146 20 0 BEADLO Cn1c2ccccc2[nH+]c1N1CC[C@H]2C[C@H]2C1 ZINC000664524210 487553047 /nfs/dbraw/zinc/55/30/47/487553047.db2.gz KJMCHPMKRWKYPK-QWRGUYRKSA-N 1 2 227.311 2.420 20 0 BEADLO C[N@H+](Cc1ncc(C2CC2)o1)CC1=CCCOC1 ZINC000685462972 487530953 /nfs/dbraw/zinc/53/09/53/487530953.db2.gz VNBKVDAAYPJKGR-UHFFFAOYSA-N 1 2 248.326 2.331 20 0 BEADLO C[N@@H+](Cc1ncc(C2CC2)o1)CC1=CCCOC1 ZINC000685462972 487530956 /nfs/dbraw/zinc/53/09/56/487530956.db2.gz VNBKVDAAYPJKGR-UHFFFAOYSA-N 1 2 248.326 2.331 20 0 BEADLO CCc1nnc(C[N@@H+]2CC[C@@H](C(F)F)C2)s1 ZINC000680070793 487531859 /nfs/dbraw/zinc/53/18/59/487531859.db2.gz MKDYNONCWWARFC-SSDOTTSWSA-N 1 2 247.314 2.188 20 0 BEADLO CCc1nnc(C[N@H+]2CC[C@@H](C(F)F)C2)s1 ZINC000680070793 487531865 /nfs/dbraw/zinc/53/18/65/487531865.db2.gz MKDYNONCWWARFC-SSDOTTSWSA-N 1 2 247.314 2.188 20 0 BEADLO C[N@H+](Cc1cn[nH]c1)Cc1cccc(F)c1F ZINC000673928116 487482268 /nfs/dbraw/zinc/48/22/68/487482268.db2.gz XHXLNNHRGZKQNS-UHFFFAOYSA-N 1 2 237.253 2.320 20 0 BEADLO C[N@@H+](Cc1cn[nH]c1)Cc1cccc(F)c1F ZINC000673928116 487482272 /nfs/dbraw/zinc/48/22/72/487482272.db2.gz XHXLNNHRGZKQNS-UHFFFAOYSA-N 1 2 237.253 2.320 20 0 BEADLO CCc1cc(NC[C@]2(C)CCCC[C@@H]2O)nc[nH+]1 ZINC000673933461 487484628 /nfs/dbraw/zinc/48/46/28/487484628.db2.gz UGAKCASWFREULE-JSGCOSHPSA-N 1 2 249.358 2.392 20 0 BEADLO Cc1cc(N[C@H](C)C[C@@H](C)O)nc(C2CC2)[nH+]1 ZINC000679934098 487497011 /nfs/dbraw/zinc/49/70/11/487497011.db2.gz YDMPIJPPMBPTHU-PSASIEDQSA-N 1 2 235.331 2.234 20 0 BEADLO Cc1noc([C@H](C)[NH2+][C@@H](C)c2ccncc2)n1 ZINC000679934420 487498225 /nfs/dbraw/zinc/49/82/25/487498225.db2.gz PRSFJRBHQVCZJJ-IUCAKERBSA-N 1 2 232.287 2.185 20 0 BEADLO COC[C@@H](C)CNc1cc[nH+]c(C(C)(C)C)n1 ZINC000674064094 487506427 /nfs/dbraw/zinc/50/64/27/487506427.db2.gz QRZRCDYWJMTMAA-JTQLQIEISA-N 1 2 237.347 2.469 20 0 BEADLO Cc1nc(CNc2cc[nH+]c(C(C)(C)C)n2)no1 ZINC000674065985 487507777 /nfs/dbraw/zinc/50/77/77/487507777.db2.gz SLEOIVUNTJCCGV-UHFFFAOYSA-N 1 2 247.302 2.078 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NCc2c[nH+]cn2C)C[C@@H]1C ZINC000295935847 487515763 /nfs/dbraw/zinc/51/57/63/487515763.db2.gz GHUFXKBZPXGKNS-GRYCIOLGSA-N 1 2 249.358 2.109 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1c(C)cnn1C ZINC000685414756 487517589 /nfs/dbraw/zinc/51/75/89/487517589.db2.gz COESTIYLKNHZCO-UHFFFAOYSA-N 1 2 233.315 2.344 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1c(C)cnn1C ZINC000685414756 487517593 /nfs/dbraw/zinc/51/75/93/487517593.db2.gz COESTIYLKNHZCO-UHFFFAOYSA-N 1 2 233.315 2.344 20 0 BEADLO CC(C)(C)c1nc(N[C@@H]2CCC[C@H]2O)cc[nH+]1 ZINC000665727845 487525583 /nfs/dbraw/zinc/52/55/83/487525583.db2.gz BHVMLXAPTBJPCR-NXEZZACHSA-N 1 2 235.331 2.099 20 0 BEADLO CCc1nc(CC)n(Cc2ccc[nH+]c2C)n1 ZINC000685579970 487557060 /nfs/dbraw/zinc/55/70/60/487557060.db2.gz KDNKKAVPYNSZKE-UHFFFAOYSA-N 1 2 230.315 2.155 20 0 BEADLO CC(C)(C)c1nc(NCCc2cn[nH]c2)cc[nH+]1 ZINC000685924796 487598251 /nfs/dbraw/zinc/59/82/51/487598251.db2.gz STESKOLCKRXYTO-UHFFFAOYSA-N 1 2 245.330 2.152 20 0 BEADLO Clc1cnc(N2CCn3c[nH+]cc3C2)s1 ZINC000685925356 487598332 /nfs/dbraw/zinc/59/83/32/487598332.db2.gz NGNZKFSEZOGHHC-UHFFFAOYSA-N 1 2 240.719 2.013 20 0 BEADLO c1cn(-c2ccccc2)nc1C[NH+]1CC2(CC2)C1 ZINC000335382779 487621637 /nfs/dbraw/zinc/62/16/37/487621637.db2.gz IFGKWQGHJQJBBX-UHFFFAOYSA-N 1 2 239.322 2.468 20 0 BEADLO CCn1c2ccccc2[nH+]c1NCc1ncc[nH]1 ZINC000680851192 487658678 /nfs/dbraw/zinc/65/86/78/487658678.db2.gz CDWXGSMVGKCTIV-UHFFFAOYSA-N 1 2 241.298 2.391 20 0 BEADLO CCc1cc(N[C@@H]2CCC[C@@H]2CCO)nc[nH+]1 ZINC000681674673 487838442 /nfs/dbraw/zinc/83/84/42/487838442.db2.gz CMXMFFCGTHUMJT-ZYHUDNBSSA-N 1 2 235.331 2.002 20 0 BEADLO C[C@@H]([NH2+]Cc1n[nH]c2ccccc21)c1cn[nH]c1 ZINC000677425397 488033561 /nfs/dbraw/zinc/03/35/61/488033561.db2.gz BILVLXOYDYXFHM-SECBINFHSA-N 1 2 241.298 2.137 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)[C@H]1C[C@H]2C[C@H]2C1 ZINC000668637429 488035615 /nfs/dbraw/zinc/03/56/15/488035615.db2.gz ODNVMEFWDAHGQF-URLYPYJESA-N 1 2 241.294 2.319 20 0 BEADLO Cc1ccc(Cc2noc(C3(C)CC3)n2)c[nH+]1 ZINC000335828647 488147480 /nfs/dbraw/zinc/14/74/80/488147480.db2.gz MXIFNMQDRPWEQS-UHFFFAOYSA-N 1 2 229.283 2.415 20 0 BEADLO Cc1ccc(N[C@@H]2CO[C@H](C3CC3)C2)c[nH+]1 ZINC000667909621 488153514 /nfs/dbraw/zinc/15/35/14/488153514.db2.gz YLQDLKIYHXETMK-STQMWFEESA-N 1 2 218.300 2.369 20 0 BEADLO CCc1cc(N2CCC23CCOCC3)nc(C)[nH+]1 ZINC000683397346 488157826 /nfs/dbraw/zinc/15/78/26/488157826.db2.gz ZRQRITPDPKUPDM-UHFFFAOYSA-N 1 2 247.342 2.107 20 0 BEADLO C[C@H]1CCN(Cc2c[nH+]c3n2CCC3)C[C@H]1F ZINC000667943711 488164516 /nfs/dbraw/zinc/16/45/16/488164516.db2.gz YLVSAPRQEBMQET-CMPLNLGQSA-N 1 2 237.322 2.009 20 0 BEADLO Cc1cnc(N2CCC[C@H](n3cc[nH+]c3)C2)s1 ZINC000683457089 488166078 /nfs/dbraw/zinc/16/60/78/488166078.db2.gz IBWLVZPADIFDHM-NSHDSACASA-N 1 2 248.355 2.490 20 0 BEADLO Cc1cccn2c(NC(=O)N[C@@H]3C[C@H]3C)c[nH+]c12 ZINC000667949993 488166530 /nfs/dbraw/zinc/16/65/30/488166530.db2.gz UYAJGROWJAGHFI-NXEZZACHSA-N 1 2 244.298 2.173 20 0 BEADLO CCn1cc(C[NH2+][C@@H]2CCCc3occc32)nn1 ZINC000404518951 488166801 /nfs/dbraw/zinc/16/68/01/488166801.db2.gz YUAQQNAFUJVXQH-GFCCVEGCSA-N 1 2 246.314 2.058 20 0 BEADLO Cc1cccn2c(NC(=O)NC3CCC3)c[nH+]c12 ZINC000667950860 488167553 /nfs/dbraw/zinc/16/75/53/488167553.db2.gz REDSJLOTDRWBDW-UHFFFAOYSA-N 1 2 244.298 2.317 20 0 BEADLO COc1ccc(N[C@@H]2CS[C@H](C)C2)[nH+]c1 ZINC000397908522 488169208 /nfs/dbraw/zinc/16/92/08/488169208.db2.gz YQMRXBYYFBBYGD-BDAKNGLRSA-N 1 2 224.329 2.396 20 0 BEADLO C[C@H]1C[N@H+](CCOCc2ccccc2)CCC1=O ZINC000390741549 488176754 /nfs/dbraw/zinc/17/67/54/488176754.db2.gz MIXVDIXIGSXJNJ-ZDUSSCGKSA-N 1 2 247.338 2.114 20 0 BEADLO C[C@H]1C[N@@H+](CCOCc2ccccc2)CCC1=O ZINC000390741549 488176760 /nfs/dbraw/zinc/17/67/60/488176760.db2.gz MIXVDIXIGSXJNJ-ZDUSSCGKSA-N 1 2 247.338 2.114 20 0 BEADLO CC(C)c1nc(N(C)C)nc(NCC2CCC2)[nH+]1 ZINC000678064174 488190050 /nfs/dbraw/zinc/19/00/50/488190050.db2.gz ILEVZEIAOJKCFI-UHFFFAOYSA-N 1 2 249.362 2.273 20 0 BEADLO CC(C)c1nc(NCC2CCC2)nc(N(C)C)[nH+]1 ZINC000678064174 488190056 /nfs/dbraw/zinc/19/00/56/488190056.db2.gz ILEVZEIAOJKCFI-UHFFFAOYSA-N 1 2 249.362 2.273 20 0 BEADLO Cc1cc(NC(=O)N[C@@H](C)C2CCC2)c(C)c[nH+]1 ZINC000678097287 488197678 /nfs/dbraw/zinc/19/76/78/488197678.db2.gz WSUMIFADIDKXNM-NSHDSACASA-N 1 2 247.342 2.430 20 0 BEADLO Fc1ccc(C[NH2+][C@@H]2CCn3ccnc32)c(F)c1 ZINC000335916471 488200507 /nfs/dbraw/zinc/20/05/07/488200507.db2.gz BOCAMDOOXFRZOY-GFCCVEGCSA-N 1 2 249.264 2.396 20 0 BEADLO CC(C)c1cc(C[NH2+][C@@H](C)c2ccnn2C)on1 ZINC000683690730 488207131 /nfs/dbraw/zinc/20/71/31/488207131.db2.gz PHMWIZFFPNUKAU-JTQLQIEISA-N 1 2 248.330 2.382 20 0 BEADLO Cc1cc(C)cc(C[NH2+]Cc2csnn2)c1 ZINC000398475652 488218283 /nfs/dbraw/zinc/21/82/83/488218283.db2.gz PRRNSMYDSMGBPF-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO CC1=CC[C@@](C)(C(=O)NCc2[nH+]ccn2C)CC1 ZINC000668193620 488219740 /nfs/dbraw/zinc/21/97/40/488219740.db2.gz KFZMRJNWQICJJP-CQSZACIVSA-N 1 2 247.342 2.173 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1ccc(F)c(F)c1F ZINC000668192834 488219767 /nfs/dbraw/zinc/21/97/67/488219767.db2.gz OLNLVPQKRUXHDU-VIFPVBQESA-N 1 2 245.244 2.325 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1ccc(F)c(F)c1F ZINC000668192834 488219769 /nfs/dbraw/zinc/21/97/69/488219769.db2.gz OLNLVPQKRUXHDU-VIFPVBQESA-N 1 2 245.244 2.325 20 0 BEADLO c1cc([C@H]2C[N@H+](Cc3cn[nH]c3)CCO2)cs1 ZINC000678284837 488237267 /nfs/dbraw/zinc/23/72/67/488237267.db2.gz JVEJMXAPHNSFSP-GFCCVEGCSA-N 1 2 249.339 2.045 20 0 BEADLO c1cc([C@H]2C[N@@H+](Cc3cn[nH]c3)CCO2)cs1 ZINC000678284837 488237269 /nfs/dbraw/zinc/23/72/69/488237269.db2.gz JVEJMXAPHNSFSP-GFCCVEGCSA-N 1 2 249.339 2.045 20 0 BEADLO CCC[C@H](C)CC(=O)N[C@H]1CCc2c[nH+]cn2C1 ZINC000672145237 488240691 /nfs/dbraw/zinc/24/06/91/488240691.db2.gz BAUBUMRZOHQVJP-RYUDHWBXSA-N 1 2 249.358 2.140 20 0 BEADLO CC(C)C[C@H](C)NC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000683919783 488244819 /nfs/dbraw/zinc/24/48/19/488244819.db2.gz OKTWASYEJMETKX-JTQLQIEISA-N 1 2 237.347 2.238 20 0 BEADLO O=C(CCn1cc[nH+]c1)N1CCC2(CCC2)CC1 ZINC000672254471 488247963 /nfs/dbraw/zinc/24/79/63/488247963.db2.gz VMKKDMANGGCHDS-UHFFFAOYSA-N 1 2 247.342 2.066 20 0 BEADLO Nc1nc(N2CCC[C@H]3C[C@H]32)[nH+]c2ccccc12 ZINC000672323090 488251152 /nfs/dbraw/zinc/25/11/52/488251152.db2.gz XESDPOZFJSPTJR-JOYOIKCWSA-N 1 2 240.310 2.201 20 0 BEADLO COc1ccncc1C[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000672553078 488259398 /nfs/dbraw/zinc/25/93/98/488259398.db2.gz ZNBKLAMHYMUTEY-PWSUYJOCSA-N 1 2 238.306 2.270 20 0 BEADLO COc1ccncc1C[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000672553078 488259401 /nfs/dbraw/zinc/25/94/01/488259401.db2.gz ZNBKLAMHYMUTEY-PWSUYJOCSA-N 1 2 238.306 2.270 20 0 BEADLO CN(Cc1ccsc1)C(=O)CCc1[nH]cc[nH+]1 ZINC000672686085 488263780 /nfs/dbraw/zinc/26/37/80/488263780.db2.gz ZWALXEFVNYVOOR-UHFFFAOYSA-N 1 2 249.339 2.062 20 0 BEADLO Cc1nnc(C[N@H+](C)CCOC(C)(C)C)s1 ZINC000678625464 488273799 /nfs/dbraw/zinc/27/37/99/488273799.db2.gz WFVXBWQZSIJJTO-UHFFFAOYSA-N 1 2 243.376 2.093 20 0 BEADLO Cc1nnc(C[N@@H+](C)CCOC(C)(C)C)s1 ZINC000678625464 488273800 /nfs/dbraw/zinc/27/38/00/488273800.db2.gz WFVXBWQZSIJJTO-UHFFFAOYSA-N 1 2 243.376 2.093 20 0 BEADLO CCc1cc(NC[C@@H]2CCC[C@@H]2OC)nc[nH+]1 ZINC000678720939 488278332 /nfs/dbraw/zinc/27/83/32/488278332.db2.gz SKDYYPUQLZETCR-JQWIXIFHSA-N 1 2 235.331 2.266 20 0 BEADLO CCc1cc(NC[C@H]2CCC[C@@H]2OC)nc[nH+]1 ZINC000678720940 488278430 /nfs/dbraw/zinc/27/84/30/488278430.db2.gz SKDYYPUQLZETCR-PWSUYJOCSA-N 1 2 235.331 2.266 20 0 BEADLO Fc1c[nH+]ccc1N1C[C@@H]2CCC[C@H]2C1 ZINC000678787369 488282925 /nfs/dbraw/zinc/28/29/25/488282925.db2.gz LDECZAJRGPLUQV-UWVGGRQHSA-N 1 2 206.264 2.457 20 0 BEADLO COC[C@@H]1CCCN(c2cc[nH+]cc2F)C1 ZINC000678787493 488283320 /nfs/dbraw/zinc/28/33/20/488283320.db2.gz PQWOKWDTODFCNF-SNVBAGLBSA-N 1 2 224.279 2.084 20 0 BEADLO Fc1c[nH+]ccc1NCCOc1ccccc1 ZINC000678788860 488283569 /nfs/dbraw/zinc/28/35/69/488283569.db2.gz OUQHWEQYXZDCFZ-UHFFFAOYSA-N 1 2 232.258 2.134 20 0 BEADLO Cc1cccc(OCCNc2cc[nH+]cc2F)c1 ZINC000678788613 488283604 /nfs/dbraw/zinc/28/36/04/488283604.db2.gz KLXOYINBGOQUBO-UHFFFAOYSA-N 1 2 246.285 2.442 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](C)c2c(C)noc2C)o1 ZINC000678804930 488285321 /nfs/dbraw/zinc/28/53/21/488285321.db2.gz JYCIXPUXKHHICA-QMMMGPOBSA-N 1 2 235.287 2.439 20 0 BEADLO CC(C)(C)c1nc(N[C@H]2CCCOC2)cc[nH+]1 ZINC000673488372 488290235 /nfs/dbraw/zinc/29/02/35/488290235.db2.gz BOQJKOVNSSWXDU-JTQLQIEISA-N 1 2 235.331 2.365 20 0 BEADLO COc1ccc(N[C@H]2CCC[C@@H](OC)C2)[nH+]c1 ZINC000684385304 488303819 /nfs/dbraw/zinc/30/38/19/488303819.db2.gz JKXSBXNBGWBMOE-WDEREUQCSA-N 1 2 236.315 2.460 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CCC[C@@H](OC)C1 ZINC000684391633 488304532 /nfs/dbraw/zinc/30/45/32/488304532.db2.gz CTDVXQBAHWNMRC-WDEREUQCSA-N 1 2 236.315 2.460 20 0 BEADLO CC[C@H](Nc1ccc(OC)c[nH+]1)[C@@H]1CCOC1 ZINC000679068463 488305337 /nfs/dbraw/zinc/30/53/37/488305337.db2.gz DTGKRVIKRPNBEG-PWSUYJOCSA-N 1 2 236.315 2.317 20 0 BEADLO CC[C@@H](Nc1ccc(OC)cn1)c1[nH+]ccn1C ZINC000679068938 488305713 /nfs/dbraw/zinc/30/57/13/488305713.db2.gz UFRQWBNWXZPYRX-LLVKDONJSA-N 1 2 246.314 2.387 20 0 BEADLO CC(C)(C)OCC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000679190132 488315607 /nfs/dbraw/zinc/31/56/07/488315607.db2.gz JGMQSTBYGRDBGA-UHFFFAOYSA-N 1 2 247.298 2.088 20 0 BEADLO CCc1cc(N(C)C[C@@H]2CCCC[C@@H]2O)nc[nH+]1 ZINC000679197816 488316278 /nfs/dbraw/zinc/31/62/78/488316278.db2.gz UPNFWIGRFSGCNV-AAEUAGOBSA-N 1 2 249.358 2.026 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)oc1C ZINC000679221435 488319918 /nfs/dbraw/zinc/31/99/18/488319918.db2.gz KUNUOYZQWMDKTQ-LDYMZIIASA-N 1 2 226.295 2.471 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)oc1C ZINC000679221435 488319920 /nfs/dbraw/zinc/31/99/20/488319920.db2.gz KUNUOYZQWMDKTQ-LDYMZIIASA-N 1 2 226.295 2.471 20 0 BEADLO COc1ccnc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)c1 ZINC000679223606 488320683 /nfs/dbraw/zinc/32/06/83/488320683.db2.gz QZNBAOLXWZZGDW-ZWNOBZJWSA-N 1 2 238.306 2.270 20 0 BEADLO COc1ccnc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)c1 ZINC000679223606 488320685 /nfs/dbraw/zinc/32/06/85/488320685.db2.gz QZNBAOLXWZZGDW-ZWNOBZJWSA-N 1 2 238.306 2.270 20 0 BEADLO COc1cc[nH+]c(CN2CC[C@@H](C)[C@H](F)C2)c1 ZINC000679223606 488320686 /nfs/dbraw/zinc/32/06/86/488320686.db2.gz QZNBAOLXWZZGDW-ZWNOBZJWSA-N 1 2 238.306 2.270 20 0 BEADLO Cc1nc(N2CC(C)(F)C2)c2c([nH+]1)CCCC2 ZINC000684592230 488329580 /nfs/dbraw/zinc/32/95/80/488329580.db2.gz GWYPYVPCRDOICF-UHFFFAOYSA-N 1 2 235.306 2.212 20 0 BEADLO CCc1nnc(C[N@@H+]2CCC=C(C)C2)s1 ZINC000684774168 488341577 /nfs/dbraw/zinc/34/15/77/488341577.db2.gz SENBSCNDSCUYGI-UHFFFAOYSA-N 1 2 223.345 2.253 20 0 BEADLO CCc1nnc(C[N@H+]2CCC=C(C)C2)s1 ZINC000684774168 488341578 /nfs/dbraw/zinc/34/15/78/488341578.db2.gz SENBSCNDSCUYGI-UHFFFAOYSA-N 1 2 223.345 2.253 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cncs2)C[C@H]1F ZINC000679357694 488344292 /nfs/dbraw/zinc/34/42/92/488344292.db2.gz DGDHGAFBVYKYTA-PSASIEDQSA-N 1 2 214.309 2.323 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cncs2)C[C@H]1F ZINC000679357694 488344293 /nfs/dbraw/zinc/34/42/93/488344293.db2.gz DGDHGAFBVYKYTA-PSASIEDQSA-N 1 2 214.309 2.323 20 0 BEADLO COc1ccc(N[C@H](C)c2c[nH]nc2C)[nH+]c1 ZINC000679359612 488345932 /nfs/dbraw/zinc/34/59/32/488345932.db2.gz PFNJCDQJHFCNHE-MRVPVSSYSA-N 1 2 232.287 2.295 20 0 BEADLO CCCn1cc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)cn1 ZINC000679361673 488346254 /nfs/dbraw/zinc/34/62/54/488346254.db2.gz UNTJBHALMMJYOQ-YPMHNXCESA-N 1 2 239.338 2.473 20 0 BEADLO CCCn1cc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)cn1 ZINC000679361673 488346256 /nfs/dbraw/zinc/34/62/56/488346256.db2.gz UNTJBHALMMJYOQ-YPMHNXCESA-N 1 2 239.338 2.473 20 0 BEADLO CCCCNc1cc(N2CC[C@@H](C)C2)nc(N)[nH+]1 ZINC000684839803 488348350 /nfs/dbraw/zinc/34/83/50/488348350.db2.gz SZXLWHRAJGSADY-SNVBAGLBSA-N 1 2 249.362 2.117 20 0 BEADLO CCCCNc1cc(N2CC[C@@H](C)C2)[nH+]c(N)n1 ZINC000684839803 488348353 /nfs/dbraw/zinc/34/83/53/488348353.db2.gz SZXLWHRAJGSADY-SNVBAGLBSA-N 1 2 249.362 2.117 20 0 BEADLO CC(C)C[C@@H](C)NC(=O)CCCn1cc[nH+]c1 ZINC000121453726 490092525 /nfs/dbraw/zinc/09/25/25/490092525.db2.gz AWVOXGOJBPHLJY-GFCCVEGCSA-N 1 2 237.347 2.214 20 0 BEADLO Cc1cc(N(C)Cc2ccco2)nc[nH+]1 ZINC000110113760 490103693 /nfs/dbraw/zinc/10/36/93/490103693.db2.gz FOLQTMDRRDHFBK-UHFFFAOYSA-N 1 2 203.245 2.014 20 0 BEADLO CCCCc1noc(C[N@H+]2CC=CCC2)n1 ZINC000679322459 490113264 /nfs/dbraw/zinc/11/32/64/490113264.db2.gz KCAKYKQVKSPZRH-UHFFFAOYSA-N 1 2 221.304 2.174 20 0 BEADLO CC(C)C[C@@H]1CCCN1C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493157156 490118254 /nfs/dbraw/zinc/11/82/54/490118254.db2.gz PZELDZZUPCXMKI-FYJFLYSWSA-N 1 2 247.342 2.460 20 0 BEADLO CCc1cc(N[C@@H]2CCC[C@@H](CO)C2)nc[nH+]1 ZINC000384089129 490179450 /nfs/dbraw/zinc/17/94/50/490179450.db2.gz YOROYXVTHOEJNF-ZYHUDNBSSA-N 1 2 235.331 2.002 20 0 BEADLO CC[C@@H](Nc1ncc(C)cn1)c1[nH]cc[nH+]1 ZINC000125217543 490420028 /nfs/dbraw/zinc/42/00/28/490420028.db2.gz TZLRSQLGAWXXNP-SECBINFHSA-N 1 2 217.276 2.071 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]Cc1ccccc1CO ZINC000305106537 490435166 /nfs/dbraw/zinc/43/51/66/490435166.db2.gz FDCNSSYIPVUUPM-SNVBAGLBSA-N 1 2 245.326 2.061 20 0 BEADLO C[C@@H](NC(=O)CCc1c[nH]c[nH+]1)c1ccccc1 ZINC000074726843 490500535 /nfs/dbraw/zinc/50/05/35/490500535.db2.gz YXITWTXHZLRSQB-LLVKDONJSA-N 1 2 243.310 2.220 20 0 BEADLO C[C@@H](NC(=O)CCc1c[nH+]c[nH]1)c1ccccc1 ZINC000074726843 490500527 /nfs/dbraw/zinc/50/05/27/490500527.db2.gz YXITWTXHZLRSQB-LLVKDONJSA-N 1 2 243.310 2.220 20 0 BEADLO CCc1cc(N[C@@H](CO)C2CCCCC2)nc[nH+]1 ZINC000075066308 490514389 /nfs/dbraw/zinc/51/43/89/490514389.db2.gz MSDSNLUQSBROKL-ZDUSSCGKSA-N 1 2 249.358 2.392 20 0 BEADLO Cc1nc(C[NH2+][C@@H](C)c2nccnc2C)cs1 ZINC000219103337 490553328 /nfs/dbraw/zinc/55/33/28/490553328.db2.gz DEGXQFSVVTUZLP-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)Nc1cccc(F)c1 ZINC000080526802 490641839 /nfs/dbraw/zinc/64/18/39/490641839.db2.gz CCGRQZQFAYIGCJ-UHFFFAOYSA-N 1 2 248.261 2.213 20 0 BEADLO COc1ccccc1C[NH2+]Cc1ncc(C)o1 ZINC000227083964 491054834 /nfs/dbraw/zinc/05/48/34/491054834.db2.gz ZICFLZCECQOWJG-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO C[C@H]([NH2+]CC(F)F)c1ccc2c(c1)OCCO2 ZINC000136570924 491061163 /nfs/dbraw/zinc/06/11/63/491061163.db2.gz RUZBYIYRQSIMII-QMMMGPOBSA-N 1 2 243.253 2.374 20 0 BEADLO CCc1nn(C)cc1Nc1cc(CC)[nH+]c(C)n1 ZINC000227867392 491065796 /nfs/dbraw/zinc/06/57/96/491065796.db2.gz SHVDNRAFODOZTG-UHFFFAOYSA-N 1 2 245.330 2.387 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@@H+]1Cc1cocn1 ZINC000651911981 491078560 /nfs/dbraw/zinc/07/85/60/491078560.db2.gz GWKSQUFVLHIDPZ-LLVKDONJSA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@H+]1Cc1cocn1 ZINC000651911981 491078561 /nfs/dbraw/zinc/07/85/61/491078561.db2.gz GWKSQUFVLHIDPZ-LLVKDONJSA-N 1 2 224.304 2.064 20 0 BEADLO CCc1cc(NC[C@H]2CCSC2)nc[nH+]1 ZINC000228582187 491095692 /nfs/dbraw/zinc/09/56/92/491095692.db2.gz YGETZOTZLMPCNO-SECBINFHSA-N 1 2 223.345 2.204 20 0 BEADLO CC[C@@H](C)CONC(=O)c1ccc2[nH+]ccn2c1 ZINC000293658276 491114328 /nfs/dbraw/zinc/11/43/28/491114328.db2.gz HLGNWSZAWWPPLT-SNVBAGLBSA-N 1 2 247.298 2.042 20 0 BEADLO C[C@H]([NH2+]Cc1ccccc1F)c1ncc[nH]1 ZINC000124814537 491128615 /nfs/dbraw/zinc/12/86/15/491128615.db2.gz CDNQZECFKMEXDU-VIFPVBQESA-N 1 2 219.263 2.400 20 0 BEADLO C[C@@H]1CCN(C(=O)CCCn2cc[nH+]c2)C[C@H]1C ZINC000132886879 491141559 /nfs/dbraw/zinc/14/15/59/491141559.db2.gz AUEPULOMWNZUBX-CHWSQXEVSA-N 1 2 249.358 2.168 20 0 BEADLO Cc1cc(N[C@H](C)C[C@H]2CCOC2)nc[nH+]1 ZINC000309525012 491149953 /nfs/dbraw/zinc/14/99/53/491149953.db2.gz CLYLERLXVZGSOR-GHMZBOCLSA-N 1 2 221.304 2.012 20 0 BEADLO C[C@@H]1CCC[C@@H](C)C1NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493230147 533725751 /nfs/dbraw/zinc/72/57/51/533725751.db2.gz UPEUQUGZIVNFET-AFPRHGJPSA-N 1 2 247.342 2.364 20 0 BEADLO C[C@@H]1CCC[C@H](CNC(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492768696 533840034 /nfs/dbraw/zinc/84/00/34/533840034.db2.gz PEYNALOHNGWIEJ-DUVUQDDDSA-N 1 2 247.342 2.365 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)C=Cc2c[nH]c[nH+]2)[C@@H]1C ZINC000493685788 533859594 /nfs/dbraw/zinc/85/95/94/533859594.db2.gz KUPIRCTWBQHRLC-IVBWLTEPSA-N 1 2 247.342 2.364 20 0 BEADLO C[C@@H]1CCN(C(=O)C=Cc2c[nH]c[nH+]2)CC1(C)C ZINC000492902301 533912967 /nfs/dbraw/zinc/91/29/67/533912967.db2.gz QQYUVLZAIABURS-DOGVGXBMSA-N 1 2 247.342 2.318 20 0 BEADLO CCCCCC[C@@H](C)[NH2+]CC(=O)NOCC ZINC000846091930 582644430 /nfs/dbraw/zinc/64/44/30/582644430.db2.gz RAOCRFVUUSFMLX-LLVKDONJSA-N 1 2 230.352 2.003 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)/C=C/C(C)(C)C)S1 ZINC000493240372 534002558 /nfs/dbraw/zinc/00/25/58/534002558.db2.gz OYOKMWQLQNVXHQ-GJIOHYHPSA-N 1 2 226.345 2.196 20 0 BEADLO CC(C)CCNc1cc(N(C)C)nc[nH+]1 ZINC000891413617 582680454 /nfs/dbraw/zinc/68/04/54/582680454.db2.gz XROMDJXTFWMWGH-UHFFFAOYSA-N 1 2 208.309 2.001 20 0 BEADLO CC(C)CCNc1cc(N(C)C)[nH+]cn1 ZINC000891413617 582680459 /nfs/dbraw/zinc/68/04/59/582680459.db2.gz XROMDJXTFWMWGH-UHFFFAOYSA-N 1 2 208.309 2.001 20 0 BEADLO C[C@H](O)c1cccc(NC[C@H]2C[C@@H]2C)[nH+]1 ZINC000891824413 582726949 /nfs/dbraw/zinc/72/69/49/582726949.db2.gz BVLVNPYBKBKYSN-LPEHRKFASA-N 1 2 206.289 2.203 20 0 BEADLO COC(=O)[C@@H](c1ccc(Cl)cc1)[NH+](C)C ZINC000095532609 523653399 /nfs/dbraw/zinc/65/33/99/523653399.db2.gz MCQRFSDDLXZPSV-SNVBAGLBSA-N 1 2 227.691 2.116 20 0 BEADLO O=C(/C=C\C1CC1)Nc1c[nH+]c2n1CCCC2 ZINC000493822851 534790005 /nfs/dbraw/zinc/79/00/05/534790005.db2.gz YDHPUINPCSZQOC-SREVYHEPSA-N 1 2 231.299 2.124 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N(C1CC1)C1CCCC1 ZINC000493787871 534800427 /nfs/dbraw/zinc/80/04/27/534800427.db2.gz VTDLLZNFCUFQMP-YVMONPNESA-N 1 2 245.326 2.357 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CCC[C@@H]1C1CCC1 ZINC000493401767 534801381 /nfs/dbraw/zinc/80/13/81/534801381.db2.gz MFKZQNLDAZTOLQ-FMFIFOJESA-N 1 2 245.326 2.214 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)Nc1cc(F)cc(F)c1 ZINC000493260296 534804894 /nfs/dbraw/zinc/80/48/94/534804894.db2.gz OJPJQSPWCGVKQV-UPHRSURJSA-N 1 2 249.220 2.340 20 0 BEADLO CC(C)c1nc(N2CCCC[C@H]2CCO)cc[nH+]1 ZINC000120539931 534908419 /nfs/dbraw/zinc/90/84/19/534908419.db2.gz ILWCGVJZSVZLJA-LBPRGKRZSA-N 1 2 249.358 2.341 20 0 BEADLO CC(C)c1nc(N2CCOC[C@H]2C2CC2)cc[nH+]1 ZINC000302124536 534910557 /nfs/dbraw/zinc/91/05/57/534910557.db2.gz HUWYWIIGIUIFJR-LBPRGKRZSA-N 1 2 247.342 2.215 20 0 BEADLO CC(C)c1nc(N2CCO[C@H]3CCC[C@H]32)cc[nH+]1 ZINC000366588631 534910594 /nfs/dbraw/zinc/91/05/94/534910594.db2.gz ZRYSVKZWPKKNBL-NEPJUHHUSA-N 1 2 247.342 2.358 20 0 BEADLO CC(C)(C)[C@@H]1CCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493161637 526667968 /nfs/dbraw/zinc/66/79/68/526667968.db2.gz TWPYABURWWGDHK-DOGVGXBMSA-N 1 2 247.342 2.318 20 0 BEADLO C/C=C(/C=C/C(=O)N1CCn2c[nH+]cc2C1)CC ZINC000493271295 527550488 /nfs/dbraw/zinc/55/04/88/527550488.db2.gz MEBUIYPPOOOJFC-VLLKVAHVSA-N 1 2 245.326 2.138 20 0 BEADLO CCC1(NC(=O)/C=C\c2[nH]cc[nH+]2)CCCC1 ZINC000493097528 527772851 /nfs/dbraw/zinc/77/28/51/527772851.db2.gz XRUVPDJNFQQYFO-WAYWQWQTSA-N 1 2 233.315 2.262 20 0 BEADLO CCCN(CC)C(=O)/C=C/c1[nH+]ccn1CC ZINC000492528695 527947472 /nfs/dbraw/zinc/94/74/72/527947472.db2.gz FTXUYYQDXRCBNK-BQYQJAHWSA-N 1 2 235.331 2.175 20 0 BEADLO CCCC(C)(C)CC(=O)NCCn1cc[nH+]c1 ZINC000494309347 527980027 /nfs/dbraw/zinc/98/00/27/527980027.db2.gz ISTUOJYMFTYQKS-UHFFFAOYSA-N 1 2 237.347 2.216 20 0 BEADLO CCC[C@H](CC)NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493085899 528091073 /nfs/dbraw/zinc/09/10/73/528091073.db2.gz DEBNYTJFBGMNMX-FGEFZZPRSA-N 1 2 221.304 2.118 20 0 BEADLO CCC[C@H](CC)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493755023 528091931 /nfs/dbraw/zinc/09/19/31/528091931.db2.gz NRNPBCUPTHTYMM-GFVADAIESA-N 1 2 221.304 2.118 20 0 BEADLO CC1CCC(O)(C[N@H+](C)CC(F)F)CC1 ZINC000305172162 528201633 /nfs/dbraw/zinc/20/16/33/528201633.db2.gz FLPGSLWCRFGDCC-UHFFFAOYSA-N 1 2 221.291 2.125 20 0 BEADLO CC1CCC(O)(C[N@@H+](C)CC(F)F)CC1 ZINC000305172162 528201634 /nfs/dbraw/zinc/20/16/34/528201634.db2.gz FLPGSLWCRFGDCC-UHFFFAOYSA-N 1 2 221.291 2.125 20 0 BEADLO CCN(CCC1CC1)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492815824 528407130 /nfs/dbraw/zinc/40/71/30/528407130.db2.gz YJVLHJRUMMZIKD-WAYWQWQTSA-N 1 2 233.315 2.072 20 0 BEADLO CCC(C)(CC)NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493108043 528610096 /nfs/dbraw/zinc/61/00/96/528610096.db2.gz QXGVABXHQIPXOD-VOTSOKGWSA-N 1 2 221.304 2.118 20 0 BEADLO CC(C)N(CC1CC1)C(=O)/C=C\c1[nH]cc[nH+]1 ZINC000493303044 528869955 /nfs/dbraw/zinc/86/99/55/528869955.db2.gz OPDBUXBDGMZBEH-WAYWQWQTSA-N 1 2 233.315 2.070 20 0 BEADLO CC1(C)CCC[C@@H]1CNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492994681 528963145 /nfs/dbraw/zinc/96/31/45/528963145.db2.gz KHCWMRVURVJSAG-ISALQUGTSA-N 1 2 247.342 2.365 20 0 BEADLO CCC1(C(=O)NCc2[nH+]ccn2CC(C)C)CC1 ZINC000487580136 529004212 /nfs/dbraw/zinc/00/42/12/529004212.db2.gz AYGCIWVZHOBMDR-UHFFFAOYSA-N 1 2 249.358 2.346 20 0 BEADLO CCC1(C)CCN(C(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000492769317 529017375 /nfs/dbraw/zinc/01/73/75/529017375.db2.gz PQAMYXQMCIJTOT-PLNGDYQASA-N 1 2 247.342 2.462 20 0 BEADLO CC[C@H]1CCCN(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493821465 529211635 /nfs/dbraw/zinc/21/16/35/529211635.db2.gz LZKKAQLBSWGTLM-QRGHLMKCSA-N 1 2 233.315 2.072 20 0 BEADLO CC[C@@H]1CCCN(C(=O)/C=C/c2[nH]cc[nH+]2)CC1 ZINC000493778346 529291751 /nfs/dbraw/zinc/29/17/51/529291751.db2.gz BIWDIOREPUTMHG-BTDICHCPSA-N 1 2 247.342 2.462 20 0 BEADLO CC[C@@H](C)CN(CC)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492807249 529315149 /nfs/dbraw/zinc/31/51/49/529315149.db2.gz AYNUPDUVHHWVQV-JMEBYUIHSA-N 1 2 235.331 2.318 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493325676 529342099 /nfs/dbraw/zinc/34/20/99/529342099.db2.gz RWUYCGBCLBXNFF-FQLSZKSXSA-N 1 2 233.315 2.212 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CCO[C@H]3CCC[C@@H]32)cn1 ZINC000334346761 535059476 /nfs/dbraw/zinc/05/94/76/535059476.db2.gz WJFPRNGQDWIMFE-KBPBESRZSA-N 1 2 249.358 2.217 20 0 BEADLO CC(C)n1cc(C[N@H+]2CCO[C@H]3CCC[C@@H]32)cn1 ZINC000334346761 535059481 /nfs/dbraw/zinc/05/94/81/535059481.db2.gz WJFPRNGQDWIMFE-KBPBESRZSA-N 1 2 249.358 2.217 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CCOC[C@H]2C2CC2)cn1 ZINC000179908161 535059504 /nfs/dbraw/zinc/05/95/04/535059504.db2.gz TTXMDZHFKOFUCY-AWEZNQCLSA-N 1 2 249.358 2.075 20 0 BEADLO CC(C)n1cc(C[N@H+]2CCOC[C@H]2C2CC2)cn1 ZINC000179908161 535059518 /nfs/dbraw/zinc/05/95/18/535059518.db2.gz TTXMDZHFKOFUCY-AWEZNQCLSA-N 1 2 249.358 2.075 20 0 BEADLO CC(C)n1c[nH+]cc1CNCC(F)(F)F ZINC000085187705 535103189 /nfs/dbraw/zinc/10/31/89/535103189.db2.gz QAUXDZSSWBJYCD-UHFFFAOYSA-N 1 2 221.226 2.116 20 0 BEADLO CC[C@@H](C)CC(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000164503193 535478029 /nfs/dbraw/zinc/47/80/29/535478029.db2.gz HHGLVIWKRZIQRW-NXEZZACHSA-N 1 2 223.320 2.413 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1ccncc1F ZINC000336217616 535843892 /nfs/dbraw/zinc/84/38/92/535843892.db2.gz RQVSHFWQXMXTPS-CMPLNLGQSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccncc1F ZINC000336217616 535843899 /nfs/dbraw/zinc/84/38/99/535843899.db2.gz RQVSHFWQXMXTPS-CMPLNLGQSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H](NC(=O)[C@H]1CC1(C)C)c1[nH]cc[nH+]1 ZINC000218083037 535849641 /nfs/dbraw/zinc/84/96/41/535849641.db2.gz RRBMQCHRYHMDRU-BDAKNGLRSA-N 1 2 221.304 2.023 20 0 BEADLO C[NH+](C)Cc1nc([C@@H]2CCc3ccccc32)no1 ZINC000336182198 536064646 /nfs/dbraw/zinc/06/46/46/536064646.db2.gz PCCXSTHQPUYPBW-GFCCVEGCSA-N 1 2 243.310 2.209 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H]1CC[C@H](C)C1 ZINC000336143579 536086564 /nfs/dbraw/zinc/08/65/64/536086564.db2.gz VPOBCHJFLQIPRN-JQWIXIFHSA-N 1 2 232.327 2.441 20 0 BEADLO CCc1nc(N2C[C@H](C)O[C@@H](C)[C@@H]2C)cc(C)[nH+]1 ZINC000342959625 536126665 /nfs/dbraw/zinc/12/66/65/536126665.db2.gz KVWUWISCXJNTTK-SRVKXCTJSA-N 1 2 249.358 2.350 20 0 BEADLO CC[C@H]1C[N@H+]([C@H](C)c2csnn2)CCS1 ZINC000335579079 536159938 /nfs/dbraw/zinc/15/99/38/536159938.db2.gz IMGHZNUCLBFILY-BDAKNGLRSA-N 1 2 243.401 2.427 20 0 BEADLO CC[C@H]1C[N@@H+]([C@H](C)c2csnn2)CCS1 ZINC000335579079 536159933 /nfs/dbraw/zinc/15/99/33/536159933.db2.gz IMGHZNUCLBFILY-BDAKNGLRSA-N 1 2 243.401 2.427 20 0 BEADLO COCC[N@H+](CCCOC(C)C)CC(F)F ZINC000170900436 536836210 /nfs/dbraw/zinc/83/62/10/536836210.db2.gz IWCYJHGCQYGLAP-UHFFFAOYSA-N 1 2 239.306 2.015 20 0 BEADLO COCC[N@@H+](CCCOC(C)C)CC(F)F ZINC000170900436 536836216 /nfs/dbraw/zinc/83/62/16/536836216.db2.gz IWCYJHGCQYGLAP-UHFFFAOYSA-N 1 2 239.306 2.015 20 0 BEADLO COCC[N@@H+]1CCc2sc(Cl)cc2C1 ZINC000335381403 536879056 /nfs/dbraw/zinc/87/90/56/536879056.db2.gz ULAWHVVMPHJGNY-UHFFFAOYSA-N 1 2 231.748 2.406 20 0 BEADLO COCC[N@H+]1CCc2sc(Cl)cc2C1 ZINC000335381403 536879057 /nfs/dbraw/zinc/87/90/57/536879057.db2.gz ULAWHVVMPHJGNY-UHFFFAOYSA-N 1 2 231.748 2.406 20 0 BEADLO COc1ccc(N[C@H](C)[C@@H]2CCCO2)[nH+]c1 ZINC000230404773 566311727 /nfs/dbraw/zinc/31/17/27/566311727.db2.gz VHTZCWIOBYNYQY-KOLCDFICSA-N 1 2 222.288 2.070 20 0 BEADLO COc1ccc(N[C@@H](C)[C@@H]2CCCO2)[nH+]c1 ZINC000230404770 566311756 /nfs/dbraw/zinc/31/17/56/566311756.db2.gz VHTZCWIOBYNYQY-ONGXEEELSA-N 1 2 222.288 2.070 20 0 BEADLO C[C@@H](O)c1cccc(N[C@H]2CCSC2)[nH+]1 ZINC000892702673 582960752 /nfs/dbraw/zinc/96/07/52/582960752.db2.gz GODTZHDYFAHZCS-BDAKNGLRSA-N 1 2 224.329 2.052 20 0 BEADLO C[C@@H](O)c1cccc(N[C@@H]2CCSC2)[nH+]1 ZINC000892702676 582960250 /nfs/dbraw/zinc/96/02/50/582960250.db2.gz GODTZHDYFAHZCS-RKDXNWHRSA-N 1 2 224.329 2.052 20 0 BEADLO C[C@H](O)c1cccc(N[C@@H]2CCCSC2)[nH+]1 ZINC000892814521 582988108 /nfs/dbraw/zinc/98/81/08/582988108.db2.gz ZRFZHYFQILAQAF-VHSXEESVSA-N 1 2 238.356 2.442 20 0 BEADLO COCC[N@H+](CCF)[C@@H](C)c1ccccn1 ZINC000852481562 583014495 /nfs/dbraw/zinc/01/44/95/583014495.db2.gz MXWJSBOSVNXRQF-NSHDSACASA-N 1 2 226.295 2.061 20 0 BEADLO COCC[N@@H+](CCF)[C@@H](C)c1ccccn1 ZINC000852481562 583014498 /nfs/dbraw/zinc/01/44/98/583014498.db2.gz MXWJSBOSVNXRQF-NSHDSACASA-N 1 2 226.295 2.061 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+](C)C[C@H]2CCCO2)n1 ZINC000893923761 583248262 /nfs/dbraw/zinc/24/82/62/583248262.db2.gz HVOZLVGEPPBRGZ-LLVKDONJSA-N 1 2 237.347 2.144 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+](C)C[C@H]2CCCO2)n1 ZINC000893923761 583248266 /nfs/dbraw/zinc/24/82/66/583248266.db2.gz HVOZLVGEPPBRGZ-LLVKDONJSA-N 1 2 237.347 2.144 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@H](C)Cc1cccc(C)c1 ZINC000877476553 583317319 /nfs/dbraw/zinc/31/73/19/583317319.db2.gz HKDXRWGQQVHJPU-NEPJUHHUSA-N 1 2 235.327 2.077 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@@H]2CC[C@@H](C)C2)c1 ZINC000853508538 588746551 /nfs/dbraw/zinc/74/65/51/588746551.db2.gz IPIHCPKQZHVRLY-ZYHUDNBSSA-N 1 2 248.326 2.398 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@@H]2CC[C@H](C)C2)c1 ZINC000853508535 588746843 /nfs/dbraw/zinc/74/68/43/588746843.db2.gz IPIHCPKQZHVRLY-CMPLNLGQSA-N 1 2 248.326 2.398 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OCCOC(F)F ZINC000853637506 588751492 /nfs/dbraw/zinc/75/14/92/588751492.db2.gz UURWYYFIOPOOPX-UHFFFAOYSA-N 1 2 244.241 2.081 20 0 BEADLO NC(Cc1ccccc1)=[NH+]OCCC1(O)CCC1 ZINC000853655713 588752823 /nfs/dbraw/zinc/75/28/23/588752823.db2.gz MDORBECOHGOVJI-UHFFFAOYSA-N 1 2 248.326 2.033 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OC[C@@H]1CCCC[C@H]1C ZINC000853673131 588754584 /nfs/dbraw/zinc/75/45/84/588754584.db2.gz AZPKVQMZYSLDPB-MXWKQRLJSA-N 1 2 228.336 2.346 20 0 BEADLO CC[C@H](CO[NH+]=C(N)[C@H](C)OC)CC(F)F ZINC000853674342 588754873 /nfs/dbraw/zinc/75/48/73/588754873.db2.gz WQXNGSCIRYONQO-YUMQZZPRSA-N 1 2 238.278 2.201 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OCCCC1CCC1 ZINC000853674419 588754951 /nfs/dbraw/zinc/75/49/51/588754951.db2.gz YLZPBQOTMFAWDR-VIFPVBQESA-N 1 2 214.309 2.100 20 0 BEADLO CC(C)c1cccc(CO[NH+]=C(N)CCO)c1 ZINC000853687273 588756309 /nfs/dbraw/zinc/75/63/09/588756309.db2.gz NTTOAIBAMPSEAS-UHFFFAOYSA-N 1 2 236.315 2.191 20 0 BEADLO CCC(C)(C)CCO[NH+]=C(N)[C@@H]1CCCO1 ZINC000853697069 588757362 /nfs/dbraw/zinc/75/73/62/588757362.db2.gz DVBIEZXMFWDKKQ-JTQLQIEISA-N 1 2 228.336 2.490 20 0 BEADLO NC(=[NH+]OC[C@@H]1CC[C@@H]2C[C@@H]2C1)[C@@H]1CCCO1 ZINC000853698378 588757625 /nfs/dbraw/zinc/75/76/25/588757625.db2.gz PNMDTAUSGKEYLL-WYUUTHIRSA-N 1 2 238.331 2.100 20 0 BEADLO C1=C[C@H](Nc2cc(NC3CC3)[nH+]cn2)CC1 ZINC000853800622 588764180 /nfs/dbraw/zinc/76/41/80/588764180.db2.gz WUQNLTDVLCLBFZ-VIFPVBQESA-N 1 2 216.288 2.181 20 0 BEADLO C1=C[C@H](Nc2cc(NC3CC3)nc[nH+]2)CC1 ZINC000853800622 588764181 /nfs/dbraw/zinc/76/41/81/588764181.db2.gz WUQNLTDVLCLBFZ-VIFPVBQESA-N 1 2 216.288 2.181 20 0 BEADLO CC(C)c1nc(N2CC[C@H]3COC[C@@H]3C2)cc[nH+]1 ZINC000853934493 588769649 /nfs/dbraw/zinc/76/96/49/588769649.db2.gz RHJDKORWFYMUHZ-RYUDHWBXSA-N 1 2 247.342 2.073 20 0 BEADLO CC[NH2+]Cc1noc(C2CC3(CC3(F)F)C2)n1 ZINC000854132237 588775856 /nfs/dbraw/zinc/77/58/56/588775856.db2.gz QFOKLWLWSFKZPQ-UHFFFAOYSA-N 1 2 243.257 2.082 20 0 BEADLO CC(C)=CCC[C@@H](C)NC(=O)Cc1[nH]cc[nH+]1 ZINC000854749170 588805187 /nfs/dbraw/zinc/80/51/87/588805187.db2.gz FMUFNYSUZBWCAT-LLVKDONJSA-N 1 2 235.331 2.203 20 0 BEADLO CCC(F)(F)C(=O)NCc1c[nH+]c(C)cc1C ZINC000854887706 588815582 /nfs/dbraw/zinc/81/55/82/588815582.db2.gz UPCBFFCQBAPRET-UHFFFAOYSA-N 1 2 242.269 2.360 20 0 BEADLO CCC[C@@H](NC(=O)Cc1[nH]cc[nH+]1)C1CCC1 ZINC000854917555 588816922 /nfs/dbraw/zinc/81/69/22/588816922.db2.gz FVPDBEVAKFXGCV-LLVKDONJSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)[C@H]2CCC2(C)C)S1 ZINC000854989186 588819687 /nfs/dbraw/zinc/81/96/87/588819687.db2.gz ABEQTQMWRGVRFV-HTQZYQBOSA-N 1 2 226.345 2.030 20 0 BEADLO CC[C@@H](C)C(=O)NCc1c(C)[nH+]c2ccccn21 ZINC000890853761 582580845 /nfs/dbraw/zinc/58/08/45/582580845.db2.gz QIUCMPKGVGRPGG-SNVBAGLBSA-N 1 2 245.326 2.305 20 0 BEADLO Cc1[nH+]c2ccccn2c1CNC(=O)C(C)(C)F ZINC000890852613 582580986 /nfs/dbraw/zinc/58/09/86/582580986.db2.gz AMLFADWIMFKUAD-UHFFFAOYSA-N 1 2 249.289 2.007 20 0 BEADLO CCCCCC[C@H](C)[NH2+]CC(=O)NOCC ZINC000846091931 582644486 /nfs/dbraw/zinc/64/44/86/582644486.db2.gz RAOCRFVUUSFMLX-NSHDSACASA-N 1 2 230.352 2.003 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H](C)OC[C@@H]2C)cnc1F ZINC000891669886 582708303 /nfs/dbraw/zinc/70/83/03/582708303.db2.gz FYPHHZLHEWOOJW-WDEREUQCSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)cnc1F ZINC000891669886 582708304 /nfs/dbraw/zinc/70/83/04/582708304.db2.gz FYPHHZLHEWOOJW-WDEREUQCSA-N 1 2 238.306 2.138 20 0 BEADLO COc1ccc2ccc(N[C@H](C)CO)[nH+]c2c1 ZINC000891684349 582709923 /nfs/dbraw/zinc/70/99/23/582709923.db2.gz KKBXFKXODYXCAH-SECBINFHSA-N 1 2 232.283 2.036 20 0 BEADLO CCc1cc(N2C[C@H](C)OC[C@H]2C)nc(CC)[nH+]1 ZINC000891734856 582715625 /nfs/dbraw/zinc/71/56/25/582715625.db2.gz YLVJOUPBQMQVTH-MNOVXSKESA-N 1 2 249.358 2.215 20 0 BEADLO Cc1cc(CN(C)c2cccc([C@H](C)O)[nH+]2)no1 ZINC000891755745 582717486 /nfs/dbraw/zinc/71/74/86/582717486.db2.gz ZGOJTPCJWNCZAP-JTQLQIEISA-N 1 2 247.298 2.068 20 0 BEADLO CC[C@@H]1CCCN(c2cc(N(C)C)[nH+]cn2)C1 ZINC000891784222 582721376 /nfs/dbraw/zinc/72/13/76/582721376.db2.gz VFWPTPAVCGZJEY-LLVKDONJSA-N 1 2 234.347 2.169 20 0 BEADLO CC[C@@H]1CCCN(c2cc(N(C)C)nc[nH+]2)C1 ZINC000891784222 582721377 /nfs/dbraw/zinc/72/13/77/582721377.db2.gz VFWPTPAVCGZJEY-LLVKDONJSA-N 1 2 234.347 2.169 20 0 BEADLO C[C@@H]1CN(Cc2[nH+]ccn2C2CC2)CC(C)(C)O1 ZINC000891796017 582723305 /nfs/dbraw/zinc/72/33/05/582723305.db2.gz AANSVDATLUQLSG-LLVKDONJSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nccn2C2CC2)CC(C)(C)O1 ZINC000891796017 582723307 /nfs/dbraw/zinc/72/33/07/582723307.db2.gz AANSVDATLUQLSG-LLVKDONJSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nccn2C2CC2)CC(C)(C)O1 ZINC000891796017 582723309 /nfs/dbraw/zinc/72/33/09/582723309.db2.gz AANSVDATLUQLSG-LLVKDONJSA-N 1 2 249.358 2.217 20 0 BEADLO CC[C@@H]1CN(Cc2[nH+]ccn2C2CC2)C[C@H](C)O1 ZINC000891805453 582724448 /nfs/dbraw/zinc/72/44/48/582724448.db2.gz JGLURSIBERDGOX-WCQYABFASA-N 1 2 249.358 2.217 20 0 BEADLO CCc1cc(NCC2(O)CCCC2)nc(CC)[nH+]1 ZINC000891959351 582747824 /nfs/dbraw/zinc/74/78/24/582747824.db2.gz JDKDQFOHYLUDOF-UHFFFAOYSA-N 1 2 249.358 2.318 20 0 BEADLO C[C@H](O)c1cccc(NC[C@H]2CCCCO2)[nH+]1 ZINC000892003049 582758862 /nfs/dbraw/zinc/75/88/62/582758862.db2.gz YCPLBXQMHYRCRP-WDEREUQCSA-N 1 2 236.315 2.116 20 0 BEADLO C[C@@H]1CSCC[N@@H+]1Cc1nccn1C1CC1 ZINC000892045158 582772073 /nfs/dbraw/zinc/77/20/73/582772073.db2.gz CFPJLKIMNJKPGX-SNVBAGLBSA-N 1 2 237.372 2.155 20 0 BEADLO C[C@@H]1CSCC[N@H+]1Cc1nccn1C1CC1 ZINC000892045158 582772075 /nfs/dbraw/zinc/77/20/75/582772075.db2.gz CFPJLKIMNJKPGX-SNVBAGLBSA-N 1 2 237.372 2.155 20 0 BEADLO C[C@H]1N(Cc2[nH+]ccn2C2CC2)CCOC1(C)C ZINC000892068062 582784469 /nfs/dbraw/zinc/78/44/69/582784469.db2.gz DFSWHPPSLYTPPI-LLVKDONJSA-N 1 2 249.358 2.217 20 0 BEADLO CCc1cc(N[C@@H](C)CCOC)nc(CC)[nH+]1 ZINC000892250581 582813579 /nfs/dbraw/zinc/81/35/79/582813579.db2.gz AUJUQQYHOBOLTA-JTQLQIEISA-N 1 2 237.347 2.438 20 0 BEADLO COc1cccc2c[nH+]c(NCC(C)(C)O)cc21 ZINC000892307994 582834918 /nfs/dbraw/zinc/83/49/18/582834918.db2.gz ABRHATUONXLDHJ-UHFFFAOYSA-N 1 2 246.310 2.426 20 0 BEADLO Cc1cccnc1CNc1cccc([C@H](C)O)[nH+]1 ZINC000892340362 582860713 /nfs/dbraw/zinc/86/07/13/582860713.db2.gz SCBBHVGXMGYQAN-NSHDSACASA-N 1 2 243.310 2.450 20 0 BEADLO c1coc(C[NH2+]Cc2nnc(C3CC3)s2)c1 ZINC000892430041 582885200 /nfs/dbraw/zinc/88/52/00/582885200.db2.gz YYOMORFUSSRERH-UHFFFAOYSA-N 1 2 235.312 2.298 20 0 BEADLO CC[C@@H](C)CN(C)c1cc(N(C)C)[nH+]cn1 ZINC000892454310 582890264 /nfs/dbraw/zinc/89/02/64/582890264.db2.gz MZYWZOCOEKJJCO-SNVBAGLBSA-N 1 2 222.336 2.025 20 0 BEADLO CC[C@@H](C)CN(C)c1cc(N(C)C)nc[nH+]1 ZINC000892454310 582890265 /nfs/dbraw/zinc/89/02/65/582890265.db2.gz MZYWZOCOEKJJCO-SNVBAGLBSA-N 1 2 222.336 2.025 20 0 BEADLO Cc1ccc(CCNc2nccnc2Cl)c[nH+]1 ZINC000892462954 582892850 /nfs/dbraw/zinc/89/28/50/582892850.db2.gz XTMBJJWNDGKPFG-UHFFFAOYSA-N 1 2 248.717 2.488 20 0 BEADLO CCC[C@@H](O)CNc1cc(CC)[nH+]c(CC)n1 ZINC000892503205 582899814 /nfs/dbraw/zinc/89/98/14/582899814.db2.gz ZLFSEHMPRTYXNZ-LLVKDONJSA-N 1 2 237.347 2.174 20 0 BEADLO CCc1nc(CNc2ccc(OC)c[nH+]2)cs1 ZINC000393244397 582912584 /nfs/dbraw/zinc/91/25/84/582912584.db2.gz RMSFGVXFIAKOCW-UHFFFAOYSA-N 1 2 249.339 2.143 20 0 BEADLO CSC[C@H](C)Nc1cccc([C@@H](C)O)[nH+]1 ZINC000892604072 582926496 /nfs/dbraw/zinc/92/64/96/582926496.db2.gz XPYNAQRGBPPVCG-DTWKUNHWSA-N 1 2 226.345 2.298 20 0 BEADLO COc1cccc2c[nH+]c(N[C@H](C)CCO)cc21 ZINC000892615424 582930415 /nfs/dbraw/zinc/93/04/15/582930415.db2.gz CYAJWVRPXIMQLS-SNVBAGLBSA-N 1 2 246.310 2.426 20 0 BEADLO CN(C)c1cc(N2CCC3(CCCC3)C2)nc[nH+]1 ZINC000892720721 582966886 /nfs/dbraw/zinc/96/68/86/582966886.db2.gz FHCFKURKAWGHPN-UHFFFAOYSA-N 1 2 246.358 2.313 20 0 BEADLO CN(C)c1cc(N2CCC3(CCCC3)C2)[nH+]cn1 ZINC000892720721 582966889 /nfs/dbraw/zinc/96/68/89/582966889.db2.gz FHCFKURKAWGHPN-UHFFFAOYSA-N 1 2 246.358 2.313 20 0 BEADLO C[C@@H](NC(=O)C=C1CCCC1)c1[nH+]ccn1C ZINC000856277455 588866570 /nfs/dbraw/zinc/86/65/70/588866570.db2.gz JTKKJXNKDCSKGF-SNVBAGLBSA-N 1 2 233.315 2.098 20 0 BEADLO CC(C(=O)N[C@H](C)c1[nH+]ccn1C)=C1CCC1 ZINC000856279248 588866800 /nfs/dbraw/zinc/86/68/00/588866800.db2.gz DLJSMGJZXDAIDT-SNVBAGLBSA-N 1 2 233.315 2.098 20 0 BEADLO CC[C@H]([NH2+]Cc1cnccn1)c1nc(C)cs1 ZINC000856769132 588876747 /nfs/dbraw/zinc/87/67/47/588876747.db2.gz HSMDGDGYKIYKLG-NSHDSACASA-N 1 2 248.355 2.482 20 0 BEADLO CCc1cc(N[C@H](CO)CC2CC2)nc(CC)[nH+]1 ZINC000892976211 583023986 /nfs/dbraw/zinc/02/39/86/583023986.db2.gz BPJFABJBDRADOO-LBPRGKRZSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@H]1CC[C@H](C)N1c1cc(N(C)C)[nH+]cn1 ZINC000893092812 583048534 /nfs/dbraw/zinc/04/85/34/583048534.db2.gz RWZZLNSTPQNULS-QWRGUYRKSA-N 1 2 234.347 2.310 20 0 BEADLO CC[C@H]1CC[C@H](C)N1c1cc(N(C)C)nc[nH+]1 ZINC000893092812 583048535 /nfs/dbraw/zinc/04/85/35/583048535.db2.gz RWZZLNSTPQNULS-QWRGUYRKSA-N 1 2 234.347 2.310 20 0 BEADLO CCn1cc(C[NH2+]Cc2ncccc2F)c(C)n1 ZINC000893181086 583065121 /nfs/dbraw/zinc/06/51/21/583065121.db2.gz BSNODJJCQQGDLE-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO CCc1cc(NCc2[nH+]ccn2C2CC2)n(C)n1 ZINC000893364125 583126257 /nfs/dbraw/zinc/12/62/57/583126257.db2.gz TYGBPEGCUFLVPH-UHFFFAOYSA-N 1 2 245.330 2.126 20 0 BEADLO CCc1cc(NC[C@H]2CC[C@@H](O)C2)nc(CC)[nH+]1 ZINC000893435049 583142495 /nfs/dbraw/zinc/14/24/95/583142495.db2.gz NWHGNCXBNYEKCJ-CMPLNLGQSA-N 1 2 249.358 2.174 20 0 BEADLO CCc1cc(NC[C@@H]2CC[C@H](O)C2)nc(CC)[nH+]1 ZINC000893435051 583142949 /nfs/dbraw/zinc/14/29/49/583142949.db2.gz NWHGNCXBNYEKCJ-PWSUYJOCSA-N 1 2 249.358 2.174 20 0 BEADLO Cc1c[nH+]c2n1CC[C@@H]2OC(=O)c1ccoc1C ZINC000893517092 583155617 /nfs/dbraw/zinc/15/56/17/583155617.db2.gz CSPRBRYPVGWQAM-NSHDSACASA-N 1 2 246.266 2.395 20 0 BEADLO CN(Cc1[nH+]ccn1C1CC1)Cc1ccncc1 ZINC000893541848 583158852 /nfs/dbraw/zinc/15/88/52/583158852.db2.gz ZFYOMRSLEWMMRZ-UHFFFAOYSA-N 1 2 242.326 2.245 20 0 BEADLO C[C@@H]1CSCC[N@@H+]1Cc1cn(C)nc1Cl ZINC000857020451 588882392 /nfs/dbraw/zinc/88/23/92/588882392.db2.gz DGNXFKLGAAFRTK-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO C[C@@H]1CSCC[N@H+]1Cc1cn(C)nc1Cl ZINC000857020451 588882393 /nfs/dbraw/zinc/88/23/93/588882393.db2.gz DGNXFKLGAAFRTK-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO CC[C@@]1(C)COCCN1Cc1[nH+]ccn1C1CC1 ZINC000893664393 583191493 /nfs/dbraw/zinc/19/14/93/583191493.db2.gz ACZHZWUZFNCUIB-AWEZNQCLSA-N 1 2 249.358 2.219 20 0 BEADLO Cn1cc(C[NH+]2CC3(CC(F)C3)C2)c(Cl)n1 ZINC000857046644 588883894 /nfs/dbraw/zinc/88/38/94/588883894.db2.gz GUZGKTRSVBRMPW-UHFFFAOYSA-N 1 2 243.713 2.007 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)C1(C2CC2)CC1 ZINC000888939201 583204591 /nfs/dbraw/zinc/20/45/91/583204591.db2.gz GBLVUBADYJHGNS-UHFFFAOYSA-N 1 2 241.294 2.463 20 0 BEADLO C[C@@H](CO)N(C)c1cc(C2CC2)[nH+]c(C2CC2)n1 ZINC000893727944 583215707 /nfs/dbraw/zinc/21/57/07/583215707.db2.gz XGYRYEYDOMSGKH-VIFPVBQESA-N 1 2 247.342 2.048 20 0 BEADLO Cn1c(Cl)cnc1C[NH+]1CC(CC2CC2)C1 ZINC000857066062 588885266 /nfs/dbraw/zinc/88/52/66/588885266.db2.gz DQWKCMWGHZSJLX-UHFFFAOYSA-N 1 2 239.750 2.305 20 0 BEADLO Cc1ncoc1C[N@@H+]1CCn2cccc2[C@@H]1C ZINC000893879032 583239689 /nfs/dbraw/zinc/23/96/89/583239689.db2.gz CAUVKMYGYCYTSQ-NSHDSACASA-N 1 2 231.299 2.361 20 0 BEADLO Cc1ncoc1C[N@H+]1CCn2cccc2[C@@H]1C ZINC000893879032 583239692 /nfs/dbraw/zinc/23/96/92/583239692.db2.gz CAUVKMYGYCYTSQ-NSHDSACASA-N 1 2 231.299 2.361 20 0 BEADLO C[C@@H]1CN(Cc2[nH+]ccn2C2CC2)[C@H](C)[C@@H](C)O1 ZINC000893888422 583243588 /nfs/dbraw/zinc/24/35/88/583243588.db2.gz IYDOIQJTMXRXML-IJLUTSLNSA-N 1 2 249.358 2.216 20 0 BEADLO COc1ccc(C[N@@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)o1 ZINC000893889052 583243920 /nfs/dbraw/zinc/24/39/20/583243920.db2.gz SRAFCRDXJCPWIV-GARJFASQSA-N 1 2 239.315 2.286 20 0 BEADLO COc1ccc(C[N@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)o1 ZINC000893889052 583243923 /nfs/dbraw/zinc/24/39/23/583243923.db2.gz SRAFCRDXJCPWIV-GARJFASQSA-N 1 2 239.315 2.286 20 0 BEADLO COC(=O)[C@H]1CCCC[N@@H+]1Cc1cc(C)co1 ZINC000893914298 583245903 /nfs/dbraw/zinc/24/59/03/583245903.db2.gz DRPGSVVMKUBABP-GFCCVEGCSA-N 1 2 237.299 2.116 20 0 BEADLO COC(=O)[C@H]1CCCC[N@H+]1Cc1cc(C)co1 ZINC000893914298 583245905 /nfs/dbraw/zinc/24/59/05/583245905.db2.gz DRPGSVVMKUBABP-GFCCVEGCSA-N 1 2 237.299 2.116 20 0 BEADLO C[C@@H](O)c1cccc(NCCCCF)[nH+]1 ZINC000893926754 583249351 /nfs/dbraw/zinc/24/93/51/583249351.db2.gz VTPZTMYSTZPRBM-SECBINFHSA-N 1 2 212.268 2.297 20 0 BEADLO Cc1ncoc1C[N@@H+]1CCc2ccc(O)cc2C1 ZINC000893963090 583257091 /nfs/dbraw/zinc/25/70/91/583257091.db2.gz ZGGPDUVBPFLLAK-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO Cc1ncoc1C[N@H+]1CCc2ccc(O)cc2C1 ZINC000893963090 583257095 /nfs/dbraw/zinc/25/70/95/583257095.db2.gz ZGGPDUVBPFLLAK-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO CC(C)c1c[nH]c(CN2C[C@H](C)OC[C@@H]2C)[nH+]1 ZINC000893952811 583261967 /nfs/dbraw/zinc/26/19/67/583261967.db2.gz MAPCGOWJUHAIIG-QWRGUYRKSA-N 1 2 237.347 2.142 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+]2CCCO[C@@H](C)C2)n1 ZINC000893994692 583267423 /nfs/dbraw/zinc/26/74/23/583267423.db2.gz DBAMJVRHQJNZLX-NSHDSACASA-N 1 2 237.347 2.144 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+]2CCCO[C@@H](C)C2)n1 ZINC000893994692 583267424 /nfs/dbraw/zinc/26/74/24/583267424.db2.gz DBAMJVRHQJNZLX-NSHDSACASA-N 1 2 237.347 2.144 20 0 BEADLO Cc1ccnc(CNc2cccc([C@@H](C)O)[nH+]2)c1 ZINC000893985765 583268826 /nfs/dbraw/zinc/26/88/26/583268826.db2.gz NFNJCDXAPCUECA-LLVKDONJSA-N 1 2 243.310 2.450 20 0 BEADLO CCc1cc(N2C[C@H](C)[C@@H]2C)nc(CC)[nH+]1 ZINC000894001416 583271501 /nfs/dbraw/zinc/27/15/01/583271501.db2.gz WLEMAYSHPUGCKS-UWVGGRQHSA-N 1 2 219.332 2.446 20 0 BEADLO C[C@]1(F)CCCN(c2nccn3c[nH+]cc23)C1 ZINC000894006257 583273967 /nfs/dbraw/zinc/27/39/67/583273967.db2.gz RTUUKIVROFSGGP-LBPRGKRZSA-N 1 2 234.278 2.058 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+]2CCSC[C@H]2C)n1 ZINC000894025872 583280552 /nfs/dbraw/zinc/28/05/52/583280552.db2.gz JBULUPCPOKWODV-SNVBAGLBSA-N 1 2 239.388 2.470 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+]2CCSC[C@H]2C)n1 ZINC000894025872 583280553 /nfs/dbraw/zinc/28/05/53/583280553.db2.gz JBULUPCPOKWODV-SNVBAGLBSA-N 1 2 239.388 2.470 20 0 BEADLO C[C@@H](O)c1cccc(N[C@H](C)CCCCO)[nH+]1 ZINC000894037462 583283078 /nfs/dbraw/zinc/28/30/78/583283078.db2.gz NLUFRYFZIXVQHR-GHMZBOCLSA-N 1 2 238.331 2.098 20 0 BEADLO CCc1cc(N2C[C@@H](F)[C@@H](F)C2)nc(CC)[nH+]1 ZINC000894049445 583288605 /nfs/dbraw/zinc/28/86/05/583288605.db2.gz WFGYBYIRCPNDKZ-AOOOYVTPSA-N 1 2 241.285 2.098 20 0 BEADLO CC(C)[C@@H]1C[C@H]1CNc1nc(N)[nH+]c(C2CC2)n1 ZINC000894081774 583294317 /nfs/dbraw/zinc/29/43/17/583294317.db2.gz CMNPCRVIAYNAKM-UWVGGRQHSA-N 1 2 247.346 2.035 20 0 BEADLO CC(C)[C@@H]1C[C@H]1CNc1nc(N)nc(C2CC2)[nH+]1 ZINC000894081774 583294320 /nfs/dbraw/zinc/29/43/20/583294320.db2.gz CMNPCRVIAYNAKM-UWVGGRQHSA-N 1 2 247.346 2.035 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CC[C@@H](C3CC3)C2)c1C ZINC000894071912 583296333 /nfs/dbraw/zinc/29/63/33/583296333.db2.gz LLUSXYVUXCGXAJ-GFCCVEGCSA-N 1 2 219.332 2.258 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CC[C@@H](C3CC3)C2)c1C ZINC000894071912 583296335 /nfs/dbraw/zinc/29/63/35/583296335.db2.gz LLUSXYVUXCGXAJ-GFCCVEGCSA-N 1 2 219.332 2.258 20 0 BEADLO CSC[C@H]1CCC[N@@H+]1Cc1n[nH]c(C)c1C ZINC000894072136 583296384 /nfs/dbraw/zinc/29/63/84/583296384.db2.gz RDUYMCGTPGMFDA-LLVKDONJSA-N 1 2 239.388 2.354 20 0 BEADLO CSC[C@H]1CCC[N@H+]1Cc1n[nH]c(C)c1C ZINC000894072136 583296386 /nfs/dbraw/zinc/29/63/86/583296386.db2.gz RDUYMCGTPGMFDA-LLVKDONJSA-N 1 2 239.388 2.354 20 0 BEADLO Cc1ncoc1CNc1ccc(N(C)C)[nH+]c1 ZINC000894137377 583314465 /nfs/dbraw/zinc/31/44/65/583314465.db2.gz ODOWFRZSTLGDJL-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO Cc1cc(N2CC=CC2)nc(C2CCC2)[nH+]1 ZINC000894179125 583328707 /nfs/dbraw/zinc/32/87/07/583328707.db2.gz TVTYKIQTLKPQIE-UHFFFAOYSA-N 1 2 215.300 2.429 20 0 BEADLO C[C@H]1CC(C)(C)CN1c1nccn2c[nH+]cc12 ZINC000894205243 583341485 /nfs/dbraw/zinc/34/14/85/583341485.db2.gz JZOYNXCUDBPUMQ-JTQLQIEISA-N 1 2 230.315 2.354 20 0 BEADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1c[nH]cn1)CC2 ZINC000894240464 583387464 /nfs/dbraw/zinc/38/74/64/583387464.db2.gz SUJHPECIYYKIOQ-ZDUSSCGKSA-N 1 2 231.274 2.326 20 0 BEADLO CC(C)n1c[nH+]cc1CNc1ccc(F)nn1 ZINC000857225120 588896078 /nfs/dbraw/zinc/89/60/78/588896078.db2.gz LFVLYJOBNCDWMU-UHFFFAOYSA-N 1 2 235.266 2.005 20 0 BEADLO Cc1ncoc1C[NH2+][C@@H](C)c1c(C)noc1C ZINC000894277172 583406320 /nfs/dbraw/zinc/40/63/20/583406320.db2.gz RCJQUZLVSSGZBL-QMMMGPOBSA-N 1 2 235.287 2.439 20 0 BEADLO COC[C@@H]([NH2+]Cc1ocnc1C)c1ccco1 ZINC000894328871 583424354 /nfs/dbraw/zinc/42/43/54/583424354.db2.gz NUGZBXXIQGJRLJ-SNVBAGLBSA-N 1 2 236.271 2.053 20 0 BEADLO C[C@@H](CNc1cc(N(C)C)nc[nH+]1)CC(F)F ZINC000894346590 583431317 /nfs/dbraw/zinc/43/13/17/583431317.db2.gz LYPIZVGFBULACP-MRVPVSSYSA-N 1 2 244.289 2.246 20 0 BEADLO C[C@@H](CNc1cc(N(C)C)[nH+]cn1)CC(F)F ZINC000894346590 583431318 /nfs/dbraw/zinc/43/13/18/583431318.db2.gz LYPIZVGFBULACP-MRVPVSSYSA-N 1 2 244.289 2.246 20 0 BEADLO CCc1cc(N[C@H]2CO[C@H](C)C2)nc(CC)[nH+]1 ZINC000894362557 583437648 /nfs/dbraw/zinc/43/76/48/583437648.db2.gz WXEGFWBRKYXQDZ-MWLCHTKSSA-N 1 2 235.331 2.191 20 0 BEADLO CCc1cc(N[C@H]2CO[C@@H](C)C2)nc(CC)[nH+]1 ZINC000894362552 583437796 /nfs/dbraw/zinc/43/77/96/583437796.db2.gz WXEGFWBRKYXQDZ-GXSJLCMTSA-N 1 2 235.331 2.191 20 0 BEADLO CCN(CCSC)c1cccc([C@H](C)O)[nH+]1 ZINC000894365353 583439080 /nfs/dbraw/zinc/43/90/80/583439080.db2.gz AXNLCUQCPICZDE-JTQLQIEISA-N 1 2 240.372 2.324 20 0 BEADLO Cc1n[nH]c(C[N@@H+](C)Cc2cccnc2)c1C ZINC000894423721 583455420 /nfs/dbraw/zinc/45/54/20/583455420.db2.gz YUXWGKGOZVJAAT-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1n[nH]c(C[N@H+](C)Cc2cccnc2)c1C ZINC000894423721 583455421 /nfs/dbraw/zinc/45/54/21/583455421.db2.gz YUXWGKGOZVJAAT-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1n[nH]c(C[N@@H+](C)Cc2ccccn2)c1C ZINC000894450979 583463112 /nfs/dbraw/zinc/46/31/12/583463112.db2.gz WVUVLDYAQKQCCN-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1n[nH]c(C[N@H+](C)Cc2ccccn2)c1C ZINC000894450979 583463115 /nfs/dbraw/zinc/46/31/15/583463115.db2.gz WVUVLDYAQKQCCN-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1ncoc1CN1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000894462550 583467241 /nfs/dbraw/zinc/46/72/41/583467241.db2.gz XNYXIVLBGYUCQM-JTQLQIEISA-N 1 2 232.287 2.043 20 0 BEADLO Cc1ncoc1C[N@@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000894462550 583467243 /nfs/dbraw/zinc/46/72/43/583467243.db2.gz XNYXIVLBGYUCQM-JTQLQIEISA-N 1 2 232.287 2.043 20 0 BEADLO Cc1ncoc1C[N@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000894462550 583467244 /nfs/dbraw/zinc/46/72/44/583467244.db2.gz XNYXIVLBGYUCQM-JTQLQIEISA-N 1 2 232.287 2.043 20 0 BEADLO CCc1cc(N[C@H](CO)C2CCC2)nc(CC)[nH+]1 ZINC000894487346 583472059 /nfs/dbraw/zinc/47/20/59/583472059.db2.gz RIQJHLOOKRJCSO-GFCCVEGCSA-N 1 2 249.358 2.174 20 0 BEADLO Cc1n[nH]c(C[N@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)c1C ZINC000894532706 583478844 /nfs/dbraw/zinc/47/88/44/583478844.db2.gz DVQZDDLCJOAQBG-AXTRIDKLSA-N 1 2 237.347 2.024 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)c1C ZINC000894532706 583478846 /nfs/dbraw/zinc/47/88/46/583478846.db2.gz DVQZDDLCJOAQBG-AXTRIDKLSA-N 1 2 237.347 2.024 20 0 BEADLO FCC[C@@H]1CCCN(c2nccn3c[nH+]cc23)C1 ZINC000894567455 583485279 /nfs/dbraw/zinc/48/52/79/583485279.db2.gz UOGOPWBILDOPAS-NSHDSACASA-N 1 2 248.305 2.305 20 0 BEADLO CC(C)c1c[nH]c(C[NH+]2CC([C@H]3CCOC3)C2)n1 ZINC000894604118 583491436 /nfs/dbraw/zinc/49/14/36/583491436.db2.gz JYXLLFDYNHMCPX-NSHDSACASA-N 1 2 249.358 2.001 20 0 BEADLO Cc1[nH]nc(C[NH+]2CC(C(C)C)C2)c1C ZINC000894597028 583492761 /nfs/dbraw/zinc/49/27/61/583492761.db2.gz HZVBHIFIPGMLDR-UHFFFAOYSA-N 1 2 207.321 2.114 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2ccnn2C2CCC2)C1 ZINC000894671257 583503419 /nfs/dbraw/zinc/50/34/19/583503419.db2.gz NWJLUZPPBLZGLK-SNVBAGLBSA-N 1 2 223.295 2.152 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2ccnn2C2CCC2)C1 ZINC000894671257 583503420 /nfs/dbraw/zinc/50/34/20/583503420.db2.gz NWJLUZPPBLZGLK-SNVBAGLBSA-N 1 2 223.295 2.152 20 0 BEADLO Cc1cc(F)ncc1C[N@@H+](C(C)C)C1COC1 ZINC000894659132 583504662 /nfs/dbraw/zinc/50/46/62/583504662.db2.gz OMZVKVXTLWSWGO-UHFFFAOYSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1cc(F)ncc1C[N@H+](C(C)C)C1COC1 ZINC000894659132 583504664 /nfs/dbraw/zinc/50/46/64/583504664.db2.gz OMZVKVXTLWSWGO-UHFFFAOYSA-N 1 2 238.306 2.138 20 0 BEADLO C(c1nnc(C2CC2)s1)[N@@H+]1CC[C@@H]1C1CC1 ZINC000894691408 583507929 /nfs/dbraw/zinc/50/79/29/583507929.db2.gz YSZSBVBGDXCIOQ-SNVBAGLBSA-N 1 2 235.356 2.400 20 0 BEADLO C(c1nnc(C2CC2)s1)[N@H+]1CC[C@@H]1C1CC1 ZINC000894691408 583507930 /nfs/dbraw/zinc/50/79/30/583507930.db2.gz YSZSBVBGDXCIOQ-SNVBAGLBSA-N 1 2 235.356 2.400 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CCC[C@@H]2[C@H]2CCCO2)c1C ZINC000894691027 583508803 /nfs/dbraw/zinc/50/88/03/583508803.db2.gz UPRCWIOPDFLXSD-ZIAGYGMSSA-N 1 2 249.358 2.170 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CCC[C@@H]2[C@H]2CCCO2)c1C ZINC000894691027 583508804 /nfs/dbraw/zinc/50/88/04/583508804.db2.gz UPRCWIOPDFLXSD-ZIAGYGMSSA-N 1 2 249.358 2.170 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CCC[C@H]2[C@H]2CCCO2)c1C ZINC000894691026 583509077 /nfs/dbraw/zinc/50/90/77/583509077.db2.gz UPRCWIOPDFLXSD-UONOGXRCSA-N 1 2 249.358 2.170 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CCC[C@H]2[C@H]2CCCO2)c1C ZINC000894691026 583509078 /nfs/dbraw/zinc/50/90/78/583509078.db2.gz UPRCWIOPDFLXSD-UONOGXRCSA-N 1 2 249.358 2.170 20 0 BEADLO CC(C)(C)c1nc(NCC2CC=CC2)nc(N)[nH+]1 ZINC000894715965 583511570 /nfs/dbraw/zinc/51/15/70/583511570.db2.gz QVMGOQCKXPTVGG-UHFFFAOYSA-N 1 2 247.346 2.129 20 0 BEADLO CC(C)(C)c1nc(N)nc(NCC2CC=CC2)[nH+]1 ZINC000894715965 583511572 /nfs/dbraw/zinc/51/15/72/583511572.db2.gz QVMGOQCKXPTVGG-UHFFFAOYSA-N 1 2 247.346 2.129 20 0 BEADLO CCC1C[NH+](Cc2nnc(C3CC3)s2)C1 ZINC000894814224 583524205 /nfs/dbraw/zinc/52/42/05/583524205.db2.gz ZKTSUWKMLLLQKI-UHFFFAOYSA-N 1 2 223.345 2.257 20 0 BEADLO COC1C[NH+](Cc2cc(C)nc3c2CCCC3)C1 ZINC000894819323 583525054 /nfs/dbraw/zinc/52/50/54/583525054.db2.gz LKEBPKQZMXLHQF-UHFFFAOYSA-N 1 2 246.354 2.099 20 0 BEADLO CCOc1ccc(C[NH+]2CC(C(F)F)C2)o1 ZINC000894831153 583527895 /nfs/dbraw/zinc/52/78/95/583527895.db2.gz ZZLGXQOKSBUXDU-UHFFFAOYSA-N 1 2 231.242 2.375 20 0 BEADLO CCc1nc(C)c(C[NH2+]Cc2ocnc2C)o1 ZINC000894850998 583531748 /nfs/dbraw/zinc/53/17/48/583531748.db2.gz MGPZBRNUFPPRFN-UHFFFAOYSA-N 1 2 235.287 2.132 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc(F)ncc2F)[C@H]1C ZINC000894860157 583533641 /nfs/dbraw/zinc/53/36/41/583533641.db2.gz BUIDOABYGVLAFQ-SFYZADRCSA-N 1 2 212.243 2.200 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc(F)ncc2F)[C@H]1C ZINC000894860157 583533642 /nfs/dbraw/zinc/53/36/42/583533642.db2.gz BUIDOABYGVLAFQ-SFYZADRCSA-N 1 2 212.243 2.200 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+]2C[C@H](C)[C@@H]2C)n1 ZINC000894862225 583535670 /nfs/dbraw/zinc/53/56/70/583535670.db2.gz UXLSHZLISMRKBK-UWVGGRQHSA-N 1 2 207.321 2.373 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+]2C[C@H](C)[C@@H]2C)n1 ZINC000894862225 583535671 /nfs/dbraw/zinc/53/56/71/583535671.db2.gz UXLSHZLISMRKBK-UWVGGRQHSA-N 1 2 207.321 2.373 20 0 BEADLO COc1cnc(F)c(C[N@@H+]2C[C@@H](C)[C@@H]2C)c1 ZINC000894862601 583537028 /nfs/dbraw/zinc/53/70/28/583537028.db2.gz ZVISETQRJAJAEJ-BDAKNGLRSA-N 1 2 224.279 2.070 20 0 BEADLO COc1cnc(F)c(C[N@H+]2C[C@@H](C)[C@@H]2C)c1 ZINC000894862601 583537029 /nfs/dbraw/zinc/53/70/29/583537029.db2.gz ZVISETQRJAJAEJ-BDAKNGLRSA-N 1 2 224.279 2.070 20 0 BEADLO COc1cnc(F)c(C[N@@H+]2C[C@H](C)[C@@H]2C)c1 ZINC000894862603 583537384 /nfs/dbraw/zinc/53/73/84/583537384.db2.gz ZVISETQRJAJAEJ-IUCAKERBSA-N 1 2 224.279 2.070 20 0 BEADLO COc1cnc(F)c(C[N@H+]2C[C@H](C)[C@@H]2C)c1 ZINC000894862603 583537385 /nfs/dbraw/zinc/53/73/85/583537385.db2.gz ZVISETQRJAJAEJ-IUCAKERBSA-N 1 2 224.279 2.070 20 0 BEADLO Cc1ncoc1C[N@@H+]1C[C@]2(CCCO2)[C@H]1C1CC1 ZINC000894866681 583537897 /nfs/dbraw/zinc/53/78/97/583537897.db2.gz XGOINPGDOLGUHE-ZIAGYGMSSA-N 1 2 248.326 2.126 20 0 BEADLO Cc1ncoc1C[N@H+]1C[C@]2(CCCO2)[C@H]1C1CC1 ZINC000894866681 583537900 /nfs/dbraw/zinc/53/79/00/583537900.db2.gz XGOINPGDOLGUHE-ZIAGYGMSSA-N 1 2 248.326 2.126 20 0 BEADLO CCC[C@H](CCO)Nc1cccc([C@H](C)O)[nH+]1 ZINC000894867832 583538238 /nfs/dbraw/zinc/53/82/38/583538238.db2.gz SHVUBDJYVOETKG-WDEREUQCSA-N 1 2 238.331 2.098 20 0 BEADLO CCOc1ncc(C)cc1NCc1c[nH+]c[nH]1 ZINC000894870220 583539785 /nfs/dbraw/zinc/53/97/85/583539785.db2.gz JKIBUVWYZBBRPL-UHFFFAOYSA-N 1 2 232.287 2.124 20 0 BEADLO CCOc1ncc(C)cc1NCc1c[nH]c[nH+]1 ZINC000894870220 583539786 /nfs/dbraw/zinc/53/97/86/583539786.db2.gz JKIBUVWYZBBRPL-UHFFFAOYSA-N 1 2 232.287 2.124 20 0 BEADLO CC(C)c1c[nH]c(CN2CC[C@@H](F)C2)[nH+]1 ZINC000894874463 583541193 /nfs/dbraw/zinc/54/11/93/583541193.db2.gz NVOGNRJWMDHMBQ-SECBINFHSA-N 1 2 211.284 2.077 20 0 BEADLO CCCc1ncc(C[NH2+][C@@H](C)c2cnccn2)o1 ZINC000894917990 583555252 /nfs/dbraw/zinc/55/52/52/583555252.db2.gz RBABMQAYHKPDNG-JTQLQIEISA-N 1 2 246.314 2.268 20 0 BEADLO CCOC1C[NH+](Cc2cccc3c2NCCC3)C1 ZINC000894968909 583560375 /nfs/dbraw/zinc/56/03/75/583560375.db2.gz AGBVVOARWWUZHT-UHFFFAOYSA-N 1 2 246.354 2.265 20 0 BEADLO CSc1ccc(C[NH+]2CC(O)(C(C)C)C2)o1 ZINC000894971383 583561323 /nfs/dbraw/zinc/56/13/23/583561323.db2.gz VTFBTHFTRQAJQP-UHFFFAOYSA-N 1 2 241.356 2.204 20 0 BEADLO Cc1ncoc1C[NH+]1CC(CC(F)(F)F)C1 ZINC000894976480 583562227 /nfs/dbraw/zinc/56/22/27/583562227.db2.gz KAQHBPNYBONHEU-UHFFFAOYSA-N 1 2 234.221 2.367 20 0 BEADLO C[C@H](O)c1cccc(N[C@H]2CC23CCC3)[nH+]1 ZINC000895090460 583586460 /nfs/dbraw/zinc/58/64/60/583586460.db2.gz MLSDJAQRRDCMFU-ONGXEEELSA-N 1 2 218.300 2.489 20 0 BEADLO COCc1cc[nH+]c(NCc2[nH]nc(C)c2C)c1 ZINC000895149803 583606080 /nfs/dbraw/zinc/60/60/80/583606080.db2.gz BSXXXFIQPNVKTQ-UHFFFAOYSA-N 1 2 246.314 2.180 20 0 BEADLO COCc1cc[nH+]c(NCc2n[nH]c(C)c2C)c1 ZINC000895149803 583606082 /nfs/dbraw/zinc/60/60/82/583606082.db2.gz BSXXXFIQPNVKTQ-UHFFFAOYSA-N 1 2 246.314 2.180 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2COCC2(C)C)c1 ZINC000895150251 583606420 /nfs/dbraw/zinc/60/64/20/583606420.db2.gz IYINUVRJGPVSGG-LLVKDONJSA-N 1 2 236.315 2.065 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2C[C@@H](C)O[C@H]2C)c1C ZINC000882459685 583616996 /nfs/dbraw/zinc/61/69/96/583616996.db2.gz MEVHJDNJICVPOP-ZHAHWJHGSA-N 1 2 235.331 2.319 20 0 BEADLO CCc1ncc(C[NH2+][C@@H]2CCCc3cn[nH]c32)o1 ZINC000857869340 588916880 /nfs/dbraw/zinc/91/68/80/588916880.db2.gz NATFTJFQPKFZBM-LLVKDONJSA-N 1 2 246.314 2.127 20 0 BEADLO CCc1ncc(C[NH2+][C@@H]2CCCc3c[nH]nc32)o1 ZINC000857869340 588916882 /nfs/dbraw/zinc/91/68/82/588916882.db2.gz NATFTJFQPKFZBM-LLVKDONJSA-N 1 2 246.314 2.127 20 0 BEADLO CCc1cc(N(C)CCCF)nc(CC)[nH+]1 ZINC000895246081 583632618 /nfs/dbraw/zinc/63/26/18/583632618.db2.gz WHMLNUZAUARABP-UHFFFAOYSA-N 1 2 225.311 2.397 20 0 BEADLO COCC[N@H+](CCF)Cc1cc(C)co1 ZINC000895251974 583633124 /nfs/dbraw/zinc/63/31/24/583633124.db2.gz ZSOLZPGRNSUJGC-UHFFFAOYSA-N 1 2 215.268 2.006 20 0 BEADLO COCC[N@@H+](CCF)Cc1cc(C)co1 ZINC000895251974 583633126 /nfs/dbraw/zinc/63/31/26/583633126.db2.gz ZSOLZPGRNSUJGC-UHFFFAOYSA-N 1 2 215.268 2.006 20 0 BEADLO Cc1ncoc1C[NH2+][C@@H](C)c1cscn1 ZINC000895254518 583633750 /nfs/dbraw/zinc/63/37/50/583633750.db2.gz UFUCVSFTANMLPY-ZETCQYMHSA-N 1 2 223.301 2.290 20 0 BEADLO Cc1cc(CO[NH+]=C(N)c2ccccc2C)no1 ZINC000727400435 583640339 /nfs/dbraw/zinc/64/03/39/583640339.db2.gz YFLNPYSNVOROEX-UHFFFAOYSA-N 1 2 245.282 2.338 20 0 BEADLO CC1(C)CC[C@H](C[N@@H+]2Cc3ccncc3C2)O1 ZINC000857879798 588919400 /nfs/dbraw/zinc/91/94/00/588919400.db2.gz RBPPUSKVKNDRCC-CYBMUJFWSA-N 1 2 232.327 2.355 20 0 BEADLO CC1(C)CC[C@H](C[N@H+]2Cc3ccncc3C2)O1 ZINC000857879798 588919402 /nfs/dbraw/zinc/91/94/02/588919402.db2.gz RBPPUSKVKNDRCC-CYBMUJFWSA-N 1 2 232.327 2.355 20 0 BEADLO CC1(c2ccccc2)C[NH+](Cc2c[nH]cn2)C1 ZINC000895378129 583662124 /nfs/dbraw/zinc/66/21/24/583662124.db2.gz QABYYCVDHJDYFU-UHFFFAOYSA-N 1 2 227.311 2.183 20 0 BEADLO CC1(c2ccccc2)C[NH+](Cc2cnc[nH]2)C1 ZINC000895378129 583662126 /nfs/dbraw/zinc/66/21/26/583662126.db2.gz QABYYCVDHJDYFU-UHFFFAOYSA-N 1 2 227.311 2.183 20 0 BEADLO c1cc(CC2C[NH+](Cc3c[nH]cn3)C2)cs1 ZINC000895379326 583662250 /nfs/dbraw/zinc/66/22/50/583662250.db2.gz UNTQQNCLXSVGBC-UHFFFAOYSA-N 1 2 233.340 2.146 20 0 BEADLO FC(F)[C@@H]1CC[N@H+]1CCC1CCOCC1 ZINC000895430098 583669807 /nfs/dbraw/zinc/66/98/07/583669807.db2.gz AXZNYAFIKFIWGJ-JTQLQIEISA-N 1 2 219.275 2.143 20 0 BEADLO CSc1ccc(C[N@@H+]2CCc3n[nH]cc3C2)o1 ZINC000895390560 583663820 /nfs/dbraw/zinc/66/38/20/583663820.db2.gz XXMDXXWPNPIUHH-UHFFFAOYSA-N 1 2 249.339 2.283 20 0 BEADLO CSc1ccc(C[N@H+]2CCc3n[nH]cc3C2)o1 ZINC000895390560 583663821 /nfs/dbraw/zinc/66/38/21/583663821.db2.gz XXMDXXWPNPIUHH-UHFFFAOYSA-N 1 2 249.339 2.283 20 0 BEADLO c1ncc(C[NH+]2CC(c3ccccc3)C2)[nH]1 ZINC000895417978 583667386 /nfs/dbraw/zinc/66/73/86/583667386.db2.gz LAMPJOPHFYHEPQ-UHFFFAOYSA-N 1 2 213.284 2.009 20 0 BEADLO OCc1cc[nH+]c(NCC[C@@H]2CC[C@H]3C[C@H]32)c1 ZINC000895424881 583667550 /nfs/dbraw/zinc/66/75/50/583667550.db2.gz BIZWCAXPDINYSV-AVGNSLFASA-N 1 2 232.327 2.422 20 0 BEADLO FC(F)[C@@H]1CC[N@@H+]1CCC1CCOCC1 ZINC000895430098 583669806 /nfs/dbraw/zinc/66/98/06/583669806.db2.gz AXZNYAFIKFIWGJ-JTQLQIEISA-N 1 2 219.275 2.143 20 0 BEADLO CCOC1CC(C[N@@H+]2CC[C@@H]2C(F)F)C1 ZINC000895430726 583670196 /nfs/dbraw/zinc/67/01/96/583670196.db2.gz HFCDNQUXZPMZLK-UDNWOFFPSA-N 1 2 219.275 2.141 20 0 BEADLO CCOC1CC(C[N@H+]2CC[C@@H]2C(F)F)C1 ZINC000895430726 583670199 /nfs/dbraw/zinc/67/01/99/583670199.db2.gz HFCDNQUXZPMZLK-UDNWOFFPSA-N 1 2 219.275 2.141 20 0 BEADLO FC(F)[C@@H]1CC[N@@H+]1C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000895432103 583670587 /nfs/dbraw/zinc/67/05/87/583670587.db2.gz USKJNMRWWDEKGR-JXUBOQSCSA-N 1 2 201.260 2.372 20 0 BEADLO FC(F)[C@@H]1CC[N@H+]1C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000895432103 583670588 /nfs/dbraw/zinc/67/05/88/583670588.db2.gz USKJNMRWWDEKGR-JXUBOQSCSA-N 1 2 201.260 2.372 20 0 BEADLO C[C@H]([NH2+][C@@H]1[C@@H]2CCC[C@@H]21)C(=O)OC(C)(C)C ZINC000895432743 583671440 /nfs/dbraw/zinc/67/14/40/583671440.db2.gz DDNMNWJAMUAYKC-MMWGEVLESA-N 1 2 225.332 2.105 20 0 BEADLO COCc1cc(NCc2c[nH+]c[nH]2)ccc1OC ZINC000895450438 583675930 /nfs/dbraw/zinc/67/59/30/583675930.db2.gz YTPYLLBSWMFXMH-UHFFFAOYSA-N 1 2 247.298 2.177 20 0 BEADLO COCc1cc(NCc2c[nH]c[nH+]2)ccc1OC ZINC000895450438 583675932 /nfs/dbraw/zinc/67/59/32/583675932.db2.gz YTPYLLBSWMFXMH-UHFFFAOYSA-N 1 2 247.298 2.177 20 0 BEADLO CCC(CC)NC(=O)C(C)(C)n1c[nH+]c(C)c1 ZINC000895479079 583680252 /nfs/dbraw/zinc/68/02/52/583680252.db2.gz HHPDSFLZDCGKBM-UHFFFAOYSA-N 1 2 237.347 2.231 20 0 BEADLO Cc1cnc(NCc2cc(N(C)C)cc[nH+]2)o1 ZINC000895471561 583680397 /nfs/dbraw/zinc/68/03/97/583680397.db2.gz SLGAEKRKBINCNT-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO Cn1c(C[NH+]2CCC(F)CC2)cnc1Cl ZINC000895545829 583689815 /nfs/dbraw/zinc/68/98/15/583689815.db2.gz HVQNVYNWRCZMAF-UHFFFAOYSA-N 1 2 231.702 2.007 20 0 BEADLO Cc1cc(NCc2csnn2)c[nH+]c1C ZINC000895645334 583700786 /nfs/dbraw/zinc/70/07/86/583700786.db2.gz PIDQOFHUBVWKLZ-UHFFFAOYSA-N 1 2 220.301 2.162 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N(C)CC(C)C)c[nH+]1 ZINC000895665922 583705914 /nfs/dbraw/zinc/70/59/14/583705914.db2.gz SJPLTVPWOGQSOK-UHFFFAOYSA-N 1 2 237.347 2.041 20 0 BEADLO Cc1nnc(C[NH+]2CC(c3ccccc3)C2)s1 ZINC000895693827 583708297 /nfs/dbraw/zinc/70/82/97/583708297.db2.gz MREZQVFBIDHSQG-UHFFFAOYSA-N 1 2 245.351 2.446 20 0 BEADLO CCc1cc(N2CCO[C@@H](C)CC2)nc(CC)[nH+]1 ZINC000895766780 583719298 /nfs/dbraw/zinc/71/92/98/583719298.db2.gz XZGFCPSMTJIKDO-NSHDSACASA-N 1 2 249.358 2.217 20 0 BEADLO CCCCCCC(=O)N[C@@H]1CCn2c[nH+]cc2C1 ZINC000857944353 588924750 /nfs/dbraw/zinc/92/47/50/588924750.db2.gz LNYXPMXNICGQTK-GFCCVEGCSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCOC1=O)[C@@H](C)c1ccccc1 ZINC000895803373 583731612 /nfs/dbraw/zinc/73/16/12/583731612.db2.gz BLBCZHDKRBIHSU-WZRBSPASSA-N 1 2 233.311 2.084 20 0 BEADLO CC1(c2ccccc2)CC([NH2+][C@H]2CCOC2=O)C1 ZINC000895807964 583732681 /nfs/dbraw/zinc/73/26/81/583732681.db2.gz XJKWIRQWTJZWDG-OWYJLGKBSA-N 1 2 245.322 2.012 20 0 BEADLO CC(C)(C)OC1CN(Cc2[nH+]ccn2C2CC2)C1 ZINC000895870808 583737517 /nfs/dbraw/zinc/73/75/17/583737517.db2.gz GYJRKVZWRIJYML-UHFFFAOYSA-N 1 2 249.358 2.217 20 0 BEADLO C[N@H+](CCCF)Cc1c(F)ccc(O)c1F ZINC000895895560 583742744 /nfs/dbraw/zinc/74/27/44/583742744.db2.gz AGKLYEGJYDLMGS-UHFFFAOYSA-N 1 2 233.233 2.462 20 0 BEADLO C[N@@H+](CCCF)Cc1c(F)ccc(O)c1F ZINC000895895560 583742746 /nfs/dbraw/zinc/74/27/46/583742746.db2.gz AGKLYEGJYDLMGS-UHFFFAOYSA-N 1 2 233.233 2.462 20 0 BEADLO Cc1cc(N[C@@H]2COC[C@@H]2C)nc(C2CCC2)[nH+]1 ZINC000895911267 583745592 /nfs/dbraw/zinc/74/55/92/583745592.db2.gz XIWRKLVCWLHUJX-JOYOIKCWSA-N 1 2 247.342 2.499 20 0 BEADLO C[C@H]1CC[C@H](C(=O)N[C@@H]2CCn3c[nH+]cc32)CC1 ZINC000857976107 588926395 /nfs/dbraw/zinc/92/63/95/588926395.db2.gz XRXWPMKPAMSESH-IJLUTSLNSA-N 1 2 247.342 2.270 20 0 BEADLO C[NH+](C)C1(c2nc(Cc3cccs3)no2)CC1 ZINC000895950089 583751599 /nfs/dbraw/zinc/75/15/99/583751599.db2.gz DEYGMYKGMCSKIN-UHFFFAOYSA-N 1 2 249.339 2.273 20 0 BEADLO CC(C)OC1C[NH+](Cc2ccc(F)cc2)C1 ZINC000895951682 583751763 /nfs/dbraw/zinc/75/17/63/583751763.db2.gz HXGFPPIAJUPSLS-UHFFFAOYSA-N 1 2 223.291 2.435 20 0 BEADLO C[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857976566 588926466 /nfs/dbraw/zinc/92/64/66/588926466.db2.gz HGCHLQMUAOCCNL-IJLUTSLNSA-N 1 2 247.342 2.270 20 0 BEADLO CCCC[C@H](C)C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857977423 588926571 /nfs/dbraw/zinc/92/65/71/588926571.db2.gz DTJWAJUCJQIGTR-WDEREUQCSA-N 1 2 235.331 2.270 20 0 BEADLO O=C(N[C@H]1CCn2c[nH+]cc21)C1=CCCCCC1 ZINC000857978120 588926600 /nfs/dbraw/zinc/92/66/00/588926600.db2.gz KIGPYVPBBQQIPV-LBPRGKRZSA-N 1 2 245.326 2.335 20 0 BEADLO Cc1cc(NC[C@H]2COC(C)(C)O2)c[nH+]c1C ZINC000896021083 583763843 /nfs/dbraw/zinc/76/38/43/583763843.db2.gz GBZZEDWYBWBKHG-LBPRGKRZSA-N 1 2 236.315 2.262 20 0 BEADLO C[C@H]([NH2+]Cc1cn2ccnc2s1)C(F)F ZINC000896038533 583766357 /nfs/dbraw/zinc/76/63/57/583766357.db2.gz QURAPEHTSROPDN-LURJTMIESA-N 1 2 231.271 2.139 20 0 BEADLO CCc1cc(NC[C@@H]2C=C[C@H]3C[C@@H]2CO3)nc[nH+]1 ZINC000896078598 583769385 /nfs/dbraw/zinc/76/93/85/583769385.db2.gz PGIFYDPPTOAKEP-LOWVWBTDSA-N 1 2 245.326 2.042 20 0 BEADLO O=C(N[C@H]1CCn2c[nH+]cc21)[C@H]1CC12CCCC2 ZINC000857982418 588928015 /nfs/dbraw/zinc/92/80/15/588928015.db2.gz INJRNABTEHGKHY-MNOVXSKESA-N 1 2 245.326 2.024 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857981824 588928119 /nfs/dbraw/zinc/92/81/19/588928119.db2.gz JNCAYWUKAKHRJF-DCAQKATOSA-N 1 2 235.331 2.126 20 0 BEADLO CCC[C@@H](O)CCNc1ccc([C@H](C)O)c[nH+]1 ZINC000896181847 583778532 /nfs/dbraw/zinc/77/85/32/583778532.db2.gz GLQXWSYCFGHGNZ-CMPLNLGQSA-N 1 2 238.331 2.098 20 0 BEADLO CCC[C@H](O)CCNc1cccc([C@H](C)O)[nH+]1 ZINC000896182331 583778842 /nfs/dbraw/zinc/77/88/42/583778842.db2.gz IQKFZGRDQAPBCR-QWRGUYRKSA-N 1 2 238.331 2.098 20 0 BEADLO CCC[C@@H](O)CCNc1cccc([C@H](C)O)[nH+]1 ZINC000896182332 583778862 /nfs/dbraw/zinc/77/88/62/583778862.db2.gz IQKFZGRDQAPBCR-WDEREUQCSA-N 1 2 238.331 2.098 20 0 BEADLO CCc1cc(NC[C@]2(C)CCCCO2)nc[nH+]1 ZINC000896183431 583778964 /nfs/dbraw/zinc/77/89/64/583778964.db2.gz XUDFZXYYYPMVAT-ZDUSSCGKSA-N 1 2 235.331 2.410 20 0 BEADLO CC[C@@H]1CCC[N@@H+]1Cn1ncn(CC)c1=S ZINC000727825366 583779645 /nfs/dbraw/zinc/77/96/45/583779645.db2.gz ZNEHITRVKYUODY-SNVBAGLBSA-N 1 2 240.376 2.266 20 0 BEADLO CC[C@@H]1CCC[N@H+]1Cn1ncn(CC)c1=S ZINC000727825366 583779646 /nfs/dbraw/zinc/77/96/46/583779646.db2.gz ZNEHITRVKYUODY-SNVBAGLBSA-N 1 2 240.376 2.266 20 0 BEADLO CCC[C@@H](C)CC(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857983546 588928744 /nfs/dbraw/zinc/92/87/44/588928744.db2.gz BMGBVXDMWGGXKF-MNOVXSKESA-N 1 2 235.331 2.270 20 0 BEADLO C[C@@H]1CC/C(=C/C(=O)N[C@H]2CCn3c[nH+]cc32)C1 ZINC000857984032 588928811 /nfs/dbraw/zinc/92/88/11/588928811.db2.gz XBYIKKBRWFPMOV-GZXATSTBSA-N 1 2 245.326 2.191 20 0 BEADLO CCC[C@H](O)CCNc1cc(CC)[nH+]cn1 ZINC000896185411 583780462 /nfs/dbraw/zinc/78/04/62/583780462.db2.gz BVMOCUZROHQPID-NSHDSACASA-N 1 2 223.320 2.002 20 0 BEADLO Cc1cc(N[C@@H]2CCS[C@@H](C)C2)nc[nH+]1 ZINC000896245261 583785134 /nfs/dbraw/zinc/78/51/34/583785134.db2.gz LHHUMARNQHLJKO-VHSXEESVSA-N 1 2 223.345 2.481 20 0 BEADLO C[C@@H]1C[C@H](Nc2cc[nH+]cc2F)CCS1 ZINC000896250591 583786735 /nfs/dbraw/zinc/78/67/35/583786735.db2.gz SLWKRCQAXNUJHK-RKDXNWHRSA-N 1 2 226.320 2.339 20 0 BEADLO C[C@@H]1C[C@@H](Nc2cc[nH+]cc2F)CCS1 ZINC000896250588 583787082 /nfs/dbraw/zinc/78/70/82/583787082.db2.gz SLWKRCQAXNUJHK-BDAKNGLRSA-N 1 2 226.320 2.339 20 0 BEADLO C[C@@H]([NH2+][C@@H]1C[C@H]1[C@@H]1C[C@H]1C)C(=O)OC(C)(C)C ZINC000896402199 583800212 /nfs/dbraw/zinc/80/02/12/583800212.db2.gz YNZPOSDXQIBURO-PZWNZHSQSA-N 1 2 239.359 2.351 20 0 BEADLO CCc1cnc(C[N@@H+]2CCO[C@@H](C)CC2)s1 ZINC000896585187 583815772 /nfs/dbraw/zinc/81/57/72/583815772.db2.gz SPZNHAXZQWWMBU-JTQLQIEISA-N 1 2 240.372 2.316 20 0 BEADLO CCc1cnc(C[N@H+]2CCO[C@@H](C)CC2)s1 ZINC000896585187 583815773 /nfs/dbraw/zinc/81/57/73/583815773.db2.gz SPZNHAXZQWWMBU-JTQLQIEISA-N 1 2 240.372 2.316 20 0 BEADLO Cc1cnc(C[NH2+]Cc2ccnc(F)c2)s1 ZINC000858146608 588935455 /nfs/dbraw/zinc/93/54/55/588935455.db2.gz IMBTZVRSDBYVDR-UHFFFAOYSA-N 1 2 237.303 2.275 20 0 BEADLO CCc1nc(NC[C@@H]2CC[C@@H](C3CC3)O2)cc[nH+]1 ZINC000896800217 583835206 /nfs/dbraw/zinc/83/52/06/583835206.db2.gz ZHIIBODALMMFKC-RYUDHWBXSA-N 1 2 247.342 2.409 20 0 BEADLO O[C@@H]1CCCC[C@@H]1CCNc1cccc[nH+]1 ZINC000896817070 583836503 /nfs/dbraw/zinc/83/65/03/583836503.db2.gz PAEWNPYIMQMCPC-VXGBXAGGSA-N 1 2 220.316 2.435 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H]2C[C@H]2C(C)(C)C)[nH+]c1C ZINC000896906634 583851380 /nfs/dbraw/zinc/85/13/80/583851380.db2.gz WRVVCRBQSFDHJK-GHMZBOCLSA-N 1 2 249.358 2.325 20 0 BEADLO Cc1[nH]c(CNC(=O)C2CC(C)(C)C2)[nH+]c1C ZINC000896911025 583852907 /nfs/dbraw/zinc/85/29/07/583852907.db2.gz YESDGAUUWUALRJ-UHFFFAOYSA-N 1 2 235.331 2.079 20 0 BEADLO CC[C@H](C)CC(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000896911438 583853244 /nfs/dbraw/zinc/85/32/44/583853244.db2.gz SUBRKQKVSLFRNJ-QMMMGPOBSA-N 1 2 223.320 2.079 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@H](C)CC(C)C)[nH+]c1C ZINC000896913348 583853992 /nfs/dbraw/zinc/85/39/92/583853992.db2.gz DRCJZJLBHASVLZ-SECBINFHSA-N 1 2 237.347 2.325 20 0 BEADLO Cc1[nH]c(CNC(=O)/C=C2\CC[C@H](C)C2)[nH+]c1C ZINC000896916368 583854711 /nfs/dbraw/zinc/85/47/11/583854711.db2.gz DEWCTYRHERZCCG-SZUMLMDFSA-N 1 2 247.342 2.389 20 0 BEADLO Cc1[nH]c(CNC(=O)C=C2CC[C@H](C)C2)[nH+]c1C ZINC000896916368 583854713 /nfs/dbraw/zinc/85/47/13/583854713.db2.gz DEWCTYRHERZCCG-SZUMLMDFSA-N 1 2 247.342 2.389 20 0 BEADLO Cc1[nH]c(CNC(=O)C=C2CCCC2)[nH+]c1C ZINC000896917264 583855568 /nfs/dbraw/zinc/85/55/68/583855568.db2.gz VAMKSOODTYTABK-UHFFFAOYSA-N 1 2 233.315 2.143 20 0 BEADLO CCCc1noc(C[NH+]2CCC(F)(F)CC2)n1 ZINC000796537453 583857499 /nfs/dbraw/zinc/85/74/99/583857499.db2.gz ABTKIFGIPUZWCF-UHFFFAOYSA-N 1 2 245.273 2.253 20 0 BEADLO CCc1c[nH]c2nc[nH+]c(SC3COC3)c12 ZINC000896961675 583864675 /nfs/dbraw/zinc/86/46/75/583864675.db2.gz CHWSBLZHCPLAFN-UHFFFAOYSA-N 1 2 235.312 2.011 20 0 BEADLO CO[C@@H]1CC[C@@H]1N(C)c1[nH]c2ccccc2[nH+]1 ZINC000897149207 583884339 /nfs/dbraw/zinc/88/43/39/583884339.db2.gz QHHDEMJPWKMWPE-NWDGAFQWSA-N 1 2 231.299 2.177 20 0 BEADLO CO[C@H]1CC[C@H]1N(C)c1[nH]c2ccccc2[nH+]1 ZINC000897149206 583884353 /nfs/dbraw/zinc/88/43/53/583884353.db2.gz QHHDEMJPWKMWPE-NEPJUHHUSA-N 1 2 231.299 2.177 20 0 BEADLO CO[C@@H]1CC[C@H]1N(C)c1cc[nH+]c2ccncc21 ZINC000897148063 583884449 /nfs/dbraw/zinc/88/44/49/583884449.db2.gz UNVNJZGTACYORD-ZIAGYGMSSA-N 1 2 243.310 2.243 20 0 BEADLO c1csc(N2CCC[C@H](n3cc[nH+]c3)C2)n1 ZINC000728567516 583897701 /nfs/dbraw/zinc/89/77/01/583897701.db2.gz SSNMEEJBSNGOTH-JTQLQIEISA-N 1 2 234.328 2.181 20 0 BEADLO c1csc(N2CCC[C@@H](n3cc[nH+]c3)C2)n1 ZINC000728567517 583897917 /nfs/dbraw/zinc/89/79/17/583897917.db2.gz SSNMEEJBSNGOTH-SNVBAGLBSA-N 1 2 234.328 2.181 20 0 BEADLO CC(C)c1nc(NC2CC(CCO)C2)cc[nH+]1 ZINC000897233731 583898847 /nfs/dbraw/zinc/89/88/47/583898847.db2.gz CKCMIJAQDQWVLF-UHFFFAOYSA-N 1 2 235.331 2.173 20 0 BEADLO CC1(C)CCC[C@H](CNc2cc[nH+]cc2F)O1 ZINC000897253991 583904029 /nfs/dbraw/zinc/90/40/29/583904029.db2.gz JSTVHUCAJXPJFG-SNVBAGLBSA-N 1 2 238.306 2.402 20 0 BEADLO Cc1nc(NC[C@]23C[C@H]2COC32CCC2)cc[nH+]1 ZINC000897266015 583906322 /nfs/dbraw/zinc/90/63/22/583906322.db2.gz XRLRFFSUFWBQNC-WCQYABFASA-N 1 2 245.326 2.156 20 0 BEADLO O[C@H]1CCN(c2[nH+]ccc3ccccc32)C[C@H]1F ZINC000897380311 583946940 /nfs/dbraw/zinc/94/69/40/583946940.db2.gz OOMBKEJGHXIASC-OLZOCXBDSA-N 1 2 246.285 2.144 20 0 BEADLO O=C(CCCn1cc[nH+]c1)OC1CCCC1 ZINC000729164539 583961794 /nfs/dbraw/zinc/96/17/94/583961794.db2.gz BEVJWSUKORQTKY-UHFFFAOYSA-N 1 2 222.288 2.149 20 0 BEADLO CCn1cnn(C[N@@H+]2C[C@@H](C)C[C@@H]2C)c1=S ZINC000740858753 583971800 /nfs/dbraw/zinc/97/18/00/583971800.db2.gz GMKNQEQIHLKALG-UWVGGRQHSA-N 1 2 240.376 2.122 20 0 BEADLO CCn1cnn(C[N@H+]2C[C@@H](C)C[C@@H]2C)c1=S ZINC000740858753 583971801 /nfs/dbraw/zinc/97/18/01/583971801.db2.gz GMKNQEQIHLKALG-UWVGGRQHSA-N 1 2 240.376 2.122 20 0 BEADLO CC/C=C(\C)C(=O)N1CC(Oc2cc[nH+]cc2)C1 ZINC000729247268 583979311 /nfs/dbraw/zinc/97/93/11/583979311.db2.gz FZXGANPDITUBAW-NYYWCZLTSA-N 1 2 246.310 2.028 20 0 BEADLO CC(C)c1nc(N[C@H]2COC[C@@H]2C2CC2)cc[nH+]1 ZINC000897446064 583986411 /nfs/dbraw/zinc/98/64/11/583986411.db2.gz BSMSNSMNFZRMNP-NEPJUHHUSA-N 1 2 247.342 2.437 20 0 BEADLO CCC/C=C/C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000729369888 583995335 /nfs/dbraw/zinc/99/53/35/583995335.db2.gz BIEPNFGLWILBMY-RPTYSRGTSA-N 1 2 247.342 2.472 20 0 BEADLO Cl/C=C/CNc1cc(N2CCCC2)nc[nH+]1 ZINC000897505098 583998370 /nfs/dbraw/zinc/99/83/70/583998370.db2.gz IUBRKERPFZAOHA-ONEGZZNKSA-N 1 2 238.722 2.241 20 0 BEADLO Cl/C=C/CNc1cc(N2CCCC2)[nH+]cn1 ZINC000897505098 583998372 /nfs/dbraw/zinc/99/83/72/583998372.db2.gz IUBRKERPFZAOHA-ONEGZZNKSA-N 1 2 238.722 2.241 20 0 BEADLO C[C@@H](O)c1cccc(N2CC3CC2(C)C3)[nH+]1 ZINC000864093105 584001386 /nfs/dbraw/zinc/00/13/86/584001386.db2.gz GQCTZKOTNRSHIX-TTXORMCVSA-N 1 2 218.300 2.124 20 0 BEADLO Cc1cn(C(C)(C)C(=O)NCCC2(C)CC2)c[nH+]1 ZINC000897614280 584031555 /nfs/dbraw/zinc/03/15/55/584031555.db2.gz IIWIJLHEQIIVPL-UHFFFAOYSA-N 1 2 249.358 2.233 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)c1nc(Cl)cs1 ZINC000858413553 588952497 /nfs/dbraw/zinc/95/24/97/588952497.db2.gz PEEFRWSNQNKPSQ-UHFFFAOYSA-N 1 2 228.708 2.156 20 0 BEADLO c1cc(CC2C[NH+](Cc3cscn3)C2)co1 ZINC000898160466 584087742 /nfs/dbraw/zinc/08/77/42/584087742.db2.gz GOXBUOQNFCKPST-UHFFFAOYSA-N 1 2 234.324 2.411 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@H](O)[C@H](F)C2)ccc1F ZINC000898191247 584095640 /nfs/dbraw/zinc/09/56/40/584095640.db2.gz AGMLSCIPLOZLAN-OLZOCXBDSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@H](O)[C@H](F)C2)ccc1F ZINC000898191247 584095643 /nfs/dbraw/zinc/09/56/43/584095643.db2.gz AGMLSCIPLOZLAN-OLZOCXBDSA-N 1 2 241.281 2.039 20 0 BEADLO COC1(C[NH2+]Cc2ccn[nH]2)CCCCCC1 ZINC000898263073 584103711 /nfs/dbraw/zinc/10/37/11/584103711.db2.gz DCEFPOBJIGLLOW-UHFFFAOYSA-N 1 2 237.347 2.239 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@@H](c1ccncc1)C1CC1 ZINC000898326265 584107354 /nfs/dbraw/zinc/10/73/54/584107354.db2.gz UYWCTJGTNOCEPX-CQSZACIVSA-N 1 2 242.326 2.354 20 0 BEADLO OC[C@]12C[C@H]1CN(c1[nH+]ccc3ccccc31)C2 ZINC000858505039 588960791 /nfs/dbraw/zinc/96/07/91/588960791.db2.gz DNIVDAYMOZBCNI-SWLSCSKDSA-N 1 2 240.306 2.053 20 0 BEADLO C/C=C(\CC)C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000898906175 584165184 /nfs/dbraw/zinc/16/51/84/584165184.db2.gz CUTRYQYRXQOFLX-VZUCSPMQSA-N 1 2 235.331 2.091 20 0 BEADLO CC(C)(CNC(=O)C=C1CCCC1)n1cc[nH+]c1 ZINC000898905280 584165321 /nfs/dbraw/zinc/16/53/21/584165321.db2.gz XAAKNMTVURJVEW-UHFFFAOYSA-N 1 2 247.342 2.235 20 0 BEADLO C/C=C(/CC)C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000898906176 584165402 /nfs/dbraw/zinc/16/54/02/584165402.db2.gz CUTRYQYRXQOFLX-WZUFQYTHSA-N 1 2 235.331 2.091 20 0 BEADLO C=C/C=C/CCNC(=O)C(C)(C)n1c[nH+]c(C)c1 ZINC000899203136 584181120 /nfs/dbraw/zinc/18/11/20/584181120.db2.gz HZJDQNACHQKCQS-VOTSOKGWSA-N 1 2 247.342 2.175 20 0 BEADLO CC1(C)C[C@@]1(C)CNC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000899203230 584181311 /nfs/dbraw/zinc/18/13/11/584181311.db2.gz KRURYPVDLYXLOF-RULNRJAQSA-N 1 2 247.342 2.066 20 0 BEADLO CC1(C)C[C@@]1(C)CNC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000899203230 584181313 /nfs/dbraw/zinc/18/13/13/584181313.db2.gz KRURYPVDLYXLOF-RULNRJAQSA-N 1 2 247.342 2.066 20 0 BEADLO Clc1csc(N2CCc3[nH+]c[nH]c3C2)n1 ZINC000858550459 588964782 /nfs/dbraw/zinc/96/47/82/588964782.db2.gz NRPGZAKQMPYVRV-UHFFFAOYSA-N 1 2 240.719 2.082 20 0 BEADLO C[C@H](c1ccccc1)[S@@](=O)Cc1[nH+]ccn1C ZINC000899296986 584194496 /nfs/dbraw/zinc/19/44/96/584194496.db2.gz DTOLEPLOHAEJNJ-DIFFPNOSSA-N 1 2 248.351 2.430 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC1CCC=CCC1 ZINC000899804821 584240002 /nfs/dbraw/zinc/24/00/02/584240002.db2.gz DFOJECIGJDTOAJ-LLVKDONJSA-N 1 2 247.342 2.203 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC1CCC=CCC1 ZINC000899804821 584240003 /nfs/dbraw/zinc/24/00/03/584240003.db2.gz DFOJECIGJDTOAJ-LLVKDONJSA-N 1 2 247.342 2.203 20 0 BEADLO CCC[C@H](C)N(C)C(=O)CNc1cccc[nH+]1 ZINC000900193401 584284948 /nfs/dbraw/zinc/28/49/48/584284948.db2.gz JGTLCNHRXPJNOC-NSHDSACASA-N 1 2 235.331 2.141 20 0 BEADLO Cc1cc(C)cc(N(C)C(=O)Cc2c[nH+]c[nH]2)c1 ZINC000900295186 584292174 /nfs/dbraw/zinc/29/21/74/584292174.db2.gz YFJKUKWRRXVMCU-UHFFFAOYSA-N 1 2 243.310 2.232 20 0 BEADLO Cc1cc(C)cc(N(C)C(=O)Cc2c[nH]c[nH+]2)c1 ZINC000900295186 584292176 /nfs/dbraw/zinc/29/21/76/584292176.db2.gz YFJKUKWRRXVMCU-UHFFFAOYSA-N 1 2 243.310 2.232 20 0 BEADLO Cc1ccc([C@@H](C)NC(=O)Cc2c[nH]c[nH+]2)s1 ZINC000900334883 584294152 /nfs/dbraw/zinc/29/41/52/584294152.db2.gz CIYHEXIKIGLHHK-SECBINFHSA-N 1 2 249.339 2.200 20 0 BEADLO Cc1ccc([C@@H](C)NC(=O)Cc2c[nH+]c[nH]2)s1 ZINC000900334883 584294154 /nfs/dbraw/zinc/29/41/54/584294154.db2.gz CIYHEXIKIGLHHK-SECBINFHSA-N 1 2 249.339 2.200 20 0 BEADLO CC[C@H](NC(=O)Cc1c[nH]c[nH+]1)C1CCCCC1 ZINC000900491445 584316836 /nfs/dbraw/zinc/31/68/36/584316836.db2.gz UDYJRAUIZZBVER-ZDUSSCGKSA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@H](NC(=O)Cc1c[nH+]c[nH]1)C1CCCCC1 ZINC000900491445 584316838 /nfs/dbraw/zinc/31/68/38/584316838.db2.gz UDYJRAUIZZBVER-ZDUSSCGKSA-N 1 2 249.358 2.427 20 0 BEADLO CCC[C@H]1CCCC[C@@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000900555859 584322493 /nfs/dbraw/zinc/32/24/93/584322493.db2.gz GYHOBPQIFRKPSX-AAEUAGOBSA-N 1 2 249.358 2.427 20 0 BEADLO CCC[C@H]1CCCC[C@@H]1NC(=O)Cc1c[nH+]c[nH]1 ZINC000900555859 584322495 /nfs/dbraw/zinc/32/24/95/584322495.db2.gz GYHOBPQIFRKPSX-AAEUAGOBSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@H]1CCC[C@H](C)N1C(=O)CNc1cccc[nH+]1 ZINC000900565606 584325586 /nfs/dbraw/zinc/32/55/86/584325586.db2.gz NFXMVDQDHZEBCP-RYUDHWBXSA-N 1 2 247.342 2.283 20 0 BEADLO CC[C@@H](C)[C@H](C)N(C(=O)Cc1c[nH+]c[nH]1)C1CC1 ZINC000900588188 584329142 /nfs/dbraw/zinc/32/91/42/584329142.db2.gz MXEFYEAAPYPUBM-MNOVXSKESA-N 1 2 249.358 2.378 20 0 BEADLO CC(=C(F)C(=O)Nc1cc[nH+]cc1C)C1CC1 ZINC000900619349 584333078 /nfs/dbraw/zinc/33/30/78/584333078.db2.gz QQRLGOKOYNXZMN-FMIVXFBMSA-N 1 2 234.274 2.404 20 0 BEADLO CC1(CNC(=O)CNc2cccc[nH+]2)CCCC1 ZINC000900634922 584334376 /nfs/dbraw/zinc/33/43/76/584334376.db2.gz QLAVZRNJQTVSDL-UHFFFAOYSA-N 1 2 247.342 2.190 20 0 BEADLO C[C@H]1CCCCCN1C(=O)CNc1cccc[nH+]1 ZINC000900720347 584344318 /nfs/dbraw/zinc/34/43/18/584344318.db2.gz TYUAAWAROPNFQL-LBPRGKRZSA-N 1 2 247.342 2.285 20 0 BEADLO C/C=C\CNc1nc(C)[nH+]c(NC/C=C\C)n1 ZINC000858800554 588976607 /nfs/dbraw/zinc/97/66/07/588976607.db2.gz QLJFAOFGJNNPIN-PEPZGXQESA-N 1 2 233.319 2.156 20 0 BEADLO CC[C@H]1CCC[C@H](NC(=O)Cc2c[nH]c[nH+]2)C1 ZINC000900806918 584353695 /nfs/dbraw/zinc/35/36/95/584353695.db2.gz OGYJYAPCUJXFIM-QWRGUYRKSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@H]1CCC[C@H](NC(=O)Cc2c[nH+]c[nH]2)C1 ZINC000900806918 584353696 /nfs/dbraw/zinc/35/36/96/584353696.db2.gz OGYJYAPCUJXFIM-QWRGUYRKSA-N 1 2 235.331 2.037 20 0 BEADLO CO[C@H]1C[C@@H](CNc2cc[nH+]c(C(C)C)n2)C1 ZINC000858853494 588978892 /nfs/dbraw/zinc/97/88/92/588978892.db2.gz LTSRWFYYRZCCSG-PHIMTYICSA-N 1 2 235.331 2.437 20 0 BEADLO CC(C)CC[C@@H]1CCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC000901117416 584386704 /nfs/dbraw/zinc/38/67/04/584386704.db2.gz IICKUVUWRANMTO-ZDUSSCGKSA-N 1 2 249.358 2.379 20 0 BEADLO Cc1cc(CSCc2c[nH+]cn2C)no1 ZINC000901715355 584487745 /nfs/dbraw/zinc/48/77/45/584487745.db2.gz SLPNDSJIISQDBZ-UHFFFAOYSA-N 1 2 223.301 2.150 20 0 BEADLO c1cn(C2CC2)c(CNc2nnc(C3CC3)o2)[nH+]1 ZINC000902038265 584515152 /nfs/dbraw/zinc/51/51/52/584515152.db2.gz QSALVZGGKGBCNY-UHFFFAOYSA-N 1 2 245.286 2.091 20 0 BEADLO Cc1nc(NCc2cnc(C3CC3)nc2)cc[nH+]1 ZINC000902124086 584529140 /nfs/dbraw/zinc/52/91/40/584529140.db2.gz AUJKSFQAKVDHPS-UHFFFAOYSA-N 1 2 241.298 2.065 20 0 BEADLO CCn1cccc1CNc1[nH+]cccc1CO ZINC000902147364 584530592 /nfs/dbraw/zinc/53/05/92/584530592.db2.gz KHYQMPNTRGTZNW-UHFFFAOYSA-N 1 2 231.299 2.007 20 0 BEADLO Cc1[nH]c(CNc2nnc([C@H]3C[C@H]3C)o2)[nH+]c1C ZINC000902148435 584530894 /nfs/dbraw/zinc/53/08/94/584530894.db2.gz FKLRHMFVGJMNNG-MUWHJKNJSA-N 1 2 247.302 2.145 20 0 BEADLO CC(C)OCC(N)=[NH+]OC[C@@H]1C[C@H]2C=C[C@@H]1C2 ZINC000902220504 584540081 /nfs/dbraw/zinc/54/00/81/584540081.db2.gz GCAPKHZMICODIM-TUAOUCFPSA-N 1 2 238.331 2.122 20 0 BEADLO CNc1ccccc1C[NH2+]Cc1ccon1 ZINC000902301666 584553736 /nfs/dbraw/zinc/55/37/36/584553736.db2.gz WFXSHJNQAREHOL-UHFFFAOYSA-N 1 2 217.272 2.006 20 0 BEADLO CCOc1cccc(NCc2cn(CC)c[nH+]2)n1 ZINC000902335400 584564269 /nfs/dbraw/zinc/56/42/69/584564269.db2.gz AVTCDYHHNZIZTM-UHFFFAOYSA-N 1 2 246.314 2.309 20 0 BEADLO CCn1c[nH+]c(CNc2cnn(C)c2C2CC2)c1 ZINC000902488338 584626692 /nfs/dbraw/zinc/62/66/92/584626692.db2.gz XURVKZWRQJFWQV-UHFFFAOYSA-N 1 2 245.330 2.126 20 0 BEADLO CCn1c[nH+]c(CNC(C)(C)C(F)F)c1 ZINC000902533258 584633882 /nfs/dbraw/zinc/63/38/82/584633882.db2.gz SVEDRCMKDNAOJG-UHFFFAOYSA-N 1 2 217.263 2.036 20 0 BEADLO CCNc1ccccc1C[NH2+]CC(F)F ZINC000902561712 584634364 /nfs/dbraw/zinc/63/43/64/584634364.db2.gz ZOUVGTPSFOVCOM-UHFFFAOYSA-N 1 2 214.259 2.473 20 0 BEADLO CCn1c[nH+]c(CN[C@H](C2CC2)C(F)(F)F)c1 ZINC000902560594 584634623 /nfs/dbraw/zinc/63/46/23/584634623.db2.gz BYHSSLNQSDARQG-SNVBAGLBSA-N 1 2 247.264 2.334 20 0 BEADLO CCn1c[nH+]c(CNc2cc3n(n2)CCCC3)c1 ZINC000902565037 584634867 /nfs/dbraw/zinc/63/48/67/584634867.db2.gz ZSMBBPFINDPZED-UHFFFAOYSA-N 1 2 245.330 2.048 20 0 BEADLO COC[C@H](COc1ccc2c[nH+]ccc2c1)OC ZINC000902637021 584648010 /nfs/dbraw/zinc/64/80/10/584648010.db2.gz GERJLECVZFWMOG-CQSZACIVSA-N 1 2 247.294 2.275 20 0 BEADLO c1cc2cc(OCCC3OCCO3)ccc2c[nH+]1 ZINC000902637047 584648233 /nfs/dbraw/zinc/64/82/33/584648233.db2.gz HBKCQZVEKRFVAV-UHFFFAOYSA-N 1 2 245.278 2.377 20 0 BEADLO c1cc2cc(OC[C@@H]3COCCO3)ccc2c[nH+]1 ZINC000902637065 584649015 /nfs/dbraw/zinc/64/90/15/584649015.db2.gz HNRWAQHFFJNLPP-AWEZNQCLSA-N 1 2 245.278 2.029 20 0 BEADLO CC[C@@H]1c2ccccc2C[N@H+]1CN1CCOC1=O ZINC000902665953 584653481 /nfs/dbraw/zinc/65/34/81/584653481.db2.gz HRDGPUUEOBFSFW-CYBMUJFWSA-N 1 2 246.310 2.363 20 0 BEADLO CC[C@@H]1c2ccccc2C[N@@H+]1CN1CCOC1=O ZINC000902665953 584653483 /nfs/dbraw/zinc/65/34/83/584653483.db2.gz HRDGPUUEOBFSFW-CYBMUJFWSA-N 1 2 246.310 2.363 20 0 BEADLO C[C@H](O[NH+]=C(N)[C@H]1CCCO1)c1ccccc1 ZINC000902738711 584663284 /nfs/dbraw/zinc/66/32/84/584663284.db2.gz LRRKIKLNEXMGMG-CMPLNLGQSA-N 1 2 234.299 2.425 20 0 BEADLO CCCn1cc([C@H](C)[NH2+]Cc2ccoc2C)nn1 ZINC000902773090 584668215 /nfs/dbraw/zinc/66/82/15/584668215.db2.gz WFZHBYHHPJOJRK-JTQLQIEISA-N 1 2 248.330 2.440 20 0 BEADLO C[C@@H]1OCC[C@@H]1COc1ccc2c(c1)[nH+]cn2C ZINC000902781127 584670281 /nfs/dbraw/zinc/67/02/81/584670281.db2.gz GBOWRXWYZUCSDM-WDEREUQCSA-N 1 2 246.310 2.377 20 0 BEADLO Cn1c[nH+]c2cc(OCCOC(F)F)ccc21 ZINC000902781252 584670475 /nfs/dbraw/zinc/67/04/75/584670475.db2.gz KZIRIBBMYOYNFZ-UHFFFAOYSA-N 1 2 242.225 2.191 20 0 BEADLO FC(F)Cn1cc[nH+]c1CN1CCC[C@@H](F)C1 ZINC000902993561 584711953 /nfs/dbraw/zinc/71/19/53/584711953.db2.gz UYDZQFQLNXKNSP-SECBINFHSA-N 1 2 247.264 2.082 20 0 BEADLO CCCCCNC(=O)[C@H](C)[N@@H+]1CCC[C@H](F)C1 ZINC000902999559 584714766 /nfs/dbraw/zinc/71/47/66/584714766.db2.gz ABWUOWIYVYUHJF-RYUDHWBXSA-N 1 2 244.354 2.115 20 0 BEADLO CCCCCNC(=O)[C@H](C)[N@H+]1CCC[C@H](F)C1 ZINC000902999559 584714767 /nfs/dbraw/zinc/71/47/67/584714767.db2.gz ABWUOWIYVYUHJF-RYUDHWBXSA-N 1 2 244.354 2.115 20 0 BEADLO CCCN(CCC)C(=O)C[N@@H+]1CCC[C@@H](F)C1 ZINC000903002788 584716143 /nfs/dbraw/zinc/71/61/43/584716143.db2.gz HNHPMXAHKXOYBU-GFCCVEGCSA-N 1 2 244.354 2.069 20 0 BEADLO CCCN(CCC)C(=O)C[N@H+]1CCC[C@@H](F)C1 ZINC000903002788 584716144 /nfs/dbraw/zinc/71/61/44/584716144.db2.gz HNHPMXAHKXOYBU-GFCCVEGCSA-N 1 2 244.354 2.069 20 0 BEADLO COCc1cc[nH+]c(N[C@H]2CCC[C@@H]2OC)c1 ZINC000903196138 584734304 /nfs/dbraw/zinc/73/43/04/584734304.db2.gz IGZQYEQPJSSNLQ-RYUDHWBXSA-N 1 2 236.315 2.207 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2CCC[C@@H]2OC)c1 ZINC000903196136 584734321 /nfs/dbraw/zinc/73/43/21/584734321.db2.gz IGZQYEQPJSSNLQ-NEPJUHHUSA-N 1 2 236.315 2.207 20 0 BEADLO Cc1cc(N[C@H]2CCO[C@@]23CCOC3)c[nH+]c1C ZINC000903220599 584737832 /nfs/dbraw/zinc/73/78/32/584737832.db2.gz NARYVDVTPFMZOA-UONOGXRCSA-N 1 2 248.326 2.058 20 0 BEADLO Cc1nonc1[C@H](C)[NH2+][C@@H](C)c1cncs1 ZINC000903309708 584747960 /nfs/dbraw/zinc/74/79/60/584747960.db2.gz HBRAPAPTHFHNDX-BQBZGAKWSA-N 1 2 238.316 2.246 20 0 BEADLO Cc1nonc1[C@@H](C)[NH2+][C@@H](C)c1cncs1 ZINC000903309709 584748192 /nfs/dbraw/zinc/74/81/92/584748192.db2.gz HBRAPAPTHFHNDX-NKWVEPMBSA-N 1 2 238.316 2.246 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCn2ccnc21)c1cncs1 ZINC000903312587 584748278 /nfs/dbraw/zinc/74/82/78/584748278.db2.gz WYSVCVARKCQCLE-BDAKNGLRSA-N 1 2 234.328 2.135 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCn2ccnc21)c1cncs1 ZINC000903312590 584748350 /nfs/dbraw/zinc/74/83/50/584748350.db2.gz WYSVCVARKCQCLE-RKDXNWHRSA-N 1 2 234.328 2.135 20 0 BEADLO CCc1ccc([C@H](C)[NH2+]Cc2cn(C)cn2)o1 ZINC000903351656 584755528 /nfs/dbraw/zinc/75/55/28/584755528.db2.gz NTASGCPFZKIKGY-JTQLQIEISA-N 1 2 233.315 2.426 20 0 BEADLO Cn1c[nH+]c(CN[C@@H]2CCCc3scnc32)c1 ZINC000903352913 584755813 /nfs/dbraw/zinc/75/58/13/584755813.db2.gz WQUKTJQDVLLTFY-SNVBAGLBSA-N 1 2 248.355 2.044 20 0 BEADLO Cn1cnc(C[NH2+][C@@H]2CCCc3scnc32)c1 ZINC000903352913 584755815 /nfs/dbraw/zinc/75/58/15/584755815.db2.gz WQUKTJQDVLLTFY-SNVBAGLBSA-N 1 2 248.355 2.044 20 0 BEADLO c1ccc([C@@H]2CC[C@H](CN3CC=CC[NH2+]3)O2)cc1 ZINC000903490795 584780745 /nfs/dbraw/zinc/78/07/45/584780745.db2.gz IMILHPSYGFEWAQ-CABCVRRESA-N 1 2 244.338 2.283 20 0 BEADLO CCCN(C(=O)/C=C/c1cn(C)c[nH+]1)C(C)(C)C ZINC000903870702 584814662 /nfs/dbraw/zinc/81/46/62/584814662.db2.gz PDCMDMPUXOVYPT-BQYQJAHWSA-N 1 2 249.358 2.470 20 0 BEADLO CC[C@]1(C)CCC[N@H+](C[C@H]([NH3+])CC(F)F)C1 ZINC000903894988 584819438 /nfs/dbraw/zinc/81/94/38/584819438.db2.gz JBSAZXWBRUXVHG-ZYHUDNBSSA-N 1 2 234.334 2.481 20 0 BEADLO CC[C@]1(C)CCC[N@@H+](C[C@H]([NH3+])CC(F)F)C1 ZINC000903894988 584819439 /nfs/dbraw/zinc/81/94/39/584819439.db2.gz JBSAZXWBRUXVHG-ZYHUDNBSSA-N 1 2 234.334 2.481 20 0 BEADLO CC[C@@]1(C)CCC[N@H+](C[C@@H]([NH3+])CC(F)F)C1 ZINC000903894986 584819664 /nfs/dbraw/zinc/81/96/64/584819664.db2.gz JBSAZXWBRUXVHG-JQWIXIFHSA-N 1 2 234.334 2.481 20 0 BEADLO CC[C@@]1(C)CCC[N@@H+](C[C@@H]([NH3+])CC(F)F)C1 ZINC000903894986 584819665 /nfs/dbraw/zinc/81/96/65/584819665.db2.gz JBSAZXWBRUXVHG-JQWIXIFHSA-N 1 2 234.334 2.481 20 0 BEADLO CC[NH2+]Cc1noc(C2(C3CC3)CCC2)n1 ZINC000904075026 584839620 /nfs/dbraw/zinc/83/96/20/584839620.db2.gz FBXGKNUQMHLKJM-UHFFFAOYSA-N 1 2 221.304 2.011 20 0 BEADLO CC[NH2+]Cc1noc(CC(C)(C)CC(F)F)n1 ZINC000904075789 584839668 /nfs/dbraw/zinc/83/96/68/584839668.db2.gz RJAJFNQUTDSYPY-UHFFFAOYSA-N 1 2 247.289 2.403 20 0 BEADLO CCO[C@@H](c1noc([C@H](C)[NH+](C)C)n1)C(C)C ZINC000904120871 584842285 /nfs/dbraw/zinc/84/22/85/584842285.db2.gz GTOLSRXULFENHZ-VHSXEESVSA-N 1 2 241.335 2.426 20 0 BEADLO CCO[C@@H](c1noc([C@@H](C)[NH+](C)C)n1)C(C)C ZINC000904129565 584842825 /nfs/dbraw/zinc/84/28/25/584842825.db2.gz GTOLSRXULFENHZ-NXEZZACHSA-N 1 2 241.335 2.426 20 0 BEADLO CCO[C@@H](C)c1nc(-c2c[nH+]c(N)cc2C)no1 ZINC000904271847 584858656 /nfs/dbraw/zinc/85/86/56/584858656.db2.gz CAGZXHRCGBVERF-QMMMGPOBSA-N 1 2 248.286 2.120 20 0 BEADLO Cc1[nH+]c(N)ccc1-c1noc([C@@H]2C[C@H]2C)n1 ZINC000904256564 584859097 /nfs/dbraw/zinc/85/90/97/584859097.db2.gz BWKYNPXARUBABL-HZGVNTEJSA-N 1 2 230.271 2.146 20 0 BEADLO Cc1[nH+]c(N)ccc1-c1noc(CCC2CC2)n1 ZINC000904260672 584859205 /nfs/dbraw/zinc/85/92/05/584859205.db2.gz SJNYLALBXOEYRN-UHFFFAOYSA-N 1 2 244.298 2.365 20 0 BEADLO CC(C)CCOC(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000859172512 589013389 /nfs/dbraw/zinc/01/33/89/589013389.db2.gz GRBIXPJXCBYAKG-JTQLQIEISA-N 1 2 237.303 2.100 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OCc1nccs1 ZINC000746557324 584883522 /nfs/dbraw/zinc/88/35/22/584883522.db2.gz AAPZADZNZQGEOS-UHFFFAOYSA-N 1 2 247.323 2.498 20 0 BEADLO Cc1ccccc1C(=O)OCCCn1cc[nH+]c1 ZINC000763287302 584921010 /nfs/dbraw/zinc/92/10/10/584921010.db2.gz LKXWHPLJHGOTHD-UHFFFAOYSA-N 1 2 244.294 2.439 20 0 BEADLO CCCCCCC(=O)OCc1c[nH+]cn1C ZINC000754685401 584927657 /nfs/dbraw/zinc/92/76/57/584927657.db2.gz DBSQXADJCPHSHP-UHFFFAOYSA-N 1 2 224.304 2.434 20 0 BEADLO CCC/C(C)=C/C(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000764893728 584932529 /nfs/dbraw/zinc/93/25/29/584932529.db2.gz WWBHYEOSNLKZJW-HUYFXPKMSA-N 1 2 247.342 2.130 20 0 BEADLO CCCC(C)=CC(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000764893728 584932530 /nfs/dbraw/zinc/93/25/30/584932530.db2.gz WWBHYEOSNLKZJW-HUYFXPKMSA-N 1 2 247.342 2.130 20 0 BEADLO CC[C@H](C)C[N@H+](C)Cn1ncn(CC)c1=S ZINC000732184177 584934490 /nfs/dbraw/zinc/93/44/90/584934490.db2.gz WOQAVKIRVONLMH-JTQLQIEISA-N 1 2 242.392 2.369 20 0 BEADLO CC[C@H](C)C[N@@H+](C)Cn1ncn(CC)c1=S ZINC000732184177 584934491 /nfs/dbraw/zinc/93/44/91/584934491.db2.gz WOQAVKIRVONLMH-JTQLQIEISA-N 1 2 242.392 2.369 20 0 BEADLO CCn1cc(C[N@H+](C)C/C=C\Cl)cn1 ZINC000733841410 584953655 /nfs/dbraw/zinc/95/36/55/584953655.db2.gz DLYDQJJLBGLYNH-PLNGDYQASA-N 1 2 213.712 2.087 20 0 BEADLO CCn1cc(C[N@@H+](C)C/C=C\Cl)cn1 ZINC000733841410 584953656 /nfs/dbraw/zinc/95/36/56/584953656.db2.gz DLYDQJJLBGLYNH-PLNGDYQASA-N 1 2 213.712 2.087 20 0 BEADLO O=C(NCCC1CCC1)c1ccc2[nH+]ccn2c1 ZINC000755498842 584956313 /nfs/dbraw/zinc/95/63/13/584956313.db2.gz AINBGQPODWKQFT-UHFFFAOYSA-N 1 2 243.310 2.254 20 0 BEADLO CCc1nc(N2CCC[C@H](COC)CC2)cc[nH+]1 ZINC000884525588 584956517 /nfs/dbraw/zinc/95/65/17/584956517.db2.gz YXJIJPXWDGTEGZ-LBPRGKRZSA-N 1 2 249.358 2.292 20 0 BEADLO c1ccc(N2CC[C@@H]([C@H]3CCCO3)C2)[nH+]c1 ZINC000884731309 584962935 /nfs/dbraw/zinc/96/29/35/584962935.db2.gz WLNGAVBOFNSYMA-VXGBXAGGSA-N 1 2 218.300 2.087 20 0 BEADLO COC[C@@H]1CCC[N@H+](CC(F)(F)C(F)F)C1 ZINC000736621435 585008232 /nfs/dbraw/zinc/00/82/32/585008232.db2.gz JHTHLDOEUAYXGN-MRVPVSSYSA-N 1 2 243.244 2.245 20 0 BEADLO COC[C@@H]1CCC[N@@H+](CC(F)(F)C(F)F)C1 ZINC000736621435 585008233 /nfs/dbraw/zinc/00/82/33/585008233.db2.gz JHTHLDOEUAYXGN-MRVPVSSYSA-N 1 2 243.244 2.245 20 0 BEADLO Cc1cc(C(=O)OCc2ccc(C)[nH+]c2C)on1 ZINC000771966315 585011550 /nfs/dbraw/zinc/01/15/50/585011550.db2.gz ABQHEKXQFXXADI-UHFFFAOYSA-N 1 2 246.266 2.352 20 0 BEADLO Cn1c[nH+]c(CNC(=O)C2CCCCCC2)c1 ZINC000890114563 585024058 /nfs/dbraw/zinc/02/40/58/585024058.db2.gz PSCVNQGWLGDVAA-UHFFFAOYSA-N 1 2 235.331 2.007 20 0 BEADLO C/C=C\C(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000737823769 585038251 /nfs/dbraw/zinc/03/82/51/585038251.db2.gz ZNSBRMUBEBQFJF-ODTOEKCJSA-N 1 2 219.288 2.039 20 0 BEADLO CC/C(C)=C/C(=O)OCc1cc[nH+]c(N)c1 ZINC000838044779 585043941 /nfs/dbraw/zinc/04/39/41/585043941.db2.gz QTVSEZUPGSMMEU-RMKNXTFCSA-N 1 2 220.272 2.063 20 0 BEADLO CC(C(=O)OCc1cc[nH+]c(N)c1)=C1CCC1 ZINC000838237500 585049816 /nfs/dbraw/zinc/04/98/16/585049816.db2.gz HLSXQWWGXHBSLC-UHFFFAOYSA-N 1 2 232.283 2.207 20 0 BEADLO CCn1ncc(C[N@H+](CC)Cc2ccccc2)n1 ZINC000838782333 585069816 /nfs/dbraw/zinc/06/98/16/585069816.db2.gz KJDUQNNXAQASGW-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CCn1ncc(C[N@@H+](CC)Cc2ccccc2)n1 ZINC000838782333 585069817 /nfs/dbraw/zinc/06/98/17/585069817.db2.gz KJDUQNNXAQASGW-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CCn1ncc(C[NH2+][C@H](C)c2cccc(F)c2)n1 ZINC000838894511 585078709 /nfs/dbraw/zinc/07/87/09/585078709.db2.gz JLEHXDUXQXOKHN-SNVBAGLBSA-N 1 2 248.305 2.288 20 0 BEADLO CCn1ncc(C[NH2+][C@@H](C)c2ccc(F)cc2)n1 ZINC000838891027 585078904 /nfs/dbraw/zinc/07/89/04/585078904.db2.gz RXONGMPJFWLKGJ-JTQLQIEISA-N 1 2 248.305 2.288 20 0 BEADLO CCn1ncc(C[NH2+][C@H](C)c2ccccc2F)n1 ZINC000838893213 585078959 /nfs/dbraw/zinc/07/89/59/585078959.db2.gz GSMUDUHEJSHINH-SNVBAGLBSA-N 1 2 248.305 2.288 20 0 BEADLO COC1(C)C[NH+](Cc2cnc3ccccc3c2)C1 ZINC000839102394 585090946 /nfs/dbraw/zinc/09/09/46/585090946.db2.gz NKIAREKNGDFISS-UHFFFAOYSA-N 1 2 242.322 2.456 20 0 BEADLO CCn1ncc(C[N@@H+]2CC3(CCC3)[C@@H]2C2CC2)n1 ZINC000839107873 585091246 /nfs/dbraw/zinc/09/12/46/585091246.db2.gz NMCONQATSCTLNB-ZDUSSCGKSA-N 1 2 246.358 2.063 20 0 BEADLO CCn1ncc(C[N@H+]2CC3(CCC3)[C@@H]2C2CC2)n1 ZINC000839107873 585091247 /nfs/dbraw/zinc/09/12/47/585091247.db2.gz NMCONQATSCTLNB-ZDUSSCGKSA-N 1 2 246.358 2.063 20 0 BEADLO COC1C[NH+](Cc2nccc3ccccc32)C1 ZINC000839128193 585093614 /nfs/dbraw/zinc/09/36/14/585093614.db2.gz NSGHXQONLBKNHL-UHFFFAOYSA-N 1 2 228.295 2.065 20 0 BEADLO CC(C)(C)OC(=O)C1C[NH+](Cc2ccoc2)C1 ZINC000839133275 585094086 /nfs/dbraw/zinc/09/40/86/585094086.db2.gz NTAFQVFMKOOQHH-UHFFFAOYSA-N 1 2 237.299 2.053 20 0 BEADLO Cn1ncc(C[NH+]2CC3(CC(F)C3)C2)c1Cl ZINC000839140794 585094344 /nfs/dbraw/zinc/09/43/44/585094344.db2.gz VZNYAZHYOJYYGS-UHFFFAOYSA-N 1 2 243.713 2.007 20 0 BEADLO CC[C@@H]1OCC[C@H]1[NH2+]CC(F)(F)C(F)F ZINC000839197649 585098876 /nfs/dbraw/zinc/09/88/76/585098876.db2.gz ADMGQESDELMOAV-RQJHMYQMSA-N 1 2 229.217 2.044 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OCc1ccon1 ZINC000740872013 585107542 /nfs/dbraw/zinc/10/75/42/585107542.db2.gz BUPPZXCUWACKAS-UHFFFAOYSA-N 1 2 231.255 2.030 20 0 BEADLO CCc1noc(-c2[nH+]c(C)n3ccccc23)n1 ZINC000741447186 585114038 /nfs/dbraw/zinc/11/40/38/585114038.db2.gz JMIVVNRHBLRBBE-UHFFFAOYSA-N 1 2 228.255 2.255 20 0 BEADLO Cc1ccccc1[C@@H](O)C[N@@H+](C)Cc1ccon1 ZINC000741796053 585119680 /nfs/dbraw/zinc/11/96/80/585119680.db2.gz REVPBFSQIMGSSN-AWEZNQCLSA-N 1 2 246.310 2.148 20 0 BEADLO Cc1ccccc1[C@@H](O)C[N@H+](C)Cc1ccon1 ZINC000741796053 585119681 /nfs/dbraw/zinc/11/96/81/585119681.db2.gz REVPBFSQIMGSSN-AWEZNQCLSA-N 1 2 246.310 2.148 20 0 BEADLO Cc1nc(NC[C@H](O)c2ccccc2F)cc[nH+]1 ZINC000742254373 585124369 /nfs/dbraw/zinc/12/43/69/585124369.db2.gz AYNKMZKAHLASTM-LBPRGKRZSA-N 1 2 247.273 2.070 20 0 BEADLO Cc1cc(NCC[C@@H](O)c2ccccc2)nc[nH+]1 ZINC000742427334 585126068 /nfs/dbraw/zinc/12/60/68/585126068.db2.gz HXSIZTXTHGFPCK-CYBMUJFWSA-N 1 2 243.310 2.321 20 0 BEADLO c1cc(NCCOC2CCC2)nc(C2CC2)[nH+]1 ZINC000742424062 585126099 /nfs/dbraw/zinc/12/60/99/585126099.db2.gz ZZWIXRASTGDJNV-UHFFFAOYSA-N 1 2 233.315 2.335 20 0 BEADLO C/C(=C\C(=O)N[C@H](C)Cn1cc[nH+]c1)C(C)(C)C ZINC000742544719 585127937 /nfs/dbraw/zinc/12/79/37/585127937.db2.gz ROYFIMNBHYGKTE-JATZPVMKSA-N 1 2 249.358 2.380 20 0 BEADLO C/C(=C/C(=O)N1CC(n2cc[nH+]c2)C1)C(C)(C)C ZINC000742677475 585129983 /nfs/dbraw/zinc/12/99/83/585129983.db2.gz MSTKPMNGSAORBX-XFFZJAGNSA-N 1 2 247.342 2.259 20 0 BEADLO C[C@H](O)CC[N@@H+]1CCn2c(Cl)ccc2[C@H]1C ZINC000839527729 585139501 /nfs/dbraw/zinc/13/95/01/585139501.db2.gz HFJISHPYFDIQFH-VHSXEESVSA-N 1 2 242.750 2.289 20 0 BEADLO C[C@H](O)CC[N@H+]1CCn2c(Cl)ccc2[C@H]1C ZINC000839527729 585139502 /nfs/dbraw/zinc/13/95/02/585139502.db2.gz HFJISHPYFDIQFH-VHSXEESVSA-N 1 2 242.750 2.289 20 0 BEADLO C[C@H](O)CC[N@@H+]1CCn2c(Cl)ccc2[C@@H]1C ZINC000839527728 585139640 /nfs/dbraw/zinc/13/96/40/585139640.db2.gz HFJISHPYFDIQFH-UWVGGRQHSA-N 1 2 242.750 2.289 20 0 BEADLO C[C@H](O)CC[N@H+]1CCn2c(Cl)ccc2[C@@H]1C ZINC000839527728 585139641 /nfs/dbraw/zinc/13/96/41/585139641.db2.gz HFJISHPYFDIQFH-UWVGGRQHSA-N 1 2 242.750 2.289 20 0 BEADLO COc1cc[nH+]cc1CSc1cccc[n+]1[O-] ZINC000804897717 585144355 /nfs/dbraw/zinc/14/43/55/585144355.db2.gz VVWUVHVKUFHDHX-UHFFFAOYSA-N 1 2 248.307 2.016 20 0 BEADLO Cc1nonc1C[NH+]1CCC(C(F)(F)F)CC1 ZINC000744421410 585150188 /nfs/dbraw/zinc/15/01/88/585150188.db2.gz YMCMQTWJDFJHHV-UHFFFAOYSA-N 1 2 249.236 2.152 20 0 BEADLO O=C(OCC1CCC1)c1ccc2[nH+]ccn2c1 ZINC000744998137 585155108 /nfs/dbraw/zinc/15/51/08/585155108.db2.gz ZTGMCRGOUZTWMF-UHFFFAOYSA-N 1 2 230.267 2.291 20 0 BEADLO CC[N@@H+]1CCCC[C@@H]1C(=O)OC[Si](C)(C)C ZINC000745083545 585156082 /nfs/dbraw/zinc/15/60/82/585156082.db2.gz NAHQFVDEVHAHMP-LLVKDONJSA-N 1 2 243.423 2.281 20 0 BEADLO CC[N@H+]1CCCC[C@@H]1C(=O)OC[Si](C)(C)C ZINC000745083545 585156083 /nfs/dbraw/zinc/15/60/83/585156083.db2.gz NAHQFVDEVHAHMP-LLVKDONJSA-N 1 2 243.423 2.281 20 0 BEADLO CC=C(C)C(=O)Nc1cc(C)[nH+]cc1C ZINC000747106660 585175128 /nfs/dbraw/zinc/17/51/28/585175128.db2.gz CYWMPWBHNYKMEO-VMPITWQZSA-N 1 2 204.273 2.025 20 0 BEADLO Cc1cc(NC(=O)C=Cc2ccco2)c(C)c[nH+]1 ZINC000747110968 585175162 /nfs/dbraw/zinc/17/51/62/585175162.db2.gz BWTPQJZJEVQVAL-WAYWQWQTSA-N 1 2 242.278 2.365 20 0 BEADLO C[C@H]1CC(=O)N(C[N@@H+]2Cc3ccccc3[C@@H]2C)C1 ZINC000747463932 585179024 /nfs/dbraw/zinc/17/90/24/585179024.db2.gz SAGFTGCRGSDTIZ-RYUDHWBXSA-N 1 2 244.338 2.389 20 0 BEADLO C[C@H]1CC(=O)N(C[N@H+]2Cc3ccccc3[C@@H]2C)C1 ZINC000747463932 585179025 /nfs/dbraw/zinc/17/90/25/585179025.db2.gz SAGFTGCRGSDTIZ-RYUDHWBXSA-N 1 2 244.338 2.389 20 0 BEADLO C[C@@H]1c2ccccc2C[N@H+]1CN1CCCC1=O ZINC000747464796 585179255 /nfs/dbraw/zinc/17/92/55/585179255.db2.gz XRGOMDVQZHHSIF-LLVKDONJSA-N 1 2 230.311 2.143 20 0 BEADLO C[C@@H]1c2ccccc2C[N@@H+]1CN1CCCC1=O ZINC000747464796 585179256 /nfs/dbraw/zinc/17/92/56/585179256.db2.gz XRGOMDVQZHHSIF-LLVKDONJSA-N 1 2 230.311 2.143 20 0 BEADLO Cc1ccc(F)cc1C(=O)OCc1c[nH+]cn1C ZINC000747784541 585184186 /nfs/dbraw/zinc/18/41/86/585184186.db2.gz XZOMPJFWCUACRE-UHFFFAOYSA-N 1 2 248.257 2.225 20 0 BEADLO Cc1ccccc1C(=O)OCc1c[nH+]cn1C ZINC000747783506 585184230 /nfs/dbraw/zinc/18/42/30/585184230.db2.gz RJQQRIZNGAOXFC-UHFFFAOYSA-N 1 2 230.267 2.086 20 0 BEADLO Cn1c[nH+]cc1COC(=O)/C=C\c1ccsc1 ZINC000747780767 585184397 /nfs/dbraw/zinc/18/43/97/585184397.db2.gz IYMRVFCASYVYGU-IHWYPQMZSA-N 1 2 248.307 2.238 20 0 BEADLO Cc1nonc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000748820226 585196770 /nfs/dbraw/zinc/19/67/70/585196770.db2.gz NOYUQNRWNRNSMR-CYBMUJFWSA-N 1 2 229.283 2.325 20 0 BEADLO Cc1nonc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000748820226 585196771 /nfs/dbraw/zinc/19/67/71/585196771.db2.gz NOYUQNRWNRNSMR-CYBMUJFWSA-N 1 2 229.283 2.325 20 0 BEADLO Cc1nonc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000748820228 585196807 /nfs/dbraw/zinc/19/68/07/585196807.db2.gz NOYUQNRWNRNSMR-ZDUSSCGKSA-N 1 2 229.283 2.325 20 0 BEADLO Cc1nonc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000748820228 585196808 /nfs/dbraw/zinc/19/68/08/585196808.db2.gz NOYUQNRWNRNSMR-ZDUSSCGKSA-N 1 2 229.283 2.325 20 0 BEADLO C/C=C(\C)C(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC000750005702 585209388 /nfs/dbraw/zinc/20/93/88/585209388.db2.gz HEJTXHURDPDGSP-RMKNXTFCSA-N 1 2 233.315 2.361 20 0 BEADLO CC(C)=C(C)C(=O)NCc1cn2ccccc2[nH+]1 ZINC000751195907 585225698 /nfs/dbraw/zinc/22/56/98/585225698.db2.gz UZEOGBMWNHPUEQ-UHFFFAOYSA-N 1 2 243.310 2.307 20 0 BEADLO C/C=C(/C)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000751378232 585228530 /nfs/dbraw/zinc/22/85/30/585228530.db2.gz FPAUEQGHLFZALY-OQFOIZHKSA-N 1 2 215.256 2.239 20 0 BEADLO CC1(C)C[C@H]1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000751954269 585239883 /nfs/dbraw/zinc/23/98/83/585239883.db2.gz LOOCBFSFKNTYDK-JTQLQIEISA-N 1 2 229.283 2.319 20 0 BEADLO C[C@@H]1CC/C(=C/C(=O)N(C)Cc2[nH]cc[nH+]2)C1 ZINC000753608001 585263749 /nfs/dbraw/zinc/26/37/49/585263749.db2.gz PBJOLDZSJQRUQH-UBYNWHESSA-N 1 2 233.315 2.115 20 0 BEADLO Fc1cccc(SCC[NH+]2CCOCC2)c1 ZINC000753795392 585269358 /nfs/dbraw/zinc/26/93/58/585269358.db2.gz HSVZWRDABYFDOG-UHFFFAOYSA-N 1 2 241.331 2.250 20 0 BEADLO CC(C)CO[NH+]=C(N)Cc1cccs1 ZINC000754294047 585282270 /nfs/dbraw/zinc/28/22/70/585282270.db2.gz YLDWQAJIDGPCSR-UHFFFAOYSA-N 1 2 212.318 2.445 20 0 BEADLO CCC/C(C)=C/C(=O)OCc1c[nH+]cn1C ZINC000754685255 585289237 /nfs/dbraw/zinc/28/92/37/585289237.db2.gz RKPYBEPPBRBCRU-UXBLZVDNSA-N 1 2 222.288 2.210 20 0 BEADLO CC(C)c1nc(N[C@@H](CO)CC2CC2)cc[nH+]1 ZINC000754787963 585290897 /nfs/dbraw/zinc/29/08/97/585290897.db2.gz YFPYWCWVBZKJFM-LLVKDONJSA-N 1 2 235.331 2.173 20 0 BEADLO C/C(=C/c1ccccc1)C[N@@H+](C)[C@@H]1CCOC1=O ZINC000755192435 585295990 /nfs/dbraw/zinc/29/59/90/585295990.db2.gz BUJIELDZSASPOY-GAJOTYCWSA-N 1 2 245.322 2.337 20 0 BEADLO C/C(=C/c1ccccc1)C[N@H+](C)[C@@H]1CCOC1=O ZINC000755192435 585295991 /nfs/dbraw/zinc/29/59/91/585295991.db2.gz BUJIELDZSASPOY-GAJOTYCWSA-N 1 2 245.322 2.337 20 0 BEADLO Cc1c(Cl)cnn1C[N@H+]1CC=C(C)CC1 ZINC000755766725 585306317 /nfs/dbraw/zinc/30/63/17/585306317.db2.gz PXFXQOMKLOGGTN-UHFFFAOYSA-N 1 2 225.723 2.454 20 0 BEADLO Cc1c(Cl)cnn1C[N@@H+]1CC=C(C)CC1 ZINC000755766725 585306318 /nfs/dbraw/zinc/30/63/18/585306318.db2.gz PXFXQOMKLOGGTN-UHFFFAOYSA-N 1 2 225.723 2.454 20 0 BEADLO Cc1ccc(NC(=O)C2(O)CCCCC2)c(C)[nH+]1 ZINC000755772158 585306645 /nfs/dbraw/zinc/30/66/45/585306645.db2.gz SFNKOSURTQXBHR-UHFFFAOYSA-N 1 2 248.326 2.332 20 0 BEADLO Cc1ccccc1OCC[N@@H+]1CCC(=O)[C@@H](C)C1 ZINC000839567232 585330543 /nfs/dbraw/zinc/33/05/43/585330543.db2.gz PEVAUGJMNUCDLG-ZDUSSCGKSA-N 1 2 247.338 2.285 20 0 BEADLO Cc1ccccc1OCC[N@H+]1CCC(=O)[C@@H](C)C1 ZINC000839567232 585330544 /nfs/dbraw/zinc/33/05/44/585330544.db2.gz PEVAUGJMNUCDLG-ZDUSSCGKSA-N 1 2 247.338 2.285 20 0 BEADLO COCC[N@H+](CCF)Cc1ccc(F)c(F)c1 ZINC000759330738 585368053 /nfs/dbraw/zinc/36/80/53/585368053.db2.gz QPKULGVDNBNIDU-UHFFFAOYSA-N 1 2 247.260 2.383 20 0 BEADLO COCC[N@@H+](CCF)Cc1ccc(F)c(F)c1 ZINC000759330738 585368054 /nfs/dbraw/zinc/36/80/54/585368054.db2.gz QPKULGVDNBNIDU-UHFFFAOYSA-N 1 2 247.260 2.383 20 0 BEADLO Cc1cnc(C[N@@H+]2CC[C@H](C(F)(F)F)C2)o1 ZINC000761048391 585403945 /nfs/dbraw/zinc/40/39/45/585403945.db2.gz XZKZFVCTULTDAC-QMMMGPOBSA-N 1 2 234.221 2.367 20 0 BEADLO Cc1cnc(C[N@H+]2CC[C@H](C(F)(F)F)C2)o1 ZINC000761048391 585403946 /nfs/dbraw/zinc/40/39/46/585403946.db2.gz XZKZFVCTULTDAC-QMMMGPOBSA-N 1 2 234.221 2.367 20 0 BEADLO CCn1ccnc1C[N@@H+]1CC[C@H](C(F)(F)F)C1 ZINC000761052524 585404652 /nfs/dbraw/zinc/40/46/52/585404652.db2.gz GPDRWSOGTDIHLI-VIFPVBQESA-N 1 2 247.264 2.287 20 0 BEADLO CCn1ccnc1C[N@H+]1CC[C@H](C(F)(F)F)C1 ZINC000761052524 585404653 /nfs/dbraw/zinc/40/46/53/585404653.db2.gz GPDRWSOGTDIHLI-VIFPVBQESA-N 1 2 247.264 2.287 20 0 BEADLO C[C@@H](CCO)SCc1cc[nH+]c(N(C)C)c1 ZINC000762482877 585432704 /nfs/dbraw/zinc/43/27/04/585432704.db2.gz ZXFLMUJPJJQKGM-JTQLQIEISA-N 1 2 240.372 2.152 20 0 BEADLO CCC/C(C)=C\C(=O)NCCNc1cccc[nH+]1 ZINC000762796730 585437399 /nfs/dbraw/zinc/43/73/99/585437399.db2.gz OTNSSAWFRJIUAT-QXMHVHEDSA-N 1 2 247.342 2.356 20 0 BEADLO O=C(CCC1CCCC1)OCCn1cc[nH+]c1 ZINC000763114445 585443184 /nfs/dbraw/zinc/44/31/84/585443184.db2.gz HYXNDIOMJNEFTJ-UHFFFAOYSA-N 1 2 236.315 2.397 20 0 BEADLO NC(Cc1cccs1)=[NH+]OCC1CC1 ZINC000763187974 585444247 /nfs/dbraw/zinc/44/42/47/585444247.db2.gz ILPCFEVHKBLLKR-UHFFFAOYSA-N 1 2 210.302 2.199 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)c1ccccc1 ZINC000763286270 585445802 /nfs/dbraw/zinc/44/58/02/585445802.db2.gz BIEDVIXCMUCTLP-UHFFFAOYSA-N 1 2 230.267 2.130 20 0 BEADLO FCC[N@@H+]1CCOC2(C1)CCCCCC2 ZINC000763659471 585451635 /nfs/dbraw/zinc/45/16/35/585451635.db2.gz RYJSJUFDJRTCIV-UHFFFAOYSA-N 1 2 215.312 2.381 20 0 BEADLO FCC[N@H+]1CCOC2(C1)CCCCCC2 ZINC000763659471 585451636 /nfs/dbraw/zinc/45/16/36/585451636.db2.gz RYJSJUFDJRTCIV-UHFFFAOYSA-N 1 2 215.312 2.381 20 0 BEADLO Cc1cccn2cc(CC(=O)OCC3CC3)[nH+]c12 ZINC000763969795 585457984 /nfs/dbraw/zinc/45/79/84/585457984.db2.gz DLSXSNUCWLUZHO-UHFFFAOYSA-N 1 2 244.294 2.138 20 0 BEADLO CCCCCO[NH+]=C(N)COC(C)C ZINC000766742635 585507631 /nfs/dbraw/zinc/50/76/31/585507631.db2.gz VLSOBMXROMTGGD-UHFFFAOYSA-N 1 2 202.298 2.100 20 0 BEADLO C[N@H+](CCOC(C)(C)C)Cn1cc(Cl)cn1 ZINC000767770321 585525735 /nfs/dbraw/zinc/52/57/35/585525735.db2.gz BCFLWEWDSAXWMX-UHFFFAOYSA-N 1 2 245.754 2.241 20 0 BEADLO C[N@@H+](CCOC(C)(C)C)Cn1cc(Cl)cn1 ZINC000767770321 585525736 /nfs/dbraw/zinc/52/57/36/585525736.db2.gz BCFLWEWDSAXWMX-UHFFFAOYSA-N 1 2 245.754 2.241 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OCc1cc2ccccc2o1 ZINC000767826501 585526653 /nfs/dbraw/zinc/52/66/53/585526653.db2.gz FAGORQQVEMDBDQ-SECBINFHSA-N 1 2 248.282 2.466 20 0 BEADLO CC[N@H+](CCc1ccccn1)Cc1cn[nH]c1C ZINC000769039472 585548017 /nfs/dbraw/zinc/54/80/17/585548017.db2.gz WOJWHULMLVZSRF-UHFFFAOYSA-N 1 2 244.342 2.178 20 0 BEADLO CC[N@@H+](CCc1ccccn1)Cc1cn[nH]c1C ZINC000769039472 585548018 /nfs/dbraw/zinc/54/80/18/585548018.db2.gz WOJWHULMLVZSRF-UHFFFAOYSA-N 1 2 244.342 2.178 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)[C@H](F)c1ccccc1 ZINC000769575705 585559470 /nfs/dbraw/zinc/55/94/70/585559470.db2.gz QPQDESAZQVPVBF-GFCCVEGCSA-N 1 2 247.273 2.079 20 0 BEADLO Cc1cc(C)cc(C[N@@H+](C)[C@@H]2CCOC2=O)c1 ZINC000769845222 585565239 /nfs/dbraw/zinc/56/52/39/585565239.db2.gz FRZLZKBJUCQWNU-CYBMUJFWSA-N 1 2 233.311 2.051 20 0 BEADLO Cc1cc(C)cc(C[N@H+](C)[C@@H]2CCOC2=O)c1 ZINC000769845222 585565240 /nfs/dbraw/zinc/56/52/40/585565240.db2.gz FRZLZKBJUCQWNU-CYBMUJFWSA-N 1 2 233.311 2.051 20 0 BEADLO CCc1noc(C)c1[C@@H](C)[NH2+]Cc1ccon1 ZINC000769873450 585565817 /nfs/dbraw/zinc/56/58/17/585565817.db2.gz IBAWOFNMKRYTTE-MRVPVSSYSA-N 1 2 235.287 2.384 20 0 BEADLO Cc1ccc(COC(=O)c2ccccn2)c(C)[nH+]1 ZINC000771883267 585603266 /nfs/dbraw/zinc/60/32/66/585603266.db2.gz YKIKHRKRWRLLMM-UHFFFAOYSA-N 1 2 242.278 2.450 20 0 BEADLO Cc1ccc(COC(=O)[C@@H]2C[C@H]2C)c(C)[nH+]1 ZINC000771889434 585603777 /nfs/dbraw/zinc/60/37/77/585603777.db2.gz JHFMROQCCNOTKZ-PRHODGIISA-N 1 2 219.284 2.398 20 0 BEADLO COc1cccc2cc(C[NH+]3CCOCC3)oc21 ZINC000771928126 585604683 /nfs/dbraw/zinc/60/46/83/585604683.db2.gz PGLRUEYRRZYUDK-UHFFFAOYSA-N 1 2 247.294 2.274 20 0 BEADLO Cc1cccc(C)c1C(=O)OCCn1cc[nH+]c1 ZINC000771979907 585606234 /nfs/dbraw/zinc/60/62/34/585606234.db2.gz SJNPFLOGFUKFQQ-UHFFFAOYSA-N 1 2 244.294 2.357 20 0 BEADLO CCCC1(C(=O)OCCn2cc[nH+]c2)CCC1 ZINC000772005932 585606569 /nfs/dbraw/zinc/60/65/69/585606569.db2.gz XTNPQZSCYNNWCM-UHFFFAOYSA-N 1 2 236.315 2.397 20 0 BEADLO Cc1ccc(COC(=O)C2(O)CCCC2)c(C)[nH+]1 ZINC000772002105 585606687 /nfs/dbraw/zinc/60/66/87/585606687.db2.gz DYXMWXCFBGBJTP-UHFFFAOYSA-N 1 2 249.310 2.047 20 0 BEADLO CCC[C@@H](C(=O)OCCn1cc[nH+]c1)C(C)C ZINC000772039095 585607423 /nfs/dbraw/zinc/60/74/23/585607423.db2.gz TVNYRKSVAMZGJG-GFCCVEGCSA-N 1 2 238.331 2.499 20 0 BEADLO CCOCCC(=O)OCc1ccc(C)[nH+]c1C ZINC000772090635 585608562 /nfs/dbraw/zinc/60/85/62/585608562.db2.gz ZTMCWCWFQMMCPQ-UHFFFAOYSA-N 1 2 237.299 2.168 20 0 BEADLO Cc1ncoc1C(=O)OCc1ccc(C)[nH+]c1C ZINC000772185415 585609823 /nfs/dbraw/zinc/60/98/23/585609823.db2.gz MOQWZUHYWHIWEX-UHFFFAOYSA-N 1 2 246.266 2.352 20 0 BEADLO Cc1ccc(COC(=O)C(C)(C)F)c(C)[nH+]1 ZINC000772238521 585610668 /nfs/dbraw/zinc/61/06/68/585610668.db2.gz VHOVEBKWJNYSBD-UHFFFAOYSA-N 1 2 225.263 2.490 20 0 BEADLO CCN(C[C@@H]1CCOC1)c1cc[nH+]c(C(C)C)n1 ZINC000772899809 585626930 /nfs/dbraw/zinc/62/69/30/585626930.db2.gz ZIRMRFREEAPPDG-LBPRGKRZSA-N 1 2 249.358 2.463 20 0 BEADLO COc1cc[nH+]cc1COC(=O)C(C)=C(C)C ZINC000805486283 585639434 /nfs/dbraw/zinc/63/94/34/585639434.db2.gz USEXKLNOLWWAHS-UHFFFAOYSA-N 1 2 235.283 2.490 20 0 BEADLO CCCC(C)=CC(=O)Nc1cc[nH+]cc1N(C)C ZINC000774094582 585650082 /nfs/dbraw/zinc/65/00/82/585650082.db2.gz HRQXBQSAOMFKPN-PKNBQFBNSA-N 1 2 247.342 2.254 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OCc1cccnc1 ZINC000774775585 585665788 /nfs/dbraw/zinc/66/57/88/585665788.db2.gz SWBOCFKHYKRSAZ-UHFFFAOYSA-N 1 2 241.294 2.437 20 0 BEADLO CCC[C@@H](C)OC(=O)[C@H](C)[NH+]1CCSCC1 ZINC000774986252 585670172 /nfs/dbraw/zinc/67/01/72/585670172.db2.gz GAWXNZSWNGTXJG-MNOVXSKESA-N 1 2 245.388 2.156 20 0 BEADLO CC[C@H]([NH2+]Cc1cccc(F)n1)c1nccn1C ZINC000775413614 585677627 /nfs/dbraw/zinc/67/76/27/585677627.db2.gz HLVFPDXPUQMDNE-NSHDSACASA-N 1 2 248.305 2.195 20 0 BEADLO COc1cc[nH+]cc1COC(=O)CCC(F)F ZINC000805549127 585682802 /nfs/dbraw/zinc/68/28/02/585682802.db2.gz AZFFOYGFTKPPAQ-UHFFFAOYSA-N 1 2 245.225 2.179 20 0 BEADLO CC(C)COC(=O)C[NH+]1CCC(C(F)F)CC1 ZINC000776585881 585701891 /nfs/dbraw/zinc/70/18/91/585701891.db2.gz BZARHLBKHLUAHN-UHFFFAOYSA-N 1 2 249.301 2.163 20 0 BEADLO CC(C)[C@@H](C)N(C)C(=O)c1cccc2[nH+]ccn21 ZINC000776796143 585705823 /nfs/dbraw/zinc/70/58/23/585705823.db2.gz NAJKKZHEUUEIDB-LLVKDONJSA-N 1 2 245.326 2.451 20 0 BEADLO CCCN(CC)C(=O)c1cccc2[nH+]ccn21 ZINC000776805683 585705966 /nfs/dbraw/zinc/70/59/66/585705966.db2.gz GHGQILSBCKHYGJ-UHFFFAOYSA-N 1 2 231.299 2.206 20 0 BEADLO O=C(N[C@@H]1CC=CCC1)c1cccc2[nH+]ccn21 ZINC000776937380 585707063 /nfs/dbraw/zinc/70/70/63/585707063.db2.gz JOPZOQVGBKTKMM-LLVKDONJSA-N 1 2 241.294 2.173 20 0 BEADLO CC(C)=C(C)C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000777454684 585712488 /nfs/dbraw/zinc/71/24/88/585712488.db2.gz OZRXCOXFZDZJQZ-LLVKDONJSA-N 1 2 233.315 2.430 20 0 BEADLO Clc1ccc(C[N@H+]2CC=CCC2)cn1 ZINC000778968333 585743157 /nfs/dbraw/zinc/74/31/57/585743157.db2.gz YZQHSGGQPMIRBX-UHFFFAOYSA-N 1 2 208.692 2.497 20 0 BEADLO Clc1ccc(C[N@@H+]2CC=CCC2)cn1 ZINC000778968333 585743158 /nfs/dbraw/zinc/74/31/58/585743158.db2.gz YZQHSGGQPMIRBX-UHFFFAOYSA-N 1 2 208.692 2.497 20 0 BEADLO Clc1cccc(C[N@H+]2CC=CCC2)n1 ZINC000778967385 585743319 /nfs/dbraw/zinc/74/33/19/585743319.db2.gz CCQMSZIGWYHHIN-UHFFFAOYSA-N 1 2 208.692 2.497 20 0 BEADLO Clc1cccc(C[N@@H+]2CC=CCC2)n1 ZINC000778967385 585743320 /nfs/dbraw/zinc/74/33/20/585743320.db2.gz CCQMSZIGWYHHIN-UHFFFAOYSA-N 1 2 208.692 2.497 20 0 BEADLO CCCCCCC(=O)N[C@@H]1CCn2cc[nH+]c2C1 ZINC000779095796 585745092 /nfs/dbraw/zinc/74/50/92/585745092.db2.gz MVRUAPGCZCXUPQ-GFCCVEGCSA-N 1 2 249.358 2.285 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc(F)nc1 ZINC000779147777 585745925 /nfs/dbraw/zinc/74/59/25/585745925.db2.gz KYMHQQBTNSEEKS-JQWIXIFHSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(F)nc1 ZINC000779147777 585745926 /nfs/dbraw/zinc/74/59/26/585745926.db2.gz KYMHQQBTNSEEKS-JQWIXIFHSA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H](CCO)Nc1ccc([NH+]2CCCC2)cc1 ZINC000779418098 585754395 /nfs/dbraw/zinc/75/43/95/585754395.db2.gz RSMIBDOERKRQHB-GFCCVEGCSA-N 1 2 234.343 2.470 20 0 BEADLO C[C@H](CCO)[NH2+]c1ccc(N2CCCC2)cc1 ZINC000779418098 585754396 /nfs/dbraw/zinc/75/43/96/585754396.db2.gz RSMIBDOERKRQHB-GFCCVEGCSA-N 1 2 234.343 2.470 20 0 BEADLO C[C@@H](CCO)Nc1ccc([NH+]2CCCC2)cc1 ZINC000779418102 585754517 /nfs/dbraw/zinc/75/45/17/585754517.db2.gz RSMIBDOERKRQHB-LBPRGKRZSA-N 1 2 234.343 2.470 20 0 BEADLO C[C@@H](CCO)[NH2+]c1ccc(N2CCCC2)cc1 ZINC000779418102 585754518 /nfs/dbraw/zinc/75/45/18/585754518.db2.gz RSMIBDOERKRQHB-LBPRGKRZSA-N 1 2 234.343 2.470 20 0 BEADLO COc1ccc([NH2+][C@H](C)CCO)c(C)c1 ZINC000779422598 585754738 /nfs/dbraw/zinc/75/47/38/585754738.db2.gz JODBCVAFIHHFRO-SNVBAGLBSA-N 1 2 209.289 2.186 20 0 BEADLO C[C@H](CCO)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000779423595 585754928 /nfs/dbraw/zinc/75/49/28/585754928.db2.gz QQTLIXFZKBBLQD-LLVKDONJSA-N 1 2 231.299 2.055 20 0 BEADLO Cc1cc(N[C@@H](C)CCO)ccc1[NH+](C)C ZINC000779424064 585754954 /nfs/dbraw/zinc/75/49/54/585754954.db2.gz YFGOBLBJJUNZTE-NSHDSACASA-N 1 2 222.332 2.244 20 0 BEADLO Cc1cc([NH2+][C@@H](C)CCO)ccc1N(C)C ZINC000779424064 585754955 /nfs/dbraw/zinc/75/49/55/585754955.db2.gz YFGOBLBJJUNZTE-NSHDSACASA-N 1 2 222.332 2.244 20 0 BEADLO C[C@H](CCO)[NH2+]c1ccc2c(c1)CCCN2C ZINC000779423823 585754998 /nfs/dbraw/zinc/75/49/98/585754998.db2.gz SSVWSUDFEIWKQA-LLVKDONJSA-N 1 2 234.343 2.252 20 0 BEADLO C[C@H](CCO)Nc1ccc2c(c1)CCC[N@H+]2C ZINC000779423823 585754999 /nfs/dbraw/zinc/75/49/99/585754999.db2.gz SSVWSUDFEIWKQA-LLVKDONJSA-N 1 2 234.343 2.252 20 0 BEADLO C[C@H](CCO)Nc1ccc2c(c1)CCC[N@@H+]2C ZINC000779423823 585755000 /nfs/dbraw/zinc/75/50/00/585755000.db2.gz SSVWSUDFEIWKQA-LLVKDONJSA-N 1 2 234.343 2.252 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)OCCn1cc[nH+]c1 ZINC000780242683 585774643 /nfs/dbraw/zinc/77/46/43/585774643.db2.gz OCLQNLPHCCQREM-WDEREUQCSA-N 1 2 224.304 2.109 20 0 BEADLO COC(=O)C(C)(C)[NH2+]C[C@@H]1CCc2ccccc21 ZINC000780294985 585777363 /nfs/dbraw/zinc/77/73/63/585777363.db2.gz YURSUKNBBZBHHI-LBPRGKRZSA-N 1 2 247.338 2.258 20 0 BEADLO CC/C(C)=C(\C)C(=O)NCCCn1cc[nH+]c1 ZINC000780848728 585785295 /nfs/dbraw/zinc/78/52/95/585785295.db2.gz FZLPYGUNXWAHQU-VAWYXSNFSA-N 1 2 235.331 2.136 20 0 BEADLO CC/C(C)=C(/C)C(=O)NC[C@@H](C)Cn1cc[nH+]c1 ZINC000780951378 585786986 /nfs/dbraw/zinc/78/69/86/585786986.db2.gz WUDOYGYNVGERPV-LPJIALBHSA-N 1 2 249.358 2.382 20 0 BEADLO COC(=O)[C@H]1CCCCC[N@@H+]1Cc1ccoc1 ZINC000781526132 585798204 /nfs/dbraw/zinc/79/82/04/585798204.db2.gz CBBNAOBNSFWLIU-GFCCVEGCSA-N 1 2 237.299 2.197 20 0 BEADLO COC(=O)[C@H]1CCCCC[N@H+]1Cc1ccoc1 ZINC000781526132 585798205 /nfs/dbraw/zinc/79/82/05/585798205.db2.gz CBBNAOBNSFWLIU-GFCCVEGCSA-N 1 2 237.299 2.197 20 0 BEADLO C[C@H]1CC[C@@H](NC(=O)c2cccc3[nH+]ccn32)C1 ZINC000781606303 585800348 /nfs/dbraw/zinc/80/03/48/585800348.db2.gz LKVSRIKWWGHPCU-WDEREUQCSA-N 1 2 243.310 2.253 20 0 BEADLO CC[C@H](C)C(=O)OCc1cc[nH+]c(N(C)C)c1 ZINC000782146675 585808388 /nfs/dbraw/zinc/80/83/88/585808388.db2.gz ISWQJTXGZUDLDW-JTQLQIEISA-N 1 2 236.315 2.237 20 0 BEADLO CCc1cc(CNc2cc(CC)[nH+]c(C)n2)n[nH]1 ZINC000782142756 585808411 /nfs/dbraw/zinc/80/84/11/585808411.db2.gz QUOGNNMJHYCREK-UHFFFAOYSA-N 1 2 245.330 2.245 20 0 BEADLO CCCC(C)(C)CC(=O)NC1=[NH+]CCS1 ZINC000782200095 585812174 /nfs/dbraw/zinc/81/21/74/585812174.db2.gz DHTFYMFZEONRPW-UHFFFAOYSA-N 1 2 228.361 2.422 20 0 BEADLO CCOCCO[NH+]=C(N)Cc1ccccc1C ZINC000782337727 585815528 /nfs/dbraw/zinc/81/55/28/585815528.db2.gz SYMNYJWXVBOIHL-UHFFFAOYSA-N 1 2 236.315 2.072 20 0 BEADLO Cc1oncc1C[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000782532188 585819719 /nfs/dbraw/zinc/81/97/19/585819719.db2.gz YZTJILAGOVSHGD-KCJUWKMLSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1oncc1C[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000782532188 585819720 /nfs/dbraw/zinc/81/97/20/585819720.db2.gz YZTJILAGOVSHGD-KCJUWKMLSA-N 1 2 212.268 2.163 20 0 BEADLO O=C(C=C1CCCC1)OCCCn1cc[nH+]c1 ZINC000783098852 585827921 /nfs/dbraw/zinc/82/79/21/585827921.db2.gz QXQWUBSEEWUOFJ-UHFFFAOYSA-N 1 2 234.299 2.317 20 0 BEADLO Cc1nccnc1[C@@H](C)[NH2+]Cc1cccc(F)n1 ZINC000783261310 585832692 /nfs/dbraw/zinc/83/26/92/585832692.db2.gz DTCYSMLDWUEUQK-SNVBAGLBSA-N 1 2 246.289 2.170 20 0 BEADLO C[C@H]1CC[C@@H]1[NH2+]c1ccc(-n2ccnn2)cc1 ZINC000783585014 585837570 /nfs/dbraw/zinc/83/75/70/585837570.db2.gz IHSSGBWBBLEDCI-GWCFXTLKSA-N 1 2 228.299 2.478 20 0 BEADLO O=C(CCC1CC1)OCCCn1cc[nH+]c1 ZINC000783686500 585840141 /nfs/dbraw/zinc/84/01/41/585840141.db2.gz VIWVOCREOJKRMH-UHFFFAOYSA-N 1 2 222.288 2.007 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc(F)nc2)[C@H](C)[C@H](C)O1 ZINC000783737985 585841687 /nfs/dbraw/zinc/84/16/87/585841687.db2.gz RNABITIHBITZLR-MXWKQRLJSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc(F)nc2)[C@H](C)[C@H](C)O1 ZINC000783737985 585841688 /nfs/dbraw/zinc/84/16/88/585841688.db2.gz RNABITIHBITZLR-MXWKQRLJSA-N 1 2 238.306 2.218 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)[C@@H]1CC12CCCC2 ZINC000783982399 585846587 /nfs/dbraw/zinc/84/65/87/585846587.db2.gz CXGOJZGMIKSYPB-LBPRGKRZSA-N 1 2 248.326 2.397 20 0 BEADLO Cc1ccc(COC(=O)[C@@H]2CO[C@@H](C)C2)c(C)[nH+]1 ZINC000784271939 585853996 /nfs/dbraw/zinc/85/39/96/585853996.db2.gz OHORXPJNMGJVRT-GWCFXTLKSA-N 1 2 249.310 2.167 20 0 BEADLO Cc1nc(F)ccc1CNc1cc[nH+]cc1F ZINC000784303556 585855296 /nfs/dbraw/zinc/85/52/96/585855296.db2.gz BNOKAGFCTRHWOJ-UHFFFAOYSA-N 1 2 235.237 2.097 20 0 BEADLO CC(C)[C@@H](F)C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000784459520 585860741 /nfs/dbraw/zinc/86/07/41/585860741.db2.gz KBKYJGUDBIISDS-VHSXEESVSA-N 1 2 239.294 2.067 20 0 BEADLO CC(C)[C@H]1C[C@H]1C(=O)OCCCn1cc[nH+]c1 ZINC000784785928 585866277 /nfs/dbraw/zinc/86/62/77/585866277.db2.gz HGSZKSFORHLSEM-VXGBXAGGSA-N 1 2 236.315 2.109 20 0 BEADLO CCC/C=C\C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000785421864 585873229 /nfs/dbraw/zinc/87/32/29/585873229.db2.gz VQZPZDVVMQBOBV-JYESYGNLSA-N 1 2 221.304 2.333 20 0 BEADLO CCCC=CC(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000785421864 585873230 /nfs/dbraw/zinc/87/32/30/585873230.db2.gz VQZPZDVVMQBOBV-JYESYGNLSA-N 1 2 221.304 2.333 20 0 BEADLO CC[N@@H+]1CCCC[C@H]1C(=O)O[C@@H](C)C(F)F ZINC000786517861 585893907 /nfs/dbraw/zinc/89/39/07/585893907.db2.gz YNULSEYHNNCUEY-IUCAKERBSA-N 1 2 235.274 2.058 20 0 BEADLO CC[N@H+]1CCCC[C@H]1C(=O)O[C@@H](C)C(F)F ZINC000786517861 585893908 /nfs/dbraw/zinc/89/39/08/585893908.db2.gz YNULSEYHNNCUEY-IUCAKERBSA-N 1 2 235.274 2.058 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccnc(F)c2)[C@H](C)[C@H](C)O1 ZINC000859270278 589026657 /nfs/dbraw/zinc/02/66/57/589026657.db2.gz NYSDYSNANDFHFN-MXWKQRLJSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccnc(F)c2)[C@H](C)[C@H](C)O1 ZINC000859270278 589026658 /nfs/dbraw/zinc/02/66/58/589026658.db2.gz NYSDYSNANDFHFN-MXWKQRLJSA-N 1 2 238.306 2.218 20 0 BEADLO c1cc(C[NH2+]Cc2cc3ccccc3[nH]2)no1 ZINC000788521360 585926342 /nfs/dbraw/zinc/92/63/42/585926342.db2.gz PIQHDRPLDUFMPZ-UHFFFAOYSA-N 1 2 227.267 2.446 20 0 BEADLO c1c(-c2ccc3c(c2)OCO3)[nH+]c2n1CCC2 ZINC000788866226 585931755 /nfs/dbraw/zinc/93/17/55/585931755.db2.gz DVDJUGXQHFTHNO-UHFFFAOYSA-N 1 2 228.251 2.225 20 0 BEADLO CCCCCC(=O)OCCCc1[nH+]ccn1C ZINC000789791531 585950303 /nfs/dbraw/zinc/95/03/03/585950303.db2.gz LMCUPDNBKKEBAV-UHFFFAOYSA-N 1 2 238.331 2.476 20 0 BEADLO Cc1nonc1C[N@H+]1CC[C@@H](C(F)(F)F)[C@H]1C ZINC000791583184 585984842 /nfs/dbraw/zinc/98/48/42/585984842.db2.gz MRCFNHIMXAPFLY-HTQZYQBOSA-N 1 2 249.236 2.151 20 0 BEADLO Cc1nonc1C[N@@H+]1CC[C@@H](C(F)(F)F)[C@H]1C ZINC000791583184 585984843 /nfs/dbraw/zinc/98/48/43/585984843.db2.gz MRCFNHIMXAPFLY-HTQZYQBOSA-N 1 2 249.236 2.151 20 0 BEADLO CCC/C(C)=C/C(=O)OCc1cc[nH+]c(N)c1 ZINC000791778033 585987680 /nfs/dbraw/zinc/98/76/80/585987680.db2.gz LJLOGZJJVAPEAG-JXMROGBWSA-N 1 2 234.299 2.453 20 0 BEADLO C[C@@H]1C[C@H](C)N1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000791821595 585988751 /nfs/dbraw/zinc/98/87/51/585988751.db2.gz HEWPDFHJXOJZBV-AOOOYVTPSA-N 1 2 244.298 2.349 20 0 BEADLO CC(C)(C)/C=C\C(=O)OCc1cc[nH+]c(N)c1 ZINC000791900322 585991041 /nfs/dbraw/zinc/99/10/41/585991041.db2.gz YNHGOBRZHACWHV-XQRVVYSFSA-N 1 2 234.299 2.309 20 0 BEADLO C[C@@H](C(=O)OCc1cc[nH+]c(N)c1)C(C)(C)C ZINC000791910220 585991216 /nfs/dbraw/zinc/99/12/16/585991216.db2.gz AGQUWUNAXVXQPV-VIFPVBQESA-N 1 2 236.315 2.389 20 0 BEADLO C[C@H]1CC/C(=C/C(=O)OCc2cc[nH+]c(N)c2)C1 ZINC000791994933 585992839 /nfs/dbraw/zinc/99/28/39/585992839.db2.gz JXWLIPQBJQLYTB-DFYQSJSGSA-N 1 2 246.310 2.453 20 0 BEADLO CCCC1(C(=O)OCc2cc[nH+]c(N)c2)CC1 ZINC000792020621 585993789 /nfs/dbraw/zinc/99/37/89/585993789.db2.gz MRZFPEDMPIFNFB-UHFFFAOYSA-N 1 2 234.299 2.287 20 0 BEADLO Cc1cccc2c1CC[N@H+](Cc1ncccn1)C2 ZINC000792217831 585998085 /nfs/dbraw/zinc/99/80/85/585998085.db2.gz QYBJEHOAZAJJGZ-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1cccc2c1CC[N@@H+](Cc1ncccn1)C2 ZINC000792217831 585998086 /nfs/dbraw/zinc/99/80/86/585998086.db2.gz QYBJEHOAZAJJGZ-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO CCC(C)(CC)C(=O)OCCc1c[nH+]cn1C ZINC000793254659 586015129 /nfs/dbraw/zinc/01/51/29/586015129.db2.gz DLEWPRIBXJRCIF-UHFFFAOYSA-N 1 2 238.331 2.332 20 0 BEADLO Cc1cc(C)c(C(=O)OCCc2c[nH+]cn2C)o1 ZINC000793258665 586015478 /nfs/dbraw/zinc/01/54/78/586015478.db2.gz OAFAYECTLPBJMO-UHFFFAOYSA-N 1 2 248.282 2.029 20 0 BEADLO Cc1cccn2cc(COC(=O)[C@@H]3C[C@@H]3C)[nH+]c12 ZINC000794637365 586045995 /nfs/dbraw/zinc/04/59/95/586045995.db2.gz AWSYOKNKYXQFDO-CMPLNLGQSA-N 1 2 244.294 2.342 20 0 BEADLO CC[C@H]([NH2+]Cc1cccnc1F)c1nccn1C ZINC000794835337 586050105 /nfs/dbraw/zinc/05/01/05/586050105.db2.gz LFBQGPLMTHUJGZ-NSHDSACASA-N 1 2 248.305 2.195 20 0 BEADLO O=C(CCC(F)F)Nc1cccc2[nH+]ccn21 ZINC000795127944 586069549 /nfs/dbraw/zinc/06/95/49/586069549.db2.gz UFCSJFNDPNADAZ-UHFFFAOYSA-N 1 2 239.225 2.318 20 0 BEADLO CCCC(=O)OCc1cn2cccc(C)c2[nH+]1 ZINC000795822299 586092567 /nfs/dbraw/zinc/09/25/67/586092567.db2.gz HORZJPCIGXEANN-UHFFFAOYSA-N 1 2 232.283 2.486 20 0 BEADLO Cc1ccc(N2CC[N@H+](CC3CC3)CC2=O)cc1 ZINC000796089362 586097457 /nfs/dbraw/zinc/09/74/57/586097457.db2.gz RXRHKBAPIICLJQ-UHFFFAOYSA-N 1 2 244.338 2.054 20 0 BEADLO Cc1ccc(N2CC[N@@H+](CC3CC3)CC2=O)cc1 ZINC000796089362 586097458 /nfs/dbraw/zinc/09/74/58/586097458.db2.gz RXRHKBAPIICLJQ-UHFFFAOYSA-N 1 2 244.338 2.054 20 0 BEADLO c1nc(C[N@@H+]2CC[C@H]2c2ccccc2)c[nH]1 ZINC000796442849 586103178 /nfs/dbraw/zinc/10/31/78/586103178.db2.gz PUPPBIDEZYMSEI-ZDUSSCGKSA-N 1 2 213.284 2.357 20 0 BEADLO c1nc(C[N@H+]2CC[C@H]2c2ccccc2)c[nH]1 ZINC000796442849 586103179 /nfs/dbraw/zinc/10/31/79/586103179.db2.gz PUPPBIDEZYMSEI-ZDUSSCGKSA-N 1 2 213.284 2.357 20 0 BEADLO c1ncc(C[N@@H+]2CC[C@H]2c2ccccc2)[nH]1 ZINC000796442849 586103180 /nfs/dbraw/zinc/10/31/80/586103180.db2.gz PUPPBIDEZYMSEI-ZDUSSCGKSA-N 1 2 213.284 2.357 20 0 BEADLO c1ncc(C[N@H+]2CC[C@H]2c2ccccc2)[nH]1 ZINC000796442849 586103181 /nfs/dbraw/zinc/10/31/81/586103181.db2.gz PUPPBIDEZYMSEI-ZDUSSCGKSA-N 1 2 213.284 2.357 20 0 BEADLO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1cnc[nH]1 ZINC000796443550 586103460 /nfs/dbraw/zinc/10/34/60/586103460.db2.gz RPMZOBXLSWJINS-ZDUSSCGKSA-N 1 2 230.315 2.085 20 0 BEADLO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1cnc[nH]1 ZINC000796443550 586103461 /nfs/dbraw/zinc/10/34/61/586103461.db2.gz RPMZOBXLSWJINS-ZDUSSCGKSA-N 1 2 230.315 2.085 20 0 BEADLO CCCCCC[N@@H+]1C[C@@H](F)C[C@H]1C(=O)OC ZINC000796512094 586105859 /nfs/dbraw/zinc/10/58/59/586105859.db2.gz OQUAUKQYQLZGHN-QWRGUYRKSA-N 1 2 231.311 2.152 20 0 BEADLO CCCCCC[N@H+]1C[C@@H](F)C[C@H]1C(=O)OC ZINC000796512094 586105860 /nfs/dbraw/zinc/10/58/60/586105860.db2.gz OQUAUKQYQLZGHN-QWRGUYRKSA-N 1 2 231.311 2.152 20 0 BEADLO Cc1ccnc(C[NH+]2CCC(F)(F)CC2)n1 ZINC000796541156 586106479 /nfs/dbraw/zinc/10/64/79/586106479.db2.gz FQRVVVCTHZLFLI-UHFFFAOYSA-N 1 2 227.258 2.016 20 0 BEADLO Cc1cc(C)c(CNC(=S)NC2(C)CC2)c[nH+]1 ZINC000840826517 586130737 /nfs/dbraw/zinc/13/07/37/586130737.db2.gz MZVDINZVPBQMCG-UHFFFAOYSA-N 1 2 249.383 2.215 20 0 BEADLO Cc1cc(N2CC[C@@H](c3ccccn3)C2)nc[nH+]1 ZINC000798414797 586143627 /nfs/dbraw/zinc/14/36/27/586143627.db2.gz BHOMZFZKMKMNHP-GFCCVEGCSA-N 1 2 240.310 2.174 20 0 BEADLO c1ccc([C@@H]2CCN(c3cccc[nH+]3)C2)nc1 ZINC000798415589 586143751 /nfs/dbraw/zinc/14/37/51/586143751.db2.gz GTCZBRHWUSUCIY-GFCCVEGCSA-N 1 2 225.295 2.471 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1cnc(Cl)cn1 ZINC000799167985 586164032 /nfs/dbraw/zinc/16/40/32/586164032.db2.gz KDPSXUDFLLYQRN-HTQZYQBOSA-N 1 2 211.696 2.113 20 0 BEADLO CC(C)(C)OC(=O)[C@]1(C)CCC[N@@H+]1CCF ZINC000859381488 589034765 /nfs/dbraw/zinc/03/47/65/589034765.db2.gz QYRHYZRXNHBPSU-LBPRGKRZSA-N 1 2 231.311 2.152 20 0 BEADLO CC(C)(C)OC(=O)[C@]1(C)CCC[N@H+]1CCF ZINC000859381488 589034766 /nfs/dbraw/zinc/03/47/66/589034766.db2.gz QYRHYZRXNHBPSU-LBPRGKRZSA-N 1 2 231.311 2.152 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2cccnc2F)nn1C ZINC000800490367 586222546 /nfs/dbraw/zinc/22/25/46/586222546.db2.gz DNEBSUOWPOMILK-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@H](C)c2ccnn2C)no1 ZINC000800502993 586223729 /nfs/dbraw/zinc/22/37/29/586223729.db2.gz KCBLZNXRRSRQGP-VHSXEESVSA-N 1 2 234.303 2.128 20 0 BEADLO Cc1ccccc1C[N@@H+]1CCO[C@H](C(F)F)C1 ZINC000801566561 586264333 /nfs/dbraw/zinc/26/43/33/586264333.db2.gz PGZMMXKPBZCVCO-LBPRGKRZSA-N 1 2 241.281 2.461 20 0 BEADLO Cc1ccccc1C[N@H+]1CCO[C@H](C(F)F)C1 ZINC000801566561 586264335 /nfs/dbraw/zinc/26/43/35/586264335.db2.gz PGZMMXKPBZCVCO-LBPRGKRZSA-N 1 2 241.281 2.461 20 0 BEADLO Cc1ccc(OCC[N@@H+]2CCC(=O)[C@@H](C)C2)cc1 ZINC000801944391 586281642 /nfs/dbraw/zinc/28/16/42/586281642.db2.gz USJYQQVASLECDE-ZDUSSCGKSA-N 1 2 247.338 2.285 20 0 BEADLO Cc1ccc(OCC[N@H+]2CCC(=O)[C@@H](C)C2)cc1 ZINC000801944391 586281643 /nfs/dbraw/zinc/28/16/43/586281643.db2.gz USJYQQVASLECDE-ZDUSSCGKSA-N 1 2 247.338 2.285 20 0 BEADLO Cc1ccc(OCC[N@@H+]2CCC(=O)[C@H](C)C2)cc1 ZINC000801944390 586281944 /nfs/dbraw/zinc/28/19/44/586281944.db2.gz USJYQQVASLECDE-CYBMUJFWSA-N 1 2 247.338 2.285 20 0 BEADLO Cc1ccc(OCC[N@H+]2CCC(=O)[C@H](C)C2)cc1 ZINC000801944390 586281947 /nfs/dbraw/zinc/28/19/47/586281947.db2.gz USJYQQVASLECDE-CYBMUJFWSA-N 1 2 247.338 2.285 20 0 BEADLO CNc1[nH+]c(C)ccc1C(=O)OC[C@@H]1C[C@@H]1C ZINC000859501292 589040920 /nfs/dbraw/zinc/04/09/20/589040920.db2.gz KIUWDYDQCJENNV-WPRPVWTQSA-N 1 2 234.299 2.245 20 0 BEADLO CCCC1(C(=O)O[C@@H]2CC[N@H+](CCF)C2)CC1 ZINC000802232737 586297265 /nfs/dbraw/zinc/29/72/65/586297265.db2.gz TZTYKHVIYATYMS-LLVKDONJSA-N 1 2 243.322 2.154 20 0 BEADLO CCCC1(C(=O)O[C@@H]2CC[N@@H+](CCF)C2)CC1 ZINC000802232737 586297266 /nfs/dbraw/zinc/29/72/66/586297266.db2.gz TZTYKHVIYATYMS-LLVKDONJSA-N 1 2 243.322 2.154 20 0 BEADLO CCCC[C@H](C)C(=O)O[C@@H]1CC[N@H+](CCF)C1 ZINC000802232879 586297908 /nfs/dbraw/zinc/29/79/08/586297908.db2.gz LMWDUXVGGYEPEI-NWDGAFQWSA-N 1 2 245.338 2.400 20 0 BEADLO CCCC[C@H](C)C(=O)O[C@@H]1CC[N@@H+](CCF)C1 ZINC000802232879 586297918 /nfs/dbraw/zinc/29/79/18/586297918.db2.gz LMWDUXVGGYEPEI-NWDGAFQWSA-N 1 2 245.338 2.400 20 0 BEADLO CCC(C)(C)C(=O)O[C@H]1CC[N@H+](CCF)C1 ZINC000802239699 586298461 /nfs/dbraw/zinc/29/84/61/586298461.db2.gz XQDXFXKSMZIQEI-JTQLQIEISA-N 1 2 231.311 2.010 20 0 BEADLO CCC(C)(C)C(=O)O[C@H]1CC[N@@H+](CCF)C1 ZINC000802239699 586298464 /nfs/dbraw/zinc/29/84/64/586298464.db2.gz XQDXFXKSMZIQEI-JTQLQIEISA-N 1 2 231.311 2.010 20 0 BEADLO CC1(C)CC(C(=O)OCc2cc[nH+]c(N)c2)C1 ZINC000803756983 586372796 /nfs/dbraw/zinc/37/27/96/586372796.db2.gz ZWWNNFYZOHWMLV-UHFFFAOYSA-N 1 2 234.299 2.143 20 0 BEADLO CCc1[nH]ccc1C(=O)OCCCn1cc[nH+]c1 ZINC000803777892 586374050 /nfs/dbraw/zinc/37/40/50/586374050.db2.gz ZFPGIXGPQAXWKY-UHFFFAOYSA-N 1 2 247.298 2.021 20 0 BEADLO C[C@@H]1c2ccccc2C[N@H+]1CN1CC[C@H](C)C1=O ZINC000840020364 586382337 /nfs/dbraw/zinc/38/23/37/586382337.db2.gz ZSUILELLHMFBTE-NWDGAFQWSA-N 1 2 244.338 2.389 20 0 BEADLO C[C@@H]1c2ccccc2C[N@@H+]1CN1CC[C@H](C)C1=O ZINC000840020364 586382338 /nfs/dbraw/zinc/38/23/38/586382338.db2.gz ZSUILELLHMFBTE-NWDGAFQWSA-N 1 2 244.338 2.389 20 0 BEADLO CCC/C(C)=C/C(=O)N[C@H]1CCc2c[nH+]cn2C1 ZINC000804335653 586390960 /nfs/dbraw/zinc/39/09/60/586390960.db2.gz CSZLQOYHTUMSQG-VNKGSWCUSA-N 1 2 247.342 2.061 20 0 BEADLO O=C(C[NH+](C1CC1)C1CC1)OCc1ccccc1 ZINC000859622812 589049663 /nfs/dbraw/zinc/04/96/63/589049663.db2.gz FOVJHJSDTWMFRG-UHFFFAOYSA-N 1 2 245.322 2.357 20 0 BEADLO C[C@@H](CNC(=O)CCc1[nH]cc[nH+]1)C(C)(C)C ZINC000806865803 586420084 /nfs/dbraw/zinc/42/00/84/586420084.db2.gz DQQZPLHLMDFYBM-JTQLQIEISA-N 1 2 237.347 2.141 20 0 BEADLO CC[NH2+]Cc1noc([C@H](C)c2ccccc2F)n1 ZINC000843145000 586436816 /nfs/dbraw/zinc/43/68/16/586436816.db2.gz REUKQIFPXJLLNG-SECBINFHSA-N 1 2 249.289 2.470 20 0 BEADLO CC[NH2+]Cc1noc(/C=C/c2ccsc2)n1 ZINC000843145101 586444181 /nfs/dbraw/zinc/44/41/81/586444181.db2.gz CVQQTVQQDDDMMA-ONEGZZNKSA-N 1 2 235.312 2.411 20 0 BEADLO CC[NH2+]Cc1noc(Cc2ccc(C)s2)n1 ZINC000843145596 586445754 /nfs/dbraw/zinc/44/57/54/586445754.db2.gz OQUZFDOZLMWWPF-UHFFFAOYSA-N 1 2 237.328 2.140 20 0 BEADLO Cc1cc(N[C@@H](C)[C@H](O)c2ccccc2)nc[nH+]1 ZINC000808130751 586464372 /nfs/dbraw/zinc/46/43/72/586464372.db2.gz QJDPZJOKNSDVRK-FZMZJTMJSA-N 1 2 243.310 2.319 20 0 BEADLO CC1(C)CCC(=O)N1C[NH+]1Cc2ccccc2C1 ZINC000808155262 586465517 /nfs/dbraw/zinc/46/55/17/586465517.db2.gz KGLMQHJDIOZAKH-UHFFFAOYSA-N 1 2 244.338 2.361 20 0 BEADLO C[C@H]1CC[N@H+](CN2C(=O)CCC2(C)C)C[C@H]1F ZINC000808177593 586467038 /nfs/dbraw/zinc/46/70/38/586467038.db2.gz VFZMKCLOXPWNOF-WDEREUQCSA-N 1 2 242.338 2.025 20 0 BEADLO C[C@H]1CC[N@@H+](CN2C(=O)CCC2(C)C)C[C@H]1F ZINC000808177593 586467041 /nfs/dbraw/zinc/46/70/41/586467041.db2.gz VFZMKCLOXPWNOF-WDEREUQCSA-N 1 2 242.338 2.025 20 0 BEADLO COc1cc(C)ccc1C[NH2+]Cc1cn(C)cn1 ZINC000808395366 586470923 /nfs/dbraw/zinc/47/09/23/586470923.db2.gz JTHJYTHZODBBPK-UHFFFAOYSA-N 1 2 245.326 2.027 20 0 BEADLO Cc1cc2c(cc1NCc1cn(C)c[nH+]1)OCO2 ZINC000808403612 586471736 /nfs/dbraw/zinc/47/17/36/586471736.db2.gz RJRHGJYPIUWBKT-UHFFFAOYSA-N 1 2 245.282 2.069 20 0 BEADLO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1cn(C)cn1 ZINC000808444765 586472618 /nfs/dbraw/zinc/47/26/18/586472618.db2.gz PQHHETLTHAMJHH-IINYFYTJSA-N 1 2 243.310 2.032 20 0 BEADLO c1coc([C@@H]2[N@H+](Cn3cnnc3)CC23CCC3)c1 ZINC000840138780 586472989 /nfs/dbraw/zinc/47/29/89/586472989.db2.gz GPOZVEQUGAMWTB-LBPRGKRZSA-N 1 2 244.298 2.056 20 0 BEADLO c1coc([C@@H]2[N@@H+](Cn3cnnc3)CC23CCC3)c1 ZINC000840138780 586472990 /nfs/dbraw/zinc/47/29/90/586472990.db2.gz GPOZVEQUGAMWTB-LBPRGKRZSA-N 1 2 244.298 2.056 20 0 BEADLO CC(C)n1cc(C[NH+]2CCC(F)(F)CC2)nn1 ZINC000809658130 586511100 /nfs/dbraw/zinc/51/11/00/586511100.db2.gz FDNHJRQQAMERQS-UHFFFAOYSA-N 1 2 244.289 2.090 20 0 BEADLO C[C@H]1CCOCC[N@@H+]1Cc1coc(C2CC2)n1 ZINC000809764932 586518425 /nfs/dbraw/zinc/51/84/25/586518425.db2.gz JPSRDYFOWRIZMQ-JTQLQIEISA-N 1 2 236.315 2.163 20 0 BEADLO C[C@H]1CCOCC[N@H+]1Cc1coc(C2CC2)n1 ZINC000809764932 586518427 /nfs/dbraw/zinc/51/84/27/586518427.db2.gz JPSRDYFOWRIZMQ-JTQLQIEISA-N 1 2 236.315 2.163 20 0 BEADLO CC(C)[N@H+](Cc1cnn(C)n1)Cc1ccccc1 ZINC000809936166 586524357 /nfs/dbraw/zinc/52/43/57/586524357.db2.gz XWSBPZUXTKCAPX-UHFFFAOYSA-N 1 2 244.342 2.226 20 0 BEADLO CC(C)[N@@H+](Cc1cnn(C)n1)Cc1ccccc1 ZINC000809936166 586524358 /nfs/dbraw/zinc/52/43/58/586524358.db2.gz XWSBPZUXTKCAPX-UHFFFAOYSA-N 1 2 244.342 2.226 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCC[C@@H]2c2cc[nH]n2)o1 ZINC000809996280 586530188 /nfs/dbraw/zinc/53/01/88/586530188.db2.gz WFCLAMAWUBDOSE-GFCCVEGCSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCC[C@@H]2c2cc[nH]n2)o1 ZINC000809996280 586530189 /nfs/dbraw/zinc/53/01/89/586530189.db2.gz WFCLAMAWUBDOSE-GFCCVEGCSA-N 1 2 246.314 2.352 20 0 BEADLO CC(C)CONC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000810231806 586537421 /nfs/dbraw/zinc/53/74/21/586537421.db2.gz OHWSPXUCJHFJBR-UHFFFAOYSA-N 1 2 248.286 2.043 20 0 BEADLO C/C(=C/C(=O)NCc1c[nH+]cn1C)C(C)(C)C ZINC000811588383 586561846 /nfs/dbraw/zinc/56/18/46/586561846.db2.gz ISUOCZWDAXCXSE-POHAHGRESA-N 1 2 235.331 2.029 20 0 BEADLO C[C@H]1C[N@H+](Cn2cc[nH]c2=S)CCC1(F)F ZINC000811780154 586566564 /nfs/dbraw/zinc/56/65/64/586566564.db2.gz VQHXJTMWPLFZRU-QMMMGPOBSA-N 1 2 247.314 2.106 20 0 BEADLO C[C@H]1C[N@@H+](Cn2cc[nH]c2=S)CCC1(F)F ZINC000811780154 586566565 /nfs/dbraw/zinc/56/65/65/586566565.db2.gz VQHXJTMWPLFZRU-QMMMGPOBSA-N 1 2 247.314 2.106 20 0 BEADLO O=C(C(F)=C1CCCC1)N1CCn2c[nH+]cc2C1 ZINC000812292452 586572716 /nfs/dbraw/zinc/57/27/16/586572716.db2.gz INMIELTVTCAYQK-UHFFFAOYSA-N 1 2 249.289 2.023 20 0 BEADLO C[C@]1([NH2+]C[C@@H]2C[C@H]2c2ccccc2)CCOC1=O ZINC000812844644 586587864 /nfs/dbraw/zinc/58/78/64/586587864.db2.gz LHGMMPGMSNQBRF-YDHLFZDLSA-N 1 2 245.322 2.085 20 0 BEADLO C1=CO[C@H](CNc2cc(NC3CC3)nc[nH+]2)CC1 ZINC000840292491 586605009 /nfs/dbraw/zinc/60/50/09/586605009.db2.gz XYAUVEBSZGBEQS-NSHDSACASA-N 1 2 246.314 2.156 20 0 BEADLO C1=CO[C@H](CNc2cc(NC3CC3)[nH+]cn2)CC1 ZINC000840292491 586605010 /nfs/dbraw/zinc/60/50/10/586605010.db2.gz XYAUVEBSZGBEQS-NSHDSACASA-N 1 2 246.314 2.156 20 0 BEADLO CC(C)(C)C(C)(C)C(=O)OCCn1cc[nH+]c1 ZINC000814489684 586623049 /nfs/dbraw/zinc/62/30/49/586623049.db2.gz QZCZFMXUDWRRPO-UHFFFAOYSA-N 1 2 238.331 2.499 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)OC[C@@H]3C[C@@H]3C)ccn12 ZINC000859734465 589057682 /nfs/dbraw/zinc/05/76/82/589057682.db2.gz CCKPGNIXJKKZLW-CABZTGNLSA-N 1 2 244.294 2.456 20 0 BEADLO CC(C)(CC(=O)NC1=[NH+]CCS1)C1CC1 ZINC000814800240 586635412 /nfs/dbraw/zinc/63/54/12/586635412.db2.gz OOQPXFWUNWPRGA-UHFFFAOYSA-N 1 2 226.345 2.032 20 0 BEADLO CC(C)c1nc(NCc2ncccn2)cc[nH+]1 ZINC000840326476 586637505 /nfs/dbraw/zinc/63/75/05/586637505.db2.gz UZWKYNJPFFEMRW-UHFFFAOYSA-N 1 2 229.287 2.002 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nnc(C(C)(C)C)o2)[C@H]1C ZINC000815161996 586671430 /nfs/dbraw/zinc/67/14/30/586671430.db2.gz FYUPPFBWLPEFTG-BDAKNGLRSA-N 1 2 223.320 2.207 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nnc(C(C)(C)C)o2)[C@H]1C ZINC000815161996 586671431 /nfs/dbraw/zinc/67/14/31/586671431.db2.gz FYUPPFBWLPEFTG-BDAKNGLRSA-N 1 2 223.320 2.207 20 0 BEADLO CC(C)(CC(=O)OCCn1cc[nH+]c1)C1CC1 ZINC000815468720 586684990 /nfs/dbraw/zinc/68/49/90/586684990.db2.gz HYWWJBLSMVEOIU-UHFFFAOYSA-N 1 2 236.315 2.253 20 0 BEADLO Cc1cocc1C(=O)OCCCn1cc[nH+]c1 ZINC000859781380 589060931 /nfs/dbraw/zinc/06/09/31/589060931.db2.gz HICXAGQVNZATFL-UHFFFAOYSA-N 1 2 234.255 2.032 20 0 BEADLO C[C@H](CC(=O)OCCn1cc[nH+]c1)c1ccco1 ZINC000859813637 589063046 /nfs/dbraw/zinc/06/30/46/589063046.db2.gz NRRTVBLAMFFMDH-LLVKDONJSA-N 1 2 248.282 2.213 20 0 BEADLO C[C@@H](NC(=O)/C=C1\CC[C@@H](C)C1)c1[nH]cc[nH+]1 ZINC000816719176 586759973 /nfs/dbraw/zinc/75/99/73/586759973.db2.gz RNCUQQQGLZHNIJ-DBUSQJFRSA-N 1 2 233.315 2.333 20 0 BEADLO C[C@@H](NC(=O)C=C1CC[C@@H](C)C1)c1[nH]cc[nH+]1 ZINC000816719176 586759974 /nfs/dbraw/zinc/75/99/74/586759974.db2.gz RNCUQQQGLZHNIJ-DBUSQJFRSA-N 1 2 233.315 2.333 20 0 BEADLO CCc1cccc(NC(=O)Cc2[nH]cc[nH+]2)c1 ZINC000816811684 586765542 /nfs/dbraw/zinc/76/55/42/586765542.db2.gz LRISLFIPALECJK-UHFFFAOYSA-N 1 2 229.283 2.153 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)Nc1ccc2c(c1)CCC2 ZINC000816832783 586767081 /nfs/dbraw/zinc/76/70/81/586767081.db2.gz MZQWENGSKSBHIV-UHFFFAOYSA-N 1 2 241.294 2.080 20 0 BEADLO CCc1ccccc1NC(=O)Cc1[nH]cc[nH+]1 ZINC000816840864 586767906 /nfs/dbraw/zinc/76/79/06/586767906.db2.gz GOXAXPWBKACRIG-UHFFFAOYSA-N 1 2 229.283 2.153 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)N[C@H]1C[C@@H]1C1CCCCC1 ZINC000816936054 586771780 /nfs/dbraw/zinc/77/17/80/586771780.db2.gz COWYKKHMCMPXTA-NEPJUHHUSA-N 1 2 247.342 2.037 20 0 BEADLO FCC[NH+]1CCN(c2cccc3[nH]ccc32)CC1 ZINC000859833788 589064846 /nfs/dbraw/zinc/06/48/46/589064846.db2.gz PTBDUIOALCZPIU-UHFFFAOYSA-N 1 2 247.317 2.259 20 0 BEADLO CCCOC(=O)[C@H](C)[N@@H+]1CCC(F)(F)C[C@H]1C ZINC000859836794 589064882 /nfs/dbraw/zinc/06/48/82/589064882.db2.gz ZLBFGDWMXSWCNZ-ZJUUUORDSA-N 1 2 249.301 2.448 20 0 BEADLO CCCOC(=O)[C@H](C)[N@H+]1CCC(F)(F)C[C@H]1C ZINC000859836794 589064884 /nfs/dbraw/zinc/06/48/84/589064884.db2.gz ZLBFGDWMXSWCNZ-ZJUUUORDSA-N 1 2 249.301 2.448 20 0 BEADLO CC[C@@H](C)CONC(=O)c1cccc2[nH+]ccn21 ZINC000816980538 586778008 /nfs/dbraw/zinc/77/80/08/586778008.db2.gz NJOZVAIUMDSFAE-SNVBAGLBSA-N 1 2 247.298 2.042 20 0 BEADLO CCC1(CC)CCN(C[N@@H+]2CC[C@H](F)C2)C1=O ZINC000817362364 586799191 /nfs/dbraw/zinc/79/91/91/586799191.db2.gz PFZXYJMDHAZFNP-NSHDSACASA-N 1 2 242.338 2.026 20 0 BEADLO CCC1(CC)CCN(C[N@H+]2CC[C@H](F)C2)C1=O ZINC000817362364 586799192 /nfs/dbraw/zinc/79/91/92/586799192.db2.gz PFZXYJMDHAZFNP-NSHDSACASA-N 1 2 242.338 2.026 20 0 BEADLO CCc1ccc(C[NH2+]Cc2nn(CC)nc2C)o1 ZINC000818219936 586879622 /nfs/dbraw/zinc/87/96/22/586879622.db2.gz DLJLPRZTESNXPT-UHFFFAOYSA-N 1 2 248.330 2.052 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C(F)=C1CCC1 ZINC000819285111 586948692 /nfs/dbraw/zinc/94/86/92/586948692.db2.gz XJMISYITLDBRBL-UHFFFAOYSA-N 1 2 234.274 2.412 20 0 BEADLO Cc1noc([C@@H](C)[NH2+][C@@H](C)c2ccns2)n1 ZINC000860053206 589077097 /nfs/dbraw/zinc/07/70/97/589077097.db2.gz SPRSTHRKNMTWER-NKWVEPMBSA-N 1 2 238.316 2.246 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000819544690 586976093 /nfs/dbraw/zinc/97/60/93/586976093.db2.gz TYUAEHLDQDHDHJ-WOPDTQHZSA-N 1 2 247.342 2.270 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)CC2CCCC2)S1 ZINC000819758846 586990417 /nfs/dbraw/zinc/99/04/17/586990417.db2.gz BCVJAHXGQARDNI-QMMMGPOBSA-N 1 2 226.345 2.174 20 0 BEADLO CCC/C(C)=C/C(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819764122 586991074 /nfs/dbraw/zinc/99/10/74/586991074.db2.gz BNKMXOVSMULVMI-ORZBULNSSA-N 1 2 226.345 2.340 20 0 BEADLO CCC[C@H](C)CC(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819767350 586991466 /nfs/dbraw/zinc/99/14/66/586991466.db2.gz SGVYKHTYRQLFQW-IUCAKERBSA-N 1 2 228.361 2.420 20 0 BEADLO CCC[C@@H](C)CC(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819767351 586991582 /nfs/dbraw/zinc/99/15/82/586991582.db2.gz SGVYKHTYRQLFQW-RKDXNWHRSA-N 1 2 228.361 2.420 20 0 BEADLO CS[C@H](C)CCC(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819775441 586992735 /nfs/dbraw/zinc/99/27/35/586992735.db2.gz GIRCJEQAMMJRCT-HTQZYQBOSA-N 1 2 246.401 2.126 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819781167 586993752 /nfs/dbraw/zinc/99/37/52/586993752.db2.gz MELZNAXVJFAHEZ-AEJSXWLSSA-N 1 2 240.372 2.420 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)CC2CC(C)(C)C2)S1 ZINC000819779889 586993851 /nfs/dbraw/zinc/99/38/51/586993851.db2.gz CCGGYXYQUPRYQD-QMMMGPOBSA-N 1 2 240.372 2.420 20 0 BEADLO C[C@H](C(=O)NC1=[NH+]C[C@@H](C)S1)C1CCC1 ZINC000819780086 586994277 /nfs/dbraw/zinc/99/42/77/586994277.db2.gz DADKYYJKROXFQI-SFYZADRCSA-N 1 2 226.345 2.030 20 0 BEADLO CN(C[C@@](C)(O)c1ccccc1)c1cccc[nH+]1 ZINC000819951277 587005427 /nfs/dbraw/zinc/00/54/27/587005427.db2.gz UVPDBKJZWQSAEI-OAHLLOKOSA-N 1 2 242.322 2.426 20 0 BEADLO CC(C(=O)N1CCc2[nH]c[nH+]c2C1)=C1CCCC1 ZINC000819967612 587008842 /nfs/dbraw/zinc/00/88/42/587008842.db2.gz IHUGWYIOVXRKEG-UHFFFAOYSA-N 1 2 245.326 2.185 20 0 BEADLO CC(C(=O)N1CCc2[nH+]c[nH]c2C1)=C1CCCC1 ZINC000819967612 587008845 /nfs/dbraw/zinc/00/88/45/587008845.db2.gz IHUGWYIOVXRKEG-UHFFFAOYSA-N 1 2 245.326 2.185 20 0 BEADLO CCN(CC(C)(C)C)C(=O)/C=C\c1cn(C)c[nH+]1 ZINC000819997551 587012232 /nfs/dbraw/zinc/01/22/32/587012232.db2.gz MBJJUOQRWKYISY-FPLPWBNLSA-N 1 2 249.358 2.328 20 0 BEADLO C[C@@H](NC(=O)[C@H]1C[C@H]2C[C@H]2C[C@H]1C)c1[nH]cc[nH+]1 ZINC000820191741 587033620 /nfs/dbraw/zinc/03/36/20/587033620.db2.gz NZJHDNFSKUNFRL-OOCWMUITSA-N 1 2 247.342 2.269 20 0 BEADLO CCCCCCNC(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000820526384 587052771 /nfs/dbraw/zinc/05/27/71/587052771.db2.gz FUEXDEUXENPESU-NSHDSACASA-N 1 2 249.358 2.211 20 0 BEADLO CCCCCCNC(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000820526384 587052772 /nfs/dbraw/zinc/05/27/72/587052772.db2.gz FUEXDEUXENPESU-NSHDSACASA-N 1 2 249.358 2.211 20 0 BEADLO C[C@H](F)CCNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000820630011 587060287 /nfs/dbraw/zinc/06/02/87/587060287.db2.gz HTIGVRZJNFZLSV-QMMMGPOBSA-N 1 2 235.262 2.041 20 0 BEADLO Cc1cnc(N2CC[C@H](C)[C@H](n3cc[nH+]c3)C2)o1 ZINC000820676552 587065760 /nfs/dbraw/zinc/06/57/60/587065760.db2.gz QAYNSVXGIXXLFZ-CMPLNLGQSA-N 1 2 246.314 2.267 20 0 BEADLO Cc1cnc(N2CC[C@H](C)[C@@H](n3cc[nH+]c3)C2)o1 ZINC000820676553 587065872 /nfs/dbraw/zinc/06/58/72/587065872.db2.gz QAYNSVXGIXXLFZ-JQWIXIFHSA-N 1 2 246.314 2.267 20 0 BEADLO O=C(C[C@H]1CC=CCC1)N[C@H]1CCn2cc[nH+]c21 ZINC000820947578 587083666 /nfs/dbraw/zinc/08/36/66/587083666.db2.gz FOORGIFIEFKDHU-RYUDHWBXSA-N 1 2 245.326 2.191 20 0 BEADLO CCC[C@H](CC)C(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000821105673 587096272 /nfs/dbraw/zinc/09/62/72/587096272.db2.gz DBFCNZWGWDMSSY-WDEREUQCSA-N 1 2 249.358 2.210 20 0 BEADLO CCC[C@H](CC)C(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000821105673 587096273 /nfs/dbraw/zinc/09/62/73/587096273.db2.gz DBFCNZWGWDMSSY-WDEREUQCSA-N 1 2 249.358 2.210 20 0 BEADLO C[C@@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)C1CC1 ZINC000821178484 587100110 /nfs/dbraw/zinc/10/01/10/587100110.db2.gz CAYAGROLAMCPKA-MRVPVSSYSA-N 1 2 229.283 2.091 20 0 BEADLO CC[C@@H]1C[C@H]1CNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000821423227 587118576 /nfs/dbraw/zinc/11/85/76/587118576.db2.gz WZNGYHRLQLGRQQ-ZJUUUORDSA-N 1 2 243.310 2.339 20 0 BEADLO CCN(C(=O)Cc1[nH]cc[nH+]1)c1ccc(C)cc1 ZINC000821433240 587120021 /nfs/dbraw/zinc/12/00/21/587120021.db2.gz PEIKYGDYHMQWAG-UHFFFAOYSA-N 1 2 243.310 2.314 20 0 BEADLO CC(C)=CC(=O)OCCc1cn2ccccc2[nH+]1 ZINC000821595879 587131426 /nfs/dbraw/zinc/13/14/26/587131426.db2.gz OYACNHBPYQFDHE-UHFFFAOYSA-N 1 2 244.294 2.386 20 0 BEADLO CCCOC(=O)c1cccc(Cn2cc[nH+]c2)c1 ZINC000821621266 587132859 /nfs/dbraw/zinc/13/28/59/587132859.db2.gz MOMJRWGTHJFPKD-UHFFFAOYSA-N 1 2 244.294 2.498 20 0 BEADLO CC(C)CCCC(=O)NC1=[NH+]CCS1 ZINC000822234487 587159276 /nfs/dbraw/zinc/15/92/76/587159276.db2.gz WIHNOQJEERDFOI-UHFFFAOYSA-N 1 2 214.334 2.032 20 0 BEADLO C[C@@H]1CC(C)(C)CN1C(=O)/C=C/c1cn(C)c[nH+]1 ZINC000822738234 587183708 /nfs/dbraw/zinc/18/37/08/587183708.db2.gz HLSSKNIIRGRHGS-MVIFTORASA-N 1 2 247.342 2.080 20 0 BEADLO CCC[C@@H](CC)C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000823237431 587210339 /nfs/dbraw/zinc/21/03/39/587210339.db2.gz VNOBPHOLWIYUNN-GHMZBOCLSA-N 1 2 235.331 2.270 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)Cc1ccncc1F ZINC000823408432 587220201 /nfs/dbraw/zinc/22/02/01/587220201.db2.gz GRMAYUVVQNSWOM-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)Cc1ccncc1F ZINC000823408432 587220203 /nfs/dbraw/zinc/22/02/03/587220203.db2.gz GRMAYUVVQNSWOM-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO CC1(C)CC[N@@H+]1Cc1cc(F)ncc1F ZINC000823453381 587222778 /nfs/dbraw/zinc/22/27/78/587222778.db2.gz NIJCXRVHNCLSEZ-UHFFFAOYSA-N 1 2 212.243 2.344 20 0 BEADLO CC1(C)CC[N@H+]1Cc1cc(F)ncc1F ZINC000823453381 587222781 /nfs/dbraw/zinc/22/27/81/587222781.db2.gz NIJCXRVHNCLSEZ-UHFFFAOYSA-N 1 2 212.243 2.344 20 0 BEADLO CCC[C@H](CC)C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000823806764 587240980 /nfs/dbraw/zinc/24/09/80/587240980.db2.gz IIDPQYSQDMHHLH-BDAKNGLRSA-N 1 2 228.361 2.420 20 0 BEADLO CC[C@@H]1OCC[C@H]1C(=O)Nc1c(C)cc[nH+]c1C ZINC000823836087 587241676 /nfs/dbraw/zinc/24/16/76/587241676.db2.gz BYQZFMBDIQYUQE-NEPJUHHUSA-N 1 2 248.326 2.452 20 0 BEADLO CCCN(C(=O)/C=C\c1cn(C)c[nH+]1)C(C)C ZINC000824264939 587264042 /nfs/dbraw/zinc/26/40/42/587264042.db2.gz WBEJLWDNZPZHFO-SREVYHEPSA-N 1 2 235.331 2.080 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1cc(F)ncc1F ZINC000824314219 587265905 /nfs/dbraw/zinc/26/59/05/587265905.db2.gz HVXJPIIZDJEMLV-OCAPTIKFSA-N 1 2 212.243 2.343 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1cc(F)ncc1F ZINC000824314219 587265906 /nfs/dbraw/zinc/26/59/06/587265906.db2.gz HVXJPIIZDJEMLV-OCAPTIKFSA-N 1 2 212.243 2.343 20 0 BEADLO CCC[C@@H](CC)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000824355740 587267277 /nfs/dbraw/zinc/26/72/77/587267277.db2.gz VRXKHVQAONNRFW-SNVBAGLBSA-N 1 2 223.320 2.194 20 0 BEADLO CCC[C@@H](CC)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000824355740 587267279 /nfs/dbraw/zinc/26/72/79/587267279.db2.gz VRXKHVQAONNRFW-SNVBAGLBSA-N 1 2 223.320 2.194 20 0 BEADLO CCC[C@@H]([NH2+][C@@H](CF)C(=O)OC)C1CCCC1 ZINC000824396967 587269327 /nfs/dbraw/zinc/26/93/27/587269327.db2.gz WLZGIKZVBWIAHR-NEPJUHHUSA-N 1 2 245.338 2.446 20 0 BEADLO Cn1ncc(C[N@@H+]2CCC[C@](C)(F)C2)c1Cl ZINC000824471775 587271312 /nfs/dbraw/zinc/27/13/12/587271312.db2.gz HIPXUQJAJNDPEW-NSHDSACASA-N 1 2 245.729 2.398 20 0 BEADLO Cn1ncc(C[N@H+]2CCC[C@](C)(F)C2)c1Cl ZINC000824471775 587271313 /nfs/dbraw/zinc/27/13/13/587271313.db2.gz HIPXUQJAJNDPEW-NSHDSACASA-N 1 2 245.729 2.398 20 0 BEADLO Fc1cc(C[N@@H+]2CC[C@@H]2C2CC2)c(F)cn1 ZINC000824653683 587281260 /nfs/dbraw/zinc/28/12/60/587281260.db2.gz FILPJAZDRYFYKJ-LLVKDONJSA-N 1 2 224.254 2.344 20 0 BEADLO Fc1cc(C[N@H+]2CC[C@@H]2C2CC2)c(F)cn1 ZINC000824653683 587281262 /nfs/dbraw/zinc/28/12/62/587281262.db2.gz FILPJAZDRYFYKJ-LLVKDONJSA-N 1 2 224.254 2.344 20 0 BEADLO CC[C@H](C)N(CC)C(=O)/C=C\c1cn(C)c[nH+]1 ZINC000824652283 587281414 /nfs/dbraw/zinc/28/14/14/587281414.db2.gz YXRSUHMIFHSOOC-TVRMLOFPSA-N 1 2 235.331 2.080 20 0 BEADLO CC1(C)CC[N@H+](Cc2ccoc2)CC[S@@]1=O ZINC000825024359 587298547 /nfs/dbraw/zinc/29/85/47/587298547.db2.gz OCERYVTZXSYGIR-INIZCTEOSA-N 1 2 241.356 2.013 20 0 BEADLO CC1(C)CC[N@@H+](Cc2ccoc2)CC[S@@]1=O ZINC000825024359 587298548 /nfs/dbraw/zinc/29/85/48/587298548.db2.gz OCERYVTZXSYGIR-INIZCTEOSA-N 1 2 241.356 2.013 20 0 BEADLO CC(C)(F)CCNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000825258265 587311586 /nfs/dbraw/zinc/31/15/86/587311586.db2.gz UHIIXIZHPBFWKG-UHFFFAOYSA-N 1 2 249.289 2.431 20 0 BEADLO CN(CCC1CCCCC1)C(=O)Cc1[nH]cc[nH+]1 ZINC000825282950 587313049 /nfs/dbraw/zinc/31/30/49/587313049.db2.gz CJRBHZJPAHNYTQ-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO O=C(C[C@H]1CC=CCC1)N[C@@H]1CCn2c[nH+]cc21 ZINC000825514316 587322316 /nfs/dbraw/zinc/32/23/16/587322316.db2.gz ZWDFRZFQPRCLCP-NWDGAFQWSA-N 1 2 245.326 2.191 20 0 BEADLO C[C@H](NC(=O)C[C@@H]1CC=CCC1)c1[nH+]ccn1C ZINC000825544398 587324659 /nfs/dbraw/zinc/32/46/59/587324659.db2.gz JLGSQLZOHHWPAD-NWDGAFQWSA-N 1 2 247.342 2.344 20 0 BEADLO CCN(C(=O)Cc1[nH]cc[nH+]1)[C@@H]1CCCC[C@@H]1C ZINC000825607796 587327266 /nfs/dbraw/zinc/32/72/66/587327266.db2.gz PMFNVBSDLHNHSP-NWDGAFQWSA-N 1 2 249.358 2.379 20 0 BEADLO CC(C)CC1(NC(=O)/C=C\c2cn(C)c[nH+]2)CC1 ZINC000825933670 587346467 /nfs/dbraw/zinc/34/64/67/587346467.db2.gz JXJBMAKGIDUFFC-PLNGDYQASA-N 1 2 247.342 2.128 20 0 BEADLO COc1cncc(C[N@@H+]2CCC[C@@H](F)C2)c1 ZINC000826143096 587351210 /nfs/dbraw/zinc/35/12/10/587351210.db2.gz SDVODSSRWYGGAM-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO COc1cncc(C[N@H+]2CCC[C@@H](F)C2)c1 ZINC000826143096 587351211 /nfs/dbraw/zinc/35/12/11/587351211.db2.gz SDVODSSRWYGGAM-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO Cc1cc[nH+]c(N[C@@H](C)C(C)C)c1-c1nn[nH]n1 ZINC000826311636 587352193 /nfs/dbraw/zinc/35/21/93/587352193.db2.gz KAJQHSWNHJTPPO-VIFPVBQESA-N 1 2 246.318 2.027 20 0 BEADLO C[N@@H+]1Cc2ccccc2[C@@H]1CNC(=O)C1CCC1 ZINC000826736005 587360763 /nfs/dbraw/zinc/36/07/63/587360763.db2.gz GXTCLKBFGJHVMU-AWEZNQCLSA-N 1 2 244.338 2.089 20 0 BEADLO C[N@H+]1Cc2ccccc2[C@@H]1CNC(=O)C1CCC1 ZINC000826736005 587360764 /nfs/dbraw/zinc/36/07/64/587360764.db2.gz GXTCLKBFGJHVMU-AWEZNQCLSA-N 1 2 244.338 2.089 20 0 BEADLO CCC(C)=CC(=O)Nc1cc(C)[nH+]cc1C ZINC000827492347 587382662 /nfs/dbraw/zinc/38/26/62/587382662.db2.gz WXILGWYGAQLHKC-TWGQIWQCSA-N 1 2 218.300 2.415 20 0 BEADLO C[C@H]1CCC[C@@H](CCNC(=O)Cc2[nH]cc[nH+]2)C1 ZINC000827955183 587412762 /nfs/dbraw/zinc/41/27/62/587412762.db2.gz AQIYLESMAIMBKN-RYUDHWBXSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1CCC[C@H](CCNC(=O)Cc2[nH]cc[nH+]2)C1 ZINC000827955184 587413153 /nfs/dbraw/zinc/41/31/53/587413153.db2.gz AQIYLESMAIMBKN-VXGBXAGGSA-N 1 2 249.358 2.285 20 0 BEADLO FC(F)[C@H]1C[N@H+](CC2=CCCC2)CCO1 ZINC000828469293 587444512 /nfs/dbraw/zinc/44/45/12/587444512.db2.gz FJCRJRVVIPREKD-SNVBAGLBSA-N 1 2 217.259 2.063 20 0 BEADLO FC(F)[C@H]1C[N@@H+](CC2=CCCC2)CCO1 ZINC000828469293 587444513 /nfs/dbraw/zinc/44/45/13/587444513.db2.gz FJCRJRVVIPREKD-SNVBAGLBSA-N 1 2 217.259 2.063 20 0 BEADLO CC[C@@H]1CCC[C@@H](NC(=O)Cc2[nH]cc[nH+]2)C1 ZINC000828507480 587445896 /nfs/dbraw/zinc/44/58/96/587445896.db2.gz ZBRKRXSFVAIAQB-GHMZBOCLSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@H]1CCC[C@H](NC(=O)Cc2[nH]cc[nH+]2)C1 ZINC000828507483 587446011 /nfs/dbraw/zinc/44/60/11/587446011.db2.gz ZBRKRXSFVAIAQB-QWRGUYRKSA-N 1 2 235.331 2.037 20 0 BEADLO C(c1nnc(C2CC2)s1)[N@@H+]1CC[C@H]2C[C@H]21 ZINC000828534067 587448885 /nfs/dbraw/zinc/44/88/85/587448885.db2.gz YBXMZOFNORTIGD-DTWKUNHWSA-N 1 2 221.329 2.010 20 0 BEADLO C(c1nnc(C2CC2)s1)[N@H+]1CC[C@H]2C[C@H]21 ZINC000828534067 587448886 /nfs/dbraw/zinc/44/88/86/587448886.db2.gz YBXMZOFNORTIGD-DTWKUNHWSA-N 1 2 221.329 2.010 20 0 BEADLO C(c1nnc(C2CC2)s1)[N@@H+]1CC[C@@H]2C[C@@H]21 ZINC000828534066 587448919 /nfs/dbraw/zinc/44/89/19/587448919.db2.gz YBXMZOFNORTIGD-BDAKNGLRSA-N 1 2 221.329 2.010 20 0 BEADLO C(c1nnc(C2CC2)s1)[N@H+]1CC[C@@H]2C[C@@H]21 ZINC000828534066 587448921 /nfs/dbraw/zinc/44/89/21/587448921.db2.gz YBXMZOFNORTIGD-BDAKNGLRSA-N 1 2 221.329 2.010 20 0 BEADLO C[C@H](NC(=O)Cc1[nH]cc[nH+]1)C1CCCCC1 ZINC000828607071 587453517 /nfs/dbraw/zinc/45/35/17/587453517.db2.gz PQYKVRLQBSELMK-JTQLQIEISA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@@]1(O)CC[N@H+](Cc2csc(Cl)n2)C1 ZINC000828992291 587478037 /nfs/dbraw/zinc/47/80/37/587478037.db2.gz SLYNZSXLIQSSDL-SNVBAGLBSA-N 1 2 246.763 2.143 20 0 BEADLO CC[C@@]1(O)CC[N@@H+](Cc2csc(Cl)n2)C1 ZINC000828992291 587478038 /nfs/dbraw/zinc/47/80/38/587478038.db2.gz SLYNZSXLIQSSDL-SNVBAGLBSA-N 1 2 246.763 2.143 20 0 BEADLO CCC[C@@H]1[C@H](C)CCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC000829016238 587479934 /nfs/dbraw/zinc/47/99/34/587479934.db2.gz PXVJBIINUPGFGT-VXGBXAGGSA-N 1 2 249.358 2.379 20 0 BEADLO CC[C@@H](C)C(=O)N1CCc2[nH]c[nH+]c2C12CCC2 ZINC000829099203 587483003 /nfs/dbraw/zinc/48/30/03/587483003.db2.gz BDPXDZGESVUGSB-SNVBAGLBSA-N 1 2 247.342 2.220 20 0 BEADLO CCC[C@]1(C)CCCN(C(=O)Cc2[nH]cc[nH+]2)C1 ZINC000829255248 587490428 /nfs/dbraw/zinc/49/04/28/587490428.db2.gz RMBCLTXAVYCVNN-CQSZACIVSA-N 1 2 249.358 2.381 20 0 BEADLO C[C@@]1([NH2+]CCC2=CCCCC2)CCOC1=O ZINC000829962623 587530403 /nfs/dbraw/zinc/53/04/03/587530403.db2.gz MOIOQBPXKIBXHI-CYBMUJFWSA-N 1 2 223.316 2.172 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@H](F)C2)nc2ccccc12 ZINC000830474645 587553531 /nfs/dbraw/zinc/55/35/31/587553531.db2.gz PDZYINZRVDTMIN-LLVKDONJSA-N 1 2 245.301 2.482 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@H](F)C2)nc2ccccc12 ZINC000830474645 587553532 /nfs/dbraw/zinc/55/35/32/587553532.db2.gz PDZYINZRVDTMIN-LLVKDONJSA-N 1 2 245.301 2.482 20 0 BEADLO CCC[C@H](C)[C@@H]1CCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC000830498830 587554649 /nfs/dbraw/zinc/55/46/49/587554649.db2.gz RBCOJDQICCRSLV-RYUDHWBXSA-N 1 2 249.358 2.379 20 0 BEADLO CSC(C)(C)C(=O)Nc1cc(C)[nH+]cc1C ZINC000830748574 587566877 /nfs/dbraw/zinc/56/68/77/587566877.db2.gz IIJZMAOVPRHUBK-UHFFFAOYSA-N 1 2 238.356 2.200 20 0 BEADLO O[C@@]1(C(F)F)CC[N@H+](C/C(Cl)=C/Cl)C1 ZINC000831176038 587589533 /nfs/dbraw/zinc/58/95/33/587589533.db2.gz RKVJWBCLTUQYID-LBLVLHIFSA-N 1 2 246.084 2.007 20 0 BEADLO O[C@@]1(C(F)F)CC[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000831176038 587589535 /nfs/dbraw/zinc/58/95/35/587589535.db2.gz RKVJWBCLTUQYID-LBLVLHIFSA-N 1 2 246.084 2.007 20 0 BEADLO O[C@@H](C[N@@H+]1CC[C@@H](F)C1)c1ccccc1Cl ZINC000831228699 587590353 /nfs/dbraw/zinc/59/03/53/587590353.db2.gz UMYMAECKWBMKNT-SKDRFNHKSA-N 1 2 243.709 2.417 20 0 BEADLO O[C@@H](C[N@H+]1CC[C@@H](F)C1)c1ccccc1Cl ZINC000831228699 587590355 /nfs/dbraw/zinc/59/03/55/587590355.db2.gz UMYMAECKWBMKNT-SKDRFNHKSA-N 1 2 243.709 2.417 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NCCC1CC=CC1 ZINC000831422908 587605359 /nfs/dbraw/zinc/60/53/59/587605359.db2.gz KIMCQYDVSJBTBI-LLVKDONJSA-N 1 2 247.342 2.061 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NCCC1CC=CC1 ZINC000831422908 587605360 /nfs/dbraw/zinc/60/53/60/587605360.db2.gz KIMCQYDVSJBTBI-LLVKDONJSA-N 1 2 247.342 2.061 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)NCCC1=CCCCCC1 ZINC000832258615 587652509 /nfs/dbraw/zinc/65/25/09/587652509.db2.gz DQXAJUOYXVIIOM-UHFFFAOYSA-N 1 2 247.342 2.349 20 0 BEADLO CCON(Cc1[nH]cc[nH+]1)Cc1ccccc1 ZINC000832795999 587690343 /nfs/dbraw/zinc/69/03/43/587690343.db2.gz VORYNPSSKGETBA-UHFFFAOYSA-N 1 2 231.299 2.363 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833272543 587704237 /nfs/dbraw/zinc/70/42/37/587704237.db2.gz PIUKWPCXEGEVHC-GRYCIOLGSA-N 1 2 247.342 2.270 20 0 BEADLO O=C(C[C@@H]1C=CCCC1)N[C@H]1CCn2cc[nH+]c21 ZINC000833279433 587704250 /nfs/dbraw/zinc/70/42/50/587704250.db2.gz ZYWLENBUJVOHBM-NEPJUHHUSA-N 1 2 245.326 2.191 20 0 BEADLO CCCC1(C(=O)N[C@@H]2CCn3cc[nH+]c32)CCC1 ZINC000833285842 587704732 /nfs/dbraw/zinc/70/47/32/587704732.db2.gz ULCJBWCZBWUFDH-LLVKDONJSA-N 1 2 247.342 2.415 20 0 BEADLO CCC/C(C)=C\C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833285314 587704770 /nfs/dbraw/zinc/70/47/70/587704770.db2.gz QHJDBHJZOADGLR-JUDLJHIGSA-N 1 2 233.315 2.191 20 0 BEADLO O=C(C=C1CCCCC1)N[C@@H]1CCn2cc[nH+]c21 ZINC000833284330 587704833 /nfs/dbraw/zinc/70/48/33/587704833.db2.gz IBKOSUINBUJDST-GFCCVEGCSA-N 1 2 245.326 2.335 20 0 BEADLO Cc1[nH]c(C(=O)NCCC[C@@H]2C=CCC2)c[nH+]1 ZINC000834335037 587752402 /nfs/dbraw/zinc/75/24/02/587752402.db2.gz SPBWKOLMYRFDPY-LLVKDONJSA-N 1 2 233.315 2.194 20 0 BEADLO CC(C)[C@H](C)[NH2+]c1ccc(O[C@H]2CC(=O)N2)cc1 ZINC000834892704 587769555 /nfs/dbraw/zinc/76/95/55/587769555.db2.gz CVSFRLJGAZLBML-HZMBPMFUSA-N 1 2 248.326 2.368 20 0 BEADLO Cc1sccc1C(=O)OCc1c[nH+]cn1C ZINC000835192401 587788173 /nfs/dbraw/zinc/78/81/73/587788173.db2.gz FBRJKXAKQHHJCP-UHFFFAOYSA-N 1 2 236.296 2.147 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)OCc1cccc2[nH+]ccn21 ZINC000835237267 587791507 /nfs/dbraw/zinc/79/15/07/587791507.db2.gz QCSZJADCYQMADV-ZYHUDNBSSA-N 1 2 244.294 2.424 20 0 BEADLO Cc1[nH+]c2cc(OC(=O)[C@@H]3C[C@@H]3C)ccc2n1C ZINC000835505506 587806368 /nfs/dbraw/zinc/80/63/68/587806368.db2.gz BZDNOHORDLORTG-GZMMTYOYSA-N 1 2 244.294 2.443 20 0 BEADLO CC/C=C(/F)C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000867179761 587834911 /nfs/dbraw/zinc/83/49/11/587834911.db2.gz PUBIGEGPOPNJIB-LLGDCAAFSA-N 1 2 237.278 2.337 20 0 BEADLO CON(C)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000836632524 587835635 /nfs/dbraw/zinc/83/56/35/587835635.db2.gz MZCCTPKJFPYYLC-UHFFFAOYSA-N 1 2 223.276 2.032 20 0 BEADLO Cc1cc(C)c(NC(=O)NOC(C)C)c(C)[nH+]1 ZINC000836630957 587835790 /nfs/dbraw/zinc/83/57/90/587835790.db2.gz CKHNYZYBJYMVSB-UHFFFAOYSA-N 1 2 237.303 2.468 20 0 BEADLO Cn1c[nH+]cc1CC(=O)N1CCCCCCCC1 ZINC000836926011 587843295 /nfs/dbraw/zinc/84/32/95/587843295.db2.gz YPSIIPRMBOAWRS-UHFFFAOYSA-N 1 2 249.358 2.145 20 0 BEADLO CC(C)=C(C)C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000836953713 587843494 /nfs/dbraw/zinc/84/34/94/587843494.db2.gz HEOIMDJXANFQDE-GXSJLCMTSA-N 1 2 233.315 2.361 20 0 BEADLO CC/C(C)=C\C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000836961761 587844225 /nfs/dbraw/zinc/84/42/25/587844225.db2.gz WZQVYPQJKRSWGQ-MHTFJADPSA-N 1 2 233.315 2.361 20 0 BEADLO Cc1cc(C)c(CNC(=O)C2=CCCCO2)c[nH+]1 ZINC000837104554 587853962 /nfs/dbraw/zinc/85/39/62/587853962.db2.gz GBOWFCQOMSYHMX-UHFFFAOYSA-N 1 2 246.310 2.009 20 0 BEADLO Cc1ccc(COC(=O)[C@H]2CC2(F)F)c(C)[nH+]1 ZINC000837978046 587907108 /nfs/dbraw/zinc/90/71/08/587907108.db2.gz BOQQWRCPGCGUNI-SNVBAGLBSA-N 1 2 241.237 2.397 20 0 BEADLO O[C@@H](Cn1c[nH+]c2cc(F)c(F)cc21)C1CC1 ZINC000840740520 587919211 /nfs/dbraw/zinc/91/92/11/587919211.db2.gz BPZGKXHNUNJUNM-LBPRGKRZSA-N 1 2 238.237 2.085 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@H](CF)C2)c(C)o1 ZINC000840954922 587931800 /nfs/dbraw/zinc/93/18/00/587931800.db2.gz NIHKABUVUPJHEQ-GFCCVEGCSA-N 1 2 227.279 2.067 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@H](CF)C2)c(C)o1 ZINC000840954922 587931802 /nfs/dbraw/zinc/93/18/02/587931802.db2.gz NIHKABUVUPJHEQ-GFCCVEGCSA-N 1 2 227.279 2.067 20 0 BEADLO COc1ccc([NH2+]C[C@H]2C[C@H]2C)cc1N ZINC000841040389 587938771 /nfs/dbraw/zinc/93/87/71/587938771.db2.gz LPTVVUMIZXIFIA-RKDXNWHRSA-N 1 2 206.289 2.345 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccsc2)n(C)n1 ZINC000841831194 587976565 /nfs/dbraw/zinc/97/65/65/587976565.db2.gz SFJRSEAXAKYVAB-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccsc2)n(C)n1 ZINC000841831194 587976566 /nfs/dbraw/zinc/97/65/66/587976566.db2.gz SFJRSEAXAKYVAB-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1cc(C[NH2+]C2(C(F)F)CCCC2)n(C)n1 ZINC000841884318 587980979 /nfs/dbraw/zinc/98/09/79/587980979.db2.gz AMZKATUYOWLUIF-UHFFFAOYSA-N 1 2 243.301 2.396 20 0 BEADLO CC[C@H](CO[NH+]=C(N)c1ccccc1C)OC ZINC000842013185 587988939 /nfs/dbraw/zinc/98/89/39/587988939.db2.gz IHLFXZQHQUSRMJ-LLVKDONJSA-N 1 2 236.315 2.267 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OCc1ccc(C)cc1C ZINC000842037024 587992059 /nfs/dbraw/zinc/99/20/59/587992059.db2.gz TWJBMWGDQIXJEN-NSHDSACASA-N 1 2 236.315 2.337 20 0 BEADLO CC[C@@H](C)C(=O)OCC1CN(c2cccc[nH+]2)C1 ZINC000842892309 588070748 /nfs/dbraw/zinc/07/07/48/588070748.db2.gz AMIOCKXMVLTEQR-LLVKDONJSA-N 1 2 248.326 2.107 20 0 BEADLO CC[NH2+]Cc1noc(/C=C2\CC[C@@H](C)C2)n1 ZINC000843144624 588086104 /nfs/dbraw/zinc/08/61/04/588086104.db2.gz DYYQESGHONYASU-YIXGCBLDSA-N 1 2 221.304 2.383 20 0 BEADLO Cn1c(Cl)cnc1C[NH+]1C2CCC1CC2 ZINC000843514439 588118067 /nfs/dbraw/zinc/11/80/67/588118067.db2.gz GHWYYJAMMLVRSK-UHFFFAOYSA-N 1 2 225.723 2.200 20 0 BEADLO CC(C)(C)C[C@@H]1C[C@H]1C(=O)NC1=[NH+]CCS1 ZINC000843525130 588119376 /nfs/dbraw/zinc/11/93/76/588119376.db2.gz NLXXGXJVVOCYBE-DTWKUNHWSA-N 1 2 240.372 2.278 20 0 BEADLO Cc1cc(-c2ccc3c(c2)C[C@@H](CO)O3)cc[nH+]1 ZINC000844232914 588175798 /nfs/dbraw/zinc/17/57/98/588175798.db2.gz VTQMLKSKGADATD-AWEZNQCLSA-N 1 2 241.290 2.353 20 0 BEADLO CCn1ccc(C[NH2+][C@H](C)c2c(C)noc2C)n1 ZINC000844313883 588183587 /nfs/dbraw/zinc/18/35/87/588183587.db2.gz XHQJCXKNJGEFQK-SECBINFHSA-N 1 2 248.330 2.359 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@@H+]1Cc1nccc(C)n1 ZINC000844388363 588188764 /nfs/dbraw/zinc/18/87/64/588188764.db2.gz XWNQYJQKBYRPIR-LBPRGKRZSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@H+]1Cc1nccc(C)n1 ZINC000844388363 588188766 /nfs/dbraw/zinc/18/87/66/588188766.db2.gz XWNQYJQKBYRPIR-LBPRGKRZSA-N 1 2 249.358 2.174 20 0 BEADLO C[C@H](CC(=O)N[C@H](C)c1ccc[nH]1)n1cc[nH+]c1 ZINC000844453890 588195818 /nfs/dbraw/zinc/19/58/18/588195818.db2.gz IMEFSMACTRICLK-GHMZBOCLSA-N 1 2 246.314 2.040 20 0 BEADLO C[C@@H](CC(=O)N[C@H]1CC[C@@H](C)C1)n1cc[nH+]c1 ZINC000844491982 588199597 /nfs/dbraw/zinc/19/95/97/588199597.db2.gz VJUOEWNNQLRKMT-WOPDTQHZSA-N 1 2 235.331 2.139 20 0 BEADLO CCCC(C)(C)c1nc(C[NH2+]CC)no1 ZINC000844906761 588219019 /nfs/dbraw/zinc/21/90/19/588219019.db2.gz TVISJYALNFLBMT-UHFFFAOYSA-N 1 2 211.309 2.257 20 0 BEADLO O=C(OCCn1cc[nH+]c1)[C@@H]1C[C@@H]2C=C[C@H]1CC2 ZINC000845226845 588224387 /nfs/dbraw/zinc/22/43/87/588224387.db2.gz VJZWJEYVCICGHF-FRRDWIJNSA-N 1 2 246.310 2.029 20 0 BEADLO CC(C)COC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000845278268 588225300 /nfs/dbraw/zinc/22/53/00/588225300.db2.gz SMSUNJJAFYBEQY-JTQLQIEISA-N 1 2 210.277 2.033 20 0 BEADLO C[C@@H](CC(=O)OC[Si](C)(C)C)n1cc[nH+]c1 ZINC000845281496 588225610 /nfs/dbraw/zinc/22/56/10/588225610.db2.gz IPBILBLGNPNPSI-JTQLQIEISA-N 1 2 240.379 2.255 20 0 BEADLO CC[C@H](C)OC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000845283413 588225825 /nfs/dbraw/zinc/22/58/25/588225825.db2.gz WPUTVJHHTIAWQK-ZJUUUORDSA-N 1 2 210.277 2.176 20 0 BEADLO C[C@H](CC(=O)OCC1=CCCC1)n1cc[nH+]c1 ZINC000845284710 588225920 /nfs/dbraw/zinc/22/59/20/588225920.db2.gz DJRGZFWGFFHEGI-LLVKDONJSA-N 1 2 234.299 2.488 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@H]1C[C@@H]1C1CCCC1 ZINC000845479529 588229950 /nfs/dbraw/zinc/22/99/50/588229950.db2.gz POBVPBOEIQSIEY-OLZOCXBDSA-N 1 2 248.326 2.290 20 0 BEADLO CC(C)[C@H](C)OC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000845497122 588230993 /nfs/dbraw/zinc/23/09/93/588230993.db2.gz YMXIZAVFTMYKEM-MNOVXSKESA-N 1 2 224.304 2.422 20 0 BEADLO C[C@@H](CC(=O)O[C@H]1C=CCC1)n1cc[nH+]c1 ZINC000845508465 588231329 /nfs/dbraw/zinc/23/13/29/588231329.db2.gz HIOKWFMDQRFIBK-QWRGUYRKSA-N 1 2 220.272 2.096 20 0 BEADLO C[C@H](CC(=O)OCCc1ccoc1)n1cc[nH+]c1 ZINC000845521595 588231968 /nfs/dbraw/zinc/23/19/68/588231968.db2.gz HQSGVPSTCRKOIW-LLVKDONJSA-N 1 2 248.282 2.213 20 0 BEADLO CCCC(C)(C)C(=O)O[C@@H]1CC[N@H+](CCF)C1 ZINC000845544078 588232877 /nfs/dbraw/zinc/23/28/77/588232877.db2.gz NPPLFABAPSEWCR-LLVKDONJSA-N 1 2 245.338 2.400 20 0 BEADLO CCCC(C)(C)C(=O)O[C@@H]1CC[N@@H+](CCF)C1 ZINC000845544078 588232878 /nfs/dbraw/zinc/23/28/78/588232878.db2.gz NPPLFABAPSEWCR-LLVKDONJSA-N 1 2 245.338 2.400 20 0 BEADLO C[C@H](CC(=O)OC[C@H]1CC1(C)C)n1cc[nH+]c1 ZINC000845575064 588233715 /nfs/dbraw/zinc/23/37/15/588233715.db2.gz FUINUDOAMSTNBL-GHMZBOCLSA-N 1 2 236.315 2.424 20 0 BEADLO Cc1ccc(COC(=O)C[C@@H](C)n2cc[nH+]c2)o1 ZINC000845581194 588233790 /nfs/dbraw/zinc/23/37/90/588233790.db2.gz FXVGXBMGBYKVPA-SNVBAGLBSA-N 1 2 248.282 2.479 20 0 BEADLO C[C@H](CC(=O)OC[C@H]1CC1(F)F)n1cc[nH+]c1 ZINC000845581170 588233829 /nfs/dbraw/zinc/23/38/29/588233829.db2.gz FOLHCXKSQUSUEV-RKDXNWHRSA-N 1 2 244.241 2.033 20 0 BEADLO Cc1cc(COC(=O)C[C@@H](C)n2cc[nH+]c2)co1 ZINC000845582001 588234127 /nfs/dbraw/zinc/23/41/27/588234127.db2.gz DRWWIDQTNWFTDR-SNVBAGLBSA-N 1 2 248.282 2.479 20 0 BEADLO C[C@@H](Cn1cccn1)Nc1ccc([NH+](C)C)cc1 ZINC000121587746 588246713 /nfs/dbraw/zinc/24/67/13/588246713.db2.gz GEZOBIMAMJYEQP-LBPRGKRZSA-N 1 2 244.342 2.450 20 0 BEADLO CCONC(=O)C[NH2+][C@H](C)C[C@H](C)CC(C)C ZINC000846090782 588256135 /nfs/dbraw/zinc/25/61/35/588256135.db2.gz DRNAZDJLOYSAFE-VXGBXAGGSA-N 1 2 244.379 2.105 20 0 BEADLO CCONC(=O)C[NH2+][C@@H](C)C[C@@H](C)CC(C)C ZINC000846090781 588256388 /nfs/dbraw/zinc/25/63/88/588256388.db2.gz DRNAZDJLOYSAFE-RYUDHWBXSA-N 1 2 244.379 2.105 20 0 BEADLO FC1(F)C[C@@]12CCC[N@H+](Cc1cocn1)C2 ZINC000846103928 588256513 /nfs/dbraw/zinc/25/65/13/588256513.db2.gz CBVIZOKJOYBYTC-SNVBAGLBSA-N 1 2 228.242 2.296 20 0 BEADLO FC1(F)C[C@@]12CCC[N@@H+](Cc1cocn1)C2 ZINC000846103928 588256514 /nfs/dbraw/zinc/25/65/14/588256514.db2.gz CBVIZOKJOYBYTC-SNVBAGLBSA-N 1 2 228.242 2.296 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000846107434 588256863 /nfs/dbraw/zinc/25/68/63/588256863.db2.gz HDFYKRHZMOKPKO-LLVKDONJSA-N 1 2 241.285 2.339 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000846107434 588256864 /nfs/dbraw/zinc/25/68/64/588256864.db2.gz HDFYKRHZMOKPKO-LLVKDONJSA-N 1 2 241.285 2.339 20 0 BEADLO Fc1ccc(C[N@H+]2CCC[C@H](F)C2)cn1 ZINC000846120828 588258227 /nfs/dbraw/zinc/25/82/27/588258227.db2.gz SSXFAGDDLFAYKQ-JTQLQIEISA-N 1 2 212.243 2.155 20 0 BEADLO Fc1ccc(C[N@@H+]2CCC[C@H](F)C2)cn1 ZINC000846120828 588258228 /nfs/dbraw/zinc/25/82/28/588258228.db2.gz SSXFAGDDLFAYKQ-JTQLQIEISA-N 1 2 212.243 2.155 20 0 BEADLO C/C(=C\C(=O)NC(C)(C)c1[nH]cc[nH+]1)C1CC1 ZINC000846245372 588262474 /nfs/dbraw/zinc/26/24/74/588262474.db2.gz DWHNTOIRECGYLN-CMDGGOBGSA-N 1 2 233.315 2.117 20 0 BEADLO CCCC(C)(C)C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000846269906 588263585 /nfs/dbraw/zinc/26/35/85/588263585.db2.gz XALIMJSEGQROOC-MRVPVSSYSA-N 1 2 228.361 2.420 20 0 BEADLO C[C@@H]1Cc2cc([NH2+]CC3(C)COC3)ccc2O1 ZINC000846748958 588284023 /nfs/dbraw/zinc/28/40/23/588284023.db2.gz PPBMBLJBCPINHH-SNVBAGLBSA-N 1 2 233.311 2.458 20 0 BEADLO CCc1nnc(CNc2ccc(C)[nH+]c2)s1 ZINC000846749356 588284737 /nfs/dbraw/zinc/28/47/37/588284737.db2.gz HZHKKKZFMPLYEK-UHFFFAOYSA-N 1 2 234.328 2.416 20 0 BEADLO CCn1cc[nH+]c1CNc1cccc2c1OCC2 ZINC000846750655 588285374 /nfs/dbraw/zinc/28/53/74/588285374.db2.gz YJNKWBXMEFNDJY-UHFFFAOYSA-N 1 2 243.310 2.450 20 0 BEADLO C[C@@H]1C[N@@H+](CC2(Br)CC2)C[C@H](C)O1 ZINC000846760518 588286304 /nfs/dbraw/zinc/28/63/04/588286304.db2.gz HBBKOZFRZBZQHG-DTORHVGOSA-N 1 2 248.164 2.023 20 0 BEADLO C[C@@H]1C[N@H+](CC2(Br)CC2)C[C@H](C)O1 ZINC000846760518 588286305 /nfs/dbraw/zinc/28/63/05/588286305.db2.gz HBBKOZFRZBZQHG-DTORHVGOSA-N 1 2 248.164 2.023 20 0 BEADLO C[C@@H]1C[C@@H](C)C[NH+](Cc2cnsn2)C1 ZINC000846768433 588286958 /nfs/dbraw/zinc/28/69/58/588286958.db2.gz JTNSVFTXUKUOLB-RKDXNWHRSA-N 1 2 211.334 2.016 20 0 BEADLO CC[C@@H]1CCC[N@H+](Cc2cnsn2)C1 ZINC000846767832 588286985 /nfs/dbraw/zinc/28/69/85/588286985.db2.gz OLPHSGGIYMZDHQ-SECBINFHSA-N 1 2 211.334 2.160 20 0 BEADLO CC[C@@H]1CCC[N@@H+](Cc2cnsn2)C1 ZINC000846767832 588286986 /nfs/dbraw/zinc/28/69/86/588286986.db2.gz OLPHSGGIYMZDHQ-SECBINFHSA-N 1 2 211.334 2.160 20 0 BEADLO c1coc([C@@H]2CC[N@@H+](Cc3cnsn3)C2)c1 ZINC000846801557 588289353 /nfs/dbraw/zinc/28/93/53/588289353.db2.gz CHACLHLYYYYFKZ-SECBINFHSA-N 1 2 235.312 2.121 20 0 BEADLO c1coc([C@@H]2CC[N@H+](Cc3cnsn3)C2)c1 ZINC000846801557 588289354 /nfs/dbraw/zinc/28/93/54/588289354.db2.gz CHACLHLYYYYFKZ-SECBINFHSA-N 1 2 235.312 2.121 20 0 BEADLO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cnsn1 ZINC000846806958 588290093 /nfs/dbraw/zinc/29/00/93/588290093.db2.gz RTJKHMWEPOZLDB-DTWKUNHWSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cnsn1 ZINC000846806958 588290094 /nfs/dbraw/zinc/29/00/94/588290094.db2.gz RTJKHMWEPOZLDB-DTWKUNHWSA-N 1 2 211.334 2.159 20 0 BEADLO CC[C@@H](C)C[N@H+](CC)Cc1cnsn1 ZINC000846811957 588290360 /nfs/dbraw/zinc/29/03/60/588290360.db2.gz PZSWIGDLCNGOMO-SECBINFHSA-N 1 2 213.350 2.406 20 0 BEADLO CC[C@@H](C)C[N@@H+](CC)Cc1cnsn1 ZINC000846811957 588290361 /nfs/dbraw/zinc/29/03/61/588290361.db2.gz PZSWIGDLCNGOMO-SECBINFHSA-N 1 2 213.350 2.406 20 0 BEADLO c1nsnc1C[N@@H+]1CCCC12CCC2 ZINC000846879393 588294728 /nfs/dbraw/zinc/29/47/28/588294728.db2.gz PBGCJSZEKVKQEO-UHFFFAOYSA-N 1 2 209.318 2.057 20 0 BEADLO c1nsnc1C[N@H+]1CCCC12CCC2 ZINC000846879393 588294729 /nfs/dbraw/zinc/29/47/29/588294729.db2.gz PBGCJSZEKVKQEO-UHFFFAOYSA-N 1 2 209.318 2.057 20 0 BEADLO CC(=O)C1CC[NH+]([C@H](C)c2ncc(C)o2)CC1 ZINC000846946188 588298029 /nfs/dbraw/zinc/29/80/29/588298029.db2.gz HQWDPKQPSWZADP-SNVBAGLBSA-N 1 2 236.315 2.345 20 0 BEADLO CCCCOC(=O)[C@@H](C)[NH2+][C@@H]1CCC1(C)C ZINC000846959480 588298557 /nfs/dbraw/zinc/29/85/57/588298557.db2.gz IXBWYWHUYAQSNY-GHMZBOCLSA-N 1 2 227.348 2.496 20 0 BEADLO CCCCOC(=O)[C@H](C)[NH2+][C@@H]1CCC1(C)C ZINC000846959487 588298624 /nfs/dbraw/zinc/29/86/24/588298624.db2.gz IXBWYWHUYAQSNY-WDEREUQCSA-N 1 2 227.348 2.496 20 0 BEADLO CCCOC(=O)[C@@H](C)[NH2+][C@H]1CCC1(C)C ZINC000846959471 588298659 /nfs/dbraw/zinc/29/86/59/588298659.db2.gz IRVMPSMNISCPDK-ZJUUUORDSA-N 1 2 213.321 2.106 20 0 BEADLO C[C@H]1CC(C)(C)C[N@@H+]1Cc1cnsn1 ZINC000846996902 588301029 /nfs/dbraw/zinc/30/10/29/588301029.db2.gz RSBVRKASLLWQIZ-QMMMGPOBSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@H]1CC(C)(C)C[N@H+]1Cc1cnsn1 ZINC000846996902 588301030 /nfs/dbraw/zinc/30/10/30/588301030.db2.gz RSBVRKASLLWQIZ-QMMMGPOBSA-N 1 2 211.334 2.159 20 0 BEADLO CCCCOC(=O)C(C)(C)[NH2+]C[C@H](CC)OC ZINC000847062655 588305574 /nfs/dbraw/zinc/30/55/74/588305574.db2.gz NJNVLDUHUJJKLY-NSHDSACASA-N 1 2 245.363 2.123 20 0 BEADLO C[Si](C)(C)CCCC(=O)NCc1[nH]cc[nH+]1 ZINC000847485103 588314432 /nfs/dbraw/zinc/31/44/32/588314432.db2.gz JQHAAVYXVHHAAT-UHFFFAOYSA-N 1 2 239.395 2.144 20 0 BEADLO CCC/C(C)=C/C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000848387175 588375886 /nfs/dbraw/zinc/37/58/86/588375886.db2.gz MARYZWNJEFPXKU-AAXQSMANSA-N 1 2 221.304 2.333 20 0 BEADLO CCCC(C)=CC(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000848387175 588375888 /nfs/dbraw/zinc/37/58/88/588375888.db2.gz MARYZWNJEFPXKU-AAXQSMANSA-N 1 2 221.304 2.333 20 0 BEADLO CC(C)(CCO[NH+]=C(N)[C@H]1CCCO1)C1CC1 ZINC000848511656 588388474 /nfs/dbraw/zinc/38/84/74/588388474.db2.gz AMQIBGKDJCLLGE-LLVKDONJSA-N 1 2 240.347 2.490 20 0 BEADLO CC[C@@H]([NH2+]Cc1cnc(Cl)n1C)C(F)F ZINC000848552748 588393044 /nfs/dbraw/zinc/39/30/44/588393044.db2.gz DWRVPUPBSGJLDS-SSDOTTSWSA-N 1 2 237.681 2.207 20 0 BEADLO CC(C)c1ccccc1C[NH2+]Cc1ncn(C)n1 ZINC000848545942 588395310 /nfs/dbraw/zinc/39/53/10/588395310.db2.gz NXAGHWTXANHDSJ-UHFFFAOYSA-N 1 2 244.342 2.228 20 0 BEADLO CCc1nc(C[NH2+][C@@H](C)c2cncnc2C)co1 ZINC000848554517 588396507 /nfs/dbraw/zinc/39/65/07/588396507.db2.gz VTBGFIFERNJAHI-VIFPVBQESA-N 1 2 246.314 2.186 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@H]1CC[C@H](C)C1 ZINC000848686316 588405275 /nfs/dbraw/zinc/40/52/75/588405275.db2.gz BJJQEYQUQDHTFB-WPRPVWTQSA-N 1 2 221.304 2.394 20 0 BEADLO Cc1nc(N2Cc3ccncc3C2)c(C)c(C)[nH+]1 ZINC000848726418 588408898 /nfs/dbraw/zinc/40/88/98/588408898.db2.gz DHDUPPDNVDJLSY-UHFFFAOYSA-N 1 2 240.310 2.317 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)OCC(C)C)ccn12 ZINC000848780227 588413796 /nfs/dbraw/zinc/41/37/96/588413796.db2.gz NVWMCKMNIZRLOW-UHFFFAOYSA-N 1 2 232.283 2.456 20 0 BEADLO C[C@@H]1CSCC[N@@H+]1Cc1cnc(Cl)n1C ZINC000848887545 588417621 /nfs/dbraw/zinc/41/76/21/588417621.db2.gz YQZIYRLWNWPROC-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO C[C@@H]1CSCC[N@H+]1Cc1cnc(Cl)n1C ZINC000848887545 588417622 /nfs/dbraw/zinc/41/76/22/588417622.db2.gz YQZIYRLWNWPROC-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO CC1=CCC[N@@H+](Cc2cnc(Cl)n2C)C1 ZINC000848908190 588419728 /nfs/dbraw/zinc/41/97/28/588419728.db2.gz OGKPHBWMUMHBKD-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO CC1=CCC[N@H+](Cc2cnc(Cl)n2C)C1 ZINC000848908190 588419730 /nfs/dbraw/zinc/41/97/30/588419730.db2.gz OGKPHBWMUMHBKD-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+]CCc1ccc(C)c(C)c1 ZINC000849323368 588472643 /nfs/dbraw/zinc/47/26/43/588472643.db2.gz OZGSQFQQYQJADC-CYBMUJFWSA-N 1 2 249.354 2.387 20 0 BEADLO CC1(C)CC[C@@H]1C(=O)OCc1cc[nH+]c(N)c1 ZINC000850071985 588518214 /nfs/dbraw/zinc/51/82/14/588518214.db2.gz YQRJXOXXSGVHQL-SNVBAGLBSA-N 1 2 234.299 2.143 20 0 BEADLO Cc1c[nH]c(C[NH2+]Cc2c(C)cccc2F)n1 ZINC000850159193 588522031 /nfs/dbraw/zinc/52/20/31/588522031.db2.gz AJKGOAYLPVPCFQ-UHFFFAOYSA-N 1 2 233.290 2.455 20 0 BEADLO Cc1c[nH]c(CNc2cnn(C(C)(C)C)c2)[nH+]1 ZINC000850229118 588530621 /nfs/dbraw/zinc/53/06/21/588530621.db2.gz UBZKPDIUQDSBCZ-UHFFFAOYSA-N 1 2 233.319 2.282 20 0 BEADLO COc1ccnc(C[NH2+]Cc2ccoc2)c1F ZINC000850381024 588542554 /nfs/dbraw/zinc/54/25/54/588542554.db2.gz UCPKCKKDEWOGRE-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO COc1cc(C)c(C)cc1[NH2+][C@@H](C)CCO ZINC000850500172 588552135 /nfs/dbraw/zinc/55/21/35/588552135.db2.gz BILSITHVCPTZIU-NSHDSACASA-N 1 2 223.316 2.495 20 0 BEADLO c1csc([C@@H]([NH2+][C@@H]2C=CCC2)c2nnc[nH]2)c1 ZINC000850509550 588554500 /nfs/dbraw/zinc/55/45/00/588554500.db2.gz RJRASDWZGBTUDF-MWLCHTKSSA-N 1 2 246.339 2.264 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H]1COC2(CCC2)C1 ZINC000850523910 588556796 /nfs/dbraw/zinc/55/67/96/588556796.db2.gz DQHYVDAYSGHCGX-ONGXEEELSA-N 1 2 235.331 2.080 20 0 BEADLO CSCCNc1cc[nH+]c(C(C)C)n1 ZINC000110114256 588611983 /nfs/dbraw/zinc/61/19/83/588611983.db2.gz XDBIHEXRBBWKJR-UHFFFAOYSA-N 1 2 211.334 2.375 20 0 BEADLO CCOc1ccc(C[N@H+](C)Cc2cnon2)cc1 ZINC000851718930 588616710 /nfs/dbraw/zinc/61/67/10/588616710.db2.gz SPFGOQUPUNYGMU-UHFFFAOYSA-N 1 2 247.298 2.100 20 0 BEADLO CCOc1ccc(C[N@@H+](C)Cc2cnon2)cc1 ZINC000851718930 588616711 /nfs/dbraw/zinc/61/67/11/588616711.db2.gz SPFGOQUPUNYGMU-UHFFFAOYSA-N 1 2 247.298 2.100 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnon2)Cc2ccccc21 ZINC000851720893 588617023 /nfs/dbraw/zinc/61/70/23/588617023.db2.gz VODJEQVZBKAFJB-SNVBAGLBSA-N 1 2 229.283 2.189 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnon2)Cc2ccccc21 ZINC000851720893 588617024 /nfs/dbraw/zinc/61/70/24/588617024.db2.gz VODJEQVZBKAFJB-SNVBAGLBSA-N 1 2 229.283 2.189 20 0 BEADLO CC(C)[N@H+](Cc1cnon1)Cc1ccccc1 ZINC000851724646 588617497 /nfs/dbraw/zinc/61/74/97/588617497.db2.gz CVEQPSLYPWFQQF-UHFFFAOYSA-N 1 2 231.299 2.480 20 0 BEADLO CC(C)[N@@H+](Cc1cnon1)Cc1ccccc1 ZINC000851724646 588617498 /nfs/dbraw/zinc/61/74/98/588617498.db2.gz CVEQPSLYPWFQQF-UHFFFAOYSA-N 1 2 231.299 2.480 20 0 BEADLO C[C@H]1C[N@H+](Cc2cnon2)[C@@H]1c1ccccc1 ZINC000851799400 588630450 /nfs/dbraw/zinc/63/04/50/588630450.db2.gz AEHUBPCMJQDVNO-GWCFXTLKSA-N 1 2 229.283 2.263 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cnon2)[C@@H]1c1ccccc1 ZINC000851799400 588630451 /nfs/dbraw/zinc/63/04/51/588630451.db2.gz AEHUBPCMJQDVNO-GWCFXTLKSA-N 1 2 229.283 2.263 20 0 BEADLO CC1(C)C[N@H+](Cc2cnon2)Cc2ccccc21 ZINC000851871792 588637831 /nfs/dbraw/zinc/63/78/31/588637831.db2.gz VMJCFUHXOKXRSZ-UHFFFAOYSA-N 1 2 243.310 2.363 20 0 BEADLO CC1(C)C[N@@H+](Cc2cnon2)Cc2ccccc21 ZINC000851871792 588637832 /nfs/dbraw/zinc/63/78/32/588637832.db2.gz VMJCFUHXOKXRSZ-UHFFFAOYSA-N 1 2 243.310 2.363 20 0 BEADLO C[C@H]([NH2+]Cc1cnon1)c1ccc(F)cc1F ZINC000851892489 588641304 /nfs/dbraw/zinc/64/13/04/588641304.db2.gz KJWWWOOOVSMJFI-ZETCQYMHSA-N 1 2 239.225 2.199 20 0 BEADLO CCOc1ccc([C@H](C)[NH2+]Cc2cnon2)cc1 ZINC000851893956 588641831 /nfs/dbraw/zinc/64/18/31/588641831.db2.gz OSRQASMSCYWOCO-JTQLQIEISA-N 1 2 247.298 2.319 20 0 BEADLO c1nonc1C[N@@H+]1Cc2ccccc2C2(CC2)C1 ZINC000851951408 588647644 /nfs/dbraw/zinc/64/76/44/588647644.db2.gz MYRLIFMHBXXIHJ-UHFFFAOYSA-N 1 2 241.294 2.117 20 0 BEADLO c1nonc1C[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000851951408 588647645 /nfs/dbraw/zinc/64/76/45/588647645.db2.gz MYRLIFMHBXXIHJ-UHFFFAOYSA-N 1 2 241.294 2.117 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cccc(F)n2)[C@@H](C)[C@@H](C)O1 ZINC000851967771 588648765 /nfs/dbraw/zinc/64/87/65/588648765.db2.gz FINPGGJLFVBPDM-OUAUKWLOSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cccc(F)n2)[C@@H](C)[C@@H](C)O1 ZINC000851967771 588648766 /nfs/dbraw/zinc/64/87/66/588648766.db2.gz FINPGGJLFVBPDM-OUAUKWLOSA-N 1 2 238.306 2.218 20 0 BEADLO FC(F)OCC[N@@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000852040140 588656979 /nfs/dbraw/zinc/65/69/79/588656979.db2.gz RDLLKIVQAFXUPF-JTQLQIEISA-N 1 2 245.273 2.176 20 0 BEADLO FC(F)OCC[N@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000852040140 588656980 /nfs/dbraw/zinc/65/69/80/588656980.db2.gz RDLLKIVQAFXUPF-JTQLQIEISA-N 1 2 245.273 2.176 20 0 BEADLO COc1cc(C[N@@H+]2CCC[C@](C)(F)C2)sn1 ZINC000852096094 588661909 /nfs/dbraw/zinc/66/19/09/588661909.db2.gz IDAABLBNPRLBDF-NSHDSACASA-N 1 2 244.335 2.476 20 0 BEADLO COc1cc(C[N@H+]2CCC[C@](C)(F)C2)sn1 ZINC000852096094 588661910 /nfs/dbraw/zinc/66/19/10/588661910.db2.gz IDAABLBNPRLBDF-NSHDSACASA-N 1 2 244.335 2.476 20 0 BEADLO COCC[N@H+](CCF)Cc1cc(F)cc(F)c1 ZINC000852482222 588684515 /nfs/dbraw/zinc/68/45/15/588684515.db2.gz YWHDZROTFOFUPR-UHFFFAOYSA-N 1 2 247.260 2.383 20 0 BEADLO COCC[N@@H+](CCF)Cc1cc(F)cc(F)c1 ZINC000852482222 588684516 /nfs/dbraw/zinc/68/45/16/588684516.db2.gz YWHDZROTFOFUPR-UHFFFAOYSA-N 1 2 247.260 2.383 20 0 BEADLO CC1(C)C[C@@]1([NH2+]Cc1cnon1)c1ccccc1 ZINC000852772210 588701462 /nfs/dbraw/zinc/70/14/62/588701462.db2.gz HNYDOXQXLSHPFP-CQSZACIVSA-N 1 2 243.310 2.485 20 0 BEADLO CC(C)(C)c1nnc(C[N@@H+]2CC3CC2(C)C3)o1 ZINC000852785829 588702140 /nfs/dbraw/zinc/70/21/40/588702140.db2.gz QKKUULKFMXNVPD-UHFFFAOYSA-N 1 2 235.331 2.351 20 0 BEADLO CC(C)(C)c1nnc(C[N@H+]2CC3CC2(C)C3)o1 ZINC000852785829 588702141 /nfs/dbraw/zinc/70/21/41/588702141.db2.gz QKKUULKFMXNVPD-UHFFFAOYSA-N 1 2 235.331 2.351 20 0 BEADLO O=C(OCc1cccc2[nH+]ccn21)C12CC(C1)C2 ZINC000860615894 589110270 /nfs/dbraw/zinc/11/02/70/589110270.db2.gz DRERZXNPWMEOJD-UHFFFAOYSA-N 1 2 242.278 2.178 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccnc(F)c2C)no1 ZINC000862275765 589198777 /nfs/dbraw/zinc/19/87/77/589198777.db2.gz ZGIOQICXHHBMSB-UHFFFAOYSA-N 1 2 235.262 2.115 20 0 BEADLO Cc1c(C[N@@H+](C(C)C)C2COC2)ccnc1F ZINC000862382420 589206517 /nfs/dbraw/zinc/20/65/17/589206517.db2.gz SIZBXZIXNCFILY-UHFFFAOYSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1c(C[N@H+](C(C)C)C2COC2)ccnc1F ZINC000862382420 589206519 /nfs/dbraw/zinc/20/65/19/589206519.db2.gz SIZBXZIXNCFILY-UHFFFAOYSA-N 1 2 238.306 2.138 20 0 BEADLO Fc1c(C[N@@H+]2C[C@@H]3C[C@@H]3C2)ccnc1Cl ZINC000862444009 589213726 /nfs/dbraw/zinc/21/37/26/589213726.db2.gz VYJFTANLRSIICE-DTORHVGOSA-N 1 2 226.682 2.326 20 0 BEADLO Fc1c(C[N@H+]2C[C@@H]3C[C@@H]3C2)ccnc1Cl ZINC000862444009 589213727 /nfs/dbraw/zinc/21/37/27/589213727.db2.gz VYJFTANLRSIICE-DTORHVGOSA-N 1 2 226.682 2.326 20 0 BEADLO Cc1cc(C[NH+]2CC3(C2)CCCO3)c(C)o1 ZINC000862484489 589217150 /nfs/dbraw/zinc/21/71/50/589217150.db2.gz QMELBYFXNCDMOQ-UHFFFAOYSA-N 1 2 221.300 2.261 20 0 BEADLO Fc1cc(C[NH+]2CC(Cc3ccco3)C2)ccn1 ZINC000862487223 589217368 /nfs/dbraw/zinc/21/73/68/589217368.db2.gz OQJHVRRJGHBJPA-UHFFFAOYSA-N 1 2 246.285 2.488 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@H](CCF)C2)c(C)o1 ZINC000862529079 589217816 /nfs/dbraw/zinc/21/78/16/589217816.db2.gz AMJDZQSIKUQJSO-CYBMUJFWSA-N 1 2 241.306 2.457 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@H](CCF)C2)c(C)o1 ZINC000862529079 589217817 /nfs/dbraw/zinc/21/78/17/589217817.db2.gz AMJDZQSIKUQJSO-CYBMUJFWSA-N 1 2 241.306 2.457 20 0 BEADLO C[C@@H]1C[C@@H]1CO[NH+]=C(N)Cc1cccs1 ZINC000863457281 589288302 /nfs/dbraw/zinc/28/83/02/589288302.db2.gz RCZVUVBSXCAWIR-RKDXNWHRSA-N 1 2 224.329 2.445 20 0 BEADLO C[C@@H]1C[C@@H]1CO[NH+]=C(N)COc1ccccc1 ZINC000863453027 589288910 /nfs/dbraw/zinc/28/89/10/589288910.db2.gz AOWVERGEQWHNLU-GHMZBOCLSA-N 1 2 234.299 2.220 20 0 BEADLO C[C@H]1C[C@@H]1CO[NH+]=C(N)Cc1cccs1 ZINC000863457278 589289335 /nfs/dbraw/zinc/28/93/35/589289335.db2.gz RCZVUVBSXCAWIR-DTWKUNHWSA-N 1 2 224.329 2.445 20 0 BEADLO COC1(C(N)=[NH+]OC[C@@H]2C[C@H]2C)CCCC1 ZINC000863477522 589292046 /nfs/dbraw/zinc/29/20/46/589292046.db2.gz NSHLVYVJWTUQFY-ZJUUUORDSA-N 1 2 226.320 2.100 20 0 BEADLO COC1(C(N)=[NH+]OCCC(C)C)CCCC1 ZINC000863477875 589292058 /nfs/dbraw/zinc/29/20/58/589292058.db2.gz ZQYKZHPDLMUNOR-UHFFFAOYSA-N 1 2 228.336 2.490 20 0 BEADLO COC1(C(N)=[NH+]O[C@@H](C)C(C)C)CCCC1 ZINC000863476857 589292183 /nfs/dbraw/zinc/29/21/83/589292183.db2.gz AGIPRPJIIGAVCP-JTQLQIEISA-N 1 2 228.336 2.489 20 0 BEADLO CC[C@H](C)CO[NH+]=C(N)C1(OC)CCCC1 ZINC000863477936 589292283 /nfs/dbraw/zinc/29/22/83/589292283.db2.gz CPFMXWZRDTZJEF-JTQLQIEISA-N 1 2 228.336 2.490 20 0 BEADLO COC1(C(N)=[NH+]O[C@H](C)C(C)C)CCCC1 ZINC000863476858 589292287 /nfs/dbraw/zinc/29/22/87/589292287.db2.gz AGIPRPJIIGAVCP-SNVBAGLBSA-N 1 2 228.336 2.489 20 0 BEADLO CC[C@H]1CC[N@H+](Cn2ncsc2=S)C1 ZINC000119579376 589309612 /nfs/dbraw/zinc/30/96/12/589309612.db2.gz VDUNVWBMBZABLK-QMMMGPOBSA-N 1 2 229.374 2.363 20 0 BEADLO CC[C@H]1CC[N@@H+](Cn2ncsc2=S)C1 ZINC000119579376 589309614 /nfs/dbraw/zinc/30/96/14/589309614.db2.gz VDUNVWBMBZABLK-QMMMGPOBSA-N 1 2 229.374 2.363 20 0 BEADLO Cc1[nH]cc(-c2cccc3c2OCCO3)[nH+]1 ZINC000863696362 589311463 /nfs/dbraw/zinc/31/14/63/589311463.db2.gz CHOIPHVOJCHASS-UHFFFAOYSA-N 1 2 216.240 2.156 20 0 BEADLO Cc1[nH]cc(-c2cnn([C@H]3CCCCO3)c2)[nH+]1 ZINC000863727944 589313331 /nfs/dbraw/zinc/31/33/31/589313331.db2.gz OQAHLQRSKUPUNT-GFCCVEGCSA-N 1 2 232.287 2.281 20 0 BEADLO C[C@H](O)c1cccc(N[C@H]2C[C@@H](C)O[C@H]2C)[nH+]1 ZINC000864088908 589343008 /nfs/dbraw/zinc/34/30/08/589343008.db2.gz IMDKZBLCDPPWPH-WDCWCFNPSA-N 1 2 236.315 2.113 20 0 BEADLO C[C@H](O)c1cccc(N[C@H]2COC(C)(C)C2)[nH+]1 ZINC000864090193 589343633 /nfs/dbraw/zinc/34/36/33/589343633.db2.gz BQYOLRMKNPSPAD-VHSXEESVSA-N 1 2 236.315 2.114 20 0 BEADLO C[C@H](O)c1ccc(N2CC3CC2(C)C3)[nH+]c1 ZINC000864092921 589343931 /nfs/dbraw/zinc/34/39/31/589343931.db2.gz CBUDACHUMDBTRY-JBLZRFIASA-N 1 2 218.300 2.124 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)[C@@H]1C[C@H]1C(C)(C)C ZINC000864883634 589399690 /nfs/dbraw/zinc/39/96/90/589399690.db2.gz DMSQOFPCCUNISZ-IJLUTSLNSA-N 1 2 249.358 2.070 20 0 BEADLO COc1cncc(NCc2c[nH+]cn2C(C)C)c1 ZINC000865294548 589420174 /nfs/dbraw/zinc/42/01/74/589420174.db2.gz MASJQWJPHOUSMH-UHFFFAOYSA-N 1 2 246.314 2.480 20 0 BEADLO CC(C)(C)c1cn(Cc2ccno2)c[nH+]1 ZINC000865375738 589428171 /nfs/dbraw/zinc/42/81/71/589428171.db2.gz MKIFLLDNVFTZTM-UHFFFAOYSA-N 1 2 205.261 2.217 20 0 BEADLO CC(C)(C)c1cn(CCC2(O)CCC2)c[nH+]1 ZINC000865376302 589428335 /nfs/dbraw/zinc/42/83/35/589428335.db2.gz IHGDSHDUYDQFDJ-UHFFFAOYSA-N 1 2 222.332 2.486 20 0 BEADLO CC(C)(C)c1cn(C[C@@H]2CCNC(=O)CC2)c[nH+]1 ZINC000865376275 589428515 /nfs/dbraw/zinc/42/85/15/589428515.db2.gz HDXLXIIYMXIKFY-NSHDSACASA-N 1 2 249.358 2.097 20 0 BEADLO CC(C)(O)CCn1c[nH+]c(C(C)(C)C)c1 ZINC000865376314 589428561 /nfs/dbraw/zinc/42/85/61/589428561.db2.gz IUMSUIMBPQVDSR-UHFFFAOYSA-N 1 2 210.321 2.342 20 0 BEADLO COCCNc1[nH+]cc(C(F)(F)F)cc1C ZINC000865397625 589431690 /nfs/dbraw/zinc/43/16/90/589431690.db2.gz QVKFKTMRWZHNLM-UHFFFAOYSA-N 1 2 234.221 2.467 20 0 BEADLO CC[C@@H](C)Nc1nc(N)[nH+]c(C2CCCC2)n1 ZINC000865398256 589431723 /nfs/dbraw/zinc/43/17/23/589431723.db2.gz XNYVUCKGHRIYBS-MRVPVSSYSA-N 1 2 235.335 2.322 20 0 BEADLO CC[C@@H](C)Nc1nc(N)nc(C2CCCC2)[nH+]1 ZINC000865398256 589431724 /nfs/dbraw/zinc/43/17/24/589431724.db2.gz XNYVUCKGHRIYBS-MRVPVSSYSA-N 1 2 235.335 2.322 20 0 BEADLO C[C@@H]1CCN1c1[nH+]cnc2[nH]c(Cl)cc21 ZINC000865463865 589437833 /nfs/dbraw/zinc/43/78/33/589437833.db2.gz FATFNJASXAJBOG-ZCFIWIBFSA-N 1 2 222.679 2.162 20 0 BEADLO CCc1cc(C[NH2+]Cc2cn(C3CC3)cn2)on1 ZINC000865473128 589438946 /nfs/dbraw/zinc/43/89/46/589438946.db2.gz KNGWEGGAAODSTI-UHFFFAOYSA-N 1 2 246.314 2.058 20 0 BEADLO CCc1cc(CNCc2cn(C3CC3)c[nH+]2)on1 ZINC000865473128 589438947 /nfs/dbraw/zinc/43/89/47/589438947.db2.gz KNGWEGGAAODSTI-UHFFFAOYSA-N 1 2 246.314 2.058 20 0 BEADLO CC[C@](C)(O)CNc1cc(CC(C)C)[nH+]cn1 ZINC000865497023 589440892 /nfs/dbraw/zinc/44/08/92/589440892.db2.gz HXKYOFMQXPDTQV-ZDUSSCGKSA-N 1 2 237.347 2.248 20 0 BEADLO CC[C@H](CCO)Nc1cc(CC(C)C)[nH+]cn1 ZINC000865554572 589445685 /nfs/dbraw/zinc/44/56/85/589445685.db2.gz ODGZWFYYEHCWIY-LLVKDONJSA-N 1 2 237.347 2.248 20 0 BEADLO CC(C)Cc1cc(NC[C@H](O)C(C)C)nc[nH+]1 ZINC000865552304 589445853 /nfs/dbraw/zinc/44/58/53/589445853.db2.gz FQJORDJPCWAHHH-LBPRGKRZSA-N 1 2 237.347 2.104 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1C[C@@H]1[C@H]1C[C@H]1C ZINC000865574963 589448095 /nfs/dbraw/zinc/44/80/95/589448095.db2.gz HVAYMSFKWLIERV-SASUGWTJSA-N 1 2 230.311 2.043 20 0 BEADLO CC1(CNc2nc(N)[nH+]c(C3CCCC3)n2)CC1 ZINC000865580835 589448510 /nfs/dbraw/zinc/44/85/10/589448510.db2.gz FOIWMBKYUVPWDO-UHFFFAOYSA-N 1 2 247.346 2.323 20 0 BEADLO CC1(CNc2nc(N)nc(C3CCCC3)[nH+]2)CC1 ZINC000865580835 589448512 /nfs/dbraw/zinc/44/85/12/589448512.db2.gz FOIWMBKYUVPWDO-UHFFFAOYSA-N 1 2 247.346 2.323 20 0 BEADLO COc1cccc(NCc2cn(C3CC3)c[nH+]2)n1 ZINC000865620901 589452097 /nfs/dbraw/zinc/45/20/97/589452097.db2.gz FJXCBXIARZNSAR-UHFFFAOYSA-N 1 2 244.298 2.234 20 0 BEADLO CC(C)Cc1cc(N2CCC(=O)[C@@H](C)C2)nc[nH+]1 ZINC000865686052 589456224 /nfs/dbraw/zinc/45/62/24/589456224.db2.gz CGJWLJDPVTUVDD-NSHDSACASA-N 1 2 247.342 2.090 20 0 BEADLO C=C=CCNc1nc(C)[nH+]c2c1CCCC2 ZINC000865825049 589463484 /nfs/dbraw/zinc/46/34/84/589463484.db2.gz VKMLGPLNUPGGLX-UHFFFAOYSA-N 1 2 215.300 2.417 20 0 BEADLO CC(C)n1ccnc1C[NH2+][C@@H](C)c1ccnn1C ZINC000865838461 589464344 /nfs/dbraw/zinc/46/43/44/589464344.db2.gz WUHNCYQLYHQEOF-NSHDSACASA-N 1 2 247.346 2.048 20 0 BEADLO C[C@@H](O)c1ccc(N2CCC[C@@](C)(F)C2)[nH+]c1 ZINC000865840090 589464408 /nfs/dbraw/zinc/46/44/08/589464408.db2.gz DDRFJISBXBPBJQ-ZWNOBZJWSA-N 1 2 238.306 2.463 20 0 BEADLO CC(C)Cc1cc(NC[C@@H](O)C2CCC2)nc[nH+]1 ZINC000865862924 589465886 /nfs/dbraw/zinc/46/58/86/589465886.db2.gz UHPLNHPWVZIRPL-CYBMUJFWSA-N 1 2 249.358 2.248 20 0 BEADLO CC[C@@H]1OCC[C@H]1Nc1ccc([C@H](C)O)c[nH+]1 ZINC000865871026 589466192 /nfs/dbraw/zinc/46/61/92/589466192.db2.gz HTJDQWXUOMLHOQ-WCQGTBRESA-N 1 2 236.315 2.114 20 0 BEADLO Cc1cc(C(F)(F)F)c[nH+]c1N[C@H]1C[C@H](O)C1 ZINC000865954876 589470270 /nfs/dbraw/zinc/47/02/70/589470270.db2.gz GXUMAASWMSNKII-KYZUINATSA-N 1 2 246.232 2.344 20 0 BEADLO CCc1cc(N2C[C@@H](OC)CC[C@@H]2C)nc(C)[nH+]1 ZINC000866073305 589474797 /nfs/dbraw/zinc/47/47/97/589474797.db2.gz YSPFNAPTFMULGT-GWCFXTLKSA-N 1 2 249.358 2.351 20 0 BEADLO C[C@@]1(C(F)(F)F)CN(c2cccc[nH+]2)CCO1 ZINC000866159910 589478516 /nfs/dbraw/zinc/47/85/16/589478516.db2.gz PMTKQWKCISNAIQ-JTQLQIEISA-N 1 2 246.232 2.239 20 0 BEADLO c1ccc(N2CC[C@H]3CSC[C@@H]3C2)[nH+]c1 ZINC000866205619 589480103 /nfs/dbraw/zinc/48/01/03/589480103.db2.gz GOOQJTXWZRLOCO-QWRGUYRKSA-N 1 2 220.341 2.271 20 0 BEADLO Cc1nc(N2CC(OC(C)(C)C)C2)c(C)c(C)[nH+]1 ZINC000866279066 589482205 /nfs/dbraw/zinc/48/22/05/589482205.db2.gz HKRHZCYDOWIYET-UHFFFAOYSA-N 1 2 249.358 2.406 20 0 BEADLO C[C@H](Nc1cc[nH+]c(C2CC2)n1)c1ccnn1C ZINC000866251710 589483002 /nfs/dbraw/zinc/48/30/02/589483002.db2.gz PPHBTBQPFZFDJR-VIFPVBQESA-N 1 2 243.314 2.261 20 0 BEADLO CCc1nc(N2CC(OC(C)(C)C)C2)cc(C)[nH+]1 ZINC000866278887 589484082 /nfs/dbraw/zinc/48/40/82/589484082.db2.gz BPOOMMRPOJVUFN-UHFFFAOYSA-N 1 2 249.358 2.351 20 0 BEADLO CC[C@@H](C[C@@H](C)O)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000866300947 589484766 /nfs/dbraw/zinc/48/47/66/589484766.db2.gz ZZERZMJRLFRGET-SCZZXKLOSA-N 1 2 248.330 2.228 20 0 BEADLO CC[C@@H](C[C@H](C)O)Nc1cc[nH+]c2ccncc12 ZINC000866300855 589484784 /nfs/dbraw/zinc/48/47/84/589484784.db2.gz YGCBHMQWMFFGJU-QWRGUYRKSA-N 1 2 245.326 2.013 20 0 BEADLO CC[C@H](C[C@@H](C)O)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000866300946 589484921 /nfs/dbraw/zinc/48/49/21/589484921.db2.gz ZZERZMJRLFRGET-PSASIEDQSA-N 1 2 248.330 2.228 20 0 BEADLO CC(C)(F)C[NH2+][C@H]1CCCc2[nH]ncc21 ZINC000866409407 589491063 /nfs/dbraw/zinc/49/10/63/589491063.db2.gz LIMMQAYAQVTOHX-VIFPVBQESA-N 1 2 211.284 2.125 20 0 BEADLO CCn1ccnc1[C@@H](C)[NH2+][C@H](C)c1ccnn1C ZINC000866613991 589505088 /nfs/dbraw/zinc/50/50/88/589505088.db2.gz KRCOZYAREUSMNQ-GHMZBOCLSA-N 1 2 247.346 2.048 20 0 BEADLO CC(C)C[C@H](C)OC(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000867756031 589533210 /nfs/dbraw/zinc/53/32/10/589533210.db2.gz DLMJVDSFVVVRPB-JTQLQIEISA-N 1 2 239.319 2.413 20 0 BEADLO CC/C=C(\F)C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000868738072 589575065 /nfs/dbraw/zinc/57/50/65/589575065.db2.gz HDLDNLFKEBHANV-SZGBIDFHSA-N 1 2 237.278 2.269 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)[C@@H]1C[C@H]1C(C)(C)C ZINC000869222967 589592775 /nfs/dbraw/zinc/59/27/75/589592775.db2.gz BLGUIYXQIOINTF-GHMZBOCLSA-N 1 2 235.331 2.050 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)[C@@H]1C[C@H]1C(C)(C)C ZINC000869222967 589592776 /nfs/dbraw/zinc/59/27/76/589592776.db2.gz BLGUIYXQIOINTF-GHMZBOCLSA-N 1 2 235.331 2.050 20 0 BEADLO C[C@H](NC(=O)[C@@]12C[C@@H]1CCCC2)c1[nH+]ccn1C ZINC000869301568 589596985 /nfs/dbraw/zinc/59/69/85/589596985.db2.gz HDQBCTCPAVFZGK-MJVIPROJSA-N 1 2 247.342 2.178 20 0 BEADLO C[C@@H]1C[C@@H]1[C@H]1C[C@H]1C(=O)OCCCn1cc[nH+]c1 ZINC000869886302 589635207 /nfs/dbraw/zinc/63/52/07/589635207.db2.gz DVDXZPATXZOKAS-YVECIDJPSA-N 1 2 248.326 2.109 20 0 BEADLO CC1(C)CCc2onc(Cn3cc[nH+]c3)c2C1 ZINC000871663631 589785147 /nfs/dbraw/zinc/78/51/47/589785147.db2.gz JVGRHWVDQORXKS-UHFFFAOYSA-N 1 2 231.299 2.434 20 0 BEADLO FC(F)Cn1cc[nH+]c1CSc1ncco1 ZINC000871668136 589787142 /nfs/dbraw/zinc/78/71/42/589787142.db2.gz JFNFKDKIILNQFB-UHFFFAOYSA-N 1 2 245.254 2.429 20 0 BEADLO CC(C)C[C@@H](C)O[NH+]=C(N)COC1CCC1 ZINC000871778702 589814655 /nfs/dbraw/zinc/81/46/55/589814655.db2.gz STIHGPQQRGMMLZ-SNVBAGLBSA-N 1 2 228.336 2.489 20 0 BEADLO CCC[C@@H]([NH2+]Cc1nonc1C)c1cccnc1 ZINC000872136781 589878978 /nfs/dbraw/zinc/87/89/78/589878978.db2.gz OXDVPXKHAGKMSX-GFCCVEGCSA-N 1 2 246.314 2.404 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2nonc2C)oc1C ZINC000872137326 589879449 /nfs/dbraw/zinc/87/94/49/589879449.db2.gz SAXJDWDLZJIFKB-SECBINFHSA-N 1 2 235.287 2.439 20 0 BEADLO Cc1c[nH+]ccc1CCNc1ncnc(F)c1C ZINC000872494787 589944817 /nfs/dbraw/zinc/94/48/17/589944817.db2.gz KBBLSAVKOPFBSG-UHFFFAOYSA-N 1 2 246.289 2.282 20 0 BEADLO c1ccc(NC[C@@H]2C[C@H]3CCC[C@H]3O2)[nH+]c1 ZINC000872699876 589962834 /nfs/dbraw/zinc/96/28/34/589962834.db2.gz VJUYCHDSVDOBPM-GRYCIOLGSA-N 1 2 218.300 2.451 20 0 BEADLO COC(=O)CC[C@H]1CCCN(c2cccc[nH+]2)C1 ZINC000872750191 589966362 /nfs/dbraw/zinc/96/63/62/589966362.db2.gz OVLKBRLIFODOSX-GFCCVEGCSA-N 1 2 248.326 2.251 20 0 BEADLO CCc1cc(N[C@@H](C)c2nccnc2C)nc[nH+]1 ZINC000872767995 589966800 /nfs/dbraw/zinc/96/68/00/589966800.db2.gz GHYZWSMNFKRNRN-JTQLQIEISA-N 1 2 243.314 2.311 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@H]2CC23CCC3)c1 ZINC000872774874 589967272 /nfs/dbraw/zinc/96/72/72/589967272.db2.gz JTZKKBSMCRKORV-NSHDSACASA-N 1 2 246.310 2.152 20 0 BEADLO CCOc1ccc([NH2+][C@@H]2CCNC(=O)CC2)cc1 ZINC000873009663 589979138 /nfs/dbraw/zinc/97/91/38/589979138.db2.gz QPWGJJUGEPIMPG-LBPRGKRZSA-N 1 2 248.326 2.166 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccn[nH]1)[C@@H](O)c1ccccc1 ZINC000873195159 589991263 /nfs/dbraw/zinc/99/12/63/589991263.db2.gz YKBHYCVOQQFYLL-KGLIPLIRSA-N 1 2 245.326 2.012 20 0 BEADLO CCC[C@@H](CC)C(=O)O[C@@H]1CC[N@H+](CCF)C1 ZINC000873525596 590053989 /nfs/dbraw/zinc/05/39/89/590053989.db2.gz XYEWHTNCCZYLOZ-VXGBXAGGSA-N 1 2 245.338 2.400 20 0 BEADLO CCC[C@@H](CC)C(=O)O[C@@H]1CC[N@@H+](CCF)C1 ZINC000873525596 590053993 /nfs/dbraw/zinc/05/39/93/590053993.db2.gz XYEWHTNCCZYLOZ-VXGBXAGGSA-N 1 2 245.338 2.400 20 0 BEADLO CCC[C@@H](CC)C(=O)O[C@H]1CC[N@H+](CCF)C1 ZINC000873525593 590054048 /nfs/dbraw/zinc/05/40/48/590054048.db2.gz XYEWHTNCCZYLOZ-NEPJUHHUSA-N 1 2 245.338 2.400 20 0 BEADLO CCC[C@@H](CC)C(=O)O[C@H]1CC[N@@H+](CCF)C1 ZINC000873525593 590054050 /nfs/dbraw/zinc/05/40/50/590054050.db2.gz XYEWHTNCCZYLOZ-NEPJUHHUSA-N 1 2 245.338 2.400 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2ncc[nH]2)o1 ZINC000124673270 590071787 /nfs/dbraw/zinc/07/17/87/590071787.db2.gz FAEOQGISCVDUIB-SECBINFHSA-N 1 2 205.261 2.162 20 0 BEADLO CCOc1ccc([NH2+]CC[C@H](C)O)cc1 ZINC000125349624 590162223 /nfs/dbraw/zinc/16/22/23/590162223.db2.gz KJISOSWNNBIUBQ-JTQLQIEISA-N 1 2 209.289 2.268 20 0 BEADLO COc1cnc(F)c(C[NH+]2[C@H](C)C[C@H]2C)c1 ZINC000877488206 590338951 /nfs/dbraw/zinc/33/89/51/590338951.db2.gz ZNPMHRKWEFYHFM-RKDXNWHRSA-N 1 2 224.279 2.212 20 0 BEADLO CC[N@H+](Cc1nc(Cl)cs1)[C@@H]1CCOC1 ZINC000877544382 590353504 /nfs/dbraw/zinc/35/35/04/590353504.db2.gz OYQSNCBMMSCURI-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO CC[N@@H+](Cc1nc(Cl)cs1)[C@@H]1CCOC1 ZINC000877544382 590353506 /nfs/dbraw/zinc/35/35/06/590353506.db2.gz OYQSNCBMMSCURI-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO COc1c(C)cnc(C[NH+]2CC3(CC3)C2)c1C ZINC000877556512 590357876 /nfs/dbraw/zinc/35/78/76/590357876.db2.gz UDAAJHGPZGKEBY-UHFFFAOYSA-N 1 2 232.327 2.303 20 0 BEADLO Cc1ncc([C@H](C)[NH2+]C(CF)CF)c(C)n1 ZINC000877559706 590358735 /nfs/dbraw/zinc/35/87/35/590358735.db2.gz SMGQRTVAEYVRGK-QMMMGPOBSA-N 1 2 229.274 2.052 20 0 BEADLO O=c1[nH]ccc2oc(C[N@H+]3CC[C@@H](F)C3)cc21 ZINC000877558710 590359287 /nfs/dbraw/zinc/35/92/87/590359287.db2.gz LROFELGMHKXMOJ-MRVPVSSYSA-N 1 2 236.246 2.077 20 0 BEADLO O=c1[nH]ccc2oc(C[N@@H+]3CC[C@@H](F)C3)cc21 ZINC000877558710 590359289 /nfs/dbraw/zinc/35/92/89/590359289.db2.gz LROFELGMHKXMOJ-MRVPVSSYSA-N 1 2 236.246 2.077 20 0 BEADLO CCc1nc(C[NH2+]Cc2cc(C)ns2)co1 ZINC000877570694 590362173 /nfs/dbraw/zinc/36/21/73/590362173.db2.gz MZBLTNIOMULHJL-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO CN(C)c1c[nH+]cc(NC[C@@H]2CCC=CO2)c1 ZINC000877668038 590389589 /nfs/dbraw/zinc/38/95/89/590389589.db2.gz MOWLKIUHABMMME-ZDUSSCGKSA-N 1 2 233.315 2.252 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@@H+]1CCc2ccccc2C1 ZINC000126650295 590391818 /nfs/dbraw/zinc/39/18/18/590391818.db2.gz ROADFEINENVOIV-GFCCVEGCSA-N 1 2 247.338 2.386 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@H+]1CCc2ccccc2C1 ZINC000126650295 590391821 /nfs/dbraw/zinc/39/18/21/590391821.db2.gz ROADFEINENVOIV-GFCCVEGCSA-N 1 2 247.338 2.386 20 0 BEADLO Cc1ccc(C[NH2+]Cc2ccc(Cl)nn2)o1 ZINC000877697863 590393493 /nfs/dbraw/zinc/39/34/93/590393493.db2.gz OMEIJDZITHNPEA-UHFFFAOYSA-N 1 2 237.690 2.321 20 0 BEADLO C[C@@H](O)c1ncc(C[NH+]2CC(C)(C)C2)s1 ZINC000877717336 590400152 /nfs/dbraw/zinc/40/01/52/590400152.db2.gz IQZWUSVELQONPK-MRVPVSSYSA-N 1 2 226.345 2.038 20 0 BEADLO CC1(C)C[NH+](Cc2cc(F)ncc2F)C1 ZINC000877717057 590400156 /nfs/dbraw/zinc/40/01/56/590400156.db2.gz DPIQLARDYRSBEX-UHFFFAOYSA-N 1 2 212.243 2.202 20 0 BEADLO C[C@@H]1CCC[C@H](C2C[NH+](Cc3ncnn3C)C2)C1 ZINC000877763580 590420124 /nfs/dbraw/zinc/42/01/24/590420124.db2.gz CRJZNNZSFLBUSN-NEPJUHHUSA-N 1 2 248.374 2.073 20 0 BEADLO Cc1ncc(C[NH+]2CC(OC(C)(C)C)C2)s1 ZINC000877772114 590422656 /nfs/dbraw/zinc/42/26/56/590422656.db2.gz NXVJXWGVUOBJIB-UHFFFAOYSA-N 1 2 240.372 2.451 20 0 BEADLO FC(F)(F)[C@H]1CC[N@H+](Cc2ccoc2)CCO1 ZINC000877820451 590427913 /nfs/dbraw/zinc/42/79/13/590427913.db2.gz PTCSDIFTZNFWSD-SNVBAGLBSA-N 1 2 249.232 2.433 20 0 BEADLO FC(F)(F)[C@H]1CC[N@@H+](Cc2ccoc2)CCO1 ZINC000877820451 590427914 /nfs/dbraw/zinc/42/79/14/590427914.db2.gz PTCSDIFTZNFWSD-SNVBAGLBSA-N 1 2 249.232 2.433 20 0 BEADLO OC1CC[NH+](Cc2cc(C(F)(F)F)co2)CC1 ZINC000877943949 590453841 /nfs/dbraw/zinc/45/38/41/590453841.db2.gz HLEYVMJRMRRMIJ-UHFFFAOYSA-N 1 2 249.232 2.255 20 0 BEADLO C[N@H+](Cc1scnc1Cl)C1CC1 ZINC000877966131 590460019 /nfs/dbraw/zinc/46/00/19/590460019.db2.gz ARGAVEFLNXTPIW-UHFFFAOYSA-N 1 2 202.710 2.391 20 0 BEADLO C[N@@H+](Cc1scnc1Cl)C1CC1 ZINC000877966131 590460020 /nfs/dbraw/zinc/46/00/20/590460020.db2.gz ARGAVEFLNXTPIW-UHFFFAOYSA-N 1 2 202.710 2.391 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)C[C@H]1CCCC(C)(C)O1 ZINC000878098325 590493142 /nfs/dbraw/zinc/49/31/42/590493142.db2.gz WRVXNZKARIOWNA-GFCCVEGCSA-N 1 2 237.347 2.189 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)C[C@H]1CCCC(C)(C)O1 ZINC000878098325 590493144 /nfs/dbraw/zinc/49/31/44/590493144.db2.gz WRVXNZKARIOWNA-GFCCVEGCSA-N 1 2 237.347 2.189 20 0 BEADLO C[N@@H+](Cc1ccon1)C[C@@H]1C[C@H]2CCC[C@H]2O1 ZINC000878126308 590500938 /nfs/dbraw/zinc/50/09/38/590500938.db2.gz WZKLKXZIDNLKEI-KGYLQXTDSA-N 1 2 236.315 2.064 20 0 BEADLO C[N@H+](Cc1ccon1)C[C@@H]1C[C@H]2CCC[C@H]2O1 ZINC000878126308 590500939 /nfs/dbraw/zinc/50/09/39/590500939.db2.gz WZKLKXZIDNLKEI-KGYLQXTDSA-N 1 2 236.315 2.064 20 0 BEADLO C[N@@H+](Cc1ccon1)C[C@@H]1CCCC(C)(C)O1 ZINC000878125909 590501746 /nfs/dbraw/zinc/50/17/46/590501746.db2.gz QQKLHFMUKWWIFD-LBPRGKRZSA-N 1 2 238.331 2.454 20 0 BEADLO C[N@H+](Cc1ccon1)C[C@@H]1CCCC(C)(C)O1 ZINC000878125909 590501749 /nfs/dbraw/zinc/50/17/49/590501749.db2.gz QQKLHFMUKWWIFD-LBPRGKRZSA-N 1 2 238.331 2.454 20 0 BEADLO C[N@@H+](Cc1ccon1)C[C@@H]1C[C@@H]2CCC[C@@H]2O1 ZINC000878126306 590502025 /nfs/dbraw/zinc/50/20/25/590502025.db2.gz WZKLKXZIDNLKEI-DRZSPHRISA-N 1 2 236.315 2.064 20 0 BEADLO C[N@H+](Cc1ccon1)C[C@@H]1C[C@@H]2CCC[C@@H]2O1 ZINC000878126306 590502028 /nfs/dbraw/zinc/50/20/28/590502028.db2.gz WZKLKXZIDNLKEI-DRZSPHRISA-N 1 2 236.315 2.064 20 0 BEADLO C[C@@H](C[N@H+](C)Cc1nnc[nH]1)CC(C)(C)C ZINC000878175788 590515800 /nfs/dbraw/zinc/51/58/00/590515800.db2.gz BVQRMGUZZBSVMX-SNVBAGLBSA-N 1 2 224.352 2.309 20 0 BEADLO C[C@@H](C[N@@H+](C)Cc1nnc[nH]1)CC(C)(C)C ZINC000878175788 590515802 /nfs/dbraw/zinc/51/58/02/590515802.db2.gz BVQRMGUZZBSVMX-SNVBAGLBSA-N 1 2 224.352 2.309 20 0 BEADLO CC(=O)C[NH2+][C@H](C)c1c(F)cccc1F ZINC000878349565 590553506 /nfs/dbraw/zinc/55/35/06/590553506.db2.gz CTUDXSCXKGXGET-MRVPVSSYSA-N 1 2 213.227 2.204 20 0 BEADLO Cc1conc1C[NH2+][C@@H](CCO)c1ccccc1 ZINC000878350706 590553834 /nfs/dbraw/zinc/55/38/34/590553834.db2.gz RNKBGBKAWWPOJA-ZDUSSCGKSA-N 1 2 246.310 2.196 20 0 BEADLO CC(=O)C[NH2+][C@@H](C)c1c(F)cccc1F ZINC000878349566 590553928 /nfs/dbraw/zinc/55/39/28/590553928.db2.gz CTUDXSCXKGXGET-QMMMGPOBSA-N 1 2 213.227 2.204 20 0 BEADLO Cc1conc1C[NH2+][C@@H](CO)c1ccccc1C ZINC000878396524 590559586 /nfs/dbraw/zinc/55/95/86/590559586.db2.gz JGUZXQAMLAJCPM-AWEZNQCLSA-N 1 2 246.310 2.115 20 0 BEADLO Cc1conc1C[NH+]1CC(C)(C)OC(C)(C)C1 ZINC000878486107 590578380 /nfs/dbraw/zinc/57/83/80/590578380.db2.gz WMJVNHNZYUQGNV-UHFFFAOYSA-N 1 2 238.331 2.372 20 0 BEADLO C=C/C=C/CC[N@@H+]1CCC[C@H](C2N=NC(=O)O2)C1 ZINC000878549358 590590745 /nfs/dbraw/zinc/59/07/45/590590745.db2.gz FHKQVBZNMROLGM-UFFNRZRYSA-N 1 2 249.314 2.087 20 0 BEADLO C=C/C=C/CC[N@H+]1CCC[C@H](C2N=NC(=O)O2)C1 ZINC000878549358 590590747 /nfs/dbraw/zinc/59/07/47/590590747.db2.gz FHKQVBZNMROLGM-UFFNRZRYSA-N 1 2 249.314 2.087 20 0 BEADLO c1cc2c(cn1)C[N@H+](C[C@H]1CCC3(CCC3)O1)C2 ZINC000878609285 590595464 /nfs/dbraw/zinc/59/54/64/590595464.db2.gz WEXDQSMTEITWAU-CQSZACIVSA-N 1 2 244.338 2.499 20 0 BEADLO c1cc2c(cn1)C[N@@H+](C[C@H]1CCC3(CCC3)O1)C2 ZINC000878609285 590595466 /nfs/dbraw/zinc/59/54/66/590595466.db2.gz WEXDQSMTEITWAU-CQSZACIVSA-N 1 2 244.338 2.499 20 0 BEADLO CC(C)(C)SCCC[NH2+][C@@]1(C)CCOC1=O ZINC000878632690 590598534 /nfs/dbraw/zinc/59/85/34/590598534.db2.gz RXQMMWSRBHEXNB-LBPRGKRZSA-N 1 2 245.388 2.203 20 0 BEADLO C[N@H+](Cc1scnc1Cl)C1(CO)CCC1 ZINC000878644364 590600609 /nfs/dbraw/zinc/60/06/09/590600609.db2.gz XPGMUZWGHJFYJR-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO C[N@@H+](Cc1scnc1Cl)C1(CO)CCC1 ZINC000878644364 590600610 /nfs/dbraw/zinc/60/06/10/590600610.db2.gz XPGMUZWGHJFYJR-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO Cc1conc1C[N@@H+]1CCC[C@](C)(F)C1 ZINC000878660798 590604916 /nfs/dbraw/zinc/60/49/16/590604916.db2.gz ZCNVBMZZKVSNHC-NSHDSACASA-N 1 2 212.268 2.307 20 0 BEADLO Cc1conc1C[N@H+]1CCC[C@](C)(F)C1 ZINC000878660798 590604918 /nfs/dbraw/zinc/60/49/18/590604918.db2.gz ZCNVBMZZKVSNHC-NSHDSACASA-N 1 2 212.268 2.307 20 0 BEADLO CC[C@H]1CCC[C@@]1(C)C(=O)NCCc1[nH]cc[nH+]1 ZINC000878798794 590625122 /nfs/dbraw/zinc/62/51/22/590625122.db2.gz XBBOORPJNYCFJQ-SMDDNHRTSA-N 1 2 249.358 2.285 20 0 BEADLO CC[C@H]1C[N@H+](Cc2nocc2C)[C@@H](CC)CO1 ZINC000878803892 590625475 /nfs/dbraw/zinc/62/54/75/590625475.db2.gz NBINSCLRVGMSKJ-RYUDHWBXSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2nocc2C)[C@@H](CC)CO1 ZINC000878803892 590625477 /nfs/dbraw/zinc/62/54/77/590625477.db2.gz NBINSCLRVGMSKJ-RYUDHWBXSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@H]1CCC[C@]1(C)C(=O)NCc1c[nH+]c[nH]1 ZINC000878907881 590645212 /nfs/dbraw/zinc/64/52/12/590645212.db2.gz RJIWCVUNGJAZFI-GWCFXTLKSA-N 1 2 235.331 2.242 20 0 BEADLO CC[C@H]1CCC[C@]1(C)C(=O)NCc1c[nH]c[nH+]1 ZINC000878907881 590645218 /nfs/dbraw/zinc/64/52/18/590645218.db2.gz RJIWCVUNGJAZFI-GWCFXTLKSA-N 1 2 235.331 2.242 20 0 BEADLO Cl/C=C/C[N@@H+]1CCC[C@H]1c1ncccn1 ZINC000878976421 590666836 /nfs/dbraw/zinc/66/68/36/590666836.db2.gz DFIQKCNKVCAGFP-FWYAXHSGSA-N 1 2 223.707 2.366 20 0 BEADLO Cl/C=C/C[N@H+]1CCC[C@H]1c1ncccn1 ZINC000878976421 590666840 /nfs/dbraw/zinc/66/68/40/590666840.db2.gz DFIQKCNKVCAGFP-FWYAXHSGSA-N 1 2 223.707 2.366 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)C[C@@H]1C[C@H]2CCC[C@H]2O1 ZINC000879188243 590710862 /nfs/dbraw/zinc/71/08/62/590710862.db2.gz IQWITVIXKCRGLG-KWCYVHTRSA-N 1 2 249.358 2.108 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)C[C@@H]1C[C@H]2CCC[C@H]2O1 ZINC000879188243 590710865 /nfs/dbraw/zinc/71/08/65/590710865.db2.gz IQWITVIXKCRGLG-KWCYVHTRSA-N 1 2 249.358 2.108 20 0 BEADLO FCC[NH+]1CCN(c2ccc(F)cc2F)CC1 ZINC000879597310 590825819 /nfs/dbraw/zinc/82/58/19/590825819.db2.gz HMHSNGIENMGIQL-UHFFFAOYSA-N 1 2 244.260 2.056 20 0 BEADLO CC1(C)C[C@H](O)C[N@H+](C/C(Cl)=C/Cl)C1 ZINC000879622862 590837041 /nfs/dbraw/zinc/83/70/41/590837041.db2.gz SRLRXOSRKACSMZ-OTOXVQDCSA-N 1 2 238.158 2.398 20 0 BEADLO CC1(C)C[C@H](O)C[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000879622862 590837043 /nfs/dbraw/zinc/83/70/43/590837043.db2.gz SRLRXOSRKACSMZ-OTOXVQDCSA-N 1 2 238.158 2.398 20 0 BEADLO CCON(CC)Cc1ccc(-n2cc[nH+]c2)nc1 ZINC000879797583 590875196 /nfs/dbraw/zinc/87/51/96/590875196.db2.gz UAOKJAXXRKKVOR-UHFFFAOYSA-N 1 2 246.314 2.041 20 0 BEADLO CCCNc1cc(N(C)C2CCC2)nc[nH+]1 ZINC000128054516 590884498 /nfs/dbraw/zinc/88/44/98/590884498.db2.gz LKMUCYUWIDBYRG-UHFFFAOYSA-N 1 2 220.320 2.287 20 0 BEADLO CCCNc1cc(N(C)C2CCC2)[nH+]cn1 ZINC000128054516 590884500 /nfs/dbraw/zinc/88/45/00/590884500.db2.gz LKMUCYUWIDBYRG-UHFFFAOYSA-N 1 2 220.320 2.287 20 0 BEADLO CCOC(=O)[C@@H](CC1CC1)[NH2+][C@H]1C=CCCC1 ZINC000879982564 590904040 /nfs/dbraw/zinc/90/40/40/590904040.db2.gz GYQSUFUBUXMFDX-QWHCGFSZSA-N 1 2 237.343 2.417 20 0 BEADLO Cc1nnc(C[N@@H+]2CC[C@@](C)(C(F)(F)F)C2)o1 ZINC000879999071 590906491 /nfs/dbraw/zinc/90/64/91/590906491.db2.gz HHILFLQAULFQKL-SECBINFHSA-N 1 2 249.236 2.152 20 0 BEADLO Cc1nnc(C[N@H+]2CC[C@@](C)(C(F)(F)F)C2)o1 ZINC000879999071 590906494 /nfs/dbraw/zinc/90/64/94/590906494.db2.gz HHILFLQAULFQKL-SECBINFHSA-N 1 2 249.236 2.152 20 0 BEADLO Cc1coc(C(=O)N[C@@H]2C[C@H](C)n3cc[nH+]c32)c1 ZINC000880227286 590961379 /nfs/dbraw/zinc/96/13/79/590961379.db2.gz JETRVFVXPBSGFC-VHSXEESVSA-N 1 2 245.282 2.220 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CCC[C@@H](CF)C2)o1 ZINC000880231971 590963404 /nfs/dbraw/zinc/96/34/04/590963404.db2.gz CIMUOWUXRUTQCC-JTQLQIEISA-N 1 2 241.310 2.375 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CCC[C@@H](CF)C2)o1 ZINC000880231971 590963406 /nfs/dbraw/zinc/96/34/06/590963406.db2.gz CIMUOWUXRUTQCC-JTQLQIEISA-N 1 2 241.310 2.375 20 0 BEADLO FC1CC[NH+](Cc2ncc(C3CC3)o2)CC1 ZINC000880240171 590974332 /nfs/dbraw/zinc/97/43/32/590974332.db2.gz OFVIVJBPDDJYFD-UHFFFAOYSA-N 1 2 224.279 2.486 20 0 BEADLO CC(C)(C)c1nc(C[N@@H+]2CC[C@H](CF)C2)no1 ZINC000880294833 590989776 /nfs/dbraw/zinc/98/97/76/590989776.db2.gz FDTWTLCLKZFJGL-SECBINFHSA-N 1 2 241.310 2.159 20 0 BEADLO CC(C)(C)c1nc(C[N@H+]2CC[C@H](CF)C2)no1 ZINC000880294833 590989778 /nfs/dbraw/zinc/98/97/78/590989778.db2.gz FDTWTLCLKZFJGL-SECBINFHSA-N 1 2 241.310 2.159 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CC[C@@H](CF)C2)s1 ZINC000880299796 590995627 /nfs/dbraw/zinc/99/56/27/590995627.db2.gz LPNAMTNSTNZHLX-VIFPVBQESA-N 1 2 243.351 2.453 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CC[C@@H](CF)C2)s1 ZINC000880299796 590995629 /nfs/dbraw/zinc/99/56/29/590995629.db2.gz LPNAMTNSTNZHLX-VIFPVBQESA-N 1 2 243.351 2.453 20 0 BEADLO FC[C@@H]1CC[N@H+](Cc2nnc(C3CC3)s2)C1 ZINC000880300412 590996542 /nfs/dbraw/zinc/99/65/42/590996542.db2.gz RWIVSLDWLDNORX-QMMMGPOBSA-N 1 2 241.335 2.207 20 0 BEADLO FC[C@@H]1CC[N@@H+](Cc2nnc(C3CC3)s2)C1 ZINC000880300412 590996544 /nfs/dbraw/zinc/99/65/44/590996544.db2.gz RWIVSLDWLDNORX-QMMMGPOBSA-N 1 2 241.335 2.207 20 0 BEADLO C[C@@H]1CC[C@H](CO)[N@@H+]1Cc1ncc(Cl)s1 ZINC000880440281 591042959 /nfs/dbraw/zinc/04/29/59/591042959.db2.gz YUFBOUPARYITFR-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H]1CC[C@H](CO)[N@H+]1Cc1ncc(Cl)s1 ZINC000880440281 591042961 /nfs/dbraw/zinc/04/29/61/591042961.db2.gz YUFBOUPARYITFR-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H]1CC[C@H](CO)[N@@H+]1Cc1csc(Cl)n1 ZINC000880444891 591046024 /nfs/dbraw/zinc/04/60/24/591046024.db2.gz ZZGMOLILOWBIEK-VXNVDRBHSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H]1CC[C@H](CO)[N@H+]1Cc1csc(Cl)n1 ZINC000880444891 591046028 /nfs/dbraw/zinc/04/60/28/591046028.db2.gz ZZGMOLILOWBIEK-VXNVDRBHSA-N 1 2 246.763 2.142 20 0 BEADLO OC[C@@H]1C=CC[N@@H+]1Cc1cccc(F)c1Cl ZINC000880488534 591064902 /nfs/dbraw/zinc/06/49/02/591064902.db2.gz HAAJKZVDEPBXRZ-JTQLQIEISA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@@H]1C=CC[N@H+]1Cc1cccc(F)c1Cl ZINC000880488534 591064905 /nfs/dbraw/zinc/06/49/05/591064905.db2.gz HAAJKZVDEPBXRZ-JTQLQIEISA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@H]1C=CC[N@@H+]1Cc1nsc2ccccc21 ZINC000880493080 591070616 /nfs/dbraw/zinc/07/06/16/591070616.db2.gz YQVPVGCUCXYCKP-SNVBAGLBSA-N 1 2 246.335 2.029 20 0 BEADLO OC[C@H]1C=CC[N@H+]1Cc1nsc2ccccc21 ZINC000880493080 591070620 /nfs/dbraw/zinc/07/06/20/591070620.db2.gz YQVPVGCUCXYCKP-SNVBAGLBSA-N 1 2 246.335 2.029 20 0 BEADLO CCC[N@H+](CCO)C/C(Cl)=C\Cl ZINC000211377140 591162370 /nfs/dbraw/zinc/16/23/70/591162370.db2.gz DDDXLIKDCPSXOL-SOFGYWHQSA-N 1 2 212.120 2.010 20 0 BEADLO CCC[N@@H+](CCO)C/C(Cl)=C\Cl ZINC000211377140 591162373 /nfs/dbraw/zinc/16/23/73/591162373.db2.gz DDDXLIKDCPSXOL-SOFGYWHQSA-N 1 2 212.120 2.010 20 0 BEADLO C[C@H](Cn1cc(Cn2cc[nH+]c2)nn1)C(C)(C)C ZINC000881327217 591191984 /nfs/dbraw/zinc/19/19/84/591191984.db2.gz YLZQUQKYYASCTF-LLVKDONJSA-N 1 2 247.346 2.205 20 0 BEADLO CCC[C@@H](C)CCNC(=O)CCn1cc[nH+]c1 ZINC000881528931 591230057 /nfs/dbraw/zinc/23/00/57/591230057.db2.gz IMGMBYIPSPUTOG-GFCCVEGCSA-N 1 2 237.347 2.216 20 0 BEADLO C[C@H](CC(=O)NC[C@]1(C)CC1(C)C)n1cc[nH+]c1 ZINC000881544651 591237307 /nfs/dbraw/zinc/23/73/07/591237307.db2.gz CUPVZHPJWDHKBS-RISCZKNCSA-N 1 2 249.358 2.387 20 0 BEADLO OCc1cc[nH+]c(NC[C@@H]2CC2(Cl)Cl)c1 ZINC000881768800 591269641 /nfs/dbraw/zinc/26/96/41/591269641.db2.gz CEDNIOZZVQHTEH-QMMMGPOBSA-N 1 2 247.125 2.180 20 0 BEADLO COc1ncccc1CNc1nc[nH+]c(C)c1C ZINC000881793624 591272041 /nfs/dbraw/zinc/27/20/41/591272041.db2.gz RSETYWJOAJZVPQ-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO Cc1[nH+]cnc(NCCc2ccccc2O)c1C ZINC000881823108 591273040 /nfs/dbraw/zinc/27/30/40/591273040.db2.gz KNEQBKNJMIHHPL-UHFFFAOYSA-N 1 2 243.310 2.454 20 0 BEADLO Cc1cc(CNc2nc[nH+]c(C)c2C)on1 ZINC000881848112 591274525 /nfs/dbraw/zinc/27/45/25/591274525.db2.gz TVDVYQMHWQDHML-UHFFFAOYSA-N 1 2 218.260 2.002 20 0 BEADLO COc1cccc(CNc2nc[nH+]c(C)c2C)n1 ZINC000881871645 591275802 /nfs/dbraw/zinc/27/58/02/591275802.db2.gz SHDGFILYCCSPSJ-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO Cc1noc(C)c1CCNc1nc[nH+]c(C)c1C ZINC000881954877 591283999 /nfs/dbraw/zinc/28/39/99/591283999.db2.gz UYLXOEXQCFQJLH-UHFFFAOYSA-N 1 2 246.314 2.353 20 0 BEADLO CCC(CC)[C@@H](O)CNc1nc[nH+]c(C)c1C ZINC000881969010 591284984 /nfs/dbraw/zinc/28/49/84/591284984.db2.gz AUFPDXKYTBICQP-LBPRGKRZSA-N 1 2 237.347 2.302 20 0 BEADLO CO[C@@H](CNc1nc[nH+]c(C)c1C)C(F)(F)F ZINC000881981942 591285249 /nfs/dbraw/zinc/28/52/49/591285249.db2.gz QQMSZFTVGRYFQP-QMMMGPOBSA-N 1 2 249.236 2.083 20 0 BEADLO CNc1nc(CNc2nc[nH+]c(C)c2C)cs1 ZINC000882026019 591288674 /nfs/dbraw/zinc/28/86/74/591288674.db2.gz VEKSTSYQXYQALL-UHFFFAOYSA-N 1 2 249.343 2.204 20 0 BEADLO CS[C@H]1CC[C@@H](Nc2cc(CO)cc[nH+]2)C1 ZINC000882027886 591288997 /nfs/dbraw/zinc/28/89/97/591288997.db2.gz GHMDYKJXDUSTIK-MNOVXSKESA-N 1 2 238.356 2.270 20 0 BEADLO Cc1[nH+]cnc(N2C[C@H](C)[C@@H](C)C2)c1C ZINC000882036816 591290128 /nfs/dbraw/zinc/29/01/28/591290128.db2.gz MWJIKCHDXAFFKN-IUCAKERBSA-N 1 2 205.305 2.186 20 0 BEADLO Cc1cnc(CNc2nc[nH+]c(C)c2C)o1 ZINC000882039185 591290660 /nfs/dbraw/zinc/29/06/60/591290660.db2.gz LVANLKBMDNTPAT-UHFFFAOYSA-N 1 2 218.260 2.002 20 0 BEADLO Cc1[nH+]cnc(NCC2(CO)CCCCC2)c1C ZINC000882069601 591293676 /nfs/dbraw/zinc/29/36/76/591293676.db2.gz UVJZHWAGDKXKRB-UHFFFAOYSA-N 1 2 249.358 2.448 20 0 BEADLO CS[C@H](C)CNc1nc[nH+]c(C)c1C ZINC000882128207 591302176 /nfs/dbraw/zinc/30/21/76/591302176.db2.gz WBMZUKAOILHXSJ-SSDOTTSWSA-N 1 2 211.334 2.257 20 0 BEADLO Cc1[nH+]cnc(N2CC(C(C)C)C2)c1C ZINC000882129887 591302871 /nfs/dbraw/zinc/30/28/71/591302871.db2.gz HGVDYKCVMVREGT-UHFFFAOYSA-N 1 2 205.305 2.186 20 0 BEADLO Cc1cncc(CNc2nc[nH+]c(C)c2C)c1 ZINC000882138033 591304827 /nfs/dbraw/zinc/30/48/27/591304827.db2.gz BWPFETYSTQWARM-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO C[C@H]1CSC(SCc2ccc[nH+]c2N)=N1 ZINC000882150753 591306755 /nfs/dbraw/zinc/30/67/55/591306755.db2.gz UOGOXGICRVTRRB-ZETCQYMHSA-N 1 2 239.369 2.388 20 0 BEADLO C[C@@H]1CSC(SCc2ccc[nH+]c2N)=N1 ZINC000882150752 591307151 /nfs/dbraw/zinc/30/71/51/591307151.db2.gz UOGOXGICRVTRRB-SSDOTTSWSA-N 1 2 239.369 2.388 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2CCCOCC2)c1C ZINC000882163691 591309498 /nfs/dbraw/zinc/30/94/98/591309498.db2.gz ZXUBCLXUDFBZAV-NSHDSACASA-N 1 2 221.304 2.074 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2CCO[C@H](C3CC3)C2)c1C ZINC000882192440 591314039 /nfs/dbraw/zinc/31/40/39/591314039.db2.gz BODFTJZQBGOHQU-OLZOCXBDSA-N 1 2 247.342 2.463 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2CCO[C@@H](C3CC3)C2)c1C ZINC000882192442 591314686 /nfs/dbraw/zinc/31/46/86/591314686.db2.gz BODFTJZQBGOHQU-QWHCGFSZSA-N 1 2 247.342 2.463 20 0 BEADLO COC[C@@H]1CCCCN(c2nc[nH+]c(C)c2C)C1 ZINC000882196384 591315279 /nfs/dbraw/zinc/31/52/79/591315279.db2.gz IOVSJGPVEXPSGH-CYBMUJFWSA-N 1 2 249.358 2.346 20 0 BEADLO Cc1[nH+]cnc(N2CCSC[C@@H](C)C2)c1C ZINC000882256042 591322143 /nfs/dbraw/zinc/32/21/43/591322143.db2.gz KVCQYGUBZMDMJB-VIFPVBQESA-N 1 2 237.372 2.283 20 0 BEADLO Cc1[nH+]cnc(NC2CC(F)(F)C2)c1C ZINC000882262650 591322380 /nfs/dbraw/zinc/32/23/80/591322380.db2.gz ZOWZWOMQNCIBSM-UHFFFAOYSA-N 1 2 213.231 2.303 20 0 BEADLO Cc1cccc(CCNc2ncnc(C)c2C)[nH+]1 ZINC000882284834 591326745 /nfs/dbraw/zinc/32/67/45/591326745.db2.gz URDGFHGERYGTQB-UHFFFAOYSA-N 1 2 242.326 2.451 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2CCOC[C@H]2C)c1C ZINC000882353882 591336792 /nfs/dbraw/zinc/33/67/92/591336792.db2.gz VGCBWQMFKBWXOK-SKDRFNHKSA-N 1 2 235.331 2.178 20 0 BEADLO CCC[C@@]1(CO)CCN(c2nc[nH+]c(C)c2C)C1 ZINC000882381231 591339980 /nfs/dbraw/zinc/33/99/80/591339980.db2.gz SOGXMYCHKZWWHB-CQSZACIVSA-N 1 2 249.358 2.082 20 0 BEADLO Cc1[nH+]cnc(NC[C@]2(O)CCC[C@@H]2C)c1C ZINC000882402987 591343406 /nfs/dbraw/zinc/34/34/06/591343406.db2.gz DDPNOBAFEBGDPS-TVQRCGJNSA-N 1 2 235.331 2.056 20 0 BEADLO Cc1[nH+]cnc(N[C@@H](C)CC(C)(C)O)c1C ZINC000882413374 591344777 /nfs/dbraw/zinc/34/47/77/591344777.db2.gz KZFGBEHIOCEWKA-QMMMGPOBSA-N 1 2 223.320 2.055 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2CC[C@H](C)O2)c1C ZINC000882438460 591348992 /nfs/dbraw/zinc/34/89/92/591348992.db2.gz FRBQIANGCZWMHB-KWQFWETISA-N 1 2 221.304 2.073 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2COC3(CCC3)C2)c1C ZINC000882617490 591400814 /nfs/dbraw/zinc/40/08/14/591400814.db2.gz ZPVLEVYDTPMGEN-NSHDSACASA-N 1 2 233.315 2.217 20 0 BEADLO CCC(O)(CC)CN(C)c1nc[nH+]c(C)c1C ZINC000882669070 591408813 /nfs/dbraw/zinc/40/88/13/591408813.db2.gz QOPOBAKQZLYOSL-UHFFFAOYSA-N 1 2 237.347 2.081 20 0 BEADLO CC[C@H](C[C@@H](C)O)Nc1nc[nH+]c(C)c1C ZINC000882708243 591416039 /nfs/dbraw/zinc/41/60/39/591416039.db2.gz WKDHUVVTJQUAQZ-LDYMZIIASA-N 1 2 223.320 2.055 20 0 BEADLO COc1c(C)[nH+]cnc1NC[C@@H]1C=CCC1 ZINC000882756364 591429743 /nfs/dbraw/zinc/42/97/43/591429743.db2.gz ZFADIMFDBNMQFC-SNVBAGLBSA-N 1 2 219.288 2.172 20 0 BEADLO Cc1[nH+]cnc(NC[C@H]2C=CCC2)c1C ZINC000882756052 591430203 /nfs/dbraw/zinc/43/02/03/591430203.db2.gz LKRVJGJZOOQMTH-NSHDSACASA-N 1 2 203.289 2.472 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CCC[C@H](CF)C2)[nH+]1 ZINC000882802122 591443926 /nfs/dbraw/zinc/44/39/26/591443926.db2.gz QLKHWXWQSPLVJT-SNVBAGLBSA-N 1 2 248.305 2.452 20 0 BEADLO Cc1nc(N2CC[C@H](CF)C2)c2c([nH+]1)CCCC2 ZINC000882841501 591451951 /nfs/dbraw/zinc/45/19/51/591451951.db2.gz XZZTWSRWTLXBIL-LLVKDONJSA-N 1 2 249.333 2.460 20 0 BEADLO COC[C@H]1C[C@@H](Nc2[nH+]c(C)nc3[nH]ccc32)C1 ZINC000882906029 591472727 /nfs/dbraw/zinc/47/27/27/591472727.db2.gz HERYKYNVHROQBO-AOOOYVTPSA-N 1 2 246.314 2.103 20 0 BEADLO Cc1noc(C)c1C[NH2+]Cc1nc(C(C)C)c[nH]1 ZINC000882921608 591474851 /nfs/dbraw/zinc/47/48/51/591474851.db2.gz LQGAUOKJBAREMM-UHFFFAOYSA-N 1 2 248.330 2.428 20 0 BEADLO NC(CO)=[NH+]OC[C@@H]1CC[C@@H](c2ccccc2)C1 ZINC000883012995 591515081 /nfs/dbraw/zinc/51/50/81/591515081.db2.gz AYLKXWUNABFCOF-DGCLKSJQSA-N 1 2 248.326 2.061 20 0 BEADLO C[C@@H](Nc1[nH+]cnc2[nH]c(Cl)cc21)C(F)F ZINC000883018849 591516777 /nfs/dbraw/zinc/51/67/77/591516777.db2.gz QXEBPMSDXWBHDZ-SCSAIBSYSA-N 1 2 246.648 2.099 20 0 BEADLO C=C/C=C\CCO[NH+]=C(N)COC1CCC1 ZINC000883040401 591525224 /nfs/dbraw/zinc/52/52/24/591525224.db2.gz AOSIMVCQPDAKDR-ARJAWSKDSA-N 1 2 224.304 2.186 20 0 BEADLO CCc1nn(C)cc1NCc1[nH]cc(C(C)C)[nH+]1 ZINC000883082546 591537180 /nfs/dbraw/zinc/53/71/80/591537180.db2.gz KDEXDPYKLKFXDX-UHFFFAOYSA-N 1 2 247.346 2.441 20 0 BEADLO C[C@H]([NH2+]C1CC=CC1)C(=O)OC(C)(C)C ZINC000131049460 591546085 /nfs/dbraw/zinc/54/60/85/591546085.db2.gz QORSMTRUQOSKJV-VIFPVBQESA-N 1 2 211.305 2.025 20 0 BEADLO CCCNc1cc(NCc2nccs2)nc[nH+]1 ZINC000131141134 591559966 /nfs/dbraw/zinc/55/99/66/591559966.db2.gz VRZRQDZHGGKCOO-UHFFFAOYSA-N 1 2 249.343 2.367 20 0 BEADLO CCCNc1cc(NCc2nccs2)[nH+]cn1 ZINC000131141134 591559967 /nfs/dbraw/zinc/55/99/67/591559967.db2.gz VRZRQDZHGGKCOO-UHFFFAOYSA-N 1 2 249.343 2.367 20 0 BEADLO CC(=O)N1CCC(Nc2c[nH+]c(C)c(C)c2)CC1 ZINC000883341636 591620452 /nfs/dbraw/zinc/62/04/52/591620452.db2.gz WDMWIHHOBCSEDH-UHFFFAOYSA-N 1 2 247.342 2.121 20 0 BEADLO COCc1cc(CNc2c[nH+]c(C)c(C)c2)no1 ZINC000883341056 591620658 /nfs/dbraw/zinc/62/06/58/591620658.db2.gz HFJWGIONUSGISR-UHFFFAOYSA-N 1 2 247.298 2.445 20 0 BEADLO Cc1cc(N[C@H]2CCn3ccnc32)c[nH+]c1C ZINC000883342512 591622068 /nfs/dbraw/zinc/62/20/68/591622068.db2.gz AXEOGIMJSCKKLP-LBPRGKRZSA-N 1 2 228.299 2.452 20 0 BEADLO Cc1cc(NCc2ccnn2C)c[nH+]c1C ZINC000883342101 591622169 /nfs/dbraw/zinc/62/21/69/591622169.db2.gz KQWHODPANVTXJR-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@@H]1CCC2(CCC2)O1 ZINC000883356115 591628196 /nfs/dbraw/zinc/62/81/96/591628196.db2.gz GAYWIELZOKGCAL-JQWIXIFHSA-N 1 2 249.358 2.470 20 0 BEADLO C(=C/c1ccccc1)\C[NH2+]Cc1csnn1 ZINC000133179248 591776977 /nfs/dbraw/zinc/77/69/77/591776977.db2.gz BXALFMRPDCTRHK-QPJJXVBHSA-N 1 2 231.324 2.341 20 0 BEADLO CCn1cc(C[N@H+](C)Cc2cccc(C)c2)nn1 ZINC000883998510 591790242 /nfs/dbraw/zinc/79/02/42/591790242.db2.gz YFALVSLIUWYDFP-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1cc(C[N@@H+](C)Cc2cccc(C)c2)nn1 ZINC000883998510 591790243 /nfs/dbraw/zinc/79/02/43/591790243.db2.gz YFALVSLIUWYDFP-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCc1nc(N2CCO[C@H](C(C)(C)C)C2)cc[nH+]1 ZINC000884490572 591954951 /nfs/dbraw/zinc/95/49/51/591954951.db2.gz AIMVZLNLHNOCDE-NSHDSACASA-N 1 2 249.358 2.290 20 0 BEADLO CCc1nc(N(CC2CCC2)[C@H](C)CO)cc[nH+]1 ZINC000884493879 591956190 /nfs/dbraw/zinc/95/61/90/591956190.db2.gz FMVLFIYBYMHQIT-LLVKDONJSA-N 1 2 249.358 2.026 20 0 BEADLO CCCCCCNc1nc[nH+]c(N)c1OC ZINC000134898267 591958217 /nfs/dbraw/zinc/95/82/17/591958217.db2.gz NKZPTQJGQTWOFG-UHFFFAOYSA-N 1 2 224.308 2.060 20 0 BEADLO CCCCCCNc1[nH+]cnc(N)c1OC ZINC000134898267 591958219 /nfs/dbraw/zinc/95/82/19/591958219.db2.gz NKZPTQJGQTWOFG-UHFFFAOYSA-N 1 2 224.308 2.060 20 0 BEADLO CCc1nc(N2CCC[C@H]2[C@@H]2CCCO2)cc[nH+]1 ZINC000884499739 591958413 /nfs/dbraw/zinc/95/84/13/591958413.db2.gz MDMLXXSIGWRUIE-RYUDHWBXSA-N 1 2 247.342 2.187 20 0 BEADLO CCOC1(C)CCN(c2cc[nH+]c(CC)n2)CC1 ZINC000884513735 591962389 /nfs/dbraw/zinc/96/23/89/591962389.db2.gz QGDMWUZVMDDFKD-UHFFFAOYSA-N 1 2 249.358 2.434 20 0 BEADLO CCc1nc(N[C@@H](C)CCCCO)cc[nH+]1 ZINC000884518928 591963885 /nfs/dbraw/zinc/96/38/85/591963885.db2.gz FAFZJVKTQYMWFM-JTQLQIEISA-N 1 2 223.320 2.002 20 0 BEADLO CCc1nc(N2CCC[C@@](C)(F)C2)cc[nH+]1 ZINC000884517796 591964110 /nfs/dbraw/zinc/96/41/10/591964110.db2.gz WPVGXAAWFGCOSB-GFCCVEGCSA-N 1 2 223.295 2.367 20 0 BEADLO CCc1nc(NCc2cnccc2C)cc[nH+]1 ZINC000884521967 591964644 /nfs/dbraw/zinc/96/46/44/591964644.db2.gz LJVXBJWJAILKBY-UHFFFAOYSA-N 1 2 228.299 2.355 20 0 BEADLO CCc1nc(N[C@H]2C[C@@H](OC)C23CCC3)cc[nH+]1 ZINC000884528681 591967697 /nfs/dbraw/zinc/96/76/97/591967697.db2.gz WHLIYOGWWOKMHV-WDEREUQCSA-N 1 2 247.342 2.409 20 0 BEADLO CCc1nc(N[C@H]2CCC[C@@H](CO)C2)cc[nH+]1 ZINC000884532247 591969437 /nfs/dbraw/zinc/96/94/37/591969437.db2.gz FVHJEYBNQLTVAQ-MNOVXSKESA-N 1 2 235.331 2.002 20 0 BEADLO CCc1nc(N2C[C@@H](CC)O[C@H](CC)C2)cc[nH+]1 ZINC000884534032 591969783 /nfs/dbraw/zinc/96/97/83/591969783.db2.gz XCFIJZNHIGQOOR-VXGBXAGGSA-N 1 2 249.358 2.433 20 0 BEADLO CCc1nc(N2CCOC[C@@H]2C2CCC2)cc[nH+]1 ZINC000884543185 591973297 /nfs/dbraw/zinc/97/32/97/591973297.db2.gz XKBHLOWJUBPDFA-GFCCVEGCSA-N 1 2 247.342 2.044 20 0 BEADLO CCc1nc(N2C[C@H](CC)OC[C@@H]2CC)cc[nH+]1 ZINC000884545159 591974161 /nfs/dbraw/zinc/97/41/61/591974161.db2.gz ZTKMWMKQKQGLEQ-RYUDHWBXSA-N 1 2 249.358 2.433 20 0 BEADLO CCc1nc(N2CCC[C@H](OC(C)C)C2)cc[nH+]1 ZINC000884544989 591974585 /nfs/dbraw/zinc/97/45/85/591974585.db2.gz WAANSZDNXLDULY-LBPRGKRZSA-N 1 2 249.358 2.433 20 0 BEADLO CCc1nc(N2CC(C)(C)OC[C@H]2CC)cc[nH+]1 ZINC000884544978 591974739 /nfs/dbraw/zinc/97/47/39/591974739.db2.gz VVWFLTCFLSBZGG-LLVKDONJSA-N 1 2 249.358 2.433 20 0 BEADLO CCc1nc(N[C@H]2COC(C)(C)C2)cc[nH+]1 ZINC000884552032 591976570 /nfs/dbraw/zinc/97/65/70/591976570.db2.gz PFHKNUWLGNQKFS-SECBINFHSA-N 1 2 221.304 2.018 20 0 BEADLO CCc1nc(N2CCCC[C@@H]2[C@H](C)CO)cc[nH+]1 ZINC000884555735 591978055 /nfs/dbraw/zinc/97/80/55/591978055.db2.gz YHXPCXXSJPZERP-VXGBXAGGSA-N 1 2 249.358 2.026 20 0 BEADLO CCc1nc(N2CC[C@@H](C)O[C@@H](C)C2)cc[nH+]1 ZINC000884558251 591979587 /nfs/dbraw/zinc/97/95/87/591979587.db2.gz NYUZNGRNRKSPQH-MNOVXSKESA-N 1 2 235.331 2.043 20 0 BEADLO CCc1nc(NCC[C@H]2CC2(F)F)cc[nH+]1 ZINC000884562004 591980690 /nfs/dbraw/zinc/98/06/90/591980690.db2.gz OSAOPMNAGWSTMF-QMMMGPOBSA-N 1 2 227.258 2.496 20 0 BEADLO CCc1nc(NCc2ccns2)cc[nH+]1 ZINC000884561722 591980698 /nfs/dbraw/zinc/98/06/98/591980698.db2.gz IQROPDGXHPXJOE-UHFFFAOYSA-N 1 2 220.301 2.108 20 0 BEADLO CCc1nc(NCC[C@@H]2CC2(F)F)cc[nH+]1 ZINC000884562003 591980731 /nfs/dbraw/zinc/98/07/31/591980731.db2.gz OSAOPMNAGWSTMF-MRVPVSSYSA-N 1 2 227.258 2.496 20 0 BEADLO CCc1nc(N[C@@H](CO)CCC(C)C)cc[nH+]1 ZINC000884564271 591982290 /nfs/dbraw/zinc/98/22/90/591982290.db2.gz BMHFBJABTFZLGE-LLVKDONJSA-N 1 2 237.347 2.248 20 0 BEADLO CCc1nc(NC[C@@H]2C[C@H]3CCC[C@@H]3O2)cc[nH+]1 ZINC000884579215 591986023 /nfs/dbraw/zinc/98/60/23/591986023.db2.gz UIZOQZHDHHNBSU-WOPDTQHZSA-N 1 2 247.342 2.409 20 0 BEADLO CCc1nc(N[C@@H]2CC23CCC3)cc[nH+]1 ZINC000884579500 591986345 /nfs/dbraw/zinc/98/63/45/591986345.db2.gz BBGIFRUCMUAPPL-SECBINFHSA-N 1 2 203.289 2.394 20 0 BEADLO CCc1nc(NC[C@@H]2C=CCC2)cc[nH+]1 ZINC000884581284 591986786 /nfs/dbraw/zinc/98/67/86/591986786.db2.gz YUEXTDMQODJIOW-SNVBAGLBSA-N 1 2 203.289 2.417 20 0 BEADLO Fc1c[nH+]ccc1NCc1cc(C2CC2)no1 ZINC000884637378 591999803 /nfs/dbraw/zinc/99/98/03/591999803.db2.gz LNEIFMLNJWXBLK-UHFFFAOYSA-N 1 2 233.246 2.120 20 0 BEADLO Cc1[nH+]cnc(NC[C@H]2CC3(CCC3)CO2)c1C ZINC000884659737 592006040 /nfs/dbraw/zinc/00/60/40/592006040.db2.gz CFOJKQPDPWFJFA-GFCCVEGCSA-N 1 2 247.342 2.465 20 0 BEADLO Cc1cc(NC[C@H]2CC3(CCC3)CO2)nc[nH+]1 ZINC000884661009 592007000 /nfs/dbraw/zinc/00/70/00/592007000.db2.gz JEZZWYKIHHNQPS-LLVKDONJSA-N 1 2 233.315 2.156 20 0 BEADLO COc1cc[nH+]cc1COC(=O)C1(C2CC2)CC1 ZINC000885732004 592095977 /nfs/dbraw/zinc/09/59/77/592095977.db2.gz BSEFSWTZSOTIKR-UHFFFAOYSA-N 1 2 247.294 2.324 20 0 BEADLO C[N@@H+](Cc1ccon1)C[C@@H]1CC[C@@H](C2CC2)O1 ZINC000886019518 592132613 /nfs/dbraw/zinc/13/26/13/592132613.db2.gz WFVNTZXFJWEZBF-STQMWFEESA-N 1 2 236.315 2.064 20 0 BEADLO C[N@H+](Cc1ccon1)C[C@@H]1CC[C@@H](C2CC2)O1 ZINC000886019518 592132614 /nfs/dbraw/zinc/13/26/14/592132614.db2.gz WFVNTZXFJWEZBF-STQMWFEESA-N 1 2 236.315 2.064 20 0 BEADLO Cc1coc(C[NH2+][C@H]2CCCc3c[nH]nc32)c1 ZINC000886022688 592134468 /nfs/dbraw/zinc/13/44/68/592134468.db2.gz IHKIEVFPLWCODN-LBPRGKRZSA-N 1 2 231.299 2.478 20 0 BEADLO Cc1coc(C[NH2+]Cc2ccc(F)cn2)c1 ZINC000886022415 592135021 /nfs/dbraw/zinc/13/50/21/592135021.db2.gz ATLSDCFJIFFSJD-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO Cc1n[nH]c(C[NH2+][C@H]2CCCC2(F)F)c1C ZINC000886116986 592154606 /nfs/dbraw/zinc/15/46/06/592154606.db2.gz WUBADZUIUBVZGA-JTQLQIEISA-N 1 2 229.274 2.304 20 0 BEADLO Cc1coc(C[NH2+][C@H]2CCn3ccnc32)c1 ZINC000886129843 592159542 /nfs/dbraw/zinc/15/95/42/592159542.db2.gz OZDYDPYEUMVMHO-NSHDSACASA-N 1 2 217.272 2.019 20 0 BEADLO Cc1n[nH]c(CNc2c[nH+]cc(N(C)C)c2)c1C ZINC000886175028 592169785 /nfs/dbraw/zinc/16/97/85/592169785.db2.gz OWBGFYUCPPDUOX-UHFFFAOYSA-N 1 2 245.330 2.100 20 0 BEADLO c1cc2c(cn1)C[N@H+](C[C@@H]1CC[C@@H](C3CC3)O1)C2 ZINC000886203525 592175643 /nfs/dbraw/zinc/17/56/43/592175643.db2.gz XEILHSZPURKDRN-GJZGRUSLSA-N 1 2 244.338 2.355 20 0 BEADLO c1cc2c(cn1)C[N@@H+](C[C@@H]1CC[C@@H](C3CC3)O1)C2 ZINC000886203525 592175646 /nfs/dbraw/zinc/17/56/46/592175646.db2.gz XEILHSZPURKDRN-GJZGRUSLSA-N 1 2 244.338 2.355 20 0 BEADLO Cc1ccoc1C[NH2+][C@H](C)c1ncco1 ZINC000886274735 592195068 /nfs/dbraw/zinc/19/50/68/592195068.db2.gz ZTBQPGJVZUVQIT-SECBINFHSA-N 1 2 206.245 2.427 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2ncco2)o1 ZINC000886275734 592195378 /nfs/dbraw/zinc/19/53/78/592195378.db2.gz KNNFXJYSDVVXDI-SECBINFHSA-N 1 2 206.245 2.427 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)C[C@H]1CC[C@@H](C2CC2)O1 ZINC000886305998 592203382 /nfs/dbraw/zinc/20/33/82/592203382.db2.gz WFFXKPAYOQPLMX-KGLIPLIRSA-N 1 2 249.358 2.108 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)C[C@H]1CC[C@@H](C2CC2)O1 ZINC000886305998 592203383 /nfs/dbraw/zinc/20/33/83/592203383.db2.gz WFFXKPAYOQPLMX-KGLIPLIRSA-N 1 2 249.358 2.108 20 0 BEADLO COC(=O)[C@H]1CC[C@H](Nc2ccc(C)[nH+]c2C)C1 ZINC000886578408 592267678 /nfs/dbraw/zinc/26/76/78/592267678.db2.gz VBBBYJVUJQVDBS-RYUDHWBXSA-N 1 2 248.326 2.452 20 0 BEADLO C/C=C(\CC)C(=O)N1CCc2c([nH+]cn2CC)C1 ZINC000886614854 592275410 /nfs/dbraw/zinc/27/54/10/592275410.db2.gz LWBGUENRQUOCQC-NYYWCZLTSA-N 1 2 247.342 2.144 20 0 BEADLO CC(C)[C@H]([NH2+]CC(C)(F)F)c1cnn(C)c1 ZINC000886615862 592276487 /nfs/dbraw/zinc/27/64/87/592276487.db2.gz POIPVEYBHAHNIB-JTQLQIEISA-N 1 2 231.290 2.362 20 0 BEADLO CC/C=C(/C)C(=O)N1CCc2c([nH+]cn2CC)C1 ZINC000886622854 592278812 /nfs/dbraw/zinc/27/88/12/592278812.db2.gz IJSFKONAFIBPQF-WDZFZDKYSA-N 1 2 247.342 2.144 20 0 BEADLO COC[C@H]([NH3+])c1nc([C@@H]2CCC[C@@H](C)C2)no1 ZINC000220115384 592279731 /nfs/dbraw/zinc/27/97/31/592279731.db2.gz PPFVIYZVEXINHV-BBBLOLIVSA-N 1 2 239.319 2.010 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCc2cccnc21)c1ccn(C)n1 ZINC000886625717 592280593 /nfs/dbraw/zinc/28/05/93/592280593.db2.gz YJCQEAJGRMXHIY-GXFFZTMASA-N 1 2 242.326 2.153 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]C[C@H]1CC2(CCC2)CO1 ZINC000886701754 592306309 /nfs/dbraw/zinc/30/63/09/592306309.db2.gz VJGYKYPVKPYIJG-ZYHUDNBSSA-N 1 2 249.358 2.328 20 0 BEADLO CC(C)(C)C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000075552494 592313161 /nfs/dbraw/zinc/31/31/61/592313161.db2.gz YZSZTNOVGYYXCP-JTQLQIEISA-N 1 2 235.331 2.162 20 0 BEADLO COC1CC(Nc2ccc([NH+](C)C)cc2)C1 ZINC000220613690 592318444 /nfs/dbraw/zinc/31/84/44/592318444.db2.gz GVMMTMUNAUWZHB-UHFFFAOYSA-N 1 2 220.316 2.342 20 0 BEADLO COC1CC([NH2+]c2ccc(N(C)C)cc2)C1 ZINC000220613690 592318450 /nfs/dbraw/zinc/31/84/50/592318450.db2.gz GVMMTMUNAUWZHB-UHFFFAOYSA-N 1 2 220.316 2.342 20 0 BEADLO CC(C)OC(=O)CC[N@H+](CC(F)F)C1CCC1 ZINC000887100737 592441515 /nfs/dbraw/zinc/44/15/15/592441515.db2.gz OIYAOKMPDYFTJW-UHFFFAOYSA-N 1 2 249.301 2.448 20 0 BEADLO CC(C)OC(=O)CC[N@@H+](CC(F)F)C1CCC1 ZINC000887100737 592441516 /nfs/dbraw/zinc/44/15/16/592441516.db2.gz OIYAOKMPDYFTJW-UHFFFAOYSA-N 1 2 249.301 2.448 20 0 BEADLO CCOC(=O)CCC[N@H+](CC(F)F)C1CCC1 ZINC000887098979 592441771 /nfs/dbraw/zinc/44/17/71/592441771.db2.gz LCPDQQWHOMOICE-UHFFFAOYSA-N 1 2 249.301 2.449 20 0 BEADLO CCOC(=O)CCC[N@@H+](CC(F)F)C1CCC1 ZINC000887098979 592441774 /nfs/dbraw/zinc/44/17/74/592441774.db2.gz LCPDQQWHOMOICE-UHFFFAOYSA-N 1 2 249.301 2.449 20 0 BEADLO Cc1ccc2c(c1)CCN2Cc1c[nH+]c[nH]1 ZINC000139937991 592442695 /nfs/dbraw/zinc/44/26/95/592442695.db2.gz HPKDAZLLNABUAJ-UHFFFAOYSA-N 1 2 213.284 2.281 20 0 BEADLO Cc1ccc2c(c1)CCN2Cc1c[nH]c[nH+]1 ZINC000139937991 592442696 /nfs/dbraw/zinc/44/26/96/592442696.db2.gz HPKDAZLLNABUAJ-UHFFFAOYSA-N 1 2 213.284 2.281 20 0 BEADLO FC(F)CN(Cc1c[nH+]c[nH]1)C1CCC1 ZINC000887102558 592442822 /nfs/dbraw/zinc/44/28/22/592442822.db2.gz UKXFTZKGMIRPCO-UHFFFAOYSA-N 1 2 215.247 2.029 20 0 BEADLO FC(F)CN(Cc1c[nH]c[nH+]1)C1CCC1 ZINC000887102558 592442826 /nfs/dbraw/zinc/44/28/26/592442826.db2.gz UKXFTZKGMIRPCO-UHFFFAOYSA-N 1 2 215.247 2.029 20 0 BEADLO CC1(C)OC[C@@H](C[N@H+](CC(F)F)C2CCC2)O1 ZINC000887102308 592443876 /nfs/dbraw/zinc/44/38/76/592443876.db2.gz KXBFWQVCVHERAU-SNVBAGLBSA-N 1 2 249.301 2.258 20 0 BEADLO CC1(C)OC[C@@H](C[N@@H+](CC(F)F)C2CCC2)O1 ZINC000887102308 592443879 /nfs/dbraw/zinc/44/38/79/592443879.db2.gz KXBFWQVCVHERAU-SNVBAGLBSA-N 1 2 249.301 2.258 20 0 BEADLO C[N@H+](CCCF)Cc1cn(-c2ccccc2)nn1 ZINC000887138664 592453603 /nfs/dbraw/zinc/45/36/03/592453603.db2.gz GPMGEZHYQIVDRI-UHFFFAOYSA-N 1 2 248.305 2.059 20 0 BEADLO C[N@@H+](CCCF)Cc1cn(-c2ccccc2)nn1 ZINC000887138664 592453606 /nfs/dbraw/zinc/45/36/06/592453606.db2.gz GPMGEZHYQIVDRI-UHFFFAOYSA-N 1 2 248.305 2.059 20 0 BEADLO CCc1c[nH]c(CC(=O)NCC(C)(C)C2CC2)[nH+]1 ZINC000887370123 592494632 /nfs/dbraw/zinc/49/46/32/592494632.db2.gz HCSVHYANHCDWAW-UHFFFAOYSA-N 1 2 249.358 2.067 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2C[C@H](C)CO2)c(C)[nH+]1 ZINC000889464240 592611291 /nfs/dbraw/zinc/61/12/91/592611291.db2.gz DOLNZBBBLFIGQO-UFBFGSQYSA-N 1 2 234.299 2.062 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)NC[C@@H]1CCC=CCCC1 ZINC000890047231 592671352 /nfs/dbraw/zinc/67/13/52/592671352.db2.gz MKKPJRDEOOYRPW-GFCCVEGCSA-N 1 2 247.342 2.205 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)NC[C@@H]1CCC=CCCC1 ZINC000890047231 592671355 /nfs/dbraw/zinc/67/13/55/592671355.db2.gz MKKPJRDEOOYRPW-GFCCVEGCSA-N 1 2 247.342 2.205 20 0 BEADLO Cn1c[nH+]c(CNC(=O)[C@H]2CCCC3(CC3)C2)c1 ZINC000890103655 592679986 /nfs/dbraw/zinc/67/99/86/592679986.db2.gz OFNCQWNRQDISBB-NSHDSACASA-N 1 2 247.342 2.007 20 0 BEADLO Cn1c[nH+]c(CNC(=O)C2CC(C(C)(C)C)C2)c1 ZINC000890103801 592680031 /nfs/dbraw/zinc/68/00/31/592680031.db2.gz DEHDDCCMINOGRI-UHFFFAOYSA-N 1 2 249.358 2.109 20 0 BEADLO CC1CCC(=CC(=O)NCc2cn(C)c[nH+]2)CC1 ZINC000890113661 592684080 /nfs/dbraw/zinc/68/40/80/592684080.db2.gz LFFCAGPEZWBBLU-UHFFFAOYSA-N 1 2 247.342 2.173 20 0 BEADLO Cc1nc(N(C)Cc2ccon2)c(C)c(C)[nH+]1 ZINC000354407598 592714874 /nfs/dbraw/zinc/71/48/74/592714874.db2.gz BJDMOIHARBAMMT-UHFFFAOYSA-N 1 2 232.287 2.026 20 0 BEADLO CO[C@H](C[NH2+][C@@H](C)C(F)F)Cc1ccccc1 ZINC000895725731 636175326 /nfs/dbraw/zinc/17/53/26/636175326.db2.gz SEWBLJZCZKBDCG-JQWIXIFHSA-N 1 2 243.297 2.487 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)[C@@H]1CC12CC2 ZINC000335529838 634481748 /nfs/dbraw/zinc/48/17/48/634481748.db2.gz LXQZNPOQKUDCSV-VIFPVBQESA-N 1 2 227.267 2.073 20 0 BEADLO Cc1cc([C@H](C)[NH2+]C/C=C\Cl)no1 ZINC000308328059 631224952 /nfs/dbraw/zinc/22/49/52/631224952.db2.gz IDQLBJGLDCUQCF-VEMNSZJBSA-N 1 2 200.669 2.386 20 0 BEADLO CC(C)=CC[N@@H+]1CC(=O)NC[C@@H]1c1ccccc1 ZINC000933322234 631246727 /nfs/dbraw/zinc/24/67/27/631246727.db2.gz HQTCFIMRAXNANS-CQSZACIVSA-N 1 2 244.338 2.126 20 0 BEADLO CC(C)=CC[N@H+]1CC(=O)NC[C@@H]1c1ccccc1 ZINC000933322234 631246731 /nfs/dbraw/zinc/24/67/31/631246731.db2.gz HQTCFIMRAXNANS-CQSZACIVSA-N 1 2 244.338 2.126 20 0 BEADLO C[C@H]1CCC[C@H](C(=O)NCc2ccc(N)[nH+]c2)C1 ZINC000308392442 631310110 /nfs/dbraw/zinc/31/01/10/631310110.db2.gz OLNFZRNOXKQNFW-JQWIXIFHSA-N 1 2 247.342 2.106 20 0 BEADLO Nc1ccc(CNC(=O)CC2=CCCCC2)c[nH+]1 ZINC000308390079 631311099 /nfs/dbraw/zinc/31/10/99/631311099.db2.gz IUOQNHRZHLFATI-UHFFFAOYSA-N 1 2 245.326 2.171 20 0 BEADLO Cc1nn(C)c(C[N@@H+](C)C(C)C)c1Cl ZINC000891452388 631362564 /nfs/dbraw/zinc/36/25/64/631362564.db2.gz XQLUYMYZKOCZBK-UHFFFAOYSA-N 1 2 215.728 2.222 20 0 BEADLO Cc1nn(C)c(C[N@H+](C)C(C)C)c1Cl ZINC000891452388 631362569 /nfs/dbraw/zinc/36/25/69/631362569.db2.gz XQLUYMYZKOCZBK-UHFFFAOYSA-N 1 2 215.728 2.222 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1ccc(OC)o1 ZINC000891476978 631373825 /nfs/dbraw/zinc/37/38/25/631373825.db2.gz WPOKTJDWUZZMAS-GHMZBOCLSA-N 1 2 239.315 2.288 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1ccc(OC)o1 ZINC000891476978 631373829 /nfs/dbraw/zinc/37/38/29/631373829.db2.gz WPOKTJDWUZZMAS-GHMZBOCLSA-N 1 2 239.315 2.288 20 0 BEADLO CNc1cc(N2CCC[C@H]2C(C)C)nc[nH+]1 ZINC000087837239 631483526 /nfs/dbraw/zinc/48/35/26/631483526.db2.gz XIJHSHUOFJZTIO-JTQLQIEISA-N 1 2 220.320 2.143 20 0 BEADLO CNc1cc(N2CCC[C@H]2C(C)C)[nH+]cn1 ZINC000087837239 631483531 /nfs/dbraw/zinc/48/35/31/631483531.db2.gz XIJHSHUOFJZTIO-JTQLQIEISA-N 1 2 220.320 2.143 20 0 BEADLO Cc1cc(C[N@H+]2CCOC[C@@H]2C)c(C)o1 ZINC000091810573 631544421 /nfs/dbraw/zinc/54/44/21/631544421.db2.gz NEEZDTZAQHYGBZ-VIFPVBQESA-N 1 2 209.289 2.117 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC[C@@H]2C)c(C)o1 ZINC000091810573 631544428 /nfs/dbraw/zinc/54/44/28/631544428.db2.gz NEEZDTZAQHYGBZ-VIFPVBQESA-N 1 2 209.289 2.117 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000933990494 631577706 /nfs/dbraw/zinc/57/77/06/631577706.db2.gz LIXPKWBQPBDXGQ-SDDRHHMPSA-N 1 2 247.342 2.161 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1C[C@@H]2C[C@@H]2C[C@H]1C ZINC000933991211 631578468 /nfs/dbraw/zinc/57/84/68/631578468.db2.gz ZFTAUHMRLAJQQE-NUGNTBJXSA-N 1 2 247.342 2.017 20 0 BEADLO OC[C@H]1CC[N@@H+]1Cc1ccc(Cl)cc1F ZINC000934013265 631591499 /nfs/dbraw/zinc/59/14/99/631591499.db2.gz GSPIRWQYRAFJLL-SNVBAGLBSA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@H]1CC[N@H+]1Cc1ccc(Cl)cc1F ZINC000934013265 631591512 /nfs/dbraw/zinc/59/15/12/631591512.db2.gz GSPIRWQYRAFJLL-SNVBAGLBSA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@@H]1CC[N@@H+]1Cc1cccc(F)c1Cl ZINC000934020276 631619395 /nfs/dbraw/zinc/61/93/95/631619395.db2.gz ZQVKMSVNLFEMDA-VIFPVBQESA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@@H]1CC[N@H+]1Cc1cccc(F)c1Cl ZINC000934020276 631619401 /nfs/dbraw/zinc/61/94/01/631619401.db2.gz ZQVKMSVNLFEMDA-VIFPVBQESA-N 1 2 229.682 2.046 20 0 BEADLO CC[N@H+](CCSC(C)(C)C)CC(=O)OC ZINC000308804453 631667951 /nfs/dbraw/zinc/66/79/51/631667951.db2.gz NYJIQWJIPIHUKV-UHFFFAOYSA-N 1 2 233.377 2.013 20 0 BEADLO CC[N@@H+](CCSC(C)(C)C)CC(=O)OC ZINC000308804453 631667954 /nfs/dbraw/zinc/66/79/54/631667954.db2.gz NYJIQWJIPIHUKV-UHFFFAOYSA-N 1 2 233.377 2.013 20 0 BEADLO CO[C@H]1CC[C@@H]1[N@H+](C)Cc1coc(C2CC2)n1 ZINC000934108201 631680926 /nfs/dbraw/zinc/68/09/26/631680926.db2.gz ZNHPYLOTRRRCIR-RYUDHWBXSA-N 1 2 236.315 2.161 20 0 BEADLO CO[C@H]1CC[C@@H]1[N@@H+](C)Cc1coc(C2CC2)n1 ZINC000934108201 631680928 /nfs/dbraw/zinc/68/09/28/631680928.db2.gz ZNHPYLOTRRRCIR-RYUDHWBXSA-N 1 2 236.315 2.161 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@@H+](C)[C@H](C)c1nnc(C)s1 ZINC000934113682 631688822 /nfs/dbraw/zinc/68/88/22/631688822.db2.gz DMTCAZOMOUNCHV-FKTZTGRPSA-N 1 2 241.360 2.017 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@H+](C)[C@H](C)c1nnc(C)s1 ZINC000934113682 631688818 /nfs/dbraw/zinc/68/88/18/631688818.db2.gz DMTCAZOMOUNCHV-FKTZTGRPSA-N 1 2 241.360 2.017 20 0 BEADLO Fc1cccc(CNc2cccc[nH+]2)n1 ZINC000308881547 631717244 /nfs/dbraw/zinc/71/72/44/631717244.db2.gz QIUFVTDLHUVURF-UHFFFAOYSA-N 1 2 203.220 2.228 20 0 BEADLO C[C@]1(C(=O)OCc2cc[nH+]c(N)c2)C=CCC1 ZINC000924407816 631738950 /nfs/dbraw/zinc/73/89/50/631738950.db2.gz LJLCPMFZQYGUJR-ZDUSSCGKSA-N 1 2 232.283 2.063 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CC[C@H]1C)C(=O)OC(C)(C)C ZINC000309087011 631875658 /nfs/dbraw/zinc/87/56/58/631875658.db2.gz YZDVNJGAMRPDCC-OPRDCNLKSA-N 1 2 213.321 2.105 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+]1CC[C@@H](O)[C@H](F)C1 ZINC000934570620 631944409 /nfs/dbraw/zinc/94/44/09/631944409.db2.gz GAXDPVRTGGUGCE-CHWSQXEVSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cc(F)ccc1C[N@H+]1CC[C@@H](O)[C@H](F)C1 ZINC000934570620 631944412 /nfs/dbraw/zinc/94/44/12/631944412.db2.gz GAXDPVRTGGUGCE-CHWSQXEVSA-N 1 2 241.281 2.039 20 0 BEADLO O[C@@H]1CC[N@H+](Cc2cc3ccccc3o2)C[C@@H]1F ZINC000934575561 631947132 /nfs/dbraw/zinc/94/71/32/631947132.db2.gz KEBFSZIDGDBAKB-QWHCGFSZSA-N 1 2 249.285 2.338 20 0 BEADLO O[C@@H]1CC[N@@H+](Cc2cc3ccccc3o2)C[C@@H]1F ZINC000934575561 631947137 /nfs/dbraw/zinc/94/71/37/631947137.db2.gz KEBFSZIDGDBAKB-QWHCGFSZSA-N 1 2 249.285 2.338 20 0 BEADLO O[C@@H]1CC[N@H+](C/C=C/c2ccccc2)C[C@H]1F ZINC000934581447 631950232 /nfs/dbraw/zinc/95/02/32/631950232.db2.gz IWOGTCPVCWCMOX-HMJDLUCASA-N 1 2 235.302 2.105 20 0 BEADLO O[C@@H]1CC[N@@H+](C/C=C/c2ccccc2)C[C@H]1F ZINC000934581447 631950237 /nfs/dbraw/zinc/95/02/37/631950237.db2.gz IWOGTCPVCWCMOX-HMJDLUCASA-N 1 2 235.302 2.105 20 0 BEADLO O[C@@H]1CC[N@H+](C/C=C/c2ccccc2)C[C@@H]1F ZINC000934581450 631950785 /nfs/dbraw/zinc/95/07/85/631950785.db2.gz IWOGTCPVCWCMOX-QFVHEQCKSA-N 1 2 235.302 2.105 20 0 BEADLO O[C@@H]1CC[N@@H+](C/C=C/c2ccccc2)C[C@@H]1F ZINC000934581450 631950792 /nfs/dbraw/zinc/95/07/92/631950792.db2.gz IWOGTCPVCWCMOX-QFVHEQCKSA-N 1 2 235.302 2.105 20 0 BEADLO C[C@H](c1ccc(F)cc1)[N@@H+]1CC[C@H](O)[C@@H](F)C1 ZINC000934582510 631951469 /nfs/dbraw/zinc/95/14/69/631951469.db2.gz QRNGULWDQBVLFG-ICCXJUOJSA-N 1 2 241.281 2.291 20 0 BEADLO C[C@H](c1ccc(F)cc1)[N@H+]1CC[C@H](O)[C@@H](F)C1 ZINC000934582510 631951472 /nfs/dbraw/zinc/95/14/72/631951472.db2.gz QRNGULWDQBVLFG-ICCXJUOJSA-N 1 2 241.281 2.291 20 0 BEADLO C[C@H](c1ccc(F)cc1)[N@@H+]1CC[C@@H](O)[C@@H](F)C1 ZINC000934582512 631954329 /nfs/dbraw/zinc/95/43/29/631954329.db2.gz QRNGULWDQBVLFG-JIMOISOXSA-N 1 2 241.281 2.291 20 0 BEADLO C[C@H](c1ccc(F)cc1)[N@H+]1CC[C@@H](O)[C@@H](F)C1 ZINC000934582512 631954336 /nfs/dbraw/zinc/95/43/36/631954336.db2.gz QRNGULWDQBVLFG-JIMOISOXSA-N 1 2 241.281 2.291 20 0 BEADLO CC[NH2+]Cc1noc(CCC2CCCC2)n1 ZINC000051860541 631972786 /nfs/dbraw/zinc/97/27/86/631972786.db2.gz AZFGYYVIOXCVKL-UHFFFAOYSA-N 1 2 223.320 2.302 20 0 BEADLO CC(C)OCCC[NH2+]C(C)(C)C(=O)OC(C)C ZINC000934817796 632088734 /nfs/dbraw/zinc/08/87/34/632088734.db2.gz HSMOGGROSQYZFC-UHFFFAOYSA-N 1 2 245.363 2.121 20 0 BEADLO CC[C@H]1CCC[N@H+](Cn2ncn(C)c2=S)C1 ZINC000126252574 635723186 /nfs/dbraw/zinc/72/31/86/635723186.db2.gz IOGUVMNWVVWDOZ-JTQLQIEISA-N 1 2 240.376 2.031 20 0 BEADLO CC[C@H]1CCC[N@@H+](Cn2ncn(C)c2=S)C1 ZINC000126252574 635723195 /nfs/dbraw/zinc/72/31/95/635723195.db2.gz IOGUVMNWVVWDOZ-JTQLQIEISA-N 1 2 240.376 2.031 20 0 BEADLO C[C@H](c1nc(CC2CCC2)no1)[NH+](C)C ZINC000924067557 632442834 /nfs/dbraw/zinc/44/28/34/632442834.db2.gz UWTCZWBORILDJJ-MRVPVSSYSA-N 1 2 209.293 2.035 20 0 BEADLO Cc1nc(NC2CCCCCCC2)nc(N)[nH+]1 ZINC000310136203 632701795 /nfs/dbraw/zinc/70/17/95/632701795.db2.gz BOAPQPQLBRYOLU-UHFFFAOYSA-N 1 2 235.335 2.287 20 0 BEADLO Cc1nc(N)nc(NC2CCCCCCC2)[nH+]1 ZINC000310136203 632701799 /nfs/dbraw/zinc/70/17/99/632701799.db2.gz BOAPQPQLBRYOLU-UHFFFAOYSA-N 1 2 235.335 2.287 20 0 BEADLO CNc1cc(N(C)Cc2occc2C)nc[nH+]1 ZINC000310389935 632733782 /nfs/dbraw/zinc/73/37/82/632733782.db2.gz IRSOZERUOZSYQD-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO CNc1cc(N(C)Cc2occc2C)[nH+]cn1 ZINC000310389935 632733789 /nfs/dbraw/zinc/73/37/89/632733789.db2.gz IRSOZERUOZSYQD-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO C[C@H]([NH2+]Cc1cn(C)cn1)c1ccccc1F ZINC000310528234 632754147 /nfs/dbraw/zinc/75/41/47/632754147.db2.gz PHMMWYCEVWSNBF-JTQLQIEISA-N 1 2 233.290 2.410 20 0 BEADLO C[C@@H]([NH2+]Cc1cn(C)cn1)c1ccccc1F ZINC000310528236 632754386 /nfs/dbraw/zinc/75/43/86/632754386.db2.gz PHMMWYCEVWSNBF-SNVBAGLBSA-N 1 2 233.290 2.410 20 0 BEADLO Cc1ccc(NC(=O)c2ccco2)c(N(C)C)[nH+]1 ZINC000152703483 632806835 /nfs/dbraw/zinc/80/68/35/632806835.db2.gz RRYAQNTXCVTITR-UHFFFAOYSA-N 1 2 245.282 2.301 20 0 BEADLO Cl/C=C\CN1CC[NH+](C/C=C\Cl)CC1 ZINC000255870296 632830805 /nfs/dbraw/zinc/83/08/05/632830805.db2.gz FHCCSKDPFKOADL-CCAGOZQPSA-N 1 2 235.158 2.109 20 0 BEADLO CC/C=C(\C)C(=O)OCc1cc[nH+]c(N)c1 ZINC000309243205 632835769 /nfs/dbraw/zinc/83/57/69/632835769.db2.gz BGOIXAYDILUYRK-RUDMXATFSA-N 1 2 220.272 2.063 20 0 BEADLO CC/C=C(/C)C(=O)OCc1cc[nH+]c(N)c1 ZINC000309243207 632835845 /nfs/dbraw/zinc/83/58/45/632835845.db2.gz BGOIXAYDILUYRK-WTKPLQERSA-N 1 2 220.272 2.063 20 0 BEADLO Cc1cc(NC(=O)c2cccnc2F)cc[nH+]1 ZINC000235827793 632837861 /nfs/dbraw/zinc/83/78/61/632837861.db2.gz FFGSMCVVPFCGLD-UHFFFAOYSA-N 1 2 231.230 2.176 20 0 BEADLO C[C@H](O)[C@@H]([NH2+][C@@H](C)c1ncco1)c1ccccc1 ZINC000926730593 632900146 /nfs/dbraw/zinc/90/01/46/632900146.db2.gz ACRQDFFJUMXEJU-GMXVVIOVSA-N 1 2 246.310 2.447 20 0 BEADLO CCC[C@H](OC)c1noc([C@@H](C)[NH+](C)C)n1 ZINC000924082033 633001277 /nfs/dbraw/zinc/00/12/77/633001277.db2.gz TVSSZYVCHDQVNR-BDAKNGLRSA-N 1 2 227.308 2.180 20 0 BEADLO Cc1n[nH]c(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)c1C ZINC000894415920 635896241 /nfs/dbraw/zinc/89/62/41/635896241.db2.gz QRJSAZYNXNJITL-KCJUWKMLSA-N 1 2 225.311 2.206 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)c1C ZINC000894415920 635896245 /nfs/dbraw/zinc/89/62/45/635896245.db2.gz QRJSAZYNXNJITL-KCJUWKMLSA-N 1 2 225.311 2.206 20 0 BEADLO CCn1cc(C[N@H+](C)Cc2cccc(F)n2)cn1 ZINC000851773885 633181549 /nfs/dbraw/zinc/18/15/49/633181549.db2.gz RWPWQMOEXPWZKF-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO CCn1cc(C[N@@H+](C)Cc2cccc(F)n2)cn1 ZINC000851773885 633181553 /nfs/dbraw/zinc/18/15/53/633181553.db2.gz RWPWQMOEXPWZKF-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO CC(C)C[NH2+]CC(F)(F)Br ZINC000306213891 635958844 /nfs/dbraw/zinc/95/88/44/635958844.db2.gz VZTSIYSILSVAHC-UHFFFAOYSA-N 1 2 216.069 2.220 20 0 BEADLO C[C@@H]1C[C@H](O)C[N@H+](C/C(Cl)=C/Cl)C1 ZINC000306893666 635977609 /nfs/dbraw/zinc/97/76/09/635977609.db2.gz YJPAFWVNEZKAKQ-ZEDNWIGOSA-N 1 2 224.131 2.008 20 0 BEADLO C[C@@H]1C[C@H](O)C[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000306893666 635977611 /nfs/dbraw/zinc/97/76/11/635977611.db2.gz YJPAFWVNEZKAKQ-ZEDNWIGOSA-N 1 2 224.131 2.008 20 0 BEADLO Cn1c[nH+]c(CCNc2nc(Cl)cs2)c1 ZINC000307464960 635989022 /nfs/dbraw/zinc/98/90/22/635989022.db2.gz LWTMAHBQEXAMHK-UHFFFAOYSA-N 1 2 242.735 2.185 20 0 BEADLO CCc1nc(CNc2cc(NC)[nH+]cn2)cs1 ZINC000328459537 633766337 /nfs/dbraw/zinc/76/63/37/633766337.db2.gz JFTHFUBIVURLRW-UHFFFAOYSA-N 1 2 249.343 2.149 20 0 BEADLO CCc1nc(CNc2cc(NC)nc[nH+]2)cs1 ZINC000328459537 633766347 /nfs/dbraw/zinc/76/63/47/633766347.db2.gz JFTHFUBIVURLRW-UHFFFAOYSA-N 1 2 249.343 2.149 20 0 BEADLO CC[C@H]1CC[C@H](C)N1c1nccn2c[nH+]cc12 ZINC000893091352 633827772 /nfs/dbraw/zinc/82/77/72/633827772.db2.gz AFRJJUDBSHSMTF-QWRGUYRKSA-N 1 2 230.315 2.497 20 0 BEADLO CCOC(=O)/C=C\C[NH+]1Cc2ccccc2C1 ZINC000310024162 634082146 /nfs/dbraw/zinc/08/21/46/634082146.db2.gz WFBLWXXKATUUKK-YVMONPNESA-N 1 2 231.295 2.122 20 0 BEADLO Cn1cnc(CNc2ccc([NH+](C)C)cc2)c1 ZINC000310160711 635272142 /nfs/dbraw/zinc/27/21/42/635272142.db2.gz RDOMVEPJRXGSNQ-UHFFFAOYSA-N 1 2 230.315 2.098 20 0 BEADLO CCC[C@H](C)CC(=O)NCc1ccc(N)[nH+]c1 ZINC000927778843 635748590 /nfs/dbraw/zinc/74/85/90/635748590.db2.gz ONKFJIRCZLRWJG-JTQLQIEISA-N 1 2 235.331 2.106 20 0 BEADLO C[C@@H]([NH2+]Cc1cc[nH]n1)c1ccnn1C1CCC1 ZINC000924993919 635831235 /nfs/dbraw/zinc/83/12/35/635831235.db2.gz RSNKICUORQPSGN-SNVBAGLBSA-N 1 2 245.330 2.182 20 0 BEADLO Cc1cc(N(C)[C@@H](C)CCO)nc(C2CCC2)[nH+]1 ZINC000894407683 635892831 /nfs/dbraw/zinc/89/28/31/635892831.db2.gz ARGLNQCKCBNDSI-NSHDSACASA-N 1 2 249.358 2.260 20 0 BEADLO Cc1[nH]c(CNC(=O)C2CC3(CCC3)C2)[nH+]c1C ZINC000896907778 636251047 /nfs/dbraw/zinc/25/10/47/636251047.db2.gz RFTQNBHNCZOXAV-UHFFFAOYSA-N 1 2 247.342 2.223 20 0 BEADLO Cc1[nH]c(CNC(=O)C[C@@H]2CC[C@@H]3C[C@@H]32)[nH+]c1C ZINC000896910749 636253196 /nfs/dbraw/zinc/25/31/96/636253196.db2.gz WBFJNMRGYGZRRK-WOPDTQHZSA-N 1 2 247.342 2.079 20 0 BEADLO Cc1cccc(F)c1C[NH2+][C@H](C)c1cnn(C)n1 ZINC000925165656 636346929 /nfs/dbraw/zinc/34/69/29/636346929.db2.gz KFIAZYAOZQCSLS-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO Cc1noc(C(C)C)c1NC(=O)Cc1c[nH]c[nH+]1 ZINC000928778780 636358082 /nfs/dbraw/zinc/35/80/82/636358082.db2.gz ACMMCZSJDRCJHC-UHFFFAOYSA-N 1 2 248.286 2.011 20 0 BEADLO CCc1nc(C[NH+]2CCCCCCC2)no1 ZINC000054315713 636388351 /nfs/dbraw/zinc/38/83/51/636388351.db2.gz NTXHMTLBQTVVAA-UHFFFAOYSA-N 1 2 223.320 2.398 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)c1ccc([N+](=O)[O-])cc1 ZINC000067647659 636758057 /nfs/dbraw/zinc/75/80/57/636758057.db2.gz GIUREYHMARYWNO-AATRIKPKSA-N 1 2 243.222 2.214 20 0 BEADLO COc1cc(C(=O)/C=C/c2[nH]cc[nH+]2)ccc1O ZINC000067647833 636758520 /nfs/dbraw/zinc/75/85/20/636758520.db2.gz PYPAAURNTXRCGN-SNAWJCMRSA-N 1 2 244.250 2.020 20 0 BEADLO Cc1nonc1[C@H](C)[NH2+][C@@H](C)c1cnccc1C ZINC000925295502 636781717 /nfs/dbraw/zinc/78/17/17/636781717.db2.gz XSVJWPHQGPJYSQ-UWVGGRQHSA-N 1 2 246.314 2.493 20 0 BEADLO C[N@@H+](Cc1cnn(CCF)c1)Cc1ccco1 ZINC000929137206 636828824 /nfs/dbraw/zinc/82/88/24/636828824.db2.gz BRRPODDQNCEWRI-UHFFFAOYSA-N 1 2 237.278 2.078 20 0 BEADLO C[N@H+](Cc1cnn(CCF)c1)Cc1ccco1 ZINC000929137206 636828830 /nfs/dbraw/zinc/82/88/30/636828830.db2.gz BRRPODDQNCEWRI-UHFFFAOYSA-N 1 2 237.278 2.078 20 0 BEADLO c1[nH]cc([C@H]2C[C@@H]2c2nc(C3CCC3)no2)[nH+]1 ZINC000923824926 636877125 /nfs/dbraw/zinc/87/71/25/636877125.db2.gz VZWVLOMRXAYXJK-IUCAKERBSA-N 1 2 230.271 2.331 20 0 BEADLO Cc1cn(C)nc1C[N@@H+]1CCc2sccc2C1 ZINC000929198702 636932217 /nfs/dbraw/zinc/93/22/17/636932217.db2.gz IKDXKQSTOIRMFH-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1cn(C)nc1C[N@H+]1CCc2sccc2C1 ZINC000929198702 636932225 /nfs/dbraw/zinc/93/22/25/636932225.db2.gz IKDXKQSTOIRMFH-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO CC(C)c1cncc(NC(=O)Cc2[nH]cc[nH+]2)c1 ZINC000888238409 636933560 /nfs/dbraw/zinc/93/35/60/636933560.db2.gz OPINAHPCPGJYQJ-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO CON1CCC(Nc2ccc([NH+](C)C)cc2)CC1 ZINC000323489500 636993817 /nfs/dbraw/zinc/99/38/17/636993817.db2.gz LYZBEZXFJFHJEP-UHFFFAOYSA-N 1 2 249.358 2.190 20 0 BEADLO C[C@H](c1nc(CC(C)(C)C)no1)[NH+](C)C ZINC000923891478 637007108 /nfs/dbraw/zinc/00/71/08/637007108.db2.gz GOSKQJDGYWDURU-MRVPVSSYSA-N 1 2 211.309 2.281 20 0 BEADLO CCC(F)(F)COC(=O)[C@@H]1CCC[N@@H+]1C(C)C ZINC000923892309 637009269 /nfs/dbraw/zinc/00/92/69/637009269.db2.gz VXYPQZATPLTVBY-JTQLQIEISA-N 1 2 249.301 2.448 20 0 BEADLO CCC(F)(F)COC(=O)[C@@H]1CCC[N@H+]1C(C)C ZINC000923892309 637009273 /nfs/dbraw/zinc/00/92/73/637009273.db2.gz VXYPQZATPLTVBY-JTQLQIEISA-N 1 2 249.301 2.448 20 0 BEADLO CNc1cc(N[C@H]2CC[C@H](C)C2)[nH+]cn1 ZINC000128148645 637009318 /nfs/dbraw/zinc/00/93/18/637009318.db2.gz QOWXHBNGAGUWHI-IUCAKERBSA-N 1 2 206.293 2.119 20 0 BEADLO CCCc1noc([C@@H]2C[C@H]2c2c[nH]c[nH+]2)n1 ZINC000923801118 637018730 /nfs/dbraw/zinc/01/87/30/637018730.db2.gz PPASJBLYSUBYTO-HTQZYQBOSA-N 1 2 218.260 2.016 20 0 BEADLO CC(C)(CNC(=O)CCCC1CC1)n1cc[nH+]c1 ZINC000898909815 637063506 /nfs/dbraw/zinc/06/35/06/637063506.db2.gz VMKWCUCKKZXQBN-UHFFFAOYSA-N 1 2 249.358 2.315 20 0 BEADLO C[C@H](c1nc(CCC(F)(F)F)no1)[NH+](C)C ZINC000923815601 637396515 /nfs/dbraw/zinc/39/65/15/637396515.db2.gz QGUWHZVHEMQZSI-ZCFIWIBFSA-N 1 2 237.225 2.187 20 0 BEADLO CCCCC1(c2nc(C[NH2+]CC)no2)CC1 ZINC000904494380 637423609 /nfs/dbraw/zinc/42/36/09/637423609.db2.gz KTQMVUUBYOHLFN-UHFFFAOYSA-N 1 2 223.320 2.401 20 0 BEADLO Cc1noc(Cc2ccc(-n3cc[nH+]c3)cc2)n1 ZINC000904578855 637437734 /nfs/dbraw/zinc/43/77/34/637437734.db2.gz GZGGUACAKHUQSL-UHFFFAOYSA-N 1 2 240.266 2.155 20 0 BEADLO CCOCOc1cnccc1-c1c[nH]c(C)[nH+]1 ZINC000904881086 637511407 /nfs/dbraw/zinc/51/14/07/637511407.db2.gz CQCBQOIJWWWEOQ-UHFFFAOYSA-N 1 2 233.271 2.153 20 0 BEADLO CCN(CC)C(=O)c1c(C)cc(C)[nH+]c1C ZINC000905034220 637555618 /nfs/dbraw/zinc/55/56/18/637555618.db2.gz CGEKCSRHGWRFFO-UHFFFAOYSA-N 1 2 220.316 2.489 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+]C12C[C@H]1CCC[C@@H]1C2 ZINC000905026378 637574914 /nfs/dbraw/zinc/57/49/14/637574914.db2.gz CNWQJKMWFFHWQA-GHMZBOCLSA-N 1 2 236.359 2.123 20 0 BEADLO CCCc1cncc(OCc2c[nH+]cn2C)c1 ZINC000905097852 637633513 /nfs/dbraw/zinc/63/35/13/637633513.db2.gz ZGXUSYRXQPXALG-UHFFFAOYSA-N 1 2 231.299 2.347 20 0 BEADLO Cc1cc(C)c(C(=O)NCC2CC2)c(C)[nH+]1 ZINC000905782827 637911293 /nfs/dbraw/zinc/91/12/93/637911293.db2.gz AAYIDCASBCPLIW-UHFFFAOYSA-N 1 2 218.300 2.147 20 0 BEADLO CC[C@H](C)[C@H]([NH2+][C@H]1CSC1(C)C)C(=O)OC ZINC000905767249 637922389 /nfs/dbraw/zinc/92/23/89/637922389.db2.gz JQUOOPJGTDNAGY-GUBZILKMSA-N 1 2 245.388 2.058 20 0 BEADLO CC[C@H](C)[C@@H]([NH2+]C[C@]1(C)CC1(F)F)C(=O)OC ZINC000905772393 637926510 /nfs/dbraw/zinc/92/65/10/637926510.db2.gz DSNBQVNZTIWSJF-NGZCFLSTSA-N 1 2 249.301 2.209 20 0 BEADLO Cc1cc(C)c(C(=O)NC[C@H]2C[C@H]2C)c(C)[nH+]1 ZINC000906165000 638080347 /nfs/dbraw/zinc/08/03/47/638080347.db2.gz YMXIDXIKHRXDPM-PRHODGIISA-N 1 2 232.327 2.393 20 0 BEADLO Cc1cc(C)c(C(=O)NC[C@@H]2C[C@H]2C)c(C)[nH+]1 ZINC000906164998 638080926 /nfs/dbraw/zinc/08/09/26/638080926.db2.gz YMXIDXIKHRXDPM-PELKAZGASA-N 1 2 232.327 2.393 20 0 BEADLO Cc1[nH]cc(-c2ccc([C@H]3CCC(=O)N3)cc2)[nH+]1 ZINC000906204341 638107486 /nfs/dbraw/zinc/10/74/86/638107486.db2.gz IODHSVBJPQBIKJ-GFCCVEGCSA-N 1 2 241.294 2.336 20 0 BEADLO c1cn(Cc2ccccc2Cn2cc[nH+]c2)cn1 ZINC000149119635 638127048 /nfs/dbraw/zinc/12/70/48/638127048.db2.gz YYNHSXPYGJETNI-UHFFFAOYSA-N 1 2 238.294 2.176 20 0 BEADLO Cc1cc(C)c(C(=O)N(C)CC2CC2)c(C)[nH+]1 ZINC000906316306 638142754 /nfs/dbraw/zinc/14/27/54/638142754.db2.gz DGMBFHCNXVTHTR-UHFFFAOYSA-N 1 2 232.327 2.489 20 0 BEADLO Cc1cc(C)c(C(=O)NCCCF)c(C)[nH+]1 ZINC000907051006 638294684 /nfs/dbraw/zinc/29/46/84/638294684.db2.gz PHPNUNWHVVVRAH-UHFFFAOYSA-N 1 2 224.279 2.096 20 0 BEADLO C[C@@H]1CCCCN(C(=O)CNc2cccc[nH+]2)C1 ZINC000907465633 638382311 /nfs/dbraw/zinc/38/23/11/638382311.db2.gz CETMNEVUDSEKDB-GFCCVEGCSA-N 1 2 247.342 2.142 20 0 BEADLO CC[C@@H]1[C@@H](C)CCN1C(=O)CNc1cccc[nH+]1 ZINC000907488241 638390194 /nfs/dbraw/zinc/39/01/94/638390194.db2.gz OYFCNBYDQISYLQ-NWDGAFQWSA-N 1 2 247.342 2.141 20 0 BEADLO CCC1(CC)CCN(C(=O)Cc2c[nH+]c[nH]2)CC1 ZINC000907505940 638395106 /nfs/dbraw/zinc/39/51/06/638395106.db2.gz FBTJDVBIHOCVRH-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)Cc2c[nH]c[nH+]2)CC1 ZINC000907629598 638424200 /nfs/dbraw/zinc/42/42/00/638424200.db2.gz FYUCKLLJHQOHHQ-MNOVXSKESA-N 1 2 235.331 2.037 20 0 BEADLO Cc1cc(C)c(C(=O)N2CC(C)(F)C2)c(C)[nH+]1 ZINC000907863055 638490772 /nfs/dbraw/zinc/49/07/72/638490772.db2.gz KELOSNUKEMKKRX-UHFFFAOYSA-N 1 2 236.290 2.191 20 0 BEADLO O=C(CNc1cccc[nH+]1)NCC1=CCCCC1 ZINC000908522906 638996720 /nfs/dbraw/zinc/99/67/20/638996720.db2.gz RTOBTKNWDOFRPE-UHFFFAOYSA-N 1 2 245.326 2.110 20 0 BEADLO Cc1cc(C)c(C(=O)N2CC[C@H](F)C2)c(C)[nH+]1 ZINC000908535619 639005216 /nfs/dbraw/zinc/00/52/16/639005216.db2.gz ATTGMZNBHJDLLA-NSHDSACASA-N 1 2 236.290 2.191 20 0 BEADLO CC(C)C[C@@]1(C)CCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC000908555559 639012619 /nfs/dbraw/zinc/01/26/19/639012619.db2.gz GOVAISOPXQYDNR-CQSZACIVSA-N 1 2 249.358 2.379 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1NC(=O)CNc1cccc[nH+]1 ZINC000909881545 639254308 /nfs/dbraw/zinc/25/43/08/639254308.db2.gz ABABOQLZRJPWGY-VXGBXAGGSA-N 1 2 247.342 2.044 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1NC(=O)CNc1cccc[nH+]1 ZINC000909903658 639266330 /nfs/dbraw/zinc/26/63/30/639266330.db2.gz RHVKBUNTAOZKHF-FZMZJTMJSA-N 1 2 247.342 2.044 20 0 BEADLO C[C@@]1(NC(=O)CNc2cccc[nH+]2)CC=CCC1 ZINC000909930782 639281306 /nfs/dbraw/zinc/28/13/06/639281306.db2.gz IIFBTYYDQMFOEL-CQSZACIVSA-N 1 2 245.326 2.109 20 0 BEADLO C[C@@H]1C[C@@H]2C[C@@H]2C[C@H]1C(=O)OCCn1cc[nH+]c1 ZINC000910076194 639366653 /nfs/dbraw/zinc/36/66/53/639366653.db2.gz KZPOICICEDFWLR-FDYHWXHSSA-N 1 2 248.326 2.109 20 0 BEADLO Cn1c[nH+]cc1Cc1noc([C@@]2(C)C=CCC2)n1 ZINC000923961186 639391896 /nfs/dbraw/zinc/39/18/96/639391896.db2.gz HTSQAUZPLSPNLT-ZDUSSCGKSA-N 1 2 244.298 2.002 20 0 BEADLO C[C@H]1CC(C)(C)CN1C(=O)CNc1cccc[nH+]1 ZINC000910466938 639462923 /nfs/dbraw/zinc/46/29/23/639462923.db2.gz UBXKEIFXKVRIBY-NSHDSACASA-N 1 2 247.342 2.141 20 0 BEADLO C[C@H]1CC[N@H+](Cc2cnn(CCF)c2)C[C@@H]1F ZINC000930243552 639653896 /nfs/dbraw/zinc/65/38/96/639653896.db2.gz GGOAIOZPPMZWEX-JQWIXIFHSA-N 1 2 243.301 2.033 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2cnn(CCF)c2)C[C@@H]1F ZINC000930243552 639653906 /nfs/dbraw/zinc/65/39/06/639653906.db2.gz GGOAIOZPPMZWEX-JQWIXIFHSA-N 1 2 243.301 2.033 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)N1CCCC[C@@H]1C1CCC1 ZINC000911606902 639675646 /nfs/dbraw/zinc/67/56/46/639675646.db2.gz UVSRGSFHBZIPHO-CYBMUJFWSA-N 1 2 247.342 2.133 20 0 BEADLO F[C@@H]1CC[N@H+](C[C@H]2CC[C@H](C(F)(F)F)O2)C1 ZINC000930604339 639817774 /nfs/dbraw/zinc/81/77/74/639817774.db2.gz XDKHSOAJTYRLHX-IWSPIJDZSA-N 1 2 241.228 2.140 20 0 BEADLO F[C@@H]1CC[N@@H+](C[C@H]2CC[C@H](C(F)(F)F)O2)C1 ZINC000930604339 639817776 /nfs/dbraw/zinc/81/77/76/639817776.db2.gz XDKHSOAJTYRLHX-IWSPIJDZSA-N 1 2 241.228 2.140 20 0 BEADLO CC[NH2+]Cc1noc([C@H]2CCC[C@H](C)C2)n1 ZINC000383224461 711476809 /nfs/dbraw/zinc/47/68/09/711476809.db2.gz GFKXKNGGWWVWCQ-UWVGGRQHSA-N 1 2 223.320 2.473 20 0 BEADLO C[C@@H](CNC(=O)c1cc2c[nH+]ccc2[nH]1)C1CC1 ZINC000930644501 639842098 /nfs/dbraw/zinc/84/20/98/639842098.db2.gz SGXMNDOYCKFWQP-VIFPVBQESA-N 1 2 243.310 2.339 20 0 BEADLO C[N@@H+](Cc1nncs1)C1CC(C)(C)C1 ZINC000930700443 639866776 /nfs/dbraw/zinc/86/67/76/639866776.db2.gz FINIZDLRIRRODJ-UHFFFAOYSA-N 1 2 211.334 2.159 20 0 BEADLO C[N@H+](Cc1nncs1)C1CC(C)(C)C1 ZINC000930700443 639866775 /nfs/dbraw/zinc/86/67/75/639866775.db2.gz FINIZDLRIRRODJ-UHFFFAOYSA-N 1 2 211.334 2.159 20 0 BEADLO C[N@@H+](Cc1cnc[nH]1)C[C@H]1CCCC2(CCC2)O1 ZINC000930914470 639983752 /nfs/dbraw/zinc/98/37/52/639983752.db2.gz FCRRUFYBIDKIJY-CYBMUJFWSA-N 1 2 249.358 2.333 20 0 BEADLO C[N@H+](Cc1cnc[nH]1)C[C@H]1CCCC2(CCC2)O1 ZINC000930914470 639983753 /nfs/dbraw/zinc/98/37/53/639983753.db2.gz FCRRUFYBIDKIJY-CYBMUJFWSA-N 1 2 249.358 2.333 20 0 BEADLO C[N@@H+](Cc1c[nH]cn1)C[C@H]1CCCC2(CCC2)O1 ZINC000930914470 639983756 /nfs/dbraw/zinc/98/37/56/639983756.db2.gz FCRRUFYBIDKIJY-CYBMUJFWSA-N 1 2 249.358 2.333 20 0 BEADLO C[N@H+](Cc1c[nH]cn1)C[C@H]1CCCC2(CCC2)O1 ZINC000930914470 639983762 /nfs/dbraw/zinc/98/37/62/639983762.db2.gz FCRRUFYBIDKIJY-CYBMUJFWSA-N 1 2 249.358 2.333 20 0 BEADLO CC12CC(C1)C[N@@H+]2Cc1c(F)cncc1F ZINC000931079097 640061448 /nfs/dbraw/zinc/06/14/48/640061448.db2.gz GJXCSJFOEBJYQF-UHFFFAOYSA-N 1 2 224.254 2.344 20 0 BEADLO CC12CC(C1)C[N@H+]2Cc1c(F)cncc1F ZINC000931079097 640061456 /nfs/dbraw/zinc/06/14/56/640061456.db2.gz GJXCSJFOEBJYQF-UHFFFAOYSA-N 1 2 224.254 2.344 20 0 BEADLO c1nc([C@@H]2CCC[N@H+]2CC2CCCC2)n[nH]1 ZINC000931137891 640071049 /nfs/dbraw/zinc/07/10/49/640071049.db2.gz TWHBOQKHEVQZGA-NSHDSACASA-N 1 2 220.320 2.132 20 0 BEADLO CCC[C@H]1CCCN1c1[nH+]cnc2c1cnn2C ZINC000912462880 640070984 /nfs/dbraw/zinc/07/09/84/640070984.db2.gz KKLUASKIXUFXPD-JTQLQIEISA-N 1 2 245.330 2.132 20 0 BEADLO c1nc([C@@H]2CCC[N@@H+]2CC2CCCC2)n[nH]1 ZINC000931137891 640071055 /nfs/dbraw/zinc/07/10/55/640071055.db2.gz TWHBOQKHEVQZGA-NSHDSACASA-N 1 2 220.320 2.132 20 0 BEADLO CCC[C@@H]1CCCN1c1[nH+]cnc2c1cnn2C ZINC000912462884 640071114 /nfs/dbraw/zinc/07/11/14/640071114.db2.gz KKLUASKIXUFXPD-SNVBAGLBSA-N 1 2 245.330 2.132 20 0 BEADLO c1csc(CC[N@@H+]2CCC[C@H]2c2nnc[nH]2)c1 ZINC000931135921 640073867 /nfs/dbraw/zinc/07/38/67/640073867.db2.gz KHLIQCDJXGEWOL-NSHDSACASA-N 1 2 248.355 2.246 20 0 BEADLO c1csc(CC[N@H+]2CCC[C@H]2c2nnc[nH]2)c1 ZINC000931135921 640073870 /nfs/dbraw/zinc/07/38/70/640073870.db2.gz KHLIQCDJXGEWOL-NSHDSACASA-N 1 2 248.355 2.246 20 0 BEADLO c1nnc([C@@H]2CCC[N@@H+]2[C@@H]2C=CCCC2)[nH]1 ZINC000931137238 640073889 /nfs/dbraw/zinc/07/38/89/640073889.db2.gz XSIBBDWCTYGEEE-MNOVXSKESA-N 1 2 218.304 2.050 20 0 BEADLO c1nnc([C@@H]2CCC[N@H+]2[C@@H]2C=CCCC2)[nH]1 ZINC000931137238 640073894 /nfs/dbraw/zinc/07/38/94/640073894.db2.gz XSIBBDWCTYGEEE-MNOVXSKESA-N 1 2 218.304 2.050 20 0 BEADLO CC1(C)CC(C[N@@H+]2CCC[C@H]2c2nc[nH]n2)C1 ZINC000931143573 640076058 /nfs/dbraw/zinc/07/60/58/640076058.db2.gz XXKKZWGXWTYLDA-NSHDSACASA-N 1 2 234.347 2.378 20 0 BEADLO CC1(C)CC(C[N@H+]2CCC[C@H]2c2nc[nH]n2)C1 ZINC000931143573 640076059 /nfs/dbraw/zinc/07/60/59/640076059.db2.gz XXKKZWGXWTYLDA-NSHDSACASA-N 1 2 234.347 2.378 20 0 BEADLO O=C(N[C@@H]1CCn2c[nH+]cc21)C1(C2CC2)CCC1 ZINC000912584274 640120306 /nfs/dbraw/zinc/12/03/06/640120306.db2.gz GJKWSQIUUQIGIC-LLVKDONJSA-N 1 2 245.326 2.024 20 0 BEADLO CCC/C=C/C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000912615081 640136493 /nfs/dbraw/zinc/13/64/93/640136493.db2.gz VGZGCDICGYMDSF-VOTSOKGWSA-N 1 2 235.331 2.091 20 0 BEADLO COC[C@@H](C[N@@H+]1CC[C@H]1C(F)F)C(C)C ZINC000931426576 640194908 /nfs/dbraw/zinc/19/49/08/640194908.db2.gz NCCICTWLPYMHJW-ZJUUUORDSA-N 1 2 221.291 2.244 20 0 BEADLO COC[C@@H](C[N@H+]1CC[C@H]1C(F)F)C(C)C ZINC000931426576 640194914 /nfs/dbraw/zinc/19/49/14/640194914.db2.gz NCCICTWLPYMHJW-ZJUUUORDSA-N 1 2 221.291 2.244 20 0 BEADLO C[C@H](CNC(=O)[C@H]1CCC1(C)C)Cn1cc[nH+]c1 ZINC000669018892 640197944 /nfs/dbraw/zinc/19/79/44/640197944.db2.gz QVMLCYURILVESS-VXGBXAGGSA-N 1 2 249.358 2.072 20 0 BEADLO CC1(C)CCC(C)(C)N(C(=O)Cc2c[nH+]c[nH]2)C1 ZINC000912986747 640263426 /nfs/dbraw/zinc/26/34/26/640263426.db2.gz HHNBIBSGGIJJJV-UHFFFAOYSA-N 1 2 249.358 2.379 20 0 BEADLO Cc1cc(C)c(C(=O)N2C[C@@H]3C[C@@H]3C2)c(C)[nH+]1 ZINC000912984993 640263647 /nfs/dbraw/zinc/26/36/47/640263647.db2.gz WSONHSCUHRGFOG-TXEJJXNPSA-N 1 2 230.311 2.099 20 0 BEADLO CC(C)c1nsc(C[N@@H+]2CC[C@@H](CF)C2)n1 ZINC000931687692 640306673 /nfs/dbraw/zinc/30/66/73/640306673.db2.gz ZICAIFQKWUVDBP-VIFPVBQESA-N 1 2 243.351 2.453 20 0 BEADLO CC(C)c1nsc(C[N@H+]2CC[C@@H](CF)C2)n1 ZINC000931687692 640306677 /nfs/dbraw/zinc/30/66/77/640306677.db2.gz ZICAIFQKWUVDBP-VIFPVBQESA-N 1 2 243.351 2.453 20 0 BEADLO FC[C@H]1CC[N@H+](Cc2c(F)cncc2F)C1 ZINC000931688728 640317614 /nfs/dbraw/zinc/31/76/14/640317614.db2.gz LNHXNEPSXRPCQU-MRVPVSSYSA-N 1 2 230.233 2.151 20 0 BEADLO FC[C@H]1CC[N@@H+](Cc2c(F)cncc2F)C1 ZINC000931688728 640317623 /nfs/dbraw/zinc/31/76/23/640317623.db2.gz LNHXNEPSXRPCQU-MRVPVSSYSA-N 1 2 230.233 2.151 20 0 BEADLO Fc1cccc2c1CC[C@H]2[NH2+]Cc1nncs1 ZINC000931756837 640351892 /nfs/dbraw/zinc/35/18/92/640351892.db2.gz XUMXARHSUZBBPL-LLVKDONJSA-N 1 2 249.314 2.454 20 0 BEADLO CCc1nc(C[NH2+]Cc2cccnc2)cs1 ZINC000054918001 640419429 /nfs/dbraw/zinc/41/94/29/640419429.db2.gz ZBJGNGULQULMMI-UHFFFAOYSA-N 1 2 233.340 2.390 20 0 BEADLO C[C@H]1CCC[C@H]1NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000932058634 640420235 /nfs/dbraw/zinc/42/02/35/640420235.db2.gz RAYCRBHXYDZODI-GXSJLCMTSA-N 1 2 243.310 2.481 20 0 BEADLO Cc1c(Cl)cnn1C[N@@H+]1CCCSCC1 ZINC000156528094 640464571 /nfs/dbraw/zinc/46/45/71/640464571.db2.gz FNYPGIWQTOWHGK-UHFFFAOYSA-N 1 2 245.779 2.241 20 0 BEADLO Cc1c(Cl)cnn1C[N@H+]1CCCSCC1 ZINC000156528094 640464575 /nfs/dbraw/zinc/46/45/75/640464575.db2.gz FNYPGIWQTOWHGK-UHFFFAOYSA-N 1 2 245.779 2.241 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2scnc2Cl)CCO1 ZINC000932334747 640479040 /nfs/dbraw/zinc/47/90/40/640479040.db2.gz DKCDNZDEGSGGOZ-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2scnc2Cl)CCO1 ZINC000932334747 640479045 /nfs/dbraw/zinc/47/90/45/640479045.db2.gz DKCDNZDEGSGGOZ-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO COC[C@H]([NH2+]Cc1ccoc1)c1ccco1 ZINC000165120935 640539315 /nfs/dbraw/zinc/53/93/15/640539315.db2.gz RTMZBBIUSSKWTF-NSHDSACASA-N 1 2 221.256 2.350 20 0 BEADLO Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1cnon1 ZINC000932561287 640574892 /nfs/dbraw/zinc/57/48/92/640574892.db2.gz KGXYGQMILHKTHX-VIFPVBQESA-N 1 2 235.262 2.368 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2C[C@@H]3C[C@@H]3C[C@@H]2C)cc[nH+]1 ZINC000932605798 640584253 /nfs/dbraw/zinc/58/42/53/640584253.db2.gz GLDWHGGOVIALNX-QVSJOPQTSA-N 1 2 244.338 2.433 20 0 BEADLO CC(C)=CC[NH+]1CC(NC(=O)[C@H]2CC=CCC2)C1 ZINC001030090030 640584989 /nfs/dbraw/zinc/58/49/89/640584989.db2.gz PRZBBRCISVGJOX-ZDUSSCGKSA-N 1 2 248.370 2.109 20 0 BEADLO Cc1cnc(C[NH+]2CCC(F)(C3CC3)CC2)nc1 ZINC000932625607 640587211 /nfs/dbraw/zinc/58/72/11/640587211.db2.gz BAMPSTXURMYUOG-UHFFFAOYSA-N 1 2 249.333 2.499 20 0 BEADLO Cc1noc(C[NH+]2CCC(F)(C3CC3)CC2)n1 ZINC000932626647 640589095 /nfs/dbraw/zinc/58/90/95/640589095.db2.gz MDJVBUYWXJGAMV-UHFFFAOYSA-N 1 2 239.294 2.092 20 0 BEADLO FC1(C2CC2)CC[NH+](Cc2ncc[nH]2)CC1 ZINC000932631126 640590555 /nfs/dbraw/zinc/59/05/55/640590555.db2.gz VNYSOSWRIBDAHO-UHFFFAOYSA-N 1 2 223.295 2.124 20 0 BEADLO CO[C@H](C[N@@H+]1CCCC(=O)[C@@H]1C)C1CCCC1 ZINC000932845179 640617676 /nfs/dbraw/zinc/61/76/76/640617676.db2.gz JBMSLWNLSYDDBH-SMDDNHRTSA-N 1 2 239.359 2.245 20 0 BEADLO CO[C@H](C[N@H+]1CCCC(=O)[C@@H]1C)C1CCCC1 ZINC000932845179 640617679 /nfs/dbraw/zinc/61/76/79/640617679.db2.gz JBMSLWNLSYDDBH-SMDDNHRTSA-N 1 2 239.359 2.245 20 0 BEADLO C[C@@H]1CCC(=O)C[N@@H+]1CCCCCF ZINC000932876532 640636694 /nfs/dbraw/zinc/63/66/94/640636694.db2.gz MHFZMGBJJFCNLJ-SNVBAGLBSA-N 1 2 201.285 2.180 20 0 BEADLO C[C@@H]1CCC(=O)C[N@H+]1CCCCCF ZINC000932876532 640636698 /nfs/dbraw/zinc/63/66/98/640636698.db2.gz MHFZMGBJJFCNLJ-SNVBAGLBSA-N 1 2 201.285 2.180 20 0 BEADLO CC(C)[NH2+][C@@H](C)C(=O)OCc1ccccc1 ZINC000224860172 640647027 /nfs/dbraw/zinc/64/70/27/640647027.db2.gz RKOVHAUSINPHKN-NSHDSACASA-N 1 2 221.300 2.116 20 0 BEADLO CSC[C@@H](C)NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000933176591 640674825 /nfs/dbraw/zinc/67/48/25/640674825.db2.gz OVKQFQGCRMTBKC-MRVPVSSYSA-N 1 2 249.339 2.044 20 0 BEADLO C[N@H+](Cc1ccccn1)Cc1ccc(Cl)nn1 ZINC000167228999 640707900 /nfs/dbraw/zinc/70/79/00/640707900.db2.gz QMXKWJQMAPQIBC-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[N@@H+](Cc1ccccn1)Cc1ccc(Cl)nn1 ZINC000167228999 640707903 /nfs/dbraw/zinc/70/79/03/640707903.db2.gz QMXKWJQMAPQIBC-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO Cl/C=C/C[N@@H+]1CCOC[C@@H]1C[C@@H]1CCCO1 ZINC000933669392 640741047 /nfs/dbraw/zinc/74/10/47/640741047.db2.gz CAYOCKIUSCIAJG-LZUDYNRMSA-N 1 2 245.750 2.009 20 0 BEADLO Cl/C=C/C[N@H+]1CCOC[C@@H]1C[C@@H]1CCCO1 ZINC000933669392 640741049 /nfs/dbraw/zinc/74/10/49/640741049.db2.gz CAYOCKIUSCIAJG-LZUDYNRMSA-N 1 2 245.750 2.009 20 0 BEADLO c1cc(C[N@H+](Cc2ccoc2)C2CC2)on1 ZINC000934002360 640803056 /nfs/dbraw/zinc/80/30/56/640803056.db2.gz TUCZUFKGJWMFMI-UHFFFAOYSA-N 1 2 218.256 2.432 20 0 BEADLO c1cc(C[N@@H+](Cc2ccoc2)C2CC2)on1 ZINC000934002360 640803061 /nfs/dbraw/zinc/80/30/61/640803061.db2.gz TUCZUFKGJWMFMI-UHFFFAOYSA-N 1 2 218.256 2.432 20 0 BEADLO C[C@]1(O)CCC[N@H+](C/C(Cl)=C\Cl)C1 ZINC000228223598 640866738 /nfs/dbraw/zinc/86/67/38/640866738.db2.gz IYMXPAOUGNLHDH-QRJSTWQJSA-N 1 2 224.131 2.152 20 0 BEADLO C[C@]1(O)CCC[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000228223598 640866740 /nfs/dbraw/zinc/86/67/40/640866740.db2.gz IYMXPAOUGNLHDH-QRJSTWQJSA-N 1 2 224.131 2.152 20 0 BEADLO C[C@@H]([NH2+]C[C@H]1CCCS1)C(=O)OC(C)(C)C ZINC000087473049 640898347 /nfs/dbraw/zinc/89/83/47/640898347.db2.gz QTJXTDYVEINUOZ-NXEZZACHSA-N 1 2 245.388 2.202 20 0 BEADLO CCC[C@H]1CCC[C@@H]1C(=O)NC1C[NH+](CC)C1 ZINC001030568570 640920772 /nfs/dbraw/zinc/92/07/72/640920772.db2.gz FQUGRNFEQPXHAU-AAEUAGOBSA-N 1 2 238.375 2.023 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+]1CCc2c(C)cccc2C1 ZINC000171609115 640995182 /nfs/dbraw/zinc/99/51/82/640995182.db2.gz WCHFBJXWPVJGOG-LBPRGKRZSA-N 1 2 247.338 2.305 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+]1CCc2c(C)cccc2C1 ZINC000171609115 640995188 /nfs/dbraw/zinc/99/51/88/640995188.db2.gz WCHFBJXWPVJGOG-LBPRGKRZSA-N 1 2 247.338 2.305 20 0 BEADLO C[C@@H]1CCN(C(=O)c2cc3c[nH+]ccc3[nH]2)[C@@H]1C ZINC000934096823 641063578 /nfs/dbraw/zinc/06/35/78/641063578.db2.gz AIBAAVYBAPRCPK-NXEZZACHSA-N 1 2 243.310 2.433 20 0 BEADLO C[C@@H]1CCN(C(=O)c2cc3c[nH+]ccc3[nH]2)[C@H]1C ZINC000934096826 641063948 /nfs/dbraw/zinc/06/39/48/641063948.db2.gz AIBAAVYBAPRCPK-ZJUUUORDSA-N 1 2 243.310 2.433 20 0 BEADLO C[C@@H]1CSCC[N@@H+]1Cn1cccnc1=S ZINC000172514677 641070190 /nfs/dbraw/zinc/07/01/90/641070190.db2.gz HLCNXSKFDYPLRC-SECBINFHSA-N 1 2 241.385 2.007 20 0 BEADLO C[C@@H]1CSCC[N@H+]1Cn1cccnc1=S ZINC000172514677 641070194 /nfs/dbraw/zinc/07/01/94/641070194.db2.gz HLCNXSKFDYPLRC-SECBINFHSA-N 1 2 241.385 2.007 20 0 BEADLO COC[C@H]([NH2+]CC(F)(F)C(F)F)C(C)C ZINC000230627731 641073675 /nfs/dbraw/zinc/07/36/75/641073675.db2.gz YIBYQVSDSVIRTG-ZETCQYMHSA-N 1 2 231.233 2.147 20 0 BEADLO CCCCOC(=O)[C@H](C)[N@@H+]1CCSC[C@@H]1C ZINC000172831545 641113983 /nfs/dbraw/zinc/11/39/83/641113983.db2.gz IOGSDZOTLTVOCH-QWRGUYRKSA-N 1 2 245.388 2.156 20 0 BEADLO CCCCOC(=O)[C@H](C)[N@H+]1CCSC[C@@H]1C ZINC000172831545 641113986 /nfs/dbraw/zinc/11/39/86/641113986.db2.gz IOGSDZOTLTVOCH-QWRGUYRKSA-N 1 2 245.388 2.156 20 0 BEADLO CC1(C)[C@@H]2C[N@@H+](Cn3ncsc3=S)C[C@@H]21 ZINC000172942315 641137022 /nfs/dbraw/zinc/13/70/22/641137022.db2.gz CHEGNBFOFHSYOW-OCAPTIKFSA-N 1 2 241.385 2.219 20 0 BEADLO CC1(C)[C@@H]2C[N@H+](Cn3ncsc3=S)C[C@@H]21 ZINC000172942315 641137025 /nfs/dbraw/zinc/13/70/25/641137025.db2.gz CHEGNBFOFHSYOW-OCAPTIKFSA-N 1 2 241.385 2.219 20 0 BEADLO CC1(O)CC[NH+](C/C(Cl)=C/Cl)CC1 ZINC000087924255 641162569 /nfs/dbraw/zinc/16/25/69/641162569.db2.gz JKYKDGUCDLKZQW-VURMDHGXSA-N 1 2 224.131 2.152 20 0 BEADLO CCO[C@H]1CC[N@H+](Cc2ncc(C3CC3)o2)C1 ZINC000932974926 641172629 /nfs/dbraw/zinc/17/26/29/641172629.db2.gz ZRWGIXSMGPVLOH-NSHDSACASA-N 1 2 236.315 2.163 20 0 BEADLO CCO[C@H]1CC[N@@H+](Cc2ncc(C3CC3)o2)C1 ZINC000932974926 641172632 /nfs/dbraw/zinc/17/26/32/641172632.db2.gz ZRWGIXSMGPVLOH-NSHDSACASA-N 1 2 236.315 2.163 20 0 BEADLO CCCNc1cc(NCc2ncc(C)o2)nc[nH+]1 ZINC000231689875 641195539 /nfs/dbraw/zinc/19/55/39/641195539.db2.gz STVQLEWXPQYRBA-UHFFFAOYSA-N 1 2 247.302 2.207 20 0 BEADLO CCCNc1cc(NCc2ncc(C)o2)[nH+]cn1 ZINC000231689875 641195541 /nfs/dbraw/zinc/19/55/41/641195541.db2.gz STVQLEWXPQYRBA-UHFFFAOYSA-N 1 2 247.302 2.207 20 0 BEADLO Cc1noc(C[NH2+][C@H](c2ccncc2)C2CC2)n1 ZINC000934685560 641246989 /nfs/dbraw/zinc/24/69/89/641246989.db2.gz GUEYOVGMBISQLB-ZDUSSCGKSA-N 1 2 244.298 2.014 20 0 BEADLO Cc1cc(NC(=O)C2(C)CC=CC2)c(C)c[nH+]1 ZINC000935017459 641319795 /nfs/dbraw/zinc/31/97/95/641319795.db2.gz TWXBHQZMFGBKGU-UHFFFAOYSA-N 1 2 230.311 2.415 20 0 BEADLO CS[C@@H](C)CNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000935045229 641324378 /nfs/dbraw/zinc/32/43/78/641324378.db2.gz WSVCOEACDAUVOZ-QMMMGPOBSA-N 1 2 249.339 2.044 20 0 BEADLO CC1=CCN(C(=O)c2cc3c[nH+]ccc3[nH]2)CC1 ZINC000935085044 641333365 /nfs/dbraw/zinc/33/33/65/641333365.db2.gz UEVMZMHCWCMXGE-UHFFFAOYSA-N 1 2 241.294 2.355 20 0 BEADLO FCCn1cc(C[NH+]2Cc3ccccc3C2)cn1 ZINC000929588171 641370935 /nfs/dbraw/zinc/37/09/35/641370935.db2.gz VUVVJTPUYPASHJ-UHFFFAOYSA-N 1 2 245.301 2.368 20 0 BEADLO CC1CCC(=CC(=O)NCCc2[nH]cc[nH+]2)CC1 ZINC000174765427 641682954 /nfs/dbraw/zinc/68/29/54/641682954.db2.gz WJZDUKKVNAJLKW-UHFFFAOYSA-N 1 2 247.342 2.205 20 0 BEADLO CNc1nc(C(=O)Nc2cc[nH+]c(C)c2)cs1 ZINC000159737672 641698210 /nfs/dbraw/zinc/69/82/10/641698210.db2.gz DNRWWIPCOMVLAK-UHFFFAOYSA-N 1 2 248.311 2.141 20 0 BEADLO CC(C)c1cnc(C[N@@H+](C)CC[C@@H](C)O)o1 ZINC000075777383 641771061 /nfs/dbraw/zinc/77/10/61/641771061.db2.gz USVWBVGIMMKIJU-SNVBAGLBSA-N 1 2 226.320 2.001 20 0 BEADLO CC(C)c1cnc(C[N@H+](C)CC[C@@H](C)O)o1 ZINC000075777383 641771065 /nfs/dbraw/zinc/77/10/65/641771065.db2.gz USVWBVGIMMKIJU-SNVBAGLBSA-N 1 2 226.320 2.001 20 0 BEADLO C[C@@H]1CC[N@H+](Cn2cc(Cl)cn2)CCS1 ZINC000191667994 641936820 /nfs/dbraw/zinc/93/68/20/641936820.db2.gz PMLJRIKZIUZWOA-SECBINFHSA-N 1 2 245.779 2.321 20 0 BEADLO C[C@@H]1CC[N@@H+](Cn2cc(Cl)cn2)CCS1 ZINC000191667994 641936827 /nfs/dbraw/zinc/93/68/27/641936827.db2.gz PMLJRIKZIUZWOA-SECBINFHSA-N 1 2 245.779 2.321 20 0 BEADLO CC(C)(CO)CSc1[nH+]cc2ccccn21 ZINC000917497327 642071865 /nfs/dbraw/zinc/07/18/65/642071865.db2.gz OILMUKRPXFGXGX-UHFFFAOYSA-N 1 2 236.340 2.445 20 0 BEADLO CC/C=C(/C)C(=O)NCCCCn1cc[nH+]c1 ZINC000918706430 642254804 /nfs/dbraw/zinc/25/48/04/642254804.db2.gz STQPPOOVXYQPLN-SDQBBNPISA-N 1 2 235.331 2.136 20 0 BEADLO CCC/C(C)=C\C(=O)NCCCn1cc[nH+]c1 ZINC000920214529 642453345 /nfs/dbraw/zinc/45/33/45/642453345.db2.gz NOFYJQCFQHOCJN-BENRWUELSA-N 1 2 235.331 2.136 20 0 BEADLO O=C(CCCn1cc[nH+]c1)Oc1ccccc1F ZINC000920925992 642559470 /nfs/dbraw/zinc/55/94/70/642559470.db2.gz OKFLICVSRFIODM-UHFFFAOYSA-N 1 2 248.257 2.408 20 0 BEADLO COc1nnc(C[N@H+](C)[C@H](C)C(C)C)s1 ZINC000929201160 642560198 /nfs/dbraw/zinc/56/01/98/642560198.db2.gz MQJUMXAHKYOZDZ-MRVPVSSYSA-N 1 2 229.349 2.023 20 0 BEADLO COc1nnc(C[N@@H+](C)[C@H](C)C(C)C)s1 ZINC000929201160 642560204 /nfs/dbraw/zinc/56/02/04/642560204.db2.gz MQJUMXAHKYOZDZ-MRVPVSSYSA-N 1 2 229.349 2.023 20 0 BEADLO CSCC[C@H](C)Nc1cc[nH+]c(C)n1 ZINC000078293406 642658716 /nfs/dbraw/zinc/65/87/16/642658716.db2.gz OIRSNPYKNNDHKA-QMMMGPOBSA-N 1 2 211.334 2.339 20 0 BEADLO O[C@@H](CNc1cccc[nH+]1)c1cccc(F)c1 ZINC000068998950 642818837 /nfs/dbraw/zinc/81/88/37/642818837.db2.gz CVOIVDNRKXCJLN-LBPRGKRZSA-N 1 2 232.258 2.366 20 0 BEADLO Cc1nonc1C[NH2+][C@H](C)c1ccsc1 ZINC000069795218 642906094 /nfs/dbraw/zinc/90/60/94/642906094.db2.gz CSAKZWIHJODNCT-SSDOTTSWSA-N 1 2 223.301 2.290 20 0 BEADLO C=C(C)COC(=O)[C@@H](c1ccccc1)[NH+](C)C ZINC000181982505 642933036 /nfs/dbraw/zinc/93/30/36/642933036.db2.gz PUILSCMDFHPAJS-CYBMUJFWSA-N 1 2 233.311 2.409 20 0 BEADLO C#CCCCOC(=O)[C@H](c1ccccc1)[NH+](C)C ZINC000181984960 642936609 /nfs/dbraw/zinc/93/66/09/642936609.db2.gz YVKMEURSEASEMR-AWEZNQCLSA-N 1 2 245.322 2.246 20 0 BEADLO CCCOC(=O)[C@H](c1ccccc1)[NH+](C)C ZINC000181984078 642939193 /nfs/dbraw/zinc/93/91/93/642939193.db2.gz FIFLYFSWULRYIL-LBPRGKRZSA-N 1 2 221.300 2.243 20 0 BEADLO CC(C)(O)c1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000214362088 643076420 /nfs/dbraw/zinc/07/64/20/643076420.db2.gz ZWMREOLNPZPDPK-UHFFFAOYSA-N 1 2 202.257 2.304 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@@H](C)Cc1cccs1 ZINC000070917142 643082547 /nfs/dbraw/zinc/08/25/47/643082547.db2.gz UBLJPZLZMSCWPC-UWVGGRQHSA-N 1 2 241.356 2.220 20 0 BEADLO CC1CC[NH+](Cn2cc(Cl)cn2)CC1 ZINC000067710367 643183997 /nfs/dbraw/zinc/18/39/97/643183997.db2.gz JEUBPEMFUUNZSG-UHFFFAOYSA-N 1 2 213.712 2.226 20 0 BEADLO C[C@@H]1CC[C@@H](O)C[N@@H+]1C/C(Cl)=C/Cl ZINC000306777438 643242832 /nfs/dbraw/zinc/24/28/32/643242832.db2.gz NGPGVKMMEDBHPR-NMTTVDAISA-N 1 2 224.131 2.151 20 0 BEADLO C[C@@H]1CC[C@@H](O)C[N@H+]1C/C(Cl)=C/Cl ZINC000306777438 643242838 /nfs/dbraw/zinc/24/28/38/643242838.db2.gz NGPGVKMMEDBHPR-NMTTVDAISA-N 1 2 224.131 2.151 20 0 BEADLO O[C@H](Cn1cc[nH+]c1)c1ccc(F)cc1Cl ZINC000184910234 643248404 /nfs/dbraw/zinc/24/84/04/643248404.db2.gz ZJRJHMJXPCSDOM-LLVKDONJSA-N 1 2 240.665 2.409 20 0 BEADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2cnc[nH]2)o1 ZINC000112341597 643332142 /nfs/dbraw/zinc/33/21/42/643332142.db2.gz IPFZWJANYPHAGT-BXKDBHETSA-N 1 2 231.299 2.416 20 0 BEADLO CC(=O)[C@H]1CCC[N@H+](Cc2csc(C)n2)C1 ZINC000082644622 643359067 /nfs/dbraw/zinc/35/90/67/643359067.db2.gz IZTYJFCUZAOHPO-NSHDSACASA-N 1 2 238.356 2.253 20 0 BEADLO CC(=O)[C@H]1CCC[N@@H+](Cc2csc(C)n2)C1 ZINC000082644622 643359075 /nfs/dbraw/zinc/35/90/75/643359075.db2.gz IZTYJFCUZAOHPO-NSHDSACASA-N 1 2 238.356 2.253 20 0 BEADLO Clc1ccc(C[NH2+]Cc2ccon2)cn1 ZINC000083473806 643464027 /nfs/dbraw/zinc/46/40/27/643464027.db2.gz NTEUVNDZTXXJFJ-UHFFFAOYSA-N 1 2 223.663 2.013 20 0 BEADLO Clc1ccc(C[NH2+]Cc2cocn2)cn1 ZINC000237744472 643699515 /nfs/dbraw/zinc/69/95/15/643699515.db2.gz MNICEOBSDBXCOV-UHFFFAOYSA-N 1 2 223.663 2.013 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C)cc(C)n2)CCO1 ZINC000929258377 643832138 /nfs/dbraw/zinc/83/21/38/643832138.db2.gz XTOAFCAIPKIOPB-CQSZACIVSA-N 1 2 234.343 2.309 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C)cc(C)n2)CCO1 ZINC000929258377 643832142 /nfs/dbraw/zinc/83/21/42/643832142.db2.gz XTOAFCAIPKIOPB-CQSZACIVSA-N 1 2 234.343 2.309 20 0 BEADLO CCCC[N@H+](Cc1nncs1)C1CC1 ZINC000929266296 643873233 /nfs/dbraw/zinc/87/32/33/643873233.db2.gz KYSGVEOYUNXBPM-UHFFFAOYSA-N 1 2 211.334 2.303 20 0 BEADLO CCCC[N@@H+](Cc1nncs1)C1CC1 ZINC000929266296 643873234 /nfs/dbraw/zinc/87/32/34/643873234.db2.gz KYSGVEOYUNXBPM-UHFFFAOYSA-N 1 2 211.334 2.303 20 0 BEADLO Cn1c[nH+]cc1COC(=O)C1C(C)(C)C1(C)C ZINC000085987255 643879228 /nfs/dbraw/zinc/87/92/28/643879228.db2.gz OQLFEIQIYIVTED-UHFFFAOYSA-N 1 2 236.315 2.146 20 0 BEADLO Cc1ccc(F)c(C(=O)OCc2c[nH+]cn2C)c1 ZINC000085988376 643880923 /nfs/dbraw/zinc/88/09/23/643880923.db2.gz NTOCMAWAUTXEDY-UHFFFAOYSA-N 1 2 248.257 2.225 20 0 BEADLO CCC[C@@H](C)C(=O)OCc1ccc[nH+]c1N ZINC000922352694 643980420 /nfs/dbraw/zinc/98/04/20/643980420.db2.gz PBESANJDHLIFQJ-SECBINFHSA-N 1 2 222.288 2.143 20 0 BEADLO C[C@H](CC(=O)OCc1ccc(N)[nH+]c1)C1CC1 ZINC000922386923 643984747 /nfs/dbraw/zinc/98/47/47/643984747.db2.gz RFTGPXTTWCRAEI-SECBINFHSA-N 1 2 234.299 2.143 20 0 BEADLO C[C@H]1CC/C(=C\C(=O)OCc2ccc[nH+]c2N)C1 ZINC000922516390 644005419 /nfs/dbraw/zinc/00/54/19/644005419.db2.gz GEFCEIZEIPBPHQ-NGPGYTDTSA-N 1 2 246.310 2.453 20 0 BEADLO Nc1[nH+]cccc1COC(=O)C(C1CC1)C1CC1 ZINC000922556155 644024862 /nfs/dbraw/zinc/02/48/62/644024862.db2.gz ZDSXLJSCVOQTHH-UHFFFAOYSA-N 1 2 246.310 2.143 20 0 BEADLO c1cnc([C@@H]([NH2+]Cc2ccncc2)C2CC2)nc1 ZINC000922583943 644034355 /nfs/dbraw/zinc/03/43/55/644034355.db2.gz XUHYBOUPKPRXFX-ZDUSSCGKSA-N 1 2 240.310 2.113 20 0 BEADLO CC[C@@H](C)[C@H](C)C(=O)OCc1ccc[nH+]c1N ZINC000922593644 644037374 /nfs/dbraw/zinc/03/73/74/644037374.db2.gz OUQWXKPNSLTROR-ZJUUUORDSA-N 1 2 236.315 2.389 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1C(=O)OCc1ccc(N)[nH+]c1 ZINC000922624032 644042863 /nfs/dbraw/zinc/04/28/63/644042863.db2.gz LLAQWQPTOXGZAG-RISCZKNCSA-N 1 2 248.326 2.389 20 0 BEADLO COCc1cc(C[NH2+]C(C)(C)/C=C\Cl)no1 ZINC000922643773 644048920 /nfs/dbraw/zinc/04/89/20/644048920.db2.gz CKGDSSOMLPLXTP-PLNGDYQASA-N 1 2 244.722 2.442 20 0 BEADLO CC(C)(/C=C/Cl)[NH2+]Cc1cocn1 ZINC000922648417 644052275 /nfs/dbraw/zinc/05/22/75/644052275.db2.gz IYZVQUDKSBCPKA-ONEGZZNKSA-N 1 2 200.669 2.295 20 0 BEADLO Nc1ccc(COC(=O)CCCC2CC2)c[nH+]1 ZINC000922742589 644085548 /nfs/dbraw/zinc/08/55/48/644085548.db2.gz JYORMYZELPPBIQ-UHFFFAOYSA-N 1 2 234.299 2.287 20 0 BEADLO Nc1ccc(COC(=O)[C@@H]2CCC[C@@H]3C[C@@H]32)c[nH+]1 ZINC000922856181 644120102 /nfs/dbraw/zinc/12/01/02/644120102.db2.gz XFSYZYCIUMTTER-UTUOFQBUSA-N 1 2 246.310 2.143 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccnn1C)c1nccs1 ZINC000192251752 644141228 /nfs/dbraw/zinc/14/12/28/644141228.db2.gz HCHHDNRXAPFCKW-DTWKUNHWSA-N 1 2 236.344 2.288 20 0 BEADLO Nc1ccc(COC(=O)C[C@@H]2C[C@H]2C2CC2)c[nH+]1 ZINC000922932419 644192530 /nfs/dbraw/zinc/19/25/30/644192530.db2.gz FMODMFQXHDFJIE-RYUDHWBXSA-N 1 2 246.310 2.143 20 0 BEADLO Cc1cc(C[N@H+]2CCOC[C@H]2C)c(C)o1 ZINC000091810574 644639843 /nfs/dbraw/zinc/63/98/43/644639843.db2.gz NEEZDTZAQHYGBZ-SECBINFHSA-N 1 2 209.289 2.117 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC[C@H]2C)c(C)o1 ZINC000091810574 644639848 /nfs/dbraw/zinc/63/98/48/644639848.db2.gz NEEZDTZAQHYGBZ-SECBINFHSA-N 1 2 209.289 2.117 20 0 BEADLO CC/C(C)=C(/C)C(=O)N[C@H]1CCn2cc[nH+]c2C1 ZINC000779215001 644710838 /nfs/dbraw/zinc/71/08/38/644710838.db2.gz IVIQBVWMZXMDKA-WEHUKYGOSA-N 1 2 247.342 2.061 20 0 BEADLO CCC(C)=C(C)C(=O)Nc1cc[nH+]c(C)c1 ZINC000780016556 644723601 /nfs/dbraw/zinc/72/36/01/644723601.db2.gz NECYOYHGCWAJNM-LUAWRHEFSA-N 1 2 218.300 2.497 20 0 BEADLO CC(C)C[C@@H](C)C(=O)OCCCn1cc[nH+]c1 ZINC000784733764 644764242 /nfs/dbraw/zinc/76/42/42/644764242.db2.gz FBPHKGIKVFZPQG-GFCCVEGCSA-N 1 2 238.331 2.499 20 0 BEADLO COC(=O)[C@@H]([NH2+]CCSC(C)(C)C)C(C)C ZINC000304448439 644908101 /nfs/dbraw/zinc/90/81/01/644908101.db2.gz VCHFJUDQPMCCAQ-JTQLQIEISA-N 1 2 247.404 2.305 20 0 BEADLO CO[C@@H]1C[C@@H]([NH2+]CC(F)(F)C(F)F)C1(C)C ZINC000304541590 644915871 /nfs/dbraw/zinc/91/58/71/644915871.db2.gz NMWSWUYKLPVDSY-RNFRBKRXSA-N 1 2 243.244 2.290 20 0 BEADLO c1cc(C[N@@H+]2C[C@]3(CCCO3)[C@H]2C2CC2)co1 ZINC000816666350 644964937 /nfs/dbraw/zinc/96/49/37/644964937.db2.gz KZTVULJCERUSEI-ZIAGYGMSSA-N 1 2 233.311 2.423 20 0 BEADLO c1cc(C[N@H+]2C[C@]3(CCCO3)[C@H]2C2CC2)co1 ZINC000816666350 644964943 /nfs/dbraw/zinc/96/49/43/644964943.db2.gz KZTVULJCERUSEI-ZIAGYGMSSA-N 1 2 233.311 2.423 20 0 BEADLO Cc1cc(CNC(=O)C2=COCCC2)cc(C)[nH+]1 ZINC000817459219 644983209 /nfs/dbraw/zinc/98/32/09/644983209.db2.gz TUQOKUXUDQJUBO-UHFFFAOYSA-N 1 2 246.310 2.009 20 0 BEADLO CC(C)C[C@H](C(=O)N[C@@H]1C=CCC1)n1cc[nH+]c1 ZINC000824438700 645054759 /nfs/dbraw/zinc/05/47/59/645054759.db2.gz XOJAFUZQMSAUOS-CHWSQXEVSA-N 1 2 247.342 2.305 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NCCCCC1CC1 ZINC000825669889 645062774 /nfs/dbraw/zinc/06/27/74/645062774.db2.gz JKMQKTFGKQYZGF-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NCCCCC1CC1 ZINC000825669889 645062776 /nfs/dbraw/zinc/06/27/76/645062776.db2.gz JKMQKTFGKQYZGF-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO CC(C)C[C@@H]1CCCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC000830020708 645114951 /nfs/dbraw/zinc/11/49/51/645114951.db2.gz DPYVFZNASTVXMM-LBPRGKRZSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H](CC(=O)OC1CCCC1)n1cc[nH+]c1 ZINC000844268002 645319807 /nfs/dbraw/zinc/31/98/07/645319807.db2.gz GBXPTPWZCXIYGZ-SNVBAGLBSA-N 1 2 222.288 2.320 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1Cc1cnc(C)cn1 ZINC000844386223 645327824 /nfs/dbraw/zinc/32/78/24/645327824.db2.gz HXIZJDVGVUETIA-KGLIPLIRSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@H+]1Cc1cnc(C)cn1 ZINC000844386223 645327829 /nfs/dbraw/zinc/32/78/29/645327829.db2.gz HXIZJDVGVUETIA-KGLIPLIRSA-N 1 2 249.358 2.174 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](C)c2cn(C)cn2)c1 ZINC000926663102 645343192 /nfs/dbraw/zinc/34/31/92/645343192.db2.gz UGHFXCKNXJYAPW-JTQLQIEISA-N 1 2 246.314 2.135 20 0 BEADLO CC/C=C/COC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000845448893 645361929 /nfs/dbraw/zinc/36/19/29/645361929.db2.gz MLRZHJVJILVMRX-SGUJLRQBSA-N 1 2 222.288 2.344 20 0 BEADLO C[C@@H]([NH2+][C@H]1C[C@H](O)C1)C(F)(F)c1ccccc1 ZINC000926733254 645392805 /nfs/dbraw/zinc/39/28/05/645392805.db2.gz SJKIFCIFJSXCQB-YUSALJHKSA-N 1 2 241.281 2.280 20 0 BEADLO C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@@H]2F)c2ncnn21 ZINC000926783882 645430249 /nfs/dbraw/zinc/43/02/49/645430249.db2.gz CHSAKCCRMSAKNH-LMLFDSFASA-N 1 2 238.310 2.154 20 0 BEADLO C1=C[C@H](Nc2cc(NCC3CC3)[nH+]cn2)CC1 ZINC000853799095 645498120 /nfs/dbraw/zinc/49/81/20/645498120.db2.gz ADPYVJOILGSVHM-NSHDSACASA-N 1 2 230.315 2.429 20 0 BEADLO C1=C[C@H](Nc2cc(NCC3CC3)nc[nH+]2)CC1 ZINC000853799095 645498127 /nfs/dbraw/zinc/49/81/27/645498127.db2.gz ADPYVJOILGSVHM-NSHDSACASA-N 1 2 230.315 2.429 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)NC[C@@]12C[C@@H]1CCCC2 ZINC000927438585 645613436 /nfs/dbraw/zinc/61/34/36/645613436.db2.gz WSPATZGTQSXAIE-SMDDNHRTSA-N 1 2 247.342 2.039 20 0 BEADLO CC(=O)C[N@@H+]1CC[C@@]2(C)[C@@H](C1)C2(Cl)Cl ZINC000878571039 645818224 /nfs/dbraw/zinc/81/82/24/645818224.db2.gz KZRSRBGMHSUEEJ-BDAKNGLRSA-N 1 2 236.142 2.091 20 0 BEADLO CC(=O)C[N@H+]1CC[C@@]2(C)[C@@H](C1)C2(Cl)Cl ZINC000878571039 645818228 /nfs/dbraw/zinc/81/82/28/645818228.db2.gz KZRSRBGMHSUEEJ-BDAKNGLRSA-N 1 2 236.142 2.091 20 0 BEADLO CC(C)c1ccc(NC(=O)Cn2cc[nH+]c2)cn1 ZINC000928617874 645849443 /nfs/dbraw/zinc/84/94/43/645849443.db2.gz AHMLAVQMGWQKDQ-UHFFFAOYSA-N 1 2 244.298 2.040 20 0 BEADLO C[C@@H](c1ccc(F)nc1)[N@@H+]1CCOC(C)(C)C1 ZINC000929118841 645953218 /nfs/dbraw/zinc/95/32/18/645953218.db2.gz UGICHJGHRPQSGS-JTQLQIEISA-N 1 2 238.306 2.393 20 0 BEADLO C[C@@H](c1ccc(F)nc1)[N@H+]1CCOC(C)(C)C1 ZINC000929118841 645953230 /nfs/dbraw/zinc/95/32/30/645953230.db2.gz UGICHJGHRPQSGS-JTQLQIEISA-N 1 2 238.306 2.393 20 0 BEADLO CCc1onc(C)c1C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000929123928 645954938 /nfs/dbraw/zinc/95/49/38/645954938.db2.gz FGUQARQJUDRNOP-AOOOYVTPSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1onc(C)c1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000929123928 645954944 /nfs/dbraw/zinc/95/49/44/645954944.db2.gz FGUQARQJUDRNOP-AOOOYVTPSA-N 1 2 238.331 2.155 20 0 BEADLO CC[C@H](C)[C@@H](C(=O)OC)[N@H+](C)Cc1ccco1 ZINC000929137691 645966648 /nfs/dbraw/zinc/96/66/48/645966648.db2.gz GXQQTZHUGPSKNX-JQWIXIFHSA-N 1 2 239.315 2.299 20 0 BEADLO CC[C@H](C)[C@@H](C(=O)OC)[N@@H+](C)Cc1ccco1 ZINC000929137691 645966655 /nfs/dbraw/zinc/96/66/55/645966655.db2.gz GXQQTZHUGPSKNX-JQWIXIFHSA-N 1 2 239.315 2.299 20 0 BEADLO CCCCC1(C(=O)NCCCn2cc[nH+]c2)CC1 ZINC000929156584 645980186 /nfs/dbraw/zinc/98/01/86/645980186.db2.gz MGBVUSPKVJAWFG-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO CCC[C@H](C)[N@H+](C)Cc1nnc(OC)s1 ZINC000929251421 646033479 /nfs/dbraw/zinc/03/34/79/646033479.db2.gz BRLYQIDKCHJSDI-QMMMGPOBSA-N 1 2 229.349 2.167 20 0 BEADLO CCC[C@H](C)[N@@H+](C)Cc1nnc(OC)s1 ZINC000929251421 646033487 /nfs/dbraw/zinc/03/34/87/646033487.db2.gz BRLYQIDKCHJSDI-QMMMGPOBSA-N 1 2 229.349 2.167 20 0 BEADLO COc1ccc(C[NH2+][C@@H](C)c2nonc2C)cc1 ZINC000924530574 646049988 /nfs/dbraw/zinc/04/99/88/646049988.db2.gz CUZWAPYOBOYMKM-VIFPVBQESA-N 1 2 247.298 2.237 20 0 BEADLO COc1cc([C@@H](C)[NH2+][C@H](C)c2ccccn2)on1 ZINC000924543801 646063168 /nfs/dbraw/zinc/06/31/68/646063168.db2.gz SCCFRYVRIPDHAU-NXEZZACHSA-N 1 2 247.298 2.490 20 0 BEADLO Cc1nonc1[C@H](C)[NH2+]Cc1cccs1 ZINC000924559259 646069140 /nfs/dbraw/zinc/06/91/40/646069140.db2.gz JGAVYNKGCQCQTE-ZETCQYMHSA-N 1 2 223.301 2.290 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2cnn(C)n2)cc1F ZINC000924588344 646074174 /nfs/dbraw/zinc/07/41/74/646074174.db2.gz FDFPKLVGLUGRAG-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO COCC[N@H+](C)Cc1coc(C(C)(C)C)n1 ZINC000929320080 646077255 /nfs/dbraw/zinc/07/72/55/646077255.db2.gz TWVKTXIGZBPRQG-UHFFFAOYSA-N 1 2 226.320 2.050 20 0 BEADLO COCC[N@@H+](C)Cc1coc(C(C)(C)C)n1 ZINC000929320080 646077258 /nfs/dbraw/zinc/07/72/58/646077258.db2.gz TWVKTXIGZBPRQG-UHFFFAOYSA-N 1 2 226.320 2.050 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCCc2occc21)c1cnn(C)n1 ZINC000924645012 646084489 /nfs/dbraw/zinc/08/44/89/646084489.db2.gz UJPJABYVEDTJHG-GXSJLCMTSA-N 1 2 246.314 2.136 20 0 BEADLO C[C@H](CO)[NH2+][C@@H](C)C(F)(F)c1ccccc1 ZINC000924755147 646102853 /nfs/dbraw/zinc/10/28/53/646102853.db2.gz XFTHXICCRIYVKG-ZJUUUORDSA-N 1 2 229.270 2.137 20 0 BEADLO CCC[N@H+](C)Cc1c(F)cncc1F ZINC000929411008 646109814 /nfs/dbraw/zinc/10/98/14/646109814.db2.gz FQMQKNDVXRMRHG-UHFFFAOYSA-N 1 2 200.232 2.202 20 0 BEADLO CCC[N@@H+](C)Cc1c(F)cncc1F ZINC000929411008 646109817 /nfs/dbraw/zinc/10/98/17/646109817.db2.gz FQMQKNDVXRMRHG-UHFFFAOYSA-N 1 2 200.232 2.202 20 0 BEADLO COc1ccnc([C@H](C)[NH2+]Cc2cc(C)no2)c1 ZINC000924959818 646144473 /nfs/dbraw/zinc/14/44/73/646144473.db2.gz MHFLHHJPEASTFD-JTQLQIEISA-N 1 2 247.298 2.237 20 0 BEADLO C[C@H]1CCC[N@@H+]1Cc1cc(C(F)(F)F)n(C)n1 ZINC000929755199 646285981 /nfs/dbraw/zinc/28/59/81/646285981.db2.gz KMLCBVJGCVLJJF-QMMMGPOBSA-N 1 2 247.264 2.423 20 0 BEADLO C[C@H]1CCC[N@H+]1Cc1cc(C(F)(F)F)n(C)n1 ZINC000929755199 646285988 /nfs/dbraw/zinc/28/59/88/646285988.db2.gz KMLCBVJGCVLJJF-QMMMGPOBSA-N 1 2 247.264 2.423 20 0 BEADLO COc1nnc(C[N@@H+]2C[C@@H](C)CC[C@H]2C)s1 ZINC000929756626 646287790 /nfs/dbraw/zinc/28/77/90/646287790.db2.gz IHKHEHDYBICYDS-DTWKUNHWSA-N 1 2 241.360 2.167 20 0 BEADLO COc1nnc(C[N@H+]2C[C@@H](C)CC[C@H]2C)s1 ZINC000929756626 646287795 /nfs/dbraw/zinc/28/77/95/646287795.db2.gz IHKHEHDYBICYDS-DTWKUNHWSA-N 1 2 241.360 2.167 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccc[nH]1)c1ncco1 ZINC000925646630 646386300 /nfs/dbraw/zinc/38/63/00/646386300.db2.gz VSYAIGIUOQZJNG-DTWKUNHWSA-N 1 2 205.261 2.415 20 0 BEADLO CCc1ncc(C[N@H+](C)Cc2cccnc2)o1 ZINC000930089732 646428865 /nfs/dbraw/zinc/42/88/65/646428865.db2.gz GZLZOUFBCWCURO-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1ncc(C[N@@H+](C)Cc2cccnc2)o1 ZINC000930089732 646428869 /nfs/dbraw/zinc/42/88/69/646428869.db2.gz GZLZOUFBCWCURO-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO Cc1cn(C)nc1C[N@@H+](C)[C@H](C)c1ccncc1 ZINC000930119738 646442093 /nfs/dbraw/zinc/44/20/93/646442093.db2.gz RHTZBSQXXVPYOF-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cn(C)nc1C[N@H+](C)[C@H](C)c1ccncc1 ZINC000930119738 646442099 /nfs/dbraw/zinc/44/20/99/646442099.db2.gz RHTZBSQXXVPYOF-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO COc1cccc([C@H](C)[NH2+]Cc2nncs2)c1 ZINC000930190425 646484691 /nfs/dbraw/zinc/48/46/91/646484691.db2.gz OJLBBVUDGRTBLZ-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO CC(C)OC1CC([NH2+]C2(C(F)F)CC2)C1 ZINC000926364494 646626391 /nfs/dbraw/zinc/62/63/91/646626391.db2.gz JXFSAPSNZIZXGI-UHFFFAOYSA-N 1 2 219.275 2.330 20 0 BEADLO [NH3+][C@H](CC(=O)Nc1cccc(Cl)c1)C(F)F ZINC000724741766 711610032 /nfs/dbraw/zinc/61/00/32/711610032.db2.gz YXTHOKJBSQRCPS-MRVPVSSYSA-N 1 2 248.660 2.261 20 0 BEADLO [NH3+][C@@H](CC(=O)Nc1ccccc1Cl)C(F)F ZINC000724737405 711610321 /nfs/dbraw/zinc/61/03/21/711610321.db2.gz BTCQLAYOSOJLSZ-ZETCQYMHSA-N 1 2 248.660 2.261 20 0 BEADLO Clc1ccc(C[NH+]2CC(CC3CC3)C2)nn1 ZINC000703843549 712090659 /nfs/dbraw/zinc/09/06/59/712090659.db2.gz LLNNMJXHNYKECJ-UHFFFAOYSA-N 1 2 237.734 2.362 20 0 BEADLO C[C@H]1COC[C@@H]1Nc1ccc([NH+](C)C)cc1 ZINC000710887602 712261590 /nfs/dbraw/zinc/26/15/90/712261590.db2.gz DFHOWDSTJUENCU-GWCFXTLKSA-N 1 2 220.316 2.199 20 0 BEADLO CC1(C)CC[N@@H+]1Cc1ccc(Cl)nn1 ZINC000706759946 712372427 /nfs/dbraw/zinc/37/24/27/712372427.db2.gz DREQHZJBTQRMBJ-UHFFFAOYSA-N 1 2 211.696 2.114 20 0 BEADLO CC1(C)CC[N@H+]1Cc1ccc(Cl)nn1 ZINC000706759946 712372428 /nfs/dbraw/zinc/37/24/28/712372428.db2.gz DREQHZJBTQRMBJ-UHFFFAOYSA-N 1 2 211.696 2.114 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2ccns2)nn1C ZINC000715937361 712544269 /nfs/dbraw/zinc/54/42/69/712544269.db2.gz AETIQCIQINYEPA-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO CCn1ccnc1C[NH2+][C@H](C)c1ccns1 ZINC000716034558 712547579 /nfs/dbraw/zinc/54/75/79/712547579.db2.gz QSQWTGMVKLILIF-SECBINFHSA-N 1 2 236.344 2.210 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccns1)c1nccn1C ZINC000716036242 712547840 /nfs/dbraw/zinc/54/78/40/712547840.db2.gz ZYJHLMIXFGYSRZ-DTWKUNHWSA-N 1 2 236.344 2.288 20 0 BEADLO COCC(C)(C)CCNc1cc[nH+]cc1F ZINC000718649878 712776531 /nfs/dbraw/zinc/77/65/31/712776531.db2.gz XDSBODCNXCHZNI-UHFFFAOYSA-N 1 2 226.295 2.117 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cnc(Cl)s2)CCO1 ZINC000720495404 712847246 /nfs/dbraw/zinc/84/72/46/712847246.db2.gz LSOWZRLJYNAQAU-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO CCc1cc(C[NH2+][C@H](C)c2nccs2)[nH]n1 ZINC000381313435 710619866 /nfs/dbraw/zinc/61/98/66/710619866.db2.gz MFIBRQNFLDVPRV-MRVPVSSYSA-N 1 2 236.344 2.279 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1cccnc1F ZINC000381595138 710659291 /nfs/dbraw/zinc/65/92/91/710659291.db2.gz JKUACVCWOVXCRC-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2ccc(O)c(F)c2)[C@@H]1C ZINC000380567426 712901606 /nfs/dbraw/zinc/90/16/06/712901606.db2.gz ZMAORICCVBRYEQ-NXEZZACHSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2ccc(O)c(F)c2)[C@@H]1C ZINC000380567426 712901607 /nfs/dbraw/zinc/90/16/07/712901607.db2.gz ZMAORICCVBRYEQ-NXEZZACHSA-N 1 2 239.290 2.141 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+]CCC(C)(C)SC ZINC000385219984 711008271 /nfs/dbraw/zinc/00/82/71/711008271.db2.gz LBIVMCVIVYBMEQ-VIFPVBQESA-N 1 2 233.377 2.059 20 0 BEADLO C[C@H]1CSC[C@H]1[NH2+]CC(F)(F)C(F)F ZINC000388939476 711070006 /nfs/dbraw/zinc/07/00/06/711070006.db2.gz WUXHUNLVKWQGEI-NTSWFWBYSA-N 1 2 231.258 2.228 20 0 BEADLO C[C@@H]1CSC[C@@H]1[NH2+]CC(F)(F)C(F)F ZINC000388939485 711070172 /nfs/dbraw/zinc/07/01/72/711070172.db2.gz WUXHUNLVKWQGEI-RITPCOANSA-N 1 2 231.258 2.228 20 0 BEADLO CCOC(=O)[C@@H](CC1CC1)[NH2+]CCSCC ZINC000390587036 711126353 /nfs/dbraw/zinc/12/63/53/711126353.db2.gz YLJUFZZOJIZIJA-LLVKDONJSA-N 1 2 245.388 2.061 20 0 BEADLO O[C@@H](C[NH2+][C@@H]1CCCC1(F)F)c1ccccc1 ZINC000398140553 711403220 /nfs/dbraw/zinc/40/32/20/711403220.db2.gz WFUMPAXVEMOSAA-NWDGAFQWSA-N 1 2 241.281 2.497 20 0 BEADLO c1[nH]nnc1C[NH2+][C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000398303475 711407226 /nfs/dbraw/zinc/40/72/26/711407226.db2.gz SQYQQWGQIUBXEZ-QJPTWQEYSA-N 1 2 234.347 2.253 20 0 BEADLO c1n[nH]nc1C[NH2+][C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000398303475 711407229 /nfs/dbraw/zinc/40/72/29/711407229.db2.gz SQYQQWGQIUBXEZ-QJPTWQEYSA-N 1 2 234.347 2.253 20 0 BEADLO CCn1c(C)nn(C[N@@H+]2CC[C@H](C)C2)c1=S ZINC000726590861 711439012 /nfs/dbraw/zinc/43/90/12/711439012.db2.gz WCWXNHLKFMQFOR-VIFPVBQESA-N 1 2 240.376 2.042 20 0 BEADLO CCn1c(C)nn(C[N@H+]2CC[C@H](C)C2)c1=S ZINC000726590861 711439016 /nfs/dbraw/zinc/43/90/16/711439016.db2.gz WCWXNHLKFMQFOR-VIFPVBQESA-N 1 2 240.376 2.042 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2cscn2)n(C)n1 ZINC000381031753 710597750 /nfs/dbraw/zinc/59/77/50/710597750.db2.gz ANFUAKZZUBLFNB-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@H]1CCC=CO1 ZINC000381475114 710642456 /nfs/dbraw/zinc/64/24/56/710642456.db2.gz QGLXDRVRMAOWMO-GXSJLCMTSA-N 1 2 221.304 2.061 20 0 BEADLO Cc1nc(NC[C@H]2CC[C@@H](C3CC3)O2)cc[nH+]1 ZINC000722307558 710705799 /nfs/dbraw/zinc/70/57/99/710705799.db2.gz CHYIDJAZZRQEKV-NEPJUHHUSA-N 1 2 233.315 2.155 20 0 BEADLO CC[C@@H]([NH2+]Cc1cnn(C)n1)c1ccccc1F ZINC000389818698 711090973 /nfs/dbraw/zinc/09/09/73/711090973.db2.gz WOEBVRZCAFSTFO-CYBMUJFWSA-N 1 2 248.305 2.195 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2ccc(F)cc2)[nH]1 ZINC000392474212 711148783 /nfs/dbraw/zinc/14/87/83/711148783.db2.gz VMJQVSITEGJTCQ-QMMMGPOBSA-N 1 2 234.278 2.103 20 0 BEADLO CC(C)OCCC[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000383511355 711512294 /nfs/dbraw/zinc/51/22/94/711512294.db2.gz FLTNSDRKKBCKPX-LLVKDONJSA-N 1 2 245.363 2.121 20 0 BEADLO Cc1ccc(CN(C)c2cc(N(C)C)[nH+]cn2)o1 ZINC000891480691 711532557 /nfs/dbraw/zinc/53/25/57/711532557.db2.gz RSNCRDCRVMGHKO-UHFFFAOYSA-N 1 2 246.314 2.080 20 0 BEADLO Cc1ccc(CN(C)c2cc(N(C)C)nc[nH+]2)o1 ZINC000891480691 711532558 /nfs/dbraw/zinc/53/25/58/711532558.db2.gz RSNCRDCRVMGHKO-UHFFFAOYSA-N 1 2 246.314 2.080 20 0 BEADLO Cc1nc(N[C@@H](C2CC2)[C@@H]2CCCOC2)cc[nH+]1 ZINC000723869768 711540772 /nfs/dbraw/zinc/54/07/72/711540772.db2.gz UBDRPWITCNEMTJ-OCCSQVGLSA-N 1 2 247.342 2.402 20 0 BEADLO Cc1cn(C)nc1C[NH2+][C@H](C)c1ccns1 ZINC000723941428 711546235 /nfs/dbraw/zinc/54/62/35/711546235.db2.gz GXPLTRRIUHPNJQ-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO CO[C@@H]1CCC[C@H]1[NH2+]CC(F)(F)C(F)F ZINC000308875138 711572784 /nfs/dbraw/zinc/57/27/84/711572784.db2.gz NSGCQIVFOXFJRS-RNFRBKRXSA-N 1 2 229.217 2.044 20 0 BEADLO CC[C@H](C)[C@H]([NH2+]CCC(C)(F)F)C(=O)OC ZINC000450725974 711578521 /nfs/dbraw/zinc/57/85/21/711578521.db2.gz SPXXGCVTWCXXCT-IUCAKERBSA-N 1 2 237.290 2.209 20 0 BEADLO CC1CCC(N(C)C(=O)C[C@H]([NH3+])C(F)F)CC1 ZINC000724758457 711610631 /nfs/dbraw/zinc/61/06/31/711610631.db2.gz LOUIORMGJKNELU-RTBKNWGFSA-N 1 2 248.317 2.006 20 0 BEADLO C[C@]1(C(F)(F)F)CC[N@H+](Cc2cnc[nH]2)C1 ZINC000724774179 711611623 /nfs/dbraw/zinc/61/16/23/711611623.db2.gz DXCJZMIDNVGIJH-VIFPVBQESA-N 1 2 233.237 2.184 20 0 BEADLO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2cnc[nH]2)C1 ZINC000724774179 711611625 /nfs/dbraw/zinc/61/16/25/711611625.db2.gz DXCJZMIDNVGIJH-VIFPVBQESA-N 1 2 233.237 2.184 20 0 BEADLO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2cnc[nH]2)C1 ZINC000724774177 711611847 /nfs/dbraw/zinc/61/18/47/711611847.db2.gz DXCJZMIDNVGIJH-SECBINFHSA-N 1 2 233.237 2.184 20 0 BEADLO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2cnc[nH]2)C1 ZINC000724774177 711611849 /nfs/dbraw/zinc/61/18/49/711611849.db2.gz DXCJZMIDNVGIJH-SECBINFHSA-N 1 2 233.237 2.184 20 0 BEADLO Cc1cc(C)c(CNC(=S)NC(C)C)c[nH+]1 ZINC000397094001 711705095 /nfs/dbraw/zinc/70/50/95/711705095.db2.gz MBUXLPVDLNHYOG-UHFFFAOYSA-N 1 2 237.372 2.071 20 0 BEADLO c1ccc(NC[C@H]2CC[C@@H](C3CC3)O2)[nH+]c1 ZINC000722335461 711739409 /nfs/dbraw/zinc/73/94/09/711739409.db2.gz HXKNACPPBZBNPW-NEPJUHHUSA-N 1 2 218.300 2.451 20 0 BEADLO Cc1ncoc1C[N@H+]1CC[C@H](C)[C@H](F)C1 ZINC000894420215 711771464 /nfs/dbraw/zinc/77/14/64/711771464.db2.gz LXQACCNQJJNIIV-WCBMZHEXSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1ncoc1C[N@@H+]1CC[C@H](C)[C@H](F)C1 ZINC000894420215 711771466 /nfs/dbraw/zinc/77/14/66/711771466.db2.gz LXQACCNQJJNIIV-WCBMZHEXSA-N 1 2 212.268 2.163 20 0 BEADLO C/C=C/C[C@H]1CCCN(C(=O)Cc2c[nH+]c[nH]2)C1 ZINC000913354049 711821908 /nfs/dbraw/zinc/82/19/08/711821908.db2.gz YVKQFQOYLRIMEJ-JDGPPOGSSA-N 1 2 247.342 2.157 20 0 BEADLO CCOC1CC2(C[C@@H]2Nc2cccc[nH+]2)C1 ZINC000721296525 711959611 /nfs/dbraw/zinc/95/96/11/711959611.db2.gz DJPHDKGZAPVKOM-AKJDGMEZSA-N 1 2 218.300 2.451 20 0 BEADLO CC(C)CCC(=O)OCc1ccc(N)[nH+]c1 ZINC000922232250 711960804 /nfs/dbraw/zinc/96/08/04/711960804.db2.gz MKEOBTLBZQUJMV-UHFFFAOYSA-N 1 2 222.288 2.143 20 0 BEADLO CC(F)(F)C[NH2+]C[C@@H](O)c1cccc(F)c1 ZINC000700055180 711984908 /nfs/dbraw/zinc/98/49/08/711984908.db2.gz DOHOKASMISTICI-SNVBAGLBSA-N 1 2 233.233 2.104 20 0 BEADLO COC(=O)[C@@H]([NH2+]CC(C)(C)C(C)(F)F)C1CC1 ZINC000700363573 711990741 /nfs/dbraw/zinc/99/07/41/711990741.db2.gz LIXAAUWBCASTAO-VIFPVBQESA-N 1 2 249.301 2.209 20 0 BEADLO CCCNc1cc(N2CC=CCC2)nc[nH+]1 ZINC000707156170 712165648 /nfs/dbraw/zinc/16/56/48/712165648.db2.gz QBENZJNTYUFSDJ-UHFFFAOYSA-N 1 2 218.304 2.065 20 0 BEADLO CCCNc1cc(N2CC=CCC2)[nH+]cn1 ZINC000707156170 712165650 /nfs/dbraw/zinc/16/56/50/712165650.db2.gz QBENZJNTYUFSDJ-UHFFFAOYSA-N 1 2 218.304 2.065 20 0 BEADLO Cc1[nH]c(CN2CC[C@H](C(F)(F)F)C2)[nH+]c1C ZINC000709063625 712206485 /nfs/dbraw/zinc/20/64/85/712206485.db2.gz DYNQPZIWAJDXMI-VIFPVBQESA-N 1 2 247.264 2.411 20 0 BEADLO Cc1[nH]c(CNc2ccc(F)nc2)[nH+]c1C ZINC000709065542 712206923 /nfs/dbraw/zinc/20/69/23/712206923.db2.gz CATUKUVNCOUGPP-UHFFFAOYSA-N 1 2 220.251 2.173 20 0 BEADLO C[C@H](O)C[N@H+](C/C(Cl)=C/Cl)C1CC1 ZINC000709487205 712222686 /nfs/dbraw/zinc/22/26/86/712222686.db2.gz YZWMJRFZTNNGMF-OJKBXMANSA-N 1 2 224.131 2.151 20 0 BEADLO C[C@H](O)C[N@@H+](C/C(Cl)=C/Cl)C1CC1 ZINC000709487205 712222688 /nfs/dbraw/zinc/22/26/88/712222688.db2.gz YZWMJRFZTNNGMF-OJKBXMANSA-N 1 2 224.131 2.151 20 0 BEADLO Cc1nc(NC[C@H]2CCC3(CCC3)O2)cc[nH+]1 ZINC000711439934 712300539 /nfs/dbraw/zinc/30/05/39/712300539.db2.gz ZVAZRRBRTYNSIM-LLVKDONJSA-N 1 2 233.315 2.299 20 0 BEADLO C[C@H]([NH2+]Cc1nccn1C1CC1)c1ccccn1 ZINC000711726130 712322608 /nfs/dbraw/zinc/32/26/08/712322608.db2.gz OOCVQZXHLZVBFD-NSHDSACASA-N 1 2 242.326 2.464 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1C=CCC1 ZINC000711786342 712330326 /nfs/dbraw/zinc/33/03/26/712330326.db2.gz MYKXZBFGOHFTRI-SNVBAGLBSA-N 1 2 204.273 2.468 20 0 BEADLO CC[C@]1(C)CC[N@H+](Cn2ncn(C)c2=S)C1 ZINC000758399843 712408572 /nfs/dbraw/zinc/40/85/72/712408572.db2.gz ZVZQHEVWCKWJRX-LLVKDONJSA-N 1 2 240.376 2.031 20 0 BEADLO CC[C@]1(C)CC[N@@H+](Cn2ncn(C)c2=S)C1 ZINC000758399843 712408573 /nfs/dbraw/zinc/40/85/73/712408573.db2.gz ZVZQHEVWCKWJRX-LLVKDONJSA-N 1 2 240.376 2.031 20 0 BEADLO FC1(F)[C@H]2C[N@H+](Cc3cccnc3Cl)C[C@H]21 ZINC000715418471 712518462 /nfs/dbraw/zinc/51/84/62/712518462.db2.gz VJAHAWLDQUOLAC-DTORHVGOSA-N 1 2 244.672 2.432 20 0 BEADLO FC1(F)[C@H]2C[N@@H+](Cc3cccnc3Cl)C[C@H]21 ZINC000715418471 712518465 /nfs/dbraw/zinc/51/84/65/712518465.db2.gz VJAHAWLDQUOLAC-DTORHVGOSA-N 1 2 244.672 2.432 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCCc2occc21)c1cn(C)nn1 ZINC000715849929 712535978 /nfs/dbraw/zinc/53/59/78/712535978.db2.gz HAEANUQELRURBC-MWLCHTKSSA-N 1 2 246.314 2.136 20 0 BEADLO CCCn1cc([C@H](C)[NH2+]Cc2ccoc2)nn1 ZINC000715894715 712540878 /nfs/dbraw/zinc/54/08/78/712540878.db2.gz JPVFKDFRKIWRJR-JTQLQIEISA-N 1 2 234.303 2.132 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2ccns2)on1 ZINC000715997555 712551629 /nfs/dbraw/zinc/55/16/29/712551629.db2.gz ZIXCRDOPVUIBDM-MRVPVSSYSA-N 1 2 223.301 2.290 20 0 BEADLO C[C@@H]1CC[C@@H](OC(=O)CCc2ccc(N)[nH+]c2)C1 ZINC000815224292 712588593 /nfs/dbraw/zinc/58/85/93/712588593.db2.gz SMORIZQOIZECFV-ZYHUDNBSSA-N 1 2 248.326 2.328 20 0 BEADLO C[C@@H]1C[N@H+](CC[C@@H]2CC2(Cl)Cl)CCO1 ZINC000822564896 712591265 /nfs/dbraw/zinc/59/12/65/712591265.db2.gz YXTMMVASHINSJH-RKDXNWHRSA-N 1 2 238.158 2.291 20 0 BEADLO C[C@@H]1C[N@@H+](CC[C@@H]2CC2(Cl)Cl)CCO1 ZINC000822564896 712591267 /nfs/dbraw/zinc/59/12/67/712591267.db2.gz YXTMMVASHINSJH-RKDXNWHRSA-N 1 2 238.158 2.291 20 0 BEADLO Cc1coc(C[NH2+]Cc2conc2C)c1 ZINC000718135915 712747380 /nfs/dbraw/zinc/74/73/80/712747380.db2.gz RQMFGPLZBLYVQQ-UHFFFAOYSA-N 1 2 206.245 2.174 20 0 BEADLO C[C@@H]1[C@H](O)CCC[N@@H+]1Cc1scnc1Cl ZINC000718956131 712790136 /nfs/dbraw/zinc/79/01/36/712790136.db2.gz MAGYBSJOICFOAV-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H]1[C@H](O)CCC[N@H+]1Cc1scnc1Cl ZINC000718956131 712790138 /nfs/dbraw/zinc/79/01/38/712790138.db2.gz MAGYBSJOICFOAV-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO CCC(F)(F)C[NH+]1CCC(C2OCCO2)CC1 ZINC000719025049 712794212 /nfs/dbraw/zinc/79/42/12/712794212.db2.gz SMUOZCGHEGUPRC-UHFFFAOYSA-N 1 2 249.301 2.117 20 0 BEADLO COC(C)(C)[C@H](C)Nc1cc[nH+]c(C)n1 ZINC000720231409 712829048 /nfs/dbraw/zinc/82/90/48/712829048.db2.gz HBBSFNSFLDSKGV-QMMMGPOBSA-N 1 2 209.293 2.010 20 0 BEADLO O[C@H]1C[C@H](CNc2cc(C(F)(F)F)cc[nH+]2)C1 ZINC000720908427 712877507 /nfs/dbraw/zinc/87/75/07/712877507.db2.gz YVCQTFOLPAVSNM-XWEPSHTISA-N 1 2 246.232 2.283 20 0 BEADLO CCOC1CC2(C[C@H]2Nc2cc[nH+]c(C)n2)C1 ZINC000721160819 712893777 /nfs/dbraw/zinc/89/37/77/712893777.db2.gz TYEGDDVAJIGODN-QWKFWESOSA-N 1 2 233.315 2.155 20 0 BEADLO Cc1nc(NCCC2SCCS2)cc[nH+]1 ZINC000693818693 959397254 /nfs/dbraw/zinc/39/72/54/959397254.db2.gz GAKAPOFBYZQFCS-UHFFFAOYSA-N 1 2 241.385 2.393 20 0 BEADLO FC(F)[C@@H]1CCC[N@H+](Cc2ncco2)C1 ZINC001141007217 960186347 /nfs/dbraw/zinc/18/63/47/960186347.db2.gz CATXZCDWOMFEPF-MRVPVSSYSA-N 1 2 216.231 2.152 20 0 BEADLO FC(F)[C@@H]1CCC[N@@H+](Cc2ncco2)C1 ZINC001141007217 960186353 /nfs/dbraw/zinc/18/63/53/960186353.db2.gz CATXZCDWOMFEPF-MRVPVSSYSA-N 1 2 216.231 2.152 20 0 BEADLO c1ncc(C[NH+]2Cc3ccccc3C2)o1 ZINC001140926974 960694727 /nfs/dbraw/zinc/69/47/27/960694727.db2.gz BIUKLCQAKAQHNF-UHFFFAOYSA-N 1 2 200.241 2.190 20 0 BEADLO C[C@@H]1CC[N@@H+]1Cc1cc(F)c(O)c(F)c1 ZINC001140988052 960777752 /nfs/dbraw/zinc/77/77/52/960777752.db2.gz LGAMQNWSKVQVNE-SSDOTTSWSA-N 1 2 213.227 2.265 20 0 BEADLO C[C@@H]1CC[N@H+]1Cc1cc(F)c(O)c(F)c1 ZINC001140988052 960777770 /nfs/dbraw/zinc/77/77/70/960777770.db2.gz LGAMQNWSKVQVNE-SSDOTTSWSA-N 1 2 213.227 2.265 20 0 BEADLO CCCC[C@H](C(=O)NC1C[NH+](CC)C1)C(C)C ZINC001268492240 961873463 /nfs/dbraw/zinc/87/34/63/961873463.db2.gz TYIFCHQTOYNNGM-ZDUSSCGKSA-N 1 2 240.391 2.269 20 0 BEADLO CCCCC1CC[NH+](Cc2cnn[nH]2)CC1 ZINC001203199377 962235101 /nfs/dbraw/zinc/23/51/01/962235101.db2.gz GZGCWAMQIMXNSG-UHFFFAOYSA-N 1 2 222.336 2.207 20 0 BEADLO CCCCC1CC[NH+](Cc2c[nH]nn2)CC1 ZINC001203199377 962235112 /nfs/dbraw/zinc/23/51/12/962235112.db2.gz GZGCWAMQIMXNSG-UHFFFAOYSA-N 1 2 222.336 2.207 20 0 BEADLO COC1(OC)CC[C@H]1Nc1ccc(C)[nH+]c1C ZINC000710999813 962579111 /nfs/dbraw/zinc/57/91/11/962579111.db2.gz YAOOPXBNAZSOJI-GFCCVEGCSA-N 1 2 236.315 2.262 20 0 BEADLO CCCN(C)c1nc(C)[nH+]c2c1CCC2 ZINC001156877574 963477971 /nfs/dbraw/zinc/47/79/71/963477971.db2.gz DTNPLHYQUMGQRK-UHFFFAOYSA-N 1 2 205.305 2.120 20 0 BEADLO Cc1c[nH+]cc(N[C@@H](CO)C(C)C)c1C ZINC001161741295 964727325 /nfs/dbraw/zinc/72/73/25/964727325.db2.gz XCPCNNBTRWBHQS-LBPRGKRZSA-N 1 2 208.305 2.127 20 0 BEADLO CCOC(=O)c1c(C)cc(N(C)CC)[nH+]c1C ZINC001163583570 965464749 /nfs/dbraw/zinc/46/47/49/965464749.db2.gz FHWFNFJVRMEZLV-UHFFFAOYSA-N 1 2 236.315 2.331 20 0 BEADLO Cc1c[nH+]c(N(C)C(C)C)nc1N1CCCC1 ZINC001163617266 965478249 /nfs/dbraw/zinc/47/82/49/965478249.db2.gz FIXPAPGUPLVQQF-UHFFFAOYSA-N 1 2 234.347 2.230 20 0 BEADLO Cc1c(F)cc[nH+]c1N1CCOCC(F)(F)C1 ZINC001163974062 965669405 /nfs/dbraw/zinc/66/94/05/965669405.db2.gz IXFQLRNBTIQWHF-UHFFFAOYSA-N 1 2 246.232 2.001 20 0 BEADLO Cc1cc(N[C@@H](C)CCO)cc(OC(F)F)[nH+]1 ZINC001165965840 966216015 /nfs/dbraw/zinc/21/60/15/966216015.db2.gz FZSFQLZJYUTBNT-ZETCQYMHSA-N 1 2 246.257 2.174 20 0 BEADLO CC1(C)C[N@H+](Cc2ccoc2)CCC1=O ZINC001204245426 966942931 /nfs/dbraw/zinc/94/29/31/966942931.db2.gz NYJXQVRMMMHTSR-UHFFFAOYSA-N 1 2 207.273 2.081 20 0 BEADLO CC1(C)C[N@@H+](Cc2ccoc2)CCC1=O ZINC001204245426 966942935 /nfs/dbraw/zinc/94/29/35/966942935.db2.gz NYJXQVRMMMHTSR-UHFFFAOYSA-N 1 2 207.273 2.081 20 0 BEADLO c1csc(C[N@H+]2CC[C@H]3CCCO[C@@H]3C2)n1 ZINC001204545612 967041959 /nfs/dbraw/zinc/04/19/59/967041959.db2.gz ZITLENPZDSVWMD-GHMZBOCLSA-N 1 2 238.356 2.144 20 0 BEADLO COc1nc(C)ccc1Nc1c[nH+]c(C)c(N)c1 ZINC001210287175 1165864034 /nfs/dbraw/zinc/86/40/34/1165864034.db2.gz NEJIJDGCOXGNJR-UHFFFAOYSA-N 1 2 244.298 2.428 20 0 BEADLO Cc1cc(Cc2ccc(C)[nH+]c2C)n(C)n1 ZINC001250417311 967825380 /nfs/dbraw/zinc/82/53/80/967825380.db2.gz FPGSKPCCDUFFEO-UHFFFAOYSA-N 1 2 215.300 2.331 20 0 BEADLO COc1ccccc1-c1ccc[nH+]c1N ZINC000069841442 1165905564 /nfs/dbraw/zinc/90/55/64/1165905564.db2.gz DWLJMRTTZQZBGH-UHFFFAOYSA-N 1 2 200.241 2.339 20 0 BEADLO CCCc1ccc(OCC[NH+]2CCOCC2)cc1 ZINC000167079904 1165963503 /nfs/dbraw/zinc/96/35/03/1165963503.db2.gz NPWBYDTXWRWDKO-UHFFFAOYSA-N 1 2 249.354 2.350 20 0 BEADLO Nc1cc[nH+]c(-c2cc(F)c(O)cc2F)c1 ZINC001206755321 968456580 /nfs/dbraw/zinc/45/65/80/968456580.db2.gz ILVPNNAKQAVOGP-UHFFFAOYSA-N 1 2 222.194 2.315 20 0 BEADLO Cc1ncc(C[N@@H+]2CCCCC23COC3)s1 ZINC001207061112 968589753 /nfs/dbraw/zinc/58/97/53/968589753.db2.gz ARFRRUYJIWPLEP-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO Cc1ncc(C[N@H+]2CCCCC23COC3)s1 ZINC001207061112 968589761 /nfs/dbraw/zinc/58/97/61/968589761.db2.gz ARFRRUYJIWPLEP-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO Cc1cncc(C[N@@H+](C)Cc2cncs2)c1 ZINC001207161890 968669270 /nfs/dbraw/zinc/66/92/70/968669270.db2.gz NHGHLTMKKCVDGD-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO COc1ccc[nH+]c1NCc1ccccc1N ZINC000128543632 1166061777 /nfs/dbraw/zinc/06/17/77/1166061777.db2.gz PXBYHLOPNSPXFP-UHFFFAOYSA-N 1 2 229.283 2.285 20 0 BEADLO C[C@H](C(=O)N1CC[C@@H](C2CCC2)C1)n1cc[nH+]c1 ZINC001348465856 1166089687 /nfs/dbraw/zinc/08/96/87/1166089687.db2.gz QZVHEEQQQQRAQZ-DGCLKSJQSA-N 1 2 247.342 2.093 20 0 BEADLO C[C@@H](C(=O)N1CC[C@@H](C2CCC2)C1)n1cc[nH+]c1 ZINC001348465870 1166090011 /nfs/dbraw/zinc/09/00/11/1166090011.db2.gz QZVHEEQQQQRAQZ-WCQYABFASA-N 1 2 247.342 2.093 20 0 BEADLO O=C1CCC[N@H+](CCCc2ccccc2)C1 ZINC000126750169 1166131095 /nfs/dbraw/zinc/13/10/95/1166131095.db2.gz LWJSPEJVRIEPPM-UHFFFAOYSA-N 1 2 217.312 2.284 20 0 BEADLO O=C1CCC[N@@H+](CCCc2ccccc2)C1 ZINC000126750169 1166131098 /nfs/dbraw/zinc/13/10/98/1166131098.db2.gz LWJSPEJVRIEPPM-UHFFFAOYSA-N 1 2 217.312 2.284 20 0 BEADLO CS[C@H](C)CC[NH+]1C[C@@H](F)[C@H](F)C1 ZINC001208139463 969057293 /nfs/dbraw/zinc/05/72/93/969057293.db2.gz RVRZDUJHGHZZHG-IWSPIJDZSA-N 1 2 209.305 2.120 20 0 BEADLO COC(=O)[C@H]1CC[C@H](C[N@H+](C)CC(F)F)CC1 ZINC001208633567 969178327 /nfs/dbraw/zinc/17/83/27/969178327.db2.gz HRIKCVLRZXRTNX-MGCOHNPYSA-N 1 2 249.301 2.163 20 0 BEADLO COC(=O)[C@H]1CC[C@H](C[N@@H+](C)CC(F)F)CC1 ZINC001208633567 969178330 /nfs/dbraw/zinc/17/83/30/969178330.db2.gz HRIKCVLRZXRTNX-MGCOHNPYSA-N 1 2 249.301 2.163 20 0 BEADLO CC/C=C\CC[N@H+]1CC(F)(F)CC[C@@H]1CO ZINC001208723608 969207485 /nfs/dbraw/zinc/20/74/85/969207485.db2.gz CQNQNZCBEDDUDN-DLRQAJBASA-N 1 2 233.302 2.435 20 0 BEADLO C[C@H](c1nc(C(C)(C)C)no1)n1cc[nH+]c1 ZINC000349795460 969316587 /nfs/dbraw/zinc/31/65/87/969316587.db2.gz SLEMYEFNWLHHLK-MRVPVSSYSA-N 1 2 220.276 2.173 20 0 BEADLO Cc1ccc(NC[C@H](O)C(C)C)c(C)[nH+]1 ZINC001253748623 969367357 /nfs/dbraw/zinc/36/73/57/969367357.db2.gz KLVSXXFNRWDQNN-LBPRGKRZSA-N 1 2 208.305 2.127 20 0 BEADLO CCc1[nH+]ccc(C)c1NC[C@@H](O)C(C)C ZINC001253757689 969378160 /nfs/dbraw/zinc/37/81/60/969378160.db2.gz RDHMMFFNKJAKSO-GFCCVEGCSA-N 1 2 222.332 2.381 20 0 BEADLO CC[C@H](C)[C@H](Nc1c[nH+]cc(C)c1C)C(N)=O ZINC001169155897 969475591 /nfs/dbraw/zinc/47/55/91/969475591.db2.gz FNVQSCUFJDXYBX-UFBFGSQYSA-N 1 2 235.331 2.010 20 0 BEADLO CCCOC1CC[NH+](Cc2cn[nH]c2C)CC1 ZINC001209556131 969541173 /nfs/dbraw/zinc/54/11/73/969541173.db2.gz ZEKNQDYGHQRIMF-UHFFFAOYSA-N 1 2 237.347 2.109 20 0 BEADLO C[C@@H]1CCC[C@@H](C)C1OCC[NH+]1CCOCC1 ZINC001210224752 969839139 /nfs/dbraw/zinc/83/91/39/969839139.db2.gz GNJJUVAAROANNU-CHWSQXEVSA-N 1 2 241.375 2.160 20 0 BEADLO CC[C@H]1CCC[C@H](C[NH2+]Cc2ncn[nH]2)C1 ZINC000394534719 1166595548 /nfs/dbraw/zinc/59/55/48/1166595548.db2.gz CCSLWPJIGXRAAB-QWRGUYRKSA-N 1 2 222.336 2.111 20 0 BEADLO CCOC(=O)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CC2(F)F)C1 ZINC001255337330 970120590 /nfs/dbraw/zinc/12/05/90/970120590.db2.gz PNYQGVSSBLJMOC-OPRDCNLKSA-N 1 2 247.285 2.106 20 0 BEADLO Nc1ccc(Nc2ccccc2O)c[nH+]1 ZINC000019952137 1166651387 /nfs/dbraw/zinc/65/13/87/1166651387.db2.gz GPXZKAQTRBRNJZ-UHFFFAOYSA-N 1 2 201.229 2.113 20 0 BEADLO Cc1cc(Nc2c[nH+]cc(C)c2C)nn1C ZINC001213523654 970344172 /nfs/dbraw/zinc/34/41/72/970344172.db2.gz YXNYYTNJXDEXPC-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO C[C@H](CC(F)(F)F)[N@H+](C1CC1)C1COC1 ZINC001255656019 970433818 /nfs/dbraw/zinc/43/38/18/970433818.db2.gz OVXUXDOKTJHBHX-SSDOTTSWSA-N 1 2 223.238 2.191 20 0 BEADLO C[C@H](CC(F)(F)F)[N@@H+](C1CC1)C1COC1 ZINC001255656019 970433822 /nfs/dbraw/zinc/43/38/22/970433822.db2.gz OVXUXDOKTJHBHX-SSDOTTSWSA-N 1 2 223.238 2.191 20 0 BEADLO CC1(C)C[C@@H](CNc2cc(N)cc(Cl)[nH+]2)O1 ZINC001157663179 970520232 /nfs/dbraw/zinc/52/02/32/970520232.db2.gz QVZNQWACLKOIRV-QMMMGPOBSA-N 1 2 241.722 2.297 20 0 BEADLO Cc1cc(N2CC[C@@H](CO)C2)[nH+]c2ccccc12 ZINC000380619609 1166883612 /nfs/dbraw/zinc/88/36/12/1166883612.db2.gz NAIBWOIYFUTBKG-GFCCVEGCSA-N 1 2 242.322 2.362 20 0 BEADLO CC(C)(C)OCC[NH2+][C@H]1CCCc2[nH]ncc21 ZINC000401958855 970751012 /nfs/dbraw/zinc/75/10/12/970751012.db2.gz YKXWGRALAUEXPV-NSHDSACASA-N 1 2 237.347 2.192 20 0 BEADLO CCCC[C@@](C)(F)C(=O)N(C)C1C[NH+](CC)C1 ZINC001269812802 1167014722 /nfs/dbraw/zinc/01/47/22/1167014722.db2.gz UFLCLESHIOQTIX-CYBMUJFWSA-N 1 2 244.354 2.067 20 0 BEADLO CCCC[C@](C)(F)C(=O)N(C)C1C[NH+](CC)C1 ZINC001269812803 1167014776 /nfs/dbraw/zinc/01/47/76/1167014776.db2.gz UFLCLESHIOQTIX-ZDUSSCGKSA-N 1 2 244.354 2.067 20 0 BEADLO COCc1ccc(C[NH2+]Cc2cnc(C)o2)o1 ZINC000397890906 1167029901 /nfs/dbraw/zinc/02/99/01/1167029901.db2.gz MGDOLMYCKGFSOL-UHFFFAOYSA-N 1 2 236.271 2.012 20 0 BEADLO CCSC[C@@H](C)[N@@H+]1CCC[C@@H](F)C(=O)C1 ZINC001173299378 975191004 /nfs/dbraw/zinc/19/10/04/975191004.db2.gz GHCLYYIESRIWTD-NXEZZACHSA-N 1 2 233.352 2.131 20 0 BEADLO CCSC[C@@H](C)[N@H+]1CCC[C@@H](F)C(=O)C1 ZINC001173299378 975191007 /nfs/dbraw/zinc/19/10/07/975191007.db2.gz GHCLYYIESRIWTD-NXEZZACHSA-N 1 2 233.352 2.131 20 0 BEADLO CCSC[C@@H](C)[N@@H+]1CCC[C@H](F)C(=O)C1 ZINC001173299381 975191445 /nfs/dbraw/zinc/19/14/45/975191445.db2.gz GHCLYYIESRIWTD-ZJUUUORDSA-N 1 2 233.352 2.131 20 0 BEADLO CCSC[C@@H](C)[N@H+]1CCC[C@H](F)C(=O)C1 ZINC001173299381 975191451 /nfs/dbraw/zinc/19/14/51/975191451.db2.gz GHCLYYIESRIWTD-ZJUUUORDSA-N 1 2 233.352 2.131 20 0 BEADLO Cc1ncc(C[NH2+]Cc2ccc(C#N)cc2F)o1 ZINC000398000436 1167039264 /nfs/dbraw/zinc/03/92/64/1167039264.db2.gz VASLCEYJCSGTAO-UHFFFAOYSA-N 1 2 245.257 2.284 20 0 BEADLO c1snnc1C[NH2+]Cc1ccc2c(c1)CCC2 ZINC000398225648 1167046622 /nfs/dbraw/zinc/04/66/22/1167046622.db2.gz FKGUOTMMRCVLIP-UHFFFAOYSA-N 1 2 245.351 2.317 20 0 BEADLO C[C@@H](c1ncccn1)[N@@H+]1CC[C@H](C(F)(F)F)C1 ZINC001332698000 975256793 /nfs/dbraw/zinc/25/67/93/975256793.db2.gz HMZMCQKLEOTVQO-IUCAKERBSA-N 1 2 245.248 2.422 20 0 BEADLO C[C@@H](c1ncccn1)[N@H+]1CC[C@H](C(F)(F)F)C1 ZINC001332698000 975256802 /nfs/dbraw/zinc/25/68/02/975256802.db2.gz HMZMCQKLEOTVQO-IUCAKERBSA-N 1 2 245.248 2.422 20 0 BEADLO CC(C)[C@H]1CCCN(c2cc(N)nc[nH+]2)CC1 ZINC000134113607 1167077834 /nfs/dbraw/zinc/07/78/34/1167077834.db2.gz DOTJLZMZGAVLGI-NSHDSACASA-N 1 2 234.347 2.321 20 0 BEADLO C/C=C\C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000228173503 1167078693 /nfs/dbraw/zinc/07/86/93/1167078693.db2.gz FKDFYKBTNZYAJE-RQOWECAXSA-N 1 2 227.267 2.387 20 0 BEADLO CCOC(=O)[C@@H](CC)Oc1c(C)cc[nH+]c1C ZINC001227264351 975337092 /nfs/dbraw/zinc/33/70/92/975337092.db2.gz LRKMLHNFTUJXDE-LLVKDONJSA-N 1 2 237.299 2.419 20 0 BEADLO C[NH+](C)Cc1nc2cc(Cl)c(F)cc2[nH]1 ZINC000308902358 1167219862 /nfs/dbraw/zinc/21/98/62/1167219862.db2.gz INWQFAMJPLUUBE-UHFFFAOYSA-N 1 2 227.670 2.417 20 0 BEADLO CC[NH+]1CC(Oc2cc(C)cc(F)c2)C1 ZINC001227845694 975730661 /nfs/dbraw/zinc/73/06/61/975730661.db2.gz NATIZMUTRKICHH-UHFFFAOYSA-N 1 2 209.264 2.217 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@H]2C[C@]2(C)C(C)C)[nH+]c1C ZINC000896914164 1167335067 /nfs/dbraw/zinc/33/50/67/1167335067.db2.gz SQALAYDFLMOUTA-BXUZGUMPSA-N 1 2 249.358 2.325 20 0 BEADLO CNc1cc(N[C@@H]2CCC[C@@H](F)C2)[nH+]cn1 ZINC001335533414 977125545 /nfs/dbraw/zinc/12/55/45/977125545.db2.gz KEHQASSBWKWKLX-RKDXNWHRSA-N 1 2 224.283 2.211 20 0 BEADLO CCC(F)(F)C[NH2+]C[C@H](O)c1ccccc1F ZINC000697554982 1167506678 /nfs/dbraw/zinc/50/66/78/1167506678.db2.gz YHIMBYJHSUUPHO-NSHDSACASA-N 1 2 247.260 2.494 20 0 BEADLO CCC(F)(F)C[NH2+]C[C@@H](O)c1ccc(F)cc1 ZINC000697554817 1167507199 /nfs/dbraw/zinc/50/71/99/1167507199.db2.gz XXDKDYFLUSGLKZ-LLVKDONJSA-N 1 2 247.260 2.494 20 0 BEADLO CCC1(Nc2c[nH+]cc(C)c2C)COC1 ZINC001168321177 1167518026 /nfs/dbraw/zinc/51/80/26/1167518026.db2.gz ALMYCPQXCCAPBA-UHFFFAOYSA-N 1 2 206.289 2.289 20 0 BEADLO Cc1cnc(N=C2CCC[N@H+](C)C2)c(F)c1 ZINC001175576432 977579332 /nfs/dbraw/zinc/57/93/32/977579332.db2.gz IGJUOMUXIYNCEU-UHFFFAOYSA-N 1 2 221.279 2.160 20 0 BEADLO Oc1cc(C[N@@H+]2CCCOCC2)ccc1Cl ZINC001231733267 977715485 /nfs/dbraw/zinc/71/54/85/977715485.db2.gz PTQZBQYMTFCQTB-UHFFFAOYSA-N 1 2 241.718 2.268 20 0 BEADLO Oc1cc(C[N@H+]2CCCOCC2)ccc1Cl ZINC001231733267 977715502 /nfs/dbraw/zinc/71/55/02/977715502.db2.gz PTQZBQYMTFCQTB-UHFFFAOYSA-N 1 2 241.718 2.268 20 0 BEADLO FC(F)(F)c1cccnc1C[NH+]1CC=CC1 ZINC001231961793 977812867 /nfs/dbraw/zinc/81/28/67/977812867.db2.gz RDGPISUNPMDLPC-UHFFFAOYSA-N 1 2 228.217 2.472 20 0 BEADLO c1nscc1C[NH+]1CC(c2cccnc2)C1 ZINC001232230064 1167677892 /nfs/dbraw/zinc/67/78/92/1167677892.db2.gz CZKPESXCKABDRF-UHFFFAOYSA-N 1 2 231.324 2.138 20 0 BEADLO Oc1cccc(C[N@@H+]2CCC[C@@H]2CF)c1F ZINC001233055997 978449819 /nfs/dbraw/zinc/44/98/19/978449819.db2.gz YAMYEIVFVCQBET-SNVBAGLBSA-N 1 2 227.254 2.465 20 0 BEADLO Oc1cccc(C[N@H+]2CCC[C@@H]2CF)c1F ZINC001233055997 978449828 /nfs/dbraw/zinc/44/98/28/978449828.db2.gz YAMYEIVFVCQBET-SNVBAGLBSA-N 1 2 227.254 2.465 20 0 BEADLO Cc1cnsc1C[N@@H+]1CCCC(=O)[C@H](C)C1 ZINC001233318038 978551035 /nfs/dbraw/zinc/55/10/35/978551035.db2.gz NJIIIOVXWABJJV-SNVBAGLBSA-N 1 2 238.356 2.253 20 0 BEADLO Cc1cnsc1C[N@H+]1CCCC(=O)[C@H](C)C1 ZINC001233318038 978551041 /nfs/dbraw/zinc/55/10/41/978551041.db2.gz NJIIIOVXWABJJV-SNVBAGLBSA-N 1 2 238.356 2.253 20 0 BEADLO Clc1cncc(C[N@@H+]2CCC[C@@H]3C[C@@H]32)n1 ZINC001233450808 978603724 /nfs/dbraw/zinc/60/37/24/978603724.db2.gz KOKJHHQRDKWROM-SCZZXKLOSA-N 1 2 223.707 2.114 20 0 BEADLO Clc1cncc(C[N@H+]2CCC[C@@H]3C[C@@H]32)n1 ZINC001233450808 978603727 /nfs/dbraw/zinc/60/37/27/978603727.db2.gz KOKJHHQRDKWROM-SCZZXKLOSA-N 1 2 223.707 2.114 20 0 BEADLO COCCc1ccc(Cn2cc[nH+]c2)cc1 ZINC001249937949 978716175 /nfs/dbraw/zinc/71/61/75/978716175.db2.gz GAKQWJPJQFYLGM-UHFFFAOYSA-N 1 2 216.284 2.120 20 0 BEADLO CC[C@H](F)C(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC001338919965 978754617 /nfs/dbraw/zinc/75/46/17/978754617.db2.gz YCUDROIJMDAUPD-VIFPVBQESA-N 1 2 239.294 2.143 20 0 BEADLO CCOc1cc(O)cc(C[N@H+](C)CCF)c1 ZINC001235407743 979037045 /nfs/dbraw/zinc/03/70/45/979037045.db2.gz WFVAIPREGCAIQB-UHFFFAOYSA-N 1 2 227.279 2.192 20 0 BEADLO CCOc1cc(O)cc(C[N@@H+](C)CCF)c1 ZINC001235407743 979037051 /nfs/dbraw/zinc/03/70/51/979037051.db2.gz WFVAIPREGCAIQB-UHFFFAOYSA-N 1 2 227.279 2.192 20 0 BEADLO C[C@H]1CCC[N@@H+]1Cc1ncc(Cl)cn1 ZINC001235404215 979038696 /nfs/dbraw/zinc/03/86/96/979038696.db2.gz IWGLLGAQABICEI-QMMMGPOBSA-N 1 2 211.696 2.114 20 0 BEADLO C[C@H]1CCC[N@H+]1Cc1ncc(Cl)cn1 ZINC001235404215 979038702 /nfs/dbraw/zinc/03/87/02/979038702.db2.gz IWGLLGAQABICEI-QMMMGPOBSA-N 1 2 211.696 2.114 20 0 BEADLO C[C@@H]1CCC[N@@H+]1Cc1ncc(Cl)cn1 ZINC001235404214 979037392 /nfs/dbraw/zinc/03/73/92/979037392.db2.gz IWGLLGAQABICEI-MRVPVSSYSA-N 1 2 211.696 2.114 20 0 BEADLO C[C@@H]1CCC[N@H+]1Cc1ncc(Cl)cn1 ZINC001235404214 979037397 /nfs/dbraw/zinc/03/73/97/979037397.db2.gz IWGLLGAQABICEI-MRVPVSSYSA-N 1 2 211.696 2.114 20 0 BEADLO Cc1nonc1Nc1ccc(C)[nH+]c1C ZINC001203367337 979103699 /nfs/dbraw/zinc/10/36/99/979103699.db2.gz KPKMBMLHXFLPGQ-UHFFFAOYSA-N 1 2 204.233 2.133 20 0 BEADLO CC(C)OCCNc1ccn2cc[nH+]c2c1 ZINC001161788812 1168378020 /nfs/dbraw/zinc/37/80/20/1168378020.db2.gz UZWMBLJQQBMWTM-UHFFFAOYSA-N 1 2 219.288 2.171 20 0 BEADLO CCc1n[nH]cc1C[N@@H+]1CC[C@](C)(F)[C@@H](F)C1 ZINC001237651334 980003676 /nfs/dbraw/zinc/00/36/76/980003676.db2.gz JOFPPAIEUJXSQW-RYUDHWBXSA-N 1 2 243.301 2.244 20 0 BEADLO CCc1n[nH]cc1C[N@H+]1CC[C@](C)(F)[C@@H](F)C1 ZINC001237651334 980003687 /nfs/dbraw/zinc/00/36/87/980003687.db2.gz JOFPPAIEUJXSQW-RYUDHWBXSA-N 1 2 243.301 2.244 20 0 BEADLO CC(C)[C@@H](C)N(C(=O)C[C@H]([NH3+])C(F)F)C1CC1 ZINC001343528097 980142149 /nfs/dbraw/zinc/14/21/49/980142149.db2.gz WHOOMOHFZALHDQ-SCZZXKLOSA-N 1 2 248.317 2.004 20 0 BEADLO CC(C)Oc1cc(C[NH+]2CCC2)c(F)cn1 ZINC001238794707 980325242 /nfs/dbraw/zinc/32/52/42/980325242.db2.gz SCFQAPIPBYPXLU-UHFFFAOYSA-N 1 2 224.279 2.214 20 0 BEADLO CC(C)Oc1cc(N[C@H]2CCCOC2)cc[nH+]1 ZINC001169662935 1168498975 /nfs/dbraw/zinc/49/89/75/1168498975.db2.gz YMAJJVCSYZTTEN-LBPRGKRZSA-N 1 2 236.315 2.460 20 0 BEADLO Oc1cccnc1CNc1ccn2cc[nH+]c2c1 ZINC001169731900 1168500886 /nfs/dbraw/zinc/50/08/86/1168500886.db2.gz SSURSFIKOAGDQO-UHFFFAOYSA-N 1 2 240.266 2.047 20 0 BEADLO C1=C(c2cc[nH+]c(N3CCCC3)c2)COC1 ZINC001239481565 980627292 /nfs/dbraw/zinc/62/72/92/980627292.db2.gz OVOMSOOLMGDEPN-UHFFFAOYSA-N 1 2 216.284 2.095 20 0 BEADLO Fc1cccc2c(C[N@H+]3C[C@H]4C[C@@H](C3)O4)c[nH]c21 ZINC001137057623 1168913407 /nfs/dbraw/zinc/91/34/07/1168913407.db2.gz KBZOMAFJBHADNM-PHIMTYICSA-N 1 2 246.285 2.280 20 0 BEADLO Fc1cccc2c(C[N@@H+]3C[C@H]4C[C@@H](C3)O4)c[nH]c21 ZINC001137057623 1168913411 /nfs/dbraw/zinc/91/34/11/1168913411.db2.gz KBZOMAFJBHADNM-PHIMTYICSA-N 1 2 246.285 2.280 20 0 BEADLO Cc1cc(-c2c[nH+]cn2C)cc(C)c1N ZINC001241883240 983093339 /nfs/dbraw/zinc/09/33/39/983093339.db2.gz LSSSWQKIFLZTJN-UHFFFAOYSA-N 1 2 201.273 2.286 20 0 BEADLO Cc1cn2cc(-c3c[nH]nc3C)ccc2[nH+]1 ZINC001240520988 1169017462 /nfs/dbraw/zinc/01/74/62/1169017462.db2.gz HJDXHDNSEKSOBD-UHFFFAOYSA-N 1 2 212.256 2.341 20 0 BEADLO Cc1cc(C[NH+]2CCC([C@H]3CCCO3)CC2)n[nH]1 ZINC001320589368 1169033098 /nfs/dbraw/zinc/03/30/98/1169033098.db2.gz LWLKPWPRXHDZKN-CQSZACIVSA-N 1 2 249.358 2.109 20 0 BEADLO C[C@H](c1nc(-c2ccoc2)no1)n1cc[nH+]c1 ZINC000350836180 1169164565 /nfs/dbraw/zinc/16/45/65/1169164565.db2.gz FWQSCISBDQWFHC-MRVPVSSYSA-N 1 2 230.227 2.135 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cnc(C)nc2)ccn1 ZINC001137416449 1169244557 /nfs/dbraw/zinc/24/45/57/1169244557.db2.gz DEVKYXKKLKCNOZ-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cnc(C)nc2)ccn1 ZINC001137416449 1169244566 /nfs/dbraw/zinc/24/45/66/1169244566.db2.gz DEVKYXKKLKCNOZ-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO C[C@@H]1CC[N@@H+]([C@@H]2CCSC2)CC1(F)F ZINC001255283035 1169245065 /nfs/dbraw/zinc/24/50/65/1169245065.db2.gz XULWRCLHNWUXAC-RKDXNWHRSA-N 1 2 221.316 2.469 20 0 BEADLO C[C@@H]1CC[N@H+]([C@@H]2CCSC2)CC1(F)F ZINC001255283035 1169245071 /nfs/dbraw/zinc/24/50/71/1169245071.db2.gz XULWRCLHNWUXAC-RKDXNWHRSA-N 1 2 221.316 2.469 20 0 BEADLO CCOCC[C@@H](C)[N@@H+]1CCC(F)(F)C1 ZINC001172422704 974696601 /nfs/dbraw/zinc/69/66/01/974696601.db2.gz HSKHRQXHTTVFQQ-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CCOCC[C@@H](C)[N@H+]1CCC(F)(F)C1 ZINC001172422704 974696606 /nfs/dbraw/zinc/69/66/06/974696606.db2.gz HSKHRQXHTTVFQQ-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CCC[C@H]1CCCC[C@H]1[NH2+]Cc1ncn[nH]1 ZINC001327554331 972634296 /nfs/dbraw/zinc/63/42/96/972634296.db2.gz NTXLBSOGEMFHDJ-WDEREUQCSA-N 1 2 222.336 2.253 20 0 BEADLO CCC[C@H]1CCCC[C@@H]1[NH2+]Cc1ncn[nH]1 ZINC001327554330 972636806 /nfs/dbraw/zinc/63/68/06/972636806.db2.gz NTXLBSOGEMFHDJ-QWRGUYRKSA-N 1 2 222.336 2.253 20 0 BEADLO CN(CCF)Cc1c[nH+]cn1Cc1ccccc1 ZINC001138568500 1169360902 /nfs/dbraw/zinc/36/09/02/1169360902.db2.gz UVHZSJVEISWYPL-UHFFFAOYSA-N 1 2 247.317 2.333 20 0 BEADLO CO[C@H](C)C[N@H+](C)Cc1ncoc1C(C)C ZINC001327891009 972794175 /nfs/dbraw/zinc/79/41/75/972794175.db2.gz OBLXVFOJUAQAIW-SNVBAGLBSA-N 1 2 226.320 2.265 20 0 BEADLO CO[C@H](C)C[N@@H+](C)Cc1ncoc1C(C)C ZINC001327891009 972794190 /nfs/dbraw/zinc/79/41/90/972794190.db2.gz OBLXVFOJUAQAIW-SNVBAGLBSA-N 1 2 226.320 2.265 20 0 BEADLO Nc1ccc(N2CCC[C@@H]2c2ccccn2)[nH+]c1 ZINC001156022147 1169422387 /nfs/dbraw/zinc/42/23/87/1169422387.db2.gz MEPVJRLDYDBCHR-CYBMUJFWSA-N 1 2 240.310 2.400 20 0 BEADLO Nc1[nH+]cccc1-c1cccc(C2COC2)c1 ZINC001243474975 970767142 /nfs/dbraw/zinc/76/71/42/970767142.db2.gz BTBJOJNHBUIPJQ-UHFFFAOYSA-N 1 2 226.279 2.445 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@@H+]1[C@H](C)CCC(C)C ZINC001256363121 970768078 /nfs/dbraw/zinc/76/80/78/970768078.db2.gz GWQPJXMUHQVYQU-WOPDTQHZSA-N 1 2 245.338 2.397 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@H+]1[C@H](C)CCC(C)C ZINC001256363121 970768087 /nfs/dbraw/zinc/76/80/87/970768087.db2.gz GWQPJXMUHQVYQU-WOPDTQHZSA-N 1 2 245.338 2.397 20 0 BEADLO CCCN1CC[NH+]([C@H](C)Cc2ccccn2)CC1 ZINC001256418459 970825353 /nfs/dbraw/zinc/82/53/53/970825353.db2.gz WCKAJCRTOZDUSI-CQSZACIVSA-N 1 2 247.386 2.040 20 0 BEADLO CC(C)[N@@H+]1CC[C@H]1c1nnc([C@H]2C[C@H]2C)o1 ZINC001256702086 970928722 /nfs/dbraw/zinc/92/87/22/970928722.db2.gz XOWSEXSYCBGMOP-UTLUCORTSA-N 1 2 221.304 2.348 20 0 BEADLO CC(C)[N@H+]1CC[C@H]1c1nnc([C@H]2C[C@H]2C)o1 ZINC001256702086 970928728 /nfs/dbraw/zinc/92/87/28/970928728.db2.gz XOWSEXSYCBGMOP-UTLUCORTSA-N 1 2 221.304 2.348 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2CC[C@@H]3C[C@@H]3C2)n1 ZINC000403408759 970932949 /nfs/dbraw/zinc/93/29/49/970932949.db2.gz UVUGWQUCTNXZII-OPRDCNLKSA-N 1 2 221.304 2.083 20 0 BEADLO c1cn2cccc(NC3=CCCOC3)c2[nH+]1 ZINC001216505311 971105324 /nfs/dbraw/zinc/10/53/24/971105324.db2.gz PPSXZNQWPMVUIR-UHFFFAOYSA-N 1 2 215.256 2.050 20 0 BEADLO CC(C)C[C@H](OCC[NH+]1CCOCC1)C(C)C ZINC001210206603 1169522023 /nfs/dbraw/zinc/52/20/23/1169522023.db2.gz HCKSUSCJFGYFEN-AWEZNQCLSA-N 1 2 243.391 2.406 20 0 BEADLO CCC[C@H](CC)[NH2+]C1(C(=O)OCC)CC1 ZINC001257247601 971145260 /nfs/dbraw/zinc/14/52/60/971145260.db2.gz XYQFBTZPIJYCJL-JTQLQIEISA-N 1 2 213.321 2.250 20 0 BEADLO Cn1c2ccccc2[nH+]c1NCc1ccns1 ZINC000404289331 971154585 /nfs/dbraw/zinc/15/45/85/971154585.db2.gz KAGYQCXREYOUHT-UHFFFAOYSA-N 1 2 244.323 2.064 20 0 BEADLO CCC[C@H](CC)[NH+]1CC(O)(C(F)(F)F)C1 ZINC001257258373 971155367 /nfs/dbraw/zinc/15/53/67/971155367.db2.gz YQPSQWFPOFXOEF-QMMMGPOBSA-N 1 2 225.254 2.174 20 0 BEADLO CCOC(=O)[C@@H](CC)[NH+]1CCC(F)(F)CC1 ZINC000405054018 971189944 /nfs/dbraw/zinc/18/99/44/971189944.db2.gz JUXSZTOAWSFFDH-SECBINFHSA-N 1 2 235.274 2.059 20 0 BEADLO CCCCCOC(=O)C[NH2+][C@@H](C)CCC ZINC001257314125 971209917 /nfs/dbraw/zinc/20/99/17/971209917.db2.gz IFIPVJCHSMCLBF-NSHDSACASA-N 1 2 215.337 2.498 20 0 BEADLO C[C@H](C(=O)NCCCCC1CC1)n1cc[nH+]c1 ZINC001329881280 974000119 /nfs/dbraw/zinc/00/01/19/974000119.db2.gz VPMGTUPBOUUCQQ-LLVKDONJSA-N 1 2 235.331 2.141 20 0 BEADLO C[NH2+][C@@H](COC(C)(C)C)c1nnc(C2CC2)o1 ZINC001217716779 971350776 /nfs/dbraw/zinc/35/07/76/971350776.db2.gz ALRMGAICWKQJEC-VIFPVBQESA-N 1 2 239.319 2.023 20 0 BEADLO CC[C@H](C)[N@@H+]1CCN(C(=O)OC(C)(C)C)C1 ZINC001257447980 971365690 /nfs/dbraw/zinc/36/56/90/971365690.db2.gz ODNIBFOOMXEHBK-JTQLQIEISA-N 1 2 228.336 2.295 20 0 BEADLO CC[C@H](C)[N@H+]1CCN(C(=O)OC(C)(C)C)C1 ZINC001257447980 971365704 /nfs/dbraw/zinc/36/57/04/971365704.db2.gz ODNIBFOOMXEHBK-JTQLQIEISA-N 1 2 228.336 2.295 20 0 BEADLO CC[NH+]1CC(Oc2ccc(C(F)(F)F)nc2)C1 ZINC001225501852 1169590336 /nfs/dbraw/zinc/59/03/36/1169590336.db2.gz DAQVWBBVMYRGDP-UHFFFAOYSA-N 1 2 246.232 2.183 20 0 BEADLO CC(C)(C)Cc1nnc(CCn2cc[nH+]c2)o1 ZINC001257852300 971502326 /nfs/dbraw/zinc/50/23/26/971502326.db2.gz FNFXWQZBZFPUAY-UHFFFAOYSA-N 1 2 234.303 2.097 20 0 BEADLO C[C@H](c1nnc(CC(C)(C)C)o1)n1cc[nH+]c1 ZINC001257852221 971502626 /nfs/dbraw/zinc/50/26/26/971502626.db2.gz CJLMNNIWUGUYQG-SECBINFHSA-N 1 2 234.303 2.464 20 0 BEADLO FC(F)C[NH2+][C@@H]1COc2ccc(Cl)cc2C1 ZINC001257946951 971544889 /nfs/dbraw/zinc/54/48/89/971544889.db2.gz LROUKTDMVNRWHV-VIFPVBQESA-N 1 2 247.672 2.498 20 0 BEADLO C[NH2+][C@H]1C[C@@H](Oc2ccc(S)cc2C)C1 ZINC001217957239 971546209 /nfs/dbraw/zinc/54/62/09/971546209.db2.gz GHCUKVXYEJGMAC-AOOOYVTPSA-N 1 2 223.341 2.413 20 0 BEADLO Fc1ccc(O[C@H]2CC[NH2+]CC2(F)F)cc1F ZINC001218007433 971567905 /nfs/dbraw/zinc/56/79/05/971567905.db2.gz XCYQOJHZEXFKFA-JTQLQIEISA-N 1 2 249.207 2.341 20 0 BEADLO Fc1cccc(O[C@@H]2CC[NH2+]CC2(F)F)c1 ZINC001218007568 971568189 /nfs/dbraw/zinc/56/81/89/971568189.db2.gz YZMCDYQGYWNWLG-SNVBAGLBSA-N 1 2 231.217 2.202 20 0 BEADLO Fc1ccc(O[C@@H]2CC[NH2+]CC2(F)F)cc1F ZINC001218007435 971569990 /nfs/dbraw/zinc/56/99/90/971569990.db2.gz XCYQOJHZEXFKFA-SNVBAGLBSA-N 1 2 249.207 2.341 20 0 BEADLO Sc1cccc(O[C@H]2CCC[NH2+]C2)c1 ZINC001218280207 971672112 /nfs/dbraw/zinc/67/21/12/971672112.db2.gz YZUKCQXAPYTUQD-JTQLQIEISA-N 1 2 209.314 2.106 20 0 BEADLO C[C@@H](Oc1cc[nH+]cc1)c1ncccn1 ZINC001225290109 974360847 /nfs/dbraw/zinc/36/08/47/974360847.db2.gz UCYJYPRDMNCNSC-SECBINFHSA-N 1 2 201.229 2.012 20 0 BEADLO CC1(C)[C@@H]2C[C@@H](Oc3cc(N)cc[nH+]3)C[C@@H]21 ZINC001218327212 971709589 /nfs/dbraw/zinc/70/95/89/971709589.db2.gz ORLUJKKWGGVTMK-RTCCRHLQSA-N 1 2 218.300 2.477 20 0 BEADLO CCOc1cc(-c2c[nH+]c(N)c(C)c2)ccn1 ZINC001245267499 971755205 /nfs/dbraw/zinc/75/52/05/971755205.db2.gz PYBIUGKGJNVCCU-UHFFFAOYSA-N 1 2 229.283 2.433 20 0 BEADLO CNc1cc(-c2cnc3c(cnn3C)c2)cc[nH+]1 ZINC001245475121 971821321 /nfs/dbraw/zinc/82/13/21/971821321.db2.gz LUKQTECKSFZUMQ-UHFFFAOYSA-N 1 2 239.282 2.072 20 0 BEADLO CC[C@@H](C)OCC[C@H](C)[NH2+]CC(=O)OC(C)C ZINC001172322578 974532536 /nfs/dbraw/zinc/53/25/36/974532536.db2.gz VVNZQAAGRQBJHQ-NWDGAFQWSA-N 1 2 245.363 2.121 20 0 BEADLO Cc1ncc(C)c(-c2c[nH+]c(N)c(C)c2)n1 ZINC001245537063 971850454 /nfs/dbraw/zinc/85/04/54/971850454.db2.gz XBOJHHHSASBSJZ-UHFFFAOYSA-N 1 2 214.272 2.046 20 0 BEADLO CC[C@@H](C)OCC[C@@H](C)[NH2+]CC(=O)OC(C)C ZINC001172322580 974534703 /nfs/dbraw/zinc/53/47/03/974534703.db2.gz VVNZQAAGRQBJHQ-VXGBXAGGSA-N 1 2 245.363 2.121 20 0 BEADLO C[C@H]1COCC[C@@H]1Nc1ccn2cc[nH+]c2c1 ZINC001170818640 971897937 /nfs/dbraw/zinc/89/79/37/971897937.db2.gz MGRRYEBFQLSYNU-JQWIXIFHSA-N 1 2 231.299 2.171 20 0 BEADLO C[C@@H]1COCC[C@@H]1Nc1ccc2[nH+]cn(C)c2c1 ZINC001170819569 971909539 /nfs/dbraw/zinc/90/95/39/971909539.db2.gz OLXUECJHNSCPBS-PWSUYJOCSA-N 1 2 245.326 2.410 20 0 BEADLO CCCOC(=O)C[NH2+][C@@H](C)CCO[C@@H](C)CC ZINC001172353816 974624215 /nfs/dbraw/zinc/62/42/15/974624215.db2.gz YDXXHTVSRMQXOO-RYUDHWBXSA-N 1 2 245.363 2.123 20 0 BEADLO Cc1cccc2c1C[N@H+](Cc1cccnn1)C2 ZINC001139969661 957167845 /nfs/dbraw/zinc/16/78/45/957167845.db2.gz CXFIXUYOGRHQLP-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO Cc1cccc2c1C[N@@H+](Cc1cccnn1)C2 ZINC001139969661 957167856 /nfs/dbraw/zinc/16/78/56/957167856.db2.gz CXFIXUYOGRHQLP-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO Cc1cc2c(cn1)C[N@H+](C[C@@H]1CCC=CO1)C2 ZINC001208878972 957194559 /nfs/dbraw/zinc/19/45/59/957194559.db2.gz AVXLIIYWJASPNV-AWEZNQCLSA-N 1 2 230.311 2.398 20 0 BEADLO Cc1cc2c(cn1)C[N@@H+](C[C@@H]1CCC=CO1)C2 ZINC001208878972 957194564 /nfs/dbraw/zinc/19/45/64/957194564.db2.gz AVXLIIYWJASPNV-AWEZNQCLSA-N 1 2 230.311 2.398 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1ccc2c(c1)OCO2 ZINC001204055619 972252579 /nfs/dbraw/zinc/25/25/79/972252579.db2.gz YDPFRQXQYQBPIC-LBPRGKRZSA-N 1 2 249.310 2.026 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1ccc2c(c1)OCO2 ZINC001204055619 972252582 /nfs/dbraw/zinc/25/25/82/972252582.db2.gz YDPFRQXQYQBPIC-LBPRGKRZSA-N 1 2 249.310 2.026 20 0 BEADLO C[C@@H]1C[C@@H]1C[N@@H+]1CCN(C(=O)OC(C)(C)C)C1 ZINC001209429417 957453181 /nfs/dbraw/zinc/45/31/81/957453181.db2.gz WQBMYYMBRSNPFL-GHMZBOCLSA-N 1 2 240.347 2.153 20 0 BEADLO C[C@@H]1C[C@@H]1C[N@H+]1CCN(C(=O)OC(C)(C)C)C1 ZINC001209429417 957453188 /nfs/dbraw/zinc/45/31/88/957453188.db2.gz WQBMYYMBRSNPFL-GHMZBOCLSA-N 1 2 240.347 2.153 20 0 BEADLO Cn1c[nH+]cc1CCCOC(=O)c1ccccc1 ZINC001346226780 957476545 /nfs/dbraw/zinc/47/65/45/957476545.db2.gz MOUWZSLKMWLNDD-UHFFFAOYSA-N 1 2 244.294 2.210 20 0 BEADLO COc1ccc[nH+]c1NCCOC(F)(F)F ZINC000398142552 957525909 /nfs/dbraw/zinc/52/59/09/957525909.db2.gz VXRGKWNEQDKWIT-UHFFFAOYSA-N 1 2 236.193 2.039 20 0 BEADLO COC[C@H](Nc1cc(N)cc(Cl)[nH+]1)C1CC1 ZINC000397258927 957556065 /nfs/dbraw/zinc/55/60/65/957556065.db2.gz JHVLIGASLCUWAP-VIFPVBQESA-N 1 2 241.722 2.154 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1ccc(O)cc1F ZINC001140124256 957592643 /nfs/dbraw/zinc/59/26/43/957592643.db2.gz HKLUGSDFQGRDGK-SCZZXKLOSA-N 1 2 227.254 2.464 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1ccc(O)cc1F ZINC001140124256 957592648 /nfs/dbraw/zinc/59/26/48/957592648.db2.gz HKLUGSDFQGRDGK-SCZZXKLOSA-N 1 2 227.254 2.464 20 0 BEADLO CCCC=CNc1cc(OC)[nH+]cc1N ZINC001210059791 957629114 /nfs/dbraw/zinc/62/91/14/957629114.db2.gz OJVDGTDHWZFWQL-AATRIKPKSA-N 1 2 207.277 2.398 20 0 BEADLO CC[C@@H]1CCCC[C@H]1OCC[NH+]1CCOCC1 ZINC001210207981 957671017 /nfs/dbraw/zinc/67/10/17/957671017.db2.gz QIDBXHFGDYTRBO-ZIAGYGMSSA-N 1 2 241.375 2.304 20 0 BEADLO CC[C@@H](OCC[NH+]1CCOCC1)C(C)(C)C ZINC001210207180 957672289 /nfs/dbraw/zinc/67/22/89/957672289.db2.gz MIDLHOKHLUSHHF-GFCCVEGCSA-N 1 2 229.364 2.160 20 0 BEADLO CCN(C)c1ccc(Nc2ccn(C)n2)c[nH+]1 ZINC001210352058 957729500 /nfs/dbraw/zinc/72/95/00/957729500.db2.gz RFBUTNPYXMNBPC-UHFFFAOYSA-N 1 2 231.303 2.015 20 0 BEADLO CCN(C)c1ccc(Nc2cncc(N)c2)c[nH+]1 ZINC001210438314 957746656 /nfs/dbraw/zinc/74/66/56/957746656.db2.gz YOLDXYHHFAVLOP-UHFFFAOYSA-N 1 2 243.314 2.259 20 0 BEADLO COc1cccc2c(NC3CC(=O)C3)cc[nH+]c12 ZINC001167344551 957820717 /nfs/dbraw/zinc/82/07/17/957820717.db2.gz QPIFRPMNRPHLKX-UHFFFAOYSA-N 1 2 242.278 2.387 20 0 BEADLO O=C1CC(Nc2ccc(F)c(-n3cc[nH+]c3)c2)C1 ZINC001167347909 957847112 /nfs/dbraw/zinc/84/71/12/957847112.db2.gz IHLHROMUQZXQJR-UHFFFAOYSA-N 1 2 245.257 2.155 20 0 BEADLO CCCn1nccc1Nc1c[nH+]ccc1OC ZINC001210914293 957935619 /nfs/dbraw/zinc/93/56/19/957935619.db2.gz QFICXPGYQODUOQ-UHFFFAOYSA-N 1 2 232.287 2.440 20 0 BEADLO Cc1ncc(C[NH2+]Cc2cc(C#N)ccc2F)o1 ZINC000398006296 957967266 /nfs/dbraw/zinc/96/72/66/957967266.db2.gz XXFWSPLJAIFYSV-UHFFFAOYSA-N 1 2 245.257 2.284 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@@H](C)C2)oc1C ZINC001204535962 958001758 /nfs/dbraw/zinc/00/17/58/958001758.db2.gz BGCQCKPHJKSWNP-JTQLQIEISA-N 1 2 209.289 2.117 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@@H](C)C2)oc1C ZINC001204535962 958001774 /nfs/dbraw/zinc/00/17/74/958001774.db2.gz BGCQCKPHJKSWNP-JTQLQIEISA-N 1 2 209.289 2.117 20 0 BEADLO COCc1cncc(Nc2cc(OC)cc[nH+]2)c1 ZINC001211074868 958018124 /nfs/dbraw/zinc/01/81/24/958018124.db2.gz TWGQXQOEIXYZCJ-UHFFFAOYSA-N 1 2 245.282 2.375 20 0 BEADLO Cc1c[nH+]cc(Nc2ccn(C)n2)c1C ZINC001213523353 958200823 /nfs/dbraw/zinc/20/08/23/958200823.db2.gz QHMZADJGHPSERX-UHFFFAOYSA-N 1 2 202.261 2.176 20 0 BEADLO CC(C)OC1C[NH+](Cc2ccc3c(c2)COC3)C1 ZINC001137029026 972332396 /nfs/dbraw/zinc/33/23/96/972332396.db2.gz MRPSENHBRXPQKL-UHFFFAOYSA-N 1 2 247.338 2.326 20 0 BEADLO C[C@H](Nc1cc[nH+]cc1F)c1ccc(F)cn1 ZINC001167478895 958404867 /nfs/dbraw/zinc/40/48/67/958404867.db2.gz BXXKVPQDQDWKFE-QMMMGPOBSA-N 1 2 235.237 2.350 20 0 BEADLO CC(C)Oc1ccc[nH+]c1N[C@H]1C[C@@H](CO)C1 ZINC000707525282 958569922 /nfs/dbraw/zinc/56/99/22/958569922.db2.gz ARSUCRPAIQWNCI-PHIMTYICSA-N 1 2 236.315 2.052 20 0 BEADLO C[NH+](C)Cc1nnc(C2CC3(CCC3)C2)o1 ZINC001327041559 972378908 /nfs/dbraw/zinc/37/89/08/972378908.db2.gz GKBFDHTZFORMJV-UHFFFAOYSA-N 1 2 221.304 2.179 20 0 BEADLO c1cn(CCO[C@@H]2C[C@H]3CC[C@@H]2C3)c[nH+]1 ZINC001222134723 972380609 /nfs/dbraw/zinc/38/06/09/972380609.db2.gz LLWUGEPKPWASTL-QJPTWQEYSA-N 1 2 206.289 2.088 20 0 BEADLO Cc1cc([C@@H]2CCCN2Cc2[nH]c[nH+]c2C)no1 ZINC001204589106 958925100 /nfs/dbraw/zinc/92/51/00/958925100.db2.gz RMQJAWUYTNCIKJ-ZDUSSCGKSA-N 1 2 246.314 2.352 20 0 BEADLO CC(C)c1cnc(NCc2cc[nH+]c(N)c2)nc1 ZINC001167615835 959073731 /nfs/dbraw/zinc/07/37/31/959073731.db2.gz XSCOTWVAXPBHOE-UHFFFAOYSA-N 1 2 243.314 2.189 20 0 BEADLO Nc1cc(CNc2cnc3cc[nH]c3c2)cc[nH+]1 ZINC001167617851 959089406 /nfs/dbraw/zinc/08/94/06/959089406.db2.gz YBTBEBDQZGGTAP-UHFFFAOYSA-N 1 2 239.282 2.152 20 0 BEADLO Nc1cc(CNc2cccc3ocnc32)cc[nH+]1 ZINC001167617569 959092045 /nfs/dbraw/zinc/09/20/45/959092045.db2.gz PSHPIVMQOYQALX-UHFFFAOYSA-N 1 2 240.266 2.417 20 0 BEADLO CC1C[NH+](Cc2cc(Br)ccn2)C1 ZINC001140761964 959815470 /nfs/dbraw/zinc/81/54/70/959815470.db2.gz IUFNELYTAUMKPM-UHFFFAOYSA-N 1 2 241.132 2.296 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1CC[C@@H]2[C@H](C1)C2(F)F ZINC001353016266 960069145 /nfs/dbraw/zinc/06/91/45/960069145.db2.gz ABWLANFASKLRBM-HLTSFMKQSA-N 1 2 242.244 2.488 20 0 BEADLO O=C1OCC[C@@H]1[NH2+]CCCC1CCCCC1 ZINC000309605075 960304780 /nfs/dbraw/zinc/30/47/80/960304780.db2.gz XQRSYRWBLZQPIU-LBPRGKRZSA-N 1 2 225.332 2.252 20 0 BEADLO c1ccc(NC2(C3CCOCC3)CC2)[nH+]c1 ZINC001167740801 960385814 /nfs/dbraw/zinc/38/58/14/960385814.db2.gz RIKHVXLGSLNKSE-UHFFFAOYSA-N 1 2 218.300 2.453 20 0 BEADLO C[N@H+](CCF)Cc1ccc(OC(F)F)c(O)c1 ZINC001140631779 960470892 /nfs/dbraw/zinc/47/08/92/960470892.db2.gz BAXLRSCAGJVSIX-UHFFFAOYSA-N 1 2 249.232 2.395 20 0 BEADLO C[N@@H+](CCF)Cc1ccc(OC(F)F)c(O)c1 ZINC001140631779 960470900 /nfs/dbraw/zinc/47/09/00/960470900.db2.gz BAXLRSCAGJVSIX-UHFFFAOYSA-N 1 2 249.232 2.395 20 0 BEADLO COc1ccc(C[NH+]2CCC(=O)CC2)c(C)c1 ZINC001140673870 960487178 /nfs/dbraw/zinc/48/71/78/960487178.db2.gz XZOOMOFJRLEDQN-UHFFFAOYSA-N 1 2 233.311 2.169 20 0 BEADLO CC[C@H](C)NC(=S)Nc1cc[nH+]c2c1CCC2 ZINC001200468442 960513006 /nfs/dbraw/zinc/51/30/06/960513006.db2.gz HFPPZWBQTBOYIA-VIFPVBQESA-N 1 2 249.383 2.077 20 0 BEADLO COc1cccc(C[N@@H+]2CCc3occc3C2)n1 ZINC001137534431 960535685 /nfs/dbraw/zinc/53/56/85/960535685.db2.gz YUBVQWOSQABDIO-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1cccc(C[N@H+]2CCc3occc3C2)n1 ZINC001137534431 960535698 /nfs/dbraw/zinc/53/56/98/960535698.db2.gz YUBVQWOSQABDIO-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO c1oc2ccccc2c1C[N@@H+]1CCC12COC2 ZINC001140785450 960572403 /nfs/dbraw/zinc/57/24/03/960572403.db2.gz GUCRUAHCOTYQAF-UHFFFAOYSA-N 1 2 229.279 2.408 20 0 BEADLO c1oc2ccccc2c1C[N@H+]1CCC12COC2 ZINC001140785450 960572424 /nfs/dbraw/zinc/57/24/24/960572424.db2.gz GUCRUAHCOTYQAF-UHFFFAOYSA-N 1 2 229.279 2.408 20 0 BEADLO Cc1cc(C[N@@H+]2CCCC[C@H](F)C2)[nH]n1 ZINC001203070488 960624288 /nfs/dbraw/zinc/62/42/88/960624288.db2.gz WDRBLCYQNSMAEP-JTQLQIEISA-N 1 2 211.284 2.042 20 0 BEADLO Cc1cc(C[N@H+]2CCCC[C@H](F)C2)[nH]n1 ZINC001203070488 960624293 /nfs/dbraw/zinc/62/42/93/960624293.db2.gz WDRBLCYQNSMAEP-JTQLQIEISA-N 1 2 211.284 2.042 20 0 BEADLO Cc1cc(C[N@H+](C)CCc2cccs2)n[nH]1 ZINC001203077010 960686945 /nfs/dbraw/zinc/68/69/45/960686945.db2.gz NXWIQYZRFHLACF-UHFFFAOYSA-N 1 2 235.356 2.454 20 0 BEADLO Cc1cc(C[N@@H+](C)CCc2cccs2)n[nH]1 ZINC001203077010 960686959 /nfs/dbraw/zinc/68/69/59/960686959.db2.gz NXWIQYZRFHLACF-UHFFFAOYSA-N 1 2 235.356 2.454 20 0 BEADLO CC[N@H+](Cc1cnco1)Cc1cccnc1 ZINC001140931666 960705049 /nfs/dbraw/zinc/70/50/49/960705049.db2.gz ONPBQUUKUOIDND-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO CC[N@@H+](Cc1cnco1)Cc1cccnc1 ZINC001140931666 960705064 /nfs/dbraw/zinc/70/50/64/960705064.db2.gz ONPBQUUKUOIDND-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO COc1cccc2c1CC[N@H+](Cc1cnco1)C2 ZINC001140933147 960713279 /nfs/dbraw/zinc/71/32/79/960713279.db2.gz MPNMWXLJVGSCFQ-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1cccc2c1CC[N@@H+](Cc1cnco1)C2 ZINC001140933147 960713290 /nfs/dbraw/zinc/71/32/90/960713290.db2.gz MPNMWXLJVGSCFQ-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO CN(C)c1cc(NC2CCCCC2)[nH+]cn1 ZINC000585415010 960759052 /nfs/dbraw/zinc/75/90/52/960759052.db2.gz HTFLNNGGCLRBSX-UHFFFAOYSA-N 1 2 220.320 2.287 20 0 BEADLO CN(C)c1cc(NC2CCCCC2)nc[nH+]1 ZINC000585415010 960759068 /nfs/dbraw/zinc/75/90/68/960759068.db2.gz HTFLNNGGCLRBSX-UHFFFAOYSA-N 1 2 220.320 2.287 20 0 BEADLO C[C@H](C[N@@H+]1CCC(=O)[C@@H](C)C1)C(F)(F)F ZINC000335059019 960801559 /nfs/dbraw/zinc/80/15/59/960801559.db2.gz BAYPJQMPOBSGBC-JGVFFNPUSA-N 1 2 223.238 2.096 20 0 BEADLO C[C@H](C[N@H+]1CCC(=O)[C@@H](C)C1)C(F)(F)F ZINC000335059019 960801561 /nfs/dbraw/zinc/80/15/61/960801561.db2.gz BAYPJQMPOBSGBC-JGVFFNPUSA-N 1 2 223.238 2.096 20 0 BEADLO c1coc(C[N@@H+]2CCC[C@H]2c2ccncc2)n1 ZINC001141008897 960808310 /nfs/dbraw/zinc/80/83/10/960808310.db2.gz POSDUTZAMRXRPE-LBPRGKRZSA-N 1 2 229.283 2.407 20 0 BEADLO c1coc(C[N@H+]2CCC[C@H]2c2ccncc2)n1 ZINC001141008897 960808317 /nfs/dbraw/zinc/80/83/17/960808317.db2.gz POSDUTZAMRXRPE-LBPRGKRZSA-N 1 2 229.283 2.407 20 0 BEADLO C[N@@H+](Cc1ncco1)C[C@H]1Cc2ccccc2O1 ZINC001141011844 960815542 /nfs/dbraw/zinc/81/55/42/960815542.db2.gz CGQLJDYCVOCFOU-GFCCVEGCSA-N 1 2 244.294 2.110 20 0 BEADLO C[N@H+](Cc1ncco1)C[C@H]1Cc2ccccc2O1 ZINC001141011844 960815544 /nfs/dbraw/zinc/81/55/44/960815544.db2.gz CGQLJDYCVOCFOU-GFCCVEGCSA-N 1 2 244.294 2.110 20 0 BEADLO CN(Cc1ccn2cc[nH+]c2c1)CC(F)(F)F ZINC001141042574 960830944 /nfs/dbraw/zinc/83/09/44/960830944.db2.gz XDDNTRMDUAPMTF-UHFFFAOYSA-N 1 2 243.232 2.328 20 0 BEADLO FC1CN(Cc2cccc(-n3cc[nH+]c3)c2)C1 ZINC001141238020 961007619 /nfs/dbraw/zinc/00/76/19/961007619.db2.gz FKFAXSHLYGWDER-UHFFFAOYSA-N 1 2 231.274 2.026 20 0 BEADLO COc1cc(F)c(C[NH+]2CCC2)cc1OC ZINC001141272346 961035317 /nfs/dbraw/zinc/03/53/17/961035317.db2.gz HWWJQBJHWARALD-UHFFFAOYSA-N 1 2 225.263 2.049 20 0 BEADLO C[NH+](C)Cc1nc(C(F)(F)F)cs1 ZINC001141753326 961146066 /nfs/dbraw/zinc/14/60/66/961146066.db2.gz ASEIBYWRYYMIND-UHFFFAOYSA-N 1 2 210.224 2.224 20 0 BEADLO COCOCCc1[nH]c2c(cc(C)cc2C)[nH+]1 ZINC001250591511 1169787964 /nfs/dbraw/zinc/78/79/64/1169787964.db2.gz QIXIXEHOMPADEX-UHFFFAOYSA-N 1 2 234.299 2.343 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)C1CC(F)C1 ZINC001142570706 961512868 /nfs/dbraw/zinc/51/28/68/961512868.db2.gz IWAGWMNYSFZWNQ-UHFFFAOYSA-N 1 2 233.246 2.021 20 0 BEADLO Cc1nc(N2CC[C@](C)(CO)C2)cc(C(C)C)[nH+]1 ZINC000709844351 961709060 /nfs/dbraw/zinc/70/90/60/961709060.db2.gz IHMLKYUDXHEBAB-AWEZNQCLSA-N 1 2 249.358 2.117 20 0 BEADLO OC1CC2(C1)C[NH+](Cc1csc(Cl)c1)C2 ZINC001142759969 961710269 /nfs/dbraw/zinc/71/02/69/961710269.db2.gz COBNPAJBOZAOIM-UHFFFAOYSA-N 1 2 243.759 2.358 20 0 BEADLO CC1(C[N@@H+]2CCC[C@H](F)C(F)(F)C2)COC1 ZINC001207790467 961808185 /nfs/dbraw/zinc/80/81/85/961808185.db2.gz BHWWGRMPPZSXKG-VIFPVBQESA-N 1 2 237.265 2.092 20 0 BEADLO CC1(C[N@H+]2CCC[C@H](F)C(F)(F)C2)COC1 ZINC001207790467 961808190 /nfs/dbraw/zinc/80/81/90/961808190.db2.gz BHWWGRMPPZSXKG-VIFPVBQESA-N 1 2 237.265 2.092 20 0 BEADLO Cn1nc(-c2ccccc2)cc1C[N@H+](C)CCF ZINC001143017968 961863912 /nfs/dbraw/zinc/86/39/12/961863912.db2.gz CPSDBVSDTWLZLY-UHFFFAOYSA-N 1 2 247.317 2.488 20 0 BEADLO Cn1nc(-c2ccccc2)cc1C[N@@H+](C)CCF ZINC001143017968 961863915 /nfs/dbraw/zinc/86/39/15/961863915.db2.gz CPSDBVSDTWLZLY-UHFFFAOYSA-N 1 2 247.317 2.488 20 0 BEADLO CCCCCOC(=O)C[NH2+][C@H]1C[C@H]2C[C@H]2C1 ZINC001167923469 961984893 /nfs/dbraw/zinc/98/48/93/961984893.db2.gz FFRHGLJOOQZANL-GDNZZTSVSA-N 1 2 225.332 2.108 20 0 BEADLO CCOC(=O)[C@H]1CCC[C@H]1Oc1cc[nH+]cc1 ZINC001225290543 962050804 /nfs/dbraw/zinc/05/08/04/962050804.db2.gz AMSFVRRCRQXILM-NWDGAFQWSA-N 1 2 235.283 2.192 20 0 BEADLO Cc1csc(C[NH+]2CC(c3cccnc3)C2)n1 ZINC001204378730 962431522 /nfs/dbraw/zinc/43/15/22/962431522.db2.gz CGNQDIFKARFBJR-UHFFFAOYSA-N 1 2 245.351 2.446 20 0 BEADLO CC(C)[C@@H]1COCC[N@@H+]1Cc1ccc(F)nc1 ZINC001137741519 962840647 /nfs/dbraw/zinc/84/06/47/962840647.db2.gz FXEHRWAWPDFRDH-LBPRGKRZSA-N 1 2 238.306 2.078 20 0 BEADLO CC(C)[C@@H]1COCC[N@H+]1Cc1ccc(F)nc1 ZINC001137741519 962840653 /nfs/dbraw/zinc/84/06/53/962840653.db2.gz FXEHRWAWPDFRDH-LBPRGKRZSA-N 1 2 238.306 2.078 20 0 BEADLO Cc1nc2[nH]ccc2c(NC2CC(F)C2)[nH+]1 ZINC001154833161 962865110 /nfs/dbraw/zinc/86/51/10/962865110.db2.gz QYDUWFHFMWUZPJ-UHFFFAOYSA-N 1 2 220.251 2.179 20 0 BEADLO COc1c[nH+]c(NC2CC(F)C2)c(C)c1 ZINC001154834233 962865474 /nfs/dbraw/zinc/86/54/74/962865474.db2.gz OWQHBDLPBSXYAH-UHFFFAOYSA-N 1 2 210.252 2.311 20 0 BEADLO CCOC(=O)CC(N)=[NH+]c1nccc2ccoc21 ZINC001155696477 963159897 /nfs/dbraw/zinc/15/98/97/963159897.db2.gz ATTYKDAMDXUHKS-UHFFFAOYSA-N 1 2 247.254 2.170 20 0 BEADLO CSc1cc[nH+]c(NCC2(CO)CCC2)c1 ZINC001156279288 963301051 /nfs/dbraw/zinc/30/10/51/963301051.db2.gz DJCYIJGSLWUYLY-UHFFFAOYSA-N 1 2 238.356 2.378 20 0 BEADLO Cc1nc(NC[C@H]2CCCCO2)c2c([nH+]1)CCC2 ZINC001156377684 963324340 /nfs/dbraw/zinc/32/43/40/963324340.db2.gz PBLIHZVQHMLGTJ-LLVKDONJSA-N 1 2 247.342 2.255 20 0 BEADLO CC(=CC(=O)OC(C)C)Nc1[nH+]cc(C)cc1N ZINC001156514380 963377483 /nfs/dbraw/zinc/37/74/83/963377483.db2.gz PHZBPJPRPXTGTO-POHAHGRESA-N 1 2 249.314 2.240 20 0 BEADLO CC(C)c1nccc(NCc2cc[nH+]c(N)c2)n1 ZINC001156756619 963452891 /nfs/dbraw/zinc/45/28/91/963452891.db2.gz BJMKNCBZVKQEIE-UHFFFAOYSA-N 1 2 243.314 2.189 20 0 BEADLO COc1cc(C)c[nH+]c1N1Cc2ncsc2C1 ZINC001156833330 963472351 /nfs/dbraw/zinc/47/23/51/963472351.db2.gz MFELDPIECMGQER-UHFFFAOYSA-N 1 2 247.323 2.375 20 0 BEADLO CCCN(C)c1cc(CC(=O)OCC)cc[nH+]1 ZINC001156881772 963480442 /nfs/dbraw/zinc/48/04/42/963480442.db2.gz KUYOWFINIMHRNA-UHFFFAOYSA-N 1 2 236.315 2.033 20 0 BEADLO COc1cc(C)c[nH+]c1N1CC2CC(C2)C1 ZINC001156902946 963489159 /nfs/dbraw/zinc/48/91/59/963489159.db2.gz RZDDFFBNUURUJX-UHFFFAOYSA-N 1 2 218.300 2.245 20 0 BEADLO CN(C(=O)c1ccc2[nH+]c(N)[nH]c2c1)C(C)(C)C ZINC001156970015 963501642 /nfs/dbraw/zinc/50/16/42/963501642.db2.gz OIMZSPWSDQNUGN-UHFFFAOYSA-N 1 2 246.314 2.016 20 0 BEADLO COc1ccc2c(ccnc2NC=[NH2+])c1 ZINC001157073518 963521874 /nfs/dbraw/zinc/52/18/74/963521874.db2.gz PGSHXUJFLONFLL-UHFFFAOYSA-N 1 2 201.229 2.262 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H]2CCCC[C@H]2C)[nH+]c1C ZINC000896910867 963522001 /nfs/dbraw/zinc/52/20/01/963522001.db2.gz ZUFIFXAYVGIWNV-BXKDBHETSA-N 1 2 249.358 2.469 20 0 BEADLO CC(=O)Nc1c(C)cc[nH+]c1N1CCC[C@H]2C[C@H]21 ZINC001157143198 963544394 /nfs/dbraw/zinc/54/43/94/963544394.db2.gz GOYNJYRTDLSWCS-NWDGAFQWSA-N 1 2 245.326 2.337 20 0 BEADLO Cc1nc(N(C)Cc2ccno2)c(C)c(C)[nH+]1 ZINC001157354908 963583026 /nfs/dbraw/zinc/58/30/26/963583026.db2.gz KWJWMWVZAMAYFV-UHFFFAOYSA-N 1 2 232.287 2.026 20 0 BEADLO CCCNc1cc(CC(=O)OCC)cc[nH+]1 ZINC001157362445 963585307 /nfs/dbraw/zinc/58/53/07/963585307.db2.gz BLCRMBOAPZGCGV-UHFFFAOYSA-N 1 2 222.288 2.009 20 0 BEADLO Cc1nc(NC[C@H]2C[C@H](F)C2)c2c([nH+]1)CCC2 ZINC001157457127 963618734 /nfs/dbraw/zinc/61/87/34/963618734.db2.gz XIPMPLCBROSSLO-MGCOHNPYSA-N 1 2 235.306 2.434 20 0 BEADLO CC(C)(C)n1cc(-c2ccc[nH+]c2N)cn1 ZINC000714315955 963657139 /nfs/dbraw/zinc/65/71/39/963657139.db2.gz CVENANFLEWRPQB-UHFFFAOYSA-N 1 2 216.288 2.282 20 0 BEADLO C=Cc1ccc(NC[C@H]2C[C@@](C)(O)C2)[nH+]c1 ZINC001157559685 963662164 /nfs/dbraw/zinc/66/21/64/963662164.db2.gz XXXICLGWRNZDDC-BJHJDKERSA-N 1 2 218.300 2.298 20 0 BEADLO Nc1cc(N[C@H]2CCNc3ccccc32)[nH+]cn1 ZINC001157837100 963742655 /nfs/dbraw/zinc/74/26/55/963742655.db2.gz OGRVBBLZQQGDEI-NSHDSACASA-N 1 2 241.298 2.028 20 0 BEADLO Cc1nc(NC2(c3ccccn3)CC2)cc[nH+]1 ZINC001168151627 963870757 /nfs/dbraw/zinc/87/07/57/963870757.db2.gz SZVNZOZQLWCHSU-UHFFFAOYSA-N 1 2 226.283 2.281 20 0 BEADLO c1nc(C[N@@H+]2CC[C@@H]3CCCO[C@@H]3C2)cs1 ZINC001137592680 963880855 /nfs/dbraw/zinc/88/08/55/963880855.db2.gz YZERJLBQTRNQIP-CMPLNLGQSA-N 1 2 238.356 2.144 20 0 BEADLO c1nc(C[N@H+]2CC[C@@H]3CCCO[C@@H]3C2)cs1 ZINC001137592680 963880860 /nfs/dbraw/zinc/88/08/60/963880860.db2.gz YZERJLBQTRNQIP-CMPLNLGQSA-N 1 2 238.356 2.144 20 0 BEADLO CN(c1[nH+]ccc2ccccc21)[C@H]1CCOC1 ZINC001158569807 963889297 /nfs/dbraw/zinc/88/92/97/963889297.db2.gz YSUMRQLWYRUBAL-LBPRGKRZSA-N 1 2 228.295 2.460 20 0 BEADLO Cn1c[nH+]cc1CN(Cc1ccco1)C1CC1 ZINC001204386339 963919592 /nfs/dbraw/zinc/91/95/92/963919592.db2.gz VBSPQMNNBOVAHT-UHFFFAOYSA-N 1 2 231.299 2.178 20 0 BEADLO Cn1cncc1C[N@H+](Cc1ccco1)C1CC1 ZINC001204386339 963919603 /nfs/dbraw/zinc/91/96/03/963919603.db2.gz VBSPQMNNBOVAHT-UHFFFAOYSA-N 1 2 231.299 2.178 20 0 BEADLO Cn1cncc1C[N@@H+](Cc1ccco1)C1CC1 ZINC001204386339 963919609 /nfs/dbraw/zinc/91/96/09/963919609.db2.gz VBSPQMNNBOVAHT-UHFFFAOYSA-N 1 2 231.299 2.178 20 0 BEADLO COc1ccc(C)[nH+]c1NCc1ncccc1O ZINC001158774253 963923815 /nfs/dbraw/zinc/92/38/15/963923815.db2.gz INQPGDNMHWXCOP-UHFFFAOYSA-N 1 2 245.282 2.111 20 0 BEADLO CCC[C@](C)(CC)C(=O)N1CC2(CC[N@@H+]2C)C1 ZINC001272056499 963951598 /nfs/dbraw/zinc/95/15/98/963951598.db2.gz HMCPXOQHYHWGSR-ZDUSSCGKSA-N 1 2 238.375 2.119 20 0 BEADLO CCC[C@](C)(CC)C(=O)N1CC2(CC[N@H+]2C)C1 ZINC001272056499 963951602 /nfs/dbraw/zinc/95/16/02/963951602.db2.gz HMCPXOQHYHWGSR-ZDUSSCGKSA-N 1 2 238.375 2.119 20 0 BEADLO COc1ccc2c(c1)C[C@H]([NH2+][C@@H]1CC1(F)F)C2 ZINC001168228713 964010619 /nfs/dbraw/zinc/01/06/19/964010619.db2.gz ISDRJQAOMPZEKK-ZYHUDNBSSA-N 1 2 239.265 2.160 20 0 BEADLO F[C@H]1C[C@H](CNc2ccc3c([nH+]2)CCOC3)C1 ZINC001168234361 964027842 /nfs/dbraw/zinc/02/78/42/964027842.db2.gz VDHZARXKNRQCEJ-HOMQSWHASA-N 1 2 236.290 2.314 20 0 BEADLO COc1cc[nH+]cc1Nc1cccc(N)c1 ZINC001159465462 964097693 /nfs/dbraw/zinc/09/76/93/964097693.db2.gz WUAORUQWIXBUDZ-UHFFFAOYSA-N 1 2 215.256 2.416 20 0 BEADLO COc1c[nH+]c(N[C@@H]2CCOC[C@H]2C)c(C)c1 ZINC001159710929 964159352 /nfs/dbraw/zinc/15/93/52/964159352.db2.gz KPYVWLUZKFDNIX-ZYHUDNBSSA-N 1 2 236.315 2.236 20 0 BEADLO Cc1nc(N[C@@H]2CCOC[C@@H]2C)c2c([nH+]1)CCC2 ZINC001159712796 964162474 /nfs/dbraw/zinc/16/24/74/964162474.db2.gz ANPZBPBKYPRULA-JOYOIKCWSA-N 1 2 247.342 2.111 20 0 BEADLO Cc1ccc(-c2noc(C[NH+]3CCC3)n2)cc1 ZINC001212093100 964255214 /nfs/dbraw/zinc/25/52/14/964255214.db2.gz FXDVIZBUQCPIRX-UHFFFAOYSA-N 1 2 229.283 2.251 20 0 BEADLO COC(C[N@H+](C)Cc1ccsc1Cl)OC ZINC000714638962 964285349 /nfs/dbraw/zinc/28/53/49/964285349.db2.gz YXFXAZVUQDJIFP-UHFFFAOYSA-N 1 2 249.763 2.452 20 0 BEADLO COC(C[N@@H+](C)Cc1ccsc1Cl)OC ZINC000714638962 964285357 /nfs/dbraw/zinc/28/53/57/964285357.db2.gz YXFXAZVUQDJIFP-UHFFFAOYSA-N 1 2 249.763 2.452 20 0 BEADLO COC(=O)C[C@H](C)Nc1cc(SC)cc[nH+]1 ZINC001160534197 964331795 /nfs/dbraw/zinc/33/17/95/964331795.db2.gz UJSBIULFNREXJZ-QMMMGPOBSA-N 1 2 240.328 2.167 20 0 BEADLO Cc1cc(NCC[C@@H](C)CO)nc(C2CC2)[nH+]1 ZINC001160608030 964355284 /nfs/dbraw/zinc/35/52/84/964355284.db2.gz LJIBINUMEGVAKK-SECBINFHSA-N 1 2 235.331 2.093 20 0 BEADLO Cc1cc(NCc2ccc(=O)[nH]c2)c[nH+]c1C ZINC001168303264 964396500 /nfs/dbraw/zinc/39/65/00/964396500.db2.gz QFFBMHFGNCSXBZ-UHFFFAOYSA-N 1 2 229.283 2.411 20 0 BEADLO c1[nH]c2c(cccc2Nc2ccnnc2)[nH+]1 ZINC001213027093 964437382 /nfs/dbraw/zinc/43/73/82/964437382.db2.gz IRXRWGHSPRURMR-UHFFFAOYSA-N 1 2 211.228 2.097 20 0 BEADLO Cn1nccc1Nc1cccc2[nH+]c[nH]c21 ZINC001213027355 964441178 /nfs/dbraw/zinc/44/11/78/964441178.db2.gz VMFDJZKSXHCFGJ-UHFFFAOYSA-N 1 2 213.244 2.040 20 0 BEADLO CCC1(Nc2nc(C)[nH+]c3c2CCCC3)COC1 ZINC001168322107 964441303 /nfs/dbraw/zinc/44/13/03/964441303.db2.gz RALKRFFOEOTWLK-UHFFFAOYSA-N 1 2 247.342 2.255 20 0 BEADLO CCC1(Nc2cc3cc(C)[nH]c3c[nH+]2)COC1 ZINC001168322564 964446590 /nfs/dbraw/zinc/44/65/90/964446590.db2.gz YQYZVFLRBNPRFI-UHFFFAOYSA-N 1 2 231.299 2.462 20 0 BEADLO CCC1(Nc2cc[nH+]c(OC(C)C)c2)COC1 ZINC001168324538 964447572 /nfs/dbraw/zinc/44/75/72/964447572.db2.gz XVFKJNUDZTVLDY-UHFFFAOYSA-N 1 2 236.315 2.460 20 0 BEADLO CCC1(Nc2cc(C)c3[nH]ccc3[nH+]2)COC1 ZINC001168325473 964451342 /nfs/dbraw/zinc/45/13/42/964451342.db2.gz QXYUEXULGOWLAS-UHFFFAOYSA-N 1 2 231.299 2.462 20 0 BEADLO CC(C)(C)CCNc1cc2c(c[nH+]1)OCC(=O)N2 ZINC001161673909 964679974 /nfs/dbraw/zinc/67/99/74/964679974.db2.gz QWKWAZWFFYDAHH-UHFFFAOYSA-N 1 2 249.314 2.261 20 0 BEADLO CC(C)n1cc(NCCCn2cc[nH+]c2)cn1 ZINC001161682023 964683255 /nfs/dbraw/zinc/68/32/55/964683255.db2.gz IPBOMAWNIYFMSW-UHFFFAOYSA-N 1 2 233.319 2.163 20 0 BEADLO Cc1cc(N[C@@H](CO)C(C)C)[nH+]c2cc[nH]c21 ZINC001161744466 964730916 /nfs/dbraw/zinc/73/09/16/964730916.db2.gz CPDUQTLXFIRXNS-NSHDSACASA-N 1 2 233.315 2.300 20 0 BEADLO COc1c[nH+]c(NCC(F)F)c2[nH]ccc21 ZINC001161809547 964763401 /nfs/dbraw/zinc/76/34/01/964763401.db2.gz LGLLHPXTTBBEJW-UHFFFAOYSA-N 1 2 227.214 2.249 20 0 BEADLO Cc1c[nH+]cc(NCc2ccnn2C)c1C ZINC001161873729 964792946 /nfs/dbraw/zinc/79/29/46/964792946.db2.gz CNVOYENFQSAAIN-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO CC(C)Oc1cc(NCc2cnn(C)c2)cc[nH+]1 ZINC001161852705 964794203 /nfs/dbraw/zinc/79/42/03/964794203.db2.gz FBQMYBKNYACLNW-UHFFFAOYSA-N 1 2 246.314 2.214 20 0 BEADLO FC1CC(Nc2ccc3c([nH+]2)CCOC3)C1 ZINC001162210209 964871937 /nfs/dbraw/zinc/87/19/37/964871937.db2.gz WLMAJNXEFMMQOM-UHFFFAOYSA-N 1 2 222.263 2.067 20 0 BEADLO CC(C)(C)[NH+]1CC(Nc2cncnc2Cl)C1 ZINC001162220311 964878777 /nfs/dbraw/zinc/87/87/77/964878777.db2.gz OQGQYYWKCADPNH-UHFFFAOYSA-N 1 2 240.738 2.025 20 0 BEADLO CSc1cc[nH+]c(N[C@@H]2CCOC[C@@H]2F)c1 ZINC001162347465 964939643 /nfs/dbraw/zinc/93/96/43/964939643.db2.gz CKKNKNPYDOOGBG-VHSXEESVSA-N 1 2 242.319 2.342 20 0 BEADLO COc1cc(C)c[nH+]c1N[C@H]1C[C@@]12CCCOC2 ZINC001162379611 964948689 /nfs/dbraw/zinc/94/86/89/964948689.db2.gz ZAQHVJVDGAPWBB-GXTWGEPZSA-N 1 2 248.326 2.380 20 0 BEADLO Cc1ccc2c(c1)[C@H](Nc1cccc[nH+]1)C(=O)N2 ZINC001162562660 965052565 /nfs/dbraw/zinc/05/25/65/965052565.db2.gz LABBDFAJVXOMAL-ZDUSSCGKSA-N 1 2 239.278 2.495 20 0 BEADLO C[C@H](C[NH+]1CCOCC1)OCC[Si](C)(C)C ZINC001224907797 965066117 /nfs/dbraw/zinc/06/61/17/965066117.db2.gz WUCOHPHLFNVNDK-GFCCVEGCSA-N 1 2 245.439 2.062 20 0 BEADLO Cc1c(F)cc[nH+]c1N[C@H]1CCC[C@H]1CO ZINC001162603048 965074839 /nfs/dbraw/zinc/07/48/39/965074839.db2.gz CRVQJLBMDMMZDV-ONGXEEELSA-N 1 2 224.279 2.102 20 0 BEADLO Cc1ncc(CNc2cc3cc[nH]c3c[nH+]2)cn1 ZINC001168381290 965088763 /nfs/dbraw/zinc/08/87/63/965088763.db2.gz GUFXRLSAAWXVQA-UHFFFAOYSA-N 1 2 239.282 2.273 20 0 BEADLO Nc1cc(N[C@H]2CCc3sccc32)[nH+]cn1 ZINC001162767036 965163901 /nfs/dbraw/zinc/16/39/01/965163901.db2.gz ZBZFCPPMNAEYAF-QMMMGPOBSA-N 1 2 232.312 2.220 20 0 BEADLO CC(C)OC(=O)[C@H](C)Nc1ccn2cc[nH+]c2c1 ZINC001163402504 965400689 /nfs/dbraw/zinc/40/06/89/965400689.db2.gz QFZCRQIACRUSIZ-JTQLQIEISA-N 1 2 247.298 2.086 20 0 BEADLO CSc1cc[nH+]c(N2CCCC[C@H]2CO)c1 ZINC001163559277 965450261 /nfs/dbraw/zinc/45/02/61/965450261.db2.gz OOLHZMIJFHXCKS-JTQLQIEISA-N 1 2 238.356 2.155 20 0 BEADLO COc1cc[nH+]cc1NCCc1cccc(O)c1 ZINC001163698239 965517819 /nfs/dbraw/zinc/51/78/19/965517819.db2.gz IURLXLQZILWJJN-UHFFFAOYSA-N 1 2 244.294 2.450 20 0 BEADLO COc1ccc(CCNc2cccc[nH+]2)cc1O ZINC001163720873 965533328 /nfs/dbraw/zinc/53/33/28/965533328.db2.gz AENKLCIZMMPASN-UHFFFAOYSA-N 1 2 244.294 2.450 20 0 BEADLO Nc1ccc[nH+]c1N1CCC(=O)[C@@H]2CCCC[C@H]21 ZINC001163790576 965589231 /nfs/dbraw/zinc/58/92/31/965589231.db2.gz NLDTXJWCZDJUSW-ZYHUDNBSSA-N 1 2 245.326 2.002 20 0 BEADLO COc1ccc(C)[nH+]c1N1CCCO[C@@H](C)C1 ZINC001163962032 965663085 /nfs/dbraw/zinc/66/30/85/965663085.db2.gz LRDOJMXUQPCHLT-NSHDSACASA-N 1 2 236.315 2.014 20 0 BEADLO COc1ccc(OC2C[NH+](C)C2)cc1Cl ZINC001234217109 965714080 /nfs/dbraw/zinc/71/40/80/965714080.db2.gz GHGXYSHEQPQWPL-UHFFFAOYSA-N 1 2 227.691 2.041 20 0 BEADLO O=C1CCCN(c2cccc(C3CC3)[nH+]2)C[C@H]1F ZINC001164136632 965753436 /nfs/dbraw/zinc/75/34/36/965753436.db2.gz JKWDICLRXNKDOU-LLVKDONJSA-N 1 2 248.301 2.466 20 0 BEADLO CC(C)c1ccc(N2CC[C@](C)(CO)C2)[nH+]c1 ZINC001164145050 965755921 /nfs/dbraw/zinc/75/59/21/965755921.db2.gz ZHALPATXAPXNCM-AWEZNQCLSA-N 1 2 234.343 2.414 20 0 BEADLO COc1cc[nH+]cc1NC[C@@H]1CC(C)(C)O1 ZINC001168453591 965756998 /nfs/dbraw/zinc/75/69/98/965756998.db2.gz YVWQMNHDRJFCTE-VIFPVBQESA-N 1 2 222.288 2.070 20 0 BEADLO c1cc2c([nH+]c1NC[C@H]1CCCCO1)CCOC2 ZINC001164689951 965948345 /nfs/dbraw/zinc/94/83/45/965948345.db2.gz VLQJOFUFUUTMNU-GFCCVEGCSA-N 1 2 248.326 2.135 20 0 BEADLO Cc1c(F)cc[nH+]c1N1CC[C@@H]2COC[C@@H]2C1 ZINC001165269900 966018215 /nfs/dbraw/zinc/01/82/15/966018215.db2.gz VUKKVRJBAQLZRE-MNOVXSKESA-N 1 2 236.290 2.002 20 0 BEADLO C[C@H]1COC[C@@H]1Nc1[nH+]c2ccccc2n1C ZINC000699752089 966066943 /nfs/dbraw/zinc/06/69/43/966066943.db2.gz CTFIPHHPVOUWNK-ONGXEEELSA-N 1 2 231.299 2.020 20 0 BEADLO C[C@@H](CCO)Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001165938637 966207014 /nfs/dbraw/zinc/20/70/14/966207014.db2.gz PAPBWXFKWHDAQV-LBPRGKRZSA-N 1 2 245.326 2.114 20 0 BEADLO COCC(C)(C)Nc1cc(SC)[nH+]c(C)n1 ZINC001165977111 966221301 /nfs/dbraw/zinc/22/13/01/966221301.db2.gz SRDSSSGUTWMXCV-UHFFFAOYSA-N 1 2 241.360 2.344 20 0 BEADLO COc1cc(C)c[nH+]c1N1C[C@@H]2C[C@H]1C[C@H]2F ZINC001166530842 966290271 /nfs/dbraw/zinc/29/02/71/966290271.db2.gz VRIQBENQRMDTQV-GARJFASQSA-N 1 2 236.290 2.335 20 0 BEADLO CCSc1cc[nH+]c(N2CC[C@@H](CO)C2)c1 ZINC001166551316 966297208 /nfs/dbraw/zinc/29/72/08/966297208.db2.gz VMZGZYIMWWXMHV-SNVBAGLBSA-N 1 2 238.356 2.012 20 0 BEADLO CCc1cn(C[C@H]2CC[C@H](C3CC3)O2)c[nH+]1 ZINC001166822316 966424788 /nfs/dbraw/zinc/42/47/88/966424788.db2.gz KDLIQGKWEQEJBO-CHWSQXEVSA-N 1 2 220.316 2.403 20 0 BEADLO CCc1cn(CC(=O)c2nccn2C(C)C)c[nH+]1 ZINC001166823041 966428213 /nfs/dbraw/zinc/42/82/13/966428213.db2.gz RMCNISUEKOLJQX-UHFFFAOYSA-N 1 2 246.314 2.106 20 0 BEADLO Cc1cccc2c(C)cc(N3CC(O)C3)[nH+]c12 ZINC001166935608 966452207 /nfs/dbraw/zinc/45/22/07/966452207.db2.gz BLKXMNOKZBFLEQ-UHFFFAOYSA-N 1 2 228.295 2.033 20 0 BEADLO CCN(c1[nH+]ccc2ccccc21)C1COC1 ZINC001166941637 966462836 /nfs/dbraw/zinc/46/28/36/966462836.db2.gz CBIMYGBWIKGJKZ-UHFFFAOYSA-N 1 2 228.295 2.460 20 0 BEADLO Cc1cc(Cl)c(C)c(N2CC3(CCO3)C2)[nH+]1 ZINC001166941740 966463646 /nfs/dbraw/zinc/46/36/46/966463646.db2.gz IDWKHUFXDMEQDF-UHFFFAOYSA-N 1 2 238.718 2.331 20 0 BEADLO CCN(c1cc(C)[nH+]c(C(C)(C)C)n1)C1COC1 ZINC001166943655 966470092 /nfs/dbraw/zinc/47/00/92/966470092.db2.gz SPDPRVQKACFTDS-UHFFFAOYSA-N 1 2 249.358 2.308 20 0 BEADLO COc1ccc(C)[nH+]c1N1CCC[C@@H](OC)C1 ZINC001166952488 966480875 /nfs/dbraw/zinc/48/08/75/966480875.db2.gz WZLFEHPFYTXLCX-LLVKDONJSA-N 1 2 236.315 2.014 20 0 BEADLO CCCc1cc(N2C[C@H](C)O[C@@H](C)C2)nc(C)[nH+]1 ZINC001166966643 966491971 /nfs/dbraw/zinc/49/19/71/966491971.db2.gz HKESLKKCXROZEN-QWRGUYRKSA-N 1 2 249.358 2.351 20 0 BEADLO Cc1ccc(O)cc1Nc1[nH+]cccc1CCO ZINC001214345063 966502113 /nfs/dbraw/zinc/50/21/13/966502113.db2.gz AFKJBCWCCVPZEQ-UHFFFAOYSA-N 1 2 244.294 2.374 20 0 BEADLO CCSc1cc[nH+]c(N(C)C2(C)COC2)c1 ZINC001166984972 966508563 /nfs/dbraw/zinc/50/85/63/966508563.db2.gz JWSWPBBWAFIBNS-UHFFFAOYSA-N 1 2 238.356 2.419 20 0 BEADLO CCc1cc(N2CCOC[C@@H]2C(C)C)nc(C)[nH+]1 ZINC001166998092 966510888 /nfs/dbraw/zinc/51/08/88/966510888.db2.gz GALCRDXIYWUHMY-CYBMUJFWSA-N 1 2 249.358 2.209 20 0 BEADLO COC(CN(C)c1cccc(C2CC2)[nH+]1)OC ZINC001167029636 966524371 /nfs/dbraw/zinc/52/43/71/966524371.db2.gz PRLFJKBDJQFFMO-UHFFFAOYSA-N 1 2 236.315 2.014 20 0 BEADLO Cc1cncc(C[N@H+](C)Cc2ccsc2)n1 ZINC001203173558 966540990 /nfs/dbraw/zinc/54/09/90/966540990.db2.gz KMFGWEUHFUMIRO-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cncc(C[N@@H+](C)Cc2ccsc2)n1 ZINC001203173558 966540995 /nfs/dbraw/zinc/54/09/95/966540995.db2.gz KMFGWEUHFUMIRO-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cncc(C[N@@H+]2CCC[C@@](C)(F)C2)n1 ZINC001203163525 966541400 /nfs/dbraw/zinc/54/14/00/966541400.db2.gz DQSQAFBGZKCXBY-GFCCVEGCSA-N 1 2 223.295 2.109 20 0 BEADLO Cc1cncc(C[N@H+]2CCC[C@@](C)(F)C2)n1 ZINC001203163525 966541405 /nfs/dbraw/zinc/54/14/05/966541405.db2.gz DQSQAFBGZKCXBY-GFCCVEGCSA-N 1 2 223.295 2.109 20 0 BEADLO COc1cc2c(cn1)CC[N@H+](Cc1ccco1)C2 ZINC001203290111 966604240 /nfs/dbraw/zinc/60/42/40/966604240.db2.gz WXSKNAKRDIBDBO-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1cc2c(cn1)CC[N@@H+](Cc1ccco1)C2 ZINC001203290111 966604246 /nfs/dbraw/zinc/60/42/46/966604246.db2.gz WXSKNAKRDIBDBO-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO Cc1ccc(Nc2cc3n(n2)CCCO3)c(C)[nH+]1 ZINC001203369861 966618697 /nfs/dbraw/zinc/61/86/97/966618697.db2.gz ULOJZCGRNNCXCR-UHFFFAOYSA-N 1 2 244.298 2.421 20 0 BEADLO CNc1ccc(Nc2cnc(C)c(C)n2)c[nH+]1 ZINC001203449589 966646491 /nfs/dbraw/zinc/64/64/91/966646491.db2.gz KLUXOCFCXSVVCZ-UHFFFAOYSA-N 1 2 229.287 2.274 20 0 BEADLO CNc1ccc(Nc2ncc(O)cc2C)c[nH+]1 ZINC001203448111 966648050 /nfs/dbraw/zinc/64/80/50/966648050.db2.gz VHLMKXZUUIITCQ-UHFFFAOYSA-N 1 2 230.271 2.276 20 0 BEADLO CNc1ccc(Nc2c3c(nn2C)CCC3)c[nH+]1 ZINC001203448898 966648125 /nfs/dbraw/zinc/64/81/25/966648125.db2.gz POIBXOJVWQSMJW-UHFFFAOYSA-N 1 2 243.314 2.089 20 0 BEADLO CNc1ccc(Nc2c(Cl)cnn2C)c[nH+]1 ZINC001203449255 966648780 /nfs/dbraw/zinc/64/87/80/966648780.db2.gz DTHRCQRQMDKOLU-UHFFFAOYSA-N 1 2 237.694 2.254 20 0 BEADLO CNc1ccc(Nc2cnc(F)cc2OC)c[nH+]1 ZINC001203454745 966652423 /nfs/dbraw/zinc/65/24/23/966652423.db2.gz LEHUCNRCFKPKNY-UHFFFAOYSA-N 1 2 248.261 2.410 20 0 BEADLO C[C@@H]1CC[N@@H+]1Cc1cnccc1Br ZINC001237383955 966653794 /nfs/dbraw/zinc/65/37/94/966653794.db2.gz HDEAVKWAKSBXGG-MRVPVSSYSA-N 1 2 241.132 2.438 20 0 BEADLO C[C@@H]1CC[N@H+]1Cc1cnccc1Br ZINC001237383955 966653807 /nfs/dbraw/zinc/65/38/07/966653807.db2.gz HDEAVKWAKSBXGG-MRVPVSSYSA-N 1 2 241.132 2.438 20 0 BEADLO CNc1ccc(Nc2ccc(F)cc2CO)c[nH+]1 ZINC001203458887 966655318 /nfs/dbraw/zinc/65/53/18/966655318.db2.gz AKOQOTONMDHKST-UHFFFAOYSA-N 1 2 247.273 2.498 20 0 BEADLO CNc1ccc(Nc2ccc(N)cc2OC)c[nH+]1 ZINC001203458329 966655901 /nfs/dbraw/zinc/65/59/01/966655901.db2.gz KNKPXWHOXBUEHX-UHFFFAOYSA-N 1 2 244.298 2.458 20 0 BEADLO CCc1[nH]ncc1C[N@H+](C)CCc1ccccn1 ZINC001237648597 966684199 /nfs/dbraw/zinc/68/41/99/966684199.db2.gz CBWSLUWOIHLWJP-UHFFFAOYSA-N 1 2 244.342 2.042 20 0 BEADLO CCc1[nH]ncc1C[N@@H+](C)CCc1ccccn1 ZINC001237648597 966684207 /nfs/dbraw/zinc/68/42/07/966684207.db2.gz CBWSLUWOIHLWJP-UHFFFAOYSA-N 1 2 244.342 2.042 20 0 BEADLO CN(C)c1ccc(Nc2ccc(N)nc2F)c[nH+]1 ZINC001203608253 966699884 /nfs/dbraw/zinc/69/98/84/966699884.db2.gz WZUBJDOXKXKMCA-UHFFFAOYSA-N 1 2 247.277 2.008 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2ccnn2C2COC2)c1 ZINC001203656239 966718191 /nfs/dbraw/zinc/71/81/91/966718191.db2.gz NLQODISSUVJCKL-UHFFFAOYSA-N 1 2 244.298 2.210 20 0 BEADLO Cc1cc(Nc2cc(C)c[nH+]c2C)n(C)n1 ZINC001203655256 966721254 /nfs/dbraw/zinc/72/12/54/966721254.db2.gz ZXUIXAQEKHLPEM-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2ncccc2CO)c1 ZINC001203656666 966722059 /nfs/dbraw/zinc/72/20/59/966722059.db2.gz ZSCMROUKUJDTFD-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO COc1ccc(C[NH+]2CC3(CCO3)C2)c(C)c1C ZINC001203725963 966749959 /nfs/dbraw/zinc/74/99/59/966749959.db2.gz XDVZDWTYJJWHSE-UHFFFAOYSA-N 1 2 247.338 2.287 20 0 BEADLO FC1(F)CSC2(C[NH+](Cc3ccc[nH]3)C2)C1 ZINC001204008869 966848232 /nfs/dbraw/zinc/84/82/32/966848232.db2.gz KXRXFINFUHQEGS-UHFFFAOYSA-N 1 2 244.310 2.341 20 0 BEADLO O=C1CC[N@H+](Cc2cccnc2)[C@@H]2CCCC[C@H]12 ZINC001204068681 966875518 /nfs/dbraw/zinc/87/55/18/966875518.db2.gz DXMDBRJWIXUZLV-UONOGXRCSA-N 1 2 244.338 2.415 20 0 BEADLO O=C1CC[N@@H+](Cc2cccnc2)[C@@H]2CCCC[C@H]12 ZINC001204068681 966875522 /nfs/dbraw/zinc/87/55/22/966875522.db2.gz DXMDBRJWIXUZLV-UONOGXRCSA-N 1 2 244.338 2.415 20 0 BEADLO CC(C)(C)[C@H](CO)Nc1ccn2cc[nH+]c2c1 ZINC001168554290 966875555 /nfs/dbraw/zinc/87/55/55/966875555.db2.gz PSGPMQFEFOPLIA-NSHDSACASA-N 1 2 233.315 2.153 20 0 BEADLO Cc1cn2cc(C3=CCOC3)ccc2[nH+]1 ZINC001239482209 966900220 /nfs/dbraw/zinc/90/02/20/966900220.db2.gz QXXSSNYNEJQXDD-UHFFFAOYSA-N 1 2 200.241 2.056 20 0 BEADLO c1cc(C[N@H+]2CCc3occc3C2)co1 ZINC001204243955 966939555 /nfs/dbraw/zinc/93/95/55/966939555.db2.gz OMYRUUZPXCHXRN-UHFFFAOYSA-N 1 2 203.241 2.431 20 0 BEADLO c1cc(C[N@@H+]2CCc3occc3C2)co1 ZINC001204243955 966939545 /nfs/dbraw/zinc/93/95/45/966939545.db2.gz OMYRUUZPXCHXRN-UHFFFAOYSA-N 1 2 203.241 2.431 20 0 BEADLO CCCOc1ccc(C[N@H+]2C[C@H]3C[C@@H](C2)O3)cc1 ZINC001204307014 966963516 /nfs/dbraw/zinc/96/35/16/966963516.db2.gz FIJTXCZVQMNXPN-GASCZTMLSA-N 1 2 247.338 2.449 20 0 BEADLO CCCOc1ccc(C[N@@H+]2C[C@H]3C[C@@H](C2)O3)cc1 ZINC001204307014 966963525 /nfs/dbraw/zinc/96/35/25/966963525.db2.gz FIJTXCZVQMNXPN-GASCZTMLSA-N 1 2 247.338 2.449 20 0 BEADLO CNc1ccc(Nc2cccc(F)c2CO)c[nH+]1 ZINC001203460903 966982918 /nfs/dbraw/zinc/98/29/18/966982918.db2.gz YROCQENDNMIXLJ-UHFFFAOYSA-N 1 2 247.273 2.498 20 0 BEADLO CC(C)Oc1ccc(C[N@H+]2C[C@H]3C[C@@H](C2)O3)cc1 ZINC001204454850 967000143 /nfs/dbraw/zinc/00/01/43/967000143.db2.gz JPEJYEXWUMWANV-GASCZTMLSA-N 1 2 247.338 2.447 20 0 BEADLO CC(C)Oc1ccc(C[N@@H+]2C[C@H]3C[C@@H](C2)O3)cc1 ZINC001204454850 967000149 /nfs/dbraw/zinc/00/01/49/967000149.db2.gz JPEJYEXWUMWANV-GASCZTMLSA-N 1 2 247.338 2.447 20 0 BEADLO C[C@H]1CC(=O)CC[N@@H+]1Cc1ccc2c(c1)CCO2 ZINC001204487474 967005272 /nfs/dbraw/zinc/00/52/72/967005272.db2.gz JMLPWFQXAFQCBI-NSHDSACASA-N 1 2 245.322 2.175 20 0 BEADLO C[C@H]1CC(=O)CC[N@H+]1Cc1ccc2c(c1)CCO2 ZINC001204487474 967005280 /nfs/dbraw/zinc/00/52/80/967005280.db2.gz JMLPWFQXAFQCBI-NSHDSACASA-N 1 2 245.322 2.175 20 0 BEADLO COC1(C)C[NH+](Cc2ccc3ccccc3n2)C1 ZINC001204499998 967008787 /nfs/dbraw/zinc/00/87/87/967008787.db2.gz OXAFLTQJSQWUDV-UHFFFAOYSA-N 1 2 242.322 2.456 20 0 BEADLO Cc1c(F)cccc1C[NH+]1CCN(C2CC2)CC1 ZINC001204506283 967011750 /nfs/dbraw/zinc/01/17/50/967011750.db2.gz HKFJAWQWRDFITA-UHFFFAOYSA-N 1 2 248.345 2.414 20 0 BEADLO Cc1c(F)cccc1C[N@H+]1CCOC[C@@H]1C ZINC001204506257 967012487 /nfs/dbraw/zinc/01/24/87/967012487.db2.gz GUQLDXJPHLYICF-JTQLQIEISA-N 1 2 223.291 2.355 20 0 BEADLO Cc1c(F)cccc1C[N@@H+]1CCOC[C@@H]1C ZINC001204506257 967012492 /nfs/dbraw/zinc/01/24/92/967012492.db2.gz GUQLDXJPHLYICF-JTQLQIEISA-N 1 2 223.291 2.355 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1cccc(F)c1C ZINC001204512058 967020236 /nfs/dbraw/zinc/02/02/36/967020236.db2.gz BUTSVSFPRFIMHB-UHFFFAOYSA-N 1 2 239.290 2.129 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1cccc(F)c1C ZINC001204512058 967020245 /nfs/dbraw/zinc/02/02/45/967020245.db2.gz BUTSVSFPRFIMHB-UHFFFAOYSA-N 1 2 239.290 2.129 20 0 BEADLO COC(=O)[C@@H]1CCC[N@@H+]1Cc1cc(C)c(C)o1 ZINC001204536763 967032704 /nfs/dbraw/zinc/03/27/04/967032704.db2.gz LSAKZIJFKJQNGK-LBPRGKRZSA-N 1 2 237.299 2.034 20 0 BEADLO COC(=O)[C@@H]1CCC[N@H+]1Cc1cc(C)c(C)o1 ZINC001204536763 967032718 /nfs/dbraw/zinc/03/27/18/967032718.db2.gz LSAKZIJFKJQNGK-LBPRGKRZSA-N 1 2 237.299 2.034 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3nn(C)cc3C2)oc1C ZINC001204534944 967034058 /nfs/dbraw/zinc/03/40/58/967034058.db2.gz OJOPMQHEEMATQI-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO Cc1cc(C[N@H+]2CCc3nn(C)cc3C2)oc1C ZINC001204534944 967034066 /nfs/dbraw/zinc/03/40/66/967034066.db2.gz OJOPMQHEEMATQI-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO Cc1cc(C[N@@H+]2CCCC(=O)CC2)oc1C ZINC001204534705 967037399 /nfs/dbraw/zinc/03/73/99/967037399.db2.gz XOGMJPAKRYMIOF-UHFFFAOYSA-N 1 2 221.300 2.451 20 0 BEADLO Cc1cc(C[N@H+]2CCCC(=O)CC2)oc1C ZINC001204534705 967037411 /nfs/dbraw/zinc/03/74/11/967037411.db2.gz XOGMJPAKRYMIOF-UHFFFAOYSA-N 1 2 221.300 2.451 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc2c(c1)OCCO2 ZINC001239603279 967038808 /nfs/dbraw/zinc/03/88/08/967038808.db2.gz UTUZJEUQRBDTNP-ZRSOPRJESA-N 1 2 217.268 2.334 20 0 BEADLO c1csc(C[N@@H+]2CC[C@H]3CCCO[C@@H]3C2)n1 ZINC001204545612 967041952 /nfs/dbraw/zinc/04/19/52/967041952.db2.gz ZITLENPZDSVWMD-GHMZBOCLSA-N 1 2 238.356 2.144 20 0 BEADLO Cc1c(C[N@@H+]2CC[C@](C)(F)[C@@H](F)C2)cnn1C ZINC001204570040 967059401 /nfs/dbraw/zinc/05/94/01/967059401.db2.gz ZDIXXOGKNMFQMN-RYUDHWBXSA-N 1 2 243.301 2.001 20 0 BEADLO Cc1c(C[N@H+]2CC[C@](C)(F)[C@@H](F)C2)cnn1C ZINC001204570040 967059418 /nfs/dbraw/zinc/05/94/18/967059418.db2.gz ZDIXXOGKNMFQMN-RYUDHWBXSA-N 1 2 243.301 2.001 20 0 BEADLO Cc1cc(Nc2c[nH+]c3ccccn23)cnc1N ZINC001249781865 967060387 /nfs/dbraw/zinc/06/03/87/967060387.db2.gz LRDCYJKTYFBGCO-UHFFFAOYSA-N 1 2 239.282 2.364 20 0 BEADLO Cc1[nH+]c[nH]c1CN1CC[C@@H](C)C(F)(F)C1 ZINC001204587521 967075426 /nfs/dbraw/zinc/07/54/26/967075426.db2.gz DQXDAOCBXQSULV-MRVPVSSYSA-N 1 2 229.274 2.195 20 0 BEADLO Cc1cc(N2CCOCC2)[nH+]cc1-c1ccoc1 ZINC001239687917 967079732 /nfs/dbraw/zinc/07/97/32/967079732.db2.gz CSVSTEDWPTXAOR-UHFFFAOYSA-N 1 2 244.294 2.487 20 0 BEADLO Cc1nc[nH]c1C[N@@H+](C)Cc1cccnc1C ZINC001204593371 967091304 /nfs/dbraw/zinc/09/13/04/967091304.db2.gz GNILMJFUTXSNOB-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1nc[nH]c1C[N@H+](C)Cc1cccnc1C ZINC001204593371 967091316 /nfs/dbraw/zinc/09/13/16/967091316.db2.gz GNILMJFUTXSNOB-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1[nH+]c[nH]c1CN1Cc2cccc(F)c2C1 ZINC001204591285 967093178 /nfs/dbraw/zinc/09/31/78/967093178.db2.gz YULJXBLDCJYSIA-UHFFFAOYSA-N 1 2 231.274 2.373 20 0 BEADLO Cc1cc(C)[nH+]c(Nc2cnc3ccnn3c2)c1 ZINC001204765388 967158164 /nfs/dbraw/zinc/15/81/64/967158164.db2.gz FNKCBLBBXMBBCA-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO CCn1nccc1Nc1ccn2cc[nH+]c2c1 ZINC001204943796 967245079 /nfs/dbraw/zinc/24/50/79/967245079.db2.gz PLVDODRYOUQICJ-UHFFFAOYSA-N 1 2 227.271 2.294 20 0 BEADLO Oc1cccnc1Nc1ccn2cc[nH+]c2c1 ZINC001204950990 967249477 /nfs/dbraw/zinc/24/94/77/967249477.db2.gz LIFXDQNOXKDVAV-UHFFFAOYSA-N 1 2 226.239 2.179 20 0 BEADLO Cc1cccc(Nc2ccc3nncn3c2)[nH+]1 ZINC001249999907 967255553 /nfs/dbraw/zinc/25/55/53/967255553.db2.gz OGJANEZATQOLQK-UHFFFAOYSA-N 1 2 225.255 2.176 20 0 BEADLO CCc1cnc(Nc2ccn3cc[nH+]c3c2)cn1 ZINC001204959281 967258616 /nfs/dbraw/zinc/25/86/16/967258616.db2.gz KIOBHHCJSLMBCH-UHFFFAOYSA-N 1 2 239.282 2.430 20 0 BEADLO Cc1ncnc(C)c1Nc1ccn2cc[nH+]c2c1 ZINC001204959522 967259457 /nfs/dbraw/zinc/25/94/57/967259457.db2.gz OYIHXVYDAUFTBP-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cc1cnn(C)c1Nc1ccn2cc[nH+]c2c1 ZINC001204959406 967263192 /nfs/dbraw/zinc/26/31/92/967263192.db2.gz MQYWKJUVHHZNBO-UHFFFAOYSA-N 1 2 227.271 2.120 20 0 BEADLO Cc1nocc1Nc1ccn2cc[nH+]c2c1 ZINC001204965893 967266695 /nfs/dbraw/zinc/26/66/95/967266695.db2.gz JJCKOKALDUJDEE-UHFFFAOYSA-N 1 2 214.228 2.374 20 0 BEADLO Cc1ccnnc1Nc1ccn2cc[nH+]c2c1 ZINC001204966495 967266996 /nfs/dbraw/zinc/26/69/96/967266996.db2.gz VMWHMGXPOUMQSY-UHFFFAOYSA-N 1 2 225.255 2.176 20 0 BEADLO Nc1cc(CCC(=O)c2ccccc2)cc[nH+]1 ZINC001250024572 967281596 /nfs/dbraw/zinc/28/15/96/967281596.db2.gz QRNHJDYYVQNIDU-UHFFFAOYSA-N 1 2 226.279 2.479 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H]3C[C@H]2CO3)ccc1F ZINC001205187293 967418959 /nfs/dbraw/zinc/41/89/59/967418959.db2.gz XCMSWKHDSDCLSW-RYUDHWBXSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H]3C[C@H]2CO3)ccc1F ZINC001205187293 967418971 /nfs/dbraw/zinc/41/89/71/967418971.db2.gz XCMSWKHDSDCLSW-RYUDHWBXSA-N 1 2 221.275 2.107 20 0 BEADLO O=c1[nH]c2ccccc2n1CCCc1[nH]cc[nH+]1 ZINC001250178073 967481282 /nfs/dbraw/zinc/48/12/82/967481282.db2.gz JAURMPONAUPISB-UHFFFAOYSA-N 1 2 242.282 2.098 20 0 BEADLO C[C@H](CCCC(C)(C)O)Nc1cc[nH+]cc1F ZINC001168712614 967598573 /nfs/dbraw/zinc/59/85/73/967598573.db2.gz SAJXXZVHEWNPND-SNVBAGLBSA-N 1 2 240.322 2.384 20 0 BEADLO Cc1cc(C)[nH+]c(Nc2cnn(C3COC3)c2)c1 ZINC001205536670 967675190 /nfs/dbraw/zinc/67/51/90/967675190.db2.gz BQCZQZINVJAGSI-UHFFFAOYSA-N 1 2 244.298 2.210 20 0 BEADLO COc1ccc(F)cc1CCn1cc[nH+]c1 ZINC001250315290 967676672 /nfs/dbraw/zinc/67/66/72/967676672.db2.gz IAGMMWGFVIFTTK-UHFFFAOYSA-N 1 2 220.247 2.274 20 0 BEADLO c1cn(CCc2cnn([C@@H]3CCCCO3)c2)c[nH+]1 ZINC001250315845 967679098 /nfs/dbraw/zinc/67/90/98/967679098.db2.gz STUPKEYZPMIOQH-ZDUSSCGKSA-N 1 2 246.314 2.021 20 0 BEADLO COc1ccc(F)c(CCn2cc[nH+]c2)c1 ZINC001250315305 967679913 /nfs/dbraw/zinc/67/99/13/967679913.db2.gz IKUQEMIJSJXWHP-UHFFFAOYSA-N 1 2 220.247 2.274 20 0 BEADLO COc1ccc(CCn2cc[nH+]c2)c(OC)c1 ZINC001250315302 967680767 /nfs/dbraw/zinc/68/07/67/967680767.db2.gz IKPLOAUQGPOEGU-UHFFFAOYSA-N 1 2 232.283 2.143 20 0 BEADLO CCc1nc(OC)ccc1CCn1cc[nH+]c1 ZINC001250316683 967683621 /nfs/dbraw/zinc/68/36/21/967683621.db2.gz SKIWAERORKDUGV-UHFFFAOYSA-N 1 2 231.299 2.092 20 0 BEADLO Cn1ncc2cccc(CCn3cc[nH+]c3)c21 ZINC001250316545 967684442 /nfs/dbraw/zinc/68/44/42/967684442.db2.gz LZEGSAYQLUPULB-UHFFFAOYSA-N 1 2 226.283 2.013 20 0 BEADLO Cc1cccc(CCn2cc[nH+]c2)c1O ZINC001250318380 967684785 /nfs/dbraw/zinc/68/47/85/967684785.db2.gz FTDWNKMEECBXHA-UHFFFAOYSA-N 1 2 202.257 2.140 20 0 BEADLO COc1cccc(F)c1CCn1cc[nH+]c1 ZINC001250316774 967685066 /nfs/dbraw/zinc/68/50/66/967685066.db2.gz XMPNYKDPIKLZNY-UHFFFAOYSA-N 1 2 220.247 2.274 20 0 BEADLO CC(=O)c1ccc(CCn2cc[nH+]c2)cc1F ZINC001250316707 967686481 /nfs/dbraw/zinc/68/64/81/967686481.db2.gz UEIDFHGMHKNDOE-UHFFFAOYSA-N 1 2 232.258 2.468 20 0 BEADLO Cc1ccc(C)c(Nc2cnn(C3COC3)c2)[nH+]1 ZINC001205549084 967692535 /nfs/dbraw/zinc/69/25/35/967692535.db2.gz DPJKICZOCYNUBU-UHFFFAOYSA-N 1 2 244.298 2.210 20 0 BEADLO Oc1ccc(CCn2cc[nH+]c2)c(Cl)c1 ZINC001250320157 967697381 /nfs/dbraw/zinc/69/73/81/967697381.db2.gz IKLBXUUEZJQMGB-UHFFFAOYSA-N 1 2 222.675 2.485 20 0 BEADLO COc1cc[nH+]cc1Cc1ccccn1 ZINC001250320349 967698230 /nfs/dbraw/zinc/69/82/30/967698230.db2.gz PKGXSXNUQLHFLN-UHFFFAOYSA-N 1 2 200.241 2.076 20 0 BEADLO CCCOc1ccc(CCn2cc[nH+]c2)cn1 ZINC001250321082 967698537 /nfs/dbraw/zinc/69/85/37/967698537.db2.gz VRWYOWRFIMVEEU-UHFFFAOYSA-N 1 2 231.299 2.310 20 0 BEADLO Oc1cccc(Cl)c1CCn1cc[nH+]c1 ZINC001250321097 967699683 /nfs/dbraw/zinc/69/96/83/967699683.db2.gz WKOVDSVVJNHAEB-UHFFFAOYSA-N 1 2 222.675 2.485 20 0 BEADLO CNc1cc(CCC(=O)OC(C)(C)C)cc[nH+]1 ZINC001250330769 967718721 /nfs/dbraw/zinc/71/87/21/967718721.db2.gz ATUWOTHSRMQPHT-UHFFFAOYSA-N 1 2 236.315 2.398 20 0 BEADLO CNc1ccc(Nc2cncs2)c[nH+]1 ZINC001203448655 967723595 /nfs/dbraw/zinc/72/35/95/967723595.db2.gz DZLGNNMMMZOTSH-UHFFFAOYSA-N 1 2 206.274 2.323 20 0 BEADLO Cc1nnc(Cc2ccc(-c3[nH]cc[nH+]3)cc2)o1 ZINC001250337578 967725945 /nfs/dbraw/zinc/72/59/45/967725945.db2.gz CNYSVLRIGNEMNC-UHFFFAOYSA-N 1 2 240.266 2.359 20 0 BEADLO c1cnc(Cc2ccc[nH+]c2N2CCCC2)nc1 ZINC001250342426 967736224 /nfs/dbraw/zinc/73/62/24/967736224.db2.gz CTCOILBYLUDOBF-UHFFFAOYSA-N 1 2 240.310 2.063 20 0 BEADLO COCCOc1cc(NCC(C)(F)F)cc[nH+]1 ZINC001162233130 967767098 /nfs/dbraw/zinc/76/70/98/967767098.db2.gz QCUSHQJGWAOROG-UHFFFAOYSA-N 1 2 246.257 2.174 20 0 BEADLO C[N@H+](Cc1cnoc1)Cc1cccc2c1OCO2 ZINC001205762331 967816172 /nfs/dbraw/zinc/81/61/72/967816172.db2.gz KZUWDSCSTGJCLC-UHFFFAOYSA-N 1 2 246.266 2.035 20 0 BEADLO C[N@@H+](Cc1cnoc1)Cc1cccc2c1OCO2 ZINC001205762331 967816173 /nfs/dbraw/zinc/81/61/73/967816173.db2.gz KZUWDSCSTGJCLC-UHFFFAOYSA-N 1 2 246.266 2.035 20 0 BEADLO CNc1ccc(Cc2cccc(C)n2)c[nH+]1 ZINC001250424139 967834640 /nfs/dbraw/zinc/83/46/40/967834640.db2.gz DFEQJWCMHRRMAN-UHFFFAOYSA-N 1 2 213.284 2.418 20 0 BEADLO COCOc1ccc2[nH]c(C3CC3)[nH+]c2c1 ZINC001250427124 967842309 /nfs/dbraw/zinc/84/23/09/967842309.db2.gz UBUPMOLDFKSUDF-UHFFFAOYSA-N 1 2 218.256 2.423 20 0 BEADLO CSCCc1[nH]c2cc3c(cc2[nH+]1)OCO3 ZINC001250426746 967842295 /nfs/dbraw/zinc/84/22/95/967842295.db2.gz RQRCOPWKQYWQFQ-UHFFFAOYSA-N 1 2 236.296 2.197 20 0 BEADLO Cn1nccc1Cc1ccc[nH+]c1N1CCCC1 ZINC001250437173 967857240 /nfs/dbraw/zinc/85/72/40/967857240.db2.gz FQEWCXHDBHMWGF-UHFFFAOYSA-N 1 2 242.326 2.006 20 0 BEADLO Cc1cn2cc(-c3cnc(C)nc3)ccc2[nH+]1 ZINC001205853357 967858017 /nfs/dbraw/zinc/85/80/17/967858017.db2.gz GPJMCRUMPBZILD-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1cc2cccnc2[nH]1 ZINC001143224584 967874961 /nfs/dbraw/zinc/87/49/61/967874961.db2.gz VRXAUWRMMFYSJR-ZDUSSCGKSA-N 1 2 245.326 2.174 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1cc2cccnc2[nH]1 ZINC001143224584 967874963 /nfs/dbraw/zinc/87/49/63/967874963.db2.gz VRXAUWRMMFYSJR-ZDUSSCGKSA-N 1 2 245.326 2.174 20 0 BEADLO Cc1cc(-c2ccc(F)c(C)n2)c[nH+]c1N ZINC001250490495 967951087 /nfs/dbraw/zinc/95/10/87/967951087.db2.gz FJHPBEKTRRLBDY-UHFFFAOYSA-N 1 2 217.247 2.482 20 0 BEADLO Cc1nc(C[NH+]2CC3(C2)CCCC3)co1 ZINC001206049413 968012842 /nfs/dbraw/zinc/01/28/42/968012842.db2.gz NTDWXFVNQBOIPX-UHFFFAOYSA-N 1 2 206.289 2.359 20 0 BEADLO CCOC(=O)[C@@H]([NH2+][C@H]1C=CCCC1)C1CC1 ZINC001118229200 968059422 /nfs/dbraw/zinc/05/94/22/968059422.db2.gz YJAPGWCLJFHVFF-RYUDHWBXSA-N 1 2 223.316 2.026 20 0 BEADLO COCc1cc[nH+]c(N2CC(C)(C)C2)c1 ZINC001163724751 968106419 /nfs/dbraw/zinc/10/64/19/968106419.db2.gz RDVFRYSMPDEMQK-UHFFFAOYSA-N 1 2 206.289 2.074 20 0 BEADLO Cc1nc(C)c(C[N@H+](C)Cc2ccno2)s1 ZINC001206186145 968113266 /nfs/dbraw/zinc/11/32/66/968113266.db2.gz XJTKUJXLHXHDNQ-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1nc(C)c(C[N@@H+](C)Cc2ccno2)s1 ZINC001206186145 968113282 /nfs/dbraw/zinc/11/32/82/968113282.db2.gz XJTKUJXLHXHDNQ-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO C[C@H](C(=O)N[C@H]1CC[C@@H](C)[C@@H](C)C1)n1cc[nH+]c1 ZINC001320394353 1169916491 /nfs/dbraw/zinc/91/64/91/1169916491.db2.gz IUWBIGNDJGBQAD-XQHKEYJVSA-N 1 2 249.358 2.385 20 0 BEADLO CNc1cc(-c2ccc3c(c2)CC(=O)N3)cc[nH+]1 ZINC001206227539 968153340 /nfs/dbraw/zinc/15/33/40/968153340.db2.gz ADCYHARXNVIJCU-UHFFFAOYSA-N 1 2 239.278 2.285 20 0 BEADLO C[NH+](C)CCn1cc(-c2ccc(S)cc2)cn1 ZINC001206340334 968243645 /nfs/dbraw/zinc/24/36/45/968243645.db2.gz GUITVGODIFNHAV-UHFFFAOYSA-N 1 2 247.367 2.400 20 0 BEADLO CC[C@@H](O)CNc1ccccc1-n1cc[nH+]c1 ZINC001251751172 968310105 /nfs/dbraw/zinc/31/01/05/968310105.db2.gz LRKWNTVOJQDLDU-LLVKDONJSA-N 1 2 231.299 2.055 20 0 BEADLO Cc1nc(N2C[C@@H]3C[C@H]2C[C@H]3F)c2c([nH+]1)CCC2 ZINC001166530000 968324536 /nfs/dbraw/zinc/32/45/36/968324536.db2.gz ACBWOTWCCNMFIW-JBLDHEPKSA-N 1 2 247.317 2.210 20 0 BEADLO COc1cnccc1C[N@@H+]1CCC[C@H](F)C1 ZINC001206473515 968329748 /nfs/dbraw/zinc/32/97/48/968329748.db2.gz QKOVYAFFHXXEDC-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO COc1cnccc1C[N@H+]1CCC[C@H](F)C1 ZINC001206473515 968329759 /nfs/dbraw/zinc/32/97/59/968329759.db2.gz QKOVYAFFHXXEDC-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO COc1ncccc1C[N@@H+]1CCCC[C@H](F)C1 ZINC001206553828 968378682 /nfs/dbraw/zinc/37/86/82/968378682.db2.gz LBEVDOOIAMIBDJ-LBPRGKRZSA-N 1 2 238.306 2.414 20 0 BEADLO COc1ncccc1C[N@H+]1CCCC[C@H](F)C1 ZINC001206553828 968378689 /nfs/dbraw/zinc/37/86/89/968378689.db2.gz LBEVDOOIAMIBDJ-LBPRGKRZSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cccnc1C[N@H+](C)Cc1ccncc1 ZINC001206610328 968419256 /nfs/dbraw/zinc/41/92/56/968419256.db2.gz DSOICJGRSQOGEL-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1cccnc1C[N@@H+](C)Cc1ccncc1 ZINC001206610328 968419260 /nfs/dbraw/zinc/41/92/60/968419260.db2.gz DSOICJGRSQOGEL-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO CCOC[C@H](O)CNc1cc2ccccc2c[nH+]1 ZINC001252018022 968438546 /nfs/dbraw/zinc/43/85/46/968438546.db2.gz MSMFATQZEUHEDN-CYBMUJFWSA-N 1 2 246.310 2.044 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)no1 ZINC001206815411 968486049 /nfs/dbraw/zinc/48/60/49/968486049.db2.gz NUFXAGKSMJUYAI-AOOOYVTPSA-N 1 2 242.269 2.460 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)no1 ZINC001206815411 968486055 /nfs/dbraw/zinc/48/60/55/968486055.db2.gz NUFXAGKSMJUYAI-AOOOYVTPSA-N 1 2 242.269 2.460 20 0 BEADLO Cc1ccnc(C[N@H+]2CCC(=O)[C@H](C)CC2)c1 ZINC001206847919 968494982 /nfs/dbraw/zinc/49/49/82/968494982.db2.gz VBICZPIPSNNJPR-GFCCVEGCSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCC(=O)[C@H](C)CC2)c1 ZINC001206847919 968494977 /nfs/dbraw/zinc/49/49/77/968494977.db2.gz VBICZPIPSNNJPR-GFCCVEGCSA-N 1 2 232.327 2.191 20 0 BEADLO CCCC[C@H](O)CNc1[nH+]cccc1OCC ZINC001252080348 968498395 /nfs/dbraw/zinc/49/83/95/968498395.db2.gz WFBTYLBZCKOOMV-NSHDSACASA-N 1 2 238.331 2.443 20 0 BEADLO CCCC[C@@H](O)CNc1[nH+]cccc1OCC ZINC001252080347 968499694 /nfs/dbraw/zinc/49/96/94/968499694.db2.gz WFBTYLBZCKOOMV-LLVKDONJSA-N 1 2 238.331 2.443 20 0 BEADLO CCC[N@H+](CCOC)Cc1c(F)cncc1F ZINC001206854381 968502746 /nfs/dbraw/zinc/50/27/46/968502746.db2.gz ALZGITUTVXAILA-UHFFFAOYSA-N 1 2 244.285 2.218 20 0 BEADLO CCC[N@@H+](CCOC)Cc1c(F)cncc1F ZINC001206854381 968502748 /nfs/dbraw/zinc/50/27/48/968502748.db2.gz ALZGITUTVXAILA-UHFFFAOYSA-N 1 2 244.285 2.218 20 0 BEADLO CC[C@H]1CCC[C@H]1C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000822715599 968533495 /nfs/dbraw/zinc/53/34/95/968533495.db2.gz HBRUDPHTHPNLGM-NWDGAFQWSA-N 1 2 249.358 2.469 20 0 BEADLO Fc1ccc(C[NH+]2CC3(CCC3)C2)nc1 ZINC001207037930 968570903 /nfs/dbraw/zinc/57/09/03/968570903.db2.gz DAKVMVYUUNOPPO-UHFFFAOYSA-N 1 2 206.264 2.207 20 0 BEADLO Fc1ccc(C[NH+]2CC(c3cccnc3)C2)nc1 ZINC001207041063 968574562 /nfs/dbraw/zinc/57/45/62/968574562.db2.gz KGZLRNHUKAIPGS-UHFFFAOYSA-N 1 2 243.285 2.215 20 0 BEADLO F[C@@H]1C[N@H+](Cc2ncc3ccccn32)C[C@@H]2C[C@@H]21 ZINC001207050967 968578393 /nfs/dbraw/zinc/57/83/93/968578393.db2.gz UCBRKORWBDDGDJ-WCFLWFBJSA-N 1 2 245.301 2.124 20 0 BEADLO F[C@@H]1C[N@@H+](Cc2ncc3ccccn32)C[C@@H]2C[C@@H]21 ZINC001207050967 968578403 /nfs/dbraw/zinc/57/84/03/968578403.db2.gz UCBRKORWBDDGDJ-WCFLWFBJSA-N 1 2 245.301 2.124 20 0 BEADLO Cc1ncc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)s1 ZINC001207058012 968583824 /nfs/dbraw/zinc/58/38/24/968583824.db2.gz BERSQMBFMJIKRF-INTQDDNPSA-N 1 2 226.320 2.241 20 0 BEADLO Cc1ncc(C[N@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)s1 ZINC001207058012 968583832 /nfs/dbraw/zinc/58/38/32/968583832.db2.gz BERSQMBFMJIKRF-INTQDDNPSA-N 1 2 226.320 2.241 20 0 BEADLO Cc1cnc(C[N@@H+]2CCCC[C@@H](F)C2)cn1 ZINC001207071626 968605876 /nfs/dbraw/zinc/60/58/76/968605876.db2.gz DIJZGURCKXMLMS-LLVKDONJSA-N 1 2 223.295 2.109 20 0 BEADLO Cc1cnc(C[N@H+]2CCCC[C@@H](F)C2)cn1 ZINC001207071626 968605881 /nfs/dbraw/zinc/60/58/81/968605881.db2.gz DIJZGURCKXMLMS-LLVKDONJSA-N 1 2 223.295 2.109 20 0 BEADLO Fc1ccc(-c2nnc(Cc3c[nH]c[nH+]3)o2)cc1 ZINC001252186537 968611931 /nfs/dbraw/zinc/61/19/31/968611931.db2.gz IDZMXMCHEPEODG-UHFFFAOYSA-N 1 2 244.229 2.190 20 0 BEADLO CC(C)(O)CNc1ccc(Cn2cc[nH+]c2)cc1 ZINC001252359003 968637573 /nfs/dbraw/zinc/63/75/73/968637573.db2.gz MVPQGNRKPDNXGF-UHFFFAOYSA-N 1 2 245.326 2.114 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCc2cccnc2C1 ZINC001207140043 968651430 /nfs/dbraw/zinc/65/14/30/968651430.db2.gz ZFWCYXQWZPMZEN-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCc2cccnc2C1 ZINC001207140043 968651437 /nfs/dbraw/zinc/65/14/37/968651437.db2.gz ZFWCYXQWZPMZEN-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cncc(C)c2)n(C)n1 ZINC001207157182 968665313 /nfs/dbraw/zinc/66/53/13/968665313.db2.gz YUPCLABUKRVLSP-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cncc(C)c2)n(C)n1 ZINC001207157182 968665318 /nfs/dbraw/zinc/66/53/18/968665318.db2.gz YUPCLABUKRVLSP-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cncc(C[N@H+](C)Cc2cncs2)c1 ZINC001207161890 968669268 /nfs/dbraw/zinc/66/92/68/968669268.db2.gz NHGHLTMKKCVDGD-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CCO[C@@H](C)n1cc(-c2c[nH+]c(N)c(C)c2)cn1 ZINC001240757328 968677793 /nfs/dbraw/zinc/67/77/93/968677793.db2.gz BCVQWYUZVDTHHN-JTQLQIEISA-N 1 2 246.314 2.391 20 0 BEADLO Clc1ncnc(Cl)c1CC[NH+]1CC=CC1 ZINC001207324660 968721832 /nfs/dbraw/zinc/72/18/32/968721832.db2.gz SUEXTQYVLDYEGM-UHFFFAOYSA-N 1 2 244.125 2.198 20 0 BEADLO Fc1ccccc1CC[NH+]1CC2(C1)CCCO2 ZINC001207496395 968806080 /nfs/dbraw/zinc/80/60/80/968806080.db2.gz HBPNESFKOLWABM-UHFFFAOYSA-N 1 2 235.302 2.233 20 0 BEADLO O=c1[nH]cccc1-c1cccc2[nH+]ccn21 ZINC001241112951 968928465 /nfs/dbraw/zinc/92/84/65/968928465.db2.gz ZCCPESRODFHVJL-UHFFFAOYSA-N 1 2 211.224 2.102 20 0 BEADLO CCC[C@H](O)CNc1cccc2[nH+]c(C)cn21 ZINC001252773467 968940322 /nfs/dbraw/zinc/94/03/22/968940322.db2.gz YGZLNCLICWRXEP-NSHDSACASA-N 1 2 233.315 2.216 20 0 BEADLO Cc1cc2c(cn1)C[N@H+](C[C@@H]1CCCCO1)C2 ZINC001207961189 968961158 /nfs/dbraw/zinc/96/11/58/968961158.db2.gz YZINODXYPCCHMC-AWEZNQCLSA-N 1 2 232.327 2.275 20 0 BEADLO Cc1cc2c(cn1)C[N@@H+](C[C@@H]1CCCCO1)C2 ZINC001207961189 968961166 /nfs/dbraw/zinc/96/11/66/968961166.db2.gz YZINODXYPCCHMC-AWEZNQCLSA-N 1 2 232.327 2.275 20 0 BEADLO Cn1c[nH+]c(Cc2nnc(-c3ccccc3)o2)c1 ZINC001253066668 969073548 /nfs/dbraw/zinc/07/35/48/969073548.db2.gz ROKDIUGOJJKQSB-UHFFFAOYSA-N 1 2 240.266 2.061 20 0 BEADLO CSc1ccc(-c2cc[nH+]c(N)c2)cn1 ZINC001241633356 969076835 /nfs/dbraw/zinc/07/68/35/969076835.db2.gz CHYQNUZSLVYOQL-UHFFFAOYSA-N 1 2 217.297 2.448 20 0 BEADLO O=C1CC[C@@H](c2ccc(-c3[nH]cc[nH+]3)cc2)N1 ZINC001242020478 969175309 /nfs/dbraw/zinc/17/53/09/969175309.db2.gz XZRYDJOLFNTBBT-NSHDSACASA-N 1 2 227.267 2.028 20 0 BEADLO CC/C=C\CC[N@@H+]1CC(F)(F)CC[C@@H]1CO ZINC001208723608 969207477 /nfs/dbraw/zinc/20/74/77/969207477.db2.gz CQNQNZCBEDDUDN-DLRQAJBASA-N 1 2 233.302 2.435 20 0 BEADLO Cc1ncc(N=C2CC[NH+](C)CC2)s1 ZINC001208795217 969241381 /nfs/dbraw/zinc/24/13/81/969241381.db2.gz XNEPMVLYMGFCDR-UHFFFAOYSA-N 1 2 209.318 2.083 20 0 BEADLO FC[C@@H]1C[C@H](F)C[N@@H+]1C[C@@H]1CCC=CO1 ZINC001208877332 969263641 /nfs/dbraw/zinc/26/36/41/969263641.db2.gz QPXVQHUDCIORSK-DCAQKATOSA-N 1 2 217.259 2.061 20 0 BEADLO FC[C@@H]1C[C@H](F)C[N@H+]1C[C@@H]1CCC=CO1 ZINC001208877332 969263650 /nfs/dbraw/zinc/26/36/50/969263650.db2.gz QPXVQHUDCIORSK-DCAQKATOSA-N 1 2 217.259 2.061 20 0 BEADLO F[C@H]1C[N@H+](C[C@H]2CCC=CO2)CCC1(F)F ZINC001208876681 969265643 /nfs/dbraw/zinc/26/56/43/969265643.db2.gz KXCVWKQFLGFPIK-ZJUUUORDSA-N 1 2 235.249 2.358 20 0 BEADLO F[C@H]1C[N@@H+](C[C@H]2CCC=CO2)CCC1(F)F ZINC001208876681 969265654 /nfs/dbraw/zinc/26/56/54/969265654.db2.gz KXCVWKQFLGFPIK-ZJUUUORDSA-N 1 2 235.249 2.358 20 0 BEADLO CC(=O)OC(C)(C)CCC[NH+]1C[C@@H](F)[C@H](F)C1 ZINC001209149100 969356159 /nfs/dbraw/zinc/35/61/59/969356159.db2.gz TVKKQIRBQZWCRO-GHMZBOCLSA-N 1 2 249.301 2.100 20 0 BEADLO CC(C)[C@@H](O)CNc1cccc(-n2cc[nH+]c2)c1 ZINC001253769255 969389141 /nfs/dbraw/zinc/38/91/41/969389141.db2.gz MVJNIDLFQZJUCH-AWEZNQCLSA-N 1 2 245.326 2.301 20 0 BEADLO Cc1cccc2c(C[NH+]3CC4(CCO4)C3)c[nH]c21 ZINC001209487738 969521245 /nfs/dbraw/zinc/52/12/45/969521245.db2.gz OODYRQQIICFBRC-UHFFFAOYSA-N 1 2 242.322 2.451 20 0 BEADLO Clc1ncc(C[N@@H+]2C[C@@H]3CCO[C@@H]3C2)s1 ZINC001209473320 969522371 /nfs/dbraw/zinc/52/23/71/969522371.db2.gz IULANMRQTNIRFV-IONNQARKSA-N 1 2 244.747 2.017 20 0 BEADLO Clc1ncc(C[N@H+]2C[C@@H]3CCO[C@@H]3C2)s1 ZINC001209473320 969522374 /nfs/dbraw/zinc/52/23/74/969522374.db2.gz IULANMRQTNIRFV-IONNQARKSA-N 1 2 244.747 2.017 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1C[C@@H]2CC(F)(F)C[C@@H]2C1 ZINC001209554764 969536993 /nfs/dbraw/zinc/53/69/93/969536993.db2.gz XMPXPININQUXDA-AOOOYVTPSA-N 1 2 241.285 2.195 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1C[C@@H]2CC(F)(F)C[C@@H]2C1 ZINC001209554764 969536999 /nfs/dbraw/zinc/53/69/99/969536999.db2.gz XMPXPININQUXDA-AOOOYVTPSA-N 1 2 241.285 2.195 20 0 BEADLO O=C1CC[NH+](Cc2c[nH]c3cc(F)ccc23)CC1 ZINC001209687944 969575052 /nfs/dbraw/zinc/57/50/52/969575052.db2.gz BOGLPVRUFRXVRC-UHFFFAOYSA-N 1 2 246.285 2.472 20 0 BEADLO Cc1cccn2cc(C[NH+]3CC=CC3)nc12 ZINC001209735009 969599716 /nfs/dbraw/zinc/59/97/16/969599716.db2.gz CQKDDRSWUZWIOG-UHFFFAOYSA-N 1 2 213.284 2.015 20 0 BEADLO C/C(=C\C=C\[NH3+])Nc1cccn(CC2CC2)c1=O ZINC001169447961 969635843 /nfs/dbraw/zinc/63/58/43/969635843.db2.gz MOZAMBTVWCGMIU-QCNCOMHOSA-N 1 2 245.326 2.046 20 0 BEADLO O=C1CC[N@H+](C2CCC3(CC3)CC2)C[C@@H]1F ZINC001254447466 969638335 /nfs/dbraw/zinc/63/83/35/969638335.db2.gz HTCUSCVKSTXYBO-NSHDSACASA-N 1 2 225.307 2.322 20 0 BEADLO O=C1CC[N@@H+](C2CCC3(CC3)CC2)C[C@@H]1F ZINC001254447466 969638347 /nfs/dbraw/zinc/63/83/47/969638347.db2.gz HTCUSCVKSTXYBO-NSHDSACASA-N 1 2 225.307 2.322 20 0 BEADLO O=C1CC[N@H+](C2CCC3(CC3)CC2)C[C@H]1F ZINC001254447464 969639138 /nfs/dbraw/zinc/63/91/38/969639138.db2.gz HTCUSCVKSTXYBO-LLVKDONJSA-N 1 2 225.307 2.322 20 0 BEADLO O=C1CC[N@@H+](C2CCC3(CC3)CC2)C[C@H]1F ZINC001254447464 969639145 /nfs/dbraw/zinc/63/91/45/969639145.db2.gz HTCUSCVKSTXYBO-LLVKDONJSA-N 1 2 225.307 2.322 20 0 BEADLO c1[nH]c2ccc(Nc3ncccn3)cc2[nH+]1 ZINC001209841657 969653008 /nfs/dbraw/zinc/65/30/08/969653008.db2.gz ZZIXMGCCVSMQRK-UHFFFAOYSA-N 1 2 211.228 2.097 20 0 BEADLO CN(c1ccc2[nH]c[nH+]c2c1)c1ncccc1N ZINC001209841517 969656149 /nfs/dbraw/zinc/65/61/49/969656149.db2.gz STYYFBABXNEUPA-UHFFFAOYSA-N 1 2 239.282 2.308 20 0 BEADLO Cc1nccnc1Nc1ccc2[nH]c[nH+]c2c1 ZINC001209842144 969656379 /nfs/dbraw/zinc/65/63/79/969656379.db2.gz DWEGQRJMRNHTII-UHFFFAOYSA-N 1 2 225.255 2.405 20 0 BEADLO COc1cc(Nc2ccc3[nH]c[nH+]c3c2)no1 ZINC001209842971 969657451 /nfs/dbraw/zinc/65/74/51/969657451.db2.gz SILQIUBTDVPNBD-UHFFFAOYSA-N 1 2 230.227 2.303 20 0 BEADLO Cc1ccc(O)c(Nc2ccc(F)c(CO)c2)[nH+]1 ZINC001209872557 969666231 /nfs/dbraw/zinc/66/62/31/969666231.db2.gz FFHGFZUSMJPLBY-UHFFFAOYSA-N 1 2 248.257 2.471 20 0 BEADLO CCOc1cc(Nc2ccnnc2)cc(C)[nH+]1 ZINC001209956561 969714211 /nfs/dbraw/zinc/71/42/11/969714211.db2.gz ZEGZBQHUUHICQY-UHFFFAOYSA-N 1 2 230.271 2.322 20 0 BEADLO Cc1cc(NCc2ncccc2O)c[nH+]c1C ZINC001169733519 969838185 /nfs/dbraw/zinc/83/81/85/969838185.db2.gz XPFZOJOKIOCZLF-UHFFFAOYSA-N 1 2 229.283 2.411 20 0 BEADLO CO[C@@H](C)CNc1cc2cc(C)[nH]c2c[nH+]1 ZINC001169772329 969844906 /nfs/dbraw/zinc/84/49/06/969844906.db2.gz GUTULEYTCOTRAW-VIFPVBQESA-N 1 2 219.288 2.318 20 0 BEADLO FC1(F)CC[N@@H+](C2Cc3ccccc3C2)C1 ZINC001255020505 969848669 /nfs/dbraw/zinc/84/86/69/969848669.db2.gz SMKHYXKYDHXNRZ-UHFFFAOYSA-N 1 2 223.266 2.495 20 0 BEADLO FC1(F)CC[N@H+](C2Cc3ccccc3C2)C1 ZINC001255020505 969848670 /nfs/dbraw/zinc/84/86/70/969848670.db2.gz SMKHYXKYDHXNRZ-UHFFFAOYSA-N 1 2 223.266 2.495 20 0 BEADLO Cc1[nH+]cc(Nc2ncc(F)s2)cc1N ZINC001210283915 969851476 /nfs/dbraw/zinc/85/14/76/969851476.db2.gz DADMYEKSIBVGLV-UHFFFAOYSA-N 1 2 224.264 2.311 20 0 BEADLO COc1ccc(Nc2c[nH+]c(C)c(N)c2)c(C)n1 ZINC001210287538 969853989 /nfs/dbraw/zinc/85/39/89/969853989.db2.gz WORCIYWKIHAMOS-UHFFFAOYSA-N 1 2 244.298 2.428 20 0 BEADLO Cc1[nH+]cc(Nc2cc(F)ccn2)cc1N ZINC001210285789 969854071 /nfs/dbraw/zinc/85/40/71/969854071.db2.gz ROJNAAWHSYOIAT-UHFFFAOYSA-N 1 2 218.235 2.250 20 0 BEADLO COc1ncc(Nc2c[nH+]c(C)c(N)c2)cc1F ZINC001210287469 969854081 /nfs/dbraw/zinc/85/40/81/969854081.db2.gz UZVSYWADMCGZSH-UHFFFAOYSA-N 1 2 248.261 2.259 20 0 BEADLO CSc1nccc(Nc2c[nH+]c(C)c(N)c2)n1 ZINC001210286087 969854841 /nfs/dbraw/zinc/85/48/41/969854841.db2.gz UZXOKHHDIBDUII-UHFFFAOYSA-N 1 2 247.327 2.228 20 0 BEADLO CCn1ncc(Nc2c[nH+]c(C)c(N)c2)c1C ZINC001210287549 969854966 /nfs/dbraw/zinc/85/49/66/969854966.db2.gz WVIUXOAZGKNIJF-UHFFFAOYSA-N 1 2 231.303 2.241 20 0 BEADLO Cc1ncc(Nc2c[nH+]c(C)c(N)c2)c(Cl)n1 ZINC001210287544 969855247 /nfs/dbraw/zinc/85/52/47/969855247.db2.gz WSRWJLKISNSYRT-UHFFFAOYSA-N 1 2 249.705 2.468 20 0 BEADLO Cc1[nH+]cc(Nc2cscn2)cc1N ZINC001210287370 969855299 /nfs/dbraw/zinc/85/52/99/969855299.db2.gz SAISHBQBYHZSIP-UHFFFAOYSA-N 1 2 206.274 2.172 20 0 BEADLO COc1cc(Nc2c[nH+]c(C)c(N)c2)c(F)cn1 ZINC001210288670 969856522 /nfs/dbraw/zinc/85/65/22/969856522.db2.gz MWHVFHLYDHNSBP-UHFFFAOYSA-N 1 2 248.261 2.259 20 0 BEADLO Cc1[nH+]cc(Nc2ccn3ccnc3c2)cc1N ZINC001210288685 969857356 /nfs/dbraw/zinc/85/73/56/969857356.db2.gz SFFDEZWVNWUSMC-UHFFFAOYSA-N 1 2 239.282 2.364 20 0 BEADLO Cc1ncc(Nc2ccn3cc[nH+]c3c2)cc1N ZINC001210288685 969857357 /nfs/dbraw/zinc/85/73/57/969857357.db2.gz SFFDEZWVNWUSMC-UHFFFAOYSA-N 1 2 239.282 2.364 20 0 BEADLO Cc1[nH+]cc(Nc2cc(N)ccc2O)cc1N ZINC001210290296 969860010 /nfs/dbraw/zinc/86/00/10/969860010.db2.gz JCCHPEPMZHBSKK-UHFFFAOYSA-N 1 2 230.271 2.004 20 0 BEADLO COc1cc(N)ccc1Nc1c[nH+]c(C)c(N)c1 ZINC001210290839 969860251 /nfs/dbraw/zinc/86/02/51/969860251.db2.gz QJRVWHLUZBKBLN-UHFFFAOYSA-N 1 2 244.298 2.307 20 0 BEADLO CCc1nnc(-c2ccc3[nH+]c(NC)[nH]c3c2)o1 ZINC001255078745 969872632 /nfs/dbraw/zinc/87/26/32/969872632.db2.gz ASRIAUQKJLWRKL-UHFFFAOYSA-N 1 2 243.270 2.217 20 0 BEADLO Cc1cc(NC[C@@H]2COC(C)(C)O2)c[nH+]c1C ZINC001169907680 969882457 /nfs/dbraw/zinc/88/24/57/969882457.db2.gz GBZZEDWYBWBKHG-GFCCVEGCSA-N 1 2 236.315 2.262 20 0 BEADLO C[C@@H](O)c1cccc(Nc2[nH+]cccc2N)c1 ZINC001210503274 969914977 /nfs/dbraw/zinc/91/49/77/969914977.db2.gz KCOZHLPFFIHDTH-SECBINFHSA-N 1 2 229.283 2.461 20 0 BEADLO O=C1CC(Nc2cc3ccccc3c[nH+]2)C1 ZINC001156610928 969937985 /nfs/dbraw/zinc/93/79/85/969937985.db2.gz HUFXDSIEILDLTA-UHFFFAOYSA-N 1 2 212.252 2.378 20 0 BEADLO C1=[NH+]c2nccc(=C3NN=C(C4CCC4)O3)c2=C1 ZINC001255209507 970006799 /nfs/dbraw/zinc/00/67/99/970006799.db2.gz JZYZGHHRZGNWGH-JTQLQIEISA-N 1 2 240.266 2.357 20 0 BEADLO CCN(CC)c1cc(N2CC3CC(C3)C2)nc[nH+]1 ZINC001156892760 970025850 /nfs/dbraw/zinc/02/58/50/970025850.db2.gz USFNQVQIMBAYJE-UHFFFAOYSA-N 1 2 246.358 2.169 20 0 BEADLO CCN(CC)c1cc(N2CC3CC(C3)C2)[nH+]cn1 ZINC001156892760 970025860 /nfs/dbraw/zinc/02/58/60/970025860.db2.gz USFNQVQIMBAYJE-UHFFFAOYSA-N 1 2 246.358 2.169 20 0 BEADLO COc1cc(Nc2ccnc(C)n2)cc(C)[nH+]1 ZINC001210777024 970028784 /nfs/dbraw/zinc/02/87/84/970028784.db2.gz UQJKHRDZNWIYSM-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO CC=C(C)Nc1cc[nH+]c2ccc(OC)nc12 ZINC001210792723 970031532 /nfs/dbraw/zinc/03/15/32/970031532.db2.gz GHPODKHLBIVNNE-RUDMXATFSA-N 1 2 229.283 2.396 20 0 BEADLO COC(=O)c1ccc2c(ccnc2NC=[NH2+])c1 ZINC001157079379 970078207 /nfs/dbraw/zinc/07/82/07/970078207.db2.gz YPSNTPDMELEVTF-UHFFFAOYSA-N 1 2 229.239 2.040 20 0 BEADLO COc1cc2ccnc(NC=[NH2+])c2cc1F ZINC001157080329 970078898 /nfs/dbraw/zinc/07/88/98/970078898.db2.gz UGHRAAMTGGSMNF-UHFFFAOYSA-N 1 2 219.219 2.401 20 0 BEADLO [NH2+]=CNc1ccc(COC2CCC2)cn1 ZINC001157080487 970079536 /nfs/dbraw/zinc/07/95/36/970079536.db2.gz XBZCDPBWEXRTCJ-UHFFFAOYSA-N 1 2 205.261 2.170 20 0 BEADLO COc1cc(NC=[NH2+])nc2ccccc21 ZINC001157078863 970080008 /nfs/dbraw/zinc/08/00/08/970080008.db2.gz QXPARXQUJDQXEP-UHFFFAOYSA-N 1 2 201.229 2.262 20 0 BEADLO Nc1ccc[nH+]c1Nc1ccc(F)c(O)c1 ZINC001211215359 970176216 /nfs/dbraw/zinc/17/62/16/970176216.db2.gz HYMOLMCJACGTOZ-UHFFFAOYSA-N 1 2 219.219 2.252 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2nnccc2c1 ZINC001243067377 970255142 /nfs/dbraw/zinc/25/51/42/970255142.db2.gz KYFAMFCTVXXZJQ-UHFFFAOYSA-N 1 2 210.240 2.030 20 0 BEADLO Cn1c[nH+]cc1-c1ccnc(C(F)F)c1 ZINC001243069577 970259571 /nfs/dbraw/zinc/25/95/71/970259571.db2.gz ULEGTKCFTFRWNO-UHFFFAOYSA-N 1 2 209.199 2.420 20 0 BEADLO COC(=O)c1ccc(C)c(-c2c[nH+]cn2C)c1 ZINC001243068544 970263771 /nfs/dbraw/zinc/26/37/71/970263771.db2.gz CZMRQPIMJLHGMR-UHFFFAOYSA-N 1 2 230.267 2.182 20 0 BEADLO Nc1cccn1-c1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213087551 970268917 /nfs/dbraw/zinc/26/89/17/970268917.db2.gz SLGYPRVDKUSHTH-UHFFFAOYSA-N 1 2 224.267 2.450 20 0 BEADLO COc1cccc(-c2c[nH+]c(C)cc2OC)n1 ZINC001243096480 970323228 /nfs/dbraw/zinc/32/32/28/970323228.db2.gz VNUCBGLPLNCTOB-UHFFFAOYSA-N 1 2 230.267 2.469 20 0 BEADLO Cc1[nH+]cc(C2CC2)cc1Nc1c(N)cnn1C ZINC001213494509 970326425 /nfs/dbraw/zinc/32/64/25/970326425.db2.gz ALPFQUVKPHKDIK-UHFFFAOYSA-N 1 2 243.314 2.327 20 0 BEADLO Cc1cc(C)c(Nc2cccc(CO)n2)c[nH+]1 ZINC001213508568 970333394 /nfs/dbraw/zinc/33/33/94/970333394.db2.gz WPPIWNMZKDQZGU-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO Cc1cc(C)c(Nc2cccnc2CO)c[nH+]1 ZINC001213510388 970335306 /nfs/dbraw/zinc/33/53/06/970335306.db2.gz AMDAAOFUBDGTAR-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO Cc1c[nH+]cc(Nc2cnn(C)c2)c1C ZINC001213522586 970337199 /nfs/dbraw/zinc/33/71/99/970337199.db2.gz CWFLKYAYLMJSCK-UHFFFAOYSA-N 1 2 202.261 2.176 20 0 BEADLO Cc1cc(N)ccc1Nc1[nH+]cccc1CCO ZINC001214112415 970438008 /nfs/dbraw/zinc/43/80/08/970438008.db2.gz HBPGVDXOXZRNQS-UHFFFAOYSA-N 1 2 243.310 2.251 20 0 BEADLO C[C@H](c1nnnn1C1CC1)[N@@H+]1CC(C)(C)C1(C)C ZINC001255733819 970468363 /nfs/dbraw/zinc/46/83/63/970468363.db2.gz PWAXHCCYZJIQPC-SECBINFHSA-N 1 2 249.362 2.189 20 0 BEADLO C[C@H](c1nnnn1C1CC1)[N@H+]1CC(C)(C)C1(C)C ZINC001255733819 970468369 /nfs/dbraw/zinc/46/83/69/970468369.db2.gz PWAXHCCYZJIQPC-SECBINFHSA-N 1 2 249.362 2.189 20 0 BEADLO CCOC(=O)C[NH2+][C@@H](C)Cc1ccc(C)cc1 ZINC001255776041 970483960 /nfs/dbraw/zinc/48/39/60/970483960.db2.gz CTMPWDCBAPPWBQ-LBPRGKRZSA-N 1 2 235.327 2.079 20 0 BEADLO CCOC1C[NH+]([C@@H](C)Cc2ccccc2F)C1 ZINC001255841033 970511916 /nfs/dbraw/zinc/51/19/16/970511916.db2.gz BBJBNVYOGRXGSW-NSHDSACASA-N 1 2 237.318 2.477 20 0 BEADLO CC[C@@H]1C[C@@H]([N@H+](C)CC(F)F)CCO1 ZINC001170240068 970619615 /nfs/dbraw/zinc/61/96/15/970619615.db2.gz CQXPZBCHAUSCDX-DTWKUNHWSA-N 1 2 207.264 2.141 20 0 BEADLO CC[C@@H]1C[C@@H]([N@@H+](C)CC(F)F)CCO1 ZINC001170240068 970619625 /nfs/dbraw/zinc/61/96/25/970619625.db2.gz CQXPZBCHAUSCDX-DTWKUNHWSA-N 1 2 207.264 2.141 20 0 BEADLO CCCCCc1nnc(C2([NH+](C)C)CC2)o1 ZINC001256103396 970657990 /nfs/dbraw/zinc/65/79/90/970657990.db2.gz VKQJFFDOQJZQCR-UHFFFAOYSA-N 1 2 223.320 2.353 20 0 BEADLO COC(=O)C[NH2+][C@H]1CCC[C@H](c2ccccc2)C1 ZINC001256106444 970659121 /nfs/dbraw/zinc/65/91/21/970659121.db2.gz JTVMJZNXRXUXFZ-KBPBESRZSA-N 1 2 247.338 2.475 20 0 BEADLO CC/C=C/C[NH2+][C@H]1CCCc2[nH]ncc21 ZINC000401599157 970712140 /nfs/dbraw/zinc/71/21/40/970712140.db2.gz YYDNTAYCXFZATD-UFFNRZRYSA-N 1 2 205.305 2.343 20 0 BEADLO C[NH+](C)Cc1nnc([C@@H]2CCCCC2(F)F)o1 ZINC001327355161 972558220 /nfs/dbraw/zinc/55/82/20/972558220.db2.gz TVBLRVSIHRRKSX-QMMMGPOBSA-N 1 2 245.273 2.424 20 0 BEADLO CCCC(C)(C)C(=O)N1CCc2[nH+]ccn2CC1 ZINC001144114941 972584843 /nfs/dbraw/zinc/58/48/43/972584843.db2.gz FZXUTYWGNGDJQK-UHFFFAOYSA-N 1 2 249.358 2.094 20 0 BEADLO Cn1c[nH+]cc1CO[C@@H]1CCc2ccccc2C1 ZINC001222600582 972598784 /nfs/dbraw/zinc/59/87/84/972598784.db2.gz QRKUHJJRCOBQFO-OAHLLOKOSA-N 1 2 242.322 2.494 20 0 BEADLO CCOc1cccc([C@@H](C)[NH2+]Cc2nnc[nH]2)c1 ZINC001327518506 972609785 /nfs/dbraw/zinc/60/97/85/972609785.db2.gz JJKWGSZHUYILOE-SNVBAGLBSA-N 1 2 246.314 2.054 20 0 BEADLO C[C@@H]([NH2+]Cc1ncn[nH]1)[C@@H](C)c1ccccc1 ZINC001327553910 972632757 /nfs/dbraw/zinc/63/27/57/972632757.db2.gz KABKLHZAZXTLRS-GHMZBOCLSA-N 1 2 230.315 2.087 20 0 BEADLO Cc1cc([C@@H](C)NC(=O)Cc2[nH]cc[nH+]2)c(C)o1 ZINC001327815857 972741622 /nfs/dbraw/zinc/74/16/22/972741622.db2.gz MEQDIDHXUUOJHJ-SECBINFHSA-N 1 2 247.298 2.039 20 0 BEADLO CCc1cccc(C[N@@H+]2CCO[C@H](C(C)=O)C2)c1 ZINC001144328637 972765155 /nfs/dbraw/zinc/76/51/55/972765155.db2.gz BGBRMLCPHOTHQL-HNNXBMFYSA-N 1 2 247.338 2.039 20 0 BEADLO CCc1cccc(C[N@H+]2CCO[C@H](C(C)=O)C2)c1 ZINC001144328637 972765163 /nfs/dbraw/zinc/76/51/63/972765163.db2.gz BGBRMLCPHOTHQL-HNNXBMFYSA-N 1 2 247.338 2.039 20 0 BEADLO C[C@@H]1CCC[C@H]1Cc1nnc(C[NH+](C)C)o1 ZINC001327865216 972768272 /nfs/dbraw/zinc/76/82/72/972768272.db2.gz MHBJXHZGCPKSFU-ZJUUUORDSA-N 1 2 223.320 2.110 20 0 BEADLO CSCC[N@H+](C)Cc1c(F)cc(O)cc1F ZINC001144561824 972868808 /nfs/dbraw/zinc/86/88/08/972868808.db2.gz NXXRHZDZQUZFQG-UHFFFAOYSA-N 1 2 247.310 2.465 20 0 BEADLO CSCC[N@@H+](C)Cc1c(F)cc(O)cc1F ZINC001144561824 972868814 /nfs/dbraw/zinc/86/88/14/972868814.db2.gz NXXRHZDZQUZFQG-UHFFFAOYSA-N 1 2 247.310 2.465 20 0 BEADLO Cc1nnc(C[NH2+][C@H](C)c2ccccc2F)n1C ZINC000042337920 973027752 /nfs/dbraw/zinc/02/77/52/973027752.db2.gz RRAOQPXIFBYIPT-SECBINFHSA-N 1 2 248.305 2.113 20 0 BEADLO Cc1cc(CO[C@@H]2CCCOC2)cc(C)[nH+]1 ZINC001223419626 973051736 /nfs/dbraw/zinc/05/17/36/973051736.db2.gz GNLVXCSZXQYYKC-CYBMUJFWSA-N 1 2 221.300 2.394 20 0 BEADLO CC[C@@H](OC1C[NH+](C)C1)c1ccccc1 ZINC001223709738 973229274 /nfs/dbraw/zinc/22/92/74/973229274.db2.gz YKUOQFMVHUEUCD-CYBMUJFWSA-N 1 2 205.301 2.468 20 0 BEADLO Cc1nc(CN2CCc3[nH+]c[nH]c3C2)c(C)s1 ZINC001329246676 973601460 /nfs/dbraw/zinc/60/14/60/973601460.db2.gz AUAPOWYOZFAUAK-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO C[C@H]1CC[C@H](c2nnc(C[NH+](C)C)o2)CC1 ZINC001329324802 973681534 /nfs/dbraw/zinc/68/15/34/973681534.db2.gz XQDLGVFZGANJKF-MGCOHNPYSA-N 1 2 223.320 2.425 20 0 BEADLO C[C@@H](CC1CCC1)NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001332201312 1169967641 /nfs/dbraw/zinc/96/76/41/1169967641.db2.gz JNMLPWGQFPNPRX-QWRGUYRKSA-N 1 2 235.331 2.139 20 0 BEADLO COc1ccc[nH+]c1NCCCCCCO ZINC000234948621 973797501 /nfs/dbraw/zinc/79/75/01/973797501.db2.gz WQEZDDXFTBFWNG-UHFFFAOYSA-N 1 2 224.304 2.055 20 0 BEADLO CCN(C(=O)c1ccc(C)cc1C)C1C[NH+](C)C1 ZINC001148248082 973817828 /nfs/dbraw/zinc/81/78/28/973817828.db2.gz VTIYPKJAFDWRFB-UHFFFAOYSA-N 1 2 246.354 2.080 20 0 BEADLO CC(=O)NCCNc1cc(C)c2ccccc2[nH+]1 ZINC000046230376 974045935 /nfs/dbraw/zinc/04/59/35/974045935.db2.gz VJKBGJUKMCWYSM-UHFFFAOYSA-N 1 2 243.310 2.091 20 0 BEADLO COc1cc[nH+]cc1NC(C)(C)CC(C)=O ZINC001171498274 974082400 /nfs/dbraw/zinc/08/24/00/974082400.db2.gz KENKULJELXSAOO-UHFFFAOYSA-N 1 2 222.288 2.260 20 0 BEADLO CC(=O)CC(C)(C)Nc1ccn2cc(N)[nH+]c2c1 ZINC001171499387 974083482 /nfs/dbraw/zinc/08/34/82/974083482.db2.gz RJPPSINPFJGBPL-UHFFFAOYSA-N 1 2 246.314 2.086 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@H]1CCc2c(C)cccc2C1 ZINC001171552810 974100711 /nfs/dbraw/zinc/10/07/11/974100711.db2.gz HKEGEOBZMDGEFP-AAEUAGOBSA-N 1 2 247.338 2.003 20 0 BEADLO CCOC(=[NH2+])CCCCO[C@H](C)CC(=O)OC ZINC001224960434 974102935 /nfs/dbraw/zinc/10/29/35/974102935.db2.gz CEEMUTGSAXUBEI-SNVBAGLBSA-N 1 2 245.319 2.139 20 0 BEADLO Cc1nonc1C[NH2+]Cc1ccc2c(c1)CCC2 ZINC001330096227 974103320 /nfs/dbraw/zinc/10/33/20/974103320.db2.gz XLXDQXCFTIRQGF-UHFFFAOYSA-N 1 2 243.310 2.157 20 0 BEADLO CCOC(=O)C[NH2+][C@H](C)CCc1ccc(C)cc1 ZINC001171660638 974123218 /nfs/dbraw/zinc/12/32/18/974123218.db2.gz NIFRQQUNHROMGM-CYBMUJFWSA-N 1 2 249.354 2.469 20 0 BEADLO CCCC[C@H](C)N(C)C(=O)[C@H](C)n1cc[nH+]c1 ZINC001330192872 974130752 /nfs/dbraw/zinc/13/07/52/974130752.db2.gz RTHSCCMBCHSSTL-RYUDHWBXSA-N 1 2 237.347 2.481 20 0 BEADLO C[C@H]1CC(=O)CC[N@@H+]1[C@H]1Cc2cccc(F)c2C1 ZINC001171792657 974186398 /nfs/dbraw/zinc/18/63/98/974186398.db2.gz IDRYJYIHZSJRDE-JQWIXIFHSA-N 1 2 247.313 2.346 20 0 BEADLO C[C@H]1CC(=O)CC[N@H+]1[C@H]1Cc2cccc(F)c2C1 ZINC001171792657 974186404 /nfs/dbraw/zinc/18/64/04/974186404.db2.gz IDRYJYIHZSJRDE-JQWIXIFHSA-N 1 2 247.313 2.346 20 0 BEADLO CC[NH+]1CC(Oc2cccc(Cl)c2)C1 ZINC001225230325 974279547 /nfs/dbraw/zinc/27/95/47/974279547.db2.gz XWBJXTXLAYMNJT-UHFFFAOYSA-N 1 2 211.692 2.423 20 0 BEADLO COC(=O)[C@@H](Oc1cc[nH+]cc1)c1ccccc1 ZINC001225290825 974359306 /nfs/dbraw/zinc/35/93/06/974359306.db2.gz JIAAYQYTADFQPJ-ZDUSSCGKSA-N 1 2 243.262 2.375 20 0 BEADLO Cc1nc([C@H](C)[NH2+][C@@H](C)[C@H]2CC2(F)F)no1 ZINC001330621600 974366954 /nfs/dbraw/zinc/36/69/54/974366954.db2.gz LMRQLQDHSVOUEC-VMHSAVOQSA-N 1 2 231.246 2.072 20 0 BEADLO C[C@H](Oc1cc[nH+]cc1)c1cnccn1 ZINC001225294183 974370457 /nfs/dbraw/zinc/37/04/57/974370457.db2.gz GUJVMTIKCQGVNM-VIFPVBQESA-N 1 2 201.229 2.012 20 0 BEADLO Cc1csc(CNC(=O)[C@@H](C)n2cc[nH+]c2)c1 ZINC001330679288 974403745 /nfs/dbraw/zinc/40/37/45/974403745.db2.gz FMIWKBPRVAABEB-SNVBAGLBSA-N 1 2 249.339 2.130 20 0 BEADLO Brc1cnccc1C[NH+]1CCC1 ZINC000258341275 974470906 /nfs/dbraw/zinc/47/09/06/974470906.db2.gz VHZISHAPGVJMMF-UHFFFAOYSA-N 1 2 227.105 2.050 20 0 BEADLO CC1(C)C[C@H]([N@@H+]2CCC(F)(F)[C@@H](F)C2)CO1 ZINC001172283293 974544092 /nfs/dbraw/zinc/54/40/92/974544092.db2.gz JKLGDJHLSSKIDA-IUCAKERBSA-N 1 2 237.265 2.233 20 0 BEADLO CC1(C)C[C@H]([N@H+]2CCC(F)(F)[C@@H](F)C2)CO1 ZINC001172283293 974544097 /nfs/dbraw/zinc/54/40/97/974544097.db2.gz JKLGDJHLSSKIDA-IUCAKERBSA-N 1 2 237.265 2.233 20 0 BEADLO CCc1nn(C[N@H+]2CC[C@@H](CC)C2)c(=S)o1 ZINC001331007905 974557246 /nfs/dbraw/zinc/55/72/46/974557246.db2.gz OIDCCRBTHIRMBQ-SECBINFHSA-N 1 2 241.360 2.457 20 0 BEADLO CCc1nn(C[N@@H+]2CC[C@@H](CC)C2)c(=S)o1 ZINC001331007905 974557251 /nfs/dbraw/zinc/55/72/51/974557251.db2.gz OIDCCRBTHIRMBQ-SECBINFHSA-N 1 2 241.360 2.457 20 0 BEADLO C[C@@H]1CC[C@H]([N@@H+]2CCC(=O)[C@H](F)C2)C[C@H]1C ZINC001172374712 974574855 /nfs/dbraw/zinc/57/48/55/974574855.db2.gz AMBPSZKPZIFONI-WISYIIOYSA-N 1 2 227.323 2.424 20 0 BEADLO C[C@@H]1CC[C@H]([N@H+]2CCC(=O)[C@H](F)C2)C[C@H]1C ZINC001172374712 974574857 /nfs/dbraw/zinc/57/48/57/974574857.db2.gz AMBPSZKPZIFONI-WISYIIOYSA-N 1 2 227.323 2.424 20 0 BEADLO CC(C)[NH+]1CC(Oc2ccc(Cl)nc2)C1 ZINC001225596876 974582956 /nfs/dbraw/zinc/58/29/56/974582956.db2.gz FENYABMTLFNNDK-UHFFFAOYSA-N 1 2 226.707 2.206 20 0 BEADLO Cc1cnc(=S)n(C[N@H+](C)CCCF)c1 ZINC001331522253 974749044 /nfs/dbraw/zinc/74/90/44/974749044.db2.gz DDTLPCKPKKODRH-UHFFFAOYSA-N 1 2 229.324 2.170 20 0 BEADLO Cc1cnc(=S)n(C[N@@H+](C)CCCF)c1 ZINC001331522253 974749049 /nfs/dbraw/zinc/74/90/49/974749049.db2.gz DDTLPCKPKKODRH-UHFFFAOYSA-N 1 2 229.324 2.170 20 0 BEADLO CC[C@@H](CC(C)C)[N@@H+]1CCC(=O)[C@H](F)C1 ZINC001172399340 974758584 /nfs/dbraw/zinc/75/85/84/974758584.db2.gz CAOBXWFBFJDZLQ-WDEREUQCSA-N 1 2 215.312 2.424 20 0 BEADLO CC[C@@H](CC(C)C)[N@H+]1CCC(=O)[C@H](F)C1 ZINC001172399340 974758589 /nfs/dbraw/zinc/75/85/89/974758589.db2.gz CAOBXWFBFJDZLQ-WDEREUQCSA-N 1 2 215.312 2.424 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N[C@H]2CC[C@H](C)C2)c[nH+]1 ZINC001331727967 974805136 /nfs/dbraw/zinc/80/51/36/974805136.db2.gz CYKRWWKLYLBEIQ-JQWIXIFHSA-N 1 2 249.358 2.231 20 0 BEADLO CC(C)OCC[C@@H](C)N1C[C@H](C)[N@H+](C)C[C@H]1C ZINC001172446368 974807753 /nfs/dbraw/zinc/80/77/53/974807753.db2.gz KPINIBLMXGJDDP-HZSPNIEDSA-N 1 2 242.407 2.214 20 0 BEADLO CC(C)OCC[C@@H](C)N1C[C@H](C)[N@@H+](C)C[C@H]1C ZINC001172446368 974807757 /nfs/dbraw/zinc/80/77/57/974807757.db2.gz KPINIBLMXGJDDP-HZSPNIEDSA-N 1 2 242.407 2.214 20 0 BEADLO CCc1ccc(NCc2cc(C)[nH]n2)[nH+]c1 ZINC001331933147 974877022 /nfs/dbraw/zinc/87/70/22/974877022.db2.gz MGBHVUYLVWHXOL-UHFFFAOYSA-N 1 2 216.288 2.288 20 0 BEADLO CCc1nn(C[N@@H+]2CC[C@@H](C)[C@H]2C)c(=S)o1 ZINC001332125899 974954015 /nfs/dbraw/zinc/95/40/15/974954015.db2.gz QKBRERINDFOYBS-RKDXNWHRSA-N 1 2 241.360 2.456 20 0 BEADLO CCc1nn(C[N@H+]2CC[C@@H](C)[C@H]2C)c(=S)o1 ZINC001332125899 974954021 /nfs/dbraw/zinc/95/40/21/974954021.db2.gz QKBRERINDFOYBS-RKDXNWHRSA-N 1 2 241.360 2.456 20 0 BEADLO COc1ccc(C)cc1C[N@H+](C)CC(C)=O ZINC000258844658 975018637 /nfs/dbraw/zinc/01/86/37/975018637.db2.gz CUAKHDJXJDJBFL-UHFFFAOYSA-N 1 2 221.300 2.024 20 0 BEADLO COc1ccc(C)cc1C[N@@H+](C)CC(C)=O ZINC000258844658 975018644 /nfs/dbraw/zinc/01/86/44/975018644.db2.gz CUAKHDJXJDJBFL-UHFFFAOYSA-N 1 2 221.300 2.024 20 0 BEADLO CC[C@@H]1CC[C@@H]([NH+]2CC(O)(C(F)(F)F)C2)C1 ZINC001173271930 975146333 /nfs/dbraw/zinc/14/63/33/975146333.db2.gz GQANHZKVKODYNG-RKDXNWHRSA-N 1 2 237.265 2.174 20 0 BEADLO CCSC[C@@H](C)[NH2+]Cc1noc(C(C)C)n1 ZINC001173286287 975246121 /nfs/dbraw/zinc/24/61/21/975246121.db2.gz AJHXJABDARDPSG-SECBINFHSA-N 1 2 243.376 2.424 20 0 BEADLO CCOC(=O)[C@@H]([NH2+][C@H](C)CSCC)C(C)C ZINC001173287684 975249883 /nfs/dbraw/zinc/24/98/83/975249883.db2.gz KYROXTPHXJHDNN-MNOVXSKESA-N 1 2 247.404 2.305 20 0 BEADLO CCOC(=O)C(C)(C)[NH2+][C@@H](C)CSCC ZINC001173287627 975252226 /nfs/dbraw/zinc/25/22/26/975252226.db2.gz JEPJBSMGOJCTFJ-VIFPVBQESA-N 1 2 233.377 2.059 20 0 BEADLO CCSC[C@@H](C)[NH2+][C@H](C(=O)OC)C(C)(C)C ZINC001173288688 975254175 /nfs/dbraw/zinc/25/41/75/975254175.db2.gz YQQRQASUAWMCJE-NXEZZACHSA-N 1 2 247.404 2.305 20 0 BEADLO CC[C@@H]1CC[C@H]([N@@H+]2CC[C@H](O)C(F)(F)C2)C1 ZINC001173288975 975254983 /nfs/dbraw/zinc/25/49/83/975254983.db2.gz QACWHVMYUDEETP-VWYCJHECSA-N 1 2 233.302 2.267 20 0 BEADLO CC[C@@H]1CC[C@H]([N@H+]2CC[C@H](O)C(F)(F)C2)C1 ZINC001173288975 975254991 /nfs/dbraw/zinc/25/49/91/975254991.db2.gz QACWHVMYUDEETP-VWYCJHECSA-N 1 2 233.302 2.267 20 0 BEADLO COc1ccc(C[NH2+]Cc2csnn2)c(C)c1 ZINC001332719063 975272070 /nfs/dbraw/zinc/27/20/70/975272070.db2.gz WUEFZUQTLOMDGU-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO CCCc1c(O)cccc1OC1C[NH+](CC)C1 ZINC001227143254 975293866 /nfs/dbraw/zinc/29/38/66/975293866.db2.gz FZQZVQJIIXEWNG-UHFFFAOYSA-N 1 2 235.327 2.428 20 0 BEADLO Cc1cc[nH+]c(C)c1O[C@H]1CCn2ccnc21 ZINC001227258908 975334158 /nfs/dbraw/zinc/33/41/58/975334158.db2.gz BQWBGONMXQFSPF-NSHDSACASA-N 1 2 229.283 2.419 20 0 BEADLO Cc1cc[nH+]c(C)c1O[C@H]1C(=O)OCC1(C)C ZINC001227263727 975337348 /nfs/dbraw/zinc/33/73/48/975337348.db2.gz HIOISDBKXHYAPE-NSHDSACASA-N 1 2 235.283 2.029 20 0 BEADLO Cc1cc[nH+]c(C)c1OC[C@@H]1CCCO1 ZINC001227264662 975339111 /nfs/dbraw/zinc/33/91/11/975339111.db2.gz PMHAVRXYTLHIDT-NSHDSACASA-N 1 2 207.273 2.256 20 0 BEADLO CC1=C(Oc2c(C)cc[nH+]c2C)C(=O)O[C@@H]1C ZINC001227264451 975340226 /nfs/dbraw/zinc/34/02/26/975340226.db2.gz MEIHDKJCPLLJCV-SNVBAGLBSA-N 1 2 233.267 2.297 20 0 BEADLO Cc1cc[nH+]c(C)c1O[C@@H]1C=C(C)OC(=O)C1 ZINC001227266254 975345669 /nfs/dbraw/zinc/34/56/69/975345669.db2.gz ZVGROKPEKBZVIA-LLVKDONJSA-N 1 2 233.267 2.297 20 0 BEADLO CC[NH+]1CC(Oc2ccc(Cl)cc2OC)C1 ZINC001227366482 975375626 /nfs/dbraw/zinc/37/56/26/975375626.db2.gz LUFZWMTWDDVWQR-UHFFFAOYSA-N 1 2 241.718 2.432 20 0 BEADLO Fc1cc2c(cc1F)CC([NH2+]CC(F)F)C2 ZINC001173472651 975380962 /nfs/dbraw/zinc/38/09/62/975380962.db2.gz JOQQTLIGNWNEBX-UHFFFAOYSA-N 1 2 233.208 2.287 20 0 BEADLO Cc1ccc(F)c(C[N@H+](C)C2CC(O)C2)c1F ZINC001333342405 975682274 /nfs/dbraw/zinc/68/22/74/975682274.db2.gz PXTJYDZVZLWHPE-UHFFFAOYSA-N 1 2 241.281 2.228 20 0 BEADLO Cc1ccc(F)c(C[N@@H+](C)C2CC(O)C2)c1F ZINC001333342405 975682263 /nfs/dbraw/zinc/68/22/63/975682263.db2.gz PXTJYDZVZLWHPE-UHFFFAOYSA-N 1 2 241.281 2.228 20 0 BEADLO Cc1coc(C(=O)OCCCc2c[nH+]cn2C)c1 ZINC001343739354 1169992828 /nfs/dbraw/zinc/99/28/28/1169992828.db2.gz PLLRTEAJNNTOBB-UHFFFAOYSA-N 1 2 248.282 2.111 20 0 BEADLO CCC(CC)[N@@H+](Cc1nc[nH]n1)CC(C)C ZINC001333583531 975868810 /nfs/dbraw/zinc/86/88/10/975868810.db2.gz TVBGFENNXRHBQO-UHFFFAOYSA-N 1 2 224.352 2.451 20 0 BEADLO CCC(CC)[N@H+](Cc1nc[nH]n1)CC(C)C ZINC001333583531 975868816 /nfs/dbraw/zinc/86/88/16/975868816.db2.gz TVBGFENNXRHBQO-UHFFFAOYSA-N 1 2 224.352 2.451 20 0 BEADLO Cc1ccc(N[C@H](C)c2cnnn2C)c(C)[nH+]1 ZINC001333595874 975878061 /nfs/dbraw/zinc/87/80/61/975878061.db2.gz GZAIJBRWDXZTQW-SNVBAGLBSA-N 1 2 231.303 2.000 20 0 BEADLO COc1cc2c(cc1OC1CC1)C=[NH+]CC2 ZINC001228090981 975901118 /nfs/dbraw/zinc/90/11/18/975901118.db2.gz PZGTXKHRALTAPW-UHFFFAOYSA-N 1 2 217.268 2.211 20 0 BEADLO CCOCCN(C)c1cc(CC)[nH+]c(CC)n1 ZINC001333738623 976048725 /nfs/dbraw/zinc/04/87/25/976048725.db2.gz FILXMDKEBCQXPD-UHFFFAOYSA-N 1 2 237.347 2.074 20 0 BEADLO CC[C@H](CSC)Nc1cc(N(C)C)nc[nH+]1 ZINC001333739441 976050153 /nfs/dbraw/zinc/05/01/53/976050153.db2.gz IIJNJMHKYZKGHV-SECBINFHSA-N 1 2 240.376 2.096 20 0 BEADLO CC[C@H](CSC)Nc1cc(N(C)C)[nH+]cn1 ZINC001333739441 976050171 /nfs/dbraw/zinc/05/01/71/976050171.db2.gz IIJNJMHKYZKGHV-SECBINFHSA-N 1 2 240.376 2.096 20 0 BEADLO CC[NH+]1CC(Oc2cccc(C(C)C)n2)C1 ZINC001228318036 976100522 /nfs/dbraw/zinc/10/05/22/976100522.db2.gz GSNIAFGKFCMKLD-UHFFFAOYSA-N 1 2 220.316 2.288 20 0 BEADLO CCc1cc(N2CC[C@@H](CF)C2)nc(CC)[nH+]1 ZINC001333831166 976111034 /nfs/dbraw/zinc/11/10/34/976111034.db2.gz DIEGWTXLJGRRPN-JTQLQIEISA-N 1 2 237.322 2.397 20 0 BEADLO COC[C@H](C)Oc1ccc2[nH]c(C)[nH+]c2c1 ZINC001228327579 976124034 /nfs/dbraw/zinc/12/40/34/976124034.db2.gz RXORQJNWDAIBGO-QMMMGPOBSA-N 1 2 220.272 2.285 20 0 BEADLO CNc1cc(N[C@H](C)c2cncs2)nc[nH+]1 ZINC001333873842 976137142 /nfs/dbraw/zinc/13/71/42/976137142.db2.gz QYNICHNMZCGXIO-SSDOTTSWSA-N 1 2 235.316 2.148 20 0 BEADLO CNc1cc(N[C@H](C)c2cncs2)[nH+]cn1 ZINC001333873842 976137153 /nfs/dbraw/zinc/13/71/53/976137153.db2.gz QYNICHNMZCGXIO-SSDOTTSWSA-N 1 2 235.316 2.148 20 0 BEADLO CCc1cccc(Nc2cccc(C(N)=O)c2)[nH+]1 ZINC001174058321 976209059 /nfs/dbraw/zinc/20/90/59/976209059.db2.gz DFEBJYUGYPXCLR-UHFFFAOYSA-N 1 2 241.294 2.487 20 0 BEADLO C[C@H](C(=O)NCC1CCC=CCC1)n1cc[nH+]c1 ZINC001334009974 976217101 /nfs/dbraw/zinc/21/71/01/976217101.db2.gz VNSUHHMMGBYAMY-GFCCVEGCSA-N 1 2 247.342 2.307 20 0 BEADLO C[NH+]1CC(Oc2ccccc2N2CCCCC2)C1 ZINC001228540492 976310263 /nfs/dbraw/zinc/31/02/63/976310263.db2.gz JVPJFKNDWAVYCL-UHFFFAOYSA-N 1 2 246.354 2.370 20 0 BEADLO c1cncc(C[NH2+]Cc2nnc(C3CC3)s2)c1 ZINC001334158145 976339583 /nfs/dbraw/zinc/33/95/83/976339583.db2.gz WZQYDPFCJXURLK-UHFFFAOYSA-N 1 2 246.339 2.100 20 0 BEADLO COc1cc[nH+]c(Nc2c(C)n[nH]c2C)c1 ZINC001174213081 976387877 /nfs/dbraw/zinc/38/78/77/976387877.db2.gz IQKOXJJMPFVCAG-UHFFFAOYSA-N 1 2 218.260 2.174 20 0 BEADLO Cc1n[nH]c(C)c1Nc1[nH+]cc(C)cc1N ZINC001174216266 976403418 /nfs/dbraw/zinc/40/34/18/976403418.db2.gz RFIPUAFIUIAUNX-UHFFFAOYSA-N 1 2 217.276 2.056 20 0 BEADLO C[C@H](C(=O)N1CC=CC12CCCC2)n1cc[nH+]c1 ZINC001334253732 976406173 /nfs/dbraw/zinc/40/61/73/976406173.db2.gz RHZVUXGDAYKIFQ-GFCCVEGCSA-N 1 2 245.326 2.155 20 0 BEADLO Cc1cc(OC2C[NH+](C)C2)nc2c(F)cccc12 ZINC001228694424 976440120 /nfs/dbraw/zinc/44/01/20/976440120.db2.gz WXVKUQJMIUNUBJ-UHFFFAOYSA-N 1 2 246.285 2.375 20 0 BEADLO CN(C)c1ccc(Nc2cncc(F)c2)c[nH+]1 ZINC001174288294 976449459 /nfs/dbraw/zinc/44/94/59/976449459.db2.gz AFEQGZAEXAUFLK-UHFFFAOYSA-N 1 2 232.262 2.425 20 0 BEADLO CCc1ccc(C)[nH+]c1Nc1ccc(=O)n(C)c1 ZINC001174353689 976513432 /nfs/dbraw/zinc/51/34/32/976513432.db2.gz GETJQYNXMDNWGZ-UHFFFAOYSA-N 1 2 243.310 2.395 20 0 BEADLO Cc1ccc(C)c(Nc2cnn(C)c2)[nH+]1 ZINC001174329007 976529089 /nfs/dbraw/zinc/52/90/89/976529089.db2.gz XPDHGRFOVIIFRN-UHFFFAOYSA-N 1 2 202.261 2.176 20 0 BEADLO Cc1cc(C)c(Nc2ccc(=O)n(C)c2)c[nH+]1 ZINC001174355566 976596535 /nfs/dbraw/zinc/59/65/35/976596535.db2.gz FLURXHRQCNRSQR-UHFFFAOYSA-N 1 2 229.283 2.141 20 0 BEADLO Cc1c(Nc2c[nH+]c(C)cc2C)cnn1C ZINC001174388542 976641705 /nfs/dbraw/zinc/64/17/05/976641705.db2.gz UEOJSLFUSREBJA-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO COc1cc(Nc2cnn(C)c2C)cc(C)[nH+]1 ZINC001174388870 976643913 /nfs/dbraw/zinc/64/39/13/976643913.db2.gz UJGKRILMMVUSRU-UHFFFAOYSA-N 1 2 232.287 2.184 20 0 BEADLO Nc1ccn(-c2cc[nH+]c3[nH]ccc32)c2nccc1-2 ZINC001174409289 976699366 /nfs/dbraw/zinc/69/93/66/976699366.db2.gz JRVYBALAIQCPSJ-UHFFFAOYSA-N 1 2 249.277 2.387 20 0 BEADLO CCn1cc(Nc2ccn3cc[nH+]c3c2)cn1 ZINC001174568630 976887768 /nfs/dbraw/zinc/88/77/68/976887768.db2.gz ZVRQDQKAXGTUAY-UHFFFAOYSA-N 1 2 227.271 2.294 20 0 BEADLO CCn1cc(-n2c(C)[nH+]c3ccc(N)cc32)cn1 ZINC001174568774 976888907 /nfs/dbraw/zinc/88/89/07/976888907.db2.gz CHDGUNCORXIYMO-UHFFFAOYSA-N 1 2 241.298 2.133 20 0 BEADLO C=CNc1ccc(N2C[C@@H](C)O[C@@H](C)C2)[nH+]c1 ZINC001174780862 976996455 /nfs/dbraw/zinc/99/64/55/976996455.db2.gz ZAQFZZHMRZUCHJ-PHIMTYICSA-N 1 2 233.315 2.251 20 0 BEADLO COC[C@H](C)Oc1ccc(-n2cc[nH+]c2)cc1 ZINC001229949412 977035006 /nfs/dbraw/zinc/03/50/06/977035006.db2.gz AFAZUNIFSGFFGU-NSHDSACASA-N 1 2 232.283 2.286 20 0 BEADLO Fc1cnccc1Nc1ccn2cc[nH+]c2c1 ZINC001175199274 977300510 /nfs/dbraw/zinc/30/05/10/977300510.db2.gz UWCWDURDOOZBKS-UHFFFAOYSA-N 1 2 228.230 2.034 20 0 BEADLO Cc1[nH+]c2ccc(N)cc2n1-c1ccncc1F ZINC001175198955 977300736 /nfs/dbraw/zinc/30/07/36/977300736.db2.gz QIZHFVPUPSJMRJ-UHFFFAOYSA-N 1 2 242.257 2.450 20 0 BEADLO CN(C)c1ccc(Nc2cn(CCF)cn2)c[nH+]1 ZINC001175341319 977361980 /nfs/dbraw/zinc/36/19/80/977361980.db2.gz GASSCSFNHJUXQS-UHFFFAOYSA-N 1 2 249.293 2.057 20 0 BEADLO CN(C)c1ccc(Nc2ccc(O)cc2O)c[nH+]1 ZINC001175341929 977365955 /nfs/dbraw/zinc/36/59/55/977365955.db2.gz NYZFSKRGNYUGKP-UHFFFAOYSA-N 1 2 245.282 2.302 20 0 BEADLO Cc1ncc(Nc2ccc(N(C)C)[nH+]c2)c(C)n1 ZINC001175341095 977385932 /nfs/dbraw/zinc/38/59/32/977385932.db2.gz PFHKNYHLPUHLII-UHFFFAOYSA-N 1 2 243.314 2.298 20 0 BEADLO CCc1cnc(Nc2ccc(N(C)C)[nH+]c2)cn1 ZINC001175338848 977386617 /nfs/dbraw/zinc/38/66/17/977386617.db2.gz NYNFYVZVPGHDAS-UHFFFAOYSA-N 1 2 243.314 2.244 20 0 BEADLO C[NH+]1CC(Oc2cccc(-c3ccccc3)n2)C1 ZINC001230945009 977394733 /nfs/dbraw/zinc/39/47/33/977394733.db2.gz XDJMEBLMRPMVKH-UHFFFAOYSA-N 1 2 240.306 2.441 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(OC2CC(=O)C2)cc1 ZINC001231084188 977473397 /nfs/dbraw/zinc/47/33/97/977473397.db2.gz ZHQZJDZWEHSAFB-UHFFFAOYSA-N 1 2 242.278 2.197 20 0 BEADLO C[N@@H+]1CCCC(=Nc2nc3c(s2)CCC3)C1 ZINC001175574439 977570034 /nfs/dbraw/zinc/57/00/34/977570034.db2.gz WTFOGRHVWBQEGO-UHFFFAOYSA-N 1 2 235.356 2.263 20 0 BEADLO C[N@H+]1CCCC(=Nc2nc3c(s2)CCC3)C1 ZINC001175574439 977570047 /nfs/dbraw/zinc/57/00/47/977570047.db2.gz WTFOGRHVWBQEGO-UHFFFAOYSA-N 1 2 235.356 2.263 20 0 BEADLO Cc1cnc(N=C2CCC[N@@H+](C)C2)c(F)c1 ZINC001175576432 977579327 /nfs/dbraw/zinc/57/93/27/977579327.db2.gz IGJUOMUXIYNCEU-UHFFFAOYSA-N 1 2 221.279 2.160 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1ccc(F)c(C)c1F ZINC001231480612 977604353 /nfs/dbraw/zinc/60/43/53/977604353.db2.gz ZTUDCPHJJZISMR-LLVKDONJSA-N 1 2 241.281 2.494 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1ccc(F)c(C)c1F ZINC001231480612 977604361 /nfs/dbraw/zinc/60/43/61/977604361.db2.gz ZTUDCPHJJZISMR-LLVKDONJSA-N 1 2 241.281 2.494 20 0 BEADLO CCc1ccc(C)[nH+]c1Nc1cnc(N)nc1C ZINC001175663778 977639040 /nfs/dbraw/zinc/63/90/40/977639040.db2.gz MPTVZHJHKYRNIR-UHFFFAOYSA-N 1 2 243.314 2.377 20 0 BEADLO Cc1cc(F)cc(N2CCSC[C@@H]2C)[nH+]1 ZINC001336527177 977746951 /nfs/dbraw/zinc/74/69/51/977746951.db2.gz CYGPECMEEPOIGW-VIFPVBQESA-N 1 2 226.320 2.471 20 0 BEADLO COC1C[NH+](Cc2ccccc2SC)C1 ZINC001231783311 977747435 /nfs/dbraw/zinc/74/74/35/977747435.db2.gz BUUMXUMHRQDAHX-UHFFFAOYSA-N 1 2 223.341 2.239 20 0 BEADLO CC(C)C1(C)CCN(c2cc(N)nc[nH+]2)CC1 ZINC001336581299 977796040 /nfs/dbraw/zinc/79/60/40/977796040.db2.gz BDMFTFTYALMUFJ-UHFFFAOYSA-N 1 2 234.347 2.321 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccno2)cnc1F ZINC001231931610 977804270 /nfs/dbraw/zinc/80/42/70/977804270.db2.gz ZFFXQBFRDJTBQO-UHFFFAOYSA-N 1 2 235.262 2.149 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccno2)cnc1F ZINC001231931610 977804279 /nfs/dbraw/zinc/80/42/79/977804279.db2.gz ZFFXQBFRDJTBQO-UHFFFAOYSA-N 1 2 235.262 2.149 20 0 BEADLO COc1ccnc(C[N@H+](C)Cc2ccncc2)c1 ZINC001231966339 977813080 /nfs/dbraw/zinc/81/30/80/977813080.db2.gz CFRDYJSOIQVWSF-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1ccnc(C[N@@H+](C)Cc2ccncc2)c1 ZINC001231966339 977813086 /nfs/dbraw/zinc/81/30/86/977813086.db2.gz CFRDYJSOIQVWSF-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1ccnc(C[N@@H+]2CCCC[C@H](F)C2)c1 ZINC001231967204 977815878 /nfs/dbraw/zinc/81/58/78/977815878.db2.gz VOPHBHBTFNBCRI-NSHDSACASA-N 1 2 238.306 2.414 20 0 BEADLO COc1ccnc(C[N@H+]2CCCC[C@H](F)C2)c1 ZINC001231967204 977815886 /nfs/dbraw/zinc/81/58/86/977815886.db2.gz VOPHBHBTFNBCRI-NSHDSACASA-N 1 2 238.306 2.414 20 0 BEADLO Cc1cc(F)cc(N2CC[C@@H](n3cccn3)C2)[nH+]1 ZINC001336635608 977823536 /nfs/dbraw/zinc/82/35/36/977823536.db2.gz AWYFVCAETBRDAV-GFCCVEGCSA-N 1 2 246.289 2.177 20 0 BEADLO C[N@H+](Cc1cc(Cl)cnc1F)[C@@H]1CCOC1 ZINC001231993914 977826026 /nfs/dbraw/zinc/82/60/26/977826026.db2.gz YNYPXFLTKKTGTE-SNVBAGLBSA-N 1 2 244.697 2.095 20 0 BEADLO C[N@@H+](Cc1cc(Cl)cnc1F)[C@@H]1CCOC1 ZINC001231993914 977826033 /nfs/dbraw/zinc/82/60/33/977826033.db2.gz YNYPXFLTKKTGTE-SNVBAGLBSA-N 1 2 244.697 2.095 20 0 BEADLO CO[C@H]1CCN(c2cc(F)cc(C)[nH+]2)C[C@H]1C ZINC001336649730 977830602 /nfs/dbraw/zinc/83/06/02/977830602.db2.gz WYMYMGAZDIJZNT-SKDRFNHKSA-N 1 2 238.306 2.390 20 0 BEADLO C[C@@]1(F)CCC[N@H+](Cc2cncc(O)c2)C1 ZINC001232039851 977866823 /nfs/dbraw/zinc/86/68/23/977866823.db2.gz YEZFNWIFGCHJJX-GFCCVEGCSA-N 1 2 224.279 2.111 20 0 BEADLO C[C@@]1(F)CCC[N@@H+](Cc2cncc(O)c2)C1 ZINC001232039851 977866830 /nfs/dbraw/zinc/86/68/30/977866830.db2.gz YEZFNWIFGCHJJX-GFCCVEGCSA-N 1 2 224.279 2.111 20 0 BEADLO CCC[C@@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC001336703313 977869020 /nfs/dbraw/zinc/86/90/20/977869020.db2.gz JPNCHVSOUWMXNB-IJLUTSLNSA-N 1 2 247.342 2.304 20 0 BEADLO CCC[C@@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC001336703313 977869026 /nfs/dbraw/zinc/86/90/26/977869026.db2.gz JPNCHVSOUWMXNB-IJLUTSLNSA-N 1 2 247.342 2.304 20 0 BEADLO Cn1nc(C(F)F)c(C[NH+](C)C)c1Cl ZINC001232052562 977873349 /nfs/dbraw/zinc/87/33/49/977873349.db2.gz UFKFRZKJMICDCH-UHFFFAOYSA-N 1 2 223.654 2.073 20 0 BEADLO Fc1nc(F)c(F)c(Nc2[nH]cc[nH+]2)c1F ZINC001176079100 977873874 /nfs/dbraw/zinc/87/38/74/977873874.db2.gz GHEBEZCMXUBMRD-UHFFFAOYSA-N 1 2 232.140 2.105 20 0 BEADLO Cc1cc2c(ccc(N)c2F)n1-c1[nH]cc[nH+]1 ZINC001176085316 977887336 /nfs/dbraw/zinc/88/73/36/977887336.db2.gz KUMWORDSNQLWMY-UHFFFAOYSA-N 1 2 230.246 2.383 20 0 BEADLO F[C@H]1CSC2(C[NH+](Cc3ccns3)C2)C1 ZINC001232192528 977919314 /nfs/dbraw/zinc/91/93/14/977919314.db2.gz MVTHJOZLXQNYBA-MRVPVSSYSA-N 1 2 244.360 2.173 20 0 BEADLO Fc1ccc(C2C[NH+](Cc3ccon3)C2)cc1 ZINC001336755771 977921768 /nfs/dbraw/zinc/92/17/68/977921768.db2.gz WZMOYKSRGRWYBH-UHFFFAOYSA-N 1 2 232.258 2.413 20 0 BEADLO CCOc1cc[nH+]cc1NC1=CCOCC1 ZINC001176140546 977924195 /nfs/dbraw/zinc/92/41/95/977924195.db2.gz JIAWFCDKFVKJNP-UHFFFAOYSA-N 1 2 220.272 2.196 20 0 BEADLO COc1cc[nH+]cc1Nc1ncccc1F ZINC001176117174 977943957 /nfs/dbraw/zinc/94/39/57/977943957.db2.gz UVTWTUFIAUTFCE-UHFFFAOYSA-N 1 2 219.219 2.368 20 0 BEADLO CCc1cnc(Nc2c[nH+]ccc2OC)cn1 ZINC001176117114 977944629 /nfs/dbraw/zinc/94/46/29/977944629.db2.gz RQZIDBRDYZZHIW-UHFFFAOYSA-N 1 2 230.271 2.186 20 0 BEADLO COc1cc[nH+]cc1Nc1cnc(C)c(C)n1 ZINC001176118424 977947377 /nfs/dbraw/zinc/94/73/77/977947377.db2.gz KLIQJJVFQXUWTQ-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO COc1cc[nH+]cc1Nc1cccc(F)n1 ZINC001176116409 977947617 /nfs/dbraw/zinc/94/76/17/977947617.db2.gz BTUBNCHEACPFME-UHFFFAOYSA-N 1 2 219.219 2.368 20 0 BEADLO COc1cc[nH+]cc1Nc1cnc(F)cc1OC ZINC001176120996 977948865 /nfs/dbraw/zinc/94/88/65/977948865.db2.gz DDOQPZRPKDMKIT-UHFFFAOYSA-N 1 2 249.245 2.377 20 0 BEADLO COc1cc[nH+]cc1Nc1onc(C)c1C ZINC001176119215 977950917 /nfs/dbraw/zinc/95/09/17/977950917.db2.gz OOOZDLOMZPWRLK-UHFFFAOYSA-N 1 2 219.244 2.439 20 0 BEADLO COc1cc[nH+]cc1Nc1cc([C@H](C)O)ccn1 ZINC001176121960 977958270 /nfs/dbraw/zinc/95/82/70/977958270.db2.gz VGSYNRAFCXDHCU-VIFPVBQESA-N 1 2 245.282 2.282 20 0 BEADLO CCOc1ccc(C[N@H+](C)CCF)c(C)n1 ZINC001232314621 977986283 /nfs/dbraw/zinc/98/62/83/977986283.db2.gz CLXXNCJWXIQJFX-UHFFFAOYSA-N 1 2 226.295 2.190 20 0 BEADLO CCOc1ccc(C[N@@H+](C)CCF)c(C)n1 ZINC001232314621 977986293 /nfs/dbraw/zinc/98/62/93/977986293.db2.gz CLXXNCJWXIQJFX-UHFFFAOYSA-N 1 2 226.295 2.190 20 0 BEADLO CC[N@H+](Cc1ccc(SC)nc1)C1COC1 ZINC001232330815 978004360 /nfs/dbraw/zinc/00/43/60/978004360.db2.gz AGISTSGRYKGAKA-UHFFFAOYSA-N 1 2 238.356 2.024 20 0 BEADLO CC[N@@H+](Cc1ccc(SC)nc1)C1COC1 ZINC001232330815 978004362 /nfs/dbraw/zinc/00/43/62/978004362.db2.gz AGISTSGRYKGAKA-UHFFFAOYSA-N 1 2 238.356 2.024 20 0 BEADLO COc1ccc(C[N@@H+]2CCC[C@H](F)C2)c(C)n1 ZINC001232332949 978009076 /nfs/dbraw/zinc/00/90/76/978009076.db2.gz LTBHOQXFKHFNER-LBPRGKRZSA-N 1 2 238.306 2.333 20 0 BEADLO COc1ccc(C[N@H+]2CCC[C@H](F)C2)c(C)n1 ZINC001232332949 978009081 /nfs/dbraw/zinc/00/90/81/978009081.db2.gz LTBHOQXFKHFNER-LBPRGKRZSA-N 1 2 238.306 2.333 20 0 BEADLO CSc1cc(C)c(C[N@H+](C)CC(C)=O)cn1 ZINC001232342774 978025626 /nfs/dbraw/zinc/02/56/26/978025626.db2.gz SHBJNJBYEWVSJB-UHFFFAOYSA-N 1 2 238.356 2.133 20 0 BEADLO CSc1cc(C)c(C[N@@H+](C)CC(C)=O)cn1 ZINC001232342774 978025628 /nfs/dbraw/zinc/02/56/28/978025628.db2.gz SHBJNJBYEWVSJB-UHFFFAOYSA-N 1 2 238.356 2.133 20 0 BEADLO Cc1ncc(Nc2[nH+]c3ccccc3n2C)cn1 ZINC001176392061 978044157 /nfs/dbraw/zinc/04/41/57/978044157.db2.gz BQXNJMNGFMQVQN-UHFFFAOYSA-N 1 2 239.282 2.415 20 0 BEADLO C[C@@]1(F)CCC[N@H+](Cc2[nH]nc3c2CCC3)C1 ZINC001232424659 978058880 /nfs/dbraw/zinc/05/88/80/978058880.db2.gz KPPMSAAESVRYAS-CYBMUJFWSA-N 1 2 237.322 2.222 20 0 BEADLO C[C@@]1(F)CCC[N@@H+](Cc2[nH]nc3c2CCC3)C1 ZINC001232424659 978058892 /nfs/dbraw/zinc/05/88/92/978058892.db2.gz KPPMSAAESVRYAS-CYBMUJFWSA-N 1 2 237.322 2.222 20 0 BEADLO Cc1[nH+]c2ccc(N)cc2n1-c1cnc(C)nc1 ZINC001176395283 978070654 /nfs/dbraw/zinc/07/06/54/978070654.db2.gz OQRKSFSSGPMZFN-UHFFFAOYSA-N 1 2 239.282 2.015 20 0 BEADLO c1cc2c(o1)CC[N@@H+](Cc1[nH]nc3c1CCC3)C2 ZINC001232430775 978072275 /nfs/dbraw/zinc/07/22/75/978072275.db2.gz DSNHSHSXQBGHGJ-UHFFFAOYSA-N 1 2 243.310 2.050 20 0 BEADLO c1cc2c(o1)CC[N@H+](Cc1[nH]nc3c1CCC3)C2 ZINC001232430775 978072290 /nfs/dbraw/zinc/07/22/90/978072290.db2.gz DSNHSHSXQBGHGJ-UHFFFAOYSA-N 1 2 243.310 2.050 20 0 BEADLO Cc1cc(F)cc(N2CCCSCC2)[nH+]1 ZINC001336982536 978106641 /nfs/dbraw/zinc/10/66/41/978106641.db2.gz HDEOMUUYWGUODZ-UHFFFAOYSA-N 1 2 226.320 2.472 20 0 BEADLO Cc1[nH]c(CN(C)Cc2cccnc2C)c[nH+]1 ZINC001232464828 978112046 /nfs/dbraw/zinc/11/20/46/978112046.db2.gz DXEJTRQDFCBYOZ-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1ncc(C[NH+]2CC3(C2)CCCCC3)[nH]1 ZINC001232464637 978112314 /nfs/dbraw/zinc/11/23/14/978112314.db2.gz JQDSLRMQVYADHM-UHFFFAOYSA-N 1 2 219.332 2.484 20 0 BEADLO Cc1nc(C[NH+]2CC3(C2)CCCCC3)c[nH]1 ZINC001232464637 978112317 /nfs/dbraw/zinc/11/23/17/978112317.db2.gz JQDSLRMQVYADHM-UHFFFAOYSA-N 1 2 219.332 2.484 20 0 BEADLO COc1ccc(O)cc1Nc1[nH+]cc(C)cc1N ZINC001176573682 978130903 /nfs/dbraw/zinc/13/09/03/978130903.db2.gz DRBMNDUHSVHSTP-UHFFFAOYSA-N 1 2 245.282 2.430 20 0 BEADLO Cc1cccc(F)c1C[N@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC001232482104 978135883 /nfs/dbraw/zinc/13/58/83/978135883.db2.gz NTBUCXSIXODIFQ-TXEJJXNPSA-N 1 2 235.302 2.497 20 0 BEADLO Cc1cccc(F)c1C[N@@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC001232482104 978135887 /nfs/dbraw/zinc/13/58/87/978135887.db2.gz NTBUCXSIXODIFQ-TXEJJXNPSA-N 1 2 235.302 2.497 20 0 BEADLO Fc1ccnc(C[NH+]2CCC(F)(F)CC2)c1 ZINC001232491746 978142340 /nfs/dbraw/zinc/14/23/40/978142340.db2.gz YJYAXIONVSYTHG-UHFFFAOYSA-N 1 2 230.233 2.452 20 0 BEADLO C[N@H+](Cc1ccncc1)Cc1cc(F)ccn1 ZINC001232491367 978144734 /nfs/dbraw/zinc/14/47/34/978144734.db2.gz YMZDFTXXKJDCCR-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[N@@H+](Cc1ccncc1)Cc1cc(F)ccn1 ZINC001232491367 978144740 /nfs/dbraw/zinc/14/47/40/978144740.db2.gz YMZDFTXXKJDCCR-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[C@H]1C[NH+](Cc2cccc(CF)n2)C[C@H](C)O1 ZINC001232531475 978163681 /nfs/dbraw/zinc/16/36/81/978163681.db2.gz BKERJDAQFTVSSK-QWRGUYRKSA-N 1 2 238.306 2.160 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1cc2ccoc2cn1 ZINC001232553656 978177235 /nfs/dbraw/zinc/17/72/35/978177235.db2.gz BFAVUPOULUBNRK-ZDUSSCGKSA-N 1 2 246.310 2.439 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1cc2ccoc2cn1 ZINC001232553656 978177243 /nfs/dbraw/zinc/17/72/43/978177243.db2.gz BFAVUPOULUBNRK-ZDUSSCGKSA-N 1 2 246.310 2.439 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)Cc2c[nH]c[nH+]2)CC(C)(C)C1 ZINC001176836862 978207763 /nfs/dbraw/zinc/20/77/63/978207763.db2.gz RBWQWVOBGSFCIJ-GHMZBOCLSA-N 1 2 249.358 2.283 20 0 BEADLO CCc1ccc(N2CCC[C@](O)(CC)C2)[nH+]c1 ZINC001337237746 978235121 /nfs/dbraw/zinc/23/51/21/978235121.db2.gz COTTVOMRUGNQOV-CQSZACIVSA-N 1 2 234.343 2.385 20 0 BEADLO C[C@@H]1CCC(F)(F)CN1Cc1c[nH+]cn1C ZINC001176899265 978256905 /nfs/dbraw/zinc/25/69/05/978256905.db2.gz YDHDTHOLWMFKKS-SECBINFHSA-N 1 2 229.274 2.040 20 0 BEADLO CCc1[nH]c(CNC(=O)C=C2CCCC2)c[nH+]1 ZINC001597250766 978304160 /nfs/dbraw/zinc/30/41/60/978304160.db2.gz JNJMBXDQESGDHT-UHFFFAOYSA-N 1 2 233.315 2.089 20 0 BEADLO CCc1[nH]cc(CNC(=O)C=C2CCCC2)[nH+]1 ZINC001597250766 978304176 /nfs/dbraw/zinc/30/41/76/978304176.db2.gz JNJMBXDQESGDHT-UHFFFAOYSA-N 1 2 233.315 2.089 20 0 BEADLO CCC[C@@H](C)C(=O)Nc1c(C)c[nH+]cc1C ZINC001337509331 978380081 /nfs/dbraw/zinc/38/00/81/978380081.db2.gz LPAFWOGUCOOTFP-SECBINFHSA-N 1 2 220.316 2.495 20 0 BEADLO Cc1ncc(F)cc1C[NH+]1CC(C(F)F)C1 ZINC001232991545 978392415 /nfs/dbraw/zinc/39/24/15/978392415.db2.gz DCBHXKVYEQNULS-UHFFFAOYSA-N 1 2 230.233 2.226 20 0 BEADLO C[C@H](CC(=O)N1CC[C@@H]1C(C)(C)C)n1cc[nH+]c1 ZINC001337663512 978441076 /nfs/dbraw/zinc/44/10/76/978441076.db2.gz ZIHMIEIAJPOOQS-VXGBXAGGSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1cccc(O)c1F ZINC001233050209 978441435 /nfs/dbraw/zinc/44/14/35/978441435.db2.gz MOQXPXRJAWYMFH-PSASIEDQSA-N 1 2 227.254 2.464 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1cccc(O)c1F ZINC001233050209 978441444 /nfs/dbraw/zinc/44/14/44/978441444.db2.gz MOQXPXRJAWYMFH-PSASIEDQSA-N 1 2 227.254 2.464 20 0 BEADLO C[C@H](C(=O)Nc1ccsc1)n1cc[nH+]c1 ZINC001177921966 978472979 /nfs/dbraw/zinc/47/29/79/978472979.db2.gz NJQCMHILPHHHGS-MRVPVSSYSA-N 1 2 221.285 2.144 20 0 BEADLO Cc1ccc(NC(=O)[C@@H](C)n2cc[nH+]c2)cc1O ZINC001177925689 978476180 /nfs/dbraw/zinc/47/61/80/978476180.db2.gz OHPKYZZNSMHNHY-SNVBAGLBSA-N 1 2 245.282 2.097 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1cnc(C)c(C)c1 ZINC001233161193 978480846 /nfs/dbraw/zinc/48/08/46/978480846.db2.gz WFNGPCDEKFBIFM-AWEZNQCLSA-N 1 2 234.343 2.309 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1cnc(C)c(C)c1 ZINC001233161193 978480849 /nfs/dbraw/zinc/48/08/49/978480849.db2.gz WFNGPCDEKFBIFM-AWEZNQCLSA-N 1 2 234.343 2.309 20 0 BEADLO Cc1ccc(C[N@@H+]2CCCC(=O)CC2)cc1O ZINC001233228379 978499499 /nfs/dbraw/zinc/49/94/99/978499499.db2.gz ADETZXBQMANNQI-UHFFFAOYSA-N 1 2 233.311 2.256 20 0 BEADLO Cc1ccc(C[N@H+]2CCCC(=O)CC2)cc1O ZINC001233228379 978499505 /nfs/dbraw/zinc/49/95/05/978499505.db2.gz ADETZXBQMANNQI-UHFFFAOYSA-N 1 2 233.311 2.256 20 0 BEADLO C[C@@H](C(=O)N1CC[C@@H](C)C[C@@H](C)C1)n1cc[nH+]c1 ZINC001178127883 978514082 /nfs/dbraw/zinc/51/40/82/978514082.db2.gz ZDQISWRLDFUHLU-UPJWGTAASA-N 1 2 249.358 2.339 20 0 BEADLO CO[C@@H]1CN(c2cc(F)cc(C)[nH+]2)CC[C@H]1C ZINC001337844709 978523228 /nfs/dbraw/zinc/52/32/28/978523228.db2.gz DQQKZVZAFDIVPY-BXKDBHETSA-N 1 2 238.306 2.390 20 0 BEADLO C[N@H+](Cc1ccon1)Cc1cccc2c1CCO2 ZINC001233276847 978524198 /nfs/dbraw/zinc/52/41/98/978524198.db2.gz CRYHYWLMQADANM-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO C[N@@H+](Cc1ccon1)Cc1cccc2c1CCO2 ZINC001233276847 978524204 /nfs/dbraw/zinc/52/42/04/978524204.db2.gz CRYHYWLMQADANM-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3ncccc3C2)sn1 ZINC001233312512 978538304 /nfs/dbraw/zinc/53/83/04/978538304.db2.gz WNLBACVFRWVNDP-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cc(C[N@H+]2CCc3ncccc3C2)sn1 ZINC001233312512 978538314 /nfs/dbraw/zinc/53/83/14/978538314.db2.gz WNLBACVFRWVNDP-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Fc1cnccc1N1CCC(c2c[nH]c[nH+]2)CC1 ZINC001337885660 978548185 /nfs/dbraw/zinc/54/81/85/978548185.db2.gz WEIPVYMYQHNZCT-UHFFFAOYSA-N 1 2 246.289 2.328 20 0 BEADLO Cc1cnsc1C[N@@H+]1CCc2ncccc2C1 ZINC001233320631 978554416 /nfs/dbraw/zinc/55/44/16/978554416.db2.gz HJVNOOGMBAPYJN-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cnsc1C[N@H+]1CCc2ncccc2C1 ZINC001233320631 978554423 /nfs/dbraw/zinc/55/44/23/978554423.db2.gz HJVNOOGMBAPYJN-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO CC1C[NH+](Cc2cnc3cccc(Cl)n23)C1 ZINC001233355833 978571532 /nfs/dbraw/zinc/57/15/32/978571532.db2.gz OBVOFMVMRMEMCS-UHFFFAOYSA-N 1 2 235.718 2.439 20 0 BEADLO CC=C(C)C(=O)Nc1c(C)c[nH+]cc1C ZINC001338241963 978638676 /nfs/dbraw/zinc/63/86/76/978638676.db2.gz JKQHELOAKVFTKR-VMPITWQZSA-N 1 2 204.273 2.025 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H]1CC[C@@H](C)C1 ZINC001338243444 978644955 /nfs/dbraw/zinc/64/49/55/978644955.db2.gz OMSUDWAKPRIHJN-BXKDBHETSA-N 1 2 232.327 2.495 20 0 BEADLO OCc1cc[nH+]c(NCc2cccs2)c1 ZINC001178992295 978658561 /nfs/dbraw/zinc/65/85/61/978658561.db2.gz MVNALSFYRPTVGG-UHFFFAOYSA-N 1 2 220.297 2.248 20 0 BEADLO CCC1(C(=O)NCCOc2cc[nH+]cc2)CCC1 ZINC001179027206 978660863 /nfs/dbraw/zinc/66/08/63/978660863.db2.gz UVLJLOZXYZDVBL-UHFFFAOYSA-N 1 2 248.326 2.157 20 0 BEADLO Cc1c(OC2C[NH+](C)C2)cnc2ccccc21 ZINC001233724991 978679879 /nfs/dbraw/zinc/67/98/79/978679879.db2.gz KCRWIIASKWUMNZ-UHFFFAOYSA-N 1 2 228.295 2.236 20 0 BEADLO c1cc(C[N@@H+]2CCc3ncccc3C2)co1 ZINC001204242802 978696874 /nfs/dbraw/zinc/69/68/74/978696874.db2.gz ANJLCDSKRIZSER-UHFFFAOYSA-N 1 2 214.268 2.233 20 0 BEADLO c1cc(C[N@H+]2CCc3ncccc3C2)co1 ZINC001204242802 978696875 /nfs/dbraw/zinc/69/68/75/978696875.db2.gz ANJLCDSKRIZSER-UHFFFAOYSA-N 1 2 214.268 2.233 20 0 BEADLO Cc1cn(C)nc1CNc1c[nH+]c(C)c(C)c1 ZINC001179453094 978707230 /nfs/dbraw/zinc/70/72/30/978707230.db2.gz APJYMFMCVULZHY-UHFFFAOYSA-N 1 2 230.315 2.352 20 0 BEADLO Cc1nocc1NCc1cccc2[nH+]ccn21 ZINC001179478499 978708964 /nfs/dbraw/zinc/70/89/64/978708964.db2.gz CLUXILUCAJIAGA-UHFFFAOYSA-N 1 2 228.255 2.243 20 0 BEADLO CC[NH+]1CC(Oc2cccc(OC(F)F)c2)C1 ZINC001233964353 978741260 /nfs/dbraw/zinc/74/12/60/978741260.db2.gz XQKNWBKRTWVQEB-UHFFFAOYSA-N 1 2 243.253 2.371 20 0 BEADLO CC(C)c1ccccc1C[NH2+]Cc1nnc[nH]1 ZINC001179842632 978763481 /nfs/dbraw/zinc/76/34/81/978763481.db2.gz QYOFUXKKCJNSJG-UHFFFAOYSA-N 1 2 230.315 2.218 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H]1CC[C@H]2C[C@H]2C1 ZINC001338987428 978765658 /nfs/dbraw/zinc/76/56/58/978765658.db2.gz MRTLHCKAOOSOBB-XQQFMLRXSA-N 1 2 244.338 2.495 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC001338987426 978766002 /nfs/dbraw/zinc/76/60/02/978766002.db2.gz MRTLHCKAOOSOBB-JHJVBQTASA-N 1 2 244.338 2.495 20 0 BEADLO CCCCOC1C[NH+](Cc2ccc(CO)cc2)C1 ZINC001203187561 978801495 /nfs/dbraw/zinc/80/14/95/978801495.db2.gz ABCQSBLGVPQTOL-UHFFFAOYSA-N 1 2 249.354 2.180 20 0 BEADLO CC(C)=CCc1cc[nH+]c(N2CCOCC2)c1 ZINC001249953140 978809292 /nfs/dbraw/zinc/80/92/92/978809292.db2.gz JOLUTOUHKUCUJA-UHFFFAOYSA-N 1 2 232.327 2.427 20 0 BEADLO CCOC(=N)c1ccc(OC2C[NH+](CC)C2)cc1 ZINC001234584798 978864126 /nfs/dbraw/zinc/86/41/26/978864126.db2.gz KIZYYJPHOABEGM-UHFFFAOYSA-N 1 2 248.326 2.131 20 0 BEADLO CCC[C@H](C)[C@H]1CCCN1c1cc(N)nc[nH+]1 ZINC001339629166 978882066 /nfs/dbraw/zinc/88/20/66/978882066.db2.gz ONHBBXGFFFZFTN-WDEREUQCSA-N 1 2 234.347 2.464 20 0 BEADLO CCCCc1ccc(N2CCOCC2)[nH+]c1 ZINC001249975585 978897351 /nfs/dbraw/zinc/89/73/51/978897351.db2.gz KWMZVBSMWVUDMP-UHFFFAOYSA-N 1 2 220.316 2.261 20 0 BEADLO C[C@]1(F)CCC[N@H+](Cc2ncc(F)cn2)CC1 ZINC001235004566 978947646 /nfs/dbraw/zinc/94/76/46/978947646.db2.gz KUIBTMHOPARKCV-LBPRGKRZSA-N 1 2 241.285 2.330 20 0 BEADLO C[C@]1(F)CCC[N@@H+](Cc2ncc(F)cn2)CC1 ZINC001235004566 978947652 /nfs/dbraw/zinc/94/76/52/978947652.db2.gz KUIBTMHOPARKCV-LBPRGKRZSA-N 1 2 241.285 2.330 20 0 BEADLO CCc1cccc(C[N@@H+]2CCOC(C)(C)C2)n1 ZINC001235250573 979007449 /nfs/dbraw/zinc/00/74/49/979007449.db2.gz LKVAVAHDPUAFTA-UHFFFAOYSA-N 1 2 234.343 2.255 20 0 BEADLO CCc1cccc(C[N@H+]2CCOC(C)(C)C2)n1 ZINC001235250573 979007456 /nfs/dbraw/zinc/00/74/56/979007456.db2.gz LKVAVAHDPUAFTA-UHFFFAOYSA-N 1 2 234.343 2.255 20 0 BEADLO CCc1cccc(C[N@@H+]2C[C@@H](C)OC[C@H]2C)n1 ZINC001235265076 979013329 /nfs/dbraw/zinc/01/33/29/979013329.db2.gz RCAVPGLARYQOMM-VXGBXAGGSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1cccc(C[N@H+]2C[C@@H](C)OC[C@H]2C)n1 ZINC001235265076 979013336 /nfs/dbraw/zinc/01/33/36/979013336.db2.gz RCAVPGLARYQOMM-VXGBXAGGSA-N 1 2 234.343 2.253 20 0 BEADLO CC[N@H+](C)Cc1cncc(F)c1Cl ZINC001235493736 979056931 /nfs/dbraw/zinc/05/69/31/979056931.db2.gz WAZUQJNZIIIHEC-UHFFFAOYSA-N 1 2 202.660 2.326 20 0 BEADLO CC[N@@H+](C)Cc1cncc(F)c1Cl ZINC001235493736 979056937 /nfs/dbraw/zinc/05/69/37/979056937.db2.gz WAZUQJNZIIIHEC-UHFFFAOYSA-N 1 2 202.660 2.326 20 0 BEADLO Cc1ccnc(C[N@@H+](C)[C@@H]2CCOC2)c1Cl ZINC001235586820 979096671 /nfs/dbraw/zinc/09/66/71/979096671.db2.gz WXJKZSOORXOLJJ-SNVBAGLBSA-N 1 2 240.734 2.264 20 0 BEADLO Cc1ccnc(C[N@H+](C)[C@@H]2CCOC2)c1Cl ZINC001235586820 979096678 /nfs/dbraw/zinc/09/66/78/979096678.db2.gz WXJKZSOORXOLJJ-SNVBAGLBSA-N 1 2 240.734 2.264 20 0 BEADLO COCC1C[NH+](Cc2nccc(C)c2Cl)C1 ZINC001235575478 979099615 /nfs/dbraw/zinc/09/96/15/979099615.db2.gz GEHCZDZJFFOQTP-UHFFFAOYSA-N 1 2 240.734 2.122 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)C[C@@H](C)C1CC1 ZINC001340811422 979116074 /nfs/dbraw/zinc/11/60/74/979116074.db2.gz XYSPFPCKAAUUDG-SECBINFHSA-N 1 2 232.327 2.495 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC[C@H]1CCCC[C@@H]1C ZINC001603422079 979455347 /nfs/dbraw/zinc/45/53/47/979455347.db2.gz MNTJYBGFHSCHIW-CMPLNLGQSA-N 1 2 249.358 2.203 20 0 BEADLO Cc1ccc(Cl)c(C[N@H+](C)CCO)c1F ZINC001236253091 979472549 /nfs/dbraw/zinc/47/25/49/979472549.db2.gz FEJZUGNFQUQSSJ-UHFFFAOYSA-N 1 2 231.698 2.212 20 0 BEADLO Cc1ccc(Cl)c(C[N@@H+](C)CCO)c1F ZINC001236253091 979472554 /nfs/dbraw/zinc/47/25/54/979472554.db2.gz FEJZUGNFQUQSSJ-UHFFFAOYSA-N 1 2 231.698 2.212 20 0 BEADLO Nc1ccc(-c2ccc3cncnc3c2)c[nH+]1 ZINC001236312539 979516134 /nfs/dbraw/zinc/51/61/34/979516134.db2.gz RNBQMDUGGMGGFE-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO Cc1cn2cc(-c3ccc(N)nc3)ccc2[nH+]1 ZINC001236313295 979522361 /nfs/dbraw/zinc/52/23/61/979522361.db2.gz MGCHNYDMHFDBEC-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO Cc1cccc(O)c1NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001341944751 979598533 /nfs/dbraw/zinc/59/85/33/979598533.db2.gz IWNNIEANORJWTG-JTQLQIEISA-N 1 2 245.282 2.097 20 0 BEADLO Cc1cc(C)c(NC(=O)[C@@H]2CC[N@H+]2C(C)C)cn1 ZINC001182828287 979652216 /nfs/dbraw/zinc/65/22/16/979652216.db2.gz BQRPMXYHLLIHTE-ZDUSSCGKSA-N 1 2 247.342 2.120 20 0 BEADLO Cc1cc(C)c(NC(=O)[C@@H]2CC[N@@H+]2C(C)C)cn1 ZINC001182828287 979652232 /nfs/dbraw/zinc/65/22/32/979652232.db2.gz BQRPMXYHLLIHTE-ZDUSSCGKSA-N 1 2 247.342 2.120 20 0 BEADLO COc1cc(C[NH+]2CC=CC2)c(F)cc1F ZINC001236816850 979747588 /nfs/dbraw/zinc/74/75/88/979747588.db2.gz HRFMJTPVVUPVNG-UHFFFAOYSA-N 1 2 225.238 2.345 20 0 BEADLO CC1(O)C[NH+](Cc2ccc(F)c3ccoc32)C1 ZINC001236891911 979783648 /nfs/dbraw/zinc/78/36/48/979783648.db2.gz XFOJQWVKECJDQP-UHFFFAOYSA-N 1 2 235.258 2.139 20 0 BEADLO CCC[NH+]1CCN(CC2OC=CC2=S)CC1 ZINC001237193050 979842404 /nfs/dbraw/zinc/84/24/04/979842404.db2.gz WOPBUVRFZVEMCU-UHFFFAOYSA-N 1 2 240.372 2.096 20 0 BEADLO Oc1cc(F)cc(C[NH+]2CC3(CSC3)C2)c1 ZINC001237285766 979862465 /nfs/dbraw/zinc/86/24/65/979862465.db2.gz AGAJMPJDEFZXST-UHFFFAOYSA-N 1 2 239.315 2.080 20 0 BEADLO CCOC1C[NH+](Cc2cccc(C)c2OC)C1 ZINC001237500360 979921680 /nfs/dbraw/zinc/92/16/80/979921680.db2.gz JTLXOAUORNBPRD-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO Cc1coc(C[N@@H+]2C[C@@H](C)C[C@H]2CF)n1 ZINC001237635699 979980172 /nfs/dbraw/zinc/98/01/72/979980172.db2.gz RRRYYNXIKDQMGZ-WPRPVWTQSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1coc(C[N@H+]2C[C@@H](C)C[C@H]2CF)n1 ZINC001237635699 979980184 /nfs/dbraw/zinc/98/01/84/979980184.db2.gz RRRYYNXIKDQMGZ-WPRPVWTQSA-N 1 2 212.268 2.163 20 0 BEADLO CCc1n[nH]cc1C[N@@H+]1CCn2cccc2[C@H]1C ZINC001237653054 980011033 /nfs/dbraw/zinc/01/10/33/980011033.db2.gz BCTMQMMHEGXZSW-LLVKDONJSA-N 1 2 244.342 2.350 20 0 BEADLO CCc1n[nH]cc1C[N@H+]1CCn2cccc2[C@H]1C ZINC001237653054 980011045 /nfs/dbraw/zinc/01/10/45/980011045.db2.gz BCTMQMMHEGXZSW-LLVKDONJSA-N 1 2 244.342 2.350 20 0 BEADLO CCc1[nH]ncc1C[N@@H+]1CCC[C@H](C(F)F)C1 ZINC001237651846 980016144 /nfs/dbraw/zinc/01/61/44/980016144.db2.gz ZQTUHJYBUYHYBT-VIFPVBQESA-N 1 2 243.301 2.449 20 0 BEADLO CCc1[nH]ncc1C[N@H+]1CCC[C@H](C(F)F)C1 ZINC001237651846 980016149 /nfs/dbraw/zinc/01/61/49/980016149.db2.gz ZQTUHJYBUYHYBT-VIFPVBQESA-N 1 2 243.301 2.449 20 0 BEADLO CCc1n[nH]cc1C[N@@H+]1CCc2occc2C1 ZINC001237657594 980019060 /nfs/dbraw/zinc/01/90/60/980019060.db2.gz GRJNHNRFSJOYNI-UHFFFAOYSA-N 1 2 231.299 2.123 20 0 BEADLO CCc1n[nH]cc1C[N@H+]1CCc2occc2C1 ZINC001237657594 980019068 /nfs/dbraw/zinc/01/90/68/980019068.db2.gz GRJNHNRFSJOYNI-UHFFFAOYSA-N 1 2 231.299 2.123 20 0 BEADLO CN(C)c1cc(N[C@H]2CCC[C@H](F)C2)[nH+]cn1 ZINC001343153662 980024090 /nfs/dbraw/zinc/02/40/90/980024090.db2.gz JIOJBQRATASHPA-UWVGGRQHSA-N 1 2 238.310 2.235 20 0 BEADLO CN(C)c1cc(N[C@H]2CCC[C@H](F)C2)nc[nH+]1 ZINC001343153662 980024099 /nfs/dbraw/zinc/02/40/99/980024099.db2.gz JIOJBQRATASHPA-UWVGGRQHSA-N 1 2 238.310 2.235 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H](F)C[C@H]2C)ccc1F ZINC001237815853 980064851 /nfs/dbraw/zinc/06/48/51/980064851.db2.gz YMKQBQSMDAFZAU-PSASIEDQSA-N 1 2 226.270 2.461 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H](F)C[C@H]2C)ccc1F ZINC001237815853 980064863 /nfs/dbraw/zinc/06/48/63/980064863.db2.gz YMKQBQSMDAFZAU-PSASIEDQSA-N 1 2 226.270 2.461 20 0 BEADLO CCOc1cc(C[N@H+]2C[C@H]3C[C@@H](C2)O3)ccc1C ZINC001238072383 980137086 /nfs/dbraw/zinc/13/70/86/980137086.db2.gz VLZFFYOPUZENQB-OKILXGFUSA-N 1 2 247.338 2.367 20 0 BEADLO CCOc1cc(C[N@@H+]2C[C@H]3C[C@@H](C2)O3)ccc1C ZINC001238072383 980137091 /nfs/dbraw/zinc/13/70/91/980137091.db2.gz VLZFFYOPUZENQB-OKILXGFUSA-N 1 2 247.338 2.367 20 0 BEADLO Cc1ccc(O)cc1C[NH+]1CC(OC(C)C)C1 ZINC001238102813 980150117 /nfs/dbraw/zinc/15/01/17/980150117.db2.gz JQMAMTQTCMHBTR-UHFFFAOYSA-N 1 2 235.327 2.310 20 0 BEADLO Cc1ncncc1C[N@@H+]1CCn2cccc2[C@H]1C ZINC001238174870 980209251 /nfs/dbraw/zinc/20/92/51/980209251.db2.gz DLDVZMUDXIOIFE-GFCCVEGCSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1ncncc1C[N@H+]1CCn2cccc2[C@H]1C ZINC001238174870 980209262 /nfs/dbraw/zinc/20/92/62/980209262.db2.gz DLDVZMUDXIOIFE-GFCCVEGCSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cncnc2C)cn1 ZINC001238179393 980212744 /nfs/dbraw/zinc/21/27/44/980212744.db2.gz VEMBPFFXLSPYAL-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cncnc2C)cn1 ZINC001238179393 980212752 /nfs/dbraw/zinc/21/27/52/980212752.db2.gz VEMBPFFXLSPYAL-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ncccc1C[N@@H+](C)Cc1cncnc1C ZINC001238179363 980212985 /nfs/dbraw/zinc/21/29/85/980212985.db2.gz UUSYZCRVSDKUNO-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ncccc1C[N@H+](C)Cc1cncnc1C ZINC001238179363 980212992 /nfs/dbraw/zinc/21/29/92/980212992.db2.gz UUSYZCRVSDKUNO-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO C/C=C(\CC)C(=O)OCCCc1c[nH+]cn1C ZINC001343734861 980228371 /nfs/dbraw/zinc/22/83/71/980228371.db2.gz YMHBVZFPNAHXMH-NYYWCZLTSA-N 1 2 236.315 2.252 20 0 BEADLO CC(C)Oc1cncc(C[N@@H+]2CC[C@@H](F)C2)c1 ZINC001238460731 980271364 /nfs/dbraw/zinc/27/13/64/980271364.db2.gz AESQOWGMYUDWQF-GFCCVEGCSA-N 1 2 238.306 2.413 20 0 BEADLO CC(C)Oc1cncc(C[N@H+]2CC[C@@H](F)C2)c1 ZINC001238460731 980271369 /nfs/dbraw/zinc/27/13/69/980271369.db2.gz AESQOWGMYUDWQF-GFCCVEGCSA-N 1 2 238.306 2.413 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)NC1CCCC1 ZINC001185862890 980294391 /nfs/dbraw/zinc/29/43/91/980294391.db2.gz WYBYIMJZEVYLQO-UHFFFAOYSA-N 1 2 244.298 2.398 20 0 BEADLO Cc1cc(F)cc(C[NH+]2CC(CO)C2)c1Cl ZINC001238781611 980328042 /nfs/dbraw/zinc/32/80/42/980328042.db2.gz NRXMYNPBNSWLBS-UHFFFAOYSA-N 1 2 243.709 2.212 20 0 BEADLO CC[C@@H]1CCC[C@H](C)N1C(=O)C[C@@H]([NH3+])C(F)F ZINC001344067809 980334100 /nfs/dbraw/zinc/33/41/00/980334100.db2.gz IUVMREBKAOEEQE-IVZWLZJFSA-N 1 2 248.317 2.149 20 0 BEADLO C[C@H](C(=O)NCCC(C)(C)C1CC1)n1cc[nH+]c1 ZINC001344350648 980375334 /nfs/dbraw/zinc/37/53/34/980375334.db2.gz GLBQRPDPHQTLMU-LLVKDONJSA-N 1 2 249.358 2.387 20 0 BEADLO Cc1cc(NC2CC2)nc(/C=C/C(C)(C)O)[nH+]1 ZINC001239136896 980457459 /nfs/dbraw/zinc/45/74/59/980457459.db2.gz UYXHLJJXDTZHQS-VOTSOKGWSA-N 1 2 233.315 2.143 20 0 BEADLO CC(C)(O)/C=C/c1cccn2cc[nH+]c12 ZINC001239150824 980465567 /nfs/dbraw/zinc/46/55/67/980465567.db2.gz JQADWJZGRIDFQA-AATRIKPKSA-N 1 2 202.257 2.118 20 0 BEADLO CC(C)(O)/C=C/c1ccc2[nH+]ccn2c1 ZINC001239156053 980470009 /nfs/dbraw/zinc/47/00/09/980470009.db2.gz OUNKEZQJZHMIAX-AATRIKPKSA-N 1 2 202.257 2.118 20 0 BEADLO CC(C)=CC(=O)OCC(C)(C)n1cc[nH+]c1 ZINC001345251054 980590427 /nfs/dbraw/zinc/59/04/27/980590427.db2.gz GKHMEAWCDHPVOP-UHFFFAOYSA-N 1 2 222.288 2.128 20 0 BEADLO C[C@@H](c1nnc(C[NH+](C)C)o1)c1ccccc1 ZINC001345570914 980635367 /nfs/dbraw/zinc/63/53/67/980635367.db2.gz OFGRPJAQOPJOHM-SNVBAGLBSA-N 1 2 231.299 2.283 20 0 BEADLO Cc1ccccc1CCc1nnc(C[NH+](C)C)o1 ZINC001345950437 980716816 /nfs/dbraw/zinc/71/68/16/980716816.db2.gz YXRAYTNKNXKBIW-UHFFFAOYSA-N 1 2 245.326 2.225 20 0 BEADLO CCn1c[nH+]cc1COC(=O)CSC(C)C ZINC001345996713 980727076 /nfs/dbraw/zinc/72/70/76/980727076.db2.gz SWYKUTOGLJKSOE-UHFFFAOYSA-N 1 2 242.344 2.088 20 0 BEADLO Fc1ccc(CCn2cc[nH+]c2)c(F)c1 ZINC001250315794 980745726 /nfs/dbraw/zinc/74/57/26/980745726.db2.gz RENKSYREYNKWBA-UHFFFAOYSA-N 1 2 208.211 2.404 20 0 BEADLO CC(=O)Nc1ccccc1CCn1cc[nH+]c1 ZINC001250315505 980753323 /nfs/dbraw/zinc/75/33/23/980753323.db2.gz NXDCMTAPVUCALX-UHFFFAOYSA-N 1 2 229.283 2.084 20 0 BEADLO c1cn(CCc2cccc3c[nH]nc32)c[nH+]1 ZINC001250316763 980758114 /nfs/dbraw/zinc/75/81/14/980758114.db2.gz WZTDNHYWEYTHKX-UHFFFAOYSA-N 1 2 212.256 2.002 20 0 BEADLO c1cn(CCc2ccc3c(c2)OCCCO3)c[nH+]1 ZINC001250318650 980758445 /nfs/dbraw/zinc/75/84/45/980758445.db2.gz INBDDSDWKLNWBA-UHFFFAOYSA-N 1 2 244.294 2.287 20 0 BEADLO CCc1cc(CCn2cc[nH+]c2)ccc1CO ZINC001250321282 980761683 /nfs/dbraw/zinc/76/16/83/980761683.db2.gz ZSPZDTDCTZQBAI-UHFFFAOYSA-N 1 2 230.311 2.181 20 0 BEADLO Oc1ccc(Cl)cc1CCn1cc[nH+]c1 ZINC001250320964 980762387 /nfs/dbraw/zinc/76/23/87/980762387.db2.gz UMUWJEHTONTKSK-UHFFFAOYSA-N 1 2 222.675 2.485 20 0 BEADLO Fc1cc(CCn2cc[nH+]c2)cc2n[nH]cc21 ZINC001250320566 980762851 /nfs/dbraw/zinc/76/28/51/980762851.db2.gz PCPWTMPYPZKHPR-UHFFFAOYSA-N 1 2 230.246 2.141 20 0 BEADLO Cn1c[nH+]cc1CCCOC(=O)C[C@@H]1C=CCC1 ZINC001346227131 980792880 /nfs/dbraw/zinc/79/28/80/980792880.db2.gz QMABEGWHCTURLK-GFCCVEGCSA-N 1 2 248.326 2.252 20 0 BEADLO c1cc(-c2ccc(C[NH+]3CCOCC3)cn2)co1 ZINC001239686308 980842727 /nfs/dbraw/zinc/84/27/27/980842727.db2.gz NSPNQMVBHBSSAK-UHFFFAOYSA-N 1 2 244.294 2.174 20 0 BEADLO CCc1cn(Cc2cn3c(cccc3C)n2)c[nH+]1 ZINC001190103061 980845259 /nfs/dbraw/zinc/84/52/59/980845259.db2.gz FUOBRNLHAQHPFL-UHFFFAOYSA-N 1 2 240.310 2.450 20 0 BEADLO O=C(c1ccccc1-n1cc[nH+]c1)N1CCCC1 ZINC001190075600 980848057 /nfs/dbraw/zinc/84/80/57/980848057.db2.gz ZMFYDUHVBMGOKV-UHFFFAOYSA-N 1 2 241.294 2.108 20 0 BEADLO CNc1ccc(Cc2cc(C)no2)c[nH+]1 ZINC001250364819 980864863 /nfs/dbraw/zinc/86/48/63/980864863.db2.gz WAFOQRLEXQDKRB-UHFFFAOYSA-N 1 2 203.245 2.011 20 0 BEADLO Cc1cc(Cc2ccn3cc[nH+]c3c2)on1 ZINC001250364863 980865081 /nfs/dbraw/zinc/86/50/81/980865081.db2.gz YLVDQGJPPPRNKB-UHFFFAOYSA-N 1 2 213.240 2.222 20 0 BEADLO CC(=O)Nc1ccc(-c2ccc[nH+]c2N)cc1 ZINC001239757220 980898563 /nfs/dbraw/zinc/89/85/63/980898563.db2.gz ULQCPRJMAKLGKA-UHFFFAOYSA-N 1 2 227.267 2.289 20 0 BEADLO CC(=O)Nc1ccccc1-c1c[nH+]cn1C ZINC001239781031 980911821 /nfs/dbraw/zinc/91/18/21/980911821.db2.gz KYPPBQFCUAGUPN-UHFFFAOYSA-N 1 2 215.256 2.046 20 0 BEADLO CC[C@@H]1CCC[C@H]1NC(=O)CCc1[nH+]ccn1C ZINC001347015591 980947908 /nfs/dbraw/zinc/94/79/08/980947908.db2.gz ODPYJFATAJPFJJ-VXGBXAGGSA-N 1 2 249.358 2.048 20 0 BEADLO c1nnc(C[NH2+][C@@H](c2ccccc2)C2CCC2)[nH]1 ZINC001347104321 980973027 /nfs/dbraw/zinc/97/30/27/980973027.db2.gz LJUPKTLXHALVOV-AWEZNQCLSA-N 1 2 242.326 2.436 20 0 BEADLO C[C@H]([NH2+]Cc1ncn[nH]1)[C@@H]1CCC[C@@H](C)C1 ZINC001347122098 980982428 /nfs/dbraw/zinc/98/24/28/980982428.db2.gz VXGHEVCKOKRGFR-OUAUKWLOSA-N 1 2 222.336 2.109 20 0 BEADLO COc1cncc(-c2ccn3cc[nH+]c3c2)c1 ZINC001239929253 981036951 /nfs/dbraw/zinc/03/69/51/981036951.db2.gz QYXJRYKXZIKQNM-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO c1coc(C[N@@H+]2CCC[C@H]2c2ncccn2)c1 ZINC001203289957 981078347 /nfs/dbraw/zinc/07/83/47/981078347.db2.gz PJWRNEPZFNSXHR-LBPRGKRZSA-N 1 2 229.283 2.407 20 0 BEADLO c1coc(C[N@H+]2CCC[C@H]2c2ncccn2)c1 ZINC001203289957 981078353 /nfs/dbraw/zinc/07/83/53/981078353.db2.gz PJWRNEPZFNSXHR-LBPRGKRZSA-N 1 2 229.283 2.407 20 0 BEADLO CNC(=O)c1cccc(-c2cc[nH+]c(NC)c2)c1 ZINC001240017046 981101245 /nfs/dbraw/zinc/10/12/45/981101245.db2.gz IGSIFCUAOSXHRH-UHFFFAOYSA-N 1 2 241.294 2.150 20 0 BEADLO CCCCCCNC(=O)Nc1c[nH+]c(C)n1C ZINC001191955203 981103649 /nfs/dbraw/zinc/10/36/49/981103649.db2.gz JDTZVZIEUROAPJ-UHFFFAOYSA-N 1 2 238.335 2.430 20 0 BEADLO C(=C\C1CC1)\CNc1cc(N2CCCC2)nc[nH+]1 ZINC001347634536 981134309 /nfs/dbraw/zinc/13/43/09/981134309.db2.gz QFMIKCDWTUZMSZ-ARJAWSKDSA-N 1 2 244.342 2.455 20 0 BEADLO C(=C\C1CC1)\CNc1cc(N2CCCC2)[nH+]cn1 ZINC001347634536 981134314 /nfs/dbraw/zinc/13/43/14/981134314.db2.gz QFMIKCDWTUZMSZ-ARJAWSKDSA-N 1 2 244.342 2.455 20 0 BEADLO Cn1cnc2ccc(-c3ccc4[nH+]ccn4c3)nc21 ZINC001240214307 981161538 /nfs/dbraw/zinc/16/15/38/981161538.db2.gz MBMZWARKOCPVPY-UHFFFAOYSA-N 1 2 249.277 2.283 20 0 BEADLO Cc1ncc(-c2ccc3[nH+]ccn3c2)nc1C ZINC001240214853 981163136 /nfs/dbraw/zinc/16/31/36/981163136.db2.gz TVKQEAUEGFOJPC-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO Cc1ccc(-c2ccc3[nH+]ccn3c2)nc1N ZINC001240216182 981163836 /nfs/dbraw/zinc/16/38/36/981163836.db2.gz DNXYDMCEWZTZIT-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO COc1nc(C)cc(-c2ccc3[nH+]ccn3c2)n1 ZINC001240215427 981164964 /nfs/dbraw/zinc/16/49/64/981164964.db2.gz WKILQPGEQOVAQG-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO COc1cnc(C)nc1-c1ccc2[nH+]ccn2c1 ZINC001240216825 981166650 /nfs/dbraw/zinc/16/66/50/981166650.db2.gz ODDSMHHCXIKGKY-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO Cc1nc2cc(-c3ccc4[nH+]ccn4c3)ccn2n1 ZINC001240218446 981168654 /nfs/dbraw/zinc/16/86/54/981168654.db2.gz NUOPETKLPSJVCL-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(-c2cn[nH]c2)cc1 ZINC001240241073 981211642 /nfs/dbraw/zinc/21/16/42/981211642.db2.gz FNEQOGWMEHXAJT-UHFFFAOYSA-N 1 2 224.267 2.477 20 0 BEADLO C/C=C(\C)C(=O)N1CCC(Cc2c[nH]c[nH+]2)CC1 ZINC001348022328 981253444 /nfs/dbraw/zinc/25/34/44/981253444.db2.gz FTXBUBVLZXPESL-QDEBKDIKSA-N 1 2 247.342 2.157 20 0 BEADLO Cn1ncc2ccc(-c3ccc[nH+]c3N)cc21 ZINC001240308269 981278796 /nfs/dbraw/zinc/27/87/96/981278796.db2.gz MTCNYAPRGYKAIO-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO CCc1ccc(N2CCC(C(C)=O)CC2)[nH+]c1 ZINC001348291116 981327721 /nfs/dbraw/zinc/32/77/21/981327721.db2.gz FRAAHPWBNNQXCL-UHFFFAOYSA-N 1 2 232.327 2.449 20 0 BEADLO Cc1c(-c2cc3[nH]ccc3c[nH+]2)cnn1C ZINC001240378257 981330686 /nfs/dbraw/zinc/33/06/86/981330686.db2.gz IKDVHPQZEBFKQT-UHFFFAOYSA-N 1 2 212.256 2.272 20 0 BEADLO Cc1c(-c2cc(C)cn3cc[nH+]c23)cnn1C ZINC001240381674 981341091 /nfs/dbraw/zinc/34/10/91/981341091.db2.gz FUHPIQBKUCKOMH-UHFFFAOYSA-N 1 2 226.283 2.352 20 0 BEADLO Nc1cn2ccc(-c3ccnc4[nH]ccc43)cc2[nH+]1 ZINC001240413350 981363566 /nfs/dbraw/zinc/36/35/66/981363566.db2.gz TTYNSCSURWCKRX-UHFFFAOYSA-N 1 2 249.277 2.460 20 0 BEADLO CC[C@H]1C[NH+](Cc2cc(C)n[nH]2)C[C@H](CC)O1 ZINC001348634652 981412101 /nfs/dbraw/zinc/41/21/01/981412101.db2.gz VOTFCJNBXWBLEZ-STQMWFEESA-N 1 2 237.347 2.108 20 0 BEADLO CCc1cncnc1-c1ccn2cc[nH+]c2c1 ZINC001240496020 981415037 /nfs/dbraw/zinc/41/50/37/981415037.db2.gz CTILIFMUAXXFAW-UHFFFAOYSA-N 1 2 224.267 2.354 20 0 BEADLO c1cn2ccc(-c3ncnc4ncccc43)cc2[nH+]1 ZINC001240495900 981416063 /nfs/dbraw/zinc/41/60/63/981416063.db2.gz CALZFKIXJBIABY-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO CCc1cnc(-c2ccn3cc[nH+]c3c2)nc1 ZINC001240496400 981417609 /nfs/dbraw/zinc/41/76/09/981417609.db2.gz LZRZJVWZLGBBDJ-UHFFFAOYSA-N 1 2 224.267 2.354 20 0 BEADLO Cn1cnc2ccnc(-c3ccn4cc[nH+]c4c3)c21 ZINC001240496419 981417787 /nfs/dbraw/zinc/41/77/87/981417787.db2.gz CSZSEPJTEAHBLS-UHFFFAOYSA-N 1 2 249.277 2.283 20 0 BEADLO c1cc2nc(-c3ccn4cc[nH+]c4c3)cnc2[nH]1 ZINC001240496227 981417796 /nfs/dbraw/zinc/41/77/96/981417796.db2.gz IQVAFJQFJODAFH-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO CCc1nccc(-c2ccn3cc[nH+]c3c2)n1 ZINC001240497762 981418130 /nfs/dbraw/zinc/41/81/30/981418130.db2.gz YXARYKHGIXGCOV-UHFFFAOYSA-N 1 2 224.267 2.354 20 0 BEADLO Cc1cn2cc(-c3ccn4cc[nH+]c4c3)cnc2n1 ZINC001240508561 981431009 /nfs/dbraw/zinc/43/10/09/981431009.db2.gz CIGIFYKWSOBUGG-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO Cc1cc(-c2ccn3cc[nH+]c3c2)c2ncnn2c1 ZINC001240509183 981433593 /nfs/dbraw/zinc/43/35/93/981433593.db2.gz UKANDEZGTWTISM-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO O=C1Cc2c(cccc2-c2ccn3cc[nH+]c3c2)N1 ZINC001240508684 981434915 /nfs/dbraw/zinc/43/49/15/981434915.db2.gz ISWIKDPGADLNHJ-UHFFFAOYSA-N 1 2 249.273 2.496 20 0 BEADLO O=C1NCc2ccc(-c3ccn4cc[nH+]c4c3)cc21 ZINC001240508660 981434935 /nfs/dbraw/zinc/43/49/35/981434935.db2.gz HLVWUFGPYZZLIE-UHFFFAOYSA-N 1 2 249.273 2.245 20 0 BEADLO c1cn2ccc(-c3cccn4cnnc34)cc2[nH+]1 ZINC001240510995 981435489 /nfs/dbraw/zinc/43/54/89/981435489.db2.gz XHXDFBYWEBTHBQ-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO Cc1cc(-c2ccn3cc[nH+]c3c2)c(=O)n(C)c1 ZINC001240518000 981447366 /nfs/dbraw/zinc/44/73/66/981447366.db2.gz KMDQGUBFZRGGRV-UHFFFAOYSA-N 1 2 239.278 2.008 20 0 BEADLO Cc1n[nH]cc1-c1cn2cc[nH+]c2cc1C ZINC001240521036 981452160 /nfs/dbraw/zinc/45/21/60/981452160.db2.gz IXBAYVOXCFEBIL-UHFFFAOYSA-N 1 2 212.256 2.341 20 0 BEADLO CCNC(=O)Nc1ccc(-c2c[nH+]cn2C)cc1 ZINC001240578278 981487177 /nfs/dbraw/zinc/48/71/77/981487177.db2.gz KDBRFHCQBVXORX-UHFFFAOYSA-N 1 2 244.298 2.229 20 0 BEADLO Cc1cc([NH+](C)C)ccc1N[C@H](C)[C@H](C)O ZINC001348973494 981490724 /nfs/dbraw/zinc/49/07/24/981490724.db2.gz RXJAAXGANCRWKP-MNOVXSKESA-N 1 2 222.332 2.242 20 0 BEADLO Cc1cc([NH+](C)C)ccc1N[C@H](C)[C@@H](C)O ZINC001348973493 981491260 /nfs/dbraw/zinc/49/12/60/981491260.db2.gz RXJAAXGANCRWKP-GHMZBOCLSA-N 1 2 222.332 2.242 20 0 BEADLO COC(=O)N(C)Cc1ccc(-n2cc[nH+]c2)cc1 ZINC001193895241 981500450 /nfs/dbraw/zinc/50/04/50/981500450.db2.gz HQQIQZOEUXOXMO-UHFFFAOYSA-N 1 2 245.282 2.071 20 0 BEADLO COc1cc(-c2ccc(C)c(N)[nH+]2)ccc1O ZINC001240613558 981509829 /nfs/dbraw/zinc/50/98/29/981509829.db2.gz ZQDYGJNHTHWFKH-UHFFFAOYSA-N 1 2 230.267 2.353 20 0 BEADLO Cc1cc(O)ccc1-c1ccc(N)[nH+]c1 ZINC001240643499 981538799 /nfs/dbraw/zinc/53/87/99/981538799.db2.gz HRPRROULOCQNMZ-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO CCCOC(=O)NCc1c[nH+]cn1C(C)C ZINC001194148169 981578038 /nfs/dbraw/zinc/57/80/38/981578038.db2.gz SZMWESSESJEDAE-UHFFFAOYSA-N 1 2 225.292 2.100 20 0 BEADLO CC[C@H](C)COC(=O)NCCCn1cc[nH+]c1 ZINC001194756658 981886636 /nfs/dbraw/zinc/88/66/36/981886636.db2.gz NWVHWZIZZBORHW-NSHDSACASA-N 1 2 239.319 2.046 20 0 BEADLO CC(C)[C@@H]([NH2+]Cc1nnc[nH]1)c1ccc(F)cc1 ZINC001350364919 981945350 /nfs/dbraw/zinc/94/53/50/981945350.db2.gz OIJDQJUOPNVFQW-CYBMUJFWSA-N 1 2 248.305 2.431 20 0 BEADLO CC(C)C[C@]1(C)CCC[N@@H+]1Cc1nc[nH]n1 ZINC001350378500 981954143 /nfs/dbraw/zinc/95/41/43/981954143.db2.gz XLCBAZWZDRRKFY-LBPRGKRZSA-N 1 2 222.336 2.205 20 0 BEADLO CC(C)C[C@]1(C)CCC[N@H+]1Cc1nc[nH]n1 ZINC001350378500 981954146 /nfs/dbraw/zinc/95/41/46/981954146.db2.gz XLCBAZWZDRRKFY-LBPRGKRZSA-N 1 2 222.336 2.205 20 0 BEADLO Cc1ccc(C2([NH2+]Cc3nnc[nH]3)CCC2)cc1 ZINC001350381037 981955602 /nfs/dbraw/zinc/95/56/02/981955602.db2.gz LDIRVWYFQDGZAE-UHFFFAOYSA-N 1 2 242.326 2.282 20 0 BEADLO C[C@H]([NH2+]Cc1ncn[nH]1)C1CCC(F)(F)CC1 ZINC001350382819 981957003 /nfs/dbraw/zinc/95/70/03/981957003.db2.gz ZDCXMAGNSSOMGG-QMMMGPOBSA-N 1 2 244.289 2.108 20 0 BEADLO Cc1cn2c(cccc2NC(=O)OCCF)[nH+]1 ZINC001194929527 981969940 /nfs/dbraw/zinc/96/99/40/981969940.db2.gz NGEYHVBAIVLVGA-UHFFFAOYSA-N 1 2 237.234 2.161 20 0 BEADLO Cc1ccc(-c2nc3[nH]ccc3c[nH+]2)cc1N ZINC001240958225 982029927 /nfs/dbraw/zinc/02/99/27/982029927.db2.gz CBIGBFLJUDOHAA-UHFFFAOYSA-N 1 2 224.267 2.467 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)Nc1ccc(Cl)cc1 ZINC001587138861 982054338 /nfs/dbraw/zinc/05/43/38/982054338.db2.gz XFTLUZDMRLRZOO-UHFFFAOYSA-N 1 2 235.674 2.244 20 0 BEADLO CCNC(=S)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001195336757 982202087 /nfs/dbraw/zinc/20/20/87/982202087.db2.gz IPORUOYBHLMDAC-UHFFFAOYSA-N 1 2 246.339 2.179 20 0 BEADLO Nc1cc(-c2ccnc(N3CCCC3)c2)cc[nH+]1 ZINC001241162243 982301438 /nfs/dbraw/zinc/30/14/38/982301438.db2.gz DLPLTIXNFSCDIJ-UHFFFAOYSA-N 1 2 240.310 2.326 20 0 BEADLO Nc1cc(-c2ccc(-c3nnco3)cc2)cc[nH+]1 ZINC001241163320 982301686 /nfs/dbraw/zinc/30/16/86/982301686.db2.gz UMDBQXHYRRSYLM-UHFFFAOYSA-N 1 2 238.250 2.381 20 0 BEADLO Nc1cc(-c2cccc3c2COC3=O)cc[nH+]1 ZINC001241162945 982304745 /nfs/dbraw/zinc/30/47/45/982304745.db2.gz PAKLFMCRJJPUCF-UHFFFAOYSA-N 1 2 226.235 2.001 20 0 BEADLO COc1cc(-c2cc[nH+]c(N)c2)cnc1C ZINC001241163620 982305758 /nfs/dbraw/zinc/30/57/58/982305758.db2.gz XDYOPMGKFZIOTD-UHFFFAOYSA-N 1 2 215.256 2.043 20 0 BEADLO COC(=O)c1cc(F)ccc1-c1cc[nH+]c(N)c1 ZINC001241163660 982308887 /nfs/dbraw/zinc/30/88/87/982308887.db2.gz XXRZYKBYSSVVPD-UHFFFAOYSA-N 1 2 246.241 2.257 20 0 BEADLO COC(=O)c1cc(F)cc(-c2cc[nH+]c(N)c2)c1 ZINC001241169658 982310789 /nfs/dbraw/zinc/31/07/89/982310789.db2.gz JVRDYZYCICVNSD-UHFFFAOYSA-N 1 2 246.241 2.257 20 0 BEADLO Cc1cncnc1-c1c[nH+]c(N(C)C)cc1C ZINC001241227787 982375923 /nfs/dbraw/zinc/37/59/23/982375923.db2.gz CEWTUDDEBIPAMK-UHFFFAOYSA-N 1 2 228.299 2.221 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1ncncc1F ZINC001241228198 982377063 /nfs/dbraw/zinc/37/70/63/982377063.db2.gz JMGIXHIAUOBVKZ-UHFFFAOYSA-N 1 2 232.262 2.052 20 0 BEADLO CCc1ccc(-c2c[nH+]c(N(C)C)cc2C)nn1 ZINC001241234486 982386690 /nfs/dbraw/zinc/38/66/90/982386690.db2.gz AQPANNXTWKSIOE-UHFFFAOYSA-N 1 2 242.326 2.475 20 0 BEADLO CCc1ncncc1-c1c[nH+]c(N(C)C)cc1C ZINC001241248854 982389283 /nfs/dbraw/zinc/38/92/83/982389283.db2.gz WUYYNLBRDGFWFK-UHFFFAOYSA-N 1 2 242.326 2.475 20 0 BEADLO CNc1cc(CNc2nc(C)ncc2C)cc[nH+]1 ZINC001352066446 982452869 /nfs/dbraw/zinc/45/28/69/982452869.db2.gz OMIGGYNOTDEVRY-UHFFFAOYSA-N 1 2 243.314 2.142 20 0 BEADLO Cc1cc(-c2ccccc2[S@](C)=O)c[nH+]c1N ZINC001241340863 982503214 /nfs/dbraw/zinc/50/32/14/982503214.db2.gz NYKUTRFDTJZPEQ-KRWDZBQOSA-N 1 2 246.335 2.377 20 0 BEADLO C[S@@](=O)c1ccccc1-c1ccc[nH+]c1N ZINC001241337693 982504531 /nfs/dbraw/zinc/50/45/31/982504531.db2.gz MXJNSUTWBZBKHA-MRXNPFEDSA-N 1 2 232.308 2.068 20 0 BEADLO Nc1cc(-c2ccc(N3CCCC3)nc2)cc[nH+]1 ZINC001241376397 982538717 /nfs/dbraw/zinc/53/87/17/982538717.db2.gz TXEOQHGPJPEUSS-UHFFFAOYSA-N 1 2 240.310 2.326 20 0 BEADLO CCN(C)c1cc(C)[nH+]c(-c2ccc(N)cc2)n1 ZINC001241538029 982710989 /nfs/dbraw/zinc/71/09/89/982710989.db2.gz RFLKSRAKDQBIEG-UHFFFAOYSA-N 1 2 242.326 2.490 20 0 BEADLO CC[C@@H](C)CNC(=S)Nc1c[nH+]c(C)n1C ZINC001200244939 982741538 /nfs/dbraw/zinc/74/15/38/982741538.db2.gz KUCWZOMVSLGBKG-MRVPVSSYSA-N 1 2 240.376 2.061 20 0 BEADLO C[N@@H+]1CCC=C(c2nccnc2C(F)(F)F)C1 ZINC001241567070 982813544 /nfs/dbraw/zinc/81/35/44/982813544.db2.gz IZFFVMYVMRPWEC-UHFFFAOYSA-N 1 2 243.232 2.214 20 0 BEADLO C[N@H+]1CCC=C(c2nccnc2C(F)(F)F)C1 ZINC001241567070 982813546 /nfs/dbraw/zinc/81/35/46/982813546.db2.gz IZFFVMYVMRPWEC-UHFFFAOYSA-N 1 2 243.232 2.214 20 0 BEADLO Cn1cc2cc(-c3cc[nH+]c(N)c3)ccc2n1 ZINC001241609232 982850606 /nfs/dbraw/zinc/85/06/06/982850606.db2.gz ZLIXWPGFDZBOGL-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO CSc1ncc(-c2cc[nH+]c3c2CCN3)cn1 ZINC001241632056 982869580 /nfs/dbraw/zinc/86/95/80/982869580.db2.gz XCTVCVVAACOIOF-UHFFFAOYSA-N 1 2 244.323 2.229 20 0 BEADLO CN1CCOc2c1cn[nH+]c2C1=CCCCC1 ZINC001241715227 982973797 /nfs/dbraw/zinc/97/37/97/982973797.db2.gz MPSHBALFOXOVIE-UHFFFAOYSA-N 1 2 231.299 2.263 20 0 BEADLO CCCCNC(=S)Nc1ccc2[nH+]ccn2c1 ZINC001200443673 982999794 /nfs/dbraw/zinc/99/97/94/982999794.db2.gz GOFYEUHGMRFSJM-UHFFFAOYSA-N 1 2 248.355 2.421 20 0 BEADLO CC[C@@H](C)NC(=S)Nc1ccn2cc[nH+]c2c1 ZINC001200472408 983037207 /nfs/dbraw/zinc/03/72/07/983037207.db2.gz YVHAWHKTVIGYQT-SECBINFHSA-N 1 2 248.355 2.419 20 0 BEADLO CCCn1nc(C)cc1-c1cc[nH+]c(N)c1 ZINC001241764070 983038936 /nfs/dbraw/zinc/03/89/36/983038936.db2.gz RAOOYVSRIPFHEY-UHFFFAOYSA-N 1 2 216.288 2.246 20 0 BEADLO COc1cc(C)c(-c2c[nH+]c(N)c(C)c2)cn1 ZINC001241766395 983040189 /nfs/dbraw/zinc/04/01/89/983040189.db2.gz USQQUMJBKDSEGV-UHFFFAOYSA-N 1 2 229.283 2.351 20 0 BEADLO COc1cc(C)c(-c2cc[nH+]c3c2CCN3)cn1 ZINC001241776142 983044196 /nfs/dbraw/zinc/04/41/96/983044196.db2.gz LDMNOQRFTWIPLA-UHFFFAOYSA-N 1 2 241.294 2.429 20 0 BEADLO Nc1cn2ccc(-c3cscn3)cc2[nH+]1 ZINC001241890781 983108346 /nfs/dbraw/zinc/10/83/46/983108346.db2.gz SCRDPBCNEHVDRG-UHFFFAOYSA-N 1 2 216.269 2.040 20 0 BEADLO Cc1cccc(Nc2ccc(N)[nH+]c2)c1O ZINC001201283583 983157529 /nfs/dbraw/zinc/15/75/29/983157529.db2.gz ACEMMIHLGQUAPZ-UHFFFAOYSA-N 1 2 215.256 2.421 20 0 BEADLO COc1cccc(OC)c1Nc1ccc(N)[nH+]c1 ZINC001201283766 983158176 /nfs/dbraw/zinc/15/81/76/983158176.db2.gz FZYKZNCWNVMRBW-UHFFFAOYSA-N 1 2 245.282 2.425 20 0 BEADLO Nc1ccc(Nc2c(O)cccc2F)c[nH+]1 ZINC001201284142 983158202 /nfs/dbraw/zinc/15/82/02/983158202.db2.gz KGGPRTSUITYHNC-UHFFFAOYSA-N 1 2 219.219 2.252 20 0 BEADLO Nc1ccc(Nc2ccc3c(c2)C(=O)OC3)c[nH+]1 ZINC001201283662 983159049 /nfs/dbraw/zinc/15/90/49/983159049.db2.gz BYAINODFEQUUDT-UHFFFAOYSA-N 1 2 241.250 2.078 20 0 BEADLO Nc1ccc(Nc2cccc(CO)c2F)c[nH+]1 ZINC001201285975 983160405 /nfs/dbraw/zinc/16/04/05/983160405.db2.gz TYJSJHTXRJTTEG-UHFFFAOYSA-N 1 2 233.246 2.039 20 0 BEADLO Nc1ccc(Nc2ccc3[nH]c(=O)oc3c2)c[nH+]1 ZINC001201286919 983163831 /nfs/dbraw/zinc/16/38/31/983163831.db2.gz HVCKZQZVEDYWCV-UHFFFAOYSA-N 1 2 242.238 2.254 20 0 BEADLO Cc1cc(N)c(Nc2ccc(N)[nH+]c2)cc1F ZINC001201286812 983164876 /nfs/dbraw/zinc/16/48/76/983164876.db2.gz BIUMSKQXNJCTKK-UHFFFAOYSA-N 1 2 232.262 2.437 20 0 BEADLO COc1cccc(O)c1Nc1ccc(N)[nH+]c1 ZINC001201291825 983168162 /nfs/dbraw/zinc/16/81/62/983168162.db2.gz DOYIXMAFGWXMDY-UHFFFAOYSA-N 1 2 231.255 2.122 20 0 BEADLO COCOc1cccc(Nc2ccc(N)[nH+]c2)c1 ZINC001201291092 983169612 /nfs/dbraw/zinc/16/96/12/983169612.db2.gz AOJCQSPJWUWOEG-UHFFFAOYSA-N 1 2 245.282 2.390 20 0 BEADLO COC(=O)c1ccsc1Nc1ccc(N)[nH+]c1 ZINC001201272375 983171576 /nfs/dbraw/zinc/17/15/76/983171576.db2.gz MCYPCCDLPGKJDI-UHFFFAOYSA-N 1 2 249.295 2.256 20 0 BEADLO Cc1cc[nH+]c(Nc2ccc(N)nc2)c1 ZINC001201272368 983172011 /nfs/dbraw/zinc/17/20/11/983172011.db2.gz LOQRRGCSJRQVFP-UHFFFAOYSA-N 1 2 200.245 2.111 20 0 BEADLO Cc1ccc(Nc2ccc(N)[nH+]c2)nc1 ZINC001201272059 983172206 /nfs/dbraw/zinc/17/22/06/983172206.db2.gz HBLRPCDDFVJPOG-UHFFFAOYSA-N 1 2 200.245 2.111 20 0 BEADLO CCOc1ncc(Nc2ccc(N)[nH+]c2)cc1F ZINC001201276587 983175177 /nfs/dbraw/zinc/17/51/77/983175177.db2.gz WTUPCAVIRFQCLQ-UHFFFAOYSA-N 1 2 248.261 2.340 20 0 BEADLO CCOc1ncccc1Nc1ccc(N)[nH+]c1 ZINC001201278449 983178421 /nfs/dbraw/zinc/17/84/21/983178421.db2.gz JITQDRJCWQXIDZ-UHFFFAOYSA-N 1 2 230.271 2.201 20 0 BEADLO Cc1cc(-c2cccc(=O)n2C)cc(C)[nH+]1 ZINC001241992559 983184438 /nfs/dbraw/zinc/18/44/38/983184438.db2.gz NURJOXMTGIWQCW-UHFFFAOYSA-N 1 2 214.268 2.064 20 0 BEADLO O=c1ccc2cc(-c3[nH]cc[nH+]3)ccc2o1 ZINC001242015839 983215573 /nfs/dbraw/zinc/21/55/73/983215573.db2.gz OJEYDBTUDMXEAS-UHFFFAOYSA-N 1 2 212.208 2.183 20 0 BEADLO COc1ccc(-c2[nH]cc[nH+]2)c(C)c1OC ZINC001242017283 983218276 /nfs/dbraw/zinc/21/82/76/983218276.db2.gz HMEOOKDGTSYNFX-UHFFFAOYSA-N 1 2 218.256 2.402 20 0 BEADLO S=C1N=NC(c2ccc(-c3[nH]cc[nH+]3)cc2)O1 ZINC001242017671 983218503 /nfs/dbraw/zinc/21/85/03/983218503.db2.gz RKSRHTAYPASAOB-UHFFFAOYSA-N 1 2 244.279 2.415 20 0 BEADLO Cc1cc(-c2[nH]cc[nH+]2)cc2c1NC(=O)CC2 ZINC001242018298 983220447 /nfs/dbraw/zinc/22/04/47/983220447.db2.gz COZSNIOKNJLVDS-UHFFFAOYSA-N 1 2 227.267 2.270 20 0 BEADLO CC(=O)N1CCCc2cc(-c3[nH]cc[nH+]3)ccc21 ZINC001242018200 983221034 /nfs/dbraw/zinc/22/10/34/983221034.db2.gz GMRITICVKWRDJM-UHFFFAOYSA-N 1 2 241.294 2.376 20 0 BEADLO Nc1cc(-c2ccnnc2)[nH+]cc1C(F)(F)F ZINC001242047522 983254944 /nfs/dbraw/zinc/25/49/44/983254944.db2.gz VNDQMIRBUXPWBS-UHFFFAOYSA-N 1 2 240.188 2.140 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1ccnnc1 ZINC001242055557 983262518 /nfs/dbraw/zinc/26/25/18/983262518.db2.gz GMLGBIYRHQZJKL-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO COc1ccncc1-c1ccn2cc[nH+]c2c1 ZINC001242056441 983263159 /nfs/dbraw/zinc/26/31/59/983263159.db2.gz KDWOMNJQARYWNS-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO Cc1cc(-c2ccc(=O)[nH]c2)c2[nH+]ccn2c1 ZINC001242063594 983285453 /nfs/dbraw/zinc/28/54/53/983285453.db2.gz SEICYLLTMALDDP-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO Cc1c[nH]c2ncnc(-c3c[nH+]c(N)cc3C)c12 ZINC001242067418 983294228 /nfs/dbraw/zinc/29/42/28/983294228.db2.gz CDUAIGPQVIHJKO-UHFFFAOYSA-N 1 2 239.282 2.171 20 0 BEADLO Cc1nc(N2CCO[C@@H](C(C)(C)C)CC2)cc[nH+]1 ZINC001354372646 983294402 /nfs/dbraw/zinc/29/44/02/983294402.db2.gz NQISEPKBKBWITI-GFCCVEGCSA-N 1 2 249.358 2.426 20 0 BEADLO CCC[C@H](C)C[N@@H+]1C[C@@H](F)C[C@H]1C(=O)OC ZINC001201538491 983296182 /nfs/dbraw/zinc/29/61/82/983296182.db2.gz HECTYQGCCAZPMW-DCAQKATOSA-N 1 2 231.311 2.008 20 0 BEADLO CCC[C@H](C)C[N@H+]1C[C@@H](F)C[C@H]1C(=O)OC ZINC001201538491 983296190 /nfs/dbraw/zinc/29/61/90/983296190.db2.gz HECTYQGCCAZPMW-DCAQKATOSA-N 1 2 231.311 2.008 20 0 BEADLO CNc1ccc(-c2c[nH+]c(N)c(C)c2)cn1 ZINC001242069522 983299287 /nfs/dbraw/zinc/29/92/87/983299287.db2.gz BMTFESDGZAFCMU-UHFFFAOYSA-N 1 2 214.272 2.076 20 0 BEADLO CNc1ccc(-c2ccn3cc(N)[nH+]c3c2)cn1 ZINC001242069390 983300418 /nfs/dbraw/zinc/30/04/18/983300418.db2.gz HHXYKKGGMJTQTK-UHFFFAOYSA-N 1 2 239.282 2.020 20 0 BEADLO Cc1cnc(-c2c[nH+]c(N)cc2C)nc1C ZINC001242077923 983324870 /nfs/dbraw/zinc/32/48/70/983324870.db2.gz LOONZODMNKNZBG-UHFFFAOYSA-N 1 2 214.272 2.046 20 0 BEADLO COc1cc2[nH+]ccn2cc1C1=CCOCC1 ZINC001242077415 983325159 /nfs/dbraw/zinc/32/51/59/983325159.db2.gz SBUXVMIACCPBJZ-UHFFFAOYSA-N 1 2 230.267 2.147 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1ncnc2sncc21 ZINC001242078370 983327634 /nfs/dbraw/zinc/32/76/34/983327634.db2.gz ILKJMZTWQHQYSH-UHFFFAOYSA-N 1 2 243.295 2.039 20 0 BEADLO CCOc1cccnc1-c1c[nH+]c(N)cc1C ZINC001242078381 983328954 /nfs/dbraw/zinc/32/89/54/983328954.db2.gz ZKXWVTSFDDPSKO-UHFFFAOYSA-N 1 2 229.283 2.433 20 0 BEADLO CSc1cnc(-c2c[nH+]c(N)cc2C)cn1 ZINC001242089795 983335479 /nfs/dbraw/zinc/33/54/79/983335479.db2.gz JQLHSOKXCFSADZ-UHFFFAOYSA-N 1 2 232.312 2.151 20 0 BEADLO CCc1ccc2c(c1)C[N@H+]([C@H](C)C(=O)OC)CC2 ZINC000082791773 983345335 /nfs/dbraw/zinc/34/53/35/983345335.db2.gz YKYHPPLKBLIFBP-LLVKDONJSA-N 1 2 247.338 2.169 20 0 BEADLO CCc1ccc2c(c1)C[N@@H+]([C@H](C)C(=O)OC)CC2 ZINC000082791773 983345343 /nfs/dbraw/zinc/34/53/43/983345343.db2.gz YKYHPPLKBLIFBP-LLVKDONJSA-N 1 2 247.338 2.169 20 0 BEADLO COCOc1ccc(-c2ccc(N)[nH+]c2)cc1F ZINC001242114671 983361711 /nfs/dbraw/zinc/36/17/11/983361711.db2.gz CVUHNSMZMMDBGN-UHFFFAOYSA-N 1 2 248.257 2.453 20 0 BEADLO Nc1cc(-c2ccc3c(c2)CCC3=O)cc[nH+]1 ZINC001242156432 983382852 /nfs/dbraw/zinc/38/28/52/983382852.db2.gz FPHLZTPUUBGSLY-UHFFFAOYSA-N 1 2 224.263 2.460 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H](C)C1CCC1 ZINC001355035467 983400872 /nfs/dbraw/zinc/40/08/72/983400872.db2.gz MQPFMCAJWWKBLG-LLVKDONJSA-N 1 2 232.327 2.495 20 0 BEADLO Cc1cc(-c2ccc(F)cc2O)c[nH+]c1N ZINC001242218591 983409184 /nfs/dbraw/zinc/40/91/84/983409184.db2.gz GKSXQIZIVGPQLE-UHFFFAOYSA-N 1 2 218.231 2.484 20 0 BEADLO Oc1cc(F)ccc1-c1cc[nH+]c2c1CCN2 ZINC001242221615 983429391 /nfs/dbraw/zinc/42/93/91/983429391.db2.gz NYRIZSWXNSTBFD-UHFFFAOYSA-N 1 2 230.242 2.204 20 0 BEADLO CCCC[C@@H](O)CNc1cc([C@@H](C)O)cc[nH+]1 ZINC001252083329 983445325 /nfs/dbraw/zinc/44/53/25/983445325.db2.gz NVISUYFMZDOETB-ZYHUDNBSSA-N 1 2 238.331 2.098 20 0 BEADLO Fc1ccccc1OC1C[NH+](CC2CC2)C1 ZINC001201942408 983510281 /nfs/dbraw/zinc/51/02/81/983510281.db2.gz HFZZFDQYUSMEGR-UHFFFAOYSA-N 1 2 221.275 2.299 20 0 BEADLO COC(=O)[C@@H]1C[C@@H](F)C[N@@H+]1CCC(C)(C)C ZINC001202065921 983544370 /nfs/dbraw/zinc/54/43/70/983544370.db2.gz XQFMPAPCZVBWIM-ZJUUUORDSA-N 1 2 231.311 2.008 20 0 BEADLO COC(=O)[C@@H]1C[C@@H](F)C[N@H+]1CCC(C)(C)C ZINC001202065921 983544378 /nfs/dbraw/zinc/54/43/78/983544378.db2.gz XQFMPAPCZVBWIM-ZJUUUORDSA-N 1 2 231.311 2.008 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cc(F)ccc1CO ZINC001242342250 983590313 /nfs/dbraw/zinc/59/03/13/983590313.db2.gz KYLUALGOFIMGKS-YGQDEOHPSA-N 1 2 207.248 2.194 20 0 BEADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1cncs1 ZINC001202388636 983633694 /nfs/dbraw/zinc/63/36/94/983633694.db2.gz WGTORFBCHNIEJB-SECBINFHSA-N 1 2 236.344 2.210 20 0 BEADLO CCCn1c[nH+]cc1CNCc1coc(CC)n1 ZINC001202435170 983656541 /nfs/dbraw/zinc/65/65/41/983656541.db2.gz FCBXRLSLAKBBOF-UHFFFAOYSA-N 1 2 248.330 2.133 20 0 BEADLO CCN(C(=O)Nc1ccc(C)cc1)C1C[NH+](C)C1 ZINC001202432008 983675974 /nfs/dbraw/zinc/67/59/74/983675974.db2.gz XHFWKSYYNCAIDA-UHFFFAOYSA-N 1 2 247.342 2.163 20 0 BEADLO COc1ncc(-c2ccc[nH+]c2N)cc1C ZINC001242433792 983734160 /nfs/dbraw/zinc/73/41/60/983734160.db2.gz MTJAARRNNJXOOP-UHFFFAOYSA-N 1 2 215.256 2.043 20 0 BEADLO Cc1cn2cc(-c3cncc(N)c3)ccc2[nH+]1 ZINC001242501015 983824884 /nfs/dbraw/zinc/82/48/84/983824884.db2.gz ZTUJSKHZSAWHRM-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1ccccc1OC(C)C ZINC001137134397 983964977 /nfs/dbraw/zinc/96/49/77/983964977.db2.gz RKMQBIKNMXUMBE-UHFFFAOYSA-N 1 2 235.327 2.495 20 0 BEADLO CC(=O)C[N@H+](C)Cc1ccccc1OC(C)C ZINC001137134397 983964990 /nfs/dbraw/zinc/96/49/90/983964990.db2.gz RKMQBIKNMXUMBE-UHFFFAOYSA-N 1 2 235.327 2.495 20 0 BEADLO C[NH+]1CC(Oc2cccc(Br)c2)C1 ZINC000201327199 983991299 /nfs/dbraw/zinc/99/12/99/983991299.db2.gz BFSLKMDRLZHIOL-UHFFFAOYSA-N 1 2 242.116 2.142 20 0 BEADLO C[C@@H](O)c1ccc(-c2ccc(N)[nH+]c2)cc1 ZINC001242647124 984020412 /nfs/dbraw/zinc/02/04/12/984020412.db2.gz WLPSCVWZTYRVRW-SECBINFHSA-N 1 2 214.268 2.384 20 0 BEADLO Clc1ccc(C[N@@H+]2CC[C@@]23CCOC3)cn1 ZINC001137169819 984021521 /nfs/dbraw/zinc/02/15/21/984021521.db2.gz XKNYCVMPAHBDFM-LBPRGKRZSA-N 1 2 238.718 2.100 20 0 BEADLO Clc1ccc(C[N@H+]2CC[C@@]23CCOC3)cn1 ZINC001137169819 984021527 /nfs/dbraw/zinc/02/15/27/984021527.db2.gz XKNYCVMPAHBDFM-LBPRGKRZSA-N 1 2 238.718 2.100 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccnc(OC2CC2)c1 ZINC001242723978 984074568 /nfs/dbraw/zinc/07/45/68/984074568.db2.gz NGXNLAVIPYFBIF-GBWIQOKOSA-N 1 2 216.284 2.499 20 0 BEADLO Cc1[nH+]cc(NC(=O)NCc2ccccc2)n1C ZINC001202627641 984135754 /nfs/dbraw/zinc/13/57/54/984135754.db2.gz YRZHNLKLGBDCAH-UHFFFAOYSA-N 1 2 244.298 2.050 20 0 BEADLO Cc1cc(CNc2ccc(CO)cn2)cc(C)[nH+]1 ZINC001202664884 984151259 /nfs/dbraw/zinc/15/12/59/984151259.db2.gz DHDKAECKNLTHRU-UHFFFAOYSA-N 1 2 243.310 2.198 20 0 BEADLO Cc1ccc2nc(C[N@@H+](C)C3COC3)ccc2c1 ZINC001137215632 984179217 /nfs/dbraw/zinc/17/92/17/984179217.db2.gz FDBZRDBTMZPDIS-UHFFFAOYSA-N 1 2 242.322 2.374 20 0 BEADLO Cc1ccc2nc(C[N@H+](C)C3COC3)ccc2c1 ZINC001137215632 984179223 /nfs/dbraw/zinc/17/92/23/984179223.db2.gz FDBZRDBTMZPDIS-UHFFFAOYSA-N 1 2 242.322 2.374 20 0 BEADLO CCCCC[C@H](O)CNc1cc[nH+]c(OC)c1 ZINC001253519529 984189079 /nfs/dbraw/zinc/18/90/79/984189079.db2.gz FJZTZFGGGWHSHL-LBPRGKRZSA-N 1 2 238.331 2.443 20 0 BEADLO c1cn(Cc2ccccc2-c2ccncn2)c[nH+]1 ZINC001242919049 984295721 /nfs/dbraw/zinc/29/57/21/984295721.db2.gz RPZPULIXMZWYDQ-UHFFFAOYSA-N 1 2 236.278 2.388 20 0 BEADLO Cc1c(-c2ccncn2)ccc2[nH+]ccn21 ZINC001242920309 984298492 /nfs/dbraw/zinc/29/84/92/984298492.db2.gz FFHRIAMRINJEBO-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO Cc1coc(C(=O)Nc2cc(C)[nH+]cc2C)c1 ZINC001435756347 984299034 /nfs/dbraw/zinc/29/90/34/984299034.db2.gz BZHKAAFZMSPAHK-UHFFFAOYSA-N 1 2 230.267 2.274 20 0 BEADLO COc1ncc(-c2ccc[nH+]c2N)cc1Cl ZINC001242932027 984305281 /nfs/dbraw/zinc/30/52/81/984305281.db2.gz QJZMJOLEMROJOL-UHFFFAOYSA-N 1 2 235.674 2.388 20 0 BEADLO c1cn2ccc(-c3cnc4[nH]cnc4c3)cc2[nH+]1 ZINC001240502993 984308983 /nfs/dbraw/zinc/30/89/83/984308983.db2.gz FCWKSLNKKSJKDJ-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO Cc1cn2c(cccc2-c2cncc(CO)c2)[nH+]1 ZINC001242971639 984340459 /nfs/dbraw/zinc/34/04/59/984340459.db2.gz YIDIGBGWFQSMAJ-UHFFFAOYSA-N 1 2 239.278 2.197 20 0 BEADLO COC(=[NH2+])c1cccc(-c2cncc(CO)c2)c1 ZINC001242974241 984344224 /nfs/dbraw/zinc/34/42/24/984344224.db2.gz YOJJKWBDCYIGGT-UHFFFAOYSA-N 1 2 242.278 2.213 20 0 BEADLO Cc1nc2[nH]ccc2cc1-c1c[nH+]cn1C ZINC001243067183 984478737 /nfs/dbraw/zinc/47/87/37/984478737.db2.gz GRBDLVPMWUZXDT-UHFFFAOYSA-N 1 2 212.256 2.223 20 0 BEADLO CC(=O)Nc1ccc(-c2c[nH+]cn2C)cc1C ZINC001243067922 984482109 /nfs/dbraw/zinc/48/21/09/984482109.db2.gz QXIJSVVKALWFIH-UHFFFAOYSA-N 1 2 229.283 2.354 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2c(c1)C1(CC1)C(=O)N2 ZINC001243068045 984484583 /nfs/dbraw/zinc/48/45/83/984484583.db2.gz UCMIANLPLNTMEK-UHFFFAOYSA-N 1 2 239.278 2.071 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(C2OCCO2)cc1 ZINC001243069011 984489659 /nfs/dbraw/zinc/48/96/59/984489659.db2.gz MNSLATIEOLGLHZ-UHFFFAOYSA-N 1 2 230.267 2.133 20 0 BEADLO Cn1c[nH+]cc1-c1cccc2cnncc21 ZINC001243070850 984501131 /nfs/dbraw/zinc/50/11/31/984501131.db2.gz ZYPLFLCKMAUFQL-UHFFFAOYSA-N 1 2 210.240 2.030 20 0 BEADLO COc1cccc(-c2cccc3[nH+]ccn32)n1 ZINC001243095813 984526817 /nfs/dbraw/zinc/52/68/17/984526817.db2.gz DCNGZZROSIDLHZ-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO CC(C)[C@H]1CCCCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC001446897788 984704563 /nfs/dbraw/zinc/70/45/63/984704563.db2.gz UYEZPPRAIBWYCZ-GFCCVEGCSA-N 1 2 249.358 2.379 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1C(=O)Cc1[nH]c[nH+]c1C ZINC001446877977 984704662 /nfs/dbraw/zinc/70/46/62/984704662.db2.gz IGTRZEQNNWGYJP-KOLCDFICSA-N 1 2 235.331 2.050 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)N[C@H](C)c1cccs1 ZINC001447904838 984790935 /nfs/dbraw/zinc/79/09/35/984790935.db2.gz MTWHVRIBEJTKGK-NXEZZACHSA-N 1 2 238.356 2.020 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)N[C@H](C)c1cccs1 ZINC001447904838 984790973 /nfs/dbraw/zinc/79/09/73/984790973.db2.gz MTWHVRIBEJTKGK-NXEZZACHSA-N 1 2 238.356 2.020 20 0 BEADLO Cc1cc(-c2ccc(F)c(N)c2)c[nH+]c1N ZINC001243454489 984960180 /nfs/dbraw/zinc/96/01/80/984960180.db2.gz ALKYRCFQLBFSDJ-UHFFFAOYSA-N 1 2 217.247 2.361 20 0 BEADLO Nc1[nH+]cccc1-c1ccnc(N2CCCC2)c1 ZINC001243472306 985017857 /nfs/dbraw/zinc/01/78/57/985017857.db2.gz HXBWWVBGJIZAQQ-UHFFFAOYSA-N 1 2 240.310 2.326 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2cnoc2c1 ZINC001243474371 985021698 /nfs/dbraw/zinc/02/16/98/985021698.db2.gz LRHVLYZZBVMWRB-UHFFFAOYSA-N 1 2 211.224 2.472 20 0 BEADLO Cc1cc(C(N)=O)cc(C)c1-c1ccc[nH+]c1N ZINC001243473382 985022932 /nfs/dbraw/zinc/02/29/32/985022932.db2.gz KQDKHGZFNLBOSQ-UHFFFAOYSA-N 1 2 241.294 2.047 20 0 BEADLO COC(=O)c1cc(C)ccc1-c1ccc[nH+]c1N ZINC001243473991 985023037 /nfs/dbraw/zinc/02/30/37/985023037.db2.gz QTAWDRQMHVVSJO-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO COc1nccc(-c2ccc[nH+]c2N)c1C ZINC001243475499 985030626 /nfs/dbraw/zinc/03/06/26/985030626.db2.gz KCLLFZLMITYCES-UHFFFAOYSA-N 1 2 215.256 2.043 20 0 BEADLO Nc1[nH+]cccc1-c1cnc2occc2c1 ZINC001243475353 985033397 /nfs/dbraw/zinc/03/33/97/985033397.db2.gz WKPQMZCOYMGGMI-UHFFFAOYSA-N 1 2 211.224 2.472 20 0 BEADLO Nc1[nH+]cccc1-c1cc2c(c(F)c1)C(=O)OC2 ZINC001243477887 985039219 /nfs/dbraw/zinc/03/92/19/985039219.db2.gz QSVJGRNYEFFQQK-UHFFFAOYSA-N 1 2 244.225 2.140 20 0 BEADLO Nc1[nH+]cccc1-c1cccc(-c2nc[nH]n2)c1 ZINC001243476863 985039931 /nfs/dbraw/zinc/03/99/31/985039931.db2.gz VTDCLYGOOPUKNL-UHFFFAOYSA-N 1 2 237.266 2.116 20 0 BEADLO O[C@@H]1CC[N@@H+](C2CCCCC2)CC1(F)F ZINC001257458948 985063884 /nfs/dbraw/zinc/06/38/84/985063884.db2.gz ISMIGSIEINALJN-SNVBAGLBSA-N 1 2 219.275 2.021 20 0 BEADLO O[C@@H]1CC[N@H+](C2CCCCC2)CC1(F)F ZINC001257458948 985063898 /nfs/dbraw/zinc/06/38/98/985063898.db2.gz ISMIGSIEINALJN-SNVBAGLBSA-N 1 2 219.275 2.021 20 0 BEADLO CCOc1cc(-c2c[nH+]cn2C)ccc1OC ZINC001243537360 985072593 /nfs/dbraw/zinc/07/25/93/985072593.db2.gz AGGIXZUHCUXYBE-UHFFFAOYSA-N 1 2 232.283 2.494 20 0 BEADLO Cc1nocc1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001243672448 985161317 /nfs/dbraw/zinc/16/13/17/985161317.db2.gz UBELPSJOHBGIFO-UHFFFAOYSA-N 1 2 240.266 2.290 20 0 BEADLO Cc1ccc(-c2cc(F)cc(CO)c2)[nH+]c1N ZINC001243693687 985220735 /nfs/dbraw/zinc/22/07/35/985220735.db2.gz DJIZFXPVOSQQDB-UHFFFAOYSA-N 1 2 232.258 2.271 20 0 BEADLO O=c1cccc(-c2cccc3[nH+]ccn32)[nH]1 ZINC001243739567 985277499 /nfs/dbraw/zinc/27/74/99/985277499.db2.gz UBIOPDJGLHDAAT-UHFFFAOYSA-N 1 2 211.224 2.102 20 0 BEADLO CO[C@@H]1CC=C(c2ccc[nH+]c2N)CC1 ZINC001243810911 985396701 /nfs/dbraw/zinc/39/67/01/985396701.db2.gz VZAKVLLBPAVOKJ-SNVBAGLBSA-N 1 2 204.273 2.246 20 0 BEADLO COCOc1cccc(-c2c[nH+]cn2C)c1 ZINC001243826147 985427717 /nfs/dbraw/zinc/42/77/17/985427717.db2.gz YRWCXOWZKVLYLU-UHFFFAOYSA-N 1 2 218.256 2.070 20 0 BEADLO c1n[nH]c2c1[C@H]([NH2+][C@H]1COC3(CCC3)C1)CCC2 ZINC000688285216 985604857 /nfs/dbraw/zinc/60/48/57/985604857.db2.gz XBVPEHUUSFJHMH-ZYHUDNBSSA-N 1 2 247.342 2.088 20 0 BEADLO c1nc2c(cccc2-c2cc[nH+]c3c2CCN3)[nH]1 ZINC001243935177 985618050 /nfs/dbraw/zinc/61/80/50/985618050.db2.gz SMKUESGMGGHIPI-UHFFFAOYSA-N 1 2 236.278 2.236 20 0 BEADLO c1ccc2c(c1)cnnc2C1=C[NH2+]CCC1 ZINC001243947662 985622998 /nfs/dbraw/zinc/62/29/98/985622998.db2.gz NZEDEGVCMTXKBY-UHFFFAOYSA-N 1 2 211.268 2.354 20 0 BEADLO c1nc(C2=C[NH2+]CCC2)cc(C2CC2)n1 ZINC001243948319 985629558 /nfs/dbraw/zinc/62/95/58/985629558.db2.gz AJZWCDQCDIHHBK-UHFFFAOYSA-N 1 2 201.273 2.078 20 0 BEADLO CCN(CC)c1cncc(C2=C[NH2+]CCC2)n1 ZINC001243949486 985635368 /nfs/dbraw/zinc/63/53/68/985635368.db2.gz NKGDVQISVDMBRX-UHFFFAOYSA-N 1 2 232.331 2.047 20 0 BEADLO c1coc(-c2cc(C3=C[NH2+]CCC3)ncn2)c1 ZINC001243949684 985643751 /nfs/dbraw/zinc/64/37/51/985643751.db2.gz XIYFVJBLCYANLY-UHFFFAOYSA-N 1 2 227.267 2.461 20 0 BEADLO COC(=O)Cc1ccccc1/C(C)=C/C=C/[NH3+] ZINC001243958146 985671175 /nfs/dbraw/zinc/67/11/75/985671175.db2.gz KEPPYPAEGHXBJW-MPEOSAONSA-N 1 2 231.295 2.278 20 0 BEADLO COc1cc(O)ccc1-c1c[nH+]c(N)c(C)c1 ZINC001243982554 985719415 /nfs/dbraw/zinc/71/94/15/985719415.db2.gz IFNNHUSNAVJBJY-UHFFFAOYSA-N 1 2 230.267 2.353 20 0 BEADLO CO[C@H]1CC=C(Nc2[nH+]cc(C)cc2N)CC1 ZINC001212873962 985827000 /nfs/dbraw/zinc/82/70/00/985827000.db2.gz YRMIWSYSSKUFES-NSHDSACASA-N 1 2 233.315 2.467 20 0 BEADLO Cc1ccccc1C(F)(F)C[NH2+][C@H](C)[C@H](C)O ZINC001327641978 985833393 /nfs/dbraw/zinc/83/33/93/985833393.db2.gz VVLUNNFPRQIXCB-MNOVXSKESA-N 1 2 243.297 2.446 20 0 BEADLO COC(=O)CC[C@H](C)[N@@H+]1Cc2cnc(C)cc2C1 ZINC001258375279 985856473 /nfs/dbraw/zinc/85/64/73/985856473.db2.gz PQKRKBJNLKKBNY-NSHDSACASA-N 1 2 248.326 2.047 20 0 BEADLO COC(=O)CC[C@H](C)[N@H+]1Cc2cnc(C)cc2C1 ZINC001258375279 985856486 /nfs/dbraw/zinc/85/64/86/985856486.db2.gz PQKRKBJNLKKBNY-NSHDSACASA-N 1 2 248.326 2.047 20 0 BEADLO CSc1ccccc1C[NH+]1CC2(CCN2C)C1 ZINC001276340736 986035959 /nfs/dbraw/zinc/03/59/59/986035959.db2.gz NBYZPSNZWIEOBB-UHFFFAOYSA-N 1 2 248.395 2.298 20 0 BEADLO CCc1nc(C[NH2+]Cc2cnc(C)s2)co1 ZINC001461515730 986065969 /nfs/dbraw/zinc/06/59/69/986065969.db2.gz QHFXLPMVMVXYPG-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO Cc1ccc2[nH+]c(NCc3cc[nH]n3)[nH]c2c1 ZINC001461710096 986117762 /nfs/dbraw/zinc/11/77/62/986117762.db2.gz OTGMRJDPDXHKPZ-UHFFFAOYSA-N 1 2 227.271 2.207 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@H](C)c2ncccc2C)n1 ZINC001461813250 986167716 /nfs/dbraw/zinc/16/77/16/986167716.db2.gz AOTDTNIYMOPRON-LLVKDONJSA-N 1 2 230.315 2.272 20 0 BEADLO COc1ccc(F)c(-c2cc(N)cc[nH+]2)c1OC ZINC001244590298 986271179 /nfs/dbraw/zinc/27/11/79/986271179.db2.gz DHZTUNLKACUGKS-UHFFFAOYSA-N 1 2 248.257 2.487 20 0 BEADLO CCc1noc(C)c1C[NH2+]Cc1ncccc1F ZINC001462263720 986329055 /nfs/dbraw/zinc/32/90/55/986329055.db2.gz HCXJBSJIUALJBN-UHFFFAOYSA-N 1 2 249.289 2.369 20 0 BEADLO C[N@@H+](CC(=O)c1ccccc1)C[C@@H](O)C(C)(C)C ZINC001253729700 986343801 /nfs/dbraw/zinc/34/38/01/986343801.db2.gz KQMGNXRBPCIJKQ-CQSZACIVSA-N 1 2 249.354 2.208 20 0 BEADLO C[N@H+](CC(=O)c1ccccc1)C[C@@H](O)C(C)(C)C ZINC001253729700 986343813 /nfs/dbraw/zinc/34/38/13/986343813.db2.gz KQMGNXRBPCIJKQ-CQSZACIVSA-N 1 2 249.354 2.208 20 0 BEADLO CCc1ncc(C[NH2+][C@H](C)c2ccccn2)o1 ZINC001262253851 986551679 /nfs/dbraw/zinc/55/16/79/986551679.db2.gz ABLUPHGLAPDLRK-SNVBAGLBSA-N 1 2 231.299 2.483 20 0 BEADLO CCc1ncc(C[NH2+][C@@H](C)c2ccccn2)o1 ZINC001262253850 986555366 /nfs/dbraw/zinc/55/53/66/986555366.db2.gz ABLUPHGLAPDLRK-JTQLQIEISA-N 1 2 231.299 2.483 20 0 BEADLO CNc1cc(-c2ccc3c(c2)C(=O)OC3)cc[nH+]1 ZINC001244974305 986556455 /nfs/dbraw/zinc/55/64/55/986556455.db2.gz VGQNIUUWENRNMQ-UHFFFAOYSA-N 1 2 240.262 2.461 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1ccc(F)cc1C ZINC001463685654 986570858 /nfs/dbraw/zinc/57/08/58/986570858.db2.gz VPNLUDFSHFLOOL-GFCCVEGCSA-N 1 2 236.290 2.167 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1ccc(F)cc1C ZINC001463685654 986570877 /nfs/dbraw/zinc/57/08/77/986570877.db2.gz VPNLUDFSHFLOOL-GFCCVEGCSA-N 1 2 236.290 2.167 20 0 BEADLO C[C@@H]1CCN(c2cc(N)nc[nH+]2)CC12CCC2 ZINC001262689333 986595956 /nfs/dbraw/zinc/59/59/56/986595956.db2.gz WPSONQZRJNOWNV-SNVBAGLBSA-N 1 2 232.331 2.075 20 0 BEADLO Clc1cc2c(cn1)C[N@@H+]([C@H]1CCCOC1)C2 ZINC001254386689 986611556 /nfs/dbraw/zinc/61/15/56/986611556.db2.gz BSMAWXXDMXOTOU-NSHDSACASA-N 1 2 238.718 2.230 20 0 BEADLO Clc1cc2c(cn1)C[N@H+]([C@H]1CCCOC1)C2 ZINC001254386689 986611560 /nfs/dbraw/zinc/61/15/60/986611560.db2.gz BSMAWXXDMXOTOU-NSHDSACASA-N 1 2 238.718 2.230 20 0 BEADLO Nc1[nH+]cccc1-c1cc(Cl)cc(CO)c1 ZINC001245089387 986661977 /nfs/dbraw/zinc/66/19/77/986661977.db2.gz YFZFKRTXASCJOK-UHFFFAOYSA-N 1 2 234.686 2.477 20 0 BEADLO CC(C)N(C(=O)Cc1c[nH+]cn1C)C1CCCC1 ZINC001464936523 986674713 /nfs/dbraw/zinc/67/47/13/986674713.db2.gz WUZYNWCIPAOOHF-UHFFFAOYSA-N 1 2 249.358 2.142 20 0 BEADLO c1cc(C2=CCCOC2)cc(N2CCCC2)[nH+]1 ZINC001245157879 986691434 /nfs/dbraw/zinc/69/14/34/986691434.db2.gz KQVXPOMPRBOTHH-UHFFFAOYSA-N 1 2 230.311 2.486 20 0 BEADLO COc1cc2[nH+]ccn2cc1C1=CCCOC1 ZINC001245161233 986710632 /nfs/dbraw/zinc/71/06/32/986710632.db2.gz GMWWJAQVVIKWSE-UHFFFAOYSA-N 1 2 230.267 2.147 20 0 BEADLO CO[C@@H]1C[N@H+](Cc2cc3ccccc3[nH]2)C[C@@H]1F ZINC001137313883 986752515 /nfs/dbraw/zinc/75/25/15/986752515.db2.gz YHTCNVPLQLNZSQ-GXTWGEPZSA-N 1 2 248.301 2.337 20 0 BEADLO CO[C@@H]1C[N@@H+](Cc2cc3ccccc3[nH]2)C[C@@H]1F ZINC001137313883 986752527 /nfs/dbraw/zinc/75/25/27/986752527.db2.gz YHTCNVPLQLNZSQ-GXTWGEPZSA-N 1 2 248.301 2.337 20 0 BEADLO Cc1cc(C)c(C[NH+]2CC(OC(C)C)C2)[nH]1 ZINC001137331076 986790013 /nfs/dbraw/zinc/79/00/13/986790013.db2.gz OIHVKLXQRXJVHF-UHFFFAOYSA-N 1 2 222.332 2.241 20 0 BEADLO CC/C=C\CNC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001466418409 986798326 /nfs/dbraw/zinc/79/83/26/986798326.db2.gz RPFQKTBBNLTQTJ-ARJAWSKDSA-N 1 2 244.298 2.422 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)N[C@H]1C=CCC1 ZINC001467068899 986835203 /nfs/dbraw/zinc/83/52/03/986835203.db2.gz XJUKOEGUXPKAEN-JTQLQIEISA-N 1 2 242.282 2.174 20 0 BEADLO C[N@H+](Cc1ccon1)Cc1c[nH]c2ncccc12 ZINC001137403398 986879503 /nfs/dbraw/zinc/87/95/03/986879503.db2.gz LRBMDROCPZKOIB-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO C[N@@H+](Cc1ccon1)Cc1c[nH]c2ncccc12 ZINC001137403398 986879511 /nfs/dbraw/zinc/87/95/11/986879511.db2.gz LRBMDROCPZKOIB-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO Cc1cc(-c2cccc(N(C)C)n2)c[nH+]c1N ZINC001245535506 986911569 /nfs/dbraw/zinc/91/15/69/986911569.db2.gz AHQVJJMPMZCRBH-UHFFFAOYSA-N 1 2 228.299 2.100 20 0 BEADLO Cc1cc(-c2ncc(F)cc2C)c[nH+]c1N ZINC001245536249 986912696 /nfs/dbraw/zinc/91/26/96/986912696.db2.gz NLLRJGGBHQHZPU-UHFFFAOYSA-N 1 2 217.247 2.482 20 0 BEADLO Cc1cc(-c2cccc(F)n2)c[nH+]c1N ZINC001245536294 986914787 /nfs/dbraw/zinc/91/47/87/986914787.db2.gz OOVCRKUFDNTOHQ-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO CCOc1cc(-c2c[nH+]c(N)c(C)c2)nc(C)n1 ZINC001245537265 986917216 /nfs/dbraw/zinc/91/72/16/986917216.db2.gz HTICYNNBUSGXOE-UHFFFAOYSA-N 1 2 244.298 2.136 20 0 BEADLO Cc1cc(-c2ccc3c(c2)C(=O)OC3)c[nH+]c1N ZINC001245537489 986919834 /nfs/dbraw/zinc/91/98/34/986919834.db2.gz FKZPWNXYHCCNRS-UHFFFAOYSA-N 1 2 240.262 2.310 20 0 BEADLO Cc1cc(-c2c[nH+]c(N)c(C)c2)c(F)cn1 ZINC001245537476 986920225 /nfs/dbraw/zinc/92/02/25/986920225.db2.gz FEQPZSYHWSGIBJ-UHFFFAOYSA-N 1 2 217.247 2.482 20 0 BEADLO Cc1cc(-c2ccc(F)nc2F)c[nH+]c1N ZINC001245537952 986922232 /nfs/dbraw/zinc/92/22/32/986922232.db2.gz HZQMXCVTVGLYNF-UHFFFAOYSA-N 1 2 221.210 2.312 20 0 BEADLO COc1ccc(-c2c[nH+]c(N)c(C)c2)c(N)c1 ZINC001245538972 986924509 /nfs/dbraw/zinc/92/45/09/986924509.db2.gz AZRNSZQZAHHMLO-UHFFFAOYSA-N 1 2 229.283 2.230 20 0 BEADLO Cc1cc(-c2cc(F)cnc2C)c[nH+]c1N ZINC001245540166 986926437 /nfs/dbraw/zinc/92/64/37/986926437.db2.gz RXWTVEVRVJFLTE-UHFFFAOYSA-N 1 2 217.247 2.482 20 0 BEADLO COc1nccc(C)c1-c1c[nH+]c(N)c(C)c1 ZINC001245539187 986926789 /nfs/dbraw/zinc/92/67/89/986926789.db2.gz UDQGYVPCXFHJIR-UHFFFAOYSA-N 1 2 229.283 2.351 20 0 BEADLO CCOc1ccncc1C[N@@H+]1C[C@@H](F)C[C@H]1C ZINC001139627283 986936372 /nfs/dbraw/zinc/93/63/72/986936372.db2.gz LJOLIVFOZRACNK-PWSUYJOCSA-N 1 2 238.306 2.413 20 0 BEADLO CCOc1ccncc1C[N@H+]1C[C@@H](F)C[C@H]1C ZINC001139627283 986936386 /nfs/dbraw/zinc/93/63/86/986936386.db2.gz LJOLIVFOZRACNK-PWSUYJOCSA-N 1 2 238.306 2.413 20 0 BEADLO COC[C@H](C)[N@@H+]1CCc2nc(Cl)ccc2C1 ZINC001255575577 987026827 /nfs/dbraw/zinc/02/68/27/987026827.db2.gz AOPPMGDKJMCIEQ-VIFPVBQESA-N 1 2 240.734 2.128 20 0 BEADLO COC[C@H](C)[N@H+]1CCc2nc(Cl)ccc2C1 ZINC001255575577 987026839 /nfs/dbraw/zinc/02/68/39/987026839.db2.gz AOPPMGDKJMCIEQ-VIFPVBQESA-N 1 2 240.734 2.128 20 0 BEADLO Cc1coc(C[NH2+][C@H](C)CC(F)(F)F)n1 ZINC001255632602 987035761 /nfs/dbraw/zinc/03/57/61/987035761.db2.gz JPQMJUMKLLXDFH-ZCFIWIBFSA-N 1 2 222.210 2.414 20 0 BEADLO Cc1cc(-c2ccc3nncn3c2)c2[nH+]ccn2c1 ZINC001245660590 987050113 /nfs/dbraw/zinc/05/01/13/987050113.db2.gz QXQUYFXTHURPOS-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO CC1(C)C[C@@H]1C(=O)OCc1cccc2[nH+]ccn21 ZINC000752521936 987109029 /nfs/dbraw/zinc/10/90/29/987109029.db2.gz DRNCDXGZTZIHNI-LLVKDONJSA-N 1 2 244.294 2.424 20 0 BEADLO CCCC(=O)N1CCC[C@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001471860492 987132342 /nfs/dbraw/zinc/13/23/42/987132342.db2.gz ZQKCYMSLXILUJA-NSHDSACASA-N 1 2 235.331 2.490 20 0 BEADLO C[C@@H]1CCC[C@@H]1N1N=C(C2CC[NH2+]CC2)CC1=O ZINC001245918077 987152255 /nfs/dbraw/zinc/15/22/55/987152255.db2.gz VHWRRRCOXJBUIQ-MFKMUULPSA-N 1 2 249.358 2.417 20 0 BEADLO O=C1CC(C2CC[NH2+]CC2)=NN1C1CCCC1 ZINC001245917854 987154141 /nfs/dbraw/zinc/15/41/41/987154141.db2.gz ORYVKJIPXCORRM-UHFFFAOYSA-N 1 2 235.331 2.171 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@H]2CC[C@H](C)CC2)c[nH+]1 ZINC001472020091 987157787 /nfs/dbraw/zinc/15/77/87/987157787.db2.gz CBVAJBCQJRBAQE-XYPYZODXSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@H]2CC[C@H](C)CC2)[nH+]1 ZINC001472020091 987157806 /nfs/dbraw/zinc/15/78/06/987157806.db2.gz CBVAJBCQJRBAQE-XYPYZODXSA-N 1 2 249.358 2.415 20 0 BEADLO CCOC(=O)C1([NH2+][C@@H](C)CCC(C)C)CC1 ZINC001256353696 987176105 /nfs/dbraw/zinc/17/61/05/987176105.db2.gz YIIOFBAERHXXSG-NSHDSACASA-N 1 2 227.348 2.496 20 0 BEADLO OC1(C[N@@H+]2CCC(F)(F)C2)CCCCCC1 ZINC001473334331 987399546 /nfs/dbraw/zinc/39/95/46/987399546.db2.gz OWDAMCJYTYJCMZ-UHFFFAOYSA-N 1 2 233.302 2.413 20 0 BEADLO OC1(C[N@H+]2CCC(F)(F)C2)CCCCCC1 ZINC001473334331 987399556 /nfs/dbraw/zinc/39/95/56/987399556.db2.gz OWDAMCJYTYJCMZ-UHFFFAOYSA-N 1 2 233.302 2.413 20 0 BEADLO CC[C@@H]1CCC[C@H]1NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001116252934 987493223 /nfs/dbraw/zinc/49/32/23/987493223.db2.gz QXTHZJKYVPNNCQ-QJPTWQEYSA-N 1 2 235.331 2.139 20 0 BEADLO Cc1[nH]c([C@@H]2CCCN2Cc2cn[nH]c2)[nH+]c1C ZINC001473788918 987556430 /nfs/dbraw/zinc/55/64/30/987556430.db2.gz SZANKDYGTGEYBM-LBPRGKRZSA-N 1 2 245.330 2.087 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001116464203 987589553 /nfs/dbraw/zinc/58/95/53/987589553.db2.gz TYLPUJOIPHAJJM-IJLUTSLNSA-N 1 2 235.331 2.234 20 0 BEADLO CC(C)COC(=O)C[N@@H+]1CC(C)(C)C1(C)C ZINC001116479125 987596744 /nfs/dbraw/zinc/59/67/44/987596744.db2.gz JPJWRKIKOOYFDW-UHFFFAOYSA-N 1 2 227.348 2.306 20 0 BEADLO CC(C)COC(=O)C[N@H+]1CC(C)(C)C1(C)C ZINC001116479125 987596750 /nfs/dbraw/zinc/59/67/50/987596750.db2.gz JPJWRKIKOOYFDW-UHFFFAOYSA-N 1 2 227.348 2.306 20 0 BEADLO CSCC[N@@H+]1CC(F)(F)CC[C@H]1C ZINC001473880098 987601619 /nfs/dbraw/zinc/60/16/19/987601619.db2.gz RGXWFCJDOYOYBT-MRVPVSSYSA-N 1 2 209.305 2.469 20 0 BEADLO CSCC[N@H+]1CC(F)(F)CC[C@H]1C ZINC001473880098 987601625 /nfs/dbraw/zinc/60/16/25/987601625.db2.gz RGXWFCJDOYOYBT-MRVPVSSYSA-N 1 2 209.305 2.469 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ncccc2C)nn1C ZINC001473880429 987603438 /nfs/dbraw/zinc/60/34/38/987603438.db2.gz ZDBHQWLEPIUWRJ-LBPRGKRZSA-N 1 2 244.342 2.283 20 0 BEADLO Cc1nnc2n1CC[N@@H+](CC1(C)CCC1)[C@H]2C ZINC001473906060 987610186 /nfs/dbraw/zinc/61/01/86/987610186.db2.gz SZGQPVXBJKBMIW-JTQLQIEISA-N 1 2 234.347 2.153 20 0 BEADLO Cc1nnc2n1CC[N@H+](CC1(C)CCC1)[C@H]2C ZINC001473906060 987610192 /nfs/dbraw/zinc/61/01/92/987610192.db2.gz SZGQPVXBJKBMIW-JTQLQIEISA-N 1 2 234.347 2.153 20 0 BEADLO Cc1nnc2n1CC[N@@H+](CC1(C)CCC1)[C@@H]2C ZINC001473906061 987611906 /nfs/dbraw/zinc/61/19/06/987611906.db2.gz SZGQPVXBJKBMIW-SNVBAGLBSA-N 1 2 234.347 2.153 20 0 BEADLO Cc1nnc2n1CC[N@H+](CC1(C)CCC1)[C@@H]2C ZINC001473906061 987611912 /nfs/dbraw/zinc/61/19/12/987611912.db2.gz SZGQPVXBJKBMIW-SNVBAGLBSA-N 1 2 234.347 2.153 20 0 BEADLO C[C@@H]1CC[C@@H](N[C@H]2C[NH2+]CC[C@H]2F)C[C@@H]1C ZINC001246218273 987617304 /nfs/dbraw/zinc/61/73/04/987617304.db2.gz RUKUIMGTZSITBT-MLGHIDQZSA-N 1 2 228.355 2.101 20 0 BEADLO C[C@@H]1CC[C@@H]([NH2+][C@H]2CNCC[C@H]2F)C[C@@H]1C ZINC001246218273 987617308 /nfs/dbraw/zinc/61/73/08/987617308.db2.gz RUKUIMGTZSITBT-MLGHIDQZSA-N 1 2 228.355 2.101 20 0 BEADLO CCn1ccnc1C[NH2+][C@@H](C)c1ncccc1C ZINC001474298188 987678497 /nfs/dbraw/zinc/67/84/97/987678497.db2.gz NPQTVHKTNNWAPC-LBPRGKRZSA-N 1 2 244.342 2.457 20 0 BEADLO c1n[nH]c(C[NH2+]C2CCC3(CCC3)CC2)n1 ZINC001474306114 987681839 /nfs/dbraw/zinc/68/18/39/987681839.db2.gz ARMVWXWWAFLZPA-UHFFFAOYSA-N 1 2 220.320 2.007 20 0 BEADLO Cc1cc(C[N@H+]2CCSCC[C@H]2C)n[nH]1 ZINC001116771115 987704270 /nfs/dbraw/zinc/70/42/70/987704270.db2.gz NTGKYOBTCQZRJK-SNVBAGLBSA-N 1 2 225.361 2.046 20 0 BEADLO Cc1cc(C[N@@H+]2CCSCC[C@H]2C)n[nH]1 ZINC001116771115 987704276 /nfs/dbraw/zinc/70/42/76/987704276.db2.gz NTGKYOBTCQZRJK-SNVBAGLBSA-N 1 2 225.361 2.046 20 0 BEADLO COc1nsc(C[N@@H+]2C[C@@H]3C[C@@H]3C2)c1Cl ZINC001474647023 987788908 /nfs/dbraw/zinc/78/89/08/987788908.db2.gz KLKDZIYIGIMMKN-KNVOCYPGSA-N 1 2 244.747 2.257 20 0 BEADLO COc1nsc(C[N@H+]2C[C@@H]3C[C@@H]3C2)c1Cl ZINC001474647023 987788912 /nfs/dbraw/zinc/78/89/12/987788912.db2.gz KLKDZIYIGIMMKN-KNVOCYPGSA-N 1 2 244.747 2.257 20 0 BEADLO CCn1cnc(Cl)c1C[N@H+](C)CCCF ZINC001474713101 987805148 /nfs/dbraw/zinc/80/51/48/987805148.db2.gz BITYEHKLSVMEMD-UHFFFAOYSA-N 1 2 233.718 2.348 20 0 BEADLO CCn1cnc(Cl)c1C[N@@H+](C)CCCF ZINC001474713101 987805152 /nfs/dbraw/zinc/80/51/52/987805152.db2.gz BITYEHKLSVMEMD-UHFFFAOYSA-N 1 2 233.718 2.348 20 0 BEADLO C[C@H]1C[C@H](N[C@@H]2C[NH2+]CC2(F)F)C[C@@H](C)C1 ZINC001246456446 987812135 /nfs/dbraw/zinc/81/21/35/987812135.db2.gz AOESSGJAFBPISP-VPOLOUISSA-N 1 2 232.318 2.008 20 0 BEADLO Cc1cc(CN2CCn3c[nH+]cc3C2)c(C)o1 ZINC001117642354 987852145 /nfs/dbraw/zinc/85/21/45/987852145.db2.gz XIFDJFBOMDDJKV-UHFFFAOYSA-N 1 2 231.299 2.109 20 0 BEADLO CCC(C)(C)N(C)C(=O)[C@H](C)n1cc[nH+]c1 ZINC001321481857 987920621 /nfs/dbraw/zinc/92/06/21/987920621.db2.gz GCVKNWRTIRCQFP-JTQLQIEISA-N 1 2 223.320 2.091 20 0 BEADLO CC(C)SCCSCC[NH+]1CCOCC1 ZINC001322037020 988083563 /nfs/dbraw/zinc/08/35/63/988083563.db2.gz JJNHIYXFZCXXEG-UHFFFAOYSA-N 1 2 249.445 2.193 20 0 BEADLO C[C@@H](c1cccs1)c1nnc(C[NH+](C)C)o1 ZINC001322340774 988212044 /nfs/dbraw/zinc/21/20/44/988212044.db2.gz UZXUITRWVQQBJX-QMMMGPOBSA-N 1 2 237.328 2.345 20 0 BEADLO CC[C@@H]1CCC[C@@H]1c1nnc(C[NH+](C)C)o1 ZINC001118371897 988261727 /nfs/dbraw/zinc/26/17/27/988261727.db2.gz JCKXVZNAWGANLC-ZJUUUORDSA-N 1 2 223.320 2.425 20 0 BEADLO Cc1cccc(Cc2nnc(C[NH+](C)C)o2)c1 ZINC001322583857 988333741 /nfs/dbraw/zinc/33/37/41/988333741.db2.gz XCEWTHVIVRBAIJ-UHFFFAOYSA-N 1 2 231.299 2.030 20 0 BEADLO Cc1c[nH]c(Nc2ncnc3ccsc32)[nH+]1 ZINC001322727885 988372484 /nfs/dbraw/zinc/37/24/84/988372484.db2.gz UETDIWXLKQILSZ-UHFFFAOYSA-N 1 2 231.284 2.466 20 0 BEADLO CC[C@H](CC(C)C)[N@@H+]1CC[C@H](N)C(F)(F)C1 ZINC001246839538 988537619 /nfs/dbraw/zinc/53/76/19/988537619.db2.gz XXDPANXSGUASSF-MNOVXSKESA-N 1 2 234.334 2.479 20 0 BEADLO CC[C@H](CC(C)C)[N@H+]1CC[C@H](N)C(F)(F)C1 ZINC001246839538 988537631 /nfs/dbraw/zinc/53/76/31/988537631.db2.gz XXDPANXSGUASSF-MNOVXSKESA-N 1 2 234.334 2.479 20 0 BEADLO C/C=C(\C)C(=O)N(C)C1C[NH+](CC=C(C)C)C1 ZINC001323909990 988650609 /nfs/dbraw/zinc/65/06/09/988650609.db2.gz YMRVALIVLYHRQA-WUXMJOGZSA-N 1 2 236.359 2.061 20 0 BEADLO CCC[C@H](C)Cc1nnc(C[NH+](C)C)o1 ZINC001324177314 988737182 /nfs/dbraw/zinc/73/71/82/988737182.db2.gz CWWFGSSBJWDMNF-VIFPVBQESA-N 1 2 211.309 2.110 20 0 BEADLO Cn1cc(COc2cc[nH+]cc2)c(C(F)F)n1 ZINC001324217508 988754310 /nfs/dbraw/zinc/75/43/10/988754310.db2.gz NXPGMUQFJFJRTN-UHFFFAOYSA-N 1 2 239.225 2.332 20 0 BEADLO C[C@H](NC(=O)Cc1[nH]cc[nH+]1)[C@]12C[C@H]1CCCC2 ZINC001118991354 988779428 /nfs/dbraw/zinc/77/94/28/988779428.db2.gz VDEOMCNKDYDALF-WDMOLILDSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H]([NH3+])c1nc2ccc3ncccc3c2[nH]1 ZINC001247015545 988839104 /nfs/dbraw/zinc/83/91/04/988839104.db2.gz ZKXXAQOJHJQHGE-ZETCQYMHSA-N 1 2 212.256 2.131 20 0 BEADLO C[C@@H](C(=O)NC[C@@H]1CCCC1(C)C)n1cc[nH+]c1 ZINC001324454995 988846632 /nfs/dbraw/zinc/84/66/32/988846632.db2.gz VAZKDELTKILEET-RYUDHWBXSA-N 1 2 249.358 2.387 20 0 BEADLO Cc1cccc(-c2noc(Cc3c[nH]c[nH+]3)n2)c1 ZINC001247137532 988852353 /nfs/dbraw/zinc/85/23/53/988852353.db2.gz KMUUNEVASQGCQW-UHFFFAOYSA-N 1 2 240.266 2.359 20 0 BEADLO FC[C@H]1CCC[N@H+](Cc2nc(C3CC3)no2)C1 ZINC001119268539 988871832 /nfs/dbraw/zinc/87/18/32/988871832.db2.gz ILJRJAUZHGBVLJ-SECBINFHSA-N 1 2 239.294 2.129 20 0 BEADLO FC[C@H]1CCC[N@@H+](Cc2nc(C3CC3)no2)C1 ZINC001119268539 988871835 /nfs/dbraw/zinc/87/18/35/988871835.db2.gz ILJRJAUZHGBVLJ-SECBINFHSA-N 1 2 239.294 2.129 20 0 BEADLO Cc1cn[nH]c1C[NH+]1CC(c2ccc(F)cc2)C1 ZINC001324711985 988943521 /nfs/dbraw/zinc/94/35/21/988943521.db2.gz ZJEUAJHCSGGIGW-UHFFFAOYSA-N 1 2 245.301 2.457 20 0 BEADLO Cc1cnc(N2CCC[C@H](n3cc[nH+]c3)C2)o1 ZINC001119401951 989040856 /nfs/dbraw/zinc/04/08/56/989040856.db2.gz LOUYWTIOOHGVJZ-NSHDSACASA-N 1 2 232.287 2.021 20 0 BEADLO CC(C)[C@H](Cc1ccccc1)[NH2+]Cc1ncn[nH]1 ZINC001119435202 989067112 /nfs/dbraw/zinc/06/71/12/989067112.db2.gz MVHLWOWGKAZDAG-ZDUSSCGKSA-N 1 2 244.342 2.162 20 0 BEADLO CO[C@H](C)CN(C)c1cc(F)cc(C)[nH+]1 ZINC001515753057 989110828 /nfs/dbraw/zinc/11/08/28/989110828.db2.gz GZFPUIBBBOUDKY-SECBINFHSA-N 1 2 212.268 2.000 20 0 BEADLO COC1(C)C[NH+](Cc2ccc3onc(C)c3c2)C1 ZINC001248686985 989125380 /nfs/dbraw/zinc/12/53/80/989125380.db2.gz CPDVQLIKVDOXQZ-UHFFFAOYSA-N 1 2 246.310 2.357 20 0 BEADLO Cc1cc(C[N@@H+]2CCC23COC3)cs1 ZINC001248803068 989155368 /nfs/dbraw/zinc/15/53/68/989155368.db2.gz DXSPLMOUERUZHH-UHFFFAOYSA-N 1 2 209.314 2.031 20 0 BEADLO Cc1cc(C[N@H+]2CCC23COC3)cs1 ZINC001248803068 989155372 /nfs/dbraw/zinc/15/53/72/989155372.db2.gz DXSPLMOUERUZHH-UHFFFAOYSA-N 1 2 209.314 2.031 20 0 BEADLO c1cc2n(c1C[NH+]1CC3(C1)CCCCO3)CCC2 ZINC001248821819 989178601 /nfs/dbraw/zinc/17/86/01/989178601.db2.gz NOAHOQACIMMJRI-UHFFFAOYSA-N 1 2 246.354 2.189 20 0 BEADLO C[N@H+](Cc1ccno1)Cc1ccc2n1CCC2 ZINC001248824816 989185358 /nfs/dbraw/zinc/18/53/58/989185358.db2.gz DFCLKVCUOHPYKX-UHFFFAOYSA-N 1 2 231.299 2.054 20 0 BEADLO C[N@@H+](Cc1ccno1)Cc1ccc2n1CCC2 ZINC001248824816 989185363 /nfs/dbraw/zinc/18/53/63/989185363.db2.gz DFCLKVCUOHPYKX-UHFFFAOYSA-N 1 2 231.299 2.054 20 0 BEADLO CC(C)OC1C[NH+](Cc2ccc3n2CCC3)C1 ZINC001248825226 989194469 /nfs/dbraw/zinc/19/44/69/989194469.db2.gz VWCMNTNUHSJFPU-UHFFFAOYSA-N 1 2 234.343 2.044 20 0 BEADLO Cc1ccc2[nH]c(C[NH+]3CC(C)C3)nc2c1 ZINC001248839247 989194991 /nfs/dbraw/zinc/19/49/91/989194991.db2.gz BEGAINCISKSOBM-UHFFFAOYSA-N 1 2 215.300 2.323 20 0 BEADLO Cc1ccc2nc(C[NH+]3CC(C)C3)[nH]c2c1 ZINC001248839247 989195004 /nfs/dbraw/zinc/19/50/04/989195004.db2.gz BEGAINCISKSOBM-UHFFFAOYSA-N 1 2 215.300 2.323 20 0 BEADLO CCCO[C@@H]1CC[N@H+](Cc2nc(C)cc(C)n2)C1 ZINC001248965979 989230189 /nfs/dbraw/zinc/23/01/89/989230189.db2.gz QMACYOHIPOJMLE-CYBMUJFWSA-N 1 2 249.358 2.094 20 0 BEADLO CCCO[C@@H]1CC[N@@H+](Cc2nc(C)cc(C)n2)C1 ZINC001248965979 989230200 /nfs/dbraw/zinc/23/02/00/989230200.db2.gz QMACYOHIPOJMLE-CYBMUJFWSA-N 1 2 249.358 2.094 20 0 BEADLO COCC[N@H+](C)Cc1cc(C)c(C)nc1Cl ZINC001248987239 989237829 /nfs/dbraw/zinc/23/78/29/989237829.db2.gz COJONLWXOVOAFF-UHFFFAOYSA-N 1 2 242.750 2.430 20 0 BEADLO COCC[N@@H+](C)Cc1cc(C)c(C)nc1Cl ZINC001248987239 989237837 /nfs/dbraw/zinc/23/78/37/989237837.db2.gz COJONLWXOVOAFF-UHFFFAOYSA-N 1 2 242.750 2.430 20 0 BEADLO CC[N@H+](C)Cc1nc2ccc(OC)cc2[nH]1 ZINC001249410794 989274927 /nfs/dbraw/zinc/27/49/27/989274927.db2.gz FZJJOSZJZBQGNA-UHFFFAOYSA-N 1 2 219.288 2.023 20 0 BEADLO CC[N@@H+](C)Cc1nc2ccc(OC)cc2[nH]1 ZINC001249410794 989274945 /nfs/dbraw/zinc/27/49/45/989274945.db2.gz FZJJOSZJZBQGNA-UHFFFAOYSA-N 1 2 219.288 2.023 20 0 BEADLO COc1ccc2[nH]c(C[NH+]3CC(C)C3)nc2c1 ZINC001249411980 989276531 /nfs/dbraw/zinc/27/65/31/989276531.db2.gz QHZZWWYKIRZOLN-UHFFFAOYSA-N 1 2 231.299 2.023 20 0 BEADLO Cc1c(N)c(F)ccc1N(C)c1[nH+]cccc1N ZINC001249630655 989326192 /nfs/dbraw/zinc/32/61/92/989326192.db2.gz RNTUQJFYNCOWPB-UHFFFAOYSA-N 1 2 246.289 2.461 20 0 BEADLO CCCN(CC1CC1)C(=O)CCc1[nH+]ccn1C ZINC001518759014 989335887 /nfs/dbraw/zinc/33/58/87/989335887.db2.gz BZYFMJJDXNHHKK-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO Cn1c[nH+]cc1CCCOC(=O)CC1CCC1 ZINC001519059761 989374533 /nfs/dbraw/zinc/37/45/33/989374533.db2.gz GHTRHTIXZUBUFW-UHFFFAOYSA-N 1 2 236.315 2.086 20 0 BEADLO C[C@H](C(=O)NC1(C)C(C)(C)C1(C)C)n1cc[nH+]c1 ZINC001119998931 989550496 /nfs/dbraw/zinc/55/04/96/989550496.db2.gz BDCUSZJNLBSJMC-SNVBAGLBSA-N 1 2 249.358 2.385 20 0 BEADLO CCn1c[nH+]cc1COC(=O)Cc1occc1C ZINC001520443235 989567679 /nfs/dbraw/zinc/56/76/79/989567679.db2.gz ZBKBASCONPTCAR-UHFFFAOYSA-N 1 2 248.282 2.090 20 0 BEADLO CCN(C(=O)[C@H](C)n1cc[nH+]c1)[C@@H](C)C(C)C ZINC001326800666 989723777 /nfs/dbraw/zinc/72/37/77/989723777.db2.gz SBHNAKZXMAYLRS-RYUDHWBXSA-N 1 2 237.347 2.337 20 0 BEADLO C[C@H](NC(=O)c1cccc2[nH+]ccn21)C1(C)CC1 ZINC001120806461 989893053 /nfs/dbraw/zinc/89/30/53/989893053.db2.gz WFUKRAZRYPQVJG-JTQLQIEISA-N 1 2 243.310 2.253 20 0 BEADLO CO[C@@H]1CCCN(c2cc(F)cc(C)[nH+]2)C1 ZINC001120811829 989894781 /nfs/dbraw/zinc/89/47/81/989894781.db2.gz CRARMXGVOWBGTO-LLVKDONJSA-N 1 2 224.279 2.144 20 0 BEADLO COCC1=CCN(c2cc(F)cc(C)[nH+]2)CC1 ZINC001120837490 989915139 /nfs/dbraw/zinc/91/51/39/989915139.db2.gz XAXGDLKVCNGVHC-UHFFFAOYSA-N 1 2 236.290 2.312 20 0 BEADLO C[C@@H](C(=O)N1CC[C@@H]1C(C)(C)C)n1cc[nH+]c1 ZINC001120850430 989920615 /nfs/dbraw/zinc/92/06/15/989920615.db2.gz VRSPVYJWDJLVDV-WDEREUQCSA-N 1 2 235.331 2.091 20 0 BEADLO C[C@H](C(=O)N1CC[C@@H]1C(C)(C)C)n1cc[nH+]c1 ZINC001120850388 989921462 /nfs/dbraw/zinc/92/14/62/989921462.db2.gz VRSPVYJWDJLVDV-GHMZBOCLSA-N 1 2 235.331 2.091 20 0 BEADLO CCc1ccc(N(C)[C@H]2CC[C@@H]2OC)[nH+]c1 ZINC001120880967 989944146 /nfs/dbraw/zinc/94/41/46/989944146.db2.gz DVABYOFNVMZZOE-RYUDHWBXSA-N 1 2 220.316 2.258 20 0 BEADLO CCc1ccc(N2CCC[C@H](OC)C2)[nH+]c1 ZINC001120897228 989955566 /nfs/dbraw/zinc/95/55/66/989955566.db2.gz UBWKAVOSQRBSNO-LBPRGKRZSA-N 1 2 220.316 2.259 20 0 BEADLO Cn1c2ccccc2[nH+]c1N[C@@H]1C[C@@H]2CC[C@H]1O2 ZINC001120956161 989986966 /nfs/dbraw/zinc/98/69/66/989986966.db2.gz DRVZMCBOIJRYDG-UFGOTCBOSA-N 1 2 243.310 2.305 20 0 BEADLO CO[C@H]1CC[C@H]1N(C)c1cc(F)cc(C)[nH+]1 ZINC001120965214 989988646 /nfs/dbraw/zinc/98/86/46/989988646.db2.gz FMBDFJQIWAVRAU-MNOVXSKESA-N 1 2 224.279 2.143 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H](C)C1CC1 ZINC001121232018 990054317 /nfs/dbraw/zinc/05/43/17/990054317.db2.gz TZUJDMQXMCFPGU-JTQLQIEISA-N 1 2 218.300 2.105 20 0 BEADLO CC=CC=CC(=O)Nc1c(C)c[nH+]cc1C ZINC001534712553 990455601 /nfs/dbraw/zinc/45/56/01/990455601.db2.gz MIYZUOKUNCEAPF-DEQVHDEQSA-N 1 2 216.284 2.191 20 0 BEADLO CC=CC=CC(=O)Nc1c(C)c[nH+]cc1C ZINC001534712554 990455818 /nfs/dbraw/zinc/45/58/18/990455818.db2.gz MIYZUOKUNCEAPF-YTXTXJHMSA-N 1 2 216.284 2.191 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1ccc(C)c(F)c1 ZINC001538612095 990537807 /nfs/dbraw/zinc/53/78/07/990537807.db2.gz AONXIAHNODOTDI-GFCCVEGCSA-N 1 2 236.290 2.167 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1ccc(C)c(F)c1 ZINC001538612095 990537813 /nfs/dbraw/zinc/53/78/13/990537813.db2.gz AONXIAHNODOTDI-GFCCVEGCSA-N 1 2 236.290 2.167 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1cccc(Cl)c1 ZINC001538812901 990544703 /nfs/dbraw/zinc/54/47/03/990544703.db2.gz MWRHVEDGABONNO-NSHDSACASA-N 1 2 238.718 2.373 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1cccc(Cl)c1 ZINC001538812901 990544711 /nfs/dbraw/zinc/54/47/11/990544711.db2.gz MWRHVEDGABONNO-NSHDSACASA-N 1 2 238.718 2.373 20 0 BEADLO CCn1c[nH+]cc1COC(=O)c1coc(C)c1 ZINC001123473458 990588845 /nfs/dbraw/zinc/58/88/45/990588845.db2.gz QRYIBWIKPIBWRS-UHFFFAOYSA-N 1 2 234.255 2.161 20 0 BEADLO C[C@@H](CNC(=O)c1cccc2[nH+]ccn21)C1CC1 ZINC001542300842 990663163 /nfs/dbraw/zinc/66/31/63/990663163.db2.gz PHGNBDGYRHBAHF-JTQLQIEISA-N 1 2 243.310 2.110 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CCCC[C@H]1C(C)C ZINC001543544331 990696098 /nfs/dbraw/zinc/69/60/98/990696098.db2.gz AZIHQFNIZCYJJL-ZDUSSCGKSA-N 1 2 249.358 2.298 20 0 BEADLO C/C(=C/C(=O)NCCc1[nH+]ccn1C)C(C)(C)C ZINC001123922055 990704176 /nfs/dbraw/zinc/70/41/76/990704176.db2.gz UCISTLBLNIKFCV-KHPPLWFESA-N 1 2 249.358 2.071 20 0 BEADLO C[C@@H]1C[C@@H](C)N(C(=O)c2cccc3[nH+]ccn32)C1 ZINC001544455982 990722719 /nfs/dbraw/zinc/72/27/19/990722719.db2.gz LQNSRYWCOHKLSK-GHMZBOCLSA-N 1 2 243.310 2.205 20 0 BEADLO CC[C@@H]1CCN(C(=O)[C@H](C)n2cc[nH+]c2)[C@H]1C ZINC001556273595 990815758 /nfs/dbraw/zinc/81/57/58/990815758.db2.gz ULTBDIHHELGIPX-SDDRHHMPSA-N 1 2 235.331 2.091 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1ccc(F)nc1 ZINC001137735142 990844958 /nfs/dbraw/zinc/84/49/58/990844958.db2.gz FRDNMHLBMCGQDK-PSASIEDQSA-N 1 2 212.243 2.153 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1ccc(F)nc1 ZINC001137735142 990844962 /nfs/dbraw/zinc/84/49/62/990844962.db2.gz FRDNMHLBMCGQDK-PSASIEDQSA-N 1 2 212.243 2.153 20 0 BEADLO CO[C@@H](C)C1C[NH+](Cc2scnc2Cl)C1 ZINC001137824932 990853425 /nfs/dbraw/zinc/85/34/25/990853425.db2.gz PUEBNOQREFBVTF-ZETCQYMHSA-N 1 2 246.763 2.263 20 0 BEADLO CC1C[NH+](Cc2cccc3c2OC(F)(F)O3)C1 ZINC001138065674 990879575 /nfs/dbraw/zinc/87/95/75/990879575.db2.gz YDEBSFVNZRTCBR-UHFFFAOYSA-N 1 2 241.237 2.460 20 0 BEADLO C[C@@H]1CCCCCN1C(=O)CCc1[nH+]ccn1C ZINC001138368085 990924966 /nfs/dbraw/zinc/92/49/66/990924966.db2.gz CMKBFXPGFSMEDW-GFCCVEGCSA-N 1 2 249.358 2.144 20 0 BEADLO CC[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)[C@H]1C ZINC001138451238 990947317 /nfs/dbraw/zinc/94/73/17/990947317.db2.gz AWYDFACGXJGTJL-IRCOFANPSA-N 1 2 247.342 2.160 20 0 BEADLO CC[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)[C@H]1C ZINC001138451238 990947322 /nfs/dbraw/zinc/94/73/22/990947322.db2.gz AWYDFACGXJGTJL-IRCOFANPSA-N 1 2 247.342 2.160 20 0 BEADLO Cc1cccc(O[C@H](C)C[NH2+]Cc2ccn[nH]2)c1 ZINC001308275637 990953945 /nfs/dbraw/zinc/95/39/45/990953945.db2.gz UGVZHAYTJHRBSR-GFCCVEGCSA-N 1 2 245.326 2.275 20 0 BEADLO Cc1ccc(O[C@@H](C)C[NH2+]Cc2ccn[nH]2)cc1 ZINC001308285726 990958257 /nfs/dbraw/zinc/95/82/57/990958257.db2.gz JQYFKVXVVGBFFP-LBPRGKRZSA-N 1 2 245.326 2.275 20 0 BEADLO CCOC(=O)CCC[C@@H](C)[N@H+](C)CC(F)F ZINC001258134010 991030201 /nfs/dbraw/zinc/03/02/01/991030201.db2.gz VIGISNFQMXTNJW-SECBINFHSA-N 1 2 237.290 2.305 20 0 BEADLO CCOC(=O)CCC[C@@H](C)[N@@H+](C)CC(F)F ZINC001258134010 991030208 /nfs/dbraw/zinc/03/02/08/991030208.db2.gz VIGISNFQMXTNJW-SECBINFHSA-N 1 2 237.290 2.305 20 0 BEADLO F[C@H]1CCC[N@H+](Cc2cccc3ccnn32)C1 ZINC001138806845 991063406 /nfs/dbraw/zinc/06/34/06/991063406.db2.gz QZCUORCHGXSJNQ-NSHDSACASA-N 1 2 233.290 2.268 20 0 BEADLO F[C@H]1CCC[N@@H+](Cc2cccc3ccnn32)C1 ZINC001138806845 991063413 /nfs/dbraw/zinc/06/34/13/991063413.db2.gz QZCUORCHGXSJNQ-NSHDSACASA-N 1 2 233.290 2.268 20 0 BEADLO CCOC(=O)C(C)(C)[NH2+][C@H](C)CCSC ZINC001258202894 991086801 /nfs/dbraw/zinc/08/68/01/991086801.db2.gz ZFQRBVHJFBZSCX-SECBINFHSA-N 1 2 233.377 2.059 20 0 BEADLO Fc1cnc(Cl)c(C[N@@H+]2C[C@@H]3C[C@@H]3C2)c1 ZINC001138892915 991095188 /nfs/dbraw/zinc/09/51/88/991095188.db2.gz TWQBDWXZQXJECB-OCAPTIKFSA-N 1 2 226.682 2.326 20 0 BEADLO Fc1cnc(Cl)c(C[N@H+]2C[C@@H]3C[C@@H]3C2)c1 ZINC001138892915 991095199 /nfs/dbraw/zinc/09/51/99/991095199.db2.gz TWQBDWXZQXJECB-OCAPTIKFSA-N 1 2 226.682 2.326 20 0 BEADLO FCC[NH2+]Cc1c(Cl)ccnc1Cl ZINC001308727229 991111926 /nfs/dbraw/zinc/11/19/26/991111926.db2.gz BVQJCOHKSNCPFR-UHFFFAOYSA-N 1 2 223.078 2.448 20 0 BEADLO CCCCOc1cccc(C[NH+]2CC(O)C2)c1 ZINC001138952291 991114937 /nfs/dbraw/zinc/11/49/37/991114937.db2.gz MSFDQJZYNXPIND-UHFFFAOYSA-N 1 2 235.327 2.042 20 0 BEADLO CC(C)Oc1cccc(C[N@H+]2C[C@H]3C[C@@H](C2)O3)c1 ZINC001138985800 991119010 /nfs/dbraw/zinc/11/90/10/991119010.db2.gz IYPJPMLWFVQQND-GASCZTMLSA-N 1 2 247.338 2.447 20 0 BEADLO CC(C)Oc1cccc(C[N@@H+]2C[C@H]3C[C@@H](C2)O3)c1 ZINC001138985800 991119016 /nfs/dbraw/zinc/11/90/16/991119016.db2.gz IYPJPMLWFVQQND-GASCZTMLSA-N 1 2 247.338 2.447 20 0 BEADLO CCCOc1ccccc1C[N@H+](C)CC(C)=O ZINC001138995793 991121078 /nfs/dbraw/zinc/12/10/78/991121078.db2.gz ULAIKJXTRXGVKO-UHFFFAOYSA-N 1 2 235.327 2.496 20 0 BEADLO CCCOc1ccccc1C[N@@H+](C)CC(C)=O ZINC001138995793 991121085 /nfs/dbraw/zinc/12/10/85/991121085.db2.gz ULAIKJXTRXGVKO-UHFFFAOYSA-N 1 2 235.327 2.496 20 0 BEADLO CCCOc1ccccc1C[NH+]1CCOCC1 ZINC001138999357 991122704 /nfs/dbraw/zinc/12/27/04/991122704.db2.gz BSVMYRNFJONXEI-UHFFFAOYSA-N 1 2 235.327 2.308 20 0 BEADLO c1cnc2cc(C[N@@H+]3CCO[C@H]4C[C@H]43)ccc2c1 ZINC001139170315 991176928 /nfs/dbraw/zinc/17/69/28/991176928.db2.gz CJNAKBCSAUDVKI-CABCVRRESA-N 1 2 240.306 2.208 20 0 BEADLO c1cnc2cc(C[N@H+]3CCO[C@H]4C[C@H]43)ccc2c1 ZINC001139170315 991176933 /nfs/dbraw/zinc/17/69/33/991176933.db2.gz CJNAKBCSAUDVKI-CABCVRRESA-N 1 2 240.306 2.208 20 0 BEADLO OCC1(F)C[NH+](C2CCCCCCC2)C1 ZINC001258237279 991182384 /nfs/dbraw/zinc/18/23/84/991182384.db2.gz IUPQRYIIMGOLCK-UHFFFAOYSA-N 1 2 215.312 2.116 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2ccc3nsnc3c2)C1 ZINC001139210198 991192161 /nfs/dbraw/zinc/19/21/61/991192161.db2.gz HPFWGMCMRGGJQJ-SECBINFHSA-N 1 2 237.303 2.235 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2ccc3nsnc3c2)C1 ZINC001139210198 991192172 /nfs/dbraw/zinc/19/21/72/991192172.db2.gz HPFWGMCMRGGJQJ-SECBINFHSA-N 1 2 237.303 2.235 20 0 BEADLO COC(=O)C1([NH2+][C@@H](C)CC(C)(C)SC)CC1 ZINC001258314598 991235450 /nfs/dbraw/zinc/23/54/50/991235450.db2.gz GUWCJNFXWCFLJT-VIFPVBQESA-N 1 2 245.388 2.202 20 0 BEADLO CC(C)CCc1nnc(C2([NH+](C)C)CC2)o1 ZINC001258310392 991240996 /nfs/dbraw/zinc/24/09/96/991240996.db2.gz XUUPOOZUVHYJQR-UHFFFAOYSA-N 1 2 223.320 2.209 20 0 BEADLO CCOc1ccc(C)cc1C[N@H+](C)C1COC1 ZINC001139603475 991286884 /nfs/dbraw/zinc/28/68/84/991286884.db2.gz DJUXEXLLVWJENT-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO CCOc1ccc(C)cc1C[N@@H+](C)C1COC1 ZINC001139603475 991286895 /nfs/dbraw/zinc/28/68/95/991286895.db2.gz DJUXEXLLVWJENT-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO CCOc1ccncc1C[N@@H+]1C[C@@H](C)[C@@H](F)C1 ZINC001139627712 991297533 /nfs/dbraw/zinc/29/75/33/991297533.db2.gz ZBTZWVSSCNFQGO-PWSUYJOCSA-N 1 2 238.306 2.270 20 0 BEADLO CCOc1ccncc1C[N@H+]1C[C@@H](C)[C@@H](F)C1 ZINC001139627712 991297548 /nfs/dbraw/zinc/29/75/48/991297548.db2.gz ZBTZWVSSCNFQGO-PWSUYJOCSA-N 1 2 238.306 2.270 20 0 BEADLO CCOc1ccncc1C[NH+]1CC(C)(C)C1 ZINC001139627509 991301625 /nfs/dbraw/zinc/30/16/25/991301625.db2.gz SHRGRFPIMOANNA-UHFFFAOYSA-N 1 2 220.316 2.322 20 0 BEADLO CC/C=C/CNC(=O)Nc1ccc2[nH+]ccn2c1 ZINC001311026362 991320724 /nfs/dbraw/zinc/32/07/24/991320724.db2.gz LHUNYPSUBBXUSH-ONEGZZNKSA-N 1 2 244.298 2.422 20 0 BEADLO COc1ccc(CC[C@H](C)[N@@H+]2CCC(=O)C2)cc1 ZINC001258408686 991349747 /nfs/dbraw/zinc/34/97/47/991349747.db2.gz LAMNJPRBQOABFS-LBPRGKRZSA-N 1 2 247.338 2.291 20 0 BEADLO COc1ccc(CC[C@H](C)[N@H+]2CCC(=O)C2)cc1 ZINC001258408686 991349758 /nfs/dbraw/zinc/34/97/58/991349758.db2.gz LAMNJPRBQOABFS-LBPRGKRZSA-N 1 2 247.338 2.291 20 0 BEADLO F[C@H]1CC[N@H+](Cc2cnc3cccnc3c2)C1 ZINC001139737898 991351986 /nfs/dbraw/zinc/35/19/86/991351986.db2.gz CGMPHGVSKLJSSU-NSHDSACASA-N 1 2 231.274 2.174 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2cnc3cccnc3c2)C1 ZINC001139737898 991351995 /nfs/dbraw/zinc/35/19/95/991351995.db2.gz CGMPHGVSKLJSSU-NSHDSACASA-N 1 2 231.274 2.174 20 0 BEADLO C[N@H+](CCF)Cc1cnc2cccnc2c1 ZINC001139744442 991352651 /nfs/dbraw/zinc/35/26/51/991352651.db2.gz IKUFSGJMEGUTJN-UHFFFAOYSA-N 1 2 219.263 2.031 20 0 BEADLO C[N@@H+](CCF)Cc1cnc2cccnc2c1 ZINC001139744442 991352658 /nfs/dbraw/zinc/35/26/58/991352658.db2.gz IKUFSGJMEGUTJN-UHFFFAOYSA-N 1 2 219.263 2.031 20 0 BEADLO C[N@H+](Cc1ccnc(F)c1)Cc1ccccn1 ZINC001139831155 991387830 /nfs/dbraw/zinc/38/78/30/991387830.db2.gz XEZIVIQJYXUCJN-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[N@@H+](Cc1ccnc(F)c1)Cc1ccccn1 ZINC001139831155 991387836 /nfs/dbraw/zinc/38/78/36/991387836.db2.gz XEZIVIQJYXUCJN-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO CC(C)[C@H]1COCC[N@@H+]1Cc1ccnc(F)c1 ZINC001139834591 991389407 /nfs/dbraw/zinc/38/94/07/991389407.db2.gz OVAYLEKNDXARGJ-GFCCVEGCSA-N 1 2 238.306 2.078 20 0 BEADLO CC(C)[C@H]1COCC[N@H+]1Cc1ccnc(F)c1 ZINC001139834591 991389413 /nfs/dbraw/zinc/38/94/13/991389413.db2.gz OVAYLEKNDXARGJ-GFCCVEGCSA-N 1 2 238.306 2.078 20 0 BEADLO Clc1cnccc1C[NH+]1CC2(CSC2)C1 ZINC001139849733 991403771 /nfs/dbraw/zinc/40/37/71/991403771.db2.gz QQUZFIAOSXLKNS-UHFFFAOYSA-N 1 2 240.759 2.284 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC(=O)[C@@H](C)CC2)cn1 ZINC001139928965 991424624 /nfs/dbraw/zinc/42/46/24/991424624.db2.gz HTUXZIHPHMZJGO-NSHDSACASA-N 1 2 232.327 2.191 20 0 BEADLO Cc1ccc(C[N@H+]2CCC(=O)[C@@H](C)CC2)cn1 ZINC001139928965 991424630 /nfs/dbraw/zinc/42/46/30/991424630.db2.gz HTUXZIHPHMZJGO-NSHDSACASA-N 1 2 232.327 2.191 20 0 BEADLO CCn1cncc1CNc1cc2cc[nH]c2c[nH+]1 ZINC001202987642 991431660 /nfs/dbraw/zinc/43/16/60/991431660.db2.gz ZALRDDMBJAAJRU-UHFFFAOYSA-N 1 2 241.298 2.391 20 0 BEADLO Fc1ccc2c(c1)CC[N@@H+](Cc1cccnn1)C2 ZINC001139973687 991443784 /nfs/dbraw/zinc/44/37/84/991443784.db2.gz DOCHAOWFTHGSJL-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1ccc2c(c1)CC[N@H+](Cc1cccnn1)C2 ZINC001139973687 991443789 /nfs/dbraw/zinc/44/37/89/991443789.db2.gz DOCHAOWFTHGSJL-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Cc1cccc2c1C[N@H+](Cc1ccnnc1)C2 ZINC001139980831 991452258 /nfs/dbraw/zinc/45/22/58/991452258.db2.gz ZEGYMXOAOJTKTP-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO Cc1cccc2c1C[N@@H+](Cc1ccnnc1)C2 ZINC001139980831 991452262 /nfs/dbraw/zinc/45/22/62/991452262.db2.gz ZEGYMXOAOJTKTP-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO COc1ccccc1C[N@H+](C)Cc1ccnnc1 ZINC001139983571 991461785 /nfs/dbraw/zinc/46/17/85/991461785.db2.gz WRDQVMYYTDSEHR-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1ccccc1C[N@@H+](C)Cc1ccnnc1 ZINC001139983571 991461792 /nfs/dbraw/zinc/46/17/92/991461792.db2.gz WRDQVMYYTDSEHR-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO CC1(C)CC[C@H]([N@@H+]2CCC(=O)[C@H](F)C2)C1 ZINC001258604736 991488380 /nfs/dbraw/zinc/48/83/80/991488380.db2.gz JIEZLZVLVOZEMY-VHSXEESVSA-N 1 2 213.296 2.178 20 0 BEADLO CC1(C)CC[C@H]([N@H+]2CCC(=O)[C@H](F)C2)C1 ZINC001258604736 991488387 /nfs/dbraw/zinc/48/83/87/991488387.db2.gz JIEZLZVLVOZEMY-VHSXEESVSA-N 1 2 213.296 2.178 20 0 BEADLO CCCn1c[nH+]cc1CNc1cncc(OC)c1 ZINC001560554183 991500234 /nfs/dbraw/zinc/50/02/34/991500234.db2.gz LVQMHIWMHMHLEG-UHFFFAOYSA-N 1 2 246.314 2.309 20 0 BEADLO CC1(C)CC[C@@H]([N@@H+]2CCC(=O)[C@H](F)C2)C1 ZINC001258604730 991515744 /nfs/dbraw/zinc/51/57/44/991515744.db2.gz JIEZLZVLVOZEMY-NXEZZACHSA-N 1 2 213.296 2.178 20 0 BEADLO CC1(C)CC[C@@H]([N@H+]2CCC(=O)[C@H](F)C2)C1 ZINC001258604730 991515759 /nfs/dbraw/zinc/51/57/59/991515759.db2.gz JIEZLZVLVOZEMY-NXEZZACHSA-N 1 2 213.296 2.178 20 0 BEADLO CC1(C)CC[C@@H](N2CC[NH2+]CC(F)(F)C2)C1 ZINC001258603064 991515849 /nfs/dbraw/zinc/51/58/49/991515849.db2.gz SSBMNRXECXSVSQ-SNVBAGLBSA-N 1 2 232.318 2.106 20 0 BEADLO CCn1ccc(C[NH2+][C@@H](C)c2ncccc2C)n1 ZINC001560618791 991525695 /nfs/dbraw/zinc/52/56/95/991525695.db2.gz WNTFFMFQPJKIBY-LBPRGKRZSA-N 1 2 244.342 2.457 20 0 BEADLO Oc1ccc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)c(F)c1 ZINC001140125844 991528967 /nfs/dbraw/zinc/52/89/67/991528967.db2.gz KDQHCKZWRDCNJV-GAFUQQFSSA-N 1 2 239.265 2.321 20 0 BEADLO Oc1ccc(C[N@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)c(F)c1 ZINC001140125844 991528980 /nfs/dbraw/zinc/52/89/80/991528980.db2.gz KDQHCKZWRDCNJV-GAFUQQFSSA-N 1 2 239.265 2.321 20 0 BEADLO CCC=CC[NH2+]Cc1n[nH]cc1Br ZINC001560849498 991620746 /nfs/dbraw/zinc/62/07/46/991620746.db2.gz UJJAKUINYCYAGJ-ARJAWSKDSA-N 1 2 244.136 2.228 20 0 BEADLO COCCC1(C)C[NH+](Cc2ncccc2F)C1 ZINC001560877340 991636171 /nfs/dbraw/zinc/63/61/71/991636171.db2.gz QRNHPTXOAQTBIH-UHFFFAOYSA-N 1 2 238.306 2.079 20 0 BEADLO COc1cccnc1C[NH2+][C@H](C)c1ccccn1 ZINC001560886975 991639458 /nfs/dbraw/zinc/63/94/58/991639458.db2.gz DIUDEOZHFOXLJI-LLVKDONJSA-N 1 2 243.310 2.336 20 0 BEADLO CCC[C@@H]([NH2+]CCSC(C)C)C(=O)OC ZINC001561025337 991690706 /nfs/dbraw/zinc/69/07/06/991690706.db2.gz VORBBEBHSPOIIA-SNVBAGLBSA-N 1 2 233.377 2.059 20 0 BEADLO CC(C)C1CCN(C(=O)[C@H](C)n2cc[nH+]c2)CC1 ZINC001318700878 991703866 /nfs/dbraw/zinc/70/38/66/991703866.db2.gz DKBNCXOGKPPXPQ-LBPRGKRZSA-N 1 2 249.358 2.339 20 0 BEADLO CC[C@@H]1CCCN(C(=O)[C@H](C)n2cc[nH+]c2)CC1 ZINC001318898379 991730002 /nfs/dbraw/zinc/73/00/02/991730002.db2.gz VFIXUOJARBUJPQ-QWHCGFSZSA-N 1 2 249.358 2.483 20 0 BEADLO CC[C@H](C[C@@H](C)CC)[NH+]1CC(F)(CO)C1 ZINC001258790141 991773607 /nfs/dbraw/zinc/77/36/07/991773607.db2.gz IXIODSFKDSJRDI-WDEREUQCSA-N 1 2 217.328 2.217 20 0 BEADLO Cc1cc(C)nc(NC(=O)[C@H](C)n2cc[nH+]c2)c1 ZINC001319361100 991848246 /nfs/dbraw/zinc/84/82/46/991848246.db2.gz XFACYOFOPXXFTM-NSHDSACASA-N 1 2 244.298 2.095 20 0 BEADLO CC[C@@H](C)CN(CC)C(=O)[C@H](C)n1cc[nH+]c1 ZINC001319367674 991849071 /nfs/dbraw/zinc/84/90/71/991849071.db2.gz LAORMUCMUIWSSW-NEPJUHHUSA-N 1 2 237.347 2.339 20 0 BEADLO Cc1ccc(NC(=O)[C@H](C)n2cc[nH+]c2)cc1O ZINC001319474680 991875626 /nfs/dbraw/zinc/87/56/26/991875626.db2.gz OHPKYZZNSMHNHY-JTQLQIEISA-N 1 2 245.282 2.097 20 0 BEADLO C[N@H+](CCF)Cc1cccc2c1OC(F)(F)O2 ZINC000840949207 991899491 /nfs/dbraw/zinc/89/94/91/991899491.db2.gz QXRNTYACLHKRIQ-UHFFFAOYSA-N 1 2 247.216 2.409 20 0 BEADLO C[N@@H+](CCF)Cc1cccc2c1OC(F)(F)O2 ZINC000840949207 991899504 /nfs/dbraw/zinc/89/95/04/991899504.db2.gz QXRNTYACLHKRIQ-UHFFFAOYSA-N 1 2 247.216 2.409 20 0 BEADLO O=C(CC(C1CC1)C1CC1)OCCn1cc[nH+]c1 ZINC001319761279 991971522 /nfs/dbraw/zinc/97/15/22/991971522.db2.gz SNAKCQXCYIIXTE-UHFFFAOYSA-N 1 2 248.326 2.253 20 0 BEADLO C[C@@H](C(=O)N(C)C[C@H]1CC=CCC1)n1cc[nH+]c1 ZINC001320057484 992093151 /nfs/dbraw/zinc/09/31/51/992093151.db2.gz CABKBNIURMAMIB-STQMWFEESA-N 1 2 247.342 2.259 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@@H](C)c2ccncc2)[nH]n1 ZINC001320139900 992114728 /nfs/dbraw/zinc/11/47/28/992114728.db2.gz NWWAYCAWKIAOJM-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO Cc1cc(C[N@H+](C)[C@@H](C)c2ccncc2)[nH]n1 ZINC001320139900 992114736 /nfs/dbraw/zinc/11/47/36/992114736.db2.gz NWWAYCAWKIAOJM-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO CCN(CCC1CC1)C(=O)[C@H](C)n1cc[nH+]c1 ZINC001320291665 992155350 /nfs/dbraw/zinc/15/53/50/992155350.db2.gz FQEOZOYQBHVTKH-NSHDSACASA-N 1 2 235.331 2.093 20 0 BEADLO C[C@@H](C(=O)N[C@H]1CCC(C)(C)C1)n1cc[nH+]c1 ZINC001320486361 992219235 /nfs/dbraw/zinc/21/92/35/992219235.db2.gz BPOMWJHJZCQYIU-QWRGUYRKSA-N 1 2 235.331 2.139 20 0 BEADLO CC[C@@H]1[C@@H](C)CCN1C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001320521695 992230830 /nfs/dbraw/zinc/23/08/30/992230830.db2.gz RFCAQDCXJIVXQA-QJPTWQEYSA-N 1 2 235.331 2.091 20 0 BEADLO CCC[C@H]1[C@@H](C)CCC[N@@H+]1Cc1nc[nH]n1 ZINC001261637797 992431576 /nfs/dbraw/zinc/43/15/76/992431576.db2.gz GRCMRNQNWXVMHL-QWRGUYRKSA-N 1 2 222.336 2.205 20 0 BEADLO CCC[C@H]1[C@@H](C)CCC[N@H+]1Cc1nc[nH]n1 ZINC001261637797 992431580 /nfs/dbraw/zinc/43/15/80/992431580.db2.gz GRCMRNQNWXVMHL-QWRGUYRKSA-N 1 2 222.336 2.205 20 0 BEADLO CCC[C@H]([NH2+]Cc1ncn[nH]1)C(C)(C)C ZINC001261639969 992435918 /nfs/dbraw/zinc/43/59/18/992435918.db2.gz RSKLVXJJVLOPHO-VIFPVBQESA-N 1 2 210.325 2.109 20 0 BEADLO CC(C)N(CC1CCC1)C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001321196556 992483884 /nfs/dbraw/zinc/48/38/84/992483884.db2.gz HTCVVESGHYHWJJ-GFCCVEGCSA-N 1 2 249.358 2.481 20 0 BEADLO CCc1cnccc1[C@H](C)[NH2+]Cc1nncs1 ZINC001262255636 992820111 /nfs/dbraw/zinc/82/01/11/992820111.db2.gz SXFVZDYGZDRKKQ-VIFPVBQESA-N 1 2 248.355 2.346 20 0 BEADLO Cc1ncccc1[C@@H](C)OC(=O)[C@H]1CCCC[NH2+]1 ZINC001574192090 992821938 /nfs/dbraw/zinc/82/19/38/992821938.db2.gz OPYSRPNJLDHYKG-DGCLKSJQSA-N 1 2 248.326 2.136 20 0 BEADLO CCN(C[C@H]1CCOC1)c1cc(F)cc(C)[nH+]1 ZINC001262687935 993030356 /nfs/dbraw/zinc/03/03/56/993030356.db2.gz BIDMWIWIOHYBLO-LLVKDONJSA-N 1 2 238.306 2.392 20 0 BEADLO Cn1c[nH+]cc1CCCOC(=O)[C@H]1CC12CCC2 ZINC001263509845 993351224 /nfs/dbraw/zinc/35/12/24/993351224.db2.gz JLNVOONICBPUOE-GFCCVEGCSA-N 1 2 248.326 2.086 20 0 BEADLO Cc1occc1C(=O)OCCCc1c[nH+]cn1C ZINC001263510208 993353860 /nfs/dbraw/zinc/35/38/60/993353860.db2.gz VFFFEDUGBSPPTD-UHFFFAOYSA-N 1 2 248.282 2.111 20 0 BEADLO CCC1(NC(=O)CCc2[nH+]ccn2C)CCCC1 ZINC001263835665 993541986 /nfs/dbraw/zinc/54/19/86/993541986.db2.gz AMADOBUIHIUWLA-UHFFFAOYSA-N 1 2 249.358 2.192 20 0 BEADLO COc1ccc[nH+]c1NCCC(F)F ZINC000389347176 993746510 /nfs/dbraw/zinc/74/65/10/993746510.db2.gz MDKSSHSAMQMGKE-UHFFFAOYSA-N 1 2 202.204 2.157 20 0 BEADLO CC(C)CC1([NH2+]CC(=O)OC(C)C)CC1 ZINC000701501252 993890861 /nfs/dbraw/zinc/89/08/61/993890861.db2.gz ALKYUOQEQSRDMT-UHFFFAOYSA-N 1 2 213.321 2.106 20 0 BEADLO COc1nccc(-c2ccc[nH+]c2N)c1Cl ZINC000701586576 993893124 /nfs/dbraw/zinc/89/31/24/993893124.db2.gz OKWKCLXJACREPZ-UHFFFAOYSA-N 1 2 235.674 2.388 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CCC(C(C)C)CC1 ZINC001293421959 994652505 /nfs/dbraw/zinc/65/25/05/994652505.db2.gz DGQSOAAXSVAFNQ-UHFFFAOYSA-N 1 2 249.358 2.155 20 0 BEADLO C[C@@H](NC(=O)C[C@H](C)n1cc[nH+]c1)C1(C)CC1 ZINC001336207589 994981183 /nfs/dbraw/zinc/98/11/83/994981183.db2.gz SLWDYRBFOWAGIW-WDEREUQCSA-N 1 2 235.331 2.139 20 0 BEADLO Cc1[nH]c([C@@H]2CCCN2C(=O)CCF)[nH+]c1C ZINC001303608917 995166389 /nfs/dbraw/zinc/16/63/89/995166389.db2.gz NHXQDMKLQPTBAF-JTQLQIEISA-N 1 2 239.294 2.050 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)[C@@H]2C[C@H]2C(C)C)[nH+]1 ZINC001304108352 995190119 /nfs/dbraw/zinc/19/01/19/995190119.db2.gz UGRYTYBKDYBLAN-NWDGAFQWSA-N 1 2 249.358 2.441 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)[C@@H]2C[C@H]2C(C)C)c[nH+]1 ZINC001304108352 995190122 /nfs/dbraw/zinc/19/01/22/995190122.db2.gz UGRYTYBKDYBLAN-NWDGAFQWSA-N 1 2 249.358 2.441 20 0 BEADLO Nc1[nH+]cccc1CSCc1ccncc1 ZINC001307404787 995342929 /nfs/dbraw/zinc/34/29/29/995342929.db2.gz NAYSASCCTIUNSI-UHFFFAOYSA-N 1 2 231.324 2.492 20 0 BEADLO C[C@@H](O)C[N@H+](C)Cc1nccc(Cl)c1Cl ZINC001307480948 995372831 /nfs/dbraw/zinc/37/28/31/995372831.db2.gz WUOVQJBACQERSL-SSDOTTSWSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@@H](O)C[N@@H+](C)Cc1nccc(Cl)c1Cl ZINC001307480948 995372846 /nfs/dbraw/zinc/37/28/46/995372846.db2.gz WUOVQJBACQERSL-SSDOTTSWSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@H](c1ncccn1)[N@@H+]1CC[C@@H]2[C@H](C1)C2(F)F ZINC001307596194 995410625 /nfs/dbraw/zinc/41/06/25/995410625.db2.gz HMPSEPBCOPHQCF-BBBLOLIVSA-N 1 2 239.269 2.125 20 0 BEADLO C[C@H](c1ncccn1)[N@H+]1CC[C@@H]2[C@H](C1)C2(F)F ZINC001307596194 995410629 /nfs/dbraw/zinc/41/06/29/995410629.db2.gz HMPSEPBCOPHQCF-BBBLOLIVSA-N 1 2 239.269 2.125 20 0 BEADLO C[C@@H]1CCC(F)(F)C[N@@H+]1CCC1OCCCO1 ZINC001308153734 995574483 /nfs/dbraw/zinc/57/44/83/995574483.db2.gz KIEWBDPNMRNYRQ-SNVBAGLBSA-N 1 2 249.301 2.259 20 0 BEADLO C[C@@H]1CCC(F)(F)C[N@H+]1CCC1OCCCO1 ZINC001308153734 995574492 /nfs/dbraw/zinc/57/44/92/995574492.db2.gz KIEWBDPNMRNYRQ-SNVBAGLBSA-N 1 2 249.301 2.259 20 0 BEADLO Nc1ccc[nH+]c1Nc1ccc2c(c1)OCO2 ZINC000020317548 1170149598 /nfs/dbraw/zinc/14/95/98/1170149598.db2.gz AVFPIISXWMMLOV-UHFFFAOYSA-N 1 2 229.239 2.136 20 0 BEADLO C=C/C=C\CCNC(=O)c1cccc2[nH+]ccn21 ZINC001610969936 1170424552 /nfs/dbraw/zinc/42/45/52/1170424552.db2.gz MAPQQNUNHJJECK-ARJAWSKDSA-N 1 2 241.294 2.196 20 0 BEADLO Cc1cnc(C(C)(C)[NH2+]CC2=NOCC2)s1 ZINC001616989078 1170573889 /nfs/dbraw/zinc/57/38/89/1170573889.db2.gz PNMYHXOOSMGRKJ-UHFFFAOYSA-N 1 2 239.344 2.053 20 0 BEADLO Cc1ccccc1[C@H](CO)[NH2+]Cc1cscn1 ZINC001617153239 1170580821 /nfs/dbraw/zinc/58/08/21/1170580821.db2.gz ASXXXPOZAYYVCS-ZDUSSCGKSA-N 1 2 248.351 2.275 20 0 BEADLO Cc1ccc([C@H]2CC[N@H+](Cc3nnc[nH]3)C2)cc1 ZINC001617146900 1170580937 /nfs/dbraw/zinc/58/09/37/1170580937.db2.gz MFKBBWJKRUJCQW-ZDUSSCGKSA-N 1 2 242.326 2.103 20 0 BEADLO Cc1ccc([C@H]2CC[N@@H+](Cc3nnc[nH]3)C2)cc1 ZINC001617146900 1170580941 /nfs/dbraw/zinc/58/09/41/1170580941.db2.gz MFKBBWJKRUJCQW-ZDUSSCGKSA-N 1 2 242.326 2.103 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1cc(C)ccc1C ZINC001618377514 1170631386 /nfs/dbraw/zinc/63/13/86/1170631386.db2.gz GVHJDOMXASEGRU-CYBMUJFWSA-N 1 2 232.327 2.336 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1cc(C)ccc1C ZINC001618377514 1170631392 /nfs/dbraw/zinc/63/13/92/1170631392.db2.gz GVHJDOMXASEGRU-CYBMUJFWSA-N 1 2 232.327 2.336 20 0 BEADLO c1csc(C[NH2+]Cc2cnc(C3CC3)nc2)n1 ZINC001620735990 1170709271 /nfs/dbraw/zinc/70/92/71/1170709271.db2.gz OGJQUSSRPWXRBG-UHFFFAOYSA-N 1 2 246.339 2.100 20 0 BEADLO CC1C[NH+](Cc2sc(N(C)C)nc2Cl)C1 ZINC001621302245 1170765372 /nfs/dbraw/zinc/76/53/72/1170765372.db2.gz MJOZDPPZCHEILB-UHFFFAOYSA-N 1 2 245.779 2.314 20 0 BEADLO CCn1cnc(Cl)c1C[N@H+](CC)CCOC ZINC001621324717 1170770581 /nfs/dbraw/zinc/77/05/81/1170770581.db2.gz VHEIGLYFYHWJQN-UHFFFAOYSA-N 1 2 245.754 2.025 20 0 BEADLO CCn1cnc(Cl)c1C[N@@H+](CC)CCOC ZINC001621324717 1170770588 /nfs/dbraw/zinc/77/05/88/1170770588.db2.gz VHEIGLYFYHWJQN-UHFFFAOYSA-N 1 2 245.754 2.025 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)N(C)C(C)C)[nH+]1 ZINC001622611683 1170894067 /nfs/dbraw/zinc/89/40/67/1170894067.db2.gz XZVJAMPAYUTSPS-UHFFFAOYSA-N 1 2 238.335 2.083 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)N(C)C(C)C)c[nH+]1 ZINC001622611683 1170894074 /nfs/dbraw/zinc/89/40/74/1170894074.db2.gz XZVJAMPAYUTSPS-UHFFFAOYSA-N 1 2 238.335 2.083 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1cc(C)ccc1OC ZINC001624061106 1171003343 /nfs/dbraw/zinc/00/33/43/1171003343.db2.gz ZXDMYTXMEOJCRF-GFCCVEGCSA-N 1 2 248.326 2.036 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1cc(C)ccc1OC ZINC001624061106 1171003350 /nfs/dbraw/zinc/00/33/50/1171003350.db2.gz ZXDMYTXMEOJCRF-GFCCVEGCSA-N 1 2 248.326 2.036 20 0 BEADLO CCCCCCOC(=O)C[NH2+][C@@H](C)CC ZINC000040952978 1171160721 /nfs/dbraw/zinc/16/07/21/1171160721.db2.gz GQZPOUBGKDGOEB-NSHDSACASA-N 1 2 215.337 2.498 20 0 BEADLO O=C(Nc1ccccc1F)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC001628393392 1171232130 /nfs/dbraw/zinc/23/21/30/1171232130.db2.gz FJXLRRNPZLPJNR-RKDXNWHRSA-N 1 2 245.257 2.291 20 0 BEADLO O=C(Nc1ccccc1F)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC001628393392 1171232136 /nfs/dbraw/zinc/23/21/36/1171232136.db2.gz FJXLRRNPZLPJNR-RKDXNWHRSA-N 1 2 245.257 2.291 20 0 BEADLO CCCCC[C@H](C)[NH2+]CC(=O)OC(C)C ZINC000043446461 1171286938 /nfs/dbraw/zinc/28/69/38/1171286938.db2.gz PVXCQADPFYATPF-NSHDSACASA-N 1 2 215.337 2.496 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NCCCCC(C)C ZINC001629670268 1171337755 /nfs/dbraw/zinc/33/77/55/1171337755.db2.gz VKOCBQUJVKROPS-UHFFFAOYSA-N 1 2 237.347 2.203 20 0 BEADLO C[C@H](C(=O)N[C@@H](C)c1cccs1)n1cc[nH+]c1 ZINC000044817664 1171415895 /nfs/dbraw/zinc/41/58/95/1171415895.db2.gz XCUJASHLSHFQDP-VHSXEESVSA-N 1 2 249.339 2.383 20 0 BEADLO C#Cc1cccc(NC(=O)[C@@H](C)n2cc[nH+]c2)c1 ZINC000045064100 1171433851 /nfs/dbraw/zinc/43/38/51/1171433851.db2.gz HTLFLZROLQCUFT-LLVKDONJSA-N 1 2 239.278 2.064 20 0 BEADLO C[C@@H](C(=O)N(C)CC1CCCCC1)n1cc[nH+]c1 ZINC000045881042 1171465875 /nfs/dbraw/zinc/46/58/75/1171465875.db2.gz UNCHQUINCNHZKZ-LBPRGKRZSA-N 1 2 249.358 2.483 20 0 BEADLO C=C/C=C/CC(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC001632283272 1171501724 /nfs/dbraw/zinc/50/17/24/1171501724.db2.gz QJDPYQKFOVYBTF-AAOUONPWSA-N 1 2 245.326 2.248 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)Nc1c(C)cccc1F ZINC001632890640 1171541512 /nfs/dbraw/zinc/54/15/12/1171541512.db2.gz VISBEZDVWGETAA-UHFFFAOYSA-N 1 2 247.273 2.347 20 0 BEADLO C/C=C/C=C/C(=O)NCc1[nH]c2c([nH+]1)CCCC2 ZINC001635850904 1171768343 /nfs/dbraw/zinc/76/83/43/1171768343.db2.gz VIFKPNSNRCRZGE-DSXPNFDZSA-N 1 2 245.326 2.037 20 0 BEADLO Nc1ccc(COCc2ccccc2)c[nH+]1 ZINC000050830348 1171841202 /nfs/dbraw/zinc/84/12/02/1171841202.db2.gz FHUBNTMWPGLGEF-UHFFFAOYSA-N 1 2 214.268 2.381 20 0 BEADLO Cn1c[nH+]cc1CCC(=O)Nc1ccccc1F ZINC000188396770 346809533 /nfs/dbraw/zinc/80/95/33/346809533.db2.gz YPPRZKWCXQLCFB-UHFFFAOYSA-N 1 2 247.273 2.131 20 0 BEADLO CCC(CC)(CNc1cc(C)[nH+]cn1)OC ZINC000309266253 168327232 /nfs/dbraw/zinc/32/72/32/168327232.db2.gz QDZSCSOCQLTXNW-UHFFFAOYSA-N 1 2 223.320 2.402 20 0 BEADLO COCC[N@H+](CC(F)F)CC1(C)CC1 ZINC000580268841 346812843 /nfs/dbraw/zinc/81/28/43/346812843.db2.gz JVEOLCUEAZHHTI-UHFFFAOYSA-N 1 2 207.264 2.000 20 0 BEADLO COCC[N@@H+](CC(F)F)CC1(C)CC1 ZINC000580268841 346812845 /nfs/dbraw/zinc/81/28/45/346812845.db2.gz JVEOLCUEAZHHTI-UHFFFAOYSA-N 1 2 207.264 2.000 20 0 BEADLO COC1C[NH+](Cc2csc(C)c2C)C1 ZINC000877580643 583336076 /nfs/dbraw/zinc/33/60/76/583336076.db2.gz VXLVVRDBKSZNKF-UHFFFAOYSA-N 1 2 211.330 2.196 20 0 BEADLO Cc1ccc2[nH+]c(CNC(=O)CC(C)C)cn2c1 ZINC000071435609 398149213 /nfs/dbraw/zinc/14/92/13/398149213.db2.gz HPYWTUMXJWMSFT-UHFFFAOYSA-N 1 2 245.326 2.305 20 0 BEADLO C[C@H](N[C@H]1C[C@H](C)n2cc[nH+]c21)C(F)F ZINC000389922562 398149358 /nfs/dbraw/zinc/14/93/58/398149358.db2.gz SMGOEBVAINIDGO-FXQIFTODSA-N 1 2 215.247 2.132 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3ccsc3C2)nn1C ZINC000341045626 178003607 /nfs/dbraw/zinc/00/36/07/178003607.db2.gz MBCWVEILNQQCTJ-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1cc(C[N@H+]2CCc3ccsc3C2)nn1C ZINC000341045626 178003611 /nfs/dbraw/zinc/00/36/11/178003611.db2.gz MBCWVEILNQQCTJ-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1cc(C[NH+]2Cc3ccccc3C2)ncn1 ZINC000292406120 178009282 /nfs/dbraw/zinc/00/92/82/178009282.db2.gz JXNIHXULJFOSHF-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccn[nH]2)c(C)s1 ZINC000049687059 178024098 /nfs/dbraw/zinc/02/40/98/178024098.db2.gz BOAWVOPFUCRDMW-UHFFFAOYSA-N 1 2 221.329 2.378 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccsc2)no1 ZINC000044692215 178025920 /nfs/dbraw/zinc/02/59/20/178025920.db2.gz NNVQETKUCMIERI-UHFFFAOYSA-N 1 2 208.286 2.334 20 0 BEADLO Cc1cc(C[NH2+]Cc2csc(C)n2)on1 ZINC000044986253 178028104 /nfs/dbraw/zinc/02/81/04/178028104.db2.gz RZMMMVPICKEAMY-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2cncs2)on1 ZINC000125548761 178037919 /nfs/dbraw/zinc/03/79/19/178037919.db2.gz PPEKVGNQQJGIMV-MRVPVSSYSA-N 1 2 223.301 2.290 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2ccc(F)cn2)on1 ZINC000133994971 178038201 /nfs/dbraw/zinc/03/82/01/178038201.db2.gz NRFWMJVTLRQWOW-SECBINFHSA-N 1 2 235.262 2.368 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2cscn2)n(C)n1 ZINC000284105331 178038231 /nfs/dbraw/zinc/03/82/31/178038231.db2.gz BYQIVLZPYZRCFA-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+]Cc2cc(C)ncn2)s1 ZINC000293023413 178038510 /nfs/dbraw/zinc/03/85/10/178038510.db2.gz CNITYEUATKIQDK-SNVBAGLBSA-N 1 2 248.355 2.401 20 0 BEADLO Cc1ccc(C[N@@H+](C)[C@@H](C)c2cnccn2)nc1 ZINC000649903049 398177392 /nfs/dbraw/zinc/17/73/92/398177392.db2.gz NQVPSDTVOVCXFT-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1ccc(C[N@H+](C)[C@@H](C)c2cnccn2)nc1 ZINC000649903049 398177396 /nfs/dbraw/zinc/17/73/96/398177396.db2.gz NQVPSDTVOVCXFT-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cc(F)ccc1C[N@H+](C)Cc1cc[nH]n1 ZINC000353517554 178084723 /nfs/dbraw/zinc/08/47/23/178084723.db2.gz JASUDMWUPFTVGA-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1cc[nH]n1 ZINC000353517554 178084725 /nfs/dbraw/zinc/08/47/25/178084725.db2.gz JASUDMWUPFTVGA-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1nccn1C ZINC000272736366 178085080 /nfs/dbraw/zinc/08/50/80/178085080.db2.gz HTFOFXFIXNFTPK-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1cc(F)ccc1C[N@H+](C)Cc1nccn1C ZINC000272736366 178085083 /nfs/dbraw/zinc/08/50/83/178085083.db2.gz HTFOFXFIXNFTPK-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)Nc1ccc(F)cc1C ZINC000336565621 178088286 /nfs/dbraw/zinc/08/82/86/178088286.db2.gz RIBBQIGATOGGKP-UHFFFAOYSA-N 1 2 247.273 2.347 20 0 BEADLO CCc1cc(N[C@H](CC)C(F)F)nc[nH+]1 ZINC000649384047 398192512 /nfs/dbraw/zinc/19/25/12/398192512.db2.gz NHLFSHFBFDKQNR-MRVPVSSYSA-N 1 2 215.247 2.495 20 0 BEADLO Cc1cc([NH+](C)C)ccc1NCc1cnn(C)c1 ZINC000057667815 178095288 /nfs/dbraw/zinc/09/52/88/178095288.db2.gz KGBORMYQUUXZRC-UHFFFAOYSA-N 1 2 244.342 2.407 20 0 BEADLO Cc1cc(N(C)CC(C)(C)CO)nc(C2CC2)[nH+]1 ZINC000296205129 178096229 /nfs/dbraw/zinc/09/62/29/178096229.db2.gz FQMREJCFFFBADQ-UHFFFAOYSA-N 1 2 249.358 2.117 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2noc3c2CCCC3)C1 ZINC000649943548 398193350 /nfs/dbraw/zinc/19/33/50/398193350.db2.gz DSGUNABKJCJJFL-SECBINFHSA-N 1 2 224.279 2.097 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2noc3c2CCCC3)C1 ZINC000649943548 398193353 /nfs/dbraw/zinc/19/33/53/398193353.db2.gz DSGUNABKJCJJFL-SECBINFHSA-N 1 2 224.279 2.097 20 0 BEADLO CSC1(CNc2ccc(N(C)C)c[nH+]2)CC1 ZINC000289954725 398194446 /nfs/dbraw/zinc/19/44/46/398194446.db2.gz AYYYYTDXNCLHJZ-UHFFFAOYSA-N 1 2 237.372 2.455 20 0 BEADLO Cc1cc(N(C)[C@@H](C)C2CCC2)nc[nH+]1 ZINC000356793106 178101081 /nfs/dbraw/zinc/10/10/81/178101081.db2.gz JWVFGPMZBOVSJH-JTQLQIEISA-N 1 2 205.305 2.410 20 0 BEADLO Cc1cc(N)nc(SC/C=C/Cl)[nH+]1 ZINC000054156322 178109208 /nfs/dbraw/zinc/10/92/08/178109208.db2.gz DSLLQPMRGXCWJF-NSCUHMNNSA-N 1 2 215.709 2.212 20 0 BEADLO Cc1cc(N)nc(SCC[C@@H]2CCCO2)[nH+]1 ZINC000148600196 178109686 /nfs/dbraw/zinc/10/96/86/178109686.db2.gz NCOUTHIKKQZBKL-VIFPVBQESA-N 1 2 239.344 2.028 20 0 BEADLO Cc1cc(N2CC(C)(C)[C@H]2[C@H]2CCCO2)nc[nH+]1 ZINC000357594755 178112245 /nfs/dbraw/zinc/11/22/45/178112245.db2.gz LWFSFQVTFFCUPM-DGCLKSJQSA-N 1 2 247.342 2.179 20 0 BEADLO Cc1cc(N2CC3(C2)CCCC3)nc[nH+]1 ZINC000336365526 178112398 /nfs/dbraw/zinc/11/23/98/178112398.db2.gz PZRAZHFOVRJIHD-UHFFFAOYSA-N 1 2 203.289 2.165 20 0 BEADLO Cc1cc(N2CCC[C@H](C3CC3)C2)nc[nH+]1 ZINC000335983496 178116715 /nfs/dbraw/zinc/11/67/15/178116715.db2.gz UOZMCGNYUSGVRY-LBPRGKRZSA-N 1 2 217.316 2.411 20 0 BEADLO Cc1cc(N2CC[C@@H](CO)[C@H]2C)nc(C(C)C)[nH+]1 ZINC000362671595 178117732 /nfs/dbraw/zinc/11/77/32/178117732.db2.gz XUVWIAMKGZGKQK-NEPJUHHUSA-N 1 2 249.358 2.116 20 0 BEADLO Cc1cc(NC(=O)NCCc2ccco2)cc[nH+]1 ZINC000119441804 178139411 /nfs/dbraw/zinc/13/94/11/178139411.db2.gz KBASQMQGXVZEMJ-UHFFFAOYSA-N 1 2 245.282 2.347 20 0 BEADLO Cn1ncc2c1nc[nH+]c2N[C@@H]1CCC(C)(C)C1 ZINC000162664191 538924213 /nfs/dbraw/zinc/92/42/13/538924213.db2.gz GAHAJGYZVGTTDE-SECBINFHSA-N 1 2 245.330 2.354 20 0 BEADLO CC(C)(C)c1nc(N[C@@H]2CCOC2(C)C)cc[nH+]1 ZINC000649403200 398205452 /nfs/dbraw/zinc/20/54/52/398205452.db2.gz ZKESJUUSYLJZQB-SNVBAGLBSA-N 1 2 249.358 2.175 20 0 BEADLO Cc1cc(NC(=O)Cc2cccc(O)c2)cc[nH+]1 ZINC000101630857 178133804 /nfs/dbraw/zinc/13/38/04/178133804.db2.gz QFBJWOKCPILFJO-UHFFFAOYSA-N 1 2 242.278 2.277 20 0 BEADLO CCc1cc(N2CCO[C@H]3CCC[C@H]32)nc(C)[nH+]1 ZINC000272900738 538926387 /nfs/dbraw/zinc/92/63/87/538926387.db2.gz PONUBIQILVWCIL-OLZOCXBDSA-N 1 2 247.342 2.105 20 0 BEADLO Cc1cc(NC(=O)N2CC[C@H](C)C2)cc[nH+]1 ZINC000271086980 178137438 /nfs/dbraw/zinc/13/74/38/178137438.db2.gz SWTYVANSTMQDGI-VIFPVBQESA-N 1 2 219.288 2.264 20 0 BEADLO Cc1cc(NC(=O)NCc2[nH]cc[nH+]2)ccc1F ZINC000120492867 178141376 /nfs/dbraw/zinc/14/13/76/178141376.db2.gz XJPSYLFPFJXCIX-UHFFFAOYSA-N 1 2 248.261 2.179 20 0 BEADLO Cc1cc(NC(=O)N[C@H](C)C2CC2)cc[nH+]1 ZINC000119286134 178142563 /nfs/dbraw/zinc/14/25/63/178142563.db2.gz SPEMNUAPIJUEFB-SECBINFHSA-N 1 2 219.288 2.310 20 0 BEADLO Cc1cc(NC[C@@H]2CCC(C)(C)O2)nc[nH+]1 ZINC000302479701 178165507 /nfs/dbraw/zinc/16/55/07/178165507.db2.gz XJWSUYMOESPCMV-JTQLQIEISA-N 1 2 221.304 2.155 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CCCS2)cc[nH+]1 ZINC000266540411 178148276 /nfs/dbraw/zinc/14/82/76/178148276.db2.gz GREVVSLCLBFGAB-SNVBAGLBSA-N 1 2 222.313 2.224 20 0 BEADLO Cc1cc(NC(=O)c2ccn(C(C)C)n2)cc[nH+]1 ZINC000264903745 178151704 /nfs/dbraw/zinc/15/17/04/178151704.db2.gz LZQQZAPUKGRHSR-UHFFFAOYSA-N 1 2 244.298 2.420 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCS[C@@H](C)CC1 ZINC000576359909 365577031 /nfs/dbraw/zinc/57/70/31/365577031.db2.gz MPWZJBDYLPDEPM-JTQLQIEISA-N 1 2 237.372 2.425 20 0 BEADLO Cc1cc(NC(=O)c2cccnc2C)cc[nH+]1 ZINC000108447046 178151810 /nfs/dbraw/zinc/15/18/10/178151810.db2.gz OQZRYVNQTHOKKD-UHFFFAOYSA-N 1 2 227.267 2.346 20 0 BEADLO Cc1cc(NC(C)(C)CO)nc(C(C)C)[nH+]1 ZINC000035234428 178153278 /nfs/dbraw/zinc/15/32/78/178153278.db2.gz GBEDUNMQNBDYNJ-UHFFFAOYSA-N 1 2 223.320 2.091 20 0 BEADLO C[C@H]([N@H+](C)Cc1csnn1)C(C)(C)C ZINC000576368445 365579879 /nfs/dbraw/zinc/57/98/79/365579879.db2.gz XOXLFYWRURRNCZ-QMMMGPOBSA-N 1 2 213.350 2.405 20 0 BEADLO C[C@H]([N@@H+](C)Cc1csnn1)C(C)(C)C ZINC000576368445 365579885 /nfs/dbraw/zinc/57/98/85/365579885.db2.gz XOXLFYWRURRNCZ-QMMMGPOBSA-N 1 2 213.350 2.405 20 0 BEADLO Cc1cc(NCC2(c3ccccn3)CC2)nc[nH+]1 ZINC000302607383 178155886 /nfs/dbraw/zinc/15/58/86/178155886.db2.gz ZYSLITZQLNFLHI-UHFFFAOYSA-N 1 2 240.310 2.324 20 0 BEADLO Cc1cc(NCCCCCO)nc(C(C)C)[nH+]1 ZINC000228724425 178158382 /nfs/dbraw/zinc/15/83/82/178158382.db2.gz SAHPFLMTVSXTKP-UHFFFAOYSA-N 1 2 237.347 2.483 20 0 BEADLO Cc1cc(NCCOc2ccccc2)nc[nH+]1 ZINC000042897022 178160997 /nfs/dbraw/zinc/16/09/97/178160997.db2.gz RSWGNRMVTBUFAA-UHFFFAOYSA-N 1 2 229.283 2.276 20 0 BEADLO Cc1cc(NCCc2ccc(O)cc2)nc[nH+]1 ZINC000040736593 178163093 /nfs/dbraw/zinc/16/30/93/178163093.db2.gz MHMRSZBKPKAIRL-UHFFFAOYSA-N 1 2 229.283 2.145 20 0 BEADLO Cc1cc(NCCn2cc[nH+]c2)nc(C(C)C)n1 ZINC000041063232 178163456 /nfs/dbraw/zinc/16/34/56/178163456.db2.gz AERHLVSHZKRLJS-UHFFFAOYSA-N 1 2 245.330 2.217 20 0 BEADLO Cc1cc(NCCn2ccnc2)nc(C(C)C)[nH+]1 ZINC000041063232 178163457 /nfs/dbraw/zinc/16/34/57/178163457.db2.gz AERHLVSHZKRLJS-UHFFFAOYSA-N 1 2 245.330 2.217 20 0 BEADLO Cc1cc(NC[C@](C)(O)CCC(C)C)nc[nH+]1 ZINC000301326414 178169662 /nfs/dbraw/zinc/16/96/62/178169662.db2.gz BAGGVVSYQJHHAO-CYBMUJFWSA-N 1 2 237.347 2.384 20 0 BEADLO Cc1cc(NC[C@H]2CCCO2)nc(C2CC2)[nH+]1 ZINC000264606552 178170257 /nfs/dbraw/zinc/17/02/57/178170257.db2.gz DELBYZQPMJELIX-LLVKDONJSA-N 1 2 233.315 2.253 20 0 BEADLO CCc1nnc(C[NH2+][C@H](C)c2cccc(F)c2)[nH]1 ZINC000274573167 538930141 /nfs/dbraw/zinc/93/01/41/538930141.db2.gz FXAZFXSHTCPFLV-SECBINFHSA-N 1 2 248.305 2.357 20 0 BEADLO Cc1cc(NCc2c[nH+]cn2C(C)C)nn1C ZINC000305954260 178175473 /nfs/dbraw/zinc/17/54/73/178175473.db2.gz HXLYYCVJOVKCKQ-UHFFFAOYSA-N 1 2 233.319 2.118 20 0 BEADLO Cc1cc(NCc2ncc[nH]2)ccc1[NH+](C)C ZINC000120166772 178176466 /nfs/dbraw/zinc/17/64/66/178176466.db2.gz KGYNUAYLPDVWFR-UHFFFAOYSA-N 1 2 230.315 2.396 20 0 BEADLO CC[C@@H](C)[C@H](CNc1ccc(CO)c[nH+]1)OC ZINC000381120023 398222127 /nfs/dbraw/zinc/22/21/27/398222127.db2.gz FADDMKDJWLWIMC-PWSUYJOCSA-N 1 2 238.331 2.047 20 0 BEADLO Cc1cc(N[C@@H](C)C[C@H](O)c2ccco2)nc[nH+]1 ZINC000301647085 178178654 /nfs/dbraw/zinc/17/86/54/178178654.db2.gz PZAWYYXLNAANGK-QWRGUYRKSA-N 1 2 247.298 2.302 20 0 BEADLO Cc1cc(N[C@@H](C)Cc2ccco2)nc[nH+]1 ZINC000040727396 178179277 /nfs/dbraw/zinc/17/92/77/178179277.db2.gz BCSSDRJCORBXBO-JTQLQIEISA-N 1 2 217.272 2.421 20 0 BEADLO Cc1cc(N[C@@H](C)c2cncs2)nc[nH+]1 ZINC000336736105 178179810 /nfs/dbraw/zinc/17/98/10/178179810.db2.gz OZTGQNXMAFSACK-QMMMGPOBSA-N 1 2 220.301 2.415 20 0 BEADLO Cc1cc(N[C@@H]2CCO[C@H]2C)nc(C(C)C)[nH+]1 ZINC000149981434 178182392 /nfs/dbraw/zinc/18/23/92/178182392.db2.gz ZGQNWUQKDCBDKQ-WDEREUQCSA-N 1 2 235.331 2.498 20 0 BEADLO Cc1cc(N[C@H]2CC[C@H](O)CC2)nc(C2CC2)[nH+]1 ZINC000269896415 178183037 /nfs/dbraw/zinc/18/30/37/178183037.db2.gz XWYXKNLJQQPVDO-HAQNSBGRSA-N 1 2 247.342 2.378 20 0 BEADLO Cc1cc(N[C@@H]2C[C@H]3CC[C@@H]2O3)nc(C2CC2)[nH+]1 ZINC000089599404 178183988 /nfs/dbraw/zinc/18/39/88/178183988.db2.gz BLCXJPPIGQOUMT-UTUOFQBUSA-N 1 2 245.326 2.394 20 0 BEADLO Cc1cc(N[C@@H]2[C@@H]3CCO[C@H]3C23CCC3)nc[nH+]1 ZINC000301799245 178185077 /nfs/dbraw/zinc/18/50/77/178185077.db2.gz BLMFIHMEBFNTSE-CYZMBNFOSA-N 1 2 245.326 2.155 20 0 BEADLO Cc1nnc([C@@H](C)Nc2cc(C)[nH+]cn2)s1 ZINC000309798220 178186779 /nfs/dbraw/zinc/18/67/79/178186779.db2.gz QRBVXGZICFBHIR-SSDOTTSWSA-N 1 2 235.316 2.118 20 0 BEADLO Cc1cc(N[C@H](CO)C(C)(C)C)nc(C2CC2)[nH+]1 ZINC000182816331 178187964 /nfs/dbraw/zinc/18/79/64/178187964.db2.gz DAJIHEPQLFEGGH-LLVKDONJSA-N 1 2 249.358 2.481 20 0 BEADLO CC[C@@H]1C[NH+](Cc2ccc(C)nn2)C[C@@H](CC)O1 ZINC000421390254 192327789 /nfs/dbraw/zinc/32/77/89/192327789.db2.gz NRKGVXQUGCDIQO-ZIAGYGMSSA-N 1 2 249.358 2.174 20 0 BEADLO COCCc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000649431687 398232260 /nfs/dbraw/zinc/23/22/60/398232260.db2.gz GBMSQEOWWYBRPW-UHFFFAOYSA-N 1 2 202.257 2.266 20 0 BEADLO COC(=O)[C@@H](C)[NH2+]C1CC2(C1)CCCCC2 ZINC000421401642 192331279 /nfs/dbraw/zinc/33/12/79/192331279.db2.gz VSJCYQXTVRNTOR-SNVBAGLBSA-N 1 2 225.332 2.250 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]CCN2CCCCC2)no1 ZINC000337386922 178225566 /nfs/dbraw/zinc/22/55/66/178225566.db2.gz GADVSCFSPWTNMD-GFCCVEGCSA-N 1 2 237.347 2.120 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2nccn2C)oc1C ZINC000282091215 178228810 /nfs/dbraw/zinc/22/88/10/178228810.db2.gz IEOCLLMMHGRHRS-SNVBAGLBSA-N 1 2 233.315 2.481 20 0 BEADLO CCC1(CC)CCN(C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000279984989 538936251 /nfs/dbraw/zinc/93/62/51/538936251.db2.gz RBRHVOOCEBXJCD-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO CCC1(CC)CCN(C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000279984989 538936252 /nfs/dbraw/zinc/93/62/52/538936252.db2.gz RBRHVOOCEBXJCD-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO CC(C)(C)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cn1 ZINC000649433487 398235041 /nfs/dbraw/zinc/23/50/41/398235041.db2.gz VUFHJIZLULYZEH-UHFFFAOYSA-N 1 2 244.298 2.456 20 0 BEADLO C[C@H]1C[NH+](Cc2csnn2)C[C@H](C)C1(F)F ZINC000625653210 398236066 /nfs/dbraw/zinc/23/60/66/398236066.db2.gz PMKNPMQBSYICAT-YUMQZZPRSA-N 1 2 247.314 2.261 20 0 BEADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ncccn2)on1 ZINC000331846620 178241084 /nfs/dbraw/zinc/24/10/84/178241084.db2.gz QKHMMUGYHSEBSD-NSHDSACASA-N 1 2 244.298 2.110 20 0 BEADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ncccn2)on1 ZINC000331846620 178241086 /nfs/dbraw/zinc/24/10/86/178241086.db2.gz QKHMMUGYHSEBSD-NSHDSACASA-N 1 2 244.298 2.110 20 0 BEADLO COC[C@H](N[C@@H](C)c1[nH]cc[nH+]1)c1ccc(C)o1 ZINC000279104067 538935628 /nfs/dbraw/zinc/93/56/28/538935628.db2.gz VNOYMLQWWMHRLG-QWRGUYRKSA-N 1 2 249.314 2.349 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2c(C)nn(C)c2C)no1 ZINC000282842164 178250576 /nfs/dbraw/zinc/25/05/76/178250576.db2.gz STGBADYGAAKJEJ-JTQLQIEISA-N 1 2 248.330 2.184 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2ccco2)nn1C ZINC000282267290 178251372 /nfs/dbraw/zinc/25/13/72/178251372.db2.gz RDYUJCQNISHUBJ-JTQLQIEISA-N 1 2 219.288 2.172 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2nccn2C)oc1C ZINC000282091210 178251688 /nfs/dbraw/zinc/25/16/88/178251688.db2.gz IEOCLLMMHGRHRS-JTQLQIEISA-N 1 2 233.315 2.481 20 0 BEADLO CC(C)CN(C(=O)CCc1c[nH+]c[nH]1)C(C)C ZINC000279762363 538936057 /nfs/dbraw/zinc/93/60/57/538936057.db2.gz JGGNMTXXNUAIFH-UHFFFAOYSA-N 1 2 237.347 2.235 20 0 BEADLO CC(C)CN(C(=O)CCc1c[nH]c[nH+]1)C(C)C ZINC000279762363 538936058 /nfs/dbraw/zinc/93/60/58/538936058.db2.gz JGGNMTXXNUAIFH-UHFFFAOYSA-N 1 2 237.347 2.235 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2cccnc2)no1 ZINC000282619937 178252551 /nfs/dbraw/zinc/25/25/51/178252551.db2.gz IYZVOHBCMKNNLG-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@H](C)c2cn[nH]c2)no1 ZINC000309553354 178257447 /nfs/dbraw/zinc/25/74/47/178257447.db2.gz IXWPBUKVBUFOKI-BDAKNGLRSA-N 1 2 220.276 2.118 20 0 BEADLO Cc1cc([C@H]2CCCN2Cc2[nH+]ccn2C)on1 ZINC000336348945 178265511 /nfs/dbraw/zinc/26/55/11/178265511.db2.gz JCMVEHFREGNPQQ-LLVKDONJSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc([C@H]2CCC[N@H+]2Cc2nccn2C)on1 ZINC000336348945 178265514 /nfs/dbraw/zinc/26/55/14/178265514.db2.gz JCMVEHFREGNPQQ-LLVKDONJSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2nccn2C)on1 ZINC000336348945 178265518 /nfs/dbraw/zinc/26/55/18/178265518.db2.gz JCMVEHFREGNPQQ-LLVKDONJSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ncccn2)on1 ZINC000331846617 178266822 /nfs/dbraw/zinc/26/68/22/178266822.db2.gz QKHMMUGYHSEBSD-LLVKDONJSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ncccn2)on1 ZINC000331846617 178266824 /nfs/dbraw/zinc/26/68/24/178266824.db2.gz QKHMMUGYHSEBSD-LLVKDONJSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCOC1CCCCC1 ZINC000576480454 365607450 /nfs/dbraw/zinc/60/74/50/365607450.db2.gz VXIRSAOIPWOOHU-UHFFFAOYSA-N 1 2 249.358 2.277 20 0 BEADLO CCC(CC)CNc1ccc(CO)c[nH+]1 ZINC000125465809 168364612 /nfs/dbraw/zinc/36/46/12/168364612.db2.gz HNTWGUIMWMGYIZ-UHFFFAOYSA-N 1 2 208.305 2.422 20 0 BEADLO Cc1cc2ccccc2[nH+]c1N(C)C[C@@H](C)O ZINC000063106501 178298584 /nfs/dbraw/zinc/29/85/84/178298584.db2.gz WBRYUOWSYBLZOD-LLVKDONJSA-N 1 2 230.311 2.360 20 0 BEADLO Cc1cc2[nH+]cn(C[C@@H](C)O)c2cc1C ZINC000037694322 178305393 /nfs/dbraw/zinc/30/53/93/178305393.db2.gz POZZVHIHQYFRPA-SNVBAGLBSA-N 1 2 204.273 2.034 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1C[C@H]1C1CC1 ZINC000176025440 365650631 /nfs/dbraw/zinc/65/06/31/365650631.db2.gz IAROYNOLAUFMEL-WDEREUQCSA-N 1 2 216.284 2.375 20 0 BEADLO Cc1cc[nH+]c(NCCC[C@H](C)O)c1Cl ZINC000336764151 178308902 /nfs/dbraw/zinc/30/89/02/178308902.db2.gz PRHCGXDRVMMYSH-VIFPVBQESA-N 1 2 228.723 2.038 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CC[C@@H]1SC ZINC000576631323 365642455 /nfs/dbraw/zinc/64/24/55/365642455.db2.gz ZPBLIYIVYQTSTA-WPRPVWTQSA-N 1 2 224.329 2.396 20 0 BEADLO C[C@H](Nc1c[nH]c[nH+]1)C1CCSCC1 ZINC000306202873 398253454 /nfs/dbraw/zinc/25/34/54/398253454.db2.gz QFFKRUABYCMXMS-QMMMGPOBSA-N 1 2 211.334 2.353 20 0 BEADLO CCc1cc(N[C@@H](CO)CCC(C)C)nc[nH+]1 ZINC000624530621 343996526 /nfs/dbraw/zinc/99/65/26/343996526.db2.gz PMMDEHQYYKFXFV-GFCCVEGCSA-N 1 2 237.347 2.248 20 0 BEADLO CC(C)CC[C@@H](CO)Nc1cccc[nH+]1 ZINC000624530358 343995929 /nfs/dbraw/zinc/99/59/29/343995929.db2.gz JASICKQYWUWJKI-NSHDSACASA-N 1 2 208.305 2.291 20 0 BEADLO CC[C@H]1CC[C@H](C(=O)NCc2c[nH+]cn2C)CC1 ZINC000291482635 538948123 /nfs/dbraw/zinc/94/81/23/538948123.db2.gz QIBRPZMCBVQEJB-HAQNSBGRSA-N 1 2 249.358 2.253 20 0 BEADLO CCC(CC)N(CC)C(=O)CCn1cc[nH+]c1 ZINC000289128512 168370919 /nfs/dbraw/zinc/37/09/19/168370919.db2.gz NBENYSRMKFXILI-UHFFFAOYSA-N 1 2 237.347 2.310 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)CC1(C)CCCC1 ZINC000291536773 538947886 /nfs/dbraw/zinc/94/78/86/538947886.db2.gz WYQAGKMFPIJGOM-UHFFFAOYSA-N 1 2 235.331 2.007 20 0 BEADLO Cc1csc(C[NH+]2C[C@H](C)O[C@@H](C)C2)n1 ZINC000081643018 398270453 /nfs/dbraw/zinc/27/04/53/398270453.db2.gz BWGYEDWDCLGQFB-UWVGGRQHSA-N 1 2 226.345 2.061 20 0 BEADLO CC[C@H]([NH2+]CC(C)(F)F)c1cnn(C)c1 ZINC000378778664 346830864 /nfs/dbraw/zinc/83/08/64/346830864.db2.gz GINWUNWKYMYWTP-VIFPVBQESA-N 1 2 217.263 2.116 20 0 BEADLO CC(C)[C@@H](C)N(C)C(=O)CCCn1cc[nH+]c1 ZINC000590218554 346832329 /nfs/dbraw/zinc/83/23/29/346832329.db2.gz QQAMZACTFPYQIO-GFCCVEGCSA-N 1 2 237.347 2.166 20 0 BEADLO CC(C)(C(=O)N1CC(n2cc[nH+]c2)C1)C1CCC1 ZINC000580281392 346840666 /nfs/dbraw/zinc/84/06/66/346840666.db2.gz UYMCATKOEWIECL-UHFFFAOYSA-N 1 2 247.342 2.093 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2cnoc2C)s1 ZINC000188847462 346845347 /nfs/dbraw/zinc/84/53/47/346845347.db2.gz DUPBUQLCCDJECZ-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2cnoc2C)s1 ZINC000188847462 346845350 /nfs/dbraw/zinc/84/53/50/346845350.db2.gz DUPBUQLCCDJECZ-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1noc(C)c1CC[NH2+][C@@H](C)c1cn[nH]c1C ZINC000180500641 538958344 /nfs/dbraw/zinc/95/83/44/538958344.db2.gz FXXJRCGCDIIWMG-QMMMGPOBSA-N 1 2 248.330 2.216 20 0 BEADLO Fc1ccc2c(c1)CC[N@@H+](Cc1cncnc1)C2 ZINC000181440528 538960649 /nfs/dbraw/zinc/96/06/49/538960649.db2.gz GTRNVALRIIHNIA-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1ccc2c(c1)CC[N@H+](Cc1cncnc1)C2 ZINC000181440528 538960651 /nfs/dbraw/zinc/96/06/51/538960651.db2.gz GTRNVALRIIHNIA-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO CO[C@@H](C[NH2+][C@@H](C)c1cn[nH]c1C)C(C)(C)C ZINC000180691010 538958798 /nfs/dbraw/zinc/95/87/98/538958798.db2.gz VJWZVGHZZFJNNK-CABZTGNLSA-N 1 2 239.363 2.430 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CS[C@@H](C)C1)C(=O)OC(C)(C)C ZINC000602591441 349614796 /nfs/dbraw/zinc/61/47/96/349614796.db2.gz FWRZAQJZFFYGPB-AEJSXWLSSA-N 1 2 245.388 2.200 20 0 BEADLO C[C@@H]1[C@@H](C)[C@H](C)CN1c1nc[nH+]c(N)c1Cl ZINC000399742147 342742262 /nfs/dbraw/zinc/74/22/62/342742262.db2.gz JJXLKACYPYJJIL-GJMOJQLCSA-N 1 2 240.738 2.193 20 0 BEADLO C[C@@H]1[C@@H](C)[C@H](C)CN1c1[nH+]cnc(N)c1Cl ZINC000399742147 342742263 /nfs/dbraw/zinc/74/22/63/342742263.db2.gz JJXLKACYPYJJIL-GJMOJQLCSA-N 1 2 240.738 2.193 20 0 BEADLO C[C@@H]([NH2+][C@H]1CS[C@@H](C)C1)C(=O)OC(C)(C)C ZINC000602591442 349614947 /nfs/dbraw/zinc/61/49/47/349614947.db2.gz FWRZAQJZFFYGPB-IVZWLZJFSA-N 1 2 245.388 2.200 20 0 BEADLO Cc1cc(N2CC[C@@H](C)C[C@H]2C)nc[nH+]1 ZINC000335605911 136236403 /nfs/dbraw/zinc/23/64/03/136236403.db2.gz URDOOFJSSNPBLM-MWLCHTKSSA-N 1 2 205.305 2.410 20 0 BEADLO CCC(CC)NC(=O)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000377103618 168384459 /nfs/dbraw/zinc/38/44/59/168384459.db2.gz NZRNJMQCGQBENG-JTQLQIEISA-N 1 2 235.331 2.134 20 0 BEADLO CCC(CC)NC(=O)[C@H]1CCCc2[nH]c[nH+]c21 ZINC000377103618 168384460 /nfs/dbraw/zinc/38/44/60/168384460.db2.gz NZRNJMQCGQBENG-JTQLQIEISA-N 1 2 235.331 2.134 20 0 BEADLO OCC(F)(F)C[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000184698574 538969486 /nfs/dbraw/zinc/96/94/86/538969486.db2.gz SRRXDXADRKQNCM-NSHDSACASA-N 1 2 245.244 2.030 20 0 BEADLO O[C@H](Cn1cc[nH+]c1)c1cccc(Cl)c1 ZINC000146860910 342772874 /nfs/dbraw/zinc/77/28/74/342772874.db2.gz LRZUTWGAXVSLHO-LLVKDONJSA-N 1 2 222.675 2.270 20 0 BEADLO C[C@H](CO)CSCc1cn2ccccc2[nH+]1 ZINC000085138661 398287387 /nfs/dbraw/zinc/28/73/87/398287387.db2.gz UYRUNUJEMZCCPP-SNVBAGLBSA-N 1 2 236.340 2.196 20 0 BEADLO COc1cc([C@H](C)[NH2+]Cc2nccs2)ccn1 ZINC000347682989 398284726 /nfs/dbraw/zinc/28/47/26/398284726.db2.gz PGTZDJNEPNPVES-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO COc1ccccc1-c1c[nH+]c(C)n1C ZINC000630049999 361912095 /nfs/dbraw/zinc/91/20/95/361912095.db2.gz LKMMXUBKEJWIEA-UHFFFAOYSA-N 1 2 202.257 2.404 20 0 BEADLO C/C=C\CNc1nc(C)[nH+]c2c1CCCC2 ZINC000624656080 342809956 /nfs/dbraw/zinc/80/99/56/342809956.db2.gz FOGOBDRPEVUFHG-ARJAWSKDSA-N 1 2 217.316 2.074 20 0 BEADLO CCc1cc(NC[C@]2(C)C[C@H]3C[C@H]3C2)nc[nH+]1 ZINC000624657268 342811064 /nfs/dbraw/zinc/81/10/64/342811064.db2.gz LXLVMPZTMGFTGF-GNXNZQSNSA-N 1 2 231.343 2.309 20 0 BEADLO CC(C)[N@@H+](Cc1ccn(C)n1)Cc1ccco1 ZINC000271064613 187335661 /nfs/dbraw/zinc/33/56/61/187335661.db2.gz ZUAFKNFXZNVDMB-UHFFFAOYSA-N 1 2 233.315 2.424 20 0 BEADLO CC(C)[N@H+](Cc1ccn(C)n1)Cc1ccco1 ZINC000271064613 187335663 /nfs/dbraw/zinc/33/56/63/187335663.db2.gz ZUAFKNFXZNVDMB-UHFFFAOYSA-N 1 2 233.315 2.424 20 0 BEADLO Cc1noc(C)c1-c1c[nH+]c2n1CCCC2 ZINC000630050421 361913294 /nfs/dbraw/zinc/91/32/94/361913294.db2.gz BHRAEDAENJEEIK-UHFFFAOYSA-N 1 2 217.272 2.491 20 0 BEADLO CCn1nccc1-c1c[nH+]c2n1CCCC2 ZINC000630050588 361913541 /nfs/dbraw/zinc/91/35/41/361913541.db2.gz HVBLOSDUFXOQOE-UHFFFAOYSA-N 1 2 216.288 2.103 20 0 BEADLO OCc1cccc(-c2c[nH+]c3n2CCCC3)c1 ZINC000630050386 361913834 /nfs/dbraw/zinc/91/38/34/361913834.db2.gz PMFUIPSNNQFXES-UHFFFAOYSA-N 1 2 228.295 2.379 20 0 BEADLO CCC(O)(CC)CN(C)c1cccc[nH+]1 ZINC000624713725 342821552 /nfs/dbraw/zinc/82/15/52/342821552.db2.gz AUZZLKLXLDWYCZ-UHFFFAOYSA-N 1 2 208.305 2.069 20 0 BEADLO COc1ccc(N[C@H](C)[C@@H]2CCCCO2)[nH+]c1 ZINC000379206735 538976719 /nfs/dbraw/zinc/97/67/19/538976719.db2.gz BRENKFIDGSWBSL-PWSUYJOCSA-N 1 2 236.315 2.460 20 0 BEADLO C[C@@H](N(C)C(=O)CCc1c[nH+]c[nH]1)C(C)(C)C ZINC000562255627 323013911 /nfs/dbraw/zinc/01/39/11/323013911.db2.gz XLXXFGQHJIFBBB-SNVBAGLBSA-N 1 2 237.347 2.235 20 0 BEADLO C[C@@H](N(C)C(=O)CCc1c[nH]c[nH+]1)C(C)(C)C ZINC000562255627 323013912 /nfs/dbraw/zinc/01/39/12/323013912.db2.gz XLXXFGQHJIFBBB-SNVBAGLBSA-N 1 2 237.347 2.235 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)CCc2c[nH+]c[nH]2)C1 ZINC000189058950 538980405 /nfs/dbraw/zinc/98/04/05/538980405.db2.gz VGYZFKXWLOVFFL-GHMZBOCLSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)CCc2c[nH]c[nH+]2)C1 ZINC000189058950 538980407 /nfs/dbraw/zinc/98/04/07/538980407.db2.gz VGYZFKXWLOVFFL-GHMZBOCLSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H]1CCC[C@@H](NC(=O)CCc2c[nH+]c[nH]2)C1 ZINC000189058968 538981259 /nfs/dbraw/zinc/98/12/59/538981259.db2.gz VGYZFKXWLOVFFL-WDEREUQCSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H]1CCC[C@@H](NC(=O)CCc2c[nH]c[nH+]2)C1 ZINC000189058968 538981260 /nfs/dbraw/zinc/98/12/60/538981260.db2.gz VGYZFKXWLOVFFL-WDEREUQCSA-N 1 2 235.331 2.037 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N1CCC[C@H]2CCC[C@H]21 ZINC000189439354 538983373 /nfs/dbraw/zinc/98/33/73/538983373.db2.gz HSAQIBPBUMGZAY-DGCLKSJQSA-N 1 2 247.342 2.133 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N1CCC[C@H]2CCC[C@H]21 ZINC000189439354 538983374 /nfs/dbraw/zinc/98/33/74/538983374.db2.gz HSAQIBPBUMGZAY-DGCLKSJQSA-N 1 2 247.342 2.133 20 0 BEADLO COc1cnccc1[C@H](C)[NH2+]Cc1nccs1 ZINC000189565283 538983900 /nfs/dbraw/zinc/98/39/00/538983900.db2.gz LWUJXDYCYORPKK-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO CCc1nn(C)cc1CNc1cc[nH+]cc1F ZINC000192150890 538993903 /nfs/dbraw/zinc/99/39/03/538993903.db2.gz LRBQZJHDPGBXOE-UHFFFAOYSA-N 1 2 234.278 2.129 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H]1CSC1(C)C ZINC000380115082 538985467 /nfs/dbraw/zinc/98/54/67/538985467.db2.gz PGXDDESFHLEHLL-OIBJUYFYSA-N 1 2 225.361 2.263 20 0 BEADLO Cc1n[nH]c(C)c1C[NH2+][C@@H]1CCCC1(F)F ZINC000381534587 539003258 /nfs/dbraw/zinc/00/32/58/539003258.db2.gz DTSUCAWEHFTJJM-SNVBAGLBSA-N 1 2 229.274 2.304 20 0 BEADLO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1ccon1 ZINC000381530302 539003372 /nfs/dbraw/zinc/00/33/72/539003372.db2.gz YRZFDTVLNVCODG-SSDOTTSWSA-N 1 2 221.260 2.130 20 0 BEADLO CC(C)[C@H](NC(=O)[C@@H]1CC12CC2)c1[nH]cc[nH+]1 ZINC000640724696 361962981 /nfs/dbraw/zinc/96/29/81/361962981.db2.gz SEUOEKTZDZVYNQ-UWVGGRQHSA-N 1 2 233.315 2.023 20 0 BEADLO FCC(CF)[NH2+]Cc1scnc1C1CC1 ZINC000449382150 398295679 /nfs/dbraw/zinc/29/56/79/398295679.db2.gz VAHCVXMZQOSSCQ-UHFFFAOYSA-N 1 2 232.299 2.418 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CCCOCC1 ZINC000381378379 538999160 /nfs/dbraw/zinc/99/91/60/538999160.db2.gz JRQCSVFVWHMREA-SNVBAGLBSA-N 1 2 222.288 2.071 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCCC1(F)F)c1cnn(C)c1 ZINC000381448311 539000587 /nfs/dbraw/zinc/00/05/87/539000587.db2.gz GOEHBXRMAKMBKG-SCZZXKLOSA-N 1 2 229.274 2.259 20 0 BEADLO CC1(CNc2cc3cc[nH]c3c[nH+]2)COC1 ZINC000381433428 539000661 /nfs/dbraw/zinc/00/06/61/539000661.db2.gz XIMGIWCRSCDPQQ-UHFFFAOYSA-N 1 2 217.272 2.011 20 0 BEADLO CC(C)(C)c1nc(N[C@H]2CC2(C)C)cc[nH+]1 ZINC000390259969 539020849 /nfs/dbraw/zinc/02/08/49/539020849.db2.gz NLXCAJXVIUJEJR-VIFPVBQESA-N 1 2 219.332 2.406 20 0 BEADLO CC(C)(C)c1nc(N[C@H]2CCSC2)cc[nH+]1 ZINC000390259545 539020891 /nfs/dbraw/zinc/02/08/91/539020891.db2.gz NJBPTHZJBNWVNS-VIFPVBQESA-N 1 2 237.372 2.113 20 0 BEADLO CC[C@@H](C)NC(=O)[C@H](C)[N@H+](C)Cc1ccco1 ZINC000042334351 361980306 /nfs/dbraw/zinc/98/03/06/361980306.db2.gz LZBADLYMKNYQRR-MNOVXSKESA-N 1 2 238.331 2.015 20 0 BEADLO CC[C@@H](C)NC(=O)[C@H](C)[N@@H+](C)Cc1ccco1 ZINC000042334351 361980311 /nfs/dbraw/zinc/98/03/11/361980311.db2.gz LZBADLYMKNYQRR-MNOVXSKESA-N 1 2 238.331 2.015 20 0 BEADLO CCn1nccc1C[NH2+][C@@H]1CCCC1(F)F ZINC000390461111 539022231 /nfs/dbraw/zinc/02/22/31/539022231.db2.gz FVPAGUBDBODJHH-SNVBAGLBSA-N 1 2 229.274 2.180 20 0 BEADLO C[C@H](N[C@@H]1CCCC1(F)F)c1[nH+]ccn1C ZINC000390645497 539026841 /nfs/dbraw/zinc/02/68/41/539026841.db2.gz NTMABPJNYTZTER-DTWKUNHWSA-N 1 2 229.274 2.259 20 0 BEADLO C=Cn1cc(C[NH2+][C@H]2CCCC2(F)F)cn1 ZINC000390816396 539027423 /nfs/dbraw/zinc/02/74/23/539027423.db2.gz LOYNJXSUUIWWFZ-JTQLQIEISA-N 1 2 227.258 2.261 20 0 BEADLO COc1ccc(N[C@H](C)[C@H]2CCCOC2)[nH+]c1 ZINC000389101822 539015551 /nfs/dbraw/zinc/01/55/51/539015551.db2.gz LIDULUPBPNLAOB-MNOVXSKESA-N 1 2 236.315 2.317 20 0 BEADLO CCC[C@H](C[N@H+](C)[C@H](C)c1nc(C)no1)OC ZINC000639300294 398300685 /nfs/dbraw/zinc/30/06/85/398300685.db2.gz HRWNJMOCNULKPR-MWLCHTKSSA-N 1 2 241.335 2.186 20 0 BEADLO CCC[C@H](C[N@@H+](C)[C@H](C)c1nc(C)no1)OC ZINC000639300294 398300687 /nfs/dbraw/zinc/30/06/87/398300687.db2.gz HRWNJMOCNULKPR-MWLCHTKSSA-N 1 2 241.335 2.186 20 0 BEADLO C[N@@H+](Cc1noc(C2CCC2)n1)CC1CC1 ZINC000625089935 342850852 /nfs/dbraw/zinc/85/08/52/342850852.db2.gz LXSVFKYCVKZTHX-UHFFFAOYSA-N 1 2 221.304 2.179 20 0 BEADLO C[N@H+](Cc1noc(C2CCC2)n1)CC1CC1 ZINC000625089935 342850853 /nfs/dbraw/zinc/85/08/53/342850853.db2.gz LXSVFKYCVKZTHX-UHFFFAOYSA-N 1 2 221.304 2.179 20 0 BEADLO C[C@@H](CC(=O)N(C)Cc1ccco1)n1cc[nH+]c1 ZINC000649518933 398307230 /nfs/dbraw/zinc/30/72/30/398307230.db2.gz NSCZSSIVKMNKMO-NSHDSACASA-N 1 2 247.298 2.086 20 0 BEADLO C[N@H+](CC(=O)c1ccccc1F)C1CC1 ZINC000037334325 398315964 /nfs/dbraw/zinc/31/59/64/398315964.db2.gz LFPMBNDSOWGCEO-UHFFFAOYSA-N 1 2 207.248 2.103 20 0 BEADLO C[N@@H+](CC(=O)c1ccccc1F)C1CC1 ZINC000037334325 398315967 /nfs/dbraw/zinc/31/59/67/398315967.db2.gz LFPMBNDSOWGCEO-UHFFFAOYSA-N 1 2 207.248 2.103 20 0 BEADLO CC(=O)C[NH+]1CCN(c2cccc(C)c2C)CC1 ZINC000037333760 398316129 /nfs/dbraw/zinc/31/61/29/398316129.db2.gz NBIFXSLHRPKKMR-UHFFFAOYSA-N 1 2 246.354 2.014 20 0 BEADLO CC[C@@H](C)C[NH2+]Cc1[nH]ncc1Br ZINC000388664812 342885031 /nfs/dbraw/zinc/88/50/31/342885031.db2.gz WKARUNUAWINOPN-SSDOTTSWSA-N 1 2 246.152 2.308 20 0 BEADLO C[C@H]1C[NH+](Cc2noc(C3CCC3)n2)C[C@@H]1C ZINC000625197511 342908314 /nfs/dbraw/zinc/90/83/14/342908314.db2.gz KXLVVQPNCFNZOM-UWVGGRQHSA-N 1 2 235.331 2.425 20 0 BEADLO C[C@@H]1C[C@H](Nc2cnn(CCF)c2)c2[nH+]ccn21 ZINC000624127938 346875368 /nfs/dbraw/zinc/87/53/68/346875368.db2.gz VWCSFBXGHASIFL-KOLCDFICSA-N 1 2 249.293 2.167 20 0 BEADLO CCCCc1noc(C[N@H+](CC)C2CC2)n1 ZINC000045771084 342918695 /nfs/dbraw/zinc/91/86/95/342918695.db2.gz NYEVZMXJRDRTIV-UHFFFAOYSA-N 1 2 223.320 2.397 20 0 BEADLO CCCCc1noc(C[N@@H+](CC)C2CC2)n1 ZINC000045771084 342918696 /nfs/dbraw/zinc/91/86/96/342918696.db2.gz NYEVZMXJRDRTIV-UHFFFAOYSA-N 1 2 223.320 2.397 20 0 BEADLO CC[C@@H]1C[C@@H](C)CN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492856858 529421572 /nfs/dbraw/zinc/42/15/72/529421572.db2.gz CKPOSDQDLMWWGW-ZHLVKLTDSA-N 1 2 233.315 2.070 20 0 BEADLO CC[C@@H]1C[C@@H](C)CN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492856855 529421578 /nfs/dbraw/zinc/42/15/78/529421578.db2.gz CKPOSDQDLMWWGW-DJVCXFJCSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@@H]([NH2+][C@H](C)[C@@H]1CC1(F)F)C(=O)OC(C)(C)C ZINC000602594943 349643755 /nfs/dbraw/zinc/64/37/55/349643755.db2.gz STFMTYROAOFJJK-HLTSFMKQSA-N 1 2 249.301 2.350 20 0 BEADLO CC[C@H]1CN(Cc2[nH]c(C)c(C)[nH+]2)C[C@@H](C)O1 ZINC000628155045 398336136 /nfs/dbraw/zinc/33/61/36/398336136.db2.gz OQZMNEZFJKDXCL-SKDRFNHKSA-N 1 2 237.347 2.026 20 0 BEADLO CCN(CCC1CC1)C(=O)Nc1cc[nH+]c(C)c1 ZINC000355193715 398331713 /nfs/dbraw/zinc/33/17/13/398331713.db2.gz WKRJUPZALJTNMT-UHFFFAOYSA-N 1 2 247.342 2.466 20 0 BEADLO CC[C@@H](O)Cn1c(C)[nH+]c2ccccc21 ZINC000037694366 342941426 /nfs/dbraw/zinc/94/14/26/342941426.db2.gz MRLOTDOJWCUBKH-SNVBAGLBSA-N 1 2 204.273 2.116 20 0 BEADLO C[C@H](NCc1c[nH+]c2ccccn12)C(F)(F)F ZINC000643799551 398339870 /nfs/dbraw/zinc/33/98/70/398339870.db2.gz BMPXTUISOQGCPP-QMMMGPOBSA-N 1 2 243.232 2.375 20 0 BEADLO c1cnc2c(c1)cccc2C[N@@H+]1CCO[C@@H]2C[C@@H]21 ZINC000368327581 398343611 /nfs/dbraw/zinc/34/36/11/398343611.db2.gz GIMVXHSUGUBVLA-UONOGXRCSA-N 1 2 240.306 2.208 20 0 BEADLO c1cnc2c(c1)cccc2C[N@H+]1CCO[C@@H]2C[C@@H]21 ZINC000368327581 398343612 /nfs/dbraw/zinc/34/36/12/398343612.db2.gz GIMVXHSUGUBVLA-UONOGXRCSA-N 1 2 240.306 2.208 20 0 BEADLO COc1ccc(C[NH2+]CC(F)F)cc1 ZINC000037755732 342951901 /nfs/dbraw/zinc/95/19/01/342951901.db2.gz IMKIZPDGBFALQR-UHFFFAOYSA-N 1 2 201.216 2.050 20 0 BEADLO Cc1cc(N(C)Cc2cc[nH]n2)nc(C(C)C)[nH+]1 ZINC000351819264 136255936 /nfs/dbraw/zinc/25/59/36/136255936.db2.gz BDYRXTBQBXXTMZ-UHFFFAOYSA-N 1 2 245.330 2.268 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N(C)[C@@H](C)C(C)C ZINC000493199219 529556757 /nfs/dbraw/zinc/55/67/57/529556757.db2.gz CKYZNYUKLSBBDA-KRZKBDHCSA-N 1 2 249.358 2.419 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)NCC1(CC)CC1 ZINC000492487302 529558682 /nfs/dbraw/zinc/55/86/82/529558682.db2.gz CKBDTZBWRMCOGH-WAYWQWQTSA-N 1 2 247.342 2.223 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N[C@@H](C)CC(C)C ZINC000492494977 529560155 /nfs/dbraw/zinc/56/01/55/529560155.db2.gz UOCREUKISSMPIW-DGMVEKRQSA-N 1 2 249.358 2.467 20 0 BEADLO CC(C)Cn1cc[nH+]c1CNC(=O)C[C@H]1C[C@H]1C ZINC000354706895 187211237 /nfs/dbraw/zinc/21/12/37/187211237.db2.gz HQHCBZNVKZAXTA-VXGBXAGGSA-N 1 2 249.358 2.201 20 0 BEADLO CC[C@@H](C)[C@H]([NH2+]Cc1ccccc1)C(=O)OC ZINC000035042620 349707331 /nfs/dbraw/zinc/70/73/31/349707331.db2.gz PTFWBRJIWLYMTF-YPMHNXCESA-N 1 2 235.327 2.364 20 0 BEADLO CC[C@@H](NC(=O)C=Cc1c[nH]c[nH+]1)C(C)(C)C ZINC000493454378 529572999 /nfs/dbraw/zinc/57/29/99/529572999.db2.gz GPUUIFRBVFWBKQ-JMEBYUIHSA-N 1 2 235.331 2.364 20 0 BEADLO COC(=O)c1coc([C@H](C)[NH+]2CCCCC2)n1 ZINC000602765089 349721712 /nfs/dbraw/zinc/72/17/12/349721712.db2.gz BTEVOARHNGZSGM-VIFPVBQESA-N 1 2 238.287 2.008 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)OC1CCC1 ZINC000495865741 529587812 /nfs/dbraw/zinc/58/78/12/529587812.db2.gz BRBHAOCWWPAGFA-SECBINFHSA-N 1 2 237.303 2.243 20 0 BEADLO C[C@@H]1C[NH+](Cc2nccn2C)C[C@@H](C)C1(F)F ZINC000625650846 344023803 /nfs/dbraw/zinc/02/38/03/344023803.db2.gz SFPGQQJDFUFGPM-NXEZZACHSA-N 1 2 243.301 2.143 20 0 BEADLO C[C@@H](NC(=O)[C@@H](C)CC(F)(F)F)c1[nH]cc[nH+]1 ZINC000402717963 343039638 /nfs/dbraw/zinc/03/96/38/343039638.db2.gz HTYQFVVSWNJHOR-NKWVEPMBSA-N 1 2 249.236 2.175 20 0 BEADLO Cc1nc(N2CCC3(CCOCC3)[C@@H]2C)cc[nH+]1 ZINC000374926307 187224776 /nfs/dbraw/zinc/22/47/76/187224776.db2.gz FGUPFZBYRQPFAY-NSHDSACASA-N 1 2 247.342 2.180 20 0 BEADLO C1CC1c1nc(N[C@@H]2CC23CC3)c2c([nH+]1)CCC2 ZINC000576838944 365702446 /nfs/dbraw/zinc/70/24/46/365702446.db2.gz WXYVMPOGFYBCPN-GFCCVEGCSA-N 1 2 241.338 2.229 20 0 BEADLO CC[C@H](C)CNC(=O)Cc1cn2ccccc2[nH+]1 ZINC000421581688 192356474 /nfs/dbraw/zinc/35/64/74/192356474.db2.gz RJJGAMRWCQEQKF-NSHDSACASA-N 1 2 245.326 2.039 20 0 BEADLO Cc1cc(NC(=O)NCCC2(C)CC2)c(C)c[nH+]1 ZINC000576878861 365712809 /nfs/dbraw/zinc/71/28/09/365712809.db2.gz ASXHNLQCPIDCOO-UHFFFAOYSA-N 1 2 247.342 2.432 20 0 BEADLO CC[C@@H](C)CNC(=O)Cc1cn2ccccc2[nH+]1 ZINC000421581687 192356309 /nfs/dbraw/zinc/35/63/09/192356309.db2.gz RJJGAMRWCQEQKF-LLVKDONJSA-N 1 2 245.326 2.039 20 0 BEADLO C[NH2+]Cc1noc([C@H]2C[C@@H]2C2CCCCC2)n1 ZINC000576959518 365734474 /nfs/dbraw/zinc/73/44/74/365734474.db2.gz ZUDDYXCYKKAOEH-MNOVXSKESA-N 1 2 235.331 2.473 20 0 BEADLO CCC[C@H](C)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000125361409 343172975 /nfs/dbraw/zinc/17/29/75/343172975.db2.gz CEMDVMVETUIEGV-DTWKUNHWSA-N 1 2 209.293 2.023 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+](Cc2nnsc2Cl)C1 ZINC000125700383 343173998 /nfs/dbraw/zinc/17/39/98/343173998.db2.gz LCJLGTSJPQPJHW-RQJHMYQMSA-N 1 2 231.752 2.422 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+](Cc2nnsc2Cl)C1 ZINC000125700383 343174000 /nfs/dbraw/zinc/17/40/00/343174000.db2.gz LCJLGTSJPQPJHW-RQJHMYQMSA-N 1 2 231.752 2.422 20 0 BEADLO CC(C)n1ccc(CNc2cccc[nH+]2)n1 ZINC000077993012 343249576 /nfs/dbraw/zinc/24/95/76/343249576.db2.gz DTCYDHOLACALRG-UHFFFAOYSA-N 1 2 216.288 2.471 20 0 BEADLO COC(=O)C(C)(C)[NH2+]C[C@H](C)c1ccccc1 ZINC000037085133 343333555 /nfs/dbraw/zinc/33/35/55/343333555.db2.gz FXRDJLVWZRESNV-NSHDSACASA-N 1 2 235.327 2.331 20 0 BEADLO CC(C)/C=C\c1cn(CCCn2cc[nH+]c2)nn1 ZINC000641055593 362166285 /nfs/dbraw/zinc/16/62/85/362166285.db2.gz XPYHXNHLRRXUIX-PLNGDYQASA-N 1 2 245.330 2.234 20 0 BEADLO Cc1[nH+]cccc1Cn1cc(C(C)(C)C)nn1 ZINC000641052935 362162704 /nfs/dbraw/zinc/16/27/04/362162704.db2.gz WOTKATCGXMSVRT-UHFFFAOYSA-N 1 2 230.315 2.327 20 0 BEADLO CC(C)(C(=O)NCCCC1CCC1)c1c[nH]c[nH+]1 ZINC000618614028 343307471 /nfs/dbraw/zinc/30/74/71/343307471.db2.gz GXHFVAAEDUTADY-UHFFFAOYSA-N 1 2 249.358 2.384 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@H](C)C1CCCC1 ZINC000584063269 343312202 /nfs/dbraw/zinc/31/22/02/343312202.db2.gz MPPGWPUXBUMDGT-GHMZBOCLSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@H](C)C1CCCC1 ZINC000584063269 343312203 /nfs/dbraw/zinc/31/22/03/343312203.db2.gz MPPGWPUXBUMDGT-GHMZBOCLSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](O)CC(C)(C)CNc1cccc[nH+]1 ZINC000078339860 343368434 /nfs/dbraw/zinc/36/84/34/343368434.db2.gz UMIQNZBZMVXRDY-JTQLQIEISA-N 1 2 208.305 2.291 20 0 BEADLO Cn1cc[nH+]c1CNc1ncccc1Cl ZINC000070853862 343338889 /nfs/dbraw/zinc/33/88/89/343338889.db2.gz VGBGWDBXEJFXKC-UHFFFAOYSA-N 1 2 222.679 2.081 20 0 BEADLO C[C@H]1C[C@H]1CNc1ccc(Cn2cc[nH+]c2)cn1 ZINC000348838065 136301998 /nfs/dbraw/zinc/30/19/98/136301998.db2.gz LUKKZUFAGWMUCU-AAEUAGOBSA-N 1 2 242.326 2.394 20 0 BEADLO Cn1nccc1[C@@H]1CCCN(c2cccc[nH+]2)C1 ZINC000335667458 136311668 /nfs/dbraw/zinc/31/16/68/136311668.db2.gz WAICYDPJMJJKFK-GFCCVEGCSA-N 1 2 242.326 2.199 20 0 BEADLO CCc1cc(N[C@H](C)c2csnn2)nc[nH+]1 ZINC000398318177 488215610 /nfs/dbraw/zinc/21/56/10/488215610.db2.gz GQAHJGDHMXVLRZ-SSDOTTSWSA-N 1 2 235.316 2.064 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1C(=O)N(C)Cc1[nH+]ccn1C ZINC000274672763 187338568 /nfs/dbraw/zinc/33/85/68/187338568.db2.gz KBMYJNGMXNFULP-BXUZGUMPSA-N 1 2 249.358 2.061 20 0 BEADLO NC(=O)[C@@H]1CC[N@H+](Cc2ncc(Cl)s2)C1 ZINC000335693274 136325751 /nfs/dbraw/zinc/32/57/51/136325751.db2.gz QXFVVGLWUYBSHD-ZCFIWIBFSA-N 1 2 245.735 2.154 20 0 BEADLO NC(=O)[C@@H]1CC[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000335693274 136325752 /nfs/dbraw/zinc/32/57/52/136325752.db2.gz QXFVVGLWUYBSHD-ZCFIWIBFSA-N 1 2 245.735 2.154 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)C1CCOCC1 ZINC000335694769 136326564 /nfs/dbraw/zinc/32/65/64/136326564.db2.gz QYMRDAYVPWZAOT-UHFFFAOYSA-N 1 2 234.299 2.064 20 0 BEADLO Cc1ccc(C[NH2+]Cc2ccn[nH]2)c(C)c1 ZINC000041013753 343412361 /nfs/dbraw/zinc/41/23/61/343412361.db2.gz AFVUWJZSLFDBGX-UHFFFAOYSA-N 1 2 215.300 2.316 20 0 BEADLO CCOc1ccccc1OCCn1cc[nH+]c1 ZINC000041258863 343417903 /nfs/dbraw/zinc/41/79/03/343417903.db2.gz WPHIGSDRYYHRBD-UHFFFAOYSA-N 1 2 232.283 2.361 20 0 BEADLO OC1(Cn2cc[nH+]c2-c2ccncc2)CCCC1 ZINC000349029133 136319485 /nfs/dbraw/zinc/31/94/85/136319485.db2.gz BIXSRVBXVMVVPY-UHFFFAOYSA-N 1 2 243.310 2.250 20 0 BEADLO CSCCC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000421557849 192361396 /nfs/dbraw/zinc/36/13/96/192361396.db2.gz LZYBWEMMPWIUEU-UHFFFAOYSA-N 1 2 238.356 2.068 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2cn3ccsc3n2)C1 ZINC000335721972 136346085 /nfs/dbraw/zinc/34/60/85/136346085.db2.gz SZCYFLLZINTIEW-NSHDSACASA-N 1 2 239.319 2.330 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2cn3ccsc3n2)C1 ZINC000335721972 136346086 /nfs/dbraw/zinc/34/60/86/136346086.db2.gz SZCYFLLZINTIEW-NSHDSACASA-N 1 2 239.319 2.330 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)CC1CCCCC1 ZINC000042509980 343441333 /nfs/dbraw/zinc/44/13/33/343441333.db2.gz GBUCLQBPYIEPAD-LBPRGKRZSA-N 1 2 249.358 2.358 20 0 BEADLO Cc1nc(N2CC(C)C2)c2c([nH+]1)CCCC2 ZINC000335725147 136347054 /nfs/dbraw/zinc/34/70/54/136347054.db2.gz UIOBDSAWLFLRFI-UHFFFAOYSA-N 1 2 217.316 2.120 20 0 BEADLO C[C@H]1CC[N@H+](C[C@@H]2CCCO2)CC1(F)F ZINC000335681422 136328974 /nfs/dbraw/zinc/32/89/74/136328974.db2.gz AAWMWNROBUVPER-UWVGGRQHSA-N 1 2 219.275 2.143 20 0 BEADLO C[C@H]1CC[N@@H+](C[C@@H]2CCCO2)CC1(F)F ZINC000335681422 136328975 /nfs/dbraw/zinc/32/89/75/136328975.db2.gz AAWMWNROBUVPER-UWVGGRQHSA-N 1 2 219.275 2.143 20 0 BEADLO Cc1cc(Cn2cc(C(C)(C)C)nn2)cc[nH+]1 ZINC000641089523 362213836 /nfs/dbraw/zinc/21/38/36/362213836.db2.gz QRRWZJVBCQPKFA-UHFFFAOYSA-N 1 2 230.315 2.327 20 0 BEADLO CCCCOC1CC[NH+](Cc2ncc[nH]2)CC1 ZINC000353969769 136357038 /nfs/dbraw/zinc/35/70/38/136357038.db2.gz CNWNCFQRGGECIF-UHFFFAOYSA-N 1 2 237.347 2.191 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)Cc1cnn(C)c1)c1cccnc1 ZINC000350518845 136361886 /nfs/dbraw/zinc/36/18/86/136361886.db2.gz WTXOLMJKOUPBSA-NWDGAFQWSA-N 1 2 244.342 2.097 20 0 BEADLO CC[C@@](C)([NH2+]C[C@@H]1CCOC1)C(F)(F)F ZINC000379931644 365744568 /nfs/dbraw/zinc/74/45/68/365744568.db2.gz OXHTXBSVMOTFAK-DTWKUNHWSA-N 1 2 225.254 2.344 20 0 BEADLO CCOC(C)(C)C[NH2+]C1CCSCC1 ZINC000166941420 136368049 /nfs/dbraw/zinc/36/80/49/136368049.db2.gz OUEGHWFCAXSZGF-UHFFFAOYSA-N 1 2 217.378 2.287 20 0 BEADLO Cc1ccc2[nH+]cc(CN(C)CC(F)F)n2c1 ZINC000092509289 136376520 /nfs/dbraw/zinc/37/65/20/136376520.db2.gz POKHJNGFCIIWNE-UHFFFAOYSA-N 1 2 239.269 2.340 20 0 BEADLO CCCN(C(=O)[C@@H]1CCc2[nH+]c[nH]c2C1)C(C)C ZINC000616695811 343541424 /nfs/dbraw/zinc/54/14/24/343541424.db2.gz LELFCLRMNLKYQR-LLVKDONJSA-N 1 2 249.358 2.162 20 0 BEADLO CCCN(C(=O)[C@@H]1CCc2[nH]c[nH+]c2C1)C(C)C ZINC000616695811 343541428 /nfs/dbraw/zinc/54/14/28/343541428.db2.gz LELFCLRMNLKYQR-LLVKDONJSA-N 1 2 249.358 2.162 20 0 BEADLO Cc1nc(C[NH2+][C@@H](C)c2cnn(C)c2)cs1 ZINC000044500251 343504413 /nfs/dbraw/zinc/50/44/13/343504413.db2.gz MCIWFKZFLSDDJF-QMMMGPOBSA-N 1 2 236.344 2.036 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CCc2[nH+]c[nH]c2C1)C(C)(C)C ZINC000616562074 343504890 /nfs/dbraw/zinc/50/48/90/343504890.db2.gz RNIIHPAWTLRXLD-ZJUUUORDSA-N 1 2 249.358 2.065 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CCc2[nH]c[nH+]c2C1)C(C)(C)C ZINC000616562074 343504891 /nfs/dbraw/zinc/50/48/91/343504891.db2.gz RNIIHPAWTLRXLD-ZJUUUORDSA-N 1 2 249.358 2.065 20 0 BEADLO CC[C@H](CC(C)C)C(=O)NCc1c[nH+]c[nH]1 ZINC000308088606 259364728 /nfs/dbraw/zinc/36/47/28/259364728.db2.gz NPRXZXISQMIPGW-SNVBAGLBSA-N 1 2 223.320 2.098 20 0 BEADLO CC[C@H](CC(C)C)C(=O)NCc1c[nH]c[nH+]1 ZINC000308088606 259364729 /nfs/dbraw/zinc/36/47/29/259364729.db2.gz NPRXZXISQMIPGW-SNVBAGLBSA-N 1 2 223.320 2.098 20 0 BEADLO CC(C)[C@@H](NC(=O)[C@H](C)Cc1c[nH+]c[nH]1)C1CC1 ZINC000620033003 343586918 /nfs/dbraw/zinc/58/69/18/343586918.db2.gz HMJITIRHAVZWTI-ZWNOBZJWSA-N 1 2 249.358 2.139 20 0 BEADLO CC(C)[C@@H](NC(=O)[C@H](C)Cc1c[nH]c[nH+]1)C1CC1 ZINC000620033003 343586920 /nfs/dbraw/zinc/58/69/20/343586920.db2.gz HMJITIRHAVZWTI-ZWNOBZJWSA-N 1 2 249.358 2.139 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)Nc1ccc(Cl)cn1 ZINC000049235995 343594391 /nfs/dbraw/zinc/59/43/91/343594391.db2.gz DBSFYTFHSCMFQD-VIFPVBQESA-N 1 2 236.706 2.432 20 0 BEADLO Cc1oc(C)c(C(=O)N(C)Cc2[nH]cc[nH+]2)c1C ZINC000070980617 343581153 /nfs/dbraw/zinc/58/11/53/343581153.db2.gz QRDHYDHSCHEAMM-UHFFFAOYSA-N 1 2 247.298 2.200 20 0 BEADLO COC(=O)[C@@H](C)[NH2+]CC(C)(C)c1ccccc1 ZINC000043627283 343617572 /nfs/dbraw/zinc/61/75/72/343617572.db2.gz QZGXBVNBGYHXPT-LLVKDONJSA-N 1 2 235.327 2.115 20 0 BEADLO CC1(C)C[C@@]1(C)NC(=O)c1ccc2[nH+]ccn2c1 ZINC000620077389 343637640 /nfs/dbraw/zinc/63/76/40/343637640.db2.gz AAKQEFBIOITFHF-CQSZACIVSA-N 1 2 243.310 2.253 20 0 BEADLO Cc1ccccc1[N@H+](C)C[C@@H]1CCNC(=O)CC1 ZINC000622764637 343650136 /nfs/dbraw/zinc/65/01/36/343650136.db2.gz VNNLUTOUNGNQTR-ZDUSSCGKSA-N 1 2 246.354 2.348 20 0 BEADLO Cc1ccccc1[N@@H+](C)C[C@@H]1CCNC(=O)CC1 ZINC000622764637 343650137 /nfs/dbraw/zinc/65/01/37/343650137.db2.gz VNNLUTOUNGNQTR-ZDUSSCGKSA-N 1 2 246.354 2.348 20 0 BEADLO CC(C)=CC[NH+]1CCN(C(=O)c2ccco2)CC1 ZINC000058019763 343696193 /nfs/dbraw/zinc/69/61/93/343696193.db2.gz TVCMDAOBNZPXBC-UHFFFAOYSA-N 1 2 248.326 2.004 20 0 BEADLO C/C=C(\C)C(=O)OCc1c[nH+]ccc1OC ZINC000287196437 187346382 /nfs/dbraw/zinc/34/63/82/187346382.db2.gz MPRGVYFMKDSLMQ-RUDMXATFSA-N 1 2 221.256 2.100 20 0 BEADLO Cc1cc(CNC(=O)C[C@@H]2C[C@@H]2C)cc(C)[nH+]1 ZINC000421573779 192364324 /nfs/dbraw/zinc/36/43/24/192364324.db2.gz CABRSOPQOCIIMZ-ZANVPECISA-N 1 2 232.327 2.361 20 0 BEADLO COc1cc[nH+]cc1Cn1cc(C(C)(C)C)nn1 ZINC000641168587 362250026 /nfs/dbraw/zinc/25/00/26/362250026.db2.gz JPXVJXVWAHFOEM-UHFFFAOYSA-N 1 2 246.314 2.028 20 0 BEADLO C[N@H+](C/C=C/c1ccncc1)Cc1ccon1 ZINC000494981256 529820240 /nfs/dbraw/zinc/82/02/40/529820240.db2.gz SIVDVAMMZDLJMD-NSCUHMNNSA-N 1 2 229.283 2.215 20 0 BEADLO C[N@@H+](C/C=C/c1ccncc1)Cc1ccon1 ZINC000494981256 529820241 /nfs/dbraw/zinc/82/02/41/529820241.db2.gz SIVDVAMMZDLJMD-NSCUHMNNSA-N 1 2 229.283 2.215 20 0 BEADLO Cc1nc(CN2CCc3[nH+]c[nH]c3C2)sc1C ZINC000625435447 343736680 /nfs/dbraw/zinc/73/66/80/343736680.db2.gz QUEMWDNRVSTDKM-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO Cc1cc[nH+]c([C@@H]2CCN(c3ncccn3)C2)c1 ZINC000624371620 343739404 /nfs/dbraw/zinc/73/94/04/343739404.db2.gz SRXKYJONDAIDFU-GFCCVEGCSA-N 1 2 240.310 2.174 20 0 BEADLO c1coc(C2=CCC[N@@H+](Cc3csnn3)C2)c1 ZINC000289598081 187347028 /nfs/dbraw/zinc/34/70/28/187347028.db2.gz VAAOJTSVPSDOQL-UHFFFAOYSA-N 1 2 247.323 2.420 20 0 BEADLO c1coc(C2=CCC[N@H+](Cc3csnn3)C2)c1 ZINC000289598081 187347030 /nfs/dbraw/zinc/34/70/30/187347030.db2.gz VAAOJTSVPSDOQL-UHFFFAOYSA-N 1 2 247.323 2.420 20 0 BEADLO Cc1cc(CNC(=O)C[C@H]2C[C@H]2C)cc(C)[nH+]1 ZINC000421573774 192364511 /nfs/dbraw/zinc/36/45/11/192364511.db2.gz CABRSOPQOCIIMZ-NOZJJQNGSA-N 1 2 232.327 2.361 20 0 BEADLO CCCCc1cc(NCC2CCOCC2)nc[nH+]1 ZINC000631087436 343748416 /nfs/dbraw/zinc/74/84/16/343748416.db2.gz XIBAJDUAIKOOHC-UHFFFAOYSA-N 1 2 249.358 2.080 20 0 BEADLO Cn1c[nH+]cc1COc1ccccc1F ZINC000090233668 343750005 /nfs/dbraw/zinc/75/00/05/343750005.db2.gz PAJPXIUBSADRAP-UHFFFAOYSA-N 1 2 206.220 2.138 20 0 BEADLO CC(C)N(C)c1ccc(C[NH2+]CC(F)F)cn1 ZINC000291416966 187348512 /nfs/dbraw/zinc/34/85/12/187348512.db2.gz HIHKDTLFAHOUPE-UHFFFAOYSA-N 1 2 243.301 2.281 20 0 BEADLO CC1(C)CCCCN(C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000336509386 537813556 /nfs/dbraw/zinc/81/35/56/537813556.db2.gz OTYBCGBBWJFUMU-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO CC1(C)CCCCN(C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000336509386 537813564 /nfs/dbraw/zinc/81/35/64/537813564.db2.gz OTYBCGBBWJFUMU-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO CC(C)(C)n1cc(C[NH+]2CC(C3CCC3)C2)nn1 ZINC000348711034 534952965 /nfs/dbraw/zinc/95/29/65/534952965.db2.gz PWUDSDMPVNSBOU-UHFFFAOYSA-N 1 2 248.374 2.265 20 0 BEADLO c1cc(N2CCCC2)[nH+]cc1N[C@@H]1CCCOC1 ZINC000070464223 187274480 /nfs/dbraw/zinc/27/44/80/187274480.db2.gz KAPRWBSAWBPPBQ-CYBMUJFWSA-N 1 2 247.342 2.273 20 0 BEADLO C[C@@H]1C[C@H]1C[N@H+](C)Cc1noc(C2CC2)n1 ZINC000625470404 343874711 /nfs/dbraw/zinc/87/47/11/343874711.db2.gz FSFZFGBJPIALAZ-SCZZXKLOSA-N 1 2 221.304 2.035 20 0 BEADLO C[C@@H]1C[C@H]1C[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000625470404 343874713 /nfs/dbraw/zinc/87/47/13/343874713.db2.gz FSFZFGBJPIALAZ-SCZZXKLOSA-N 1 2 221.304 2.035 20 0 BEADLO Cc1cc(NC(=O)N2CCC(C)(C)CC2)cc[nH+]1 ZINC000335889809 344044148 /nfs/dbraw/zinc/04/41/48/344044148.db2.gz AFJJYXNPAKNKGN-UHFFFAOYSA-N 1 2 247.342 2.466 20 0 BEADLO Cc1cnc(C[N@@H+]2CCCC(F)(F)CC2)nc1 ZINC000625770921 344066489 /nfs/dbraw/zinc/06/64/89/344066489.db2.gz YEUVHUTTXKVMBM-UHFFFAOYSA-N 1 2 241.285 2.406 20 0 BEADLO Cc1cnc(C[N@H+]2CCCC(F)(F)CC2)nc1 ZINC000625770921 344066490 /nfs/dbraw/zinc/06/64/90/344066490.db2.gz YEUVHUTTXKVMBM-UHFFFAOYSA-N 1 2 241.285 2.406 20 0 BEADLO OCc1cc[nH+]c(NCC2CCCC2)c1 ZINC000641284887 362344637 /nfs/dbraw/zinc/34/46/37/362344637.db2.gz RTRLZAIAUYKCMS-UHFFFAOYSA-N 1 2 206.289 2.176 20 0 BEADLO CC(C)C[C@H](C)CC(=O)NCc1c[nH+]c[nH]1 ZINC000331089345 187358593 /nfs/dbraw/zinc/35/85/93/187358593.db2.gz UAYJJNGCJHAYPQ-JTQLQIEISA-N 1 2 223.320 2.098 20 0 BEADLO CC(C)C[C@H](C)CC(=O)NCc1c[nH]c[nH+]1 ZINC000331089345 187358595 /nfs/dbraw/zinc/35/85/95/187358595.db2.gz UAYJJNGCJHAYPQ-JTQLQIEISA-N 1 2 223.320 2.098 20 0 BEADLO CC[C@@H](C)Cc1noc(CCn2cc[nH+]c2)n1 ZINC000632246057 344078286 /nfs/dbraw/zinc/07/82/86/344078286.db2.gz KWJQCTNPLLOFGB-SNVBAGLBSA-N 1 2 234.303 2.097 20 0 BEADLO CCCC[C@@H]([NH2+][C@H](C)COC(C)C)C(=O)OC ZINC000337514750 344117402 /nfs/dbraw/zinc/11/74/02/344117402.db2.gz UKZNIUZMZNXTHD-VXGBXAGGSA-N 1 2 245.363 2.121 20 0 BEADLO C(c1nnc(C2CC2)o1)[NH+](C1CC1)C1CC1 ZINC000625838270 344090629 /nfs/dbraw/zinc/09/06/29/344090629.db2.gz WWUKYBZWHXABTK-UHFFFAOYSA-N 1 2 219.288 2.074 20 0 BEADLO CC(C)Cn1ncnc1C[NH+](C1CC1)C1CC1 ZINC000625843297 344094452 /nfs/dbraw/zinc/09/44/52/344094452.db2.gz SFPBWOBPTDLMFO-UHFFFAOYSA-N 1 2 234.347 2.061 20 0 BEADLO Cn1cnnc1C[N@@H+]1CCC[C@H]1c1cccs1 ZINC000195513940 344207687 /nfs/dbraw/zinc/20/76/87/344207687.db2.gz MPYBORCSKBSVRR-JTQLQIEISA-N 1 2 248.355 2.214 20 0 BEADLO Cn1cnnc1C[N@H+]1CCC[C@H]1c1cccs1 ZINC000195513940 344207688 /nfs/dbraw/zinc/20/76/88/344207688.db2.gz MPYBORCSKBSVRR-JTQLQIEISA-N 1 2 248.355 2.214 20 0 BEADLO CN(C[C@H]1CC=CCC1)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492903720 529962260 /nfs/dbraw/zinc/96/22/60/529962260.db2.gz URLRLINWPBMRNK-GUOLPTJISA-N 1 2 245.326 2.238 20 0 BEADLO CC[C@@H]1CN(c2nc(C)[nH+]cc2C)CCCO1 ZINC000572617207 344296357 /nfs/dbraw/zinc/29/63/57/344296357.db2.gz VVORHDNCFVFVEC-GFCCVEGCSA-N 1 2 235.331 2.099 20 0 BEADLO CCOCCN(CC)c1cc[nH+]cc1F ZINC000641363098 362377320 /nfs/dbraw/zinc/37/73/20/362377320.db2.gz OKLLYEPZHFFRDI-UHFFFAOYSA-N 1 2 212.268 2.084 20 0 BEADLO Cn1cc[nH+]c1CS[C@H]1COC(C)(C)C1 ZINC000600574679 344288013 /nfs/dbraw/zinc/28/80/13/344288013.db2.gz WQRXFTQCGLNSFW-SECBINFHSA-N 1 2 226.345 2.221 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1ccno1 ZINC000600639084 344348848 /nfs/dbraw/zinc/34/88/48/344348848.db2.gz GZQFCMROKXFWTF-UHFFFAOYSA-N 1 2 206.245 2.290 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1ccno1 ZINC000600639084 344348851 /nfs/dbraw/zinc/34/88/51/344348851.db2.gz GZQFCMROKXFWTF-UHFFFAOYSA-N 1 2 206.245 2.290 20 0 BEADLO CCC1(C(=O)N[C@@H](C)c2[nH+]ccn2C)CCC1 ZINC000620603802 344354644 /nfs/dbraw/zinc/35/46/44/344354644.db2.gz NMSSCLPXBULPKN-JTQLQIEISA-N 1 2 235.331 2.178 20 0 BEADLO CCOC[C@H]1CCCN(c2cc[nH+]cc2F)C1 ZINC000641376207 362380706 /nfs/dbraw/zinc/38/07/06/362380706.db2.gz AYLCDSHXDIEFHU-NSHDSACASA-N 1 2 238.306 2.474 20 0 BEADLO COc1ccsc1C[N@H+](C)Cc1cnccn1 ZINC000092590989 344299538 /nfs/dbraw/zinc/29/95/38/344299538.db2.gz ZUGWZZQJOGLDTM-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1ccsc1C[N@@H+](C)Cc1cnccn1 ZINC000092590989 344299539 /nfs/dbraw/zinc/29/95/39/344299539.db2.gz ZUGWZZQJOGLDTM-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO CCCCNc1nc(N)c2ccccc2[nH+]1 ZINC000041146492 344422592 /nfs/dbraw/zinc/42/25/92/344422592.db2.gz JVDYOKIUMXQXAM-UHFFFAOYSA-N 1 2 216.288 2.424 20 0 BEADLO C[C@H](NC(=O)[C@@H](C)C1CCC1)c1[nH+]ccn1C ZINC000620612640 344368716 /nfs/dbraw/zinc/36/87/16/344368716.db2.gz ZXQLQYVOINRLDD-UWVGGRQHSA-N 1 2 235.331 2.034 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)c1cc2occc2s1 ZINC000605512149 344405365 /nfs/dbraw/zinc/40/53/65/344405365.db2.gz MCNVTIUAUPWCDC-UHFFFAOYSA-N 1 2 247.279 2.147 20 0 BEADLO CC(C)CC[C@](C)(O)CNc1cc[nH+]cc1F ZINC000641391048 362390062 /nfs/dbraw/zinc/39/00/62/362390062.db2.gz YGZONMYCOXGNEJ-ZDUSSCGKSA-N 1 2 240.322 2.242 20 0 BEADLO CC[C@@H](Nc1cc[nH+]cc1F)C1CCOCC1 ZINC000641409279 362401102 /nfs/dbraw/zinc/40/11/02/362401102.db2.gz QFIXJIAEEKVYAM-GFCCVEGCSA-N 1 2 238.306 2.260 20 0 BEADLO OCc1ccc(C[NH2+]Cc2ccc(Cl)o2)o1 ZINC000381508398 344514918 /nfs/dbraw/zinc/51/49/18/344514918.db2.gz UNNAODOVEBNWKU-UHFFFAOYSA-N 1 2 241.674 2.308 20 0 BEADLO C[C@H](O)C1CC[NH+](C/C(Cl)=C\Cl)CC1 ZINC000381637537 344529167 /nfs/dbraw/zinc/52/91/67/344529167.db2.gz FWLKHAHFNIUSOX-QMEHYBMDSA-N 1 2 238.158 2.398 20 0 BEADLO CC(C)C[C@H](CCO)CNc1cc[nH+]cc1F ZINC000641407668 362400360 /nfs/dbraw/zinc/40/03/60/362400360.db2.gz ABRYNTXHGUEUMP-NSHDSACASA-N 1 2 240.322 2.099 20 0 BEADLO OCc1cc[nH+]c(N[C@H]2CCC(F)(F)C2)c1 ZINC000641439673 362420426 /nfs/dbraw/zinc/42/04/26/362420426.db2.gz KUOQOXCQNDEUMB-VIFPVBQESA-N 1 2 228.242 2.174 20 0 BEADLO C[C@@]1(CNc2cc[nH+]c(C3CC3)n2)CCCO1 ZINC000152517590 344590738 /nfs/dbraw/zinc/59/07/38/344590738.db2.gz BVVCMYTUNJBCEO-ZDUSSCGKSA-N 1 2 233.315 2.335 20 0 BEADLO C[C@]1(CNc2cc[nH+]c(C3CC3)n2)CCCO1 ZINC000152517501 344590970 /nfs/dbraw/zinc/59/09/70/344590970.db2.gz BVVCMYTUNJBCEO-CYBMUJFWSA-N 1 2 233.315 2.335 20 0 BEADLO COCCN(CC(C)C)c1cc[nH+]cc1F ZINC000641451301 362425426 /nfs/dbraw/zinc/42/54/26/362425426.db2.gz OXYMSZRJVXVLTP-UHFFFAOYSA-N 1 2 226.295 2.330 20 0 BEADLO Cc1noc(C)c1[C@@H](C)CNc1cc[nH+]cc1F ZINC000641457525 362427691 /nfs/dbraw/zinc/42/76/91/362427691.db2.gz XWYCEHSIQNBUSI-QMMMGPOBSA-N 1 2 249.289 2.463 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N(C)[C@H]1CC[C@@H](C)C1 ZINC000577744113 344595369 /nfs/dbraw/zinc/59/53/69/344595369.db2.gz DRPRIJRSDJOZCV-WZRBSPASSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N(C)[C@H]1CC[C@@H](C)C1 ZINC000577744113 344595372 /nfs/dbraw/zinc/59/53/72/344595372.db2.gz DRPRIJRSDJOZCV-WZRBSPASSA-N 1 2 249.358 2.235 20 0 BEADLO COC1CCC(CNc2cc[nH+]cc2F)CC1 ZINC000641419599 362408211 /nfs/dbraw/zinc/40/82/11/362408211.db2.gz NTIZMAAZDYFBCF-UHFFFAOYSA-N 1 2 238.306 2.260 20 0 BEADLO Fc1c[nH+]ccc1N1CCO[C@H](c2ccco2)C1 ZINC000641427169 362411847 /nfs/dbraw/zinc/41/18/47/362411847.db2.gz ZCBALOFDMLHKRW-ZDUSSCGKSA-N 1 2 248.257 2.392 20 0 BEADLO CN(CCC1CCOCC1)c1cc[nH+]cc1F ZINC000641432632 362416080 /nfs/dbraw/zinc/41/60/80/362416080.db2.gz HMYPAYKVVXBQIW-UHFFFAOYSA-N 1 2 238.306 2.474 20 0 BEADLO CC(C)CO[C@H]1CCN(c2cc[nH+]cc2F)C1 ZINC000641435940 362416685 /nfs/dbraw/zinc/41/66/85/362416685.db2.gz YKNSOBMFFQXGKU-NSHDSACASA-N 1 2 238.306 2.472 20 0 BEADLO CCOC[C@@H](Nc1cc[nH+]cc1F)C(C)C ZINC000641545330 362492118 /nfs/dbraw/zinc/49/21/18/362492118.db2.gz JZMGHNGRDFIJKT-GFCCVEGCSA-N 1 2 226.295 2.116 20 0 BEADLO Fc1c[nH+]ccc1NCC[C@H]1CCCCO1 ZINC000641485039 362453634 /nfs/dbraw/zinc/45/36/34/362453634.db2.gz HNGPLLKBNXTEMZ-SNVBAGLBSA-N 1 2 224.279 2.014 20 0 BEADLO Cc1nc(SCc2cn(C)c[nH+]2)[nH]c1C ZINC000641485701 362456220 /nfs/dbraw/zinc/45/62/20/362456220.db2.gz KGVSENQIRLBRGN-UHFFFAOYSA-N 1 2 222.317 2.052 20 0 BEADLO Fc1c[nH+]ccc1NCCC[C@@H]1CCCCO1 ZINC000641489824 362457174 /nfs/dbraw/zinc/45/71/74/362457174.db2.gz TUSLSFMXLMCGCJ-NSHDSACASA-N 1 2 238.306 2.404 20 0 BEADLO CC(C)C[C@@H](CO)N(C)c1cc[nH+]cc1F ZINC000641496710 362461510 /nfs/dbraw/zinc/46/15/10/362461510.db2.gz KSWSUUFLDIEGNI-JTQLQIEISA-N 1 2 226.295 2.064 20 0 BEADLO CC(C)[C@H]1CCCN(c2cc(CO)cc[nH+]2)C1 ZINC000641521526 362479127 /nfs/dbraw/zinc/47/91/27/362479127.db2.gz NUJVDJLJTTZJHW-ZDUSSCGKSA-N 1 2 234.343 2.446 20 0 BEADLO OC[C@@H]1CCCN(c2[nH+]ccc3ccccc32)C1 ZINC000168745839 344680700 /nfs/dbraw/zinc/68/07/00/344680700.db2.gz CTTVCBMKFFNHSD-GFCCVEGCSA-N 1 2 242.322 2.444 20 0 BEADLO COC(=O)[C@H](c1cccc(OC)c1)[NH+]1CCCC1 ZINC000259503908 344656401 /nfs/dbraw/zinc/65/64/01/344656401.db2.gz ZXYMPXCPQKXVDB-ZDUSSCGKSA-N 1 2 249.310 2.005 20 0 BEADLO C[C@@H](c1ccncc1)[N@@H+]1CCO[C@H](CCF)C1 ZINC000626002013 344662255 /nfs/dbraw/zinc/66/22/55/344662255.db2.gz DMSOVQXQSGNTCK-WCQYABFASA-N 1 2 238.306 2.203 20 0 BEADLO C[C@@H](c1ccncc1)[N@H+]1CCO[C@H](CCF)C1 ZINC000626002013 344662256 /nfs/dbraw/zinc/66/22/56/344662256.db2.gz DMSOVQXQSGNTCK-WCQYABFASA-N 1 2 238.306 2.203 20 0 BEADLO Cc1ncc(C[N@@H+]2CCO[C@H](CCF)C2)s1 ZINC000626002486 344662816 /nfs/dbraw/zinc/66/28/16/344662816.db2.gz OJSJXDJFKDUGEJ-SNVBAGLBSA-N 1 2 244.335 2.012 20 0 BEADLO Cc1ncc(C[N@H+]2CCO[C@H](CCF)C2)s1 ZINC000626002486 344662817 /nfs/dbraw/zinc/66/28/17/344662817.db2.gz OJSJXDJFKDUGEJ-SNVBAGLBSA-N 1 2 244.335 2.012 20 0 BEADLO FCC[C@H]1C[N@H+](Cc2ccsc2)CCO1 ZINC000626005634 344668131 /nfs/dbraw/zinc/66/81/31/344668131.db2.gz GZOYUHIQJTYNSC-NSHDSACASA-N 1 2 229.320 2.309 20 0 BEADLO FCC[C@H]1C[N@@H+](Cc2ccsc2)CCO1 ZINC000626005634 344668133 /nfs/dbraw/zinc/66/81/33/344668133.db2.gz GZOYUHIQJTYNSC-NSHDSACASA-N 1 2 229.320 2.309 20 0 BEADLO FCC[C@@H]1C[N@H+](Cc2ccsc2)CCO1 ZINC000626005633 344668226 /nfs/dbraw/zinc/66/82/26/344668226.db2.gz GZOYUHIQJTYNSC-LLVKDONJSA-N 1 2 229.320 2.309 20 0 BEADLO FCC[C@@H]1C[N@@H+](Cc2ccsc2)CCO1 ZINC000626005633 344668229 /nfs/dbraw/zinc/66/82/29/344668229.db2.gz GZOYUHIQJTYNSC-LLVKDONJSA-N 1 2 229.320 2.309 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3c(O)cccc3C2)no1 ZINC000626026146 344678926 /nfs/dbraw/zinc/67/89/26/344678926.db2.gz XTEMTUAGYPZTEU-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO Cc1cc(C[N@H+]2CCc3c(O)cccc3C2)no1 ZINC000626026146 344678927 /nfs/dbraw/zinc/67/89/27/344678927.db2.gz XTEMTUAGYPZTEU-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO Cc1cnc(C[N@@H+]2CCc3c(O)cccc3C2)o1 ZINC000626026968 344679626 /nfs/dbraw/zinc/67/96/26/344679626.db2.gz GYYFTYSEJOHBJR-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO Cc1cnc(C[N@H+]2CCc3c(O)cccc3C2)o1 ZINC000626026968 344679628 /nfs/dbraw/zinc/67/96/28/344679628.db2.gz GYYFTYSEJOHBJR-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO CC(C)(NC(=O)C[C@@H]1C=CCC1)c1[nH]cc[nH+]1 ZINC000574284391 344732326 /nfs/dbraw/zinc/73/23/26/344732326.db2.gz ACUCFPGTXLFIGQ-SNVBAGLBSA-N 1 2 233.315 2.117 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1ccc(Cl)cc1 ZINC000049956416 344704010 /nfs/dbraw/zinc/70/40/10/344704010.db2.gz NKNOKVFLSWLYEM-SECBINFHSA-N 1 2 241.718 2.333 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000049956416 344704011 /nfs/dbraw/zinc/70/40/11/344704011.db2.gz NKNOKVFLSWLYEM-SECBINFHSA-N 1 2 241.718 2.333 20 0 BEADLO O=C(c1ccoc1)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000075553603 344779142 /nfs/dbraw/zinc/77/91/42/344779142.db2.gz YUJJCSBJYAGXCW-JTQLQIEISA-N 1 2 245.282 2.023 20 0 BEADLO Cc1noc(C[NH2+]C2(c3ccccc3)CC2)n1 ZINC000077378794 344817924 /nfs/dbraw/zinc/81/79/24/344817924.db2.gz DDSBZYSHTIGMKO-UHFFFAOYSA-N 1 2 229.283 2.157 20 0 BEADLO Cc1ccccc1[C@H](O)CNc1cc[nH+]c(C)n1 ZINC000078251946 344837723 /nfs/dbraw/zinc/83/77/23/344837723.db2.gz IBUUQIBKIIQCPI-CYBMUJFWSA-N 1 2 243.310 2.239 20 0 BEADLO CC[N@@H+](Cc1nc(C)c(C)[nH]1)C[C@@H]1CCCO1 ZINC000628152638 344841155 /nfs/dbraw/zinc/84/11/55/344841155.db2.gz JERRILKFOOFVHJ-LBPRGKRZSA-N 1 2 237.347 2.027 20 0 BEADLO CC[N@H+](Cc1nc(C)c(C)[nH]1)C[C@@H]1CCCO1 ZINC000628152638 344841156 /nfs/dbraw/zinc/84/11/56/344841156.db2.gz JERRILKFOOFVHJ-LBPRGKRZSA-N 1 2 237.347 2.027 20 0 BEADLO CCN(Cc1[nH]c(C)c(C)[nH+]1)C[C@@H]1CCCO1 ZINC000628152638 344841157 /nfs/dbraw/zinc/84/11/57/344841157.db2.gz JERRILKFOOFVHJ-LBPRGKRZSA-N 1 2 237.347 2.027 20 0 BEADLO CCN(C(=O)Cn1cc[nH+]c1)c1ccc(F)cc1 ZINC000078288546 344841188 /nfs/dbraw/zinc/84/11/88/344841188.db2.gz DLFOXQVGTTVPAK-UHFFFAOYSA-N 1 2 247.273 2.075 20 0 BEADLO CCc1ccccc1CNC(=O)c1c[nH+]c(C)[nH]1 ZINC000077617107 344823596 /nfs/dbraw/zinc/82/35/96/344823596.db2.gz MVKQEBWOXFTONN-UHFFFAOYSA-N 1 2 243.310 2.211 20 0 BEADLO Cc1nc(NC[C@](C)(O)c2ccsc2)cc[nH+]1 ZINC000078301523 344842680 /nfs/dbraw/zinc/84/26/80/344842680.db2.gz ODVCIEXQQULONG-LBPRGKRZSA-N 1 2 249.339 2.166 20 0 BEADLO CO[C@H]1CCCC[C@H]1Nc1cc[nH+]c(C)n1 ZINC000078426984 344867483 /nfs/dbraw/zinc/86/74/83/344867483.db2.gz UGFOXJUMQPRABG-MNOVXSKESA-N 1 2 221.304 2.155 20 0 BEADLO C[C@H]1CN(c2cccc[nH+]2)C[C@H](C)S1 ZINC000078495628 344876440 /nfs/dbraw/zinc/87/64/40/344876440.db2.gz APAUQFWIEKRTMM-UWVGGRQHSA-N 1 2 208.330 2.412 20 0 BEADLO COCc1ccc(C[NH2+]Cc2ncc(C)o2)cc1 ZINC000234748690 537872786 /nfs/dbraw/zinc/87/27/86/537872786.db2.gz VATUEWRCSXEOCE-UHFFFAOYSA-N 1 2 246.310 2.419 20 0 BEADLO Cc1ncc(C[N@@H+]2CCOC3(CCCC3)C2)o1 ZINC000628182330 344926081 /nfs/dbraw/zinc/92/60/81/344926081.db2.gz OXWILWUZIBTAJH-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO Cc1ncc(C[N@H+]2CCOC3(CCCC3)C2)o1 ZINC000628182330 344926083 /nfs/dbraw/zinc/92/60/83/344926083.db2.gz OXWILWUZIBTAJH-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO c1nc(C2CC2)oc1C[N@@H+]1CCOC2(CCC2)C1 ZINC000628183564 344932312 /nfs/dbraw/zinc/93/23/12/344932312.db2.gz GPJKVKPKDVUJHY-UHFFFAOYSA-N 1 2 248.326 2.307 20 0 BEADLO c1nc(C2CC2)oc1C[N@H+]1CCOC2(CCC2)C1 ZINC000628183564 344932316 /nfs/dbraw/zinc/93/23/16/344932316.db2.gz GPJKVKPKDVUJHY-UHFFFAOYSA-N 1 2 248.326 2.307 20 0 BEADLO CSC[C@@H](C)NC(=O)Nc1cc[nH+]cc1C ZINC000121252558 187295662 /nfs/dbraw/zinc/29/56/62/187295662.db2.gz RTARLNWAULAZAJ-SECBINFHSA-N 1 2 239.344 2.263 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCS[C@H](C)[C@H]2C)n1 ZINC000628178781 344913429 /nfs/dbraw/zinc/91/34/29/344913429.db2.gz BTSFMUKTRMHCSS-NXEZZACHSA-N 1 2 225.361 2.044 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCS[C@H](C)[C@H]2C)n1 ZINC000628178781 344913430 /nfs/dbraw/zinc/91/34/30/344913430.db2.gz BTSFMUKTRMHCSS-NXEZZACHSA-N 1 2 225.361 2.044 20 0 BEADLO Cc1nc(C)c(CNc2ccc(N(C)C)[nH+]c2)o1 ZINC000628198953 344965423 /nfs/dbraw/zinc/96/54/23/344965423.db2.gz SXSXZRGIHFVNGE-UHFFFAOYSA-N 1 2 246.314 2.365 20 0 BEADLO Cc1ccc(CCNc2nccnc2C)c[nH+]1 ZINC000574732667 344980569 /nfs/dbraw/zinc/98/05/69/344980569.db2.gz LZQIYXLWKTZLFL-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]2C(F)F)n1 ZINC000336559131 178794287 /nfs/dbraw/zinc/79/42/87/178794287.db2.gz WDVUFTRZDRTZBB-SNVBAGLBSA-N 1 2 242.269 2.325 20 0 BEADLO Cc1ccc(O)c(C[N@H+]2CCC[C@@H]2C(F)F)n1 ZINC000336559131 178794289 /nfs/dbraw/zinc/79/42/89/178794289.db2.gz WDVUFTRZDRTZBB-SNVBAGLBSA-N 1 2 242.269 2.325 20 0 BEADLO CN(Cc1nc2ccccc2o1)Cc1[nH]cc[nH+]1 ZINC000153999641 345005892 /nfs/dbraw/zinc/00/58/92/345005892.db2.gz ZVCGHJAKNFGJGT-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO Cn1c[nH+]c(CSCC(=O)C(C)(C)C)c1 ZINC000603322127 349922254 /nfs/dbraw/zinc/92/22/54/349922254.db2.gz UJHWWQBFWJVTPF-UHFFFAOYSA-N 1 2 226.345 2.269 20 0 BEADLO Nc1[nH+]cccc1CS[C@H]1CCCOC1 ZINC000603322605 349922528 /nfs/dbraw/zinc/92/25/28/349922528.db2.gz JXTJHMHICXHESY-JTQLQIEISA-N 1 2 224.329 2.076 20 0 BEADLO C[C@@H](CNc1nc[nH+]c(N)c1Cl)C1CC1 ZINC000235152214 537884347 /nfs/dbraw/zinc/88/43/47/537884347.db2.gz NMXIKXZDMYWSEV-LURJTMIESA-N 1 2 226.711 2.170 20 0 BEADLO C[C@@H](CNc1[nH+]cnc(N)c1Cl)C1CC1 ZINC000235152214 537884355 /nfs/dbraw/zinc/88/43/55/537884355.db2.gz NMXIKXZDMYWSEV-LURJTMIESA-N 1 2 226.711 2.170 20 0 BEADLO CCC[C@H]1C[C@H]1C(=O)Nc1c[nH+]ccc1OC ZINC000079843610 345043271 /nfs/dbraw/zinc/04/32/71/345043271.db2.gz BIJVROJZRKWQPW-VHSXEESVSA-N 1 2 234.299 2.465 20 0 BEADLO CCc1nocc1CN(C)c1cc[nH+]cc1F ZINC000641615522 362548330 /nfs/dbraw/zinc/54/83/30/362548330.db2.gz KEUAWBJQHKROKR-UHFFFAOYSA-N 1 2 235.262 2.408 20 0 BEADLO COC[C@]1(C)CCN(c2cc[nH+]cc2F)C1 ZINC000641615556 362548581 /nfs/dbraw/zinc/54/85/81/362548581.db2.gz MXLJIPPEPVLTGT-GFCCVEGCSA-N 1 2 224.279 2.084 20 0 BEADLO CC[C@@H]1CCCCN1C(=O)CCCn1cc[nH+]c1 ZINC000125286063 345074102 /nfs/dbraw/zinc/07/41/02/345074102.db2.gz MNECOGSDIRKBIZ-CYBMUJFWSA-N 1 2 249.358 2.454 20 0 BEADLO Fc1c[nH+]ccc1NC[C@@H]1CCCC1(F)F ZINC000641618523 362551834 /nfs/dbraw/zinc/55/18/34/362551834.db2.gz GNJCEEUNIPUXBE-QMMMGPOBSA-N 1 2 230.233 2.490 20 0 BEADLO CCO[C@H]1CCN(c2cc[nH+]cc2F)C[C@H]1C ZINC000641618607 362551900 /nfs/dbraw/zinc/55/19/00/362551900.db2.gz INRNZQUWZMWXDZ-MFKMUULPSA-N 1 2 238.306 2.472 20 0 BEADLO CCO[C@H]1CCN(c2cc[nH+]cc2F)C[C@@H]1C ZINC000641618605 362551948 /nfs/dbraw/zinc/55/19/48/362551948.db2.gz INRNZQUWZMWXDZ-GWCFXTLKSA-N 1 2 238.306 2.472 20 0 BEADLO Cc1cncnc1N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000641622374 362554380 /nfs/dbraw/zinc/55/43/80/362554380.db2.gz SYRZQIYKWWOLRJ-VHSXEESVSA-N 1 2 229.287 2.099 20 0 BEADLO CCOCC(C)(C)CNc1cc[nH+]cc1F ZINC000641599449 362539992 /nfs/dbraw/zinc/53/99/92/362539992.db2.gz ARIPTZAXVQNNNU-UHFFFAOYSA-N 1 2 226.295 2.117 20 0 BEADLO CCOCC(C)(C)CNc1cc(CO)cc[nH+]1 ZINC000641599835 362540425 /nfs/dbraw/zinc/54/04/25/362540425.db2.gz FENSEMDAJCUEPD-UHFFFAOYSA-N 1 2 238.331 2.049 20 0 BEADLO CCc1nc(C)c(CNc2cc(CO)cc[nH+]2)o1 ZINC000641608806 362543385 /nfs/dbraw/zinc/54/33/85/362543385.db2.gz KUDGAZKUGNOMAR-UHFFFAOYSA-N 1 2 247.298 2.045 20 0 BEADLO Cc1ccoc1CNc1cc(CO)cc[nH+]1 ZINC000641607287 362544175 /nfs/dbraw/zinc/54/41/75/362544175.db2.gz QPMKJTQRADGPEN-UHFFFAOYSA-N 1 2 218.256 2.087 20 0 BEADLO C[C@H](CNc1cc[nH+]cc1F)CC(F)F ZINC000641646499 362572380 /nfs/dbraw/zinc/57/23/80/362572380.db2.gz TWZBMJGZSJHFHN-ZETCQYMHSA-N 1 2 218.222 2.346 20 0 BEADLO CC[C@H](Nc1cc[nH+]cc1F)[C@H]1CCCCO1 ZINC000641655098 362578977 /nfs/dbraw/zinc/57/89/77/362578977.db2.gz CLPMGQCSCWRRLV-WCQYABFASA-N 1 2 238.306 2.402 20 0 BEADLO CC[C@@H](COCC1CC1)Nc1cc[nH+]cc1F ZINC000641656310 362579649 /nfs/dbraw/zinc/57/96/49/362579649.db2.gz FNCIFQMQGOSWJB-NSHDSACASA-N 1 2 238.306 2.260 20 0 BEADLO CCCc1ncc(CNc2cc[nH+]cc2F)o1 ZINC000641628637 362558859 /nfs/dbraw/zinc/55/88/59/362558859.db2.gz FEGWVRHVNAXIDT-UHFFFAOYSA-N 1 2 235.262 2.195 20 0 BEADLO OCc1cc[nH+]c(N[C@H]2CCC[C@@H]3C[C@@H]32)c1 ZINC000641629645 362560121 /nfs/dbraw/zinc/56/01/21/362560121.db2.gz KKESAZPKTRBWHQ-WOPDTQHZSA-N 1 2 218.300 2.174 20 0 BEADLO OCc1cc[nH+]c(N[C@@H]2CCC[C@@H]3C[C@@H]32)c1 ZINC000641629644 362560739 /nfs/dbraw/zinc/56/07/39/362560739.db2.gz KKESAZPKTRBWHQ-GRYCIOLGSA-N 1 2 218.300 2.174 20 0 BEADLO CO[C@H]1C[C@@H](Nc2cc[nH+]cc2F)C12CCC2 ZINC000641630327 362560908 /nfs/dbraw/zinc/56/09/08/362560908.db2.gz UCPVLIVAYIZJFV-NEPJUHHUSA-N 1 2 236.290 2.012 20 0 BEADLO CC(C)O[C@H]1C[C@@H](Nc2cc[nH+]cc2F)C1 ZINC000641627534 362561773 /nfs/dbraw/zinc/56/17/73/362561773.db2.gz PRMNTHZXKVFLOM-AOOOYVTPSA-N 1 2 224.279 2.011 20 0 BEADLO CC[C@H]1C[C@H](Nc2cc[nH+]cc2F)CCO1 ZINC000641638608 362565799 /nfs/dbraw/zinc/56/57/99/362565799.db2.gz CXTRKCDACWKALR-ZJUUUORDSA-N 1 2 224.279 2.012 20 0 BEADLO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1ccon1 ZINC000634981068 345164589 /nfs/dbraw/zinc/16/45/89/345164589.db2.gz WJRYQAPBJMFKQX-NOZJJQNGSA-N 1 2 230.267 2.286 20 0 BEADLO C[C@H](CF)[NH2+]Cc1nc2cc(F)ccc2o1 ZINC000634981047 345164612 /nfs/dbraw/zinc/16/46/12/345164612.db2.gz VRIMCSQHFDCNDU-SSDOTTSWSA-N 1 2 226.226 2.415 20 0 BEADLO CC[C@@H](CSC)Nc1cc[nH+]cc1F ZINC000603328070 349924030 /nfs/dbraw/zinc/92/40/30/349924030.db2.gz FFNFXQAODDAKGH-QMMMGPOBSA-N 1 2 214.309 2.196 20 0 BEADLO Fc1cccc2c1OCC[C@H]2[NH2+]Cc1ccon1 ZINC000634977810 345154633 /nfs/dbraw/zinc/15/46/33/345154633.db2.gz LENHSMJBMJQOEC-GFCCVEGCSA-N 1 2 248.257 2.427 20 0 BEADLO CC[C@@H](C)NC(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC000635056991 345231040 /nfs/dbraw/zinc/23/10/40/345231040.db2.gz OCVXZPOORVRARA-NEPJUHHUSA-N 1 2 237.347 2.385 20 0 BEADLO CC(C)C[C@@H](C(=O)N1CCCC1)n1cc[nH+]c1 ZINC000635058092 345232199 /nfs/dbraw/zinc/23/21/99/345232199.db2.gz ABKPZMCFRNWPNQ-LBPRGKRZSA-N 1 2 235.331 2.093 20 0 BEADLO O=C(NCCCn1cc[nH+]c1)C1CCC=CCC1 ZINC000635067583 345236617 /nfs/dbraw/zinc/23/66/17/345236617.db2.gz XOVOTZPUEMDAFS-UHFFFAOYSA-N 1 2 247.342 2.136 20 0 BEADLO CCCN(CCC)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635065493 345237018 /nfs/dbraw/zinc/23/70/18/345237018.db2.gz KRBQYQLGWZUIHT-GHMZBOCLSA-N 1 2 235.331 2.162 20 0 BEADLO CCCN(CCC)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635065493 345237020 /nfs/dbraw/zinc/23/70/20/345237020.db2.gz KRBQYQLGWZUIHT-GHMZBOCLSA-N 1 2 235.331 2.162 20 0 BEADLO CCCCNC(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC000635065272 345237633 /nfs/dbraw/zinc/23/76/33/345237633.db2.gz LGVZWWNXEUFBEH-GFCCVEGCSA-N 1 2 237.347 2.387 20 0 BEADLO C[C@@H]1C[C@H](C)CN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635066572 345238874 /nfs/dbraw/zinc/23/88/74/345238874.db2.gz ZQOZRMFFNAZIEL-WRWGMCAJSA-N 1 2 247.342 2.018 20 0 BEADLO C[C@@H]1C[C@H](C)CN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635066572 345238877 /nfs/dbraw/zinc/23/88/77/345238877.db2.gz ZQOZRMFFNAZIEL-WRWGMCAJSA-N 1 2 247.342 2.018 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)C1CCC=CCC1 ZINC000635127288 345254424 /nfs/dbraw/zinc/25/44/24/345254424.db2.gz NVPBZSPHPZOHQL-UHFFFAOYSA-N 1 2 247.342 2.125 20 0 BEADLO Cc1ccc([C@@H](C)NCc2[nH+]cc(C)n2C)o1 ZINC000341110786 178844635 /nfs/dbraw/zinc/84/46/35/178844635.db2.gz OSKPGGYQGZDRTO-LLVKDONJSA-N 1 2 233.315 2.481 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2ncc(C)n2C)o1 ZINC000341110786 178844639 /nfs/dbraw/zinc/84/46/39/178844639.db2.gz OSKPGGYQGZDRTO-LLVKDONJSA-N 1 2 233.315 2.481 20 0 BEADLO CCN(C(=O)[C@@H](CC(C)C)n1cc[nH+]c1)C1CC1 ZINC000635216772 345274580 /nfs/dbraw/zinc/27/45/80/345274580.db2.gz VIJJIHVTGICUKA-CYBMUJFWSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@@H](N(C)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C(C)(C)C ZINC000635224636 345278103 /nfs/dbraw/zinc/27/81/03/345278103.db2.gz RCWBSGIUHWTCLS-GMTAPVOTSA-N 1 2 249.358 2.406 20 0 BEADLO C[C@@H](N(C)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C(C)(C)C ZINC000635224636 345278104 /nfs/dbraw/zinc/27/81/04/345278104.db2.gz RCWBSGIUHWTCLS-GMTAPVOTSA-N 1 2 249.358 2.406 20 0 BEADLO Cc1cn2ccc(C(=O)N(C)C(C)C)cc2[nH+]1 ZINC000635226106 345278311 /nfs/dbraw/zinc/27/83/11/345278311.db2.gz QJSKNRCMEAGKDY-UHFFFAOYSA-N 1 2 231.299 2.123 20 0 BEADLO CCC[C@H](CC)NC(=O)Cc1[nH]cc(CC)[nH+]1 ZINC000635444347 345374360 /nfs/dbraw/zinc/37/43/60/345374360.db2.gz PTTBPQAQCPKVJZ-JTQLQIEISA-N 1 2 237.347 2.210 20 0 BEADLO CCCN(C)C(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC000635447938 345374993 /nfs/dbraw/zinc/37/49/93/345374993.db2.gz ABWVDCQWEMDFTA-LBPRGKRZSA-N 1 2 237.347 2.339 20 0 BEADLO CC(C)CN(C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C(C)C ZINC000635461807 345382073 /nfs/dbraw/zinc/38/20/73/345382073.db2.gz KHABWHZUACLWHH-VXGBXAGGSA-N 1 2 249.358 2.406 20 0 BEADLO CC(C)CN(C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C(C)C ZINC000635461807 345382076 /nfs/dbraw/zinc/38/20/76/345382076.db2.gz KHABWHZUACLWHH-VXGBXAGGSA-N 1 2 249.358 2.406 20 0 BEADLO CCc1c[nH]c(CC(=O)NCC(CC)CC)[nH+]1 ZINC000635504065 345403781 /nfs/dbraw/zinc/40/37/81/345403781.db2.gz RVACGKRFGIWXSM-UHFFFAOYSA-N 1 2 237.347 2.067 20 0 BEADLO C[C@H]1CCC[C@H](C)N1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635512416 345409268 /nfs/dbraw/zinc/40/92/68/345409268.db2.gz RIORMTVGAUMNGP-NNYUYHANSA-N 1 2 247.342 2.303 20 0 BEADLO C[C@H]1CCC[C@H](C)N1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635512416 345409270 /nfs/dbraw/zinc/40/92/70/345409270.db2.gz RIORMTVGAUMNGP-NNYUYHANSA-N 1 2 247.342 2.303 20 0 BEADLO C[N@H+](Cc1ccno1)Cc1ccc(Cl)nc1 ZINC000080911908 345450690 /nfs/dbraw/zinc/45/06/90/345450690.db2.gz HKHAYCXSEIVCOP-UHFFFAOYSA-N 1 2 237.690 2.355 20 0 BEADLO C[N@@H+](Cc1ccno1)Cc1ccc(Cl)nc1 ZINC000080911908 345450692 /nfs/dbraw/zinc/45/06/92/345450692.db2.gz HKHAYCXSEIVCOP-UHFFFAOYSA-N 1 2 237.690 2.355 20 0 BEADLO CCC(CC)C(=O)NCCNc1cccc[nH+]1 ZINC000081946061 345495487 /nfs/dbraw/zinc/49/54/87/345495487.db2.gz CYMCUBZPSNGWRA-UHFFFAOYSA-N 1 2 235.331 2.046 20 0 BEADLO CN(CC1=CCSC1)c1cc[nH+]cc1F ZINC000641672373 362596661 /nfs/dbraw/zinc/59/66/61/362596661.db2.gz KFXKEUJXQRBBBM-UHFFFAOYSA-N 1 2 224.304 2.330 20 0 BEADLO CCC1C[NH+](Cc2nn(C)c(C)c2Cl)C1 ZINC000334983963 168530623 /nfs/dbraw/zinc/53/06/23/168530623.db2.gz FKBWSMWXFWQWJT-UHFFFAOYSA-N 1 2 227.739 2.224 20 0 BEADLO O=C(N1CCCC[C@@H]1c1[nH]cc[nH+]1)C(F)(F)F ZINC000082277987 345501150 /nfs/dbraw/zinc/50/11/50/345501150.db2.gz DTCTZHOGACVLDV-SSDOTTSWSA-N 1 2 247.220 2.026 20 0 BEADLO CC(C)CC(=O)N[C@H](c1[nH+]ccn1C)C1CC1 ZINC000082277304 345501354 /nfs/dbraw/zinc/50/13/54/345501354.db2.gz ZEMXASGNMZTLER-LBPRGKRZSA-N 1 2 235.331 2.034 20 0 BEADLO Fc1c[nH+]ccc1NCC[C@@H]1CC1(F)F ZINC000641674341 362591295 /nfs/dbraw/zinc/59/12/95/362591295.db2.gz UBAVMFVHBRDVFD-SSDOTTSWSA-N 1 2 216.206 2.100 20 0 BEADLO CC1(C)CN(c2cccc[nH+]2)CCS1 ZINC000081032436 345462793 /nfs/dbraw/zinc/46/27/93/345462793.db2.gz GYOGJERJVQRLSG-UHFFFAOYSA-N 1 2 208.330 2.413 20 0 BEADLO COCc1nc(C[N@@H+]2CCC23CCC3)cs1 ZINC000081515644 345482436 /nfs/dbraw/zinc/48/24/36/345482436.db2.gz PRFPBDYOLVWIGI-UHFFFAOYSA-N 1 2 238.356 2.418 20 0 BEADLO COCc1nc(C[N@H+]2CCC23CCC3)cs1 ZINC000081515644 345482439 /nfs/dbraw/zinc/48/24/39/345482439.db2.gz PRFPBDYOLVWIGI-UHFFFAOYSA-N 1 2 238.356 2.418 20 0 BEADLO CC[C@@H](C)[C@@H](O)CNc1cc[nH+]c2ccncc12 ZINC000085686788 345529228 /nfs/dbraw/zinc/52/92/28/345529228.db2.gz GTKXLNHWGGEJHP-YGRLFVJLSA-N 1 2 245.326 2.449 20 0 BEADLO Cc1ccc2c(c1)CCN2Cc1[nH+]ccn1C ZINC000091086667 345577800 /nfs/dbraw/zinc/57/78/00/345577800.db2.gz LDYATBTXORFYLL-UHFFFAOYSA-N 1 2 227.311 2.291 20 0 BEADLO CCc1cc(NCCc2cscn2)nc[nH+]1 ZINC000082626475 345544803 /nfs/dbraw/zinc/54/48/03/345544803.db2.gz KUMVGGNVIPQDEO-UHFFFAOYSA-N 1 2 234.328 2.150 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@H](C)OC[C@@H]2C)s1 ZINC000092017105 345614561 /nfs/dbraw/zinc/61/45/61/345614561.db2.gz KRGNJZNZHBRNAR-UWVGGRQHSA-N 1 2 240.372 2.315 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@H](C)OC[C@@H]2C)s1 ZINC000092017105 345614565 /nfs/dbraw/zinc/61/45/65/345614565.db2.gz KRGNJZNZHBRNAR-UWVGGRQHSA-N 1 2 240.372 2.315 20 0 BEADLO CSC1(CNc2cc(CO)cc[nH+]2)CCC1 ZINC000603366520 349933595 /nfs/dbraw/zinc/93/35/95/349933595.db2.gz PBEAMNFFWYSUPD-UHFFFAOYSA-N 1 2 238.356 2.272 20 0 BEADLO CC(C)(C)OC(=O)CCCn1cc[nH+]c1 ZINC000182104374 187309049 /nfs/dbraw/zinc/30/90/49/187309049.db2.gz YHHVJWIRNCHELZ-UHFFFAOYSA-N 1 2 210.277 2.005 20 0 BEADLO CCC[C@H](C[NH2+][C@@H](C)C(=O)OC(C)(C)C)OC ZINC000378829356 345640188 /nfs/dbraw/zinc/64/01/88/345640188.db2.gz QZSMCXIDLPMIAY-WDEREUQCSA-N 1 2 245.363 2.121 20 0 BEADLO OCc1cc[nH+]c(N2CCCC(F)(F)CC2)c1 ZINC000641677886 362599930 /nfs/dbraw/zinc/59/99/30/362599930.db2.gz NXENWQRHGCNXRF-UHFFFAOYSA-N 1 2 242.269 2.200 20 0 BEADLO Cc1cc(N[C@H](C)C(F)F)nc(C2CC2)[nH+]1 ZINC000641729440 362643163 /nfs/dbraw/zinc/64/31/63/362643163.db2.gz BIRWMNLDWAXBOH-SSDOTTSWSA-N 1 2 227.258 2.150 20 0 BEADLO CC(=O)c1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000115033874 345676489 /nfs/dbraw/zinc/67/64/89/345676489.db2.gz BPFAFWGYMQMABZ-TXEJJXNPSA-N 1 2 247.338 2.498 20 0 BEADLO CC(=O)c1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000115033874 345676491 /nfs/dbraw/zinc/67/64/91/345676491.db2.gz BPFAFWGYMQMABZ-TXEJJXNPSA-N 1 2 247.338 2.498 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccc3c(n2)CCC3)on1 ZINC000641717581 362639722 /nfs/dbraw/zinc/63/97/22/362639722.db2.gz MCIZKZJYSVCWOL-UHFFFAOYSA-N 1 2 243.310 2.157 20 0 BEADLO CC(=O)c1ccc(C[N@@H+]2CC[C@H](F)C2)cc1 ZINC000148151081 345719534 /nfs/dbraw/zinc/71/95/34/345719534.db2.gz QSUQTSLFHYNSNB-ZDUSSCGKSA-N 1 2 221.275 2.433 20 0 BEADLO CC(=O)c1ccc(C[N@H+]2CC[C@H](F)C2)cc1 ZINC000148151081 345719537 /nfs/dbraw/zinc/71/95/37/345719537.db2.gz QSUQTSLFHYNSNB-ZDUSSCGKSA-N 1 2 221.275 2.433 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1ccccc1 ZINC000205188336 345732849 /nfs/dbraw/zinc/73/28/49/345732849.db2.gz VORWZCKXLXEOFO-UHFFFAOYSA-N 1 2 228.251 2.343 20 0 BEADLO CC[C@@H](Nc1nc(C)cc(C)n1)c1[nH]cc[nH+]1 ZINC000139826852 345802937 /nfs/dbraw/zinc/80/29/37/345802937.db2.gz AQLNVBNYLQMXRP-SNVBAGLBSA-N 1 2 231.303 2.380 20 0 BEADLO Cc1ccc(CC(=O)N[C@H](C)c2[nH]cc[nH+]2)cc1 ZINC000140948772 345826298 /nfs/dbraw/zinc/82/62/98/345826298.db2.gz WGDGRVBFIACCGT-LLVKDONJSA-N 1 2 243.310 2.138 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CCC[C@@H](C)[C@@H]2C)[nH+]1 ZINC000635602617 345887874 /nfs/dbraw/zinc/88/78/74/345887874.db2.gz JGFSCIKWUGAZTR-MNOVXSKESA-N 1 2 249.358 2.162 20 0 BEADLO CC(C)C[C@@H](C(=O)N(C)C1CCC1)n1cc[nH+]c1 ZINC000635613785 345893285 /nfs/dbraw/zinc/89/32/85/345893285.db2.gz IAWOAOONLNZQAK-ZDUSSCGKSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1cn2ccc(C(=O)N3CCC[C@H]3C)cc2[nH+]1 ZINC000635628714 345903457 /nfs/dbraw/zinc/90/34/57/345903457.db2.gz QLXAGTVDAOXVSW-LLVKDONJSA-N 1 2 243.310 2.267 20 0 BEADLO CC1(C)SC[C@H]1Nc1nc[nH+]c(N)c1Cl ZINC000282958828 187360890 /nfs/dbraw/zinc/36/08/90/187360890.db2.gz ZXPGUGCWIBXGGF-RXMQYKEDSA-N 1 2 244.751 2.018 20 0 BEADLO CC1(C)SC[C@H]1Nc1[nH+]cnc(N)c1Cl ZINC000282958828 187360892 /nfs/dbraw/zinc/36/08/92/187360892.db2.gz ZXPGUGCWIBXGGF-RXMQYKEDSA-N 1 2 244.751 2.018 20 0 BEADLO CC[C@H]1C[C@@H](C)CN1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635634323 345908498 /nfs/dbraw/zinc/90/84/98/345908498.db2.gz DGZFBVAFPGPYJJ-WRWGMCAJSA-N 1 2 247.342 2.160 20 0 BEADLO CC[C@H]1C[C@@H](C)CN1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635634323 345908501 /nfs/dbraw/zinc/90/85/01/345908501.db2.gz DGZFBVAFPGPYJJ-WRWGMCAJSA-N 1 2 247.342 2.160 20 0 BEADLO CC(C)C[C@H](C(=O)NC1CC(C)C1)n1cc[nH+]c1 ZINC000635642392 345917275 /nfs/dbraw/zinc/91/72/75/345917275.db2.gz PNSCRXICXIHYEO-WXRRBKDZSA-N 1 2 249.358 2.385 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H]2C[C@@H](C)O[C@@H]2C)[nH+]1 ZINC000631466778 345920198 /nfs/dbraw/zinc/92/01/98/345920198.db2.gz WVYJZWOWMRGWNH-SOCHQFKDSA-N 1 2 246.314 2.244 20 0 BEADLO C[C@@H]1C[C@H](Nc2cc(NC3CC3)[nH+]cn2)[C@H](C)O1 ZINC000631466788 345921556 /nfs/dbraw/zinc/92/15/56/345921556.db2.gz XAUXHQWXGBGPDG-YWVKMMECSA-N 1 2 248.330 2.029 20 0 BEADLO C[C@@H]1C[C@H](Nc2cc(NC3CC3)nc[nH+]2)[C@H](C)O1 ZINC000631466788 345921559 /nfs/dbraw/zinc/92/15/59/345921559.db2.gz XAUXHQWXGBGPDG-YWVKMMECSA-N 1 2 248.330 2.029 20 0 BEADLO CC[C@H](C)CN(CC)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635647844 345923887 /nfs/dbraw/zinc/92/38/87/345923887.db2.gz KJWGGBFAUTVOTD-QJPTWQEYSA-N 1 2 249.358 2.408 20 0 BEADLO CC[C@H](C)CN(CC)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635647844 345923888 /nfs/dbraw/zinc/92/38/88/345923888.db2.gz KJWGGBFAUTVOTD-QJPTWQEYSA-N 1 2 249.358 2.408 20 0 BEADLO CC[C@](C)(C[NH2+][C@@H](C)C(=O)OC(C)(C)C)OC ZINC000322639998 345956815 /nfs/dbraw/zinc/95/68/15/345956815.db2.gz UBSNZAJVLCEXEF-GXFFZTMASA-N 1 2 245.363 2.121 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@H]2CCCC2(C)C)[nH+]1 ZINC000635654856 345934076 /nfs/dbraw/zinc/93/40/76/345934076.db2.gz KSLBGRVGGJVTIX-NSHDSACASA-N 1 2 249.358 2.210 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@H]2CCC[C@@H]2CC)[nH+]1 ZINC000635676941 345972634 /nfs/dbraw/zinc/97/26/34/345972634.db2.gz OQQZNZUUHZVPDD-JQWIXIFHSA-N 1 2 249.358 2.210 20 0 BEADLO CC[C@@H]([NH2+]Cc1ncn(C)n1)c1ccsc1 ZINC000294396705 345981123 /nfs/dbraw/zinc/98/11/23/345981123.db2.gz KRAFXFUNHOEZQG-SNVBAGLBSA-N 1 2 236.344 2.118 20 0 BEADLO CCc1[nH]c(CNC(=O)C[C@@H]2C=CCCC2)c[nH+]1 ZINC001639094214 1172071257 /nfs/dbraw/zinc/07/12/57/1172071257.db2.gz WXXCQPIZQKAWCW-LLVKDONJSA-N 1 2 247.342 2.335 20 0 BEADLO CCc1[nH]cc(CNC(=O)C[C@@H]2C=CCCC2)[nH+]1 ZINC001639094214 1172071265 /nfs/dbraw/zinc/07/12/65/1172071265.db2.gz WXXCQPIZQKAWCW-LLVKDONJSA-N 1 2 247.342 2.335 20 0 BEADLO COCCCCN(C)c1cc[nH+]c2ccncc21 ZINC000419015937 192094294 /nfs/dbraw/zinc/09/42/94/192094294.db2.gz NXBIDZOITMTFIJ-UHFFFAOYSA-N 1 2 245.326 2.493 20 0 BEADLO Cc1nc(N2C[C@H](C)[C@@H](C)[C@@H]2C)cc[nH+]1 ZINC000419022692 192094574 /nfs/dbraw/zinc/09/45/74/192094574.db2.gz VKAKRNXGDPFXHX-AEJSXWLSSA-N 1 2 205.305 2.266 20 0 BEADLO Cc1nc(N2C[C@H](C)[C@H](C)[C@@H]2C)cc[nH+]1 ZINC000419022693 192094596 /nfs/dbraw/zinc/09/45/96/192094596.db2.gz VKAKRNXGDPFXHX-GUBZILKMSA-N 1 2 205.305 2.266 20 0 BEADLO COCc1ccccc1C[NH2+]Cc1ccon1 ZINC000148713800 346041037 /nfs/dbraw/zinc/04/10/37/346041037.db2.gz FDZAHZJMXFDXGJ-UHFFFAOYSA-N 1 2 232.283 2.111 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CC[C@@H](C)[C@H]2CC)[nH+]1 ZINC000635816178 346071972 /nfs/dbraw/zinc/07/19/72/346071972.db2.gz LHUFTGRMKMGUAK-ZYHUDNBSSA-N 1 2 249.358 2.162 20 0 BEADLO C[C@@H]1CCCCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635813576 346075437 /nfs/dbraw/zinc/07/54/37/346075437.db2.gz DIODPXDPYIHDRP-IJLUTSLNSA-N 1 2 247.342 2.162 20 0 BEADLO C[C@@H]1CCCCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635813576 346075440 /nfs/dbraw/zinc/07/54/40/346075440.db2.gz DIODPXDPYIHDRP-IJLUTSLNSA-N 1 2 247.342 2.162 20 0 BEADLO CCCn1cc[nH+]c1CCCN(C)C(=O)CC ZINC000192257645 187314862 /nfs/dbraw/zinc/31/48/62/187314862.db2.gz HNYNSKKZBABMOB-UHFFFAOYSA-N 1 2 237.347 2.094 20 0 BEADLO CC(C)C[C@H](C(=O)N1[C@H](C)C[C@H]1C)n1cc[nH+]c1 ZINC000635876003 346096111 /nfs/dbraw/zinc/09/61/11/346096111.db2.gz SLOYKRHAFSLZGX-JHJVBQTASA-N 1 2 249.358 2.480 20 0 BEADLO CCN(CC1CCC1)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635884489 346102041 /nfs/dbraw/zinc/10/20/41/346102041.db2.gz XOUKNLVRVFEJMC-VXGBXAGGSA-N 1 2 247.342 2.162 20 0 BEADLO CCN(CC1CCC1)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635884489 346102043 /nfs/dbraw/zinc/10/20/43/346102043.db2.gz XOUKNLVRVFEJMC-VXGBXAGGSA-N 1 2 247.342 2.162 20 0 BEADLO CCc1ncc(C[NH2+]C(CF)CF)s1 ZINC000449382801 201896662 /nfs/dbraw/zinc/89/66/62/201896662.db2.gz YTNFRXDNAKTENE-UHFFFAOYSA-N 1 2 220.288 2.103 20 0 BEADLO Cc1cc(NC[C@H]2CC23CC3)nc(C2CC2)[nH+]1 ZINC000418996172 192096736 /nfs/dbraw/zinc/09/67/36/192096736.db2.gz SENPTPGGJYRFED-LLVKDONJSA-N 1 2 229.327 2.296 20 0 BEADLO Cc1cn2ccc(C(=O)N[C@H]3CC[C@@H]3C)cc2[nH+]1 ZINC000635924915 346116343 /nfs/dbraw/zinc/11/63/43/346116343.db2.gz FNEGRSDGRNDTBT-CABZTGNLSA-N 1 2 243.310 2.171 20 0 BEADLO Cc1cn2ccc(C(=O)NCC[C@@H](C)F)cc2[nH+]1 ZINC000635965899 346125049 /nfs/dbraw/zinc/12/50/49/346125049.db2.gz PKUYWPLEQVXHTI-SECBINFHSA-N 1 2 249.289 2.121 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)CC(C)=C(C)C ZINC000635958394 346133215 /nfs/dbraw/zinc/13/32/15/346133215.db2.gz VIEPCIIUGNVMGB-UHFFFAOYSA-N 1 2 248.326 2.453 20 0 BEADLO CC[C@@H](C)[C@H]([NH2+]CCc1ccccc1)C(=O)OC ZINC000035044494 358452782 /nfs/dbraw/zinc/45/27/82/358452782.db2.gz YNYWNHSEWFELCZ-OCCSQVGLSA-N 1 2 249.354 2.406 20 0 BEADLO C[C@@H]1CCN(c2nc[nH+]c(N)c2Cl)[C@H](C)C1 ZINC000300333794 346147660 /nfs/dbraw/zinc/14/76/60/346147660.db2.gz SZCXNDMIZBJZND-HTQZYQBOSA-N 1 2 240.738 2.337 20 0 BEADLO C[C@@H]1CCN(c2[nH+]cnc(N)c2Cl)[C@H](C)C1 ZINC000300333794 346147668 /nfs/dbraw/zinc/14/76/68/346147668.db2.gz SZCXNDMIZBJZND-HTQZYQBOSA-N 1 2 240.738 2.337 20 0 BEADLO CCC1CN(C(=O)[C@H](CC(C)C)n2cc[nH+]c2)C1 ZINC000636014264 346155545 /nfs/dbraw/zinc/15/55/45/346155545.db2.gz FTQPXMZZMJMFAZ-ZDUSSCGKSA-N 1 2 249.358 2.339 20 0 BEADLO Cc1nc(C)c(C[NH2+]Cc2ccc(F)cn2)o1 ZINC000628229006 346177683 /nfs/dbraw/zinc/17/76/83/346177683.db2.gz HKKVXSXITRTWMK-UHFFFAOYSA-N 1 2 235.262 2.115 20 0 BEADLO Cc1ccc(NCc2nccs2)c[nH+]1 ZINC000149806148 346158511 /nfs/dbraw/zinc/15/85/11/346158511.db2.gz ASYXIXSNNSLXNV-UHFFFAOYSA-N 1 2 205.286 2.459 20 0 BEADLO Cc1nc(C[N@@H+]2CCOCC3(CCC3)C2)[nH]c1C ZINC000628238718 346198626 /nfs/dbraw/zinc/19/86/26/346198626.db2.gz KGCMQOULYPHNJJ-UHFFFAOYSA-N 1 2 249.358 2.029 20 0 BEADLO Cc1nc(C[N@H+]2CCOCC3(CCC3)C2)[nH]c1C ZINC000628238718 346198627 /nfs/dbraw/zinc/19/86/27/346198627.db2.gz KGCMQOULYPHNJJ-UHFFFAOYSA-N 1 2 249.358 2.029 20 0 BEADLO Cc1[nH]c(CN2CCOCC3(CCC3)C2)[nH+]c1C ZINC000628238718 346198630 /nfs/dbraw/zinc/19/86/30/346198630.db2.gz KGCMQOULYPHNJJ-UHFFFAOYSA-N 1 2 249.358 2.029 20 0 BEADLO COc1cnccc1[C@H](C)[NH2+]Cc1cnc(C)o1 ZINC000628244567 346208921 /nfs/dbraw/zinc/20/89/21/346208921.db2.gz MONZHFMMNJKAMQ-VIFPVBQESA-N 1 2 247.298 2.237 20 0 BEADLO Cc1c[nH]c(CN2CCOc3cc(F)ccc32)[nH+]1 ZINC000628246470 346212684 /nfs/dbraw/zinc/21/26/84/346212684.db2.gz NTBRNUFGUWQMHH-UHFFFAOYSA-N 1 2 247.273 2.256 20 0 BEADLO Cc1c[nH]c(CN(C)[C@H](C)c2ccccn2)[nH+]1 ZINC000628234489 346187676 /nfs/dbraw/zinc/18/76/76/346187676.db2.gz CIFQTLLDDXKQCL-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO Cc1[nH]c(CN(C)Cc2cccnc2)[nH+]c1C ZINC000628234981 346188668 /nfs/dbraw/zinc/18/86/68/346188668.db2.gz UUGAAZKIJWCQRI-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1c[nH]c(C[N@@H+](C)[C@H](C)c2ccncc2)n1 ZINC000628237187 346193545 /nfs/dbraw/zinc/19/35/45/346193545.db2.gz DWXDZOXLDUBXPF-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO Cc1c[nH]c(C[N@H+](C)[C@H](C)c2ccncc2)n1 ZINC000628237187 346193546 /nfs/dbraw/zinc/19/35/46/346193546.db2.gz DWXDZOXLDUBXPF-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO Cc1c[nH]c(CN(C)[C@H](C)c2ccncc2)[nH+]1 ZINC000628237187 346193549 /nfs/dbraw/zinc/19/35/49/346193549.db2.gz DWXDZOXLDUBXPF-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO CCn1ccc(CN(C)Cc2[nH]c(C)c(C)[nH+]2)c1 ZINC000628250704 346220702 /nfs/dbraw/zinc/22/07/02/346220702.db2.gz BQJLSJLOZNLXRI-UHFFFAOYSA-N 1 2 246.358 2.480 20 0 BEADLO CCn1ccc(C[N@H+](C)Cc2nc(C)c(C)[nH]2)c1 ZINC000628250704 346220705 /nfs/dbraw/zinc/22/07/05/346220705.db2.gz BQJLSJLOZNLXRI-UHFFFAOYSA-N 1 2 246.358 2.480 20 0 BEADLO CCn1ccc(C[N@@H+](C)Cc2nc(C)c(C)[nH]2)c1 ZINC000628250704 346220708 /nfs/dbraw/zinc/22/07/08/346220708.db2.gz BQJLSJLOZNLXRI-UHFFFAOYSA-N 1 2 246.358 2.480 20 0 BEADLO Cc1noc([C@@H]2CCC[N@H+]2Cc2cnc(C)o2)n1 ZINC000628276016 346283872 /nfs/dbraw/zinc/28/38/72/346283872.db2.gz NSMIFMSJRQDQLB-NSHDSACASA-N 1 2 248.286 2.012 20 0 BEADLO Cc1noc([C@@H]2CCC[N@@H+]2Cc2cnc(C)o2)n1 ZINC000628276016 346283878 /nfs/dbraw/zinc/28/38/78/346283878.db2.gz NSMIFMSJRQDQLB-NSHDSACASA-N 1 2 248.286 2.012 20 0 BEADLO Cc1cccc(C(=O)N[C@H](C)Cn2cc[nH+]c2)c1 ZINC000042512282 179023171 /nfs/dbraw/zinc/02/31/71/179023171.db2.gz HAPQLXQPSJKOPR-GFCCVEGCSA-N 1 2 243.310 2.010 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC[C@H]2c2ccncc2)n1 ZINC000628277548 346286261 /nfs/dbraw/zinc/28/62/61/346286261.db2.gz XHBGWLYSERORFY-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC[C@H]2c2ccncc2)n1 ZINC000628277548 346286264 /nfs/dbraw/zinc/28/62/64/346286264.db2.gz XHBGWLYSERORFY-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1cccc(C)c1C ZINC000266997941 179020042 /nfs/dbraw/zinc/02/00/42/179020042.db2.gz XHLQIOMENRPABZ-UHFFFAOYSA-N 1 2 243.310 2.265 20 0 BEADLO CC[C@@]1(O)CCCN(c2nc(C)[nH+]c(C)c2C)C1 ZINC000631486584 346279678 /nfs/dbraw/zinc/27/96/78/346279678.db2.gz VUCGSRMFMBSGCU-CQSZACIVSA-N 1 2 249.358 2.143 20 0 BEADLO CCCCc1cc(NCC[C@@H](C)OC)nc[nH+]1 ZINC000631094807 346285964 /nfs/dbraw/zinc/28/59/64/346285964.db2.gz MCHMAJATCRWFIN-LLVKDONJSA-N 1 2 237.347 2.078 20 0 BEADLO Cc1c[nH]c(CN2CCOCc3ccccc32)[nH+]1 ZINC000628283801 346295236 /nfs/dbraw/zinc/29/52/36/346295236.db2.gz NILNCPGSZISMEO-UHFFFAOYSA-N 1 2 243.310 2.255 20 0 BEADLO CC(C)C[C@@H](C(=O)N[C@H]1CC12CC2)n1cc[nH+]c1 ZINC000636056202 346302971 /nfs/dbraw/zinc/30/29/71/346302971.db2.gz KHHFRYNJYVPTLC-RYUDHWBXSA-N 1 2 247.342 2.139 20 0 BEADLO Cc1[nH]c(CN(C)Cc2ccc(O)cc2)[nH+]c1C ZINC000628279812 346290544 /nfs/dbraw/zinc/29/05/44/346290544.db2.gz AQLXOZPSMDNPGV-UHFFFAOYSA-N 1 2 245.326 2.364 20 0 BEADLO Cc1nc(C[N@@H+](C)Cc2ccc(O)cc2)[nH]c1C ZINC000628279812 346290545 /nfs/dbraw/zinc/29/05/45/346290545.db2.gz AQLXOZPSMDNPGV-UHFFFAOYSA-N 1 2 245.326 2.364 20 0 BEADLO Cc1nc(C[N@H+](C)Cc2ccc(O)cc2)[nH]c1C ZINC000628279812 346290548 /nfs/dbraw/zinc/29/05/48/346290548.db2.gz AQLXOZPSMDNPGV-UHFFFAOYSA-N 1 2 245.326 2.364 20 0 BEADLO Cc1cccc(C)c1C[NH2+][C@H](C)c1ncn(C)n1 ZINC000275517447 179038563 /nfs/dbraw/zinc/03/85/63/179038563.db2.gz IVCJHHYBXKWWAW-GFCCVEGCSA-N 1 2 244.342 2.283 20 0 BEADLO Cc1nsc(C)c1C[N@H+]1CCO[C@@H](C)[C@H]1C ZINC000563350753 323120120 /nfs/dbraw/zinc/12/01/20/323120120.db2.gz QHGCUBJGCVOMIR-ZJUUUORDSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nsc(C)c1C[N@@H+]1CCO[C@@H](C)[C@H]1C ZINC000563350753 323120121 /nfs/dbraw/zinc/12/01/21/323120121.db2.gz QHGCUBJGCVOMIR-ZJUUUORDSA-N 1 2 240.372 2.369 20 0 BEADLO CC(F)(F)C[NH2+]Cc1ccc2[nH]c(=O)[nH]c2c1 ZINC000641757613 362687077 /nfs/dbraw/zinc/68/70/77/362687077.db2.gz ZTTAKTYWJRFTNW-UHFFFAOYSA-N 1 2 241.241 2.013 20 0 BEADLO CC[C@@](C)(NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C1CC1 ZINC000636203788 346352336 /nfs/dbraw/zinc/35/23/36/346352336.db2.gz DDYUOPAYALCTQY-JTNHKYCSSA-N 1 2 247.342 2.208 20 0 BEADLO CC[C@@](C)(NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C1CC1 ZINC000636203788 346352337 /nfs/dbraw/zinc/35/23/37/346352337.db2.gz DDYUOPAYALCTQY-JTNHKYCSSA-N 1 2 247.342 2.208 20 0 BEADLO CCc1c[nH]c(CC(=O)NCCCC2CCC2)[nH+]1 ZINC000636202948 346353330 /nfs/dbraw/zinc/35/33/30/346353330.db2.gz RXNHTWLSMSMMRH-UHFFFAOYSA-N 1 2 249.358 2.211 20 0 BEADLO CC(C)=C(C)CC(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000636211403 346354861 /nfs/dbraw/zinc/35/48/61/346354861.db2.gz FBCBULUTDFNECX-NSHDSACASA-N 1 2 235.331 2.344 20 0 BEADLO Cc1cccc(CCC[NH2+][C@@]2(C)CCOC2=O)c1 ZINC000289464348 179055874 /nfs/dbraw/zinc/05/58/74/179055874.db2.gz GVCBRCKWEIDZGB-HNNXBMFYSA-N 1 2 247.338 2.223 20 0 BEADLO Fc1ccc2nc(NCCn3cc[nH+]c3)oc2c1 ZINC001639164639 1172082061 /nfs/dbraw/zinc/08/20/61/1172082061.db2.gz RESMZHXRXIAXGH-UHFFFAOYSA-N 1 2 246.245 2.276 20 0 BEADLO C[C@@H](CC1CCC1)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636328488 346397533 /nfs/dbraw/zinc/39/75/33/346397533.db2.gz FEWYWTYSHDMJFW-MVWJERBFSA-N 1 2 247.342 2.208 20 0 BEADLO C[C@@H](CC1CCC1)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636328488 346397535 /nfs/dbraw/zinc/39/75/35/346397535.db2.gz FEWYWTYSHDMJFW-MVWJERBFSA-N 1 2 247.342 2.208 20 0 BEADLO CC(C)(C)n1ncnc1C[N@@H+]1CCCC2(CC2)C1 ZINC000336478115 187368215 /nfs/dbraw/zinc/36/82/15/187368215.db2.gz NZMSABHNDXQXHZ-UHFFFAOYSA-N 1 2 248.374 2.409 20 0 BEADLO CC(C)(C)n1ncnc1C[N@H+]1CCCC2(CC2)C1 ZINC000336478115 187368216 /nfs/dbraw/zinc/36/82/16/187368216.db2.gz NZMSABHNDXQXHZ-UHFFFAOYSA-N 1 2 248.374 2.409 20 0 BEADLO C[N@H+](Cc1cn[nH]c1)Cc1ccc(Cl)cn1 ZINC000679217285 488317430 /nfs/dbraw/zinc/31/74/30/488317430.db2.gz YJWHLJDQEGRYBV-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO C[N@@H+](Cc1cn[nH]c1)Cc1ccc(Cl)cn1 ZINC000679217285 488317432 /nfs/dbraw/zinc/31/74/32/488317432.db2.gz YJWHLJDQEGRYBV-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO Cc1cccc(C[N@H+]2CCc3c(ncn3C)C2)c1 ZINC000363801332 179082182 /nfs/dbraw/zinc/08/21/82/179082182.db2.gz GVXJBGSSSYVBDM-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO Cc1cccc(C[N@@H+]2CCc3c(ncn3C)C2)c1 ZINC000363801332 179082187 /nfs/dbraw/zinc/08/21/87/179082187.db2.gz GVXJBGSSSYVBDM-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO Cc1cccc(CN2CCc3c([nH+]cn3C)C2)c1 ZINC000363801332 179082188 /nfs/dbraw/zinc/08/21/88/179082188.db2.gz GVXJBGSSSYVBDM-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO Cc1n[nH]cc1[C@H](C)[NH2+][C@@H](C)C(F)F ZINC000641792287 362727611 /nfs/dbraw/zinc/72/76/11/362727611.db2.gz TXVIIAJJXUVONV-FSPLSTOPSA-N 1 2 203.236 2.022 20 0 BEADLO Cc1ncncc1[C@H](C)[NH2+][C@@H](C)C(F)F ZINC000641792576 362728052 /nfs/dbraw/zinc/72/80/52/362728052.db2.gz XJZWVEVPIWSEJQ-YUMQZZPRSA-N 1 2 215.247 2.089 20 0 BEADLO Cc1ncncc1[C@H](C)[NH2+][C@H](C)C(F)F ZINC000641792574 362728080 /nfs/dbraw/zinc/72/80/80/362728080.db2.gz XJZWVEVPIWSEJQ-JGVFFNPUSA-N 1 2 215.247 2.089 20 0 BEADLO CCc1noc(C)c1C[N@@H+]1C[C@@H](C)OC[C@H]1C ZINC000334226833 346446976 /nfs/dbraw/zinc/44/69/76/346446976.db2.gz NIHHKQGPTHYHKD-NXEZZACHSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1noc(C)c1C[N@H+]1C[C@@H](C)OC[C@H]1C ZINC000334226833 346446981 /nfs/dbraw/zinc/44/69/81/346446981.db2.gz NIHHKQGPTHYHKD-NXEZZACHSA-N 1 2 238.331 2.155 20 0 BEADLO Cc1cnn(CC2CC[NH+](CC(F)F)CC2)c1 ZINC000603412942 349961562 /nfs/dbraw/zinc/96/15/62/349961562.db2.gz QEKCUHFBAZZCSU-UHFFFAOYSA-N 1 2 243.301 2.169 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)N[C@@H](C)C(F)F ZINC000641791634 362732045 /nfs/dbraw/zinc/73/20/45/362732045.db2.gz LKERPIWVMJURMS-JGVFFNPUSA-N 1 2 217.263 2.207 20 0 BEADLO COc1ccsc1C[NH2+][C@H](C)C(F)F ZINC000641794265 362734244 /nfs/dbraw/zinc/73/42/44/362734244.db2.gz UMXBPIXYAJRFMG-ZCFIWIBFSA-N 1 2 221.272 2.500 20 0 BEADLO CCN(C)c1ccc(C[NH2+][C@H](C)C(F)F)cn1 ZINC000641794601 362735423 /nfs/dbraw/zinc/73/54/23/362735423.db2.gz WVSFLKPJWVMWOR-SECBINFHSA-N 1 2 243.301 2.281 20 0 BEADLO CCN(C)c1ccc(C[NH2+][C@@H](C)C(F)F)cn1 ZINC000641794602 362735697 /nfs/dbraw/zinc/73/56/97/362735697.db2.gz WVSFLKPJWVMWOR-VIFPVBQESA-N 1 2 243.301 2.281 20 0 BEADLO Cc1cccc(C[NH2+]CC(F)(F)CO)c1C ZINC000183884339 179091082 /nfs/dbraw/zinc/09/10/82/179091082.db2.gz REVSUDGIWNZRMJ-UHFFFAOYSA-N 1 2 229.270 2.021 20 0 BEADLO CO[C@@H](CC(C)C)C[N@H+](C)Cc1ccon1 ZINC000419207532 192104330 /nfs/dbraw/zinc/10/43/30/192104330.db2.gz PCMIKPJYXKJACS-LBPRGKRZSA-N 1 2 226.320 2.168 20 0 BEADLO CO[C@@H](CC(C)C)C[N@@H+](C)Cc1ccon1 ZINC000419207532 192104331 /nfs/dbraw/zinc/10/43/31/192104331.db2.gz PCMIKPJYXKJACS-LBPRGKRZSA-N 1 2 226.320 2.168 20 0 BEADLO CO[C@H](CC(C)C)C[N@H+](C)Cc1ccon1 ZINC000419207531 192104383 /nfs/dbraw/zinc/10/43/83/192104383.db2.gz PCMIKPJYXKJACS-GFCCVEGCSA-N 1 2 226.320 2.168 20 0 BEADLO CC[C@@H]([NH2+]Cc1cccc(C)c1)C(=O)OC ZINC000168241029 346731452 /nfs/dbraw/zinc/73/14/52/346731452.db2.gz PNQLRDGCQYWEHI-GFCCVEGCSA-N 1 2 221.300 2.036 20 0 BEADLO Cc1cccc(NCc2n[nH]c(C(C)C)n2)[nH+]1 ZINC000294845571 179152225 /nfs/dbraw/zinc/15/22/25/179152225.db2.gz AKANLNSIBGIJTH-UHFFFAOYSA-N 1 2 231.303 2.244 20 0 BEADLO CO[C@H](CC(C)C)C[N@@H+](C)Cc1ccon1 ZINC000419207531 192104385 /nfs/dbraw/zinc/10/43/85/192104385.db2.gz PCMIKPJYXKJACS-GFCCVEGCSA-N 1 2 226.320 2.168 20 0 BEADLO C[C@H]1CN(c2[nH+]ccc3ccccc32)C[C@H]1O ZINC000387846223 347109081 /nfs/dbraw/zinc/10/90/81/347109081.db2.gz CCMGQNNJWQEPSH-GXFFZTMASA-N 1 2 228.295 2.052 20 0 BEADLO CCN(CC)C(=O)C[C@@H](C)Nc1ccc(C)[nH+]c1 ZINC000182906550 347111522 /nfs/dbraw/zinc/11/15/22/347111522.db2.gz MSFKWFPDPRXUMO-GFCCVEGCSA-N 1 2 249.358 2.449 20 0 BEADLO Cc1cccc(OCC[N@@H+](C)Cc2cocn2)c1 ZINC000191923475 179165925 /nfs/dbraw/zinc/16/59/25/179165925.db2.gz GGXILKCBCRZBKM-UHFFFAOYSA-N 1 2 246.310 2.494 20 0 BEADLO Cc1cccc(OCC[N@H+](C)Cc2cocn2)c1 ZINC000191923475 179165928 /nfs/dbraw/zinc/16/59/28/179165928.db2.gz GGXILKCBCRZBKM-UHFFFAOYSA-N 1 2 246.310 2.494 20 0 BEADLO CC[C@@H]([NH2+]Cc1nccs1)c1nccn1C ZINC000182527019 346798561 /nfs/dbraw/zinc/79/85/61/346798561.db2.gz KVQCAULOEJRPRF-SECBINFHSA-N 1 2 236.344 2.118 20 0 BEADLO CC[C@@H](NCc1nccs1)c1[nH+]ccn1C ZINC000182527019 346798566 /nfs/dbraw/zinc/79/85/66/346798566.db2.gz KVQCAULOEJRPRF-SECBINFHSA-N 1 2 236.344 2.118 20 0 BEADLO CCOC(=O)C1(C)CC([NH2+]C2(C(F)F)CC2)C1 ZINC000601279589 347142153 /nfs/dbraw/zinc/14/21/53/347142153.db2.gz HWMYBUPZJHUAJE-UHFFFAOYSA-N 1 2 247.285 2.106 20 0 BEADLO COC(=O)[C@H](Cc1ccccc1)[NH2+]CCC(C)C ZINC000034605248 347230886 /nfs/dbraw/zinc/23/08/86/347230886.db2.gz HGMWYPZHJXQRLQ-AWEZNQCLSA-N 1 2 249.354 2.406 20 0 BEADLO Cc1c[nH]c(CN2CCOC[C@@H]2CC2CCC2)[nH+]1 ZINC000628296977 347243368 /nfs/dbraw/zinc/24/33/68/347243368.db2.gz FLKCJILSCSRVRN-ZDUSSCGKSA-N 1 2 249.358 2.109 20 0 BEADLO CC[C@H]1CCC[C@@H]1C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627372831 347256511 /nfs/dbraw/zinc/25/65/11/347256511.db2.gz XWRYOGNQTCSCMA-QWRGUYRKSA-N 1 2 247.342 2.121 20 0 BEADLO CC[C@H]1CCC[C@@H]1C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627372831 347256515 /nfs/dbraw/zinc/25/65/15/347256515.db2.gz XWRYOGNQTCSCMA-QWRGUYRKSA-N 1 2 247.342 2.121 20 0 BEADLO CC[C@@H]([NH2+]Cc1ncn(C)n1)c1cccc(F)c1 ZINC000188296000 347277349 /nfs/dbraw/zinc/27/73/49/347277349.db2.gz WWRSQANMFVOWHI-GFCCVEGCSA-N 1 2 248.305 2.195 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+](CC=C(C)C)C1CC1 ZINC000190831413 347335833 /nfs/dbraw/zinc/33/58/33/347335833.db2.gz DMFLTGBJPZNWMY-LLVKDONJSA-N 1 2 225.332 2.369 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+](CC=C(C)C)C1CC1 ZINC000190831413 347335835 /nfs/dbraw/zinc/33/58/35/347335835.db2.gz DMFLTGBJPZNWMY-LLVKDONJSA-N 1 2 225.332 2.369 20 0 BEADLO Cc1nonc1C[N@@H+]1CCc2cccc(C)c2C1 ZINC000277103487 179217570 /nfs/dbraw/zinc/21/75/70/179217570.db2.gz GRGUTIBAEIHTFZ-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1nonc1C[N@H+]1CCc2cccc(C)c2C1 ZINC000277103487 179217572 /nfs/dbraw/zinc/21/75/72/179217572.db2.gz GRGUTIBAEIHTFZ-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1cccc2c1C[N@H+](Cc1cnns1)CC2 ZINC000295861058 179217600 /nfs/dbraw/zinc/21/76/00/179217600.db2.gz BXFHUSNTMAPIHR-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cccc2c1C[N@@H+](Cc1cnns1)CC2 ZINC000295861058 179217602 /nfs/dbraw/zinc/21/76/02/179217602.db2.gz BXFHUSNTMAPIHR-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cccc2c1N(Cc1c[nH+]cn1C)CC2 ZINC000177011788 179219640 /nfs/dbraw/zinc/21/96/40/179219640.db2.gz NJICZYDJHLEIHY-UHFFFAOYSA-N 1 2 227.311 2.291 20 0 BEADLO CC(F)(F)C[NH2+]Cc1ccc(C#N)s1 ZINC000382140248 347399095 /nfs/dbraw/zinc/39/90/95/347399095.db2.gz ZQVLRUWZXGJUSM-UHFFFAOYSA-N 1 2 216.256 2.365 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616921608 347450841 /nfs/dbraw/zinc/45/08/41/347450841.db2.gz XGMBTBSSKKSOTQ-PWSUYJOCSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616921608 347450846 /nfs/dbraw/zinc/45/08/46/347450846.db2.gz XGMBTBSSKKSOTQ-PWSUYJOCSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@H]1CC(C(=O)N(C)Cc2c[nH+]c[nH]2)C[C@H](C)C1 ZINC000616927522 347454588 /nfs/dbraw/zinc/45/45/88/347454588.db2.gz KNIFCWFZKJPJRA-GHMZBOCLSA-N 1 2 249.358 2.440 20 0 BEADLO C[C@H]1CC(C(=O)N(C)Cc2c[nH]c[nH+]2)C[C@H](C)C1 ZINC000616927522 347454592 /nfs/dbraw/zinc/45/45/92/347454592.db2.gz KNIFCWFZKJPJRA-GHMZBOCLSA-N 1 2 249.358 2.440 20 0 BEADLO C[C@@H](C(=O)N(C)Cc1c[nH+]c[nH]1)c1cccs1 ZINC000616925755 347457384 /nfs/dbraw/zinc/45/73/84/347457384.db2.gz PGCCPXBTWGPGIK-SECBINFHSA-N 1 2 249.339 2.233 20 0 BEADLO C[C@@H](C(=O)N(C)Cc1c[nH]c[nH+]1)c1cccs1 ZINC000616925755 347457387 /nfs/dbraw/zinc/45/73/87/347457387.db2.gz PGCCPXBTWGPGIK-SECBINFHSA-N 1 2 249.339 2.233 20 0 BEADLO CC(C)c1ccoc1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616928487 347494696 /nfs/dbraw/zinc/49/46/96/347494696.db2.gz BHMDLOIDNSSJTQ-UHFFFAOYSA-N 1 2 247.298 2.398 20 0 BEADLO CC(C)c1ccoc1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616928487 347494698 /nfs/dbraw/zinc/49/46/98/347494698.db2.gz BHMDLOIDNSSJTQ-UHFFFAOYSA-N 1 2 247.298 2.398 20 0 BEADLO CCC(C)(C)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000590727040 347496838 /nfs/dbraw/zinc/49/68/38/347496838.db2.gz IAQQOTGRKDYZAE-GFCCVEGCSA-N 1 2 249.358 2.483 20 0 BEADLO CC(C)n1cccc1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616926423 347458195 /nfs/dbraw/zinc/45/81/95/347458195.db2.gz BMYRIGAOHUQHLN-UHFFFAOYSA-N 1 2 246.314 2.064 20 0 BEADLO CC(C)n1cccc1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616926423 347458200 /nfs/dbraw/zinc/45/82/00/347458200.db2.gz BMYRIGAOHUQHLN-UHFFFAOYSA-N 1 2 246.314 2.064 20 0 BEADLO C[C@@H]1CC[C@H](CC(=O)N(C)Cc2c[nH+]c[nH]2)C1 ZINC000616926744 347459599 /nfs/dbraw/zinc/45/95/99/347459599.db2.gz OCTMTYYPZCTAHS-MNOVXSKESA-N 1 2 235.331 2.194 20 0 BEADLO C[C@@H]1CC[C@H](CC(=O)N(C)Cc2c[nH]c[nH+]2)C1 ZINC000616926744 347459603 /nfs/dbraw/zinc/45/96/03/347459603.db2.gz OCTMTYYPZCTAHS-MNOVXSKESA-N 1 2 235.331 2.194 20 0 BEADLO Cc1cnc(C[NH2+][C@H](C)c2ccnn2C)s1 ZINC000192905227 365879043 /nfs/dbraw/zinc/87/90/43/365879043.db2.gz WQIQMZOJGNCYHU-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO CCc1nc(C[N@@H+](C)C[C@H](C)CC)no1 ZINC000111253333 347472970 /nfs/dbraw/zinc/47/29/70/347472970.db2.gz ANPNALBXGQMBAB-SECBINFHSA-N 1 2 211.309 2.110 20 0 BEADLO CCc1nc(C[N@H+](C)C[C@H](C)CC)no1 ZINC000111253333 347472973 /nfs/dbraw/zinc/47/29/73/347472973.db2.gz ANPNALBXGQMBAB-SECBINFHSA-N 1 2 211.309 2.110 20 0 BEADLO CCC[C@H](C)C(=O)NCc1[nH]c2c([nH+]1)CCCC2 ZINC001639296422 1172092726 /nfs/dbraw/zinc/09/27/26/1172092726.db2.gz UUHJNISVDVXXAM-JTQLQIEISA-N 1 2 249.358 2.341 20 0 BEADLO Cc1ccccc1C[N@@H+](C)Cc1ncccn1 ZINC000361702785 179270618 /nfs/dbraw/zinc/27/06/18/179270618.db2.gz OPUHUGRALZDQCF-UHFFFAOYSA-N 1 2 227.311 2.417 20 0 BEADLO Cc1ccccc1C[N@H+](C)Cc1ncccn1 ZINC000361702785 179270619 /nfs/dbraw/zinc/27/06/19/179270619.db2.gz OPUHUGRALZDQCF-UHFFFAOYSA-N 1 2 227.311 2.417 20 0 BEADLO Cc1ccccc1C[N@@H+]1CC(F)(F)C[C@H]1CO ZINC000366678215 179271301 /nfs/dbraw/zinc/27/13/01/179271301.db2.gz LTLLXTOSDBUHQB-LBPRGKRZSA-N 1 2 241.281 2.197 20 0 BEADLO Cc1ccccc1C[N@H+]1CC(F)(F)C[C@H]1CO ZINC000366678215 179271303 /nfs/dbraw/zinc/27/13/03/179271303.db2.gz LTLLXTOSDBUHQB-LBPRGKRZSA-N 1 2 241.281 2.197 20 0 BEADLO CC[C@@H]1CCCN1C(=O)CCCn1cc[nH+]c1 ZINC000591201094 347630093 /nfs/dbraw/zinc/63/00/93/347630093.db2.gz AYXMNMSRQZURRV-GFCCVEGCSA-N 1 2 235.331 2.064 20 0 BEADLO CCCC[C@H]([NH2+][C@H](C)[C@@H]1CC1(F)F)C(=O)OC ZINC000591377448 347651291 /nfs/dbraw/zinc/65/12/91/347651291.db2.gz ZXADOXVWHZPTQV-UTLUCORTSA-N 1 2 249.301 2.352 20 0 BEADLO CCC(CC)C(=O)N1CC(Oc2cc[nH+]cc2)C1 ZINC000591047083 347615219 /nfs/dbraw/zinc/61/52/19/347615219.db2.gz JRWKCLQNVMOCFM-UHFFFAOYSA-N 1 2 248.326 2.107 20 0 BEADLO Cc1ccccc1C[N@@H+]1CCn2cnnc2[C@@H]1C ZINC000276737044 179275770 /nfs/dbraw/zinc/27/57/70/179275770.db2.gz CLFHIRHPHHCMGW-LBPRGKRZSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1ccccc1C[N@H+]1CCn2cnnc2[C@@H]1C ZINC000276737044 179275774 /nfs/dbraw/zinc/27/57/74/179275774.db2.gz CLFHIRHPHHCMGW-LBPRGKRZSA-N 1 2 242.326 2.163 20 0 BEADLO FC(F)(F)CN1CCC[C@H](n2cc[nH+]c2)C1 ZINC000591866879 347707636 /nfs/dbraw/zinc/70/76/36/347707636.db2.gz IHKCGJWJIQNOJA-VIFPVBQESA-N 1 2 233.237 2.082 20 0 BEADLO c1cn([C@@H]2CCCN(Cc3cscn3)C2)c[nH+]1 ZINC000591866865 347707674 /nfs/dbraw/zinc/70/76/74/347707674.db2.gz IALAMJCKXVOCRQ-GFCCVEGCSA-N 1 2 248.355 2.177 20 0 BEADLO C[C@H]1CCCN(C(=O)/C=C/c2[nH]cc[nH+]2)CC1 ZINC000493348502 347731348 /nfs/dbraw/zinc/73/13/48/347731348.db2.gz FPFRBQAEPYOVGF-ZWNMCFTASA-N 1 2 233.315 2.072 20 0 BEADLO CCCc1noc(C[N@H+](CC)CCSC)n1 ZINC000592199538 347752130 /nfs/dbraw/zinc/75/21/30/347752130.db2.gz QXMFFGGFIZCNIE-UHFFFAOYSA-N 1 2 243.376 2.207 20 0 BEADLO CCCc1noc(C[N@@H+](CC)CCSC)n1 ZINC000592199538 347752133 /nfs/dbraw/zinc/75/21/33/347752133.db2.gz QXMFFGGFIZCNIE-UHFFFAOYSA-N 1 2 243.376 2.207 20 0 BEADLO CC[N@H+](CCSC)[C@@H](C)c1csnn1 ZINC000592201222 347752554 /nfs/dbraw/zinc/75/25/54/347752554.db2.gz DBBYKZJNZZACDO-QMMMGPOBSA-N 1 2 231.390 2.284 20 0 BEADLO CC[N@@H+](CCSC)[C@@H](C)c1csnn1 ZINC000592201222 347752557 /nfs/dbraw/zinc/75/25/57/347752557.db2.gz DBBYKZJNZZACDO-QMMMGPOBSA-N 1 2 231.390 2.284 20 0 BEADLO Cn1ccnc1C[N@@H+]1CCCc2sccc2C1 ZINC000592981693 347841793 /nfs/dbraw/zinc/84/17/93/347841793.db2.gz AXPPCLGYOPUAFS-UHFFFAOYSA-N 1 2 247.367 2.430 20 0 BEADLO Cn1ccnc1C[N@H+]1CCCc2sccc2C1 ZINC000592981693 347841797 /nfs/dbraw/zinc/84/17/97/347841797.db2.gz AXPPCLGYOPUAFS-UHFFFAOYSA-N 1 2 247.367 2.430 20 0 BEADLO CC(C)(C)OC(=O)C[NH2+]C1(C2CCC2)CC1 ZINC000593084195 347852433 /nfs/dbraw/zinc/85/24/33/347852433.db2.gz OHRZYPXONDLNDI-UHFFFAOYSA-N 1 2 225.332 2.250 20 0 BEADLO Cc1ccc2[nH+]c(CN(C)CC(F)F)cn2c1 ZINC000176915394 365928466 /nfs/dbraw/zinc/92/84/66/365928466.db2.gz UBXKOEBLRKQJBW-UHFFFAOYSA-N 1 2 239.269 2.340 20 0 BEADLO CCc1cccc(C[NH2+][C@H](CC)C(=O)OC)c1 ZINC000593183227 347869108 /nfs/dbraw/zinc/86/91/08/347869108.db2.gz QYVFXVYVUGLELE-CYBMUJFWSA-N 1 2 235.327 2.290 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C1(C(F)(F)F)CC1 ZINC000593271065 347876514 /nfs/dbraw/zinc/87/65/14/347876514.db2.gz JAPXEWZKCMKUMH-UHFFFAOYSA-N 1 2 244.216 2.093 20 0 BEADLO Cc1ccccc1S(=O)(=O)Nc1cc[nH+]cc1 ZINC000109420549 179315440 /nfs/dbraw/zinc/31/54/40/179315440.db2.gz UONCGWYSHBRVBK-UHFFFAOYSA-N 1 2 248.307 2.191 20 0 BEADLO C[C@@H]1CC[C@H](C)N1C(=O)c1ccc2[nH+]ccn2c1 ZINC000176934819 365932388 /nfs/dbraw/zinc/93/23/88/365932388.db2.gz VFANWZDKBPUERB-PHIMTYICSA-N 1 2 243.310 2.347 20 0 BEADLO Cc1ccccc1[C@@H](C)[NH2+]Cc1nccc(N)n1 ZINC000181552856 179321442 /nfs/dbraw/zinc/32/14/42/179321442.db2.gz FAYDAKLOVNNIOY-LLVKDONJSA-N 1 2 242.326 2.218 20 0 BEADLO Cc1nc(N2C[C@H]3CCCC[C@@H]3C2)cc[nH+]1 ZINC000176974307 365951866 /nfs/dbraw/zinc/95/18/66/365951866.db2.gz CWYRHPRXWKARKS-VXGBXAGGSA-N 1 2 217.316 2.411 20 0 BEADLO Cc1cccn2cc(CNC(=O)CC3CC3)[nH+]c12 ZINC000110800535 179356878 /nfs/dbraw/zinc/35/68/78/179356878.db2.gz GSLOFOWGOYBCQU-UHFFFAOYSA-N 1 2 243.310 2.059 20 0 BEADLO CCC[C@H]([NH2+]CCC(C)(C)F)C(=O)OCC ZINC000594731334 348113310 /nfs/dbraw/zinc/11/33/10/348113310.db2.gz RBVUAAPKPCBXQB-JTQLQIEISA-N 1 2 233.327 2.446 20 0 BEADLO CCc1cc[nH+]cc1N[C@H](C)[C@@H]1C[C@@H]1C(=O)OC ZINC000594948051 348146656 /nfs/dbraw/zinc/14/66/56/348146656.db2.gz JZYFOCHOCITUQF-USWWRNFRSA-N 1 2 248.326 2.254 20 0 BEADLO CCc1cc[nH+]cc1N[C@H](C)[C@H]1C[C@@H]1C(=O)OC ZINC000594948050 348146768 /nfs/dbraw/zinc/14/67/68/348146768.db2.gz JZYFOCHOCITUQF-JLLWLGSASA-N 1 2 248.326 2.254 20 0 BEADLO COC(=O)[C@H]([NH2+]CC1CC=CC1)c1ccccc1 ZINC000595364801 348230484 /nfs/dbraw/zinc/23/04/84/348230484.db2.gz WFWAXNHTVUFVNC-CQSZACIVSA-N 1 2 245.322 2.457 20 0 BEADLO Cc1cc(N[C@H](CO)c2ccccc2C)nc[nH+]1 ZINC000531334379 348297055 /nfs/dbraw/zinc/29/70/55/348297055.db2.gz WMZJMBWINPJLED-CYBMUJFWSA-N 1 2 243.310 2.239 20 0 BEADLO CC[C@H]([NH2+]C1(CC(C)C)CC1)C(=O)OC ZINC000595831022 348365740 /nfs/dbraw/zinc/36/57/40/348365740.db2.gz KHUYDVFPTDDVAO-JTQLQIEISA-N 1 2 213.321 2.106 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)C2CC=CC2)[nH+]1 ZINC001639428002 1172104317 /nfs/dbraw/zinc/10/43/17/1172104317.db2.gz SIQFTJYAJRQPFX-UHFFFAOYSA-N 1 2 233.315 2.116 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)C2CC=CC2)c[nH+]1 ZINC001639428002 1172104320 /nfs/dbraw/zinc/10/43/20/1172104320.db2.gz SIQFTJYAJRQPFX-UHFFFAOYSA-N 1 2 233.315 2.116 20 0 BEADLO CCCC[C@H]([NH2+]CC1=CCCC1)C(=O)OC ZINC000596048923 348429419 /nfs/dbraw/zinc/42/94/19/348429419.db2.gz WWEJTMOYNMPPAX-LBPRGKRZSA-N 1 2 225.332 2.418 20 0 BEADLO COC(=O)Cc1cc[nH+]c(NCC(C)(C)C)c1 ZINC000596085111 348431724 /nfs/dbraw/zinc/43/17/24/348431724.db2.gz AFDNKLGRKIXRDI-UHFFFAOYSA-N 1 2 236.315 2.255 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@H]2CC=CCC2)c1 ZINC000596134311 348447211 /nfs/dbraw/zinc/44/72/11/348447211.db2.gz LKLCSLFXKQIXSL-LBPRGKRZSA-N 1 2 246.310 2.318 20 0 BEADLO CCC[C@@H]1C[C@H]1Nc1cc(CC(=O)OC)cc[nH+]1 ZINC000596145565 348451283 /nfs/dbraw/zinc/45/12/83/348451283.db2.gz QHUONYWERRPXTC-VXGBXAGGSA-N 1 2 248.326 2.398 20 0 BEADLO CC[C@@H](CSCCn1cc[nH+]c1)OC ZINC000419622051 192142570 /nfs/dbraw/zinc/14/25/70/192142570.db2.gz GEBYFAVBTJYCMN-JTQLQIEISA-N 1 2 214.334 2.041 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N2[C@H](C)CC[C@H]2C)c1 ZINC000596162484 348459887 /nfs/dbraw/zinc/45/98/87/348459887.db2.gz LAWFJGQLTZRZBS-GHMZBOCLSA-N 1 2 248.326 2.174 20 0 BEADLO COC(=O)Cc1cc[nH+]c(NCCC2(C)CC2)c1 ZINC000596221425 348470255 /nfs/dbraw/zinc/47/02/55/348470255.db2.gz GUNHTURVLRHPSK-UHFFFAOYSA-N 1 2 248.326 2.399 20 0 BEADLO COc1cc[nH+]cc1CSCC[C@@H](C)O ZINC000596363893 348526096 /nfs/dbraw/zinc/52/60/96/348526096.db2.gz LPJRPZJMEAFFJG-SECBINFHSA-N 1 2 227.329 2.094 20 0 BEADLO COC(=O)C[C@@H](CNc1cccc[nH+]1)C1CC1 ZINC000596490254 348560365 /nfs/dbraw/zinc/56/03/65/348560365.db2.gz IXSHKARTIGPPMI-NSHDSACASA-N 1 2 234.299 2.083 20 0 BEADLO CCCNC(=O)C[NH2+]C1(C(F)F)CCCCC1 ZINC000352204927 535078668 /nfs/dbraw/zinc/07/86/68/535078668.db2.gz ZHAHUFRNZXTCIR-UHFFFAOYSA-N 1 2 248.317 2.070 20 0 BEADLO Cc1cc(NC(=O)[C@H](C)C(F)(F)F)c(C)c[nH+]1 ZINC000536575221 323198160 /nfs/dbraw/zinc/19/81/60/323198160.db2.gz JFBLGLTUJRLEFE-QMMMGPOBSA-N 1 2 246.232 2.257 20 0 BEADLO Cc1nocc1C[NH2+]Cc1ncc(Cl)s1 ZINC000397893431 362933820 /nfs/dbraw/zinc/93/38/20/362933820.db2.gz HLGIBYSMLABATK-UHFFFAOYSA-N 1 2 243.719 2.383 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@]1(C)C[C@H]2CC[C@@H]1O2 ZINC000191457474 179709979 /nfs/dbraw/zinc/70/99/79/179709979.db2.gz VQMPEVBWTNHSDL-OSMZGAPFSA-N 1 2 246.310 2.286 20 0 BEADLO C[C@@H]([NH2+]Cc1ncccn1)c1cccc(F)c1 ZINC000054459563 349033332 /nfs/dbraw/zinc/03/33/32/349033332.db2.gz SOMICTAADQINJE-SNVBAGLBSA-N 1 2 231.274 2.467 20 0 BEADLO Cc1nc(C)c([C@H](C)[NH2+]Cc2ncccn2)s1 ZINC000054459392 349033719 /nfs/dbraw/zinc/03/37/19/349033719.db2.gz NXOVRTUKYUSLHT-QMMMGPOBSA-N 1 2 248.355 2.401 20 0 BEADLO COC(=O)[C@H]([NH2+]C[C@H]1CCCC1(F)F)C(C)C ZINC000394661568 349091777 /nfs/dbraw/zinc/09/17/77/349091777.db2.gz OQIYEVGTHOLRQI-NXEZZACHSA-N 1 2 249.301 2.209 20 0 BEADLO COC(=O)CCCC[N@@H+]1CCC[C@H]1C(F)F ZINC000599339790 349152361 /nfs/dbraw/zinc/15/23/61/349152361.db2.gz VCQJHHNJTYHUNR-VIFPVBQESA-N 1 2 235.274 2.059 20 0 BEADLO COC(=O)CCCC[N@H+]1CCC[C@H]1C(F)F ZINC000599339790 349152363 /nfs/dbraw/zinc/15/23/63/349152363.db2.gz VCQJHHNJTYHUNR-VIFPVBQESA-N 1 2 235.274 2.059 20 0 BEADLO CC[C@@H](C[NH2+]C(C)(C)C(=O)OC(C)(C)C)OC ZINC000599653335 349234637 /nfs/dbraw/zinc/23/46/37/349234637.db2.gz VELBQWNWKBZSHR-JTQLQIEISA-N 1 2 245.363 2.121 20 0 BEADLO CSCCC[NH2+]C(C)(C)C(=O)OC(C)(C)C ZINC000599660790 349236251 /nfs/dbraw/zinc/23/62/51/349236251.db2.gz ROPREAJEEMNXLQ-UHFFFAOYSA-N 1 2 247.404 2.449 20 0 BEADLO CCOCCC[NH2+]C(C)(C)C(=O)OC(C)(C)C ZINC000599659930 349236399 /nfs/dbraw/zinc/23/63/99/349236399.db2.gz MIEVRYDIGKWAQS-UHFFFAOYSA-N 1 2 245.363 2.123 20 0 BEADLO CCCCc1cc(NC[C@]2(C)CCOC2)nc[nH+]1 ZINC000631117469 349262626 /nfs/dbraw/zinc/26/26/26/349262626.db2.gz JPHYANDYGFLTCO-AWEZNQCLSA-N 1 2 249.358 2.080 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CC[C@@H](C)C[C@@H]2C)c[nH+]1 ZINC000265086700 179887692 /nfs/dbraw/zinc/88/76/92/179887692.db2.gz RYMUVXGOFNHNAK-WCABBAIRSA-N 1 2 235.331 2.273 20 0 BEADLO CC1(C)CCC[C@@H]1C(=O)N1CCn2c[nH+]cc2C1 ZINC000290908887 349313537 /nfs/dbraw/zinc/31/35/37/349313537.db2.gz IPLXUNULEWFAPS-GFCCVEGCSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1nc(N2CC[C@@](C)(F)C2)c(C)c(C)[nH+]1 ZINC000334340985 179906945 /nfs/dbraw/zinc/90/69/45/179906945.db2.gz IFWDSWCXMVADEI-GFCCVEGCSA-N 1 2 223.295 2.340 20 0 BEADLO O=[S@](Cc1cn2ccccc2[nH+]1)CC1CCC1 ZINC000601913658 349378627 /nfs/dbraw/zinc/37/86/27/349378627.db2.gz SZBOLAFUPVKDPF-KRWDZBQOSA-N 1 2 248.351 2.383 20 0 BEADLO CCc1nc(CN[C@H](C)c2[nH]cc[nH+]2)cs1 ZINC000336751610 538049911 /nfs/dbraw/zinc/04/99/11/538049911.db2.gz CJPHZEZHWJDSPU-MRVPVSSYSA-N 1 2 236.344 2.279 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CCC[C@H]2C)[nH+]1 ZINC000336541669 180003099 /nfs/dbraw/zinc/00/30/99/180003099.db2.gz HJMFIEFUCYTRIT-MRVPVSSYSA-N 1 2 216.288 2.255 20 0 BEADLO Cc1nc2[nH]ccc2c(NCCC[C@@H](C)CO)[nH+]1 ZINC000340076119 180017370 /nfs/dbraw/zinc/01/73/70/180017370.db2.gz AECTXRNYAPTGMG-SECBINFHSA-N 1 2 248.330 2.038 20 0 BEADLO CCC[C@H]([NH2+][C@@H]1CCS[C@H]1C)C(=O)OCC ZINC000390748159 362949492 /nfs/dbraw/zinc/94/94/92/362949492.db2.gz BHAZSWAWRMCPGH-AXFHLTTASA-N 1 2 245.388 2.202 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2CCC[C@@H](C)C2)no1 ZINC000335857323 180036240 /nfs/dbraw/zinc/03/62/40/180036240.db2.gz SMOUKDNMFKPWJA-RKDXNWHRSA-N 1 2 209.293 2.171 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2CCC[C@@H](C)C2)no1 ZINC000335857323 180036243 /nfs/dbraw/zinc/03/62/43/180036243.db2.gz SMOUKDNMFKPWJA-RKDXNWHRSA-N 1 2 209.293 2.171 20 0 BEADLO Cc1nc([C@@H](C)[NH2+]Cc2cncn2C)cs1 ZINC000264614406 180037004 /nfs/dbraw/zinc/03/70/04/180037004.db2.gz QHZPPFNSIBWBSS-MRVPVSSYSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CCC(F)(F)[C@@H](C)C2)[nH]1 ZINC000334580768 180047518 /nfs/dbraw/zinc/04/75/18/180047518.db2.gz AZGONDBBFQAAAH-YUMQZZPRSA-N 1 2 244.289 2.151 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CCC(F)(F)[C@@H](C)C2)[nH]1 ZINC000334580768 180047520 /nfs/dbraw/zinc/04/75/20/180047520.db2.gz AZGONDBBFQAAAH-YUMQZZPRSA-N 1 2 244.289 2.151 20 0 BEADLO Cc1nc([C@H]2CCCC[N@@H+]2CCCF)no1 ZINC000363784235 180055014 /nfs/dbraw/zinc/05/50/14/180055014.db2.gz APYIYPRYBXGREV-SNVBAGLBSA-N 1 2 227.283 2.265 20 0 BEADLO Cc1nc([C@H]2CCCC[N@H+]2CCCF)no1 ZINC000363784235 180055015 /nfs/dbraw/zinc/05/50/15/180055015.db2.gz APYIYPRYBXGREV-SNVBAGLBSA-N 1 2 227.283 2.265 20 0 BEADLO Cc1nc(NCCCCCO)c2c([nH+]1)CCCC2 ZINC000279413364 180070852 /nfs/dbraw/zinc/07/08/52/180070852.db2.gz JRLJZVZGQOTBKD-UHFFFAOYSA-N 1 2 249.358 2.238 20 0 BEADLO Cc1nc(NCCC[C@H](C)O)c2c([nH+]1)CCCC2 ZINC000278553385 180070902 /nfs/dbraw/zinc/07/09/02/180070902.db2.gz AHUNDHBEVFUIME-JTQLQIEISA-N 1 2 249.358 2.237 20 0 BEADLO Cc1[nH+]c2ccccn2c1CNCC(F)(F)F ZINC000037184441 180107793 /nfs/dbraw/zinc/10/77/93/180107793.db2.gz ABDSBWKICPUQDR-UHFFFAOYSA-N 1 2 243.232 2.295 20 0 BEADLO Cc1nc2n(n1)CC[N@@H+]([C@H]1C=CCCCCC1)C2 ZINC000292837382 180113536 /nfs/dbraw/zinc/11/35/36/180113536.db2.gz PGTJJFACTHFTMU-ZDUSSCGKSA-N 1 2 246.358 2.291 20 0 BEADLO Cc1nc2n(n1)CC[N@H+]([C@H]1C=CCCCCC1)C2 ZINC000292837382 180113538 /nfs/dbraw/zinc/11/35/38/180113538.db2.gz PGTJJFACTHFTMU-ZDUSSCGKSA-N 1 2 246.358 2.291 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)Nc1cccc(F)c1C ZINC000336536770 180118994 /nfs/dbraw/zinc/11/89/94/180118994.db2.gz DODCSGBZUZVJNP-UHFFFAOYSA-N 1 2 247.273 2.347 20 0 BEADLO Cc1ncc(C[N@@H+]2CCO[C@H]3CCC[C@@H]32)s1 ZINC000299197903 180144355 /nfs/dbraw/zinc/14/43/55/180144355.db2.gz KQTOZLPYAAZHBZ-RYUDHWBXSA-N 1 2 238.356 2.205 20 0 BEADLO Cc1ncc(C[N@H+]2CCO[C@H]3CCC[C@@H]32)s1 ZINC000299197903 180144356 /nfs/dbraw/zinc/14/43/56/180144356.db2.gz KQTOZLPYAAZHBZ-RYUDHWBXSA-N 1 2 238.356 2.205 20 0 BEADLO Cc1ncc(C[N@@H+]2CCO[C@@H](C(C)(C)C)C2)cn1 ZINC000352414145 180143124 /nfs/dbraw/zinc/14/31/24/180143124.db2.gz SJUZYXWVMZWAQR-CYBMUJFWSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1ncc(C[N@H+]2CCO[C@@H](C(C)(C)C)C2)cn1 ZINC000352414145 180143125 /nfs/dbraw/zinc/14/31/25/180143125.db2.gz SJUZYXWVMZWAQR-CYBMUJFWSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1ncc(C[NH2+]Cc2cscn2)s1 ZINC000040997870 180154094 /nfs/dbraw/zinc/15/40/94/180154094.db2.gz IWBTXAWILATOCR-UHFFFAOYSA-N 1 2 225.342 2.198 20 0 BEADLO Cc1ncc(C[NH2+][C@H](C)c2ccon2)s1 ZINC000336770327 180159136 /nfs/dbraw/zinc/15/91/36/180159136.db2.gz WMTMQWAGTQUTLT-SSDOTTSWSA-N 1 2 223.301 2.290 20 0 BEADLO Cc1ncc(C[N@@H+]2CCOC[C@@H]2C2CC2)s1 ZINC000090009696 180144532 /nfs/dbraw/zinc/14/45/32/180144532.db2.gz TUZXPSHZEZXPRZ-GFCCVEGCSA-N 1 2 238.356 2.062 20 0 BEADLO Cc1ncc(C[N@H+]2CCOC[C@@H]2C2CC2)s1 ZINC000090009696 180144535 /nfs/dbraw/zinc/14/45/35/180144535.db2.gz TUZXPSHZEZXPRZ-GFCCVEGCSA-N 1 2 238.356 2.062 20 0 BEADLO Cc1ncc(C[N@H+]2C[C@H](C)OC[C@H]2C)s1 ZINC000250640436 180145923 /nfs/dbraw/zinc/14/59/23/180145923.db2.gz SVBKLHFXSGFWPN-BDAKNGLRSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ncc(C[N@@H+]2C[C@H](C)OC[C@H]2C)s1 ZINC000250640436 180145924 /nfs/dbraw/zinc/14/59/24/180145924.db2.gz SVBKLHFXSGFWPN-BDAKNGLRSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ccc(NC(=O)NCC(F)(F)F)c(C)[nH+]1 ZINC000122854660 191073073 /nfs/dbraw/zinc/07/30/73/191073073.db2.gz YAFVXAWOMUJIRO-UHFFFAOYSA-N 1 2 247.220 2.382 20 0 BEADLO FC(F)(F)C1=CC[N@H+](Cc2cncnc2)CC1 ZINC000334415395 538069181 /nfs/dbraw/zinc/06/91/81/538069181.db2.gz PNHSJVPYQMOQLL-UHFFFAOYSA-N 1 2 243.232 2.171 20 0 BEADLO FC(F)(F)C1=CC[N@@H+](Cc2cncnc2)CC1 ZINC000334415395 538069187 /nfs/dbraw/zinc/06/91/87/538069187.db2.gz PNHSJVPYQMOQLL-UHFFFAOYSA-N 1 2 243.232 2.171 20 0 BEADLO Cc1nc(NCCN(C)c2ccccc2)cc[nH+]1 ZINC000266183294 180197753 /nfs/dbraw/zinc/19/77/53/180197753.db2.gz VWOQLQWWJORROS-UHFFFAOYSA-N 1 2 242.326 2.333 20 0 BEADLO Cc1nc(NCC2(C3CC3)CC2)cc[nH+]1 ZINC000131317819 180198535 /nfs/dbraw/zinc/19/85/35/180198535.db2.gz FXQTURKWUNAVNJ-UHFFFAOYSA-N 1 2 203.289 2.387 20 0 BEADLO Cc1nc(NCCCOCC(C)C)cc[nH+]1 ZINC000229943430 180199360 /nfs/dbraw/zinc/19/93/60/180199360.db2.gz RLMPFJAKAOQUDY-UHFFFAOYSA-N 1 2 223.320 2.260 20 0 BEADLO Cc1ncsc1CCNc1cc[nH+]c(C)n1 ZINC000294987679 180200983 /nfs/dbraw/zinc/20/09/83/180200983.db2.gz MTBXQFQMFNSSLE-UHFFFAOYSA-N 1 2 234.328 2.205 20 0 BEADLO Cc1nc(NC[C@@H]2CCCCS2)cc[nH+]1 ZINC000087685979 180201276 /nfs/dbraw/zinc/20/12/76/180201276.db2.gz RPIYQUBSIFNJPT-JTQLQIEISA-N 1 2 223.345 2.483 20 0 BEADLO Cc1nc(N[C@@H](C)Cc2ccco2)cc[nH+]1 ZINC000054936040 180203633 /nfs/dbraw/zinc/20/36/33/180203633.db2.gz ZZTBGAJFSVVXAX-VIFPVBQESA-N 1 2 217.272 2.421 20 0 BEADLO Cc1nc(N[C@@H]2CCO[C@@H](C(C)C)C2)cc[nH+]1 ZINC000271485278 180203662 /nfs/dbraw/zinc/20/36/62/180203662.db2.gz VCLQJBYKXCYLRS-VXGBXAGGSA-N 1 2 235.331 2.401 20 0 BEADLO Cc1nc(NCc2cn3ccccc3n2)cc[nH+]1 ZINC000301340259 180203679 /nfs/dbraw/zinc/20/36/79/180203679.db2.gz FSMANRVWPWEPDU-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO Cn1cc([C@H]([NH2+]Cc2cocn2)C(C)(C)C)cn1 ZINC000428861293 191078893 /nfs/dbraw/zinc/07/88/93/191078893.db2.gz JSMKVSWRPRRDRG-LBPRGKRZSA-N 1 2 248.330 2.285 20 0 BEADLO Cc1nc(N[C@@H]2[C@H]3CCO[C@H]3C2(C)C)cc[nH+]1 ZINC000266294637 180204600 /nfs/dbraw/zinc/20/46/00/180204600.db2.gz XGIVBHPAOVWNJX-YUSALJHKSA-N 1 2 233.315 2.010 20 0 BEADLO Cc1nc(N[C@H](C)[C@@H]2CCCCO2)cc[nH+]1 ZINC000271915268 180205625 /nfs/dbraw/zinc/20/56/25/180205625.db2.gz BUHSMESIXWDICA-KOLCDFICSA-N 1 2 221.304 2.155 20 0 BEADLO Cc1nc(N[C@H]2CCC[C@@H]3OCC[C@@H]32)cc[nH+]1 ZINC000153261716 180205788 /nfs/dbraw/zinc/20/57/88/180205788.db2.gz NSSODHIHQWXLHR-WOPDTQHZSA-N 1 2 233.315 2.155 20 0 BEADLO Cc1nc(N[C@H]2C[C@H](C)n3ccnc32)cc[nH+]1 ZINC000333657888 180207757 /nfs/dbraw/zinc/20/77/57/180207757.db2.gz GIHCMMGEBDECSS-WPRPVWTQSA-N 1 2 229.287 2.099 20 0 BEADLO Cc1nc(N[C@H]2CCO[C@H](C3CC3)C2)cc[nH+]1 ZINC000185425488 180207939 /nfs/dbraw/zinc/20/79/39/180207939.db2.gz GCWXBCKMRLYABA-RYUDHWBXSA-N 1 2 233.315 2.155 20 0 BEADLO Cc1[nH+]cccc1Cc1nc(C2CC2)no1 ZINC000285378434 180222124 /nfs/dbraw/zinc/22/21/24/180222124.db2.gz OMXKWSSVUBTECT-UHFFFAOYSA-N 1 2 215.256 2.241 20 0 BEADLO Cc1[nH+]cccc1Cc1nc([C@@H]2CCCO2)no1 ZINC000285158160 180223471 /nfs/dbraw/zinc/22/34/71/180223471.db2.gz SCMRPRIXPFGSFV-NSHDSACASA-N 1 2 245.282 2.215 20 0 BEADLO CCOc1nnc(C[N@@H+]2CCC[C@@H](C)C2)s1 ZINC000049982643 350273287 /nfs/dbraw/zinc/27/32/87/350273287.db2.gz AEONGWRHIBFAGD-SECBINFHSA-N 1 2 241.360 2.169 20 0 BEADLO CCOc1nnc(C[N@H+]2CCC[C@@H](C)C2)s1 ZINC000049982643 350273290 /nfs/dbraw/zinc/27/32/90/350273290.db2.gz AEONGWRHIBFAGD-SECBINFHSA-N 1 2 241.360 2.169 20 0 BEADLO Cc1nccnc1NCCCNc1cccc[nH+]1 ZINC000290547306 180276786 /nfs/dbraw/zinc/27/67/86/180276786.db2.gz QARAFUWSWNKVDA-UHFFFAOYSA-N 1 2 243.314 2.094 20 0 BEADLO Cc1nccnc1[C@H](C)[NH2+]Cc1ccco1 ZINC000187680939 180283994 /nfs/dbraw/zinc/28/39/94/180283994.db2.gz XIOFHGHSKZETGO-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO CC(C)(C)c1nsc(-n2cc[nH+]c2)n1 ZINC000083675981 350288145 /nfs/dbraw/zinc/28/81/45/350288145.db2.gz LACVLVYHUIMISB-UHFFFAOYSA-N 1 2 208.290 2.021 20 0 BEADLO CCc1cc(NCc2cccnc2OC)nc[nH+]1 ZINC000040765145 350395061 /nfs/dbraw/zinc/39/50/61/350395061.db2.gz GGHXCKDABXKYFE-UHFFFAOYSA-N 1 2 244.298 2.055 20 0 BEADLO CCc1cc(NCc2cnc(C)s2)nc[nH+]1 ZINC000040998294 350402937 /nfs/dbraw/zinc/40/29/37/350402937.db2.gz URYNFHNAFLWFNZ-UHFFFAOYSA-N 1 2 234.328 2.416 20 0 BEADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cc[nH]n2)o1 ZINC000041014027 350402994 /nfs/dbraw/zinc/40/29/94/350402994.db2.gz UKPUPEWLYHCFKX-CABZTGNLSA-N 1 2 231.299 2.416 20 0 BEADLO Cc1nn(C)c(C)c1N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000293898266 180345111 /nfs/dbraw/zinc/34/51/11/180345111.db2.gz GYXNDEDIXIACTH-LDYMZIIASA-N 1 2 245.330 2.351 20 0 BEADLO Cc1nn(C)c(C)c1CCNc1cccc[nH+]1 ZINC000301128864 180336958 /nfs/dbraw/zinc/33/69/58/180336958.db2.gz YLNNJXHSYHYLNZ-UHFFFAOYSA-N 1 2 230.315 2.087 20 0 BEADLO CCc1cnc(C[N@H+](C)[C@H]2CCCOC2)s1 ZINC000336673305 350431461 /nfs/dbraw/zinc/43/14/61/350431461.db2.gz KOUWWCQLQKBUCK-JTQLQIEISA-N 1 2 240.372 2.316 20 0 BEADLO CCc1cnc(C[N@@H+](C)[C@H]2CCCOC2)s1 ZINC000336673305 350431467 /nfs/dbraw/zinc/43/14/67/350431467.db2.gz KOUWWCQLQKBUCK-JTQLQIEISA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nc(C[N@@H+]2CC[C@@](C)(CC)C2)no1 ZINC000336691836 350448341 /nfs/dbraw/zinc/44/83/41/350448341.db2.gz CKVNGACETLOGFE-GFCCVEGCSA-N 1 2 223.320 2.254 20 0 BEADLO CCc1nc(C[N@H+]2CC[C@@](C)(CC)C2)no1 ZINC000336691836 350448345 /nfs/dbraw/zinc/44/83/45/350448345.db2.gz CKVNGACETLOGFE-GFCCVEGCSA-N 1 2 223.320 2.254 20 0 BEADLO CCc1nc(C)c(C[N@H+]2CCOC[C@H]2CC)o1 ZINC000428225078 191104296 /nfs/dbraw/zinc/10/42/96/191104296.db2.gz MRDGXPASKHWRSL-LLVKDONJSA-N 1 2 238.331 2.156 20 0 BEADLO CCc1nc(C)c(C[N@@H+]2CCOC[C@H]2CC)o1 ZINC000428225078 191104298 /nfs/dbraw/zinc/10/42/98/191104298.db2.gz MRDGXPASKHWRSL-LLVKDONJSA-N 1 2 238.331 2.156 20 0 BEADLO CCC[C@H](C)CC(=O)N[C@@H]1CCn2cc[nH+]c2C1 ZINC000427989992 191104360 /nfs/dbraw/zinc/10/43/60/191104360.db2.gz CBESJTIGBAXDAJ-NWDGAFQWSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1ncc(C[NH2+][C@H](C)c2nccn2C)s1 ZINC000070007965 350491251 /nfs/dbraw/zinc/49/12/51/350491251.db2.gz QAEYHOMOIVSCMW-MRVPVSSYSA-N 1 2 236.344 2.036 20 0 BEADLO CCC[C@@H](CCO)CNc1[nH+]cccc1OC ZINC000227455037 350497222 /nfs/dbraw/zinc/49/72/22/350497222.db2.gz RGZJHCASFOSGFE-NSHDSACASA-N 1 2 238.331 2.301 20 0 BEADLO COc1c(C)[nH+]c(C2CC2)nc1N[C@@H]1CC[C@@H]1C ZINC000580784278 350533783 /nfs/dbraw/zinc/53/37/83/350533783.db2.gz RZEHOYJAHKVSJL-GZMMTYOYSA-N 1 2 247.342 2.303 20 0 BEADLO CC(C)(C)[C@@H]1C[C@@H]([NH2+]Cc2ccn[nH]2)CS1 ZINC000309397261 323372675 /nfs/dbraw/zinc/37/26/75/323372675.db2.gz VQFJPWHTDPOBLO-MNOVXSKESA-N 1 2 239.388 2.420 20 0 BEADLO COc1cc[nH+]cc1NC(=O)CCC(C)(F)F ZINC000623083894 350833500 /nfs/dbraw/zinc/83/35/00/350833500.db2.gz JURTXUQAFMLXAH-UHFFFAOYSA-N 1 2 244.241 2.464 20 0 BEADLO Fc1c[nH+]ccc1NCc1nccs1 ZINC000306734267 350904303 /nfs/dbraw/zinc/90/43/03/350904303.db2.gz UODWRDSBIAKUTP-UHFFFAOYSA-N 1 2 209.249 2.289 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cnc(C)o2)C[C@H](CC)O1 ZINC000628315220 350875463 /nfs/dbraw/zinc/87/54/63/350875463.db2.gz CXQVZTLJBGRGRW-TXEJJXNPSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cnc(C)o2)C[C@H](CC)O1 ZINC000628315220 350875467 /nfs/dbraw/zinc/87/54/67/350875467.db2.gz CXQVZTLJBGRGRW-TXEJJXNPSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1CN(Cc2[nH]cc(C)[nH+]2)C[C@@H](CC)O1 ZINC000628315657 350897217 /nfs/dbraw/zinc/89/72/17/350897217.db2.gz RKBAJSIIYNJNSG-VXGBXAGGSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1ncc(C[NH2+]Cc2ccccc2[N+](=O)[O-])o1 ZINC000397899246 350988449 /nfs/dbraw/zinc/98/84/49/350988449.db2.gz AWKAPGVCBQAGDZ-UHFFFAOYSA-N 1 2 247.254 2.181 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cocn2)cc1[N+](=O)[O-] ZINC000397939844 350993825 /nfs/dbraw/zinc/99/38/25/350993825.db2.gz UGZUCMCINWNHIH-UHFFFAOYSA-N 1 2 247.254 2.181 20 0 BEADLO COc1ccc(C)cc1C[NH2+]Cc1cocn1 ZINC000397968126 350995361 /nfs/dbraw/zinc/99/53/61/350995361.db2.gz LKWSJUPHYAICOI-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO CCCN(CCC)c1cc(-n2cc[nH+]c2)ncn1 ZINC000607142496 350943800 /nfs/dbraw/zinc/94/38/00/350943800.db2.gz VUUWYNDHSYRSQF-UHFFFAOYSA-N 1 2 245.330 2.289 20 0 BEADLO CC1(C)CC([NH2+]Cc2c[nH]nn2)CC(C)(C)C1 ZINC000398351402 351048474 /nfs/dbraw/zinc/04/84/74/351048474.db2.gz FPQCPTJWFNRWJL-UHFFFAOYSA-N 1 2 236.363 2.499 20 0 BEADLO CC1(C)CC([NH2+]Cc2cn[nH]n2)CC(C)(C)C1 ZINC000398351402 351048477 /nfs/dbraw/zinc/04/84/77/351048477.db2.gz FPQCPTJWFNRWJL-UHFFFAOYSA-N 1 2 236.363 2.499 20 0 BEADLO Cc1scc(C(=O)NCc2[nH+]ccn2C)c1C ZINC000271363383 180560957 /nfs/dbraw/zinc/56/09/57/180560957.db2.gz KLYLSCFVESOKEE-UHFFFAOYSA-N 1 2 249.339 2.028 20 0 BEADLO C[C@H](O)C[NH2+]CC(F)(F)c1ccc(Cl)cc1 ZINC000571516316 351075879 /nfs/dbraw/zinc/07/58/79/351075879.db2.gz QOZLEEAFDNLZEQ-QMMMGPOBSA-N 1 2 249.688 2.402 20 0 BEADLO Cc1cc(C)c(C[NH2+]Cc2c[nH]nn2)cc1C ZINC000398369399 351124705 /nfs/dbraw/zinc/12/47/05/351124705.db2.gz QGOXTMVHOSPEBI-UHFFFAOYSA-N 1 2 230.315 2.020 20 0 BEADLO Cc1cc(C)c(C[NH2+]Cc2cn[nH]n2)cc1C ZINC000398369399 351124706 /nfs/dbraw/zinc/12/47/06/351124706.db2.gz QGOXTMVHOSPEBI-UHFFFAOYSA-N 1 2 230.315 2.020 20 0 BEADLO CC(C)C1CCC(C[NH2+]Cc2c[nH]nn2)CC1 ZINC000398421129 351150327 /nfs/dbraw/zinc/15/03/27/351150327.db2.gz YJOXGMVAJIKVMP-UHFFFAOYSA-N 1 2 236.363 2.357 20 0 BEADLO CC(C)C1CCC(C[NH2+]Cc2cn[nH]n2)CC1 ZINC000398421129 351150328 /nfs/dbraw/zinc/15/03/28/351150328.db2.gz YJOXGMVAJIKVMP-UHFFFAOYSA-N 1 2 236.363 2.357 20 0 BEADLO CCSc1cccc(C[NH2+]Cc2cnn[nH]2)c1 ZINC000623578304 363011645 /nfs/dbraw/zinc/01/16/45/363011645.db2.gz BMXVKXPSAXTPJV-UHFFFAOYSA-N 1 2 248.355 2.207 20 0 BEADLO CCSc1cccc(C[NH2+]Cc2c[nH]nn2)c1 ZINC000623578304 363011652 /nfs/dbraw/zinc/01/16/52/363011652.db2.gz BMXVKXPSAXTPJV-UHFFFAOYSA-N 1 2 248.355 2.207 20 0 BEADLO CC[C@@H]1CCC[C@@H]([NH2+]Cc2c[nH]nn2)CC1 ZINC000398415819 351142074 /nfs/dbraw/zinc/14/20/74/351142074.db2.gz SJUMMKZETJTDBA-GHMZBOCLSA-N 1 2 222.336 2.253 20 0 BEADLO CC[C@@H]1CCC[C@@H]([NH2+]Cc2cn[nH]n2)CC1 ZINC000398415819 351142077 /nfs/dbraw/zinc/14/20/77/351142077.db2.gz SJUMMKZETJTDBA-GHMZBOCLSA-N 1 2 222.336 2.253 20 0 BEADLO CCN(Cc1[nH]c(C)c(C)[nH+]1)[C@H]1CCCOC1 ZINC000628324700 351244559 /nfs/dbraw/zinc/24/45/59/351244559.db2.gz FKKPIGXQXHDTPT-LBPRGKRZSA-N 1 2 237.347 2.027 20 0 BEADLO CC[C@@H]([NH2+]Cc1cnns1)c1nccs1 ZINC000379894474 351247042 /nfs/dbraw/zinc/24/70/42/351247042.db2.gz BOJIHZQWRKQANB-MRVPVSSYSA-N 1 2 240.357 2.236 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1cnn(CC)c1 ZINC000265205464 351265307 /nfs/dbraw/zinc/26/53/07/351265307.db2.gz KNZMUQRLIPMNGG-UHFFFAOYSA-N 1 2 244.298 2.113 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)COCC1CC1 ZINC000264978107 351260689 /nfs/dbraw/zinc/26/06/89/351260689.db2.gz GMVHBXOUYPFGEI-UHFFFAOYSA-N 1 2 234.299 2.009 20 0 BEADLO Clc1ccc(NCCCn2cc[nH+]c2)nc1 ZINC000020506400 180583151 /nfs/dbraw/zinc/58/31/51/180583151.db2.gz PKXAPNAOALBQAV-UHFFFAOYSA-N 1 2 236.706 2.434 20 0 BEADLO CC(C)(CNc1ccc2ccccc2[nH+]1)C(N)=O ZINC000225738537 191133124 /nfs/dbraw/zinc/13/31/24/191133124.db2.gz BDBGVUJSHOVRQP-UHFFFAOYSA-N 1 2 243.310 2.158 20 0 BEADLO CC(C)CCc1nc(C[N@H+](C)CCO)cs1 ZINC000264107602 351219825 /nfs/dbraw/zinc/21/98/25/351219825.db2.gz VOKIQFOZBBQZID-UHFFFAOYSA-N 1 2 242.388 2.156 20 0 BEADLO CC(C)CCc1nc(C[N@@H+](C)CCO)cs1 ZINC000264107602 351219828 /nfs/dbraw/zinc/21/98/28/351219828.db2.gz VOKIQFOZBBQZID-UHFFFAOYSA-N 1 2 242.388 2.156 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H]1CCCS1 ZINC000266528065 351292365 /nfs/dbraw/zinc/29/23/65/351292365.db2.gz GJIHHINXYLHKQQ-LLVKDONJSA-N 1 2 236.340 2.478 20 0 BEADLO Cc1c[nH]c(C[NH+]2CC(Cc3ccsc3)C2)n1 ZINC000628361643 351334266 /nfs/dbraw/zinc/33/42/66/351334266.db2.gz OKEADDIHQZJJIO-UHFFFAOYSA-N 1 2 247.367 2.454 20 0 BEADLO c1c[nH+]c(CNCc2nc3c(s2)CCCC3)[nH]1 ZINC000607288132 351296345 /nfs/dbraw/zinc/29/63/45/351296345.db2.gz UGBIRULCRLAMPF-UHFFFAOYSA-N 1 2 248.355 2.035 20 0 BEADLO CC[N@H+](Cc1cc(C)on1)Cc1ccncc1 ZINC000267900556 351323578 /nfs/dbraw/zinc/32/35/78/351323578.db2.gz LEVSHOHRGRCGKL-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1cc(C)on1)Cc1ccncc1 ZINC000267900556 351323582 /nfs/dbraw/zinc/32/35/82/351323582.db2.gz LEVSHOHRGRCGKL-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CCc1cc(N[C@@H]2[C@H]3CCO[C@H]3C2(C)C)nc[nH+]1 ZINC000607356659 351331086 /nfs/dbraw/zinc/33/10/86/351331086.db2.gz XPCNXMRKYOMCTH-RAIGVLPGSA-N 1 2 247.342 2.264 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)CCSC ZINC000265239329 351266123 /nfs/dbraw/zinc/26/61/23/351266123.db2.gz QWSUGISTIOZZEQ-UHFFFAOYSA-N 1 2 224.329 2.336 20 0 BEADLO OC[C@H]1CCN(c2cc3ccccc3c[nH+]2)C1 ZINC000631126381 351368497 /nfs/dbraw/zinc/36/84/97/351368497.db2.gz MNQGEFLCNBXPHT-NSHDSACASA-N 1 2 228.295 2.053 20 0 BEADLO CC(C)c1nc2[nH]ccc2c(NCCCCO)[nH+]1 ZINC000631250416 351386156 /nfs/dbraw/zinc/38/61/56/351386156.db2.gz ITMBQNJIBWLIDI-UHFFFAOYSA-N 1 2 248.330 2.217 20 0 BEADLO CC[N@H+](Cc1ccncc1)[C@H](C)c1nnc(C)o1 ZINC000270971094 351392482 /nfs/dbraw/zinc/39/24/82/351392482.db2.gz CRDLEJYLJLUJHC-SNVBAGLBSA-N 1 2 246.314 2.356 20 0 BEADLO CC[N@@H+](Cc1ccncc1)[C@H](C)c1nnc(C)o1 ZINC000270971094 351392491 /nfs/dbraw/zinc/39/24/91/351392491.db2.gz CRDLEJYLJLUJHC-SNVBAGLBSA-N 1 2 246.314 2.356 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C1(CCOC)CC1 ZINC000269449795 351355794 /nfs/dbraw/zinc/35/57/94/351355794.db2.gz TUARYYLBBPNIRH-UHFFFAOYSA-N 1 2 248.326 2.399 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)c2occc2C)[nH+]1 ZINC000571649044 351411752 /nfs/dbraw/zinc/41/17/52/351411752.db2.gz LIUDZLTXBHBAQH-UHFFFAOYSA-N 1 2 247.298 2.285 20 0 BEADLO Cn1c2cccc(F)c2[nH]c1=[NH+]C1CCC1 ZINC000336713594 180609428 /nfs/dbraw/zinc/60/94/28/180609428.db2.gz UKHHQARZPWAKNS-UHFFFAOYSA-N 1 2 219.263 2.099 20 0 BEADLO c1cc(N2CCCC2)[nH+]cc1NC1CCOCC1 ZINC000036982097 358465316 /nfs/dbraw/zinc/46/53/16/358465316.db2.gz KHAPFFDLHJADFX-UHFFFAOYSA-N 1 2 247.342 2.273 20 0 BEADLO CCCC[N@@H+]1CCNC(=O)[C@@H]1c1cccs1 ZINC000072799046 351577411 /nfs/dbraw/zinc/57/74/11/351577411.db2.gz GRJSOJBLQYELAX-NSHDSACASA-N 1 2 238.356 2.021 20 0 BEADLO CCCC[N@H+]1CCNC(=O)[C@@H]1c1cccs1 ZINC000072799046 351577415 /nfs/dbraw/zinc/57/74/15/351577415.db2.gz GRJSOJBLQYELAX-NSHDSACASA-N 1 2 238.356 2.021 20 0 BEADLO CC(C)COCC[N@@H+]1Cc2cccnc2C1 ZINC000577625103 366024069 /nfs/dbraw/zinc/02/40/69/366024069.db2.gz UPRGLLMFKZMUEP-UHFFFAOYSA-N 1 2 220.316 2.070 20 0 BEADLO CC(C)COCC[N@H+]1Cc2cccnc2C1 ZINC000577625103 366024072 /nfs/dbraw/zinc/02/40/72/366024072.db2.gz UPRGLLMFKZMUEP-UHFFFAOYSA-N 1 2 220.316 2.070 20 0 BEADLO CC(C)CC[C@H](C)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000276445366 351621807 /nfs/dbraw/zinc/62/18/07/351621807.db2.gz AFNBEJIJWIQQSY-MLRMMBSGSA-N 1 2 235.331 2.364 20 0 BEADLO CCc1nc(C)ccc1OCc1c[nH+]cn1C ZINC000276473548 351624557 /nfs/dbraw/zinc/62/45/57/351624557.db2.gz HJYNEONDZDWRON-UHFFFAOYSA-N 1 2 231.299 2.265 20 0 BEADLO CCCC1(CNC(=O)C[NH+]2CC(C)(C)C2)CC1 ZINC000577647659 366030345 /nfs/dbraw/zinc/03/03/45/366030345.db2.gz WHUUXZASTCFDJL-UHFFFAOYSA-N 1 2 238.375 2.025 20 0 BEADLO CC1(C)C[C@@H]1Nc1nc(N)c2ccccc2[nH+]1 ZINC000577719120 366042283 /nfs/dbraw/zinc/04/22/83/366042283.db2.gz FKILOODKSATIIL-JTQLQIEISA-N 1 2 228.299 2.253 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@@H](C)C2)c(F)c1 ZINC000637883003 351750718 /nfs/dbraw/zinc/75/07/18/351750718.db2.gz LCNLVNUIZPINIZ-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@@H](C)C2)c(F)c1 ZINC000637883003 351750722 /nfs/dbraw/zinc/75/07/22/351750722.db2.gz LCNLVNUIZPINIZ-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1nc(N2CCS[C@H](C)C2)c(C)c(C)[nH+]1 ZINC000177824971 366065886 /nfs/dbraw/zinc/06/58/86/366065886.db2.gz QOSASGNEUHOOCR-MRVPVSSYSA-N 1 2 237.372 2.344 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1[C@@H](C)c1cnc(C)nc1C ZINC000637948413 351822110 /nfs/dbraw/zinc/82/21/10/351822110.db2.gz MYMASCVPVXZZSY-WCQYABFASA-N 1 2 249.358 2.265 20 0 BEADLO CC[C@@H]1COCC[N@H+]1[C@@H](C)c1cnc(C)nc1C ZINC000637948413 351822111 /nfs/dbraw/zinc/82/21/11/351822111.db2.gz MYMASCVPVXZZSY-WCQYABFASA-N 1 2 249.358 2.265 20 0 BEADLO C[C@@H]1CCC[C@@H](C(=O)N2CC(n3cc[nH+]c3)C2)C1 ZINC000607651305 351826517 /nfs/dbraw/zinc/82/65/17/351826517.db2.gz PEKHUNVKGNHMLG-VXGBXAGGSA-N 1 2 247.342 2.093 20 0 BEADLO Cc1ncc([C@H](C)[N@@H+]2C[C@H](C)OC[C@@H]2C)c(C)n1 ZINC000637930698 351806824 /nfs/dbraw/zinc/80/68/24/351806824.db2.gz SEGHHGQKCWDMQJ-NHCYSSNCSA-N 1 2 249.358 2.264 20 0 BEADLO Cc1ncc([C@H](C)[N@H+]2C[C@H](C)OC[C@@H]2C)c(C)n1 ZINC000637930698 351806828 /nfs/dbraw/zinc/80/68/28/351806828.db2.gz SEGHHGQKCWDMQJ-NHCYSSNCSA-N 1 2 249.358 2.264 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H](C)OC[C@@H]2C)sn1 ZINC000637930642 351807161 /nfs/dbraw/zinc/80/71/61/351807161.db2.gz QTTARANVTMIOAA-VHSXEESVSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)sn1 ZINC000637930642 351807163 /nfs/dbraw/zinc/80/71/63/351807163.db2.gz QTTARANVTMIOAA-VHSXEESVSA-N 1 2 226.345 2.061 20 0 BEADLO COc1ncc(C[N@H+](C)Cc2ccoc2)s1 ZINC000637966506 351839899 /nfs/dbraw/zinc/83/98/99/351839899.db2.gz RVNSGDYPBLXWSK-UHFFFAOYSA-N 1 2 238.312 2.377 20 0 BEADLO COc1ncc(C[N@@H+](C)Cc2ccoc2)s1 ZINC000637966506 351839902 /nfs/dbraw/zinc/83/99/02/351839902.db2.gz RVNSGDYPBLXWSK-UHFFFAOYSA-N 1 2 238.312 2.377 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cc(C)ns2)C[C@H](C)O1 ZINC000637970041 351845089 /nfs/dbraw/zinc/84/50/89/351845089.db2.gz APAKXFZBVCOMCT-QWRGUYRKSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cc(C)ns2)C[C@H](C)O1 ZINC000637970041 351845091 /nfs/dbraw/zinc/84/50/91/351845091.db2.gz APAKXFZBVCOMCT-QWRGUYRKSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C)ns2)C[C@@H](C)O1 ZINC000637970037 351845175 /nfs/dbraw/zinc/84/51/75/351845175.db2.gz APAKXFZBVCOMCT-GHMZBOCLSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C)ns2)C[C@@H](C)O1 ZINC000637970037 351845178 /nfs/dbraw/zinc/84/51/78/351845178.db2.gz APAKXFZBVCOMCT-GHMZBOCLSA-N 1 2 240.372 2.451 20 0 BEADLO CN(CC(F)F)[C@@H](c1[nH+]ccn1C)C1CC1 ZINC000637972652 351847755 /nfs/dbraw/zinc/84/77/55/351847755.db2.gz CFGMNXXGTUUSQW-SNVBAGLBSA-N 1 2 229.274 2.068 20 0 BEADLO C[N@H+](CC(F)F)CC1CCSCC1 ZINC000637973514 351848389 /nfs/dbraw/zinc/84/83/89/351848389.db2.gz KDHOKKZOZVMRAC-UHFFFAOYSA-N 1 2 209.305 2.327 20 0 BEADLO C[N@@H+](CC(F)F)CC1CCSCC1 ZINC000637973514 351848391 /nfs/dbraw/zinc/84/83/91/351848391.db2.gz KDHOKKZOZVMRAC-UHFFFAOYSA-N 1 2 209.305 2.327 20 0 BEADLO CC[C@@H](C)[C@@H](C[N@H+](C)CC(F)F)OC ZINC000637974491 351850036 /nfs/dbraw/zinc/85/00/36/351850036.db2.gz UZGXYTRIWBWYFS-RKDXNWHRSA-N 1 2 209.280 2.244 20 0 BEADLO CC[C@@H](C)[C@@H](C[N@@H+](C)CC(F)F)OC ZINC000637974491 351850037 /nfs/dbraw/zinc/85/00/37/351850037.db2.gz UZGXYTRIWBWYFS-RKDXNWHRSA-N 1 2 209.280 2.244 20 0 BEADLO c1cc(C[N@@H+]2CCOCC23CCCC3)sn1 ZINC000638148875 352010297 /nfs/dbraw/zinc/01/02/97/352010297.db2.gz NNDAJMLIIIFKNW-UHFFFAOYSA-N 1 2 238.356 2.288 20 0 BEADLO c1cc(C[N@H+]2CCOCC23CCCC3)sn1 ZINC000638148875 352010300 /nfs/dbraw/zinc/01/03/00/352010300.db2.gz NNDAJMLIIIFKNW-UHFFFAOYSA-N 1 2 238.356 2.288 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2ccns2)CCO1 ZINC000638096698 351977013 /nfs/dbraw/zinc/97/70/13/351977013.db2.gz QMQGFQJNHDCVKE-SNVBAGLBSA-N 1 2 226.345 2.144 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2ccns2)CCO1 ZINC000638096698 351977016 /nfs/dbraw/zinc/97/70/16/351977016.db2.gz QMQGFQJNHDCVKE-SNVBAGLBSA-N 1 2 226.345 2.144 20 0 BEADLO C[C@H]1[N@H+](Cc2ccns2)CCOC1(C)C ZINC000638097710 351977196 /nfs/dbraw/zinc/97/71/96/351977196.db2.gz ZHHQRHSVJJABPM-SECBINFHSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@H]1[N@@H+](Cc2ccns2)CCOC1(C)C ZINC000638097710 351977200 /nfs/dbraw/zinc/97/72/00/351977200.db2.gz ZHHQRHSVJJABPM-SECBINFHSA-N 1 2 226.345 2.142 20 0 BEADLO CC(C)Cc1noc([C@H]([NH3+])c2ccccc2)n1 ZINC000021808543 187592133 /nfs/dbraw/zinc/59/21/33/187592133.db2.gz ZUYGPZKHWAJIPX-GFCCVEGCSA-N 1 2 231.299 2.316 20 0 BEADLO CC1(C)CC[C@H]1NC(=O)c1ccc2[nH+]ccn2c1 ZINC000286962025 352108660 /nfs/dbraw/zinc/10/86/60/352108660.db2.gz FXHDLNOAQBCTHX-LLVKDONJSA-N 1 2 243.310 2.253 20 0 BEADLO CCCC[C@H](C)N(C)C(=O)CCc1[nH]cc[nH+]1 ZINC000291152478 352263860 /nfs/dbraw/zinc/26/38/60/352263860.db2.gz FYHNWDGNJQNJPX-NSHDSACASA-N 1 2 237.347 2.379 20 0 BEADLO CC(C)CSc1[nH+]cnc2c1cnn2C ZINC000073324559 352266305 /nfs/dbraw/zinc/26/63/05/352266305.db2.gz BRHNDMYJIUOMMM-UHFFFAOYSA-N 1 2 222.317 2.111 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccns2)C2(CCC2)CO1 ZINC000630072910 363156054 /nfs/dbraw/zinc/15/60/54/363156054.db2.gz MIYCQNQZENFWDS-JTQLQIEISA-N 1 2 238.356 2.287 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccns2)C2(CCC2)CO1 ZINC000630072910 363156057 /nfs/dbraw/zinc/15/60/57/363156057.db2.gz MIYCQNQZENFWDS-JTQLQIEISA-N 1 2 238.356 2.287 20 0 BEADLO C[C@]1(C2CC2)C[N@H+](Cc2ccns2)CCO1 ZINC000630075975 363162576 /nfs/dbraw/zinc/16/25/76/363162576.db2.gz JLTRPYWPJJRZTL-GFCCVEGCSA-N 1 2 238.356 2.144 20 0 BEADLO C[C@]1(C2CC2)C[N@@H+](Cc2ccns2)CCO1 ZINC000630075975 363162579 /nfs/dbraw/zinc/16/25/79/363162579.db2.gz JLTRPYWPJJRZTL-GFCCVEGCSA-N 1 2 238.356 2.144 20 0 BEADLO CCCC[C@H](C)N(C)C(=O)Cc1[nH]c[nH+]c1C ZINC000291934519 352295927 /nfs/dbraw/zinc/29/59/27/352295927.db2.gz CJBRRYBLITYSIS-JTQLQIEISA-N 1 2 237.347 2.298 20 0 BEADLO Cc1cc(NC(=O)[C@H](C)CC(F)F)cc[nH+]1 ZINC000411199286 191169631 /nfs/dbraw/zinc/16/96/31/191169631.db2.gz KJZROTNBKXNQSM-SSDOTTSWSA-N 1 2 228.242 2.042 20 0 BEADLO Cn1ccc(C[NH2+]Cc2sccc2Cl)n1 ZINC000336688305 180702553 /nfs/dbraw/zinc/70/25/53/180702553.db2.gz LNSLVVRTZMBJQL-UHFFFAOYSA-N 1 2 241.747 2.425 20 0 BEADLO CC1(C)CCC[C@H]1CNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000294118180 352369723 /nfs/dbraw/zinc/36/97/23/352369723.db2.gz KHCWMRVURVJSAG-QRGHLMKCSA-N 1 2 247.342 2.365 20 0 BEADLO CC(C)[C@H](NC(=O)[C@H]1CC1(C)C)c1[nH]cc[nH+]1 ZINC000276716390 187687109 /nfs/dbraw/zinc/68/71/09/187687109.db2.gz RRDAKJFACNPOLJ-ZJUUUORDSA-N 1 2 235.331 2.269 20 0 BEADLO Cc1ccc(N[C@H](C)Cn2cccn2)c[nH+]1 ZINC000138844927 191183040 /nfs/dbraw/zinc/18/30/40/191183040.db2.gz XJWUVQNITURNGA-LLVKDONJSA-N 1 2 216.288 2.087 20 0 BEADLO CC(C)(C)OC(=O)C1C[NH+](Cc2ccco2)C1 ZINC000297508430 187701244 /nfs/dbraw/zinc/70/12/44/187701244.db2.gz VQRQMLWIVHGULY-UHFFFAOYSA-N 1 2 237.299 2.053 20 0 BEADLO C[C@@H]1CCC[N@@H+]1Cn1ccc(Br)n1 ZINC000307574450 352658448 /nfs/dbraw/zinc/65/84/48/352658448.db2.gz HEGRDTFZIKZMQE-MRVPVSSYSA-N 1 2 244.136 2.087 20 0 BEADLO C[C@@H]1CCC[N@H+]1Cn1ccc(Br)n1 ZINC000307574450 352658450 /nfs/dbraw/zinc/65/84/50/352658450.db2.gz HEGRDTFZIKZMQE-MRVPVSSYSA-N 1 2 244.136 2.087 20 0 BEADLO CC[C@@](C)(CNc1ccc(N(C)C)c[nH+]1)OC ZINC000638760736 352695033 /nfs/dbraw/zinc/69/50/33/352695033.db2.gz UHRIILATZZFGHB-ZDUSSCGKSA-N 1 2 237.347 2.375 20 0 BEADLO CO[C@](C)(CNc1ccc(N(C)C)c[nH+]1)C1CC1 ZINC000638759893 352697220 /nfs/dbraw/zinc/69/72/20/352697220.db2.gz MWDSMLSTJPFZFD-CQSZACIVSA-N 1 2 249.358 2.375 20 0 BEADLO Cc1ccc(N[C@H](C)C[C@H]2CCCC(=O)N2)c[nH+]1 ZINC000638762757 352701325 /nfs/dbraw/zinc/70/13/25/352701325.db2.gz ZJVAYBONNKVSSB-VXGBXAGGSA-N 1 2 247.342 2.249 20 0 BEADLO CC[N@H+](Cc1ccnn1C)Cc1occc1C ZINC000412025032 191239297 /nfs/dbraw/zinc/23/92/97/191239297.db2.gz HDVWMUHABMEVSM-UHFFFAOYSA-N 1 2 233.315 2.344 20 0 BEADLO CC[N@@H+](Cc1ccnn1C)Cc1occc1C ZINC000412025032 191239299 /nfs/dbraw/zinc/23/92/99/191239299.db2.gz HDVWMUHABMEVSM-UHFFFAOYSA-N 1 2 233.315 2.344 20 0 BEADLO COc1ccc(NC2CC(n3cccn3)C2)[nH+]c1 ZINC000638774092 352715500 /nfs/dbraw/zinc/71/55/00/352715500.db2.gz CZLIPCKCDRODBJ-UHFFFAOYSA-N 1 2 244.298 2.102 20 0 BEADLO Cc1nc(N2CCC[C@@H]2C2CC2)cc[nH+]1 ZINC000608082661 352746831 /nfs/dbraw/zinc/74/68/31/352746831.db2.gz JWLZURDSNYPZGX-LLVKDONJSA-N 1 2 203.289 2.164 20 0 BEADLO c1cn([C@@H]2CCCN(c3ccccn3)C2)c[nH+]1 ZINC000608083268 352755786 /nfs/dbraw/zinc/75/57/86/352755786.db2.gz UHDILOPZLXVAGW-GFCCVEGCSA-N 1 2 228.299 2.120 20 0 BEADLO C[C@H]1CN(C)CC[N@@H+]1C/C=C/c1ccccc1 ZINC000334212305 352810356 /nfs/dbraw/zinc/81/03/56/352810356.db2.gz ZXRPSVBXAXSQBX-MRZGDXHCSA-N 1 2 230.355 2.336 20 0 BEADLO C[C@H]1c2ccccc2C[N@H+]1Cc1ccn(C)n1 ZINC000334217597 352818486 /nfs/dbraw/zinc/81/84/86/352818486.db2.gz WZEOKVFEHHAAEU-NSHDSACASA-N 1 2 227.311 2.497 20 0 BEADLO C[C@H]1c2ccccc2C[N@@H+]1Cc1ccn(C)n1 ZINC000334217597 352818492 /nfs/dbraw/zinc/81/84/92/352818492.db2.gz WZEOKVFEHHAAEU-NSHDSACASA-N 1 2 227.311 2.497 20 0 BEADLO Cc1nocc1C[N@@H+]1CCO[C@@H](c2ccco2)C1 ZINC000334188495 352777896 /nfs/dbraw/zinc/77/78/96/352777896.db2.gz HMHFKWPHVUNGNO-CYBMUJFWSA-N 1 2 248.282 2.150 20 0 BEADLO Cc1nocc1C[N@H+]1CCO[C@@H](c2ccco2)C1 ZINC000334188495 352777899 /nfs/dbraw/zinc/77/78/99/352777899.db2.gz HMHFKWPHVUNGNO-CYBMUJFWSA-N 1 2 248.282 2.150 20 0 BEADLO Cc1cc(N2CC3(CCC3(F)F)C2)nc[nH+]1 ZINC000334195251 352787421 /nfs/dbraw/zinc/78/74/21/352787421.db2.gz WLIVSIVJKOUQFU-UHFFFAOYSA-N 1 2 225.242 2.021 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CCC2(CCOCC2)CC1 ZINC000334199366 352791322 /nfs/dbraw/zinc/79/13/22/352791322.db2.gz PFAWSKMIZIFALX-UHFFFAOYSA-N 1 2 249.358 2.111 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CC[C@](C)(F)C1 ZINC000334199752 352792570 /nfs/dbraw/zinc/79/25/70/352792570.db2.gz MPYVEEJHAYNEFS-LBPRGKRZSA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1ccnc1C[N@@H+]1CC[C@](C)(F)C1 ZINC000334199752 352792573 /nfs/dbraw/zinc/79/25/73/352792573.db2.gz MPYVEEJHAYNEFS-LBPRGKRZSA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1ccnc1C[N@H+]1CC[C@](C)(F)C1 ZINC000334199752 352792576 /nfs/dbraw/zinc/79/25/76/352792576.db2.gz MPYVEEJHAYNEFS-LBPRGKRZSA-N 1 2 225.311 2.398 20 0 BEADLO CCC(C)(C)C(=O)N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000334202838 352796008 /nfs/dbraw/zinc/79/60/08/352796008.db2.gz PHFOTWHWZQVVFK-NSHDSACASA-N 1 2 249.358 2.172 20 0 BEADLO CC(F)(F)CC(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000334246419 352837279 /nfs/dbraw/zinc/83/72/79/352837279.db2.gz IDQHIFDNAORESL-QMMMGPOBSA-N 1 2 243.257 2.119 20 0 BEADLO O=C(C[C@@H]1C=CCC1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000334248025 352839766 /nfs/dbraw/zinc/83/97/66/352839766.db2.gz OKWALANASWPOHD-NEPJUHHUSA-N 1 2 245.326 2.430 20 0 BEADLO CO[C@H](CNc1cc2cc[nH]c2c[nH+]1)CC(C)C ZINC000642278465 363198900 /nfs/dbraw/zinc/19/89/00/363198900.db2.gz SENAQSWLTLRUFI-LBPRGKRZSA-N 1 2 247.342 2.458 20 0 BEADLO Cc1nc(N2CC[C@H](c3ccco3)C2)cc[nH+]1 ZINC000608085804 352918944 /nfs/dbraw/zinc/91/89/44/352918944.db2.gz JHLSOSJTAHNUKH-NSHDSACASA-N 1 2 229.283 2.372 20 0 BEADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cc[nH]n2)on1 ZINC000334352133 352987484 /nfs/dbraw/zinc/98/74/84/352987484.db2.gz GVKJCSOBIZWEDL-NSHDSACASA-N 1 2 232.287 2.043 20 0 BEADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cc[nH]n2)on1 ZINC000334352133 352987486 /nfs/dbraw/zinc/98/74/86/352987486.db2.gz GVKJCSOBIZWEDL-NSHDSACASA-N 1 2 232.287 2.043 20 0 BEADLO Cn1ncc(C[N@@H+]2CCC[C@@H]2c2ccsc2)n1 ZINC000289778778 180816367 /nfs/dbraw/zinc/81/63/67/180816367.db2.gz KUWPXGSNUKVIOZ-GFCCVEGCSA-N 1 2 248.355 2.214 20 0 BEADLO Cn1ncc(C[N@H+]2CCC[C@@H]2c2ccsc2)n1 ZINC000289778778 180816368 /nfs/dbraw/zinc/81/63/68/180816368.db2.gz KUWPXGSNUKVIOZ-GFCCVEGCSA-N 1 2 248.355 2.214 20 0 BEADLO CN(C(=O)CCc1[nH]cc[nH+]1)c1ccc(F)cc1 ZINC000343082692 352956028 /nfs/dbraw/zinc/95/60/28/352956028.db2.gz YJCCVLFEEODHFN-UHFFFAOYSA-N 1 2 247.273 2.144 20 0 BEADLO CCC[C@H](C[N@@H+]1CCC(F)(F)C1)OC ZINC000638841958 353017997 /nfs/dbraw/zinc/01/79/97/353017997.db2.gz HPXFECUWULAPFU-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CCC[C@H](C[N@H+]1CCC(F)(F)C1)OC ZINC000638841958 353017998 /nfs/dbraw/zinc/01/79/98/353017998.db2.gz HPXFECUWULAPFU-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CC[C@@H](C)[C@@H](C[N@@H+]1CCC(F)(F)C1)OC ZINC000638842358 353018592 /nfs/dbraw/zinc/01/85/92/353018592.db2.gz PXPNIUUTXXAENI-NXEZZACHSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@@H](C)[C@@H](C[N@H+]1CCC(F)(F)C1)OC ZINC000638842358 353018594 /nfs/dbraw/zinc/01/85/94/353018594.db2.gz PXPNIUUTXXAENI-NXEZZACHSA-N 1 2 221.291 2.389 20 0 BEADLO COC1C[NH+](Cc2ccc(F)c3cccnc23)C1 ZINC000334375311 353030681 /nfs/dbraw/zinc/03/06/81/353030681.db2.gz DKHSVJDAZCXNNN-UHFFFAOYSA-N 1 2 246.285 2.205 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@H](C(C)C)C2)sn1 ZINC000638910578 353074632 /nfs/dbraw/zinc/07/46/32/353074632.db2.gz ACXGXRUHZSVWFD-LBPRGKRZSA-N 1 2 240.372 2.308 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@H](C(C)C)C2)sn1 ZINC000638910578 353074634 /nfs/dbraw/zinc/07/46/34/353074634.db2.gz ACXGXRUHZSVWFD-LBPRGKRZSA-N 1 2 240.372 2.308 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1nc(C)c(C)o1 ZINC000334429624 353104630 /nfs/dbraw/zinc/10/46/30/353104630.db2.gz ZFGSLPLYZPYOCR-BXKDBHETSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1nc(C)c(C)o1 ZINC000334429624 353104631 /nfs/dbraw/zinc/10/46/31/353104631.db2.gz ZFGSLPLYZPYOCR-BXKDBHETSA-N 1 2 238.331 2.291 20 0 BEADLO Cn1c[nH+]cc1CCC(=O)Nc1ccsc1 ZINC000189899038 188002190 /nfs/dbraw/zinc/00/21/90/188002190.db2.gz WDOWCLXRBUFQCW-UHFFFAOYSA-N 1 2 235.312 2.053 20 0 BEADLO C/C=C/C=C/C(=O)NCCCNc1cccc[nH+]1 ZINC000136198303 187985841 /nfs/dbraw/zinc/98/58/41/187985841.db2.gz RJNHWQPQXFMIRC-DSXPNFDZSA-N 1 2 245.326 2.132 20 0 BEADLO C/C=C/C[C@H]([NH2+]C1CC(C)C1)C(=O)OCC ZINC000336781255 188008012 /nfs/dbraw/zinc/00/80/12/188008012.db2.gz UEVIXANQVTYDQS-CXDXVQSMSA-N 1 2 225.332 2.272 20 0 BEADLO OCc1ccccc1-c1cccc2[nH+]ccn21 ZINC000061895379 188013176 /nfs/dbraw/zinc/01/31/76/188013176.db2.gz QMGYAJQXRNPXSH-UHFFFAOYSA-N 1 2 224.263 2.494 20 0 BEADLO CC(C)c1nc(N2CCC[C@H](CO)CC2)cc[nH+]1 ZINC000338826971 188017752 /nfs/dbraw/zinc/01/77/52/188017752.db2.gz DORJQNUIYFWXDU-LBPRGKRZSA-N 1 2 249.358 2.199 20 0 BEADLO CC(C)c1ccoc1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000339935303 188020520 /nfs/dbraw/zinc/02/05/20/188020520.db2.gz DPNJOGFBZDJHCA-UHFFFAOYSA-N 1 2 247.298 2.398 20 0 BEADLO CCC1(C(=O)NCc2[nH+]ccn2C)CCCCC1 ZINC000274132037 188027579 /nfs/dbraw/zinc/02/75/79/188027579.db2.gz IOAARFISTGQMTM-UHFFFAOYSA-N 1 2 249.358 2.397 20 0 BEADLO C/C=C/C[C@@H](CO)Nc1cc[nH+]c(C2CC2)n1 ZINC000274518119 188027754 /nfs/dbraw/zinc/02/77/54/188027754.db2.gz WALMVFCUEYDCKC-VUDBWIFFSA-N 1 2 233.315 2.093 20 0 BEADLO CC1(C)C[C@H]1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000283091499 188033620 /nfs/dbraw/zinc/03/36/20/188033620.db2.gz QPISYHPAPZCEAJ-JTQLQIEISA-N 1 2 229.283 2.319 20 0 BEADLO Cc1c[nH]nc1NC(=O)Nc1c(C)cc[nH+]c1C ZINC000287385721 188035421 /nfs/dbraw/zinc/03/54/21/188035421.db2.gz CKLNTBUWOMEPTA-UHFFFAOYSA-N 1 2 245.286 2.374 20 0 BEADLO CC(C)C(=O)CC[N@H+](C)Cc1nccs1 ZINC000290356641 188035915 /nfs/dbraw/zinc/03/59/15/188035915.db2.gz QLYVDJRZKLQRST-UHFFFAOYSA-N 1 2 226.345 2.190 20 0 BEADLO CC(C)C(=O)CC[N@@H+](C)Cc1nccs1 ZINC000290356641 188035917 /nfs/dbraw/zinc/03/59/17/188035917.db2.gz QLYVDJRZKLQRST-UHFFFAOYSA-N 1 2 226.345 2.190 20 0 BEADLO CC(C)[C@H](C)N(C(=O)CCn1cc[nH+]c1)C1CC1 ZINC000299663975 188043355 /nfs/dbraw/zinc/04/33/55/188043355.db2.gz NTKUHRNWGMVTIT-LBPRGKRZSA-N 1 2 249.358 2.309 20 0 BEADLO COc1ccc[nH+]c1NCCC[C@H]1CCOC1 ZINC000402292372 353234682 /nfs/dbraw/zinc/23/46/82/353234682.db2.gz NKEDSCWFYYGKSP-NSHDSACASA-N 1 2 236.315 2.319 20 0 BEADLO CC(C)[C@@H](C)N(C)c1nc[nH+]c(N)c1Cl ZINC000232719533 353268993 /nfs/dbraw/zinc/26/89/93/353268993.db2.gz GPNYRIVQUQBRAR-SSDOTTSWSA-N 1 2 228.727 2.193 20 0 BEADLO CC(C)[C@@H](C)N(C)c1[nH+]cnc(N)c1Cl ZINC000232719533 353268998 /nfs/dbraw/zinc/26/89/98/353268998.db2.gz GPNYRIVQUQBRAR-SSDOTTSWSA-N 1 2 228.727 2.193 20 0 BEADLO CN(c1cc[nH+]c2ccncc21)[C@@H]1CCCOC1 ZINC000343268461 353281045 /nfs/dbraw/zinc/28/10/45/353281045.db2.gz DYQSCPPJQTYKLC-LLVKDONJSA-N 1 2 243.310 2.245 20 0 BEADLO CCOC(=O)c1coc(C[NH2+]Cc2ccco2)c1 ZINC000353909411 188234157 /nfs/dbraw/zinc/23/41/57/188234157.db2.gz APRZXOYZHQGPFE-UHFFFAOYSA-N 1 2 249.266 2.339 20 0 BEADLO COc1ccc(N[C@H]2CCO[C@@H](C)C2)[nH+]c1 ZINC000225835363 538114139 /nfs/dbraw/zinc/11/41/39/538114139.db2.gz IJFYJMCQQVCPDW-UWVGGRQHSA-N 1 2 222.288 2.070 20 0 BEADLO CCN(C[C@@H](C)O)c1cc(C)[nH+]c(C(C)C)n1 ZINC000343279318 353317891 /nfs/dbraw/zinc/31/78/91/353317891.db2.gz XPRXCDVIEDBDCG-LLVKDONJSA-N 1 2 237.347 2.116 20 0 BEADLO CCN(C[C@H](C)O)c1cc(C)[nH+]c(C(C)C)n1 ZINC000343279319 353317903 /nfs/dbraw/zinc/31/79/03/353317903.db2.gz XPRXCDVIEDBDCG-NSHDSACASA-N 1 2 237.347 2.116 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2ccns2)cn1 ZINC000639043112 353326383 /nfs/dbraw/zinc/32/63/83/353326383.db2.gz PHTWJSNKVGJHOT-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2ccns2)cn1 ZINC000639043112 353326387 /nfs/dbraw/zinc/32/63/87/353326387.db2.gz PHTWJSNKVGJHOT-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO CCO[C@H]1C[C@H]1[NH2+]Cc1ncc(Cl)s1 ZINC000308496343 353357567 /nfs/dbraw/zinc/35/75/67/353357567.db2.gz DIKXYUYAJBHIDR-RQJHMYQMSA-N 1 2 232.736 2.064 20 0 BEADLO CC(C)C[C@H](CO)Nc1cc[nH+]c(C2CC2)n1 ZINC000112558195 188327544 /nfs/dbraw/zinc/32/75/44/188327544.db2.gz OMMYUKOVTLRNLX-LLVKDONJSA-N 1 2 235.331 2.173 20 0 BEADLO C=Cn1cc(C[NH2+]C(C)(C)c2nccs2)cn1 ZINC000194317958 188351676 /nfs/dbraw/zinc/35/16/76/188351676.db2.gz QCJMFCPOCPJFMY-UHFFFAOYSA-N 1 2 248.355 2.465 20 0 BEADLO Cn1c[nH+]cc1CCC(=O)NC1(C)CCCCC1 ZINC000192840508 188352358 /nfs/dbraw/zinc/35/23/58/188352358.db2.gz AHEUQXDLATZEBX-UHFFFAOYSA-N 1 2 249.358 2.192 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)NCC(F)(F)F ZINC000302578191 188354411 /nfs/dbraw/zinc/35/44/11/188354411.db2.gz BWNDDWYDZYDBLB-UHFFFAOYSA-N 1 2 247.220 2.382 20 0 BEADLO OC[C@@]1(F)CC[N@H+](Cc2cc(Cl)cs2)C1 ZINC000334508969 353397577 /nfs/dbraw/zinc/39/75/77/353397577.db2.gz NFGHWASQLFOFAX-SNVBAGLBSA-N 1 2 249.738 2.308 20 0 BEADLO OC[C@@]1(F)CC[N@@H+](Cc2cc(Cl)cs2)C1 ZINC000334508969 353397578 /nfs/dbraw/zinc/39/75/78/353397578.db2.gz NFGHWASQLFOFAX-SNVBAGLBSA-N 1 2 249.738 2.308 20 0 BEADLO Cc1nc(N(C)Cc2cccs2)cc[nH+]1 ZINC000266120552 188372126 /nfs/dbraw/zinc/37/21/26/188372126.db2.gz MMOZBPOVBLYGSB-UHFFFAOYSA-N 1 2 219.313 2.483 20 0 BEADLO COc1ccc(CN(C)c2cc[nH+]c(C)n2)cc1 ZINC000266155016 188372383 /nfs/dbraw/zinc/37/23/83/188372383.db2.gz UXXNULHVPBBCFI-UHFFFAOYSA-N 1 2 243.310 2.430 20 0 BEADLO CC(C)=CC(=O)N1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000268372479 188373915 /nfs/dbraw/zinc/37/39/15/188373915.db2.gz KMCMZNJCWGMLHA-OLZOCXBDSA-N 1 2 247.342 2.259 20 0 BEADLO Cc1cccc([S@@](=O)Cc2c[nH+]cn2C)c1 ZINC000268249111 188374379 /nfs/dbraw/zinc/37/43/79/188374379.db2.gz ZBEGGNKYWMHDCT-INIZCTEOSA-N 1 2 234.324 2.036 20 0 BEADLO CC(C)([NH2+]Cc1nccc(N)n1)c1ccccc1 ZINC000269674160 188374720 /nfs/dbraw/zinc/37/47/20/188374720.db2.gz BPAAXBQMVBDPTR-UHFFFAOYSA-N 1 2 242.326 2.084 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2ccns2)n1 ZINC000639086261 353426216 /nfs/dbraw/zinc/42/62/16/353426216.db2.gz RKMVBALYUBPFNM-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2ccns2)n1 ZINC000639086261 353426219 /nfs/dbraw/zinc/42/62/19/353426219.db2.gz RKMVBALYUBPFNM-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO c1[nH]nnc1C[NH2+][C@H]1CCCC12CCCC2 ZINC000398346372 363223612 /nfs/dbraw/zinc/22/36/12/363223612.db2.gz MXMMBDZLONCDJL-NSHDSACASA-N 1 2 220.320 2.007 20 0 BEADLO c1n[nH]nc1C[NH2+][C@H]1CCCC12CCCC2 ZINC000398346372 363223618 /nfs/dbraw/zinc/22/36/18/363223618.db2.gz MXMMBDZLONCDJL-NSHDSACASA-N 1 2 220.320 2.007 20 0 BEADLO Fc1cc2ncnc(-n3cc[nH+]c3)c2cc1F ZINC000359678724 180957380 /nfs/dbraw/zinc/95/73/80/180957380.db2.gz IBZAGDOQMACWNK-UHFFFAOYSA-N 1 2 232.193 2.094 20 0 BEADLO Cc1nc(N2CC(C)(C)[C@@H]2[C@@H]2CCCO2)cc[nH+]1 ZINC000291141928 188390411 /nfs/dbraw/zinc/39/04/11/188390411.db2.gz OANZEDYVNUMNDI-AAEUAGOBSA-N 1 2 247.342 2.179 20 0 BEADLO CC[C@@]1(C)C[N@H+](Cc2ccns2)CCO1 ZINC000639089032 353445214 /nfs/dbraw/zinc/44/52/14/353445214.db2.gz BUQQVOOWMRJHGT-NSHDSACASA-N 1 2 226.345 2.144 20 0 BEADLO CC[C@@]1(C)C[N@@H+](Cc2ccns2)CCO1 ZINC000639089032 353445215 /nfs/dbraw/zinc/44/52/15/353445215.db2.gz BUQQVOOWMRJHGT-NSHDSACASA-N 1 2 226.345 2.144 20 0 BEADLO Cc1ccnc(Cl)c1OCc1c[nH+]cn1C ZINC000272384955 188376957 /nfs/dbraw/zinc/37/69/57/188376957.db2.gz SQUXQUXAYGLFAB-UHFFFAOYSA-N 1 2 237.690 2.356 20 0 BEADLO C[C@H]1COc2ccccc2C[N@@H+]1Cc1cc[nH]n1 ZINC000272993794 188377181 /nfs/dbraw/zinc/37/71/81/188377181.db2.gz XRGXJBKQDVFABC-NSHDSACASA-N 1 2 243.310 2.193 20 0 BEADLO C[C@H]1COc2ccccc2C[N@H+]1Cc1cc[nH]n1 ZINC000272993794 188377182 /nfs/dbraw/zinc/37/71/82/188377182.db2.gz XRGXJBKQDVFABC-NSHDSACASA-N 1 2 243.310 2.193 20 0 BEADLO Cc1ccc(Cc2noc([C@@H]3CCCO3)n2)c[nH+]1 ZINC000273863437 188378509 /nfs/dbraw/zinc/37/85/09/188378509.db2.gz DWVWGINUKSLQTR-NSHDSACASA-N 1 2 245.282 2.215 20 0 BEADLO COC(=O)[C@H](c1ccccc1)[N@@H+]1C[C@@H](C)[C@@H]1C ZINC000292886117 188391467 /nfs/dbraw/zinc/39/14/67/188391467.db2.gz CMSLCXFQSPAARE-MDZLAQPJSA-N 1 2 233.311 2.241 20 0 BEADLO COC(=O)[C@H](c1ccccc1)[N@H+]1C[C@@H](C)[C@@H]1C ZINC000292886117 188391469 /nfs/dbraw/zinc/39/14/69/188391469.db2.gz CMSLCXFQSPAARE-MDZLAQPJSA-N 1 2 233.311 2.241 20 0 BEADLO CC[C@]1(C)C[N@H+](Cc2cc(C)ns2)CCO1 ZINC000639092176 353454329 /nfs/dbraw/zinc/45/43/29/353454329.db2.gz YCOKKPBWPJCPRE-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO CC[C@]1(C)C[N@@H+](Cc2cc(C)ns2)CCO1 ZINC000639092176 353454330 /nfs/dbraw/zinc/45/43/30/353454330.db2.gz YCOKKPBWPJCPRE-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO Cc1nc(F)ccc1C[N@@H+]1CCOCC1(C)C ZINC000278474477 188382404 /nfs/dbraw/zinc/38/24/04/188382404.db2.gz RCNRZILEEBEZER-UHFFFAOYSA-N 1 2 238.306 2.140 20 0 BEADLO Cc1nc(F)ccc1C[N@H+]1CCOCC1(C)C ZINC000278474477 188382406 /nfs/dbraw/zinc/38/24/06/188382406.db2.gz RCNRZILEEBEZER-UHFFFAOYSA-N 1 2 238.306 2.140 20 0 BEADLO CC(C)(C)[C@H]1CCCN(C(=O)Cn2cc[nH+]c2)C1 ZINC000279887820 188383246 /nfs/dbraw/zinc/38/32/46/188383246.db2.gz AHJNNVSEPYAOGK-LBPRGKRZSA-N 1 2 249.358 2.168 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccns2)[C@H](C)[C@@H](C)O1 ZINC000639085883 353433386 /nfs/dbraw/zinc/43/33/86/353433386.db2.gz MBVFMRJHFWOKOK-OPRDCNLKSA-N 1 2 226.345 2.141 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccns2)[C@H](C)[C@@H](C)O1 ZINC000639085883 353433387 /nfs/dbraw/zinc/43/33/87/353433387.db2.gz MBVFMRJHFWOKOK-OPRDCNLKSA-N 1 2 226.345 2.141 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](Cc1ccno1)CCO2 ZINC000285690507 188386732 /nfs/dbraw/zinc/38/67/32/188386732.db2.gz VJYQREPJEATHKC-UHFFFAOYSA-N 1 2 244.294 2.378 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](Cc1ccno1)CCO2 ZINC000285690507 188386734 /nfs/dbraw/zinc/38/67/34/188386734.db2.gz VJYQREPJEATHKC-UHFFFAOYSA-N 1 2 244.294 2.378 20 0 BEADLO C[C@H]([NH2+]CC(F)F)c1cccc(O)c1 ZINC000147332317 538117535 /nfs/dbraw/zinc/11/75/35/538117535.db2.gz YGTPQHVDUYHLSC-ZETCQYMHSA-N 1 2 201.216 2.308 20 0 BEADLO CC(C)[C@H](O)CNc1cc[nH+]c2ccncc12 ZINC000290510070 188389190 /nfs/dbraw/zinc/38/91/90/188389190.db2.gz BKAFWHIXCPZVBZ-CYBMUJFWSA-N 1 2 231.299 2.059 20 0 BEADLO C/C=C(\CC)C(=O)NCc1c[nH+]ccc1OC ZINC000294408700 188392097 /nfs/dbraw/zinc/39/20/97/188392097.db2.gz FHFFNMZVLBORFH-ONNFQVAWSA-N 1 2 234.299 2.063 20 0 BEADLO CC(C)C[C@H](C)OC(=O)NCc1[nH+]ccn1C ZINC000295212130 188393635 /nfs/dbraw/zinc/39/36/35/188393635.db2.gz UTFGBMGLBGJNME-JTQLQIEISA-N 1 2 239.319 2.081 20 0 BEADLO C[C@H]1COC(C)(C)C[N@@H+]1Cc1ccns1 ZINC000639101709 353550350 /nfs/dbraw/zinc/55/03/50/353550350.db2.gz GDDSMRMYOUDATM-VIFPVBQESA-N 1 2 226.345 2.142 20 0 BEADLO C[C@H]1COC(C)(C)C[N@H+]1Cc1ccns1 ZINC000639101709 353550353 /nfs/dbraw/zinc/55/03/53/353550353.db2.gz GDDSMRMYOUDATM-VIFPVBQESA-N 1 2 226.345 2.142 20 0 BEADLO CO[C@@H]1CC[C@@H](NC(=O)Nc2cc[nH+]cc2C)C1 ZINC000189755706 353534486 /nfs/dbraw/zinc/53/44/86/353534486.db2.gz BBWGJTMTRIXERB-GHMZBOCLSA-N 1 2 249.314 2.079 20 0 BEADLO CO[C@H]1CC[C@@H](NC(=O)Nc2cc[nH+]c(C)c2)C1 ZINC000189754197 353534928 /nfs/dbraw/zinc/53/49/28/353534928.db2.gz YPUCUQFRVVFJDF-PWSUYJOCSA-N 1 2 249.314 2.079 20 0 BEADLO Cc1cn2c([nH+]1)C[C@H](C(=O)N(C)C(C)(C)C)CC2 ZINC000627964080 353497088 /nfs/dbraw/zinc/49/70/88/353497088.db2.gz CMALGMQLAPBNOF-LLVKDONJSA-N 1 2 249.358 2.011 20 0 BEADLO C[C@@H]1CC[C@H](CNc2[nH+]cnc3c2cnn3C)C1 ZINC000230434248 353497706 /nfs/dbraw/zinc/49/77/06/353497706.db2.gz DNQFIEDJTFEURJ-ZJUUUORDSA-N 1 2 245.330 2.211 20 0 BEADLO Cc1cc(NC2Cc3ccccc3C2)nc[nH+]1 ZINC000231038859 353554437 /nfs/dbraw/zinc/55/44/37/353554437.db2.gz OHXPHWQBNUFFQE-UHFFFAOYSA-N 1 2 225.295 2.364 20 0 BEADLO CCC[C@H]([NH2+]Cc1c[nH]nn1)[C@@H]1CC1(C)C ZINC000398423918 363237375 /nfs/dbraw/zinc/23/73/75/363237375.db2.gz WMMNNFCDZHXJDN-QWRGUYRKSA-N 1 2 222.336 2.109 20 0 BEADLO CCC[C@H]([NH2+]Cc1cn[nH]n1)[C@@H]1CC1(C)C ZINC000398423918 363237378 /nfs/dbraw/zinc/23/73/78/363237378.db2.gz WMMNNFCDZHXJDN-QWRGUYRKSA-N 1 2 222.336 2.109 20 0 BEADLO Fc1cccc2c1OCC[C@@H]2[NH2+]Cc1cocn1 ZINC000277028979 181006666 /nfs/dbraw/zinc/00/66/66/181006666.db2.gz NTBUTNZYUKVHRD-LBPRGKRZSA-N 1 2 248.257 2.427 20 0 BEADLO CCC[C@H](C)N(C)C(=O)[C@H]1CCn2c[nH+]cc2C1 ZINC000343325661 353712886 /nfs/dbraw/zinc/71/28/86/353712886.db2.gz SXTPJNKVCIEFOM-RYUDHWBXSA-N 1 2 249.358 2.093 20 0 BEADLO Fc1ccccc1CCOCc1[nH]cc[nH+]1 ZINC000277930836 181012179 /nfs/dbraw/zinc/01/21/79/181012179.db2.gz HIPYCAMFXDZQIN-UHFFFAOYSA-N 1 2 220.247 2.308 20 0 BEADLO Cc1cc(NCCCCO)nc(C(C)C)[nH+]1 ZINC000232767193 353761132 /nfs/dbraw/zinc/76/11/32/353761132.db2.gz KFMTZVBSVXXEJK-UHFFFAOYSA-N 1 2 223.320 2.093 20 0 BEADLO Cc1[nH+]c2cc(NC(=O)[C@@H]3C[C@H]3C)ccc2n1C ZINC000608248457 353769991 /nfs/dbraw/zinc/76/99/91/353769991.db2.gz NYEHWNNMUYKSBM-LDYMZIIASA-N 1 2 243.310 2.476 20 0 BEADLO Fc1ccccc1C1C[NH+](Cc2cocn2)C1 ZINC000361237339 181010620 /nfs/dbraw/zinc/01/06/20/181010620.db2.gz JMODCSWSFVDTPG-UHFFFAOYSA-N 1 2 232.258 2.413 20 0 BEADLO Fc1cncc(C[N@@H+]2CCC[C@H]2c2cc[nH]n2)c1 ZINC000286041714 181019848 /nfs/dbraw/zinc/01/98/48/181019848.db2.gz IIQLZASCGICXES-ZDUSSCGKSA-N 1 2 246.289 2.281 20 0 BEADLO Fc1cncc(C[N@H+]2CCC[C@H]2c2cc[nH]n2)c1 ZINC000286041714 181019850 /nfs/dbraw/zinc/01/98/50/181019850.db2.gz IIQLZASCGICXES-ZDUSSCGKSA-N 1 2 246.289 2.281 20 0 BEADLO CN(C(=O)Nc1ccc2[nH+]ccn2c1)C1CCC1 ZINC000608313898 353868215 /nfs/dbraw/zinc/86/82/15/353868215.db2.gz RWVAFVOYPNBSEO-UHFFFAOYSA-N 1 2 244.298 2.351 20 0 BEADLO FC(F)OC[C@@H]1CCN(c2cccc[nH+]2)C1 ZINC000343541270 353917446 /nfs/dbraw/zinc/91/74/46/353917446.db2.gz LXBXUMDXBWYJSY-SECBINFHSA-N 1 2 228.242 2.147 20 0 BEADLO CN(C[C@@H]1CC=CCC1)C(=O)CCn1cc[nH+]c1 ZINC000343626714 353947350 /nfs/dbraw/zinc/94/73/50/353947350.db2.gz QHTHTVDPVGMOQL-CYBMUJFWSA-N 1 2 247.342 2.088 20 0 BEADLO CN(C[C@H]1CC=CCC1)C(=O)CCn1cc[nH+]c1 ZINC000343626715 353947405 /nfs/dbraw/zinc/94/74/05/353947405.db2.gz QHTHTVDPVGMOQL-ZDUSSCGKSA-N 1 2 247.342 2.088 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@@H]1CCc2c1cccc2O ZINC000038011360 358482247 /nfs/dbraw/zinc/48/22/47/358482247.db2.gz BBPKRRKMNRHDGH-CYBMUJFWSA-N 1 2 243.310 2.201 20 0 BEADLO CC[C@]1(C)C[C@H]1C(=O)NC[C@@H](C)Cn1cc[nH+]c1 ZINC000343783115 354018617 /nfs/dbraw/zinc/01/86/17/354018617.db2.gz VDALKTPTYIIOEH-MBNYWOFBSA-N 1 2 249.358 2.072 20 0 BEADLO CCC(C)(C)CC[S@](=O)Cc1c[nH+]cn1C ZINC000343862618 354025059 /nfs/dbraw/zinc/02/50/59/354025059.db2.gz ORSZFIKQYVGVDN-INIZCTEOSA-N 1 2 242.388 2.495 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1CCO[C@@H](C)C1 ZINC000334568956 354094034 /nfs/dbraw/zinc/09/40/34/354094034.db2.gz GTLMBVOZYLMINP-CMPLNLGQSA-N 1 2 248.326 2.452 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@@H](C(C)(C)C)C2)no1 ZINC000334571066 354099079 /nfs/dbraw/zinc/09/90/79/354099079.db2.gz MWCAECWLIOZCIX-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@@H](C(C)(C)C)C2)no1 ZINC000334571066 354099084 /nfs/dbraw/zinc/09/90/84/354099084.db2.gz MWCAECWLIOZCIX-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO CCC1CN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000334576271 354108915 /nfs/dbraw/zinc/10/89/15/354108915.db2.gz LNAOTQBLIKMWAY-UHFFFAOYSA-N 1 2 203.289 2.200 20 0 BEADLO Cc1cc(C[NH+]2Cc3ccccc3C2)n(C)n1 ZINC000334576920 354110862 /nfs/dbraw/zinc/11/08/62/354110862.db2.gz JFSMWQPFFMCXNY-UHFFFAOYSA-N 1 2 227.311 2.244 20 0 BEADLO CC(C)(C)[C@@H]1CCN(C(=O)CCn2cc[nH+]c2)C1 ZINC000344099125 354139816 /nfs/dbraw/zinc/13/98/16/354139816.db2.gz NCSGKDONABPVEH-GFCCVEGCSA-N 1 2 249.358 2.168 20 0 BEADLO Cc1cc(C[N@@H+]2CCCc3occc3C2)nn1C ZINC000344238809 354186296 /nfs/dbraw/zinc/18/62/96/354186296.db2.gz BBJRVVNRXIPKLW-UHFFFAOYSA-N 1 2 245.326 2.270 20 0 BEADLO Cc1cc(C[N@H+]2CCCc3occc3C2)nn1C ZINC000344238809 354186298 /nfs/dbraw/zinc/18/62/98/354186298.db2.gz BBJRVVNRXIPKLW-UHFFFAOYSA-N 1 2 245.326 2.270 20 0 BEADLO CCC[C@@H](C)CC(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000344253583 354190766 /nfs/dbraw/zinc/19/07/66/354190766.db2.gz RWIQUJJWPBWJDT-MNOVXSKESA-N 1 2 249.358 2.210 20 0 BEADLO CCC[C@@H](C)CC(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000344253583 354190769 /nfs/dbraw/zinc/19/07/69/354190769.db2.gz RWIQUJJWPBWJDT-MNOVXSKESA-N 1 2 249.358 2.210 20 0 BEADLO Cn1cc[nH+]c1[C@@H]1CCN(C(=O)CC(C)(C)C)C1 ZINC000334597091 354231485 /nfs/dbraw/zinc/23/14/85/354231485.db2.gz YHFMEUPEYMUGCX-LLVKDONJSA-N 1 2 249.358 2.172 20 0 BEADLO Cn1nnc2cc(C[N@@H+]3CCC=C(F)C3)ccc21 ZINC000334611825 354294810 /nfs/dbraw/zinc/29/48/10/354294810.db2.gz RWOWUZVXEVFCSR-UHFFFAOYSA-N 1 2 246.289 2.027 20 0 BEADLO Cn1nnc2cc(C[N@H+]3CCC=C(F)C3)ccc21 ZINC000334611825 354294812 /nfs/dbraw/zinc/29/48/12/354294812.db2.gz RWOWUZVXEVFCSR-UHFFFAOYSA-N 1 2 246.289 2.027 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccon2)ccc1F ZINC000086452714 491061749 /nfs/dbraw/zinc/06/17/49/491061749.db2.gz GFEBZWVZPGQKCU-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO C[C@@H](CF)[NH2+][C@@H](c1nnc[nH]1)C1CCCCC1 ZINC000639182943 354340086 /nfs/dbraw/zinc/34/00/86/354340086.db2.gz NEHSKYUDDPOYJI-GXSJLCMTSA-N 1 2 240.326 2.374 20 0 BEADLO Cn1c[nH+]cc1CN1CCc2ccc(F)c(F)c21 ZINC000334621314 354358695 /nfs/dbraw/zinc/35/86/95/354358695.db2.gz SWRLIIURWDTOLX-UHFFFAOYSA-N 1 2 249.264 2.261 20 0 BEADLO CCc1cnc(C[NH2+]Cc2cnc(C)nc2)s1 ZINC000344756054 354351286 /nfs/dbraw/zinc/35/12/86/354351286.db2.gz DUHROINCZBKNRR-UHFFFAOYSA-N 1 2 248.355 2.094 20 0 BEADLO CC1(CO)C[NH+](Cc2ccc(F)c(Cl)c2)C1 ZINC000334646234 354436369 /nfs/dbraw/zinc/43/63/69/354436369.db2.gz MFOUDLWSOMJKAL-UHFFFAOYSA-N 1 2 243.709 2.293 20 0 BEADLO CCc1noc(-c2cccc(-n3cc[nH+]c3)c2)n1 ZINC000345030122 354438729 /nfs/dbraw/zinc/43/87/29/354438729.db2.gz LQFHTEDNCYOKDM-UHFFFAOYSA-N 1 2 240.266 2.485 20 0 BEADLO C[C@H]1CCC[C@@]1(C)C(=O)N1CCn2cc[nH+]c2C1 ZINC000334667051 354406176 /nfs/dbraw/zinc/40/61/76/354406176.db2.gz WMYPVLHNKNRAFY-SMDDNHRTSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1nc(C[N@@H+]2CCCO[C@H](CF)C2)cs1 ZINC000334648286 354439187 /nfs/dbraw/zinc/43/91/87/354439187.db2.gz VHDKNYGANXTCGL-LLVKDONJSA-N 1 2 244.335 2.012 20 0 BEADLO Cc1nc(C[N@H+]2CCCO[C@H](CF)C2)cs1 ZINC000334648286 354439189 /nfs/dbraw/zinc/43/91/89/354439189.db2.gz VHDKNYGANXTCGL-LLVKDONJSA-N 1 2 244.335 2.012 20 0 BEADLO C[C@H]([NH2+][C@H]1CCCc2nn(C)cc21)C(C)(F)F ZINC000334668910 354409518 /nfs/dbraw/zinc/40/95/18/354409518.db2.gz CZIGWBQILBWHHZ-WPRPVWTQSA-N 1 2 243.301 2.431 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC1C(C)(C)C1(C)C ZINC000578023699 366189565 /nfs/dbraw/zinc/18/95/65/366189565.db2.gz AQSXOUVYVBAHEV-SECBINFHSA-N 1 2 249.358 2.139 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC1C(C)(C)C1(C)C ZINC000578023699 366189568 /nfs/dbraw/zinc/18/95/68/366189568.db2.gz AQSXOUVYVBAHEV-SECBINFHSA-N 1 2 249.358 2.139 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC(=O)[C@@H](C)C2)c(C)n1 ZINC000335926609 134009212 /nfs/dbraw/zinc/00/92/12/134009212.db2.gz RVIBZIQYBKTQID-JTQLQIEISA-N 1 2 232.327 2.109 20 0 BEADLO CC(C)[C@@H](C)C(=O)Nc1c[nH+]c2n1CCCC2 ZINC000334653176 354446543 /nfs/dbraw/zinc/44/65/43/354446543.db2.gz LESZOKIMFAGCAH-SNVBAGLBSA-N 1 2 235.331 2.450 20 0 BEADLO C[C@H]1CCC[C@]1(C)C(=O)N1CCn2c[nH+]cc2C1 ZINC000334662062 354461847 /nfs/dbraw/zinc/46/18/47/354461847.db2.gz UFTFHBBXSOKHBJ-FZMZJTMJSA-N 1 2 247.342 2.052 20 0 BEADLO C[C@H]1C[N@H+](C)CCN1C[C@@H]1CCC(F)(F)C1 ZINC000334664603 354466045 /nfs/dbraw/zinc/46/60/45/354466045.db2.gz VDNBHWVVYVCODQ-WDEREUQCSA-N 1 2 232.318 2.058 20 0 BEADLO CC(C)=CCNC(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000334694744 354485635 /nfs/dbraw/zinc/48/56/35/354485635.db2.gz BHRXJSCRPHNUMT-GHMZBOCLSA-N 1 2 248.330 2.154 20 0 BEADLO C[C@H]1CCCC[C@@H]1CCNC(=O)Cn1cc[nH+]c1 ZINC000578061028 366207278 /nfs/dbraw/zinc/20/72/78/366207278.db2.gz DTAXSSPIGKVQMJ-QWHCGFSZSA-N 1 2 249.358 2.216 20 0 BEADLO c1cc2c(o1)CCC[N@@H+](Cc1cnccn1)C2 ZINC000334727364 354528088 /nfs/dbraw/zinc/52/80/88/354528088.db2.gz LPPKJJHXTFOODP-UHFFFAOYSA-N 1 2 229.283 2.018 20 0 BEADLO c1cc2c(o1)CCC[N@H+](Cc1cnccn1)C2 ZINC000334727364 354528093 /nfs/dbraw/zinc/52/80/93/354528093.db2.gz LPPKJJHXTFOODP-UHFFFAOYSA-N 1 2 229.283 2.018 20 0 BEADLO CC(C)[C@H]1C[N@H+](Cc2ccncc2F)CCO1 ZINC000334743062 354545980 /nfs/dbraw/zinc/54/59/80/354545980.db2.gz RFBHQPQGNQURTC-CYBMUJFWSA-N 1 2 238.306 2.078 20 0 BEADLO CC(C)[C@H]1C[N@@H+](Cc2ccncc2F)CCO1 ZINC000334743062 354545984 /nfs/dbraw/zinc/54/59/84/354545984.db2.gz RFBHQPQGNQURTC-CYBMUJFWSA-N 1 2 238.306 2.078 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CC(C)(C)[C@@H]1[C@H]1CCCO1 ZINC000334695823 354486955 /nfs/dbraw/zinc/48/69/55/354486955.db2.gz WIWSROCESCWIDH-OLZOCXBDSA-N 1 2 249.358 2.108 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CC(C)(C)[C@@H]1[C@H]1CCCO1 ZINC000334695823 354486958 /nfs/dbraw/zinc/48/69/58/354486958.db2.gz WIWSROCESCWIDH-OLZOCXBDSA-N 1 2 249.358 2.108 20 0 BEADLO Cc1ccc(NC(=O)N2CC[C@H](F)C2)c(C)[nH+]1 ZINC000334696383 354487517 /nfs/dbraw/zinc/48/75/17/354487517.db2.gz IEVORIDKRQSSRR-JTQLQIEISA-N 1 2 237.278 2.274 20 0 BEADLO C[C@@H]1CC[C@@H](NC(=O)c2ccc3[nH+]ccn3c2)C1 ZINC000334699725 354492213 /nfs/dbraw/zinc/49/22/13/354492213.db2.gz RTBDDFMOFZUDOM-ZYHUDNBSSA-N 1 2 243.310 2.253 20 0 BEADLO CC[C@@H]1CCN1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000334704206 354497734 /nfs/dbraw/zinc/49/77/34/354497734.db2.gz XLYYNYVDVMGRTP-LLVKDONJSA-N 1 2 244.298 2.351 20 0 BEADLO CC[C@H]1CCN1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000334704209 354498082 /nfs/dbraw/zinc/49/80/82/354498082.db2.gz XLYYNYVDVMGRTP-NSHDSACASA-N 1 2 244.298 2.351 20 0 BEADLO c1coc(C[N@@H+]2CCC[C@H]2c2ncc[nH]2)c1 ZINC000334709140 354504973 /nfs/dbraw/zinc/50/49/73/354504973.db2.gz WINPNRYRHHQPDV-NSHDSACASA-N 1 2 217.272 2.340 20 0 BEADLO c1coc(C[N@H+]2CCC[C@H]2c2ncc[nH]2)c1 ZINC000334709140 354504975 /nfs/dbraw/zinc/50/49/75/354504975.db2.gz WINPNRYRHHQPDV-NSHDSACASA-N 1 2 217.272 2.340 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CCO[C@H]2CCC[C@@H]21 ZINC000334798492 354553067 /nfs/dbraw/zinc/55/30/67/354553067.db2.gz PSJHXWMLUHXULA-STQMWFEESA-N 1 2 249.358 2.217 20 0 BEADLO Cc1cc(N2CC[C@H](CC3CC3)C2)nc[nH+]1 ZINC000334814493 354572315 /nfs/dbraw/zinc/57/23/15/354572315.db2.gz KGGBRGBUFGDNEQ-GFCCVEGCSA-N 1 2 217.316 2.411 20 0 BEADLO Cc1cnc(C[N@@H+]2C[C@@H](C)S[C@@H](C)C2)nc1 ZINC000334754338 354575654 /nfs/dbraw/zinc/57/56/54/354575654.db2.gz DBOQNAIEHRAKPU-PHIMTYICSA-N 1 2 237.372 2.111 20 0 BEADLO Cc1cnc(C[N@H+]2C[C@@H](C)S[C@@H](C)C2)nc1 ZINC000334754338 354575658 /nfs/dbraw/zinc/57/56/58/354575658.db2.gz DBOQNAIEHRAKPU-PHIMTYICSA-N 1 2 237.372 2.111 20 0 BEADLO O=C([C@H]1CCCc2[nH+]c[nH]c21)N1CCCCCC1 ZINC000334762274 354582097 /nfs/dbraw/zinc/58/20/97/354582097.db2.gz QIHOCJNMSIQLCO-NSHDSACASA-N 1 2 247.342 2.232 20 0 BEADLO CCc1nc(C)c(C[N@@H+]2CCO[C@H](C)[C@@H]2C)o1 ZINC000334762325 354582322 /nfs/dbraw/zinc/58/23/22/354582322.db2.gz KLIBOXNISWFPMX-WDEREUQCSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1nc(C)c(C[N@H+]2CCO[C@H](C)[C@@H]2C)o1 ZINC000334762325 354582325 /nfs/dbraw/zinc/58/23/25/354582325.db2.gz KLIBOXNISWFPMX-WDEREUQCSA-N 1 2 238.331 2.155 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@]1(C)CCCC[C@@H]1C ZINC000334762574 354582871 /nfs/dbraw/zinc/58/28/71/354582871.db2.gz XEVNHKVZDQQQBA-HZMBPMFUSA-N 1 2 249.358 2.346 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@@]1(C)CCCC[C@@H]1C ZINC000334762574 354582872 /nfs/dbraw/zinc/58/28/72/354582872.db2.gz XEVNHKVZDQQQBA-HZMBPMFUSA-N 1 2 249.358 2.346 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@]1(C)CCCC[C@H]1C ZINC000334762580 354583065 /nfs/dbraw/zinc/58/30/65/354583065.db2.gz XEVNHKVZDQQQBA-YGRLFVJLSA-N 1 2 249.358 2.346 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@@]1(C)CCCC[C@H]1C ZINC000334762580 354583068 /nfs/dbraw/zinc/58/30/68/354583068.db2.gz XEVNHKVZDQQQBA-YGRLFVJLSA-N 1 2 249.358 2.346 20 0 BEADLO C[C@@H]1CCC[C@@H](CC(=O)NCCn2cc[nH+]c2)C1 ZINC000345368102 354639053 /nfs/dbraw/zinc/63/90/53/354639053.db2.gz ATECQULQLKYVNA-CHWSQXEVSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@H]1CCCC[C@H]1C(=O)N1CCn2c[nH+]cc2C1 ZINC000335111986 354698528 /nfs/dbraw/zinc/69/85/28/354698528.db2.gz AYEQNBIFERDTNK-WCQYABFASA-N 1 2 247.342 2.052 20 0 BEADLO CC(C)n1cncc1C[N@@H+]1CCO[C@H]2CCC[C@@H]21 ZINC000335112150 354698580 /nfs/dbraw/zinc/69/85/80/354698580.db2.gz UHIJHEQAUFGTMT-KBPBESRZSA-N 1 2 249.358 2.217 20 0 BEADLO CC(C)n1cncc1C[N@H+]1CCO[C@H]2CCC[C@@H]21 ZINC000335112150 354698582 /nfs/dbraw/zinc/69/85/82/354698582.db2.gz UHIJHEQAUFGTMT-KBPBESRZSA-N 1 2 249.358 2.217 20 0 BEADLO CC(C)n1c[nH+]cc1CN1CCO[C@H]2CCC[C@@H]21 ZINC000335112150 354698585 /nfs/dbraw/zinc/69/85/85/354698585.db2.gz UHIJHEQAUFGTMT-KBPBESRZSA-N 1 2 249.358 2.217 20 0 BEADLO Cc1cn2cc(NC(=O)[C@]3(C)C[C@H]3F)ccc2[nH+]1 ZINC000335102402 354713629 /nfs/dbraw/zinc/71/36/29/354713629.db2.gz FYUDNFAYEMRBGH-ZWNOBZJWSA-N 1 2 247.273 2.329 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nc(C(F)F)no2)C[C@@H]1C ZINC000335119088 354724285 /nfs/dbraw/zinc/72/42/85/354724285.db2.gz RNPMOSZYBHZMFF-SFYZADRCSA-N 1 2 245.273 2.485 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nc(C(F)F)no2)C[C@@H]1C ZINC000335119088 354724288 /nfs/dbraw/zinc/72/42/88/354724288.db2.gz RNPMOSZYBHZMFF-SFYZADRCSA-N 1 2 245.273 2.485 20 0 BEADLO CCC[C@H](C)CC(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000345606339 354728412 /nfs/dbraw/zinc/72/84/12/354728412.db2.gz IRFZQJXUPNCFIC-NWDGAFQWSA-N 1 2 237.347 2.214 20 0 BEADLO Cc1sccc1C[N@@H+]1CC[S@](=O)[C@@H](C)C1 ZINC000335942418 134018197 /nfs/dbraw/zinc/01/81/97/134018197.db2.gz MZSHBQOSOUVZBX-VFZGTOFNSA-N 1 2 243.397 2.009 20 0 BEADLO Cc1sccc1C[N@H+]1CC[S@](=O)[C@@H](C)C1 ZINC000335942418 134018198 /nfs/dbraw/zinc/01/81/98/134018198.db2.gz MZSHBQOSOUVZBX-VFZGTOFNSA-N 1 2 243.397 2.009 20 0 BEADLO Cc1ccc(C[N@H+]2CCOC[C@@H]2C)c(F)c1 ZINC000639218677 354870001 /nfs/dbraw/zinc/87/00/01/354870001.db2.gz PPYXTEGKPMIUME-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ccc(C[N@@H+]2CCOC[C@@H]2C)c(F)c1 ZINC000639218677 354870002 /nfs/dbraw/zinc/87/00/02/354870002.db2.gz PPYXTEGKPMIUME-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO C[C@H]1COCC[N@@H+]1Cc1cc2ccccc2n1C ZINC000639219750 354874634 /nfs/dbraw/zinc/87/46/34/354874634.db2.gz XDJKUCFRADFTHA-LBPRGKRZSA-N 1 2 244.338 2.399 20 0 BEADLO C[C@H]1COCC[N@H+]1Cc1cc2ccccc2n1C ZINC000639219750 354874637 /nfs/dbraw/zinc/87/46/37/354874637.db2.gz XDJKUCFRADFTHA-LBPRGKRZSA-N 1 2 244.338 2.399 20 0 BEADLO CC[C@@H](C)CN(C)C(=O)C(C)(C)c1c[nH+]c[nH]1 ZINC000346354346 354889768 /nfs/dbraw/zinc/88/97/68/354889768.db2.gz JGXKZLIQGFGMGT-SNVBAGLBSA-N 1 2 237.347 2.192 20 0 BEADLO CC(C)n1cc(C[NH+]2CC3(C2)CCCC3)nn1 ZINC000335170848 354934873 /nfs/dbraw/zinc/93/48/73/354934873.db2.gz QMMVXCPHRYFOAS-UHFFFAOYSA-N 1 2 234.347 2.235 20 0 BEADLO CC[C@H]1CC[N@@H+]1Cc1nn(C)c(C)c1Cl ZINC000335173714 354940074 /nfs/dbraw/zinc/94/00/74/354940074.db2.gz GBGUPGJAOKPANP-VIFPVBQESA-N 1 2 227.739 2.366 20 0 BEADLO CC[C@H]1CC[N@H+]1Cc1nn(C)c(C)c1Cl ZINC000335173714 354940077 /nfs/dbraw/zinc/94/00/77/354940077.db2.gz GBGUPGJAOKPANP-VIFPVBQESA-N 1 2 227.739 2.366 20 0 BEADLO Cc1c(Cl)c(C[N@@H+]2CC[C@@H]2C2CC2)nn1C ZINC000335174784 354941690 /nfs/dbraw/zinc/94/16/90/354941690.db2.gz HXAQDKJXXPNLJK-LLVKDONJSA-N 1 2 239.750 2.366 20 0 BEADLO Cc1c(Cl)c(C[N@H+]2CC[C@@H]2C2CC2)nn1C ZINC000335174784 354941692 /nfs/dbraw/zinc/94/16/92/354941692.db2.gz HXAQDKJXXPNLJK-LLVKDONJSA-N 1 2 239.750 2.366 20 0 BEADLO C[C@@H](CNC(=O)[C@H]1CC[C@@H](C)C1)Cn1cc[nH+]c1 ZINC000346525654 354975869 /nfs/dbraw/zinc/97/58/69/354975869.db2.gz LAYQNEMLEDKZLQ-AGIUHOORSA-N 1 2 249.358 2.072 20 0 BEADLO CC[C@@](C)(O)C[N@@H+]1CC[C@H](C)C(F)(F)C1 ZINC000335201186 355034623 /nfs/dbraw/zinc/03/46/23/355034623.db2.gz HFOBLBDZOFKGNP-VHSXEESVSA-N 1 2 221.291 2.125 20 0 BEADLO CC[C@@](C)(O)C[N@H+]1CC[C@H](C)C(F)(F)C1 ZINC000335201186 355034627 /nfs/dbraw/zinc/03/46/27/355034627.db2.gz HFOBLBDZOFKGNP-VHSXEESVSA-N 1 2 221.291 2.125 20 0 BEADLO CSC[C@H]1CCCN(c2cc(C)[nH+]cn2)C1 ZINC000335204828 355039425 /nfs/dbraw/zinc/03/94/25/355039425.db2.gz ZPAPXQOISVPCOQ-NSHDSACASA-N 1 2 237.372 2.364 20 0 BEADLO Cc1cc(NC(=O)c2ncccc2Cl)cc[nH+]1 ZINC000335183173 355081059 /nfs/dbraw/zinc/08/10/59/355081059.db2.gz LVRSOAGRQQIAGT-UHFFFAOYSA-N 1 2 247.685 2.113 20 0 BEADLO Cc1ncc([C@@H](C)[N@@H+]2CC[C@H](F)C2)c(C)n1 ZINC000639228414 355105144 /nfs/dbraw/zinc/10/51/44/355105144.db2.gz OJVJRECQCDUFFT-KOLCDFICSA-N 1 2 223.295 2.198 20 0 BEADLO Cc1ncc([C@@H](C)[N@H+]2CC[C@H](F)C2)c(C)n1 ZINC000639228414 355105148 /nfs/dbraw/zinc/10/51/48/355105148.db2.gz OJVJRECQCDUFFT-KOLCDFICSA-N 1 2 223.295 2.198 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2ccnn2CC2CCC2)C1 ZINC000639227853 355093072 /nfs/dbraw/zinc/09/30/72/355093072.db2.gz MBUSHYKQXPUOOL-GFCCVEGCSA-N 1 2 237.322 2.227 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2ccnn2CC2CCC2)C1 ZINC000639227853 355093073 /nfs/dbraw/zinc/09/30/73/355093073.db2.gz MBUSHYKQXPUOOL-GFCCVEGCSA-N 1 2 237.322 2.227 20 0 BEADLO C[C@H](CC(=O)N1CCn2c[nH+]cc2C1)C(C)(C)C ZINC000335237803 355099355 /nfs/dbraw/zinc/09/93/55/355099355.db2.gz BGHYXKWKOVRWPY-LLVKDONJSA-N 1 2 249.358 2.298 20 0 BEADLO Cc1nc(N2CC[C@@H](C(C)C)C2)cc[nH+]1 ZINC000335244999 355159796 /nfs/dbraw/zinc/15/97/96/355159796.db2.gz NJGQWIKOEBFKDP-LLVKDONJSA-N 1 2 205.305 2.267 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc(F)cn2)[C@@H](C)[C@@H](C)O1 ZINC000346971236 355207622 /nfs/dbraw/zinc/20/76/22/355207622.db2.gz GNEDWXOCGMNKMK-OUAUKWLOSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc(F)cn2)[C@@H](C)[C@@H](C)O1 ZINC000346971236 355207623 /nfs/dbraw/zinc/20/76/23/355207623.db2.gz GNEDWXOCGMNKMK-OUAUKWLOSA-N 1 2 238.306 2.218 20 0 BEADLO CC(C)[C@@H]1C[C@H]1c1nc(Cc2c[nH+]cn2C)no1 ZINC000346927979 355178274 /nfs/dbraw/zinc/17/82/74/355178274.db2.gz DLGWBQFQXPDNKR-WDEREUQCSA-N 1 2 246.314 2.153 20 0 BEADLO c1nc(NC2CC2)cc(NCC2CCC2)[nH+]1 ZINC000413087849 191356057 /nfs/dbraw/zinc/35/60/57/191356057.db2.gz FOSRLNBEFMTGIX-UHFFFAOYSA-N 1 2 218.304 2.263 20 0 BEADLO c1nc(NCC2CCC2)cc(NC2CC2)[nH+]1 ZINC000413087849 191356060 /nfs/dbraw/zinc/35/60/60/191356060.db2.gz FOSRLNBEFMTGIX-UHFFFAOYSA-N 1 2 218.304 2.263 20 0 BEADLO CSC[C@H](C)Nc1cc(NC2CC2)[nH+]cn1 ZINC000413153601 191356284 /nfs/dbraw/zinc/35/62/84/191356284.db2.gz HKMKDQQQJZIUBM-QMMMGPOBSA-N 1 2 238.360 2.214 20 0 BEADLO CSC[C@H](C)Nc1cc(NC2CC2)nc[nH+]1 ZINC000413153601 191356288 /nfs/dbraw/zinc/35/62/88/191356288.db2.gz HKMKDQQQJZIUBM-QMMMGPOBSA-N 1 2 238.360 2.214 20 0 BEADLO C[C@H]1CCN(c2cc(NC3CC3)[nH+]cn2)[C@H]1C ZINC000413163304 191359892 /nfs/dbraw/zinc/35/98/92/191359892.db2.gz AVNPDRJHPCQJSJ-UWVGGRQHSA-N 1 2 232.331 2.286 20 0 BEADLO C[C@H]1CCN(c2cc(NC3CC3)nc[nH+]2)[C@H]1C ZINC000413163304 191359895 /nfs/dbraw/zinc/35/98/95/191359895.db2.gz AVNPDRJHPCQJSJ-UWVGGRQHSA-N 1 2 232.331 2.286 20 0 BEADLO C[C@H]1CN(c2cc(NC3CC3)[nH+]cn2)C[C@@H]1C ZINC000413170815 191361060 /nfs/dbraw/zinc/36/10/60/191361060.db2.gz OCVDUUCWEJFLPV-UWVGGRQHSA-N 1 2 232.331 2.143 20 0 BEADLO C[C@H]1CN(c2cc(NC3CC3)nc[nH+]2)C[C@@H]1C ZINC000413170815 191361061 /nfs/dbraw/zinc/36/10/61/191361061.db2.gz OCVDUUCWEJFLPV-UWVGGRQHSA-N 1 2 232.331 2.143 20 0 BEADLO CC[C@@H](C[N@H+](CC(F)F)C(C)C)OC ZINC000412978662 191349505 /nfs/dbraw/zinc/34/95/05/191349505.db2.gz QQGBVHCBUXTVPW-VIFPVBQESA-N 1 2 209.280 2.387 20 0 BEADLO CC[C@@H](C[N@@H+](CC(F)F)C(C)C)OC ZINC000412978662 191349508 /nfs/dbraw/zinc/34/95/08/191349508.db2.gz QQGBVHCBUXTVPW-VIFPVBQESA-N 1 2 209.280 2.387 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H](C)CC(F)F ZINC000413452364 191385330 /nfs/dbraw/zinc/38/53/30/191385330.db2.gz HBXJMHSFYNRDLF-QMMMGPOBSA-N 1 2 242.269 2.296 20 0 BEADLO Cc1nc(NC[C@@H]2CCC[C@H]2C2CC2)cc[nH+]1 ZINC000413481664 191387661 /nfs/dbraw/zinc/38/76/61/191387661.db2.gz NXKMTPJTIQRAHC-STQMWFEESA-N 1 2 231.343 2.445 20 0 BEADLO COCC[C@H](C)C[NH+]=c1[nH]c2ccccc2[nH]1 ZINC000413489506 191389005 /nfs/dbraw/zinc/38/90/05/191389005.db2.gz GYYNRHYITABVLR-JTQLQIEISA-N 1 2 233.315 2.069 20 0 BEADLO c1nc(N2CCCC3(CC3)C2)cc(NC2CC2)[nH+]1 ZINC000413238585 191363631 /nfs/dbraw/zinc/36/36/31/191363631.db2.gz VGXRYWCBVQXXCV-UHFFFAOYSA-N 1 2 244.342 2.431 20 0 BEADLO c1nc(NC2CC2)cc(N2CCCC3(CC3)C2)[nH+]1 ZINC000413238585 191363633 /nfs/dbraw/zinc/36/36/33/191363633.db2.gz VGXRYWCBVQXXCV-UHFFFAOYSA-N 1 2 244.342 2.431 20 0 BEADLO Cc1cc(C[NH+]2CC(CC(F)(F)F)C2)on1 ZINC000639252567 355288842 /nfs/dbraw/zinc/28/88/42/355288842.db2.gz KVCLTFVBZDQIIY-UHFFFAOYSA-N 1 2 234.221 2.367 20 0 BEADLO FC1CC2(C1)C[NH+](Cc1cc(C3CC3)no1)C2 ZINC000639252783 355289600 /nfs/dbraw/zinc/28/96/00/355289600.db2.gz UDHJMBRDQYDZPS-UHFFFAOYSA-N 1 2 236.290 2.486 20 0 BEADLO Cc1cccc(CC[NH+]2CC(C(F)(F)F)C2)n1 ZINC000583497262 355329497 /nfs/dbraw/zinc/32/94/97/355329497.db2.gz BTPBXTKEYZBZJX-UHFFFAOYSA-N 1 2 244.260 2.427 20 0 BEADLO Cc1nnsc1C[NH+]1CC(C)(CC(F)F)C1 ZINC000639282216 355377498 /nfs/dbraw/zinc/37/74/98/355377498.db2.gz BYURYLXBRUBVRU-UHFFFAOYSA-N 1 2 247.314 2.324 20 0 BEADLO CCc1cc(N[C@@H](CC)C[C@@H](C)CO)nc[nH+]1 ZINC000608369418 355380891 /nfs/dbraw/zinc/38/08/91/355380891.db2.gz WSCYNLQFZSBPHD-PWSUYJOCSA-N 1 2 237.347 2.248 20 0 BEADLO Cc1cnc(C[NH+]2CC(C)(CC(F)F)C2)o1 ZINC000639284496 355385381 /nfs/dbraw/zinc/38/53/81/355385381.db2.gz VDOCJLVLWXSURB-UHFFFAOYSA-N 1 2 230.258 2.460 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1CCCOC1 ZINC000335780455 355427626 /nfs/dbraw/zinc/42/76/26/355427626.db2.gz UQUJPRCIZXQQJX-LLVKDONJSA-N 1 2 234.299 2.064 20 0 BEADLO Cc1noc(CCc2[nH]c3c(cccc3C)[nH+]2)n1 ZINC000349782980 355461423 /nfs/dbraw/zinc/46/14/23/355461423.db2.gz PYYGYEJVPGRAPP-UHFFFAOYSA-N 1 2 242.282 2.348 20 0 BEADLO Cc1noc(CCc2[nH]c3cccc(C)c3[nH+]2)n1 ZINC000349782980 355461427 /nfs/dbraw/zinc/46/14/27/355461427.db2.gz PYYGYEJVPGRAPP-UHFFFAOYSA-N 1 2 242.282 2.348 20 0 BEADLO C[C@H](C(N)=O)[N@@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000335807541 355479707 /nfs/dbraw/zinc/47/97/07/355479707.db2.gz KDBZZNDBMKANRM-SECBINFHSA-N 1 2 246.310 2.163 20 0 BEADLO C[C@H](C(N)=O)[N@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000335807541 355479712 /nfs/dbraw/zinc/47/97/12/355479712.db2.gz KDBZZNDBMKANRM-SECBINFHSA-N 1 2 246.310 2.163 20 0 BEADLO CCn1cc([C@@H](C)[NH2+][C@@H](C)c2ccon2)cn1 ZINC000349833796 355488908 /nfs/dbraw/zinc/48/89/08/355488908.db2.gz LSHSUJZLSMTJNB-ZJUUUORDSA-N 1 2 234.303 2.303 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)Nc1cc(F)ccc1C ZINC000335822617 355542954 /nfs/dbraw/zinc/54/29/54/355542954.db2.gz OSCVLVHVKVNLDF-UHFFFAOYSA-N 1 2 247.273 2.347 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H]1CC[C@@H](C)C1 ZINC000335827747 355553585 /nfs/dbraw/zinc/55/35/85/355553585.db2.gz MTMUMKDWBXMYIF-NXEZZACHSA-N 1 2 234.299 2.465 20 0 BEADLO C[NH2+]Cc1noc([C@H]2C[C@H]2c2sccc2C)n1 ZINC000349873095 355514126 /nfs/dbraw/zinc/51/41/26/355514126.db2.gz DDYALNFOEJLPOJ-BDAKNGLRSA-N 1 2 249.339 2.430 20 0 BEADLO C[NH2+]Cc1noc([C@@H](C)Cc2cccc(F)c2)n1 ZINC000349876078 355514449 /nfs/dbraw/zinc/51/44/49/355514449.db2.gz CQQMVSOFEWLYDM-VIFPVBQESA-N 1 2 249.289 2.274 20 0 BEADLO C[NH2+]Cc1noc(C(C)(C)c2ccc(C)cc2)n1 ZINC000349876829 355515552 /nfs/dbraw/zinc/51/55/52/355515552.db2.gz DGTMODBKIRETNN-UHFFFAOYSA-N 1 2 245.326 2.423 20 0 BEADLO C[NH2+]Cc1noc(C[C@@H](C)c2ccccc2)n1 ZINC000349878759 355516761 /nfs/dbraw/zinc/51/67/61/355516761.db2.gz FXRGALLJPWOPOM-SNVBAGLBSA-N 1 2 231.299 2.135 20 0 BEADLO C[NH2+]Cc1noc(C[C@@H](C)c2ccccc2F)n1 ZINC000349899036 355522342 /nfs/dbraw/zinc/52/23/42/355522342.db2.gz VHVHPNJEIYROKS-SECBINFHSA-N 1 2 249.289 2.274 20 0 BEADLO C[NH2+]Cc1noc(CC/C=C\c2ccccc2)n1 ZINC000349917849 355526437 /nfs/dbraw/zinc/52/64/37/355526437.db2.gz BPXWKQFDNZQHON-UITAMQMPSA-N 1 2 243.310 2.435 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccns2)[C@@H](C)CO1 ZINC000639296798 355581873 /nfs/dbraw/zinc/58/18/73/355581873.db2.gz PVXFSPFSUFFNPF-VHSXEESVSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccns2)[C@@H](C)CO1 ZINC000639296798 355581876 /nfs/dbraw/zinc/58/18/76/355581876.db2.gz PVXFSPFSUFFNPF-VHSXEESVSA-N 1 2 226.345 2.142 20 0 BEADLO c1ccc(N2CCC[C@@H]2C2CCOCC2)[nH+]c1 ZINC000335847402 355591500 /nfs/dbraw/zinc/59/15/00/355591500.db2.gz JEOPBYNSLDSTNW-CYBMUJFWSA-N 1 2 232.327 2.477 20 0 BEADLO CCCC[N@@H+]1CC(=O)N[C@@H]1[C@@H]1CCC[C@@H](C)C1 ZINC000350126919 355609742 /nfs/dbraw/zinc/60/97/42/355609742.db2.gz NWUPCIZKYKKRPU-BZPMIXESSA-N 1 2 238.375 2.371 20 0 BEADLO CCCC[N@H+]1CC(=O)N[C@@H]1[C@@H]1CCC[C@@H](C)C1 ZINC000350126919 355609744 /nfs/dbraw/zinc/60/97/44/355609744.db2.gz NWUPCIZKYKKRPU-BZPMIXESSA-N 1 2 238.375 2.371 20 0 BEADLO CCCC1(C(=O)NC[C@@H](C)Cn2cc[nH+]c2)CC1 ZINC000350181545 355621176 /nfs/dbraw/zinc/62/11/76/355621176.db2.gz PTGPLVAKLHEPIG-GFCCVEGCSA-N 1 2 249.358 2.216 20 0 BEADLO CCC[N@H+](C)Cc1nc([C@@](C)(CC)OC)no1 ZINC000350427293 355703906 /nfs/dbraw/zinc/70/39/06/355703906.db2.gz CIYOWXBFMPDUKS-GFCCVEGCSA-N 1 2 241.335 2.183 20 0 BEADLO CCC[N@@H+](C)Cc1nc([C@@](C)(CC)OC)no1 ZINC000350427293 355703909 /nfs/dbraw/zinc/70/39/09/355703909.db2.gz CIYOWXBFMPDUKS-GFCCVEGCSA-N 1 2 241.335 2.183 20 0 BEADLO COC1(C[N@@H+]2Cc3cnn(C)c3C2)CCCCC1 ZINC000639320367 355720661 /nfs/dbraw/zinc/72/06/61/355720661.db2.gz KZOXZBJYSMRESG-UHFFFAOYSA-N 1 2 249.358 2.085 20 0 BEADLO COC1(C[N@H+]2Cc3cnn(C)c3C2)CCCCC1 ZINC000639320367 355720667 /nfs/dbraw/zinc/72/06/67/355720667.db2.gz KZOXZBJYSMRESG-UHFFFAOYSA-N 1 2 249.358 2.085 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@H](F)C2)sn1 ZINC000639313326 355685332 /nfs/dbraw/zinc/68/53/32/355685332.db2.gz QIBIXOFUJWFTMV-SECBINFHSA-N 1 2 214.309 2.385 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@H](F)C2)sn1 ZINC000639313326 355685334 /nfs/dbraw/zinc/68/53/34/355685334.db2.gz QIBIXOFUJWFTMV-SECBINFHSA-N 1 2 214.309 2.385 20 0 BEADLO Cc1nocc1C[N@H+](C)Cc1ccoc1 ZINC000350653253 355737672 /nfs/dbraw/zinc/73/76/72/355737672.db2.gz DRZQORPPWTVNGS-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO Cc1nocc1C[N@@H+](C)Cc1ccoc1 ZINC000350653253 355737675 /nfs/dbraw/zinc/73/76/75/355737675.db2.gz DRZQORPPWTVNGS-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO Cc1nccc(C[N@H+](C)CCC(F)(F)F)n1 ZINC000350699608 355743727 /nfs/dbraw/zinc/74/37/27/355743727.db2.gz KDFOWUWJMLMQMC-UHFFFAOYSA-N 1 2 233.237 2.169 20 0 BEADLO Cc1nccc(C[N@@H+](C)CCC(F)(F)F)n1 ZINC000350699608 355743730 /nfs/dbraw/zinc/74/37/30/355743730.db2.gz KDFOWUWJMLMQMC-UHFFFAOYSA-N 1 2 233.237 2.169 20 0 BEADLO CCc1nocc1C[N@H+]1C[C@@H](CC)O[C@@H](C)C1 ZINC000350699732 355743784 /nfs/dbraw/zinc/74/37/84/355743784.db2.gz LQOGUJCWUNNCDN-CMPLNLGQSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1nocc1C[N@@H+]1C[C@@H](CC)O[C@@H](C)C1 ZINC000350699732 355743786 /nfs/dbraw/zinc/74/37/86/355743786.db2.gz LQOGUJCWUNNCDN-CMPLNLGQSA-N 1 2 238.331 2.236 20 0 BEADLO CC1(c2ccccc2)C[NH+](Cc2ccon2)C1 ZINC000639337352 355775884 /nfs/dbraw/zinc/77/58/84/355775884.db2.gz AVRRCXOJHNIJCU-UHFFFAOYSA-N 1 2 228.295 2.448 20 0 BEADLO CC1=C(C)C[C@H]([C@H](C)[NH2+]Cc2c[nH]nn2)CC1 ZINC000639341237 355782477 /nfs/dbraw/zinc/78/24/77/355782477.db2.gz JLAWDXITKJBBBA-NWDGAFQWSA-N 1 2 234.347 2.419 20 0 BEADLO CC1=C(C)C[C@H]([C@H](C)[NH2+]Cc2cn[nH]n2)CC1 ZINC000639341237 355782479 /nfs/dbraw/zinc/78/24/79/355782479.db2.gz JLAWDXITKJBBBA-NWDGAFQWSA-N 1 2 234.347 2.419 20 0 BEADLO CC1=C(C)C[C@@H]([C@H](C)[NH2+]Cc2c[nH]nn2)CC1 ZINC000639341238 355783010 /nfs/dbraw/zinc/78/30/10/355783010.db2.gz JLAWDXITKJBBBA-RYUDHWBXSA-N 1 2 234.347 2.419 20 0 BEADLO CC1=C(C)C[C@@H]([C@H](C)[NH2+]Cc2cn[nH]n2)CC1 ZINC000639341238 355783013 /nfs/dbraw/zinc/78/30/13/355783013.db2.gz JLAWDXITKJBBBA-RYUDHWBXSA-N 1 2 234.347 2.419 20 0 BEADLO Cc1nc(C[NH+]2C3CCCC2CCC3)no1 ZINC000608498857 355827225 /nfs/dbraw/zinc/82/72/25/355827225.db2.gz DFHBAVPKMOWUDC-UHFFFAOYSA-N 1 2 221.304 2.285 20 0 BEADLO COCC1(CNc2c[nH+]cc(N(C)C)c2)CCC1 ZINC000639362852 355818788 /nfs/dbraw/zinc/81/87/88/355818788.db2.gz KPJYFJJLTBOAAJ-UHFFFAOYSA-N 1 2 249.358 2.376 20 0 BEADLO C[C@H]1C[C@H]1CNc1c[nH+]cc(N(C)C)c1 ZINC000639365634 355838133 /nfs/dbraw/zinc/83/81/33/355838133.db2.gz QBSNJYHSLONUMY-UWVGGRQHSA-N 1 2 205.305 2.216 20 0 BEADLO C[C@@H]1C[C@H]1CNc1c[nH+]cc(N(C)C)c1 ZINC000639365636 355838619 /nfs/dbraw/zinc/83/86/19/355838619.db2.gz QBSNJYHSLONUMY-ZJUUUORDSA-N 1 2 205.305 2.216 20 0 BEADLO CCC[C@@H](Cc1ccccc1)[NH2+]Cc1c[nH]nn1 ZINC000628363430 355848475 /nfs/dbraw/zinc/84/84/75/355848475.db2.gz JXNNXWJEQJQEFC-ZDUSSCGKSA-N 1 2 244.342 2.306 20 0 BEADLO CCC[C@@H](Cc1ccccc1)[NH2+]Cc1cn[nH]n1 ZINC000628363430 355848478 /nfs/dbraw/zinc/84/84/78/355848478.db2.gz JXNNXWJEQJQEFC-ZDUSSCGKSA-N 1 2 244.342 2.306 20 0 BEADLO COc1cccc(C)c1C[NH2+]Cc1ncc[nH]1 ZINC000639371090 355866143 /nfs/dbraw/zinc/86/61/43/355866143.db2.gz IDAFAMLZOSWYQF-UHFFFAOYSA-N 1 2 231.299 2.017 20 0 BEADLO CC[C@H](NC(=O)[C@@H]1CC[C@H]2C[C@H]2C1)c1[nH]cc[nH+]1 ZINC000403781198 355868514 /nfs/dbraw/zinc/86/85/14/355868514.db2.gz XWNBXGIKUGLVIX-USZNOCQGSA-N 1 2 247.342 2.413 20 0 BEADLO CC1([NH2+]Cc2cc(Cl)ccc2F)COC1 ZINC000639380186 355916337 /nfs/dbraw/zinc/91/63/37/355916337.db2.gz BLWTWYZUTPHQGS-UHFFFAOYSA-N 1 2 229.682 2.358 20 0 BEADLO CC1([NH2+]Cc2coc(-c3ccccc3)n2)COC1 ZINC000639381586 355922637 /nfs/dbraw/zinc/92/26/37/355922637.db2.gz FRJBLBBINWDKTR-UHFFFAOYSA-N 1 2 244.294 2.220 20 0 BEADLO CCc1cc(NCCc2csc(C)n2)nc[nH+]1 ZINC000223444456 355900319 /nfs/dbraw/zinc/90/03/19/355900319.db2.gz XGEQLFHENBMGPA-UHFFFAOYSA-N 1 2 248.355 2.459 20 0 BEADLO CC[C@@H]([NH2+]Cc1cocn1)c1ccncc1 ZINC000192317973 355983782 /nfs/dbraw/zinc/98/37/82/355983782.db2.gz NOHHDPYLJYJELS-GFCCVEGCSA-N 1 2 217.272 2.311 20 0 BEADLO OCc1cccc(NCc2cccc(F)c2)[nH+]1 ZINC000351420910 355987501 /nfs/dbraw/zinc/98/75/01/355987501.db2.gz SWKLHYUKRMHZBO-UHFFFAOYSA-N 1 2 232.258 2.325 20 0 BEADLO Cc1cccc(CNc2cccc(CO)[nH+]2)c1 ZINC000351423249 355989152 /nfs/dbraw/zinc/98/91/52/355989152.db2.gz UZMNNQJRGWXPDD-UHFFFAOYSA-N 1 2 228.295 2.494 20 0 BEADLO Cc1nc([C@H](C)[N@H+](C)CC(C)(C)C)no1 ZINC000351489516 356000772 /nfs/dbraw/zinc/00/07/72/356000772.db2.gz HNNLQTILCMUCBZ-QMMMGPOBSA-N 1 2 211.309 2.417 20 0 BEADLO Cc1nc([C@H](C)[N@@H+](C)CC(C)(C)C)no1 ZINC000351489516 356000776 /nfs/dbraw/zinc/00/07/76/356000776.db2.gz HNNLQTILCMUCBZ-QMMMGPOBSA-N 1 2 211.309 2.417 20 0 BEADLO CC(C)(C)CCNC(=O)CCCn1cc[nH+]c1 ZINC000623256924 356001680 /nfs/dbraw/zinc/00/16/80/356001680.db2.gz CQVZZRTZILXULC-UHFFFAOYSA-N 1 2 237.347 2.216 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCOC2(CCCC2)C1 ZINC000583641317 355947062 /nfs/dbraw/zinc/94/70/62/355947062.db2.gz MHLJCQGKZSPGPE-UHFFFAOYSA-N 1 2 247.342 2.243 20 0 BEADLO Cc1cnc(C[NH2+][C@@H]2C[C@H]2C(F)(F)F)o1 ZINC000639390860 356033964 /nfs/dbraw/zinc/03/39/64/356033964.db2.gz OPSFKWPSKJLMFA-RNFRBKRXSA-N 1 2 220.194 2.023 20 0 BEADLO Cc1nocc1C[N@@H+](C)Cc1cccc(C)n1 ZINC000351644334 356041789 /nfs/dbraw/zinc/04/17/89/356041789.db2.gz OUHJVMSNQUOJQW-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1nocc1C[N@H+](C)Cc1cccc(C)n1 ZINC000351644334 356041798 /nfs/dbraw/zinc/04/17/98/356041798.db2.gz OUHJVMSNQUOJQW-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CC(C)n1ncnc1C[NH+]1CCC(C)(F)CC1 ZINC000639388438 356017447 /nfs/dbraw/zinc/01/74/47/356017447.db2.gz BEOAALTZYBRKPC-UHFFFAOYSA-N 1 2 240.326 2.183 20 0 BEADLO C/C=C\C[C@H](CO)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000351585075 356021745 /nfs/dbraw/zinc/02/17/45/356021745.db2.gz KPWLHWNJUNDWGU-UMBAGQNISA-N 1 2 246.314 2.005 20 0 BEADLO C[C@H]([NH2+]Cc1cccc2nccn21)c1ccon1 ZINC000351593389 356025587 /nfs/dbraw/zinc/02/55/87/356025587.db2.gz NIICLFAWIBEEIF-JTQLQIEISA-N 1 2 242.282 2.173 20 0 BEADLO CC(C)n1ccnc1C[NH+]1CC(C)(C)C1 ZINC000639393616 356080193 /nfs/dbraw/zinc/08/01/93/356080193.db2.gz PKXSHRKHROWARI-UHFFFAOYSA-N 1 2 207.321 2.306 20 0 BEADLO CCCC(C)(C)CC(=O)N[C@@H]1Cc2c[nH+]cn2C1 ZINC000623259926 356092978 /nfs/dbraw/zinc/09/29/78/356092978.db2.gz ODNQJDOBMUXNLM-LLVKDONJSA-N 1 2 249.358 2.140 20 0 BEADLO C[C@@H]1C[C@@H](C)[N@H+](Cc2noc(C3CC3)n2)C1 ZINC000335917221 356161063 /nfs/dbraw/zinc/16/10/63/356161063.db2.gz GYSMNFGNHVSPHG-RKDXNWHRSA-N 1 2 221.304 2.177 20 0 BEADLO C[C@@H]1C[C@@H](C)[N@@H+](Cc2noc(C3CC3)n2)C1 ZINC000335917221 356161065 /nfs/dbraw/zinc/16/10/65/356161065.db2.gz GYSMNFGNHVSPHG-RKDXNWHRSA-N 1 2 221.304 2.177 20 0 BEADLO Cc1nc(N2CC[C@H]3CCC[C@@H]32)cc[nH+]1 ZINC000336090947 134078494 /nfs/dbraw/zinc/07/84/94/134078494.db2.gz MWKNKFOIWPPCBI-MNOVXSKESA-N 1 2 203.289 2.164 20 0 BEADLO Cc1cc(N2CC[C@@H](C)C(F)(F)C2)nc[nH+]1 ZINC000336098592 134080927 /nfs/dbraw/zinc/08/09/27/134080927.db2.gz PVYMOMHLACHXEJ-MRVPVSSYSA-N 1 2 227.258 2.267 20 0 BEADLO CC[C@]1(O)CC[N@H+](Cc2ncc(Cl)s2)C1 ZINC000336107345 134082907 /nfs/dbraw/zinc/08/29/07/134082907.db2.gz DEAJDSVDAAMJHL-JTQLQIEISA-N 1 2 246.763 2.143 20 0 BEADLO CC[C@]1(O)CC[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000336107345 134082908 /nfs/dbraw/zinc/08/29/08/134082908.db2.gz DEAJDSVDAAMJHL-JTQLQIEISA-N 1 2 246.763 2.143 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@@H]1[C@H]1CCCC[C@@H]1C ZINC000639426699 356208646 /nfs/dbraw/zinc/20/86/46/356208646.db2.gz HOTWEEAVRPMWIC-SRVKXCTJSA-N 1 2 238.375 2.369 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@@H]1[C@H]1CCCC[C@H]1C ZINC000639426704 356208677 /nfs/dbraw/zinc/20/86/77/356208677.db2.gz HOTWEEAVRPMWIC-WOPDTQHZSA-N 1 2 238.375 2.369 20 0 BEADLO CC[C@@H](C)CCNC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000617643033 356255209 /nfs/dbraw/zinc/25/52/09/356255209.db2.gz NGZAABZPFWHYNG-VXGBXAGGSA-N 1 2 237.347 2.387 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCCO[C@H](C)C1 ZINC000639473287 356265699 /nfs/dbraw/zinc/26/56/99/356265699.db2.gz XWUIYJLZEIEJJL-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CCC(F)(F)C[N@H+]1CCCO[C@H](C)C1 ZINC000639473287 356265702 /nfs/dbraw/zinc/26/57/02/356265702.db2.gz XWUIYJLZEIEJJL-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CCc1nc(C[N@H+]2CC(C)=C[C@@H](C)C2)no1 ZINC000336117100 134088896 /nfs/dbraw/zinc/08/88/96/134088896.db2.gz HONLRHXLUMETJJ-SECBINFHSA-N 1 2 221.304 2.030 20 0 BEADLO CCc1nc(C[N@@H+]2CC(C)=C[C@@H](C)C2)no1 ZINC000336117100 134088897 /nfs/dbraw/zinc/08/88/97/134088897.db2.gz HONLRHXLUMETJJ-SECBINFHSA-N 1 2 221.304 2.030 20 0 BEADLO COc1ccccc1C[N@H+](CC(C)=O)C1CC1 ZINC000639455652 356240526 /nfs/dbraw/zinc/24/05/26/356240526.db2.gz SZKUVBNSUFYFKE-UHFFFAOYSA-N 1 2 233.311 2.249 20 0 BEADLO COc1ccccc1C[N@@H+](CC(C)=O)C1CC1 ZINC000639455652 356240527 /nfs/dbraw/zinc/24/05/27/356240527.db2.gz SZKUVBNSUFYFKE-UHFFFAOYSA-N 1 2 233.311 2.249 20 0 BEADLO O=c1cc(C[N@@H+](CC(F)F)C2CC2)cc[nH]1 ZINC000639482028 356296863 /nfs/dbraw/zinc/29/68/63/356296863.db2.gz GTHLMHMFHWEYBT-UHFFFAOYSA-N 1 2 228.242 2.017 20 0 BEADLO O=c1cc(C[N@H+](CC(F)F)C2CC2)cc[nH]1 ZINC000639482028 356296867 /nfs/dbraw/zinc/29/68/67/356296867.db2.gz GTHLMHMFHWEYBT-UHFFFAOYSA-N 1 2 228.242 2.017 20 0 BEADLO C[C@H]1OCC[C@H]1C[N@H+](CC(F)F)C1CC1 ZINC000639483043 356298019 /nfs/dbraw/zinc/29/80/19/356298019.db2.gz PMPXJERCHJIOEU-BDAKNGLRSA-N 1 2 219.275 2.141 20 0 BEADLO C[C@H]1OCC[C@H]1C[N@@H+](CC(F)F)C1CC1 ZINC000639483043 356298023 /nfs/dbraw/zinc/29/80/23/356298023.db2.gz PMPXJERCHJIOEU-BDAKNGLRSA-N 1 2 219.275 2.141 20 0 BEADLO CCCC[C@@H](C)[N@H+](C)Cc1noc(C)n1 ZINC000352413554 356341334 /nfs/dbraw/zinc/34/13/34/356341334.db2.gz AISUPEXACIXZIL-SECBINFHSA-N 1 2 211.309 2.389 20 0 BEADLO CCCC[C@@H](C)[N@@H+](C)Cc1noc(C)n1 ZINC000352413554 356341336 /nfs/dbraw/zinc/34/13/36/356341336.db2.gz AISUPEXACIXZIL-SECBINFHSA-N 1 2 211.309 2.389 20 0 BEADLO CCc1[nH+]c(C)ccc1OCC1(C)COC1 ZINC000352537064 356375926 /nfs/dbraw/zinc/37/59/26/356375926.db2.gz OVSQESLJDDNVQC-UHFFFAOYSA-N 1 2 221.300 2.368 20 0 BEADLO CC[C@@](C)([NH2+]CC(C)=O)c1nc(C)cs1 ZINC000639535207 356387529 /nfs/dbraw/zinc/38/75/29/356387529.db2.gz FCHDKJZRYDFWKE-LLVKDONJSA-N 1 2 226.345 2.255 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2nnc(C(C)C)[nH]2)on1 ZINC000631101684 356420683 /nfs/dbraw/zinc/42/06/83/356420683.db2.gz LTBOFOGSDZORDB-SECBINFHSA-N 1 2 249.318 2.075 20 0 BEADLO CCCC[C@H](CC)C(=O)N[C@@H]1Cc2c[nH+]cn2C1 ZINC000623274823 356408599 /nfs/dbraw/zinc/40/85/99/356408599.db2.gz WBWJVGFOGITWGE-NWDGAFQWSA-N 1 2 249.358 2.140 20 0 BEADLO CC[C@@H]1C[C@@H](Nc2cc[nH+]c(C)n2)CCO1 ZINC000420616024 192248858 /nfs/dbraw/zinc/24/88/58/192248858.db2.gz FZDYPHHGLSWYPH-WDEREUQCSA-N 1 2 221.304 2.155 20 0 BEADLO CC[C@@H]1C[C@@H](Nc2cc[nH+]c(C3CC3)n2)CCO1 ZINC000420623531 192250511 /nfs/dbraw/zinc/25/05/11/192250511.db2.gz VGBWUKMAWWPCCN-NWDGAFQWSA-N 1 2 247.342 2.145 20 0 BEADLO CCC(F)(F)C[N@H+](C)C[C@H]1CCC[C@@H]1O ZINC000639567895 356490444 /nfs/dbraw/zinc/49/04/44/356490444.db2.gz QLRHXHYVDNUZHL-ZJUUUORDSA-N 1 2 221.291 2.125 20 0 BEADLO CCC(F)(F)C[N@@H+](C)C[C@H]1CCC[C@@H]1O ZINC000639567895 356490447 /nfs/dbraw/zinc/49/04/47/356490447.db2.gz QLRHXHYVDNUZHL-ZJUUUORDSA-N 1 2 221.291 2.125 20 0 BEADLO CCCCC[N@@H+]1CCSC[C@@H]1C(=O)OCC ZINC000609798170 356472829 /nfs/dbraw/zinc/47/28/29/356472829.db2.gz FBRUYAXIIXOIRJ-LLVKDONJSA-N 1 2 245.388 2.157 20 0 BEADLO CCCCC[N@H+]1CCSC[C@@H]1C(=O)OCC ZINC000609798170 356472832 /nfs/dbraw/zinc/47/28/32/356472832.db2.gz FBRUYAXIIXOIRJ-LLVKDONJSA-N 1 2 245.388 2.157 20 0 BEADLO CC(=O)C[NH2+][C@@H](c1nc(C)cs1)C1CC1 ZINC000639568592 356494130 /nfs/dbraw/zinc/49/41/30/356494130.db2.gz BSTDNLXHXLASSO-SNVBAGLBSA-N 1 2 224.329 2.081 20 0 BEADLO C1=CC[N@H+](Cc2nc(C3CCC3)no2)CC1 ZINC000639570734 356495122 /nfs/dbraw/zinc/49/51/22/356495122.db2.gz DOCKTLMVWYYUCY-UHFFFAOYSA-N 1 2 219.288 2.099 20 0 BEADLO C1=CC[N@@H+](Cc2nc(C3CCC3)no2)CC1 ZINC000639570734 356495124 /nfs/dbraw/zinc/49/51/24/356495124.db2.gz DOCKTLMVWYYUCY-UHFFFAOYSA-N 1 2 219.288 2.099 20 0 BEADLO CCC[N@H+](CC)Cc1nn(C)cc1Cl ZINC000420900993 192268425 /nfs/dbraw/zinc/26/84/25/192268425.db2.gz JHTAMDQMPJGANQ-UHFFFAOYSA-N 1 2 215.728 2.305 20 0 BEADLO CCC[N@@H+](CC)Cc1nn(C)cc1Cl ZINC000420900993 192268427 /nfs/dbraw/zinc/26/84/27/192268427.db2.gz JHTAMDQMPJGANQ-UHFFFAOYSA-N 1 2 215.728 2.305 20 0 BEADLO CCC(F)(F)C[N@@H+]1CC[C@@H](C)[C@H](OC)C1 ZINC000639603944 356524500 /nfs/dbraw/zinc/52/45/00/356524500.db2.gz IOOPELUITKHNCA-NXEZZACHSA-N 1 2 221.291 2.389 20 0 BEADLO CCC(F)(F)C[N@H+]1CC[C@@H](C)[C@H](OC)C1 ZINC000639603944 356524501 /nfs/dbraw/zinc/52/45/01/356524501.db2.gz IOOPELUITKHNCA-NXEZZACHSA-N 1 2 221.291 2.389 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@H]1CC[C@@H](C)C1 ZINC000336183919 134120563 /nfs/dbraw/zinc/12/05/63/134120563.db2.gz GDLUTQHQBCLYQS-MWLCHTKSSA-N 1 2 233.315 2.122 20 0 BEADLO CCc1nc(CCNc2cc(C)[nH+]cn2)cs1 ZINC000301266531 356516281 /nfs/dbraw/zinc/51/62/81/356516281.db2.gz UFPJRYLXERBDQR-UHFFFAOYSA-N 1 2 248.355 2.459 20 0 BEADLO CCOC1(C)CN(c2[nH+]c3ccccc3n2C)C1 ZINC000336192662 134124245 /nfs/dbraw/zinc/12/42/45/134124245.db2.gz UHDANQIFXKLPGZ-UHFFFAOYSA-N 1 2 245.326 2.189 20 0 BEADLO Cc1cc(C)c(C[N@@H+]2CCOCC23CC3)c(C)n1 ZINC000639632215 356546265 /nfs/dbraw/zinc/54/62/65/356546265.db2.gz YEMPUUYITMSJQZ-UHFFFAOYSA-N 1 2 246.354 2.372 20 0 BEADLO Cc1cc(C)c(C[N@H+]2CCOCC23CC3)c(C)n1 ZINC000639632215 356546268 /nfs/dbraw/zinc/54/62/68/356546268.db2.gz YEMPUUYITMSJQZ-UHFFFAOYSA-N 1 2 246.354 2.372 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+]1CCC(C)(C)C1 ZINC000336192503 134124226 /nfs/dbraw/zinc/12/42/26/134124226.db2.gz PEWLIEBIRBLYMP-QMMMGPOBSA-N 1 2 211.334 2.331 20 0 BEADLO C[C@@H](c1csnn1)[N@H+]1CCC(C)(C)C1 ZINC000336192503 134124227 /nfs/dbraw/zinc/12/42/27/134124227.db2.gz PEWLIEBIRBLYMP-QMMMGPOBSA-N 1 2 211.334 2.331 20 0 BEADLO Cc1ccc(F)c(C[N@@H+]2CCc3n[nH]cc3C2)c1 ZINC000336195110 134125498 /nfs/dbraw/zinc/12/54/98/134125498.db2.gz JSJRIQDTGOYOJQ-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1ccc(F)c(C[N@H+]2CCc3n[nH]cc3C2)c1 ZINC000336195110 134125499 /nfs/dbraw/zinc/12/54/99/134125499.db2.gz JSJRIQDTGOYOJQ-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CCO[C@@H](C)[C@H]2C)cn1 ZINC000179678256 366283839 /nfs/dbraw/zinc/28/38/39/366283839.db2.gz HZCYXLAFECLTEV-NEPJUHHUSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)n1cc(C[N@H+]2CCO[C@@H](C)[C@H]2C)cn1 ZINC000179678256 366283842 /nfs/dbraw/zinc/28/38/42/366283842.db2.gz HZCYXLAFECLTEV-NEPJUHHUSA-N 1 2 237.347 2.073 20 0 BEADLO CCc1cc(NC[C@@H]2CCSC2)nc[nH+]1 ZINC000228582178 491095699 /nfs/dbraw/zinc/09/56/99/491095699.db2.gz YGETZOTZLMPCNO-VIFPVBQESA-N 1 2 223.345 2.204 20 0 BEADLO CCc1nc(C[N@@H+]2CC[C@]23CCOC3)cs1 ZINC000421023259 192305530 /nfs/dbraw/zinc/30/55/30/192305530.db2.gz BDZQBNYYPLELRH-GFCCVEGCSA-N 1 2 238.356 2.070 20 0 BEADLO CCc1nc(C[N@H+]2CC[C@]23CCOC3)cs1 ZINC000421023259 192305531 /nfs/dbraw/zinc/30/55/31/192305531.db2.gz BDZQBNYYPLELRH-GFCCVEGCSA-N 1 2 238.356 2.070 20 0 BEADLO Fc1ccc(C[N@@H+]2CC[C@]23CCOC3)cc1F ZINC000421030671 192309314 /nfs/dbraw/zinc/30/93/14/192309314.db2.gz YZTHRMMFZULTIN-CYBMUJFWSA-N 1 2 239.265 2.330 20 0 BEADLO Fc1ccc(C[N@H+]2CC[C@]23CCOC3)cc1F ZINC000421030671 192309315 /nfs/dbraw/zinc/30/93/15/192309315.db2.gz YZTHRMMFZULTIN-CYBMUJFWSA-N 1 2 239.265 2.330 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]21 ZINC000449893475 202050477 /nfs/dbraw/zinc/05/04/77/202050477.db2.gz XZKOHMSHPFQNSE-AGIUHOORSA-N 1 2 244.338 2.441 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nc(C3CCC3)no2)[C@H]1C ZINC000639657458 356572743 /nfs/dbraw/zinc/57/27/43/356572743.db2.gz ZFNPBKCNOJXZRY-BDAKNGLRSA-N 1 2 221.304 2.177 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nc(C3CCC3)no2)[C@H]1C ZINC000639657458 356572745 /nfs/dbraw/zinc/57/27/45/356572745.db2.gz ZFNPBKCNOJXZRY-BDAKNGLRSA-N 1 2 221.304 2.177 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@]1(C)CC=CCC1 ZINC000336210813 134134342 /nfs/dbraw/zinc/13/43/42/134134342.db2.gz IMMIAAUCJPYMJA-CYBMUJFWSA-N 1 2 233.315 2.081 20 0 BEADLO COc1ccc[nH+]c1N1C[C@@H](C)S[C@@H](C)C1 ZINC000624003451 363496865 /nfs/dbraw/zinc/49/68/65/363496865.db2.gz ZMMTZTOYTIBNSD-AOOOYVTPSA-N 1 2 238.356 2.420 20 0 BEADLO O=C(CSC1CC1)Nc1cccc2[nH+]ccn21 ZINC000449948808 202058641 /nfs/dbraw/zinc/05/86/41/202058641.db2.gz MYVNADXQQUUHTH-UHFFFAOYSA-N 1 2 247.323 2.168 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccnn2C2CCCC2)CCO1 ZINC000336216012 134137001 /nfs/dbraw/zinc/13/70/01/134137001.db2.gz VAFGVQIECCHEHQ-GFCCVEGCSA-N 1 2 249.358 2.219 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccnn2C2CCCC2)CCO1 ZINC000336216012 134137002 /nfs/dbraw/zinc/13/70/02/134137002.db2.gz VAFGVQIECCHEHQ-GFCCVEGCSA-N 1 2 249.358 2.219 20 0 BEADLO CC[C@@H](NC(=O)C1CC2(CC2)C1)c1[nH]cc[nH+]1 ZINC000613579275 363521692 /nfs/dbraw/zinc/52/16/92/363521692.db2.gz KWFPXYHHWWJYDR-SNVBAGLBSA-N 1 2 233.315 2.167 20 0 BEADLO CC[N@H+](C[C@H]1CCCO1)[C@@H](C)c1csnn1 ZINC000450322769 202128585 /nfs/dbraw/zinc/12/85/85/202128585.db2.gz BLRNTJPUWYPUBR-VHSXEESVSA-N 1 2 241.360 2.100 20 0 BEADLO CC[N@@H+](C[C@H]1CCCO1)[C@@H](C)c1csnn1 ZINC000450322769 202128586 /nfs/dbraw/zinc/12/85/86/202128586.db2.gz BLRNTJPUWYPUBR-VHSXEESVSA-N 1 2 241.360 2.100 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)c1ccccc1Cl ZINC000041534531 358511120 /nfs/dbraw/zinc/51/11/20/358511120.db2.gz XPRCAAWOZBYNSE-UHFFFAOYSA-N 1 2 249.701 2.004 20 0 BEADLO COC(=O)C(C)(C)[NH2+]CC1=CCCCC1 ZINC000450346452 202136867 /nfs/dbraw/zinc/13/68/67/202136867.db2.gz HIAGGZNQDRGHBA-UHFFFAOYSA-N 1 2 211.305 2.028 20 0 BEADLO C[C@@H]([NH2+]Cc1cccnc1)C(C)(F)F ZINC000389458493 356678855 /nfs/dbraw/zinc/67/88/55/356678855.db2.gz CLUUWBZSAQDSHB-MRVPVSSYSA-N 1 2 200.232 2.215 20 0 BEADLO CC[C@H]1CN(C(=O)Nc2cc[nH+]c(C)c2)CCO1 ZINC000179835282 366320685 /nfs/dbraw/zinc/32/06/85/366320685.db2.gz RMLDNOKCJLESIS-LBPRGKRZSA-N 1 2 249.314 2.033 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCC[C@@H]1CF ZINC000578143327 366322952 /nfs/dbraw/zinc/32/29/52/366322952.db2.gz KXJYYHXOAYNZJK-SNVBAGLBSA-N 1 2 209.268 2.032 20 0 BEADLO C[C@H]([NH2+][C@H]1C[C@@H](C)N(C2CC2)C1)C(C)(F)F ZINC000389480482 356689114 /nfs/dbraw/zinc/68/91/14/356689114.db2.gz FIZTZDAVBNZPMT-UTLUCORTSA-N 1 2 232.318 2.245 20 0 BEADLO COCCSCc1c[nH+]c2ccccn12 ZINC000179901315 366332120 /nfs/dbraw/zinc/33/21/20/366332120.db2.gz BEHFIQXCQCWIOJ-UHFFFAOYSA-N 1 2 222.313 2.214 20 0 BEADLO Cc1cc(NC2CC(C)(C)C2)c(C#N)c[nH+]1 ZINC000399434434 356700318 /nfs/dbraw/zinc/70/03/18/356700318.db2.gz JZYKYZPDDVKMGE-UHFFFAOYSA-N 1 2 215.300 2.284 20 0 BEADLO Cc1cc(NC[C@@H](C)C2CC2)c(C#N)c[nH+]1 ZINC000399442898 356700983 /nfs/dbraw/zinc/70/09/83/356700983.db2.gz LGCAVMDJTKVSLR-SECBINFHSA-N 1 2 215.300 2.142 20 0 BEADLO Cc1[nH+]ccn1Cc1nnc(-c2cccs2)[nH]1 ZINC000180014055 366354343 /nfs/dbraw/zinc/35/43/43/366354343.db2.gz VCMSGCVPWRCNKV-UHFFFAOYSA-N 1 2 245.311 2.086 20 0 BEADLO Fc1cncc(C[N@@H+]2CCC[C@H]2c2cn[nH]c2)c1 ZINC000639778785 356726898 /nfs/dbraw/zinc/72/68/98/356726898.db2.gz UIOSNLMDUSCJLM-ZDUSSCGKSA-N 1 2 246.289 2.281 20 0 BEADLO Fc1cncc(C[N@H+]2CCC[C@H]2c2cn[nH]c2)c1 ZINC000639778785 356726901 /nfs/dbraw/zinc/72/69/01/356726901.db2.gz UIOSNLMDUSCJLM-ZDUSSCGKSA-N 1 2 246.289 2.281 20 0 BEADLO Cc1ncccc1C[N@H+](C)Cc1ccns1 ZINC000639806818 356777862 /nfs/dbraw/zinc/77/78/62/356777862.db2.gz GVSGFCPWGQWKAK-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ncccc1C[N@@H+](C)Cc1ccns1 ZINC000639806818 356777866 /nfs/dbraw/zinc/77/78/66/356777866.db2.gz GVSGFCPWGQWKAK-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CC1(C)C[N@H+](Cc2cocn2)[C@@H]1[C@H]1CCCO1 ZINC000356239350 356791769 /nfs/dbraw/zinc/79/17/69/356791769.db2.gz PQBXZFGMQWIXSN-VXGBXAGGSA-N 1 2 236.315 2.064 20 0 BEADLO CC1(C)C[N@@H+](Cc2cocn2)[C@@H]1[C@H]1CCCO1 ZINC000356239350 356791771 /nfs/dbraw/zinc/79/17/71/356791771.db2.gz PQBXZFGMQWIXSN-VXGBXAGGSA-N 1 2 236.315 2.064 20 0 BEADLO CC1(C)C[N@H+](Cc2cocn2)[C@@H]1[C@@H]1CCCO1 ZINC000356239347 356791799 /nfs/dbraw/zinc/79/17/99/356791799.db2.gz PQBXZFGMQWIXSN-NWDGAFQWSA-N 1 2 236.315 2.064 20 0 BEADLO CC1(C)C[N@@H+](Cc2cocn2)[C@@H]1[C@@H]1CCCO1 ZINC000356239347 356791803 /nfs/dbraw/zinc/79/18/03/356791803.db2.gz PQBXZFGMQWIXSN-NWDGAFQWSA-N 1 2 236.315 2.064 20 0 BEADLO CCc1nc(C[N@H+](C)[C@H](C)C2CCC2)no1 ZINC000357028042 356812544 /nfs/dbraw/zinc/81/25/44/356812544.db2.gz AKGIWSRXIRYOFG-SECBINFHSA-N 1 2 223.320 2.252 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@H](C)C2CCC2)no1 ZINC000357028042 356812545 /nfs/dbraw/zinc/81/25/45/356812545.db2.gz AKGIWSRXIRYOFG-SECBINFHSA-N 1 2 223.320 2.252 20 0 BEADLO CO[C@@H]1C[N@@H+]([C@@H](C)c2ccccc2F)CCO1 ZINC000639832344 356817574 /nfs/dbraw/zinc/81/75/74/356817574.db2.gz GHJKCMXJJRSAHT-GWCFXTLKSA-N 1 2 239.290 2.191 20 0 BEADLO CO[C@@H]1C[N@H+]([C@@H](C)c2ccccc2F)CCO1 ZINC000639832344 356817575 /nfs/dbraw/zinc/81/75/75/356817575.db2.gz GHJKCMXJJRSAHT-GWCFXTLKSA-N 1 2 239.290 2.191 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NCCC1CCCCC1 ZINC000350916528 538691997 /nfs/dbraw/zinc/69/19/97/538691997.db2.gz DSOHAVKKVBFEJU-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NCCC1CCCCC1 ZINC000350916528 538692000 /nfs/dbraw/zinc/69/20/00/538692000.db2.gz DSOHAVKKVBFEJU-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO CO[C@H]1C[N@@H+]([C@H](C)c2cccc(F)c2)CCO1 ZINC000639834323 356819058 /nfs/dbraw/zinc/81/90/58/356819058.db2.gz WFWDTSQUUDEUJJ-ZWNOBZJWSA-N 1 2 239.290 2.191 20 0 BEADLO CO[C@H]1C[N@H+]([C@H](C)c2cccc(F)c2)CCO1 ZINC000639834323 356819063 /nfs/dbraw/zinc/81/90/63/356819063.db2.gz WFWDTSQUUDEUJJ-ZWNOBZJWSA-N 1 2 239.290 2.191 20 0 BEADLO CO[C@H]1C[N@@H+]([C@@H](C)c2ccc(F)cc2)CCO1 ZINC000639836593 356822227 /nfs/dbraw/zinc/82/22/27/356822227.db2.gz UZFMGBDJIUPTFB-GXFFZTMASA-N 1 2 239.290 2.191 20 0 BEADLO CO[C@H]1C[N@H+]([C@@H](C)c2ccc(F)cc2)CCO1 ZINC000639836593 356822231 /nfs/dbraw/zinc/82/22/31/356822231.db2.gz UZFMGBDJIUPTFB-GXFFZTMASA-N 1 2 239.290 2.191 20 0 BEADLO CO[C@@H]1C[N@H+](Cc2cc(C)cc(C)c2)CCO1 ZINC000639837034 356826099 /nfs/dbraw/zinc/82/60/99/356826099.db2.gz XHUGUAFELCPKNR-AWEZNQCLSA-N 1 2 235.327 2.108 20 0 BEADLO CO[C@@H]1C[N@@H+](Cc2cc(C)cc(C)c2)CCO1 ZINC000639837034 356826103 /nfs/dbraw/zinc/82/61/03/356826103.db2.gz XHUGUAFELCPKNR-AWEZNQCLSA-N 1 2 235.327 2.108 20 0 BEADLO c1cnc([C@H]2CCC[N@H+]2Cc2ccncc2)nc1 ZINC000639843286 356839133 /nfs/dbraw/zinc/83/91/33/356839133.db2.gz PAKCKRIFYHQHOP-CYBMUJFWSA-N 1 2 240.310 2.209 20 0 BEADLO c1cnc([C@H]2CCC[N@@H+]2Cc2ccncc2)nc1 ZINC000639843286 356839134 /nfs/dbraw/zinc/83/91/34/356839134.db2.gz PAKCKRIFYHQHOP-CYBMUJFWSA-N 1 2 240.310 2.209 20 0 BEADLO CC(C)CNC(=O)C[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000361089400 356916943 /nfs/dbraw/zinc/91/69/43/356916943.db2.gz VOGBUMFDNYOHJW-LBPRGKRZSA-N 1 2 246.354 2.335 20 0 BEADLO CC(C)CNC(=O)C[N@H+]1Cc2ccccc2[C@@H]1C ZINC000361089400 356916946 /nfs/dbraw/zinc/91/69/46/356916946.db2.gz VOGBUMFDNYOHJW-LBPRGKRZSA-N 1 2 246.354 2.335 20 0 BEADLO C[C@@H]([NH2+]Cc1cscn1)c1ccccn1 ZINC000040420956 356938820 /nfs/dbraw/zinc/93/88/20/356938820.db2.gz BBHPOWHFWVZSAQ-SECBINFHSA-N 1 2 219.313 2.389 20 0 BEADLO c1ncc(C[N@@H+]2CCC[C@@H]2c2ncccn2)s1 ZINC000639865291 356962820 /nfs/dbraw/zinc/96/28/20/356962820.db2.gz GTOWWGRWZYYPOT-LLVKDONJSA-N 1 2 246.339 2.270 20 0 BEADLO c1ncc(C[N@H+]2CCC[C@@H]2c2ncccn2)s1 ZINC000639865291 356962825 /nfs/dbraw/zinc/96/28/25/356962825.db2.gz GTOWWGRWZYYPOT-LLVKDONJSA-N 1 2 246.339 2.270 20 0 BEADLO CCOC1(C)CN(c2cc[nH+]c(C(C)C)n2)C1 ZINC000450576278 202202732 /nfs/dbraw/zinc/20/27/32/202202732.db2.gz BTIPOWOBKWCURI-UHFFFAOYSA-N 1 2 235.331 2.215 20 0 BEADLO CC(C)CNC(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000117565147 356981108 /nfs/dbraw/zinc/98/11/08/356981108.db2.gz WEEJZJAKALYLCQ-UHFFFAOYSA-N 1 2 243.310 2.258 20 0 BEADLO OCCCCc1[nH]c2ccc(F)cc2[nH+]1 ZINC000026462194 357135767 /nfs/dbraw/zinc/13/57/67/357135767.db2.gz OVQVGMAHZSEMCY-UHFFFAOYSA-N 1 2 208.236 2.017 20 0 BEADLO Cc1[nH]ncc1C[NH+]1C[C@@H](C)C(F)(F)[C@H](C)C1 ZINC000628390077 357186272 /nfs/dbraw/zinc/18/62/72/357186272.db2.gz CIEQPERPOTYODV-RKDXNWHRSA-N 1 2 243.301 2.441 20 0 BEADLO Cc1[nH]ncc1C[NH+]1C[C@H](C)C(F)(F)[C@@H](C)C1 ZINC000628390076 357186692 /nfs/dbraw/zinc/18/66/92/357186692.db2.gz CIEQPERPOTYODV-IUCAKERBSA-N 1 2 243.301 2.441 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCCCOC(C)C ZINC000583704049 357283719 /nfs/dbraw/zinc/28/37/19/357283719.db2.gz STAWUDVCNVYBNO-UHFFFAOYSA-N 1 2 237.347 2.132 20 0 BEADLO CC[C@@H](NCC(C)(F)F)c1[nH+]ccn1C ZINC000393544057 357287333 /nfs/dbraw/zinc/28/73/33/357287333.db2.gz GIECMOBYJCCAKH-MRVPVSSYSA-N 1 2 217.263 2.116 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@H]1CCCC12CC2 ZINC000639899967 357310388 /nfs/dbraw/zinc/31/03/88/357310388.db2.gz NEABXFYBTOOINH-LBPRGKRZSA-N 1 2 245.326 2.266 20 0 BEADLO CC(C)[N@H+](C)Cc1nc([C@H]2CCCS2)no1 ZINC000357092732 538825743 /nfs/dbraw/zinc/82/57/43/538825743.db2.gz XJTFQBROBKPNBW-SECBINFHSA-N 1 2 241.360 2.478 20 0 BEADLO CC(C)[N@@H+](C)Cc1nc([C@H]2CCCS2)no1 ZINC000357092732 538825748 /nfs/dbraw/zinc/82/57/48/538825748.db2.gz XJTFQBROBKPNBW-SECBINFHSA-N 1 2 241.360 2.478 20 0 BEADLO C[C@@H]1C[C@@H](C)[C@H](C)N(C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000357146623 538825970 /nfs/dbraw/zinc/82/59/70/538825970.db2.gz ZBZQUQNLBWYAID-UTUOFQBUSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H]1C[C@@H](C)[C@H](C)N(C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000357146623 538825975 /nfs/dbraw/zinc/82/59/75/538825975.db2.gz ZBZQUQNLBWYAID-UTUOFQBUSA-N 1 2 249.358 2.235 20 0 BEADLO COc1ccccc1C[NH+]1CC2(C1)CCCO2 ZINC000628426686 357255048 /nfs/dbraw/zinc/25/50/48/357255048.db2.gz FZKKUCFRZFUULI-UHFFFAOYSA-N 1 2 233.311 2.060 20 0 BEADLO CCOc1cccc(C[NH+]2CC3(C2)CCCO3)c1 ZINC000628426916 357257584 /nfs/dbraw/zinc/25/75/84/357257584.db2.gz UQJKXQVPCCDFKL-UHFFFAOYSA-N 1 2 247.338 2.450 20 0 BEADLO CC(C)(C)c1n[nH]cc1C[NH+]1CC2(C1)CCCO2 ZINC000628426996 357258366 /nfs/dbraw/zinc/25/83/66/357258366.db2.gz YWOPIPDGRINQBA-UHFFFAOYSA-N 1 2 249.358 2.072 20 0 BEADLO CC1=CCCN(C(=O)C[C@H](C)n2cc[nH+]c2)C1 ZINC000583698415 357272841 /nfs/dbraw/zinc/27/28/41/357272841.db2.gz ZKGOGOLXPWKHDX-LBPRGKRZSA-N 1 2 233.315 2.013 20 0 BEADLO Cc1cc(NC(=O)N[C@]23C[C@H]2CCCC3)cc[nH+]1 ZINC000639900177 357312577 /nfs/dbraw/zinc/31/25/77/357312577.db2.gz JHZLHLZUXUYSNB-BXUZGUMPSA-N 1 2 245.326 2.266 20 0 BEADLO CC1=C(C)C[C@H](C(=O)NCCc2[nH]cc[nH+]2)CC1 ZINC000582547920 357332456 /nfs/dbraw/zinc/33/24/56/357332456.db2.gz PPWFOHICRRSCIS-GFCCVEGCSA-N 1 2 247.342 2.205 20 0 BEADLO CCN(C(=O)Cn1cc[nH+]c1)c1ccccc1C ZINC000073180604 357358958 /nfs/dbraw/zinc/35/89/58/357358958.db2.gz NRWDWESREBWNOR-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO CCc1cc(NCCCc2c[nH]nc2C)nc[nH+]1 ZINC000050182945 357386818 /nfs/dbraw/zinc/38/68/18/357386818.db2.gz PPFKOMSRPOQQCI-UHFFFAOYSA-N 1 2 245.330 2.115 20 0 BEADLO CCCCNC(=O)C[N@H+](CC)Cc1ccoc1 ZINC000102409019 357389149 /nfs/dbraw/zinc/38/91/49/357389149.db2.gz NQVSWBGKXVTBQF-UHFFFAOYSA-N 1 2 238.331 2.018 20 0 BEADLO CCCCNC(=O)C[N@@H+](CC)Cc1ccoc1 ZINC000102409019 357389154 /nfs/dbraw/zinc/38/91/54/357389154.db2.gz NQVSWBGKXVTBQF-UHFFFAOYSA-N 1 2 238.331 2.018 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CC(C)=C[C@H](C)C1 ZINC000582855976 357421919 /nfs/dbraw/zinc/42/19/19/357421919.db2.gz HOMRVKJCOHLKSG-VIFPVBQESA-N 1 2 217.316 2.496 20 0 BEADLO Cc1nc(N2CCC[C@@H]2[C@@H]2CCCOC2)cc[nH+]1 ZINC000582902730 357425803 /nfs/dbraw/zinc/42/58/03/357425803.db2.gz KWDNRIPBQMULBE-CHWSQXEVSA-N 1 2 247.342 2.180 20 0 BEADLO CC(C)=CCCNC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000583094333 357478742 /nfs/dbraw/zinc/47/87/42/357478742.db2.gz SRZGJVOJFLDVMI-NSHDSACASA-N 1 2 235.331 2.061 20 0 BEADLO CC(C)=CCCNC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000583094333 357478745 /nfs/dbraw/zinc/47/87/45/357478745.db2.gz SRZGJVOJFLDVMI-NSHDSACASA-N 1 2 235.331 2.061 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCC[C@H](F)C1 ZINC000583095149 357479177 /nfs/dbraw/zinc/47/91/77/357479177.db2.gz YUKHRCORVPENBY-JTQLQIEISA-N 1 2 209.268 2.032 20 0 BEADLO COc1ccc[nH+]c1N1CCS[C@H](C)C1 ZINC000623938681 357517594 /nfs/dbraw/zinc/51/75/94/357517594.db2.gz YXQZRCSFHXCWAT-SECBINFHSA-N 1 2 224.329 2.032 20 0 BEADLO CCCc1nc(C[NH+]2CCC(C)CC2)no1 ZINC000054982863 363583577 /nfs/dbraw/zinc/58/35/77/363583577.db2.gz XITRBIQWECDZLM-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO Cc1nocc1C[NH2+]Cc1ccn(C(C)C)n1 ZINC000397840842 357729795 /nfs/dbraw/zinc/72/97/95/357729795.db2.gz BSXPXBLHAYESQN-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO CC[C@H](C)CNc1nc[nH+]c(N)c1Cl ZINC000233978450 357764445 /nfs/dbraw/zinc/76/44/45/357764445.db2.gz NPNHBALGXHMCPL-LURJTMIESA-N 1 2 214.700 2.170 20 0 BEADLO CC[C@H](C)CNc1[nH+]cnc(N)c1Cl ZINC000233978450 357764450 /nfs/dbraw/zinc/76/44/50/357764450.db2.gz NPNHBALGXHMCPL-LURJTMIESA-N 1 2 214.700 2.170 20 0 BEADLO c1cnc(C[N@@H+]2CCC[C@@H]2c2ccncc2)nc1 ZINC000192134136 357824360 /nfs/dbraw/zinc/82/43/60/357824360.db2.gz IODQERBKUXEDJY-CYBMUJFWSA-N 1 2 240.310 2.209 20 0 BEADLO c1cnc(C[N@H+]2CCC[C@@H]2c2ccncc2)nc1 ZINC000192134136 357824364 /nfs/dbraw/zinc/82/43/64/357824364.db2.gz IODQERBKUXEDJY-CYBMUJFWSA-N 1 2 240.310 2.209 20 0 BEADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1ncccn1 ZINC000192135439 357824509 /nfs/dbraw/zinc/82/45/09/357824509.db2.gz SESHLYCHKVGZOJ-NSHDSACASA-N 1 2 228.299 2.065 20 0 BEADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1ncccn1 ZINC000192135439 357824511 /nfs/dbraw/zinc/82/45/11/357824511.db2.gz SESHLYCHKVGZOJ-NSHDSACASA-N 1 2 228.299 2.065 20 0 BEADLO C[C@@H]1C[C@H](Nc2nc[nH+]c(N)c2Cl)CS1 ZINC000397998562 357821543 /nfs/dbraw/zinc/82/15/43/357821543.db2.gz RKYNSLDUQJKVFL-RITPCOANSA-N 1 2 244.751 2.018 20 0 BEADLO C[C@@H]1C[C@H](Nc2[nH+]cnc(N)c2Cl)CS1 ZINC000397998562 357821544 /nfs/dbraw/zinc/82/15/44/357821544.db2.gz RKYNSLDUQJKVFL-RITPCOANSA-N 1 2 244.751 2.018 20 0 BEADLO COc1cc(C)c(CNc2c[nH]c[nH+]2)c(C)n1 ZINC000583294308 357860364 /nfs/dbraw/zinc/86/03/64/357860364.db2.gz BLSOKTWTBNUPEM-UHFFFAOYSA-N 1 2 232.287 2.042 20 0 BEADLO CC[C@@H]([NH2+]Cc1ncccn1)c1c(C)noc1C ZINC000192179680 357826232 /nfs/dbraw/zinc/82/62/32/357826232.db2.gz LATUVDCLLWDMAK-LLVKDONJSA-N 1 2 246.314 2.322 20 0 BEADLO C[C@H]1CCCC[C@@H]1C[N@H+](CCO)CC(F)F ZINC000193024912 357864905 /nfs/dbraw/zinc/86/49/05/357864905.db2.gz FCFSPRBFKOCQDB-WDEREUQCSA-N 1 2 235.318 2.372 20 0 BEADLO C[C@H]1CCCC[C@@H]1C[N@@H+](CCO)CC(F)F ZINC000193024912 357864907 /nfs/dbraw/zinc/86/49/07/357864907.db2.gz FCFSPRBFKOCQDB-WDEREUQCSA-N 1 2 235.318 2.372 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)CCc1cccc(C)n1 ZINC000639972358 358031351 /nfs/dbraw/zinc/03/13/51/358031351.db2.gz PPZUURSTJJVMRB-UHFFFAOYSA-N 1 2 244.342 2.096 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)CCc1cccc(C)n1 ZINC000639972358 358031353 /nfs/dbraw/zinc/03/13/53/358031353.db2.gz PPZUURSTJJVMRB-UHFFFAOYSA-N 1 2 244.342 2.096 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@@H](CCF)C2)o1 ZINC000628458088 358040335 /nfs/dbraw/zinc/04/03/35/358040335.db2.gz CAXVMKAZHRSASW-LBPRGKRZSA-N 1 2 241.306 2.402 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@@H](CCF)C2)o1 ZINC000628458088 358040338 /nfs/dbraw/zinc/04/03/38/358040338.db2.gz CAXVMKAZHRSASW-LBPRGKRZSA-N 1 2 241.306 2.402 20 0 BEADLO CSCCNC(=O)Nc1ccc(C)[nH+]c1C ZINC000610674901 358061536 /nfs/dbraw/zinc/06/15/36/358061536.db2.gz FEHQPGJULZPNFS-UHFFFAOYSA-N 1 2 239.344 2.183 20 0 BEADLO CC[C@H](C)C[NH2+]c1ccc(-n2cnnn2)c(C)c1 ZINC000037103988 358065280 /nfs/dbraw/zinc/06/52/80/358065280.db2.gz YMRAWOOXNQYCQK-JTQLQIEISA-N 1 2 245.330 2.429 20 0 BEADLO CC[C@@H](NC(=O)[C@H]1CC1(C)C)c1[nH]cc[nH+]1 ZINC000218082969 134251682 /nfs/dbraw/zinc/25/16/82/134251682.db2.gz RRBMQCHRYHMDRU-RKDXNWHRSA-N 1 2 221.304 2.023 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N[C@H]1CCC(C)(C)C1 ZINC000583881015 358115257 /nfs/dbraw/zinc/11/52/57/358115257.db2.gz PSSIBNJRXPLPLC-QWRGUYRKSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N[C@H]1CCC(C)(C)C1 ZINC000583881015 358115258 /nfs/dbraw/zinc/11/52/58/358115258.db2.gz PSSIBNJRXPLPLC-QWRGUYRKSA-N 1 2 249.358 2.283 20 0 BEADLO CCN(Cc1c[nH+]cn1C)[C@@H](C)C(F)(F)F ZINC000640053860 358142288 /nfs/dbraw/zinc/14/22/88/358142288.db2.gz XQAYKDQRSCHKIO-QMMMGPOBSA-N 1 2 235.253 2.193 20 0 BEADLO C[C@H]([NH2+]CC(F)F)c1ccc2[nH]c(=O)oc2c1 ZINC000640061381 358150433 /nfs/dbraw/zinc/15/04/33/358150433.db2.gz SPWLCZCNHRATFQ-LURJTMIESA-N 1 2 242.225 2.449 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)Nc1nc(C)cc(C)n1 ZINC000584701592 358154778 /nfs/dbraw/zinc/15/47/78/358154778.db2.gz PVBBNTWEDNUSLS-LLVKDONJSA-N 1 2 245.330 2.483 20 0 BEADLO CC1(F)CC[NH+](Cc2nnc(C3CC3)o2)CC1 ZINC000640070286 358155870 /nfs/dbraw/zinc/15/58/70/358155870.db2.gz ATCVCLRIYBWYDV-UHFFFAOYSA-N 1 2 239.294 2.271 20 0 BEADLO C[C@H](CC(=O)N1CCCC[C@H](C)C1)n1cc[nH+]c1 ZINC000584783330 358176927 /nfs/dbraw/zinc/17/69/27/358176927.db2.gz BCTZVAFTYXXPSJ-QWHCGFSZSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1cc(N[C@H]2CCOC2(C)C)nc(C2CC2)[nH+]1 ZINC000450636688 202220198 /nfs/dbraw/zinc/22/01/98/202220198.db2.gz FEACUDYPYGYZFU-NSHDSACASA-N 1 2 247.342 2.064 20 0 BEADLO C[C@H](Cc1nc(CCC2CC2)no1)n1cc[nH+]c1 ZINC000351433245 358201449 /nfs/dbraw/zinc/20/14/49/358201449.db2.gz RNBPXRGAASOSAC-SNVBAGLBSA-N 1 2 246.314 2.412 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@H](OC(F)F)C2)oc1C ZINC000558864054 491125015 /nfs/dbraw/zinc/12/50/15/491125015.db2.gz LSBVOSPJUICOOC-VIFPVBQESA-N 1 2 246.257 2.105 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@H](OC(F)F)C2)oc1C ZINC000558864054 491125016 /nfs/dbraw/zinc/12/50/16/491125016.db2.gz LSBVOSPJUICOOC-VIFPVBQESA-N 1 2 246.257 2.105 20 0 BEADLO C[C@H](O)CC[N@H+](CC(F)F)CC1CCC1 ZINC000450635258 202220991 /nfs/dbraw/zinc/22/09/91/202220991.db2.gz JFPMRTRHTNJBPB-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO C[C@H](O)CC[N@@H+](CC(F)F)CC1CCC1 ZINC000450635258 202220993 /nfs/dbraw/zinc/22/09/93/202220993.db2.gz JFPMRTRHTNJBPB-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO CC/C=C\CNc1cc[nH+]c(C(C)C)n1 ZINC000450687879 202233648 /nfs/dbraw/zinc/23/36/48/202233648.db2.gz BQEUPRJPKVFEMC-WAYWQWQTSA-N 1 2 205.305 2.400 20 0 BEADLO CC/C=C/CNc1cc[nH+]c(C(C)C)n1 ZINC000450687878 202233694 /nfs/dbraw/zinc/23/36/94/202233694.db2.gz BQEUPRJPKVFEMC-AATRIKPKSA-N 1 2 205.305 2.400 20 0 BEADLO Cc1cc(N2C[C@@H]3[C@@H]4C=C[C@@H](C4)[C@]3(C)C2)nc[nH+]1 ZINC000450698841 202236149 /nfs/dbraw/zinc/23/61/49/202236149.db2.gz XXLLQSXLGCGJRY-COMQUAJESA-N 1 2 241.338 2.433 20 0 BEADLO Cc1ncc([C@H](C)[NH2+]Cc2cc[nH]n2)s1 ZINC000090408775 491126347 /nfs/dbraw/zinc/12/63/47/491126347.db2.gz GCTNXUQPRNNBBS-ZETCQYMHSA-N 1 2 222.317 2.025 20 0 BEADLO C[C@@H]([NH2+]Cc1c[nH]nn1)[C@@H](C)C1CCCCC1 ZINC000450728006 202250140 /nfs/dbraw/zinc/25/01/40/202250140.db2.gz NUCQAPXNRVNDLU-GHMZBOCLSA-N 1 2 236.363 2.499 20 0 BEADLO C[C@@H]([NH2+]Cc1cn[nH]n1)[C@@H](C)C1CCCCC1 ZINC000450728006 202250143 /nfs/dbraw/zinc/25/01/43/202250143.db2.gz NUCQAPXNRVNDLU-GHMZBOCLSA-N 1 2 236.363 2.499 20 0 BEADLO COC(=O)c1ccc(-c2ccc[nH+]c2N)cc1F ZINC000584597946 358255865 /nfs/dbraw/zinc/25/58/65/358255865.db2.gz VMDDLIHKHDRNSB-UHFFFAOYSA-N 1 2 246.241 2.257 20 0 BEADLO CC[C@@](C)(CNc1cc[nH+]c(C2CC2)n1)OC ZINC000450713844 202241699 /nfs/dbraw/zinc/24/16/99/202241699.db2.gz KNGVANVIYGWALF-ZDUSSCGKSA-N 1 2 235.331 2.003 20 0 BEADLO Cc1cccc(C)c1[C@@H](C)[NH2+]Cc1c[nH]nn1 ZINC000450748056 202253805 /nfs/dbraw/zinc/25/38/05/202253805.db2.gz RIUUHJQEUZNNDL-LLVKDONJSA-N 1 2 230.315 2.272 20 0 BEADLO Cc1cccc(C)c1[C@@H](C)[NH2+]Cc1cn[nH]n1 ZINC000450748056 202253808 /nfs/dbraw/zinc/25/38/08/202253808.db2.gz RIUUHJQEUZNNDL-LLVKDONJSA-N 1 2 230.315 2.272 20 0 BEADLO CCO[C@@H]1CCN(c2cc(C)[nH+]cn2)C[C@@H]1C ZINC000450744260 202254602 /nfs/dbraw/zinc/25/46/02/202254602.db2.gz LROKVGXZCQJKNS-CMPLNLGQSA-N 1 2 235.331 2.036 20 0 BEADLO CCC(CC)(CC)NC(=O)Cc1c[nH+]cn1C ZINC000547606783 325374931 /nfs/dbraw/zinc/37/49/31/325374931.db2.gz GBOORAIZXRVXRN-UHFFFAOYSA-N 1 2 237.347 2.048 20 0 BEADLO Cc1csc(CN[C@H](C)c2[nH]cc[nH+]2)n1 ZINC000124805707 491128635 /nfs/dbraw/zinc/12/86/35/491128635.db2.gz OHLFBBNZXZDUNO-MRVPVSSYSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1csc(C[NH2+][C@H](C)c2ncc[nH]2)n1 ZINC000124805707 491128636 /nfs/dbraw/zinc/12/86/36/491128636.db2.gz OHLFBBNZXZDUNO-MRVPVSSYSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1nn(C)cc1C[NH2+][C@@H](C)c1cscn1 ZINC000229134489 358345851 /nfs/dbraw/zinc/34/58/51/358345851.db2.gz PLUMHILUNRSHCJ-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO CC(=O)C[NH2+][C@@H](CF)c1ccc(F)cc1 ZINC000640155074 358438330 /nfs/dbraw/zinc/43/83/30/358438330.db2.gz PTLOBSYGDSIMJN-NSHDSACASA-N 1 2 213.227 2.015 20 0 BEADLO Cc1cc(C(=O)NCCCCF)c2[nH+]ccn2c1 ZINC000627431634 358533122 /nfs/dbraw/zinc/53/31/22/358533122.db2.gz JDXPZRIKMWXAAO-UHFFFAOYSA-N 1 2 249.289 2.122 20 0 BEADLO CC[C@@H](Nc1cc[nH+]c(C)n1)c1ncc[nH]1 ZINC000125232389 358535796 /nfs/dbraw/zinc/53/57/96/358535796.db2.gz VCJBSVWPIUPWCW-SECBINFHSA-N 1 2 217.276 2.071 20 0 BEADLO CCOC(=O)C[N@H+](CC)Cc1ccccc1C ZINC000047867247 358604721 /nfs/dbraw/zinc/60/47/21/358604721.db2.gz SFBUTNBVHDZDKS-UHFFFAOYSA-N 1 2 235.327 2.380 20 0 BEADLO CCOC(=O)C[N@@H+](CC)Cc1ccccc1C ZINC000047867247 358604724 /nfs/dbraw/zinc/60/47/24/358604724.db2.gz SFBUTNBVHDZDKS-UHFFFAOYSA-N 1 2 235.327 2.380 20 0 BEADLO CC(C)Cn1cc[nH+]c1CNC(=O)[C@@H](C)C1CC1 ZINC000175359083 134285679 /nfs/dbraw/zinc/28/56/79/134285679.db2.gz HOBJNVQYXSNWGP-NSHDSACASA-N 1 2 249.358 2.201 20 0 BEADLO CCCCCCNC(=O)[C@@H]1CCn2c[nH+]cc2C1 ZINC000130703336 358641604 /nfs/dbraw/zinc/64/16/04/358641604.db2.gz BONLCENIJPUEHC-GFCCVEGCSA-N 1 2 249.358 2.142 20 0 BEADLO CC(C)(C)NC(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000048720642 358652468 /nfs/dbraw/zinc/65/24/68/358652468.db2.gz WRZSQRWMBLDXAJ-UHFFFAOYSA-N 1 2 243.310 2.401 20 0 BEADLO CCCCc1nc(C[N@H+](C)[C@H](C)CO)cs1 ZINC000132116654 358708085 /nfs/dbraw/zinc/70/80/85/358708085.db2.gz JTWLIZINCVUYTA-SNVBAGLBSA-N 1 2 242.388 2.298 20 0 BEADLO CCCCc1nc(C[N@@H+](C)[C@H](C)CO)cs1 ZINC000132116654 358708087 /nfs/dbraw/zinc/70/80/87/358708087.db2.gz JTWLIZINCVUYTA-SNVBAGLBSA-N 1 2 242.388 2.298 20 0 BEADLO CS[C@H]1CCCC[N@H+](Cc2noc(C)n2)C1 ZINC000134577183 358796397 /nfs/dbraw/zinc/79/63/97/358796397.db2.gz ASJKFDMCFZAYTD-JTQLQIEISA-N 1 2 241.360 2.096 20 0 BEADLO CS[C@H]1CCCC[N@@H+](Cc2noc(C)n2)C1 ZINC000134577183 358796398 /nfs/dbraw/zinc/79/63/98/358796398.db2.gz ASJKFDMCFZAYTD-JTQLQIEISA-N 1 2 241.360 2.096 20 0 BEADLO CCc1nc(C[NH+]2CCCCCC2)no1 ZINC000054316486 358858344 /nfs/dbraw/zinc/85/83/44/358858344.db2.gz JCZLMARAJWKDAG-UHFFFAOYSA-N 1 2 209.293 2.008 20 0 BEADLO Cc1nc(NC[C@H]2Cc3ccccc3O2)cc[nH+]1 ZINC000054935976 358879864 /nfs/dbraw/zinc/87/98/64/358879864.db2.gz UPTPAQUTMPUVLI-GFCCVEGCSA-N 1 2 241.294 2.201 20 0 BEADLO CCc1cnc(C[NH2+][C@@H]2CCCn3nccc32)o1 ZINC000640220378 358894445 /nfs/dbraw/zinc/89/44/45/358894445.db2.gz YMODZNVDVNBKIJ-LLVKDONJSA-N 1 2 246.314 2.058 20 0 BEADLO CCc1cnc(C[NH2+][C@H]2CCCn3nccc32)o1 ZINC000640220379 358894774 /nfs/dbraw/zinc/89/47/74/358894774.db2.gz YMODZNVDVNBKIJ-NSHDSACASA-N 1 2 246.314 2.058 20 0 BEADLO CCc1ncc(CNc2c[nH]c[nH+]2)s1 ZINC000306161437 358965872 /nfs/dbraw/zinc/96/58/72/358965872.db2.gz GCCPPMHEBDMIGD-UHFFFAOYSA-N 1 2 208.290 2.041 20 0 BEADLO C[C@@H]1C[C@H]([N@@H+]2OC3CCC2CC3)CCO1 ZINC000640232838 358957546 /nfs/dbraw/zinc/95/75/46/358957546.db2.gz XIOHGSGXRDGUSB-QTAHKJALSA-N 1 2 211.305 2.112 20 0 BEADLO C[C@@H]1C[C@H]([N@H+]2OC3CCC2CC3)CCO1 ZINC000640232838 358957548 /nfs/dbraw/zinc/95/75/48/358957548.db2.gz XIOHGSGXRDGUSB-QTAHKJALSA-N 1 2 211.305 2.112 20 0 BEADLO COC(=O)C[N@@H+]1CCC[C@@H]1c1ccccc1OC ZINC000069610825 359031003 /nfs/dbraw/zinc/03/10/03/359031003.db2.gz ARZSCVGUFIVTMM-GFCCVEGCSA-N 1 2 249.310 2.005 20 0 BEADLO COC(=O)C[N@H+]1CCC[C@@H]1c1ccccc1OC ZINC000069610825 359031007 /nfs/dbraw/zinc/03/10/07/359031007.db2.gz ARZSCVGUFIVTMM-GFCCVEGCSA-N 1 2 249.310 2.005 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cnccn1)c1ccccn1 ZINC000070477508 359056383 /nfs/dbraw/zinc/05/63/83/359056383.db2.gz YPWDTFOYACRBRN-MNOVXSKESA-N 1 2 228.299 2.283 20 0 BEADLO CCC(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000074829728 359130802 /nfs/dbraw/zinc/13/08/02/359130802.db2.gz LPDOGLJTYGBKKK-UHFFFAOYSA-N 1 2 215.256 2.425 20 0 BEADLO FC(F)(C[NH2+]C1CSC1)c1ccccc1 ZINC000308861349 491139301 /nfs/dbraw/zinc/13/93/01/491139301.db2.gz AGNUFZIAOXWLDA-UHFFFAOYSA-N 1 2 229.295 2.483 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nc(C)c(C)o2)C[C@@H](C)O1 ZINC000247500598 359228148 /nfs/dbraw/zinc/22/81/48/359228148.db2.gz IDMCTOJZUMSNSW-BXKDBHETSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nc(C)c(C)o2)C[C@@H](C)O1 ZINC000247500598 359228151 /nfs/dbraw/zinc/22/81/51/359228151.db2.gz IDMCTOJZUMSNSW-BXKDBHETSA-N 1 2 238.331 2.291 20 0 BEADLO C[C@@H]1CCN(CC(F)(F)F)C[C@H]1n1cc[nH+]c1 ZINC000247325061 359212728 /nfs/dbraw/zinc/21/27/28/359212728.db2.gz GFGRWOPROYIROI-NXEZZACHSA-N 1 2 247.264 2.328 20 0 BEADLO FC1(F)CCC[C@H]1[NH2+]Cc1ccccn1 ZINC000308889481 491139747 /nfs/dbraw/zinc/13/97/47/491139747.db2.gz VZOJDKKPGDGOQI-SNVBAGLBSA-N 1 2 212.243 2.359 20 0 BEADLO CC(C)[C@@H]1C[C@@H](Nc2c[nH]c[nH+]2)CS1 ZINC000306220853 359346449 /nfs/dbraw/zinc/34/64/49/359346449.db2.gz OXZMOBBVRBMCCR-BDAKNGLRSA-N 1 2 211.334 2.352 20 0 BEADLO COC(=O)C[N@@H+]1CCC[C@@H]1/C=C\c1ccccc1 ZINC000611554679 359396404 /nfs/dbraw/zinc/39/64/04/359396404.db2.gz RZWYGUBMAMPRSK-CFYYFVFUSA-N 1 2 245.322 2.337 20 0 BEADLO COC(=O)C[N@H+]1CCC[C@@H]1/C=C\c1ccccc1 ZINC000611554679 359396409 /nfs/dbraw/zinc/39/64/09/359396409.db2.gz RZWYGUBMAMPRSK-CFYYFVFUSA-N 1 2 245.322 2.337 20 0 BEADLO CC[C@@H]([NH2+]CC1=CCCCC1)C(=O)OC ZINC000379572818 359549110 /nfs/dbraw/zinc/54/91/10/359549110.db2.gz UCMXBEPEZLNLQQ-LLVKDONJSA-N 1 2 211.305 2.028 20 0 BEADLO Cc1cc(N2CC=CC2)nc(C(C)C)[nH+]1 ZINC000580438717 359555643 /nfs/dbraw/zinc/55/56/43/359555643.db2.gz ZVUPQNVCJCQPNX-UHFFFAOYSA-N 1 2 203.289 2.285 20 0 BEADLO Fc1cccc2c1CC[C@@H]2[NH2+]Cc1ncccn1 ZINC000580451532 359559595 /nfs/dbraw/zinc/55/95/95/359559595.db2.gz HBFUGTCIZRRABV-ZDUSSCGKSA-N 1 2 243.285 2.393 20 0 BEADLO C[C@@H]1CSCC[N@@H+]1Cc1cnc(Cl)cn1 ZINC000231282207 359693230 /nfs/dbraw/zinc/69/32/30/359693230.db2.gz MXPWSMPMQRJQMY-MRVPVSSYSA-N 1 2 243.763 2.067 20 0 BEADLO C[C@@H]1CSCC[N@H+]1Cc1cnc(Cl)cn1 ZINC000231282207 359693235 /nfs/dbraw/zinc/69/32/35/359693235.db2.gz MXPWSMPMQRJQMY-MRVPVSSYSA-N 1 2 243.763 2.067 20 0 BEADLO C[C@H](c1csnn1)[N@H+](C)CC[C@@H]1CCCO1 ZINC000450826220 202276056 /nfs/dbraw/zinc/27/60/56/202276056.db2.gz ZBSFOAFUZCFHRS-ZJUUUORDSA-N 1 2 241.360 2.100 20 0 BEADLO C[C@H](c1csnn1)[N@@H+](C)CC[C@@H]1CCCO1 ZINC000450826220 202276059 /nfs/dbraw/zinc/27/60/59/202276059.db2.gz ZBSFOAFUZCFHRS-ZJUUUORDSA-N 1 2 241.360 2.100 20 0 BEADLO Cc1nc(N[C@@H]2CCC(F)(F)C2)cc[nH+]1 ZINC000309078956 491144014 /nfs/dbraw/zinc/14/40/14/491144014.db2.gz NOVPPGFQRYFIAZ-MRVPVSSYSA-N 1 2 213.231 2.385 20 0 BEADLO CCn1ccnc1[C@@H](C)Nc1cc(C)[nH+]cn1 ZINC000450835693 202284026 /nfs/dbraw/zinc/28/40/26/202284026.db2.gz XPUUMFYDSHGPEX-SNVBAGLBSA-N 1 2 231.303 2.175 20 0 BEADLO Cc1ccc(NC(=O)CCCF)c(C)[nH+]1 ZINC000612226309 359740884 /nfs/dbraw/zinc/74/08/84/359740884.db2.gz KFUYJOZPJRPSDZ-UHFFFAOYSA-N 1 2 210.252 2.387 20 0 BEADLO CCc1ncc(CNc2cc[nH+]c(C(C)C)n2)o1 ZINC000450850730 202287074 /nfs/dbraw/zinc/28/70/74/202287074.db2.gz YLJQORXLAZKORC-UHFFFAOYSA-N 1 2 246.314 2.184 20 0 BEADLO OCC[N@H+](CC(F)F)CC12CCC(CC1)C2 ZINC000450890825 202299740 /nfs/dbraw/zinc/29/97/40/202299740.db2.gz ICDMZPHEDNVQTR-UHFFFAOYSA-N 1 2 233.302 2.126 20 0 BEADLO OCC[N@@H+](CC(F)F)CC12CCC(CC1)C2 ZINC000450890825 202299743 /nfs/dbraw/zinc/29/97/43/202299743.db2.gz ICDMZPHEDNVQTR-UHFFFAOYSA-N 1 2 233.302 2.126 20 0 BEADLO CC[C@H]1C[N@@H+]([C@@H](C)c2csnn2)CCCO1 ZINC000450902503 202302473 /nfs/dbraw/zinc/30/24/73/202302473.db2.gz KYBYQVVPYRHTAF-UWVGGRQHSA-N 1 2 241.360 2.100 20 0 BEADLO CC[C@H]1C[N@H+]([C@@H](C)c2csnn2)CCCO1 ZINC000450902503 202302476 /nfs/dbraw/zinc/30/24/76/202302476.db2.gz KYBYQVVPYRHTAF-UWVGGRQHSA-N 1 2 241.360 2.100 20 0 BEADLO CC[C@@H](O)[C@@H](CC)Nc1cc[nH+]c2ccncc12 ZINC000450866670 202293691 /nfs/dbraw/zinc/29/36/91/202293691.db2.gz XODJKPGPQBVKDZ-BXUZGUMPSA-N 1 2 245.326 2.013 20 0 BEADLO Cc1[nH+]cccc1N[C@H](C)[C@H]1CCCO1 ZINC000309091974 491144657 /nfs/dbraw/zinc/14/46/57/491144657.db2.gz FBIJIUMROZIPPX-ZYHUDNBSSA-N 1 2 206.289 2.369 20 0 BEADLO Cc1nnsc1C[N@@H+]1CCC[C@](C)(F)C1 ZINC000578512231 366584095 /nfs/dbraw/zinc/58/40/95/366584095.db2.gz RDYGHVQWOJXFJL-JTQLQIEISA-N 1 2 229.324 2.171 20 0 BEADLO Cc1nnsc1C[N@H+]1CCC[C@](C)(F)C1 ZINC000578512231 366584099 /nfs/dbraw/zinc/58/40/99/366584099.db2.gz RDYGHVQWOJXFJL-JTQLQIEISA-N 1 2 229.324 2.171 20 0 BEADLO COC(=O)[C@H](CC(C)C)[N@@H+]1CCC[C@](C)(F)C1 ZINC000451115963 202354068 /nfs/dbraw/zinc/35/40/68/202354068.db2.gz QCYJQSOEJXBFQO-AAEUAGOBSA-N 1 2 245.338 2.398 20 0 BEADLO COC(=O)[C@H](CC(C)C)[N@H+]1CCC[C@](C)(F)C1 ZINC000451115963 202354072 /nfs/dbraw/zinc/35/40/72/202354072.db2.gz QCYJQSOEJXBFQO-AAEUAGOBSA-N 1 2 245.338 2.398 20 0 BEADLO CC(C)N(Cc1[nH+]ccn1C(C)C)C1COC1 ZINC000451122136 202357034 /nfs/dbraw/zinc/35/70/34/202357034.db2.gz WPTWDLLWTGGYSC-UHFFFAOYSA-N 1 2 237.347 2.073 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[N@@H+]1CC[C@@H](F)C1 ZINC000451194921 202375330 /nfs/dbraw/zinc/37/53/30/202375330.db2.gz LAQGZIAXMYRWIH-MNOVXSKESA-N 1 2 231.311 2.008 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[N@H+]1CC[C@@H](F)C1 ZINC000451194921 202375331 /nfs/dbraw/zinc/37/53/31/202375331.db2.gz LAQGZIAXMYRWIH-MNOVXSKESA-N 1 2 231.311 2.008 20 0 BEADLO FC(F)(F)c1cc[nH+]c(N[C@@H]2CCOC2)c1 ZINC000087787954 359929380 /nfs/dbraw/zinc/92/93/80/359929380.db2.gz YEKNDBXBUTZOHU-MRVPVSSYSA-N 1 2 232.205 2.301 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2CC23CCCC3)cc[nH+]1 ZINC000578713950 366629623 /nfs/dbraw/zinc/62/96/23/366629623.db2.gz HFSDUYUKWASJNJ-GFCCVEGCSA-N 1 2 245.326 2.266 20 0 BEADLO Cc1noc([C@@H](C)[N@H+](C)CCC(C)(F)F)n1 ZINC000578761892 366631177 /nfs/dbraw/zinc/63/11/77/366631177.db2.gz SUXCWBGXUFMZNJ-SSDOTTSWSA-N 1 2 233.262 2.416 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+](C)CCC(C)(F)F)n1 ZINC000578761892 366631180 /nfs/dbraw/zinc/63/11/80/366631180.db2.gz SUXCWBGXUFMZNJ-SSDOTTSWSA-N 1 2 233.262 2.416 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)C[C@@H]2C[C@H]2C)[nH+]1 ZINC000578875834 366664290 /nfs/dbraw/zinc/66/42/90/366664290.db2.gz YJVOTMMGVWFQDT-SCZZXKLOSA-N 1 2 235.331 2.116 20 0 BEADLO CC(C)n1ncnc1C[NH2+][C@@H](C)c1ccccn1 ZINC000088589306 359967926 /nfs/dbraw/zinc/96/79/26/359967926.db2.gz ZSOLAUHKVJBSRK-NSHDSACASA-N 1 2 245.330 2.105 20 0 BEADLO CCn1ncnc1C[NH2+][C@H](C)c1cccc(F)c1 ZINC000088590639 359969022 /nfs/dbraw/zinc/96/90/22/359969022.db2.gz YKGRYVSZXFVVMY-SNVBAGLBSA-N 1 2 248.305 2.288 20 0 BEADLO CC[C@@]1(C)CCN(C(=O)[C@@H](C)Cc2c[nH+]c[nH]2)C1 ZINC000578905799 366672667 /nfs/dbraw/zinc/67/26/67/366672667.db2.gz JNGCDLKDAVEXAB-FZMZJTMJSA-N 1 2 249.358 2.237 20 0 BEADLO CC[C@@]1(C)CCN(C(=O)[C@@H](C)Cc2c[nH]c[nH+]2)C1 ZINC000578905799 366672673 /nfs/dbraw/zinc/67/26/73/366672673.db2.gz JNGCDLKDAVEXAB-FZMZJTMJSA-N 1 2 249.358 2.237 20 0 BEADLO Cn1cc[nH+]c1CNc1c(F)cc(F)cc1F ZINC000088719482 359973483 /nfs/dbraw/zinc/97/34/83/359973483.db2.gz YTUZZSRIZBLEAN-UHFFFAOYSA-N 1 2 241.216 2.450 20 0 BEADLO O=C(NCc1c[nH+]c[nH]1)c1coc2ccccc12 ZINC000088759116 359975479 /nfs/dbraw/zinc/97/54/79/359975479.db2.gz ORIAGZJDXIIHDU-UHFFFAOYSA-N 1 2 241.250 2.086 20 0 BEADLO O=C(NCc1c[nH]c[nH+]1)c1coc2ccccc12 ZINC000088759116 359975481 /nfs/dbraw/zinc/97/54/81/359975481.db2.gz ORIAGZJDXIIHDU-UHFFFAOYSA-N 1 2 241.250 2.086 20 0 BEADLO Cc1cc(NC(=O)C2CC3(CC3)C2)c(C)c[nH+]1 ZINC000612747260 360040186 /nfs/dbraw/zinc/04/01/86/360040186.db2.gz PDSULOWWQSYIIG-UHFFFAOYSA-N 1 2 230.311 2.249 20 0 BEADLO COc1ccc([C@H](C)[NH2+]Cc2ncccn2)cc1 ZINC000090340142 360070300 /nfs/dbraw/zinc/07/03/00/360070300.db2.gz AEOJQLZFXABRDD-NSHDSACASA-N 1 2 243.310 2.336 20 0 BEADLO COC(=O)c1occc1CNc1ccc[nH+]c1C ZINC000091495739 360117325 /nfs/dbraw/zinc/11/73/25/360117325.db2.gz YRAUSGCDINSWMI-UHFFFAOYSA-N 1 2 246.266 2.382 20 0 BEADLO Cc1[nH+]cccc1NCc1ccc(C(N)=O)cc1 ZINC000091495987 360118569 /nfs/dbraw/zinc/11/85/69/360118569.db2.gz MJYWIPOWEZEXQJ-UHFFFAOYSA-N 1 2 241.294 2.101 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1csc(C)c1 ZINC001641608539 1172273987 /nfs/dbraw/zinc/27/39/87/1172273987.db2.gz AJFZQPQJNJKBRQ-JTQLQIEISA-N 1 2 224.329 2.089 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1csc(C)c1 ZINC001641608539 1172273993 /nfs/dbraw/zinc/27/39/93/1172273993.db2.gz AJFZQPQJNJKBRQ-JTQLQIEISA-N 1 2 224.329 2.089 20 0 BEADLO O=C(Nc1cc[nH+]cc1O)[C@@H]1CCCC2(CC2)C1 ZINC000613086300 360347934 /nfs/dbraw/zinc/34/79/34/360347934.db2.gz KWWJBUMMUFCMAK-SNVBAGLBSA-N 1 2 246.310 2.118 20 0 BEADLO CCC[C@@H](C(=O)OCC)[N@H+](C)Cc1ccoc1 ZINC000098003092 360386954 /nfs/dbraw/zinc/38/69/54/360386954.db2.gz MTXSTPGOHZAREN-LBPRGKRZSA-N 1 2 239.315 2.443 20 0 BEADLO CCC[C@@H](C(=O)OCC)[N@@H+](C)Cc1ccoc1 ZINC000098003092 360386962 /nfs/dbraw/zinc/38/69/62/360386962.db2.gz MTXSTPGOHZAREN-LBPRGKRZSA-N 1 2 239.315 2.443 20 0 BEADLO CC[N@H+](CCO)Cc1nccc(Cl)c1Cl ZINC001641701844 1172284575 /nfs/dbraw/zinc/28/45/75/1172284575.db2.gz PBEVSELVAQLXBD-UHFFFAOYSA-N 1 2 249.141 2.203 20 0 BEADLO CC[N@@H+](CCO)Cc1nccc(Cl)c1Cl ZINC001641701844 1172284582 /nfs/dbraw/zinc/28/45/82/1172284582.db2.gz PBEVSELVAQLXBD-UHFFFAOYSA-N 1 2 249.141 2.203 20 0 BEADLO Cc1cc(NC(=O)C2(CCF)CC2)c(C)c[nH+]1 ZINC000580503580 360778203 /nfs/dbraw/zinc/77/82/03/360778203.db2.gz OQASFFWNPSXGTB-UHFFFAOYSA-N 1 2 236.290 2.199 20 0 BEADLO C[C@@H]1C[C@@H]1CSc1[nH+]cnc2c1cnn2C ZINC000629113832 360882699 /nfs/dbraw/zinc/88/26/99/360882699.db2.gz ZQCPUPDREFYHPU-HTQZYQBOSA-N 1 2 234.328 2.111 20 0 BEADLO C[C@H](Nc1c[nH+]cc(N(C)C)c1)C1CC1 ZINC000631203968 360915815 /nfs/dbraw/zinc/91/58/15/360915815.db2.gz VBCPUUQAVMJZNO-VIFPVBQESA-N 1 2 205.305 2.358 20 0 BEADLO Cc1ncc(C[NH2+][C@H]2CCCC2(F)F)cn1 ZINC000309622394 491153532 /nfs/dbraw/zinc/15/35/32/491153532.db2.gz DTIONIQBFUXLJT-JTQLQIEISA-N 1 2 227.258 2.062 20 0 BEADLO CCCc1nc(C[N@H+](C)CC(C)C)no1 ZINC000065960938 361083513 /nfs/dbraw/zinc/08/35/13/361083513.db2.gz QJDMDHGXFXLUDK-UHFFFAOYSA-N 1 2 211.309 2.110 20 0 BEADLO CCCc1nc(C[N@@H+](C)CC(C)C)no1 ZINC000065960938 361083516 /nfs/dbraw/zinc/08/35/16/361083516.db2.gz QJDMDHGXFXLUDK-UHFFFAOYSA-N 1 2 211.309 2.110 20 0 BEADLO C/C=C(\C)C(=O)N1CC(C)(C)[C@H]1c1[nH+]ccn1C ZINC000296063574 219886560 /nfs/dbraw/zinc/88/65/60/219886560.db2.gz GFVFKAUMCLWRGM-CDCCAWJDSA-N 1 2 247.342 2.296 20 0 BEADLO C[C@H](CCCCO)[NH2+][C@H](C1CC1)C(F)(F)F ZINC000309734648 491155286 /nfs/dbraw/zinc/15/52/86/491155286.db2.gz GCDCWUMHCCPFED-PSASIEDQSA-N 1 2 239.281 2.468 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2CC[C@H]2C)c(C)c[nH+]1 ZINC000579095796 366709194 /nfs/dbraw/zinc/70/91/94/366709194.db2.gz PSVNWLSDEJQYNE-KCJUWKMLSA-N 1 2 233.315 2.040 20 0 BEADLO Cc1c[nH+]cc(NC[C@H]2CCC=CO2)c1 ZINC000194524623 361319045 /nfs/dbraw/zinc/31/90/45/361319045.db2.gz WEUFFKWLZJFNQW-GFCCVEGCSA-N 1 2 204.273 2.495 20 0 BEADLO CC[C@H]([NH2+]Cc1cc(C)ncn1)c1nccs1 ZINC000428353274 201010944 /nfs/dbraw/zinc/01/09/44/201010944.db2.gz UKKVUUHBZSJZDM-NSHDSACASA-N 1 2 248.355 2.482 20 0 BEADLO CCC[C@H]1C[N@@H+]([C@H](C)c2cnc(C)cn2)CCO1 ZINC000428296965 201008557 /nfs/dbraw/zinc/00/85/57/201008557.db2.gz ZDHAPUVJJNFAHT-OLZOCXBDSA-N 1 2 249.358 2.347 20 0 BEADLO CCC[C@H]1C[N@H+]([C@H](C)c2cnc(C)cn2)CCO1 ZINC000428296965 201008559 /nfs/dbraw/zinc/00/85/59/201008559.db2.gz ZDHAPUVJJNFAHT-OLZOCXBDSA-N 1 2 249.358 2.347 20 0 BEADLO Cc1cc(N(C)[C@@H]2CC[C@@H](C)C2)nc[nH+]1 ZINC000428669684 201033726 /nfs/dbraw/zinc/03/37/26/201033726.db2.gz QLUKEBHHPMZAAF-MWLCHTKSSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1cnc(C[NH2+]Cc2oc(C)nc2C)s1 ZINC000394755401 361336257 /nfs/dbraw/zinc/33/62/57/361336257.db2.gz ZGPKSZCVSPMHFY-UHFFFAOYSA-N 1 2 237.328 2.346 20 0 BEADLO CCC(CC)N(C(=O)Cn1cc[nH+]c1)C1CC1 ZINC000579318498 366759572 /nfs/dbraw/zinc/75/95/72/366759572.db2.gz SDKKNRZBCKYMNM-UHFFFAOYSA-N 1 2 235.331 2.063 20 0 BEADLO Cc1ccc(C)c(C[N@@H+](C)Cc2cn(C)nn2)c1 ZINC000429293494 201095321 /nfs/dbraw/zinc/09/53/21/201095321.db2.gz LNGKWNSFAAFFDK-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1ccc(C)c(C[N@H+](C)Cc2cn(C)nn2)c1 ZINC000429293494 201095324 /nfs/dbraw/zinc/09/53/24/201095324.db2.gz LNGKWNSFAAFFDK-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO CCc1nc(C[N@H+](C)[C@@H]2CC[C@H](C)C2)no1 ZINC000429567663 201117988 /nfs/dbraw/zinc/11/79/88/201117988.db2.gz MLSPUFJGFIHEKO-VHSXEESVSA-N 1 2 223.320 2.252 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@@H]2CC[C@H](C)C2)no1 ZINC000429567663 201117990 /nfs/dbraw/zinc/11/79/90/201117990.db2.gz MLSPUFJGFIHEKO-VHSXEESVSA-N 1 2 223.320 2.252 20 0 BEADLO COc1ccc(N[C@H](C)CCCCO)[nH+]c1 ZINC000309871613 491157802 /nfs/dbraw/zinc/15/78/02/491157802.db2.gz QUGPBCJRVOSTDJ-SNVBAGLBSA-N 1 2 224.304 2.053 20 0 BEADLO Cc1ccoc1CN(C)Cc1[nH+]cc(C)n1C ZINC000430193667 201151573 /nfs/dbraw/zinc/15/15/73/201151573.db2.gz ADANKMAWNNLHGC-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO CC[C@@H]1CC[N@@H+]1Cc1cc(C(F)(F)F)n[nH]1 ZINC000430199437 201153576 /nfs/dbraw/zinc/15/35/76/201153576.db2.gz UTKANWRPWRFZRH-MRVPVSSYSA-N 1 2 233.237 2.413 20 0 BEADLO CC[C@@H]1CC[N@H+]1Cc1cc(C(F)(F)F)n[nH]1 ZINC000430199437 201153580 /nfs/dbraw/zinc/15/35/80/201153580.db2.gz UTKANWRPWRFZRH-MRVPVSSYSA-N 1 2 233.237 2.413 20 0 BEADLO CSCC[N@H+](C)Cc1nc(C(C)(C)C)no1 ZINC000152330714 201196527 /nfs/dbraw/zinc/19/65/27/201196527.db2.gz XENWKXLDZKPCRM-UHFFFAOYSA-N 1 2 243.376 2.162 20 0 BEADLO CSCC[N@@H+](C)Cc1nc(C(C)(C)C)no1 ZINC000152330714 201196529 /nfs/dbraw/zinc/19/65/29/201196529.db2.gz XENWKXLDZKPCRM-UHFFFAOYSA-N 1 2 243.376 2.162 20 0 BEADLO CCc1cc(N[C@@]2(CC)CCOC2)nc[nH+]1 ZINC000309951895 491158845 /nfs/dbraw/zinc/15/88/45/491158845.db2.gz GLPJQAABTOMBPM-LBPRGKRZSA-N 1 2 221.304 2.020 20 0 BEADLO Cc1nc2[nH]ccc2c(NCC2CCCC2)[nH+]1 ZINC000433781525 201193893 /nfs/dbraw/zinc/19/38/93/201193893.db2.gz XJHDTVJUBGSVQX-UHFFFAOYSA-N 1 2 230.315 2.290 20 0 BEADLO Cc1nc2[nH]ccc2c(NC[C@H](C)C(C)C)[nH+]1 ZINC000433803449 201194366 /nfs/dbraw/zinc/19/43/66/201194366.db2.gz MMPCLSDWHWLEML-VIFPVBQESA-N 1 2 232.331 2.392 20 0 BEADLO CCC[N@H+](Cc1ncnn1C(C)C)C1CC1 ZINC000434477342 201220991 /nfs/dbraw/zinc/22/09/91/201220991.db2.gz OPUKAMCAFLVBMK-UHFFFAOYSA-N 1 2 222.336 2.233 20 0 BEADLO CCC[N@@H+](Cc1ncnn1C(C)C)C1CC1 ZINC000434477342 201220995 /nfs/dbraw/zinc/22/09/95/201220995.db2.gz OPUKAMCAFLVBMK-UHFFFAOYSA-N 1 2 222.336 2.233 20 0 BEADLO OCCCCNc1ccc(-c2cccs2)c[nH+]1 ZINC000629689943 361624364 /nfs/dbraw/zinc/62/43/64/361624364.db2.gz DHXKJWCNENFJFL-UHFFFAOYSA-N 1 2 248.351 2.416 20 0 BEADLO Cc1noc(C)c1-c1ccc(N[C@@H](C)CO)[nH+]c1 ZINC000629712144 361648884 /nfs/dbraw/zinc/64/88/84/361648884.db2.gz JZULVLQTVIAYKN-QMMMGPOBSA-N 1 2 247.298 2.146 20 0 BEADLO CCNc1ccc(-c2c(C)noc2C)c[nH+]1 ZINC000629711470 361647480 /nfs/dbraw/zinc/64/74/80/361647480.db2.gz ITQGVZULMVAECJ-UHFFFAOYSA-N 1 2 217.272 2.207 20 0 BEADLO CC(C)CCn1cccc1C[NH+]1CCN(C)CC1 ZINC000154405289 201276574 /nfs/dbraw/zinc/27/65/74/201276574.db2.gz OQSDGNFKJXLUTQ-UHFFFAOYSA-N 1 2 249.402 2.282 20 0 BEADLO Cc1[nH]cc(-c2cc(C(F)(F)F)nn2C)[nH+]1 ZINC000629725462 361666678 /nfs/dbraw/zinc/66/66/78/361666678.db2.gz PEUSCFPDJWGFEE-UHFFFAOYSA-N 1 2 230.193 2.137 20 0 BEADLO Cc1noc(C)c1-c1c[nH+]c(N)c(C)c1 ZINC000629712981 361651737 /nfs/dbraw/zinc/65/17/37/361651737.db2.gz ZJBDASJXPIDFNL-UHFFFAOYSA-N 1 2 203.245 2.074 20 0 BEADLO CC[C@H]1CCC[C@H]1C(=O)NCCCn1cc[nH+]c1 ZINC000448565630 201290931 /nfs/dbraw/zinc/29/09/31/201290931.db2.gz MQFORUIHWXGIPT-QWHCGFSZSA-N 1 2 249.358 2.216 20 0 BEADLO CCC[C@@H]([NH2+]C[C@H](C)SC)C(=O)OCC ZINC000155097699 201301054 /nfs/dbraw/zinc/30/10/54/201301054.db2.gz FPCJUPJSNLIDHJ-VHSXEESVSA-N 1 2 233.377 2.059 20 0 BEADLO C[C@]1(C(=O)NCCCn2cc[nH+]c2)CC=CCC1 ZINC000448567660 201304534 /nfs/dbraw/zinc/30/45/34/201304534.db2.gz ZCONEXDTWYBTCB-AWEZNQCLSA-N 1 2 247.342 2.136 20 0 BEADLO FCC[NH2+][C@H](c1ccccc1)c1cncnc1 ZINC000436310970 201321033 /nfs/dbraw/zinc/32/10/33/201321033.db2.gz WEHUPZMDGDAUMJ-CYBMUJFWSA-N 1 2 231.274 2.125 20 0 BEADLO Cc1cccc2[nH+]cc(CNc3ncccn3)n21 ZINC000438235229 201398854 /nfs/dbraw/zinc/39/88/54/201398854.db2.gz NFQXMADFVZTHJZ-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C12CCC(CC1)C2 ZINC000452568822 202616028 /nfs/dbraw/zinc/61/60/28/202616028.db2.gz CFKJJVYVNXWHCF-UHFFFAOYSA-N 1 2 247.342 2.100 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCC=C(C)C1 ZINC000579494672 366833823 /nfs/dbraw/zinc/83/38/23/366833823.db2.gz WHMSCEKIOAMWDA-UHFFFAOYSA-N 1 2 203.289 2.250 20 0 BEADLO CC[C@@](C)(NC(=O)CCc1[nH]cc[nH+]1)C1CC1 ZINC000618962254 364410161 /nfs/dbraw/zinc/41/01/61/364410161.db2.gz VBQMPFRQIHUYNX-CYBMUJFWSA-N 1 2 235.331 2.037 20 0 BEADLO CC[N@H+](Cc1cnoc1C)Cc1ccccn1 ZINC000181741832 366844328 /nfs/dbraw/zinc/84/43/28/366844328.db2.gz JUKNHQPSJLTZMF-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1cnoc1C)Cc1ccccn1 ZINC000181741832 366844332 /nfs/dbraw/zinc/84/43/32/366844332.db2.gz JUKNHQPSJLTZMF-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CCC[C@@H]2C[C@@H]21)c1[nH]cc[nH+]1 ZINC000615158866 364552289 /nfs/dbraw/zinc/55/22/89/364552289.db2.gz WERBTBNAQIUKPP-DBIOUOCHSA-N 1 2 233.315 2.023 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)[C@H]1CCC1(C)C ZINC000615233567 364649520 /nfs/dbraw/zinc/64/95/20/364649520.db2.gz JOHIADWLIHDPLH-LLVKDONJSA-N 1 2 248.326 2.143 20 0 BEADLO Cc1cc(N2CCC[C@H]2[C@H]2CCCOC2)nc[nH+]1 ZINC000567767348 364754328 /nfs/dbraw/zinc/75/43/28/364754328.db2.gz JSTOWVDLISMTFN-STQMWFEESA-N 1 2 247.342 2.180 20 0 BEADLO COc1cc(C[NH2+][C@@H]2CCCC2(F)F)sn1 ZINC000399066688 364762636 /nfs/dbraw/zinc/76/26/36/364762636.db2.gz QOEPAUFDPJECNB-MRVPVSSYSA-N 1 2 248.298 2.429 20 0 BEADLO COC(=O)[C@H]([NH2+][C@@H]1C[C@H]1CC(C)(C)C)C1CC1 ZINC000593182277 541378340 /nfs/dbraw/zinc/37/83/40/541378340.db2.gz FVAQSWOZXOQLSA-QJPTWQEYSA-N 1 2 239.359 2.352 20 0 BEADLO CC(C)n1cncc1C[N@@H+]1CCC[C@H](F)C1 ZINC000573498509 364848607 /nfs/dbraw/zinc/84/86/07/364848607.db2.gz GYZUIKBTJWHTGC-NSHDSACASA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1cncc1C[N@H+]1CCC[C@H](F)C1 ZINC000573498509 364848610 /nfs/dbraw/zinc/84/86/10/364848610.db2.gz GYZUIKBTJWHTGC-NSHDSACASA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1c[nH+]cc1CN1CCC[C@H](F)C1 ZINC000573498509 364848615 /nfs/dbraw/zinc/84/86/15/364848615.db2.gz GYZUIKBTJWHTGC-NSHDSACASA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)C[C@@H]1CCCCN1C(=O)Cn1cc[nH+]c1 ZINC000573501669 364850045 /nfs/dbraw/zinc/85/00/45/364850045.db2.gz KONKZABHYOEXKH-ZDUSSCGKSA-N 1 2 249.358 2.310 20 0 BEADLO CC(C)CCCC(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000573623504 364878601 /nfs/dbraw/zinc/87/86/01/364878601.db2.gz BIKPLLUNKMVECW-SNVBAGLBSA-N 1 2 223.320 2.413 20 0 BEADLO Cn1cc[nH+]c1[C@H]1N(CC2(F)CC2)CC1(C)C ZINC000573654980 364883857 /nfs/dbraw/zinc/88/38/57/364883857.db2.gz PYGJIFKOFYKTGY-SNVBAGLBSA-N 1 2 237.322 2.305 20 0 BEADLO C[C@H]1CN(C(=O)CCc2c[nH+]c[nH]2)CC(C)(C)C1 ZINC000334722529 541417273 /nfs/dbraw/zinc/41/72/73/541417273.db2.gz NPNNSNOLHIEOTI-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@H]1CN(C(=O)CCc2c[nH]c[nH+]2)CC(C)(C)C1 ZINC000334722529 541417277 /nfs/dbraw/zinc/41/72/77/541417277.db2.gz NPNNSNOLHIEOTI-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@H](Nc1cc[nH+]c(C2CC2)n1)c1cncs1 ZINC000439135719 201435962 /nfs/dbraw/zinc/43/59/62/201435962.db2.gz YLZBTMHZSOJKFL-QMMMGPOBSA-N 1 2 246.339 2.406 20 0 BEADLO CC1(C)CN(C(=O)Cn2cc[nH+]c2)CC(C)(C)C1 ZINC000574129320 364992690 /nfs/dbraw/zinc/99/26/90/364992690.db2.gz DIXQDMFIMCNHNM-UHFFFAOYSA-N 1 2 249.358 2.168 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)c2[nH]ccc2C)[nH+]1 ZINC000574165312 365001280 /nfs/dbraw/zinc/00/12/80/365001280.db2.gz UTHCHTLOPOUVSW-UHFFFAOYSA-N 1 2 246.314 2.020 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N3CC[C@@H](C)C3)ccn12 ZINC000574216276 365012267 /nfs/dbraw/zinc/01/22/67/365012267.db2.gz DKRPSDIRHJZNRK-SNVBAGLBSA-N 1 2 243.310 2.125 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N[C@H](C)C3CC3)ccn12 ZINC000574290960 365030551 /nfs/dbraw/zinc/03/05/51/365030551.db2.gz AHVGAFFBUFOONR-SNVBAGLBSA-N 1 2 243.310 2.171 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)N2CCC2(C)C)c2[nH+]ccn21 ZINC000574537576 365086892 /nfs/dbraw/zinc/08/68/92/365086892.db2.gz OXPMXEWENAIRTJ-NXEZZACHSA-N 1 2 248.330 2.083 20 0 BEADLO C[C@@H]([NH2+]Cc1ncccn1)c1ccc(Cl)cn1 ZINC000574584550 365098347 /nfs/dbraw/zinc/09/83/47/365098347.db2.gz HJHPSYRDIXNJKC-SECBINFHSA-N 1 2 248.717 2.376 20 0 BEADLO FCC(CF)[NH2+]Cc1cnc(C2CC2)s1 ZINC000574875833 365165341 /nfs/dbraw/zinc/16/53/41/365165341.db2.gz CZDQHSOLPGUOHL-UHFFFAOYSA-N 1 2 232.299 2.418 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)NCC12CCC(CC1)C2 ZINC000575014697 365167981 /nfs/dbraw/zinc/16/79/81/365167981.db2.gz SYADWCOFPXVBIZ-UHFFFAOYSA-N 1 2 247.342 2.039 20 0 BEADLO CCOCC[N@H+](CC)Cc1nccn1C(C)C ZINC000171635448 365223355 /nfs/dbraw/zinc/22/33/55/365223355.db2.gz ZOXDFTCLBJVOCO-UHFFFAOYSA-N 1 2 239.363 2.322 20 0 BEADLO CCOCC[N@@H+](CC)Cc1nccn1C(C)C ZINC000171635448 365223361 /nfs/dbraw/zinc/22/33/61/365223361.db2.gz ZOXDFTCLBJVOCO-UHFFFAOYSA-N 1 2 239.363 2.322 20 0 BEADLO Cc1nc2[nH]ccc2c(NCC2(C3CC3)CC2)[nH+]1 ZINC000443685537 193027786 /nfs/dbraw/zinc/02/77/86/193027786.db2.gz CEBVUPHFYRZLNN-UHFFFAOYSA-N 1 2 242.326 2.290 20 0 BEADLO C[C@@H](NC(=O)C[C@H](C)n1cccc1)c1[nH]cc[nH+]1 ZINC000575137413 365218639 /nfs/dbraw/zinc/21/86/39/365218639.db2.gz XJUZXWDHUZSRSV-WDEREUQCSA-N 1 2 246.314 2.040 20 0 BEADLO FC(F)(F)[C@@H]1CCCN(Cc2[nH]cc[nH+]2)C1 ZINC000171808723 365241705 /nfs/dbraw/zinc/24/17/05/365241705.db2.gz YNHJWVSJWZVDRM-MRVPVSSYSA-N 1 2 233.237 2.184 20 0 BEADLO CCC1(C(=O)N[C@H](C)c2[nH]cc[nH+]2)CCC1 ZINC000575195549 365237579 /nfs/dbraw/zinc/23/75/79/365237579.db2.gz NFFMCJMGLOKDDJ-SECBINFHSA-N 1 2 221.304 2.167 20 0 BEADLO CCc1cc(N)nc(SCc2ccncc2)[nH+]1 ZINC000575474454 365327661 /nfs/dbraw/zinc/32/76/61/365327661.db2.gz GSKDEYKOBCLXCU-UHFFFAOYSA-N 1 2 246.339 2.139 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@H]1CCCC1(C)C ZINC000575933398 365420806 /nfs/dbraw/zinc/42/08/06/365420806.db2.gz LKCZXBQJEZOGPS-ZYHUDNBSSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@H]1CCCC1(C)C ZINC000575933398 365420809 /nfs/dbraw/zinc/42/08/09/365420809.db2.gz LKCZXBQJEZOGPS-ZYHUDNBSSA-N 1 2 249.358 2.283 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)CC2(C)CC2)[nH+]1 ZINC000579603952 366902343 /nfs/dbraw/zinc/90/23/43/366902343.db2.gz VLTFBAPFSKPTBQ-UHFFFAOYSA-N 1 2 235.331 2.260 20 0 BEADLO CC[C@@H]1CCC[C@H](C[N@H+](C)Cc2nnc[nH]2)C1 ZINC000183085072 366975753 /nfs/dbraw/zinc/97/57/53/366975753.db2.gz XRRYRWZWILODSO-NEPJUHHUSA-N 1 2 236.363 2.453 20 0 BEADLO CC[C@@H]1CCC[C@H](C[N@@H+](C)Cc2nnc[nH]2)C1 ZINC000183085072 366975757 /nfs/dbraw/zinc/97/57/57/366975757.db2.gz XRRYRWZWILODSO-NEPJUHHUSA-N 1 2 236.363 2.453 20 0 BEADLO CSCC(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000579687074 366978399 /nfs/dbraw/zinc/97/83/99/366978399.db2.gz FQDKDVQTASNVAN-UHFFFAOYSA-N 1 2 247.323 2.378 20 0 BEADLO CCCCOCC[NH2+][C@@H]1CCCc2[nH]ncc21 ZINC000367625292 367087005 /nfs/dbraw/zinc/08/70/05/367087005.db2.gz KZXJZUOQVVBDBZ-GFCCVEGCSA-N 1 2 237.347 2.193 20 0 BEADLO CC[C@H]1CCCN(C(=O)[C@@H](C)Cc2c[nH+]c[nH]2)C1 ZINC000580842310 367184784 /nfs/dbraw/zinc/18/47/84/367184784.db2.gz CGZUHBQHIMUGOZ-RYUDHWBXSA-N 1 2 249.358 2.237 20 0 BEADLO CC[C@H]1CCCN(C(=O)[C@@H](C)Cc2c[nH]c[nH+]2)C1 ZINC000580842310 367184790 /nfs/dbraw/zinc/18/47/90/367184790.db2.gz CGZUHBQHIMUGOZ-RYUDHWBXSA-N 1 2 249.358 2.237 20 0 BEADLO CN(C)c1ccc(NCC2(F)CC2)c[nH+]1 ZINC000380346297 367188211 /nfs/dbraw/zinc/18/82/11/367188211.db2.gz TZUMYQIRYPZXEF-UHFFFAOYSA-N 1 2 209.268 2.062 20 0 BEADLO CCCc1ccc(C[N@H+](C)CC(=O)OC)cc1 ZINC000195025764 367331833 /nfs/dbraw/zinc/33/18/33/367331833.db2.gz IITONFKAXNTVCO-UHFFFAOYSA-N 1 2 235.327 2.244 20 0 BEADLO CCCc1ccc(C[N@@H+](C)CC(=O)OC)cc1 ZINC000195025764 367331840 /nfs/dbraw/zinc/33/18/40/367331840.db2.gz IITONFKAXNTVCO-UHFFFAOYSA-N 1 2 235.327 2.244 20 0 BEADLO CCCN(C(=O)[C@H]1CCc2c[nH+]cn2C1)C(C)C ZINC000581200086 367293133 /nfs/dbraw/zinc/29/31/33/367293133.db2.gz NUBUGJBVLJOZJF-LBPRGKRZSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1nnc(C[NH2+][C@H](C)c2ccncc2)s1 ZINC000381316702 367379671 /nfs/dbraw/zinc/37/96/71/367379671.db2.gz TYCAHCVCLCMVIZ-MRVPVSSYSA-N 1 2 234.328 2.092 20 0 BEADLO Cc1csc(C(=O)N[C@H](C)c2[nH]cc[nH+]2)c1 ZINC000382174792 367493204 /nfs/dbraw/zinc/49/32/04/367493204.db2.gz MKTHREGIBCKERT-MRVPVSSYSA-N 1 2 235.312 2.271 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CSC[C@H]1C)C(=O)OC(C)(C)C ZINC000381557693 367430179 /nfs/dbraw/zinc/43/01/79/367430179.db2.gz PSOZXBFVFMZCNU-OPRDCNLKSA-N 1 2 245.388 2.058 20 0 BEADLO CC(C)C(C)(C)NC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000581491738 367522137 /nfs/dbraw/zinc/52/21/37/367522137.db2.gz GGDICDXXVYCIDH-NSHDSACASA-N 1 2 237.347 2.385 20 0 BEADLO COc1ccc[nH+]c1NCCCOC(C)C ZINC000383275929 367611127 /nfs/dbraw/zinc/61/11/27/367611127.db2.gz INLJVIBWVHISBI-UHFFFAOYSA-N 1 2 224.304 2.317 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N(C)CC1CCCC1 ZINC000581674933 367705179 /nfs/dbraw/zinc/70/51/79/367705179.db2.gz CVPVHTASPZWOKL-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N(C)CC1CCCC1 ZINC000581674933 367705185 /nfs/dbraw/zinc/70/51/85/367705185.db2.gz CVPVHTASPZWOKL-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO CC[C@@H](Nc1ccc2ccccc2[nH+]1)[C@@H](C)O ZINC000386714659 368012361 /nfs/dbraw/zinc/01/23/61/368012361.db2.gz QJZHWHLMEHZFQH-ZYHUDNBSSA-N 1 2 230.311 2.228 20 0 BEADLO C[C@@H]1CN(c2cc(CO)cc[nH+]2)[C@@H](C)[C@H]1C ZINC000399532595 368174517 /nfs/dbraw/zinc/17/45/17/368174517.db2.gz NRYKTFPUMJTLTD-VWYCJHECSA-N 1 2 220.316 2.055 20 0 BEADLO C[C@H]1[C@@H](C)N(c2cc(CO)cc[nH+]2)C[C@H]1C ZINC000399532590 368174981 /nfs/dbraw/zinc/17/49/81/368174981.db2.gz NRYKTFPUMJTLTD-GMTAPVOTSA-N 1 2 220.316 2.055 20 0 BEADLO CCC(C)(C)N(C)C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000566443713 326047974 /nfs/dbraw/zinc/04/79/74/326047974.db2.gz AHDRAQYFDLNVDO-JTQLQIEISA-N 1 2 237.347 2.235 20 0 BEADLO CCC(C)(C)N(C)C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000566443713 326047975 /nfs/dbraw/zinc/04/79/75/326047975.db2.gz AHDRAQYFDLNVDO-JTQLQIEISA-N 1 2 237.347 2.235 20 0 BEADLO CC(C)C[N@H+](C)Cc1noc(C(C)(C)C)n1 ZINC000065961455 368636682 /nfs/dbraw/zinc/63/66/82/368636682.db2.gz PICMOZCNEMOFEA-UHFFFAOYSA-N 1 2 225.336 2.455 20 0 BEADLO CC(C)C[N@@H+](C)Cc1noc(C(C)(C)C)n1 ZINC000065961455 368636687 /nfs/dbraw/zinc/63/66/87/368636687.db2.gz PICMOZCNEMOFEA-UHFFFAOYSA-N 1 2 225.336 2.455 20 0 BEADLO COc1ccccc1C[N@H+](C)Cc1ccno1 ZINC000066561384 368652859 /nfs/dbraw/zinc/65/28/59/368652859.db2.gz KBKUYVHCDKCNHF-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1ccccc1C[N@@H+](C)Cc1ccno1 ZINC000066561384 368652864 /nfs/dbraw/zinc/65/28/64/368652864.db2.gz KBKUYVHCDKCNHF-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO C[C@@H]1CCCC[C@@]1(C)NC(=O)CCn1cc[nH+]c1 ZINC000457249429 203028625 /nfs/dbraw/zinc/02/86/25/203028625.db2.gz IWDKWWVNAZIUMT-TZMCWYRMSA-N 1 2 249.358 2.358 20 0 BEADLO CC(C)(NC(=O)[C@@H]1CCC[C@@H]2C[C@@H]21)c1[nH]cc[nH+]1 ZINC000615952764 368760796 /nfs/dbraw/zinc/76/07/96/368760796.db2.gz HZUABJDEAYWRHA-MXWKQRLJSA-N 1 2 247.342 2.197 20 0 BEADLO Cc1cc(NC(=O)C2CCC(=O)CC2)cc[nH+]1 ZINC000073609999 368811010 /nfs/dbraw/zinc/81/10/10/368811010.db2.gz ZNCYWIMTUCJJQB-UHFFFAOYSA-N 1 2 232.283 2.088 20 0 BEADLO CC(C)(C)C1CCN(C(=O)Cn2cc[nH+]c2)CC1 ZINC000073762559 368814482 /nfs/dbraw/zinc/81/44/82/368814482.db2.gz AFLGZXCRSBOUQG-UHFFFAOYSA-N 1 2 249.358 2.168 20 0 BEADLO CCCC[C@@H](CC)C(=O)NCCn1cc[nH+]c1 ZINC000073967355 368824008 /nfs/dbraw/zinc/82/40/08/368824008.db2.gz LOGINGKTGOTRSK-GFCCVEGCSA-N 1 2 237.347 2.216 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)C2CC3(CC3)C2)c2[nH+]ccn21 ZINC000615962809 368798399 /nfs/dbraw/zinc/79/83/99/368798399.db2.gz IGJLFSCRROJKOT-MWLCHTKSSA-N 1 2 245.326 2.195 20 0 BEADLO C[C@H]1CCC(C)(C)N1C(=O)CCc1c[nH+]c[nH]1 ZINC000616164910 368999152 /nfs/dbraw/zinc/99/91/52/368999152.db2.gz KMLFBMANMRMEIH-JTQLQIEISA-N 1 2 235.331 2.132 20 0 BEADLO C[C@H]1CCC(C)(C)N1C(=O)CCc1c[nH]c[nH+]1 ZINC000616164910 368999159 /nfs/dbraw/zinc/99/91/59/368999159.db2.gz KMLFBMANMRMEIH-JTQLQIEISA-N 1 2 235.331 2.132 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1[C@@H](C)CCC1(C)C ZINC000616179038 369011816 /nfs/dbraw/zinc/01/18/16/369011816.db2.gz MIXAIYFGETYBTA-MNOVXSKESA-N 1 2 249.358 2.378 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1[C@@H](C)CCC1(C)C ZINC000616179038 369011820 /nfs/dbraw/zinc/01/18/20/369011820.db2.gz MIXAIYFGETYBTA-MNOVXSKESA-N 1 2 249.358 2.378 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H](C)C1CCC1 ZINC000457557097 203074425 /nfs/dbraw/zinc/07/44/25/203074425.db2.gz AVMPUVTVKQTKPA-SNVBAGLBSA-N 1 2 232.327 2.441 20 0 BEADLO C[C@H](CNC(=O)[C@@H](C)C1CCC1)Cn1cc[nH+]c1 ZINC000457568518 203076089 /nfs/dbraw/zinc/07/60/89/203076089.db2.gz FNXFDAZBBXHIJE-NEPJUHHUSA-N 1 2 249.358 2.072 20 0 BEADLO CC(C)(F)CCNC(=O)c1ccc2[nH+]ccn2c1 ZINC000618409018 369138858 /nfs/dbraw/zinc/13/88/58/369138858.db2.gz VQQVLYQDZJTXFX-UHFFFAOYSA-N 1 2 249.289 2.202 20 0 BEADLO CC[C@](C)(NC(=O)C[NH+]1CC(C)(C)C1)C1CC1 ZINC000618960815 369249134 /nfs/dbraw/zinc/24/91/34/369249134.db2.gz KKUMJRDMYOYFFQ-AWEZNQCLSA-N 1 2 238.375 2.023 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N(C(=O)CCn2cc[nH+]c2)C1 ZINC000619132832 369292036 /nfs/dbraw/zinc/29/20/36/369292036.db2.gz PPCJHYOADKZQGO-CHWSQXEVSA-N 1 2 249.358 2.310 20 0 BEADLO C[N@H+](Cc1ccc[nH]1)Cc1cnc(C2CC2)nc1 ZINC000459350743 203263522 /nfs/dbraw/zinc/26/35/22/203263522.db2.gz IXKCLLPWQRXXRY-UHFFFAOYSA-N 1 2 242.326 2.314 20 0 BEADLO C[N@@H+](Cc1ccc[nH]1)Cc1cnc(C2CC2)nc1 ZINC000459350743 203263526 /nfs/dbraw/zinc/26/35/26/203263526.db2.gz IXKCLLPWQRXXRY-UHFFFAOYSA-N 1 2 242.326 2.314 20 0 BEADLO COC1C[NH+](Cc2ccc([C@@H]3C[C@H]3C)o2)C1 ZINC000459588106 203306087 /nfs/dbraw/zinc/30/60/87/203306087.db2.gz VVHCXINWBXXGRI-BXKDBHETSA-N 1 2 221.300 2.234 20 0 BEADLO CCc1cc(OC)ccc1C[NH+]1CC(OC)C1 ZINC000459573788 203302708 /nfs/dbraw/zinc/30/27/08/203302708.db2.gz CDLREIDZUGSVOA-UHFFFAOYSA-N 1 2 235.327 2.088 20 0 BEADLO CCOC1(C)C[NH+](Cc2scnc2C)C1 ZINC000459616439 203316767 /nfs/dbraw/zinc/31/67/67/203316767.db2.gz GIHXACGYCVRUMG-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO CCc1cnc(C[NH+]2CC(C)(COC)C2)s1 ZINC000459619619 203319964 /nfs/dbraw/zinc/31/99/64/203319964.db2.gz FQXIUNSAXOUBOR-UHFFFAOYSA-N 1 2 240.372 2.174 20 0 BEADLO O=C(Nc1nccs1)c1ccc2[nH+]ccn2c1 ZINC000057757627 369409526 /nfs/dbraw/zinc/40/95/26/369409526.db2.gz UXNUTINPDNINNT-UHFFFAOYSA-N 1 2 244.279 2.043 20 0 BEADLO C[C@@H]1CCCCN1C(=O)c1ccc2[nH+]ccn2c1 ZINC000057776521 369448225 /nfs/dbraw/zinc/44/82/25/369448225.db2.gz UHJOOWWEIADCTK-LLVKDONJSA-N 1 2 243.310 2.349 20 0 BEADLO C[C@H]1CCCCN1C(=O)c1ccc2[nH+]ccn2c1 ZINC000057776522 369448358 /nfs/dbraw/zinc/44/83/58/369448358.db2.gz UHJOOWWEIADCTK-NSHDSACASA-N 1 2 243.310 2.349 20 0 BEADLO CCOC[C@H]1CCCC[N@@H+]1Cc1cn[nH]c1C ZINC000459676705 203335986 /nfs/dbraw/zinc/33/59/86/203335986.db2.gz ODWGLIPQIRVWMD-CYBMUJFWSA-N 1 2 237.347 2.109 20 0 BEADLO CCOC[C@H]1CCCC[N@H+]1Cc1cn[nH]c1C ZINC000459676705 203335988 /nfs/dbraw/zinc/33/59/88/203335988.db2.gz ODWGLIPQIRVWMD-CYBMUJFWSA-N 1 2 237.347 2.109 20 0 BEADLO Cc1ccc(C[NH2+]Cc2nnc(C(C)(C)C)[nH]2)o1 ZINC000459707011 203340738 /nfs/dbraw/zinc/34/07/38/203340738.db2.gz NYQLRTQQRSWFFR-UHFFFAOYSA-N 1 2 248.330 2.293 20 0 BEADLO CCOCC[N@@H+]1Cc2cccc(F)c2C1 ZINC000459736634 203346386 /nfs/dbraw/zinc/34/63/86/203346386.db2.gz QCKCVHSEDHGWGB-UHFFFAOYSA-N 1 2 209.264 2.178 20 0 BEADLO CCOCC[N@H+]1Cc2cccc(F)c2C1 ZINC000459736634 203346387 /nfs/dbraw/zinc/34/63/87/203346387.db2.gz QCKCVHSEDHGWGB-UHFFFAOYSA-N 1 2 209.264 2.178 20 0 BEADLO C[C@H](O)CNc1cc2ccccc2c[nH+]1 ZINC000631033641 370977593 /nfs/dbraw/zinc/97/75/93/370977593.db2.gz CCNXQBCJVOOASL-VIFPVBQESA-N 1 2 202.257 2.028 20 0 BEADLO C[C@H]([NH2+]Cc1cc(O)cc(F)c1)c1ccn(C)n1 ZINC000459757244 203358874 /nfs/dbraw/zinc/35/88/74/203358874.db2.gz PULFDPHMLGSVQZ-VIFPVBQESA-N 1 2 249.289 2.116 20 0 BEADLO CCOCC[N@H+](CC)[C@@H](C)c1nnc(CC)o1 ZINC000157462893 326276715 /nfs/dbraw/zinc/27/67/15/326276715.db2.gz NIRRMWIUKLPBMZ-JTQLQIEISA-N 1 2 241.335 2.051 20 0 BEADLO CCOCC[N@@H+](CC)[C@@H](C)c1nnc(CC)o1 ZINC000157462893 326276717 /nfs/dbraw/zinc/27/67/17/326276717.db2.gz NIRRMWIUKLPBMZ-JTQLQIEISA-N 1 2 241.335 2.051 20 0 BEADLO c1c[nH+]c(CNCc2csc(C3CC3)n2)[nH]1 ZINC000069876830 370992309 /nfs/dbraw/zinc/99/23/09/370992309.db2.gz XKODEOBBVIIWRQ-UHFFFAOYSA-N 1 2 234.328 2.033 20 0 BEADLO CC[C@H]1C[C@H](C)CN1C(=O)CCCn1cc[nH+]c1 ZINC000073344120 369585493 /nfs/dbraw/zinc/58/54/93/369585493.db2.gz ZQUJLQWCOCVWOA-STQMWFEESA-N 1 2 249.358 2.310 20 0 BEADLO CS[C@@H](C)CC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000619867572 369623094 /nfs/dbraw/zinc/62/30/94/369623094.db2.gz WSIBWDWPHQMSLT-VIFPVBQESA-N 1 2 249.339 2.414 20 0 BEADLO CC(C)[C@H](NC(=O)CCCn1cc[nH+]c1)C1CC1 ZINC000620039383 369681448 /nfs/dbraw/zinc/68/14/48/369681448.db2.gz VXNKQYFYZWRHAH-AWEZNQCLSA-N 1 2 249.358 2.214 20 0 BEADLO CC(C)[C@@H](NC(=O)CCCn1cc[nH+]c1)C1CC1 ZINC000620039391 369681543 /nfs/dbraw/zinc/68/15/43/369681543.db2.gz VXNKQYFYZWRHAH-CQSZACIVSA-N 1 2 249.358 2.214 20 0 BEADLO C[C@@H](CC(=O)N[C@@]1(C)CC1(C)C)n1cc[nH+]c1 ZINC000620084530 369723218 /nfs/dbraw/zinc/72/32/18/369723218.db2.gz BZKBVWXIUQXKAA-GWCFXTLKSA-N 1 2 235.331 2.139 20 0 BEADLO C[C@H](CC(=O)N[C@]1(C)CC1(C)C)n1cc[nH+]c1 ZINC000620084533 369723525 /nfs/dbraw/zinc/72/35/25/369723525.db2.gz BZKBVWXIUQXKAA-ZWNOBZJWSA-N 1 2 235.331 2.139 20 0 BEADLO Cc1cc(NC[C@H](O)C2CCCCC2)nc[nH+]1 ZINC000110519215 369849156 /nfs/dbraw/zinc/84/91/56/369849156.db2.gz XZIQVKAYOQLWDM-LBPRGKRZSA-N 1 2 235.331 2.138 20 0 BEADLO Cc1cc(NC[C@@H](O)C2CCCCC2)nc[nH+]1 ZINC000110519217 369849298 /nfs/dbraw/zinc/84/92/98/369849298.db2.gz XZIQVKAYOQLWDM-GFCCVEGCSA-N 1 2 235.331 2.138 20 0 BEADLO CN(C(=O)CCCn1cc[nH+]c1)C1CCCC1 ZINC000620413443 369867517 /nfs/dbraw/zinc/86/75/17/369867517.db2.gz XVTZPMKERFUEPD-UHFFFAOYSA-N 1 2 235.331 2.064 20 0 BEADLO CC(C)C[C@@H](C)C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620603467 369951989 /nfs/dbraw/zinc/95/19/89/369951989.db2.gz IOPWQEMYJLGZES-GHMZBOCLSA-N 1 2 237.347 2.280 20 0 BEADLO C[C@@H](NC(=O)C(C)(C)C1CC1)c1[nH+]ccn1C ZINC000620608956 369956855 /nfs/dbraw/zinc/95/68/55/369956855.db2.gz QIEOOAFMFMCJAY-SECBINFHSA-N 1 2 235.331 2.034 20 0 BEADLO Cc1cn2ccc(NC(=O)C3(C)CC3)cc2[nH+]1 ZINC000620649955 369972264 /nfs/dbraw/zinc/97/22/64/369972264.db2.gz ICVGZTQAEJFROD-UHFFFAOYSA-N 1 2 229.283 2.381 20 0 BEADLO Cc1cn2ccc(NC(=O)C(C)C)cc2[nH+]1 ZINC000620649144 369972279 /nfs/dbraw/zinc/97/22/79/369972279.db2.gz VDWIIPWYJNGUPC-UHFFFAOYSA-N 1 2 217.272 2.237 20 0 BEADLO CC(C)CCC(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620593222 369946392 /nfs/dbraw/zinc/94/63/92/369946392.db2.gz XRGOHPTXEZREAZ-SNVBAGLBSA-N 1 2 223.320 2.034 20 0 BEADLO CCCCC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000074859403 370048539 /nfs/dbraw/zinc/04/85/39/370048539.db2.gz XKYMNWPLDSHVDZ-UHFFFAOYSA-N 1 2 217.272 2.463 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@@H](C)c2nnc(C)o2)CCS1 ZINC000076072685 370210619 /nfs/dbraw/zinc/21/06/19/370210619.db2.gz DIKCICNFKQMFDC-WCBMZHEXSA-N 1 2 241.360 2.266 20 0 BEADLO CC[C@@H]1C[N@H+]([C@@H](C)c2nnc(C)o2)CCS1 ZINC000076072685 370210621 /nfs/dbraw/zinc/21/06/21/370210621.db2.gz DIKCICNFKQMFDC-WCBMZHEXSA-N 1 2 241.360 2.266 20 0 BEADLO Cc1ccnc([C@@H](C)Nc2cc(C)[nH+]cn2)n1 ZINC000621329212 370262472 /nfs/dbraw/zinc/26/24/72/370262472.db2.gz UJQNEWAKISPJGI-SNVBAGLBSA-N 1 2 229.287 2.057 20 0 BEADLO Cc1csc([C@H](C)[NH2+]Cc2nccnc2C)n1 ZINC000621333803 370266831 /nfs/dbraw/zinc/26/68/31/370266831.db2.gz RGFXNQOAVZXLRA-JTQLQIEISA-N 1 2 248.355 2.401 20 0 BEADLO C[C@@H](c1ccccc1F)[NH+]1CCN(C)CC1 ZINC000076574614 370321520 /nfs/dbraw/zinc/32/15/20/370321520.db2.gz XITJQXHSIYBIMP-NSHDSACASA-N 1 2 222.307 2.134 20 0 BEADLO Cn1nc(C[NH2+]Cc2ccco2)c2ccccc21 ZINC000112337662 370285206 /nfs/dbraw/zinc/28/52/06/370285206.db2.gz ZZEMEVQYEPWWIO-UHFFFAOYSA-N 1 2 241.294 2.456 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)[C@H]1CCc2[nH+]ccn2C1 ZINC000621545777 370384772 /nfs/dbraw/zinc/38/47/72/370384772.db2.gz FNHJIBGOVQESND-NEPJUHHUSA-N 1 2 249.358 2.093 20 0 BEADLO CC1(C)CC[C@@H]1C(=O)NCCNc1cccc[nH+]1 ZINC000621424032 370349468 /nfs/dbraw/zinc/34/94/68/370349468.db2.gz KAVFWHLQGIJGEF-LLVKDONJSA-N 1 2 247.342 2.046 20 0 BEADLO CC[N@H+](CCC(F)(F)F)Cc1ccon1 ZINC000077274049 370409464 /nfs/dbraw/zinc/40/94/64/370409464.db2.gz PRJZAFSVNVXEAR-UHFFFAOYSA-N 1 2 222.210 2.449 20 0 BEADLO CC[N@@H+](CCC(F)(F)F)Cc1ccon1 ZINC000077274049 370409465 /nfs/dbraw/zinc/40/94/65/370409465.db2.gz PRJZAFSVNVXEAR-UHFFFAOYSA-N 1 2 222.210 2.449 20 0 BEADLO Cc1nccnc1C[N@H+](C)Cc1ccoc1 ZINC000621713163 370458982 /nfs/dbraw/zinc/45/89/82/370458982.db2.gz BFIVMZYKIUOYLQ-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1nccnc1C[N@@H+](C)Cc1ccoc1 ZINC000621713163 370458985 /nfs/dbraw/zinc/45/89/85/370458985.db2.gz BFIVMZYKIUOYLQ-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1nccnc1C[N@@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000621725536 370476992 /nfs/dbraw/zinc/47/69/92/370476992.db2.gz RXVDNAXSFWNQOT-CYBMUJFWSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1nccnc1C[N@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000621725536 370476996 /nfs/dbraw/zinc/47/69/96/370476996.db2.gz RXVDNAXSFWNQOT-CYBMUJFWSA-N 1 2 249.358 2.032 20 0 BEADLO CCOc1cncc(C[N@@H+]2CC[C@@H](F)C2)c1 ZINC000621730187 370483474 /nfs/dbraw/zinc/48/34/74/370483474.db2.gz BUSUNRPWHGPENS-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO CCOc1cncc(C[N@H+]2CC[C@@H](F)C2)c1 ZINC000621730187 370483476 /nfs/dbraw/zinc/48/34/76/370483476.db2.gz BUSUNRPWHGPENS-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO Cn1ccc(C[NH+]2CC(C)(c3ccccc3)C2)n1 ZINC000621733974 370485993 /nfs/dbraw/zinc/48/59/93/370485993.db2.gz CADURKSGHHRDAE-UHFFFAOYSA-N 1 2 241.338 2.194 20 0 BEADLO CC(C)=C[C@H]1[C@@H](C(=O)NCc2[nH]cc[nH+]2)C1(C)C ZINC000114336445 370553440 /nfs/dbraw/zinc/55/34/40/370553440.db2.gz JTYMFIOIKZLSMB-JQWIXIFHSA-N 1 2 247.342 2.264 20 0 BEADLO CC(C)=C[C@@H]1[C@H](C(=O)NCc2[nH]cc[nH+]2)C1(C)C ZINC000114336439 370554026 /nfs/dbraw/zinc/55/40/26/370554026.db2.gz JTYMFIOIKZLSMB-ZYHUDNBSSA-N 1 2 247.342 2.264 20 0 BEADLO CC[C@@]1(C)CCN(C(=O)C(C)(C)c2c[nH+]c[nH]2)C1 ZINC000621911998 370595160 /nfs/dbraw/zinc/59/51/60/370595160.db2.gz WPCSICLEWHCDCL-AWEZNQCLSA-N 1 2 249.358 2.336 20 0 BEADLO CCCC[C@H](C(=O)NCc1c[nH+]c[nH]1)C(C)C ZINC000621876888 370575472 /nfs/dbraw/zinc/57/54/72/370575472.db2.gz LUYRGDVYZWFSSK-LBPRGKRZSA-N 1 2 237.347 2.488 20 0 BEADLO CCCC[C@H](C(=O)NCc1c[nH]c[nH+]1)C(C)C ZINC000621876888 370575475 /nfs/dbraw/zinc/57/54/75/370575475.db2.gz LUYRGDVYZWFSSK-LBPRGKRZSA-N 1 2 237.347 2.488 20 0 BEADLO CC(C)=CCCNC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000621970901 370628787 /nfs/dbraw/zinc/62/87/87/370628787.db2.gz VTICHIQZIRLVRO-UHFFFAOYSA-N 1 2 235.331 2.160 20 0 BEADLO CCOc1ncccc1C[NH2+]Cc1cc(C)no1 ZINC000631040187 370997270 /nfs/dbraw/zinc/99/72/70/370997270.db2.gz QJRLHHZVLNKGRT-UHFFFAOYSA-N 1 2 247.298 2.067 20 0 BEADLO CC(C)(C(=O)N[C@H]1CCC(C)(C)C1)c1c[nH]c[nH+]1 ZINC000621939605 370609723 /nfs/dbraw/zinc/60/97/23/370609723.db2.gz JRKSOKMZQQOAJP-JTQLQIEISA-N 1 2 249.358 2.382 20 0 BEADLO C[C@@H](CC(=O)OC(C)(C)C)[NH2+]CC(C)(F)F ZINC000378875456 371024322 /nfs/dbraw/zinc/02/43/22/371024322.db2.gz ZDHHPRULIHIDMD-QMMMGPOBSA-N 1 2 237.290 2.352 20 0 BEADLO COc1ccc[nH+]c1N1CCC[C@@H](C)C1 ZINC000623788850 371094353 /nfs/dbraw/zinc/09/43/53/371094353.db2.gz SZXLDXIBVLEUTC-SNVBAGLBSA-N 1 2 206.289 2.327 20 0 BEADLO FCC[NH2+][C@H]1CCCc2scnc21 ZINC000623977351 371211634 /nfs/dbraw/zinc/21/16/34/371211634.db2.gz OOOBKKIITXQLEJ-ZETCQYMHSA-N 1 2 200.282 2.080 20 0 BEADLO C[C@H]([NH2+]C1(C(F)F)CC1)[C@H]1CCCCO1 ZINC000623979134 371212972 /nfs/dbraw/zinc/21/29/72/371212972.db2.gz RECWLTWGYBTOBR-DTWKUNHWSA-N 1 2 219.275 2.331 20 0 BEADLO Cc1cc(C(=O)NCC2CCC2)c2[nH+]ccn2c1 ZINC000624022079 371254444 /nfs/dbraw/zinc/25/44/44/371254444.db2.gz BHMDXVIPWUDHBK-UHFFFAOYSA-N 1 2 243.310 2.173 20 0 BEADLO COc1ccc[nH+]c1N1CCC[C@H](OC)CC1 ZINC000624095460 371303394 /nfs/dbraw/zinc/30/33/94/371303394.db2.gz DKYJHCCGNBPBTF-NSHDSACASA-N 1 2 236.315 2.096 20 0 BEADLO CC[C@H]1CCCN(C(=O)CCCn2cc[nH+]c2)C1 ZINC000125315230 371317752 /nfs/dbraw/zinc/31/77/52/371317752.db2.gz BAIWELUMKHNKHF-ZDUSSCGKSA-N 1 2 249.358 2.312 20 0 BEADLO CCC(F)(F)C[NH2+][C@H]1CN(C2CC2)C[C@@H]1C ZINC000624147625 371341910 /nfs/dbraw/zinc/34/19/10/371341910.db2.gz GMSLGFYXPVDDDF-ONGXEEELSA-N 1 2 232.318 2.104 20 0 BEADLO CCC(F)(F)CN[C@H]1CCCn2cc[nH+]c21 ZINC000624148516 371344534 /nfs/dbraw/zinc/34/45/34/371344534.db2.gz GYLDPXXEKKMJLK-VIFPVBQESA-N 1 2 229.274 2.353 20 0 BEADLO CC[C@H](C)C[C@@H](CO)Nc1[nH+]cccc1OC ZINC000624330553 371483715 /nfs/dbraw/zinc/48/37/15/371483715.db2.gz YUJOFQLBICKFKQ-QWRGUYRKSA-N 1 2 238.331 2.299 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1CCC[C@H](C)O1 ZINC000624399634 371500857 /nfs/dbraw/zinc/50/08/57/371500857.db2.gz RASKYRUOUVPZOG-WDEREUQCSA-N 1 2 236.315 2.460 20 0 BEADLO Cc1nc(N2CCCC(F)(F)CC2)cc[nH+]1 ZINC000624521005 371528513 /nfs/dbraw/zinc/52/85/13/371528513.db2.gz LVBQYENBWVXRJG-UHFFFAOYSA-N 1 2 227.258 2.411 20 0 BEADLO CC[C@H](CC(=O)N1CCc2[nH]c[nH+]c2C1)C(C)C ZINC000627367419 371586175 /nfs/dbraw/zinc/58/61/75/371586175.db2.gz TXELDFUTWVMSHJ-LLVKDONJSA-N 1 2 249.358 2.367 20 0 BEADLO CC[C@H](CC(=O)N1CCc2[nH+]c[nH]c2C1)C(C)C ZINC000627367419 371586181 /nfs/dbraw/zinc/58/61/81/371586181.db2.gz TXELDFUTWVMSHJ-LLVKDONJSA-N 1 2 249.358 2.367 20 0 BEADLO C[C@H]1CCC[C@H]1CC(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627369736 371587511 /nfs/dbraw/zinc/58/75/11/371587511.db2.gz BKGHDRCUANAILV-QWRGUYRKSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@H]1CCC[C@H]1CC(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627369736 371587516 /nfs/dbraw/zinc/58/75/16/371587516.db2.gz BKGHDRCUANAILV-QWRGUYRKSA-N 1 2 247.342 2.121 20 0 BEADLO CC1(C)CC[C@@H](C(=O)N2CCc3[nH]c[nH+]c3C2)C1 ZINC000627370359 371587594 /nfs/dbraw/zinc/58/75/94/371587594.db2.gz WVHBOCYKIMUGGG-SNVBAGLBSA-N 1 2 247.342 2.121 20 0 BEADLO CC1(C)CC[C@@H](C(=O)N2CCc3[nH+]c[nH]c3C2)C1 ZINC000627370359 371587598 /nfs/dbraw/zinc/58/75/98/371587598.db2.gz WVHBOCYKIMUGGG-SNVBAGLBSA-N 1 2 247.342 2.121 20 0 BEADLO CCC(CC)CC(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627369429 371588091 /nfs/dbraw/zinc/58/80/91/371588091.db2.gz SQRYNTYGHBETCH-UHFFFAOYSA-N 1 2 235.331 2.121 20 0 BEADLO CCC(CC)CC(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627369429 371588093 /nfs/dbraw/zinc/58/80/93/371588093.db2.gz SQRYNTYGHBETCH-UHFFFAOYSA-N 1 2 235.331 2.121 20 0 BEADLO C[C@](CO)([NH2+]Cc1nccs1)c1ccccc1 ZINC000227213040 371803996 /nfs/dbraw/zinc/80/39/96/371803996.db2.gz QLKWHAIDWYMZHG-CYBMUJFWSA-N 1 2 248.351 2.140 20 0 BEADLO COC(=O)[C@H]([NH2+][C@@H]1CCc2ccccc21)C1CC1 ZINC000227768048 371932961 /nfs/dbraw/zinc/93/29/61/371932961.db2.gz RAAAGDAEZDQPCU-ZIAGYGMSSA-N 1 2 245.322 2.215 20 0 BEADLO CCc1cc(NCC2(SC)CC2)nc[nH+]1 ZINC000227991497 371966288 /nfs/dbraw/zinc/96/62/88/371966288.db2.gz LGICPXCASIPBMU-UHFFFAOYSA-N 1 2 223.345 2.347 20 0 BEADLO Cc1cccn2cc(C[NH+]3CCSCC3)nc12 ZINC000059386008 372175764 /nfs/dbraw/zinc/17/57/64/372175764.db2.gz JTADSWAJGZMPQN-UHFFFAOYSA-N 1 2 247.367 2.192 20 0 BEADLO C[C@]1(O)CCN(c2cc3ccccc3c[nH+]2)C1 ZINC000631146844 372208317 /nfs/dbraw/zinc/20/83/17/372208317.db2.gz LMZMNCFLLUZRLI-AWEZNQCLSA-N 1 2 228.295 2.196 20 0 BEADLO Cc1c[nH]c(C[NH2+]Cc2cccc(F)c2F)n1 ZINC000631205438 372234985 /nfs/dbraw/zinc/23/49/85/372234985.db2.gz ASNTVMBGBPIRSY-UHFFFAOYSA-N 1 2 237.253 2.286 20 0 BEADLO CCCCc1cc(NC2(COC)CC2)nc[nH+]1 ZINC000631261154 372267198 /nfs/dbraw/zinc/26/71/98/372267198.db2.gz GIXURRMFNMTGQE-UHFFFAOYSA-N 1 2 235.331 2.410 20 0 BEADLO C[C@H](CF)Nc1[nH+]c(C2CC2)nc2[nH]ccc21 ZINC000631282949 372276537 /nfs/dbraw/zinc/27/65/37/372276537.db2.gz CRKGCMICOBQPMQ-SSDOTTSWSA-N 1 2 234.278 2.027 20 0 BEADLO CCCCc1cc(NC2(CCO)CC2)nc[nH+]1 ZINC000631287053 372278097 /nfs/dbraw/zinc/27/80/97/372278097.db2.gz FCILCSYQOJXLBN-UHFFFAOYSA-N 1 2 235.331 2.146 20 0 BEADLO CN(CCF)c1[nH+]c(C2CC2)nc2[nH]ccc21 ZINC000631293385 372280734 /nfs/dbraw/zinc/28/07/34/372280734.db2.gz APNJIJNJEKWRCH-UHFFFAOYSA-N 1 2 234.278 2.241 20 0 BEADLO C[C@@H]1C[C@H](O)CN(c2cc3ccccc3c[nH+]2)C1 ZINC000631296747 372282004 /nfs/dbraw/zinc/28/20/04/372282004.db2.gz MMUOVMXTEGYJFF-RISCZKNCSA-N 1 2 242.322 2.442 20 0 BEADLO CCCCc1cc(N(C)Cc2c[nH+]c[nH]2)ncn1 ZINC000631350042 372307505 /nfs/dbraw/zinc/30/75/05/372307505.db2.gz SOYQXOMLTAHQGP-UHFFFAOYSA-N 1 2 245.330 2.179 20 0 BEADLO CCc1cc(N[C@@H](C)c2cnccn2)nc[nH+]1 ZINC000631348252 372307549 /nfs/dbraw/zinc/30/75/49/372307549.db2.gz OIMRNASSZRDHLQ-VIFPVBQESA-N 1 2 229.287 2.002 20 0 BEADLO CCCCc1cc(NCc2ccns2)nc[nH+]1 ZINC000631386532 372329647 /nfs/dbraw/zinc/32/96/47/372329647.db2.gz CRIDCUARPWABHJ-UHFFFAOYSA-N 1 2 248.355 2.310 20 0 BEADLO CCCCc1cc(N[C@H]2C[C@H](OC)C2)nc[nH+]1 ZINC000631394398 372334249 /nfs/dbraw/zinc/33/42/49/372334249.db2.gz PWOWGOFFIYNIBA-HAQNSBGRSA-N 1 2 235.331 2.409 20 0 BEADLO CC[C@@H](CC(=O)NCc1c[nH+]c[nH]1)C(C)(C)C ZINC000631413115 372346830 /nfs/dbraw/zinc/34/68/30/372346830.db2.gz AOENVGVEKLTBHR-JTQLQIEISA-N 1 2 237.347 2.488 20 0 BEADLO CC[C@@H](CC(=O)NCc1c[nH]c[nH+]1)C(C)(C)C ZINC000631413115 372346835 /nfs/dbraw/zinc/34/68/35/372346835.db2.gz AOENVGVEKLTBHR-JTQLQIEISA-N 1 2 237.347 2.488 20 0 BEADLO CC[C@]1(O)CCCN(c2nc(C)[nH+]c(C)c2C)C1 ZINC000631486583 372390401 /nfs/dbraw/zinc/39/04/01/372390401.db2.gz VUCGSRMFMBSGCU-AWEZNQCLSA-N 1 2 249.358 2.143 20 0 BEADLO C[C@@H]1c2cccn2CC[N@H+]1CC(F)F ZINC000171668701 372726363 /nfs/dbraw/zinc/72/63/63/372726363.db2.gz MXNFKBOZCVBMMM-MRVPVSSYSA-N 1 2 200.232 2.130 20 0 BEADLO C[C@@H]1c2cccn2CC[N@@H+]1CC(F)F ZINC000171668701 372726368 /nfs/dbraw/zinc/72/63/68/372726368.db2.gz MXNFKBOZCVBMMM-MRVPVSSYSA-N 1 2 200.232 2.130 20 0 BEADLO O=C(CSC1CC1)Nc1ccn2cc[nH+]c2c1 ZINC000297886176 182008093 /nfs/dbraw/zinc/00/80/93/182008093.db2.gz VDTHYFLYFZPWRL-UHFFFAOYSA-N 1 2 247.323 2.168 20 0 BEADLO OCC[N@H+](CC(F)F)[C@@H]1CCc2ccccc21 ZINC000172256674 372919970 /nfs/dbraw/zinc/91/99/70/372919970.db2.gz KIVZEFOIPAVVQN-GFCCVEGCSA-N 1 2 241.281 2.233 20 0 BEADLO OCC[N@@H+](CC(F)F)[C@@H]1CCc2ccccc21 ZINC000172256674 372919978 /nfs/dbraw/zinc/91/99/78/372919978.db2.gz KIVZEFOIPAVVQN-GFCCVEGCSA-N 1 2 241.281 2.233 20 0 BEADLO CCO[C@@H]1C[C@@H]([N@H+](C)CC(F)F)C1(C)C ZINC000172665901 373036925 /nfs/dbraw/zinc/03/69/25/373036925.db2.gz RBFHVDOWPQPAAK-RKDXNWHRSA-N 1 2 221.291 2.387 20 0 BEADLO CCO[C@@H]1C[C@@H]([N@@H+](C)CC(F)F)C1(C)C ZINC000172665901 373036930 /nfs/dbraw/zinc/03/69/30/373036930.db2.gz RBFHVDOWPQPAAK-RKDXNWHRSA-N 1 2 221.291 2.387 20 0 BEADLO O=C(Cn1cc[nH+]c1)Nc1ccc2cc[nH]c2c1 ZINC000360455757 182071725 /nfs/dbraw/zinc/07/17/25/182071725.db2.gz PIOVUORJRUHVNV-UHFFFAOYSA-N 1 2 240.266 2.003 20 0 BEADLO O=C(NC1CCC1)c1cccc(-n2cc[nH+]c2)c1 ZINC000334156166 182106973 /nfs/dbraw/zinc/10/69/73/182106973.db2.gz XQCBTLGXYQDVEC-UHFFFAOYSA-N 1 2 241.294 2.155 20 0 BEADLO CC(C)[C@@H]1C[N@H+](CC(F)F)CCS1 ZINC000174335275 374182143 /nfs/dbraw/zinc/18/21/43/374182143.db2.gz OIEBQRIRRMFMSZ-QMMMGPOBSA-N 1 2 209.305 2.325 20 0 BEADLO CC(C)[C@@H]1C[N@@H+](CC(F)F)CCS1 ZINC000174335275 374182156 /nfs/dbraw/zinc/18/21/56/374182156.db2.gz OIEBQRIRRMFMSZ-QMMMGPOBSA-N 1 2 209.305 2.325 20 0 BEADLO Cc1ccc(CNC(=O)C[C@H](C)n2cc[nH+]c2)o1 ZINC000634313151 374165153 /nfs/dbraw/zinc/16/51/53/374165153.db2.gz QMHZPZBTGJXWJD-JTQLQIEISA-N 1 2 247.298 2.052 20 0 BEADLO CC(C)Cn1ccnc1C[NH2+]Cc1ccco1 ZINC000174454330 374216328 /nfs/dbraw/zinc/21/63/28/374216328.db2.gz CZVWPVBCCHZFHE-UHFFFAOYSA-N 1 2 233.315 2.422 20 0 BEADLO C[C@@H](CC1CCC1)NC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000634369757 374218274 /nfs/dbraw/zinc/21/82/74/374218274.db2.gz HUHVNVRNSVZIBW-JTQLQIEISA-N 1 2 249.358 2.382 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)C1CCCCCCC1 ZINC000086580597 182273387 /nfs/dbraw/zinc/27/33/87/182273387.db2.gz AZEWVGKPEPGMAJ-UHFFFAOYSA-N 1 2 235.331 2.386 20 0 BEADLO CSCC[NH2+][C@H](C(=O)OC(C)(C)C)C(C)C ZINC000184311564 206011452 /nfs/dbraw/zinc/01/14/52/206011452.db2.gz FTLPCYGRGFZBNR-JTQLQIEISA-N 1 2 247.404 2.305 20 0 BEADLO c1cc(OCc2nc(C3CCC3)no2)cc[nH+]1 ZINC000634547808 374302758 /nfs/dbraw/zinc/30/27/58/374302758.db2.gz FGNLDUMMZLELPZ-UHFFFAOYSA-N 1 2 231.255 2.311 20 0 BEADLO CC[C@@H](O)C[NH2+][C@@H](Cc1ccccc1)C(F)F ZINC000421879634 206027047 /nfs/dbraw/zinc/02/70/47/206027047.db2.gz PGHPOSOTDIJGIC-NEPJUHHUSA-N 1 2 243.297 2.223 20 0 BEADLO CC(C)CC1(C(=O)N(C)Cc2[nH+]ccn2C)CC1 ZINC000440446744 206078674 /nfs/dbraw/zinc/07/86/74/206078674.db2.gz MZQPASJUFKRMSJ-UHFFFAOYSA-N 1 2 249.358 2.205 20 0 BEADLO CC[C@@H](F)C[N@H+](CC(=O)OC)[C@H](C)CC ZINC000440488018 206080181 /nfs/dbraw/zinc/08/01/81/206080181.db2.gz CMZSNELSFPXWNO-NXEZZACHSA-N 1 2 219.300 2.008 20 0 BEADLO CC[C@@H](F)C[N@@H+](CC(=O)OC)[C@H](C)CC ZINC000440488018 206080189 /nfs/dbraw/zinc/08/01/89/206080189.db2.gz CMZSNELSFPXWNO-NXEZZACHSA-N 1 2 219.300 2.008 20 0 BEADLO COCCOC1C[NH+](Cc2ccc(C)c(C)c2)C1 ZINC000459465507 206126845 /nfs/dbraw/zinc/12/68/45/206126845.db2.gz NPVMLPODAWFMHU-UHFFFAOYSA-N 1 2 249.354 2.151 20 0 BEADLO CC(C)n1ccc(C[C@@H](C)[NH2+]CC(F)F)n1 ZINC000459545480 206134537 /nfs/dbraw/zinc/13/45/37/206134537.db2.gz LUZVDDKBEDKFNG-SECBINFHSA-N 1 2 231.290 2.250 20 0 BEADLO CCOC(=O)CCCCC[N@H+](C)CC(F)F ZINC000117879171 170198610 /nfs/dbraw/zinc/19/86/10/170198610.db2.gz XCZHZZRPAPYJKX-UHFFFAOYSA-N 1 2 237.290 2.307 20 0 BEADLO CCOC(=O)CCCCC[N@@H+](C)CC(F)F ZINC000117879171 170198612 /nfs/dbraw/zinc/19/86/12/170198612.db2.gz XCZHZZRPAPYJKX-UHFFFAOYSA-N 1 2 237.290 2.307 20 0 BEADLO Cc1cc(NC(=O)Nc2cc[nH+]cc2C)n[nH]1 ZINC000192288844 259585956 /nfs/dbraw/zinc/58/59/56/259585956.db2.gz ZASRFDVWHRTUOE-UHFFFAOYSA-N 1 2 231.259 2.066 20 0 BEADLO CCOCC[N@H+](C)Cc1cccnc1Cl ZINC000087977629 170389955 /nfs/dbraw/zinc/38/99/55/170389955.db2.gz CCUAPCKYDGQWDP-UHFFFAOYSA-N 1 2 228.723 2.203 20 0 BEADLO CCOCC[N@@H+](C)Cc1cccnc1Cl ZINC000087977629 170389957 /nfs/dbraw/zinc/38/99/57/170389957.db2.gz CCUAPCKYDGQWDP-UHFFFAOYSA-N 1 2 228.723 2.203 20 0 BEADLO OC1(c2ccccc2)C[NH+](Cc2cccs2)C1 ZINC000285704304 183022748 /nfs/dbraw/zinc/02/27/48/183022748.db2.gz ONAHRMSGTWQAGH-UHFFFAOYSA-N 1 2 245.347 2.452 20 0 BEADLO OC1(c2ccc(F)cc2)C[NH+](Cc2ccco2)C1 ZINC000375073611 183023474 /nfs/dbraw/zinc/02/34/74/183023474.db2.gz GQSJOCQMSAVJSJ-UHFFFAOYSA-N 1 2 247.269 2.122 20 0 BEADLO OCC[N@H+](Cc1nccs1)Cc1ccccc1 ZINC000094975998 183070338 /nfs/dbraw/zinc/07/03/38/183070338.db2.gz MXEXUONCDVGOIW-UHFFFAOYSA-N 1 2 248.351 2.138 20 0 BEADLO OCC[N@@H+](Cc1nccs1)Cc1ccccc1 ZINC000094975998 183070340 /nfs/dbraw/zinc/07/03/40/183070340.db2.gz MXEXUONCDVGOIW-UHFFFAOYSA-N 1 2 248.351 2.138 20 0 BEADLO OCC[N@@H+]1CCCc2c3cccc(F)c3[nH]c2C1 ZINC000336404247 183074397 /nfs/dbraw/zinc/07/43/97/183074397.db2.gz OYWIOGVDFFADIP-UHFFFAOYSA-N 1 2 248.301 2.048 20 0 BEADLO OCC[N@H+]1CCCc2c3cccc(F)c3[nH]c2C1 ZINC000336404247 183074402 /nfs/dbraw/zinc/07/44/02/183074402.db2.gz OYWIOGVDFFADIP-UHFFFAOYSA-N 1 2 248.301 2.048 20 0 BEADLO OCCOCCCNc1ccc2ccccc2[nH+]1 ZINC000227313186 183081473 /nfs/dbraw/zinc/08/14/73/183081473.db2.gz JXFBFVLHIIUABF-UHFFFAOYSA-N 1 2 246.310 2.046 20 0 BEADLO OCC[C@@H]1CCC[C@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000275016980 183095366 /nfs/dbraw/zinc/09/53/66/183095366.db2.gz LCBJHMZSHRZOHI-CMPLNLGQSA-N 1 2 247.342 2.317 20 0 BEADLO CCCC[C@H](COC)[NH2+]Cc1cn[nH]c1C ZINC000265455123 169005166 /nfs/dbraw/zinc/00/51/66/169005166.db2.gz BMCKFLNXSWLXEL-GFCCVEGCSA-N 1 2 225.336 2.013 20 0 BEADLO OC[C@@H]1CCCC[C@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000266217584 183118302 /nfs/dbraw/zinc/11/83/02/183118302.db2.gz PNOVFBZBAKVAKE-NWDGAFQWSA-N 1 2 247.342 2.317 20 0 BEADLO CCCC[C@H]([NH2+][C@@H]1CSC[C@@H]1C)C(=O)OC ZINC000310002925 169012630 /nfs/dbraw/zinc/01/26/30/169012630.db2.gz FMSJELPPXCBLEO-GARJFASQSA-N 1 2 245.388 2.059 20 0 BEADLO CCCC[C@H]([NH2+][C@H]1C[C@@H]1C1CC1)C(=O)OC ZINC000310016237 169012748 /nfs/dbraw/zinc/01/27/48/169012748.db2.gz LAWAOYUOLRJIJL-WOPDTQHZSA-N 1 2 225.332 2.106 20 0 BEADLO CCCC[C@H]([NH2+][C@H]1CC[C@@H](F)C1)C(=O)OC ZINC000336747543 169013265 /nfs/dbraw/zinc/01/32/65/169013265.db2.gz XGSVOLIKOSHDHH-VWYCJHECSA-N 1 2 231.311 2.198 20 0 BEADLO CCCC[C@H]([NH2+][C@@H]1C[C@@H]1CC)C(=O)OC ZINC000300389999 169013383 /nfs/dbraw/zinc/01/33/83/169013383.db2.gz SUSKKCCMRBHPJF-GARJFASQSA-N 1 2 213.321 2.106 20 0 BEADLO CCCCn1cc(C[NH2+]Cc2cc[nH]n2)c(C)n1 ZINC000358503086 169036442 /nfs/dbraw/zinc/03/64/42/169036442.db2.gz DQEYDPKKIRUTOW-UHFFFAOYSA-N 1 2 247.346 2.005 20 0 BEADLO O[C@@H]1CCCCC[C@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000288234794 183188469 /nfs/dbraw/zinc/18/84/69/183188469.db2.gz NSVRFEDZEBGZBS-VXGBXAGGSA-N 1 2 247.342 2.460 20 0 BEADLO O[C@@H]1CCC[C@@H](CNc2cc[nH+]c(C3CC3)n2)C1 ZINC000301394146 183193989 /nfs/dbraw/zinc/19/39/89/183193989.db2.gz KEOZVBRYQXRQAR-ZYHUDNBSSA-N 1 2 247.342 2.317 20 0 BEADLO O[C@H](C[N@@H+]1CCC=C(F)C1)c1ccccc1 ZINC000272489337 183219745 /nfs/dbraw/zinc/21/97/45/183219745.db2.gz MYGNEMPLARVOTJ-CYBMUJFWSA-N 1 2 221.275 2.279 20 0 BEADLO O[C@H](C[N@H+]1CCC=C(F)C1)c1ccccc1 ZINC000272489337 183219747 /nfs/dbraw/zinc/21/97/47/183219747.db2.gz MYGNEMPLARVOTJ-CYBMUJFWSA-N 1 2 221.275 2.279 20 0 BEADLO O[C@H]1CCC[C@H](CNc2cc[nH+]c(C3CC3)n2)C1 ZINC000301394144 183236302 /nfs/dbraw/zinc/23/63/02/183236302.db2.gz KEOZVBRYQXRQAR-JQWIXIFHSA-N 1 2 247.342 2.317 20 0 BEADLO CCC[N@H+](CC)[C@@H](C(=O)OC)c1cccnc1 ZINC000270683007 169132498 /nfs/dbraw/zinc/13/24/98/169132498.db2.gz CUSPEOXEDMGPTK-GFCCVEGCSA-N 1 2 236.315 2.028 20 0 BEADLO CCC[N@@H+](CC)[C@@H](C(=O)OC)c1cccnc1 ZINC000270683007 169132501 /nfs/dbraw/zinc/13/25/01/169132501.db2.gz CUSPEOXEDMGPTK-GFCCVEGCSA-N 1 2 236.315 2.028 20 0 BEADLO O=c1cc(CNc2cc[nH+]c(C3CC3)n2)cc[nH]1 ZINC000271667448 183257337 /nfs/dbraw/zinc/25/73/37/183257337.db2.gz ZQMVYISHIIRTEK-UHFFFAOYSA-N 1 2 242.282 2.067 20 0 BEADLO CCCN(CCC)C(=O)[C@H]1CCc2[nH+]ccn2C1 ZINC000371483733 169144744 /nfs/dbraw/zinc/14/47/44/169144744.db2.gz UUOHESARXZWSIG-LBPRGKRZSA-N 1 2 249.358 2.094 20 0 BEADLO CCC[N@H+](CCn1cc(C)cn1)CC(F)F ZINC000336667732 169170501 /nfs/dbraw/zinc/17/05/01/169170501.db2.gz OKWLLQLJVDHNOH-UHFFFAOYSA-N 1 2 231.290 2.169 20 0 BEADLO CCC[N@@H+](CCn1cc(C)cn1)CC(F)F ZINC000336667732 169170503 /nfs/dbraw/zinc/17/05/03/169170503.db2.gz OKWLLQLJVDHNOH-UHFFFAOYSA-N 1 2 231.290 2.169 20 0 BEADLO CCCN(c1cc(N2CCCC2)[nH+]cn1)C1CC1 ZINC000286585809 169182323 /nfs/dbraw/zinc/18/23/23/169182323.db2.gz SWPWUJHLCWJTCE-UHFFFAOYSA-N 1 2 246.358 2.456 20 0 BEADLO CCCN(c1cc(N2CCCC2)nc[nH+]1)C1CC1 ZINC000286585809 169182325 /nfs/dbraw/zinc/18/23/25/169182325.db2.gz SWPWUJHLCWJTCE-UHFFFAOYSA-N 1 2 246.358 2.456 20 0 BEADLO c1c[nH+]c(CNc2ccc3c(c2)CCCO3)[nH]1 ZINC000178218960 183325689 /nfs/dbraw/zinc/32/56/89/183325689.db2.gz QHCSGTUMSSAYKG-UHFFFAOYSA-N 1 2 229.283 2.347 20 0 BEADLO c1c[nH]c([C@@H]2CCC[N@H+]2Cc2cnc[nH]2)c1 ZINC000274882939 183327208 /nfs/dbraw/zinc/32/72/08/183327208.db2.gz XGAQUFFOVWXXRY-LBPRGKRZSA-N 1 2 216.288 2.075 20 0 BEADLO c1c[nH]c([C@@H]2CCC[N@@H+]2Cc2cnc[nH]2)c1 ZINC000274882939 183327210 /nfs/dbraw/zinc/32/72/10/183327210.db2.gz XGAQUFFOVWXXRY-LBPRGKRZSA-N 1 2 216.288 2.075 20 0 BEADLO c1cc(C[N@@H+]2CCO[C@@H](C3CCCCC3)C2)n[nH]1 ZINC000336375014 183345026 /nfs/dbraw/zinc/34/50/26/183345026.db2.gz POKOOHYPCUKILO-CQSZACIVSA-N 1 2 249.358 2.191 20 0 BEADLO c1cc(C[N@H+]2CCO[C@@H](C3CCCCC3)C2)n[nH]1 ZINC000336375014 183345029 /nfs/dbraw/zinc/34/50/29/183345029.db2.gz POKOOHYPCUKILO-CQSZACIVSA-N 1 2 249.358 2.191 20 0 BEADLO c1csc(C[NH2+]Cc2cccc3c2OCO3)n1 ZINC000040444102 183351977 /nfs/dbraw/zinc/35/19/77/183351977.db2.gz VGMWSJVAQUOKOE-UHFFFAOYSA-N 1 2 248.307 2.162 20 0 BEADLO c1cc(N[C@@H]2C[C@H]3OCCC[C@H]23)nc(C2CC2)[nH+]1 ZINC000302557493 183358759 /nfs/dbraw/zinc/35/87/59/183358759.db2.gz LVAMLRGELLJBQT-IJLUTSLNSA-N 1 2 245.326 2.333 20 0 BEADLO c1cc(N[C@@H]2CCSC2)nc(C2CC2)[nH+]1 ZINC000266197816 183358875 /nfs/dbraw/zinc/35/88/75/183358875.db2.gz CXGKPEPHNFTQJF-SECBINFHSA-N 1 2 221.329 2.271 20 0 BEADLO CCCNC(=O)Nc1ccc(C)[nH+]c1C ZINC000130115855 169240258 /nfs/dbraw/zinc/24/02/58/169240258.db2.gz SAUWJCBYFCBBRB-UHFFFAOYSA-N 1 2 207.277 2.230 20 0 BEADLO c1cn(Cc2csc(-c3ccccn3)n2)c[nH+]1 ZINC000124305765 183381605 /nfs/dbraw/zinc/38/16/05/183381605.db2.gz ZBTKWWWNCPVYMA-UHFFFAOYSA-N 1 2 242.307 2.450 20 0 BEADLO c1ccc(-c2noc([C@@H]3CSCC[NH2+]3)n2)cc1 ZINC000096881132 183385344 /nfs/dbraw/zinc/38/53/44/183385344.db2.gz QFLDFTGRWDYWMQ-JTQLQIEISA-N 1 2 247.323 2.114 20 0 BEADLO c1cn(CCSc2ccncc2)c[nH+]1 ZINC000342206971 183360979 /nfs/dbraw/zinc/36/09/79/183360979.db2.gz ITAKXTQSFDKYNA-UHFFFAOYSA-N 1 2 205.286 2.070 20 0 BEADLO CCCNC(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000117566822 169252420 /nfs/dbraw/zinc/25/24/20/169252420.db2.gz HWQATYUGWSQPLK-UHFFFAOYSA-N 1 2 229.283 2.012 20 0 BEADLO CCC[NH2+][C@H](C(=O)OC)c1ccccc1C ZINC000037459248 169284908 /nfs/dbraw/zinc/28/49/08/169284908.db2.gz VDWLJOUJPVPDJM-LBPRGKRZSA-N 1 2 221.300 2.209 20 0 BEADLO c1c[nH+]c(COCCc2ccccc2)[nH]1 ZINC000123725782 183394827 /nfs/dbraw/zinc/39/48/27/183394827.db2.gz SAIJEXFWUFBGSQ-UHFFFAOYSA-N 1 2 202.257 2.169 20 0 BEADLO c1nc([C@H]2CCC[N@H+]2Cc2ccccc2)no1 ZINC000377500697 183398307 /nfs/dbraw/zinc/39/83/07/183398307.db2.gz UPDQPMWFCMHBCD-GFCCVEGCSA-N 1 2 229.283 2.407 20 0 BEADLO c1nc([C@H]2CCC[N@@H+]2Cc2ccccc2)no1 ZINC000377500697 183398309 /nfs/dbraw/zinc/39/83/09/183398309.db2.gz UPDQPMWFCMHBCD-GFCCVEGCSA-N 1 2 229.283 2.407 20 0 BEADLO CCCSCC(=O)Nc1cccc2[nH+]ccn21 ZINC000266173320 169338293 /nfs/dbraw/zinc/33/82/93/169338293.db2.gz YZCHSILSUQACMQ-UHFFFAOYSA-N 1 2 249.339 2.416 20 0 BEADLO CCC[C@@H](C)C(=O)N[C@@H](c1[nH+]ccn1C)C1CC1 ZINC000341714880 169352304 /nfs/dbraw/zinc/35/23/04/169352304.db2.gz RRWOVZXPRFPYTE-ZYHUDNBSSA-N 1 2 249.358 2.424 20 0 BEADLO CCC[C@@H](C)CC(=O)NCCNc1cccc[nH+]1 ZINC000299648713 169356312 /nfs/dbraw/zinc/35/63/12/169356312.db2.gz RTHRQVPIPLVUFR-GFCCVEGCSA-N 1 2 249.358 2.436 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@@H](C)C2)ccc1F ZINC000179863419 134324125 /nfs/dbraw/zinc/32/41/25/134324125.db2.gz HYNVUOTVHOYBNX-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@@H](C)C2)ccc1F ZINC000179863419 134324126 /nfs/dbraw/zinc/32/41/26/134324126.db2.gz HYNVUOTVHOYBNX-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO CCc1cn(CC(=O)c2ccc(F)cc2)c[nH+]1 ZINC001644227718 1172536046 /nfs/dbraw/zinc/53/60/46/1172536046.db2.gz NUCIQLQNRVWXOK-UHFFFAOYSA-N 1 2 232.258 2.468 20 0 BEADLO CC[C@H](C)C[N@H+](CC)Cc1noc(COC)n1 ZINC000182533741 134346098 /nfs/dbraw/zinc/34/60/98/134346098.db2.gz NXLLCJAOEUBKGM-JTQLQIEISA-N 1 2 241.335 2.084 20 0 BEADLO CC[C@H](C)C[N@@H+](CC)Cc1noc(COC)n1 ZINC000182533741 134346099 /nfs/dbraw/zinc/34/60/99/134346099.db2.gz NXLLCJAOEUBKGM-JTQLQIEISA-N 1 2 241.335 2.084 20 0 BEADLO Cc1[nH]c([C@@H]2CCCN2C(=O)C2CCC2)[nH+]c1C ZINC001644727959 1172597856 /nfs/dbraw/zinc/59/78/56/1172597856.db2.gz RSAVIOXQRZJGCS-LBPRGKRZSA-N 1 2 247.342 2.490 20 0 BEADLO Fc1ccc(F)c(C[NH2+][C@@H]2CCn3ccnc32)c1 ZINC000293834001 383824612 /nfs/dbraw/zinc/82/46/12/383824612.db2.gz BNDOMSGYBYXLLG-GFCCVEGCSA-N 1 2 249.264 2.396 20 0 BEADLO CC[N@H+](CCCO)C/C(Cl)=C/Cl ZINC000131729015 383843833 /nfs/dbraw/zinc/84/38/33/383843833.db2.gz KXLBEEVYMCFYOX-VURMDHGXSA-N 1 2 212.120 2.010 20 0 BEADLO CC[N@@H+](CCCO)C/C(Cl)=C/Cl ZINC000131729015 383843836 /nfs/dbraw/zinc/84/38/36/383843836.db2.gz KXLBEEVYMCFYOX-VURMDHGXSA-N 1 2 212.120 2.010 20 0 BEADLO Cc1[nH]ncc1C[NH2+]Cc1cccc(F)c1 ZINC000035273961 383847469 /nfs/dbraw/zinc/84/74/69/383847469.db2.gz BDXSPVPQQZFKOI-UHFFFAOYSA-N 1 2 219.263 2.147 20 0 BEADLO Cc1c[nH+]cc(N[C@@H]2C[C@@H](C)O[C@H]2C)c1 ZINC000295863672 383867357 /nfs/dbraw/zinc/86/73/57/383867357.db2.gz WYORFOFJIGZRDH-JFGNBEQYSA-N 1 2 206.289 2.368 20 0 BEADLO c1cn(CCc2ccc3c(c2)CCO3)c[nH+]1 ZINC000088106564 383881345 /nfs/dbraw/zinc/88/13/45/383881345.db2.gz HOJZOYBUMNHULO-UHFFFAOYSA-N 1 2 214.268 2.061 20 0 BEADLO c1cc(C[NH2+][C@H]2CCc3ccccc32)[nH]n1 ZINC000036900170 383917522 /nfs/dbraw/zinc/91/75/22/383917522.db2.gz FVQZAAVIXQDJNW-ZDUSSCGKSA-N 1 2 213.284 2.187 20 0 BEADLO CC[C@H]1C[C@@H]1Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000348188182 383930971 /nfs/dbraw/zinc/93/09/71/383930971.db2.gz UXACNTHHNCOEEF-ONGXEEELSA-N 1 2 217.316 2.295 20 0 BEADLO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2nncn2C)o1 ZINC000037017354 383931417 /nfs/dbraw/zinc/93/14/17/383931417.db2.gz BKUFSYRJQGBPKG-UWVGGRQHSA-N 1 2 234.303 2.128 20 0 BEADLO C[C@@H]([NH2+]Cc1ccon1)c1cncc(F)c1 ZINC000122434199 383884209 /nfs/dbraw/zinc/88/42/09/383884209.db2.gz SWXZANDEWZXNKN-MRVPVSSYSA-N 1 2 221.235 2.060 20 0 BEADLO CC[C@@H]([NH2+]Cc1cncc(F)c1)C(F)F ZINC000449361904 383979044 /nfs/dbraw/zinc/97/90/44/383979044.db2.gz LRVYKVXADURWED-SECBINFHSA-N 1 2 218.222 2.354 20 0 BEADLO CCCC[C@@H]([NH2+][C@H](CC)CSC)C(=O)OC ZINC000091555070 383982493 /nfs/dbraw/zinc/98/24/93/383982493.db2.gz CXULWCUFNSVOEQ-GHMZBOCLSA-N 1 2 247.404 2.449 20 0 BEADLO CC1=C[C@H](C)C[N@H+](Cc2nnc(C3CC3)o2)C1 ZINC000572938331 383995759 /nfs/dbraw/zinc/99/57/59/383995759.db2.gz DXSKDXPDLPSDIF-VIFPVBQESA-N 1 2 233.315 2.345 20 0 BEADLO CC1=C[C@H](C)C[N@@H+](Cc2nnc(C3CC3)o2)C1 ZINC000572938331 383995767 /nfs/dbraw/zinc/99/57/67/383995767.db2.gz DXSKDXPDLPSDIF-VIFPVBQESA-N 1 2 233.315 2.345 20 0 BEADLO FC1(F)CC[N@H+](CC[C@@H]2CCCCO2)C1 ZINC000336500310 384018100 /nfs/dbraw/zinc/01/81/00/384018100.db2.gz GHNMICYCJMFTFJ-JTQLQIEISA-N 1 2 219.275 2.287 20 0 BEADLO FC1(F)CC[N@@H+](CC[C@@H]2CCCCO2)C1 ZINC000336500310 384018108 /nfs/dbraw/zinc/01/81/08/384018108.db2.gz GHNMICYCJMFTFJ-JTQLQIEISA-N 1 2 219.275 2.287 20 0 BEADLO CC(C)C[C@H](C)CC(=O)NCc1[nH]cc[nH+]1 ZINC000114337337 384031488 /nfs/dbraw/zinc/03/14/88/384031488.db2.gz BJTGKOKABNYELM-JTQLQIEISA-N 1 2 223.320 2.098 20 0 BEADLO CCOC[C@@H](O)Cn1c[nH+]c2cc(C)c(C)cc21 ZINC000069277546 384038072 /nfs/dbraw/zinc/03/80/72/384038072.db2.gz ZIIZBMVEHXZTJE-LBPRGKRZSA-N 1 2 248.326 2.051 20 0 BEADLO Cc1cc(C)cc([C@@H](C)[NH2+]Cc2ncn(C)n2)c1 ZINC000090969194 384084738 /nfs/dbraw/zinc/08/47/38/384084738.db2.gz CVRJTWHIPSLBPO-GFCCVEGCSA-N 1 2 244.342 2.283 20 0 BEADLO Cc1nonc1C[NH2+][C@@H](C)c1ccccc1 ZINC000069794434 384062719 /nfs/dbraw/zinc/06/27/19/384062719.db2.gz GFJAIFWWPYVEQA-VIFPVBQESA-N 1 2 217.272 2.229 20 0 BEADLO C[C@H](CC(=O)NCC1(C)CCC1)n1cc[nH+]c1 ZINC000569461092 384069694 /nfs/dbraw/zinc/06/96/94/384069694.db2.gz MLNOKQIYVIOLKE-LLVKDONJSA-N 1 2 235.331 2.141 20 0 BEADLO CC(C)CCC(=O)NCCCNc1cccc[nH+]1 ZINC000115160265 384071267 /nfs/dbraw/zinc/07/12/67/384071267.db2.gz GXFRUEFESWNCEZ-UHFFFAOYSA-N 1 2 249.358 2.436 20 0 BEADLO CC[C@H](O)c1ccc(OCc2c[nH+]cn2C)cc1 ZINC000091278660 384112581 /nfs/dbraw/zinc/11/25/81/384112581.db2.gz FWZZNMSZYKQYTI-AWEZNQCLSA-N 1 2 246.310 2.443 20 0 BEADLO CC[C@@H](C(=O)NCc1[nH]cc[nH+]1)c1ccccc1 ZINC000070990485 384146090 /nfs/dbraw/zinc/14/60/90/384146090.db2.gz VRFMLORTYFOFDX-GFCCVEGCSA-N 1 2 243.310 2.220 20 0 BEADLO Cc1ccc(F)c(C[N@H+]2CCOC[C@@H]2C)c1 ZINC000091800560 384147107 /nfs/dbraw/zinc/14/71/07/384147107.db2.gz ZNFPNPQPZFGLFL-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ccc(F)c(C[N@@H+]2CCOC[C@@H]2C)c1 ZINC000091800560 384147111 /nfs/dbraw/zinc/14/71/11/384147111.db2.gz ZNFPNPQPZFGLFL-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ccc(C[N@H+]2CCOC[C@@H]2C)cc1F ZINC000091815123 384147642 /nfs/dbraw/zinc/14/76/42/384147642.db2.gz OWJYBDWLFZRIRN-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ccc(C[N@@H+]2CCOC[C@@H]2C)cc1F ZINC000091815123 384147648 /nfs/dbraw/zinc/14/76/48/384147648.db2.gz OWJYBDWLFZRIRN-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO CCOc1ccccc1C[NH2+]Cc1nccn1C ZINC000071138721 384149792 /nfs/dbraw/zinc/14/97/92/384149792.db2.gz ADIHMKZJCNUMSG-UHFFFAOYSA-N 1 2 245.326 2.109 20 0 BEADLO Cc1csc(C[NH2+]Cc2conc2C)n1 ZINC000293965276 384153271 /nfs/dbraw/zinc/15/32/71/384153271.db2.gz CUUDAAVUGWTUPR-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO COC(=O)c1ccccc1C[N@@H+]1CC[C@H](F)C1 ZINC000449393214 384161551 /nfs/dbraw/zinc/16/15/51/384161551.db2.gz LRSPODGIDDCWFI-NSHDSACASA-N 1 2 237.274 2.017 20 0 BEADLO COC(=O)c1ccccc1C[N@H+]1CC[C@H](F)C1 ZINC000449393214 384161552 /nfs/dbraw/zinc/16/15/52/384161552.db2.gz LRSPODGIDDCWFI-NSHDSACASA-N 1 2 237.274 2.017 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)c(C)s1 ZINC000336574410 384162707 /nfs/dbraw/zinc/16/27/07/384162707.db2.gz XAEFUGFDBNPNRR-PHIMTYICSA-N 1 2 238.356 2.123 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c(C)s1 ZINC000336574410 384162711 /nfs/dbraw/zinc/16/27/11/384162711.db2.gz XAEFUGFDBNPNRR-PHIMTYICSA-N 1 2 238.356 2.123 20 0 BEADLO Cc1ccc(C[NH2+]Cc2csnn2)s1 ZINC000050225273 384167277 /nfs/dbraw/zinc/16/72/77/384167277.db2.gz GIGYGTFJAHIENG-UHFFFAOYSA-N 1 2 225.342 2.198 20 0 BEADLO c1csc([C@H]2CN(Cc3c[nH+]c[nH]3)CCO2)c1 ZINC000092594012 384185867 /nfs/dbraw/zinc/18/58/67/384185867.db2.gz PXDXLBPXTQMTIC-LLVKDONJSA-N 1 2 249.339 2.045 20 0 BEADLO c1csc([C@H]2CN(Cc3c[nH]c[nH+]3)CCO2)c1 ZINC000092594012 384185868 /nfs/dbraw/zinc/18/58/68/384185868.db2.gz PXDXLBPXTQMTIC-LLVKDONJSA-N 1 2 249.339 2.045 20 0 BEADLO COc1ccc2c(c1)[C@H]([NH2+]Cc1ccn[nH]1)CC2 ZINC000092836710 384197483 /nfs/dbraw/zinc/19/74/83/384197483.db2.gz UZJXBEDYKPFYGT-CQSZACIVSA-N 1 2 243.310 2.195 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@@H](C)[C@@H]2C)o1 ZINC000093418142 384235521 /nfs/dbraw/zinc/23/55/21/384235521.db2.gz RCIYZWGFPWZQQP-QWRGUYRKSA-N 1 2 223.316 2.451 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@@H](C)[C@@H]2C)o1 ZINC000093418142 384235524 /nfs/dbraw/zinc/23/55/24/384235524.db2.gz RCIYZWGFPWZQQP-QWRGUYRKSA-N 1 2 223.316 2.451 20 0 BEADLO CC(C)Nc1cc(CSCCO)cc[nH+]1 ZINC000132852938 384216228 /nfs/dbraw/zinc/21/62/28/384216228.db2.gz FBFUQFRUNDOOGZ-UHFFFAOYSA-N 1 2 226.345 2.127 20 0 BEADLO Cc1nnc(C[NH2+][C@H](C)c2cc(C)ccn2)s1 ZINC000560550001 384216623 /nfs/dbraw/zinc/21/66/23/384216623.db2.gz SNQVIQPJYPXNIB-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO Cc1cc([NH2+]CC2CCC2)ccc1-n1cnnn1 ZINC000149490287 384244870 /nfs/dbraw/zinc/24/48/70/384244870.db2.gz MMQJOFQYWYJXFF-UHFFFAOYSA-N 1 2 243.314 2.183 20 0 BEADLO C[C@@H](NC(=O)[C@@H](C)c1cccs1)c1[nH]cc[nH+]1 ZINC000560698168 384304635 /nfs/dbraw/zinc/30/46/35/384304635.db2.gz LTHKXBHXFSLYBT-DTWKUNHWSA-N 1 2 249.339 2.452 20 0 BEADLO CSCCN(C)C(=O)Nc1cc[nH+]c(C)c1 ZINC000119837619 384308668 /nfs/dbraw/zinc/30/86/68/384308668.db2.gz VPTJHRGVIGLRLZ-UHFFFAOYSA-N 1 2 239.344 2.217 20 0 BEADLO Cn1cc[nH+]c1CN1CCc2ccc(F)cc2C1 ZINC000133871661 384317189 /nfs/dbraw/zinc/31/71/89/384317189.db2.gz NAJRDZZWITUJNI-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1ncc2c1nc[nH+]c2N[C@@H]1CCCC1(C)C ZINC000094267160 384295216 /nfs/dbraw/zinc/29/52/16/384295216.db2.gz HJYKFNFDUKNJJR-SNVBAGLBSA-N 1 2 245.330 2.354 20 0 BEADLO Cc1cnc([C@H](C)[NH2+][C@H](CO)c2ccccc2)o1 ZINC000359614121 384300867 /nfs/dbraw/zinc/30/08/67/384300867.db2.gz YAPUFSWYYGJWIG-WCQYABFASA-N 1 2 246.310 2.367 20 0 BEADLO CC(C)(C)CC(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000120315442 384347078 /nfs/dbraw/zinc/34/70/78/384347078.db2.gz HUWWJKXVWNPSRG-UHFFFAOYSA-N 1 2 249.358 2.483 20 0 BEADLO CC(C)(C(=O)NCc1[nH]cc[nH+]1)C1CCCC1 ZINC000120586334 384364585 /nfs/dbraw/zinc/36/45/85/384364585.db2.gz SZQTXGODTAJQDW-UHFFFAOYSA-N 1 2 235.331 2.242 20 0 BEADLO CC(C)[C@H]1CCN(C(=O)C(C)(C)c2c[nH+]c[nH]2)C1 ZINC000621908264 384372820 /nfs/dbraw/zinc/37/28/20/384372820.db2.gz ROFZIUQBRQJLAK-NSHDSACASA-N 1 2 249.358 2.192 20 0 BEADLO O=C(c1ccoc1)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000120143294 384332058 /nfs/dbraw/zinc/33/20/58/384332058.db2.gz MSZMJUCKKUBNRU-NSHDSACASA-N 1 2 245.282 2.370 20 0 BEADLO CCN(C(=O)Nc1cc[nH+]cc1C)C1CC1 ZINC000121121388 384398146 /nfs/dbraw/zinc/39/81/46/384398146.db2.gz VVHUNJDWWVCTBX-UHFFFAOYSA-N 1 2 219.288 2.406 20 0 BEADLO CC[C@H]([NH2+]CCc1cccc(C)c1)C(=O)OC ZINC000134974298 384405172 /nfs/dbraw/zinc/40/51/72/384405172.db2.gz GIHAWYKAOVXIEW-ZDUSSCGKSA-N 1 2 235.327 2.079 20 0 BEADLO CCn1cc[nH+]c1CNc1cnoc1C1CC1 ZINC000556472948 384406946 /nfs/dbraw/zinc/40/69/46/384406946.db2.gz ZRPJRSCRVGVHAS-UHFFFAOYSA-N 1 2 232.287 2.381 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC[C@@H]1CCCCO1 ZINC000121444280 384417542 /nfs/dbraw/zinc/41/75/42/384417542.db2.gz OJQQFRLOZJSION-NSHDSACASA-N 1 2 249.314 2.081 20 0 BEADLO c1ccc2oc(C[N@H+]3C[C@H]4CC[C@@H](C3)O4)nc2c1 ZINC000363344604 384421518 /nfs/dbraw/zinc/42/15/18/384421518.db2.gz JNBOZNFBOYJQJP-PHIMTYICSA-N 1 2 244.294 2.191 20 0 BEADLO c1ccc2oc(C[N@@H+]3C[C@H]4CC[C@@H](C3)O4)nc2c1 ZINC000363344604 384421526 /nfs/dbraw/zinc/42/15/26/384421526.db2.gz JNBOZNFBOYJQJP-PHIMTYICSA-N 1 2 244.294 2.191 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@H](C)C1CC1 ZINC000120720988 384376525 /nfs/dbraw/zinc/37/65/25/384376525.db2.gz SLOUIAGCFKPMBO-VIFPVBQESA-N 1 2 219.288 2.310 20 0 BEADLO O=C(/C=C\C1CCCCC1)NCCc1[nH]cc[nH+]1 ZINC000255192685 384446942 /nfs/dbraw/zinc/44/69/42/384446942.db2.gz ZSCQIKGVVGEFQH-SREVYHEPSA-N 1 2 247.342 2.205 20 0 BEADLO CC[N@H+](Cc1nnc(C)n1C)Cc1ccccc1 ZINC000047540950 384455432 /nfs/dbraw/zinc/45/54/32/384455432.db2.gz QXJJVXOIMZAOSB-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CC[N@@H+](Cc1nnc(C)n1C)Cc1ccccc1 ZINC000047540950 384455436 /nfs/dbraw/zinc/45/54/36/384455436.db2.gz QXJJVXOIMZAOSB-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO Fc1ccc(COCc2[nH]cc[nH+]2)cc1 ZINC000180031677 384427938 /nfs/dbraw/zinc/42/79/38/384427938.db2.gz XUVIPFLGRYCEMQ-UHFFFAOYSA-N 1 2 206.220 2.266 20 0 BEADLO C[C@H]1C[C@@H](Nc2ccc(N3CCCC3)c[nH+]2)CO1 ZINC000647173691 384434442 /nfs/dbraw/zinc/43/44/42/384434442.db2.gz VOSDRHCMGQHNJX-NWDGAFQWSA-N 1 2 247.342 2.271 20 0 BEADLO C[C@@H]1C[C@H](Nc2ccc(N3CCCC3)c[nH+]2)CO1 ZINC000647173690 384435048 /nfs/dbraw/zinc/43/50/48/384435048.db2.gz VOSDRHCMGQHNJX-NEPJUHHUSA-N 1 2 247.342 2.271 20 0 BEADLO O=C(Nc1ccc(-c2c[nH]c[nH+]2)cc1)C1CC1 ZINC000070243821 384471412 /nfs/dbraw/zinc/47/14/12/384471412.db2.gz YGDRGGRRDOKNPN-UHFFFAOYSA-N 1 2 227.267 2.425 20 0 BEADLO CC(C)(C)OCCSCCn1cc[nH+]c1 ZINC000122379325 384478736 /nfs/dbraw/zinc/47/87/36/384478736.db2.gz RUBVJDRUSGZMEH-UHFFFAOYSA-N 1 2 228.361 2.431 20 0 BEADLO Nc1[nH+]cnc(N[C@@H]2CC[C@@H]3C[C@@H]3C2)c1Cl ZINC000403071328 384479417 /nfs/dbraw/zinc/47/94/17/384479417.db2.gz GKLGLIPSBCBBQD-BWZBUEFSSA-N 1 2 238.722 2.313 20 0 BEADLO Nc1nc[nH+]c(N[C@@H]2CC[C@@H]3C[C@@H]3C2)c1Cl ZINC000403071328 384479422 /nfs/dbraw/zinc/47/94/22/384479422.db2.gz GKLGLIPSBCBBQD-BWZBUEFSSA-N 1 2 238.722 2.313 20 0 BEADLO CN(C)c1ccccc1N(C)Cc1[nH+]ccn1C ZINC000136203183 384484146 /nfs/dbraw/zinc/48/41/46/384484146.db2.gz BKXAPQDTPQHALK-UHFFFAOYSA-N 1 2 244.342 2.123 20 0 BEADLO CCC[NH2+][C@@H](C(=O)OCC)c1ccccc1 ZINC000037382473 384495832 /nfs/dbraw/zinc/49/58/32/384495832.db2.gz HMFRHTJCEIILSA-GFCCVEGCSA-N 1 2 221.300 2.290 20 0 BEADLO CCCc1nc(C[NH+]2CCC3(CC3)CC2)no1 ZINC000363479260 384502082 /nfs/dbraw/zinc/50/20/82/384502082.db2.gz GSSDNHVVWOTCJD-UHFFFAOYSA-N 1 2 235.331 2.398 20 0 BEADLO CC1CC(C(=O)N[C@H](c2[nH+]ccn2C)C2CC2)C1 ZINC000561121014 384507826 /nfs/dbraw/zinc/50/78/26/384507826.db2.gz GBSVTNUOXKGTCU-NHNAUAITSA-N 1 2 247.342 2.034 20 0 BEADLO Cc1cc(C)c(CNC(=O)[C@@H]2CC23CC3)c[nH+]1 ZINC000335021208 384490519 /nfs/dbraw/zinc/49/05/19/384490519.db2.gz LKDYOFPWHAJNOK-LBPRGKRZSA-N 1 2 230.311 2.115 20 0 BEADLO CC(C)c1nsc(NCc2[nH+]ccn2C)n1 ZINC000083668840 384513448 /nfs/dbraw/zinc/51/34/48/384513448.db2.gz LYBRLGJVZHABEP-UHFFFAOYSA-N 1 2 237.332 2.007 20 0 BEADLO Cc1nc(C)c(C[NH2+]CC(F)F)s1 ZINC000147426070 384542515 /nfs/dbraw/zinc/54/25/15/384542515.db2.gz FIAHZEHRYWNMQU-UHFFFAOYSA-N 1 2 206.261 2.115 20 0 BEADLO Cc1cc(N[C@@H]2CC23CC3)nc(C2CC2)[nH+]1 ZINC000335105825 384551140 /nfs/dbraw/zinc/55/11/40/384551140.db2.gz VQEIYHATILPYHG-SNVBAGLBSA-N 1 2 215.300 2.049 20 0 BEADLO Cc1ccc(NCc2[nH]cc[nH+]2)cc1F ZINC000049714582 384558191 /nfs/dbraw/zinc/55/81/91/384558191.db2.gz MGEQSDPJFGGBQJ-UHFFFAOYSA-N 1 2 205.236 2.469 20 0 BEADLO c1c[nH]c(C[NH2+][C@H]2CCOc3ccccc32)n1 ZINC000049715216 384561062 /nfs/dbraw/zinc/56/10/62/384561062.db2.gz FXYJGRDQFPLICO-NSHDSACASA-N 1 2 229.283 2.023 20 0 BEADLO COC[C@@H]([NH2+]Cc1cccnc1)c1ccc(C)o1 ZINC000080238098 384538352 /nfs/dbraw/zinc/53/83/52/384538352.db2.gz BRFLXKRRFCDDHB-CYBMUJFWSA-N 1 2 246.310 2.460 20 0 BEADLO COC[C@@H]([NH2+]Cc1cccc(O)c1)c1ccco1 ZINC000080240304 384540649 /nfs/dbraw/zinc/54/06/49/384540649.db2.gz ZYAZGBSHYRYWTG-CYBMUJFWSA-N 1 2 247.294 2.463 20 0 BEADLO CS[C@H]1CCCC[N@H+](CC(F)F)C1 ZINC000179112610 384572205 /nfs/dbraw/zinc/57/22/05/384572205.db2.gz SMFPLJUVWHYBJB-QMMMGPOBSA-N 1 2 209.305 2.469 20 0 BEADLO CS[C@H]1CCCC[N@@H+](CC(F)F)C1 ZINC000179112610 384572212 /nfs/dbraw/zinc/57/22/12/384572212.db2.gz SMFPLJUVWHYBJB-QMMMGPOBSA-N 1 2 209.305 2.469 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2ccon2)cc1 ZINC000172382914 384576659 /nfs/dbraw/zinc/57/66/59/384576659.db2.gz JOEZMZLBFQPXDP-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2ccon2)cc1 ZINC000172382914 384576663 /nfs/dbraw/zinc/57/66/63/384576663.db2.gz JOEZMZLBFQPXDP-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO C[N@H+](Cc1ccon1)Cc1ccccc1 ZINC000172382573 384577051 /nfs/dbraw/zinc/57/70/51/384577051.db2.gz KEKAHPCYCZWOCN-UHFFFAOYSA-N 1 2 202.257 2.307 20 0 BEADLO C[N@@H+](Cc1ccon1)Cc1ccccc1 ZINC000172382573 384577055 /nfs/dbraw/zinc/57/70/55/384577055.db2.gz KEKAHPCYCZWOCN-UHFFFAOYSA-N 1 2 202.257 2.307 20 0 BEADLO COC(=O)[C@@H](C)C[N@H+](C)C/C(Cl)=C/Cl ZINC000086001381 384587038 /nfs/dbraw/zinc/58/70/38/384587038.db2.gz UASCGTUDQKGZAD-OJKBXMANSA-N 1 2 240.130 2.046 20 0 BEADLO COC(=O)[C@@H](C)C[N@@H+](C)C/C(Cl)=C/Cl ZINC000086001381 384587046 /nfs/dbraw/zinc/58/70/46/384587046.db2.gz UASCGTUDQKGZAD-OJKBXMANSA-N 1 2 240.130 2.046 20 0 BEADLO CCC[C@@H]1C[C@@H]1C(=O)Nc1cc[nH+]c(C)c1 ZINC000359914852 384609819 /nfs/dbraw/zinc/60/98/19/384609819.db2.gz BWICBUUJAHMGHC-PWSUYJOCSA-N 1 2 218.300 2.187 20 0 BEADLO COC[C@@H]([NH2+]Cc1cc(C)no1)c1ccco1 ZINC000184572455 384621578 /nfs/dbraw/zinc/62/15/78/384621578.db2.gz VMVMJIRMHMQARY-LLVKDONJSA-N 1 2 236.271 2.053 20 0 BEADLO C[N@H+](CCOCC1CC1)Cc1cscn1 ZINC000172762704 384622808 /nfs/dbraw/zinc/62/28/08/384622808.db2.gz JNIZYPHJVVJYNC-UHFFFAOYSA-N 1 2 226.345 2.002 20 0 BEADLO C[N@@H+](CCOCC1CC1)Cc1cscn1 ZINC000172762704 384622816 /nfs/dbraw/zinc/62/28/16/384622816.db2.gz JNIZYPHJVVJYNC-UHFFFAOYSA-N 1 2 226.345 2.002 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1C[C@H](C)CC1(C)C ZINC000517962052 384596456 /nfs/dbraw/zinc/59/64/56/384596456.db2.gz YJPDIKPOIRDSLA-MNOVXSKESA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1C[C@H](C)CC1(C)C ZINC000517962052 384596462 /nfs/dbraw/zinc/59/64/62/384596462.db2.gz YJPDIKPOIRDSLA-MNOVXSKESA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1C[C@@H](C)CC1(C)C ZINC000517962054 384597761 /nfs/dbraw/zinc/59/77/61/384597761.db2.gz YJPDIKPOIRDSLA-QWRGUYRKSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1C[C@@H](C)CC1(C)C ZINC000517962054 384597770 /nfs/dbraw/zinc/59/77/70/384597770.db2.gz YJPDIKPOIRDSLA-QWRGUYRKSA-N 1 2 249.358 2.235 20 0 BEADLO COc1cc(C)ccc1[NH2+]CCC1(O)CC1 ZINC000309848159 384667896 /nfs/dbraw/zinc/66/78/96/384667896.db2.gz HRDTWHWFZCIWJY-UHFFFAOYSA-N 1 2 221.300 2.331 20 0 BEADLO Cc1ccc(C(=O)NCc2c[nH+]c[nH]2)c(Cl)c1 ZINC000235852097 384635355 /nfs/dbraw/zinc/63/53/55/384635355.db2.gz PFPZXPABJSHPAK-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO Cc1ccc(C(=O)NCc2c[nH]c[nH+]2)c(Cl)c1 ZINC000235852097 384635363 /nfs/dbraw/zinc/63/53/63/384635363.db2.gz PFPZXPABJSHPAK-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO Cn1ncc2c1nc[nH+]c2SCC1CCC1 ZINC000172915298 384636372 /nfs/dbraw/zinc/63/63/72/384636372.db2.gz IFWTWTLBZHGQMZ-UHFFFAOYSA-N 1 2 234.328 2.256 20 0 BEADLO Cn1c(Cl)cnc1C[N@H+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000172954211 384638218 /nfs/dbraw/zinc/63/82/18/384638218.db2.gz PJECBORDUKLDPJ-DTORHVGOSA-N 1 2 239.750 2.161 20 0 BEADLO Cn1c(Cl)cnc1C[N@@H+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000172954211 384638226 /nfs/dbraw/zinc/63/82/26/384638226.db2.gz PJECBORDUKLDPJ-DTORHVGOSA-N 1 2 239.750 2.161 20 0 BEADLO O=C(CC1CCC1)N1CCC(n2cc[nH+]c2)CC1 ZINC000172932930 384638288 /nfs/dbraw/zinc/63/82/88/384638288.db2.gz LTSPWBUYEQJTEE-UHFFFAOYSA-N 1 2 247.342 2.237 20 0 BEADLO CCCC(=O)N1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000124467085 384643212 /nfs/dbraw/zinc/64/32/12/384643212.db2.gz FOFBGLAUZXTVQK-VXGBXAGGSA-N 1 2 235.331 2.093 20 0 BEADLO C[N@H+](CCCOCC(F)(F)F)CC(F)F ZINC000103559698 384643702 /nfs/dbraw/zinc/64/37/02/384643702.db2.gz IFJYXGJYXRUIEH-UHFFFAOYSA-N 1 2 235.196 2.152 20 0 BEADLO C[N@@H+](CCCOCC(F)(F)F)CC(F)F ZINC000103559698 384643706 /nfs/dbraw/zinc/64/37/06/384643706.db2.gz IFJYXGJYXRUIEH-UHFFFAOYSA-N 1 2 235.196 2.152 20 0 BEADLO CN(C)c1ccc(NCc2cc[nH]c2)[nH+]c1 ZINC000124573902 384653034 /nfs/dbraw/zinc/65/30/34/384653034.db2.gz FOJPYTZGWDCXMR-UHFFFAOYSA-N 1 2 216.288 2.088 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ccco2)on1 ZINC000044315381 384654725 /nfs/dbraw/zinc/65/47/25/384654725.db2.gz CIMPHHSADGDLRC-VIFPVBQESA-N 1 2 206.245 2.427 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccc(C)o2)CCO1 ZINC000125531668 384725977 /nfs/dbraw/zinc/72/59/77/384725977.db2.gz WLEDXDCULLBEES-NSHDSACASA-N 1 2 209.289 2.199 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccc(C)o2)CCO1 ZINC000125531668 384725985 /nfs/dbraw/zinc/72/59/85/384725985.db2.gz WLEDXDCULLBEES-NSHDSACASA-N 1 2 209.289 2.199 20 0 BEADLO Cn1ccnc1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC000162757608 384682211 /nfs/dbraw/zinc/68/22/11/384682211.db2.gz FTBYOYWVWXKBPZ-CYBMUJFWSA-N 1 2 242.326 2.152 20 0 BEADLO Cn1ccnc1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000162757608 384682220 /nfs/dbraw/zinc/68/22/20/384682220.db2.gz FTBYOYWVWXKBPZ-CYBMUJFWSA-N 1 2 242.326 2.152 20 0 BEADLO CCOC(=O)C[N@H+](CC)Cc1ccc(C)cc1 ZINC000049899160 384687881 /nfs/dbraw/zinc/68/78/81/384687881.db2.gz OVAHMWPTLOCWSW-UHFFFAOYSA-N 1 2 235.327 2.380 20 0 BEADLO CCOC(=O)C[N@@H+](CC)Cc1ccc(C)cc1 ZINC000049899160 384687887 /nfs/dbraw/zinc/68/78/87/384687887.db2.gz OVAHMWPTLOCWSW-UHFFFAOYSA-N 1 2 235.327 2.380 20 0 BEADLO c1cn(CCCOCc2ccccc2)c[nH+]1 ZINC000101784504 384689598 /nfs/dbraw/zinc/68/95/98/384689598.db2.gz DWSMQKKHTLNGBR-UHFFFAOYSA-N 1 2 216.284 2.490 20 0 BEADLO c1ccc2nc(C[N@@H+]3CCO[C@@H]4C[C@@H]43)ccc2c1 ZINC000368334205 384690870 /nfs/dbraw/zinc/69/08/70/384690870.db2.gz VSGRNVDBVJBIKZ-LSDHHAIUSA-N 1 2 240.306 2.208 20 0 BEADLO c1ccc2nc(C[N@H+]3CCO[C@@H]4C[C@@H]43)ccc2c1 ZINC000368334205 384690876 /nfs/dbraw/zinc/69/08/76/384690876.db2.gz VSGRNVDBVJBIKZ-LSDHHAIUSA-N 1 2 240.306 2.208 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+]Cc2ccnn2C)s1 ZINC000125174437 384702054 /nfs/dbraw/zinc/70/20/54/384702054.db2.gz GDUWDJYRBMQPPZ-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1nc(C[N@H+]2CCO[C@H](C)[C@H]2C)sc1C ZINC000248216427 384727501 /nfs/dbraw/zinc/72/75/01/384727501.db2.gz ZSYNOTRUKROHLN-NXEZZACHSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nc(C[N@@H+]2CCO[C@H](C)[C@H]2C)sc1C ZINC000248216427 384727507 /nfs/dbraw/zinc/72/75/07/384727507.db2.gz ZSYNOTRUKROHLN-NXEZZACHSA-N 1 2 240.372 2.369 20 0 BEADLO CCc1cc(N)nc(S[C@H](C)CCOC)[nH+]1 ZINC000279079718 384778877 /nfs/dbraw/zinc/77/88/77/384778877.db2.gz LPKPPSBCMDOIGH-MRVPVSSYSA-N 1 2 241.360 2.138 20 0 BEADLO CCS[C@@H]1CCC[C@@H]1[NH2+][C@H](CC)C(=O)OC ZINC000300393107 384745850 /nfs/dbraw/zinc/74/58/50/384745850.db2.gz WFFSXXJKKVFDJS-OUAUKWLOSA-N 1 2 245.388 2.202 20 0 BEADLO CSc1ccc(N[C@H]2CO[C@@H](C)C2)[nH+]c1 ZINC000647193506 384754195 /nfs/dbraw/zinc/75/41/95/384754195.db2.gz CYAPURHCHYEPGM-DTWKUNHWSA-N 1 2 224.329 2.393 20 0 BEADLO CC(C)[C@H]1C[C@H]1C(=O)N(C)CCCn1cc[nH+]c1 ZINC000185754773 384766846 /nfs/dbraw/zinc/76/68/46/384766846.db2.gz ZAJMFSCOPIOEQP-CHWSQXEVSA-N 1 2 249.358 2.024 20 0 BEADLO Cc1nc(C)c(C(=O)Nc2cc[nH+]cc2C)o1 ZINC000174696554 384825399 /nfs/dbraw/zinc/82/53/99/384825399.db2.gz QWZUUIOOHRWHPL-UHFFFAOYSA-N 1 2 231.255 2.247 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cscn2)CCS1 ZINC000174363002 384781064 /nfs/dbraw/zinc/78/10/64/384781064.db2.gz KWCMUCMXWKSCFH-JTQLQIEISA-N 1 2 228.386 2.471 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cscn2)CCS1 ZINC000174363002 384781069 /nfs/dbraw/zinc/78/10/69/384781069.db2.gz KWCMUCMXWKSCFH-JTQLQIEISA-N 1 2 228.386 2.471 20 0 BEADLO CC(C)CCC[C@H](C)NC(=O)Cn1cc[nH+]c1 ZINC000174532622 384804306 /nfs/dbraw/zinc/80/43/06/384804306.db2.gz DXFAFOULTASGDB-LBPRGKRZSA-N 1 2 237.347 2.214 20 0 BEADLO CC[C@H]([NH2+]Cc1nncn1C)c1ccccc1F ZINC000163467969 384809872 /nfs/dbraw/zinc/80/98/72/384809872.db2.gz LFQBNYWTWNZCKP-LBPRGKRZSA-N 1 2 248.305 2.195 20 0 BEADLO CCC[C@@H]([NH2+][C@H]1CSC1(C)C)C(=O)OCC ZINC000310039952 384810131 /nfs/dbraw/zinc/81/01/31/384810131.db2.gz XLPQPCPRBJNOMM-ZJUUUORDSA-N 1 2 245.388 2.202 20 0 BEADLO CO[C@H]1CCCC[C@H]1Nc1cc(C)[nH+]cn1 ZINC000301475221 384877417 /nfs/dbraw/zinc/87/74/17/384877417.db2.gz VVUUSXKNXXGTOV-MNOVXSKESA-N 1 2 221.304 2.155 20 0 BEADLO Cc1cccc([C@@H](C)[N@H+](C)Cc2nnc[nH]2)c1 ZINC000177135336 384879420 /nfs/dbraw/zinc/87/94/20/384879420.db2.gz YJPZZZUZYIFUEL-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO Cc1cccc([C@@H](C)[N@@H+](C)Cc2nnc[nH]2)c1 ZINC000177135336 384879426 /nfs/dbraw/zinc/87/94/26/384879426.db2.gz YJPZZZUZYIFUEL-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO C[C@@H]1SCC[N@H+](CC(=O)OC(C)(C)C)[C@H]1C ZINC000118415314 384839159 /nfs/dbraw/zinc/83/91/59/384839159.db2.gz HJMMQHWQACGTTG-UWVGGRQHSA-N 1 2 245.388 2.154 20 0 BEADLO C[C@@H]1SCC[N@@H+](CC(=O)OC(C)(C)C)[C@H]1C ZINC000118415314 384839168 /nfs/dbraw/zinc/83/91/68/384839168.db2.gz HJMMQHWQACGTTG-UWVGGRQHSA-N 1 2 245.388 2.154 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)OCCCF ZINC000497189804 384843289 /nfs/dbraw/zinc/84/32/89/384843289.db2.gz JQNABDUNONKTJB-SECBINFHSA-N 1 2 243.282 2.050 20 0 BEADLO C[C@@H]([NH2+]Cc1ccsc1)c1csnn1 ZINC000398227256 384857963 /nfs/dbraw/zinc/85/79/63/384857963.db2.gz HITUFOYMAGXMML-SSDOTTSWSA-N 1 2 225.342 2.450 20 0 BEADLO C[C@@H]([NH2+]Cc1cocn1)c1ccncc1F ZINC000309830512 384860273 /nfs/dbraw/zinc/86/02/73/384860273.db2.gz YKJIMUDWDBFZRV-MRVPVSSYSA-N 1 2 221.235 2.060 20 0 BEADLO Cc1nc(C[NH2+]Cc2ccc(C)nc2)cs1 ZINC000057591044 384956769 /nfs/dbraw/zinc/95/67/69/384956769.db2.gz RSPDFBSVBAWZIC-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO OCC(F)(F)C[NH2+]Cc1coc2ccccc12 ZINC000183893036 384892529 /nfs/dbraw/zinc/89/25/29/384892529.db2.gz AWIAJUJTRDZIMG-UHFFFAOYSA-N 1 2 241.237 2.150 20 0 BEADLO CCc1cnc(C[N@@H+]2CCC[C@H]2CF)o1 ZINC000559410480 384897785 /nfs/dbraw/zinc/89/77/85/384897785.db2.gz SXUZTMKBZNJQGS-VIFPVBQESA-N 1 2 212.268 2.171 20 0 BEADLO CCc1cnc(C[N@H+]2CCC[C@H]2CF)o1 ZINC000559410480 384897792 /nfs/dbraw/zinc/89/77/92/384897792.db2.gz SXUZTMKBZNJQGS-VIFPVBQESA-N 1 2 212.268 2.171 20 0 BEADLO O=C(CC1CCCCCC1)NCCn1cc[nH+]c1 ZINC000175482808 384916482 /nfs/dbraw/zinc/91/64/82/384916482.db2.gz KVBCSIVBRKXQKR-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+]C12CCC(F)(F)CC2 ZINC000647602502 384918469 /nfs/dbraw/zinc/91/84/69/384918469.db2.gz JDUFRZXXHHHIRM-UHFFFAOYSA-N 1 2 246.301 2.122 20 0 BEADLO C[C@H](O)C[N@H+](C)Cc1c(F)cccc1Cl ZINC000051821454 384918521 /nfs/dbraw/zinc/91/85/21/384918521.db2.gz LHJXXARXJHTLFQ-QMMMGPOBSA-N 1 2 231.698 2.292 20 0 BEADLO C[C@H](O)C[N@@H+](C)Cc1c(F)cccc1Cl ZINC000051821454 384918531 /nfs/dbraw/zinc/91/85/31/384918531.db2.gz LHJXXARXJHTLFQ-QMMMGPOBSA-N 1 2 231.698 2.292 20 0 BEADLO Cc1noc(C[N@@H+]2CCc3ccccc3[C@H]2C)n1 ZINC000106862233 384937415 /nfs/dbraw/zinc/93/74/15/384937415.db2.gz FBGTVPWGRDONGU-SNVBAGLBSA-N 1 2 243.310 2.497 20 0 BEADLO Cc1noc(C[N@H+]2CCc3ccccc3[C@H]2C)n1 ZINC000106862233 384937421 /nfs/dbraw/zinc/93/74/21/384937421.db2.gz FBGTVPWGRDONGU-SNVBAGLBSA-N 1 2 243.310 2.497 20 0 BEADLO CCOCCC1(CNc2cc[nH+]c(C)n2)CC1 ZINC000127808168 384948518 /nfs/dbraw/zinc/94/85/18/384948518.db2.gz LLSFFAYDRMPEFP-UHFFFAOYSA-N 1 2 235.331 2.404 20 0 BEADLO CCC(=CC(=O)NCc1c[nH+]c(CC)[nH]1)CC ZINC001645212997 1172643127 /nfs/dbraw/zinc/64/31/27/1172643127.db2.gz STQDOCRIDWBANT-UHFFFAOYSA-N 1 2 235.331 2.335 20 0 BEADLO CCC(=CC(=O)NCc1c[nH]c(CC)[nH+]1)CC ZINC001645212997 1172643132 /nfs/dbraw/zinc/64/31/32/1172643132.db2.gz STQDOCRIDWBANT-UHFFFAOYSA-N 1 2 235.331 2.335 20 0 BEADLO CSC[C@H](O)Cn1c(C)[nH+]c2ccccc21 ZINC000187722024 384975322 /nfs/dbraw/zinc/97/53/22/384975322.db2.gz DVDXLESLZUICSU-SNVBAGLBSA-N 1 2 236.340 2.069 20 0 BEADLO Cc1ccc(C[NH2+]Cc2nccs2)nc1 ZINC000087782260 384988274 /nfs/dbraw/zinc/98/82/74/384988274.db2.gz VZYIVOFOHQKBMT-UHFFFAOYSA-N 1 2 219.313 2.136 20 0 BEADLO CCc1noc(C)c1C[NH2+]Cc1nccn1CC ZINC000559311945 385022985 /nfs/dbraw/zinc/02/29/85/385022985.db2.gz AENUWMLTDHQPOR-UHFFFAOYSA-N 1 2 248.330 2.052 20 0 BEADLO CC(C)c1nc(NCCCCCO)cc[nH+]1 ZINC000302820097 385009329 /nfs/dbraw/zinc/00/93/29/385009329.db2.gz PDJBYYLMKNALDF-UHFFFAOYSA-N 1 2 223.320 2.175 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)CCOC(C)C ZINC000107289461 384961544 /nfs/dbraw/zinc/96/15/44/384961544.db2.gz YUAZIPZZKNGAGI-UHFFFAOYSA-N 1 2 222.288 2.144 20 0 BEADLO C[C@H]1c2cccn2CC[N@H+]1CCOCC(F)F ZINC000188642388 385072365 /nfs/dbraw/zinc/07/23/65/385072365.db2.gz RPBIDBYUGACHLV-JTQLQIEISA-N 1 2 244.285 2.146 20 0 BEADLO C[C@H]1c2cccn2CC[N@@H+]1CCOCC(F)F ZINC000188642388 385072370 /nfs/dbraw/zinc/07/23/70/385072370.db2.gz RPBIDBYUGACHLV-JTQLQIEISA-N 1 2 244.285 2.146 20 0 BEADLO CCCN(C)C(=O)Cn1c(C)[nH+]c2ccccc21 ZINC000063601730 385043044 /nfs/dbraw/zinc/04/30/44/385043044.db2.gz JLFBCOMXARJZHS-UHFFFAOYSA-N 1 2 245.326 2.213 20 0 BEADLO Cc1nnc(C[N@@H+](C)C(C)(C)c2ccccc2)[nH]1 ZINC000644691866 385111198 /nfs/dbraw/zinc/11/11/98/385111198.db2.gz ZYZNUJDIPQVBEZ-UHFFFAOYSA-N 1 2 244.342 2.480 20 0 BEADLO Cc1nnc(C[N@H+](C)C(C)(C)c2ccccc2)[nH]1 ZINC000644691866 385111206 /nfs/dbraw/zinc/11/12/06/385111206.db2.gz ZYZNUJDIPQVBEZ-UHFFFAOYSA-N 1 2 244.342 2.480 20 0 BEADLO CCC[C@H]([NH2+][C@@H](CC)CSC)C(=O)OCC ZINC000162120490 385112786 /nfs/dbraw/zinc/11/27/86/385112786.db2.gz YYOUGBHESUAPDW-QWRGUYRKSA-N 1 2 247.404 2.449 20 0 BEADLO CSCCNc1cc(NCC2CC2)[nH+]cn1 ZINC000119514838 385117894 /nfs/dbraw/zinc/11/78/94/385117894.db2.gz IYKCWLJVHGOJFW-UHFFFAOYSA-N 1 2 238.360 2.073 20 0 BEADLO CSCCNc1cc(NCC2CC2)nc[nH+]1 ZINC000119514838 385117900 /nfs/dbraw/zinc/11/79/00/385117900.db2.gz IYKCWLJVHGOJFW-UHFFFAOYSA-N 1 2 238.360 2.073 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)[C@H]2C[C@@H]2C(C)C)[nH+]1 ZINC000516657463 385124639 /nfs/dbraw/zinc/12/46/39/385124639.db2.gz ZOYVMRCKPDZZBE-MNOVXSKESA-N 1 2 249.358 2.362 20 0 BEADLO CCCOc1ccc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)cc1 ZINC000644717488 385136295 /nfs/dbraw/zinc/13/62/95/385136295.db2.gz UAZLPXLTFTVSIH-LSDHHAIUSA-N 1 2 247.338 2.449 20 0 BEADLO CCCOc1ccc(C[N@H+]2CCO[C@@H]3C[C@@H]32)cc1 ZINC000644717488 385136300 /nfs/dbraw/zinc/13/63/00/385136300.db2.gz UAZLPXLTFTVSIH-LSDHHAIUSA-N 1 2 247.338 2.449 20 0 BEADLO CC[C@@H]1CC[N@H+](Cc2noc(C(C)C)n2)C1 ZINC000125792582 385087925 /nfs/dbraw/zinc/08/79/25/385087925.db2.gz DLYRHWOOZJLFAM-SNVBAGLBSA-N 1 2 223.320 2.425 20 0 BEADLO CC[C@@H]1CC[N@@H+](Cc2noc(C(C)C)n2)C1 ZINC000125792582 385087928 /nfs/dbraw/zinc/08/79/28/385087928.db2.gz DLYRHWOOZJLFAM-SNVBAGLBSA-N 1 2 223.320 2.425 20 0 BEADLO Cc1csc([C@H]2COCC[N@@H+]2CC2CC2)n1 ZINC000189271961 385140604 /nfs/dbraw/zinc/14/06/04/385140604.db2.gz GDRZYIRKQATOSO-LLVKDONJSA-N 1 2 238.356 2.235 20 0 BEADLO Cc1csc([C@H]2COCC[N@H+]2CC2CC2)n1 ZINC000189271961 385140610 /nfs/dbraw/zinc/14/06/10/385140610.db2.gz GDRZYIRKQATOSO-LLVKDONJSA-N 1 2 238.356 2.235 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CC[C@H](C(F)F)C2)[nH]1 ZINC000644680081 385092147 /nfs/dbraw/zinc/09/21/47/385092147.db2.gz YFLANIPUBZAQIZ-QMMMGPOBSA-N 1 2 244.289 2.015 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CC[C@H](C(F)F)C2)[nH]1 ZINC000644680081 385092151 /nfs/dbraw/zinc/09/21/51/385092151.db2.gz YFLANIPUBZAQIZ-QMMMGPOBSA-N 1 2 244.289 2.015 20 0 BEADLO CC1(C)CCC(C(=O)NCc2[nH]cc[nH+]2)CC1 ZINC000151222085 385094690 /nfs/dbraw/zinc/09/46/90/385094690.db2.gz KDFLDWOGDNJIDF-UHFFFAOYSA-N 1 2 235.331 2.242 20 0 BEADLO C[C@@H]([NH2+]c1ccc2c(c1)CCO2)[C@@H]1CCOC1 ZINC000165287731 385097941 /nfs/dbraw/zinc/09/79/41/385097941.db2.gz IGONCHIZHCKQQQ-ZYHUDNBSSA-N 1 2 233.311 2.458 20 0 BEADLO Cc1nc(N(C)[C@H](C)C2(C)CC2)cc[nH+]1 ZINC000176856197 385152069 /nfs/dbraw/zinc/15/20/69/385152069.db2.gz OZTRDFIYWULYSR-SECBINFHSA-N 1 2 205.305 2.410 20 0 BEADLO COC[C@@H](Nc1cc[nH+]c(C)n1)c1ccc(C)o1 ZINC000176947247 385160618 /nfs/dbraw/zinc/16/06/18/385160618.db2.gz FWOZTBCAIYCZCQ-LLVKDONJSA-N 1 2 247.298 2.486 20 0 BEADLO COC[C@@H](Nc1cc(C)[nH+]c(C2CC2)n1)C1CC1 ZINC000129545808 385163448 /nfs/dbraw/zinc/16/34/48/385163448.db2.gz HQCXVTACNNWJJE-GFCCVEGCSA-N 1 2 247.342 2.499 20 0 BEADLO CCS[C@@H](C)c1noc(C[N@H+](C)C2CC2)n1 ZINC000178304195 385221837 /nfs/dbraw/zinc/22/18/37/385221837.db2.gz FVDYXRIBCSDBPS-QMMMGPOBSA-N 1 2 241.360 2.478 20 0 BEADLO CCS[C@@H](C)c1noc(C[N@@H+](C)C2CC2)n1 ZINC000178304195 385221846 /nfs/dbraw/zinc/22/18/46/385221846.db2.gz FVDYXRIBCSDBPS-QMMMGPOBSA-N 1 2 241.360 2.478 20 0 BEADLO CC(=O)CC[N@@H+]1CCO[C@H](c2cccs2)C1 ZINC000157600714 385228052 /nfs/dbraw/zinc/22/80/52/385228052.db2.gz WSTCSDFKCWBGOE-NSHDSACASA-N 1 2 239.340 2.101 20 0 BEADLO CC(=O)CC[N@H+]1CCO[C@H](c2cccs2)C1 ZINC000157600714 385228056 /nfs/dbraw/zinc/22/80/56/385228056.db2.gz WSTCSDFKCWBGOE-NSHDSACASA-N 1 2 239.340 2.101 20 0 BEADLO C[N@@H+](Cc1cnccn1)Cc1cccc(Cl)n1 ZINC000177239078 385204849 /nfs/dbraw/zinc/20/48/49/385204849.db2.gz HPPSPGLJGNRDIH-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[N@H+](Cc1cnccn1)Cc1cccc(Cl)n1 ZINC000177239078 385204856 /nfs/dbraw/zinc/20/48/56/385204856.db2.gz HPPSPGLJGNRDIH-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[C@@H]1OCC[N@H+](Cc2ccnc(Cl)c2)[C@H]1C ZINC000178585882 385302757 /nfs/dbraw/zinc/30/27/57/385302757.db2.gz SKNSRIUESXBNIW-UWVGGRQHSA-N 1 2 240.734 2.344 20 0 BEADLO C[C@@H]1OCC[N@@H+](Cc2ccnc(Cl)c2)[C@H]1C ZINC000178585882 385302761 /nfs/dbraw/zinc/30/27/61/385302761.db2.gz SKNSRIUESXBNIW-UWVGGRQHSA-N 1 2 240.734 2.344 20 0 BEADLO CC(C)CSCCC[N@H+](C)Cc1nnc[nH]1 ZINC000178734039 385321791 /nfs/dbraw/zinc/32/17/91/385321791.db2.gz PZWSEVSLXYJTNW-UHFFFAOYSA-N 1 2 242.392 2.016 20 0 BEADLO CC(C)CSCCC[N@@H+](C)Cc1nnc[nH]1 ZINC000178734039 385321796 /nfs/dbraw/zinc/32/17/96/385321796.db2.gz PZWSEVSLXYJTNW-UHFFFAOYSA-N 1 2 242.392 2.016 20 0 BEADLO Cc1cccc(CNc2nc[nH+]c(N)c2Cl)n1 ZINC000227848366 385261929 /nfs/dbraw/zinc/26/19/29/385261929.db2.gz GVQLCYWQKJSOTD-UHFFFAOYSA-N 1 2 249.705 2.028 20 0 BEADLO Cc1cccc(CNc2[nH+]cnc(N)c2Cl)n1 ZINC000227848366 385261934 /nfs/dbraw/zinc/26/19/34/385261934.db2.gz GVQLCYWQKJSOTD-UHFFFAOYSA-N 1 2 249.705 2.028 20 0 BEADLO CCCC[N@H+](CCOC)Cc1nnc(C)s1 ZINC000358508929 385262490 /nfs/dbraw/zinc/26/24/90/385262490.db2.gz MNOFZRSJFPCKDB-UHFFFAOYSA-N 1 2 243.376 2.095 20 0 BEADLO CCCC[N@@H+](CCOC)Cc1nnc(C)s1 ZINC000358508929 385262497 /nfs/dbraw/zinc/26/24/97/385262497.db2.gz MNOFZRSJFPCKDB-UHFFFAOYSA-N 1 2 243.376 2.095 20 0 BEADLO O=C(CC1CC1)NCCCCNc1cccc[nH+]1 ZINC000109281966 385277869 /nfs/dbraw/zinc/27/78/69/385277869.db2.gz NQYTZDLPNLTAOB-UHFFFAOYSA-N 1 2 247.342 2.190 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccno2)C[C@H](CC)O1 ZINC000569224046 385292111 /nfs/dbraw/zinc/29/21/11/385292111.db2.gz ATCPZUHOCWQOIL-PHIMTYICSA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccno2)C[C@H](CC)O1 ZINC000569224046 385292116 /nfs/dbraw/zinc/29/21/16/385292116.db2.gz ATCPZUHOCWQOIL-PHIMTYICSA-N 1 2 224.304 2.064 20 0 BEADLO COC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@@H+]1C/C=C/Cl ZINC000191215158 385293197 /nfs/dbraw/zinc/29/31/97/385293197.db2.gz REYZKIKEAIZFSI-FBFJJQQKSA-N 1 2 243.734 2.012 20 0 BEADLO COC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@H+]1C/C=C/Cl ZINC000191215158 385293200 /nfs/dbraw/zinc/29/32/00/385293200.db2.gz REYZKIKEAIZFSI-FBFJJQQKSA-N 1 2 243.734 2.012 20 0 BEADLO Cc1cc(CN2CCc3c([nH+]cn3C)C2)cs1 ZINC000648347379 385298621 /nfs/dbraw/zinc/29/86/21/385298621.db2.gz NTWBITGJITVXGF-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1cc(C[N@H+]2CCc3c(ncn3C)C2)cs1 ZINC000648347379 385298629 /nfs/dbraw/zinc/29/86/29/385298629.db2.gz NTWBITGJITVXGF-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3c(ncn3C)C2)cs1 ZINC000648347379 385298634 /nfs/dbraw/zinc/29/86/34/385298634.db2.gz NTWBITGJITVXGF-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO CC(C)c1nc(NC2CCOCC2)cc[nH+]1 ZINC000110247410 385388695 /nfs/dbraw/zinc/38/86/95/385388695.db2.gz WEICFNBZBYRKPJ-UHFFFAOYSA-N 1 2 221.304 2.191 20 0 BEADLO CC[C@@H](C)CN(C)C(=O)/C=C\c1[nH+]ccn1CC ZINC000492322992 385358816 /nfs/dbraw/zinc/35/88/16/385358816.db2.gz UBBPRQRLVNKIQJ-QDZRJHCZSA-N 1 2 249.358 2.421 20 0 BEADLO C[C@H](CNC(=O)CCCC1CC1)Cn1cc[nH+]c1 ZINC000643992443 385359578 /nfs/dbraw/zinc/35/95/78/385359578.db2.gz ANXGQBXFIACQBO-GFCCVEGCSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1ccc(N[C@@H](C)[C@H]2CCCO2)c[nH+]1 ZINC000309042651 385387547 /nfs/dbraw/zinc/38/75/47/385387547.db2.gz KXJIZOVGMYNFKP-CMPLNLGQSA-N 1 2 206.289 2.369 20 0 BEADLO CCCc1nc(C[NH+]2CCCCC2)no1 ZINC000065587862 385326922 /nfs/dbraw/zinc/32/69/22/385326922.db2.gz ATKPIXBDDQEZCO-UHFFFAOYSA-N 1 2 209.293 2.008 20 0 BEADLO CC[C@H]1CCC[C@@H](NC(=O)CCc2c[nH+]c[nH]2)C1 ZINC000193329454 385392249 /nfs/dbraw/zinc/39/22/49/385392249.db2.gz QOOTWIFGZBGBHM-NWDGAFQWSA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@H]1CCC[C@@H](NC(=O)CCc2c[nH]c[nH+]2)C1 ZINC000193329454 385392251 /nfs/dbraw/zinc/39/22/51/385392251.db2.gz QOOTWIFGZBGBHM-NWDGAFQWSA-N 1 2 249.358 2.427 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2CCCCO2)c(C)[nH+]1 ZINC000178576349 385394543 /nfs/dbraw/zinc/39/45/43/385394543.db2.gz IUTHUTTTZOJDJC-LBPRGKRZSA-N 1 2 234.299 2.206 20 0 BEADLO CC(C)([NH2+]Cc1ccn[nH]1)c1cccs1 ZINC000309076020 385397851 /nfs/dbraw/zinc/39/78/51/385397851.db2.gz KLQDBDKVEONYOZ-UHFFFAOYSA-N 1 2 221.329 2.496 20 0 BEADLO C=Cn1cc(C[N@H+](C)Cc2ccco2)cn1 ZINC000193620090 385404970 /nfs/dbraw/zinc/40/49/70/385404970.db2.gz HCSALTHOZFXFJA-UHFFFAOYSA-N 1 2 217.272 2.209 20 0 BEADLO C=Cn1cc(C[N@@H+](C)Cc2ccco2)cn1 ZINC000193620090 385404977 /nfs/dbraw/zinc/40/49/77/385404977.db2.gz HCSALTHOZFXFJA-UHFFFAOYSA-N 1 2 217.272 2.209 20 0 BEADLO CCOC(=O)[C@@H]([NH2+]CCSCC)[C@H](C)CC ZINC000181637558 385412022 /nfs/dbraw/zinc/41/20/22/385412022.db2.gz MPOCJRZFUJYYFE-MNOVXSKESA-N 1 2 247.404 2.307 20 0 BEADLO Cc1cc(C[NH2+]Cc2ncc(C)s2)on1 ZINC000309092738 385414060 /nfs/dbraw/zinc/41/40/60/385414060.db2.gz FLBJAQQTBDBANG-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO Cc1noc([C@@H](C)[NH2+]Cc2ccsc2)n1 ZINC000309103715 385421479 /nfs/dbraw/zinc/42/14/79/385421479.db2.gz GXUFGRWPHARIRM-SSDOTTSWSA-N 1 2 223.301 2.290 20 0 BEADLO CC(C)N(C)C(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000170822752 385449589 /nfs/dbraw/zinc/44/95/89/385449589.db2.gz WQNGYXOMAIOAKC-UHFFFAOYSA-N 1 2 243.310 2.353 20 0 BEADLO CCN(CC(C)C)C(=O)c1ccc2[nH+]ccn2c1 ZINC000170867015 385452000 /nfs/dbraw/zinc/45/20/00/385452000.db2.gz QQCOBGZECHERCS-UHFFFAOYSA-N 1 2 245.326 2.452 20 0 BEADLO C[C@](O)(C[NH+]1Cc2ccccc2C1)C(F)(F)F ZINC000281869110 385454984 /nfs/dbraw/zinc/45/49/84/385454984.db2.gz CBFQZVBDXPWFSK-NSHDSACASA-N 1 2 245.244 2.316 20 0 BEADLO C[C@H](C(=O)Nc1ccc(N)[nH+]c1)C1CCCC1 ZINC000644084447 385434740 /nfs/dbraw/zinc/43/47/40/385434740.db2.gz PPERMJLIQIECBI-VIFPVBQESA-N 1 2 233.315 2.259 20 0 BEADLO CC(C)(C)CNC(=O)c1ccc2[nH+]ccn2c1 ZINC000171159014 385469018 /nfs/dbraw/zinc/46/90/18/385469018.db2.gz YUIKDVRKJBUPOZ-UHFFFAOYSA-N 1 2 231.299 2.110 20 0 BEADLO Cc1ccc(CSc2ncnn2C)c(C)[nH+]1 ZINC000336213077 385472688 /nfs/dbraw/zinc/47/26/88/385472688.db2.gz XMDQPLZRORPZFI-UHFFFAOYSA-N 1 2 234.328 2.119 20 0 BEADLO CC(C)(C)CCCC(=O)NCCn1cc[nH+]c1 ZINC000171430028 385484608 /nfs/dbraw/zinc/48/46/08/385484608.db2.gz SNSICYZWQYWSRB-UHFFFAOYSA-N 1 2 237.347 2.216 20 0 BEADLO COc1cc(C[N@@H+]2CC[C@@](C)(F)C2)ccn1 ZINC000336324893 385485145 /nfs/dbraw/zinc/48/51/45/385485145.db2.gz YMZKOSMAJAAJDZ-GFCCVEGCSA-N 1 2 224.279 2.024 20 0 BEADLO COc1cc(C[N@H+]2CC[C@@](C)(F)C2)ccn1 ZINC000336324893 385485151 /nfs/dbraw/zinc/48/51/51/385485151.db2.gz YMZKOSMAJAAJDZ-GFCCVEGCSA-N 1 2 224.279 2.024 20 0 BEADLO C[N@@H+](Cc1noc(C2CC2)n1)CC1CCC1 ZINC000111299133 385502804 /nfs/dbraw/zinc/50/28/04/385502804.db2.gz AWINPMCZFPQMJJ-UHFFFAOYSA-N 1 2 221.304 2.179 20 0 BEADLO C[N@H+](Cc1noc(C2CC2)n1)CC1CCC1 ZINC000111299133 385502806 /nfs/dbraw/zinc/50/28/06/385502806.db2.gz AWINPMCZFPQMJJ-UHFFFAOYSA-N 1 2 221.304 2.179 20 0 BEADLO Cc1ccc(OCC[N@@H+](C)Cc2cnc[nH]2)cc1 ZINC000179770811 385489484 /nfs/dbraw/zinc/48/94/84/385489484.db2.gz FNEDTHAQDLOKPO-UHFFFAOYSA-N 1 2 245.326 2.229 20 0 BEADLO Cc1ccc(OCC[N@H+](C)Cc2cnc[nH]2)cc1 ZINC000179770811 385489486 /nfs/dbraw/zinc/48/94/86/385489486.db2.gz FNEDTHAQDLOKPO-UHFFFAOYSA-N 1 2 245.326 2.229 20 0 BEADLO C[C@H](Nc1ncnc2c1C[N@H+](C)CC2)C(C)(C)C ZINC000364870240 385533251 /nfs/dbraw/zinc/53/32/51/385533251.db2.gz OQIVPMKPWZVPDE-JTQLQIEISA-N 1 2 248.374 2.311 20 0 BEADLO C[C@H](Nc1ncnc2c1C[N@@H+](C)CC2)C(C)(C)C ZINC000364870240 385533253 /nfs/dbraw/zinc/53/32/53/385533253.db2.gz OQIVPMKPWZVPDE-JTQLQIEISA-N 1 2 248.374 2.311 20 0 BEADLO CC(C)[C@H]1CCCN1C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493162319 385540011 /nfs/dbraw/zinc/54/00/11/385540011.db2.gz SKFQECBZCSEQFE-MVIFTORASA-N 1 2 233.315 2.070 20 0 BEADLO Cc1cnc(C[N@H+](C)CCc2nccs2)o1 ZINC000157997051 385542715 /nfs/dbraw/zinc/54/27/15/385542715.db2.gz RZGFVTUFEAYCJB-UHFFFAOYSA-N 1 2 237.328 2.114 20 0 BEADLO Cc1cnc(C[N@@H+](C)CCc2nccs2)o1 ZINC000157997051 385542719 /nfs/dbraw/zinc/54/27/19/385542719.db2.gz RZGFVTUFEAYCJB-UHFFFAOYSA-N 1 2 237.328 2.114 20 0 BEADLO CC(C)(C)CCCNC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493109835 385522400 /nfs/dbraw/zinc/52/24/00/385522400.db2.gz XNLKZIWXIJAFCJ-AATRIKPKSA-N 1 2 235.331 2.365 20 0 BEADLO c1cn(CCCSc2nnc(C3CC3)[nH]2)c[nH+]1 ZINC000180434603 385522782 /nfs/dbraw/zinc/52/27/82/385522782.db2.gz DDESKPKQZPOHNV-UHFFFAOYSA-N 1 2 249.343 2.061 20 0 BEADLO c1cn(CCCSc2nc(C3CC3)n[nH]2)c[nH+]1 ZINC000180434603 385522786 /nfs/dbraw/zinc/52/27/86/385522786.db2.gz DDESKPKQZPOHNV-UHFFFAOYSA-N 1 2 249.343 2.061 20 0 BEADLO c1cn(CCCSc2n[nH]c(C3CC3)n2)c[nH+]1 ZINC000180434603 385522790 /nfs/dbraw/zinc/52/27/90/385522790.db2.gz DDESKPKQZPOHNV-UHFFFAOYSA-N 1 2 249.343 2.061 20 0 BEADLO C[C@H](CCC1CC1)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493132199 385528503 /nfs/dbraw/zinc/52/85/03/385528503.db2.gz QPMHGFWRSQGVDO-JYESYGNLSA-N 1 2 233.315 2.118 20 0 BEADLO CO[C@@H](C)CCC(=O)Nc1cc[nH+]cc1C ZINC000181387453 385575228 /nfs/dbraw/zinc/57/52/28/385575228.db2.gz QHDSGFGJEVNKPK-JTQLQIEISA-N 1 2 222.288 2.144 20 0 BEADLO Cc1ccc(C(=O)Nc2cc[nH+]cc2C)cn1 ZINC000107287154 385562155 /nfs/dbraw/zinc/56/21/55/385562155.db2.gz BBEYSPPLICXLBL-UHFFFAOYSA-N 1 2 227.267 2.346 20 0 BEADLO CC(C)c1nnc(C[NH2+]Cc2cc[nH]c2)s1 ZINC000309401456 385571761 /nfs/dbraw/zinc/57/17/61/385571761.db2.gz WHQNCDUTJCTCKV-UHFFFAOYSA-N 1 2 236.344 2.279 20 0 BEADLO Cc1cc[nH+]c(NC[C@@H](CO)C2CC2)c1Cl ZINC000336675743 385597818 /nfs/dbraw/zinc/59/78/18/385597818.db2.gz BOUIVDGSKZZMNA-JTQLQIEISA-N 1 2 240.734 2.474 20 0 BEADLO C[C@@H]1CCC[C@H](C)N(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493465695 385578231 /nfs/dbraw/zinc/57/82/31/385578231.db2.gz ZDIVMPFWOHVDBR-PBWNMSGQSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccccn1)c1ccon1 ZINC000309428204 385581309 /nfs/dbraw/zinc/58/13/09/385581309.db2.gz AZSXSNQRBFMWTK-VHSXEESVSA-N 1 2 217.272 2.481 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ccccn1)c1ccon1 ZINC000309428202 385582011 /nfs/dbraw/zinc/58/20/11/385582011.db2.gz AZSXSNQRBFMWTK-NXEZZACHSA-N 1 2 217.272 2.481 20 0 BEADLO Cc1ncccc1COc1cc[nH+]cc1 ZINC000644869834 385619223 /nfs/dbraw/zinc/61/92/23/385619223.db2.gz MDIOORBZYAZGPP-UHFFFAOYSA-N 1 2 200.241 2.364 20 0 BEADLO Cc1cnc(NCc2ccn3cc[nH+]c3c2)nc1 ZINC000340062510 385619793 /nfs/dbraw/zinc/61/97/93/385619793.db2.gz VSCHEIYYBITYTJ-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO CCOCCNc1[nH+]ccc(C)c1Cl ZINC000336651379 385622626 /nfs/dbraw/zinc/62/26/26/385622626.db2.gz JNTGYNWWCMOUJB-UHFFFAOYSA-N 1 2 214.696 2.492 20 0 BEADLO CCCCNC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000280989905 385625670 /nfs/dbraw/zinc/62/56/70/385625670.db2.gz OMHPQFBDQJVPAG-UHFFFAOYSA-N 1 2 232.287 2.256 20 0 BEADLO CC1(C)CCC(NC(=O)CCc2[nH]cc[nH+]2)CC1 ZINC000281067063 385633402 /nfs/dbraw/zinc/63/34/02/385633402.db2.gz ZJVNNRYEFQAGMQ-UHFFFAOYSA-N 1 2 249.358 2.427 20 0 BEADLO CC1CCC(N(C)C(=O)/C=C\c2[nH]cc[nH+]2)CC1 ZINC000493750028 385613619 /nfs/dbraw/zinc/61/36/19/385613619.db2.gz TUNOBZZGJRVEGR-FPLPWBNLSA-N 1 2 247.342 2.460 20 0 BEADLO CO[C@H](CCNc1cccc[nH+]1)C(F)(F)F ZINC000309500541 385637302 /nfs/dbraw/zinc/63/73/02/385637302.db2.gz ZQFFHNGRRVHYCI-MRVPVSSYSA-N 1 2 234.221 2.461 20 0 BEADLO CC(C)(C)NC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000281123948 385638393 /nfs/dbraw/zinc/63/83/93/385638393.db2.gz XTGQFDXUNVTLBZ-UHFFFAOYSA-N 1 2 232.287 2.254 20 0 BEADLO Cc1cnn(CC[N@@H+]2CCCC[C@H]2C(F)F)c1 ZINC000337389259 385639564 /nfs/dbraw/zinc/63/95/64/385639564.db2.gz GOPGEXXDUUCGMG-NSHDSACASA-N 1 2 243.301 2.311 20 0 BEADLO Cc1cnn(CC[N@H+]2CCCC[C@H]2C(F)F)c1 ZINC000337389259 385639567 /nfs/dbraw/zinc/63/95/67/385639567.db2.gz GOPGEXXDUUCGMG-NSHDSACASA-N 1 2 243.301 2.311 20 0 BEADLO Cn1ncc2c1nc[nH+]c2SC1CCC1 ZINC000270075492 385665168 /nfs/dbraw/zinc/66/51/68/385665168.db2.gz DMTHPFBLMYVYGP-UHFFFAOYSA-N 1 2 220.301 2.008 20 0 BEADLO CC[C@@H](Cc1nc(C[NH2+]C)no1)C(C)C ZINC000309528260 385665573 /nfs/dbraw/zinc/66/55/73/385665573.db2.gz VJAOAVZXXAUJKD-VIFPVBQESA-N 1 2 211.309 2.014 20 0 BEADLO FC1(F)CC[N@H+](C[C@@H]2CCSC2)C1 ZINC000307461638 385691791 /nfs/dbraw/zinc/69/17/91/385691791.db2.gz FWIMRQLBCFACTC-QMMMGPOBSA-N 1 2 207.289 2.081 20 0 BEADLO FC1(F)CC[N@@H+](C[C@@H]2CCSC2)C1 ZINC000307461638 385691796 /nfs/dbraw/zinc/69/17/96/385691796.db2.gz FWIMRQLBCFACTC-QMMMGPOBSA-N 1 2 207.289 2.081 20 0 BEADLO CN(CC1CC1)c1cc(NCC2CC2)[nH+]cn1 ZINC000270318589 385696211 /nfs/dbraw/zinc/69/62/11/385696211.db2.gz VYEPMXFSOJXLEZ-UHFFFAOYSA-N 1 2 232.331 2.145 20 0 BEADLO CN(CC1CC1)c1cc(NCC2CC2)nc[nH+]1 ZINC000270318589 385696220 /nfs/dbraw/zinc/69/62/20/385696220.db2.gz VYEPMXFSOJXLEZ-UHFFFAOYSA-N 1 2 232.331 2.145 20 0 BEADLO C[C@H](CC(=O)OC(C)(C)C)[NH2+]C1(C(F)F)CC1 ZINC000337549667 385706025 /nfs/dbraw/zinc/70/60/25/385706025.db2.gz NPCSMPBFPCUBET-MRVPVSSYSA-N 1 2 249.301 2.494 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@H]1CS[C@H](C(C)(C)C)C1 ZINC000309578225 385711365 /nfs/dbraw/zinc/71/13/65/385711365.db2.gz POMAPUZLIXQZPH-BBBLOLIVSA-N 1 2 245.388 2.058 20 0 BEADLO Fc1ccc2c(c1)CC[N@@H+](Cc1ccno1)C2 ZINC000271089803 385786009 /nfs/dbraw/zinc/78/60/09/385786009.db2.gz GERWAYMDLOSKEM-UHFFFAOYSA-N 1 2 232.258 2.372 20 0 BEADLO Fc1ccc2c(c1)CC[N@H+](Cc1ccno1)C2 ZINC000271089803 385786011 /nfs/dbraw/zinc/78/60/11/385786011.db2.gz GERWAYMDLOSKEM-UHFFFAOYSA-N 1 2 232.258 2.372 20 0 BEADLO Cn1ccc(C[N@@H+]2CCc3sccc3C2)n1 ZINC000270749580 385738758 /nfs/dbraw/zinc/73/87/58/385738758.db2.gz BYHBGXXRMAXCKF-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO Cn1ccc(C[N@H+]2CCc3sccc3C2)n1 ZINC000270749580 385738768 /nfs/dbraw/zinc/73/87/68/385738768.db2.gz BYHBGXXRMAXCKF-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO C[C@H]([NH2+][C@@H]1C[C@H](C)[C@H]1C)C(=O)OC(C)(C)C ZINC000309608897 385739908 /nfs/dbraw/zinc/73/99/08/385739908.db2.gz ZKKPEVNVFFDLOY-ZRUFSTJUSA-N 1 2 227.348 2.351 20 0 BEADLO FC(F)(C[NH2+][C@H]1CCOC1)c1ccccc1 ZINC000161173530 385744994 /nfs/dbraw/zinc/74/49/94/385744994.db2.gz ZZQAKAZRPAUGPU-NSHDSACASA-N 1 2 227.254 2.157 20 0 BEADLO Cc1n[nH]c(C)c1C[N@@H+]1CCn2cccc2[C@@H]1C ZINC000270988248 385767008 /nfs/dbraw/zinc/76/70/08/385767008.db2.gz GLMCAHXMPBTDRL-LBPRGKRZSA-N 1 2 244.342 2.405 20 0 BEADLO Cc1n[nH]c(C)c1C[N@H+]1CCn2cccc2[C@@H]1C ZINC000270988248 385767011 /nfs/dbraw/zinc/76/70/11/385767011.db2.gz GLMCAHXMPBTDRL-LBPRGKRZSA-N 1 2 244.342 2.405 20 0 BEADLO CC[C@@H]([NH2+]CCc1sccc1C)C(=O)OC ZINC000336737411 385771293 /nfs/dbraw/zinc/77/12/93/385771293.db2.gz NLCCSEPXNQPGFA-SNVBAGLBSA-N 1 2 241.356 2.140 20 0 BEADLO CN(C[C@@H]1CCC[C@H]1O)c1[nH]c2ccccc2[nH+]1 ZINC000270595158 385722923 /nfs/dbraw/zinc/72/29/23/385722923.db2.gz UKNZJQRDLHSSRJ-GXFFZTMASA-N 1 2 245.326 2.160 20 0 BEADLO C[C@@H]1[C@@H](C)[S@@](=O)CC[N@@H+]1Cc1cccs1 ZINC000271180137 385799654 /nfs/dbraw/zinc/79/96/54/385799654.db2.gz HIPKSPKQPCFKLL-FCHSOHFDSA-N 1 2 243.397 2.089 20 0 BEADLO C[C@@H]1[C@@H](C)[S@@](=O)CC[N@H+]1Cc1cccs1 ZINC000271180137 385799661 /nfs/dbraw/zinc/79/96/61/385799661.db2.gz HIPKSPKQPCFKLL-FCHSOHFDSA-N 1 2 243.397 2.089 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cnn(C)c1)c1cscn1 ZINC000271195478 385804496 /nfs/dbraw/zinc/80/44/96/385804496.db2.gz YIKHFRINQRJCCH-DTWKUNHWSA-N 1 2 236.344 2.288 20 0 BEADLO C[N@H+](CCc1cnccn1)C/C(Cl)=C/Cl ZINC000271308308 385817305 /nfs/dbraw/zinc/81/73/05/385817305.db2.gz HDTGUPWWTMMXAS-TWGQIWQCSA-N 1 2 246.141 2.270 20 0 BEADLO C[N@@H+](CCc1cnccn1)C/C(Cl)=C/Cl ZINC000271308308 385817307 /nfs/dbraw/zinc/81/73/07/385817307.db2.gz HDTGUPWWTMMXAS-TWGQIWQCSA-N 1 2 246.141 2.270 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@@H](C)c1cnccc1C ZINC000271480602 385833056 /nfs/dbraw/zinc/83/30/56/385833056.db2.gz LTIXYHDVDOSQDM-NSHDSACASA-N 1 2 230.315 2.272 20 0 BEADLO Cc1sccc1C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000294295547 385835421 /nfs/dbraw/zinc/83/54/21/385835421.db2.gz BTFBORLHVHNYRS-SECBINFHSA-N 1 2 249.339 2.072 20 0 BEADLO COC[C@H]([NH2+][C@@H](C)c1cn[nH]c1)c1ccc(C)o1 ZINC000283953050 385841694 /nfs/dbraw/zinc/84/16/94/385841694.db2.gz FXDKDOPSOIVKEQ-JQWIXIFHSA-N 1 2 249.314 2.349 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)Nc1ccnc(C2CC2)n1 ZINC000271621535 385842105 /nfs/dbraw/zinc/84/21/05/385842105.db2.gz MENKSGGVKKIXBS-SNVBAGLBSA-N 1 2 243.314 2.051 20 0 BEADLO CC(C)c1ccoc1C(=O)NCc1[nH+]ccn1C ZINC000283963798 385843850 /nfs/dbraw/zinc/84/38/50/385843850.db2.gz LTXYZIJFAPCFAR-UHFFFAOYSA-N 1 2 247.298 2.067 20 0 BEADLO Cc1c[nH]nc1CN1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000284039789 385847442 /nfs/dbraw/zinc/84/74/42/385847442.db2.gz LSCILFSUYYVADO-GFCCVEGCSA-N 1 2 245.330 2.168 20 0 BEADLO Cc1ccsc1C[N@@H+]1CCO[C@H]2C[C@H]21 ZINC000644837448 385849031 /nfs/dbraw/zinc/84/90/31/385849031.db2.gz JSFOZTDDONWNFZ-ZJUUUORDSA-N 1 2 209.314 2.030 20 0 BEADLO Cc1ccsc1C[N@H+]1CCO[C@H]2C[C@H]21 ZINC000644837448 385849035 /nfs/dbraw/zinc/84/90/35/385849035.db2.gz JSFOZTDDONWNFZ-ZJUUUORDSA-N 1 2 209.314 2.030 20 0 BEADLO Cc1nc(C[N@H+](C)CCc2ccc(C)cc2)no1 ZINC000183706214 385788836 /nfs/dbraw/zinc/78/88/36/385788836.db2.gz GXILBRMDKHLTLQ-UHFFFAOYSA-N 1 2 245.326 2.361 20 0 BEADLO Cc1nc(C[N@@H+](C)CCc2ccc(C)cc2)no1 ZINC000183706214 385788845 /nfs/dbraw/zinc/78/88/45/385788845.db2.gz GXILBRMDKHLTLQ-UHFFFAOYSA-N 1 2 245.326 2.361 20 0 BEADLO C[NH+](C)Cc1nc([C@H]2C[C@H]2c2ccccc2)no1 ZINC000338066302 385884491 /nfs/dbraw/zinc/88/44/91/385884491.db2.gz AQXJQFXHJOKWEX-RYUDHWBXSA-N 1 2 243.310 2.402 20 0 BEADLO C[C@H](NC(=O)CCn1cc[nH+]c1)c1cccs1 ZINC000338060856 385885535 /nfs/dbraw/zinc/88/55/35/385885535.db2.gz XATSPNCMDIUVFZ-JTQLQIEISA-N 1 2 249.339 2.212 20 0 BEADLO Cc1ccc(CNc2nc(C)[nH+]cc2C)cc1 ZINC000647846006 385886481 /nfs/dbraw/zinc/88/64/81/385886481.db2.gz KDTZQXZSTOJNJO-UHFFFAOYSA-N 1 2 227.311 2.436 20 0 BEADLO CCc1oc2ccccc2c1C[NH2+][C@@H](C)C[NH3+] ZINC000414961780 385887335 /nfs/dbraw/zinc/88/73/35/385887335.db2.gz WDXZKYGNDWNRAS-JTQLQIEISA-N 1 2 232.327 2.432 20 0 BEADLO c1[nH]c2c([nH+]1)CCN(c1nc3ccccc3o1)C2 ZINC000647843007 385891220 /nfs/dbraw/zinc/89/12/20/385891220.db2.gz XVKLVVMYDKPOTO-UHFFFAOYSA-N 1 2 240.266 2.114 20 0 BEADLO Cc1nc(N(C)[C@H]2CCCOC2)c(C)c(C)[nH+]1 ZINC000343265214 385929279 /nfs/dbraw/zinc/92/92/79/385929279.db2.gz NFOWWDAHSNWAPY-LBPRGKRZSA-N 1 2 235.331 2.017 20 0 BEADLO CC[C@@H](C)[C@H](C)C(=O)NCc1[nH]c[nH+]c1C ZINC000272687173 385923276 /nfs/dbraw/zinc/92/32/76/385923276.db2.gz PMOHCSVQNIDWIF-BDAKNGLRSA-N 1 2 223.320 2.017 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](C)c2ccncc2F)cn1 ZINC000337950549 385859444 /nfs/dbraw/zinc/85/94/44/385859444.db2.gz HCNYXRRZUUNXJD-JTQLQIEISA-N 1 2 246.289 2.170 20 0 BEADLO COc1nccnc1C[N@H+](C)Cc1ccc(C)o1 ZINC000294578140 385870333 /nfs/dbraw/zinc/87/03/33/385870333.db2.gz PSQIQZUKDWVJCF-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1nccnc1C[N@@H+](C)Cc1ccc(C)o1 ZINC000294578140 385870335 /nfs/dbraw/zinc/87/03/35/385870335.db2.gz PSQIQZUKDWVJCF-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO Cn1ccc(C[N@@H+]2CCc3cc(F)ccc3C2)n1 ZINC000272086210 385872993 /nfs/dbraw/zinc/87/29/93/385872993.db2.gz XEIXLDAYJLKYHK-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1ccc(C[N@H+]2CCc3cc(F)ccc3C2)n1 ZINC000272086210 385872997 /nfs/dbraw/zinc/87/29/97/385872997.db2.gz XEIXLDAYJLKYHK-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO CCC[C@@](C)([NH2+]CCSC(C)C)C(=O)OC ZINC000336738438 385875127 /nfs/dbraw/zinc/87/51/27/385875127.db2.gz OGORWPFYDPIGLH-GFCCVEGCSA-N 1 2 247.404 2.449 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ccncc1F)c1nccn1C ZINC000338017855 385875538 /nfs/dbraw/zinc/87/55/38/385875538.db2.gz WQILSANHBAHSMR-NXEZZACHSA-N 1 2 248.305 2.366 20 0 BEADLO C[C@H](Nc1cc(N2CCCC2)nc[nH+]1)C1CC1 ZINC000285983536 385984150 /nfs/dbraw/zinc/98/41/50/385984150.db2.gz CEGYKQFOJUBPMI-JTQLQIEISA-N 1 2 232.331 2.287 20 0 BEADLO C[C@H](Nc1cc(N2CCCC2)[nH+]cn1)C1CC1 ZINC000285983536 385984157 /nfs/dbraw/zinc/98/41/57/385984157.db2.gz CEGYKQFOJUBPMI-JTQLQIEISA-N 1 2 232.331 2.287 20 0 BEADLO Cc1cc[nH+]c(NC[C@H](C)CCO)c1Cl ZINC000336748363 385985425 /nfs/dbraw/zinc/98/54/25/385985425.db2.gz DJBCXSLTGAIOMX-MRVPVSSYSA-N 1 2 228.723 2.474 20 0 BEADLO CC(C)(C)c1nc(N[C@H]2CC23CC3)cc[nH+]1 ZINC000644879624 385988433 /nfs/dbraw/zinc/98/84/33/385988433.db2.gz GDGTXGPWPSRQFJ-VIFPVBQESA-N 1 2 217.316 2.160 20 0 BEADLO CCOc1cc(C(=O)Nc2cc[nH+]c(C)c2)on1 ZINC000294989212 385934585 /nfs/dbraw/zinc/93/45/85/385934585.db2.gz UBHIGTBMFSFWRX-UHFFFAOYSA-N 1 2 247.254 2.029 20 0 BEADLO C[C@H](CCO)CCNc1cc[nH+]c2ccncc12 ZINC000294993304 385937049 /nfs/dbraw/zinc/93/70/49/385937049.db2.gz QWENCVVEPUVACA-NSHDSACASA-N 1 2 245.326 2.450 20 0 BEADLO Cc1cnccc1C[N@H+](C)Cc1cscn1 ZINC000295000268 385940981 /nfs/dbraw/zinc/94/09/81/385940981.db2.gz YQHDHWSQZBQHEK-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cnccc1C[N@@H+](C)Cc1cscn1 ZINC000295000268 385940987 /nfs/dbraw/zinc/94/09/87/385940987.db2.gz YQHDHWSQZBQHEK-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1nnc([C@H](C)[N@H+](C)C[C@H]2CCCO2)s1 ZINC000338292309 385944468 /nfs/dbraw/zinc/94/44/68/385944468.db2.gz ASDUASJCAMRRDL-WCBMZHEXSA-N 1 2 241.360 2.018 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+](C)C[C@H]2CCCO2)s1 ZINC000338292309 385944469 /nfs/dbraw/zinc/94/44/69/385944469.db2.gz ASDUASJCAMRRDL-WCBMZHEXSA-N 1 2 241.360 2.018 20 0 BEADLO CON(CCCn1cc[nH+]c1)CC(C)(C)C ZINC000285624843 385948958 /nfs/dbraw/zinc/94/89/58/385948958.db2.gz WRBLYUQPYIVYDM-UHFFFAOYSA-N 1 2 225.336 2.183 20 0 BEADLO C[C@H](CF)[NH2+]Cc1nccn1Cc1ccccc1 ZINC000342211632 385958564 /nfs/dbraw/zinc/95/85/64/385958564.db2.gz ZTBUTGBIAPTBFJ-GFCCVEGCSA-N 1 2 247.317 2.379 20 0 BEADLO Cc1noc([C@@H]2CCC[N@@H+]2Cc2ccncc2)n1 ZINC000285730503 385961361 /nfs/dbraw/zinc/96/13/61/385961361.db2.gz QOZDWQRVLZGAMA-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1noc([C@@H]2CCC[N@H+]2Cc2ccncc2)n1 ZINC000285730503 385961365 /nfs/dbraw/zinc/96/13/65/385961365.db2.gz QOZDWQRVLZGAMA-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1c[nH]cc1C(=O)NCc1c[nH+]c(C)cc1C ZINC000335059166 385961655 /nfs/dbraw/zinc/96/16/55/385961655.db2.gz QUNCGRYBJSCJSZ-UHFFFAOYSA-N 1 2 243.310 2.265 20 0 BEADLO Cc1noc([C@H]2CCC[N@@H+]2Cc2ccncc2)n1 ZINC000285730502 385961726 /nfs/dbraw/zinc/96/17/26/385961726.db2.gz QOZDWQRVLZGAMA-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1noc([C@H]2CCC[N@H+]2Cc2ccncc2)n1 ZINC000285730502 385961729 /nfs/dbraw/zinc/96/17/29/385961729.db2.gz QOZDWQRVLZGAMA-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1[nH+]cccc1NC1CC(n2cccn2)C1 ZINC000638786522 385965238 /nfs/dbraw/zinc/96/52/38/385965238.db2.gz OORWWUPXVIEVQZ-UHFFFAOYSA-N 1 2 228.299 2.402 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CC[C@H](C(F)(F)F)[C@H]1C ZINC000334845819 385967819 /nfs/dbraw/zinc/96/78/19/385967819.db2.gz UELOLKWQBFXFLH-BDAKNGLRSA-N 1 2 247.264 2.491 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CC[C@H](C(F)(F)F)[C@H]1C ZINC000334845819 385967823 /nfs/dbraw/zinc/96/78/23/385967823.db2.gz UELOLKWQBFXFLH-BDAKNGLRSA-N 1 2 247.264 2.491 20 0 BEADLO C[C@@H](CCC(C)(C)C)C(=O)NCc1[nH]cc[nH+]1 ZINC000273520314 386008620 /nfs/dbraw/zinc/00/86/20/386008620.db2.gz PWVILNJGLPVTMD-JTQLQIEISA-N 1 2 237.347 2.488 20 0 BEADLO CO[C@H](C)CN(C)c1cc(C)[nH+]c(C2CC2)n1 ZINC000286210175 386009427 /nfs/dbraw/zinc/00/94/27/386009427.db2.gz BEYVWMZAOIWQBR-SNVBAGLBSA-N 1 2 235.331 2.134 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2CC[C@H](C)[C@@H](C)C2)n1 ZINC000414636386 386018670 /nfs/dbraw/zinc/01/86/70/386018670.db2.gz AFTCKDRHBVQZMU-LPEHRKFASA-N 1 2 223.320 2.329 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCc2cn[nH]c2C1)c1nccs1 ZINC000334947066 386019408 /nfs/dbraw/zinc/01/94/08/386019408.db2.gz OMZYVUWPOSXSQL-WCBMZHEXSA-N 1 2 248.355 2.074 20 0 BEADLO CCC1(c2nc(C[NH2+]C)no2)CCCCC1 ZINC000414640999 386034941 /nfs/dbraw/zinc/03/49/41/386034941.db2.gz JFAMCZHJRVRHPR-UHFFFAOYSA-N 1 2 223.320 2.401 20 0 BEADLO C[NH2+]Cc1noc(CCCCC(C)C)n1 ZINC000414641437 386038678 /nfs/dbraw/zinc/03/86/78/386038678.db2.gz JQMAUXZASVJVQA-UHFFFAOYSA-N 1 2 211.309 2.158 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2cn[nH]c2)o1 ZINC000303741081 386045718 /nfs/dbraw/zinc/04/57/18/386045718.db2.gz HDOCNZKAGWOYBE-RKDXNWHRSA-N 1 2 220.276 2.118 20 0 BEADLO C[C@H]1CCCC[C@@H]1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000335076253 386045653 /nfs/dbraw/zinc/04/56/53/386045653.db2.gz KIBDZYSDENGWIW-QWRGUYRKSA-N 1 2 235.331 2.194 20 0 BEADLO Cc1cnc(C[NH2+][C@@H]2CCCc3cn[nH]c32)s1 ZINC000295586281 386054869 /nfs/dbraw/zinc/05/48/69/386054869.db2.gz DYXVBIRAQCBXSJ-SNVBAGLBSA-N 1 2 248.355 2.342 20 0 BEADLO Cc1cnc(C[NH2+][C@@H]2CCCc3c[nH]nc32)s1 ZINC000295586281 386054876 /nfs/dbraw/zinc/05/48/76/386054876.db2.gz DYXVBIRAQCBXSJ-SNVBAGLBSA-N 1 2 248.355 2.342 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)C1CC(C)(C)C1 ZINC000335166308 386107449 /nfs/dbraw/zinc/10/74/49/386107449.db2.gz IRBQHZPLSOUSOA-UHFFFAOYSA-N 1 2 207.321 2.339 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)C1CC(C)(C)C1 ZINC000335166308 386107452 /nfs/dbraw/zinc/10/74/52/386107452.db2.gz IRBQHZPLSOUSOA-UHFFFAOYSA-N 1 2 207.321 2.339 20 0 BEADLO Cc1noc(C[NH2+][C@@H](C)c2cccs2)n1 ZINC000037980754 386108231 /nfs/dbraw/zinc/10/82/31/386108231.db2.gz ZSXXEIVQXUKNKY-ZETCQYMHSA-N 1 2 223.301 2.290 20 0 BEADLO CCC1(C(=O)N[C@@H]2C[C@@H](C)n3cc[nH+]c32)CC1 ZINC000335139301 386115407 /nfs/dbraw/zinc/11/54/07/386115407.db2.gz IILJVWMDJOLVOS-NXEZZACHSA-N 1 2 233.315 2.195 20 0 BEADLO c1ccc(NC[C@@H]2CSCCS2)[nH+]c1 ZINC000129905595 386118676 /nfs/dbraw/zinc/11/86/76/386118676.db2.gz DPSDHWPZLCUTCA-SECBINFHSA-N 1 2 226.370 2.342 20 0 BEADLO Cc1occc1CNc1cccc(CO)[nH+]1 ZINC000414322146 386121553 /nfs/dbraw/zinc/12/15/53/386121553.db2.gz UYRBAHFBFTZGAD-UHFFFAOYSA-N 1 2 218.256 2.087 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)NC[C@@H]1C[C@@H]1C ZINC000287445147 386122094 /nfs/dbraw/zinc/12/20/94/386122094.db2.gz HRPVACGWLXRSPB-ONGXEEELSA-N 1 2 233.315 2.476 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2[C@@H](C)[C@@H]2c2ccccc2)n1 ZINC000414649558 386069467 /nfs/dbraw/zinc/06/94/67/386069467.db2.gz XAFCETDAWWPNBQ-ZWKOPEQDSA-N 1 2 243.310 2.306 20 0 BEADLO CCn1ccc(C[NH2+][C@@H](C)c2cc(C)ccn2)n1 ZINC000414216024 386070011 /nfs/dbraw/zinc/07/00/11/386070011.db2.gz ZECPCSBFFXAQEH-LBPRGKRZSA-N 1 2 244.342 2.457 20 0 BEADLO C[N@H+](Cc1csc(Cl)n1)CC1(CO)CC1 ZINC000295828557 386092521 /nfs/dbraw/zinc/09/25/21/386092521.db2.gz VWNUEGUXDPACGK-UHFFFAOYSA-N 1 2 246.763 2.001 20 0 BEADLO C[N@@H+](Cc1csc(Cl)n1)CC1(CO)CC1 ZINC000295828557 386092525 /nfs/dbraw/zinc/09/25/25/386092525.db2.gz VWNUEGUXDPACGK-UHFFFAOYSA-N 1 2 246.763 2.001 20 0 BEADLO CCc1ncc(CNc2cccc[nH+]2)cn1 ZINC000414287249 386095908 /nfs/dbraw/zinc/09/59/08/386095908.db2.gz DLLNVCUHZWWWDQ-UHFFFAOYSA-N 1 2 214.272 2.046 20 0 BEADLO Cc1ccc(CNc2c[nH+]ccc2C)nn1 ZINC000414358505 386145411 /nfs/dbraw/zinc/14/54/11/386145411.db2.gz GXKQQCOLFJUFNB-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO CC(C)(O)CCNc1cc[nH+]c2ccncc12 ZINC000274749814 386145870 /nfs/dbraw/zinc/14/58/70/386145870.db2.gz HGJOHSUUIOYGJV-UHFFFAOYSA-N 1 2 231.299 2.203 20 0 BEADLO CC(C)c1nc(N[C@@H]2CCC[C@H]2F)cc[nH+]1 ZINC000338848018 386154499 /nfs/dbraw/zinc/15/44/99/386154499.db2.gz YXRNGIALQFKBIY-NXEZZACHSA-N 1 2 223.295 2.324 20 0 BEADLO COC(=O)[C@H]1CCCC[N@@H+]1Cc1ccoc1C ZINC000414368535 386155251 /nfs/dbraw/zinc/15/52/51/386155251.db2.gz HABSEKAKSDYSKP-GFCCVEGCSA-N 1 2 237.299 2.116 20 0 BEADLO COC(=O)[C@H]1CCCC[N@H+]1Cc1ccoc1C ZINC000414368535 386155255 /nfs/dbraw/zinc/15/52/55/386155255.db2.gz HABSEKAKSDYSKP-GFCCVEGCSA-N 1 2 237.299 2.116 20 0 BEADLO Nc1[nH+]cnc(N[C@H]2CCC[C@@H]2F)c1Cl ZINC000338841913 386157304 /nfs/dbraw/zinc/15/73/04/386157304.db2.gz IJVMABAKBVQCBC-WDSKDSINSA-N 1 2 230.674 2.015 20 0 BEADLO Nc1nc[nH+]c(N[C@H]2CCC[C@@H]2F)c1Cl ZINC000338841913 386157311 /nfs/dbraw/zinc/15/73/11/386157311.db2.gz IJVMABAKBVQCBC-WDSKDSINSA-N 1 2 230.674 2.015 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1ccc(C)cc1C ZINC000287963591 386159059 /nfs/dbraw/zinc/15/90/59/386159059.db2.gz SQEWSFCLBBYQAN-GFCCVEGCSA-N 1 2 235.327 2.297 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(C)cc1C ZINC000287963591 386159063 /nfs/dbraw/zinc/15/90/63/386159063.db2.gz SQEWSFCLBBYQAN-GFCCVEGCSA-N 1 2 235.327 2.297 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)CC(F)F ZINC000334476893 386160147 /nfs/dbraw/zinc/16/01/47/386160147.db2.gz PHRLJJGYSMFKRB-UHFFFAOYSA-N 1 2 243.257 2.427 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1C[C@]1(C)C(C)C ZINC000274884183 386160300 /nfs/dbraw/zinc/16/03/00/386160300.db2.gz HKYJCCUKAALPLR-GXFFZTMASA-N 1 2 235.331 2.017 20 0 BEADLO CCCCCC[N@@H+]1CC(F)(F)C[C@H]1CO ZINC000366658279 386168623 /nfs/dbraw/zinc/16/86/23/386168623.db2.gz HEEVLPXSXIRSPS-JTQLQIEISA-N 1 2 221.291 2.269 20 0 BEADLO CCCCCC[N@H+]1CC(F)(F)C[C@H]1CO ZINC000366658279 386168632 /nfs/dbraw/zinc/16/86/32/386168632.db2.gz HEEVLPXSXIRSPS-JTQLQIEISA-N 1 2 221.291 2.269 20 0 BEADLO CCCCCC[N@@H+]1CC(F)(F)C[C@@H]1CO ZINC000366658292 386169085 /nfs/dbraw/zinc/16/90/85/386169085.db2.gz HEEVLPXSXIRSPS-SNVBAGLBSA-N 1 2 221.291 2.269 20 0 BEADLO CCCCCC[N@H+]1CC(F)(F)C[C@@H]1CO ZINC000366658292 386169089 /nfs/dbraw/zinc/16/90/89/386169089.db2.gz HEEVLPXSXIRSPS-SNVBAGLBSA-N 1 2 221.291 2.269 20 0 BEADLO CCc1cc(NC[C@@](C)(OC)C2CC2)nc[nH+]1 ZINC000310406959 386178559 /nfs/dbraw/zinc/17/85/59/386178559.db2.gz OJSPQIZICXLQSC-CYBMUJFWSA-N 1 2 235.331 2.266 20 0 BEADLO Cc1csc(C2([NH2+]Cc3cc[nH]n3)CCC2)n1 ZINC000263859950 386185347 /nfs/dbraw/zinc/18/53/47/386185347.db2.gz VHIDSIAUQFVWRK-UHFFFAOYSA-N 1 2 248.355 2.344 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)C[C@H]1C=CCCC1 ZINC000275169358 386187464 /nfs/dbraw/zinc/18/74/64/386187464.db2.gz UFDTXCDTFAOIKE-STQMWFEESA-N 1 2 247.342 2.134 20 0 BEADLO Cc1nc(C[N@H+](C)CCc2nccs2)co1 ZINC000647969394 386188297 /nfs/dbraw/zinc/18/82/97/386188297.db2.gz WPXURLTUSIFBTJ-UHFFFAOYSA-N 1 2 237.328 2.114 20 0 BEADLO Cc1nc(C[N@@H+](C)CCc2nccs2)co1 ZINC000647969394 386188302 /nfs/dbraw/zinc/18/83/02/386188302.db2.gz WPXURLTUSIFBTJ-UHFFFAOYSA-N 1 2 237.328 2.114 20 0 BEADLO c1ncc(C[N@@H+]2CCC=C(c3cccnc3)C2)[nH]1 ZINC000296023574 386124780 /nfs/dbraw/zinc/12/47/80/386124780.db2.gz RLEKYRFBFQTVJJ-UHFFFAOYSA-N 1 2 240.310 2.094 20 0 BEADLO c1ncc(C[N@H+]2CCC=C(c3cccnc3)C2)[nH]1 ZINC000296023574 386124785 /nfs/dbraw/zinc/12/47/85/386124785.db2.gz RLEKYRFBFQTVJJ-UHFFFAOYSA-N 1 2 240.310 2.094 20 0 BEADLO Cc1nc(C)c(C[N@H+](C2CC2)C2COC2)s1 ZINC000296067357 386133228 /nfs/dbraw/zinc/13/32/28/386133228.db2.gz PRQAFVNYWMILOZ-UHFFFAOYSA-N 1 2 238.356 2.123 20 0 BEADLO Cc1nc(C)c(C[N@@H+](C2CC2)C2COC2)s1 ZINC000296067357 386133232 /nfs/dbraw/zinc/13/32/32/386133232.db2.gz PRQAFVNYWMILOZ-UHFFFAOYSA-N 1 2 238.356 2.123 20 0 BEADLO CO[C@@H](Cc1ccccc1)Cn1cc[nH+]c1 ZINC000296825250 386206279 /nfs/dbraw/zinc/20/62/79/386206279.db2.gz RHTSAMVIALDPAU-ZDUSSCGKSA-N 1 2 216.284 2.141 20 0 BEADLO C[N@H+](Cc1cscn1)[C@@H](CO)c1ccccc1 ZINC000264051039 386206248 /nfs/dbraw/zinc/20/62/48/386206248.db2.gz VFSYLQUKYBJNBW-ZDUSSCGKSA-N 1 2 248.351 2.309 20 0 BEADLO C[N@@H+](Cc1cscn1)[C@@H](CO)c1ccccc1 ZINC000264051039 386206255 /nfs/dbraw/zinc/20/62/55/386206255.db2.gz VFSYLQUKYBJNBW-ZDUSSCGKSA-N 1 2 248.351 2.309 20 0 BEADLO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1ccn(C)n1 ZINC000288623824 386222851 /nfs/dbraw/zinc/22/28/51/386222851.db2.gz RXMRPZSFNXIEAN-IINYFYTJSA-N 1 2 243.310 2.032 20 0 BEADLO CCC[N@H+](CC(=O)OCC)Cc1ccoc1C ZINC000414382689 386228990 /nfs/dbraw/zinc/22/89/90/386228990.db2.gz PTCUKBWOHLCFNW-UHFFFAOYSA-N 1 2 239.315 2.363 20 0 BEADLO CCC[N@@H+](CC(=O)OCC)Cc1ccoc1C ZINC000414382689 386228994 /nfs/dbraw/zinc/22/89/94/386228994.db2.gz PTCUKBWOHLCFNW-UHFFFAOYSA-N 1 2 239.315 2.363 20 0 BEADLO CC(C)C1CCN(C(=O)CCc2[nH]cc[nH+]2)CC1 ZINC000288828237 386234786 /nfs/dbraw/zinc/23/47/86/386234786.db2.gz OQCJKRLWTHYBAW-UHFFFAOYSA-N 1 2 249.358 2.237 20 0 BEADLO CC(C)C(C)(C)C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000275739062 386236589 /nfs/dbraw/zinc/23/65/89/386236589.db2.gz BNNSKBLQUHZSNK-LLVKDONJSA-N 1 2 237.347 2.070 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@H](C3CC3)C2)nc1 ZINC000339090681 386239698 /nfs/dbraw/zinc/23/96/98/386239698.db2.gz KZLLXPOPXWCQTJ-HNNXBMFYSA-N 1 2 246.354 2.255 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@H](C3CC3)C2)nc1 ZINC000339090681 386239701 /nfs/dbraw/zinc/23/97/01/386239701.db2.gz KZLLXPOPXWCQTJ-HNNXBMFYSA-N 1 2 246.354 2.255 20 0 BEADLO CC[C@@H](C)C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000125339153 386246105 /nfs/dbraw/zinc/24/61/05/386246105.db2.gz QXMLJJMLUYPPRE-BDAKNGLRSA-N 1 2 209.293 2.023 20 0 BEADLO Cc1ccnc(NCCn2cc[nH+]c2)c1Cl ZINC000336742761 386247584 /nfs/dbraw/zinc/24/75/84/386247584.db2.gz SLDDDCCTEASCKH-UHFFFAOYSA-N 1 2 236.706 2.352 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)CCc1nccs1 ZINC000264558129 386249656 /nfs/dbraw/zinc/24/96/56/386249656.db2.gz UATHKMXWJOFWGZ-UHFFFAOYSA-N 1 2 247.323 2.418 20 0 BEADLO CCCCC[C@@H](C)NC(=O)c1c[nH+]c(C)[nH]1 ZINC000264674984 386261367 /nfs/dbraw/zinc/26/13/67/386261367.db2.gz JYBKDMCJFLWGHE-SECBINFHSA-N 1 2 223.320 2.417 20 0 BEADLO C[C@@H]1CN(C(=O)C(C)(C)c2c[nH+]c[nH]2)[C@@H](C)[C@H]1C ZINC000416325343 386259180 /nfs/dbraw/zinc/25/91/80/386259180.db2.gz SNAXPRCHLSLOJR-VWYCJHECSA-N 1 2 249.358 2.190 20 0 BEADLO CCOc1cccc(C[N@@H+]2CCOCC23CC3)c1 ZINC000339000021 386198336 /nfs/dbraw/zinc/19/83/36/386198336.db2.gz SFVKAIYWRRAMCI-UHFFFAOYSA-N 1 2 247.338 2.450 20 0 BEADLO CCOc1cccc(C[N@H+]2CCOCC23CC3)c1 ZINC000339000021 386198339 /nfs/dbraw/zinc/19/83/39/386198339.db2.gz SFVKAIYWRRAMCI-UHFFFAOYSA-N 1 2 247.338 2.450 20 0 BEADLO CC(C)(C)OCC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000297866934 386283372 /nfs/dbraw/zinc/28/33/72/386283372.db2.gz TULMJUUKHGDVKA-UHFFFAOYSA-N 1 2 247.298 2.088 20 0 BEADLO c1cc(N2CCCSCC2)nc(C2CC2)[nH+]1 ZINC000264957369 386290106 /nfs/dbraw/zinc/29/01/06/386290106.db2.gz WSQMPMLLQNDPFJ-UHFFFAOYSA-N 1 2 235.356 2.297 20 0 BEADLO Cc1noc(CCc2[nH]c3ccccc3[nH+]2)n1 ZINC000264977237 386291852 /nfs/dbraw/zinc/29/18/52/386291852.db2.gz FDWLRIBTSHDGOA-UHFFFAOYSA-N 1 2 228.255 2.040 20 0 BEADLO FC(F)C[NH2+]Cc1ccnn1-c1ccccc1 ZINC000298027867 386293227 /nfs/dbraw/zinc/29/32/27/386293227.db2.gz FMSVQQCWAUNJRM-UHFFFAOYSA-N 1 2 237.253 2.227 20 0 BEADLO CCn1c[nH+]cc1CNc1ccc(C)nc1 ZINC000164794097 386302713 /nfs/dbraw/zinc/30/27/13/386302713.db2.gz SZVLYUSBZFZYDF-UHFFFAOYSA-N 1 2 216.288 2.219 20 0 BEADLO C[N@H+](Cc1cnns1)Cc1cccc(F)c1 ZINC000289426410 386302777 /nfs/dbraw/zinc/30/27/77/386302777.db2.gz VEPJHWGYZGXHSQ-UHFFFAOYSA-N 1 2 237.303 2.309 20 0 BEADLO C[N@@H+](Cc1cnns1)Cc1cccc(F)c1 ZINC000289426410 386302787 /nfs/dbraw/zinc/30/27/87/386302787.db2.gz VEPJHWGYZGXHSQ-UHFFFAOYSA-N 1 2 237.303 2.309 20 0 BEADLO CCn1c[nH+]cc1CNc1ncccc1F ZINC000416428192 386303680 /nfs/dbraw/zinc/30/36/80/386303680.db2.gz SYQDVAUZXAFOIY-UHFFFAOYSA-N 1 2 220.251 2.049 20 0 BEADLO COc1cc(C)ccc1C[NH2+]Cc1[nH]ncc1C ZINC000289433274 386303837 /nfs/dbraw/zinc/30/38/37/386303837.db2.gz FBQLVXHNAQEHNG-UHFFFAOYSA-N 1 2 245.326 2.325 20 0 BEADLO COc1cc(C)ccc1C[NH2+]Cc1n[nH]cc1C ZINC000289433274 386303846 /nfs/dbraw/zinc/30/38/46/386303846.db2.gz FBQLVXHNAQEHNG-UHFFFAOYSA-N 1 2 245.326 2.325 20 0 BEADLO C[C@H](CC1CCCC1)C(=O)NCc1[nH+]ccn1C ZINC000265116867 386307121 /nfs/dbraw/zinc/30/71/21/386307121.db2.gz MNOXKSAAYAOBSZ-LLVKDONJSA-N 1 2 249.358 2.253 20 0 BEADLO CO[C@@H](C)[C@H](C)Nc1nc(C)[nH+]c2c1CCCC2 ZINC000276354644 386307420 /nfs/dbraw/zinc/30/74/20/386307420.db2.gz UXZUVVGRHKENKH-UWVGGRQHSA-N 1 2 249.358 2.499 20 0 BEADLO Cc1nonc1C[N@@H+]1CCc2ccccc2[C@H]1C ZINC000265137025 386310414 /nfs/dbraw/zinc/31/04/14/386310414.db2.gz OWTSPYYYIQWBFX-LLVKDONJSA-N 1 2 243.310 2.497 20 0 BEADLO Cc1nonc1C[N@H+]1CCc2ccccc2[C@H]1C ZINC000265137025 386310418 /nfs/dbraw/zinc/31/04/18/386310418.db2.gz OWTSPYYYIQWBFX-LLVKDONJSA-N 1 2 243.310 2.497 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccc(F)cn2)C[C@@H](C)O1 ZINC000276360051 386310714 /nfs/dbraw/zinc/31/07/14/386310714.db2.gz MBZDRGGZQHDSPY-MFKMUULPSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccc(F)cn2)C[C@@H](C)O1 ZINC000276360051 386310717 /nfs/dbraw/zinc/31/07/17/386310717.db2.gz MBZDRGGZQHDSPY-MFKMUULPSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccc(F)cn2)C[C@H](C)O1 ZINC000276360045 386311115 /nfs/dbraw/zinc/31/11/15/386311115.db2.gz MBZDRGGZQHDSPY-GWCFXTLKSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccc(F)cn2)C[C@H](C)O1 ZINC000276360045 386311121 /nfs/dbraw/zinc/31/11/21/386311121.db2.gz MBZDRGGZQHDSPY-GWCFXTLKSA-N 1 2 238.306 2.220 20 0 BEADLO COCc1cc(C[NH2+]Cc2cccc(C)c2)no1 ZINC000298223342 386311512 /nfs/dbraw/zinc/31/15/12/386311512.db2.gz APRQIYCDLLADFO-UHFFFAOYSA-N 1 2 246.310 2.419 20 0 BEADLO CSCCC[N@H+](C)Cc1nc(C2CC2)no1 ZINC000336670012 386312221 /nfs/dbraw/zinc/31/22/21/386312221.db2.gz XRLOIQYWWZMSRH-UHFFFAOYSA-N 1 2 241.360 2.132 20 0 BEADLO CSCCC[N@@H+](C)Cc1nc(C2CC2)no1 ZINC000336670012 386312227 /nfs/dbraw/zinc/31/22/27/386312227.db2.gz XRLOIQYWWZMSRH-UHFFFAOYSA-N 1 2 241.360 2.132 20 0 BEADLO Cc1cc(CNC(=O)N2CC[C@H]2C)cc(C)[nH+]1 ZINC000643384063 386315444 /nfs/dbraw/zinc/31/54/44/386315444.db2.gz ODGBANZWFCIJSF-LLVKDONJSA-N 1 2 233.315 2.002 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H]1CCCC1(C)C ZINC000274707702 386319825 /nfs/dbraw/zinc/31/98/25/386319825.db2.gz SDGCMCZSVREOCM-SNVBAGLBSA-N 1 2 235.331 2.161 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)[C@H](C)C(C)(C)C ZINC000265245725 386322922 /nfs/dbraw/zinc/32/29/22/386322922.db2.gz RFZCMSLYRAEDMK-MNOVXSKESA-N 1 2 237.347 2.070 20 0 BEADLO CCCCC[C@H](C)NC(=O)c1c[nH+]c(C)[nH]1 ZINC000264674986 386261472 /nfs/dbraw/zinc/26/14/72/386261472.db2.gz JYBKDMCJFLWGHE-VIFPVBQESA-N 1 2 223.320 2.417 20 0 BEADLO FC(F)[C@H]1CCC[N@@H+]1CCOC1CCC1 ZINC000347148566 386261497 /nfs/dbraw/zinc/26/14/97/386261497.db2.gz BABHWIHLBYLYRB-SNVBAGLBSA-N 1 2 219.275 2.285 20 0 BEADLO FC(F)[C@H]1CCC[N@H+]1CCOC1CCC1 ZINC000347148566 386261499 /nfs/dbraw/zinc/26/14/99/386261499.db2.gz BABHWIHLBYLYRB-SNVBAGLBSA-N 1 2 219.275 2.285 20 0 BEADLO CN(Cc1cccs1)Cc1[nH]cc[nH+]1 ZINC000264705801 386264127 /nfs/dbraw/zinc/26/41/27/386264127.db2.gz KTBYISNWAKNTQZ-UHFFFAOYSA-N 1 2 207.302 2.103 20 0 BEADLO C[N@@H+](Cc1cccs1)Cc1ncc[nH]1 ZINC000264705801 386264130 /nfs/dbraw/zinc/26/41/30/386264130.db2.gz KTBYISNWAKNTQZ-UHFFFAOYSA-N 1 2 207.302 2.103 20 0 BEADLO C[N@H+](Cc1cccs1)Cc1ncc[nH]1 ZINC000264705801 386264133 /nfs/dbraw/zinc/26/41/33/386264133.db2.gz KTBYISNWAKNTQZ-UHFFFAOYSA-N 1 2 207.302 2.103 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CCCC[C@@H]2C)c[nH+]1 ZINC000264740527 386265672 /nfs/dbraw/zinc/26/56/72/386265672.db2.gz RFXNRLYAVOBCHB-WCBMZHEXSA-N 1 2 221.304 2.027 20 0 BEADLO COCc1nc(C[NH+]2CCCCC2)cs1 ZINC000336651530 386266165 /nfs/dbraw/zinc/26/61/65/386266165.db2.gz VKBQWHABMIKROZ-UHFFFAOYSA-N 1 2 226.345 2.275 20 0 BEADLO Cc1nnc(C[N@@H+](C)[C@@H](C)c2cccc(O)c2)o1 ZINC000264732090 386267629 /nfs/dbraw/zinc/26/76/29/386267629.db2.gz RFOOBTUBHUOKEG-VIFPVBQESA-N 1 2 247.298 2.277 20 0 BEADLO Cc1nnc(C[N@H+](C)[C@@H](C)c2cccc(O)c2)o1 ZINC000264732090 386267632 /nfs/dbraw/zinc/26/76/32/386267632.db2.gz RFOOBTUBHUOKEG-VIFPVBQESA-N 1 2 247.298 2.277 20 0 BEADLO c1cc(C[NH+]2Cc3ccccc3C2)on1 ZINC000264724415 386268040 /nfs/dbraw/zinc/26/80/40/386268040.db2.gz PRLBYPLGACRSPN-UHFFFAOYSA-N 1 2 200.241 2.190 20 0 BEADLO CC[C@H]([NH2+][C@H](C)c1cn(C)nc1C)C(F)F ZINC000453245723 386273831 /nfs/dbraw/zinc/27/38/31/386273831.db2.gz LVENWIGGYWNNMM-XCBNKYQSSA-N 1 2 231.290 2.423 20 0 BEADLO CCc1ncc(C[N@H+](C)Cc2cccn2C)cn1 ZINC000414394378 386274497 /nfs/dbraw/zinc/27/44/97/386274497.db2.gz IGPINZJZWSTULF-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO CCc1ncc(C[N@@H+](C)Cc2cccn2C)cn1 ZINC000414394378 386274501 /nfs/dbraw/zinc/27/45/01/386274501.db2.gz IGPINZJZWSTULF-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO COCc1nc(C[N@H+](C)CCSC)cs1 ZINC000336644358 386276370 /nfs/dbraw/zinc/27/63/70/386276370.db2.gz GCNNZGLZICZZQB-UHFFFAOYSA-N 1 2 246.401 2.084 20 0 BEADLO COCc1nc(C[N@@H+](C)CCSC)cs1 ZINC000336644358 386276378 /nfs/dbraw/zinc/27/63/78/386276378.db2.gz GCNNZGLZICZZQB-UHFFFAOYSA-N 1 2 246.401 2.084 20 0 BEADLO FC(F)(F)Cc1noc(C[NH+]2CCCCC2)n1 ZINC000336675988 386324133 /nfs/dbraw/zinc/32/41/33/386324133.db2.gz AKLMUSOHTPEZNK-UHFFFAOYSA-N 1 2 249.236 2.160 20 0 BEADLO C[C@@H]1[C@@H](C)[S@@](=O)CC[N@@H+]1Cc1ccccc1 ZINC000265492426 386343306 /nfs/dbraw/zinc/34/33/06/386343306.db2.gz CQQXJFSNNKJUHY-HSMVNMDESA-N 1 2 237.368 2.028 20 0 BEADLO C[C@@H]1[C@@H](C)[S@@](=O)CC[N@H+]1Cc1ccccc1 ZINC000265492426 386343310 /nfs/dbraw/zinc/34/33/10/386343310.db2.gz CQQXJFSNNKJUHY-HSMVNMDESA-N 1 2 237.368 2.028 20 0 BEADLO C[C@@H]1[C@H](C)[S@@](=O)CC[N@@H+]1Cc1ccccc1 ZINC000265492424 386344482 /nfs/dbraw/zinc/34/44/82/386344482.db2.gz CQQXJFSNNKJUHY-WQGACYEGSA-N 1 2 237.368 2.028 20 0 BEADLO C[C@@H]1[C@H](C)[S@@](=O)CC[N@H+]1Cc1ccccc1 ZINC000265492424 386344488 /nfs/dbraw/zinc/34/44/88/386344488.db2.gz CQQXJFSNNKJUHY-WQGACYEGSA-N 1 2 237.368 2.028 20 0 BEADLO CN(CC1CCCC1)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000276574931 386346275 /nfs/dbraw/zinc/34/62/75/386346275.db2.gz KXCBJUGYBWUKLK-VOTSOKGWSA-N 1 2 233.315 2.072 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)[C@H]1C[C@H]1C1CC1 ZINC000334492570 386354245 /nfs/dbraw/zinc/35/42/45/386354245.db2.gz ONUKLYDXLCMYDA-QWRGUYRKSA-N 1 2 241.294 2.319 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2ncnn2C)cc1F ZINC000276678774 386362248 /nfs/dbraw/zinc/36/22/48/386362248.db2.gz LKNIPKOJNBDIRS-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO C[C@H]([NH2+][C@H](c1nnc[nH]1)c1ccccc1)C1CC1 ZINC000276702616 386364866 /nfs/dbraw/zinc/36/48/66/386364866.db2.gz BPJTYKBPZILBKZ-GWCFXTLKSA-N 1 2 242.326 2.282 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)NC1CCCCCC1 ZINC000276691903 386365142 /nfs/dbraw/zinc/36/51/42/386365142.db2.gz QGCIGESAMMGSRP-BQYQJAHWSA-N 1 2 233.315 2.262 20 0 BEADLO CCOc1nnc(C[N@H+](C)CC2CCC2)s1 ZINC000336699986 386387019 /nfs/dbraw/zinc/38/70/19/386387019.db2.gz JZFKYYNYQMECDZ-UHFFFAOYSA-N 1 2 241.360 2.169 20 0 BEADLO CCOc1nnc(C[N@@H+](C)CC2CCC2)s1 ZINC000336699986 386387023 /nfs/dbraw/zinc/38/70/23/386387023.db2.gz JZFKYYNYQMECDZ-UHFFFAOYSA-N 1 2 241.360 2.169 20 0 BEADLO CC(C)CCOCC[N@H+](C)Cc1ccon1 ZINC000265765050 386367362 /nfs/dbraw/zinc/36/73/62/386367362.db2.gz BNYYMMSGFASDJK-UHFFFAOYSA-N 1 2 226.320 2.169 20 0 BEADLO CC(C)CCOCC[N@@H+](C)Cc1ccon1 ZINC000265765050 386367366 /nfs/dbraw/zinc/36/73/66/386367366.db2.gz BNYYMMSGFASDJK-UHFFFAOYSA-N 1 2 226.320 2.169 20 0 BEADLO Cn1ccc(C[NH2+]C2(c3cccc(F)c3)CC2)n1 ZINC000265782365 386369476 /nfs/dbraw/zinc/36/94/76/386369476.db2.gz OTSLWHNCIJTDRZ-UHFFFAOYSA-N 1 2 245.301 2.338 20 0 BEADLO CC[C@H]1CCC[C@@H](NC(=O)CCn2cc[nH+]c2)C1 ZINC000265826983 386375091 /nfs/dbraw/zinc/37/50/91/386375091.db2.gz VKNDRQYSPRRVDK-QWHCGFSZSA-N 1 2 249.358 2.358 20 0 BEADLO COC[C@H]([NH2+]Cc1coc(C)n1)c1ccccc1 ZINC000647970438 386377809 /nfs/dbraw/zinc/37/78/09/386377809.db2.gz QKEOVBSUABMTPB-AWEZNQCLSA-N 1 2 246.310 2.460 20 0 BEADLO C[NH+](C)Cc1nc([C@@H]2CCC(F)(F)C2)no1 ZINC000334496477 386381134 /nfs/dbraw/zinc/38/11/34/386381134.db2.gz KCYGMBQPVHNGMJ-SSDOTTSWSA-N 1 2 231.246 2.034 20 0 BEADLO CCCC[C@H](C(=O)OC)[N@@H+]1CC[C@@](C)(F)C1 ZINC000347395933 386382549 /nfs/dbraw/zinc/38/25/49/386382549.db2.gz XJAUIVZTLWZQAQ-ZYHUDNBSSA-N 1 2 231.311 2.152 20 0 BEADLO CCCC[C@H](C(=O)OC)[N@H+]1CC[C@@](C)(F)C1 ZINC000347395933 386382552 /nfs/dbraw/zinc/38/25/52/386382552.db2.gz XJAUIVZTLWZQAQ-ZYHUDNBSSA-N 1 2 231.311 2.152 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)CC1CCOCC1 ZINC000265321817 386328165 /nfs/dbraw/zinc/32/81/65/386328165.db2.gz VQTOAIOOZPKERK-UHFFFAOYSA-N 1 2 248.326 2.399 20 0 BEADLO Cc1cn2cc(NC(=O)c3ccc[nH]3)ccc2[nH+]1 ZINC000339268692 386333312 /nfs/dbraw/zinc/33/33/12/386333312.db2.gz CCXWSMPCQSMOAL-UHFFFAOYSA-N 1 2 240.266 2.223 20 0 BEADLO COC(=O)[C@H]([NH2+]CCc1ccc(C)cc1)C1CC1 ZINC000276491835 386333524 /nfs/dbraw/zinc/33/35/24/386333524.db2.gz VNWAILKZVFSPEJ-CQSZACIVSA-N 1 2 247.338 2.079 20 0 BEADLO CO[C@H](C)CCNc1cc(C)[nH+]c(C2CC2)n1 ZINC000265387398 386333639 /nfs/dbraw/zinc/33/36/39/386333639.db2.gz SOVWKWMOVOFMFR-SNVBAGLBSA-N 1 2 235.331 2.499 20 0 BEADLO CC(C)c1nc(NC[C@@H]2C[C@@H]2C)cc[nH+]1 ZINC000336773772 386334468 /nfs/dbraw/zinc/33/44/68/386334468.db2.gz ZCPUOJGCNGWLKE-UWVGGRQHSA-N 1 2 205.305 2.090 20 0 BEADLO CCCCN(C(=O)C=Cc1c[nH]c[nH+]1)C1CC1 ZINC000276506520 386334830 /nfs/dbraw/zinc/33/48/30/386334830.db2.gz AJTQXXYAIRBIPT-QPJJXVBHSA-N 1 2 233.315 2.214 20 0 BEADLO CCn1cc(C[NH2+]Cc2cc(C3CC3)no2)cn1 ZINC000638660788 386338440 /nfs/dbraw/zinc/33/84/40/386338440.db2.gz VHMMAQZHHGQRIZ-UHFFFAOYSA-N 1 2 246.314 2.058 20 0 BEADLO CC[C@@H](C)C[C@@H](C)NC(=O)c1c[nH+]c(C)[nH]1 ZINC000266470829 386438788 /nfs/dbraw/zinc/43/87/88/386438788.db2.gz JDQDBKRNTMZNQZ-RKDXNWHRSA-N 1 2 223.320 2.273 20 0 BEADLO Cc1c[nH]nc1C[NH+]1Cc2ccccc2C1 ZINC000290488131 386441634 /nfs/dbraw/zinc/44/16/34/386441634.db2.gz RKWRDRBKWRLDIZ-UHFFFAOYSA-N 1 2 213.284 2.234 20 0 BEADLO COC(=O)[C@H](C)[NH2+]C[C@H](C)c1ccc(F)cc1 ZINC000266502811 386442407 /nfs/dbraw/zinc/44/24/07/386442407.db2.gz VVPNQQWOXPHYHZ-UWVGGRQHSA-N 1 2 239.290 2.080 20 0 BEADLO Cc1cnc(C[NH2+]Cc2cnc(C)cc2C)o1 ZINC000639240235 386388079 /nfs/dbraw/zinc/38/80/79/386388079.db2.gz SXAHQJLMHLCZET-UHFFFAOYSA-N 1 2 231.299 2.285 20 0 BEADLO CC(C)n1ccnc1SCc1[nH+]ccn1C ZINC000299026933 386404488 /nfs/dbraw/zinc/40/44/88/386404488.db2.gz HZGPSLIBJOSPTE-UHFFFAOYSA-N 1 2 236.344 2.490 20 0 BEADLO Cc1occc1C[NH2+][C@H](C)c1ccon1 ZINC000414428261 386412631 /nfs/dbraw/zinc/41/26/31/386412631.db2.gz GNTMWHFTGJWSNB-MRVPVSSYSA-N 1 2 206.245 2.427 20 0 BEADLO Cc1cc(NC(=O)N2C[C@H](C)[C@@H](C)[C@@H]2C)cc[nH+]1 ZINC000416947584 386420319 /nfs/dbraw/zinc/42/03/19/386420319.db2.gz JFHBCBODMWTBAE-WCQGTBRESA-N 1 2 247.342 2.320 20 0 BEADLO Cc1cnc(C[N@@H+](C)[C@@H](C)c2cccnc2)cn1 ZINC000336710469 386424866 /nfs/dbraw/zinc/42/48/66/386424866.db2.gz MXRCCEPDBFPYKX-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cnc(C[N@H+](C)[C@@H](C)c2cccnc2)cn1 ZINC000336710469 386424869 /nfs/dbraw/zinc/42/48/69/386424869.db2.gz MXRCCEPDBFPYKX-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO O=C(CC1CCC1)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000266316220 386425624 /nfs/dbraw/zinc/42/56/24/386425624.db2.gz VKFXLCCHWRDHBK-LBPRGKRZSA-N 1 2 247.342 2.306 20 0 BEADLO Cc1cn[nH]c1C[N@@H+](C)Cc1cccc(F)c1 ZINC000290368175 386425812 /nfs/dbraw/zinc/42/58/12/386425812.db2.gz HLOAKLSAMNWROQ-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1cn[nH]c1C[N@H+](C)Cc1cccc(F)c1 ZINC000290368175 386425815 /nfs/dbraw/zinc/42/58/15/386425815.db2.gz HLOAKLSAMNWROQ-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1c[nH]nc1C[N@@H+](C)Cc1cccc(F)c1 ZINC000290368175 386425823 /nfs/dbraw/zinc/42/58/23/386425823.db2.gz HLOAKLSAMNWROQ-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1c[nH]nc1C[N@H+](C)Cc1cccc(F)c1 ZINC000290368175 386425829 /nfs/dbraw/zinc/42/58/29/386425829.db2.gz HLOAKLSAMNWROQ-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO c1cncc(C[N@H+](Cc2cncnc2)C2CC2)c1 ZINC000290385685 386425999 /nfs/dbraw/zinc/42/59/99/386425999.db2.gz IKZYAUKVMDTJQB-UHFFFAOYSA-N 1 2 240.310 2.036 20 0 BEADLO c1cncc(C[N@@H+](Cc2cncnc2)C2CC2)c1 ZINC000290385685 386426004 /nfs/dbraw/zinc/42/60/04/386426004.db2.gz IKZYAUKVMDTJQB-UHFFFAOYSA-N 1 2 240.310 2.036 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H](C)C(C)(F)F ZINC000340338851 386426651 /nfs/dbraw/zinc/42/66/51/386426651.db2.gz IMRFZCDEEPPNGG-MRVPVSSYSA-N 1 2 242.269 2.296 20 0 BEADLO Cc1cc(N[C@H]2CCS[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000645402078 386426789 /nfs/dbraw/zinc/42/67/89/386426789.db2.gz NPDOOGXEOWCPRS-KOLCDFICSA-N 1 2 249.383 2.390 20 0 BEADLO Cc1cnc(C[N@@H+](C)[C@H](C)c2cccnc2)cn1 ZINC000336710467 386427013 /nfs/dbraw/zinc/42/70/13/386427013.db2.gz MXRCCEPDBFPYKX-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cnc(C[N@H+](C)[C@H](C)c2cccnc2)cn1 ZINC000336710467 386427015 /nfs/dbraw/zinc/42/70/15/386427015.db2.gz MXRCCEPDBFPYKX-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H]1C[C@H]1C1CC1 ZINC000340339400 386434970 /nfs/dbraw/zinc/43/49/70/386434970.db2.gz JIAAJBSDLQBZNL-RYUDHWBXSA-N 1 2 230.311 2.051 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H]1CCCS1 ZINC000266435453 386436169 /nfs/dbraw/zinc/43/61/69/386436169.db2.gz JWSMGIVNCSUPRX-SNVBAGLBSA-N 1 2 222.313 2.224 20 0 BEADLO CC[C@@H](CNc1cc[nH+]c2ccncc12)OC ZINC000290697711 386468363 /nfs/dbraw/zinc/46/83/63/386468363.db2.gz NCFKIGIQBZOCJA-JTQLQIEISA-N 1 2 231.299 2.467 20 0 BEADLO COCc1nc(C[N@@H+]2C[C@@H](C)[C@H]2C)cs1 ZINC000339574024 386471908 /nfs/dbraw/zinc/47/19/08/386471908.db2.gz OWDHOJXPDSVHOZ-RKDXNWHRSA-N 1 2 226.345 2.130 20 0 BEADLO COCc1nc(C[N@H+]2C[C@@H](C)[C@H]2C)cs1 ZINC000339574024 386471912 /nfs/dbraw/zinc/47/19/12/386471912.db2.gz OWDHOJXPDSVHOZ-RKDXNWHRSA-N 1 2 226.345 2.130 20 0 BEADLO CC[C@@H](COC)Nc1cc[nH+]c2ccncc12 ZINC000290758940 386472407 /nfs/dbraw/zinc/47/24/07/386472407.db2.gz JVMAUYNMXLXSFS-JTQLQIEISA-N 1 2 231.299 2.467 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2C[C@H](C)[C@@H]2C)s1 ZINC000339579277 386472413 /nfs/dbraw/zinc/47/24/13/386472413.db2.gz BLGZSECZOYHFCW-FXQIFTODSA-N 1 2 211.334 2.248 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2C[C@H](C)[C@@H]2C)s1 ZINC000339579277 386472418 /nfs/dbraw/zinc/47/24/18/386472418.db2.gz BLGZSECZOYHFCW-FXQIFTODSA-N 1 2 211.334 2.248 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2C[C@H](C)[C@H]2C)s1 ZINC000339579279 386473559 /nfs/dbraw/zinc/47/35/59/386473559.db2.gz BLGZSECZOYHFCW-RNJXMRFFSA-N 1 2 211.334 2.248 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2C[C@H](C)[C@H]2C)s1 ZINC000339579279 386473566 /nfs/dbraw/zinc/47/35/66/386473566.db2.gz BLGZSECZOYHFCW-RNJXMRFFSA-N 1 2 211.334 2.248 20 0 BEADLO Cc1cc(N2C[C@H](O)CC[C@@H]2C)nc(C(C)C)[nH+]1 ZINC000399268019 386473698 /nfs/dbraw/zinc/47/36/98/386473698.db2.gz SMRFCNWIWROLCO-NWDGAFQWSA-N 1 2 249.358 2.258 20 0 BEADLO CC1(CO)CN(c2[nH+]ccc3cc(F)ccc32)C1 ZINC000335365396 386476451 /nfs/dbraw/zinc/47/64/51/386476451.db2.gz PWYZGWGXIXLNFB-UHFFFAOYSA-N 1 2 246.285 2.193 20 0 BEADLO CC[C@H](CNc1cc(C)[nH+]c(C2CC2)n1)OC ZINC000290782020 386476687 /nfs/dbraw/zinc/47/66/87/386476687.db2.gz WLRGXDZVYYSMBG-LLVKDONJSA-N 1 2 235.331 2.499 20 0 BEADLO CC[C@@H](CCO)Nc1cc(C)[nH+]c(C(C)C)n1 ZINC000134964549 386476946 /nfs/dbraw/zinc/47/69/46/386476946.db2.gz MYUNYQYNZKDOLI-NSHDSACASA-N 1 2 237.347 2.481 20 0 BEADLO C[C@@H](C1CC1)N(C(=O)CCn1cc[nH+]c1)C1CC1 ZINC000299650706 386477171 /nfs/dbraw/zinc/47/71/71/386477171.db2.gz XGFFYYMYDONVFB-NSHDSACASA-N 1 2 247.342 2.063 20 0 BEADLO Nc1ccc(NC(=O)CC2CCCC2)c[nH+]1 ZINC000061680491 386479793 /nfs/dbraw/zinc/47/97/93/386479793.db2.gz MPQFJYZIBSHWJT-UHFFFAOYSA-N 1 2 219.288 2.183 20 0 BEADLO C[C@H](C[NH2+][C@@]1(C)CCOC1=O)Cc1ccccc1 ZINC000290864119 386483048 /nfs/dbraw/zinc/48/30/48/386483048.db2.gz JVRVBYHLXFREHF-WFASDCNBSA-N 1 2 247.338 2.160 20 0 BEADLO Cc1cnn([C@H]2CCN(c3cccc[nH+]3)C2)c1 ZINC000290891334 386487241 /nfs/dbraw/zinc/48/72/41/386487241.db2.gz UCAATBDQNPPIDY-LBPRGKRZSA-N 1 2 228.299 2.038 20 0 BEADLO COCc1cnc(C[NH2+][C@H]2CCC[C@@H]2F)s1 ZINC000339584381 386488193 /nfs/dbraw/zinc/48/81/93/386488193.db2.gz MANHUQQOZOJQEM-UWVGGRQHSA-N 1 2 244.335 2.270 20 0 BEADLO Clc1cnn([C@H]2CCN(c3cccc[nH+]3)C2)c1 ZINC000290935610 386488429 /nfs/dbraw/zinc/48/84/29/386488429.db2.gz ZLKIGLQTMNRUIU-NSHDSACASA-N 1 2 248.717 2.383 20 0 BEADLO Cc1nc(C[NH2+][C@@H](C)c2cnn(C)c2C)oc1C ZINC000183382252 386497249 /nfs/dbraw/zinc/49/72/49/386497249.db2.gz CIICNKDUPYPDBA-VIFPVBQESA-N 1 2 248.330 2.184 20 0 BEADLO Cc1nc(C[NH2+][C@H](C)c2cnn(C)c2C)oc1C ZINC000183382272 386497313 /nfs/dbraw/zinc/49/73/13/386497313.db2.gz CIICNKDUPYPDBA-SECBINFHSA-N 1 2 248.330 2.184 20 0 BEADLO CO[C@@H](C)c1noc(C[N@H+](C)CC=C(C)C)n1 ZINC000267118015 386497167 /nfs/dbraw/zinc/49/71/67/386497167.db2.gz SSCBALKARYRAFL-JTQLQIEISA-N 1 2 239.319 2.175 20 0 BEADLO CO[C@@H](C)c1noc(C[N@@H+](C)CC=C(C)C)n1 ZINC000267118015 386497173 /nfs/dbraw/zinc/49/71/73/386497173.db2.gz SSCBALKARYRAFL-JTQLQIEISA-N 1 2 239.319 2.175 20 0 BEADLO C[C@@H](C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1)C1CC1 ZINC000267128018 386497369 /nfs/dbraw/zinc/49/73/69/386497369.db2.gz LDYMQNACSAABJU-PWSUYJOCSA-N 1 2 247.342 2.162 20 0 BEADLO COc1cc(C[N@@H+]2CCOC[C@H]2C)ccc1C ZINC000278307229 386510217 /nfs/dbraw/zinc/51/02/17/386510217.db2.gz WKFBBLLCSJWLCL-GFCCVEGCSA-N 1 2 235.327 2.224 20 0 BEADLO COc1cc(C[N@H+]2CCOC[C@H]2C)ccc1C ZINC000278307229 386510220 /nfs/dbraw/zinc/51/02/20/386510220.db2.gz WKFBBLLCSJWLCL-GFCCVEGCSA-N 1 2 235.327 2.224 20 0 BEADLO Cc1[nH+]c2ccc(C(=O)N(C)C3CC3)cc2n1C ZINC000335445216 386510204 /nfs/dbraw/zinc/51/02/04/386510204.db2.gz OQRFAPNVQSYGEG-UHFFFAOYSA-N 1 2 243.310 2.116 20 0 BEADLO c1cc2[nH+]ccc(NC[C@H]3CCCS3)c2cn1 ZINC000335447551 386515698 /nfs/dbraw/zinc/51/56/98/386515698.db2.gz RDHFDXATGDDXNV-SNVBAGLBSA-N 1 2 245.351 2.359 20 0 BEADLO CCC1(C(=O)Nc2c[nH+]ccc2OC)CC1 ZINC000267255741 386518961 /nfs/dbraw/zinc/51/89/61/386518961.db2.gz MKZRXCMWDPIUNT-UHFFFAOYSA-N 1 2 220.272 2.219 20 0 BEADLO CCCCC(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000299524785 386461986 /nfs/dbraw/zinc/46/19/86/386461986.db2.gz LUPCDULKCOGNNG-UHFFFAOYSA-N 1 2 235.331 2.237 20 0 BEADLO COCCc1cccc(OCc2c[nH+]cn2C)c1 ZINC000278751087 386578271 /nfs/dbraw/zinc/57/82/71/386578271.db2.gz PWTCHCLHSBMOOI-UHFFFAOYSA-N 1 2 246.310 2.188 20 0 BEADLO Cc1ccccc1C[C@@H](C)[NH2+]CC(F)(F)CN ZINC000414921613 386578559 /nfs/dbraw/zinc/57/85/59/386578559.db2.gz AVNWFIBJWOXSOB-LLVKDONJSA-N 1 2 242.313 2.110 20 0 BEADLO CCCCC[C@@H](C)NC(=O)Cc1[nH+]c[nH]c1C ZINC000278790582 386584206 /nfs/dbraw/zinc/58/42/06/386584206.db2.gz YLXHRVLXLIXQPY-SNVBAGLBSA-N 1 2 237.347 2.346 20 0 BEADLO Cn1c[nH+]cc1Cc1noc(CCCC2CC2)n1 ZINC000643359203 386595822 /nfs/dbraw/zinc/59/58/22/386595822.db2.gz FBFMKFGZLZLYHS-UHFFFAOYSA-N 1 2 246.314 2.127 20 0 BEADLO Cn1cc(Cl)c(C[N@H+](C)C(C)(C)C)n1 ZINC000335456499 386533077 /nfs/dbraw/zinc/53/30/77/386533077.db2.gz RYURWDKNQIBYOE-UHFFFAOYSA-N 1 2 215.728 2.304 20 0 BEADLO Cn1cc(Cl)c(C[N@@H+](C)C(C)(C)C)n1 ZINC000335456499 386533083 /nfs/dbraw/zinc/53/30/83/386533083.db2.gz RYURWDKNQIBYOE-UHFFFAOYSA-N 1 2 215.728 2.304 20 0 BEADLO CO[C@H]1CCN(c2cc(C(F)(F)F)cc[nH+]2)C1 ZINC000238920736 386538769 /nfs/dbraw/zinc/53/87/69/386538769.db2.gz TUYQEXUJGYGFII-VIFPVBQESA-N 1 2 246.232 2.326 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2ccccc2)nc1 ZINC000340664003 386547573 /nfs/dbraw/zinc/54/75/73/386547573.db2.gz VROHDGCYPZJRAG-UHFFFAOYSA-N 1 2 227.311 2.417 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2ccccc2)nc1 ZINC000340664003 386547577 /nfs/dbraw/zinc/54/75/77/386547577.db2.gz VROHDGCYPZJRAG-UHFFFAOYSA-N 1 2 227.311 2.417 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H]2CCCC2(C)C)c[nH+]1 ZINC000267509293 386548091 /nfs/dbraw/zinc/54/80/91/386548091.db2.gz IFPZUVMPVBPPFI-JTQLQIEISA-N 1 2 221.304 2.027 20 0 BEADLO CCc1ccc(C[N@@H+]2CC[C@@H](F)C2)nc1 ZINC000335467184 386555353 /nfs/dbraw/zinc/55/53/53/386555353.db2.gz AYZYSPKCTYQSOE-LLVKDONJSA-N 1 2 208.280 2.188 20 0 BEADLO CCc1ccc(C[N@H+]2CC[C@@H](F)C2)nc1 ZINC000335467184 386555358 /nfs/dbraw/zinc/55/53/58/386555358.db2.gz AYZYSPKCTYQSOE-LLVKDONJSA-N 1 2 208.280 2.188 20 0 BEADLO CCc1nc(C)c(C[N@@H+]2CC[C@H](F)C2)o1 ZINC000335467625 386556602 /nfs/dbraw/zinc/55/66/02/386556602.db2.gz YZBCBNZMLWTPAT-VIFPVBQESA-N 1 2 212.268 2.089 20 0 BEADLO CCc1nc(C)c(C[N@H+]2CC[C@H](F)C2)o1 ZINC000335467625 386556612 /nfs/dbraw/zinc/55/66/12/386556612.db2.gz YZBCBNZMLWTPAT-VIFPVBQESA-N 1 2 212.268 2.089 20 0 BEADLO Cn1c[nH+]cc1CN1CCc2ccc(F)cc21 ZINC000267586468 386557379 /nfs/dbraw/zinc/55/73/79/386557379.db2.gz HQSUUBKQAQYSHU-UHFFFAOYSA-N 1 2 231.274 2.122 20 0 BEADLO COC1CC(N(C)c2cc[nH+]c(C(C)C)n2)C1 ZINC000343244508 386565195 /nfs/dbraw/zinc/56/51/95/386565195.db2.gz ADAJOZZYBHBYFN-UHFFFAOYSA-N 1 2 235.331 2.214 20 0 BEADLO CC(C)(C)c1ncc(C[N@@H+]2CC[C@H](F)C2)cn1 ZINC000335406717 386566944 /nfs/dbraw/zinc/56/69/44/386566944.db2.gz NDWCIHUNJDGLOK-NSHDSACASA-N 1 2 237.322 2.318 20 0 BEADLO CC(C)(C)c1ncc(C[N@H+]2CC[C@H](F)C2)cn1 ZINC000335406717 386566949 /nfs/dbraw/zinc/56/69/49/386566949.db2.gz NDWCIHUNJDGLOK-NSHDSACASA-N 1 2 237.322 2.318 20 0 BEADLO Cc1ccc2[nH+]c(CN3CC[C@H](F)C3)cn2c1 ZINC000335407814 386568926 /nfs/dbraw/zinc/56/89/26/386568926.db2.gz VTTBZALHMXAMMI-NSHDSACASA-N 1 2 233.290 2.187 20 0 BEADLO Cc1ccc2nc(C[N@@H+]3CC[C@H](F)C3)cn2c1 ZINC000335407814 386568934 /nfs/dbraw/zinc/56/89/34/386568934.db2.gz VTTBZALHMXAMMI-NSHDSACASA-N 1 2 233.290 2.187 20 0 BEADLO Cc1ccc2nc(C[N@H+]3CC[C@H](F)C3)cn2c1 ZINC000335407814 386568940 /nfs/dbraw/zinc/56/89/40/386568940.db2.gz VTTBZALHMXAMMI-NSHDSACASA-N 1 2 233.290 2.187 20 0 BEADLO CC[C@@H]([NH2+]CC(F)(F)CO)c1cccs1 ZINC000184704379 386619352 /nfs/dbraw/zinc/61/93/52/386619352.db2.gz MQCROFPNMQDIFG-MRVPVSSYSA-N 1 2 235.299 2.416 20 0 BEADLO CC[NH+](CC)[C@H](C(=O)OC)c1ccsc1 ZINC000337134046 386620030 /nfs/dbraw/zinc/62/00/30/386620030.db2.gz MPPKCMHLHSBHRX-JTQLQIEISA-N 1 2 227.329 2.304 20 0 BEADLO Cn1cc(Cl)c(C[N@H+](C)[C@H]2CC2(C)C)n1 ZINC000335502190 386630901 /nfs/dbraw/zinc/63/09/01/386630901.db2.gz IQQHRSJSGLXADY-JTQLQIEISA-N 1 2 227.739 2.304 20 0 BEADLO Cn1cc(Cl)c(C[N@@H+](C)[C@H]2CC2(C)C)n1 ZINC000335502190 386630904 /nfs/dbraw/zinc/63/09/04/386630904.db2.gz IQQHRSJSGLXADY-JTQLQIEISA-N 1 2 227.739 2.304 20 0 BEADLO Cc1ccc([S@](=O)Cc2c[nH+]cn2C)cc1 ZINC000268203944 386630973 /nfs/dbraw/zinc/63/09/73/386630973.db2.gz OZFPDFVMIRYKHL-MRXNPFEDSA-N 1 2 234.324 2.036 20 0 BEADLO Cc1ccc([S@@](=O)Cc2c[nH+]cn2C)cc1 ZINC000268203941 386630990 /nfs/dbraw/zinc/63/09/90/386630990.db2.gz OZFPDFVMIRYKHL-INIZCTEOSA-N 1 2 234.324 2.036 20 0 BEADLO Cc1[nH]c(C(=O)NCC2(CC(C)C)CC2)c[nH+]1 ZINC000268305637 386638532 /nfs/dbraw/zinc/63/85/32/386638532.db2.gz XXWGBHDXLBJJTG-UHFFFAOYSA-N 1 2 235.331 2.274 20 0 BEADLO Cc1ccc(C[NH2+][C@@H]2CCCc3cn[nH]c32)nc1 ZINC000329230859 386641292 /nfs/dbraw/zinc/64/12/92/386641292.db2.gz KFXROUGQRJGKDA-CYBMUJFWSA-N 1 2 242.326 2.280 20 0 BEADLO Cc1ccc(C[NH2+][C@@H]2CCCc3c[nH]nc32)nc1 ZINC000329230859 386641297 /nfs/dbraw/zinc/64/12/97/386641297.db2.gz KFXROUGQRJGKDA-CYBMUJFWSA-N 1 2 242.326 2.280 20 0 BEADLO Cc1[nH+]cccc1Cc1noc([C@@]2(C)C[C@@H]2F)n1 ZINC000335509693 386643110 /nfs/dbraw/zinc/64/31/10/386643110.db2.gz GSQFLKDPOXZSNF-GWCFXTLKSA-N 1 2 247.273 2.363 20 0 BEADLO Cc1[nH+]cccc1Cc1noc([C@]2(C)C[C@@H]2F)n1 ZINC000335509695 386643628 /nfs/dbraw/zinc/64/36/28/386643628.db2.gz GSQFLKDPOXZSNF-GXFFZTMASA-N 1 2 247.273 2.363 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@H]1CCC[C@H](C)[C@@H]1C ZINC000279195592 386646921 /nfs/dbraw/zinc/64/69/21/386646921.db2.gz KEXPZUPKNHHOPX-JBLDHEPKSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@@H]1CCC[C@H](C)[C@@H]1C ZINC000279195592 386646927 /nfs/dbraw/zinc/64/69/27/386646927.db2.gz KEXPZUPKNHHOPX-JBLDHEPKSA-N 1 2 249.358 2.202 20 0 BEADLO CC(C)(C)OCCNc1cc[nH+]c(C2CC2)n1 ZINC000520319345 386650138 /nfs/dbraw/zinc/65/01/38/386650138.db2.gz DIZVLJOWPLJBCQ-UHFFFAOYSA-N 1 2 235.331 2.003 20 0 BEADLO c1ccc(N2CCOC[C@H](C3CCC3)C2)[nH+]c1 ZINC000292313402 386650712 /nfs/dbraw/zinc/65/07/12/386650712.db2.gz OIQFXNXBLPORGT-CYBMUJFWSA-N 1 2 232.327 2.335 20 0 BEADLO CC(C)n1nccc1C[NH2+][C@H](C)c1ccon1 ZINC000337202572 386650991 /nfs/dbraw/zinc/65/09/91/386650991.db2.gz GZTVFFCKSRMHRA-SNVBAGLBSA-N 1 2 234.303 2.303 20 0 BEADLO CCO[C@H](CC)C(=O)Nc1c(C)cc[nH+]c1C ZINC000644972850 386651637 /nfs/dbraw/zinc/65/16/37/386651637.db2.gz MIYANNNNBXIABO-LLVKDONJSA-N 1 2 236.315 2.452 20 0 BEADLO CCN(C(=O)CCc1[nH]cc[nH+]1)c1ccccc1 ZINC000279242106 386653673 /nfs/dbraw/zinc/65/36/73/386653673.db2.gz QNYWUWRNCIDYHE-UHFFFAOYSA-N 1 2 243.310 2.395 20 0 BEADLO O=C(C=C1CCC1)N1CCC(n2cc[nH+]c2)CC1 ZINC000267979924 386606379 /nfs/dbraw/zinc/60/63/79/386606379.db2.gz UQZLENYHMAMAEG-UHFFFAOYSA-N 1 2 245.326 2.157 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2cc(C)ncn2)s1 ZINC000291999775 386607211 /nfs/dbraw/zinc/60/72/11/386607211.db2.gz BMZFHMSJGDAJNG-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2cc(C)ncn2)s1 ZINC000291999775 386607219 /nfs/dbraw/zinc/60/72/19/386607219.db2.gz BMZFHMSJGDAJNG-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO CC[C@H]1C[N@H+](Cc2nc(C)cs2)C[C@@H](C)O1 ZINC000268020112 386609592 /nfs/dbraw/zinc/60/95/92/386609592.db2.gz JBMJCKSIGNMADT-MNOVXSKESA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2nc(C)cs2)C[C@@H](C)O1 ZINC000268020112 386609597 /nfs/dbraw/zinc/60/95/97/386609597.db2.gz JBMJCKSIGNMADT-MNOVXSKESA-N 1 2 240.372 2.451 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC[C@@H]2c2cccnc2)o1 ZINC000328688458 386613096 /nfs/dbraw/zinc/61/30/96/386613096.db2.gz ZYSWACNCOASODI-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1nnc(C[N@H+]2CCC[C@@H]2c2cccnc2)o1 ZINC000328688458 386613106 /nfs/dbraw/zinc/61/31/06/386613106.db2.gz ZYSWACNCOASODI-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO Cn1cc(Cl)c(C[N@H+](C)[C@@H]2CCSC2)n1 ZINC000335495159 386615756 /nfs/dbraw/zinc/61/57/56/386615756.db2.gz LRXFRIZWGMNXOS-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO Cn1cc(Cl)c(C[N@@H+](C)[C@@H]2CCSC2)n1 ZINC000335495159 386615760 /nfs/dbraw/zinc/61/57/60/386615760.db2.gz LRXFRIZWGMNXOS-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO Cc1nnsc1C(=O)Nc1c(C)cc[nH+]c1C ZINC000425588528 386660214 /nfs/dbraw/zinc/66/02/14/386660214.db2.gz QJZAGPZQJBUYNB-UHFFFAOYSA-N 1 2 248.311 2.111 20 0 BEADLO Cc1nnc(C[N@H+]2C[C@H](C)[C@H]2c2ccccc2)[nH]1 ZINC000292514644 386682213 /nfs/dbraw/zinc/68/22/13/386682213.db2.gz NPYBTGXYXVWEBH-HZMBPMFUSA-N 1 2 242.326 2.306 20 0 BEADLO Cc1nnc(C[N@@H+]2C[C@H](C)[C@H]2c2ccccc2)[nH]1 ZINC000292514644 386682226 /nfs/dbraw/zinc/68/22/26/386682226.db2.gz NPYBTGXYXVWEBH-HZMBPMFUSA-N 1 2 242.326 2.306 20 0 BEADLO CC1=C(C)C[C@H](C(=O)NCc2[nH+]ccn2C)CC1 ZINC000335532802 386666213 /nfs/dbraw/zinc/66/62/13/386666213.db2.gz CZUMYIRDRHHPRF-GFCCVEGCSA-N 1 2 247.342 2.173 20 0 BEADLO CC[C@@H]1CCN1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000645009922 386666638 /nfs/dbraw/zinc/66/66/38/386666638.db2.gz VYWHQJAXRKDYPA-LLVKDONJSA-N 1 2 244.298 2.351 20 0 BEADLO CC[C@H]1CCN1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000645009923 386667027 /nfs/dbraw/zinc/66/70/27/386667027.db2.gz VYWHQJAXRKDYPA-NSHDSACASA-N 1 2 244.298 2.351 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@]1(C)CCCO1 ZINC000335526580 386670925 /nfs/dbraw/zinc/67/09/25/386670925.db2.gz DRQWIHRMLSNEJU-ZDUSSCGKSA-N 1 2 234.299 2.206 20 0 BEADLO CC[C@H]1CC[N@@H+]1Cc1ncc(Cl)n1C ZINC000292433625 386671944 /nfs/dbraw/zinc/67/19/44/386671944.db2.gz NVJCRCNQWGLKIS-QMMMGPOBSA-N 1 2 213.712 2.058 20 0 BEADLO CC[C@H]1CC[N@H+]1Cc1ncc(Cl)n1C ZINC000292433625 386671949 /nfs/dbraw/zinc/67/19/49/386671949.db2.gz NVJCRCNQWGLKIS-QMMMGPOBSA-N 1 2 213.712 2.058 20 0 BEADLO Cc1cnc(C[NH+]2CCC(OC(C)C)CC2)nc1 ZINC000535556017 386674296 /nfs/dbraw/zinc/67/42/96/386674296.db2.gz IXAMSNZZJFTICP-UHFFFAOYSA-N 1 2 249.358 2.174 20 0 BEADLO Cc1csc2nc(C)nc(-n3cc[nH+]c3)c12 ZINC000120696894 386676252 /nfs/dbraw/zinc/67/62/52/386676252.db2.gz DZZWDLKFESFJCN-UHFFFAOYSA-N 1 2 230.296 2.494 20 0 BEADLO Cc1cnnn1-c1ccc([NH2+]C(C)C)cc1 ZINC000648059254 386677679 /nfs/dbraw/zinc/67/76/79/386677679.db2.gz FFTPPXHZOUZRBZ-UHFFFAOYSA-N 1 2 216.288 2.396 20 0 BEADLO CCCn1ncnc1C[N@H+](C)Cc1ccccc1 ZINC000279399893 386678347 /nfs/dbraw/zinc/67/83/47/386678347.db2.gz IMHXLXPROARLHH-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CCCn1ncnc1C[N@@H+](C)Cc1ccccc1 ZINC000279399893 386678354 /nfs/dbraw/zinc/67/83/54/386678354.db2.gz IMHXLXPROARLHH-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CC[C@@H]([NH2+]C[C@@H]1CCc2ccccc21)C(=O)OC ZINC000192847951 386678878 /nfs/dbraw/zinc/67/88/78/386678878.db2.gz HBFMHUIUURKIHT-GXTWGEPZSA-N 1 2 247.338 2.258 20 0 BEADLO CCn1cc[nH+]c1CN1CC(C)(CC(F)F)C1 ZINC000648058593 386679213 /nfs/dbraw/zinc/67/92/13/386679213.db2.gz SJYSYVVNJCHUMQ-UHFFFAOYSA-N 1 2 243.301 2.380 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1CCO[C@H]1C ZINC000335531149 386680116 /nfs/dbraw/zinc/68/01/16/386680116.db2.gz WDLGSQLXNZBXNW-WDEREUQCSA-N 1 2 234.299 2.062 20 0 BEADLO CC[C@H](C)OCC(=O)Nc1c(C)cc[nH+]c1C ZINC000425586985 386656821 /nfs/dbraw/zinc/65/68/21/386656821.db2.gz MOKNRVDDTMCPHL-JTQLQIEISA-N 1 2 236.315 2.452 20 0 BEADLO CCC1(C(=O)NCc2ccn3cc[nH+]c3c2)CC1 ZINC000268511056 386657474 /nfs/dbraw/zinc/65/74/74/386657474.db2.gz KFTZMGSYKBVKKA-UHFFFAOYSA-N 1 2 243.310 2.141 20 0 BEADLO CC[C@H](Nc1cc[nH+]c(C2CC2)n1)C(C)(C)O ZINC000292688584 386710965 /nfs/dbraw/zinc/71/09/65/386710965.db2.gz FERQGDWDMOFUMS-JTQLQIEISA-N 1 2 235.331 2.315 20 0 BEADLO CC[C@H](O)CCNc1cc[nH+]c2ccncc12 ZINC000268723866 386687615 /nfs/dbraw/zinc/68/76/15/386687615.db2.gz WHAKMXHFSDXNLC-JTQLQIEISA-N 1 2 231.299 2.203 20 0 BEADLO CCc1cc(N[C@@H](C)c2cc[nH]c(=O)c2)nc[nH+]1 ZINC000645046366 386688067 /nfs/dbraw/zinc/68/80/67/386688067.db2.gz XGQKMHYHPMXLNS-VIFPVBQESA-N 1 2 244.298 2.313 20 0 BEADLO CC[C@H]([NH2+][C@@H]1CC12CCCCC2)C(=O)OC ZINC000192862225 386694361 /nfs/dbraw/zinc/69/43/61/386694361.db2.gz VSHHZPFGRQJBSX-WDEREUQCSA-N 1 2 225.332 2.250 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2c(C)noc2C)nn1C ZINC000330381469 386694356 /nfs/dbraw/zinc/69/43/56/386694356.db2.gz NLCYIEULYGONIP-JTQLQIEISA-N 1 2 248.330 2.184 20 0 BEADLO CC(C)[C@H]1CC[C@H](C(=O)NCc2c[nH+]c[nH]2)CC1 ZINC000330389207 386698245 /nfs/dbraw/zinc/69/82/45/386698245.db2.gz DPQZZMOAPUOBMZ-HAQNSBGRSA-N 1 2 249.358 2.488 20 0 BEADLO CC(C)[C@H]1CC[C@H](C(=O)NCc2c[nH]c[nH+]2)CC1 ZINC000330389207 386698255 /nfs/dbraw/zinc/69/82/55/386698255.db2.gz DPQZZMOAPUOBMZ-HAQNSBGRSA-N 1 2 249.358 2.488 20 0 BEADLO CC[C@@H]1C[C@@H](C)CN1C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000520606904 386703824 /nfs/dbraw/zinc/70/38/24/386703824.db2.gz WDSNXNSKTIXXMF-NTZNESFSSA-N 1 2 249.358 2.235 20 0 BEADLO CC[C@@H]1C[C@@H](C)CN1C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000520606904 386703834 /nfs/dbraw/zinc/70/38/34/386703834.db2.gz WDSNXNSKTIXXMF-NTZNESFSSA-N 1 2 249.358 2.235 20 0 BEADLO Cn1c[nH+]cc1CC(=O)N[C@@H]1CCCC(C)(C)C1 ZINC000526944788 386706234 /nfs/dbraw/zinc/70/62/34/386706234.db2.gz YTNAQWNSXISCAT-LLVKDONJSA-N 1 2 249.358 2.048 20 0 BEADLO Cc1ccncc1CNc1cc[nH+]c(C(C)C)n1 ZINC000450794168 386707044 /nfs/dbraw/zinc/70/70/44/386707044.db2.gz JXHRAONMLWQXHI-UHFFFAOYSA-N 1 2 242.326 2.337 20 0 BEADLO COC(=O)[C@H](CC1CC1)[NH2+]Cc1ccc(C)cc1 ZINC000414489255 386708082 /nfs/dbraw/zinc/70/80/82/386708082.db2.gz MTQJWBCSUSIXBA-AWEZNQCLSA-N 1 2 247.338 2.426 20 0 BEADLO COC(=O)[C@@H](CC1CC1)[NH2+]Cc1ccccc1C ZINC000414494177 386731169 /nfs/dbraw/zinc/73/11/69/386731169.db2.gz UYCWIISRIGTPIV-CQSZACIVSA-N 1 2 247.338 2.426 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@H]2C[C@@H]2c2ccccc2)no1 ZINC000268978626 386731252 /nfs/dbraw/zinc/73/12/52/386731252.db2.gz QAEFURQJQKTFLM-OLZOCXBDSA-N 1 2 243.310 2.366 20 0 BEADLO Cc1nc(C[N@H+](C)[C@H]2C[C@@H]2c2ccccc2)no1 ZINC000268978626 386731257 /nfs/dbraw/zinc/73/12/57/386731257.db2.gz QAEFURQJQKTFLM-OLZOCXBDSA-N 1 2 243.310 2.366 20 0 BEADLO CC[C@H]1CC[C@H](C)N1C(=O)CCn1cc[nH+]c1 ZINC000357175323 386731291 /nfs/dbraw/zinc/73/12/91/386731291.db2.gz LTXNTKVOSLGASE-RYUDHWBXSA-N 1 2 235.331 2.063 20 0 BEADLO C[C@@]1(O)CCN(c2[nH+]ccc3cc(F)ccc32)C1 ZINC000335484097 386712825 /nfs/dbraw/zinc/71/28/25/386712825.db2.gz PTFWLEJGPQYLDQ-CQSZACIVSA-N 1 2 246.285 2.335 20 0 BEADLO Cc1csc(C[NH2+][C@H]2CCCc3cn[nH]c32)n1 ZINC000268883760 386714518 /nfs/dbraw/zinc/71/45/18/386714518.db2.gz YJWDXIFFCVWDDO-JTQLQIEISA-N 1 2 248.355 2.342 20 0 BEADLO Cc1csc(C[NH2+][C@H]2CCCc3c[nH]nc32)n1 ZINC000268883760 386714526 /nfs/dbraw/zinc/71/45/26/386714526.db2.gz YJWDXIFFCVWDDO-JTQLQIEISA-N 1 2 248.355 2.342 20 0 BEADLO CN(CC[C@@H]1CCCO1)c1cccc[nH+]1 ZINC000302699654 386717129 /nfs/dbraw/zinc/71/71/29/386717129.db2.gz HWKJOFDYGOYPBY-NSHDSACASA-N 1 2 206.289 2.087 20 0 BEADLO COc1cc(C[NH2+][C@H](C)c2cc(C)on2)ccn1 ZINC000279690868 386719245 /nfs/dbraw/zinc/71/92/45/386719245.db2.gz UKIXHZHLUKDGEC-SNVBAGLBSA-N 1 2 247.298 2.237 20 0 BEADLO CO[C@H](CNc1cc[nH+]c2ccncc12)C1CC1 ZINC000292754149 386721130 /nfs/dbraw/zinc/72/11/30/386721130.db2.gz JUTJNMKCHMARHO-CQSZACIVSA-N 1 2 243.310 2.467 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)C[C@@H]1C[C@H]1c1ccccc1 ZINC000353744311 386722577 /nfs/dbraw/zinc/72/25/77/386722577.db2.gz ZVLKHNKEOCHDED-STQMWFEESA-N 1 2 242.326 2.040 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)C[C@@H]1C[C@H]1c1ccccc1 ZINC000353744311 386722586 /nfs/dbraw/zinc/72/25/86/386722586.db2.gz ZVLKHNKEOCHDED-STQMWFEESA-N 1 2 242.326 2.040 20 0 BEADLO COC(=O)[C@@H](CC1CC1)[NH2+]Cc1ccccc1 ZINC000414492408 386723693 /nfs/dbraw/zinc/72/36/93/386723693.db2.gz RLXATRFOBZWENQ-CYBMUJFWSA-N 1 2 233.311 2.118 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)CC(C)(C)C1CC1 ZINC000292798487 386726501 /nfs/dbraw/zinc/72/65/01/386726501.db2.gz NZXJTORPXVEDNY-UHFFFAOYSA-N 1 2 249.358 2.205 20 0 BEADLO CC(C)c1ncc(C[N@H+](C)CC(N)=O)s1 ZINC000330558830 386769245 /nfs/dbraw/zinc/76/92/45/386769245.db2.gz AIFYEXKJOFNZOW-UHFFFAOYSA-N 1 2 227.333 2.234 20 0 BEADLO CC(C)c1ncc(C[N@@H+](C)CC(N)=O)s1 ZINC000330558830 386769247 /nfs/dbraw/zinc/76/92/47/386769247.db2.gz AIFYEXKJOFNZOW-UHFFFAOYSA-N 1 2 227.333 2.234 20 0 BEADLO CC(C)n1nccc1C[N@H+](C)Cc1ccccn1 ZINC000279901787 386751368 /nfs/dbraw/zinc/75/13/68/386751368.db2.gz LNPLZRPXDLJZIQ-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO CC(C)n1nccc1C[N@@H+](C)Cc1ccccn1 ZINC000279901787 386751371 /nfs/dbraw/zinc/75/13/71/386751371.db2.gz LNPLZRPXDLJZIQ-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)CC1(C)CCCC1 ZINC000348530623 386751724 /nfs/dbraw/zinc/75/17/24/386751724.db2.gz JLINSBMCXKQNST-UHFFFAOYSA-N 1 2 235.331 2.339 20 0 BEADLO Cc1ccc(Cc2nc([C@@H]3C[C@H]3C)no2)c[nH+]1 ZINC000334153007 386752665 /nfs/dbraw/zinc/75/26/65/386752665.db2.gz NEIQMCUEZAWGAF-LDYMZIIASA-N 1 2 229.283 2.487 20 0 BEADLO CCn1c[nH+]cc1CNc1cnn(CC(C)C)c1 ZINC000417951847 386753076 /nfs/dbraw/zinc/75/30/76/386753076.db2.gz MDKVVOOTVGXNEB-UHFFFAOYSA-N 1 2 247.346 2.368 20 0 BEADLO CC(C)(C)c1ccncc1C[NH2+]Cc1ncc[nH]1 ZINC000414502325 386769725 /nfs/dbraw/zinc/76/97/25/386769725.db2.gz UCZFHKOFYDJENV-UHFFFAOYSA-N 1 2 244.342 2.392 20 0 BEADLO CCCC(C)(C)NC(=O)CCc1c[nH+]cn1C ZINC000279932107 386758006 /nfs/dbraw/zinc/75/80/06/386758006.db2.gz YFIMBAUVIUFTNT-UHFFFAOYSA-N 1 2 237.347 2.048 20 0 BEADLO Cc1nc(N2CC(C)(CC(F)F)C2)cc[nH+]1 ZINC000645338583 386766734 /nfs/dbraw/zinc/76/67/34/386766734.db2.gz ZQKNWDPAIBJDSG-UHFFFAOYSA-N 1 2 227.258 2.267 20 0 BEADLO Cc1cc(N2CC(C)(CC(F)F)C2)nc[nH+]1 ZINC000645338129 386767690 /nfs/dbraw/zinc/76/76/90/386767690.db2.gz SNKZFJKLWAQLNL-UHFFFAOYSA-N 1 2 227.258 2.267 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@]3(CC[C@H](C)C3)C2)no1 ZINC000334140555 386741071 /nfs/dbraw/zinc/74/10/71/386741071.db2.gz HFGZVYGXALLNHA-GWCFXTLKSA-N 1 2 235.331 2.390 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@]3(CC[C@H](C)C3)C2)no1 ZINC000334140555 386741080 /nfs/dbraw/zinc/74/10/80/386741080.db2.gz HFGZVYGXALLNHA-GWCFXTLKSA-N 1 2 235.331 2.390 20 0 BEADLO CO[C@H](CNc1cc[nH+]c(C2CC2)n1)C1CC1 ZINC000292875668 386742127 /nfs/dbraw/zinc/74/21/27/386742127.db2.gz UHWFXSIKCMEZTC-LLVKDONJSA-N 1 2 233.315 2.191 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)CCc1ccoc1 ZINC000340874190 386795634 /nfs/dbraw/zinc/79/56/34/386795634.db2.gz DLRAHIROKDFXNF-UHFFFAOYSA-N 1 2 244.294 2.230 20 0 BEADLO Cc1cscc1CNC(=O)CCc1[nH]cc[nH+]1 ZINC000357391737 386772113 /nfs/dbraw/zinc/77/21/13/386772113.db2.gz LZZCZQSPVOCJKD-UHFFFAOYSA-N 1 2 249.339 2.029 20 0 BEADLO CSC1(C[N@H+](C)CC(F)F)CCC1 ZINC000336667195 386778554 /nfs/dbraw/zinc/77/85/54/386778554.db2.gz ZALBYNVSOMWRAG-UHFFFAOYSA-N 1 2 209.305 2.469 20 0 BEADLO CSC1(C[N@@H+](C)CC(F)F)CCC1 ZINC000336667195 386778558 /nfs/dbraw/zinc/77/85/58/386778558.db2.gz ZALBYNVSOMWRAG-UHFFFAOYSA-N 1 2 209.305 2.469 20 0 BEADLO C[C@H](c1ccccc1)[C@H](C)[NH2+]CC(F)(F)CN ZINC000414933423 386783261 /nfs/dbraw/zinc/78/32/61/386783261.db2.gz UDSUBCUZMOAQTQ-QWRGUYRKSA-N 1 2 242.313 2.362 20 0 BEADLO C[C@@]1(O)CCCN(c2cc[nH+]c(C3CC3)n2)CC1 ZINC000280160267 386784262 /nfs/dbraw/zinc/78/42/62/386784262.db2.gz CVJGWUKZYSPBPJ-CQSZACIVSA-N 1 2 247.342 2.095 20 0 BEADLO Cc1nnc(C[N@H+]2CC=C(C(C)(C)C)CC2)[nH]1 ZINC000293176123 386785829 /nfs/dbraw/zinc/78/58/29/386785829.db2.gz NQMRESUDWUUUHG-UHFFFAOYSA-N 1 2 234.347 2.291 20 0 BEADLO Cc1nnc(C[N@@H+]2CC=C(C(C)(C)C)CC2)[nH]1 ZINC000293176123 386785833 /nfs/dbraw/zinc/78/58/33/386785833.db2.gz NQMRESUDWUUUHG-UHFFFAOYSA-N 1 2 234.347 2.291 20 0 BEADLO Cc1cncc(NCc2ccn3cc[nH+]c3c2)n1 ZINC000357477607 386789385 /nfs/dbraw/zinc/78/93/85/386789385.db2.gz BHYHGTHFGTXCBV-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO CSc1ccc([C@H](C)[NH2+]Cc2cnn[nH]2)cc1 ZINC000398422109 386820134 /nfs/dbraw/zinc/82/01/34/386820134.db2.gz ZAAHVNMLLYNSIC-VIFPVBQESA-N 1 2 248.355 2.377 20 0 BEADLO CSc1ccc([C@H](C)[NH2+]Cc2c[nH]nn2)cc1 ZINC000398422109 386820143 /nfs/dbraw/zinc/82/01/43/386820143.db2.gz ZAAHVNMLLYNSIC-VIFPVBQESA-N 1 2 248.355 2.377 20 0 BEADLO CSc1ccc([C@H](C)[NH2+]Cc2cn[nH]n2)cc1 ZINC000398422109 386820149 /nfs/dbraw/zinc/82/01/49/386820149.db2.gz ZAAHVNMLLYNSIC-VIFPVBQESA-N 1 2 248.355 2.377 20 0 BEADLO CC[C@@H](C)N(CCO)c1cc[nH+]c(C(C)C)n1 ZINC000340927365 386803147 /nfs/dbraw/zinc/80/31/47/386803147.db2.gz XQAQIHZQRZKBHB-LLVKDONJSA-N 1 2 237.347 2.197 20 0 BEADLO C[C@H](c1ccccc1)[N@@H+]1CCn2cncc2C1 ZINC000647939104 386804679 /nfs/dbraw/zinc/80/46/79/386804679.db2.gz AZZWOEGGMFOYRA-GFCCVEGCSA-N 1 2 227.311 2.460 20 0 BEADLO C[C@H](c1ccccc1)[N@H+]1CCn2cncc2C1 ZINC000647939104 386804687 /nfs/dbraw/zinc/80/46/87/386804687.db2.gz AZZWOEGGMFOYRA-GFCCVEGCSA-N 1 2 227.311 2.460 20 0 BEADLO C[C@H](c1ccccc1)N1CCn2c[nH+]cc2C1 ZINC000647939104 386804693 /nfs/dbraw/zinc/80/46/93/386804693.db2.gz AZZWOEGGMFOYRA-GFCCVEGCSA-N 1 2 227.311 2.460 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ncnn2-c2ccccc2)[C@H]1C ZINC000293399823 386813063 /nfs/dbraw/zinc/81/30/63/386813063.db2.gz LODXULCKYHAZNN-NEPJUHHUSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ncnn2-c2ccccc2)[C@H]1C ZINC000293399823 386813069 /nfs/dbraw/zinc/81/30/69/386813069.db2.gz LODXULCKYHAZNN-NEPJUHHUSA-N 1 2 242.326 2.108 20 0 BEADLO CC[C@H]1CCCC[C@H]1C(=O)NCCn1cc[nH+]c1 ZINC000280446243 386813430 /nfs/dbraw/zinc/81/34/30/386813430.db2.gz YLIVYWTXGQQHTQ-QWHCGFSZSA-N 1 2 249.358 2.216 20 0 BEADLO CC/C=C/C[NH2+][C@H](CCCC)C(=O)OC ZINC000395047536 386814084 /nfs/dbraw/zinc/81/40/84/386814084.db2.gz LIYQLURCWQODMF-LXSSAFMLSA-N 1 2 213.321 2.274 20 0 BEADLO CC(=O)c1c(F)cccc1NCCn1cc[nH+]c1 ZINC000301062294 386815727 /nfs/dbraw/zinc/81/57/27/386815727.db2.gz GTTDXKNCSIFUCD-UHFFFAOYSA-N 1 2 247.273 2.337 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1[nH]ccc1C1CC1 ZINC000334773528 386825130 /nfs/dbraw/zinc/82/51/30/386825130.db2.gz UMRCLWJCHJPEBC-UHFFFAOYSA-N 1 2 241.294 2.270 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1cncnc1OC ZINC000648005717 386827165 /nfs/dbraw/zinc/82/71/65/386827165.db2.gz BZUGFDUPNSVQEQ-UHFFFAOYSA-N 1 2 247.298 2.100 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1cncnc1OC ZINC000648005717 386827170 /nfs/dbraw/zinc/82/71/70/386827170.db2.gz BZUGFDUPNSVQEQ-UHFFFAOYSA-N 1 2 247.298 2.100 20 0 BEADLO C[C@@H](NC(=O)Nc1ccn2cc[nH+]c2c1)C1CC1 ZINC000280724810 386839837 /nfs/dbraw/zinc/83/98/37/386839837.db2.gz CLOYOGITXSUVLR-SECBINFHSA-N 1 2 244.298 2.254 20 0 BEADLO CO[C@@]1(C)C[C@H](Nc2cc(C)[nH+]cn2)C1(C)C ZINC000301427522 386842491 /nfs/dbraw/zinc/84/24/91/386842491.db2.gz MOFKIAYSUXSSKR-GWCFXTLKSA-N 1 2 235.331 2.401 20 0 BEADLO Cc1nc(N(C)C[C@H]2CCCCO2)c(C)c(C)[nH+]1 ZINC000301423690 386843804 /nfs/dbraw/zinc/84/38/04/386843804.db2.gz AUBQNWMXUHHNOU-CYBMUJFWSA-N 1 2 249.358 2.407 20 0 BEADLO CN(CC(=O)Nc1ccccc1)c1cccc[nH+]1 ZINC000301460048 386846409 /nfs/dbraw/zinc/84/64/09/386846409.db2.gz YPDMLLUSWDPCGT-UHFFFAOYSA-N 1 2 241.294 2.157 20 0 BEADLO CCCC[C@H]([NH2+][C@@H]1CC[C@@H]1SC)C(=O)OC ZINC000425335132 386847832 /nfs/dbraw/zinc/84/78/32/386847832.db2.gz HOPMXLXOTUNOOF-VWYCJHECSA-N 1 2 245.388 2.202 20 0 BEADLO CN(C[C@@H]1CCCO1)c1cc[nH+]c(C(C)(C)C)n1 ZINC000301497585 386848468 /nfs/dbraw/zinc/84/84/68/386848468.db2.gz BUJOCCOLEWSFTQ-NSHDSACASA-N 1 2 249.358 2.389 20 0 BEADLO CC(C)c1nc(N(C)C)nc(NC2(C)CCC2)[nH+]1 ZINC000301914998 386891985 /nfs/dbraw/zinc/89/19/85/386891985.db2.gz DBONNGDQAUULJE-UHFFFAOYSA-N 1 2 249.362 2.416 20 0 BEADLO CC(C)c1nc(NC2(C)CCC2)nc(N(C)C)[nH+]1 ZINC000301914998 386891989 /nfs/dbraw/zinc/89/19/89/386891989.db2.gz DBONNGDQAUULJE-UHFFFAOYSA-N 1 2 249.362 2.416 20 0 BEADLO CC(C)[C@@H](O)CNc1cc[nH+]c(C(C)(C)C)n1 ZINC000301577502 386856036 /nfs/dbraw/zinc/85/60/36/386856036.db2.gz MTGAKTJOSOPCHD-JTQLQIEISA-N 1 2 237.347 2.203 20 0 BEADLO C[C@H](CO)[C@H](C)Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000301556940 386856407 /nfs/dbraw/zinc/85/64/07/386856407.db2.gz HMVPZKMPTURRBG-ZJUUUORDSA-N 1 2 237.347 2.203 20 0 BEADLO Cc1ccc(F)c(C[N@@H+]2CCO[C@H](CF)C2)c1 ZINC000334828576 386865391 /nfs/dbraw/zinc/86/53/91/386865391.db2.gz IRLDLJQBQFMFTE-GFCCVEGCSA-N 1 2 241.281 2.304 20 0 BEADLO Cc1ccc(F)c(C[N@H+]2CCO[C@H](CF)C2)c1 ZINC000334828576 386865397 /nfs/dbraw/zinc/86/53/97/386865397.db2.gz IRLDLJQBQFMFTE-GFCCVEGCSA-N 1 2 241.281 2.304 20 0 BEADLO CC1(C)C[C@@H]1C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000334829161 386866405 /nfs/dbraw/zinc/86/64/05/386866405.db2.gz RIMGQICJISLHFJ-ZJUUUORDSA-N 1 2 233.315 2.119 20 0 BEADLO CC(C)c1nc(N(C)C)nc(N[C@@H](C)C2CC2)[nH+]1 ZINC000301945855 386894503 /nfs/dbraw/zinc/89/45/03/386894503.db2.gz XIEHKODTRFMWCM-VIFPVBQESA-N 1 2 249.362 2.271 20 0 BEADLO CC(C)c1nc(N[C@@H](C)C2CC2)nc(N(C)C)[nH+]1 ZINC000301945855 386894507 /nfs/dbraw/zinc/89/45/07/386894507.db2.gz XIEHKODTRFMWCM-VIFPVBQESA-N 1 2 249.362 2.271 20 0 BEADLO Cn1c[nH+]cc1Cc1noc(CCC(C)(C)C)n1 ZINC000357946031 386870238 /nfs/dbraw/zinc/87/02/38/386870238.db2.gz FPYPCVJTBZGBHX-UHFFFAOYSA-N 1 2 248.330 2.373 20 0 BEADLO CCCC1(c2nc(Cc3c[nH+]cn3C)no2)CC1 ZINC000357946093 386870927 /nfs/dbraw/zinc/87/09/27/386870927.db2.gz FTUAFOMKQXQIGG-UHFFFAOYSA-N 1 2 246.314 2.226 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000293741995 386872027 /nfs/dbraw/zinc/87/20/27/386872027.db2.gz VWOYQMFXCOCLFJ-VIFPVBQESA-N 1 2 245.244 2.325 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000293741995 386872033 /nfs/dbraw/zinc/87/20/33/386872033.db2.gz VWOYQMFXCOCLFJ-VIFPVBQESA-N 1 2 245.244 2.325 20 0 BEADLO C[C@@H]([NH2+][C@@H](c1cccs1)c1nnc[nH]1)C1CC1 ZINC000293757921 386873916 /nfs/dbraw/zinc/87/39/16/386873916.db2.gz ORBLWTQQFLWSMG-KCJUWKMLSA-N 1 2 248.355 2.344 20 0 BEADLO Cc1nc(N2CCC[C@H]2C[C@@H](C)O)c(C)c(C)[nH+]1 ZINC000301771023 386878126 /nfs/dbraw/zinc/87/81/26/386878126.db2.gz KSYHWUFBWQWWBJ-RNCFNFMXSA-N 1 2 249.358 2.142 20 0 BEADLO Cc1cnc(NCc2[nH+]ccn2CC(C)C)nc1 ZINC000301825797 386882677 /nfs/dbraw/zinc/88/26/77/386882677.db2.gz DXBMFRXZFNWOGF-UHFFFAOYSA-N 1 2 245.330 2.250 20 0 BEADLO CC(C)[C@@H](NC(=O)[C@@H](C)C1CC1)c1[nH]cc[nH+]1 ZINC000331703746 386884077 /nfs/dbraw/zinc/88/40/77/386884077.db2.gz XMRVVLHGPPJUCK-GXSJLCMTSA-N 1 2 235.331 2.269 20 0 BEADLO CCN(CC)c1[nH+]cnc2c1cnn2C(C)(C)C ZINC000301858615 386887327 /nfs/dbraw/zinc/88/73/27/386887327.db2.gz CVTQEOQZGOFREF-UHFFFAOYSA-N 1 2 247.346 2.428 20 0 BEADLO C[C@@H]1C[C@H]1Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC000301902052 386889328 /nfs/dbraw/zinc/88/93/28/386889328.db2.gz WCGCJOOUQRBPHV-PSASIEDQSA-N 1 2 245.330 2.402 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@@H](C3CCC3)C2)cn1 ZINC000334861089 386913816 /nfs/dbraw/zinc/91/38/16/386913816.db2.gz BMRORWMGZYMYNV-OAHLLOKOSA-N 1 2 246.354 2.391 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@@H](C3CCC3)C2)cn1 ZINC000334861089 386913820 /nfs/dbraw/zinc/91/38/20/386913820.db2.gz BMRORWMGZYMYNV-OAHLLOKOSA-N 1 2 246.354 2.391 20 0 BEADLO Cn1cncc1CNc1ccc2c(c1)CCC[NH2+]2 ZINC000334861802 386914583 /nfs/dbraw/zinc/91/45/83/386914583.db2.gz HAXGCEIGCQWZLJ-UHFFFAOYSA-N 1 2 242.326 2.390 20 0 BEADLO c1cc(CNc2ccc3c(c2)CCC[NH2+]3)n[nH]1 ZINC000334861307 386915851 /nfs/dbraw/zinc/91/58/51/386915851.db2.gz CRENOHLFSHYBBA-UHFFFAOYSA-N 1 2 228.299 2.380 20 0 BEADLO CC(C)n1ncnc1C[N@@H+]1CCCC2(CC2)C1 ZINC000335764174 386904979 /nfs/dbraw/zinc/90/49/79/386904979.db2.gz MOKGGRDMOZDEFN-UHFFFAOYSA-N 1 2 234.347 2.235 20 0 BEADLO CC(C)n1ncnc1C[N@H+]1CCCC2(CC2)C1 ZINC000335764174 386904982 /nfs/dbraw/zinc/90/49/82/386904982.db2.gz MOKGGRDMOZDEFN-UHFFFAOYSA-N 1 2 234.347 2.235 20 0 BEADLO CC(C)c1nc(NCCC2CCOCC2)cc[nH+]1 ZINC000358191609 386911202 /nfs/dbraw/zinc/91/12/02/386911202.db2.gz KVTZXILIDBHEFF-UHFFFAOYSA-N 1 2 249.358 2.251 20 0 BEADLO c1c(CSc2cccnn2)[nH+]c2ccccn12 ZINC000358264317 386924620 /nfs/dbraw/zinc/92/46/20/386924620.db2.gz OVHQWPBRWWWMBL-UHFFFAOYSA-N 1 2 242.307 2.417 20 0 BEADLO Cc1c[nH+]ccc1CCNc1ncncc1Cl ZINC000302624068 386928775 /nfs/dbraw/zinc/92/87/75/386928775.db2.gz HQDKWDRTMLZHBQ-UHFFFAOYSA-N 1 2 248.717 2.488 20 0 BEADLO CN(CC[C@@H]1CCCO1)c1cc[nH+]c(C2CC2)n1 ZINC000302712522 386932130 /nfs/dbraw/zinc/93/21/30/386932130.db2.gz LSAJKSWETDPDLX-LBPRGKRZSA-N 1 2 247.342 2.359 20 0 BEADLO CCCCC(=O)N[C@H](c1[nH]cc[nH+]1)C(C)C ZINC000331021205 386936141 /nfs/dbraw/zinc/93/61/41/386936141.db2.gz RVWPOJXFEQTWPY-NSHDSACASA-N 1 2 223.320 2.413 20 0 BEADLO Cc1nc(Cl)cc(NCc2ccc(N)[nH+]c2)n1 ZINC000302782959 386936790 /nfs/dbraw/zinc/93/67/90/386936790.db2.gz TUSJPPMTDPXIKF-UHFFFAOYSA-N 1 2 249.705 2.028 20 0 BEADLO CO[C@@H](C(=O)Nc1ccc(C)[nH+]c1C)C(C)C ZINC000330996063 386943264 /nfs/dbraw/zinc/94/32/64/386943264.db2.gz MCOGBQSIZNIEIS-GFCCVEGCSA-N 1 2 236.315 2.308 20 0 BEADLO CCC(CC)[C@H](C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000341697227 386952988 /nfs/dbraw/zinc/95/29/88/386952988.db2.gz SSCSRZOOFGLHQZ-JTQLQIEISA-N 1 2 237.347 2.440 20 0 BEADLO Cc1noc(C[NH2+]C2(c3ccc(F)cc3)CC2)n1 ZINC000341693221 386953229 /nfs/dbraw/zinc/95/32/29/386953229.db2.gz KGKSABMZGCTMSK-UHFFFAOYSA-N 1 2 247.273 2.296 20 0 BEADLO Cn1cc[nH+]c1[C@H](NC(=O)CC1(C)CC1)C1CC1 ZINC000341723960 386955404 /nfs/dbraw/zinc/95/54/04/386955404.db2.gz YJYVSOCJQDCNBN-GFCCVEGCSA-N 1 2 247.342 2.178 20 0 BEADLO Cn1cc[nH+]c1[C@H](NC(=O)CC1CCC1)C1CC1 ZINC000341719347 386955730 /nfs/dbraw/zinc/95/57/30/386955730.db2.gz MTAFJZQUUWBBKR-CYBMUJFWSA-N 1 2 247.342 2.178 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCc2ncccc2C1 ZINC000368335084 386961564 /nfs/dbraw/zinc/96/15/64/386961564.db2.gz XXVAZLMBYHZHKY-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCc2ncccc2C1 ZINC000368335084 386961575 /nfs/dbraw/zinc/96/15/75/386961575.db2.gz XXVAZLMBYHZHKY-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO CO[C@H](C)C[N@H+](Cc1nnc(C)s1)C(C)C ZINC000358494230 386966240 /nfs/dbraw/zinc/96/62/40/386966240.db2.gz BXLIUFVKBLBVOZ-SECBINFHSA-N 1 2 243.376 2.092 20 0 BEADLO CO[C@H](C)C[N@@H+](Cc1nnc(C)s1)C(C)C ZINC000358494230 386966244 /nfs/dbraw/zinc/96/62/44/386966244.db2.gz BXLIUFVKBLBVOZ-SECBINFHSA-N 1 2 243.376 2.092 20 0 BEADLO CC[C@]1(C)C[C@H]1C(=O)Nc1c[nH+]ccc1OC ZINC000126014689 386966501 /nfs/dbraw/zinc/96/65/01/386966501.db2.gz BHDKICMLOHXSIF-TVQRCGJNSA-N 1 2 234.299 2.465 20 0 BEADLO Cc1cc(NCCCCCO)nc(C2CC2)[nH+]1 ZINC000192580549 386967864 /nfs/dbraw/zinc/96/78/64/386967864.db2.gz LTSQNKBGEMPURW-UHFFFAOYSA-N 1 2 235.331 2.237 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CC(C)(C)C[C@@H]1C ZINC000334900656 386975066 /nfs/dbraw/zinc/97/50/66/386975066.db2.gz YRMWYZNUIQWKQM-NSHDSACASA-N 1 2 247.342 2.464 20 0 BEADLO Cc1cc(N2CC(C)=C[C@@H](C)C2)nc[nH+]1 ZINC000334914745 386987904 /nfs/dbraw/zinc/98/79/04/386987904.db2.gz HTYGSMPKKOUQDZ-SECBINFHSA-N 1 2 203.289 2.187 20 0 BEADLO C[C@H]1C[N@H+](Cc2nc(-c3ccoc3)no2)[C@H]1C ZINC000334919067 386995377 /nfs/dbraw/zinc/99/53/77/386995377.db2.gz BFRXJNRCQOUPOQ-IUCAKERBSA-N 1 2 233.271 2.170 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nc(-c3ccoc3)no2)[C@H]1C ZINC000334919067 386995381 /nfs/dbraw/zinc/99/53/81/386995381.db2.gz BFRXJNRCQOUPOQ-IUCAKERBSA-N 1 2 233.271 2.170 20 0 BEADLO CC[C@@H](CSC)[N@H+](C)Cc1nnc(C)s1 ZINC000358743056 387006073 /nfs/dbraw/zinc/00/60/73/387006073.db2.gz JXBOXGOSLWPECU-VIFPVBQESA-N 1 2 245.417 2.420 20 0 BEADLO CC[C@@H](CSC)[N@@H+](C)Cc1nnc(C)s1 ZINC000358743056 387006080 /nfs/dbraw/zinc/00/60/80/387006080.db2.gz JXBOXGOSLWPECU-VIFPVBQESA-N 1 2 245.417 2.420 20 0 BEADLO Cn1cc[nH+]c1[C@H](NC(=O)[C@H]1CC1(C)C)C1CC1 ZINC000341686745 386951003 /nfs/dbraw/zinc/95/10/03/386951003.db2.gz GFKKMOVBXNGTNG-GHMZBOCLSA-N 1 2 247.342 2.034 20 0 BEADLO Cc1ccnc(N[C@@H]2C[C@H](C)n3cc[nH+]c32)n1 ZINC000333760605 387053687 /nfs/dbraw/zinc/05/36/87/387053687.db2.gz ZRMKPOKNXHJLFI-VHSXEESVSA-N 1 2 229.287 2.099 20 0 BEADLO Cc1ccccc1[C@]1(F)CC[N@H+](CC(N)=O)C1 ZINC000334970527 387055033 /nfs/dbraw/zinc/05/50/33/387055033.db2.gz VJVNUBKFXNWULD-ZDUSSCGKSA-N 1 2 236.290 2.401 20 0 BEADLO Cc1ccccc1[C@]1(F)CC[N@@H+](CC(N)=O)C1 ZINC000334970527 387055038 /nfs/dbraw/zinc/05/50/38/387055038.db2.gz VJVNUBKFXNWULD-ZDUSSCGKSA-N 1 2 236.290 2.401 20 0 BEADLO COC(=O)[C@@H]([NH2+]C[C@H](C)c1ccccc1)C1CC1 ZINC000227767554 387057480 /nfs/dbraw/zinc/05/74/80/387057480.db2.gz SDENMVSLCUULOD-FZMZJTMJSA-N 1 2 247.338 2.331 20 0 BEADLO COC(=O)[C@@H]([NH2+]C[C@@H](C)c1ccccc1)C1CC1 ZINC000227767546 387058656 /nfs/dbraw/zinc/05/86/56/387058656.db2.gz SDENMVSLCUULOD-RISCZKNCSA-N 1 2 247.338 2.331 20 0 BEADLO c1nc(CCNc2cccc[nH+]2)cs1 ZINC000070533474 387067431 /nfs/dbraw/zinc/06/74/31/387067431.db2.gz DXMRATLZHXXTMC-UHFFFAOYSA-N 1 2 205.286 2.193 20 0 BEADLO Cc1oncc1NCc1c[nH+]cn1C(C)C ZINC000425366385 387024070 /nfs/dbraw/zinc/02/40/70/387024070.db2.gz ZYDHHSYWOMTHGH-UHFFFAOYSA-N 1 2 220.276 2.373 20 0 BEADLO C[C@@H]1C[C@H]1NC(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000117785154 387028601 /nfs/dbraw/zinc/02/86/01/387028601.db2.gz MJEHCYJLTPRQTJ-ZWNOBZJWSA-N 1 2 241.294 2.011 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1cncc(F)c1)c1nccn1C ZINC000359224649 387069987 /nfs/dbraw/zinc/06/99/87/387069987.db2.gz FKUDHEPXOAHNGR-NXEZZACHSA-N 1 2 248.305 2.366 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1cncc(F)c1)c1nccn1C ZINC000359224651 387070251 /nfs/dbraw/zinc/07/02/51/387070251.db2.gz FKUDHEPXOAHNGR-UWVGGRQHSA-N 1 2 248.305 2.366 20 0 BEADLO CCn1c[nH+]cc1CNc1cccc2c1CCO2 ZINC000418040500 387072613 /nfs/dbraw/zinc/07/26/13/387072613.db2.gz IWOHEQUSLVSCFJ-UHFFFAOYSA-N 1 2 243.310 2.450 20 0 BEADLO CCOC(=O)C[N@@H+]1Cc2ccccc2C2(CC2)C1 ZINC000186199640 387076627 /nfs/dbraw/zinc/07/66/27/387076627.db2.gz ZEHCXBXDICKMMD-UHFFFAOYSA-N 1 2 245.322 2.097 20 0 BEADLO CCOC(=O)C[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000186199640 387076635 /nfs/dbraw/zinc/07/66/35/387076635.db2.gz ZEHCXBXDICKMMD-UHFFFAOYSA-N 1 2 245.322 2.097 20 0 BEADLO CCn1c[nH+]cc1CN1CCC[C@@H]1C(F)F ZINC000418055337 387076797 /nfs/dbraw/zinc/07/67/97/387076797.db2.gz IKTVHEOBWOFWMU-SNVBAGLBSA-N 1 2 229.274 2.133 20 0 BEADLO CCn1cncc1C[N@H+](C)Cc1occc1C ZINC000418063576 387080299 /nfs/dbraw/zinc/08/02/99/387080299.db2.gz HWSDEGLMGQBQEH-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CCn1cncc1C[N@@H+](C)Cc1occc1C ZINC000418063576 387080301 /nfs/dbraw/zinc/08/03/01/387080301.db2.gz HWSDEGLMGQBQEH-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)[C@]1(C)CC=CCC1 ZINC000336245563 387081692 /nfs/dbraw/zinc/08/16/92/387081692.db2.gz PFNMSJOJMGHGLG-CYBMUJFWSA-N 1 2 233.315 2.115 20 0 BEADLO CC[C@H](CO)Nc1cc(C)[nH+]c(C(C)C)n1 ZINC000035121261 387130743 /nfs/dbraw/zinc/13/07/43/387130743.db2.gz UXXRRNCSTRONFD-SNVBAGLBSA-N 1 2 223.320 2.091 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@]1(C)CC1(F)F ZINC000334994428 387083716 /nfs/dbraw/zinc/08/37/16/387083716.db2.gz WUCIMAUVFPNVKJ-LLVKDONJSA-N 1 2 240.253 2.050 20 0 BEADLO Cc1c(Cl)c(C[N@H+](C)C2CCC2)nn1C ZINC000334996078 387087533 /nfs/dbraw/zinc/08/75/33/387087533.db2.gz SUVDZODHYAQUEA-UHFFFAOYSA-N 1 2 227.739 2.366 20 0 BEADLO Cc1c(Cl)c(C[N@@H+](C)C2CCC2)nn1C ZINC000334996078 387087539 /nfs/dbraw/zinc/08/75/39/387087539.db2.gz SUVDZODHYAQUEA-UHFFFAOYSA-N 1 2 227.739 2.366 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@@H](C3CC3)C2)cn1 ZINC000336273648 387106858 /nfs/dbraw/zinc/10/68/58/387106858.db2.gz DVYLSKAALQSWIJ-CQSZACIVSA-N 1 2 232.327 2.001 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@@H](C3CC3)C2)cn1 ZINC000336273648 387106867 /nfs/dbraw/zinc/10/68/67/387106867.db2.gz DVYLSKAALQSWIJ-CQSZACIVSA-N 1 2 232.327 2.001 20 0 BEADLO CC[C@@H](CO)Nc1cc(C)[nH+]c(C(C)C)n1 ZINC000035121260 387131811 /nfs/dbraw/zinc/13/18/11/387131811.db2.gz UXXRRNCSTRONFD-JTQLQIEISA-N 1 2 223.320 2.091 20 0 BEADLO C[C@@H](c1ccco1)[N@H+](C)CC(=O)NC(C)(C)C ZINC000069069564 387112326 /nfs/dbraw/zinc/11/23/26/387112326.db2.gz FIQRBEPHSPRIEP-JTQLQIEISA-N 1 2 238.331 2.187 20 0 BEADLO C[C@@H](c1ccco1)[N@@H+](C)CC(=O)NC(C)(C)C ZINC000069069564 387112333 /nfs/dbraw/zinc/11/23/33/387112333.db2.gz FIQRBEPHSPRIEP-JTQLQIEISA-N 1 2 238.331 2.187 20 0 BEADLO COC[C@H]1CCN(c2cc[nH+]c(C(C)C)n2)C1 ZINC000352365662 387113786 /nfs/dbraw/zinc/11/37/86/387113786.db2.gz VFXQQAHCUCPDBN-NSHDSACASA-N 1 2 235.331 2.073 20 0 BEADLO Cc1ccc(CS[C@H](C)CO)c(C)[nH+]1 ZINC000186624241 387116455 /nfs/dbraw/zinc/11/64/55/387116455.db2.gz LIRRIBPOGWENEW-SECBINFHSA-N 1 2 211.330 2.312 20 0 BEADLO CC[C@H]1CCC[N@H+](Cc2csnn2)C1 ZINC000119316543 387119893 /nfs/dbraw/zinc/11/98/93/387119893.db2.gz KXBPRXRNFRTKHY-VIFPVBQESA-N 1 2 211.334 2.160 20 0 BEADLO CC[C@H]1CCC[N@@H+](Cc2csnn2)C1 ZINC000119316543 387119895 /nfs/dbraw/zinc/11/98/95/387119895.db2.gz KXBPRXRNFRTKHY-VIFPVBQESA-N 1 2 211.334 2.160 20 0 BEADLO Cc1ccc(NC(=O)NCc2[nH]cc[nH+]2)cc1F ZINC000119374586 387122332 /nfs/dbraw/zinc/12/23/32/387122332.db2.gz AVLISBNWCXFHQA-UHFFFAOYSA-N 1 2 248.261 2.179 20 0 BEADLO Cc1ccc(C(C)(C)[NH2+]Cc2c[nH]cn2)cn1 ZINC000353184907 387149834 /nfs/dbraw/zinc/14/98/34/387149834.db2.gz PYGXBSNIYPGMQI-UHFFFAOYSA-N 1 2 230.315 2.138 20 0 BEADLO C[C@H](Cc1ccccc1)C[N@H+](C)Cc1nnc[nH]1 ZINC000187004225 387150900 /nfs/dbraw/zinc/15/09/00/387150900.db2.gz RNMOVEVRQGYWBW-GFCCVEGCSA-N 1 2 244.342 2.115 20 0 BEADLO C[C@H](Cc1ccccc1)C[N@@H+](C)Cc1nnc[nH]1 ZINC000187004225 387150905 /nfs/dbraw/zinc/15/09/05/387150905.db2.gz RNMOVEVRQGYWBW-GFCCVEGCSA-N 1 2 244.342 2.115 20 0 BEADLO c1c2ccccc2[nH]c1C[NH+]1CCOCC1 ZINC000036460065 387151417 /nfs/dbraw/zinc/15/14/17/387151417.db2.gz AQTUTBPTRQEZDU-UHFFFAOYSA-N 1 2 216.284 2.000 20 0 BEADLO CC(C)Cn1ncnc1C[N@@H+]1CCCC2(CC2)C1 ZINC000187009678 387153194 /nfs/dbraw/zinc/15/31/94/387153194.db2.gz VMKQWCWGTYACQQ-UHFFFAOYSA-N 1 2 248.374 2.310 20 0 BEADLO CC(C)Cn1ncnc1C[N@H+]1CCCC2(CC2)C1 ZINC000187009678 387153199 /nfs/dbraw/zinc/15/31/99/387153199.db2.gz VMKQWCWGTYACQQ-UHFFFAOYSA-N 1 2 248.374 2.310 20 0 BEADLO CO[C@H]([C@H](C)Nc1cc[nH+]c(C(C)C)n1)C1CC1 ZINC000450867733 533214449 /nfs/dbraw/zinc/21/44/49/533214449.db2.gz ZTWKYUHJKHYBRB-GXFFZTMASA-N 1 2 249.358 2.247 20 0 BEADLO C(c1nc(C2CC2)no1)[N@@H+]1CCCC2(CC2)C1 ZINC000186994633 387159325 /nfs/dbraw/zinc/15/93/25/387159325.db2.gz LDDZMLHBCUXGFL-UHFFFAOYSA-N 1 2 233.315 2.323 20 0 BEADLO C(c1nc(C2CC2)no1)[N@H+]1CCCC2(CC2)C1 ZINC000186994633 387159331 /nfs/dbraw/zinc/15/93/31/387159331.db2.gz LDDZMLHBCUXGFL-UHFFFAOYSA-N 1 2 233.315 2.323 20 0 BEADLO Cn1ccc(C[N@@H+]2CCC[C@@H]2c2cccnc2)n1 ZINC000336338844 387162986 /nfs/dbraw/zinc/16/29/86/387162986.db2.gz DQXMNOFSGRUNCF-CQSZACIVSA-N 1 2 242.326 2.152 20 0 BEADLO Cn1ccc(C[N@H+]2CCC[C@@H]2c2cccnc2)n1 ZINC000336338844 387162989 /nfs/dbraw/zinc/16/29/89/387162989.db2.gz DQXMNOFSGRUNCF-CQSZACIVSA-N 1 2 242.326 2.152 20 0 BEADLO CC[C@H](C)n1ncc(NCc2[nH]cc[nH+]2)c1C ZINC000359811345 387166857 /nfs/dbraw/zinc/16/68/57/387166857.db2.gz DOBDYLGQZOGGRK-VIFPVBQESA-N 1 2 233.319 2.498 20 0 BEADLO CC(C)c1nc(NCC2(C(F)F)CC2)cc[nH+]1 ZINC000359831266 387172267 /nfs/dbraw/zinc/17/22/67/387172267.db2.gz LOYQSDZUCQFVSA-UHFFFAOYSA-N 1 2 241.285 2.479 20 0 BEADLO CCc1ccc(C[N@@H+]2C[C@H](C)OC[C@H]2C)cn1 ZINC000336346830 387177040 /nfs/dbraw/zinc/17/70/40/387177040.db2.gz YLLGXNOHGQLVJZ-NEPJUHHUSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1ccc(C[N@H+]2C[C@H](C)OC[C@H]2C)cn1 ZINC000336346830 387177045 /nfs/dbraw/zinc/17/70/45/387177045.db2.gz YLLGXNOHGQLVJZ-NEPJUHHUSA-N 1 2 234.343 2.253 20 0 BEADLO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1c[nH]cn1 ZINC000336310540 387138205 /nfs/dbraw/zinc/13/82/05/387138205.db2.gz AXRZLYSWPKVWBW-IONNQARKSA-N 1 2 233.237 2.182 20 0 BEADLO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1c[nH]cn1 ZINC000336310540 387138209 /nfs/dbraw/zinc/13/82/09/387138209.db2.gz AXRZLYSWPKVWBW-IONNQARKSA-N 1 2 233.237 2.182 20 0 BEADLO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cnc[nH]1 ZINC000336310540 387138213 /nfs/dbraw/zinc/13/82/13/387138213.db2.gz AXRZLYSWPKVWBW-IONNQARKSA-N 1 2 233.237 2.182 20 0 BEADLO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cnc[nH]1 ZINC000336310540 387138218 /nfs/dbraw/zinc/13/82/18/387138218.db2.gz AXRZLYSWPKVWBW-IONNQARKSA-N 1 2 233.237 2.182 20 0 BEADLO COC(=O)c1coc(C[NH2+]Cc2occc2C)c1 ZINC000292773449 387138786 /nfs/dbraw/zinc/13/87/86/387138786.db2.gz KSOIAXIOSOCJQB-UHFFFAOYSA-N 1 2 249.266 2.257 20 0 BEADLO CCCc1nc(C[N@H+](C)C2CC(O)C2)cs1 ZINC000353488410 387212935 /nfs/dbraw/zinc/21/29/35/387212935.db2.gz GVFZDLWISKYTBQ-UHFFFAOYSA-N 1 2 240.372 2.051 20 0 BEADLO CCCc1nc(C[N@@H+](C)C2CC(O)C2)cs1 ZINC000353488410 387212940 /nfs/dbraw/zinc/21/29/40/387212940.db2.gz GVFZDLWISKYTBQ-UHFFFAOYSA-N 1 2 240.372 2.051 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@H]2CCC[C@@H]21 ZINC000092485919 387213493 /nfs/dbraw/zinc/21/34/93/387213493.db2.gz XARYWTPZIOIUER-YPMHNXCESA-N 1 2 219.332 2.483 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC000092485919 387213499 /nfs/dbraw/zinc/21/34/99/387213499.db2.gz XARYWTPZIOIUER-YPMHNXCESA-N 1 2 219.332 2.483 20 0 BEADLO CC/C=C(\C)C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000371442437 387213519 /nfs/dbraw/zinc/21/35/19/387213519.db2.gz ILKUQJARDJBABJ-IGLBNKAOSA-N 1 2 233.315 2.430 20 0 BEADLO CC[C@H](F)C[N@@H+]1CCC[C@H]1c1nc(C)no1 ZINC000353549297 387229080 /nfs/dbraw/zinc/22/90/80/387229080.db2.gz JPTPMPZRYFSPDG-UWVGGRQHSA-N 1 2 227.283 2.263 20 0 BEADLO CC[C@H](F)C[N@H+]1CCC[C@H]1c1nc(C)no1 ZINC000353549297 387229083 /nfs/dbraw/zinc/22/90/83/387229083.db2.gz JPTPMPZRYFSPDG-UWVGGRQHSA-N 1 2 227.283 2.263 20 0 BEADLO Cc1cc(C)c(NC(=O)C2CC2)c(C)[nH+]1 ZINC000097039901 387234938 /nfs/dbraw/zinc/23/49/38/387234938.db2.gz ZWDFIJZMUVHHER-UHFFFAOYSA-N 1 2 204.273 2.355 20 0 BEADLO Cn1c[nH+]cc1COc1ccc(F)c(F)c1 ZINC000336405969 387235798 /nfs/dbraw/zinc/23/57/98/387235798.db2.gz HPMJWAXHXLTGJA-UHFFFAOYSA-N 1 2 224.210 2.277 20 0 BEADLO Cc1ccc(C[N@@H+]2C[C@H](F)C[C@H]2CO)cc1F ZINC000336406184 387236189 /nfs/dbraw/zinc/23/61/89/387236189.db2.gz CGYLZIKUVKHARX-NEPJUHHUSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1ccc(C[N@H+]2C[C@H](F)C[C@H]2CO)cc1F ZINC000336406184 387236194 /nfs/dbraw/zinc/23/61/94/387236194.db2.gz CGYLZIKUVKHARX-NEPJUHHUSA-N 1 2 241.281 2.039 20 0 BEADLO CCc1cc(N)nc(SCCCCF)[nH+]1 ZINC000285098068 387250804 /nfs/dbraw/zinc/25/08/04/387250804.db2.gz IJXSZUCGNPTAAT-UHFFFAOYSA-N 1 2 229.324 2.463 20 0 BEADLO Cc1cnn(C)c1CNc1c[nH+]cc(C)c1 ZINC000285174289 387251638 /nfs/dbraw/zinc/25/16/38/387251638.db2.gz QNDMBQUMFIXLAI-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO CCCC[C@H]([NH2+]CC1(SC)CC1)C(=O)OC ZINC000193331286 387201694 /nfs/dbraw/zinc/20/16/94/387201694.db2.gz ZXMORYGOXULSMW-JTQLQIEISA-N 1 2 245.388 2.203 20 0 BEADLO COc1ccc(C[N@@H+]2CCC[C@@H](F)C2)cc1O ZINC000514944349 387311487 /nfs/dbraw/zinc/31/14/87/387311487.db2.gz PQDNMZFQCPGTBX-LLVKDONJSA-N 1 2 239.290 2.335 20 0 BEADLO COc1ccc(C[N@H+]2CCC[C@@H](F)C2)cc1O ZINC000514944349 387311494 /nfs/dbraw/zinc/31/14/94/387311494.db2.gz PQDNMZFQCPGTBX-LLVKDONJSA-N 1 2 239.290 2.335 20 0 BEADLO Clc1ccc(CN2CCn3c[nH+]cc3C2)o1 ZINC000336487632 387316537 /nfs/dbraw/zinc/31/65/37/387316537.db2.gz MXLRHEHSEIBJTH-UHFFFAOYSA-N 1 2 237.690 2.145 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)C[C@H]1C[C@@H]1c1ccccc1 ZINC000353744306 387266662 /nfs/dbraw/zinc/26/66/62/387266662.db2.gz ZVLKHNKEOCHDED-CHWSQXEVSA-N 1 2 242.326 2.040 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)C[C@H]1C[C@@H]1c1ccccc1 ZINC000353744306 387266663 /nfs/dbraw/zinc/26/66/63/387266663.db2.gz ZVLKHNKEOCHDED-CHWSQXEVSA-N 1 2 242.326 2.040 20 0 BEADLO CSc1ccc(NCC2(C)COC2)[nH+]c1 ZINC000285634313 387276287 /nfs/dbraw/zinc/27/62/87/387276287.db2.gz AHYLLXPVRSRIBT-UHFFFAOYSA-N 1 2 224.329 2.252 20 0 BEADLO CC[C@@H](C)C(=O)N1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000120896922 387278959 /nfs/dbraw/zinc/27/89/59/387278959.db2.gz KGWAIDHJWZTTPJ-DGCLKSJQSA-N 1 2 248.326 2.107 20 0 BEADLO C[N@H+](Cc1ccon1)Cc1ccc2c[nH]nc2c1 ZINC000353821514 387279253 /nfs/dbraw/zinc/27/92/53/387279253.db2.gz SPUVZMKRPRDKDD-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO C[N@@H+](Cc1ccon1)Cc1ccc2c[nH]nc2c1 ZINC000353821514 387279258 /nfs/dbraw/zinc/27/92/58/387279258.db2.gz SPUVZMKRPRDKDD-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2cc(C)cc(C)c2)[nH]1 ZINC000353882902 387289274 /nfs/dbraw/zinc/28/92/74/387289274.db2.gz RYDCJQKLSROUEU-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2cc(C)cc(C)c2)[nH]1 ZINC000353882902 387289277 /nfs/dbraw/zinc/28/92/77/387289277.db2.gz RYDCJQKLSROUEU-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO CO[C@@H]1CC[N@H+](Cc2csc(C(C)C)n2)C1 ZINC000353878480 387290428 /nfs/dbraw/zinc/29/04/28/387290428.db2.gz DFQMPPAUGXIHKQ-LLVKDONJSA-N 1 2 240.372 2.487 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2csc(C(C)C)n2)C1 ZINC000353878480 387290435 /nfs/dbraw/zinc/29/04/35/387290435.db2.gz DFQMPPAUGXIHKQ-LLVKDONJSA-N 1 2 240.372 2.487 20 0 BEADLO C[C@H](CC(=O)N(C)CC1CCC1)n1cc[nH+]c1 ZINC000514792305 387292498 /nfs/dbraw/zinc/29/24/98/387292498.db2.gz KVXNXBRVYKOAPA-LLVKDONJSA-N 1 2 235.331 2.093 20 0 BEADLO CCc1ccc(CN2CCn3cc[nH+]c3C2)cc1 ZINC000336471983 387301671 /nfs/dbraw/zinc/30/16/71/387301671.db2.gz MEWJDAIQCISBAA-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO CO[C@@H]1CCC[N@H+](Cc2cnc(Cl)s2)C1 ZINC000079320134 387354386 /nfs/dbraw/zinc/35/43/86/387354386.db2.gz XMDDKSVIFIXRAT-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO CO[C@@H]1CCC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC000079320134 387354391 /nfs/dbraw/zinc/35/43/91/387354391.db2.gz XMDDKSVIFIXRAT-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@H](CC(N)=O)Nc1[nH+]ccc2ccc(F)cc21 ZINC000354327773 387359351 /nfs/dbraw/zinc/35/93/51/387359351.db2.gz KEIDINFUNFWZJT-MRVPVSSYSA-N 1 2 247.273 2.050 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@H]3C[C@H]32)cs1 ZINC000648592439 387364249 /nfs/dbraw/zinc/36/42/49/387364249.db2.gz DXAHJCFBWDNBHK-MNOVXSKESA-N 1 2 209.314 2.030 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@H]3C[C@H]32)cs1 ZINC000648592439 387364252 /nfs/dbraw/zinc/36/42/52/387364252.db2.gz DXAHJCFBWDNBHK-MNOVXSKESA-N 1 2 209.314 2.030 20 0 BEADLO CC(C)[C@H](C)C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000336549418 387371214 /nfs/dbraw/zinc/37/12/14/387371214.db2.gz DLESGNXJFWKMNG-NSHDSACASA-N 1 2 249.358 2.408 20 0 BEADLO CC(C)[C@H](C)C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000336549418 387371219 /nfs/dbraw/zinc/37/12/19/387371219.db2.gz DLESGNXJFWKMNG-NSHDSACASA-N 1 2 249.358 2.408 20 0 BEADLO CC[C@@H]1C[C@@H](Nc2ccc(OC)c[nH+]2)CCO1 ZINC000648481895 387381271 /nfs/dbraw/zinc/38/12/71/387381271.db2.gz QXWLHLJYVQUGAR-WDEREUQCSA-N 1 2 236.315 2.460 20 0 BEADLO Cc1cc(C)c(CNC(=O)NC2(C)CCC2)c[nH+]1 ZINC000514999283 387320843 /nfs/dbraw/zinc/32/08/43/387320843.db2.gz GMVKWISRXMZYME-UHFFFAOYSA-N 1 2 247.342 2.440 20 0 BEADLO CC(=O)CC[N@@H+]1CCOC[C@@H]1c1ccccc1 ZINC000372768391 387324847 /nfs/dbraw/zinc/32/48/47/387324847.db2.gz UGYVNVVNJKNXIR-CQSZACIVSA-N 1 2 233.311 2.039 20 0 BEADLO CC(=O)CC[N@H+]1CCOC[C@@H]1c1ccccc1 ZINC000372768391 387324854 /nfs/dbraw/zinc/32/48/54/387324854.db2.gz UGYVNVVNJKNXIR-CQSZACIVSA-N 1 2 233.311 2.039 20 0 BEADLO Cc1cc(NCCCc2cccs2)nc[nH+]1 ZINC000390443667 387327623 /nfs/dbraw/zinc/32/76/23/387327623.db2.gz WOFNUXOTLHFAFV-UHFFFAOYSA-N 1 2 233.340 2.313 20 0 BEADLO Clc1cnc(COCc2[nH]cc[nH+]2)s1 ZINC000515087148 387336172 /nfs/dbraw/zinc/33/61/72/387336172.db2.gz KIPFOPRQCFHLDN-UHFFFAOYSA-N 1 2 229.692 2.236 20 0 BEADLO Cc1nc(NC2C[C@@H](C)O[C@H](C)C2)cc[nH+]1 ZINC000162288524 387336890 /nfs/dbraw/zinc/33/68/90/387336890.db2.gz KZPYJNCSWMSGCO-RKDXNWHRSA-N 1 2 221.304 2.153 20 0 BEADLO Cc1c[nH+]cc(NCc2cn(C(C)C)nn2)c1 ZINC000286876728 387345850 /nfs/dbraw/zinc/34/58/50/387345850.db2.gz NWADUMHZTYEHMD-UHFFFAOYSA-N 1 2 231.303 2.175 20 0 BEADLO CC[C@H]1C[C@@H](C)CN1C(=O)Nc1cc[nH+]cc1C ZINC000336527718 387351636 /nfs/dbraw/zinc/35/16/36/387351636.db2.gz SRAQJXOIMKWJGD-PWSUYJOCSA-N 1 2 247.342 2.464 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1CCCO[C@H]1C ZINC000191457394 387430866 /nfs/dbraw/zinc/43/08/66/387430866.db2.gz WXSSCWZXRVJWNW-WDEREUQCSA-N 1 2 234.299 2.144 20 0 BEADLO Cn1nccc1C[N@@H+]1CCC[C@H]1c1nccs1 ZINC000374301960 387439053 /nfs/dbraw/zinc/43/90/53/387439053.db2.gz LYIDKCXKNVSYRD-NSHDSACASA-N 1 2 248.355 2.214 20 0 BEADLO Cn1nccc1C[N@H+]1CCC[C@H]1c1nccs1 ZINC000374301960 387439060 /nfs/dbraw/zinc/43/90/60/387439060.db2.gz LYIDKCXKNVSYRD-NSHDSACASA-N 1 2 248.355 2.214 20 0 BEADLO Cc1ccc(F)cc1C[N@H+](C)Cc1cc[nH]n1 ZINC000352693016 387439118 /nfs/dbraw/zinc/43/91/18/387439118.db2.gz ITGFRHORPRVJBT-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+](C)Cc1cc[nH]n1 ZINC000352693016 387439123 /nfs/dbraw/zinc/43/91/23/387439123.db2.gz ITGFRHORPRVJBT-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ncccn1 ZINC000336615895 387456513 /nfs/dbraw/zinc/45/65/13/387456513.db2.gz OREQRIGCCAUVQN-RKDXNWHRSA-N 1 2 245.248 2.249 20 0 BEADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ncccn1 ZINC000336615895 387456514 /nfs/dbraw/zinc/45/65/14/387456514.db2.gz OREQRIGCCAUVQN-RKDXNWHRSA-N 1 2 245.248 2.249 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@H]2CCCOC2)cs1 ZINC000336618030 387458546 /nfs/dbraw/zinc/45/85/46/387458546.db2.gz VYPIZURYVPYIDV-NSHDSACASA-N 1 2 226.345 2.062 20 0 BEADLO Cc1nc(C[N@H+](C)[C@H]2CCCOC2)cs1 ZINC000336618030 387458550 /nfs/dbraw/zinc/45/85/50/387458550.db2.gz VYPIZURYVPYIDV-NSHDSACASA-N 1 2 226.345 2.062 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC(C)(C)[C@@H]1[C@H]1CCCO1 ZINC000336562406 387388571 /nfs/dbraw/zinc/38/85/71/387388571.db2.gz ZHMPFRQHLWOLMK-OLZOCXBDSA-N 1 2 249.358 2.108 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC(C)(C)[C@@H]1[C@H]1CCCO1 ZINC000336562406 387388572 /nfs/dbraw/zinc/38/85/72/387388572.db2.gz ZHMPFRQHLWOLMK-OLZOCXBDSA-N 1 2 249.358 2.108 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ccncn1)c1cscn1 ZINC000515500518 387390122 /nfs/dbraw/zinc/39/01/22/387390122.db2.gz LQIUWNILHKWPQB-IUCAKERBSA-N 1 2 234.328 2.345 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC(C)(C)[C@H]1[C@@H]1CCCO1 ZINC000336562407 387390315 /nfs/dbraw/zinc/39/03/15/387390315.db2.gz ZHMPFRQHLWOLMK-QWHCGFSZSA-N 1 2 249.358 2.108 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC(C)(C)[C@H]1[C@@H]1CCCO1 ZINC000336562407 387390321 /nfs/dbraw/zinc/39/03/21/387390321.db2.gz ZHMPFRQHLWOLMK-QWHCGFSZSA-N 1 2 249.358 2.108 20 0 BEADLO Cc1ccncc1C[N@@H+](C)[C@H](C)c1cnccn1 ZINC000361423498 387460092 /nfs/dbraw/zinc/46/00/92/387460092.db2.gz CETHISIDJLWVNG-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1ccncc1C[N@H+](C)[C@H](C)c1cnccn1 ZINC000361423498 387460097 /nfs/dbraw/zinc/46/00/97/387460097.db2.gz CETHISIDJLWVNG-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO CC1(C)CC[N@H+](CC(F)F)CCS1 ZINC000306569049 387397006 /nfs/dbraw/zinc/39/70/06/387397006.db2.gz KGIFDIFVKKZLMI-UHFFFAOYSA-N 1 2 209.305 2.469 20 0 BEADLO CC1(C)CC[N@@H+](CC(F)F)CCS1 ZINC000306569049 387397012 /nfs/dbraw/zinc/39/70/12/387397012.db2.gz KGIFDIFVKKZLMI-UHFFFAOYSA-N 1 2 209.305 2.469 20 0 BEADLO Cc1cnc(C[NH2+][C@H](C)c2cccnc2)nc1 ZINC000361088056 387400667 /nfs/dbraw/zinc/40/06/67/387400667.db2.gz XMJSCOAJCGDNEM-LLVKDONJSA-N 1 2 228.299 2.031 20 0 BEADLO C[C@H]([NH2+]Cc1ccn[nH]1)c1ccc(F)cc1 ZINC000036900108 387409315 /nfs/dbraw/zinc/40/93/15/387409315.db2.gz GCGRTGAAEYUKAC-VIFPVBQESA-N 1 2 219.263 2.400 20 0 BEADLO COC(=O)c1occc1C[NH2+][C@@H]1CCC[C@H]1F ZINC000354647696 387411455 /nfs/dbraw/zinc/41/14/55/387411455.db2.gz CSNGTBFNBYPTGW-NXEZZACHSA-N 1 2 241.262 2.046 20 0 BEADLO COC(=O)c1occc1C[NH2+][C@H]1CCC[C@H]1F ZINC000354647702 387411502 /nfs/dbraw/zinc/41/15/02/387411502.db2.gz CSNGTBFNBYPTGW-ZJUUUORDSA-N 1 2 241.262 2.046 20 0 BEADLO c1cn(CCSc2ccccn2)c[nH+]1 ZINC000121830002 387420259 /nfs/dbraw/zinc/42/02/59/387420259.db2.gz LTFJXTQCQPIWSN-UHFFFAOYSA-N 1 2 205.286 2.070 20 0 BEADLO C[C@@H](O)[C@H]1CCN(c2[nH+]ccc3ccccc32)C1 ZINC000162698140 387494711 /nfs/dbraw/zinc/49/47/11/387494711.db2.gz PCPBOTXIAIVPJB-YPMHNXCESA-N 1 2 242.322 2.442 20 0 BEADLO COC(=O)[C@H](C1CC1)[N@@H+]1Cc2ccc(C)cc2C1 ZINC000361592315 387505811 /nfs/dbraw/zinc/50/58/11/387505811.db2.gz BUJXSZIYMBAARU-AWEZNQCLSA-N 1 2 245.322 2.262 20 0 BEADLO COC(=O)[C@H](C1CC1)[N@H+]1Cc2ccc(C)cc2C1 ZINC000361592315 387505816 /nfs/dbraw/zinc/50/58/16/387505816.db2.gz BUJXSZIYMBAARU-AWEZNQCLSA-N 1 2 245.322 2.262 20 0 BEADLO Cc1c[nH+]cc(N[C@@H]2CCOC[C@H]2C)c1 ZINC000192645235 387511568 /nfs/dbraw/zinc/51/15/68/387511568.db2.gz UFVQMUOVDJYWFY-ZYHUDNBSSA-N 1 2 206.289 2.227 20 0 BEADLO COC[C@@H]1CCCCN(c2cc[nH+]c(C)n2)C1 ZINC000375142468 387513236 /nfs/dbraw/zinc/51/32/36/387513236.db2.gz OAFIGVZKOMPILX-GFCCVEGCSA-N 1 2 235.331 2.038 20 0 BEADLO CCc1noc(C)c1C[N@@H+]1C[C@H](C)OC[C@@H]1C ZINC000162751263 387515184 /nfs/dbraw/zinc/51/51/84/387515184.db2.gz NIHHKQGPTHYHKD-UWVGGRQHSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1noc(C)c1C[N@H+]1C[C@H](C)OC[C@@H]1C ZINC000162751263 387515188 /nfs/dbraw/zinc/51/51/88/387515188.db2.gz NIHHKQGPTHYHKD-UWVGGRQHSA-N 1 2 238.331 2.155 20 0 BEADLO c1nc(NCC2CCC2)cc(NCC2CCC2)[nH+]1 ZINC000355337674 387522056 /nfs/dbraw/zinc/52/20/56/387522056.db2.gz QYCYYAUOFLLMEQ-UHFFFAOYSA-N 1 2 246.358 2.323 20 0 BEADLO CCn1c[nH+]cc1CNc1ccnn1CC(C)C ZINC000417969931 387528442 /nfs/dbraw/zinc/52/84/42/387528442.db2.gz PAHBGBJIQXOBHM-UHFFFAOYSA-N 1 2 247.346 2.368 20 0 BEADLO Cc1cc(NC[C@@H](C)CC(F)(F)F)nc[nH+]1 ZINC000397024107 387530848 /nfs/dbraw/zinc/53/08/48/387530848.db2.gz UJRTVYZJFMIATN-ZETCQYMHSA-N 1 2 233.237 2.207 20 0 BEADLO CCC[C@H]1C[C@@H]1C(=O)Nc1cc[nH+]cc1CC ZINC000361788397 387535154 /nfs/dbraw/zinc/53/51/54/387535154.db2.gz RNDGREYXSULSIQ-RYUDHWBXSA-N 1 2 232.327 2.441 20 0 BEADLO CCc1ccc(C[NH2+][C@H](C)c2ccon2)cn1 ZINC000352736346 387463912 /nfs/dbraw/zinc/46/39/12/387463912.db2.gz GZAXEEBPELCJGT-SNVBAGLBSA-N 1 2 231.299 2.483 20 0 BEADLO COC(=O)[C@@H](CC(F)F)[NH2+]C[C@H]1CC=CCC1 ZINC000355048837 387469376 /nfs/dbraw/zinc/46/93/76/387469376.db2.gz KHMKWUWLOCKTHK-VHSXEESVSA-N 1 2 247.285 2.129 20 0 BEADLO CC[N@H+](CCC1CC1)Cc1noc(C)n1 ZINC000355047384 387469721 /nfs/dbraw/zinc/46/97/21/387469721.db2.gz XLKGLOHUHGNVJN-UHFFFAOYSA-N 1 2 209.293 2.000 20 0 BEADLO CC[N@@H+](CCC1CC1)Cc1noc(C)n1 ZINC000355047384 387469725 /nfs/dbraw/zinc/46/97/25/387469725.db2.gz XLKGLOHUHGNVJN-UHFFFAOYSA-N 1 2 209.293 2.000 20 0 BEADLO CCC[C@H](C)CC(=O)N1CCn2cc(C)[nH+]c2C1 ZINC000374656213 387476888 /nfs/dbraw/zinc/47/68/88/387476888.db2.gz ASWGMDNEYKRSPO-NSHDSACASA-N 1 2 249.358 2.360 20 0 BEADLO Cc1cn2c([nH+]1)CN(Cc1ccc(C)o1)CC2 ZINC000374704217 387483083 /nfs/dbraw/zinc/48/30/83/387483083.db2.gz XNFXYRRAANZIFU-UHFFFAOYSA-N 1 2 231.299 2.109 20 0 BEADLO COC(=O)C[N@H+](Cc1cccc(C)c1C)C1CC1 ZINC000355132315 387484985 /nfs/dbraw/zinc/48/49/85/387484985.db2.gz KHAZUHYCPXEORH-UHFFFAOYSA-N 1 2 247.338 2.441 20 0 BEADLO COC(=O)C[N@@H+](Cc1cccc(C)c1C)C1CC1 ZINC000355132315 387484992 /nfs/dbraw/zinc/48/49/92/387484992.db2.gz KHAZUHYCPXEORH-UHFFFAOYSA-N 1 2 247.338 2.441 20 0 BEADLO COC(=O)C[N@@H+]1CCC[C@@H]1/C=C/c1ccccc1 ZINC000374768507 387490777 /nfs/dbraw/zinc/49/07/77/387490777.db2.gz RZWYGUBMAMPRSK-ATWMFIQVSA-N 1 2 245.322 2.337 20 0 BEADLO COC(=O)C[N@H+]1CCC[C@@H]1/C=C/c1ccccc1 ZINC000374768507 387490781 /nfs/dbraw/zinc/49/07/81/387490781.db2.gz RZWYGUBMAMPRSK-ATWMFIQVSA-N 1 2 245.322 2.337 20 0 BEADLO CCC1(NC(=O)NCc2cc(C)[nH+]c(C)c2)CC1 ZINC000422201682 387585766 /nfs/dbraw/zinc/58/57/66/387585766.db2.gz GRAXBTZXTGZHTB-UHFFFAOYSA-N 1 2 247.342 2.440 20 0 BEADLO Cc1nc(C[N@H+]2CCOCC[C@H]2C)cs1 ZINC000362232773 387588070 /nfs/dbraw/zinc/58/80/70/387588070.db2.gz CUUOQRFNNQURIC-SECBINFHSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1nc(C[N@@H+]2CCOCC[C@H]2C)cs1 ZINC000362232773 387588075 /nfs/dbraw/zinc/58/80/75/387588075.db2.gz CUUOQRFNNQURIC-SECBINFHSA-N 1 2 226.345 2.062 20 0 BEADLO CSCc1cnc(C[NH2+][C@@H](C)CF)s1 ZINC000293070079 387591365 /nfs/dbraw/zinc/59/13/65/387591365.db2.gz VIYSWIYPQDSTSQ-ZETCQYMHSA-N 1 2 234.365 2.454 20 0 BEADLO Clc1cccnc1C[N@H+]1CC=CCC1 ZINC000527532165 387598623 /nfs/dbraw/zinc/59/86/23/387598623.db2.gz HPBJFJHRDQDDJM-UHFFFAOYSA-N 1 2 208.692 2.497 20 0 BEADLO Clc1cccnc1C[N@@H+]1CC=CCC1 ZINC000527532165 387598625 /nfs/dbraw/zinc/59/86/25/387598625.db2.gz HPBJFJHRDQDDJM-UHFFFAOYSA-N 1 2 208.692 2.497 20 0 BEADLO CCCc1noc(C[N@H+]2CC(C)=C[C@H](C)C2)n1 ZINC000430269862 387605578 /nfs/dbraw/zinc/60/55/78/387605578.db2.gz SNUROZRJTPHDTB-JTQLQIEISA-N 1 2 235.331 2.420 20 0 BEADLO CCCc1noc(C[N@@H+]2CC(C)=C[C@H](C)C2)n1 ZINC000430269862 387605585 /nfs/dbraw/zinc/60/55/85/387605585.db2.gz SNUROZRJTPHDTB-JTQLQIEISA-N 1 2 235.331 2.420 20 0 BEADLO Cc1noc([C@@H](C)[N@H+](C)Cc2ccnc(C)c2)n1 ZINC000527539908 387607739 /nfs/dbraw/zinc/60/77/39/387607739.db2.gz YACYHFVOWVCUHJ-SNVBAGLBSA-N 1 2 246.314 2.274 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+](C)Cc2ccnc(C)c2)n1 ZINC000527539908 387607746 /nfs/dbraw/zinc/60/77/46/387607746.db2.gz YACYHFVOWVCUHJ-SNVBAGLBSA-N 1 2 246.314 2.274 20 0 BEADLO Cc1noc(C(C)(C)[NH2+]Cc2ccnc(C)c2)n1 ZINC000527539652 387608188 /nfs/dbraw/zinc/60/81/88/387608188.db2.gz NQMCAEBGQITPAH-UHFFFAOYSA-N 1 2 246.314 2.106 20 0 BEADLO COC(=O)c1ccc(COc2cc[nH+]cc2)cc1 ZINC000356099905 387615901 /nfs/dbraw/zinc/61/59/01/387615901.db2.gz SBKLXRWRHUQDMH-UHFFFAOYSA-N 1 2 243.262 2.447 20 0 BEADLO Cc1ccc(Cc2noc(COC(C)C)n2)c[nH+]1 ZINC000356169738 387624594 /nfs/dbraw/zinc/62/45/94/387624594.db2.gz LUKKPSCNGGWUSE-UHFFFAOYSA-N 1 2 247.298 2.289 20 0 BEADLO CCCC(C)(C)CC(=O)NCc1[nH]cc[nH+]1 ZINC000426304940 387554105 /nfs/dbraw/zinc/55/41/05/387554105.db2.gz UUEJGOZMXBQHHF-UHFFFAOYSA-N 1 2 223.320 2.242 20 0 BEADLO Cc1noc(C)c1CNc1ccc(N(C)C)[nH+]c1 ZINC000036989096 387558389 /nfs/dbraw/zinc/55/83/89/387558389.db2.gz DQOVEJRDDDWPEH-UHFFFAOYSA-N 1 2 246.314 2.365 20 0 BEADLO C[C@@H](CC(=O)NCc1[nH]cc[nH+]1)c1ccccc1 ZINC000114124736 387567339 /nfs/dbraw/zinc/56/73/39/387567339.db2.gz MTQCAXRYBMNGDX-NSHDSACASA-N 1 2 243.310 2.220 20 0 BEADLO CCCC(C)(C)NC(=O)[C@@H]1CCn2c[nH+]cc2C1 ZINC000362136472 387578149 /nfs/dbraw/zinc/57/81/49/387578149.db2.gz LUECNESLTKXVNU-LLVKDONJSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccnc(C)c2)no1 ZINC000527536039 387631814 /nfs/dbraw/zinc/63/18/14/387631814.db2.gz ZMVRXZVNDFTTNQ-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccnc(C)c2)no1 ZINC000527536039 387631819 /nfs/dbraw/zinc/63/18/19/387631819.db2.gz ZMVRXZVNDFTTNQ-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO C[C@@H](CCC1CC1)NC(=O)CCc1[nH]cc[nH+]1 ZINC000356238399 387631918 /nfs/dbraw/zinc/63/19/18/387631918.db2.gz ZVOIRAJBIIRMAR-JTQLQIEISA-N 1 2 235.331 2.037 20 0 BEADLO Cc1nnsc1C[N@H+]1CCC(F)(F)C[C@@H]1C ZINC000528768261 387634667 /nfs/dbraw/zinc/63/46/67/387634667.db2.gz IRLODABFFXUDKC-ZETCQYMHSA-N 1 2 247.314 2.466 20 0 BEADLO Cc1nnsc1C[N@@H+]1CCC(F)(F)C[C@@H]1C ZINC000528768261 387634672 /nfs/dbraw/zinc/63/46/72/387634672.db2.gz IRLODABFFXUDKC-ZETCQYMHSA-N 1 2 247.314 2.466 20 0 BEADLO Cc1ccc(CNc2ccc(CO)c[nH+]2)cc1F ZINC000356298140 387640586 /nfs/dbraw/zinc/64/05/86/387640586.db2.gz GBFDLRWUNAAOTA-UHFFFAOYSA-N 1 2 246.285 2.055 20 0 BEADLO CCCc1nc(C[N@@H+]2CC[C@@H](CC)C2)no1 ZINC000125564897 387661148 /nfs/dbraw/zinc/66/11/48/387661148.db2.gz JVBWBXMMUFXNKG-SNVBAGLBSA-N 1 2 223.320 2.254 20 0 BEADLO CCCc1nc(C[N@H+]2CC[C@@H](CC)C2)no1 ZINC000125564897 387661152 /nfs/dbraw/zinc/66/11/52/387661152.db2.gz JVBWBXMMUFXNKG-SNVBAGLBSA-N 1 2 223.320 2.254 20 0 BEADLO Cc1cc(N[C@H]2[C@@H]3CCC[C@@H]32)nc(C2CC2)[nH+]1 ZINC000362842429 387664419 /nfs/dbraw/zinc/66/44/19/387664419.db2.gz LMCQWNSSLNBONF-PJXYFTJBSA-N 1 2 229.327 2.295 20 0 BEADLO CC[C@H](F)C[N@H+](CCOC)Cc1ccco1 ZINC000440714181 387680083 /nfs/dbraw/zinc/68/00/83/387680083.db2.gz OHXXHTCHSAOQSR-NSHDSACASA-N 1 2 229.295 2.476 20 0 BEADLO CC[C@H](F)C[N@@H+](CCOC)Cc1ccco1 ZINC000440714181 387680090 /nfs/dbraw/zinc/68/00/90/387680090.db2.gz OHXXHTCHSAOQSR-NSHDSACASA-N 1 2 229.295 2.476 20 0 BEADLO CCn1ncc(C[NH2+]Cc2cccc(C)c2F)n1 ZINC000527736200 387684520 /nfs/dbraw/zinc/68/45/20/387684520.db2.gz RPELUGWKSOUQDT-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO CCCc1nc(C[N@@H+]2CCC3(CCC3)C2)no1 ZINC000123318683 387684804 /nfs/dbraw/zinc/68/48/04/387684804.db2.gz XLZSSTMGEQXFIG-UHFFFAOYSA-N 1 2 235.331 2.398 20 0 BEADLO CCCc1nc(C[N@H+]2CCC3(CCC3)C2)no1 ZINC000123318683 387684807 /nfs/dbraw/zinc/68/48/07/387684807.db2.gz XLZSSTMGEQXFIG-UHFFFAOYSA-N 1 2 235.331 2.398 20 0 BEADLO CC[C@@H](C)[C@H](C)C(=O)Nc1ccc(N)[nH+]c1 ZINC000422794312 387696430 /nfs/dbraw/zinc/69/64/30/387696430.db2.gz UCZBSDOVSFPFPV-BDAKNGLRSA-N 1 2 221.304 2.115 20 0 BEADLO CC[C@H](F)C[N@H+](C)[C@H](C)C(=O)OC(C)(C)C ZINC000440776232 387693068 /nfs/dbraw/zinc/69/30/68/387693068.db2.gz BRUJBFGKMFAZHO-ZJUUUORDSA-N 1 2 233.327 2.397 20 0 BEADLO CC[C@H](F)C[N@@H+](C)[C@H](C)C(=O)OC(C)(C)C ZINC000440776232 387693075 /nfs/dbraw/zinc/69/30/75/387693075.db2.gz BRUJBFGKMFAZHO-ZJUUUORDSA-N 1 2 233.327 2.397 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000440776293 387693513 /nfs/dbraw/zinc/69/35/13/387693513.db2.gz BZUPFDGQGCTMGA-NXEZZACHSA-N 1 2 211.284 2.295 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000440776293 387693519 /nfs/dbraw/zinc/69/35/19/387693519.db2.gz BZUPFDGQGCTMGA-NXEZZACHSA-N 1 2 211.284 2.295 20 0 BEADLO CCn1cncc1C[NH2+][C@@H](C)c1ncccc1F ZINC000527827793 387748031 /nfs/dbraw/zinc/74/80/31/387748031.db2.gz JMDOLPUUIRQGAO-JTQLQIEISA-N 1 2 248.305 2.288 20 0 BEADLO COC(=O)CC1(C[N@H+](CC(F)F)C(C)C)CC1 ZINC000440779095 387697300 /nfs/dbraw/zinc/69/73/00/387697300.db2.gz CTEOLNHPJHMGKK-UHFFFAOYSA-N 1 2 249.301 2.305 20 0 BEADLO COC(=O)CC1(C[N@@H+](CC(F)F)C(C)C)CC1 ZINC000440779095 387697302 /nfs/dbraw/zinc/69/73/02/387697302.db2.gz CTEOLNHPJHMGKK-UHFFFAOYSA-N 1 2 249.301 2.305 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCO[C@H](c2ccco2)C1 ZINC000440790533 387698749 /nfs/dbraw/zinc/69/87/49/387698749.db2.gz LDHARWLJZBEWMY-PWSUYJOCSA-N 1 2 227.279 2.401 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCO[C@H](c2ccco2)C1 ZINC000440790533 387698756 /nfs/dbraw/zinc/69/87/56/387698756.db2.gz LDHARWLJZBEWMY-PWSUYJOCSA-N 1 2 227.279 2.401 20 0 BEADLO CCCOc1cncc(NCc2[nH+]ccn2C)c1 ZINC000527782691 387709303 /nfs/dbraw/zinc/70/93/03/387709303.db2.gz ZKOGZMRSTWZBCD-UHFFFAOYSA-N 1 2 246.314 2.216 20 0 BEADLO c1cc(OCC[C@H]2CCCCO2)cc[nH+]1 ZINC000431495243 387713890 /nfs/dbraw/zinc/71/38/90/387713890.db2.gz NTYBQZZPWRZQQS-LLVKDONJSA-N 1 2 207.273 2.420 20 0 BEADLO C[C@H]([NH2+]Cc1c[nH]nn1)[C@@H]1CCC[C@@H](C)C1 ZINC000452055456 387716832 /nfs/dbraw/zinc/71/68/32/387716832.db2.gz BYUOVVZJAGVXST-OUAUKWLOSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@H]([NH2+]Cc1cn[nH]n1)[C@@H]1CCC[C@@H](C)C1 ZINC000452055456 387716837 /nfs/dbraw/zinc/71/68/37/387716837.db2.gz BYUOVVZJAGVXST-OUAUKWLOSA-N 1 2 222.336 2.109 20 0 BEADLO O=C(OCC1CC1)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000377534352 387724049 /nfs/dbraw/zinc/72/40/49/387724049.db2.gz RXRORKJSDQQVBX-LLVKDONJSA-N 1 2 249.314 2.136 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1CCC[C@@H]1OC ZINC000527945386 387781123 /nfs/dbraw/zinc/78/11/23/387781123.db2.gz IOBGOUFOUJGREZ-MNOVXSKESA-N 1 2 236.315 2.317 20 0 BEADLO COC[C@@H](Nc1[nH+]c(C)nc2[nH]ccc21)C1CC1 ZINC000441954612 387784267 /nfs/dbraw/zinc/78/42/67/387784267.db2.gz KPQTXVRLOSHIAC-LLVKDONJSA-N 1 2 246.314 2.103 20 0 BEADLO O=C(C=C1CCC1)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000378514316 387787309 /nfs/dbraw/zinc/78/73/09/387787309.db2.gz AXIBFZCARVXKFM-LLVKDONJSA-N 1 2 231.299 2.184 20 0 BEADLO C/C(=C\C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1)C1CC1 ZINC000378520148 387789570 /nfs/dbraw/zinc/78/95/70/387789570.db2.gz RYMNWBGDEGWYFN-VMPCVLLUSA-N 1 2 245.326 2.430 20 0 BEADLO COc1ccc[nH+]c1N1C[C@@H]2CCC[C@@H]2C1 ZINC000527919786 387790366 /nfs/dbraw/zinc/79/03/66/387790366.db2.gz KGLPVTGZUJUVSP-PHIMTYICSA-N 1 2 218.300 2.327 20 0 BEADLO CCc1cnc(CNc2cccc(CO)[nH+]2)s1 ZINC000432741512 387812832 /nfs/dbraw/zinc/81/28/32/387812832.db2.gz HQFDUKCHRXZSNW-UHFFFAOYSA-N 1 2 249.339 2.205 20 0 BEADLO CC(C)CC1(C(=O)N[C@@H](C)Cn2cc[nH+]c2)CC1 ZINC000442287667 387793089 /nfs/dbraw/zinc/79/30/89/387793089.db2.gz BOIRFEHXAZXFGD-LBPRGKRZSA-N 1 2 249.358 2.214 20 0 BEADLO CC(C)CC1(C(=O)NCCCn2cc[nH+]c2)CC1 ZINC000442408269 387796054 /nfs/dbraw/zinc/79/60/54/387796054.db2.gz KCUFWBWYCBGNJG-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO COc1ccc[nH+]c1N1C[C@H](C)O[C@@H](C2CC2)C1 ZINC000527995867 387805915 /nfs/dbraw/zinc/80/59/15/387805915.db2.gz VPCYGRPXPSUWFK-GXFFZTMASA-N 1 2 248.326 2.094 20 0 BEADLO CCc1nc(C[N@H+](C)[C@@H](C)COC)cs1 ZINC000193897940 387807118 /nfs/dbraw/zinc/80/71/18/387807118.db2.gz UKXMAKURYZABJJ-VIFPVBQESA-N 1 2 228.361 2.172 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@@H](C)COC)cs1 ZINC000193897940 387807123 /nfs/dbraw/zinc/80/71/23/387807123.db2.gz UKXMAKURYZABJJ-VIFPVBQESA-N 1 2 228.361 2.172 20 0 BEADLO FC(F)(F)c1cnc(CNc2c[nH]c[nH+]2)s1 ZINC000309520523 387813656 /nfs/dbraw/zinc/81/36/56/387813656.db2.gz BJDKGVALMREJMA-UHFFFAOYSA-N 1 2 248.233 2.497 20 0 BEADLO CN(c1[nH+]ccc2ccccc21)C1CC(O)C1 ZINC000527962859 387811528 /nfs/dbraw/zinc/81/15/28/387811528.db2.gz ROWJBJKNXKFTTF-UHFFFAOYSA-N 1 2 228.295 2.194 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)cc1 ZINC000367831679 387757359 /nfs/dbraw/zinc/75/73/59/387757359.db2.gz JUAOFLZTUZFKNL-UONOGXRCSA-N 1 2 233.311 2.058 20 0 BEADLO CCOc1ccc(C[N@H+]2CCO[C@@H]3C[C@@H]32)cc1 ZINC000367831679 387757365 /nfs/dbraw/zinc/75/73/65/387757365.db2.gz JUAOFLZTUZFKNL-UONOGXRCSA-N 1 2 233.311 2.058 20 0 BEADLO C[C@@H]([NH2+]Cc1ncccn1)c1ccccc1 ZINC000054458765 387826057 /nfs/dbraw/zinc/82/60/57/387826057.db2.gz BOOQOGPOYLCZHP-LLVKDONJSA-N 1 2 213.284 2.327 20 0 BEADLO COCCC1CCN(c2cccc[nH+]2)CC1 ZINC000528082881 387836102 /nfs/dbraw/zinc/83/61/02/387836102.db2.gz CXSHMZLKWZHHNW-UHFFFAOYSA-N 1 2 220.316 2.335 20 0 BEADLO c1ccc2[nH]c(=[NH+]CC[C@@H]3CCCOC3)[nH]c2c1 ZINC000528071577 387843082 /nfs/dbraw/zinc/84/30/82/387843082.db2.gz FVEGLPUGYSYCIN-NSHDSACASA-N 1 2 245.326 2.213 20 0 BEADLO CC[C@@H]1CCC[C@@H]1CNC(=O)CCc1[nH]cc[nH+]1 ZINC000452513080 387845054 /nfs/dbraw/zinc/84/50/54/387845054.db2.gz AAMOCHCYNYIBAP-VXGBXAGGSA-N 1 2 249.358 2.285 20 0 BEADLO CC[C@H](NC(=O)[C@@H]1C[C@H]1C(C)C)c1[nH]cc[nH+]1 ZINC000442814105 387845306 /nfs/dbraw/zinc/84/53/06/387845306.db2.gz UVJCBFRTVFHUSZ-AXFHLTTASA-N 1 2 235.331 2.269 20 0 BEADLO CC[C@H](NC(=O)[C@H]1CC[C@H](C)C1)c1[nH]cc[nH+]1 ZINC000442809936 387846917 /nfs/dbraw/zinc/84/69/17/387846917.db2.gz LGRYJCZXIAJIDP-DCAQKATOSA-N 1 2 235.331 2.413 20 0 BEADLO CCN(CC)C(=O)C[N@H+](C)Cc1ccsc1 ZINC000061800428 387847391 /nfs/dbraw/zinc/84/73/91/387847391.db2.gz MRBDYUQUHOVEGN-UHFFFAOYSA-N 1 2 240.372 2.048 20 0 BEADLO CCN(CC)C(=O)C[N@@H+](C)Cc1ccsc1 ZINC000061800428 387847395 /nfs/dbraw/zinc/84/73/95/387847395.db2.gz MRBDYUQUHOVEGN-UHFFFAOYSA-N 1 2 240.372 2.048 20 0 BEADLO CC[C@H]1CCC[C@@H]1CNC(=O)c1c[nH+]c(C)[nH]1 ZINC000452531385 387849788 /nfs/dbraw/zinc/84/97/88/387849788.db2.gz QLOVILFJUKSFHZ-WDEREUQCSA-N 1 2 235.331 2.274 20 0 BEADLO FC1(F)CC[N@H+](CCC[C@@H]2CCOC2)C1 ZINC000645847554 387856963 /nfs/dbraw/zinc/85/69/63/387856963.db2.gz DJSBHJVYVFJHEE-SNVBAGLBSA-N 1 2 219.275 2.144 20 0 BEADLO FC1(F)CC[N@@H+](CCC[C@@H]2CCOC2)C1 ZINC000645847554 387856965 /nfs/dbraw/zinc/85/69/65/387856965.db2.gz DJSBHJVYVFJHEE-SNVBAGLBSA-N 1 2 219.275 2.144 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@@H]1CC12CCCC2 ZINC000452570948 387861728 /nfs/dbraw/zinc/86/17/28/387861728.db2.gz MQKNRVOUTWYFHH-NSHDSACASA-N 1 2 247.342 2.100 20 0 BEADLO CC[N@@H+]1Cc2ccccc2C[C@@H]1c1nnc(C)o1 ZINC000193865268 387865927 /nfs/dbraw/zinc/86/59/27/387865927.db2.gz JQMQMUITJWEOMK-CYBMUJFWSA-N 1 2 243.310 2.497 20 0 BEADLO CC[N@H+]1Cc2ccccc2C[C@@H]1c1nnc(C)o1 ZINC000193865268 387865928 /nfs/dbraw/zinc/86/59/28/387865928.db2.gz JQMQMUITJWEOMK-CYBMUJFWSA-N 1 2 243.310 2.497 20 0 BEADLO Cc1csc(CNC(=O)CCc2[nH]cc[nH+]2)c1 ZINC000452763048 387909503 /nfs/dbraw/zinc/90/95/03/387909503.db2.gz XMQISWNHQOKUCD-UHFFFAOYSA-N 1 2 249.339 2.029 20 0 BEADLO C[N@@H+](Cc1ncccc1Cl)C[C@H]1CCCO1 ZINC000528360471 387912127 /nfs/dbraw/zinc/91/21/27/387912127.db2.gz YLKUBSIIKSWPBI-SNVBAGLBSA-N 1 2 240.734 2.346 20 0 BEADLO C[N@H+](Cc1ncccc1Cl)C[C@H]1CCCO1 ZINC000528360471 387912131 /nfs/dbraw/zinc/91/21/31/387912131.db2.gz YLKUBSIIKSWPBI-SNVBAGLBSA-N 1 2 240.734 2.346 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)cs1 ZINC000438353050 387925235 /nfs/dbraw/zinc/92/52/35/387925235.db2.gz JEMVKWNHVXQHAP-GUBZILKMSA-N 1 2 240.372 2.449 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)cs1 ZINC000438353050 387925239 /nfs/dbraw/zinc/92/52/39/387925239.db2.gz JEMVKWNHVXQHAP-GUBZILKMSA-N 1 2 240.372 2.449 20 0 BEADLO C[N@H+](Cc1cnc[nH]1)Cc1ccccc1 ZINC000178842768 387926281 /nfs/dbraw/zinc/92/62/81/387926281.db2.gz AEDLZMFEGNUMKX-UHFFFAOYSA-N 1 2 201.273 2.042 20 0 BEADLO C[N@@H+](Cc1cnc[nH]1)Cc1ccccc1 ZINC000178842768 387926284 /nfs/dbraw/zinc/92/62/84/387926284.db2.gz AEDLZMFEGNUMKX-UHFFFAOYSA-N 1 2 201.273 2.042 20 0 BEADLO COC(=O)CC1CC(Nc2ccc(C)[nH+]c2)C1 ZINC000424288924 387953418 /nfs/dbraw/zinc/95/34/18/387953418.db2.gz SQMXDYMHZGCLGH-UHFFFAOYSA-N 1 2 234.299 2.144 20 0 BEADLO C[C@H]1C[N@H+](Cc2cccc3c2OCO3)[C@@H](C)CO1 ZINC000245515229 387953734 /nfs/dbraw/zinc/95/37/34/387953734.db2.gz HEEXHXMBZBWCNJ-QWRGUYRKSA-N 1 2 249.310 2.025 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cccc3c2OCO3)[C@@H](C)CO1 ZINC000245515229 387953737 /nfs/dbraw/zinc/95/37/37/387953737.db2.gz HEEXHXMBZBWCNJ-QWRGUYRKSA-N 1 2 249.310 2.025 20 0 BEADLO CCc1ccccc1C[N@H+](CC)CC(=O)OC ZINC000445803032 387969029 /nfs/dbraw/zinc/96/90/29/387969029.db2.gz QWYWMMPBHBBSKQ-UHFFFAOYSA-N 1 2 235.327 2.244 20 0 BEADLO CCc1ccccc1C[N@@H+](CC)CC(=O)OC ZINC000445803032 387969033 /nfs/dbraw/zinc/96/90/33/387969033.db2.gz QWYWMMPBHBBSKQ-UHFFFAOYSA-N 1 2 235.327 2.244 20 0 BEADLO CCCCc1cnc(NCc2c[nH+]cn2C)nc1 ZINC000453055062 387973046 /nfs/dbraw/zinc/97/30/46/387973046.db2.gz VHRWJVPUGJJZTR-UHFFFAOYSA-N 1 2 245.330 2.165 20 0 BEADLO Cc1cnc(C[N@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)s1 ZINC000446083998 387998465 /nfs/dbraw/zinc/99/84/65/387998465.db2.gz STTVPYPEMJUVGI-LSJOCFKGSA-N 1 2 240.372 2.449 20 0 BEADLO Cc1cnc(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)s1 ZINC000446083998 387998470 /nfs/dbraw/zinc/99/84/70/387998470.db2.gz STTVPYPEMJUVGI-LSJOCFKGSA-N 1 2 240.372 2.449 20 0 BEADLO Cc1cc(NC(=O)NC[C@@H]2CCC[C@H]2C)cc[nH+]1 ZINC000439456924 387999212 /nfs/dbraw/zinc/99/92/12/387999212.db2.gz PELVVBQLAPICBM-PWSUYJOCSA-N 1 2 247.342 2.370 20 0 BEADLO CC[C@@H]([NH2+][C@@H]1CCCc2c1cnn2C)C(F)F ZINC000453233022 388017341 /nfs/dbraw/zinc/01/73/41/388017341.db2.gz GTVNPUNZZMNPBH-NXEZZACHSA-N 1 2 243.301 2.431 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)[C@H]2CC23CCC3)[nH+]1 ZINC001645476485 1172670590 /nfs/dbraw/zinc/67/05/90/1172670590.db2.gz OFEYCBPIUZGPTO-LLVKDONJSA-N 1 2 247.342 2.340 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)[C@H]2CC23CCC3)c[nH+]1 ZINC001645476485 1172670594 /nfs/dbraw/zinc/67/05/94/1172670594.db2.gz OFEYCBPIUZGPTO-LLVKDONJSA-N 1 2 247.342 2.340 20 0 BEADLO C[C@H]1COCC[N@@H+]1CCc1c(F)cccc1F ZINC000645924044 388034506 /nfs/dbraw/zinc/03/45/06/388034506.db2.gz CNPURMGECDEXKU-JTQLQIEISA-N 1 2 241.281 2.228 20 0 BEADLO C[C@H]1COCC[N@H+]1CCc1c(F)cccc1F ZINC000645924044 388034511 /nfs/dbraw/zinc/03/45/11/388034511.db2.gz CNPURMGECDEXKU-JTQLQIEISA-N 1 2 241.281 2.228 20 0 BEADLO CO[C@H]1C[C@@H](Nc2cc[nH+]c(C3CC3)n2)C1(C)C ZINC000440190215 388035325 /nfs/dbraw/zinc/03/53/25/388035325.db2.gz IYTWFYKVJIRPHH-MNOVXSKESA-N 1 2 247.342 2.001 20 0 BEADLO CC[C@@H](N[C@@H](C)c1[nH+]ccn1C)C(F)F ZINC000453252162 388026999 /nfs/dbraw/zinc/02/69/99/388026999.db2.gz UUUWTQOAIWGRHZ-JGVFFNPUSA-N 1 2 217.263 2.114 20 0 BEADLO CC[C@H](F)C[N@@H+]1CC[C@@H](C)C[C@@H]1C(=O)OC ZINC000440533339 388052742 /nfs/dbraw/zinc/05/27/42/388052742.db2.gz QMWUGLOKWBALAP-OUAUKWLOSA-N 1 2 231.311 2.008 20 0 BEADLO CC[C@H](F)C[N@H+]1CC[C@@H](C)C[C@@H]1C(=O)OC ZINC000440533339 388052745 /nfs/dbraw/zinc/05/27/45/388052745.db2.gz QMWUGLOKWBALAP-OUAUKWLOSA-N 1 2 231.311 2.008 20 0 BEADLO c1cc(C[NH2+][C@@H]2CSc3ccccc32)n[nH]1 ZINC000083748876 388060921 /nfs/dbraw/zinc/06/09/21/388060921.db2.gz BWAKNBBOOBMRNU-LLVKDONJSA-N 1 2 231.324 2.346 20 0 BEADLO CC[C@H]([NH2+][C@@H]1C[C@@H]1C1CCCCC1)C(=O)OC ZINC000447793766 388092761 /nfs/dbraw/zinc/09/27/61/388092761.db2.gz AHHDUGRJVZPDPU-FRRDWIJNSA-N 1 2 239.359 2.496 20 0 BEADLO OCCCCCNc1[nH+]ccc2ccc(F)cc21 ZINC000447813405 388094395 /nfs/dbraw/zinc/09/43/95/388094395.db2.gz RPHYBYRETFYYSD-UHFFFAOYSA-N 1 2 248.301 2.370 20 0 BEADLO COc1ccc[nH+]c1NCC[C@@H]1CCCCO1 ZINC000224139536 388094857 /nfs/dbraw/zinc/09/48/57/388094857.db2.gz BWZXZBJWUKJGMO-NSHDSACASA-N 1 2 236.315 2.461 20 0 BEADLO C[C@@H]1CCCC[C@H]1C(=O)NCCCn1cc[nH+]c1 ZINC000424532686 388098654 /nfs/dbraw/zinc/09/86/54/388098654.db2.gz XOPSZRZEQWLPCS-CHWSQXEVSA-N 1 2 249.358 2.216 20 0 BEADLO CC[C@@H](C)NC(=O)N[C@H](C)c1[nH+]ccn1CC ZINC000454185527 388104279 /nfs/dbraw/zinc/10/42/79/388104279.db2.gz IHFPTOAMTVWLFT-NXEZZACHSA-N 1 2 238.335 2.062 20 0 BEADLO C[C@@H](O)C[N@@H+](CC1=CCCC1)CC(F)F ZINC000645925860 388109425 /nfs/dbraw/zinc/10/94/25/388109425.db2.gz VNSCAHUGOKIQLZ-SECBINFHSA-N 1 2 219.275 2.045 20 0 BEADLO C[C@@H](O)C[N@H+](CC1=CCCC1)CC(F)F ZINC000645925860 388109428 /nfs/dbraw/zinc/10/94/28/388109428.db2.gz VNSCAHUGOKIQLZ-SECBINFHSA-N 1 2 219.275 2.045 20 0 BEADLO Cc1cc(C)c(CNC(=O)NC[C@H]2C[C@@H]2C)c[nH+]1 ZINC000454263816 388111385 /nfs/dbraw/zinc/11/13/85/388111385.db2.gz GBSYWSTZXRREIH-CMPLNLGQSA-N 1 2 247.342 2.154 20 0 BEADLO CCC[C@H]([NH2+][C@H](CC)CSC)C(=O)OCC ZINC000162120755 388114139 /nfs/dbraw/zinc/11/41/39/388114139.db2.gz YYOUGBHESUAPDW-MNOVXSKESA-N 1 2 247.404 2.449 20 0 BEADLO CC/C=C/CNC(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000455342060 388156553 /nfs/dbraw/zinc/15/65/53/388156553.db2.gz VGQLLAKALBALNJ-XKFHPXPTSA-N 1 2 248.330 2.154 20 0 BEADLO CCCN(Cc1[nH+]ccn1CC)CC(F)F ZINC000195515485 388165364 /nfs/dbraw/zinc/16/53/64/388165364.db2.gz UWXSFDDNLKZOKZ-UHFFFAOYSA-N 1 2 231.290 2.380 20 0 BEADLO CC[N@H+](Cc1cnn(C)c1)Cc1c(C)noc1C ZINC000195518546 388165733 /nfs/dbraw/zinc/16/57/33/388165733.db2.gz LHYFGCIKQDURQA-UHFFFAOYSA-N 1 2 248.330 2.047 20 0 BEADLO CC[N@@H+](Cc1cnn(C)c1)Cc1c(C)noc1C ZINC000195518546 388165735 /nfs/dbraw/zinc/16/57/35/388165735.db2.gz LHYFGCIKQDURQA-UHFFFAOYSA-N 1 2 248.330 2.047 20 0 BEADLO CC1(C)CN(Cc2[nH]cc[nH+]2)[C@H]1c1ccncc1 ZINC000646217180 388166876 /nfs/dbraw/zinc/16/68/76/388166876.db2.gz BPVDASJACIWDKV-ZDUSSCGKSA-N 1 2 242.326 2.388 20 0 BEADLO Cc1cccc2[nH+]cc(CNC(CF)CF)n21 ZINC000449378181 388188079 /nfs/dbraw/zinc/18/80/79/388188079.db2.gz CQQKDOXEAOOMBI-UHFFFAOYSA-N 1 2 239.269 2.040 20 0 BEADLO Cc1cccc2ncc(C[NH2+]C(CF)CF)n21 ZINC000449378181 388188084 /nfs/dbraw/zinc/18/80/84/388188084.db2.gz CQQKDOXEAOOMBI-UHFFFAOYSA-N 1 2 239.269 2.040 20 0 BEADLO CCC(C)(CC)C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000646260787 388171432 /nfs/dbraw/zinc/17/14/32/388171432.db2.gz HSWAFRQWUCGJSN-UHFFFAOYSA-N 1 2 235.331 2.121 20 0 BEADLO CCC(C)(CC)C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000646260787 388171434 /nfs/dbraw/zinc/17/14/34/388171434.db2.gz HSWAFRQWUCGJSN-UHFFFAOYSA-N 1 2 235.331 2.121 20 0 BEADLO O=C(C1CCCCCC1)N1CCc2[nH]c[nH+]c2C1 ZINC000646259592 388171761 /nfs/dbraw/zinc/17/17/61/388171761.db2.gz NLAPIZHVISBUEF-UHFFFAOYSA-N 1 2 247.342 2.265 20 0 BEADLO O=C(C1CCCCCC1)N1CCc2[nH+]c[nH]c2C1 ZINC000646259592 388171765 /nfs/dbraw/zinc/17/17/65/388171765.db2.gz NLAPIZHVISBUEF-UHFFFAOYSA-N 1 2 247.342 2.265 20 0 BEADLO C[C@@H]1CCC[C@@H](C(=O)N2CCc3[nH]c[nH+]c3C2)C1 ZINC000646260687 388171788 /nfs/dbraw/zinc/17/17/88/388171788.db2.gz ZRTHBNPCXUZQTL-GHMZBOCLSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@@H]1CCC[C@@H](C(=O)N2CCc3[nH+]c[nH]c3C2)C1 ZINC000646260687 388171789 /nfs/dbraw/zinc/17/17/89/388171789.db2.gz ZRTHBNPCXUZQTL-GHMZBOCLSA-N 1 2 247.342 2.121 20 0 BEADLO O=C(CC1=CCCCC1)N1CCc2[nH]c[nH+]c2C1 ZINC000646260555 388171874 /nfs/dbraw/zinc/17/18/74/388171874.db2.gz RBYWGSPSMZASLH-UHFFFAOYSA-N 1 2 245.326 2.185 20 0 BEADLO O=C(CC1=CCCCC1)N1CCc2[nH+]c[nH]c2C1 ZINC000646260555 388171876 /nfs/dbraw/zinc/17/18/76/388171876.db2.gz RBYWGSPSMZASLH-UHFFFAOYSA-N 1 2 245.326 2.185 20 0 BEADLO CCC[C@H](C(=O)N1CCc2[nH]c[nH+]c2C1)C(C)C ZINC000646259034 388172064 /nfs/dbraw/zinc/17/20/64/388172064.db2.gz AYNVBQUCLMDNSA-NSHDSACASA-N 1 2 249.358 2.367 20 0 BEADLO CCC[C@H](C(=O)N1CCc2[nH+]c[nH]c2C1)C(C)C ZINC000646259034 388172066 /nfs/dbraw/zinc/17/20/66/388172066.db2.gz AYNVBQUCLMDNSA-NSHDSACASA-N 1 2 249.358 2.367 20 0 BEADLO Cc1cc(C[NH2+]C(CF)CF)cs1 ZINC000449378123 388188282 /nfs/dbraw/zinc/18/82/82/388188282.db2.gz CIJZVQVVZJPXOJ-UHFFFAOYSA-N 1 2 205.273 2.454 20 0 BEADLO COc1ccsc1C[N@H+](C(C)C)C1COC1 ZINC000449348962 388178581 /nfs/dbraw/zinc/17/85/81/388178581.db2.gz DKZREILVDMJDGL-UHFFFAOYSA-N 1 2 241.356 2.366 20 0 BEADLO COc1ccsc1C[N@@H+](C(C)C)C1COC1 ZINC000449348962 388178583 /nfs/dbraw/zinc/17/85/83/388178583.db2.gz DKZREILVDMJDGL-UHFFFAOYSA-N 1 2 241.356 2.366 20 0 BEADLO CC[C@@H](NCc1cn2ccccc2[nH+]1)C(F)F ZINC000449364182 388182490 /nfs/dbraw/zinc/18/24/90/388182490.db2.gz RHFCGGVQOKQPHM-SNVBAGLBSA-N 1 2 239.269 2.468 20 0 BEADLO COc1ccc(C[NH2+]C(CF)CF)cc1 ZINC000449373354 388185548 /nfs/dbraw/zinc/18/55/48/388185548.db2.gz QLIKLEPWKPOBJB-UHFFFAOYSA-N 1 2 215.243 2.092 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000448890850 388117562 /nfs/dbraw/zinc/11/75/62/388117562.db2.gz NBSBKSPQZPGUAR-IJLUTSLNSA-N 1 2 247.342 2.162 20 0 BEADLO COc1ccc(C[NH2+]C(CF)CF)c(OC)c1 ZINC000449374169 388185991 /nfs/dbraw/zinc/18/59/91/388185991.db2.gz XRARLPNIBSWMMF-UHFFFAOYSA-N 1 2 245.269 2.101 20 0 BEADLO CCn1nnc(C)c1C[N@H+](C)Cc1ccoc1C ZINC000449014909 388130268 /nfs/dbraw/zinc/13/02/68/388130268.db2.gz ASVXWUMNRWFJGC-UHFFFAOYSA-N 1 2 248.330 2.140 20 0 BEADLO CCn1nnc(C)c1C[N@@H+](C)Cc1ccoc1C ZINC000449014909 388130270 /nfs/dbraw/zinc/13/02/70/388130270.db2.gz ASVXWUMNRWFJGC-UHFFFAOYSA-N 1 2 248.330 2.140 20 0 BEADLO CC1(C)CC=C(C(=O)NCCn2cc[nH+]c2)CC1 ZINC000454703524 388130982 /nfs/dbraw/zinc/13/09/82/388130982.db2.gz FONPVRBGYRMFMZ-UHFFFAOYSA-N 1 2 247.342 2.136 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)C1=CC[C@H](C)CC1 ZINC000454747767 388132319 /nfs/dbraw/zinc/13/23/19/388132319.db2.gz CJJCZFRWDYVHOR-NWDGAFQWSA-N 1 2 247.342 2.134 20 0 BEADLO CC[C@H]([NH2+]Cc1cnn[nH]1)c1csc(C)c1 ZINC000646126878 388148049 /nfs/dbraw/zinc/14/80/49/388148049.db2.gz GEVFSXTYPPSQEY-NSHDSACASA-N 1 2 236.344 2.416 20 0 BEADLO CC[C@H]([NH2+]Cc1c[nH]nn1)c1csc(C)c1 ZINC000646126878 388148051 /nfs/dbraw/zinc/14/80/51/388148051.db2.gz GEVFSXTYPPSQEY-NSHDSACASA-N 1 2 236.344 2.416 20 0 BEADLO CC[C@H]([NH2+]Cc1cn[nH]n1)c1csc(C)c1 ZINC000646126878 388148052 /nfs/dbraw/zinc/14/80/52/388148052.db2.gz GEVFSXTYPPSQEY-NSHDSACASA-N 1 2 236.344 2.416 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2cnccn2)o1 ZINC000070025780 388254938 /nfs/dbraw/zinc/25/49/38/388254938.db2.gz MGRXQPABQHORPJ-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO COc1ccsc1C[NH2+]C(CF)CF ZINC000449381994 388189063 /nfs/dbraw/zinc/18/90/63/388189063.db2.gz UNACOWKGMATLOX-UHFFFAOYSA-N 1 2 221.272 2.154 20 0 BEADLO C[C@H]([NH2+]C(CF)CF)c1ccccn1 ZINC000449380459 388189142 /nfs/dbraw/zinc/18/91/42/388189142.db2.gz NDTNWDMLLXHJKC-QMMMGPOBSA-N 1 2 200.232 2.040 20 0 BEADLO CC(C)Cn1cc(C[N@@H+]2CC[C@H](F)C2)cn1 ZINC000449392314 388193107 /nfs/dbraw/zinc/19/31/07/388193107.db2.gz JQGPHGBREGVOQM-LBPRGKRZSA-N 1 2 225.311 2.083 20 0 BEADLO CC(C)Cn1cc(C[N@H+]2CC[C@H](F)C2)cn1 ZINC000449392314 388193109 /nfs/dbraw/zinc/19/31/09/388193109.db2.gz JQGPHGBREGVOQM-LBPRGKRZSA-N 1 2 225.311 2.083 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)CC(C)C ZINC000456353472 388196406 /nfs/dbraw/zinc/19/64/06/388196406.db2.gz OPANEZCWKRDYEN-SNVBAGLBSA-N 1 2 223.320 2.126 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)c1ccccc1 ZINC000456356783 388196508 /nfs/dbraw/zinc/19/65/08/388196508.db2.gz RYQWMZKTGIITAX-NSHDSACASA-N 1 2 243.310 2.394 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@@H]1C[C@@H]1C1CC1 ZINC000456356442 388196529 /nfs/dbraw/zinc/19/65/29/388196529.db2.gz OVYHROFOJNUUIO-MVWJERBFSA-N 1 2 247.342 2.126 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)c1[nH]ccc1C ZINC000456353504 388197081 /nfs/dbraw/zinc/19/70/81/388197081.db2.gz MPWYJXHFYIBTLP-SNVBAGLBSA-N 1 2 246.314 2.031 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)C1=CCCC1 ZINC000456367755 388197260 /nfs/dbraw/zinc/19/72/60/388197260.db2.gz XEQPQDXFZIKXDJ-SNVBAGLBSA-N 1 2 233.315 2.191 20 0 BEADLO CC[C@H](C)CC(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456417595 388200306 /nfs/dbraw/zinc/20/03/06/388200306.db2.gz KSEXIYMGPLMKGA-GARJFASQSA-N 1 2 235.331 2.441 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)N[C@@H]2C[C@@H](C)n3cc[nH+]c32)C1 ZINC000456437198 388201189 /nfs/dbraw/zinc/20/11/89/388201189.db2.gz WVLSDEDTCNZLJM-WISYIIOYSA-N 1 2 247.342 2.441 20 0 BEADLO COCc1cnc(C[N@@H+]2CC[C@H]2C2CC2)s1 ZINC000449427356 388202936 /nfs/dbraw/zinc/20/29/36/388202936.db2.gz NQSFRPBQHJCZNC-NSHDSACASA-N 1 2 238.356 2.274 20 0 BEADLO COCc1cnc(C[N@H+]2CC[C@H]2C2CC2)s1 ZINC000449427356 388202938 /nfs/dbraw/zinc/20/29/38/388202938.db2.gz NQSFRPBQHJCZNC-NSHDSACASA-N 1 2 238.356 2.274 20 0 BEADLO CC(C)c1nnc(C[N@H+](C)[C@@H]2CC2(C)C)o1 ZINC000489480883 388217741 /nfs/dbraw/zinc/21/77/41/388217741.db2.gz MRRXTXOLHMWQHT-SECBINFHSA-N 1 2 223.320 2.423 20 0 BEADLO CC(C)c1nnc(C[N@@H+](C)[C@@H]2CC2(C)C)o1 ZINC000489480883 388217743 /nfs/dbraw/zinc/21/77/43/388217743.db2.gz MRRXTXOLHMWQHT-SECBINFHSA-N 1 2 223.320 2.423 20 0 BEADLO CC[C@H]1CCCCN1c1nc(C)[nH+]c(N(C)C)n1 ZINC000489494489 388218213 /nfs/dbraw/zinc/21/82/13/388218213.db2.gz JQFIQFKRPSXRHJ-NSHDSACASA-N 1 2 249.362 2.015 20 0 BEADLO CC[C@H]1CCCCN1c1nc(N(C)C)nc(C)[nH+]1 ZINC000489494489 388218215 /nfs/dbraw/zinc/21/82/15/388218215.db2.gz JQFIQFKRPSXRHJ-NSHDSACASA-N 1 2 249.362 2.015 20 0 BEADLO Fc1ccc(CC2([NH2+]Cc3ccn[nH]3)CC2)cc1 ZINC000449567418 388234879 /nfs/dbraw/zinc/23/48/79/388234879.db2.gz UAXNGHLLJXLACA-UHFFFAOYSA-N 1 2 245.301 2.414 20 0 BEADLO COC1C[NH+](Cc2ccc(C)c(Cl)c2)C1 ZINC000459576743 388246435 /nfs/dbraw/zinc/24/64/35/388246435.db2.gz HAPGHIWSSMBWBZ-UHFFFAOYSA-N 1 2 225.719 2.479 20 0 BEADLO COC1C[NH+](Cc2ccc3c(c2)CC(C)(C)O3)C1 ZINC000459577621 388246453 /nfs/dbraw/zinc/24/64/53/388246453.db2.gz HNGFHRAPVVDHTN-UHFFFAOYSA-N 1 2 247.338 2.231 20 0 BEADLO C/C=C/C=C\C(=O)N1CCC[C@H]1Cn1cc[nH+]c1 ZINC000492063561 388333276 /nfs/dbraw/zinc/33/32/76/388333276.db2.gz CSRFWDNZCIPFGV-XGZIJWKSSA-N 1 2 245.326 2.006 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)/C=C\C1CCCCC1 ZINC000491845675 388324562 /nfs/dbraw/zinc/32/45/62/388324562.db2.gz NZMXHRXKOHGAIL-FPLPWBNLSA-N 1 2 247.342 2.173 20 0 BEADLO CC(C)Cn1cc[nH+]c1CNC(=O)/C=C\C1CC1 ZINC000491912738 388327666 /nfs/dbraw/zinc/32/76/66/388327666.db2.gz VTWFCFPGOUXNPP-WAYWQWQTSA-N 1 2 247.342 2.122 20 0 BEADLO O=C(/C=C\C1CC1)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000491931190 388328499 /nfs/dbraw/zinc/32/84/99/388328499.db2.gz YEPBRXSYFOLLRM-FOQNGQEVSA-N 1 2 245.326 2.082 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N1CCC(C)(C)C1 ZINC000492322899 388341324 /nfs/dbraw/zinc/34/13/24/388341324.db2.gz XWNJPHWEDSEIDM-WAYWQWQTSA-N 1 2 247.342 2.175 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N1CC[C@@H]1C(C)C ZINC000492387207 388343141 /nfs/dbraw/zinc/34/31/41/388343141.db2.gz PAIDGZVRXFDJEE-FOQNGQEVSA-N 1 2 247.342 2.173 20 0 BEADLO CC[C@@H]1CCN(C(=O)/C=C\c2[nH+]ccn2CC)C1 ZINC000492411048 388343669 /nfs/dbraw/zinc/34/36/69/388343669.db2.gz SCKXQCWOUVGURC-FOQNGQEVSA-N 1 2 247.342 2.175 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccsc1)c1ncn(C)n1 ZINC000275705995 388345707 /nfs/dbraw/zinc/34/57/07/388345707.db2.gz LPDMAPUUGVQABY-DTWKUNHWSA-N 1 2 236.344 2.288 20 0 BEADLO CC[C@@H](CSC)Nc1nc[nH+]c(N)c1Cl ZINC000233881274 388349257 /nfs/dbraw/zinc/34/92/57/388349257.db2.gz XXPWQEBMUXVIEK-LURJTMIESA-N 1 2 246.767 2.266 20 0 BEADLO CC[C@@H](CSC)Nc1[nH+]cnc(N)c1Cl ZINC000233881274 388349262 /nfs/dbraw/zinc/34/92/62/388349262.db2.gz XXPWQEBMUXVIEK-LURJTMIESA-N 1 2 246.767 2.266 20 0 BEADLO CO[C@@H](C)[C@@H](C)Nc1cc[nH+]c(C2CC2)n1 ZINC000290754877 388369644 /nfs/dbraw/zinc/36/96/44/388369644.db2.gz SXTJFPPKEKLPSX-BDAKNGLRSA-N 1 2 221.304 2.189 20 0 BEADLO C[C@@H]1C[C@@H](C)CN(c2nc[nH+]c(N)c2Cl)C1 ZINC000227840700 388371690 /nfs/dbraw/zinc/37/16/90/388371690.db2.gz XEMVKWLQHTYCPG-HTQZYQBOSA-N 1 2 240.738 2.195 20 0 BEADLO C[C@@H]1C[C@@H](C)CN(c2[nH+]cnc(N)c2Cl)C1 ZINC000227840700 388371692 /nfs/dbraw/zinc/37/16/92/388371692.db2.gz XEMVKWLQHTYCPG-HTQZYQBOSA-N 1 2 240.738 2.195 20 0 BEADLO O=C(Cn1cc[nH+]c1)Nc1cccc2cc[nH]c21 ZINC000572746115 388372313 /nfs/dbraw/zinc/37/23/13/388372313.db2.gz GMLUNTGSCLFHIR-UHFFFAOYSA-N 1 2 240.266 2.003 20 0 BEADLO COc1ccccc1[C@@H](CO)Nc1cccc[nH+]1 ZINC000524687709 388374755 /nfs/dbraw/zinc/37/47/55/388374755.db2.gz KZRLPGXXSBRVHG-GFCCVEGCSA-N 1 2 244.294 2.236 20 0 BEADLO CC1=C[C@@H](C)C[N@H+](Cc2nnc(C3CC3)o2)C1 ZINC000572938330 388392674 /nfs/dbraw/zinc/39/26/74/388392674.db2.gz DXSKDXPDLPSDIF-SECBINFHSA-N 1 2 233.315 2.345 20 0 BEADLO CC1=C[C@@H](C)C[N@@H+](Cc2nnc(C3CC3)o2)C1 ZINC000572938330 388392677 /nfs/dbraw/zinc/39/26/77/388392677.db2.gz DXSKDXPDLPSDIF-SECBINFHSA-N 1 2 233.315 2.345 20 0 BEADLO CC(C)c1nn(C)cc1N[C@H]1CCn2cc[nH+]c21 ZINC000294193032 388396869 /nfs/dbraw/zinc/39/68/69/388396869.db2.gz SOBAQJUAYQSRRC-JTQLQIEISA-N 1 2 245.330 2.297 20 0 BEADLO O=C(/C=C/C1CCC1)NCCCCn1cc[nH+]c1 ZINC000492083494 388333985 /nfs/dbraw/zinc/33/39/85/388333985.db2.gz IQMYSLAEDIAHDY-VOTSOKGWSA-N 1 2 247.342 2.136 20 0 BEADLO CC=C(C=CC(=O)NCc1[nH]c[nH+]c1C)CC ZINC000492171504 388337310 /nfs/dbraw/zinc/33/73/10/388337310.db2.gz SGNDWDWIZXCOFW-HNGDNPSASA-N 1 2 233.315 2.247 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N(C)CC(C)C ZINC000492264380 388339561 /nfs/dbraw/zinc/33/95/61/388339561.db2.gz WQOGZXJAJFOORR-VOTSOKGWSA-N 1 2 235.331 2.031 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)NC1(C)CCCC1 ZINC000492275034 388340094 /nfs/dbraw/zinc/34/00/94/388340094.db2.gz KOAFIKDJFZBJIF-VOTSOKGWSA-N 1 2 247.342 2.365 20 0 BEADLO CO[C@H](C)Cn1c[nH+]c2cc(F)c(F)cc21 ZINC000167328479 388440995 /nfs/dbraw/zinc/44/09/95/388440995.db2.gz OSUTXGZWOFFPFQ-SSDOTTSWSA-N 1 2 226.226 2.349 20 0 BEADLO O=C(Cn1cc[nH+]c1)N1CCCC[C@@H]1C1CCC1 ZINC000649197519 388455623 /nfs/dbraw/zinc/45/56/23/388455623.db2.gz OLRMKIHCJMDSLR-CYBMUJFWSA-N 1 2 247.342 2.064 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@H]1CS[C@@H](C(C)(C)C)C1 ZINC000309578233 388458439 /nfs/dbraw/zinc/45/84/39/388458439.db2.gz POMAPUZLIXQZPH-OPRDCNLKSA-N 1 2 245.388 2.058 20 0 BEADLO FCCCCNc1cc[nH+]c2ccncc12 ZINC000336717447 388467582 /nfs/dbraw/zinc/46/75/82/388467582.db2.gz WTRPWYDWRXIVME-UHFFFAOYSA-N 1 2 219.263 2.213 20 0 BEADLO Cc1c[nH+]c(CNc2cncc(C)c2)n1C ZINC000336732420 388471292 /nfs/dbraw/zinc/47/12/92/388471292.db2.gz JMUHNGXKEFHCES-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO CCn1cc[nH+]c1CN1CCc2ccccc21 ZINC000195513724 388474953 /nfs/dbraw/zinc/47/49/53/388474953.db2.gz UTZQXJYMHNQUEF-UHFFFAOYSA-N 1 2 227.311 2.466 20 0 BEADLO CC1(C)CCCN1CC[NH2+]Cc1nccs1 ZINC000648870655 388476275 /nfs/dbraw/zinc/47/62/75/388476275.db2.gz AKMPFJQAZNYAFS-UHFFFAOYSA-N 1 2 239.388 2.107 20 0 BEADLO COC[C@@H](C)Nc1ccc(SC)c[nH+]1 ZINC000134308652 388476322 /nfs/dbraw/zinc/47/63/22/388476322.db2.gz XODVWIDDPSJSGG-MRVPVSSYSA-N 1 2 212.318 2.250 20 0 BEADLO CC(C)c1nc(N[C@@H]2CCC[C@@H]2F)cc[nH+]1 ZINC000338848021 388478076 /nfs/dbraw/zinc/47/80/76/388478076.db2.gz YXRNGIALQFKBIY-VHSXEESVSA-N 1 2 223.295 2.324 20 0 BEADLO CCOc1nnc(C[N@H+](C)C(C)(C)C)s1 ZINC000573061946 388415290 /nfs/dbraw/zinc/41/52/90/388415290.db2.gz SYYBXNLOQLJAJV-UHFFFAOYSA-N 1 2 229.349 2.167 20 0 BEADLO CCOc1nnc(C[N@@H+](C)C(C)(C)C)s1 ZINC000573061946 388415292 /nfs/dbraw/zinc/41/52/92/388415292.db2.gz SYYBXNLOQLJAJV-UHFFFAOYSA-N 1 2 229.349 2.167 20 0 BEADLO CO[C@@H](C)c1noc(C[N@@H+]2CCCC[C@H]2C)n1 ZINC000245479742 388420121 /nfs/dbraw/zinc/42/01/21/388420121.db2.gz WPQHNULQTOTSHQ-ZJUUUORDSA-N 1 2 239.319 2.151 20 0 BEADLO CO[C@@H](C)c1noc(C[N@H+]2CCCC[C@H]2C)n1 ZINC000245479742 388420123 /nfs/dbraw/zinc/42/01/23/388420123.db2.gz WPQHNULQTOTSHQ-ZJUUUORDSA-N 1 2 239.319 2.151 20 0 BEADLO CC[C@H](C)NC(=O)c1ccn2c(C)c[nH+]c2c1 ZINC000573134362 388422748 /nfs/dbraw/zinc/42/27/48/388422748.db2.gz HHLGOCPTCGMBBY-VIFPVBQESA-N 1 2 231.299 2.171 20 0 BEADLO CC[C@H](CC(C)C)C(=O)NCc1[nH]cc[nH+]1 ZINC000308083332 388431279 /nfs/dbraw/zinc/43/12/79/388431279.db2.gz BNDJPPNIZPXSHG-SNVBAGLBSA-N 1 2 223.320 2.098 20 0 BEADLO COC(=O)C[N@H+](C/C=C/Cl)C1CCCC1 ZINC000134881234 388479995 /nfs/dbraw/zinc/47/99/95/388479995.db2.gz RGKIMSUEZSFQNR-QPJJXVBHSA-N 1 2 231.723 2.157 20 0 BEADLO COC(=O)C[N@@H+](C/C=C/Cl)C1CCCC1 ZINC000134881234 388480000 /nfs/dbraw/zinc/48/00/00/388480000.db2.gz RGKIMSUEZSFQNR-QPJJXVBHSA-N 1 2 231.723 2.157 20 0 BEADLO CC(C)(O)C(C)(C)CNc1cccc[nH+]1 ZINC000393567748 388434235 /nfs/dbraw/zinc/43/42/35/388434235.db2.gz FYXVHSBXEWDFQN-UHFFFAOYSA-N 1 2 208.305 2.291 20 0 BEADLO CC[C@@H](C)CN(C)C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000517172213 388540916 /nfs/dbraw/zinc/54/09/16/388540916.db2.gz UZFMMTOHNZADPT-GHMZBOCLSA-N 1 2 237.347 2.093 20 0 BEADLO CC[C@@H](C)CN(C)C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000517172213 388540919 /nfs/dbraw/zinc/54/09/19/388540919.db2.gz UZFMMTOHNZADPT-GHMZBOCLSA-N 1 2 237.347 2.093 20 0 BEADLO C[C@H](O)C[N@H+](CC(F)F)CC1CC(C)(C)C1 ZINC000528522917 388542709 /nfs/dbraw/zinc/54/27/09/388542709.db2.gz WYUQLGZKDPANKL-VIFPVBQESA-N 1 2 235.318 2.371 20 0 BEADLO C[C@H](O)C[N@@H+](CC(F)F)CC1CC(C)(C)C1 ZINC000528522917 388542710 /nfs/dbraw/zinc/54/27/10/388542710.db2.gz WYUQLGZKDPANKL-VIFPVBQESA-N 1 2 235.318 2.371 20 0 BEADLO CC[C@H](C)C(=O)N(C)c1ccc[nH+]c1N(C)C ZINC000079725951 388545669 /nfs/dbraw/zinc/54/56/69/388545669.db2.gz BAYMIDHKWZXCTI-JTQLQIEISA-N 1 2 235.331 2.157 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)CC(C)(C)C1CC1 ZINC000340059350 388487665 /nfs/dbraw/zinc/48/76/65/388487665.db2.gz PHIVQYVUMKWQBO-UHFFFAOYSA-N 1 2 235.331 2.194 20 0 BEADLO CCCC[C@H]([NH2+]C[C@@H](C)SC)C(=O)OC ZINC000135255979 388488292 /nfs/dbraw/zinc/48/82/92/388488292.db2.gz LWNNMTMICGMTQR-ZJUUUORDSA-N 1 2 233.377 2.059 20 0 BEADLO COc1cc(F)cc(C[NH2+]CC(F)F)c1 ZINC000312250712 388508279 /nfs/dbraw/zinc/50/82/79/388508279.db2.gz AMIYHSLYYBIUCP-UHFFFAOYSA-N 1 2 219.206 2.189 20 0 BEADLO COCc1nc(C[NH+]2[C@@H](C)C[C@@H]2C)cs1 ZINC000548097465 388510609 /nfs/dbraw/zinc/51/06/09/388510609.db2.gz URLCOSNZWWCHQJ-IUCAKERBSA-N 1 2 226.345 2.272 20 0 BEADLO Cc1ncc(C[NH2+]Cc2cccc3c2OCO3)o1 ZINC000397904239 388510926 /nfs/dbraw/zinc/51/09/26/388510926.db2.gz DEEZTXGLKCNLDM-UHFFFAOYSA-N 1 2 246.266 2.002 20 0 BEADLO CCC[C@H]([NH2+][C@H]1CS[C@@H](C)C1)C(=O)OCC ZINC000397941781 388512573 /nfs/dbraw/zinc/51/25/73/388512573.db2.gz QMRKQSIRMDUPQF-AXFHLTTASA-N 1 2 245.388 2.202 20 0 BEADLO C[C@@H]1C[C@H](NCc2nccs2)c2[nH+]ccn21 ZINC000345362961 388513034 /nfs/dbraw/zinc/51/30/34/388513034.db2.gz VWHILRYBVNRVFA-BDAKNGLRSA-N 1 2 234.328 2.135 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H]1C[C@H]1C1CCC1 ZINC000517034364 256812533 /nfs/dbraw/zinc/81/25/33/256812533.db2.gz WSMCEIPEGLGRHJ-WDEREUQCSA-N 1 2 246.310 2.465 20 0 BEADLO C[C@H]1CCCC[C@H]1CC(=O)NCCn1cc[nH+]c1 ZINC000516840752 388519648 /nfs/dbraw/zinc/51/96/48/388519648.db2.gz DHBNOSSSVGWOSK-STQMWFEESA-N 1 2 249.358 2.216 20 0 BEADLO CO[C@H](Cn1cc[nH+]c1)c1ccc(F)cc1 ZINC000528406821 388520873 /nfs/dbraw/zinc/52/08/73/388520873.db2.gz ZBZWSQIJNZCNJE-GFCCVEGCSA-N 1 2 220.247 2.410 20 0 BEADLO C/C(Cl)=C\C[N@H+]1CCO[C@H](C)[C@H]1C ZINC000528404849 388520946 /nfs/dbraw/zinc/52/09/46/388520946.db2.gz OCWQMYIRGNMTGE-PSVJHUJZSA-N 1 2 203.713 2.238 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1CCO[C@H](C)[C@H]1C ZINC000528404849 388520950 /nfs/dbraw/zinc/52/09/50/388520950.db2.gz OCWQMYIRGNMTGE-PSVJHUJZSA-N 1 2 203.713 2.238 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000528437561 388526901 /nfs/dbraw/zinc/52/69/01/388526901.db2.gz IUKFHWHVGHQBBU-NOQGZOHOSA-N 1 2 203.713 2.238 20 0 BEADLO C/C(Cl)=C/C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000528437561 388526902 /nfs/dbraw/zinc/52/69/02/388526902.db2.gz IUKFHWHVGHQBBU-NOQGZOHOSA-N 1 2 203.713 2.238 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1CCO[C@H](COC(C)C)C1 ZINC000528461061 388530287 /nfs/dbraw/zinc/53/02/87/388530287.db2.gz ZSAXHQNSOYABEE-MCWZUMHDSA-N 1 2 247.766 2.255 20 0 BEADLO C/C(Cl)=C/C[N@H+]1CCO[C@H](COC(C)C)C1 ZINC000528461061 388530291 /nfs/dbraw/zinc/53/02/91/388530291.db2.gz ZSAXHQNSOYABEE-MCWZUMHDSA-N 1 2 247.766 2.255 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N(C)C1CC(C)(C)C1 ZINC000517040759 388534761 /nfs/dbraw/zinc/53/47/61/388534761.db2.gz XJFDSGMFSZBUTK-SNVBAGLBSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N(C)C1CC(C)(C)C1 ZINC000517040759 388534763 /nfs/dbraw/zinc/53/47/63/388534763.db2.gz XJFDSGMFSZBUTK-SNVBAGLBSA-N 1 2 249.358 2.235 20 0 BEADLO CCc1noc([C@@H](C)[N@H+]2[C@H](C)C[C@@H]2C)n1 ZINC000548424816 388535669 /nfs/dbraw/zinc/53/56/69/388535669.db2.gz XAYXOJYEPPKIBM-HRDYMLBCSA-N 1 2 209.293 2.176 20 0 BEADLO CCc1noc([C@@H](C)[N@@H+]2[C@H](C)C[C@@H]2C)n1 ZINC000548424816 388535672 /nfs/dbraw/zinc/53/56/72/388535672.db2.gz XAYXOJYEPPKIBM-HRDYMLBCSA-N 1 2 209.293 2.176 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+]1CCCOC(C)(C)C1 ZINC000649315899 388604807 /nfs/dbraw/zinc/60/48/07/388604807.db2.gz AEHFWZPDECEXFV-VIFPVBQESA-N 1 2 241.360 2.100 20 0 BEADLO C[C@@H](c1csnn1)[N@H+]1CCCOC(C)(C)C1 ZINC000649315899 388604810 /nfs/dbraw/zinc/60/48/10/388604810.db2.gz AEHFWZPDECEXFV-VIFPVBQESA-N 1 2 241.360 2.100 20 0 BEADLO O=C(NCC1CCCC1)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000548738436 388556054 /nfs/dbraw/zinc/55/60/54/388556054.db2.gz HOYIBHWFIJDDJP-NSHDSACASA-N 1 2 247.342 2.136 20 0 BEADLO O=C(NCC1CCCC1)[C@H]1CCCc2[nH]c[nH+]c21 ZINC000548738436 388556055 /nfs/dbraw/zinc/55/60/55/388556055.db2.gz HOYIBHWFIJDDJP-NSHDSACASA-N 1 2 247.342 2.136 20 0 BEADLO COc1ccccc1NC(=O)C[N@H+]1[C@H](C)C[C@@H]1C ZINC000548754368 388556917 /nfs/dbraw/zinc/55/69/17/388556917.db2.gz BATDCUHZLDRFBF-PHIMTYICSA-N 1 2 248.326 2.116 20 0 BEADLO COc1ccccc1NC(=O)C[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548754368 388556920 /nfs/dbraw/zinc/55/69/20/388556920.db2.gz BATDCUHZLDRFBF-PHIMTYICSA-N 1 2 248.326 2.116 20 0 BEADLO Cc1cc(NC(=O)N(C)[C@@H]2CC2(C)C)c(C)c[nH+]1 ZINC000520930538 388558931 /nfs/dbraw/zinc/55/89/31/388558931.db2.gz SUGVNORGNHXLLB-GFCCVEGCSA-N 1 2 247.342 2.383 20 0 BEADLO C[C@@H](NC(=O)Cc1c[nH+]cn1C)C1CCCCC1 ZINC000548813236 388562822 /nfs/dbraw/zinc/56/28/22/388562822.db2.gz RICQKIDMPHNJJH-LLVKDONJSA-N 1 2 249.358 2.048 20 0 BEADLO CC(C)n1cnnc1C[N@H+](C)CC1(C)CC1 ZINC000521163737 388563054 /nfs/dbraw/zinc/56/30/54/388563054.db2.gz SQYXFOPCJAMPHZ-UHFFFAOYSA-N 1 2 222.336 2.091 20 0 BEADLO CC(C)n1cnnc1C[N@@H+](C)CC1(C)CC1 ZINC000521163737 388563058 /nfs/dbraw/zinc/56/30/58/388563058.db2.gz SQYXFOPCJAMPHZ-UHFFFAOYSA-N 1 2 222.336 2.091 20 0 BEADLO CCc1nnc(C[N@@H+]2CCC(F)(F)C[C@@H]2C)o1 ZINC000528764214 388568738 /nfs/dbraw/zinc/56/87/38/388568738.db2.gz DFPHRPPIDPXXBN-QMMMGPOBSA-N 1 2 245.273 2.252 20 0 BEADLO CCc1nnc(C[N@H+]2CCC(F)(F)C[C@@H]2C)o1 ZINC000528764214 388568740 /nfs/dbraw/zinc/56/87/40/388568740.db2.gz DFPHRPPIDPXXBN-QMMMGPOBSA-N 1 2 245.273 2.252 20 0 BEADLO Cc1cc(C[N@H+]2CCC(F)(F)C[C@@H]2C)nn1C ZINC000528764178 388569238 /nfs/dbraw/zinc/56/92/38/388569238.db2.gz CYOGYGJGGCWMSK-JTQLQIEISA-N 1 2 243.301 2.348 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(F)(F)C[C@@H]2C)nn1C ZINC000528764178 388569241 /nfs/dbraw/zinc/56/92/41/388569241.db2.gz CYOGYGJGGCWMSK-JTQLQIEISA-N 1 2 243.301 2.348 20 0 BEADLO Cc1cc(C[N@H+]2CCC(F)(F)C[C@H]2C)nn1C ZINC000528764181 388569796 /nfs/dbraw/zinc/56/97/96/388569796.db2.gz CYOGYGJGGCWMSK-SNVBAGLBSA-N 1 2 243.301 2.348 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(F)(F)C[C@H]2C)nn1C ZINC000528764181 388569798 /nfs/dbraw/zinc/56/97/98/388569798.db2.gz CYOGYGJGGCWMSK-SNVBAGLBSA-N 1 2 243.301 2.348 20 0 BEADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1cn(C)cn1 ZINC000528774747 388571695 /nfs/dbraw/zinc/57/16/95/388571695.db2.gz WDLCSDRXKHWLTO-SECBINFHSA-N 1 2 229.274 2.040 20 0 BEADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1cn(C)cn1 ZINC000528774747 388571697 /nfs/dbraw/zinc/57/16/97/388571697.db2.gz WDLCSDRXKHWLTO-SECBINFHSA-N 1 2 229.274 2.040 20 0 BEADLO C[C@H](CC(=O)N[C@@H]1CC12CCCC2)n1cc[nH+]c1 ZINC000521055105 256834539 /nfs/dbraw/zinc/83/45/39/256834539.db2.gz WFBOPMUHWGFGOU-VXGBXAGGSA-N 1 2 247.342 2.283 20 0 BEADLO CCC[C@@H]([NH2+]CC(F)(F)CO)c1cccnc1 ZINC000184705253 388581795 /nfs/dbraw/zinc/58/17/95/388581795.db2.gz GLWBSBJPOAWYFD-LLVKDONJSA-N 1 2 244.285 2.140 20 0 BEADLO CC(C)OCC[N@H+](C)[C@@H](C)C(=O)OC(C)(C)C ZINC000081569417 388584380 /nfs/dbraw/zinc/58/43/80/388584380.db2.gz GRURMUSAWJBNFL-NSHDSACASA-N 1 2 245.363 2.073 20 0 BEADLO CC(C)OCC[N@@H+](C)[C@@H](C)C(=O)OC(C)(C)C ZINC000081569417 388584382 /nfs/dbraw/zinc/58/43/82/388584382.db2.gz GRURMUSAWJBNFL-NSHDSACASA-N 1 2 245.363 2.073 20 0 BEADLO C[C@@H]1CCCC[C@@H]1[C@H]1NC(=O)[C@H]2CCCC[N@@H+]21 ZINC000248374191 388677500 /nfs/dbraw/zinc/67/75/00/388677500.db2.gz ONCNBKJSAIEDFD-XQHKEYJVSA-N 1 2 236.359 2.123 20 0 BEADLO C[C@@H]1CCCC[C@@H]1[C@H]1NC(=O)[C@H]2CCCC[N@H+]21 ZINC000248374191 388677501 /nfs/dbraw/zinc/67/75/01/388677501.db2.gz ONCNBKJSAIEDFD-XQHKEYJVSA-N 1 2 236.359 2.123 20 0 BEADLO C[C@@H]1CC[C@H]1[NH2+][C@H](c1cccs1)c1nnc[nH]1 ZINC000551201103 388623902 /nfs/dbraw/zinc/62/39/02/388623902.db2.gz PKAQLYIBOVZWHN-FXPVBKGRSA-N 1 2 248.355 2.344 20 0 BEADLO FC(F)C[N@H+](CC[C@H]1CCCO1)C1CC1 ZINC000189241439 388628023 /nfs/dbraw/zinc/62/80/23/388628023.db2.gz SFLGBEQOWUOODT-SNVBAGLBSA-N 1 2 219.275 2.285 20 0 BEADLO FC(F)C[N@@H+](CC[C@H]1CCCO1)C1CC1 ZINC000189241439 388628026 /nfs/dbraw/zinc/62/80/26/388628026.db2.gz SFLGBEQOWUOODT-SNVBAGLBSA-N 1 2 219.275 2.285 20 0 BEADLO C[C@@H]1CCCCN1C(=O)CCCn1cc[nH+]c1 ZINC000620409283 388646698 /nfs/dbraw/zinc/64/66/98/388646698.db2.gz KZTXJWWOPJDEMM-GFCCVEGCSA-N 1 2 235.331 2.064 20 0 BEADLO C[C@H]1CCCC[C@@H]1NC(=O)CCCn1cc[nH+]c1 ZINC000620409502 388646878 /nfs/dbraw/zinc/64/68/78/388646878.db2.gz QHWWFEHFZIMNIM-STQMWFEESA-N 1 2 249.358 2.358 20 0 BEADLO Cc1cc([NH2+]CCCCF)ccc1-n1cnnn1 ZINC000551929374 388647702 /nfs/dbraw/zinc/64/77/02/388647702.db2.gz CYCDTTNMKUZPDW-UHFFFAOYSA-N 1 2 249.293 2.132 20 0 BEADLO Cc1ccsc1CN1CC[NH+](C2CC2)CC1 ZINC000127931403 388734354 /nfs/dbraw/zinc/73/43/54/388734354.db2.gz RZVVTWABVBEUHE-UHFFFAOYSA-N 1 2 236.384 2.337 20 0 BEADLO CC[C@H](C(=O)OC)[N@H+](C)Cc1ccc(F)cc1 ZINC000194560564 388734693 /nfs/dbraw/zinc/73/46/93/388734693.db2.gz PTLNNUGBCCZSDE-GFCCVEGCSA-N 1 2 239.290 2.209 20 0 BEADLO CC[C@H](C(=O)OC)[N@@H+](C)Cc1ccc(F)cc1 ZINC000194560564 388734695 /nfs/dbraw/zinc/73/46/95/388734695.db2.gz PTLNNUGBCCZSDE-GFCCVEGCSA-N 1 2 239.290 2.209 20 0 BEADLO C[C@@H]([NH2+]Cc1nccs1)c1cncs1 ZINC000128155361 388739884 /nfs/dbraw/zinc/73/98/84/388739884.db2.gz PFBKGTYPHSIHGW-SSDOTTSWSA-N 1 2 225.342 2.450 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)Nc1ccnc(Cl)c1 ZINC000227686414 388754441 /nfs/dbraw/zinc/75/44/41/388754441.db2.gz FSMJXKZRJNXONX-VIFPVBQESA-N 1 2 236.706 2.432 20 0 BEADLO CCc1nc(C[N@H+](C(C)C)C2CC2)no1 ZINC000065431500 388694029 /nfs/dbraw/zinc/69/40/29/388694029.db2.gz UWELDMHIYMEBPK-UHFFFAOYSA-N 1 2 209.293 2.005 20 0 BEADLO CCc1nc(C[N@@H+](C(C)C)C2CC2)no1 ZINC000065431500 388694032 /nfs/dbraw/zinc/69/40/32/388694032.db2.gz UWELDMHIYMEBPK-UHFFFAOYSA-N 1 2 209.293 2.005 20 0 BEADLO CCc1nc(C[N@H+](C)[C@H](C)CCSC)no1 ZINC000126509417 388697045 /nfs/dbraw/zinc/69/70/45/388697045.db2.gz PKFXFUVLRXXBLP-SECBINFHSA-N 1 2 243.376 2.205 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@H](C)CCSC)no1 ZINC000126509417 388697048 /nfs/dbraw/zinc/69/70/48/388697048.db2.gz PKFXFUVLRXXBLP-SECBINFHSA-N 1 2 243.376 2.205 20 0 BEADLO COC(=O)C[N@H+](C)[C@H](C)c1ccccc1C ZINC000193426452 388704652 /nfs/dbraw/zinc/70/46/52/388704652.db2.gz HPZONSFJWDKEKT-LLVKDONJSA-N 1 2 221.300 2.161 20 0 BEADLO COC(=O)C[N@@H+](C)[C@H](C)c1ccccc1C ZINC000193426452 388704654 /nfs/dbraw/zinc/70/46/54/388704654.db2.gz HPZONSFJWDKEKT-LLVKDONJSA-N 1 2 221.300 2.161 20 0 BEADLO C[C@@H](NC(=O)c1ccoc1C1CC1)c1[nH]cc[nH+]1 ZINC000552557855 388725435 /nfs/dbraw/zinc/72/54/35/388725435.db2.gz OWAFTAJNBNVKGV-MRVPVSSYSA-N 1 2 245.282 2.371 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H]1CCOC[C@@H]1C ZINC000194314262 388728942 /nfs/dbraw/zinc/72/89/42/388728942.db2.gz UKESWHGGHIRMGQ-QWRGUYRKSA-N 1 2 234.299 2.001 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H](O)CC(C)(C)C ZINC000226128296 388731825 /nfs/dbraw/zinc/73/18/25/388731825.db2.gz YMONZROPPVFKRV-JTQLQIEISA-N 1 2 238.331 2.299 20 0 BEADLO CCN(C(=O)CCn1cc[nH+]c1)[C@@H](C)C(C)C ZINC000554215250 388804943 /nfs/dbraw/zinc/80/49/43/388804943.db2.gz BXVZRJRVCGKQEY-LBPRGKRZSA-N 1 2 237.347 2.166 20 0 BEADLO COc1ccccc1[C@H](CO)[NH2+]Cc1ccco1 ZINC000522536548 388760098 /nfs/dbraw/zinc/76/00/98/388760098.db2.gz ULKJPXKGOZGTJV-ZDUSSCGKSA-N 1 2 247.294 2.111 20 0 BEADLO Cc1cc(N[C@H](C)CF)nc(-c2ccncc2)[nH+]1 ZINC000340961609 177709560 /nfs/dbraw/zinc/70/95/60/177709560.db2.gz DTUPKPVHGUIDPL-SNVBAGLBSA-N 1 2 246.289 2.039 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@H]2CSC[C@H]2C)[nH+]1 ZINC000553678516 388786645 /nfs/dbraw/zinc/78/66/45/388786645.db2.gz FCANZMWCOYSCDD-XCBNKYQSSA-N 1 2 248.355 2.430 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@H]2CSC[C@@H]2C)[nH+]1 ZINC000553678517 388787209 /nfs/dbraw/zinc/78/72/09/388787209.db2.gz FCANZMWCOYSCDD-XVKPBYJWSA-N 1 2 248.355 2.430 20 0 BEADLO CC[C@@H]1CCCC[C@H]1NC(=O)Cc1c[nH+]cn1C ZINC000554501152 388816359 /nfs/dbraw/zinc/81/63/59/388816359.db2.gz IPOVUQVFRKQMQL-DGCLKSJQSA-N 1 2 249.358 2.048 20 0 BEADLO CC(C)C(=O)NCc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000540853423 388820899 /nfs/dbraw/zinc/82/08/99/388820899.db2.gz UIRKFJUXDOGBIG-UHFFFAOYSA-N 1 2 243.310 2.349 20 0 BEADLO CC(C)[C@@H]1CCN(c2nc[nH+]c(N)c2Cl)C1 ZINC000232719435 388856181 /nfs/dbraw/zinc/85/61/81/388856181.db2.gz XDDYRDDLWLSPJC-MRVPVSSYSA-N 1 2 240.738 2.195 20 0 BEADLO CC(C)[C@@H]1CCN(c2[nH+]cnc(N)c2Cl)C1 ZINC000232719435 388856183 /nfs/dbraw/zinc/85/61/83/388856183.db2.gz XDDYRDDLWLSPJC-MRVPVSSYSA-N 1 2 240.738 2.195 20 0 BEADLO COc1cc(C)c(C[NH2+]CC(C)(F)F)c(C)n1 ZINC000555609212 388857298 /nfs/dbraw/zinc/85/72/98/388857298.db2.gz CDNBRFHEOHKBRP-UHFFFAOYSA-N 1 2 244.285 2.452 20 0 BEADLO CC1(C)CC(CC(=O)N2CC(n3cc[nH+]c3)C2)C1 ZINC000556172019 388869342 /nfs/dbraw/zinc/86/93/42/388869342.db2.gz SUSNPOSZAGLHRI-UHFFFAOYSA-N 1 2 247.342 2.093 20 0 BEADLO F[C@H]1CCC[N@H+](Cc2cnc(C3CC3)nc2)C1 ZINC000564802538 388890493 /nfs/dbraw/zinc/89/04/93/388890493.db2.gz LRRUNCVWAZHIIM-LBPRGKRZSA-N 1 2 235.306 2.288 20 0 BEADLO F[C@H]1CCC[N@@H+](Cc2cnc(C3CC3)nc2)C1 ZINC000564802538 388890499 /nfs/dbraw/zinc/89/04/99/388890499.db2.gz LRRUNCVWAZHIIM-LBPRGKRZSA-N 1 2 235.306 2.288 20 0 BEADLO C[C@@H](CC(=O)NCC1(C2CC2)CC1)n1cc[nH+]c1 ZINC000565049130 388911802 /nfs/dbraw/zinc/91/18/02/388911802.db2.gz YXWJESMRSYJKIS-NSHDSACASA-N 1 2 247.342 2.141 20 0 BEADLO CCCn1cc(C[N@@H+]2CCC[C@H](F)C2)cn1 ZINC000565097857 388914894 /nfs/dbraw/zinc/91/48/94/388914894.db2.gz DFNDQOXGAGZCCG-LBPRGKRZSA-N 1 2 225.311 2.227 20 0 BEADLO CCCn1cc(C[N@H+]2CCC[C@H](F)C2)cn1 ZINC000565097857 388914896 /nfs/dbraw/zinc/91/48/96/388914896.db2.gz DFNDQOXGAGZCCG-LBPRGKRZSA-N 1 2 225.311 2.227 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000565191518 388923928 /nfs/dbraw/zinc/92/39/28/388923928.db2.gz LNALSHXVVRKKPE-DMDPSCGWSA-N 1 2 249.358 2.378 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000565191518 388923925 /nfs/dbraw/zinc/92/39/25/388923925.db2.gz LNALSHXVVRKKPE-DMDPSCGWSA-N 1 2 249.358 2.378 20 0 BEADLO c1cnc(C[N@@H+]2CCOCC23CCCCC3)cn1 ZINC000565761099 388967912 /nfs/dbraw/zinc/96/79/12/388967912.db2.gz MNPYBNBHVUAELG-UHFFFAOYSA-N 1 2 247.342 2.012 20 0 BEADLO c1cnc(C[N@H+]2CCOCC23CCCCC3)cn1 ZINC000565761099 388967915 /nfs/dbraw/zinc/96/79/15/388967915.db2.gz MNPYBNBHVUAELG-UHFFFAOYSA-N 1 2 247.342 2.012 20 0 BEADLO CCn1cc(N(Cc2c[nH+]c[nH]2)CC(C)C)cn1 ZINC000565900619 388977655 /nfs/dbraw/zinc/97/76/55/388977655.db2.gz OOXWTYGPSMHNSD-UHFFFAOYSA-N 1 2 247.346 2.289 20 0 BEADLO CCn1cc(N(Cc2c[nH]c[nH+]2)CC(C)C)cn1 ZINC000565900619 388977658 /nfs/dbraw/zinc/97/76/58/388977658.db2.gz OOXWTYGPSMHNSD-UHFFFAOYSA-N 1 2 247.346 2.289 20 0 BEADLO Cc1cc(N2C[C@@H](C)C[C@H](C)C2)nc[nH+]1 ZINC000097075509 132242436 /nfs/dbraw/zinc/24/24/36/132242436.db2.gz DECBAMWRGAMONK-UWVGGRQHSA-N 1 2 205.305 2.267 20 0 BEADLO CO[C@@H](C)CCNc1cc[nH+]c(C2CC2)n1 ZINC000264645461 388992339 /nfs/dbraw/zinc/99/23/39/388992339.db2.gz HEHSJPAYPXGJQI-VIFPVBQESA-N 1 2 221.304 2.191 20 0 BEADLO C[C@@](O)(CNc1cccc[nH+]1)c1ccsc1 ZINC000265833562 388994190 /nfs/dbraw/zinc/99/41/90/388994190.db2.gz LLVOYZCMRVCDJM-GFCCVEGCSA-N 1 2 234.324 2.463 20 0 BEADLO COC(=O)c1ccc(C[NH2+]Cc2occc2C)o1 ZINC000266172146 388995795 /nfs/dbraw/zinc/99/57/95/388995795.db2.gz CQBWMHFZKXAYMX-UHFFFAOYSA-N 1 2 249.266 2.257 20 0 BEADLO c1nc(C[NH2+][C@H]2CCCc3cn[nH]c32)cs1 ZINC000268853576 389006297 /nfs/dbraw/zinc/00/62/97/389006297.db2.gz QHOLWBSWSOZQQE-JTQLQIEISA-N 1 2 234.328 2.033 20 0 BEADLO c1nc(C[NH2+][C@H]2CCCc3c[nH]nc32)cs1 ZINC000268853576 389006300 /nfs/dbraw/zinc/00/63/00/389006300.db2.gz QHOLWBSWSOZQQE-JTQLQIEISA-N 1 2 234.328 2.033 20 0 BEADLO c1ccc2ncc(C[NH+]3CCOCC3)cc2c1 ZINC000269354041 389008593 /nfs/dbraw/zinc/00/85/93/389008593.db2.gz HCOROIPABHEHSM-UHFFFAOYSA-N 1 2 228.295 2.067 20 0 BEADLO Cc1c[nH]c(C[NH2+]Cc2ccccc2F)n1 ZINC000045205742 177641094 /nfs/dbraw/zinc/64/10/94/177641094.db2.gz USCHTJBHHYYCJI-UHFFFAOYSA-N 1 2 219.263 2.147 20 0 BEADLO C[C@@H](CCC1CC1)NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493193516 533521825 /nfs/dbraw/zinc/52/18/25/533521825.db2.gz SPVYJRYYBVRCSP-FGEFZZPRSA-N 1 2 233.315 2.118 20 0 BEADLO CC[C@@H]([NH2+]Cc1ncccc1F)c1ccn(C)n1 ZINC000530524268 322826165 /nfs/dbraw/zinc/82/61/65/322826165.db2.gz GQOLFVCCNCPKJB-LLVKDONJSA-N 1 2 248.305 2.195 20 0 BEADLO CC[C@H]1CN(c2cccc[nH+]2)C[C@H](C)O1 ZINC000264714568 132179659 /nfs/dbraw/zinc/17/96/59/132179659.db2.gz GVKSIAFRQBDHQS-QWRGUYRKSA-N 1 2 206.289 2.085 20 0 BEADLO c1cc(N2CCO[C@@H]3CCC[C@@H]32)nc(C2CC2)[nH+]1 ZINC000268016843 132190929 /nfs/dbraw/zinc/19/09/29/132190929.db2.gz GTQCFVHXQVNUNH-NWDGAFQWSA-N 1 2 245.326 2.112 20 0 BEADLO C[C@H]1CN(c2cccc[nH+]2)C[C@@H](C2CC2)O1 ZINC000280132568 132209799 /nfs/dbraw/zinc/20/97/99/132209799.db2.gz BFWVDCLDTOTPNB-JQWIXIFHSA-N 1 2 218.300 2.085 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CCC[C@H](F)C2)[nH+]1 ZINC000336324531 132246420 /nfs/dbraw/zinc/24/64/20/132246420.db2.gz VXXLIDKURRLTAP-VIFPVBQESA-N 1 2 234.278 2.205 20 0 BEADLO c1cc([C@@H]2CCCN(c3cccc[nH+]3)C2)n[nH]1 ZINC000301985867 132259426 /nfs/dbraw/zinc/25/94/26/132259426.db2.gz LVDADAWAINDRFW-LLVKDONJSA-N 1 2 228.299 2.189 20 0 BEADLO Cc1nc(N2CCC(C)(CO)CC2)c(C)c(C)[nH+]1 ZINC000302170697 132261393 /nfs/dbraw/zinc/26/13/93/132261393.db2.gz UDYARGFRAUQVMX-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO Cc1cc(N2CCCC3(CCOCC3)C2)nc[nH+]1 ZINC000361111446 132279948 /nfs/dbraw/zinc/27/99/48/132279948.db2.gz RQCYYHTWOAHFIT-UHFFFAOYSA-N 1 2 247.342 2.182 20 0 BEADLO Cc1nc(N2CCO[C@H](C3CC3)C2)c(C)c(C)[nH+]1 ZINC000372259989 132285879 /nfs/dbraw/zinc/28/58/79/132285879.db2.gz FDYJJRCGAVNXHF-ZDUSSCGKSA-N 1 2 247.342 2.017 20 0 BEADLO C[C@@H]1COc2ccccc2N1Cc1[nH+]ccn1C ZINC000072825990 132397539 /nfs/dbraw/zinc/39/75/39/132397539.db2.gz QZYNEYPBAGPZGP-LLVKDONJSA-N 1 2 243.310 2.208 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CCO[C@H](C)C1 ZINC000225869272 322840458 /nfs/dbraw/zinc/84/04/58/322840458.db2.gz AECSODVLXSMCGU-NXEZZACHSA-N 1 2 222.288 2.070 20 0 BEADLO CC(C)CC(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000334743793 133746398 /nfs/dbraw/zinc/74/63/98/133746398.db2.gz NADHBEBYZVILIZ-ZJUUUORDSA-N 1 2 221.304 2.051 20 0 BEADLO C[NH2+]Cc1noc([C@H](C)Cc2ccc(C)cc2)n1 ZINC000349932188 133926002 /nfs/dbraw/zinc/92/60/02/133926002.db2.gz DNYQOUPIGONEPK-LLVKDONJSA-N 1 2 245.326 2.444 20 0 BEADLO C[NH2+]Cc1noc(C(C)(C)c2ccc(F)cc2)n1 ZINC000349922765 133926306 /nfs/dbraw/zinc/92/63/06/133926306.db2.gz SLWYCAXUZZUVHR-UHFFFAOYSA-N 1 2 249.289 2.254 20 0 BEADLO C[C@@H]([NH2+]Cc1cccc2nccn21)c1ccon1 ZINC000351593390 133975356 /nfs/dbraw/zinc/97/53/56/133975356.db2.gz NIICLFAWIBEEIF-SNVBAGLBSA-N 1 2 242.282 2.173 20 0 BEADLO CCCC1(C(=O)NCCNc2cccc[nH+]2)CC1 ZINC000351914907 134001640 /nfs/dbraw/zinc/00/16/40/134001640.db2.gz GWMQWGWUXKNEGD-UHFFFAOYSA-N 1 2 247.342 2.190 20 0 BEADLO Cc1ccc(C[N@H+]2CCC(=O)[C@@H](C)C2)c(C)n1 ZINC000335926609 134009213 /nfs/dbraw/zinc/00/92/13/134009213.db2.gz RVIBZIQYBKTQID-JTQLQIEISA-N 1 2 232.327 2.109 20 0 BEADLO Cc1[nH]c(C(=O)NCc2ccc(C)cc2C)c[nH+]1 ZINC000335930154 134010463 /nfs/dbraw/zinc/01/04/63/134010463.db2.gz MODTZUHCIMDPAE-UHFFFAOYSA-N 1 2 243.310 2.265 20 0 BEADLO Cc1ccc(CN(C)c2ccn(C)n2)c(C)[nH+]1 ZINC000335938034 134013071 /nfs/dbraw/zinc/01/30/71/134013071.db2.gz HHVDVCCEMGZODO-UHFFFAOYSA-N 1 2 230.315 2.068 20 0 BEADLO CCOc1ccccc1C[N@@H+]1CCO[C@@H](C)C1 ZINC000192465772 134015418 /nfs/dbraw/zinc/01/54/18/134015418.db2.gz PJGPUCBOFIOIRA-LBPRGKRZSA-N 1 2 235.327 2.306 20 0 BEADLO CCOc1ccccc1C[N@H+]1CCO[C@@H](C)C1 ZINC000192465772 134015419 /nfs/dbraw/zinc/01/54/19/134015419.db2.gz PJGPUCBOFIOIRA-LBPRGKRZSA-N 1 2 235.327 2.306 20 0 BEADLO CC[C@H](F)C[N@@H+]1CCOc2cc(O)ccc2C1 ZINC000335945365 134020015 /nfs/dbraw/zinc/02/00/15/134020015.db2.gz GLJKLAKIUSGGQC-NSHDSACASA-N 1 2 239.290 2.335 20 0 BEADLO CC[C@H](F)C[N@H+]1CCOc2cc(O)ccc2C1 ZINC000335945365 134020016 /nfs/dbraw/zinc/02/00/16/134020016.db2.gz GLJKLAKIUSGGQC-NSHDSACASA-N 1 2 239.290 2.335 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H]1CC[C@@H](C)C1 ZINC000335954351 134022423 /nfs/dbraw/zinc/02/24/23/134022423.db2.gz XWBQBZLODQQEJS-KOLCDFICSA-N 1 2 218.300 2.187 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1CCC(C)(C)C1 ZINC000335960992 134026812 /nfs/dbraw/zinc/02/68/12/134026812.db2.gz CHQOHFLOXANQJE-SNVBAGLBSA-N 1 2 235.331 2.161 20 0 BEADLO c1nc(C[N@@H+]2CCOCC3(CC3)C2)oc1C1CC1 ZINC000335975401 134030949 /nfs/dbraw/zinc/03/09/49/134030949.db2.gz OJGRUJRUFUBKOY-UHFFFAOYSA-N 1 2 248.326 2.164 20 0 BEADLO c1nc(C[N@H+]2CCOCC3(CC3)C2)oc1C1CC1 ZINC000335975401 134030950 /nfs/dbraw/zinc/03/09/50/134030950.db2.gz OJGRUJRUFUBKOY-UHFFFAOYSA-N 1 2 248.326 2.164 20 0 BEADLO Cc1cc(C(=O)C[N@H+]2C[C@@H](C)[C@@H]2C)c(C)[nH]1 ZINC000335980134 134037281 /nfs/dbraw/zinc/03/72/81/134037281.db2.gz VSABTIZKBXWHII-KCJUWKMLSA-N 1 2 220.316 2.154 20 0 BEADLO Cc1cc(C(=O)C[N@@H+]2C[C@@H](C)[C@@H]2C)c(C)[nH]1 ZINC000335980134 134037282 /nfs/dbraw/zinc/03/72/82/134037282.db2.gz VSABTIZKBXWHII-KCJUWKMLSA-N 1 2 220.316 2.154 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@@H](C3CC3)C2)no1 ZINC000335993330 134041621 /nfs/dbraw/zinc/04/16/21/134041621.db2.gz DCOJTIOYHJUKMA-LLVKDONJSA-N 1 2 221.304 2.000 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@@H](C3CC3)C2)no1 ZINC000335993330 134041622 /nfs/dbraw/zinc/04/16/22/134041622.db2.gz DCOJTIOYHJUKMA-LLVKDONJSA-N 1 2 221.304 2.000 20 0 BEADLO Cc1cn[nH]c1C[NH2+][C@H]1COc2ccc(F)cc21 ZINC000336007088 134049459 /nfs/dbraw/zinc/04/94/59/134049459.db2.gz OPKWQWHQDLYNSJ-LBPRGKRZSA-N 1 2 247.273 2.081 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@H]1COc2ccc(F)cc21 ZINC000336007088 134049460 /nfs/dbraw/zinc/04/94/60/134049460.db2.gz OPKWQWHQDLYNSJ-LBPRGKRZSA-N 1 2 247.273 2.081 20 0 BEADLO CCc1nnc(C[N@@H+]2CCC(F)(F)[C@H](C)C2)o1 ZINC000336009131 134050233 /nfs/dbraw/zinc/05/02/33/134050233.db2.gz FUTMSUIROHVDII-MRVPVSSYSA-N 1 2 245.273 2.109 20 0 BEADLO CCc1nnc(C[N@H+]2CCC(F)(F)[C@H](C)C2)o1 ZINC000336009131 134050234 /nfs/dbraw/zinc/05/02/34/134050234.db2.gz FUTMSUIROHVDII-MRVPVSSYSA-N 1 2 245.273 2.109 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2CCCC(C)(C)C2)n1 ZINC000336059372 134067647 /nfs/dbraw/zinc/06/76/47/134067647.db2.gz DKVILDCXHJXICL-SECBINFHSA-N 1 2 223.320 2.473 20 0 BEADLO CSCCC[N@H+](C)[C@H](C)c1noc(C)n1 ZINC000352115515 134071896 /nfs/dbraw/zinc/07/18/96/134071896.db2.gz LVNAJCHYVUZSLC-MRVPVSSYSA-N 1 2 229.349 2.124 20 0 BEADLO CSCCC[N@@H+](C)[C@H](C)c1noc(C)n1 ZINC000352115515 134071897 /nfs/dbraw/zinc/07/18/97/134071897.db2.gz LVNAJCHYVUZSLC-MRVPVSSYSA-N 1 2 229.349 2.124 20 0 BEADLO CO[C@@H](C)C[N@H+](C)Cc1cc(C(C)(C)C)on1 ZINC000352115534 134072071 /nfs/dbraw/zinc/07/20/71/134072071.db2.gz MARNQVDQHOKLHD-JTQLQIEISA-N 1 2 240.347 2.439 20 0 BEADLO CO[C@@H](C)C[N@@H+](C)Cc1cc(C(C)(C)C)on1 ZINC000352115534 134072072 /nfs/dbraw/zinc/07/20/72/134072072.db2.gz MARNQVDQHOKLHD-JTQLQIEISA-N 1 2 240.347 2.439 20 0 BEADLO Cc1nc(N2CC[C@H]3CCC[C@H]32)cc[nH+]1 ZINC000336090946 134078282 /nfs/dbraw/zinc/07/82/82/134078282.db2.gz MWKNKFOIWPPCBI-GHMZBOCLSA-N 1 2 203.289 2.164 20 0 BEADLO Cc1cccc2c1C[N@H+](Cc1ncccn1)CC2 ZINC000336119379 134089497 /nfs/dbraw/zinc/08/94/97/134089497.db2.gz JLRNSHBJMZLCAX-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1cccc2c1C[N@@H+](Cc1ncccn1)CC2 ZINC000336119379 134089498 /nfs/dbraw/zinc/08/94/98/134089498.db2.gz JLRNSHBJMZLCAX-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1cnc(C[N@@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)o1 ZINC000336118588 134089665 /nfs/dbraw/zinc/08/96/65/134089665.db2.gz WCGUBKPOADHXRM-GXSJLCMTSA-N 1 2 242.269 2.460 20 0 BEADLO Cc1cnc(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)o1 ZINC000336118588 134089666 /nfs/dbraw/zinc/08/96/66/134089666.db2.gz WCGUBKPOADHXRM-GXSJLCMTSA-N 1 2 242.269 2.460 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CC[C@H]2CCC[C@@H]21 ZINC000336121700 134091804 /nfs/dbraw/zinc/09/18/04/134091804.db2.gz QTOWAMUAQKDMJT-YPMHNXCESA-N 1 2 245.326 2.218 20 0 BEADLO C[C@H]1C[C@H](COc2cc[nH+]cc2)CCO1 ZINC000336134216 134095442 /nfs/dbraw/zinc/09/54/42/134095442.db2.gz XWVAVPHSAWKVFA-WDEREUQCSA-N 1 2 207.273 2.276 20 0 BEADLO c1c2cccnc2oc1C[N@@H+]1CCOCC12CC2 ZINC000336216051 134137065 /nfs/dbraw/zinc/13/70/65/134137065.db2.gz YBUDLDIZTVJQLE-UHFFFAOYSA-N 1 2 244.294 2.193 20 0 BEADLO c1c2cccnc2oc1C[N@H+]1CCOCC12CC2 ZINC000336216051 134137066 /nfs/dbraw/zinc/13/70/66/134137066.db2.gz YBUDLDIZTVJQLE-UHFFFAOYSA-N 1 2 244.294 2.193 20 0 BEADLO CCC[N@H+](Cc1noc(C2CC2)n1)C1CC1 ZINC000171678696 134257687 /nfs/dbraw/zinc/25/76/87/134257687.db2.gz PSMVHSHVEZZSGO-UHFFFAOYSA-N 1 2 221.304 2.321 20 0 BEADLO CCC[N@@H+](Cc1noc(C2CC2)n1)C1CC1 ZINC000171678696 134257688 /nfs/dbraw/zinc/25/76/88/134257688.db2.gz PSMVHSHVEZZSGO-UHFFFAOYSA-N 1 2 221.304 2.321 20 0 BEADLO COC[C@H](C)N(C)c1cc[nH+]c(C(C)C)n1 ZINC000171987620 134264060 /nfs/dbraw/zinc/26/40/60/134264060.db2.gz JEWGVJMVYLELGM-JTQLQIEISA-N 1 2 223.320 2.071 20 0 BEADLO CC(C)n1ccc(C[N@@H+]2CCCO[C@H](C)C2)n1 ZINC000172013713 134264291 /nfs/dbraw/zinc/26/42/91/134264291.db2.gz VFPBWGGTNWHBFM-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccc(C[N@H+]2CCCO[C@H](C)C2)n1 ZINC000172013713 134264292 /nfs/dbraw/zinc/26/42/92/134264292.db2.gz VFPBWGGTNWHBFM-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO Cc1nc(C[N@@H+]2CCC3(CCCC3)C2)no1 ZINC000174262232 134279925 /nfs/dbraw/zinc/27/99/25/134279925.db2.gz CWGOUWCTAZXOOD-UHFFFAOYSA-N 1 2 221.304 2.144 20 0 BEADLO Cc1nc(C[N@H+]2CCC3(CCCC3)C2)no1 ZINC000174262232 134279926 /nfs/dbraw/zinc/27/99/26/134279926.db2.gz CWGOUWCTAZXOOD-UHFFFAOYSA-N 1 2 221.304 2.144 20 0 BEADLO Cc1cnc([C@@H](NCc2[nH]cc[nH+]2)C2CC2)s1 ZINC000174545169 134282397 /nfs/dbraw/zinc/28/23/97/134282397.db2.gz UZROEJWOENGJHM-NSHDSACASA-N 1 2 248.355 2.416 20 0 BEADLO Cc1cnc([C@@H]([NH2+]Cc2ncc[nH]2)C2CC2)s1 ZINC000174545169 134282398 /nfs/dbraw/zinc/28/23/98/134282398.db2.gz UZROEJWOENGJHM-NSHDSACASA-N 1 2 248.355 2.416 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CCOC2(CCC2)C1 ZINC000179579878 134321894 /nfs/dbraw/zinc/32/18/94/134321894.db2.gz NCRBIUGUKPWGKC-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cnc[nH]1 ZINC000179909988 134325445 /nfs/dbraw/zinc/32/54/45/134325445.db2.gz BBTTZPZVTYKZOI-LLVKDONJSA-N 1 2 227.311 2.357 20 0 BEADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1cnc[nH]1 ZINC000179909988 134325446 /nfs/dbraw/zinc/32/54/46/134325446.db2.gz BBTTZPZVTYKZOI-LLVKDONJSA-N 1 2 227.311 2.357 20 0 BEADLO COC(=O)C[N@H+](C)Cc1ccc(Cl)c(C)c1 ZINC000180421721 134327294 /nfs/dbraw/zinc/32/72/94/134327294.db2.gz YUDDVOKFJASLGC-UHFFFAOYSA-N 1 2 241.718 2.253 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1ccc(Cl)c(C)c1 ZINC000180421721 134327295 /nfs/dbraw/zinc/32/72/95/134327295.db2.gz YUDDVOKFJASLGC-UHFFFAOYSA-N 1 2 241.718 2.253 20 0 BEADLO CCOC(=O)C[N@@H+]1C[C@@H](C)C[C@@H]1c1cccnc1 ZINC000184897899 134369760 /nfs/dbraw/zinc/36/97/60/134369760.db2.gz CSUAXBZBRVXPPA-WCQYABFASA-N 1 2 248.326 2.028 20 0 BEADLO CCOC(=O)C[N@H+]1C[C@@H](C)C[C@@H]1c1cccnc1 ZINC000184897899 134369761 /nfs/dbraw/zinc/36/97/61/134369761.db2.gz CSUAXBZBRVXPPA-WCQYABFASA-N 1 2 248.326 2.028 20 0 BEADLO COC(=O)[C@@H]([NH2+]Cc1cccc(C)c1)C1CC1 ZINC000227768272 134392836 /nfs/dbraw/zinc/39/28/36/134392836.db2.gz GIMUUDQXBKHHAJ-ZDUSSCGKSA-N 1 2 233.311 2.036 20 0 BEADLO C[C@@H]1CCC[C@H]1CNc1[nH+]cnc2c1cnn2C ZINC000230695537 134532356 /nfs/dbraw/zinc/53/23/56/134532356.db2.gz YVJWIVFYIPFDFD-ZJUUUORDSA-N 1 2 245.330 2.211 20 0 BEADLO CCOC(=O)C[N@@H+]1C[C@H](C)[C@H]1c1ccccc1 ZINC000245422721 134854277 /nfs/dbraw/zinc/85/42/77/134854277.db2.gz JBRBGILTPHFWDM-FZMZJTMJSA-N 1 2 233.311 2.243 20 0 BEADLO CCOC(=O)C[N@H+]1C[C@H](C)[C@H]1c1ccccc1 ZINC000245422721 134854278 /nfs/dbraw/zinc/85/42/78/134854278.db2.gz JBRBGILTPHFWDM-FZMZJTMJSA-N 1 2 233.311 2.243 20 0 BEADLO C[C@@H]1CCC[N@@H+]1Cc1noc(C(C)(C)C)n1 ZINC000076114686 135010766 /nfs/dbraw/zinc/01/07/66/135010766.db2.gz NWNWQZZSQMCTQN-SECBINFHSA-N 1 2 223.320 2.351 20 0 BEADLO C[C@@H]1CCC[N@H+]1Cc1noc(C(C)(C)C)n1 ZINC000076114686 135010768 /nfs/dbraw/zinc/01/07/68/135010768.db2.gz NWNWQZZSQMCTQN-SECBINFHSA-N 1 2 223.320 2.351 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@H](C)c2cnccn2)C[C@H](C)O1 ZINC000248599800 135015421 /nfs/dbraw/zinc/01/54/21/135015421.db2.gz BWWLMARARKZAJW-QJPTWQEYSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@@H]1C[N@H+]([C@H](C)c2cnccn2)C[C@H](C)O1 ZINC000248599800 135015423 /nfs/dbraw/zinc/01/54/23/135015423.db2.gz BWWLMARARKZAJW-QJPTWQEYSA-N 1 2 235.331 2.037 20 0 BEADLO CN(c1[nH]c2ccccc2[nH+]1)[C@@H]1CCCC[C@H]1O ZINC000249179787 135035735 /nfs/dbraw/zinc/03/57/35/135035735.db2.gz HIOKRHLOYSDLQB-CHWSQXEVSA-N 1 2 245.326 2.303 20 0 BEADLO CCc1nc(C[N@@H+]2CCCC2(C)C)no1 ZINC000077483555 135067380 /nfs/dbraw/zinc/06/73/80/135067380.db2.gz LZHBEUKUIAYGER-UHFFFAOYSA-N 1 2 209.293 2.006 20 0 BEADLO CCc1nc(C[N@H+]2CCCC2(C)C)no1 ZINC000077483555 135067381 /nfs/dbraw/zinc/06/73/81/135067381.db2.gz LZHBEUKUIAYGER-UHFFFAOYSA-N 1 2 209.293 2.006 20 0 BEADLO C[C@@H](c1ccccc1)N(C)C(=O)Cn1cc[nH+]c1 ZINC000078288537 135118518 /nfs/dbraw/zinc/11/85/18/135118518.db2.gz QATJDULVUIZEEA-LBPRGKRZSA-N 1 2 243.310 2.103 20 0 BEADLO C[N@H+](Cc1nccs1)Cc1cccc(N)c1 ZINC000087391498 135128066 /nfs/dbraw/zinc/12/80/66/135128066.db2.gz HXFRPVMVIANTQK-UHFFFAOYSA-N 1 2 233.340 2.357 20 0 BEADLO C[N@@H+](Cc1nccs1)Cc1cccc(N)c1 ZINC000087391498 135128067 /nfs/dbraw/zinc/12/80/67/135128067.db2.gz HXFRPVMVIANTQK-UHFFFAOYSA-N 1 2 233.340 2.357 20 0 BEADLO C/C=C\C[S@](=O)Cc1cn2c(cccc2C)[nH+]1 ZINC000255576574 135129987 /nfs/dbraw/zinc/12/99/87/135129987.db2.gz DEMNAVVUZRREGQ-LIMHQNJXSA-N 1 2 248.351 2.468 20 0 BEADLO C/C=C\C[S@@](=O)Cc1cn2c(cccc2C)[nH+]1 ZINC000255576567 135130178 /nfs/dbraw/zinc/13/01/78/135130178.db2.gz DEMNAVVUZRREGQ-CWIOURORSA-N 1 2 248.351 2.468 20 0 BEADLO O=C1CCC(C[N@H+]2CCC(F)(F)C2)CC1 ZINC000259273614 135142512 /nfs/dbraw/zinc/14/25/12/135142512.db2.gz BJKAKXATQYFWMK-UHFFFAOYSA-N 1 2 217.259 2.087 20 0 BEADLO O=C1CCC(C[N@@H+]2CCC(F)(F)C2)CC1 ZINC000259273614 135142513 /nfs/dbraw/zinc/14/25/13/135142513.db2.gz BJKAKXATQYFWMK-UHFFFAOYSA-N 1 2 217.259 2.087 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)c1sccc1Cl ZINC000087721761 135165342 /nfs/dbraw/zinc/16/53/42/135165342.db2.gz BAWMBQOESRBYSU-UHFFFAOYSA-N 1 2 241.703 2.055 20 0 BEADLO F[C@@H]1C[NH2+][C@@H](c2nc(C3CCCCC3)no2)C1 ZINC000261867505 135258079 /nfs/dbraw/zinc/25/80/79/135258079.db2.gz UXZPWHXQNJJHSY-VHSXEESVSA-N 1 2 239.294 2.490 20 0 BEADLO CC1(C)CCCC[C@@H]1NC(=O)CCn1cc[nH+]c1 ZINC000342309754 135258998 /nfs/dbraw/zinc/25/89/98/135258998.db2.gz ZLWNCXGKUDQVPU-LBPRGKRZSA-N 1 2 249.358 2.358 20 0 BEADLO CCCC[N@@H+]1CC(=O)N[C@]12CC[C@H](C)[C@H](C)C2 ZINC000342453580 135276392 /nfs/dbraw/zinc/27/63/92/135276392.db2.gz NAXJAILDDZCEGY-OUCADQQQSA-N 1 2 238.375 2.371 20 0 BEADLO CCCC[N@H+]1CC(=O)N[C@]12CC[C@H](C)[C@H](C)C2 ZINC000342453580 135276393 /nfs/dbraw/zinc/27/63/93/135276393.db2.gz NAXJAILDDZCEGY-OUCADQQQSA-N 1 2 238.375 2.371 20 0 BEADLO C[C@@H](C(=O)NC(C)(C)C)[N@H+](C)Cc1ccoc1 ZINC000342647784 135298870 /nfs/dbraw/zinc/29/88/70/135298870.db2.gz UPUXAEIEBBYXEY-JTQLQIEISA-N 1 2 238.331 2.015 20 0 BEADLO C[C@@H](C(=O)NC(C)(C)C)[N@@H+](C)Cc1ccoc1 ZINC000342647784 135298871 /nfs/dbraw/zinc/29/88/71/135298871.db2.gz UPUXAEIEBBYXEY-JTQLQIEISA-N 1 2 238.331 2.015 20 0 BEADLO CCCCNC(=O)[C@H](C)[N@H+](C)Cc1ccoc1 ZINC000342638620 135299131 /nfs/dbraw/zinc/29/91/31/135299131.db2.gz OBFZNXNCQCZZMR-NSHDSACASA-N 1 2 238.331 2.016 20 0 BEADLO CCCCNC(=O)[C@H](C)[N@@H+](C)Cc1ccoc1 ZINC000342638620 135299132 /nfs/dbraw/zinc/29/91/32/135299132.db2.gz OBFZNXNCQCZZMR-NSHDSACASA-N 1 2 238.331 2.016 20 0 BEADLO CCc1nc(N2CCOC(C)(C)[C@@H]2C)cc(C)[nH+]1 ZINC000342706675 135313047 /nfs/dbraw/zinc/31/30/47/135313047.db2.gz RGKUMPLNEHXZBO-NSHDSACASA-N 1 2 249.358 2.351 20 0 BEADLO CO[C@@H]1[C@H](C)[C@@H](Nc2cc(C)[nH+]cn2)C1(C)C ZINC000342779636 135317577 /nfs/dbraw/zinc/31/75/77/135317577.db2.gz FAKDVYRMHSMNIR-YUSALJHKSA-N 1 2 235.331 2.256 20 0 BEADLO Cc1c[nH+]c(CN2CCc3ccccc3C2)n1C ZINC000342797102 135320572 /nfs/dbraw/zinc/32/05/72/135320572.db2.gz DFKNUDIEMDHDNF-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO Cc1cnc(C[N@@H+]2CCc3ccccc3C2)n1C ZINC000342797102 135320574 /nfs/dbraw/zinc/32/05/74/135320574.db2.gz DFKNUDIEMDHDNF-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO Cc1cnc(C[N@H+]2CCc3ccccc3C2)n1C ZINC000342797102 135320575 /nfs/dbraw/zinc/32/05/75/135320575.db2.gz DFKNUDIEMDHDNF-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO [NH3+]CC[N@H+]1CCC[C@]2(CCCc3ccccc32)C1 ZINC000262990142 135325532 /nfs/dbraw/zinc/32/55/32/135325532.db2.gz NOUSLCSHYOBKIR-MRXNPFEDSA-N 1 2 244.382 2.315 20 0 BEADLO C[C@H]1CCCN(C(=O)C(C)(C)c2c[nH+]c[nH]2)CC1 ZINC000334313330 135351316 /nfs/dbraw/zinc/35/13/16/135351316.db2.gz NHRHMLKZYMDTJO-NSHDSACASA-N 1 2 249.358 2.336 20 0 BEADLO C[C@@H](c1nncn1C)[N@@H+]1CC[C@H]1c1ccccc1 ZINC000334320704 135352163 /nfs/dbraw/zinc/35/21/63/135352163.db2.gz WAAVAMFWEDMDDA-AAEUAGOBSA-N 1 2 242.326 2.323 20 0 BEADLO C[C@@H](c1nncn1C)[N@H+]1CC[C@H]1c1ccccc1 ZINC000334320704 135352164 /nfs/dbraw/zinc/35/21/64/135352164.db2.gz WAAVAMFWEDMDDA-AAEUAGOBSA-N 1 2 242.326 2.323 20 0 BEADLO COc1cccc(C[N@@H+]2CCOCC23CC3)c1 ZINC000334329679 135354932 /nfs/dbraw/zinc/35/49/32/135354932.db2.gz OGOCSFAVKJAUHJ-UHFFFAOYSA-N 1 2 233.311 2.060 20 0 BEADLO COc1cccc(C[N@H+]2CCOCC23CC3)c1 ZINC000334329679 135354933 /nfs/dbraw/zinc/35/49/33/135354933.db2.gz OGOCSFAVKJAUHJ-UHFFFAOYSA-N 1 2 233.311 2.060 20 0 BEADLO F[C@@H]1CCC[C@@H]1Nc1cc[nH+]c2ccncc12 ZINC000334344665 135366016 /nfs/dbraw/zinc/36/60/16/135366016.db2.gz NTUPZGPLMXAJMP-MFKMUULPSA-N 1 2 231.274 2.354 20 0 BEADLO c1c[nH]c([C@@H]2CCC[N@H+]2CC2CCC2)n1 ZINC000334354278 135370477 /nfs/dbraw/zinc/37/04/77/135370477.db2.gz JMEGIEGVHZUPJE-NSHDSACASA-N 1 2 205.305 2.347 20 0 BEADLO c1c[nH]c([C@@H]2CCC[N@@H+]2CC2CCC2)n1 ZINC000334354278 135370478 /nfs/dbraw/zinc/37/04/78/135370478.db2.gz JMEGIEGVHZUPJE-NSHDSACASA-N 1 2 205.305 2.347 20 0 BEADLO Cc1cnc(C[N@@H+]2CCOC(C)(C)[C@H]2C)s1 ZINC000334373227 135376069 /nfs/dbraw/zinc/37/60/69/135376069.db2.gz SODLLHOFYOWFSG-SNVBAGLBSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1cnc(C[N@H+]2CCOC(C)(C)[C@H]2C)s1 ZINC000334373227 135376070 /nfs/dbraw/zinc/37/60/70/135376070.db2.gz SODLLHOFYOWFSG-SNVBAGLBSA-N 1 2 240.372 2.451 20 0 BEADLO Fc1cc(F)c2c(c1)C[N@H+]([C@@H]1CCOC1)CC2 ZINC000334400901 135390373 /nfs/dbraw/zinc/39/03/73/135390373.db2.gz YRKYIMWOENPALG-LLVKDONJSA-N 1 2 239.265 2.112 20 0 BEADLO Fc1cc(F)c2c(c1)C[N@@H+]([C@@H]1CCOC1)CC2 ZINC000334400901 135390375 /nfs/dbraw/zinc/39/03/75/135390375.db2.gz YRKYIMWOENPALG-LLVKDONJSA-N 1 2 239.265 2.112 20 0 BEADLO O=C(c1ccc2[nH+]ccn2c1)N1CCC=C(F)C1 ZINC000334402710 135391111 /nfs/dbraw/zinc/39/11/11/135391111.db2.gz GDIKFPAWMNGZES-UHFFFAOYSA-N 1 2 245.257 2.034 20 0 BEADLO Cc1cn2c([nH+]1)[C@@H](CNC(=O)C(C)(C)C)CCC2 ZINC000334410536 135392615 /nfs/dbraw/zinc/39/26/15/135392615.db2.gz JUROAWVGKLVGSH-LLVKDONJSA-N 1 2 249.358 2.231 20 0 BEADLO c1cn(CCCNc2nc(C3CC3)ns2)c[nH+]1 ZINC000087640560 135509803 /nfs/dbraw/zinc/50/98/03/135509803.db2.gz YDOBOKCBRIIQHJ-UHFFFAOYSA-N 1 2 249.343 2.114 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C1CC(F)(F)C1 ZINC000334616117 135781579 /nfs/dbraw/zinc/78/15/79/135781579.db2.gz XKOOQUIMSPUKBI-UHFFFAOYSA-N 1 2 242.225 2.074 20 0 BEADLO CO[C@H]1CCC[N@H+](Cc2ncc(Cl)s2)C1 ZINC000335248992 135982833 /nfs/dbraw/zinc/98/28/33/135982833.db2.gz HJGPYSCDVRTOAT-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO CO[C@H]1CCC[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000335248992 135982834 /nfs/dbraw/zinc/98/28/34/135982834.db2.gz HJGPYSCDVRTOAT-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO O=C(C1CCCC1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000335281934 136000257 /nfs/dbraw/zinc/00/02/57/136000257.db2.gz ZJKGPXLBAJHPES-NSHDSACASA-N 1 2 233.315 2.263 20 0 BEADLO c1cn(-c2cccc(OC[C@H]3CCCO3)c2)c[nH+]1 ZINC000347867472 136016725 /nfs/dbraw/zinc/01/67/25/136016725.db2.gz SLAISZWAUYBRKT-CQSZACIVSA-N 1 2 244.294 2.430 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[NH2+][C@@H]1C[C@@H]1CC ZINC000348155951 136040634 /nfs/dbraw/zinc/04/06/34/136040634.db2.gz ZWIHJYOUZVVMLW-TUAOUCFPSA-N 1 2 227.348 2.352 20 0 BEADLO OC1(Cn2cc[nH+]c2-c2ccccc2)CCC1 ZINC000335326403 136052016 /nfs/dbraw/zinc/05/20/16/136052016.db2.gz FEDDFNOSWSVSOR-UHFFFAOYSA-N 1 2 228.295 2.465 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)c1cccs1 ZINC000348273616 136058790 /nfs/dbraw/zinc/05/87/90/136058790.db2.gz AJLHNLWPRAFVPQ-UHFFFAOYSA-N 1 2 248.307 2.082 20 0 BEADLO Cn1c[nH+]cc1COc1cccc2c1CCC2 ZINC000335344401 136065457 /nfs/dbraw/zinc/06/54/57/136065457.db2.gz DQNQESNISTWFPK-UHFFFAOYSA-N 1 2 228.295 2.488 20 0 BEADLO COc1cncc(C[N@@H+]2CC[C@@](C)(F)C2)c1 ZINC000335352572 136069637 /nfs/dbraw/zinc/06/96/37/136069637.db2.gz ZFTHDKGSYYETIB-GFCCVEGCSA-N 1 2 224.279 2.024 20 0 BEADLO COc1cncc(C[N@H+]2CC[C@@](C)(F)C2)c1 ZINC000335352572 136069638 /nfs/dbraw/zinc/06/96/38/136069638.db2.gz ZFTHDKGSYYETIB-GFCCVEGCSA-N 1 2 224.279 2.024 20 0 BEADLO CCc1ccc(C[NH2+][C@H](C)c2nc(C)no2)cn1 ZINC000348410334 136077593 /nfs/dbraw/zinc/07/75/93/136077593.db2.gz OPERSAVXIFUNQE-SECBINFHSA-N 1 2 246.314 2.186 20 0 BEADLO CC1(C(N)=O)C[NH+](Cc2cccc(F)c2F)C1 ZINC000335387469 136089178 /nfs/dbraw/zinc/08/91/78/136089178.db2.gz CYWPDWBPYNUPLA-UHFFFAOYSA-N 1 2 240.253 2.322 20 0 BEADLO CC1(C(N)=O)C[NH+](Cc2ccc(F)c(F)c2)C1 ZINC000335390458 136090756 /nfs/dbraw/zinc/09/07/56/136090756.db2.gz UYAMPLHMSSVTAZ-UHFFFAOYSA-N 1 2 240.253 2.322 20 0 BEADLO Cn1c2ccccc2[nH+]c1N1CC[C@H](F)C1 ZINC000335398309 136093327 /nfs/dbraw/zinc/09/33/27/136093327.db2.gz IVWPIIBEZWVHKR-VIFPVBQESA-N 1 2 219.263 2.122 20 0 BEADLO Cn1c2c(cccc2F)[nH+]c1N1CC[C@@H](F)C1 ZINC000335398603 136093355 /nfs/dbraw/zinc/09/33/55/136093355.db2.gz BAWJTBCMFYQKDT-MRVPVSSYSA-N 1 2 237.253 2.261 20 0 BEADLO Cc1nc(N2CC[C@@H](F)C2)c2c([nH+]1)CCCC2 ZINC000335401803 136094441 /nfs/dbraw/zinc/09/44/41/136094441.db2.gz VATIIOPOZMSXOS-SNVBAGLBSA-N 1 2 235.306 2.212 20 0 BEADLO Cc1cc(C)c(NC(=O)N[C@@H](C)CF)c(C)[nH+]1 ZINC000335589910 136103287 /nfs/dbraw/zinc/10/32/87/136103287.db2.gz MPEUXFVSZMORMG-VIFPVBQESA-N 1 2 239.294 2.486 20 0 BEADLO CC(C)n1c[nH+]cc1CN1CCC(F)(F)C1 ZINC000335561786 136106413 /nfs/dbraw/zinc/10/64/13/136106413.db2.gz QIMFPCUCNMGJLE-UHFFFAOYSA-N 1 2 229.274 2.305 20 0 BEADLO Cc1cc(C)c(CNC(=O)N2C[C@H](C)[C@@H]2C)c[nH+]1 ZINC000335579461 136112017 /nfs/dbraw/zinc/11/20/17/136112017.db2.gz KBMBAWYWYDKHRX-JQWIXIFHSA-N 1 2 247.342 2.248 20 0 BEADLO C(c1nnc(C2CC2)o1)[N@@H+]1C[C@H]2CCCC[C@H]21 ZINC001646924436 1172750486 /nfs/dbraw/zinc/75/04/86/1172750486.db2.gz ZDGRAIWIXXXGRG-GHMZBOCLSA-N 1 2 233.315 2.321 20 0 BEADLO C(c1nnc(C2CC2)o1)[N@H+]1C[C@H]2CCCC[C@H]21 ZINC001646924436 1172750490 /nfs/dbraw/zinc/75/04/90/1172750490.db2.gz ZDGRAIWIXXXGRG-GHMZBOCLSA-N 1 2 233.315 2.321 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)[C@H]2C[C@H]3C[C@H]3C2)[nH+]1 ZINC001647827697 1172766870 /nfs/dbraw/zinc/76/68/70/1172766870.db2.gz HQLRPQUTFPARRJ-URLYPYJESA-N 1 2 247.342 2.195 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)[C@H]2C[C@H]3C[C@H]3C2)c[nH+]1 ZINC001647827697 1172766875 /nfs/dbraw/zinc/76/68/75/1172766875.db2.gz HQLRPQUTFPARRJ-URLYPYJESA-N 1 2 247.342 2.195 20 0 BEADLO CCn1nnc(C)c1C[N@H+](CC)Cc1ccoc1 ZINC000648366568 397804564 /nfs/dbraw/zinc/80/45/64/397804564.db2.gz UKYWOQLCAVZWHN-UHFFFAOYSA-N 1 2 248.330 2.222 20 0 BEADLO CCn1nnc(C)c1C[N@@H+](CC)Cc1ccoc1 ZINC000648366568 397804568 /nfs/dbraw/zinc/80/45/68/397804568.db2.gz UKYWOQLCAVZWHN-UHFFFAOYSA-N 1 2 248.330 2.222 20 0 BEADLO CC[C@@H](F)C[N@H+](CCOC)Cc1cncs1 ZINC000440492788 397927763 /nfs/dbraw/zinc/92/77/63/397927763.db2.gz JRDVCEFASCVYRZ-SNVBAGLBSA-N 1 2 246.351 2.340 20 0 BEADLO CC[C@@H](F)C[N@@H+](CCOC)Cc1cncs1 ZINC000440492788 397927766 /nfs/dbraw/zinc/92/77/66/397927766.db2.gz JRDVCEFASCVYRZ-SNVBAGLBSA-N 1 2 246.351 2.340 20 0 BEADLO CCCC(C)(C)C(=O)N(C)Cc1[nH+]ccn1C ZINC000649550740 397942735 /nfs/dbraw/zinc/94/27/35/397942735.db2.gz ZJRWYYPXERTAKM-UHFFFAOYSA-N 1 2 237.347 2.205 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccncc2F)[C@H](C)[C@H](C)O1 ZINC000449264561 397954043 /nfs/dbraw/zinc/95/40/43/397954043.db2.gz MQZGPEOUPCNDBB-MXWKQRLJSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccncc2F)[C@H](C)[C@H](C)O1 ZINC000449264561 397954048 /nfs/dbraw/zinc/95/40/48/397954048.db2.gz MQZGPEOUPCNDBB-MXWKQRLJSA-N 1 2 238.306 2.218 20 0 BEADLO Cc1nsc(Nc2ccc(N(C)C)[nH+]c2)n1 ZINC000271531630 397969018 /nfs/dbraw/zinc/96/90/18/397969018.db2.gz NHUZNKSLVBFFJQ-UHFFFAOYSA-N 1 2 235.316 2.051 20 0 BEADLO CCC1(CC)CCN(c2nc(C)[nH+]c(N)n2)CC1 ZINC000302637316 397957364 /nfs/dbraw/zinc/95/73/64/397957364.db2.gz SARAYOCXCYLLRU-UHFFFAOYSA-N 1 2 249.362 2.169 20 0 BEADLO CCC1(CC)CCN(c2nc(N)nc(C)[nH+]2)CC1 ZINC000302637316 397957366 /nfs/dbraw/zinc/95/73/66/397957366.db2.gz SARAYOCXCYLLRU-UHFFFAOYSA-N 1 2 249.362 2.169 20 0 BEADLO CO[C@H]1C[C@@H]([N@H+](C)CC(F)F)C12CCC2 ZINC000650184794 397961722 /nfs/dbraw/zinc/96/17/22/397961722.db2.gz QQMWJUQEMFUVEW-BDAKNGLRSA-N 1 2 219.275 2.141 20 0 BEADLO CO[C@H]1C[C@@H]([N@@H+](C)CC(F)F)C12CCC2 ZINC000650184794 397961725 /nfs/dbraw/zinc/96/17/25/397961725.db2.gz QQMWJUQEMFUVEW-BDAKNGLRSA-N 1 2 219.275 2.141 20 0 BEADLO CC[C@H]1CN(c2cc[nH+]c(C(C)C)n2)CCO1 ZINC000110127481 397902897 /nfs/dbraw/zinc/90/28/97/397902897.db2.gz RQNAEUJURGAPFF-NSHDSACASA-N 1 2 235.331 2.215 20 0 BEADLO CCN(CC(C)C)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000649599199 397991495 /nfs/dbraw/zinc/99/14/95/397991495.db2.gz RQYMOQZPJACWIO-GFCCVEGCSA-N 1 2 237.347 2.339 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1C(=O)N(C)Cc1[nH+]ccn1C ZINC000274672771 398012134 /nfs/dbraw/zinc/01/21/34/398012134.db2.gz KBMYJNGMXNFULP-SMDDNHRTSA-N 1 2 249.358 2.061 20 0 BEADLO CCOC1CC[NH+]([C@H](C)c2csnn2)CC1 ZINC000649650043 398021064 /nfs/dbraw/zinc/02/10/64/398021064.db2.gz HZXUOCQQVHTPOJ-SECBINFHSA-N 1 2 241.360 2.100 20 0 BEADLO Cc1ccccc1[C@@H](C)Nc1nc(C)[nH+]c(N)n1 ZINC000197838853 398021183 /nfs/dbraw/zinc/02/11/83/398021183.db2.gz LXRGOLQDXPPEQU-SECBINFHSA-N 1 2 243.314 2.244 20 0 BEADLO Cc1ccccc1[C@@H](C)Nc1nc(N)nc(C)[nH+]1 ZINC000197838853 398021185 /nfs/dbraw/zinc/02/11/85/398021185.db2.gz LXRGOLQDXPPEQU-SECBINFHSA-N 1 2 243.314 2.244 20 0 BEADLO CC1(C)CN(c2[nH]c3ccccc3[nH+]2)CC[C@@H]1O ZINC000275493202 398021643 /nfs/dbraw/zinc/02/16/43/398021643.db2.gz RPDRMMWXQDCOLS-LBPRGKRZSA-N 1 2 245.326 2.160 20 0 BEADLO CC(C)Cn1ncnc1C[N@@H+]1CCC12CCCC2 ZINC000649657643 398026076 /nfs/dbraw/zinc/02/60/76/398026076.db2.gz IEOQDDURBFPMGT-UHFFFAOYSA-N 1 2 248.374 2.453 20 0 BEADLO CC(C)Cn1ncnc1C[N@H+]1CCC12CCCC2 ZINC000649657643 398026077 /nfs/dbraw/zinc/02/60/77/398026077.db2.gz IEOQDDURBFPMGT-UHFFFAOYSA-N 1 2 248.374 2.453 20 0 BEADLO CCc1ccc(CCNc2cc[nH+]c(C)n2)cc1 ZINC000361053252 397971436 /nfs/dbraw/zinc/97/14/36/397971436.db2.gz QJGNPMPRACOSRU-UHFFFAOYSA-N 1 2 241.338 2.424 20 0 BEADLO CC(C)OCC[N@@H+]1CCCC(F)(F)C1 ZINC000649692240 398042025 /nfs/dbraw/zinc/04/20/25/398042025.db2.gz JRKWEWZXSBTQBX-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO CC(C)OCC[N@H+]1CCCC(F)(F)C1 ZINC000649692240 398042027 /nfs/dbraw/zinc/04/20/27/398042027.db2.gz JRKWEWZXSBTQBX-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO CCO[C@@H]1C[C@@H](Nc2cccc[nH+]2)[C@]12CCCO2 ZINC000272669836 397983196 /nfs/dbraw/zinc/98/31/96/397983196.db2.gz KDKVYUSQQRVWNJ-YRGRVCCFSA-N 1 2 248.326 2.220 20 0 BEADLO CO[C@@H](C[N@@H+]1CCCC(F)(F)C1)C1CC1 ZINC000649695609 398044052 /nfs/dbraw/zinc/04/40/52/398044052.db2.gz AGADPCFCJSZYEH-JTQLQIEISA-N 1 2 219.275 2.143 20 0 BEADLO CO[C@@H](C[N@H+]1CCCC(F)(F)C1)C1CC1 ZINC000649695609 398044053 /nfs/dbraw/zinc/04/40/53/398044053.db2.gz AGADPCFCJSZYEH-JTQLQIEISA-N 1 2 219.275 2.143 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1Cc1ncc(C)cn1 ZINC000649719819 398062521 /nfs/dbraw/zinc/06/25/21/398062521.db2.gz XZQZQZOSBZIYJQ-OLZOCXBDSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@H+]1Cc1ncc(C)cn1 ZINC000649719819 398062523 /nfs/dbraw/zinc/06/25/23/398062523.db2.gz XZQZQZOSBZIYJQ-OLZOCXBDSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ncc(C)cn2)[C@@H](CC)CO1 ZINC000649719821 398062527 /nfs/dbraw/zinc/06/25/27/398062527.db2.gz XZQZQZOSBZIYJQ-STQMWFEESA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ncc(C)cn2)[C@@H](CC)CO1 ZINC000649719821 398062529 /nfs/dbraw/zinc/06/25/29/398062529.db2.gz XZQZQZOSBZIYJQ-STQMWFEESA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ncc(C)o2)[C@@H](CC)CO1 ZINC000649721247 398064449 /nfs/dbraw/zinc/06/44/49/398064449.db2.gz VAYIZQJWFBERGZ-NWDGAFQWSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ncc(C)o2)[C@@H](CC)CO1 ZINC000649721247 398064450 /nfs/dbraw/zinc/06/44/50/398064450.db2.gz VAYIZQJWFBERGZ-NWDGAFQWSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ncc(C)o2)[C@@H](CC)CO1 ZINC000649721248 398064732 /nfs/dbraw/zinc/06/47/32/398064732.db2.gz VAYIZQJWFBERGZ-RYUDHWBXSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ncc(C)o2)[C@@H](CC)CO1 ZINC000649721248 398064735 /nfs/dbraw/zinc/06/47/35/398064735.db2.gz VAYIZQJWFBERGZ-RYUDHWBXSA-N 1 2 238.331 2.372 20 0 BEADLO COc1cc[nH+]cc1NC(=O)/C=C/c1ccc[nH]1 ZINC000187629461 398093809 /nfs/dbraw/zinc/09/38/09/398093809.db2.gz IFIDAVFUPHIYSK-SNAWJCMRSA-N 1 2 243.266 2.070 20 0 BEADLO CC[C@H]1C[N@H+](Cc2oc(C)nc2C)[C@@H](C)CO1 ZINC000649735806 398076460 /nfs/dbraw/zinc/07/64/60/398076460.db2.gz QSPKNDPLIMUJOE-CABZTGNLSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2oc(C)nc2C)[C@@H](C)CO1 ZINC000649735806 398076462 /nfs/dbraw/zinc/07/64/62/398076462.db2.gz QSPKNDPLIMUJOE-CABZTGNLSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@H]1C[N@H+](Cc2oc(C)nc2C)[C@H](C)CO1 ZINC000649735808 398076501 /nfs/dbraw/zinc/07/65/01/398076501.db2.gz QSPKNDPLIMUJOE-SKDRFNHKSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2oc(C)nc2C)[C@H](C)CO1 ZINC000649735808 398076505 /nfs/dbraw/zinc/07/65/05/398076505.db2.gz QSPKNDPLIMUJOE-SKDRFNHKSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ncc(C)s2)[C@@H](C)CO1 ZINC000649735309 398076965 /nfs/dbraw/zinc/07/69/65/398076965.db2.gz JFDVWAGVRKDWKQ-ONGXEEELSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ncc(C)s2)[C@@H](C)CO1 ZINC000649735309 398076967 /nfs/dbraw/zinc/07/69/67/398076967.db2.gz JFDVWAGVRKDWKQ-ONGXEEELSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1ccc(CN2CCn3c[nH+]cc3C2)s1 ZINC000291555801 398095031 /nfs/dbraw/zinc/09/50/31/398095031.db2.gz MSEBPVYRJSXURU-UHFFFAOYSA-N 1 2 233.340 2.269 20 0 BEADLO Cc1ccc(C[N@@H+]2CCn3cncc3C2)s1 ZINC000291555801 398095035 /nfs/dbraw/zinc/09/50/35/398095035.db2.gz MSEBPVYRJSXURU-UHFFFAOYSA-N 1 2 233.340 2.269 20 0 BEADLO Cc1ccc(C[N@H+]2CCn3cncc3C2)s1 ZINC000291555801 398095039 /nfs/dbraw/zinc/09/50/39/398095039.db2.gz MSEBPVYRJSXURU-UHFFFAOYSA-N 1 2 233.340 2.269 20 0 BEADLO FC1(F)CC12CC[NH+](Cc1csnn1)CC2 ZINC000649772935 398095081 /nfs/dbraw/zinc/09/50/81/398095081.db2.gz CUILBXITGXRBER-UHFFFAOYSA-N 1 2 245.298 2.159 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccon2)[C@@H](CC)CO1 ZINC000649717800 398058790 /nfs/dbraw/zinc/05/87/90/398058790.db2.gz MNANRGNGRNRBDB-RYUDHWBXSA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccon2)[C@@H](CC)CO1 ZINC000649717800 398058791 /nfs/dbraw/zinc/05/87/91/398058791.db2.gz MNANRGNGRNRBDB-RYUDHWBXSA-N 1 2 224.304 2.064 20 0 BEADLO Clc1ccc(CC[NH2+]Cc2ccn[nH]2)s1 ZINC000163810523 398059089 /nfs/dbraw/zinc/05/90/89/398059089.db2.gz VJCCRRVOROJMLL-UHFFFAOYSA-N 1 2 241.747 2.457 20 0 BEADLO c1c(COc2cc[nH+]cc2)nn2c1CCCC2 ZINC000650320175 398107884 /nfs/dbraw/zinc/10/78/84/398107884.db2.gz LMHLDBKFQSEWME-UHFFFAOYSA-N 1 2 229.283 2.193 20 0 BEADLO Cc1[nH]c(C(=O)NCCC(C)(C)C2CC2)c[nH+]1 ZINC000294154662 398123824 /nfs/dbraw/zinc/12/38/24/398123824.db2.gz MPKKQSFLWUUDGZ-UHFFFAOYSA-N 1 2 235.331 2.274 20 0 BEADLO Cc1[nH]ccc1C(=O)NCc1c[nH+]c(C)cc1C ZINC000335044809 398125518 /nfs/dbraw/zinc/12/55/18/398125518.db2.gz QUHNZRCRQNXXDT-UHFFFAOYSA-N 1 2 243.310 2.265 20 0 BEADLO C[C@@H]([NH2+]Cc1c[nH]nn1)[C@H]1CCCC[C@H]1C ZINC000649831502 398130896 /nfs/dbraw/zinc/13/08/96/398130896.db2.gz VUQJMCABTVQSJQ-FOGDFJRCSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@@H]([NH2+]Cc1cn[nH]n1)[C@H]1CCCC[C@H]1C ZINC000649831502 398130897 /nfs/dbraw/zinc/13/08/97/398130897.db2.gz VUQJMCABTVQSJQ-FOGDFJRCSA-N 1 2 222.336 2.109 20 0 BEADLO Cc1cccc([C@H]2CC[N@H+](Cc3cn[nH]n3)C2)c1 ZINC000295047949 398131372 /nfs/dbraw/zinc/13/13/72/398131372.db2.gz UEVABZXAXSVQMV-ZDUSSCGKSA-N 1 2 242.326 2.103 20 0 BEADLO Cc1cccc([C@H]2CC[N@@H+](Cc3cn[nH]n3)C2)c1 ZINC000295047949 398131376 /nfs/dbraw/zinc/13/13/76/398131376.db2.gz UEVABZXAXSVQMV-ZDUSSCGKSA-N 1 2 242.326 2.103 20 0 BEADLO CC(C)OCC[N@H+](CC(F)F)C(C)C ZINC000135376938 398133447 /nfs/dbraw/zinc/13/34/47/398133447.db2.gz VYIUPDHTSQYLKR-UHFFFAOYSA-N 1 2 209.280 2.387 20 0 BEADLO CC(C)OCC[N@@H+](CC(F)F)C(C)C ZINC000135376938 398133451 /nfs/dbraw/zinc/13/34/51/398133451.db2.gz VYIUPDHTSQYLKR-UHFFFAOYSA-N 1 2 209.280 2.387 20 0 BEADLO C[C@H]([NH2+]Cc1cccs1)c1csnn1 ZINC000398258880 322868241 /nfs/dbraw/zinc/86/82/41/322868241.db2.gz KFZGLHKGQZUQNA-ZETCQYMHSA-N 1 2 225.342 2.450 20 0 BEADLO Cc1[nH+]cccc1Cn1cc(Cl)cn1 ZINC000685579352 487556998 /nfs/dbraw/zinc/55/69/98/487556998.db2.gz ZDWNLTSGMFWURT-UHFFFAOYSA-N 1 2 207.664 2.288 20 0 BEADLO C[N@H+](Cc1cccc(O)c1Cl)C1(CO)CC1 ZINC000668798600 487557735 /nfs/dbraw/zinc/55/77/35/487557735.db2.gz PZAMDHYHLPVBDV-UHFFFAOYSA-N 1 2 241.718 2.002 20 0 BEADLO C[N@@H+](Cc1cccc(O)c1Cl)C1(CO)CC1 ZINC000668798600 487557738 /nfs/dbraw/zinc/55/77/38/487557738.db2.gz PZAMDHYHLPVBDV-UHFFFAOYSA-N 1 2 241.718 2.002 20 0 BEADLO CCOC(=O)[C@H](C)N(C)c1cc[nH+]c(CC)c1 ZINC000260349396 322884536 /nfs/dbraw/zinc/88/45/36/322884536.db2.gz MLWMFIYBRPLLQH-JTQLQIEISA-N 1 2 236.315 2.032 20 0 BEADLO Cc1cc(N(C)C2CCOCC2)nc(C2CC2)[nH+]1 ZINC000530588290 322885520 /nfs/dbraw/zinc/88/55/20/322885520.db2.gz FJXCPMIHAWZHBK-UHFFFAOYSA-N 1 2 247.342 2.278 20 0 BEADLO Cc1[nH]c([C@@H]2CCCN2C(=O)CC2CC2)[nH+]c1C ZINC001649368861 1172871217 /nfs/dbraw/zinc/87/12/17/1172871217.db2.gz FBEVLWNKVAQVEI-LBPRGKRZSA-N 1 2 247.342 2.490 20 0 BEADLO C/C=C/C(=O)N1CCC[C@@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001649369510 1172873579 /nfs/dbraw/zinc/87/35/79/1172873579.db2.gz IGLOOAOBEKSMFL-DUMNWFOQSA-N 1 2 233.315 2.266 20 0 BEADLO Cc1cc(C[NH2+]Cc2csc(C3CC3)n2)[nH]n1 ZINC001650404444 1172882121 /nfs/dbraw/zinc/88/21/21/1172882121.db2.gz OJDNYCVEODBDDK-UHFFFAOYSA-N 1 2 248.355 2.342 20 0 BEADLO CC(C)OC1CCN(c2cccc[nH+]2)CC1 ZINC000530675930 322889764 /nfs/dbraw/zinc/88/97/64/322889764.db2.gz DAHZGTABJNCCFA-UHFFFAOYSA-N 1 2 220.316 2.475 20 0 BEADLO COc1ccc[nH+]c1NC1CCC(OC)CC1 ZINC000680334831 487567176 /nfs/dbraw/zinc/56/71/76/487567176.db2.gz OZRACHXRWMSWBO-UHFFFAOYSA-N 1 2 236.315 2.460 20 0 BEADLO Cc1nc(F)ccc1CNc1cc(CO)cc[nH+]1 ZINC001651239323 1172934704 /nfs/dbraw/zinc/93/47/04/1172934704.db2.gz OOGKFJYUDNUCNQ-UHFFFAOYSA-N 1 2 247.273 2.029 20 0 BEADLO OCc1cc[nH+]c(NCc2ccc(Cl)cn2)c1 ZINC001651239693 1172935598 /nfs/dbraw/zinc/93/55/98/1172935598.db2.gz YBDYCIVEMBMEQY-UHFFFAOYSA-N 1 2 249.701 2.234 20 0 BEADLO CCCN(C(=O)[C@H](C)Cc1c[nH+]c[nH]1)C(C)C ZINC000655238827 487590754 /nfs/dbraw/zinc/59/07/54/487590754.db2.gz DHWNUPQCJDPCLC-LLVKDONJSA-N 1 2 237.347 2.235 20 0 BEADLO CCCN(C(=O)[C@H](C)Cc1c[nH]c[nH+]1)C(C)C ZINC000655238827 487590760 /nfs/dbraw/zinc/59/07/60/487590760.db2.gz DHWNUPQCJDPCLC-LLVKDONJSA-N 1 2 237.347 2.235 20 0 BEADLO CC(C)=CCC[N@H+](CC(F)F)C[C@@H](C)O ZINC000660737641 487591776 /nfs/dbraw/zinc/59/17/76/487591776.db2.gz MTIGQNPFZKKCJO-SNVBAGLBSA-N 1 2 221.291 2.291 20 0 BEADLO CC(C)=CCC[N@@H+](CC(F)F)C[C@@H](C)O ZINC000660737641 487591781 /nfs/dbraw/zinc/59/17/81/487591781.db2.gz MTIGQNPFZKKCJO-SNVBAGLBSA-N 1 2 221.291 2.291 20 0 BEADLO CC[C@@]1(CO)CCCN(c2nc(C)[nH+]cc2C)C1 ZINC000564585380 322917404 /nfs/dbraw/zinc/91/74/04/322917404.db2.gz JPLIMXBJCLYKIK-CQSZACIVSA-N 1 2 249.358 2.082 20 0 BEADLO C[C@]1(C(F)F)C[N@H+](Cc2ccco2)CCO1 ZINC000668825915 487609810 /nfs/dbraw/zinc/60/98/10/487609810.db2.gz SFMWCAWOZHDMGF-LLVKDONJSA-N 1 2 231.242 2.136 20 0 BEADLO C[C@]1(C(F)F)C[N@@H+](Cc2ccco2)CCO1 ZINC000668825915 487609814 /nfs/dbraw/zinc/60/98/14/487609814.db2.gz SFMWCAWOZHDMGF-LLVKDONJSA-N 1 2 231.242 2.136 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1NC(=O)CCCn1cc[nH+]c1 ZINC000655266591 409770020 /nfs/dbraw/zinc/77/00/20/409770020.db2.gz JGXSPNPBQACZKY-OCCSQVGLSA-N 1 2 249.358 2.214 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2n[nH]c(=O)o2)c(C)c1 ZINC000660844713 409844235 /nfs/dbraw/zinc/84/42/35/409844235.db2.gz UCCBHQDXECUJJG-UHFFFAOYSA-N 1 2 247.298 2.024 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2n[nH]c(=O)o2)c(C)c1 ZINC000660844713 409844242 /nfs/dbraw/zinc/84/42/42/409844242.db2.gz UCCBHQDXECUJJG-UHFFFAOYSA-N 1 2 247.298 2.024 20 0 BEADLO CCn1cncc1C[N@@H+]1C[C@@H](C)OCC12CCC2 ZINC000651974940 409963989 /nfs/dbraw/zinc/96/39/89/409963989.db2.gz VDADMWBMBWJPGE-GFCCVEGCSA-N 1 2 249.358 2.046 20 0 BEADLO CCn1cncc1C[N@H+]1C[C@@H](C)OCC12CCC2 ZINC000651974940 409963994 /nfs/dbraw/zinc/96/39/94/409963994.db2.gz VDADMWBMBWJPGE-GFCCVEGCSA-N 1 2 249.358 2.046 20 0 BEADLO c1nn[nH]c1CC[N@@H+]1CCC[C@@H]1CC1CCCC1 ZINC000660925598 409971747 /nfs/dbraw/zinc/97/17/47/409971747.db2.gz CKPOHLLCHFBFGC-CQSZACIVSA-N 1 2 248.374 2.392 20 0 BEADLO c1nn[nH]c1CC[N@H+]1CCC[C@@H]1CC1CCCC1 ZINC000660925598 409971751 /nfs/dbraw/zinc/97/17/51/409971751.db2.gz CKPOHLLCHFBFGC-CQSZACIVSA-N 1 2 248.374 2.392 20 0 BEADLO CSc1ccc[nH+]c1NC1CSC1 ZINC000651971749 409942944 /nfs/dbraw/zinc/94/29/44/409942944.db2.gz SUSQUCMXBHLJRQ-UHFFFAOYSA-N 1 2 212.343 2.331 20 0 BEADLO CCc1cc[nH+]cc1NC[C@H](C)COC ZINC000651979344 410113005 /nfs/dbraw/zinc/11/30/05/410113005.db2.gz KNNWFTVRQIFQDV-JTQLQIEISA-N 1 2 208.305 2.338 20 0 BEADLO CCOC[C@H](C)Nc1c[nH+]ccc1CC ZINC000651979349 410113135 /nfs/dbraw/zinc/11/31/35/410113135.db2.gz KYNPOZOZDLFFSW-JTQLQIEISA-N 1 2 208.305 2.481 20 0 BEADLO CCc1cc[nH+]cc1NCc1n[nH]cc1C ZINC000651979779 410114870 /nfs/dbraw/zinc/11/48/70/410114870.db2.gz JEBWDPJWAXPNES-UHFFFAOYSA-N 1 2 216.288 2.288 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)Cc1ncc(C(C)(C)C)o1 ZINC000661085506 410151979 /nfs/dbraw/zinc/15/19/79/410151979.db2.gz LMGNHYKIZZRLQU-UHFFFAOYSA-N 1 2 248.330 2.327 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)Cc1ncc(C(C)(C)C)o1 ZINC000661085506 410151985 /nfs/dbraw/zinc/15/19/85/410151985.db2.gz LMGNHYKIZZRLQU-UHFFFAOYSA-N 1 2 248.330 2.327 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CCC[C@H](F)C1)c1[nH]cc[nH+]1 ZINC000655401977 410205112 /nfs/dbraw/zinc/20/51/12/410205112.db2.gz ONGPOUKKEWMJCN-BBBLOLIVSA-N 1 2 239.294 2.115 20 0 BEADLO CCc1nc(C[N@@H+](CC)[C@@H](C)CC)no1 ZINC000661108729 410260905 /nfs/dbraw/zinc/26/09/05/410260905.db2.gz NSASSKCJSMNSEK-VIFPVBQESA-N 1 2 211.309 2.252 20 0 BEADLO CCc1nc(C[N@H+](CC)[C@@H](C)CC)no1 ZINC000661108729 410260909 /nfs/dbraw/zinc/26/09/09/410260909.db2.gz NSASSKCJSMNSEK-VIFPVBQESA-N 1 2 211.309 2.252 20 0 BEADLO Cn1ccnc1C[NH+]1CCC(c2ccco2)CC1 ZINC000661160860 410312675 /nfs/dbraw/zinc/31/26/75/410312675.db2.gz FKAQWSXCLNKKJL-UHFFFAOYSA-N 1 2 245.326 2.393 20 0 BEADLO CCCCNC(=O)c1ccn2cc(C)[nH+]c2c1 ZINC000071540724 410416569 /nfs/dbraw/zinc/41/65/69/410416569.db2.gz KAKROYGRWCPCRU-UHFFFAOYSA-N 1 2 231.299 2.173 20 0 BEADLO Cc1nc(N2C[C@H](C)[C@H]2C)c(C)c(C)[nH+]1 ZINC000663948432 410397389 /nfs/dbraw/zinc/39/73/89/410397389.db2.gz YVTJXRPWCQWKAU-OIBJUYFYSA-N 1 2 205.305 2.246 20 0 BEADLO Cc1nc(N2C[C@H](C)[C@@H]2C)c(C)c(C)[nH+]1 ZINC000663948434 410398058 /nfs/dbraw/zinc/39/80/58/410398058.db2.gz YVTJXRPWCQWKAU-XVKPBYJWSA-N 1 2 205.305 2.246 20 0 BEADLO COCCCCNc1cc[nH+]c2ccncc12 ZINC000085657233 410466628 /nfs/dbraw/zinc/46/66/28/410466628.db2.gz ORWHSZRORKDDKV-UHFFFAOYSA-N 1 2 231.299 2.468 20 0 BEADLO C[C@@H]1C[C@H](O)CN1c1cc(C(F)(F)F)cc[nH+]1 ZINC000335797207 410466767 /nfs/dbraw/zinc/46/67/67/410466767.db2.gz PENNFYGDPRIVJF-APPZFPTMSA-N 1 2 246.232 2.060 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C(C)(CC)CC ZINC000650788313 410435386 /nfs/dbraw/zinc/43/53/86/410435386.db2.gz SURHHZFTXTWAOU-UHFFFAOYSA-N 1 2 237.347 2.346 20 0 BEADLO CCc1cc(NC[C@@H]2CCC[C@H](C)O2)nc[nH+]1 ZINC000664394111 410575932 /nfs/dbraw/zinc/57/59/32/410575932.db2.gz KURGMIXFMTUYDY-JQWIXIFHSA-N 1 2 235.331 2.409 20 0 BEADLO c1ccc(N2C[C@]34COC[C@@]3(C2)CCCC4)[nH+]c1 ZINC000664651190 410615752 /nfs/dbraw/zinc/61/57/52/410615752.db2.gz WSQAMADBFNPHMH-GASCZTMLSA-N 1 2 244.338 2.479 20 0 BEADLO C[C@H]1C[C@H](C)CN(c2cc(CO)cc[nH+]2)C1 ZINC000040864692 410896045 /nfs/dbraw/zinc/89/60/45/410896045.db2.gz LVYNJVMDHQUFNT-QWRGUYRKSA-N 1 2 220.316 2.056 20 0 BEADLO CC(C)C[NH2+][C@@H](c1nnc[nH]1)c1ccc(F)cc1 ZINC000340167009 167013989 /nfs/dbraw/zinc/01/39/89/167013989.db2.gz RWTCAGAOFSVDNA-GFCCVEGCSA-N 1 2 248.305 2.279 20 0 BEADLO CC(C)CNc1ccc(-n2cc[nH+]c2)nc1 ZINC000037040407 167016148 /nfs/dbraw/zinc/01/61/48/167016148.db2.gz RPVCTXLWPTVDKB-UHFFFAOYSA-N 1 2 216.288 2.335 20 0 BEADLO CC(C)CNc1cc(N2CCCC2)nc[nH+]1 ZINC000243810525 167016580 /nfs/dbraw/zinc/01/65/80/167016580.db2.gz QQENWSCLELRHDW-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO CC(C)CNc1cc(N2CCCC2)[nH+]cn1 ZINC000243810525 167016583 /nfs/dbraw/zinc/01/65/83/167016583.db2.gz QQENWSCLELRHDW-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO CC(C)NC(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000117741201 167088771 /nfs/dbraw/zinc/08/87/71/167088771.db2.gz UHUREFOPMVEUGK-UHFFFAOYSA-N 1 2 229.283 2.011 20 0 BEADLO CC(C)OC(=O)[C@@H](C)[N@H+](C)Cc1ccccc1 ZINC000126634470 167168414 /nfs/dbraw/zinc/16/84/14/167168414.db2.gz QTAKLZXRCGBTHQ-GFCCVEGCSA-N 1 2 235.327 2.459 20 0 BEADLO CC(C)OC(=O)[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000126634470 167168415 /nfs/dbraw/zinc/16/84/15/167168415.db2.gz QTAKLZXRCGBTHQ-GFCCVEGCSA-N 1 2 235.327 2.459 20 0 BEADLO CC(C)OCCCN(C)c1cccc[nH+]1 ZINC000354354537 167211214 /nfs/dbraw/zinc/21/12/14/167211214.db2.gz UWOIHFXPYNDNQJ-UHFFFAOYSA-N 1 2 208.305 2.333 20 0 BEADLO CC(C)OCC[N@@H+]1CCC[C@H]1C(F)F ZINC000353192113 167232297 /nfs/dbraw/zinc/23/22/97/167232297.db2.gz BGVILSTWZKGLKU-VIFPVBQESA-N 1 2 207.264 2.141 20 0 BEADLO CC(C)OCC[N@H+]1CCC[C@H]1C(F)F ZINC000353192113 167232298 /nfs/dbraw/zinc/23/22/98/167232298.db2.gz BGVILSTWZKGLKU-VIFPVBQESA-N 1 2 207.264 2.141 20 0 BEADLO CC(C)O[C@H]1C[C@@H]([NH2+]Cc2ccn[nH]2)C1(C)C ZINC000361238161 167282987 /nfs/dbraw/zinc/28/29/87/167282987.db2.gz SIOBFOVLFCHGQV-NEPJUHHUSA-N 1 2 237.347 2.091 20 0 BEADLO CC(C)Oc1ccc(C[NH2+]Cc2ccn[nH]2)cc1 ZINC000041015165 167294437 /nfs/dbraw/zinc/29/44/37/167294437.db2.gz HBQKJTGAJHKFOX-UHFFFAOYSA-N 1 2 245.326 2.487 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCCC1(F)F)c1cn[nH]c1 ZINC000398025856 410940706 /nfs/dbraw/zinc/94/07/06/410940706.db2.gz DTVMPMYXWDNFRS-APPZFPTMSA-N 1 2 215.247 2.248 20 0 BEADLO CC(C)[C@@H](NC(=O)c1ccco1)c1[nH]cc[nH+]1 ZINC000276594851 167428702 /nfs/dbraw/zinc/42/87/02/167428702.db2.gz KWYGPTCHSKKUIY-SNVBAGLBSA-N 1 2 233.271 2.130 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1C[C@@H]1C1CCCC1 ZINC000651427303 411015310 /nfs/dbraw/zinc/01/53/10/411015310.db2.gz SIRYVZARLGPJAM-VXGBXAGGSA-N 1 2 247.342 2.161 20 0 BEADLO CC[C@@H]1CN(c2cc(C)[nH+]cn2)[C@@H](CC)CO1 ZINC000651396753 410978260 /nfs/dbraw/zinc/97/82/60/410978260.db2.gz CBIVLTKMNRAJKJ-NWDGAFQWSA-N 1 2 235.331 2.179 20 0 BEADLO Cc1cc(N2CC[C@@]3(CC3(F)F)C2)nc[nH+]1 ZINC000651488198 411071921 /nfs/dbraw/zinc/07/19/21/411071921.db2.gz RAIXSFSGNISGGF-SNVBAGLBSA-N 1 2 225.242 2.021 20 0 BEADLO Cc1cc(N[C@H](C)COCC2CC2)nc[nH+]1 ZINC000651459057 411043263 /nfs/dbraw/zinc/04/32/63/411043263.db2.gz ZPUMUHUYPFUMER-SNVBAGLBSA-N 1 2 221.304 2.012 20 0 BEADLO CC[C@@H](NC(=O)[C@@H]1C[C@H]1C1CCC1)c1[nH]cc[nH+]1 ZINC000651752922 411141692 /nfs/dbraw/zinc/14/16/92/411141692.db2.gz ZKRRUBYZXCNKSM-QJPTWQEYSA-N 1 2 247.342 2.413 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2C[C@H]2CC(C)(C)C)c[nH+]1 ZINC000652758794 411151570 /nfs/dbraw/zinc/15/15/70/411151570.db2.gz JPWBGNKPMWNHSO-VHSXEESVSA-N 1 2 235.331 2.273 20 0 BEADLO C[C@H]1C[C@@H]1C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000046106038 411156811 /nfs/dbraw/zinc/15/68/11/411156811.db2.gz ROOJFGJKYFBLOA-GWCFXTLKSA-N 1 2 241.294 2.467 20 0 BEADLO C[C@@H]1C[C@@H]1C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000046106037 411157067 /nfs/dbraw/zinc/15/70/67/411157067.db2.gz ROOJFGJKYFBLOA-MFKMUULPSA-N 1 2 241.294 2.467 20 0 BEADLO C[C@H]1C[C@H]1C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000046106040 411157650 /nfs/dbraw/zinc/15/76/50/411157650.db2.gz ROOJFGJKYFBLOA-GXFFZTMASA-N 1 2 241.294 2.467 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)C[C@@H]1CCCCC1(C)C ZINC000659995492 411160582 /nfs/dbraw/zinc/16/05/82/411160582.db2.gz TXNHPLZVRTXTNS-NSHDSACASA-N 1 2 236.363 2.453 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)C[C@@H]1CCCCC1(C)C ZINC000659995492 411160584 /nfs/dbraw/zinc/16/05/84/411160584.db2.gz TXNHPLZVRTXTNS-NSHDSACASA-N 1 2 236.363 2.453 20 0 BEADLO CC(C)c1nc(N[C@H]2C[C@@H](O)C2(C)C)cc[nH+]1 ZINC000302480901 167691694 /nfs/dbraw/zinc/69/16/94/167691694.db2.gz XPEFSOUOWOSJEE-VHSXEESVSA-N 1 2 235.331 2.171 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2C[C@H](C)O[C@@H]2C)c1 ZINC000652067703 411103016 /nfs/dbraw/zinc/10/30/16/411103016.db2.gz DHWBWRQVOWLFIJ-HOSYDEDBSA-N 1 2 236.315 2.206 20 0 BEADLO COCc1cc[nH+]c(N[C@H]2CCCOCC2)c1 ZINC000652068038 411104854 /nfs/dbraw/zinc/10/48/54/411104854.db2.gz PRBIXYFXBMDKIX-LBPRGKRZSA-N 1 2 236.315 2.209 20 0 BEADLO COCc1cc[nH+]c(NC2CC(C)C2)c1 ZINC000652067760 411105704 /nfs/dbraw/zinc/10/57/04/411105704.db2.gz GMQSXVIRKJPRNF-UHFFFAOYSA-N 1 2 206.289 2.438 20 0 BEADLO CCc1nnc([C@H](C)[N@@H+]2CCC=C(C)C2)[nH]1 ZINC000660462755 411172721 /nfs/dbraw/zinc/17/27/21/411172721.db2.gz SULMMNKFFAYFTH-JTQLQIEISA-N 1 2 220.320 2.080 20 0 BEADLO CCc1nnc([C@H](C)[N@H+]2CCC=C(C)C2)[nH]1 ZINC000660462755 411172725 /nfs/dbraw/zinc/17/27/25/411172725.db2.gz SULMMNKFFAYFTH-JTQLQIEISA-N 1 2 220.320 2.080 20 0 BEADLO COc1c(C)[nH+]cnc1N(C)Cc1ccoc1 ZINC000656111175 411180825 /nfs/dbraw/zinc/18/08/25/411180825.db2.gz LPDLHTWJRYQZBQ-UHFFFAOYSA-N 1 2 233.271 2.023 20 0 BEADLO COc1c(C)[nH+]cnc1NCC(C)(C)C ZINC000656111810 411181635 /nfs/dbraw/zinc/18/16/35/411181635.db2.gz BMZIPUIHRZBOAS-UHFFFAOYSA-N 1 2 209.293 2.252 20 0 BEADLO Cc1c[nH+]c(C)nc1NC[C@@H](O)CC(C)(C)C ZINC000656126982 411183083 /nfs/dbraw/zinc/18/30/83/411183083.db2.gz GCYLCLWPPMNIKJ-NSHDSACASA-N 1 2 237.347 2.302 20 0 BEADLO Cc1c[nH+]c(C)c(NCc2cn(C(C)C)nn2)c1 ZINC000404602042 411183691 /nfs/dbraw/zinc/18/36/91/411183691.db2.gz MXKCIBADZBKUCI-UHFFFAOYSA-N 1 2 245.330 2.483 20 0 BEADLO CC[C@]1(C)CCN(c2nc[nH+]c(C)c2OC)C1 ZINC000656146677 411186085 /nfs/dbraw/zinc/18/60/85/411186085.db2.gz JXPJXYYAUBJUFE-CYBMUJFWSA-N 1 2 235.331 2.420 20 0 BEADLO COc1c(C)[nH+]cnc1N1CCC2(CCC2)C1 ZINC000656146695 411186314 /nfs/dbraw/zinc/18/63/14/411186314.db2.gz KNFQDXOYJFALPN-UHFFFAOYSA-N 1 2 233.315 2.174 20 0 BEADLO COc1c(C)[nH+]cnc1N1CC[C@@H](C(C)C)C1 ZINC000656146578 411186364 /nfs/dbraw/zinc/18/63/64/411186364.db2.gz YIAWAZVPORPLMF-LLVKDONJSA-N 1 2 235.331 2.276 20 0 BEADLO COc1c(C)[nH+]cnc1NC[C@@H]1CCCS1 ZINC000656145156 411186425 /nfs/dbraw/zinc/18/64/25/411186425.db2.gz MPFRNZTXYJTIMW-VIFPVBQESA-N 1 2 239.344 2.101 20 0 BEADLO c1cn(Cc2cn(C3CCCCC3)nn2)c[nH+]1 ZINC000656438002 411248227 /nfs/dbraw/zinc/24/82/27/411248227.db2.gz RWZKDAYYHHJDDJ-UHFFFAOYSA-N 1 2 231.303 2.028 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@@H]2CCCn3nccc32)no1 ZINC000658005377 411195932 /nfs/dbraw/zinc/19/59/32/411195932.db2.gz ZGMRZKMJCNTTBL-GHMZBOCLSA-N 1 2 246.314 2.365 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1CC[C@@H]1C ZINC000656188210 411197098 /nfs/dbraw/zinc/19/70/98/411197098.db2.gz ZRZUPVIJTNGIEP-IONNQARKSA-N 1 2 207.277 2.004 20 0 BEADLO COc1c(C)[nH+]cnc1N1CCC[C@H](C2CC2)C1 ZINC000656188592 411197731 /nfs/dbraw/zinc/19/77/31/411197731.db2.gz CXFXNXWMTVMOLJ-LBPRGKRZSA-N 1 2 247.342 2.420 20 0 BEADLO CCC[C@@H](CNc1nc[nH+]c(C)c1OC)OC ZINC000656192628 411198576 /nfs/dbraw/zinc/19/85/76/411198576.db2.gz MHHYNWMVAFKAKS-JTQLQIEISA-N 1 2 239.319 2.021 20 0 BEADLO CC[C@@](C)(CNc1nc[nH+]c(C)c1OC)OC ZINC000656194572 411201525 /nfs/dbraw/zinc/20/15/25/411201525.db2.gz KSZIVBIHYQAMLA-LBPRGKRZSA-N 1 2 239.319 2.021 20 0 BEADLO CC[C@H]([NH2+][C@H]1CCCn2nccc21)C(F)F ZINC000658024257 411201632 /nfs/dbraw/zinc/20/16/32/411201632.db2.gz ITBYZANBHFZUIC-IUCAKERBSA-N 1 2 229.274 2.351 20 0 BEADLO COCc1cc[nH+]c(N[C@H](C)C(C)(C)OC)c1 ZINC000652330848 411202245 /nfs/dbraw/zinc/20/22/45/411202245.db2.gz QQYDLOVQUNDZHN-SNVBAGLBSA-N 1 2 238.331 2.453 20 0 BEADLO COc1c(C)[nH+]cnc1N1CC(C)(C)C[C@H]1C ZINC000656201994 411205914 /nfs/dbraw/zinc/20/59/14/411205914.db2.gz YJPUADOTYVBRKJ-SECBINFHSA-N 1 2 235.331 2.418 20 0 BEADLO Cn1cc([C@@H]2C[N@H+](CC(F)F)CC2(C)C)cn1 ZINC000653710691 411207323 /nfs/dbraw/zinc/20/73/23/411207323.db2.gz VOCDVIOPSCPTTD-JTQLQIEISA-N 1 2 243.301 2.111 20 0 BEADLO Cn1cc([C@@H]2C[N@@H+](CC(F)F)CC2(C)C)cn1 ZINC000653710691 411207326 /nfs/dbraw/zinc/20/73/26/411207326.db2.gz VOCDVIOPSCPTTD-JTQLQIEISA-N 1 2 243.301 2.111 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1CCS[C@H]1C ZINC000656203591 411207463 /nfs/dbraw/zinc/20/74/63/411207463.db2.gz KNLIDEJXIWZEBX-DTWKUNHWSA-N 1 2 239.344 2.100 20 0 BEADLO Cc1c[nH+]c(CCNc2ncc(F)cn2)c(C)c1 ZINC000656210874 411210432 /nfs/dbraw/zinc/21/04/32/411210432.db2.gz JFNMJHLBBAYPTH-UHFFFAOYSA-N 1 2 246.289 2.282 20 0 BEADLO C[C@H]([NH2+][C@H]1C[C@H](C)n2ncnc21)c1ccccn1 ZINC000658101340 411246036 /nfs/dbraw/zinc/24/60/36/411246036.db2.gz LFQUVSBFYYEXGL-NHCYSSNCSA-N 1 2 243.314 2.030 20 0 BEADLO Cc1cc(N[C@@H](C)Cc2ccccn2)nc[nH+]1 ZINC000656221134 411213411 /nfs/dbraw/zinc/21/34/11/411213411.db2.gz FRAIEVMIJMIJEJ-NSHDSACASA-N 1 2 228.299 2.223 20 0 BEADLO CC1(C)CC[C@H]1C(=O)Nc1ccc(N)[nH+]c1 ZINC000659293599 411215809 /nfs/dbraw/zinc/21/58/09/411215809.db2.gz FUVFDXVCDXBSOF-VIFPVBQESA-N 1 2 219.288 2.039 20 0 BEADLO COCc1ccc(C[NH+]2CC3(CC3(F)F)C2)o1 ZINC000656265840 411221907 /nfs/dbraw/zinc/22/19/07/411221907.db2.gz KWYRCYHYGGLLBP-UHFFFAOYSA-N 1 2 243.253 2.267 20 0 BEADLO Cc1nc(CN[C@H]2CCCn3cc[nH+]c32)cs1 ZINC000655698203 411247396 /nfs/dbraw/zinc/24/73/96/411247396.db2.gz ZPUQDGDOAXJQGQ-NSHDSACASA-N 1 2 248.355 2.273 20 0 BEADLO CCCCCC(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000652410114 411231615 /nfs/dbraw/zinc/23/16/15/411231615.db2.gz BEVZICPVCBZSIA-UHFFFAOYSA-N 1 2 223.320 2.341 20 0 BEADLO CC(C)(NC(=O)[C@H]1CC12CCCC2)c1[nH]cc[nH+]1 ZINC000652411802 411234229 /nfs/dbraw/zinc/23/42/29/411234229.db2.gz VZMMBMIWDMJJRC-SNVBAGLBSA-N 1 2 247.342 2.341 20 0 BEADLO Cc1cc(C(=O)NC(C)(C)c2[nH]cc[nH+]2)cs1 ZINC000652412665 411234294 /nfs/dbraw/zinc/23/42/94/411234294.db2.gz NQEXCTOVFROFLT-UHFFFAOYSA-N 1 2 249.339 2.445 20 0 BEADLO C[C@H]1Cc2cc(-c3[nH+]ccn3C)ccc2O1 ZINC000656371567 411236316 /nfs/dbraw/zinc/23/63/16/411236316.db2.gz INTXCBWEWQKGIF-VIFPVBQESA-N 1 2 214.268 2.411 20 0 BEADLO Cc1cc(-c2[nH+]ccn2C)c2c(c1)C(=O)CCO2 ZINC000656371345 411236638 /nfs/dbraw/zinc/23/66/38/411236638.db2.gz DWTOBBSDBWUXJI-UHFFFAOYSA-N 1 2 242.278 2.361 20 0 BEADLO Cc1cscc1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000086795660 411261951 /nfs/dbraw/zinc/26/19/51/411261951.db2.gz JWOZEAPHGYQCIY-UHFFFAOYSA-N 1 2 235.312 2.052 20 0 BEADLO CC(C)[C@@H]1C[C@H]1CNC(=O)CCCn1cc[nH+]c1 ZINC000653965150 411278219 /nfs/dbraw/zinc/27/82/19/411278219.db2.gz XDMFCNRGPQJYES-STQMWFEESA-N 1 2 249.358 2.072 20 0 BEADLO CCn1cc(C[NH2+][C@@H](C)c2cc(C)c(C)o2)nn1 ZINC000658177681 411282874 /nfs/dbraw/zinc/28/28/74/411282874.db2.gz UMPIOLBFZRLXSY-JTQLQIEISA-N 1 2 248.330 2.359 20 0 BEADLO Cc1ncc(C[NH+]2CC(CC(F)(F)F)C2)cn1 ZINC000656686346 411328778 /nfs/dbraw/zinc/32/87/78/411328778.db2.gz GAFBLBNIZFBJNF-UHFFFAOYSA-N 1 2 245.248 2.169 20 0 BEADLO FC(F)C1C[NH+](Cc2ccc3c(n2)CCC3)C1 ZINC000656691494 411330166 /nfs/dbraw/zinc/33/01/66/411330166.db2.gz BURLRWKAJJLMSS-UHFFFAOYSA-N 1 2 238.281 2.267 20 0 BEADLO CC[S@](=O)Cc1c[nH+]cn1Cc1ccccc1 ZINC000445539323 411304481 /nfs/dbraw/zinc/30/44/81/411304481.db2.gz MDKXTMORLPQIMX-KRWDZBQOSA-N 1 2 248.351 2.200 20 0 BEADLO FC(F)C1C[NH+](Cc2nc3c(s2)CCC3)C1 ZINC000656690065 411330984 /nfs/dbraw/zinc/33/09/84/411330984.db2.gz GPWATFHHNMWOMA-UHFFFAOYSA-N 1 2 244.310 2.329 20 0 BEADLO CC1(C)CCC[C@@H](C(=O)NCCn2cc[nH+]c2)C1 ZINC000179295529 167905741 /nfs/dbraw/zinc/90/57/41/167905741.db2.gz QPJTVWCIAWLBBG-GFCCVEGCSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@H](CC(=O)NCc1c[nH+]c[nH]1)c1ccccc1 ZINC000359680471 411313548 /nfs/dbraw/zinc/31/35/48/411313548.db2.gz KFAZIQDHDLKAQM-LLVKDONJSA-N 1 2 243.310 2.220 20 0 BEADLO C[C@H](CC(=O)NCc1c[nH]c[nH+]1)c1ccccc1 ZINC000359680471 411313553 /nfs/dbraw/zinc/31/35/53/411313553.db2.gz KFAZIQDHDLKAQM-LLVKDONJSA-N 1 2 243.310 2.220 20 0 BEADLO C[C@H]([NH2+][C@@H]1C[C@@H](C)n2ncnc21)c1cccnc1 ZINC000656679786 411320351 /nfs/dbraw/zinc/32/03/51/411320351.db2.gz KLOYSSDFIQZNGD-JFGNBEQYSA-N 1 2 243.314 2.030 20 0 BEADLO C[C@H]([NH2+][C@H]1C[C@@H](C)n2ncnc21)c1ccncc1 ZINC000656678566 411323380 /nfs/dbraw/zinc/32/33/80/411323380.db2.gz ADYAQZGPUIPXBY-SCVCMEIPSA-N 1 2 243.314 2.030 20 0 BEADLO c1cn(Cc2cn(CC3CCCCC3)nn2)c[nH+]1 ZINC000656445874 411255470 /nfs/dbraw/zinc/25/54/70/411255470.db2.gz XQPKKBXJBRQLGO-UHFFFAOYSA-N 1 2 245.330 2.103 20 0 BEADLO COc1cc(C[N@H+](C)[C@H](C)c2cccnc2)on1 ZINC000660140322 411256721 /nfs/dbraw/zinc/25/67/21/411256721.db2.gz LDYYNUPCLUYJPO-SNVBAGLBSA-N 1 2 247.298 2.271 20 0 BEADLO COc1cc(C[N@@H+](C)[C@H](C)c2cccnc2)on1 ZINC000660140322 411256723 /nfs/dbraw/zinc/25/67/23/411256723.db2.gz LDYYNUPCLUYJPO-SNVBAGLBSA-N 1 2 247.298 2.271 20 0 BEADLO CC1(C2(NC(=O)CCCn3cc[nH+]c3)CC2)CC1 ZINC000654216122 411352830 /nfs/dbraw/zinc/35/28/30/411352830.db2.gz JPXAYIRBPIRHRU-UHFFFAOYSA-N 1 2 247.342 2.112 20 0 BEADLO Cc1[nH+]cccc1NCc1cnn2c1CCC2 ZINC000656769733 411363158 /nfs/dbraw/zinc/36/31/58/411363158.db2.gz YMGQTNKLWMFDTR-UHFFFAOYSA-N 1 2 228.299 2.145 20 0 BEADLO Cc1cc(NCc2[nH+]ccn2C(C)C)no1 ZINC000656768158 411363443 /nfs/dbraw/zinc/36/34/43/411363443.db2.gz JXPPHYAVVQKGRF-UHFFFAOYSA-N 1 2 220.276 2.373 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccoc2)nc(C)n1 ZINC000659853625 411344047 /nfs/dbraw/zinc/34/40/47/411344047.db2.gz UQYNISAGFVYXTQ-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccoc2)nc(C)n1 ZINC000659853625 411344049 /nfs/dbraw/zinc/34/40/49/411344049.db2.gz UQYNISAGFVYXTQ-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CC1(C[NH2+]c2ccc3c(c2)CCO3)COC1 ZINC000227523388 168048040 /nfs/dbraw/zinc/04/80/40/168048040.db2.gz NYJMUOMYGJQDDZ-UHFFFAOYSA-N 1 2 219.284 2.070 20 0 BEADLO CCn1cc([C@H](C)[NH2+][C@H](C)c2nccn2C)cn1 ZINC000658338478 411346214 /nfs/dbraw/zinc/34/62/14/411346214.db2.gz YXLYZNVCOHIKFQ-WDEREUQCSA-N 1 2 247.346 2.048 20 0 BEADLO CCn1cc([C@@H](C)[NH2+][C@H](C)c2nccn2C)cn1 ZINC000658338475 411346458 /nfs/dbraw/zinc/34/64/58/411346458.db2.gz YXLYZNVCOHIKFQ-GHMZBOCLSA-N 1 2 247.346 2.048 20 0 BEADLO CC1(CNC(=O)CCc2[nH]cc[nH+]2)CCCCC1 ZINC000288303670 168029680 /nfs/dbraw/zinc/02/96/80/168029680.db2.gz HTRZEOGQXZBIHK-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO CC1(CO)CCN(c2[nH]c3ccccc3[nH+]2)CC1 ZINC000273871998 168051033 /nfs/dbraw/zinc/05/10/33/168051033.db2.gz OSNNOCIXXKWKML-UHFFFAOYSA-N 1 2 245.326 2.162 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2CCC(C)=C(C)C2)no1 ZINC000289402994 168085964 /nfs/dbraw/zinc/08/59/64/168085964.db2.gz OFWHLKRUQCLHCP-JTQLQIEISA-N 1 2 221.304 2.481 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2CCC(C)=C(C)C2)no1 ZINC000289402994 168085967 /nfs/dbraw/zinc/08/59/67/168085967.db2.gz OFWHLKRUQCLHCP-JTQLQIEISA-N 1 2 221.304 2.481 20 0 BEADLO CC1=C(C)C[C@@H](C(=O)NCc2[nH+]ccn2C)CC1 ZINC000335532804 168086316 /nfs/dbraw/zinc/08/63/16/168086316.db2.gz CZUMYIRDRHHPRF-LBPRGKRZSA-N 1 2 247.342 2.173 20 0 BEADLO CC1=C(C2CCOCC2)N2CC[NH+]=C2S1 ZINC000295424614 168086445 /nfs/dbraw/zinc/08/64/45/168086445.db2.gz YPHCDSRXADSGQG-UHFFFAOYSA-N 1 2 224.329 2.063 20 0 BEADLO CC1=C(c2ccco2)C[N@@H+]([C@H]2CCOC2=O)CC1 ZINC000374512039 168089298 /nfs/dbraw/zinc/08/92/98/168089298.db2.gz FHUHSHBHWIJACX-LBPRGKRZSA-N 1 2 247.294 2.074 20 0 BEADLO CC1=C(c2ccco2)C[N@H+]([C@H]2CCOC2=O)CC1 ZINC000374512039 168089301 /nfs/dbraw/zinc/08/93/01/168089301.db2.gz FHUHSHBHWIJACX-LBPRGKRZSA-N 1 2 247.294 2.074 20 0 BEADLO CC1=CCC[N@H+](Cc2nnc3n2CCCCC3)C1 ZINC000280820699 168100659 /nfs/dbraw/zinc/10/06/59/168100659.db2.gz NGLXOGFNWJASAS-UHFFFAOYSA-N 1 2 246.358 2.157 20 0 BEADLO CC1=CCC[N@@H+](Cc2nnc3n2CCCCC3)C1 ZINC000280820699 168100660 /nfs/dbraw/zinc/10/06/60/168100660.db2.gz NGLXOGFNWJASAS-UHFFFAOYSA-N 1 2 246.358 2.157 20 0 BEADLO Cc1ccc(CNCC[N@H+]2CC=C(C)CC2)nc1 ZINC000358175955 168113172 /nfs/dbraw/zinc/11/31/72/168113172.db2.gz VRHGTZOYLDHBBV-UHFFFAOYSA-N 1 2 245.370 2.132 20 0 BEADLO Cc1ccc(CNCC[N@@H+]2CC=C(C)CC2)nc1 ZINC000358175955 168113175 /nfs/dbraw/zinc/11/31/75/168113175.db2.gz VRHGTZOYLDHBBV-UHFFFAOYSA-N 1 2 245.370 2.132 20 0 BEADLO CC1=CC[N@H+](Cc2nc(-c3ccoc3)no2)CC1 ZINC000336237447 168115882 /nfs/dbraw/zinc/11/58/82/168115882.db2.gz NKEDHQFWOURUEP-UHFFFAOYSA-N 1 2 245.282 2.482 20 0 BEADLO CC1=CC[N@@H+](Cc2nc(-c3ccoc3)no2)CC1 ZINC000336237447 168115884 /nfs/dbraw/zinc/11/58/84/168115884.db2.gz NKEDHQFWOURUEP-UHFFFAOYSA-N 1 2 245.282 2.482 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CC=C(C)CC2)o1 ZINC000270335530 168116954 /nfs/dbraw/zinc/11/69/54/168116954.db2.gz MQYBHEYKKGRZOF-SECBINFHSA-N 1 2 207.277 2.091 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CC=C(C)CC2)o1 ZINC000270335530 168116957 /nfs/dbraw/zinc/11/69/57/168116957.db2.gz MQYBHEYKKGRZOF-SECBINFHSA-N 1 2 207.277 2.091 20 0 BEADLO CC1C[NH+](Cc2ccc(Br)cn2)C1 ZINC000306464516 168189778 /nfs/dbraw/zinc/18/97/78/168189778.db2.gz IFJFJRGVQHBROC-UHFFFAOYSA-N 1 2 241.132 2.296 20 0 BEADLO CC1C[NH+](Cc2ccc(Br)o2)C1 ZINC000307500175 168190655 /nfs/dbraw/zinc/19/06/55/168190655.db2.gz MJPALWJSRLJFKO-UHFFFAOYSA-N 1 2 230.105 2.494 20 0 BEADLO CCC(C)(C)C(=O)NCc1ccc(N(C)C)[nH+]c1 ZINC000263768384 168266806 /nfs/dbraw/zinc/26/68/06/168266806.db2.gz LLZITAIQRGGRFM-UHFFFAOYSA-N 1 2 249.358 2.200 20 0 BEADLO CCC(C)(C)N(C)C(=O)[C@H]1CCn2cc[nH+]c2C1 ZINC000336543362 168284779 /nfs/dbraw/zinc/28/47/79/168284779.db2.gz QUXXUACFILDFLW-NSHDSACASA-N 1 2 249.358 2.093 20 0 BEADLO CO[C@@H](COCc1[nH]cc[nH+]1)c1ccccc1 ZINC000282601337 411455221 /nfs/dbraw/zinc/45/52/21/411455221.db2.gz GCOGQBFJEZILAG-LBPRGKRZSA-N 1 2 232.283 2.314 20 0 BEADLO Cc1nc(N[C@@H]2CCS[C@H]2C)cc[nH+]1 ZINC000306676182 411456172 /nfs/dbraw/zinc/45/61/72/411456172.db2.gz VIUBBWXFVMYCQD-IONNQARKSA-N 1 2 209.318 2.091 20 0 BEADLO CC(C)CCN(C)C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000654470787 411401597 /nfs/dbraw/zinc/40/15/97/411401597.db2.gz ULKWIEBJCJDIGI-NSHDSACASA-N 1 2 237.347 2.093 20 0 BEADLO CC(C)CCN(C)C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000654470787 411401600 /nfs/dbraw/zinc/40/16/00/411401600.db2.gz ULKWIEBJCJDIGI-NSHDSACASA-N 1 2 237.347 2.093 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)NC3CC=CC3)ccn12 ZINC000654895552 411461568 /nfs/dbraw/zinc/46/15/68/411461568.db2.gz YGUVDEHQCGLHRO-UHFFFAOYSA-N 1 2 241.294 2.091 20 0 BEADLO Cc1nsc(C)c1C[N@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC000653562140 411421612 /nfs/dbraw/zinc/42/16/12/411421612.db2.gz FMMAEAZZWDEQKX-PHIMTYICSA-N 1 2 238.356 2.123 20 0 BEADLO Cc1nsc(C)c1C[N@@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC000653562140 411421613 /nfs/dbraw/zinc/42/16/13/411421613.db2.gz FMMAEAZZWDEQKX-PHIMTYICSA-N 1 2 238.356 2.123 20 0 BEADLO c1c[nH+]c(COC[C@@H]2CC[C@H]3C[C@H]3C2)[nH]1 ZINC000657254648 411435610 /nfs/dbraw/zinc/43/56/10/411435610.db2.gz BILURTLIZLNEKG-OUAUKWLOSA-N 1 2 206.289 2.363 20 0 BEADLO Cc1noc(C)c1C[NH2+]Cc1nccn1C(C)C ZINC000657328907 411467039 /nfs/dbraw/zinc/46/70/39/411467039.db2.gz GVKCLLVZRSWKJN-UHFFFAOYSA-N 1 2 248.330 2.359 20 0 BEADLO CSc1cccc(C[NH+]2CCN(C)CC2)c1 ZINC000659832556 411468207 /nfs/dbraw/zinc/46/82/07/411468207.db2.gz VMGGZVUIMZRLBD-UHFFFAOYSA-N 1 2 236.384 2.156 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N3CC=CCC3)ccn12 ZINC000654988046 411470588 /nfs/dbraw/zinc/47/05/88/411470588.db2.gz XQCFHXUNFPTJCN-UHFFFAOYSA-N 1 2 241.294 2.045 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@@H](C)c2cnn(C(C)C)c2)n1 ZINC000657359869 411477476 /nfs/dbraw/zinc/47/74/76/411477476.db2.gz QFHWRPWABVJISX-NSHDSACASA-N 1 2 247.346 2.346 20 0 BEADLO Cc1c[nH]c(CNCc2cc(C(C)C)no2)[nH+]1 ZINC000657361753 411478013 /nfs/dbraw/zinc/47/80/13/411478013.db2.gz RNIJPCGCDSSFGW-UHFFFAOYSA-N 1 2 234.303 2.119 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@H](C)c2c(C)noc2C)n1 ZINC000657367812 411480280 /nfs/dbraw/zinc/48/02/80/411480280.db2.gz RPOITYFZYNOEPT-MRVPVSSYSA-N 1 2 234.303 2.174 20 0 BEADLO COC(C)(C)CC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000297932122 411483503 /nfs/dbraw/zinc/48/35/03/411483503.db2.gz YQKWRHFHFCHVGT-UHFFFAOYSA-N 1 2 247.298 2.088 20 0 BEADLO Cc1c[nH]c(CN[C@H](C)c2ncc(C)s2)[nH+]1 ZINC000657389438 411491636 /nfs/dbraw/zinc/49/16/36/411491636.db2.gz VSIYWIXLMATOAK-SECBINFHSA-N 1 2 236.344 2.334 20 0 BEADLO CSc1ccc(NCc2[nH]cc(C)[nH+]2)nc1 ZINC000657401906 411496295 /nfs/dbraw/zinc/49/62/95/411496295.db2.gz HVQRCONXDVLRQB-UHFFFAOYSA-N 1 2 234.328 2.447 20 0 BEADLO CC[C@H]1C[C@@H](Nc2ccc(C)[nH+]c2)CO1 ZINC000657402862 411497772 /nfs/dbraw/zinc/49/77/72/411497772.db2.gz KGFZLAJOJRCYTO-NEPJUHHUSA-N 1 2 206.289 2.369 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nc(C)oc2C)C[C@H](C)O1 ZINC000659920953 411499405 /nfs/dbraw/zinc/49/94/05/411499405.db2.gz YCFFLJROJGXADB-JOYOIKCWSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nc(C)oc2C)C[C@H](C)O1 ZINC000659920953 411499407 /nfs/dbraw/zinc/49/94/07/411499407.db2.gz YCFFLJROJGXADB-JOYOIKCWSA-N 1 2 238.331 2.291 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1C[C@H](C)[C@@H](C)[C@H]1C ZINC000655150397 411506246 /nfs/dbraw/zinc/50/62/46/411506246.db2.gz MCIXTSAOBWENEX-WRWGMCAJSA-N 1 2 249.358 2.091 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1C[C@H](C)[C@@H](C)[C@H]1C ZINC000655150397 411506248 /nfs/dbraw/zinc/50/62/48/411506248.db2.gz MCIXTSAOBWENEX-WRWGMCAJSA-N 1 2 249.358 2.091 20 0 BEADLO Cc1c[nH]c(CN[C@@H](C(C)C)C(F)(F)F)[nH+]1 ZINC000657445007 411512869 /nfs/dbraw/zinc/51/28/69/411512869.db2.gz VPLCVLHUZOHLRS-VIFPVBQESA-N 1 2 235.253 2.395 20 0 BEADLO CCC[C@@]1(C)CCC[N@H+](CCc2cnn[nH]2)C1 ZINC000659970984 411514231 /nfs/dbraw/zinc/51/42/31/411514231.db2.gz MBQUNQJQVKWCIV-ZDUSSCGKSA-N 1 2 236.363 2.249 20 0 BEADLO CCC[C@@]1(C)CCC[N@@H+](CCc2cnn[nH]2)C1 ZINC000659970984 411514235 /nfs/dbraw/zinc/51/42/35/411514235.db2.gz MBQUNQJQVKWCIV-ZDUSSCGKSA-N 1 2 236.363 2.249 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@H]2c3ccccc3O[C@H]2C)n1 ZINC000657469910 411522011 /nfs/dbraw/zinc/52/20/11/411522011.db2.gz XYWXQDUDNFDPKD-IINYFYTJSA-N 1 2 243.310 2.330 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@@H]2c3ccccc3O[C@H]2C)n1 ZINC000657469908 411522120 /nfs/dbraw/zinc/52/21/20/411522120.db2.gz XYWXQDUDNFDPKD-HZMBPMFUSA-N 1 2 243.310 2.330 20 0 BEADLO Cn1cnc(C[N@@H+]2CCC[C@H]2c2ccccn2)c1 ZINC000659994287 411522642 /nfs/dbraw/zinc/52/26/42/411522642.db2.gz MWADFELMONSEGR-AWEZNQCLSA-N 1 2 242.326 2.152 20 0 BEADLO Cn1cnc(C[N@H+]2CCC[C@H]2c2ccccn2)c1 ZINC000659994287 411522643 /nfs/dbraw/zinc/52/26/43/411522643.db2.gz MWADFELMONSEGR-AWEZNQCLSA-N 1 2 242.326 2.152 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccnn1CC1CC1)C(F)F ZINC000657476133 411524590 /nfs/dbraw/zinc/52/45/90/411524590.db2.gz AVENWHHHDZYQJV-LLVKDONJSA-N 1 2 243.301 2.426 20 0 BEADLO CC(C)c1cccc(C[N@@H+]2CCO[C@H](CO)C2)c1 ZINC000659999407 411525490 /nfs/dbraw/zinc/52/54/90/411525490.db2.gz QFEZSECSQANBHN-HNNXBMFYSA-N 1 2 249.354 2.003 20 0 BEADLO CC(C)c1cccc(C[N@H+]2CCO[C@H](CO)C2)c1 ZINC000659999407 411525491 /nfs/dbraw/zinc/52/54/91/411525491.db2.gz QFEZSECSQANBHN-HNNXBMFYSA-N 1 2 249.354 2.003 20 0 BEADLO CC(C)CC[C@@H]1CCC[N@@H+]1CCc1cnn[nH]1 ZINC000660011939 411527427 /nfs/dbraw/zinc/52/74/27/411527427.db2.gz IVNFVIQOUHDBHM-ZDUSSCGKSA-N 1 2 236.363 2.248 20 0 BEADLO CC(C)CC[C@@H]1CCC[N@H+]1CCc1cnn[nH]1 ZINC000660011939 411527429 /nfs/dbraw/zinc/52/74/29/411527429.db2.gz IVNFVIQOUHDBHM-ZDUSSCGKSA-N 1 2 236.363 2.248 20 0 BEADLO COc1c(C)cccc1C[NH2+]Cc1ccn(C)n1 ZINC000655832532 411529148 /nfs/dbraw/zinc/52/91/48/411529148.db2.gz VXICSCLQWYCZGN-UHFFFAOYSA-N 1 2 245.326 2.027 20 0 BEADLO CCCn1nccc1C[NH2+]Cc1cnc(CC)o1 ZINC000657485540 411529701 /nfs/dbraw/zinc/52/97/01/411529701.db2.gz KSAKCMQNYKHDPK-UHFFFAOYSA-N 1 2 248.330 2.133 20 0 BEADLO CC[N@@H+]1C[C@H]([NH2+]CCc2cccs2)[C@@H](C)C1 ZINC000309494326 170034634 /nfs/dbraw/zinc/03/46/34/170034634.db2.gz XZUFNXXLXRUYKL-AAEUAGOBSA-N 1 2 238.400 2.220 20 0 BEADLO CC[N@@H+]1C[C@H]([NH2+]CCCC(F)(F)F)[C@@H](C)C1 ZINC000336777911 170035998 /nfs/dbraw/zinc/03/59/98/170035998.db2.gz JVRSQZGKUCNJDM-UWVGGRQHSA-N 1 2 238.297 2.259 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2cc(C)nc(C)n2)CCO1 ZINC000660131761 411543130 /nfs/dbraw/zinc/54/31/30/411543130.db2.gz BQPFHWSMPQCHGS-CQSZACIVSA-N 1 2 249.358 2.094 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2cc(C)nc(C)n2)CCO1 ZINC000660131761 411543132 /nfs/dbraw/zinc/54/31/32/411543132.db2.gz BQPFHWSMPQCHGS-CQSZACIVSA-N 1 2 249.358 2.094 20 0 BEADLO CCNC(=O)C[C@@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000340951245 170070200 /nfs/dbraw/zinc/07/02/00/170070200.db2.gz NRFKOAKOZHPFJB-GFCCVEGCSA-N 1 2 243.310 2.068 20 0 BEADLO C[C@H]1C[C@H]([NH2+]Cc2ccc(F)cc2)c2ncnn21 ZINC000657567520 411552810 /nfs/dbraw/zinc/55/28/10/411552810.db2.gz SAGVVZNZSAMVAZ-CABZTGNLSA-N 1 2 246.289 2.213 20 0 BEADLO CC[NH2+]Cc1noc(C2CCCCC2)n1 ZINC000051860688 170132019 /nfs/dbraw/zinc/13/20/19/170132019.db2.gz IRVOZSNFWVEUTN-UHFFFAOYSA-N 1 2 209.293 2.227 20 0 BEADLO Cc1nc(C[N@@H+]2CCO[C@@H](C(C)C)C2)c(C)o1 ZINC000660222483 411555948 /nfs/dbraw/zinc/55/59/48/411555948.db2.gz VZSXCCJAGPQGLL-CYBMUJFWSA-N 1 2 238.331 2.148 20 0 BEADLO Cc1nc(C[N@H+]2CCO[C@@H](C(C)C)C2)c(C)o1 ZINC000660222483 411555950 /nfs/dbraw/zinc/55/59/50/411555950.db2.gz VZSXCCJAGPQGLL-CYBMUJFWSA-N 1 2 238.331 2.148 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)c(C)o1 ZINC000660222105 411556228 /nfs/dbraw/zinc/55/62/28/411556228.db2.gz TUBBPFQVAZMETJ-LDYMZIIASA-N 1 2 226.295 2.471 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)c(C)o1 ZINC000660222105 411556229 /nfs/dbraw/zinc/55/62/29/411556229.db2.gz TUBBPFQVAZMETJ-LDYMZIIASA-N 1 2 226.295 2.471 20 0 BEADLO CN(Cc1cc(C(C)(C)C)on1)Cc1[nH]cc[nH+]1 ZINC000660141496 411545054 /nfs/dbraw/zinc/54/50/54/411545054.db2.gz DJZJUWBQTISMLB-UHFFFAOYSA-N 1 2 248.330 2.327 20 0 BEADLO CCc1nnc([C@H](C)[N@@H+]2CC[C@@H](C(F)F)C2)[nH]1 ZINC000660146273 411545731 /nfs/dbraw/zinc/54/57/31/411545731.db2.gz FPXHEKQVMPSPDT-JGVFFNPUSA-N 1 2 244.289 2.015 20 0 BEADLO CCc1nnc([C@H](C)[N@H+]2CC[C@@H](C(F)F)C2)[nH]1 ZINC000660146273 411545733 /nfs/dbraw/zinc/54/57/33/411545733.db2.gz FPXHEKQVMPSPDT-JGVFFNPUSA-N 1 2 244.289 2.015 20 0 BEADLO CC[NH2+]c1ccc(O[C@H]2CCOC2)cc1 ZINC000133505222 170174372 /nfs/dbraw/zinc/17/43/72/170174372.db2.gz PVNPJOQHKMVANE-LBPRGKRZSA-N 1 2 207.273 2.286 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1cc2ccccc2o1 ZINC000175178114 170214418 /nfs/dbraw/zinc/21/44/18/170214418.db2.gz MDFNSRZDTCTHOH-UHFFFAOYSA-N 1 2 247.294 2.428 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1cc2ccccc2o1 ZINC000175178114 170214419 /nfs/dbraw/zinc/21/44/19/170214419.db2.gz MDFNSRZDTCTHOH-UHFFFAOYSA-N 1 2 247.294 2.428 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1cccc(Cl)c1 ZINC000042223911 170214546 /nfs/dbraw/zinc/21/45/46/170214546.db2.gz XFPCNMNWGZWLIS-UHFFFAOYSA-N 1 2 241.718 2.335 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1cccc(Cl)c1 ZINC000042223911 170214547 /nfs/dbraw/zinc/21/45/47/170214547.db2.gz XFPCNMNWGZWLIS-UHFFFAOYSA-N 1 2 241.718 2.335 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1ccsc1C ZINC000294832380 170215055 /nfs/dbraw/zinc/21/50/55/170215055.db2.gz HGAFLIMQTPMEQX-UHFFFAOYSA-N 1 2 227.329 2.051 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1ccsc1C ZINC000294832380 170215056 /nfs/dbraw/zinc/21/50/56/170215056.db2.gz HGAFLIMQTPMEQX-UHFFFAOYSA-N 1 2 227.329 2.051 20 0 BEADLO CCOC(=O)C[N@H+](C)[C@@H](C)c1ccccc1 ZINC000050275274 170216044 /nfs/dbraw/zinc/21/60/44/170216044.db2.gz SSYJACMKLYDXNN-NSHDSACASA-N 1 2 221.300 2.243 20 0 BEADLO CCOC(=O)C[N@@H+](C)[C@@H](C)c1ccccc1 ZINC000050275274 170216045 /nfs/dbraw/zinc/21/60/45/170216045.db2.gz SSYJACMKLYDXNN-NSHDSACASA-N 1 2 221.300 2.243 20 0 BEADLO CCOC(=O)C[N@H+](CC)Cc1cccs1 ZINC000042225532 170217210 /nfs/dbraw/zinc/21/72/10/170217210.db2.gz SSTVRPUVMHTYLW-UHFFFAOYSA-N 1 2 227.329 2.133 20 0 BEADLO CCOC(=O)C[N@@H+](CC)Cc1cccs1 ZINC000042225532 170217211 /nfs/dbraw/zinc/21/72/11/170217211.db2.gz SSTVRPUVMHTYLW-UHFFFAOYSA-N 1 2 227.329 2.133 20 0 BEADLO CCOC(=O)C[N@H+](CCc1ccccc1)C1CC1 ZINC000049573424 170217622 /nfs/dbraw/zinc/21/76/22/170217622.db2.gz UNABOECZUOWJEM-UHFFFAOYSA-N 1 2 247.338 2.257 20 0 BEADLO CCOC(=O)C[N@@H+](CCc1ccccc1)C1CC1 ZINC000049573424 170217623 /nfs/dbraw/zinc/21/76/23/170217623.db2.gz UNABOECZUOWJEM-UHFFFAOYSA-N 1 2 247.338 2.257 20 0 BEADLO CCOC(=O)C[NH2+][C@@H](C)[C@@H](C)c1ccccc1 ZINC000181524323 170226058 /nfs/dbraw/zinc/22/60/58/170226058.db2.gz CJCKNWFPYLUOGW-NEPJUHHUSA-N 1 2 235.327 2.331 20 0 BEADLO CCOC(=O)C[NH2+][C@H](Cc1ccccc1)C1CC1 ZINC000181548605 170227166 /nfs/dbraw/zinc/22/71/66/170227166.db2.gz TTZHRXFGEVJAMJ-CQSZACIVSA-N 1 2 247.338 2.160 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[NH2+][C@H]1CCSC1 ZINC000336776662 170249934 /nfs/dbraw/zinc/24/99/34/170249934.db2.gz GGGQDQHFYFLDMR-WDEREUQCSA-N 1 2 245.388 2.059 20 0 BEADLO CCOC(=O)[C@H](CC)[N@H+](C)Cc1ccco1 ZINC000077901426 170271252 /nfs/dbraw/zinc/27/12/52/170271252.db2.gz YMRYLTIKCQUBMR-NSHDSACASA-N 1 2 225.288 2.053 20 0 BEADLO CCOC(=O)[C@H](CC)[N@@H+](C)Cc1ccco1 ZINC000077901426 170271254 /nfs/dbraw/zinc/27/12/54/170271254.db2.gz YMRYLTIKCQUBMR-NSHDSACASA-N 1 2 225.288 2.053 20 0 BEADLO CCOC(=O)[C@H](CC)[N@H+](C)Cc1ccoc1C ZINC000084120611 170271946 /nfs/dbraw/zinc/27/19/46/170271946.db2.gz YOSXZNKUODZQLH-LBPRGKRZSA-N 1 2 239.315 2.362 20 0 BEADLO CCOC(=O)[C@H](CC)[N@@H+](C)Cc1ccoc1C ZINC000084120611 170271947 /nfs/dbraw/zinc/27/19/47/170271947.db2.gz YOSXZNKUODZQLH-LBPRGKRZSA-N 1 2 239.315 2.362 20 0 BEADLO CCOC(=O)[C@H](Cc1ccccc1)[NH2+]CC(C)C ZINC000037966241 170274191 /nfs/dbraw/zinc/27/41/91/170274191.db2.gz BISCJSKHFILGST-AWEZNQCLSA-N 1 2 249.354 2.406 20 0 BEADLO CCOC1CC(Sc2nc(N)cc(C)[nH+]2)C1 ZINC000278540094 170331415 /nfs/dbraw/zinc/33/14/15/170331415.db2.gz JRNSTRKVKQNDRS-UHFFFAOYSA-N 1 2 239.344 2.027 20 0 BEADLO CCOCCC(=O)Nc1cc[nH+]cc1CC ZINC000265076286 170363866 /nfs/dbraw/zinc/36/38/66/170363866.db2.gz VUSSUCXNPNMCGE-UHFFFAOYSA-N 1 2 222.288 2.009 20 0 BEADLO CCOCCCNc1cc[nH+]c2ccncc12 ZINC000267911754 170383766 /nfs/dbraw/zinc/38/37/66/170383766.db2.gz APYUUPVARCFSBD-UHFFFAOYSA-N 1 2 231.299 2.468 20 0 BEADLO CCOCCCNc1cc[nH+]c(C(C)C)n1 ZINC000110111758 170384132 /nfs/dbraw/zinc/38/41/32/170384132.db2.gz DBPYNLDIHOYUJE-UHFFFAOYSA-N 1 2 223.320 2.439 20 0 BEADLO CCOCCN(C)c1nc(C)[nH+]c2c1CCCC2 ZINC000272953826 170392124 /nfs/dbraw/zinc/39/21/24/170392124.db2.gz YZSWHINVHPDZBB-UHFFFAOYSA-N 1 2 249.358 2.137 20 0 BEADLO CCOCC[N@H+](CC)Cc1csc(C)n1 ZINC000076728697 170396605 /nfs/dbraw/zinc/39/66/05/170396605.db2.gz PQJZCMHIBPAZBY-UHFFFAOYSA-N 1 2 228.361 2.310 20 0 BEADLO CCOCC[N@@H+](CC)Cc1csc(C)n1 ZINC000076728697 170396606 /nfs/dbraw/zinc/39/66/06/170396606.db2.gz PQJZCMHIBPAZBY-UHFFFAOYSA-N 1 2 228.361 2.310 20 0 BEADLO CCOCC[N@H+](CC)Cc1cscn1 ZINC000171670568 170396798 /nfs/dbraw/zinc/39/67/98/170396798.db2.gz GTEHPVWERUKWAW-UHFFFAOYSA-N 1 2 214.334 2.002 20 0 BEADLO CCOCC[N@@H+](CC)Cc1cscn1 ZINC000171670568 170396799 /nfs/dbraw/zinc/39/67/99/170396799.db2.gz GTEHPVWERUKWAW-UHFFFAOYSA-N 1 2 214.334 2.002 20 0 BEADLO C[C@H]([NH2+]Cc1cc(C2CC2)no1)c1ccn(C)n1 ZINC000660778628 411627526 /nfs/dbraw/zinc/62/75/26/411627526.db2.gz FZLBZQDTFKYYIU-VIFPVBQESA-N 1 2 246.314 2.136 20 0 BEADLO CC[C@H](O)C[NH2+]CC(F)(F)c1ccc(F)cc1 ZINC000663367251 411638800 /nfs/dbraw/zinc/63/88/00/411638800.db2.gz OLRMTYZQJVJNSZ-NSHDSACASA-N 1 2 247.260 2.278 20 0 BEADLO Cc1ccccc1C(F)(F)C[NH2+]C[C@H](C)O ZINC000663367235 411638848 /nfs/dbraw/zinc/63/88/48/411638848.db2.gz OHAOQWSKOHLTBL-JTQLQIEISA-N 1 2 229.270 2.057 20 0 BEADLO Cc1ccc2c(c1)CC[N@@H+](Cc1cn(C)cn1)C2 ZINC000660396878 411579502 /nfs/dbraw/zinc/57/95/02/411579502.db2.gz PJRBWQXLVLCIQL-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO Cc1ccc2c(c1)CC[N@H+](Cc1cn(C)cn1)C2 ZINC000660396878 411579504 /nfs/dbraw/zinc/57/95/04/411579504.db2.gz PJRBWQXLVLCIQL-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1cn(C)cn1 ZINC000660406829 411580398 /nfs/dbraw/zinc/58/03/98/411580398.db2.gz ZBPJWAPXOTVTKD-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1cc(F)ccc1C[N@H+](C)Cc1cn(C)cn1 ZINC000660406829 411580400 /nfs/dbraw/zinc/58/04/00/411580400.db2.gz ZBPJWAPXOTVTKD-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1nocc1C[N@@H+]1CCC[C@H]1c1cc[nH]n1 ZINC000660428500 411583528 /nfs/dbraw/zinc/58/35/28/411583528.db2.gz DDHQGDUTRWRPII-LBPRGKRZSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1nocc1C[N@H+]1CCC[C@H]1c1cc[nH]n1 ZINC000660428500 411583529 /nfs/dbraw/zinc/58/35/29/411583529.db2.gz DDHQGDUTRWRPII-LBPRGKRZSA-N 1 2 232.287 2.043 20 0 BEADLO CCc1nnc([C@@H](C)[N@@H+]2CCC(C)=C(C)C2)[nH]1 ZINC000660454642 411587575 /nfs/dbraw/zinc/58/75/75/411587575.db2.gz AEFJWSIESIWBSS-LLVKDONJSA-N 1 2 234.347 2.470 20 0 BEADLO CCc1nnc([C@@H](C)[N@H+]2CCC(C)=C(C)C2)[nH]1 ZINC000660454642 411587576 /nfs/dbraw/zinc/58/75/76/411587576.db2.gz AEFJWSIESIWBSS-LLVKDONJSA-N 1 2 234.347 2.470 20 0 BEADLO CCOc1ccc(NCc2ncc[nH]2)[nH+]c1C ZINC000657791887 411598006 /nfs/dbraw/zinc/59/80/06/411598006.db2.gz AFEIWHBJZXRDFU-UHFFFAOYSA-N 1 2 232.287 2.124 20 0 BEADLO CC(C)(C)C(F)(F)CNCc1[nH]cc[nH+]1 ZINC000657792641 411598700 /nfs/dbraw/zinc/59/87/00/411598700.db2.gz DXABIULQQRQPMC-UHFFFAOYSA-N 1 2 217.263 2.181 20 0 BEADLO COc1cc(C[N@H+](C)Cc2ccccn2)sn1 ZINC000660680661 411617246 /nfs/dbraw/zinc/61/72/46/411617246.db2.gz VOCWXBHHTHXAFY-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2ccccn2)sn1 ZINC000660680661 411617247 /nfs/dbraw/zinc/61/72/47/411617247.db2.gz VOCWXBHHTHXAFY-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO C[C@H](O)C[N@H+](CCC1CCC1)CC(F)F ZINC000660736436 411619999 /nfs/dbraw/zinc/61/99/99/411619999.db2.gz HGGZKBCDGQPQOW-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO C[C@H](O)C[N@@H+](CCC1CCC1)CC(F)F ZINC000660736436 411620000 /nfs/dbraw/zinc/62/00/00/411620000.db2.gz HGGZKBCDGQPQOW-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO C[N@H+](CCOCC1CCCC1)Cc1cnc[nH]1 ZINC000661093205 411705186 /nfs/dbraw/zinc/70/51/86/411705186.db2.gz NTXKSIXNUMOVCD-UHFFFAOYSA-N 1 2 237.347 2.048 20 0 BEADLO C[N@@H+](CCOCC1CCCC1)Cc1cnc[nH]1 ZINC000661093205 411705191 /nfs/dbraw/zinc/70/51/91/411705191.db2.gz NTXKSIXNUMOVCD-UHFFFAOYSA-N 1 2 237.347 2.048 20 0 BEADLO C[N@H+](CCOCC1CCCC1)Cc1c[nH]cn1 ZINC000661093205 411705194 /nfs/dbraw/zinc/70/51/94/411705194.db2.gz NTXKSIXNUMOVCD-UHFFFAOYSA-N 1 2 237.347 2.048 20 0 BEADLO C[N@@H+](CCOCC1CCCC1)Cc1c[nH]cn1 ZINC000661093205 411705198 /nfs/dbraw/zinc/70/51/98/411705198.db2.gz NTXKSIXNUMOVCD-UHFFFAOYSA-N 1 2 237.347 2.048 20 0 BEADLO Cc1ccc(NCCc2ccc(C)[nH+]c2)nn1 ZINC000663587492 411706629 /nfs/dbraw/zinc/70/66/29/411706629.db2.gz RCECQOJMJMNJDY-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO Nc1cccc2c1cc[nH+]c2N1CCSCC1 ZINC000663398090 411647882 /nfs/dbraw/zinc/64/78/82/411647882.db2.gz XQNPQVVDCQJGFE-UHFFFAOYSA-N 1 2 245.351 2.370 20 0 BEADLO Cc1cccc([C@@H](C)[N@H+](C)Cc2n[nH]c(=O)o2)c1 ZINC000660849678 411657590 /nfs/dbraw/zinc/65/75/90/411657590.db2.gz PREFIJTUSMMFKZ-SNVBAGLBSA-N 1 2 247.298 2.277 20 0 BEADLO Cc1cccc([C@@H](C)[N@@H+](C)Cc2n[nH]c(=O)o2)c1 ZINC000660849678 411657593 /nfs/dbraw/zinc/65/75/93/411657593.db2.gz PREFIJTUSMMFKZ-SNVBAGLBSA-N 1 2 247.298 2.277 20 0 BEADLO Cc1nc([C@H](C)[NH+]2CCC3(CC3)CC2)n[nH]1 ZINC000663437450 411657864 /nfs/dbraw/zinc/65/78/64/411657864.db2.gz AFOREZGSYRTEDK-VIFPVBQESA-N 1 2 220.320 2.050 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nc(C)oc2C)[C@@H](C)CO1 ZINC000660912330 411669310 /nfs/dbraw/zinc/66/93/10/411669310.db2.gz JCPWJOLYWYLEIH-JOYOIKCWSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nc(C)oc2C)[C@@H](C)CO1 ZINC000660912330 411669314 /nfs/dbraw/zinc/66/93/14/411669314.db2.gz JCPWJOLYWYLEIH-JOYOIKCWSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@H]1C[N@H+](Cc2nc(C)oc2C)[C@@H](C)CO1 ZINC000660912328 411669346 /nfs/dbraw/zinc/66/93/46/411669346.db2.gz JCPWJOLYWYLEIH-CABZTGNLSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2nc(C)oc2C)[C@@H](C)CO1 ZINC000660912328 411669348 /nfs/dbraw/zinc/66/93/48/411669348.db2.gz JCPWJOLYWYLEIH-CABZTGNLSA-N 1 2 238.331 2.291 20 0 BEADLO CCCc1noc(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)n1 ZINC000660927432 411677367 /nfs/dbraw/zinc/67/73/67/411677367.db2.gz ZYHPFKFHJXQVAK-QWRGUYRKSA-N 1 2 235.331 2.397 20 0 BEADLO CCCc1noc(C[N@H+]2C[C@@H]3CCCC[C@@H]32)n1 ZINC000660927432 411677371 /nfs/dbraw/zinc/67/73/71/411677371.db2.gz ZYHPFKFHJXQVAK-QWRGUYRKSA-N 1 2 235.331 2.397 20 0 BEADLO Cn1cc(Cl)c(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)n1 ZINC000660933705 411683333 /nfs/dbraw/zinc/68/33/33/411683333.db2.gz FJFPOIXTMDIHDG-CABZTGNLSA-N 1 2 239.750 2.448 20 0 BEADLO Cn1cc(Cl)c(C[N@H+]2C[C@@H]3CCCC[C@@H]32)n1 ZINC000660933705 411683338 /nfs/dbraw/zinc/68/33/38/411683338.db2.gz FJFPOIXTMDIHDG-CABZTGNLSA-N 1 2 239.750 2.448 20 0 BEADLO CC(C)Cn1ncnc1C[N@@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660933661 411683931 /nfs/dbraw/zinc/68/39/31/411683931.db2.gz WCACESGBKGQWDY-STQMWFEESA-N 1 2 248.374 2.309 20 0 BEADLO CC(C)Cn1ncnc1C[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660933661 411683934 /nfs/dbraw/zinc/68/39/34/411683934.db2.gz WCACESGBKGQWDY-STQMWFEESA-N 1 2 248.374 2.309 20 0 BEADLO CC(=O)c1cccc(CN(C)Cc2c[nH+]c[nH]2)c1 ZINC000661089703 411702841 /nfs/dbraw/zinc/70/28/41/411702841.db2.gz FSVDHQKGFCCRFN-UHFFFAOYSA-N 1 2 243.310 2.244 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](Cc1ncccn1)CC2 ZINC000661373470 411758238 /nfs/dbraw/zinc/75/82/38/411758238.db2.gz USHGEPLBIUHEJG-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](Cc1ncccn1)CC2 ZINC000661373470 411758242 /nfs/dbraw/zinc/75/82/42/411758242.db2.gz USHGEPLBIUHEJG-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO CO[C@H](C)CN(C)c1[nH+]ccc2c(N)cccc21 ZINC000663909688 411771594 /nfs/dbraw/zinc/77/15/94/411771594.db2.gz RDZYIGAVJOMSPA-SNVBAGLBSA-N 1 2 245.326 2.288 20 0 BEADLO CCc1cc(N2CC[C@@H]2C(F)F)nc(C)[nH+]1 ZINC000663944605 411784417 /nfs/dbraw/zinc/78/44/17/411784417.db2.gz DRLWCNACOLVOOK-SECBINFHSA-N 1 2 227.258 2.191 20 0 BEADLO Cc1nnc(C[NH+]2CCC(c3ccco3)CC2)[nH]1 ZINC000661161545 411723555 /nfs/dbraw/zinc/72/35/55/411723555.db2.gz UDLOLODLNLSHNW-UHFFFAOYSA-N 1 2 246.314 2.086 20 0 BEADLO Cc1cnc(N[C@H]2C[C@@H](C)n3cc[nH+]c32)nc1 ZINC000663973018 411796451 /nfs/dbraw/zinc/79/64/51/411796451.db2.gz DGUPEMNKGZZGQB-ZJUUUORDSA-N 1 2 229.287 2.099 20 0 BEADLO Cc1cccc(C[NH+]2C[C@@H](C)C(=O)[C@H](C)C2)n1 ZINC000661539394 411798527 /nfs/dbraw/zinc/79/85/27/411798527.db2.gz RGUKIJZKBHUMEQ-GHMZBOCLSA-N 1 2 232.327 2.047 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)Nc1ncc(C)cn1 ZINC000663975415 411798679 /nfs/dbraw/zinc/79/86/79/411798679.db2.gz QFZXBJOFUATENT-JTQLQIEISA-N 1 2 231.303 2.175 20 0 BEADLO C[C@@H]1C[NH+](Cc2ccc(F)cc2)C[C@@H](C)C1=O ZINC000661544786 411799612 /nfs/dbraw/zinc/79/96/12/411799612.db2.gz JSWBDGXWEIFYDG-GHMZBOCLSA-N 1 2 235.302 2.483 20 0 BEADLO CC[C@@H](C)CC(=O)NCCNc1cccc[nH+]1 ZINC000276734160 170686940 /nfs/dbraw/zinc/68/69/40/170686940.db2.gz BXUXPYZADNTIGJ-LLVKDONJSA-N 1 2 235.331 2.046 20 0 BEADLO Cc1cc[nH+]cc1Cn1cnc(C(C)C)n1 ZINC000664108310 411853931 /nfs/dbraw/zinc/85/39/31/411853931.db2.gz ZECSWGQEUSKMEN-UHFFFAOYSA-N 1 2 216.288 2.153 20 0 BEADLO COc1ccc2c(c1)CC[N@@H+](Cc1ccno1)C2 ZINC000661739091 411860520 /nfs/dbraw/zinc/86/05/20/411860520.db2.gz YESBFBJHTBLYHG-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1ccc2c(c1)CC[N@H+](Cc1ccno1)C2 ZINC000661739091 411860522 /nfs/dbraw/zinc/86/05/22/411860522.db2.gz YESBFBJHTBLYHG-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO Cc1cc[nH+]c(NC/C=C\CO)c1Cl ZINC000664235024 411891949 /nfs/dbraw/zinc/89/19/49/411891949.db2.gz FRQQKGFPVNSNGA-IHWYPQMZSA-N 1 2 212.680 2.004 20 0 BEADLO CC[C@@H](CC(=O)N1CCn2c[nH+]cc2C1)C(C)C ZINC000290978752 170812664 /nfs/dbraw/zinc/81/26/64/170812664.db2.gz VEFPIDMZZURZQV-LBPRGKRZSA-N 1 2 249.358 2.298 20 0 BEADLO C[C@@H]1CN(c2[nH]c3ccccc3[nH+]2)C[C@@H](C)C1O ZINC000664350217 411928299 /nfs/dbraw/zinc/92/82/99/411928299.db2.gz HGBUHCFRWOLBCA-NXEZZACHSA-N 1 2 245.326 2.016 20 0 BEADLO c1cc(N2CC[C@@H]3C[C@@H]3C2)nc(C2CC2)[nH+]1 ZINC000664521990 411975310 /nfs/dbraw/zinc/97/53/10/411975310.db2.gz CWNYRRGQGPOMAP-GHMZBOCLSA-N 1 2 215.300 2.200 20 0 BEADLO c1ccc2[nH+]c(N3CC[C@@H]4COC[C@@H]4C3)[nH]c2c1 ZINC000664557147 411986747 /nfs/dbraw/zinc/98/67/47/411986747.db2.gz PSSFLDSHCHSRIU-MNOVXSKESA-N 1 2 243.310 2.036 20 0 BEADLO Cc1nc(NCCCc2ccco2)cc[nH+]1 ZINC000664584947 411991929 /nfs/dbraw/zinc/99/19/29/411991929.db2.gz OIEUHKFHFZJXRD-UHFFFAOYSA-N 1 2 217.272 2.423 20 0 BEADLO C[C@H](Nc1ccnc(C2CC2)n1)c1[nH+]ccn1C ZINC000664609475 411997729 /nfs/dbraw/zinc/99/77/29/411997729.db2.gz ZWXANNBTNKBRNM-VIFPVBQESA-N 1 2 243.314 2.261 20 0 BEADLO Cc1cc(C)nc(N[C@@H](C)c2[nH+]ccn2C)n1 ZINC000664608990 411998207 /nfs/dbraw/zinc/99/82/07/411998207.db2.gz RXGJKWNYIXZFNQ-JTQLQIEISA-N 1 2 231.303 2.000 20 0 BEADLO C[C@H](Nc1nc(C2CC2)ns1)c1[nH+]ccn1C ZINC000664608934 411998441 /nfs/dbraw/zinc/99/84/41/411998441.db2.gz QOOSNURSGZHDSV-ZETCQYMHSA-N 1 2 249.343 2.322 20 0 BEADLO Cc1cc(N(C)C[C@@H]2CC2(C)C)nc[nH+]1 ZINC000664670234 412000620 /nfs/dbraw/zinc/00/06/20/412000620.db2.gz MXFSYTAGDFHPOE-JTQLQIEISA-N 1 2 205.305 2.267 20 0 BEADLO c1nn[nH]c1CC[N@@H+]1CCCC[C@H]1CC1CCC1 ZINC000662156918 412010913 /nfs/dbraw/zinc/01/09/13/412010913.db2.gz NCUHVRXCBCYLIH-AWEZNQCLSA-N 1 2 248.374 2.392 20 0 BEADLO c1nn[nH]c1CC[N@H+]1CCCC[C@H]1CC1CCC1 ZINC000662156918 412010916 /nfs/dbraw/zinc/01/09/16/412010916.db2.gz NCUHVRXCBCYLIH-AWEZNQCLSA-N 1 2 248.374 2.392 20 0 BEADLO Cc1cc(N2CCC[C@H](CCF)C2)nc[nH+]1 ZINC000664414871 411947941 /nfs/dbraw/zinc/94/79/41/411947941.db2.gz WJNYXGDFCOWVEL-LLVKDONJSA-N 1 2 223.295 2.361 20 0 BEADLO CC(C)=CC[N@@H+]1CCn2c(nnc2C(C)(C)C)C1 ZINC000662236151 412035766 /nfs/dbraw/zinc/03/57/66/412035766.db2.gz DJLQKVWATRVUGW-UHFFFAOYSA-N 1 2 248.374 2.357 20 0 BEADLO CC(C)=CC[N@H+]1CCn2c(nnc2C(C)(C)C)C1 ZINC000662236151 412035770 /nfs/dbraw/zinc/03/57/70/412035770.db2.gz DJLQKVWATRVUGW-UHFFFAOYSA-N 1 2 248.374 2.357 20 0 BEADLO CCCc1nc(Cc2c[nH+]ccc2C)no1 ZINC000664978639 412055950 /nfs/dbraw/zinc/05/59/50/412055950.db2.gz IHRUJHNENNCHEC-UHFFFAOYSA-N 1 2 217.272 2.316 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1c1nc(C)[nH+]c(N(C)C)n1 ZINC000357297048 171039202 /nfs/dbraw/zinc/03/92/02/171039202.db2.gz YXEXSHQOSFVOSN-MWLCHTKSSA-N 1 2 249.362 2.013 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1c1nc(N(C)C)nc(C)[nH+]1 ZINC000357297048 171039204 /nfs/dbraw/zinc/03/92/04/171039204.db2.gz YXEXSHQOSFVOSN-MWLCHTKSSA-N 1 2 249.362 2.013 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1c1[nH+]cnc2c1cnn2C ZINC000337784970 171056880 /nfs/dbraw/zinc/05/68/80/171056880.db2.gz AQQLPRAAYDKPNR-VHSXEESVSA-N 1 2 245.330 2.131 20 0 BEADLO CCc1cnc(C[N@H+](C)CC2=CCSC2)o1 ZINC000662268488 412061182 /nfs/dbraw/zinc/06/11/82/412061182.db2.gz BMGRRBVOIOPKDT-UHFFFAOYSA-N 1 2 238.356 2.342 20 0 BEADLO CCc1cnc(C[N@@H+](C)CC2=CCSC2)o1 ZINC000662268488 412061189 /nfs/dbraw/zinc/06/11/89/412061189.db2.gz BMGRRBVOIOPKDT-UHFFFAOYSA-N 1 2 238.356 2.342 20 0 BEADLO O[C@@H]1C[C@H](c2ccccc2)[N@H+](CC(F)F)C1 ZINC000665029832 412061232 /nfs/dbraw/zinc/06/12/32/412061232.db2.gz ZTUNNUUEXOKJQG-GHMZBOCLSA-N 1 2 227.254 2.059 20 0 BEADLO O[C@@H]1C[C@H](c2ccccc2)[N@@H+](CC(F)F)C1 ZINC000665029832 412061235 /nfs/dbraw/zinc/06/12/35/412061235.db2.gz ZTUNNUUEXOKJQG-GHMZBOCLSA-N 1 2 227.254 2.059 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C)on2)CCS1 ZINC000076073599 171088606 /nfs/dbraw/zinc/08/86/06/171088606.db2.gz AHGSHZYBJJITRM-LLVKDONJSA-N 1 2 226.345 2.310 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C)on2)CCS1 ZINC000076073599 171088608 /nfs/dbraw/zinc/08/86/08/171088608.db2.gz AHGSHZYBJJITRM-LLVKDONJSA-N 1 2 226.345 2.310 20 0 BEADLO Cc1noc([C@H](C)[N@H+](C)CC2=CCSC2)n1 ZINC000662271639 412063272 /nfs/dbraw/zinc/06/32/72/412063272.db2.gz WMGRYQUNALKBAV-QMMMGPOBSA-N 1 2 239.344 2.044 20 0 BEADLO Cc1noc([C@H](C)[N@@H+](C)CC2=CCSC2)n1 ZINC000662271639 412063279 /nfs/dbraw/zinc/06/32/79/412063279.db2.gz WMGRYQUNALKBAV-QMMMGPOBSA-N 1 2 239.344 2.044 20 0 BEADLO CCO[C@H](CC)c1noc(C[N@H+](C)C(C)C)n1 ZINC000665034625 412063392 /nfs/dbraw/zinc/06/33/92/412063392.db2.gz DQPMUVWHXCOKID-SNVBAGLBSA-N 1 2 241.335 2.397 20 0 BEADLO CCO[C@H](CC)c1noc(C[N@@H+](C)C(C)C)n1 ZINC000665034625 412063396 /nfs/dbraw/zinc/06/33/96/412063396.db2.gz DQPMUVWHXCOKID-SNVBAGLBSA-N 1 2 241.335 2.397 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@@H](C)c2cnccn2)C[C@H](C)O1 ZINC000184546050 171094746 /nfs/dbraw/zinc/09/47/46/171094746.db2.gz BWWLMARARKZAJW-SDDRHHMPSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@@H]1C[N@H+]([C@@H](C)c2cnccn2)C[C@H](C)O1 ZINC000184546050 171094748 /nfs/dbraw/zinc/09/47/48/171094748.db2.gz BWWLMARARKZAJW-SDDRHHMPSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@@](C)([NH2+]Cc1cc[nH]n1)c1nccs1 ZINC000152656426 171176058 /nfs/dbraw/zinc/17/60/58/171176058.db2.gz MUINFWUISOWKPS-LLVKDONJSA-N 1 2 236.344 2.281 20 0 BEADLO CC[C@@](C)(NCc1[nH]cc[nH+]1)c1nccs1 ZINC000152643979 171176531 /nfs/dbraw/zinc/17/65/31/171176531.db2.gz FUFIKCFRKQYZRU-LLVKDONJSA-N 1 2 236.344 2.281 20 0 BEADLO CC[C@@](C)([NH2+]Cc1ncc[nH]1)c1nccs1 ZINC000152643979 171176532 /nfs/dbraw/zinc/17/65/32/171176532.db2.gz FUFIKCFRKQYZRU-LLVKDONJSA-N 1 2 236.344 2.281 20 0 BEADLO CC[C@H](C)C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000299573131 171246928 /nfs/dbraw/zinc/24/69/28/171246928.db2.gz UHBDEFNEEYQJLS-JTQLQIEISA-N 1 2 235.331 2.162 20 0 BEADLO CC[C@H](C)C(=O)N1CC(C)(C)[C@@H]1c1[nH+]ccn1C ZINC000295988041 171247386 /nfs/dbraw/zinc/24/73/86/171247386.db2.gz UMKMDNYQAWBIBJ-QWRGUYRKSA-N 1 2 249.358 2.376 20 0 BEADLO CC[C@H](C)CC(=O)NC[C@@H](C)Cn1cc[nH+]c1 ZINC000276563418 171260067 /nfs/dbraw/zinc/26/00/67/171260067.db2.gz AEAFHZIRTZPGBB-NWDGAFQWSA-N 1 2 237.347 2.072 20 0 BEADLO CC[C@H](C)CCC(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000352725480 171263533 /nfs/dbraw/zinc/26/35/33/171263533.db2.gz QATACQFTWYOFRP-JTQLQIEISA-N 1 2 223.320 2.194 20 0 BEADLO CC[C@H](C)CCC(=O)N1CCn2c[nH+]cc2C1 ZINC000378124246 171265708 /nfs/dbraw/zinc/26/57/08/171265708.db2.gz XFFCNAZKHKCWEQ-NSHDSACASA-N 1 2 235.331 2.052 20 0 BEADLO CC[C@H](C)CCC(=O)NCCCn1cc[nH+]c1 ZINC000285253723 171266586 /nfs/dbraw/zinc/26/65/86/171266586.db2.gz UUAIOEBKWQLEKQ-LBPRGKRZSA-N 1 2 237.347 2.216 20 0 BEADLO CC[C@H](C)Cn1c2ccccc2[nH+]c1NCCO ZINC000268718414 171301462 /nfs/dbraw/zinc/30/14/62/171301462.db2.gz NMQRJZCURXYHBK-NSHDSACASA-N 1 2 247.342 2.487 20 0 BEADLO CCc1cn(Cc2nc(C(C)C)ns2)c[nH+]1 ZINC001652205647 1173044386 /nfs/dbraw/zinc/04/43/86/1173044386.db2.gz LBBVMZZQKGTENG-UHFFFAOYSA-N 1 2 236.344 2.469 20 0 BEADLO CC[C@H](C)[NH2+][C@H](C(=O)OC)c1ccccc1 ZINC000037976075 171347657 /nfs/dbraw/zinc/34/76/57/171347657.db2.gz ZWGFTAZHZOLJCS-JQWIXIFHSA-N 1 2 221.300 2.289 20 0 BEADLO CCc1cn(CC(=O)c2ccccc2OC)c[nH+]1 ZINC001652207970 1173044371 /nfs/dbraw/zinc/04/43/71/1173044371.db2.gz LPVJXWXPUANKLC-UHFFFAOYSA-N 1 2 244.294 2.337 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)NCc1[nH+]ccn1CC ZINC000295544891 171360453 /nfs/dbraw/zinc/36/04/53/171360453.db2.gz DAMSRFGHVNUIFK-WDEREUQCSA-N 1 2 237.347 2.201 20 0 BEADLO CC[C@H](C)[C@@H]([NH2+][C@H]1C=CCCC1)C(=O)OC ZINC000336749765 171374733 /nfs/dbraw/zinc/37/47/33/171374733.db2.gz YYLOMFSMLSZTJJ-SDDRHHMPSA-N 1 2 225.332 2.272 20 0 BEADLO CC[C@H](C)[C@H]([NH2+]Cc1cccs1)C(=O)OC ZINC000035036740 171399655 /nfs/dbraw/zinc/39/96/55/171399655.db2.gz CDJAKAAQQBSCCG-ONGXEEELSA-N 1 2 241.356 2.425 20 0 BEADLO CCc1cn(CC(=O)Cc2ccccc2)c[nH+]1 ZINC001652205667 1173044643 /nfs/dbraw/zinc/04/46/43/1173044643.db2.gz LSAKMKDGTVQOND-UHFFFAOYSA-N 1 2 228.295 2.257 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+](C)Cc2ccsc2)[nH]1 ZINC000662344056 412113990 /nfs/dbraw/zinc/11/39/90/412113990.db2.gz DFNLCPORRPMXDI-MRVPVSSYSA-N 1 2 236.344 2.368 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+](C)Cc2ccsc2)[nH]1 ZINC000662344056 412113991 /nfs/dbraw/zinc/11/39/91/412113991.db2.gz DFNLCPORRPMXDI-MRVPVSSYSA-N 1 2 236.344 2.368 20 0 BEADLO Cc1nc([C@H](C)[N@H+](C)C[C@@H]2CC2(C)C)no1 ZINC000662346007 412115665 /nfs/dbraw/zinc/11/56/65/412115665.db2.gz PUZLUYDDSSCBFX-WPRPVWTQSA-N 1 2 223.320 2.417 20 0 BEADLO Cc1nc([C@H](C)[N@@H+](C)C[C@@H]2CC2(C)C)no1 ZINC000662346007 412115669 /nfs/dbraw/zinc/11/56/69/412115669.db2.gz PUZLUYDDSSCBFX-WPRPVWTQSA-N 1 2 223.320 2.417 20 0 BEADLO CCc1nc(C[N@H+](C)C[C@H]2CC2(C)C)no1 ZINC000662349022 412120334 /nfs/dbraw/zinc/12/03/34/412120334.db2.gz ZMOOXAYNJJKPQW-SECBINFHSA-N 1 2 223.320 2.110 20 0 BEADLO CCc1nc(C[N@@H+](C)C[C@H]2CC2(C)C)no1 ZINC000662349022 412120339 /nfs/dbraw/zinc/12/03/39/412120339.db2.gz ZMOOXAYNJJKPQW-SECBINFHSA-N 1 2 223.320 2.110 20 0 BEADLO CC12CC(C1)C[N@@H+]2Cc1nccn1C(F)F ZINC000662381035 412133302 /nfs/dbraw/zinc/13/33/02/412133302.db2.gz MVBPSBDRYURDBV-UHFFFAOYSA-N 1 2 227.258 2.263 20 0 BEADLO CC12CC(C1)C[N@H+]2Cc1nccn1C(F)F ZINC000662381035 412133304 /nfs/dbraw/zinc/13/33/04/412133304.db2.gz MVBPSBDRYURDBV-UHFFFAOYSA-N 1 2 227.258 2.263 20 0 BEADLO COCc1cc(-c2c[nH+]cn2C)cs1 ZINC000665220151 412159277 /nfs/dbraw/zinc/15/92/77/412159277.db2.gz SXUJNHRZPKOYCB-UHFFFAOYSA-N 1 2 208.286 2.295 20 0 BEADLO CC[C@H]([NH2+][C@H](C)C(F)(F)F)[C@H]1CCOC1 ZINC000336773647 171543682 /nfs/dbraw/zinc/54/36/82/171543682.db2.gz YXRRZJRIKGWTKO-VGMNWLOBSA-N 1 2 225.254 2.342 20 0 BEADLO CC[C@H]1C[N@@H+]([C@@H](C)c2cnccn2)C[C@H](C)O1 ZINC000184546065 171665583 /nfs/dbraw/zinc/66/55/83/171665583.db2.gz BWWLMARARKZAJW-SRVKXCTJSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@H]1C[N@H+]([C@@H](C)c2cnccn2)C[C@H](C)O1 ZINC000184546065 171665585 /nfs/dbraw/zinc/66/55/85/171665585.db2.gz BWWLMARARKZAJW-SRVKXCTJSA-N 1 2 235.331 2.037 20 0 BEADLO c1cn(Cc2nc([C@H]3CCCOC3)cs2)c[nH+]1 ZINC000663219868 412394232 /nfs/dbraw/zinc/39/42/32/412394232.db2.gz LYBRVHHRMJWSPF-JTQLQIEISA-N 1 2 249.339 2.282 20 0 BEADLO CCc1ccc([C@@H](C)[NH2+]Cc2ccn(C)n2)o1 ZINC000358248630 171831609 /nfs/dbraw/zinc/83/16/09/171831609.db2.gz MGHVVMOYFIHFGI-SNVBAGLBSA-N 1 2 233.315 2.426 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1O[C@@H](C)C[C@H]1C ZINC000281832361 171926123 /nfs/dbraw/zinc/92/61/23/171926123.db2.gz IIUZZNZLOUFYDT-GBIKHYSHSA-N 1 2 248.326 2.396 20 0 BEADLO CCc1[nH+]c2ccccc2n1Cc1noc(C)n1 ZINC000131372215 172013512 /nfs/dbraw/zinc/01/35/12/172013512.db2.gz OSNBOJCWEHGTTK-UHFFFAOYSA-N 1 2 242.282 2.338 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@@H](C)OC[C@H]2C)s1 ZINC000271068181 172017533 /nfs/dbraw/zinc/01/75/33/172017533.db2.gz KRGNJZNZHBRNAR-NXEZZACHSA-N 1 2 240.372 2.315 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@@H](C)OC[C@H]2C)s1 ZINC000271068181 172017535 /nfs/dbraw/zinc/01/75/35/172017535.db2.gz KRGNJZNZHBRNAR-NXEZZACHSA-N 1 2 240.372 2.315 20 0 BEADLO CCc1nn(C)cc1N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000294242686 172044142 /nfs/dbraw/zinc/04/41/42/172044142.db2.gz WFENUMNLCZGKLG-MWLCHTKSSA-N 1 2 245.330 2.297 20 0 BEADLO CCc1nnc(C[N@@H+]2CCc3ccsc3C2)o1 ZINC000132641570 172049810 /nfs/dbraw/zinc/04/98/10/172049810.db2.gz LZTJYAQEJUCUGX-UHFFFAOYSA-N 1 2 249.339 2.252 20 0 BEADLO CCc1nnc(C[N@H+]2CCc3ccsc3C2)o1 ZINC000132641570 172049813 /nfs/dbraw/zinc/04/98/13/172049813.db2.gz LZTJYAQEJUCUGX-UHFFFAOYSA-N 1 2 249.339 2.252 20 0 BEADLO CCc1nnc(C[NH2+]Cc2cccnc2C)s1 ZINC000353158590 172052571 /nfs/dbraw/zinc/05/25/71/172052571.db2.gz WUUWOOGQTGTRAH-UHFFFAOYSA-N 1 2 248.355 2.094 20 0 BEADLO CCc1nnc(Cn2c(C)[nH+]c3ccccc32)o1 ZINC000045284803 172055507 /nfs/dbraw/zinc/05/55/07/172055507.db2.gz NDAICEVIYJKPOP-UHFFFAOYSA-N 1 2 242.282 2.338 20 0 BEADLO CCc1noc(C)c1C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000161960900 172076889 /nfs/dbraw/zinc/07/68/89/172076889.db2.gz WSGPVDXCHGYNKX-AOOOYVTPSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1noc(C)c1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000161960900 172076890 /nfs/dbraw/zinc/07/68/90/172076890.db2.gz WSGPVDXCHGYNKX-AOOOYVTPSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1noc(C)c1C[NH2+][C@H](C)c1nccn1C ZINC000340442070 172080826 /nfs/dbraw/zinc/08/08/26/172080826.db2.gz MPLSQOKVOONHTP-SECBINFHSA-N 1 2 248.330 2.130 20 0 BEADLO CCc1nocc1CN(C)c1cccc[nH+]1 ZINC000292920718 172095410 /nfs/dbraw/zinc/09/54/10/172095410.db2.gz YLXSQQXHKRUTPL-UHFFFAOYSA-N 1 2 217.272 2.268 20 0 BEADLO CCn1cc(C[N@H+](C)Cc2ccc(C)o2)cn1 ZINC000179618242 172162633 /nfs/dbraw/zinc/16/26/33/172162633.db2.gz UDDZUEAVDOHZQQ-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CCn1cc(C[N@@H+](C)Cc2ccc(C)o2)cn1 ZINC000179618242 172162635 /nfs/dbraw/zinc/16/26/35/172162635.db2.gz UDDZUEAVDOHZQQ-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CCn1cc(C[NH2+][C@H](C)c2cc(C)on2)cn1 ZINC000282767628 172173543 /nfs/dbraw/zinc/17/35/43/172173543.db2.gz UPLALZCJOYYZQN-SNVBAGLBSA-N 1 2 234.303 2.050 20 0 BEADLO CCn1cc(N[C@H]2C[C@@H](C)n3cc[nH+]c32)cn1 ZINC000294165132 172187915 /nfs/dbraw/zinc/18/79/15/172187915.db2.gz RAEJNFSCJPSBGG-KOLCDFICSA-N 1 2 231.303 2.217 20 0 BEADLO CCn1cc(OCc2cc(OC)cc(C)[nH+]2)cn1 ZINC000228134951 172191104 /nfs/dbraw/zinc/19/11/04/172191104.db2.gz HFFWFSIYTCGXAU-UHFFFAOYSA-N 1 2 247.298 2.194 20 0 BEADLO CCn1cc([C@H](C)Nc2cccc[nH+]2)cn1 ZINC000271951082 172199095 /nfs/dbraw/zinc/19/90/95/172199095.db2.gz ORTKPVZWFGKNDD-JTQLQIEISA-N 1 2 216.288 2.471 20 0 BEADLO CCn1ccc(C[NH2+]Cc2ccc(C)o2)n1 ZINC000020351134 172201943 /nfs/dbraw/zinc/20/19/43/172201943.db2.gz HRWLJGJKIDKDQH-UHFFFAOYSA-N 1 2 219.288 2.094 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)c1sccc1C ZINC000295903839 172221591 /nfs/dbraw/zinc/22/15/91/172221591.db2.gz ZYIONTQTSNEDLG-UHFFFAOYSA-N 1 2 249.339 2.203 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)CCC1CCCC1 ZINC000295891342 172221629 /nfs/dbraw/zinc/22/16/29/172221629.db2.gz ZDVKEDWFZXCVHH-UHFFFAOYSA-N 1 2 249.358 2.490 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C[C@H]1CC[C@@H](C)C1 ZINC000295828825 172221924 /nfs/dbraw/zinc/22/19/24/172221924.db2.gz USSRLCZZDPJAGO-NEPJUHHUSA-N 1 2 249.358 2.346 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)c1cccc(C)c1 ZINC000295579572 172222061 /nfs/dbraw/zinc/22/20/61/172222061.db2.gz GXWOTYRMDJNPSA-UHFFFAOYSA-N 1 2 243.310 2.141 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@H](C)CC(C)C ZINC000295711260 172222118 /nfs/dbraw/zinc/22/21/18/172222118.db2.gz JUWNVEBGTBLKHL-LLVKDONJSA-N 1 2 237.347 2.201 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)c1cscc1C ZINC000295759577 172222896 /nfs/dbraw/zinc/22/28/96/172222896.db2.gz ODDJPOZNYSKAGQ-UHFFFAOYSA-N 1 2 249.339 2.203 20 0 BEADLO CCn1ccnc1C[NH2+][C@@H](C)c1ccccn1 ZINC000051921036 172223546 /nfs/dbraw/zinc/22/35/46/172223546.db2.gz HASQFSUDQZCXHF-NSHDSACASA-N 1 2 230.315 2.149 20 0 BEADLO CCn1cc[nH+]c1CN[C@@H](C)c1cc(C)on1 ZINC000282723309 172225085 /nfs/dbraw/zinc/22/50/85/172225085.db2.gz QOGZUKWCXUJOOJ-JTQLQIEISA-N 1 2 234.303 2.050 20 0 BEADLO CCn1cc[nH+]c1CNc1ccccc1CO ZINC000051923193 172226269 /nfs/dbraw/zinc/22/62/69/172226269.db2.gz PSORNTQZIOUCPB-UHFFFAOYSA-N 1 2 231.299 2.007 20 0 BEADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1ccco1 ZINC000295224069 172227695 /nfs/dbraw/zinc/22/76/95/172227695.db2.gz NALRMIFVAFXBRN-SNVBAGLBSA-N 1 2 219.288 2.347 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)Nc1c(C)nn(C)c1C ZINC000297018789 172229222 /nfs/dbraw/zinc/22/92/22/172229222.db2.gz UFUVOBBLIFNDHA-SNVBAGLBSA-N 1 2 247.346 2.426 20 0 BEADLO CCn1cnnc1C[NH2+]Cc1ccc(C)c(F)c1 ZINC000109068784 172235985 /nfs/dbraw/zinc/23/59/85/172235985.db2.gz FLMGSSNGYBVTKV-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO CCn1cnnc1C[NH2+][C@H](C)c1ccc(C)o1 ZINC000158487505 172236740 /nfs/dbraw/zinc/23/67/40/172236740.db2.gz IRUCUUMJCGSBMX-SNVBAGLBSA-N 1 2 234.303 2.050 20 0 BEADLO CCn1nc(C)c(C[NH2+]Cc2cccc(F)c2)n1 ZINC000294880393 172246872 /nfs/dbraw/zinc/24/68/72/172246872.db2.gz XLONYIAUBDNGFJ-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO CCn1nccc1CC[N@@H+]1CCC=C(F)C1 ZINC000284496751 172259772 /nfs/dbraw/zinc/25/97/72/172259772.db2.gz URSFROBYXRWOKC-UHFFFAOYSA-N 1 2 223.295 2.005 20 0 BEADLO CCn1nccc1CC[N@H+]1CCC=C(F)C1 ZINC000284496751 172259773 /nfs/dbraw/zinc/25/97/73/172259773.db2.gz URSFROBYXRWOKC-UHFFFAOYSA-N 1 2 223.295 2.005 20 0 BEADLO CCn1nccc1C[N@H+](C)[C@@H](C)c1ccccn1 ZINC000183677838 172264223 /nfs/dbraw/zinc/26/42/23/172264223.db2.gz FAOQRTJRFGARRG-LBPRGKRZSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1nccc1C[N@@H+](C)[C@@H](C)c1ccccn1 ZINC000183677838 172264227 /nfs/dbraw/zinc/26/42/27/172264227.db2.gz FAOQRTJRFGARRG-LBPRGKRZSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1nccc1CNc1cc[nH+]cc1F ZINC000192150354 172274237 /nfs/dbraw/zinc/27/42/37/172274237.db2.gz WXQCNIAOCSGODW-UHFFFAOYSA-N 1 2 220.251 2.049 20 0 BEADLO CCn1ncnc1C[NH2+]C1(c2ccccc2)CC1 ZINC000278932595 172281811 /nfs/dbraw/zinc/28/18/11/172281811.db2.gz WMVSRDQHZJHUIA-UHFFFAOYSA-N 1 2 242.326 2.077 20 0 BEADLO CN(C)c1ccc(NCc2cscn2)c[nH+]1 ZINC000040504392 172557068 /nfs/dbraw/zinc/55/70/68/172557068.db2.gz NTBGMJFACHTXFN-UHFFFAOYSA-N 1 2 234.328 2.216 20 0 BEADLO CN(C[C@@H]1CCOC1)c1[nH+]c2ccccc2n1C ZINC000178813627 172818183 /nfs/dbraw/zinc/81/81/83/172818183.db2.gz RCFNSCIDPKHTAP-NSHDSACASA-N 1 2 245.326 2.046 20 0 BEADLO C[N@@H+]1CCC[C@H]1C(=O)Nc1ccsc1Cl ZINC000275900338 173050154 /nfs/dbraw/zinc/05/01/54/173050154.db2.gz QVWVRGPZUXZTFR-QMMMGPOBSA-N 1 2 244.747 2.434 20 0 BEADLO C[N@H+]1CCC[C@H]1C(=O)Nc1ccsc1Cl ZINC000275900338 173050156 /nfs/dbraw/zinc/05/01/56/173050156.db2.gz QVWVRGPZUXZTFR-QMMMGPOBSA-N 1 2 244.747 2.434 20 0 BEADLO C[NH2+]Cc1noc([C@H]2CCCCC2(C)C)n1 ZINC000226694315 173399758 /nfs/dbraw/zinc/39/97/58/173399758.db2.gz CGGGZIWOOSETAP-SECBINFHSA-N 1 2 223.320 2.473 20 0 BEADLO COC(=O)C[N@H+](Cc1csc(C)c1)C(C)C ZINC000294720460 173584594 /nfs/dbraw/zinc/58/45/94/173584594.db2.gz GEZJIIWWMAGDJF-UHFFFAOYSA-N 1 2 241.356 2.440 20 0 BEADLO COC(=O)C[N@@H+](Cc1csc(C)c1)C(C)C ZINC000294720460 173584596 /nfs/dbraw/zinc/58/45/96/173584596.db2.gz GEZJIIWWMAGDJF-UHFFFAOYSA-N 1 2 241.356 2.440 20 0 BEADLO COC1(CNc2cccc[nH+]2)CCCC1 ZINC000276524639 174006010 /nfs/dbraw/zinc/00/60/10/174006010.db2.gz GDGLASAIWYNKPV-UHFFFAOYSA-N 1 2 206.289 2.453 20 0 BEADLO COC1C[NH+](Cc2ccc(OC(F)F)cc2)C1 ZINC000358447770 174034484 /nfs/dbraw/zinc/03/44/84/174034484.db2.gz BWGRYQDMGYVJFO-UHFFFAOYSA-N 1 2 243.253 2.119 20 0 BEADLO COC1C[NH+](Cc2cccc(Cl)c2)C1 ZINC000357894481 174035026 /nfs/dbraw/zinc/03/50/26/174035026.db2.gz POBZHHVXWJZBCZ-UHFFFAOYSA-N 1 2 211.692 2.171 20 0 BEADLO COCC1(NC(=O)Nc2cc[nH+]cc2C)CCC1 ZINC000284821645 174107839 /nfs/dbraw/zinc/10/78/39/174107839.db2.gz OHXVJHOBOVWKKQ-UHFFFAOYSA-N 1 2 249.314 2.081 20 0 BEADLO COCC1=CC[N@H+](Cc2ncc(C)s2)CC1 ZINC000185874753 174116738 /nfs/dbraw/zinc/11/67/38/174116738.db2.gz FQJIPXQSOQGIME-UHFFFAOYSA-N 1 2 238.356 2.230 20 0 BEADLO COCC1=CC[N@@H+](Cc2ncc(C)s2)CC1 ZINC000185874753 174116739 /nfs/dbraw/zinc/11/67/39/174116739.db2.gz FQJIPXQSOQGIME-UHFFFAOYSA-N 1 2 238.356 2.230 20 0 BEADLO COCCC(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000118643709 174137537 /nfs/dbraw/zinc/13/75/37/174137537.db2.gz UYVSEKQHDRSHGB-UHFFFAOYSA-N 1 2 245.282 2.052 20 0 BEADLO COCCC(C)(C)C(=O)Nc1cc[nH+]c(C)c1 ZINC000185279081 174142615 /nfs/dbraw/zinc/14/26/15/174142615.db2.gz YFXDNEFGSARPSM-UHFFFAOYSA-N 1 2 236.315 2.391 20 0 BEADLO COCCCC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000097366515 174167840 /nfs/dbraw/zinc/16/78/40/174167840.db2.gz NIMHKWJKHJCDNZ-UHFFFAOYSA-N 1 2 236.315 2.372 20 0 BEADLO COCCC[N@@H+]1CCCC[C@@H]1C(F)F ZINC000337411190 174228684 /nfs/dbraw/zinc/22/86/84/174228684.db2.gz OZEFTGZOKXGGQI-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO COCCC[N@H+]1CCCC[C@@H]1C(F)F ZINC000337411190 174228686 /nfs/dbraw/zinc/22/86/86/174228686.db2.gz OZEFTGZOKXGGQI-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO COCCC[C@H](C)C(=O)Nc1cc[nH+]cc1C ZINC000182796516 174263134 /nfs/dbraw/zinc/26/31/34/174263134.db2.gz UDHFCJWENUGHGX-JTQLQIEISA-N 1 2 236.315 2.391 20 0 BEADLO COCC[N@H+](C)Cc1ccc(Cl)nc1Cl ZINC000234608826 174281496 /nfs/dbraw/zinc/28/14/96/174281496.db2.gz PCEDKXYTCXFMEV-UHFFFAOYSA-N 1 2 249.141 2.467 20 0 BEADLO COCC[N@@H+](C)Cc1ccc(Cl)nc1Cl ZINC000234608826 174281497 /nfs/dbraw/zinc/28/14/97/174281497.db2.gz PCEDKXYTCXFMEV-UHFFFAOYSA-N 1 2 249.141 2.467 20 0 BEADLO COCC[N@H+](CCC(C)(C)OC)CC(F)F ZINC000346244586 174289535 /nfs/dbraw/zinc/28/95/35/174289535.db2.gz BPCVFBZQIUEFFV-UHFFFAOYSA-N 1 2 239.306 2.015 20 0 BEADLO COCC[N@@H+](CCC(C)(C)OC)CC(F)F ZINC000346244586 174289538 /nfs/dbraw/zinc/28/95/38/174289538.db2.gz BPCVFBZQIUEFFV-UHFFFAOYSA-N 1 2 239.306 2.015 20 0 BEADLO COCC[N@H+](Cc1nc(C)cs1)C1CC1 ZINC000336649482 174300315 /nfs/dbraw/zinc/30/03/15/174300315.db2.gz RAVFZMKAOAEKOW-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO COCC[N@@H+](Cc1nc(C)cs1)C1CC1 ZINC000336649482 174300318 /nfs/dbraw/zinc/30/03/18/174300318.db2.gz RAVFZMKAOAEKOW-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO COCCSCCCOc1cc[nH+]cc1 ZINC000292766373 174375626 /nfs/dbraw/zinc/37/56/26/174375626.db2.gz OOUGZQCDBMLKIP-UHFFFAOYSA-N 1 2 227.329 2.230 20 0 BEADLO COCC[C@@H](CO)Nc1ccc2ccccc2[nH+]1 ZINC000281810080 174390279 /nfs/dbraw/zinc/39/02/79/174390279.db2.gz IZTSXRSIMHUCTQ-LBPRGKRZSA-N 1 2 246.310 2.044 20 0 BEADLO COCC[C@@H]([NH2+]Cc1cocn1)c1ccco1 ZINC000277084990 174394435 /nfs/dbraw/zinc/39/44/35/174394435.db2.gz UPVQZSMYTLILSN-LLVKDONJSA-N 1 2 236.271 2.135 20 0 BEADLO COc1cc(NCc2[nH]cc[nH+]2)cc(OC)c1 ZINC000049714517 175003563 /nfs/dbraw/zinc/00/35/63/175003563.db2.gz CPYVDZZDRRMODZ-UHFFFAOYSA-N 1 2 233.271 2.039 20 0 BEADLO CCCn1nccc1C[N@@H+]1CCC[C@@H](F)C1 ZINC000668292831 487629820 /nfs/dbraw/zinc/62/98/20/487629820.db2.gz PNPIQDACPSIYKF-LLVKDONJSA-N 1 2 225.311 2.227 20 0 BEADLO CCCn1nccc1C[N@H+]1CCC[C@@H](F)C1 ZINC000668292831 487629826 /nfs/dbraw/zinc/62/98/26/487629826.db2.gz PNPIQDACPSIYKF-LLVKDONJSA-N 1 2 225.311 2.227 20 0 BEADLO COc1ccc(F)c(C[N@@H+]2CCOC[C@@H]2C)c1 ZINC000295178950 175124818 /nfs/dbraw/zinc/12/48/18/175124818.db2.gz VKVNIIXMMOVTGZ-JTQLQIEISA-N 1 2 239.290 2.055 20 0 BEADLO COc1ccc(F)c(C[N@H+]2CCOC[C@@H]2C)c1 ZINC000295178950 175124820 /nfs/dbraw/zinc/12/48/20/175124820.db2.gz VKVNIIXMMOVTGZ-JTQLQIEISA-N 1 2 239.290 2.055 20 0 BEADLO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1cnc[nH]1 ZINC000054764775 175133241 /nfs/dbraw/zinc/13/32/41/175133241.db2.gz VUTZANFFKGKAKH-VIFPVBQESA-N 1 2 249.289 2.408 20 0 BEADLO COc1ccc(NCc2[nH+]ccn2C)c(C)c1 ZINC000061566655 175152951 /nfs/dbraw/zinc/15/29/51/175152951.db2.gz NMAMXLMPYXAJRZ-UHFFFAOYSA-N 1 2 231.299 2.349 20 0 BEADLO COc1ccc([C@@H](C)[NH2+]Cc2c[nH]cn2)cc1 ZINC000112344499 175177214 /nfs/dbraw/zinc/17/72/14/175177214.db2.gz CLYSIKVNQZOINU-SNVBAGLBSA-N 1 2 231.299 2.269 20 0 BEADLO COc1ccc([C@H](C)[NH2+]Cc2nc(C)no2)cc1 ZINC000038034371 175189854 /nfs/dbraw/zinc/18/98/54/175189854.db2.gz ACTKEBKZKFBHMX-VIFPVBQESA-N 1 2 247.298 2.237 20 0 BEADLO Cn1ncc(C2CC2)c1C[N@@H+]1CCC[C@@H](F)C1 ZINC000668292995 487630086 /nfs/dbraw/zinc/63/00/86/487630086.db2.gz RQIXWVMQFPMLAX-LLVKDONJSA-N 1 2 237.322 2.231 20 0 BEADLO Cn1ncc(C2CC2)c1C[N@H+]1CCC[C@@H](F)C1 ZINC000668292995 487630093 /nfs/dbraw/zinc/63/00/93/487630093.db2.gz RQIXWVMQFPMLAX-LLVKDONJSA-N 1 2 237.322 2.231 20 0 BEADLO COc1ccc2[nH+]c(N(C)C[C@H](C)O)ccc2c1 ZINC000302614653 175229128 /nfs/dbraw/zinc/22/91/28/175229128.db2.gz CCYSSQQBPWQFIQ-JTQLQIEISA-N 1 2 246.310 2.060 20 0 BEADLO COc1cccc(CCNc2cc(C)[nH+]cn2)c1 ZINC000225726754 175252610 /nfs/dbraw/zinc/25/26/10/175252610.db2.gz CRIBVOQWZADFGN-UHFFFAOYSA-N 1 2 243.310 2.448 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2cocn2)c1 ZINC000277959708 175254517 /nfs/dbraw/zinc/25/45/17/175254517.db2.gz JBBWLIRUKBYXHD-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2cocn2)c1 ZINC000277959708 175254519 /nfs/dbraw/zinc/25/45/19/175254519.db2.gz JBBWLIRUKBYXHD-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1cccc(C[N@@H+]2CCC[C@](C)(F)C2)n1 ZINC000296134007 175258450 /nfs/dbraw/zinc/25/84/50/175258450.db2.gz URGWYFFHAGNVJN-ZDUSSCGKSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cccc(C[N@H+]2CCC[C@](C)(F)C2)n1 ZINC000296134007 175258452 /nfs/dbraw/zinc/25/84/52/175258452.db2.gz URGWYFFHAGNVJN-ZDUSSCGKSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cccc([C@@H](C)[NH2+]Cc2nonc2C)c1 ZINC000148240730 175287680 /nfs/dbraw/zinc/28/76/80/175287680.db2.gz NNEHTZSJKLQTFP-SECBINFHSA-N 1 2 247.298 2.237 20 0 BEADLO COc1cccc2c(N[C@@H](C)CCO)cc[nH+]c12 ZINC000275499589 175299974 /nfs/dbraw/zinc/29/99/74/175299974.db2.gz MBIUYICVEYRNAZ-JTQLQIEISA-N 1 2 246.310 2.426 20 0 BEADLO COc1cccc2c(N(C)C[C@@H](C)O)cc[nH+]c12 ZINC000302670465 175300464 /nfs/dbraw/zinc/30/04/64/175300464.db2.gz NTQLEYXQUMDEQK-SNVBAGLBSA-N 1 2 246.310 2.060 20 0 BEADLO COc1ccccc1C[N@H+](C)Cc1ccn(C)n1 ZINC000270861069 175324594 /nfs/dbraw/zinc/32/45/94/175324594.db2.gz ZXCUSXDRWYTEEX-UHFFFAOYSA-N 1 2 245.326 2.061 20 0 BEADLO COc1ccccc1C[N@@H+](C)Cc1ccn(C)n1 ZINC000270861069 175324595 /nfs/dbraw/zinc/32/45/95/175324595.db2.gz ZXCUSXDRWYTEEX-UHFFFAOYSA-N 1 2 245.326 2.061 20 0 BEADLO COc1ccccc1C[N@@H+]1CCC(=O)[C@@H](C)C1 ZINC000049693513 175325590 /nfs/dbraw/zinc/32/55/90/175325590.db2.gz QQLJIFJPUWHVER-NSHDSACASA-N 1 2 233.311 2.106 20 0 BEADLO COc1ccccc1C[N@H+]1CCC(=O)[C@@H](C)C1 ZINC000049693513 175325592 /nfs/dbraw/zinc/32/55/92/175325592.db2.gz QQLJIFJPUWHVER-NSHDSACASA-N 1 2 233.311 2.106 20 0 BEADLO COc1ccccc1OCc1c[nH+]cn1C ZINC000258276401 175341252 /nfs/dbraw/zinc/34/12/52/175341252.db2.gz SVDPJXOODQAMFI-UHFFFAOYSA-N 1 2 218.256 2.008 20 0 BEADLO COc1ccncc1C[NH2+]Cc1nc(C)cs1 ZINC000292478225 175371642 /nfs/dbraw/zinc/37/16/42/175371642.db2.gz AMUWOCMMVMJQRJ-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO COc1cc[nH+]cc1COc1cccc(CO)c1 ZINC000336793272 175373628 /nfs/dbraw/zinc/37/36/28/175373628.db2.gz WAMUWYKQCSENGL-UHFFFAOYSA-N 1 2 245.278 2.162 20 0 BEADLO COc1cc[nH+]cc1CNc1nc(C)cc(C)n1 ZINC000292841203 175374136 /nfs/dbraw/zinc/37/41/36/175374136.db2.gz VICOTCPBOCPTAL-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@H]1CC1(C)C ZINC000120507314 175375167 /nfs/dbraw/zinc/37/51/67/175375167.db2.gz QOFDYVCZCWBZTR-MRVPVSSYSA-N 1 2 220.272 2.075 20 0 BEADLO COc1cc[nH+]cc1NC(=O)CC1CCC1 ZINC000079843616 175375179 /nfs/dbraw/zinc/37/51/79/175375179.db2.gz DZLUVDPZQFMFRO-UHFFFAOYSA-N 1 2 220.272 2.219 20 0 BEADLO C[C@@H](O)C[N@H+](C)Cc1nc(Cl)ccc1Cl ZINC000061631192 175968219 /nfs/dbraw/zinc/96/82/19/175968219.db2.gz VQUAAZMUDUQTLE-SSDOTTSWSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@@H](O)C[N@@H+](C)Cc1nc(Cl)ccc1Cl ZINC000061631192 175968221 /nfs/dbraw/zinc/96/82/21/175968221.db2.gz VQUAAZMUDUQTLE-SSDOTTSWSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1cnnn1C ZINC000129711308 176024504 /nfs/dbraw/zinc/02/45/04/176024504.db2.gz SOMJBJCTPCNBTM-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1cnnn1C ZINC000129711308 176024505 /nfs/dbraw/zinc/02/45/05/176024505.db2.gz SOMJBJCTPCNBTM-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO C[C@@H](c1cccs1)[N@H+](C)Cc1cnnn1C ZINC000157801994 176032914 /nfs/dbraw/zinc/03/29/14/176032914.db2.gz PUIYZOXHFKTLGF-VIFPVBQESA-N 1 2 236.344 2.070 20 0 BEADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1cnnn1C ZINC000157801994 176032915 /nfs/dbraw/zinc/03/29/15/176032915.db2.gz PUIYZOXHFKTLGF-VIFPVBQESA-N 1 2 236.344 2.070 20 0 BEADLO C[C@@H]1CC(C)(C)CC[C@@H]1[NH2+]Cc1c[nH]nn1 ZINC000334622624 176051558 /nfs/dbraw/zinc/05/15/58/176051558.db2.gz BVNDQCIDFHXBLS-KOLCDFICSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@@H]1CC(C)(C)CC[C@@H]1[NH2+]Cc1cn[nH]n1 ZINC000334622624 176051560 /nfs/dbraw/zinc/05/15/60/176051560.db2.gz BVNDQCIDFHXBLS-KOLCDFICSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@@H]1CC/C(=C\C(=O)NCCCn2cc[nH+]c2)C1 ZINC000267834288 176057370 /nfs/dbraw/zinc/05/73/70/176057370.db2.gz FEJVIZGZMYDFSX-GMCKNXKJSA-N 1 2 247.342 2.136 20 0 BEADLO C[C@@H]1CCCCN1C(=O)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000336221848 176067945 /nfs/dbraw/zinc/06/79/45/176067945.db2.gz YOLJBYCJCXEWNB-MNOVXSKESA-N 1 2 247.342 2.231 20 0 BEADLO C[C@@H]1CCCC[C@@H]1CNC(=O)CCn1cc[nH+]c1 ZINC000299657326 176076095 /nfs/dbraw/zinc/07/60/95/176076095.db2.gz MLFALFBDXYWDIH-CHWSQXEVSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@@H]1CCCC[C@@H]1N(C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000276445526 176077671 /nfs/dbraw/zinc/07/76/71/176077671.db2.gz AGGYOLFAXFJBAJ-HOVLTTNMSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@@H]1CCCC[C@H]1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000276506832 176086024 /nfs/dbraw/zinc/08/60/24/176086024.db2.gz INNNRDWNORWUFW-PWBFPFQSSA-N 1 2 233.315 2.118 20 0 BEADLO C[C@@H]1CCCC[C@H]1NC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000336624391 176086572 /nfs/dbraw/zinc/08/65/72/176086572.db2.gz IIRDOTLNVGNBEE-GHMZBOCLSA-N 1 2 249.358 2.382 20 0 BEADLO C[C@@H]1CCCC[C@H]1Nc1[nH+]cnc2c1cnn2C ZINC000014207696 176089467 /nfs/dbraw/zinc/08/94/67/176089467.db2.gz HGCUIXQXJDMQEP-MWLCHTKSSA-N 1 2 245.330 2.354 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)[C@@H]1CCC[C@@H](C)C1 ZINC000357018792 176113344 /nfs/dbraw/zinc/11/33/44/176113344.db2.gz MKVRYQLDGOODDY-JHJVBQTASA-N 1 2 249.358 2.214 20 0 BEADLO C[C@@H]1CCN(C(=O)C=Cc2c[nH]c[nH+]2)CC1(C)C ZINC000283195401 176154093 /nfs/dbraw/zinc/15/40/93/176154093.db2.gz QQYUVLZAIABURS-SGUJLRQBSA-N 1 2 247.342 2.318 20 0 BEADLO C[C@@H]1CCN(C(=O)c2ccc3[nH+]ccn3c2)[C@@H]1C ZINC000177060788 176163072 /nfs/dbraw/zinc/16/30/72/176163072.db2.gz HDDCZHLKQLBOIU-GHMZBOCLSA-N 1 2 243.310 2.205 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cccs2)CC[S@]1=O ZINC000277101221 176175852 /nfs/dbraw/zinc/17/58/52/176175852.db2.gz GLXMJHIOFODTAB-MEBBXXQBSA-N 1 2 243.397 2.091 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cccs2)CC[S@]1=O ZINC000277101221 176175855 /nfs/dbraw/zinc/17/58/55/176175855.db2.gz GLXMJHIOFODTAB-MEBBXXQBSA-N 1 2 243.397 2.091 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nccn2CC(F)(F)F)C1 ZINC000264091572 176178742 /nfs/dbraw/zinc/17/87/42/176178742.db2.gz QACNWFIRACKRIZ-SECBINFHSA-N 1 2 247.264 2.287 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nccn2CC(F)(F)F)C1 ZINC000264091572 176178743 /nfs/dbraw/zinc/17/87/43/176178743.db2.gz QACNWFIRACKRIZ-SECBINFHSA-N 1 2 247.264 2.287 20 0 BEADLO C[C@@H]1CCN(c2nc(N)c3ccccc3[nH+]2)[C@@H]1C ZINC000301910276 176182211 /nfs/dbraw/zinc/18/22/11/176182211.db2.gz SBUVWBDMYMJTSR-NXEZZACHSA-N 1 2 242.326 2.447 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cncc(F)c2)CC(C)(C)O1 ZINC000274885178 176310521 /nfs/dbraw/zinc/31/05/21/176310521.db2.gz XYNQGDHCWNTCJQ-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cncc(F)c2)CC(C)(C)O1 ZINC000274885178 176310522 /nfs/dbraw/zinc/31/05/22/176310522.db2.gz XYNQGDHCWNTCJQ-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nccs2)CCS1 ZINC000135043713 176311755 /nfs/dbraw/zinc/31/17/55/176311755.db2.gz JAMHBDKRNORSQI-MRVPVSSYSA-N 1 2 214.359 2.080 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nccs2)CCS1 ZINC000135043713 176311756 /nfs/dbraw/zinc/31/17/56/176311756.db2.gz JAMHBDKRNORSQI-MRVPVSSYSA-N 1 2 214.359 2.080 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nnc(C3CC3)n2C2CC2)[C@@H]1C ZINC000339572848 176312947 /nfs/dbraw/zinc/31/29/47/176312947.db2.gz YZZICTICTRNNLQ-NXEZZACHSA-N 1 2 246.358 2.331 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nnc(C3CC3)n2C2CC2)[C@@H]1C ZINC000339572848 176312948 /nfs/dbraw/zinc/31/29/48/176312948.db2.gz YZZICTICTRNNLQ-NXEZZACHSA-N 1 2 246.358 2.331 20 0 BEADLO C[C@@H]1CN(c2[nH+]ccc3ccc(F)cc32)C[C@H]1O ZINC000354874041 176320459 /nfs/dbraw/zinc/32/04/59/176320459.db2.gz GRAIBNXIBSEVIA-NOZJJQNGSA-N 1 2 246.285 2.191 20 0 BEADLO C[C@@H]1COCC[N@H+](Cc2ncc(C3CC3)o2)C1 ZINC000336612711 176333129 /nfs/dbraw/zinc/33/31/29/176333129.db2.gz BYRFGYCDDRBPJK-JTQLQIEISA-N 1 2 236.315 2.020 20 0 BEADLO C[C@@H]1COCC[N@@H+](Cc2ncc(C3CC3)o2)C1 ZINC000336612711 176333132 /nfs/dbraw/zinc/33/31/32/176333132.db2.gz BYRFGYCDDRBPJK-JTQLQIEISA-N 1 2 236.315 2.020 20 0 BEADLO C[C@@H]1COCC[C@H]1[NH2+][C@H](C1CC1)C(F)(F)F ZINC000309822858 176345238 /nfs/dbraw/zinc/34/52/38/176345238.db2.gz WRUOAWDFUVYGAO-SZEHBUNVSA-N 1 2 237.265 2.342 20 0 BEADLO C[C@@H]1COc2ccccc2C[N@@H+]1Cc1ccno1 ZINC000272915279 176347949 /nfs/dbraw/zinc/34/79/49/176347949.db2.gz IDDBXPHSNUFOGE-LLVKDONJSA-N 1 2 244.294 2.458 20 0 BEADLO C[C@@H]1COc2ccccc2C[N@H+]1Cc1ccno1 ZINC000272915279 176347951 /nfs/dbraw/zinc/34/79/51/176347951.db2.gz IDDBXPHSNUFOGE-LLVKDONJSA-N 1 2 244.294 2.458 20 0 BEADLO C[C@@H]1C[C@@H](Nc2ncc(Cl)cn2)c2[nH+]ccn21 ZINC000333642710 176380285 /nfs/dbraw/zinc/38/02/85/176380285.db2.gz CKSVTRADPPLRQL-VXNVDRBHSA-N 1 2 249.705 2.444 20 0 BEADLO C[C@@H]1C[C@@H]1CC(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000355499146 176387832 /nfs/dbraw/zinc/38/78/32/176387832.db2.gz AYOSRZJPNGSJOI-GMTAPVOTSA-N 1 2 233.315 2.119 20 0 BEADLO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1cnn(C)n1 ZINC000289755600 177033910 /nfs/dbraw/zinc/03/39/10/177033910.db2.gz JGAVFIVBSYSBFG-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1cnn(C)n1 ZINC000289755600 177033911 /nfs/dbraw/zinc/03/39/11/177033911.db2.gz JGAVFIVBSYSBFG-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO C[C@H](c1ccccn1)[N@H+](C)Cc1ccnn1C ZINC000091079573 177042696 /nfs/dbraw/zinc/04/26/96/177042696.db2.gz IQXJERWLMPAZEZ-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1ccnn1C ZINC000091079573 177042697 /nfs/dbraw/zinc/04/26/97/177042697.db2.gz IQXJERWLMPAZEZ-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1ccco1)[N@H+](Cc1cnnn1C)C1CC1 ZINC000092483354 177048773 /nfs/dbraw/zinc/04/87/73/177048773.db2.gz BUGDXAVXHDLBDS-SNVBAGLBSA-N 1 2 246.314 2.134 20 0 BEADLO C[C@H](c1ccco1)[N@@H+](Cc1cnnn1C)C1CC1 ZINC000092483354 177048775 /nfs/dbraw/zinc/04/87/75/177048775.db2.gz BUGDXAVXHDLBDS-SNVBAGLBSA-N 1 2 246.314 2.134 20 0 BEADLO C[C@H](c1cccs1)[N@H+](C)Cc1cn(C)nn1 ZINC000336671550 177049134 /nfs/dbraw/zinc/04/91/34/177049134.db2.gz ZOQOEJAAHHQNBN-SECBINFHSA-N 1 2 236.344 2.070 20 0 BEADLO C[C@H](c1cccs1)[N@@H+](C)Cc1cn(C)nn1 ZINC000336671550 177049136 /nfs/dbraw/zinc/04/91/36/177049136.db2.gz ZOQOEJAAHHQNBN-SECBINFHSA-N 1 2 236.344 2.070 20 0 BEADLO C[C@H](c1cnccn1)[N@@H+]1CCC[C@](C)(F)C1 ZINC000295451552 177051716 /nfs/dbraw/zinc/05/17/16/177051716.db2.gz PLPVWQFANBHAIO-PWSUYJOCSA-N 1 2 223.295 2.362 20 0 BEADLO C[C@H](c1cnccn1)[N@H+]1CCC[C@](C)(F)C1 ZINC000295451552 177051718 /nfs/dbraw/zinc/05/17/18/177051718.db2.gz PLPVWQFANBHAIO-PWSUYJOCSA-N 1 2 223.295 2.362 20 0 BEADLO C[C@@H](c1cccs1)c1noc(C[NH+](C)C)n1 ZINC000277921253 177056271 /nfs/dbraw/zinc/05/62/71/177056271.db2.gz MXEANBVAJBDRIF-QMMMGPOBSA-N 1 2 237.328 2.345 20 0 BEADLO C[C@H]1CC(C(=O)NCc2[nH+]ccn2C)C[C@H](C)C1 ZINC000272614355 177063525 /nfs/dbraw/zinc/06/35/25/177063525.db2.gz ZXFBLFZOCICHTF-GHMZBOCLSA-N 1 2 249.358 2.109 20 0 BEADLO C[C@H]1CC/C(=C\C(=O)NCCCn2cc[nH+]c2)C1 ZINC000267834287 177067130 /nfs/dbraw/zinc/06/71/30/177067130.db2.gz FEJVIZGZMYDFSX-CVCOIXHCSA-N 1 2 247.342 2.136 20 0 BEADLO C[C@H]1CCCC[C@@H]1Nc1[nH+]cnc2c1cnn2C ZINC000014207695 177083457 /nfs/dbraw/zinc/08/34/57/177083457.db2.gz HGCUIXQXJDMQEP-ONGXEEELSA-N 1 2 245.330 2.354 20 0 BEADLO C[C@H]1CCCC[C@H]1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000276506835 177086990 /nfs/dbraw/zinc/08/69/90/177086990.db2.gz INNNRDWNORWUFW-SKBQGCEYSA-N 1 2 233.315 2.118 20 0 BEADLO C[C@H]1CCCN(c2nc[nH+]c(N)c2Cl)CC1 ZINC000235654478 177105022 /nfs/dbraw/zinc/10/50/22/177105022.db2.gz BFECVXVTHBFLAA-QMMMGPOBSA-N 1 2 240.738 2.339 20 0 BEADLO C[C@H]1CCCN(c2[nH+]cnc(N)c2Cl)CC1 ZINC000235654478 177105024 /nfs/dbraw/zinc/10/50/24/177105024.db2.gz BFECVXVTHBFLAA-QMMMGPOBSA-N 1 2 240.738 2.339 20 0 BEADLO C[C@H]1CCC[N@@H+]1Cc1ncn(-c2ccccc2)n1 ZINC000179356343 177111153 /nfs/dbraw/zinc/11/11/53/177111153.db2.gz WTBVOWYOAYIWHX-LBPRGKRZSA-N 1 2 242.326 2.252 20 0 BEADLO C[C@H]1CCC[N@H+]1Cc1ncn(-c2ccccc2)n1 ZINC000179356343 177111155 /nfs/dbraw/zinc/11/11/55/177111155.db2.gz WTBVOWYOAYIWHX-LBPRGKRZSA-N 1 2 242.326 2.252 20 0 BEADLO C[C@H]1CCC[C@@H](C(=O)N(C)Cc2[nH]cc[nH+]2)C1 ZINC000335835791 177112932 /nfs/dbraw/zinc/11/29/32/177112932.db2.gz WXPFQDDIGSINPR-WDEREUQCSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@@H]1CCC[C@H](C)N1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000283958586 177115452 /nfs/dbraw/zinc/11/54/52/177115452.db2.gz LRRMSHUDTDXJJW-XIUUEPKSSA-N 1 2 233.315 2.212 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)C[C@H]1CCC[C@@H]1C ZINC000274388965 177124027 /nfs/dbraw/zinc/12/40/27/177124027.db2.gz BRMRZTLWWNPHHL-YNEHKIRRSA-N 1 2 249.358 2.214 20 0 BEADLO C[C@H]1CCC[C@H](CNC(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000283503865 177133371 /nfs/dbraw/zinc/13/33/71/177133371.db2.gz PEYNALOHNGWIEJ-WTIVYXKASA-N 1 2 247.342 2.365 20 0 BEADLO C[C@H]1CCC[C@H](NC(=O)CCc2[nH]cc[nH+]2)CC1 ZINC000289277645 177135386 /nfs/dbraw/zinc/13/53/86/177135386.db2.gz YXVCGXRMSXXCIA-RYUDHWBXSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@H]1CC[N@H+](Cc2noc(C(C)(C)C)n2)C1 ZINC000336191614 177168191 /nfs/dbraw/zinc/16/81/91/177168191.db2.gz UAFIUMWIBQYKLI-VIFPVBQESA-N 1 2 223.320 2.209 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2noc(C(C)(C)C)n2)C1 ZINC000336191614 177168193 /nfs/dbraw/zinc/16/81/93/177168193.db2.gz UAFIUMWIBQYKLI-VIFPVBQESA-N 1 2 223.320 2.209 20 0 BEADLO C[C@H]1CCOCC[N@@H+]1Cc1ncc(C2CC2)o1 ZINC000367655467 177177009 /nfs/dbraw/zinc/17/70/09/177177009.db2.gz DAQFOGUSEBEUGP-JTQLQIEISA-N 1 2 236.315 2.163 20 0 BEADLO C[C@H]1CCOCC[N@H+]1Cc1ncc(C2CC2)o1 ZINC000367655467 177177011 /nfs/dbraw/zinc/17/70/11/177177011.db2.gz DAQFOGUSEBEUGP-JTQLQIEISA-N 1 2 236.315 2.163 20 0 BEADLO C[C@H]1CCOCC[N@@H+]1Cc1cnc(Cl)s1 ZINC000362232196 177177627 /nfs/dbraw/zinc/17/76/27/177177627.db2.gz BDTFDPZLTYIKAU-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@H]1CCOCC[N@H+]1Cc1cnc(Cl)s1 ZINC000362232196 177177628 /nfs/dbraw/zinc/17/76/28/177177628.db2.gz BDTFDPZLTYIKAU-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@H]1CC[C@H]([NH2+]c2ccc(OCC(N)=O)cc2)C1 ZINC000080451871 177205209 /nfs/dbraw/zinc/20/52/09/177205209.db2.gz CDYUGUUCFSKEME-JQWIXIFHSA-N 1 2 248.326 2.151 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1cccc2c1OCO2 ZINC000092017505 177264496 /nfs/dbraw/zinc/26/44/96/177264496.db2.gz HEEXHXMBZBWCNJ-MNOVXSKESA-N 1 2 249.310 2.025 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1cccc2c1OCO2 ZINC000092017505 177264497 /nfs/dbraw/zinc/26/44/97/177264497.db2.gz HEEXHXMBZBWCNJ-MNOVXSKESA-N 1 2 249.310 2.025 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cccc3c2OCO3)C[C@H](C)O1 ZINC000126989769 177265402 /nfs/dbraw/zinc/26/54/02/177265402.db2.gz JDUPGMRNKDVTRU-PHIMTYICSA-N 1 2 249.310 2.025 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cccc3c2OCO3)C[C@H](C)O1 ZINC000126989769 177265403 /nfs/dbraw/zinc/26/54/03/177265403.db2.gz JDUPGMRNKDVTRU-PHIMTYICSA-N 1 2 249.310 2.025 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccon2)Cc2ccccc2O1 ZINC000292442446 177268218 /nfs/dbraw/zinc/26/82/18/177268218.db2.gz OPVCHAFZDFYBED-NSHDSACASA-N 1 2 244.294 2.458 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccon2)Cc2ccccc2O1 ZINC000292442446 177268220 /nfs/dbraw/zinc/26/82/20/177268220.db2.gz OPVCHAFZDFYBED-NSHDSACASA-N 1 2 244.294 2.458 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccnc(Cl)c2)[C@@H](C)CO1 ZINC000223909039 177268561 /nfs/dbraw/zinc/26/85/61/177268561.db2.gz RGDSORGSEBUQAI-UWVGGRQHSA-N 1 2 240.734 2.344 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccnc(Cl)c2)[C@@H](C)CO1 ZINC000223909039 177268562 /nfs/dbraw/zinc/26/85/62/177268562.db2.gz RGDSORGSEBUQAI-UWVGGRQHSA-N 1 2 240.734 2.344 20 0 BEADLO C[C@@H]1[C@@H](C)CN1Cc1[nH+]ccn1CC(F)(F)F ZINC000339573242 177272149 /nfs/dbraw/zinc/27/21/49/177272149.db2.gz KMMXREUHLZWGFR-DTWKUNHWSA-N 1 2 247.264 2.286 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1ncnn1-c1ccccc1 ZINC000293401601 177272427 /nfs/dbraw/zinc/27/24/27/177272427.db2.gz LODXULCKYHAZNN-NWDGAFQWSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1ncnn1-c1ccccc1 ZINC000293401601 177272428 /nfs/dbraw/zinc/27/24/28/177272428.db2.gz LODXULCKYHAZNN-NWDGAFQWSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@H]1COCC[N@@H+]1Cc1ccc(F)cc1 ZINC000046773842 177292831 /nfs/dbraw/zinc/29/28/31/177292831.db2.gz BSGPDMSJULZFQO-JTQLQIEISA-N 1 2 209.264 2.046 20 0 BEADLO C[C@H]1COCC[N@H+]1Cc1ccc(F)cc1 ZINC000046773842 177292833 /nfs/dbraw/zinc/29/28/33/177292833.db2.gz BSGPDMSJULZFQO-JTQLQIEISA-N 1 2 209.264 2.046 20 0 BEADLO C[C@H]1CSC(SCCn2cc[nH+]c2)=N1 ZINC000155518015 177302881 /nfs/dbraw/zinc/30/28/81/177302881.db2.gz GUUFETIEKVRZOF-QMMMGPOBSA-N 1 2 227.358 2.108 20 0 BEADLO C[C@H]1C[C@H](C(=O)NCc2[nH+]ccn2C)C[C@@H](C)C1 ZINC000272614351 177317018 /nfs/dbraw/zinc/31/70/18/177317018.db2.gz ZXFBLFZOCICHTF-GDNZZTSVSA-N 1 2 249.358 2.109 20 0 BEADLO C[C@@H]1CCCN1C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000333227591 177328646 /nfs/dbraw/zinc/32/86/46/177328646.db2.gz XKCJOXFVAUJZFD-OUAUKWLOSA-N 1 2 248.330 2.083 20 0 BEADLO C[C@H]1C[C@@H]([NH2+]CC(F)(F)CO)c2ccccc21 ZINC000290380474 177330503 /nfs/dbraw/zinc/33/05/03/177330503.db2.gz RSLWTELGVQBSCE-JOYOIKCWSA-N 1 2 241.281 2.452 20 0 BEADLO C[C@H]1C[C@@H]([NH2+]Cc2ccoc2)c2nccn21 ZINC000293853255 177334218 /nfs/dbraw/zinc/33/42/18/177334218.db2.gz CVCOGGMHUDVCEZ-GXSJLCMTSA-N 1 2 217.272 2.272 20 0 BEADLO CC1=C(C)C[C@H](C(=O)NCc2c[nH+]cn2C)CC1 ZINC000335476134 487637626 /nfs/dbraw/zinc/63/76/26/487637626.db2.gz YYLKDGARJHEHJU-GFCCVEGCSA-N 1 2 247.342 2.173 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NCc2[nH+]ccn2C)C[C@@H]1C ZINC000294487642 177354477 /nfs/dbraw/zinc/35/44/77/177354477.db2.gz GEINAWQNWVKDHB-GRYCIOLGSA-N 1 2 249.358 2.109 20 0 BEADLO C[C@H]1C[C@H](CSCCn2cc[nH+]c2)CCO1 ZINC000362457243 177363310 /nfs/dbraw/zinc/36/33/10/177363310.db2.gz PJCXYEJSAVDMQP-NWDGAFQWSA-N 1 2 240.372 2.431 20 0 BEADLO C[C@H]1Cc2ccccc2N1Cc1c[nH+]cn1C ZINC000267093078 177390888 /nfs/dbraw/zinc/39/08/88/177390888.db2.gz VFZVYLZWLCJDFQ-NSHDSACASA-N 1 2 227.311 2.371 20 0 BEADLO C[C@H]1Cc2ncn(Cc3c[nH+]cn3C)c2C[C@@H]1C ZINC000295082467 177391514 /nfs/dbraw/zinc/39/15/14/177391514.db2.gz DMTKQODXQGAPLA-QWRGUYRKSA-N 1 2 244.342 2.036 20 0 BEADLO C[C@H]1[N@H+](Cc2cncc(F)c2)CCOC1(C)C ZINC000336353179 177392738 /nfs/dbraw/zinc/39/27/38/177392738.db2.gz UJQGOLBKDUUCNU-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H]1[N@@H+](Cc2cncc(F)c2)CCOC1(C)C ZINC000336353179 177392741 /nfs/dbraw/zinc/39/27/41/177392741.db2.gz UJQGOLBKDUUCNU-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO CCc1[nH]c(CNC(=O)CCC2CCC2)c[nH+]1 ZINC001652463702 1173087756 /nfs/dbraw/zinc/08/77/56/1173087756.db2.gz KJJGRVHLWRZVSH-UHFFFAOYSA-N 1 2 235.331 2.169 20 0 BEADLO CCc1[nH]cc(CNC(=O)CCC2CCC2)[nH+]1 ZINC001652463702 1173087762 /nfs/dbraw/zinc/08/77/62/1173087762.db2.gz KJJGRVHLWRZVSH-UHFFFAOYSA-N 1 2 235.331 2.169 20 0 BEADLO C[C@@H](CCc1cccn1C)Nc1cc[nH+]cc1F ZINC000678787762 487642637 /nfs/dbraw/zinc/64/26/37/487642637.db2.gz XWEYMDPQQZCGGE-NSHDSACASA-N 1 2 247.317 2.414 20 0 BEADLO C[C@H]1CN(C(=O)C=Cc2c[nH]c[nH+]2)CC(C)(C)C1 ZINC000492776530 226052001 /nfs/dbraw/zinc/05/20/01/226052001.db2.gz ZWBJANUFIRYUMS-DOGVGXBMSA-N 1 2 247.342 2.318 20 0 BEADLO Cc1nc(C)c(NC(=O)C=Cc2c[nH]c[nH+]2)s1 ZINC000492820242 226060636 /nfs/dbraw/zinc/06/06/36/226060636.db2.gz ATADREKDDPVRSR-ARJAWSKDSA-N 1 2 248.311 2.135 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)C=Cc2c[nH]c[nH+]2)[C@H](C)C1 ZINC000492815711 226060743 /nfs/dbraw/zinc/06/07/43/226060743.db2.gz XPISVJSKZSMGKA-OFHFNFAWSA-N 1 2 247.342 2.364 20 0 BEADLO Cc1cccc(NC(=O)C=Cc2c[nH]c[nH+]2)c1 ZINC000492861147 226069195 /nfs/dbraw/zinc/06/91/95/226069195.db2.gz JEVCMMWYAUALNE-AATRIKPKSA-N 1 2 227.267 2.370 20 0 BEADLO CN(C(=O)C=Cc1c[nH]c[nH+]1)C1(C)CCCC1 ZINC000492897569 226077985 /nfs/dbraw/zinc/07/79/85/226077985.db2.gz KCJIPXPJBPIVIY-WAYWQWQTSA-N 1 2 233.315 2.214 20 0 BEADLO CCn1nccc1C[NH2+][C@H](C)c1cc(C)on1 ZINC000669686782 487648487 /nfs/dbraw/zinc/64/84/87/487648487.db2.gz MBHWZOCNUKUXNV-SNVBAGLBSA-N 1 2 234.303 2.050 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)NCCC1=CCCC1 ZINC000493326550 226186419 /nfs/dbraw/zinc/18/64/19/226186419.db2.gz STQGESDDMXXYHL-AATRIKPKSA-N 1 2 231.299 2.040 20 0 BEADLO O=C(/C=C/C1CCCC1)N1CC(n2cc[nH+]c2)C1 ZINC000493134773 226135574 /nfs/dbraw/zinc/13/55/74/226135574.db2.gz AQOUCTYPXGWMSO-AATRIKPKSA-N 1 2 245.326 2.013 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)NCCC1CCCC1 ZINC000493151890 226140758 /nfs/dbraw/zinc/14/07/58/226140758.db2.gz MXFHVZRFNSKAOS-AATRIKPKSA-N 1 2 233.315 2.119 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)/C=C/C1CCCC1 ZINC000493238939 226164772 /nfs/dbraw/zinc/16/47/72/226164772.db2.gz YCTOCVJJRLBOHT-NNNHXZLVSA-N 1 2 247.342 2.134 20 0 BEADLO C[C@@H](NC(=O)C=Cc1c[nH]c[nH+]1)C1CCCC1 ZINC000493417562 226210143 /nfs/dbraw/zinc/21/01/43/226210143.db2.gz GPGSSSBZTUDKAB-JYESYGNLSA-N 1 2 233.315 2.118 20 0 BEADLO C[C@@H](c1ccco1)N(C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493448198 226218294 /nfs/dbraw/zinc/21/82/94/226218294.db2.gz HZPQICBNVCTHJB-PORFMDCZSA-N 1 2 245.282 2.236 20 0 BEADLO C[C@H](CC(C)(C)C)NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493449858 226219440 /nfs/dbraw/zinc/21/94/40/226219440.db2.gz IRVFLZLGGCHJNR-BRAIEQGRSA-N 1 2 235.331 2.364 20 0 BEADLO C[C@@H]1C[C@H](C)CCN(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493592345 226245218 /nfs/dbraw/zinc/24/52/18/226245218.db2.gz RBNCQTPJMYMHTP-BLDJZWNYSA-N 1 2 247.342 2.318 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)NCC1=CCCCC1 ZINC000493714717 226250545 /nfs/dbraw/zinc/25/05/45/226250545.db2.gz JDYMWVRHYYIVLQ-VOTSOKGWSA-N 1 2 231.299 2.040 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)N[C@@H]1CC2CCC1CC2 ZINC000493718611 226250842 /nfs/dbraw/zinc/25/08/42/226250842.db2.gz FWVIRRBAKWSYMA-LTEAHWCBSA-N 1 2 245.326 2.118 20 0 BEADLO COCC(C)(C)CNc1ccc(N(C)C)c[nH+]1 ZINC000494201488 226262005 /nfs/dbraw/zinc/26/20/05/226262005.db2.gz MULSBRWHGCSAQD-UHFFFAOYSA-N 1 2 237.347 2.232 20 0 BEADLO O=C(NCc1ccn2cc[nH+]c2c1)OC1CCC1 ZINC000496619375 226309721 /nfs/dbraw/zinc/30/97/21/226309721.db2.gz YMFNOSONLDUZPE-UHFFFAOYSA-N 1 2 245.282 2.113 20 0 BEADLO CCOc1ccc(C[N@H+](C)Cc2cc[nH]n2)cc1 ZINC000505664837 226358340 /nfs/dbraw/zinc/35/83/40/226358340.db2.gz VGSHDHDYZXIAJA-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO CCOc1ccc(C[N@@H+](C)Cc2cc[nH]n2)cc1 ZINC000505664837 226358341 /nfs/dbraw/zinc/35/83/41/226358341.db2.gz VGSHDHDYZXIAJA-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO CCc1cc(N[C@H]2CS[C@H](C)C2)nc[nH+]1 ZINC000397794601 487651071 /nfs/dbraw/zinc/65/10/71/487651071.db2.gz FPTBJOZYZZDHJX-PSASIEDQSA-N 1 2 223.345 2.345 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccncc1)C(F)F ZINC000228482565 487656844 /nfs/dbraw/zinc/65/68/44/487656844.db2.gz NJIUIJWKHHNXAZ-JGVFFNPUSA-N 1 2 200.232 2.386 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H]1CC12CCC2 ZINC000675335082 487672088 /nfs/dbraw/zinc/67/20/88/487672088.db2.gz HYCMWASHXHPVAU-LLVKDONJSA-N 1 2 230.311 2.195 20 0 BEADLO Cc1nc(N2C[C@H](C)OC(C)(C)C2)c(C)c(C)[nH+]1 ZINC000174422093 229381829 /nfs/dbraw/zinc/38/18/29/229381829.db2.gz OKWAIAYILJRWLT-VIFPVBQESA-N 1 2 249.358 2.406 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]CCOCC1CCC1 ZINC000680938032 487675943 /nfs/dbraw/zinc/67/59/43/487675943.db2.gz IYLPVSBTQLXDHU-JTQLQIEISA-N 1 2 237.347 2.185 20 0 BEADLO CC(C)CCCNC(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000666153475 487686737 /nfs/dbraw/zinc/68/67/37/487686737.db2.gz AEGJDLDOJCEMBZ-LLVKDONJSA-N 1 2 249.358 2.067 20 0 BEADLO CC(C)CCCNC(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000666153475 487686739 /nfs/dbraw/zinc/68/67/39/487686739.db2.gz AEGJDLDOJCEMBZ-LLVKDONJSA-N 1 2 249.358 2.067 20 0 BEADLO C[C@H]1C[N@H+](CCCCF)C[C@H](C(F)(F)F)O1 ZINC000671683133 487688337 /nfs/dbraw/zinc/68/83/37/487688337.db2.gz DKSXMNVPVJKGRF-DTWKUNHWSA-N 1 2 243.244 2.388 20 0 BEADLO C[C@H]1C[N@@H+](CCCCF)C[C@H](C(F)(F)F)O1 ZINC000671683133 487688341 /nfs/dbraw/zinc/68/83/41/487688341.db2.gz DKSXMNVPVJKGRF-DTWKUNHWSA-N 1 2 243.244 2.388 20 0 BEADLO CC[C@]1(C)COCC[N@@H+]1Cc1cc(C)nc(C)n1 ZINC000660149218 487697117 /nfs/dbraw/zinc/69/71/17/487697117.db2.gz PHPCZQYWOGNTQA-CQSZACIVSA-N 1 2 249.358 2.094 20 0 BEADLO CC[C@]1(C)COCC[N@H+]1Cc1cc(C)nc(C)n1 ZINC000660149218 487697122 /nfs/dbraw/zinc/69/71/22/487697122.db2.gz PHPCZQYWOGNTQA-CQSZACIVSA-N 1 2 249.358 2.094 20 0 BEADLO c1ccc2[nH+]c(NCC34CC(C3)CO4)ccc2c1 ZINC000528183707 262908140 /nfs/dbraw/zinc/90/81/40/262908140.db2.gz RLTZRTHAEYCGOZ-UHFFFAOYSA-N 1 2 240.306 2.248 20 0 BEADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1cn(C)cn1 ZINC000683900294 487710649 /nfs/dbraw/zinc/71/06/49/487710649.db2.gz SKRRAIFXTVYJAC-CQSZACIVSA-N 1 2 244.342 2.398 20 0 BEADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1cn(C)cn1 ZINC000683900294 487710650 /nfs/dbraw/zinc/71/06/50/487710650.db2.gz SKRRAIFXTVYJAC-CQSZACIVSA-N 1 2 244.342 2.398 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1c1nc[nH+]c2c1OCCN2 ZINC000665710094 487737763 /nfs/dbraw/zinc/73/77/63/487737763.db2.gz WATKEEKLNRRMGP-NXEZZACHSA-N 1 2 248.330 2.048 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1c1[nH+]cnc2c1OCCN2 ZINC000665710094 487737771 /nfs/dbraw/zinc/73/77/71/487737771.db2.gz WATKEEKLNRRMGP-NXEZZACHSA-N 1 2 248.330 2.048 20 0 BEADLO CCc1nnc(C[N@@H+]2CCCC3(CC3)C2)s1 ZINC000681169028 487741986 /nfs/dbraw/zinc/74/19/86/487741986.db2.gz YSTMFOKADWJGGH-UHFFFAOYSA-N 1 2 237.372 2.477 20 0 BEADLO CCc1nnc(C[N@H+]2CCCC3(CC3)C2)s1 ZINC000681169028 487741988 /nfs/dbraw/zinc/74/19/88/487741988.db2.gz YSTMFOKADWJGGH-UHFFFAOYSA-N 1 2 237.372 2.477 20 0 BEADLO CCc1cccc(CNc2cc[nH+]c(C)n2)c1 ZINC000651464288 487746083 /nfs/dbraw/zinc/74/60/83/487746083.db2.gz ZXGQOPRYKKVKHP-UHFFFAOYSA-N 1 2 227.311 2.381 20 0 BEADLO CC1(C)[NH2+][C@@H](C2CC2)N(c2ccccc2)C1=O ZINC000666182221 487748757 /nfs/dbraw/zinc/74/87/57/487748757.db2.gz NPAADICIFMDYCX-GFCCVEGCSA-N 1 2 230.311 2.138 20 0 BEADLO CCc1cc(N[C@H](CC)[C@H](O)C(C)C)nc[nH+]1 ZINC000665749168 487755039 /nfs/dbraw/zinc/75/50/39/487755039.db2.gz TXOXHPZCEPVNAM-DGCLKSJQSA-N 1 2 237.347 2.246 20 0 BEADLO CC[C@@H]1[C@@H](C)CCN1C(=O)CCCn1cc[nH+]c1 ZINC000681264603 487763690 /nfs/dbraw/zinc/76/36/90/487763690.db2.gz ZFRZRFPFEKDJCE-QWHCGFSZSA-N 1 2 249.358 2.310 20 0 BEADLO FC(F)(F)CN1CCC(n2cc[nH+]c2)CC1 ZINC000111243729 487772177 /nfs/dbraw/zinc/77/21/77/487772177.db2.gz FQPWNJXWRQDQIT-UHFFFAOYSA-N 1 2 233.237 2.082 20 0 BEADLO CCC(CC)CC(=O)Nc1cc[nH+]cc1N(C)C ZINC000681356014 487782896 /nfs/dbraw/zinc/78/28/96/487782896.db2.gz GIJZRRZJRNDEGB-UHFFFAOYSA-N 1 2 249.358 2.334 20 0 BEADLO CC(C)(C)CCNC(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000666308344 487783518 /nfs/dbraw/zinc/78/35/18/487783518.db2.gz QSYXKCLADIZEIP-SNVBAGLBSA-N 1 2 249.358 2.067 20 0 BEADLO CC(C)(C)CCNC(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000666308344 487783521 /nfs/dbraw/zinc/78/35/21/487783521.db2.gz QSYXKCLADIZEIP-SNVBAGLBSA-N 1 2 249.358 2.067 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1nc2ccccc2c(=O)[nH]1 ZINC000684208362 487792357 /nfs/dbraw/zinc/79/23/57/487792357.db2.gz LQLVTRZZGGDTCF-UWVGGRQHSA-N 1 2 243.310 2.318 20 0 BEADLO FC1(F)CC12CC[NH+](Cc1ncccn1)CC2 ZINC000649773495 487792512 /nfs/dbraw/zinc/79/25/12/487792512.db2.gz VLZUAKOWPOZFPZ-UHFFFAOYSA-N 1 2 239.269 2.098 20 0 BEADLO FC[C@@H]1C[N@H+](Cc2cc3ccccc3[nH]2)CCO1 ZINC000666399586 487798713 /nfs/dbraw/zinc/79/87/13/487798713.db2.gz KRACYMSNUZYDDR-CYBMUJFWSA-N 1 2 248.301 2.338 20 0 BEADLO FC[C@@H]1C[N@@H+](Cc2cc3ccccc3[nH]2)CCO1 ZINC000666399586 487798716 /nfs/dbraw/zinc/79/87/16/487798716.db2.gz KRACYMSNUZYDDR-CYBMUJFWSA-N 1 2 248.301 2.338 20 0 BEADLO Cc1ncccc1C[NH2+][C@H](C)C(F)F ZINC000389970104 487801891 /nfs/dbraw/zinc/80/18/91/487801891.db2.gz SUWNXZVEJIYRTM-MRVPVSSYSA-N 1 2 200.232 2.133 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnc(C3CC3)o2)C[C@H](C)O1 ZINC000628117634 487802453 /nfs/dbraw/zinc/80/24/53/487802453.db2.gz PTFILFBUNHUJGW-AOOOYVTPSA-N 1 2 236.315 2.161 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnc(C3CC3)o2)C[C@H](C)O1 ZINC000628117634 487802462 /nfs/dbraw/zinc/80/24/62/487802462.db2.gz PTFILFBUNHUJGW-AOOOYVTPSA-N 1 2 236.315 2.161 20 0 BEADLO COc1ccc(OC)c(-c2[nH+]ccn2C)c1 ZINC000041231033 487812685 /nfs/dbraw/zinc/81/26/85/487812685.db2.gz BVLWIOUJJYRJTD-UHFFFAOYSA-N 1 2 218.256 2.104 20 0 BEADLO CO[C@@H](C[NH2+][C@@H](C)c1cn[nH]c1C)CC(C)C ZINC000669424967 487814520 /nfs/dbraw/zinc/81/45/20/487814520.db2.gz JQLWPWXQDQXYPW-CMPLNLGQSA-N 1 2 239.363 2.430 20 0 BEADLO CO[C@H](C[NH2+][C@@H](C)c1cn[nH]c1C)CC(C)C ZINC000669424968 487814790 /nfs/dbraw/zinc/81/47/90/487814790.db2.gz JQLWPWXQDQXYPW-JQWIXIFHSA-N 1 2 239.363 2.430 20 0 BEADLO C[C@H]1C[C@@H](O)C[N@@H+]1Cc1ccc(F)c(F)c1F ZINC000668045228 487818872 /nfs/dbraw/zinc/81/88/72/487818872.db2.gz LNTYFJIKZSCVHU-IONNQARKSA-N 1 2 245.244 2.059 20 0 BEADLO C[C@H]1C[C@@H](O)C[N@H+]1Cc1ccc(F)c(F)c1F ZINC000668045228 487818877 /nfs/dbraw/zinc/81/88/77/487818877.db2.gz LNTYFJIKZSCVHU-IONNQARKSA-N 1 2 245.244 2.059 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1C[C@@H]2CCCC[C@@H]21 ZINC000666492940 487820257 /nfs/dbraw/zinc/82/02/57/487820257.db2.gz NKNAAXNSIKGQCB-AAEUAGOBSA-N 1 2 245.326 2.218 20 0 BEADLO CC[C@H](NC(=O)Nc1cc[nH+]c(C)c1)C1CC1 ZINC000666489874 487820358 /nfs/dbraw/zinc/82/03/58/487820358.db2.gz KXPBXDYEXDEUIZ-LBPRGKRZSA-N 1 2 233.315 2.122 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1c(C(F)(F)F)cnn1C ZINC000668089973 487833490 /nfs/dbraw/zinc/83/34/90/487833490.db2.gz COJKTWDVNCJMFN-OCAPTIKFSA-N 1 2 247.264 2.422 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1c(C(F)(F)F)cnn1C ZINC000668089973 487833497 /nfs/dbraw/zinc/83/34/97/487833497.db2.gz COJKTWDVNCJMFN-OCAPTIKFSA-N 1 2 247.264 2.422 20 0 BEADLO CCc1cc(N[C@H]2CCC[C@@H]2CCO)nc[nH+]1 ZINC000681674672 487838302 /nfs/dbraw/zinc/83/83/02/487838302.db2.gz CMXMFFCGTHUMJT-PWSUYJOCSA-N 1 2 235.331 2.002 20 0 BEADLO CC(C)C[N@@H+](Cc1cnsn1)C1CC1 ZINC000846769457 588286812 /nfs/dbraw/zinc/28/68/12/588286812.db2.gz LFZIDJGRUOUHRH-UHFFFAOYSA-N 1 2 211.334 2.159 20 0 BEADLO CC(C)C(C)(C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000668114232 487843585 /nfs/dbraw/zinc/84/35/85/487843585.db2.gz MARQBXWBLMNDKP-GHMZBOCLSA-N 1 2 249.358 2.074 20 0 BEADLO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1ccon1 ZINC000077247421 487845945 /nfs/dbraw/zinc/84/59/45/487845945.db2.gz NOEJMDGGYSYUTC-CYBMUJFWSA-N 1 2 231.299 2.350 20 0 BEADLO Cn1cccc1[C@H]1CCC[N@H+]1Cc1ccon1 ZINC000077247421 487845949 /nfs/dbraw/zinc/84/59/49/487845949.db2.gz NOEJMDGGYSYUTC-CYBMUJFWSA-N 1 2 231.299 2.350 20 0 BEADLO Cc1coc(C)c1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000558454617 322950322 /nfs/dbraw/zinc/95/03/22/322950322.db2.gz KGBPHAQNVBXZAJ-MRVPVSSYSA-N 1 2 233.271 2.111 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2[nH]nc3ccccc32)C[C@H](C)O1 ZINC000676463614 487852312 /nfs/dbraw/zinc/85/23/12/487852312.db2.gz XXDZXNAYMCCNPP-PHIMTYICSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1C[N@H+](Cc2[nH]nc3ccccc32)C[C@H](C)O1 ZINC000676463614 487852315 /nfs/dbraw/zinc/85/23/15/487852315.db2.gz XXDZXNAYMCCNPP-PHIMTYICSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2n[nH]c3ccccc32)C[C@H](C)O1 ZINC000676463614 487852319 /nfs/dbraw/zinc/85/23/19/487852319.db2.gz XXDZXNAYMCCNPP-PHIMTYICSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1C[N@H+](Cc2n[nH]c3ccccc32)C[C@H](C)O1 ZINC000676463614 487852324 /nfs/dbraw/zinc/85/23/24/487852324.db2.gz XXDZXNAYMCCNPP-PHIMTYICSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@H](CC(=O)N(C)C(C)(C)C)n1cc[nH+]c1 ZINC000569345437 322951622 /nfs/dbraw/zinc/95/16/22/322951622.db2.gz QVDGZLUAJNRTDL-SNVBAGLBSA-N 1 2 223.320 2.091 20 0 BEADLO CC(C)C1CN(C(=O)c2ccc3[nH+]ccn3c2)C1 ZINC000677117736 487869597 /nfs/dbraw/zinc/86/95/97/487869597.db2.gz IFKJSAXBJFGSJR-UHFFFAOYSA-N 1 2 243.310 2.062 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CC23CCC3)c(C)c[nH+]1 ZINC000676588130 487877324 /nfs/dbraw/zinc/87/73/24/487877324.db2.gz PPKBWEDDJKSHEE-NSHDSACASA-N 1 2 230.311 2.249 20 0 BEADLO CCC[C@@H](C)[N@H+](C)Cc1nnc(OC)s1 ZINC000929251417 646032428 /nfs/dbraw/zinc/03/24/28/646032428.db2.gz BRLYQIDKCHJSDI-MRVPVSSYSA-N 1 2 229.349 2.167 20 0 BEADLO CCC[C@@H](C)[N@@H+](C)Cc1nnc(OC)s1 ZINC000929251417 646032434 /nfs/dbraw/zinc/03/24/34/646032434.db2.gz BRLYQIDKCHJSDI-MRVPVSSYSA-N 1 2 229.349 2.167 20 0 BEADLO CC[C@H](C)[N@@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000682074499 487896064 /nfs/dbraw/zinc/89/60/64/487896064.db2.gz UVKBFJIDFLHOBS-YUMQZZPRSA-N 1 2 211.227 2.048 20 0 BEADLO CC[C@H](C)[N@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000682074499 487896071 /nfs/dbraw/zinc/89/60/71/487896071.db2.gz UVKBFJIDFLHOBS-YUMQZZPRSA-N 1 2 211.227 2.048 20 0 BEADLO OC[C@@]1(F)CC[N@H+](Cc2cscc2Cl)C1 ZINC000670273441 487896785 /nfs/dbraw/zinc/89/67/85/487896785.db2.gz VYKMEYNAMZNASX-SNVBAGLBSA-N 1 2 249.738 2.308 20 0 BEADLO OC[C@@]1(F)CC[N@@H+](Cc2cscc2Cl)C1 ZINC000670273441 487896787 /nfs/dbraw/zinc/89/67/87/487896787.db2.gz VYKMEYNAMZNASX-SNVBAGLBSA-N 1 2 249.738 2.308 20 0 BEADLO CC[C@@H](C)[N@@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000682074494 487898235 /nfs/dbraw/zinc/89/82/35/487898235.db2.gz UVKBFJIDFLHOBS-HTQZYQBOSA-N 1 2 211.227 2.048 20 0 BEADLO CC[C@@H](C)[N@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000682074494 487898236 /nfs/dbraw/zinc/89/82/36/487898236.db2.gz UVKBFJIDFLHOBS-HTQZYQBOSA-N 1 2 211.227 2.048 20 0 BEADLO COc1cnccc1[C@H](C)[NH2+]Cc1cc(C)no1 ZINC000682095463 487909710 /nfs/dbraw/zinc/90/97/10/487909710.db2.gz VOKHIPLSTXEQQX-JTQLQIEISA-N 1 2 247.298 2.237 20 0 BEADLO COc1ccc(N[C@H](C)c2nccnc2C)[nH+]c1 ZINC000682138981 487912962 /nfs/dbraw/zinc/91/29/62/487912962.db2.gz OUTBASQRMFDURG-SNVBAGLBSA-N 1 2 244.298 2.362 20 0 BEADLO CCC[C@@H](C)[N@H+](C)Cc1nnn(C(C)(C)C)n1 ZINC000653492121 487922884 /nfs/dbraw/zinc/92/28/84/487922884.db2.gz ZBLZBKKUVSPGRV-SNVBAGLBSA-N 1 2 239.367 2.049 20 0 BEADLO CCC[C@@H](C)[N@@H+](C)Cc1nnn(C(C)(C)C)n1 ZINC000653492121 487922891 /nfs/dbraw/zinc/92/28/91/487922891.db2.gz ZBLZBKKUVSPGRV-SNVBAGLBSA-N 1 2 239.367 2.049 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1ccc(OC)nn1 ZINC000669928455 487930380 /nfs/dbraw/zinc/93/03/80/487930380.db2.gz GJAVUWFDJVMYKF-UHFFFAOYSA-N 1 2 247.298 2.100 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1ccc(OC)nn1 ZINC000669928455 487930387 /nfs/dbraw/zinc/93/03/87/487930387.db2.gz GJAVUWFDJVMYKF-UHFFFAOYSA-N 1 2 247.298 2.100 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000667142214 487946212 /nfs/dbraw/zinc/94/62/12/487946212.db2.gz ORZSFVXGBCAYER-GARJFASQSA-N 1 2 249.358 2.065 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000667142214 487946215 /nfs/dbraw/zinc/94/62/15/487946215.db2.gz ORZSFVXGBCAYER-GARJFASQSA-N 1 2 249.358 2.065 20 0 BEADLO C[C@H](CC(=O)NC1CCCCC1)n1cc[nH+]c1 ZINC000551909293 322829293 /nfs/dbraw/zinc/82/92/93/322829293.db2.gz AMBYHCIKASPADZ-LLVKDONJSA-N 1 2 235.331 2.283 20 0 BEADLO C[C@@H](CC(=O)NC1(C2(C)CC2)CC1)n1cc[nH+]c1 ZINC000569367816 322964801 /nfs/dbraw/zinc/96/48/01/322964801.db2.gz PKYNCFDBIWFDDS-NSHDSACASA-N 1 2 247.342 2.283 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)Nc1ccccc1F ZINC000074727116 323002695 /nfs/dbraw/zinc/00/26/95/323002695.db2.gz VQGUGRYFKWQMOW-UHFFFAOYSA-N 1 2 233.246 2.120 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)Nc1ccccc1F ZINC000074727116 323002696 /nfs/dbraw/zinc/00/26/96/323002696.db2.gz VQGUGRYFKWQMOW-UHFFFAOYSA-N 1 2 233.246 2.120 20 0 BEADLO CCS[C@@H](C)c1noc(C[N@H+](C)CC)n1 ZINC000126277267 323003183 /nfs/dbraw/zinc/00/31/83/323003183.db2.gz NIZHCKPHEKHLBO-QMMMGPOBSA-N 1 2 229.349 2.335 20 0 BEADLO CCS[C@@H](C)c1noc(C[N@@H+](C)CC)n1 ZINC000126277267 323003184 /nfs/dbraw/zinc/00/31/84/323003184.db2.gz NIZHCKPHEKHLBO-QMMMGPOBSA-N 1 2 229.349 2.335 20 0 BEADLO CC[C@H]1CN(c2[nH+]ccc3ccccc32)C[C@@H]1O ZINC000400275867 323015770 /nfs/dbraw/zinc/01/57/70/323015770.db2.gz GFVDLPCYGQLQBD-FZMZJTMJSA-N 1 2 242.322 2.442 20 0 BEADLO CC[C@H]1CN(c2[nH+]ccc3ccccc32)C[C@H]1O ZINC000400275876 323015857 /nfs/dbraw/zinc/01/58/57/323015857.db2.gz GFVDLPCYGQLQBD-SMDDNHRTSA-N 1 2 242.322 2.442 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]21 ZINC000562513462 323022209 /nfs/dbraw/zinc/02/22/09/323022209.db2.gz KGTTULQFAXMBFE-VWYCJHECSA-N 1 2 246.310 2.465 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1NC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000562657566 323026727 /nfs/dbraw/zinc/02/67/27/323026727.db2.gz GHYUTOFXLWGZPR-YGRLFVJLSA-N 1 2 249.358 2.238 20 0 BEADLO COc1cccc2c1CC[C@H](Nc1c[nH]c[nH+]1)C2 ZINC000562913253 323033248 /nfs/dbraw/zinc/03/32/48/323033248.db2.gz HHNJTHGBXGCNTA-NSHDSACASA-N 1 2 243.310 2.388 20 0 BEADLO CC(C)c1ncc(C[NH2+]Cc2ncccn2)s1 ZINC000565242653 323037626 /nfs/dbraw/zinc/03/76/26/323037626.db2.gz GTEFAZBIRMWKMA-UHFFFAOYSA-N 1 2 248.355 2.346 20 0 BEADLO CCC(O)(CC)CNc1[nH+]cccc1OC ZINC000159597640 323040003 /nfs/dbraw/zinc/04/00/03/323040003.db2.gz RHLQQNFUGGLUPH-UHFFFAOYSA-N 1 2 224.304 2.053 20 0 BEADLO C[C@@H](CC(=O)N1[C@H](C)CC[C@@H]1C)n1cc[nH+]c1 ZINC000570048439 323048205 /nfs/dbraw/zinc/04/82/05/323048205.db2.gz VFUIDAWOLYTERJ-TUAOUCFPSA-N 1 2 235.331 2.234 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)[C@@H]1CC[C@@H](C)CC1 ZINC000570285015 323055204 /nfs/dbraw/zinc/05/52/04/323055204.db2.gz QNPXMZDEVKZZKG-AVGNSLFASA-N 1 2 249.358 2.214 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N[C@]1(C)CC=CCC1 ZINC000570460353 323060394 /nfs/dbraw/zinc/06/03/94/323060394.db2.gz SEHBLGVHILZSQL-SMDDNHRTSA-N 1 2 247.342 2.203 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N[C@]1(C)CC=CCC1 ZINC000570460353 323060395 /nfs/dbraw/zinc/06/03/95/323060395.db2.gz SEHBLGVHILZSQL-SMDDNHRTSA-N 1 2 247.342 2.203 20 0 BEADLO CCN(C(=O)[C@@H](C)Cc1c[nH+]c[nH]1)C1CCCC1 ZINC000570526484 323062185 /nfs/dbraw/zinc/06/21/85/323062185.db2.gz JICRJBJJQNUSLV-NSHDSACASA-N 1 2 249.358 2.379 20 0 BEADLO CCN(C(=O)[C@@H](C)Cc1c[nH]c[nH+]1)C1CCCC1 ZINC000570526484 323062186 /nfs/dbraw/zinc/06/21/86/323062186.db2.gz JICRJBJJQNUSLV-NSHDSACASA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H](NC(=O)C[C@@H]1CC[C@H](C)C1)c1[nH]cc[nH+]1 ZINC000570647992 323066072 /nfs/dbraw/zinc/06/60/72/323066072.db2.gz JUKXAQMYAXRLHX-HBNTYKKESA-N 1 2 235.331 2.413 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+]1CCOCC12CC2 ZINC000570742926 323069146 /nfs/dbraw/zinc/06/91/46/323069146.db2.gz KYTMTXGPARRPKR-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1cc(F)ccc1C[N@H+]1CCOCC12CC2 ZINC000570742926 323069147 /nfs/dbraw/zinc/06/91/47/323069147.db2.gz KYTMTXGPARRPKR-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO C[C@@H]1CCCC[C@H]1CC(=O)NCCc1[nH]cc[nH+]1 ZINC000531287290 323087042 /nfs/dbraw/zinc/08/70/42/323087042.db2.gz QIBSJHMMRAFJIO-NEPJUHHUSA-N 1 2 249.358 2.285 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1CC[C@@H](c2n[nH]c(C)n2)C1 ZINC000528529334 323096582 /nfs/dbraw/zinc/09/65/82/323096582.db2.gz ZUSAXQQZYUWKKN-SIUBYYJGSA-N 1 2 240.738 2.045 20 0 BEADLO C[C@H](CC(=O)NCc1cccs1)n1cc[nH+]c1 ZINC000563210316 323102077 /nfs/dbraw/zinc/10/20/77/323102077.db2.gz QBSZONFYPCMUFH-SNVBAGLBSA-N 1 2 249.339 2.212 20 0 BEADLO C[C@@H](CC(=O)N1CCCC1(C)C)n1cc[nH+]c1 ZINC000563215850 323102959 /nfs/dbraw/zinc/10/29/59/323102959.db2.gz CZAMKCZYCJXRTP-NSHDSACASA-N 1 2 235.331 2.235 20 0 BEADLO C[C@H](CC(=O)N(C)[C@@H](C)C1(C)CC1)n1cc[nH+]c1 ZINC000563216211 323103168 /nfs/dbraw/zinc/10/31/68/323103168.db2.gz GPEIEHRNEZAXGD-NEPJUHHUSA-N 1 2 249.358 2.481 20 0 BEADLO C1CC1c1nc(N2CC3(CC3)C2)c2c([nH+]1)CCC2 ZINC000571032640 323104067 /nfs/dbraw/zinc/10/40/67/323104067.db2.gz WTUJFPDQSBWBOM-UHFFFAOYSA-N 1 2 241.338 2.443 20 0 BEADLO C[C@H](CC(=O)N1CC2(C1)CCCC2)n1cc[nH+]c1 ZINC000563254992 323106923 /nfs/dbraw/zinc/10/69/23/323106923.db2.gz XUZSQFZZSRPZST-GFCCVEGCSA-N 1 2 247.342 2.237 20 0 BEADLO Cn1cnnc1C[N@@H+]1CCC[C@H]1c1ccsc1 ZINC000534079033 323113385 /nfs/dbraw/zinc/11/33/85/323113385.db2.gz DZUADIWNAKDMRP-NSHDSACASA-N 1 2 248.355 2.214 20 0 BEADLO Cn1cnnc1C[N@H+]1CCC[C@H]1c1ccsc1 ZINC000534079033 323113386 /nfs/dbraw/zinc/11/33/86/323113386.db2.gz DZUADIWNAKDMRP-NSHDSACASA-N 1 2 248.355 2.214 20 0 BEADLO Cc1occc1C(=O)Nc1cc(C)[nH+]cc1C ZINC000534299917 323115849 /nfs/dbraw/zinc/11/58/49/323115849.db2.gz LNJNXJWDDBECHL-UHFFFAOYSA-N 1 2 230.267 2.274 20 0 BEADLO Cc1cc(NC(=O)NC(C)(C)C)c(C)c[nH+]1 ZINC000534324745 323116655 /nfs/dbraw/zinc/11/66/55/323116655.db2.gz CDKYLLOGDLMYHV-UHFFFAOYSA-N 1 2 221.304 2.040 20 0 BEADLO CCC1(CNc2nc(C)[nH+]cc2C)CC1 ZINC000563428057 323124883 /nfs/dbraw/zinc/12/48/83/323124883.db2.gz VNDXWFMEHGYTOF-UHFFFAOYSA-N 1 2 205.305 2.117 20 0 BEADLO CCC1(CNC(=O)Cn2cc[nH+]c2)CCCCC1 ZINC000563489486 323127735 /nfs/dbraw/zinc/12/77/35/323127735.db2.gz WXDGTAYBGBPZJL-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO CC(C)[C@@H](C)[NH2+]Cc1[nH]ncc1Br ZINC000308147641 323131917 /nfs/dbraw/zinc/13/19/17/323131917.db2.gz MPOZEOPUMVHGCT-SSDOTTSWSA-N 1 2 246.152 2.306 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)CCC1CC1 ZINC000571225882 323138739 /nfs/dbraw/zinc/13/87/39/323138739.db2.gz DKVDMQVSIIYZAB-UHFFFAOYSA-N 1 2 205.305 2.330 20 0 BEADLO c1cnc2c(c1)C[N@@H+](CCOCC1CCC1)C2 ZINC000571397502 323143603 /nfs/dbraw/zinc/14/36/03/323143603.db2.gz YZDLOFOGBRWJPJ-UHFFFAOYSA-N 1 2 232.327 2.214 20 0 BEADLO c1cnc2c(c1)C[N@H+](CCOCC1CCC1)C2 ZINC000571397502 323143604 /nfs/dbraw/zinc/14/36/04/323143604.db2.gz YZDLOFOGBRWJPJ-UHFFFAOYSA-N 1 2 232.327 2.214 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CC[C@H](OC)C1 ZINC000300384762 323152780 /nfs/dbraw/zinc/15/27/80/323152780.db2.gz JPNLMNVCKQPZPL-UWVGGRQHSA-N 1 2 222.288 2.070 20 0 BEADLO COC(C)(C)CN(C)c1[nH+]c2ccccc2n1C ZINC000534976415 323162398 /nfs/dbraw/zinc/16/23/98/323162398.db2.gz ZAXDCXMYJCBTIG-UHFFFAOYSA-N 1 2 247.342 2.435 20 0 BEADLO Cc1cc(NC(=O)c2ccsc2)c(C)c[nH+]1 ZINC000535036208 323164144 /nfs/dbraw/zinc/16/41/44/323164144.db2.gz KAFOGZNQIMAFBU-UHFFFAOYSA-N 1 2 232.308 2.434 20 0 BEADLO CC(C)[N@H+](Cc1ccn(C)n1)Cc1ccccn1 ZINC000535083131 323165836 /nfs/dbraw/zinc/16/58/36/323165836.db2.gz OFUNRCRZWKXGJE-UHFFFAOYSA-N 1 2 244.342 2.226 20 0 BEADLO CC(C)[N@@H+](Cc1ccn(C)n1)Cc1ccccn1 ZINC000535083131 323165837 /nfs/dbraw/zinc/16/58/37/323165837.db2.gz OFUNRCRZWKXGJE-UHFFFAOYSA-N 1 2 244.342 2.226 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)/C=C/C1CCOCC1 ZINC000112197247 323166581 /nfs/dbraw/zinc/16/65/81/323166581.db2.gz PTZSFVUKDGIQJB-NSCUHMNNSA-N 1 2 246.310 2.311 20 0 BEADLO CC[C@]1(C)C[C@@H]1C(=O)NCCCCn1cc[nH+]c1 ZINC000532069486 323171371 /nfs/dbraw/zinc/17/13/71/323171371.db2.gz HJQXOIXYHDGMLF-TZMCWYRMSA-N 1 2 249.358 2.216 20 0 BEADLO CC(C)c1nc(N(C)[C@H]2CCCOC2)cc[nH+]1 ZINC000343265355 323174249 /nfs/dbraw/zinc/17/42/49/323174249.db2.gz BWRJWDLZNLLXCQ-NSHDSACASA-N 1 2 235.331 2.215 20 0 BEADLO COc1ccc[nH+]c1NCCOC(C)(C)C ZINC000308536025 323175119 /nfs/dbraw/zinc/17/51/19/323175119.db2.gz ZEXDCFOWJJGRDP-UHFFFAOYSA-N 1 2 224.304 2.317 20 0 BEADLO CC[C@@H](F)C[N@H+](C)Cc1cnn(CC)c1 ZINC000563775938 323177395 /nfs/dbraw/zinc/17/73/95/323177395.db2.gz ZMJOVEYAVNWMGG-LLVKDONJSA-N 1 2 213.300 2.083 20 0 BEADLO CC[C@@H](F)C[N@@H+](C)Cc1cnn(CC)c1 ZINC000563775938 323177396 /nfs/dbraw/zinc/17/73/96/323177396.db2.gz ZMJOVEYAVNWMGG-LLVKDONJSA-N 1 2 213.300 2.083 20 0 BEADLO CC[C@@H]1CC[C@@H](C(=O)Nc2cc(C)[nH+]cc2C)O1 ZINC000536574376 323197961 /nfs/dbraw/zinc/19/79/61/323197961.db2.gz SCFYAGFISHQQGB-YPMHNXCESA-N 1 2 248.326 2.016 20 0 BEADLO Cc1ccc(N[C@H](C)c2ccncn2)c[nH+]1 ZINC000395915228 323263117 /nfs/dbraw/zinc/26/31/17/323263117.db2.gz MJNRKYPQIRNBLY-SNVBAGLBSA-N 1 2 214.272 2.353 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cnccc2C)n(C)n1 ZINC000418049400 323347320 /nfs/dbraw/zinc/34/73/20/323347320.db2.gz UCKHACBARAUITB-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cnccc2C)n(C)n1 ZINC000418049400 323347326 /nfs/dbraw/zinc/34/73/26/323347326.db2.gz UCKHACBARAUITB-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO CC(C)c1nc(N2[C@@H](C)C[C@@H]2C)nc(N(C)C)[nH+]1 ZINC000530379576 323383701 /nfs/dbraw/zinc/38/37/01/323383701.db2.gz HTTVFHVPEWXUQU-UWVGGRQHSA-N 1 2 249.362 2.048 20 0 BEADLO CO[C@H]1CCN(c2nc(C)[nH+]cc2C)CC1(C)C ZINC000567290474 323418792 /nfs/dbraw/zinc/41/87/92/323418792.db2.gz GPUXZEQRRPCYGE-LBPRGKRZSA-N 1 2 249.358 2.345 20 0 BEADLO C[C@@H](CC(=O)N[C@@H]1C=CCCC1)n1cc[nH+]c1 ZINC000571686604 323458260 /nfs/dbraw/zinc/45/82/60/323458260.db2.gz DIEGKNMUTBBXRZ-NWDGAFQWSA-N 1 2 233.315 2.059 20 0 BEADLO CCO[C@H]1C[C@H]1Nc1nc(C)[nH+]c2c1CCCC2 ZINC000571982891 323516349 /nfs/dbraw/zinc/51/63/49/323516349.db2.gz GRXVNLVIIICRLB-OLZOCXBDSA-N 1 2 247.342 2.253 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CCC[C@H]2OCC[C@@H]21 ZINC000527925597 323731896 /nfs/dbraw/zinc/73/18/96/323731896.db2.gz MOTCGLSXOGRHOH-IJLUTSLNSA-N 1 2 248.326 2.460 20 0 BEADLO COc1ccc[nH+]c1N1CCC=C(C)C1 ZINC000527997051 323733586 /nfs/dbraw/zinc/73/35/86/323733586.db2.gz SWLSMILUPMIXRD-UHFFFAOYSA-N 1 2 204.273 2.247 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)Cc1ccc(C)o1 ZINC000533130552 323853731 /nfs/dbraw/zinc/85/37/31/323853731.db2.gz IZIPVGALMHTXLW-UHFFFAOYSA-N 1 2 244.294 2.149 20 0 BEADLO C[C@H](c1ccncc1)[N@H+](C)Cc1ccno1 ZINC000537677200 324095639 /nfs/dbraw/zinc/09/56/39/324095639.db2.gz CEXLTJVHFSPFDN-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1ccno1 ZINC000537677200 324095641 /nfs/dbraw/zinc/09/56/41/324095641.db2.gz CEXLTJVHFSPFDN-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO COC1C[NH+](Cc2ccc(SC)s2)C1 ZINC000459575816 324148826 /nfs/dbraw/zinc/14/88/26/324148826.db2.gz FJKNMPYHRHFXEI-UHFFFAOYSA-N 1 2 229.370 2.301 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)c1cocc1C ZINC000529457993 324304835 /nfs/dbraw/zinc/30/48/35/324304835.db2.gz MYYIKORVYNEUDO-SNVBAGLBSA-N 1 2 247.298 2.295 20 0 BEADLO C[C@@H]1[C@@H](C(=O)NC(C)(C)c2[nH]cc[nH+]2)[C@H]1C1CC1 ZINC000529461382 324305782 /nfs/dbraw/zinc/30/57/82/324305782.db2.gz ZHGGDJKMILCJJT-JMJZKYOTSA-N 1 2 247.342 2.053 20 0 BEADLO CCc1noc(C)c1C[NH2+]Cc1ccc(F)cn1 ZINC000529582600 324351494 /nfs/dbraw/zinc/35/14/94/324351494.db2.gz BCDOQWCTGVKBTA-UHFFFAOYSA-N 1 2 249.289 2.369 20 0 BEADLO CCC(C)(C)OC1C[NH+](Cc2c[nH]nc2C)C1 ZINC000529643265 324367041 /nfs/dbraw/zinc/36/70/41/324367041.db2.gz WVTGDWVYGTZPFQ-UHFFFAOYSA-N 1 2 237.347 2.108 20 0 BEADLO CCC(C)(C)OC1C[NH+](CC2(F)CC2)C1 ZINC000529639397 324368869 /nfs/dbraw/zinc/36/88/69/324368869.db2.gz CNHIFSDNYSNPPH-UHFFFAOYSA-N 1 2 215.312 2.378 20 0 BEADLO COc1cccc(C[NH2+][C@@H](C)c2nnc(C)o2)c1 ZINC000542616393 325037323 /nfs/dbraw/zinc/03/73/23/325037323.db2.gz XOEOFWICPNFUKR-VIFPVBQESA-N 1 2 247.298 2.237 20 0 BEADLO C[C@H]([NH2+]Cc1ccc2[nH]cnc2c1)c1ccon1 ZINC000542708522 325043092 /nfs/dbraw/zinc/04/30/92/325043092.db2.gz BVJUQGDAZOOJLY-VIFPVBQESA-N 1 2 242.282 2.402 20 0 BEADLO C[C@H]([NH2+]Cc1ccc2nc[nH]c2c1)c1ccon1 ZINC000542708522 325043094 /nfs/dbraw/zinc/04/30/94/325043094.db2.gz BVJUQGDAZOOJLY-VIFPVBQESA-N 1 2 242.282 2.402 20 0 BEADLO c1c[nH+]c(CNc2cnc3c(c2)CCCC3)[nH]1 ZINC000542923302 325063767 /nfs/dbraw/zinc/06/37/67/325063767.db2.gz CXQIDDQPGIWZNF-UHFFFAOYSA-N 1 2 228.299 2.296 20 0 BEADLO CCc1cc(N2C3CCC2CC3)nc(C)[nH+]1 ZINC000542949675 325064838 /nfs/dbraw/zinc/06/48/38/325064838.db2.gz OAGONALUCFCMCL-UHFFFAOYSA-N 1 2 217.316 2.479 20 0 BEADLO c1snnc1CNc1c[nH+]c2c(c1)CCCC2 ZINC000543113749 325072402 /nfs/dbraw/zinc/07/24/02/325072402.db2.gz OJRZPWOKPIIAHA-UHFFFAOYSA-N 1 2 246.339 2.424 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](CO)c2ccccc2C)o1 ZINC000543838497 325116479 /nfs/dbraw/zinc/11/64/79/325116479.db2.gz ISWQLRSTCIDYGV-ZDUSSCGKSA-N 1 2 246.310 2.115 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2c(C)noc2C)CCO1 ZINC000131595780 325167480 /nfs/dbraw/zinc/16/74/80/325167480.db2.gz LGFGQQBSPCODIE-LBPRGKRZSA-N 1 2 238.331 2.292 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2c(C)noc2C)CCO1 ZINC000131595780 325167483 /nfs/dbraw/zinc/16/74/83/325167483.db2.gz LGFGQQBSPCODIE-LBPRGKRZSA-N 1 2 238.331 2.292 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1C[C@@H](OC)C1(C)C ZINC000234886707 325240887 /nfs/dbraw/zinc/24/08/87/325240887.db2.gz DQVAFXRGJBCMLV-WDEREUQCSA-N 1 2 236.315 2.316 20 0 BEADLO CC[N@H+](Cc1nc([C@@H]2C[C@H]2C)no1)C1CC1 ZINC000546481363 325283822 /nfs/dbraw/zinc/28/38/22/325283822.db2.gz NRYISPIAOJGLPG-PSASIEDQSA-N 1 2 221.304 2.177 20 0 BEADLO CC[N@@H+](Cc1nc([C@@H]2C[C@H]2C)no1)C1CC1 ZINC000546481363 325283824 /nfs/dbraw/zinc/28/38/24/325283824.db2.gz NRYISPIAOJGLPG-PSASIEDQSA-N 1 2 221.304 2.177 20 0 BEADLO CC[N@H+](Cc1nc([C@@H]2C[C@@H]2C)no1)C1CC1 ZINC000546481365 325283863 /nfs/dbraw/zinc/28/38/63/325283863.db2.gz NRYISPIAOJGLPG-WCBMZHEXSA-N 1 2 221.304 2.177 20 0 BEADLO CC[N@@H+](Cc1nc([C@@H]2C[C@@H]2C)no1)C1CC1 ZINC000546481365 325283867 /nfs/dbraw/zinc/28/38/67/325283867.db2.gz NRYISPIAOJGLPG-WCBMZHEXSA-N 1 2 221.304 2.177 20 0 BEADLO C/C(=C/c1nc(Cc2c[nH+]cn2C)no1)C1CC1 ZINC000546552492 325287030 /nfs/dbraw/zinc/28/70/30/325287030.db2.gz CTHAZLDHNIDBNF-UITAMQMPSA-N 1 2 244.298 2.207 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccncc2Cl)C[C@H](C)O1 ZINC000075589655 325301476 /nfs/dbraw/zinc/30/14/76/325301476.db2.gz LLKPVPQTCNVNCD-AOOOYVTPSA-N 1 2 240.734 2.344 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccncc2Cl)C[C@H](C)O1 ZINC000075589655 325301479 /nfs/dbraw/zinc/30/14/79/325301479.db2.gz LLKPVPQTCNVNCD-AOOOYVTPSA-N 1 2 240.734 2.344 20 0 BEADLO C[N@H+](Cc1noc(C(C)(C)C)n1)C1CCC1 ZINC000075840818 325314800 /nfs/dbraw/zinc/31/48/00/325314800.db2.gz VBGCYBKUJSSTED-UHFFFAOYSA-N 1 2 223.320 2.351 20 0 BEADLO C[N@@H+](Cc1noc(C(C)(C)C)n1)C1CCC1 ZINC000075840818 325314803 /nfs/dbraw/zinc/31/48/03/325314803.db2.gz VBGCYBKUJSSTED-UHFFFAOYSA-N 1 2 223.320 2.351 20 0 BEADLO CCCc1nc(C[N@@H+]2CCC(C)(C)C2)no1 ZINC000076013406 325325363 /nfs/dbraw/zinc/32/53/63/325325363.db2.gz KVITZKDSIBIXKJ-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO CCCc1nc(C[N@H+]2CCC(C)(C)C2)no1 ZINC000076013406 325325365 /nfs/dbraw/zinc/32/53/65/325325365.db2.gz KVITZKDSIBIXKJ-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO Cc1nnc(C[NH2+][C@H](C)c2cncc(C)c2)s1 ZINC000547354268 325346991 /nfs/dbraw/zinc/34/69/91/325346991.db2.gz SDJBKYMDGOIDNO-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+]C(C)(C)c2cnn(C)c2)o1 ZINC000547412748 325351858 /nfs/dbraw/zinc/35/18/58/325351858.db2.gz DCCLPQLNDPQQFP-SNVBAGLBSA-N 1 2 248.330 2.302 20 0 BEADLO C[C@@H]1CCC[C@@H]1CC(=O)N1CC(n2cc[nH+]c2)C1 ZINC000547424662 325353103 /nfs/dbraw/zinc/35/31/03/325353103.db2.gz IRLLPFAYHVIYFN-VXGBXAGGSA-N 1 2 247.342 2.093 20 0 BEADLO Cc1c[nH+]cc(N[C@H](C)[C@H]2CCOC2)c1 ZINC000134342706 325354411 /nfs/dbraw/zinc/35/44/11/325354411.db2.gz IXYGSTPDKSFWPZ-MNOVXSKESA-N 1 2 206.289 2.227 20 0 BEADLO C[C@@H]1C[C@H](C)N1Cc1[nH+]ccn1CC(F)(F)F ZINC000547769990 325395070 /nfs/dbraw/zinc/39/50/70/325395070.db2.gz NVNUCEFIMPYPPC-DTORHVGOSA-N 1 2 247.264 2.428 20 0 BEADLO CC(=O)CSCc1cn2cc(C)ccc2[nH+]1 ZINC000081273760 325495157 /nfs/dbraw/zinc/49/51/57/325495157.db2.gz ZSXYFLQVMQFYJF-UHFFFAOYSA-N 1 2 234.324 2.465 20 0 BEADLO CC(C)C(C)(C)NC(=O)c1ccc2[nH+]ccn2c1 ZINC000551893019 325573091 /nfs/dbraw/zinc/57/30/91/325573091.db2.gz KHDABIUDVAMZCO-UHFFFAOYSA-N 1 2 245.326 2.499 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1NC(=O)Cc1c[nH+]cn1C ZINC000554501154 325722639 /nfs/dbraw/zinc/72/26/39/325722639.db2.gz IPOVUQVFRKQMQL-YPMHNXCESA-N 1 2 249.358 2.048 20 0 BEADLO c1cc(N2CCC3(CCO3)CC2)nc(C2CC2)[nH+]1 ZINC000554519498 325724389 /nfs/dbraw/zinc/72/43/89/325724389.db2.gz ZEORHXZGWBZNRZ-UHFFFAOYSA-N 1 2 245.326 2.113 20 0 BEADLO CCC[C@@H]1CCCCN1C(=O)Cc1c[nH+]cn1C ZINC000554597965 325730281 /nfs/dbraw/zinc/73/02/81/325730281.db2.gz CAYDUARRCRJBQB-GFCCVEGCSA-N 1 2 249.358 2.144 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1C[C@H]1C1CCC1 ZINC000564661065 325802088 /nfs/dbraw/zinc/80/20/88/325802088.db2.gz OZKJFZPZNQXQBT-QWHCGFSZSA-N 1 2 244.338 2.441 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2[C@@H]3CCC[C@@H]32)c(C)c[nH+]1 ZINC000565474138 325915105 /nfs/dbraw/zinc/91/51/05/325915105.db2.gz DPXOOAGVURNWEW-PTEHBNRSSA-N 1 2 245.326 2.040 20 0 BEADLO Cc1ccc(NC(=O)N[C@@H]2CC23CC3)c(C)[nH+]1 ZINC000566143646 326002607 /nfs/dbraw/zinc/00/26/07/326002607.db2.gz HWVHFXTZBJGPMV-LLVKDONJSA-N 1 2 231.299 2.372 20 0 BEADLO CCC1(CNC(=O)C[C@@H](C)n2cc[nH+]c2)CC1 ZINC000566303648 326031228 /nfs/dbraw/zinc/03/12/28/326031228.db2.gz FVESGKPZINVLTK-LLVKDONJSA-N 1 2 235.331 2.141 20 0 BEADLO C[C@H](C(=O)Nc1ccccc1F)[NH+]1CC(C)C1 ZINC000566431080 326046327 /nfs/dbraw/zinc/04/63/27/326046327.db2.gz DUUMOAWGBZQTPX-SNVBAGLBSA-N 1 2 236.290 2.104 20 0 BEADLO CCN(C(=O)Cc1[nH]c[nH+]c1C)[C@H](C)C(C)C ZINC000566453476 326050180 /nfs/dbraw/zinc/05/01/80/326050180.db2.gz YEYKMVRCUGCPSD-LLVKDONJSA-N 1 2 237.347 2.154 20 0 BEADLO CC1=C[C@@H](C)CN(C(=O)[C@@H](C)Cc2c[nH+]c[nH]2)C1 ZINC000566457462 326050620 /nfs/dbraw/zinc/05/06/20/326050620.db2.gz JGNAJGKHFDHAMI-PWSUYJOCSA-N 1 2 247.342 2.013 20 0 BEADLO CC1=C[C@@H](C)CN(C(=O)[C@@H](C)Cc2c[nH]c[nH+]2)C1 ZINC000566457462 326050624 /nfs/dbraw/zinc/05/06/24/326050624.db2.gz JGNAJGKHFDHAMI-PWSUYJOCSA-N 1 2 247.342 2.013 20 0 BEADLO CC[C@]1(C)CCN(C(=O)C[C@H](C)n2cc[nH+]c2)C1 ZINC000566623214 326069286 /nfs/dbraw/zinc/06/92/86/326069286.db2.gz BKMRSAPRCMNVRB-GXTWGEPZSA-N 1 2 249.358 2.483 20 0 BEADLO O=C(Cn1cc[nH+]c1)NCCC1=CCCCCC1 ZINC000567094047 326114494 /nfs/dbraw/zinc/11/44/94/326114494.db2.gz IPMUNTCLAIXWNS-UHFFFAOYSA-N 1 2 247.342 2.280 20 0 BEADLO CCC[N@H+](Cc1nc(C2CC2)nn1C)C1CC1 ZINC000567264741 326152916 /nfs/dbraw/zinc/15/29/16/326152916.db2.gz LDDKCQVXDSHDKS-UHFFFAOYSA-N 1 2 234.347 2.067 20 0 BEADLO CCC[N@@H+](Cc1nc(C2CC2)nn1C)C1CC1 ZINC000567264741 326152918 /nfs/dbraw/zinc/15/29/18/326152918.db2.gz LDDKCQVXDSHDKS-UHFFFAOYSA-N 1 2 234.347 2.067 20 0 BEADLO C[C@@H]1CCCC[C@@H]1CC(=O)NCc1c[nH+]cn1C ZINC000567287325 326156198 /nfs/dbraw/zinc/15/61/98/326156198.db2.gz VDBPVYCRHWYALA-VXGBXAGGSA-N 1 2 249.358 2.253 20 0 BEADLO C[C@H]1CCCC[C@@H]1CC(=O)NCc1c[nH+]cn1C ZINC000567287323 326156124 /nfs/dbraw/zinc/15/61/24/326156124.db2.gz VDBPVYCRHWYALA-NWDGAFQWSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCc1ccsc1 ZINC000567291223 326156804 /nfs/dbraw/zinc/15/68/04/326156804.db2.gz UPKHPMTUWLRISC-UHFFFAOYSA-N 1 2 233.340 2.231 20 0 BEADLO CCC[N@H+](Cc1noc(CC)n1)C(C)C ZINC000567364813 326175142 /nfs/dbraw/zinc/17/51/42/326175142.db2.gz VKELBVWWWBGGEG-UHFFFAOYSA-N 1 2 211.309 2.252 20 0 BEADLO CCC[N@@H+](Cc1noc(CC)n1)C(C)C ZINC000567364813 326175146 /nfs/dbraw/zinc/17/51/46/326175146.db2.gz VKELBVWWWBGGEG-UHFFFAOYSA-N 1 2 211.309 2.252 20 0 BEADLO CC[C@]1(C)C[C@H]1C(=O)N(C)CCCn1cc[nH+]c1 ZINC000154960976 326175176 /nfs/dbraw/zinc/17/51/76/326175176.db2.gz FONIDXSMKOLSNA-GXTWGEPZSA-N 1 2 249.358 2.168 20 0 BEADLO CCCC[C@@H]([NH2+]C1(C2CC2)CC1)C(=O)OC ZINC000310020469 326179736 /nfs/dbraw/zinc/17/97/36/326179736.db2.gz NAXKIQWNTKEBGK-LLVKDONJSA-N 1 2 225.332 2.250 20 0 BEADLO CC[C@](C)(NCCn1cc[nH+]c1)C(F)(F)F ZINC000310024992 326179967 /nfs/dbraw/zinc/17/99/67/326179967.db2.gz OTMIVJKKSJMAKE-VIFPVBQESA-N 1 2 235.253 2.204 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC1(C)CCCC1 ZINC000567403723 326184560 /nfs/dbraw/zinc/18/45/60/326184560.db2.gz RFCYEEPJLSTSFD-SNVBAGLBSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC1(C)CCCC1 ZINC000567403723 326184562 /nfs/dbraw/zinc/18/45/62/326184562.db2.gz RFCYEEPJLSTSFD-SNVBAGLBSA-N 1 2 235.331 2.037 20 0 BEADLO Cn1c[nH+]cc1CNc1ccc2c(c1)COC2 ZINC000155556577 326200520 /nfs/dbraw/zinc/20/05/20/326200520.db2.gz QAJDVIBXVHPCDD-UHFFFAOYSA-N 1 2 229.283 2.062 20 0 BEADLO Cc1cc(F)c(C[NH2+]Cc2cc[nH]n2)c(F)c1 ZINC000567660962 326239320 /nfs/dbraw/zinc/23/93/20/326239320.db2.gz MWHAPWJBNJIAIG-UHFFFAOYSA-N 1 2 237.253 2.286 20 0 BEADLO CC[C@H](NC(=O)Cn1cc[nH+]c1)c1ccccc1 ZINC000567863738 326272907 /nfs/dbraw/zinc/27/29/07/326272907.db2.gz DHBGCTBNYWQPBE-ZDUSSCGKSA-N 1 2 243.310 2.151 20 0 BEADLO CCC(C)(C)N(C)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000567993089 326293211 /nfs/dbraw/zinc/29/32/11/326293211.db2.gz FKNCMZIHRHOTRE-LLVKDONJSA-N 1 2 237.347 2.481 20 0 BEADLO CCc1coc(NC(=O)C[C@@H](C)n2cc[nH+]c2)n1 ZINC000568174344 326320034 /nfs/dbraw/zinc/32/00/34/326320034.db2.gz VVDYANFQKCZXPT-SECBINFHSA-N 1 2 248.286 2.023 20 0 BEADLO CCC1(CC)CN(C(=O)[C@@H](C)Cc2c[nH+]c[nH]2)C1 ZINC000568213765 326327148 /nfs/dbraw/zinc/32/71/48/326327148.db2.gz HHVYJNIMEKKZAJ-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO CCC1(CC)CN(C(=O)[C@@H](C)Cc2c[nH]c[nH+]2)C1 ZINC000568213765 326327150 /nfs/dbraw/zinc/32/71/50/326327150.db2.gz HHVYJNIMEKKZAJ-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO CC(C)C1(CNC(=O)C[C@H](C)n2cc[nH+]c2)CC1 ZINC000568516490 326362223 /nfs/dbraw/zinc/36/22/23/326362223.db2.gz CTCBFXNRVWAURJ-LBPRGKRZSA-N 1 2 249.358 2.387 20 0 BEADLO CC(C)OC(=O)c1cccc(Cn2cc[nH+]c2)c1 ZINC000568717765 326373476 /nfs/dbraw/zinc/37/34/76/326373476.db2.gz JTDUJJVSCBZCHG-UHFFFAOYSA-N 1 2 244.294 2.497 20 0 BEADLO Cc1cccc(N(C)C(=O)C[NH+]2CC(C)(C)C2)c1 ZINC000568765150 326376206 /nfs/dbraw/zinc/37/62/06/326376206.db2.gz SWISBFVVCBCHSC-UHFFFAOYSA-N 1 2 246.354 2.300 20 0 BEADLO c1[nH]cc(N[C@@H]2CCC[C@@H]([C@@H]3CCOC3)C2)[nH+]1 ZINC000569161462 326393095 /nfs/dbraw/zinc/39/30/95/326393095.db2.gz AGVDQWDLXUNRDE-IJLUTSLNSA-N 1 2 235.331 2.417 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CCCSC1 ZINC000164002614 326408384 /nfs/dbraw/zinc/40/83/84/326408384.db2.gz CYKKBVAVAZVFFJ-VIFPVBQESA-N 1 2 224.329 2.398 20 0 BEADLO CC/C=C\CC[N@@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000682546803 487984695 /nfs/dbraw/zinc/98/46/95/487984695.db2.gz OFSYFNGKIXIPTJ-XOULXFPDSA-N 1 2 219.275 2.045 20 0 BEADLO CC/C=C\CC[N@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000682546803 487984699 /nfs/dbraw/zinc/98/46/99/487984699.db2.gz OFSYFNGKIXIPTJ-XOULXFPDSA-N 1 2 219.275 2.045 20 0 BEADLO CCc1cc(N[C@H]2COC(C)(C)C2)nc[nH+]1 ZINC000396650217 487992624 /nfs/dbraw/zinc/99/26/24/487992624.db2.gz KUBIIHTUNAGWDE-SNVBAGLBSA-N 1 2 221.304 2.018 20 0 BEADLO CC(C)(CC(F)(F)F)C(=O)NCc1[nH]cc[nH+]1 ZINC000668603371 487996158 /nfs/dbraw/zinc/99/61/58/487996158.db2.gz DGWPOMABOAAWPW-UHFFFAOYSA-N 1 2 249.236 2.005 20 0 BEADLO CCC[C@@H](CC)NC(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000667423584 488001020 /nfs/dbraw/zinc/00/10/20/488001020.db2.gz QHIMPFSONRYPBS-GHMZBOCLSA-N 1 2 249.358 2.210 20 0 BEADLO CCC[C@@H](CC)NC(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000667423584 488001028 /nfs/dbraw/zinc/00/10/28/488001028.db2.gz QHIMPFSONRYPBS-GHMZBOCLSA-N 1 2 249.358 2.210 20 0 BEADLO C[C@H](c1nnnn1C1CCCCC1)[NH+]1CCCC1 ZINC000188664782 488001595 /nfs/dbraw/zinc/00/15/95/488001595.db2.gz WPOSZJLKRJLJJE-LLVKDONJSA-N 1 2 249.362 2.335 20 0 BEADLO CC(C)c1cnc(C[N@@H+]2CCC[C@@H](O)C2)s1 ZINC000134871744 488003176 /nfs/dbraw/zinc/00/31/76/488003176.db2.gz XYZCYUKEONNTSK-SNVBAGLBSA-N 1 2 240.372 2.223 20 0 BEADLO CC(C)c1cnc(C[N@H+]2CCC[C@@H](O)C2)s1 ZINC000134871744 488003179 /nfs/dbraw/zinc/00/31/79/488003179.db2.gz XYZCYUKEONNTSK-SNVBAGLBSA-N 1 2 240.372 2.223 20 0 BEADLO CCc1cc(N[C@@H](CC)[C@@H]2CCCO2)nc[nH+]1 ZINC000677308978 488012971 /nfs/dbraw/zinc/01/29/71/488012971.db2.gz YIHUDPDPAJIECC-RYUDHWBXSA-N 1 2 235.331 2.409 20 0 BEADLO Cc1[nH+]cc(CN(C)Cc2ccccc2)n1C ZINC000667461870 488013779 /nfs/dbraw/zinc/01/37/79/488013779.db2.gz QBWDMJOSFRGTIO-UHFFFAOYSA-N 1 2 229.327 2.361 20 0 BEADLO CCc1cc(N[C@H](CC)[C@@H]2CCCO2)nc[nH+]1 ZINC000677308976 488013785 /nfs/dbraw/zinc/01/37/85/488013785.db2.gz YIHUDPDPAJIECC-NEPJUHHUSA-N 1 2 235.331 2.409 20 0 BEADLO Cc1ccc(C[NH+]2CC(C)(O)C2)c(Cl)c1 ZINC000235868393 488026462 /nfs/dbraw/zinc/02/64/62/488026462.db2.gz CXDKQQDPQUGKKI-UHFFFAOYSA-N 1 2 225.719 2.215 20 0 BEADLO Cc1cc(NC(=O)[C@H](C)Cc2ccco2)cc[nH+]1 ZINC000668635671 488034776 /nfs/dbraw/zinc/03/47/76/488034776.db2.gz NIHUXDCUESKQKY-SNVBAGLBSA-N 1 2 244.294 2.222 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@H](F)C2)sc1C ZINC000334812415 488053274 /nfs/dbraw/zinc/05/32/74/488053274.db2.gz OVHQQGYQPSMNDK-SECBINFHSA-N 1 2 214.309 2.304 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@H](F)C2)sc1C ZINC000334812415 488053277 /nfs/dbraw/zinc/05/32/77/488053277.db2.gz OVHQQGYQPSMNDK-SECBINFHSA-N 1 2 214.309 2.304 20 0 BEADLO COc1ccc(NCc2cccc(OC)n2)[nH+]c1 ZINC000682854446 488054895 /nfs/dbraw/zinc/05/48/95/488054895.db2.gz UIHXAXSWFOJLPA-UHFFFAOYSA-N 1 2 245.282 2.106 20 0 BEADLO C[C@H]([NH2+][C@H]1CCCC1(F)F)c1ccc(=O)[nH]n1 ZINC000672620639 488061852 /nfs/dbraw/zinc/06/18/52/488061852.db2.gz OSPOBPCNSIRNEL-CBAPKCEASA-N 1 2 243.257 2.021 20 0 BEADLO CC[C@@H](NC(=O)[C@H]1CC=CCC1)c1[nH]cc[nH+]1 ZINC000140543335 488063662 /nfs/dbraw/zinc/06/36/62/488063662.db2.gz WTODVSICCOVMFP-WDEREUQCSA-N 1 2 233.315 2.333 20 0 BEADLO CCCC(C)(C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000667645176 488068152 /nfs/dbraw/zinc/06/81/52/488068152.db2.gz HFEDQVQYSQXASX-GHMZBOCLSA-N 1 2 249.358 2.219 20 0 BEADLO Cn1cc[nH+]c1-c1ccc2c(c1)OCCCC2=O ZINC000656369580 488082074 /nfs/dbraw/zinc/08/20/74/488082074.db2.gz DUSWIDDGVFJPJC-UHFFFAOYSA-N 1 2 242.278 2.442 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000667679349 488084450 /nfs/dbraw/zinc/08/44/50/488084450.db2.gz CCVKRACBRPJUKY-MXWKQRLJSA-N 1 2 246.310 2.465 20 0 BEADLO CC(C)C1(CNC(=O)CCCn2cc[nH+]c2)CC1 ZINC000674663176 488086799 /nfs/dbraw/zinc/08/67/99/488086799.db2.gz XTCUFRLRVVBWES-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@H](CC)C2)cn1 ZINC000347682571 488088431 /nfs/dbraw/zinc/08/84/31/488088431.db2.gz YMPGLWOUARJZAC-CQSZACIVSA-N 1 2 234.343 2.255 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@H](CC)C2)cn1 ZINC000347682571 488088433 /nfs/dbraw/zinc/08/84/33/488088433.db2.gz YMPGLWOUARJZAC-CQSZACIVSA-N 1 2 234.343 2.255 20 0 BEADLO Cn1ncc(C(F)(F)F)c1C[NH+]1CCCCC1 ZINC000667712680 488098349 /nfs/dbraw/zinc/09/83/49/488098349.db2.gz MQAFZHZYXMETFR-UHFFFAOYSA-N 1 2 247.264 2.425 20 0 BEADLO CCn1ccc(C[N@H+](C)[C@H](C)c2nnc(C)o2)c1 ZINC000683031303 488102385 /nfs/dbraw/zinc/10/23/85/488102385.db2.gz UNRNKXFIQHYRRI-SNVBAGLBSA-N 1 2 248.330 2.392 20 0 BEADLO CCn1ccc(C[N@@H+](C)[C@H](C)c2nnc(C)o2)c1 ZINC000683031303 488102388 /nfs/dbraw/zinc/10/23/88/488102388.db2.gz UNRNKXFIQHYRRI-SNVBAGLBSA-N 1 2 248.330 2.392 20 0 BEADLO CCc1nc(C[N@H+](C)C2(COC)CC2)cs1 ZINC000677728034 488105173 /nfs/dbraw/zinc/10/51/73/488105173.db2.gz NRPWALKUCANFTD-UHFFFAOYSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nc(C[N@@H+](C)C2(COC)CC2)cs1 ZINC000677728034 488105176 /nfs/dbraw/zinc/10/51/76/488105176.db2.gz NRPWALKUCANFTD-UHFFFAOYSA-N 1 2 240.372 2.316 20 0 BEADLO COCCC1(CNc2cc[nH+]cc2F)CCC1 ZINC000683070139 488105361 /nfs/dbraw/zinc/10/53/61/488105361.db2.gz XSMKQMBSXCYMRC-UHFFFAOYSA-N 1 2 238.306 2.261 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+]2CC[C@@H](C(F)F)C2)n1 ZINC000677729870 488107860 /nfs/dbraw/zinc/10/78/60/488107860.db2.gz DPTFOANNYXHVIB-HTRCEHHLSA-N 1 2 231.246 2.026 20 0 BEADLO Cc1noc([C@@H](C)[N@H+]2CC[C@@H](C(F)F)C2)n1 ZINC000677729870 488107866 /nfs/dbraw/zinc/10/78/66/488107866.db2.gz DPTFOANNYXHVIB-HTRCEHHLSA-N 1 2 231.246 2.026 20 0 BEADLO CC(C)c1noc(C[N@@H+]2CC[C@H](C(F)F)C2)n1 ZINC000677733115 488111151 /nfs/dbraw/zinc/11/11/51/488111151.db2.gz JWEVTVKCSHNYAZ-QMMMGPOBSA-N 1 2 245.273 2.280 20 0 BEADLO CC(C)c1noc(C[N@H+]2CC[C@H](C(F)F)C2)n1 ZINC000677733115 488111156 /nfs/dbraw/zinc/11/11/56/488111156.db2.gz JWEVTVKCSHNYAZ-QMMMGPOBSA-N 1 2 245.273 2.280 20 0 BEADLO CC[C@H](CC(C)C)C(=O)NCc1c[nH+]cn1C ZINC000451812927 488114875 /nfs/dbraw/zinc/11/48/75/488114875.db2.gz HVSGAEOWSOEGEG-LLVKDONJSA-N 1 2 237.347 2.109 20 0 BEADLO FC(F)[C@@H]1CC[N@H+](Cc2nnc(C3CC3)o2)C1 ZINC000677736583 488115749 /nfs/dbraw/zinc/11/57/49/488115749.db2.gz UGUGFADHASPTLL-MRVPVSSYSA-N 1 2 243.257 2.034 20 0 BEADLO FC(F)[C@@H]1CC[N@@H+](Cc2nnc(C3CC3)o2)C1 ZINC000677736583 488115755 /nfs/dbraw/zinc/11/57/55/488115755.db2.gz UGUGFADHASPTLL-MRVPVSSYSA-N 1 2 243.257 2.034 20 0 BEADLO CC1(C)CCC[C@@H]1NC(=O)CCCn1cc[nH+]c1 ZINC000674260172 487540730 /nfs/dbraw/zinc/54/07/30/487540730.db2.gz NHRFLXGWBIKIHC-LBPRGKRZSA-N 1 2 249.358 2.358 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2C[C@H]2C)c(C)[nH+]1 ZINC000119393336 487544480 /nfs/dbraw/zinc/54/44/80/487544480.db2.gz POWMDDFOMLIRAW-GMSGAONNSA-N 1 2 204.273 2.293 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)C1=CCC(C)(C)CC1 ZINC000334726158 487545653 /nfs/dbraw/zinc/54/56/53/487545653.db2.gz PVBYYTCKMHRZJL-UHFFFAOYSA-N 1 2 247.342 2.173 20 0 BEADLO COC[C@@H]1CCCN1C(=O)Nc1cc[nH+]c(C)c1 ZINC000119476721 487551149 /nfs/dbraw/zinc/55/11/49/487551149.db2.gz UKDDVQORGPETDN-LBPRGKRZSA-N 1 2 249.314 2.033 20 0 BEADLO CCc1nnc(C[N@H+]2CC=C(C)CC2)s1 ZINC000680071109 487532012 /nfs/dbraw/zinc/53/20/12/487532012.db2.gz WZYMPEAMBWZINC-UHFFFAOYSA-N 1 2 223.345 2.253 20 0 BEADLO CCc1nnc(C[N@@H+]2CC=C(C)CC2)s1 ZINC000680071109 487532015 /nfs/dbraw/zinc/53/20/15/487532015.db2.gz WZYMPEAMBWZINC-UHFFFAOYSA-N 1 2 223.345 2.253 20 0 BEADLO CCc1nnc(C[N@@H+]2CC[C@H](C(F)F)C2)s1 ZINC000680070794 487532292 /nfs/dbraw/zinc/53/22/92/487532292.db2.gz MKDYNONCWWARFC-ZETCQYMHSA-N 1 2 247.314 2.188 20 0 BEADLO CCc1nnc(C[N@H+]2CC[C@H](C(F)F)C2)s1 ZINC000680070794 487532295 /nfs/dbraw/zinc/53/22/95/487532295.db2.gz MKDYNONCWWARFC-ZETCQYMHSA-N 1 2 247.314 2.188 20 0 BEADLO C[C@@H]([NH2+]Cc1c[nH]cn1)c1ccsc1 ZINC000061361768 487472245 /nfs/dbraw/zinc/47/22/45/487472245.db2.gz XXDHFWCXZZKJBN-MRVPVSSYSA-N 1 2 207.302 2.322 20 0 BEADLO C[C@@H](C(=O)N1CCC[C@H](n2cc[nH+]c2)C1)C1CC1 ZINC000673906249 487474778 /nfs/dbraw/zinc/47/47/78/487474778.db2.gz MXDYREGQAIYNBZ-YPMHNXCESA-N 1 2 247.342 2.093 20 0 BEADLO C[C@@H]1CCCC[C@@H]1CC(=O)NCc1c[nH+]c[nH]1 ZINC000673934848 487484376 /nfs/dbraw/zinc/48/43/76/487484376.db2.gz JGOIPAPTSOEOMH-GHMZBOCLSA-N 1 2 235.331 2.242 20 0 BEADLO C[C@@H]1CCCC[C@@H]1CC(=O)NCc1c[nH]c[nH+]1 ZINC000673934848 487484379 /nfs/dbraw/zinc/48/43/79/487484379.db2.gz JGOIPAPTSOEOMH-GHMZBOCLSA-N 1 2 235.331 2.242 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](Cc1ncc[nH]1)CC2 ZINC000149037722 487484273 /nfs/dbraw/zinc/48/42/73/487484273.db2.gz XHFHGAFZICHBOG-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](Cc1ncc[nH]1)CC2 ZINC000149037722 487484276 /nfs/dbraw/zinc/48/42/76/487484276.db2.gz XHFHGAFZICHBOG-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO COc1cccc(C[NH2+]Cc2ccno2)c1F ZINC000231896328 487488049 /nfs/dbraw/zinc/48/80/49/487488049.db2.gz PSHMHNBOZDLHKF-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO c1nc(C[N@H+]2CC=CCC2)n(-c2ccccc2)n1 ZINC000685003297 487490553 /nfs/dbraw/zinc/49/05/53/487490553.db2.gz VTLHDGYCIKRYKD-UHFFFAOYSA-N 1 2 240.310 2.029 20 0 BEADLO c1nc(C[N@@H+]2CC=CCC2)n(-c2ccccc2)n1 ZINC000685003297 487490556 /nfs/dbraw/zinc/49/05/56/487490556.db2.gz VTLHDGYCIKRYKD-UHFFFAOYSA-N 1 2 240.310 2.029 20 0 BEADLO Cc1cc(C)n(Cc2ccc(C)[nH+]c2)n1 ZINC000405730519 487490703 /nfs/dbraw/zinc/49/07/03/487490703.db2.gz STOJDVWCTJIRPB-UHFFFAOYSA-N 1 2 201.273 2.252 20 0 BEADLO CCC1C[NH+](Cc2c(C(F)(F)F)cnn2C)C1 ZINC000668229655 487492846 /nfs/dbraw/zinc/49/28/46/487492846.db2.gz PGTDZXMVDRTJRV-UHFFFAOYSA-N 1 2 247.264 2.281 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+]2CCCc3occc3C2)n1 ZINC000685057823 487498655 /nfs/dbraw/zinc/49/86/55/487498655.db2.gz YPGSXJNKRNIRJW-SECBINFHSA-N 1 2 247.298 2.480 20 0 BEADLO Cc1noc([C@@H](C)[N@H+]2CCCc3occc3C2)n1 ZINC000685057823 487498658 /nfs/dbraw/zinc/49/86/58/487498658.db2.gz YPGSXJNKRNIRJW-SECBINFHSA-N 1 2 247.298 2.480 20 0 BEADLO Cc1nc(N[C@@H](C)C[C@@H](C)O)c2c([nH+]1)CCCC2 ZINC000679932675 487496009 /nfs/dbraw/zinc/49/60/09/487496009.db2.gz MMXOJPVPPGHGRX-VHSXEESVSA-N 1 2 249.358 2.235 20 0 BEADLO CCOC1(C)CN(Cc2[nH+]ccn2C(C)C)C1 ZINC000668232135 487500014 /nfs/dbraw/zinc/50/00/14/487500014.db2.gz FBBCNJNNLJNQSR-UHFFFAOYSA-N 1 2 237.347 2.075 20 0 BEADLO COC[C@H](C)CNc1cc[nH+]c(C(C)(C)C)n1 ZINC000674064095 487505190 /nfs/dbraw/zinc/50/51/90/487505190.db2.gz QRZRCDYWJMTMAA-SNVBAGLBSA-N 1 2 237.347 2.469 20 0 BEADLO Cn1cc[nH+]c1CNc1ccnc(C(C)(C)C)n1 ZINC000674065563 487507247 /nfs/dbraw/zinc/50/72/47/487507247.db2.gz NFULWOARFUNNAF-UHFFFAOYSA-N 1 2 245.330 2.120 20 0 BEADLO CCCN(CCC)C(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000220513959 487509561 /nfs/dbraw/zinc/50/95/61/487509561.db2.gz HBWWMOOBMJDQSZ-NSHDSACASA-N 1 2 249.358 2.163 20 0 BEADLO CCCN(CCC)C(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000220513959 487509566 /nfs/dbraw/zinc/50/95/66/487509566.db2.gz HBWWMOOBMJDQSZ-NSHDSACASA-N 1 2 249.358 2.163 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1cn(C(C)C)nn1 ZINC000685414773 487517261 /nfs/dbraw/zinc/51/72/61/487517261.db2.gz JRBOQZKSJFEEDV-UHFFFAOYSA-N 1 2 248.330 2.474 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1cn(C(C)C)nn1 ZINC000685414773 487517266 /nfs/dbraw/zinc/51/72/66/487517266.db2.gz JRBOQZKSJFEEDV-UHFFFAOYSA-N 1 2 248.330 2.474 20 0 BEADLO c1cc(CNc2c[nH]c[nH+]2)n(-c2ccccc2)n1 ZINC000685845792 487586233 /nfs/dbraw/zinc/58/62/33/487586233.db2.gz WGXDOVLJVOJATP-UHFFFAOYSA-N 1 2 239.282 2.208 20 0 BEADLO O=c1[nH]c(C[N@H+]2CC=CCC2)nc2ccccc21 ZINC000679322265 487900538 /nfs/dbraw/zinc/90/05/38/487900538.db2.gz XXWCGZYFCDIRRS-UHFFFAOYSA-N 1 2 241.294 2.097 20 0 BEADLO O=c1[nH]c(C[N@@H+]2CC=CCC2)nc2ccccc21 ZINC000679322265 487900541 /nfs/dbraw/zinc/90/05/41/487900541.db2.gz XXWCGZYFCDIRRS-UHFFFAOYSA-N 1 2 241.294 2.097 20 0 BEADLO Cc1cc(CNc2cc[nH+]c(C3CC3)n2)ncn1 ZINC000677418413 488032555 /nfs/dbraw/zinc/03/25/55/488032555.db2.gz JSDHYAGCKOTIIC-UHFFFAOYSA-N 1 2 241.298 2.065 20 0 BEADLO CC1(CC(=O)Nc2ccc3[nH+]ccn3c2)CC1 ZINC000683201641 488129537 /nfs/dbraw/zinc/12/95/37/488129537.db2.gz XDAXHOGLNKHQLG-UHFFFAOYSA-N 1 2 229.283 2.463 20 0 BEADLO CCC(C)(CC)NC(=O)[C@@H]1CCc2c[nH+]cn2C1 ZINC000668705541 488143934 /nfs/dbraw/zinc/14/39/34/488143934.db2.gz KIHJRQFAMXXTSG-LLVKDONJSA-N 1 2 249.358 2.140 20 0 BEADLO CCC(C)(CC)NC(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000668706104 488145803 /nfs/dbraw/zinc/14/58/03/488145803.db2.gz PRILQEFZXNHWNC-GHMZBOCLSA-N 1 2 249.358 2.219 20 0 BEADLO C[C@H]1CCN(Cc2c[nH+]c3n2CCC3)C[C@@H]1F ZINC000667943712 488163160 /nfs/dbraw/zinc/16/31/60/488163160.db2.gz YLVSAPRQEBMQET-JQWIXIFHSA-N 1 2 237.322 2.009 20 0 BEADLO CCn1cc(C[NH2+][C@@H](C)c2cc(C)oc2C)nn1 ZINC000404512601 488165911 /nfs/dbraw/zinc/16/59/11/488165911.db2.gz RQRUZTSVKLSDDX-JTQLQIEISA-N 1 2 248.330 2.359 20 0 BEADLO CCc1cc(NCc2ccc(OC)cn2)nc[nH+]1 ZINC000683461171 488167961 /nfs/dbraw/zinc/16/79/61/488167961.db2.gz SOUOOLFEOSIZPN-UHFFFAOYSA-N 1 2 244.298 2.055 20 0 BEADLO CN(CC(C)(C)C)C(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000667971965 488172149 /nfs/dbraw/zinc/17/21/49/488172149.db2.gz APZMJDNUBJDSED-GHMZBOCLSA-N 1 2 249.358 2.028 20 0 BEADLO C(=C\c1ccncn1)\c1c[nH+]c2ccccn12 ZINC000678027383 488175197 /nfs/dbraw/zinc/17/51/97/488175197.db2.gz GXJLYWMFCBPGKS-PLNGDYQASA-N 1 2 222.251 2.295 20 0 BEADLO CCn1c[nH+]cc1CN[C@H]1CCCC1(F)F ZINC000398018005 488184954 /nfs/dbraw/zinc/18/49/54/488184954.db2.gz YAWSKPDLYJKFQK-JTQLQIEISA-N 1 2 229.274 2.180 20 0 BEADLO CCC[C@@H](C)NC(=O)Nc1cc(C)[nH+]cc1C ZINC000678097915 488197527 /nfs/dbraw/zinc/19/75/27/488197527.db2.gz CHLUJIVJLVIEDQ-SNVBAGLBSA-N 1 2 235.331 2.430 20 0 BEADLO Cc1cc(NC(=O)N2CCC[C@@H](C)C2)c(C)c[nH+]1 ZINC000678096929 488197661 /nfs/dbraw/zinc/19/76/61/488197661.db2.gz FHCPQTZGMDBTBY-SNVBAGLBSA-N 1 2 247.342 2.384 20 0 BEADLO COc1cccc(C[NH2+][C@H](C)c2cscn2)n1 ZINC000678115277 488198856 /nfs/dbraw/zinc/19/88/56/488198856.db2.gz ZPUORHPMCKRLAD-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO COc1cccc(C[NH2+][C@@H](C)c2cscn2)n1 ZINC000678115278 488199027 /nfs/dbraw/zinc/19/90/27/488199027.db2.gz ZPUORHPMCKRLAD-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO Fc1ccc(C[NH2+][C@H]2CCn3ccnc32)c(F)c1 ZINC000335916472 488200630 /nfs/dbraw/zinc/20/06/30/488200630.db2.gz BOCAMDOOXFRZOY-LBPRGKRZSA-N 1 2 249.264 2.396 20 0 BEADLO CC[C@H]1C[N@H+](Cc2[nH]nc3ccccc32)CCO1 ZINC000678131443 488202000 /nfs/dbraw/zinc/20/20/00/488202000.db2.gz BNZZCQOGJONJSE-NSHDSACASA-N 1 2 245.326 2.174 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2[nH]nc3ccccc32)CCO1 ZINC000678131443 488202004 /nfs/dbraw/zinc/20/20/04/488202004.db2.gz BNZZCQOGJONJSE-NSHDSACASA-N 1 2 245.326 2.174 20 0 BEADLO CC[C@H]1C[N@H+](Cc2n[nH]c3ccccc32)CCO1 ZINC000678131443 488202007 /nfs/dbraw/zinc/20/20/07/488202007.db2.gz BNZZCQOGJONJSE-NSHDSACASA-N 1 2 245.326 2.174 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2n[nH]c3ccccc32)CCO1 ZINC000678131443 488202010 /nfs/dbraw/zinc/20/20/10/488202010.db2.gz BNZZCQOGJONJSE-NSHDSACASA-N 1 2 245.326 2.174 20 0 BEADLO Cc1ccc(C[N@H+](Cc2cc[nH]n2)C2CC2)o1 ZINC000678135687 488202684 /nfs/dbraw/zinc/20/26/84/488202684.db2.gz RTBBGKAGMLLXPO-UHFFFAOYSA-N 1 2 231.299 2.476 20 0 BEADLO Cc1ccc(C[N@@H+](Cc2cc[nH]n2)C2CC2)o1 ZINC000678135687 488202685 /nfs/dbraw/zinc/20/26/85/488202685.db2.gz RTBBGKAGMLLXPO-UHFFFAOYSA-N 1 2 231.299 2.476 20 0 BEADLO CC1(C[N@@H+]2CCO[C@H](C(F)(F)F)C2)CCC1 ZINC000683700279 488209785 /nfs/dbraw/zinc/20/97/85/488209785.db2.gz VHNFQNOYVDYEKJ-VIFPVBQESA-N 1 2 237.265 2.440 20 0 BEADLO CC1(C[N@H+]2CCO[C@H](C(F)(F)F)C2)CCC1 ZINC000683700279 488209789 /nfs/dbraw/zinc/20/97/89/488209789.db2.gz VHNFQNOYVDYEKJ-VIFPVBQESA-N 1 2 237.265 2.440 20 0 BEADLO C=Cn1cc(C[N@H+]2CC[C@H](C)[C@H](F)C2)cn1 ZINC000683708260 488211696 /nfs/dbraw/zinc/21/16/96/488211696.db2.gz BMEIBERLJPQNFC-CMPLNLGQSA-N 1 2 223.295 2.164 20 0 BEADLO C=Cn1cc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)cn1 ZINC000683708260 488211700 /nfs/dbraw/zinc/21/17/00/488211700.db2.gz BMEIBERLJPQNFC-CMPLNLGQSA-N 1 2 223.295 2.164 20 0 BEADLO Cc1cn2ccc(NC(=O)N3CC(C)C3)cc2[nH+]1 ZINC000668162820 488211963 /nfs/dbraw/zinc/21/19/63/488211963.db2.gz JHZGZLIZOSLLPL-UHFFFAOYSA-N 1 2 244.298 2.126 20 0 BEADLO Cc1ccc2cc(C[N@@H+]3CCO[C@H]4C[C@H]43)[nH]c2c1 ZINC000668186226 488216911 /nfs/dbraw/zinc/21/69/11/488216911.db2.gz FCQYGEOOVDDQSO-CABCVRRESA-N 1 2 242.322 2.449 20 0 BEADLO Cc1ccc2cc(C[N@H+]3CCO[C@H]4C[C@H]43)[nH]c2c1 ZINC000668186226 488216915 /nfs/dbraw/zinc/21/69/15/488216915.db2.gz FCQYGEOOVDDQSO-CABCVRRESA-N 1 2 242.322 2.449 20 0 BEADLO Cc1cnc(C[NH2+]Cc2ccc3c(c2)OCO3)o1 ZINC000231637770 488217330 /nfs/dbraw/zinc/21/73/30/488217330.db2.gz QMIQUTDCQUEQMG-UHFFFAOYSA-N 1 2 246.266 2.002 20 0 BEADLO COCc1ccccc1C[NH2+]Cc1ncc(C)o1 ZINC000231641031 488218372 /nfs/dbraw/zinc/21/83/72/488218372.db2.gz PPBMBYRLWNMCDS-UHFFFAOYSA-N 1 2 246.310 2.419 20 0 BEADLO COCc1csc(C[N@@H+]2CCOC[C@@H]2C)c1 ZINC000668203726 488223683 /nfs/dbraw/zinc/22/36/83/488223683.db2.gz QUNVNUTWSGKUIX-JTQLQIEISA-N 1 2 241.356 2.115 20 0 BEADLO COCc1csc(C[N@H+]2CCOC[C@@H]2C)c1 ZINC000668203726 488223684 /nfs/dbraw/zinc/22/36/84/488223684.db2.gz QUNVNUTWSGKUIX-JTQLQIEISA-N 1 2 241.356 2.115 20 0 BEADLO C[N@H+](Cc1cn[nH]c1)Cc1scnc1C1CC1 ZINC000683830514 488228600 /nfs/dbraw/zinc/22/86/00/488228600.db2.gz PRAIUHDEWREXTR-UHFFFAOYSA-N 1 2 248.355 2.376 20 0 BEADLO C[N@@H+](Cc1cn[nH]c1)Cc1scnc1C1CC1 ZINC000683830514 488228604 /nfs/dbraw/zinc/22/86/04/488228604.db2.gz PRAIUHDEWREXTR-UHFFFAOYSA-N 1 2 248.355 2.376 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+]1CCc2c[nH]nc2C1 ZINC000678276118 488235167 /nfs/dbraw/zinc/23/51/67/488235167.db2.gz XITJKHJMCRVXNK-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1cc(F)ccc1C[N@H+]1CCc2c[nH]nc2C1 ZINC000678276118 488235168 /nfs/dbraw/zinc/23/51/68/488235168.db2.gz XITJKHJMCRVXNK-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1cn(C)cn1 ZINC000683900243 488241835 /nfs/dbraw/zinc/24/18/35/488241835.db2.gz SATXVCBQVMPWMS-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1cn(C)cn1 ZINC000683900243 488241837 /nfs/dbraw/zinc/24/18/37/488241837.db2.gz SATXVCBQVMPWMS-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO CC[C@@H](C)CCC(=O)N[C@H]1CCc2c[nH+]cn2C1 ZINC000672156776 488242670 /nfs/dbraw/zinc/24/26/70/488242670.db2.gz UNKGRKLIYQPZFB-NEPJUHHUSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1cc(CNc2cc3cc[nH]c3c[nH+]2)on1 ZINC000672189094 488243737 /nfs/dbraw/zinc/24/37/37/488243737.db2.gz LMLHAFUXTQTJJU-UHFFFAOYSA-N 1 2 228.255 2.471 20 0 BEADLO CC1(C)CN(C(=O)Nc2ccc3[nH+]ccn3c2)C1 ZINC000683943234 488249283 /nfs/dbraw/zinc/24/92/83/488249283.db2.gz CBYHUWWGNBDOSX-UHFFFAOYSA-N 1 2 244.298 2.208 20 0 BEADLO COc1ccncc1C[N@@H+]1CC[C@H](C)[C@H](F)C1 ZINC000672553076 488259715 /nfs/dbraw/zinc/25/97/15/488259715.db2.gz ZNBKLAMHYMUTEY-CMPLNLGQSA-N 1 2 238.306 2.270 20 0 BEADLO COc1ccncc1C[N@H+]1CC[C@H](C)[C@H](F)C1 ZINC000672553076 488259717 /nfs/dbraw/zinc/25/97/17/488259717.db2.gz ZNBKLAMHYMUTEY-CMPLNLGQSA-N 1 2 238.306 2.270 20 0 BEADLO Cc1cc(NC(=O)N2CCC[C@H]3C[C@H]32)c(C)c[nH+]1 ZINC000672712839 488264633 /nfs/dbraw/zinc/26/46/33/488264633.db2.gz DECUJKORFSADLH-WCQYABFASA-N 1 2 245.326 2.137 20 0 BEADLO c1coc(-c2noc(C[N@H+]3CC=CCC3)n2)c1 ZINC000679323482 488337158 /nfs/dbraw/zinc/33/71/58/488337158.db2.gz XWKNFHORCBFLQC-UHFFFAOYSA-N 1 2 231.255 2.092 20 0 BEADLO c1coc(-c2noc(C[N@@H+]3CC=CCC3)n2)c1 ZINC000679323482 488337160 /nfs/dbraw/zinc/33/71/60/488337160.db2.gz XWKNFHORCBFLQC-UHFFFAOYSA-N 1 2 231.255 2.092 20 0 BEADLO C[C@@H]1C[C@H]1NC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000673081417 488276180 /nfs/dbraw/zinc/27/61/80/488276180.db2.gz ZFEWNTMVNCBTAL-GMTAPVOTSA-N 1 2 248.330 2.055 20 0 BEADLO CCc1noc(C[NH2+][C@@H](C)c2cccc(O)c2)n1 ZINC000678761663 488280648 /nfs/dbraw/zinc/28/06/48/488280648.db2.gz OUXZKZGMHFQZSA-VIFPVBQESA-N 1 2 247.298 2.188 20 0 BEADLO CC(C)c1cc(C[NH2+][C@@H](C)c2nccn2C)on1 ZINC000678771234 488281723 /nfs/dbraw/zinc/28/17/23/488281723.db2.gz LUAZZSCJLNXHHU-JTQLQIEISA-N 1 2 248.330 2.382 20 0 BEADLO CC(C)c1cc(CN[C@@H](C)c2[nH+]ccn2C)on1 ZINC000678771234 488281725 /nfs/dbraw/zinc/28/17/25/488281725.db2.gz LUAZZSCJLNXHHU-JTQLQIEISA-N 1 2 248.330 2.382 20 0 BEADLO Fc1c[nH+]ccc1N1CCOC2(CCCC2)C1 ZINC000678787207 488282949 /nfs/dbraw/zinc/28/29/49/488282949.db2.gz CIBINYHWZISBKR-UHFFFAOYSA-N 1 2 236.290 2.370 20 0 BEADLO CN(Cc1ccncc1)c1cc[nH+]cc1F ZINC000678788231 488283384 /nfs/dbraw/zinc/28/33/84/488283384.db2.gz FVENHXOUMIFZGY-UHFFFAOYSA-N 1 2 217.247 2.252 20 0 BEADLO CN(CCc1ccncc1)c1cc[nH+]cc1F ZINC000678787453 488283391 /nfs/dbraw/zinc/28/33/91/488283391.db2.gz OXSQEKIABCWHFN-UHFFFAOYSA-N 1 2 231.274 2.295 20 0 BEADLO FC(F)C[NH2+]C1(c2ccc3c(c2)OCO3)CC1 ZINC000678799495 488284419 /nfs/dbraw/zinc/28/44/19/488284419.db2.gz YVAMLTQNQYPOME-UHFFFAOYSA-N 1 2 241.237 2.259 20 0 BEADLO c1cc2cc(NCC3=CCCOC3)[nH+]cc2[nH]1 ZINC000673474403 488288216 /nfs/dbraw/zinc/28/82/16/488288216.db2.gz IBONSAXVGLAIQR-UHFFFAOYSA-N 1 2 229.283 2.322 20 0 BEADLO CCc1cc(NCC2([C@H](O)C(C)C)CC2)nc[nH+]1 ZINC000678829445 488288916 /nfs/dbraw/zinc/28/89/16/488288916.db2.gz CVSAOLYGCVXLIT-CYBMUJFWSA-N 1 2 249.358 2.248 20 0 BEADLO FC(F)(F)Cn1cc[nH+]c1CN1CC=CCC1 ZINC000679321468 488336025 /nfs/dbraw/zinc/33/60/25/488336025.db2.gz CZRWXPQJYQXDEK-UHFFFAOYSA-N 1 2 245.248 2.207 20 0 BEADLO COc1ccc[nH+]c1NC1C[C@@H](C)O[C@H](C)C1 ZINC000678941950 488297032 /nfs/dbraw/zinc/29/70/32/488297032.db2.gz ZDYHLZKVQWOBLC-NXEZZACHSA-N 1 2 236.315 2.458 20 0 BEADLO C[C@@H]([NH2+]Cc1cocn1)c1cccc(CO)c1 ZINC000679050983 488305054 /nfs/dbraw/zinc/30/50/54/488305054.db2.gz UNIMUABLQOFFPL-SNVBAGLBSA-N 1 2 232.283 2.018 20 0 BEADLO CC[C@H](Nc1ccc(OC)c[nH+]1)[C@H]1CCOC1 ZINC000679068462 488305250 /nfs/dbraw/zinc/30/52/50/488305250.db2.gz DTGKRVIKRPNBEG-JQWIXIFHSA-N 1 2 236.315 2.317 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)CCC(F)F ZINC000684442583 488313405 /nfs/dbraw/zinc/31/34/05/488313405.db2.gz NJOWOPUVIINONW-UHFFFAOYSA-N 1 2 228.242 2.050 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nccs2)C[C@H]1F ZINC000679218172 488315203 /nfs/dbraw/zinc/31/52/03/488315203.db2.gz CEZJPICTZSJVNM-RKDXNWHRSA-N 1 2 214.309 2.323 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nccs2)C[C@H]1F ZINC000679218172 488315205 /nfs/dbraw/zinc/31/52/05/488315205.db2.gz CEZJPICTZSJVNM-RKDXNWHRSA-N 1 2 214.309 2.323 20 0 BEADLO CCc1cc(N(C)C[C@@H]2CCCC[C@H]2O)nc[nH+]1 ZINC000679197818 488316355 /nfs/dbraw/zinc/31/63/55/488316355.db2.gz UPNFWIGRFSGCNV-WCQYABFASA-N 1 2 249.358 2.026 20 0 BEADLO COc1ccnc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)c1 ZINC000679223605 488320395 /nfs/dbraw/zinc/32/03/95/488320395.db2.gz QZNBAOLXWZZGDW-MFKMUULPSA-N 1 2 238.306 2.270 20 0 BEADLO COc1ccnc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)c1 ZINC000679223605 488320397 /nfs/dbraw/zinc/32/03/97/488320397.db2.gz QZNBAOLXWZZGDW-MFKMUULPSA-N 1 2 238.306 2.270 20 0 BEADLO COc1cc[nH+]c(CN2CC[C@@H](C)[C@@H](F)C2)c1 ZINC000679223605 488320398 /nfs/dbraw/zinc/32/03/98/488320398.db2.gz QZNBAOLXWZZGDW-MFKMUULPSA-N 1 2 238.306 2.270 20 0 BEADLO C[C@H]1CC[C@H](CNC(=O)CCCn2cc[nH+]c2)C1 ZINC000684515136 488324543 /nfs/dbraw/zinc/32/45/43/488324543.db2.gz QNUYCJRCZNGEFX-STQMWFEESA-N 1 2 249.358 2.216 20 0 BEADLO CCN(CC1CCC1)C(=O)CCCn1cc[nH+]c1 ZINC000684516656 488324893 /nfs/dbraw/zinc/32/48/93/488324893.db2.gz ZRGAKQKRDWCQCR-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO c1cc2[nH+]ccc(N3CC=CCC3)c2cn1 ZINC000679279602 488328383 /nfs/dbraw/zinc/32/83/83/488328383.db2.gz DHNXHYTZTZRGKB-UHFFFAOYSA-N 1 2 211.268 2.396 20 0 BEADLO CCc1cc(N[C@@H](CO)CC2CCC2)nc[nH+]1 ZINC000684598670 488330666 /nfs/dbraw/zinc/33/06/66/488330666.db2.gz ANTBQOBGEFODES-GFCCVEGCSA-N 1 2 235.331 2.002 20 0 BEADLO Cc1ccc(F)cc1C[N@H+](C)Cc1cnc[nH]1 ZINC000684620861 488333990 /nfs/dbraw/zinc/33/39/90/488333990.db2.gz MSWXQFFVHGSKFS-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+](C)Cc1cnc[nH]1 ZINC000684620861 488333992 /nfs/dbraw/zinc/33/39/92/488333992.db2.gz MSWXQFFVHGSKFS-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1ccc(F)cc1C[N@H+](C)Cc1c[nH]cn1 ZINC000684620861 488333994 /nfs/dbraw/zinc/33/39/94/488333994.db2.gz MSWXQFFVHGSKFS-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+](C)Cc1c[nH]cn1 ZINC000684620861 488333996 /nfs/dbraw/zinc/33/39/96/488333996.db2.gz MSWXQFFVHGSKFS-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO COCc1cnc(C[N@H+]2CC=CCC2)s1 ZINC000679360812 488346524 /nfs/dbraw/zinc/34/65/24/488346524.db2.gz XJDZKQVJWKLCMG-UHFFFAOYSA-N 1 2 224.329 2.051 20 0 BEADLO COCc1cnc(C[N@@H+]2CC=CCC2)s1 ZINC000679360812 488346527 /nfs/dbraw/zinc/34/65/27/488346527.db2.gz XJDZKQVJWKLCMG-UHFFFAOYSA-N 1 2 224.329 2.051 20 0 BEADLO CC(C)C[C@H](C)NC(=O)CCCn1cc[nH+]c1 ZINC000121453891 490092511 /nfs/dbraw/zinc/09/25/11/490092511.db2.gz AWVOXGOJBPHLJY-LBPRGKRZSA-N 1 2 237.347 2.214 20 0 BEADLO CCc1cc(N[C@H]2CCC[C@@H](CO)C2)nc[nH+]1 ZINC000384089125 490179433 /nfs/dbraw/zinc/17/94/33/490179433.db2.gz YOROYXVTHOEJNF-PWSUYJOCSA-N 1 2 235.331 2.002 20 0 BEADLO CCc1ccc(C[N@H+](CC(=O)OC)C2CC2)cc1 ZINC000051737635 490194611 /nfs/dbraw/zinc/19/46/11/490194611.db2.gz XILYKHQBTQMBNQ-UHFFFAOYSA-N 1 2 247.338 2.386 20 0 BEADLO CCc1ccc(C[N@@H+](CC(=O)OC)C2CC2)cc1 ZINC000051737635 490194619 /nfs/dbraw/zinc/19/46/19/490194619.db2.gz XILYKHQBTQMBNQ-UHFFFAOYSA-N 1 2 247.338 2.386 20 0 BEADLO CC1(C)C(C(=O)NCCCn2cc[nH+]c2)C1(C)C ZINC000072793473 490287642 /nfs/dbraw/zinc/28/76/42/490287642.db2.gz KAPISXMNWGWKEE-UHFFFAOYSA-N 1 2 249.358 2.072 20 0 BEADLO CC(C)c1ccc(C[N@@H+]2CCNC(=O)[C@@H]2C)cc1 ZINC000075636931 490315651 /nfs/dbraw/zinc/31/56/51/490315651.db2.gz MRTZIUDWYFKJPB-LBPRGKRZSA-N 1 2 246.354 2.130 20 0 BEADLO CC(C)c1ccc(C[N@H+]2CCNC(=O)[C@@H]2C)cc1 ZINC000075636931 490315658 /nfs/dbraw/zinc/31/56/58/490315658.db2.gz MRTZIUDWYFKJPB-LBPRGKRZSA-N 1 2 246.354 2.130 20 0 BEADLO C[C@@H](Nc1nc(C2CC2)ns1)c1[nH]cc[nH+]1 ZINC000125249108 490421461 /nfs/dbraw/zinc/42/14/61/490421461.db2.gz NTXJLSCJJUKVTJ-ZCFIWIBFSA-N 1 2 235.316 2.312 20 0 BEADLO CCc1cc(NC[C@@H](C)CC(F)(F)F)nc[nH+]1 ZINC000396931849 490482912 /nfs/dbraw/zinc/48/29/12/490482912.db2.gz ARPIHQAMXLAZIY-QMMMGPOBSA-N 1 2 247.264 2.461 20 0 BEADLO CCc1cc(N[C@@H]2CCO[C@H](C)C2)nc[nH+]1 ZINC000220082245 490589046 /nfs/dbraw/zinc/58/90/46/490589046.db2.gz OEVPXRUPRBGFEY-MWLCHTKSSA-N 1 2 221.304 2.018 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@@H+]1Cc1cocn1 ZINC000651911982 491078577 /nfs/dbraw/zinc/07/85/77/491078577.db2.gz GWKSQUFVLHIDPZ-NSHDSACASA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@H+]1Cc1cocn1 ZINC000651911982 491078579 /nfs/dbraw/zinc/07/85/79/491078579.db2.gz GWKSQUFVLHIDPZ-NSHDSACASA-N 1 2 224.304 2.064 20 0 BEADLO Cc1cnc(C[NH2+]Cc2cccc(F)c2)o1 ZINC000227083892 491054719 /nfs/dbraw/zinc/05/47/19/491054719.db2.gz SGXZPYXSULAAKC-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616927974 491069048 /nfs/dbraw/zinc/06/90/48/491069048.db2.gz VBKJHMKXWGGTEI-WCQYABFASA-N 1 2 235.331 2.050 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616927974 491069049 /nfs/dbraw/zinc/06/90/49/491069049.db2.gz VBKJHMKXWGGTEI-WCQYABFASA-N 1 2 235.331 2.050 20 0 BEADLO CC(C)[N@H+](Cc1cn(C)cn1)Cc1ccccn1 ZINC000659847218 491081437 /nfs/dbraw/zinc/08/14/37/491081437.db2.gz KYYUJSBABLAGMS-UHFFFAOYSA-N 1 2 244.342 2.226 20 0 BEADLO CC(C)[N@@H+](Cc1cn(C)cn1)Cc1ccccn1 ZINC000659847218 491081438 /nfs/dbraw/zinc/08/14/38/491081438.db2.gz KYYUJSBABLAGMS-UHFFFAOYSA-N 1 2 244.342 2.226 20 0 BEADLO COc1cccc2c1C[N@H+](Cc1ccno1)CC2 ZINC000650106522 491085733 /nfs/dbraw/zinc/08/57/33/491085733.db2.gz CCCXJVRRNQGTKB-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1cccc2c1C[N@@H+](Cc1ccno1)CC2 ZINC000650106522 491085735 /nfs/dbraw/zinc/08/57/35/491085735.db2.gz CCCXJVRRNQGTKB-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO CCc1cc(NC[C@H]2CCCS2)nc[nH+]1 ZINC000087475452 491088916 /nfs/dbraw/zinc/08/89/16/491088916.db2.gz HFAYMIYAMKQXRZ-SNVBAGLBSA-N 1 2 223.345 2.347 20 0 BEADLO COc1cccc(C[NH2+][C@H](C)C(F)F)c1 ZINC000228504808 491089193 /nfs/dbraw/zinc/08/91/93/491089193.db2.gz LMQGYDUSDMTGPS-MRVPVSSYSA-N 1 2 215.243 2.438 20 0 BEADLO CCc1cnc(C[NH2+][C@@H](C)c2ccccn2)o1 ZINC000228577390 491095546 /nfs/dbraw/zinc/09/55/46/491095546.db2.gz ZKYWVMRLNIQARI-JTQLQIEISA-N 1 2 231.299 2.483 20 0 BEADLO CCc1cc(NCC(CC)(CC)CO)nc[nH+]1 ZINC000229177010 491109357 /nfs/dbraw/zinc/10/93/57/491109357.db2.gz OISICNINUZHYQI-UHFFFAOYSA-N 1 2 237.347 2.250 20 0 BEADLO Cc1ncc([C@@H](C)[NH2+]Cc2cc[nH]n2)s1 ZINC000090408774 491126355 /nfs/dbraw/zinc/12/63/55/491126355.db2.gz GCTNXUQPRNNBBS-SSDOTTSWSA-N 1 2 222.317 2.025 20 0 BEADLO CCc1ccc(C[N@H+]2CCN(C)C[C@H]2CC)cn1 ZINC000560614525 491129333 /nfs/dbraw/zinc/12/93/33/491129333.db2.gz IDZSLTUAFQIKFZ-OAHLLOKOSA-N 1 2 247.386 2.170 20 0 BEADLO CCc1ccc(C[N@@H+]2CCN(C)C[C@H]2CC)cn1 ZINC000560614525 491129334 /nfs/dbraw/zinc/12/93/34/491129334.db2.gz IDZSLTUAFQIKFZ-OAHLLOKOSA-N 1 2 247.386 2.170 20 0 BEADLO Cc1noc([C@H](C)[N@@H+]2CCSC(C)(C)C2)n1 ZINC000083415871 491161550 /nfs/dbraw/zinc/16/15/50/491161550.db2.gz JFODMKLJWGOWHB-QMMMGPOBSA-N 1 2 241.360 2.266 20 0 BEADLO Cc1noc([C@H](C)[N@H+]2CCSC(C)(C)C2)n1 ZINC000083415871 491161551 /nfs/dbraw/zinc/16/15/51/491161551.db2.gz JFODMKLJWGOWHB-QMMMGPOBSA-N 1 2 241.360 2.266 20 0 BEADLO C[C@@H]1CCC[C@@H](N(C)C(=O)/C=C\c2[nH]cc[nH+]2)C1 ZINC000493085566 533757800 /nfs/dbraw/zinc/75/78/00/533757800.db2.gz MZCLPNHXWMWONE-UXFRKABBSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@H](CCC1CC1)NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493193519 533816006 /nfs/dbraw/zinc/81/60/06/533816006.db2.gz SPVYJRYYBVRCSP-VQCYPWCPSA-N 1 2 233.315 2.118 20 0 BEADLO Cc1ccc(CNC(=O)C=Cc2c[nH]c[nH+]2)s1 ZINC000492810250 533966536 /nfs/dbraw/zinc/96/65/36/533966536.db2.gz HTHPNANBMYEKNK-HWKANZROSA-N 1 2 247.323 2.109 20 0 BEADLO CCC[C@H](C(=O)N(C)Cc1[nH]cc[nH+]1)C(C)C ZINC000343547802 535576333 /nfs/dbraw/zinc/57/63/33/535576333.db2.gz XVBAIVCTHBCVDA-NSHDSACASA-N 1 2 237.347 2.440 20 0 BEADLO C[C@@H]1CC[C@H](N(C)C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492761518 534244043 /nfs/dbraw/zinc/24/40/43/534244043.db2.gz GLYSIONMQYCTNJ-RDVLDQKLSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@@H]1CN(C(=O)/C=C/c2[nH]cc[nH+]2)C(C)(C)C1 ZINC000493393881 534275569 /nfs/dbraw/zinc/27/55/69/534275569.db2.gz WDBUIGJIVAFTKQ-YEZKRMTDSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@@H](N(C)C(=O)C=Cc1c[nH]c[nH+]1)C(C)(C)C ZINC000493577172 534280467 /nfs/dbraw/zinc/28/04/67/534280467.db2.gz DHGDYKQLSUJCIO-JYESYGNLSA-N 1 2 235.331 2.316 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)NC1(CC)CCC1 ZINC000492413947 517880616 /nfs/dbraw/zinc/88/06/16/517880616.db2.gz YUCDXOWNOWUXIQ-VOTSOKGWSA-N 1 2 247.342 2.365 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CCCCCCC1 ZINC000278654874 518185741 /nfs/dbraw/zinc/18/57/41/518185741.db2.gz OYCARHCMEQSOGU-UHFFFAOYSA-N 1 2 235.331 2.053 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)/C=C\[C@H]1CCOC1 ZINC000493136248 534384909 /nfs/dbraw/zinc/38/49/09/534384909.db2.gz DBDSXUVWWPDIST-MVZIDQBPSA-N 1 2 246.310 2.230 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)NC1(C2CCC2)CCC1 ZINC000493729459 534786034 /nfs/dbraw/zinc/78/60/34/534786034.db2.gz UOCDLGYSDYYINT-AATRIKPKSA-N 1 2 245.326 2.262 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)N1CC[C@H](CC2CC2)C1 ZINC000493182583 534786823 /nfs/dbraw/zinc/78/68/23/534786823.db2.gz BPLASWVZELFJIL-AAOUONPWSA-N 1 2 245.326 2.072 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)NC1CCC2(CC2)CC1 ZINC000493623453 534787509 /nfs/dbraw/zinc/78/75/09/534787509.db2.gz RMYBGHPBBGYMTA-OWOJBTEDSA-N 1 2 245.326 2.262 20 0 BEADLO O=C(/C=C\C1CC1)Nc1ccn2cc[nH+]c2c1 ZINC000493274158 534790120 /nfs/dbraw/zinc/79/01/20/534790120.db2.gz RQGVWXOHYFFSQY-ARJAWSKDSA-N 1 2 227.267 2.239 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N(CC1CC1)C1CCC1 ZINC000492859223 534800343 /nfs/dbraw/zinc/80/03/43/534800343.db2.gz GHWWRAHGRJFNTF-SREVYHEPSA-N 1 2 245.326 2.214 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)Nc1ccc(F)cc1 ZINC000492866548 534804985 /nfs/dbraw/zinc/80/49/85/534804985.db2.gz QHFNISMRXRVQLI-WAYWQWQTSA-N 1 2 231.230 2.201 20 0 BEADLO CC(=O)c1cccc(C[N@H+]2CCO[C@@H](C)[C@H]2C)c1 ZINC000336196003 534888686 /nfs/dbraw/zinc/88/86/86/534888686.db2.gz KDTAWRPBMQYZIM-YPMHNXCESA-N 1 2 247.338 2.498 20 0 BEADLO CC(=O)c1cccc(C[N@@H+]2CCO[C@@H](C)[C@H]2C)c1 ZINC000336196003 534888687 /nfs/dbraw/zinc/88/86/87/534888687.db2.gz KDTAWRPBMQYZIM-YPMHNXCESA-N 1 2 247.338 2.498 20 0 BEADLO CC(C)c1nc(N2CCO[C@@H]3CCC[C@@H]32)cc[nH+]1 ZINC000370388066 534908906 /nfs/dbraw/zinc/90/89/06/534908906.db2.gz ZRYSVKZWPKKNBL-NWDGAFQWSA-N 1 2 247.342 2.358 20 0 BEADLO CC(C)c1nc(N2CCC23CCOCC3)cc[nH+]1 ZINC000366786298 534907882 /nfs/dbraw/zinc/90/78/82/534907882.db2.gz FDIPOYVFOAMILS-UHFFFAOYSA-N 1 2 247.342 2.359 20 0 BEADLO CC(C)c1nc(N2C[C@@H](C)O[C@@H](C)C2)cc[nH+]1 ZINC000106461742 534909608 /nfs/dbraw/zinc/90/96/08/534909608.db2.gz ALKFCTOFNHTLBN-PHIMTYICSA-N 1 2 235.331 2.214 20 0 BEADLO CC(C)(NC(=O)/C=C/c1[nH]cc[nH+]1)C1CCC1 ZINC000493180912 527264007 /nfs/dbraw/zinc/26/40/07/527264007.db2.gz BJIOLGYJXLOANH-VOTSOKGWSA-N 1 2 233.315 2.118 20 0 BEADLO CC(C)C(CNC(=O)C=Cc1c[nH]c[nH+]1)C(C)C ZINC000492901748 527577936 /nfs/dbraw/zinc/57/79/36/527577936.db2.gz PJBMAPIASXFZTF-WAYWQWQTSA-N 1 2 249.358 2.467 20 0 BEADLO C/C=C/C=C\C(=O)NCCCNc1cccc[nH+]1 ZINC000493235861 527601971 /nfs/dbraw/zinc/60/19/71/527601971.db2.gz RJNHWQPQXFMIRC-OQIXSKIXSA-N 1 2 245.326 2.132 20 0 BEADLO C/C=C/C=C\C(=O)N[C@H](C)c1[nH+]ccn1CC ZINC000493424394 527611196 /nfs/dbraw/zinc/61/11/96/527611196.db2.gz SIFPVUYPSPCTSS-QLDOWJLSSA-N 1 2 233.315 2.213 20 0 BEADLO C/C=C/C=C\C(=O)Nc1c[nH+]c2n1CCCC2 ZINC000493431991 527614136 /nfs/dbraw/zinc/61/41/36/527614136.db2.gz LNXBVORKNPKZEL-HOJFPOIOSA-N 1 2 231.299 2.290 20 0 BEADLO CC(C)(C)C1CC(NC(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493237713 527624932 /nfs/dbraw/zinc/62/49/32/527624932.db2.gz JIASVTSTJIOHOI-PLNGDYQASA-N 1 2 247.342 2.364 20 0 BEADLO CC(C)CC1(CNC(=O)/C=C/c2[nH]cc[nH+]2)CC1 ZINC000493714569 527690086 /nfs/dbraw/zinc/69/00/86/527690086.db2.gz BCVRYSCEUCLOID-ONEGZZNKSA-N 1 2 247.342 2.365 20 0 BEADLO CCCN(C(=O)C=Cc1c[nH]c[nH+]1)C(C)C ZINC000493616671 527720216 /nfs/dbraw/zinc/72/02/16/527720216.db2.gz TYVAQLPNOXZYBX-WAYWQWQTSA-N 1 2 221.304 2.070 20 0 BEADLO CC(C)OC(=O)N[C@@H](c1[nH+]ccn1C)C1CC1 ZINC000496764743 527826835 /nfs/dbraw/zinc/82/68/35/527826835.db2.gz BQBDPOCOECOGCH-SNVBAGLBSA-N 1 2 237.303 2.006 20 0 BEADLO CCC[N@H+](CC(=O)OC)Cc1ccc(Cl)o1 ZINC000471819438 527906388 /nfs/dbraw/zinc/90/63/88/527906388.db2.gz ICNIZYLDRJBQEW-UHFFFAOYSA-N 1 2 245.706 2.318 20 0 BEADLO CCC[N@@H+](CC(=O)OC)Cc1ccc(Cl)o1 ZINC000471819438 527906394 /nfs/dbraw/zinc/90/63/94/527906394.db2.gz ICNIZYLDRJBQEW-UHFFFAOYSA-N 1 2 245.706 2.318 20 0 BEADLO CCN(CC(C)(C)C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493300068 527940206 /nfs/dbraw/zinc/94/02/06/527940206.db2.gz HSTQXBNOGZPSTL-SREVYHEPSA-N 1 2 235.331 2.318 20 0 BEADLO CC(C)OCC[N@@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000494209289 527962571 /nfs/dbraw/zinc/96/25/71/527962571.db2.gz QOAVLXQNWZTLFI-SNVBAGLBSA-N 1 2 221.291 2.389 20 0 BEADLO CC(C)OCC[N@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000494209289 527962576 /nfs/dbraw/zinc/96/25/76/527962576.db2.gz QOAVLXQNWZTLFI-SNVBAGLBSA-N 1 2 221.291 2.389 20 0 BEADLO CC1CCC(CNC(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000492767652 528178572 /nfs/dbraw/zinc/17/85/72/528178572.db2.gz NTXPTIUGWRAXRJ-SREVYHEPSA-N 1 2 247.342 2.365 20 0 BEADLO CCN(CC1CCC1)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493812563 528336716 /nfs/dbraw/zinc/33/67/16/528336716.db2.gz BXSZLZUFHHZWPK-SREVYHEPSA-N 1 2 233.315 2.072 20 0 BEADLO CCC[C@H]1CCCN(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493674994 528370198 /nfs/dbraw/zinc/37/01/98/528370198.db2.gz BEIYYISFOTVHOC-SYTKJHMZSA-N 1 2 247.342 2.462 20 0 BEADLO CC(C)C[C@@H]1CCCN1C(=O)/C=C\c1[nH]cc[nH+]1 ZINC000493157151 528376573 /nfs/dbraw/zinc/37/65/73/528376573.db2.gz PZELDZZUPCXMKI-FJOGCWAESA-N 1 2 247.342 2.460 20 0 BEADLO CCOCCC[N@@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000494280676 528661128 /nfs/dbraw/zinc/66/11/28/528661128.db2.gz YCVWMARSMWVFEE-SNVBAGLBSA-N 1 2 221.291 2.390 20 0 BEADLO CCOCCC[N@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000494280676 528661133 /nfs/dbraw/zinc/66/11/33/528661133.db2.gz YCVWMARSMWVFEE-SNVBAGLBSA-N 1 2 221.291 2.390 20 0 BEADLO CCCC[C@@H](C)N(C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493818336 528756404 /nfs/dbraw/zinc/75/64/04/528756404.db2.gz SNNNHVIEJYIRHW-SKVAFPRGSA-N 1 2 235.331 2.460 20 0 BEADLO CC1(C)CC[C@H](NC(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493497392 529045721 /nfs/dbraw/zinc/04/57/21/529045721.db2.gz YAYXCUUOZWZDCF-FSIBCCDJSA-N 1 2 233.315 2.118 20 0 BEADLO CC[C@@H]1CCC[C@H]1NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493664604 529319845 /nfs/dbraw/zinc/31/98/45/529319845.db2.gz ZWCQOCMUDLKTQV-AFPRHGJPSA-N 1 2 233.315 2.118 20 0 BEADLO CC[C@@H]1CC[C@H](C)N(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493434643 529340478 /nfs/dbraw/zinc/34/04/78/529340478.db2.gz QWQBTVIXKVJOBG-QHDQMSKJSA-N 1 2 247.342 2.460 20 0 BEADLO CC(C)C[N@@H+]1CC(=O)N[C@]12CC[C@@H](C)[C@H](C)C2 ZINC000342444550 535066264 /nfs/dbraw/zinc/06/62/64/535066264.db2.gz CLYLHERAHOUFEI-YRGRVCCFSA-N 1 2 238.375 2.227 20 0 BEADLO CC(C)C[N@H+]1CC(=O)N[C@]12CC[C@@H](C)[C@H](C)C2 ZINC000342444550 535066268 /nfs/dbraw/zinc/06/62/68/535066268.db2.gz CLYLHERAHOUFEI-YRGRVCCFSA-N 1 2 238.375 2.227 20 0 BEADLO CC(C)[NH+](Cc1nsc(N(C)C)n1)C(C)C ZINC000183037127 535121754 /nfs/dbraw/zinc/12/17/54/535121754.db2.gz DYIWKVDNJHCNIV-UHFFFAOYSA-N 1 2 242.392 2.223 20 0 BEADLO CCCCNC(=O)C[N@H+](C)[C@@H](C)c1ccco1 ZINC000069069585 535279755 /nfs/dbraw/zinc/27/97/55/535279755.db2.gz QSPDJMAYHKVFCH-NSHDSACASA-N 1 2 238.331 2.189 20 0 BEADLO CCCCNC(=O)C[N@@H+](C)[C@@H](C)c1ccco1 ZINC000069069585 535279759 /nfs/dbraw/zinc/27/97/59/535279759.db2.gz QSPDJMAYHKVFCH-NSHDSACASA-N 1 2 238.331 2.189 20 0 BEADLO CC[C@@H](C)CC(=O)Nc1ccc(N)[nH+]c1 ZINC000164512965 535478714 /nfs/dbraw/zinc/47/87/14/535478714.db2.gz WPOLLFUHPWKJLX-MRVPVSSYSA-N 1 2 207.277 2.039 20 0 BEADLO CCCc1nc(C[N@H+]2C[C@@H]3[C@H](C2)C3(C)C)no1 ZINC000172961835 535528440 /nfs/dbraw/zinc/52/84/40/535528440.db2.gz DZCJMWQNARJSHN-AOOOYVTPSA-N 1 2 235.331 2.110 20 0 BEADLO CCCc1nc(C[N@@H+]2C[C@@H]3[C@H](C2)C3(C)C)no1 ZINC000172961835 535528445 /nfs/dbraw/zinc/52/84/45/535528445.db2.gz DZCJMWQNARJSHN-AOOOYVTPSA-N 1 2 235.331 2.110 20 0 BEADLO CCO[C@H]1CCCN(c2nc(C)[nH+]c(C)c2C)C1 ZINC000301432828 535622024 /nfs/dbraw/zinc/62/20/24/535622024.db2.gz HSJZFCZZNGQFPS-ZDUSSCGKSA-N 1 2 249.358 2.407 20 0 BEADLO CCO[C@H]1CCN(c2cccc[nH+]2)C[C@@H]1C ZINC000336261352 535635941 /nfs/dbraw/zinc/63/59/41/535635941.db2.gz FNJPMFBJRFHJLN-RYUDHWBXSA-N 1 2 220.316 2.333 20 0 BEADLO CC[C@H](NC(=O)c1[nH]c(C)cc1C)c1[nH]cc[nH+]1 ZINC000347977966 535857111 /nfs/dbraw/zinc/85/71/11/535857111.db2.gz XVTYSTAXMURLFM-JTQLQIEISA-N 1 2 246.314 2.236 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cnc(C)s2)C[C@@H](C)O1 ZINC000252442550 535866354 /nfs/dbraw/zinc/86/63/54/535866354.db2.gz AFZNNZLOFJNBIE-MWLCHTKSSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cnc(C)s2)C[C@@H](C)O1 ZINC000252442550 535866347 /nfs/dbraw/zinc/86/63/47/535866347.db2.gz AFZNNZLOFJNBIE-MWLCHTKSSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@]1(C)CC[N@H+](Cc2noc(C)n2)C1 ZINC000336218861 535910045 /nfs/dbraw/zinc/91/00/45/535910045.db2.gz NREMOPMKWPOWMP-LLVKDONJSA-N 1 2 209.293 2.000 20 0 BEADLO CC[C@]1(C)CC[N@@H+](Cc2noc(C)n2)C1 ZINC000336218861 535910048 /nfs/dbraw/zinc/91/00/48/535910048.db2.gz NREMOPMKWPOWMP-LLVKDONJSA-N 1 2 209.293 2.000 20 0 BEADLO COC1(C)CCN(c2cc[nH+]c(C3CC3)n2)CC1 ZINC000271607550 536567242 /nfs/dbraw/zinc/56/72/42/536567242.db2.gz BZQKPPNWNWACST-UHFFFAOYSA-N 1 2 247.342 2.359 20 0 BEADLO COC1(CNC(=O)Nc2cc[nH+]cc2C)CCC1 ZINC000184188455 536666532 /nfs/dbraw/zinc/66/65/32/536666532.db2.gz GCHKRWGYHWYVCO-UHFFFAOYSA-N 1 2 249.314 2.081 20 0 BEADLO CCc1cc(N[C@@H]2C[C@H]2C(C)C)nc[nH+]1 ZINC000665737148 566267324 /nfs/dbraw/zinc/26/73/24/566267324.db2.gz CQKDWYSGHKONSM-WDEREUQCSA-N 1 2 205.305 2.495 20 0 BEADLO CCCC(C)(C)C(=O)NCCCn1cc[nH+]c1 ZINC000650987065 566332932 /nfs/dbraw/zinc/33/29/32/566332932.db2.gz NNKAXSPGOGWQGY-UHFFFAOYSA-N 1 2 237.347 2.216 20 0 BEADLO Cc1[nH]c2ccc(CSC[C@@H](C)O)cc2[nH+]1 ZINC000413016411 566379102 /nfs/dbraw/zinc/37/91/02/566379102.db2.gz LXCKRMRRFCXNOG-MRVPVSSYSA-N 1 2 236.340 2.485 20 0 BEADLO Cc1[nH]c2cc(CSC[C@@H](C)O)ccc2[nH+]1 ZINC000413016411 566379113 /nfs/dbraw/zinc/37/91/13/566379113.db2.gz LXCKRMRRFCXNOG-MRVPVSSYSA-N 1 2 236.340 2.485 20 0 BEADLO Cc1cccc(CCNc2ccc(F)cn2)[nH+]1 ZINC000343108830 566436348 /nfs/dbraw/zinc/43/63/48/566436348.db2.gz SAQGYXKJMLSCHP-UHFFFAOYSA-N 1 2 231.274 2.001 20 0 BEADLO C[C@H](O)c1cccc(NC[C@@H]2CCCS2)[nH+]1 ZINC000892885583 583003020 /nfs/dbraw/zinc/00/30/20/583003020.db2.gz ZUFXPHSWGRQQTC-UWVGGRQHSA-N 1 2 238.356 2.442 20 0 BEADLO CCOC[C@H](C)Nc1cc(CC)[nH+]c(CC)n1 ZINC000893269074 583081195 /nfs/dbraw/zinc/08/11/95/583081195.db2.gz LJOMNJUVESXTNM-JTQLQIEISA-N 1 2 237.347 2.438 20 0 BEADLO Cc1ncoc1C[N@H+](C)Cc1ccco1 ZINC000893903268 583243391 /nfs/dbraw/zinc/24/33/91/583243391.db2.gz DVTOGTUMBFVTDQ-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO Cc1ncoc1C[N@@H+](C)Cc1ccco1 ZINC000893903268 583243395 /nfs/dbraw/zinc/24/33/95/583243395.db2.gz DVTOGTUMBFVTDQ-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+]C1CC2(C1)CCCC2 ZINC000893950972 583260494 /nfs/dbraw/zinc/26/04/94/583260494.db2.gz ORURAZOMAJOARR-SNVBAGLBSA-N 1 2 225.332 2.250 20 0 BEADLO Cc1[nH]nc(C[NH+]2[C@H](C)CC[C@H]2C)c1C ZINC000894095260 583300390 /nfs/dbraw/zinc/30/03/90/583300390.db2.gz QJVCYNOORILBJK-RKDXNWHRSA-N 1 2 207.321 2.399 20 0 BEADLO Fc1cnc(N2CCCC[C@@H]2c2[nH]cc[nH+]2)cn1 ZINC000853411420 588741704 /nfs/dbraw/zinc/74/17/04/588741704.db2.gz LXHPKVUMBKIVLX-SECBINFHSA-N 1 2 247.277 2.070 20 0 BEADLO NC(=[NH+]OCC1CC=CC1)c1ccccc1 ZINC000853636288 588751254 /nfs/dbraw/zinc/75/12/54/588751254.db2.gz AHSDGBDDZNKFRH-UHFFFAOYSA-N 1 2 216.284 2.499 20 0 BEADLO CC1(C)C[C@H](O[NH+]=C(N)Cc2ccccc2)CO1 ZINC000853656251 588752716 /nfs/dbraw/zinc/75/27/16/588752716.db2.gz WGYYOPRTBSYQPU-LBPRGKRZSA-N 1 2 248.326 2.295 20 0 BEADLO CC(C)OCC(N)=[NH+]OCC1(C)CCC1 ZINC000853659685 588753446 /nfs/dbraw/zinc/75/34/46/588753446.db2.gz ZRHUWNBYIMUENX-UHFFFAOYSA-N 1 2 214.309 2.100 20 0 BEADLO CC1=NO[C@H](CNc2cc[nH+]c(C(C)(C)C)n2)C1 ZINC000853661439 588753593 /nfs/dbraw/zinc/75/35/93/588753593.db2.gz VRDHAQGYEBQZLH-JTQLQIEISA-N 1 2 248.330 2.351 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)Nc1cnc(F)cn1 ZINC000853668780 588754050 /nfs/dbraw/zinc/75/40/50/588754050.db2.gz ZQBWWRHECYZMOZ-QMMMGPOBSA-N 1 2 235.266 2.005 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OCCCC1CCC1 ZINC000853674418 588754962 /nfs/dbraw/zinc/75/49/62/588754962.db2.gz YLZPBQOTMFAWDR-SECBINFHSA-N 1 2 214.309 2.100 20 0 BEADLO CCC(C)(C)CCO[NH+]=C(N)[C@@H](C)OC ZINC000853674431 588755006 /nfs/dbraw/zinc/75/50/06/588755006.db2.gz YYHGLZQUQYDOFN-SECBINFHSA-N 1 2 216.325 2.346 20 0 BEADLO CC(C)c1nc(N[C@H](CO)C2CCC2)cc[nH+]1 ZINC000853761046 588761972 /nfs/dbraw/zinc/76/19/72/588761972.db2.gz MCIHYIWOPUNSCS-LLVKDONJSA-N 1 2 235.331 2.173 20 0 BEADLO C[C@H](Nc1cncc(Cl)n1)c1[nH+]ccn1C ZINC000853967967 588770448 /nfs/dbraw/zinc/77/04/48/588770448.db2.gz ZJQFARDUDMOVAU-ZETCQYMHSA-N 1 2 237.694 2.037 20 0 BEADLO CSc1cnc(N[C@H](C)c2[nH+]ccn2C)nc1 ZINC000853966395 588770490 /nfs/dbraw/zinc/77/04/90/588770490.db2.gz CAZPWGPCBNGGRG-MRVPVSSYSA-N 1 2 249.343 2.105 20 0 BEADLO CCn1nccc1CNc1cc[nH+]c(C(C)C)n1 ZINC000854000439 588770862 /nfs/dbraw/zinc/77/08/62/588770862.db2.gz XEZBPOFMBHYEQP-UHFFFAOYSA-N 1 2 245.330 2.429 20 0 BEADLO CC1(C)C[N@H+](CCF)[C@@H]1c1ccncc1 ZINC000854041008 588772493 /nfs/dbraw/zinc/77/24/93/588772493.db2.gz XOPZQVNYYRZKRL-LLVKDONJSA-N 1 2 208.280 2.434 20 0 BEADLO CC1(C)C[N@@H+](CCF)[C@@H]1c1ccncc1 ZINC000854041008 588772494 /nfs/dbraw/zinc/77/24/94/588772494.db2.gz XOPZQVNYYRZKRL-LLVKDONJSA-N 1 2 208.280 2.434 20 0 BEADLO CCC(CC)c1noc([C@@H]([NH3+])COC(C)C)n1 ZINC000854139015 588776537 /nfs/dbraw/zinc/77/65/37/588776537.db2.gz CDGVYCHZJPRKPU-JTQLQIEISA-N 1 2 241.335 2.398 20 0 BEADLO CC(C)OC[C@H]([NH3+])c1nc([C@@H](C)C2CC2)no1 ZINC000854143120 588776915 /nfs/dbraw/zinc/77/69/15/588776915.db2.gz JIBYIUFCGVPFHG-WPRPVWTQSA-N 1 2 239.319 2.008 20 0 BEADLO O=C(NC1=[NH+]CCS1)C1CCC2(CC2)CC1 ZINC000854292134 588782676 /nfs/dbraw/zinc/78/26/76/588782676.db2.gz CSIMZYJPOFCLDG-UHFFFAOYSA-N 1 2 238.356 2.176 20 0 BEADLO CCOc1ccc(OC(=O)C2([NH+](C)C)CC2)cc1 ZINC000854314349 588783128 /nfs/dbraw/zinc/78/31/28/588783128.db2.gz MNQNMVUJILQJSA-UHFFFAOYSA-N 1 2 249.310 2.085 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)N1CCCCCCCC1 ZINC000854843340 588813181 /nfs/dbraw/zinc/81/31/81/588813181.db2.gz NVSAOCJTXFCXHH-UHFFFAOYSA-N 1 2 235.331 2.135 20 0 BEADLO CCC(F)(F)C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000854845193 588813192 /nfs/dbraw/zinc/81/31/92/588813192.db2.gz KTHNYJNUVIFKCR-JGVFFNPUSA-N 1 2 243.257 2.050 20 0 BEADLO CC(C)(C)C[C@H]1CCN(C(=O)Cc2[nH]cc[nH+]2)C1 ZINC000854892783 588815615 /nfs/dbraw/zinc/81/56/15/588815615.db2.gz FBUWGVRIIZUNAM-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@H]1CCCC[C@@]1(C)NC(=O)Cc1[nH]cc[nH+]1 ZINC000854902467 588816196 /nfs/dbraw/zinc/81/61/96/588816196.db2.gz DUODNIZEIZZTLZ-GXFFZTMASA-N 1 2 235.331 2.037 20 0 BEADLO CC(C)(C)[C@H]1CCC[C@@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000854942525 588817675 /nfs/dbraw/zinc/81/76/75/588817675.db2.gz VKOZELSLEWIVKG-QWRGUYRKSA-N 1 2 249.358 2.283 20 0 BEADLO CCCC[C@](C)(F)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000855135202 588822722 /nfs/dbraw/zinc/82/27/22/588822722.db2.gz ICYYYKICVOUJHR-LBPRGKRZSA-N 1 2 241.310 2.287 20 0 BEADLO CCCC[C@](C)(F)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000855135202 588822723 /nfs/dbraw/zinc/82/27/23/588822723.db2.gz ICYYYKICVOUJHR-LBPRGKRZSA-N 1 2 241.310 2.287 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)C(F)=C1CCCC1 ZINC000855134186 588822974 /nfs/dbraw/zinc/82/29/74/588822974.db2.gz HXKPKKIFUUFIQE-UHFFFAOYSA-N 1 2 237.278 2.166 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)C(F)=C1CCCC1 ZINC000855134186 588822975 /nfs/dbraw/zinc/82/29/75/588822975.db2.gz HXKPKKIFUUFIQE-UHFFFAOYSA-N 1 2 237.278 2.166 20 0 BEADLO C[C@@H]1CC/C(=C\C(=O)N(C)Cc2c[nH+]c[nH]2)C1 ZINC000855134172 588823006 /nfs/dbraw/zinc/82/30/06/588823006.db2.gz HNVSSYNUZTYHTG-VUUNSECVSA-N 1 2 233.315 2.115 20 0 BEADLO C[C@@H]1CC/C(=C\C(=O)N(C)Cc2c[nH]c[nH+]2)C1 ZINC000855134172 588823007 /nfs/dbraw/zinc/82/30/07/588823007.db2.gz HNVSSYNUZTYHTG-VUUNSECVSA-N 1 2 233.315 2.115 20 0 BEADLO Cc1csc(C[N@@H+]2C[C@H]3[C@@H](C2)C3(F)F)n1 ZINC000844453375 582592143 /nfs/dbraw/zinc/59/21/43/582592143.db2.gz JLWHZCNRUGITJZ-OCAPTIKFSA-N 1 2 230.283 2.148 20 0 BEADLO Cc1csc(C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)n1 ZINC000844453375 582592145 /nfs/dbraw/zinc/59/21/45/582592145.db2.gz JLWHZCNRUGITJZ-OCAPTIKFSA-N 1 2 230.283 2.148 20 0 BEADLO COc1cccc2c[nH+]c(NC[C@@H](C)O)cc21 ZINC000891435920 582684421 /nfs/dbraw/zinc/68/44/21/582684421.db2.gz IBXBUEXUXZBUAH-SECBINFHSA-N 1 2 232.283 2.036 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cnc(F)c(C)c2)CCO1 ZINC000891561535 582697127 /nfs/dbraw/zinc/69/71/27/582697127.db2.gz CWXHTNVCTZBHOA-LBPRGKRZSA-N 1 2 238.306 2.140 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cnc(F)c(C)c2)CCO1 ZINC000891561535 582697129 /nfs/dbraw/zinc/69/71/29/582697129.db2.gz CWXHTNVCTZBHOA-LBPRGKRZSA-N 1 2 238.306 2.140 20 0 BEADLO Cc1cc(Br)cc(N2CCC2)[nH+]1 ZINC000891669217 582707553 /nfs/dbraw/zinc/70/75/53/582707553.db2.gz AKOHXPURFJTKJB-UHFFFAOYSA-N 1 2 227.105 2.363 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccnn2C2CCC2)[C@H](C)CO1 ZINC000891669240 582708291 /nfs/dbraw/zinc/70/82/91/582708291.db2.gz AQRNTASXVNPYCQ-VXGBXAGGSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccnn2C2CCC2)[C@H](C)CO1 ZINC000891669240 582708293 /nfs/dbraw/zinc/70/82/93/582708293.db2.gz AQRNTASXVNPYCQ-VXGBXAGGSA-N 1 2 249.358 2.217 20 0 BEADLO Cc1cc(N2CCC2)nc(C2CCC2)[nH+]1 ZINC000891670183 582708993 /nfs/dbraw/zinc/70/89/93/582708993.db2.gz HSLDOZIWRZYPTG-UHFFFAOYSA-N 1 2 203.289 2.263 20 0 BEADLO COc1cccc2c[nH+]c(N[C@H](C)CO)cc21 ZINC000891684064 582709899 /nfs/dbraw/zinc/70/98/99/582709899.db2.gz FKEITQYURVHUFQ-SECBINFHSA-N 1 2 232.283 2.036 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC(C)(C)C2)cnc1F ZINC000891705487 582711617 /nfs/dbraw/zinc/71/16/17/582711617.db2.gz GXXXWPMXINFTMP-UHFFFAOYSA-N 1 2 238.306 2.140 20 0 BEADLO Cc1cc(C[N@H+]2CCOC(C)(C)C2)cnc1F ZINC000891705487 582711620 /nfs/dbraw/zinc/71/16/20/582711620.db2.gz GXXXWPMXINFTMP-UHFFFAOYSA-N 1 2 238.306 2.140 20 0 BEADLO Cc1cc(F)ncc1C[N@@H+]1CCOCC1(C)C ZINC000891778907 582719347 /nfs/dbraw/zinc/71/93/47/582719347.db2.gz UZVDMHBQNMVQRZ-UHFFFAOYSA-N 1 2 238.306 2.140 20 0 BEADLO Cc1cc(F)ncc1C[N@H+]1CCOCC1(C)C ZINC000891778907 582719349 /nfs/dbraw/zinc/71/93/49/582719349.db2.gz UZVDMHBQNMVQRZ-UHFFFAOYSA-N 1 2 238.306 2.140 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCOCC2(C)C)o1 ZINC000891782713 582720288 /nfs/dbraw/zinc/72/02/88/582720288.db2.gz WXYCFGPIQGYXSL-UHFFFAOYSA-N 1 2 239.315 2.289 20 0 BEADLO CCOc1ccc(C[N@H+]2CCOCC2(C)C)o1 ZINC000891782713 582720289 /nfs/dbraw/zinc/72/02/89/582720289.db2.gz WXYCFGPIQGYXSL-UHFFFAOYSA-N 1 2 239.315 2.289 20 0 BEADLO COCCN(C)c1cc(C)[nH+]c(C2CCC2)n1 ZINC000891941163 582742027 /nfs/dbraw/zinc/74/20/27/582742027.db2.gz SNZUFZWCIPGCBC-UHFFFAOYSA-N 1 2 235.331 2.135 20 0 BEADLO CC(C)[C@H]1CCCN1c1cc(N(C)C)[nH+]cn1 ZINC000892009608 582760129 /nfs/dbraw/zinc/76/01/29/582760129.db2.gz LLFGIUGMDQTPQH-LLVKDONJSA-N 1 2 234.347 2.167 20 0 BEADLO CC(C)[C@H]1CCCN1c1cc(N(C)C)nc[nH+]1 ZINC000892009608 582760132 /nfs/dbraw/zinc/76/01/32/582760132.db2.gz LLFGIUGMDQTPQH-LLVKDONJSA-N 1 2 234.347 2.167 20 0 BEADLO Nc1nc(NC[C@H]2CC=CCC2)nc(C2CC2)[nH+]1 ZINC000892035191 582768157 /nfs/dbraw/zinc/76/81/57/582768157.db2.gz ADEAHDMOVSMPGN-VIFPVBQESA-N 1 2 245.330 2.099 20 0 BEADLO Nc1nc(NC[C@H]2CC=CCC2)[nH+]c(C2CC2)n1 ZINC000892035191 582768161 /nfs/dbraw/zinc/76/81/61/582768161.db2.gz ADEAHDMOVSMPGN-VIFPVBQESA-N 1 2 245.330 2.099 20 0 BEADLO CCc1cc(N(C)CCCOC)nc(CC)[nH+]1 ZINC000892036198 582769194 /nfs/dbraw/zinc/76/91/94/582769194.db2.gz HQWALBUSRFGMLL-UHFFFAOYSA-N 1 2 237.347 2.074 20 0 BEADLO Cc1cc(F)ncc1C[N@H+]1CCO[C@H](C)[C@H]1C ZINC000892049496 582774271 /nfs/dbraw/zinc/77/42/71/582774271.db2.gz QZBWVDLKIBBEEL-GHMZBOCLSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1cc(F)ncc1C[N@@H+]1CCO[C@H](C)[C@H]1C ZINC000892049496 582774272 /nfs/dbraw/zinc/77/42/72/582774272.db2.gz QZBWVDLKIBBEEL-GHMZBOCLSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1cc(F)ncc1C[N@H+]1CCO[C@@H](C)[C@@H]1C ZINC000892049498 582774303 /nfs/dbraw/zinc/77/43/03/582774303.db2.gz QZBWVDLKIBBEEL-QWRGUYRKSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1cc(F)ncc1C[N@@H+]1CCO[C@@H](C)[C@@H]1C ZINC000892049498 582774305 /nfs/dbraw/zinc/77/43/05/582774305.db2.gz QZBWVDLKIBBEEL-QWRGUYRKSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@H](C)[C@H]2C)cnc1F ZINC000892049259 582774356 /nfs/dbraw/zinc/77/43/56/582774356.db2.gz QKUUXBCNUZWNSM-GHMZBOCLSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@H](C)[C@H]2C)cnc1F ZINC000892049259 582774357 /nfs/dbraw/zinc/77/43/57/582774357.db2.gz QKUUXBCNUZWNSM-GHMZBOCLSA-N 1 2 238.306 2.138 20 0 BEADLO CCOc1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)o1 ZINC000892055749 582777951 /nfs/dbraw/zinc/77/79/51/582777951.db2.gz LAAMNGXXWUSUFV-PHIMTYICSA-N 1 2 237.299 2.042 20 0 BEADLO CCOc1ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)o1 ZINC000892055749 582777953 /nfs/dbraw/zinc/77/79/53/582777953.db2.gz LAAMNGXXWUSUFV-PHIMTYICSA-N 1 2 237.299 2.042 20 0 BEADLO Cc1nn(C)c(C[N@H+](C)C2CCC2)c1Cl ZINC000892058789 582778879 /nfs/dbraw/zinc/77/88/79/582778879.db2.gz HISWCIAEMUVWEM-UHFFFAOYSA-N 1 2 227.739 2.366 20 0 BEADLO Cc1nn(C)c(C[N@@H+](C)C2CCC2)c1Cl ZINC000892058789 582778882 /nfs/dbraw/zinc/77/88/82/582778882.db2.gz HISWCIAEMUVWEM-UHFFFAOYSA-N 1 2 227.739 2.366 20 0 BEADLO Cc1cc(N2CCC[C@@H]2CO)nc(C2CCC2)[nH+]1 ZINC000892073361 582786346 /nfs/dbraw/zinc/78/63/46/582786346.db2.gz NDCHMSRRWNUESA-GFCCVEGCSA-N 1 2 247.342 2.014 20 0 BEADLO CN(CC1CCCC1)c1nccn2c[nH+]cc12 ZINC000892125683 582795468 /nfs/dbraw/zinc/79/54/68/582795468.db2.gz ICFXGNCSHCBXRS-UHFFFAOYSA-N 1 2 230.315 2.356 20 0 BEADLO CCC(O)(CC)CNc1cccc([C@@H](C)O)[nH+]1 ZINC000892125797 582795481 /nfs/dbraw/zinc/79/54/81/582795481.db2.gz MXADRGQSICNPQT-SNVBAGLBSA-N 1 2 238.331 2.098 20 0 BEADLO CO[C@@H](C)CC(=O)Nc1c[nH+]c2c(C)cccn12 ZINC000855903367 588853362 /nfs/dbraw/zinc/85/33/62/588853362.db2.gz YZWQCFSGLLWTTI-JTQLQIEISA-N 1 2 247.298 2.006 20 0 BEADLO CN(C)c1cc(N2CCC(C)(C)CC2)nc[nH+]1 ZINC000892282530 582826877 /nfs/dbraw/zinc/82/68/77/582826877.db2.gz XRGJJTGYHCNPAO-UHFFFAOYSA-N 1 2 234.347 2.169 20 0 BEADLO CN(C)c1cc(N2CCC(C)(C)CC2)[nH+]cn1 ZINC000892282530 582826880 /nfs/dbraw/zinc/82/68/80/582826880.db2.gz XRGJJTGYHCNPAO-UHFFFAOYSA-N 1 2 234.347 2.169 20 0 BEADLO CCc1cc(N(C)CC(F)F)nc(CC)[nH+]1 ZINC000892324713 582845203 /nfs/dbraw/zinc/84/52/03/582845203.db2.gz CDYHJBXCJHDKTO-UHFFFAOYSA-N 1 2 229.274 2.303 20 0 BEADLO Cc1nn(C[N@H+]2CC[C@@H](C)C2)c(=S)s1 ZINC000725780348 582848667 /nfs/dbraw/zinc/84/86/67/582848667.db2.gz XXJDLUUJYOXFIP-SSDOTTSWSA-N 1 2 229.374 2.282 20 0 BEADLO Cc1nn(C[N@@H+]2CC[C@@H](C)C2)c(=S)s1 ZINC000725780348 582848669 /nfs/dbraw/zinc/84/86/69/582848669.db2.gz XXJDLUUJYOXFIP-SSDOTTSWSA-N 1 2 229.374 2.282 20 0 BEADLO COc1cccc2c[nH+]c(NCC[C@H](C)O)cc21 ZINC000892541093 582908916 /nfs/dbraw/zinc/90/89/16/582908916.db2.gz YLQDZTIUOUWWKR-JTQLQIEISA-N 1 2 246.310 2.426 20 0 BEADLO C[C@@H](CCO)Nc1cc(C2CC2)[nH+]c(C2CC2)n1 ZINC000892617156 582930846 /nfs/dbraw/zinc/93/08/46/582930846.db2.gz SWKDFYBOCWAQBR-VIFPVBQESA-N 1 2 247.342 2.414 20 0 BEADLO CCc1cc(N[C@H](CCO)C2CC2)nc(CC)[nH+]1 ZINC000892656844 582941655 /nfs/dbraw/zinc/94/16/55/582941655.db2.gz GPPSTXDRWLJEHO-GFCCVEGCSA-N 1 2 249.358 2.174 20 0 BEADLO C[C@@H](O)c1cccc(N[C@@H](C)c2cnn(C)c2)[nH+]1 ZINC000892663745 582944197 /nfs/dbraw/zinc/94/41/97/582944197.db2.gz ULHMQFCZWQAONM-VHSXEESVSA-N 1 2 246.314 2.042 20 0 BEADLO Cc1cc(N(C)CC[C@H](C)O)nc(C2CCC2)[nH+]1 ZINC000892684406 582954228 /nfs/dbraw/zinc/95/42/28/582954228.db2.gz RNGQNYYEWHLTGM-NSHDSACASA-N 1 2 249.358 2.260 20 0 BEADLO C[C@@H]1CC[C@H]1Nc1ccc(N2CCOCC2)c[nH+]1 ZINC000783279633 582955362 /nfs/dbraw/zinc/95/53/62/582955362.db2.gz YTYKCIMIVIHMTL-DGCLKSJQSA-N 1 2 247.342 2.129 20 0 BEADLO CCc1cc(NC[C@H]2CCC[C@@H]2O)nc(CC)[nH+]1 ZINC000892702756 582960731 /nfs/dbraw/zinc/96/07/31/582960731.db2.gz CEOHJXOCBMXCRF-PWSUYJOCSA-N 1 2 249.358 2.174 20 0 BEADLO CC(C(=O)N[C@H](C)c1[nH+]ccn1C)=C1CCCC1 ZINC000856277488 588866483 /nfs/dbraw/zinc/86/64/83/588866483.db2.gz KMQGSJRGPROCSC-LLVKDONJSA-N 1 2 247.342 2.488 20 0 BEADLO CO[C@H](CNc1cccc([C@H](C)O)[nH+]1)C(C)C ZINC000892753832 582975722 /nfs/dbraw/zinc/97/57/22/582975722.db2.gz XYJSRADPRPHJDA-CMPLNLGQSA-N 1 2 238.331 2.218 20 0 BEADLO CO[C@H](CNc1cccc([C@@H](C)O)[nH+]1)C(C)C ZINC000892753836 582976152 /nfs/dbraw/zinc/97/61/52/582976152.db2.gz XYJSRADPRPHJDA-ZYHUDNBSSA-N 1 2 238.331 2.218 20 0 BEADLO CC(C(=O)N[C@@H](C)c1[nH+]ccn1C)=C1CCC1 ZINC000856279247 588866948 /nfs/dbraw/zinc/86/69/48/588866948.db2.gz DLJSMGJZXDAIDT-JTQLQIEISA-N 1 2 233.315 2.098 20 0 BEADLO CCc1cc(Nc2cnn(C)c2C)nc(CC)[nH+]1 ZINC000892894795 583005301 /nfs/dbraw/zinc/00/53/01/583005301.db2.gz XTDXXQJAGXBFLL-UHFFFAOYSA-N 1 2 245.330 2.387 20 0 BEADLO CCc1cc(N2CCO[C@@H](C)[C@@H]2C)nc(CC)[nH+]1 ZINC000892941663 583013761 /nfs/dbraw/zinc/01/37/61/583013761.db2.gz GJJGZHQASXVGQS-QWRGUYRKSA-N 1 2 249.358 2.215 20 0 BEADLO CCc1cc(N2CCOC[C@H](C)C2)nc(CC)[nH+]1 ZINC000892973695 583023991 /nfs/dbraw/zinc/02/39/91/583023991.db2.gz VPEDGNUCBWJDTF-LLVKDONJSA-N 1 2 249.358 2.074 20 0 BEADLO CCc1cc(N[C@H](C)c2cn[nH]c2)nc(CC)[nH+]1 ZINC000892995791 583027131 /nfs/dbraw/zinc/02/71/31/583027131.db2.gz SSHNHYVMOAPMGK-SECBINFHSA-N 1 2 245.330 2.498 20 0 BEADLO CC(C)Oc1cc[nH+]cc1COC(=O)CCF ZINC000893010341 583029718 /nfs/dbraw/zinc/02/97/18/583029718.db2.gz ALEDPNYYWXNPAX-UHFFFAOYSA-N 1 2 241.262 2.272 20 0 BEADLO CNc1cc(N[C@H](C)c2ccc[nH]2)nc[nH+]1 ZINC000893021012 583030294 /nfs/dbraw/zinc/03/02/94/583030294.db2.gz BWLKEDLQBCWAST-MRVPVSSYSA-N 1 2 217.276 2.020 20 0 BEADLO CNc1cc(N[C@H](C)c2ccc[nH]2)[nH+]cn1 ZINC000893021012 583030298 /nfs/dbraw/zinc/03/02/98/583030298.db2.gz BWLKEDLQBCWAST-MRVPVSSYSA-N 1 2 217.276 2.020 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1c1cc(N(C)C)[nH+]cn1 ZINC000893092815 583048361 /nfs/dbraw/zinc/04/83/61/583048361.db2.gz RWZZLNSTPQNULS-WDEREUQCSA-N 1 2 234.347 2.310 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1c1cc(N(C)C)nc[nH+]1 ZINC000893092815 583048364 /nfs/dbraw/zinc/04/83/64/583048364.db2.gz RWZZLNSTPQNULS-WDEREUQCSA-N 1 2 234.347 2.310 20 0 BEADLO CCc1cc(N[C@@H](C)C[C@H](C)O)nc(CC)[nH+]1 ZINC000893127877 583054031 /nfs/dbraw/zinc/05/40/31/583054031.db2.gz QXAVHDNYGNBFOE-UWVGGRQHSA-N 1 2 237.347 2.173 20 0 BEADLO NC(=[NH+]OCCCC1CCC1)[C@H]1CCCO1 ZINC000853698964 583061911 /nfs/dbraw/zinc/06/19/11/583061911.db2.gz WEGRGTASSJBALT-LLVKDONJSA-N 1 2 226.320 2.244 20 0 BEADLO CCc1onc(C)c1C[NH2+]Cc1cccc(F)n1 ZINC000893203089 583070478 /nfs/dbraw/zinc/07/04/78/583070478.db2.gz SXGSQEDRYJGVOU-UHFFFAOYSA-N 1 2 249.289 2.369 20 0 BEADLO FC1(F)[C@H]2C[N@H+](Cc3cncc(Cl)c3)C[C@H]21 ZINC000856757122 588876025 /nfs/dbraw/zinc/87/60/25/588876025.db2.gz VYWGSQBCIOFYHP-AOOOYVTPSA-N 1 2 244.672 2.432 20 0 BEADLO FC1(F)[C@H]2C[N@@H+](Cc3cncc(Cl)c3)C[C@H]21 ZINC000856757122 588876026 /nfs/dbraw/zinc/87/60/26/588876026.db2.gz VYWGSQBCIOFYHP-AOOOYVTPSA-N 1 2 244.672 2.432 20 0 BEADLO C/C=C\C[C@H](CO)Nc1cc(CC)[nH+]c(CC)n1 ZINC000893239590 583076482 /nfs/dbraw/zinc/07/64/82/583076482.db2.gz SGJWAYMVYVIWOH-DJFZKKHWSA-N 1 2 249.358 2.340 20 0 BEADLO CCc1cc(N[C@@H]2C[C@@H](O)C2(C)C)nc(CC)[nH+]1 ZINC000893264829 583080454 /nfs/dbraw/zinc/08/04/54/583080454.db2.gz HQQZWNSMZGMJGA-GHMZBOCLSA-N 1 2 249.358 2.173 20 0 BEADLO CCc1nc(N(CC)[C@@H]2CCCOC2)cc(C)[nH+]1 ZINC000651415589 583086018 /nfs/dbraw/zinc/08/60/18/583086018.db2.gz IRZFJUNWYREJLK-GFCCVEGCSA-N 1 2 249.358 2.353 20 0 BEADLO COc1ccc2c(c1)[C@H]([NH2+]Cc1cocn1)CC2 ZINC000397738610 583107858 /nfs/dbraw/zinc/10/78/58/583107858.db2.gz CLBLROXIXVRBFA-CQSZACIVSA-N 1 2 244.294 2.460 20 0 BEADLO Cc1cnc(C(C)(C)[NH2+]Cc2cnccn2)s1 ZINC000856772389 588877189 /nfs/dbraw/zinc/87/71/89/588877189.db2.gz YIVNAYMKVVHBGP-UHFFFAOYSA-N 1 2 248.355 2.266 20 0 BEADLO C[C@H]1CC[C@H](Nc2cc(N(C)C)nc[nH+]2)C1 ZINC000893369335 583128522 /nfs/dbraw/zinc/12/85/22/583128522.db2.gz RKMFBIKYKGLJMR-UWVGGRQHSA-N 1 2 220.320 2.143 20 0 BEADLO C[C@H]1CC[C@H](Nc2cc(N(C)C)[nH+]cn2)C1 ZINC000893369335 583128523 /nfs/dbraw/zinc/12/85/23/583128523.db2.gz RKMFBIKYKGLJMR-UWVGGRQHSA-N 1 2 220.320 2.143 20 0 BEADLO Cc1cc(N(C)CCCCO)nc(C2CCC2)[nH+]1 ZINC000893428352 583142221 /nfs/dbraw/zinc/14/22/21/583142221.db2.gz QKLADFAHOBIPBD-UHFFFAOYSA-N 1 2 249.358 2.261 20 0 BEADLO Cc1c[nH+]c2n1CC[C@@H]2OC(=O)[C@H]1CC12CCC2 ZINC000893523608 583156746 /nfs/dbraw/zinc/15/67/46/583156746.db2.gz DYNCMSAJLFFOHA-MNOVXSKESA-N 1 2 246.310 2.370 20 0 BEADLO Cc1c[nH+]c2n1CC[C@@H]2OC(=O)[C@@H]1CC12CCC2 ZINC000893523609 583156994 /nfs/dbraw/zinc/15/69/94/583156994.db2.gz DYNCMSAJLFFOHA-QWRGUYRKSA-N 1 2 246.310 2.370 20 0 BEADLO CCN(Cc1[nH+]ccn1C1CC1)CC(F)F ZINC000893561462 583164402 /nfs/dbraw/zinc/16/44/02/583164402.db2.gz ITMCIHPWYCZEGL-UHFFFAOYSA-N 1 2 229.274 2.305 20 0 BEADLO CC[C@]1(C)COCCN1Cc1[nH+]ccn1C1CC1 ZINC000893664394 583191311 /nfs/dbraw/zinc/19/13/11/583191311.db2.gz ACZHZWUZFNCUIB-CQSZACIVSA-N 1 2 249.358 2.219 20 0 BEADLO C[C@H](O)c1cccc(N[C@H]2CSC[C@H]2C)[nH+]1 ZINC000893829451 583227127 /nfs/dbraw/zinc/22/71/27/583227127.db2.gz YNDKXTZEJKPCCP-YWVKMMECSA-N 1 2 238.356 2.298 20 0 BEADLO CN(C)c1cc(N[C@@H]2CCC2(C)C)[nH+]cn1 ZINC000893859086 583233643 /nfs/dbraw/zinc/23/36/43/583233643.db2.gz HNPODLXLVUDSFA-SECBINFHSA-N 1 2 220.320 2.143 20 0 BEADLO CN(C)c1cc(N[C@@H]2CCC2(C)C)nc[nH+]1 ZINC000893859086 583233646 /nfs/dbraw/zinc/23/36/46/583233646.db2.gz HNPODLXLVUDSFA-SECBINFHSA-N 1 2 220.320 2.143 20 0 BEADLO COc1ccc(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)o1 ZINC000893889051 583244462 /nfs/dbraw/zinc/24/44/62/583244462.db2.gz SRAFCRDXJCPWIV-DCAQKATOSA-N 1 2 239.315 2.286 20 0 BEADLO COc1ccc(C[N@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)o1 ZINC000893889051 583244465 /nfs/dbraw/zinc/24/44/65/583244465.db2.gz SRAFCRDXJCPWIV-DCAQKATOSA-N 1 2 239.315 2.286 20 0 BEADLO CCc1cc(NC[C@H](CC)OC)nc(CC)[nH+]1 ZINC000893917524 583247355 /nfs/dbraw/zinc/24/73/55/583247355.db2.gz IQXSETJRPRNVGA-NSHDSACASA-N 1 2 237.347 2.438 20 0 BEADLO CCN(c1cc(C)[nH+]c(C2CCC2)n1)[C@H](C)CO ZINC000893947647 583259499 /nfs/dbraw/zinc/25/94/99/583259499.db2.gz KJKPMACEASDLOK-LLVKDONJSA-N 1 2 249.358 2.260 20 0 BEADLO c1[nH+]cn2ccnc(N3CCC(C4CC4)CC3)c12 ZINC000893949802 583260584 /nfs/dbraw/zinc/26/05/84/583260584.db2.gz YJWOBXCMOHFAON-UHFFFAOYSA-N 1 2 242.326 2.356 20 0 BEADLO CSc1ccc(C[N@H+](C)Cc2cc[nH]n2)o1 ZINC000894017367 583273907 /nfs/dbraw/zinc/27/39/07/583273907.db2.gz NNORZNZCQOXXSW-UHFFFAOYSA-N 1 2 237.328 2.357 20 0 BEADLO CSc1ccc(C[N@@H+](C)Cc2cc[nH]n2)o1 ZINC000894017367 583273908 /nfs/dbraw/zinc/27/39/08/583273908.db2.gz NNORZNZCQOXXSW-UHFFFAOYSA-N 1 2 237.328 2.357 20 0 BEADLO Cc1coc(C[N@@H+]2CCOCC23CCC3)c1 ZINC000894036426 583279591 /nfs/dbraw/zinc/27/95/91/583279591.db2.gz XLFFIZQVYORQKX-UHFFFAOYSA-N 1 2 221.300 2.343 20 0 BEADLO Cc1coc(C[N@H+]2CCOCC23CCC3)c1 ZINC000894036426 583279594 /nfs/dbraw/zinc/27/95/94/583279594.db2.gz XLFFIZQVYORQKX-UHFFFAOYSA-N 1 2 221.300 2.343 20 0 BEADLO Cc1cc(CNc2cccc([C@H](C)O)[nH+]2)ccn1 ZINC000894028324 583281489 /nfs/dbraw/zinc/28/14/89/583281489.db2.gz NIZKQSAAVKYKMQ-NSHDSACASA-N 1 2 243.310 2.450 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CC[C@@H](C)[C@H]2C)c1C ZINC000894084304 583295933 /nfs/dbraw/zinc/29/59/33/583295933.db2.gz KCSCZJYNXFUVEL-LDYMZIIASA-N 1 2 207.321 2.257 20 0 BEADLO Cc1c(NCc2c[nH+]c[nH]2)cccc1N(C)C ZINC000894137716 583314326 /nfs/dbraw/zinc/31/43/26/583314326.db2.gz UFYIYUGXWDHUKG-UHFFFAOYSA-N 1 2 230.315 2.396 20 0 BEADLO Cc1c(NCc2c[nH]c[nH+]2)cccc1N(C)C ZINC000894137716 583314328 /nfs/dbraw/zinc/31/43/28/583314328.db2.gz UFYIYUGXWDHUKG-UHFFFAOYSA-N 1 2 230.315 2.396 20 0 BEADLO Cc1nn(C)c(C[NH+]2CC(C(C)C)C2)c1Cl ZINC000894135866 583314397 /nfs/dbraw/zinc/31/43/97/583314397.db2.gz XMGYLIDQWYXZLP-UHFFFAOYSA-N 1 2 241.766 2.470 20 0 BEADLO Cc1nn(C)c(C[N@H+]2[C@H](C)C[C@@H]2C)c1Cl ZINC000894138539 583315056 /nfs/dbraw/zinc/31/50/56/583315056.db2.gz FZLKFNPKICMXMA-OCAPTIKFSA-N 1 2 227.739 2.365 20 0 BEADLO Cc1nn(C)c(C[N@@H+]2[C@H](C)C[C@@H]2C)c1Cl ZINC000894138539 583315060 /nfs/dbraw/zinc/31/50/60/583315060.db2.gz FZLKFNPKICMXMA-OCAPTIKFSA-N 1 2 227.739 2.365 20 0 BEADLO Cc1nc(C[NH2+]Cc2c(C)ccnc2N)cs1 ZINC000894164448 583322487 /nfs/dbraw/zinc/32/24/87/583322487.db2.gz HMBRJNVUFJQQFV-UHFFFAOYSA-N 1 2 248.355 2.027 20 0 BEADLO CNc1cc(N[C@@H]2CCCC[C@H]2F)nc[nH+]1 ZINC000894200907 583337810 /nfs/dbraw/zinc/33/78/10/583337810.db2.gz GUXZEXKPBGBZHV-RKDXNWHRSA-N 1 2 224.283 2.211 20 0 BEADLO CNc1cc(N[C@@H]2CCCC[C@H]2F)[nH+]cn1 ZINC000894200907 583337814 /nfs/dbraw/zinc/33/78/14/583337814.db2.gz GUXZEXKPBGBZHV-RKDXNWHRSA-N 1 2 224.283 2.211 20 0 BEADLO COc1cc(C[NH2+]Cc2c[nH]cn2)ccc1C ZINC000894207650 583353637 /nfs/dbraw/zinc/35/36/37/583353637.db2.gz VAHRJDONQXYCIV-UHFFFAOYSA-N 1 2 231.299 2.017 20 0 BEADLO CCC[C@H](C)CC(=O)OCc1c[nH+]cn1C ZINC000747781419 583388413 /nfs/dbraw/zinc/38/84/13/583388413.db2.gz KXBBHXURRCUOHZ-JTQLQIEISA-N 1 2 224.304 2.290 20 0 BEADLO Clc1ccc2c(c1)[C@H]([NH2+]Cc1cnc[nH]1)CO2 ZINC000894333597 583426217 /nfs/dbraw/zinc/42/62/17/583426217.db2.gz OYWBPLFYDNXJRB-LLVKDONJSA-N 1 2 249.701 2.286 20 0 BEADLO Cc1ncoc1CNc1ccc(C)[nH+]c1 ZINC000894345282 583430564 /nfs/dbraw/zinc/43/05/64/583430564.db2.gz GKFGPJQLXMIWPU-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO CC[C@@]1(C)COCC[N@@H+]1Cc1[nH]nc(C)c1C ZINC000894486313 583471732 /nfs/dbraw/zinc/47/17/32/583471732.db2.gz XUHRYODQSRCBMW-ZDUSSCGKSA-N 1 2 237.347 2.027 20 0 BEADLO CC[C@@]1(C)COCC[N@H+]1Cc1[nH]nc(C)c1C ZINC000894486313 583471733 /nfs/dbraw/zinc/47/17/33/583471733.db2.gz XUHRYODQSRCBMW-ZDUSSCGKSA-N 1 2 237.347 2.027 20 0 BEADLO Cc1n[nH]c(C[N@@H+](C)Cc2ccc(C)cn2)c1C ZINC000894541043 583481027 /nfs/dbraw/zinc/48/10/27/583481027.db2.gz OHIYIGMRNDHNPI-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO Cc1n[nH]c(C[N@H+](C)Cc2ccc(C)cn2)c1C ZINC000894541043 583481029 /nfs/dbraw/zinc/48/10/29/583481029.db2.gz OHIYIGMRNDHNPI-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO CC[C@@H](O)CNc1cc(C)[nH+]c(C2CCC2)n1 ZINC000894551005 583482477 /nfs/dbraw/zinc/48/24/77/583482477.db2.gz OPMWRFJWAASORH-LLVKDONJSA-N 1 2 235.331 2.235 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)Cc1scnc1C1CC1 ZINC000894585385 583489015 /nfs/dbraw/zinc/48/90/15/583489015.db2.gz GWWCVTDIJRFRAK-UHFFFAOYSA-N 1 2 248.355 2.376 20 0 BEADLO COc1ccc(CN(C)Cc2[nH]cc[nH+]2)c(F)c1 ZINC000894587297 583490254 /nfs/dbraw/zinc/49/02/54/583490254.db2.gz ZDHNZTXVHIMBDN-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO CC(C)c1nnc(C[NH2+][C@@H](C)CF)s1 ZINC000894601083 583491573 /nfs/dbraw/zinc/49/15/73/583491573.db2.gz PKFRYUPXKDZIFO-ZETCQYMHSA-N 1 2 217.313 2.109 20 0 BEADLO CNc1cc(NCC2=CCCC2)nc[nH+]1 ZINC000894600052 583493755 /nfs/dbraw/zinc/49/37/55/583493755.db2.gz YYAWHOQLOVYNFP-UHFFFAOYSA-N 1 2 204.277 2.041 20 0 BEADLO CNc1cc(NCC2=CCCC2)[nH+]cn1 ZINC000894600052 583493756 /nfs/dbraw/zinc/49/37/56/583493756.db2.gz YYAWHOQLOVYNFP-UHFFFAOYSA-N 1 2 204.277 2.041 20 0 BEADLO CN(C)c1cc(NCC2=CCCC2)[nH+]cn1 ZINC000894599115 583493762 /nfs/dbraw/zinc/49/37/62/583493762.db2.gz HBLNFTHVDYWEMZ-UHFFFAOYSA-N 1 2 218.304 2.065 20 0 BEADLO CN(C)c1cc(NCC2=CCCC2)nc[nH+]1 ZINC000894599115 583493764 /nfs/dbraw/zinc/49/37/64/583493764.db2.gz HBLNFTHVDYWEMZ-UHFFFAOYSA-N 1 2 218.304 2.065 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1cc(C)cnc1Cl ZINC000894613238 583494156 /nfs/dbraw/zinc/49/41/56/583494156.db2.gz UMJKJHHZBVSEST-NSHDSACASA-N 1 2 240.734 2.264 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1cc(C)cnc1Cl ZINC000894613238 583494157 /nfs/dbraw/zinc/49/41/57/583494157.db2.gz UMJKJHHZBVSEST-NSHDSACASA-N 1 2 240.734 2.264 20 0 BEADLO Cc1nn(C)c(C[N@H+]2C[C@@H](C)[C@@H]2C)c1Cl ZINC000894629161 583497348 /nfs/dbraw/zinc/49/73/48/583497348.db2.gz UOFPRKCYTIKAGK-APPZFPTMSA-N 1 2 227.739 2.222 20 0 BEADLO Cc1nn(C)c(C[N@@H+]2C[C@@H](C)[C@@H]2C)c1Cl ZINC000894629161 583497350 /nfs/dbraw/zinc/49/73/50/583497350.db2.gz UOFPRKCYTIKAGK-APPZFPTMSA-N 1 2 227.739 2.222 20 0 BEADLO CCOc1ccc(C[N@H+](C(C)C)C2COC2)o1 ZINC000894658453 583499043 /nfs/dbraw/zinc/49/90/43/583499043.db2.gz IDSFFVFPZMDJLT-UHFFFAOYSA-N 1 2 239.315 2.288 20 0 BEADLO CCOc1ccc(C[N@@H+](C(C)C)C2COC2)o1 ZINC000894658453 583499044 /nfs/dbraw/zinc/49/90/44/583499044.db2.gz IDSFFVFPZMDJLT-UHFFFAOYSA-N 1 2 239.315 2.288 20 0 BEADLO CCOc1ccc(C[N@H+](C2CC2)C2COC2)o1 ZINC000894658456 583500549 /nfs/dbraw/zinc/50/05/49/583500549.db2.gz IETNKTXLLUFTFT-UHFFFAOYSA-N 1 2 237.299 2.042 20 0 BEADLO CCOc1ccc(C[N@@H+](C2CC2)C2COC2)o1 ZINC000894658456 583500551 /nfs/dbraw/zinc/50/05/51/583500551.db2.gz IETNKTXLLUFTFT-UHFFFAOYSA-N 1 2 237.299 2.042 20 0 BEADLO Cc1cc(F)ncc1C[N@@H+]1CC[C@@H](F)C1 ZINC000894670700 583503121 /nfs/dbraw/zinc/50/31/21/583503121.db2.gz KVLOILCHUGEXGL-SNVBAGLBSA-N 1 2 212.243 2.073 20 0 BEADLO Cc1cc(F)ncc1C[N@H+]1CC[C@@H](F)C1 ZINC000894670700 583503125 /nfs/dbraw/zinc/50/31/25/583503125.db2.gz KVLOILCHUGEXGL-SNVBAGLBSA-N 1 2 212.243 2.073 20 0 BEADLO Cc1cc(F)ncc1C[N@@H+]1CC[C@H](F)C1 ZINC000894670699 583503385 /nfs/dbraw/zinc/50/33/85/583503385.db2.gz KVLOILCHUGEXGL-JTQLQIEISA-N 1 2 212.243 2.073 20 0 BEADLO Cc1cc(F)ncc1C[N@H+]1CC[C@H](F)C1 ZINC000894670699 583503386 /nfs/dbraw/zinc/50/33/86/583503386.db2.gz KVLOILCHUGEXGL-JTQLQIEISA-N 1 2 212.243 2.073 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@H](F)C2)cnc1F ZINC000894673258 583504046 /nfs/dbraw/zinc/50/40/46/583504046.db2.gz YOAYZCVLPJXABS-JTQLQIEISA-N 1 2 212.243 2.073 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@H](F)C2)cnc1F ZINC000894673258 583504048 /nfs/dbraw/zinc/50/40/48/583504048.db2.gz YOAYZCVLPJXABS-JTQLQIEISA-N 1 2 212.243 2.073 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC[C@@H](CF)C2)s1 ZINC000880236792 583505894 /nfs/dbraw/zinc/50/58/94/583505894.db2.gz IYBDXTVEXOQVOV-VIFPVBQESA-N 1 2 229.324 2.028 20 0 BEADLO Cc1nnc(C[N@H+]2CCC[C@@H](CF)C2)s1 ZINC000880236792 583505896 /nfs/dbraw/zinc/50/58/96/583505896.db2.gz IYBDXTVEXOQVOV-VIFPVBQESA-N 1 2 229.324 2.028 20 0 BEADLO FC[C@@H]1CCC[N@H+](Cc2nc(C(F)F)no2)C1 ZINC000880237971 583507629 /nfs/dbraw/zinc/50/76/29/583507629.db2.gz LSQBPXFLOONLII-ZETCQYMHSA-N 1 2 249.236 2.189 20 0 BEADLO FC[C@@H]1CCC[N@@H+](Cc2nc(C(F)F)no2)C1 ZINC000880237971 583507630 /nfs/dbraw/zinc/50/76/30/583507630.db2.gz LSQBPXFLOONLII-ZETCQYMHSA-N 1 2 249.236 2.189 20 0 BEADLO CCc1ncc(C[NH2+]Cc2ccc(OC)o2)o1 ZINC000894752207 583516297 /nfs/dbraw/zinc/51/62/97/583516297.db2.gz AFECYWLWNJTPTF-UHFFFAOYSA-N 1 2 236.271 2.128 20 0 BEADLO CCc1nc(N2CC(C)(C)CC[C@H]2CO)cc[nH+]1 ZINC000894789335 583520067 /nfs/dbraw/zinc/52/00/67/583520067.db2.gz DRLIVGITHHLUJK-NSHDSACASA-N 1 2 249.358 2.026 20 0 BEADLO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1cnc[nH]1 ZINC000894786374 583521830 /nfs/dbraw/zinc/52/18/30/583521830.db2.gz HDOREMZZZKJRDR-NOZJJQNGSA-N 1 2 229.283 2.022 20 0 BEADLO CCOC1C[NH+](CCc2ccc(F)c(F)c2)C1 ZINC000894820611 583525176 /nfs/dbraw/zinc/52/51/76/583525176.db2.gz ZQCPGHRXOUZIDZ-UHFFFAOYSA-N 1 2 241.281 2.228 20 0 BEADLO Oc1ccc(C[NH+]2CC(C(F)F)C2)cc1F ZINC000894827843 583526523 /nfs/dbraw/zinc/52/65/23/583526523.db2.gz HSBBDZQGRVVSEJ-UHFFFAOYSA-N 1 2 231.217 2.228 20 0 BEADLO CCc1onc(C)c1C[NH+]1CC(C(F)F)C1 ZINC000894830379 583527827 /nfs/dbraw/zinc/52/78/27/583527827.db2.gz MZXKVJPTJFXEJZ-UHFFFAOYSA-N 1 2 230.258 2.242 20 0 BEADLO CSC1CCN(c2nccn3c[nH+]cc23)CC1 ZINC000894859645 583534255 /nfs/dbraw/zinc/53/42/55/583534255.db2.gz YGJXDEQPUFYMRZ-UHFFFAOYSA-N 1 2 248.355 2.061 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc(C(F)(F)F)nn2C)[C@@H]1C ZINC000894862267 583535363 /nfs/dbraw/zinc/53/53/63/583535363.db2.gz WPCJKTHTKIHSPA-HTQZYQBOSA-N 1 2 247.264 2.279 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc(C(F)(F)F)nn2C)[C@@H]1C ZINC000894862267 583535365 /nfs/dbraw/zinc/53/53/65/583535365.db2.gz WPCJKTHTKIHSPA-HTQZYQBOSA-N 1 2 247.264 2.279 20 0 BEADLO CCC[C@@H](CCO)Nc1cccc([C@@H](C)O)[nH+]1 ZINC000894867830 583538225 /nfs/dbraw/zinc/53/82/25/583538225.db2.gz SHVUBDJYVOETKG-MNOVXSKESA-N 1 2 238.331 2.098 20 0 BEADLO C[C@@H](NC(=O)/C=C/c1ccccc1)c1[nH]cc[nH+]1 ZINC000141078033 583549451 /nfs/dbraw/zinc/54/94/51/583549451.db2.gz OWHMFNRDHGRIMK-WSKFYRRCSA-N 1 2 241.294 2.300 20 0 BEADLO Cc1nc2c(s1)CN(c1cc[nH+]c(C)n1)C2 ZINC000894907347 583554381 /nfs/dbraw/zinc/55/43/81/583554381.db2.gz NCTCGPPINFLOGH-UHFFFAOYSA-N 1 2 232.312 2.070 20 0 BEADLO CCn1ccnc1[C@@H](C)[NH2+][C@@H](C)c1cnccn1 ZINC000894911957 583554804 /nfs/dbraw/zinc/55/48/04/583554804.db2.gz OXORMSPXLLOZGB-WDEREUQCSA-N 1 2 245.330 2.105 20 0 BEADLO CC(C)OC1CN(c2cc[nH+]c(C(C)C)n2)C1 ZINC000894967600 583560826 /nfs/dbraw/zinc/56/08/26/583560826.db2.gz NAJCLEINIGGNTL-UHFFFAOYSA-N 1 2 235.331 2.214 20 0 BEADLO CC(C)c1c[nH]c(C[NH+]2CC3(C2)CCOCC3)n1 ZINC000894976051 583562682 /nfs/dbraw/zinc/56/26/82/583562682.db2.gz IEKVFBLXZFXJGU-UHFFFAOYSA-N 1 2 249.358 2.146 20 0 BEADLO Cc1noc(C)c1C[NH2+][C@@H]1CCCc2cn[nH]c21 ZINC000857850108 588912412 /nfs/dbraw/zinc/91/24/12/588912412.db2.gz OFJCSECZQIMASM-GFCCVEGCSA-N 1 2 246.314 2.182 20 0 BEADLO Cc1noc(C)c1C[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000857850108 588912413 /nfs/dbraw/zinc/91/24/13/588912413.db2.gz OFJCSECZQIMASM-GFCCVEGCSA-N 1 2 246.314 2.182 20 0 BEADLO Cc1c(NCc2c[nH+]c[nH]2)n[nH]c1C(C)C ZINC000895079969 583582766 /nfs/dbraw/zinc/58/27/66/583582766.db2.gz YKPAJZMEPXFIBH-UHFFFAOYSA-N 1 2 219.292 2.177 20 0 BEADLO Cc1c(NCc2c[nH]c[nH+]2)n[nH]c1C(C)C ZINC000895079969 583582768 /nfs/dbraw/zinc/58/27/68/583582768.db2.gz YKPAJZMEPXFIBH-UHFFFAOYSA-N 1 2 219.292 2.177 20 0 BEADLO Cc1[nH+]cnc(NC[C@H]2CCO[C@@H](C)C2)c1C ZINC000882153318 583595471 /nfs/dbraw/zinc/59/54/71/583595471.db2.gz FKVBCGOLIIDUBY-CABZTGNLSA-N 1 2 235.331 2.320 20 0 BEADLO Cc1n[nH]c(C[N@H+]2C[C@H](C)OCC23CCC3)c1C ZINC000895141442 583603297 /nfs/dbraw/zinc/60/32/97/583603297.db2.gz AJFPUMAIWYKFKS-JTQLQIEISA-N 1 2 249.358 2.170 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2C[C@H](C)OCC23CCC3)c1C ZINC000895141442 583603298 /nfs/dbraw/zinc/60/32/98/583603298.db2.gz AJFPUMAIWYKFKS-JTQLQIEISA-N 1 2 249.358 2.170 20 0 BEADLO CN(C)c1cc(F)cc(NCc2c[nH+]c[nH]2)c1 ZINC000895176580 583616061 /nfs/dbraw/zinc/61/60/61/583616061.db2.gz QQMHCUOQYWEVCU-UHFFFAOYSA-N 1 2 234.278 2.227 20 0 BEADLO CN(C)c1cc(F)cc(NCc2c[nH]c[nH+]2)c1 ZINC000895176580 583616062 /nfs/dbraw/zinc/61/60/62/583616062.db2.gz QQMHCUOQYWEVCU-UHFFFAOYSA-N 1 2 234.278 2.227 20 0 BEADLO Cc1cc(N[C@]23C[C@H]2COC3)nc(C2CCC2)[nH+]1 ZINC000895195280 583623120 /nfs/dbraw/zinc/62/31/20/583623120.db2.gz QIVSAEMMCLQGGS-FZMZJTMJSA-N 1 2 245.326 2.253 20 0 BEADLO Cc1cc(C[NH+]2CC3(CC3(F)F)C2)cnc1F ZINC000895199425 583623882 /nfs/dbraw/zinc/62/38/82/583623882.db2.gz JRHZWUULRWGFLE-UHFFFAOYSA-N 1 2 242.244 2.370 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2CCO[C@@](C)(C3CC3)C2)c1C ZINC000895231249 583628981 /nfs/dbraw/zinc/62/89/81/583628981.db2.gz QCYVZGHNHJKUNO-CQSZACIVSA-N 1 2 249.358 2.027 20 0 BEADLO Cc1n[nH]c(C[N@H+]2CCO[C@@](C)(C3CC3)C2)c1C ZINC000895231249 583628983 /nfs/dbraw/zinc/62/89/83/583628983.db2.gz QCYVZGHNHJKUNO-CQSZACIVSA-N 1 2 249.358 2.027 20 0 BEADLO Cc1ncoc1C[NH2+][C@H](C)c1cscn1 ZINC000895254517 583633643 /nfs/dbraw/zinc/63/36/43/583633643.db2.gz UFUCVSFTANMLPY-SSDOTTSWSA-N 1 2 223.301 2.290 20 0 BEADLO CSCCO[NH+]=C(N)c1ccccc1C ZINC000727400402 583640196 /nfs/dbraw/zinc/64/01/96/583640196.db2.gz XCRSUWZXSWUNPY-UHFFFAOYSA-N 1 2 224.329 2.205 20 0 BEADLO CC1=NO[C@H](C[NH2+]Cc2nc3ccccc3o2)C1 ZINC000895305626 583643411 /nfs/dbraw/zinc/64/34/11/583643411.db2.gz VOPLTPSIDIHXNQ-JTQLQIEISA-N 1 2 245.282 2.082 20 0 BEADLO CCOc1ccc(NCc2c[nH]cn2)[nH+]c1C ZINC000895340035 583654307 /nfs/dbraw/zinc/65/43/07/583654307.db2.gz FKRGTCXOIBFDAH-UHFFFAOYSA-N 1 2 232.287 2.124 20 0 BEADLO Cc1noc(C)c1CC[N@@H+]1Cc2ccncc2C1 ZINC000857877524 588919153 /nfs/dbraw/zinc/91/91/53/588919153.db2.gz FWMYNQNHQGSAEL-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1noc(C)c1CC[N@H+]1Cc2ccncc2C1 ZINC000857877524 588919155 /nfs/dbraw/zinc/91/91/55/588919155.db2.gz FWMYNQNHQGSAEL-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO C[C@@H]1C[C@H]1C(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000727496316 583661865 /nfs/dbraw/zinc/66/18/65/583661865.db2.gz MWMFPWSNFLFXFD-UTUOFQBUSA-N 1 2 249.358 2.070 20 0 BEADLO FC(F)[C@H]1CC[N@H+]1CCC1CCOCC1 ZINC000895430099 583669672 /nfs/dbraw/zinc/66/96/72/583669672.db2.gz AXZNYAFIKFIWGJ-SNVBAGLBSA-N 1 2 219.275 2.143 20 0 BEADLO COCc1ccc(NCc2c[nH+]c[nH]2)cc1OC ZINC000895412518 583666362 /nfs/dbraw/zinc/66/63/62/583666362.db2.gz YBMRKHHSYCVWEA-UHFFFAOYSA-N 1 2 247.298 2.177 20 0 BEADLO COCc1ccc(NCc2c[nH]c[nH+]2)cc1OC ZINC000895412518 583666363 /nfs/dbraw/zinc/66/63/63/583666363.db2.gz YBMRKHHSYCVWEA-UHFFFAOYSA-N 1 2 247.298 2.177 20 0 BEADLO OCc1cc[nH+]c(NCC[C@@H]2CC[C@@H]3C[C@@H]32)c1 ZINC000895424887 583667527 /nfs/dbraw/zinc/66/75/27/583667527.db2.gz BIZWCAXPDINYSV-YNEHKIRRSA-N 1 2 232.327 2.422 20 0 BEADLO FC(F)[C@H]1CC[N@@H+]1CCC1CCOCC1 ZINC000895430099 583669670 /nfs/dbraw/zinc/66/96/70/583669670.db2.gz AXZNYAFIKFIWGJ-SNVBAGLBSA-N 1 2 219.275 2.143 20 0 BEADLO CSC1(C[N@@H+]2CC[C@H]2C(F)F)CC1 ZINC000895430372 583669799 /nfs/dbraw/zinc/66/97/99/583669799.db2.gz CWCFEAFRPWKEMO-ZETCQYMHSA-N 1 2 207.289 2.221 20 0 BEADLO CSC1(C[N@H+]2CC[C@H]2C(F)F)CC1 ZINC000895430372 583669800 /nfs/dbraw/zinc/66/98/00/583669800.db2.gz CWCFEAFRPWKEMO-ZETCQYMHSA-N 1 2 207.289 2.221 20 0 BEADLO CSC1(C[N@@H+]2CC[C@@H]2C(F)F)CC1 ZINC000895430370 583669820 /nfs/dbraw/zinc/66/98/20/583669820.db2.gz CWCFEAFRPWKEMO-SSDOTTSWSA-N 1 2 207.289 2.221 20 0 BEADLO CSC1(C[N@H+]2CC[C@@H]2C(F)F)CC1 ZINC000895430370 583669821 /nfs/dbraw/zinc/66/98/21/583669821.db2.gz CWCFEAFRPWKEMO-SSDOTTSWSA-N 1 2 207.289 2.221 20 0 BEADLO CC[C@H](C)[C@H](C[N@@H+]1CC[C@@H]1C(F)F)OC ZINC000895431426 583671087 /nfs/dbraw/zinc/67/10/87/583671087.db2.gz MOFWGNPRCJXJDR-AEJSXWLSSA-N 1 2 221.291 2.387 20 0 BEADLO CC[C@H](C)[C@H](C[N@H+]1CC[C@@H]1C(F)F)OC ZINC000895431426 583671089 /nfs/dbraw/zinc/67/10/89/583671089.db2.gz MOFWGNPRCJXJDR-AEJSXWLSSA-N 1 2 221.291 2.387 20 0 BEADLO C[C@@H]([NH2+][C@H]1[C@@H]2CCC[C@@H]21)C(=O)OC(C)(C)C ZINC000895432745 583671564 /nfs/dbraw/zinc/67/15/64/583671564.db2.gz DDNMNWJAMUAYKC-ZNSHCXBVSA-N 1 2 225.332 2.105 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N2CCC[C@@H](C)C2)c[nH+]1 ZINC000895451748 583676388 /nfs/dbraw/zinc/67/63/88/583676388.db2.gz MKQJBJPVSJGXGR-LLVKDONJSA-N 1 2 249.358 2.185 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N2CCC[C@H](C)C2)c[nH+]1 ZINC000895451749 583676653 /nfs/dbraw/zinc/67/66/53/583676653.db2.gz MKQJBJPVSJGXGR-NSHDSACASA-N 1 2 249.358 2.185 20 0 BEADLO CC(=O)OC[C@@H](C)[NH2+]CC(F)(F)C(C)(C)C ZINC000895461575 583677604 /nfs/dbraw/zinc/67/76/04/583677604.db2.gz RLUATNKTOSOBKM-MRVPVSSYSA-N 1 2 237.290 2.209 20 0 BEADLO Cc1nnc(C[NH+]2CC(CC3CC3)C2)s1 ZINC000895516262 583683259 /nfs/dbraw/zinc/68/32/59/583683259.db2.gz QTYYDUVMXLYYEC-UHFFFAOYSA-N 1 2 223.345 2.078 20 0 BEADLO C[C@H](O)c1cccc(N[C@@H]2CCO[C@H]2C2CC2)[nH+]1 ZINC000895543350 583688838 /nfs/dbraw/zinc/68/88/38/583688838.db2.gz JOKWAWATZPHQLZ-BHYNMZESSA-N 1 2 248.326 2.114 20 0 BEADLO CC(C)c1c[nH]c(C[NH+]2CCC(F)CC2)n1 ZINC000895545106 583689621 /nfs/dbraw/zinc/68/96/21/583689621.db2.gz BWDVGXZLQCIWNF-UHFFFAOYSA-N 1 2 225.311 2.467 20 0 BEADLO Cn1ncc(Cl)c1C[NH+]1CCC(F)CC1 ZINC000895547023 583690684 /nfs/dbraw/zinc/69/06/84/583690684.db2.gz IFKIREVWHQCXRA-UHFFFAOYSA-N 1 2 231.702 2.007 20 0 BEADLO COc1ccc(C[NH+]2CC3(C2)CCCO3)c(C)c1 ZINC000895589225 583695029 /nfs/dbraw/zinc/69/50/29/583695029.db2.gz JUVDGTDMMDYRFG-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO Cn1nccc1[C@@H]1CCCN1c1cc[nH+]cc1F ZINC000895717071 583711586 /nfs/dbraw/zinc/71/15/86/583711586.db2.gz FNIYYNYNZUGALF-ZDUSSCGKSA-N 1 2 246.289 2.296 20 0 BEADLO Cc1sccc1C[N@@H+]1CCc2ncncc2C1 ZINC000895724862 583713236 /nfs/dbraw/zinc/71/32/36/583713236.db2.gz VJVPOBRBLKGNCF-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1sccc1C[N@H+]1CCc2ncncc2C1 ZINC000895724862 583713238 /nfs/dbraw/zinc/71/32/38/583713238.db2.gz VJVPOBRBLKGNCF-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO C[C@@H](CC[NH2+][C@H]1CCOC1=O)c1ccccc1 ZINC000895804396 583731546 /nfs/dbraw/zinc/73/15/46/583731546.db2.gz RGWCTQMVKYGFBZ-AAEUAGOBSA-N 1 2 233.311 2.085 20 0 BEADLO CCCCc1cc(N[C@@H]2COC[C@@H]2C)nc[nH+]1 ZINC000895910772 583745711 /nfs/dbraw/zinc/74/57/11/583745711.db2.gz WBTOPSIOOULPHH-CMPLNLGQSA-N 1 2 235.331 2.266 20 0 BEADLO O=C(N[C@@H]1CCn2c[nH+]cc21)C1CC2(CCC2)C1 ZINC000857976825 588926277 /nfs/dbraw/zinc/92/62/77/588926277.db2.gz MSDWVFIZKXZFRJ-LLVKDONJSA-N 1 2 245.326 2.024 20 0 BEADLO C[C@@H]1CC=C(C(=O)N[C@H]2CCn3c[nH+]cc32)CC1 ZINC000857976313 588926324 /nfs/dbraw/zinc/92/63/24/588926324.db2.gz AZIOTDHPHOQBLU-PWSUYJOCSA-N 1 2 245.326 2.191 20 0 BEADLO CC(C)OC1C[NH+](Cc2ccc3c[nH]nc3c2)C1 ZINC000895952243 583751564 /nfs/dbraw/zinc/75/15/64/583751564.db2.gz KZFMFCFGOUJEHZ-UHFFFAOYSA-N 1 2 245.326 2.172 20 0 BEADLO CC(C)OC1C[NH+](Cc2ccc3c(c2)CCO3)C1 ZINC000895952320 583751576 /nfs/dbraw/zinc/75/15/76/583751576.db2.gz LYDFVBJWSCBCRE-UHFFFAOYSA-N 1 2 247.338 2.231 20 0 BEADLO C[C@@H]1CC=C(C(=O)N[C@@H]2CCn3c[nH+]cc32)CC1 ZINC000857976314 588926485 /nfs/dbraw/zinc/92/64/85/588926485.db2.gz AZIOTDHPHOQBLU-ZYHUDNBSSA-N 1 2 245.326 2.191 20 0 BEADLO CC(C)OC1C[NH+](Cc2ccc3c(n2)CCC3)C1 ZINC000895955613 583752856 /nfs/dbraw/zinc/75/28/56/583752856.db2.gz UBNVZAJXEWXIOH-UHFFFAOYSA-N 1 2 246.354 2.180 20 0 BEADLO CC(C)CCCC(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857977839 588926668 /nfs/dbraw/zinc/92/66/68/588926668.db2.gz HVUSNPCLVKKBAH-LLVKDONJSA-N 1 2 235.331 2.270 20 0 BEADLO C[C@]1(C(=O)N[C@H]2CCn3c[nH+]cc32)CC=CCC1 ZINC000857977776 588926685 /nfs/dbraw/zinc/92/66/85/588926685.db2.gz ZINFXCQWBOMTSD-FZMZJTMJSA-N 1 2 245.326 2.191 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857979315 588927339 /nfs/dbraw/zinc/92/73/39/588927339.db2.gz AYKBSGPTLDTYRD-PFEDMVJOSA-N 1 2 247.342 2.437 20 0 BEADLO COCCOC[C@@H](C)Nc1c[nH+]c(C)c(C)c1 ZINC000896020435 583763867 /nfs/dbraw/zinc/76/38/67/583763867.db2.gz ATXVKTWCSRQRRI-LLVKDONJSA-N 1 2 238.331 2.162 20 0 BEADLO Cc1nnc(CNc2c[nH+]c(C)c(C)c2)s1 ZINC000896023197 583764329 /nfs/dbraw/zinc/76/43/29/583764329.db2.gz YNWREVMUWJLKEB-UHFFFAOYSA-N 1 2 234.328 2.470 20 0 BEADLO CC/C(C)=C(/C)C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857979230 588927704 /nfs/dbraw/zinc/92/77/04/588927704.db2.gz ACDIPHAHQSFOGG-DWOQACPDSA-N 1 2 233.315 2.191 20 0 BEADLO Cc1nn(C)c(C[N@H+](C)CCCF)c1Cl ZINC000896069628 583767868 /nfs/dbraw/zinc/76/78/68/583767868.db2.gz FAHVJZBKZFQIDQ-UHFFFAOYSA-N 1 2 233.718 2.173 20 0 BEADLO Cc1nn(C)c(C[N@@H+](C)CCCF)c1Cl ZINC000896069628 583767870 /nfs/dbraw/zinc/76/78/70/583767870.db2.gz FAHVJZBKZFQIDQ-UHFFFAOYSA-N 1 2 233.718 2.173 20 0 BEADLO CCC(CC)CC(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857982515 588927767 /nfs/dbraw/zinc/92/77/67/588927767.db2.gz JTDDYVOERCKUCM-LLVKDONJSA-N 1 2 235.331 2.270 20 0 BEADLO Cc1cc(NC[C@@H]2C[C@H]2C(F)(F)F)nc[nH+]1 ZINC000896089739 583769292 /nfs/dbraw/zinc/76/92/92/583769292.db2.gz VBVKWYIOARMIQY-JGVFFNPUSA-N 1 2 231.221 2.395 20 0 BEADLO CC1(C)CCC[C@@H]1C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857982203 588927993 /nfs/dbraw/zinc/92/79/93/588927993.db2.gz NOPVWHDUMFYNSA-MNOVXSKESA-N 1 2 247.342 2.270 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857981823 588927995 /nfs/dbraw/zinc/92/79/95/588927995.db2.gz JNCAYWUKAKHRJF-AXFHLTTASA-N 1 2 235.331 2.126 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857981825 588928207 /nfs/dbraw/zinc/92/82/07/588928207.db2.gz JNCAYWUKAKHRJF-GARJFASQSA-N 1 2 235.331 2.126 20 0 BEADLO CCC[C@H](O)CCNc1ccc([C@H](C)O)c[nH+]1 ZINC000896181848 583778518 /nfs/dbraw/zinc/77/85/18/583778518.db2.gz GLQXWSYCFGHGNZ-JQWIXIFHSA-N 1 2 238.331 2.098 20 0 BEADLO CCC[C@H](O)CCNc1cccc([C@@H](C)O)[nH+]1 ZINC000896182330 583779113 /nfs/dbraw/zinc/77/91/13/583779113.db2.gz IQKFZGRDQAPBCR-MNOVXSKESA-N 1 2 238.331 2.098 20 0 BEADLO Cc1cc(NC[C@@]2(C)CCCCO2)nc[nH+]1 ZINC000896179610 583779683 /nfs/dbraw/zinc/77/96/83/583779683.db2.gz VFGXYZVALRLBNA-GFCCVEGCSA-N 1 2 221.304 2.156 20 0 BEADLO C[C@@H]1C[C@H](Nc2cc(CO)cc[nH+]2)CCS1 ZINC000896245074 583784710 /nfs/dbraw/zinc/78/47/10/583784710.db2.gz DBOLKGOJAJJYKY-MWLCHTKSSA-N 1 2 238.356 2.270 20 0 BEADLO C[C@H]1C[C@@H](Nc2cc(CO)cc[nH+]2)CCS1 ZINC000896245075 583784857 /nfs/dbraw/zinc/78/48/57/583784857.db2.gz DBOLKGOJAJJYKY-ONGXEEELSA-N 1 2 238.356 2.270 20 0 BEADLO CCN(CC1CC1)C(=O)C(C)(C)n1c[nH+]c(C)c1 ZINC000896312387 583790637 /nfs/dbraw/zinc/79/06/37/583790637.db2.gz PDSYBWZFGLHCQP-UHFFFAOYSA-N 1 2 249.358 2.185 20 0 BEADLO O=C(CCC1CCCC1)N[C@@H]1CCn2c[nH+]cc21 ZINC000857990080 588929756 /nfs/dbraw/zinc/92/97/56/588929756.db2.gz MUDJIZAKJFCPSG-GFCCVEGCSA-N 1 2 247.342 2.415 20 0 BEADLO Cc1ccc(C(=O)N[C@@H]2CCn3c[nH+]cc32)cc1 ZINC000857990674 588929847 /nfs/dbraw/zinc/92/98/47/588929847.db2.gz QVYKATYPGLSODA-GFCCVEGCSA-N 1 2 241.294 2.066 20 0 BEADLO COC[C@H](Cc1ccccc1)[NH2+][C@H](C)C(F)F ZINC000883399244 583794094 /nfs/dbraw/zinc/79/40/94/583794094.db2.gz IERMEPZYMZKMTC-PWSUYJOCSA-N 1 2 243.297 2.487 20 0 BEADLO Cc1c[nH+]c2c(c1)N(C(=O)[C@@H](C)C1CC1)CCN2 ZINC000857997769 588930269 /nfs/dbraw/zinc/93/02/69/588930269.db2.gz UKGVHUYZFFAREZ-JTQLQIEISA-N 1 2 245.326 2.195 20 0 BEADLO Cc1c[nH+]c2c(c1)N(C(=O)/C=C\C1CC1)CCN2 ZINC000857997366 588930327 /nfs/dbraw/zinc/93/03/27/588930327.db2.gz LWXBNKVHYPNJQB-PLNGDYQASA-N 1 2 243.310 2.115 20 0 BEADLO Cc1cc(N[C@@H](c2cnn(C)c2)C(C)C)nc[nH+]1 ZINC000896422525 583801998 /nfs/dbraw/zinc/80/19/98/583801998.db2.gz KGPRCMUBVJNSBU-CYBMUJFWSA-N 1 2 245.330 2.328 20 0 BEADLO FC(F)(F)[C@@H]1C[N@H+](CC2(F)CC2)CCS1 ZINC000896455435 583802941 /nfs/dbraw/zinc/80/29/41/583802941.db2.gz GZCKMWZTJHBJSO-ZETCQYMHSA-N 1 2 243.269 2.468 20 0 BEADLO FC(F)(F)[C@@H]1C[N@@H+](CC2(F)CC2)CCS1 ZINC000896455435 583802942 /nfs/dbraw/zinc/80/29/42/583802942.db2.gz GZCKMWZTJHBJSO-ZETCQYMHSA-N 1 2 243.269 2.468 20 0 BEADLO Cc1c[nH+]c2c(c1)N(C(=O)C1(C)CCC1)CCN2 ZINC000857997608 588930677 /nfs/dbraw/zinc/93/06/77/588930677.db2.gz RQVIXVIHNGUMQG-UHFFFAOYSA-N 1 2 245.326 2.339 20 0 BEADLO Cc1c[nH+]c2c(c1)N(C(=O)C1=CCCC1)CCN2 ZINC000857997426 588930706 /nfs/dbraw/zinc/93/07/06/588930706.db2.gz NLDMFAIFLUBSEG-UHFFFAOYSA-N 1 2 243.310 2.259 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+]2CCO[C@H](C)CC2)n1 ZINC000896579159 583814946 /nfs/dbraw/zinc/81/49/46/583814946.db2.gz NOJXDGNTAJVYLK-LLVKDONJSA-N 1 2 237.347 2.144 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+]2CCO[C@H](C)CC2)n1 ZINC000896579159 583814947 /nfs/dbraw/zinc/81/49/47/583814947.db2.gz NOJXDGNTAJVYLK-LLVKDONJSA-N 1 2 237.347 2.144 20 0 BEADLO CCc1cc(C[NH2+]Cc2ccnc(F)c2)on1 ZINC000858144919 588934885 /nfs/dbraw/zinc/93/48/85/588934885.db2.gz WIYYRWDGGRZXTP-UHFFFAOYSA-N 1 2 235.262 2.061 20 0 BEADLO CCc1nc(NC[C@H]2CC[C@H](C3CC3)O2)cc[nH+]1 ZINC000896800218 583834881 /nfs/dbraw/zinc/83/48/81/583834881.db2.gz ZHIIBODALMMFKC-VXGBXAGGSA-N 1 2 247.342 2.409 20 0 BEADLO Cc1[nH+]cnc(NC[C@H]2CC[C@@H](C3CC3)O2)c1C ZINC000896801292 583835190 /nfs/dbraw/zinc/83/51/90/583835190.db2.gz MGOUCBRTVZTZOR-OLZOCXBDSA-N 1 2 247.342 2.463 20 0 BEADLO Cc1[nH+]cnc(NCC2(C3(O)CCC3)CC2)c1C ZINC000896812491 583836277 /nfs/dbraw/zinc/83/62/77/583836277.db2.gz WFUZRZLOFGWENT-UHFFFAOYSA-N 1 2 247.342 2.201 20 0 BEADLO C[C@H]1C[C@H]([NH2+]Cc2ccnc(F)c2)c2nccn21 ZINC000858171742 588936831 /nfs/dbraw/zinc/93/68/31/588936831.db2.gz BTSSCYVJONLTCB-ONGXEEELSA-N 1 2 246.289 2.213 20 0 BEADLO CC[C@H]([NH2+]Cc1ccnc(F)c1)C(F)F ZINC000858169730 588936861 /nfs/dbraw/zinc/93/68/61/588936861.db2.gz COUGIMLUBBLQGP-QMMMGPOBSA-N 1 2 218.222 2.354 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H]2CC[C@H]3C[C@H]3C2)[nH+]c1C ZINC000896909983 583852665 /nfs/dbraw/zinc/85/26/65/583852665.db2.gz JTYVQQMPAYZGAY-TUAOUCFPSA-N 1 2 247.342 2.079 20 0 BEADLO CC[C@@H](C)CC(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000896911437 583853230 /nfs/dbraw/zinc/85/32/30/583853230.db2.gz SUBRKQKVSLFRNJ-MRVPVSSYSA-N 1 2 223.320 2.079 20 0 BEADLO Cc1[nH]c(CNC(=O)/C=C2/CC[C@H](C)C2)[nH+]c1C ZINC000896916366 583854889 /nfs/dbraw/zinc/85/48/89/583854889.db2.gz DEWCTYRHERZCCG-PPLKPFPSSA-N 1 2 247.342 2.389 20 0 BEADLO Cc1[nH]c(CNC(=O)C=C2CC[C@H](C)C2)[nH+]c1C ZINC000896916366 583854891 /nfs/dbraw/zinc/85/48/91/583854891.db2.gz DEWCTYRHERZCCG-PPLKPFPSSA-N 1 2 247.342 2.389 20 0 BEADLO Cc1[nH]c(CNC(=O)C[C@H]2CC[C@H](C)C2)[nH+]c1C ZINC000896917183 583855524 /nfs/dbraw/zinc/85/55/24/583855524.db2.gz QXTBMVXERSSLLB-CABZTGNLSA-N 1 2 249.358 2.469 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@H](C)c2ccco2)[nH+]c1C ZINC000896918769 583856165 /nfs/dbraw/zinc/85/61/65/583856165.db2.gz HFFIOTYQNOXNHA-MRVPVSSYSA-N 1 2 247.298 2.039 20 0 BEADLO Cc1[nH]c(CNC(=O)c2cccc(C)c2)[nH+]c1C ZINC000896929040 583859891 /nfs/dbraw/zinc/85/98/91/583859891.db2.gz BJIRSJNRSXUSDZ-UHFFFAOYSA-N 1 2 243.310 2.265 20 0 BEADLO CC[C@H]1CCN(C(=O)C(C)(C)n2c[nH+]c(C)c2)C1 ZINC000896942870 583862807 /nfs/dbraw/zinc/86/28/07/583862807.db2.gz AOVWCKDZKLWUQS-LBPRGKRZSA-N 1 2 249.358 2.185 20 0 BEADLO Cc1[nH+]cnc(NC2CC3(C2)CO[C@H](C)C3)c1C ZINC000897044880 583873095 /nfs/dbraw/zinc/87/30/95/583873095.db2.gz PTFYBRKBCQJYHE-JTZLXEIQSA-N 1 2 247.342 2.463 20 0 BEADLO CCO[C@H]1CC[N@H+](Cc2nc(Cl)cs2)C1 ZINC000897066917 583876731 /nfs/dbraw/zinc/87/67/31/583876731.db2.gz BXECOCQHCSRSEM-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO CCO[C@H]1CC[N@@H+](Cc2nc(Cl)cs2)C1 ZINC000897066917 583876732 /nfs/dbraw/zinc/87/67/32/583876732.db2.gz BXECOCQHCSRSEM-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO CO[C@H]1CC[C@H]1N(C)c1cc(C)[nH+]c(C2CC2)n1 ZINC000897148558 583884310 /nfs/dbraw/zinc/88/43/10/583884310.db2.gz GMUXKXKMGUBSAG-NEPJUHHUSA-N 1 2 247.342 2.276 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1C[C@H]2CCC[C@@H]21 ZINC000897177012 583889979 /nfs/dbraw/zinc/88/99/79/583889979.db2.gz IMQROFMZRAFLGU-VDDIYKPWSA-N 1 2 206.264 2.243 20 0 BEADLO CCc1nc(N[C@@H](C)Cc2cccnc2)cc[nH+]1 ZINC000897194721 583893590 /nfs/dbraw/zinc/89/35/90/583893590.db2.gz FTPPGPKLUBEKCQ-NSHDSACASA-N 1 2 242.326 2.477 20 0 BEADLO OCc1cc[nH+]c(N[C@@H]2CCOC23CCCC3)c1 ZINC000897322300 583922246 /nfs/dbraw/zinc/92/22/46/583922246.db2.gz BQHSHIYHJKLGSA-GFCCVEGCSA-N 1 2 248.326 2.088 20 0 BEADLO CCC[N@H+](Cn1ncn(CC)c1=S)C1CC1 ZINC000728902376 583935604 /nfs/dbraw/zinc/93/56/04/583935604.db2.gz IBPJWLZPCGNORD-UHFFFAOYSA-N 1 2 240.376 2.266 20 0 BEADLO CCC[N@@H+](Cn1ncn(CC)c1=S)C1CC1 ZINC000728902376 583935605 /nfs/dbraw/zinc/93/56/05/583935605.db2.gz IBPJWLZPCGNORD-UHFFFAOYSA-N 1 2 240.376 2.266 20 0 BEADLO CCn1cc[nH+]c1CNc1cnn(C2CCC2)c1 ZINC000897877151 584057383 /nfs/dbraw/zinc/05/73/83/584057383.db2.gz XGVRPPAFHBPNKO-UHFFFAOYSA-N 1 2 245.330 2.437 20 0 BEADLO CCc1cccc(F)c1C[NH2+]Cc1cn(C)cn1 ZINC000898043274 584080589 /nfs/dbraw/zinc/08/05/89/584080589.db2.gz KKNNEHHHFXVGTM-UHFFFAOYSA-N 1 2 247.317 2.411 20 0 BEADLO Fc1ccc(C[NH+]2CC(Cc3ccoc3)C2)cn1 ZINC000898160609 584087839 /nfs/dbraw/zinc/08/78/39/584087839.db2.gz LTLDLKLMYOCBBH-UHFFFAOYSA-N 1 2 246.285 2.488 20 0 BEADLO Cc1cc(C[NH+]2CC(Cc3ccoc3)C2)no1 ZINC000898159998 584087994 /nfs/dbraw/zinc/08/79/94/584087994.db2.gz MDKTUDNSBQZSKZ-UHFFFAOYSA-N 1 2 232.283 2.251 20 0 BEADLO Cc1ccc(C[N@@H+]2CC[C@H](O)[C@@H](F)C2)c(F)c1 ZINC000898184541 584093267 /nfs/dbraw/zinc/09/32/67/584093267.db2.gz UQPSFQJETWIFIH-STQMWFEESA-N 1 2 241.281 2.039 20 0 BEADLO Cc1ccc(C[N@H+]2CC[C@H](O)[C@@H](F)C2)c(F)c1 ZINC000898184541 584093269 /nfs/dbraw/zinc/09/32/69/584093269.db2.gz UQPSFQJETWIFIH-STQMWFEESA-N 1 2 241.281 2.039 20 0 BEADLO O[C@H]1CC[N@H+](Cc2ccc3occc3c2)C[C@@H]1F ZINC000898187555 584094158 /nfs/dbraw/zinc/09/41/58/584094158.db2.gz GVQBUEOSCKIMSQ-STQMWFEESA-N 1 2 249.285 2.338 20 0 BEADLO O[C@H]1CC[N@@H+](Cc2ccc3occc3c2)C[C@@H]1F ZINC000898187555 584094160 /nfs/dbraw/zinc/09/41/60/584094160.db2.gz GVQBUEOSCKIMSQ-STQMWFEESA-N 1 2 249.285 2.338 20 0 BEADLO COc1ccc([NH2+]CC[C@H]2CCOC2)cc1N ZINC000841040414 584116487 /nfs/dbraw/zinc/11/64/87/584116487.db2.gz LWHKAHABCDLCBN-JTQLQIEISA-N 1 2 236.315 2.116 20 0 BEADLO COc1ccc([NH2+]C[C@H]2C[C@H]2C)cc1NC(N)=O ZINC000787317112 584118302 /nfs/dbraw/zinc/11/83/02/584118302.db2.gz YLLKJSGCWNVIDY-RKDXNWHRSA-N 1 2 249.314 2.254 20 0 BEADLO C[C@H](c1ccncc1)[N@@H+]1CCO[C@H](C(F)F)C1 ZINC000801567066 584127837 /nfs/dbraw/zinc/12/78/37/584127837.db2.gz HLUIGYAHWUWTJT-KOLCDFICSA-N 1 2 242.269 2.109 20 0 BEADLO C[C@H](c1ccncc1)[N@H+]1CCO[C@H](C(F)F)C1 ZINC000801567066 584127838 /nfs/dbraw/zinc/12/78/38/584127838.db2.gz HLUIGYAHWUWTJT-KOLCDFICSA-N 1 2 242.269 2.109 20 0 BEADLO C[C@@H](c1ccncc1)[N@@H+]1CCO[C@H](C(F)F)C1 ZINC000801567080 584128136 /nfs/dbraw/zinc/12/81/36/584128136.db2.gz HLUIGYAHWUWTJT-ONGXEEELSA-N 1 2 242.269 2.109 20 0 BEADLO C[C@@H](c1ccncc1)[N@H+]1CCO[C@H](C(F)F)C1 ZINC000801567080 584128138 /nfs/dbraw/zinc/12/81/38/584128138.db2.gz HLUIGYAHWUWTJT-ONGXEEELSA-N 1 2 242.269 2.109 20 0 BEADLO Cl/C=C\C[NH2+]Cc1nnc(C2CC2)s1 ZINC000898428891 584133131 /nfs/dbraw/zinc/13/31/31/584133131.db2.gz KCXCNKSBEXAYIA-RJRFIUFISA-N 1 2 229.736 2.258 20 0 BEADLO CCC[C@H](CC)C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000898809546 584160364 /nfs/dbraw/zinc/16/03/64/584160364.db2.gz ATOGLDYMLJYQQM-QWRGUYRKSA-N 1 2 235.331 2.270 20 0 BEADLO CC(C)[C@@H]1C[C@@H]1C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000898906244 584164895 /nfs/dbraw/zinc/16/48/95/584164895.db2.gz KKKZKRUVEVTUBB-RYUDHWBXSA-N 1 2 249.358 2.027 20 0 BEADLO C[C@@H](CC(=O)NCC(C)(C)n1cc[nH+]c1)C1CC1 ZINC000898901043 584165219 /nfs/dbraw/zinc/16/52/19/584165219.db2.gz CEWOKBPWVQGWJU-NSHDSACASA-N 1 2 249.358 2.171 20 0 BEADLO C[C@H](CC(=O)NCC(C)(C)n1cc[nH+]c1)C1CC1 ZINC000898901042 584165453 /nfs/dbraw/zinc/16/54/53/584165453.db2.gz CEWOKBPWVQGWJU-LLVKDONJSA-N 1 2 249.358 2.171 20 0 BEADLO CCC(=CC(=O)NCC(C)(C)n1cc[nH+]c1)CC ZINC000898905258 584165500 /nfs/dbraw/zinc/16/55/00/584165500.db2.gz VVUBBOCEBHNJDG-UHFFFAOYSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@H](c1ccccc1)[S@](=O)Cc1[nH+]ccn1C ZINC000899296989 584194598 /nfs/dbraw/zinc/19/45/98/584194598.db2.gz DTOLEPLOHAEJNJ-PIGZYNQJSA-N 1 2 248.351 2.430 20 0 BEADLO COc1ccc[nH+]c1N1CCC[C@](C)(F)C1 ZINC000858557308 588965748 /nfs/dbraw/zinc/96/57/48/588965748.db2.gz YBASZGQNQWIDSJ-LBPRGKRZSA-N 1 2 224.279 2.419 20 0 BEADLO CCn1c[nH+]c(/C=C(\C)c2ncccn2)c1 ZINC000899378900 584209452 /nfs/dbraw/zinc/20/94/52/584209452.db2.gz UPVGDFQESIYRCR-JXMROGBWSA-N 1 2 214.272 2.254 20 0 BEADLO CCN(Cc1cccs1)C(=O)Cc1c[nH+]c[nH]1 ZINC000899980768 584261486 /nfs/dbraw/zinc/26/14/86/584261486.db2.gz IZKWMAYGLDXVHM-UHFFFAOYSA-N 1 2 249.339 2.062 20 0 BEADLO CC(C)CN(C(=O)CNc1cccc[nH+]1)C1CC1 ZINC000900116859 584274237 /nfs/dbraw/zinc/27/42/37/584274237.db2.gz ZTVAGOAPPDGUHE-UHFFFAOYSA-N 1 2 247.342 2.141 20 0 BEADLO CC[C@@H](NC(=O)Cc1c[nH]c[nH+]1)c1ccccc1 ZINC000900124090 584276097 /nfs/dbraw/zinc/27/60/97/584276097.db2.gz NWPLRHIFJLLGDT-CYBMUJFWSA-N 1 2 243.310 2.220 20 0 BEADLO CC[C@@H](NC(=O)Cc1c[nH+]c[nH]1)c1ccccc1 ZINC000900124090 584276098 /nfs/dbraw/zinc/27/60/98/584276098.db2.gz NWPLRHIFJLLGDT-CYBMUJFWSA-N 1 2 243.310 2.220 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000900189275 584284740 /nfs/dbraw/zinc/28/47/40/584284740.db2.gz XFZRNHNNCSOUKP-PWSUYJOCSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1NC(=O)Cc1c[nH+]c[nH]1 ZINC000900189275 584284742 /nfs/dbraw/zinc/28/47/42/584284742.db2.gz XFZRNHNNCSOUKP-PWSUYJOCSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H](c1cccs1)N(C)C(=O)Cc1c[nH+]c[nH]1 ZINC000900244981 584288721 /nfs/dbraw/zinc/28/87/21/584288721.db2.gz FHYIOBAZWJFKBF-VIFPVBQESA-N 1 2 249.339 2.233 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)N(C1CC1)C1CCCCC1 ZINC000900338969 584294396 /nfs/dbraw/zinc/29/43/96/584294396.db2.gz DGOLXYCPPFNMBV-UHFFFAOYSA-N 1 2 247.342 2.276 20 0 BEADLO C/C(Cl)=C/C(=O)Nc1ccc[nH+]c1N(C)C ZINC000900323414 584294771 /nfs/dbraw/zinc/29/47/71/584294771.db2.gz UKMPXVSEGMWRRF-FPLPWBNLSA-N 1 2 239.706 2.229 20 0 BEADLO CC1(C)CCN(C(=O)CNc2cccc[nH+]2)CC1 ZINC000900516998 584320542 /nfs/dbraw/zinc/32/05/42/584320542.db2.gz QQZANIORWKULQS-UHFFFAOYSA-N 1 2 247.342 2.142 20 0 BEADLO CCCC[C@H]1CCC[C@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000900543170 584324187 /nfs/dbraw/zinc/32/41/87/584324187.db2.gz LUSVLCZRNVCAQF-WCQYABFASA-N 1 2 249.358 2.427 20 0 BEADLO CCCC[C@H]1CCC[C@H]1NC(=O)Cc1c[nH+]c[nH]1 ZINC000900543170 584324188 /nfs/dbraw/zinc/32/41/88/584324188.db2.gz LUSVLCZRNVCAQF-WCQYABFASA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@@H](C)[C@@H](C)N(C(=O)Cc1c[nH+]c[nH]1)C1CC1 ZINC000900588186 584328897 /nfs/dbraw/zinc/32/88/97/584328897.db2.gz MXEFYEAAPYPUBM-GHMZBOCLSA-N 1 2 249.358 2.378 20 0 BEADLO C/C(=C(\F)C(=O)N(C)Cc1[nH]cc[nH+]1)C1CC1 ZINC000900623704 584333087 /nfs/dbraw/zinc/33/30/87/584333087.db2.gz COCNDMLALQJEHF-DHZHZOJOSA-N 1 2 237.278 2.022 20 0 BEADLO CSCc1cn(Cc2cc(C)cc(C)[nH+]2)nn1 ZINC000900622049 584333210 /nfs/dbraw/zinc/33/32/10/584333210.db2.gz OPDCYKUSODARFH-UHFFFAOYSA-N 1 2 248.355 2.201 20 0 BEADLO CC(C)CN(CC(C)C)C(=O)Cc1c[nH+]c[nH]1 ZINC000900683891 584341352 /nfs/dbraw/zinc/34/13/52/584341352.db2.gz SHDHMJHBUCTGRE-UHFFFAOYSA-N 1 2 237.347 2.093 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)N[C@@H]1CC[C@@H]2CCC[C@H]2C1 ZINC000900851146 584357480 /nfs/dbraw/zinc/35/74/80/584357480.db2.gz AGLSPGWPQQUHEP-SDDRHHMPSA-N 1 2 247.342 2.037 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)N[C@@H]1CC[C@@H]2CCC[C@H]2C1 ZINC000900851146 584357481 /nfs/dbraw/zinc/35/74/81/584357481.db2.gz AGLSPGWPQQUHEP-SDDRHHMPSA-N 1 2 247.342 2.037 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)N[C@@H]1C[C@@H]1C1CCCCC1 ZINC000900836525 584359309 /nfs/dbraw/zinc/35/93/09/584359309.db2.gz ORWGTQOUHPRCCM-CHWSQXEVSA-N 1 2 247.342 2.037 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)N[C@@H]1C[C@@H]1C1CCCCC1 ZINC000900836525 584359312 /nfs/dbraw/zinc/35/93/12/584359312.db2.gz ORWGTQOUHPRCCM-CHWSQXEVSA-N 1 2 247.342 2.037 20 0 BEADLO Cc1[nH]c(CNC(=O)/C=C\C2CCCC2)[nH+]c1C ZINC000901001015 584373104 /nfs/dbraw/zinc/37/31/04/584373104.db2.gz QLTMUYOQVATGOG-FPLPWBNLSA-N 1 2 247.342 2.389 20 0 BEADLO Cc1[nH]c(CNC(=O)C=CC2CCCC2)[nH+]c1C ZINC000901001015 584373106 /nfs/dbraw/zinc/37/31/06/584373106.db2.gz QLTMUYOQVATGOG-FPLPWBNLSA-N 1 2 247.342 2.389 20 0 BEADLO C[C@@H](N(C)C(=O)CNc1cccc[nH+]1)C1(C)CC1 ZINC000900988558 584373326 /nfs/dbraw/zinc/37/33/26/584373326.db2.gz MHAPRABYZKNEBD-LLVKDONJSA-N 1 2 247.342 2.141 20 0 BEADLO CC(C)C1(CNC(=O)CNc2cccc[nH+]2)CC1 ZINC000900994178 584375094 /nfs/dbraw/zinc/37/50/94/584375094.db2.gz NHFWOXKEHNACPR-UHFFFAOYSA-N 1 2 247.342 2.046 20 0 BEADLO CC[C@@]1(C)CCN(C(=O)CNc2cccc[nH+]2)C1 ZINC000901032080 584375812 /nfs/dbraw/zinc/37/58/12/584375812.db2.gz PBPNNQHKOUALKC-AWEZNQCLSA-N 1 2 247.342 2.142 20 0 BEADLO CCC[C@H](C)[C@H]1CCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC000901116303 584386458 /nfs/dbraw/zinc/38/64/58/584386458.db2.gz CNWCWENLMMTZSY-WCQYABFASA-N 1 2 249.358 2.379 20 0 BEADLO c1csc(-c2cc([C@@H]3COCC[NH2+]3)on2)c1 ZINC000901387972 584436651 /nfs/dbraw/zinc/43/66/51/584436651.db2.gz OTBHEEPQQKFGRH-VIFPVBQESA-N 1 2 236.296 2.064 20 0 BEADLO Fc1ccccc1-c1cc([C@@H]2COCC[NH2+]2)on1 ZINC000901399426 584438953 /nfs/dbraw/zinc/43/89/53/584438953.db2.gz HBULXXYOSOWGHN-LBPRGKRZSA-N 1 2 248.257 2.142 20 0 BEADLO COC/C(C)=C/CSCCn1cc[nH+]c1 ZINC000901880692 584502201 /nfs/dbraw/zinc/50/22/01/584502201.db2.gz BZOWPWQBJCKIRJ-QDEBKDIKSA-N 1 2 226.345 2.209 20 0 BEADLO CC(C)c1nnc(NCc2[nH+]ccn2C2CC2)o1 ZINC000902042309 584515566 /nfs/dbraw/zinc/51/55/66/584515566.db2.gz UJTYRPHDFGDOEL-UHFFFAOYSA-N 1 2 247.302 2.337 20 0 BEADLO Cc1[nH]c(CNc2nnc(C(C)(C)C)o2)[nH+]c1C ZINC000902044320 584516210 /nfs/dbraw/zinc/51/62/10/584516210.db2.gz SUKVMSMZRPEVTC-UHFFFAOYSA-N 1 2 249.318 2.319 20 0 BEADLO CCn1c[nH+]c(CNc2ccc3c(c2)OCO3)c1 ZINC000902078433 584520336 /nfs/dbraw/zinc/52/03/36/584520336.db2.gz BSPYMNWKCOHOEW-UHFFFAOYSA-N 1 2 245.282 2.244 20 0 BEADLO COc1ccsc1CNc1cc[nH+]c(C)n1 ZINC000902126079 584529080 /nfs/dbraw/zinc/52/90/80/584529080.db2.gz XPJMAIXFJIUCKV-UHFFFAOYSA-N 1 2 235.312 2.467 20 0 BEADLO CCc1ncc(CNc2cc[nH+]c(C)n2)s1 ZINC000902125197 584529362 /nfs/dbraw/zinc/52/93/62/584529362.db2.gz OZVKAHXLSFYCEQ-UHFFFAOYSA-N 1 2 234.328 2.416 20 0 BEADLO CCn1c[nH+]c(CNc2cnn(C(C)C)c2)c1 ZINC000902170588 584534362 /nfs/dbraw/zinc/53/43/62/584534362.db2.gz XGKHEZGOKXOMDZ-UHFFFAOYSA-N 1 2 233.319 2.293 20 0 BEADLO Cc1cc(NCc2ccc(F)nc2C)nc[nH+]1 ZINC000902196607 584536581 /nfs/dbraw/zinc/53/65/81/584536581.db2.gz VGWQEOMFGKQKHK-UHFFFAOYSA-N 1 2 232.262 2.240 20 0 BEADLO Cc1cc(NCc2ccnn2CC2CC2)nc[nH+]1 ZINC000902193864 584536776 /nfs/dbraw/zinc/53/67/76/584536776.db2.gz CISXTKPLCCTKKU-UHFFFAOYSA-N 1 2 243.314 2.004 20 0 BEADLO CCn1c[nH+]c(CNc2ccc3c(c2)CCO3)c1 ZINC000902244457 584546078 /nfs/dbraw/zinc/54/60/78/584546078.db2.gz WTGVXCLUONAEHH-UHFFFAOYSA-N 1 2 243.310 2.450 20 0 BEADLO CC1=CCC[N@H+](CN2Cc3ccccc3C2=O)C1 ZINC000902247920 584547040 /nfs/dbraw/zinc/54/70/40/584547040.db2.gz LGEURQWZIGVLFI-UHFFFAOYSA-N 1 2 242.322 2.252 20 0 BEADLO CC1=CCC[N@@H+](CN2Cc3ccccc3C2=O)C1 ZINC000902247920 584547041 /nfs/dbraw/zinc/54/70/41/584547041.db2.gz LGEURQWZIGVLFI-UHFFFAOYSA-N 1 2 242.322 2.252 20 0 BEADLO CCn1c[nH+]cc1CNc1noc2c1CCCC2 ZINC000902277154 584551004 /nfs/dbraw/zinc/55/10/04/584551004.db2.gz JVGBUJZIBVMPBK-UHFFFAOYSA-N 1 2 246.314 2.382 20 0 BEADLO CCn1c[nH+]c(CNc2ccc(C)nc2)c1 ZINC000902338193 584565582 /nfs/dbraw/zinc/56/55/82/584565582.db2.gz MEXMIGGGWHFAJT-UHFFFAOYSA-N 1 2 216.288 2.219 20 0 BEADLO BrC1(COc2cc[nH+]cc2)CC1 ZINC000902355003 584569732 /nfs/dbraw/zinc/56/97/32/584569732.db2.gz GMSFTGVLKFPJPC-UHFFFAOYSA-N 1 2 228.089 2.388 20 0 BEADLO O=C(OCCF)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000859057563 588995100 /nfs/dbraw/zinc/99/51/00/588995100.db2.gz HBBVUMXKVAZPTK-VIFPVBQESA-N 1 2 241.266 2.043 20 0 BEADLO COCCOc1ccc2c[nH+]ccc2c1 ZINC000902637042 584648601 /nfs/dbraw/zinc/64/86/01/584648601.db2.gz GRKYYRCNZKLZHV-UHFFFAOYSA-N 1 2 203.241 2.260 20 0 BEADLO Cc1cc(C)[nH+]c(Cn2cnc(C(C)C)n2)c1 ZINC000902763061 584663682 /nfs/dbraw/zinc/66/36/82/584663682.db2.gz PNYUVLCHVNJBSK-UHFFFAOYSA-N 1 2 230.315 2.462 20 0 BEADLO CCCn1cc([C@@H](C)[NH2+]Cc2ccoc2C)nn1 ZINC000902773091 584668194 /nfs/dbraw/zinc/66/81/94/584668194.db2.gz WFZHBYHHPJOJRK-SNVBAGLBSA-N 1 2 248.330 2.440 20 0 BEADLO C[C@H]1OCC[C@@H]1COc1ccc2c(c1)[nH+]cn2C ZINC000902781124 584670070 /nfs/dbraw/zinc/67/00/70/584670070.db2.gz GBOWRXWYZUCSDM-GHMZBOCLSA-N 1 2 246.310 2.377 20 0 BEADLO COCCOc1cc[nH+]c2ccc(OC)cc21 ZINC000902901109 584693337 /nfs/dbraw/zinc/69/33/37/584693337.db2.gz XTGQGXZFGIRFKZ-UHFFFAOYSA-N 1 2 233.267 2.269 20 0 BEADLO Cc1nnsc1[C@H](C)[N@@H+]1CCC[C@H](F)C1 ZINC000902991454 584709995 /nfs/dbraw/zinc/70/99/95/584709995.db2.gz RQWZBKRYGXUOPR-IUCAKERBSA-N 1 2 229.324 2.341 20 0 BEADLO Cc1nnsc1[C@H](C)[N@H+]1CCC[C@H](F)C1 ZINC000902991454 584709996 /nfs/dbraw/zinc/70/99/96/584709996.db2.gz RQWZBKRYGXUOPR-IUCAKERBSA-N 1 2 229.324 2.341 20 0 BEADLO CCCCCNC(=O)[C@H](C)[N@@H+]1CCC[C@@H](F)C1 ZINC000902999558 584714790 /nfs/dbraw/zinc/71/47/90/584714790.db2.gz ABWUOWIYVYUHJF-NWDGAFQWSA-N 1 2 244.354 2.115 20 0 BEADLO CCCCCNC(=O)[C@H](C)[N@H+]1CCC[C@@H](F)C1 ZINC000902999558 584714791 /nfs/dbraw/zinc/71/47/91/584714791.db2.gz ABWUOWIYVYUHJF-NWDGAFQWSA-N 1 2 244.354 2.115 20 0 BEADLO O[C@@H](C[N@@H+]1CCC[C@H](F)C1)c1cccc(F)c1 ZINC000903002054 584716229 /nfs/dbraw/zinc/71/62/29/584716229.db2.gz VCQHRNGCKJHKPH-STQMWFEESA-N 1 2 241.281 2.293 20 0 BEADLO O[C@@H](C[N@H+]1CCC[C@H](F)C1)c1cccc(F)c1 ZINC000903002054 584716230 /nfs/dbraw/zinc/71/62/30/584716230.db2.gz VCQHRNGCKJHKPH-STQMWFEESA-N 1 2 241.281 2.293 20 0 BEADLO Cc1cc(N[C@@H]2CCO[C@@]23CCOC3)c[nH+]c1C ZINC000903220601 584737721 /nfs/dbraw/zinc/73/77/21/584737721.db2.gz NARYVDVTPFMZOA-ZIAGYGMSSA-N 1 2 248.326 2.058 20 0 BEADLO CCn1nc(C)c([C@H](C)[NH2+]C/C=C/Cl)n1 ZINC000903445181 584769234 /nfs/dbraw/zinc/76/92/34/584769234.db2.gz SEMZYBIQPLRLPR-GJIOHYHPSA-N 1 2 228.727 2.010 20 0 BEADLO CCn1nc(C)c([C@H](C)[NH2+]C/C=C\Cl)n1 ZINC000903445191 584769690 /nfs/dbraw/zinc/76/96/90/584769690.db2.gz SEMZYBIQPLRLPR-SLGIHZDVSA-N 1 2 228.727 2.010 20 0 BEADLO CC(C)n1cc([C@@H](C)[NH2+]C/C=C/Cl)nn1 ZINC000903446568 584770029 /nfs/dbraw/zinc/77/00/29/584770029.db2.gz YLVVESSIVVHFGK-XNPJLODASA-N 1 2 228.727 2.262 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)OCCC(C)C ZINC000859175844 589014324 /nfs/dbraw/zinc/01/43/24/589014324.db2.gz NFSVQXHZJVUDIP-UHFFFAOYSA-N 1 2 239.319 2.175 20 0 BEADLO CC1(C)CCC[C@H](NC(=O)Cc2[nH]cc[nH+]2)C1 ZINC000832754978 584912418 /nfs/dbraw/zinc/91/24/18/584912418.db2.gz XQMLROVBRCMEMP-JTQLQIEISA-N 1 2 235.331 2.037 20 0 BEADLO CSCCO[NH+]=C(N)Cc1cccs1 ZINC000763424732 584921812 /nfs/dbraw/zinc/92/18/12/584921812.db2.gz AAQFXOZJGUQXLF-UHFFFAOYSA-N 1 2 230.358 2.152 20 0 BEADLO CC[N@@H+]1CCCC[C@H]1C(=O)OC[C@@H](C)SC ZINC000835684080 584929083 /nfs/dbraw/zinc/92/90/83/584929083.db2.gz CZISQKRQHFRATN-MNOVXSKESA-N 1 2 245.388 2.156 20 0 BEADLO CC[N@H+]1CCCC[C@H]1C(=O)OC[C@@H](C)SC ZINC000835684080 584929084 /nfs/dbraw/zinc/92/90/84/584929084.db2.gz CZISQKRQHFRATN-MNOVXSKESA-N 1 2 245.388 2.156 20 0 BEADLO CCC/C=C/C(=O)NCCCCn1cc[nH+]c1 ZINC000733166211 584943781 /nfs/dbraw/zinc/94/37/81/584943781.db2.gz LRFDMOJZODVJRU-QPJJXVBHSA-N 1 2 235.331 2.136 20 0 BEADLO CCC/C=C\C(=O)NCCCCn1cc[nH+]c1 ZINC000733166210 584943827 /nfs/dbraw/zinc/94/38/27/584943827.db2.gz LRFDMOJZODVJRU-DAXSKMNVSA-N 1 2 235.331 2.136 20 0 BEADLO CC(C)c1cnc(C[N@@H+]2CCCO[C@@H](C)C2)o1 ZINC000733309167 584946751 /nfs/dbraw/zinc/94/67/51/584946751.db2.gz CVACWPRFYVSZIP-NSHDSACASA-N 1 2 238.331 2.409 20 0 BEADLO CC(C)c1cnc(C[N@H+]2CCCO[C@@H](C)C2)o1 ZINC000733309167 584946752 /nfs/dbraw/zinc/94/67/52/584946752.db2.gz CVACWPRFYVSZIP-NSHDSACASA-N 1 2 238.331 2.409 20 0 BEADLO Cc1nonc1C[N@@H+](C)Cc1ccccc1 ZINC000733896818 584954873 /nfs/dbraw/zinc/95/48/73/584954873.db2.gz ZJWDNKLMIHXOIK-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1nonc1C[N@H+](C)Cc1ccccc1 ZINC000733896818 584954874 /nfs/dbraw/zinc/95/48/74/584954874.db2.gz ZJWDNKLMIHXOIK-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1nonc1C[N@@H+]1Cc2ccccc2[C@H](C)C1 ZINC000734146505 584957321 /nfs/dbraw/zinc/95/73/21/584957321.db2.gz FGLYHSBAROWNMK-SNVBAGLBSA-N 1 2 243.310 2.497 20 0 BEADLO Cc1nonc1C[N@H+]1Cc2ccccc2[C@H](C)C1 ZINC000734146505 584957322 /nfs/dbraw/zinc/95/73/22/584957322.db2.gz FGLYHSBAROWNMK-SNVBAGLBSA-N 1 2 243.310 2.497 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+]C[C@H]1C[C@H]1c1ccccc1 ZINC000734159480 584959198 /nfs/dbraw/zinc/95/91/98/584959198.db2.gz ONPUXXFJPHWUMS-YUTCNCBUSA-N 1 2 247.338 2.331 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+]C[C@@H]1C[C@@H]1c1ccccc1 ZINC000734159475 584959205 /nfs/dbraw/zinc/95/92/05/584959205.db2.gz ONPUXXFJPHWUMS-FPMFFAJLSA-N 1 2 247.338 2.331 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+]C[C@@H]1CCc2ccccc21 ZINC000734158666 584959267 /nfs/dbraw/zinc/95/92/67/584959267.db2.gz KCWLLRNKAJNAGH-YPMHNXCESA-N 1 2 247.338 2.258 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@H](C)C(C)(C)C)c[nH+]1 ZINC000734549871 584964134 /nfs/dbraw/zinc/96/41/34/584964134.db2.gz YSQUSTPRSBERMU-QMMMGPOBSA-N 1 2 223.320 2.130 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C(=O)OCc1c[nH+]cn1C ZINC000820161105 585011129 /nfs/dbraw/zinc/01/11/29/585011129.db2.gz DMIJYDARUFKNDZ-PWSUYJOCSA-N 1 2 236.315 2.290 20 0 BEADLO C[C@@H]1CCCC[C@H]1C(=O)OCc1c[nH+]cn1C ZINC000820161106 585011163 /nfs/dbraw/zinc/01/11/63/585011163.db2.gz DMIJYDARUFKNDZ-ZYHUDNBSSA-N 1 2 236.315 2.290 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1C(=O)OCc1c[nH+]cn1C ZINC000774140800 585027204 /nfs/dbraw/zinc/02/72/04/585027204.db2.gz UZUXWKWHXKXPQZ-YPMHNXCESA-N 1 2 236.315 2.146 20 0 BEADLO Cc1cnccc1C[NH+]1CC(C(F)(F)F)C1 ZINC000859201012 589018162 /nfs/dbraw/zinc/01/81/62/589018162.db2.gz UYHVZSASWYMWGK-UHFFFAOYSA-N 1 2 230.233 2.384 20 0 BEADLO O=C(O[C@H]1CC[N@@H+](CCF)C1)C1CCCCC1 ZINC000788085750 585039226 /nfs/dbraw/zinc/03/92/26/585039226.db2.gz WMKGNIHZPJLQJG-LBPRGKRZSA-N 1 2 243.322 2.154 20 0 BEADLO O=C(O[C@H]1CC[N@H+](CCF)C1)C1CCCCC1 ZINC000788085750 585039227 /nfs/dbraw/zinc/03/92/27/585039227.db2.gz WMKGNIHZPJLQJG-LBPRGKRZSA-N 1 2 243.322 2.154 20 0 BEADLO Cc1ccc(COC(=O)CC2(O)CCC2)c(C)[nH+]1 ZINC000838212541 585048744 /nfs/dbraw/zinc/04/87/44/585048744.db2.gz YVPCROFUFUOSPM-UHFFFAOYSA-N 1 2 249.310 2.047 20 0 BEADLO CC(C(=O)OCCc1c[nH+]cn1C)=C1CCC1 ZINC000838238137 585050118 /nfs/dbraw/zinc/05/01/18/585050118.db2.gz UBCOUOUUGBJXRK-UHFFFAOYSA-N 1 2 234.299 2.006 20 0 BEADLO CCn1ncc(C[N@H+](C)Cc2cccc(F)c2)n1 ZINC000838785063 585069928 /nfs/dbraw/zinc/06/99/28/585069928.db2.gz ZGKPWRBKSCMRHB-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO CCn1ncc(C[N@@H+](C)Cc2cccc(F)c2)n1 ZINC000838785063 585069929 /nfs/dbraw/zinc/06/99/29/585069929.db2.gz ZGKPWRBKSCMRHB-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO CCn1ncc(C[N@H+](C)[C@@H](C)c2ccccc2)n1 ZINC000838785893 585070024 /nfs/dbraw/zinc/07/00/24/585070024.db2.gz CLRGSZDVFTVQMT-LBPRGKRZSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1ncc(C[N@@H+](C)[C@@H](C)c2ccccc2)n1 ZINC000838785893 585070025 /nfs/dbraw/zinc/07/00/25/585070025.db2.gz CLRGSZDVFTVQMT-LBPRGKRZSA-N 1 2 244.342 2.491 20 0 BEADLO CC1(C(=O)OCCc2cn3ccccc3[nH+]2)CC1 ZINC000838921968 585078487 /nfs/dbraw/zinc/07/84/87/585078487.db2.gz RPOPYUPMPKXQII-UHFFFAOYSA-N 1 2 244.294 2.220 20 0 BEADLO C/C=C(/C)C(=O)OCc1ccc[nH+]c1N(C)C ZINC000838958269 585080638 /nfs/dbraw/zinc/08/06/38/585080638.db2.gz XBWZTMCJHZCUCO-YHYXMXQVSA-N 1 2 234.299 2.157 20 0 BEADLO C[C@H](C(=O)OCc1ccc[nH+]c1N(C)C)C1CC1 ZINC000838955068 585080667 /nfs/dbraw/zinc/08/06/67/585080667.db2.gz ZFJLKZQDUARHAD-JTQLQIEISA-N 1 2 248.326 2.237 20 0 BEADLO CCC1(C(=O)OCc2ccc[nH+]c2N(C)C)CC1 ZINC000838952562 585080835 /nfs/dbraw/zinc/08/08/35/585080835.db2.gz IVTLQJLVFLAFHT-UHFFFAOYSA-N 1 2 248.326 2.381 20 0 BEADLO Cc1nc(F)ccc1C[NH+]1CC(C(F)F)C1 ZINC000839141198 585094631 /nfs/dbraw/zinc/09/46/31/585094631.db2.gz LXKDOYJJUKJSIQ-UHFFFAOYSA-N 1 2 230.233 2.226 20 0 BEADLO c1oc(C2CC2)nc1C[N@@H+]1C[C@@H]2C[C@H]1CS2 ZINC000839190763 585097354 /nfs/dbraw/zinc/09/73/54/585097354.db2.gz AMQKHCZKAQODMQ-QWRGUYRKSA-N 1 2 236.340 2.242 20 0 BEADLO c1oc(C2CC2)nc1C[N@H+]1C[C@@H]2C[C@H]1CS2 ZINC000839190763 585097355 /nfs/dbraw/zinc/09/73/55/585097355.db2.gz AMQKHCZKAQODMQ-QWRGUYRKSA-N 1 2 236.340 2.242 20 0 BEADLO Cl/C=C(/Cl)C[N@@H+]1C[C@@H]2C[C@H]1CS2 ZINC000839201721 585099501 /nfs/dbraw/zinc/09/95/01/585099501.db2.gz QRMVRNJUXCRZFV-VSSAVIFKSA-N 1 2 224.156 2.495 20 0 BEADLO Cl/C=C(/Cl)C[N@H+]1C[C@@H]2C[C@H]1CS2 ZINC000839201721 585099502 /nfs/dbraw/zinc/09/95/02/585099502.db2.gz QRMVRNJUXCRZFV-VSSAVIFKSA-N 1 2 224.156 2.495 20 0 BEADLO Cc1cccc(F)c1C[NH2+]Cc1ccn(C)n1 ZINC000742380391 585125483 /nfs/dbraw/zinc/12/54/83/585125483.db2.gz CXKYRWPDHQHWQP-UHFFFAOYSA-N 1 2 233.290 2.157 20 0 BEADLO Fc1cccc(N2CCC[C@@H](n3cc[nH+]c3)C2)n1 ZINC000742400566 585125716 /nfs/dbraw/zinc/12/57/16/585125716.db2.gz DUYDRIKSQZXAQP-LLVKDONJSA-N 1 2 246.289 2.259 20 0 BEADLO C[C@@H]1CCC[C@@]2(C1)[NH2+]C1(CCCC1)C(=O)N2C ZINC000742438482 585126279 /nfs/dbraw/zinc/12/62/79/585126279.db2.gz DAFKDOPZQUFJKS-BXUZGUMPSA-N 1 2 236.359 2.267 20 0 BEADLO CC(C)N1C(=O)C[N@H+](C/C=C\Cl)CC1(C)C ZINC000743859286 585141049 /nfs/dbraw/zinc/14/10/49/585141049.db2.gz OJJFPYPUFZYBCU-WAYWQWQTSA-N 1 2 244.766 2.070 20 0 BEADLO CC(C)N1C(=O)C[N@@H+](C/C=C\Cl)CC1(C)C ZINC000743859286 585141050 /nfs/dbraw/zinc/14/10/50/585141050.db2.gz OJJFPYPUFZYBCU-WAYWQWQTSA-N 1 2 244.766 2.070 20 0 BEADLO Cc1ccc([C@@H](C)NC(=O)Cn2cc[nH+]c2)s1 ZINC000746157476 585164183 /nfs/dbraw/zinc/16/41/83/585164183.db2.gz ODMPSYSYPAKWDU-SNVBAGLBSA-N 1 2 249.339 2.130 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2ccnc(F)c2)CCO1 ZINC000859210035 589019588 /nfs/dbraw/zinc/01/95/88/589019588.db2.gz PJPLDWQWQFWDAV-GFCCVEGCSA-N 1 2 238.306 2.222 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2ccnc(F)c2)CCO1 ZINC000859210035 589019590 /nfs/dbraw/zinc/01/95/90/589019590.db2.gz PJPLDWQWQFWDAV-GFCCVEGCSA-N 1 2 238.306 2.222 20 0 BEADLO Cc1ccccc1C[N@H+](C)Cn1ccsc1=O ZINC000746604258 585171001 /nfs/dbraw/zinc/17/10/01/585171001.db2.gz AHIIGLDSHUJJTN-UHFFFAOYSA-N 1 2 248.351 2.308 20 0 BEADLO Cc1ccccc1C[N@@H+](C)Cn1ccsc1=O ZINC000746604258 585171002 /nfs/dbraw/zinc/17/10/02/585171002.db2.gz AHIIGLDSHUJJTN-UHFFFAOYSA-N 1 2 248.351 2.308 20 0 BEADLO CCC/C(C)=C\C(=O)NC[C@@H](C)Cn1cc[nH+]c1 ZINC000747400740 585178841 /nfs/dbraw/zinc/17/88/41/585178841.db2.gz MFZIIDNRGPSZLG-LLBKUYECSA-N 1 2 249.358 2.382 20 0 BEADLO C[C@@H]1CC(=O)N(C[N@@H+]2Cc3ccccc3[C@@H]2C)C1 ZINC000747463930 585179184 /nfs/dbraw/zinc/17/91/84/585179184.db2.gz SAGFTGCRGSDTIZ-NEPJUHHUSA-N 1 2 244.338 2.389 20 0 BEADLO C[C@@H]1CC(=O)N(C[N@H+]2Cc3ccccc3[C@@H]2C)C1 ZINC000747463930 585179185 /nfs/dbraw/zinc/17/91/85/585179185.db2.gz SAGFTGCRGSDTIZ-NEPJUHHUSA-N 1 2 244.338 2.389 20 0 BEADLO C[C@@H]1CC(=O)N(C[N@@H+]2Cc3ccccc3[C@H]2C)C1 ZINC000747463933 585179265 /nfs/dbraw/zinc/17/92/65/585179265.db2.gz SAGFTGCRGSDTIZ-VXGBXAGGSA-N 1 2 244.338 2.389 20 0 BEADLO C[C@@H]1CC(=O)N(C[N@H+]2Cc3ccccc3[C@H]2C)C1 ZINC000747463933 585179266 /nfs/dbraw/zinc/17/92/66/585179266.db2.gz SAGFTGCRGSDTIZ-VXGBXAGGSA-N 1 2 244.338 2.389 20 0 BEADLO Cc1cccc(CC(=O)OCc2c[nH+]cn2C)c1 ZINC000747782455 585184286 /nfs/dbraw/zinc/18/42/86/585184286.db2.gz ISIJAYFOTQRKPF-UHFFFAOYSA-N 1 2 244.294 2.014 20 0 BEADLO Cc1ccccc1CC(=O)OCc1c[nH+]cn1C ZINC000747781956 585184315 /nfs/dbraw/zinc/18/43/15/585184315.db2.gz MXYRCRWZBTWZSP-UHFFFAOYSA-N 1 2 244.294 2.014 20 0 BEADLO Cc1ccsc1C(=O)OCc1c[nH+]cn1C ZINC000747783790 585184418 /nfs/dbraw/zinc/18/44/18/585184418.db2.gz VMRAXDSYOZVYDT-UHFFFAOYSA-N 1 2 236.296 2.147 20 0 BEADLO O=C(CCCn1cc[nH+]c1)Oc1ccccc1 ZINC000748597877 585194521 /nfs/dbraw/zinc/19/45/21/585194521.db2.gz KSZMVNNUCYJYEP-UHFFFAOYSA-N 1 2 230.267 2.269 20 0 BEADLO CC[C@]1(C)COCC[N@@H+]1Cc1ccnc(F)c1 ZINC000859216848 589019955 /nfs/dbraw/zinc/01/99/55/589019955.db2.gz NPJQDPRKVBUDCZ-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO CC[C@]1(C)COCC[N@H+]1Cc1ccnc(F)c1 ZINC000859216848 589019956 /nfs/dbraw/zinc/01/99/56/589019956.db2.gz NPJQDPRKVBUDCZ-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO CC[C@@H](C)NC(=S)Nc1c[nH+]ccc1OC ZINC000749768497 585205788 /nfs/dbraw/zinc/20/57/88/585205788.db2.gz MZZDNLCNFPIVJC-MRVPVSSYSA-N 1 2 239.344 2.175 20 0 BEADLO C/C=C(/C)C(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC000750005705 585209375 /nfs/dbraw/zinc/20/93/75/585209375.db2.gz HEJTXHURDPDGSP-TWGQIWQCSA-N 1 2 233.315 2.361 20 0 BEADLO CC[C@@]1(C)COCC[N@@H+]1Cc1ccnc(F)c1 ZINC000859216850 589020110 /nfs/dbraw/zinc/02/01/10/589020110.db2.gz NPJQDPRKVBUDCZ-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO CC[C@@]1(C)COCC[N@H+]1Cc1ccnc(F)c1 ZINC000859216850 589020112 /nfs/dbraw/zinc/02/01/12/589020112.db2.gz NPJQDPRKVBUDCZ-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO CC(C)=C(C)C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000751366022 585227733 /nfs/dbraw/zinc/22/77/33/585227733.db2.gz MFGRFTFFZMFJKO-UHFFFAOYSA-N 1 2 247.342 2.472 20 0 BEADLO CC[C@@H](C)COC(=O)CCc1ccc(N)[nH+]c1 ZINC000751439836 585230485 /nfs/dbraw/zinc/23/04/85/585230485.db2.gz OZXPRLBINSFZHD-SNVBAGLBSA-N 1 2 236.315 2.186 20 0 BEADLO C[C@@H]1C[NH+](Cn2ncsc2=S)C[C@H]1C ZINC000751925479 585239155 /nfs/dbraw/zinc/23/91/55/585239155.db2.gz FRBVMKUGVTZZAJ-HTQZYQBOSA-N 1 2 229.374 2.219 20 0 BEADLO Cn1c[nH+]cc1COC(=O)/C=C\c1cccs1 ZINC000753146079 585254259 /nfs/dbraw/zinc/25/42/59/585254259.db2.gz HGHMVSVSQQCNRL-PLNGDYQASA-N 1 2 248.307 2.238 20 0 BEADLO FCC[N@@H+]1CCO[C@@]2(CCc3ccccc32)C1 ZINC000753273648 585256138 /nfs/dbraw/zinc/25/61/38/585256138.db2.gz HSUMXGIXRZLFDD-AWEZNQCLSA-N 1 2 235.302 2.130 20 0 BEADLO FCC[N@H+]1CCO[C@@]2(CCc3ccccc32)C1 ZINC000753273648 585256139 /nfs/dbraw/zinc/25/61/39/585256139.db2.gz HSUMXGIXRZLFDD-AWEZNQCLSA-N 1 2 235.302 2.130 20 0 BEADLO NC(=[NH+]OCC1CCC1)c1cccc(F)c1 ZINC000753822110 585270331 /nfs/dbraw/zinc/27/03/31/585270331.db2.gz JWGMXRPYAAPGDI-UHFFFAOYSA-N 1 2 222.263 2.472 20 0 BEADLO Cc1cc(Cl)ncc1OCc1c[nH+]cn1C ZINC000753828090 585270569 /nfs/dbraw/zinc/27/05/69/585270569.db2.gz CSODWTLRBWMBKZ-UHFFFAOYSA-N 1 2 237.690 2.356 20 0 BEADLO O=C(/C=C/C1CCCCC1)NCc1c[nH+]c[nH]1 ZINC000754295043 585282436 /nfs/dbraw/zinc/28/24/36/585282436.db2.gz VXVWYSBYWXAWMS-VOTSOKGWSA-N 1 2 233.315 2.162 20 0 BEADLO O=C(C=CC1CCCCC1)NCc1c[nH]c[nH+]1 ZINC000754295043 585282437 /nfs/dbraw/zinc/28/24/37/585282437.db2.gz VXVWYSBYWXAWMS-VOTSOKGWSA-N 1 2 233.315 2.162 20 0 BEADLO C[C@H]1CC/C(=C/C(=O)OCc2c[nH+]cn2C)C1 ZINC000754682772 585289280 /nfs/dbraw/zinc/28/92/80/585289280.db2.gz BZKHDHVWOPAKFS-OYUORYAFSA-N 1 2 234.299 2.210 20 0 BEADLO CCC(CC)OC(=O)CCc1ccc(N)[nH+]c1 ZINC000754856731 585291704 /nfs/dbraw/zinc/29/17/04/585291704.db2.gz FXUJEZXMKHBWSS-UHFFFAOYSA-N 1 2 236.315 2.328 20 0 BEADLO O=C(C=C1CCC1)Nc1ccc2[nH+]ccn2c1 ZINC000755310881 585297530 /nfs/dbraw/zinc/29/75/30/585297530.db2.gz RFXJWLXPHCKENT-UHFFFAOYSA-N 1 2 227.267 2.383 20 0 BEADLO CN(C)c1cc(COC(=O)C2CC=CC2)cc[nH+]1 ZINC000755900974 585309681 /nfs/dbraw/zinc/30/96/81/585309681.db2.gz CWAALGUTRBEOJY-UHFFFAOYSA-N 1 2 246.310 2.157 20 0 BEADLO CN(C)c1cc(COC(=O)[C@@H]2CC2(C)C)cc[nH+]1 ZINC000755913210 585310467 /nfs/dbraw/zinc/31/04/67/585310467.db2.gz JDMFAOSAJQFBFO-NSHDSACASA-N 1 2 248.326 2.237 20 0 BEADLO CC1=CCN(C(=O)c2cccc3[nH+]ccn32)CC1 ZINC000756045566 585313652 /nfs/dbraw/zinc/31/36/52/585313652.db2.gz LOTSWUBPSBRROF-UHFFFAOYSA-N 1 2 241.294 2.127 20 0 BEADLO Cc1ccnc(C[N@H+](C)Cc2ccsc2)n1 ZINC000756489168 585320172 /nfs/dbraw/zinc/32/01/72/585320172.db2.gz ZAJYKOCEMZDMAH-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ccnc(C[N@@H+](C)Cc2ccsc2)n1 ZINC000756489168 585320173 /nfs/dbraw/zinc/32/01/73/585320173.db2.gz ZAJYKOCEMZDMAH-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CC[C@H](C(F)(F)F)C2)[nH]1 ZINC000839534492 585329346 /nfs/dbraw/zinc/32/93/46/585329346.db2.gz STILTFHCQAWSGC-SVRRBLITSA-N 1 2 248.252 2.058 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CC[C@H](C(F)(F)F)C2)[nH]1 ZINC000839534492 585329347 /nfs/dbraw/zinc/32/93/47/585329347.db2.gz STILTFHCQAWSGC-SVRRBLITSA-N 1 2 248.252 2.058 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+]CCc1ccc(C)cc1 ZINC000221475637 585346454 /nfs/dbraw/zinc/34/64/54/585346454.db2.gz GVARBRKTLGTMFY-GFCCVEGCSA-N 1 2 235.327 2.079 20 0 BEADLO Cc1ccc2[nH+]c(COC(=O)[C@@H]3C[C@H]3C)cn2c1 ZINC000758031820 585348516 /nfs/dbraw/zinc/34/85/16/585348516.db2.gz ZQQLSZYXRZICGA-ZYHUDNBSSA-N 1 2 244.294 2.342 20 0 BEADLO O[C@H](Cn1cc[nH+]c1)c1ccc(Cl)c(F)c1 ZINC000759050548 585363883 /nfs/dbraw/zinc/36/38/83/585363883.db2.gz QUEPROOZYYTZDP-LLVKDONJSA-N 1 2 240.665 2.409 20 0 BEADLO COC1(C)C[NH+](C[C@@H](O)c2cc(C)cc(C)c2)C1 ZINC000759047927 585364043 /nfs/dbraw/zinc/36/40/43/585364043.db2.gz JNDVGDKQBGWMFS-CQSZACIVSA-N 1 2 249.354 2.058 20 0 BEADLO C[C@H]1CO[C@H](c2ccccc2)C[N@@H+]1CCF ZINC000759340169 585368564 /nfs/dbraw/zinc/36/85/64/585368564.db2.gz SHJBXFFHAFAUQG-AAEUAGOBSA-N 1 2 223.291 2.418 20 0 BEADLO C[C@H]1CO[C@H](c2ccccc2)C[N@H+]1CCF ZINC000759340169 585368565 /nfs/dbraw/zinc/36/85/65/585368565.db2.gz SHJBXFFHAFAUQG-AAEUAGOBSA-N 1 2 223.291 2.418 20 0 BEADLO CCC(=CC(=O)OCc1c[nH+]cn1C)CC ZINC000759564149 585376234 /nfs/dbraw/zinc/37/62/34/585376234.db2.gz KLRBBPXYODVEPO-UHFFFAOYSA-N 1 2 222.288 2.210 20 0 BEADLO CC(C)c1cnc(COCc2[nH]cc[nH+]2)o1 ZINC000760179475 585386270 /nfs/dbraw/zinc/38/62/70/585386270.db2.gz VPTMQXCIBVNZKU-UHFFFAOYSA-N 1 2 221.260 2.238 20 0 BEADLO CCC(CC)(CC)C(=O)NC1=[NH+]CCS1 ZINC000760306005 585389749 /nfs/dbraw/zinc/38/97/49/585389749.db2.gz YGSMGMOTNLUJSI-UHFFFAOYSA-N 1 2 228.361 2.422 20 0 BEADLO COCCCCO[NH+]=C(N)c1ccccc1C ZINC000760341344 585390875 /nfs/dbraw/zinc/39/08/75/585390875.db2.gz FSOSDRAZMOWNJI-UHFFFAOYSA-N 1 2 236.315 2.268 20 0 BEADLO CC(C)CC1CC[NH+](Cc2ncnn2C)CC1 ZINC000760933765 585401923 /nfs/dbraw/zinc/40/19/23/585401923.db2.gz PBKFXUKRAMJCIW-UHFFFAOYSA-N 1 2 236.363 2.073 20 0 BEADLO CCc1noc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)n1 ZINC000761048326 585404007 /nfs/dbraw/zinc/40/40/07/585404007.db2.gz XEPKSDRLHCKQGE-SSDOTTSWSA-N 1 2 249.236 2.016 20 0 BEADLO CCc1noc(C[N@H+]2CC[C@@H](C(F)(F)F)C2)n1 ZINC000761048326 585404008 /nfs/dbraw/zinc/40/40/08/585404008.db2.gz XEPKSDRLHCKQGE-SSDOTTSWSA-N 1 2 249.236 2.016 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CC[C@H](C(F)(F)F)C2)o1 ZINC000761053947 585404535 /nfs/dbraw/zinc/40/45/35/585404535.db2.gz IFJVCAOXTJXZRD-XPUUQOCRSA-N 1 2 249.236 2.323 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CC[C@H](C(F)(F)F)C2)o1 ZINC000761053947 585404536 /nfs/dbraw/zinc/40/45/36/585404536.db2.gz IFJVCAOXTJXZRD-XPUUQOCRSA-N 1 2 249.236 2.323 20 0 BEADLO c1csc(-c2noc(C[N@@H+]3CC[C@@H]4C[C@@H]43)n2)c1 ZINC000761084653 585407463 /nfs/dbraw/zinc/40/74/63/585407463.db2.gz AYKYNXYYDZXPFD-BDAKNGLRSA-N 1 2 247.323 2.392 20 0 BEADLO c1csc(-c2noc(C[N@H+]3CC[C@@H]4C[C@@H]43)n2)c1 ZINC000761084653 585407464 /nfs/dbraw/zinc/40/74/64/585407464.db2.gz AYKYNXYYDZXPFD-BDAKNGLRSA-N 1 2 247.323 2.392 20 0 BEADLO c1ccc(-c2nc(C[N@@H+]3CC[C@@H]4C[C@@H]43)no2)cc1 ZINC000761101516 585409504 /nfs/dbraw/zinc/40/95/04/585409504.db2.gz YUGCVXUACOYYSB-NEPJUHHUSA-N 1 2 241.294 2.331 20 0 BEADLO c1ccc(-c2nc(C[N@H+]3CC[C@@H]4C[C@@H]43)no2)cc1 ZINC000761101516 585409505 /nfs/dbraw/zinc/40/95/05/585409505.db2.gz YUGCVXUACOYYSB-NEPJUHHUSA-N 1 2 241.294 2.331 20 0 BEADLO Cc1cnc(C[NH+]2CC3(C2)CC(F)(F)C3)cn1 ZINC000761115725 585410536 /nfs/dbraw/zinc/41/05/36/585410536.db2.gz WUXJIBDIODMAKT-UHFFFAOYSA-N 1 2 239.269 2.016 20 0 BEADLO Cn1cc[nH+]c1CN(Cc1ccoc1)C1CC1 ZINC000761222806 585412399 /nfs/dbraw/zinc/41/23/99/585412399.db2.gz RWPCNIODBSOULY-UHFFFAOYSA-N 1 2 231.299 2.178 20 0 BEADLO CC(C)CCCO[NH+]=C(N)COC(C)C ZINC000762205923 585429221 /nfs/dbraw/zinc/42/92/21/585429221.db2.gz DFKQQSYIOVFKNU-UHFFFAOYSA-N 1 2 216.325 2.346 20 0 BEADLO CCCC[C@@H]([NH2+][C@H](C)c1ccc[nH]1)C(=O)OC ZINC000762557348 585434105 /nfs/dbraw/zinc/43/41/05/585434105.db2.gz DHQPXIOQVZCGDP-ZYHUDNBSSA-N 1 2 238.331 2.397 20 0 BEADLO CC(C)=C(C)C(=O)NCc1ccn2cc[nH+]c2c1 ZINC000762560275 585434139 /nfs/dbraw/zinc/43/41/39/585434139.db2.gz BAMIXBISHIMRKP-UHFFFAOYSA-N 1 2 243.310 2.307 20 0 BEADLO CC(C)c1nnc([C@H](C)[NH2+]Cc2ccoc2)[nH]1 ZINC000762627504 585434747 /nfs/dbraw/zinc/43/47/47/585434747.db2.gz JYKRTZXDXFDWGP-VIFPVBQESA-N 1 2 234.303 2.372 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)[C@H]1CC=CCC1 ZINC000763288710 585445798 /nfs/dbraw/zinc/44/57/98/585445798.db2.gz XVFOGQUHBARBGX-LBPRGKRZSA-N 1 2 234.299 2.173 20 0 BEADLO CCCCC(=O)OCCCn1cc[nH+]c1 ZINC000763286699 585445848 /nfs/dbraw/zinc/44/58/48/585445848.db2.gz CBMPMLJYPONFMP-UHFFFAOYSA-N 1 2 210.277 2.007 20 0 BEADLO O=C(/C=C\c1ccco1)OCCCn1cc[nH+]c1 ZINC000763287879 585445971 /nfs/dbraw/zinc/44/59/71/585445971.db2.gz PIOUVLORPVBIKH-PLNGDYQASA-N 1 2 246.266 2.123 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+][C@H](C)Cc1ccccc1C ZINC000763285756 585446038 /nfs/dbraw/zinc/44/60/38/585446038.db2.gz TVNQTBDGMMQCDT-CHWSQXEVSA-N 1 2 249.354 2.467 20 0 BEADLO S=c1scnn1C[N@@H+]1CC[C@@H](C2CC2)C1 ZINC000763331795 585446697 /nfs/dbraw/zinc/44/66/97/585446697.db2.gz IXASPTJKWBYZPM-SECBINFHSA-N 1 2 241.385 2.363 20 0 BEADLO S=c1scnn1C[N@H+]1CC[C@@H](C2CC2)C1 ZINC000763331795 585446698 /nfs/dbraw/zinc/44/66/98/585446698.db2.gz IXASPTJKWBYZPM-SECBINFHSA-N 1 2 241.385 2.363 20 0 BEADLO CCN(CC1CC1)C(=O)c1cccc2[nH+]ccn21 ZINC000764235534 585462231 /nfs/dbraw/zinc/46/22/31/585462231.db2.gz QFGFYTAQMZLVKC-UHFFFAOYSA-N 1 2 243.310 2.206 20 0 BEADLO CS/C=C/C(=O)Nc1cccc2[nH+]ccn21 ZINC000764261938 585463209 /nfs/dbraw/zinc/46/32/09/585463209.db2.gz JBQBLXUEGIGXGS-VMPITWQZSA-N 1 2 233.296 2.150 20 0 BEADLO C[C@@H](OC(=O)CCCn1cc[nH+]c1)C1CC1 ZINC000764384735 585464463 /nfs/dbraw/zinc/46/44/63/585464463.db2.gz XSLCHYXLLAWELS-SNVBAGLBSA-N 1 2 222.288 2.005 20 0 BEADLO C[C@H]1CCN1c1[nH+]cnc2c1cnn2C(C)(C)C ZINC000766405995 585501890 /nfs/dbraw/zinc/50/18/90/585501890.db2.gz XKCXUCCFDHKIEG-VIFPVBQESA-N 1 2 245.330 2.180 20 0 BEADLO Cc1ccc([N@@H+](C)C[C@H](C)CO)cc1C ZINC000766895079 585509013 /nfs/dbraw/zinc/50/90/13/585509013.db2.gz JDJCDKIHYBHCAY-JTQLQIEISA-N 1 2 207.317 2.368 20 0 BEADLO Cc1ccc([N@H+](C)C[C@H](C)CO)cc1C ZINC000766895079 585509014 /nfs/dbraw/zinc/50/90/14/585509014.db2.gz JDJCDKIHYBHCAY-JTQLQIEISA-N 1 2 207.317 2.368 20 0 BEADLO CCc1nnc([C@@H](C)[NH2+]Cc2cc(C)oc2C)[nH]1 ZINC000767394080 585518939 /nfs/dbraw/zinc/51/89/39/585518939.db2.gz YUGVFOUWSFCMFL-SECBINFHSA-N 1 2 248.330 2.428 20 0 BEADLO CO[C@@H](C)CSCc1cc[nH+]c(N(C)C)c1 ZINC000767873947 585527335 /nfs/dbraw/zinc/52/73/35/585527335.db2.gz IYOPYISPPBULMU-JTQLQIEISA-N 1 2 240.372 2.416 20 0 BEADLO Cc1[nH]c(C(=O)NCc2c(C)cccc2C)c[nH+]1 ZINC000768287029 585535072 /nfs/dbraw/zinc/53/50/72/585535072.db2.gz UYUOAJXUOFSKSO-UHFFFAOYSA-N 1 2 243.310 2.265 20 0 BEADLO C[C@@H](CC(=O)N(C)CCCn1cc[nH+]c1)C1CC1 ZINC000768323250 585535731 /nfs/dbraw/zinc/53/57/31/585535731.db2.gz GGEMGKFVCOCTJA-LBPRGKRZSA-N 1 2 249.358 2.168 20 0 BEADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cn[nH]c2)no1 ZINC000768429197 585538549 /nfs/dbraw/zinc/53/85/49/585538549.db2.gz MQBHJFJGVPUQTL-LBPRGKRZSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cn[nH]c2)no1 ZINC000768429197 585538550 /nfs/dbraw/zinc/53/85/50/585538550.db2.gz MQBHJFJGVPUQTL-LBPRGKRZSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1nc(N2CCCCCCC2)nc(N(C)C)[nH+]1 ZINC000768522565 585539593 /nfs/dbraw/zinc/53/95/93/585539593.db2.gz SNWGWJLJFSSOJQ-UHFFFAOYSA-N 1 2 249.362 2.017 20 0 BEADLO Cc1nc(N(C)C)nc(N2CCCCCCC2)[nH+]1 ZINC000768522565 585539594 /nfs/dbraw/zinc/53/95/94/585539594.db2.gz SNWGWJLJFSSOJQ-UHFFFAOYSA-N 1 2 249.362 2.017 20 0 BEADLO COCCCCCO[NH+]=C(N)COC(C)(C)C ZINC000768931493 585546097 /nfs/dbraw/zinc/54/60/97/585546097.db2.gz KSEOMXQTQOLVPR-UHFFFAOYSA-N 1 2 246.351 2.117 20 0 BEADLO CCCCO[NH+]=C(N)COC(C)(C)C ZINC000768932211 585546303 /nfs/dbraw/zinc/54/63/03/585546303.db2.gz LYQIOCJJOXWXSZ-UHFFFAOYSA-N 1 2 202.298 2.100 20 0 BEADLO CC(C)(C)OCC(N)=[NH+]OCC1CCCC1 ZINC000768934156 585546312 /nfs/dbraw/zinc/54/63/12/585546312.db2.gz ZMAQTRUZHQTDIG-UHFFFAOYSA-N 1 2 228.336 2.490 20 0 BEADLO C[C@@H]1CCC[C@@H]1CC(=O)OCc1c[nH+]cn1C ZINC000769303201 585553078 /nfs/dbraw/zinc/55/30/78/585553078.db2.gz HBPPEBPWZDMNRZ-GHMZBOCLSA-N 1 2 236.315 2.290 20 0 BEADLO C[C@@H]1CCC[C@H]1CC(=O)OCc1c[nH+]cn1C ZINC000769303203 585553099 /nfs/dbraw/zinc/55/30/99/585553099.db2.gz HBPPEBPWZDMNRZ-MNOVXSKESA-N 1 2 236.315 2.290 20 0 BEADLO C[C@H]1C[N@H+](Cc2coc(C3CC3)n2)CCCO1 ZINC000769319716 585553796 /nfs/dbraw/zinc/55/37/96/585553796.db2.gz XXERMOLARZCPCX-JTQLQIEISA-N 1 2 236.315 2.163 20 0 BEADLO C[C@H]1C[N@@H+](Cc2coc(C3CC3)n2)CCCO1 ZINC000769319716 585553797 /nfs/dbraw/zinc/55/37/97/585553797.db2.gz XXERMOLARZCPCX-JTQLQIEISA-N 1 2 236.315 2.163 20 0 BEADLO CCN1CC[N@@H+](Cc2cc(C)oc2C)C[C@@H]1C ZINC000769380498 585554985 /nfs/dbraw/zinc/55/49/85/585554985.db2.gz JJJULODAHLAYGQ-NSHDSACASA-N 1 2 236.359 2.422 20 0 BEADLO NC(Cc1ccccc1)=[NH+]OC[C@@H]1CCCOC1 ZINC000769877878 585565790 /nfs/dbraw/zinc/56/57/90/585565790.db2.gz MNHRJINRKFQELT-CYBMUJFWSA-N 1 2 248.326 2.154 20 0 BEADLO CCc1noc(C)c1[C@@H](C)[NH2+]Cc1cc[nH]n1 ZINC000769875804 585565879 /nfs/dbraw/zinc/56/58/79/585565879.db2.gz XDDNIOYJXHYRQX-MRVPVSSYSA-N 1 2 234.303 2.119 20 0 BEADLO CCn1cc[nH+]c1CNc1cnn(C)c1C1CC1 ZINC000769922994 585566632 /nfs/dbraw/zinc/56/66/32/585566632.db2.gz ICSNQMKTXLNBFW-UHFFFAOYSA-N 1 2 245.330 2.126 20 0 BEADLO O=C(Nc1nccs1)c1cccc2[nH+]ccn21 ZINC000770040510 585570055 /nfs/dbraw/zinc/57/00/55/585570055.db2.gz VGCBBXYUEKYYOR-UHFFFAOYSA-N 1 2 244.279 2.043 20 0 BEADLO C[C@@H](C1CC1)N(C)C(=O)c1cccc2[nH+]ccn21 ZINC000770402686 585573913 /nfs/dbraw/zinc/57/39/13/585573913.db2.gz QWZJVCHNIIERJT-JTQLQIEISA-N 1 2 243.310 2.205 20 0 BEADLO C[N@@H+]1CCCc2cc(NCc3cn[nH]c3)ccc21 ZINC000770539818 585576014 /nfs/dbraw/zinc/57/60/14/585576014.db2.gz FNHSPECUDTXUHL-UHFFFAOYSA-N 1 2 242.326 2.404 20 0 BEADLO C[N@H+]1CCCc2cc(NCc3cn[nH]c3)ccc21 ZINC000770539818 585576015 /nfs/dbraw/zinc/57/60/15/585576015.db2.gz FNHSPECUDTXUHL-UHFFFAOYSA-N 1 2 242.326 2.404 20 0 BEADLO CCCC(=O)OCc1cccc2[nH+]ccn21 ZINC000770732055 585580669 /nfs/dbraw/zinc/58/06/69/585580669.db2.gz AVGIZVRTCJXSLB-UHFFFAOYSA-N 1 2 218.256 2.178 20 0 BEADLO COc1cc[nH+]cc1COC(=O)/C=C(\C)C1CC1 ZINC000805420183 585591430 /nfs/dbraw/zinc/59/14/30/585591430.db2.gz UNGGWADZFIGCAT-JXMROGBWSA-N 1 2 247.294 2.490 20 0 BEADLO CC/C=C(/C)C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000771498859 585595657 /nfs/dbraw/zinc/59/56/57/585595657.db2.gz ILKUQJARDJBABJ-GULOHRGCSA-N 1 2 233.315 2.430 20 0 BEADLO Cc1cc(F)ccc1C(=O)OCc1c[nH+]cn1C ZINC000771616789 585597901 /nfs/dbraw/zinc/59/79/01/585597901.db2.gz OQBMQVYSPRDTAN-UHFFFAOYSA-N 1 2 248.257 2.225 20 0 BEADLO C/C(=C/C(C)(C)C)C(=O)NCCCn1cc[nH+]c1 ZINC000771841628 585602209 /nfs/dbraw/zinc/60/22/09/585602209.db2.gz WPEWLNOHMDNGKO-BENRWUELSA-N 1 2 249.358 2.382 20 0 BEADLO CC(C)OCC(N)=[NH+]OCC1CCCC1 ZINC000771863899 585603040 /nfs/dbraw/zinc/60/30/40/585603040.db2.gz LAVWOVWVMVGWEE-UHFFFAOYSA-N 1 2 214.309 2.100 20 0 BEADLO CCc1cc(NCCc2cnc(C)s2)nc[nH+]1 ZINC000771926713 585604733 /nfs/dbraw/zinc/60/47/33/585604733.db2.gz ISKUAGMHTYALFZ-UHFFFAOYSA-N 1 2 248.355 2.459 20 0 BEADLO C[C@@H](C(=O)OCCn1cc[nH+]c1)C(C)(C)C ZINC000771964135 585605722 /nfs/dbraw/zinc/60/57/22/585605722.db2.gz GUFXLSUAANTPKL-JTQLQIEISA-N 1 2 224.304 2.109 20 0 BEADLO O=C(OCCn1cc[nH+]c1)[C@H]1CC12CCCC2 ZINC000771984343 585606125 /nfs/dbraw/zinc/60/61/25/585606125.db2.gz NVFJXKNUPLSPGW-LLVKDONJSA-N 1 2 234.299 2.007 20 0 BEADLO Cc1cccc(C(=O)OCCn2cc[nH+]c2)c1F ZINC000772003346 585606690 /nfs/dbraw/zinc/60/66/90/585606690.db2.gz KSQJUAOFCJOLMV-UHFFFAOYSA-N 1 2 248.257 2.188 20 0 BEADLO CCc1oc(C(=O)OCCn2cc[nH+]c2)cc1C ZINC000772001290 585606720 /nfs/dbraw/zinc/60/67/20/585606720.db2.gz DFJVJZIOUGWDLR-UHFFFAOYSA-N 1 2 248.282 2.204 20 0 BEADLO Cc1cc(F)ccc1C(=O)OCCn1cc[nH+]c1 ZINC000772013121 585606875 /nfs/dbraw/zinc/60/68/75/585606875.db2.gz KPNUWTXVAAVGQZ-UHFFFAOYSA-N 1 2 248.257 2.188 20 0 BEADLO Cc1ccc(COC(=O)COCC2CC2)c(C)[nH+]1 ZINC000772016436 585606923 /nfs/dbraw/zinc/60/69/23/585606923.db2.gz QNOSREQHPQSWMP-UHFFFAOYSA-N 1 2 249.310 2.168 20 0 BEADLO Cc1ccc(COC(=O)[C@H]2CCCCO2)c(C)[nH+]1 ZINC000772208172 585610009 /nfs/dbraw/zinc/61/00/09/585610009.db2.gz SPORMLKDJBJFJC-CYBMUJFWSA-N 1 2 249.310 2.311 20 0 BEADLO COCCC(=O)Cn1c[nH+]c2cc(C)c(C)cc21 ZINC000772229747 585610634 /nfs/dbraw/zinc/61/06/34/585610634.db2.gz JBEJWODUWHKNOF-UHFFFAOYSA-N 1 2 246.310 2.259 20 0 BEADLO COCC1(C(=O)OCc2ccc(C)[nH+]c2C)CC1 ZINC000772239407 585610773 /nfs/dbraw/zinc/61/07/73/585610773.db2.gz CWDWHIDRWPIXPT-UHFFFAOYSA-N 1 2 249.310 2.168 20 0 BEADLO CC1(C)CCC[C@H]1C(=O)OCCn1cc[nH+]c1 ZINC000772604194 585619033 /nfs/dbraw/zinc/61/90/33/585619033.db2.gz WUULTPLBHOQLSD-NSHDSACASA-N 1 2 236.315 2.253 20 0 BEADLO Cn1c[nH+]cc1COC(=O)C1=CCCCCC1 ZINC000774136065 585651396 /nfs/dbraw/zinc/65/13/96/585651396.db2.gz ANSVUXGFAKTNNH-UHFFFAOYSA-N 1 2 234.299 2.354 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@@H]1CCCC1(C)C ZINC000774138104 585651638 /nfs/dbraw/zinc/65/16/38/585651638.db2.gz KMYBAOUKBHQFDC-NSHDSACASA-N 1 2 236.315 2.290 20 0 BEADLO C/C=C/C(=O)NCc1ccccc1-n1cc[nH+]c1 ZINC000774166407 585652468 /nfs/dbraw/zinc/65/24/68/585652468.db2.gz DOCJYWDPNDCPIC-GORDUTHDSA-N 1 2 241.294 2.065 20 0 BEADLO Cc1occc1SCC[NH+]1CCOCC1 ZINC000775216412 585673597 /nfs/dbraw/zinc/67/35/97/585673597.db2.gz RNBWVPXIBMZDRZ-UHFFFAOYSA-N 1 2 227.329 2.012 20 0 BEADLO Cc1nc2[nH]ccc2c(NCCCCCCO)[nH+]1 ZINC000775697585 585683441 /nfs/dbraw/zinc/68/34/41/585683441.db2.gz GHGQCOUFGVOATC-UHFFFAOYSA-N 1 2 248.330 2.183 20 0 BEADLO CCCC[C@@H]([NH2+]C1CC(C(F)F)C1)C(=O)OC ZINC000775980619 585688914 /nfs/dbraw/zinc/68/89/14/585688914.db2.gz SAQBPCFJPBLJKN-UDNWOFFPSA-N 1 2 249.301 2.352 20 0 BEADLO CCCOC(=O)[C@H](C)[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000778232521 585727780 /nfs/dbraw/zinc/72/77/80/585727780.db2.gz FXJIAZGMKSKNHQ-OUAUKWLOSA-N 1 2 231.311 2.008 20 0 BEADLO CCCOC(=O)[C@H](C)[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000778232521 585727781 /nfs/dbraw/zinc/72/77/81/585727781.db2.gz FXJIAZGMKSKNHQ-OUAUKWLOSA-N 1 2 231.311 2.008 20 0 BEADLO O=C1c2cc(F)ccc2CN1C[N@H+]1CC=CCC1 ZINC000778576422 585737565 /nfs/dbraw/zinc/73/75/65/585737565.db2.gz KGKKQGKXXBWQHH-UHFFFAOYSA-N 1 2 246.285 2.001 20 0 BEADLO O=C1c2cc(F)ccc2CN1C[N@@H+]1CC=CCC1 ZINC000778576422 585737566 /nfs/dbraw/zinc/73/75/66/585737566.db2.gz KGKKQGKXXBWQHH-UHFFFAOYSA-N 1 2 246.285 2.001 20 0 BEADLO CC(C)(C)c1nnc(C[N@H+]2CC=CCC2)o1 ZINC000778967704 585743078 /nfs/dbraw/zinc/74/30/78/585743078.db2.gz UMGJLVVLTUJOBJ-UHFFFAOYSA-N 1 2 221.304 2.129 20 0 BEADLO CC(C)(C)c1nnc(C[N@@H+]2CC=CCC2)o1 ZINC000778967704 585743079 /nfs/dbraw/zinc/74/30/79/585743079.db2.gz UMGJLVVLTUJOBJ-UHFFFAOYSA-N 1 2 221.304 2.129 20 0 BEADLO Cc1cc(Cl)ccc1CO[NH+]=C(N)CCO ZINC000780126326 585772847 /nfs/dbraw/zinc/77/28/47/585772847.db2.gz XZALAPFVXNTXKQ-UHFFFAOYSA-N 1 2 242.706 2.029 20 0 BEADLO Cc1nc2[nH]ccc2c(NC[C@H]2CCC=CO2)[nH+]1 ZINC000780621593 585782368 /nfs/dbraw/zinc/78/23/68/585782368.db2.gz GUTMNLCPBSAIBS-SNVBAGLBSA-N 1 2 244.298 2.371 20 0 BEADLO CCc1cccnc1[C@H](C)[NH2+]Cc1ccon1 ZINC000780725351 585783626 /nfs/dbraw/zinc/78/36/26/585783626.db2.gz QHGKMRWOVCLFEF-JTQLQIEISA-N 1 2 231.299 2.483 20 0 BEADLO CC/C(C)=C(/C)C(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000780986520 585787953 /nfs/dbraw/zinc/78/79/53/585787953.db2.gz NIZRIIMNMLMHIA-DWOQACPDSA-N 1 2 247.342 2.130 20 0 BEADLO CCC(C)=C(C)C(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000780986520 585787954 /nfs/dbraw/zinc/78/79/54/585787954.db2.gz NIZRIIMNMLMHIA-DWOQACPDSA-N 1 2 247.342 2.130 20 0 BEADLO CC[C@@H](NC(=O)C[C@@H](C)C1CC1)c1[nH]cc[nH+]1 ZINC000781994137 585806296 /nfs/dbraw/zinc/80/62/96/585806296.db2.gz YAKZNQDKBXPCNR-MWLCHTKSSA-N 1 2 235.331 2.413 20 0 BEADLO CC/C=C(\C)C(=O)OCCCn1cc[nH+]c1 ZINC000782306353 585814507 /nfs/dbraw/zinc/81/45/07/585814507.db2.gz REXDAUAPDMQLOY-VZUCSPMQSA-N 1 2 222.288 2.173 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OCCOC(C)C ZINC000782305636 585814607 /nfs/dbraw/zinc/81/46/07/585814607.db2.gz QWIREDQFVIZJBK-UHFFFAOYSA-N 1 2 236.315 2.267 20 0 BEADLO CC(C)OCCO[NH+]=C(N)c1cccc(F)c1 ZINC000782321118 585814937 /nfs/dbraw/zinc/81/49/37/585814937.db2.gz MRJQIFNWCDSYPV-UHFFFAOYSA-N 1 2 240.278 2.097 20 0 BEADLO CCC/C(C)=C/C(=O)N1CCn2cc(C)[nH+]c2C1 ZINC000782727161 585824154 /nfs/dbraw/zinc/82/41/54/585824154.db2.gz CWZJMSDJMLCBHQ-DHZHZOJOSA-N 1 2 247.342 2.280 20 0 BEADLO CC(F)(F)CCC(=O)OCCCn1cc[nH+]c1 ZINC000783005909 585826802 /nfs/dbraw/zinc/82/68/02/585826802.db2.gz GLDNBZBASVGUOD-UHFFFAOYSA-N 1 2 246.257 2.252 20 0 BEADLO C[C@@H]1C[C@@H](CO[NH+]=C(N)c2ccccc2)CCO1 ZINC000783001293 585826817 /nfs/dbraw/zinc/82/68/17/585826817.db2.gz MFHIUQUSLOJQQO-NEPJUHHUSA-N 1 2 248.326 2.348 20 0 BEADLO C[C@H]1C[C@@H](CO[NH+]=C(N)c2ccccc2)CCO1 ZINC000783001295 585826972 /nfs/dbraw/zinc/82/69/72/585826972.db2.gz MFHIUQUSLOJQQO-RYUDHWBXSA-N 1 2 248.326 2.348 20 0 BEADLO NC(COc1ccccc1)=[NH+]OCCC1CC1 ZINC000783555306 585836622 /nfs/dbraw/zinc/83/66/22/585836622.db2.gz NJEZOUZAUUDTDP-UHFFFAOYSA-N 1 2 234.299 2.364 20 0 BEADLO O=C(CCCc1ccsc1)NCc1[nH]cc[nH+]1 ZINC000783577616 585837268 /nfs/dbraw/zinc/83/72/68/585837268.db2.gz UIWMLVWFHOMXND-UHFFFAOYSA-N 1 2 249.339 2.110 20 0 BEADLO CCC1(C(=O)OCCCn2cc[nH+]c2)CC1 ZINC000784015182 585846951 /nfs/dbraw/zinc/84/69/51/585846951.db2.gz MSKSYWPKLSIWPS-UHFFFAOYSA-N 1 2 222.288 2.007 20 0 BEADLO CC(C)[C@H](F)C(=O)Nc1cccc2[nH+]ccn21 ZINC000784120357 585850172 /nfs/dbraw/zinc/85/01/72/585850172.db2.gz VMWYJLVJTYCFBK-NSHDSACASA-N 1 2 235.262 2.267 20 0 BEADLO CC[C@@]1(CO)CCC[N@@H+]1CC(F)(F)C(F)F ZINC000784388118 585857742 /nfs/dbraw/zinc/85/77/42/585857742.db2.gz HFCSYTWMMMBGMP-VIFPVBQESA-N 1 2 243.244 2.124 20 0 BEADLO CC[C@@]1(CO)CCC[N@H+]1CC(F)(F)C(F)F ZINC000784388118 585857743 /nfs/dbraw/zinc/85/77/43/585857743.db2.gz HFCSYTWMMMBGMP-VIFPVBQESA-N 1 2 243.244 2.124 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccnc(F)c2)[C@@H](C)[C@H](C)O1 ZINC000859270280 589026564 /nfs/dbraw/zinc/02/65/64/589026564.db2.gz NYSDYSNANDFHFN-VWYCJHECSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccnc(F)c2)[C@@H](C)[C@H](C)O1 ZINC000859270280 589026566 /nfs/dbraw/zinc/02/65/66/589026566.db2.gz NYSDYSNANDFHFN-VWYCJHECSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)OCCCn2cc[nH+]c2)C1 ZINC000784568074 585863521 /nfs/dbraw/zinc/86/35/21/585863521.db2.gz PZMZBRVIBLZRHT-VXGBXAGGSA-N 1 2 236.315 2.253 20 0 BEADLO CO[C@@H]1Cc2ccc(NCc3[nH]cc[nH+]3)cc2C1 ZINC000784637576 585864977 /nfs/dbraw/zinc/86/49/77/585864977.db2.gz SGXGBCQROPDADN-CYBMUJFWSA-N 1 2 243.310 2.135 20 0 BEADLO O=C(OCC1CC1)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000785017604 585869769 /nfs/dbraw/zinc/86/97/69/585869769.db2.gz HMILPOGJLMVEFM-LBPRGKRZSA-N 1 2 249.314 2.067 20 0 BEADLO COc1ccc([NH2+]CC(C)C)cc1NC(N)=O ZINC000785561878 585875521 /nfs/dbraw/zinc/87/55/21/585875521.db2.gz WXEULDQGWKJHSF-UHFFFAOYSA-N 1 2 237.303 2.254 20 0 BEADLO Cc1nc(F)ccc1C[N@H+]1CCO[C@H](C)[C@@H]1C ZINC000787174303 585902567 /nfs/dbraw/zinc/90/25/67/585902567.db2.gz BCJBULQGRWUZJS-WDEREUQCSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1nc(F)ccc1C[N@@H+]1CCO[C@H](C)[C@@H]1C ZINC000787174303 585902568 /nfs/dbraw/zinc/90/25/68/585902568.db2.gz BCJBULQGRWUZJS-WDEREUQCSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1ccccc1C(=O)OCc1cc[nH+]c(N)c1 ZINC000787577720 585912128 /nfs/dbraw/zinc/91/21/28/585912128.db2.gz DAMMIKWEFMLELA-UHFFFAOYSA-N 1 2 242.278 2.329 20 0 BEADLO CC1(C)C[NH+](C[C@H](O)c2c(F)cccc2F)C1 ZINC000788433544 585923157 /nfs/dbraw/zinc/92/31/57/585923157.db2.gz BSVYOSQCAGRRDO-NSHDSACASA-N 1 2 241.281 2.340 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2cccnc2F)no1 ZINC000788801594 585930653 /nfs/dbraw/zinc/93/06/53/585930653.db2.gz BBBABIASEDZAQM-VIFPVBQESA-N 1 2 235.262 2.368 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@@H+]1CC[C@@H]2C[C@@H]21 ZINC000789300973 585939261 /nfs/dbraw/zinc/93/92/61/585939261.db2.gz QSUZKWGXNQXFSE-MIMYLULJSA-N 1 2 237.324 2.056 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@H+]1CC[C@@H]2C[C@@H]21 ZINC000789300973 585939262 /nfs/dbraw/zinc/93/92/62/585939262.db2.gz QSUZKWGXNQXFSE-MIMYLULJSA-N 1 2 237.324 2.056 20 0 BEADLO CC(C)C[C@@H](C)CO[NH+]=C(N)[C@H]1CCCO1 ZINC000789608694 585946224 /nfs/dbraw/zinc/94/62/24/585946224.db2.gz LDUGSNBDIOHMCZ-GHMZBOCLSA-N 1 2 228.336 2.346 20 0 BEADLO CC(C)CCCO[NH+]=C(N)[C@@H]1CCCO1 ZINC000789608533 585946261 /nfs/dbraw/zinc/94/62/61/585946261.db2.gz KKXFIPBOCSGTOX-JTQLQIEISA-N 1 2 214.309 2.100 20 0 BEADLO C[C@@H]1CCC[C@@H](CO[NH+]=C(N)[C@H]2CCCO2)C1 ZINC000789608543 585946276 /nfs/dbraw/zinc/94/62/76/585946276.db2.gz KMIHTKOCLACRKJ-IJLUTSLNSA-N 1 2 240.347 2.490 20 0 BEADLO CC=C(CC)C(=O)Nc1cc(C)[nH+]cc1C ZINC000789662708 585948213 /nfs/dbraw/zinc/94/82/13/585948213.db2.gz VKYDOBNMJSAQOI-WZUFQYTHSA-N 1 2 218.300 2.415 20 0 BEADLO CCC[C@@H](C)CC(=O)OCCc1c[nH+]cn1C ZINC000789776038 585949669 /nfs/dbraw/zinc/94/96/69/585949669.db2.gz GNJPHIRHAPWIJE-LLVKDONJSA-N 1 2 238.331 2.332 20 0 BEADLO Cn1cc[nH+]c1CCCOC(=O)C[C@@H]1C=CCC1 ZINC000789792429 585950373 /nfs/dbraw/zinc/95/03/73/585950373.db2.gz UMMZURNCOIHDQE-GFCCVEGCSA-N 1 2 248.326 2.252 20 0 BEADLO Cc1cnc(C[N@@H+]2CCO[C@H](C(C)(C)C)C2)cn1 ZINC000790434100 585964605 /nfs/dbraw/zinc/96/46/05/585964605.db2.gz YIEYSMPFSYFNMU-ZDUSSCGKSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1cnc(C[N@H+]2CCO[C@H](C(C)(C)C)C2)cn1 ZINC000790434100 585964606 /nfs/dbraw/zinc/96/46/06/585964606.db2.gz YIEYSMPFSYFNMU-ZDUSSCGKSA-N 1 2 249.358 2.032 20 0 BEADLO CCc1[nH+]c(C)ccc1OCc1ncccn1 ZINC000790513340 585965849 /nfs/dbraw/zinc/96/58/49/585965849.db2.gz HHNDEUYAEUNNBB-UHFFFAOYSA-N 1 2 229.283 2.321 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1CC(=O)OCc1ccccc1 ZINC000791566038 585984149 /nfs/dbraw/zinc/98/41/49/585984149.db2.gz LHURJIOYTWNJMT-RYUDHWBXSA-N 1 2 233.311 2.213 20 0 BEADLO CC1(C(=O)OCc2cc[nH+]c(N)c2)CCCC1 ZINC000791569501 585984515 /nfs/dbraw/zinc/98/45/15/585984515.db2.gz CWGYEOHIBHGBEU-UHFFFAOYSA-N 1 2 234.299 2.287 20 0 BEADLO Cc1nonc1C[N@H+]1CC[C@H](C(F)(F)F)[C@H]1C ZINC000791583186 585984705 /nfs/dbraw/zinc/98/47/05/585984705.db2.gz MRCFNHIMXAPFLY-SFYZADRCSA-N 1 2 249.236 2.151 20 0 BEADLO Cc1nonc1C[N@@H+]1CC[C@H](C(F)(F)F)[C@H]1C ZINC000791583186 585984706 /nfs/dbraw/zinc/98/47/06/585984706.db2.gz MRCFNHIMXAPFLY-SFYZADRCSA-N 1 2 249.236 2.151 20 0 BEADLO C[C@H](C(=O)OCc1cc[nH+]c(N)c1)c1ccco1 ZINC000791943140 585992349 /nfs/dbraw/zinc/99/23/49/585992349.db2.gz DRSZNEIATZOBRZ-VIFPVBQESA-N 1 2 246.266 2.104 20 0 BEADLO CCC(=CC(=O)OCc1cc[nH+]c(N)c1)CC ZINC000792024092 585994025 /nfs/dbraw/zinc/99/40/25/585994025.db2.gz LMJVHTBMYFHSSC-UHFFFAOYSA-N 1 2 234.299 2.453 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)C=C1CCCC1 ZINC000793259234 586015242 /nfs/dbraw/zinc/01/52/42/586015242.db2.gz RQJPXESSNCQPFQ-UHFFFAOYSA-N 1 2 234.299 2.006 20 0 BEADLO CCc1cc(C[NH2+][C@@H](C)c2cc(C)nn2C)on1 ZINC000793533918 586021905 /nfs/dbraw/zinc/02/19/05/586021905.db2.gz LOPONSSTFFJHAQ-JTQLQIEISA-N 1 2 248.330 2.130 20 0 BEADLO COc1ccc(N[C@H](C)c2cc(C)nn2C)[nH+]c1 ZINC000793551284 586022881 /nfs/dbraw/zinc/02/28/81/586022881.db2.gz YPXVKIPWPSTPLM-SNVBAGLBSA-N 1 2 246.314 2.305 20 0 BEADLO CC[C@@H]1CC[N@@H+]1CN1Cc2ccc(F)cc2C1=O ZINC000793822752 586027454 /nfs/dbraw/zinc/02/74/54/586027454.db2.gz FHNVKCDJPIUNBD-GFCCVEGCSA-N 1 2 248.301 2.223 20 0 BEADLO CC[C@@H]1CC[N@H+]1CN1Cc2ccc(F)cc2C1=O ZINC000793822752 586027455 /nfs/dbraw/zinc/02/74/55/586027455.db2.gz FHNVKCDJPIUNBD-GFCCVEGCSA-N 1 2 248.301 2.223 20 0 BEADLO CC1=CCC[N@@H+](Cc2cc(Cl)n(C)n2)C1 ZINC000859289255 589028090 /nfs/dbraw/zinc/02/80/90/589028090.db2.gz BUBNIEDIULPNFM-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO CC1=CCC[N@H+](Cc2cc(Cl)n(C)n2)C1 ZINC000859289255 589028092 /nfs/dbraw/zinc/02/80/92/589028092.db2.gz BUBNIEDIULPNFM-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO CCOC1CC(CO[NH+]=C(N)c2ccccc2)C1 ZINC000795196711 586071124 /nfs/dbraw/zinc/07/11/24/586071124.db2.gz FHXVTQFAZFODNQ-UHFFFAOYSA-N 1 2 248.326 2.348 20 0 BEADLO C[N@H+](Cc1ccccc1)[C@H]1CC(C)(C)OC1=O ZINC000795662120 586090444 /nfs/dbraw/zinc/09/04/44/586090444.db2.gz RHGSVBIQKINKKO-LBPRGKRZSA-N 1 2 233.311 2.213 20 0 BEADLO C[N@@H+](Cc1ccccc1)[C@H]1CC(C)(C)OC1=O ZINC000795662120 586090445 /nfs/dbraw/zinc/09/04/45/586090445.db2.gz RHGSVBIQKINKKO-LBPRGKRZSA-N 1 2 233.311 2.213 20 0 BEADLO CCC(=O)OCc1cn2cccc(C)c2[nH+]1 ZINC000795920564 586094470 /nfs/dbraw/zinc/09/44/70/586094470.db2.gz VBPBVHIJTMEQJL-UHFFFAOYSA-N 1 2 218.256 2.096 20 0 BEADLO Cc1cnc(C[NH+]2CCC(F)(F)CC2)o1 ZINC000796539691 586106568 /nfs/dbraw/zinc/10/65/68/586106568.db2.gz CWCCZDZCSPEIKK-UHFFFAOYSA-N 1 2 216.231 2.214 20 0 BEADLO Cc1nnc([C@@H](C)[NH+]2CCC(F)(F)CC2)o1 ZINC000796548984 586106659 /nfs/dbraw/zinc/10/66/59/586106659.db2.gz FCAUAWKTJWHHOH-SSDOTTSWSA-N 1 2 231.246 2.170 20 0 BEADLO CC1=C(C)C[N@H+](CC(=O)OCC(C)C)CC1 ZINC000796590920 586107971 /nfs/dbraw/zinc/10/79/71/586107971.db2.gz YJYGGOVZPFFGLF-UHFFFAOYSA-N 1 2 225.332 2.228 20 0 BEADLO CC1=C(C)C[N@@H+](CC(=O)OCC(C)C)CC1 ZINC000796590920 586107972 /nfs/dbraw/zinc/10/79/72/586107972.db2.gz YJYGGOVZPFFGLF-UHFFFAOYSA-N 1 2 225.332 2.228 20 0 BEADLO CC1=C[C@H](C)C[N@H+](Cn2cc(Cl)cn2)C1 ZINC000797416044 586126711 /nfs/dbraw/zinc/12/67/11/586126711.db2.gz FYXMXGWGYWCXJX-VIFPVBQESA-N 1 2 225.723 2.392 20 0 BEADLO CC1=C[C@H](C)C[N@@H+](Cn2cc(Cl)cn2)C1 ZINC000797416044 586126712 /nfs/dbraw/zinc/12/67/12/586126712.db2.gz FYXMXGWGYWCXJX-VIFPVBQESA-N 1 2 225.723 2.392 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)c2ccc[nH]2)c1 ZINC000797858367 586133393 /nfs/dbraw/zinc/13/33/93/586133393.db2.gz NEASOUHVZBIWIM-UHFFFAOYSA-N 1 2 246.266 2.084 20 0 BEADLO CCCC[C@@H](C)C(=O)OCc1c[nH+]cn1C ZINC000800394527 586215746 /nfs/dbraw/zinc/21/57/46/586215746.db2.gz HNPVAHWXBKPQLZ-SNVBAGLBSA-N 1 2 224.304 2.290 20 0 BEADLO O=C1OCC[C@@H]1CC[N@H+]1CCCC[C@H]1C(F)F ZINC000800445772 586220233 /nfs/dbraw/zinc/22/02/33/586220233.db2.gz KXTSUYPBUCIKAK-UWVGGRQHSA-N 1 2 247.285 2.059 20 0 BEADLO O=C1OCC[C@@H]1CC[N@@H+]1CCCC[C@H]1C(F)F ZINC000800445772 586220235 /nfs/dbraw/zinc/22/02/35/586220235.db2.gz KXTSUYPBUCIKAK-UWVGGRQHSA-N 1 2 247.285 2.059 20 0 BEADLO CC(C)SCCO[NH+]=C(N)COC(C)(C)C ZINC000800868616 586235337 /nfs/dbraw/zinc/23/53/37/586235337.db2.gz GVCWDBBZDAXUFZ-UHFFFAOYSA-N 1 2 248.392 2.442 20 0 BEADLO C[C@@H](c1cccnc1)[N@@H+]1CCO[C@H](C(F)F)C1 ZINC000801566627 586264199 /nfs/dbraw/zinc/26/41/99/586264199.db2.gz DHZSSZQZROALAI-ONGXEEELSA-N 1 2 242.269 2.109 20 0 BEADLO C[C@@H](c1cccnc1)[N@H+]1CCO[C@H](C(F)F)C1 ZINC000801566627 586264201 /nfs/dbraw/zinc/26/42/01/586264201.db2.gz DHZSSZQZROALAI-ONGXEEELSA-N 1 2 242.269 2.109 20 0 BEADLO CNc1[nH+]c(C)ccc1C(=O)OC[C@H]1C[C@H]1C ZINC000859501289 589040903 /nfs/dbraw/zinc/04/09/03/589040903.db2.gz KIUWDYDQCJENNV-PSASIEDQSA-N 1 2 234.299 2.245 20 0 BEADLO CCC1(C(=O)O[C@H]2CC[N@H+](CCF)C2)CCC1 ZINC000802236274 586297178 /nfs/dbraw/zinc/29/71/78/586297178.db2.gz XNEQLAGDJKSZJO-NSHDSACASA-N 1 2 243.322 2.154 20 0 BEADLO CCC1(C(=O)O[C@H]2CC[N@@H+](CCF)C2)CCC1 ZINC000802236274 586297180 /nfs/dbraw/zinc/29/71/80/586297180.db2.gz XNEQLAGDJKSZJO-NSHDSACASA-N 1 2 243.322 2.154 20 0 BEADLO CC(C)C(C)(C)C(=O)O[C@@H]1CC[N@H+](CCF)C1 ZINC000802238668 586299278 /nfs/dbraw/zinc/29/92/78/586299278.db2.gz JUFYPYCJIIKOGG-LLVKDONJSA-N 1 2 245.338 2.256 20 0 BEADLO CC(C)C(C)(C)C(=O)O[C@@H]1CC[N@@H+](CCF)C1 ZINC000802238668 586299279 /nfs/dbraw/zinc/29/92/79/586299279.db2.gz JUFYPYCJIIKOGG-LLVKDONJSA-N 1 2 245.338 2.256 20 0 BEADLO FC1(F)CCC[N@H+](Cc2cnsn2)CC1 ZINC000859540989 589042389 /nfs/dbraw/zinc/04/23/89/589042389.db2.gz OIZOASPTVQFVNI-UHFFFAOYSA-N 1 2 233.287 2.159 20 0 BEADLO FC1(F)CCC[N@@H+](Cc2cnsn2)CC1 ZINC000859540989 589042390 /nfs/dbraw/zinc/04/23/90/589042390.db2.gz OIZOASPTVQFVNI-UHFFFAOYSA-N 1 2 233.287 2.159 20 0 BEADLO Cn1cc[nH+]c1CCCOC(=O)CC1(C)CC1 ZINC000802789737 586315073 /nfs/dbraw/zinc/31/50/73/586315073.db2.gz GKXKMIAVWJEXDH-UHFFFAOYSA-N 1 2 236.315 2.086 20 0 BEADLO CC1(C)CC(C(=O)O[C@H]2CC[N@H+](CCF)C2)C1 ZINC000802821755 586317151 /nfs/dbraw/zinc/31/71/51/586317151.db2.gz RATWCIRLPNQDPS-NSHDSACASA-N 1 2 243.322 2.010 20 0 BEADLO CC1(C)CC(C(=O)O[C@H]2CC[N@@H+](CCF)C2)C1 ZINC000802821755 586317153 /nfs/dbraw/zinc/31/71/53/586317153.db2.gz RATWCIRLPNQDPS-NSHDSACASA-N 1 2 243.322 2.010 20 0 BEADLO C[C@@H]1C[C@H]1COC(=O)c1ccc2[nH+]ccn2c1 ZINC000859551823 589044246 /nfs/dbraw/zinc/04/42/46/589044246.db2.gz HIXKBFIAVJISHI-KOLCDFICSA-N 1 2 230.267 2.147 20 0 BEADLO CC1(C)CCN(C[NH+]2Cc3ccccc3C2)C1=O ZINC000839990595 586332939 /nfs/dbraw/zinc/33/29/39/586332939.db2.gz IKWPJNQSVNBNGF-UHFFFAOYSA-N 1 2 244.338 2.218 20 0 BEADLO C[N@H+](C/C(Cl)=C/Cl)CC1(C)COC1 ZINC000859571066 589045942 /nfs/dbraw/zinc/04/59/42/589045942.db2.gz NAKHRUICKXTNJT-BAQGIRSFSA-N 1 2 224.131 2.274 20 0 BEADLO C[N@@H+](C/C(Cl)=C/Cl)CC1(C)COC1 ZINC000859571066 589045943 /nfs/dbraw/zinc/04/59/43/589045943.db2.gz NAKHRUICKXTNJT-BAQGIRSFSA-N 1 2 224.131 2.274 20 0 BEADLO CC[NH2+]Cc1noc(C[C@@H]2CC[C@H](C)C2)n1 ZINC000843144987 586436843 /nfs/dbraw/zinc/43/68/43/586436843.db2.gz RBQSUFDDWDZORE-VHSXEESVSA-N 1 2 223.320 2.158 20 0 BEADLO CC[NH2+]Cc1noc([C@H](C)c2cccc(F)c2)n1 ZINC000843145096 586444382 /nfs/dbraw/zinc/44/43/82/586444382.db2.gz TYJKASGVKIRRKR-SECBINFHSA-N 1 2 249.289 2.470 20 0 BEADLO CC[NH2+]Cc1noc([C@@H](C)c2ccc(C)o2)n1 ZINC000843145247 586444888 /nfs/dbraw/zinc/44/48/88/586444888.db2.gz ZDYBIPPBDCMMFU-VIFPVBQESA-N 1 2 235.287 2.232 20 0 BEADLO CC[NH2+]Cc1noc(C[C@@H](C)CC(C)C)n1 ZINC000843145418 586445355 /nfs/dbraw/zinc/44/53/55/586445355.db2.gz KMIOMSKVGOQDQG-JTQLQIEISA-N 1 2 225.336 2.404 20 0 BEADLO CS[C@@H]1CC[N@H+](Cn2ncc(Cl)c2C)C1 ZINC000840114753 586449072 /nfs/dbraw/zinc/44/90/72/586449072.db2.gz SAIBHVYSNCYGAP-SECBINFHSA-N 1 2 245.779 2.240 20 0 BEADLO CS[C@@H]1CC[N@@H+](Cn2ncc(Cl)c2C)C1 ZINC000840114753 586449073 /nfs/dbraw/zinc/44/90/73/586449073.db2.gz SAIBHVYSNCYGAP-SECBINFHSA-N 1 2 245.779 2.240 20 0 BEADLO C[C@H]1CC[N@H+](CN2C(=O)CCC2(C)C)C[C@@H]1F ZINC000808177592 586466011 /nfs/dbraw/zinc/46/60/11/586466011.db2.gz VFZMKCLOXPWNOF-QWRGUYRKSA-N 1 2 242.338 2.025 20 0 BEADLO C[C@H]1CC[N@@H+](CN2C(=O)CCC2(C)C)C[C@@H]1F ZINC000808177592 586466012 /nfs/dbraw/zinc/46/60/12/586466012.db2.gz VFZMKCLOXPWNOF-QWRGUYRKSA-N 1 2 242.338 2.025 20 0 BEADLO COc1cc(C)c(NCc2cn(C)c[nH+]2)cc1F ZINC000808406851 586471480 /nfs/dbraw/zinc/47/14/80/586471480.db2.gz OTSVWKJVKDARDX-UHFFFAOYSA-N 1 2 249.289 2.488 20 0 BEADLO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1cn(C)cn1 ZINC000808444766 586472624 /nfs/dbraw/zinc/47/26/24/586472624.db2.gz PQHHETLTHAMJHH-QMTHXVAHSA-N 1 2 243.310 2.032 20 0 BEADLO Cn1c[nH+]cc1COC(=O)CC1(C)CCCC1 ZINC000808989910 586491407 /nfs/dbraw/zinc/49/14/07/586491407.db2.gz JCEZHKFBCJPNAR-UHFFFAOYSA-N 1 2 236.315 2.434 20 0 BEADLO C[C@H]1CC(C)(C)C[N@@H+]1Cn1ncn(C)c1=S ZINC000840183475 586513239 /nfs/dbraw/zinc/51/32/39/586513239.db2.gz MBJPHJQIRPPLDT-VIFPVBQESA-N 1 2 240.376 2.029 20 0 BEADLO C[C@H]1CC(C)(C)C[N@H+]1Cn1ncn(C)c1=S ZINC000840183475 586513240 /nfs/dbraw/zinc/51/32/40/586513240.db2.gz MBJPHJQIRPPLDT-VIFPVBQESA-N 1 2 240.376 2.029 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccoc2)C[C@@H](C)[S@]1=O ZINC000809699427 586513748 /nfs/dbraw/zinc/51/37/48/586513748.db2.gz OCOHFLLARUMPIQ-NSODJVPESA-N 1 2 241.356 2.011 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccoc2)C[C@@H](C)[S@]1=O ZINC000809699427 586513749 /nfs/dbraw/zinc/51/37/49/586513749.db2.gz OCOHFLLARUMPIQ-NSODJVPESA-N 1 2 241.356 2.011 20 0 BEADLO Cc1nonc1C[NH2+]Cc1ccc(C)cc1C ZINC000809744657 586516504 /nfs/dbraw/zinc/51/65/04/586516504.db2.gz WSLCVLFDOGECDP-UHFFFAOYSA-N 1 2 231.299 2.285 20 0 BEADLO CCOc1ccc(C[NH2+]Cc2nonc2C)cc1 ZINC000809744205 586516616 /nfs/dbraw/zinc/51/66/16/586516616.db2.gz AKQLESOALOPKGJ-UHFFFAOYSA-N 1 2 247.298 2.067 20 0 BEADLO Cc1nonc1C[NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000809744256 586516823 /nfs/dbraw/zinc/51/68/23/586516823.db2.gz CSRVVAHQKADBLN-LDYMZIIASA-N 1 2 247.298 2.384 20 0 BEADLO CCCCOC(=O)C[N@@H+]1CCC(F)(F)[C@H](C)C1 ZINC000810045147 586532507 /nfs/dbraw/zinc/53/25/07/586532507.db2.gz FIONCQVLXCEGPJ-SNVBAGLBSA-N 1 2 249.301 2.307 20 0 BEADLO CCCCOC(=O)C[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000810045147 586532508 /nfs/dbraw/zinc/53/25/08/586532508.db2.gz FIONCQVLXCEGPJ-SNVBAGLBSA-N 1 2 249.301 2.307 20 0 BEADLO Cn1c[nH+]cc1CNc1ccnc(C(C)(C)C)n1 ZINC000811845682 586567914 /nfs/dbraw/zinc/56/79/14/586567914.db2.gz GSRDMMZPKSDFBE-UHFFFAOYSA-N 1 2 245.330 2.120 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnn(-c3ccccc3)n2)[C@H]1C ZINC000815162682 586671543 /nfs/dbraw/zinc/67/15/43/586671543.db2.gz GPHSNFVTLYTKBT-NEPJUHHUSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnn(-c3ccccc3)n2)[C@H]1C ZINC000815162682 586671544 /nfs/dbraw/zinc/67/15/44/586671544.db2.gz GPHSNFVTLYTKBT-NEPJUHHUSA-N 1 2 242.326 2.108 20 0 BEADLO Cn1ncc(C[N@H+](C)Cc2ccco2)c1Cl ZINC000816482198 586735450 /nfs/dbraw/zinc/73/54/50/586735450.db2.gz XWTXPXQLHSVCFI-UHFFFAOYSA-N 1 2 239.706 2.299 20 0 BEADLO Cn1ncc(C[N@@H+](C)Cc2ccco2)c1Cl ZINC000816482198 586735452 /nfs/dbraw/zinc/73/54/52/586735452.db2.gz XWTXPXQLHSVCFI-UHFFFAOYSA-N 1 2 239.706 2.299 20 0 BEADLO C[C@H]1CC[N@H+](Cc2cnn(C)c2Cl)C[C@@H]1F ZINC000816564567 586740580 /nfs/dbraw/zinc/74/05/80/586740580.db2.gz JTPIAVUMFRWEAH-WPRPVWTQSA-N 1 2 245.729 2.253 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2cnn(C)c2Cl)C[C@@H]1F ZINC000816564567 586740582 /nfs/dbraw/zinc/74/05/82/586740582.db2.gz JTPIAVUMFRWEAH-WPRPVWTQSA-N 1 2 245.729 2.253 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1cc(C)nc(Cl)c1 ZINC000816636681 586746460 /nfs/dbraw/zinc/74/64/60/586746460.db2.gz FBDIEBMBDCLKAJ-NSHDSACASA-N 1 2 240.734 2.264 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1cc(C)nc(Cl)c1 ZINC000816636681 586746463 /nfs/dbraw/zinc/74/64/63/586746463.db2.gz FBDIEBMBDCLKAJ-NSHDSACASA-N 1 2 240.734 2.264 20 0 BEADLO Cc1nc(C)c(C[N@H+](C)CCF)s1 ZINC000816639722 586747188 /nfs/dbraw/zinc/74/71/88/586747188.db2.gz CSSUJBWPWYCEST-UHFFFAOYSA-N 1 2 202.298 2.161 20 0 BEADLO Cc1nc(C)c(C[N@@H+](C)CCF)s1 ZINC000816639722 586747191 /nfs/dbraw/zinc/74/71/91/586747191.db2.gz CSSUJBWPWYCEST-UHFFFAOYSA-N 1 2 202.298 2.161 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cn3cccc(F)c3n2)[C@@H]1C ZINC000816647612 586750310 /nfs/dbraw/zinc/75/03/10/586750310.db2.gz VQLWGSPZCOENTD-NXEZZACHSA-N 1 2 233.290 2.314 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cn3cccc(F)c3n2)[C@@H]1C ZINC000816647612 586750312 /nfs/dbraw/zinc/75/03/12/586750312.db2.gz VQLWGSPZCOENTD-NXEZZACHSA-N 1 2 233.290 2.314 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)N1CCC[C@H]1C1CCCC1 ZINC000816895303 586769653 /nfs/dbraw/zinc/76/96/53/586769653.db2.gz HVODVHQEUMDTNP-LBPRGKRZSA-N 1 2 247.342 2.133 20 0 BEADLO Cc1cc(NC(=O)Cc2[nH]cc[nH+]2)ccc1F ZINC000816917734 586771047 /nfs/dbraw/zinc/77/10/47/586771047.db2.gz ZSGCKPARYIEAIS-UHFFFAOYSA-N 1 2 233.246 2.038 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)N1CCC2(C1)CCCCC2 ZINC000816937193 586771759 /nfs/dbraw/zinc/77/17/59/586771759.db2.gz YFSFENNTUSWVGH-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@@H+]1CCC(F)(F)C[C@H]1C ZINC000859836791 589064797 /nfs/dbraw/zinc/06/47/97/589064797.db2.gz ZLBFGDWMXSWCNZ-NXEZZACHSA-N 1 2 249.301 2.448 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@H+]1CCC(F)(F)C[C@H]1C ZINC000859836791 589064799 /nfs/dbraw/zinc/06/47/99/589064799.db2.gz ZLBFGDWMXSWCNZ-NXEZZACHSA-N 1 2 249.301 2.448 20 0 BEADLO CCC1(CC)CCN(C(=O)Cc2[nH]cc[nH+]2)CC1 ZINC000816972028 586775904 /nfs/dbraw/zinc/77/59/04/586775904.db2.gz YXGJRPRPMSREQG-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO CCC/C=C/C(=O)NCc1c[nH+]ccc1OC ZINC000817086267 586781283 /nfs/dbraw/zinc/78/12/83/586781283.db2.gz MXBFUOQRZKTWNC-AATRIKPKSA-N 1 2 234.299 2.063 20 0 BEADLO CCc1cc(NCc2c[nH+]cn2C(C)C)nn1C ZINC000818216291 586880071 /nfs/dbraw/zinc/88/00/71/586880071.db2.gz LYWZCFJJAFGRJT-UHFFFAOYSA-N 1 2 247.346 2.372 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C(=O)NC1=[NH+]CCS1 ZINC000819031583 586925652 /nfs/dbraw/zinc/92/56/52/586925652.db2.gz SSRSSIUEFLBDBR-BDAKNGLRSA-N 1 2 226.345 2.032 20 0 BEADLO CC[C@@H](O)CNc1ccc([NH+](C)C)cc1C ZINC000819409669 586962136 /nfs/dbraw/zinc/96/21/36/586962136.db2.gz SFWBPEGCLZZRQT-GFCCVEGCSA-N 1 2 222.332 2.244 20 0 BEADLO O=C(C(F)=C1CCC1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000819456079 586965253 /nfs/dbraw/zinc/96/52/53/586965253.db2.gz IUXMYLCNEGVVOO-JTQLQIEISA-N 1 2 249.289 2.481 20 0 BEADLO CCCC[C@@H](C)C(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819777131 586992295 /nfs/dbraw/zinc/99/22/95/586992295.db2.gz HRTIMDYYWPYXCW-BDAKNGLRSA-N 1 2 228.361 2.420 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)CCc2ccccc2)S1 ZINC000819760460 586990393 /nfs/dbraw/zinc/99/03/93/586990393.db2.gz OZLXJRKJKZQFIE-JTQLQIEISA-N 1 2 248.351 2.227 20 0 BEADLO CC[C@@H](C)CCC(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819777467 586992985 /nfs/dbraw/zinc/99/29/85/586992985.db2.gz JIBIOJOMHHUKKF-RKDXNWHRSA-N 1 2 228.361 2.420 20 0 BEADLO CC(C)C[C@H](C)C(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819778064 586993311 /nfs/dbraw/zinc/99/33/11/586993311.db2.gz XYWJIUALNNZCOO-IUCAKERBSA-N 1 2 228.361 2.276 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)[C@]2(C)CC=CCC2)S1 ZINC000819781071 586993794 /nfs/dbraw/zinc/99/37/94/586993794.db2.gz LDXIPNIRNWMULJ-BXKDBHETSA-N 1 2 238.356 2.340 20 0 BEADLO CCC[C@@H](CC)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000820003244 587012308 /nfs/dbraw/zinc/01/23/08/587012308.db2.gz KMJWOLXVNAYFFY-LLVKDONJSA-N 1 2 235.331 2.093 20 0 BEADLO CC(C)C[C@H](C(=O)N1CCC1(C)C)n1cc[nH+]c1 ZINC000820176765 587032417 /nfs/dbraw/zinc/03/24/17/587032417.db2.gz IHPNSNWCUPISHC-GFCCVEGCSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CC[C@@H]2C[C@@H]2CC1)c1[nH]cc[nH+]1 ZINC000820191406 587033690 /nfs/dbraw/zinc/03/36/90/587033690.db2.gz FEJWDCRCBCAWRP-WISYIIOYSA-N 1 2 247.342 2.413 20 0 BEADLO CC[C@H](C)CONC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000820279683 587040401 /nfs/dbraw/zinc/04/04/01/587040401.db2.gz QHLNQEWWPFVQSM-VIFPVBQESA-N 1 2 247.298 2.270 20 0 BEADLO CCCCCCNC(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000820528916 587052689 /nfs/dbraw/zinc/05/26/89/587052689.db2.gz VBTQLRNFHHRVCB-VXGBXAGGSA-N 1 2 249.358 2.220 20 0 BEADLO CC1(C)C(NC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1(C)C ZINC000820589810 587056980 /nfs/dbraw/zinc/05/69/80/587056980.db2.gz UMAABRCDLGKASD-RKDXNWHRSA-N 1 2 247.342 2.064 20 0 BEADLO CC1(C)C(NC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1(C)C ZINC000820589810 587056981 /nfs/dbraw/zinc/05/69/81/587056981.db2.gz UMAABRCDLGKASD-RKDXNWHRSA-N 1 2 247.342 2.064 20 0 BEADLO Cc1cnc(N2CC[C@@H](C)[C@H](n3cc[nH+]c3)C2)o1 ZINC000820676556 587065880 /nfs/dbraw/zinc/06/58/80/587065880.db2.gz QAYNSVXGIXXLFZ-ZYHUDNBSSA-N 1 2 246.314 2.267 20 0 BEADLO CC(C)(C)CC(C)(C)NC(=O)Cc1[nH]cc[nH+]1 ZINC000820700284 587067392 /nfs/dbraw/zinc/06/73/92/587067392.db2.gz XNQTZRAKBDTYSG-UHFFFAOYSA-N 1 2 237.347 2.283 20 0 BEADLO Cc1ccc(N[C@@H](C)c2cc(CO)on2)c[nH+]1 ZINC000820837801 587075755 /nfs/dbraw/zinc/07/57/55/587075755.db2.gz XBCSMLCIBHMSIP-VIFPVBQESA-N 1 2 233.271 2.043 20 0 BEADLO Cc1ccc(N[C@H](C)c2cc(CO)on2)c[nH+]1 ZINC000820837800 587075991 /nfs/dbraw/zinc/07/59/91/587075991.db2.gz XBCSMLCIBHMSIP-SECBINFHSA-N 1 2 233.271 2.043 20 0 BEADLO C[C@H]1CCCC[C@H]1C(=O)OCCn1cc[nH+]c1 ZINC000820858431 587078042 /nfs/dbraw/zinc/07/80/42/587078042.db2.gz YSWWXGJYNFQPDU-NWDGAFQWSA-N 1 2 236.315 2.253 20 0 BEADLO Cn1c[nH+]c(/C=C/C(=O)NCC2=CCCCC2)c1 ZINC000820963432 587084877 /nfs/dbraw/zinc/08/48/77/587084877.db2.gz XHNBIMATFUXJNQ-BQYQJAHWSA-N 1 2 245.326 2.050 20 0 BEADLO Cc1ccc([C@H](C)NC(=O)Cc2[nH]cc[nH+]2)cc1 ZINC000821023908 587089524 /nfs/dbraw/zinc/08/95/24/587089524.db2.gz WPNHOPYCZFTNSD-NSHDSACASA-N 1 2 243.310 2.138 20 0 BEADLO O=C1CC[C@@H](CSc2[nH+]cc3ccccn32)O1 ZINC000821069370 587093406 /nfs/dbraw/zinc/09/34/06/587093406.db2.gz KXUMFNPXHVDLHQ-JTQLQIEISA-N 1 2 248.307 2.132 20 0 BEADLO O=C1CC[C@H](CSc2[nH+]cc3ccccn32)O1 ZINC000821069371 587093507 /nfs/dbraw/zinc/09/35/07/587093507.db2.gz KXUMFNPXHVDLHQ-SNVBAGLBSA-N 1 2 248.307 2.132 20 0 BEADLO CCCCC1(C(=O)NCc2[nH+]ccn2CC)CC1 ZINC000821238652 587103261 /nfs/dbraw/zinc/10/32/61/587103261.db2.gz ITVUDZWPUJRJKV-UHFFFAOYSA-N 1 2 249.358 2.490 20 0 BEADLO OCc1ccc(C[N@@H+]2Cc3ccncc3C2)cc1 ZINC000821258218 587104190 /nfs/dbraw/zinc/10/41/90/587104190.db2.gz CWAGMPZGZCYYEX-UHFFFAOYSA-N 1 2 240.306 2.090 20 0 BEADLO OCc1ccc(C[N@H+]2Cc3ccncc3C2)cc1 ZINC000821258218 587104191 /nfs/dbraw/zinc/10/41/91/587104191.db2.gz CWAGMPZGZCYYEX-UHFFFAOYSA-N 1 2 240.306 2.090 20 0 BEADLO CCONC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000821439896 587120117 /nfs/dbraw/zinc/12/01/17/587120117.db2.gz QLJDYXQIKVWIBK-UHFFFAOYSA-N 1 2 223.276 2.080 20 0 BEADLO CC(C)(C)C(=O)OCCc1cn2ccccc2[nH+]1 ZINC000821594428 587131625 /nfs/dbraw/zinc/13/16/25/587131625.db2.gz NOUDURXZMZQGHN-UHFFFAOYSA-N 1 2 246.310 2.466 20 0 BEADLO O=C(OCCc1cn2ccccc2[nH+]1)C1CCC1 ZINC000821594162 587131817 /nfs/dbraw/zinc/13/18/17/587131817.db2.gz BARHQQZBBJZXBZ-UHFFFAOYSA-N 1 2 244.294 2.220 20 0 BEADLO C[C@H]1C[C@H](NC(=O)C2(C)CC=CC2)c2[nH+]ccn21 ZINC000821787317 587138030 /nfs/dbraw/zinc/13/80/30/587138030.db2.gz SIKIPQXBJCHVES-QWRGUYRKSA-N 1 2 245.326 2.361 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NC2=[NH+]CCS2)C[C@@H]1C ZINC000822234314 587159053 /nfs/dbraw/zinc/15/90/53/587159053.db2.gz OEEMYTHXEIRDQH-KXUCPTDWSA-N 1 2 240.372 2.278 20 0 BEADLO CS[C@@H]1CC[C@H]1[NH2+][C@@H](C)C(=O)OCC(C)C ZINC000822475956 587170734 /nfs/dbraw/zinc/17/07/34/587170734.db2.gz DZIWOKCCRPAGPJ-HBNTYKKESA-N 1 2 245.388 2.058 20 0 BEADLO CC[C@@H]([NH3+])c1nc(-c2ccc3[nH]cnc3c2)no1 ZINC000822817987 587187721 /nfs/dbraw/zinc/18/77/21/587187721.db2.gz FFALJWBKNUWKHY-MRVPVSSYSA-N 1 2 243.270 2.023 20 0 BEADLO CCC[C@@H](CC)C(=O)N[C@@H]1CCc2c[nH+]cn2C1 ZINC000822861263 587189751 /nfs/dbraw/zinc/18/97/51/587189751.db2.gz IUUIEFGJPLUKCP-VXGBXAGGSA-N 1 2 249.358 2.140 20 0 BEADLO CC/C(C)=C/C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000823088250 587202123 /nfs/dbraw/zinc/20/21/23/587202123.db2.gz KQHZYSWPXHQHLY-SRXBQZRASA-N 1 2 247.342 2.403 20 0 BEADLO C[N@H+](Cc1ccnc(Cl)c1F)[C@H]1CCOC1 ZINC000823436845 587221863 /nfs/dbraw/zinc/22/18/63/587221863.db2.gz DGUZVOVTRRQBSD-VIFPVBQESA-N 1 2 244.697 2.095 20 0 BEADLO C[N@@H+](Cc1ccnc(Cl)c1F)[C@H]1CCOC1 ZINC000823436845 587221865 /nfs/dbraw/zinc/22/18/65/587221865.db2.gz DGUZVOVTRRQBSD-VIFPVBQESA-N 1 2 244.697 2.095 20 0 BEADLO CN(C(=O)c1cc2c[nH+]ccc2[nH]1)C(C)(C)C ZINC000823658845 587235367 /nfs/dbraw/zinc/23/53/67/587235367.db2.gz FPIXXONEAWWJLU-UHFFFAOYSA-N 1 2 231.299 2.433 20 0 BEADLO CCC1(C(=O)Nc2c(C)cc[nH+]c2C)COC1 ZINC000823836095 587241512 /nfs/dbraw/zinc/24/15/12/587241512.db2.gz CCKQYGHPMBHPBY-UHFFFAOYSA-N 1 2 234.299 2.064 20 0 BEADLO CO[C@H](C)CC(=O)Nc1c(C)cc[nH+]c1C ZINC000823842532 587241934 /nfs/dbraw/zinc/24/19/34/587241934.db2.gz YLFUCKOJZBTQAH-SECBINFHSA-N 1 2 222.288 2.062 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)/C=C/[C@H]1CCCO1 ZINC000823837078 587242218 /nfs/dbraw/zinc/24/22/18/587242218.db2.gz XBGCOWJQWWTKKF-BTDICHCPSA-N 1 2 246.310 2.372 20 0 BEADLO CCCN(C(=O)/C=C/c1cn(C)c[nH+]1)C(C)C ZINC000824264940 587263957 /nfs/dbraw/zinc/26/39/57/587263957.db2.gz WBEJLWDNZPZHFO-VOTSOKGWSA-N 1 2 235.331 2.080 20 0 BEADLO Clc1ccc(C[NH+]2CC3(CC3)C2)cn1 ZINC000824533986 587273594 /nfs/dbraw/zinc/27/35/94/587273594.db2.gz WDOXJOIBDLPGPY-UHFFFAOYSA-N 1 2 208.692 2.331 20 0 BEADLO CCc1ccc(C[NH2+][C@H]2CCn3ccnc32)o1 ZINC000824527558 587273891 /nfs/dbraw/zinc/27/38/91/587273891.db2.gz WGKVFWRVBCIMKV-LBPRGKRZSA-N 1 2 231.299 2.273 20 0 BEADLO Cc1[nH]ncc1C[NH2+]C[C@]1(C)CC1(Cl)Cl ZINC000824765141 587286332 /nfs/dbraw/zinc/28/63/32/587286332.db2.gz IFASRXSRRMOFBJ-VIFPVBQESA-N 1 2 248.157 2.392 20 0 BEADLO Cn1nc(C(F)(F)F)cc1C[N@@H+]1CCC1(C)C ZINC000824825120 587289075 /nfs/dbraw/zinc/28/90/75/587289075.db2.gz MWPQKOKXXUCBSX-UHFFFAOYSA-N 1 2 247.264 2.423 20 0 BEADLO Cn1nc(C(F)(F)F)cc1C[N@H+]1CCC1(C)C ZINC000824825120 587289076 /nfs/dbraw/zinc/28/90/76/587289076.db2.gz MWPQKOKXXUCBSX-UHFFFAOYSA-N 1 2 247.264 2.423 20 0 BEADLO Cn1c[nH+]c(/C=C/C(=O)NCCCC2CCC2)c1 ZINC000825330115 587315507 /nfs/dbraw/zinc/31/55/07/587315507.db2.gz QFXFTHVFKLZECB-BQYQJAHWSA-N 1 2 247.342 2.130 20 0 BEADLO CC[C@@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)C1CC1 ZINC000825375507 587317514 /nfs/dbraw/zinc/31/75/14/587317514.db2.gz HFJDNJUWGICXMN-LLVKDONJSA-N 1 2 243.310 2.481 20 0 BEADLO CC[C@@](C)(NC(=O)/C=C\c1cn(C)c[nH+]1)C1CC1 ZINC000825398355 587318269 /nfs/dbraw/zinc/31/82/69/587318269.db2.gz QFAMBDKEOFBBSX-WBTMPAOCSA-N 1 2 247.342 2.128 20 0 BEADLO C[C@H](NC(=O)C[C@H]1CC=CCC1)c1[nH+]ccn1C ZINC000825544399 587324583 /nfs/dbraw/zinc/32/45/83/587324583.db2.gz JLGSQLZOHHWPAD-RYUDHWBXSA-N 1 2 247.342 2.344 20 0 BEADLO O=C(c1cc2c[nH+]ccc2[nH]1)N1CC[C@@H]2C[C@@H]2C1 ZINC000825603873 587326874 /nfs/dbraw/zinc/32/68/74/587326874.db2.gz GMDFQXVPGKGWKY-MWLCHTKSSA-N 1 2 241.294 2.045 20 0 BEADLO CC(C(=O)Nc1cc[nH+]cc1C)=C1CCC1 ZINC000825759845 587337891 /nfs/dbraw/zinc/33/78/91/587337891.db2.gz AXYPKSDQEZNMBQ-UHFFFAOYSA-N 1 2 216.284 2.251 20 0 BEADLO CCCC[C@@H]1CCC[C@@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000825773729 587338190 /nfs/dbraw/zinc/33/81/90/587338190.db2.gz OKJANQIQOGGRDW-NEPJUHHUSA-N 1 2 249.358 2.427 20 0 BEADLO Cc1cn2ccc(NC(=O)NOC(C)C)cc2[nH+]1 ZINC000825922229 587345124 /nfs/dbraw/zinc/34/51/24/587345124.db2.gz MCRRHNOACAGBLQ-UHFFFAOYSA-N 1 2 248.286 2.104 20 0 BEADLO CC(C)N(C(=O)Cc1[nH]cc[nH+]1)C1CCCC1 ZINC000826072326 587350360 /nfs/dbraw/zinc/35/03/60/587350360.db2.gz XHHPZRZNKKZCQX-UHFFFAOYSA-N 1 2 235.331 2.132 20 0 BEADLO COc1ncccc1C[N@@H+]1CCC[C@H](F)C1 ZINC000826142462 587351227 /nfs/dbraw/zinc/35/12/27/587351227.db2.gz CNQCAMHFTKADOK-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO COc1ncccc1C[N@H+]1CCC[C@H](F)C1 ZINC000826142462 587351228 /nfs/dbraw/zinc/35/12/28/587351228.db2.gz CNQCAMHFTKADOK-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO COC/C=C\c1nc(Cc2c[nH+]ccc2C)no1 ZINC000867046337 587375488 /nfs/dbraw/zinc/37/54/88/587375488.db2.gz YDZBENSUBPGXFZ-ARJAWSKDSA-N 1 2 245.282 2.023 20 0 BEADLO CCCCC1(C(=O)NCc2[nH]cc(C)[nH+]2)CC1 ZINC000827582242 587389903 /nfs/dbraw/zinc/38/99/03/587389903.db2.gz CTYRIJHDNUFRGK-UHFFFAOYSA-N 1 2 235.331 2.305 20 0 BEADLO Cc1c[nH]c(CNC(=O)[C@@H]2C[C@@H]3C[C@@H]3C[C@H]2C)[nH+]1 ZINC000827582775 587390162 /nfs/dbraw/zinc/39/01/62/587390162.db2.gz YHRPEYPGWOYVCK-NUGNTBJXSA-N 1 2 247.342 2.017 20 0 BEADLO Cc1c[nH]c(CNC(=O)[C@@H]2C[C@@H]3C[C@@H]3C[C@@H]2C)[nH+]1 ZINC000827582776 587390280 /nfs/dbraw/zinc/39/02/80/587390280.db2.gz YHRPEYPGWOYVCK-PDEGPIFNSA-N 1 2 247.342 2.017 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3nccnc3C2)c(C)o1 ZINC000827692615 587397133 /nfs/dbraw/zinc/39/71/33/587397133.db2.gz LEGOCTXKYOLTRS-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1cc(C[N@H+]2CCc3nccnc3C2)c(C)o1 ZINC000827692615 587397136 /nfs/dbraw/zinc/39/71/36/587397136.db2.gz LEGOCTXKYOLTRS-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C(C)(C)SC ZINC000827715698 587398646 /nfs/dbraw/zinc/39/86/46/587398646.db2.gz NRKLCOJKPAJAGD-UHFFFAOYSA-N 1 2 238.356 2.146 20 0 BEADLO Cc1cc(C[NH2+][C@H](c2ccccc2)[C@@H](C)O)no1 ZINC000827855601 587405905 /nfs/dbraw/zinc/40/59/05/587405905.db2.gz FULOQCQMRJMVLI-RISCZKNCSA-N 1 2 246.310 2.195 20 0 BEADLO CC[C@@H](C)[C@H]([NH2+]CC1=CCCC1)C(=O)OC ZINC000828236142 587427034 /nfs/dbraw/zinc/42/70/34/587427034.db2.gz ZDDZWKSSGAIQTB-PWSUYJOCSA-N 1 2 225.332 2.274 20 0 BEADLO CC/C(C)=C\C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000828316067 587434306 /nfs/dbraw/zinc/43/43/06/587434306.db2.gz DRJCSMKANNAQQE-DWOQACPDSA-N 1 2 233.315 2.430 20 0 BEADLO CCCc1nsc(N[C@H]2CCn3cc[nH+]c32)n1 ZINC000828358254 587438028 /nfs/dbraw/zinc/43/80/28/587438028.db2.gz QFRVIGWFNFPEQY-QMMMGPOBSA-N 1 2 249.343 2.244 20 0 BEADLO CC(C)c1cc(N[C@@H]2CCn3cc[nH+]c32)ncn1 ZINC000828358539 587438252 /nfs/dbraw/zinc/43/82/52/587438252.db2.gz RPYNZCJLDHASRU-SNVBAGLBSA-N 1 2 243.314 2.353 20 0 BEADLO c1cn2c([nH+]1)[C@H](Nc1ccnc(C3CC3)n1)CC2 ZINC000828359260 587438469 /nfs/dbraw/zinc/43/84/69/587438469.db2.gz ZBVBQKXLTWVGIJ-SNVBAGLBSA-N 1 2 241.298 2.107 20 0 BEADLO CC(C)c1nsc(N[C@@H]2CCn3cc[nH+]c32)n1 ZINC000828359245 587438611 /nfs/dbraw/zinc/43/86/11/587438611.db2.gz ZAHNLNHZEXAVOH-MRVPVSSYSA-N 1 2 249.343 2.415 20 0 BEADLO CC(C)(C)c1nc(NC(CF)CF)cc[nH+]1 ZINC000828405980 587440470 /nfs/dbraw/zinc/44/04/70/587440470.db2.gz SQRVKPCLVYTLIN-UHFFFAOYSA-N 1 2 229.274 2.494 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)N[C@@H]1CC[C@@H]2CCC[C@H]2C1 ZINC000828794664 587462567 /nfs/dbraw/zinc/46/25/67/587462567.db2.gz ISHJJPCFHOSCMY-SDDRHHMPSA-N 1 2 247.342 2.037 20 0 BEADLO FCCCC[N@@H+]1CCc2cc(Cl)nnc2C1 ZINC000829175626 587486421 /nfs/dbraw/zinc/48/64/21/587486421.db2.gz KBUOPMWMXYYRBY-UHFFFAOYSA-N 1 2 243.713 2.238 20 0 BEADLO FCCCC[N@H+]1CCc2cc(Cl)nnc2C1 ZINC000829175626 587486422 /nfs/dbraw/zinc/48/64/22/587486422.db2.gz KBUOPMWMXYYRBY-UHFFFAOYSA-N 1 2 243.713 2.238 20 0 BEADLO Cc1nonc1C[NH2+]C1(c2ccccc2C)CC1 ZINC000829500504 587500899 /nfs/dbraw/zinc/50/08/99/587500899.db2.gz MJEYABYOYXVZNN-UHFFFAOYSA-N 1 2 243.310 2.465 20 0 BEADLO C[C@@H]1CC(C)(C)CC[C@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000829663327 587508438 /nfs/dbraw/zinc/50/84/38/587508438.db2.gz FEMNWRARRDFAKH-GHMZBOCLSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@]1([NH2+]C[C@H]2CCCCC2(F)F)CCOC1=O ZINC000829962840 587528842 /nfs/dbraw/zinc/52/88/42/587528842.db2.gz UULAUIQTRRHCOX-KOLCDFICSA-N 1 2 247.285 2.107 20 0 BEADLO O[C@H](C[N@@H+]1CC[C@H](F)C1)c1c(F)cccc1F ZINC000830467228 587552223 /nfs/dbraw/zinc/55/22/23/587552223.db2.gz JCONXCMWDZHTJU-GZMMTYOYSA-N 1 2 245.244 2.042 20 0 BEADLO O[C@H](C[N@H+]1CC[C@H](F)C1)c1c(F)cccc1F ZINC000830467228 587552224 /nfs/dbraw/zinc/55/22/24/587552224.db2.gz JCONXCMWDZHTJU-GZMMTYOYSA-N 1 2 245.244 2.042 20 0 BEADLO Cc1cccn2cc(COC(=O)C3(F)CC3)[nH+]c12 ZINC000830761284 587568523 /nfs/dbraw/zinc/56/85/23/587568523.db2.gz NVKGTUOPOBXEFQ-UHFFFAOYSA-N 1 2 248.257 2.188 20 0 BEADLO C[C@H](CC(=O)NCCC1CC=CC1)n1cc[nH+]c1 ZINC000831423468 587605923 /nfs/dbraw/zinc/60/59/23/587605923.db2.gz RAVCKUCOBLOBMQ-GFCCVEGCSA-N 1 2 247.342 2.307 20 0 BEADLO CCc1ccc(NC(=O)Cc2[nH]cc[nH+]2)cc1C ZINC000831575756 587620324 /nfs/dbraw/zinc/62/03/24/587620324.db2.gz WLUPASUARGOYDZ-UHFFFAOYSA-N 1 2 243.310 2.462 20 0 BEADLO CCC1(CNC(=O)Cc2[nH]cc[nH+]2)CCCCC1 ZINC000832213715 587650546 /nfs/dbraw/zinc/65/05/46/587650546.db2.gz VHSMVHKDYVMJRZ-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO CC1(C)CN(C(=O)Cc2[nH]cc[nH+]2)CC(C)(C)C1 ZINC000832283116 587653377 /nfs/dbraw/zinc/65/33/77/587653377.db2.gz LVJUYLSEARWRHJ-UHFFFAOYSA-N 1 2 249.358 2.237 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)N1CCCC2(CCCC2)C1 ZINC000832711914 587678788 /nfs/dbraw/zinc/67/87/88/587678788.db2.gz BLDNNRVGYNJKEJ-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO C[C@@H]1CCC[C@H]1CC(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833279003 587703840 /nfs/dbraw/zinc/70/38/40/587703840.db2.gz WNTZWDNBEZFEFU-WOPDTQHZSA-N 1 2 247.342 2.270 20 0 BEADLO O=C(C[C@@H]1C=CCCC1)N[C@@H]1CCn2cc[nH+]c21 ZINC000833279436 587703875 /nfs/dbraw/zinc/70/38/75/587703875.db2.gz ZYWLENBUJVOHBM-VXGBXAGGSA-N 1 2 245.326 2.191 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833278752 587704165 /nfs/dbraw/zinc/70/41/65/587704165.db2.gz VBTLOLSTXSUQDB-AXFHLTTASA-N 1 2 235.331 2.126 20 0 BEADLO CC1(C)CC[C@@H](C(=O)N[C@@H]2CCn3cc[nH+]c32)C1 ZINC000833277940 587704206 /nfs/dbraw/zinc/70/42/06/587704206.db2.gz KJUVHRXTQXLOAI-GHMZBOCLSA-N 1 2 247.342 2.270 20 0 BEADLO C[C@H](C(=O)N[C@@H]1CCn2cc[nH+]c21)C1CCCC1 ZINC000833284124 587704583 /nfs/dbraw/zinc/70/45/83/587704583.db2.gz GXIHNKDUTSFELI-CMPLNLGQSA-N 1 2 247.342 2.270 20 0 BEADLO CCC/C(C)=C/C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833285320 587704592 /nfs/dbraw/zinc/70/45/92/587704592.db2.gz QHJDBHJZOADGLR-USKTWTLRSA-N 1 2 233.315 2.191 20 0 BEADLO C[C@@H]1CCC[C@@H](C(=O)N[C@@H]2CCn3cc[nH+]c32)C1 ZINC000833292641 587704837 /nfs/dbraw/zinc/70/48/37/587704837.db2.gz JNGASRSSHGJICE-IJLUTSLNSA-N 1 2 247.342 2.270 20 0 BEADLO CCCCCC(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833300266 587705219 /nfs/dbraw/zinc/70/52/19/587705219.db2.gz PAUFDTBJRQUWIW-SNVBAGLBSA-N 1 2 221.304 2.024 20 0 BEADLO O=C1C[C@H](Oc2ccc([NH2+]CC3CCC3)cc2)N1 ZINC000834664342 587763322 /nfs/dbraw/zinc/76/33/22/587763322.db2.gz PLJYULGZQTZAFO-AWEZNQCLSA-N 1 2 246.310 2.123 20 0 BEADLO CC1(C)CC=C(C(=O)NC2=[NH+]CCS2)CC1 ZINC000836250747 587829709 /nfs/dbraw/zinc/82/97/09/587829709.db2.gz YUBOGMOHDMLZNN-UHFFFAOYSA-N 1 2 238.356 2.342 20 0 BEADLO CCC/C=C\C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000836961652 587843937 /nfs/dbraw/zinc/84/39/37/587843937.db2.gz ZTSPEJKRUXPXEJ-TUISVCKWSA-N 1 2 233.315 2.361 20 0 BEADLO CCC/C=C/C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000836961654 587844299 /nfs/dbraw/zinc/84/42/99/587844299.db2.gz ZTSPEJKRUXPXEJ-XIJCSBCJSA-N 1 2 233.315 2.361 20 0 BEADLO C/C=C(/C)C(=O)Nc1nc(C[NH+](C)C)cs1 ZINC000837264350 587862305 /nfs/dbraw/zinc/86/23/05/587862305.db2.gz XDFJLNXEHDVQLF-YVMONPNESA-N 1 2 239.344 2.109 20 0 BEADLO CCO/C=C\C(=O)OCc1ccc(C)[nH+]c1C ZINC000840592030 587913548 /nfs/dbraw/zinc/91/35/48/587913548.db2.gz VQIDVGOTKFKYBV-FPLPWBNLSA-N 1 2 235.283 2.292 20 0 BEADLO COc1ccc([NH2+]CC2(C)CC2)cc1N ZINC000841040719 587938390 /nfs/dbraw/zinc/93/83/90/587938390.db2.gz RIQISORYBKIZRP-UHFFFAOYSA-N 1 2 206.289 2.489 20 0 BEADLO C=COc1ccc([NH2+]C[C@@H](C)CO)cc1 ZINC000841702096 587972675 /nfs/dbraw/zinc/97/26/75/587972675.db2.gz XEKRVRKVNMBFIT-SNVBAGLBSA-N 1 2 207.273 2.249 20 0 BEADLO CC[C@H](CO[NH+]=C(N)Cc1ccccc1)OC ZINC000842022635 587989379 /nfs/dbraw/zinc/98/93/79/587989379.db2.gz ZXESZKDNGZETAO-GFCCVEGCSA-N 1 2 236.315 2.153 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OCc1sccc1Cl ZINC000842037294 587991888 /nfs/dbraw/zinc/99/18/88/587991888.db2.gz WMWDPACMHNOTPW-LURJTMIESA-N 1 2 248.735 2.435 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OCc1ccc(C)cc1C ZINC000842037023 587992158 /nfs/dbraw/zinc/99/21/58/587992158.db2.gz TWJBMWGDQIXJEN-LLVKDONJSA-N 1 2 236.315 2.337 20 0 BEADLO CC[NH2+]Cc1noc(CCc2ccccc2F)n1 ZINC000843145569 588087166 /nfs/dbraw/zinc/08/71/66/588087166.db2.gz KSSYIFXJMIRSIY-UHFFFAOYSA-N 1 2 249.289 2.103 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)[C@@H]1C[C@H]1CC(C)(C)C ZINC000843599191 588128213 /nfs/dbraw/zinc/12/82/13/588128213.db2.gz WAZUDXJPXXQKCA-CMPLNLGQSA-N 1 2 249.358 2.109 20 0 BEADLO O=C(/C=C\C1CCCC1)N[C@@H]1CCn2cc[nH+]c21 ZINC000843600369 588128481 /nfs/dbraw/zinc/12/84/81/588128481.db2.gz BZBMUIITZGJIHF-FOQNGQEVSA-N 1 2 245.326 2.191 20 0 BEADLO O=C(N[C@H]1CCn2cc[nH+]c21)C1CC2(CCC2)C1 ZINC000843600564 588128615 /nfs/dbraw/zinc/12/86/15/588128615.db2.gz FKEDPPIIBMAXCM-NSHDSACASA-N 1 2 245.326 2.024 20 0 BEADLO CCON(C(=O)c1cccc2[nH+]ccn21)C(C)C ZINC000844075572 588160634 /nfs/dbraw/zinc/16/06/34/588160634.db2.gz QIOFFENSMSCOSI-UHFFFAOYSA-N 1 2 247.298 2.136 20 0 BEADLO C[C@@H]1Cc2cc(-c3[nH]cc[nH+]3)ccc2O1 ZINC000844228054 588173693 /nfs/dbraw/zinc/17/36/93/588173693.db2.gz XETNLZDELCQLBO-MRVPVSSYSA-N 1 2 200.241 2.400 20 0 BEADLO C[C@H](CCO)[N@H+](C)C/C(Cl)=C/Cl ZINC000844453042 588195954 /nfs/dbraw/zinc/19/59/54/588195954.db2.gz YTNBNUPZEVOSMY-BESBCXERSA-N 1 2 212.120 2.008 20 0 BEADLO C[C@H](CCO)[N@@H+](C)C/C(Cl)=C/Cl ZINC000844453042 588195956 /nfs/dbraw/zinc/19/59/56/588195956.db2.gz YTNBNUPZEVOSMY-BESBCXERSA-N 1 2 212.120 2.008 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2C[C@H]3[C@@H](C2)C3(F)F)s1 ZINC000844457058 588196352 /nfs/dbraw/zinc/19/63/52/588196352.db2.gz ISRMDSOGVLDCBW-APQOSEDMSA-N 1 2 245.298 2.104 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)s1 ZINC000844457058 588196353 /nfs/dbraw/zinc/19/63/53/588196353.db2.gz ISRMDSOGVLDCBW-APQOSEDMSA-N 1 2 245.298 2.104 20 0 BEADLO C[C@H](CC(=O)O[C@@H](C)C1CC1)n1cc[nH+]c1 ZINC000844457640 588196603 /nfs/dbraw/zinc/19/66/03/588196603.db2.gz DJHOMUTUMMVHHG-ZJUUUORDSA-N 1 2 222.288 2.176 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+]2C[C@H]3[C@@H](C2)C3(F)F)o1 ZINC000844457828 588196656 /nfs/dbraw/zinc/19/66/56/588196656.db2.gz LOCCEEYHBPUDIY-HLTSFMKQSA-N 1 2 228.242 2.241 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)o1 ZINC000844457828 588196657 /nfs/dbraw/zinc/19/66/57/588196657.db2.gz LOCCEEYHBPUDIY-HLTSFMKQSA-N 1 2 228.242 2.241 20 0 BEADLO FC1(F)[C@H]2C[N@H+](Cc3ncc(C4CC4)o3)C[C@H]21 ZINC000844457497 588196701 /nfs/dbraw/zinc/19/67/01/588196701.db2.gz KUYMQYZUWLYNGD-DTORHVGOSA-N 1 2 240.253 2.249 20 0 BEADLO FC1(F)[C@H]2C[N@@H+](Cc3ncc(C4CC4)o3)C[C@H]21 ZINC000844457497 588196702 /nfs/dbraw/zinc/19/67/02/588196702.db2.gz KUYMQYZUWLYNGD-DTORHVGOSA-N 1 2 240.253 2.249 20 0 BEADLO CCc1cc[nH+]cc1NCc1cncnc1 ZINC000844705455 588214117 /nfs/dbraw/zinc/21/41/17/588214117.db2.gz JUPAHLKIZZJHSK-UHFFFAOYSA-N 1 2 214.272 2.046 20 0 BEADLO CC[NH2+]Cc1noc([C@H]2C[C@H]2C2CCCC2)n1 ZINC000844906066 588219011 /nfs/dbraw/zinc/21/90/11/588219011.db2.gz JJUNAGRWSZNIAG-QWRGUYRKSA-N 1 2 235.331 2.473 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2C[C@H]2C2CCC2)n1 ZINC000844907224 588219066 /nfs/dbraw/zinc/21/90/66/588219066.db2.gz XQFODHZYCZCDNB-VHSXEESVSA-N 1 2 221.304 2.083 20 0 BEADLO CC(C)COC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000845278269 588225293 /nfs/dbraw/zinc/22/52/93/588225293.db2.gz SMSUNJJAFYBEQY-SNVBAGLBSA-N 1 2 210.277 2.033 20 0 BEADLO CSCCCOC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000845282340 588225493 /nfs/dbraw/zinc/22/54/93/588225493.db2.gz OAUDKBOXKLZPOO-JTQLQIEISA-N 1 2 242.344 2.131 20 0 BEADLO O=C(OCCn1cc[nH+]c1)[C@@H]1C[C@@H]1C1CCCC1 ZINC000845337781 588227203 /nfs/dbraw/zinc/22/72/03/588227203.db2.gz AFBLNWSOUNSFKR-CHWSQXEVSA-N 1 2 248.326 2.253 20 0 BEADLO C[C@H](CC(=O)OCCc1ccco1)n1cc[nH+]c1 ZINC000845606703 588235758 /nfs/dbraw/zinc/23/57/58/588235758.db2.gz UFUMFKIHVPQIMS-LLVKDONJSA-N 1 2 248.282 2.213 20 0 BEADLO CC(C)C1(O)C[NH+](Cc2cc3cnccc3o2)C1 ZINC000845981013 588252593 /nfs/dbraw/zinc/25/25/93/588252593.db2.gz JMBUMUKXTCBZLX-UHFFFAOYSA-N 1 2 246.310 2.031 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccc(C)nn2)[C@@H](CC)CO1 ZINC000846027735 588254026 /nfs/dbraw/zinc/25/40/26/588254026.db2.gz ORGLYDLQRLXXEK-UONOGXRCSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccc(C)nn2)[C@@H](CC)CO1 ZINC000846027735 588254027 /nfs/dbraw/zinc/25/40/27/588254027.db2.gz ORGLYDLQRLXXEK-UONOGXRCSA-N 1 2 249.358 2.174 20 0 BEADLO CCn1ncc(CNc2[nH+]cccc2SC)n1 ZINC000846061702 588255039 /nfs/dbraw/zinc/25/50/39/588255039.db2.gz QZIROGLGGQMZOW-UHFFFAOYSA-N 1 2 249.343 2.027 20 0 BEADLO CCONC(=O)C[NH2+][C@@H](C)C[C@H](C)CC(C)C ZINC000846090778 588256170 /nfs/dbraw/zinc/25/61/70/588256170.db2.gz DRNAZDJLOYSAFE-NEPJUHHUSA-N 1 2 244.379 2.105 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000846107435 588257101 /nfs/dbraw/zinc/25/71/01/588257101.db2.gz HDFYKRHZMOKPKO-NSHDSACASA-N 1 2 241.285 2.339 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000846107435 588257102 /nfs/dbraw/zinc/25/71/02/588257102.db2.gz HDFYKRHZMOKPKO-NSHDSACASA-N 1 2 241.285 2.339 20 0 BEADLO CC(C)(NC(=O)C(F)=C1CCC1)c1[nH]cc[nH+]1 ZINC000846245767 588262417 /nfs/dbraw/zinc/26/24/17/588262417.db2.gz CVHSZUKROCRTBZ-UHFFFAOYSA-N 1 2 237.278 2.169 20 0 BEADLO CC(C)C[N@H+](Cc1cnsn1)C1CC1 ZINC000846769457 588286811 /nfs/dbraw/zinc/28/68/11/588286811.db2.gz LFZIDJGRUOUHRH-UHFFFAOYSA-N 1 2 211.334 2.159 20 0 BEADLO CC[C@@H]1C[N@H+](CC2(Br)CC2)CCO1 ZINC000846769289 588287003 /nfs/dbraw/zinc/28/70/03/588287003.db2.gz IRLCNOJETCHBPW-SECBINFHSA-N 1 2 248.164 2.025 20 0 BEADLO CC[C@@H]1C[N@@H+](CC2(Br)CC2)CCO1 ZINC000846769289 588287004 /nfs/dbraw/zinc/28/70/04/588287004.db2.gz IRLCNOJETCHBPW-SECBINFHSA-N 1 2 248.164 2.025 20 0 BEADLO CCC(CC)[N@H+](CCOC)Cc1cnsn1 ZINC000846797252 588288831 /nfs/dbraw/zinc/28/88/31/588288831.db2.gz QQRIECRGJQELQJ-UHFFFAOYSA-N 1 2 243.376 2.175 20 0 BEADLO CCC(CC)[N@@H+](CCOC)Cc1cnsn1 ZINC000846797252 588288832 /nfs/dbraw/zinc/28/88/32/588288832.db2.gz QQRIECRGJQELQJ-UHFFFAOYSA-N 1 2 243.376 2.175 20 0 BEADLO CC(C)[C@@H]1C[N@H+](Cc2cnsn2)CCS1 ZINC000846808464 588290037 /nfs/dbraw/zinc/29/00/37/588290037.db2.gz IOFSMUIYAOJWIH-JTQLQIEISA-N 1 2 243.401 2.112 20 0 BEADLO CC(C)[C@@H]1C[N@@H+](Cc2cnsn2)CCS1 ZINC000846808464 588290038 /nfs/dbraw/zinc/29/00/38/588290038.db2.gz IOFSMUIYAOJWIH-JTQLQIEISA-N 1 2 243.401 2.112 20 0 BEADLO c1nsnc1C[N@@H+]1CCC2(CCCC2)C1 ZINC000846807130 588290070 /nfs/dbraw/zinc/29/00/70/588290070.db2.gz ACQGTBNSYVWCOL-UHFFFAOYSA-N 1 2 223.345 2.304 20 0 BEADLO c1nsnc1C[N@H+]1CCC2(CCCC2)C1 ZINC000846807130 588290071 /nfs/dbraw/zinc/29/00/71/588290071.db2.gz ACQGTBNSYVWCOL-UHFFFAOYSA-N 1 2 223.345 2.304 20 0 BEADLO CC[C@]1(C)CC[N@H+](Cc2cnsn2)C1 ZINC000846814886 588290944 /nfs/dbraw/zinc/29/09/44/588290944.db2.gz HAWNVLGZLNWBJB-SNVBAGLBSA-N 1 2 211.334 2.160 20 0 BEADLO CC[C@]1(C)CC[N@@H+](Cc2cnsn2)C1 ZINC000846814886 588290945 /nfs/dbraw/zinc/29/09/45/588290945.db2.gz HAWNVLGZLNWBJB-SNVBAGLBSA-N 1 2 211.334 2.160 20 0 BEADLO Fc1ccc(C2([NH2+]Cc3cnsn3)CC2)cc1 ZINC000846825244 588291187 /nfs/dbraw/zinc/29/11/87/588291187.db2.gz TYPVTKVDICCPMU-UHFFFAOYSA-N 1 2 249.314 2.456 20 0 BEADLO CC[N@H+](CCC1CC1)Cc1cnsn1 ZINC000846855435 588293441 /nfs/dbraw/zinc/29/34/41/588293441.db2.gz FIKLAELSPXVLGR-UHFFFAOYSA-N 1 2 211.334 2.160 20 0 BEADLO CC[N@@H+](CCC1CC1)Cc1cnsn1 ZINC000846855435 588293442 /nfs/dbraw/zinc/29/34/42/588293442.db2.gz FIKLAELSPXVLGR-UHFFFAOYSA-N 1 2 211.334 2.160 20 0 BEADLO CC(C)(C)[C@@H]1CCCN(C(=O)Cc2[nH]cc[nH+]2)C1 ZINC000846937985 588297691 /nfs/dbraw/zinc/29/76/91/588297691.db2.gz MRPWIGXFODLTPL-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO CON1CC[NH+]([C@H](C)c2ccccc2F)CC1 ZINC000846976924 588299856 /nfs/dbraw/zinc/29/98/56/588299856.db2.gz KRGNHDQSIFQVFC-LLVKDONJSA-N 1 2 238.306 2.066 20 0 BEADLO Fc1cc2c(cc1F)CN(Cc1c[nH+]c[nH]1)C2 ZINC000847043988 588304855 /nfs/dbraw/zinc/30/48/55/588304855.db2.gz CUBJEMJCRGGETB-UHFFFAOYSA-N 1 2 235.237 2.204 20 0 BEADLO Fc1cc2c(cc1F)CN(Cc1c[nH]c[nH+]1)C2 ZINC000847043988 588304856 /nfs/dbraw/zinc/30/48/56/588304856.db2.gz CUBJEMJCRGGETB-UHFFFAOYSA-N 1 2 235.237 2.204 20 0 BEADLO CCCCOC(=O)C(C)(C)[NH2+]CCCSC ZINC000847063825 588305491 /nfs/dbraw/zinc/30/54/91/588305491.db2.gz XAISIDRMJXFIFZ-UHFFFAOYSA-N 1 2 247.404 2.451 20 0 BEADLO Cc1ccc(N(C)C(=O)C[NH+]2CC(C)(C)C2)cc1 ZINC000847420599 588312760 /nfs/dbraw/zinc/31/27/60/588312760.db2.gz AMQINULHBCXXES-UHFFFAOYSA-N 1 2 246.354 2.300 20 0 BEADLO C[Si](C)(C)CCCC(=O)NCc1c[nH+]c[nH]1 ZINC000847515198 588315394 /nfs/dbraw/zinc/31/53/94/588315394.db2.gz ILTGYHGOLCVTOR-UHFFFAOYSA-N 1 2 239.395 2.144 20 0 BEADLO C[Si](C)(C)CCCC(=O)NCc1c[nH]c[nH+]1 ZINC000847515198 588315395 /nfs/dbraw/zinc/31/53/95/588315395.db2.gz ILTGYHGOLCVTOR-UHFFFAOYSA-N 1 2 239.395 2.144 20 0 BEADLO CCCCOC(=O)CC[N@H+](CC(F)F)C1CC1 ZINC000106936298 588316588 /nfs/dbraw/zinc/31/65/88/588316588.db2.gz WPYCMRIMTPAVTP-UHFFFAOYSA-N 1 2 249.301 2.449 20 0 BEADLO CCCCOC(=O)CC[N@@H+](CC(F)F)C1CC1 ZINC000106936298 588316590 /nfs/dbraw/zinc/31/65/90/588316590.db2.gz WPYCMRIMTPAVTP-UHFFFAOYSA-N 1 2 249.301 2.449 20 0 BEADLO Cc1ccc([C@@H](C)C(=O)N[C@H](C)c2[nH]cc[nH+]2)o1 ZINC000848387530 588375656 /nfs/dbraw/zinc/37/56/56/588375656.db2.gz VIMWJKHKXIBWHB-NXEZZACHSA-N 1 2 247.298 2.292 20 0 BEADLO Cc1ccc([C@H](C)C(=O)N[C@H](C)c2[nH]cc[nH+]2)o1 ZINC000848387531 588376063 /nfs/dbraw/zinc/37/60/63/588376063.db2.gz VIMWJKHKXIBWHB-VHSXEESVSA-N 1 2 247.298 2.292 20 0 BEADLO CCCn1cc(N[C@@H]2CCCn3cc[nH+]c32)cn1 ZINC000848540485 588394360 /nfs/dbraw/zinc/39/43/60/588394360.db2.gz OKJBAQCEPLVBMK-GFCCVEGCSA-N 1 2 245.330 2.437 20 0 BEADLO COc1c(C)[nH+]cnc1N(C)CC1CCC1 ZINC000848663596 588404148 /nfs/dbraw/zinc/40/41/48/588404148.db2.gz KVSZFVRLKGMXSH-UHFFFAOYSA-N 1 2 221.304 2.030 20 0 BEADLO CC(C)c1nc(N2CC3(CC3(F)F)C2)cc[nH+]1 ZINC000848742288 588410151 /nfs/dbraw/zinc/41/01/51/588410151.db2.gz HTEZODFTUJKONI-UHFFFAOYSA-N 1 2 239.269 2.445 20 0 BEADLO C=COc1ccc([NH2+]CC[C@H](C)O)cc1 ZINC000849317376 588472167 /nfs/dbraw/zinc/47/21/67/588472167.db2.gz OPYSAFDMYDRJDZ-JTQLQIEISA-N 1 2 207.273 2.392 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[NH2+][C@H]1C=CCC1 ZINC000849322274 588472441 /nfs/dbraw/zinc/47/24/41/588472441.db2.gz GJYJFZMKQQAEKZ-RYUDHWBXSA-N 1 2 225.332 2.272 20 0 BEADLO Cc1c[nH]c(CNc2cccc3c2OCCO3)[nH+]1 ZINC000850060954 588516337 /nfs/dbraw/zinc/51/63/37/588516337.db2.gz XNRQYAWLDSZHNW-UHFFFAOYSA-N 1 2 245.282 2.101 20 0 BEADLO O=C(OCCn1cc[nH+]c1)[C@H]1CCCC2(CC2)C1 ZINC000850204978 588528815 /nfs/dbraw/zinc/52/88/15/588528815.db2.gz DGNGMJJXZYVUGB-LBPRGKRZSA-N 1 2 248.326 2.397 20 0 BEADLO CCc1nc(CNCc2[nH+]ccn2C(C)C)co1 ZINC000850316177 588536369 /nfs/dbraw/zinc/53/63/69/588536369.db2.gz CPCAPBIUHLUZLQ-UHFFFAOYSA-N 1 2 248.330 2.304 20 0 BEADLO Cn1cnc(CNc2c[nH+]cc3c2CCCC3)c1 ZINC000850341646 588537166 /nfs/dbraw/zinc/53/71/66/588537166.db2.gz APKUMNDMEVOQRM-UHFFFAOYSA-N 1 2 242.326 2.306 20 0 BEADLO Cc1cc(C[NH2+][C@@H]2C[C@H](C)n3ncnc32)c(C)o1 ZINC000850352420 588538145 /nfs/dbraw/zinc/53/81/45/588538145.db2.gz VMPRYBSKDVDDEN-QPUJVOFHSA-N 1 2 246.314 2.284 20 0 BEADLO O[C@@H]1C[C@@H]([NH2+]Cc2cscn2)c2ccccc21 ZINC000850371774 588541252 /nfs/dbraw/zinc/54/12/52/588541252.db2.gz LVNJYHKJUUHBNX-CHWSQXEVSA-N 1 2 246.335 2.411 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2ncccn2)c(C)n1 ZINC000850553460 588560290 /nfs/dbraw/zinc/56/02/90/588560290.db2.gz ZKZGNIMQYLHLMP-LLVKDONJSA-N 1 2 242.326 2.339 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]CC1SCCS1 ZINC000850562267 588560863 /nfs/dbraw/zinc/56/08/63/588560863.db2.gz YYPZRHYNZJLLOT-SSDOTTSWSA-N 1 2 243.401 2.175 20 0 BEADLO CC1(C)CC[C@H]1C(=O)O[C@H]1CC[N@H+](CCF)C1 ZINC000850997354 588582650 /nfs/dbraw/zinc/58/26/50/588582650.db2.gz DUTVXKRHWGAPKP-QWRGUYRKSA-N 1 2 243.322 2.010 20 0 BEADLO CC1(C)CC[C@H]1C(=O)O[C@H]1CC[N@@H+](CCF)C1 ZINC000850997354 588582651 /nfs/dbraw/zinc/58/26/51/588582651.db2.gz DUTVXKRHWGAPKP-QWRGUYRKSA-N 1 2 243.322 2.010 20 0 BEADLO C[C@@H](c1ccccc1)[N@H+](C)Cc1cnon1 ZINC000851717804 588616364 /nfs/dbraw/zinc/61/63/64/588616364.db2.gz XWUNJFHFBMWJBO-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@@H](c1ccccc1)[N@@H+](C)Cc1cnon1 ZINC000851717804 588616365 /nfs/dbraw/zinc/61/63/65/588616365.db2.gz XWUNJFHFBMWJBO-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[N@H+](Cc1cnon1)Cc1cccc(Cl)c1 ZINC000851721239 588617300 /nfs/dbraw/zinc/61/73/00/588617300.db2.gz FKNAPBOIZPZZCV-UHFFFAOYSA-N 1 2 237.690 2.355 20 0 BEADLO C[N@@H+](Cc1cnon1)Cc1cccc(Cl)c1 ZINC000851721239 588617301 /nfs/dbraw/zinc/61/73/01/588617301.db2.gz FKNAPBOIZPZZCV-UHFFFAOYSA-N 1 2 237.690 2.355 20 0 BEADLO c1cc2c(s1)CCC[N@@H+](Cc1cnon1)C2 ZINC000851763164 588624659 /nfs/dbraw/zinc/62/46/59/588624659.db2.gz KWCJGMCLDZGITG-UHFFFAOYSA-N 1 2 235.312 2.080 20 0 BEADLO c1cc2c(s1)CCC[N@H+](Cc1cnon1)C2 ZINC000851763164 588624660 /nfs/dbraw/zinc/62/46/60/588624660.db2.gz KWCJGMCLDZGITG-UHFFFAOYSA-N 1 2 235.312 2.080 20 0 BEADLO C[N@H+](CC=C(Cl)Cl)[C@H]1CCOC1 ZINC000851762014 588624719 /nfs/dbraw/zinc/62/47/19/588624719.db2.gz HGYRFSISJPBUMG-ZETCQYMHSA-N 1 2 210.104 2.026 20 0 BEADLO C[N@@H+](CC=C(Cl)Cl)[C@H]1CCOC1 ZINC000851762014 588624720 /nfs/dbraw/zinc/62/47/20/588624720.db2.gz HGYRFSISJPBUMG-ZETCQYMHSA-N 1 2 210.104 2.026 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cccc(F)n2)C[C@H](C)O1 ZINC000851767629 588625157 /nfs/dbraw/zinc/62/51/57/588625157.db2.gz BMGMFSISEVADGI-JQWIXIFHSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cccc(F)n2)C[C@H](C)O1 ZINC000851767629 588625158 /nfs/dbraw/zinc/62/51/58/588625158.db2.gz BMGMFSISEVADGI-JQWIXIFHSA-N 1 2 238.306 2.220 20 0 BEADLO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1cnon1 ZINC000851798744 588630364 /nfs/dbraw/zinc/63/03/64/588630364.db2.gz NCSKZSXJFZIYRQ-ZDUSSCGKSA-N 1 2 246.314 2.135 20 0 BEADLO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1cnon1 ZINC000851798744 588630365 /nfs/dbraw/zinc/63/03/65/588630365.db2.gz NCSKZSXJFZIYRQ-ZDUSSCGKSA-N 1 2 246.314 2.135 20 0 BEADLO FC(F)(F)CC[N@@H+](Cc1cnon1)CC1CC1 ZINC000851806564 588631127 /nfs/dbraw/zinc/63/11/27/588631127.db2.gz RKVLOGABJBOBGT-UHFFFAOYSA-N 1 2 249.236 2.234 20 0 BEADLO FC(F)(F)CC[N@H+](Cc1cnon1)CC1CC1 ZINC000851806564 588631128 /nfs/dbraw/zinc/63/11/28/588631128.db2.gz RKVLOGABJBOBGT-UHFFFAOYSA-N 1 2 249.236 2.234 20 0 BEADLO CCOc1cccc([C@H](C)[NH2+]Cc2cnon2)c1 ZINC000851897893 588641819 /nfs/dbraw/zinc/64/18/19/588641819.db2.gz RZYGRAVBZUUTRR-JTQLQIEISA-N 1 2 247.298 2.319 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cccc(F)n2)C[C@H]1F ZINC000851909313 588642434 /nfs/dbraw/zinc/64/24/34/588642434.db2.gz BAOILEGSRJRBBZ-MWLCHTKSSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cccc(F)n2)C[C@H]1F ZINC000851909313 588642435 /nfs/dbraw/zinc/64/24/35/588642435.db2.gz BAOILEGSRJRBBZ-MWLCHTKSSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@H]1CC[N@H+](Cc2cccc(F)n2)C[C@@H]1F ZINC000851909314 588642510 /nfs/dbraw/zinc/64/25/10/588642510.db2.gz BAOILEGSRJRBBZ-ONGXEEELSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2cccc(F)n2)C[C@@H]1F ZINC000851909314 588642511 /nfs/dbraw/zinc/64/25/11/588642511.db2.gz BAOILEGSRJRBBZ-ONGXEEELSA-N 1 2 226.270 2.401 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]CC=C(Cl)Cl)o1 ZINC000851931941 588645110 /nfs/dbraw/zinc/64/51/10/588645110.db2.gz GGAAQGPZERCPDX-RXMQYKEDSA-N 1 2 236.102 2.348 20 0 BEADLO FC(F)(F)CC1CC[NH+](Cc2cnon2)CC1 ZINC000852021788 588656409 /nfs/dbraw/zinc/65/64/09/588656409.db2.gz CZNNZMMGEWGXGD-UHFFFAOYSA-N 1 2 249.236 2.234 20 0 BEADLO C[N@H+](Cc1cnc[nH]1)Cc1ccc2c(c1)COC2 ZINC000852288869 588676352 /nfs/dbraw/zinc/67/63/52/588676352.db2.gz UMMBPUWVJVUIOR-UHFFFAOYSA-N 1 2 243.310 2.072 20 0 BEADLO C[N@@H+](Cc1cnc[nH]1)Cc1ccc2c(c1)COC2 ZINC000852288869 588676353 /nfs/dbraw/zinc/67/63/53/588676353.db2.gz UMMBPUWVJVUIOR-UHFFFAOYSA-N 1 2 243.310 2.072 20 0 BEADLO C[N@H+](Cc1c[nH]cn1)Cc1ccc2c(c1)COC2 ZINC000852288869 588676354 /nfs/dbraw/zinc/67/63/54/588676354.db2.gz UMMBPUWVJVUIOR-UHFFFAOYSA-N 1 2 243.310 2.072 20 0 BEADLO C[N@@H+](Cc1c[nH]cn1)Cc1ccc2c(c1)COC2 ZINC000852288869 588676355 /nfs/dbraw/zinc/67/63/55/588676355.db2.gz UMMBPUWVJVUIOR-UHFFFAOYSA-N 1 2 243.310 2.072 20 0 BEADLO CCCCCC[N@@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000852411767 588681558 /nfs/dbraw/zinc/68/15/58/588681558.db2.gz HSRNNIRUEUBVIC-SNVBAGLBSA-N 1 2 221.291 2.269 20 0 BEADLO CCCCCC[N@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000852411767 588681559 /nfs/dbraw/zinc/68/15/59/588681559.db2.gz HSRNNIRUEUBVIC-SNVBAGLBSA-N 1 2 221.291 2.269 20 0 BEADLO COCC[N@H+](CCF)[C@@H](C)c1cccnc1 ZINC000852484066 588685190 /nfs/dbraw/zinc/68/51/90/588685190.db2.gz VHZHYZSTLKIFHX-NSHDSACASA-N 1 2 226.295 2.061 20 0 BEADLO COCC[N@@H+](CCF)[C@@H](C)c1cccnc1 ZINC000852484066 588685191 /nfs/dbraw/zinc/68/51/91/588685191.db2.gz VHZHYZSTLKIFHX-NSHDSACASA-N 1 2 226.295 2.061 20 0 BEADLO CCCCCC[NH2+][C@@](C)(CCF)C(=O)OC ZINC000852577528 588691612 /nfs/dbraw/zinc/69/16/12/588691612.db2.gz VMMGOPXMBARZTL-LBPRGKRZSA-N 1 2 233.327 2.448 20 0 BEADLO C[C@]1(C(F)F)C[N@H+](C/C=C\Cl)CCO1 ZINC000852784554 588702249 /nfs/dbraw/zinc/70/22/49/588702249.db2.gz OFCHCDQXQPUSBL-PKRMOACSSA-N 1 2 225.666 2.095 20 0 BEADLO C[C@]1(C(F)F)C[N@@H+](C/C=C\Cl)CCO1 ZINC000852784554 588702250 /nfs/dbraw/zinc/70/22/50/588702250.db2.gz OFCHCDQXQPUSBL-PKRMOACSSA-N 1 2 225.666 2.095 20 0 BEADLO CC12CC(C1)C[N@@H+]2CC(F)(F)C(F)F ZINC000852786343 588702320 /nfs/dbraw/zinc/70/23/20/588702320.db2.gz VPRDKMZJZDRPDZ-UHFFFAOYSA-N 1 2 211.202 2.371 20 0 BEADLO CC12CC(C1)C[N@H+]2CC(F)(F)C(F)F ZINC000852786343 588702321 /nfs/dbraw/zinc/70/23/21/588702321.db2.gz VPRDKMZJZDRPDZ-UHFFFAOYSA-N 1 2 211.202 2.371 20 0 BEADLO O=C(/C=C/C1CCCC1)N1CCc2[nH]c[nH+]c2C1 ZINC000861763489 589176853 /nfs/dbraw/zinc/17/68/53/589176853.db2.gz ROEAOCAOKMANLL-AATRIKPKSA-N 1 2 245.326 2.041 20 0 BEADLO O=C(/C=C/C1CCCC1)N1CCc2[nH+]c[nH]c2C1 ZINC000861763489 589176855 /nfs/dbraw/zinc/17/68/55/589176855.db2.gz ROEAOCAOKMANLL-AATRIKPKSA-N 1 2 245.326 2.041 20 0 BEADLO O=C(N[C@H]1CCn2cc[nH+]c21)[C@H]1CCCC12CC2 ZINC000861854156 589180618 /nfs/dbraw/zinc/18/06/18/589180618.db2.gz KRDLUUJARYJPPK-MNOVXSKESA-N 1 2 245.326 2.024 20 0 BEADLO O=C(N[C@H]1CCn2cc[nH+]c21)[C@@H]1CCCC12CC2 ZINC000861854157 589180891 /nfs/dbraw/zinc/18/08/91/589180891.db2.gz KRDLUUJARYJPPK-QWRGUYRKSA-N 1 2 245.326 2.024 20 0 BEADLO C[N@H+](CCF)Cc1cnc2ccccc2n1 ZINC000862378476 589205912 /nfs/dbraw/zinc/20/59/12/589205912.db2.gz ULUBAYZNEHVRIN-UHFFFAOYSA-N 1 2 219.263 2.031 20 0 BEADLO C[N@@H+](CCF)Cc1cnc2ccccc2n1 ZINC000862378476 589205913 /nfs/dbraw/zinc/20/59/13/589205913.db2.gz ULUBAYZNEHVRIN-UHFFFAOYSA-N 1 2 219.263 2.031 20 0 BEADLO Cc1c[nH]c(CN2CCC[C@@](C)(F)C2)[nH+]1 ZINC000862381295 589206388 /nfs/dbraw/zinc/20/63/88/589206388.db2.gz BVXDIEKPGNPICU-LLVKDONJSA-N 1 2 211.284 2.042 20 0 BEADLO CC[C@@H]1CC(=O)N(C[NH+]2Cc3ccccc3C2)C1 ZINC000119301660 589263206 /nfs/dbraw/zinc/26/32/06/589263206.db2.gz HIQMQZCLMMZSKO-GFCCVEGCSA-N 1 2 244.338 2.218 20 0 BEADLO c1c[nH+]c(COC[C@@H]2C[C@H]3C=C[C@@H]2C3)[nH]1 ZINC000863315198 589278951 /nfs/dbraw/zinc/27/89/51/589278951.db2.gz OOWRSRTVPWELBL-AXFHLTTASA-N 1 2 204.273 2.139 20 0 BEADLO COC1(C(N)=[NH+]OCCCSC)CCCC1 ZINC000863478401 589292271 /nfs/dbraw/zinc/29/22/71/589292271.db2.gz NPBMGNZQRKKHFQ-UHFFFAOYSA-N 1 2 246.376 2.197 20 0 BEADLO CNc1ccc(-c2c(C)n[nH]c2C)c[nH+]1 ZINC000863697883 589311709 /nfs/dbraw/zinc/31/17/09/589311709.db2.gz ZOYUKHNUZNCJKO-UHFFFAOYSA-N 1 2 202.261 2.130 20 0 BEADLO Cc1[nH+]cc(-c2cnn([C@@H]3CCCCO3)c2)n1C ZINC000863976662 589331379 /nfs/dbraw/zinc/33/13/79/589331379.db2.gz JRJMMXNUIPSBRX-ZDUSSCGKSA-N 1 2 246.314 2.291 20 0 BEADLO Cn1c(Cl)ncc1-c1c[nH+]c2n1CCCC2 ZINC000863978085 589332080 /nfs/dbraw/zinc/33/20/80/589332080.db2.gz BHRYQJRYDBWBAN-UHFFFAOYSA-N 1 2 236.706 2.273 20 0 BEADLO C[C@@H](O)c1ccc(N2CC3CC2(C)C3)[nH+]c1 ZINC000864092922 589343706 /nfs/dbraw/zinc/34/37/06/589343706.db2.gz CBUDACHUMDBTRY-TTXORMCVSA-N 1 2 218.300 2.124 20 0 BEADLO CC/C=C(/F)C(=O)Nc1c[nH+]ccc1OC ZINC000865069647 589407421 /nfs/dbraw/zinc/40/74/21/589407421.db2.gz KEHVWNDQSMKEJK-XBXARRHUSA-N 1 2 224.235 2.292 20 0 BEADLO Cc1cc(Cn2c[nH+]c(C(C)(C)C)c2)ncn1 ZINC000865376505 589429037 /nfs/dbraw/zinc/42/90/37/589429037.db2.gz QIOKQZFMEOZZCP-UHFFFAOYSA-N 1 2 230.315 2.327 20 0 BEADLO CC[C@H](C)Nc1nc(N)[nH+]c(C2CCCC2)n1 ZINC000865398257 589431787 /nfs/dbraw/zinc/43/17/87/589431787.db2.gz XNYVUCKGHRIYBS-QMMMGPOBSA-N 1 2 235.335 2.322 20 0 BEADLO CC[C@H](C)Nc1nc(N)nc(C2CCCC2)[nH+]1 ZINC000865398257 589431788 /nfs/dbraw/zinc/43/17/88/589431788.db2.gz XNYVUCKGHRIYBS-QMMMGPOBSA-N 1 2 235.335 2.322 20 0 BEADLO CSCCNc1[nH+]cnc2[nH]c(Cl)cc21 ZINC000865408953 589433899 /nfs/dbraw/zinc/43/38/99/589433899.db2.gz OBGANZNQZMQLAD-UHFFFAOYSA-N 1 2 242.735 2.386 20 0 BEADLO Cc1cc(CN(C)c2ccc([C@@H](C)O)c[nH+]2)no1 ZINC000865436881 589436092 /nfs/dbraw/zinc/43/60/92/589436092.db2.gz SMEYKBGKWBHQCZ-SNVBAGLBSA-N 1 2 247.298 2.068 20 0 BEADLO CC(C)Cn1cc[nH+]c1CNc1ccc(F)nn1 ZINC000865555633 589446411 /nfs/dbraw/zinc/44/64/11/589446411.db2.gz FOCCQHVPJHEIND-UHFFFAOYSA-N 1 2 249.293 2.080 20 0 BEADLO CCC=C(F)C(=O)Nc1cc[nH+]cc1C ZINC000865574917 589448060 /nfs/dbraw/zinc/44/80/60/589448060.db2.gz GMECBAFCTKVWNR-WTKPLQERSA-N 1 2 208.236 2.014 20 0 BEADLO Cc1cncc(CNc2ccc([C@H](C)O)c[nH+]2)c1 ZINC000865647349 589454337 /nfs/dbraw/zinc/45/43/37/589454337.db2.gz BMEACJKRUNWAHI-NSHDSACASA-N 1 2 243.310 2.450 20 0 BEADLO C[C@H](O)c1ccc(N2CC[C@H](C)[C@@H](F)C2)[nH+]c1 ZINC000865662527 589454903 /nfs/dbraw/zinc/45/49/03/589454903.db2.gz APLNGWVYGWGHOX-NHCYSSNCSA-N 1 2 238.306 2.319 20 0 BEADLO Clc1cc2c(nc[nH+]c2N2CC=CCC2)[nH]1 ZINC000865662885 589455297 /nfs/dbraw/zinc/45/52/97/589455297.db2.gz LTIZISPNSFZVLS-UHFFFAOYSA-N 1 2 234.690 2.329 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@@H]1CCCC[C@@H]1F ZINC000865698743 589457192 /nfs/dbraw/zinc/45/71/92/589457192.db2.gz GVLJFKCQIVSILX-WDEREUQCSA-N 1 2 211.284 2.088 20 0 BEADLO CC(C)Cc1cc(NCCCCCO)nc[nH+]1 ZINC000865736250 589459300 /nfs/dbraw/zinc/45/93/00/589459300.db2.gz IUOPYGSBLOWDKA-UHFFFAOYSA-N 1 2 237.347 2.250 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2C[C@@H]2[C@@H]2C[C@@H]2C)cc[nH+]1 ZINC000865741575 589460214 /nfs/dbraw/zinc/46/02/14/589460214.db2.gz PYRILMGHWMLNBC-BXGBBSSXSA-N 1 2 230.311 2.043 20 0 BEADLO C[C@H]1CC[C@@H]1Nc1[nH+]cnc2[nH]c(Cl)cc21 ZINC000865803730 589462468 /nfs/dbraw/zinc/46/24/68/589462468.db2.gz HYOILXZRTGEXOL-XPUUQOCRSA-N 1 2 236.706 2.244 20 0 BEADLO F[C@@H]1CCN(c2[nH+]cnc3[nH]c(Cl)cc32)C1 ZINC000865843577 589464760 /nfs/dbraw/zinc/46/47/60/589464760.db2.gz VMWDONNSMCPBJY-ZCFIWIBFSA-N 1 2 240.669 2.111 20 0 BEADLO Cn1c[nH+]c(CNc2cncc(C(F)F)c2)c1 ZINC000865865732 589465774 /nfs/dbraw/zinc/46/57/74/589465774.db2.gz WXZZTMOBQRGRNN-UHFFFAOYSA-N 1 2 238.241 2.365 20 0 BEADLO CC(C)Cc1cc(N(C)Cc2c[nH+]c[nH]2)ncn1 ZINC000865929309 589468862 /nfs/dbraw/zinc/46/88/62/589468862.db2.gz GANIDBMPGOMBKL-UHFFFAOYSA-N 1 2 245.330 2.035 20 0 BEADLO Clc1cc2c(nc[nH+]c2N[C@@H]2C=CCC2)[nH]1 ZINC000865939035 589469631 /nfs/dbraw/zinc/46/96/31/589469631.db2.gz NSOFNIITLWQHKD-SSDOTTSWSA-N 1 2 234.690 2.164 20 0 BEADLO Cc1nc(N[C@@H]2CCCC[C@@H]2F)cc[nH+]1 ZINC000866048352 589474161 /nfs/dbraw/zinc/47/41/61/589474161.db2.gz YTUGUOVLAMDURE-VHSXEESVSA-N 1 2 209.268 2.478 20 0 BEADLO COc1c(C)[nH+]cnc1NCCC(C)(C)OC ZINC000866131404 589477766 /nfs/dbraw/zinc/47/77/66/589477766.db2.gz DRMCYBHHYBNMGF-UHFFFAOYSA-N 1 2 239.319 2.021 20 0 BEADLO c1ccc(NC[C@H]2CC3(CO2)CCOCC3)[nH+]c1 ZINC000866178504 589479094 /nfs/dbraw/zinc/47/90/94/589479094.db2.gz ULOTVVIYGAUOGE-GFCCVEGCSA-N 1 2 248.326 2.079 20 0 BEADLO c1ccc(N2CC[C@@H]3CSC[C@H]3C2)[nH+]c1 ZINC000866205617 589480339 /nfs/dbraw/zinc/48/03/39/589480339.db2.gz GOOQJTXWZRLOCO-GHMZBOCLSA-N 1 2 220.341 2.271 20 0 BEADLO Cc1cc(NCC[C@H](O)C2CCCC2)nc[nH+]1 ZINC000866303906 589485421 /nfs/dbraw/zinc/48/54/21/589485421.db2.gz QSEMCRSOKNCVCT-LBPRGKRZSA-N 1 2 235.331 2.138 20 0 BEADLO Fc1cc(C[NH2+][C@@H]2CCCc3[nH]ncc32)ccn1 ZINC000866474848 589494837 /nfs/dbraw/zinc/49/48/37/589494837.db2.gz OMDBXPZCAAEPPZ-LLVKDONJSA-N 1 2 246.289 2.111 20 0 BEADLO COCc1cc([NH2+][C@H](C)CCO)ccc1OC ZINC000866499666 589497815 /nfs/dbraw/zinc/49/78/15/589497815.db2.gz OQRCWHLURVGJJC-SNVBAGLBSA-N 1 2 239.315 2.024 20 0 BEADLO CN(C)c1ccc([NH2+]C2CCOCC2)cc1F ZINC000866624298 589505700 /nfs/dbraw/zinc/50/57/00/589505700.db2.gz GWDRBVDTAZVNHX-UHFFFAOYSA-N 1 2 238.306 2.483 20 0 BEADLO Nc1ccc2c(c1)OCC[N@@H+](C/C=C/Cl)C2 ZINC000866688846 589512340 /nfs/dbraw/zinc/51/23/40/589512340.db2.gz AJCFEEDTTXFGQH-DAFODLJHSA-N 1 2 238.718 2.216 20 0 BEADLO Nc1ccc2c(c1)OCC[N@H+](C/C=C/Cl)C2 ZINC000866688846 589512341 /nfs/dbraw/zinc/51/23/41/589512341.db2.gz AJCFEEDTTXFGQH-DAFODLJHSA-N 1 2 238.718 2.216 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)C(C)C)c1 ZINC000122268036 589573672 /nfs/dbraw/zinc/57/36/72/589573672.db2.gz GPRXNOBWJGCPSB-UHFFFAOYSA-N 1 2 223.272 2.098 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@]12C[C@H]1CCCC2 ZINC000870219968 589650270 /nfs/dbraw/zinc/65/02/70/589650270.db2.gz KPORKKBNHNNEKA-ZWNOBZJWSA-N 1 2 234.299 2.044 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)C2(C)CC2)c1 ZINC000123030738 589652960 /nfs/dbraw/zinc/65/29/60/589652960.db2.gz SXLCLDRTMUHGFK-UHFFFAOYSA-N 1 2 235.283 2.242 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)[C@H]2CC2(C)C)c1 ZINC000123075344 589658892 /nfs/dbraw/zinc/65/88/92/589658892.db2.gz CVZMDGFYJZCMFA-GFCCVEGCSA-N 1 2 249.310 2.488 20 0 BEADLO CC(=O)[C@@H](C)SCc1[nH+]ccn1CC(F)F ZINC000871656667 589783296 /nfs/dbraw/zinc/78/32/96/589783296.db2.gz SVMYMASXJNJIIQ-MRVPVSSYSA-N 1 2 248.298 2.359 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OC[C@H](C)C(C)(C)C ZINC000871735569 589801150 /nfs/dbraw/zinc/80/11/50/589801150.db2.gz ULBYKKXCLBATNB-DTWKUNHWSA-N 1 2 216.325 2.202 20 0 BEADLO CC1(C)CC(O[NH+]=C(N)COC2CCC2)C1 ZINC000871778307 589813752 /nfs/dbraw/zinc/81/37/52/589813752.db2.gz BRBWRUIWIUEXII-UHFFFAOYSA-N 1 2 226.320 2.243 20 0 BEADLO CCCC[C@@H]([NH2+][C@H]1C[C@H](SC)C1)C(=O)OC ZINC000871916185 589832462 /nfs/dbraw/zinc/83/24/62/589832462.db2.gz JJDFKDDSIMEHOZ-GMTAPVOTSA-N 1 2 245.388 2.202 20 0 BEADLO Cc1nonc1C[NH2+][C@@H]1CCCc2occc21 ZINC000872135931 589879478 /nfs/dbraw/zinc/87/94/78/589879478.db2.gz JKPPHENDEUXPKY-SNVBAGLBSA-N 1 2 233.271 2.138 20 0 BEADLO CCCCc1cc(NC[C@H]2C[C@H](O)C2)nc[nH+]1 ZINC000872719037 589964722 /nfs/dbraw/zinc/96/47/22/589964722.db2.gz UGFHKYROQXAGRD-UMSPYCQHSA-N 1 2 235.331 2.002 20 0 BEADLO CCOc1cccc(F)c1C[NH2+]Cc1cc[nH]n1 ZINC000873045151 589981531 /nfs/dbraw/zinc/98/15/31/589981531.db2.gz BUAYKGGXLBCKFY-UHFFFAOYSA-N 1 2 249.289 2.237 20 0 BEADLO CCC[C@H](CC)C(=O)OCCn1cc[nH+]c1 ZINC000873422620 590042679 /nfs/dbraw/zinc/04/26/79/590042679.db2.gz ZTIYYLYDWFYQMB-NSHDSACASA-N 1 2 224.304 2.253 20 0 BEADLO CCC[C@H](CC)C(=O)NC1=[NH+]CCS1 ZINC000873837874 590074083 /nfs/dbraw/zinc/07/40/83/590074083.db2.gz JTGIVGMXMJYFHP-QMMMGPOBSA-N 1 2 214.334 2.032 20 0 BEADLO CSCC[C@@H](C)[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000125239704 590157609 /nfs/dbraw/zinc/15/76/09/590157609.db2.gz XLXOBZWHRJQLED-NXEZZACHSA-N 1 2 247.404 2.448 20 0 BEADLO C[N@@H+](Cc1nc(Cl)cs1)C[C@@H]1CCCO1 ZINC000876566680 590216963 /nfs/dbraw/zinc/21/69/63/590216963.db2.gz QAYINADEDQEOJN-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO C[N@H+](Cc1nc(Cl)cs1)C[C@@H]1CCCO1 ZINC000876566680 590216964 /nfs/dbraw/zinc/21/69/64/590216964.db2.gz QAYINADEDQEOJN-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO CCc1cc(C[NH2+]Cc2cc(C3CC3)no2)[nH]n1 ZINC000877033637 590272267 /nfs/dbraw/zinc/27/22/67/590272267.db2.gz JAMUBJKSOLRICF-UHFFFAOYSA-N 1 2 246.314 2.127 20 0 BEADLO CC1(C[N@@H+]2C[C@@H](O)CC(F)(F)C2)CCCC1 ZINC000877467976 590333741 /nfs/dbraw/zinc/33/37/41/590333741.db2.gz VBBIWRKQEQQQNU-JTQLQIEISA-N 1 2 233.302 2.269 20 0 BEADLO CC1(C[N@H+]2C[C@@H](O)CC(F)(F)C2)CCCC1 ZINC000877467976 590333743 /nfs/dbraw/zinc/33/37/43/590333743.db2.gz VBBIWRKQEQQQNU-JTQLQIEISA-N 1 2 233.302 2.269 20 0 BEADLO COc1cnc(F)c(C[NH+]2CC(C3CC3)C2)c1 ZINC000877542064 590351432 /nfs/dbraw/zinc/35/14/32/590351432.db2.gz OTUXECZDEORDGO-UHFFFAOYSA-N 1 2 236.290 2.071 20 0 BEADLO CC1(C)[C@@H](O)CC[N@@H+]1Cc1nc(Cl)cs1 ZINC000877541462 590351717 /nfs/dbraw/zinc/35/17/17/590351717.db2.gz JJFWJCPORXNIFV-ZETCQYMHSA-N 1 2 246.763 2.142 20 0 BEADLO CC1(C)[C@@H](O)CC[N@H+]1Cc1nc(Cl)cs1 ZINC000877541462 590351718 /nfs/dbraw/zinc/35/17/18/590351718.db2.gz JJFWJCPORXNIFV-ZETCQYMHSA-N 1 2 246.763 2.142 20 0 BEADLO CC(F)(F)C[NH2+]C[C@@H]1CC1(Cl)Cl ZINC000877551494 590352078 /nfs/dbraw/zinc/35/20/78/590352078.db2.gz BWJNMJULCDOKPA-YFKPBYRVSA-N 1 2 218.074 2.425 20 0 BEADLO c1ccc2oc(C[NH+]3CC4(C3)CCOC4)nc2c1 ZINC000877555468 590356880 /nfs/dbraw/zinc/35/68/80/590356880.db2.gz ZEWULJNBBJVUOI-UHFFFAOYSA-N 1 2 244.294 2.050 20 0 BEADLO FCC(CF)[NH2+]C[C@@H]1CC1(Cl)Cl ZINC000877555843 590356892 /nfs/dbraw/zinc/35/68/92/590356892.db2.gz DODLFWGIZBHLBR-YFKPBYRVSA-N 1 2 218.074 2.077 20 0 BEADLO CCOC1(C)C[NH+](C[C@H]2CC2(Cl)Cl)C1 ZINC000877581439 590365995 /nfs/dbraw/zinc/36/59/95/590365995.db2.gz DMGVOGWNDOKVSM-MRVPVSSYSA-N 1 2 238.158 2.291 20 0 BEADLO Cc1nc(C[N@@H+](C)CC2(C)CCCC2)no1 ZINC000877641771 590383530 /nfs/dbraw/zinc/38/35/30/590383530.db2.gz JBSNKGSCALLEPZ-UHFFFAOYSA-N 1 2 223.320 2.390 20 0 BEADLO Cc1nc(C[N@H+](C)CC2(C)CCCC2)no1 ZINC000877641771 590383533 /nfs/dbraw/zinc/38/35/33/590383533.db2.gz JBSNKGSCALLEPZ-UHFFFAOYSA-N 1 2 223.320 2.390 20 0 BEADLO CC(C)(C)c1csc(C[NH2+]C2(C)COC2)n1 ZINC000877691216 590392408 /nfs/dbraw/zinc/39/24/08/590392408.db2.gz LFLKEJRICCMSIP-UHFFFAOYSA-N 1 2 240.372 2.319 20 0 BEADLO Cc1ccc(C[NH+]2CC(OC(C)(C)C)C2)nc1 ZINC000877770085 590420938 /nfs/dbraw/zinc/42/09/38/590420938.db2.gz PAKLHUOYYLYXLG-UHFFFAOYSA-N 1 2 234.343 2.389 20 0 BEADLO CC(C)(C)OC1C[NH+](Cc2ccco2)C1 ZINC000877771664 590422160 /nfs/dbraw/zinc/42/21/60/590422160.db2.gz AFDUUSMWSUVKLB-UHFFFAOYSA-N 1 2 209.289 2.279 20 0 BEADLO Cn1ccnc1C[N@@H+]1CC[C@](C)(C(F)(F)F)C1 ZINC000877813103 590427204 /nfs/dbraw/zinc/42/72/04/590427204.db2.gz WKRBSOGUEXBVLI-JTQLQIEISA-N 1 2 247.264 2.194 20 0 BEADLO Cn1ccnc1C[N@H+]1CC[C@](C)(C(F)(F)F)C1 ZINC000877813103 590427207 /nfs/dbraw/zinc/42/72/07/590427207.db2.gz WKRBSOGUEXBVLI-JTQLQIEISA-N 1 2 247.264 2.194 20 0 BEADLO C[N@@H+](Cc1scnc1Cl)C[C@H]1CCCO1 ZINC000877973223 590463078 /nfs/dbraw/zinc/46/30/78/590463078.db2.gz WWYTUTXWYDCCMI-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO C[N@H+](Cc1scnc1Cl)C[C@H]1CCCO1 ZINC000877973223 590463080 /nfs/dbraw/zinc/46/30/80/590463080.db2.gz WWYTUTXWYDCCMI-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO CC[N@H+](CCOC)Cc1nc2c(o1)CCCC2 ZINC000877992913 590467661 /nfs/dbraw/zinc/46/76/61/590467661.db2.gz AMCJBQIJPQVYFQ-UHFFFAOYSA-N 1 2 238.331 2.022 20 0 BEADLO CC[N@@H+](CCOC)Cc1nc2c(o1)CCCC2 ZINC000877992913 590467664 /nfs/dbraw/zinc/46/76/64/590467664.db2.gz AMCJBQIJPQVYFQ-UHFFFAOYSA-N 1 2 238.331 2.022 20 0 BEADLO C[C@H]1C[N@H+](Cc2scnc2Cl)CCCO1 ZINC000878041980 590478968 /nfs/dbraw/zinc/47/89/68/590478968.db2.gz RDTJAIBPGQIVAV-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@H]1C[N@@H+](Cc2scnc2Cl)CCCO1 ZINC000878041980 590478972 /nfs/dbraw/zinc/47/89/72/590478972.db2.gz RDTJAIBPGQIVAV-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO COC(=O)C(C)(C)[NH2+]CCCSC(C)(C)C ZINC000878045015 590480348 /nfs/dbraw/zinc/48/03/48/590480348.db2.gz TZZZDWPXBNKCIW-UHFFFAOYSA-N 1 2 247.404 2.449 20 0 BEADLO C=C/C=C/CC[N@@H+](CCOC)CC(F)F ZINC000878052778 590484015 /nfs/dbraw/zinc/48/40/15/590484015.db2.gz XWDUZSHDBWRYJY-SNAWJCMRSA-N 1 2 219.275 2.332 20 0 BEADLO C=C/C=C/CC[N@H+](CCOC)CC(F)F ZINC000878052778 590484017 /nfs/dbraw/zinc/48/40/17/590484017.db2.gz XWDUZSHDBWRYJY-SNAWJCMRSA-N 1 2 219.275 2.332 20 0 BEADLO CC(C)[C@H](O)CC[N@H+](CC(F)F)C1CC1 ZINC000878084460 590490091 /nfs/dbraw/zinc/49/00/91/590490091.db2.gz TWBDOJFQXYHWRN-SNVBAGLBSA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)[C@H](O)CC[N@@H+](CC(F)F)C1CC1 ZINC000878084460 590490092 /nfs/dbraw/zinc/49/00/92/590490092.db2.gz TWBDOJFQXYHWRN-SNVBAGLBSA-N 1 2 221.291 2.123 20 0 BEADLO Cc1[nH]c(CN2CC3(C2)CC(F)(F)C3)[nH+]c1C ZINC000878321379 590544774 /nfs/dbraw/zinc/54/47/74/590544774.db2.gz PIYUSNPGPQXUKC-UHFFFAOYSA-N 1 2 241.285 2.258 20 0 BEADLO C[C@@H]1CCOCC[N@@H+]1Cc1scnc1Cl ZINC000878373469 590556100 /nfs/dbraw/zinc/55/61/00/590556100.db2.gz MEWOVGCYCMQALV-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@@H]1CCOCC[N@H+]1Cc1scnc1Cl ZINC000878373469 590556102 /nfs/dbraw/zinc/55/61/02/590556102.db2.gz MEWOVGCYCMQALV-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO O[C@H]1C[N@H+](CC2CC3(CCC3)C2)CC(F)(F)C1 ZINC000878493685 590579704 /nfs/dbraw/zinc/57/97/04/590579704.db2.gz TYMBAFSEZKXZCI-LLVKDONJSA-N 1 2 245.313 2.269 20 0 BEADLO O[C@H]1C[N@@H+](CC2CC3(CCC3)C2)CC(F)(F)C1 ZINC000878493685 590579708 /nfs/dbraw/zinc/57/97/08/590579708.db2.gz TYMBAFSEZKXZCI-LLVKDONJSA-N 1 2 245.313 2.269 20 0 BEADLO CCC(F)(F)C[NH2+]C(C)(C)C(=O)N1CCCC1 ZINC000878544650 590590028 /nfs/dbraw/zinc/59/00/28/590590028.db2.gz WXXWTRUTABDIMN-UHFFFAOYSA-N 1 2 248.317 2.022 20 0 BEADLO c1cnc2c(c1)C[N@@H+](C[C@@H]1C[C@H]3CCC[C@@H]3O1)C2 ZINC000878548932 590590528 /nfs/dbraw/zinc/59/05/28/590590528.db2.gz YVJNYUOFEDXHRQ-ZLDLUXBVSA-N 1 2 244.338 2.355 20 0 BEADLO c1cnc2c(c1)C[N@H+](C[C@@H]1C[C@H]3CCC[C@@H]3O1)C2 ZINC000878548932 590590529 /nfs/dbraw/zinc/59/05/29/590590529.db2.gz YVJNYUOFEDXHRQ-ZLDLUXBVSA-N 1 2 244.338 2.355 20 0 BEADLO c1cnc2c(c1)C[N@@H+](C[C@@H]1CCC3(CCC3)O1)C2 ZINC000878548782 590590558 /nfs/dbraw/zinc/59/05/58/590590558.db2.gz SRZUKYNCZAXVPP-ZDUSSCGKSA-N 1 2 244.338 2.499 20 0 BEADLO c1cnc2c(c1)C[N@H+](C[C@@H]1CCC3(CCC3)O1)C2 ZINC000878548782 590590559 /nfs/dbraw/zinc/59/05/59/590590559.db2.gz SRZUKYNCZAXVPP-ZDUSSCGKSA-N 1 2 244.338 2.499 20 0 BEADLO c1cc2c(cn1)C[N@H+](C[C@@H]1CCC3(CCC3)O1)C2 ZINC000878609284 590595665 /nfs/dbraw/zinc/59/56/65/590595665.db2.gz WEXDQSMTEITWAU-AWEZNQCLSA-N 1 2 244.338 2.499 20 0 BEADLO c1cc2c(cn1)C[N@@H+](C[C@@H]1CCC3(CCC3)O1)C2 ZINC000878609284 590595666 /nfs/dbraw/zinc/59/56/66/590595666.db2.gz WEXDQSMTEITWAU-AWEZNQCLSA-N 1 2 244.338 2.499 20 0 BEADLO c1cc2c(cn1)C[N@H+](C[C@H]1CC3(CCC3)CO1)C2 ZINC000878608886 590595910 /nfs/dbraw/zinc/59/59/10/590595910.db2.gz HFVPDZPWSLBMLE-CQSZACIVSA-N 1 2 244.338 2.356 20 0 BEADLO c1cc2c(cn1)C[N@@H+](C[C@H]1CC3(CCC3)CO1)C2 ZINC000878608886 590595913 /nfs/dbraw/zinc/59/59/13/590595913.db2.gz HFVPDZPWSLBMLE-CQSZACIVSA-N 1 2 244.338 2.356 20 0 BEADLO CO[C@@H](C)C[N@H+](C)Cc1scnc1Cl ZINC000878613708 590596296 /nfs/dbraw/zinc/59/62/96/590596296.db2.gz VKLWKJUECJHOMV-ZETCQYMHSA-N 1 2 234.752 2.263 20 0 BEADLO CO[C@@H](C)C[N@@H+](C)Cc1scnc1Cl ZINC000878613708 590596297 /nfs/dbraw/zinc/59/62/97/590596297.db2.gz VKLWKJUECJHOMV-ZETCQYMHSA-N 1 2 234.752 2.263 20 0 BEADLO C=C/C=C\CC[N@H+](CC(F)F)C[C@@H](C)O ZINC000878685126 590609066 /nfs/dbraw/zinc/60/90/66/590609066.db2.gz QVOCSAJEZPMCCA-UMCURTJPSA-N 1 2 219.275 2.067 20 0 BEADLO C=C/C=C\CC[N@@H+](CC(F)F)C[C@@H](C)O ZINC000878685126 590609068 /nfs/dbraw/zinc/60/90/68/590609068.db2.gz QVOCSAJEZPMCCA-UMCURTJPSA-N 1 2 219.275 2.067 20 0 BEADLO Clc1ncsc1C[N@@H+]1C[C@@H]2C[C@H]1CS2 ZINC000878706254 590612648 /nfs/dbraw/zinc/61/26/48/590612648.db2.gz UEZDPWXFMRTWPX-BQBZGAKWSA-N 1 2 246.788 2.486 20 0 BEADLO Clc1ncsc1C[N@H+]1C[C@@H]2C[C@H]1CS2 ZINC000878706254 590612650 /nfs/dbraw/zinc/61/26/50/590612650.db2.gz UEZDPWXFMRTWPX-BQBZGAKWSA-N 1 2 246.788 2.486 20 0 BEADLO CC[C@H]1C[NH+](Cc2nocc2C)C[C@H](CC)O1 ZINC000878719475 590615701 /nfs/dbraw/zinc/61/57/01/590615701.db2.gz BYLRSTPNETVFCQ-RYUDHWBXSA-N 1 2 238.331 2.372 20 0 BEADLO Cc1conc1C[N@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC000878770935 590620268 /nfs/dbraw/zinc/62/02/68/590620268.db2.gz YLONFXYQRMJGNE-LLVKDONJSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1conc1C[N@@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC000878770935 590620269 /nfs/dbraw/zinc/62/02/69/590620269.db2.gz YLONFXYQRMJGNE-LLVKDONJSA-N 1 2 236.315 2.126 20 0 BEADLO CCON(CC)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000878773092 590620944 /nfs/dbraw/zinc/62/09/44/590620944.db2.gz AYBCJARSPPZSSY-UHFFFAOYSA-N 1 2 248.286 2.140 20 0 BEADLO ClC1=CCC[N@H+](Cc2ccccn2)C1 ZINC000878794190 590621577 /nfs/dbraw/zinc/62/15/77/590621577.db2.gz UZTPTEPSMRGEPX-UHFFFAOYSA-N 1 2 208.692 2.410 20 0 BEADLO ClC1=CCC[N@@H+](Cc2ccccn2)C1 ZINC000878794190 590621579 /nfs/dbraw/zinc/62/15/79/590621579.db2.gz UZTPTEPSMRGEPX-UHFFFAOYSA-N 1 2 208.692 2.410 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@@H+]1Cc1nocc1C ZINC000878803073 590624720 /nfs/dbraw/zinc/62/47/20/590624720.db2.gz BIOWKDRXLGNFQX-LLVKDONJSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@H+]1Cc1nocc1C ZINC000878803073 590624722 /nfs/dbraw/zinc/62/47/22/590624722.db2.gz BIOWKDRXLGNFQX-LLVKDONJSA-N 1 2 238.331 2.372 20 0 BEADLO CC(C)[C@H](O)CC[N@@H+]1CCCC(F)(F)C1 ZINC000878803606 590625094 /nfs/dbraw/zinc/62/50/94/590625094.db2.gz DVXJTJAOEGEDAR-SNVBAGLBSA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)[C@H](O)CC[N@H+]1CCCC(F)(F)C1 ZINC000878803606 590625097 /nfs/dbraw/zinc/62/50/97/590625097.db2.gz DVXJTJAOEGEDAR-SNVBAGLBSA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)(CC(=O)NCc1c[nH+]c[nH]1)CC(F)F ZINC000878907789 590644662 /nfs/dbraw/zinc/64/46/62/590644662.db2.gz PCZLIUWEOZKAQB-UHFFFAOYSA-N 1 2 245.273 2.097 20 0 BEADLO CC(C)(CC(=O)NCc1c[nH]c[nH+]1)CC(F)F ZINC000878907789 590644665 /nfs/dbraw/zinc/64/46/65/590644665.db2.gz PCZLIUWEOZKAQB-UHFFFAOYSA-N 1 2 245.273 2.097 20 0 BEADLO CC(=O)C[NH+]1CCN(c2ccc(C)cc2C)CC1 ZINC000878997869 590672473 /nfs/dbraw/zinc/67/24/73/590672473.db2.gz KNQYLQRSTXPFDF-UHFFFAOYSA-N 1 2 246.354 2.014 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)CCOCCC(C)C ZINC000879185240 590710154 /nfs/dbraw/zinc/71/01/54/590710154.db2.gz HZXAEFGHCWSDTE-UHFFFAOYSA-N 1 2 239.363 2.213 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)CCOCCC(C)C ZINC000879185240 590710157 /nfs/dbraw/zinc/71/01/57/590710157.db2.gz HZXAEFGHCWSDTE-UHFFFAOYSA-N 1 2 239.363 2.213 20 0 BEADLO C=C/C=C/CC[N@@H+](C)Cc1cn[nH]c1C ZINC000879188945 590712296 /nfs/dbraw/zinc/71/22/96/590712296.db2.gz UDNPUMYMQZQEHK-AATRIKPKSA-N 1 2 205.305 2.282 20 0 BEADLO C=C/C=C/CC[N@H+](C)Cc1cn[nH]c1C ZINC000879188945 590712297 /nfs/dbraw/zinc/71/22/97/590712297.db2.gz UDNPUMYMQZQEHK-AATRIKPKSA-N 1 2 205.305 2.282 20 0 BEADLO CC(C)COC(=O)C[NH+]1CCC(CCF)CC1 ZINC000879208252 590715282 /nfs/dbraw/zinc/71/52/82/590715282.db2.gz ALFGKOAFDUMQMO-UHFFFAOYSA-N 1 2 245.338 2.257 20 0 BEADLO C[C@@]1(C(F)(F)F)C[N@H+](CCCCF)CCO1 ZINC000879502328 590783074 /nfs/dbraw/zinc/78/30/74/590783074.db2.gz ZELGPKKWUKHDPR-VIFPVBQESA-N 1 2 243.244 2.389 20 0 BEADLO C[C@@]1(C(F)(F)F)C[N@@H+](CCCCF)CCO1 ZINC000879502328 590783080 /nfs/dbraw/zinc/78/30/80/590783080.db2.gz ZELGPKKWUKHDPR-VIFPVBQESA-N 1 2 243.244 2.389 20 0 BEADLO COC(C[NH2+][C@@H](CF)c1ccc(F)cc1)OC ZINC000879659642 590844843 /nfs/dbraw/zinc/84/48/43/590844843.db2.gz DRAMUVHBEQHOBZ-NSHDSACASA-N 1 2 245.269 2.045 20 0 BEADLO Cc1cncc([C@@H]2CCC[N@@H+]2Cc2c[nH]cn2)c1 ZINC000879749929 590862751 /nfs/dbraw/zinc/86/27/51/590862751.db2.gz NFDJUUROLKYWEV-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cncc([C@@H]2CCC[N@H+]2Cc2c[nH]cn2)c1 ZINC000879749929 590862756 /nfs/dbraw/zinc/86/27/56/590862756.db2.gz NFDJUUROLKYWEV-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cncc([C@@H]2CCC[N@@H+]2Cc2cnc[nH]2)c1 ZINC000879749929 590862761 /nfs/dbraw/zinc/86/27/61/590862761.db2.gz NFDJUUROLKYWEV-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cncc([C@@H]2CCC[N@H+]2Cc2cnc[nH]2)c1 ZINC000879749929 590862763 /nfs/dbraw/zinc/86/27/63/590862763.db2.gz NFDJUUROLKYWEV-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO CCON(CC)CCc1cc[nH+]cc1C ZINC000879797770 590874896 /nfs/dbraw/zinc/87/48/96/590874896.db2.gz HBBKRDMQXFUVMK-UHFFFAOYSA-N 1 2 208.305 2.206 20 0 BEADLO CCOC(=O)[C@@H](CC1CC1)[NH2+]CC1=CCCC1 ZINC000879981313 590904305 /nfs/dbraw/zinc/90/43/05/590904305.db2.gz PGPXYYQVCYEBAC-CYBMUJFWSA-N 1 2 237.343 2.418 20 0 BEADLO Cc1coc(C(=O)N[C@H]2C[C@@H](C)n3cc[nH+]c32)c1 ZINC000880227287 590961695 /nfs/dbraw/zinc/96/16/95/590961695.db2.gz JETRVFVXPBSGFC-ZJUUUORDSA-N 1 2 245.282 2.220 20 0 BEADLO Cc1coc(C(=O)N[C@@H]2C[C@@H](C)n3cc[nH+]c32)c1 ZINC000880227284 590962067 /nfs/dbraw/zinc/96/20/67/590962067.db2.gz JETRVFVXPBSGFC-NXEZZACHSA-N 1 2 245.282 2.220 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2CCC[C@@H](CF)C2)no1 ZINC000880236961 590967466 /nfs/dbraw/zinc/96/74/66/590967466.db2.gz MXTFHZZRRHFVTO-SCZZXKLOSA-N 1 2 227.283 2.121 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2CCC[C@@H](CF)C2)no1 ZINC000880236961 590967467 /nfs/dbraw/zinc/96/74/67/590967467.db2.gz MXTFHZZRRHFVTO-SCZZXKLOSA-N 1 2 227.283 2.121 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+]1CCC[C@@H](CF)C1 ZINC000880238903 590970947 /nfs/dbraw/zinc/97/09/47/590970947.db2.gz YWBJVAXPWBCMRQ-IUCAKERBSA-N 1 2 229.324 2.281 20 0 BEADLO C[C@@H](c1csnn1)[N@H+]1CCC[C@@H](CF)C1 ZINC000880238903 590970952 /nfs/dbraw/zinc/97/09/52/590970952.db2.gz YWBJVAXPWBCMRQ-IUCAKERBSA-N 1 2 229.324 2.281 20 0 BEADLO FC1CC[NH+](Cc2nc3c(o2)CCCC3)CC1 ZINC000880239348 590973228 /nfs/dbraw/zinc/97/32/28/590973228.db2.gz ZQSQNYYYBFCLRN-UHFFFAOYSA-N 1 2 238.306 2.487 20 0 BEADLO FC(F)n1ccnc1C[NH+]1CCC(F)CC1 ZINC000880242547 590975181 /nfs/dbraw/zinc/97/51/81/590975181.db2.gz CMAQEIDOYGPFEW-UHFFFAOYSA-N 1 2 233.237 2.212 20 0 BEADLO FC1CC[NH+](Cc2cscn2)CC1 ZINC000880243001 590976717 /nfs/dbraw/zinc/97/67/17/590976717.db2.gz BNWGNXORIXGKRH-UHFFFAOYSA-N 1 2 200.282 2.077 20 0 BEADLO Cn1c(Cl)cnc1C[NH+]1CCC(F)CC1 ZINC000880243262 590976851 /nfs/dbraw/zinc/97/68/51/590976851.db2.gz VYDZPKYPIZHFAN-UHFFFAOYSA-N 1 2 231.702 2.007 20 0 BEADLO FC[C@H]1CC[N@H+](Cc2nccn2C(F)F)C1 ZINC000880295073 590989593 /nfs/dbraw/zinc/98/95/93/590989593.db2.gz IJGRBTIOMOZYCL-MRVPVSSYSA-N 1 2 233.237 2.070 20 0 BEADLO FC[C@H]1CC[N@@H+](Cc2nccn2C(F)F)C1 ZINC000880295073 590989595 /nfs/dbraw/zinc/98/95/95/590989595.db2.gz IJGRBTIOMOZYCL-MRVPVSSYSA-N 1 2 233.237 2.070 20 0 BEADLO C[C@H]1c2sccc2CC[N@H+]1CCc1cnn[nH]1 ZINC000880376508 591015121 /nfs/dbraw/zinc/01/51/21/591015121.db2.gz IBRVPIRNSIIVJA-VIFPVBQESA-N 1 2 248.355 2.028 20 0 BEADLO C[C@H]1c2sccc2CC[N@@H+]1CCc1cnn[nH]1 ZINC000880376508 591015126 /nfs/dbraw/zinc/01/51/26/591015126.db2.gz IBRVPIRNSIIVJA-VIFPVBQESA-N 1 2 248.355 2.028 20 0 BEADLO C[C@@H]1c2sccc2CC[N@H+]1CCc1cnn[nH]1 ZINC000880376507 591016003 /nfs/dbraw/zinc/01/60/03/591016003.db2.gz IBRVPIRNSIIVJA-SECBINFHSA-N 1 2 248.355 2.028 20 0 BEADLO C[C@@H]1c2sccc2CC[N@@H+]1CCc1cnn[nH]1 ZINC000880376507 591016009 /nfs/dbraw/zinc/01/60/09/591016009.db2.gz IBRVPIRNSIIVJA-SECBINFHSA-N 1 2 248.355 2.028 20 0 BEADLO Fc1cc2c(cc1F)CN(Cc1c[nH+]c[nH]1)CC2 ZINC000880445067 591046248 /nfs/dbraw/zinc/04/62/48/591046248.db2.gz VRXVPIKUXKUXBX-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO Fc1cc2c(cc1F)CN(Cc1c[nH]c[nH+]1)CC2 ZINC000880445067 591046253 /nfs/dbraw/zinc/04/62/53/591046253.db2.gz VRXVPIKUXKUXBX-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO CCCC(=O)c1cn(Cc2cc[nH+]c(C)c2)nn1 ZINC000881322804 591190812 /nfs/dbraw/zinc/19/08/12/591190812.db2.gz OBGGQAPXSQRBQQ-UHFFFAOYSA-N 1 2 244.298 2.013 20 0 BEADLO Cc1[nH]c(C(=O)NCC2(CC3CC3)CC2)c[nH+]1 ZINC000881518233 591227544 /nfs/dbraw/zinc/22/75/44/591227544.db2.gz ZCIDDENXDZVTLQ-UHFFFAOYSA-N 1 2 233.315 2.028 20 0 BEADLO CCC[C@H](C)CCNC(=O)c1c[nH+]c(C)[nH]1 ZINC000881530369 591231035 /nfs/dbraw/zinc/23/10/35/591231035.db2.gz QOHXZYWHDHDSSK-VIFPVBQESA-N 1 2 223.320 2.274 20 0 BEADLO CCC[C@@H](C)CCNC(=O)CCc1c[nH+]c[nH]1 ZINC000881532556 591231864 /nfs/dbraw/zinc/23/18/64/591231864.db2.gz SDHFCRDIEULCLE-LLVKDONJSA-N 1 2 237.347 2.285 20 0 BEADLO CCC[C@@H](C)CCNC(=O)CCc1c[nH]c[nH+]1 ZINC000881532556 591231866 /nfs/dbraw/zinc/23/18/66/591231866.db2.gz SDHFCRDIEULCLE-LLVKDONJSA-N 1 2 237.347 2.285 20 0 BEADLO C=C/C=C\CCNC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000881570939 591244784 /nfs/dbraw/zinc/24/47/84/591244784.db2.gz WVABXIVXHZXKJO-QMAVJUDZSA-N 1 2 233.315 2.083 20 0 BEADLO Cc1cnc(C)c(Nc2ccc(N(C)C)[nH+]c2)n1 ZINC000881787086 591270980 /nfs/dbraw/zinc/27/09/80/591270980.db2.gz WODJSKGNKWBPMN-UHFFFAOYSA-N 1 2 243.314 2.298 20 0 BEADLO Cc1n[nH]cc1CCCNc1nc[nH+]c(C)c1C ZINC000881787972 591271324 /nfs/dbraw/zinc/27/13/24/591271324.db2.gz SJTNCCXMKNICDW-UHFFFAOYSA-N 1 2 245.330 2.170 20 0 BEADLO Cc1[nH+]cnc(NCc2nccs2)c1C ZINC000881813510 591272964 /nfs/dbraw/zinc/27/29/64/591272964.db2.gz MGQDJXVFIYICRW-UHFFFAOYSA-N 1 2 220.301 2.162 20 0 BEADLO Cc1nc(CNc2nc[nH+]c(C)c2C)cs1 ZINC000881817900 591273386 /nfs/dbraw/zinc/27/33/86/591273386.db2.gz XESLHUJCSADKAP-UHFFFAOYSA-N 1 2 234.328 2.470 20 0 BEADLO Cc1[nH+]cnc(NCc2ccccc2CO)c1C ZINC000881835662 591273681 /nfs/dbraw/zinc/27/36/81/591273681.db2.gz GSJOLYMGVUKOMG-UHFFFAOYSA-N 1 2 243.310 2.198 20 0 BEADLO Cc1[nH+]cnc(NCCOC(C)(C)C)c1C ZINC000881865999 591274860 /nfs/dbraw/zinc/27/48/60/591274860.db2.gz FGYIDZWZGNELDP-UHFFFAOYSA-N 1 2 223.320 2.320 20 0 BEADLO CCC(O)(CC)CNc1nc[nH+]c(C)c1C ZINC000881865193 591275324 /nfs/dbraw/zinc/27/53/24/591275324.db2.gz QAUXDYRYLZRGIE-UHFFFAOYSA-N 1 2 223.320 2.056 20 0 BEADLO Cc1ccc(CCNc2ncnc(C)c2C)c[nH+]1 ZINC000881964944 591283827 /nfs/dbraw/zinc/28/38/27/591283827.db2.gz GHCGHHMGMTYIMV-UHFFFAOYSA-N 1 2 242.326 2.451 20 0 BEADLO CO[C@H](CNc1nc[nH+]c(C)c1C)C(F)(F)F ZINC000881981935 591285295 /nfs/dbraw/zinc/28/52/95/591285295.db2.gz QQMSZFTVGRYFQP-MRVPVSSYSA-N 1 2 249.236 2.083 20 0 BEADLO CS[C@@H]1CC[C@@H](Nc2cc(CO)cc[nH+]2)C1 ZINC000882027885 591288805 /nfs/dbraw/zinc/28/88/05/591288805.db2.gz GHMDYKJXDUSTIK-GHMZBOCLSA-N 1 2 238.356 2.270 20 0 BEADLO Cc1[nH+]cnc(NC2CCC(C)(O)CC2)c1C ZINC000882057421 591292933 /nfs/dbraw/zinc/29/29/33/591292933.db2.gz BPPUVXPNEHVOHN-UHFFFAOYSA-N 1 2 235.331 2.199 20 0 BEADLO Cc1[nH+]cnc(N(C)CCC2CCOCC2)c1C ZINC000882082267 591294744 /nfs/dbraw/zinc/29/47/44/591294744.db2.gz KYGDYHQZPQHBAO-UHFFFAOYSA-N 1 2 249.358 2.346 20 0 BEADLO CO[C@@H]1CCC[C@H]1CNc1nc[nH+]c(C)c1C ZINC000882159548 591309146 /nfs/dbraw/zinc/30/91/46/591309146.db2.gz CBBKHKCWOPUHPT-NWDGAFQWSA-N 1 2 235.331 2.320 20 0 BEADLO CC[C@](C)(CNc1nc[nH+]c(C)c1C)OC ZINC000882417554 591345486 /nfs/dbraw/zinc/34/54/86/591345486.db2.gz YLBNZHDADLAKGS-GFCCVEGCSA-N 1 2 223.320 2.320 20 0 BEADLO Cc1cnc(C)c(N[C@H]2C[C@@H](C)n3cc[nH+]c32)n1 ZINC000882426596 591346402 /nfs/dbraw/zinc/34/64/02/591346402.db2.gz NBATXDMUWAAUSG-KOLCDFICSA-N 1 2 243.314 2.408 20 0 BEADLO Cc1ncnc(N[C@H]2C[C@@H](C)n3cc[nH+]c32)c1C ZINC000882426683 591346446 /nfs/dbraw/zinc/34/64/46/591346446.db2.gz PFUMMVSKLSUQOV-KCJUWKMLSA-N 1 2 243.314 2.408 20 0 BEADLO Cc1[nH+]cnc(NC[C@H]2CC[C@@H](C)O2)c1C ZINC000882438461 591348985 /nfs/dbraw/zinc/34/89/85/591348985.db2.gz FRBQIANGCZWMHB-LDYMZIIASA-N 1 2 221.304 2.073 20 0 BEADLO CO[C@@H]1C[C@@H](Nc2nc[nH+]c(C)c2C)C12CCC2 ZINC000882443122 591350309 /nfs/dbraw/zinc/35/03/09/591350309.db2.gz QMQLJSSZIJXOFM-VXGBXAGGSA-N 1 2 247.342 2.463 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2CS[C@@H](C)C2)c1C ZINC000882456338 591352112 /nfs/dbraw/zinc/35/21/12/591352112.db2.gz JOPSHOSZLCGCQS-XVKPBYJWSA-N 1 2 223.345 2.399 20 0 BEADLO Cc1cc(NC2CSC2)nc(C2CC2)[nH+]1 ZINC000882625673 591402900 /nfs/dbraw/zinc/40/29/00/591402900.db2.gz MZLFLDJTLZKJJR-UHFFFAOYSA-N 1 2 221.329 2.190 20 0 BEADLO Cc1[nH+]cnc(NCC[C@@H]2CCCOC2)c1C ZINC000882649226 591406936 /nfs/dbraw/zinc/40/69/36/591406936.db2.gz XBUWYKGCDDBRAC-LBPRGKRZSA-N 1 2 235.331 2.322 20 0 BEADLO OCc1cc[nH+]c(NCC[C@H]2CCSC2)c1 ZINC000882675013 591408610 /nfs/dbraw/zinc/40/86/10/591408610.db2.gz KGCZPHIVVDBWBH-JTQLQIEISA-N 1 2 238.356 2.129 20 0 BEADLO OCc1cc[nH+]c(N[C@@H]2CCCC[C@@H]2F)c1 ZINC000882681273 591411843 /nfs/dbraw/zinc/41/18/43/591411843.db2.gz MXHJPGIDVQMIGH-WDEREUQCSA-N 1 2 224.279 2.267 20 0 BEADLO Cc1[nH+]cnc(N2CC[C@@H]3CSC[C@H]3C2)c1C ZINC000882697857 591413357 /nfs/dbraw/zinc/41/33/57/591413357.db2.gz HEIQVPRJMKHGDP-VXGBXAGGSA-N 1 2 249.383 2.283 20 0 BEADLO Fc1c[nH+]ccc1NC[C@@H]1C[C@H]2CCC[C@@H]2O1 ZINC000882715499 591419640 /nfs/dbraw/zinc/41/96/40/591419640.db2.gz DXDFXZJVRVETBG-NRUUGDAUSA-N 1 2 236.290 2.012 20 0 BEADLO COC(=O)Cc1cc[nH+]c(NC[C@@H]2C=CCC2)c1 ZINC000882756574 591430455 /nfs/dbraw/zinc/43/04/55/591430455.db2.gz HBJHBCYDCOCCES-LLVKDONJSA-N 1 2 246.310 2.175 20 0 BEADLO C1=C[C@@H](CNc2cc[nH+]c3ccncc23)CC1 ZINC000882758170 591431318 /nfs/dbraw/zinc/43/13/18/591431318.db2.gz XNTYCVBQYGJXGF-LLVKDONJSA-N 1 2 225.295 2.430 20 0 BEADLO CO[C@H]1C[C@H](CNc2cc[nH+]c(C(C)C)n2)C1 ZINC000882798431 591442645 /nfs/dbraw/zinc/44/26/45/591442645.db2.gz LTSRWFYYRZCCSG-XYPYZODXSA-N 1 2 235.331 2.437 20 0 BEADLO CC(C)c1nc(N2CC[C@H](CF)C2)cc[nH+]1 ZINC000882842170 591452047 /nfs/dbraw/zinc/45/20/47/591452047.db2.gz OYJOBCQXZWRBFC-SNVBAGLBSA-N 1 2 223.295 2.396 20 0 BEADLO CCc1cc(NC2CCC3(COC3)CC2)nc[nH+]1 ZINC000882994581 591499001 /nfs/dbraw/zinc/49/90/01/591499001.db2.gz MCLVFWRPTREODQ-UHFFFAOYSA-N 1 2 247.342 2.410 20 0 BEADLO COCC[C@H](C)O[NH+]=C(N)c1ccccc1C ZINC000883059046 591532052 /nfs/dbraw/zinc/53/20/52/591532052.db2.gz KNBXITPGSASAHC-NSHDSACASA-N 1 2 236.315 2.267 20 0 BEADLO FCC(CF)[NH2+]Cc1cccc2c1CCOC2 ZINC000883132016 591547368 /nfs/dbraw/zinc/54/73/68/591547368.db2.gz CLLFZJIZNFNYNY-UHFFFAOYSA-N 1 2 241.281 2.157 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NCc1cc(C)on1 ZINC000883135566 591548313 /nfs/dbraw/zinc/54/83/13/591548313.db2.gz HNLNPOBZXPXGPZ-JTQLQIEISA-N 1 2 234.303 2.050 20 0 BEADLO CC(C)c1c[nH]c(C[NH2+][C@H](C)c2ccnn2C)n1 ZINC000883199366 591570508 /nfs/dbraw/zinc/57/05/08/591570508.db2.gz BTKWOCKQVHINCS-SNVBAGLBSA-N 1 2 247.346 2.117 20 0 BEADLO Cc1ccc(CNCc2[nH]cc[nH+]2)c(Cl)n1 ZINC000883291554 591608389 /nfs/dbraw/zinc/60/83/89/591608389.db2.gz JNRIAAGJDHLBQK-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO Cc1ccc(C[NH2+]Cc2ncc[nH]2)c(Cl)n1 ZINC000883291554 591608392 /nfs/dbraw/zinc/60/83/92/591608392.db2.gz JNRIAAGJDHLBQK-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO CCCn1cc(CNc2c[nH+]c(C)c(C)c2)nn1 ZINC000883341806 591619952 /nfs/dbraw/zinc/61/99/52/591619952.db2.gz ZXCCMMZFAHWZCJ-UHFFFAOYSA-N 1 2 245.330 2.312 20 0 BEADLO Cc1cc(N[C@H]2CO[C@@H](C)C2)c[nH+]c1C ZINC000883341141 591620420 /nfs/dbraw/zinc/62/04/20/591620420.db2.gz JGLGUARVEAVUQX-JOYOIKCWSA-N 1 2 206.289 2.288 20 0 BEADLO Cc1cc(N[C@H]2CCO[C@H]2C)c[nH+]c1C ZINC000883341250 591620880 /nfs/dbraw/zinc/62/08/80/591620880.db2.gz LGHDVWIHLSHIMD-JQWIXIFHSA-N 1 2 206.289 2.288 20 0 BEADLO Cc1cc(N[C@H](C)c2ccc(=O)[nH]n2)c[nH+]c1C ZINC000883342595 591621158 /nfs/dbraw/zinc/62/11/58/591621158.db2.gz FIQNPFVVVTVHPC-SNVBAGLBSA-N 1 2 244.298 2.367 20 0 BEADLO CC[N@@H+]1CC[C@H]1CNCc1nc2ccccc2o1 ZINC000883358649 591629026 /nfs/dbraw/zinc/62/90/26/591629026.db2.gz OUHWDKMGKJDDIQ-NSHDSACASA-N 1 2 245.326 2.012 20 0 BEADLO CC[N@H+]1CC[C@H]1CNCc1nc2ccccc2o1 ZINC000883358649 591629030 /nfs/dbraw/zinc/62/90/30/591629030.db2.gz OUHWDKMGKJDDIQ-NSHDSACASA-N 1 2 245.326 2.012 20 0 BEADLO C[C@H]([NH2+]Cc1ccc(Cl)nc1)C(F)F ZINC000883407057 591648352 /nfs/dbraw/zinc/64/83/52/591648352.db2.gz JSRYFVKYKXFMMQ-LURJTMIESA-N 1 2 220.650 2.478 20 0 BEADLO Cc1cc2ccccc2[nH+]c1NCC[S@](C)=O ZINC000133202809 591778554 /nfs/dbraw/zinc/77/85/54/591778554.db2.gz RQJBJBCQJCLXFE-QGZVFWFLSA-N 1 2 248.351 2.334 20 0 BEADLO C[C@H]([NH2+]c1ccc(OCCO)cc1)C1CC1 ZINC000134503190 591932040 /nfs/dbraw/zinc/93/20/40/591932040.db2.gz SCGFROQMCBIQGQ-JTQLQIEISA-N 1 2 221.300 2.268 20 0 BEADLO CCc1nc(NC[C@H]2CCSC2)cc[nH+]1 ZINC000884491158 591955302 /nfs/dbraw/zinc/95/53/02/591955302.db2.gz OQGLZPQETRFDST-SECBINFHSA-N 1 2 223.345 2.204 20 0 BEADLO CCc1nc(N[C@]2(CC)CCOC2)cc[nH+]1 ZINC000884497069 591957215 /nfs/dbraw/zinc/95/72/15/591957215.db2.gz OBKIRXFHLVACQK-GFCCVEGCSA-N 1 2 221.304 2.020 20 0 BEADLO CCc1nc(N2CCC[C@@H]2[C@@H]2CCCO2)cc[nH+]1 ZINC000884499737 591957601 /nfs/dbraw/zinc/95/76/01/591957601.db2.gz MDMLXXSIGWRUIE-NEPJUHHUSA-N 1 2 247.342 2.187 20 0 BEADLO CCc1nc(N2CC(C)(CC)C2)cc[nH+]1 ZINC000884512952 591962031 /nfs/dbraw/zinc/96/20/31/591962031.db2.gz VEMCKIOOYURTEW-UHFFFAOYSA-N 1 2 205.305 2.275 20 0 BEADLO CCc1nc(NC[C@](C)(OC)C2CC2)cc[nH+]1 ZINC000884513075 591962292 /nfs/dbraw/zinc/96/22/92/591962292.db2.gz YOIRORLZQPTTRA-ZDUSSCGKSA-N 1 2 235.331 2.266 20 0 BEADLO CCc1nc(N2CCC[C@](C)(F)C2)cc[nH+]1 ZINC000884517797 591964122 /nfs/dbraw/zinc/96/41/22/591964122.db2.gz WPVGXAAWFGCOSB-LBPRGKRZSA-N 1 2 223.295 2.367 20 0 BEADLO CCc1nc(N[C@H](C)CCCCO)cc[nH+]1 ZINC000884518929 591964208 /nfs/dbraw/zinc/96/42/08/591964208.db2.gz FAFZJVKTQYMWFM-SNVBAGLBSA-N 1 2 223.320 2.002 20 0 BEADLO CCc1nc(N[C@@H]2CC23CCOCC3)cc[nH+]1 ZINC000884521715 591965237 /nfs/dbraw/zinc/96/52/37/591965237.db2.gz FEJLBUBDISFMTR-SNVBAGLBSA-N 1 2 233.315 2.020 20 0 BEADLO CCc1nc(NCCc2ncccc2C)cc[nH+]1 ZINC000884521237 591965301 /nfs/dbraw/zinc/96/53/01/591965301.db2.gz QZRXIQWJDQQXPT-UHFFFAOYSA-N 1 2 242.326 2.397 20 0 BEADLO CCc1nc(N[C@H](C)[C@H](OC)C2CC2)cc[nH+]1 ZINC000884524473 591965666 /nfs/dbraw/zinc/96/56/66/591965666.db2.gz YPJOLFQFUIVUHM-RNCFNFMXSA-N 1 2 235.331 2.264 20 0 BEADLO CCc1nc(N[C@@H](C)c2nccn2CC)cc[nH+]1 ZINC000884523151 591965833 /nfs/dbraw/zinc/96/58/33/591965833.db2.gz QXGIODZQWWETRC-JTQLQIEISA-N 1 2 245.330 2.429 20 0 BEADLO CCO[C@H]1C[C@@H](Nc2cc[nH+]c(CC)n2)C1 ZINC000884527582 591966380 /nfs/dbraw/zinc/96/63/80/591966380.db2.gz UYVNGEJUAXAGJC-AOOOYVTPSA-N 1 2 221.304 2.018 20 0 BEADLO CCc1nc(N[C@@H]2C[C@@H](OC)C23CCC3)cc[nH+]1 ZINC000884528678 591967727 /nfs/dbraw/zinc/96/77/27/591967727.db2.gz WHLIYOGWWOKMHV-GHMZBOCLSA-N 1 2 247.342 2.409 20 0 BEADLO CCc1nc(NCc2cnc(Cl)cn2)cc[nH+]1 ZINC000884528853 591968158 /nfs/dbraw/zinc/96/81/58/591968158.db2.gz ZTLNFGIGBHKAKG-UHFFFAOYSA-N 1 2 249.705 2.095 20 0 BEADLO CCc1nc(N[C@@H]2CS[C@H](C)C2)cc[nH+]1 ZINC000884530747 591968525 /nfs/dbraw/zinc/96/85/25/591968525.db2.gz SKVRNFRTHIOAGP-BDAKNGLRSA-N 1 2 223.345 2.345 20 0 BEADLO CCc1nc(N2C[C@@H](CC)O[C@@H](CC)C2)cc[nH+]1 ZINC000884534031 591969907 /nfs/dbraw/zinc/96/99/07/591969907.db2.gz XCFIJZNHIGQOOR-TXEJJXNPSA-N 1 2 249.358 2.433 20 0 BEADLO CCc1nc(N[C@@H]2CCS[C@H]2C)cc[nH+]1 ZINC000884543999 591973570 /nfs/dbraw/zinc/97/35/70/591973570.db2.gz SYSJTQRLBHWLCD-DTWKUNHWSA-N 1 2 223.345 2.345 20 0 BEADLO CCC[C@H](C)[C@@H](CO)Nc1cc[nH+]c(CC)n1 ZINC000884544772 591973594 /nfs/dbraw/zinc/97/35/94/591973594.db2.gz PCBZIWUKONSHQL-WDEREUQCSA-N 1 2 237.347 2.248 20 0 BEADLO CCc1nc(N2CCCC[C@H]2[C@@H](C)CO)cc[nH+]1 ZINC000884555734 591977944 /nfs/dbraw/zinc/97/79/44/591977944.db2.gz YHXPCXXSJPZERP-RYUDHWBXSA-N 1 2 249.358 2.026 20 0 BEADLO CCc1nc(NCC(O)(C2CC2)C2CC2)cc[nH+]1 ZINC000884558047 591979566 /nfs/dbraw/zinc/97/95/66/591979566.db2.gz IDTONJUJZPWLRM-UHFFFAOYSA-N 1 2 247.342 2.002 20 0 BEADLO CCc1nc(N[C@@]23C[C@@H]2COC3(C)C)cc[nH+]1 ZINC000884564047 591981325 /nfs/dbraw/zinc/98/13/25/591981325.db2.gz WJOUBEKSGGVGQP-RNCFNFMXSA-N 1 2 233.315 2.018 20 0 BEADLO CCc1nc(N[C@@H]2C[C@H](C)O[C@H]2C)cc[nH+]1 ZINC000884570712 591982215 /nfs/dbraw/zinc/98/22/15/591982215.db2.gz WQIOLNLCQUOGSL-LPEHRKFASA-N 1 2 221.304 2.017 20 0 BEADLO CCc1nc(NCc2cccnc2C)cc[nH+]1 ZINC000884565495 591982759 /nfs/dbraw/zinc/98/27/59/591982759.db2.gz LENUMJHLMQPPKW-UHFFFAOYSA-N 1 2 228.299 2.355 20 0 BEADLO CCc1nc(N[C@@H](CC)C[C@H](C)O)cc[nH+]1 ZINC000884575927 591985309 /nfs/dbraw/zinc/98/53/09/591985309.db2.gz WDRALJXMHAESJL-UWVGGRQHSA-N 1 2 223.320 2.000 20 0 BEADLO CCOC1CC2(C[C@@H]2Nc2cc[nH+]c(CC)n2)C1 ZINC000884579876 591985761 /nfs/dbraw/zinc/98/57/61/591985761.db2.gz KUWRNBLZKFTYJS-CVZZAPKMSA-N 1 2 247.342 2.409 20 0 BEADLO CCc1nc(NC[C@H]2C=CCC2)cc[nH+]1 ZINC000884581283 591986701 /nfs/dbraw/zinc/98/67/01/591986701.db2.gz YUEXTDMQODJIOW-JTQLQIEISA-N 1 2 203.289 2.417 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1CC2(CCC2)CO1 ZINC000884659927 592006009 /nfs/dbraw/zinc/00/60/09/592006009.db2.gz HECORPFJODSUKE-NSHDSACASA-N 1 2 248.326 2.461 20 0 BEADLO Cc1nc(NC[C@@H]2CC3(CCC3)CO2)cc[nH+]1 ZINC000884663555 592007489 /nfs/dbraw/zinc/00/74/89/592007489.db2.gz POZLAWKNPMYMRN-NSHDSACASA-N 1 2 233.315 2.156 20 0 BEADLO CCc1ccc(C(=O)NCCc2[nH]cc[nH+]2)s1 ZINC000135486493 592014989 /nfs/dbraw/zinc/01/49/89/592014989.db2.gz FTVBAUDUCJTXTF-UHFFFAOYSA-N 1 2 249.339 2.006 20 0 BEADLO CC[C@]1(C)C[N@H+](C/C=C/Cl)CCO1 ZINC000135600495 592024300 /nfs/dbraw/zinc/02/43/00/592024300.db2.gz STKLBFSYGTXXFN-ORAHPGNNSA-N 1 2 203.713 2.240 20 0 BEADLO CC[C@]1(C)C[N@@H+](C/C=C/Cl)CCO1 ZINC000135600495 592024303 /nfs/dbraw/zinc/02/43/03/592024303.db2.gz STKLBFSYGTXXFN-ORAHPGNNSA-N 1 2 203.713 2.240 20 0 BEADLO C[N@@H+](Cc1ccon1)C[C@H]1CC[C@H](C2CC2)O1 ZINC000886019515 592133084 /nfs/dbraw/zinc/13/30/84/592133084.db2.gz WFVNTZXFJWEZBF-CHWSQXEVSA-N 1 2 236.315 2.064 20 0 BEADLO C[N@H+](Cc1ccon1)C[C@H]1CC[C@H](C2CC2)O1 ZINC000886019515 592133086 /nfs/dbraw/zinc/13/30/86/592133086.db2.gz WFVNTZXFJWEZBF-CHWSQXEVSA-N 1 2 236.315 2.064 20 0 BEADLO C[N@@H+](Cc1ccon1)C[C@H]1CC[C@@H](C2CC2)O1 ZINC000886019516 592133353 /nfs/dbraw/zinc/13/33/53/592133353.db2.gz WFVNTZXFJWEZBF-OLZOCXBDSA-N 1 2 236.315 2.064 20 0 BEADLO C[N@H+](Cc1ccon1)C[C@H]1CC[C@@H](C2CC2)O1 ZINC000886019516 592133356 /nfs/dbraw/zinc/13/33/56/592133356.db2.gz WFVNTZXFJWEZBF-OLZOCXBDSA-N 1 2 236.315 2.064 20 0 BEADLO Cc1coc(C[NH2+][C@@H]2CCCc3c[nH]nc32)c1 ZINC000886022684 592134750 /nfs/dbraw/zinc/13/47/50/592134750.db2.gz IHKIEVFPLWCODN-GFCCVEGCSA-N 1 2 231.299 2.478 20 0 BEADLO OCC(F)(F)C[NH2+]C/C=C/c1cccc(F)c1 ZINC000886068040 592143192 /nfs/dbraw/zinc/14/31/92/592143192.db2.gz REFDSSDVBZSSJI-DUXPYHPUSA-N 1 2 245.244 2.056 20 0 BEADLO Cc1n[nH]c(C[NH2+][C@@H]2CCCC2(F)F)c1C ZINC000886116987 592154425 /nfs/dbraw/zinc/15/44/25/592154425.db2.gz WUBADZUIUBVZGA-SNVBAGLBSA-N 1 2 229.274 2.304 20 0 BEADLO Cc1coc(C[NH2+][C@H](c2nncn2C)C(C)C)c1 ZINC000886114142 592156083 /nfs/dbraw/zinc/15/60/83/592156083.db2.gz HVMZKKWKINVQDU-LBPRGKRZSA-N 1 2 248.330 2.203 20 0 BEADLO CCc1nc(C[NH2+]Cc2cc(C)co2)co1 ZINC000886136626 592161061 /nfs/dbraw/zinc/16/10/61/592161061.db2.gz SKPIKCSGVMACPV-UHFFFAOYSA-N 1 2 220.272 2.428 20 0 BEADLO Cc1[nH]nc(NCc2[nH+]ccn2C(C)C)c1C ZINC000886198130 592173940 /nfs/dbraw/zinc/17/39/40/592173940.db2.gz ZBCTVSBCBKLXBC-UHFFFAOYSA-N 1 2 233.319 2.416 20 0 BEADLO c1nc2c([nH]1)C[N@H+](CCOC1CCCCC1)CC2 ZINC000886211112 592177475 /nfs/dbraw/zinc/17/74/75/592177475.db2.gz JIDBEPKKYFWZJX-UHFFFAOYSA-N 1 2 249.358 2.117 20 0 BEADLO c1nc2c([nH]1)C[N@@H+](CCOC1CCCCC1)CC2 ZINC000886211112 592177477 /nfs/dbraw/zinc/17/74/77/592177477.db2.gz JIDBEPKKYFWZJX-UHFFFAOYSA-N 1 2 249.358 2.117 20 0 BEADLO C[C@@H]([NH2+]Cc1ccc(CO)cc1)c1ncco1 ZINC000886272305 592192646 /nfs/dbraw/zinc/19/26/46/592192646.db2.gz MMWLVNJMWUXITK-SNVBAGLBSA-N 1 2 232.283 2.018 20 0 BEADLO Cc1ncsc1C[NH2+][C@@H](C)c1ncco1 ZINC000886274055 592193616 /nfs/dbraw/zinc/19/36/16/592193616.db2.gz LPBWHXLUFJAQAC-QMMMGPOBSA-N 1 2 223.301 2.290 20 0 BEADLO C[C@@H]([NH2+]Cc1cccc2c1OCO2)c1ncco1 ZINC000886274098 592193671 /nfs/dbraw/zinc/19/36/71/592193671.db2.gz MKXYHADCSQTNKI-SECBINFHSA-N 1 2 246.266 2.254 20 0 BEADLO C[N@H+](CCSC(F)(F)F)Cc1cnc[nH]1 ZINC000886273657 592194055 /nfs/dbraw/zinc/19/40/55/592194055.db2.gz DGBAPEPAQIOFLG-UHFFFAOYSA-N 1 2 239.266 2.095 20 0 BEADLO C[N@@H+](CCSC(F)(F)F)Cc1cnc[nH]1 ZINC000886273657 592194057 /nfs/dbraw/zinc/19/40/57/592194057.db2.gz DGBAPEPAQIOFLG-UHFFFAOYSA-N 1 2 239.266 2.095 20 0 BEADLO C[N@H+](CCSC(F)(F)F)Cc1c[nH]cn1 ZINC000886273657 592194058 /nfs/dbraw/zinc/19/40/58/592194058.db2.gz DGBAPEPAQIOFLG-UHFFFAOYSA-N 1 2 239.266 2.095 20 0 BEADLO C[N@@H+](CCSC(F)(F)F)Cc1c[nH]cn1 ZINC000886273657 592194060 /nfs/dbraw/zinc/19/40/60/592194060.db2.gz DGBAPEPAQIOFLG-UHFFFAOYSA-N 1 2 239.266 2.095 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2ncco2)o1 ZINC000886275735 592195473 /nfs/dbraw/zinc/19/54/73/592195473.db2.gz KNNFXJYSDVVXDI-VIFPVBQESA-N 1 2 206.245 2.427 20 0 BEADLO COc1cccc(NCc2[nH]cc[nH+]2)c1OC ZINC000886275524 592195731 /nfs/dbraw/zinc/19/57/31/592195731.db2.gz CBKRDFNMVBDEGD-UHFFFAOYSA-N 1 2 233.271 2.039 20 0 BEADLO CO[C@@H](C)c1nc(C[N@@H+]2C[C@@H]3C[C@@H]3C2)cs1 ZINC000886336710 592211833 /nfs/dbraw/zinc/21/18/33/592211833.db2.gz VRRDZAUBHLGJMU-LPEHRKFASA-N 1 2 238.356 2.302 20 0 BEADLO CO[C@@H](C)c1nc(C[N@H+]2C[C@@H]3C[C@@H]3C2)cs1 ZINC000886336710 592211835 /nfs/dbraw/zinc/21/18/35/592211835.db2.gz VRRDZAUBHLGJMU-LPEHRKFASA-N 1 2 238.356 2.302 20 0 BEADLO O=C(CCCn1cc[nH+]c1)OCc1ccccc1 ZINC000137801268 592222145 /nfs/dbraw/zinc/22/21/45/592222145.db2.gz STVLWOPMFLLWLA-UHFFFAOYSA-N 1 2 244.294 2.407 20 0 BEADLO Cc1ccccc1[C@H](CO)[N@H+](C)Cc1ccon1 ZINC000886434006 592226015 /nfs/dbraw/zinc/22/60/15/592226015.db2.gz ZOEQKFMNPYZOKZ-AWEZNQCLSA-N 1 2 246.310 2.148 20 0 BEADLO Cc1ccccc1[C@H](CO)[N@@H+](C)Cc1ccon1 ZINC000886434006 592226016 /nfs/dbraw/zinc/22/60/16/592226016.db2.gz ZOEQKFMNPYZOKZ-AWEZNQCLSA-N 1 2 246.310 2.148 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ccccn1)c1ncco1 ZINC000886536227 592250857 /nfs/dbraw/zinc/25/08/57/592250857.db2.gz DHJYFWDNCOCPLL-NXEZZACHSA-N 1 2 217.272 2.481 20 0 BEADLO CCCCCC(=O)N1CCc2c([nH+]cn2CC)C1 ZINC000886625869 592281202 /nfs/dbraw/zinc/28/12/02/592281202.db2.gz DDFNTWBOKCHCQV-UHFFFAOYSA-N 1 2 249.358 2.368 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@@H]1CC2(CCC2)CO1 ZINC000886701752 592307003 /nfs/dbraw/zinc/30/70/03/592307003.db2.gz VJGYKYPVKPYIJG-JQWIXIFHSA-N 1 2 249.358 2.328 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@H]1CC2(CCC2)CO1 ZINC000886701751 592307107 /nfs/dbraw/zinc/30/71/07/592307107.db2.gz VJGYKYPVKPYIJG-CMPLNLGQSA-N 1 2 249.358 2.328 20 0 BEADLO O=C(C1CCCC1)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000075556045 592312870 /nfs/dbraw/zinc/31/28/70/592312870.db2.gz XHZUSSDXRYJISF-LBPRGKRZSA-N 1 2 247.342 2.306 20 0 BEADLO FC(F)C[N@@H+](C[C@H]1CCCO1)C1CCC1 ZINC000887098869 592440886 /nfs/dbraw/zinc/44/08/86/592440886.db2.gz FNXJVBAXRTZKPC-SNVBAGLBSA-N 1 2 219.275 2.285 20 0 BEADLO FC(F)C[N@H+](C[C@H]1CCCO1)C1CCC1 ZINC000887098869 592440884 /nfs/dbraw/zinc/44/08/84/592440884.db2.gz FNXJVBAXRTZKPC-SNVBAGLBSA-N 1 2 219.275 2.285 20 0 BEADLO O=C1OCC[C@H]1CC[N@@H+](CC(F)F)C1CCC1 ZINC000887100962 592441453 /nfs/dbraw/zinc/44/14/53/592441453.db2.gz ZFIPKOINKWXMKX-SECBINFHSA-N 1 2 247.285 2.059 20 0 BEADLO O=C1OCC[C@H]1CC[N@H+](CC(F)F)C1CCC1 ZINC000887100962 592441457 /nfs/dbraw/zinc/44/14/57/592441457.db2.gz ZFIPKOINKWXMKX-SECBINFHSA-N 1 2 247.285 2.059 20 0 BEADLO CSCC[N@H+](CC(F)F)C1CCC1 ZINC000887098821 592441835 /nfs/dbraw/zinc/44/18/35/592441835.db2.gz CTAKOAODRNTAKY-UHFFFAOYSA-N 1 2 209.305 2.469 20 0 BEADLO CSCC[N@@H+](CC(F)F)C1CCC1 ZINC000887098821 592441836 /nfs/dbraw/zinc/44/18/36/592441836.db2.gz CTAKOAODRNTAKY-UHFFFAOYSA-N 1 2 209.305 2.469 20 0 BEADLO C/C=C\c1cn(CCc2cccc(C)[nH+]2)nn1 ZINC000887427892 592505174 /nfs/dbraw/zinc/50/51/74/592505174.db2.gz FZFANIXVFBCBNU-HYXAFXHYSA-N 1 2 228.299 2.257 20 0 BEADLO C[C@@H](NCc1ncc(Cl)s1)c1[nH]cc[nH+]1 ZINC000223053207 592515469 /nfs/dbraw/zinc/51/54/69/592515469.db2.gz QUVBTUTWLFKYSD-ZCFIWIBFSA-N 1 2 242.735 2.370 20 0 BEADLO CCc1cnc(NC(=O)C[C@@H](C)n2cc[nH+]c2)o1 ZINC000889385528 592604137 /nfs/dbraw/zinc/60/41/37/592604137.db2.gz WLFQEPKZZZDMRW-SECBINFHSA-N 1 2 248.286 2.023 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N1CC[C@H]1C1CCCC1 ZINC000889407128 592608868 /nfs/dbraw/zinc/60/88/68/592608868.db2.gz JTBWYJJITJXQJM-LBPRGKRZSA-N 1 2 247.342 2.133 20 0 BEADLO Cn1c[nH+]c(CNC(=O)C2=CCC(C)(C)CC2)c1 ZINC000890103809 592680013 /nfs/dbraw/zinc/68/00/13/592680013.db2.gz DGRQSNAHXOMBMQ-UHFFFAOYSA-N 1 2 247.342 2.173 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NCc2cn(C)c[nH+]2)C[C@H]1C ZINC000890106866 592681370 /nfs/dbraw/zinc/68/13/70/592681370.db2.gz HBLFCMKRULAOHR-IJLUTSLNSA-N 1 2 249.358 2.109 20 0 BEADLO CC[C@H]1CCCC[C@@H]1C(=O)NCc1cn(C)c[nH+]1 ZINC000890106484 592681440 /nfs/dbraw/zinc/68/14/40/592681440.db2.gz ALDPPCQIXNNVSS-AAEUAGOBSA-N 1 2 249.358 2.253 20 0 BEADLO CCC[C@@H]1CCC[C@H]1C(=O)NCc1cn(C)c[nH+]1 ZINC000890107808 592683239 /nfs/dbraw/zinc/68/32/39/592683239.db2.gz QXUPZRKDWHRIBQ-DGCLKSJQSA-N 1 2 249.358 2.253 20 0 BEADLO CC[C@H](CC(=O)NCc1cn(C)c[nH+]1)C(C)C ZINC000890113427 592684751 /nfs/dbraw/zinc/68/47/51/592684751.db2.gz CPUBIFCZZAHVEX-LLVKDONJSA-N 1 2 237.347 2.109 20 0 BEADLO C[C@H]1CCCC[C@H]1CC(=O)NCc1cn(C)c[nH+]1 ZINC000890114587 592685688 /nfs/dbraw/zinc/68/56/88/592685688.db2.gz QMELHMGMDCXVNV-RYUDHWBXSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1C[C@@H](C)CO1 ZINC000890492716 592702327 /nfs/dbraw/zinc/70/23/27/592702327.db2.gz PSFDQPYPVRHXIX-LDYMZIIASA-N 1 2 234.299 2.062 20 0 BEADLO Cc1cc(NCCF)nc(C2CCC2)[nH+]1 ZINC000893659433 635426998 /nfs/dbraw/zinc/42/69/98/635426998.db2.gz AMYBSRYKVFWHFA-UHFFFAOYSA-N 1 2 209.268 2.434 20 0 BEADLO CNc1cc(N[C@@H]2CC[C@H](SC)C2)[nH+]cn1 ZINC000234525405 635557136 /nfs/dbraw/zinc/55/71/36/635557136.db2.gz BAUBUIUXQNCDFA-BDAKNGLRSA-N 1 2 238.360 2.214 20 0 BEADLO C[C@H]1CCC[C@@H](C(=O)NCc2ccc(N)[nH+]c2)C1 ZINC000308392440 631253573 /nfs/dbraw/zinc/25/35/73/631253573.db2.gz OLNFZRNOXKQNFW-CMPLNLGQSA-N 1 2 247.342 2.106 20 0 BEADLO COc1ccc2ccc(NC[C@H](C)O)[nH+]c2c1 ZINC000891437662 631254668 /nfs/dbraw/zinc/25/46/68/631254668.db2.gz WCCBDMHETKNIIY-VIFPVBQESA-N 1 2 232.283 2.036 20 0 BEADLO C[C@@H]1CCCCN1c1nccn2c[nH+]cc12 ZINC000891442572 631300705 /nfs/dbraw/zinc/30/07/05/631300705.db2.gz SDALDZFBZFQJLF-SNVBAGLBSA-N 1 2 216.288 2.108 20 0 BEADLO CC[NH+](CC)Cc1c(Cl)c(C)nn1C ZINC000308519634 631324392 /nfs/dbraw/zinc/32/43/92/631324392.db2.gz WZZGGHWZLWTMIC-UHFFFAOYSA-N 1 2 215.728 2.224 20 0 BEADLO CCc1[nH]nc(Cl)c1C[NH+]1CCSCC1 ZINC000891571912 631393856 /nfs/dbraw/zinc/39/38/56/631393856.db2.gz IUKMKPTWKGVSAF-UHFFFAOYSA-N 1 2 245.779 2.174 20 0 BEADLO Cc1cccc(C)c1C[N@H+](C)Cc1cnon1 ZINC000933763967 631503589 /nfs/dbraw/zinc/50/35/89/631503589.db2.gz IIQPOSPFPUXNHP-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cccc(C)c1C[N@@H+](C)Cc1cnon1 ZINC000933763967 631503595 /nfs/dbraw/zinc/50/35/95/631503595.db2.gz IIQPOSPFPUXNHP-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Fc1cccc(/C=C\C[NH+]2CCOCC2)c1 ZINC000893867869 635633443 /nfs/dbraw/zinc/63/34/43/635633443.db2.gz VTPVSHIVKYBJQF-RQOWECAXSA-N 1 2 221.275 2.171 20 0 BEADLO Cc1nc(C[NH2+][C@H](C)c2cncs2)[nH]c1C ZINC000934196659 631727783 /nfs/dbraw/zinc/72/77/83/631727783.db2.gz WGLQKDBMLMKUGX-SECBINFHSA-N 1 2 236.344 2.334 20 0 BEADLO Cc1[nH]c(CN[C@H](C)c2cncs2)[nH+]c1C ZINC000934196659 631727788 /nfs/dbraw/zinc/72/77/88/631727788.db2.gz WGLQKDBMLMKUGX-SECBINFHSA-N 1 2 236.344 2.334 20 0 BEADLO Cc1ccc(C[N@@H+]2CC[C@H](O)[C@H](F)C2)cc1F ZINC000934569435 631939573 /nfs/dbraw/zinc/93/95/73/631939573.db2.gz YEEKVLLYJRNLEZ-OLZOCXBDSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1ccc(C[N@H+]2CC[C@H](O)[C@H](F)C2)cc1F ZINC000934569435 631939575 /nfs/dbraw/zinc/93/95/75/631939575.db2.gz YEEKVLLYJRNLEZ-OLZOCXBDSA-N 1 2 241.281 2.039 20 0 BEADLO CC[NH2+]Cc1noc(CCc2cccc(C)c2)n1 ZINC000051986483 632038688 /nfs/dbraw/zinc/03/86/88/632038688.db2.gz YPRHOWQOFBQZSB-UHFFFAOYSA-N 1 2 245.326 2.273 20 0 BEADLO C[C@@H]([NH2+][C@H]1C[C@@H](O)C1)C(F)(F)c1ccccc1 ZINC000926552060 632487408 /nfs/dbraw/zinc/48/74/08/632487408.db2.gz SJKIFCIFJSXCQB-JLLWLGSASA-N 1 2 241.281 2.280 20 0 BEADLO CC[NH2+]Cc1noc(CSC(C)(C)C)n1 ZINC000309615074 632586522 /nfs/dbraw/zinc/58/65/22/632586522.db2.gz DRBJMASKHCKDDA-UHFFFAOYSA-N 1 2 229.349 2.211 20 0 BEADLO CCOC(=O)C(C)(C)[NH2+]CCSC(C)(C)C ZINC000309658355 632625040 /nfs/dbraw/zinc/62/50/40/632625040.db2.gz QPWIEGFRVCTZKN-UHFFFAOYSA-N 1 2 247.404 2.449 20 0 BEADLO O=Cc1c[nH]nc1C=Cc1cccc2[nH+]ccn21 ZINC000255622344 632657928 /nfs/dbraw/zinc/65/79/28/632657928.db2.gz FWAGVRREVRQVIO-PLNGDYQASA-N 1 2 238.250 2.040 20 0 BEADLO Cc1cccc(F)c1C[NH2+]Cc1cc[nH]n1 ZINC000309725186 632661387 /nfs/dbraw/zinc/66/13/87/632661387.db2.gz XPEVOONZGKVMMN-UHFFFAOYSA-N 1 2 219.263 2.147 20 0 BEADLO C[C@H]([NH2+]C[C@H]1CCN1C(C)(C)C)c1ncco1 ZINC000926670894 632799353 /nfs/dbraw/zinc/79/93/53/632799353.db2.gz GJKIXTAEYRJTQD-WDEREUQCSA-N 1 2 237.347 2.198 20 0 BEADLO C[Si](C)(C)c1ccc(Cn2cc[nH+]c2)cc1 ZINC000235744893 632824887 /nfs/dbraw/zinc/82/48/87/632824887.db2.gz GHWPIULQQLVUTD-UHFFFAOYSA-N 1 2 230.387 2.477 20 0 BEADLO Cn1cc[nH+]c1Cn1nc(Cl)c2ccccc21 ZINC000163766203 633063188 /nfs/dbraw/zinc/06/31/88/633063188.db2.gz XAZALOAOAIEOCH-UHFFFAOYSA-N 1 2 246.701 2.472 20 0 BEADLO C[N@H+](Cc1cnon1)[C@H]1CCc2ccccc21 ZINC000851724891 633170387 /nfs/dbraw/zinc/17/03/87/633170387.db2.gz LLDVORBDZJVCCM-ZDUSSCGKSA-N 1 2 229.283 2.189 20 0 BEADLO C[N@@H+](Cc1cnon1)[C@H]1CCc2ccccc21 ZINC000851724891 633170394 /nfs/dbraw/zinc/17/03/94/633170394.db2.gz LLDVORBDZJVCCM-ZDUSSCGKSA-N 1 2 229.283 2.189 20 0 BEADLO CC[C@]1(C)CCN(c2nccn3c[nH+]cc23)C1 ZINC000892899876 633241069 /nfs/dbraw/zinc/24/10/69/633241069.db2.gz IWJQKIKAQCWRIV-CYBMUJFWSA-N 1 2 230.315 2.356 20 0 BEADLO CC[C@@]1(C)CCN(c2nccn3c[nH+]cc23)C1 ZINC000892899880 633242068 /nfs/dbraw/zinc/24/20/68/633242068.db2.gz IWJQKIKAQCWRIV-ZDUSSCGKSA-N 1 2 230.315 2.356 20 0 BEADLO Cc1ccc(O)c(C[NH+]2CC(C(F)(F)F)C2)n1 ZINC000894891713 636000333 /nfs/dbraw/zinc/00/03/33/636000333.db2.gz DOLRDDMLYSGQFD-UHFFFAOYSA-N 1 2 246.232 2.090 20 0 BEADLO FC(F)C(F)(F)C[NH2+]C1(C2CC2)CC1 ZINC000308514517 633742877 /nfs/dbraw/zinc/74/28/77/633742877.db2.gz MIAXZKBOHQLFLB-UHFFFAOYSA-N 1 2 211.202 2.419 20 0 BEADLO CC1(C)OCC[C@H]1[NH2+]CC(F)(F)C(F)F ZINC000328411942 633762910 /nfs/dbraw/zinc/76/29/10/633762910.db2.gz HHFGEZQWPLCXMQ-ZCFIWIBFSA-N 1 2 229.217 2.044 20 0 BEADLO Cc1ccc(OC[C@@H](C)[NH2+]Cc2ccn[nH]2)cc1 ZINC000040499578 633814861 /nfs/dbraw/zinc/81/48/61/633814861.db2.gz PSMVAXVTNVDRFU-GFCCVEGCSA-N 1 2 245.326 2.275 20 0 BEADLO CCC[C@H](C)Cc1nc(C[NH2+]CC)no1 ZINC000309848063 634030113 /nfs/dbraw/zinc/03/01/13/634030113.db2.gz VSWWLYYZBOLCKB-VIFPVBQESA-N 1 2 211.309 2.158 20 0 BEADLO CN(C)c1cc[nH+]c(CNc2nccs2)c1 ZINC000895472909 636147915 /nfs/dbraw/zinc/14/79/15/636147915.db2.gz CERNICWEIMSJKB-UHFFFAOYSA-N 1 2 234.328 2.216 20 0 BEADLO Cc1c(Cl)c(C[N@@H+]2CC[C@@H](CF)C2)nn1C ZINC000895567788 636158418 /nfs/dbraw/zinc/15/84/18/636158418.db2.gz KUQYGILGYGUSOS-VIFPVBQESA-N 1 2 245.729 2.173 20 0 BEADLO Cc1c(Cl)c(C[N@H+]2CC[C@@H](CF)C2)nn1C ZINC000895567788 636158419 /nfs/dbraw/zinc/15/84/19/636158419.db2.gz KUQYGILGYGUSOS-VIFPVBQESA-N 1 2 245.729 2.173 20 0 BEADLO CC[C@@](C)([NH2+]CCSC(C)(C)C)C(=O)OC ZINC000310008774 634062786 /nfs/dbraw/zinc/06/27/86/634062786.db2.gz HWKUWBYYSUXMBW-GFCCVEGCSA-N 1 2 247.404 2.449 20 0 BEADLO CC1(C)C[C@H]1C(=O)NNc1cc[nH+]cc1Cl ZINC000162414152 634135146 /nfs/dbraw/zinc/13/51/46/634135146.db2.gz KJGNEZRCIQQXDS-ZETCQYMHSA-N 1 2 239.706 2.224 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc(F)nc2)CC(C)(C)O1 ZINC000189307184 634177605 /nfs/dbraw/zinc/17/76/05/634177605.db2.gz SMHWBGSMYCZZGK-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc(F)nc2)CC(C)(C)O1 ZINC000189307184 634177607 /nfs/dbraw/zinc/17/76/07/634177607.db2.gz SMHWBGSMYCZZGK-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO CCO[C@@H]1C[C@H]([NH2+][C@H](C)C(F)F)[C@H]1SC ZINC000895725749 636174214 /nfs/dbraw/zinc/17/42/14/636174214.db2.gz SMBDMJNOEZOKOR-BZNPZCIMSA-N 1 2 239.331 2.139 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2cnccn2)nc1C ZINC000314346307 635171595 /nfs/dbraw/zinc/17/15/95/635171595.db2.gz VPTFPEQYEGWSMB-LBPRGKRZSA-N 1 2 242.326 2.339 20 0 BEADLO Cn1ccc2c1nccc2-c1cc[nH+]c(N)c1 ZINC000072148858 635309858 /nfs/dbraw/zinc/30/98/58/635309858.db2.gz NKNKUCZCWSLSFD-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO CC(C)c1ccc(NC(=O)Cc2c[nH]c[nH+]2)cn1 ZINC000928623826 636213358 /nfs/dbraw/zinc/21/33/58/636213358.db2.gz MZCPANFWPURGQP-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H]2CCC[C@H]3C[C@H]32)[nH+]c1C ZINC000896908136 636251628 /nfs/dbraw/zinc/25/16/28/636251628.db2.gz WNZLULCRJHJZEL-QJPTWQEYSA-N 1 2 247.342 2.079 20 0 BEADLO C[C@H]1CCCC[C@]1(C)NC(=O)Cc1c[nH]c[nH+]1 ZINC000909566633 636255589 /nfs/dbraw/zinc/25/55/89/636255589.db2.gz IZHIHPRAZHOSLQ-GWCFXTLKSA-N 1 2 235.331 2.037 20 0 BEADLO CC1(C)CC(O[NH+]=C(N)Cc2cccnc2)C1 ZINC000871737261 636488717 /nfs/dbraw/zinc/48/87/17/636488717.db2.gz CDFBYFMZRLEFDU-UHFFFAOYSA-N 1 2 233.315 2.311 20 0 BEADLO O=C(OCCn1cc[nH+]c1)C1CCCCC1 ZINC000090624358 636650594 /nfs/dbraw/zinc/65/05/94/636650594.db2.gz BITIVYUNLYNIOR-UHFFFAOYSA-N 1 2 222.288 2.007 20 0 BEADLO Cl/C=C/CNc1cc(NCC2CC2)[nH+]cn1 ZINC000897506240 636730436 /nfs/dbraw/zinc/73/04/36/636730436.db2.gz XAQBADUMUFTHNM-DAFODLJHSA-N 1 2 238.722 2.463 20 0 BEADLO Cl/C=C/CNc1cc(NCC2CC2)nc[nH+]1 ZINC000897506240 636730443 /nfs/dbraw/zinc/73/04/43/636730443.db2.gz XAQBADUMUFTHNM-DAFODLJHSA-N 1 2 238.722 2.463 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)c1ccc2c(c1)OCO2 ZINC000067647689 636758507 /nfs/dbraw/zinc/75/85/07/636758507.db2.gz ZGYMSYIFPPNATR-DUXPYHPUSA-N 1 2 242.234 2.035 20 0 BEADLO CC(C)OCCCc1noc([C@@H](C)[NH+](C)C)n1 ZINC000923909974 636860698 /nfs/dbraw/zinc/86/06/98/636860698.db2.gz WTWCSHGXYYFNLB-SNVBAGLBSA-N 1 2 241.335 2.050 20 0 BEADLO CCc1onc(C)c1C[N@@H+]1C[C@@H](C)OC[C@H]1C ZINC000929183358 636920258 /nfs/dbraw/zinc/92/02/58/636920258.db2.gz UOVAJKVFCBTFMH-NXEZZACHSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1onc(C)c1C[N@H+]1C[C@@H](C)OC[C@H]1C ZINC000929183358 636920260 /nfs/dbraw/zinc/92/02/60/636920260.db2.gz UOVAJKVFCBTFMH-NXEZZACHSA-N 1 2 238.331 2.155 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+][C@@H](C)CCc1ccco1 ZINC000042322092 637174781 /nfs/dbraw/zinc/17/47/81/637174781.db2.gz NUINMPQUYGZFCI-WDEREUQCSA-N 1 2 239.315 2.142 20 0 BEADLO C[C@H]1CC[C@H](C)N(C(=O)CNc2cccc[nH+]2)C1 ZINC000900903423 637195355 /nfs/dbraw/zinc/19/53/55/637195355.db2.gz HWASMPOUHXZRRR-RYUDHWBXSA-N 1 2 247.342 2.141 20 0 BEADLO CC[C@H]1C[C@@H](C)CN1C(=O)CNc1cccc[nH+]1 ZINC000900908473 637204140 /nfs/dbraw/zinc/20/41/40/637204140.db2.gz HYPRIXFTHRKYKL-NEPJUHHUSA-N 1 2 247.342 2.141 20 0 BEADLO CC[C@H](Nc1cc(NC)nc[nH+]1)C1CC1 ZINC000323675440 637279599 /nfs/dbraw/zinc/27/95/99/637279599.db2.gz CXOZGAXXZVVVNH-VIFPVBQESA-N 1 2 206.293 2.119 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1noc(CC(C)C)n1 ZINC000904272754 637394305 /nfs/dbraw/zinc/39/43/05/637394305.db2.gz IHQFYOGVJQXFRR-UHFFFAOYSA-N 1 2 232.287 2.221 20 0 BEADLO Cc1noc(-c2ccn3c(C)c[nH+]c3c2)n1 ZINC000904580123 637439962 /nfs/dbraw/zinc/43/99/62/637439962.db2.gz YDOPWVHILAYNPN-UHFFFAOYSA-N 1 2 214.228 2.001 20 0 BEADLO CN(C)c1cc(-c2c[nH+]c3n2CCCC3)ccn1 ZINC000904849456 637507491 /nfs/dbraw/zinc/50/74/91/637507491.db2.gz MAZRICLLBPGWMA-UHFFFAOYSA-N 1 2 242.326 2.347 20 0 BEADLO COc1ccc(-c2c[nH+]c(C)n2C)c(OC)c1 ZINC000904888319 637511642 /nfs/dbraw/zinc/51/16/42/637511642.db2.gz QBARZACQXOMZRE-UHFFFAOYSA-N 1 2 232.283 2.413 20 0 BEADLO Cn1c[nH+]cc1-c1ccc([C@H]2CCC(=O)N2)cc1 ZINC000905304921 637763132 /nfs/dbraw/zinc/76/31/32/637763132.db2.gz ORMBNSYZUISULS-GFCCVEGCSA-N 1 2 241.294 2.038 20 0 BEADLO Cc1cc(NCc2cnn(CCF)c2)c[nH+]c1C ZINC000905417718 637803879 /nfs/dbraw/zinc/80/38/79/637803879.db2.gz AVBOZXBSDRARFC-UHFFFAOYSA-N 1 2 248.305 2.477 20 0 BEADLO CCn1c[nH+]cc1CNc1nnc(C2CCC2)o1 ZINC000905427531 637812485 /nfs/dbraw/zinc/81/24/85/637812485.db2.gz CXYDWSOKGNKNDV-UHFFFAOYSA-N 1 2 247.302 2.166 20 0 BEADLO Cn1c2ccccc2[nH+]c1NCc1ccon1 ZINC000148960662 637815650 /nfs/dbraw/zinc/81/56/50/637815650.db2.gz NVSLMQUKLIXJGE-UHFFFAOYSA-N 1 2 228.255 2.173 20 0 BEADLO Cc1cc(C)c(C(=O)N[C@H](C)C(F)F)c(C)[nH+]1 ZINC000906135396 638071817 /nfs/dbraw/zinc/07/18/17/638071817.db2.gz YELDOMMWKJZDCS-SECBINFHSA-N 1 2 242.269 2.390 20 0 BEADLO Cc1noc(C)c1-c1c[nH+]c2c(c1)CCCN2 ZINC000906165582 638080016 /nfs/dbraw/zinc/08/00/16/638080016.db2.gz SIMXLZZTXSTXPM-UHFFFAOYSA-N 1 2 229.283 2.354 20 0 BEADLO c1cc(-c2c[nH+]c3c(c2)CCCN3)co1 ZINC000906166064 638080232 /nfs/dbraw/zinc/08/02/32/638080232.db2.gz WAONIDJZGIUYMN-UHFFFAOYSA-N 1 2 200.241 2.342 20 0 BEADLO COc1ncc(-c2c[nH]c(C)[nH+]2)cc1C ZINC000906191615 638097480 /nfs/dbraw/zinc/09/74/80/638097480.db2.gz ZLTYTIMYKMOJDV-UHFFFAOYSA-N 1 2 203.245 2.097 20 0 BEADLO Cc1cc(C)c(C(=O)N2CC[C@@H](C)C2)c(C)[nH+]1 ZINC000906495701 638174745 /nfs/dbraw/zinc/17/47/45/638174745.db2.gz WZEBLDFGXFDLRW-SECBINFHSA-N 1 2 232.327 2.489 20 0 BEADLO CCC[C@H]1CCCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC000907358631 638359559 /nfs/dbraw/zinc/35/95/59/638359559.db2.gz NYLMWRFQWHMCQY-LBPRGKRZSA-N 1 2 235.331 2.133 20 0 BEADLO CC[C@@H]1[C@H](C)CCN1C(=O)CNc1cccc[nH+]1 ZINC000907488243 638389119 /nfs/dbraw/zinc/38/91/19/638389119.db2.gz OYFCNBYDQISYLQ-VXGBXAGGSA-N 1 2 247.342 2.141 20 0 BEADLO CC1(C)CC(CNC(=O)CNc2cccc[nH+]2)C1 ZINC000907603702 638421165 /nfs/dbraw/zinc/42/11/65/638421165.db2.gz VXCRTYRPKYOZJX-UHFFFAOYSA-N 1 2 247.342 2.046 20 0 BEADLO C[C@@H]1CCC[C@H]1CNC(=O)CNc1cccc[nH+]1 ZINC000907973647 638530645 /nfs/dbraw/zinc/53/06/45/638530645.db2.gz MVNKHDMNRBTUMX-NEPJUHHUSA-N 1 2 247.342 2.046 20 0 BEADLO CCC[C@H](NC(=O)Cc1c[nH]c[nH+]1)C(C)(C)C ZINC000908686459 639044846 /nfs/dbraw/zinc/04/48/46/639044846.db2.gz ASUFSLZCZGCHOR-NSHDSACASA-N 1 2 237.347 2.283 20 0 BEADLO CNc1cc(N[C@H](C)c2cccnc2)nc[nH+]1 ZINC000129266591 639179942 /nfs/dbraw/zinc/17/99/42/639179942.db2.gz VVUOXQACACJUNR-SECBINFHSA-N 1 2 229.287 2.086 20 0 BEADLO CNc1cc(N[C@H](C)c2cccnc2)[nH+]cn1 ZINC000129266591 639179946 /nfs/dbraw/zinc/17/99/46/639179946.db2.gz VVUOXQACACJUNR-SECBINFHSA-N 1 2 229.287 2.086 20 0 BEADLO CC1=C(C(=O)OCCCc2[nH+]ccn2C)CCC1 ZINC000802790127 639231269 /nfs/dbraw/zinc/23/12/69/639231269.db2.gz ULJKRHOBGSTPMG-UHFFFAOYSA-N 1 2 248.326 2.396 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1NC(=O)CNc1cccc[nH+]1 ZINC000909903657 639264967 /nfs/dbraw/zinc/26/49/67/639264967.db2.gz RHVKBUNTAOZKHF-BXUZGUMPSA-N 1 2 247.342 2.044 20 0 BEADLO C/C(Cl)=C\C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000911169142 639594057 /nfs/dbraw/zinc/59/40/57/639594057.db2.gz TXVIVFUMBPWONE-XBXARRHUSA-N 1 2 238.718 2.457 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)N[C@@H]1CCC[C@H](C2CC2)C1 ZINC000911327864 639619797 /nfs/dbraw/zinc/61/97/97/639619797.db2.gz QXTZMVNJHMOPEY-NWDGAFQWSA-N 1 2 247.342 2.037 20 0 BEADLO CS[C@@H]1CC[N@H+](Cc2c(F)cncc2F)C1 ZINC000930611510 639820265 /nfs/dbraw/zinc/82/02/65/639820265.db2.gz VUBIJZLTUCUAEI-MRVPVSSYSA-N 1 2 244.310 2.297 20 0 BEADLO CS[C@@H]1CC[N@@H+](Cc2c(F)cncc2F)C1 ZINC000930611510 639820270 /nfs/dbraw/zinc/82/02/70/639820270.db2.gz VUBIJZLTUCUAEI-MRVPVSSYSA-N 1 2 244.310 2.297 20 0 BEADLO Cc1cc(C)nc(C[NH2+][C@H](C)c2ccn(C)n2)c1 ZINC000930704886 639870914 /nfs/dbraw/zinc/87/09/14/639870914.db2.gz OTXXQHXZWXWSPV-GFCCVEGCSA-N 1 2 244.342 2.283 20 0 BEADLO CN(C(=O)CCc1[nH]cc[nH+]1)c1ccsc1 ZINC000912004998 639920984 /nfs/dbraw/zinc/92/09/84/639920984.db2.gz YPEXQCAQPWFCAB-UHFFFAOYSA-N 1 2 235.312 2.067 20 0 BEADLO C=C/C=C/CC[NH2+][C@@]1(C)CC(C)(C)OC1=O ZINC000930876876 639966715 /nfs/dbraw/zinc/96/67/15/639966715.db2.gz ASRKINJWECOVTQ-YBJDMEARSA-N 1 2 223.316 2.193 20 0 BEADLO FCC[C@@H]1CCC[N@H+](Cc2nncs2)C1 ZINC000931014823 640017864 /nfs/dbraw/zinc/01/78/64/640017864.db2.gz IQPVLQYEMFVATL-VIFPVBQESA-N 1 2 229.324 2.110 20 0 BEADLO FCC[C@@H]1CCC[N@@H+](Cc2nncs2)C1 ZINC000931014823 640017866 /nfs/dbraw/zinc/01/78/66/640017866.db2.gz IQPVLQYEMFVATL-VIFPVBQESA-N 1 2 229.324 2.110 20 0 BEADLO CCC(C)(C)[C@H](C)NC(=O)CNc1cccc[nH+]1 ZINC000912309014 640024630 /nfs/dbraw/zinc/02/46/30/640024630.db2.gz UYJDOFJGPUJJNO-NSHDSACASA-N 1 2 249.358 2.434 20 0 BEADLO CCC(C)(C)[C@@H](C)NC(=O)CNc1cccc[nH+]1 ZINC000912309013 640024783 /nfs/dbraw/zinc/02/47/83/640024783.db2.gz UYJDOFJGPUJJNO-LLVKDONJSA-N 1 2 249.358 2.434 20 0 BEADLO CC(C)SCC[N@@H+]1CCC[C@H]1c1nnc[nH]1 ZINC000931140745 640075644 /nfs/dbraw/zinc/07/56/44/640075644.db2.gz XADIDCVRQTYWIQ-JTQLQIEISA-N 1 2 240.376 2.083 20 0 BEADLO CC(C)SCC[N@H+]1CCC[C@H]1c1nnc[nH]1 ZINC000931140745 640075649 /nfs/dbraw/zinc/07/56/49/640075649.db2.gz XADIDCVRQTYWIQ-JTQLQIEISA-N 1 2 240.376 2.083 20 0 BEADLO CC(C)=CCC[N@@H+]1CCC[C@H]1c1nnc[nH]1 ZINC000931143829 640075772 /nfs/dbraw/zinc/07/57/72/640075772.db2.gz YNWYTJKPQVYLIQ-NSHDSACASA-N 1 2 220.320 2.298 20 0 BEADLO CC(C)=CCC[N@H+]1CCC[C@H]1c1nnc[nH]1 ZINC000931143829 640075777 /nfs/dbraw/zinc/07/57/77/640075777.db2.gz YNWYTJKPQVYLIQ-NSHDSACASA-N 1 2 220.320 2.298 20 0 BEADLO C/C(=C(\F)C(=O)N[C@H]1CCn2c[nH+]cc21)C1CC1 ZINC000912585707 640122460 /nfs/dbraw/zinc/12/24/60/640122460.db2.gz ZJUDKMCFQODMSY-MJWAUXSNSA-N 1 2 249.289 2.098 20 0 BEADLO C=C/C(C)=C/CC(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000912615281 640139771 /nfs/dbraw/zinc/13/97/71/640139771.db2.gz KGYFQCZTTVFXMV-WUXMJOGZSA-N 1 2 247.342 2.257 20 0 BEADLO CCc1onc(C)c1C[N@H+](C)Cc1c[nH]nc1C ZINC000931414957 640186118 /nfs/dbraw/zinc/18/61/18/640186118.db2.gz HYJXNZJLZUBZMH-UHFFFAOYSA-N 1 2 248.330 2.209 20 0 BEADLO CCc1onc(C)c1C[N@@H+](C)Cc1c[nH]nc1C ZINC000931414957 640186122 /nfs/dbraw/zinc/18/61/22/640186122.db2.gz HYJXNZJLZUBZMH-UHFFFAOYSA-N 1 2 248.330 2.209 20 0 BEADLO Cc1ncc(C[N@@H+]2Cc3c[nH]nc3[C@@H](C)C2)s1 ZINC000931458879 640217530 /nfs/dbraw/zinc/21/75/30/640217530.db2.gz KGUUVOVFSCDKCK-QMMMGPOBSA-N 1 2 248.355 2.294 20 0 BEADLO Cc1ncc(C[N@H+]2Cc3c[nH]nc3[C@@H](C)C2)s1 ZINC000931458879 640217533 /nfs/dbraw/zinc/21/75/33/640217533.db2.gz KGUUVOVFSCDKCK-QMMMGPOBSA-N 1 2 248.355 2.294 20 0 BEADLO CC1(C)CCC[C@@H]1CCNC(=O)Cc1c[nH]c[nH+]1 ZINC000912971052 640269493 /nfs/dbraw/zinc/26/94/93/640269493.db2.gz CSSOCWCSYCHLAE-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO CCOC(=O)C[N@@H+]1CCSC[C@H]1C(C)(C)C ZINC000931590272 640282522 /nfs/dbraw/zinc/28/25/22/640282522.db2.gz NYHUQNRGZUXLCB-JTQLQIEISA-N 1 2 245.388 2.013 20 0 BEADLO CCOC(=O)C[N@H+]1CCSC[C@H]1C(C)(C)C ZINC000931590272 640282523 /nfs/dbraw/zinc/28/25/23/640282523.db2.gz NYHUQNRGZUXLCB-JTQLQIEISA-N 1 2 245.388 2.013 20 0 BEADLO C/C=C/CNC(=O)c1c(C)cc(C)[nH+]c1C ZINC000913165978 640315658 /nfs/dbraw/zinc/31/56/58/640315658.db2.gz FNKLBVVDWMPGMF-AATRIKPKSA-N 1 2 218.300 2.313 20 0 BEADLO C[C@H]1CC[N@H+](Cc2ccc(Cl)cn2)CCO1 ZINC000932336122 640478982 /nfs/dbraw/zinc/47/89/82/640478982.db2.gz PBWBTETWVKDUSH-JTQLQIEISA-N 1 2 240.734 2.346 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2ccc(Cl)cn2)CCO1 ZINC000932336122 640478988 /nfs/dbraw/zinc/47/89/88/640478988.db2.gz PBWBTETWVKDUSH-JTQLQIEISA-N 1 2 240.734 2.346 20 0 BEADLO CCCCOC(=O)[C@@H](C)[NH2+][C@@H](C)C(C)(C)OC ZINC000932368593 640501625 /nfs/dbraw/zinc/50/16/25/640501625.db2.gz HWLDJASTPAKUCK-MNOVXSKESA-N 1 2 245.363 2.121 20 0 BEADLO c1nnsc1C[NH2+][C@H](c1ccccn1)C1CC1 ZINC000932387610 640515225 /nfs/dbraw/zinc/51/52/25/640515225.db2.gz YVIUQWCAPKYYFW-LBPRGKRZSA-N 1 2 246.339 2.174 20 0 BEADLO CN(C)c1nc(C[NH2+]Cc2ccoc2)cs1 ZINC000165125476 640539805 /nfs/dbraw/zinc/53/98/05/640539805.db2.gz JASJDNQRXBIPHF-UHFFFAOYSA-N 1 2 237.328 2.092 20 0 BEADLO C[C@H](c1ccccn1)[N@@H+]1CCn2cccc2C1 ZINC000932524904 640562353 /nfs/dbraw/zinc/56/23/53/640562353.db2.gz BKAQGHGTYZXMBS-GFCCVEGCSA-N 1 2 227.311 2.460 20 0 BEADLO C[C@H](c1ccccn1)[N@H+]1CCn2cccc2C1 ZINC000932524904 640562358 /nfs/dbraw/zinc/56/23/58/640562358.db2.gz BKAQGHGTYZXMBS-GFCCVEGCSA-N 1 2 227.311 2.460 20 0 BEADLO Cc1cc(NC(=O)[C@@]2(C)C=CCC2)cc[nH+]1 ZINC000932605708 640583689 /nfs/dbraw/zinc/58/36/89/640583689.db2.gz DTJWEAMXLSPMQD-ZDUSSCGKSA-N 1 2 216.284 2.107 20 0 BEADLO CO[C@@H](C[N@@H+]1CCCC(=O)[C@H]1C)C1CCCC1 ZINC000932845175 640618244 /nfs/dbraw/zinc/61/82/44/640618244.db2.gz JBMSLWNLSYDDBH-RISCZKNCSA-N 1 2 239.359 2.245 20 0 BEADLO CO[C@@H](C[N@H+]1CCCC(=O)[C@H]1C)C1CCCC1 ZINC000932845175 640618249 /nfs/dbraw/zinc/61/82/49/640618249.db2.gz JBMSLWNLSYDDBH-RISCZKNCSA-N 1 2 239.359 2.245 20 0 BEADLO CO[C@@H](C[N@@H+]1CC(=O)CC[C@@H]1C)C1CCCC1 ZINC000932875592 640634326 /nfs/dbraw/zinc/63/43/26/640634326.db2.gz ANIAWHOXGOLXIX-FZMZJTMJSA-N 1 2 239.359 2.245 20 0 BEADLO CO[C@@H](C[N@H+]1CC(=O)CC[C@@H]1C)C1CCCC1 ZINC000932875592 640634329 /nfs/dbraw/zinc/63/43/29/640634329.db2.gz ANIAWHOXGOLXIX-FZMZJTMJSA-N 1 2 239.359 2.245 20 0 BEADLO CCO[C@H]1CC[N@@H+]([C@H](C)c2nnc(C)s2)C1 ZINC000932969859 640655772 /nfs/dbraw/zinc/65/57/72/640655772.db2.gz QZMYCLOFUXCLLR-SCZZXKLOSA-N 1 2 241.360 2.018 20 0 BEADLO CCO[C@H]1CC[N@H+]([C@H](C)c2nnc(C)s2)C1 ZINC000932969859 640655776 /nfs/dbraw/zinc/65/57/76/640655776.db2.gz QZMYCLOFUXCLLR-SCZZXKLOSA-N 1 2 241.360 2.018 20 0 BEADLO CCO[C@H]1CC[N@H+](C/C(Cl)=C/Cl)C1 ZINC000932973868 640658271 /nfs/dbraw/zinc/65/82/71/640658271.db2.gz MEAQLLZOORIHBX-RDOCRHDPSA-N 1 2 224.131 2.416 20 0 BEADLO CCO[C@H]1CC[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000932973868 640658276 /nfs/dbraw/zinc/65/82/76/640658276.db2.gz MEAQLLZOORIHBX-RDOCRHDPSA-N 1 2 224.131 2.416 20 0 BEADLO CC[N@H+](Cc1ncc(Cl)n1C)C1CC1 ZINC000045770961 640661422 /nfs/dbraw/zinc/66/14/22/640661422.db2.gz WVTCHBSRCYBUQR-UHFFFAOYSA-N 1 2 213.712 2.058 20 0 BEADLO CC[N@@H+](Cc1ncc(Cl)n1C)C1CC1 ZINC000045770961 640661427 /nfs/dbraw/zinc/66/14/27/640661427.db2.gz WVTCHBSRCYBUQR-UHFFFAOYSA-N 1 2 213.712 2.058 20 0 BEADLO C[N@H+](Cc1ccco1)Cc1ccc(Cl)nn1 ZINC000167394161 640718998 /nfs/dbraw/zinc/71/89/98/640718998.db2.gz MBRWKLJXGVCBAB-UHFFFAOYSA-N 1 2 237.690 2.355 20 0 BEADLO C[N@@H+](Cc1ccco1)Cc1ccc(Cl)nn1 ZINC000167394161 640718999 /nfs/dbraw/zinc/71/89/99/640718999.db2.gz MBRWKLJXGVCBAB-UHFFFAOYSA-N 1 2 237.690 2.355 20 0 BEADLO CC[NH+]1CC(NC(=O)c2ccccc2C(C)C)C1 ZINC001030403000 640824952 /nfs/dbraw/zinc/82/49/52/640824952.db2.gz QCCHFAUDUXXNSB-UHFFFAOYSA-N 1 2 246.354 2.244 20 0 BEADLO O[C@H](C[NH2+]CC(F)(F)c1ccccc1)C1CC1 ZINC000227901789 640852249 /nfs/dbraw/zinc/85/22/49/640852249.db2.gz UCPTVKQKGOAMJG-GFCCVEGCSA-N 1 2 241.281 2.139 20 0 BEADLO Cc1cc(N)nc(SC[Si](C)(C)C)[nH+]1 ZINC000171632393 640996477 /nfs/dbraw/zinc/99/64/77/640996477.db2.gz NGRUNOKCKAXPAU-UHFFFAOYSA-N 1 2 227.409 2.337 20 0 BEADLO CNc1cc(N2CCCC(C)(C)C2)nc[nH+]1 ZINC000087830919 641063179 /nfs/dbraw/zinc/06/31/79/641063179.db2.gz ZRCIXLACFVQJIH-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO CNc1cc(N2CCCC(C)(C)C2)[nH+]cn1 ZINC000087830919 641063186 /nfs/dbraw/zinc/06/31/86/641063186.db2.gz ZRCIXLACFVQJIH-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO CCCCC1([NH2+][C@@H](CC)C(=O)OC)CC1 ZINC000934203021 641101601 /nfs/dbraw/zinc/10/16/01/641101601.db2.gz NAYOWQAVEOEOEU-JTQLQIEISA-N 1 2 213.321 2.250 20 0 BEADLO CCCCC1([NH2+][C@H](CC)C(=O)OC)CC1 ZINC000934203022 641101956 /nfs/dbraw/zinc/10/19/56/641101956.db2.gz NAYOWQAVEOEOEU-SNVBAGLBSA-N 1 2 213.321 2.250 20 0 BEADLO c1cc(C[NH2+][C@H](c2ccncc2)C2CC2)no1 ZINC000934691247 641246964 /nfs/dbraw/zinc/24/69/64/641246964.db2.gz GXBVDKGMIJJPCI-ZDUSSCGKSA-N 1 2 229.283 2.311 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)C1(C)CC=CC1 ZINC000934912887 641301493 /nfs/dbraw/zinc/30/14/93/641301493.db2.gz QOPRJKYBUTWTPW-UHFFFAOYSA-N 1 2 247.342 2.088 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@@H](C)O[C@@H](CC)C2)o1 ZINC000929620150 641376453 /nfs/dbraw/zinc/37/64/53/641376453.db2.gz OBVJVJZVZRIMJL-MNOVXSKESA-N 1 2 238.331 2.236 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@@H](C)O[C@@H](CC)C2)o1 ZINC000929620150 641376461 /nfs/dbraw/zinc/37/64/61/641376461.db2.gz OBVJVJZVZRIMJL-MNOVXSKESA-N 1 2 238.331 2.236 20 0 BEADLO CCCCC1(C(=O)NCCc2c[nH+]cn2C)CC1 ZINC000935332115 641387104 /nfs/dbraw/zinc/38/71/04/641387104.db2.gz ZTKVOILNTZLCLN-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO CC(C)=CC[NH+]1CC(NC(=O)C2(C)CC=CC2)C1 ZINC001030895307 641407279 /nfs/dbraw/zinc/40/72/79/641407279.db2.gz HAMDISNUTBXIAH-UHFFFAOYSA-N 1 2 248.370 2.109 20 0 BEADLO CC1(C)CN(C(=O)c2cc3c[nH+]ccc3[nH]2)C1 ZINC000935715822 641467162 /nfs/dbraw/zinc/46/71/62/641467162.db2.gz NJENXZMCTVCROO-UHFFFAOYSA-N 1 2 229.283 2.045 20 0 BEADLO Cc1cc(CNc2ccc([NH+](C)C)cc2)n(C)n1 ZINC000089182737 641511847 /nfs/dbraw/zinc/51/18/47/641511847.db2.gz IZSODOZMYZJFNP-UHFFFAOYSA-N 1 2 244.342 2.407 20 0 BEADLO Cc1c(Cl)cnn1C[NH+]1CCCCC1 ZINC000156452504 641607148 /nfs/dbraw/zinc/60/71/48/641607148.db2.gz JEWOZHFLJQOQOG-UHFFFAOYSA-N 1 2 213.712 2.288 20 0 BEADLO C[C@@H](c1ccc(F)nc1)[N@H+](C)Cc1cnccn1 ZINC000929799477 641614925 /nfs/dbraw/zinc/61/49/25/641614925.db2.gz VTGBJAALJSSQKD-JTQLQIEISA-N 1 2 246.289 2.204 20 0 BEADLO C[C@@H](c1ccc(F)nc1)[N@@H+](C)Cc1cnccn1 ZINC000929799477 641614928 /nfs/dbraw/zinc/61/49/28/641614928.db2.gz VTGBJAALJSSQKD-JTQLQIEISA-N 1 2 246.289 2.204 20 0 BEADLO CCC[C@@H](C)CCNC(=O)Cc1[nH]c[nH+]c1C ZINC000914363729 641646477 /nfs/dbraw/zinc/64/64/77/641646477.db2.gz HAWLMRMVXYRUQW-SNVBAGLBSA-N 1 2 237.347 2.203 20 0 BEADLO c1nnc(C[N@@H+]2CC[C@@H]2Cc2ccccc2)s1 ZINC000929813622 641651166 /nfs/dbraw/zinc/65/11/66/641651166.db2.gz GKYNMZLRLGYRKT-GFCCVEGCSA-N 1 2 245.351 2.355 20 0 BEADLO c1nnc(C[N@H+]2CC[C@@H]2Cc2ccccc2)s1 ZINC000929813622 641651167 /nfs/dbraw/zinc/65/11/67/641651167.db2.gz GKYNMZLRLGYRKT-GFCCVEGCSA-N 1 2 245.351 2.355 20 0 BEADLO COC[C@H]([NH3+])c1nc(C2CCC(C)CC2)no1 ZINC000159340095 641677551 /nfs/dbraw/zinc/67/75/51/641677551.db2.gz XODZZHVUADOAHL-RTBKNWGFSA-N 1 2 239.319 2.010 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N1CCCCCCC1 ZINC000188845480 641770360 /nfs/dbraw/zinc/77/03/60/641770360.db2.gz JHJYQQSTEHHYMY-UHFFFAOYSA-N 1 2 235.331 2.135 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N1CCCCCCC1 ZINC000188845480 641770366 /nfs/dbraw/zinc/77/03/66/641770366.db2.gz JHJYQQSTEHHYMY-UHFFFAOYSA-N 1 2 235.331 2.135 20 0 BEADLO CC(C)N(C)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000929923146 641918314 /nfs/dbraw/zinc/91/83/14/641918314.db2.gz XFFMASXIFIICAL-UHFFFAOYSA-N 1 2 217.272 2.043 20 0 BEADLO CC[NH+]1CC(NC(=O)C2CCC(C)(C)CC2)C1 ZINC001031456740 642174974 /nfs/dbraw/zinc/17/49/74/642174974.db2.gz LUBZABNYNRWZFY-UHFFFAOYSA-N 1 2 238.375 2.023 20 0 BEADLO COC(=O)/C=C(\C)Cn1c[nH+]c(C(C)(C)C)c1 ZINC000918473840 642201718 /nfs/dbraw/zinc/20/17/18/642201718.db2.gz FNSFDRNSCGPFIM-UXBLZVDNSA-N 1 2 236.315 2.300 20 0 BEADLO CC(C)C[C@H]1C[N@H+](C)CCN1CCOC(C)C ZINC000933243458 642410147 /nfs/dbraw/zinc/41/01/47/642410147.db2.gz LAGOLVLFCGTTPY-AWEZNQCLSA-N 1 2 242.407 2.074 20 0 BEADLO CC(C)C[C@H]1C[N@@H+](C)CCN1CCOC(C)C ZINC000933243458 642410151 /nfs/dbraw/zinc/41/01/51/642410151.db2.gz LAGOLVLFCGTTPY-AWEZNQCLSA-N 1 2 242.407 2.074 20 0 BEADLO C[C@@H]1CCCC[C@H]1N(C)C(=O)CCc1c[nH]c[nH+]1 ZINC000188566381 642415685 /nfs/dbraw/zinc/41/56/85/642415685.db2.gz DMUAXHUOXBAGJV-DGCLKSJQSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H]1CCCC[C@H]1N(C)C(=O)CCc1c[nH+]c[nH]1 ZINC000188566381 642415691 /nfs/dbraw/zinc/41/56/91/642415691.db2.gz DMUAXHUOXBAGJV-DGCLKSJQSA-N 1 2 249.358 2.379 20 0 BEADLO Cc1ccc(OCC[N@@H+](C)C[C@@H](C)C#N)cc1 ZINC000070870034 642444364 /nfs/dbraw/zinc/44/43/64/642444364.db2.gz SVCJGJZKBFNEQU-ZDUSSCGKSA-N 1 2 232.327 2.465 20 0 BEADLO Cc1ccc(OCC[N@H+](C)C[C@@H](C)C#N)cc1 ZINC000070870034 642444372 /nfs/dbraw/zinc/44/43/72/642444372.db2.gz SVCJGJZKBFNEQU-ZDUSSCGKSA-N 1 2 232.327 2.465 20 0 BEADLO COc1nnc(C[N@H+](C)[C@H](C)C(C)(C)C)s1 ZINC000920258347 642465215 /nfs/dbraw/zinc/46/52/15/642465215.db2.gz MYVHXXQGHJATLT-MRVPVSSYSA-N 1 2 243.376 2.413 20 0 BEADLO COc1nnc(C[N@@H+](C)[C@H](C)C(C)(C)C)s1 ZINC000920258347 642465221 /nfs/dbraw/zinc/46/52/21/642465221.db2.gz MYVHXXQGHJATLT-MRVPVSSYSA-N 1 2 243.376 2.413 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N[C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000921380006 642605600 /nfs/dbraw/zinc/60/56/00/642605600.db2.gz ZPYNFJMOGFUFAI-SDDRHHMPSA-N 1 2 247.342 2.037 20 0 BEADLO CSCC[C@@H](C)Nc1cc[nH+]c(C)n1 ZINC000078293410 642657034 /nfs/dbraw/zinc/65/70/34/642657034.db2.gz OIRSNPYKNNDHKA-MRVPVSSYSA-N 1 2 211.334 2.339 20 0 BEADLO CO[C@H]1CCC[N@H+](C/C(Cl)=C/Cl)C1 ZINC000306365126 642740899 /nfs/dbraw/zinc/74/08/99/642740899.db2.gz GQGLYDLGZWWYNH-RDOCRHDPSA-N 1 2 224.131 2.416 20 0 BEADLO CO[C@H]1CCC[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000306365126 642740904 /nfs/dbraw/zinc/74/09/04/642740904.db2.gz GQGLYDLGZWWYNH-RDOCRHDPSA-N 1 2 224.131 2.416 20 0 BEADLO Cc1ccc(C[NH2+]Cc2nonc2C)s1 ZINC000069795134 642906563 /nfs/dbraw/zinc/90/65/63/642906563.db2.gz OEBACWSDAPLOPO-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO CCCC(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000070266095 643010141 /nfs/dbraw/zinc/01/01/41/643010141.db2.gz PFGMTODRBWWCEE-NSHDSACASA-N 1 2 237.347 2.214 20 0 BEADLO Cc1csc([C@H](C)[NH2+]Cc2cncnc2)n1 ZINC000070650051 643055164 /nfs/dbraw/zinc/05/51/64/643055164.db2.gz VHIJFOSPRQCSDJ-VIFPVBQESA-N 1 2 234.328 2.092 20 0 BEADLO C[C@@H]1CCOCC[N@@H+]1C/C(Cl)=C/Cl ZINC000306574043 643187163 /nfs/dbraw/zinc/18/71/63/643187163.db2.gz QVFDCXMGXPJTNG-WSQKDGNHSA-N 1 2 224.131 2.416 20 0 BEADLO C[C@@H]1CCOCC[N@H+]1C/C(Cl)=C/Cl ZINC000306574043 643187168 /nfs/dbraw/zinc/18/71/68/643187168.db2.gz QVFDCXMGXPJTNG-WSQKDGNHSA-N 1 2 224.131 2.416 20 0 BEADLO Cc1cc(NC(=O)C2=CCCCO2)cc[nH+]1 ZINC000073609992 643220011 /nfs/dbraw/zinc/22/00/11/643220011.db2.gz FSWRANLMZDEPJG-UHFFFAOYSA-N 1 2 218.256 2.023 20 0 BEADLO CC[N@H+](CCC#N)C[C@H](O)c1cccc(F)c1 ZINC000081514141 643229862 /nfs/dbraw/zinc/22/98/62/643229862.db2.gz QOPYBUCENOFAAO-ZDUSSCGKSA-N 1 2 236.290 2.095 20 0 BEADLO CC[N@@H+](CCC#N)C[C@H](O)c1cccc(F)c1 ZINC000081514141 643229867 /nfs/dbraw/zinc/22/98/67/643229867.db2.gz QOPYBUCENOFAAO-ZDUSSCGKSA-N 1 2 236.290 2.095 20 0 BEADLO C/C=C/C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000082275561 643291660 /nfs/dbraw/zinc/29/16/60/643291660.db2.gz MSMWAQZUBCQZHV-NSCUHMNNSA-N 1 2 227.267 2.387 20 0 BEADLO Cc1cc(C[NH2+]Cc2c[nH]cn2)ccc1F ZINC000082394044 643309548 /nfs/dbraw/zinc/30/95/48/643309548.db2.gz HZPWSECKGOJHNL-UHFFFAOYSA-N 1 2 219.263 2.147 20 0 BEADLO COC(=O)[C@@H]([NH2+]CCc1cccs1)C(C)C ZINC000082602227 643348901 /nfs/dbraw/zinc/34/89/01/643348901.db2.gz JAGRCHPHJWOJGX-NSHDSACASA-N 1 2 241.356 2.078 20 0 BEADLO Fc1cncc(F)c1C[NH+]1CCCCC1 ZINC000929237704 643765271 /nfs/dbraw/zinc/76/52/71/643765271.db2.gz KUSDSCCCADHNDA-UHFFFAOYSA-N 1 2 212.243 2.346 20 0 BEADLO O=c1cc(C[NH2+][C@@H]2CCCC2(F)F)cc[nH]1 ZINC000922128562 643867814 /nfs/dbraw/zinc/86/78/14/643867814.db2.gz IUWMSYTZYCPIHE-SECBINFHSA-N 1 2 228.242 2.065 20 0 BEADLO Nc1[nH+]cccc1COC(=O)C1CCCCC1 ZINC000922174313 643890885 /nfs/dbraw/zinc/89/08/85/643890885.db2.gz UJYNBKPJWGGAGQ-UHFFFAOYSA-N 1 2 234.299 2.287 20 0 BEADLO Nc1[nH+]cccc1COC(=O)[C@@H]1CC=CCC1 ZINC000922220376 643908235 /nfs/dbraw/zinc/90/82/35/643908235.db2.gz UINGSTHCSJMXIH-SNVBAGLBSA-N 1 2 232.283 2.063 20 0 BEADLO Nc1[nH+]cccc1COC(=O)CCC(F)(F)F ZINC000922494601 644004242 /nfs/dbraw/zinc/00/42/42/644004242.db2.gz GMHMFUGKKBZIJI-UHFFFAOYSA-N 1 2 248.204 2.050 20 0 BEADLO CC(C)=C(C)C(=O)OCc1ccc[nH+]c1N ZINC000922512167 644009783 /nfs/dbraw/zinc/00/97/83/644009783.db2.gz MZIHJMALMWYTQD-UHFFFAOYSA-N 1 2 220.272 2.063 20 0 BEADLO c1cnc([C@H]([NH2+]Cc2cccnc2)C2CC2)nc1 ZINC000922581303 644032462 /nfs/dbraw/zinc/03/24/62/644032462.db2.gz HBCKFZXTYOFLQM-CYBMUJFWSA-N 1 2 240.310 2.113 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)OCc2ccc(N)[nH+]c2)C1 ZINC000922585353 644036435 /nfs/dbraw/zinc/03/64/35/644036435.db2.gz FHELHQAZGIGKCZ-KOLCDFICSA-N 1 2 234.299 2.143 20 0 BEADLO Nc1ccc(COC(=O)C[C@H]2C=CCCC2)c[nH+]1 ZINC000922623809 644042443 /nfs/dbraw/zinc/04/24/43/644042443.db2.gz ZHHYHXKAJHNTOR-NSHDSACASA-N 1 2 246.310 2.453 20 0 BEADLO Nc1[nH+]cccc1COC(=O)CCCC1CC1 ZINC000922749434 644084717 /nfs/dbraw/zinc/08/47/17/644084717.db2.gz PDEKGTILRFVTKV-UHFFFAOYSA-N 1 2 234.299 2.287 20 0 BEADLO C[C@]1(C(=O)OCc2ccc(N)[nH+]c2)C[C@H]2C[C@H]2C1 ZINC000922765056 644089478 /nfs/dbraw/zinc/08/94/78/644089478.db2.gz QHNPRPPUKARPQL-YABSGUDNSA-N 1 2 246.310 2.143 20 0 BEADLO C[C@]1(C(=O)OCc2ccc[nH+]c2N)CC=CCC1 ZINC000922780436 644093698 /nfs/dbraw/zinc/09/36/98/644093698.db2.gz BDYNGDVFNPVHKF-AWEZNQCLSA-N 1 2 246.310 2.453 20 0 BEADLO Nc1ccc(COC(=O)[C@@H]2CC[C@H]3C[C@H]3C2)c[nH+]1 ZINC000922808726 644100838 /nfs/dbraw/zinc/10/08/38/644100838.db2.gz IFOHZOQPARECBE-TUAOUCFPSA-N 1 2 246.310 2.143 20 0 BEADLO Nc1[nH+]cccc1COC(=O)C(F)=C1CCC1 ZINC000922820108 644110407 /nfs/dbraw/zinc/11/04/07/644110407.db2.gz OIIKZVSBJGUWDA-UHFFFAOYSA-N 1 2 236.246 2.115 20 0 BEADLO OC[C@@H]1CCCC[N@@H+]1C/C(Cl)=C/Cl ZINC000086001397 644453960 /nfs/dbraw/zinc/45/39/60/644453960.db2.gz ZFTQGHTZWGNLIC-RDOCRHDPSA-N 1 2 224.131 2.152 20 0 BEADLO OC[C@@H]1CCCC[N@H+]1C/C(Cl)=C/Cl ZINC000086001397 644453965 /nfs/dbraw/zinc/45/39/65/644453965.db2.gz ZFTQGHTZWGNLIC-RDOCRHDPSA-N 1 2 224.131 2.152 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cnccn2)c(C)o1 ZINC000092591418 644661818 /nfs/dbraw/zinc/66/18/18/644661818.db2.gz OHWYBHVDCRUSJZ-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cnccn2)c(C)o1 ZINC000092591418 644661823 /nfs/dbraw/zinc/66/18/23/644661823.db2.gz OHWYBHVDCRUSJZ-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CCC(=CC(=O)N[C@@H]1CCn2cc[nH+]c2C1)CC ZINC000779212938 644710366 /nfs/dbraw/zinc/71/03/66/644710366.db2.gz AJJKLHZHHXMSNZ-GFCCVEGCSA-N 1 2 247.342 2.061 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2CC[C@H](C)C2)c(C)c[nH+]1 ZINC000782059441 644738385 /nfs/dbraw/zinc/73/83/85/644738385.db2.gz WYGYNHHYYTWDDO-CABZTGNLSA-N 1 2 247.342 2.430 20 0 BEADLO Nc1cc(COC(=O)C[C@@H]2C=CCCC2)cc[nH+]1 ZINC000792152998 644790605 /nfs/dbraw/zinc/79/06/05/644790605.db2.gz UJUGMFKABFZLGK-LLVKDONJSA-N 1 2 246.310 2.453 20 0 BEADLO Nc1cc(COC(=O)C[C@H]2C=CCCC2)cc[nH+]1 ZINC000792152999 644790773 /nfs/dbraw/zinc/79/07/73/644790773.db2.gz UJUGMFKABFZLGK-NSHDSACASA-N 1 2 246.310 2.453 20 0 BEADLO C[C@@H]1CCN(C[N@@H+]2Cc3ccccc3[C@@H]2C)C1=O ZINC000840020362 644850871 /nfs/dbraw/zinc/85/08/71/644850871.db2.gz ZSUILELLHMFBTE-NEPJUHHUSA-N 1 2 244.338 2.389 20 0 BEADLO C[C@@H]1CCN(C[N@H+]2Cc3ccccc3[C@@H]2C)C1=O ZINC000840020362 644850879 /nfs/dbraw/zinc/85/08/79/644850879.db2.gz ZSUILELLHMFBTE-NEPJUHHUSA-N 1 2 244.338 2.389 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2CC23CC3)c(N(C)C)[nH+]1 ZINC000817438897 644980921 /nfs/dbraw/zinc/98/09/21/644980921.db2.gz FLTCYLYAVDUQDL-SNVBAGLBSA-N 1 2 245.326 2.195 20 0 BEADLO CCCNC(=S)NCc1cc(C)[nH+]c(C)c1 ZINC000817560728 644988452 /nfs/dbraw/zinc/98/84/52/644988452.db2.gz PVVXACSXWGNNGN-UHFFFAOYSA-N 1 2 237.372 2.073 20 0 BEADLO Cc1nonc1[C@@H](C)[NH2+][C@@H]1CCCC[C@H]1F ZINC000926587165 645301485 /nfs/dbraw/zinc/30/14/85/645301485.db2.gz JIDJNPLHTSPRAD-SZEHBUNVSA-N 1 2 227.283 2.309 20 0 BEADLO Cc1nonc1[C@@H](C)[NH2+]Cc1cc(C)nc(C)c1 ZINC000926601087 645308724 /nfs/dbraw/zinc/30/87/24/645308724.db2.gz LVZVYXVVMOCZBW-SNVBAGLBSA-N 1 2 246.314 2.241 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cnc(C)cn2)[C@H](CC)CO1 ZINC000844386225 645326732 /nfs/dbraw/zinc/32/67/32/645326732.db2.gz HXIZJDVGVUETIA-ZIAGYGMSSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cnc(C)cn2)[C@H](CC)CO1 ZINC000844386225 645326739 /nfs/dbraw/zinc/32/67/39/645326739.db2.gz HXIZJDVGVUETIA-ZIAGYGMSSA-N 1 2 249.358 2.174 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](C)C(C)(C)CO)c1 ZINC000926658257 645338909 /nfs/dbraw/zinc/33/89/09/645338909.db2.gz CJYXAZIKZRGNKQ-JTQLQIEISA-N 1 2 238.331 2.047 20 0 BEADLO COCc1cc[nH+]c(N[C@H](C)c2ccnnc2)c1 ZINC000926659169 645341808 /nfs/dbraw/zinc/34/18/08/645341808.db2.gz FLDBNOZSJFYLKW-SNVBAGLBSA-N 1 2 244.298 2.191 20 0 BEADLO COCc1cc[nH+]c(N[C@H](C)c2cn(C)cn2)c1 ZINC000926663103 645342314 /nfs/dbraw/zinc/34/23/14/645342314.db2.gz UGHFXCKNXJYAPW-SNVBAGLBSA-N 1 2 246.314 2.135 20 0 BEADLO C[C@H](OC(=O)Cc1cn2c([nH+]1)CCCC2)C1CC1 ZINC000845447233 645361835 /nfs/dbraw/zinc/36/18/35/645361835.db2.gz BDHWLIOGBPUVBY-JTQLQIEISA-N 1 2 248.326 2.104 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@H]2C=CCC2)[nH+]1 ZINC000853799735 645498133 /nfs/dbraw/zinc/49/81/33/645498133.db2.gz KKXJYNOOFGKRQB-VIFPVBQESA-N 1 2 214.272 2.397 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H]2C=CCC2)[nH+]1 ZINC000853799725 645498487 /nfs/dbraw/zinc/49/84/87/645498487.db2.gz KKXJYNOOFGKRQB-SECBINFHSA-N 1 2 214.272 2.397 20 0 BEADLO C/C=C\C(=O)N1CCC(Nc2cccc[nH+]2)CC1 ZINC000927074229 645536305 /nfs/dbraw/zinc/53/63/05/645536305.db2.gz GMRCTLVSUFGMHB-DJWKRKHSSA-N 1 2 245.326 2.061 20 0 BEADLO CC(C)(C)c1noc([C@@H]2C[C@H]2c2c[nH]c[nH+]2)n1 ZINC000923969748 645967465 /nfs/dbraw/zinc/96/74/65/645967465.db2.gz JWIJQAQECZGLEM-HTQZYQBOSA-N 1 2 232.287 2.361 20 0 BEADLO C[C@@H](c1ccco1)c1noc([C@@H](C)[NH+](C)C)n1 ZINC000924124648 645987579 /nfs/dbraw/zinc/98/75/79/645987579.db2.gz FSAMLUNOFQOPHX-DTWKUNHWSA-N 1 2 235.287 2.437 20 0 BEADLO CC[NH+](CC)Cc1c(F)cncc1F ZINC000929204724 646004148 /nfs/dbraw/zinc/00/41/48/646004148.db2.gz LNPGWYDIQZXXRY-UHFFFAOYSA-N 1 2 200.232 2.202 20 0 BEADLO C[C@]1(C(=O)OCc2ccc(N)[nH+]c2)C=CCC1 ZINC000924414073 646033257 /nfs/dbraw/zinc/03/32/57/646033257.db2.gz YCNYVPJPGJABFY-ZDUSSCGKSA-N 1 2 232.283 2.063 20 0 BEADLO C[C@H]([NH2+]Cc1ccc2c(c1)OCO2)c1ncco1 ZINC000924538168 646056359 /nfs/dbraw/zinc/05/63/59/646056359.db2.gz TXLJOBRQKMWQSV-VIFPVBQESA-N 1 2 246.266 2.254 20 0 BEADLO COCC[NH2+][C@@H](C)C(F)(F)c1ccccc1 ZINC000924537634 646056573 /nfs/dbraw/zinc/05/65/73/646056573.db2.gz MIJQMUZHEVZZHT-JTQLQIEISA-N 1 2 229.270 2.403 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2cnn(C)n2)cc1F ZINC000924588346 646075665 /nfs/dbraw/zinc/07/56/65/646075665.db2.gz FDFPKLVGLUGRAG-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO C[N@H+](Cc1nncs1)C1Cc2ccccc2C1 ZINC000929337028 646083927 /nfs/dbraw/zinc/08/39/27/646083927.db2.gz KGNVSUHVYGKCEY-UHFFFAOYSA-N 1 2 245.351 2.137 20 0 BEADLO C[N@@H+](Cc1nncs1)C1Cc2ccccc2C1 ZINC000929337028 646083933 /nfs/dbraw/zinc/08/39/33/646083933.db2.gz KGNVSUHVYGKCEY-UHFFFAOYSA-N 1 2 245.351 2.137 20 0 BEADLO C[C@H](c1ncccn1)[N@H+](C)C[C@H]1CCCCO1 ZINC000929331342 646084707 /nfs/dbraw/zinc/08/47/07/646084707.db2.gz WQDUXVLFMKRKCP-VXGBXAGGSA-N 1 2 235.331 2.039 20 0 BEADLO C[C@H](c1ncccn1)[N@@H+](C)C[C@H]1CCCCO1 ZINC000929331342 646084712 /nfs/dbraw/zinc/08/47/12/646084712.db2.gz WQDUXVLFMKRKCP-VXGBXAGGSA-N 1 2 235.331 2.039 20 0 BEADLO Cc1nc(C[NH2+][C@H](C)c2ccnnc2)cs1 ZINC000924720944 646095916 /nfs/dbraw/zinc/09/59/16/646095916.db2.gz BYXLASPWTBBWFP-MRVPVSSYSA-N 1 2 234.328 2.092 20 0 BEADLO COc1cc([C@H](C)[NH2+]Cc2ccoc2C)on1 ZINC000924824998 646112270 /nfs/dbraw/zinc/11/22/70/646112270.db2.gz KPVLLBNHDZMFDC-QMMMGPOBSA-N 1 2 236.271 2.435 20 0 BEADLO COc1nnc(C[N@H+](C)CC(C)(C)C)s1 ZINC000929481701 646136393 /nfs/dbraw/zinc/13/63/93/646136393.db2.gz HPBIXTNFDUMJRC-UHFFFAOYSA-N 1 2 229.349 2.025 20 0 BEADLO COc1nnc(C[N@@H+](C)CC(C)(C)C)s1 ZINC000929481701 646136399 /nfs/dbraw/zinc/13/63/99/646136399.db2.gz HPBIXTNFDUMJRC-UHFFFAOYSA-N 1 2 229.349 2.025 20 0 BEADLO CC(C)c1cc(C[NH2+][C@H](C)c2ccnnc2)on1 ZINC000925068153 646174405 /nfs/dbraw/zinc/17/44/05/646174405.db2.gz TZRQNJLKVLIVLX-SNVBAGLBSA-N 1 2 246.314 2.439 20 0 BEADLO c1nnc(C[N@@H+]2CCCc3ccccc3C2)s1 ZINC000929598203 646189863 /nfs/dbraw/zinc/18/98/63/646189863.db2.gz BMAOSRXVBITDGA-UHFFFAOYSA-N 1 2 245.351 2.487 20 0 BEADLO c1nnc(C[N@H+]2CCCc3ccccc3C2)s1 ZINC000929598203 646189868 /nfs/dbraw/zinc/18/98/68/646189868.db2.gz BMAOSRXVBITDGA-UHFFFAOYSA-N 1 2 245.351 2.487 20 0 BEADLO CCc1ncc(C[N@@H+](C)Cc2cnn(CC)c2)o1 ZINC000929645727 646219650 /nfs/dbraw/zinc/21/96/50/646219650.db2.gz JWDMIAJNYYWLPY-UHFFFAOYSA-N 1 2 248.330 2.085 20 0 BEADLO CCc1ncc(C[N@H+](C)Cc2cnn(CC)c2)o1 ZINC000929645727 646219653 /nfs/dbraw/zinc/21/96/53/646219653.db2.gz JWDMIAJNYYWLPY-UHFFFAOYSA-N 1 2 248.330 2.085 20 0 BEADLO C[C@H]([N@H+](C)Cc1nncs1)C1(C)CC1 ZINC000929816681 646333935 /nfs/dbraw/zinc/33/39/35/646333935.db2.gz KVQNHZBIFOFZPP-QMMMGPOBSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@H]([N@@H+](C)Cc1nncs1)C1(C)CC1 ZINC000929816681 646333939 /nfs/dbraw/zinc/33/39/39/646333939.db2.gz KVQNHZBIFOFZPP-QMMMGPOBSA-N 1 2 211.334 2.159 20 0 BEADLO CCc1ncc(C[N@@H+]2CCOC(C)(C)[C@H]2C)o1 ZINC000929843887 646355346 /nfs/dbraw/zinc/35/53/46/646355346.db2.gz YWYHRPREOOWIJG-SNVBAGLBSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1ncc(C[N@H+]2CCOC(C)(C)[C@H]2C)o1 ZINC000929843887 646355350 /nfs/dbraw/zinc/35/53/50/646355350.db2.gz YWYHRPREOOWIJG-SNVBAGLBSA-N 1 2 238.331 2.236 20 0 BEADLO Cc1cc(C)nc(C[N@H+]2CCO[C@@H](C)[C@@H]2C)c1 ZINC000929848088 646358850 /nfs/dbraw/zinc/35/88/50/646358850.db2.gz QBUAOPXMWZGAQN-STQMWFEESA-N 1 2 234.343 2.308 20 0 BEADLO Cc1cc(C)nc(C[N@@H+]2CCO[C@@H](C)[C@@H]2C)c1 ZINC000929848088 646358855 /nfs/dbraw/zinc/35/88/55/646358855.db2.gz QBUAOPXMWZGAQN-STQMWFEESA-N 1 2 234.343 2.308 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ncco1)c1ccc[nH]1 ZINC000925646629 646386375 /nfs/dbraw/zinc/38/63/75/646386375.db2.gz VSYAIGIUOQZJNG-BDAKNGLRSA-N 1 2 205.261 2.415 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ncco1)c1ccc[nH]1 ZINC000925646631 646387273 /nfs/dbraw/zinc/38/72/73/646387273.db2.gz VSYAIGIUOQZJNG-IUCAKERBSA-N 1 2 205.261 2.415 20 0 BEADLO C[C@H](c1ccc(F)nc1)[N@@H+]1CCc2c[nH]nc2C1 ZINC000930068970 646418870 /nfs/dbraw/zinc/41/88/70/646418870.db2.gz MQQUUMVPGYPZKF-SECBINFHSA-N 1 2 246.289 2.063 20 0 BEADLO C[C@H](c1ccc(F)nc1)[N@H+]1CCc2c[nH]nc2C1 ZINC000930068970 646418876 /nfs/dbraw/zinc/41/88/76/646418876.db2.gz MQQUUMVPGYPZKF-SECBINFHSA-N 1 2 246.289 2.063 20 0 BEADLO Cc1cn(C)nc1C[N@@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000930121593 646444638 /nfs/dbraw/zinc/44/46/38/646444638.db2.gz PNUCZQXMZGQJJQ-SECBINFHSA-N 1 2 247.264 2.113 20 0 BEADLO Cc1cn(C)nc1C[N@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000930121593 646444644 /nfs/dbraw/zinc/44/46/44/646444644.db2.gz PNUCZQXMZGQJJQ-SECBINFHSA-N 1 2 247.264 2.113 20 0 BEADLO C[N@H+](CCSc1ccncc1)Cc1ncc[nH]1 ZINC000930121624 646445445 /nfs/dbraw/zinc/44/54/45/646445445.db2.gz QREAQVMYFNXZES-UHFFFAOYSA-N 1 2 248.355 2.029 20 0 BEADLO C[N@@H+](CCSc1ccncc1)Cc1ncc[nH]1 ZINC000930121624 646445450 /nfs/dbraw/zinc/44/54/50/646445450.db2.gz QREAQVMYFNXZES-UHFFFAOYSA-N 1 2 248.355 2.029 20 0 BEADLO COc1cccc([C@@H](C)[NH2+]Cc2nncs2)c1 ZINC000930190423 646484045 /nfs/dbraw/zinc/48/40/45/646484045.db2.gz OJLBBVUDGRTBLZ-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO Cc1cscc1C[NH2+][C@@H](C)c1cnn(C)n1 ZINC000926304388 646614191 /nfs/dbraw/zinc/61/41/91/646614191.db2.gz SDJGJMVXEMBXCA-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO Cc1ccc(F)c(NC(=O)C[C@@H]([NH3+])C(F)F)c1 ZINC000724738537 711609725 /nfs/dbraw/zinc/60/97/25/711609725.db2.gz HTYYCAMRHGKVKV-MRVPVSSYSA-N 1 2 246.232 2.055 20 0 BEADLO Cc1ccc(NC(=O)C[C@H]([NH3+])C(F)F)c(F)c1 ZINC000724740893 711609849 /nfs/dbraw/zinc/60/98/49/711609849.db2.gz RHDRUGCNDFPMQP-QMMMGPOBSA-N 1 2 246.232 2.055 20 0 BEADLO Cc1ccc(F)c(NC(=O)C[C@H]([NH3+])C(F)F)c1 ZINC000724738540 711610144 /nfs/dbraw/zinc/61/01/44/711610144.db2.gz HTYYCAMRHGKVKV-QMMMGPOBSA-N 1 2 246.232 2.055 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1c1cc(NC)[nH+]cn1 ZINC000136785593 711744275 /nfs/dbraw/zinc/74/42/75/711744275.db2.gz DFCIPNRCBPARFM-NXEZZACHSA-N 1 2 220.320 2.286 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1c1cc(NC)nc[nH+]1 ZINC000136785593 711744277 /nfs/dbraw/zinc/74/42/77/711744277.db2.gz DFCIPNRCBPARFM-NXEZZACHSA-N 1 2 220.320 2.286 20 0 BEADLO C[C@@H](O)C[N@H+](C/C(Cl)=C/Cl)C1CC1 ZINC000709487210 711753759 /nfs/dbraw/zinc/75/37/59/711753759.db2.gz YZWMJRFZTNNGMF-UDGZVJEDSA-N 1 2 224.131 2.151 20 0 BEADLO C[C@@H](O)C[N@@H+](C/C(Cl)=C/Cl)C1CC1 ZINC000709487210 711753760 /nfs/dbraw/zinc/75/37/60/711753760.db2.gz YZWMJRFZTNNGMF-UDGZVJEDSA-N 1 2 224.131 2.151 20 0 BEADLO C[C@@H]1CC[C@@H](O)C[N@@H+]1Cc1scnc1Cl ZINC000721955058 711948082 /nfs/dbraw/zinc/94/80/82/711948082.db2.gz LEZOINYMHLZFOJ-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H]1CC[C@@H](O)C[N@H+]1Cc1scnc1Cl ZINC000721955058 711948084 /nfs/dbraw/zinc/94/80/84/711948084.db2.gz LEZOINYMHLZFOJ-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO CCCOC(=O)[C@H](C)[NH2+]C1(C(C)C)CC1 ZINC000378863053 712365018 /nfs/dbraw/zinc/36/50/18/712365018.db2.gz UTYSUAOBWKFSIJ-JTQLQIEISA-N 1 2 213.321 2.106 20 0 BEADLO CC[N@H+](C/C(Cl)=C\Cl)[C@H]1CCOC1 ZINC000379387810 712380155 /nfs/dbraw/zinc/38/01/55/712380155.db2.gz IGBFIXVXVWXNJL-QRJSTWQJSA-N 1 2 224.131 2.416 20 0 BEADLO CC[N@@H+](C/C(Cl)=C\Cl)[C@H]1CCOC1 ZINC000379387810 712380156 /nfs/dbraw/zinc/38/01/56/712380156.db2.gz IGBFIXVXVWXNJL-QRJSTWQJSA-N 1 2 224.131 2.416 20 0 BEADLO C[C@@H]1CCC(C)(C)C[C@@H]1[NH2+]Cc1c[nH]nn1 ZINC000713096958 712452351 /nfs/dbraw/zinc/45/23/51/712452351.db2.gz PBPLFYCSSBBQPK-KOLCDFICSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@@H]1CCC(C)(C)C[C@@H]1[NH2+]Cc1cn[nH]n1 ZINC000713096958 712452352 /nfs/dbraw/zinc/45/23/52/712452352.db2.gz PBPLFYCSSBBQPK-KOLCDFICSA-N 1 2 222.336 2.109 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@@H](C)c2ccns2)n1 ZINC000715968918 712546061 /nfs/dbraw/zinc/54/60/61/712546061.db2.gz WLRRHAFSRVVZPM-QMMMGPOBSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1n[nH]c(C[NH2+][C@@H](C)c2cscn2)c1C ZINC000716452965 712561929 /nfs/dbraw/zinc/56/19/29/712561929.db2.gz YNLGWVJQDPKOQL-VIFPVBQESA-N 1 2 236.344 2.334 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)c1ccc(F)cc1F ZINC000036946673 1166760215 /nfs/dbraw/zinc/76/02/15/1166760215.db2.gz VARUKVXNCZHPPT-UHFFFAOYSA-N 1 2 222.194 2.113 20 0 BEADLO CC(C)(O)[C@@H]1CCCN(c2cccc[nH+]2)C1 ZINC000382691958 710974712 /nfs/dbraw/zinc/97/47/12/710974712.db2.gz TUTSBMNUAWRWRO-LLVKDONJSA-N 1 2 220.316 2.069 20 0 BEADLO C[C@H]([NH2+]Cc1nc(C#N)cs1)c1ccncc1 ZINC000386130654 711024200 /nfs/dbraw/zinc/02/42/00/711024200.db2.gz OGEGBHIKTMPOIX-VIFPVBQESA-N 1 2 244.323 2.261 20 0 BEADLO COc1cccc(C[NH2+]Cc2nnc(C)s2)c1 ZINC000391789796 711140033 /nfs/dbraw/zinc/14/00/33/711140033.db2.gz WMOVTILEXZBJOV-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO c1[nH]nnc1C[NH2+][C@@H]1CC[C@@H]2CCCC[C@H]2C1 ZINC000398303476 711406675 /nfs/dbraw/zinc/40/66/75/711406675.db2.gz SQYQQWGQIUBXEZ-SDDRHHMPSA-N 1 2 234.347 2.253 20 0 BEADLO c1n[nH]nc1C[NH2+][C@@H]1CC[C@@H]2CCCC[C@H]2C1 ZINC000398303476 711406678 /nfs/dbraw/zinc/40/66/78/711406678.db2.gz SQYQQWGQIUBXEZ-SDDRHHMPSA-N 1 2 234.347 2.253 20 0 BEADLO CC[C@@]1(C)CCN(c2cc(NC)[nH+]cn2)C1 ZINC000399454595 711430224 /nfs/dbraw/zinc/43/02/24/711430224.db2.gz ZRXXUOUXJJIFRI-LBPRGKRZSA-N 1 2 220.320 2.145 20 0 BEADLO CC[C@@]1(C)CCN(c2cc(NC)nc[nH+]2)C1 ZINC000399454595 711430225 /nfs/dbraw/zinc/43/02/25/711430225.db2.gz ZRXXUOUXJJIFRI-LBPRGKRZSA-N 1 2 220.320 2.145 20 0 BEADLO Cc1cc(C[NH2+]Cc2nonc2C)cs1 ZINC000381213061 710609673 /nfs/dbraw/zinc/60/96/73/710609673.db2.gz XXYJZZCDTOBFDK-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO FC1(F)CC2(C[NH+](C/C=C\Cl)C2)C1 ZINC000393591101 711505049 /nfs/dbraw/zinc/50/50/49/711505049.db2.gz PEWNGIFXRRVBCK-UPHRSURJSA-N 1 2 207.651 2.470 20 0 BEADLO C[C@@]1(O)CCC[N@H+](C/C(Cl)=C/Cl)C1 ZINC000161015938 711529310 /nfs/dbraw/zinc/52/93/10/711529310.db2.gz IYMXPAOUGNLHDH-BZJXQOFCSA-N 1 2 224.131 2.152 20 0 BEADLO C[C@@]1(O)CCC[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000161015938 711529312 /nfs/dbraw/zinc/52/93/12/711529312.db2.gz IYMXPAOUGNLHDH-BZJXQOFCSA-N 1 2 224.131 2.152 20 0 BEADLO CNc1cc(NCc2ncc(C)cc2C)nc[nH+]1 ZINC000723709656 711535231 /nfs/dbraw/zinc/53/52/31/711535231.db2.gz FEPGUDCIONOPOQ-UHFFFAOYSA-N 1 2 243.314 2.142 20 0 BEADLO CNc1cc(NCc2ncc(C)cc2C)[nH+]cn1 ZINC000723709656 711535232 /nfs/dbraw/zinc/53/52/32/711535232.db2.gz FEPGUDCIONOPOQ-UHFFFAOYSA-N 1 2 243.314 2.142 20 0 BEADLO CC(C)C[C@H]1CCCN1C(=O)C[C@H]([NH3+])C(F)F ZINC000724695161 711608879 /nfs/dbraw/zinc/60/88/79/711608879.db2.gz AXXFTHXUKJDRPC-ZJUUUORDSA-N 1 2 248.317 2.006 20 0 BEADLO C[NH+](C)[C@H](C(=O)OCC(F)F)c1ccccc1 ZINC000181997969 711698914 /nfs/dbraw/zinc/69/89/14/711698914.db2.gz BZFBQTKPYAMKRH-NSHDSACASA-N 1 2 243.253 2.098 20 0 BEADLO c1ccc(NC[C@H]2CC[C@H](C3CC3)O2)[nH+]c1 ZINC000722335472 711739587 /nfs/dbraw/zinc/73/95/87/711739587.db2.gz HXKNACPPBZBNPW-VXGBXAGGSA-N 1 2 218.300 2.451 20 0 BEADLO CCCNc1cc(NC[C@H](CC)OC)nc[nH+]1 ZINC000310178749 711751453 /nfs/dbraw/zinc/75/14/53/711751453.db2.gz SJDKFUYFBFETCL-JTQLQIEISA-N 1 2 238.335 2.135 20 0 BEADLO CCCNc1cc(NC[C@H](CC)OC)[nH+]cn1 ZINC000310178749 711751454 /nfs/dbraw/zinc/75/14/54/711751454.db2.gz SJDKFUYFBFETCL-JTQLQIEISA-N 1 2 238.335 2.135 20 0 BEADLO Cc1cn(C(C)(C)C(=O)NCC2(C)CCC2)c[nH+]1 ZINC000896867600 711782670 /nfs/dbraw/zinc/78/26/70/711782670.db2.gz GFPXRUMOGQDCFI-UHFFFAOYSA-N 1 2 249.358 2.233 20 0 BEADLO C[C@@H](CC(C)(C)C)NC(=O)CNc1cccc[nH+]1 ZINC000909554898 711783220 /nfs/dbraw/zinc/78/32/20/711783220.db2.gz BJEVIMZJMHEHSP-NSHDSACASA-N 1 2 249.358 2.434 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@]23C[C@@H]2CCCC3)[nH+]c1C ZINC000896905451 711783695 /nfs/dbraw/zinc/78/36/95/711783695.db2.gz HNZYUIGBTGFHGD-FZMZJTMJSA-N 1 2 247.342 2.223 20 0 BEADLO COC(=O)c1cc(C[NH2+]Cc2ccco2)oc1C ZINC000034981171 711786273 /nfs/dbraw/zinc/78/62/73/711786273.db2.gz CZJDCTKAFITNIY-UHFFFAOYSA-N 1 2 249.266 2.257 20 0 BEADLO Cc1nc2[nH]ccc2c(NC2CC=CC2)[nH+]1 ZINC000393747581 711789416 /nfs/dbraw/zinc/78/94/16/711789416.db2.gz NZTHZOBBODDADO-UHFFFAOYSA-N 1 2 214.272 2.397 20 0 BEADLO CNc1cc(N[C@H](C)CCSC)[nH+]cn1 ZINC000229055275 711837122 /nfs/dbraw/zinc/83/71/22/711837122.db2.gz MAJNKURDSZTEJJ-MRVPVSSYSA-N 1 2 226.349 2.072 20 0 BEADLO CC[C@H](C)[C@@H]([NH2+]CCC(C)(F)F)C(=O)OC ZINC000450725973 711946035 /nfs/dbraw/zinc/94/60/35/711946035.db2.gz SPXXGCVTWCXXCT-DTWKUNHWSA-N 1 2 237.290 2.209 20 0 BEADLO C[C@H]1O[C@@H](C)[C@H](C)[C@H]1[NH2+]CC(F)(F)C(F)F ZINC000701034488 712013023 /nfs/dbraw/zinc/01/30/23/712013023.db2.gz JIVGNZURDULPEI-RULNZFCNSA-N 1 2 243.244 2.288 20 0 BEADLO C[C@@H]([NH2+]CC[C@H](C)F)C(=O)OC(C)(C)C ZINC000702552777 712055239 /nfs/dbraw/zinc/05/52/39/712055239.db2.gz CSTHDISJZSRUKR-DTWKUNHWSA-N 1 2 219.300 2.054 20 0 BEADLO CNc1cc(N2CCCC3(CC3)CC2)nc[nH+]1 ZINC000702594592 712056471 /nfs/dbraw/zinc/05/64/71/712056471.db2.gz NUGXWBUMNVNYMI-UHFFFAOYSA-N 1 2 232.331 2.289 20 0 BEADLO CNc1cc(N2CCCC3(CC3)CC2)[nH+]cn1 ZINC000702594592 712056472 /nfs/dbraw/zinc/05/64/72/712056472.db2.gz NUGXWBUMNVNYMI-UHFFFAOYSA-N 1 2 232.331 2.289 20 0 BEADLO CCCC[C@@H]([NH2+]C1CC(SC)C1)C(=O)OC ZINC000707021236 712164213 /nfs/dbraw/zinc/16/42/13/712164213.db2.gz JJDFKDDSIMEHOZ-VQXHTEKXSA-N 1 2 245.388 2.202 20 0 BEADLO CC[NH2+]Cc1noc([C@H]2CCCC23CC3)n1 ZINC000707085504 712164944 /nfs/dbraw/zinc/16/49/44/712164944.db2.gz INFHUTQNVRJQFI-SECBINFHSA-N 1 2 221.304 2.227 20 0 BEADLO Cc1occc1C[NH2+][C@@H](C)c1cn(C)cn1 ZINC000710045310 712243785 /nfs/dbraw/zinc/24/37/85/712243785.db2.gz DTFVUMYGCJXOLU-VIFPVBQESA-N 1 2 219.288 2.172 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cncs1)c1cn(C)cn1 ZINC000710184225 712247704 /nfs/dbraw/zinc/24/77/04/712247704.db2.gz NIRNQPGZVICMHB-BDAKNGLRSA-N 1 2 236.344 2.288 20 0 BEADLO C[C@@H]1COC[C@@H]1Nc1ccc([NH+](C)C)cc1 ZINC000710887608 712261523 /nfs/dbraw/zinc/26/15/23/712261523.db2.gz DFHOWDSTJUENCU-MFKMUULPSA-N 1 2 220.316 2.199 20 0 BEADLO COC(C)(C)CCNc1cc[nH+]c(C)n1 ZINC000711888695 712337931 /nfs/dbraw/zinc/33/79/31/712337931.db2.gz RLJRVXBGNWNAPQ-UHFFFAOYSA-N 1 2 209.293 2.012 20 0 BEADLO CCCCN(CCCC)C(=O)Cc1c[nH+]c[nH]1 ZINC000142631144 712342828 /nfs/dbraw/zinc/34/28/28/712342828.db2.gz PMSYGTRUMFCVOY-UHFFFAOYSA-N 1 2 237.347 2.381 20 0 BEADLO O=C(NCCC1CCC1)c1cccc2[nH+]ccn21 ZINC000777005425 712415924 /nfs/dbraw/zinc/41/59/24/712415924.db2.gz GBXUEQAJNKXJKH-UHFFFAOYSA-N 1 2 243.310 2.254 20 0 BEADLO CCCn1cc(C[NH2+]Cc2cccc(F)c2)nn1 ZINC000714500589 712493017 /nfs/dbraw/zinc/49/30/17/712493017.db2.gz NOKODBLDHKQALA-UHFFFAOYSA-N 1 2 248.305 2.117 20 0 BEADLO C[C@H]([NH2+]Cc1nccs1)c1ccns1 ZINC000715946026 712545150 /nfs/dbraw/zinc/54/51/50/712545150.db2.gz WBDNDCFOPIGFSH-ZETCQYMHSA-N 1 2 225.342 2.450 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ccns1)c1cn(C)cn1 ZINC000716034234 712547399 /nfs/dbraw/zinc/54/73/99/712547399.db2.gz QLKXUGVXSWVMGC-RKDXNWHRSA-N 1 2 236.344 2.288 20 0 BEADLO Cc1[nH]c(CN[C@@H](C)c2ccns2)[nH+]c1C ZINC000716032696 712547410 /nfs/dbraw/zinc/54/74/10/712547410.db2.gz GOVBJMOIOTXPGV-VIFPVBQESA-N 1 2 236.344 2.334 20 0 BEADLO Cc1nc(C[NH2+][C@@H](C)c2ccns2)[nH]c1C ZINC000716032696 712547412 /nfs/dbraw/zinc/54/74/12/712547412.db2.gz GOVBJMOIOTXPGV-VIFPVBQESA-N 1 2 236.344 2.334 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCn2ccnc21)c1ccns1 ZINC000715999988 712551734 /nfs/dbraw/zinc/55/17/34/712551734.db2.gz RURRSFINIQKOLT-DTWKUNHWSA-N 1 2 234.328 2.135 20 0 BEADLO Cc1cn[nH]c1C[NH2+][C@H]1CCCc2cccnc21 ZINC000716438210 712560546 /nfs/dbraw/zinc/56/05/46/712560546.db2.gz BZKLKYMPQDIXFL-LBPRGKRZSA-N 1 2 242.326 2.280 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@H]1CCCc2cccnc21 ZINC000716438210 712560547 /nfs/dbraw/zinc/56/05/47/712560547.db2.gz BZKLKYMPQDIXFL-LBPRGKRZSA-N 1 2 242.326 2.280 20 0 BEADLO Cc1n[nH]c(CNc2cccc[nH+]2)c1C ZINC000716444642 712561025 /nfs/dbraw/zinc/56/10/25/712561025.db2.gz ZFQYKAHKODKICW-UHFFFAOYSA-N 1 2 202.261 2.034 20 0 BEADLO CC1(C)CO[C@@H](CCNc2cc[nH+]cc2F)C1 ZINC000717335515 712649175 /nfs/dbraw/zinc/64/91/75/712649175.db2.gz VBMBFWFXEIENPB-JTQLQIEISA-N 1 2 238.306 2.260 20 0 BEADLO c1nnc([C@@H]2CCC[N@H+]2CCCC2CC2)[nH]1 ZINC000931142039 712713626 /nfs/dbraw/zinc/71/36/26/712713626.db2.gz JISOJHFGEUKXGF-NSHDSACASA-N 1 2 220.320 2.132 20 0 BEADLO c1nnc([C@@H]2CCC[N@@H+]2CCCC2CC2)[nH]1 ZINC000931142039 712713629 /nfs/dbraw/zinc/71/36/29/712713629.db2.gz JISOJHFGEUKXGF-NSHDSACASA-N 1 2 220.320 2.132 20 0 BEADLO COc1ncccc1C[NH2+]Cc1cc(C)co1 ZINC000718134205 712747518 /nfs/dbraw/zinc/74/75/18/712747518.db2.gz XJJLXEMJESTOIC-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCC[C@H](C2OCCO2)C1 ZINC000719028170 712794093 /nfs/dbraw/zinc/79/40/93/712794093.db2.gz AXJFNXDZYSZFOE-JTQLQIEISA-N 1 2 249.301 2.117 20 0 BEADLO CCC(F)(F)C[N@H+]1CCC[C@H](C2OCCO2)C1 ZINC000719028170 712794094 /nfs/dbraw/zinc/79/40/94/712794094.db2.gz AXJFNXDZYSZFOE-JTQLQIEISA-N 1 2 249.301 2.117 20 0 BEADLO C[C@H]1Cc2cc(C[NH2+]Cc3ccon3)ccc2O1 ZINC000720789536 712865901 /nfs/dbraw/zinc/86/59/01/712865901.db2.gz FUJZVLNHNRVDKH-JTQLQIEISA-N 1 2 244.294 2.288 20 0 BEADLO COc1c(F)cc(F)cc1C[NH+]1CC=CC1 ZINC001143552331 960310059 /nfs/dbraw/zinc/31/00/59/960310059.db2.gz YTMAWAVGGUXZAV-UHFFFAOYSA-N 1 2 225.238 2.345 20 0 BEADLO C[C@H]1CC[N@H+](Cc2csnn2)[C@@H](C)C1 ZINC001140997039 960786329 /nfs/dbraw/zinc/78/63/29/960786329.db2.gz SQDHKMSQHVPNCK-IUCAKERBSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2csnn2)[C@@H](C)C1 ZINC001140997039 960786349 /nfs/dbraw/zinc/78/63/49/960786349.db2.gz SQDHKMSQHVPNCK-IUCAKERBSA-N 1 2 211.334 2.159 20 0 BEADLO CCCCc1[nH]cc(CN2CC(C)(F)C2)[nH+]1 ZINC001141067912 960859901 /nfs/dbraw/zinc/85/99/01/960859901.db2.gz RJEYXMRSJRLOFW-UHFFFAOYSA-N 1 2 225.311 2.296 20 0 BEADLO Cc1nc(N[C@H](C)CCO)cc(C(C)C)[nH+]1 ZINC000709783823 961575017 /nfs/dbraw/zinc/57/50/17/961575017.db2.gz HXOBRTYEYAOWSA-SECBINFHSA-N 1 2 223.320 2.091 20 0 BEADLO O[C@@H]1C[N@H+](Cc2csc(Cl)c2)CC[C@H]1F ZINC001142760652 961714340 /nfs/dbraw/zinc/71/43/40/961714340.db2.gz ZQHZZSXMJWZMNJ-RKDXNWHRSA-N 1 2 249.738 2.306 20 0 BEADLO O[C@@H]1C[N@@H+](Cc2csc(Cl)c2)CC[C@H]1F ZINC001142760652 961714350 /nfs/dbraw/zinc/71/43/50/961714350.db2.gz ZQHZZSXMJWZMNJ-RKDXNWHRSA-N 1 2 249.738 2.306 20 0 BEADLO CNc1cc(N2CCC(F)(F)C[C@@H]2C)nc[nH+]1 ZINC000697653680 964415328 /nfs/dbraw/zinc/41/53/28/964415328.db2.gz RDIWIYNDNAXXFP-QMMMGPOBSA-N 1 2 242.273 2.142 20 0 BEADLO CNc1cc(N2CCC(F)(F)C[C@@H]2C)[nH+]cn1 ZINC000697653680 964415331 /nfs/dbraw/zinc/41/53/31/964415331.db2.gz RDIWIYNDNAXXFP-QMMMGPOBSA-N 1 2 242.273 2.142 20 0 BEADLO CSc1cc[nH+]c(N[C@H]2CCC[C@H]2CO)c1 ZINC001162608099 965074810 /nfs/dbraw/zinc/07/48/10/965074810.db2.gz UTXXKMSIRHXRMF-ONGXEEELSA-N 1 2 238.356 2.376 20 0 BEADLO CSc1cc[nH+]c(N2C[C@@H](F)[C@H](F)C2)c1 ZINC001164214961 965800461 /nfs/dbraw/zinc/80/04/61/965800461.db2.gz MAPQUBMSEAFLKD-RKDXNWHRSA-N 1 2 230.283 2.300 20 0 BEADLO COC(C)(C)CNc1ccn2cc[nH+]c2c1 ZINC001165829584 966165268 /nfs/dbraw/zinc/16/52/68/966165268.db2.gz FYNJGODFLMRVOL-UHFFFAOYSA-N 1 2 219.288 2.171 20 0 BEADLO CO[C@@H]1CCCN(c2[nH+]ccc(F)c2C)C1 ZINC001166952056 966478354 /nfs/dbraw/zinc/47/83/54/966478354.db2.gz IEAMFOVXZWJYIE-SNVBAGLBSA-N 1 2 224.279 2.144 20 0 BEADLO Cc1cc(C2=CCOC2)c2[nH+]ccn2c1 ZINC001239480780 966897158 /nfs/dbraw/zinc/89/71/58/966897158.db2.gz GLKJQRWRXMZSJS-UHFFFAOYSA-N 1 2 200.241 2.056 20 0 BEADLO Cc1[nH+]c[nH]c1CN1CCC[C@H]1C(F)(F)F ZINC001204588185 967078289 /nfs/dbraw/zinc/07/82/89/967078289.db2.gz UYOGGBLRVWLCLR-VIFPVBQESA-N 1 2 233.237 2.245 20 0 BEADLO CC1C[NH+](Cc2nc3ccccc3[nH]2)C1 ZINC001204752028 967146682 /nfs/dbraw/zinc/14/66/82/967146682.db2.gz RSUXFENMFVCULP-UHFFFAOYSA-N 1 2 201.273 2.015 20 0 BEADLO C[C@@H]1C[C@H]([N@@H+]2CCO[C@H](C#N)C2)CC(C)(C)C1 ZINC000093134600 1165824704 /nfs/dbraw/zinc/82/47/04/1165824704.db2.gz MFRAAVHSAZRROM-FRRDWIJNSA-N 1 2 236.359 2.426 20 0 BEADLO C[C@@H]1C[C@H]([N@H+]2CCO[C@H](C#N)C2)CC(C)(C)C1 ZINC000093134600 1165824708 /nfs/dbraw/zinc/82/47/08/1165824708.db2.gz MFRAAVHSAZRROM-FRRDWIJNSA-N 1 2 236.359 2.426 20 0 BEADLO C[C@@H](COc1cccc(F)c1)[NH2+]Cc1ccn[nH]1 ZINC001648897835 1165882596 /nfs/dbraw/zinc/88/25/96/1165882596.db2.gz CLLNICHBGFKENF-JTQLQIEISA-N 1 2 249.289 2.106 20 0 BEADLO COc1ccc(-c2ccc[nH+]c2N)cc1 ZINC000069841468 1165905918 /nfs/dbraw/zinc/90/59/18/1165905918.db2.gz VVJJDUZQGPQZBW-UHFFFAOYSA-N 1 2 200.241 2.339 20 0 BEADLO COCCc1[nH]c2ccc(F)c(C)c2[nH+]1 ZINC001250595665 968127504 /nfs/dbraw/zinc/12/75/04/968127504.db2.gz PCHNKFAFXCDWOM-UHFFFAOYSA-N 1 2 208.236 2.199 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)c1ccccc1 ZINC000166172034 1165958761 /nfs/dbraw/zinc/95/87/61/1165958761.db2.gz AJQXIYFZMYIYBU-UHFFFAOYSA-N 1 2 200.241 2.225 20 0 BEADLO C[N@H+](Cc1cccnc1)Cc1c(N)cccc1F ZINC000109427162 1166013955 /nfs/dbraw/zinc/01/39/55/1166013955.db2.gz XKEFFWOPUYYNGS-UHFFFAOYSA-N 1 2 245.301 2.435 20 0 BEADLO C[N@@H+](Cc1cccnc1)Cc1c(N)cccc1F ZINC000109427162 1166013959 /nfs/dbraw/zinc/01/39/59/1166013959.db2.gz XKEFFWOPUYYNGS-UHFFFAOYSA-N 1 2 245.301 2.435 20 0 BEADLO C[N@H+](Cc1ccncc1)Cc1c(N)cccc1F ZINC000109427166 1166015502 /nfs/dbraw/zinc/01/55/02/1166015502.db2.gz QYUVJAMOSMHMHN-UHFFFAOYSA-N 1 2 245.301 2.435 20 0 BEADLO C[N@@H+](Cc1ccncc1)Cc1c(N)cccc1F ZINC000109427166 1166015508 /nfs/dbraw/zinc/01/55/08/1166015508.db2.gz QYUVJAMOSMHMHN-UHFFFAOYSA-N 1 2 245.301 2.435 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2c(N)cccc2F)C[C@H](C)O1 ZINC000109426977 1166015704 /nfs/dbraw/zinc/01/57/04/1166015704.db2.gz DYXIBOKHKGGMCO-AOOOYVTPSA-N 1 2 238.306 2.017 20 0 BEADLO C[C@@H]1C[N@H+](Cc2c(N)cccc2F)C[C@H](C)O1 ZINC000109426977 1166015710 /nfs/dbraw/zinc/01/57/10/1166015710.db2.gz DYXIBOKHKGGMCO-AOOOYVTPSA-N 1 2 238.306 2.017 20 0 BEADLO Nc1ccc(CSc2nccn2C2CC2)c[nH+]1 ZINC000689833526 1166099960 /nfs/dbraw/zinc/09/99/60/1166099960.db2.gz FBIVTTRTRPWDAO-UHFFFAOYSA-N 1 2 246.339 2.488 20 0 BEADLO C[C@@H]1C[C@H]1c1nnc([C@@H]([NH3+])c2ccccc2)o1 ZINC000224321289 1166232974 /nfs/dbraw/zinc/23/29/74/1166232974.db2.gz TVSRZZWGFWMHLR-IEBDPFPHSA-N 1 2 229.283 2.241 20 0 BEADLO COC1(C)C[NH+](CCc2cccc(F)c2)C1 ZINC001208195778 969123352 /nfs/dbraw/zinc/12/33/52/969123352.db2.gz GGTGPLABGMCQPJ-UHFFFAOYSA-N 1 2 223.291 2.089 20 0 BEADLO Cc1cc(-c2[nH]cc[nH+]2)ccc1N(C)C ZINC001242018655 969172730 /nfs/dbraw/zinc/17/27/30/969172730.db2.gz NMLGUGKPGTTXPM-UHFFFAOYSA-N 1 2 201.273 2.451 20 0 BEADLO CCCCC[C@@H](O)CNc1cc[nH+]c(C)n1 ZINC001253520254 969197540 /nfs/dbraw/zinc/19/75/40/969197540.db2.gz JEGKAUVXANYBCU-LLVKDONJSA-N 1 2 223.320 2.138 20 0 BEADLO CC[C@H]([NH2+]CCOC(C)(C)C)c1noc(C)n1 ZINC001169111433 969446073 /nfs/dbraw/zinc/44/60/73/969446073.db2.gz ISMXSTGSOXVHIE-JTQLQIEISA-N 1 2 241.335 2.234 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)Cc1ccccc1 ZINC001625883713 1166501069 /nfs/dbraw/zinc/50/10/69/1166501069.db2.gz DQUJDDRGRPCPFD-UHFFFAOYSA-N 1 2 240.306 2.302 20 0 BEADLO FC(F)(C[NH2+][C@H]1CCSC1)c1ccccn1 ZINC001255276941 970029806 /nfs/dbraw/zinc/02/98/06/970029806.db2.gz NCSNOZZRBOHEGB-VIFPVBQESA-N 1 2 244.310 2.269 20 0 BEADLO Nc1ccc(Nc2cccc(O)c2)c[nH+]1 ZINC000019952400 1166652447 /nfs/dbraw/zinc/65/24/47/1166652447.db2.gz MZTHMBAZBXYXQV-UHFFFAOYSA-N 1 2 201.229 2.113 20 0 BEADLO C[C@H]([NH2+][C@@H](C)C1(Cl)CC1)c1csnn1 ZINC000695665779 1166663257 /nfs/dbraw/zinc/66/32/57/1166663257.db2.gz DRRWMVIUXCGPAV-BQBZGAKWSA-N 1 2 231.752 2.349 20 0 BEADLO CCCOC1C[NH+]([C@H](C)CC(F)(F)F)C1 ZINC001255658657 970440206 /nfs/dbraw/zinc/44/02/06/970440206.db2.gz UDBBOLHOAVZHNS-MRVPVSSYSA-N 1 2 225.254 2.438 20 0 BEADLO O=C1CC[N@H+](C2CCCCCC2)C[C@H]1F ZINC001255892686 970561094 /nfs/dbraw/zinc/56/10/94/970561094.db2.gz RULREGRJABWOSJ-LLVKDONJSA-N 1 2 213.296 2.322 20 0 BEADLO O=C1CC[N@@H+](C2CCCCCC2)C[C@H]1F ZINC001255892686 970561098 /nfs/dbraw/zinc/56/10/98/970561098.db2.gz RULREGRJABWOSJ-LLVKDONJSA-N 1 2 213.296 2.322 20 0 BEADLO CCSC[C@@H](C)[NH2+][C@@H](C)C(=O)OC(C)C ZINC001173288378 975254664 /nfs/dbraw/zinc/25/46/64/975254664.db2.gz UOYQJOAKTLSCER-ZJUUUORDSA-N 1 2 233.377 2.058 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C/C=C/C1CC1 ZINC000382160949 1167090256 /nfs/dbraw/zinc/09/02/56/1167090256.db2.gz SQQNSKPRSZALHG-NWALNABHSA-N 1 2 205.305 2.335 20 0 BEADLO COc1nnc(C[N@@H+]2CCCC[C@H](C)C2)s1 ZINC001332924231 975323019 /nfs/dbraw/zinc/32/30/19/975323019.db2.gz XRGGQFOVAPLUMJ-VIFPVBQESA-N 1 2 241.360 2.169 20 0 BEADLO COc1nnc(C[N@H+]2CCCC[C@H](C)C2)s1 ZINC001332924231 975323027 /nfs/dbraw/zinc/32/30/27/975323027.db2.gz XRGGQFOVAPLUMJ-VIFPVBQESA-N 1 2 241.360 2.169 20 0 BEADLO CC[C@@H](C)Nc1cc(N(C)CC)nc[nH+]1 ZINC001167999113 1167130509 /nfs/dbraw/zinc/13/05/09/1167130509.db2.gz MFWPDMIAFWROJC-SECBINFHSA-N 1 2 208.309 2.143 20 0 BEADLO CC[C@@H](C)Nc1cc(N(C)CC)[nH+]cn1 ZINC001167999113 1167130517 /nfs/dbraw/zinc/13/05/17/1167130517.db2.gz MFWPDMIAFWROJC-SECBINFHSA-N 1 2 208.309 2.143 20 0 BEADLO Cc1cc[nH+]c(C)c1O[C@H]1CCCOC1 ZINC001227264612 975337892 /nfs/dbraw/zinc/33/78/92/975337892.db2.gz OYEBPSDYFZONFW-NSHDSACASA-N 1 2 207.273 2.256 20 0 BEADLO CO[C@@H](C[NH2+][C@H](C)c1noc(C)n1)CC(C)C ZINC001332961835 975341924 /nfs/dbraw/zinc/34/19/24/975341924.db2.gz OUYTUICNYUQHDP-MWLCHTKSSA-N 1 2 241.335 2.090 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H]2C[C@@]2(C)C(C)C)[nH+]c1C ZINC000896914165 1167335251 /nfs/dbraw/zinc/33/52/51/1167335251.db2.gz SQALAYDFLMOUTA-FZMZJTMJSA-N 1 2 249.358 2.325 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)n[nH]1 ZINC001330816848 977111392 /nfs/dbraw/zinc/11/13/92/977111392.db2.gz DODJHNYLJPXWMG-JQWIXIFHSA-N 1 2 205.305 2.093 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H]3CCCC[C@@H]32)n[nH]1 ZINC001330816848 977111405 /nfs/dbraw/zinc/11/14/05/977111405.db2.gz DODJHNYLJPXWMG-JQWIXIFHSA-N 1 2 205.305 2.093 20 0 BEADLO CCC(F)(F)C[NH2+]C[C@@H](O)c1ccccc1F ZINC000697554980 1167506286 /nfs/dbraw/zinc/50/62/86/1167506286.db2.gz YHIMBYJHSUUPHO-LLVKDONJSA-N 1 2 247.260 2.494 20 0 BEADLO Cc1cc(C[NH2+]Cc2csnn2)cs1 ZINC000381301001 1167538808 /nfs/dbraw/zinc/53/88/08/1167538808.db2.gz QVJCADSGEDNBRD-UHFFFAOYSA-N 1 2 225.342 2.198 20 0 BEADLO COc1cc(F)ccc1C[N@H+](C)C1(C)COC1 ZINC001231607357 977650156 /nfs/dbraw/zinc/65/01/56/977650156.db2.gz ZCOLAEWMTWUDIR-UHFFFAOYSA-N 1 2 239.290 2.055 20 0 BEADLO COc1cc(F)ccc1C[N@@H+](C)C1(C)COC1 ZINC001231607357 977650159 /nfs/dbraw/zinc/65/01/59/977650159.db2.gz ZCOLAEWMTWUDIR-UHFFFAOYSA-N 1 2 239.290 2.055 20 0 BEADLO CSc1ccc(C[N@H+](C)C2(C)COC2)cn1 ZINC001232333735 978007920 /nfs/dbraw/zinc/00/79/20/978007920.db2.gz ZSVZWOGMFPESKC-UHFFFAOYSA-N 1 2 238.356 2.024 20 0 BEADLO CSc1ccc(C[N@@H+](C)C2(C)COC2)cn1 ZINC001232333735 978007924 /nfs/dbraw/zinc/00/79/24/978007924.db2.gz ZSVZWOGMFPESKC-UHFFFAOYSA-N 1 2 238.356 2.024 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@@H](C(F)F)C2)c[nH]1 ZINC001232464343 978106987 /nfs/dbraw/zinc/10/69/87/978106987.db2.gz YYPTVHWINWIGKU-SECBINFHSA-N 1 2 229.274 2.195 20 0 BEADLO Cc1ncc(C[N@@H+]2CCC[C@@H](C(F)F)C2)[nH]1 ZINC001232464343 978106995 /nfs/dbraw/zinc/10/69/95/978106995.db2.gz YYPTVHWINWIGKU-SECBINFHSA-N 1 2 229.274 2.195 20 0 BEADLO Cc1ncc(C[N@H+]2CCC[C@@H](C(F)F)C2)[nH]1 ZINC001232464343 978107002 /nfs/dbraw/zinc/10/70/02/978107002.db2.gz YYPTVHWINWIGKU-SECBINFHSA-N 1 2 229.274 2.195 20 0 BEADLO CO[C@H](C)CNc1cccc(-n2cc[nH+]c2)c1 ZINC000386220865 1167702244 /nfs/dbraw/zinc/70/22/44/1167702244.db2.gz FNKDLQMFSHXXPL-LLVKDONJSA-N 1 2 231.299 2.319 20 0 BEADLO CC[C@H](F)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001337261620 978255549 /nfs/dbraw/zinc/25/55/49/978255549.db2.gz OAHRSHUTITYRBU-VIFPVBQESA-N 1 2 221.235 2.021 20 0 BEADLO CC[C@H](C)[C@H](C(=O)OC)[N@@H+]1CC[C@H](C)[C@@H](F)C1 ZINC001168466333 1167758963 /nfs/dbraw/zinc/75/89/63/1167758963.db2.gz NEHRWNPWTSCIPL-FIQHERPVSA-N 1 2 245.338 2.254 20 0 BEADLO CC[C@H](C)[C@H](C(=O)OC)[N@H+]1CC[C@H](C)[C@@H](F)C1 ZINC001168466333 1167758974 /nfs/dbraw/zinc/75/89/74/1167758974.db2.gz NEHRWNPWTSCIPL-FIQHERPVSA-N 1 2 245.338 2.254 20 0 BEADLO C[C@@H]1CC[N@@H+]1Cc1cc(O)c(F)c(F)c1 ZINC001232971014 978377997 /nfs/dbraw/zinc/37/79/97/978377997.db2.gz QPXMKCPHJFKKOZ-SSDOTTSWSA-N 1 2 213.227 2.265 20 0 BEADLO C[C@@H]1CC[N@H+]1Cc1cc(O)c(F)c(F)c1 ZINC001232971014 978378007 /nfs/dbraw/zinc/37/80/07/978378007.db2.gz QPXMKCPHJFKKOZ-SSDOTTSWSA-N 1 2 213.227 2.265 20 0 BEADLO C[C@H]1CC[N@@H+]1Cc1cc(O)c(F)c(F)c1 ZINC001232971015 978374812 /nfs/dbraw/zinc/37/48/12/978374812.db2.gz QPXMKCPHJFKKOZ-ZETCQYMHSA-N 1 2 213.227 2.265 20 0 BEADLO C[C@H]1CC[N@H+]1Cc1cc(O)c(F)c(F)c1 ZINC001232971015 978374826 /nfs/dbraw/zinc/37/48/26/978374826.db2.gz QPXMKCPHJFKKOZ-ZETCQYMHSA-N 1 2 213.227 2.265 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1cc(Cl)ncc1O ZINC001233032080 978413589 /nfs/dbraw/zinc/41/35/89/978413589.db2.gz DDVPZQXJCMAKHM-APPZFPTMSA-N 1 2 244.697 2.373 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1sncc1C ZINC001233321663 978560793 /nfs/dbraw/zinc/56/07/93/978560793.db2.gz YKYPQDUREXCYFA-JTQLQIEISA-N 1 2 226.345 2.062 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1sncc1C ZINC001233321663 978560802 /nfs/dbraw/zinc/56/08/02/978560802.db2.gz YKYPQDUREXCYFA-JTQLQIEISA-N 1 2 226.345 2.062 20 0 BEADLO C[C@@H](N(C)C(=O)[C@H](C)n1cc[nH+]c1)C1(C)CC1 ZINC001340074925 978964485 /nfs/dbraw/zinc/96/44/85/978964485.db2.gz PRYUWVYELXMRRC-WDEREUQCSA-N 1 2 235.331 2.091 20 0 BEADLO CCN(Cc1c(C)[nH+]cn1C)CC(F)(F)F ZINC001235546650 979083334 /nfs/dbraw/zinc/08/33/34/979083334.db2.gz AMTMOYVQEDZLEV-UHFFFAOYSA-N 1 2 235.253 2.113 20 0 BEADLO FC(F)(F)Cc1ccn2cc[nH+]c2c1 ZINC001250030503 979391154 /nfs/dbraw/zinc/39/11/54/979391154.db2.gz VKPJOFAYNOXWEV-UHFFFAOYSA-N 1 2 200.163 2.439 20 0 BEADLO Cc1noc(C)c1[C@@H](C)[NH2+][C@@H]1CCn2ccnc21 ZINC000382312068 1168241424 /nfs/dbraw/zinc/24/14/24/1168241424.db2.gz SIXLYLZCCDHDDY-LDYMZIIASA-N 1 2 246.314 2.284 20 0 BEADLO CCN1CCC[N@H+](CC2OC=CC2=S)CC1 ZINC001237181891 979832276 /nfs/dbraw/zinc/83/22/76/979832276.db2.gz JDPPGTXRLDAJQV-UHFFFAOYSA-N 1 2 240.372 2.096 20 0 BEADLO CCN1CCC[N@@H+](CC2OC=CC2=S)CC1 ZINC001237181891 979832278 /nfs/dbraw/zinc/83/22/78/979832278.db2.gz JDPPGTXRLDAJQV-UHFFFAOYSA-N 1 2 240.372 2.096 20 0 BEADLO C[NH+](C)C[C@@H]1CCCN1CC1OC=CC1=S ZINC001237192354 979841699 /nfs/dbraw/zinc/84/16/99/979841699.db2.gz UMSDZDJNQJHRHW-JTQLQIEISA-N 1 2 240.372 2.094 20 0 BEADLO COc1nc(Cl)ccc1C[N@@H+]1CC[C@@H]1C ZINC001237243668 979855485 /nfs/dbraw/zinc/85/54/85/979855485.db2.gz XDTSZFBLPKYRGY-QMMMGPOBSA-N 1 2 226.707 2.338 20 0 BEADLO COc1nc(Cl)ccc1C[N@H+]1CC[C@@H]1C ZINC001237243668 979855491 /nfs/dbraw/zinc/85/54/91/979855491.db2.gz XDTSZFBLPKYRGY-QMMMGPOBSA-N 1 2 226.707 2.338 20 0 BEADLO CC1(C[NH2+]Cc2nc(C(F)(F)F)n[nH]2)CCC1 ZINC001184448806 980075272 /nfs/dbraw/zinc/07/52/72/980075272.db2.gz CKQQEBJMJHHHEX-UHFFFAOYSA-N 1 2 248.252 2.103 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1cc(C)c(Cl)cn1 ZINC001238421550 980253407 /nfs/dbraw/zinc/25/34/07/980253407.db2.gz IKDCEKCSZQQFGJ-NSHDSACASA-N 1 2 240.734 2.264 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1cc(C)c(Cl)cn1 ZINC001238421550 980253412 /nfs/dbraw/zinc/25/34/12/980253412.db2.gz IKDCEKCSZQQFGJ-NSHDSACASA-N 1 2 240.734 2.264 20 0 BEADLO CCOc1ccc(C)c(C[NH+]2CCOCC2)c1 ZINC001238706642 980313734 /nfs/dbraw/zinc/31/37/34/980313734.db2.gz ZQSMQXBGWDRZKN-UHFFFAOYSA-N 1 2 235.327 2.226 20 0 BEADLO CCCCCC[C@H](O)C[NH2+][C@H](C)c1ncon1 ZINC001346312831 980809693 /nfs/dbraw/zinc/80/96/93/980809693.db2.gz MNOXWLLAVRHWLT-MNOVXSKESA-N 1 2 241.335 2.052 20 0 BEADLO Cc1nc(N2CCC(F)(F)CC2)cc[nH+]1 ZINC000585380712 1168666555 /nfs/dbraw/zinc/66/65/55/1168666555.db2.gz VFXPQQPXKBJQBS-UHFFFAOYSA-N 1 2 213.231 2.021 20 0 BEADLO CC[C@@H](CC(F)F)c1nnc(C[NH+](C)C)o1 ZINC001349986971 981837045 /nfs/dbraw/zinc/83/70/45/981837045.db2.gz SVKIPBBXPDNRIP-ZETCQYMHSA-N 1 2 233.262 2.280 20 0 BEADLO C[C@@H]([NH2+]CC(F)(F)c1ccc(F)cc1)[C@H](C)O ZINC001350434876 981975281 /nfs/dbraw/zinc/97/52/81/981975281.db2.gz ZORYPNOILYDGOX-BDAKNGLRSA-N 1 2 247.260 2.276 20 0 BEADLO CC(C)(C)c1nnc(Nc2cc[nH+]c(N)c2)o1 ZINC001206522731 1168742566 /nfs/dbraw/zinc/74/25/66/1168742566.db2.gz XUCNKDLEHZKMPD-UHFFFAOYSA-N 1 2 233.275 2.088 20 0 BEADLO CC[N@H+](Cc1cnoc1)Cc1cccnc1 ZINC001205696936 982196406 /nfs/dbraw/zinc/19/64/06/982196406.db2.gz JSTHVWUEKBMXMF-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO CC[N@@H+](Cc1cnoc1)Cc1cccnc1 ZINC001205696936 982196417 /nfs/dbraw/zinc/19/64/17/982196417.db2.gz JSTHVWUEKBMXMF-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO CC(C)(C)C[N@@H+]1CC(F)(F)CC[C@@H]1CO ZINC001201427261 983229938 /nfs/dbraw/zinc/22/99/38/983229938.db2.gz VPFCCTFQQURNCA-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)(C)C[N@H+]1CC(F)(F)CC[C@@H]1CO ZINC001201427261 983229961 /nfs/dbraw/zinc/22/99/61/983229961.db2.gz VPFCCTFQQURNCA-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cnn(C(F)(F)F)c1 ZINC001242463109 983788832 /nfs/dbraw/zinc/78/88/32/983788832.db2.gz JUXMVMKSEXGEIM-JKEDICHKSA-N 1 2 217.194 2.235 20 0 BEADLO CCC[C@H](C)N(C)C(=O)[C@H](C)n1cc[nH+]c1 ZINC000052902295 1169133833 /nfs/dbraw/zinc/13/38/33/1169133833.db2.gz VDZAWQPZIZJHAI-QWRGUYRKSA-N 1 2 223.320 2.091 20 0 BEADLO CCC[C@H](C)N(C)C(=O)[C@@H](C)n1cc[nH+]c1 ZINC000052902291 1169134726 /nfs/dbraw/zinc/13/47/26/1169134726.db2.gz VDZAWQPZIZJHAI-WDEREUQCSA-N 1 2 223.320 2.091 20 0 BEADLO CCOCC[C@H](C)[N@@H+]1CCC(F)(F)C1 ZINC001172422705 974697534 /nfs/dbraw/zinc/69/75/34/974697534.db2.gz HSKHRQXHTTVFQQ-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CCOCC[C@H](C)[N@H+]1CCC(F)(F)C1 ZINC001172422705 974697538 /nfs/dbraw/zinc/69/75/38/974697538.db2.gz HSKHRQXHTTVFQQ-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CC[NH+]1CC(Oc2cc(F)c(F)c(F)c2)C1 ZINC001225914509 974728776 /nfs/dbraw/zinc/72/87/76/974728776.db2.gz KZSZIMUPGAEGGR-UHFFFAOYSA-N 1 2 231.217 2.187 20 0 BEADLO CC(C)OCC[C@@H](C)[N@@H+]1CCCC(=O)[C@H](F)C1 ZINC001172445250 974807631 /nfs/dbraw/zinc/80/76/31/974807631.db2.gz XVJDCRSTCWIZSF-VXGBXAGGSA-N 1 2 245.338 2.193 20 0 BEADLO CC(C)OCC[C@@H](C)[N@H+]1CCCC(=O)[C@H](F)C1 ZINC001172445250 974807635 /nfs/dbraw/zinc/80/76/35/974807635.db2.gz XVJDCRSTCWIZSF-VXGBXAGGSA-N 1 2 245.338 2.193 20 0 BEADLO CC(C)COCC[C@@H](C)[NH2+][C@@H]1CC1(F)F ZINC001172453704 974816988 /nfs/dbraw/zinc/81/69/88/974816988.db2.gz GJEUXTNWAVAKDG-NXEZZACHSA-N 1 2 221.291 2.435 20 0 BEADLO Cc1cc(C[NH+]2CC=CC2)cnc1Cl ZINC001139540928 1169365829 /nfs/dbraw/zinc/36/58/29/1169365829.db2.gz KLHCFMZPXGPABV-UHFFFAOYSA-N 1 2 208.692 2.415 20 0 BEADLO CN(C)C1C[NH+](Cc2ccccc2C2CC2)C1 ZINC001139880074 1169367185 /nfs/dbraw/zinc/36/71/85/1169367185.db2.gz XLKNHXFVGMURTG-UHFFFAOYSA-N 1 2 230.355 2.310 20 0 BEADLO COCC[N@H+](CCF)Cc1cccn1C1CC1 ZINC001327946704 972822401 /nfs/dbraw/zinc/82/24/01/972822401.db2.gz NBIMROHZNFOCHA-UHFFFAOYSA-N 1 2 240.322 2.241 20 0 BEADLO COCC[N@@H+](CCF)Cc1cccn1C1CC1 ZINC001327946704 972822405 /nfs/dbraw/zinc/82/24/05/972822405.db2.gz NBIMROHZNFOCHA-UHFFFAOYSA-N 1 2 240.322 2.241 20 0 BEADLO Cc1cc(COC2CCOCC2)cc(C)[nH+]1 ZINC001223420823 973053797 /nfs/dbraw/zinc/05/37/97/973053797.db2.gz GDXNKEDUUQPESZ-UHFFFAOYSA-N 1 2 221.300 2.394 20 0 BEADLO O=C(N[C@@H]1C[C@@H]1C1CC1)c1cc2c[nH+]ccc2[nH]1 ZINC001151979547 1169411918 /nfs/dbraw/zinc/41/19/18/1169411918.db2.gz SAHAUHSRUBUZDE-ZYHUDNBSSA-N 1 2 241.294 2.091 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2c(c1)C(=O)OC2 ZINC001243474745 970767000 /nfs/dbraw/zinc/76/70/00/970767000.db2.gz QLEFEPZCVDWJOA-UHFFFAOYSA-N 1 2 226.235 2.001 20 0 BEADLO COC[C@H](Nc1[nH+]cc(OC)cc1C)C1CC1 ZINC001161724051 1169446211 /nfs/dbraw/zinc/44/62/11/1169446211.db2.gz YLZDTNMSDWELGE-LBPRGKRZSA-N 1 2 236.315 2.236 20 0 BEADLO COC[C@@H](Nc1[nH+]cc(OC)cc1C)C1CC1 ZINC001161724050 1169446537 /nfs/dbraw/zinc/44/65/37/1169446537.db2.gz YLZDTNMSDWELGE-GFCCVEGCSA-N 1 2 236.315 2.236 20 0 BEADLO C[NH+]1CC(OCc2ccc3ccccc3n2)C1 ZINC001206052573 970782906 /nfs/dbraw/zinc/78/29/06/970782906.db2.gz PBFUFIRXXDCTQT-UHFFFAOYSA-N 1 2 228.295 2.065 20 0 BEADLO CCCN1CC[NH+]([C@@H](C)Cc2ccccn2)CC1 ZINC001256418458 970827045 /nfs/dbraw/zinc/82/70/45/970827045.db2.gz WCKAJCRTOZDUSI-AWEZNQCLSA-N 1 2 247.386 2.040 20 0 BEADLO CC1=C(C)CN(C(=O)[C@@H](C)n2cc[nH+]c2)CC1 ZINC001256441800 970840198 /nfs/dbraw/zinc/84/01/98/970840198.db2.gz UZGODXOOIURVEN-GFCCVEGCSA-N 1 2 233.315 2.013 20 0 BEADLO CC(C)CC1=NNC(=c2ccnc3c2=CC=[NH+]3)O1 ZINC001256457215 970847633 /nfs/dbraw/zinc/84/76/33/970847633.db2.gz JVKGOUDIMAZDQB-JTQLQIEISA-N 1 2 242.282 2.288 20 0 BEADLO CC(C)Cc1nnc([C@@H]2CC[N@@H+]2C(C)C)o1 ZINC001256462826 970848103 /nfs/dbraw/zinc/84/81/03/970848103.db2.gz DMJANTCISDKCFO-JTQLQIEISA-N 1 2 223.320 2.423 20 0 BEADLO CC(C)Cc1nnc([C@@H]2CC[N@H+]2C(C)C)o1 ZINC001256462826 970848106 /nfs/dbraw/zinc/84/81/06/970848106.db2.gz DMJANTCISDKCFO-JTQLQIEISA-N 1 2 223.320 2.423 20 0 BEADLO Cn1ncc2c1CC[N@H+](Cc1ccc(F)cc1)C2 ZINC001203915108 1169469843 /nfs/dbraw/zinc/46/98/43/1169469843.db2.gz IYFNZRKKDHCXEM-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1ncc2c1CC[N@@H+](Cc1ccc(F)cc1)C2 ZINC001203915108 1169469847 /nfs/dbraw/zinc/46/98/47/1169469847.db2.gz IYFNZRKKDHCXEM-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)C1=CCCC1 ZINC001129594320 970863400 /nfs/dbraw/zinc/86/34/00/970863400.db2.gz NXCWRWXVNSVPNT-UHFFFAOYSA-N 1 2 227.267 2.383 20 0 BEADLO CC(C)[N@@H+]1CC[C@H]1c1nnc([C@@H]2C[C@@H]2C)o1 ZINC001256702083 970931383 /nfs/dbraw/zinc/93/13/83/970931383.db2.gz XOWSEXSYCBGMOP-AEJSXWLSSA-N 1 2 221.304 2.348 20 0 BEADLO CC(C)[N@H+]1CC[C@H]1c1nnc([C@@H]2C[C@@H]2C)o1 ZINC001256702083 970931385 /nfs/dbraw/zinc/93/13/85/970931385.db2.gz XOWSEXSYCBGMOP-AEJSXWLSSA-N 1 2 221.304 2.348 20 0 BEADLO C[C@H](Cc1ccncc1)[N@@H+]1C[C@@H](F)C[C@H]1CF ZINC001256737229 970967849 /nfs/dbraw/zinc/96/78/49/970967849.db2.gz YQAMTZYBHLZMHS-WXHSDQCUSA-N 1 2 240.297 2.395 20 0 BEADLO C[C@H](Cc1ccncc1)[N@H+]1C[C@@H](F)C[C@H]1CF ZINC001256737229 970967859 /nfs/dbraw/zinc/96/78/59/970967859.db2.gz YQAMTZYBHLZMHS-WXHSDQCUSA-N 1 2 240.297 2.395 20 0 BEADLO CCOC(=[NH2+])c1ccc(-c2cnc(N)nc2)cc1 ZINC001243873893 970995307 /nfs/dbraw/zinc/99/53/07/970995307.db2.gz AFYQUQCWZQUEMN-UHFFFAOYSA-N 1 2 242.282 2.088 20 0 BEADLO Cc1c[nH+]c(Nc2ccc(CO)cc2F)c(N)c1 ZINC001216270671 971010244 /nfs/dbraw/zinc/01/02/44/971010244.db2.gz OVQNTXVSDPIAMM-UHFFFAOYSA-N 1 2 247.273 2.347 20 0 BEADLO c1nc2ccnc(C3=C[NH2+]CCC3)c2s1 ZINC001243948593 971035096 /nfs/dbraw/zinc/03/50/96/971035096.db2.gz ANFUWMHNMADFEW-UHFFFAOYSA-N 1 2 217.297 2.416 20 0 BEADLO COc1ccc(C)nc1C1=C[NH2+]CCC1 ZINC001243947274 971036707 /nfs/dbraw/zinc/03/67/07/971036707.db2.gz GCUOWPFQGOVKNU-UHFFFAOYSA-N 1 2 204.273 2.123 20 0 BEADLO CC[C@H](CCC(=O)OC)C[N@@H+]1CCC(F)(F)C1 ZINC001208776950 1169503770 /nfs/dbraw/zinc/50/37/70/1169503770.db2.gz AALARJDXCXGVDV-SNVBAGLBSA-N 1 2 249.301 2.307 20 0 BEADLO CC[C@H](CCC(=O)OC)C[N@H+]1CCC(F)(F)C1 ZINC001208776950 1169503780 /nfs/dbraw/zinc/50/37/80/1169503780.db2.gz AALARJDXCXGVDV-SNVBAGLBSA-N 1 2 249.301 2.307 20 0 BEADLO COc1nnc(C2=C[NH2+]CCC2)c2ccccc21 ZINC001243948596 971039957 /nfs/dbraw/zinc/03/99/57/971039957.db2.gz IZPODSILHSYKIP-UHFFFAOYSA-N 1 2 241.294 2.363 20 0 BEADLO NC(=O)CCNc1cc(-c2ccccc2)cc[nH+]1 ZINC001158106348 971071812 /nfs/dbraw/zinc/07/18/12/971071812.db2.gz XRCTVMBQKXMBOW-UHFFFAOYSA-N 1 2 241.294 2.036 20 0 BEADLO CCOc1cc[nH+]cc1NC1=CCCOC1 ZINC001216505155 971102924 /nfs/dbraw/zinc/10/29/24/971102924.db2.gz IOVKWTSKUWUQPP-UHFFFAOYSA-N 1 2 220.272 2.196 20 0 BEADLO Cn1c[nH+]c2cc(NC3=CCCOC3)ccc21 ZINC001216509304 971110921 /nfs/dbraw/zinc/11/09/21/971110921.db2.gz CJLVYFDASYKBOO-UHFFFAOYSA-N 1 2 229.283 2.289 20 0 BEADLO CC(C)n1cc(C[N@H+]2CC(C)(C)C2(C)C)nn1 ZINC001329736327 973905562 /nfs/dbraw/zinc/90/55/62/973905562.db2.gz GHYWLTKEYHBPOE-UHFFFAOYSA-N 1 2 236.363 2.479 20 0 BEADLO COc1cc[nH+]c(Nc2ccc(C(C)=O)nc2)c1 ZINC001210270981 1169521810 /nfs/dbraw/zinc/52/18/10/1169521810.db2.gz OPMXUGSYNWYXOJ-UHFFFAOYSA-N 1 2 243.266 2.431 20 0 BEADLO CCC[C@@H](CC)[NH2+]C1(C(=O)OCC)CC1 ZINC001257247602 971144670 /nfs/dbraw/zinc/14/46/70/971144670.db2.gz XYQFBTZPIJYCJL-SNVBAGLBSA-N 1 2 213.321 2.250 20 0 BEADLO CCC[C@@H](CC)[N@@H+]1CCC(=O)[C@H](F)C1 ZINC001257264681 971163749 /nfs/dbraw/zinc/16/37/49/971163749.db2.gz QSQVAPYBCCZIMA-NXEZZACHSA-N 1 2 201.285 2.178 20 0 BEADLO CCC[C@@H](CC)[N@H+]1CCC(=O)[C@H](F)C1 ZINC001257264681 971163751 /nfs/dbraw/zinc/16/37/51/971163751.db2.gz QSQVAPYBCCZIMA-NXEZZACHSA-N 1 2 201.285 2.178 20 0 BEADLO C[C@@H](C(=O)OC(C)(C)C)[N@H+](C)Cc1cc[nH]c1 ZINC000179969249 1169536408 /nfs/dbraw/zinc/53/64/08/1169536408.db2.gz LAAIQBFESPELRT-JTQLQIEISA-N 1 2 238.331 2.177 20 0 BEADLO C[C@@H](C(=O)OC(C)(C)C)[N@@H+](C)Cc1cc[nH]c1 ZINC000179969249 1169536418 /nfs/dbraw/zinc/53/64/18/1169536418.db2.gz LAAIQBFESPELRT-JTQLQIEISA-N 1 2 238.331 2.177 20 0 BEADLO Cc1cocc1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC001131516190 971197499 /nfs/dbraw/zinc/19/74/99/971197499.db2.gz LDTFDKHPLAENRT-UHFFFAOYSA-N 1 2 241.250 2.488 20 0 BEADLO CCCC(CCC)[NH2+]C1(C(=O)OC)CC1 ZINC001257328070 971231931 /nfs/dbraw/zinc/23/19/31/971231931.db2.gz KIEYDDAHGMECDU-UHFFFAOYSA-N 1 2 213.321 2.250 20 0 BEADLO CCCC[C@@H](CC)[NH2+]C1(C(=O)OC)CC1 ZINC001257410387 971304615 /nfs/dbraw/zinc/30/46/15/971304615.db2.gz RZVICRIDIDZLNK-SNVBAGLBSA-N 1 2 213.321 2.250 20 0 BEADLO c1nc(COC2C[NH+](Cc3ccccc3)C2)co1 ZINC001223134524 1169569865 /nfs/dbraw/zinc/56/98/65/1169569865.db2.gz CTJFIBLFTLMKFM-UHFFFAOYSA-N 1 2 244.294 2.076 20 0 BEADLO c1[nH]cc(Cc2nnc(C3CCCC3)o2)[nH+]1 ZINC001257517626 971442948 /nfs/dbraw/zinc/44/29/48/971442948.db2.gz DANJGWPFHBBNGN-UHFFFAOYSA-N 1 2 218.260 2.041 20 0 BEADLO CC1(C)CC(CO[C@@H]2C[NH2+]CC(F)(F)C2)C1 ZINC001217854312 971444187 /nfs/dbraw/zinc/44/41/87/971444187.db2.gz FQJSVBNLQDSBGD-JTQLQIEISA-N 1 2 233.302 2.436 20 0 BEADLO CSc1cccc(OC2C[NH+](C)C2)c1 ZINC001226232995 1169604741 /nfs/dbraw/zinc/60/47/41/1169604741.db2.gz OPRXZTORJOYACP-UHFFFAOYSA-N 1 2 209.314 2.101 20 0 BEADLO CCc1ccc(O[C@@H]2CC[NH2+]CC2(F)F)nc1 ZINC001218010454 971569394 /nfs/dbraw/zinc/56/93/94/971569394.db2.gz PJBYVSZBKVFYQX-SNVBAGLBSA-N 1 2 242.269 2.020 20 0 BEADLO CC(C)(C)OC(=O)C[NH2+][C@@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170716518 971639427 /nfs/dbraw/zinc/63/94/27/971639427.db2.gz VMPDAFRBIABIHC-RTCCRHLQSA-N 1 2 239.359 2.352 20 0 BEADLO Nc1cc[nH+]c(O[C@@H]2C[C@H]3CC[C@@H]2C3)c1 ZINC001218295134 971695811 /nfs/dbraw/zinc/69/58/11/971695811.db2.gz QMACBKWGACJROC-IQJOONFLSA-N 1 2 204.273 2.231 20 0 BEADLO Cc1cc(S)ccc1O[C@H]1C[NH2+][C@H]1C ZINC001218384467 971764695 /nfs/dbraw/zinc/76/46/95/971764695.db2.gz DOQDQBLVYMFPMY-KWQFWETISA-N 1 2 209.314 2.023 20 0 BEADLO CC[C@H](C)OCC[C@H](C)[NH2+]CC(=O)OC(C)C ZINC001172322579 974533559 /nfs/dbraw/zinc/53/35/59/974533559.db2.gz VVNZQAAGRQBJHQ-RYUDHWBXSA-N 1 2 245.363 2.121 20 0 BEADLO C[C@@H]1COCC[C@@H]1Nc1ccn2cc[nH+]c2c1 ZINC001170818642 971900323 /nfs/dbraw/zinc/90/03/23/971900323.db2.gz MGRRYEBFQLSYNU-PWSUYJOCSA-N 1 2 231.299 2.171 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)Nc1cccc2[nH]ccc21 ZINC001136565000 972203779 /nfs/dbraw/zinc/20/37/79/972203779.db2.gz BUWBVIJSCATWNK-UHFFFAOYSA-N 1 2 240.266 2.072 20 0 BEADLO Cc1cccc(CN(C)c2cc(N)nc[nH+]2)c1 ZINC000112750263 972220443 /nfs/dbraw/zinc/22/04/43/972220443.db2.gz ANHKUVNGIAFDAW-UHFFFAOYSA-N 1 2 228.299 2.004 20 0 BEADLO C[C@@H]1COCC[N@@H+]1Cc1cc2ccccc2cn1 ZINC001139995367 957327666 /nfs/dbraw/zinc/32/76/66/957327666.db2.gz IQMLMBKPHPGDLD-GFCCVEGCSA-N 1 2 242.322 2.456 20 0 BEADLO C[C@@H]1COCC[N@H+]1Cc1cc2ccccc2cn1 ZINC001139995367 957327675 /nfs/dbraw/zinc/32/76/75/957327675.db2.gz IQMLMBKPHPGDLD-GFCCVEGCSA-N 1 2 242.322 2.456 20 0 BEADLO CC(=O)OC(C)(C)CCC[N@@H+]1CCC(F)(F)C1 ZINC001209148645 957331696 /nfs/dbraw/zinc/33/16/96/957331696.db2.gz IEPNIBQFBZAXSB-UHFFFAOYSA-N 1 2 249.301 2.449 20 0 BEADLO CC(=O)OC(C)(C)CCC[N@H+]1CCC(F)(F)C1 ZINC001209148645 957331702 /nfs/dbraw/zinc/33/17/02/957331702.db2.gz IEPNIBQFBZAXSB-UHFFFAOYSA-N 1 2 249.301 2.449 20 0 BEADLO Cc1nc(NCc2cccc3c2OCC3)cc[nH+]1 ZINC000692985837 957357213 /nfs/dbraw/zinc/35/72/13/957357213.db2.gz KNQWEWOTBWXDSY-UHFFFAOYSA-N 1 2 241.294 2.332 20 0 BEADLO CCN(CC(C)(C)O)c1[nH+]ccc(F)c1C ZINC001167160521 957503593 /nfs/dbraw/zinc/50/35/93/957503593.db2.gz WLCOORRMZNQFMF-UHFFFAOYSA-N 1 2 226.295 2.126 20 0 BEADLO Cn1ccc(Nc2ccc3[nH]c[nH+]c3c2)n1 ZINC001209841353 957542436 /nfs/dbraw/zinc/54/24/36/957542436.db2.gz KDUJOOKREFTUMD-UHFFFAOYSA-N 1 2 213.244 2.040 20 0 BEADLO COc1cc(C)c[nH+]c1N1CC[C@@H]2OCC[C@@H]2C1 ZINC001167211504 957545159 /nfs/dbraw/zinc/54/51/59/957545159.db2.gz BFZKXORSHQLRJT-NEPJUHHUSA-N 1 2 248.326 2.014 20 0 BEADLO COc1cc(C)c[nH+]c1N1C[C@H]2[C@H](CF)[C@H]2C1 ZINC001167225491 957558456 /nfs/dbraw/zinc/55/84/56/957558456.db2.gz JILKSESFZWYOIK-RTCCRHLQSA-N 1 2 236.290 2.050 20 0 BEADLO CN(C)c1ccccc1N(C)c1[nH+]cccc1N ZINC001209989438 957599032 /nfs/dbraw/zinc/59/90/32/957599032.db2.gz WOWDQQXNAZOGGM-UHFFFAOYSA-N 1 2 242.326 2.498 20 0 BEADLO CC[C@H]1CC[C@H](OCC[NH+]2CCOCC2)CC1 ZINC001210225816 957687347 /nfs/dbraw/zinc/68/73/47/957687347.db2.gz ZYZOSVNFAHMXEF-HDJSIYSDSA-N 1 2 241.375 2.304 20 0 BEADLO Cc1ccc(Nc2c[nH+]c(C)c(N)c2)nc1 ZINC001210286236 957715364 /nfs/dbraw/zinc/71/53/64/957715364.db2.gz YTXYSLUJLUFWBP-UHFFFAOYSA-N 1 2 214.272 2.419 20 0 BEADLO Cc1[nH+]cc(Nc2cnn(C(F)F)c2)cc1N ZINC001210288095 957716678 /nfs/dbraw/zinc/71/66/78/957716678.db2.gz KUTZORRRBSSWSX-UHFFFAOYSA-N 1 2 239.229 2.307 20 0 BEADLO Cc1ccc(C)c(Nc2cncc(N)c2)[nH+]1 ZINC001210436298 957746703 /nfs/dbraw/zinc/74/67/03/957746703.db2.gz CKYZMZMZOLCKBC-UHFFFAOYSA-N 1 2 214.272 2.419 20 0 BEADLO CCOc1cc[nH+]cc1Nc1ccncn1 ZINC001211024358 957993473 /nfs/dbraw/zinc/99/34/73/957993473.db2.gz LWFSJVAQGBIPNW-UHFFFAOYSA-N 1 2 216.244 2.014 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3cnn(C)c3C2)oc1C ZINC001204539952 958022591 /nfs/dbraw/zinc/02/25/91/958022591.db2.gz ULLONFXFRVNNHI-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO Cc1cc(C[N@H+]2CCc3cnn(C)c3C2)oc1C ZINC001204539952 958022598 /nfs/dbraw/zinc/02/25/98/958022598.db2.gz ULLONFXFRVNNHI-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO Cc1cc[nH+]c(C)c1N[C@@](C)(C(N)=O)C(C)C ZINC001167415636 958045351 /nfs/dbraw/zinc/04/53/51/958045351.db2.gz WRBGIMOYBKZBHH-CYBMUJFWSA-N 1 2 235.331 2.010 20 0 BEADLO C[N@H+](Cc1nc(C(F)(F)F)c[nH]1)C1CC1 ZINC001137010641 972325724 /nfs/dbraw/zinc/32/57/24/972325724.db2.gz YWOPYBGJJHTLNX-UHFFFAOYSA-N 1 2 219.210 2.023 20 0 BEADLO C[N@@H+](Cc1nc(C(F)(F)F)c[nH]1)C1CC1 ZINC001137010641 972325726 /nfs/dbraw/zinc/32/57/26/972325726.db2.gz YWOPYBGJJHTLNX-UHFFFAOYSA-N 1 2 219.210 2.023 20 0 BEADLO Cc1c[nH+]cc(Nc2ccnnc2)c1C ZINC001213525063 958205870 /nfs/dbraw/zinc/20/58/70/958205870.db2.gz MRSSYCPMEDYFLY-UHFFFAOYSA-N 1 2 200.245 2.232 20 0 BEADLO Cc1c[nH+]cc(Nc2ncccc2CCO)c1C ZINC001213528645 958226572 /nfs/dbraw/zinc/22/65/72/958226572.db2.gz JNZKTNFWYVYIIH-UHFFFAOYSA-N 1 2 243.310 2.372 20 0 BEADLO c1cc(C[NH+]2CC3(C2)CCCO3)cc2c1COC2 ZINC001137023462 972329562 /nfs/dbraw/zinc/32/95/62/972329562.db2.gz QEOVYWPBIPRYQD-UHFFFAOYSA-N 1 2 245.322 2.082 20 0 BEADLO c1nn[nH]c1C[NH2+]Cc1ccc2ccccc2c1 ZINC000398350347 958227787 /nfs/dbraw/zinc/22/77/87/958227787.db2.gz ZFASGAZCXGIBRX-UHFFFAOYSA-N 1 2 238.294 2.248 20 0 BEADLO Cc1cc(N2CCC[C@H](O)C2)nc(C2CCC2)[nH+]1 ZINC000891430591 958365672 /nfs/dbraw/zinc/36/56/72/958365672.db2.gz HYEFGAWZUSFQSJ-LBPRGKRZSA-N 1 2 247.342 2.014 20 0 BEADLO C[C@H](OCCn1cc[nH+]c1)c1cccnc1 ZINC001222129628 972377837 /nfs/dbraw/zinc/37/78/37/972377837.db2.gz PSAHZKOUGWVUFK-NSHDSACASA-N 1 2 217.272 2.056 20 0 BEADLO CC[C@@H](C)CCc1nnc(C[NH+](C)C)o1 ZINC001327043292 972376027 /nfs/dbraw/zinc/37/60/27/972376027.db2.gz XYRCMEKIFZRKTD-SECBINFHSA-N 1 2 211.309 2.110 20 0 BEADLO Cc1cc(C)nc(NC2C[NH+](C(C)C)C2)c1 ZINC000707927396 958843414 /nfs/dbraw/zinc/84/34/14/958843414.db2.gz MYGUHNMLJUBWTI-UHFFFAOYSA-N 1 2 219.332 2.203 20 0 BEADLO CNc1cc(Nc2nnc(C(C)C)o2)cc[nH+]1 ZINC001216331417 958847876 /nfs/dbraw/zinc/84/78/76/958847876.db2.gz SUAOXRZGDPDCKA-UHFFFAOYSA-N 1 2 233.275 2.373 20 0 BEADLO Cc1[nH+]c[nH]c1CN1CC(F)(F)C[C@]1(C)CF ZINC001204587443 958876658 /nfs/dbraw/zinc/87/66/58/958876658.db2.gz DIPKIJVREWYTNV-SNVBAGLBSA-N 1 2 247.264 2.287 20 0 BEADLO C[C@@H](OCCn1cc[nH+]c1)c1nccs1 ZINC001222138251 972385771 /nfs/dbraw/zinc/38/57/71/972385771.db2.gz CLEHNIRIVCOSIA-SECBINFHSA-N 1 2 223.301 2.117 20 0 BEADLO FC1(F)CC[C@H](OCCn2cc[nH+]c2)C1 ZINC001222138796 972386200 /nfs/dbraw/zinc/38/62/00/972386200.db2.gz KFWUMUMGJJZSIT-VIFPVBQESA-N 1 2 216.231 2.088 20 0 BEADLO C[C@H](OCCn1cc[nH+]c1)C1CCCC1 ZINC001222139699 972389747 /nfs/dbraw/zinc/38/97/47/972389747.db2.gz URDRXUGGFMHKJY-NSHDSACASA-N 1 2 208.305 2.478 20 0 BEADLO CCCc1cnc(NCc2cc[nH+]c(N)c2)nc1 ZINC001167615158 959073701 /nfs/dbraw/zinc/07/37/01/959073701.db2.gz ZNOQDDDFNHMVJI-UHFFFAOYSA-N 1 2 243.314 2.018 20 0 BEADLO Nc1cc(CNc2ccc3[nH]ccc3n2)cc[nH+]1 ZINC001167615834 959078605 /nfs/dbraw/zinc/07/86/05/959078605.db2.gz XMWIWBYWKBMOJD-UHFFFAOYSA-N 1 2 239.282 2.152 20 0 BEADLO Nc1cc(CNc2cnc3ccoc3c2)cc[nH+]1 ZINC001167617409 959091073 /nfs/dbraw/zinc/09/10/73/959091073.db2.gz LXBXRSPWQRTGOJ-UHFFFAOYSA-N 1 2 240.266 2.417 20 0 BEADLO Cc1ccc(NCc2cc[nH+]c(N)c2)c(F)n1 ZINC001167617770 959091701 /nfs/dbraw/zinc/09/17/01/959091701.db2.gz UJRPFUIAPKYZAG-UHFFFAOYSA-N 1 2 232.262 2.118 20 0 BEADLO C[C@@]1(CO)CC[N@H+](Cc2cnc(Cl)s2)C1 ZINC000307231117 959160223 /nfs/dbraw/zinc/16/02/23/959160223.db2.gz CADRYCVSMYAUFL-SNVBAGLBSA-N 1 2 246.763 2.001 20 0 BEADLO C[C@@]1(CO)CC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC000307231117 959160228 /nfs/dbraw/zinc/16/02/28/959160228.db2.gz CADRYCVSMYAUFL-SNVBAGLBSA-N 1 2 246.763 2.001 20 0 BEADLO CCCc1ccn(Cc2c[nH+]ccc2OC)n1 ZINC001327108182 972411248 /nfs/dbraw/zinc/41/12/48/972411248.db2.gz PEQIFCQBQJIVMO-UHFFFAOYSA-N 1 2 231.299 2.288 20 0 BEADLO CCOCC[C@@H](C)[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC001172409498 974670844 /nfs/dbraw/zinc/67/08/44/974670844.db2.gz VMNIBYZHQAOAOL-MNOVXSKESA-N 1 2 245.363 2.121 20 0 BEADLO CC[C@H](CSC)[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000162113449 959497716 /nfs/dbraw/zinc/49/77/16/959497716.db2.gz ZLUSYXKACHVPAI-NXEZZACHSA-N 1 2 247.404 2.448 20 0 BEADLO CC[N@H+](C)Cc1c(F)ccc(OC)c1F ZINC001143969455 972439742 /nfs/dbraw/zinc/43/97/42/972439742.db2.gz CLWFBVZRGWCTRE-UHFFFAOYSA-N 1 2 215.243 2.425 20 0 BEADLO CC[N@@H+](C)Cc1c(F)ccc(OC)c1F ZINC001143969455 972439744 /nfs/dbraw/zinc/43/97/44/972439744.db2.gz CLWFBVZRGWCTRE-UHFFFAOYSA-N 1 2 215.243 2.425 20 0 BEADLO CCCC[N@H+](CC(=O)OCC)Cc1cc[nH]c1 ZINC001140708232 959679620 /nfs/dbraw/zinc/67/96/20/959679620.db2.gz VIJKBOZGKVMQMY-UHFFFAOYSA-N 1 2 238.331 2.180 20 0 BEADLO CCCC[N@@H+](CC(=O)OCC)Cc1cc[nH]c1 ZINC001140708232 959679626 /nfs/dbraw/zinc/67/96/26/959679626.db2.gz VIJKBOZGKVMQMY-UHFFFAOYSA-N 1 2 238.331 2.180 20 0 BEADLO C[C@H]([NH2+]Cc1ccsc1)c1cc(CO)on1 ZINC000309786279 959695955 /nfs/dbraw/zinc/69/59/55/959695955.db2.gz OCZPMSUPDPKMMT-QMMMGPOBSA-N 1 2 238.312 2.079 20 0 BEADLO C[N@@H+](Cc1ccsc1)Cc1cnco1 ZINC001140932545 960098437 /nfs/dbraw/zinc/09/84/37/960098437.db2.gz RKFYQSWGMFHBAK-UHFFFAOYSA-N 1 2 208.286 2.368 20 0 BEADLO C[N@H+](Cc1ccsc1)Cc1cnco1 ZINC001140932545 960098450 /nfs/dbraw/zinc/09/84/50/960098450.db2.gz RKFYQSWGMFHBAK-UHFFFAOYSA-N 1 2 208.286 2.368 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2ccc(CO)o2)C[C@H]1F ZINC001140679024 960493506 /nfs/dbraw/zinc/49/35/06/960493506.db2.gz NXAMDKSEFOJERI-NEPJUHHUSA-N 1 2 245.269 2.044 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2ccc(CO)o2)C[C@H]1F ZINC001140679024 960493513 /nfs/dbraw/zinc/49/35/13/960493513.db2.gz NXAMDKSEFOJERI-NEPJUHHUSA-N 1 2 245.269 2.044 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC(=O)[C@@H](F)CC2)c1C ZINC001140858838 960636438 /nfs/dbraw/zinc/63/64/38/960636438.db2.gz PJWXMZBHKQRKHE-NSHDSACASA-N 1 2 238.306 2.135 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC(=O)[C@@H](F)CC2)c1C ZINC001140858838 960636441 /nfs/dbraw/zinc/63/64/41/960636441.db2.gz PJWXMZBHKQRKHE-NSHDSACASA-N 1 2 238.306 2.135 20 0 BEADLO Cc1c[nH]c(C[N@@H+](C)Cc2cnccn2)c1C ZINC001140862715 960639352 /nfs/dbraw/zinc/63/93/52/960639352.db2.gz JMPGVFCDPQADOY-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1c[nH]c(C[N@H+](C)Cc2cnccn2)c1C ZINC001140862715 960639364 /nfs/dbraw/zinc/63/93/64/960639364.db2.gz JMPGVFCDPQADOY-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1c[nH]c(C[NH+]2CC(OC(C)C)C2)c1C ZINC001140862197 960640213 /nfs/dbraw/zinc/64/02/13/960640213.db2.gz YPKYMWHPLYIGEY-UHFFFAOYSA-N 1 2 222.332 2.241 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccs2)[nH]n1 ZINC001203075294 960666591 /nfs/dbraw/zinc/66/65/91/960666591.db2.gz CMGZVTHVFZAZLE-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccs2)[nH]n1 ZINC001203075294 960666595 /nfs/dbraw/zinc/66/65/95/960666595.db2.gz CMGZVTHVFZAZLE-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO c1nn[nH]c1C[NH2+]Cc1csc2ccccc12 ZINC000398423687 960676208 /nfs/dbraw/zinc/67/62/08/960676208.db2.gz ZQCJEJXIKHOSLK-UHFFFAOYSA-N 1 2 244.323 2.309 20 0 BEADLO FC(F)(F)c1ccncc1C[NH+]1CCC1 ZINC001140914613 960684439 /nfs/dbraw/zinc/68/44/39/960684439.db2.gz QGTQUPAEJFPQQJ-UHFFFAOYSA-N 1 2 216.206 2.306 20 0 BEADLO C[N@H+](Cc1cnco1)Cc1cccc(O)c1 ZINC001140927201 960687631 /nfs/dbraw/zinc/68/76/31/960687631.db2.gz IYCRFNILOAGEDJ-UHFFFAOYSA-N 1 2 218.256 2.012 20 0 BEADLO C[N@@H+](Cc1cnco1)Cc1cccc(O)c1 ZINC001140927201 960687641 /nfs/dbraw/zinc/68/76/41/960687641.db2.gz IYCRFNILOAGEDJ-UHFFFAOYSA-N 1 2 218.256 2.012 20 0 BEADLO C[C@@H]1C[C@@H](C)CN(c2cc(N(C)C)[nH+]cn2)C1 ZINC000585414997 960759567 /nfs/dbraw/zinc/75/95/67/960759567.db2.gz GWZWTNOQYREQDX-GHMZBOCLSA-N 1 2 234.347 2.025 20 0 BEADLO C[C@@H]1C[C@@H](C)CN(c2cc(N(C)C)nc[nH+]2)C1 ZINC000585414997 960759593 /nfs/dbraw/zinc/75/95/93/960759593.db2.gz GWZWTNOQYREQDX-GHMZBOCLSA-N 1 2 234.347 2.025 20 0 BEADLO Cc1cc(C[N@@H+]2CCn3cccc3[C@@H]2C)[nH]n1 ZINC001203082436 960771134 /nfs/dbraw/zinc/77/11/34/960771134.db2.gz RBQYPLBHFJSVGP-NSHDSACASA-N 1 2 230.315 2.096 20 0 BEADLO Cc1cc(C[N@H+]2CCn3cccc3[C@@H]2C)[nH]n1 ZINC001203082436 960771150 /nfs/dbraw/zinc/77/11/50/960771150.db2.gz RBQYPLBHFJSVGP-NSHDSACASA-N 1 2 230.315 2.096 20 0 BEADLO Cc1ncoc1C[N@@H+]1CCc2occc2C1 ZINC001141053375 960844867 /nfs/dbraw/zinc/84/48/67/960844867.db2.gz DTQNQCHLOGJPKK-UHFFFAOYSA-N 1 2 218.256 2.134 20 0 BEADLO Cc1ncoc1C[N@H+]1CCc2occc2C1 ZINC001141053375 960844868 /nfs/dbraw/zinc/84/48/68/960844868.db2.gz DTQNQCHLOGJPKK-UHFFFAOYSA-N 1 2 218.256 2.134 20 0 BEADLO CCCCc1[nH]c(CN2C[C@H]3CC[C@@H](C2)O3)c[nH+]1 ZINC001141067908 960858137 /nfs/dbraw/zinc/85/81/37/960858137.db2.gz QYRSXZPAGWLMCH-BETUJISGSA-N 1 2 249.358 2.116 20 0 BEADLO CCCCc1[nH]cc(CN2C[C@H]3CC[C@@H](C2)O3)[nH+]1 ZINC001141067908 960858140 /nfs/dbraw/zinc/85/81/40/960858140.db2.gz QYRSXZPAGWLMCH-BETUJISGSA-N 1 2 249.358 2.116 20 0 BEADLO CCCCc1ncc(C[N@@H+]2CC[C@@H](C(C)=O)C2)[nH]1 ZINC001141071108 960858812 /nfs/dbraw/zinc/85/88/12/960858812.db2.gz BTDMYBIHFWDUGG-GFCCVEGCSA-N 1 2 249.358 2.163 20 0 BEADLO CCCCc1ncc(C[N@H+]2CC[C@@H](C(C)=O)C2)[nH]1 ZINC001141071108 960858827 /nfs/dbraw/zinc/85/88/27/960858827.db2.gz BTDMYBIHFWDUGG-GFCCVEGCSA-N 1 2 249.358 2.163 20 0 BEADLO CCCCc1nc(C[N@@H+]2CC[C@@H](C(C)=O)C2)c[nH]1 ZINC001141071108 960858838 /nfs/dbraw/zinc/85/88/38/960858838.db2.gz BTDMYBIHFWDUGG-GFCCVEGCSA-N 1 2 249.358 2.163 20 0 BEADLO CCCCc1nc(C[N@H+]2CC[C@@H](C(C)=O)C2)c[nH]1 ZINC001141071108 960858842 /nfs/dbraw/zinc/85/88/42/960858842.db2.gz BTDMYBIHFWDUGG-GFCCVEGCSA-N 1 2 249.358 2.163 20 0 BEADLO CCCCc1[nH]c(CN2CC(C)(F)C2)c[nH+]1 ZINC001141067912 960859898 /nfs/dbraw/zinc/85/98/98/960859898.db2.gz RJEYXMRSJRLOFW-UHFFFAOYSA-N 1 2 225.311 2.296 20 0 BEADLO CCCCc1[nH]cc(CN2CC[C@@H](F)C2)[nH+]1 ZINC001141067393 960863122 /nfs/dbraw/zinc/86/31/22/960863122.db2.gz AMUAZNIYVBTCJH-SNVBAGLBSA-N 1 2 225.311 2.296 20 0 BEADLO CCCCc1[nH]c(CN2CC[C@@H](F)C2)c[nH+]1 ZINC001141067393 960863125 /nfs/dbraw/zinc/86/31/25/960863125.db2.gz AMUAZNIYVBTCJH-SNVBAGLBSA-N 1 2 225.311 2.296 20 0 BEADLO C[C@H](C(=O)N(C)Cc1ccccc1)n1cc[nH+]c1 ZINC000053898559 961173292 /nfs/dbraw/zinc/17/32/92/961173292.db2.gz BZWQQTSTEOLXEV-GFCCVEGCSA-N 1 2 243.310 2.103 20 0 BEADLO Cc1cc(C)c2ccc(NC=[NH2+])nc2n1 ZINC001167865224 961338339 /nfs/dbraw/zinc/33/83/39/961338339.db2.gz UOGCRUXDXSBIRC-UHFFFAOYSA-N 1 2 200.245 2.266 20 0 BEADLO Cc1nc(NC2CSC2)cc(C(C)C)[nH+]1 ZINC000709808730 961625303 /nfs/dbraw/zinc/62/53/03/961625303.db2.gz AUSPPFWYWSBNQN-UHFFFAOYSA-N 1 2 223.345 2.436 20 0 BEADLO CCCOC1C[NH+](Cc2cccc3[nH]cnc32)C1 ZINC001142686539 961625864 /nfs/dbraw/zinc/62/58/64/961625864.db2.gz FIZWRPZNMZVLSM-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO C[N@H+](Cc1ccno1)Cc1cccc2nc[nH]c21 ZINC001142692438 961628507 /nfs/dbraw/zinc/62/85/07/961628507.db2.gz CWEGYAWUKFFBDO-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO C[N@@H+](Cc1ccno1)Cc1cccc2nc[nH]c21 ZINC001142692438 961628512 /nfs/dbraw/zinc/62/85/12/961628512.db2.gz CWEGYAWUKFFBDO-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO COc1ccccc1C[NH+]1CC2(C1)CCCCO2 ZINC001203424971 961693576 /nfs/dbraw/zinc/69/35/76/961693576.db2.gz DSCGUJNTFGVBFX-UHFFFAOYSA-N 1 2 247.338 2.450 20 0 BEADLO COCC1C[NH+](Cc2csc(Cl)c2)C1 ZINC001142760433 961709429 /nfs/dbraw/zinc/70/94/29/961709429.db2.gz TVYJXOAUTIFDNH-UHFFFAOYSA-N 1 2 231.748 2.480 20 0 BEADLO COc1cc(C)cc(C[NH+]2CC(C)(OC)C2)c1 ZINC001143149579 961888724 /nfs/dbraw/zinc/88/87/24/961888724.db2.gz GXAFQUIMNDYGAF-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO COc1cc(C)cc(C[NH+]2CC3(C2)CCCO3)c1 ZINC001143153398 961890729 /nfs/dbraw/zinc/89/07/29/961890729.db2.gz MBDYGRHVZLWSHH-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO C[C@@H]1C[NH+](Cc2cc3cccnc3[nH]2)C[C@@H](C)O1 ZINC001143212453 961956516 /nfs/dbraw/zinc/95/65/16/961956516.db2.gz QSFWVZAFYMSADE-GHMZBOCLSA-N 1 2 245.326 2.172 20 0 BEADLO CC1(C)COCC[N@@H+]1Cc1cc2cccnc2[nH]1 ZINC001143220099 961960981 /nfs/dbraw/zinc/96/09/81/961960981.db2.gz FMMDRPIXGFCPEJ-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO CC1(C)COCC[N@H+]1Cc1cc2cccnc2[nH]1 ZINC001143220099 961960999 /nfs/dbraw/zinc/96/09/99/961960999.db2.gz FMMDRPIXGFCPEJ-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO CCOC(=O)[C@@H]1CCC[C@H]1Oc1cc[nH+]cc1 ZINC001225290547 962051550 /nfs/dbraw/zinc/05/15/50/962051550.db2.gz AMSFVRRCRQXILM-VXGBXAGGSA-N 1 2 235.283 2.192 20 0 BEADLO Oc1ccc(C[NH+]2Cc3ccccc3C2)nc1 ZINC000133777401 962668180 /nfs/dbraw/zinc/66/81/80/962668180.db2.gz JKLYIIJMANAWAW-UHFFFAOYSA-N 1 2 226.279 2.303 20 0 BEADLO Nc1ccc[nH+]c1Nc1ccc2c(c1)OCC2 ZINC001206652069 962713667 /nfs/dbraw/zinc/71/36/67/962713667.db2.gz ARKYIULBPXBBFL-UHFFFAOYSA-N 1 2 227.267 2.342 20 0 BEADLO COc1ccc(C[N@@H+]2CCC[C@@H]2CF)nc1 ZINC000293188190 962818172 /nfs/dbraw/zinc/81/81/72/962818172.db2.gz WJCANTDVEUGEFS-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO COc1ccc(C[N@H+]2CCC[C@@H]2CF)nc1 ZINC000293188190 962818175 /nfs/dbraw/zinc/81/81/75/962818175.db2.gz WJCANTDVEUGEFS-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO C=Cc1ccc(NCCN2CCCCC2=O)[nH+]c1 ZINC001154627966 962817548 /nfs/dbraw/zinc/81/75/48/962817548.db2.gz BAHIWRBQIZCVPK-UHFFFAOYSA-N 1 2 245.326 2.149 20 0 BEADLO Cc1cc(Cl)c(C)c(NCC2COC2)[nH+]1 ZINC001154633655 962820153 /nfs/dbraw/zinc/82/01/53/962820153.db2.gz DGIDFMLYSNKGSQ-UHFFFAOYSA-N 1 2 226.707 2.410 20 0 BEADLO CSCc1ccc(NCC2COC2)[nH+]c1 ZINC001154637585 962824697 /nfs/dbraw/zinc/82/46/97/962824697.db2.gz DJGLUWNSNKYXQE-UHFFFAOYSA-N 1 2 224.329 2.003 20 0 BEADLO C[C@H](C(=O)N1CCCCC[C@H]1C)n1cc[nH+]c1 ZINC001154674976 962833519 /nfs/dbraw/zinc/83/35/19/962833519.db2.gz KYRBIERCVXLMRI-VXGBXAGGSA-N 1 2 235.331 2.235 20 0 BEADLO COc1ccc[nH+]c1NCCn1nc(C)cc1C ZINC001154785632 962846679 /nfs/dbraw/zinc/84/66/79/962846679.db2.gz VMWNABZRNYVAKC-UHFFFAOYSA-N 1 2 246.314 2.016 20 0 BEADLO Cc1oncc1CNc1ccc(Cl)c(N)[nH+]1 ZINC001154887314 962884070 /nfs/dbraw/zinc/88/40/70/962884070.db2.gz IDBFBTNTHIUAFX-UHFFFAOYSA-N 1 2 238.678 2.226 20 0 BEADLO COc1cc(C)c[nH+]c1N[C@@H](CO)CC(C)C ZINC001154959941 962922309 /nfs/dbraw/zinc/92/23/09/962922309.db2.gz CWYATNGTTGRKND-LLVKDONJSA-N 1 2 238.331 2.218 20 0 BEADLO c1cc(C2CC2)cc(NCCN2CCCCO2)[nH+]1 ZINC001155002053 962939371 /nfs/dbraw/zinc/93/93/71/962939371.db2.gz IJHVFBHHZSEYQS-UHFFFAOYSA-N 1 2 247.342 2.398 20 0 BEADLO CC(C)CNc1cc(C2(C)OCCO2)cc[nH+]1 ZINC001161644512 962972756 /nfs/dbraw/zinc/97/27/56/962972756.db2.gz AESDDLJNYZEIJQ-UHFFFAOYSA-N 1 2 236.315 2.369 20 0 BEADLO COc1cc(C)c[nH+]c1NCc1cccn1C ZINC001155213359 963026196 /nfs/dbraw/zinc/02/61/96/963026196.db2.gz VMVCGOMNZLOMOX-UHFFFAOYSA-N 1 2 231.299 2.349 20 0 BEADLO Cc1cc(F)cc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)c1 ZINC001143580635 963167367 /nfs/dbraw/zinc/16/73/67/963167367.db2.gz QEXLFMFBPQDREH-OKILXGFUSA-N 1 2 235.302 2.497 20 0 BEADLO Cc1cc(F)cc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c1 ZINC001143580635 963167372 /nfs/dbraw/zinc/16/73/72/963167372.db2.gz QEXLFMFBPQDREH-OKILXGFUSA-N 1 2 235.302 2.497 20 0 BEADLO Cc1ncoc1C[NH2+][C@H]1COCc2ccccc21 ZINC000895026764 963180160 /nfs/dbraw/zinc/18/01/60/963180160.db2.gz ZRVHXORJVTZAEH-ZDUSSCGKSA-N 1 2 244.294 2.344 20 0 BEADLO CC[C@@H](C)Nc1ccc2c([nH+]1)CCOC2 ZINC001167998832 963206437 /nfs/dbraw/zinc/20/64/37/963206437.db2.gz KVCVBHDRFFUHIN-SECBINFHSA-N 1 2 206.289 2.365 20 0 BEADLO CC[C@@H](C)Nc1[nH+]cnc2[nH]cc(F)c21 ZINC001168000443 963221542 /nfs/dbraw/zinc/22/15/42/963221542.db2.gz QAIQJZDNEVYDEU-ZCFIWIBFSA-N 1 2 208.240 2.307 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H]2C[C@H]2C2CCC2)c[nH+]1 ZINC001156537929 963378243 /nfs/dbraw/zinc/37/82/43/963378243.db2.gz DKBBHFDZPMMATJ-NWDGAFQWSA-N 1 2 247.342 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H]2C[C@H]2C2CCC2)[nH+]1 ZINC001156537929 963378247 /nfs/dbraw/zinc/37/82/47/963378247.db2.gz DKBBHFDZPMMATJ-NWDGAFQWSA-N 1 2 247.342 2.025 20 0 BEADLO CSc1cccnc1NCc1cc[nH+]c(N)c1 ZINC001156757086 963453198 /nfs/dbraw/zinc/45/31/98/963453198.db2.gz KMIANDADFHVDQW-UHFFFAOYSA-N 1 2 246.339 2.393 20 0 BEADLO Nc1cc(CNc2nccc3ccoc32)cc[nH+]1 ZINC001156756386 963453790 /nfs/dbraw/zinc/45/37/90/963453790.db2.gz WVMOLFANSOJYIS-UHFFFAOYSA-N 1 2 240.266 2.417 20 0 BEADLO Nc1cc(CNc2nccc3occc32)cc[nH+]1 ZINC001156756183 963455630 /nfs/dbraw/zinc/45/56/30/963455630.db2.gz QTFAZKGFQWKWIB-UHFFFAOYSA-N 1 2 240.266 2.417 20 0 BEADLO CCCN(C)c1nc(N2CCCC2)c(C)c[nH+]1 ZINC001156871896 963476902 /nfs/dbraw/zinc/47/69/02/963476902.db2.gz KTVOSQWLIHDCOI-UHFFFAOYSA-N 1 2 234.347 2.231 20 0 BEADLO Cc1c(F)cc[nH+]c1NC(C)(C)CCO ZINC001156910450 963491788 /nfs/dbraw/zinc/49/17/88/963491788.db2.gz USVWOOACGYIONS-UHFFFAOYSA-N 1 2 212.268 2.102 20 0 BEADLO CSc1nc(NC(C)(C)CCO)cc(C)[nH+]1 ZINC001156905033 963492725 /nfs/dbraw/zinc/49/27/25/963492725.db2.gz BYMHDUXUYBEIQK-UHFFFAOYSA-N 1 2 241.360 2.080 20 0 BEADLO CSc1cc[nH+]c(NC(C)(C)CCO)c1 ZINC001156913344 963495650 /nfs/dbraw/zinc/49/56/50/963495650.db2.gz MQUUFIRFCFANBE-UHFFFAOYSA-N 1 2 226.345 2.376 20 0 BEADLO CCc1cc(N[C@@H](C)[C@@H]2CCOC2)nc(CC)[nH+]1 ZINC001355242629 963509992 /nfs/dbraw/zinc/50/99/92/963509992.db2.gz DKIRRCOLNMGXSZ-WDEREUQCSA-N 1 2 249.358 2.438 20 0 BEADLO CCOC(=O)c1cc(NC=[NH2+])nc2ccccc21 ZINC001157078392 963520956 /nfs/dbraw/zinc/52/09/56/963520956.db2.gz LJJKQZCLTXJJSN-UHFFFAOYSA-N 1 2 243.266 2.430 20 0 BEADLO Cc1cc(N(C)Cc2ccno2)nc(C2CC2)[nH+]1 ZINC001157355587 963582608 /nfs/dbraw/zinc/58/26/08/963582608.db2.gz RSGZDSIVLVGVHL-UHFFFAOYSA-N 1 2 244.298 2.287 20 0 BEADLO CCN(c1nc(C)ccc1Cl)C1C[NH+](C)C1 ZINC001157455201 963614955 /nfs/dbraw/zinc/61/49/55/963614955.db2.gz CNORWNQBQGFMBU-UHFFFAOYSA-N 1 2 239.750 2.184 20 0 BEADLO CCN(c1cc(Cl)ncc1F)C1C[NH+](C)C1 ZINC001157455381 963615258 /nfs/dbraw/zinc/61/52/58/963615258.db2.gz IWNPCSNHQWZVJG-UHFFFAOYSA-N 1 2 243.713 2.014 20 0 BEADLO Cc1cc(NCC2CC(=O)C2)nc(C(C)C)[nH+]1 ZINC001157608331 963676364 /nfs/dbraw/zinc/67/63/64/963676364.db2.gz BDHNODNKWYKMDB-UHFFFAOYSA-N 1 2 233.315 2.299 20 0 BEADLO Cc1nc(NC[C@H]2CC(C)(C)O2)c2c([nH+]1)CCC2 ZINC001157660329 963691683 /nfs/dbraw/zinc/69/16/83/963691683.db2.gz JKEZHWPOYUZADJ-SNVBAGLBSA-N 1 2 247.342 2.253 20 0 BEADLO CC1(C)C[C@H](CNc2cc(N)cc(Cl)[nH+]2)O1 ZINC001157663178 963694281 /nfs/dbraw/zinc/69/42/81/963694281.db2.gz QVZNQWACLKOIRV-MRVPVSSYSA-N 1 2 241.722 2.297 20 0 BEADLO CC(C)(C)[C@H](CO)Nc1ccc(Cl)c(N)[nH+]1 ZINC001157762839 963718040 /nfs/dbraw/zinc/71/80/40/963718040.db2.gz KHPQPASBYKCCPY-QMMMGPOBSA-N 1 2 243.738 2.136 20 0 BEADLO CC(C)(C)c1ccc(N[C@H]2COC(=O)C2)[nH+]c1 ZINC001158251707 963840315 /nfs/dbraw/zinc/84/03/15/963840315.db2.gz PHDZEICRMDJEPM-SNVBAGLBSA-N 1 2 234.299 2.107 20 0 BEADLO C[C@@H](C(=O)N(C)Cc1ccccc1)n1cc[nH+]c1 ZINC000053898558 963842462 /nfs/dbraw/zinc/84/24/62/963842462.db2.gz BZWQQTSTEOLXEV-LBPRGKRZSA-N 1 2 243.310 2.103 20 0 BEADLO Nc1cc(N[C@H](C2CCC2)C(F)(F)F)[nH+]cn1 ZINC001158400889 963859568 /nfs/dbraw/zinc/85/95/68/963859568.db2.gz HXSIMTLCXKUAKP-SECBINFHSA-N 1 2 246.236 2.202 20 0 BEADLO COc1c[nH+]c(N[C@@H](C)c2cnccn2)c(C)c1 ZINC001158597568 963893102 /nfs/dbraw/zinc/89/31/02/963893102.db2.gz XZOCPWOCTUVGCN-JTQLQIEISA-N 1 2 244.298 2.362 20 0 BEADLO Cc1nc(N(C)CC(F)F)c(C)c(C)[nH+]1 ZINC001158933520 963960690 /nfs/dbraw/zinc/96/06/90/963960690.db2.gz BJMALKGWPZJZNG-UHFFFAOYSA-N 1 2 215.247 2.103 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@@H+]1C1CCC(C)CC1 ZINC001168210712 963990059 /nfs/dbraw/zinc/99/00/59/963990059.db2.gz XAHPRUJURBMGHU-ADPBJBESSA-N 1 2 243.322 2.151 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@H+]1C1CCC(C)CC1 ZINC001168210712 963990067 /nfs/dbraw/zinc/99/00/67/963990067.db2.gz XAHPRUJURBMGHU-ADPBJBESSA-N 1 2 243.322 2.151 20 0 BEADLO Cc1cc(N[C@H]2C[C@@H](CO)C2)[nH+]c2cc[nH]c21 ZINC001168246424 964058540 /nfs/dbraw/zinc/05/85/40/964058540.db2.gz KFTVIXJEVJIGTQ-AOOOYVTPSA-N 1 2 231.299 2.054 20 0 BEADLO Cc1ccc(-c2noc(C[NH+]3CCC3)n2)c(F)c1 ZINC001212093348 964253430 /nfs/dbraw/zinc/25/34/30/964253430.db2.gz RXHUJYHHESHHKW-UHFFFAOYSA-N 1 2 247.273 2.390 20 0 BEADLO CCCN(CCC)C(=O)CCc1ccc(N)[nH+]c1 ZINC001160861328 964423177 /nfs/dbraw/zinc/42/31/77/964423177.db2.gz PYCUCGMRCWXDPU-UHFFFAOYSA-N 1 2 249.358 2.245 20 0 BEADLO CC(C)(C)CNc1ccn2cc(N)[nH+]c2c1 ZINC001161639625 964657202 /nfs/dbraw/zinc/65/72/02/964657202.db2.gz YMVRHLVKBLUSOQ-UHFFFAOYSA-N 1 2 218.304 2.375 20 0 BEADLO Cc1ccc(NCCCn2cc[nH+]c2)c(F)n1 ZINC001161684773 964682791 /nfs/dbraw/zinc/68/27/91/964682791.db2.gz OQXDQHWWUNHYTG-UHFFFAOYSA-N 1 2 234.278 2.228 20 0 BEADLO CCc1ccncc1NCCCn1cc[nH+]c1 ZINC001161687805 964683695 /nfs/dbraw/zinc/68/36/95/964683695.db2.gz DXEKHJUDIJOCBX-UHFFFAOYSA-N 1 2 230.315 2.343 20 0 BEADLO CC(C)[C@H](CO)Nc1ccc(N2CCCC2)[nH+]c1 ZINC001161740900 964725452 /nfs/dbraw/zinc/72/54/52/964725452.db2.gz WXRJAUUJRDYCDS-ZDUSSCGKSA-N 1 2 249.358 2.111 20 0 BEADLO Cc1cc(NCc2cnn(C)c2)[nH+]c2cc[nH]c21 ZINC001161856498 964793592 /nfs/dbraw/zinc/79/35/92/964793592.db2.gz APHKBCQTPLXWDG-UHFFFAOYSA-N 1 2 241.298 2.217 20 0 BEADLO Cc1cccnc1CNc1ccc(N(C)C)c[nH+]1 ZINC001161886940 964808250 /nfs/dbraw/zinc/80/82/50/964808250.db2.gz QDPSYXLODFPURU-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO Cc1c(F)cc[nH+]c1NC1(c2cnccn2)CC1 ZINC001161945390 964829682 /nfs/dbraw/zinc/82/96/82/964829682.db2.gz XVJXATFMOXJWSF-UHFFFAOYSA-N 1 2 244.273 2.420 20 0 BEADLO Cc1nccnc1CNc1ccc(Cl)c(N)[nH+]1 ZINC001162003421 964844789 /nfs/dbraw/zinc/84/47/89/964844789.db2.gz DMNVEHSPDIZMPI-UHFFFAOYSA-N 1 2 249.705 2.028 20 0 BEADLO COc1cc[nH+]cc1NCCn1nc(C)cc1C ZINC001162148856 964858200 /nfs/dbraw/zinc/85/82/00/964858200.db2.gz RGJPPXBUDKXUQF-UHFFFAOYSA-N 1 2 246.314 2.016 20 0 BEADLO C[C@H](CCO)[NH2+]CC(F)(F)c1ccccc1 ZINC000161174422 964877833 /nfs/dbraw/zinc/87/78/33/964877833.db2.gz HTBDPGIZZXXSEV-SNVBAGLBSA-N 1 2 229.270 2.139 20 0 BEADLO Cc1oncc1CNc1ccc2c([nH+]1)CCOC2 ZINC001162270002 964896831 /nfs/dbraw/zinc/89/68/31/964896831.db2.gz YVCLLJDNGWIFLR-UHFFFAOYSA-N 1 2 245.282 2.063 20 0 BEADLO CCOc1ccc[nH+]c1N[C@@H]1C[C@]12CCCOC2 ZINC001162381037 964948783 /nfs/dbraw/zinc/94/87/83/964948783.db2.gz PECQUNAFUVIJCN-OCCSQVGLSA-N 1 2 248.326 2.461 20 0 BEADLO Cc1cc[nH+]c(Nc2cc(C)c(=O)n(C)c2)c1 ZINC001162504493 965004749 /nfs/dbraw/zinc/00/47/49/965004749.db2.gz BBVSEBHDWOGFTK-UHFFFAOYSA-N 1 2 229.283 2.141 20 0 BEADLO Cc1ncc(CNc2c[nH+]c(C)c(C)c2)cn1 ZINC001168387212 965112351 /nfs/dbraw/zinc/11/23/51/965112351.db2.gz ZANJCMNLFKRTJZ-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO CSc1cc(NCc2cccn2C)nc(C)[nH+]1 ZINC001162704094 965129862 /nfs/dbraw/zinc/12/98/62/965129862.db2.gz IPMIVXGATFVKLA-UHFFFAOYSA-N 1 2 248.355 2.458 20 0 BEADLO c1csc(NCc2ccn3cc[nH+]c3c2)n1 ZINC001162793566 965184005 /nfs/dbraw/zinc/18/40/05/965184005.db2.gz WKQAINQDQCRSOG-UHFFFAOYSA-N 1 2 230.296 2.403 20 0 BEADLO O=C(CCc1ccccc1)OCCn1cc[nH+]c1 ZINC000059219604 965245666 /nfs/dbraw/zinc/24/56/66/965245666.db2.gz JKJTTYSOALFSJY-UHFFFAOYSA-N 1 2 244.294 2.059 20 0 BEADLO C[C@@H](Nc1cc(N)cc(Cl)[nH+]1)c1ccno1 ZINC001163208293 965304543 /nfs/dbraw/zinc/30/45/43/965304543.db2.gz ISBZBJWMZMLFRZ-ZCFIWIBFSA-N 1 2 238.678 2.478 20 0 BEADLO Cc1[nH]c(CN(Cc2ccco2)C2CC2)c[nH+]1 ZINC001232464387 965356172 /nfs/dbraw/zinc/35/61/72/965356172.db2.gz BICHVAZNTCXZON-UHFFFAOYSA-N 1 2 231.299 2.476 20 0 BEADLO Cc1[nH]cc(CN(Cc2ccco2)C2CC2)[nH+]1 ZINC001232464387 965356184 /nfs/dbraw/zinc/35/61/84/965356184.db2.gz BICHVAZNTCXZON-UHFFFAOYSA-N 1 2 231.299 2.476 20 0 BEADLO COc1c[nH+]c(N[C@@H](C)[C@@H]2CCCO2)c(C)c1 ZINC001163479296 965415288 /nfs/dbraw/zinc/41/52/88/965415288.db2.gz SNBTXKXYIAFYKS-JQWIXIFHSA-N 1 2 236.315 2.378 20 0 BEADLO CCCN(CCC)c1cc(N2CCC2)nc[nH+]1 ZINC001163538328 965434482 /nfs/dbraw/zinc/43/44/82/965434482.db2.gz ZASJXMSTABWWLZ-UHFFFAOYSA-N 1 2 234.347 2.313 20 0 BEADLO CCCN(CCC)c1cc(N2CCC2)[nH+]cn1 ZINC001163538328 965434490 /nfs/dbraw/zinc/43/44/90/965434490.db2.gz ZASJXMSTABWWLZ-UHFFFAOYSA-N 1 2 234.347 2.313 20 0 BEADLO Cc1cnsc1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC001233318306 965488625 /nfs/dbraw/zinc/48/86/25/965488625.db2.gz YSUATIJKLWHXKU-AOOOYVTPSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1cnsc1C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC001233318306 965488635 /nfs/dbraw/zinc/48/86/35/965488635.db2.gz YSUATIJKLWHXKU-AOOOYVTPSA-N 1 2 226.345 2.061 20 0 BEADLO CCCN(CCOC)c1[nH+]ccc(F)c1C ZINC001163647190 965494412 /nfs/dbraw/zinc/49/44/12/965494412.db2.gz IFRJCYRHMXMKGI-UHFFFAOYSA-N 1 2 226.295 2.392 20 0 BEADLO CCN(CC)c1cc(N2CC(C)(C)C2)nc[nH+]1 ZINC001163727289 965540846 /nfs/dbraw/zinc/54/08/46/965540846.db2.gz PGJZDVDDVKSURR-UHFFFAOYSA-N 1 2 234.347 2.169 20 0 BEADLO CCN(CC)c1cc(N2CC(C)(C)C2)[nH+]cn1 ZINC001163727289 965540854 /nfs/dbraw/zinc/54/08/54/965540854.db2.gz PGJZDVDDVKSURR-UHFFFAOYSA-N 1 2 234.347 2.169 20 0 BEADLO COC(=O)c1c(C)cc(C)[nH+]c1N1CC(C)(C)C1 ZINC001163725097 965541163 /nfs/dbraw/zinc/54/11/63/965541163.db2.gz ZCXXFHMDQRDENU-UHFFFAOYSA-N 1 2 248.326 2.331 20 0 BEADLO COCC1CN(c2[nH+]c(C)cc(Cl)c2C)C1 ZINC001163732550 965548787 /nfs/dbraw/zinc/54/87/87/965548787.db2.gz GLCCWVOTZOSKHM-UHFFFAOYSA-N 1 2 240.734 2.434 20 0 BEADLO CCCOCCNc1[nH+]cccc1OCC ZINC000714961288 965568543 /nfs/dbraw/zinc/56/85/43/965568543.db2.gz SZOLDKUOQSFSRP-UHFFFAOYSA-N 1 2 224.304 2.319 20 0 BEADLO Nc1ccc[nH+]c1N1CCC(=O)[C@H]2CCCC[C@@H]21 ZINC001163790574 965590844 /nfs/dbraw/zinc/59/08/44/965590844.db2.gz NLDTXJWCZDJUSW-JQWIXIFHSA-N 1 2 245.326 2.002 20 0 BEADLO CCCc1cc(N2CC=CC2)nc(C)[nH+]1 ZINC001163918701 965629272 /nfs/dbraw/zinc/62/92/72/965629272.db2.gz MCNOGWMFYYHGSX-UHFFFAOYSA-N 1 2 203.289 2.114 20 0 BEADLO Cc1nonc1CNc1cc[nH+]c(OC(C)C)c1 ZINC001164058947 965720825 /nfs/dbraw/zinc/72/08/25/965720825.db2.gz FDNDRFCDUXQZLF-UHFFFAOYSA-N 1 2 248.286 2.172 20 0 BEADLO Cc1cc(N2[C@@H](C)CC[C@H]2CO)nc(C2CC2)[nH+]1 ZINC001164309508 965839139 /nfs/dbraw/zinc/83/91/39/965839139.db2.gz KVLQGFALGLUUKP-JQWIXIFHSA-N 1 2 247.342 2.012 20 0 BEADLO Cc1cc(NCC2(CO)CCC2)[nH+]c2cc[nH]c21 ZINC001164366558 965862514 /nfs/dbraw/zinc/86/25/14/965862514.db2.gz OEJNMGGFAPUTFK-UHFFFAOYSA-N 1 2 245.326 2.446 20 0 BEADLO CSc1cc(NCCn2cccc2)nc(C)[nH+]1 ZINC001164443163 965885392 /nfs/dbraw/zinc/88/53/92/965885392.db2.gz PFCQDSPIQXMTLY-UHFFFAOYSA-N 1 2 248.355 2.421 20 0 BEADLO Cc1nc(N2CC(C)(F)C2)cc(C(C)C)[nH+]1 ZINC001164582933 965925375 /nfs/dbraw/zinc/92/53/75/965925375.db2.gz YTRRGBBBICZDDL-UHFFFAOYSA-N 1 2 223.295 2.457 20 0 BEADLO c1cn2c(cccc2Nc2cnoc2)[nH+]1 ZINC001203226807 965998645 /nfs/dbraw/zinc/99/86/45/965998645.db2.gz MXRRZTWLYUMUDA-UHFFFAOYSA-N 1 2 200.201 2.066 20 0 BEADLO Cc1nc(N2C[C@@H]3C[C@@H]3[C@H](F)C2)c2c([nH+]1)CCC2 ZINC001165366465 966068235 /nfs/dbraw/zinc/06/82/35/966068235.db2.gz BJGPQOVXVSQPQU-ZMLRMANQSA-N 1 2 247.317 2.068 20 0 BEADLO C[C@H](Cc1cccc(F)c1)[N@@H+]1CCO[C@@H]2C[C@@H]21 ZINC001168499841 966090657 /nfs/dbraw/zinc/09/06/57/966090657.db2.gz GKHGRUNHPNLFDS-DDTOSNHZSA-N 1 2 235.302 2.230 20 0 BEADLO C[C@H](Cc1cccc(F)c1)[N@H+]1CCO[C@@H]2C[C@@H]21 ZINC001168499841 966090668 /nfs/dbraw/zinc/09/06/68/966090668.db2.gz GKHGRUNHPNLFDS-DDTOSNHZSA-N 1 2 235.302 2.230 20 0 BEADLO C[C@H](CCO)Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001165938635 966210405 /nfs/dbraw/zinc/21/04/05/966210405.db2.gz PAPBWXFKWHDAQV-GFCCVEGCSA-N 1 2 245.326 2.114 20 0 BEADLO COCC(C)(C)Nc1ccc2[nH+]cn(C)c2c1 ZINC001166002373 966231200 /nfs/dbraw/zinc/23/12/00/966231200.db2.gz LNVVLTADMVYFEN-UHFFFAOYSA-N 1 2 233.315 2.410 20 0 BEADLO Cc1c(F)cc[nH+]c1N1CCn2cccc2C1 ZINC001166601838 966317013 /nfs/dbraw/zinc/31/70/13/966317013.db2.gz NZQGCSFTROGLML-UHFFFAOYSA-N 1 2 231.274 2.351 20 0 BEADLO Nc1ccc(-c2ccc3ccc(=O)oc3c2)c[nH+]1 ZINC001236318151 966364937 /nfs/dbraw/zinc/36/49/37/966364937.db2.gz YRMRSLBUVMEFMT-UHFFFAOYSA-N 1 2 238.246 2.437 20 0 BEADLO Cc1cc(N2C[C@@H]3C[C@H]2CO3)nc(C(C)(C)C)[nH+]1 ZINC001166755937 966395009 /nfs/dbraw/zinc/39/50/09/966395009.db2.gz WLBCCVHGWQUOJV-QWRGUYRKSA-N 1 2 247.342 2.060 20 0 BEADLO CCN(c1cc2ccccc2c[nH+]1)C1COC1 ZINC001166941936 966462456 /nfs/dbraw/zinc/46/24/56/966462456.db2.gz MOVJYAFYVVWGMP-UHFFFAOYSA-N 1 2 228.295 2.460 20 0 BEADLO COc1nonc1Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC001213070602 966479426 /nfs/dbraw/zinc/47/94/26/966479426.db2.gz YKKSTRPFTGFUCY-UHFFFAOYSA-N 1 2 245.242 2.007 20 0 BEADLO COc1cc(C)c[nH+]c1N1CCC[C@@H](OC)C1 ZINC001166952696 966479946 /nfs/dbraw/zinc/47/99/46/966479946.db2.gz NAAUBHQDDPJIRR-LLVKDONJSA-N 1 2 236.315 2.014 20 0 BEADLO CCCc1cc(N2CCC[C@@H](OC)C2)nc(C)[nH+]1 ZINC001166952808 966482068 /nfs/dbraw/zinc/48/20/68/966482068.db2.gz VRPWOYKRWCSWKU-CYBMUJFWSA-N 1 2 249.358 2.353 20 0 BEADLO Cc1cncc(C[N@@H+]2CCC[C@](C)(F)C2)n1 ZINC001203163526 966540406 /nfs/dbraw/zinc/54/04/06/966540406.db2.gz DQSQAFBGZKCXBY-LBPRGKRZSA-N 1 2 223.295 2.109 20 0 BEADLO Cc1cncc(C[N@H+]2CCC[C@](C)(F)C2)n1 ZINC001203163526 966540414 /nfs/dbraw/zinc/54/04/14/966540414.db2.gz DQSQAFBGZKCXBY-LBPRGKRZSA-N 1 2 223.295 2.109 20 0 BEADLO C[C@H]1CC[N@H+](Cc2ccco2)CCC1=O ZINC001203273142 966591165 /nfs/dbraw/zinc/59/11/65/966591165.db2.gz UDVPMJYBJJXUCY-JTQLQIEISA-N 1 2 207.273 2.081 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2ccco2)CCC1=O ZINC001203273142 966591174 /nfs/dbraw/zinc/59/11/74/966591174.db2.gz UDVPMJYBJJXUCY-JTQLQIEISA-N 1 2 207.273 2.081 20 0 BEADLO Cc1ccc(Nc2cnc3ccnn3c2)c(C)[nH+]1 ZINC001203370618 966618906 /nfs/dbraw/zinc/61/89/06/966618906.db2.gz PTLRVBHRFPRENP-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cc1c(Nc2ccc(C)[nH+]c2C)ncn1C ZINC001203369241 966621271 /nfs/dbraw/zinc/62/12/71/966621271.db2.gz MHLLNDRZQJTXJG-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO CC[N@H+](C)c1ccc(NC2=CCOC2)cc1 ZINC001203397860 966632167 /nfs/dbraw/zinc/63/21/67/966632167.db2.gz HTHWZRMROISRRH-UHFFFAOYSA-N 1 2 218.300 2.469 20 0 BEADLO CC[N@@H+](C)c1ccc(NC2=CCOC2)cc1 ZINC001203397860 966632172 /nfs/dbraw/zinc/63/21/72/966632172.db2.gz HTHWZRMROISRRH-UHFFFAOYSA-N 1 2 218.300 2.469 20 0 BEADLO CNc1ccc(Nc2ncccc2C(C)=O)c[nH+]1 ZINC001203448930 966645757 /nfs/dbraw/zinc/64/57/57/966645757.db2.gz RJRZVFQBFNBBAJ-UHFFFAOYSA-N 1 2 242.282 2.465 20 0 BEADLO CNc1ccc(Nc2cncnc2Cl)c[nH+]1 ZINC001203448579 966646092 /nfs/dbraw/zinc/64/60/92/966646092.db2.gz BEPHGORBVTVPOX-UHFFFAOYSA-N 1 2 235.678 2.310 20 0 BEADLO CNc1ccc(Nc2cccnc2OC)c[nH+]1 ZINC001203446925 966646693 /nfs/dbraw/zinc/64/66/93/966646693.db2.gz HGRSCDBOUOBOSH-UHFFFAOYSA-N 1 2 230.271 2.271 20 0 BEADLO CNc1ccc(Nc2cnnc(Cl)c2)c[nH+]1 ZINC001203446598 966647666 /nfs/dbraw/zinc/64/76/66/966647666.db2.gz FODAOEZZADUITP-UHFFFAOYSA-N 1 2 235.678 2.310 20 0 BEADLO CNc1ccc(Nc2ccnn2CCF)c[nH+]1 ZINC001203451885 966655177 /nfs/dbraw/zinc/65/51/77/966655177.db2.gz FOTAFBHWLOCZOY-UHFFFAOYSA-N 1 2 235.266 2.033 20 0 BEADLO CNc1ccc(Nc2cccc(N)c2O)c[nH+]1 ZINC001203462029 966662802 /nfs/dbraw/zinc/66/28/02/966662802.db2.gz FTROHKAMIXDGDP-UHFFFAOYSA-N 1 2 230.271 2.155 20 0 BEADLO Nc1ccc(Nc2cccc3[nH+]ccn32)c(F)n1 ZINC001203607415 966699577 /nfs/dbraw/zinc/69/95/77/966699577.db2.gz FXLROIXPHVEHGD-UHFFFAOYSA-N 1 2 243.245 2.194 20 0 BEADLO COc1ccoc1C[N@@H+]1C[C@@H]2C[C@@H]2[C@H](F)C1 ZINC001237870649 966699485 /nfs/dbraw/zinc/69/94/85/966699485.db2.gz ZZNZIXDAEJDANB-LPEHRKFASA-N 1 2 225.263 2.078 20 0 BEADLO COc1ccoc1C[N@H+]1C[C@@H]2C[C@@H]2[C@H](F)C1 ZINC001237870649 966699491 /nfs/dbraw/zinc/69/94/91/966699491.db2.gz ZZNZIXDAEJDANB-LPEHRKFASA-N 1 2 225.263 2.078 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2nc(N)cnc2Cl)c1 ZINC001203657586 966721145 /nfs/dbraw/zinc/72/11/45/966721145.db2.gz QHZLNLIVOYXARA-UHFFFAOYSA-N 1 2 249.705 2.468 20 0 BEADLO COc1ccc(N)c(Nc2cc(C)c[nH+]c2C)n1 ZINC001203656585 966723568 /nfs/dbraw/zinc/72/35/68/966723568.db2.gz VXHPRYXTTCHIOI-UHFFFAOYSA-N 1 2 244.298 2.428 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2cnc(N(C)C)nc2)c1 ZINC001203657588 966724234 /nfs/dbraw/zinc/72/42/34/966724234.db2.gz QKNWFQHENXSRJY-UHFFFAOYSA-N 1 2 243.314 2.298 20 0 BEADLO COc1cc(Nc2cc(C)c[nH+]c2C)c(N)cn1 ZINC001203658153 966726987 /nfs/dbraw/zinc/72/69/87/966726987.db2.gz YEWVPVFWKMJREU-UHFFFAOYSA-N 1 2 244.298 2.428 20 0 BEADLO Nc1ccc[nH+]c1Nc1ccc2cncnc2c1 ZINC001203701599 966739558 /nfs/dbraw/zinc/73/95/58/966739558.db2.gz FCAJZFNCJVLJSY-UHFFFAOYSA-N 1 2 237.266 2.351 20 0 BEADLO COc1ccc(C[NH+]2CC(OC)C2)c(C)c1C ZINC001203713952 966741565 /nfs/dbraw/zinc/74/15/65/966741565.db2.gz ZGKFEKAOGHVONW-UHFFFAOYSA-N 1 2 235.327 2.143 20 0 BEADLO CC(=O)[C@@H]1C[N@H+](Cc2ccc(C)cc2C)CCO1 ZINC001203744385 966762972 /nfs/dbraw/zinc/76/29/72/966762972.db2.gz BDXQORRUJVEAIW-HNNXBMFYSA-N 1 2 247.338 2.093 20 0 BEADLO CC(=O)[C@@H]1C[N@@H+](Cc2ccc(C)cc2C)CCO1 ZINC001203744385 966762977 /nfs/dbraw/zinc/76/29/77/966762977.db2.gz BDXQORRUJVEAIW-HNNXBMFYSA-N 1 2 247.338 2.093 20 0 BEADLO COc1cc(C)c(C[NH+]2CC3(CCO3)C2)cc1C ZINC001203761719 966775727 /nfs/dbraw/zinc/77/57/27/966775727.db2.gz YPGCQOALXGUPJE-UHFFFAOYSA-N 1 2 247.338 2.287 20 0 BEADLO Cn1ncc2c1CC[N@H+](Cc1cccc(F)c1)C2 ZINC001203788705 966779722 /nfs/dbraw/zinc/77/97/22/966779722.db2.gz BFVAMUSIMZTONZ-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1ncc2c1CC[N@@H+](Cc1cccc(F)c1)C2 ZINC001203788705 966779732 /nfs/dbraw/zinc/77/97/32/966779732.db2.gz BFVAMUSIMZTONZ-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO COc1ccc(C[N@@H+]2CCC(=O)[C@H](C)C2)cc1C ZINC001203895065 966813052 /nfs/dbraw/zinc/81/30/52/966813052.db2.gz OSENXWHEPXHGCN-GFCCVEGCSA-N 1 2 247.338 2.415 20 0 BEADLO COc1ccc(C[N@H+]2CCC(=O)[C@H](C)C2)cc1C ZINC001203895065 966813054 /nfs/dbraw/zinc/81/30/54/966813054.db2.gz OSENXWHEPXHGCN-GFCCVEGCSA-N 1 2 247.338 2.415 20 0 BEADLO CCCOC1C[NH+](Cc2ccc(OC)cc2)C1 ZINC001203956409 966826870 /nfs/dbraw/zinc/82/68/70/966826870.db2.gz XILXEBKFIFLFRZ-UHFFFAOYSA-N 1 2 235.327 2.306 20 0 BEADLO CCOc1ccc(C[N@H+]2C[C@H]3C[C@@H](C2)O3)cc1 ZINC001203968231 966832008 /nfs/dbraw/zinc/83/20/08/966832008.db2.gz ATVLPMSPAQUYHK-OKILXGFUSA-N 1 2 233.311 2.058 20 0 BEADLO CCOc1ccc(C[N@@H+]2C[C@H]3C[C@@H](C2)O3)cc1 ZINC001203968231 966832017 /nfs/dbraw/zinc/83/20/17/966832017.db2.gz ATVLPMSPAQUYHK-OKILXGFUSA-N 1 2 233.311 2.058 20 0 BEADLO CC[C@H](C)[C@@H](C(=O)OC)[N@H+](C)Cc1ccc[nH]1 ZINC001204011091 966851448 /nfs/dbraw/zinc/85/14/48/966851448.db2.gz IWQBKRXSINCKQN-JQWIXIFHSA-N 1 2 238.331 2.034 20 0 BEADLO CC[C@H](C)[C@@H](C(=O)OC)[N@@H+](C)Cc1ccc[nH]1 ZINC001204011091 966851451 /nfs/dbraw/zinc/85/14/51/966851451.db2.gz IWQBKRXSINCKQN-JQWIXIFHSA-N 1 2 238.331 2.034 20 0 BEADLO Cc1cccc(C[N@@H+]2CCC(=O)[C@H](C)CC2)n1 ZINC001204067251 966876597 /nfs/dbraw/zinc/87/65/97/966876597.db2.gz QELIVDWWAJLDOT-LLVKDONJSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1cccc(C[N@H+]2CCC(=O)[C@H](C)CC2)n1 ZINC001204067251 966876599 /nfs/dbraw/zinc/87/65/99/966876599.db2.gz QELIVDWWAJLDOT-LLVKDONJSA-N 1 2 232.327 2.191 20 0 BEADLO c1ccc2c(C[N@@H+]3CCC34COC4)ccnc2c1 ZINC001204088094 966891848 /nfs/dbraw/zinc/89/18/48/966891848.db2.gz IXDKRAITRJHTBM-UHFFFAOYSA-N 1 2 240.306 2.210 20 0 BEADLO c1ccc2c(C[N@H+]3CCC34COC4)ccnc2c1 ZINC001204088094 966891854 /nfs/dbraw/zinc/89/18/54/966891854.db2.gz IXDKRAITRJHTBM-UHFFFAOYSA-N 1 2 240.306 2.210 20 0 BEADLO c1cn(Cc2ccc(C3=CCOC3)cc2)c[nH+]1 ZINC001239487055 966908952 /nfs/dbraw/zinc/90/89/52/966908952.db2.gz ZWHXCEXLGZGNSI-UHFFFAOYSA-N 1 2 226.279 2.345 20 0 BEADLO Cc1c(F)cccc1C[N@@H+]1CC[C@@H](O)[C@@H](F)C1 ZINC001204507778 967010251 /nfs/dbraw/zinc/01/02/51/967010251.db2.gz KETDGCVVUSELKC-QWHCGFSZSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1c(F)cccc1C[N@H+]1CC[C@@H](O)[C@@H](F)C1 ZINC001204507778 967010264 /nfs/dbraw/zinc/01/02/64/967010264.db2.gz KETDGCVVUSELKC-QWHCGFSZSA-N 1 2 241.281 2.039 20 0 BEADLO c1ccc2nc(C[N@H+]3C[C@H]4C[C@@H](C3)O4)ccc2c1 ZINC001204505925 967011097 /nfs/dbraw/zinc/01/10/97/967011097.db2.gz WJKFYMZCZXFMHU-OKILXGFUSA-N 1 2 240.306 2.208 20 0 BEADLO c1ccc2nc(C[N@@H+]3C[C@H]4C[C@@H](C3)O4)ccc2c1 ZINC001204505925 967011109 /nfs/dbraw/zinc/01/11/09/967011109.db2.gz WJKFYMZCZXFMHU-OKILXGFUSA-N 1 2 240.306 2.208 20 0 BEADLO Cc1c(F)cccc1C[N@@H+]1CCO[C@H](C)C1 ZINC001204507790 967012971 /nfs/dbraw/zinc/01/29/71/967012971.db2.gz KQOMNQQZWPNGMV-SNVBAGLBSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1c(F)cccc1C[N@H+]1CCO[C@H](C)C1 ZINC001204507790 967012976 /nfs/dbraw/zinc/01/29/76/967012976.db2.gz KQOMNQQZWPNGMV-SNVBAGLBSA-N 1 2 223.291 2.355 20 0 BEADLO CC(=O)OC1C[NH+](Cc2cc(C)cc(C)c2)C1 ZINC001204526909 967022582 /nfs/dbraw/zinc/02/25/82/967022582.db2.gz UXLMYZJKBWRQJB-UHFFFAOYSA-N 1 2 233.311 2.051 20 0 BEADLO Cc1cc(C)cc(C[NH+]2CC3(CCO3)C2)c1 ZINC001204526872 967024148 /nfs/dbraw/zinc/02/41/48/967024148.db2.gz UPSQDDHJQMUQGT-UHFFFAOYSA-N 1 2 217.312 2.278 20 0 BEADLO Cc1cc(CN2CCc3c([nH+]cn3C)C2)oc1C ZINC001204532978 967031100 /nfs/dbraw/zinc/03/11/00/967031100.db2.gz KAGJXIMPPFKZPS-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO Cc1cc(C[N@H+]2CCc3c(cnn3C)C2)oc1C ZINC001204540321 967042353 /nfs/dbraw/zinc/04/23/53/967042353.db2.gz WBJOPQKYTPHTMP-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3c(cnn3C)C2)oc1C ZINC001204540321 967042373 /nfs/dbraw/zinc/04/23/73/967042373.db2.gz WBJOPQKYTPHTMP-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO COc1cccc2c1CN(Cc1[nH]c[nH+]c1C)C2 ZINC001204593327 967091840 /nfs/dbraw/zinc/09/18/40/967091840.db2.gz WDWAYFLESVECKW-UHFFFAOYSA-N 1 2 243.310 2.243 20 0 BEADLO Nc1ccc(CC(=O)c2ccccc2)c[nH+]1 ZINC001249885005 967129940 /nfs/dbraw/zinc/12/99/40/967129940.db2.gz MURIZXFRGHVYKP-UHFFFAOYSA-N 1 2 212.252 2.089 20 0 BEADLO CNc1cc(CC(=O)C(C)(C)C)cc[nH+]1 ZINC001249920501 967162467 /nfs/dbraw/zinc/16/24/67/967162467.db2.gz IZEGDVYLTSQOLV-UHFFFAOYSA-N 1 2 206.289 2.281 20 0 BEADLO COC(=O)[C@@H]([NH3+])c1ccc(C2=CCCC2)cc1 ZINC001239788541 967176633 /nfs/dbraw/zinc/17/66/33/967176633.db2.gz DWSXDFVUUPNFEM-ZDUSSCGKSA-N 1 2 231.295 2.427 20 0 BEADLO COc1cc[nH+]c(Nc2ccn3ccnc3c2)c1 ZINC001204950616 967251071 /nfs/dbraw/zinc/25/10/71/967251071.db2.gz AXOIPBLRSLRHKN-UHFFFAOYSA-N 1 2 240.266 2.482 20 0 BEADLO Cc1conc1Nc1ccn2cc[nH+]c2c1 ZINC001204951286 967252574 /nfs/dbraw/zinc/25/25/74/967252574.db2.gz QJQDJQUWTLRWKT-UHFFFAOYSA-N 1 2 214.228 2.374 20 0 BEADLO Cc1coc(Nc2ccn3cc[nH+]c3c2)n1 ZINC001204950646 967252723 /nfs/dbraw/zinc/25/27/23/967252723.db2.gz CMGKMNFYAWTVGH-UHFFFAOYSA-N 1 2 214.228 2.374 20 0 BEADLO Cc1cnc(Nc2ccn3cc[nH+]c3c2)c(C)n1 ZINC001204959669 967260366 /nfs/dbraw/zinc/26/03/66/967260366.db2.gz SVUGYNIVPGMFFH-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Nc1cc(F)cnc1Nc1ccn2cc[nH+]c2c1 ZINC001204959297 967261975 /nfs/dbraw/zinc/26/19/75/967261975.db2.gz LGRRVMRWBYVMGN-UHFFFAOYSA-N 1 2 243.245 2.194 20 0 BEADLO Cn1ncc(Cl)c1Nc1ccn2cc[nH+]c2c1 ZINC001204966489 967265983 /nfs/dbraw/zinc/26/59/83/967265983.db2.gz VGOQOSIIZVFXIE-UHFFFAOYSA-N 1 2 247.689 2.465 20 0 BEADLO FCCn1nccc1Nc1ccn2cc[nH+]c2c1 ZINC001204971777 967269274 /nfs/dbraw/zinc/26/92/74/967269274.db2.gz PSFWEIDGZJGPCP-UHFFFAOYSA-N 1 2 245.261 2.244 20 0 BEADLO Nc1cccc2c1cnn2-c1ccn2cc[nH+]c2c1 ZINC001204977106 967273096 /nfs/dbraw/zinc/27/30/96/967273096.db2.gz BTSDHLWAOYYPTL-UHFFFAOYSA-N 1 2 249.277 2.255 20 0 BEADLO CCOc1cc(C[NH+]2CC(C(F)F)C2)ccn1 ZINC001250018689 967276761 /nfs/dbraw/zinc/27/67/61/967276761.db2.gz GIULWZQVTDXYDP-UHFFFAOYSA-N 1 2 242.269 2.177 20 0 BEADLO FC(F)(F)Cc1ccc[nH+]c1N1CCOCC1 ZINC001250030053 967279949 /nfs/dbraw/zinc/27/99/49/967279949.db2.gz JLFWUNCSDXSFAC-UHFFFAOYSA-N 1 2 246.232 2.023 20 0 BEADLO Cn1cc(C[N@H+](Cc2ccco2)C2CC2)cn1 ZINC001205015262 967292819 /nfs/dbraw/zinc/29/28/19/967292819.db2.gz IJCAVGWASRYUOA-UHFFFAOYSA-N 1 2 231.299 2.178 20 0 BEADLO Cn1cc(C[N@@H+](Cc2ccco2)C2CC2)cn1 ZINC001205015262 967292829 /nfs/dbraw/zinc/29/28/29/967292829.db2.gz IJCAVGWASRYUOA-UHFFFAOYSA-N 1 2 231.299 2.178 20 0 BEADLO Cn1ccnc1C[N@@H+]1CCCC[C@](C)(F)C1 ZINC001205111442 967359000 /nfs/dbraw/zinc/35/90/00/967359000.db2.gz AJQAMVQNHWHHKJ-LBPRGKRZSA-N 1 2 225.311 2.134 20 0 BEADLO Cn1ccnc1C[N@H+]1CCCC[C@](C)(F)C1 ZINC001205111442 967359007 /nfs/dbraw/zinc/35/90/07/967359007.db2.gz AJQAMVQNHWHHKJ-LBPRGKRZSA-N 1 2 225.311 2.134 20 0 BEADLO CCOc1cc(C)ccc1C[N@@H+]1C[C@@H]2C[C@H]1CO2 ZINC001250182128 967483832 /nfs/dbraw/zinc/48/38/32/967483832.db2.gz SFVGLRPFTAFTRO-KBPBESRZSA-N 1 2 247.338 2.367 20 0 BEADLO CCOc1cc(C)ccc1C[N@H+]1C[C@@H]2C[C@H]1CO2 ZINC001250182128 967483852 /nfs/dbraw/zinc/48/38/52/967483852.db2.gz SFVGLRPFTAFTRO-KBPBESRZSA-N 1 2 247.338 2.367 20 0 BEADLO Cn1cc(-c2cccc(-c3c[nH+]cn3C)c2)cn1 ZINC001240297015 967507163 /nfs/dbraw/zinc/50/71/63/967507163.db2.gz WBTZNYFWCNCOPA-UHFFFAOYSA-N 1 2 238.294 2.488 20 0 BEADLO OC1CC2(C1)C[NH+](Cc1sccc1Cl)C2 ZINC001205312503 967509548 /nfs/dbraw/zinc/50/95/48/967509548.db2.gz RDKBGKRWIZDGNM-UHFFFAOYSA-N 1 2 243.759 2.358 20 0 BEADLO Cc1nn(C)cc1-c1ccc2[nH+]ccn2c1 ZINC001240300492 967513742 /nfs/dbraw/zinc/51/37/42/967513742.db2.gz FKLKMMLFBFOIMV-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO Cc1nn(C)cc1-c1cc(C)cn2cc[nH+]c12 ZINC001240302573 967519271 /nfs/dbraw/zinc/51/92/71/967519271.db2.gz MEJUDHRNSIZSCD-UHFFFAOYSA-N 1 2 226.283 2.352 20 0 BEADLO Cc1cc(-c2ccc3ncnn3c2)c2[nH+]ccn2c1 ZINC001240357585 967562832 /nfs/dbraw/zinc/56/28/32/967562832.db2.gz IXISXSJSNQVHNB-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO O[C@@H]1CC[N@H+](Cc2ccc(F)c(Cl)c2F)C1 ZINC001143616160 967593836 /nfs/dbraw/zinc/59/38/36/967593836.db2.gz OYLQTIMHQAXJCF-MRVPVSSYSA-N 1 2 247.672 2.185 20 0 BEADLO O[C@@H]1CC[N@@H+](Cc2ccc(F)c(Cl)c2F)C1 ZINC001143616160 967593848 /nfs/dbraw/zinc/59/38/48/967593848.db2.gz OYLQTIMHQAXJCF-MRVPVSSYSA-N 1 2 247.672 2.185 20 0 BEADLO Cc1c(F)ccc(CC[NH+]2CCOCC2)c1F ZINC001250280576 967614012 /nfs/dbraw/zinc/61/40/12/967614012.db2.gz ZNMXQKBXLMOWJO-UHFFFAOYSA-N 1 2 241.281 2.148 20 0 BEADLO COc1ccc(F)c(F)c1CCn1cc[nH+]c1 ZINC001250315458 967679559 /nfs/dbraw/zinc/67/95/59/967679559.db2.gz MRTLEQDRCXLUMK-UHFFFAOYSA-N 1 2 238.237 2.413 20 0 BEADLO O=c1ccoc2ccc(CCn3cc[nH+]c3)cc12 ZINC001250316323 967679956 /nfs/dbraw/zinc/67/99/56/967679956.db2.gz IWQUPEPLDASRMR-UHFFFAOYSA-N 1 2 240.262 2.232 20 0 BEADLO COCCOc1ccc(CCn2cc[nH+]c2)cc1 ZINC001250316298 967682600 /nfs/dbraw/zinc/68/26/00/967682600.db2.gz HIRNLMPZVRDFGP-UHFFFAOYSA-N 1 2 246.310 2.151 20 0 BEADLO CN(C)c1ccc(Cc2ccccn2)c[nH+]1 ZINC001250318616 967685038 /nfs/dbraw/zinc/68/50/38/967685038.db2.gz FHXYUOGRUJBCOC-UHFFFAOYSA-N 1 2 213.284 2.133 20 0 BEADLO COc1ncc(Cl)cc1CCn1cc[nH+]c1 ZINC001250318341 967685689 /nfs/dbraw/zinc/68/56/89/967685689.db2.gz CSMOGSXGZNGBJJ-UHFFFAOYSA-N 1 2 237.690 2.183 20 0 BEADLO CCOc1cc(C)c(CCn2cc[nH+]c2)cn1 ZINC001250316595 967688820 /nfs/dbraw/zinc/68/88/20/967688820.db2.gz NXLDCRSFCJMRHD-UHFFFAOYSA-N 1 2 231.299 2.228 20 0 BEADLO c1cn(CCc2cnn(-c3ccccc3)c2)c[nH+]1 ZINC001250316817 967690546 /nfs/dbraw/zinc/69/05/46/967690546.db2.gz ZWDWRAMRFYCBQY-UHFFFAOYSA-N 1 2 238.294 2.312 20 0 BEADLO COC(=O)c1cc(CCn2cc[nH+]c2)ccc1C ZINC001250319050 967693608 /nfs/dbraw/zinc/69/36/08/967693608.db2.gz PVULCIHZTIIDMJ-UHFFFAOYSA-N 1 2 244.294 2.221 20 0 BEADLO c1cn(CCc2ccc3ocnc3c2)c[nH+]1 ZINC001250318928 967694956 /nfs/dbraw/zinc/69/49/56/967694956.db2.gz MQPPGJJIFXWBON-UHFFFAOYSA-N 1 2 213.240 2.267 20 0 BEADLO Cc1cc(CO)cc(C)c1CCn1cc[nH+]c1 ZINC001250320496 967695914 /nfs/dbraw/zinc/69/59/14/967695914.db2.gz MUAQFRWDPSSJOJ-UHFFFAOYSA-N 1 2 230.311 2.235 20 0 BEADLO CSc1cnc(F)c(CCn2cc[nH+]c2)c1 ZINC001250319914 967696695 /nfs/dbraw/zinc/69/66/95/967696695.db2.gz GLIDIAQQVRFLRH-UHFFFAOYSA-N 1 2 237.303 2.382 20 0 BEADLO c1cc2cc(C[N@@H+]3CCC34COC4)ccc2[nH]1 ZINC001205593666 967712599 /nfs/dbraw/zinc/71/25/99/967712599.db2.gz GTXRBRCXYOZMOJ-UHFFFAOYSA-N 1 2 228.295 2.143 20 0 BEADLO c1cc2cc(C[N@H+]3CCC34COC4)ccc2[nH]1 ZINC001205593666 967712606 /nfs/dbraw/zinc/71/26/06/967712606.db2.gz GTXRBRCXYOZMOJ-UHFFFAOYSA-N 1 2 228.295 2.143 20 0 BEADLO COc1ccccc1C[N@H+](C)Cc1cnoc1 ZINC001205697490 967785519 /nfs/dbraw/zinc/78/55/19/967785519.db2.gz WQRCWDOPRLUHNL-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1ccccc1C[N@@H+](C)Cc1cnoc1 ZINC001205697490 967785539 /nfs/dbraw/zinc/78/55/39/967785539.db2.gz WQRCWDOPRLUHNL-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO c1cn2ccc(CC3CCOCC3)cc2[nH+]1 ZINC001250393930 967810124 /nfs/dbraw/zinc/81/01/24/967810124.db2.gz YOGCLKMHUCSQNP-UHFFFAOYSA-N 1 2 216.284 2.303 20 0 BEADLO c1c2[nH]c(C3CCOCC3)[nH+]c2cc2c1OCO2 ZINC001250433403 967850647 /nfs/dbraw/zinc/85/06/47/967850647.db2.gz LWUDKQNHEGMNCI-UHFFFAOYSA-N 1 2 246.266 2.186 20 0 BEADLO Cc1ncc(-c2cn3cc[nH+]c3cc2C)cn1 ZINC001205854146 967856139 /nfs/dbraw/zinc/85/61/39/967856139.db2.gz OBWJJNVREGGIOJ-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO c1c2[nH]c([C@H]3CCCOC3)[nH+]c2cc2c1OCO2 ZINC001250549667 968057148 /nfs/dbraw/zinc/05/71/48/968057148.db2.gz FRULDSMYICKNJJ-QMMMGPOBSA-N 1 2 246.266 2.186 20 0 BEADLO CCCN(CC)c1cc(COC)cc[nH+]1 ZINC001163601985 968079799 /nfs/dbraw/zinc/07/97/99/968079799.db2.gz LOGGRLPZPXWNEC-UHFFFAOYSA-N 1 2 208.305 2.464 20 0 BEADLO C[C@H](C(=O)N[C@H]1CC[C@@H](C)[C@H](C)C1)n1cc[nH+]c1 ZINC001320394350 1169916088 /nfs/dbraw/zinc/91/60/88/1169916088.db2.gz IUWBIGNDJGBQAD-LPWJVIDDSA-N 1 2 249.358 2.385 20 0 BEADLO COCc1nc2cc(-n3cc[nH+]c3)c(F)cc2[nH]1 ZINC001250602734 968145983 /nfs/dbraw/zinc/14/59/83/968145983.db2.gz LAWCWCOZMPNQLC-UHFFFAOYSA-N 1 2 246.245 2.034 20 0 BEADLO Cc1c(F)cc[nH+]c1N1CC(F)(C2CC2)C1 ZINC001163969159 968148179 /nfs/dbraw/zinc/14/81/79/968148179.db2.gz OSLAMCKQJVSACQ-UHFFFAOYSA-N 1 2 224.254 2.467 20 0 BEADLO COCCCc1[nH]c2cc3c(cc2[nH+]1)OCC3 ZINC001250603350 968148446 /nfs/dbraw/zinc/14/84/46/968148446.db2.gz QNLBRVJJZFXZGD-UHFFFAOYSA-N 1 2 232.283 2.077 20 0 BEADLO COC(C)(C)Cc1[nH]c2cc3c(cc2[nH+]1)OCO3 ZINC001250613789 968160549 /nfs/dbraw/zinc/16/05/49/968160549.db2.gz UQQUAGJOQOFJJD-UHFFFAOYSA-N 1 2 248.282 2.259 20 0 BEADLO Cn1cnc(C[N@@H+]2CC[C@@H]2c2ccccc2)c1 ZINC001206237069 968160496 /nfs/dbraw/zinc/16/04/96/968160496.db2.gz KCYFCVHSSTUMKO-CQSZACIVSA-N 1 2 227.311 2.367 20 0 BEADLO Cn1cnc(C[N@H+]2CC[C@@H]2c2ccccc2)c1 ZINC001206237069 968160503 /nfs/dbraw/zinc/16/05/03/968160503.db2.gz KCYFCVHSSTUMKO-CQSZACIVSA-N 1 2 227.311 2.367 20 0 BEADLO C[C@H]1C[C@@H]1c1[nH]c2cc3c(cc2[nH+]1)OCO3 ZINC001250614048 968161587 /nfs/dbraw/zinc/16/15/87/968161587.db2.gz GMFJFORSBSOPSG-BQBZGAKWSA-N 1 2 216.240 2.415 20 0 BEADLO C[C@@H](C(=O)NC[C@H]1CCCC[C@H]1C)n1cc[nH+]c1 ZINC001251289285 968279650 /nfs/dbraw/zinc/27/96/50/968279650.db2.gz ZWIWWHIBELRKPC-FRRDWIJNSA-N 1 2 249.358 2.387 20 0 BEADLO CC[C@@H](O)CNc1cccc(-n2cc[nH+]c2)c1 ZINC001251784322 968328235 /nfs/dbraw/zinc/32/82/35/968328235.db2.gz HZERBUMUSQTNLH-CYBMUJFWSA-N 1 2 231.299 2.055 20 0 BEADLO CC[C@@H](O)CNc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001251791026 968334399 /nfs/dbraw/zinc/33/43/99/968334399.db2.gz XPHYKPNIZMPCLU-GFCCVEGCSA-N 1 2 231.299 2.260 20 0 BEADLO Cc1cc(Cl)c(C)c(N(C)CC2COC2)[nH+]1 ZINC001166950548 968405410 /nfs/dbraw/zinc/40/54/10/968405410.db2.gz XNATUFYYTAFXJE-UHFFFAOYSA-N 1 2 240.734 2.434 20 0 BEADLO CN(c1cc2ccccc2c[nH+]1)C1(C)COC1 ZINC001166985382 968413459 /nfs/dbraw/zinc/41/34/59/968413459.db2.gz XMMNZYDGQAQHBI-UHFFFAOYSA-N 1 2 228.295 2.460 20 0 BEADLO COc1cccnc1C[N@@H+]1C[C@H](F)C[C@H]1C ZINC001206610417 968421148 /nfs/dbraw/zinc/42/11/48/968421148.db2.gz GUJIUPGAPSLYLD-NXEZZACHSA-N 1 2 224.279 2.023 20 0 BEADLO COc1cccnc1C[N@H+]1C[C@H](F)C[C@H]1C ZINC001206610417 968421153 /nfs/dbraw/zinc/42/11/53/968421153.db2.gz GUJIUPGAPSLYLD-NXEZZACHSA-N 1 2 224.279 2.023 20 0 BEADLO CCOc1cccc(NCc2ccc[nH+]c2N)n1 ZINC001206672022 968433552 /nfs/dbraw/zinc/43/35/52/968433552.db2.gz IGBIFWOYKFERIU-UHFFFAOYSA-N 1 2 244.298 2.070 20 0 BEADLO COc1c(F)cccc1OC1C[NH+](C(C)C)C1 ZINC001230833387 968483442 /nfs/dbraw/zinc/48/34/42/968483442.db2.gz ADGNIBGPURYVBS-UHFFFAOYSA-N 1 2 239.290 2.306 20 0 BEADLO FC[C@H]1[C@@H]2C[N@H+](Cc3c(F)cncc3F)C[C@H]12 ZINC001206862259 968504016 /nfs/dbraw/zinc/50/40/16/968504016.db2.gz IUYUSLWEZQACOG-PSVAKVPMSA-N 1 2 242.244 2.007 20 0 BEADLO FC[C@H]1[C@@H]2C[N@@H+](Cc3c(F)cncc3F)C[C@H]12 ZINC001206862259 968504021 /nfs/dbraw/zinc/50/40/21/968504021.db2.gz IUYUSLWEZQACOG-PSVAKVPMSA-N 1 2 242.244 2.007 20 0 BEADLO O=c1[nH]cccc1C[N@H+]1CCCCC(F)(F)C1 ZINC001207000333 968535097 /nfs/dbraw/zinc/53/50/97/968535097.db2.gz JLEUENOCLMBUMH-UHFFFAOYSA-N 1 2 242.269 2.408 20 0 BEADLO O=c1[nH]cccc1C[N@@H+]1CCCCC(F)(F)C1 ZINC001207000333 968535102 /nfs/dbraw/zinc/53/51/02/968535102.db2.gz JLEUENOCLMBUMH-UHFFFAOYSA-N 1 2 242.269 2.408 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2ncccn2)CCC1(F)F ZINC001207010162 968547740 /nfs/dbraw/zinc/54/77/40/968547740.db2.gz KAGLVTQYNCJTRW-SECBINFHSA-N 1 2 245.248 2.046 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2ncccn2)CCC1(F)F ZINC001207010162 968547745 /nfs/dbraw/zinc/54/77/45/968547745.db2.gz KAGLVTQYNCJTRW-SECBINFHSA-N 1 2 245.248 2.046 20 0 BEADLO Cc1cc2c(cn1)C[N@H+](Cc1ccc[nH]c1=O)C2 ZINC001207009279 968547817 /nfs/dbraw/zinc/54/78/17/968547817.db2.gz RPTYTBWRGLJQGY-UHFFFAOYSA-N 1 2 241.294 2.006 20 0 BEADLO Cc1cc2c(cn1)C[N@@H+](Cc1ccc[nH]c1=O)C2 ZINC001207009279 968547820 /nfs/dbraw/zinc/54/78/20/968547820.db2.gz RPTYTBWRGLJQGY-UHFFFAOYSA-N 1 2 241.294 2.006 20 0 BEADLO CC(=O)C1CC[NH+](Cc2ncccc2F)CC1 ZINC001207034740 968563759 /nfs/dbraw/zinc/56/37/59/968563759.db2.gz WSJZEKYRFAXOSH-UHFFFAOYSA-N 1 2 236.290 2.022 20 0 BEADLO Cc1ncc(C[N@@H+]2CCc3ncccc3C2)s1 ZINC001207061173 968592654 /nfs/dbraw/zinc/59/26/54/968592654.db2.gz FXOPULRCIXGPOY-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ncc(C[N@H+]2CCc3ncccc3C2)s1 ZINC001207061173 968592665 /nfs/dbraw/zinc/59/26/65/968592665.db2.gz FXOPULRCIXGPOY-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2cccc(=O)[nH]2)C[C@@H]1F ZINC001207065131 968594529 /nfs/dbraw/zinc/59/45/29/968594529.db2.gz IULZONLJJCPOHZ-CMPLNLGQSA-N 1 2 242.269 2.059 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2cccc(=O)[nH]2)C[C@@H]1F ZINC001207065131 968594535 /nfs/dbraw/zinc/59/45/35/968594535.db2.gz IULZONLJJCPOHZ-CMPLNLGQSA-N 1 2 242.269 2.059 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cnc(C)cn2)cn1 ZINC001207080267 968613392 /nfs/dbraw/zinc/61/33/92/968613392.db2.gz IXHBLQUHTAKOHK-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cnc(C)cn2)cn1 ZINC001207080267 968613396 /nfs/dbraw/zinc/61/33/96/968613396.db2.gz IXHBLQUHTAKOHK-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO CCn1ccnc1C[N@@H+]1C[C@@H](C)C[C@H]1CF ZINC001207140156 968652882 /nfs/dbraw/zinc/65/28/82/968652882.db2.gz FDOAHKLXDNABKK-QWRGUYRKSA-N 1 2 225.311 2.083 20 0 BEADLO CCn1ccnc1C[N@H+]1C[C@@H](C)C[C@H]1CF ZINC001207140156 968652888 /nfs/dbraw/zinc/65/28/88/968652888.db2.gz FDOAHKLXDNABKK-QWRGUYRKSA-N 1 2 225.311 2.083 20 0 BEADLO Cc1cncc(C[N@H+]2CCc3cccnc3C2)c1 ZINC001207162362 968672105 /nfs/dbraw/zinc/67/21/05/968672105.db2.gz GYILSBMGUABMCI-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1cncc(C[N@@H+]2CCc3cccnc3C2)c1 ZINC001207162362 968672102 /nfs/dbraw/zinc/67/21/02/968672102.db2.gz GYILSBMGUABMCI-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO c1ccc(COCC[NH+]2CC3(C2)CCCO3)cc1 ZINC001207227663 968689014 /nfs/dbraw/zinc/68/90/14/968689014.db2.gz AXMXFYPBRPFGHZ-UHFFFAOYSA-N 1 2 247.338 2.068 20 0 BEADLO C[C@@H]1CC[N@@H+]1CCc1c(Cl)ncnc1Cl ZINC001207325668 968725002 /nfs/dbraw/zinc/72/50/02/968725002.db2.gz DVLOCHYVNNXOLT-SSDOTTSWSA-N 1 2 246.141 2.420 20 0 BEADLO C[C@@H]1CC[N@H+]1CCc1c(Cl)ncnc1Cl ZINC001207325668 968725011 /nfs/dbraw/zinc/72/50/11/968725011.db2.gz DVLOCHYVNNXOLT-SSDOTTSWSA-N 1 2 246.141 2.420 20 0 BEADLO Fc1ccc(CC[N@@H+]2Cc3cncnc3C2)cc1 ZINC001207511121 968811291 /nfs/dbraw/zinc/81/12/91/968811291.db2.gz IAMGLNIMXJNVMD-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1ccc(CC[N@H+]2Cc3cncnc3C2)cc1 ZINC001207511121 968811295 /nfs/dbraw/zinc/81/12/95/968811295.db2.gz IAMGLNIMXJNVMD-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Cc1sccc1C[N@@H+](C)Cc1ccn(C)n1 ZINC001207774148 968881988 /nfs/dbraw/zinc/88/19/88/968881988.db2.gz KNQSDLYRWKLTPF-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1sccc1C[N@H+](C)Cc1ccn(C)n1 ZINC001207774148 968881990 /nfs/dbraw/zinc/88/19/90/968881990.db2.gz KNQSDLYRWKLTPF-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO C[C@H](C(=O)N[C@@H](C)CCC1CC1)n1cc[nH+]c1 ZINC001324037641 968885519 /nfs/dbraw/zinc/88/55/19/968885519.db2.gz JSLUIAVQURSDOF-WDEREUQCSA-N 1 2 235.331 2.139 20 0 BEADLO Oc1ccc(-c2c[nH+]c3c(c2)CCCN3)cc1 ZINC001241065674 968885716 /nfs/dbraw/zinc/88/57/16/968885716.db2.gz TWESNHODOQPLKJ-UHFFFAOYSA-N 1 2 226.279 2.455 20 0 BEADLO CCC[C@@H](O)CNc1ccc(-n2cc[nH+]c2)cc1 ZINC001252770921 968939682 /nfs/dbraw/zinc/93/96/82/968939682.db2.gz MFJRPLDCQSTOBF-CQSZACIVSA-N 1 2 245.326 2.445 20 0 BEADLO CCC[C@@H](O)CNc1ccc2[nH+]cn(C)c2c1 ZINC001252791378 968973695 /nfs/dbraw/zinc/97/36/95/968973695.db2.gz SMDNCTVWNKIMFE-LLVKDONJSA-N 1 2 233.315 2.146 20 0 BEADLO c1cn(CCc2nnc(-c3ccccc3)o2)c[nH+]1 ZINC001253066978 969075281 /nfs/dbraw/zinc/07/52/81/969075281.db2.gz VBOOIXUJLBUOOB-UHFFFAOYSA-N 1 2 240.266 2.176 20 0 BEADLO CNc1cc(-c2ccc(F)c(CO)c2)cc[nH+]1 ZINC001241795771 969114279 /nfs/dbraw/zinc/11/42/79/969114279.db2.gz ABRPNSGCFNGVLZ-UHFFFAOYSA-N 1 2 232.258 2.422 20 0 BEADLO COc1ccc(C)nc1-c1c[nH+]c(N)cc1C ZINC001242072900 969197069 /nfs/dbraw/zinc/19/70/69/969197069.db2.gz TUWPBYYDEZZMHV-UHFFFAOYSA-N 1 2 229.283 2.351 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1cc2c(nn1)CCCC2 ZINC001242078250 969199714 /nfs/dbraw/zinc/19/97/14/969199714.db2.gz WURUHHCDXSHRJW-UHFFFAOYSA-N 1 2 240.310 2.308 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]c2cccc(=O)n2C)nc1 ZINC001168857258 969238097 /nfs/dbraw/zinc/23/80/97/969238097.db2.gz GVVADLYOTIGMLS-NSHDSACASA-N 1 2 243.310 2.262 20 0 BEADLO COC(=O)Cc1ccc(NCCC2CCC2)[nH+]c1 ZINC001168886674 969258713 /nfs/dbraw/zinc/25/87/13/969258713.db2.gz KUBXKDQZRNVUEI-UHFFFAOYSA-N 1 2 248.326 2.399 20 0 BEADLO C[C@@H](C[NH+]1CC2(C1)CCCO2)C(F)(F)F ZINC001208895830 969288076 /nfs/dbraw/zinc/28/80/76/969288076.db2.gz MUJVNBCAHAKHMW-QMMMGPOBSA-N 1 2 223.238 2.050 20 0 BEADLO Cc1cc(N2CCCC[C@@H]2CO)nc(C2CC2)[nH+]1 ZINC000090065415 969310223 /nfs/dbraw/zinc/31/02/23/969310223.db2.gz OWDXTOPVXLUQHJ-GFCCVEGCSA-N 1 2 247.342 2.014 20 0 BEADLO Cc1cn2c(cccc2NC[C@H](O)C(C)(C)C)[nH+]1 ZINC001253714423 969339400 /nfs/dbraw/zinc/33/94/00/969339400.db2.gz YXWWZYXFUDPBNI-NSHDSACASA-N 1 2 247.342 2.462 20 0 BEADLO Cc1cn2c(cccc2NC[C@H](O)C(C)C)[nH+]1 ZINC001253748236 969365176 /nfs/dbraw/zinc/36/51/76/969365176.db2.gz DGHGEHHCMOGAMJ-NSHDSACASA-N 1 2 233.315 2.072 20 0 BEADLO CC(C)[C@H](O)CNc1ccc[nH+]c1N1CCCC1 ZINC001253753735 969372455 /nfs/dbraw/zinc/37/24/55/969372455.db2.gz VCHOBNZRKGIFKN-CYBMUJFWSA-N 1 2 249.358 2.111 20 0 BEADLO O=C1C[C@@H](Nc2cc3cc(F)ccc3c[nH+]2)CO1 ZINC001169120935 969416487 /nfs/dbraw/zinc/41/64/87/969416487.db2.gz USFYMSRUASCZNB-LLVKDONJSA-N 1 2 246.241 2.101 20 0 BEADLO C[C@@H]1C[C@@H](C[N@H+](C)CC(F)F)C[C@H](C)O1 ZINC001209393737 969460879 /nfs/dbraw/zinc/46/08/79/969460879.db2.gz SIVIOWXCYSLYSX-ILWJIGKKSA-N 1 2 221.291 2.387 20 0 BEADLO C[C@@H]1C[C@@H](C[N@@H+](C)CC(F)F)C[C@H](C)O1 ZINC001209393737 969460883 /nfs/dbraw/zinc/46/08/83/969460883.db2.gz SIVIOWXCYSLYSX-ILWJIGKKSA-N 1 2 221.291 2.387 20 0 BEADLO C[C@H]1CC[N@H+](CCCC2OCCO2)CC1(F)F ZINC001209303672 969434291 /nfs/dbraw/zinc/43/42/91/969434291.db2.gz MUSRXBOFAKBXPN-JTQLQIEISA-N 1 2 249.301 2.117 20 0 BEADLO C[C@H]1CC[N@@H+](CCCC2OCCO2)CC1(F)F ZINC001209303672 969434295 /nfs/dbraw/zinc/43/42/95/969434295.db2.gz MUSRXBOFAKBXPN-JTQLQIEISA-N 1 2 249.301 2.117 20 0 BEADLO CC[C@@H]([NH2+]CCOC(C)(C)C)c1noc(C)n1 ZINC001169111434 969445433 /nfs/dbraw/zinc/44/54/33/969445433.db2.gz ISMXSTGSOXVHIE-SNVBAGLBSA-N 1 2 241.335 2.234 20 0 BEADLO c1ncc(C[N@@H+]2CCc3cccnc3C2)s1 ZINC001209549978 969539255 /nfs/dbraw/zinc/53/92/55/969539255.db2.gz XBHALXWTQVGZLL-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1ncc(C[N@H+]2CCc3cccnc3C2)s1 ZINC001209549978 969539261 /nfs/dbraw/zinc/53/92/61/969539261.db2.gz XBHALXWTQVGZLL-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO Cn1c[nH+]c2ccc(N[C@H]3CCC[C@@H](O)C3)cc21 ZINC001169251792 969543607 /nfs/dbraw/zinc/54/36/07/969543607.db2.gz VXMVKAJNVALSKM-CMPLNLGQSA-N 1 2 245.326 2.289 20 0 BEADLO Cc1ccnc(CCNc2cccc[nH+]2)c1 ZINC001169311353 969585362 /nfs/dbraw/zinc/58/53/62/969585362.db2.gz FEGPHKQRUKBVKD-UHFFFAOYSA-N 1 2 213.284 2.440 20 0 BEADLO Cc1cccn2cc(C[NH+]3CC(C)(C)C3)nc12 ZINC001209733080 969592140 /nfs/dbraw/zinc/59/21/40/969592140.db2.gz GCQPZSJHWUNMGG-UHFFFAOYSA-N 1 2 229.327 2.485 20 0 BEADLO Cc1c(F)cc[nH+]c1NCCn1cccc1 ZINC001156299117 969597719 /nfs/dbraw/zinc/59/77/19/969597719.db2.gz HOWOWLQRMCDJER-UHFFFAOYSA-N 1 2 219.263 2.443 20 0 BEADLO C[C@@H](Nc1ccc(N(C)C)c[nH+]1)c1cnccn1 ZINC001169533025 969721167 /nfs/dbraw/zinc/72/11/67/969721167.db2.gz KONNGDGCMQKBLO-SNVBAGLBSA-N 1 2 243.314 2.111 20 0 BEADLO C[C@H](C(=O)N1CC[C@H](C(C)(C)C)C1)n1cc[nH+]c1 ZINC001254630859 969750978 /nfs/dbraw/zinc/75/09/78/969750978.db2.gz QHJVEXJHSCHYND-NEPJUHHUSA-N 1 2 249.358 2.339 20 0 BEADLO Cc1cc(C)c(NC[C@@H]2COCC[N@H+]2C)c(C)c1 ZINC001169653728 969801926 /nfs/dbraw/zinc/80/19/26/969801926.db2.gz KEQKKRMXBYNPQM-CQSZACIVSA-N 1 2 248.370 2.354 20 0 BEADLO Cc1cc(C)c(NC[C@@H]2COCC[N@@H+]2C)c(C)c1 ZINC001169653728 969801930 /nfs/dbraw/zinc/80/19/30/969801930.db2.gz KEQKKRMXBYNPQM-CQSZACIVSA-N 1 2 248.370 2.354 20 0 BEADLO CC/C=C(\C)[C@@H](CC)OCC[NH+]1CCOCC1 ZINC001210224662 969837078 /nfs/dbraw/zinc/83/70/78/969837078.db2.gz COOIMTGRJIOUPN-YGLIYXGISA-N 1 2 241.375 2.470 20 0 BEADLO CO[C@@H](C)CNc1cc[nH+]c(OC(C)C)c1 ZINC001169775484 969841246 /nfs/dbraw/zinc/84/12/46/969841246.db2.gz HQMRROIZXXDHTL-JTQLQIEISA-N 1 2 224.304 2.316 20 0 BEADLO CO[C@@H](C)CNc1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001169778900 969845193 /nfs/dbraw/zinc/84/51/93/969845193.db2.gz XTHZUBPUVVFGMT-JTQLQIEISA-N 1 2 249.289 2.458 20 0 BEADLO Cc1cncc(Nc2c[nH+]c(C)c(N)c2)c1 ZINC001210284493 969850847 /nfs/dbraw/zinc/85/08/47/969850847.db2.gz HENKKHHFXKMKSW-UHFFFAOYSA-N 1 2 214.272 2.419 20 0 BEADLO Cc1cc(Nc2c[nH+]c(C)c(N)c2)on1 ZINC001210284142 969852733 /nfs/dbraw/zinc/85/27/33/969852733.db2.gz FIPWQSCAXIKEGT-UHFFFAOYSA-N 1 2 204.233 2.012 20 0 BEADLO Cc1[nH+]cc(Nc2noc(C(C)(C)C)n2)cc1N ZINC001210286149 969853482 /nfs/dbraw/zinc/85/34/82/969853482.db2.gz WCAHESYOBYBWDT-UHFFFAOYSA-N 1 2 247.302 2.396 20 0 BEADLO Cc1ncccc1Nc1c[nH+]c(C)c(N)c1 ZINC001210286233 969854158 /nfs/dbraw/zinc/85/41/58/969854158.db2.gz YQIRMGUMEZAOQS-UHFFFAOYSA-N 1 2 214.272 2.419 20 0 BEADLO COc1cc[nH+]cc1Nc1cnc(C)c(N)c1 ZINC001210287429 969854595 /nfs/dbraw/zinc/85/45/95/969854595.db2.gz SVEISTMUPMNWDS-UHFFFAOYSA-N 1 2 230.271 2.119 20 0 BEADLO Cc1[nH+]cc(Nc2cnc(Cl)cn2)cc1N ZINC001210287562 969855091 /nfs/dbraw/zinc/85/50/91/969855091.db2.gz XDGAENCURXAENO-UHFFFAOYSA-N 1 2 235.678 2.159 20 0 BEADLO CC(=O)c1cccc(Nc2c[nH+]c(C)c(N)c2)n1 ZINC001210288008 969855811 /nfs/dbraw/zinc/85/58/11/969855811.db2.gz GXDAWTYJZQFDCU-UHFFFAOYSA-N 1 2 242.282 2.313 20 0 BEADLO Cc1[nH+]cc(Nc2ccnn2CC2CC2)cc1N ZINC001210287688 969856208 /nfs/dbraw/zinc/85/62/08/969856208.db2.gz ZQMYANKERAKMGJ-UHFFFAOYSA-N 1 2 243.314 2.322 20 0 BEADLO Cc1[nH+]cc(Nc2ccc(CCO)cc2)cc1N ZINC001210288316 969856753 /nfs/dbraw/zinc/85/67/53/969856753.db2.gz LUUCDBUXUOSBPI-UHFFFAOYSA-N 1 2 243.310 2.251 20 0 BEADLO COc1cccc(O)c1Nc1c[nH+]c(C)c(N)c1 ZINC001210289322 969857820 /nfs/dbraw/zinc/85/78/20/969857820.db2.gz GIFNVKRDYCXPLC-UHFFFAOYSA-N 1 2 245.282 2.430 20 0 BEADLO Cc1[nH+]cc(Nc2c(N)cccc2O)cc1N ZINC001210291934 969860310 /nfs/dbraw/zinc/86/03/10/969860310.db2.gz UQSRKFVVSJBDDT-UHFFFAOYSA-N 1 2 230.271 2.004 20 0 BEADLO COc1cc(O)ccc1Nc1c[nH+]c(C)c(N)c1 ZINC001210291350 969860376 /nfs/dbraw/zinc/86/03/76/969860376.db2.gz KVWDQJVDAORLFD-UHFFFAOYSA-N 1 2 245.282 2.430 20 0 BEADLO Cn1ccc(Nc2cccc(-n3cc[nH+]c3)c2)n1 ZINC001210351438 969875629 /nfs/dbraw/zinc/87/56/29/969875629.db2.gz ZJZFFZZYSNIBTP-UHFFFAOYSA-N 1 2 239.282 2.349 20 0 BEADLO Cc1c[nH+]c(Nc2ccnn2C(C)C)c(N)c1 ZINC001210516806 969923392 /nfs/dbraw/zinc/92/33/92/969923392.db2.gz PYKJWUPSKXVRMP-UHFFFAOYSA-N 1 2 231.303 2.493 20 0 BEADLO COc1cc(Nc2cnoc2C)cc(C)[nH+]1 ZINC001210578847 969953766 /nfs/dbraw/zinc/95/37/66/969953766.db2.gz VBKZQNFSGUUOKG-UHFFFAOYSA-N 1 2 219.244 2.439 20 0 BEADLO C[C@@H](O)c1ccc(Nc2[nH+]cccc2N)cc1 ZINC001210640659 969986452 /nfs/dbraw/zinc/98/64/52/969986452.db2.gz KCIDMQCFVMQBGX-SECBINFHSA-N 1 2 229.283 2.461 20 0 BEADLO C[C@@H](O)c1ccc(N(C)c2[nH+]cccc2N)cc1 ZINC001210640605 969986491 /nfs/dbraw/zinc/98/64/91/969986491.db2.gz OYPGWZPQAWVTQS-SNVBAGLBSA-N 1 2 243.310 2.485 20 0 BEADLO C[C@H]1CC[C@H]([N@@H+]2CCOCC(F)(F)C2)C1 ZINC000339205768 970030548 /nfs/dbraw/zinc/03/05/48/970030548.db2.gz OYLPVKMVHLYWBH-UWVGGRQHSA-N 1 2 219.275 2.143 20 0 BEADLO C[C@H]1CC[C@H]([N@H+]2CCOCC(F)(F)C2)C1 ZINC000339205768 970030561 /nfs/dbraw/zinc/03/05/61/970030561.db2.gz OYLPVKMVHLYWBH-UWVGGRQHSA-N 1 2 219.275 2.143 20 0 BEADLO Cc1cccc(CN2CC[NH2+]CC(F)(F)C2)c1 ZINC001210815585 970049541 /nfs/dbraw/zinc/04/95/41/970049541.db2.gz WOEIRZJFYXPHLJ-UHFFFAOYSA-N 1 2 240.297 2.036 20 0 BEADLO COC(=O)C1([NH2+][C@@H](C)CCCC(C)C)CC1 ZINC001170057819 970105621 /nfs/dbraw/zinc/10/56/21/970105621.db2.gz OFBYTHAWTXINMC-NSHDSACASA-N 1 2 227.348 2.496 20 0 BEADLO Cc1ccc(C[NH+]2CC3(CCO3)C2)s1 ZINC001204033316 970169469 /nfs/dbraw/zinc/16/94/69/970169469.db2.gz QKXDJIQHBURMBY-UHFFFAOYSA-N 1 2 209.314 2.031 20 0 BEADLO Cc1cn2cc(-c3cncc(CO)c3)ccc2[nH+]1 ZINC001242972003 970184503 /nfs/dbraw/zinc/18/45/03/970184503.db2.gz HQMWFMGRVQOAIS-UHFFFAOYSA-N 1 2 239.278 2.197 20 0 BEADLO COc1cccc(-c2c[nH+]cn2C)c1C ZINC001243069047 970260095 /nfs/dbraw/zinc/26/00/95/970260095.db2.gz NQKWVVOKZBHNKG-UHFFFAOYSA-N 1 2 202.257 2.404 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2c(c1)NC(=O)C2(C)C ZINC001243069766 970261974 /nfs/dbraw/zinc/26/19/74/970261974.db2.gz LBURFRVZTBIEOM-UHFFFAOYSA-N 1 2 241.294 2.317 20 0 BEADLO Cc1cc([NH2+][C@@H]2CCOC[C@@H]2C)ccc1N ZINC000301026093 970309104 /nfs/dbraw/zinc/30/91/04/970309104.db2.gz PKBBBVKYJVXMRM-GXFFZTMASA-N 1 2 220.316 2.414 20 0 BEADLO COc1ccc(N)c(Nc2c[nH+]c(C)cc2C)n1 ZINC001213507792 970332458 /nfs/dbraw/zinc/33/24/58/970332458.db2.gz FVFNBVVUQIWJSO-UHFFFAOYSA-N 1 2 244.298 2.428 20 0 BEADLO COc1cnc(Nc2c[nH+]c(C)cc2C)cn1 ZINC001213505697 970334085 /nfs/dbraw/zinc/33/40/85/970334085.db2.gz NBMZQQWIJZSSKW-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO Cc1cc(C)c(-n2cc(N)c(Cl)n2)c[nH+]1 ZINC001213508406 970334214 /nfs/dbraw/zinc/33/42/14/970334214.db2.gz RYKDUPRPVBHHCX-UHFFFAOYSA-N 1 2 222.679 2.120 20 0 BEADLO Cc1cc(C)c(Nc2nc(Cl)cnc2N)c[nH+]1 ZINC001213508615 970334942 /nfs/dbraw/zinc/33/49/42/970334942.db2.gz XQIJXOAMRPQFOB-UHFFFAOYSA-N 1 2 249.705 2.468 20 0 BEADLO COc1cc(Nc2c[nH+]cc(C)c2C)c(N)cn1 ZINC001213527188 970349361 /nfs/dbraw/zinc/34/93/61/970349361.db2.gz BYEBCENLFSWBKD-UHFFFAOYSA-N 1 2 244.298 2.428 20 0 BEADLO C[C@@H](CC(F)(F)F)[NH2+]C1(c2ncccn2)CC1 ZINC001255643522 970416620 /nfs/dbraw/zinc/41/66/20/970416620.db2.gz QHSWIEJODQFRSU-QMMMGPOBSA-N 1 2 245.248 2.396 20 0 BEADLO Cc1ccc(Nc2[nH+]cccc2N)c(N)c1 ZINC001214177920 970448507 /nfs/dbraw/zinc/44/85/07/970448507.db2.gz PIXQNGLZVNIMGK-UHFFFAOYSA-N 1 2 214.272 2.298 20 0 BEADLO CC(C)[C@H](Nc1cccc[nH+]1)C(=O)N1CCCC1 ZINC001170149804 970449390 /nfs/dbraw/zinc/44/93/90/970449390.db2.gz GJDTWMQGIGQXAX-ZDUSSCGKSA-N 1 2 247.342 2.141 20 0 BEADLO Cc1ccc(C[C@@H](C)[NH2+]CC(=O)OC(C)C)cc1 ZINC001255772140 970475382 /nfs/dbraw/zinc/47/53/82/970475382.db2.gz FVTOAXUIAODOSY-CYBMUJFWSA-N 1 2 249.354 2.467 20 0 BEADLO CC[C@H]([NH2+][C@H](C)Cc1ccc(C)cc1)C(=O)OC ZINC001255773883 970478528 /nfs/dbraw/zinc/47/85/28/970478528.db2.gz RJHHNEONJFACSG-OCCSQVGLSA-N 1 2 249.354 2.467 20 0 BEADLO CC(C)n1cc(C[NH+]2C[C@H](C)O[C@@H](C)C2)cn1 ZINC000179192084 970501958 /nfs/dbraw/zinc/50/19/58/970501958.db2.gz DSBDQGLDJZAQMS-RYUDHWBXSA-N 1 2 237.347 2.073 20 0 BEADLO C[C@@H](Cc1ccccc1F)[N@@H+]1CCC12COC2 ZINC001255851439 970518289 /nfs/dbraw/zinc/51/82/89/970518289.db2.gz OKKSPKJZFSKAIK-NSHDSACASA-N 1 2 235.302 2.231 20 0 BEADLO C[C@@H](Cc1ccccc1F)[N@H+]1CCC12COC2 ZINC001255851439 970518297 /nfs/dbraw/zinc/51/82/97/970518297.db2.gz OKKSPKJZFSKAIK-NSHDSACASA-N 1 2 235.302 2.231 20 0 BEADLO O=C1CC[N@@H+](Cc2ccsc2)CC[C@H]1F ZINC001204034828 970520732 /nfs/dbraw/zinc/52/07/32/970520732.db2.gz PSBJLFMVGJESFK-SNVBAGLBSA-N 1 2 227.304 2.251 20 0 BEADLO O=C1CC[N@H+](Cc2ccsc2)CC[C@H]1F ZINC001204034828 970520742 /nfs/dbraw/zinc/52/07/42/970520742.db2.gz PSBJLFMVGJESFK-SNVBAGLBSA-N 1 2 227.304 2.251 20 0 BEADLO C[C@H](Cc1ccccc1F)[N@@H+]1CCO[C@@H]2C[C@@H]21 ZINC001255857300 970522461 /nfs/dbraw/zinc/52/24/61/970522461.db2.gz PYFLJPIDJYHJOC-DDTOSNHZSA-N 1 2 235.302 2.230 20 0 BEADLO C[C@H](Cc1ccccc1F)[N@H+]1CCO[C@@H]2C[C@@H]21 ZINC001255857300 970522473 /nfs/dbraw/zinc/52/24/73/970522473.db2.gz PYFLJPIDJYHJOC-DDTOSNHZSA-N 1 2 235.302 2.230 20 0 BEADLO C[C@H]1C[C@@H](Nc2ccc([NH+](C)C)cc2)CO1 ZINC000401951724 970748384 /nfs/dbraw/zinc/74/83/84/970748384.db2.gz VEEZVGAKAKXFDG-CMPLNLGQSA-N 1 2 220.316 2.342 20 0 BEADLO Cc1ccc([C@H](C)OCc2c[nH+]cn2C)cn1 ZINC001222595035 972591712 /nfs/dbraw/zinc/59/17/12/972591712.db2.gz MERPRHGTYLOICH-NSHDSACASA-N 1 2 231.299 2.401 20 0 BEADLO COc1ccc([C@H](C)OCc2c[nH+]cn2C)cn1 ZINC001222595106 972593860 /nfs/dbraw/zinc/59/38/60/972593860.db2.gz OTYPVSMHYYMBGL-JTQLQIEISA-N 1 2 247.298 2.102 20 0 BEADLO Cn1c[nH+]cc1CO[C@@H]1CCC(F)(F)C1 ZINC001222600971 972599844 /nfs/dbraw/zinc/59/98/44/972599844.db2.gz WVWUYNMFFRBDEP-SECBINFHSA-N 1 2 216.231 2.125 20 0 BEADLO COc1ccc(O)cc1-c1cc[nH+]c(N)c1 ZINC001222629285 972613278 /nfs/dbraw/zinc/61/32/78/972613278.db2.gz SJAWRMJGVXQNME-UHFFFAOYSA-N 1 2 216.240 2.045 20 0 BEADLO Cc1cccc([C@H](C)[NH2+]Cc2nnc[nH]2)c1C ZINC001327553477 972629162 /nfs/dbraw/zinc/62/91/62/972629162.db2.gz FYVRVXYHTFTXJL-NSHDSACASA-N 1 2 230.315 2.272 20 0 BEADLO Cc1cc(C[N@@H+]2CC3(CCC3)[C@@H]2C2CC2)n[nH]1 ZINC001327573703 972650446 /nfs/dbraw/zinc/65/04/46/972650446.db2.gz TXASZUNWWLZCAS-ZDUSSCGKSA-N 1 2 231.343 2.483 20 0 BEADLO Cc1cc(C[N@H+]2CC3(CCC3)[C@@H]2C2CC2)n[nH]1 ZINC001327573703 972650454 /nfs/dbraw/zinc/65/04/54/972650454.db2.gz TXASZUNWWLZCAS-ZDUSSCGKSA-N 1 2 231.343 2.483 20 0 BEADLO CC[NH+]1CC(OCc2cc(-c3ccco3)on2)C1 ZINC001222712386 972664910 /nfs/dbraw/zinc/66/49/10/972664910.db2.gz IHIHCPVNCNIYHE-UHFFFAOYSA-N 1 2 248.282 2.155 20 0 BEADLO C[N@H+](CCF)Cc1[nH]nc2ccc(F)cc21 ZINC001144205664 972690677 /nfs/dbraw/zinc/69/06/77/972690677.db2.gz DRIGDQCUDLFOBN-UHFFFAOYSA-N 1 2 225.242 2.103 20 0 BEADLO C[N@@H+](CCF)Cc1[nH]nc2ccc(F)cc21 ZINC001144205664 972690687 /nfs/dbraw/zinc/69/06/87/972690687.db2.gz DRIGDQCUDLFOBN-UHFFFAOYSA-N 1 2 225.242 2.103 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nnc[nH]2)[C@H]2CCCC[C@@H]12 ZINC001327866411 972770875 /nfs/dbraw/zinc/77/08/75/972770875.db2.gz XBKXNKGYSSAKBK-WOPDTQHZSA-N 1 2 234.347 2.205 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nnc[nH]2)[C@H]2CCCC[C@@H]12 ZINC001327866411 972770884 /nfs/dbraw/zinc/77/08/84/972770884.db2.gz XBKXNKGYSSAKBK-WOPDTQHZSA-N 1 2 234.347 2.205 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nc[nH]n2)[C@H]2CCCC[C@@H]12 ZINC001327866411 972770896 /nfs/dbraw/zinc/77/08/96/972770896.db2.gz XBKXNKGYSSAKBK-WOPDTQHZSA-N 1 2 234.347 2.205 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nc[nH]n2)[C@H]2CCCC[C@@H]12 ZINC001327866411 972770906 /nfs/dbraw/zinc/77/09/06/972770906.db2.gz XBKXNKGYSSAKBK-WOPDTQHZSA-N 1 2 234.347 2.205 20 0 BEADLO CCC(CC)CCC[N@H+](C)Cc1nnc[nH]1 ZINC001327913150 972807575 /nfs/dbraw/zinc/80/75/75/972807575.db2.gz JYNXQRWRLCCZKZ-UHFFFAOYSA-N 1 2 224.352 2.453 20 0 BEADLO CCC(CC)CCC[N@@H+](C)Cc1nnc[nH]1 ZINC001327913150 972807577 /nfs/dbraw/zinc/80/75/77/972807577.db2.gz JYNXQRWRLCCZKZ-UHFFFAOYSA-N 1 2 224.352 2.453 20 0 BEADLO CCCOc1ccc(COC2C[NH+](C)C2)cc1 ZINC001223205304 972881289 /nfs/dbraw/zinc/88/12/89/972881289.db2.gz WNJPQXYLGGGSDE-UHFFFAOYSA-N 1 2 235.327 2.306 20 0 BEADLO C[C@H]1CC[N@@H+]1Cc1cc(F)c(O)cc1F ZINC001144648798 972908602 /nfs/dbraw/zinc/90/86/02/972908602.db2.gz XKZBRXSSDYFSJV-ZETCQYMHSA-N 1 2 213.227 2.265 20 0 BEADLO C[C@H]1CC[N@H+]1Cc1cc(F)c(O)cc1F ZINC001144648798 972908612 /nfs/dbraw/zinc/90/86/12/972908612.db2.gz XKZBRXSSDYFSJV-ZETCQYMHSA-N 1 2 213.227 2.265 20 0 BEADLO CC1=C(OCc2cc(C)[nH+]c(C)c2)C(=O)O[C@@H]1C ZINC001223422693 973059452 /nfs/dbraw/zinc/05/94/52/973059452.db2.gz YZEGHUOXEKUGLY-LLVKDONJSA-N 1 2 247.294 2.434 20 0 BEADLO COC(=O)[C@H]1C[C@H](OCc2cc(C)[nH+]c(C)c2)C1 ZINC001223422185 973060001 /nfs/dbraw/zinc/06/00/01/973060001.db2.gz UOPGOMOYYQHDIR-JOCQHMNTSA-N 1 2 249.310 2.167 20 0 BEADLO Cc1c[nH]c(CCNC(=O)c2sccc2C)[nH+]1 ZINC001147116223 973426268 /nfs/dbraw/zinc/42/62/68/973426268.db2.gz YOGLRYGUNVUZJN-UHFFFAOYSA-N 1 2 249.339 2.061 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H](C)OC3(CCCC3)C2)[nH]n1 ZINC001329513557 973805483 /nfs/dbraw/zinc/80/54/83/973805483.db2.gz FJTHZYPWTVYGFV-GFCCVEGCSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H](C)OC3(CCCC3)C2)[nH]n1 ZINC001329513557 973805486 /nfs/dbraw/zinc/80/54/86/973805486.db2.gz FJTHZYPWTVYGFV-GFCCVEGCSA-N 1 2 249.358 2.252 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CC(C)(C)C2(C)C)nn1 ZINC001329736327 973905556 /nfs/dbraw/zinc/90/55/56/973905556.db2.gz GHYWLTKEYHBPOE-UHFFFAOYSA-N 1 2 236.363 2.479 20 0 BEADLO Cc1ccc(CNc2cc(N(C)C)nc[nH+]2)cc1 ZINC000585415578 973908916 /nfs/dbraw/zinc/90/89/16/973908916.db2.gz XNUVZSKKKVPWKE-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO Cc1ccc(CNc2cc(N(C)C)[nH+]cn2)cc1 ZINC000585415578 973908927 /nfs/dbraw/zinc/90/89/27/973908927.db2.gz XNUVZSKKKVPWKE-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO CC(C)(C)[C@H]1CCC[N@H+](Cc2nnc[nH]2)CC1 ZINC001329878481 973996327 /nfs/dbraw/zinc/99/63/27/973996327.db2.gz UTWWVTQBQHOHHU-NSHDSACASA-N 1 2 236.363 2.453 20 0 BEADLO CC(C)(C)[C@H]1CCC[N@@H+](Cc2nnc[nH]2)CC1 ZINC001329878481 973996343 /nfs/dbraw/zinc/99/63/43/973996343.db2.gz UTWWVTQBQHOHHU-NSHDSACASA-N 1 2 236.363 2.453 20 0 BEADLO C[C@@H](C(=O)NCCCCC1CC1)n1cc[nH+]c1 ZINC001329881283 973997962 /nfs/dbraw/zinc/99/79/62/973997962.db2.gz VPMGTUPBOUUCQQ-NSHDSACASA-N 1 2 235.331 2.141 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H]1CCc2c(C)cccc2C1 ZINC001171552811 974098188 /nfs/dbraw/zinc/09/81/88/974098188.db2.gz HKEGEOBZMDGEFP-WCQYABFASA-N 1 2 247.338 2.003 20 0 BEADLO CCOC(=[NH2+])CCCCOC[C@@H]1CCCO1 ZINC001224963157 974103601 /nfs/dbraw/zinc/10/36/01/974103601.db2.gz HMNRSKKTCJRJRU-NSHDSACASA-N 1 2 229.320 2.366 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2ccnc(F)c2)no1 ZINC001330322371 974235090 /nfs/dbraw/zinc/23/50/90/974235090.db2.gz CIJSGVMJQCNCNU-VIFPVBQESA-N 1 2 235.262 2.368 20 0 BEADLO CC(C)[NH+]1CC(Oc2cc(F)cc(F)c2)C1 ZINC001225226121 974265750 /nfs/dbraw/zinc/26/57/50/974265750.db2.gz ISDZBUHFRPEWRK-UHFFFAOYSA-N 1 2 227.254 2.436 20 0 BEADLO CCCCOC(=O)[C@H](C)Oc1cc[nH+]cc1 ZINC001225290838 974361151 /nfs/dbraw/zinc/36/11/51/974361151.db2.gz JWTOVJWHXADMEE-JTQLQIEISA-N 1 2 223.272 2.192 20 0 BEADLO CC[C@](C)([NH2+]Cc1nnc[nH]1)c1ccc(F)cc1 ZINC001330687819 974417558 /nfs/dbraw/zinc/41/75/58/974417558.db2.gz CXAXCBMXAAAWIL-ZDUSSCGKSA-N 1 2 248.305 2.359 20 0 BEADLO [CH2]CC[N@H+](CC[NH3+])[C@H]1CSc2ccccc2C1 ZINC001172201056 974482890 /nfs/dbraw/zinc/48/28/90/974482890.db2.gz LRTWAURFKLPHBG-CYBMUJFWSA-N 1 2 249.403 2.188 20 0 BEADLO [CH2]CC[N@@H+](CC[NH3+])[C@H]1CSc2ccccc2C1 ZINC001172201056 974482898 /nfs/dbraw/zinc/48/28/98/974482898.db2.gz LRTWAURFKLPHBG-CYBMUJFWSA-N 1 2 249.403 2.188 20 0 BEADLO CCc1nn(C[N@H+](C)CC2CC2)c(=S)o1 ZINC001331015877 974559064 /nfs/dbraw/zinc/55/90/64/974559064.db2.gz ATFBPEONMPOFDG-UHFFFAOYSA-N 1 2 227.333 2.067 20 0 BEADLO CCc1nn(C[N@@H+](C)CC2CC2)c(=S)o1 ZINC001331015877 974559073 /nfs/dbraw/zinc/55/90/73/974559073.db2.gz ATFBPEONMPOFDG-UHFFFAOYSA-N 1 2 227.333 2.067 20 0 BEADLO Cc1nc2c(s1)C[N@@H+]([C@@H]1COC(C)(C)C1)C2 ZINC001172295903 974564588 /nfs/dbraw/zinc/56/45/88/974564588.db2.gz UCLBXCJLSCYEMD-VIFPVBQESA-N 1 2 238.356 2.335 20 0 BEADLO Cc1nc2c(s1)C[N@H+]([C@@H]1COC(C)(C)C1)C2 ZINC001172295903 974564596 /nfs/dbraw/zinc/56/45/96/974564596.db2.gz UCLBXCJLSCYEMD-VIFPVBQESA-N 1 2 238.356 2.335 20 0 BEADLO CC[NH+]1CC(Oc2nccc3ccccc32)C1 ZINC001225749349 974667081 /nfs/dbraw/zinc/66/70/81/974667081.db2.gz JTPOXGSINFJJHD-UHFFFAOYSA-N 1 2 228.295 2.318 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@@H]2OCCC[C@@H]2C1 ZINC001331272429 974668675 /nfs/dbraw/zinc/66/86/75/974668675.db2.gz UZBFYIBYAXQXDG-MFKMUULPSA-N 1 2 236.290 2.226 20 0 BEADLO CC[C@H]1C[N@H+](Cc2[nH]nc(C)c2C)[C@@H](C)CO1 ZINC001331548632 974759781 /nfs/dbraw/zinc/75/97/81/974759781.db2.gz MJUBDVGPNQHSSS-CABZTGNLSA-N 1 2 237.347 2.026 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2[nH]nc(C)c2C)[C@@H](C)CO1 ZINC001331548632 974759784 /nfs/dbraw/zinc/75/97/84/974759784.db2.gz MJUBDVGPNQHSSS-CABZTGNLSA-N 1 2 237.347 2.026 20 0 BEADLO CC(C)COCC[C@@H](C)[N@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001172475030 974770764 /nfs/dbraw/zinc/77/07/64/974770764.db2.gz ZALMIMLVNJQRRB-UTUOFQBUSA-N 1 2 235.318 2.429 20 0 BEADLO CC(C)COCC[C@@H](C)[N@@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001172475030 974770769 /nfs/dbraw/zinc/77/07/69/974770769.db2.gz ZALMIMLVNJQRRB-UTUOFQBUSA-N 1 2 235.318 2.429 20 0 BEADLO C[C@H]1CC[N@H+](Cc2nnc[nH]2)[C@@H]1c1ccccc1 ZINC001331703342 974796235 /nfs/dbraw/zinc/79/62/35/974796235.db2.gz QZKFTRKANQSLEF-FZMZJTMJSA-N 1 2 242.326 2.388 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2nnc[nH]2)[C@@H]1c1ccccc1 ZINC001331703342 974796240 /nfs/dbraw/zinc/79/62/40/974796240.db2.gz QZKFTRKANQSLEF-FZMZJTMJSA-N 1 2 242.326 2.388 20 0 BEADLO CC(C)OCC[C@H](C)[N@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001172441604 974798444 /nfs/dbraw/zinc/79/84/44/974798444.db2.gz BLBUAUNVHWNEAM-GARJFASQSA-N 1 2 221.291 2.182 20 0 BEADLO CC(C)OCC[C@H](C)[N@@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001172441604 974798449 /nfs/dbraw/zinc/79/84/49/974798449.db2.gz BLBUAUNVHWNEAM-GARJFASQSA-N 1 2 221.291 2.182 20 0 BEADLO CCc1nc(C)ccc1OC1C[NH+](CC)C1 ZINC001226412139 974889820 /nfs/dbraw/zinc/88/98/20/974889820.db2.gz MZHJSBRMWAVCRF-UHFFFAOYSA-N 1 2 220.316 2.035 20 0 BEADLO O=C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccc(O)cc1 ZINC001204096798 974901656 /nfs/dbraw/zinc/90/16/56/974901656.db2.gz KQHIVMOCPWMYKR-BETUJISGSA-N 1 2 245.322 2.478 20 0 BEADLO O=C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccc(O)cc1 ZINC001204096798 974901663 /nfs/dbraw/zinc/90/16/63/974901663.db2.gz KQHIVMOCPWMYKR-BETUJISGSA-N 1 2 245.322 2.478 20 0 BEADLO Clc1ccc2c(c1)C[C@@H]([N@H+]1C[C@H]3C[C@@H](C1)O3)C2 ZINC001172722033 974905502 /nfs/dbraw/zinc/90/55/02/974905502.db2.gz NBOKROSMKRLVNZ-MELADBBJSA-N 1 2 249.741 2.280 20 0 BEADLO Clc1ccc2c(c1)C[C@@H]([N@@H+]1C[C@H]3C[C@@H](C1)O3)C2 ZINC001172722033 974905509 /nfs/dbraw/zinc/90/55/09/974905509.db2.gz NBOKROSMKRLVNZ-MELADBBJSA-N 1 2 249.741 2.280 20 0 BEADLO Clc1ccc2c(c1)C[C@@H]([NH+]1CCOCC1)C2 ZINC001172714623 974926076 /nfs/dbraw/zinc/92/60/76/974926076.db2.gz FSYFPYBEEVHECX-ZDUSSCGKSA-N 1 2 237.730 2.139 20 0 BEADLO Cc1cc(C)nc(C[NH+]2CC3(C2)CCCC3)n1 ZINC001248940253 974941660 /nfs/dbraw/zinc/94/16/60/974941660.db2.gz SYBJOVGIQKOEPA-UHFFFAOYSA-N 1 2 231.343 2.469 20 0 BEADLO CCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)[nH+]c1 ZINC000147000242 974943552 /nfs/dbraw/zinc/94/35/52/974943552.db2.gz KJWSDEAJQKHGMP-PHIMTYICSA-N 1 2 220.316 2.258 20 0 BEADLO CCc1nccc(Nc2ccc(NC)[nH+]c2)n1 ZINC001332197026 975002067 /nfs/dbraw/zinc/00/20/67/975002067.db2.gz DRMLELAAPAYIIH-UHFFFAOYSA-N 1 2 229.287 2.219 20 0 BEADLO CO[C@H]1CCC[C@@H]([N@H+](C)CC(F)F)C1 ZINC001172947774 975003457 /nfs/dbraw/zinc/00/34/57/975003457.db2.gz AUMIBKWEKRPGTF-BDAKNGLRSA-N 1 2 207.264 2.141 20 0 BEADLO CO[C@H]1CCC[C@@H]([N@@H+](C)CC(F)F)C1 ZINC001172947774 975003464 /nfs/dbraw/zinc/00/34/64/975003464.db2.gz AUMIBKWEKRPGTF-BDAKNGLRSA-N 1 2 207.264 2.141 20 0 BEADLO C[C@@H](C(=O)NCC1(CC2CC2)CC1)n1cc[nH+]c1 ZINC001332291239 975044805 /nfs/dbraw/zinc/04/48/05/975044805.db2.gz PEPNTGPMDXIDNT-NSHDSACASA-N 1 2 247.342 2.141 20 0 BEADLO Cn1cccc1C[N@@H+]1CC[C@](C)(F)[C@@H](F)C1 ZINC001203254258 975056985 /nfs/dbraw/zinc/05/69/85/975056985.db2.gz OKNSRZWYZIYXFQ-RYUDHWBXSA-N 1 2 228.286 2.297 20 0 BEADLO Cn1cccc1C[N@H+]1CC[C@](C)(F)[C@@H](F)C1 ZINC001203254258 975056992 /nfs/dbraw/zinc/05/69/92/975056992.db2.gz OKNSRZWYZIYXFQ-RYUDHWBXSA-N 1 2 228.286 2.297 20 0 BEADLO CC[NH+]1CC(Oc2cccc(F)c2C)C1 ZINC001226772137 975074027 /nfs/dbraw/zinc/07/40/27/975074027.db2.gz NGZQHLZNWPGFKV-UHFFFAOYSA-N 1 2 209.264 2.217 20 0 BEADLO CCc1ccc(C[C@@H](C)[N@@H+]2CCC(=O)C2)cc1 ZINC001173243473 975080317 /nfs/dbraw/zinc/08/03/17/975080317.db2.gz OAFNWYPUGWUJKQ-GFCCVEGCSA-N 1 2 231.339 2.455 20 0 BEADLO CCc1ccc(C[C@@H](C)[N@H+]2CCC(=O)C2)cc1 ZINC001173243473 975080324 /nfs/dbraw/zinc/08/03/24/975080324.db2.gz OAFNWYPUGWUJKQ-GFCCVEGCSA-N 1 2 231.339 2.455 20 0 BEADLO CC[C@H]1CC[C@@H](N2CC[NH2+]CC(F)(F)C2)C1 ZINC001173272935 975152411 /nfs/dbraw/zinc/15/24/11/975152411.db2.gz LKLFJBICKDGKDV-WDEREUQCSA-N 1 2 232.318 2.106 20 0 BEADLO CCSC[C@H](C)[NH2+][C@H](C(=O)OC)[C@@H](C)CC ZINC001173292628 975167940 /nfs/dbraw/zinc/16/79/40/975167940.db2.gz NHGBAQVLLBIBKZ-DCAQKATOSA-N 1 2 247.404 2.305 20 0 BEADLO CCC[C@H]([NH2+][C@@H](C)CSCC)C(=O)OC ZINC001173294507 975172228 /nfs/dbraw/zinc/17/22/28/975172228.db2.gz CRHSMTAWYMTNDA-UWVGGRQHSA-N 1 2 233.377 2.059 20 0 BEADLO CCOC(=O)[C@@H]([NH2+][C@@H](C)CSCC)C(C)C ZINC001173287685 975251356 /nfs/dbraw/zinc/25/13/56/975251356.db2.gz KYROXTPHXJHDNN-QWRGUYRKSA-N 1 2 247.404 2.305 20 0 BEADLO COC(=O)[C@H]1C[C@@H](Oc2c(C)cc[nH+]c2C)C1 ZINC001227261075 975334848 /nfs/dbraw/zinc/33/48/48/975334848.db2.gz XRHUVYXGKDDRPS-PHIMTYICSA-N 1 2 235.283 2.029 20 0 BEADLO CCOC(=O)C[C@@H](C)Oc1c(C)cc[nH+]c1C ZINC001227263156 975337306 /nfs/dbraw/zinc/33/73/06/975337306.db2.gz CLOFPXVCUHCKKR-SNVBAGLBSA-N 1 2 237.299 2.419 20 0 BEADLO CC1=C(Oc2c(C)cc[nH+]c2C)C(=O)O[C@H]1C ZINC001227264448 975339839 /nfs/dbraw/zinc/33/98/39/975339839.db2.gz MEIHDKJCPLLJCV-JTQLQIEISA-N 1 2 233.267 2.297 20 0 BEADLO COc1cc[nH+]cc1Nc1cccnc1 ZINC001173854452 975768367 /nfs/dbraw/zinc/76/83/67/975768367.db2.gz CQXFLMBGBPZTKE-UHFFFAOYSA-N 1 2 201.229 2.229 20 0 BEADLO C[NH+]1CC(Oc2ccc(-c3ccccn3)cc2)C1 ZINC001227906388 975785310 /nfs/dbraw/zinc/78/53/10/975785310.db2.gz JGSIEECGOMQGSN-UHFFFAOYSA-N 1 2 240.306 2.441 20 0 BEADLO Cc1ccccc1[C@@H]1CC[N@H+](Cc2nnc[nH]2)C1 ZINC001333581339 975864412 /nfs/dbraw/zinc/86/44/12/975864412.db2.gz DSDJZAKKCGWOLW-GFCCVEGCSA-N 1 2 242.326 2.103 20 0 BEADLO Cc1ccccc1[C@@H]1CC[N@@H+](Cc2nnc[nH]2)C1 ZINC001333581339 975864417 /nfs/dbraw/zinc/86/44/17/975864417.db2.gz DSDJZAKKCGWOLW-GFCCVEGCSA-N 1 2 242.326 2.103 20 0 BEADLO COc1cc2c(cc1O[C@@H](C)C(C)=O)C=[NH+]CC2 ZINC001228091470 975901876 /nfs/dbraw/zinc/90/18/76/975901876.db2.gz WWDGLYPTMUHXNB-JTQLQIEISA-N 1 2 247.294 2.027 20 0 BEADLO COc1cc2c(cc1O[C@H](C)C(C)=O)C=[NH+]CC2 ZINC001228091471 975903169 /nfs/dbraw/zinc/90/31/69/975903169.db2.gz WWDGLYPTMUHXNB-SNVBAGLBSA-N 1 2 247.294 2.027 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+]2CCOC[C@@H](C)C2)n1 ZINC001333732368 976036191 /nfs/dbraw/zinc/03/61/91/976036191.db2.gz FCDOAJKIAFAIBR-NSHDSACASA-N 1 2 237.347 2.001 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+]2CCOC[C@@H](C)C2)n1 ZINC001333732368 976036216 /nfs/dbraw/zinc/03/62/16/976036216.db2.gz FCDOAJKIAFAIBR-NSHDSACASA-N 1 2 237.347 2.001 20 0 BEADLO CN(C)c1ccc(Nc2ccoc2)c[nH+]1 ZINC001173931035 976041189 /nfs/dbraw/zinc/04/11/89/976041189.db2.gz DFWDDYCEINSBLD-UHFFFAOYSA-N 1 2 203.245 2.484 20 0 BEADLO CCc1cc(N[C@H](C)C2(CO)CC2)nc(CC)[nH+]1 ZINC001333764831 976070126 /nfs/dbraw/zinc/07/01/26/976070126.db2.gz OILFYJKVNXBIDP-SNVBAGLBSA-N 1 2 249.358 2.174 20 0 BEADLO Cc1[nH]c2ccc(O[C@H]3COC[C@@H]3C)cc2[nH+]1 ZINC001228327255 976119899 /nfs/dbraw/zinc/11/98/99/976119899.db2.gz QAQOFGSLRZXZIQ-SDBXPKJASA-N 1 2 232.283 2.285 20 0 BEADLO Cc1[nH]c2ccc(OC3CC4(COC4)C3)cc2[nH+]1 ZINC001228327930 976123404 /nfs/dbraw/zinc/12/34/04/976123404.db2.gz YJRGDCLUXTVFEG-UHFFFAOYSA-N 1 2 244.294 2.429 20 0 BEADLO CC1(C)CCC[N@H+](Cc2nncs2)C1 ZINC001334001311 976213768 /nfs/dbraw/zinc/21/37/68/976213768.db2.gz RXRLCHKIAFOBGJ-UHFFFAOYSA-N 1 2 211.334 2.160 20 0 BEADLO CC1(C)CCC[N@@H+](Cc2nncs2)C1 ZINC001334001311 976213785 /nfs/dbraw/zinc/21/37/85/976213785.db2.gz RXRLCHKIAFOBGJ-UHFFFAOYSA-N 1 2 211.334 2.160 20 0 BEADLO CCc1ccc(C)[nH+]c1Nc1cnc(OC)nc1 ZINC001174032617 976230037 /nfs/dbraw/zinc/23/00/37/976230037.db2.gz PQLTYBQEOJKDEH-UHFFFAOYSA-N 1 2 244.298 2.495 20 0 BEADLO C[C@@H](C(=O)N1CC=CC12CCCC2)n1cc[nH+]c1 ZINC001334253739 976407083 /nfs/dbraw/zinc/40/70/83/976407083.db2.gz RHZVUXGDAYKIFQ-LBPRGKRZSA-N 1 2 245.326 2.155 20 0 BEADLO Cn1c2ccccc2[nH+]c1Nc1cn[nH]c1 ZINC001174293418 976468736 /nfs/dbraw/zinc/46/87/36/976468736.db2.gz BFFOSEFLSMJSRO-UHFFFAOYSA-N 1 2 213.244 2.040 20 0 BEADLO COc1cc(Nc2[nH+]cc(C)cc2N)ccn1 ZINC001174303754 976495375 /nfs/dbraw/zinc/49/53/75/976495375.db2.gz XWQLOGXOWULALZ-UHFFFAOYSA-N 1 2 230.271 2.119 20 0 BEADLO Cc1ccc(C)c(Nc2ccc3ncnn3c2)[nH+]1 ZINC001174373013 976609988 /nfs/dbraw/zinc/60/99/88/976609988.db2.gz VDLJBEVVWYPMLQ-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO c1ncc(Nc2ccc(N3CCCC3)[nH+]c2)cn1 ZINC001174385900 976630402 /nfs/dbraw/zinc/63/04/02/976630402.db2.gz SSNHQXOWSOOYFE-UHFFFAOYSA-N 1 2 241.298 2.215 20 0 BEADLO Cc1c(Nc2cc(C)cc(C)[nH+]2)cnn1C ZINC001174389207 976644223 /nfs/dbraw/zinc/64/42/23/976644223.db2.gz NBMLENLRBXGFPF-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO Nc1cn(-c2cc[nH+]c3[nH]ccc32)c2cccnc12 ZINC001174410020 976698554 /nfs/dbraw/zinc/69/85/54/976698554.db2.gz FHHTUCXJFYLJBB-UHFFFAOYSA-N 1 2 249.277 2.436 20 0 BEADLO Cc1cc(CSCCn2cc[nH+]c2)c(C)nn1 ZINC001334814830 976710285 /nfs/dbraw/zinc/71/02/85/976710285.db2.gz YEBOOYLMHSCMBZ-UHFFFAOYSA-N 1 2 248.355 2.223 20 0 BEADLO Cc1n[nH]cc1Nc1ccn2cc[nH+]c2c1 ZINC001174472982 976782925 /nfs/dbraw/zinc/78/29/25/976782925.db2.gz JYLMZHCFQZHGLP-UHFFFAOYSA-N 1 2 213.244 2.109 20 0 BEADLO Cc1cc(NC2(CO)CCC2)nc(C2CCC2)[nH+]1 ZINC001334949351 976803211 /nfs/dbraw/zinc/80/32/11/976803211.db2.gz AGNUJGSTTPEGJY-UHFFFAOYSA-N 1 2 247.342 2.379 20 0 BEADLO C[NH+]1CC(Oc2cc(F)cc3scnc32)C1 ZINC001229279659 976810590 /nfs/dbraw/zinc/81/05/90/976810590.db2.gz LGMWLKZWRXYPON-UHFFFAOYSA-N 1 2 238.287 2.128 20 0 BEADLO COc1cc(N(C)c2[nH+]cccc2N)ccc1O ZINC001174540543 976831170 /nfs/dbraw/zinc/83/11/70/976831170.db2.gz QMXCTCZMXREZRP-UHFFFAOYSA-N 1 2 245.282 2.146 20 0 BEADLO COCCn1cc(Nc2cc(C)cc(C)[nH+]2)cn1 ZINC001174549008 976852546 /nfs/dbraw/zinc/85/25/46/976852546.db2.gz MGHKYKPIYPHQSU-UHFFFAOYSA-N 1 2 246.314 2.285 20 0 BEADLO CCCC(=O)Nc1ccc(OC2C[NH+](C)C2)cc1 ZINC001229487292 976878677 /nfs/dbraw/zinc/87/86/77/976878677.db2.gz LQZFSKFTHHVCHJ-UHFFFAOYSA-N 1 2 248.326 2.118 20 0 BEADLO C[C@@H](C(=O)NC(C)(C)/C=C/Cl)n1cc[nH+]c1 ZINC001335323984 976963368 /nfs/dbraw/zinc/96/33/68/976963368.db2.gz LUNFLYPCLBRSHH-MOVJSRMASA-N 1 2 241.722 2.091 20 0 BEADLO C=CNc1ccc(OC)nc1-n1cc[nH+]c1CC ZINC001174781097 976994839 /nfs/dbraw/zinc/99/48/39/976994839.db2.gz ITTQTRGIMRNPLS-UHFFFAOYSA-N 1 2 244.298 2.394 20 0 BEADLO c1snnc1C[NH2+]Cc1cc2ccccc2[nH]1 ZINC001335481219 977090251 /nfs/dbraw/zinc/09/02/51/977090251.db2.gz GVCOUBQLEOHFCI-UHFFFAOYSA-N 1 2 244.323 2.309 20 0 BEADLO CNc1cc(N[C@@H]2CCC[C@H](F)C2)[nH+]cn1 ZINC001335533410 977124889 /nfs/dbraw/zinc/12/48/89/977124889.db2.gz KEHQASSBWKWKLX-DTWKUNHWSA-N 1 2 224.283 2.211 20 0 BEADLO CNc1cc(N[C@H]2CCC[C@@H](F)C2)[nH+]cn1 ZINC001335533409 977125129 /nfs/dbraw/zinc/12/51/29/977125129.db2.gz KEHQASSBWKWKLX-BDAKNGLRSA-N 1 2 224.283 2.211 20 0 BEADLO Cc1ccc(Nc2ccncc2F)c(C)[nH+]1 ZINC001175197524 977297944 /nfs/dbraw/zinc/29/79/44/977297944.db2.gz ZOFBJYXRJFLFDN-UHFFFAOYSA-N 1 2 217.247 2.398 20 0 BEADLO CC[NH+]1CC(Oc2ncnc3c(C)cccc23)C1 ZINC001230817099 977343229 /nfs/dbraw/zinc/34/32/29/977343229.db2.gz PVMMXLVJBPRAOB-UHFFFAOYSA-N 1 2 243.310 2.021 20 0 BEADLO CN(C)c1ccc(Nc2cc(N)ccc2O)c[nH+]1 ZINC001175344161 977365156 /nfs/dbraw/zinc/36/51/56/977365156.db2.gz ADYZBQXPXRZVKM-UHFFFAOYSA-N 1 2 244.298 2.179 20 0 BEADLO Oc1cc2c(cc1O[C@@H]1C=CCC1)CC[NH+]=C2 ZINC001230921875 977383125 /nfs/dbraw/zinc/38/31/25/977383125.db2.gz USVIPKYWSNJVOB-GFCCVEGCSA-N 1 2 229.279 2.465 20 0 BEADLO Cc1cnc(Nc2ccc(N(C)C)[nH+]c2)c(C)n1 ZINC001175340510 977386084 /nfs/dbraw/zinc/38/60/84/977386084.db2.gz JLAXMTMOIDPERQ-UHFFFAOYSA-N 1 2 243.314 2.298 20 0 BEADLO C[NH+]1CC(Oc2cnc3c(F)cccc3c2)C1 ZINC001231144259 977510403 /nfs/dbraw/zinc/51/04/03/977510403.db2.gz VQGJGPGVUKTTFY-UHFFFAOYSA-N 1 2 232.258 2.067 20 0 BEADLO C[N@@H+]1CCC=C(Nc2c(F)cc(O)cc2F)C1 ZINC001175578519 977595069 /nfs/dbraw/zinc/59/50/69/977595069.db2.gz LJXZZRFQZCVORW-UHFFFAOYSA-N 1 2 240.253 2.302 20 0 BEADLO C[N@H+]1CCC=C(Nc2c(F)cc(O)cc2F)C1 ZINC001175578519 977595075 /nfs/dbraw/zinc/59/50/75/977595075.db2.gz LJXZZRFQZCVORW-UHFFFAOYSA-N 1 2 240.253 2.302 20 0 BEADLO CC(C)(C)[C@H]1CCN1C(=O)CCCn1cc[nH+]c1 ZINC001336356778 977644856 /nfs/dbraw/zinc/64/48/56/977644856.db2.gz TXFRLWOYARGVIQ-GFCCVEGCSA-N 1 2 249.358 2.310 20 0 BEADLO CCc1ccc(C[N@@H+]2C[C@H]3CC[C@@H]2CO3)nc1 ZINC001231646628 977661921 /nfs/dbraw/zinc/66/19/21/977661921.db2.gz LTBDAVFKTAWPLS-ZIAGYGMSSA-N 1 2 232.327 2.007 20 0 BEADLO CCc1ccc(C[N@H+]2C[C@H]3CC[C@@H]2CO3)nc1 ZINC001231646628 977661926 /nfs/dbraw/zinc/66/19/26/977661926.db2.gz LTBDAVFKTAWPLS-ZIAGYGMSSA-N 1 2 232.327 2.007 20 0 BEADLO CCOc1ncccc1C[N@@H+]1C[C@H](F)C[C@H]1C ZINC001231760253 977736746 /nfs/dbraw/zinc/73/67/46/977736746.db2.gz IGDPEIJROOOUJJ-ZYHUDNBSSA-N 1 2 238.306 2.413 20 0 BEADLO CCOc1ncccc1C[N@H+]1C[C@H](F)C[C@H]1C ZINC001231760253 977736757 /nfs/dbraw/zinc/73/67/57/977736757.db2.gz IGDPEIJROOOUJJ-ZYHUDNBSSA-N 1 2 238.306 2.413 20 0 BEADLO CN(C)c1ccc(Nc2cnn(C3CC3)c2)c[nH+]1 ZINC001175958172 977823363 /nfs/dbraw/zinc/82/33/63/977823363.db2.gz IIVUNIXOCSCTDC-UHFFFAOYSA-N 1 2 243.314 2.423 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(=O)C(C)(C)C2)cc(C)n1 ZINC001232002064 977835575 /nfs/dbraw/zinc/83/55/75/977835575.db2.gz WYLDRKHKXRPWGP-UHFFFAOYSA-N 1 2 246.354 2.499 20 0 BEADLO Cc1cc(C[N@H+]2CCC(=O)C(C)(C)C2)cc(C)n1 ZINC001232002064 977835581 /nfs/dbraw/zinc/83/55/81/977835581.db2.gz WYLDRKHKXRPWGP-UHFFFAOYSA-N 1 2 246.354 2.499 20 0 BEADLO COc1cc[nH+]c(Nc2ccc3[nH]nnc3c2)c1 ZINC001175995419 977852244 /nfs/dbraw/zinc/85/22/44/977852244.db2.gz DGTCSFALKFJYEB-UHFFFAOYSA-N 1 2 241.254 2.105 20 0 BEADLO COc1cccc2[nH]cc(C[NH+]3CCOCC3)c21 ZINC001232032848 977856887 /nfs/dbraw/zinc/85/68/87/977856887.db2.gz FEXZPDDMOQDIGC-UHFFFAOYSA-N 1 2 246.310 2.009 20 0 BEADLO CCc1cccc(NC2=CCN(C(C)=O)CC2)[nH+]1 ZINC001176028304 977865000 /nfs/dbraw/zinc/86/50/00/977865000.db2.gz IGODLRXCAMQJRE-UHFFFAOYSA-N 1 2 245.326 2.192 20 0 BEADLO Cc1ncccc1C[N@H+](C)Cc1cncc(O)c1 ZINC001232045746 977870217 /nfs/dbraw/zinc/87/02/17/977870217.db2.gz BTDHNRCVVVMQKZ-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO Cc1ncccc1C[N@@H+](C)Cc1cncc(O)c1 ZINC001232045746 977870221 /nfs/dbraw/zinc/87/02/21/977870221.db2.gz BTDHNRCVVVMQKZ-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO CC[N@H+](C)Cc1c(Cl)n(C)nc1C(F)F ZINC001232052395 977875148 /nfs/dbraw/zinc/87/51/48/977875148.db2.gz REAGLGYDBRHYPX-UHFFFAOYSA-N 1 2 237.681 2.463 20 0 BEADLO CC[N@@H+](C)Cc1c(Cl)n(C)nc1C(F)F ZINC001232052395 977875150 /nfs/dbraw/zinc/87/51/50/977875150.db2.gz REAGLGYDBRHYPX-UHFFFAOYSA-N 1 2 237.681 2.463 20 0 BEADLO C[C@@H]1C[NH+](Cc2cc3ncccc3[nH]2)C[C@@H](C)O1 ZINC001232063863 977877164 /nfs/dbraw/zinc/87/71/64/977877164.db2.gz PKTWKQCDHTVGIR-GHMZBOCLSA-N 1 2 245.326 2.172 20 0 BEADLO CC1(C)C[N@H+](Cc2cc3ccncc3[nH]2)CCO1 ZINC001232089531 977889669 /nfs/dbraw/zinc/88/96/69/977889669.db2.gz WBEBGYSXCMVHEL-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO CC1(C)C[N@@H+](Cc2cc3ccncc3[nH]2)CCO1 ZINC001232089531 977889672 /nfs/dbraw/zinc/88/96/72/977889672.db2.gz WBEBGYSXCMVHEL-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc3ccncc3[nH]2)[C@@H](C)CO1 ZINC001232096597 977891890 /nfs/dbraw/zinc/89/18/90/977891890.db2.gz FSKADKQCGRYWDG-WDEREUQCSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc3ccncc3[nH]2)[C@@H](C)CO1 ZINC001232096597 977891895 /nfs/dbraw/zinc/89/18/95/977891895.db2.gz FSKADKQCGRYWDG-WDEREUQCSA-N 1 2 245.326 2.172 20 0 BEADLO CCc1cc(NCc2ccncn2)nc(CC)[nH+]1 ZINC001336760394 977927277 /nfs/dbraw/zinc/92/72/77/977927277.db2.gz GZODNXSSGMZMLK-UHFFFAOYSA-N 1 2 243.314 2.004 20 0 BEADLO CC(=O)[C@@H]1CCC[N@H+](Cc2ncsc2C)C1 ZINC001232207090 977933160 /nfs/dbraw/zinc/93/31/60/977933160.db2.gz VZRYOOKEZHKXAK-LLVKDONJSA-N 1 2 238.356 2.253 20 0 BEADLO CC(=O)[C@@H]1CCC[N@@H+](Cc2ncsc2C)C1 ZINC001232207090 977933165 /nfs/dbraw/zinc/93/31/65/977933165.db2.gz VZRYOOKEZHKXAK-LLVKDONJSA-N 1 2 238.356 2.253 20 0 BEADLO COc1ccncc1Nc1c[nH+]ccc1OC ZINC001176116592 977943750 /nfs/dbraw/zinc/94/37/50/977943750.db2.gz HCISAZWUQINACN-UHFFFAOYSA-N 1 2 231.255 2.237 20 0 BEADLO C[C@]1(F)CCC[N@H+](Cc2cnsc2)C1 ZINC001232223008 977944977 /nfs/dbraw/zinc/94/49/77/977944977.db2.gz BLNVRZKEFZIQOO-JTQLQIEISA-N 1 2 214.309 2.467 20 0 BEADLO C[C@]1(F)CCC[N@@H+](Cc2cnsc2)C1 ZINC001232223008 977944991 /nfs/dbraw/zinc/94/49/91/977944991.db2.gz BLNVRZKEFZIQOO-JTQLQIEISA-N 1 2 214.309 2.467 20 0 BEADLO CCn1ncc(Nc2c[nH+]ccc2OC)c1C ZINC001176117147 977945647 /nfs/dbraw/zinc/94/56/47/977945647.db2.gz TZFOHDUWUIQCOG-UHFFFAOYSA-N 1 2 232.287 2.359 20 0 BEADLO CCn1cc(Nc2c[nH+]ccc2OC)c(C)n1 ZINC001176117082 977946509 /nfs/dbraw/zinc/94/65/09/977946509.db2.gz QLDTYKYFYHGGRZ-UHFFFAOYSA-N 1 2 232.287 2.359 20 0 BEADLO COc1cc[nH+]cc1Nc1cncc(Cl)n1 ZINC001176116847 977946883 /nfs/dbraw/zinc/94/68/83/977946883.db2.gz MYYFMOHJPJONEL-UHFFFAOYSA-N 1 2 236.662 2.277 20 0 BEADLO COc1cc[nH+]cc1Nc1cnc(C)nc1C ZINC001176119057 977949561 /nfs/dbraw/zinc/94/95/61/977949561.db2.gz UIHSXQIXAZHUAE-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO COc1cc[nH+]cc1Nc1cc(C)nc(C)n1 ZINC001176118801 977950357 /nfs/dbraw/zinc/95/03/57/977950357.db2.gz INCZHHDGBBEEFA-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO COc1cc[nH+]cc1Nc1c(C)noc1C ZINC001176118548 977950799 /nfs/dbraw/zinc/95/07/99/977950799.db2.gz NKERSAMAUZOKSY-UHFFFAOYSA-N 1 2 219.244 2.439 20 0 BEADLO COc1cc[nH+]cc1Nc1noc2cccnc12 ZINC001176118757 977951774 /nfs/dbraw/zinc/95/17/74/977951774.db2.gz GPUKGQRYXYALHG-UHFFFAOYSA-N 1 2 242.238 2.370 20 0 BEADLO COc1cc[nH+]cc1Nc1ncccc1N(C)C ZINC001176121923 977955733 /nfs/dbraw/zinc/95/57/33/977955733.db2.gz RUUNWTXKUOKJMF-UHFFFAOYSA-N 1 2 244.298 2.295 20 0 BEADLO COc1cc[nH+]cc1Nc1ccn2ccnc2c1 ZINC001176122008 977956271 /nfs/dbraw/zinc/95/62/71/977956271.db2.gz YTFOZLOCYCVYAH-UHFFFAOYSA-N 1 2 240.266 2.482 20 0 BEADLO COc1cc[nH+]cc1Nc1ccc(CO)c(F)c1 ZINC001176124893 977957781 /nfs/dbraw/zinc/95/77/81/977957781.db2.gz UFYXINRQDUAHPF-UHFFFAOYSA-N 1 2 248.257 2.465 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC[C@@H](C(F)F)C2)s1 ZINC001232245246 977975231 /nfs/dbraw/zinc/97/52/31/977975231.db2.gz OVPILSVRKDSWTE-MRVPVSSYSA-N 1 2 247.314 2.324 20 0 BEADLO Cc1nnc(C[N@H+]2CCC[C@@H](C(F)F)C2)s1 ZINC001232245246 977975242 /nfs/dbraw/zinc/97/52/42/977975242.db2.gz OVPILSVRKDSWTE-MRVPVSSYSA-N 1 2 247.314 2.324 20 0 BEADLO CCOc1ncc(C[N@H+](C)CCF)cc1C ZINC001232308714 977999351 /nfs/dbraw/zinc/99/93/51/977999351.db2.gz VMZSQARIEHQTHP-UHFFFAOYSA-N 1 2 226.295 2.190 20 0 BEADLO CCOc1ncc(C[N@@H+](C)CCF)cc1C ZINC001232308714 977999367 /nfs/dbraw/zinc/99/93/67/977999367.db2.gz VMZSQARIEHQTHP-UHFFFAOYSA-N 1 2 226.295 2.190 20 0 BEADLO Cc1ccc(C)c(Nc2cnc(N(C)C)nc2)[nH+]1 ZINC001176329235 978025613 /nfs/dbraw/zinc/02/56/13/978025613.db2.gz LHROASLLBVFWAV-UHFFFAOYSA-N 1 2 243.314 2.298 20 0 BEADLO COc1cc(C)c(C[N@@H+]2CCC[C@@H](F)C2)cn1 ZINC001232355174 978030915 /nfs/dbraw/zinc/03/09/15/978030915.db2.gz OPZCZMAJBTWHGG-GFCCVEGCSA-N 1 2 238.306 2.333 20 0 BEADLO COc1cc(C)c(C[N@H+]2CCC[C@@H](F)C2)cn1 ZINC001232355174 978030925 /nfs/dbraw/zinc/03/09/25/978030925.db2.gz OPZCZMAJBTWHGG-GFCCVEGCSA-N 1 2 238.306 2.333 20 0 BEADLO Cc1ccc(OC(C)C)c(C[NH+]2CC(C)(O)C2)c1 ZINC001232394566 978049911 /nfs/dbraw/zinc/04/99/11/978049911.db2.gz SMCGFCNYIRSNKZ-UHFFFAOYSA-N 1 2 249.354 2.349 20 0 BEADLO CCN(C)c1ccc(Nc2cnc(C)nc2)c[nH+]1 ZINC001176395364 978070400 /nfs/dbraw/zinc/07/04/00/978070400.db2.gz PSDUIGIRPVTVAC-UHFFFAOYSA-N 1 2 243.314 2.380 20 0 BEADLO Cc1[nH]c(CN2CCC(=O)[C@@H]3CCCC[C@H]32)c[nH+]1 ZINC001232458660 978086633 /nfs/dbraw/zinc/08/66/33/978086633.db2.gz PTQDAMWKUVHQHN-CHWSQXEVSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1[nH]cc(CN2CCC(=O)[C@@H]3CCCC[C@H]32)[nH+]1 ZINC001232458660 978086645 /nfs/dbraw/zinc/08/66/45/978086645.db2.gz PTQDAMWKUVHQHN-CHWSQXEVSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1[nH]c(CN2CCc3sccc3C2)c[nH+]1 ZINC001232459965 978086723 /nfs/dbraw/zinc/08/67/23/978086723.db2.gz KTEJDGAJSDRHIZ-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1[nH]c(CN2CCc3ccc(F)cc3C2)c[nH+]1 ZINC001232463088 978097879 /nfs/dbraw/zinc/09/78/79/978097879.db2.gz BUPLHZHZDJPDRJ-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1[nH]cc(CN2CCc3ccc(F)cc3C2)[nH+]1 ZINC001232463088 978097890 /nfs/dbraw/zinc/09/78/90/978097890.db2.gz BUPLHZHZDJPDRJ-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@@H](C(F)F)C2)c[nH]1 ZINC001232464343 978106968 /nfs/dbraw/zinc/10/69/68/978106968.db2.gz YYPTVHWINWIGKU-SECBINFHSA-N 1 2 229.274 2.195 20 0 BEADLO Cc1cccc(F)c1C[N@@H+](C)C1(C)COC1 ZINC001232484233 978132217 /nfs/dbraw/zinc/13/22/17/978132217.db2.gz YPJXSEZFZCRPGZ-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cccc(F)c1C[N@H+](C)C1(C)COC1 ZINC001232484233 978132224 /nfs/dbraw/zinc/13/22/24/978132224.db2.gz YPJXSEZFZCRPGZ-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO Fc1ccnc(C[NH+]2CC(c3cccnc3)C2)c1 ZINC001232495106 978146216 /nfs/dbraw/zinc/14/62/16/978146216.db2.gz NIQANPAPPZYMCD-UHFFFAOYSA-N 1 2 243.285 2.215 20 0 BEADLO c1cc(Nc2ccc[nH+]c2N2CCCC2)on1 ZINC001176743262 978169173 /nfs/dbraw/zinc/16/91/73/978169173.db2.gz HYHYICDEYTUFJP-UHFFFAOYSA-N 1 2 230.271 2.413 20 0 BEADLO c1cnnc(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001176744179 978171557 /nfs/dbraw/zinc/17/15/57/978171557.db2.gz QDFJVWAXXYKCPD-UHFFFAOYSA-N 1 2 241.298 2.215 20 0 BEADLO CC[N@H+](Cc1cc2ccoc2cn1)C1COC1 ZINC001232554412 978183266 /nfs/dbraw/zinc/18/32/66/978183266.db2.gz USJLZYAIEMNJMI-UHFFFAOYSA-N 1 2 232.283 2.049 20 0 BEADLO CC[N@@H+](Cc1cc2ccoc2cn1)C1COC1 ZINC001232554412 978183269 /nfs/dbraw/zinc/18/32/69/978183269.db2.gz USJLZYAIEMNJMI-UHFFFAOYSA-N 1 2 232.283 2.049 20 0 BEADLO COc1cccc(C)c1C[N@H+](C)CC(C)=O ZINC001232620430 978201917 /nfs/dbraw/zinc/20/19/17/978201917.db2.gz NNWQBIFXIBISNQ-UHFFFAOYSA-N 1 2 221.300 2.024 20 0 BEADLO COc1cccc(C)c1C[N@@H+](C)CC(C)=O ZINC001232620430 978201927 /nfs/dbraw/zinc/20/19/27/978201927.db2.gz NNWQBIFXIBISNQ-UHFFFAOYSA-N 1 2 221.300 2.024 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)Cc2c[nH]c[nH+]2)CC(C)(C)C1 ZINC001176836866 978205836 /nfs/dbraw/zinc/20/58/36/978205836.db2.gz RBWQWVOBGSFCIJ-WDEREUQCSA-N 1 2 249.358 2.283 20 0 BEADLO CNc1ccccc1C[N@@H+]1CCC(=O)C[C@H]1C ZINC001232665986 978214875 /nfs/dbraw/zinc/21/48/75/978214875.db2.gz FLAKZRRYHKOIRQ-LLVKDONJSA-N 1 2 232.327 2.282 20 0 BEADLO CNc1ccccc1C[N@H+]1CCC(=O)C[C@H]1C ZINC001232665986 978214879 /nfs/dbraw/zinc/21/48/79/978214879.db2.gz FLAKZRRYHKOIRQ-LLVKDONJSA-N 1 2 232.327 2.282 20 0 BEADLO CCCn1cnc(C[N@@H+]2C[C@@H](C)C[C@H]2CF)c1 ZINC001232797620 978285905 /nfs/dbraw/zinc/28/59/05/978285905.db2.gz MFMGJXTWCXUWIP-AAEUAGOBSA-N 1 2 239.338 2.473 20 0 BEADLO CCCn1cnc(C[N@H+]2C[C@@H](C)C[C@H]2CF)c1 ZINC001232797620 978285916 /nfs/dbraw/zinc/28/59/16/978285916.db2.gz MFMGJXTWCXUWIP-AAEUAGOBSA-N 1 2 239.338 2.473 20 0 BEADLO COc1cc(N(C)c2[nH+]cccc2N)ccc1N ZINC001249715049 978300567 /nfs/dbraw/zinc/30/05/67/978300567.db2.gz NCYSMEFSOSSQPN-UHFFFAOYSA-N 1 2 244.298 2.023 20 0 BEADLO FC(F)CCNc1cc(NCC2CC2)nc[nH+]1 ZINC001337433239 978336237 /nfs/dbraw/zinc/33/62/37/978336237.db2.gz XZATUBQTDAYWDJ-UHFFFAOYSA-N 1 2 242.273 2.366 20 0 BEADLO FC(F)CCNc1cc(NCC2CC2)[nH+]cn1 ZINC001337433239 978336252 /nfs/dbraw/zinc/33/62/52/978336252.db2.gz XZATUBQTDAYWDJ-UHFFFAOYSA-N 1 2 242.273 2.366 20 0 BEADLO CC(=O)[C@@H]1CCC[N@@H+]1Cc1cc(F)cnc1C ZINC001232994476 978396015 /nfs/dbraw/zinc/39/60/15/978396015.db2.gz RSPZJUSYUNMKFF-ZDUSSCGKSA-N 1 2 236.290 2.083 20 0 BEADLO CC(=O)[C@@H]1CCC[N@H+]1Cc1cc(F)cnc1C ZINC001232994476 978396024 /nfs/dbraw/zinc/39/60/24/978396024.db2.gz RSPZJUSYUNMKFF-ZDUSSCGKSA-N 1 2 236.290 2.083 20 0 BEADLO Cc1cc(C)c(C[N@H+](C)Cc2cnccn2)cn1 ZINC001233007751 978403188 /nfs/dbraw/zinc/40/31/88/978403188.db2.gz QWTBUWSMIJOWHR-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cc(C)c(C[N@@H+](C)Cc2cnccn2)cn1 ZINC001233007751 978403193 /nfs/dbraw/zinc/40/31/93/978403193.db2.gz QWTBUWSMIJOWHR-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1cc(Cl)ncc1O ZINC001233032080 978413583 /nfs/dbraw/zinc/41/35/83/978413583.db2.gz DDVPZQXJCMAKHM-APPZFPTMSA-N 1 2 244.697 2.373 20 0 BEADLO CCOC(=O)c1ccsc1C[NH+]1CC=CC1 ZINC001233018554 978415433 /nfs/dbraw/zinc/41/54/33/978415433.db2.gz YYZQKSROQNVLHW-UHFFFAOYSA-N 1 2 237.324 2.297 20 0 BEADLO CC1(C)C[NH+](Cc2cc(Cl)ncc2O)C1 ZINC001233031399 978415954 /nfs/dbraw/zinc/41/59/54/978415954.db2.gz BHVYPCVUMMYYDG-UHFFFAOYSA-N 1 2 226.707 2.282 20 0 BEADLO c1[nH+]cn2c1CN(CCOC1CCCCC1)CC2 ZINC001337585702 978420404 /nfs/dbraw/zinc/42/04/04/978420404.db2.gz LPRIZMKIMRDADO-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc(Cl)ncc2O)C[C@@H]1F ZINC001233032830 978422414 /nfs/dbraw/zinc/42/24/14/978422414.db2.gz UGOWRJBDUPRXAM-APPZFPTMSA-N 1 2 244.697 2.230 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc(Cl)ncc2O)C[C@@H]1F ZINC001233032830 978422418 /nfs/dbraw/zinc/42/24/18/978422418.db2.gz UGOWRJBDUPRXAM-APPZFPTMSA-N 1 2 244.697 2.230 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H]1CC=CCC1 ZINC001337639383 978438733 /nfs/dbraw/zinc/43/87/33/978438733.db2.gz JEXZXAQBRDJWAP-GFCCVEGCSA-N 1 2 230.311 2.415 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nc3ccccn3n2)[C@@H](C)C1 ZINC001233069783 978459137 /nfs/dbraw/zinc/45/91/37/978459137.db2.gz GCPPWGFQUUMFBA-NEPJUHHUSA-N 1 2 244.342 2.350 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nc3ccccn3n2)[C@@H](C)C1 ZINC001233069783 978459149 /nfs/dbraw/zinc/45/91/49/978459149.db2.gz GCPPWGFQUUMFBA-NEPJUHHUSA-N 1 2 244.342 2.350 20 0 BEADLO F[C@@H]1CCC[N@H+](Cc2nc3ccccn3n2)CC1 ZINC001233069720 978459749 /nfs/dbraw/zinc/45/97/49/978459749.db2.gz YYANBDMEMUQJIC-LLVKDONJSA-N 1 2 248.305 2.053 20 0 BEADLO F[C@@H]1CCC[N@@H+](Cc2nc3ccccn3n2)CC1 ZINC001233069720 978459753 /nfs/dbraw/zinc/45/97/53/978459753.db2.gz YYANBDMEMUQJIC-LLVKDONJSA-N 1 2 248.305 2.053 20 0 BEADLO Cc1cc(C[N@@H+]2CCCCC23COC3)cnc1C ZINC001233161883 978480815 /nfs/dbraw/zinc/48/08/15/978480815.db2.gz KVXSQNYWHPAAFR-UHFFFAOYSA-N 1 2 246.354 2.453 20 0 BEADLO Cc1cc(C[N@H+]2CCCCC23COC3)cnc1C ZINC001233161883 978480818 /nfs/dbraw/zinc/48/08/18/978480818.db2.gz KVXSQNYWHPAAFR-UHFFFAOYSA-N 1 2 246.354 2.453 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1cnc(C)c(C)c1 ZINC001233161194 978481275 /nfs/dbraw/zinc/48/12/75/978481275.db2.gz WFNGPCDEKFBIFM-CQSZACIVSA-N 1 2 234.343 2.309 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1cnc(C)c(C)c1 ZINC001233161194 978481281 /nfs/dbraw/zinc/48/12/81/978481281.db2.gz WFNGPCDEKFBIFM-CQSZACIVSA-N 1 2 234.343 2.309 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccncn2)cnc1C ZINC001233162378 978482129 /nfs/dbraw/zinc/48/21/29/978482129.db2.gz AYUCHZVKZQQUPE-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccncn2)cnc1C ZINC001233162378 978482134 /nfs/dbraw/zinc/48/21/34/978482134.db2.gz AYUCHZVKZQQUPE-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO COc1c(O)cccc1C[NH+]1CC(C(F)F)C1 ZINC001233258903 978516867 /nfs/dbraw/zinc/51/68/67/978516867.db2.gz YHQGHAUZQBPPTC-UHFFFAOYSA-N 1 2 243.253 2.098 20 0 BEADLO CCN(Cc1ccc(Cl)o1)C1C[NH+](C)C1 ZINC001233317214 978544313 /nfs/dbraw/zinc/54/43/13/978544313.db2.gz CLOOBQQLVNMDSJ-UHFFFAOYSA-N 1 2 228.723 2.069 20 0 BEADLO CC[N@H+](Cc1ccc(Cl)o1)C1CN(C)C1 ZINC001233317214 978544292 /nfs/dbraw/zinc/54/42/92/978544292.db2.gz CLOOBQQLVNMDSJ-UHFFFAOYSA-N 1 2 228.723 2.069 20 0 BEADLO CC[N@@H+](Cc1ccc(Cl)o1)C1CN(C)C1 ZINC001233317214 978544306 /nfs/dbraw/zinc/54/43/06/978544306.db2.gz CLOOBQQLVNMDSJ-UHFFFAOYSA-N 1 2 228.723 2.069 20 0 BEADLO CCc1ccc(N2CC[C@H](CCCO)C2)[nH+]c1 ZINC001337892816 978550616 /nfs/dbraw/zinc/55/06/16/978550616.db2.gz MUUXBAHBNUBUIN-ZDUSSCGKSA-N 1 2 234.343 2.243 20 0 BEADLO CCc1ccc(N2CC[C@@H](CCCO)C2)[nH+]c1 ZINC001337892815 978551288 /nfs/dbraw/zinc/55/12/88/978551288.db2.gz MUUXBAHBNUBUIN-CYBMUJFWSA-N 1 2 234.343 2.243 20 0 BEADLO Cc1cnsc1C[N@@H+]1CCOC(C)(C)C1 ZINC001233318281 978552563 /nfs/dbraw/zinc/55/25/63/978552563.db2.gz XRZGQIQDKWVMPS-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1cnsc1C[N@H+]1CCOC(C)(C)C1 ZINC001233318281 978552573 /nfs/dbraw/zinc/55/25/73/978552573.db2.gz XRZGQIQDKWVMPS-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@@H](CO)[C@H]2C)[nH+]1 ZINC001337909542 978560330 /nfs/dbraw/zinc/56/03/30/978560330.db2.gz IIHUIOLGTDSXLT-MNOVXSKESA-N 1 2 238.306 2.126 20 0 BEADLO Cc1cc(F)cc(N2C[C@@H]3COC[C@]3(C)C2)[nH+]1 ZINC001337926538 978565421 /nfs/dbraw/zinc/56/54/21/978565421.db2.gz XZCDKDSEIMXMHY-MFKMUULPSA-N 1 2 236.290 2.002 20 0 BEADLO Cc1cc(F)cc(N2C[C@H]3COC[C@]3(C)C2)[nH+]1 ZINC001337926536 978566498 /nfs/dbraw/zinc/56/64/98/978566498.db2.gz XZCDKDSEIMXMHY-GWCFXTLKSA-N 1 2 236.290 2.002 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2ccc(C)nc2)o1 ZINC001233367807 978581225 /nfs/dbraw/zinc/58/12/25/978581225.db2.gz GIZPWJBFSAUMGD-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2ccc(C)nc2)o1 ZINC001233367807 978581230 /nfs/dbraw/zinc/58/12/30/978581230.db2.gz GIZPWJBFSAUMGD-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO C[C@H]1c2cccn2CCN1Cc1cccc(N)[nH+]1 ZINC001233371855 978587831 /nfs/dbraw/zinc/58/78/31/978587831.db2.gz LDZBXWMPWIZFFU-NSHDSACASA-N 1 2 242.326 2.042 20 0 BEADLO C[C@H]1c2cccn2CC[N@H+]1Cc1cccc(N)n1 ZINC001233371855 978587841 /nfs/dbraw/zinc/58/78/41/978587841.db2.gz LDZBXWMPWIZFFU-NSHDSACASA-N 1 2 242.326 2.042 20 0 BEADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1cccc(N)n1 ZINC001233371855 978587845 /nfs/dbraw/zinc/58/78/45/978587845.db2.gz LDZBXWMPWIZFFU-NSHDSACASA-N 1 2 242.326 2.042 20 0 BEADLO Cc1cc(F)cc(N(C)[C@@H]2CCCC[C@H]2O)[nH+]1 ZINC001338063212 978601660 /nfs/dbraw/zinc/60/16/60/978601660.db2.gz JLNBANVIOGYNAK-VXGBXAGGSA-N 1 2 238.306 2.269 20 0 BEADLO CCc1[nH]c(CNC(=O)c2ccc(F)cc2)c[nH+]1 ZINC001178662543 978603749 /nfs/dbraw/zinc/60/37/49/978603749.db2.gz PFRGUNPSHVOMFW-UHFFFAOYSA-N 1 2 247.273 2.041 20 0 BEADLO CCc1[nH]cc(CNC(=O)c2ccc(F)cc2)[nH+]1 ZINC001178662543 978603752 /nfs/dbraw/zinc/60/37/52/978603752.db2.gz PFRGUNPSHVOMFW-UHFFFAOYSA-N 1 2 247.273 2.041 20 0 BEADLO C=C/C=C/CC(=O)NCc1[nH]c2c([nH+]1)CCCC2 ZINC001178922738 978646811 /nfs/dbraw/zinc/64/68/11/978646811.db2.gz WAWZCWZQWICLGG-ONEGZZNKSA-N 1 2 245.326 2.037 20 0 BEADLO CCc1cc(NCc2cnccn2)nc(CC)[nH+]1 ZINC001338313639 978658942 /nfs/dbraw/zinc/65/89/42/978658942.db2.gz LOXDSIIPRHRKLH-UHFFFAOYSA-N 1 2 243.314 2.004 20 0 BEADLO CC[C@H](C)C(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001179087360 978667045 /nfs/dbraw/zinc/66/70/45/978667045.db2.gz CADBCMDOFQAESD-VIFPVBQESA-N 1 2 223.320 2.195 20 0 BEADLO CC[C@H](C)C(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001179087360 978667049 /nfs/dbraw/zinc/66/70/49/978667049.db2.gz CADBCMDOFQAESD-VIFPVBQESA-N 1 2 223.320 2.195 20 0 BEADLO c1cc(C[N@@H+]2CCCCC23COC3)co1 ZINC001204242805 978697021 /nfs/dbraw/zinc/69/70/21/978697021.db2.gz APWCBYPALLUAOK-UHFFFAOYSA-N 1 2 207.273 2.035 20 0 BEADLO c1cc(C[N@H+]2CCCCC23COC3)co1 ZINC001204242805 978697025 /nfs/dbraw/zinc/69/70/25/978697025.db2.gz APWCBYPALLUAOK-UHFFFAOYSA-N 1 2 207.273 2.035 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)CC(C)(C)C ZINC001338992529 978768912 /nfs/dbraw/zinc/76/89/12/978768912.db2.gz LGUXFLYGODAANW-UHFFFAOYSA-N 1 2 220.316 2.495 20 0 BEADLO CSc1ccc(C)c(OC2C[NH+](C)C2)c1 ZINC001234232950 978800133 /nfs/dbraw/zinc/80/01/33/978800133.db2.gz AKPJRSVQRKXVEI-UHFFFAOYSA-N 1 2 223.341 2.410 20 0 BEADLO C[NH+]1CC(Oc2cncc(-c3ccccc3)c2)C1 ZINC001234268855 978807102 /nfs/dbraw/zinc/80/71/02/978807102.db2.gz XDYQHGFYEPYWMY-UHFFFAOYSA-N 1 2 240.306 2.441 20 0 BEADLO COc1cccc(C[N@@H+]2CCCC[C@@H]2C(C)=O)n1 ZINC000070093724 978807215 /nfs/dbraw/zinc/80/72/15/978807215.db2.gz PURZWOSJJDWUNT-CYBMUJFWSA-N 1 2 248.326 2.034 20 0 BEADLO COc1cccc(C[N@H+]2CCCC[C@@H]2C(C)=O)n1 ZINC000070093724 978807218 /nfs/dbraw/zinc/80/72/18/978807218.db2.gz PURZWOSJJDWUNT-CYBMUJFWSA-N 1 2 248.326 2.034 20 0 BEADLO Cc1[nH]c(CN2CCCC[C@H](F)C2)c(C)[nH+]1 ZINC001234600388 978869743 /nfs/dbraw/zinc/86/97/43/978869743.db2.gz FJSKGLVMNFNJEH-NSHDSACASA-N 1 2 225.311 2.351 20 0 BEADLO C[NH+]1CC(Oc2ccccc2-c2ccon2)C1 ZINC001234631558 978878337 /nfs/dbraw/zinc/87/83/37/978878337.db2.gz WIPHMOGKERCNAJ-UHFFFAOYSA-N 1 2 230.267 2.034 20 0 BEADLO CC[NH+]1CC(Oc2cccc(Cl)c2OC)C1 ZINC001234637792 978880045 /nfs/dbraw/zinc/88/00/45/978880045.db2.gz IWZKIVWTRQKXDY-UHFFFAOYSA-N 1 2 241.718 2.432 20 0 BEADLO CCc1cccc(OC)c1OC1C[NH+](CC)C1 ZINC001234641690 978881998 /nfs/dbraw/zinc/88/19/98/978881998.db2.gz ZTPIPKIEEXGEQZ-UHFFFAOYSA-N 1 2 235.327 2.341 20 0 BEADLO CCc1ccc(OC)c(OC2C[NH+](CC)C2)c1 ZINC001234645382 978885600 /nfs/dbraw/zinc/88/56/00/978885600.db2.gz RHMNLVYDVKOTAW-UHFFFAOYSA-N 1 2 235.327 2.341 20 0 BEADLO CCc1cc(OC2C[NH+](C(C)(C)C)C2)no1 ZINC001234650610 978888172 /nfs/dbraw/zinc/88/81/72/978888172.db2.gz MQZMMTOXESAECQ-UHFFFAOYSA-N 1 2 224.304 2.099 20 0 BEADLO Cc1cc(F)cc(N2CCOCC3(CC3)C2)[nH+]1 ZINC001339659450 978889634 /nfs/dbraw/zinc/88/96/34/978889634.db2.gz HBJDNEAFTIZHKC-UHFFFAOYSA-N 1 2 236.290 2.146 20 0 BEADLO C[C@@]1(F)CCC[N@H+](Cc2ncc(F)cn2)CC1 ZINC001235004562 978947384 /nfs/dbraw/zinc/94/73/84/978947384.db2.gz KUIBTMHOPARKCV-GFCCVEGCSA-N 1 2 241.285 2.330 20 0 BEADLO C[C@@]1(F)CCC[N@@H+](Cc2ncc(F)cn2)CC1 ZINC001235004562 978947388 /nfs/dbraw/zinc/94/73/88/978947388.db2.gz KUIBTMHOPARKCV-GFCCVEGCSA-N 1 2 241.285 2.330 20 0 BEADLO COc1ccnc([C@H](C)[NH2+]Cc2cnc(C)o2)c1 ZINC001340117810 978970038 /nfs/dbraw/zinc/97/00/38/978970038.db2.gz MFQBXXMJNZWLMN-VIFPVBQESA-N 1 2 247.298 2.237 20 0 BEADLO COc1cnccc1C[N@H+](C)Cc1ccncc1 ZINC001206437783 978987823 /nfs/dbraw/zinc/98/78/23/978987823.db2.gz AAIWCASMOWZBER-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1cnccc1C[N@@H+](C)Cc1ccncc1 ZINC001206437783 978987834 /nfs/dbraw/zinc/98/78/34/978987834.db2.gz AAIWCASMOWZBER-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO CCc1cccc(C[N@@H+]2CCC(=O)C(C)(C)C2)n1 ZINC001235257185 979012151 /nfs/dbraw/zinc/01/21/51/979012151.db2.gz FIVVAXSVIZNBPW-UHFFFAOYSA-N 1 2 246.354 2.445 20 0 BEADLO CCc1cccc(C[N@H+]2CCC(=O)C(C)(C)C2)n1 ZINC001235257185 979012157 /nfs/dbraw/zinc/01/21/57/979012157.db2.gz FIVVAXSVIZNBPW-UHFFFAOYSA-N 1 2 246.354 2.445 20 0 BEADLO CCc1cccc(C[N@@H+]2C[C@H]3CC[C@@H]2CO3)n1 ZINC001235271012 979017594 /nfs/dbraw/zinc/01/75/94/979017594.db2.gz NBILKUMWMBFJGC-ZIAGYGMSSA-N 1 2 232.327 2.007 20 0 BEADLO CCc1cccc(C[N@H+]2C[C@H]3CC[C@@H]2CO3)n1 ZINC001235271012 979017597 /nfs/dbraw/zinc/01/75/97/979017597.db2.gz NBILKUMWMBFJGC-ZIAGYGMSSA-N 1 2 232.327 2.007 20 0 BEADLO C[C@@H]1CCC[N@H+](Cc2ncc(Cl)cn2)C1 ZINC001235408124 979037650 /nfs/dbraw/zinc/03/76/50/979037650.db2.gz YWRWKRVKNAXHCL-SECBINFHSA-N 1 2 225.723 2.362 20 0 BEADLO C[C@@H]1CCC[N@@H+](Cc2ncc(Cl)cn2)C1 ZINC001235408124 979037655 /nfs/dbraw/zinc/03/76/55/979037655.db2.gz YWRWKRVKNAXHCL-SECBINFHSA-N 1 2 225.723 2.362 20 0 BEADLO Cc1ncn(C)c1C[N@@H+]1CC[C@](C)(F)[C@H](F)C1 ZINC001235539558 979078819 /nfs/dbraw/zinc/07/88/19/979078819.db2.gz VSZKOPWDNLGCDZ-NEPJUHHUSA-N 1 2 243.301 2.001 20 0 BEADLO Cc1ncn(C)c1C[N@H+]1CC[C@](C)(F)[C@H](F)C1 ZINC001235539558 979078829 /nfs/dbraw/zinc/07/88/29/979078829.db2.gz VSZKOPWDNLGCDZ-NEPJUHHUSA-N 1 2 243.301 2.001 20 0 BEADLO Cc1ccnc(C[NH+]2CC=CC2)c1Cl ZINC001235578074 979102859 /nfs/dbraw/zinc/10/28/59/979102859.db2.gz ZQJNTXYWOQPQAT-UHFFFAOYSA-N 1 2 208.692 2.415 20 0 BEADLO CC(C)(C)OC(=O)n1cccc1C[NH+]1CCC1 ZINC001235625395 979105502 /nfs/dbraw/zinc/10/55/02/979105502.db2.gz NONZXDAAINJTMN-UHFFFAOYSA-N 1 2 236.315 2.477 20 0 BEADLO Cc1c(C(=O)Nc2c(C)c[nH+]cc2C)ccn1C ZINC001340810467 979116258 /nfs/dbraw/zinc/11/62/58/979116258.db2.gz LRIWKMSGTXDWKZ-UHFFFAOYSA-N 1 2 243.310 2.020 20 0 BEADLO C[C@@H]1CC[N@@H+]1Cc1nc2cc(F)ccc2[nH]1 ZINC001235683909 979118192 /nfs/dbraw/zinc/11/81/92/979118192.db2.gz QMBYWEYJWKWZSX-MRVPVSSYSA-N 1 2 219.263 2.296 20 0 BEADLO C[C@@H]1CC[N@H+]1Cc1nc2cc(F)ccc2[nH]1 ZINC001235683909 979118198 /nfs/dbraw/zinc/11/81/98/979118198.db2.gz QMBYWEYJWKWZSX-MRVPVSSYSA-N 1 2 219.263 2.296 20 0 BEADLO Fc1ccc2[nH]c(C[NH+]3CC=CC3)nc2c1 ZINC001235681888 979120298 /nfs/dbraw/zinc/12/02/98/979120298.db2.gz FUHGXNVCYVGGBO-UHFFFAOYSA-N 1 2 217.247 2.074 20 0 BEADLO C[C@@H]1C[C@@H]1C[N@@H+]1CCNC[C@H]1c1ccccc1F ZINC001235743202 979138335 /nfs/dbraw/zinc/13/83/35/979138335.db2.gz LPUQADKNMCQVOL-JMSVASOKSA-N 1 2 248.345 2.428 20 0 BEADLO C[C@@H]1C[C@@H]1C[N@H+]1CCNC[C@H]1c1ccccc1F ZINC001235743202 979138339 /nfs/dbraw/zinc/13/83/39/979138339.db2.gz LPUQADKNMCQVOL-JMSVASOKSA-N 1 2 248.345 2.428 20 0 BEADLO Sc1ccc(CN2CC3(C2)CCCC[NH2+]3)cc1 ZINC001235922423 979207274 /nfs/dbraw/zinc/20/72/74/979207274.db2.gz VMXBQEHGQVDEJB-UHFFFAOYSA-N 1 2 248.395 2.303 20 0 BEADLO CCC1(CC)C[C@H]1C(=O)NCCc1[nH]cc(C)[nH+]1 ZINC001181886013 979354494 /nfs/dbraw/zinc/35/44/94/979354494.db2.gz GCAIAUYTPRDALM-NSHDSACASA-N 1 2 249.358 2.203 20 0 BEADLO F[C@H]1CC[N@H+](Cc2cc(-c3ccccn3)n[nH]2)C1 ZINC001181892568 979359506 /nfs/dbraw/zinc/35/95/06/979359506.db2.gz MBABWAGFXDTINI-JTQLQIEISA-N 1 2 246.289 2.016 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2cc(-c3ccccn3)n[nH]2)C1 ZINC001181892568 979359519 /nfs/dbraw/zinc/35/95/19/979359519.db2.gz MBABWAGFXDTINI-JTQLQIEISA-N 1 2 246.289 2.016 20 0 BEADLO C[C@@H]1C[C@@H]1C[N@@H+]1CCNC[C@@H]1c1ccc(F)cc1 ZINC001236126935 979402972 /nfs/dbraw/zinc/40/29/72/979402972.db2.gz FNNQDQDNGWVUCT-UXIGCNINSA-N 1 2 248.345 2.428 20 0 BEADLO C[C@@H]1C[C@@H]1C[N@H+]1CCNC[C@@H]1c1ccc(F)cc1 ZINC001236126935 979402982 /nfs/dbraw/zinc/40/29/82/979402982.db2.gz FNNQDQDNGWVUCT-UXIGCNINSA-N 1 2 248.345 2.428 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC[C@H]1CCCC[C@H]1C ZINC001603422085 979453495 /nfs/dbraw/zinc/45/34/95/979453495.db2.gz MNTJYBGFHSCHIW-ZYHUDNBSSA-N 1 2 249.358 2.203 20 0 BEADLO CS[C@H]1CC[C@@H]([N@H+](C)Cc2csnn2)C1 ZINC001341570439 979459327 /nfs/dbraw/zinc/45/93/27/979459327.db2.gz WQYFTEKRSDANBT-ZJUUUORDSA-N 1 2 243.401 2.254 20 0 BEADLO CS[C@H]1CC[C@@H]([N@@H+](C)Cc2csnn2)C1 ZINC001341570439 979459335 /nfs/dbraw/zinc/45/93/35/979459335.db2.gz WQYFTEKRSDANBT-ZJUUUORDSA-N 1 2 243.401 2.254 20 0 BEADLO C[C@@H]1c2cc(-c3ccc(N)[nH+]c3)ccc2NC1=O ZINC001236311532 979517204 /nfs/dbraw/zinc/51/72/04/979517204.db2.gz BMRQJDQZPQNVGU-MRVPVSSYSA-N 1 2 239.278 2.386 20 0 BEADLO Nc1ccc(-c2ccc3nnccc3c2)c[nH+]1 ZINC001236313146 979520753 /nfs/dbraw/zinc/52/07/53/979520753.db2.gz HRNPSKFZDZPODU-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO Cc1cc2c(cc1-c1ccc(N)[nH+]c1)CC(=O)N2 ZINC001236315183 979526923 /nfs/dbraw/zinc/52/69/23/979526923.db2.gz DWEHMFWJLFUTRV-UHFFFAOYSA-N 1 2 239.278 2.134 20 0 BEADLO c1cc2c(cccc2C[N@@H+]2CCC23COC3)o1 ZINC001236740968 979723676 /nfs/dbraw/zinc/72/36/76/979723676.db2.gz RTECEFUWKQQPIS-UHFFFAOYSA-N 1 2 229.279 2.408 20 0 BEADLO c1cc2c(cccc2C[N@H+]2CCC23COC3)o1 ZINC001236740968 979723684 /nfs/dbraw/zinc/72/36/84/979723684.db2.gz RTECEFUWKQQPIS-UHFFFAOYSA-N 1 2 229.279 2.408 20 0 BEADLO COC1C[NH+](Cc2cc(O)cc3ccccc32)C1 ZINC001237064656 979811421 /nfs/dbraw/zinc/81/14/21/979811421.db2.gz IGMCYMZAWGRCNE-UHFFFAOYSA-N 1 2 243.306 2.376 20 0 BEADLO CC1(C)C[NH+](Cc2sc(=O)[nH]c2Cl)C1 ZINC001237160692 979823349 /nfs/dbraw/zinc/82/33/49/979823349.db2.gz JDOPVBAXQNOPBB-UHFFFAOYSA-N 1 2 232.736 2.344 20 0 BEADLO S=C1C=COC1C[N@@H+]1Cc2ccncc2C1 ZINC001237192265 979843044 /nfs/dbraw/zinc/84/30/44/979843044.db2.gz RUAYAGXNUUNRKC-UHFFFAOYSA-N 1 2 232.308 2.479 20 0 BEADLO S=C1C=COC1C[N@H+]1Cc2ccncc2C1 ZINC001237192265 979843049 /nfs/dbraw/zinc/84/30/49/979843049.db2.gz RUAYAGXNUUNRKC-UHFFFAOYSA-N 1 2 232.308 2.479 20 0 BEADLO Cc1cc(F)cc(C)c1C[NH+]1CCOCC1 ZINC001237317038 979862428 /nfs/dbraw/zinc/86/24/28/979862428.db2.gz UQVLSSSYRWEFOG-UHFFFAOYSA-N 1 2 223.291 2.275 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1cc(O)cc(F)c1 ZINC001237285537 979863603 /nfs/dbraw/zinc/86/36/03/979863603.db2.gz UVMLQSXNUPKEOV-KCJUWKMLSA-N 1 2 227.254 2.464 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1cc(O)cc(F)c1 ZINC001237285537 979863607 /nfs/dbraw/zinc/86/36/07/979863607.db2.gz UVMLQSXNUPKEOV-KCJUWKMLSA-N 1 2 227.254 2.464 20 0 BEADLO Cc1cc(F)cc(C)c1C[N@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001237320271 979867102 /nfs/dbraw/zinc/86/71/02/979867102.db2.gz CGFYBNVASDXHBR-BETUJISGSA-N 1 2 235.302 2.416 20 0 BEADLO Cc1cc(F)cc(C)c1C[N@@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001237320271 979867105 /nfs/dbraw/zinc/86/71/05/979867105.db2.gz CGFYBNVASDXHBR-BETUJISGSA-N 1 2 235.302 2.416 20 0 BEADLO O=C(Nc1cc[nH+]c2c1CCC2)C1(C2CC2)CC1 ZINC001183799687 979887361 /nfs/dbraw/zinc/88/73/61/979887361.db2.gz BTQIBBPODMLGFB-UHFFFAOYSA-N 1 2 242.322 2.121 20 0 BEADLO CC[N@H+](Cc1cccc(C)c1OC)C1COC1 ZINC001237512945 979925379 /nfs/dbraw/zinc/92/53/79/979925379.db2.gz JHRLLAFTMRIFRY-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO CC[N@@H+](Cc1cccc(C)c1OC)C1COC1 ZINC001237512945 979925389 /nfs/dbraw/zinc/92/53/89/979925389.db2.gz JHRLLAFTMRIFRY-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO CCn1c[nH+]cc1CN1CCC[C@H]1C(F)(F)F ZINC001237587118 979943798 /nfs/dbraw/zinc/94/37/98/979943798.db2.gz BARABWHTDFPWNO-JTQLQIEISA-N 1 2 247.264 2.430 20 0 BEADLO Cc1coc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)n1 ZINC001237645113 979978688 /nfs/dbraw/zinc/97/86/88/979978688.db2.gz IUTITUZYXRYKEZ-MRVPVSSYSA-N 1 2 234.221 2.367 20 0 BEADLO Cc1coc(C[N@H+]2CC[C@@H](C(F)(F)F)C2)n1 ZINC001237645113 979978690 /nfs/dbraw/zinc/97/86/90/979978690.db2.gz IUTITUZYXRYKEZ-MRVPVSSYSA-N 1 2 234.221 2.367 20 0 BEADLO CCc1cc(N2CCOCC[C@H]2C)nc(CC)[nH+]1 ZINC001343142239 980020263 /nfs/dbraw/zinc/02/02/63/980020263.db2.gz YYVJIHCZLNEZFB-LLVKDONJSA-N 1 2 249.358 2.217 20 0 BEADLO CC[C@@]12C[C@@H](CO1)[N@H+](Cc1occc1OC)C2 ZINC001237877252 980111225 /nfs/dbraw/zinc/11/12/25/980111225.db2.gz TUOQPYDOWLWBSY-GWCFXTLKSA-N 1 2 237.299 2.042 20 0 BEADLO CC[C@@]12C[C@@H](CO1)[N@@H+](Cc1occc1OC)C2 ZINC001237877252 980111233 /nfs/dbraw/zinc/11/12/33/980111233.db2.gz TUOQPYDOWLWBSY-GWCFXTLKSA-N 1 2 237.299 2.042 20 0 BEADLO Cc1ccc(O)cc1C[N@@H+]1CCC(=O)[C@H](C)C1 ZINC001238094899 980144602 /nfs/dbraw/zinc/14/46/02/980144602.db2.gz NVDWSKVVHZVSPW-LLVKDONJSA-N 1 2 233.311 2.112 20 0 BEADLO Cc1ccc(O)cc1C[N@H+]1CCC(=O)[C@H](C)C1 ZINC001238094899 980144605 /nfs/dbraw/zinc/14/46/05/980144605.db2.gz NVDWSKVVHZVSPW-LLVKDONJSA-N 1 2 233.311 2.112 20 0 BEADLO Cc1ccc(O)cc1C[NH+]1CC2(C1)CCCO2 ZINC001238096351 980144840 /nfs/dbraw/zinc/14/48/40/980144840.db2.gz RPLMEYSCDFRHDZ-UHFFFAOYSA-N 1 2 233.311 2.065 20 0 BEADLO COCC[N@H+](C)Cc1cc(Cl)c(O)cc1F ZINC001238144581 980171176 /nfs/dbraw/zinc/17/11/76/980171176.db2.gz WASGALFAHPRKTI-UHFFFAOYSA-N 1 2 247.697 2.263 20 0 BEADLO COCC[N@@H+](C)Cc1cc(Cl)c(O)cc1F ZINC001238144581 980171179 /nfs/dbraw/zinc/17/11/79/980171179.db2.gz WASGALFAHPRKTI-UHFFFAOYSA-N 1 2 247.697 2.263 20 0 BEADLO Nc1ccc(Nc2cccn3cc[nH+]c23)c(F)n1 ZINC001203610794 980184918 /nfs/dbraw/zinc/18/49/18/980184918.db2.gz DNWBPFJHABLNFO-UHFFFAOYSA-N 1 2 243.245 2.194 20 0 BEADLO COc1cc(C)c(C)cc1C[N@@H+]1C[C@@H]2C[C@H]1CO2 ZINC001238761137 980318892 /nfs/dbraw/zinc/31/88/92/980318892.db2.gz AWNVQXQPXNMGQN-KBPBESRZSA-N 1 2 247.338 2.285 20 0 BEADLO COc1cc(C)c(C)cc1C[N@H+]1C[C@@H]2C[C@H]1CO2 ZINC001238761137 980318899 /nfs/dbraw/zinc/31/88/99/980318899.db2.gz AWNVQXQPXNMGQN-KBPBESRZSA-N 1 2 247.338 2.285 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cccn2C2CC2)CCO1 ZINC001344060773 980332899 /nfs/dbraw/zinc/33/28/99/980332899.db2.gz FZACCOJPUVKMSG-LLVKDONJSA-N 1 2 220.316 2.044 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cccn2C2CC2)CCO1 ZINC001344060773 980332908 /nfs/dbraw/zinc/33/29/08/980332908.db2.gz FZACCOJPUVKMSG-LLVKDONJSA-N 1 2 220.316 2.044 20 0 BEADLO Cc1c[nH]cc1C(=O)OCC(C)(C)n1cc[nH+]c1 ZINC001344123765 980351539 /nfs/dbraw/zinc/35/15/39/980351539.db2.gz AYMPPJWMQDVVOD-UHFFFAOYSA-N 1 2 247.298 2.112 20 0 BEADLO Cc1ccc(-c2cccc(CCO)c2)[nH+]c1N ZINC001239024199 980414192 /nfs/dbraw/zinc/41/41/92/980414192.db2.gz BEHMFIQSIDSXAZ-UHFFFAOYSA-N 1 2 228.295 2.174 20 0 BEADLO COc1ccc(Nc2cc(C)c[nH+]c2C)nn1 ZINC001203654299 980475457 /nfs/dbraw/zinc/47/54/57/980475457.db2.gz GXJCCPACYMYXBL-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO Cc1cc(Nc2cc(C)c[nH+]c2C)nn1C ZINC001203654617 980477233 /nfs/dbraw/zinc/47/72/33/980477233.db2.gz NCPIVIAMNWINSB-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO Cc1c(Nc2cc(C)c[nH+]c2C)cnn1C ZINC001203654061 980477461 /nfs/dbraw/zinc/47/74/61/980477461.db2.gz BVHYEYQXFGQGNM-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO CCn1c[nH+]cc1COC(=O)CC1CCC1 ZINC001344972959 980509290 /nfs/dbraw/zinc/50/92/90/980509290.db2.gz XJPPTZXBHLSJSQ-UHFFFAOYSA-N 1 2 222.288 2.136 20 0 BEADLO Cc1cncc(/C=C\c2nnc(C[NH+](C)C)o2)c1 ZINC001345941371 980714262 /nfs/dbraw/zinc/71/42/62/980714262.db2.gz KZYICCRSENGDCC-PLNGDYQASA-N 1 2 244.298 2.005 20 0 BEADLO Cc1cncc(/C=C/c2nnc(C[NH+](C)C)o2)c1 ZINC001345941398 980714282 /nfs/dbraw/zinc/71/42/82/980714282.db2.gz KZYICCRSENGDCC-SNAWJCMRSA-N 1 2 244.298 2.005 20 0 BEADLO COc1cc(CCn2cc[nH+]c2)c(F)cc1F ZINC001250316285 980746955 /nfs/dbraw/zinc/74/69/55/980746955.db2.gz GSRJLOFCPGMCRZ-UHFFFAOYSA-N 1 2 238.237 2.413 20 0 BEADLO Cc1cc(O)ccc1CCn1cc[nH+]c1 ZINC001250315064 980753283 /nfs/dbraw/zinc/75/32/83/980753283.db2.gz CYJSPDNYCWOESG-UHFFFAOYSA-N 1 2 202.257 2.140 20 0 BEADLO c1cn(CCc2cccc3n[nH]cc32)c[nH+]1 ZINC001250315039 980754091 /nfs/dbraw/zinc/75/40/91/980754091.db2.gz BRSRZXHVNWYMPN-UHFFFAOYSA-N 1 2 212.256 2.002 20 0 BEADLO c1cn(CCc2ccc3c(c2)NCC3)c[nH+]1 ZINC001250318523 980758154 /nfs/dbraw/zinc/75/81/54/980758154.db2.gz GMYXGHCPSNAFQE-UHFFFAOYSA-N 1 2 213.284 2.094 20 0 BEADLO O=c1ccc2cc(CCn3cc[nH+]c3)ccc2[nH]1 ZINC001250319959 980761859 /nfs/dbraw/zinc/76/18/59/980761859.db2.gz WBISQXUXXCMSOI-UHFFFAOYSA-N 1 2 239.278 2.380 20 0 BEADLO C/C(=C\C(=O)OCCCc1c[nH+]cn1C)C1CC1 ZINC001346225958 980790523 /nfs/dbraw/zinc/79/05/23/980790523.db2.gz FXQHRQAZRUUXID-DHZHZOJOSA-N 1 2 248.326 2.252 20 0 BEADLO C[C@H](c1ccco1)N(C)C(=O)[C@H](C)n1cc[nH+]c1 ZINC000076902000 980805712 /nfs/dbraw/zinc/80/57/12/980805712.db2.gz GIDMUYBYBMOIQQ-MNOVXSKESA-N 1 2 247.298 2.257 20 0 BEADLO Cn1cc[nH+]c1CCC(=O)NC1(C)CCCCC1 ZINC001346308842 980806680 /nfs/dbraw/zinc/80/66/80/980806680.db2.gz XLMALLCZXWMXMN-UHFFFAOYSA-N 1 2 249.358 2.192 20 0 BEADLO C[C@@H]1CCC[C@H](C)N1C(=O)CCc1[nH+]ccn1C ZINC001346411572 980831334 /nfs/dbraw/zinc/83/13/34/980831334.db2.gz UVCXNTSBWUJRSA-TXEJJXNPSA-N 1 2 249.358 2.142 20 0 BEADLO CCc1cn(Cc2oc(C)nc2C)c[nH+]1 ZINC001190103425 980844899 /nfs/dbraw/zinc/84/48/99/980844899.db2.gz KTUVUEBQZCCKRP-UHFFFAOYSA-N 1 2 205.261 2.099 20 0 BEADLO CCc1cn(Cc2noc(C3CCC3)n2)c[nH+]1 ZINC001190104018 980847601 /nfs/dbraw/zinc/84/76/01/980847601.db2.gz NXAIFKLNDRZVQG-UHFFFAOYSA-N 1 2 232.287 2.144 20 0 BEADLO CCCCc1nc(Cn2c[nH+]c(CC)c2)no1 ZINC001190104944 980848185 /nfs/dbraw/zinc/84/81/85/980848185.db2.gz VTDLOPVQEISDTD-UHFFFAOYSA-N 1 2 234.303 2.219 20 0 BEADLO CC(C)(COC(=O)C1CC2(CC2)C1)n1cc[nH+]c1 ZINC001346610404 980870193 /nfs/dbraw/zinc/87/01/93/980870193.db2.gz ZRBFXRMRBUZLPZ-UHFFFAOYSA-N 1 2 248.326 2.352 20 0 BEADLO CCc1nc(OC)ccc1-c1cc[nH+]c(N)c1 ZINC001239771699 980909024 /nfs/dbraw/zinc/90/90/24/980909024.db2.gz BIVLURTXCJGEEA-UHFFFAOYSA-N 1 2 229.283 2.297 20 0 BEADLO CC(=O)Nc1ccccc1-c1ccc[nH+]c1N ZINC001239779281 980911661 /nfs/dbraw/zinc/91/16/61/980911661.db2.gz KQCKCLWPXDLVGG-UHFFFAOYSA-N 1 2 227.267 2.289 20 0 BEADLO CC[C@H]1CCC[C@@H]1NC(=O)CCc1[nH+]ccn1C ZINC001347015590 980949706 /nfs/dbraw/zinc/94/97/06/980949706.db2.gz ODPYJFATAJPFJJ-RYUDHWBXSA-N 1 2 249.358 2.048 20 0 BEADLO Nc1ccc(-c2ccn3cc[nH+]c3c2)c(F)n1 ZINC001239820424 980962213 /nfs/dbraw/zinc/96/22/13/980962213.db2.gz FSUPABVOWSMUNH-UHFFFAOYSA-N 1 2 228.230 2.118 20 0 BEADLO CC(C)CCCCNC(=O)CCn1cc[nH+]c1 ZINC000078010246 981018082 /nfs/dbraw/zinc/01/80/82/981018082.db2.gz AGYCCTOTWHKYOW-UHFFFAOYSA-N 1 2 237.347 2.216 20 0 BEADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)NC1CC1 ZINC001191476927 981040010 /nfs/dbraw/zinc/04/00/10/981040010.db2.gz WMZJRQNJMCBGLV-UHFFFAOYSA-N 1 2 242.282 2.156 20 0 BEADLO CCC[C@@H]1CCCN1C(=O)CCc1c[nH+]cn1C ZINC001347412301 981074408 /nfs/dbraw/zinc/07/44/08/981074408.db2.gz AWCOBFPDPRWKTK-GFCCVEGCSA-N 1 2 249.358 2.144 20 0 BEADLO COc1cc(F)ccc1-c1ccc[nH+]c1N ZINC001239996022 981088363 /nfs/dbraw/zinc/08/83/63/981088363.db2.gz ASJHDBNBJNECFU-UHFFFAOYSA-N 1 2 218.231 2.479 20 0 BEADLO CCCn1cc(-c2ccn3cc(N)[nH+]c3c2)cn1 ZINC001240131395 981134316 /nfs/dbraw/zinc/13/43/16/981134316.db2.gz RTRXLRIUBOYBCR-UHFFFAOYSA-N 1 2 241.298 2.190 20 0 BEADLO Cc1nn(C)c(C)c1-c1c[nH+]c2c(c1)CCCN2 ZINC001240147608 981148267 /nfs/dbraw/zinc/14/82/67/981148267.db2.gz YCCFZVXJJSPGON-UHFFFAOYSA-N 1 2 242.326 2.100 20 0 BEADLO Cc1ccnnc1-c1ccc2[nH+]ccn2c1 ZINC001240214206 981160689 /nfs/dbraw/zinc/16/06/89/981160689.db2.gz LBVSDPYNOHTWFD-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO c1cn2cc(-c3ncnc4ncccc43)ccc2[nH+]1 ZINC001240214331 981162297 /nfs/dbraw/zinc/16/22/97/981162297.db2.gz OADARTWDHQRKTH-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO Cc1nc2ccc(-c3ccc4[nH+]ccn4c3)cn2n1 ZINC001240217481 981165838 /nfs/dbraw/zinc/16/58/38/981165838.db2.gz FZFFIMLMEGCTEN-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO Nc1nccc(F)c1-c1ccc2[nH+]ccn2c1 ZINC001240217584 981167727 /nfs/dbraw/zinc/16/77/27/981167727.db2.gz QYPQGILIZLRNEJ-UHFFFAOYSA-N 1 2 228.230 2.118 20 0 BEADLO CN(C)c1cncc(-c2ccc3[nH+]ccn3c2)c1 ZINC001240219001 981169083 /nfs/dbraw/zinc/16/90/83/981169083.db2.gz UKJRUVHVEOCCNA-UHFFFAOYSA-N 1 2 238.294 2.462 20 0 BEADLO Cc1nnc2cc(-c3ccc4[nH+]ccn4c3)ccn12 ZINC001240219528 981169439 /nfs/dbraw/zinc/16/94/39/981169439.db2.gz MATIVYSJQKBCGR-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO COC(=[NH2+])c1cccc(-c2cn[nH]c2)c1 ZINC001240242029 981215383 /nfs/dbraw/zinc/21/53/83/981215383.db2.gz YPFVFIOVBZKZCU-UHFFFAOYSA-N 1 2 201.229 2.048 20 0 BEADLO Cc1cc(NC(=O)NC/C=C/C2CC2)c(C)c[nH+]1 ZINC001347973100 981232107 /nfs/dbraw/zinc/23/21/07/981232107.db2.gz QNNAOONEUUBGIX-ONEGZZNKSA-N 1 2 245.326 2.208 20 0 BEADLO COc1cc(-c2cc[nH+]c3c2CCN3)ccn1 ZINC001240259160 981232654 /nfs/dbraw/zinc/23/26/54/981232654.db2.gz VNIXZOFHSPBYNX-UHFFFAOYSA-N 1 2 227.267 2.120 20 0 BEADLO C[C@@H](C(=O)NC(C)(C)C1CCC1)n1cc[nH+]c1 ZINC001348011676 981244106 /nfs/dbraw/zinc/24/41/06/981244106.db2.gz PFOCPCAEJAJVOF-JTQLQIEISA-N 1 2 235.331 2.139 20 0 BEADLO C[C@@H](CC(C)(C)C)NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001348024997 981253946 /nfs/dbraw/zinc/25/39/46/981253946.db2.gz XXDQEKSDWWRUOG-QWRGUYRKSA-N 1 2 237.347 2.385 20 0 BEADLO Cc1nn(C)cc1-c1cc2[nH]ccc2c[nH+]1 ZINC001240299535 981254912 /nfs/dbraw/zinc/25/49/12/981254912.db2.gz PKEHFVWKEHKSTE-UHFFFAOYSA-N 1 2 212.256 2.272 20 0 BEADLO CCc1ccc(N2CCO[C@H](C)[C@H]2C)[nH+]c1 ZINC001348041689 981257634 /nfs/dbraw/zinc/25/76/34/981257634.db2.gz CGGKIOFVJXXAQN-GHMZBOCLSA-N 1 2 220.316 2.258 20 0 BEADLO Nc1cn2ccc(-c3cccc4n[nH]cc43)cc2[nH+]1 ZINC001240313539 981284973 /nfs/dbraw/zinc/28/49/73/981284973.db2.gz HRASQWMSWNYCOY-UHFFFAOYSA-N 1 2 249.277 2.460 20 0 BEADLO c1[nH]nc2cccc(-c3cc[nH+]c4c3CCN4)c12 ZINC001240317208 981290913 /nfs/dbraw/zinc/29/09/13/981290913.db2.gz FJRFWXGXANEDHC-UHFFFAOYSA-N 1 2 236.278 2.236 20 0 BEADLO Nc1cc(-c2cncnc2)[nH+]cc1C(F)(F)F ZINC001240373063 981320354 /nfs/dbraw/zinc/32/03/54/981320354.db2.gz RLDPLXUQQGTTDV-UHFFFAOYSA-N 1 2 240.188 2.140 20 0 BEADLO Cc1[nH]c(CNc2ncncc2Cl)[nH+]c1C ZINC001348311752 981331013 /nfs/dbraw/zinc/33/10/13/981331013.db2.gz MDFRQDIPTPKUSU-UHFFFAOYSA-N 1 2 237.694 2.082 20 0 BEADLO Cc1ccc2[nH+]cc(CNC(=O)OC(C)C)n2c1 ZINC001193498885 981354242 /nfs/dbraw/zinc/35/42/42/981354242.db2.gz LNSIEEQUAMBFDR-UHFFFAOYSA-N 1 2 247.298 2.277 20 0 BEADLO Cc1cn2cc(-c3cnc4ccnn4c3)ccc2[nH+]1 ZINC001240429667 981380478 /nfs/dbraw/zinc/38/04/78/981380478.db2.gz WZLUEAGLEGTMKU-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO Cc1cc(C)nc(-c2ccn3cc[nH+]c3c2)n1 ZINC001240495966 981415110 /nfs/dbraw/zinc/41/51/10/981415110.db2.gz DQTLUYKJRGSTPV-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO COc1nc(C)cc(-c2ccn3cc[nH+]c3c2)n1 ZINC001240496192 981415369 /nfs/dbraw/zinc/41/53/69/981415369.db2.gz HONONGILLCJQEM-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO Cc1ncc(C)c(-c2ccn3cc[nH+]c3c2)n1 ZINC001240497162 981416929 /nfs/dbraw/zinc/41/69/29/981416929.db2.gz ZOHZHSPFDKBUHQ-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO Cn1cnc2ccc(-c3ccn4cc[nH+]c4c3)nc21 ZINC001240496414 981418021 /nfs/dbraw/zinc/41/80/21/981418021.db2.gz NURVZIIXDAEULJ-UHFFFAOYSA-N 1 2 249.277 2.283 20 0 BEADLO CCOc1nccnc1-c1ccn2cc[nH+]c2c1 ZINC001240503159 981430631 /nfs/dbraw/zinc/43/06/31/981430631.db2.gz IFLHEBVFKREAHG-UHFFFAOYSA-N 1 2 240.266 2.190 20 0 BEADLO O=C1Cc2cccc(-c3ccn4cc[nH+]c4c3)c2N1 ZINC001240504014 981431665 /nfs/dbraw/zinc/43/16/65/981431665.db2.gz UHVLUPXFOZLQEN-UHFFFAOYSA-N 1 2 249.273 2.496 20 0 BEADLO c1cn2ccc(-c3cc4c(nn3)CCC4)cc2[nH+]1 ZINC001240503184 981431996 /nfs/dbraw/zinc/43/19/96/981431996.db2.gz JIOFHLNJCHCION-UHFFFAOYSA-N 1 2 236.278 2.280 20 0 BEADLO S=c1ccc(-c2ccn3cc[nH+]c3c2)n[nH]1 ZINC001240503433 981432174 /nfs/dbraw/zinc/43/21/74/981432174.db2.gz APSJWFHJDGYDAD-UHFFFAOYSA-N 1 2 228.280 2.080 20 0 BEADLO Cc1nc2c(-c3ccn4cc[nH+]c4c3)cccn2n1 ZINC001240508841 981432704 /nfs/dbraw/zinc/43/27/04/981432704.db2.gz LWMXHPDYFRNUOV-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO CCOc1cnc(-c2ccn3cc[nH+]c3c2)cn1 ZINC001240511267 981437282 /nfs/dbraw/zinc/43/72/82/981437282.db2.gz CIGYATHLGIRJLC-UHFFFAOYSA-N 1 2 240.266 2.190 20 0 BEADLO CCCOC(=O)NCc1c[nH+]c2c(C)cccn12 ZINC001194130546 981566734 /nfs/dbraw/zinc/56/67/34/981566734.db2.gz UJEFBBNQZCSKRS-UHFFFAOYSA-N 1 2 247.298 2.279 20 0 BEADLO CCn1nccc1-c1c[nH+]c(N(C)C)cc1C ZINC001240700076 981625845 /nfs/dbraw/zinc/62/58/45/981625845.db2.gz YRAVYWXZWBARBB-UHFFFAOYSA-N 1 2 230.315 2.339 20 0 BEADLO CCn1nccc1-c1cccc2[nH+]ccn21 ZINC001240699619 981629520 /nfs/dbraw/zinc/62/95/20/981629520.db2.gz JJJUBWUWOIEENU-UHFFFAOYSA-N 1 2 212.256 2.218 20 0 BEADLO Cc1ncccc1-c1ccn2cc(N)[nH+]c2c1 ZINC001240724466 981765394 /nfs/dbraw/zinc/76/53/94/981765394.db2.gz XNSQXAHROBXUNO-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO CCC(CC)COC(=O)NCCn1cc[nH+]c1 ZINC001194679261 981852163 /nfs/dbraw/zinc/85/21/63/981852163.db2.gz KLMLSOPJRWCTKY-UHFFFAOYSA-N 1 2 239.319 2.046 20 0 BEADLO COCCCc1[nH]c2cc(F)c(OC)cc2[nH+]1 ZINC001250602764 981951120 /nfs/dbraw/zinc/95/11/20/981951120.db2.gz MHVZJONXYLCNGG-UHFFFAOYSA-N 1 2 238.262 2.290 20 0 BEADLO COCCCc1[nH]c2cc(OC)c(F)cc2[nH+]1 ZINC001250602764 981951123 /nfs/dbraw/zinc/95/11/23/981951123.db2.gz MHVZJONXYLCNGG-UHFFFAOYSA-N 1 2 238.262 2.290 20 0 BEADLO C[C@@H](Cc1cccc(F)c1)[N@H+](C)Cc1nnc[nH]1 ZINC001350376738 981955008 /nfs/dbraw/zinc/95/50/08/981955008.db2.gz LPNSPHKFDIZCSN-JTQLQIEISA-N 1 2 248.305 2.007 20 0 BEADLO C[C@@H](Cc1cccc(F)c1)[N@@H+](C)Cc1nnc[nH]1 ZINC001350376738 981955015 /nfs/dbraw/zinc/95/50/15/981955015.db2.gz LPNSPHKFDIZCSN-JTQLQIEISA-N 1 2 248.305 2.007 20 0 BEADLO O=C(N=c1ccc2[nH+]s[nH]c-2c1)OCCF ZINC001194929466 981970607 /nfs/dbraw/zinc/97/06/07/981970607.db2.gz JBRSVUMIYICONP-UHFFFAOYSA-N 1 2 241.247 2.209 20 0 BEADLO O=c1[nH]cccc1-c1ccn2cc[nH+]c2c1 ZINC001241113398 982226964 /nfs/dbraw/zinc/22/69/64/982226964.db2.gz KOCXORLRXBLZBV-UHFFFAOYSA-N 1 2 211.224 2.102 20 0 BEADLO Cc1cc(NC(=O)c2cnoc2C(C)C)cc[nH+]1 ZINC001351199084 982232166 /nfs/dbraw/zinc/23/21/66/982232166.db2.gz WFNPIINTKDKEKT-UHFFFAOYSA-N 1 2 245.282 2.176 20 0 BEADLO Cc1cn2c(cccc2-c2cc[nH+]c(N)c2)n1 ZINC001241162370 982296193 /nfs/dbraw/zinc/29/61/93/982296193.db2.gz HYAFQWPONNGPOD-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO Cc1cnc(F)cc1-c1cc[nH+]c(N)c1 ZINC001241163868 982309372 /nfs/dbraw/zinc/30/93/72/982309372.db2.gz RWLFFUQMEDIHRX-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO Cc1c(F)nccc1-c1cc[nH+]c(N)c1 ZINC001241170699 982315761 /nfs/dbraw/zinc/31/57/61/982315761.db2.gz PPVFGYKEAIPCGK-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO Nc1cc(-c2cc3[nH]cnc3c(F)c2)cc[nH+]1 ZINC001241170438 982317595 /nfs/dbraw/zinc/31/75/95/982317595.db2.gz NLCZQLNUPNAFBS-UHFFFAOYSA-N 1 2 228.230 2.346 20 0 BEADLO Nc1cc(-c2ccnc(OC(F)F)c2)cc[nH+]1 ZINC001241170548 982317643 /nfs/dbraw/zinc/31/76/43/982317643.db2.gz NMBJMBMMBLKCEJ-UHFFFAOYSA-N 1 2 237.209 2.327 20 0 BEADLO CC(C)Cn1cc(-c2cc[nH+]c(N)c2)ccc1=O ZINC001241176257 982326369 /nfs/dbraw/zinc/32/63/69/982326369.db2.gz XIKMJPSYGMIQBF-UHFFFAOYSA-N 1 2 243.310 2.149 20 0 BEADLO COC(=O)[C@H](C(C)C)[N@H+](C)Cc1ccc(C)o1 ZINC001203301617 982331749 /nfs/dbraw/zinc/33/17/49/982331749.db2.gz LXJCAOKRCUVYAT-LBPRGKRZSA-N 1 2 239.315 2.217 20 0 BEADLO COC(=O)[C@H](C(C)C)[N@@H+](C)Cc1ccc(C)o1 ZINC001203301617 982331760 /nfs/dbraw/zinc/33/17/60/982331760.db2.gz LXJCAOKRCUVYAT-LBPRGKRZSA-N 1 2 239.315 2.217 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1ccc(=S)[nH]n1 ZINC001241239768 982386242 /nfs/dbraw/zinc/38/62/42/982386242.db2.gz CTGZLQTVQAEOPR-UHFFFAOYSA-N 1 2 246.339 2.202 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1c(N)nccc1F ZINC001241243989 982386535 /nfs/dbraw/zinc/38/65/35/982386535.db2.gz QRQURUOQXWUOLU-UHFFFAOYSA-N 1 2 246.289 2.239 20 0 BEADLO CCc1ncc(-c2c[nH+]c(N(C)C)cc2C)cn1 ZINC001241243729 982387160 /nfs/dbraw/zinc/38/71/60/982387160.db2.gz ZEXLAQSGCBBPAB-UHFFFAOYSA-N 1 2 242.326 2.475 20 0 BEADLO Cc1ccc(-c2c[nH+]c(N(C)C)cc2C)nc1N ZINC001241235346 982387297 /nfs/dbraw/zinc/38/72/97/982387297.db2.gz NNTSKMXAJJBXTJ-UHFFFAOYSA-N 1 2 242.326 2.409 20 0 BEADLO Cn1c[nH+]c2cc(Nc3cnoc3)ccc21 ZINC001203241738 982520268 /nfs/dbraw/zinc/52/02/68/982520268.db2.gz KCKYGFYISJPTON-UHFFFAOYSA-N 1 2 214.228 2.305 20 0 BEADLO CCCCCNC(=S)Nc1c[nH+]c(C)n1C ZINC001200047121 982535317 /nfs/dbraw/zinc/53/53/17/982535317.db2.gz QCOCXCFCQMCJEC-UHFFFAOYSA-N 1 2 240.376 2.205 20 0 BEADLO c1cn2cc(-c3cnc4n[nH]cc4c3)ccc2[nH+]1 ZINC001241424348 982574906 /nfs/dbraw/zinc/57/49/06/982574906.db2.gz JHWWUBBTZPTHSE-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO CC[N@H+](CC(F)F)CC1(OC)CCC1 ZINC001352826645 982594386 /nfs/dbraw/zinc/59/43/86/982594386.db2.gz VGKGTPFDSXZDAX-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO CC[N@@H+](CC(F)F)CC1(OC)CCC1 ZINC001352826645 982594395 /nfs/dbraw/zinc/59/43/95/982594395.db2.gz VGKGTPFDSXZDAX-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO C[C@@H]1CCC[C@H](C2C[NH+](Cc3cn(C)nn3)C2)C1 ZINC001352878091 982619594 /nfs/dbraw/zinc/61/95/94/982619594.db2.gz PNXKOWDZLZXALV-NEPJUHHUSA-N 1 2 248.374 2.073 20 0 BEADLO Nc1cn2ccc(-c3ccc(N)cc3)cc2[nH+]1 ZINC001241541699 982731794 /nfs/dbraw/zinc/73/17/94/982731794.db2.gz DYOXXUNMWMQDRA-UHFFFAOYSA-N 1 2 224.267 2.166 20 0 BEADLO Cc1c[nH+]ccc1NC(=S)NC1CCCC1 ZINC001198510204 982747881 /nfs/dbraw/zinc/74/78/81/982747881.db2.gz KTHXOCNJWHSKAS-UHFFFAOYSA-N 1 2 235.356 2.041 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cccc2nn(C)cc21 ZINC001241582319 982828582 /nfs/dbraw/zinc/82/85/82/982828582.db2.gz ZSNYVSRETXWFBT-DXNUHORPSA-N 1 2 213.284 2.449 20 0 BEADLO CSc1ccc(-c2c[nH+]cn2C)cn1 ZINC001241634312 982871871 /nfs/dbraw/zinc/87/18/71/982871871.db2.gz XNCQWKPJCZRLCC-UHFFFAOYSA-N 1 2 205.286 2.204 20 0 BEADLO COC(=[NH2+])c1cccc(-c2cnc(N)nc2C)c1 ZINC001241646265 982887792 /nfs/dbraw/zinc/88/77/92/982887792.db2.gz DDIMXEYRSAPBSM-UHFFFAOYSA-N 1 2 242.282 2.006 20 0 BEADLO CCOc1ccc(-c2ccc[nH+]c2N)cn1 ZINC001241703898 982964011 /nfs/dbraw/zinc/96/40/11/982964011.db2.gz GLUUSOKMGWYWSY-UHFFFAOYSA-N 1 2 215.256 2.125 20 0 BEADLO Nc1n[nH]c2ccc(-c3ccc4[nH+]ccn4c3)cc12 ZINC001241722733 983007037 /nfs/dbraw/zinc/00/70/37/983007037.db2.gz NTJZOFXLSSBPJY-UHFFFAOYSA-N 1 2 249.277 2.460 20 0 BEADLO Nc1n[nH]c2ccc(-c3cccc4[nH+]ccn43)cc12 ZINC001241723412 983007921 /nfs/dbraw/zinc/00/79/21/983007921.db2.gz VIGNOCABAVKYHZ-UHFFFAOYSA-N 1 2 249.277 2.460 20 0 BEADLO COc1cc(C)c(/C(C)=C/C=C/[NH3+])cn1 ZINC001241761376 983035611 /nfs/dbraw/zinc/03/56/11/983035611.db2.gz MYBDKTXIJPRIBG-REZHQCRGSA-N 1 2 204.273 2.274 20 0 BEADLO c1cn(Cc2ccc(-c3cscn3)nc2)c[nH+]1 ZINC001241889094 983104676 /nfs/dbraw/zinc/10/46/76/983104676.db2.gz QKRIXQYWJBHLEM-UHFFFAOYSA-N 1 2 242.307 2.450 20 0 BEADLO Nc1ccc(Nc2ccc3nccnc3c2)c[nH+]1 ZINC001201284658 983156996 /nfs/dbraw/zinc/15/69/96/983156996.db2.gz VEFXTFSLOPUHEU-UHFFFAOYSA-N 1 2 237.266 2.351 20 0 BEADLO Cn1ncc2ccc(Nc3ccc(N)[nH+]c3)cc21 ZINC001201284072 983157440 /nfs/dbraw/zinc/15/74/40/983157440.db2.gz IIRNDLYAVRPOAO-UHFFFAOYSA-N 1 2 239.282 2.294 20 0 BEADLO COc1cc(Nc2ccc(N)[nH+]c2)c(C)cn1 ZINC001201279920 983157794 /nfs/dbraw/zinc/15/77/94/983157794.db2.gz WDKSXUHUQJWYAF-UHFFFAOYSA-N 1 2 230.271 2.119 20 0 BEADLO Cc1cccc(N)c1Nc1ccc(N)[nH+]c1 ZINC001201285428 983160468 /nfs/dbraw/zinc/16/04/68/983160468.db2.gz HVVKWJKBIFMOCK-UHFFFAOYSA-N 1 2 214.272 2.298 20 0 BEADLO COc1ccc(Nc2ccc(N)[nH+]c2)c(O)c1 ZINC001201286048 983162712 /nfs/dbraw/zinc/16/27/12/983162712.db2.gz VGRGHRDTNUCPFW-UHFFFAOYSA-N 1 2 231.255 2.122 20 0 BEADLO Nc1ccc(Nc2cc(F)c(F)cc2N)c[nH+]1 ZINC001201286966 983163911 /nfs/dbraw/zinc/16/39/11/983163911.db2.gz KURWSKCXKYTDLM-UHFFFAOYSA-N 1 2 236.225 2.268 20 0 BEADLO Cn1cc2c(cccc2Nc2ccc(N)[nH+]c2)n1 ZINC001201287069 983166446 /nfs/dbraw/zinc/16/64/46/983166446.db2.gz RIUVBFLWIFIXGK-UHFFFAOYSA-N 1 2 239.282 2.294 20 0 BEADLO Nc1ccc(Nc2ccc[nH]c2=S)c[nH+]1 ZINC001201276349 983174925 /nfs/dbraw/zinc/17/49/25/983174925.db2.gz UNZPBLPNNTVRAI-UHFFFAOYSA-N 1 2 218.285 2.091 20 0 BEADLO CCOc1cccnc1Nc1ccc(N)[nH+]c1 ZINC001201276335 983176822 /nfs/dbraw/zinc/17/68/22/983176822.db2.gz TYOHLWGLSLLIBG-UHFFFAOYSA-N 1 2 230.271 2.201 20 0 BEADLO CC(=O)c1cccc(Nc2ccc(N)[nH+]c2)n1 ZINC001201278864 983178406 /nfs/dbraw/zinc/17/84/06/983178406.db2.gz IHTTUXWMLPTSFS-UHFFFAOYSA-N 1 2 228.255 2.005 20 0 BEADLO Nc1ccc(Nc2cnc(F)c(F)c2)c[nH+]1 ZINC001201278794 983179123 /nfs/dbraw/zinc/17/91/23/983179123.db2.gz GPKBLCATQWDBAX-UHFFFAOYSA-N 1 2 222.198 2.081 20 0 BEADLO CN(c1ccc(N)[nH+]c1)c1cccc(N)c1 ZINC001201295365 983180742 /nfs/dbraw/zinc/18/07/42/983180742.db2.gz PZZAXABGMJPLMW-UHFFFAOYSA-N 1 2 214.272 2.014 20 0 BEADLO Cn1cnc2c1cccc2Nc1ccc(N)[nH+]c1 ZINC001201295213 983182006 /nfs/dbraw/zinc/18/20/06/983182006.db2.gz MEDGVKIUZOXCEO-UHFFFAOYSA-N 1 2 239.282 2.294 20 0 BEADLO Cc1cc(F)cc(N2CC[C@@H]3OCC[C@@H]3C2)[nH+]1 ZINC001354226521 983207667 /nfs/dbraw/zinc/20/76/67/983207667.db2.gz OFCWBVVABIRFSP-PWSUYJOCSA-N 1 2 236.290 2.144 20 0 BEADLO COC(=O)CCc1cccc(-c2[nH]cc[nH+]2)c1 ZINC001242017796 983219239 /nfs/dbraw/zinc/21/92/39/983219239.db2.gz WXKFTKLYFVYIJP-UHFFFAOYSA-N 1 2 230.267 2.182 20 0 BEADLO O=C1Nc2ccc(-c3[nH]cc[nH+]3)cc2C12CC2 ZINC001242018463 983220268 /nfs/dbraw/zinc/22/02/68/983220268.db2.gz OMLFJINKMGGFDK-UHFFFAOYSA-N 1 2 225.251 2.060 20 0 BEADLO COc1ccc(-c2[nH]cc[nH+]2)cc1NC(C)=O ZINC001242018420 983221355 /nfs/dbraw/zinc/22/13/55/983221355.db2.gz GUNIMYOBDCVDAP-UHFFFAOYSA-N 1 2 231.255 2.044 20 0 BEADLO c1cn(Cc2ccc(-c3ccnnc3)cc2)c[nH+]1 ZINC001242059801 983270137 /nfs/dbraw/zinc/27/01/37/983270137.db2.gz YZZOPGXPDORZPS-UHFFFAOYSA-N 1 2 236.278 2.388 20 0 BEADLO Cc1cn2cc(-c3ccc(=O)[nH]c3)ccc2[nH+]1 ZINC001242063154 983282532 /nfs/dbraw/zinc/28/25/32/983282532.db2.gz HIVHXSBVANSSQV-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO Cc1c(-c2ccc(=O)[nH]c2)ccc2[nH+]ccn21 ZINC001242066089 983291753 /nfs/dbraw/zinc/29/17/53/983291753.db2.gz BVMDGEHRWJHFIH-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO CNc1ccc(-c2ccc(C)c(N)[nH+]2)cn1 ZINC001242067510 983294740 /nfs/dbraw/zinc/29/47/40/983294740.db2.gz DGUZSTIUIHKZRF-UHFFFAOYSA-N 1 2 214.272 2.076 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1nc(C)c(C)nc1C ZINC001242078218 983325145 /nfs/dbraw/zinc/32/51/45/983325145.db2.gz UUDMJUSMKAGFEH-UHFFFAOYSA-N 1 2 228.299 2.354 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1cnc2c(n1)CCCC2 ZINC001242077994 983325245 /nfs/dbraw/zinc/32/52/45/983325245.db2.gz OGYABVJHRQROMV-UHFFFAOYSA-N 1 2 240.310 2.308 20 0 BEADLO CCC(CC)C[N@@H+]1CCC(=O)[C@H](F)C1 ZINC001201531911 983325647 /nfs/dbraw/zinc/32/56/47/983325647.db2.gz XOEMQIVZHLUHTB-SNVBAGLBSA-N 1 2 201.285 2.036 20 0 BEADLO CCC(CC)C[N@H+]1CCC(=O)[C@H](F)C1 ZINC001201531911 983325653 /nfs/dbraw/zinc/32/56/53/983325653.db2.gz XOEMQIVZHLUHTB-SNVBAGLBSA-N 1 2 201.285 2.036 20 0 BEADLO Cc1cn2c(cccc2NC(=S)NC(C)C)[nH+]1 ZINC001200773849 983354572 /nfs/dbraw/zinc/35/45/72/983354572.db2.gz WCOJCTUOBSZCAX-UHFFFAOYSA-N 1 2 248.355 2.338 20 0 BEADLO Cc1cn2cc(NC(=S)NC(C)C)ccc2[nH+]1 ZINC001200776712 983355482 /nfs/dbraw/zinc/35/54/82/983355482.db2.gz PPRUAZCACSCQQN-UHFFFAOYSA-N 1 2 248.355 2.338 20 0 BEADLO CCOc1cc[nH+]cc1Nc1cncc(O)c1 ZINC001201633353 983362220 /nfs/dbraw/zinc/36/22/20/983362220.db2.gz RJMVHUSRWPYFKH-UHFFFAOYSA-N 1 2 231.255 2.325 20 0 BEADLO CC(C)(C)[C@H]1CSCC[N@@H+]1Cc1cnon1 ZINC001354889127 983380499 /nfs/dbraw/zinc/38/04/99/983380499.db2.gz TUVICNMESSOSOP-SNVBAGLBSA-N 1 2 241.360 2.033 20 0 BEADLO CC(C)(C)[C@H]1CSCC[N@H+]1Cc1cnon1 ZINC001354889127 983380511 /nfs/dbraw/zinc/38/05/11/983380511.db2.gz TUVICNMESSOSOP-SNVBAGLBSA-N 1 2 241.360 2.033 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H]1CC12CCC2 ZINC001355036446 983401020 /nfs/dbraw/zinc/40/10/20/983401020.db2.gz SAAOZIFPGOFJFL-LLVKDONJSA-N 1 2 230.311 2.249 20 0 BEADLO CCCC[N@@H+]1CCN(C(=O)OC(C)(C)C)C1 ZINC001201723037 983429472 /nfs/dbraw/zinc/42/94/72/983429472.db2.gz OXLNAZMVOFUSNF-UHFFFAOYSA-N 1 2 228.336 2.297 20 0 BEADLO CCCC[N@H+]1CCN(C(=O)OC(C)(C)C)C1 ZINC001201723037 983429483 /nfs/dbraw/zinc/42/94/83/983429483.db2.gz OXLNAZMVOFUSNF-UHFFFAOYSA-N 1 2 228.336 2.297 20 0 BEADLO COCn1ncc(C)c1C[N@H+](C)Cc1ccoc1 ZINC001355214177 983450654 /nfs/dbraw/zinc/45/06/54/983450654.db2.gz IZQAUODIUFBNDE-UHFFFAOYSA-N 1 2 249.314 2.020 20 0 BEADLO COCn1ncc(C)c1C[N@@H+](C)Cc1ccoc1 ZINC001355214177 983450659 /nfs/dbraw/zinc/45/06/59/983450659.db2.gz IZQAUODIUFBNDE-UHFFFAOYSA-N 1 2 249.314 2.020 20 0 BEADLO F[C@@H]1CCC[N@H+](CC2CC2)CC1(F)F ZINC001201875889 983502223 /nfs/dbraw/zinc/50/22/23/983502223.db2.gz NCLFQZKDMAUBMQ-SECBINFHSA-N 1 2 207.239 2.466 20 0 BEADLO F[C@@H]1CCC[N@@H+](CC2CC2)CC1(F)F ZINC001201875889 983502233 /nfs/dbraw/zinc/50/22/33/983502233.db2.gz NCLFQZKDMAUBMQ-SECBINFHSA-N 1 2 207.239 2.466 20 0 BEADLO CCC1(C(=O)Nc2c(C)cc(C)[nH+]c2C)COC1 ZINC001355891208 983546855 /nfs/dbraw/zinc/54/68/55/983546855.db2.gz HLRGDVBNRYHQPZ-UHFFFAOYSA-N 1 2 248.326 2.372 20 0 BEADLO CNc1cc(-c2cc(F)ccc2CO)cc[nH+]1 ZINC001242342164 983591271 /nfs/dbraw/zinc/59/12/71/983591271.db2.gz PRTJAZSWAZAYSN-UHFFFAOYSA-N 1 2 232.258 2.422 20 0 BEADLO COC(=O)CCC[N@@H+]1Cc2ccc(F)cc2C1 ZINC001202240433 983616049 /nfs/dbraw/zinc/61/60/49/983616049.db2.gz ZKHVLTYCUBQPMV-UHFFFAOYSA-N 1 2 237.274 2.095 20 0 BEADLO COC(=O)CCC[N@H+]1Cc2ccc(F)cc2C1 ZINC001202240433 983616070 /nfs/dbraw/zinc/61/60/70/983616070.db2.gz ZKHVLTYCUBQPMV-UHFFFAOYSA-N 1 2 237.274 2.095 20 0 BEADLO C[C@H]1CC[N@H+](CCC(F)(F)F)CCC1=O ZINC001202306794 983616162 /nfs/dbraw/zinc/61/61/62/983616162.db2.gz BXVWHSBMDSDIJQ-QMMMGPOBSA-N 1 2 223.238 2.240 20 0 BEADLO C[C@H]1CC[N@@H+](CCC(F)(F)F)CCC1=O ZINC001202306794 983616165 /nfs/dbraw/zinc/61/61/65/983616165.db2.gz BXVWHSBMDSDIJQ-QMMMGPOBSA-N 1 2 223.238 2.240 20 0 BEADLO COc1ncc(-c2cc[nH+]c3c2CCN3)cc1C ZINC001242433459 983733920 /nfs/dbraw/zinc/73/39/20/983733920.db2.gz DTPHJBMGNQGMKY-UHFFFAOYSA-N 1 2 241.294 2.429 20 0 BEADLO Cn1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)n1 ZINC001242459176 983773224 /nfs/dbraw/zinc/77/32/24/983773224.db2.gz DQHFWGXAUZFCKR-UHFFFAOYSA-N 1 2 238.294 2.332 20 0 BEADLO Cc1cc(-c2ccn(C)n2)cn2cc[nH+]c12 ZINC001242460124 983777845 /nfs/dbraw/zinc/77/78/45/983777845.db2.gz RFMGFOIVIXBNMS-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO Cc1cc(C)c(-c2ccn(C)n2)c(C)[nH+]1 ZINC001242461493 983785624 /nfs/dbraw/zinc/78/56/24/983785624.db2.gz OCIBQHCUQRTSLJ-UHFFFAOYSA-N 1 2 201.273 2.407 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1cncc(N)c1 ZINC001242499969 983821919 /nfs/dbraw/zinc/82/19/19/983821919.db2.gz GGIWOKIMQGPCOD-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2ncncc2c1 ZINC001242512410 983834565 /nfs/dbraw/zinc/83/45/65/983834565.db2.gz QVMDWWDULXIGPY-UHFFFAOYSA-N 1 2 210.240 2.030 20 0 BEADLO C[C@@H](C(=O)N[C@@H]1C[C@@H]2CCCC[C@H]12)n1cc[nH+]c1 ZINC001153597756 983844237 /nfs/dbraw/zinc/84/42/37/983844237.db2.gz QILUCHDTOBWKHO-ZDEQEGDKSA-N 1 2 247.342 2.139 20 0 BEADLO Cc1cc(-c2cncc(N(C)C)c2)c[nH+]c1N ZINC001242528209 983850707 /nfs/dbraw/zinc/85/07/07/983850707.db2.gz KCIXXJKBQOFZGT-UHFFFAOYSA-N 1 2 228.299 2.100 20 0 BEADLO CN(C)c1cncc(-c2cc[nH+]c3c2CCN3)c1 ZINC001242529630 983852887 /nfs/dbraw/zinc/85/28/87/983852887.db2.gz SRNIKUSMLSCAQR-UHFFFAOYSA-N 1 2 240.310 2.178 20 0 BEADLO COCOc1ccc(-c2c[nH+]cn2C)c(C)c1 ZINC001242536720 983856870 /nfs/dbraw/zinc/85/68/70/983856870.db2.gz CJYOJPNUWGPETJ-UHFFFAOYSA-N 1 2 232.283 2.378 20 0 BEADLO CCC[C@H](O)CNc1ccccc1-n1cc[nH+]c1 ZINC001252772485 983876105 /nfs/dbraw/zinc/87/61/05/983876105.db2.gz ZTUGNUIWQDJPHN-LBPRGKRZSA-N 1 2 245.326 2.445 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CCCC(=O)[C@@H](C)C2)cn1 ZINC001137073228 983904696 /nfs/dbraw/zinc/90/46/96/983904696.db2.gz VGILEPRWSOPZQL-LBPRGKRZSA-N 1 2 249.358 2.265 20 0 BEADLO CC(C)n1cc(C[N@H+]2CCCC(=O)[C@@H](C)C2)cn1 ZINC001137073228 983904706 /nfs/dbraw/zinc/90/47/06/983904706.db2.gz VGILEPRWSOPZQL-LBPRGKRZSA-N 1 2 249.358 2.265 20 0 BEADLO c1cc2c(c(-c3cc[nH+]c4c3CCN4)c1)OCO2 ZINC001242590778 983908263 /nfs/dbraw/zinc/90/82/63/983908263.db2.gz ZILZFRRNOVAVCX-UHFFFAOYSA-N 1 2 240.262 2.088 20 0 BEADLO COc1cc(C)[nH+]cc1-c1cnoc1C ZINC001242602130 983952487 /nfs/dbraw/zinc/95/24/87/983952487.db2.gz AYXVQSMMVIMRJJ-UHFFFAOYSA-N 1 2 204.229 2.362 20 0 BEADLO CNc1cc(-c2ccnc(C(C)=O)c2)cc[nH+]1 ZINC001242611978 983978843 /nfs/dbraw/zinc/97/88/43/983978843.db2.gz IXTCQXAEWYBSOR-UHFFFAOYSA-N 1 2 227.267 2.388 20 0 BEADLO Cc1csc(CN2CCn3c[nH+]cc3C2)c1 ZINC001137158366 984002176 /nfs/dbraw/zinc/00/21/76/984002176.db2.gz OYYSUDSDMWJQIU-UHFFFAOYSA-N 1 2 233.340 2.269 20 0 BEADLO CN(C)C(=O)Nc1ccc(-c2c[nH+]cn2C)cc1 ZINC001242637799 984008381 /nfs/dbraw/zinc/00/83/81/984008381.db2.gz WYVAVRRZWBVZMS-UHFFFAOYSA-N 1 2 244.298 2.181 20 0 BEADLO C=COc1ccc(NC(=O)[C@@H]2CC[N@H+]2CC)cc1 ZINC001570210362 984022878 /nfs/dbraw/zinc/02/28/78/984022878.db2.gz UYSVSBKGCLVFJO-ZDUSSCGKSA-N 1 2 246.310 2.242 20 0 BEADLO C=COc1ccc(NC(=O)[C@@H]2CC[N@@H+]2CC)cc1 ZINC001570210362 984022895 /nfs/dbraw/zinc/02/28/95/984022895.db2.gz UYSVSBKGCLVFJO-ZDUSSCGKSA-N 1 2 246.310 2.242 20 0 BEADLO O=c1cccc(Nc2ccn3cc[nH+]c3c2)[nH]1 ZINC001212790170 984034675 /nfs/dbraw/zinc/03/46/75/984034675.db2.gz WDQDLHQIKRXDTL-UHFFFAOYSA-N 1 2 226.239 2.179 20 0 BEADLO Nc1cc(-c2ccnc(OC3CC3)c2)cc[nH+]1 ZINC001242722592 984075535 /nfs/dbraw/zinc/07/55/35/984075535.db2.gz AFWZACATBYZCMY-UHFFFAOYSA-N 1 2 227.267 2.267 20 0 BEADLO COC1C[NH+](Cc2ccc3cc(C)ccc3n2)C1 ZINC001137209629 984172720 /nfs/dbraw/zinc/17/27/20/984172720.db2.gz MFIPEPLJWABDOL-UHFFFAOYSA-N 1 2 242.322 2.374 20 0 BEADLO Cc1[nH]c2ccc(-n3cccc3N)cc2[nH+]1 ZINC001213072189 984174066 /nfs/dbraw/zinc/17/40/66/984174066.db2.gz HHCVFEDZJMBTPW-UHFFFAOYSA-N 1 2 212.256 2.244 20 0 BEADLO CCCCC[C@H](O)CNc1c[nH+]ccc1OC ZINC001253521976 984192728 /nfs/dbraw/zinc/19/27/28/984192728.db2.gz YKPBZMOTNMNFSQ-NSHDSACASA-N 1 2 238.331 2.443 20 0 BEADLO CCCn1nccc1-c1cc[nH+]c(NC)c1 ZINC001242846971 984197850 /nfs/dbraw/zinc/19/78/50/984197850.db2.gz QRUXHXICKZLLMX-UHFFFAOYSA-N 1 2 216.288 2.397 20 0 BEADLO Cc1cc(C)c(NC(=O)[C@H]2C[C@@H]2F)c(C)[nH+]1 ZINC001434889441 984272745 /nfs/dbraw/zinc/27/27/45/984272745.db2.gz HFPFHHMTSGYGNP-UWVGGRQHSA-N 1 2 222.263 2.303 20 0 BEADLO Cc1cc(C)c(NC(=O)[C@H]2C[C@H]2F)c(C)[nH+]1 ZINC001434889442 984273335 /nfs/dbraw/zinc/27/33/35/984273335.db2.gz HFPFHHMTSGYGNP-VHSXEESVSA-N 1 2 222.263 2.303 20 0 BEADLO COc1ncc(-c2c[nH+]cn2C)cc1Cl ZINC001242931402 984304186 /nfs/dbraw/zinc/30/41/86/984304186.db2.gz KEXFFQJVQQPFAR-UHFFFAOYSA-N 1 2 223.663 2.144 20 0 BEADLO Cc1c(CO)cccc1-c1ccc[nH+]c1N ZINC001243015019 984370917 /nfs/dbraw/zinc/37/09/17/984370917.db2.gz FEUFRTNHPNVXTJ-UHFFFAOYSA-N 1 2 214.268 2.132 20 0 BEADLO Nc1cn2ccc(-c3ccc(F)c(O)c3)cc2[nH+]1 ZINC001243049370 984405247 /nfs/dbraw/zinc/40/52/47/984405247.db2.gz MCNLQZBGKSCGRK-UHFFFAOYSA-N 1 2 243.241 2.428 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC001243066869 984478521 /nfs/dbraw/zinc/47/85/21/984478521.db2.gz CIBPVPMZOQPVBA-UHFFFAOYSA-N 1 2 241.294 2.317 20 0 BEADLO Cn1c[nH+]cc1-c1ccccc1C(C)(C)O ZINC001243067315 984485172 /nfs/dbraw/zinc/48/51/72/984485172.db2.gz UWMHPYDNNMPHLN-UHFFFAOYSA-N 1 2 216.284 2.315 20 0 BEADLO COC(=O)c1cc(-c2c[nH+]cn2C)c(C)cc1C ZINC001243067212 984485289 /nfs/dbraw/zinc/48/52/89/984485289.db2.gz RIWKJRLTSSTAAC-UHFFFAOYSA-N 1 2 244.294 2.491 20 0 BEADLO COC(=O)c1ccc(-c2c[nH+]cn2C)c(C)c1 ZINC001243069147 984488937 /nfs/dbraw/zinc/48/89/37/984488937.db2.gz QBSHEGXOOVLRLV-UHFFFAOYSA-N 1 2 230.267 2.182 20 0 BEADLO COc1cc(C)c(-c2c[nH+]cn2C)c(C)n1 ZINC001243068438 984489776 /nfs/dbraw/zinc/48/97/76/984489776.db2.gz XEQLODGWCUFUCW-UHFFFAOYSA-N 1 2 217.272 2.108 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2nc(N)ccc2c1 ZINC001243071092 984499642 /nfs/dbraw/zinc/49/96/42/984499642.db2.gz LHMBLRWFSRZTJS-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO OCc1cccc(-c2cc[nH+]c3c2CCN3)c1F ZINC001243145447 984605569 /nfs/dbraw/zinc/60/55/69/984605569.db2.gz UXJHNGSYAFGOAB-UHFFFAOYSA-N 1 2 244.269 2.348 20 0 BEADLO CC[NH2+][C@@H](C)C(=O)OCc1ccccc1C ZINC001577814358 984793290 /nfs/dbraw/zinc/79/32/90/984793290.db2.gz XXULQWYJHALOBO-NSHDSACASA-N 1 2 221.300 2.036 20 0 BEADLO CC[NH2+][C@H](C)C(=O)OC[C@H]1CC=CC[C@H]1C ZINC001577814304 984803044 /nfs/dbraw/zinc/80/30/44/984803044.db2.gz VSLVBBAJLSOGOB-IJLUTSLNSA-N 1 2 225.332 2.130 20 0 BEADLO Cc1cc(-c2cc(N)ccc2F)c[nH+]c1N ZINC001243286537 984814576 /nfs/dbraw/zinc/81/45/76/984814576.db2.gz ROYWYQNYNGSGCR-UHFFFAOYSA-N 1 2 217.247 2.361 20 0 BEADLO Nc1cc(-c2ccncc2Cl)cc[nH+]1 ZINC001243384634 984872369 /nfs/dbraw/zinc/87/23/69/984872369.db2.gz KMZPJXGVLQGFSR-UHFFFAOYSA-N 1 2 205.648 2.379 20 0 BEADLO COc1nc(C)ccc1-c1ccc[nH+]c1N ZINC001243473929 985022489 /nfs/dbraw/zinc/02/24/89/985022489.db2.gz PSPVRPLYKYURTN-UHFFFAOYSA-N 1 2 215.256 2.043 20 0 BEADLO CC(C)n1ccc(-c2ccc[nH+]c2N)cc1=O ZINC001243473248 985023953 /nfs/dbraw/zinc/02/39/53/985023953.db2.gz JFFQFVWBFFFJSC-UHFFFAOYSA-N 1 2 229.283 2.073 20 0 BEADLO Nc1noc2cc(-c3ccc[nH+]c3N)ccc12 ZINC001243474515 985028176 /nfs/dbraw/zinc/02/81/76/985028176.db2.gz YIJONYWIHKPUDK-UHFFFAOYSA-N 1 2 226.239 2.054 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2nsnc2c1 ZINC001243474728 985030737 /nfs/dbraw/zinc/03/07/37/985030737.db2.gz PXMHPMMMJKCLKN-UHFFFAOYSA-N 1 2 228.280 2.336 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2ccc(=O)oc2c1 ZINC001243477202 985034486 /nfs/dbraw/zinc/03/44/86/985034486.db2.gz MEGMFYGVMUXPEX-UHFFFAOYSA-N 1 2 238.246 2.437 20 0 BEADLO COc1cnc(C)c(-c2ccc[nH+]c2N)c1 ZINC001243476483 985035294 /nfs/dbraw/zinc/03/52/94/985035294.db2.gz SRAILHDIQGEGIZ-UHFFFAOYSA-N 1 2 215.256 2.043 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2[nH]cnc2c1F ZINC001243477001 985035459 /nfs/dbraw/zinc/03/54/59/985035459.db2.gz GLGVTYCOFAAKOI-UHFFFAOYSA-N 1 2 228.230 2.346 20 0 BEADLO Cc1cc(O)cc(NC(=O)[C@H](C)n2cc[nH+]c2)c1 ZINC001454499983 985038414 /nfs/dbraw/zinc/03/84/14/985038414.db2.gz YIKJUOZPAQPEBJ-JTQLQIEISA-N 1 2 245.282 2.097 20 0 BEADLO Nc1[nH+]cccc1-c1cc(F)c2nccn2c1 ZINC001243476508 985038740 /nfs/dbraw/zinc/03/87/40/985038740.db2.gz DSKQVJUYOXGQSS-UHFFFAOYSA-N 1 2 228.230 2.118 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@H]2CCC[C@@H](C)C2)c[nH+]1 ZINC001456143517 985114699 /nfs/dbraw/zinc/11/46/99/985114699.db2.gz RXYRLEYPICOYRS-MNOVXSKESA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@H]2CCC[C@@H](C)C2)[nH+]1 ZINC001456143517 985114704 /nfs/dbraw/zinc/11/47/04/985114704.db2.gz RXYRLEYPICOYRS-MNOVXSKESA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H]2CCC[C@H](C)C2)c[nH+]1 ZINC001456143529 985118343 /nfs/dbraw/zinc/11/83/43/985118343.db2.gz RXYRLEYPICOYRS-WDEREUQCSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H]2CCC[C@H](C)C2)[nH+]1 ZINC001456143529 985118364 /nfs/dbraw/zinc/11/83/64/985118364.db2.gz RXYRLEYPICOYRS-WDEREUQCSA-N 1 2 249.358 2.415 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)CC2(C)CC2)[nH+]1 ZINC001456346421 985135571 /nfs/dbraw/zinc/13/55/71/985135571.db2.gz RXEWLVWHGYOCRT-UHFFFAOYSA-N 1 2 235.331 2.340 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)CC2(C)CC2)c[nH+]1 ZINC001456346421 985135576 /nfs/dbraw/zinc/13/55/76/985135576.db2.gz RXEWLVWHGYOCRT-UHFFFAOYSA-N 1 2 235.331 2.340 20 0 BEADLO Cc1cc(-c2cnc(F)cc2C)c[nH+]c1N ZINC001243760319 985293098 /nfs/dbraw/zinc/29/30/98/985293098.db2.gz PWGRLHJHQCRPIT-UHFFFAOYSA-N 1 2 217.247 2.482 20 0 BEADLO Cc1cc(C(=O)Nc2cc[nH+]c(C)c2)cc(C)n1 ZINC001458479650 985318157 /nfs/dbraw/zinc/31/81/57/985318157.db2.gz MKRZAMBSHZSUGJ-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO CCc1cn(CC(=O)NC2CCC(C)CC2)c[nH+]1 ZINC001459259003 985415614 /nfs/dbraw/zinc/41/56/14/985415614.db2.gz GUCLECLERDYHSN-UHFFFAOYSA-N 1 2 249.358 2.140 20 0 BEADLO COc1ccccc1Cc1cn(CC(C)=O)c[nH+]1 ZINC001459302487 985433539 /nfs/dbraw/zinc/43/35/39/985433539.db2.gz PXCKAICQQFLKKE-UHFFFAOYSA-N 1 2 244.294 2.072 20 0 BEADLO C[C@@H]1COC[C@@H]1Nc1ccc(N2CCCC2)[nH+]c1 ZINC000687997223 985448912 /nfs/dbraw/zinc/44/89/12/985448912.db2.gz PAFRQLYYKZJERW-YPMHNXCESA-N 1 2 247.342 2.129 20 0 BEADLO CCCCOC(=O)[C@H](C)[NH2+][C@@H](C)CCSC ZINC001258202140 985613041 /nfs/dbraw/zinc/61/30/41/985613041.db2.gz ISMZVPUKXAKDOB-QWRGUYRKSA-N 1 2 247.404 2.449 20 0 BEADLO c1coc(-c2cnc(C3=C[NH2+]CCC3)cn2)c1 ZINC001243947623 985625464 /nfs/dbraw/zinc/62/54/64/985625464.db2.gz NAGKEIJKMCBOMK-UHFFFAOYSA-N 1 2 227.267 2.461 20 0 BEADLO c1ncc(-c2nccc(C3=C[NH2+]CCC3)n2)s1 ZINC001243948887 985636582 /nfs/dbraw/zinc/63/65/82/985636582.db2.gz FDOKYOSPGOWHCB-UHFFFAOYSA-N 1 2 244.323 2.324 20 0 BEADLO CCCCN(C)c1cncc(C2=C[NH2+]CCC2)n1 ZINC001243949162 985636667 /nfs/dbraw/zinc/63/66/67/985636667.db2.gz SEQUROVIJSLYAB-UHFFFAOYSA-N 1 2 246.358 2.437 20 0 BEADLO CCOc1cccnc1C1=C[NH2+]CCC1 ZINC001243948857 985639389 /nfs/dbraw/zinc/63/93/89/985639389.db2.gz DKOIKRPSASNZQY-UHFFFAOYSA-N 1 2 204.273 2.205 20 0 BEADLO CC(C)Cc1cc(C2=C[NH2+]CCC2)ncn1 ZINC001243949803 985642321 /nfs/dbraw/zinc/64/23/21/985642321.db2.gz YTMIRZMXWASJEL-UHFFFAOYSA-N 1 2 217.316 2.399 20 0 BEADLO Cc1nc(C)c(C2=C[NH2+]CCC2)nc1C ZINC001243950311 985652500 /nfs/dbraw/zinc/65/25/00/985652500.db2.gz XRDVAWUKLCZGMM-UHFFFAOYSA-N 1 2 203.289 2.126 20 0 BEADLO Fc1cc(-c2c[nH+]c3c(c2)CCCN3)cc(F)n1 ZINC001243974771 985703706 /nfs/dbraw/zinc/70/37/06/985703706.db2.gz OUUIEXKZBBORKW-UHFFFAOYSA-N 1 2 247.248 2.423 20 0 BEADLO COc1cc(O)ccc1-c1cc[nH+]c2c1CCN2 ZINC001243986237 985722957 /nfs/dbraw/zinc/72/29/57/985722957.db2.gz QMNCPCZLOZBSQL-UHFFFAOYSA-N 1 2 242.278 2.074 20 0 BEADLO Cn1c[nH+]cc1-c1cc(F)c(F)c(F)c1N ZINC001244166262 985872087 /nfs/dbraw/zinc/87/20/87/985872087.db2.gz JVAXJXKHUUULQE-UHFFFAOYSA-N 1 2 227.189 2.087 20 0 BEADLO Cc1cccc(OCCC[NH2+]Cc2ccn[nH]2)c1 ZINC001461012223 985995352 /nfs/dbraw/zinc/99/53/52/985995352.db2.gz FRMUDMXNAPSFAB-UHFFFAOYSA-N 1 2 245.326 2.277 20 0 BEADLO COC(=O)C1([NH2+][C@H]2C[C@@H](C)CC(C)(C)C2)CC1 ZINC001258685423 986008393 /nfs/dbraw/zinc/00/83/93/986008393.db2.gz MKTUPXCYAXRQGR-MNOVXSKESA-N 1 2 239.359 2.496 20 0 BEADLO Nc1ccc(F)cc1-c1ccc[nH+]c1N ZINC001244397026 986048081 /nfs/dbraw/zinc/04/80/81/986048081.db2.gz ATVWLEATBYVBNY-UHFFFAOYSA-N 1 2 203.220 2.052 20 0 BEADLO Nc1ccc(F)cc1-c1c[nH+]c2c(c1)CCCN2 ZINC001244400854 986060397 /nfs/dbraw/zinc/06/03/97/986060397.db2.gz WLGMADQHPHZABQ-UHFFFAOYSA-N 1 2 243.285 2.471 20 0 BEADLO Cc1c(N)cccc1NCc1ccc[nH+]c1N ZINC001579538418 986074680 /nfs/dbraw/zinc/07/46/80/986074680.db2.gz WJEFYSAWKZSDSR-UHFFFAOYSA-N 1 2 228.299 2.167 20 0 BEADLO CCn1nccc1CNc1cc2cc[nH]c2c[nH+]1 ZINC001461610606 986092175 /nfs/dbraw/zinc/09/21/75/986092175.db2.gz YZUFYCYRLVNDRD-UHFFFAOYSA-N 1 2 241.298 2.391 20 0 BEADLO Nc1[nH+]cccc1-c1cccc(Cl)c1CO ZINC001244577593 986257941 /nfs/dbraw/zinc/25/79/41/986257941.db2.gz SPAMZBXOVGSZEH-UHFFFAOYSA-N 1 2 234.686 2.477 20 0 BEADLO C[C@@H]1CCC[C@H]([N@@H+]2CCC(=O)[C@H](F)C2)C1 ZINC001258826545 986290169 /nfs/dbraw/zinc/29/01/69/986290169.db2.gz KGRIBISIFFDBSB-OUAUKWLOSA-N 1 2 213.296 2.178 20 0 BEADLO C[C@@H]1CCC[C@H]([N@H+]2CCC(=O)[C@H](F)C2)C1 ZINC001258826545 986290183 /nfs/dbraw/zinc/29/01/83/986290183.db2.gz KGRIBISIFFDBSB-OUAUKWLOSA-N 1 2 213.296 2.178 20 0 BEADLO CNC(=O)c1ccc(/C(C)=C/C=C/[NH3+])c(F)c1 ZINC001244664520 986302638 /nfs/dbraw/zinc/30/26/38/986302638.db2.gz SZLTWDJLXTYVEB-DDEWIXKASA-N 1 2 234.274 2.061 20 0 BEADLO CC(C)(C)OC(=O)N1CC[N@H+](CC2CCC2)C1 ZINC001202792546 986309605 /nfs/dbraw/zinc/30/96/05/986309605.db2.gz MIYNPJFCFUVNFF-UHFFFAOYSA-N 1 2 240.347 2.297 20 0 BEADLO CC(C)(C)OC(=O)N1CC[N@@H+](CC2CCC2)C1 ZINC001202792546 986309613 /nfs/dbraw/zinc/30/96/13/986309613.db2.gz MIYNPJFCFUVNFF-UHFFFAOYSA-N 1 2 240.347 2.297 20 0 BEADLO COC(=O)c1cc(/C(C)=C/C=C/[NH3+])ccc1OC ZINC001244746321 986327118 /nfs/dbraw/zinc/32/71/18/986327118.db2.gz VJTUTKZDCXEGBK-DXNUHORPSA-N 1 2 247.294 2.358 20 0 BEADLO Cc1n[nH]c(C)c1C[N@@H+]1CC[C@](C)(F)[C@@H](F)C1 ZINC001139094700 986371029 /nfs/dbraw/zinc/37/10/29/986371029.db2.gz SLLOHSNECYXPMT-RYUDHWBXSA-N 1 2 243.301 2.299 20 0 BEADLO Cc1n[nH]c(C)c1C[N@H+]1CC[C@](C)(F)[C@@H](F)C1 ZINC001139094700 986371036 /nfs/dbraw/zinc/37/10/36/986371036.db2.gz SLLOHSNECYXPMT-RYUDHWBXSA-N 1 2 243.301 2.299 20 0 BEADLO C[C@]1(C[NH2+]Cc2c[nH]nn2)C[C@@H]1c1ccccc1 ZINC001462451646 986391987 /nfs/dbraw/zinc/39/19/87/986391987.db2.gz DQDZFFVHOLYUPT-ZIAGYGMSSA-N 1 2 242.326 2.088 20 0 BEADLO C[C@]1(C[NH2+]Cc2cn[nH]n2)C[C@@H]1c1ccccc1 ZINC001462451646 986391991 /nfs/dbraw/zinc/39/19/91/986391991.db2.gz DQDZFFVHOLYUPT-ZIAGYGMSSA-N 1 2 242.326 2.088 20 0 BEADLO COc1cc(C)[nH+]cc1-c1cnc(OC)c(O)c1 ZINC001244847420 986397174 /nfs/dbraw/zinc/39/71/74/986397174.db2.gz UIQUXLBFUYOJEK-UHFFFAOYSA-N 1 2 246.266 2.175 20 0 BEADLO CCCNC(=S)Nc1ccn2cc[nH+]c2c1 ZINC001244852293 986397255 /nfs/dbraw/zinc/39/72/55/986397255.db2.gz CVHUHSWNOAQOHX-UHFFFAOYSA-N 1 2 234.328 2.031 20 0 BEADLO C[C@H]([NH2+]C1CC(C(=O)OC(C)(C)C)C1)C(F)F ZINC001462538571 986415575 /nfs/dbraw/zinc/41/55/75/986415575.db2.gz YRYMHVPLKHQFNU-UEJVZZJDSA-N 1 2 249.301 2.350 20 0 BEADLO Cc1cc(Cl)ncc1-c1c[nH+]cn1C ZINC001244911952 986457004 /nfs/dbraw/zinc/45/70/04/986457004.db2.gz FAKFVBRMLUFGEU-UHFFFAOYSA-N 1 2 207.664 2.444 20 0 BEADLO CC(C)[C@@H]1C[C@H]1[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC001462687917 986504255 /nfs/dbraw/zinc/50/42/55/986504255.db2.gz MVCVCIHAWHDFNK-OUAUKWLOSA-N 1 2 227.348 2.351 20 0 BEADLO CNc1cc(-c2ccc3c(c2)nnn3C)cc[nH+]1 ZINC001244970690 986544539 /nfs/dbraw/zinc/54/45/39/986544539.db2.gz AIALCSTXJZJPCJ-UHFFFAOYSA-N 1 2 239.282 2.072 20 0 BEADLO CNc1cc(-c2ccc3nnn(C)c3c2)cc[nH+]1 ZINC001244972329 986550256 /nfs/dbraw/zinc/55/02/56/986550256.db2.gz MFOPTXAFCUWLRF-UHFFFAOYSA-N 1 2 239.282 2.072 20 0 BEADLO CNc1cc(-c2ccc3nc(C)nn3c2)cc[nH+]1 ZINC001244973330 986555465 /nfs/dbraw/zinc/55/54/65/986555465.db2.gz MPMNZMHXIRJDDC-UHFFFAOYSA-N 1 2 239.282 2.141 20 0 BEADLO CNc1cc(-c2ccc(F)c(C(N)=O)c2)cc[nH+]1 ZINC001244974124 986555487 /nfs/dbraw/zinc/55/54/87/986555487.db2.gz YAZVQUYVGBDTLO-UHFFFAOYSA-N 1 2 245.257 2.028 20 0 BEADLO O[C@H](C[N@@H+]1CCC[C@H](F)C1)c1ccccc1F ZINC000689439226 986613059 /nfs/dbraw/zinc/61/30/59/986613059.db2.gz XPUSHVBTTUEDIM-GXFFZTMASA-N 1 2 241.281 2.293 20 0 BEADLO O[C@H](C[N@H+]1CCC[C@H](F)C1)c1ccccc1F ZINC000689439226 986613066 /nfs/dbraw/zinc/61/30/66/986613066.db2.gz XPUSHVBTTUEDIM-GXFFZTMASA-N 1 2 241.281 2.293 20 0 BEADLO COc1cnc(F)c(/C(C)=C/C=C/[NH3+])c1 ZINC001245062600 986624328 /nfs/dbraw/zinc/62/43/28/986624328.db2.gz YHIHHBGOZKWXCC-MSLMYCKWSA-N 1 2 208.236 2.105 20 0 BEADLO O[C@H]1CC[N@@H+](C2CCC3(CC3)CC2)CC1(F)F ZINC001254446685 986640476 /nfs/dbraw/zinc/64/04/76/986640476.db2.gz BZXHGKLSQDZKEY-NSHDSACASA-N 1 2 245.313 2.411 20 0 BEADLO O[C@H]1CC[N@H+](C2CCC3(CC3)CC2)CC1(F)F ZINC001254446685 986640483 /nfs/dbraw/zinc/64/04/83/986640483.db2.gz BZXHGKLSQDZKEY-NSHDSACASA-N 1 2 245.313 2.411 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(O)cc1Cl ZINC001245080809 986643316 /nfs/dbraw/zinc/64/33/16/986643316.db2.gz ZONBLWIIZHZWAA-UHFFFAOYSA-N 1 2 208.648 2.446 20 0 BEADLO CCSCC[NH2+][C@@H](CC)c1noc(C)n1 ZINC000379996601 986691167 /nfs/dbraw/zinc/69/11/67/986691167.db2.gz JWDHDPVHFOPBFC-VIFPVBQESA-N 1 2 229.349 2.172 20 0 BEADLO CC(=Cc1ccco1)C(=O)NCc1[nH]c[nH+]c1C ZINC001465604187 986726068 /nfs/dbraw/zinc/72/60/68/986726068.db2.gz FEZIWQNWAFEFJG-RMKNXTFCSA-N 1 2 245.282 2.031 20 0 BEADLO CC(=Cc1ccco1)C(=O)NCc1[nH]c[nH+]c1C ZINC001465604188 986728956 /nfs/dbraw/zinc/72/89/56/986728956.db2.gz FEZIWQNWAFEFJG-TWGQIWQCSA-N 1 2 245.282 2.031 20 0 BEADLO Cc1ccc2[nH+]cc(CN3CC(C)(F)C3)n2c1 ZINC001137304987 986739153 /nfs/dbraw/zinc/73/91/53/986739153.db2.gz UBNIEVVFKKNVMJ-UHFFFAOYSA-N 1 2 233.290 2.187 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1cc2ccccc2[nH]1 ZINC001137313585 986753723 /nfs/dbraw/zinc/75/37/23/986753723.db2.gz HOHQWWSARPPQGZ-UHFFFAOYSA-N 1 2 216.284 2.189 20 0 BEADLO CC(=O)C[N@H+](C)Cc1cc2ccccc2[nH]1 ZINC001137313585 986753736 /nfs/dbraw/zinc/75/37/36/986753736.db2.gz HOHQWWSARPPQGZ-UHFFFAOYSA-N 1 2 216.284 2.189 20 0 BEADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc[nH]n1 ZINC001245311790 986794592 /nfs/dbraw/zinc/79/45/92/986794592.db2.gz CHHCQSJRUVZMBJ-UHFFFAOYSA-N 1 2 240.266 2.271 20 0 BEADLO Cc1cc(C)c(C[N@@H+](C)Cc2ccncn2)[nH]1 ZINC001137333341 986800171 /nfs/dbraw/zinc/80/01/71/986800171.db2.gz BNNQREBYLQODMH-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1cc(C)c(C[N@H+](C)Cc2ccncn2)[nH]1 ZINC001137333341 986800179 /nfs/dbraw/zinc/80/01/79/986800179.db2.gz BNNQREBYLQODMH-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO CCCCCOC(=O)C[NH2+]C1CCSCC1 ZINC001255087747 986813130 /nfs/dbraw/zinc/81/31/30/986813130.db2.gz OGTDVAXXXAKEFR-UHFFFAOYSA-N 1 2 245.388 2.205 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cnn(CC(F)(F)F)c1 ZINC001245389951 986829056 /nfs/dbraw/zinc/82/90/56/986829056.db2.gz NQDRAJXXKFLNJB-BVOBWIRXSA-N 1 2 231.221 2.321 20 0 BEADLO COc1cc(/C(C)=C/C=C/[NH3+])ccc1N ZINC001245501580 986883449 /nfs/dbraw/zinc/88/34/49/986883449.db2.gz GDXUKLHWVRUAJG-DDEWIXKASA-N 1 2 204.273 2.153 20 0 BEADLO FC1(F)CCC[N@@H+]([C@@H]2CCSC2)C1 ZINC001255278805 986884053 /nfs/dbraw/zinc/88/40/53/986884053.db2.gz BTSIXEIAIPIKDC-MRVPVSSYSA-N 1 2 207.289 2.223 20 0 BEADLO FC1(F)CCC[N@H+]([C@@H]2CCSC2)C1 ZINC001255278805 986884058 /nfs/dbraw/zinc/88/40/58/986884058.db2.gz BTSIXEIAIPIKDC-MRVPVSSYSA-N 1 2 207.289 2.223 20 0 BEADLO Cc1cc(-c2cnc(N)c(F)c2)c2[nH+]ccn2c1 ZINC001245519580 986897544 /nfs/dbraw/zinc/89/75/44/986897544.db2.gz MTQYBAGZDSMFAK-UHFFFAOYSA-N 1 2 242.257 2.426 20 0 BEADLO Cc1cc(-c2ccnc(C3CC3)n2)c[nH+]c1N ZINC001245536197 986914824 /nfs/dbraw/zinc/91/48/24/986914824.db2.gz QSGLXPNBMRNEBW-UHFFFAOYSA-N 1 2 226.283 2.307 20 0 BEADLO Fc1nc(Cl)ccc1C[NH+]1CCCC1 ZINC001137468836 986917444 /nfs/dbraw/zinc/91/74/44/986917444.db2.gz JGCOMSGGKDLLDF-UHFFFAOYSA-N 1 2 214.671 2.470 20 0 BEADLO Cc1cc(-c2ccc(N)c(F)c2)c[nH+]c1N ZINC001245537956 986920259 /nfs/dbraw/zinc/92/02/59/986920259.db2.gz IARCECZYSQXOLL-UHFFFAOYSA-N 1 2 217.247 2.361 20 0 BEADLO Cc1cc(-c2cccn(C(C)C)c2=O)c[nH+]c1N ZINC001245540072 986926198 /nfs/dbraw/zinc/92/61/98/986926198.db2.gz MYGZINHHGQLTNW-UHFFFAOYSA-N 1 2 243.310 2.382 20 0 BEADLO Cc1cc(-c2cnc(C)c(F)c2)c[nH+]c1N ZINC001245539527 986928174 /nfs/dbraw/zinc/92/81/74/986928174.db2.gz VOXAEDOINQMJBU-UHFFFAOYSA-N 1 2 217.247 2.482 20 0 BEADLO [NH3+]Cc1cnccc1-c1cccc(S)c1 ZINC001245558193 986947456 /nfs/dbraw/zinc/94/74/56/986947456.db2.gz NCXLXCNSTBLNGH-UHFFFAOYSA-N 1 2 216.309 2.496 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cnc(N)c(Cl)c1 ZINC001245565213 986961261 /nfs/dbraw/zinc/96/12/61/986961261.db2.gz BIQWAIJGOHNMSP-JKEDICHKSA-N 1 2 209.680 2.193 20 0 BEADLO Cc1cc(-c2c(O)cccc2F)c[nH+]c1N ZINC001245656840 987042178 /nfs/dbraw/zinc/04/21/78/987042178.db2.gz VDOWEYRMWFQXAB-UHFFFAOYSA-N 1 2 218.231 2.484 20 0 BEADLO Cc1cc(-c2ccc[nH+]c2N)c(C)cc1CO ZINC001245698440 987067477 /nfs/dbraw/zinc/06/74/77/987067477.db2.gz DCUPHLBRHGEOOP-UHFFFAOYSA-N 1 2 228.295 2.440 20 0 BEADLO COC1C[NH+]([C@H](C)Cc2ccccc2F)C1 ZINC001255841808 987075536 /nfs/dbraw/zinc/07/55/36/987075536.db2.gz KNMWQIMTIOVAHK-SNVBAGLBSA-N 1 2 223.291 2.087 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@H]2C[C@@]2(C)C(C)C)c[nH+]1 ZINC001472020397 987159708 /nfs/dbraw/zinc/15/97/08/987159708.db2.gz IFVVADNEPQUHEP-RISCZKNCSA-N 1 2 249.358 2.271 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@H]2C[C@@]2(C)C(C)C)[nH+]1 ZINC001472020397 987159716 /nfs/dbraw/zinc/15/97/16/987159716.db2.gz IFVVADNEPQUHEP-RISCZKNCSA-N 1 2 249.358 2.271 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H]2C[C@@]2(C)C(C)C)c[nH+]1 ZINC001472020394 987162509 /nfs/dbraw/zinc/16/25/09/987162509.db2.gz IFVVADNEPQUHEP-FZMZJTMJSA-N 1 2 249.358 2.271 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H]2C[C@@]2(C)C(C)C)[nH+]1 ZINC001472020394 987162512 /nfs/dbraw/zinc/16/25/12/987162512.db2.gz IFVVADNEPQUHEP-FZMZJTMJSA-N 1 2 249.358 2.271 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@H]2C[C@]2(C)C(C)C)c[nH+]1 ZINC001472020393 987163855 /nfs/dbraw/zinc/16/38/55/987163855.db2.gz IFVVADNEPQUHEP-BXUZGUMPSA-N 1 2 249.358 2.271 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@H]2C[C@]2(C)C(C)C)[nH+]1 ZINC001472020393 987163874 /nfs/dbraw/zinc/16/38/74/987163874.db2.gz IFVVADNEPQUHEP-BXUZGUMPSA-N 1 2 249.358 2.271 20 0 BEADLO C[C@@H]1C[C@@H]1c1nnc([C@H]2CCCC[N@@H+]2C)o1 ZINC001256657958 987264324 /nfs/dbraw/zinc/26/43/24/987264324.db2.gz NIMNEKRHECVWNP-KXUCPTDWSA-N 1 2 221.304 2.350 20 0 BEADLO C[C@@H]1C[C@@H]1c1nnc([C@H]2CCCC[N@H+]2C)o1 ZINC001256657958 987264337 /nfs/dbraw/zinc/26/43/37/987264337.db2.gz NIMNEKRHECVWNP-KXUCPTDWSA-N 1 2 221.304 2.350 20 0 BEADLO CCc1cn(Cc2cc3n(n2)CCCC3)c[nH+]1 ZINC001473086879 987330367 /nfs/dbraw/zinc/33/03/67/987330367.db2.gz BQMCUWQPSRNGBD-UHFFFAOYSA-N 1 2 230.315 2.027 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+]Cc2cccnc2N)s1 ZINC001473360691 987404935 /nfs/dbraw/zinc/40/49/35/987404935.db2.gz CHQSBFUYYLIQCE-SECBINFHSA-N 1 2 248.355 2.280 20 0 BEADLO F[C@]1(c2ccccc2)CC[N@H+](CC2=NOCC2)C1 ZINC001473423013 987433831 /nfs/dbraw/zinc/43/38/31/987433831.db2.gz HCPXAZJKPJJXPG-CQSZACIVSA-N 1 2 248.301 2.333 20 0 BEADLO F[C@]1(c2ccccc2)CC[N@@H+](CC2=NOCC2)C1 ZINC001473423013 987433837 /nfs/dbraw/zinc/43/38/37/987433837.db2.gz HCPXAZJKPJJXPG-CQSZACIVSA-N 1 2 248.301 2.333 20 0 BEADLO C[C@H](C(=O)N1C[C@H](C)CCC[C@H]1C)n1cc[nH+]c1 ZINC001116120528 987446904 /nfs/dbraw/zinc/44/69/04/987446904.db2.gz FOEXMVYFVKNCBS-JHJVBQTASA-N 1 2 249.358 2.481 20 0 BEADLO C[C@H](C(=O)N[C@H]1CCCC1(C)C)n1cc[nH+]c1 ZINC001116210033 987479270 /nfs/dbraw/zinc/47/92/70/987479270.db2.gz GWOZOVGPDSEPKR-MNOVXSKESA-N 1 2 235.331 2.139 20 0 BEADLO CC[C@@H]1CCC[C@@H]1NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001116252935 987494544 /nfs/dbraw/zinc/49/45/44/987494544.db2.gz QXTHZJKYVPNNCQ-TUAOUCFPSA-N 1 2 235.331 2.139 20 0 BEADLO Cc1ccc(NC(=O)NC2(C)CC2)c(N(C)C)[nH+]1 ZINC001116351587 987529069 /nfs/dbraw/zinc/52/90/69/987529069.db2.gz HTYMDFMVPBXNJH-UHFFFAOYSA-N 1 2 248.330 2.130 20 0 BEADLO COCCC[N@@H+]1CC(F)(F)CC[C@@H]1C ZINC001473880388 987601323 /nfs/dbraw/zinc/60/13/23/987601323.db2.gz YIHQRRMYMLOMCE-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO COCCC[N@H+]1CC(F)(F)CC[C@@H]1C ZINC001473880388 987601337 /nfs/dbraw/zinc/60/13/37/987601337.db2.gz YIHQRRMYMLOMCE-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO C[C@@H]1CC[C@H](N[C@H]2C[NH2+]CC[C@H]2F)C[C@H]1C ZINC001246218272 987616211 /nfs/dbraw/zinc/61/62/11/987616211.db2.gz RUKUIMGTZSITBT-LBELIVKGSA-N 1 2 228.355 2.101 20 0 BEADLO C[C@@H]1CC[C@H]([NH2+][C@H]2CNCC[C@H]2F)C[C@H]1C ZINC001246218272 987616213 /nfs/dbraw/zinc/61/62/13/987616213.db2.gz RUKUIMGTZSITBT-LBELIVKGSA-N 1 2 228.355 2.101 20 0 BEADLO C[C@H]1C[C@@H](N[C@H]2C[NH2+]CC[C@H]2F)CC(C)(C)C1 ZINC001246219213 987618246 /nfs/dbraw/zinc/61/82/46/987618246.db2.gz YMLFYWLJQZYLPW-LOWDOPEQSA-N 1 2 242.382 2.491 20 0 BEADLO C[C@H]1C[C@@H]([NH2+][C@H]2CNCC[C@H]2F)CC(C)(C)C1 ZINC001246219213 987618251 /nfs/dbraw/zinc/61/82/51/987618251.db2.gz YMLFYWLJQZYLPW-LOWDOPEQSA-N 1 2 242.382 2.491 20 0 BEADLO COc1ccnc(CSCCn2cc[nH+]c2)c1 ZINC001116635736 987652861 /nfs/dbraw/zinc/65/28/61/987652861.db2.gz JMZZQXRAACBVRT-UHFFFAOYSA-N 1 2 249.339 2.220 20 0 BEADLO Cc1nc([C@@H](C)[NH2+]CCc2ccccc2F)no1 ZINC001116775002 987704807 /nfs/dbraw/zinc/70/48/07/987704807.db2.gz IRMMLOJXHPPDKL-SECBINFHSA-N 1 2 249.289 2.410 20 0 BEADLO CCOC(=O)C[N@H+](C)CCc1cc(C)cc(C)c1 ZINC001474402645 987710975 /nfs/dbraw/zinc/71/09/75/987710975.db2.gz ZLCHEGUOEUUMBM-UHFFFAOYSA-N 1 2 249.354 2.341 20 0 BEADLO CCOC(=O)C[N@@H+](C)CCc1cc(C)cc(C)c1 ZINC001474402645 987710981 /nfs/dbraw/zinc/71/09/81/987710981.db2.gz ZLCHEGUOEUUMBM-UHFFFAOYSA-N 1 2 249.354 2.341 20 0 BEADLO CCC1C[NH+](Cc2c(Cl)ncn2CC)C1 ZINC001474564848 987762186 /nfs/dbraw/zinc/76/21/86/987762186.db2.gz BXEGPIVPALRDLD-UHFFFAOYSA-N 1 2 227.739 2.398 20 0 BEADLO CCC1(C)C[NH+](Cc2cn(C3CC3)cn2)C1 ZINC001474569532 987764370 /nfs/dbraw/zinc/76/43/70/987764370.db2.gz CVTPKFVTHPOBJC-UHFFFAOYSA-N 1 2 219.332 2.450 20 0 BEADLO C[NH+](C)Cc1nnc([C@H]2[C@@H]3CCCC[C@@H]32)o1 ZINC001117229366 987805336 /nfs/dbraw/zinc/80/53/36/987805336.db2.gz UPNZEMOHFVMSLW-JZYVYDRUSA-N 1 2 221.304 2.035 20 0 BEADLO CCC1(CC)CN(C(=O)[C@@H](C)n2cc[nH+]c2)C1 ZINC001117771593 987900076 /nfs/dbraw/zinc/90/00/76/987900076.db2.gz MBULGCOZNMERFX-LLVKDONJSA-N 1 2 235.331 2.093 20 0 BEADLO CCC(C)(CC)c1nnc(C[NH+](C)C)o1 ZINC001118138431 988046743 /nfs/dbraw/zinc/04/67/43/988046743.db2.gz DOLHFCBKGZLLNW-UHFFFAOYSA-N 1 2 211.309 2.209 20 0 BEADLO Cc1cc(N[C@H](C)[C@@H](C)O)ccc1[NH+](C)C ZINC001118155616 988065246 /nfs/dbraw/zinc/06/52/46/988065246.db2.gz LZZBNVIONGXRRX-GHMZBOCLSA-N 1 2 222.332 2.242 20 0 BEADLO CCOC(=O)[C@H]([NH2+]CCSC(C)C)C1CC1 ZINC001118224604 988128061 /nfs/dbraw/zinc/12/80/61/988128061.db2.gz LAHHSRRMRSJSQI-LLVKDONJSA-N 1 2 245.388 2.059 20 0 BEADLO CC(C)C[C@@H](C)Cc1nnc(C[NH+](C)C)o1 ZINC001322583849 988332831 /nfs/dbraw/zinc/33/28/31/988332831.db2.gz WNEHCRSRANDVKM-SNVBAGLBSA-N 1 2 225.336 2.356 20 0 BEADLO C[NH+](C)Cc1nnc(C2Cc3ccccc3C2)o1 ZINC001118433301 988345210 /nfs/dbraw/zinc/34/52/10/988345210.db2.gz RTIAXRFIRLHTKT-UHFFFAOYSA-N 1 2 243.310 2.014 20 0 BEADLO C[C@H]1CCCC[C@H]1c1nnc(C[NH+](C)C)o1 ZINC001118433571 988347843 /nfs/dbraw/zinc/34/78/43/988347843.db2.gz VWYHBWWKJFTSGA-VHSXEESVSA-N 1 2 223.320 2.425 20 0 BEADLO CC(C)([NH2+]Cc1cnon1)c1ccccc1 ZINC001118494584 988387426 /nfs/dbraw/zinc/38/74/26/988387426.db2.gz IOLIQXAUHXFTQF-UHFFFAOYSA-N 1 2 217.272 2.095 20 0 BEADLO CC(C)C[C@@H]1CCC[N@H+](Cc2nnc[nH]2)C1 ZINC001118496578 988393313 /nfs/dbraw/zinc/39/33/13/988393313.db2.gz ZDXGRWDOWDMOLC-NSHDSACASA-N 1 2 222.336 2.063 20 0 BEADLO CC(C)C[C@@H]1CCC[N@@H+](Cc2nnc[nH]2)C1 ZINC001118496578 988393319 /nfs/dbraw/zinc/39/33/19/988393319.db2.gz ZDXGRWDOWDMOLC-NSHDSACASA-N 1 2 222.336 2.063 20 0 BEADLO C[C@@H](C(=O)N1CCC[C@@H]1C(C)(C)C)n1cc[nH+]c1 ZINC001323203625 988474783 /nfs/dbraw/zinc/47/47/83/988474783.db2.gz CXGWJHCUSSRXJF-NWDGAFQWSA-N 1 2 249.358 2.481 20 0 BEADLO CC[C@@H](CC(C)C)[N@@H+]1CC[C@@H](N)C(F)(F)C1 ZINC001246839540 988542323 /nfs/dbraw/zinc/54/23/23/988542323.db2.gz XXDPANXSGUASSF-WDEREUQCSA-N 1 2 234.334 2.479 20 0 BEADLO CC[C@@H](CC(C)C)[N@H+]1CC[C@@H](N)C(F)(F)C1 ZINC001246839540 988542330 /nfs/dbraw/zinc/54/23/30/988542330.db2.gz XXDPANXSGUASSF-WDEREUQCSA-N 1 2 234.334 2.479 20 0 BEADLO CCC1(CC)CCN(C(=O)[C@@H](C)n2cc[nH+]c2)C1 ZINC001323739424 988598972 /nfs/dbraw/zinc/59/89/72/988598972.db2.gz VLEINTYIFLGGAB-GFCCVEGCSA-N 1 2 249.358 2.483 20 0 BEADLO CCCC[C@H](COC)[NH2+][C@H](C)c1noc(C)n1 ZINC001323767945 988609884 /nfs/dbraw/zinc/60/98/84/988609884.db2.gz LDYOALLUNGQTFG-MWLCHTKSSA-N 1 2 241.335 2.234 20 0 BEADLO Cn1cc(C[NH+]2CC3(C2)CCCC3)c(Cl)n1 ZINC001118809022 988620819 /nfs/dbraw/zinc/62/08/19/988620819.db2.gz AZBZVTJOPBJLFL-UHFFFAOYSA-N 1 2 239.750 2.450 20 0 BEADLO C[C@H]1CC[C@@]2(CCN(c3cc(N)nc[nH+]3)C2)C1 ZINC001548515173 988676430 /nfs/dbraw/zinc/67/64/30/988676430.db2.gz SUABKUWXGXZTRK-GXFFZTMASA-N 1 2 232.331 2.075 20 0 BEADLO C[C@H]1CC[C@]2(CCN(c3cc(N)nc[nH+]3)C2)C1 ZINC001548515165 988678997 /nfs/dbraw/zinc/67/89/97/988678997.db2.gz SUABKUWXGXZTRK-GWCFXTLKSA-N 1 2 232.331 2.075 20 0 BEADLO C[C@H](C(=O)N1C[C@@H]2CCCC[C@@]21C)n1cc[nH+]c1 ZINC001118900458 988679755 /nfs/dbraw/zinc/67/97/55/988679755.db2.gz QQNFLJOVXQHTSP-DYEKYZERSA-N 1 2 247.342 2.235 20 0 BEADLO C[C@@H](C(=O)N1C[C@@H]2CCCC[C@@]21C)n1cc[nH+]c1 ZINC001118900459 988683939 /nfs/dbraw/zinc/68/39/39/988683939.db2.gz QQNFLJOVXQHTSP-OBJOEFQTSA-N 1 2 247.342 2.235 20 0 BEADLO C[NH+](C)Cc1nnc([C@H]2CC23CCCC3)o1 ZINC001324173331 988737480 /nfs/dbraw/zinc/73/74/80/988737480.db2.gz KXGPDWHTALRFAY-SECBINFHSA-N 1 2 221.304 2.179 20 0 BEADLO Cc1cccc2c1[nH+]c(CCCCO)n2C ZINC001247035780 988848463 /nfs/dbraw/zinc/84/84/63/988848463.db2.gz IZMPPVGUMWGOSA-UHFFFAOYSA-N 1 2 218.300 2.197 20 0 BEADLO Cc1cc(C)c(C(=O)OCCCn2cc[nH+]c2)[nH]1 ZINC001324776092 988980345 /nfs/dbraw/zinc/98/03/45/988980345.db2.gz KMXIQSAHICEFPT-UHFFFAOYSA-N 1 2 247.298 2.075 20 0 BEADLO C/C=C(\C)C(=O)OCCc1cn2c([nH+]1)CCCC2 ZINC001515195655 989002159 /nfs/dbraw/zinc/00/21/59/989002159.db2.gz CQDQSTFXRHVOFR-QDEBKDIKSA-N 1 2 248.326 2.271 20 0 BEADLO CC[C@@H](C)CC(=O)OCCCc1c[nH+]cn1C ZINC001515350723 989030965 /nfs/dbraw/zinc/03/09/65/989030965.db2.gz IJLSTKJDGAEGAT-LLVKDONJSA-N 1 2 238.331 2.332 20 0 BEADLO CO[C@@H](C)CN(C)c1cc(F)cc(C)[nH+]1 ZINC001515753058 989112743 /nfs/dbraw/zinc/11/27/43/989112743.db2.gz GZFPUIBBBOUDKY-VIFPVBQESA-N 1 2 212.268 2.000 20 0 BEADLO C[C@@H](C(=O)NCC(C)(C)C1CCC1)n1cc[nH+]c1 ZINC001325292312 989145371 /nfs/dbraw/zinc/14/53/71/989145371.db2.gz MMTNUCAEHOOVAY-NSHDSACASA-N 1 2 249.358 2.387 20 0 BEADLO Fc1cc(C(F)(F)F)cnc1C[NH+]1CCC1 ZINC001248786667 989147022 /nfs/dbraw/zinc/14/70/22/989147022.db2.gz YYVFLQIMGMWRGA-UHFFFAOYSA-N 1 2 234.196 2.445 20 0 BEADLO CC[N@H+](Cc1csc(C)c1)[C@@H](C)C(=O)OC ZINC001248804731 989163138 /nfs/dbraw/zinc/16/31/38/989163138.db2.gz SJMQSAOLFJDGGV-JTQLQIEISA-N 1 2 241.356 2.440 20 0 BEADLO CC[N@@H+](Cc1csc(C)c1)[C@@H](C)C(=O)OC ZINC001248804731 989163150 /nfs/dbraw/zinc/16/31/50/989163150.db2.gz SJMQSAOLFJDGGV-JTQLQIEISA-N 1 2 241.356 2.440 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1ccc(Cl)c(C)n1 ZINC001248874639 989203771 /nfs/dbraw/zinc/20/37/71/989203771.db2.gz OFIIAUBLKXXFOJ-NSHDSACASA-N 1 2 240.734 2.264 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1ccc(Cl)c(C)n1 ZINC001248874639 989203781 /nfs/dbraw/zinc/20/37/81/989203781.db2.gz OFIIAUBLKXXFOJ-NSHDSACASA-N 1 2 240.734 2.264 20 0 BEADLO Cc1nc(C[N@@H+]2CCCOCC2)ccc1Cl ZINC001248869518 989211294 /nfs/dbraw/zinc/21/12/94/989211294.db2.gz WIULAOVACPXMFV-UHFFFAOYSA-N 1 2 240.734 2.266 20 0 BEADLO Cc1nc(C[N@H+]2CCCOCC2)ccc1Cl ZINC001248869518 989211304 /nfs/dbraw/zinc/21/13/04/989211304.db2.gz WIULAOVACPXMFV-UHFFFAOYSA-N 1 2 240.734 2.266 20 0 BEADLO COc1ccc2nc(C[N@H+](C)C3CC3)[nH]c2c1 ZINC001249410683 989273638 /nfs/dbraw/zinc/27/36/38/989273638.db2.gz BURWXKUSQHUAPK-UHFFFAOYSA-N 1 2 231.299 2.166 20 0 BEADLO COc1ccc2nc(C[N@@H+](C)C3CC3)[nH]c2c1 ZINC001249410683 989273642 /nfs/dbraw/zinc/27/36/42/989273642.db2.gz BURWXKUSQHUAPK-UHFFFAOYSA-N 1 2 231.299 2.166 20 0 BEADLO CC[C@H](C)[N@H+](C)Cc1ncc(C(=O)OC)s1 ZINC001249463765 989285924 /nfs/dbraw/zinc/28/59/24/989285924.db2.gz VURQJOHEQGUUMS-QMMMGPOBSA-N 1 2 242.344 2.160 20 0 BEADLO CC[C@H](C)[N@@H+](C)Cc1ncc(C(=O)OC)s1 ZINC001249463765 989285933 /nfs/dbraw/zinc/28/59/33/989285933.db2.gz VURQJOHEQGUUMS-QMMMGPOBSA-N 1 2 242.344 2.160 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)C1CC=CC1 ZINC001518385026 989302816 /nfs/dbraw/zinc/30/28/16/989302816.db2.gz SXGYZJAJUHDDSM-UHFFFAOYSA-N 1 2 216.284 2.025 20 0 BEADLO Cc1cccc(Nc2cnc3c(cnn3C)c2)[nH+]1 ZINC001249660256 989334870 /nfs/dbraw/zinc/33/48/70/989334870.db2.gz ZKLOXDGAQZFEQV-UHFFFAOYSA-N 1 2 239.282 2.415 20 0 BEADLO FCc1ccccc1CN1CCn2c[nH+]cc2C1 ZINC001119865861 989445586 /nfs/dbraw/zinc/44/55/86/989445586.db2.gz RILTYYHGGKQWFR-UHFFFAOYSA-N 1 2 245.301 2.368 20 0 BEADLO CCc1cc(NCC[C@H](C)OC)nc(CC)[nH+]1 ZINC001119965006 989512984 /nfs/dbraw/zinc/51/29/84/989512984.db2.gz WDHRBBMZPXUNNQ-JTQLQIEISA-N 1 2 237.347 2.438 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@]1(C)C=CCC1 ZINC001520443291 989562865 /nfs/dbraw/zinc/56/28/65/989562865.db2.gz ZZUJSJWCFIJSSB-CYBMUJFWSA-N 1 2 234.299 2.303 20 0 BEADLO CCc1cc(NCC(C)(C)OC)nc(CC)[nH+]1 ZINC001120026857 989567027 /nfs/dbraw/zinc/56/70/27/989567027.db2.gz LSDLXBACCGLXNQ-UHFFFAOYSA-N 1 2 237.347 2.438 20 0 BEADLO CC(=CC(=O)Nc1cc[nH+]c(C)c1)c1ccco1 ZINC001520754943 989601095 /nfs/dbraw/zinc/60/10/95/989601095.db2.gz WLUBUEXHLIBSHR-NTMALXAHSA-N 1 2 242.278 2.447 20 0 BEADLO CCCCN(C(=O)CCc1[nH+]ccn1C)C1CC1 ZINC001520773347 989604127 /nfs/dbraw/zinc/60/41/27/989604127.db2.gz OPOJFLUMOQEADK-UHFFFAOYSA-N 1 2 249.358 2.144 20 0 BEADLO C[C@H](C(=O)N[C@]1(C)CC=CCC1)n1cc[nH+]c1 ZINC001326764903 989692833 /nfs/dbraw/zinc/69/28/33/989692833.db2.gz XAJFASBADWDSHA-DGCLKSJQSA-N 1 2 233.315 2.059 20 0 BEADLO Cc1nc([C@H](C)[NH2+][C@@H]2CC[C@@H](C)SC2)no1 ZINC001326853510 989752279 /nfs/dbraw/zinc/75/22/79/989752279.db2.gz OMJOTWXQIMYVPZ-KHQFGBGNSA-N 1 2 241.360 2.313 20 0 BEADLO CC(C)(C)C(=O)N1CCC(Cc2c[nH]c[nH+]2)CC1 ZINC001522425348 989853974 /nfs/dbraw/zinc/85/39/74/989853974.db2.gz DRABGPXMYQYMDL-UHFFFAOYSA-N 1 2 249.358 2.237 20 0 BEADLO CCc1ccc(N(C)[C@@H]2CC[C@H]2OC)[nH+]c1 ZINC001120880968 989943244 /nfs/dbraw/zinc/94/32/44/989943244.db2.gz DVABYOFNVMZZOE-VXGBXAGGSA-N 1 2 220.316 2.258 20 0 BEADLO Cc1cc(F)cc(N2CC[C@H](O)C(C)(C)C2)[nH+]1 ZINC001120926053 989968708 /nfs/dbraw/zinc/96/87/08/989968708.db2.gz OZHUMZZXKAMCJU-NSHDSACASA-N 1 2 238.306 2.126 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)C1(F)CCCC1 ZINC001121230891 990054405 /nfs/dbraw/zinc/05/44/05/990054405.db2.gz FCDYWLWZVZMGGH-UHFFFAOYSA-N 1 2 236.290 2.341 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)C=C1CCC1 ZINC001121230962 990055278 /nfs/dbraw/zinc/05/52/78/990055278.db2.gz HENXIMNHGUSXKQ-UHFFFAOYSA-N 1 2 216.284 2.169 20 0 BEADLO CCCCC(=O)N1CCC(c2c[nH+]cn2C)CC1 ZINC001121309145 990074683 /nfs/dbraw/zinc/07/46/83/990074683.db2.gz WYTWVMQRVBHMLE-UHFFFAOYSA-N 1 2 249.358 2.316 20 0 BEADLO CCCCC(=O)OCCCc1c[nH+]cn1C ZINC001525848187 990077862 /nfs/dbraw/zinc/07/78/62/990077862.db2.gz VPQOPEZBMZZZIU-UHFFFAOYSA-N 1 2 224.304 2.086 20 0 BEADLO Cc1cc(CNC(=O)c2ccncc2)cc(C)[nH+]1 ZINC001525865316 990082960 /nfs/dbraw/zinc/08/29/60/990082960.db2.gz PTEROKMNGMJKRD-UHFFFAOYSA-N 1 2 241.294 2.023 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@H]1CC=CCC1 ZINC001527008796 990198448 /nfs/dbraw/zinc/19/84/48/990198448.db2.gz ZBPRWSLMYLUQEB-NSHDSACASA-N 1 2 234.299 2.303 20 0 BEADLO CC(C)(COC(=O)C1CCCC1)n1cc[nH+]c1 ZINC001123054327 990498772 /nfs/dbraw/zinc/49/87/72/990498772.db2.gz CYRUYECLCYJPMT-UHFFFAOYSA-N 1 2 236.315 2.352 20 0 BEADLO Cc1coc(C(=O)Nc2c(C)c[nH+]cc2C)c1 ZINC001537609195 990508033 /nfs/dbraw/zinc/50/80/33/990508033.db2.gz DTVSPTQZNKKORX-UHFFFAOYSA-N 1 2 230.267 2.274 20 0 BEADLO Cc1cc[nH]c1C(=O)Nc1c(C)c[nH+]cc1C ZINC001537891341 990517265 /nfs/dbraw/zinc/51/72/65/990517265.db2.gz GYVXRVDNGRELPH-UHFFFAOYSA-N 1 2 229.283 2.009 20 0 BEADLO Cc1cc(F)ccc1NC(=O)Cc1c[nH]c[nH+]1 ZINC001538874383 990549611 /nfs/dbraw/zinc/54/96/11/990549611.db2.gz BYBYWHZZEWYXID-UHFFFAOYSA-N 1 2 233.246 2.038 20 0 BEADLO C/C=C(\CC)C(=O)OCc1c[nH+]cn1CC ZINC001123374693 990563924 /nfs/dbraw/zinc/56/39/24/990563924.db2.gz FFSCNNSJQNVMSP-ONNFQVAWSA-N 1 2 222.288 2.303 20 0 BEADLO C/C=C(/CC)C(=O)OCc1c[nH+]cn1CC ZINC001123374695 990565345 /nfs/dbraw/zinc/56/53/45/990565345.db2.gz FFSCNNSJQNVMSP-WMZJFQQLSA-N 1 2 222.288 2.303 20 0 BEADLO CCc1ccccc1NC(=O)[C@H]1CC[N@H+]1CC ZINC001540677990 990636336 /nfs/dbraw/zinc/63/63/36/990636336.db2.gz AFCXFQJPGXKEQN-CYBMUJFWSA-N 1 2 232.327 2.282 20 0 BEADLO CCc1ccccc1NC(=O)[C@H]1CC[N@@H+]1CC ZINC001540677990 990636340 /nfs/dbraw/zinc/63/63/40/990636340.db2.gz AFCXFQJPGXKEQN-CYBMUJFWSA-N 1 2 232.327 2.282 20 0 BEADLO CC(C)CCN(C)C(=O)c1cccc2[nH+]ccn21 ZINC001542161524 990659872 /nfs/dbraw/zinc/65/98/72/990659872.db2.gz GLSOSEBJTLNJNT-UHFFFAOYSA-N 1 2 245.326 2.452 20 0 BEADLO Cn1cc[nH+]c1CCC(=O)N[C@H]1CCCC1(C)C ZINC001123751034 990660008 /nfs/dbraw/zinc/66/00/08/990660008.db2.gz KTJTXICNSXBDKG-NSHDSACASA-N 1 2 249.358 2.048 20 0 BEADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)[C@H]1C[C@H]1F ZINC001542442209 990664682 /nfs/dbraw/zinc/66/46/82/990664682.db2.gz MNDXYFKDZPKTCS-WDEREUQCSA-N 1 2 245.257 2.373 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CCCC[C@@H]1C(C)C ZINC001543544330 990695096 /nfs/dbraw/zinc/69/50/96/990695096.db2.gz AZIHQFNIZCYJJL-CYBMUJFWSA-N 1 2 249.358 2.298 20 0 BEADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)[C@H]1C[C@@H]1F ZINC001125150852 990816762 /nfs/dbraw/zinc/81/67/62/990816762.db2.gz IDMUDTSBWVPCKJ-RYUDHWBXSA-N 1 2 245.257 2.169 20 0 BEADLO C[N@H+](Cc1cc(F)cc(F)c1F)[C@@H]1CCOC1 ZINC001137872434 990865348 /nfs/dbraw/zinc/86/53/48/990865348.db2.gz PORSDWRLVKJPBW-SNVBAGLBSA-N 1 2 245.244 2.325 20 0 BEADLO C[N@@H+](Cc1cc(F)cc(F)c1F)[C@@H]1CCOC1 ZINC001137872434 990865349 /nfs/dbraw/zinc/86/53/49/990865349.db2.gz PORSDWRLVKJPBW-SNVBAGLBSA-N 1 2 245.244 2.325 20 0 BEADLO CO[C@H]1CC[N@@H+](Cc2c(F)ccc(F)c2F)C1 ZINC001137927304 990870452 /nfs/dbraw/zinc/87/04/52/990870452.db2.gz VTOMZUHJCHPIPG-QMMMGPOBSA-N 1 2 245.244 2.325 20 0 BEADLO CO[C@H]1CC[N@H+](Cc2c(F)ccc(F)c2F)C1 ZINC001137927304 990870449 /nfs/dbraw/zinc/87/04/49/990870449.db2.gz VTOMZUHJCHPIPG-QMMMGPOBSA-N 1 2 245.244 2.325 20 0 BEADLO Clc1cc2c(cc1C[NH+]1CC=CC1)OCO2 ZINC001138239526 990900421 /nfs/dbraw/zinc/90/04/21/990900421.db2.gz GSZUHRXFPKZLDK-UHFFFAOYSA-N 1 2 237.686 2.441 20 0 BEADLO Clc1cc2c(cc1C[NH+]1CCC1)OCO2 ZINC001138238352 990901458 /nfs/dbraw/zinc/90/14/58/990901458.db2.gz QMYJDOXPTMBMQA-UHFFFAOYSA-N 1 2 225.675 2.274 20 0 BEADLO Oc1cc(O)cc(C[N@@H+]2CCC[C@H](F)C2)c1 ZINC001138328624 990917612 /nfs/dbraw/zinc/91/76/12/990917612.db2.gz QIBBTYMVXAUQLF-JTQLQIEISA-N 1 2 225.263 2.032 20 0 BEADLO Oc1cc(O)cc(C[N@H+]2CCC[C@H](F)C2)c1 ZINC001138328624 990917616 /nfs/dbraw/zinc/91/76/16/990917616.db2.gz QIBBTYMVXAUQLF-JTQLQIEISA-N 1 2 225.263 2.032 20 0 BEADLO CC[C@@H](C)C(=O)NCCCN(C)c1cccc[nH+]1 ZINC001558087724 990920093 /nfs/dbraw/zinc/92/00/93/990920093.db2.gz HRPAKAPKOKMTIE-GFCCVEGCSA-N 1 2 249.358 2.070 20 0 BEADLO Oc1cccnc1C[N@@H+]1Cc2ccc(F)cc2C1 ZINC001138394702 990936448 /nfs/dbraw/zinc/93/64/48/990936448.db2.gz LBWXIWGCXKCAJD-UHFFFAOYSA-N 1 2 244.269 2.442 20 0 BEADLO Oc1cccnc1C[N@H+]1Cc2ccc(F)cc2C1 ZINC001138394702 990936458 /nfs/dbraw/zinc/93/64/58/990936458.db2.gz LBWXIWGCXKCAJD-UHFFFAOYSA-N 1 2 244.269 2.442 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1[nH]c2ccccc2c1C ZINC001138397499 990939269 /nfs/dbraw/zinc/93/92/69/990939269.db2.gz VDSPPVXAIZKDAC-UHFFFAOYSA-N 1 2 230.311 2.497 20 0 BEADLO CC(=O)C[N@H+](C)Cc1[nH]c2ccccc2c1C ZINC001138397499 990939274 /nfs/dbraw/zinc/93/92/74/990939274.db2.gz VDSPPVXAIZKDAC-UHFFFAOYSA-N 1 2 230.311 2.497 20 0 BEADLO Cc1c2ccccc2[nH]c1C[N@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001138402318 990941608 /nfs/dbraw/zinc/94/16/08/990941608.db2.gz NCEQNWIXRKZKIR-TXEJJXNPSA-N 1 2 242.322 2.449 20 0 BEADLO Cc1c2ccccc2[nH]c1C[N@@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001138402318 990941615 /nfs/dbraw/zinc/94/16/15/990941615.db2.gz NCEQNWIXRKZKIR-TXEJJXNPSA-N 1 2 242.322 2.449 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@]2(C)CC=CCC2)c[nH+]1 ZINC001558497201 990949784 /nfs/dbraw/zinc/94/97/84/990949784.db2.gz FGTIAHFGWCBNHK-AWEZNQCLSA-N 1 2 247.342 2.335 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@]2(C)CC=CCC2)[nH+]1 ZINC001558497201 990949789 /nfs/dbraw/zinc/94/97/89/990949789.db2.gz FGTIAHFGWCBNHK-AWEZNQCLSA-N 1 2 247.342 2.335 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)NCc1c[nH+]c(CC)[nH]1 ZINC001558498149 990952301 /nfs/dbraw/zinc/95/23/01/990952301.db2.gz QUWUACPVGHJWCE-MWLCHTKSSA-N 1 2 235.331 2.025 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)NCc1c[nH]c(CC)[nH+]1 ZINC001558498149 990952307 /nfs/dbraw/zinc/95/23/07/990952307.db2.gz QUWUACPVGHJWCE-MWLCHTKSSA-N 1 2 235.331 2.025 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@H]2CCC[C@@H]2CC)c[nH+]1 ZINC001558497571 990953456 /nfs/dbraw/zinc/95/34/56/990953456.db2.gz UPCQXMBWDORVMU-JQWIXIFHSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@H]2CCC[C@@H]2CC)[nH+]1 ZINC001558497571 990953460 /nfs/dbraw/zinc/95/34/60/990953460.db2.gz UPCQXMBWDORVMU-JQWIXIFHSA-N 1 2 249.358 2.415 20 0 BEADLO Cc1coc(C(=O)NCc2c[nH]c(C(C)C)[nH+]2)c1 ZINC001558560087 990967576 /nfs/dbraw/zinc/96/75/76/990967576.db2.gz GSEQQGUHEYVSSE-UHFFFAOYSA-N 1 2 247.298 2.365 20 0 BEADLO Cc1coc(C(=O)NCc2c[nH+]c(C(C)C)[nH]2)c1 ZINC001558560087 990967585 /nfs/dbraw/zinc/96/75/85/990967585.db2.gz GSEQQGUHEYVSSE-UHFFFAOYSA-N 1 2 247.298 2.365 20 0 BEADLO Cl/C=C\C[NH2+]Cc1cnn(-c2ccccc2)n1 ZINC001308544190 991025456 /nfs/dbraw/zinc/02/54/56/991025456.db2.gz OYALMOSHSYOXHY-DAXSKMNVSA-N 1 2 248.717 2.109 20 0 BEADLO C[C@H]1C[C@H]([N@@H+]2CCC(=O)[C@@H](F)C2)C[C@@H](C)C1 ZINC001258167038 991061007 /nfs/dbraw/zinc/06/10/07/991061007.db2.gz FSMIZVMQLIQCTB-QCNOEVLYSA-N 1 2 227.323 2.424 20 0 BEADLO C[C@H]1C[C@H]([N@H+]2CCC(=O)[C@@H](F)C2)C[C@@H](C)C1 ZINC001258167038 991061014 /nfs/dbraw/zinc/06/10/14/991061014.db2.gz FSMIZVMQLIQCTB-QCNOEVLYSA-N 1 2 227.323 2.424 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CC[C@@H](F)C(F)(F)CC2)n1 ZINC001138935502 991106223 /nfs/dbraw/zinc/10/62/23/991106223.db2.gz SNQDCKLQZZBHFM-SECBINFHSA-N 1 2 247.264 2.287 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CC[C@@H](F)C(F)(F)CC2)n1 ZINC001138935502 991106229 /nfs/dbraw/zinc/10/62/29/991106229.db2.gz SNQDCKLQZZBHFM-SECBINFHSA-N 1 2 247.264 2.287 20 0 BEADLO CCc1cn(Cc2cc(C)ns2)c[nH+]1 ZINC001559466425 991114033 /nfs/dbraw/zinc/11/40/33/991114033.db2.gz TVMARDDUZCNPNK-UHFFFAOYSA-N 1 2 207.302 2.259 20 0 BEADLO CCCn1cc(C[N@@H+]2CCCC(=O)[C@@H](C)C2)cn1 ZINC001139037387 991127796 /nfs/dbraw/zinc/12/77/96/991127796.db2.gz MPWOPYKRWUUGPN-LBPRGKRZSA-N 1 2 249.358 2.094 20 0 BEADLO CCCn1cc(C[N@H+]2CCCC(=O)[C@@H](C)C2)cn1 ZINC001139037387 991127799 /nfs/dbraw/zinc/12/77/99/991127799.db2.gz MPWOPYKRWUUGPN-LBPRGKRZSA-N 1 2 249.358 2.094 20 0 BEADLO CCOC(=O)C1([NH2+][C@H](C)CCSC)CCC1 ZINC001258206872 991128320 /nfs/dbraw/zinc/12/83/20/991128320.db2.gz YRQXRVMTBBFQMG-SNVBAGLBSA-N 1 2 245.388 2.203 20 0 BEADLO CSCC[C@H](C)[NH+]1C[C@@H](F)[C@H](F)C1 ZINC001258216133 991143523 /nfs/dbraw/zinc/14/35/23/991143523.db2.gz UVQMSHRXWYHZNN-DJLDLDEBSA-N 1 2 209.305 2.120 20 0 BEADLO CCc1cnc(C[N@@H+]2CC[C@@H]3[C@H](C2)C3(F)F)o1 ZINC001559665743 991205119 /nfs/dbraw/zinc/20/51/19/991205119.db2.gz QFYPSVPTCYACTN-ZJUUUORDSA-N 1 2 242.269 2.324 20 0 BEADLO CCc1cnc(C[N@H+]2CC[C@@H]3[C@H](C2)C3(F)F)o1 ZINC001559665743 991205127 /nfs/dbraw/zinc/20/51/27/991205127.db2.gz QFYPSVPTCYACTN-ZJUUUORDSA-N 1 2 242.269 2.324 20 0 BEADLO FC1(F)CN(Cc2ccc(-n3cc[nH+]c3)cc2)C1 ZINC001139358378 991231088 /nfs/dbraw/zinc/23/10/88/991231088.db2.gz QMBXVAMUEQCKEK-UHFFFAOYSA-N 1 2 249.264 2.323 20 0 BEADLO CC[C@H]([NH2+]C/C=C(\C)COC)c1noc(C)n1 ZINC001559737958 991232824 /nfs/dbraw/zinc/23/28/24/991232824.db2.gz RPUYLBMHUJQFEP-LAHYYIKRSA-N 1 2 239.319 2.011 20 0 BEADLO CC[C@@H]([NH2+]C/C=C(\C)COC)c1noc(C)n1 ZINC001559737959 991235954 /nfs/dbraw/zinc/23/59/54/991235954.db2.gz RPUYLBMHUJQFEP-OALRPVAKSA-N 1 2 239.319 2.011 20 0 BEADLO Nc1[nH+]cccc1CNc1ccccc1[N+](=O)[O-] ZINC000083372436 991262150 /nfs/dbraw/zinc/26/21/50/991262150.db2.gz JEUBYGWLVIAAOG-UHFFFAOYSA-N 1 2 244.254 2.184 20 0 BEADLO CCOc1ccc(C)cc1C[NH+]1CCOCC1 ZINC001139602194 991286495 /nfs/dbraw/zinc/28/64/95/991286495.db2.gz FGYBMENPSSJQNG-UHFFFAOYSA-N 1 2 235.327 2.226 20 0 BEADLO COC(=O)CC[C@@H](C)[N@@H+]1CCCCC(F)(F)C1 ZINC001258366721 991310800 /nfs/dbraw/zinc/31/08/00/991310800.db2.gz VQPIOBVTHYYNIY-SNVBAGLBSA-N 1 2 249.301 2.449 20 0 BEADLO COC(=O)CC[C@@H](C)[N@H+]1CCCCC(F)(F)C1 ZINC001258366721 991310810 /nfs/dbraw/zinc/31/08/10/991310810.db2.gz VQPIOBVTHYYNIY-SNVBAGLBSA-N 1 2 249.301 2.449 20 0 BEADLO Cc1cnc(C[NH+]2CC3(CCC3)C2)s1 ZINC001139810544 991376081 /nfs/dbraw/zinc/37/60/81/991376081.db2.gz ZYYYAYKWSZOURY-UHFFFAOYSA-N 1 2 208.330 2.437 20 0 BEADLO COCc1ccc(C[NH+]2CC(C)(OC)C2)s1 ZINC001139824282 991380672 /nfs/dbraw/zinc/38/06/72/991380672.db2.gz SJNLBTYHEKLMNR-UHFFFAOYSA-N 1 2 241.356 2.115 20 0 BEADLO COCc1ccc(C[N@@H+]2CCOC[C@@H]2C)s1 ZINC001139824531 991385018 /nfs/dbraw/zinc/38/50/18/991385018.db2.gz ZBYXPOWWISBQLI-JTQLQIEISA-N 1 2 241.356 2.115 20 0 BEADLO COCc1ccc(C[N@H+]2CCOC[C@@H]2C)s1 ZINC001139824531 991385024 /nfs/dbraw/zinc/38/50/24/991385024.db2.gz ZBYXPOWWISBQLI-JTQLQIEISA-N 1 2 241.356 2.115 20 0 BEADLO Cn1c(C[N@@H+]2C[C@@H]3C[C@H]2CO3)cc2ccccc21 ZINC001139871349 991406485 /nfs/dbraw/zinc/40/64/85/991406485.db2.gz ABQCLQDLANQCEX-KBPBESRZSA-N 1 2 242.322 2.151 20 0 BEADLO Cn1c(C[N@H+]2C[C@@H]3C[C@H]2CO3)cc2ccccc21 ZINC001139871349 991406487 /nfs/dbraw/zinc/40/64/87/991406487.db2.gz ABQCLQDLANQCEX-KBPBESRZSA-N 1 2 242.322 2.151 20 0 BEADLO COC(=O)[C@@H]1CC[N@@H+]1Cc1ccccc1C1CC1 ZINC001139880166 991409780 /nfs/dbraw/zinc/40/97/80/991409780.db2.gz BJDSDJQBLGRCMO-AWEZNQCLSA-N 1 2 245.322 2.311 20 0 BEADLO COC(=O)[C@@H]1CC[N@H+]1Cc1ccccc1C1CC1 ZINC001139880166 991409785 /nfs/dbraw/zinc/40/97/85/991409785.db2.gz BJDSDJQBLGRCMO-AWEZNQCLSA-N 1 2 245.322 2.311 20 0 BEADLO CC(=O)OC1C[NH+](Cc2ccccc2C2CC2)C1 ZINC001139882348 991411121 /nfs/dbraw/zinc/41/11/21/991411121.db2.gz GYVUWKYXFDXVBX-UHFFFAOYSA-N 1 2 245.322 2.311 20 0 BEADLO c1coc(C[N@H+](Cc2ccnnc2)C2CC2)c1 ZINC001139985698 991465182 /nfs/dbraw/zinc/46/51/82/991465182.db2.gz WMWRKVWYRZEXOF-UHFFFAOYSA-N 1 2 229.283 2.234 20 0 BEADLO c1coc(C[N@@H+](Cc2ccnnc2)C2CC2)c1 ZINC001139985698 991465190 /nfs/dbraw/zinc/46/51/90/991465190.db2.gz WMWRKVWYRZEXOF-UHFFFAOYSA-N 1 2 229.283 2.234 20 0 BEADLO Cn1cc(Cl)c(C[NH2+]C2(C)CC(F)(F)C2)n1 ZINC001560577350 991506742 /nfs/dbraw/zinc/50/67/42/991506742.db2.gz ADTOZMFRQONMQU-UHFFFAOYSA-N 1 2 249.692 2.351 20 0 BEADLO Oc1ccc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)c(F)c1 ZINC001140125846 991521704 /nfs/dbraw/zinc/52/17/04/991521704.db2.gz KDQHCKZWRDCNJV-XHVZSJERSA-N 1 2 239.265 2.321 20 0 BEADLO Oc1ccc(C[N@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)c(F)c1 ZINC001140125846 991521708 /nfs/dbraw/zinc/52/17/08/991521708.db2.gz KDQHCKZWRDCNJV-XHVZSJERSA-N 1 2 239.265 2.321 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1cccc(F)n1 ZINC001140129885 991533470 /nfs/dbraw/zinc/53/34/70/991533470.db2.gz AIQZNXGZCMXEPM-RKDXNWHRSA-N 1 2 212.243 2.153 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1cccc(F)n1 ZINC001140129885 991533483 /nfs/dbraw/zinc/53/34/83/991533483.db2.gz AIQZNXGZCMXEPM-RKDXNWHRSA-N 1 2 212.243 2.153 20 0 BEADLO Fc1cccc(C[NH+]2CC(c3cccnc3)C2)n1 ZINC001140134309 991540656 /nfs/dbraw/zinc/54/06/56/991540656.db2.gz QJHPRYMIHVHPRN-UHFFFAOYSA-N 1 2 243.285 2.215 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1n[nH]c2ccc(C)cc21 ZINC001140331555 991610343 /nfs/dbraw/zinc/61/03/43/991610343.db2.gz KSNQAWDXLCJVIE-LLVKDONJSA-N 1 2 245.326 2.092 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1n[nH]c2ccc(C)cc21 ZINC001140331555 991610348 /nfs/dbraw/zinc/61/03/48/991610348.db2.gz KSNQAWDXLCJVIE-LLVKDONJSA-N 1 2 245.326 2.092 20 0 BEADLO CCC[C@H](CC(C)C)C(=O)NC1C[NH+](CC)C1 ZINC001318093375 991620786 /nfs/dbraw/zinc/62/07/86/991620786.db2.gz LMXMXQYSMMYFQO-GFCCVEGCSA-N 1 2 240.391 2.269 20 0 BEADLO C[C@H]1CC(=O)CC[N@@H+]1Cc1ccc2n[nH]cc2c1 ZINC001140385051 991631670 /nfs/dbraw/zinc/63/16/70/991631670.db2.gz RHHWKFCYRYCCON-JTQLQIEISA-N 1 2 243.310 2.116 20 0 BEADLO C[C@H]1CC(=O)CC[N@H+]1Cc1ccc2n[nH]cc2c1 ZINC001140385051 991631675 /nfs/dbraw/zinc/63/16/75/991631675.db2.gz RHHWKFCYRYCCON-JTQLQIEISA-N 1 2 243.310 2.116 20 0 BEADLO C[C@@H](C(=O)N[C@@H]1CC[C@@H](C)CC1)n1cc[nH+]c1 ZINC001318333269 991648002 /nfs/dbraw/zinc/64/80/02/991648002.db2.gz CNXIPKPXZDDQOL-SRVKXCTJSA-N 1 2 235.331 2.139 20 0 BEADLO CC1(C)C[NH+](Cc2cn(C3CC3)cn2)C1 ZINC001560971561 991673944 /nfs/dbraw/zinc/67/39/44/991673944.db2.gz IYIVWFWMJNWGKK-UHFFFAOYSA-N 1 2 205.305 2.060 20 0 BEADLO CC[C@H]1CCCN(C(=O)[C@H](C)n2cc[nH+]c2)CC1 ZINC001318898381 991731451 /nfs/dbraw/zinc/73/14/51/991731451.db2.gz VFIXUOJARBUJPQ-STQMWFEESA-N 1 2 249.358 2.483 20 0 BEADLO C[C@@H](C(=O)N1CC(C)(C)C1(C)C)n1cc[nH+]c1 ZINC001318921794 991738907 /nfs/dbraw/zinc/73/89/07/991738907.db2.gz WJUYVDCMVXGYRO-JTQLQIEISA-N 1 2 235.331 2.091 20 0 BEADLO CC[C@@H](C)C[C@@H](CC)[NH2+]C1(C(=O)OC)CC1 ZINC001258779137 991745260 /nfs/dbraw/zinc/74/52/60/991745260.db2.gz UMYAGQWAFXJSAH-GHMZBOCLSA-N 1 2 227.348 2.496 20 0 BEADLO CC[C@H](C)C[C@H](CC)[NH+]1CC(F)(CO)C1 ZINC001258790140 991775596 /nfs/dbraw/zinc/77/55/96/991775596.db2.gz IXIODSFKDSJRDI-QWRGUYRKSA-N 1 2 217.328 2.217 20 0 BEADLO COC(=O)C1([NH2+]C2CCC(C(C)C)CC2)CC1 ZINC001258798236 991792992 /nfs/dbraw/zinc/79/29/92/991792992.db2.gz YWCBSZUCSMLAMA-UHFFFAOYSA-N 1 2 239.359 2.496 20 0 BEADLO CC(=CC(=O)NCc1[nH]c[nH+]c1C)c1ccco1 ZINC001566188686 991829462 /nfs/dbraw/zinc/82/94/62/991829462.db2.gz FFRGRYIQIWNWPV-TWGQIWQCSA-N 1 2 245.282 2.031 20 0 BEADLO O=C(c1cc2c[nH+]ccc2[nH]1)N1CC2(CCC2)C1 ZINC001566351564 991842127 /nfs/dbraw/zinc/84/21/27/991842127.db2.gz VBUJLWJHOOFFTL-UHFFFAOYSA-N 1 2 241.294 2.189 20 0 BEADLO Cc1cc(C)nc(NC(=O)[C@@H](C)n2cc[nH+]c2)c1 ZINC001319361099 991847584 /nfs/dbraw/zinc/84/75/84/991847584.db2.gz XFACYOFOPXXFTM-LLVKDONJSA-N 1 2 244.298 2.095 20 0 BEADLO C[C@H](C(=O)N(C)C[C@H]1CC=CCC1)n1cc[nH+]c1 ZINC001320057482 992091011 /nfs/dbraw/zinc/09/10/11/992091011.db2.gz CABKBNIURMAMIB-OLZOCXBDSA-N 1 2 247.342 2.259 20 0 BEADLO CCC(CC)N(CC)C(=O)[C@H](C)n1cc[nH+]c1 ZINC001261221868 992201888 /nfs/dbraw/zinc/20/18/88/992201888.db2.gz MLVQOJYDOLVKGZ-NSHDSACASA-N 1 2 237.347 2.481 20 0 BEADLO C[C@@H](c1noc([C@H](C)n2cc[nH+]c2)n1)C1CC1 ZINC001320500285 992221579 /nfs/dbraw/zinc/22/15/79/992221579.db2.gz QKOGVGDOJYBFEQ-BDAKNGLRSA-N 1 2 232.287 2.389 20 0 BEADLO C[C@@H](c1noc([C@@H](C)n2cc[nH+]c2)n1)C1CC1 ZINC001320500292 992221900 /nfs/dbraw/zinc/22/19/00/992221900.db2.gz QKOGVGDOJYBFEQ-RKDXNWHRSA-N 1 2 232.287 2.389 20 0 BEADLO CCCC[C@H](C)c1nnc(C[NH+](C)C)o1 ZINC001261432575 992301654 /nfs/dbraw/zinc/30/16/54/992301654.db2.gz UMRQAMLNVQAHMT-VIFPVBQESA-N 1 2 211.309 2.425 20 0 BEADLO C[C@@H](C(=O)N1CC(C2CCCC2)C1)n1cc[nH+]c1 ZINC001321240512 992499398 /nfs/dbraw/zinc/49/93/98/992499398.db2.gz KLGITXQIWYMDTK-NSHDSACASA-N 1 2 247.342 2.093 20 0 BEADLO Cc1c(Cl)cnn1C[NH+]1CCC(F)CC1 ZINC001262051131 992635610 /nfs/dbraw/zinc/63/56/10/992635610.db2.gz GCFFCFQWVWRJCM-UHFFFAOYSA-N 1 2 231.702 2.236 20 0 BEADLO C[C@H](CNC(=O)[C@H](C)n1cc[nH+]c1)C(C)(C)C ZINC001262126368 992692135 /nfs/dbraw/zinc/69/21/35/992692135.db2.gz CYULJRIWOJJNHG-MNOVXSKESA-N 1 2 237.347 2.243 20 0 BEADLO C[NH2+]CC(=O)O[C@H](C)c1ccc2c(c1)CCCC2 ZINC001573895124 992752420 /nfs/dbraw/zinc/75/24/20/992752420.db2.gz BGTURGTZVGNXBG-LLVKDONJSA-N 1 2 247.338 2.389 20 0 BEADLO Cc1ccc(N[C@@H](C)c2cnn(C)n2)c(C)[nH+]1 ZINC001262203182 992800589 /nfs/dbraw/zinc/80/05/89/992800589.db2.gz NSKRBBNIKZYWAS-JTQLQIEISA-N 1 2 231.303 2.000 20 0 BEADLO CCn1cc(CN(C)c2cc(F)cc(C)[nH+]2)cn1 ZINC001262683421 993022936 /nfs/dbraw/zinc/02/29/36/993022936.db2.gz IRZMOUXWCIDESW-UHFFFAOYSA-N 1 2 248.305 2.382 20 0 BEADLO Cc1cc(F)cc(N2CCOC[C@H](C)C2)[nH+]1 ZINC001262688144 993030985 /nfs/dbraw/zinc/03/09/85/993030985.db2.gz ITFXVAYXUWESTA-SECBINFHSA-N 1 2 224.279 2.002 20 0 BEADLO CC(C)=CCC[C@H](C)NC(=O)C[C@@H]([NH3+])C(F)F ZINC001575390018 993035385 /nfs/dbraw/zinc/03/53/85/993035385.db2.gz NUXIHBDPLFCIBD-VHSXEESVSA-N 1 2 248.317 2.220 20 0 BEADLO C[C@H](Nc1cc(CO)cc[nH+]1)C1(C)CC1 ZINC001262710671 993049364 /nfs/dbraw/zinc/04/93/64/993049364.db2.gz YGOBQIUGHLEZMF-VIFPVBQESA-N 1 2 206.289 2.174 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)CSC(C)C ZINC001262805481 993069098 /nfs/dbraw/zinc/06/90/98/993069098.db2.gz SGAKBUINGCQQKL-UHFFFAOYSA-N 1 2 238.356 2.200 20 0 BEADLO C[C@@H]1CCC[C@H](C)N1c1cc(N(C)C)[nH+]cn1 ZINC000585415007 993265947 /nfs/dbraw/zinc/26/59/47/993265947.db2.gz HLJNGTASWBUFSZ-PHIMTYICSA-N 1 2 234.347 2.310 20 0 BEADLO C[C@@H]1CCC[C@H](C)N1c1cc(N(C)C)nc[nH+]1 ZINC000585415007 993265959 /nfs/dbraw/zinc/26/59/59/993265959.db2.gz HLJNGTASWBUFSZ-PHIMTYICSA-N 1 2 234.347 2.310 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N1c1cc(N(C)C)[nH+]cn1 ZINC000585415006 993267058 /nfs/dbraw/zinc/26/70/58/993267058.db2.gz HLJNGTASWBUFSZ-GHMZBOCLSA-N 1 2 234.347 2.310 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N1c1cc(N(C)C)nc[nH+]1 ZINC000585415006 993267069 /nfs/dbraw/zinc/26/70/69/993267069.db2.gz HLJNGTASWBUFSZ-GHMZBOCLSA-N 1 2 234.347 2.310 20 0 BEADLO CC/C(C)=C/C(=O)OCCCc1c[nH+]cn1C ZINC001263510934 993354688 /nfs/dbraw/zinc/35/46/88/993354688.db2.gz UAOYSIUTXMWGFZ-DHZHZOJOSA-N 1 2 236.315 2.252 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ncc(C)s2)[nH]n1 ZINC000381219020 993378757 /nfs/dbraw/zinc/37/87/57/993378757.db2.gz ILTZQPGMJGMVQV-VIFPVBQESA-N 1 2 236.344 2.334 20 0 BEADLO CC[C@H](SC)C(=O)OCc1c[nH+]cn1CC ZINC001263662515 993454736 /nfs/dbraw/zinc/45/47/36/993454736.db2.gz FAVSHLCZXLWKLU-JTQLQIEISA-N 1 2 242.344 2.088 20 0 BEADLO CCn1c[nH+]cc1COC(=O)C[C@@H]1CC[C@@H]2C[C@@H]21 ZINC001263663115 993455252 /nfs/dbraw/zinc/45/52/52/993455252.db2.gz VEUBLMTYQZNIEK-MDZLAQPJSA-N 1 2 248.326 2.382 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)NCCc1[nH+]ccn1C ZINC001263920547 993599912 /nfs/dbraw/zinc/59/99/12/993599912.db2.gz KXUXLGLRSAWYAC-ZHACJKMWSA-N 1 2 249.358 2.071 20 0 BEADLO CC(C)[NH+]1CC(Nc2ncc(Cl)cc2F)C1 ZINC000393621268 993970589 /nfs/dbraw/zinc/97/05/89/993970589.db2.gz QZNRCUUKFBQEKJ-UHFFFAOYSA-N 1 2 243.713 2.379 20 0 BEADLO C=C/C=C/CC(=O)NCc1ccn2cc[nH+]c2c1 ZINC001294905356 994721549 /nfs/dbraw/zinc/72/15/49/994721549.db2.gz NWSRIKNBFKVGBL-ONEGZZNKSA-N 1 2 241.294 2.083 20 0 BEADLO Cc1cscc1NC(=O)Cc1[nH]c[nH+]c1C ZINC001295259826 994746750 /nfs/dbraw/zinc/74/67/50/994746750.db2.gz MHNYBPPMYBQZPT-UHFFFAOYSA-N 1 2 235.312 2.269 20 0 BEADLO C[C@@H](CC(=O)N[C@@H](C)C1(C)CC1)n1cc[nH+]c1 ZINC001336207553 994978624 /nfs/dbraw/zinc/97/86/24/994978624.db2.gz SLWDYRBFOWAGIW-QWRGUYRKSA-N 1 2 235.331 2.139 20 0 BEADLO CC(C)CC(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001304104559 995187889 /nfs/dbraw/zinc/18/78/89/995187889.db2.gz JLXYDEOMQCRVKP-UHFFFAOYSA-N 1 2 223.320 2.195 20 0 BEADLO CC(C)CC(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001304104559 995187894 /nfs/dbraw/zinc/18/78/94/995187894.db2.gz JLXYDEOMQCRVKP-UHFFFAOYSA-N 1 2 223.320 2.195 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)[C@H]2C[C@@H]2C(C)C)[nH+]1 ZINC001304108351 995190598 /nfs/dbraw/zinc/19/05/98/995190598.db2.gz UGRYTYBKDYBLAN-NEPJUHHUSA-N 1 2 249.358 2.441 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)[C@H]2C[C@@H]2C(C)C)c[nH+]1 ZINC001304108351 995190603 /nfs/dbraw/zinc/19/06/03/995190603.db2.gz UGRYTYBKDYBLAN-NEPJUHHUSA-N 1 2 249.358 2.441 20 0 BEADLO CCc1cn(CC(=O)N(C)c2ccccc2)c[nH+]1 ZINC001307398555 995342531 /nfs/dbraw/zinc/34/25/31/995342531.db2.gz YFFSWZVCLVLDKB-UHFFFAOYSA-N 1 2 243.310 2.109 20 0 BEADLO Cc1cn(C)nc1C[N@@H+]1CCc2ccsc2C1 ZINC001308132498 995563188 /nfs/dbraw/zinc/56/31/88/995563188.db2.gz AIFJPPNRGJGGIO-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1cn(C)nc1C[N@H+]1CCc2ccsc2C1 ZINC001308132498 995563193 /nfs/dbraw/zinc/56/31/93/995563193.db2.gz AIFJPPNRGJGGIO-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO CCCn1cncc1CNc1cccc[nH+]1 ZINC001308212165 995599867 /nfs/dbraw/zinc/59/98/67/995599867.db2.gz QJIPNFQBWVUUDX-UHFFFAOYSA-N 1 2 216.288 2.300 20 0 BEADLO OCc1cc[nH+]c(NCc2ccsc2)c1 ZINC001620978441 1170178427 /nfs/dbraw/zinc/17/84/27/1170178427.db2.gz JATULOYOGCKRFA-UHFFFAOYSA-N 1 2 220.297 2.248 20 0 BEADLO CCc1cn(Cc2nc(CCC(C)C)no2)c[nH+]1 ZINC001614961687 1170501167 /nfs/dbraw/zinc/50/11/67/1170501167.db2.gz UZCUIXNOAGYATD-UHFFFAOYSA-N 1 2 248.330 2.465 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1ccccc1C ZINC001618518669 1170639376 /nfs/dbraw/zinc/63/93/76/1170639376.db2.gz LVTQLCYOULZRJQ-GFCCVEGCSA-N 1 2 218.300 2.028 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1ccccc1C ZINC001618518669 1170639379 /nfs/dbraw/zinc/63/93/79/1170639379.db2.gz LVTQLCYOULZRJQ-GFCCVEGCSA-N 1 2 218.300 2.028 20 0 BEADLO C[C@H]1CN(C(=O)c2cccc3[nH+]ccn32)C[C@H]1C ZINC001618560483 1170641353 /nfs/dbraw/zinc/64/13/53/1170641353.db2.gz LXFXRQQFITVFPY-PHIMTYICSA-N 1 2 243.310 2.062 20 0 BEADLO Cc1noc(C2CC2)c1NCc1c[nH+]cn1C ZINC001621068993 1170655298 /nfs/dbraw/zinc/65/52/98/1170655298.db2.gz JSZNDKSZLQLJJW-UHFFFAOYSA-N 1 2 232.287 2.206 20 0 BEADLO Cc1cc(C[N@@H+]2Cc3c[nH]nc3[C@@H](C)C2)sn1 ZINC001620483375 1170674324 /nfs/dbraw/zinc/67/43/24/1170674324.db2.gz NPMKNWFGVUIJIJ-QMMMGPOBSA-N 1 2 248.355 2.294 20 0 BEADLO Cc1cc(C[N@H+]2Cc3c[nH]nc3[C@@H](C)C2)sn1 ZINC001620483375 1170674329 /nfs/dbraw/zinc/67/43/29/1170674329.db2.gz NPMKNWFGVUIJIJ-QMMMGPOBSA-N 1 2 248.355 2.294 20 0 BEADLO C[C@H](O)CCC[N@@H+]1CC(F)(F)CC[C@H]1C ZINC001620664313 1170698626 /nfs/dbraw/zinc/69/86/26/1170698626.db2.gz CMDXKTQYZPCODZ-ZJUUUORDSA-N 1 2 221.291 2.267 20 0 BEADLO C[C@H](O)CCC[N@H+]1CC(F)(F)CC[C@H]1C ZINC001620664313 1170698630 /nfs/dbraw/zinc/69/86/30/1170698630.db2.gz CMDXKTQYZPCODZ-ZJUUUORDSA-N 1 2 221.291 2.267 20 0 BEADLO Cc1noc([C@@H](C)[NH2+]Cc2cccn2C2CC2)n1 ZINC001621307084 1170772301 /nfs/dbraw/zinc/77/23/01/1170772301.db2.gz DEDVEJPPHKNRII-SECBINFHSA-N 1 2 246.314 2.365 20 0 BEADLO COC1CC[NH+](CC(=O)c2cccs2)CC1 ZINC000037337341 1170938704 /nfs/dbraw/zinc/93/87/04/1170938704.db2.gz KJZLRNRRKGNKNT-UHFFFAOYSA-N 1 2 239.340 2.042 20 0 BEADLO CCC[C@@H](C)[NH2+]CC(=O)OC(C)(C)C ZINC000037394148 1170941482 /nfs/dbraw/zinc/94/14/82/1170941482.db2.gz OJPTWXZCNIWCJD-SECBINFHSA-N 1 2 201.310 2.106 20 0 BEADLO CCCCCOC(=O)C[NH2+][C@H](C)CC ZINC000040954394 1171158652 /nfs/dbraw/zinc/15/86/52/1171158652.db2.gz HCEFWCLIILXESA-SNVBAGLBSA-N 1 2 201.310 2.108 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1[C@H](C)CCC[C@@H]1C ZINC001628457339 1171239551 /nfs/dbraw/zinc/23/95/51/1171239551.db2.gz UNPGGHWYXDYXBQ-AOOOYVTPSA-N 1 2 235.331 2.050 20 0 BEADLO O=C(NCc1ccco1)c1cc2c[nH+]ccc2[nH]1 ZINC001628444692 1171237247 /nfs/dbraw/zinc/23/72/47/1171237247.db2.gz NGOWELKZGLDSJC-UHFFFAOYSA-N 1 2 241.250 2.086 20 0 BEADLO C[C@@H]1CC(=O)CC[N@@H+]1CCOc1ccccc1 ZINC000042896788 1171260947 /nfs/dbraw/zinc/26/09/47/1171260947.db2.gz ILCRRIMEXLCMRR-GFCCVEGCSA-N 1 2 233.311 2.119 20 0 BEADLO C[C@@H]1CC(=O)CC[N@H+]1CCOc1ccccc1 ZINC000042896788 1171260958 /nfs/dbraw/zinc/26/09/58/1171260958.db2.gz ILCRRIMEXLCMRR-GFCCVEGCSA-N 1 2 233.311 2.119 20 0 BEADLO CC(C)N(C(=O)CCc1[nH]cc[nH+]1)C1CCC1 ZINC001629724045 1171339540 /nfs/dbraw/zinc/33/95/40/1171339540.db2.gz LBBTXJSGCHHPST-UHFFFAOYSA-N 1 2 235.331 2.132 20 0 BEADLO CCCN(CCC)C(=O)[C@H](C)n1cc[nH+]c1 ZINC000045080081 1171432837 /nfs/dbraw/zinc/43/28/37/1171432837.db2.gz UARPHFXTAZPLHO-NSHDSACASA-N 1 2 223.320 2.093 20 0 BEADLO C#Cc1cccc(NC(=O)[C@H](C)n2cc[nH+]c2)c1 ZINC000045064097 1171434456 /nfs/dbraw/zinc/43/44/56/1171434456.db2.gz HTLFLZROLQCUFT-NSHDSACASA-N 1 2 239.278 2.064 20 0 BEADLO C[C@H](C(=O)NC1CCCCCC1)n1cc[nH+]c1 ZINC000046761929 1171497675 /nfs/dbraw/zinc/49/76/75/1171497675.db2.gz SPEDNEGTZHWLKZ-LLVKDONJSA-N 1 2 235.331 2.283 20 0 BEADLO Cc1ccccc1CNC(=O)[C@H](C)n1cc[nH+]c1 ZINC000046762866 1171497921 /nfs/dbraw/zinc/49/79/21/1171497921.db2.gz NGDVPXHIYGMURM-LBPRGKRZSA-N 1 2 243.310 2.069 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H](C)[C@H](C)CC)c[nH+]1 ZINC001635610305 1171744140 /nfs/dbraw/zinc/74/41/40/1171744140.db2.gz GTTRTZRBPIGHBQ-ZJUUUORDSA-N 1 2 237.347 2.271 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H](C)[C@H](C)CC)[nH+]1 ZINC001635610305 1171744145 /nfs/dbraw/zinc/74/41/45/1171744145.db2.gz GTTRTZRBPIGHBQ-ZJUUUORDSA-N 1 2 237.347 2.271 20 0 BEADLO CCc1[nH]c(CNC(=O)C2=CCCCCC2)c[nH+]1 ZINC001635610979 1171743232 /nfs/dbraw/zinc/74/32/32/1171743232.db2.gz ZGXDDQMIZVFBHY-UHFFFAOYSA-N 1 2 247.342 2.479 20 0 BEADLO CCc1[nH]cc(CNC(=O)C2=CCCCCC2)[nH+]1 ZINC001635610979 1171743239 /nfs/dbraw/zinc/74/32/39/1171743239.db2.gz ZGXDDQMIZVFBHY-UHFFFAOYSA-N 1 2 247.342 2.479 20 0 BEADLO CC(Cl)=CC(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001636016567 1171784808 /nfs/dbraw/zinc/78/48/08/1171784808.db2.gz AQRYXWNCEWVCSC-YWEYNIOJSA-N 1 2 241.722 2.292 20 0 BEADLO C/C(Cl)=C/C(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001636016567 1171784812 /nfs/dbraw/zinc/78/48/12/1171784812.db2.gz AQRYXWNCEWVCSC-YWEYNIOJSA-N 1 2 241.722 2.292 20 0 BEADLO CCC(CC)(CC)NC(=O)CCn1cc[nH+]c1 ZINC000266066602 168316020 /nfs/dbraw/zinc/31/60/20/168316020.db2.gz DXGWLVNPUXLDLW-UHFFFAOYSA-N 1 2 237.347 2.358 20 0 BEADLO CCC(CC)(CC)NC(=O)c1c[nH+]c(C)[nH]1 ZINC000270098766 168317145 /nfs/dbraw/zinc/31/71/45/168317145.db2.gz NTCGTDPSYXUZOA-UHFFFAOYSA-N 1 2 223.320 2.417 20 0 BEADLO CCC(CC)(CCO)CNc1cc(C)[nH+]cn1 ZINC000301422435 168319286 /nfs/dbraw/zinc/31/92/86/168319286.db2.gz JHGJHOCULNBVTR-UHFFFAOYSA-N 1 2 237.347 2.386 20 0 BEADLO CCO[C@H]1CCC[N@@H+]([C@@H](C)c2csnn2)C1 ZINC000649318228 398142633 /nfs/dbraw/zinc/14/26/33/398142633.db2.gz FOLDEVCPQCPIEF-UWVGGRQHSA-N 1 2 241.360 2.100 20 0 BEADLO CCO[C@H]1CCC[N@H+]([C@@H](C)c2csnn2)C1 ZINC000649318228 398142636 /nfs/dbraw/zinc/14/26/36/398142636.db2.gz FOLDEVCPQCPIEF-UWVGGRQHSA-N 1 2 241.360 2.100 20 0 BEADLO CC(C)[N@H+](Cc1ccco1)Cc1nccn1C ZINC000336713530 187321645 /nfs/dbraw/zinc/32/16/45/187321645.db2.gz SQKWBFUGBHXCBU-UHFFFAOYSA-N 1 2 233.315 2.424 20 0 BEADLO CC(C)[N@@H+](Cc1ccco1)Cc1nccn1C ZINC000336713530 187321647 /nfs/dbraw/zinc/32/16/47/187321647.db2.gz SQKWBFUGBHXCBU-UHFFFAOYSA-N 1 2 233.315 2.424 20 0 BEADLO CC(C)N(Cc1ccco1)Cc1[nH+]ccn1C ZINC000336713530 187321649 /nfs/dbraw/zinc/32/16/49/187321649.db2.gz SQKWBFUGBHXCBU-UHFFFAOYSA-N 1 2 233.315 2.424 20 0 BEADLO CCn1cc([C@H](C)[NH2+][C@H](C)C(F)F)cn1 ZINC000389925549 398149232 /nfs/dbraw/zinc/14/92/32/398149232.db2.gz VVHHDNMZJDTQCD-JGVFFNPUSA-N 1 2 217.263 2.207 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)C(F)F)c1cncs1 ZINC000389957683 398152141 /nfs/dbraw/zinc/15/21/41/398152141.db2.gz XULLECQLPDNSTE-RITPCOANSA-N 1 2 206.261 2.447 20 0 BEADLO Cc1cc(C[NH2+]C(C)(C)c2nccs2)ncn1 ZINC000293129690 178016871 /nfs/dbraw/zinc/01/68/71/178016871.db2.gz LFFFAHIFBNEUSY-UHFFFAOYSA-N 1 2 248.355 2.266 20 0 BEADLO Cc1cc(C[NH2+]CC(F)F)cc(C)c1O ZINC000147350205 178020938 /nfs/dbraw/zinc/02/09/38/178020938.db2.gz NBPYIQIJVZATTH-UHFFFAOYSA-N 1 2 215.243 2.364 20 0 BEADLO Cc1cc(C[NH2+]Cc2cn[nH]c2C)cs1 ZINC000292745898 178024150 /nfs/dbraw/zinc/02/41/50/178024150.db2.gz REFGPYDABCCXTD-UHFFFAOYSA-N 1 2 221.329 2.378 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccc(F)cc2)no1 ZINC000044295854 178026565 /nfs/dbraw/zinc/02/65/65/178026565.db2.gz QOECQRIOIHALGS-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2ncn(C)n2)ccc1F ZINC000275392757 178038223 /nfs/dbraw/zinc/03/82/23/178038223.db2.gz AZLLTLMSENAQCJ-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO Cc1cc(C[NH2+][C@H]2COCc3ccccc32)no1 ZINC000225996420 178041382 /nfs/dbraw/zinc/04/13/82/178041382.db2.gz VLNOICKNOFFCEG-AWEZNQCLSA-N 1 2 244.294 2.344 20 0 BEADLO Cc1nnc(C[N@@H+]2CC[C@]3(CC3(F)F)C2)s1 ZINC000649907360 398179218 /nfs/dbraw/zinc/17/92/18/398179218.db2.gz PPVMFOXBQPYJGA-VIFPVBQESA-N 1 2 245.298 2.078 20 0 BEADLO Cc1nnc(C[N@H+]2CC[C@]3(CC3(F)F)C2)s1 ZINC000649907360 398179223 /nfs/dbraw/zinc/17/92/23/398179223.db2.gz PPVMFOXBQPYJGA-VIFPVBQESA-N 1 2 245.298 2.078 20 0 BEADLO Cc1cn2c([nH+]1)CN(C(=O)CCCC(C)C)CC2 ZINC000649367456 398180902 /nfs/dbraw/zinc/18/09/02/398180902.db2.gz KKDQUIZASIGKFC-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO CCc1cc(NCCCC2CCOCC2)nc[nH+]1 ZINC000649380962 398189683 /nfs/dbraw/zinc/18/96/83/398189683.db2.gz ZZKLDJNHNQLYET-UHFFFAOYSA-N 1 2 249.358 2.080 20 0 BEADLO Cc1nc(C)c(C[NH2+][C@H]2C[C@@H](C)n3ccnc32)o1 ZINC000385926196 398191891 /nfs/dbraw/zinc/19/18/91/398191891.db2.gz AXOGGUODIUZZQN-KCJUWKMLSA-N 1 2 246.314 2.284 20 0 BEADLO Cc1cccn2cc(CN3CC[C@H](F)C3)[nH+]c12 ZINC000649938206 398191917 /nfs/dbraw/zinc/19/19/17/398191917.db2.gz XVGIOQYVYQYNEH-NSHDSACASA-N 1 2 233.290 2.187 20 0 BEADLO Cc1cccn2cc(C[N@@H+]3CC[C@H](F)C3)nc12 ZINC000649938206 398191918 /nfs/dbraw/zinc/19/19/18/398191918.db2.gz XVGIOQYVYQYNEH-NSHDSACASA-N 1 2 233.290 2.187 20 0 BEADLO Cc1cccn2cc(C[N@H+]3CC[C@H](F)C3)nc12 ZINC000649938206 398191919 /nfs/dbraw/zinc/19/19/19/398191919.db2.gz XVGIOQYVYQYNEH-NSHDSACASA-N 1 2 233.290 2.187 20 0 BEADLO CCC(CC)C(=O)NC[C@@H](C)Cn1cc[nH+]c1 ZINC000265840781 168339060 /nfs/dbraw/zinc/33/90/60/168339060.db2.gz RYVPLDQKJYYWAM-LLVKDONJSA-N 1 2 237.347 2.072 20 0 BEADLO Cc1cc(N(C)[C@H]2CCOC2)nc(C(C)C)[nH+]1 ZINC000112966645 178102720 /nfs/dbraw/zinc/10/27/20/178102720.db2.gz PCLBFMATLJMWOX-NSHDSACASA-N 1 2 235.331 2.134 20 0 BEADLO Cc1[nH+]cccc1Cc1nc(C(C)C)no1 ZINC000334300155 398197498 /nfs/dbraw/zinc/19/74/98/398197498.db2.gz SVZVKYVRMMYJQL-UHFFFAOYSA-N 1 2 217.272 2.487 20 0 BEADLO Cc1cc(N)nc(SCCC(F)(F)F)[nH+]1 ZINC000071858231 178108912 /nfs/dbraw/zinc/10/89/12/178108912.db2.gz MKBZLQFPHOHFGR-UHFFFAOYSA-N 1 2 237.250 2.412 20 0 BEADLO Cc1cc(N)nc(SC[C@H]2CC[C@@H](C)O2)[nH+]1 ZINC000188525328 178109516 /nfs/dbraw/zinc/10/95/16/178109516.db2.gz XLJYUMLFRAYKJM-RKDXNWHRSA-N 1 2 239.344 2.027 20 0 BEADLO Cc1cc(N2CC(C)(C)[C@@H]2[C@@H]2CCCO2)nc[nH+]1 ZINC000357594748 178110646 /nfs/dbraw/zinc/11/06/46/178110646.db2.gz LWFSFQVTFFCUPM-AAEUAGOBSA-N 1 2 247.342 2.179 20 0 BEADLO Cc1cc(N2CC(C)(C)[C@H]2[C@@H]2CCCO2)nc[nH+]1 ZINC000357594758 178110736 /nfs/dbraw/zinc/11/07/36/178110736.db2.gz LWFSFQVTFFCUPM-WCQYABFASA-N 1 2 247.342 2.179 20 0 BEADLO Cc1cc(N2CCS[C@@H](C)CC2)nc[nH+]1 ZINC000302736774 178116785 /nfs/dbraw/zinc/11/67/85/178116785.db2.gz PEFOMTKLLPWITK-JTQLQIEISA-N 1 2 223.345 2.117 20 0 BEADLO Cc1cc(N2CCOC[C@@H](C)C2)nc(C(C)C)[nH+]1 ZINC000338260105 178116824 /nfs/dbraw/zinc/11/68/24/178116824.db2.gz FGCYCSVZNMWYOG-NSHDSACASA-N 1 2 249.358 2.381 20 0 BEADLO Cc1cc(N2CC[C@H](OCC(C)C)C2)nc[nH+]1 ZINC000301651214 178119399 /nfs/dbraw/zinc/11/93/99/178119399.db2.gz SBBZECCINZQHTL-LBPRGKRZSA-N 1 2 235.331 2.036 20 0 BEADLO Cc1cc(N2CC[C@H]([C@H](C)O)C2)nc(C(C)C)[nH+]1 ZINC000228159602 178119888 /nfs/dbraw/zinc/11/98/88/178119888.db2.gz CXSJULJAMUMUHC-RYUDHWBXSA-N 1 2 249.358 2.116 20 0 BEADLO Cc1cc(NC(=O)CC[C@@H]2CCOC2)cc[nH+]1 ZINC000175861625 178128749 /nfs/dbraw/zinc/12/87/49/178128749.db2.gz XTKLKBSQFZJMSU-LLVKDONJSA-N 1 2 234.299 2.145 20 0 BEADLO CCc1cc(N2CCO[C@@H]3CCC[C@H]32)nc(C)[nH+]1 ZINC000272900734 538926229 /nfs/dbraw/zinc/92/62/29/538926229.db2.gz PONUBIQILVWCIL-CHWSQXEVSA-N 1 2 247.342 2.105 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CCC(=O)C[C@H]2C)cc[nH+]1 ZINC000126056341 178144141 /nfs/dbraw/zinc/14/41/41/178144141.db2.gz UMKJFUOQDRRGKU-NOZJJQNGSA-N 1 2 246.310 2.334 20 0 BEADLO Cc1cc(NC(=O)[C@@]2(C)CCCOC2)cc[nH+]1 ZINC000272839676 178146591 /nfs/dbraw/zinc/14/65/91/178146591.db2.gz ZPXAGEXNCYGFFU-ZDUSSCGKSA-N 1 2 234.299 2.145 20 0 BEADLO Cc1cc(NC(=O)[C@H](C)C2CC2)cc[nH+]1 ZINC000175329634 178147176 /nfs/dbraw/zinc/14/71/76/178147176.db2.gz BXEIFRQIZJFFGJ-SECBINFHSA-N 1 2 204.273 2.375 20 0 BEADLO CC[C@@H](CC(=O)NCc1c[nH+]c[nH]1)C(C)C ZINC000331089789 398217697 /nfs/dbraw/zinc/21/76/97/398217697.db2.gz UNCOQGLZCNLRFV-JTQLQIEISA-N 1 2 223.320 2.098 20 0 BEADLO CC[C@@H](CC(=O)NCc1c[nH]c[nH+]1)C(C)C ZINC000331089789 398217701 /nfs/dbraw/zinc/21/77/01/398217701.db2.gz UNCOQGLZCNLRFV-JTQLQIEISA-N 1 2 223.320 2.098 20 0 BEADLO Cc1cc(NC(=O)[C@]2(C)CCCOC2)cc[nH+]1 ZINC000272839675 178148979 /nfs/dbraw/zinc/14/89/79/178148979.db2.gz ZPXAGEXNCYGFFU-CYBMUJFWSA-N 1 2 234.299 2.145 20 0 BEADLO Cc1cc(NC(=O)c2c[nH]nc2C(C)C)cc[nH+]1 ZINC000193371552 178151173 /nfs/dbraw/zinc/15/11/73/178151173.db2.gz KJPKOCIHHJYYOK-UHFFFAOYSA-N 1 2 244.298 2.489 20 0 BEADLO Cc1cc(NC(=O)c2cn[nH]c2C(C)C)cc[nH+]1 ZINC000193371552 178151175 /nfs/dbraw/zinc/15/11/75/178151175.db2.gz KJPKOCIHHJYYOK-UHFFFAOYSA-N 1 2 244.298 2.489 20 0 BEADLO Cc1cc(NC(=O)c2cnn(C(C)C)c2)cc[nH+]1 ZINC000191589547 178151366 /nfs/dbraw/zinc/15/13/66/178151366.db2.gz VGWMBZBNJHUVFP-UHFFFAOYSA-N 1 2 244.298 2.420 20 0 BEADLO Cc1cc(NC2CC2)nc(-c2cccnc2)[nH+]1 ZINC000298804005 178153219 /nfs/dbraw/zinc/15/32/19/178153219.db2.gz SSWDZSIULVHRGI-UHFFFAOYSA-N 1 2 226.283 2.421 20 0 BEADLO Cc1cc(NC(C)(C)[C@H](C)O)nc(C2CC2)[nH+]1 ZINC000270711669 178153768 /nfs/dbraw/zinc/15/37/68/178153768.db2.gz LPEOMLBFENAXSK-VIFPVBQESA-N 1 2 235.331 2.234 20 0 BEADLO Cc1cc(NCCC2(O)CCC2)nc(C2CC2)[nH+]1 ZINC000286344818 178158240 /nfs/dbraw/zinc/15/82/40/178158240.db2.gz BGWRIXWRDTVWRC-UHFFFAOYSA-N 1 2 247.342 2.379 20 0 BEADLO Cc1noc(C)c1CCCNc1cc(C)[nH+]cn1 ZINC000301547050 178159299 /nfs/dbraw/zinc/15/92/99/178159299.db2.gz FJXCSKRSBYRJNH-UHFFFAOYSA-N 1 2 246.314 2.435 20 0 BEADLO Cc1cc(NCCCNc2cccc[nH+]2)ncn1 ZINC000112514966 178159403 /nfs/dbraw/zinc/15/94/03/178159403.db2.gz KDXRMVXHOBAZQB-UHFFFAOYSA-N 1 2 243.314 2.094 20 0 BEADLO Cc1cc(NCCCOCC(C)C)nc[nH+]1 ZINC000225692837 178159614 /nfs/dbraw/zinc/15/96/14/178159614.db2.gz OXOVMWGLWFZSSJ-UHFFFAOYSA-N 1 2 223.320 2.260 20 0 BEADLO Cc1noc(C)c1CCNc1cc(C)[nH+]cn1 ZINC000301284825 178162818 /nfs/dbraw/zinc/16/28/18/178162818.db2.gz UZXBLAWRDAWOLF-UHFFFAOYSA-N 1 2 232.287 2.044 20 0 BEADLO Cc1cc(NCCc2cn[nH]c2)nc(C2CC2)[nH+]1 ZINC000291217524 178162962 /nfs/dbraw/zinc/16/29/62/178162962.db2.gz VRGLZSWMSMBMPI-UHFFFAOYSA-N 1 2 243.314 2.040 20 0 BEADLO Cc1cc(NCc2ccc(Cl)nc2)nc[nH+]1 ZINC000301282308 178171487 /nfs/dbraw/zinc/17/14/87/178171487.db2.gz XZUQCUNDKGMGGN-UHFFFAOYSA-N 1 2 234.690 2.446 20 0 BEADLO CCC(CC)CC(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000371359672 168347528 /nfs/dbraw/zinc/34/75/28/168347528.db2.gz KYHOLXKPELIUBS-NSHDSACASA-N 1 2 249.358 2.210 20 0 BEADLO CCC(CC)CC(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000371359672 168347530 /nfs/dbraw/zinc/34/75/30/168347530.db2.gz KYHOLXKPELIUBS-NSHDSACASA-N 1 2 249.358 2.210 20 0 BEADLO Cc1cc(N[C@@H](C)C[C@@H](O)c2ccco2)nc[nH+]1 ZINC000301647086 178178147 /nfs/dbraw/zinc/17/81/47/178178147.db2.gz PZAWYYXLNAANGK-WDEREUQCSA-N 1 2 247.298 2.302 20 0 BEADLO Cc1cc(N[C@@H](C)[C@H]2CCCCO2)nc[nH+]1 ZINC000309762505 178179355 /nfs/dbraw/zinc/17/93/55/178179355.db2.gz IZEPDTRYCQKQNL-WDEREUQCSA-N 1 2 221.304 2.155 20 0 BEADLO Cc1cc(N[C@@H]2C=C[C@H](CO)C2)nc(C2CC2)[nH+]1 ZINC000267131596 178179722 /nfs/dbraw/zinc/17/97/22/178179722.db2.gz VYERZZRGILGXKH-CMPLNLGQSA-N 1 2 245.326 2.011 20 0 BEADLO Cc1cc(N[C@@H](C)c2ccccn2)nc[nH+]1 ZINC000040727179 178180947 /nfs/dbraw/zinc/18/09/47/178180947.db2.gz DIPCRSXYEIXURA-JTQLQIEISA-N 1 2 214.272 2.353 20 0 BEADLO Cc1[nH]c(CN2CCOC[C@H]2C2CCC2)[nH+]c1C ZINC000628322266 398223099 /nfs/dbraw/zinc/22/30/99/398223099.db2.gz LIEUINCPVGKNBZ-ZDUSSCGKSA-N 1 2 249.358 2.027 20 0 BEADLO C[C@@H]1CCC[C@H](C)N1C(=O)CCn1cc[nH+]c1 ZINC000073319760 343986470 /nfs/dbraw/zinc/98/64/70/343986470.db2.gz QCSXSYQLNXUFTK-TXEJJXNPSA-N 1 2 235.331 2.063 20 0 BEADLO Cc1cc(N[C@@H]2CCOC[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000277612528 178182051 /nfs/dbraw/zinc/18/20/51/178182051.db2.gz LVTDMWMUIONZMQ-JOYOIKCWSA-N 1 2 247.342 2.499 20 0 BEADLO Cc1cc(N[C@@H]2C[C@H]2C)nc(C2CC2)[nH+]1 ZINC000265322588 178183971 /nfs/dbraw/zinc/18/39/71/178183971.db2.gz FGAZIWYHKHIWIX-GMSGAONNSA-N 1 2 203.289 2.483 20 0 BEADLO Cc1cc(N[C@@H]2C[C@@H](O)C2(C)C)nc(C2CC2)[nH+]1 ZINC000189211456 178184822 /nfs/dbraw/zinc/18/48/22/178184822.db2.gz AIWYHCYXWAXWHQ-GHMZBOCLSA-N 1 2 247.342 2.234 20 0 BEADLO Cc1cc(N[C@H](C)C[C@@H]2CCCO2)nc[nH+]1 ZINC000110484404 178186045 /nfs/dbraw/zinc/18/60/45/178186045.db2.gz MWSQNYBOBPUWRT-MNOVXSKESA-N 1 2 221.304 2.155 20 0 BEADLO Cc1cc(N[C@H](C)C[C@H]2CCCO2)nc[nH+]1 ZINC000110484413 178186620 /nfs/dbraw/zinc/18/66/20/178186620.db2.gz MWSQNYBOBPUWRT-GHMZBOCLSA-N 1 2 221.304 2.155 20 0 BEADLO Cc1cnc(C[N@H+](C)CCOc2ccccc2)o1 ZINC000075615476 398223983 /nfs/dbraw/zinc/22/39/83/398223983.db2.gz FPHWXOUHQKWJCJ-UHFFFAOYSA-N 1 2 246.310 2.494 20 0 BEADLO Cc1cnc(C[N@@H+](C)CCOc2ccccc2)o1 ZINC000075615476 398223987 /nfs/dbraw/zinc/22/39/87/398223987.db2.gz FPHWXOUHQKWJCJ-UHFFFAOYSA-N 1 2 246.310 2.494 20 0 BEADLO Cc1cc(N[C@H](CCO)C(C)C)nc(C2CC2)[nH+]1 ZINC000266244159 178187191 /nfs/dbraw/zinc/18/71/91/178187191.db2.gz LXUDBLYIHRNUNJ-GFCCVEGCSA-N 1 2 249.358 2.481 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1sccc1C ZINC000073405264 343987459 /nfs/dbraw/zinc/98/74/59/343987459.db2.gz ODSCRGOXAALAFP-VIFPVBQESA-N 1 2 227.329 2.050 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1sccc1C ZINC000073405264 343987460 /nfs/dbraw/zinc/98/74/60/343987460.db2.gz ODSCRGOXAALAFP-VIFPVBQESA-N 1 2 227.329 2.050 20 0 BEADLO Cc1cc(N[C@H]2C[C@H](O)C2(C)C)nc(C(C)C)[nH+]1 ZINC000129104390 178192543 /nfs/dbraw/zinc/19/25/43/178192543.db2.gz NMZRPRLOTUSPCI-QWRGUYRKSA-N 1 2 249.358 2.480 20 0 BEADLO Cc1nc(N(C)[C@@H](C)c2ccccn2)cc[nH+]1 ZINC000266165997 187332434 /nfs/dbraw/zinc/33/24/34/187332434.db2.gz YCQFPCFAQXJPNO-JTQLQIEISA-N 1 2 228.299 2.377 20 0 BEADLO CC[C@@H]1C[NH+](Cc2conc2C)C[C@@H](CC)O1 ZINC000421392703 192327721 /nfs/dbraw/zinc/32/77/21/192327721.db2.gz RDMWBXWVCHPJLQ-CHWSQXEVSA-N 1 2 238.331 2.372 20 0 BEADLO C[C@H]1Oc2cc(F)ccc2[C@@H]1[NH2+]Cc1cocn1 ZINC000342316631 136222917 /nfs/dbraw/zinc/22/29/17/136222917.db2.gz ZPXHSAVNAYJYNB-AMIZOPFISA-N 1 2 248.257 2.426 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@H]2CCCc3cn[nH]c32)no1 ZINC000285316709 178233406 /nfs/dbraw/zinc/23/34/06/178233406.db2.gz SVUKLVXVIZDLGU-KOLCDFICSA-N 1 2 246.314 2.434 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@H]2CCCc3c[nH]nc32)no1 ZINC000285316709 178233407 /nfs/dbraw/zinc/23/34/07/178233407.db2.gz SVUKLVXVIZDLGU-KOLCDFICSA-N 1 2 246.314 2.434 20 0 BEADLO COCCOc1cccc(-c2c[nH]c[nH+]2)c1 ZINC000649429331 398232242 /nfs/dbraw/zinc/23/22/42/398232242.db2.gz XDEHKIGXTMQTND-UHFFFAOYSA-N 1 2 218.256 2.102 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@]1(C)C[C@H]2C[C@H]2C1 ZINC000334184170 136224110 /nfs/dbraw/zinc/22/41/10/136224110.db2.gz GNTFUOWPGSCQJR-WDAIWFPHSA-N 1 2 246.310 2.465 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2cccnc2)no1 ZINC000282619943 178228570 /nfs/dbraw/zinc/22/85/70/178228570.db2.gz IYZVOHBCMKNNLG-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2ccoc2)no1 ZINC000282634460 178229230 /nfs/dbraw/zinc/22/92/30/178229230.db2.gz JZDJGLDMIKHMSX-SECBINFHSA-N 1 2 206.245 2.427 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2nnc[nH]2)c(C)s1 ZINC000037919508 178229337 /nfs/dbraw/zinc/22/93/37/178229337.db2.gz AANACZHRIARKLG-MRVPVSSYSA-N 1 2 236.344 2.334 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2ncn(C)n2)cs1 ZINC000294208923 178229765 /nfs/dbraw/zinc/22/97/65/178229765.db2.gz MKVDIZGILQIZKN-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2ncnn2C)c(C)o1 ZINC000278150357 178232251 /nfs/dbraw/zinc/23/22/51/178232251.db2.gz ACEDXLUIIVJUCD-NXEZZACHSA-N 1 2 248.330 2.437 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2nncn2C)oc1C ZINC000282078826 178232704 /nfs/dbraw/zinc/23/27/04/178232704.db2.gz HMTIWLXIWRXQEU-NXEZZACHSA-N 1 2 248.330 2.437 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2nncn2C)c(C)o1 ZINC000037017606 178233374 /nfs/dbraw/zinc/23/33/74/178233374.db2.gz HTIHKOKLNVCDGU-NXEZZACHSA-N 1 2 248.330 2.437 20 0 BEADLO CC(C)[C@@H]1CCCCN1C(=O)CCc1c[nH+]c[nH]1 ZINC000280187372 538936427 /nfs/dbraw/zinc/93/64/27/538936427.db2.gz PWGNAWUTXHRFHW-ZDUSSCGKSA-N 1 2 249.358 2.379 20 0 BEADLO CC(C)[C@@H]1CCCCN1C(=O)CCc1c[nH]c[nH+]1 ZINC000280187372 538936429 /nfs/dbraw/zinc/93/64/29/538936429.db2.gz PWGNAWUTXHRFHW-ZDUSSCGKSA-N 1 2 249.358 2.379 20 0 BEADLO COCCOCc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000649433656 398234883 /nfs/dbraw/zinc/23/48/83/398234883.db2.gz AVTJAEIRMNXNTP-UHFFFAOYSA-N 1 2 232.283 2.240 20 0 BEADLO Cn1c[nH+]cc1CN1CCc2cc(F)c(F)cc21 ZINC000334493759 136226077 /nfs/dbraw/zinc/22/60/77/136226077.db2.gz OSTFYBFUSPRSRU-UHFFFAOYSA-N 1 2 249.264 2.261 20 0 BEADLO CC(C)[C@H](CCO)Nc1cc[nH+]c(C2CC2)n1 ZINC000266212004 187332672 /nfs/dbraw/zinc/33/26/72/187332672.db2.gz GIHIGFQQNUFMPJ-NSHDSACASA-N 1 2 235.331 2.173 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cnn(C(C)C)c2)CCO1 ZINC000179930904 259305569 /nfs/dbraw/zinc/30/55/69/259305569.db2.gz IVHRJCIBFWSMNN-CYBMUJFWSA-N 1 2 237.347 2.075 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cnn(C(C)C)c2)CCO1 ZINC000179930904 259305571 /nfs/dbraw/zinc/30/55/71/259305571.db2.gz IVHRJCIBFWSMNN-CYBMUJFWSA-N 1 2 237.347 2.075 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2nnc(C)o2)s1 ZINC000076342657 398236425 /nfs/dbraw/zinc/23/64/25/398236425.db2.gz YWTAKVUKIDUDBD-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2nnc(C)o2)s1 ZINC000076342657 398236428 /nfs/dbraw/zinc/23/64/28/398236428.db2.gz YWTAKVUKIDUDBD-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO CC[C@@H](C)C[C@H](C)NC(=O)CCc1c[nH+]c[nH]1 ZINC000280313630 538937325 /nfs/dbraw/zinc/93/73/25/538937325.db2.gz YQSZDIBEIFPXNP-MNOVXSKESA-N 1 2 237.347 2.283 20 0 BEADLO CC[C@@H](C)C[C@H](C)NC(=O)CCc1c[nH]c[nH+]1 ZINC000280313630 538937326 /nfs/dbraw/zinc/93/73/26/538937326.db2.gz YQSZDIBEIFPXNP-MNOVXSKESA-N 1 2 237.347 2.283 20 0 BEADLO CC[C@H](C)C[C@H](C)NC(=O)CCc1c[nH+]c[nH]1 ZINC000280313631 538937374 /nfs/dbraw/zinc/93/73/74/538937374.db2.gz YQSZDIBEIFPXNP-QWRGUYRKSA-N 1 2 237.347 2.283 20 0 BEADLO CC[C@H](C)C[C@H](C)NC(=O)CCc1c[nH]c[nH+]1 ZINC000280313631 538937375 /nfs/dbraw/zinc/93/73/75/538937375.db2.gz YQSZDIBEIFPXNP-QWRGUYRKSA-N 1 2 237.347 2.283 20 0 BEADLO CC1(C)CC[C@@H](n2cc(Cn3cc[nH+]c3)nn2)C1 ZINC000629941462 361785950 /nfs/dbraw/zinc/78/59/50/361785950.db2.gz KDTYHKRXKJWMRI-GFCCVEGCSA-N 1 2 245.330 2.274 20 0 BEADLO COC[C@@H](N[C@H](C)c1[nH]cc[nH+]1)c1ccc(C)o1 ZINC000279104062 538935598 /nfs/dbraw/zinc/93/55/98/538935598.db2.gz VNOYMLQWWMHRLG-GHMZBOCLSA-N 1 2 249.314 2.349 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2ccoc2)no1 ZINC000282634464 178252039 /nfs/dbraw/zinc/25/20/39/178252039.db2.gz JZDJGLDMIKHMSX-VIFPVBQESA-N 1 2 206.245 2.427 20 0 BEADLO c1[nH]cc(-c2ccc(N3CCCC3)nc2)[nH+]1 ZINC000649438118 398240162 /nfs/dbraw/zinc/24/01/62/398240162.db2.gz UWYMOITZSQHPMU-UHFFFAOYSA-N 1 2 214.272 2.072 20 0 BEADLO C[C@H]1C[NH+](Cc2ncccn2)C[C@H](C)C1(F)F ZINC000625654834 398237252 /nfs/dbraw/zinc/23/72/52/398237252.db2.gz RAJJXOOIJUTPCX-UWVGGRQHSA-N 1 2 241.285 2.200 20 0 BEADLO CCC1(CC)C[N@H+](CC2(F)CC2)CC[S@]1=O ZINC000527233652 262834636 /nfs/dbraw/zinc/83/46/36/262834636.db2.gz SUAWIVUEKCQIAQ-MRXNPFEDSA-N 1 2 247.379 2.112 20 0 BEADLO CCC1(CC)C[N@@H+](CC2(F)CC2)CC[S@]1=O ZINC000527233652 262834638 /nfs/dbraw/zinc/83/46/38/262834638.db2.gz SUAWIVUEKCQIAQ-MRXNPFEDSA-N 1 2 247.379 2.112 20 0 BEADLO Cc1cc2ccccc2[nH+]c1NCCCO ZINC000063105664 178298737 /nfs/dbraw/zinc/29/87/37/178298737.db2.gz DMEKLHRSVGPOHE-UHFFFAOYSA-N 1 2 216.284 2.338 20 0 BEADLO Cc1nonc1Cn1c[nH+]c2cc(C)c(C)cc21 ZINC000128332782 178304772 /nfs/dbraw/zinc/30/47/72/178304772.db2.gz ONMSKBQXQNKDQY-UHFFFAOYSA-N 1 2 242.282 2.393 20 0 BEADLO CC(C)c1nnc([C@@H](C)N[C@H](C)c2[nH]cc[nH+]2)[nH]1 ZINC000286356777 538943561 /nfs/dbraw/zinc/94/35/61/538943561.db2.gz ZNIHYROCPWNVQN-RKDXNWHRSA-N 1 2 248.334 2.063 20 0 BEADLO CC(C)c1nnc([C@@H](C)N[C@@H](C)c2[nH]cc[nH+]2)[nH]1 ZINC000286356768 538943792 /nfs/dbraw/zinc/94/37/92/538943792.db2.gz ZNIHYROCPWNVQN-DTWKUNHWSA-N 1 2 248.334 2.063 20 0 BEADLO Cc1cc[nH]c1C(=O)N[C@@H](c1[nH]cc[nH+]1)C(C)C ZINC000283160296 178315373 /nfs/dbraw/zinc/31/53/73/178315373.db2.gz ZHIWYKKNGDCEQG-SNVBAGLBSA-N 1 2 246.314 2.173 20 0 BEADLO C[C@@H](Nc1c[nH]c[nH+]1)C1CCSCC1 ZINC000306202871 398253473 /nfs/dbraw/zinc/25/34/73/398253473.db2.gz QFFKRUABYCMXMS-MRVPVSSYSA-N 1 2 211.334 2.353 20 0 BEADLO CCC[C@@H](C(=O)NCc1c[nH+]cn1C)C(C)C ZINC000291410299 538947594 /nfs/dbraw/zinc/94/75/94/538947594.db2.gz JOHSPKWXVJEIEB-GFCCVEGCSA-N 1 2 237.347 2.109 20 0 BEADLO COc1cc(CNc2ccc(C)[nH+]c2)sn1 ZINC000399138164 398258622 /nfs/dbraw/zinc/25/86/22/398258622.db2.gz VYZXHCGZIUOXPO-UHFFFAOYSA-N 1 2 235.312 2.467 20 0 BEADLO CC(C)N(C(=O)[C@H](C)Cc1c[nH+]c[nH]1)C1CCC1 ZINC000576716193 365669419 /nfs/dbraw/zinc/66/94/19/365669419.db2.gz SBVVHXBEYMEMIH-LLVKDONJSA-N 1 2 249.358 2.378 20 0 BEADLO CC(C)N(C(=O)[C@H](C)Cc1c[nH]c[nH+]1)C1CCC1 ZINC000576716193 365669425 /nfs/dbraw/zinc/66/94/25/365669425.db2.gz SBVVHXBEYMEMIH-LLVKDONJSA-N 1 2 249.358 2.378 20 0 BEADLO CCC(C)(C)CC(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000344358945 136231951 /nfs/dbraw/zinc/23/19/51/136231951.db2.gz VQKWVDPSDJLBDM-JTQLQIEISA-N 1 2 249.358 2.210 20 0 BEADLO CCC(C)(C)CC(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000344358945 136231952 /nfs/dbraw/zinc/23/19/52/136231952.db2.gz VQKWVDPSDJLBDM-JTQLQIEISA-N 1 2 249.358 2.210 20 0 BEADLO COc1ccc(N[C@@H]2C[C@@H](C)O[C@@H]2C)[nH+]c1 ZINC000385083809 398261146 /nfs/dbraw/zinc/26/11/46/398261146.db2.gz FLMPZERTWSWYRN-FXPVBKGRSA-N 1 2 222.288 2.068 20 0 BEADLO Cc1ccc(C(=O)N(C)Cc2[nH]cc[nH+]2)s1 ZINC000070650736 178379573 /nfs/dbraw/zinc/37/95/73/178379573.db2.gz VGFABCNEFMPVHM-UHFFFAOYSA-N 1 2 235.312 2.052 20 0 BEADLO Cc1ccc(NC(=O)[C@@]2(C)C[C@H]2F)c(C)[nH+]1 ZINC000335088374 136232943 /nfs/dbraw/zinc/23/29/43/136232943.db2.gz XSHGITGNLQRNKG-PWSUYJOCSA-N 1 2 222.263 2.385 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]C[C@H](O)CC(C)(C)C ZINC000180566589 538958521 /nfs/dbraw/zinc/95/85/21/538958521.db2.gz QDJASVHGCIQNCO-MWLCHTKSSA-N 1 2 239.363 2.166 20 0 BEADLO Cn1cccc1C[N@H+](C)Cc1ccncc1F ZINC000449029526 398272167 /nfs/dbraw/zinc/27/21/67/398272167.db2.gz OSVIEVWZNDLACH-UHFFFAOYSA-N 1 2 233.290 2.191 20 0 BEADLO Cn1cccc1C[N@@H+](C)Cc1ccncc1F ZINC000449029526 398272169 /nfs/dbraw/zinc/27/21/69/398272169.db2.gz OSVIEVWZNDLACH-UHFFFAOYSA-N 1 2 233.290 2.191 20 0 BEADLO CCCCCNC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000649474092 398272481 /nfs/dbraw/zinc/27/24/81/398272481.db2.gz QTPYVXABACCNSW-NSHDSACASA-N 1 2 223.320 2.141 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@@H](O)CC(C)(C)C ZINC000180566646 538958215 /nfs/dbraw/zinc/95/82/15/538958215.db2.gz QDJASVHGCIQNCO-ONGXEEELSA-N 1 2 239.363 2.166 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)[C@@]12C[C@@H]1CCC2 ZINC000421470326 192342329 /nfs/dbraw/zinc/34/23/29/192342329.db2.gz CJUOOJTZMISKSH-HZMBPMFUSA-N 1 2 241.294 2.463 20 0 BEADLO Cc1ncsc1C[N@@H+](C)Cc1cnoc1C ZINC000188996258 346854696 /nfs/dbraw/zinc/85/46/96/346854696.db2.gz BEVIKJAVNZYBET-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1ncsc1C[N@H+](C)Cc1cnoc1C ZINC000188996258 346854698 /nfs/dbraw/zinc/85/46/98/346854698.db2.gz BEVIKJAVNZYBET-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1csc(C[N@@H+]2CC[C@@](C)(F)C2)n1 ZINC000334925170 398274624 /nfs/dbraw/zinc/27/46/24/398274624.db2.gz FUEAUSBLWHMCHP-SNVBAGLBSA-N 1 2 214.309 2.385 20 0 BEADLO Cc1csc(C[N@H+]2CC[C@@](C)(F)C2)n1 ZINC000334925170 398274626 /nfs/dbraw/zinc/27/46/26/398274626.db2.gz FUEAUSBLWHMCHP-SNVBAGLBSA-N 1 2 214.309 2.385 20 0 BEADLO Cc1[nH]c([C@@H]2CCCN2C(=O)[C@@H]2C[C@@H]2C)[nH+]c1C ZINC001638207145 1172004367 /nfs/dbraw/zinc/00/43/67/1172004367.db2.gz GAWDUSTZOCPLJQ-AXTRIDKLSA-N 1 2 247.342 2.346 20 0 BEADLO Cc1[nH]c([C@H]2CCCN2C(=O)[C@H]2C[C@@H]2C)[nH+]c1C ZINC001638207146 1172004438 /nfs/dbraw/zinc/00/44/38/1172004438.db2.gz GAWDUSTZOCPLJQ-KPXOXKRLSA-N 1 2 247.342 2.346 20 0 BEADLO C[C@H]1CC[C@H](C)[NH+]1Cc1nc(C(F)F)no1 ZINC000335603313 136235764 /nfs/dbraw/zinc/23/57/64/136235764.db2.gz GTIDKSUFWFXXTC-BQBZGAKWSA-N 1 2 231.246 2.380 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1ccc2[nH]ccc2c1 ZINC000600153822 342691812 /nfs/dbraw/zinc/69/18/12/342691812.db2.gz QFSRZEHEBDCYAX-SNVBAGLBSA-N 1 2 246.310 2.161 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1ccc2[nH]ccc2c1 ZINC000600153822 342691814 /nfs/dbraw/zinc/69/18/14/342691814.db2.gz QFSRZEHEBDCYAX-SNVBAGLBSA-N 1 2 246.310 2.161 20 0 BEADLO CCc1ccc(C[NH2+]CC(F)(F)CO)s1 ZINC000231776248 342693137 /nfs/dbraw/zinc/69/31/37/342693137.db2.gz UROKRSIZMLTSKI-UHFFFAOYSA-N 1 2 235.299 2.028 20 0 BEADLO C[C@@H](Nc1cnn(CC2CC2)c1)c1[nH+]ccn1C ZINC000183420193 538967064 /nfs/dbraw/zinc/96/70/64/538967064.db2.gz OOPONKUASWGMSZ-SNVBAGLBSA-N 1 2 245.330 2.200 20 0 BEADLO Cc1cc[nH+]cc1CCCNc1c[nH]cn1 ZINC000309618422 342753221 /nfs/dbraw/zinc/75/32/21/342753221.db2.gz CLJJWTIFDWPTJR-UHFFFAOYSA-N 1 2 216.288 2.158 20 0 BEADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1cncnc1 ZINC000183730881 538967332 /nfs/dbraw/zinc/96/73/32/538967332.db2.gz SMGQDKWRFMRJBP-NSHDSACASA-N 1 2 228.299 2.065 20 0 BEADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1cncnc1 ZINC000183730881 538967334 /nfs/dbraw/zinc/96/73/34/538967334.db2.gz SMGQDKWRFMRJBP-NSHDSACASA-N 1 2 228.299 2.065 20 0 BEADLO C[C@H](c1cccnc1)[N@H+](C)Cc1cncnc1 ZINC000183730900 538967792 /nfs/dbraw/zinc/96/77/92/538967792.db2.gz SMGQDKWRFMRJBP-LLVKDONJSA-N 1 2 228.299 2.065 20 0 BEADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1cncnc1 ZINC000183730900 538967793 /nfs/dbraw/zinc/96/77/93/538967793.db2.gz SMGQDKWRFMRJBP-LLVKDONJSA-N 1 2 228.299 2.065 20 0 BEADLO CC(C)(C[NH2+]CC(F)(F)CO)c1ccccc1 ZINC000183888622 538968065 /nfs/dbraw/zinc/96/80/65/538968065.db2.gz IRCIWEMSNADNDV-UHFFFAOYSA-N 1 2 243.297 2.181 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1nccs1 ZINC000126693590 398284862 /nfs/dbraw/zinc/28/48/62/398284862.db2.gz XWSNBIBBOLNTRT-UHFFFAOYSA-N 1 2 208.286 2.334 20 0 BEADLO CC[C@]1(C(C)C)C[C@H]1NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493422279 529390589 /nfs/dbraw/zinc/39/05/89/529390589.db2.gz MNBIHGOGZZOOGB-VYBLIETJSA-N 1 2 247.342 2.364 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+][C@@H]2CCCn3nccc32)o1 ZINC000634581945 342797668 /nfs/dbraw/zinc/79/76/68/342797668.db2.gz HVMAQJYECRFCGS-GHMZBOCLSA-N 1 2 246.314 2.365 20 0 BEADLO CCc1cc(NC[C@H]2CCCC23CC3)nc[nH+]1 ZINC000624756380 342825175 /nfs/dbraw/zinc/82/51/75/342825175.db2.gz ACNDMALMCAHUIC-LLVKDONJSA-N 1 2 231.343 2.453 20 0 BEADLO Cc1nc(NC[C@]2(C)C[C@H]3C[C@H]3C2)cc[nH+]1 ZINC000624657142 342809944 /nfs/dbraw/zinc/80/99/44/342809944.db2.gz JALXMRMGCZFYIN-PTEHBNRSSA-N 1 2 217.316 2.055 20 0 BEADLO C/C=C\CNc1nc(C2CC2)[nH+]c(C)c1OC ZINC000624656706 342810226 /nfs/dbraw/zinc/81/02/26/342810226.db2.gz ZDLMQIUAJWEZHE-PLNGDYQASA-N 1 2 233.315 2.081 20 0 BEADLO Cc1cc(NC[C@@H]2CCCC23CC3)nc[nH+]1 ZINC000624756509 342825310 /nfs/dbraw/zinc/82/53/10/342825310.db2.gz CWWVHXLSAULXRT-NSHDSACASA-N 1 2 217.316 2.199 20 0 BEADLO Cc1ccc(NC(=O)CCc2c[nH+]c[nH]2)c(F)c1 ZINC000188477752 538978965 /nfs/dbraw/zinc/97/89/65/538978965.db2.gz BDNIALPJWRBDTD-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO Cc1ccc(NC(=O)CCc2c[nH]c[nH+]2)c(F)c1 ZINC000188477752 538978966 /nfs/dbraw/zinc/97/89/66/538978966.db2.gz BDNIALPJWRBDTD-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO COc1cccc2c1CN(c1cc[nH+]c(C)n1)C2 ZINC000624672792 342816825 /nfs/dbraw/zinc/81/68/25/342816825.db2.gz ZKNJGTOJERIGLQ-UHFFFAOYSA-N 1 2 241.294 2.314 20 0 BEADLO CCc1cc(N[C@@H]2CO[C@H](C3CC3)C2)nc[nH+]1 ZINC000624673344 342817035 /nfs/dbraw/zinc/81/70/35/342817035.db2.gz HWURIUHKHXTNGZ-RYUDHWBXSA-N 1 2 233.315 2.018 20 0 BEADLO CCc1cc(N[C@H]2CO[C@@H](C3CC3)C2)nc[nH+]1 ZINC000624673345 342817053 /nfs/dbraw/zinc/81/70/53/342817053.db2.gz HWURIUHKHXTNGZ-VXGBXAGGSA-N 1 2 233.315 2.018 20 0 BEADLO CCC(O)(CC)CN(C)c1[nH+]cccc1OC ZINC000624718801 342821857 /nfs/dbraw/zinc/82/18/57/342821857.db2.gz VBIUMBMAMJJLQN-UHFFFAOYSA-N 1 2 238.331 2.078 20 0 BEADLO CC1(c2noc(Cn3cc[nH+]c3)n2)CCCC1 ZINC000624757884 342825793 /nfs/dbraw/zinc/82/57/93/342825793.db2.gz HXVRTLBONKWPPX-UHFFFAOYSA-N 1 2 232.287 2.146 20 0 BEADLO CO[C@H]1C[C@@H](CNc2ccc3ccccc3[nH+]2)C1 ZINC000624755242 342824863 /nfs/dbraw/zinc/82/48/63/342824863.db2.gz VRCRIHVCQQRHGG-BJHJDKERSA-N 1 2 242.322 2.494 20 0 BEADLO CC1(C)CCN(C(=O)[C@@H]2CCCc3[nH+]c[nH]c32)C1 ZINC000336450336 342806506 /nfs/dbraw/zinc/80/65/06/342806506.db2.gz CHMZGAHNTINADE-SNVBAGLBSA-N 1 2 247.342 2.088 20 0 BEADLO CC1(C)CC[C@@H](C[N@@H+]2CCC(F)(F)C2)O1 ZINC000336477540 342807596 /nfs/dbraw/zinc/80/75/96/342807596.db2.gz MSOANYPMLAAJMV-VIFPVBQESA-N 1 2 219.275 2.285 20 0 BEADLO CC1(C)CC[C@@H](C[N@H+]2CCC(F)(F)C2)O1 ZINC000336477540 342807598 /nfs/dbraw/zinc/80/75/98/342807598.db2.gz MSOANYPMLAAJMV-VIFPVBQESA-N 1 2 219.275 2.285 20 0 BEADLO C[C@@H]1C[C@@H]1CNc1cc2cc[nH]c2c[nH+]1 ZINC000380246704 538988147 /nfs/dbraw/zinc/98/81/47/538988147.db2.gz OJBPAJOYVFYDJO-PSASIEDQSA-N 1 2 201.273 2.053 20 0 BEADLO CCc1cc(NCCCCn2cc[nH+]c2)ncn1 ZINC000045108229 538991078 /nfs/dbraw/zinc/99/10/78/538991078.db2.gz SBVPTZYKPDKUFH-UHFFFAOYSA-N 1 2 245.330 2.128 20 0 BEADLO CN(C(=O)CCc1c[nH+]c[nH]1)C1CCCCC1 ZINC000188814581 538979796 /nfs/dbraw/zinc/97/97/96/538979796.db2.gz GFNONYVDHZFWJX-UHFFFAOYSA-N 1 2 235.331 2.133 20 0 BEADLO CN(C(=O)CCc1c[nH]c[nH+]1)C1CCCCC1 ZINC000188814581 538979797 /nfs/dbraw/zinc/97/97/97/538979797.db2.gz GFNONYVDHZFWJX-UHFFFAOYSA-N 1 2 235.331 2.133 20 0 BEADLO FC(F)C[NH+]1CCC([C@H]2CCCO2)CC1 ZINC000189148598 538980953 /nfs/dbraw/zinc/98/09/53/538980953.db2.gz STQMHCVWKZPPEP-SNVBAGLBSA-N 1 2 219.275 2.143 20 0 BEADLO CCc1nn(C)cc1C[NH2+]C(C)(C)C(F)F ZINC000381471673 539001774 /nfs/dbraw/zinc/00/17/74/539001774.db2.gz OVFPOAHAGSRKFR-UHFFFAOYSA-N 1 2 231.290 2.116 20 0 BEADLO CO[C@H](C[NH2+][C@@H](C)c1cn[nH]c1C)C(C)C ZINC000381480443 539001894 /nfs/dbraw/zinc/00/18/94/539001894.db2.gz SMTSFVXBOVVPFU-JOYOIKCWSA-N 1 2 225.336 2.040 20 0 BEADLO Cc1cccc(F)c1NC(=O)CCc1c[nH+]c[nH]1 ZINC000193760592 539007846 /nfs/dbraw/zinc/00/78/46/539007846.db2.gz ZLICOEZGWBBGKT-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO Cc1cccc(F)c1NC(=O)CCc1c[nH]c[nH+]1 ZINC000193760592 539007847 /nfs/dbraw/zinc/00/78/47/539007847.db2.gz ZLICOEZGWBBGKT-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO CCC(CC)[C@@H](C)C(=O)N1CCn2c[nH+]cc2C1 ZINC000358158575 168398849 /nfs/dbraw/zinc/39/88/49/168398849.db2.gz AWHAQSJJMRKYCH-LLVKDONJSA-N 1 2 249.358 2.298 20 0 BEADLO CC(C)[C@H](NC(=O)[C@@H]1C[C@H]2C[C@H]2C1)c1[nH]cc[nH+]1 ZINC000640724858 361963072 /nfs/dbraw/zinc/96/30/72/361963072.db2.gz WKQNXQPXLACOGN-USZNOCQGSA-N 1 2 247.342 2.269 20 0 BEADLO CC(C)[C@H](NC(=O)[C@H]1CC12CC2)c1[nH]cc[nH+]1 ZINC000640724697 361963139 /nfs/dbraw/zinc/96/31/39/361963139.db2.gz SEUOEKTZDZVYNQ-ZJUUUORDSA-N 1 2 233.315 2.023 20 0 BEADLO CC(C)[C@H](NC(=O)C1CC2(CC2)C1)c1[nH]cc[nH+]1 ZINC000640724911 361963339 /nfs/dbraw/zinc/96/33/39/361963339.db2.gz YTJVDYKTYXDQGU-NSHDSACASA-N 1 2 247.342 2.413 20 0 BEADLO C[C@@H](C[N@@H+]1CCC(=O)C1)c1ccccc1 ZINC000127085155 342839268 /nfs/dbraw/zinc/83/92/68/342839268.db2.gz WSBWRSXBQLAGIV-NSHDSACASA-N 1 2 203.285 2.065 20 0 BEADLO C[C@@H](C[N@H+]1CCC(=O)C1)c1ccccc1 ZINC000127085155 342839269 /nfs/dbraw/zinc/83/92/69/342839269.db2.gz WSBWRSXBQLAGIV-NSHDSACASA-N 1 2 203.285 2.065 20 0 BEADLO Cc1cc(NC(=O)CCc2c[nH+]c[nH]2)cs1 ZINC000634423997 361946000 /nfs/dbraw/zinc/94/60/00/361946000.db2.gz ICNTUCQGLNZYDH-UHFFFAOYSA-N 1 2 235.312 2.351 20 0 BEADLO Cc1cc(NC(=O)CCc2c[nH]c[nH+]2)cs1 ZINC000634423997 361946005 /nfs/dbraw/zinc/94/60/05/361946005.db2.gz ICNTUCQGLNZYDH-UHFFFAOYSA-N 1 2 235.312 2.351 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2c(C)noc2C)on1 ZINC000383856688 539012604 /nfs/dbraw/zinc/01/26/04/539012604.db2.gz BXSDVEQHBIVRLJ-MRVPVSSYSA-N 1 2 235.287 2.439 20 0 BEADLO c1nc(C[NH2+]Cc2cnc(C3CC3)s2)co1 ZINC000381250091 538997063 /nfs/dbraw/zinc/99/70/63/538997063.db2.gz PDAVLOGTAWGKQX-UHFFFAOYSA-N 1 2 235.312 2.298 20 0 BEADLO COc1ccc(C[NH2+]C(C)(C)C(F)F)cn1 ZINC000381408469 539000289 /nfs/dbraw/zinc/00/02/89/539000289.db2.gz TUSIELGRIJVLHB-UHFFFAOYSA-N 1 2 230.258 2.224 20 0 BEADLO CC(C)(C)c1nc(N[C@@H]2CCSC2)cc[nH+]1 ZINC000390259543 539020816 /nfs/dbraw/zinc/02/08/16/539020816.db2.gz NJBPTHZJBNWVNS-SECBINFHSA-N 1 2 237.372 2.113 20 0 BEADLO CC(C)(C)c1nc(N[C@@H]2CC2(C)C)cc[nH+]1 ZINC000390259966 539021038 /nfs/dbraw/zinc/02/10/38/539021038.db2.gz NLXCAJXVIUJEJR-SECBINFHSA-N 1 2 219.332 2.406 20 0 BEADLO CCc1cc(N[C@H](C)[C@H]2CCCOC2)nc[nH+]1 ZINC000388898157 539015746 /nfs/dbraw/zinc/01/57/46/539015746.db2.gz MDCLDOWRCYBHDO-MNOVXSKESA-N 1 2 235.331 2.266 20 0 BEADLO Cc1cc(C[NH2+]Cc2ncc(Cl)s2)[nH]n1 ZINC000389860427 539018139 /nfs/dbraw/zinc/01/81/39/539018139.db2.gz DDQQZVMENZYIJO-UHFFFAOYSA-N 1 2 242.735 2.118 20 0 BEADLO FC[C@@H]1C[N@H+](Cc2ccc(Cl)o2)CCCO1 ZINC000335644888 136243165 /nfs/dbraw/zinc/24/31/65/136243165.db2.gz XGCQTNZOEBJJTC-SNVBAGLBSA-N 1 2 247.697 2.493 20 0 BEADLO FC[C@@H]1C[N@@H+](Cc2ccc(Cl)o2)CCCO1 ZINC000335644888 136243166 /nfs/dbraw/zinc/24/31/66/136243166.db2.gz XGCQTNZOEBJJTC-SNVBAGLBSA-N 1 2 247.697 2.493 20 0 BEADLO Oc1ccc(Cl)c(C[N@@H+]2CCCOCC2)c1 ZINC000625116169 342873687 /nfs/dbraw/zinc/87/36/87/342873687.db2.gz FCDZNQUMHYANKZ-UHFFFAOYSA-N 1 2 241.718 2.268 20 0 BEADLO Oc1ccc(Cl)c(C[N@H+]2CCCOCC2)c1 ZINC000625116169 342873688 /nfs/dbraw/zinc/87/36/88/342873688.db2.gz FCDZNQUMHYANKZ-UHFFFAOYSA-N 1 2 241.718 2.268 20 0 BEADLO CCCC1(CNc2nc[nH+]c(N)c2OC)CC1 ZINC000233061912 342895019 /nfs/dbraw/zinc/89/50/19/342895019.db2.gz HJDFPSVXQSVWKO-UHFFFAOYSA-N 1 2 236.319 2.060 20 0 BEADLO CCCC1(CNc2[nH+]cnc(N)c2OC)CC1 ZINC000233061912 342895021 /nfs/dbraw/zinc/89/50/21/342895021.db2.gz HJDFPSVXQSVWKO-UHFFFAOYSA-N 1 2 236.319 2.060 20 0 BEADLO CCc1[nH+]c(C)ccc1OCc1ccn(C)n1 ZINC000352563030 398321407 /nfs/dbraw/zinc/32/14/07/398321407.db2.gz PHPLQQJDKGEDCC-UHFFFAOYSA-N 1 2 231.299 2.265 20 0 BEADLO CCc1cc(NC[C@H](OC)C(C)C)nc[nH+]1 ZINC000075062693 342881649 /nfs/dbraw/zinc/88/16/49/342881649.db2.gz VDNIFNYQDNARAN-NSHDSACASA-N 1 2 223.320 2.122 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)NC3CC(C)C3)ccn12 ZINC000584003347 342900087 /nfs/dbraw/zinc/90/00/87/342900087.db2.gz BSPSXPKXCYBVSZ-UHFFFAOYSA-N 1 2 243.310 2.171 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](Cc1cncnc1)C2 ZINC000336085292 398314998 /nfs/dbraw/zinc/31/49/98/398314998.db2.gz JXWAWKVBZNEPNI-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](Cc1cncnc1)C2 ZINC000336085292 398315001 /nfs/dbraw/zinc/31/50/01/398315001.db2.gz JXWAWKVBZNEPNI-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO CC1(C)C[C@@H]1CNc1nc[nH+]c(N)c1Cl ZINC000232981181 342892347 /nfs/dbraw/zinc/89/23/47/342892347.db2.gz MFXZJDKWEZANDY-ZCFIWIBFSA-N 1 2 226.711 2.170 20 0 BEADLO CC1(C)C[C@@H]1CNc1[nH+]cnc(N)c1Cl ZINC000232981181 342892348 /nfs/dbraw/zinc/89/23/48/342892348.db2.gz MFXZJDKWEZANDY-ZCFIWIBFSA-N 1 2 226.711 2.170 20 0 BEADLO CC[C@@H]([NH2+]CCc1ccc(C)cc1C)C(=O)OC ZINC000192841041 398323896 /nfs/dbraw/zinc/32/38/96/398323896.db2.gz INSJFRAGCUJFNA-CQSZACIVSA-N 1 2 249.354 2.387 20 0 BEADLO CCCCc1cc(N[C@H](CC)[C@@H](C)O)nc[nH+]1 ZINC000631291951 342903299 /nfs/dbraw/zinc/90/32/99/342903299.db2.gz DEYNJVFBXAQWLC-ZYHUDNBSSA-N 1 2 237.347 2.391 20 0 BEADLO CCCCc1cc(N[C@@H](CC)[C@H](C)O)nc[nH+]1 ZINC000631291949 342903348 /nfs/dbraw/zinc/90/33/48/342903348.db2.gz DEYNJVFBXAQWLC-JQWIXIFHSA-N 1 2 237.347 2.391 20 0 BEADLO COc1ccc(C[NH2+][C@H](C)c2ccon2)cc1O ZINC000351572272 136247161 /nfs/dbraw/zinc/24/71/61/136247161.db2.gz CMMQOYUOSNOQGF-SECBINFHSA-N 1 2 248.282 2.240 20 0 BEADLO c1cc(C[NH2+][C@H](c2cccnc2)C2CC2)no1 ZINC000351599400 136247399 /nfs/dbraw/zinc/24/73/99/136247399.db2.gz XTLZRGWZVZELQY-ZDUSSCGKSA-N 1 2 229.283 2.311 20 0 BEADLO C[C@H]1C[C@@H](Nc2cnn(CCF)c2)c2[nH+]ccn21 ZINC000624127937 346875490 /nfs/dbraw/zinc/87/54/90/346875490.db2.gz VWCSFBXGHASIFL-GXSJLCMTSA-N 1 2 249.293 2.167 20 0 BEADLO CCc1ccc(C[NH2+]Cc2ncccn2)cc1 ZINC000234198729 342917541 /nfs/dbraw/zinc/91/75/41/342917541.db2.gz OVUYWITZNISODM-UHFFFAOYSA-N 1 2 227.311 2.329 20 0 BEADLO CC(C)C(C)(C)NC(=O)CCCn1cc[nH+]c1 ZINC000590243751 346877131 /nfs/dbraw/zinc/87/71/31/346877131.db2.gz CWAHOTLEHCFCSI-UHFFFAOYSA-N 1 2 237.347 2.214 20 0 BEADLO CCc1c[nH]c(Sc2[nH+]cnc3[nH]ccc32)n1 ZINC000354410124 398329324 /nfs/dbraw/zinc/32/93/24/398329324.db2.gz XIMHDBLIGDBKKA-UHFFFAOYSA-N 1 2 245.311 2.395 20 0 BEADLO CCc1[nH]ccc1C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000354764539 398329667 /nfs/dbraw/zinc/32/96/67/398329667.db2.gz DQWBILGEOLYMOD-NSHDSACASA-N 1 2 246.314 2.181 20 0 BEADLO CC[C@@H]1C[C@H]1CNC(=O)/C=C/c1[nH+]ccn1CC ZINC000493424348 529452678 /nfs/dbraw/zinc/45/26/78/529452678.db2.gz DQTOAWFTHPOJDX-AIIUZBJTSA-N 1 2 247.342 2.079 20 0 BEADLO Cc1ccc(NC(=O)C2CCC2)c(C)[nH+]1 ZINC000119296073 398336187 /nfs/dbraw/zinc/33/61/87/398336187.db2.gz RHVUTVYOKOOQFL-UHFFFAOYSA-N 1 2 204.273 2.437 20 0 BEADLO C[C@H]1CC[C@H](CC(=O)N2CCc3[nH]c[nH+]c3C2)C1 ZINC000627368886 346889585 /nfs/dbraw/zinc/88/95/85/346889585.db2.gz FOIDQTKIFWJZFY-QWRGUYRKSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@H]1CC[C@H](CC(=O)N2CCc3[nH+]c[nH]c3C2)C1 ZINC000627368886 346889586 /nfs/dbraw/zinc/88/95/86/346889586.db2.gz FOIDQTKIFWJZFY-QWRGUYRKSA-N 1 2 247.342 2.121 20 0 BEADLO CC[C@H](NC(=O)C=Cc1c[nH]c[nH+]1)[C@H]1CC1(C)C ZINC000493449702 529457622 /nfs/dbraw/zinc/45/76/22/529457622.db2.gz IIDYMPZFTMUVKH-DUVUQDDDSA-N 1 2 247.342 2.364 20 0 BEADLO CC[C@H](NC(=O)/C=C\c1[nH]cc[nH+]1)[C@H]1CC1(C)C ZINC000493466187 529457696 /nfs/dbraw/zinc/45/76/96/529457696.db2.gz NBUAFJFMCNIYIY-MXFLAHGMSA-N 1 2 247.342 2.364 20 0 BEADLO CC[C@@H]([NH2+]Cc1cnc(C)nc1)c1nccs1 ZINC000351728876 136250102 /nfs/dbraw/zinc/25/01/02/136250102.db2.gz IQEHLPNETDSMJS-LLVKDONJSA-N 1 2 248.355 2.482 20 0 BEADLO CCOc1cccc(C[NH2+]CC(F)F)c1 ZINC000037755942 342951809 /nfs/dbraw/zinc/95/18/09/342951809.db2.gz JARHNUITBUQEHB-UHFFFAOYSA-N 1 2 215.243 2.440 20 0 BEADLO C[N@H+](Cc1ncc(C2CC2)o1)[C@@H]1CCCOC1 ZINC000351814408 136254624 /nfs/dbraw/zinc/25/46/24/136254624.db2.gz TVMGYSKORGIQMW-LLVKDONJSA-N 1 2 236.315 2.163 20 0 BEADLO C[N@@H+](Cc1ncc(C2CC2)o1)[C@@H]1CCCOC1 ZINC000351814408 136254625 /nfs/dbraw/zinc/25/46/25/136254625.db2.gz TVMGYSKORGIQMW-LLVKDONJSA-N 1 2 236.315 2.163 20 0 BEADLO CC[C@@H]([NH2+][C@H]1CCOC1=O)c1ccccc1 ZINC000019876278 342960368 /nfs/dbraw/zinc/96/03/68/342960368.db2.gz VOTZOMCBZGJFFD-NEPJUHHUSA-N 1 2 219.284 2.043 20 0 BEADLO CC(C)(O)[C@@H]1CCCN1c1cc[nH+]c(C2CC2)n1 ZINC000301969251 187207444 /nfs/dbraw/zinc/20/74/44/187207444.db2.gz BHWHXFHJKJFHTN-NSHDSACASA-N 1 2 247.342 2.094 20 0 BEADLO Cc1cc(N[C@@H]2CCCOC2)nc(C(C)C)[nH+]1 ZINC000109548284 187208500 /nfs/dbraw/zinc/20/85/00/187208500.db2.gz CNGPLMVYAMAFEP-LLVKDONJSA-N 1 2 235.331 2.499 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N(C)CC(C)(C)C ZINC000492543090 529556930 /nfs/dbraw/zinc/55/69/30/529556930.db2.gz ZWPIQZIHGIURNJ-FPLPWBNLSA-N 1 2 249.358 2.421 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)NCCCC1CC1 ZINC000492494628 529558634 /nfs/dbraw/zinc/55/86/34/529558634.db2.gz RJJLHMABGBUTNB-FPLPWBNLSA-N 1 2 247.342 2.223 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)NCCC=C(C)C ZINC000493457016 529558976 /nfs/dbraw/zinc/55/89/76/529558976.db2.gz JDUWMFLBASYKLJ-FPLPWBNLSA-N 1 2 247.342 2.389 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N(C)[C@@H]1CC1(C)C ZINC000492998051 529549745 /nfs/dbraw/zinc/54/97/45/529549745.db2.gz OOZNSPZTNWGDQO-XUIVZRPNSA-N 1 2 247.342 2.173 20 0 BEADLO CS[C@H]1CC[C@@H]1Nc1c[nH+]cc(N(C)C)c1 ZINC000602726016 349715285 /nfs/dbraw/zinc/71/52/85/349715285.db2.gz UIQGZKGFNFVXCA-RYUDHWBXSA-N 1 2 237.372 2.454 20 0 BEADLO CCn1cc[nH+]c1CN(C)[C@H](C)c1cccnc1 ZINC000162468362 349715743 /nfs/dbraw/zinc/71/57/43/349715743.db2.gz UIYYTSTWIMHWPJ-GFCCVEGCSA-N 1 2 244.342 2.491 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCC[C@H]1CC(=O)OC ZINC000602798417 349740020 /nfs/dbraw/zinc/74/00/20/349740020.db2.gz QECVDNMEMCPOJN-VIFPVBQESA-N 1 2 235.274 2.059 20 0 BEADLO CCC(F)(F)C[N@H+]1CCC[C@H]1CC(=O)OC ZINC000602798417 349740023 /nfs/dbraw/zinc/74/00/23/349740023.db2.gz QECVDNMEMCPOJN-VIFPVBQESA-N 1 2 235.274 2.059 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCC[C@@H]1CC(=O)OC ZINC000602798414 349740140 /nfs/dbraw/zinc/74/01/40/349740140.db2.gz QECVDNMEMCPOJN-SECBINFHSA-N 1 2 235.274 2.059 20 0 BEADLO CCC(F)(F)C[N@H+]1CCC[C@@H]1CC(=O)OC ZINC000602798414 349740142 /nfs/dbraw/zinc/74/01/42/349740142.db2.gz QECVDNMEMCPOJN-SECBINFHSA-N 1 2 235.274 2.059 20 0 BEADLO CCOc1ccc([NH2+]C(C)C)cc1CO ZINC000037901525 342999930 /nfs/dbraw/zinc/99/99/30/342999930.db2.gz VGDFCNYSAWPISV-UHFFFAOYSA-N 1 2 209.289 2.398 20 0 BEADLO CCC(F)(F)C[N@H+](C[C@H](C)C(=O)OC)C1CC1 ZINC000602772112 349725932 /nfs/dbraw/zinc/72/59/32/349725932.db2.gz PGOSXGXGYLSNFQ-VIFPVBQESA-N 1 2 249.301 2.305 20 0 BEADLO CCC(F)(F)C[N@@H+](C[C@H](C)C(=O)OC)C1CC1 ZINC000602772112 349725934 /nfs/dbraw/zinc/72/59/34/349725934.db2.gz PGOSXGXGYLSNFQ-VIFPVBQESA-N 1 2 249.301 2.305 20 0 BEADLO C[C@@H]1CC[N@H+](CC2=CCCOC2)CC1(F)F ZINC000335902517 136259837 /nfs/dbraw/zinc/25/98/37/136259837.db2.gz AYXDXANPDPCYHA-SNVBAGLBSA-N 1 2 231.286 2.310 20 0 BEADLO C[C@@H]1CC[N@@H+](CC2=CCCOC2)CC1(F)F ZINC000335902517 136259838 /nfs/dbraw/zinc/25/98/38/136259838.db2.gz AYXDXANPDPCYHA-SNVBAGLBSA-N 1 2 231.286 2.310 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+]1Cc2ccc(C)cc2C1 ZINC000361599910 187217919 /nfs/dbraw/zinc/21/79/19/187217919.db2.gz FGWWKHOWIYNKHJ-LLVKDONJSA-N 1 2 233.311 2.262 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+]1Cc2ccc(C)cc2C1 ZINC000361599910 187217922 /nfs/dbraw/zinc/21/79/22/187217922.db2.gz FGWWKHOWIYNKHJ-LLVKDONJSA-N 1 2 233.311 2.262 20 0 BEADLO CC(C)C[C@H](C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000361212052 187218597 /nfs/dbraw/zinc/21/85/97/187218597.db2.gz SBIOZTADAYIEAS-JTQLQIEISA-N 1 2 223.320 2.050 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)c1ncc(Cl)cc1F ZINC000336111148 136263512 /nfs/dbraw/zinc/26/35/12/136263512.db2.gz DKSNNONJVFYGNV-UHFFFAOYSA-N 1 2 240.669 2.234 20 0 BEADLO CC(C)(C)OC(=O)[C@@H](C1CC1)[N@@H+]1CC[C@@H](F)C1 ZINC000602841584 349779479 /nfs/dbraw/zinc/77/94/79/349779479.db2.gz OLCPFERDQDZZJI-GHMZBOCLSA-N 1 2 243.322 2.151 20 0 BEADLO CC(C)(C)OC(=O)[C@@H](C1CC1)[N@H+]1CC[C@@H](F)C1 ZINC000602841584 349779480 /nfs/dbraw/zinc/77/94/80/349779480.db2.gz OLCPFERDQDZZJI-GHMZBOCLSA-N 1 2 243.322 2.151 20 0 BEADLO CCCCC(=O)NCc1cn2ccccc2[nH+]1 ZINC000022024418 343036408 /nfs/dbraw/zinc/03/64/08/343036408.db2.gz QNVXXTUYMYGLEV-UHFFFAOYSA-N 1 2 231.299 2.141 20 0 BEADLO C[C@@H]1C[NH+](CC(F)F)C[C@@H](C)C1(F)F ZINC000625647435 344024954 /nfs/dbraw/zinc/02/49/54/344024954.db2.gz DXZZEZRBWVSLRS-RNFRBKRXSA-N 1 2 213.218 2.475 20 0 BEADLO C[C@H]1C[NH+](Cc2cnc[nH]2)C[C@H](C)C1(F)F ZINC000625656003 344025623 /nfs/dbraw/zinc/02/56/23/344025623.db2.gz YKXNODSSSLEMOC-IUCAKERBSA-N 1 2 229.274 2.133 20 0 BEADLO Cc1ccc2[nH+]c(CNc3ncccn3)cn2c1 ZINC000048625755 343048957 /nfs/dbraw/zinc/04/89/57/343048957.db2.gz DBKVESSSIZWKNA-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO Cc1ccc2[nH+]c(CNC(=O)C3CCC3)cn2c1 ZINC000048747820 343056572 /nfs/dbraw/zinc/05/65/72/343056572.db2.gz HYZPAQJRMNDIPK-UHFFFAOYSA-N 1 2 243.310 2.059 20 0 BEADLO Cc1ccc2nc(C[NH+]3CCSCC3)cn2c1 ZINC000051914748 136271844 /nfs/dbraw/zinc/27/18/44/136271844.db2.gz OXVWMHHLGOTWEH-UHFFFAOYSA-N 1 2 247.367 2.192 20 0 BEADLO C[C@@H](C(=O)NCCCCn1cc[nH+]c1)C1CCC1 ZINC000576920217 365721018 /nfs/dbraw/zinc/72/10/18/365721018.db2.gz PQWAADSEQFYWPS-GFCCVEGCSA-N 1 2 249.358 2.216 20 0 BEADLO CC(C)CNC(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000030513280 343177411 /nfs/dbraw/zinc/17/74/11/343177411.db2.gz QURDBFKBWDDQKT-UHFFFAOYSA-N 1 2 243.310 2.258 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1nc(C)c(C)s1 ZINC000176374153 365725317 /nfs/dbraw/zinc/72/53/17/365725317.db2.gz HMEUHAMFKPPVIR-LLVKDONJSA-N 1 2 240.372 2.371 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1nc(C)c(C)s1 ZINC000176374153 365725325 /nfs/dbraw/zinc/72/53/25/365725325.db2.gz HMEUHAMFKPPVIR-LLVKDONJSA-N 1 2 240.372 2.371 20 0 BEADLO Cc1ccccc1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000141081021 343197603 /nfs/dbraw/zinc/19/76/03/343197603.db2.gz YRLKBNLALBBZRP-SNVBAGLBSA-N 1 2 229.283 2.209 20 0 BEADLO O=C(CCn1cc[nH+]c1)N1CCCCCCC1 ZINC000032720223 343241261 /nfs/dbraw/zinc/24/12/61/343241261.db2.gz VNMHWYGGHRLOOW-UHFFFAOYSA-N 1 2 235.331 2.066 20 0 BEADLO COC(=O)C[NH2+][C@@H](c1ccccc1)C(C)C ZINC000035037919 343283719 /nfs/dbraw/zinc/28/37/19/343283719.db2.gz WDBUGXGXSOHRCS-CYBMUJFWSA-N 1 2 221.300 2.146 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2ccn(C)n2)o1 ZINC000020351318 343268484 /nfs/dbraw/zinc/26/84/84/343268484.db2.gz VAUCGWPTCHZFGB-SNVBAGLBSA-N 1 2 219.288 2.172 20 0 BEADLO CCOc1ccc(NCc2[nH+]ccn2C)cc1 ZINC000036804449 343324693 /nfs/dbraw/zinc/32/46/93/343324693.db2.gz BVELCOKEPZNKNT-UHFFFAOYSA-N 1 2 231.299 2.431 20 0 BEADLO FC(F)n1ccnc1C[NH2+]Cc1ccco1 ZINC000036804913 343324754 /nfs/dbraw/zinc/32/47/54/343324754.db2.gz JEVBYAYTWWSBJF-UHFFFAOYSA-N 1 2 227.214 2.161 20 0 BEADLO COC(=O)[C@@H]([NH2+]CC(C)C)c1ccccc1 ZINC000037853376 343357459 /nfs/dbraw/zinc/35/74/59/343357459.db2.gz OCODRJUJZGYQEW-LBPRGKRZSA-N 1 2 221.300 2.146 20 0 BEADLO COCc1cccc(C[NH2+]Cc2cn[nH]c2C)c1 ZINC000038010691 343365137 /nfs/dbraw/zinc/36/51/37/343365137.db2.gz UAJOTDIOJQNUDA-UHFFFAOYSA-N 1 2 245.326 2.154 20 0 BEADLO CC(=O)NCCNc1[nH+]c2ccccc2cc1C ZINC000038805164 343379528 /nfs/dbraw/zinc/37/95/28/343379528.db2.gz UFNZIXHVFHOTHJ-UHFFFAOYSA-N 1 2 243.310 2.091 20 0 BEADLO COC(=O)[C@H](C)[NH2+]Cc1cc(C)c(C)cc1C ZINC000037303177 343343181 /nfs/dbraw/zinc/34/31/81/343343181.db2.gz NEOJOVHJCMETPY-LBPRGKRZSA-N 1 2 235.327 2.263 20 0 BEADLO COC(=O)C(C)(C)[NH2+][C@@H]1CCc2ccccc2C1 ZINC000037304467 343343185 /nfs/dbraw/zinc/34/31/85/343343185.db2.gz IRNYLBDPRFYYBZ-CYBMUJFWSA-N 1 2 247.338 2.085 20 0 BEADLO Cc1nc(N(C)Cc2ccoc2)cc[nH+]1 ZINC000335674952 136318068 /nfs/dbraw/zinc/31/80/68/136318068.db2.gz JUPAYKHTRHHKDR-UHFFFAOYSA-N 1 2 203.245 2.014 20 0 BEADLO Cc1cc[nH+]cc1Cn1cc(C(C)(C)C)nn1 ZINC000641070445 362179407 /nfs/dbraw/zinc/17/94/07/362179407.db2.gz FKRBRKDQTGFUKZ-UHFFFAOYSA-N 1 2 230.315 2.327 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3ccc(O)cc3C2)no1 ZINC000335676622 136318605 /nfs/dbraw/zinc/31/86/05/136318605.db2.gz XQZOWQITZCIRPH-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO Cc1cc(C[N@H+]2CCc3ccc(O)cc3C2)no1 ZINC000335676622 136318606 /nfs/dbraw/zinc/31/86/06/136318606.db2.gz XQZOWQITZCIRPH-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO Cc1nc(C[N@@H+]2CCO[C@H]3CCC[C@H]32)oc1C ZINC000335669411 136312491 /nfs/dbraw/zinc/31/24/91/136312491.db2.gz ZHJBXYHIBJYMRW-NEPJUHHUSA-N 1 2 236.315 2.045 20 0 BEADLO Cc1nc(C[N@H+]2CCO[C@H]3CCC[C@H]32)oc1C ZINC000335669411 136312492 /nfs/dbraw/zinc/31/24/92/136312492.db2.gz ZHJBXYHIBJYMRW-NEPJUHHUSA-N 1 2 236.315 2.045 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1cccnc1C ZINC000335670782 136312908 /nfs/dbraw/zinc/31/29/08/136312908.db2.gz HZPHGYGAJMCRHJ-UHFFFAOYSA-N 1 2 241.294 2.022 20 0 BEADLO COC[C@H](C)CNc1cc[nH+]c(C(C)C)n1 ZINC000171865417 259358498 /nfs/dbraw/zinc/35/84/98/259358498.db2.gz GUXSGXMGCGTJCN-SNVBAGLBSA-N 1 2 223.320 2.294 20 0 BEADLO Cc1noc(-c2ccc(Cn3cc[nH+]c3)cc2)n1 ZINC000113742024 136321518 /nfs/dbraw/zinc/32/15/18/136321518.db2.gz RWIABQNDRSMDBS-UHFFFAOYSA-N 1 2 240.266 2.290 20 0 BEADLO C/C=C(\CC)C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000276628717 187338626 /nfs/dbraw/zinc/33/86/26/187338626.db2.gz NTAOREHECJJYAV-KGVSQERTSA-N 1 2 247.342 2.403 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cccc(C)n2)CCO1 ZINC000335697321 136327448 /nfs/dbraw/zinc/32/74/48/136327448.db2.gz GPKUZQZZJUEKTH-CYBMUJFWSA-N 1 2 220.316 2.001 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cccc(C)n2)CCO1 ZINC000335697321 136327449 /nfs/dbraw/zinc/32/74/49/136327449.db2.gz GPKUZQZZJUEKTH-CYBMUJFWSA-N 1 2 220.316 2.001 20 0 BEADLO CC(C)(C)C[NH2+]c1ccc(OCC(N)=O)cc1 ZINC000041120472 343415610 /nfs/dbraw/zinc/41/56/10/343415610.db2.gz WSEMCRPJFJKYLK-UHFFFAOYSA-N 1 2 236.315 2.009 20 0 BEADLO CCOC(=O)C[N@@H+]1CCCc2sccc2C1 ZINC000609338467 343419684 /nfs/dbraw/zinc/41/96/84/343419684.db2.gz JVDHVZFNDHHOQF-UHFFFAOYSA-N 1 2 239.340 2.059 20 0 BEADLO CCOC(=O)C[N@H+]1CCCc2sccc2C1 ZINC000609338467 343419687 /nfs/dbraw/zinc/41/96/87/343419687.db2.gz JVDHVZFNDHHOQF-UHFFFAOYSA-N 1 2 239.340 2.059 20 0 BEADLO C[C@@H]1CC[N@H+](CCC(C)(C)O)CC1(F)F ZINC000335724840 136347065 /nfs/dbraw/zinc/34/70/65/136347065.db2.gz DGFZHEYAYUZVBX-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO C[C@@H]1CC[N@@H+](CCC(C)(C)O)CC1(F)F ZINC000335724840 136347066 /nfs/dbraw/zinc/34/70/66/136347066.db2.gz DGFZHEYAYUZVBX-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO OC[C@H]1CCCC[N@@H+]1Cc1ncc(Cl)s1 ZINC000335737679 136351032 /nfs/dbraw/zinc/35/10/32/136351032.db2.gz QEJGISRPARGKSE-MRVPVSSYSA-N 1 2 246.763 2.143 20 0 BEADLO OC[C@H]1CCCC[N@H+]1Cc1ncc(Cl)s1 ZINC000335737679 136351033 /nfs/dbraw/zinc/35/10/33/136351033.db2.gz QEJGISRPARGKSE-MRVPVSSYSA-N 1 2 246.763 2.143 20 0 BEADLO C/C=C\c1cn(Cc2cc[nH+]c(C)c2)nn1 ZINC000641088345 362211867 /nfs/dbraw/zinc/21/18/67/362211867.db2.gz HCYAUFSYJCJDMI-ARJAWSKDSA-N 1 2 214.272 2.063 20 0 BEADLO CC(C)(O)C[N@@H+]1CCn2c(cc3ccccc32)C1 ZINC000335714328 136338851 /nfs/dbraw/zinc/33/88/51/136338851.db2.gz SRWBAXVFTQFZSL-UHFFFAOYSA-N 1 2 244.338 2.228 20 0 BEADLO CC(C)(O)C[N@H+]1CCn2c(cc3ccccc32)C1 ZINC000335714328 136338852 /nfs/dbraw/zinc/33/88/52/136338852.db2.gz SRWBAXVFTQFZSL-UHFFFAOYSA-N 1 2 244.338 2.228 20 0 BEADLO CC[C@@H]([NH2+][C@H](C)C(=O)OC)c1ccccc1 ZINC000042304446 343434477 /nfs/dbraw/zinc/43/44/77/343434477.db2.gz SFJGDLZNFIQLDR-ZYHUDNBSSA-N 1 2 221.300 2.289 20 0 BEADLO CC[C@H]([NH2+][C@H](C)C(=O)OC)c1ccccc1 ZINC000042304443 343434505 /nfs/dbraw/zinc/43/45/05/343434505.db2.gz SFJGDLZNFIQLDR-PWSUYJOCSA-N 1 2 221.300 2.289 20 0 BEADLO Cc1cnc(C[N@H+]2CCS[C@@H](C)[C@H]2C)nc1 ZINC000335718371 136340438 /nfs/dbraw/zinc/34/04/38/136340438.db2.gz KECGXWRVDZEOQQ-MNOVXSKESA-N 1 2 237.372 2.111 20 0 BEADLO Cc1cnc(C[N@@H+]2CCS[C@@H](C)[C@H]2C)nc1 ZINC000335718371 136340439 /nfs/dbraw/zinc/34/04/39/136340439.db2.gz KECGXWRVDZEOQQ-MNOVXSKESA-N 1 2 237.372 2.111 20 0 BEADLO CC1=CCCN(c2[nH+]c(C)nc3[nH]ccc32)C1 ZINC000335850591 136355571 /nfs/dbraw/zinc/35/55/71/136355571.db2.gz NYCOLLLWQHBOEI-UHFFFAOYSA-N 1 2 228.299 2.423 20 0 BEADLO C[C@H]1CCC[N@@H+]1Cc1cc(C(F)(F)F)n[nH]1 ZINC000335879810 136357103 /nfs/dbraw/zinc/35/71/03/136357103.db2.gz VQGDPEFBYHDEPD-ZETCQYMHSA-N 1 2 233.237 2.413 20 0 BEADLO C[C@H]1CCC[N@H+]1Cc1cc(C(F)(F)F)n[nH]1 ZINC000335879810 136357104 /nfs/dbraw/zinc/35/71/04/136357104.db2.gz VQGDPEFBYHDEPD-ZETCQYMHSA-N 1 2 233.237 2.413 20 0 BEADLO CC(C)(C)OC1CC(Nc2c[nH]c[nH+]2)C1 ZINC000308918099 346940601 /nfs/dbraw/zinc/94/06/01/346940601.db2.gz BQVGSUBYROJLEG-UHFFFAOYSA-N 1 2 209.293 2.168 20 0 BEADLO C[C@H](Cc1cnn(C)c1)[NH2+][C@@H](C)c1cccnc1 ZINC000350518844 136361918 /nfs/dbraw/zinc/36/19/18/136361918.db2.gz WTXOLMJKOUPBSA-NEPJUHHUSA-N 1 2 244.342 2.097 20 0 BEADLO CCCCOCC[N@@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000351105356 136367990 /nfs/dbraw/zinc/36/79/90/136367990.db2.gz VSFRDOWFLLYFMO-LBPRGKRZSA-N 1 2 237.347 2.363 20 0 BEADLO CCCCOCC[N@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000351105356 136367991 /nfs/dbraw/zinc/36/79/91/136367991.db2.gz VSFRDOWFLLYFMO-LBPRGKRZSA-N 1 2 237.347 2.363 20 0 BEADLO C[C@@H]([NH2+]Cc1cnn2ccccc12)c1ccon1 ZINC000351573560 136369200 /nfs/dbraw/zinc/36/92/00/136369200.db2.gz KVKKFIAGDFXIID-SNVBAGLBSA-N 1 2 242.282 2.173 20 0 BEADLO C[C@H]([NH2+]Cc1ccc2c[nH]nc2c1)c1ccon1 ZINC000351580311 136369204 /nfs/dbraw/zinc/36/92/04/136369204.db2.gz LLCJCNGVKZBWNY-VIFPVBQESA-N 1 2 242.282 2.402 20 0 BEADLO Cc1nc(F)ccc1C[N@H+]1C[C@@H](C)OC[C@H]1C ZINC000278442580 187340656 /nfs/dbraw/zinc/34/06/56/187340656.db2.gz LUCHLRPBXWAGTR-NXEZZACHSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1nc(F)ccc1C[N@@H+]1C[C@@H](C)OC[C@H]1C ZINC000278442580 187340658 /nfs/dbraw/zinc/34/06/58/187340658.db2.gz LUCHLRPBXWAGTR-NXEZZACHSA-N 1 2 238.306 2.138 20 0 BEADLO CC[NH2+][C@@H](c1ncn[nH]1)C1CCCCC1 ZINC000083746804 343497841 /nfs/dbraw/zinc/49/78/41/343497841.db2.gz HLBAVMWWNCBJEG-SNVBAGLBSA-N 1 2 208.309 2.036 20 0 BEADLO O=C(CCCn1cc[nH+]c1)N1C[C@@H]2CCCC[C@@H]21 ZINC000616727018 343551862 /nfs/dbraw/zinc/55/18/62/343551862.db2.gz NTBBWOGGEUQXMF-STQMWFEESA-N 1 2 247.342 2.064 20 0 BEADLO Cc1cccc(CC(=O)N[C@H](C)c2[nH]cc[nH+]2)c1 ZINC000140758986 343561659 /nfs/dbraw/zinc/56/16/59/343561659.db2.gz SBYMWTPTEHDUDY-LLVKDONJSA-N 1 2 243.310 2.138 20 0 BEADLO CC(C)C(=O)NCc1ccccc1-n1cc[nH+]c1 ZINC000048926921 343590261 /nfs/dbraw/zinc/59/02/61/343590261.db2.gz LKGVOHOEXQEIQW-UHFFFAOYSA-N 1 2 243.310 2.145 20 0 BEADLO Cc1ccc2[nH+]c(CNC(=O)C(C)(C)C)cn2c1 ZINC000048968938 343590908 /nfs/dbraw/zinc/59/09/08/343590908.db2.gz GCOFBKWBJIIIOO-UHFFFAOYSA-N 1 2 245.326 2.305 20 0 BEADLO COC(=O)[C@@H](Cc1ccccc1)[NH2+]CCC(C)C ZINC000083381167 343591286 /nfs/dbraw/zinc/59/12/86/343591286.db2.gz HGMWYPZHJXQRLQ-CQSZACIVSA-N 1 2 249.354 2.406 20 0 BEADLO Cn1c[nH+]cc1CCC(=O)N1CCCC(C)(C)C1 ZINC000280636792 187342859 /nfs/dbraw/zinc/34/28/59/187342859.db2.gz XXHZAEOFXMMBON-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO COC(=O)[C@H](C)[NH2+]CC(C)(C)c1ccccc1 ZINC000043627281 343617833 /nfs/dbraw/zinc/61/78/33/343617833.db2.gz QZGXBVNBGYHXPT-NSHDSACASA-N 1 2 235.327 2.115 20 0 BEADLO Cc1ccc(CN(C)c2cccc[nH+]2)nc1 ZINC000302622112 178557867 /nfs/dbraw/zinc/55/78/67/178557867.db2.gz AAZDZIXBYGQSML-UHFFFAOYSA-N 1 2 213.284 2.421 20 0 BEADLO Cc1ccc(F)c(C(=O)N(C)Cc2c[nH+]c[nH]2)c1 ZINC000622745879 343606275 /nfs/dbraw/zinc/60/62/75/343606275.db2.gz YSJKEZDKMHQONW-UHFFFAOYSA-N 1 2 247.273 2.129 20 0 BEADLO Cc1ccc(F)c(C(=O)N(C)Cc2c[nH]c[nH+]2)c1 ZINC000622745879 343606277 /nfs/dbraw/zinc/60/62/77/343606277.db2.gz YSJKEZDKMHQONW-UHFFFAOYSA-N 1 2 247.273 2.129 20 0 BEADLO Cc1c(F)cccc1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000622746242 343606826 /nfs/dbraw/zinc/60/68/26/343606826.db2.gz NVQOXXWLLBUFOM-UHFFFAOYSA-N 1 2 247.273 2.129 20 0 BEADLO Cc1c(F)cccc1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000622746242 343606828 /nfs/dbraw/zinc/60/68/28/343606828.db2.gz NVQOXXWLLBUFOM-UHFFFAOYSA-N 1 2 247.273 2.129 20 0 BEADLO Cc1cscc1C[NH2+]Cc1csnn1 ZINC000087309141 343643469 /nfs/dbraw/zinc/64/34/69/343643469.db2.gz ZGJODYMETRUHJO-UHFFFAOYSA-N 1 2 225.342 2.198 20 0 BEADLO Cc1occc1CNc1cc[nH+]c(C)n1 ZINC000309071364 349826371 /nfs/dbraw/zinc/82/63/71/349826371.db2.gz DLTHOIDUAZJZPE-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO c1coc(C2=CCC[N@@H+](Cc3ncc[nH]3)C2)c1 ZINC000285781843 187344671 /nfs/dbraw/zinc/34/46/71/187344671.db2.gz YTNMCYVISKYVBV-UHFFFAOYSA-N 1 2 229.283 2.292 20 0 BEADLO c1coc(C2=CCC[N@H+](Cc3ncc[nH]3)C2)c1 ZINC000285781843 187344673 /nfs/dbraw/zinc/34/46/73/187344673.db2.gz YTNMCYVISKYVBV-UHFFFAOYSA-N 1 2 229.283 2.292 20 0 BEADLO CCc1nc(C[N@H+](CCOC)C2CC2)cs1 ZINC000048024065 343702008 /nfs/dbraw/zinc/70/20/08/343702008.db2.gz ZIHNHSVTXYXFAN-UHFFFAOYSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nc(C[N@@H+](CCOC)C2CC2)cs1 ZINC000048024065 343702011 /nfs/dbraw/zinc/70/20/11/343702011.db2.gz ZIHNHSVTXYXFAN-UHFFFAOYSA-N 1 2 240.372 2.316 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCCC1 ZINC000287550262 187346512 /nfs/dbraw/zinc/34/65/12/187346512.db2.gz OTTQTGKSIQBFKG-UHFFFAOYSA-N 1 2 219.288 2.326 20 0 BEADLO COc1ccc[nH+]c1N1CC[C@]2(CC2(F)F)C1 ZINC000624356252 343737704 /nfs/dbraw/zinc/73/77/04/343737704.db2.gz SNVBRUXZRZGZTG-NSHDSACASA-N 1 2 240.253 2.326 20 0 BEADLO COc1ccc[nH+]c1N1C[C@@H]2CCCC[C@@H]21 ZINC000624376297 343742238 /nfs/dbraw/zinc/74/22/38/343742238.db2.gz NHVVUEKIRQWMQR-QWRGUYRKSA-N 1 2 218.300 2.469 20 0 BEADLO CN(c1cc2ccccc2c[nH+]1)[C@H]1CCOC1 ZINC000631111807 343711214 /nfs/dbraw/zinc/71/12/14/343711214.db2.gz VQPOLXUWFYVZBR-ZDUSSCGKSA-N 1 2 228.295 2.460 20 0 BEADLO Cc1noc(C)c1C[NH2+]Cc1nccs1 ZINC000088300179 343720058 /nfs/dbraw/zinc/72/00/58/343720058.db2.gz VSZONTUNCVPLEA-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2nnc(C)o2)c1 ZINC000061759670 343728619 /nfs/dbraw/zinc/72/86/19/343728619.db2.gz OHYJCTQFRAPXQB-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2nnc(C)o2)c1 ZINC000061759670 343728621 /nfs/dbraw/zinc/72/86/21/343728621.db2.gz OHYJCTQFRAPXQB-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO CC(C)(C)c1nc(COc2cc[nH+]cc2)no1 ZINC000292456823 187348952 /nfs/dbraw/zinc/34/89/52/187348952.db2.gz OJEXYXLUKNKGQR-UHFFFAOYSA-N 1 2 233.271 2.341 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCC(C)(C)C1 ZINC000570408895 323058758 /nfs/dbraw/zinc/05/87/58/323058758.db2.gz AJLOVPITFLXFJC-UHFFFAOYSA-N 1 2 205.305 2.330 20 0 BEADLO COC(=O)[C@H](c1ccccc1)[N@@H+]1C[C@@H](C)[C@H]1C ZINC000292886120 187349130 /nfs/dbraw/zinc/34/91/30/187349130.db2.gz CMSLCXFQSPAARE-WZRBSPASSA-N 1 2 233.311 2.241 20 0 BEADLO COC(=O)[C@H](c1ccccc1)[N@H+]1C[C@@H](C)[C@H]1C ZINC000292886120 187349132 /nfs/dbraw/zinc/34/91/32/187349132.db2.gz CMSLCXFQSPAARE-WZRBSPASSA-N 1 2 233.311 2.241 20 0 BEADLO Cc1ccc(N[C@@H](C)c2[nH]cc[nH+]2)cn1 ZINC000286149955 537809039 /nfs/dbraw/zinc/80/90/39/537809039.db2.gz OUKDBZGZFLWSQW-VIFPVBQESA-N 1 2 202.261 2.286 20 0 BEADLO CC(C)(C)c1ncc(CNc2c[nH]c[nH+]2)cn1 ZINC000584144513 343764698 /nfs/dbraw/zinc/76/46/98/343764698.db2.gz AIZDDMMCFSEUKU-UHFFFAOYSA-N 1 2 231.303 2.109 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)[C@@H]1CC12CCCCC2 ZINC000336531412 537812868 /nfs/dbraw/zinc/81/28/68/537812868.db2.gz OXAVAIBVVGOUNC-LBPRGKRZSA-N 1 2 247.342 2.007 20 0 BEADLO CC(C)[C@@H]1CN(c2cccc[nH+]2)CCCO1 ZINC000293925816 187350684 /nfs/dbraw/zinc/35/06/84/187350684.db2.gz FASDAKLEGLOEJL-LBPRGKRZSA-N 1 2 220.316 2.333 20 0 BEADLO C[N@H+](CCCCO)Cc1ncc(Cl)s1 ZINC000471818403 529885102 /nfs/dbraw/zinc/88/51/02/529885102.db2.gz AIUURHCMEAGDCA-UHFFFAOYSA-N 1 2 234.752 2.001 20 0 BEADLO C[N@@H+](CCCCO)Cc1ncc(Cl)s1 ZINC000471818403 529885103 /nfs/dbraw/zinc/88/51/03/529885103.db2.gz AIUURHCMEAGDCA-UHFFFAOYSA-N 1 2 234.752 2.001 20 0 BEADLO CCC[C@H](C)CCC[N@H+](C)Cc1n[nH]c(=O)o1 ZINC000625483420 343881867 /nfs/dbraw/zinc/88/18/67/343881867.db2.gz HBPFPWSJXAOSHS-JTQLQIEISA-N 1 2 241.335 2.423 20 0 BEADLO CCC[C@H](C)CCC[N@@H+](C)Cc1n[nH]c(=O)o1 ZINC000625483420 343881868 /nfs/dbraw/zinc/88/18/68/343881868.db2.gz HBPFPWSJXAOSHS-JTQLQIEISA-N 1 2 241.335 2.423 20 0 BEADLO CC[C@@H](NCc1[nH]cc[nH+]1)c1nc(C)cs1 ZINC000066594080 343874642 /nfs/dbraw/zinc/87/46/42/343874642.db2.gz ZCIIEUAEWMWODT-SECBINFHSA-N 1 2 236.344 2.416 20 0 BEADLO CC[C@@H]([NH2+]Cc1ncc[nH]1)c1nc(C)cs1 ZINC000066594080 343874644 /nfs/dbraw/zinc/87/46/44/343874644.db2.gz ZCIIEUAEWMWODT-SECBINFHSA-N 1 2 236.344 2.416 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cocn2)[C@@H](CC)CO1 ZINC000651913016 537827790 /nfs/dbraw/zinc/82/77/90/537827790.db2.gz KOPXMUAGJDLVDU-NWDGAFQWSA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cocn2)[C@@H](CC)CO1 ZINC000651913016 537827794 /nfs/dbraw/zinc/82/77/94/537827794.db2.gz KOPXMUAGJDLVDU-NWDGAFQWSA-N 1 2 224.304 2.064 20 0 BEADLO CC1(C)CC(C[N@@H+]2CC[C@@H](O)C(F)(F)C2)C1 ZINC000625535133 343925721 /nfs/dbraw/zinc/92/57/21/343925721.db2.gz KIILNJDMEJAVRX-SNVBAGLBSA-N 1 2 233.302 2.125 20 0 BEADLO CC1(C)CC(C[N@H+]2CC[C@@H](O)C(F)(F)C2)C1 ZINC000625535133 343925722 /nfs/dbraw/zinc/92/57/22/343925722.db2.gz KIILNJDMEJAVRX-SNVBAGLBSA-N 1 2 233.302 2.125 20 0 BEADLO Cc1c[nH]c(CN2CCn3cccc3[C@@H]2C)[nH+]1 ZINC000628119372 343970518 /nfs/dbraw/zinc/97/05/18/343970518.db2.gz OSUQGRZBCVIRNM-NSHDSACASA-N 1 2 230.315 2.096 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCn3cccc3[C@@H]2C)n1 ZINC000628119372 343970521 /nfs/dbraw/zinc/97/05/21/343970521.db2.gz OSUQGRZBCVIRNM-NSHDSACASA-N 1 2 230.315 2.096 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCn3cccc3[C@@H]2C)n1 ZINC000628119372 343970524 /nfs/dbraw/zinc/97/05/24/343970524.db2.gz OSUQGRZBCVIRNM-NSHDSACASA-N 1 2 230.315 2.096 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC[C@H]2c2cccn2C)n1 ZINC000628120765 343971294 /nfs/dbraw/zinc/97/12/94/343971294.db2.gz CRHKXVIEUCMFOX-ZDUSSCGKSA-N 1 2 244.342 2.394 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC[C@H]2c2cccn2C)n1 ZINC000628120765 343971296 /nfs/dbraw/zinc/97/12/96/343971296.db2.gz CRHKXVIEUCMFOX-ZDUSSCGKSA-N 1 2 244.342 2.394 20 0 BEADLO CCCC[C@@H](CC)C(=O)NCc1[nH]cc[nH+]1 ZINC000070651451 343953545 /nfs/dbraw/zinc/95/35/45/343953545.db2.gz MSLJCXKWZRDLLV-SNVBAGLBSA-N 1 2 223.320 2.242 20 0 BEADLO Cc1c[nH]c(C[N@@H+](C)Cc2ccc(F)cc2)n1 ZINC000628119783 343968215 /nfs/dbraw/zinc/96/82/15/343968215.db2.gz KTDMRUOVOULKDH-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1c[nH]c(C[N@H+](C)Cc2ccc(F)cc2)n1 ZINC000628119783 343968216 /nfs/dbraw/zinc/96/82/16/343968216.db2.gz KTDMRUOVOULKDH-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2ncnn2C)cc1F ZINC000276678773 178622095 /nfs/dbraw/zinc/62/20/95/178622095.db2.gz LKNIPKOJNBDIRS-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO CCn1cc(C[N@@H+]2Cc3ccc(O)cc3C2)cn1 ZINC000625728351 344059914 /nfs/dbraw/zinc/05/99/14/344059914.db2.gz KPBHEEUXQXGOQT-UHFFFAOYSA-N 1 2 243.310 2.124 20 0 BEADLO CCn1cc(C[N@H+]2Cc3ccc(O)cc3C2)cn1 ZINC000625728351 344059916 /nfs/dbraw/zinc/05/99/16/344059916.db2.gz KPBHEEUXQXGOQT-UHFFFAOYSA-N 1 2 243.310 2.124 20 0 BEADLO CC(C)C[C@@H](C(=O)N1CC[C@@H]1C)n1cc[nH+]c1 ZINC000641247389 362326943 /nfs/dbraw/zinc/32/69/43/362326943.db2.gz RAPATEIRJAUGLZ-RYUDHWBXSA-N 1 2 235.331 2.091 20 0 BEADLO CCc1noc(C[NH2+]C2(c3ccccc3)CC2)n1 ZINC000077378743 344068306 /nfs/dbraw/zinc/06/83/06/344068306.db2.gz NMDLZEIEIWOGJN-UHFFFAOYSA-N 1 2 243.310 2.411 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000570693282 323067440 /nfs/dbraw/zinc/06/74/40/323067440.db2.gz BKRNPYGVRXIFSU-DCAQKATOSA-N 1 2 237.347 2.139 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000570693282 323067441 /nfs/dbraw/zinc/06/74/41/323067441.db2.gz BKRNPYGVRXIFSU-DCAQKATOSA-N 1 2 237.347 2.139 20 0 BEADLO CC(F)(F)CNc1cc(N2CCCC2)nc[nH+]1 ZINC000558949833 344089502 /nfs/dbraw/zinc/08/95/02/344089502.db2.gz YMZLUHVZUHDGEX-UHFFFAOYSA-N 1 2 242.273 2.144 20 0 BEADLO CC(F)(F)CNc1cc(N2CCCC2)[nH+]cn1 ZINC000558949833 344089506 /nfs/dbraw/zinc/08/95/06/344089506.db2.gz YMZLUHVZUHDGEX-UHFFFAOYSA-N 1 2 242.273 2.144 20 0 BEADLO Cn1cc(Cl)c(C[NH+](C2CC2)C2CC2)n1 ZINC000625842081 344093123 /nfs/dbraw/zinc/09/31/23/344093123.db2.gz UUXNHOMKPSPNIR-UHFFFAOYSA-N 1 2 225.723 2.200 20 0 BEADLO CC(C)CCOCCNc1cc(CO)cc[nH+]1 ZINC000641316972 362362705 /nfs/dbraw/zinc/36/27/05/362362705.db2.gz WPXRHDFXZZFSCG-UHFFFAOYSA-N 1 2 238.331 2.049 20 0 BEADLO CC[C@H](C(=O)OC)[N@H+](C)Cc1ccsc1 ZINC000588689909 344173223 /nfs/dbraw/zinc/17/32/23/344173223.db2.gz VKLVVHAJELXKHE-SNVBAGLBSA-N 1 2 227.329 2.132 20 0 BEADLO CC[C@H](C(=O)OC)[N@@H+](C)Cc1ccsc1 ZINC000588689909 344173225 /nfs/dbraw/zinc/17/32/25/344173225.db2.gz VKLVVHAJELXKHE-SNVBAGLBSA-N 1 2 227.329 2.132 20 0 BEADLO COc1cc[nH+]cc1NC(=O)CCC(F)(F)F ZINC000079849015 344120449 /nfs/dbraw/zinc/12/04/49/344120449.db2.gz RGEHHJAHZUMDBL-UHFFFAOYSA-N 1 2 248.204 2.371 20 0 BEADLO COCCC1(CNc2[nH+]cccc2OC)CC1 ZINC000234608688 344155661 /nfs/dbraw/zinc/15/56/61/344155661.db2.gz CKBBMZAZMZKGNC-UHFFFAOYSA-N 1 2 236.315 2.319 20 0 BEADLO Cc1c[nH]c(C[NH+]2CCC(C(F)(F)F)CC2)n1 ZINC000628129627 344157887 /nfs/dbraw/zinc/15/78/87/344157887.db2.gz MZSQKRAQHGBJOS-UHFFFAOYSA-N 1 2 247.264 2.492 20 0 BEADLO COC1CCN(c2cc[nH+]c3ccncc32)CC1 ZINC000085654531 344207703 /nfs/dbraw/zinc/20/77/03/344207703.db2.gz DXALWOOMRXFVDO-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO CN(Cc1[nH+]ccn1C)c1c(F)cccc1F ZINC000195515199 344208330 /nfs/dbraw/zinc/20/83/30/344208330.db2.gz PVDKQCOKCWVLGQ-UHFFFAOYSA-N 1 2 237.253 2.335 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC[C@H]2c2ccccn2)n1 ZINC000628136687 344212589 /nfs/dbraw/zinc/21/25/89/344212589.db2.gz KAXNNIHMUNLXLL-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC[C@H]2c2ccccn2)n1 ZINC000628136687 344212590 /nfs/dbraw/zinc/21/25/90/344212590.db2.gz KAXNNIHMUNLXLL-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO CN(C[C@H]1CC=CCC1)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492903721 529962250 /nfs/dbraw/zinc/96/22/50/529962250.db2.gz URLRLINWPBMRNK-KRZKBDHCSA-N 1 2 245.326 2.238 20 0 BEADLO COCCCCCNc1[nH+]cccc1OC ZINC000234665797 344182728 /nfs/dbraw/zinc/18/27/28/344182728.db2.gz CAVZBLACEIRLDC-UHFFFAOYSA-N 1 2 224.304 2.319 20 0 BEADLO CN(CC(C)(C)C)C(=O)CCCn1cc[nH+]c1 ZINC000588799776 344189767 /nfs/dbraw/zinc/18/97/67/344189767.db2.gz POOQLZGERRSSGA-UHFFFAOYSA-N 1 2 237.347 2.168 20 0 BEADLO COc1cc[nH+]cc1CSC[C@H](C)OC ZINC000588918205 344199770 /nfs/dbraw/zinc/19/97/70/344199770.db2.gz MIGLAJDNOWKDFN-VIFPVBQESA-N 1 2 227.329 2.358 20 0 BEADLO CSCCCCNc1cc[nH+]cc1F ZINC000603290545 349907938 /nfs/dbraw/zinc/90/79/38/349907938.db2.gz BIWKPLATNYWILB-UHFFFAOYSA-N 1 2 214.309 2.198 20 0 BEADLO Fc1cnccc1N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000641342202 362370744 /nfs/dbraw/zinc/37/07/44/362370744.db2.gz BXMBAGQOAJSYDM-LLVKDONJSA-N 1 2 246.289 2.259 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@H]1CCc2cc(N)ccc21 ZINC000094087914 344325700 /nfs/dbraw/zinc/32/57/00/344325700.db2.gz KZJOEXFFLUEABK-AWEZNQCLSA-N 1 2 242.326 2.077 20 0 BEADLO CC[C@H]([NH2+][C@@H]1C[C@H]1c1ccsc1)C(=O)OC ZINC000600612736 344336077 /nfs/dbraw/zinc/33/60/77/344336077.db2.gz BZTWQCBIGNJTDH-GARJFASQSA-N 1 2 239.340 2.145 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CCCC1(C)C)c1[nH+]ccn1C ZINC000620603784 344354165 /nfs/dbraw/zinc/35/41/65/344354165.db2.gz LKLPIMQNGAHZMJ-MNOVXSKESA-N 1 2 249.358 2.424 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CCCC1(C)C)c1[nH+]ccn1C ZINC000620603782 344354423 /nfs/dbraw/zinc/35/44/23/344354423.db2.gz LKLPIMQNGAHZMJ-GHMZBOCLSA-N 1 2 249.358 2.424 20 0 BEADLO Fc1c[nH+]ccc1NCC1CCSCC1 ZINC000641376047 362381419 /nfs/dbraw/zinc/38/14/19/362381419.db2.gz QQNSZQVOZGRFIY-UHFFFAOYSA-N 1 2 226.320 2.198 20 0 BEADLO CCOC(=O)C[N@H+](CC)Cc1csc(C)c1 ZINC000380603353 344423965 /nfs/dbraw/zinc/42/39/65/344423965.db2.gz VXCRWSGIFWWKQT-UHFFFAOYSA-N 1 2 241.356 2.442 20 0 BEADLO CCOC(=O)C[N@@H+](CC)Cc1csc(C)c1 ZINC000380603353 344423966 /nfs/dbraw/zinc/42/39/66/344423966.db2.gz VXCRWSGIFWWKQT-UHFFFAOYSA-N 1 2 241.356 2.442 20 0 BEADLO C[C@@H](NC(=O)[C@H](C)C1CCC1)c1[nH+]ccn1C ZINC000620612639 344368774 /nfs/dbraw/zinc/36/87/74/344368774.db2.gz ZXQLQYVOINRLDD-NXEZZACHSA-N 1 2 235.331 2.034 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)Cc1cscn1 ZINC000622866841 344436024 /nfs/dbraw/zinc/43/60/24/344436024.db2.gz UUEWHSMBDOPWRY-UHFFFAOYSA-N 1 2 247.323 2.336 20 0 BEADLO O=C([C@H]1CC12CC2)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000622337956 344506433 /nfs/dbraw/zinc/50/64/33/344506433.db2.gz RBCMUOCGYLZEPV-GHMZBOCLSA-N 1 2 245.326 2.263 20 0 BEADLO CCc1cc(NC[C@H]2CC=CCC2)nc[nH+]1 ZINC000381306215 344493298 /nfs/dbraw/zinc/49/32/98/344493298.db2.gz JWOPJBRDUMVESZ-NSHDSACASA-N 1 2 217.316 2.229 20 0 BEADLO CC(C)[C@@H]1C[C@H](Nc2cc[nH+]cc2F)CCO1 ZINC000641476747 362445133 /nfs/dbraw/zinc/44/51/33/362445133.db2.gz PWKMVHIZCOODPT-MFKMUULPSA-N 1 2 238.306 2.258 20 0 BEADLO CC(C)[C@H]1C[C@@H](Nc2cc[nH+]cc2F)CCO1 ZINC000641476746 362445219 /nfs/dbraw/zinc/44/52/19/362445219.db2.gz PWKMVHIZCOODPT-GXFFZTMASA-N 1 2 238.306 2.258 20 0 BEADLO C[C@H]1CCN(c2cc(CO)cc[nH+]2)C[C@H](C)C1 ZINC000641456544 362429372 /nfs/dbraw/zinc/42/93/72/362429372.db2.gz QKCGJIYBPDCIQT-NWDGAFQWSA-N 1 2 234.343 2.446 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N(C)[C@@H]1CC[C@@H](C)C1 ZINC000577744112 344595143 /nfs/dbraw/zinc/59/51/43/344595143.db2.gz DRPRIJRSDJOZCV-NTZNESFSSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N(C)[C@@H]1CC[C@@H](C)C1 ZINC000577744112 344595145 /nfs/dbraw/zinc/59/51/45/344595145.db2.gz DRPRIJRSDJOZCV-NTZNESFSSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H]1CC(Nc2cc[nH+]cc2F)C[C@H](C)O1 ZINC000641473939 362442404 /nfs/dbraw/zinc/44/24/04/362442404.db2.gz QXYNRAIYQXLLLW-IUCAKERBSA-N 1 2 224.279 2.011 20 0 BEADLO OCc1cc[nH+]c(NC[C@@H]2CCCCS2)c1 ZINC000641487285 362455359 /nfs/dbraw/zinc/45/53/59/362455359.db2.gz IRVJYDUPRTUTDQ-NSHDSACASA-N 1 2 238.356 2.272 20 0 BEADLO Cc1nc(SCc2ccc[nH+]c2N)[nH]c1C ZINC000641486262 362456194 /nfs/dbraw/zinc/45/61/94/362456194.db2.gz SRFCVPJITFLCCA-UHFFFAOYSA-N 1 2 234.328 2.296 20 0 BEADLO C[C@@H]1CN(c2cc[nH+]cc2F)[C@H](C)[C@@H](C)O1 ZINC000641522875 362479659 /nfs/dbraw/zinc/47/96/59/362479659.db2.gz WXAUPHWNQGZWDL-OPRDCNLKSA-N 1 2 224.279 2.223 20 0 BEADLO C[C@@H]1CC2(CCC2)CN1c1cc(CO)cc[nH+]1 ZINC000641538100 362490139 /nfs/dbraw/zinc/49/01/39/362490139.db2.gz SDSYWHKFASTBSN-LLVKDONJSA-N 1 2 232.327 2.343 20 0 BEADLO C[C@@H](c1cccnc1)[N@@H+]1CCO[C@@H](CCF)C1 ZINC000626001969 344662476 /nfs/dbraw/zinc/66/24/76/344662476.db2.gz CIHNBVOGNMGKLT-AAEUAGOBSA-N 1 2 238.306 2.203 20 0 BEADLO C[C@@H](c1cccnc1)[N@H+]1CCO[C@@H](CCF)C1 ZINC000626001969 344662479 /nfs/dbraw/zinc/66/24/79/344662479.db2.gz CIHNBVOGNMGKLT-AAEUAGOBSA-N 1 2 238.306 2.203 20 0 BEADLO CC(C)(NC(=O)C[C@H]1C=CCC1)c1[nH]cc[nH+]1 ZINC000574284387 344732352 /nfs/dbraw/zinc/73/23/52/344732352.db2.gz ACUCFPGTXLFIGQ-JTQLQIEISA-N 1 2 233.315 2.117 20 0 BEADLO Cc1ccc(C(=O)N[C@H](C)c2[nH+]ccn2C)cc1 ZINC000082281445 344714115 /nfs/dbraw/zinc/71/41/15/344714115.db2.gz UMFPDZMALLGFTQ-LLVKDONJSA-N 1 2 243.310 2.220 20 0 BEADLO Oc1ccccc1SCCn1cc[nH+]c1 ZINC000050046957 344717141 /nfs/dbraw/zinc/71/71/41/344717141.db2.gz FWWKSJKKNSGNEA-UHFFFAOYSA-N 1 2 220.297 2.381 20 0 BEADLO Cc1[nH]ncc1C[NH2+]CC1(C(F)(F)F)CC1 ZINC000309847225 187292590 /nfs/dbraw/zinc/29/25/90/187292590.db2.gz HEGHTWQJZNYFBF-UHFFFAOYSA-N 1 2 233.237 2.150 20 0 BEADLO O=C(C1CC=CC1)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000076988951 344811552 /nfs/dbraw/zinc/81/15/52/344811552.db2.gz QQYCSVIUINHWQI-LBPRGKRZSA-N 1 2 245.326 2.082 20 0 BEADLO O=C(C1CC=CC1)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000076988948 344811967 /nfs/dbraw/zinc/81/19/67/344811967.db2.gz QQYCSVIUINHWQI-GFCCVEGCSA-N 1 2 245.326 2.082 20 0 BEADLO CC1(C)C[N@H+](Cc2cnc(C3CC3)o2)CCO1 ZINC000628144393 344813906 /nfs/dbraw/zinc/81/39/06/344813906.db2.gz APCGCAITRPECHJ-UHFFFAOYSA-N 1 2 236.315 2.163 20 0 BEADLO CC1(C)C[N@@H+](Cc2cnc(C3CC3)o2)CCO1 ZINC000628144393 344813908 /nfs/dbraw/zinc/81/39/08/344813908.db2.gz APCGCAITRPECHJ-UHFFFAOYSA-N 1 2 236.315 2.163 20 0 BEADLO Cc1[nH]c(CN(C)Cc2ccoc2)[nH+]c1C ZINC000628152558 344841235 /nfs/dbraw/zinc/84/12/35/344841235.db2.gz GMSHBVPCRKHCCB-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO Cc1ccc(N)cc1NCCCn1cc[nH+]c1 ZINC000053734635 1172049019 /nfs/dbraw/zinc/04/90/19/1172049019.db2.gz LBMYDIGVBAJGIR-UHFFFAOYSA-N 1 2 230.315 2.276 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2ncc[nH]2)cc1C ZINC000111219111 187293645 /nfs/dbraw/zinc/29/36/45/187293645.db2.gz OCCTZJVXSWUKER-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2ncc[nH]2)cc1C ZINC000111219111 187293647 /nfs/dbraw/zinc/29/36/47/187293647.db2.gz OCCTZJVXSWUKER-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO Cc1nc(C[NH+]2C[C@@H](C)S[C@H](C)C2)[nH]c1C ZINC000628156263 344847976 /nfs/dbraw/zinc/84/79/76/344847976.db2.gz JENFKCBHKGDOFM-RKDXNWHRSA-N 1 2 239.388 2.352 20 0 BEADLO Cc1[nH]c(CN2C[C@@H](C)S[C@H](C)C2)[nH+]c1C ZINC000628156263 344847978 /nfs/dbraw/zinc/84/79/78/344847978.db2.gz JENFKCBHKGDOFM-RKDXNWHRSA-N 1 2 239.388 2.352 20 0 BEADLO Cc1ncc(CN2CCCC[C@H]2c2[nH]cc[nH+]2)o1 ZINC000628160048 344858947 /nfs/dbraw/zinc/85/89/47/344858947.db2.gz GCAJDYGDVVJLLG-LBPRGKRZSA-N 1 2 246.314 2.433 20 0 BEADLO COC(C)(C)C[C@H](C)Nc1cc[nH+]c(C)n1 ZINC000078402186 344860482 /nfs/dbraw/zinc/86/04/82/344860482.db2.gz CDFZBDBZCYUOJR-VIFPVBQESA-N 1 2 223.320 2.401 20 0 BEADLO Cc1nc(NC[C@@](C)(O)c2ccsc2)cc[nH+]1 ZINC000078301528 344842845 /nfs/dbraw/zinc/84/28/45/344842845.db2.gz ODVCIEXQQULONG-GFCCVEGCSA-N 1 2 249.339 2.166 20 0 BEADLO Cc1nc(NCc2ccc(O)c(F)c2)cc[nH+]1 ZINC000078295593 344843671 /nfs/dbraw/zinc/84/36/71/344843671.db2.gz FZLJJRYWTGFXIT-UHFFFAOYSA-N 1 2 233.246 2.242 20 0 BEADLO CCOC[C@@H](Nc1cc(CO)cc[nH+]1)C(C)C ZINC000641550966 362496031 /nfs/dbraw/zinc/49/60/31/362496031.db2.gz ZRCSGWWCLOWAIS-GFCCVEGCSA-N 1 2 238.331 2.047 20 0 BEADLO Cc1n[nH]cc1CNc1ccc(C)[nH+]c1C ZINC000087151537 178762397 /nfs/dbraw/zinc/76/23/97/178762397.db2.gz ASXSYZGPZQPXQO-UHFFFAOYSA-N 1 2 216.288 2.342 20 0 BEADLO Cc1nc(NCC[C@@H](O)c2ccccc2)cc[nH+]1 ZINC000078519759 344878713 /nfs/dbraw/zinc/87/87/13/344878713.db2.gz SOYZLAPJUCUYCK-CYBMUJFWSA-N 1 2 243.310 2.321 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000578515570 344889476 /nfs/dbraw/zinc/88/94/76/344889476.db2.gz ZBFWCSIPYUWIMD-YGRLFVJLSA-N 1 2 249.358 2.443 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)CCc2c[nH+]c[nH]2)C[C@H]1C ZINC000249116852 537871112 /nfs/dbraw/zinc/87/11/12/537871112.db2.gz SKAXGMBKNFXYEQ-UTUOFQBUSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)CCc2c[nH]c[nH+]2)C[C@H]1C ZINC000249116852 537871118 /nfs/dbraw/zinc/87/11/18/537871118.db2.gz SKAXGMBKNFXYEQ-UTUOFQBUSA-N 1 2 249.358 2.283 20 0 BEADLO Cc1ccc(NCc2[nH+]ccn2C)c(F)c1 ZINC000036804626 178768921 /nfs/dbraw/zinc/76/89/21/178768921.db2.gz KXDGPTDOJYMKKZ-UHFFFAOYSA-N 1 2 219.263 2.480 20 0 BEADLO Cc1c[nH]c(C[NH+]2CCC(C(F)F)CC2)n1 ZINC000628177893 344906990 /nfs/dbraw/zinc/90/69/90/344906990.db2.gz SBMZREXHMCVPJR-UHFFFAOYSA-N 1 2 229.274 2.195 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCS[C@@H](C)[C@H]2C)n1 ZINC000628178784 344913476 /nfs/dbraw/zinc/91/34/76/344913476.db2.gz BTSFMUKTRMHCSS-ZJUUUORDSA-N 1 2 225.361 2.044 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCS[C@@H](C)[C@H]2C)n1 ZINC000628178784 344913478 /nfs/dbraw/zinc/91/34/78/344913478.db2.gz BTSFMUKTRMHCSS-ZJUUUORDSA-N 1 2 225.361 2.044 20 0 BEADLO COC(=O)C[N@H+](Cc1cc(C)ccc1C)C1CC1 ZINC000079501478 344983395 /nfs/dbraw/zinc/98/33/95/344983395.db2.gz UJFTXNSQVBULHE-UHFFFAOYSA-N 1 2 247.338 2.441 20 0 BEADLO COC(=O)C[N@@H+](Cc1cc(C)ccc1C)C1CC1 ZINC000079501478 344983398 /nfs/dbraw/zinc/98/33/98/344983398.db2.gz UJFTXNSQVBULHE-UHFFFAOYSA-N 1 2 247.338 2.441 20 0 BEADLO COc1ccc(N[C@H]2CCOC(C)(C)C2)[nH+]c1 ZINC000234970656 537882502 /nfs/dbraw/zinc/88/25/02/537882502.db2.gz XRQIZCZCRNZPMC-JTQLQIEISA-N 1 2 236.315 2.460 20 0 BEADLO CC(C)(NC(=O)[C@@H]1CC=CCC1)c1[nH]cc[nH+]1 ZINC000574763028 345001741 /nfs/dbraw/zinc/00/17/41/345001741.db2.gz GPNJUSADFVWQTE-SNVBAGLBSA-N 1 2 233.315 2.117 20 0 BEADLO COc1ccc(NCc2cnccc2C)[nH+]c1 ZINC000234956483 537882621 /nfs/dbraw/zinc/88/26/21/537882621.db2.gz VTHUBGHEKMQTOA-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@]2(C1)CCCOC2 ZINC000641563072 362503572 /nfs/dbraw/zinc/50/35/72/362503572.db2.gz OZGCBKZGNLKIOX-ZDUSSCGKSA-N 1 2 236.290 2.228 20 0 BEADLO CC[C@@]1(C)C[N@H+](Cc2cnc(C)s2)CCO1 ZINC000135710265 187299522 /nfs/dbraw/zinc/29/95/22/187299522.db2.gz ICFZLGDNHFILDI-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO CC[C@@]1(C)C[N@@H+](Cc2cnc(C)s2)CCO1 ZINC000135710265 187299524 /nfs/dbraw/zinc/29/95/24/187299524.db2.gz ICFZLGDNHFILDI-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H](C)C(F)(F)F ZINC000079843622 345043258 /nfs/dbraw/zinc/04/32/58/345043258.db2.gz YSNBPLNGXSRJIL-ZCFIWIBFSA-N 1 2 248.204 2.227 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1cncc(C)c1 ZINC000079843707 345043668 /nfs/dbraw/zinc/04/36/68/345043668.db2.gz ABHWREAIEGHCFJ-UHFFFAOYSA-N 1 2 243.266 2.046 20 0 BEADLO CN(c1cc[nH+]cc1F)[C@@H](CO)CC(C)(C)C ZINC000641621068 362553226 /nfs/dbraw/zinc/55/32/26/362553226.db2.gz AUFHDNCJUKSUPK-SNVBAGLBSA-N 1 2 240.322 2.454 20 0 BEADLO Cc1c[nH+]c(C)nc1NC[C@@H](C)c1nccs1 ZINC000566485720 345087773 /nfs/dbraw/zinc/08/77/73/345087773.db2.gz RYKHOICXADLUJF-SECBINFHSA-N 1 2 248.355 2.187 20 0 BEADLO Fc1c[nH+]ccc1NCCCC1CCOCC1 ZINC000641612515 362544042 /nfs/dbraw/zinc/54/40/42/362544042.db2.gz GFUIMAPPMMLYJN-UHFFFAOYSA-N 1 2 238.306 2.261 20 0 BEADLO C[C@H]1C(=O)N(C)CN1c1cc(C(C)(C)C)cc[nH+]1 ZINC000641649344 362576034 /nfs/dbraw/zinc/57/60/34/362576034.db2.gz YOPMICCJLGVSSZ-JTQLQIEISA-N 1 2 247.342 2.004 20 0 BEADLO C[C@@H](CNc1cc(CO)cc[nH+]1)c1ccccn1 ZINC000641656040 362579755 /nfs/dbraw/zinc/57/97/55/362579755.db2.gz AVJMJHSRJPYPGP-NSHDSACASA-N 1 2 243.310 2.185 20 0 BEADLO Fc1c[nH+]ccc1NCCC1CC(F)(F)C1 ZINC000641624770 362556765 /nfs/dbraw/zinc/55/67/65/362556765.db2.gz JTMUZVPZANLLBR-UHFFFAOYSA-N 1 2 230.233 2.490 20 0 BEADLO CC[C@@H]1C[C@@H](Nc2cc[nH+]cc2F)CCO1 ZINC000641638607 362566507 /nfs/dbraw/zinc/56/65/07/362566507.db2.gz CXTRKCDACWKALR-VHSXEESVSA-N 1 2 224.279 2.012 20 0 BEADLO CNc1cc(N(C)Cc2ccccc2)nc[nH+]1 ZINC000127237565 345166731 /nfs/dbraw/zinc/16/67/31/345166731.db2.gz VLTBQVJVEJEZGK-UHFFFAOYSA-N 1 2 228.299 2.155 20 0 BEADLO CNc1cc(N(C)Cc2ccccc2)[nH+]cn1 ZINC000127237565 345166732 /nfs/dbraw/zinc/16/67/32/345166732.db2.gz VLTBQVJVEJEZGK-UHFFFAOYSA-N 1 2 228.299 2.155 20 0 BEADLO CC[C@H](CSC)Nc1cc[nH+]cc1F ZINC000603328069 349924154 /nfs/dbraw/zinc/92/41/54/349924154.db2.gz FFNFXQAODDAKGH-MRVPVSSYSA-N 1 2 214.309 2.196 20 0 BEADLO CC[C@H](C)NC(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC000635056992 345230759 /nfs/dbraw/zinc/23/07/59/345230759.db2.gz OCVXZPOORVRARA-NWDGAFQWSA-N 1 2 237.347 2.385 20 0 BEADLO CC[C@@H](C)NC(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC000635056994 345231058 /nfs/dbraw/zinc/23/10/58/345231058.db2.gz OCVXZPOORVRARA-VXGBXAGGSA-N 1 2 237.347 2.385 20 0 BEADLO Cc1cccc(NC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)c1 ZINC000635059165 345232610 /nfs/dbraw/zinc/23/26/10/345232610.db2.gz QBBMMYRIMFYODZ-VXGBXAGGSA-N 1 2 241.294 2.460 20 0 BEADLO Cc1cccc(NC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)c1 ZINC000635059165 345232614 /nfs/dbraw/zinc/23/26/14/345232614.db2.gz QBBMMYRIMFYODZ-VXGBXAGGSA-N 1 2 241.294 2.460 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccoc1)c1nccn1C ZINC000132116207 345317513 /nfs/dbraw/zinc/31/75/13/345317513.db2.gz SAYHMCSICLVNLL-LLVKDONJSA-N 1 2 219.288 2.254 20 0 BEADLO CCC(O)(CC)C[N@H+](C)[C@H](C)c1csnn1 ZINC000626112159 345278753 /nfs/dbraw/zinc/27/87/53/345278753.db2.gz PDSUMKFIXIUECF-SECBINFHSA-N 1 2 243.376 2.082 20 0 BEADLO CCC(O)(CC)C[N@@H+](C)[C@H](C)c1csnn1 ZINC000626112159 345278754 /nfs/dbraw/zinc/27/87/54/345278754.db2.gz PDSUMKFIXIUECF-SECBINFHSA-N 1 2 243.376 2.082 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@H]2CCC[C@H](C)C2)[nH+]1 ZINC000635230076 345279363 /nfs/dbraw/zinc/27/93/63/345279363.db2.gz VQELGVFNOAMCLY-JQWIXIFHSA-N 1 2 249.358 2.210 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2nncn2C)o1 ZINC000037017353 178847860 /nfs/dbraw/zinc/84/78/60/178847860.db2.gz BKUFSYRJQGBPKG-ZJUUUORDSA-N 1 2 234.303 2.128 20 0 BEADLO Cc1cn2ccc(C(=O)NC[C@@H]3C[C@@H]3C)cc2[nH+]1 ZINC000635300606 345299311 /nfs/dbraw/zinc/29/93/11/345299311.db2.gz MYJAXLSMQDVNIT-CABZTGNLSA-N 1 2 243.310 2.029 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635420704 345360435 /nfs/dbraw/zinc/36/04/35/345360435.db2.gz SARFYEHIXRBPOS-LNFKQOIKSA-N 1 2 235.331 2.064 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635420704 345360436 /nfs/dbraw/zinc/36/04/36/345360436.db2.gz SARFYEHIXRBPOS-LNFKQOIKSA-N 1 2 235.331 2.064 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635420705 345360446 /nfs/dbraw/zinc/36/04/46/345360446.db2.gz SARFYEHIXRBPOS-UKKRHICBSA-N 1 2 235.331 2.064 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635420705 345360447 /nfs/dbraw/zinc/36/04/47/345360447.db2.gz SARFYEHIXRBPOS-UKKRHICBSA-N 1 2 235.331 2.064 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CCC[C@H](C)CC2)[nH+]1 ZINC000635447450 345373904 /nfs/dbraw/zinc/37/39/04/345373904.db2.gz RHTPMEVLJKNYEV-NSHDSACASA-N 1 2 249.358 2.163 20 0 BEADLO CCC[NH2+][C@H](c1c[nH]nn1)c1ccc(F)cc1 ZINC000158938555 345390275 /nfs/dbraw/zinc/39/02/75/345390275.db2.gz BVURMXIZNVXWRK-LBPRGKRZSA-N 1 2 234.278 2.033 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2CCCC3(CC3)CC2)n[nH]1 ZINC000626115128 345328849 /nfs/dbraw/zinc/32/88/49/345328849.db2.gz GTZXFVGDODRBFK-JTQLQIEISA-N 1 2 234.347 2.440 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2CCCC3(CC3)CC2)n[nH]1 ZINC000626115128 345328850 /nfs/dbraw/zinc/32/88/50/345328850.db2.gz GTZXFVGDODRBFK-JTQLQIEISA-N 1 2 234.347 2.440 20 0 BEADLO CCc1c[nH]c(CC(=O)N2[C@@H](C)CCC[C@@H]2C)[nH+]1 ZINC000635514033 345407729 /nfs/dbraw/zinc/40/77/29/345407729.db2.gz YTWNSXAKXKYMFV-QWRGUYRKSA-N 1 2 249.358 2.304 20 0 BEADLO C[C@@H]1CCN(C(=O)C2(C)CC2)C[C@@H]1n1cc[nH+]c1 ZINC000159091808 345409231 /nfs/dbraw/zinc/40/92/31/345409231.db2.gz YSFIALZLBPAHHM-NEPJUHHUSA-N 1 2 247.342 2.093 20 0 BEADLO c1ccc(N2CCC[C@@]3(CCCOC3)C2)[nH+]c1 ZINC000080688424 345434334 /nfs/dbraw/zinc/43/43/34/345434334.db2.gz NHTHVZHKRIWGNH-CQSZACIVSA-N 1 2 232.327 2.479 20 0 BEADLO OCc1cc[nH+]c(NC[C@@H]2CC[C@@H]3C[C@@H]3C2)c1 ZINC000641675763 362595600 /nfs/dbraw/zinc/59/56/00/362595600.db2.gz CUXGRXPAOWZRKO-RTXFEEFZSA-N 1 2 232.327 2.422 20 0 BEADLO OCc1cc[nH+]c(NC[C@@H]2CC[C@H]3C[C@H]3C2)c1 ZINC000641675761 362595708 /nfs/dbraw/zinc/59/57/08/362595708.db2.gz CUXGRXPAOWZRKO-KGYLQXTDSA-N 1 2 232.327 2.422 20 0 BEADLO Fc1c[nH+]ccc1NCCCc1ccco1 ZINC000641670902 362589871 /nfs/dbraw/zinc/58/98/71/362589871.db2.gz RLHATWSKQAOSBW-UHFFFAOYSA-N 1 2 220.247 2.280 20 0 BEADLO Cc1ccc(CCNc2cncc(Cl)n2)c[nH+]1 ZINC000080981810 345458274 /nfs/dbraw/zinc/45/82/74/345458274.db2.gz SQFCOKRRLXHDRG-UHFFFAOYSA-N 1 2 248.717 2.488 20 0 BEADLO Cc1nc2[nH]ccc2c(NCCn2cccc2)[nH+]1 ZINC000081011362 345461133 /nfs/dbraw/zinc/46/11/33/345461133.db2.gz VACMLIDSWUOPAR-UHFFFAOYSA-N 1 2 241.298 2.180 20 0 BEADLO COC(=O)[C@](C)([NH2+]Cc1ccccc1C)C1CC1 ZINC000081154046 345463554 /nfs/dbraw/zinc/46/35/54/345463554.db2.gz TVSGWOOYULJXHI-OAHLLOKOSA-N 1 2 247.338 2.426 20 0 BEADLO CCC[C@H]1[C@@H](C)CCCN1C(=O)Cn1cc[nH+]c1 ZINC000081473005 345476259 /nfs/dbraw/zinc/47/62/59/345476259.db2.gz UNEUSRYLMRZRFR-STQMWFEESA-N 1 2 249.358 2.310 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C1CCC=CCC1 ZINC000635535313 345486956 /nfs/dbraw/zinc/48/69/56/345486956.db2.gz MBTYFBLBEHADHN-UHFFFAOYSA-N 1 2 230.311 2.497 20 0 BEADLO C[C@H](CCO)CNc1cc[nH+]c2ccncc12 ZINC000085688835 345528568 /nfs/dbraw/zinc/52/85/68/345528568.db2.gz SZNWLWWAMNZVBU-SNVBAGLBSA-N 1 2 231.299 2.060 20 0 BEADLO c1cc2[nH+]ccc(N[C@@H]3CCCOC3)c2cn1 ZINC000085684757 345528633 /nfs/dbraw/zinc/52/86/33/345528633.db2.gz KPIAANDZPOIUGZ-SNVBAGLBSA-N 1 2 229.283 2.221 20 0 BEADLO C[C@@H](CCO)CNc1cc[nH+]c2ccncc12 ZINC000085688834 345528645 /nfs/dbraw/zinc/52/86/45/345528645.db2.gz SZNWLWWAMNZVBU-JTQLQIEISA-N 1 2 231.299 2.060 20 0 BEADLO C[C@H](O)C[C@H](C)CNc1cc[nH+]c2ccncc12 ZINC000085687901 345528679 /nfs/dbraw/zinc/52/86/79/345528679.db2.gz VXEGRXGYLCSOBS-QWRGUYRKSA-N 1 2 245.326 2.449 20 0 BEADLO CC[C@@H](CCO)Nc1cc[nH+]c2ccncc12 ZINC000085687942 345528975 /nfs/dbraw/zinc/52/89/75/345528975.db2.gz ZBLFIZGBLDJTGE-JTQLQIEISA-N 1 2 231.299 2.203 20 0 BEADLO Cc1nn(C)c(C)c1CCCNc1cccc[nH+]1 ZINC000089265040 345552192 /nfs/dbraw/zinc/55/21/92/345552192.db2.gz BGFYVFQTORPDMU-UHFFFAOYSA-N 1 2 244.342 2.477 20 0 BEADLO CC[C@@H](C)CN(C)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635545477 345568520 /nfs/dbraw/zinc/56/85/20/345568520.db2.gz CKESKZLQGFKJRF-GMTAPVOTSA-N 1 2 235.331 2.018 20 0 BEADLO CC[C@@H](C)CN(C)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635545477 345568522 /nfs/dbraw/zinc/56/85/22/345568522.db2.gz CKESKZLQGFKJRF-GMTAPVOTSA-N 1 2 235.331 2.018 20 0 BEADLO COCCC1CCN(c2cc[nH+]cc2F)CC1 ZINC000641675842 362596754 /nfs/dbraw/zinc/59/67/54/362596754.db2.gz HBKWYFXYVIWTTB-UHFFFAOYSA-N 1 2 238.306 2.474 20 0 BEADLO Cc1ccoc1C[N@H+]1CCC[C@H]1c1nncn1C ZINC000093810259 345664601 /nfs/dbraw/zinc/66/46/01/345664601.db2.gz TVSLPFYTCQLZGZ-NSHDSACASA-N 1 2 246.314 2.054 20 0 BEADLO Cc1ccoc1C[N@@H+]1CCC[C@H]1c1nncn1C ZINC000093810259 345664604 /nfs/dbraw/zinc/66/46/04/345664604.db2.gz TVSLPFYTCQLZGZ-NSHDSACASA-N 1 2 246.314 2.054 20 0 BEADLO CC(C)(C)OC(=O)CCCCn1cc[nH+]c1 ZINC000182104688 187309033 /nfs/dbraw/zinc/30/90/33/187309033.db2.gz BJBICJCEIUPNHT-UHFFFAOYSA-N 1 2 224.304 2.395 20 0 BEADLO C[N@H+](Cc1ccc(Cl)o1)Cc1cnccn1 ZINC000092590719 345640437 /nfs/dbraw/zinc/64/04/37/345640437.db2.gz WYNOTILFUIRNEJ-UHFFFAOYSA-N 1 2 237.690 2.355 20 0 BEADLO C[N@@H+](Cc1ccc(Cl)o1)Cc1cnccn1 ZINC000092590719 345640438 /nfs/dbraw/zinc/64/04/38/345640438.db2.gz WYNOTILFUIRNEJ-UHFFFAOYSA-N 1 2 237.690 2.355 20 0 BEADLO COCc1cc(C[NH2+]Cc2ccoc2C)no1 ZINC000641710032 362619060 /nfs/dbraw/zinc/61/90/60/362619060.db2.gz SWLGYKBJFYGOQI-UHFFFAOYSA-N 1 2 236.271 2.012 20 0 BEADLO CCc1nsc(Nc2ccc(N(C)C)[nH+]c2)n1 ZINC000092584791 345640933 /nfs/dbraw/zinc/64/09/33/345640933.db2.gz YWWLLIHPZMELAN-UHFFFAOYSA-N 1 2 249.343 2.305 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2ncn(C)n2)s1 ZINC000090969799 178893533 /nfs/dbraw/zinc/89/35/33/178893533.db2.gz KNKYIXIPNMPXNB-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO COc1cc[nH+]cc1NCc1ncc(C)s1 ZINC000449204409 201836441 /nfs/dbraw/zinc/83/64/41/201836441.db2.gz JDWRKSKZSOOTSF-UHFFFAOYSA-N 1 2 235.312 2.467 20 0 BEADLO Cc1cc2ccccc2[nH+]c1N1C[C@@H]2C[C@]2(O)C1 ZINC000641713581 362626588 /nfs/dbraw/zinc/62/65/88/362626588.db2.gz OBIQHBOREMHBLC-WFASDCNBSA-N 1 2 240.306 2.114 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccc3c(n2)CCC3)no1 ZINC000641710318 362626720 /nfs/dbraw/zinc/62/67/20/362626720.db2.gz SBEIEFPUOBMTQJ-UHFFFAOYSA-N 1 2 243.310 2.157 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1coc(C)c1 ZINC000189224024 259384195 /nfs/dbraw/zinc/38/41/95/259384195.db2.gz ASKVJTZEIZBPIK-UHFFFAOYSA-N 1 2 232.239 2.244 20 0 BEADLO COC[C@H](C)Nc1ccc2cc(OC)ccc2[nH+]1 ZINC000641719396 362634047 /nfs/dbraw/zinc/63/40/47/362634047.db2.gz SXAHXTNWJSINDO-JTQLQIEISA-N 1 2 246.310 2.112 20 0 BEADLO Cc1ccc(C[N@@H+]2CCc3nc(C)ncc3C2)o1 ZINC000139423105 345692317 /nfs/dbraw/zinc/69/23/17/345692317.db2.gz IPZOIAVDGKXZEO-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1ccc(C[N@H+]2CCc3nc(C)ncc3C2)o1 ZINC000139423105 345692318 /nfs/dbraw/zinc/69/23/18/345692318.db2.gz IPZOIAVDGKXZEO-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO c1cn(-c2ccccc2OC[C@H]2CCCO2)c[nH+]1 ZINC000221740795 345747595 /nfs/dbraw/zinc/74/75/95/345747595.db2.gz ATRLHKDJANBNPR-GFCCVEGCSA-N 1 2 244.294 2.430 20 0 BEADLO Clc1snnc1C[N@@H+]1CC[C@@H](C2CC2)C1 ZINC000307536027 345808799 /nfs/dbraw/zinc/80/87/99/345808799.db2.gz KQXNAZKOUKIWDM-MRVPVSSYSA-N 1 2 243.763 2.423 20 0 BEADLO Clc1snnc1C[N@H+]1CC[C@@H](C2CC2)C1 ZINC000307536027 345808800 /nfs/dbraw/zinc/80/88/00/345808800.db2.gz KQXNAZKOUKIWDM-MRVPVSSYSA-N 1 2 243.763 2.423 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H]1CCC1(C)C ZINC000668419964 537910905 /nfs/dbraw/zinc/91/09/05/537910905.db2.gz QVBPGRBXPJXIQM-SNVBAGLBSA-N 1 2 218.300 2.187 20 0 BEADLO C[C@@H](NC(=O)c1ccc(F)cc1)c1[nH]cc[nH+]1 ZINC000139440652 345796542 /nfs/dbraw/zinc/79/65/42/345796542.db2.gz URRHXUYTEBECQA-MRVPVSSYSA-N 1 2 233.246 2.040 20 0 BEADLO C[C@@H](NC(=O)c1ccccc1F)c1[nH]cc[nH+]1 ZINC000139439360 345796645 /nfs/dbraw/zinc/79/66/45/345796645.db2.gz IVHSIBLLBYGYMK-MRVPVSSYSA-N 1 2 233.246 2.040 20 0 BEADLO C[C@@H]1C[C@H](Nc2cc[nH+]c(C(C)(C)C)n2)[C@H](C)O1 ZINC000631466250 345854178 /nfs/dbraw/zinc/85/41/78/345854178.db2.gz UCFUWQDOYAPUNO-VWYCJHECSA-N 1 2 249.358 2.174 20 0 BEADLO C[C@@H]1C[C@@H](Nc2cc[nH+]c(C(C)(C)C)n2)[C@@H](C)O1 ZINC000631465999 345854267 /nfs/dbraw/zinc/85/42/67/345854267.db2.gz UCFUWQDOYAPUNO-GMTAPVOTSA-N 1 2 249.358 2.174 20 0 BEADLO Cc1nc(NC[C@@H]2CC23CC3)c2c([nH+]1)CCCC2 ZINC000418984387 192091274 /nfs/dbraw/zinc/09/12/74/192091274.db2.gz DCTXHGPHSWGRSE-NSHDSACASA-N 1 2 243.354 2.298 20 0 BEADLO C[C@@H]1[C@@H](C)CCCN1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635604719 345888942 /nfs/dbraw/zinc/88/89/42/345888942.db2.gz WJBSBLZKGIKJGR-IRCOFANPSA-N 1 2 247.342 2.160 20 0 BEADLO C[C@@H]1[C@@H](C)CCCN1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635604719 345888943 /nfs/dbraw/zinc/88/89/43/345888943.db2.gz WJBSBLZKGIKJGR-IRCOFANPSA-N 1 2 247.342 2.160 20 0 BEADLO c1cc(OCCOCC2CCC2)cc[nH+]1 ZINC000418956496 192092340 /nfs/dbraw/zinc/09/23/40/192092340.db2.gz SGOIDCWWKLINFI-UHFFFAOYSA-N 1 2 207.273 2.277 20 0 BEADLO C[C@H]1CC[C@H](C)N(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635632863 345911213 /nfs/dbraw/zinc/91/12/13/345911213.db2.gz VEZKOZDZOZMUMA-NNYUYHANSA-N 1 2 247.342 2.160 20 0 BEADLO C[C@H]1CC[C@H](C)N(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635632863 345911217 /nfs/dbraw/zinc/91/12/17/345911217.db2.gz VEZKOZDZOZMUMA-NNYUYHANSA-N 1 2 247.342 2.160 20 0 BEADLO CC(C)C[C@H](C(=O)NCC1(C)CC1)n1cc[nH+]c1 ZINC000635646254 345922551 /nfs/dbraw/zinc/92/25/51/345922551.db2.gz MLZTWNIQWCCVGO-GFCCVEGCSA-N 1 2 249.358 2.387 20 0 BEADLO O[C@H]1C[C@H](Nc2ccc3ccccc3[nH+]2)C1 ZINC000145313983 345933747 /nfs/dbraw/zinc/93/37/47/345933747.db2.gz 1 2 214.268 2.170 20 0 BEADLO CCCCN(CCCC)c1cc(N)nc[nH+]1 ZINC000087801205 345940917 /nfs/dbraw/zinc/94/09/17/345940917.db2.gz HSEOBHUZKNCZPL-UHFFFAOYSA-N 1 2 222.336 2.465 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@@H]2CCC[C@@H]2CC)[nH+]1 ZINC000635676940 345972388 /nfs/dbraw/zinc/97/23/88/345972388.db2.gz OQQZNZUUHZVPDD-CMPLNLGQSA-N 1 2 249.358 2.210 20 0 BEADLO CC[C@@H]1CCC[C@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635677440 345974511 /nfs/dbraw/zinc/97/45/11/345974511.db2.gz SDPLFVRZRFBFOA-DDHJBXDOSA-N 1 2 247.342 2.208 20 0 BEADLO CC[C@@H]1CCC[C@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635677440 345974514 /nfs/dbraw/zinc/97/45/14/345974514.db2.gz SDPLFVRZRFBFOA-DDHJBXDOSA-N 1 2 247.342 2.208 20 0 BEADLO CC(C)C[C@@H](C(=O)NC1CC=CC1)n1cc[nH+]c1 ZINC000635682337 345976212 /nfs/dbraw/zinc/97/62/12/345976212.db2.gz MICNWOGMTQELTJ-ZDUSSCGKSA-N 1 2 247.342 2.305 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CC[C@](C)(CC)C2)[nH+]1 ZINC000635683523 345976988 /nfs/dbraw/zinc/97/69/88/345976988.db2.gz ULQJPSBSMAFDHE-AWEZNQCLSA-N 1 2 249.358 2.163 20 0 BEADLO CCCC1(C(=O)NCc2c[nH+]c(CC)[nH]2)CC1 ZINC001639092807 1172070437 /nfs/dbraw/zinc/07/04/37/1172070437.db2.gz BWFXPQNNUJYLGF-UHFFFAOYSA-N 1 2 235.331 2.169 20 0 BEADLO CCCC1(C(=O)NCc2c[nH]c(CC)[nH+]2)CC1 ZINC001639092807 1172070445 /nfs/dbraw/zinc/07/04/45/1172070445.db2.gz BWFXPQNNUJYLGF-UHFFFAOYSA-N 1 2 235.331 2.169 20 0 BEADLO CC(C)=C(C)CC(=O)N(C)CCCn1cc[nH+]c1 ZINC000635705149 345991620 /nfs/dbraw/zinc/99/16/20/345991620.db2.gz RYMZVJBDDXMUAC-UHFFFAOYSA-N 1 2 249.358 2.478 20 0 BEADLO CC(C)(O)C1C[NH+](Cc2ccc(Cl)o2)C1 ZINC000335149269 187362959 /nfs/dbraw/zinc/36/29/59/187362959.db2.gz IABIYHUCBBHHGQ-UHFFFAOYSA-N 1 2 229.707 2.136 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CC[C@H](C)[C@@H](C)C2)[nH+]1 ZINC000635752707 346049600 /nfs/dbraw/zinc/04/96/00/346049600.db2.gz MEEHJBSOKNFGIF-QWRGUYRKSA-N 1 2 249.358 2.019 20 0 BEADLO CC(C)=C(C)CC(=O)N[C@H]1CCn2cc[nH+]c2C1 ZINC000635821353 346076631 /nfs/dbraw/zinc/07/66/31/346076631.db2.gz WKQOKCLWMXHANP-LBPRGKRZSA-N 1 2 247.342 2.061 20 0 BEADLO C[C@H]1CC[C@@H](CNC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635882262 346101150 /nfs/dbraw/zinc/10/11/50/346101150.db2.gz VRGSXBNRMUONFI-IRCOFANPSA-N 1 2 247.342 2.066 20 0 BEADLO C[C@H]1CC[C@@H](CNC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635882262 346101152 /nfs/dbraw/zinc/10/11/52/346101152.db2.gz VRGSXBNRMUONFI-IRCOFANPSA-N 1 2 247.342 2.066 20 0 BEADLO C[C@@H]1CCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635892856 346104189 /nfs/dbraw/zinc/10/41/89/346104189.db2.gz DMEAZWMIQCALAB-DDHJBXDOSA-N 1 2 247.342 2.066 20 0 BEADLO C[C@@H]1CCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635892856 346104190 /nfs/dbraw/zinc/10/41/90/346104190.db2.gz DMEAZWMIQCALAB-DDHJBXDOSA-N 1 2 247.342 2.066 20 0 BEADLO CCc1cc(N(C)C[C@@H]2CCCCO2)nc[nH+]1 ZINC000603385039 349941773 /nfs/dbraw/zinc/94/17/73/349941773.db2.gz WIRHZTADJODBLH-LBPRGKRZSA-N 1 2 235.331 2.044 20 0 BEADLO CC(C)C[C@H](C(=O)N[C@H]1CC[C@H]1C)n1cc[nH+]c1 ZINC000635926472 346116956 /nfs/dbraw/zinc/11/69/56/346116956.db2.gz SYSDKVRHQGRKKK-FRRDWIJNSA-N 1 2 249.358 2.385 20 0 BEADLO CC(C)C[C@H](C(=O)N1C[C@H](C)[C@@H]1C)n1cc[nH+]c1 ZINC000635966532 346125788 /nfs/dbraw/zinc/12/57/88/346125788.db2.gz QYPICUVDMXHHSS-RWMBFGLXSA-N 1 2 249.358 2.337 20 0 BEADLO CC1(C)[C@@H](O)CC[N@@H+]1Cc1ncc(Cl)s1 ZINC000336626930 535030069 /nfs/dbraw/zinc/03/00/69/535030069.db2.gz HRWAOUQNYJHEJT-ZETCQYMHSA-N 1 2 246.763 2.142 20 0 BEADLO CC1(C)[C@@H](O)CC[N@H+]1Cc1ncc(Cl)s1 ZINC000336626930 535030071 /nfs/dbraw/zinc/03/00/71/535030071.db2.gz HRWAOUQNYJHEJT-ZETCQYMHSA-N 1 2 246.763 2.142 20 0 BEADLO COc1cnccc1[C@@H](C)[NH2+]Cc1cnc(C)o1 ZINC000628244566 346209058 /nfs/dbraw/zinc/20/90/58/346209058.db2.gz MONZHFMMNJKAMQ-SECBINFHSA-N 1 2 247.298 2.237 20 0 BEADLO Fc1cccnc1C[NH2+]Cc1cnc(C2CC2)o1 ZINC000628229958 346179598 /nfs/dbraw/zinc/17/95/98/346179598.db2.gz NOEFGMGDOKBSRY-UHFFFAOYSA-N 1 2 247.273 2.376 20 0 BEADLO CCOc1ncccc1C[NH2+]Cc1cnc(C)o1 ZINC000628232651 346185263 /nfs/dbraw/zinc/18/52/63/346185263.db2.gz HZCJWNDWCMICKX-UHFFFAOYSA-N 1 2 247.298 2.067 20 0 BEADLO Cc1c[nH]c(CN(C)[C@H](C)c2cccnc2)[nH+]1 ZINC000628237378 346193502 /nfs/dbraw/zinc/19/35/02/346193502.db2.gz LLWDDHBANAUNCG-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CC[C@H](CC(F)(F)F)C2)n1 ZINC000628252725 346229027 /nfs/dbraw/zinc/22/90/27/346229027.db2.gz FAKBVTBZMISEQV-SECBINFHSA-N 1 2 247.264 2.492 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CC[C@H](CC(F)(F)F)C2)n1 ZINC000628252725 346229029 /nfs/dbraw/zinc/22/90/29/346229029.db2.gz FAKBVTBZMISEQV-SECBINFHSA-N 1 2 247.264 2.492 20 0 BEADLO Cc1cccc(C(=O)N(C)Cc2[nH]cc[nH+]2)c1F ZINC000161589781 179005369 /nfs/dbraw/zinc/00/53/69/179005369.db2.gz BBAXIGXDBQXLNO-UHFFFAOYSA-N 1 2 247.273 2.129 20 0 BEADLO CCc1cc(N[C@H](C)c2cn(C)nc2C)nc[nH+]1 ZINC000603390811 349944081 /nfs/dbraw/zinc/94/40/81/349944081.db2.gz OMNYRBDTCONWDV-SECBINFHSA-N 1 2 245.330 2.254 20 0 BEADLO C/C=C/C[C@@H]1CCC[N@H+](CCc2cnn[nH]2)C1 ZINC000626164608 346271347 /nfs/dbraw/zinc/27/13/47/346271347.db2.gz LTIWNTKHJUZUSF-QAVQXKDTSA-N 1 2 234.347 2.025 20 0 BEADLO C/C=C/C[C@@H]1CCC[N@@H+](CCc2cnn[nH]2)C1 ZINC000626164608 346271348 /nfs/dbraw/zinc/27/13/48/346271348.db2.gz LTIWNTKHJUZUSF-QAVQXKDTSA-N 1 2 234.347 2.025 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1C[C@H]1CC(C)C ZINC000380162632 346299170 /nfs/dbraw/zinc/29/91/70/346299170.db2.gz BZNJEPIWFDQFJN-GHMZBOCLSA-N 1 2 235.331 2.017 20 0 BEADLO CC[N@H+](Cc1ccccc1Cl)[C@H](C)C(N)=O ZINC000153590983 346301770 /nfs/dbraw/zinc/30/17/70/346301770.db2.gz DXOLDFAKNBUCKL-SECBINFHSA-N 1 2 240.734 2.036 20 0 BEADLO CC[N@@H+](Cc1ccccc1Cl)[C@H](C)C(N)=O ZINC000153590983 346301773 /nfs/dbraw/zinc/30/17/73/346301773.db2.gz DXOLDFAKNBUCKL-SECBINFHSA-N 1 2 240.734 2.036 20 0 BEADLO C[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)[C@H](C)C1 ZINC000636056840 346303709 /nfs/dbraw/zinc/30/37/09/346303709.db2.gz AQUDAAPBSQBWEX-DDHJBXDOSA-N 1 2 247.342 2.160 20 0 BEADLO C[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)[C@H](C)C1 ZINC000636056840 346303712 /nfs/dbraw/zinc/30/37/12/346303712.db2.gz AQUDAAPBSQBWEX-DDHJBXDOSA-N 1 2 247.342 2.160 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C(C)(C)C ZINC000636129504 346330836 /nfs/dbraw/zinc/33/08/36/346330836.db2.gz UFHZGOHOHJCKNF-OPRDCNLKSA-N 1 2 235.331 2.064 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C(C)(C)C ZINC000636129504 346330839 /nfs/dbraw/zinc/33/08/39/346330839.db2.gz UFHZGOHOHJCKNF-OPRDCNLKSA-N 1 2 235.331 2.064 20 0 BEADLO C/C=C/CNC(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC000636284503 346378208 /nfs/dbraw/zinc/37/82/08/346378208.db2.gz BXNHRXRUHAAOED-ZYOFXKKJSA-N 1 2 235.331 2.163 20 0 BEADLO Oc1cccc2c1CC[C@H]2[NH2+]Cc1ccon1 ZINC000148665001 346384245 /nfs/dbraw/zinc/38/42/45/346384245.db2.gz CBTYJWQSRHMGJC-GFCCVEGCSA-N 1 2 230.267 2.157 20 0 BEADLO Cc1cn2ccc(C(=O)NCC(C)(C)F)cc2[nH+]1 ZINC000636304844 346384355 /nfs/dbraw/zinc/38/43/55/346384355.db2.gz DIQGODCBOLZJDX-UHFFFAOYSA-N 1 2 249.289 2.121 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[NH2+]CC[C@H](C)F ZINC000419172365 192101349 /nfs/dbraw/zinc/10/13/49/192101349.db2.gz JWUXZZGTXAAVKH-QWRGUYRKSA-N 1 2 233.327 2.302 20 0 BEADLO CCCC[C@H]([NH2+]CC[C@H](C)F)C(=O)OC ZINC000419171067 192101353 /nfs/dbraw/zinc/10/13/53/192101353.db2.gz IIEYEIZBKDXVRV-UWVGGRQHSA-N 1 2 219.300 2.056 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2cccc(C)c2)o1 ZINC000298731532 179068509 /nfs/dbraw/zinc/06/85/09/179068509.db2.gz SZAKSUJHSGXNQN-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2cccc(C)c2)o1 ZINC000298731532 179068511 /nfs/dbraw/zinc/06/85/11/179068511.db2.gz SZAKSUJHSGXNQN-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO C[C@H](CC1CCC1)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636328489 346397986 /nfs/dbraw/zinc/39/79/86/346397986.db2.gz FEWYWTYSHDMJFW-YUSALJHKSA-N 1 2 247.342 2.208 20 0 BEADLO C[C@H](CC1CCC1)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636328489 346397990 /nfs/dbraw/zinc/39/79/90/346397990.db2.gz FEWYWTYSHDMJFW-YUSALJHKSA-N 1 2 247.342 2.208 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@@H](C)CC2CCC2)[nH+]1 ZINC000636330600 346399101 /nfs/dbraw/zinc/39/91/01/346399101.db2.gz QHICFGIXMJXNRG-JTQLQIEISA-N 1 2 249.358 2.210 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2cnn(C)c2)c1F ZINC000294509530 179069984 /nfs/dbraw/zinc/06/99/84/179069984.db2.gz COYVIBKPRLRBQZ-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2cnn(C)c2)c1F ZINC000294509530 179069987 /nfs/dbraw/zinc/06/99/87/179069987.db2.gz COYVIBKPRLRBQZ-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO CC1=C[C@H](C)CN(C(=O)C(C)(C)c2c[nH+]c[nH]2)C1 ZINC000621989259 370647054 /nfs/dbraw/zinc/64/70/54/370647054.db2.gz ANMJUMODXNLHBU-JTQLQIEISA-N 1 2 247.342 2.112 20 0 BEADLO c1cc(C[NH2+]Cc2csc(C3CC3)n2)on1 ZINC000574916664 346413712 /nfs/dbraw/zinc/41/37/12/346413712.db2.gz AGTDBUFQNXHBME-UHFFFAOYSA-N 1 2 235.312 2.298 20 0 BEADLO Cc1ncc([C@@H](C)[NH2+][C@@H](C)C(F)F)c(C)n1 ZINC000641792438 362727769 /nfs/dbraw/zinc/72/77/69/362727769.db2.gz VEQZAMMAIWIPNW-SVRRBLITSA-N 1 2 229.274 2.398 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cccc(CO)c1)C(F)F ZINC000641791598 362731842 /nfs/dbraw/zinc/73/18/42/362731842.db2.gz KXEBQJMKXSDEEX-DTWKUNHWSA-N 1 2 229.270 2.483 20 0 BEADLO Cc1cccc(C[NH2+][C@@H](C)c2ncnn2C)c1F ZINC000296758375 179097740 /nfs/dbraw/zinc/09/77/40/179097740.db2.gz KSSFKEBLCWESJK-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO FC(F)C[N@@H+]1CC[C@H](c2ccco2)C1 ZINC000603416346 349963558 /nfs/dbraw/zinc/96/35/58/349963558.db2.gz ZUPSJQRJXJKVAU-QMMMGPOBSA-N 1 2 201.216 2.334 20 0 BEADLO FC(F)C[N@H+]1CC[C@H](c2ccco2)C1 ZINC000603416346 349963563 /nfs/dbraw/zinc/96/35/63/349963563.db2.gz ZUPSJQRJXJKVAU-QMMMGPOBSA-N 1 2 201.216 2.334 20 0 BEADLO Cc1cccc(C[NH2+]Cc2c[nH]cn2)c1 ZINC000054763632 179094484 /nfs/dbraw/zinc/09/44/84/179094484.db2.gz WJPXTBASOJROSB-UHFFFAOYSA-N 1 2 201.273 2.008 20 0 BEADLO Cc1cccc(COCc2[nH]cc[nH+]2)c1 ZINC000123812022 179103281 /nfs/dbraw/zinc/10/32/81/179103281.db2.gz VIOFNKQJBDALRX-UHFFFAOYSA-N 1 2 202.257 2.435 20 0 BEADLO Cc1cccc(F)c1NCc1c[nH+]cn1C ZINC000135093822 179110413 /nfs/dbraw/zinc/11/04/13/179110413.db2.gz PQHYPACOFPUUNN-UHFFFAOYSA-N 1 2 219.263 2.480 20 0 BEADLO Cc1ccc(COCc2ncc[nH]2)c(C)[nH+]1 ZINC000186665758 346529482 /nfs/dbraw/zinc/52/94/82/346529482.db2.gz YONSEAACOSVUGW-UHFFFAOYSA-N 1 2 217.272 2.138 20 0 BEADLO CCc1cccc(NC(=O)Cc2c[nH+]cn2C)c1 ZINC000186751967 346536069 /nfs/dbraw/zinc/53/60/69/346536069.db2.gz AGYKZCZWPORFBH-UHFFFAOYSA-N 1 2 243.310 2.164 20 0 BEADLO Cc1cc(C)c(CNC(=O)N[C@@H]2CC23CC3)c[nH+]1 ZINC000580710584 346537168 /nfs/dbraw/zinc/53/71/68/346537168.db2.gz JMEKDGMFKCZTPJ-GFCCVEGCSA-N 1 2 245.326 2.050 20 0 BEADLO CC[C@H]1CC[C@@H]1[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000390516670 259391971 /nfs/dbraw/zinc/39/19/71/259391971.db2.gz DFUSKTLBWFSTHX-DCAQKATOSA-N 1 2 227.348 2.495 20 0 BEADLO CC(=O)CCC(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC000201810037 346577106 /nfs/dbraw/zinc/57/71/06/346577106.db2.gz ZHGSYGXYOPGBQL-UHFFFAOYSA-N 1 2 245.282 2.179 20 0 BEADLO c1csc(C[NH2+]Cc2ccc3nc[nH]c3c2)n1 ZINC000589643045 346721840 /nfs/dbraw/zinc/72/18/40/346721840.db2.gz XUWZHQXMSUIPTD-UHFFFAOYSA-N 1 2 244.323 2.309 20 0 BEADLO Cc1cccc(NCCN(C)CC(F)(F)F)[nH+]1 ZINC000274579711 179144825 /nfs/dbraw/zinc/14/48/25/179144825.db2.gz HGXIJZFTXGMCQS-UHFFFAOYSA-N 1 2 247.264 2.296 20 0 BEADLO Cc1ccnc([C@H](C)[NH2+]Cc2ncccn2)c1 ZINC000580213616 346691607 /nfs/dbraw/zinc/69/16/07/346691607.db2.gz BPUVNJXKHUIYBI-NSHDSACASA-N 1 2 228.299 2.031 20 0 BEADLO CC(C)[C@@H]1C[N@@H+]([C@H](C)c2cccnc2)CCN1C ZINC000336605968 187370979 /nfs/dbraw/zinc/37/09/79/187370979.db2.gz KUQKYRCKGYQJOM-HIFRSBDPSA-N 1 2 247.386 2.415 20 0 BEADLO CC(C)[C@@H]1C[N@H+]([C@H](C)c2cccnc2)CCN1C ZINC000336605968 187370981 /nfs/dbraw/zinc/37/09/81/187370981.db2.gz KUQKYRCKGYQJOM-HIFRSBDPSA-N 1 2 247.386 2.415 20 0 BEADLO CC(C)(C)C1CC(NC(=O)CCc2c[nH+]c[nH]2)C1 ZINC000580669020 365866573 /nfs/dbraw/zinc/86/65/73/365866573.db2.gz ZKZYTSOVNDPUGH-UHFFFAOYSA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)(C)C1CC(NC(=O)CCc2c[nH]c[nH+]2)C1 ZINC000580669020 365866582 /nfs/dbraw/zinc/86/65/82/365866582.db2.gz ZKZYTSOVNDPUGH-UHFFFAOYSA-N 1 2 249.358 2.283 20 0 BEADLO CCc1nc(C[N@@H+]2CCCO[C@H](C)C2)cs1 ZINC000170767045 346795851 /nfs/dbraw/zinc/79/58/51/346795851.db2.gz DXKZWQFLRPUZOK-SNVBAGLBSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nc(C[N@H+]2CCCO[C@H](C)C2)cs1 ZINC000170767045 346795853 /nfs/dbraw/zinc/79/58/53/346795853.db2.gz DXKZWQFLRPUZOK-SNVBAGLBSA-N 1 2 240.372 2.316 20 0 BEADLO Cc1[nH]ncc1C[NH2+]CCOc1cccc(C)c1 ZINC000042267793 179168670 /nfs/dbraw/zinc/16/86/70/179168670.db2.gz WWIQJWORWPYTPX-UHFFFAOYSA-N 1 2 245.326 2.195 20 0 BEADLO Cc1cc(F)ccc1Cc1noc(C[NH+](C)C)n1 ZINC000577179320 365862833 /nfs/dbraw/zinc/86/28/33/365862833.db2.gz BOPSVCKZOVCMJJ-UHFFFAOYSA-N 1 2 249.289 2.170 20 0 BEADLO CC(C)[C@@H](NC(=O)[C@H]1C[C@@H]1C1CC1)c1[nH]cc[nH+]1 ZINC000582043982 347125253 /nfs/dbraw/zinc/12/52/53/347125253.db2.gz LLDIPYCVQIDSPJ-GRYCIOLGSA-N 1 2 247.342 2.269 20 0 BEADLO CCc1nc(C[NH2+][C@@H](C)c2cn[nH]c2)cs1 ZINC000309957778 347205475 /nfs/dbraw/zinc/20/54/75/347205475.db2.gz JJLCJFSMSOUAMB-QMMMGPOBSA-N 1 2 236.344 2.279 20 0 BEADLO C[C@H]([NH2+]CC(C)(F)F)c1cccnc1 ZINC000382195241 347226974 /nfs/dbraw/zinc/22/69/74/347226974.db2.gz CXHVDPHFDYANIY-QMMMGPOBSA-N 1 2 200.232 2.387 20 0 BEADLO Cc1cc(N2C[C@@H](O)C(C)(C)C2)nc(C(C)C)[nH+]1 ZINC000388198856 347231948 /nfs/dbraw/zinc/23/19/48/347231948.db2.gz SDZUDLFAVXWVRG-LLVKDONJSA-N 1 2 249.358 2.116 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1cnc(C)o1 ZINC000628296419 347244043 /nfs/dbraw/zinc/24/40/43/347244043.db2.gz KQSAHJSLFBMFAX-UHFFFAOYSA-N 1 2 235.287 2.165 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1cnc(C)o1 ZINC000628296419 347244045 /nfs/dbraw/zinc/24/40/45/347244045.db2.gz KQSAHJSLFBMFAX-UHFFFAOYSA-N 1 2 235.287 2.165 20 0 BEADLO Cc1cccc([C@H](C)[NH2+][C@H]2CCOC2=O)c1C ZINC000115603298 179197675 /nfs/dbraw/zinc/19/76/75/179197675.db2.gz RLELPJIYXOYHKM-AAEUAGOBSA-N 1 2 233.311 2.270 20 0 BEADLO CCC(F)(F)C[NH2+][C@H]1CCCn2nccc21 ZINC000624148871 347280165 /nfs/dbraw/zinc/28/01/65/347280165.db2.gz PZYLOAKCANYPNA-VIFPVBQESA-N 1 2 229.274 2.353 20 0 BEADLO Cc1cc(NC(=O)c2ccncc2)cc[nH+]1 ZINC000072709686 347284028 /nfs/dbraw/zinc/28/40/28/347284028.db2.gz UXTWEENOYXXRKI-UHFFFAOYSA-N 1 2 213.240 2.037 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccc(C)cc1C)C(=O)OC ZINC000190197197 347323475 /nfs/dbraw/zinc/32/34/75/347323475.db2.gz IUWWXJULMSMLEG-CYBMUJFWSA-N 1 2 235.327 2.345 20 0 BEADLO CC[C@@H]1CCC[C@@H](NC(=O)CCc2c[nH+]c[nH]2)C1 ZINC000193329446 347395803 /nfs/dbraw/zinc/39/58/03/347395803.db2.gz QOOTWIFGZBGBHM-VXGBXAGGSA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@@H]1CCC[C@@H](NC(=O)CCc2c[nH]c[nH+]2)C1 ZINC000193329446 347395807 /nfs/dbraw/zinc/39/58/07/347395807.db2.gz QOOTWIFGZBGBHM-VXGBXAGGSA-N 1 2 249.358 2.427 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)CCC1CCCC1 ZINC000616921715 347451428 /nfs/dbraw/zinc/45/14/28/347451428.db2.gz AKQAMFYGQMEUAX-UHFFFAOYSA-N 1 2 235.331 2.339 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)CCC1CCCC1 ZINC000616921715 347451431 /nfs/dbraw/zinc/45/14/31/347451431.db2.gz AKQAMFYGQMEUAX-UHFFFAOYSA-N 1 2 235.331 2.339 20 0 BEADLO C[C@@H]1CCCC[C@H]1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616921609 347451755 /nfs/dbraw/zinc/45/17/55/347451755.db2.gz XGMBTBSSKKSOTQ-ZYHUDNBSSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@@H]1CCCC[C@H]1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616921609 347451757 /nfs/dbraw/zinc/45/17/57/347451757.db2.gz XGMBTBSSKKSOTQ-ZYHUDNBSSA-N 1 2 235.331 2.194 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)[C@H]1CCCC2(CC2)C1 ZINC000616922144 347452685 /nfs/dbraw/zinc/45/26/85/347452685.db2.gz QVKNYYLEBULOIF-NSHDSACASA-N 1 2 247.342 2.339 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)[C@H]1CCCC2(CC2)C1 ZINC000616922144 347452686 /nfs/dbraw/zinc/45/26/86/347452686.db2.gz QVKNYYLEBULOIF-NSHDSACASA-N 1 2 247.342 2.339 20 0 BEADLO C[C@H]1C[C@H](C(=O)N(C)Cc2c[nH+]c[nH]2)C[C@@H](C)C1 ZINC000616927521 347455111 /nfs/dbraw/zinc/45/51/11/347455111.db2.gz KNIFCWFZKJPJRA-GDNZZTSVSA-N 1 2 249.358 2.440 20 0 BEADLO C[C@H]1C[C@H](C(=O)N(C)Cc2c[nH]c[nH+]2)C[C@@H](C)C1 ZINC000616927521 347455113 /nfs/dbraw/zinc/45/51/13/347455113.db2.gz KNIFCWFZKJPJRA-GDNZZTSVSA-N 1 2 249.358 2.440 20 0 BEADLO CC[C@@H](C)[C@@H]([NH2+]Cc1cccs1)C(=O)OC ZINC000035036742 358453190 /nfs/dbraw/zinc/45/31/90/358453190.db2.gz CDJAKAAQQBSCCG-MWLCHTKSSA-N 1 2 241.356 2.425 20 0 BEADLO C[C@@H](NC(=O)CCC1CCC1)c1[nH]cc[nH+]1 ZINC000571469817 323145671 /nfs/dbraw/zinc/14/56/71/323145671.db2.gz HOKFZJIJJSLRMI-SECBINFHSA-N 1 2 221.304 2.167 20 0 BEADLO FC1=CCC[N@H+](CCOCC2CCC2)C1 ZINC000419225540 192106814 /nfs/dbraw/zinc/10/68/14/192106814.db2.gz HLGBOLCAJISARC-UHFFFAOYSA-N 1 2 213.296 2.362 20 0 BEADLO FC1=CCC[N@@H+](CCOCC2CCC2)C1 ZINC000419225540 192106815 /nfs/dbraw/zinc/10/68/15/192106815.db2.gz HLGBOLCAJISARC-UHFFFAOYSA-N 1 2 213.296 2.362 20 0 BEADLO C[C@H](CNC(=O)c1ccc2[nH+]ccn2c1)C1CC1 ZINC000590669652 347488374 /nfs/dbraw/zinc/48/83/74/347488374.db2.gz AINCUXWNCLPCOA-SNVBAGLBSA-N 1 2 243.310 2.110 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)N(C)Cc2c[nH+]c[nH]2)C[C@H]1C ZINC000616928730 347495064 /nfs/dbraw/zinc/49/50/64/347495064.db2.gz KCAPNHPHXPHOOH-IJLUTSLNSA-N 1 2 249.358 2.440 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)N(C)Cc2c[nH]c[nH+]2)C[C@H]1C ZINC000616928730 347495066 /nfs/dbraw/zinc/49/50/66/347495066.db2.gz KCAPNHPHXPHOOH-IJLUTSLNSA-N 1 2 249.358 2.440 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)C[C@H]1C=CCCC1 ZINC000616927125 347459282 /nfs/dbraw/zinc/45/92/82/347459282.db2.gz AJDDENKYQLWUSX-NSHDSACASA-N 1 2 233.315 2.115 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)C[C@H]1C=CCCC1 ZINC000616927125 347459284 /nfs/dbraw/zinc/45/92/84/347459284.db2.gz AJDDENKYQLWUSX-NSHDSACASA-N 1 2 233.315 2.115 20 0 BEADLO CC(C)C(C)(C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616927156 347459459 /nfs/dbraw/zinc/45/94/59/347459459.db2.gz BJBDKMHQNCTLHR-UHFFFAOYSA-N 1 2 223.320 2.050 20 0 BEADLO CC(C)C(C)(C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616927156 347459460 /nfs/dbraw/zinc/45/94/60/347459460.db2.gz BJBDKMHQNCTLHR-UHFFFAOYSA-N 1 2 223.320 2.050 20 0 BEADLO CCc1cc(NCCC(F)(F)F)nc[nH+]1 ZINC000063100565 347515900 /nfs/dbraw/zinc/51/59/00/347515900.db2.gz QSYHLKUYTFSVSO-UHFFFAOYSA-N 1 2 219.210 2.403 20 0 BEADLO CC[C@H](C)N(CC)C(=O)[C@H]1CCn2c[nH+]cc2C1 ZINC000616978947 347562091 /nfs/dbraw/zinc/56/20/91/347562091.db2.gz JUSYHCVBAORMGB-RYUDHWBXSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1csc(CCNc2cc[nH+]c(C)n2)n1 ZINC000063134377 347591309 /nfs/dbraw/zinc/59/13/09/347591309.db2.gz TWIYDHMPKORGNE-UHFFFAOYSA-N 1 2 234.328 2.205 20 0 BEADLO CC1(C)CCN(C(=O)CCCn2cc[nH+]c2)CC1 ZINC000591185813 347625792 /nfs/dbraw/zinc/62/57/92/347625792.db2.gz JSXCXOLXHVWNGG-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO Cc1ccccc1C[N@H+](C)Cc1ncc[nH]1 ZINC000109825282 179269446 /nfs/dbraw/zinc/26/94/46/179269446.db2.gz YZHLHXOWPBWANQ-UHFFFAOYSA-N 1 2 215.300 2.350 20 0 BEADLO Cc1ccccc1C[N@@H+](C)Cc1ncc[nH]1 ZINC000109825282 179269448 /nfs/dbraw/zinc/26/94/48/179269448.db2.gz YZHLHXOWPBWANQ-UHFFFAOYSA-N 1 2 215.300 2.350 20 0 BEADLO C[C@@H]1C[N@H+](CC(F)F)C[C@H]1C(=O)OC(C)(C)C ZINC000591060895 347611824 /nfs/dbraw/zinc/61/18/24/347611824.db2.gz IKKXWCFGMWYRHU-RKDXNWHRSA-N 1 2 249.301 2.161 20 0 BEADLO C[C@@H]1C[N@@H+](CC(F)F)C[C@H]1C(=O)OC(C)(C)C ZINC000591060895 347611826 /nfs/dbraw/zinc/61/18/26/347611826.db2.gz IKKXWCFGMWYRHU-RKDXNWHRSA-N 1 2 249.301 2.161 20 0 BEADLO Cc1ccccc1C[N@H+]1CCN(C(C)C)C(=O)C1 ZINC000356346143 179275269 /nfs/dbraw/zinc/27/52/69/179275269.db2.gz BTHUUDPPTIHUOH-UHFFFAOYSA-N 1 2 246.354 2.048 20 0 BEADLO Cc1ccccc1C[N@@H+]1CCN(C(C)C)C(=O)C1 ZINC000356346143 179275270 /nfs/dbraw/zinc/27/52/70/179275270.db2.gz BTHUUDPPTIHUOH-UHFFFAOYSA-N 1 2 246.354 2.048 20 0 BEADLO CO[C@@H]1C[C@@H](Nc2cccc[nH+]2)C12CCC2 ZINC000334533975 133689899 /nfs/dbraw/zinc/68/98/99/133689899.db2.gz GKAPYFFBVWVFTL-GHMZBOCLSA-N 1 2 218.300 2.451 20 0 BEADLO CCCN(Cc1[nH+]ccn1C)CC(F)(F)F ZINC000591809468 347700139 /nfs/dbraw/zinc/70/01/39/347700139.db2.gz KDZDHXGHQPHWHY-UHFFFAOYSA-N 1 2 235.253 2.194 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@H](n3ccnc3)C2)no1 ZINC000591866727 347707365 /nfs/dbraw/zinc/70/73/65/347707365.db2.gz DQCXOLIPHMGUFM-CYBMUJFWSA-N 1 2 246.314 2.017 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@H](n3ccnc3)C2)no1 ZINC000591866727 347707366 /nfs/dbraw/zinc/70/73/66/347707366.db2.gz DQCXOLIPHMGUFM-CYBMUJFWSA-N 1 2 246.314 2.017 20 0 BEADLO CC[C@H]([NH2+][C@H](C)[C@@H](C)OC)C(=O)OC(C)(C)C ZINC000592401028 347777314 /nfs/dbraw/zinc/77/73/14/347777314.db2.gz WQPHOYBWVAQVDH-MXWKQRLJSA-N 1 2 245.363 2.120 20 0 BEADLO CC[C@H]([NH2+][C@@H](C)[C@H](C)OC)C(=O)OC(C)(C)C ZINC000592401027 347777378 /nfs/dbraw/zinc/77/73/78/347777378.db2.gz WQPHOYBWVAQVDH-DCAQKATOSA-N 1 2 245.363 2.120 20 0 BEADLO CC[C@H](C)[C@H]([NH2+]CC1=CCCC1)C(=O)OC ZINC000592105141 347733878 /nfs/dbraw/zinc/73/38/78/347733878.db2.gz ZDDZWKSSGAIQTB-JQWIXIFHSA-N 1 2 225.332 2.274 20 0 BEADLO CC[N@H+](CCSC)Cc1nc(C(C)C)no1 ZINC000592200481 347751687 /nfs/dbraw/zinc/75/16/87/347751687.db2.gz ZLQINHXACFLSNR-UHFFFAOYSA-N 1 2 243.376 2.378 20 0 BEADLO CC[N@@H+](CCSC)Cc1nc(C(C)C)no1 ZINC000592200481 347751691 /nfs/dbraw/zinc/75/16/91/347751691.db2.gz ZLQINHXACFLSNR-UHFFFAOYSA-N 1 2 243.376 2.378 20 0 BEADLO CCc1nnc(C[N@H+](CC)CCSC)s1 ZINC000592201584 347753957 /nfs/dbraw/zinc/75/39/57/347753957.db2.gz IOKLFRYKURAIKU-UHFFFAOYSA-N 1 2 245.417 2.285 20 0 BEADLO CCc1nnc(C[N@@H+](CC)CCSC)s1 ZINC000592201584 347753959 /nfs/dbraw/zinc/75/39/59/347753959.db2.gz IOKLFRYKURAIKU-UHFFFAOYSA-N 1 2 245.417 2.285 20 0 BEADLO CC[N@H+](CCSC)[C@H](C)c1noc(C)n1 ZINC000592202984 347754556 /nfs/dbraw/zinc/75/45/56/347754556.db2.gz VCXWMEUIRVRVPU-MRVPVSSYSA-N 1 2 229.349 2.124 20 0 BEADLO CC[N@@H+](CCSC)[C@H](C)c1noc(C)n1 ZINC000592202984 347754557 /nfs/dbraw/zinc/75/45/57/347754557.db2.gz VCXWMEUIRVRVPU-MRVPVSSYSA-N 1 2 229.349 2.124 20 0 BEADLO Cc1ccccc1C[NH2+]Cc1c[nH]cn1 ZINC000054765004 179282698 /nfs/dbraw/zinc/28/26/98/179282698.db2.gz NXYMQABXAXQNMH-UHFFFAOYSA-N 1 2 201.273 2.008 20 0 BEADLO CCCN(CCC)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000577282899 365917799 /nfs/dbraw/zinc/91/77/99/365917799.db2.gz CCQAWEOEKNIBRA-LBPRGKRZSA-N 1 2 237.347 2.483 20 0 BEADLO FC(F)O[C@@H]1CCC[N@H+](Cc2cscn2)C1 ZINC000679678226 488363821 /nfs/dbraw/zinc/36/38/21/488363821.db2.gz KTTPZTKOFIASMS-SECBINFHSA-N 1 2 248.298 2.347 20 0 BEADLO FC(F)O[C@@H]1CCC[N@@H+](Cc2cscn2)C1 ZINC000679678226 488363822 /nfs/dbraw/zinc/36/38/22/488363822.db2.gz KTTPZTKOFIASMS-SECBINFHSA-N 1 2 248.298 2.347 20 0 BEADLO CCC(C)(CC)NC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000577294896 365920378 /nfs/dbraw/zinc/92/03/78/365920378.db2.gz PIOBGCSJDQYGAC-SNVBAGLBSA-N 1 2 237.347 2.283 20 0 BEADLO CCC(C)(CC)NC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000577294896 365920386 /nfs/dbraw/zinc/92/03/86/365920386.db2.gz PIOBGCSJDQYGAC-SNVBAGLBSA-N 1 2 237.347 2.283 20 0 BEADLO CCCCC[C@@H]1CCCN1C(=O)Cn1cc[nH+]c1 ZINC000577333186 365926836 /nfs/dbraw/zinc/92/68/36/365926836.db2.gz ROTMILWPQGCFDE-CYBMUJFWSA-N 1 2 249.358 2.454 20 0 BEADLO Cc1ccccc1[C@@H]([NH2+][C@H]1CCOC1=O)C1CC1 ZINC000271976046 179326807 /nfs/dbraw/zinc/32/68/07/179326807.db2.gz DBBBMNYVYKANEO-KBPBESRZSA-N 1 2 245.322 2.351 20 0 BEADLO Cc1nc(N2C[C@@H]3CCCC[C@H]3C2)cc[nH+]1 ZINC000176974323 365951685 /nfs/dbraw/zinc/95/16/85/365951685.db2.gz CWYRHPRXWKARKS-RYUDHWBXSA-N 1 2 217.316 2.411 20 0 BEADLO C[C@H]1CC[C@H](NC(=O)CCCn2cc[nH+]c2)CC1 ZINC000594563800 348072637 /nfs/dbraw/zinc/07/26/37/348072637.db2.gz HHVKWIOYTSLJIC-JOCQHMNTSA-N 1 2 249.358 2.358 20 0 BEADLO Cc1ccccc1[C@H]([NH2+][C@H]1CCOC1=O)C1CC1 ZINC000271976057 179345275 /nfs/dbraw/zinc/34/52/75/179345275.db2.gz DBBBMNYVYKANEO-UONOGXRCSA-N 1 2 245.322 2.351 20 0 BEADLO CCC[C@H]([NH2+]C[C@@]1(C)CC1(F)F)C(=O)OCC ZINC000594733249 348108859 /nfs/dbraw/zinc/10/88/59/348108859.db2.gz ZZONNCMNCWMODG-GXSJLCMTSA-N 1 2 249.301 2.353 20 0 BEADLO CCCC[C@@H]([NH2+]CCc1ccoc1)C(=O)OC ZINC000594726566 348112653 /nfs/dbraw/zinc/11/26/53/348112653.db2.gz MPPCTEIUMBLYQI-GFCCVEGCSA-N 1 2 239.315 2.144 20 0 BEADLO Cc1cccn2cc(CNc3ncccn3)[nH+]c12 ZINC000035451363 179357587 /nfs/dbraw/zinc/35/75/87/179357587.db2.gz FBZPMLGTVMPINR-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO COC(=O)[C@@H]([NH2+]CC1CC=CC1)c1ccccc1 ZINC000595364800 348230551 /nfs/dbraw/zinc/23/05/51/348230551.db2.gz WFWAXNHTVUFVNC-AWEZNQCLSA-N 1 2 245.322 2.457 20 0 BEADLO CC[C@@H](CCO)CNc1cc[nH+]c(C(C)C)n1 ZINC000152407573 323180937 /nfs/dbraw/zinc/18/09/37/323180937.db2.gz AJQASGYOZFAJQF-NSHDSACASA-N 1 2 237.347 2.421 20 0 BEADLO CCc1ncc(C[NH2+]Cc2cnc(C3CC3)o2)o1 ZINC000628300340 348295646 /nfs/dbraw/zinc/29/56/46/348295646.db2.gz AMJAGMRXOMLPAB-UHFFFAOYSA-N 1 2 247.298 2.392 20 0 BEADLO CCCc1ncc(C[NH2+]Cc2cnc(C)o2)o1 ZINC000628300356 348307010 /nfs/dbraw/zinc/30/70/10/348307010.db2.gz BPSSAOROFREMSP-UHFFFAOYSA-N 1 2 235.287 2.213 20 0 BEADLO Cc1cccnc1SCc1[nH+]ccn1C ZINC000286627273 179397540 /nfs/dbraw/zinc/39/75/40/179397540.db2.gz VJLWAWPHPASXKS-UHFFFAOYSA-N 1 2 219.313 2.416 20 0 BEADLO Cc1cccnc1SCc1cc[nH+]c(N)c1 ZINC000335630683 179398108 /nfs/dbraw/zinc/39/81/08/179398108.db2.gz HKWFQGJNZDVNHR-UHFFFAOYSA-N 1 2 231.324 2.490 20 0 BEADLO COC(=O)[C@@](C)(CCF)[NH2+]CCCC1CCC1 ZINC000595772328 348337420 /nfs/dbraw/zinc/33/74/20/348337420.db2.gz JKRHCOQHJBWSMF-CYBMUJFWSA-N 1 2 245.338 2.448 20 0 BEADLO CC/C=C/CC[NH2+][C@](C)(CCF)C(=O)OC ZINC000595776569 348338634 /nfs/dbraw/zinc/33/86/34/348338634.db2.gz TZHJONAKRFBXPT-BTDICHCPSA-N 1 2 231.311 2.224 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)[C@H](C)C2CC2)[nH+]1 ZINC001639423359 1172104544 /nfs/dbraw/zinc/10/45/44/1172104544.db2.gz GWUQCXPOUVSBNW-SECBINFHSA-N 1 2 235.331 2.195 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)[C@H](C)C2CC2)c[nH+]1 ZINC001639423359 1172104548 /nfs/dbraw/zinc/10/45/48/1172104548.db2.gz GWUQCXPOUVSBNW-SECBINFHSA-N 1 2 235.331 2.195 20 0 BEADLO CCCC[C@H]([NH2+][C@@H]1C[C@H]1C(C)C)C(=O)OC ZINC000419330424 192124118 /nfs/dbraw/zinc/12/41/18/192124118.db2.gz PROYEXBXEWXCEI-SDDRHHMPSA-N 1 2 227.348 2.352 20 0 BEADLO CC[C@H](C)Nc1cc(CC(=O)OC)cc[nH+]1 ZINC000596047802 348429325 /nfs/dbraw/zinc/42/93/25/348429325.db2.gz AOIUEKGSCIFQLC-VIFPVBQESA-N 1 2 222.288 2.008 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N2CCCCCC2)c1 ZINC000596048937 348429560 /nfs/dbraw/zinc/42/95/60/348429560.db2.gz GICUMEMWNKFJHN-UHFFFAOYSA-N 1 2 248.326 2.178 20 0 BEADLO C[C@@H]1C[N@@H+](CC(=O)OC(C)(C)C)C[C@H](C)S1 ZINC000075891348 349988396 /nfs/dbraw/zinc/98/83/96/349988396.db2.gz GTMNTJSVDSIQTM-AOOOYVTPSA-N 1 2 245.388 2.154 20 0 BEADLO C[C@@H]1C[N@H+](CC(=O)OC(C)(C)C)C[C@H](C)S1 ZINC000075891348 349988398 /nfs/dbraw/zinc/98/83/98/349988398.db2.gz GTMNTJSVDSIQTM-AOOOYVTPSA-N 1 2 245.388 2.154 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@H]2CCC[C@H]2C)c1 ZINC000596115285 348442503 /nfs/dbraw/zinc/44/25/03/348442503.db2.gz UDPVGJWTZARHIS-PWSUYJOCSA-N 1 2 248.326 2.398 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N2C[C@H](C)C[C@H]2C)c1 ZINC000596135719 348447822 /nfs/dbraw/zinc/44/78/22/348447822.db2.gz KONAETDSASDBJX-GHMZBOCLSA-N 1 2 248.326 2.032 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N2CC[C@@H](C)[C@@H]2C)c1 ZINC000596148568 348451991 /nfs/dbraw/zinc/45/19/91/348451991.db2.gz CMIUZJYAVOPFTO-MNOVXSKESA-N 1 2 248.326 2.032 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N2CC[C@H](C)[C@@H]2C)c1 ZINC000596148569 348452399 /nfs/dbraw/zinc/45/23/99/348452399.db2.gz CMIUZJYAVOPFTO-QWRGUYRKSA-N 1 2 248.326 2.032 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@H](C)C2CCC2)c1 ZINC000596174270 348461573 /nfs/dbraw/zinc/46/15/73/348461573.db2.gz JOCMJIVPQFGYHZ-SNVBAGLBSA-N 1 2 248.326 2.398 20 0 BEADLO Cc1nocc1CSCCn1cc[nH+]c1 ZINC000596381707 348517451 /nfs/dbraw/zinc/51/74/51/348517451.db2.gz HLNABIMRTKCGCY-UHFFFAOYSA-N 1 2 223.301 2.113 20 0 BEADLO C[C@H]1CC[C@H](C(=O)N2CCc3[nH]c[nH+]c3C2)CC1 ZINC000627374299 348575098 /nfs/dbraw/zinc/57/50/98/348575098.db2.gz PWMWOJDYXVCLRX-XYPYZODXSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@H]1CC[C@H](C(=O)N2CCc3[nH+]c[nH]c3C2)CC1 ZINC000627374299 348575102 /nfs/dbraw/zinc/57/51/02/348575102.db2.gz PWMWOJDYXVCLRX-XYPYZODXSA-N 1 2 247.342 2.121 20 0 BEADLO COc1ccc(F)cc1C[N@@H+]1CCOC[C@H]1C ZINC000073617581 352539501 /nfs/dbraw/zinc/53/95/01/352539501.db2.gz WHRDLYITERXMGF-SNVBAGLBSA-N 1 2 239.290 2.055 20 0 BEADLO COc1ccc(F)cc1C[N@H+]1CCOC[C@H]1C ZINC000073617581 352539505 /nfs/dbraw/zinc/53/95/05/352539505.db2.gz WHRDLYITERXMGF-SNVBAGLBSA-N 1 2 239.290 2.055 20 0 BEADLO Cc1nc(CN[C@H](C)c2[nH+]ccn2C)cs1 ZINC000070007970 490194111 /nfs/dbraw/zinc/19/41/11/490194111.db2.gz BEMSDOTVWCONMC-MRVPVSSYSA-N 1 2 236.344 2.036 20 0 BEADLO c1cncc(CNc2cc(NC3CC3)[nH+]cn2)c1 ZINC000244447680 349057226 /nfs/dbraw/zinc/05/72/26/349057226.db2.gz YZXCUPKNESREET-UHFFFAOYSA-N 1 2 241.298 2.058 20 0 BEADLO c1cncc(CNc2cc(NC3CC3)nc[nH+]2)c1 ZINC000244447680 349057227 /nfs/dbraw/zinc/05/72/27/349057227.db2.gz YZXCUPKNESREET-UHFFFAOYSA-N 1 2 241.298 2.058 20 0 BEADLO C[C@@H]([NH2+]Cc1ncccn1)c1ccccc1F ZINC000054459559 349033220 /nfs/dbraw/zinc/03/32/20/349033220.db2.gz OGWOUKCLSKIGMR-SNVBAGLBSA-N 1 2 231.274 2.467 20 0 BEADLO c1cnc(C[NH2+][C@@H]2CCc3ccccc32)nc1 ZINC000054459257 349033250 /nfs/dbraw/zinc/03/32/50/349033250.db2.gz FFJNJUWPGOPHJR-CYBMUJFWSA-N 1 2 225.295 2.254 20 0 BEADLO O=C(CCCn1cc[nH+]c1)N1CCC2(CC2)CC1 ZINC000598907235 349060629 /nfs/dbraw/zinc/06/06/29/349060629.db2.gz QZVPEMPUCNWEDC-UHFFFAOYSA-N 1 2 247.342 2.066 20 0 BEADLO Cc1csc(C[NH2+][C@@H]2C[C@H](C)n3ccnc32)n1 ZINC000294134580 179778510 /nfs/dbraw/zinc/77/85/10/179778510.db2.gz OWRJVXGCPQUGFP-VHSXEESVSA-N 1 2 248.355 2.444 20 0 BEADLO Cc1csc(C[NH2+]Cc2ccccn2)n1 ZINC000037988458 179776672 /nfs/dbraw/zinc/77/66/72/179776672.db2.gz ZYCXQJTWUONUNR-UHFFFAOYSA-N 1 2 219.313 2.136 20 0 BEADLO C[C@H]1CC(F)(F)CC[N@@H+]1CC(=O)OC(C)(C)C ZINC000599621782 349229574 /nfs/dbraw/zinc/22/95/74/349229574.db2.gz FTAIBVXIRQYVHO-VIFPVBQESA-N 1 2 249.301 2.448 20 0 BEADLO C[C@H]1CC(F)(F)CC[N@H+]1CC(=O)OC(C)(C)C ZINC000599621782 349229576 /nfs/dbraw/zinc/22/95/76/349229576.db2.gz FTAIBVXIRQYVHO-VIFPVBQESA-N 1 2 249.301 2.448 20 0 BEADLO COC(=O)C[NH2+][C@@H](c1cccc(C)c1)C(C)C ZINC000599626331 349231129 /nfs/dbraw/zinc/23/11/29/349231129.db2.gz DAMZEIQKIHJKLP-CQSZACIVSA-N 1 2 235.327 2.455 20 0 BEADLO CC[C@H](C[NH2+]C(C)(C)C(=O)OC(C)(C)C)OC ZINC000599653336 349234299 /nfs/dbraw/zinc/23/42/99/349234299.db2.gz VELBQWNWKBZSHR-SNVBAGLBSA-N 1 2 245.363 2.121 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCCSCC1 ZINC000583471146 349252247 /nfs/dbraw/zinc/25/22/47/349252247.db2.gz VHCMQFDZQXQVQE-UHFFFAOYSA-N 1 2 223.345 2.037 20 0 BEADLO CC1(C)CCC[C@H]1C(=O)N1CCn2c[nH+]cc2C1 ZINC000290908890 349313302 /nfs/dbraw/zinc/31/33/02/349313302.db2.gz IPLXUNULEWFAPS-LBPRGKRZSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1nc(N(C)CC2(O)CCCC2)c(C)c(C)[nH+]1 ZINC000301771019 179905046 /nfs/dbraw/zinc/90/50/46/179905046.db2.gz KSSOPRRAFKUHAE-UHFFFAOYSA-N 1 2 249.358 2.143 20 0 BEADLO CCc1cnc(NCc2c[nH+]cn2C)s1 ZINC000185967415 349383548 /nfs/dbraw/zinc/38/35/48/349383548.db2.gz NSUWSVRBMNZYEU-UHFFFAOYSA-N 1 2 222.317 2.051 20 0 BEADLO Cc1nc(C2([NH2+]Cc3cc[nH]c3)CCCC2)no1 ZINC000086252391 179924290 /nfs/dbraw/zinc/92/42/90/179924290.db2.gz KCVFISLUJFCJPD-UHFFFAOYSA-N 1 2 246.314 2.265 20 0 BEADLO CC[C@@H]([NH2+]Cc1nccn1C)c1ccc(F)cn1 ZINC000161336304 349424698 /nfs/dbraw/zinc/42/46/98/349424698.db2.gz CGWMCSOECIVRLE-LLVKDONJSA-N 1 2 248.305 2.195 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CC[C@H](C)C2)[nH+]1 ZINC000336483044 180003927 /nfs/dbraw/zinc/00/39/27/180003927.db2.gz DKBBGKWBFUKXGZ-QMMMGPOBSA-N 1 2 216.288 2.113 20 0 BEADLO Cc1nc2[nH]ccc2c(N2C[C@H](C)[C@@H](C)C2)[nH+]1 ZINC000336541633 180004056 /nfs/dbraw/zinc/00/40/56/180004056.db2.gz DXZIGQQPPUWQCP-IUCAKERBSA-N 1 2 230.315 2.359 20 0 BEADLO Cc1nc2[nH]ccc2c(NCC[C@@H](C)F)[nH+]1 ZINC000338757669 180019220 /nfs/dbraw/zinc/01/92/20/180019220.db2.gz VPASHXFJAHNMTF-SSDOTTSWSA-N 1 2 222.267 2.378 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@H](CO)C(C)(C)C)[nH+]1 ZINC000358132686 180024981 /nfs/dbraw/zinc/02/49/81/180024981.db2.gz UGYPXLKYPPGECV-SNVBAGLBSA-N 1 2 248.330 2.085 20 0 BEADLO Cc1nc([C@@H](C)[NH2+]Cc2cnn(C)c2)cs1 ZINC000041054733 180037327 /nfs/dbraw/zinc/03/73/27/180037327.db2.gz PPBJFMXUGZLOHM-MRVPVSSYSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1nc([C@@H](C)[NH2+]Cc2c[nH]nc2C)cs1 ZINC000038011397 180037635 /nfs/dbraw/zinc/03/76/35/180037635.db2.gz LQGUFDIECUVWBJ-MRVPVSSYSA-N 1 2 236.344 2.334 20 0 BEADLO Cc1nc([C@H](C)[NH+]2CCC(CF)CC2)no1 ZINC000336260576 180047951 /nfs/dbraw/zinc/04/79/51/180047951.db2.gz AOKHWZILGMSHTR-QMMMGPOBSA-N 1 2 227.283 2.121 20 0 BEADLO Cc1nc(NC[C@@H]2C[C@@H]2C)c2c([nH+]1)CCCC2 ZINC000359716923 180067793 /nfs/dbraw/zinc/06/77/93/180067793.db2.gz NHJQSXXWKZKKOI-ONGXEEELSA-N 1 2 231.343 2.154 20 0 BEADLO Cc1nc(NC(C)(C)[C@@H](C)O)c2c([nH+]1)CCCC2 ZINC000272922556 180067813 /nfs/dbraw/zinc/06/78/13/180067813.db2.gz UBNVXRIARWZLDF-SECBINFHSA-N 1 2 249.358 2.235 20 0 BEADLO Cc1nnc(C[NH+]2C[C@H](C)C(F)(F)[C@@H](C)C2)o1 ZINC000625644671 490318638 /nfs/dbraw/zinc/31/86/38/490318638.db2.gz CACOXOBWTAPIIN-YUMQZZPRSA-N 1 2 245.273 2.101 20 0 BEADLO Cc1nnc(C[N@@H+]2C[C@@H](C)C(F)(F)[C@@H](C)C2)o1 ZINC000625644670 490319215 /nfs/dbraw/zinc/31/92/15/490319215.db2.gz CACOXOBWTAPIIN-OCAPTIKFSA-N 1 2 245.273 2.101 20 0 BEADLO Cc1nnc(C[N@H+]2C[C@@H](C)C(F)(F)[C@@H](C)C2)o1 ZINC000625644670 490319222 /nfs/dbraw/zinc/31/92/22/490319222.db2.gz CACOXOBWTAPIIN-OCAPTIKFSA-N 1 2 245.273 2.101 20 0 BEADLO CCc1cc(N[C@]2(C)CCO[C@H]2C)nc[nH+]1 ZINC000230098190 538055320 /nfs/dbraw/zinc/05/53/20/538055320.db2.gz XLKDRFMUVNBJBI-JOYOIKCWSA-N 1 2 221.304 2.018 20 0 BEADLO CCc1cc(N[C@@]2(C)CCO[C@H]2C)nc[nH+]1 ZINC000230098186 538055440 /nfs/dbraw/zinc/05/54/40/538055440.db2.gz XLKDRFMUVNBJBI-CABZTGNLSA-N 1 2 221.304 2.018 20 0 BEADLO Cc1nc(NC[C@H]2C[C@@H]2C)c2c([nH+]1)CCCC2 ZINC000359716920 180068753 /nfs/dbraw/zinc/06/87/53/180068753.db2.gz NHJQSXXWKZKKOI-GXSJLCMTSA-N 1 2 231.343 2.154 20 0 BEADLO Cc1nc(NC[C@@H]2CCCO2)c2c([nH+]1)CCCC2 ZINC000267975515 180069801 /nfs/dbraw/zinc/06/98/01/180069801.db2.gz NYQCXMDXZPJWFF-NSHDSACASA-N 1 2 247.342 2.255 20 0 BEADLO CCCC(C)(C)CC(=O)NCc1c[nH+]c[nH]1 ZINC000426869534 191048152 /nfs/dbraw/zinc/04/81/52/191048152.db2.gz SMBFZKPILACYTB-UHFFFAOYSA-N 1 2 223.320 2.242 20 0 BEADLO CCCC(C)(C)CC(=O)NCc1c[nH]c[nH+]1 ZINC000426869534 191048155 /nfs/dbraw/zinc/04/81/55/191048155.db2.gz SMBFZKPILACYTB-UHFFFAOYSA-N 1 2 223.320 2.242 20 0 BEADLO Cc1[nH]c(C(=O)NCC2(C3CCC3)CCC2)c[nH+]1 ZINC000333499876 180129953 /nfs/dbraw/zinc/12/99/53/180129953.db2.gz KEVRGOPKYXTEST-UHFFFAOYSA-N 1 2 247.342 2.418 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cnc(C)nc2)o1 ZINC000338412090 180137148 /nfs/dbraw/zinc/13/71/48/180137148.db2.gz SJHDCGDPJTZALA-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cnc(C)nc2)o1 ZINC000338412090 180137150 /nfs/dbraw/zinc/13/71/50/180137150.db2.gz SJHDCGDPJTZALA-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ncc(C[N@@H+](C)[C@@H](C)c2cnccn2)s1 ZINC000184454472 180141578 /nfs/dbraw/zinc/14/15/78/180141578.db2.gz DHNZTFWSILUKHT-VIFPVBQESA-N 1 2 248.355 2.435 20 0 BEADLO Cc1ncc(C[N@H+](C)[C@@H](C)c2cnccn2)s1 ZINC000184454472 180141581 /nfs/dbraw/zinc/14/15/81/180141581.db2.gz DHNZTFWSILUKHT-VIFPVBQESA-N 1 2 248.355 2.435 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C1(C)CCCCC1 ZINC000336202342 180118936 /nfs/dbraw/zinc/11/89/36/180118936.db2.gz JUDSZTWUZZCEAW-UHFFFAOYSA-N 1 2 235.331 2.305 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1CCC[C@@H](C)C1 ZINC000336080195 180119844 /nfs/dbraw/zinc/11/98/44/180119844.db2.gz XWTPWAACUJBWFW-MWLCHTKSSA-N 1 2 235.331 2.161 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1cccc(Cl)c1 ZINC000336063742 180120554 /nfs/dbraw/zinc/12/05/54/180120554.db2.gz SBESUZWZMBIHHP-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO Cc1cc(N)nc(SC[C@H]2CCCCO2)[nH+]1 ZINC000048397717 191069800 /nfs/dbraw/zinc/06/98/00/191069800.db2.gz QHRYPWNMHLALSG-SECBINFHSA-N 1 2 239.344 2.028 20 0 BEADLO Cc1nc(NC(C2CC2)C2CC2)cc[nH+]1 ZINC000054936226 180198646 /nfs/dbraw/zinc/19/86/46/180198646.db2.gz WDSHJJJXQXFBJE-UHFFFAOYSA-N 1 2 203.289 2.386 20 0 BEADLO Cc1nc(NC[C@@H]2COc3ccccc32)cc[nH+]1 ZINC000289084274 180200227 /nfs/dbraw/zinc/20/02/27/180200227.db2.gz OHTYIHFEGIQAIK-LLVKDONJSA-N 1 2 241.294 2.373 20 0 BEADLO Cc1nc(NCCc2ccco2)cc[nH+]1 ZINC000054936018 180200536 /nfs/dbraw/zinc/20/05/36/180200536.db2.gz GOBATWPOOHJEIE-UHFFFAOYSA-N 1 2 203.245 2.033 20 0 BEADLO Cc1nc(NC[C@H](O)C2CCCCC2)cc[nH+]1 ZINC000266380811 180200915 /nfs/dbraw/zinc/20/09/15/180200915.db2.gz MZRRUDBWBFQICF-LBPRGKRZSA-N 1 2 235.331 2.138 20 0 BEADLO Cc1cnccc1CCNc1cc[nH+]c(C)n1 ZINC000166705825 180201444 /nfs/dbraw/zinc/20/14/44/180201444.db2.gz HKJXZYZGNQCMEG-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO Cc1nc(N[C@@H](C)[C@H](O)c2ccccc2)cc[nH+]1 ZINC000288183461 180203815 /nfs/dbraw/zinc/20/38/15/180203815.db2.gz JGLINDJHXXDOOF-HZMBPMFUSA-N 1 2 243.310 2.319 20 0 BEADLO Cc1nc(N[C@@H]2CCOC3(CCC3)C2)cc[nH+]1 ZINC000268982143 180203977 /nfs/dbraw/zinc/20/39/77/180203977.db2.gz RVNRDBKMKYMEGB-LLVKDONJSA-N 1 2 233.315 2.299 20 0 BEADLO Cc1nc(N[C@@H]2CS[C@@H](C)C2)cc[nH+]1 ZINC000307171419 180204704 /nfs/dbraw/zinc/20/47/04/180204704.db2.gz OEKPEWUULYQPPD-CBAPKCEASA-N 1 2 209.318 2.091 20 0 BEADLO Cc1nc(N[C@H](C)C[C@@H]2CCCO2)cc[nH+]1 ZINC000309761118 180205415 /nfs/dbraw/zinc/20/54/15/180205415.db2.gz MOZNSBFOTDJNLX-KOLCDFICSA-N 1 2 221.304 2.155 20 0 BEADLO Cc1nc(N[C@@H]2C[C@@H](C)n3ccnc32)cc[nH+]1 ZINC000333657885 180205862 /nfs/dbraw/zinc/20/58/62/180205862.db2.gz GIHCMMGEBDECSS-PSASIEDQSA-N 1 2 229.287 2.099 20 0 BEADLO Cc1nc(N[C@H]2C[C@@H]2c2cccnc2)cc[nH+]1 ZINC000367162348 180207579 /nfs/dbraw/zinc/20/75/79/180207579.db2.gz AFEOKJREANAVQU-NEPJUHHUSA-N 1 2 226.283 2.148 20 0 BEADLO Cc1nc(NCC(F)(F)c2ccccc2)cc[nH+]1 ZINC000357631289 180179280 /nfs/dbraw/zinc/17/92/80/180179280.db2.gz SBZGGHLVCRFFGH-UHFFFAOYSA-N 1 2 249.264 2.411 20 0 BEADLO Cc1nc(NCC23CCC(CC2)C3)cc[nH+]1 ZINC000336735345 180180036 /nfs/dbraw/zinc/18/00/36/180180036.db2.gz LSSMQVIMJCDEBV-UHFFFAOYSA-N 1 2 217.316 2.199 20 0 BEADLO Cc1nc(N[C@H](C)CCC2CC2)cc[nH+]1 ZINC000336769490 180182025 /nfs/dbraw/zinc/18/20/25/180182025.db2.gz VOJZBBYGSUDCNB-SECBINFHSA-N 1 2 205.305 2.198 20 0 BEADLO Cc1nc(NCc2cc3ccccc3[nH]2)cc[nH+]1 ZINC000360219276 180182113 /nfs/dbraw/zinc/18/21/13/180182113.db2.gz SVKXZSXQVIOUFK-UHFFFAOYSA-N 1 2 238.294 2.300 20 0 BEADLO Cc1ccoc1C[N@@H+](C)Cc1ccnc(C)n1 ZINC000353586251 180183962 /nfs/dbraw/zinc/18/39/62/180183962.db2.gz ADOKMYVSJQVZOE-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ccoc1C[N@H+](C)Cc1ccnc(C)n1 ZINC000353586251 180183965 /nfs/dbraw/zinc/18/39/65/180183965.db2.gz ADOKMYVSJQVZOE-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1[nH+]cccc1Cc1noc(C2(C)CC2)n1 ZINC000335010477 180223219 /nfs/dbraw/zinc/22/32/19/180223219.db2.gz RPKFDVNZIBXTOZ-UHFFFAOYSA-N 1 2 229.283 2.415 20 0 BEADLO Cc1c[nH+]c(CNc2cccnc2C)n1C ZINC000309724197 180225625 /nfs/dbraw/zinc/22/56/25/180225625.db2.gz XEOKLNYQAPWAOE-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO CCC(C)(C)CC(=O)Nc1ccc(N)[nH+]c1 ZINC000428917495 191082303 /nfs/dbraw/zinc/08/23/03/191082303.db2.gz WXLXGKPFAMQCSH-UHFFFAOYSA-N 1 2 221.304 2.259 20 0 BEADLO CCOc1nnc(C[N@@H+]2CCC[C@H](C)C2)s1 ZINC000049982642 350273125 /nfs/dbraw/zinc/27/31/25/350273125.db2.gz AEONGWRHIBFAGD-VIFPVBQESA-N 1 2 241.360 2.169 20 0 BEADLO CCOc1nnc(C[N@H+]2CCC[C@H](C)C2)s1 ZINC000049982642 350273129 /nfs/dbraw/zinc/27/31/29/350273129.db2.gz AEONGWRHIBFAGD-VIFPVBQESA-N 1 2 241.360 2.169 20 0 BEADLO CCN(C(=O)CCCn1cc[nH+]c1)C1CCC1 ZINC000606215624 350287640 /nfs/dbraw/zinc/28/76/40/350287640.db2.gz KBCDOHDAZXWFFF-UHFFFAOYSA-N 1 2 235.331 2.064 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1C[C@H](C)O[C@@H]1C ZINC000637243780 350342318 /nfs/dbraw/zinc/34/23/18/350342318.db2.gz WYWUFQKXORRAKR-MVWJERBFSA-N 1 2 248.326 2.450 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)C1CCC(C)(C)CC1 ZINC000335170019 538089859 /nfs/dbraw/zinc/08/98/59/538089859.db2.gz LUMNBTVOYMTCGK-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO CC(C)(C)c1n[nH]cc1CNc1c[nH]c[nH+]1 ZINC000309377942 350360264 /nfs/dbraw/zinc/36/02/64/350360264.db2.gz ROJHKQJLYRFQMI-UHFFFAOYSA-N 1 2 219.292 2.042 20 0 BEADLO CCO[C@@H]1CCC[N@H+](Cc2cscn2)C1 ZINC000606438593 350333618 /nfs/dbraw/zinc/33/36/18/350333618.db2.gz BLVLWNOEKSTGND-LLVKDONJSA-N 1 2 226.345 2.144 20 0 BEADLO CCO[C@@H]1CCC[N@@H+](Cc2cscn2)C1 ZINC000606438593 350333621 /nfs/dbraw/zinc/33/36/21/350333621.db2.gz BLVLWNOEKSTGND-LLVKDONJSA-N 1 2 226.345 2.144 20 0 BEADLO C[C@H](NC(=O)Nc1ccc2[nH+]ccn2c1)C1CC1 ZINC000606581625 350372966 /nfs/dbraw/zinc/37/29/66/350372966.db2.gz KRYZCWGVSYJGEE-VIFPVBQESA-N 1 2 244.298 2.254 20 0 BEADLO CCc1cc(NCCc2ccccn2)nc[nH+]1 ZINC000040764987 350394654 /nfs/dbraw/zinc/39/46/54/350394654.db2.gz LCHSGZQOQDBNIS-UHFFFAOYSA-N 1 2 228.299 2.089 20 0 BEADLO CC[N@H+](Cc1csc(COC)n1)C1CC1 ZINC000336647325 350417221 /nfs/dbraw/zinc/41/72/21/350417221.db2.gz MBWJVLLITDYOLO-UHFFFAOYSA-N 1 2 226.345 2.274 20 0 BEADLO CC[N@@H+](Cc1csc(COC)n1)C1CC1 ZINC000336647325 350417223 /nfs/dbraw/zinc/41/72/23/350417223.db2.gz MBWJVLLITDYOLO-UHFFFAOYSA-N 1 2 226.345 2.274 20 0 BEADLO Cc1cc(C(=O)Nc2ccc[nH+]c2N(C)C)co1 ZINC000188665409 259413390 /nfs/dbraw/zinc/41/33/90/259413390.db2.gz FOABUWNWCXAUMS-UHFFFAOYSA-N 1 2 245.282 2.301 20 0 BEADLO CC[N@H+](Cc1nccn1C(C)C)[C@H]1CCOC1 ZINC000336712501 350463501 /nfs/dbraw/zinc/46/35/01/350463501.db2.gz NVRRSEOCWNWKHU-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO CC[N@@H+](Cc1nccn1C(C)C)[C@H]1CCOC1 ZINC000336712501 350463505 /nfs/dbraw/zinc/46/35/05/350463505.db2.gz NVRRSEOCWNWKHU-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO Cc1csc(C[NH2+][C@H](C)c2nccn2C)n1 ZINC000070007910 350490207 /nfs/dbraw/zinc/49/02/07/350490207.db2.gz QTCPNHJTDYAATN-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1csc(CN[C@H](C)c2[nH+]ccn2C)n1 ZINC000070007910 350490208 /nfs/dbraw/zinc/49/02/08/350490208.db2.gz QTCPNHJTDYAATN-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1nn(C)cc1CNc1ccc[nH+]c1C ZINC000119230513 180375226 /nfs/dbraw/zinc/37/52/26/180375226.db2.gz UFBHZCMFZULTTD-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO C[C@@H]([NH2+]Cc1ccccc1F)c1ccn(C)n1 ZINC000020349319 350467983 /nfs/dbraw/zinc/46/79/83/350467983.db2.gz CJLNAZQDPDCYLE-SNVBAGLBSA-N 1 2 233.290 2.410 20 0 BEADLO Cc1nn(C)cc1[C@@H](C)Nc1cccc[nH+]1 ZINC000134133862 180380985 /nfs/dbraw/zinc/38/09/85/180380985.db2.gz BIHJMQNNTJJAGV-SECBINFHSA-N 1 2 216.288 2.297 20 0 BEADLO CC[C@@H](N[C@@H](C)c1[nH+]ccn1C)C(F)(F)F ZINC000336726477 350481983 /nfs/dbraw/zinc/48/19/83/350481983.db2.gz CACPYEXNYQVCOM-JGVFFNPUSA-N 1 2 235.253 2.412 20 0 BEADLO Cc1nn(C)cc1[C@@H]1CCCN1c1cccc[nH+]1 ZINC000369504358 180381931 /nfs/dbraw/zinc/38/19/31/180381931.db2.gz TYJGXADXAHANRM-ZDUSSCGKSA-N 1 2 242.326 2.465 20 0 BEADLO CCC(C)(C)CC(=O)N[C@@H]1CCn2cc[nH+]c2C1 ZINC000427999816 191105979 /nfs/dbraw/zinc/10/59/79/191105979.db2.gz FWZARQJEOMYAGY-LLVKDONJSA-N 1 2 249.358 2.140 20 0 BEADLO CC[C@@](C)(NCc1c[nH+]c[nH]1)C(F)(F)F ZINC000380178974 350501530 /nfs/dbraw/zinc/50/15/30/350501530.db2.gz KWNLHXVZFHTTPS-MRVPVSSYSA-N 1 2 221.226 2.230 20 0 BEADLO CC[C@@](C)(NCc1c[nH]c[nH+]1)C(F)(F)F ZINC000380178974 350501537 /nfs/dbraw/zinc/50/15/37/350501537.db2.gz KWNLHXVZFHTTPS-MRVPVSSYSA-N 1 2 221.226 2.230 20 0 BEADLO CC[C@@H](NCc1[nH+]cc(C)n1C)C(F)(F)F ZINC000336777796 350504889 /nfs/dbraw/zinc/50/48/89/350504889.db2.gz JOOODGMBQGJLHI-MRVPVSSYSA-N 1 2 235.253 2.159 20 0 BEADLO COC(=O)[C@@H]([NH2+][C@H]1C=CCCC1)C(C)(C)C ZINC000309464447 350538758 /nfs/dbraw/zinc/53/87/58/350538758.db2.gz OWZSPBKQXDFOSN-WDEREUQCSA-N 1 2 225.332 2.272 20 0 BEADLO Cc1ccc(NC(=O)NCc2c[nH+]cn2C)cc1 ZINC000335327248 538095363 /nfs/dbraw/zinc/09/53/63/538095363.db2.gz ITEUKKGBLUEDDH-UHFFFAOYSA-N 1 2 244.298 2.050 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCOC2(CCC2)C1 ZINC000334412098 535145872 /nfs/dbraw/zinc/14/58/72/535145872.db2.gz KVYZNASFQFNUGJ-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCOC2(CCC2)C1 ZINC000334412098 535145876 /nfs/dbraw/zinc/14/58/76/535145876.db2.gz KVYZNASFQFNUGJ-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO COC(=O)[C@@H]([NH2+]CCSC(C)C)C(C)(C)C ZINC000309499968 350614362 /nfs/dbraw/zinc/61/43/62/350614362.db2.gz ZLDPQNKGBOHDIX-SNVBAGLBSA-N 1 2 247.404 2.305 20 0 BEADLO CC(C)=CC[N@@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000606905759 350627670 /nfs/dbraw/zinc/62/76/70/350627670.db2.gz ZZCSXMWTWPEUSZ-SECBINFHSA-N 1 2 223.238 2.216 20 0 BEADLO CC(C)=CC[N@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000606905759 350627673 /nfs/dbraw/zinc/62/76/73/350627673.db2.gz ZZCSXMWTWPEUSZ-SECBINFHSA-N 1 2 223.238 2.216 20 0 BEADLO C/C=C/CNC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000637488547 350650927 /nfs/dbraw/zinc/65/09/27/350650927.db2.gz QAXCFFFLCBTDLY-VUDBWIFFSA-N 1 2 248.330 2.222 20 0 BEADLO C/C=C\CNC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000637488546 350651061 /nfs/dbraw/zinc/65/10/61/350651061.db2.gz QAXCFFFLCBTDLY-QUCGXOGASA-N 1 2 248.330 2.222 20 0 BEADLO COC(=O)[C@@H]1CCCC[N@@H+]1Cc1cccs1 ZINC000096465931 350676259 /nfs/dbraw/zinc/67/62/59/350676259.db2.gz WIJADSLAGHJFNP-NSHDSACASA-N 1 2 239.340 2.276 20 0 BEADLO COC(=O)[C@@H]1CCCC[N@H+]1Cc1cccs1 ZINC000096465931 350676262 /nfs/dbraw/zinc/67/62/62/350676262.db2.gz WIJADSLAGHJFNP-NSHDSACASA-N 1 2 239.340 2.276 20 0 BEADLO Cc1nocc1C[NH2+]Cc1ccncc1Cl ZINC000397980409 350758425 /nfs/dbraw/zinc/75/84/25/350758425.db2.gz GOHMVCOQOARFNG-UHFFFAOYSA-N 1 2 237.690 2.321 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC12CCC(CC1)CC2 ZINC000577592448 366010017 /nfs/dbraw/zinc/01/00/17/366010017.db2.gz GVZDYVBOKBWRMQ-UHFFFAOYSA-N 1 2 247.342 2.100 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)NC12CCC(CC1)CC2 ZINC000577592448 366010020 /nfs/dbraw/zinc/01/00/20/366010020.db2.gz GVZDYVBOKBWRMQ-UHFFFAOYSA-N 1 2 247.342 2.100 20 0 BEADLO COc1ccc(C)cc1CNc1c[nH]c[nH+]1 ZINC000309903839 350825544 /nfs/dbraw/zinc/82/55/44/350825544.db2.gz JBPVINIFGMPZPY-UHFFFAOYSA-N 1 2 217.272 2.339 20 0 BEADLO C[C@H]1CCCCN1c1cc(-n2cc[nH+]c2)ncn1 ZINC000607141855 350941671 /nfs/dbraw/zinc/94/16/71/350941671.db2.gz WJAPINSXKLMGHR-NSHDSACASA-N 1 2 243.314 2.041 20 0 BEADLO c1ccc2oc(C[NH+]3CCSCC3)nc2c1 ZINC000051914738 350870682 /nfs/dbraw/zinc/87/06/82/350870682.db2.gz WKKSJHVPESKSAS-UHFFFAOYSA-N 1 2 234.324 2.377 20 0 BEADLO Cc1cnc(C[NH2+][C@H]2CCc3c2cccc3O)o1 ZINC000231637187 350986204 /nfs/dbraw/zinc/98/62/04/350986204.db2.gz JVPZKQASTBPMJH-LBPRGKRZSA-N 1 2 244.294 2.466 20 0 BEADLO C[C@H]([NH2+][C@@H]1CS[C@H](C)C1)C(=O)OC(C)(C)C ZINC000397918459 350990991 /nfs/dbraw/zinc/99/09/91/350990991.db2.gz FWRZAQJZFFYGPB-UTLUCORTSA-N 1 2 245.388 2.200 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CS[C@H](C)C1)C(=O)OC(C)(C)C ZINC000397918454 350991219 /nfs/dbraw/zinc/99/12/19/350991219.db2.gz FWRZAQJZFFYGPB-BBBLOLIVSA-N 1 2 245.388 2.200 20 0 BEADLO CC(C)[C@@H](C)N(C)c1cc(-n2cc[nH+]c2)ncn1 ZINC000607142992 350943313 /nfs/dbraw/zinc/94/33/13/350943313.db2.gz URBWYFMPUVQZLV-LLVKDONJSA-N 1 2 245.330 2.143 20 0 BEADLO CCc1cc(Nc2c(C)nn(C)c2C)nc(C)[nH+]1 ZINC000265993380 351084141 /nfs/dbraw/zinc/08/41/41/351084141.db2.gz JCXWDIPCLZYDGQ-UHFFFAOYSA-N 1 2 245.330 2.441 20 0 BEADLO CC(C)C[C@H]1CCC[C@@H]([NH2+]Cc2c[nH]nn2)C1 ZINC000398423249 351150264 /nfs/dbraw/zinc/15/02/64/351150264.db2.gz ZODKSRLTJASWCL-VXGBXAGGSA-N 1 2 236.363 2.499 20 0 BEADLO CC(C)C[C@H]1CCC[C@@H]([NH2+]Cc2cn[nH]n2)C1 ZINC000398423249 351150268 /nfs/dbraw/zinc/15/02/68/351150268.db2.gz ZODKSRLTJASWCL-VXGBXAGGSA-N 1 2 236.363 2.499 20 0 BEADLO CCCc1ccc(C[NH2+]Cc2cnn[nH]2)s1 ZINC000623578519 363011983 /nfs/dbraw/zinc/01/19/83/363011983.db2.gz LFXDBDFWCFRTQP-UHFFFAOYSA-N 1 2 236.344 2.109 20 0 BEADLO CCCc1ccc(C[NH2+]Cc2c[nH]nn2)s1 ZINC000623578519 363011990 /nfs/dbraw/zinc/01/19/90/363011990.db2.gz LFXDBDFWCFRTQP-UHFFFAOYSA-N 1 2 236.344 2.109 20 0 BEADLO CCCc1ccc(C[NH2+]Cc2cn[nH]n2)s1 ZINC000623578519 363011994 /nfs/dbraw/zinc/01/19/94/363011994.db2.gz LFXDBDFWCFRTQP-UHFFFAOYSA-N 1 2 236.344 2.109 20 0 BEADLO CCCc1cccc(C[NH2+]Cc2cnn[nH]2)c1 ZINC000623578756 363012722 /nfs/dbraw/zinc/01/27/22/363012722.db2.gz WZCLSHVPGKUDFP-UHFFFAOYSA-N 1 2 230.315 2.047 20 0 BEADLO CCCc1cccc(C[NH2+]Cc2c[nH]nn2)c1 ZINC000623578756 363012725 /nfs/dbraw/zinc/01/27/25/363012725.db2.gz WZCLSHVPGKUDFP-UHFFFAOYSA-N 1 2 230.315 2.047 20 0 BEADLO CCCc1cccc(C[NH2+]Cc2cn[nH]n2)c1 ZINC000623578756 363012729 /nfs/dbraw/zinc/01/27/29/363012729.db2.gz WZCLSHVPGKUDFP-UHFFFAOYSA-N 1 2 230.315 2.047 20 0 BEADLO CC1(C)CCC[C@H]([NH2+]Cc2c[nH]nn2)CC1 ZINC000398402725 351137787 /nfs/dbraw/zinc/13/77/87/351137787.db2.gz NJTLSPRFHOQRIA-JTQLQIEISA-N 1 2 222.336 2.253 20 0 BEADLO CC1(C)CCC[C@H]([NH2+]Cc2cn[nH]n2)CC1 ZINC000398402725 351137789 /nfs/dbraw/zinc/13/77/89/351137789.db2.gz NJTLSPRFHOQRIA-JTQLQIEISA-N 1 2 222.336 2.253 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC[C@@H](OC(C)C)C2)n1 ZINC000628323843 351233986 /nfs/dbraw/zinc/23/39/86/351233986.db2.gz QRSBVJGSAHNLSD-GFCCVEGCSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC[C@@H](OC(C)C)C2)n1 ZINC000628323843 351233988 /nfs/dbraw/zinc/23/39/88/351233988.db2.gz QRSBVJGSAHNLSD-GFCCVEGCSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@H]1CN(Cc2[nH]cc(C)[nH+]2)[C@@H](CC)CO1 ZINC000628324305 351236557 /nfs/dbraw/zinc/23/65/57/351236557.db2.gz NICODYCMCDLYBW-RYUDHWBXSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H]1CN(Cc2[nH]cc(C)[nH+]2)[C@H](CC)CO1 ZINC000628324306 351236814 /nfs/dbraw/zinc/23/68/14/351236814.db2.gz NICODYCMCDLYBW-VXGBXAGGSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1[nH]c(CN2CC[C@@]3(CC3(F)F)C2)[nH+]c1C ZINC000628325722 351255860 /nfs/dbraw/zinc/25/58/60/351255860.db2.gz BDJVSQHXHSFKSS-LLVKDONJSA-N 1 2 241.285 2.258 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1CCCS1 ZINC000266528066 351292457 /nfs/dbraw/zinc/29/24/57/351292457.db2.gz GJIHHINXYLHKQQ-NSHDSACASA-N 1 2 236.340 2.478 20 0 BEADLO C[C@@H](NC(=O)CCn1cc[nH+]c1)c1ccccc1 ZINC000072615544 351299982 /nfs/dbraw/zinc/29/99/82/351299982.db2.gz FYLYTIZGNVFPAB-GFCCVEGCSA-N 1 2 243.310 2.151 20 0 BEADLO C[C@@H]([NH2+]Cc1cnc(C2CC2)o1)c1nccn1C ZINC000628352435 351315137 /nfs/dbraw/zinc/31/51/37/351315137.db2.gz ISQTXLXEXITDRJ-SECBINFHSA-N 1 2 246.314 2.136 20 0 BEADLO C[C@@H](NCc1cnc(C2CC2)o1)c1[nH+]ccn1C ZINC000628352435 351315141 /nfs/dbraw/zinc/31/51/41/351315141.db2.gz ISQTXLXEXITDRJ-SECBINFHSA-N 1 2 246.314 2.136 20 0 BEADLO CC[C@@H]1CCC[C@H](NC(=O)c2c[nH+]c(C)[nH]2)C1 ZINC000265960940 351276657 /nfs/dbraw/zinc/27/66/57/351276657.db2.gz XMCDCCDXWUPJCG-MNOVXSKESA-N 1 2 235.331 2.417 20 0 BEADLO CC[C@@H](C(=O)OC)[N@@H+]1CCc2ccsc2C1 ZINC000270957344 351392830 /nfs/dbraw/zinc/39/28/30/351392830.db2.gz ULINDWRVKPRCGZ-JTQLQIEISA-N 1 2 239.340 2.058 20 0 BEADLO CC[C@@H](C(=O)OC)[N@H+]1CCc2ccsc2C1 ZINC000270957344 351392835 /nfs/dbraw/zinc/39/28/35/351392835.db2.gz ULINDWRVKPRCGZ-JTQLQIEISA-N 1 2 239.340 2.058 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1CCO[C@H](C)C1 ZINC000271867806 351442000 /nfs/dbraw/zinc/44/20/00/351442000.db2.gz FYMQNHZEBJUQPU-ZYHUDNBSSA-N 1 2 248.326 2.398 20 0 BEADLO C[C@H](O)[C@H](C)[NH2+]CC(F)(F)c1ccccc1 ZINC000386876248 363055394 /nfs/dbraw/zinc/05/53/94/363055394.db2.gz HRXWNRFPTAIMDS-UWVGGRQHSA-N 1 2 229.270 2.137 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@H](C)c1ccco1 ZINC000607485175 351544727 /nfs/dbraw/zinc/54/47/27/351544727.db2.gz VWWMLECZVGUPCA-SECBINFHSA-N 1 2 246.266 2.425 20 0 BEADLO C[C@@H]1CCCN(C(=O)CCCn2cc[nH+]c2)[C@H]1C ZINC000607525495 351574047 /nfs/dbraw/zinc/57/40/47/351574047.db2.gz MIBGNYORBUJRFJ-OLZOCXBDSA-N 1 2 249.358 2.310 20 0 BEADLO Nc1[nH+]cccc1CNc1ncc(Cl)s1 ZINC001639927894 1172143569 /nfs/dbraw/zinc/14/35/69/1172143569.db2.gz RSWLOCMCIRHQJR-UHFFFAOYSA-N 1 2 240.719 2.386 20 0 BEADLO CC(C)CN(C(=O)C=Cc1c[nH]c[nH+]1)C1CC1 ZINC000276462489 351623656 /nfs/dbraw/zinc/62/36/56/351623656.db2.gz CATJQZBBKXPVRU-ZZXKWVIFSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N(C)[C@@H](C)C1(C)CC1 ZINC000577647080 366030439 /nfs/dbraw/zinc/03/04/39/366030439.db2.gz GCRYGJWPKCQDTQ-MNOVXSKESA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N(C)[C@@H](C)C1(C)CC1 ZINC000577647080 366030450 /nfs/dbraw/zinc/03/04/50/366030450.db2.gz GCRYGJWPKCQDTQ-MNOVXSKESA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000276547952 351631835 /nfs/dbraw/zinc/63/18/35/351631835.db2.gz HBMMRBPZGUJHFI-PVTPVBHGSA-N 1 2 233.315 2.118 20 0 BEADLO c1cc([C@H]2CCC[N@@H+](Cc3ccns3)C2)[nH]n1 ZINC000637952530 351827643 /nfs/dbraw/zinc/82/76/43/351827643.db2.gz RWLQCVYOBSMMGO-JTQLQIEISA-N 1 2 248.355 2.246 20 0 BEADLO c1cc([C@H]2CCC[N@H+](Cc3ccns3)C2)[nH]n1 ZINC000637952530 351827648 /nfs/dbraw/zinc/82/76/48/351827648.db2.gz RWLQCVYOBSMMGO-JTQLQIEISA-N 1 2 248.355 2.246 20 0 BEADLO CC[C@@H]1CCCC[C@H]1C(=O)NCCn1cc[nH+]c1 ZINC000280446240 351844354 /nfs/dbraw/zinc/84/43/54/351844354.db2.gz YLIVYWTXGQQHTQ-CHWSQXEVSA-N 1 2 249.358 2.216 20 0 BEADLO CC[C@@H]([NH2+]Cc1cscn1)c1ccn(C)n1 ZINC000336737316 351931936 /nfs/dbraw/zinc/93/19/36/351931936.db2.gz NHECMWULILKLRB-SNVBAGLBSA-N 1 2 236.344 2.118 20 0 BEADLO Cc1ccc(COc2ccc(CO)nc2)c(C)[nH+]1 ZINC000358697420 187554016 /nfs/dbraw/zinc/55/40/16/187554016.db2.gz VIBHEWPFWUGIHF-UHFFFAOYSA-N 1 2 244.294 2.165 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2ccns2)CCO1 ZINC000638096697 351976791 /nfs/dbraw/zinc/97/67/91/351976791.db2.gz QMQGFQJNHDCVKE-JTQLQIEISA-N 1 2 226.345 2.144 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2ccns2)CCO1 ZINC000638096697 351976793 /nfs/dbraw/zinc/97/67/93/351976793.db2.gz QMQGFQJNHDCVKE-JTQLQIEISA-N 1 2 226.345 2.144 20 0 BEADLO Cn1cccc1C[N@H+](C)Cc1ccns1 ZINC000638106620 351984647 /nfs/dbraw/zinc/98/46/47/351984647.db2.gz QLYODSYQEJMKOI-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO Cn1cccc1C[N@@H+](C)Cc1ccns1 ZINC000638106620 351984650 /nfs/dbraw/zinc/98/46/50/351984650.db2.gz QLYODSYQEJMKOI-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO Cn1cc([C@@H]([NH2+]Cc2ccon2)C(C)(C)C)cn1 ZINC000330713712 180665049 /nfs/dbraw/zinc/66/50/49/180665049.db2.gz XBVCFVNSNIYBRC-GFCCVEGCSA-N 1 2 248.330 2.285 20 0 BEADLO CC(C)[N@@H+](Cc1ccc(=O)[nH]c1)CC(F)F ZINC000638179944 352043744 /nfs/dbraw/zinc/04/37/44/352043744.db2.gz VCQWPAYFSSIDRF-UHFFFAOYSA-N 1 2 230.258 2.263 20 0 BEADLO CC(C)[N@H+](Cc1ccc(=O)[nH]c1)CC(F)F ZINC000638179944 352043746 /nfs/dbraw/zinc/04/37/46/352043746.db2.gz VCQWPAYFSSIDRF-UHFFFAOYSA-N 1 2 230.258 2.263 20 0 BEADLO CCc1nc(N[C@@H](C)Cn2ccnc2)cc(C)[nH+]1 ZINC000286204051 352080882 /nfs/dbraw/zinc/08/08/82/352080882.db2.gz RUAUMCDEKRGSPC-NSHDSACASA-N 1 2 245.330 2.045 20 0 BEADLO CCc1cc(C[NH2+]Cc2cc(C)ns2)on1 ZINC000638274938 352109873 /nfs/dbraw/zinc/10/98/73/352109873.db2.gz QTYFALUZTXYPIM-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO COC(=O)[C@H]1CCC[N@@H+]1C/C=C\c1ccccc1 ZINC000212746703 363119580 /nfs/dbraw/zinc/11/95/80/363119580.db2.gz IOAVDOFCHUVINQ-VYLZPFMQSA-N 1 2 245.322 2.337 20 0 BEADLO COC(=O)[C@H]1CCC[N@H+]1C/C=C\c1ccccc1 ZINC000212746703 363119586 /nfs/dbraw/zinc/11/95/86/363119586.db2.gz IOAVDOFCHUVINQ-VYLZPFMQSA-N 1 2 245.322 2.337 20 0 BEADLO CCc1ccc(CN(C)Cc2[nH+]ccn2C)nc1 ZINC000411406377 191184046 /nfs/dbraw/zinc/18/40/46/191184046.db2.gz BVEJFSJWWVUGDC-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO CCC[N@H+](C[C@H](F)CC)[C@@H](C)C(=O)OCC ZINC000411653215 191201131 /nfs/dbraw/zinc/20/11/31/191201131.db2.gz WHWYHYDBVUVMDQ-WDEREUQCSA-N 1 2 233.327 2.398 20 0 BEADLO CCC[N@@H+](C[C@H](F)CC)[C@@H](C)C(=O)OCC ZINC000411653215 191201133 /nfs/dbraw/zinc/20/11/33/191201133.db2.gz WHWYHYDBVUVMDQ-WDEREUQCSA-N 1 2 233.327 2.398 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)CSC1CC1 ZINC000295947374 352429354 /nfs/dbraw/zinc/42/93/54/352429354.db2.gz UFVWLEKPUQVIOC-UHFFFAOYSA-N 1 2 236.340 2.478 20 0 BEADLO CC(C)=C[C@H]1[C@@H](C(=O)NCc2c[nH+]c[nH]2)C1(C)C ZINC000607948773 352454695 /nfs/dbraw/zinc/45/46/95/352454695.db2.gz SFEPOBZCACEQSG-RYUDHWBXSA-N 1 2 247.342 2.264 20 0 BEADLO CC(C)=C[C@H]1[C@@H](C(=O)NCc2c[nH]c[nH+]2)C1(C)C ZINC000607948773 352454697 /nfs/dbraw/zinc/45/46/97/352454697.db2.gz SFEPOBZCACEQSG-RYUDHWBXSA-N 1 2 247.342 2.264 20 0 BEADLO Cc1[nH]c(CNCc2ccc(F)cc2)[nH+]c1C ZINC000045205757 352588127 /nfs/dbraw/zinc/58/81/27/352588127.db2.gz BGPAXERQOOEBMP-UHFFFAOYSA-N 1 2 233.290 2.455 20 0 BEADLO CCn1cc[nH+]c1CNc1nc(C)c(C)s1 ZINC000385367217 352559655 /nfs/dbraw/zinc/55/96/55/352559655.db2.gz QCQFAMJCZLTOJS-UHFFFAOYSA-N 1 2 236.344 2.010 20 0 BEADLO Cc1n[nH]cc1CCCNc1cccc[nH+]1 ZINC000043536601 352640272 /nfs/dbraw/zinc/64/02/72/352640272.db2.gz HQLJRYMPAJAEMU-UHFFFAOYSA-N 1 2 216.288 2.158 20 0 BEADLO CCc1ccc([C@@H](COC)[NH2+]Cc2cn[nH]c2)o1 ZINC000608060553 352658396 /nfs/dbraw/zinc/65/83/96/352658396.db2.gz IFMYSAZLLDPFGZ-GFCCVEGCSA-N 1 2 249.314 2.042 20 0 BEADLO CCc1nc(C[NH2+]Cc2cnc(C)nc2)cs1 ZINC000341225346 352696100 /nfs/dbraw/zinc/69/61/00/352696100.db2.gz DPWINKFLHHKNAL-UHFFFAOYSA-N 1 2 248.355 2.094 20 0 BEADLO Cc1ccc(N[C@@H](C)C[C@H]2CCCC(=O)N2)c[nH+]1 ZINC000638762755 352701181 /nfs/dbraw/zinc/70/11/81/352701181.db2.gz ZJVAYBONNKVSSB-NWDGAFQWSA-N 1 2 247.342 2.249 20 0 BEADLO CC[N@H+](Cc1occc1C)Cc1ncccn1 ZINC000412026610 191239218 /nfs/dbraw/zinc/23/92/18/191239218.db2.gz MHBVHRGEGFJZBQ-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1occc1C)Cc1ncccn1 ZINC000412026610 191239220 /nfs/dbraw/zinc/23/92/20/191239220.db2.gz MHBVHRGEGFJZBQ-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@H+](Cc1ccn(C)n1)Cc1occc1C ZINC000412024383 191239286 /nfs/dbraw/zinc/23/92/86/191239286.db2.gz FTQVFTQOFSODEM-UHFFFAOYSA-N 1 2 233.315 2.344 20 0 BEADLO CC[N@@H+](Cc1ccn(C)n1)Cc1occc1C ZINC000412024383 191239289 /nfs/dbraw/zinc/23/92/89/191239289.db2.gz FTQVFTQOFSODEM-UHFFFAOYSA-N 1 2 233.315 2.344 20 0 BEADLO Cc1[nH+]cccc1NCCCc1cnn(C)c1 ZINC000638785558 352739541 /nfs/dbraw/zinc/73/95/41/352739541.db2.gz CTQGISMPEUKCBC-UHFFFAOYSA-N 1 2 230.315 2.168 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC=C(C)C2)n1C1CC1 ZINC000334186564 352775768 /nfs/dbraw/zinc/77/57/68/352775768.db2.gz GCSIHICFLHERHJ-UHFFFAOYSA-N 1 2 232.331 2.073 20 0 BEADLO Cc1nnc(C[N@H+]2CCC=C(C)C2)n1C1CC1 ZINC000334186564 352775771 /nfs/dbraw/zinc/77/57/71/352775771.db2.gz GCSIHICFLHERHJ-UHFFFAOYSA-N 1 2 232.331 2.073 20 0 BEADLO CC1(C)CCCN1c1cc(-n2cc[nH+]c2)ncn1 ZINC000608083169 352755950 /nfs/dbraw/zinc/75/59/50/352755950.db2.gz XCESQWBLPLGOMN-UHFFFAOYSA-N 1 2 243.314 2.041 20 0 BEADLO Cc1nc(N(C)Cc2[nH+]ccn2C)sc1C ZINC000334181496 352769908 /nfs/dbraw/zinc/76/99/08/352769908.db2.gz ARJADOIZRCAANF-UHFFFAOYSA-N 1 2 236.344 2.130 20 0 BEADLO O[C@@H]1CCN(c2cc[nH+]c3c(Cl)cccc23)C1 ZINC000334184896 352772787 /nfs/dbraw/zinc/77/27/87/352772787.db2.gz FZJJIOBBBWYFEK-SECBINFHSA-N 1 2 248.713 2.459 20 0 BEADLO Cc1nc(C[N@H+]2CCO[C@@H](C)[C@@H]2C)c(C)s1 ZINC000334184921 352772890 /nfs/dbraw/zinc/77/28/90/352772890.db2.gz DIJXEAXRFOYOMF-IUCAKERBSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nc(C[N@@H+]2CCO[C@@H](C)[C@@H]2C)c(C)s1 ZINC000334184921 352772893 /nfs/dbraw/zinc/77/28/93/352772893.db2.gz DIJXEAXRFOYOMF-IUCAKERBSA-N 1 2 240.372 2.369 20 0 BEADLO Cn1c[nH+]cc1CN1CCCC[C@@H]1C(F)F ZINC000334185448 352774039 /nfs/dbraw/zinc/77/40/39/352774039.db2.gz GJPLKJJVOYQJTO-SNVBAGLBSA-N 1 2 229.274 2.040 20 0 BEADLO C[C@H]1C[N@H+](Cc2nncn2-c2ccccc2)[C@H]1C ZINC000334220832 352823441 /nfs/dbraw/zinc/82/34/41/352823441.db2.gz SERVHMCKKVUJQE-RYUDHWBXSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nncn2-c2ccccc2)[C@H]1C ZINC000334220832 352823444 /nfs/dbraw/zinc/82/34/44/352823444.db2.gz SERVHMCKKVUJQE-RYUDHWBXSA-N 1 2 242.326 2.108 20 0 BEADLO Cn1cc[nH+]c1CN1CCCC[C@H]1C(F)F ZINC000334205428 352800043 /nfs/dbraw/zinc/80/00/43/352800043.db2.gz XTVGIZCWFRKISI-VIFPVBQESA-N 1 2 229.274 2.040 20 0 BEADLO CC1(C(=O)NCc2c[nH+]c[nH]2)CCCCCC1 ZINC000334235638 352852826 /nfs/dbraw/zinc/85/28/26/352852826.db2.gz KMMFUEXHFHHFDP-UHFFFAOYSA-N 1 2 235.331 2.386 20 0 BEADLO CC1(C(=O)NCc2c[nH]c[nH+]2)CCCCCC1 ZINC000334235638 352852829 /nfs/dbraw/zinc/85/28/29/352852829.db2.gz KMMFUEXHFHHFDP-UHFFFAOYSA-N 1 2 235.331 2.386 20 0 BEADLO Cc1[nH]c(C(=O)NC(C)(C)c2cccs2)c[nH+]1 ZINC000334239118 352858672 /nfs/dbraw/zinc/85/86/72/352858672.db2.gz UGTWNMJFMXVJNP-UHFFFAOYSA-N 1 2 249.339 2.445 20 0 BEADLO CC1(CC(=O)N2CCC[C@H]2c2[nH]cc[nH+]2)CC1 ZINC000334248635 352840721 /nfs/dbraw/zinc/84/07/21/352840721.db2.gz QMMCRWFCTADWII-JTQLQIEISA-N 1 2 233.315 2.263 20 0 BEADLO C[C@H]1C[N@H+](Cc2ncc(C3CC3)o2)CCCO1 ZINC000334229101 352846263 /nfs/dbraw/zinc/84/62/63/352846263.db2.gz PNDMFWTVVZDDRQ-JTQLQIEISA-N 1 2 236.315 2.163 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ncc(C3CC3)o2)CCCO1 ZINC000334229101 352846265 /nfs/dbraw/zinc/84/62/65/352846265.db2.gz PNDMFWTVVZDDRQ-JTQLQIEISA-N 1 2 236.315 2.163 20 0 BEADLO c1ccc(C[N@@H+]2C[C@@]3(CCCO3)[C@@H]2C2CC2)nc1 ZINC000334279163 352913695 /nfs/dbraw/zinc/91/36/95/352913695.db2.gz FUCHYDGWEOBENG-GJZGRUSLSA-N 1 2 244.338 2.225 20 0 BEADLO c1ccc(C[N@H+]2C[C@@]3(CCCO3)[C@@H]2C2CC2)nc1 ZINC000334279163 352913700 /nfs/dbraw/zinc/91/37/00/352913700.db2.gz FUCHYDGWEOBENG-GJZGRUSLSA-N 1 2 244.338 2.225 20 0 BEADLO CNC(=O)c1cccc(C[N@@H+]2CCC=C(F)C2)c1 ZINC000334298970 352919379 /nfs/dbraw/zinc/91/93/79/352919379.db2.gz PJMKQZDFITYCRV-UHFFFAOYSA-N 1 2 248.301 2.105 20 0 BEADLO CNC(=O)c1cccc(C[N@H+]2CCC=C(F)C2)c1 ZINC000334298970 352919380 /nfs/dbraw/zinc/91/93/80/352919380.db2.gz PJMKQZDFITYCRV-UHFFFAOYSA-N 1 2 248.301 2.105 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000334281328 352922015 /nfs/dbraw/zinc/92/20/15/352922015.db2.gz HJZSUSMXYUXSIP-LBPRGKRZSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000334281328 352922016 /nfs/dbraw/zinc/92/20/16/352922016.db2.gz HJZSUSMXYUXSIP-LBPRGKRZSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1noc(C)c1CN1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000334281328 352922017 /nfs/dbraw/zinc/92/20/17/352922017.db2.gz HJZSUSMXYUXSIP-LBPRGKRZSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1c(NCc2[nH+]ccn2C)cccc1N(C)C ZINC000342863470 352880685 /nfs/dbraw/zinc/88/06/85/352880685.db2.gz XJPIESPCEAAGCS-UHFFFAOYSA-N 1 2 244.342 2.407 20 0 BEADLO OCC[N@@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000334328949 352966121 /nfs/dbraw/zinc/96/61/21/352966121.db2.gz ISMYNBWMTIMYIP-LBPRGKRZSA-N 1 2 243.709 2.203 20 0 BEADLO OCC[N@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000334328949 352966124 /nfs/dbraw/zinc/96/61/24/352966124.db2.gz ISMYNBWMTIMYIP-LBPRGKRZSA-N 1 2 243.709 2.203 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)sn1 ZINC000638844531 353023092 /nfs/dbraw/zinc/02/30/92/353023092.db2.gz OKHLJEYVBSFUAF-AOOOYVTPSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)sn1 ZINC000638844531 353023094 /nfs/dbraw/zinc/02/30/94/353023094.db2.gz OKHLJEYVBSFUAF-AOOOYVTPSA-N 1 2 226.345 2.061 20 0 BEADLO Cn1cccc1C[N@@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000334375985 353032821 /nfs/dbraw/zinc/03/28/21/353032821.db2.gz DVVONAQFNAEEEP-GFCCVEGCSA-N 1 2 230.315 2.085 20 0 BEADLO Cn1cccc1C[N@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000334375985 353032823 /nfs/dbraw/zinc/03/28/23/353032823.db2.gz DVVONAQFNAEEEP-GFCCVEGCSA-N 1 2 230.315 2.085 20 0 BEADLO COC[C@H](Nc1cc(C)[nH+]c(C2CC2)n1)C(C)C ZINC000608088082 353063158 /nfs/dbraw/zinc/06/31/58/353063158.db2.gz BPFKYTQFBIOASC-LBPRGKRZSA-N 1 2 249.358 2.167 20 0 BEADLO Cc1cc(N[C@@H]2CCCC[C@H]2O)nc(C2CC2)[nH+]1 ZINC000186366057 188000710 /nfs/dbraw/zinc/00/07/10/188000710.db2.gz VCKYLNYOUAWSJG-VXGBXAGGSA-N 1 2 247.342 2.378 20 0 BEADLO CC(C)[C@@H]1C[C@@H]1C(=O)N(C)CCCn1cc[nH+]c1 ZINC000185754713 188000728 /nfs/dbraw/zinc/00/07/28/188000728.db2.gz ZAJMFSCOPIOEQP-STQMWFEESA-N 1 2 249.358 2.024 20 0 BEADLO C(c1nnc(C2CC2)s1)[NH+]1CCCC1 ZINC000336189860 188006732 /nfs/dbraw/zinc/00/67/32/188006732.db2.gz QUYODCAOEYQALX-UHFFFAOYSA-N 1 2 209.318 2.011 20 0 BEADLO Cc1ccnc(C[N@@H+](C)[C@@H](C)c2cccnc2)n1 ZINC000336706573 188012123 /nfs/dbraw/zinc/01/21/23/188012123.db2.gz KAHOKSCVWVRZMB-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1ccnc(C[N@H+](C)[C@@H](C)c2cccnc2)n1 ZINC000336706573 188012125 /nfs/dbraw/zinc/01/21/25/188012125.db2.gz KAHOKSCVWVRZMB-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1ccc(SCc2c[nH+]cn2C)nc1 ZINC000267163826 188022394 /nfs/dbraw/zinc/02/23/94/188022394.db2.gz RVOAYYQXVRJWJF-UHFFFAOYSA-N 1 2 219.313 2.416 20 0 BEADLO Cc1ccc(CN(C)c2cc[nH+]c(C)n2)o1 ZINC000266136135 188022828 /nfs/dbraw/zinc/02/28/28/188022828.db2.gz FROHWXDAQFHWJZ-UHFFFAOYSA-N 1 2 217.272 2.323 20 0 BEADLO Cc1nc(N(C)CC2CCCC2)cc[nH+]1 ZINC000266430010 188022862 /nfs/dbraw/zinc/02/28/62/188022862.db2.gz UFBYNZNEIMTJHN-UHFFFAOYSA-N 1 2 205.305 2.411 20 0 BEADLO Cc1ccc(NC(=O)[C@@H](C)n2cccn2)c(C)[nH+]1 ZINC000268033662 188023624 /nfs/dbraw/zinc/02/36/24/188023624.db2.gz YQDFHZMYYDOUMX-LLVKDONJSA-N 1 2 244.298 2.095 20 0 BEADLO CC(C)C[C@@H](C)C(=O)NCCNc1cccc[nH+]1 ZINC000274183659 188027585 /nfs/dbraw/zinc/02/75/85/188027585.db2.gz DSAJDSITQFGCJS-GFCCVEGCSA-N 1 2 249.358 2.292 20 0 BEADLO CC(C)[C@H](NC(=O)[C@@H]1CC1(C)C)c1[nH]cc[nH+]1 ZINC000276716373 188029654 /nfs/dbraw/zinc/02/96/54/188029654.db2.gz RRDAKJFACNPOLJ-UWVGGRQHSA-N 1 2 235.331 2.269 20 0 BEADLO C[C@H]1COc2ccccc2C[N@@H+]1Cc1cocn1 ZINC000277682979 188029815 /nfs/dbraw/zinc/02/98/15/188029815.db2.gz QJGCGXAWZINBET-NSHDSACASA-N 1 2 244.294 2.458 20 0 BEADLO C[C@H]1COc2ccccc2C[N@H+]1Cc1cocn1 ZINC000277682979 188029816 /nfs/dbraw/zinc/02/98/16/188029816.db2.gz QJGCGXAWZINBET-NSHDSACASA-N 1 2 244.294 2.458 20 0 BEADLO Cc1ccc(Cc2noc(C[NH+](C)C)n2)cc1 ZINC000278258117 188030206 /nfs/dbraw/zinc/03/02/06/188030206.db2.gz ZNZOYXDHANINCG-UHFFFAOYSA-N 1 2 231.299 2.030 20 0 BEADLO Cc1ccc2c(c1)CN(Cc1[nH]cc[nH+]1)CCO2 ZINC000285540083 188034545 /nfs/dbraw/zinc/03/45/45/188034545.db2.gz LLDPAISPHPBDBM-UHFFFAOYSA-N 1 2 243.310 2.113 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)NCC(F)F ZINC000287385862 188035382 /nfs/dbraw/zinc/03/53/82/188035382.db2.gz CLNYMKPXHDPBBD-UHFFFAOYSA-N 1 2 229.230 2.085 20 0 BEADLO c1cc(C[N@@H+]2CCC=C(c3cccnc3)C2)no1 ZINC000289455960 188035652 /nfs/dbraw/zinc/03/56/52/188035652.db2.gz XUFCWNGSSRJAPI-UHFFFAOYSA-N 1 2 241.294 2.359 20 0 BEADLO c1cc(C[N@H+]2CCC=C(c3cccnc3)C2)no1 ZINC000289455960 188035654 /nfs/dbraw/zinc/03/56/54/188035654.db2.gz XUFCWNGSSRJAPI-UHFFFAOYSA-N 1 2 241.294 2.359 20 0 BEADLO C[C@H]1C[C@@H]1CNC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000290592752 188036099 /nfs/dbraw/zinc/03/60/99/188036099.db2.gz GQMUPRUGFHOFCV-VHSXEESVSA-N 1 2 244.298 2.112 20 0 BEADLO CC(C)C(=O)CC[N@H+](C)Cc1cscn1 ZINC000290015671 188036127 /nfs/dbraw/zinc/03/61/27/188036127.db2.gz BWIVSYJMXVMVEF-UHFFFAOYSA-N 1 2 226.345 2.190 20 0 BEADLO CC(C)C(=O)CC[N@@H+](C)Cc1cscn1 ZINC000290015671 188036129 /nfs/dbraw/zinc/03/61/29/188036129.db2.gz BWIVSYJMXVMVEF-UHFFFAOYSA-N 1 2 226.345 2.190 20 0 BEADLO CC(=O)NC1C[NH+](Cc2ccc(C(C)C)cc2)C1 ZINC000297471671 188040715 /nfs/dbraw/zinc/04/07/15/188040715.db2.gz RGHBXSMFGXZBEQ-UHFFFAOYSA-N 1 2 246.354 2.130 20 0 BEADLO Cc1nc(N2CC3(C2)CCCC3)cc[nH+]1 ZINC000336365553 188054985 /nfs/dbraw/zinc/05/49/85/188054985.db2.gz WBMVAQFPSBMDGQ-UHFFFAOYSA-N 1 2 203.289 2.165 20 0 BEADLO Cn1c[nH+]cc1CN(CC(F)F)CC1CCC1 ZINC000341754290 188044881 /nfs/dbraw/zinc/04/48/81/188044881.db2.gz LCIRFZBZOOMNQJ-UHFFFAOYSA-N 1 2 243.301 2.287 20 0 BEADLO FC(F)O[C@H]1CCC[N@H+](Cc2ccns2)C1 ZINC000638969845 353176393 /nfs/dbraw/zinc/17/63/93/353176393.db2.gz JBHSFNBPOQNSFU-QMMMGPOBSA-N 1 2 248.298 2.347 20 0 BEADLO FC(F)O[C@H]1CCC[N@@H+](Cc2ccns2)C1 ZINC000638969845 353176396 /nfs/dbraw/zinc/17/63/96/353176396.db2.gz JBHSFNBPOQNSFU-QMMMGPOBSA-N 1 2 248.298 2.347 20 0 BEADLO CCc1[nH+]c(C)ccc1OCc1nnc(C)o1 ZINC000331237494 353236066 /nfs/dbraw/zinc/23/60/66/353236066.db2.gz HPVVMPABXTWMFR-UHFFFAOYSA-N 1 2 233.271 2.223 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]CCC(F)(F)F ZINC000134579098 538113332 /nfs/dbraw/zinc/11/33/32/538113332.db2.gz WODRNMKJXCJMCY-LURJTMIESA-N 1 2 221.226 2.321 20 0 BEADLO Cc1cc(N[C@@H]2CCC[C@H]3OCC[C@@H]32)nc[nH+]1 ZINC000301658742 188232899 /nfs/dbraw/zinc/23/28/99/188232899.db2.gz LXBOLWBXHUACPZ-IJLUTSLNSA-N 1 2 233.315 2.155 20 0 BEADLO COc1ccc(NCc2ccncc2)[nH+]c1 ZINC000225894948 538114508 /nfs/dbraw/zinc/11/45/08/538114508.db2.gz CTJTXKQEWAPYBW-UHFFFAOYSA-N 1 2 215.256 2.097 20 0 BEADLO CC(C)(C)c1nc(N[C@]2(C)CCOC2)cc[nH+]1 ZINC000301865537 188233083 /nfs/dbraw/zinc/23/30/83/188233083.db2.gz VAODZIHQNQARJY-CYBMUJFWSA-N 1 2 235.331 2.365 20 0 BEADLO Cc1cc(N(C)[C@H]2CCC[C@H]2O)nc(C2CC2)[nH+]1 ZINC000343268739 353284886 /nfs/dbraw/zinc/28/48/86/353284886.db2.gz WTPUKVKBMGTGQX-NWDGAFQWSA-N 1 2 247.342 2.012 20 0 BEADLO CC(C)[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000357577766 188239847 /nfs/dbraw/zinc/23/98/47/188239847.db2.gz DUEAKSSIXDEMER-SDDRHHMPSA-N 1 2 247.342 2.365 20 0 BEADLO Cc1cc(N(C)[C@H]2CCC[C@H]2O)nc(C(C)C)[nH+]1 ZINC000343272433 353294717 /nfs/dbraw/zinc/29/47/17/353294717.db2.gz UGHJQSIBWHLTEL-NWDGAFQWSA-N 1 2 249.358 2.258 20 0 BEADLO CC(C)C[C@H](CO)Nc1[nH+]c2ccccc2n1C ZINC000079045340 188269144 /nfs/dbraw/zinc/26/91/44/188269144.db2.gz AMXVZYHJVPPIJX-LLVKDONJSA-N 1 2 247.342 2.392 20 0 BEADLO CC(C)(C)c1csc([C@H]2COCC[NH2+]2)n1 ZINC000076136776 188289931 /nfs/dbraw/zinc/28/99/31/188289931.db2.gz ABFUBRAGJUZGLH-MRVPVSSYSA-N 1 2 226.345 2.102 20 0 BEADLO CC(C)[C@H](C)NC(=O)c1ccc2[nH+]ccn2c1 ZINC000057776897 188301658 /nfs/dbraw/zinc/30/16/58/188301658.db2.gz LAQBSQFWBUDNOU-JTQLQIEISA-N 1 2 231.299 2.109 20 0 BEADLO CC[C@]1(C)COCC[N@@H+]1Cc1cc(C)ns1 ZINC000639058416 353364014 /nfs/dbraw/zinc/36/40/14/353364014.db2.gz MCUAHRMCBLHKTA-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO CC[C@]1(C)COCC[N@H+]1Cc1cc(C)ns1 ZINC000639058416 353364017 /nfs/dbraw/zinc/36/40/17/353364017.db2.gz MCUAHRMCBLHKTA-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO COc1ccc(NC[C@H]2CCSC2)[nH+]c1 ZINC000226385261 538115873 /nfs/dbraw/zinc/11/58/73/538115873.db2.gz HOFYGDOJJLYGJL-SECBINFHSA-N 1 2 224.329 2.255 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)COC(C)(C)C ZINC000302620036 188335477 /nfs/dbraw/zinc/33/54/77/188335477.db2.gz NMNYPWXYOJGVTF-UHFFFAOYSA-N 1 2 236.315 2.452 20 0 BEADLO O=C(Nc1cscc1Cl)[C@@H]1CSC[NH2+]1 ZINC000639073743 353391225 /nfs/dbraw/zinc/39/12/25/353391225.db2.gz QABKJPKBLGRLHD-ZETCQYMHSA-N 1 2 248.760 2.003 20 0 BEADLO Cc1cccc(OCc2c[nH+]cn2C)c1F ZINC000227319473 188359866 /nfs/dbraw/zinc/35/98/66/188359866.db2.gz LNLOQXRRISCKGE-UHFFFAOYSA-N 1 2 220.247 2.447 20 0 BEADLO CC(C)=CC[NH2+]C(C)(C)c1noc(C)n1 ZINC000264287796 188371242 /nfs/dbraw/zinc/37/12/42/188371242.db2.gz HJMANNQRMDKGBB-UHFFFAOYSA-N 1 2 209.293 2.169 20 0 BEADLO Cn1c[nH+]cc1CCC(=O)NCCC1CCCC1 ZINC000280886897 188383577 /nfs/dbraw/zinc/38/35/77/188383577.db2.gz NNLWBVHEFYVKCT-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO Cc1ccc(F)cc1OCc1c[nH+]cn1C ZINC000230402930 353493019 /nfs/dbraw/zinc/49/30/19/353493019.db2.gz CZWRJHCKKLOJCP-UHFFFAOYSA-N 1 2 220.247 2.447 20 0 BEADLO CC(C)(CO)CCNc1cc[nH+]c(C2CC2)n1 ZINC000294934965 188393160 /nfs/dbraw/zinc/39/31/60/188393160.db2.gz KPDXUFKYUVDNNF-UHFFFAOYSA-N 1 2 235.331 2.175 20 0 BEADLO C[C@@H](C[NH2+]Cc1c[nH]nn1)C1CCCCC1 ZINC000398416582 363236101 /nfs/dbraw/zinc/23/61/01/363236101.db2.gz SQWCIUJQALYCJP-JTQLQIEISA-N 1 2 222.336 2.111 20 0 BEADLO C[C@@H](C[NH2+]Cc1cn[nH]n1)C1CCCCC1 ZINC000398416582 363236106 /nfs/dbraw/zinc/23/61/06/363236106.db2.gz SQWCIUJQALYCJP-JTQLQIEISA-N 1 2 222.336 2.111 20 0 BEADLO CCC[C@H]([NH2+]Cc1c[nH]nn1)[C@H]1CC1(C)C ZINC000398423917 363237195 /nfs/dbraw/zinc/23/71/95/363237195.db2.gz WMMNNFCDZHXJDN-MNOVXSKESA-N 1 2 222.336 2.109 20 0 BEADLO CCC[C@H]([NH2+]Cc1cn[nH]n1)[C@H]1CC1(C)C ZINC000398423917 363237199 /nfs/dbraw/zinc/23/71/99/363237199.db2.gz WMMNNFCDZHXJDN-MNOVXSKESA-N 1 2 222.336 2.109 20 0 BEADLO Cc1cnc([C@H](C)[NH2+]Cc2c(C)n[nH]c2C)o1 ZINC000231525725 353618818 /nfs/dbraw/zinc/61/88/18/353618818.db2.gz LCUPZEGUSBRFNF-JTQLQIEISA-N 1 2 234.303 2.174 20 0 BEADLO Fc1cccc2c1CC[C@H]2[NH2+]Cc1ccn[nH]1 ZINC000112344074 181006259 /nfs/dbraw/zinc/00/62/59/181006259.db2.gz KSCOYFGUUVUKBL-CYBMUJFWSA-N 1 2 231.274 2.326 20 0 BEADLO OCC[N@H+](CCCc1ccccc1)CC(F)F ZINC000194854338 353700658 /nfs/dbraw/zinc/70/06/58/353700658.db2.gz LPXDGVRSTOVNOG-UHFFFAOYSA-N 1 2 243.297 2.179 20 0 BEADLO OCC[N@@H+](CCCc1ccccc1)CC(F)F ZINC000194854338 353700661 /nfs/dbraw/zinc/70/06/61/353700661.db2.gz LPXDGVRSTOVNOG-UHFFFAOYSA-N 1 2 243.297 2.179 20 0 BEADLO C[C@@H]([NH2+]Cc1c[nH]nn1)[C@H]1CC2CCC1CC2 ZINC000398472256 363251004 /nfs/dbraw/zinc/25/10/04/363251004.db2.gz XOOMLSMTHYOKMK-ZUYNKMSQSA-N 1 2 234.347 2.109 20 0 BEADLO C[C@@H]([NH2+]Cc1cn[nH]n1)[C@H]1CC2CCC1CC2 ZINC000398472256 363251007 /nfs/dbraw/zinc/25/10/07/363251007.db2.gz XOOMLSMTHYOKMK-ZUYNKMSQSA-N 1 2 234.347 2.109 20 0 BEADLO Cc1noc([C@H](C)[NH2+]Cc2ccccc2)n1 ZINC000074071558 353742123 /nfs/dbraw/zinc/74/21/23/353742123.db2.gz HYVWDSLBKNSLBU-VIFPVBQESA-N 1 2 217.272 2.229 20 0 BEADLO Cc1noc([C@@H](C)[NH2+]Cc2cccs2)n1 ZINC000074071790 353744709 /nfs/dbraw/zinc/74/47/09/353744709.db2.gz OKXOVTHYVSVVQO-SSDOTTSWSA-N 1 2 223.301 2.290 20 0 BEADLO Fc1ccccc1C[N@H+](C1CC1)C1COC1 ZINC000289388302 181011522 /nfs/dbraw/zinc/01/15/22/181011522.db2.gz QRJRDAPKLYKLCD-UHFFFAOYSA-N 1 2 221.275 2.189 20 0 BEADLO Fc1ccccc1C[N@@H+](C1CC1)C1COC1 ZINC000289388302 181011525 /nfs/dbraw/zinc/01/15/25/181011525.db2.gz QRJRDAPKLYKLCD-UHFFFAOYSA-N 1 2 221.275 2.189 20 0 BEADLO OCc1ccc(NCc2cc(C3CC3)no2)[nH+]c1 ZINC000639133170 353842742 /nfs/dbraw/zinc/84/27/42/353842742.db2.gz ZXDCOVQELIZKHQ-UHFFFAOYSA-N 1 2 245.282 2.051 20 0 BEADLO FCC[NH2+]Cc1nc2cc(F)ccc2o1 ZINC000639133100 353842846 /nfs/dbraw/zinc/84/28/46/353842846.db2.gz ILEXSBFKEXBKDV-UHFFFAOYSA-N 1 2 212.199 2.026 20 0 BEADLO OCc1ccc(C[NH2+]C2(C(F)F)CC2)cc1 ZINC000639139882 353848712 /nfs/dbraw/zinc/84/87/12/353848712.db2.gz PWKIVLSPVSYSTM-UHFFFAOYSA-N 1 2 227.254 2.066 20 0 BEADLO CC[C@](C)(C[NH2+]C1(C(F)F)CC1)OC ZINC000639139334 353855956 /nfs/dbraw/zinc/85/59/56/353855956.db2.gz JIAYXGJYCXPURX-SECBINFHSA-N 1 2 207.264 2.189 20 0 BEADLO Cc1cc(N2CC(F)C2)nc(-c2ccncc2)[nH+]1 ZINC000343497253 353913136 /nfs/dbraw/zinc/91/31/36/353913136.db2.gz DFJPCKSLSFSCBS-UHFFFAOYSA-N 1 2 244.273 2.005 20 0 BEADLO Cc1nc(N2CC(C3CCCC3)C2)cc[nH+]1 ZINC000334535684 353921485 /nfs/dbraw/zinc/92/14/85/353921485.db2.gz ZUDSOXNLDKQVQR-UHFFFAOYSA-N 1 2 217.316 2.411 20 0 BEADLO c1cc(NC[C@@H]2CCCCS2)nc(C2CC2)[nH+]1 ZINC000343604756 353931692 /nfs/dbraw/zinc/93/16/92/353931692.db2.gz SGAWEZMHQNCGCA-NSHDSACASA-N 1 2 249.383 2.474 20 0 BEADLO c1cc(NC[C@H]2CCCCS2)nc(C2CC2)[nH+]1 ZINC000343604755 353931858 /nfs/dbraw/zinc/93/18/58/353931858.db2.gz SGAWEZMHQNCGCA-LLVKDONJSA-N 1 2 249.383 2.474 20 0 BEADLO CC[C@H](C)[C@H](CN1CC[N@@H+](CC)C[C@@H]1C)OC ZINC000639161157 353942431 /nfs/dbraw/zinc/94/24/31/353942431.db2.gz WTMREEXTYHPEHN-IHRRRGAJSA-N 1 2 242.407 2.074 20 0 BEADLO COc1cccc(C)c1C[NH2+]CC(F)F ZINC000639161999 353948270 /nfs/dbraw/zinc/94/82/70/353948270.db2.gz KQPSIZCXYRDXNV-UHFFFAOYSA-N 1 2 215.243 2.358 20 0 BEADLO Cc1cccc(C[N@@H+]2CCO[C@H](C3CC3)C2)n1 ZINC000334552162 353993091 /nfs/dbraw/zinc/99/30/91/353993091.db2.gz RZEVOFYTRLXSLV-AWEZNQCLSA-N 1 2 232.327 2.001 20 0 BEADLO Cc1cccc(C[N@H+]2CCO[C@H](C3CC3)C2)n1 ZINC000334552162 353993094 /nfs/dbraw/zinc/99/30/94/353993094.db2.gz RZEVOFYTRLXSLV-AWEZNQCLSA-N 1 2 232.327 2.001 20 0 BEADLO CC1(C[NH2+][C@H](c2nnc[nH]2)c2ccccc2)CC1 ZINC000343650728 353954216 /nfs/dbraw/zinc/95/42/16/353954216.db2.gz BVRVSXVOERRJLD-LBPRGKRZSA-N 1 2 242.326 2.284 20 0 BEADLO C[C@H]1CC[C@H]1Nc1cc(N2CCCC2)nc[nH+]1 ZINC000343809358 354011082 /nfs/dbraw/zinc/01/10/82/354011082.db2.gz OJFCHBKIHOBZNS-WDEREUQCSA-N 1 2 232.331 2.287 20 0 BEADLO C[C@H]1CC[C@H]1Nc1cc(N2CCCC2)[nH+]cn1 ZINC000343809358 354011084 /nfs/dbraw/zinc/01/10/84/354011084.db2.gz OJFCHBKIHOBZNS-WDEREUQCSA-N 1 2 232.331 2.287 20 0 BEADLO CO[C@@H](C)CN(C)c1cc[nH+]c(C(C)C)n1 ZINC000343818467 354013779 /nfs/dbraw/zinc/01/37/79/354013779.db2.gz VYXDVZFBKVORMJ-JTQLQIEISA-N 1 2 223.320 2.071 20 0 BEADLO CC[C@]1(C)C[C@@H]1C(=O)NC[C@@H](C)Cn1cc[nH+]c1 ZINC000343784763 354018288 /nfs/dbraw/zinc/01/82/88/354018288.db2.gz VDALKTPTYIIOEH-YRGRVCCFSA-N 1 2 249.358 2.072 20 0 BEADLO C[C@@H]1CC[C@H]1[NH+]=c1[nH]c2c(cccc2F)n1C ZINC000343842648 354019689 /nfs/dbraw/zinc/01/96/89/354019689.db2.gz HIBAIYCGASFOLF-PSASIEDQSA-N 1 2 233.290 2.345 20 0 BEADLO CCC(C)(C)CC[S@@](=O)Cc1c[nH+]cn1C ZINC000343862619 354024966 /nfs/dbraw/zinc/02/49/66/354024966.db2.gz ORSZFIKQYVGVDN-MRXNPFEDSA-N 1 2 242.388 2.495 20 0 BEADLO Cc1cc(N(C)CCc2ccccc2O)nc[nH+]1 ZINC000343873928 354028966 /nfs/dbraw/zinc/02/89/66/354028966.db2.gz NGPZNNIIWVFBRV-UHFFFAOYSA-N 1 2 243.310 2.170 20 0 BEADLO CC(C)=CCN1CC[NH+](Cc2ccco2)CC1 ZINC000053440940 363288814 /nfs/dbraw/zinc/28/88/14/363288814.db2.gz DNGNELDKOOQBLT-UHFFFAOYSA-N 1 2 234.343 2.363 20 0 BEADLO C[C@@H]1CC[N@H+](C[C@H](O)C(C)(C)C)CC1(F)F ZINC000343938948 354048508 /nfs/dbraw/zinc/04/85/08/354048508.db2.gz UDNBDFFFHXLNRP-ZJUUUORDSA-N 1 2 235.318 2.371 20 0 BEADLO C[C@@H]1CC[N@@H+](C[C@H](O)C(C)(C)C)CC1(F)F ZINC000343938948 354048510 /nfs/dbraw/zinc/04/85/10/354048510.db2.gz UDNBDFFFHXLNRP-ZJUUUORDSA-N 1 2 235.318 2.371 20 0 BEADLO C[C@@H]1CC[N@H+](C[C@@H](O)C(C)(C)C)CC1(F)F ZINC000343938940 354048674 /nfs/dbraw/zinc/04/86/74/354048674.db2.gz UDNBDFFFHXLNRP-NXEZZACHSA-N 1 2 235.318 2.371 20 0 BEADLO C[C@@H]1CC[N@@H+](C[C@@H](O)C(C)(C)C)CC1(F)F ZINC000343938940 354048675 /nfs/dbraw/zinc/04/86/75/354048675.db2.gz UDNBDFFFHXLNRP-NXEZZACHSA-N 1 2 235.318 2.371 20 0 BEADLO Cc1ccnc(NCc2c[nH+]cn2C)c1Cl ZINC000309705721 491058709 /nfs/dbraw/zinc/05/87/09/491058709.db2.gz OKBXNYQHMSBIRY-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@H](C(C)(C)C)C2)no1 ZINC000334571068 354098921 /nfs/dbraw/zinc/09/89/21/354098921.db2.gz MWCAECWLIOZCIX-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@H](C(C)(C)C)C2)no1 ZINC000334571068 354098924 /nfs/dbraw/zinc/09/89/24/354098924.db2.gz MWCAECWLIOZCIX-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO COc1cc[nH+]cc1CSc1ncc[nH]1 ZINC000344120254 354143452 /nfs/dbraw/zinc/14/34/52/354143452.db2.gz ZDUPOXLFZTVBJX-UHFFFAOYSA-N 1 2 221.285 2.106 20 0 BEADLO CCC1CC([NH2+][C@@H](C)C(=O)OC(C)C)C1 ZINC000449664930 201998221 /nfs/dbraw/zinc/99/82/21/201998221.db2.gz QCDNRFDSNGWIDG-WHXUTIOJSA-N 1 2 213.321 2.105 20 0 BEADLO CC(C)[C@H](C)CC(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000344256086 354191354 /nfs/dbraw/zinc/19/13/54/354191354.db2.gz VSFARCCRDQQRDO-MNOVXSKESA-N 1 2 249.358 2.065 20 0 BEADLO CC(C)[C@H](C)CC(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000344256086 354191357 /nfs/dbraw/zinc/19/13/57/354191357.db2.gz VSFARCCRDQQRDO-MNOVXSKESA-N 1 2 249.358 2.065 20 0 BEADLO CC(C)[C@@H](C)CC(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000344256089 354191574 /nfs/dbraw/zinc/19/15/74/354191574.db2.gz VSFARCCRDQQRDO-QWRGUYRKSA-N 1 2 249.358 2.065 20 0 BEADLO CC(C)[C@@H](C)CC(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000344256089 354191576 /nfs/dbraw/zinc/19/15/76/354191576.db2.gz VSFARCCRDQQRDO-QWRGUYRKSA-N 1 2 249.358 2.065 20 0 BEADLO FC1C[NH+](Cc2cccc3cc[nH]c32)C1 ZINC000334587979 354214511 /nfs/dbraw/zinc/21/45/11/354214511.db2.gz ICPCWNGJNCEPSM-UHFFFAOYSA-N 1 2 204.248 2.322 20 0 BEADLO Cc1nnsc1C[N@@H+](C)Cc1ccc(O)cc1 ZINC000639176162 354218916 /nfs/dbraw/zinc/21/89/16/354218916.db2.gz YSUSYWHKSFDSNV-UHFFFAOYSA-N 1 2 249.339 2.184 20 0 BEADLO Cc1nnsc1C[N@H+](C)Cc1ccc(O)cc1 ZINC000639176162 354218918 /nfs/dbraw/zinc/21/89/18/354218918.db2.gz YSUSYWHKSFDSNV-UHFFFAOYSA-N 1 2 249.339 2.184 20 0 BEADLO Cc1cc(C(=O)Nc2c(C)cc[nH+]c2C)on1 ZINC000334595257 354227763 /nfs/dbraw/zinc/22/77/63/354227763.db2.gz JHUNEJSBMZOVSN-UHFFFAOYSA-N 1 2 231.255 2.247 20 0 BEADLO Cc1cc(CNc2ccc[nH+]c2C)n(C)n1 ZINC000334598109 354232685 /nfs/dbraw/zinc/23/26/85/354232685.db2.gz KUKDPMXHLRILOG-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO COC1(C)C[NH+](Cc2cc3ccccc3n2C)C1 ZINC000639180624 354284088 /nfs/dbraw/zinc/28/40/88/354284088.db2.gz ODFSHNGXWWVKOC-UHFFFAOYSA-N 1 2 244.338 2.399 20 0 BEADLO C[N@H+](CC(F)F)C[C@@H](O)CC1CCCC1 ZINC000232145549 363365312 /nfs/dbraw/zinc/36/53/12/363365312.db2.gz IRUFXYMOIAURHE-JTQLQIEISA-N 1 2 221.291 2.125 20 0 BEADLO C[N@@H+](CC(F)F)C[C@@H](O)CC1CCCC1 ZINC000232145549 363365317 /nfs/dbraw/zinc/36/53/17/363365317.db2.gz IRUFXYMOIAURHE-JTQLQIEISA-N 1 2 221.291 2.125 20 0 BEADLO Cn1cc[nH+]c1CN1CCc2ccc(F)c(F)c21 ZINC000334617440 354305353 /nfs/dbraw/zinc/30/53/53/354305353.db2.gz DJOFRASCGISQQF-UHFFFAOYSA-N 1 2 249.264 2.261 20 0 BEADLO Cc1nc(C[NH+]2CC3(C2)CCCOC3)cs1 ZINC000334600648 354278341 /nfs/dbraw/zinc/27/83/41/354278341.db2.gz SPNRTYPWASICJJ-UHFFFAOYSA-N 1 2 238.356 2.064 20 0 BEADLO CCC1CN(C(=O)Nc2ccn3cc[nH+]c3c2)C1 ZINC000334633445 354377512 /nfs/dbraw/zinc/37/75/12/354377512.db2.gz RKYCVIFANCEMEN-UHFFFAOYSA-N 1 2 244.298 2.208 20 0 BEADLO CC[C@H](C)C(=O)Nc1c[nH+]c2n1CCCC2 ZINC000334633987 354378895 /nfs/dbraw/zinc/37/88/95/354378895.db2.gz OMPNWYPMYVZGLM-VIFPVBQESA-N 1 2 221.304 2.204 20 0 BEADLO C[C@H](O)[C@H](C)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000578007343 366176122 /nfs/dbraw/zinc/17/61/22/366176122.db2.gz LZAQZLSDDZGBON-QWRGUYRKSA-N 1 2 231.299 2.054 20 0 BEADLO C[C@@H]1CCC[C@@]1(C)C(=O)N1CCn2cc[nH+]c2C1 ZINC000334667039 354406424 /nfs/dbraw/zinc/40/64/24/354406424.db2.gz WMYPVLHNKNRAFY-BXUZGUMPSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1ccc(CS(=O)(=O)C2CCC2)c(C)[nH+]1 ZINC000334674533 354417628 /nfs/dbraw/zinc/41/76/28/354417628.db2.gz FYPARBWMRUQGAZ-UHFFFAOYSA-N 1 2 239.340 2.166 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CC[C@@](C)(F)C1 ZINC000334675220 354418234 /nfs/dbraw/zinc/41/82/34/354418234.db2.gz KEYFFHPNTZNGSB-GFCCVEGCSA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CC[C@@](C)(F)C1 ZINC000334675220 354418241 /nfs/dbraw/zinc/41/82/41/354418241.db2.gz KEYFFHPNTZNGSB-GFCCVEGCSA-N 1 2 225.311 2.398 20 0 BEADLO CCn1ncnc1C[N@@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC000639190416 354426048 /nfs/dbraw/zinc/42/60/48/354426048.db2.gz AFOPKFSVHMCNLO-ZDUSSCGKSA-N 1 2 246.358 2.063 20 0 BEADLO CCn1ncnc1C[N@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC000639190416 354426052 /nfs/dbraw/zinc/42/60/52/354426052.db2.gz AFOPKFSVHMCNLO-ZDUSSCGKSA-N 1 2 246.358 2.063 20 0 BEADLO Cc1cc(C)c(CNC(=O)N(C)C(C)C)c[nH+]1 ZINC000334682010 354427611 /nfs/dbraw/zinc/42/76/11/354427611.db2.gz XGTCHSITSPEMGZ-UHFFFAOYSA-N 1 2 235.331 2.248 20 0 BEADLO CC1=C[C@@H](C)C[N@@H+]([C@H](C)c2csnn2)C1 ZINC000334650770 354442969 /nfs/dbraw/zinc/44/29/69/354442969.db2.gz GKXJYOADKNTDGA-PSASIEDQSA-N 1 2 223.345 2.497 20 0 BEADLO CC1=C[C@@H](C)C[N@H+]([C@H](C)c2csnn2)C1 ZINC000334650770 354442972 /nfs/dbraw/zinc/44/29/72/354442972.db2.gz GKXJYOADKNTDGA-PSASIEDQSA-N 1 2 223.345 2.497 20 0 BEADLO CC[C@@]1(C)COCC[N@@H+]1Cc1ccncc1F ZINC000334657241 354451955 /nfs/dbraw/zinc/45/19/55/354451955.db2.gz WQKOJIJCOXMQBS-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO CC[C@@]1(C)COCC[N@H+]1Cc1ccncc1F ZINC000334657241 354451958 /nfs/dbraw/zinc/45/19/58/354451958.db2.gz WQKOJIJCOXMQBS-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO FC(F)(F)[C@@H]([NH2+]CCC[C@H]1CCO1)C1CC1 ZINC000639189367 354452152 /nfs/dbraw/zinc/45/21/52/354452152.db2.gz XVBRGMZYNSKNFW-UWVGGRQHSA-N 1 2 237.265 2.486 20 0 BEADLO CC[C@@]1(C)COCC[N@@H+]1Cc1csc(C)n1 ZINC000334658857 354454992 /nfs/dbraw/zinc/45/49/92/354454992.db2.gz JJOFJKDFSKCYOJ-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO CC[C@@]1(C)COCC[N@H+]1Cc1csc(C)n1 ZINC000334658857 354454995 /nfs/dbraw/zinc/45/49/95/354454995.db2.gz JJOFJKDFSKCYOJ-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO CC(C)[C@@H](C)Sc1[nH+]cnc2c1cnn2C ZINC000335922967 134007869 /nfs/dbraw/zinc/00/78/69/134007869.db2.gz JUFMIBXHQKZRNV-MRVPVSSYSA-N 1 2 236.344 2.500 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)C2(C)CCC2)c2[nH+]ccn21 ZINC000334752014 354485213 /nfs/dbraw/zinc/48/52/13/354485213.db2.gz OAPZMQTXAWEOPZ-ZJUUUORDSA-N 1 2 233.315 2.195 20 0 BEADLO Cc1cncc(C[N@@H+]2CCC[C@H]2c2ncc[nH]2)c1 ZINC000334749637 354474812 /nfs/dbraw/zinc/47/48/12/354474812.db2.gz GKXMCQXAHQYTNV-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cncc(C[N@H+]2CCC[C@H]2c2ncc[nH]2)c1 ZINC000334749637 354474813 /nfs/dbraw/zinc/47/48/13/354474813.db2.gz GKXMCQXAHQYTNV-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO C[C@@H]1C[C@@H]1CC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000334731043 354530972 /nfs/dbraw/zinc/53/09/72/354530972.db2.gz KQLVLECBNQEZQP-NXEZZACHSA-N 1 2 229.283 2.319 20 0 BEADLO C[C@H]1C[C@H]1CC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000334731044 354531237 /nfs/dbraw/zinc/53/12/37/354531237.db2.gz KQLVLECBNQEZQP-UWVGGRQHSA-N 1 2 229.283 2.319 20 0 BEADLO CC[C@@]1(C)C[N@H+](Cc2ccncc2F)CCO1 ZINC000334734398 354534391 /nfs/dbraw/zinc/53/43/91/354534391.db2.gz COVRBRVHSXNMKE-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO CC[C@@]1(C)C[N@@H+](Cc2ccncc2F)CCO1 ZINC000334734398 354534393 /nfs/dbraw/zinc/53/43/93/354534393.db2.gz COVRBRVHSXNMKE-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO Cc1cc(C)c(NC(=O)NCCF)c(C)[nH+]1 ZINC000334704819 354498685 /nfs/dbraw/zinc/49/86/85/354498685.db2.gz AGUHZNWIYQOVRK-UHFFFAOYSA-N 1 2 225.267 2.098 20 0 BEADLO Cc1nc(COc2cc[nH+]cc2)cs1 ZINC000334709937 354505900 /nfs/dbraw/zinc/50/59/00/354505900.db2.gz DBKXXXAZYYJSES-UHFFFAOYSA-N 1 2 206.270 2.426 20 0 BEADLO COC1C[NH+](Cc2ccc3occc3c2)C1 ZINC000334740581 354544581 /nfs/dbraw/zinc/54/45/81/354544581.db2.gz NWNJCWHZUVNTGE-UHFFFAOYSA-N 1 2 217.268 2.263 20 0 BEADLO Cc1nc(N2CC(C)(C)C[C@@H]2C)cc[nH+]1 ZINC000334714922 354513175 /nfs/dbraw/zinc/51/31/75/354513175.db2.gz JSZPCIBHVRKIMT-VIFPVBQESA-N 1 2 205.305 2.410 20 0 BEADLO CC1(C)CC=C(C(=O)NCc2c[nH+]c[nH]2)CC1 ZINC000334716664 354515538 /nfs/dbraw/zinc/51/55/38/354515538.db2.gz YHXDOVQVNRKMGJ-UHFFFAOYSA-N 1 2 233.315 2.162 20 0 BEADLO CC1(C)CC=C(C(=O)NCc2c[nH]c[nH+]2)CC1 ZINC000334716664 354515542 /nfs/dbraw/zinc/51/55/42/354515542.db2.gz YHXDOVQVNRKMGJ-UHFFFAOYSA-N 1 2 233.315 2.162 20 0 BEADLO CC(C)c1nc(N[C@H]2CS[C@H](C)C2)cc[nH+]1 ZINC000334802714 354558557 /nfs/dbraw/zinc/55/85/57/354558557.db2.gz ADHAQDPTQKKAKU-NXEZZACHSA-N 1 2 237.372 2.328 20 0 BEADLO C[C@@H]1C[C@@H](Nc2cc[nH+]c3ccncc23)CS1 ZINC000334805567 354561795 /nfs/dbraw/zinc/56/17/95/354561795.db2.gz KTKGZXSVFWBZGG-NXEZZACHSA-N 1 2 245.351 2.358 20 0 BEADLO C[C@H]1C[C@H](Nc2cc[nH+]c(C3CC3)n2)CS1 ZINC000334808232 354564769 /nfs/dbraw/zinc/56/47/69/354564769.db2.gz WTDYAOFLNPCCTE-WPRPVWTQSA-N 1 2 235.356 2.082 20 0 BEADLO Cn1c[nH+]cc1CCC(=O)N1CCC(C)(C)CC1 ZINC000334815542 354573637 /nfs/dbraw/zinc/57/36/37/354573637.db2.gz VCESWZLYHGBDBU-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)c2ccccc2)c2[nH+]ccn21 ZINC000334743795 354547602 /nfs/dbraw/zinc/54/76/02/354547602.db2.gz NCORHMMVNKMWFP-CMPLNLGQSA-N 1 2 241.294 2.319 20 0 BEADLO CC(C)n1cncc1C[N@@H+]1CCOC2(CCC2)C1 ZINC000335082151 354615019 /nfs/dbraw/zinc/61/50/19/354615019.db2.gz CVXXFDGTJONNFT-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO CC(C)n1cncc1C[N@H+]1CCOC2(CCC2)C1 ZINC000335082151 354615022 /nfs/dbraw/zinc/61/50/22/354615022.db2.gz CVXXFDGTJONNFT-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO CC(C)n1c[nH+]cc1CN1CCOC2(CCC2)C1 ZINC000335082151 354615027 /nfs/dbraw/zinc/61/50/27/354615027.db2.gz CVXXFDGTJONNFT-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO Cc1ccsc1C[N@@H+]1CC[S@@](=O)[C@H](C)C1 ZINC000335085425 354618926 /nfs/dbraw/zinc/61/89/26/354618926.db2.gz LCAKKYAHMNJFBI-MEBBXXQBSA-N 1 2 243.397 2.009 20 0 BEADLO Cc1ccsc1C[N@H+]1CC[S@@](=O)[C@H](C)C1 ZINC000335085425 354618929 /nfs/dbraw/zinc/61/89/29/354618929.db2.gz LCAKKYAHMNJFBI-MEBBXXQBSA-N 1 2 243.397 2.009 20 0 BEADLO c1cc(C[NH2+][C@H]2CCCNc3ccccc32)[nH]n1 ZINC000335133095 354780263 /nfs/dbraw/zinc/78/02/63/354780263.db2.gz CCGIYXTXSMMZAM-AWEZNQCLSA-N 1 2 242.326 2.446 20 0 BEADLO FC(F)(F)COCCC[N@@H+]1CCC(F)(F)C1 ZINC000345812835 354781232 /nfs/dbraw/zinc/78/12/32/354781232.db2.gz ZLEVQEVUDXQOPG-UHFFFAOYSA-N 1 2 247.207 2.296 20 0 BEADLO FC(F)(F)COCCC[N@H+]1CCC(F)(F)C1 ZINC000345812835 354781235 /nfs/dbraw/zinc/78/12/35/354781235.db2.gz ZLEVQEVUDXQOPG-UHFFFAOYSA-N 1 2 247.207 2.296 20 0 BEADLO Cc1cc(C[NH2+][C@@H]2CCCc3scnc32)[nH]n1 ZINC000623896627 354792391 /nfs/dbraw/zinc/79/23/91/354792391.db2.gz XFXPMKVOYZYZPT-SNVBAGLBSA-N 1 2 248.355 2.342 20 0 BEADLO C[N@H+](CCO)Cc1cc(Cl)sc1Cl ZINC000234294732 363419349 /nfs/dbraw/zinc/41/93/49/363419349.db2.gz DDAWFZVDQSZUGB-UHFFFAOYSA-N 1 2 240.155 2.479 20 0 BEADLO C[N@@H+](CCO)Cc1cc(Cl)sc1Cl ZINC000234294732 363419355 /nfs/dbraw/zinc/41/93/55/363419355.db2.gz DDAWFZVDQSZUGB-UHFFFAOYSA-N 1 2 240.155 2.479 20 0 BEADLO CC[C@H](C)CN(C)C(=O)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000346303781 354890992 /nfs/dbraw/zinc/89/09/92/354890992.db2.gz MJYFKESZYCPALQ-WDEREUQCSA-N 1 2 249.358 2.334 20 0 BEADLO Cc1cc(N2CC(C)(C)[C@@H]2C2CC2)nc[nH+]1 ZINC000335166364 354923816 /nfs/dbraw/zinc/92/38/16/354923816.db2.gz MZOAPRYJDWJATQ-LBPRGKRZSA-N 1 2 217.316 2.410 20 0 BEADLO C[C@H]1OCC[C@H]1Nc1ccc(N2CCCC2)c[nH+]1 ZINC000346423077 354924949 /nfs/dbraw/zinc/92/49/49/354924949.db2.gz ZCDMIQBQHKZSNO-DGCLKSJQSA-N 1 2 247.342 2.271 20 0 BEADLO CCN(C(=O)CCn1cc[nH+]c1)C1CC(C)(C)C1 ZINC000412814415 191314058 /nfs/dbraw/zinc/31/40/58/191314058.db2.gz RKXNJXRSMIEXLC-UHFFFAOYSA-N 1 2 249.358 2.310 20 0 BEADLO CC(C)c1nc(N[C@H](C)[C@H]2CCCCO2)cc[nH+]1 ZINC000346464868 354953707 /nfs/dbraw/zinc/95/37/07/354953707.db2.gz UKTHPNNEQFIJHG-VXGBXAGGSA-N 1 2 249.358 2.391 20 0 BEADLO Cc1c(F)cccc1NC(=O)CCn1cc[nH+]c1 ZINC000346621146 354995913 /nfs/dbraw/zinc/99/59/13/354995913.db2.gz QZYSCJLSWMPCRP-UHFFFAOYSA-N 1 2 247.273 2.359 20 0 BEADLO Cc1cccc(C[N@@H+]2CCC[C@H]2c2ncc[nH]2)n1 ZINC000335189541 355021641 /nfs/dbraw/zinc/02/16/41/355021641.db2.gz CLHJTALFPWIAGX-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc(C[N@H+]2CCC[C@H]2c2ncc[nH]2)n1 ZINC000335189541 355021645 /nfs/dbraw/zinc/02/16/45/355021645.db2.gz CLHJTALFPWIAGX-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO C[C@@H]1CC(C)(C)C[N@@H+]1Cc1csnn1 ZINC000335192998 355026076 /nfs/dbraw/zinc/02/60/76/355026076.db2.gz SOVHSMZAXNFAAW-MRVPVSSYSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]1CC(C)(C)C[N@H+]1Cc1csnn1 ZINC000335192998 355026078 /nfs/dbraw/zinc/02/60/78/355026078.db2.gz SOVHSMZAXNFAAW-MRVPVSSYSA-N 1 2 211.334 2.159 20 0 BEADLO CC1(C)CCC(C(=O)NCc2c[nH+]c[nH]2)CC1 ZINC000335194702 355027533 /nfs/dbraw/zinc/02/75/33/355027533.db2.gz DJXOKWWGGREXNY-UHFFFAOYSA-N 1 2 235.331 2.242 20 0 BEADLO CC1(C)CCC(C(=O)NCc2c[nH]c[nH+]2)CC1 ZINC000335194702 355027537 /nfs/dbraw/zinc/02/75/37/355027537.db2.gz DJXOKWWGGREXNY-UHFFFAOYSA-N 1 2 235.331 2.242 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000335183368 355081887 /nfs/dbraw/zinc/08/18/87/355081887.db2.gz BYVDYCWOQCTTGM-ZYHUDNBSSA-N 1 2 247.342 2.162 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000335183368 355081891 /nfs/dbraw/zinc/08/18/91/355081891.db2.gz BYVDYCWOQCTTGM-ZYHUDNBSSA-N 1 2 247.342 2.162 20 0 BEADLO CC1(CNc2cc[nH+]c(C3CC3)n2)CCOCC1 ZINC000346695805 355059612 /nfs/dbraw/zinc/05/96/12/355059612.db2.gz HBDWWJJZCOHIEN-UHFFFAOYSA-N 1 2 247.342 2.005 20 0 BEADLO Cc1cc(NC(=O)c2[nH]ccc2C2CC2)cc[nH+]1 ZINC000335225186 355066270 /nfs/dbraw/zinc/06/62/70/355066270.db2.gz SRQFXIKPNUILCS-UHFFFAOYSA-N 1 2 241.294 2.270 20 0 BEADLO COc1cc[nH+]cc1NC(=O)CCc1ccco1 ZINC000346724402 355104581 /nfs/dbraw/zinc/10/45/81/355104581.db2.gz VUMZVLHWHAWVHE-UHFFFAOYSA-N 1 2 246.266 2.255 20 0 BEADLO C[C@H](N[C@H]1CCC[N@H+](C)[C@H]1C)c1ccccn1 ZINC000346785801 355116584 /nfs/dbraw/zinc/11/65/84/355116584.db2.gz AGSUZNQUJLCDJJ-OBJOEFQTSA-N 1 2 233.359 2.215 20 0 BEADLO C[C@H](N[C@H]1CCC[N@@H+](C)[C@H]1C)c1ccccn1 ZINC000346785801 355116585 /nfs/dbraw/zinc/11/65/85/355116585.db2.gz AGSUZNQUJLCDJJ-OBJOEFQTSA-N 1 2 233.359 2.215 20 0 BEADLO Cc1cc(NC(=O)N(C)[C@@H]2CC[C@@H](C)C2)cc[nH+]1 ZINC000335231528 355092608 /nfs/dbraw/zinc/09/26/08/355092608.db2.gz RFFDCPYESXFGCK-ZWNOBZJWSA-N 1 2 247.342 2.464 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1cnc(C)s1 ZINC000346707879 355098341 /nfs/dbraw/zinc/09/83/41/355098341.db2.gz SBKBXRIWBBCSCF-UHFFFAOYSA-N 1 2 249.295 2.107 20 0 BEADLO Cc1nocc1C[NH2+]Cc1cnc(C2CC2)o1 ZINC000639228202 355101768 /nfs/dbraw/zinc/10/17/68/355101768.db2.gz RIIWORVHDHMMPZ-UHFFFAOYSA-N 1 2 233.271 2.138 20 0 BEADLO Cc1nc(C[N@@H+]2CCCCC(C)(C)C2)no1 ZINC000335248138 355165524 /nfs/dbraw/zinc/16/55/24/355165524.db2.gz FKCXYPQBTICAJY-UHFFFAOYSA-N 1 2 223.320 2.390 20 0 BEADLO Cc1nc(C[N@H+]2CCCCC(C)(C)C2)no1 ZINC000335248138 355165525 /nfs/dbraw/zinc/16/55/25/355165525.db2.gz FKCXYPQBTICAJY-UHFFFAOYSA-N 1 2 223.320 2.390 20 0 BEADLO CCOc1ccc(CNc2cc(C)[nH+]cn2)cc1 ZINC000346955961 355167482 /nfs/dbraw/zinc/16/74/82/355167482.db2.gz ZYKPIUSHDFMYGG-UHFFFAOYSA-N 1 2 243.310 2.218 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CC23CCCC3)cc[nH+]1 ZINC000346847867 355136504 /nfs/dbraw/zinc/13/65/04/355136504.db2.gz VHYIVYMERLBMAJ-LBPRGKRZSA-N 1 2 230.311 2.331 20 0 BEADLO Cc1nc(C[N@H+](C)CCOC2CCC2)cs1 ZINC000346849712 355137598 /nfs/dbraw/zinc/13/75/98/355137598.db2.gz RAIIUMBRVJQILO-UHFFFAOYSA-N 1 2 240.372 2.452 20 0 BEADLO Cc1nc(C[N@@H+](C)CCOC2CCC2)cs1 ZINC000346849712 355137603 /nfs/dbraw/zinc/13/76/03/355137603.db2.gz RAIIUMBRVJQILO-UHFFFAOYSA-N 1 2 240.372 2.452 20 0 BEADLO CC[C@H]([NH2+]Cc1cocn1)c1c(C)nn(C)c1C ZINC000346852850 355138670 /nfs/dbraw/zinc/13/86/70/355138670.db2.gz JTJRGHKLCSRADY-LBPRGKRZSA-N 1 2 248.330 2.266 20 0 BEADLO COc1ccncc1C[N@H+](C)CCC(F)(F)F ZINC000346899600 355148221 /nfs/dbraw/zinc/14/82/21/355148221.db2.gz IJGQPBJMQTWTDV-UHFFFAOYSA-N 1 2 248.248 2.474 20 0 BEADLO COc1ccncc1C[N@@H+](C)CCC(F)(F)F ZINC000346899600 355148223 /nfs/dbraw/zinc/14/82/23/355148223.db2.gz IJGQPBJMQTWTDV-UHFFFAOYSA-N 1 2 248.248 2.474 20 0 BEADLO C[C@H]1CN(c2cc(NC3CC3)[nH+]cn2)C[C@H]1C ZINC000413170811 191361470 /nfs/dbraw/zinc/36/14/70/191361470.db2.gz OCVDUUCWEJFLPV-AOOOYVTPSA-N 1 2 232.331 2.143 20 0 BEADLO C[C@H]1CN(c2cc(NC3CC3)nc[nH+]2)C[C@H]1C ZINC000413170811 191361473 /nfs/dbraw/zinc/36/14/73/191361473.db2.gz OCVDUUCWEJFLPV-AOOOYVTPSA-N 1 2 232.331 2.143 20 0 BEADLO COC(=O)C(C)(C)[NH2+]C[C@H]1C[C@H]1c1ccccc1 ZINC000347630180 355241190 /nfs/dbraw/zinc/24/11/90/355241190.db2.gz IANOEQDQKVGQGJ-OLZOCXBDSA-N 1 2 247.338 2.331 20 0 BEADLO c1nc(N2C[C@@H]3CCC[C@H]3C2)cc(NC2CC2)[nH+]1 ZINC000413177519 191361284 /nfs/dbraw/zinc/36/12/84/191361284.db2.gz AXNRWFUBNIUQBW-QWRGUYRKSA-N 1 2 244.342 2.287 20 0 BEADLO c1nc(NC2CC2)cc(N2C[C@@H]3CCC[C@H]3C2)[nH+]1 ZINC000413177519 191361287 /nfs/dbraw/zinc/36/12/87/191361287.db2.gz AXNRWFUBNIUQBW-QWRGUYRKSA-N 1 2 244.342 2.287 20 0 BEADLO CC(C)C1(C[N@@H+](CC(F)F)C[C@H](C)O)CC1 ZINC000639234687 355219302 /nfs/dbraw/zinc/21/93/02/355219302.db2.gz KZXXCBVEINCEIR-JTQLQIEISA-N 1 2 235.318 2.371 20 0 BEADLO CC(C)C1(C[N@H+](CC(F)F)C[C@H](C)O)CC1 ZINC000639234687 355219304 /nfs/dbraw/zinc/21/93/04/355219304.db2.gz KZXXCBVEINCEIR-JTQLQIEISA-N 1 2 235.318 2.371 20 0 BEADLO CC[C@@H]1OCC[C@H]1Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000413455084 191385698 /nfs/dbraw/zinc/38/56/98/191385698.db2.gz RSZXNVTZRZUEDF-NEPJUHHUSA-N 1 2 247.342 2.064 20 0 BEADLO Cc1cc(NC[C@H]2CCC[C@H]2C2CC2)nc[nH+]1 ZINC000413483498 191387832 /nfs/dbraw/zinc/38/78/32/191387832.db2.gz RLXBMDOXBFHRKN-OLZOCXBDSA-N 1 2 231.343 2.445 20 0 BEADLO Cc1cc(NC[C@@H]2CCC[C@@H]2C2CC2)nc[nH+]1 ZINC000413483500 191387962 /nfs/dbraw/zinc/38/79/62/191387962.db2.gz RLXBMDOXBFHRKN-QWHCGFSZSA-N 1 2 231.343 2.445 20 0 BEADLO C[C@@H]1C[C@H](CNc2cccc[nH+]2)[C@H](C)O1 ZINC000413539440 191393433 /nfs/dbraw/zinc/39/34/33/191393433.db2.gz UBNIGBSDNOTLNU-OUAUKWLOSA-N 1 2 206.289 2.307 20 0 BEADLO C[C@@H]1CC[C@@H](C)N1c1cc(NC2CC2)[nH+]cn1 ZINC000413186933 191361893 /nfs/dbraw/zinc/36/18/93/191361893.db2.gz CWHQMIOOTJCLPS-NXEZZACHSA-N 1 2 232.331 2.428 20 0 BEADLO C[C@@H]1CC[C@@H](C)N1c1cc(NC2CC2)nc[nH+]1 ZINC000413186933 191361895 /nfs/dbraw/zinc/36/18/95/191361895.db2.gz CWHQMIOOTJCLPS-NXEZZACHSA-N 1 2 232.331 2.428 20 0 BEADLO F[C@@H]1CC[C@@H](Nc2cc(NC3CC3)[nH+]cn2)C1 ZINC000413290461 191369340 /nfs/dbraw/zinc/36/93/40/191369340.db2.gz AMJLSLORYFFLLM-PSASIEDQSA-N 1 2 236.294 2.353 20 0 BEADLO F[C@@H]1CC[C@@H](Nc2cc(NC3CC3)nc[nH+]2)C1 ZINC000413290461 191369342 /nfs/dbraw/zinc/36/93/42/191369342.db2.gz AMJLSLORYFFLLM-PSASIEDQSA-N 1 2 236.294 2.353 20 0 BEADLO Cc1nc(N[C@H]2C[C@@H](OC(C)C)C2)cc[nH+]1 ZINC000413390341 191378025 /nfs/dbraw/zinc/37/80/25/191378025.db2.gz XPWZFRIYGLPKGO-PHIMTYICSA-N 1 2 221.304 2.153 20 0 BEADLO CC(C)CCn1cccc1C[NH+]1CC(C)(O)C1 ZINC000639253213 355290366 /nfs/dbraw/zinc/29/03/66/355290366.db2.gz ARBSKRGOJXROGX-UHFFFAOYSA-N 1 2 236.359 2.101 20 0 BEADLO CC(C)Oc1ccc(C[NH+]2CC(C)(O)C2)cc1 ZINC000639253781 355293168 /nfs/dbraw/zinc/29/31/68/355293168.db2.gz GYLCESBIYWAKTM-UHFFFAOYSA-N 1 2 235.327 2.040 20 0 BEADLO CC(C)[N@H+](Cc1cocn1)Cc1cccnc1 ZINC000349238064 355372726 /nfs/dbraw/zinc/37/27/26/355372726.db2.gz GHGCXSCKGJEDNP-UHFFFAOYSA-N 1 2 231.299 2.480 20 0 BEADLO CC(C)[N@@H+](Cc1cocn1)Cc1cccnc1 ZINC000349238064 355372730 /nfs/dbraw/zinc/37/27/30/355372730.db2.gz GHGCXSCKGJEDNP-UHFFFAOYSA-N 1 2 231.299 2.480 20 0 BEADLO CC(C)[C@@H](C)N(C)C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000583508976 355346099 /nfs/dbraw/zinc/34/60/99/355346099.db2.gz ZPLFPPMOOCPQMM-GHMZBOCLSA-N 1 2 237.347 2.091 20 0 BEADLO CC(C)[C@@H](C)N(C)C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000583508976 355346102 /nfs/dbraw/zinc/34/61/02/355346102.db2.gz ZPLFPPMOOCPQMM-GHMZBOCLSA-N 1 2 237.347 2.091 20 0 BEADLO CC(C)[C@@H](C)N(C)C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000583508979 355346156 /nfs/dbraw/zinc/34/61/56/355346156.db2.gz ZPLFPPMOOCPQMM-WDEREUQCSA-N 1 2 237.347 2.091 20 0 BEADLO CC(C)[C@@H](C)N(C)C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000583508979 355346159 /nfs/dbraw/zinc/34/61/59/355346159.db2.gz ZPLFPPMOOCPQMM-WDEREUQCSA-N 1 2 237.347 2.091 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1ccnc(C)c1 ZINC000335789057 355439971 /nfs/dbraw/zinc/43/99/71/355439971.db2.gz BEYMZHAFGVBREA-UHFFFAOYSA-N 1 2 241.294 2.022 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCCc2c1cnn2C)c1ccon1 ZINC000349830956 355487760 /nfs/dbraw/zinc/48/77/60/355487760.db2.gz GMLSQDIPJAGAKY-JOYOIKCWSA-N 1 2 246.314 2.136 20 0 BEADLO CCn1cc([C@@H](C)[NH2+][C@H](C)c2ccon2)cn1 ZINC000349833790 355488798 /nfs/dbraw/zinc/48/87/98/355488798.db2.gz LSHSUJZLSMTJNB-NXEZZACHSA-N 1 2 234.303 2.303 20 0 BEADLO C[C@@H]1Oc2cc(F)ccc2[C@H]1[NH2+]Cc1cc[nH]n1 ZINC000335826745 355552041 /nfs/dbraw/zinc/55/20/41/355552041.db2.gz HIVUFWRKPAXJAD-SDBXPKJASA-N 1 2 247.273 2.161 20 0 BEADLO C[C@@H]1Oc2cc(F)ccc2[C@@H]1[NH2+]Cc1cc[nH]n1 ZINC000335826743 355552061 /nfs/dbraw/zinc/55/20/61/355552061.db2.gz HIVUFWRKPAXJAD-ISVAXAHUSA-N 1 2 247.273 2.161 20 0 BEADLO C[NH2+]Cc1noc(C(C)(C)c2cccc(F)c2)n1 ZINC000349886255 355518596 /nfs/dbraw/zinc/51/85/96/355518596.db2.gz VRRHQRMRMHDZIS-UHFFFAOYSA-N 1 2 249.289 2.254 20 0 BEADLO C[NH2+]Cc1noc(C[C@H]2CCC[C@H](C)C2)n1 ZINC000349893674 355521308 /nfs/dbraw/zinc/52/13/08/355521308.db2.gz NXVOJHYZWZSJHS-UWVGGRQHSA-N 1 2 223.320 2.158 20 0 BEADLO C[NH2+]Cc1noc(/C=C/C2CCCCC2)n1 ZINC000349898489 355522182 /nfs/dbraw/zinc/52/21/82/355522182.db2.gz UEHWPZUJHDMHAC-BQYQJAHWSA-N 1 2 221.304 2.383 20 0 BEADLO C[NH2+]Cc1noc(CCSc2ccccc2)n1 ZINC000349906049 355522797 /nfs/dbraw/zinc/52/27/97/355522797.db2.gz GBTQIJXKWOLEPH-UHFFFAOYSA-N 1 2 249.339 2.124 20 0 BEADLO Cc1nc(NC/C=C\c2ccccc2)cc[nH+]1 ZINC000349912691 355524721 /nfs/dbraw/zinc/52/47/21/355524721.db2.gz FMPOYVZQRGPBLY-YVMONPNESA-N 1 2 225.295 2.332 20 0 BEADLO C[NH2+]Cc1noc([C@@H](C)Cc2ccccc2F)n1 ZINC000349918743 355526584 /nfs/dbraw/zinc/52/65/84/355526584.db2.gz FQUKQLPWDJUSFE-VIFPVBQESA-N 1 2 249.289 2.274 20 0 BEADLO Cc1cc(Cl)cc(C[NH+]2CCOCC2)c1 ZINC000350098436 355596970 /nfs/dbraw/zinc/59/69/70/355596970.db2.gz KOHSVZKMYKMSMB-UHFFFAOYSA-N 1 2 225.719 2.481 20 0 BEADLO CCC[C@@H](CNc1cc(COC)cc[nH+]1)OC ZINC000639310024 355666464 /nfs/dbraw/zinc/66/64/64/355666464.db2.gz BBYBKVIEIXDAGT-LBPRGKRZSA-N 1 2 238.331 2.455 20 0 BEADLO CN(Cc1cn2c([nH+]1)CCCC2)C(=O)C(C)(C)C ZINC000335865809 355629920 /nfs/dbraw/zinc/62/99/20/355629920.db2.gz FIUKFQRPNVCBMN-UHFFFAOYSA-N 1 2 249.358 2.224 20 0 BEADLO NC(=O)[C@@H](c1ccccc1)[N@@H+]1CC[C@H](F)C1 ZINC000336261188 181204308 /nfs/dbraw/zinc/20/43/08/181204308.db2.gz SCPBHFKBQXDWNW-WDEREUQCSA-N 1 2 222.263 2.307 20 0 BEADLO NC(=O)[C@@H](c1ccccc1)[N@H+]1CC[C@H](F)C1 ZINC000336261188 181204310 /nfs/dbraw/zinc/20/43/10/181204310.db2.gz SCPBHFKBQXDWNW-WDEREUQCSA-N 1 2 222.263 2.307 20 0 BEADLO Cc1noc(C[N@H+]2CC[C@H](C(F)(F)F)[C@H]2C)n1 ZINC000336006188 134048900 /nfs/dbraw/zinc/04/89/00/134048900.db2.gz NKYDBNVROIDYBL-SVRRBLITSA-N 1 2 249.236 2.151 20 0 BEADLO Cc1noc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@H]2C)n1 ZINC000336006188 134048901 /nfs/dbraw/zinc/04/89/01/134048901.db2.gz NKYDBNVROIDYBL-SVRRBLITSA-N 1 2 249.236 2.151 20 0 BEADLO Cn1ncc2c1C[N@H+](C[C@]1(C)CCCS1)C2 ZINC000639319291 355710908 /nfs/dbraw/zinc/71/09/08/355710908.db2.gz FOECKGBJFJNACW-LBPRGKRZSA-N 1 2 237.372 2.021 20 0 BEADLO Cn1ncc2c1C[N@@H+](C[C@]1(C)CCCS1)C2 ZINC000639319291 355710912 /nfs/dbraw/zinc/71/09/12/355710912.db2.gz FOECKGBJFJNACW-LBPRGKRZSA-N 1 2 237.372 2.021 20 0 BEADLO CCc1nocc1C[N@@H+]1C[C@@H](C)O[C@@H](CC)C1 ZINC000350699734 355743553 /nfs/dbraw/zinc/74/35/53/355743553.db2.gz LQOGUJCWUNNCDN-PWSUYJOCSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1nocc1C[N@H+]1C[C@@H](C)O[C@@H](CC)C1 ZINC000350699734 355743555 /nfs/dbraw/zinc/74/35/55/355743555.db2.gz LQOGUJCWUNNCDN-PWSUYJOCSA-N 1 2 238.331 2.236 20 0 BEADLO CC(C)=CC[N@H+]1Cc2ccccc2N(C)C(=O)C1 ZINC000623247406 355773209 /nfs/dbraw/zinc/77/32/09/355773209.db2.gz BNBJXXDVPPGJIJ-UHFFFAOYSA-N 1 2 244.338 2.431 20 0 BEADLO CC(C)=CC[N@@H+]1Cc2ccccc2N(C)C(=O)C1 ZINC000623247406 355773210 /nfs/dbraw/zinc/77/32/10/355773210.db2.gz BNBJXXDVPPGJIJ-UHFFFAOYSA-N 1 2 244.338 2.431 20 0 BEADLO CCc1nnc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)o1 ZINC000336009132 134050559 /nfs/dbraw/zinc/05/05/59/134050559.db2.gz FUTMSUIROHVDII-QMMMGPOBSA-N 1 2 245.273 2.109 20 0 BEADLO CCc1nnc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)o1 ZINC000336009132 134050560 /nfs/dbraw/zinc/05/05/60/134050560.db2.gz FUTMSUIROHVDII-QMMMGPOBSA-N 1 2 245.273 2.109 20 0 BEADLO CC[C@@](C)(C[N@H+](C)Cc1nnc(C)s1)OC ZINC000639332413 355758944 /nfs/dbraw/zinc/75/89/44/355758944.db2.gz IZJABKSQHGCMDQ-NSHDSACASA-N 1 2 243.376 2.093 20 0 BEADLO CC[C@@](C)(C[N@@H+](C)Cc1nnc(C)s1)OC ZINC000639332413 355758946 /nfs/dbraw/zinc/75/89/46/355758946.db2.gz IZJABKSQHGCMDQ-NSHDSACASA-N 1 2 243.376 2.093 20 0 BEADLO Cc1c[nH]c(C[NH+]2CC(c3ccccc3)C2)n1 ZINC000639361532 355815494 /nfs/dbraw/zinc/81/54/94/355815494.db2.gz GOZIRTQNTMNZNV-UHFFFAOYSA-N 1 2 227.311 2.318 20 0 BEADLO c1cc(C[NH+]2CC(c3ccccc3)C2)no1 ZINC000639361867 355816129 /nfs/dbraw/zinc/81/61/29/355816129.db2.gz VXFOABPSLQXKGM-UHFFFAOYSA-N 1 2 214.268 2.274 20 0 BEADLO CCc1cnc(C[N@@H+]2C[C@@H](C)OC(C)(C)C2)o1 ZINC000608493466 355819699 /nfs/dbraw/zinc/81/96/99/355819699.db2.gz QMRQIDLYQXRVMT-SNVBAGLBSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1cnc(C[N@H+]2C[C@@H](C)OC(C)(C)C2)o1 ZINC000608493466 355819702 /nfs/dbraw/zinc/81/97/02/355819702.db2.gz QMRQIDLYQXRVMT-SNVBAGLBSA-N 1 2 238.331 2.236 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@@H](n3ccnc3)C2)o1 ZINC000608495573 355821645 /nfs/dbraw/zinc/82/16/45/355821645.db2.gz SODUGCPERSCXLD-GFCCVEGCSA-N 1 2 246.314 2.017 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@@H](n3ccnc3)C2)o1 ZINC000608495573 355821649 /nfs/dbraw/zinc/82/16/49/355821649.db2.gz SODUGCPERSCXLD-GFCCVEGCSA-N 1 2 246.314 2.017 20 0 BEADLO CC[C@@H](Cc1ccc(C)cc1)[NH2+]Cc1c[nH]nn1 ZINC000628363643 355847056 /nfs/dbraw/zinc/84/70/56/355847056.db2.gz RUWRQTIQFMIGCI-ZDUSSCGKSA-N 1 2 244.342 2.224 20 0 BEADLO CC[C@@H](Cc1ccc(C)cc1)[NH2+]Cc1cn[nH]n1 ZINC000628363643 355847059 /nfs/dbraw/zinc/84/70/59/355847059.db2.gz RUWRQTIQFMIGCI-ZDUSSCGKSA-N 1 2 244.342 2.224 20 0 BEADLO C[C@H]([NH2+]Cc1c[nH]nn1)C1CCCCCC1 ZINC000628363342 355847185 /nfs/dbraw/zinc/84/71/85/355847185.db2.gz GPIYJUIFPZUYHL-JTQLQIEISA-N 1 2 222.336 2.253 20 0 BEADLO C[C@H]([NH2+]Cc1cn[nH]n1)C1CCCCCC1 ZINC000628363342 355847188 /nfs/dbraw/zinc/84/71/88/355847188.db2.gz GPIYJUIFPZUYHL-JTQLQIEISA-N 1 2 222.336 2.253 20 0 BEADLO C[C@@H]([NH2+]Cc1c[nH]nn1)C1CCCCCC1 ZINC000628363343 355847724 /nfs/dbraw/zinc/84/77/24/355847724.db2.gz GPIYJUIFPZUYHL-SNVBAGLBSA-N 1 2 222.336 2.253 20 0 BEADLO C[C@@H]([NH2+]Cc1cn[nH]n1)C1CCCCCC1 ZINC000628363343 355847727 /nfs/dbraw/zinc/84/77/27/355847727.db2.gz GPIYJUIFPZUYHL-SNVBAGLBSA-N 1 2 222.336 2.253 20 0 BEADLO CC(C)CCN(C)C(=O)CCCn1cc[nH+]c1 ZINC000623254889 355856539 /nfs/dbraw/zinc/85/65/39/355856539.db2.gz NIWDBDZUWSAXER-UHFFFAOYSA-N 1 2 237.347 2.168 20 0 BEADLO COC(=O)[C@@H](c1ccccc1C)[N@H+]1CC=CCC1 ZINC000613477298 363456337 /nfs/dbraw/zinc/45/63/37/363456337.db2.gz XTFSQDGFWSXXHW-CQSZACIVSA-N 1 2 245.322 2.471 20 0 BEADLO COC(=O)[C@@H](c1ccccc1C)[N@@H+]1CC=CCC1 ZINC000613477298 363456343 /nfs/dbraw/zinc/45/63/43/363456343.db2.gz XTFSQDGFWSXXHW-CQSZACIVSA-N 1 2 245.322 2.471 20 0 BEADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]C2(C)COC2)o1 ZINC000639382451 355929355 /nfs/dbraw/zinc/92/93/55/355929355.db2.gz QELBIGGYTAKORK-ONGXEEELSA-N 1 2 221.300 2.282 20 0 BEADLO Cc1ncc([C@H](C)[NH2+]Cc2csnn2)s1 ZINC000639383024 355934832 /nfs/dbraw/zinc/93/48/32/355934832.db2.gz OPGDCPFXFZYNJA-LURJTMIESA-N 1 2 240.357 2.154 20 0 BEADLO Cc1nnc(C[N@@H+]2CC[C@@H](CC(F)(F)F)C2)o1 ZINC000351635138 356038482 /nfs/dbraw/zinc/03/84/82/356038482.db2.gz OSYBCCNIAMZUIG-QMMMGPOBSA-N 1 2 249.236 2.152 20 0 BEADLO Cc1nnc(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)o1 ZINC000351635138 356038486 /nfs/dbraw/zinc/03/84/86/356038486.db2.gz OSYBCCNIAMZUIG-QMMMGPOBSA-N 1 2 249.236 2.152 20 0 BEADLO NC(=O)COc1ccc([NH2+]C2CCCCC2)cc1 ZINC000037041272 181238975 /nfs/dbraw/zinc/23/89/75/181238975.db2.gz WWFGRUITUCLDMZ-UHFFFAOYSA-N 1 2 248.326 2.295 20 0 BEADLO Cn1cc(C[NH+]2CC(C)(C)C2)c(C(F)F)n1 ZINC000639392934 356061890 /nfs/dbraw/zinc/06/18/90/356061890.db2.gz CIOABUAPENNTFP-UHFFFAOYSA-N 1 2 229.274 2.200 20 0 BEADLO CSCCC[N@@H+](C)[C@@H](C)c1noc(C)n1 ZINC000352115516 134071813 /nfs/dbraw/zinc/07/18/13/134071813.db2.gz LVNAJCHYVUZSLC-QMMMGPOBSA-N 1 2 229.349 2.124 20 0 BEADLO CC(C)Cn1cc(C[NH2+][C@H](C)c2ccon2)cn1 ZINC000351592332 356024297 /nfs/dbraw/zinc/02/42/97/356024297.db2.gz JVYAUMAYCHGIFB-LLVKDONJSA-N 1 2 248.330 2.378 20 0 BEADLO C[C@@H]([NH2+]Cc1cnn(C(C)(C)C)c1)c1ccon1 ZINC000351591363 356024625 /nfs/dbraw/zinc/02/46/25/356024625.db2.gz DJJYVWMBFFECIB-SNVBAGLBSA-N 1 2 248.330 2.477 20 0 BEADLO C[C@H](c1ccc(F)cc1)[N@@H+]1CCc2nn[nH]c2C1 ZINC000351610806 356027335 /nfs/dbraw/zinc/02/73/35/356027335.db2.gz XZSSZQNOISGHNW-SECBINFHSA-N 1 2 246.289 2.063 20 0 BEADLO C[C@H](c1ccc(F)cc1)[N@H+]1CCc2nn[nH]c2C1 ZINC000351610806 356027339 /nfs/dbraw/zinc/02/73/39/356027339.db2.gz XZSSZQNOISGHNW-SECBINFHSA-N 1 2 246.289 2.063 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N(C)[C@@H]1CC[C@@H](C)C1 ZINC000335906368 356105859 /nfs/dbraw/zinc/10/58/59/356105859.db2.gz AKTODRGPGMFOMU-ZYHUDNBSSA-N 1 2 247.342 2.464 20 0 BEADLO CCC(C)(C)[C@H](C)NC(=O)Cc1[nH]c[nH+]c1C ZINC000617568520 356123277 /nfs/dbraw/zinc/12/32/77/356123277.db2.gz DYMYHGPXDNFECI-JTQLQIEISA-N 1 2 237.347 2.202 20 0 BEADLO CCC(C)(C)[C@H](C)NC(=O)Cc1[nH+]c[nH]c1C ZINC000617568520 356123283 /nfs/dbraw/zinc/12/32/83/356123283.db2.gz DYMYHGPXDNFECI-JTQLQIEISA-N 1 2 237.347 2.202 20 0 BEADLO Cc1cnn(CC[N@H+]2CC[C@@H](C)C(F)(F)C2)c1 ZINC000335911323 356123328 /nfs/dbraw/zinc/12/33/28/356123328.db2.gz YXEYQAXNYFXUFD-LLVKDONJSA-N 1 2 243.301 2.169 20 0 BEADLO Cc1cnn(CC[N@@H+]2CC[C@@H](C)C(F)(F)C2)c1 ZINC000335911323 356123332 /nfs/dbraw/zinc/12/33/32/356123332.db2.gz YXEYQAXNYFXUFD-LLVKDONJSA-N 1 2 243.301 2.169 20 0 BEADLO Cc1nc([C@H](C)[N@H+](C)CCC2CC2)no1 ZINC000351714410 356068152 /nfs/dbraw/zinc/06/81/52/356068152.db2.gz DFXVWVXTRWURRQ-QMMMGPOBSA-N 1 2 209.293 2.171 20 0 BEADLO Cc1nc([C@H](C)[N@@H+](C)CCC2CC2)no1 ZINC000351714410 356068156 /nfs/dbraw/zinc/06/81/56/356068156.db2.gz DFXVWVXTRWURRQ-QMMMGPOBSA-N 1 2 209.293 2.171 20 0 BEADLO COC(=O)[C@@H](CC(C)C)[N@@H+]1CC[C@@](C)(F)C1 ZINC000351738625 356076656 /nfs/dbraw/zinc/07/66/56/356076656.db2.gz XRDIRJPVPZHTHX-ZYHUDNBSSA-N 1 2 231.311 2.008 20 0 BEADLO COC(=O)[C@@H](CC(C)C)[N@H+]1CC[C@@](C)(F)C1 ZINC000351738625 356076657 /nfs/dbraw/zinc/07/66/57/356076657.db2.gz XRDIRJPVPZHTHX-ZYHUDNBSSA-N 1 2 231.311 2.008 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+](Cc2noc(C3CC3)n2)C1 ZINC000335917218 356160644 /nfs/dbraw/zinc/16/06/44/356160644.db2.gz GYSMNFGNHVSPHG-BDAKNGLRSA-N 1 2 221.304 2.177 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+](Cc2noc(C3CC3)n2)C1 ZINC000335917218 356160648 /nfs/dbraw/zinc/16/06/48/356160648.db2.gz GYSMNFGNHVSPHG-BDAKNGLRSA-N 1 2 221.304 2.177 20 0 BEADLO C[C@H](c1ccccc1)[N@@H+]1CC[S@@](=O)[C@H](C)C1 ZINC000351898279 356169990 /nfs/dbraw/zinc/16/99/90/356169990.db2.gz PEQRKMGCQCDXAU-XHBSWPGZSA-N 1 2 237.368 2.200 20 0 BEADLO C[C@H](c1ccccc1)[N@H+]1CC[S@@](=O)[C@H](C)C1 ZINC000351898279 356169996 /nfs/dbraw/zinc/16/99/96/356169996.db2.gz PEQRKMGCQCDXAU-XHBSWPGZSA-N 1 2 237.368 2.200 20 0 BEADLO CC[C@@]1(C)COCC[N@@H+]1Cc1cncs1 ZINC000336085877 134076583 /nfs/dbraw/zinc/07/65/83/134076583.db2.gz LHSZYHVDXSLKRV-NSHDSACASA-N 1 2 226.345 2.144 20 0 BEADLO CC[C@@]1(C)COCC[N@H+]1Cc1cncs1 ZINC000336085877 134076584 /nfs/dbraw/zinc/07/65/84/134076584.db2.gz LHSZYHVDXSLKRV-NSHDSACASA-N 1 2 226.345 2.144 20 0 BEADLO CC(C)c1nc(N2CC3(C2)CCCOC3)cc[nH+]1 ZINC000377162738 192019114 /nfs/dbraw/zinc/01/91/14/192019114.db2.gz UZJYMOLRRVWOCQ-UHFFFAOYSA-N 1 2 247.342 2.217 20 0 BEADLO Cc1cc(C[N@H+](C)C[C@@H]2CC(C)(C)CO2)no1 ZINC000639450709 356235708 /nfs/dbraw/zinc/23/57/08/356235708.db2.gz YBDKXSWVBBEXAB-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cc(C[N@@H+](C)C[C@@H]2CC(C)(C)CO2)no1 ZINC000639450709 356235711 /nfs/dbraw/zinc/23/57/11/356235711.db2.gz YBDKXSWVBBEXAB-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1occc1C[N@@H+](C)Cc1cnc(C)nc1 ZINC000351911559 356195882 /nfs/dbraw/zinc/19/58/82/356195882.db2.gz RUPHLYDNSWNROE-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1occc1C[N@H+](C)Cc1cnc(C)nc1 ZINC000351911559 356195884 /nfs/dbraw/zinc/19/58/84/356195884.db2.gz RUPHLYDNSWNROE-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CC[C@H](C)CCNC(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000617640782 356253213 /nfs/dbraw/zinc/25/32/13/356253213.db2.gz CGSMKDFUAYNHQF-QJPTWQEYSA-N 1 2 249.358 2.076 20 0 BEADLO CC(=O)C[N@@H+]1CCc2cc(F)ccc2[C@H]1C ZINC000639495990 356322454 /nfs/dbraw/zinc/32/24/54/356322454.db2.gz LJVHMURNMYNKLO-SNVBAGLBSA-N 1 2 221.275 2.334 20 0 BEADLO CC(=O)C[N@H+]1CCc2cc(F)ccc2[C@H]1C ZINC000639495990 356322455 /nfs/dbraw/zinc/32/24/55/356322455.db2.gz LJVHMURNMYNKLO-SNVBAGLBSA-N 1 2 221.275 2.334 20 0 BEADLO CC[C@@]1(C)COCC[N@@H+]1Cc1cncc(F)c1 ZINC000336121625 134091537 /nfs/dbraw/zinc/09/15/37/134091537.db2.gz VQLAEEPEJOCICV-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO CC[C@@]1(C)COCC[N@H+]1Cc1cncc(F)c1 ZINC000336121625 134091538 /nfs/dbraw/zinc/09/15/38/134091538.db2.gz VQLAEEPEJOCICV-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CC[C@@H]2CCC[C@H]21 ZINC000336121699 134091647 /nfs/dbraw/zinc/09/16/47/134091647.db2.gz QTOWAMUAQKDMJT-WCQYABFASA-N 1 2 245.326 2.218 20 0 BEADLO CCC(F)(F)C[NH+]1CCC([C@H](C)O)CC1 ZINC000639487075 356303005 /nfs/dbraw/zinc/30/30/05/356303005.db2.gz WIZGUIMYAZADHQ-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO CC(=O)C[N@@H+]1CCSC[C@H]1c1ccccc1 ZINC000639491140 356309331 /nfs/dbraw/zinc/30/93/31/356309331.db2.gz YVYQVKARUOFOMJ-ZDUSSCGKSA-N 1 2 235.352 2.366 20 0 BEADLO CC(=O)C[N@H+]1CCSC[C@H]1c1ccccc1 ZINC000639491140 356309333 /nfs/dbraw/zinc/30/93/33/356309333.db2.gz YVYQVKARUOFOMJ-ZDUSSCGKSA-N 1 2 235.352 2.366 20 0 BEADLO CC(=O)C[N@@H+]1CCSC[C@@H]1c1ccccc1 ZINC000639491138 356309489 /nfs/dbraw/zinc/30/94/89/356309489.db2.gz YVYQVKARUOFOMJ-CYBMUJFWSA-N 1 2 235.352 2.366 20 0 BEADLO CC(=O)C[N@H+]1CCSC[C@@H]1c1ccccc1 ZINC000639491138 356309492 /nfs/dbraw/zinc/30/94/92/356309492.db2.gz YVYQVKARUOFOMJ-CYBMUJFWSA-N 1 2 235.352 2.366 20 0 BEADLO CC(=O)C[N@@H+]1CC[C@H]1c1cccc(F)c1 ZINC000639511354 356346335 /nfs/dbraw/zinc/34/63/35/356346335.db2.gz PGXKQFSGANSWFI-LBPRGKRZSA-N 1 2 207.248 2.162 20 0 BEADLO CC(=O)C[N@H+]1CC[C@H]1c1cccc(F)c1 ZINC000639511354 356346337 /nfs/dbraw/zinc/34/63/37/356346337.db2.gz PGXKQFSGANSWFI-LBPRGKRZSA-N 1 2 207.248 2.162 20 0 BEADLO CCC(F)(F)C[N@H+](C)CCOCC1CC1 ZINC000639512678 356349812 /nfs/dbraw/zinc/34/98/12/356349812.db2.gz FQTWQEMMYSPBHP-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO CCC(F)(F)C[N@@H+](C)CCOCC1CC1 ZINC000639512678 356349813 /nfs/dbraw/zinc/34/98/13/356349813.db2.gz FQTWQEMMYSPBHP-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO CC(=O)C[N@@H+](C)[C@@H]1CCCc2nc(C)sc21 ZINC000639529109 356377727 /nfs/dbraw/zinc/37/77/27/356377727.db2.gz JBJZXZSGHHCVJV-LLVKDONJSA-N 1 2 238.356 2.350 20 0 BEADLO CC(=O)C[N@H+](C)[C@@H]1CCCc2nc(C)sc21 ZINC000639529109 356377729 /nfs/dbraw/zinc/37/77/29/356377729.db2.gz JBJZXZSGHHCVJV-LLVKDONJSA-N 1 2 238.356 2.350 20 0 BEADLO Cn1cc(C[NH2+]C2(C(F)F)CCCCC2)cn1 ZINC000352205250 134104742 /nfs/dbraw/zinc/10/47/42/134104742.db2.gz ZTDQZXZUVZPHKQ-UHFFFAOYSA-N 1 2 243.301 2.478 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCCSCC1 ZINC000639550959 356430112 /nfs/dbraw/zinc/43/01/12/356430112.db2.gz FECFOSQMEVEWTJ-UHFFFAOYSA-N 1 2 209.305 2.471 20 0 BEADLO CCC(F)(F)C[N@H+]1CCCSCC1 ZINC000639550959 356430117 /nfs/dbraw/zinc/43/01/17/356430117.db2.gz FECFOSQMEVEWTJ-UHFFFAOYSA-N 1 2 209.305 2.471 20 0 BEADLO CC[C@@H]1C[C@@H](Nc2cc[nH+]c(C(C)C)n2)CCO1 ZINC000420617054 192249441 /nfs/dbraw/zinc/24/94/41/192249441.db2.gz JFUZRTCRBSFXST-NWDGAFQWSA-N 1 2 249.358 2.391 20 0 BEADLO CC(C)c1nc(NCCOCC2CCC2)cc[nH+]1 ZINC000583667685 356489876 /nfs/dbraw/zinc/48/98/76/356489876.db2.gz LVXJTHKLPBNZGU-UHFFFAOYSA-N 1 2 249.358 2.251 20 0 BEADLO Cc1cc(NC[C@H]2Cc3ccccc32)c(C#N)c[nH+]1 ZINC000399358552 356466805 /nfs/dbraw/zinc/46/68/05/356466805.db2.gz AMLUVPOSRWBQSX-CYBMUJFWSA-N 1 2 249.317 2.435 20 0 BEADLO CC[C@@H]1CN(c2cc[nH+]c(C)n2)C[C@@H](CC)O1 ZINC000420640610 192254163 /nfs/dbraw/zinc/25/41/63/192254163.db2.gz YYBONEDDQLJEKB-VXGBXAGGSA-N 1 2 235.331 2.179 20 0 BEADLO Cc1cc(CNc2ncc(Cl)cn2)cc(C)[nH+]1 ZINC000420654310 192255243 /nfs/dbraw/zinc/25/52/43/192255243.db2.gz PWHKOCOQBRRAHM-UHFFFAOYSA-N 1 2 248.717 2.176 20 0 BEADLO C[C@@H](C[N@H+](CCO)CC(F)F)c1ccccc1 ZINC000193029124 356494365 /nfs/dbraw/zinc/49/43/65/356494365.db2.gz SECQHFWXSRSZCA-NSHDSACASA-N 1 2 243.297 2.350 20 0 BEADLO C[C@@H](C[N@@H+](CCO)CC(F)F)c1ccccc1 ZINC000193029124 356494367 /nfs/dbraw/zinc/49/43/67/356494367.db2.gz SECQHFWXSRSZCA-NSHDSACASA-N 1 2 243.297 2.350 20 0 BEADLO CCCC[N@H+](C)Cc1nn(C)cc1Cl ZINC000420897758 192268488 /nfs/dbraw/zinc/26/84/88/192268488.db2.gz DFYTZUUJHPNNHX-UHFFFAOYSA-N 1 2 215.728 2.305 20 0 BEADLO CCCC[N@@H+](C)Cc1nn(C)cc1Cl ZINC000420897758 192268491 /nfs/dbraw/zinc/26/84/91/192268491.db2.gz DFYTZUUJHPNNHX-UHFFFAOYSA-N 1 2 215.728 2.305 20 0 BEADLO CCC(F)(F)C[NH+]1[C@@H](C)CC(O)C[C@@H]1C ZINC000639601089 356520200 /nfs/dbraw/zinc/52/02/00/356520200.db2.gz NVGOZPOEKXLDKM-IUCAKERBSA-N 1 2 221.291 2.265 20 0 BEADLO CC[C@H]1C[NH+](Cc2ncc(C)cn2)C[C@H](CC)O1 ZINC000420950020 192276433 /nfs/dbraw/zinc/27/64/33/192276433.db2.gz FWLNDMWNNXFEDR-STQMWFEESA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cnc(C)cn2)C[C@H](CC)O1 ZINC000420955249 192277492 /nfs/dbraw/zinc/27/74/92/192277492.db2.gz LDXMILUVWMEPMW-OKILXGFUSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cnc(C)cn2)C[C@H](CC)O1 ZINC000420955249 192277495 /nfs/dbraw/zinc/27/74/95/192277495.db2.gz LDXMILUVWMEPMW-OKILXGFUSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[NH+]([C@H](C)c2cnccn2)C[C@@H](CC)O1 ZINC000420953264 192278603 /nfs/dbraw/zinc/27/86/03/192278603.db2.gz IYVBBIQCXFXXRV-JHJVBQTASA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@H]1C[NH+](Cc2ccnc(C)n2)C[C@H](CC)O1 ZINC000420959697 192281542 /nfs/dbraw/zinc/28/15/42/192281542.db2.gz QPLWAMJUAQYQMR-KBPBESRZSA-N 1 2 249.358 2.174 20 0 BEADLO Cc1cc(NC(=O)N2CCCC23CCC3)cc[nH+]1 ZINC000336183936 134120577 /nfs/dbraw/zinc/12/05/77/134120577.db2.gz HXRVLWFHMWWNPW-UHFFFAOYSA-N 1 2 245.326 2.362 20 0 BEADLO CC(=O)C[N@@H+]1CC[C@H](C(F)(F)F)C(C)(C)C1 ZINC000639609221 356531369 /nfs/dbraw/zinc/53/13/69/356531369.db2.gz QAZYCYVEMGAQPS-VIFPVBQESA-N 1 2 237.265 2.486 20 0 BEADLO CC(=O)C[N@H+]1CC[C@H](C(F)(F)F)C(C)(C)C1 ZINC000639609221 356531371 /nfs/dbraw/zinc/53/13/71/356531371.db2.gz QAZYCYVEMGAQPS-VIFPVBQESA-N 1 2 237.265 2.486 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCC12CCOCC2 ZINC000639626517 356540130 /nfs/dbraw/zinc/54/01/30/356540130.db2.gz IUOHKXQVLHPMCZ-UHFFFAOYSA-N 1 2 219.275 2.287 20 0 BEADLO CCC(F)(F)C[N@H+]1CCC12CCOCC2 ZINC000639626517 356540132 /nfs/dbraw/zinc/54/01/32/356540132.db2.gz IUOHKXQVLHPMCZ-UHFFFAOYSA-N 1 2 219.275 2.287 20 0 BEADLO c1cnc(C[N@@H+]2CCOC3(CCCCC3)C2)cn1 ZINC000578118143 366275436 /nfs/dbraw/zinc/27/54/36/366275436.db2.gz YPCIRKITWVCUKH-UHFFFAOYSA-N 1 2 247.342 2.012 20 0 BEADLO c1cnc(C[N@H+]2CCOC3(CCCCC3)C2)cn1 ZINC000578118143 366275439 /nfs/dbraw/zinc/27/54/39/366275439.db2.gz YPCIRKITWVCUKH-UHFFFAOYSA-N 1 2 247.342 2.012 20 0 BEADLO CC1=CCC[N@H+](Cc2nc(CC3CC3)no2)C1 ZINC000639622682 356542065 /nfs/dbraw/zinc/54/20/65/356542065.db2.gz FWYANZPKFNIIEI-UHFFFAOYSA-N 1 2 233.315 2.174 20 0 BEADLO CC1=CCC[N@@H+](Cc2nc(CC3CC3)no2)C1 ZINC000639622682 356542067 /nfs/dbraw/zinc/54/20/67/356542067.db2.gz FWYANZPKFNIIEI-UHFFFAOYSA-N 1 2 233.315 2.174 20 0 BEADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1cnns1 ZINC000336196099 134126314 /nfs/dbraw/zinc/12/63/14/134126314.db2.gz RBQINUUJGKCSEC-JTQLQIEISA-N 1 2 245.351 2.485 20 0 BEADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1cnns1 ZINC000336196099 134126315 /nfs/dbraw/zinc/12/63/15/134126315.db2.gz RBQINUUJGKCSEC-JTQLQIEISA-N 1 2 245.351 2.485 20 0 BEADLO CCc1nc(C[N@@H+]2CC[C@@]23CCOC3)cs1 ZINC000421023261 192305263 /nfs/dbraw/zinc/30/52/63/192305263.db2.gz BDZQBNYYPLELRH-LBPRGKRZSA-N 1 2 238.356 2.070 20 0 BEADLO CCc1nc(C[N@H+]2CC[C@@]23CCOC3)cs1 ZINC000421023261 192305266 /nfs/dbraw/zinc/30/52/66/192305266.db2.gz BDZQBNYYPLELRH-LBPRGKRZSA-N 1 2 238.356 2.070 20 0 BEADLO C[C@H]1C[N@H+](CC(=O)c2ccccc2F)[C@H]1C ZINC000639654699 356559851 /nfs/dbraw/zinc/55/98/51/356559851.db2.gz GDNCHPJRTRZFOZ-UWVGGRQHSA-N 1 2 221.275 2.349 20 0 BEADLO C[C@H]1C[N@@H+](CC(=O)c2ccccc2F)[C@H]1C ZINC000639654699 356559856 /nfs/dbraw/zinc/55/98/56/356559856.db2.gz GDNCHPJRTRZFOZ-UWVGGRQHSA-N 1 2 221.275 2.349 20 0 BEADLO C[C@H]1COCC[N@@H+]1Cc1cc2cccnc2o1 ZINC000336213774 134135544 /nfs/dbraw/zinc/13/55/44/134135544.db2.gz DHZTXNQMLIXOIU-JTQLQIEISA-N 1 2 232.283 2.049 20 0 BEADLO C[C@H]1COCC[N@H+]1Cc1cc2cccnc2o1 ZINC000336213774 134135545 /nfs/dbraw/zinc/13/55/45/134135545.db2.gz DHZTXNQMLIXOIU-JTQLQIEISA-N 1 2 232.283 2.049 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C[C@@H]1CC[C@H]2C[C@H]21 ZINC000449893478 202050142 /nfs/dbraw/zinc/05/01/42/202050142.db2.gz XZKOHMSHPFQNSE-RWMBFGLXSA-N 1 2 244.338 2.441 20 0 BEADLO CC(=O)C[N@@H+]1CCc2cccc(Cl)c2C1 ZINC000639670268 356584480 /nfs/dbraw/zinc/58/44/80/356584480.db2.gz FACPPYJAQMOOIK-UHFFFAOYSA-N 1 2 223.703 2.287 20 0 BEADLO CC(=O)C[N@H+]1CCc2cccc(Cl)c2C1 ZINC000639670268 356584485 /nfs/dbraw/zinc/58/44/85/356584485.db2.gz FACPPYJAQMOOIK-UHFFFAOYSA-N 1 2 223.703 2.287 20 0 BEADLO CCC(C)(CC)C(=O)N[C@@H]1CCn2c[nH+]cc2C1 ZINC000623304117 356594607 /nfs/dbraw/zinc/59/46/07/356594607.db2.gz QXRFPGJMJAZWEO-LLVKDONJSA-N 1 2 249.358 2.140 20 0 BEADLO CC1C[C@H]2CC[C@@H](C1)N2c1cc(CO)cc[nH+]1 ZINC000630092329 363515222 /nfs/dbraw/zinc/51/52/22/363515222.db2.gz DRNZODURHPKRDD-VGPLMAKISA-N 1 2 232.327 2.341 20 0 BEADLO CC[C@H](NC(=O)[C@H]1CCC1(C)C)c1[nH]cc[nH+]1 ZINC000613579216 363521000 /nfs/dbraw/zinc/52/10/00/363521000.db2.gz JCFARSKFPOPGQC-ZJUUUORDSA-N 1 2 235.331 2.413 20 0 BEADLO CC[NH+](CC)Cc1nnc(C2CC2)s1 ZINC000450247461 202107204 /nfs/dbraw/zinc/10/72/04/202107204.db2.gz YBOOZHRNGSCWQZ-UHFFFAOYSA-N 1 2 211.334 2.257 20 0 BEADLO OCc1cc[nH+]c(NCC[C@@H]2CC2(F)F)c1 ZINC000630095374 363548516 /nfs/dbraw/zinc/54/85/16/363548516.db2.gz ZZYQEVZAMICAKP-SECBINFHSA-N 1 2 228.242 2.031 20 0 BEADLO C[NH+](C)Cc1nc(CC2CCCCC2)no1 ZINC000350636834 366312263 /nfs/dbraw/zinc/31/22/63/366312263.db2.gz PUXDFSSISGBFNM-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO C[N@H+](CCC1CCCCC1)Cc1cnn[nH]1 ZINC000450337177 202131505 /nfs/dbraw/zinc/13/15/05/202131505.db2.gz CZSKYQAEOYAUOL-UHFFFAOYSA-N 1 2 222.336 2.207 20 0 BEADLO C[N@@H+](CCC1CCCCC1)Cc1cnn[nH]1 ZINC000450337177 202131508 /nfs/dbraw/zinc/13/15/08/202131508.db2.gz CZSKYQAEOYAUOL-UHFFFAOYSA-N 1 2 222.336 2.207 20 0 BEADLO C[N@H+](CCC1CCCCC1)Cc1c[nH]nn1 ZINC000450337177 202131513 /nfs/dbraw/zinc/13/15/13/202131513.db2.gz CZSKYQAEOYAUOL-UHFFFAOYSA-N 1 2 222.336 2.207 20 0 BEADLO C[N@@H+](CCC1CCCCC1)Cc1c[nH]nn1 ZINC000450337177 202131516 /nfs/dbraw/zinc/13/15/16/202131516.db2.gz CZSKYQAEOYAUOL-UHFFFAOYSA-N 1 2 222.336 2.207 20 0 BEADLO C[N@H+](CCC1CCCCC1)Cc1cn[nH]n1 ZINC000450337177 202131519 /nfs/dbraw/zinc/13/15/19/202131519.db2.gz CZSKYQAEOYAUOL-UHFFFAOYSA-N 1 2 222.336 2.207 20 0 BEADLO C[N@@H+](CCC1CCCCC1)Cc1cn[nH]n1 ZINC000450337177 202131522 /nfs/dbraw/zinc/13/15/22/202131522.db2.gz CZSKYQAEOYAUOL-UHFFFAOYSA-N 1 2 222.336 2.207 20 0 BEADLO Cc1c(NC(=O)Nc2cc[nH+]c(C)c2)cnn1C ZINC000179795484 366309605 /nfs/dbraw/zinc/30/96/05/366309605.db2.gz SPZZTJHAXCZPEB-UHFFFAOYSA-N 1 2 245.286 2.076 20 0 BEADLO CC[C@H](Nc1cnn(C)c1C)c1[nH+]ccn1C ZINC000179869085 366326272 /nfs/dbraw/zinc/32/62/72/366326272.db2.gz KQAIIUSMYNJHDK-JTQLQIEISA-N 1 2 233.319 2.025 20 0 BEADLO CC[C@@H](Nc1cnn(C)c1C)c1[nH+]ccn1C ZINC000179869098 366326476 /nfs/dbraw/zinc/32/64/76/366326476.db2.gz KQAIIUSMYNJHDK-SNVBAGLBSA-N 1 2 233.319 2.025 20 0 BEADLO CNc1nc(N2CCC[C@@H]2C)[nH+]c2ccccc21 ZINC000450359714 202143405 /nfs/dbraw/zinc/14/34/05/202143405.db2.gz HVPWOCJGSSAIOL-JTQLQIEISA-N 1 2 242.326 2.082 20 0 BEADLO C[C@@H](N[C@@H](C)C(C)(F)F)c1[nH+]ccn1C ZINC000389458875 356678848 /nfs/dbraw/zinc/67/88/48/356678848.db2.gz DBIQZQRVFCZGFG-SFYZADRCSA-N 1 2 217.263 2.114 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cn[nH]c1)C(C)(F)F ZINC000389464916 356679375 /nfs/dbraw/zinc/67/93/75/356679375.db2.gz JPAYFRSDKUJWAT-NKWVEPMBSA-N 1 2 203.236 2.104 20 0 BEADLO C[C@@H]([NH2+][C@@H]1C[C@@H](C)N(C2CC2)C1)C(C)(F)F ZINC000389480480 356688962 /nfs/dbraw/zinc/68/89/62/356688962.db2.gz FIZTZDAVBNZPMT-OPRDCNLKSA-N 1 2 232.318 2.245 20 0 BEADLO CCCn1cc(C[NH2+][C@@H](C)C(C)(F)F)cn1 ZINC000389486049 356691998 /nfs/dbraw/zinc/69/19/98/356691998.db2.gz MHYBPBMDTREEQJ-VIFPVBQESA-N 1 2 231.290 2.426 20 0 BEADLO Cn1c[nH+]cc1CC(=O)N[C@@H]1CCCCC1(C)C ZINC000582259992 356695110 /nfs/dbraw/zinc/69/51/10/356695110.db2.gz UAOKZXVUQNVPBI-GFCCVEGCSA-N 1 2 249.358 2.048 20 0 BEADLO Cc1ccc(O)c(C[NH2+][C@H](C)C(C)(F)F)n1 ZINC000389471199 356683659 /nfs/dbraw/zinc/68/36/59/356683659.db2.gz QXFTYNCNOLHFPS-MRVPVSSYSA-N 1 2 230.258 2.229 20 0 BEADLO C[C@@H]([NH2+]Cc1cnn2ccccc12)C(C)(F)F ZINC000389469796 356684368 /nfs/dbraw/zinc/68/43/68/356684368.db2.gz NETJWJIFXRCOLO-SECBINFHSA-N 1 2 239.269 2.468 20 0 BEADLO Cc1ccc(O)c(C[NH2+][C@@H](C)C(C)(F)F)n1 ZINC000389471205 356684402 /nfs/dbraw/zinc/68/44/02/356684402.db2.gz QXFTYNCNOLHFPS-QMMMGPOBSA-N 1 2 230.258 2.229 20 0 BEADLO CC[NH+](CC)Cc1nc([C@H]2CCCS2)no1 ZINC000346992715 538561793 /nfs/dbraw/zinc/56/17/93/538561793.db2.gz QESFRZBFJVHASK-SECBINFHSA-N 1 2 241.360 2.480 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccc(N)c2)no1 ZINC000036198450 356706792 /nfs/dbraw/zinc/70/67/92/356706792.db2.gz LAFJEHNXNIZSOT-UHFFFAOYSA-N 1 2 231.299 2.197 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccc(N)c2)no1 ZINC000036198450 356706795 /nfs/dbraw/zinc/70/67/95/356706795.db2.gz LAFJEHNXNIZSOT-UHFFFAOYSA-N 1 2 231.299 2.197 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@@H]2c2cn[nH]c2)co1 ZINC000639778544 356723395 /nfs/dbraw/zinc/72/33/95/356723395.db2.gz RIZHOFSQEJQSNB-GFCCVEGCSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@@H]2c2cn[nH]c2)co1 ZINC000639778544 356723401 /nfs/dbraw/zinc/72/34/01/356723401.db2.gz RIZHOFSQEJQSNB-GFCCVEGCSA-N 1 2 232.287 2.043 20 0 BEADLO CCc1nc(C[N@@H+]2CCCC[C@H]2C)no1 ZINC000054316318 363565941 /nfs/dbraw/zinc/56/59/41/363565941.db2.gz UZGKSCCNQJJZDX-SECBINFHSA-N 1 2 209.293 2.006 20 0 BEADLO CCc1nc(C[N@H+]2CCCC[C@H]2C)no1 ZINC000054316318 363565949 /nfs/dbraw/zinc/56/59/49/363565949.db2.gz UZGKSCCNQJJZDX-SECBINFHSA-N 1 2 209.293 2.006 20 0 BEADLO c1coc(-c2cc(COCc3[nH]cc[nH+]3)no2)c1 ZINC000180023666 366356154 /nfs/dbraw/zinc/35/61/54/366356154.db2.gz PTJZGIRNOGBLDM-UHFFFAOYSA-N 1 2 245.238 2.375 20 0 BEADLO COc1cncc(C[N@H+](C)Cc2ccns2)c1 ZINC000639807629 356777024 /nfs/dbraw/zinc/77/70/24/356777024.db2.gz JRXVFLPXXCUHDB-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1cncc(C[N@@H+](C)Cc2ccns2)c1 ZINC000639807629 356777027 /nfs/dbraw/zinc/77/70/27/356777027.db2.gz JRXVFLPXXCUHDB-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO C[C@H](c1cnccn1)[N@H+](C)Cc1ccns1 ZINC000639807701 356777574 /nfs/dbraw/zinc/77/75/74/356777574.db2.gz KPMAWBGJKYZIQN-SECBINFHSA-N 1 2 234.328 2.126 20 0 BEADLO C[C@H](c1cnccn1)[N@@H+](C)Cc1ccns1 ZINC000639807701 356777577 /nfs/dbraw/zinc/77/75/77/356777577.db2.gz KPMAWBGJKYZIQN-SECBINFHSA-N 1 2 234.328 2.126 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2ccns2)nc1 ZINC000639807774 356778478 /nfs/dbraw/zinc/77/84/78/356778478.db2.gz LKORXFYQKQOSDZ-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2ccns2)nc1 ZINC000639807774 356778483 /nfs/dbraw/zinc/77/84/83/356778483.db2.gz LKORXFYQKQOSDZ-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO CCC(F)(F)C[N@H+](C)CC1=CCCOC1 ZINC000639814709 356795025 /nfs/dbraw/zinc/79/50/25/356795025.db2.gz QQVIITCTYBSWNR-UHFFFAOYSA-N 1 2 219.275 2.310 20 0 BEADLO CCC(F)(F)C[N@@H+](C)CC1=CCCOC1 ZINC000639814709 356795029 /nfs/dbraw/zinc/79/50/29/356795029.db2.gz QQVIITCTYBSWNR-UHFFFAOYSA-N 1 2 219.275 2.310 20 0 BEADLO CC[C@@H](O)CCCNc1cc[nH+]c2ccncc12 ZINC000357505208 356835592 /nfs/dbraw/zinc/83/55/92/356835592.db2.gz AFHDNNHYXGZCSF-LLVKDONJSA-N 1 2 245.326 2.015 20 0 BEADLO C[N@H+](CCC1=CCCCC1)Cc1nnc[nH]1 ZINC000450479230 202179797 /nfs/dbraw/zinc/17/97/97/202179797.db2.gz MKPUOTIUDBIBCP-UHFFFAOYSA-N 1 2 220.320 2.127 20 0 BEADLO C[N@@H+](CCC1=CCCCC1)Cc1nnc[nH]1 ZINC000450479230 202179798 /nfs/dbraw/zinc/17/97/98/202179798.db2.gz MKPUOTIUDBIBCP-UHFFFAOYSA-N 1 2 220.320 2.127 20 0 BEADLO CO[C@@H]1C[N@H+](Cc2cc(C)sc2C)CCO1 ZINC000639832221 356817484 /nfs/dbraw/zinc/81/74/84/356817484.db2.gz DKDFSWFJGDNFBL-LBPRGKRZSA-N 1 2 241.356 2.170 20 0 BEADLO CO[C@@H]1C[N@@H+](Cc2cc(C)sc2C)CCO1 ZINC000639832221 356817486 /nfs/dbraw/zinc/81/74/86/356817486.db2.gz DKDFSWFJGDNFBL-LBPRGKRZSA-N 1 2 241.356 2.170 20 0 BEADLO CO[C@H]1C[N@H+](C/C=C\c2ccccc2)CCO1 ZINC000639836562 356822391 /nfs/dbraw/zinc/82/23/91/356822391.db2.gz UTGYAKGTYJMRIV-BMWLXYDHSA-N 1 2 233.311 2.005 20 0 BEADLO CO[C@H]1C[N@@H+](C/C=C\c2ccccc2)CCO1 ZINC000639836562 356822397 /nfs/dbraw/zinc/82/23/97/356822397.db2.gz UTGYAKGTYJMRIV-BMWLXYDHSA-N 1 2 233.311 2.005 20 0 BEADLO CO[C@H]1C[N@H+](Cc2ccc(C)c(C)c2)CCO1 ZINC000639836126 356827365 /nfs/dbraw/zinc/82/73/65/356827365.db2.gz GURKHXZRTBZEQX-CQSZACIVSA-N 1 2 235.327 2.108 20 0 BEADLO CO[C@H]1C[N@@H+](Cc2ccc(C)c(C)c2)CCO1 ZINC000639836126 356827367 /nfs/dbraw/zinc/82/73/67/356827367.db2.gz GURKHXZRTBZEQX-CQSZACIVSA-N 1 2 235.327 2.108 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@@H](OC)C2)cc1 ZINC000639838278 356828531 /nfs/dbraw/zinc/82/85/31/356828531.db2.gz NEORWCBISMFUDR-CQSZACIVSA-N 1 2 235.327 2.054 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@@H](OC)C2)cc1 ZINC000639838278 356828533 /nfs/dbraw/zinc/82/85/33/356828533.db2.gz NEORWCBISMFUDR-CQSZACIVSA-N 1 2 235.327 2.054 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1CC(C(C)(C)C)C1 ZINC000655140926 538728964 /nfs/dbraw/zinc/72/89/64/538728964.db2.gz AJQIPPNQQXYVIX-JTQLQIEISA-N 1 2 249.358 2.093 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1CC(C(C)(C)C)C1 ZINC000655140926 538728969 /nfs/dbraw/zinc/72/89/69/538728969.db2.gz AJQIPPNQQXYVIX-JTQLQIEISA-N 1 2 249.358 2.093 20 0 BEADLO c1cnc([C@H]2CCC[N@H+]2Cc2cccnc2)nc1 ZINC000639842141 356836253 /nfs/dbraw/zinc/83/62/53/356836253.db2.gz AKIYMKBUEXEFTG-CYBMUJFWSA-N 1 2 240.310 2.209 20 0 BEADLO c1cnc([C@H]2CCC[N@@H+]2Cc2cccnc2)nc1 ZINC000639842141 356836257 /nfs/dbraw/zinc/83/62/57/356836257.db2.gz AKIYMKBUEXEFTG-CYBMUJFWSA-N 1 2 240.310 2.209 20 0 BEADLO CCC(CC)NC(=O)[C@@H]1CCn2cc(C)[nH+]c2C1 ZINC000623383169 356907059 /nfs/dbraw/zinc/90/70/59/356907059.db2.gz HHZKMYGCPRTNGP-LLVKDONJSA-N 1 2 249.358 2.059 20 0 BEADLO COc1ccc(N[C@H]2CCCSC2)[nH+]c1 ZINC000228808003 491105035 /nfs/dbraw/zinc/10/50/35/491105035.db2.gz ISCMQZUVYNIADC-VIFPVBQESA-N 1 2 224.329 2.398 20 0 BEADLO CC(C)CC[C@H](O)C[N@@H+]1CCC(F)(F)C1 ZINC000361321127 356927753 /nfs/dbraw/zinc/92/77/53/356927753.db2.gz MGHXHHAZUOKNHW-JTQLQIEISA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)CC[C@H](O)C[N@H+]1CCC(F)(F)C1 ZINC000361321127 356927755 /nfs/dbraw/zinc/92/77/55/356927755.db2.gz MGHXHHAZUOKNHW-JTQLQIEISA-N 1 2 221.291 2.125 20 0 BEADLO Cc1cc[nH+]c(NCC[C@@H](C)CCO)c1Cl ZINC000450559120 202196201 /nfs/dbraw/zinc/19/62/01/202196201.db2.gz GBZCRJWCSMJREL-SECBINFHSA-N 1 2 242.750 2.286 20 0 BEADLO C[C@@H]([NH2+]Cc1nnc2ccccn21)c1ccco1 ZINC000020185471 357000257 /nfs/dbraw/zinc/00/02/57/357000257.db2.gz KTJXJNRJIGGWPV-SNVBAGLBSA-N 1 2 242.282 2.173 20 0 BEADLO COC[C@]1(C)CCN(c2nc(C)[nH+]c(C)c2C)C1 ZINC000450605587 202209431 /nfs/dbraw/zinc/20/94/31/202209431.db2.gz QANZVBBUHAHRCL-CQSZACIVSA-N 1 2 249.358 2.265 20 0 BEADLO COc1cnccc1[C@@H](C)[NH2+][C@H](C)c1ncc[nH]1 ZINC000353668992 538755405 /nfs/dbraw/zinc/75/54/05/538755405.db2.gz HGWTXKQVASXEQV-NXEZZACHSA-N 1 2 246.314 2.225 20 0 BEADLO COc1cnccc1[C@H](C)[NH2+][C@@H](C)c1ncc[nH]1 ZINC000353668993 538755624 /nfs/dbraw/zinc/75/56/24/538755624.db2.gz HGWTXKQVASXEQV-UWVGGRQHSA-N 1 2 246.314 2.225 20 0 BEADLO CC[C@@H]1CCC[N@H+](Cc2csnn2)C1 ZINC000119316394 357017331 /nfs/dbraw/zinc/01/73/31/357017331.db2.gz KXBPRXRNFRTKHY-SECBINFHSA-N 1 2 211.334 2.160 20 0 BEADLO CC[C@@H]1CCC[N@@H+](Cc2csnn2)C1 ZINC000119316394 357017333 /nfs/dbraw/zinc/01/73/33/357017333.db2.gz KXBPRXRNFRTKHY-SECBINFHSA-N 1 2 211.334 2.160 20 0 BEADLO C[C@@H](CC1CCCC1)C(=O)NCc1c[nH+]cn1C ZINC000355250666 538793941 /nfs/dbraw/zinc/79/39/41/538793941.db2.gz CBZPBJQNWRVLOG-NSHDSACASA-N 1 2 249.358 2.253 20 0 BEADLO c1[nH]cc(NCc2csc(C3CC3)n2)[nH+]1 ZINC000390004152 357083682 /nfs/dbraw/zinc/08/36/82/357083682.db2.gz VPEULKBUNNVGMQ-UHFFFAOYSA-N 1 2 220.301 2.356 20 0 BEADLO OC[C@H](Nc1cccc[nH+]1)C1CCCCC1 ZINC000390797293 357116422 /nfs/dbraw/zinc/11/64/22/357116422.db2.gz TXVDZNINWWDLGU-LBPRGKRZSA-N 1 2 220.316 2.435 20 0 BEADLO C[C@H](CCN(C)CC(F)F)[N@H+](C)CC(F)F ZINC000156788730 538797146 /nfs/dbraw/zinc/79/71/46/538797146.db2.gz FTIKQHSJOZGVSP-MRVPVSSYSA-N 1 2 244.276 2.159 20 0 BEADLO C[C@H](CCN(C)CC(F)F)[N@@H+](C)CC(F)F ZINC000156788730 538797152 /nfs/dbraw/zinc/79/71/52/538797152.db2.gz FTIKQHSJOZGVSP-MRVPVSSYSA-N 1 2 244.276 2.159 20 0 BEADLO CCc1nc(C[N@H+]2[C@H](C)CC[C@@H]2C)no1 ZINC000123032346 357205139 /nfs/dbraw/zinc/20/51/39/357205139.db2.gz PCGIIDJRFJJWNL-DTORHVGOSA-N 1 2 209.293 2.005 20 0 BEADLO CCc1nc(C[N@@H+]2[C@H](C)CC[C@@H]2C)no1 ZINC000123032346 357205145 /nfs/dbraw/zinc/20/51/45/357205145.db2.gz PCGIIDJRFJJWNL-DTORHVGOSA-N 1 2 209.293 2.005 20 0 BEADLO CC(C)[C@@H]1CCCN(C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000356769256 538814434 /nfs/dbraw/zinc/81/44/34/538814434.db2.gz HSFCPOAVYALNEO-GFCCVEGCSA-N 1 2 249.358 2.237 20 0 BEADLO CC(C)[C@@H]1CCCN(C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000356769256 538814444 /nfs/dbraw/zinc/81/44/44/538814444.db2.gz HSFCPOAVYALNEO-GFCCVEGCSA-N 1 2 249.358 2.237 20 0 BEADLO CC(C)(F)CN[C@@H](c1[nH]cc[nH+]1)c1cccnc1 ZINC000631663863 357231477 /nfs/dbraw/zinc/23/14/77/357231477.db2.gz QCHBQLPZMOSEED-LLVKDONJSA-N 1 2 248.305 2.232 20 0 BEADLO CC(C)(F)C[NH2+][C@@H](c1ncc[nH]1)c1cccnc1 ZINC000631663863 357231479 /nfs/dbraw/zinc/23/14/79/357231479.db2.gz QCHBQLPZMOSEED-LLVKDONJSA-N 1 2 248.305 2.232 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1C[C@@H](C)C(F)(F)[C@@H](C)C1 ZINC000628390075 357186461 /nfs/dbraw/zinc/18/64/61/357186461.db2.gz CIEQPERPOTYODV-DTORHVGOSA-N 1 2 243.301 2.441 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1C[C@@H](C)C(F)(F)[C@@H](C)C1 ZINC000628390075 357186465 /nfs/dbraw/zinc/18/64/65/357186465.db2.gz CIEQPERPOTYODV-DTORHVGOSA-N 1 2 243.301 2.441 20 0 BEADLO CCOC(=O)C[N@@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000610212712 357281673 /nfs/dbraw/zinc/28/16/73/357281673.db2.gz XYQVCEJBFPQOLY-CYBMUJFWSA-N 1 2 249.310 2.092 20 0 BEADLO CCOC(=O)C[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000610212712 357281678 /nfs/dbraw/zinc/28/16/78/357281678.db2.gz XYQVCEJBFPQOLY-CYBMUJFWSA-N 1 2 249.310 2.092 20 0 BEADLO COc1ccc[nH+]c1NCC(C)(C)C[C@H](C)O ZINC000393566106 357287321 /nfs/dbraw/zinc/28/73/21/357287321.db2.gz SCFNZXXMGNGNEE-JTQLQIEISA-N 1 2 238.331 2.299 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCCc2c1cnn2C)C(F)F ZINC000228499329 491109878 /nfs/dbraw/zinc/10/98/78/491109878.db2.gz DBEDSVXAYHNLJK-APPZFPTMSA-N 1 2 229.274 2.041 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2cc[nH]n2)oc1C ZINC000393736837 357294443 /nfs/dbraw/zinc/29/44/43/357294443.db2.gz CGBGBWWBESORPJ-SECBINFHSA-N 1 2 219.288 2.470 20 0 BEADLO C[C@H]([NH2+][C@H]1CCCc2c1cnn2C)C(F)F ZINC000228499334 491109900 /nfs/dbraw/zinc/10/99/00/491109900.db2.gz DBEDSVXAYHNLJK-CBAPKCEASA-N 1 2 229.274 2.041 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@H]1CCCC12CC2 ZINC000639899966 357310176 /nfs/dbraw/zinc/31/01/76/357310176.db2.gz NEABXFYBTOOINH-GFCCVEGCSA-N 1 2 245.326 2.266 20 0 BEADLO Cn1ncc2c1CCC[C@H]2[NH2+]CC(C)(F)F ZINC000393461634 357310406 /nfs/dbraw/zinc/31/04/06/357310406.db2.gz GIYHEQXYXDGXBT-SECBINFHSA-N 1 2 229.274 2.042 20 0 BEADLO COCc1cccc(C[NH+]2CC3(C2)CCCO3)c1 ZINC000628427317 357257066 /nfs/dbraw/zinc/25/70/66/357257066.db2.gz UKKRGKRELACMDN-UHFFFAOYSA-N 1 2 247.338 2.198 20 0 BEADLO COC(=O)[C@@](C)([NH2+]CCSC(C)C)C1CC1 ZINC000381460895 357260307 /nfs/dbraw/zinc/26/03/07/357260307.db2.gz LAPBAUYDMJNIJV-LBPRGKRZSA-N 1 2 245.388 2.059 20 0 BEADLO CO[C@@H]1COC[C@H]1Nc1ccc2ccccc2[nH+]1 ZINC000582722744 357372800 /nfs/dbraw/zinc/37/28/00/357372800.db2.gz NHNDXCDWSBUYRK-CHWSQXEVSA-N 1 2 244.294 2.061 20 0 BEADLO COC(=O)[C@@H]([NH2+]C[C@@H]1CCCC1(F)F)C(C)C ZINC000394661570 357368239 /nfs/dbraw/zinc/36/82/39/357368239.db2.gz OQIYEVGTHOLRQI-UWVGGRQHSA-N 1 2 249.301 2.209 20 0 BEADLO CC[C@H]1CCC[C@@H]1C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000583005203 357455637 /nfs/dbraw/zinc/45/56/37/357455637.db2.gz OWCFGPDOKODNTK-AAEUAGOBSA-N 1 2 247.342 2.093 20 0 BEADLO C[C@@H](CC(=O)NC[C@H]1CC=CCC1)n1cc[nH+]c1 ZINC000583028205 357463141 /nfs/dbraw/zinc/46/31/41/357463141.db2.gz KIWBJESBMUZRBX-STQMWFEESA-N 1 2 247.342 2.307 20 0 BEADLO C[C@H](CC(=O)NC[C@H]1CC=CCC1)n1cc[nH+]c1 ZINC000583028203 357463599 /nfs/dbraw/zinc/46/35/99/357463599.db2.gz KIWBJESBMUZRBX-OLZOCXBDSA-N 1 2 247.342 2.307 20 0 BEADLO C[C@H]1CCC[C@@H]1CNc1[nH+]cnc2c1cnn2C ZINC000230695533 357567034 /nfs/dbraw/zinc/56/70/34/357567034.db2.gz YVJWIVFYIPFDFD-VHSXEESVSA-N 1 2 245.330 2.211 20 0 BEADLO c1cn(CCNc2nccc3occc32)c[nH+]1 ZINC000230815617 357574770 /nfs/dbraw/zinc/57/47/70/357574770.db2.gz HYEJAKZFJJVRTM-UHFFFAOYSA-N 1 2 228.255 2.136 20 0 BEADLO CC1(C)CCCN1CC[NH2+]Cc1ccccn1 ZINC000063074114 357519926 /nfs/dbraw/zinc/51/99/26/357519926.db2.gz CJZVLDPDNQZHKE-UHFFFAOYSA-N 1 2 233.359 2.046 20 0 BEADLO CC(C)[C@H]1CCN(C(=O)C[C@H](C)n2cc[nH+]c2)C1 ZINC000583207410 357520371 /nfs/dbraw/zinc/52/03/71/357520371.db2.gz QIIFCRGNKXWOIS-STQMWFEESA-N 1 2 249.358 2.339 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CCC([C@H]2CCCO2)CC1 ZINC000188243915 357537078 /nfs/dbraw/zinc/53/70/78/357537078.db2.gz JVZPKWJAGYUUBF-CQSZACIVSA-N 1 2 249.358 2.109 20 0 BEADLO CC1(C)C[N@H+](Cc2ncc[nH]2)CC2(CCCC2)O1 ZINC000190978151 357735419 /nfs/dbraw/zinc/73/54/19/357735419.db2.gz PTIGFPPRTAKGSU-UHFFFAOYSA-N 1 2 249.358 2.333 20 0 BEADLO CC1(C)C[N@@H+](Cc2ncc[nH]2)CC2(CCCC2)O1 ZINC000190978151 357735424 /nfs/dbraw/zinc/73/54/24/357735424.db2.gz PTIGFPPRTAKGSU-UHFFFAOYSA-N 1 2 249.358 2.333 20 0 BEADLO CCC(=O)CCC[NH+]1CCN([C@H](C)CC)CC1 ZINC000233837320 357756145 /nfs/dbraw/zinc/75/61/45/357756145.db2.gz PMYFXBUGIXKKBO-CYBMUJFWSA-N 1 2 240.391 2.162 20 0 BEADLO CC(C)COC1CC[NH+](Cc2ncccn2)CC1 ZINC000191955236 357806422 /nfs/dbraw/zinc/80/64/22/357806422.db2.gz YYLYJCLWKSOSBW-UHFFFAOYSA-N 1 2 249.358 2.114 20 0 BEADLO C[C@H](c1cccnc1)[N@H+](C)Cc1ncccn1 ZINC000192135445 357823833 /nfs/dbraw/zinc/82/38/33/357823833.db2.gz SESHLYCHKVGZOJ-LLVKDONJSA-N 1 2 228.299 2.065 20 0 BEADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1ncccn1 ZINC000192135445 357823837 /nfs/dbraw/zinc/82/38/37/357823837.db2.gz SESHLYCHKVGZOJ-LLVKDONJSA-N 1 2 228.299 2.065 20 0 BEADLO c1[nH]cc(NCc2cc(-c3ccccc3)n[nH]2)[nH+]1 ZINC000583294626 357860811 /nfs/dbraw/zinc/86/08/11/357860811.db2.gz RAJYPNFRJXWACX-UHFFFAOYSA-N 1 2 239.282 2.412 20 0 BEADLO CC(=O)C[N@@H+]1CC(C)(C)[C@@H]1c1ccco1 ZINC000639929060 357880276 /nfs/dbraw/zinc/88/02/76/357880276.db2.gz KMJKWMBEDAFBHT-NSHDSACASA-N 1 2 207.273 2.252 20 0 BEADLO CC(=O)C[N@H+]1CC(C)(C)[C@@H]1c1ccco1 ZINC000639929060 357880281 /nfs/dbraw/zinc/88/02/81/357880281.db2.gz KMJKWMBEDAFBHT-NSHDSACASA-N 1 2 207.273 2.252 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N1CCC2(CCCC2)C1 ZINC000193388727 357881179 /nfs/dbraw/zinc/88/11/79/357881179.db2.gz BDVSQNYMDQYDOJ-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N1CCC2(CCCC2)C1 ZINC000193388727 357881182 /nfs/dbraw/zinc/88/11/82/357881182.db2.gz BDVSQNYMDQYDOJ-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CC12CCCC2)c1[nH]cc[nH+]1 ZINC000583762800 357938629 /nfs/dbraw/zinc/93/86/29/357938629.db2.gz GVFGGKXAHJTZGX-ZJUUUORDSA-N 1 2 233.315 2.167 20 0 BEADLO Cc1cc2ccccc2[nH+]c1N[C@H]1C[C@@](C)(O)C1 ZINC000583802500 357953002 /nfs/dbraw/zinc/95/30/02/357953002.db2.gz XJDQAZHEJCHAIE-JNSHFYNHSA-N 1 2 242.322 2.290 20 0 BEADLO CC[C@H]1CCC[C@H]1CNC(=O)CCc1c[nH+]c[nH]1 ZINC000584451714 357970723 /nfs/dbraw/zinc/97/07/23/357970723.db2.gz GGDGGIWJCCFXHC-RYUDHWBXSA-N 1 2 249.358 2.285 20 0 BEADLO CC[C@H]1CCC[C@H]1CNC(=O)CCc1c[nH]c[nH+]1 ZINC000584451714 357970727 /nfs/dbraw/zinc/97/07/27/357970727.db2.gz GGDGGIWJCCFXHC-RYUDHWBXSA-N 1 2 249.358 2.285 20 0 BEADLO CC[C@H]1CCC[C@@H]1CNC(=O)CCc1c[nH+]c[nH]1 ZINC000584451713 357971001 /nfs/dbraw/zinc/97/10/01/357971001.db2.gz GGDGGIWJCCFXHC-NWDGAFQWSA-N 1 2 249.358 2.285 20 0 BEADLO CC[C@H]1CCC[C@@H]1CNC(=O)CCc1c[nH]c[nH+]1 ZINC000584451713 357971007 /nfs/dbraw/zinc/97/10/07/357971007.db2.gz GGDGGIWJCCFXHC-NWDGAFQWSA-N 1 2 249.358 2.285 20 0 BEADLO CCc1nc(C)c(C[N@H+](C)Cc2c[nH]nc2C)o1 ZINC000639970721 358023887 /nfs/dbraw/zinc/02/38/87/358023887.db2.gz JJNOUFSYCCZQTM-UHFFFAOYSA-N 1 2 248.330 2.209 20 0 BEADLO CCc1nc(C)c(C[N@@H+](C)Cc2c[nH]nc2C)o1 ZINC000639970721 358023888 /nfs/dbraw/zinc/02/38/88/358023888.db2.gz JJNOUFSYCCZQTM-UHFFFAOYSA-N 1 2 248.330 2.209 20 0 BEADLO Cc1n[nH]cc1C[N@@H+](C)[C@@H](C)c1cnc(C)cn1 ZINC000639971002 358023916 /nfs/dbraw/zinc/02/39/16/358023916.db2.gz MKNJORNUGQFMRQ-NSHDSACASA-N 1 2 245.330 2.010 20 0 BEADLO Cc1n[nH]cc1C[N@H+](C)[C@@H](C)c1cnc(C)cn1 ZINC000639971002 358023918 /nfs/dbraw/zinc/02/39/18/358023918.db2.gz MKNJORNUGQFMRQ-NSHDSACASA-N 1 2 245.330 2.010 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)CCCOC(C)(C)C ZINC000639970872 358024171 /nfs/dbraw/zinc/02/41/71/358024171.db2.gz VIGIDUYEVRUODK-UHFFFAOYSA-N 1 2 239.363 2.355 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)CCCOC(C)(C)C ZINC000639970872 358024175 /nfs/dbraw/zinc/02/41/75/358024175.db2.gz VIGIDUYEVRUODK-UHFFFAOYSA-N 1 2 239.363 2.355 20 0 BEADLO CC[C@@H]1CCN1C(=O)Nc1cc(C)[nH+]cc1C ZINC000584512660 358024936 /nfs/dbraw/zinc/02/49/36/358024936.db2.gz RGKLKKAIMTUEBP-LLVKDONJSA-N 1 2 233.315 2.137 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)CC1=CCCC1 ZINC000639972629 358031399 /nfs/dbraw/zinc/03/13/99/358031399.db2.gz XJOJDVDUSQUCHQ-UHFFFAOYSA-N 1 2 205.305 2.260 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)CC1=CCCC1 ZINC000639972629 358031403 /nfs/dbraw/zinc/03/14/03/358031403.db2.gz XJOJDVDUSQUCHQ-UHFFFAOYSA-N 1 2 205.305 2.260 20 0 BEADLO Cn1cc[nH+]c1CNc1ccc(F)c(F)c1 ZINC000036804581 358052670 /nfs/dbraw/zinc/05/26/70/358052670.db2.gz ABHACAPNNYWCHZ-UHFFFAOYSA-N 1 2 223.226 2.310 20 0 BEADLO CC1(F)CC[NH+](Cc2nc(C3CC3)no2)CC1 ZINC000640069711 358155462 /nfs/dbraw/zinc/15/54/62/358155462.db2.gz JBPCQVOVHWLABD-UHFFFAOYSA-N 1 2 239.294 2.271 20 0 BEADLO C[C@@H](CC(=O)N1C[C@H](C)CC[C@H]1C)n1cc[nH+]c1 ZINC000584723244 358165493 /nfs/dbraw/zinc/16/54/93/358165493.db2.gz HIHCBNRPNRJKEH-UPJWGTAASA-N 1 2 249.358 2.481 20 0 BEADLO Cc1cc(N[C@@H]2CCOC2(C)C)nc(C2CC2)[nH+]1 ZINC000450636678 202219299 /nfs/dbraw/zinc/21/92/99/202219299.db2.gz FEACUDYPYGYZFU-LLVKDONJSA-N 1 2 247.342 2.064 20 0 BEADLO C[C@H](CC(=O)N1CC[C@@H](C)[C@@H]1C)n1cc[nH+]c1 ZINC000584842645 358199717 /nfs/dbraw/zinc/19/97/17/358199717.db2.gz BKFHGWOMZFEMQP-UTUOFQBUSA-N 1 2 235.331 2.091 20 0 BEADLO Cc1nc(N2C[C@H]3[C@@H]4C=C[C@@H](C4)[C@]3(C)C2)cc[nH+]1 ZINC000450684694 202234239 /nfs/dbraw/zinc/23/42/39/202234239.db2.gz AHLQDAMSFXAXQQ-OSFYFWSMSA-N 1 2 241.338 2.433 20 0 BEADLO O[C@@H]1CCC[C@@H]1[C@H]1CCCN1c1cccc[nH+]1 ZINC000450706322 202238685 /nfs/dbraw/zinc/23/86/85/202238685.db2.gz OPKAWDNQBBSHKO-JHJVBQTASA-N 1 2 232.327 2.211 20 0 BEADLO COC(=O)c1ccc(-c2ccc[nH+]c2N)cc1C ZINC000584597736 358255372 /nfs/dbraw/zinc/25/53/72/358255372.db2.gz GTIBRZZBCIKIHA-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO C[C@@H]([C@H](C)[NH2+]Cc1c[nH]nn1)C1CCCCC1 ZINC000450728010 202249865 /nfs/dbraw/zinc/24/98/65/202249865.db2.gz NUCQAPXNRVNDLU-QWRGUYRKSA-N 1 2 236.363 2.499 20 0 BEADLO C[C@@H]([C@H](C)[NH2+]Cc1cn[nH]n1)C1CCCCC1 ZINC000450728010 202249869 /nfs/dbraw/zinc/24/98/69/202249869.db2.gz NUCQAPXNRVNDLU-QWRGUYRKSA-N 1 2 236.363 2.499 20 0 BEADLO COc1ccnc(C[NH2+][C@H](C)c2cccs2)n1 ZINC000450726293 202246563 /nfs/dbraw/zinc/24/65/63/202246563.db2.gz UMZOGFJOHOZNFM-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO CCO[C@H]1CCN(c2cc(C)[nH+]cn2)C[C@H]1C ZINC000450744262 202252991 /nfs/dbraw/zinc/25/29/91/202252991.db2.gz LROKVGXZCQJKNS-PWSUYJOCSA-N 1 2 235.331 2.036 20 0 BEADLO O[C@H](CNc1cccc[nH+]1)c1ccsc1 ZINC000218920541 134269031 /nfs/dbraw/zinc/26/90/31/134269031.db2.gz LAQOMFQAPHRBML-SNVBAGLBSA-N 1 2 220.297 2.289 20 0 BEADLO C[C@@H]([NH2+]Cc1ccncc1)c1cscn1 ZINC000229111432 358345298 /nfs/dbraw/zinc/34/52/98/358345298.db2.gz SETJCDNURDNGNL-SECBINFHSA-N 1 2 219.313 2.389 20 0 BEADLO CCC[C@H](OC)c1noc(C[N@H+](C)C(C)C)n1 ZINC000351132687 366416516 /nfs/dbraw/zinc/41/65/16/366416516.db2.gz KTGAWJQYICDRRD-JTQLQIEISA-N 1 2 241.335 2.397 20 0 BEADLO CCC[C@H](OC)c1noc(C[N@@H+](C)C(C)C)n1 ZINC000351132687 366416521 /nfs/dbraw/zinc/41/65/21/366416521.db2.gz KTGAWJQYICDRRD-JTQLQIEISA-N 1 2 241.335 2.397 20 0 BEADLO CC[C@H](SC)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000610961029 358399577 /nfs/dbraw/zinc/39/95/77/358399577.db2.gz DOZGWBZIWYGFLM-JTQLQIEISA-N 1 2 249.339 2.414 20 0 BEADLO CCCc1noc(C[N@H+](CC)C2CC2)n1 ZINC000046058679 358568840 /nfs/dbraw/zinc/56/88/40/358568840.db2.gz OUYLMGXOFGTPQH-UHFFFAOYSA-N 1 2 209.293 2.006 20 0 BEADLO CCCc1noc(C[N@@H+](CC)C2CC2)n1 ZINC000046058679 358568844 /nfs/dbraw/zinc/56/88/44/358568844.db2.gz OUYLMGXOFGTPQH-UHFFFAOYSA-N 1 2 209.293 2.006 20 0 BEADLO CSCc1nc(CCc2[nH+]cccc2C)no1 ZINC000351128512 358575574 /nfs/dbraw/zinc/57/55/74/358575574.db2.gz IVZFENPBJOCRGX-UHFFFAOYSA-N 1 2 249.339 2.421 20 0 BEADLO Cc1nc([C@@H](C)[NH2+]CCF)c(C)s1 ZINC000308177674 491135119 /nfs/dbraw/zinc/13/51/19/491135119.db2.gz GAICQDJGYQFMIH-ZCFIWIBFSA-N 1 2 202.298 2.380 20 0 BEADLO Fc1ccc(C[NH2+]Cc2csnn2)cc1F ZINC000049577449 358695176 /nfs/dbraw/zinc/69/51/76/358695176.db2.gz DNCYSQQPHLPGDS-UHFFFAOYSA-N 1 2 241.266 2.106 20 0 BEADLO Fc1cc2[nH+]cn(C[C@@H]3CCOC3)c2cc1F ZINC000131875251 358698462 /nfs/dbraw/zinc/69/84/62/358698462.db2.gz GMPKVAHMNPWLJK-QMMMGPOBSA-N 1 2 238.237 2.351 20 0 BEADLO COCCOc1cccc(NCc2[nH]cc[nH+]2)c1 ZINC000049715545 358699436 /nfs/dbraw/zinc/69/94/36/358699436.db2.gz OPFLYGBJPTVPKJ-UHFFFAOYSA-N 1 2 247.298 2.047 20 0 BEADLO CCCC[C@H](CC)C(=O)NCCc1[nH]cc[nH+]1 ZINC000135073556 358818928 /nfs/dbraw/zinc/81/89/28/358818928.db2.gz JVCCZYUZCANZGB-NSHDSACASA-N 1 2 237.347 2.285 20 0 BEADLO C[C@H]1CCC[N@H+](Cc2noc(C3CC3)n2)C1 ZINC000053602275 358835899 /nfs/dbraw/zinc/83/58/99/358835899.db2.gz IMBZUDAVEVMLFA-VIFPVBQESA-N 1 2 221.304 2.179 20 0 BEADLO C[C@H]1CCC[N@@H+](Cc2noc(C3CC3)n2)C1 ZINC000053602275 358835901 /nfs/dbraw/zinc/83/59/01/358835901.db2.gz IMBZUDAVEVMLFA-VIFPVBQESA-N 1 2 221.304 2.179 20 0 BEADLO C[C@@H]1CCCC[N@@H+]1Cc1noc(C2CC2)n1 ZINC000053602531 358836079 /nfs/dbraw/zinc/83/60/79/358836079.db2.gz GSMYJFFLFJEDHB-SECBINFHSA-N 1 2 221.304 2.321 20 0 BEADLO C[C@@H]1CCCC[N@H+]1Cc1noc(C2CC2)n1 ZINC000053602531 358836083 /nfs/dbraw/zinc/83/60/83/358836083.db2.gz GSMYJFFLFJEDHB-SECBINFHSA-N 1 2 221.304 2.321 20 0 BEADLO CC[C@]1(C)C[C@@H]1C(=O)Nc1cc[nH+]cc1O ZINC000136791112 358885639 /nfs/dbraw/zinc/88/56/39/358885639.db2.gz KJLNRUJCHPGYQT-PRHODGIISA-N 1 2 220.272 2.162 20 0 BEADLO CC[C@@H](NC(=O)c1ccc(C)o1)c1[nH]cc[nH+]1 ZINC000140533653 358922403 /nfs/dbraw/zinc/92/24/03/358922403.db2.gz BXMOVCJNARDBTM-SECBINFHSA-N 1 2 233.271 2.192 20 0 BEADLO CC[C@H](NC(=O)Cc1ccccc1)c1[nH]cc[nH+]1 ZINC000140724653 358926094 /nfs/dbraw/zinc/92/60/94/358926094.db2.gz BTOLTKYPRRUZHY-LBPRGKRZSA-N 1 2 243.310 2.220 20 0 BEADLO CC(C)c1nc(C[N@@H+]2CC[C@H](C)[C@H]2C)no1 ZINC000177908993 134301551 /nfs/dbraw/zinc/30/15/51/134301551.db2.gz YBZCKQUNLGUXEN-VHSXEESVSA-N 1 2 223.320 2.423 20 0 BEADLO CC(C)c1nc(C[N@H+]2CC[C@H](C)[C@H]2C)no1 ZINC000177908993 134301552 /nfs/dbraw/zinc/30/15/52/134301552.db2.gz YBZCKQUNLGUXEN-VHSXEESVSA-N 1 2 223.320 2.423 20 0 BEADLO COC(C)(C)CC[N@@H+]1OC2CCC1CC2 ZINC000640230168 358943216 /nfs/dbraw/zinc/94/32/16/358943216.db2.gz LNMGQTJSWWPPHA-UHFFFAOYSA-N 1 2 213.321 2.360 20 0 BEADLO COC(C)(C)CC[N@H+]1OC2CCC1CC2 ZINC000640230168 358943219 /nfs/dbraw/zinc/94/32/19/358943219.db2.gz LNMGQTJSWWPPHA-UHFFFAOYSA-N 1 2 213.321 2.360 20 0 BEADLO C/C=C\CNC(=O)Nc1c(C)cc[nH+]c1C ZINC000626559766 358953776 /nfs/dbraw/zinc/95/37/76/358953776.db2.gz PJQLXBMEDOYWHK-PLNGDYQASA-N 1 2 219.288 2.396 20 0 BEADLO C/C=C/CNC(=O)Nc1c(C)cc[nH+]c1C ZINC000626559767 358953870 /nfs/dbraw/zinc/95/38/70/358953870.db2.gz PJQLXBMEDOYWHK-SNAWJCMRSA-N 1 2 219.288 2.396 20 0 BEADLO Cc1c[nH+]ccc1CCN1OC2CCC1CC2 ZINC000640232871 358957562 /nfs/dbraw/zinc/95/75/62/358957562.db2.gz YSMKVASAUZJDLF-UHFFFAOYSA-N 1 2 232.327 2.491 20 0 BEADLO COC(=O)C[N@@H+]1CCC[C@H]1c1ccccc1OC ZINC000069610824 359030273 /nfs/dbraw/zinc/03/02/73/359030273.db2.gz ARZSCVGUFIVTMM-LBPRGKRZSA-N 1 2 249.310 2.005 20 0 BEADLO COC(=O)C[N@H+]1CCC[C@H]1c1ccccc1OC ZINC000069610824 359030280 /nfs/dbraw/zinc/03/02/80/359030280.db2.gz ARZSCVGUFIVTMM-LBPRGKRZSA-N 1 2 249.310 2.005 20 0 BEADLO CC[N@@H+](Cc1noc(C(C)C)n1)CC1CC1 ZINC000070013544 359039092 /nfs/dbraw/zinc/03/90/92/359039092.db2.gz ULXUBDOUOAZRRU-UHFFFAOYSA-N 1 2 223.320 2.425 20 0 BEADLO CC[N@H+](Cc1noc(C(C)C)n1)CC1CC1 ZINC000070013544 359039094 /nfs/dbraw/zinc/03/90/94/359039094.db2.gz ULXUBDOUOAZRRU-UHFFFAOYSA-N 1 2 223.320 2.425 20 0 BEADLO Cc1ccc(C)c(C(=O)N(C)Cc2[nH]cc[nH+]2)c1 ZINC000070978978 359067596 /nfs/dbraw/zinc/06/75/96/359067596.db2.gz HSVJSDJZOLALFA-UHFFFAOYSA-N 1 2 243.310 2.299 20 0 BEADLO Cc1ccc(C(=O)N(C)Cc2[nH]cc[nH+]2)cc1C ZINC000070978985 359067625 /nfs/dbraw/zinc/06/76/25/359067625.db2.gz UNEUXBSYUPDHBK-UHFFFAOYSA-N 1 2 243.310 2.299 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)CCc1cccs1 ZINC000070979311 359069067 /nfs/dbraw/zinc/06/90/67/359069067.db2.gz JKMGPVOHMMALQB-UHFFFAOYSA-N 1 2 249.339 2.062 20 0 BEADLO COc1ncccc1C(=O)Nc1cc[nH+]c(C)c1 ZINC000074043933 359111016 /nfs/dbraw/zinc/11/10/16/359111016.db2.gz GEYRZWXQBLDGCK-UHFFFAOYSA-N 1 2 243.266 2.046 20 0 BEADLO CCc1nc(C[N@@H+]2C[C@H](C)CC[C@H]2C)no1 ZINC000247552334 359232702 /nfs/dbraw/zinc/23/27/02/359232702.db2.gz QBPDSPHQNVMNDO-NXEZZACHSA-N 1 2 223.320 2.252 20 0 BEADLO CCc1nc(C[N@H+]2C[C@H](C)CC[C@H]2C)no1 ZINC000247552334 359232704 /nfs/dbraw/zinc/23/27/04/359232704.db2.gz QBPDSPHQNVMNDO-NXEZZACHSA-N 1 2 223.320 2.252 20 0 BEADLO Cc1noc(CSc2[nH+]cc3ccccn32)n1 ZINC000248003396 359251875 /nfs/dbraw/zinc/25/18/75/359251875.db2.gz GHEIIBUSHQOCSW-UHFFFAOYSA-N 1 2 246.295 2.318 20 0 BEADLO COC(=O)C[N@@H+]1CC[C@H](C)C[C@@H]1c1ccco1 ZINC000247183122 359199675 /nfs/dbraw/zinc/19/96/75/359199675.db2.gz BLTBRMOBDYAQMW-WDEREUQCSA-N 1 2 237.299 2.226 20 0 BEADLO COC(=O)C[N@H+]1CC[C@H](C)C[C@@H]1c1ccco1 ZINC000247183122 359199677 /nfs/dbraw/zinc/19/96/77/359199677.db2.gz BLTBRMOBDYAQMW-WDEREUQCSA-N 1 2 237.299 2.226 20 0 BEADLO FC1(F)CCC[C@@H]1[NH2+]Cc1cccnc1 ZINC000308872090 491139463 /nfs/dbraw/zinc/13/94/63/491139463.db2.gz KSOOXEFXQULZNG-JTQLQIEISA-N 1 2 212.243 2.359 20 0 BEADLO c1csc(CC2C[NH+](Cc3cocn3)C2)c1 ZINC000628478903 359313593 /nfs/dbraw/zinc/31/35/93/359313593.db2.gz TUXBNEZXNVDAHP-UHFFFAOYSA-N 1 2 234.324 2.411 20 0 BEADLO C[C@H](CCO)SCc1c[nH+]c2ccccn12 ZINC000611468626 359375540 /nfs/dbraw/zinc/37/55/40/359375540.db2.gz HSKBPNHTKHWDGT-SNVBAGLBSA-N 1 2 236.340 2.338 20 0 BEADLO CC(C)[C@H]1C[C@@H](Nc2c[nH]c[nH+]2)CS1 ZINC000306220856 359346541 /nfs/dbraw/zinc/34/65/41/359346541.db2.gz OXZMOBBVRBMCCR-RKDXNWHRSA-N 1 2 211.334 2.352 20 0 BEADLO CCCC[C@H](C(=O)OC)[N@@H+]1CC[C@H](C)[C@H](F)C1 ZINC000611501615 359383425 /nfs/dbraw/zinc/38/34/25/359383425.db2.gz FUDQYADZTHFAME-QJPTWQEYSA-N 1 2 245.338 2.398 20 0 BEADLO CCCC[C@H](C(=O)OC)[N@H+]1CC[C@H](C)[C@H](F)C1 ZINC000611501615 359383430 /nfs/dbraw/zinc/38/34/30/359383430.db2.gz FUDQYADZTHFAME-QJPTWQEYSA-N 1 2 245.338 2.398 20 0 BEADLO COC(=O)[C@@H]([NH2+]CC1=CCCCC1)C1CC1 ZINC000379582406 359553650 /nfs/dbraw/zinc/55/36/50/359553650.db2.gz OOOJWYLTMBJILD-LBPRGKRZSA-N 1 2 223.316 2.028 20 0 BEADLO COC(=O)c1occc1C[NH2+]C1(CF)CCC1 ZINC000580447063 359562687 /nfs/dbraw/zinc/56/26/87/359562687.db2.gz OZFKTXQNEDUINJ-UHFFFAOYSA-N 1 2 241.262 2.048 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CCS[C@H]1C ZINC000308963703 491141353 /nfs/dbraw/zinc/14/13/53/491141353.db2.gz TXEMZEYFERNBSS-DTWKUNHWSA-N 1 2 224.329 2.396 20 0 BEADLO C[C@@H]([NH2+]CC1(C)CC1)C(=O)OC(C)(C)C ZINC000224399567 359598838 /nfs/dbraw/zinc/59/88/38/359598838.db2.gz CYVSJBYQHMWANK-SECBINFHSA-N 1 2 213.321 2.106 20 0 BEADLO CC[C@H](N[C@H](C)c1[nH]cc[nH+]1)C(F)(F)F ZINC000309033067 491142934 /nfs/dbraw/zinc/14/29/34/491142934.db2.gz GGTAJXVKWRLHNU-RQJHMYQMSA-N 1 2 221.226 2.401 20 0 BEADLO CC(C)c1nc(N[C@H]2CC23CCOCC3)cc[nH+]1 ZINC000450788953 202266002 /nfs/dbraw/zinc/26/60/02/202266002.db2.gz FDPSSQNVSXVTJB-NSHDSACASA-N 1 2 247.342 2.003 20 0 BEADLO CC(C)CCCC(=O)N[C@H]1CCn2cc[nH+]c2C1 ZINC000450801364 202269977 /nfs/dbraw/zinc/26/99/77/202269977.db2.gz RXGHXDNPNXJZKU-LBPRGKRZSA-N 1 2 249.358 2.140 20 0 BEADLO CO[C@@H]([C@@H](C)Nc1cc[nH+]c(C2CC2)n1)C1CC1 ZINC000450855730 202290702 /nfs/dbraw/zinc/29/07/02/202290702.db2.gz GRHCISYBUZYMMM-RNCFNFMXSA-N 1 2 247.342 2.001 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)Nc1ncc(F)cn1 ZINC000450825236 202278159 /nfs/dbraw/zinc/27/81/59/202278159.db2.gz DXIXUOSTSXROCE-QMMMGPOBSA-N 1 2 235.266 2.005 20 0 BEADLO C[C@H]1C[C@@H](Nc2ncncc2Cl)c2[nH+]ccn21 ZINC000450833881 202279970 /nfs/dbraw/zinc/27/99/70/202279970.db2.gz UFNSMQORIBRMFP-IONNQARKSA-N 1 2 249.705 2.444 20 0 BEADLO CCCC(CCC)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000533116469 359735784 /nfs/dbraw/zinc/73/57/84/359735784.db2.gz IMTBPFHAIIHIEA-UHFFFAOYSA-N 1 2 249.358 2.483 20 0 BEADLO CCC[C@@H](O)C[N@@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000450842775 202285186 /nfs/dbraw/zinc/28/51/86/202285186.db2.gz CDPUHJWWTWGJEM-NXEZZACHSA-N 1 2 221.291 2.125 20 0 BEADLO CCC[C@@H](O)C[N@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000450842775 202285190 /nfs/dbraw/zinc/28/51/90/202285190.db2.gz CDPUHJWWTWGJEM-NXEZZACHSA-N 1 2 221.291 2.125 20 0 BEADLO C/C(=C\c1ccccc1)C[N@@H+](C)Cc1cnn[nH]1 ZINC000450842500 202286335 /nfs/dbraw/zinc/28/63/35/202286335.db2.gz BTRBQVALMGBWTM-XYOKQWHBSA-N 1 2 242.326 2.340 20 0 BEADLO C/C(=C\c1ccccc1)C[N@H+](C)Cc1cnn[nH]1 ZINC000450842500 202286338 /nfs/dbraw/zinc/28/63/38/202286338.db2.gz BTRBQVALMGBWTM-XYOKQWHBSA-N 1 2 242.326 2.340 20 0 BEADLO C/C(=C\c1ccccc1)C[N@@H+](C)Cc1c[nH]nn1 ZINC000450842500 202286340 /nfs/dbraw/zinc/28/63/40/202286340.db2.gz BTRBQVALMGBWTM-XYOKQWHBSA-N 1 2 242.326 2.340 20 0 BEADLO C/C(=C\c1ccccc1)C[N@H+](C)Cc1c[nH]nn1 ZINC000450842500 202286344 /nfs/dbraw/zinc/28/63/44/202286344.db2.gz BTRBQVALMGBWTM-XYOKQWHBSA-N 1 2 242.326 2.340 20 0 BEADLO CO[C@H]1CC[C@@H](C(=O)Nc2ccc(C)[nH+]c2C)C1 ZINC000612227030 359740398 /nfs/dbraw/zinc/74/03/98/359740398.db2.gz PJSQKUKOSSPQSR-NEPJUHHUSA-N 1 2 248.326 2.452 20 0 BEADLO CO[C@]1(C)CCC[N@@H+]([C@H](C)c2csnn2)C1 ZINC000450885390 202299371 /nfs/dbraw/zinc/29/93/71/202299371.db2.gz BOBWJZNNJVFIFT-MWLCHTKSSA-N 1 2 241.360 2.100 20 0 BEADLO CO[C@]1(C)CCC[N@H+]([C@H](C)c2csnn2)C1 ZINC000450885390 202299376 /nfs/dbraw/zinc/29/93/76/202299376.db2.gz BOBWJZNNJVFIFT-MWLCHTKSSA-N 1 2 241.360 2.100 20 0 BEADLO CC(C)c1nc(N2CC[C@@H](CCCO)C2)cc[nH+]1 ZINC000450950833 202318012 /nfs/dbraw/zinc/31/80/12/202318012.db2.gz DQFUSXWPWALLNH-GFCCVEGCSA-N 1 2 249.358 2.199 20 0 BEADLO OCCC[C@H]1CCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000450957377 202318722 /nfs/dbraw/zinc/31/87/22/202318722.db2.gz UIVSXGZPVPSUCR-NSHDSACASA-N 1 2 245.326 2.162 20 0 BEADLO Cc1[nH+]cccc1N[C@@H](C)[C@H]1CCCO1 ZINC000309091971 491144663 /nfs/dbraw/zinc/14/46/63/491144663.db2.gz FBIJIUMROZIPPX-CMPLNLGQSA-N 1 2 206.289 2.369 20 0 BEADLO CC(C)C[C@@H](C)[N@@H+]1CCOCC(F)(F)C1 ZINC000451045599 202335404 /nfs/dbraw/zinc/33/54/04/202335404.db2.gz YDGIQPNRYQMMFS-SNVBAGLBSA-N 1 2 221.291 2.389 20 0 BEADLO CC(C)C[C@@H](C)[N@H+]1CCOCC(F)(F)C1 ZINC000451045599 202335405 /nfs/dbraw/zinc/33/54/05/202335405.db2.gz YDGIQPNRYQMMFS-SNVBAGLBSA-N 1 2 221.291 2.389 20 0 BEADLO Cc1ccnc([C@H](C)Nc2c[nH]c[nH+]2)c1 ZINC000309104925 491145009 /nfs/dbraw/zinc/14/50/09/491145009.db2.gz HOOKPEOLHXDTLQ-VIFPVBQESA-N 1 2 202.261 2.286 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)N[C@@H](c1[nH]cc[nH+]1)C(C)C ZINC000451101258 202351159 /nfs/dbraw/zinc/35/11/59/202351159.db2.gz BOSGAVCTIYFNIE-GMTAPVOTSA-N 1 2 235.331 2.269 20 0 BEADLO COC(=O)[C@@H](CC(C)C)[N@@H+]1CCC[C@@](C)(F)C1 ZINC000451115964 202354876 /nfs/dbraw/zinc/35/48/76/202354876.db2.gz QCYJQSOEJXBFQO-DGCLKSJQSA-N 1 2 245.338 2.398 20 0 BEADLO COC(=O)[C@@H](CC(C)C)[N@H+]1CCC[C@@](C)(F)C1 ZINC000451115964 202354878 /nfs/dbraw/zinc/35/48/78/202354878.db2.gz QCYJQSOEJXBFQO-DGCLKSJQSA-N 1 2 245.338 2.398 20 0 BEADLO Cc1ccnc([C@@H](C)Nc2c[nH]c[nH+]2)c1 ZINC000309104924 491145067 /nfs/dbraw/zinc/14/50/67/491145067.db2.gz HOOKPEOLHXDTLQ-SECBINFHSA-N 1 2 202.261 2.286 20 0 BEADLO OCCC[N@H+](CC1CCOCC1)c1ccccc1 ZINC000085900968 359863207 /nfs/dbraw/zinc/86/32/07/359863207.db2.gz NPXYPQCIWITETP-UHFFFAOYSA-N 1 2 249.354 2.302 20 0 BEADLO OCCC[N@@H+](CC1CCOCC1)c1ccccc1 ZINC000085900968 359863211 /nfs/dbraw/zinc/86/32/11/359863211.db2.gz NPXYPQCIWITETP-UHFFFAOYSA-N 1 2 249.354 2.302 20 0 BEADLO CCc1nc(C)c(C[N@H+](C(C)C)C2COC2)o1 ZINC000451118558 202357202 /nfs/dbraw/zinc/35/72/02/202357202.db2.gz AXIHZAQZTXHRBQ-UHFFFAOYSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1nc(C)c(C[N@@H+](C(C)C)C2COC2)o1 ZINC000451118558 202357205 /nfs/dbraw/zinc/35/72/05/202357205.db2.gz AXIHZAQZTXHRBQ-UHFFFAOYSA-N 1 2 238.331 2.155 20 0 BEADLO CCOC(=O)[C@@H](CC)[N@@H+]1CCC[C@](C)(F)C1 ZINC000451118403 202357740 /nfs/dbraw/zinc/35/77/40/202357740.db2.gz XTBBPAYCMRLJOQ-PWSUYJOCSA-N 1 2 231.311 2.152 20 0 BEADLO CCOC(=O)[C@@H](CC)[N@H+]1CCC[C@](C)(F)C1 ZINC000451118403 202357743 /nfs/dbraw/zinc/35/77/43/202357743.db2.gz XTBBPAYCMRLJOQ-PWSUYJOCSA-N 1 2 231.311 2.152 20 0 BEADLO CCC(C)(C)CNC(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000613995358 363697102 /nfs/dbraw/zinc/69/71/02/363697102.db2.gz ZAWZLNWPVAVFCZ-JTQLQIEISA-N 1 2 249.358 2.067 20 0 BEADLO CCC(C)(C)CNC(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000613995358 363697103 /nfs/dbraw/zinc/69/71/03/363697103.db2.gz ZAWZLNWPVAVFCZ-JTQLQIEISA-N 1 2 249.358 2.067 20 0 BEADLO CC[C@H](C(=O)OC(C)(C)C)[N@@H+]1CC[C@H](F)C1 ZINC000451202570 202379492 /nfs/dbraw/zinc/37/94/92/202379492.db2.gz XJERMZVMRHVDME-VHSXEESVSA-N 1 2 231.311 2.151 20 0 BEADLO CC[C@H](C(=O)OC(C)(C)C)[N@H+]1CC[C@H](F)C1 ZINC000451202570 202379493 /nfs/dbraw/zinc/37/94/93/202379493.db2.gz XJERMZVMRHVDME-VHSXEESVSA-N 1 2 231.311 2.151 20 0 BEADLO Cc1cc(NC[C@H]2CCCS2)nc[nH+]1 ZINC000087475261 359913353 /nfs/dbraw/zinc/91/33/53/359913353.db2.gz ROOZOONJFWEKID-SECBINFHSA-N 1 2 209.318 2.093 20 0 BEADLO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1cnccn1 ZINC000578615230 366607617 /nfs/dbraw/zinc/60/76/17/366607617.db2.gz ZJHXRKCBFDXSAE-YGRLFVJLSA-N 1 2 241.294 2.088 20 0 BEADLO Cc1nsc(C)c1C[N@@H+](C)Cc1cnccn1 ZINC000578710337 366628328 /nfs/dbraw/zinc/62/83/28/366628328.db2.gz CRPBNRKPPRZNNX-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO Cc1nsc(C)c1C[N@H+](C)Cc1cnccn1 ZINC000578710337 366628331 /nfs/dbraw/zinc/62/83/31/366628331.db2.gz CRPBNRKPPRZNNX-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO CCn1ncnc1C[NH2+][C@@H](C)c1cc(C)oc1C ZINC000088591086 359969164 /nfs/dbraw/zinc/96/91/64/359969164.db2.gz AHFFISCJRPWYCF-JTQLQIEISA-N 1 2 248.330 2.359 20 0 BEADLO CC(C)([NH2+]Cc1ncccc1O)c1nccs1 ZINC000578919386 366675382 /nfs/dbraw/zinc/67/53/82/366675382.db2.gz JRNMQRJIYCWYCD-UHFFFAOYSA-N 1 2 249.339 2.269 20 0 BEADLO CC(C)(C(=O)NCc1c[nH+]c[nH]1)c1ccccc1 ZINC000088759156 359976843 /nfs/dbraw/zinc/97/68/43/359976843.db2.gz TZWDGJILEQDMJJ-UHFFFAOYSA-N 1 2 243.310 2.004 20 0 BEADLO CC(C)(C(=O)NCc1c[nH]c[nH+]1)c1ccccc1 ZINC000088759156 359976847 /nfs/dbraw/zinc/97/68/47/359976847.db2.gz TZWDGJILEQDMJJ-UHFFFAOYSA-N 1 2 243.310 2.004 20 0 BEADLO Cc1nc(N[C@@H]2CCCC2(F)F)cc[nH+]1 ZINC000309218373 491146439 /nfs/dbraw/zinc/14/64/39/491146439.db2.gz USNWDWWTGSFNMW-MRVPVSSYSA-N 1 2 213.231 2.385 20 0 BEADLO CC(C)C[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000612840661 360102277 /nfs/dbraw/zinc/10/22/77/360102277.db2.gz REDJPCQWFXXNQZ-IJLUTSLNSA-N 1 2 249.358 2.074 20 0 BEADLO CC(C)c1nc(NC(C)(C)[C@@H](C)O)cc[nH+]1 ZINC000309379947 491147723 /nfs/dbraw/zinc/14/77/23/491147723.db2.gz RVBWBIPHLQNTFF-SECBINFHSA-N 1 2 223.320 2.171 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000092541416 360178464 /nfs/dbraw/zinc/17/84/64/360178464.db2.gz CCOJYJCGXUCQEU-DTORHVGOSA-N 1 2 225.361 2.044 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000092541416 360178468 /nfs/dbraw/zinc/17/84/68/360178468.db2.gz CCOJYJCGXUCQEU-DTORHVGOSA-N 1 2 225.361 2.044 20 0 BEADLO CCC[C@@H]([NH2+]CCc1ccco1)C(=O)OCC ZINC000097988057 360385165 /nfs/dbraw/zinc/38/51/65/360385165.db2.gz SKUDSIWWSPZCED-GFCCVEGCSA-N 1 2 239.315 2.144 20 0 BEADLO Cc1cc(NC(=O)c2ccc(F)cc2O)cc[nH+]1 ZINC000123267109 360399216 /nfs/dbraw/zinc/39/92/16/360399216.db2.gz OJCMIDXSEPLPPM-UHFFFAOYSA-N 1 2 246.241 2.487 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@H]1CCCC12CC2 ZINC000633780775 360496469 /nfs/dbraw/zinc/49/64/69/360496469.db2.gz VAYPRJCSUNPBOI-ZYHUDNBSSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@H]1CCCC12CC2 ZINC000633780775 360496473 /nfs/dbraw/zinc/49/64/73/360496473.db2.gz VAYPRJCSUNPBOI-ZYHUDNBSSA-N 1 2 247.342 2.037 20 0 BEADLO Brc1cccnc1Cn1cc[nH+]c1 ZINC000231507914 360532024 /nfs/dbraw/zinc/53/20/24/360532024.db2.gz ZZWGBAUDSXHBSD-UHFFFAOYSA-N 1 2 238.088 2.089 20 0 BEADLO Cn1c[nH+]cc1CNC1(C(F)F)CCCC1 ZINC000309519624 491149899 /nfs/dbraw/zinc/14/98/99/491149899.db2.gz SWCHYNKJQQUVQL-UHFFFAOYSA-N 1 2 229.274 2.088 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)NCC[C@H]1CC=CCC1 ZINC000628889398 360730200 /nfs/dbraw/zinc/73/02/00/360730200.db2.gz NQIYOLRBFZLMNS-LBPRGKRZSA-N 1 2 247.342 2.205 20 0 BEADLO C[C@@H](O)[C@H]1CCN(c2cc3ccccc3c[nH+]2)C1 ZINC000631200443 360789187 /nfs/dbraw/zinc/78/91/87/360789187.db2.gz HERNHJIYGPAXGJ-RISCZKNCSA-N 1 2 242.322 2.442 20 0 BEADLO COC[C@@H](Nc1ccc(C)[nH+]c1)C1CC1 ZINC000154256216 360791106 /nfs/dbraw/zinc/79/11/06/360791106.db2.gz DGGBGMZFPCHKRM-GFCCVEGCSA-N 1 2 206.289 2.227 20 0 BEADLO CN(C)c1ccc(CSc2nccn2C)c[nH+]1 ZINC000629088551 360874501 /nfs/dbraw/zinc/87/45/01/360874501.db2.gz ITMVPGHLZGQRCC-UHFFFAOYSA-N 1 2 248.355 2.173 20 0 BEADLO Cc1cc(N)nc(SCc2ccncc2C)[nH+]1 ZINC000629104034 360878340 /nfs/dbraw/zinc/87/83/40/360878340.db2.gz NJFSFLAJKOPQLL-UHFFFAOYSA-N 1 2 246.339 2.193 20 0 BEADLO COC(=O)[C@H](Cc1ccccc1)[NH2+]C1CCCC1 ZINC000037970190 360878897 /nfs/dbraw/zinc/87/88/97/360878897.db2.gz JOYFPXGYOIROJG-AWEZNQCLSA-N 1 2 247.338 2.303 20 0 BEADLO Cc1ncc(C[NH2+][C@@H]2CCCC2(F)F)cn1 ZINC000309622397 491153521 /nfs/dbraw/zinc/15/35/21/491153521.db2.gz DTIONIQBFUXLJT-SNVBAGLBSA-N 1 2 227.258 2.062 20 0 BEADLO COc1cc[nH+]cc1NCc1cc(C)ns1 ZINC000309683307 491154388 /nfs/dbraw/zinc/15/43/88/491154388.db2.gz AOWSXMQKBROKQW-UHFFFAOYSA-N 1 2 235.312 2.467 20 0 BEADLO CCc1nc(C)c(C[N@@H+]2CCO[C@H](CC)C2)o1 ZINC000428255967 201004620 /nfs/dbraw/zinc/00/46/20/201004620.db2.gz ZWGZZGHQKWIJIY-LLVKDONJSA-N 1 2 238.331 2.156 20 0 BEADLO CCc1nc(C)c(C[N@H+]2CCO[C@H](CC)C2)o1 ZINC000428255967 201004623 /nfs/dbraw/zinc/00/46/23/201004623.db2.gz ZWGZZGHQKWIJIY-LLVKDONJSA-N 1 2 238.331 2.156 20 0 BEADLO CC[C@@H]([NH2+]Cc1cc(C)ncn1)c1nccs1 ZINC000428353273 201011857 /nfs/dbraw/zinc/01/18/57/201011857.db2.gz UKKVUUHBZSJZDM-LLVKDONJSA-N 1 2 248.355 2.482 20 0 BEADLO CCCc1nc(C)c(C[N@@H+]2CCOC[C@H]2C)o1 ZINC000428446554 201017160 /nfs/dbraw/zinc/01/71/60/201017160.db2.gz JXXJSTBXNMPUBJ-SNVBAGLBSA-N 1 2 238.331 2.156 20 0 BEADLO CCCc1nc(C)c(C[N@H+]2CCOC[C@H]2C)o1 ZINC000428446554 201017162 /nfs/dbraw/zinc/01/71/62/201017162.db2.gz JXXJSTBXNMPUBJ-SNVBAGLBSA-N 1 2 238.331 2.156 20 0 BEADLO Cc1ccc(C(C)(C)[NH2+]Cc2cocn2)cn1 ZINC000428871431 201047342 /nfs/dbraw/zinc/04/73/42/201047342.db2.gz ITQQSZFNUZMEAN-UHFFFAOYSA-N 1 2 231.299 2.403 20 0 BEADLO Cc1cc(N[C@@H]2Cc3cccc(O)c3C2)nc[nH+]1 ZINC000428667197 201032075 /nfs/dbraw/zinc/03/20/75/201032075.db2.gz UOVXQSXBTIPFMV-LLVKDONJSA-N 1 2 241.294 2.070 20 0 BEADLO Cc1cc(N[C@H]2Cc3cccc(O)c3C2)nc[nH+]1 ZINC000428667198 201032905 /nfs/dbraw/zinc/03/29/05/201032905.db2.gz UOVXQSXBTIPFMV-NSHDSACASA-N 1 2 241.294 2.070 20 0 BEADLO Cc1nc(N(C)[C@H]2CC[C@H](C)C2)cc[nH+]1 ZINC000428674816 201033820 /nfs/dbraw/zinc/03/38/20/201033820.db2.gz YGRYQCABCZSZGE-ONGXEEELSA-N 1 2 205.305 2.410 20 0 BEADLO CCCCn1cc(C[NH2+]Cc2cocn2)c(C)n1 ZINC000428891301 201046821 /nfs/dbraw/zinc/04/68/21/201046821.db2.gz XIKJHSZWMJJGSF-UHFFFAOYSA-N 1 2 248.330 2.269 20 0 BEADLO CCSCC[N@H+](C)Cc1nncn1C(C)C ZINC000429273435 201089954 /nfs/dbraw/zinc/08/99/54/201089954.db2.gz MEOPYSLIDPRPLT-UHFFFAOYSA-N 1 2 242.392 2.044 20 0 BEADLO CCSCC[N@@H+](C)Cc1nncn1C(C)C ZINC000429273435 201089955 /nfs/dbraw/zinc/08/99/55/201089955.db2.gz MEOPYSLIDPRPLT-UHFFFAOYSA-N 1 2 242.392 2.044 20 0 BEADLO C[C@@H]([NH2+]Cc1ccc(CO)o1)c1cscn1 ZINC000579376057 366774369 /nfs/dbraw/zinc/77/43/69/366774369.db2.gz YOFQQQQVXDDSFS-MRVPVSSYSA-N 1 2 238.312 2.079 20 0 BEADLO COC(=O)c1cc(COc2cc[nH+]cc2)oc1C ZINC000431512945 192919173 /nfs/dbraw/zinc/91/91/73/192919173.db2.gz RGGFEKUSYGQTBR-UHFFFAOYSA-N 1 2 247.250 2.349 20 0 BEADLO CCc1ccc(NC(=O)Cn2cc[nH+]c2)cc1C ZINC000579455764 366809664 /nfs/dbraw/zinc/80/96/64/366809664.db2.gz GHFYBBLYKXQZTG-UHFFFAOYSA-N 1 2 243.310 2.393 20 0 BEADLO Cc1nsc(C)c1C[N@H+]1C[C@H](C)OC[C@H]1C ZINC000579430714 366782690 /nfs/dbraw/zinc/78/26/90/366782690.db2.gz YLCCDDJLEIXQTQ-BDAKNGLRSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nsc(C)c1C[N@@H+]1C[C@H](C)OC[C@H]1C ZINC000579430714 366782697 /nfs/dbraw/zinc/78/26/97/366782697.db2.gz YLCCDDJLEIXQTQ-BDAKNGLRSA-N 1 2 240.372 2.369 20 0 BEADLO CC[C@@H]1CC[N@@H+]1Cc1ccn(C(F)F)n1 ZINC000430198450 201151723 /nfs/dbraw/zinc/15/17/23/201151723.db2.gz YMOWUZDCAVZOFO-SECBINFHSA-N 1 2 215.247 2.263 20 0 BEADLO CC[C@@H]1CC[N@H+]1Cc1ccn(C(F)F)n1 ZINC000430198450 201151725 /nfs/dbraw/zinc/15/17/25/201151725.db2.gz YMOWUZDCAVZOFO-SECBINFHSA-N 1 2 215.247 2.263 20 0 BEADLO Cc1nc2[nH]ccc2c(NC[C@H]2CC=CCC2)[nH+]1 ZINC000433796907 201194693 /nfs/dbraw/zinc/19/46/93/201194693.db2.gz RKJBVTLQPVAGDA-NSHDSACASA-N 1 2 242.326 2.456 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CCCC2(CC2)CC1 ZINC000629646025 361534608 /nfs/dbraw/zinc/53/46/08/361534608.db2.gz IEYULJJWJHPKJS-UHFFFAOYSA-N 1 2 247.342 2.053 20 0 BEADLO CCCC[N@H+](C)Cc1ncnn1C(C)C ZINC000434539559 201227620 /nfs/dbraw/zinc/22/76/20/201227620.db2.gz HFUPGLAYBSUJMI-UHFFFAOYSA-N 1 2 210.325 2.091 20 0 BEADLO CCCC[N@@H+](C)Cc1ncnn1C(C)C ZINC000434539559 201227624 /nfs/dbraw/zinc/22/76/24/201227624.db2.gz HFUPGLAYBSUJMI-UHFFFAOYSA-N 1 2 210.325 2.091 20 0 BEADLO CC[C@@H](Nc1cc[nH+]c(C)n1)[C@@H]1CCCO1 ZINC000153191569 201226257 /nfs/dbraw/zinc/22/62/57/201226257.db2.gz UYCSCNBHRFJPIQ-MNOVXSKESA-N 1 2 221.304 2.155 20 0 BEADLO COCCOc1cccc(-c2c[nH]c(C)[nH+]2)c1 ZINC000629699494 361629232 /nfs/dbraw/zinc/62/92/32/361629232.db2.gz YAQGGBKENGZPMS-UHFFFAOYSA-N 1 2 232.283 2.410 20 0 BEADLO COCCN(C)c1ccc(-c2ccoc2)c[nH+]1 ZINC000629714472 361650812 /nfs/dbraw/zinc/65/08/12/361650812.db2.gz IDJGOFGBBFPHEQ-UHFFFAOYSA-N 1 2 232.283 2.424 20 0 BEADLO CC(C)(C(=O)NCCCn1cc[nH+]c1)C1CCC1 ZINC000448563712 201285114 /nfs/dbraw/zinc/28/51/14/201285114.db2.gz DILMIHPEUGTZQS-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO CCCC[C@H]([NH2+][C@@H]1CCCSC1)C(=O)OC ZINC000154597105 201285143 /nfs/dbraw/zinc/28/51/43/201285143.db2.gz ANSLKICNYMEQBS-MNOVXSKESA-N 1 2 245.388 2.203 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1C(=O)NCCCn1cc[nH+]c1 ZINC000448566745 201302101 /nfs/dbraw/zinc/30/21/01/201302101.db2.gz RVCMFFHDSLZQHE-CHWSQXEVSA-N 1 2 249.358 2.072 20 0 BEADLO FCC[NH2+][C@@H](c1ccccc1)c1cncnc1 ZINC000436310971 201320200 /nfs/dbraw/zinc/32/02/00/201320200.db2.gz WEHUPZMDGDAUMJ-ZDUSSCGKSA-N 1 2 231.274 2.125 20 0 BEADLO Cc1c([C@@H](C)[NH2+]CCF)nnn1-c1ccccc1 ZINC000436305287 201320544 /nfs/dbraw/zinc/32/05/44/201320544.db2.gz ZUTABMAGYFKYLZ-SNVBAGLBSA-N 1 2 248.305 2.196 20 0 BEADLO CC1=C(C(=O)NC[C@H](C)Cn2cc[nH+]c2)CCC1 ZINC000437658517 201364071 /nfs/dbraw/zinc/36/40/71/201364071.db2.gz FTJFWRPXVGTXDJ-NSHDSACASA-N 1 2 247.342 2.136 20 0 BEADLO CC[C@H]1CC[C@H](C(=O)Nc2cc[nH+]cc2O)CC1 ZINC000438149851 201394493 /nfs/dbraw/zinc/39/44/93/201394493.db2.gz IJDWOGQCABPNHH-XYPYZODXSA-N 1 2 248.326 2.364 20 0 BEADLO Cc1nnsc1C[NH2+][C@@H](C)c1cscn1 ZINC000389569358 541318116 /nfs/dbraw/zinc/31/81/16/541318116.db2.gz BBRNMSVAZWMFAS-LURJTMIESA-N 1 2 240.357 2.154 20 0 BEADLO CCC[NH2+][C@@]1(C(=O)OCC)CCc2ccccc21 ZINC000037513556 364140036 /nfs/dbraw/zinc/14/00/36/364140036.db2.gz ZSXDOKFRLIWJHJ-HNNXBMFYSA-N 1 2 247.338 2.391 20 0 BEADLO Cc1ccc(CC(=O)Nc2cc[nH+]c(C)c2)cn1 ZINC000080266130 370744312 /nfs/dbraw/zinc/74/43/12/370744312.db2.gz BMUUTYKEGONLAK-UHFFFAOYSA-N 1 2 241.294 2.275 20 0 BEADLO CC[C@](C)(NC(=O)CCc1[nH]cc[nH+]1)C1CC1 ZINC000618962255 364409635 /nfs/dbraw/zinc/40/96/35/364409635.db2.gz VBQMPFRQIHUYNX-ZDUSSCGKSA-N 1 2 235.331 2.037 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)n[nH]1 ZINC000181718969 366841142 /nfs/dbraw/zinc/84/11/42/366841142.db2.gz FGMNRDGZAGCJEZ-MNOVXSKESA-N 1 2 234.347 2.132 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)n[nH]1 ZINC000181718969 366841150 /nfs/dbraw/zinc/84/11/50/366841150.db2.gz FGMNRDGZAGCJEZ-MNOVXSKESA-N 1 2 234.347 2.132 20 0 BEADLO c1cn(CCSC[C@H]2CCCCO2)c[nH+]1 ZINC000090199854 364661827 /nfs/dbraw/zinc/66/18/27/364661827.db2.gz HJWKNPRNTCIOCF-LLVKDONJSA-N 1 2 226.345 2.185 20 0 BEADLO C[C@@H](C(=O)NC(C)(C)c1[nH]cc[nH+]1)C(C)(F)F ZINC000573501150 364848684 /nfs/dbraw/zinc/84/86/84/364848684.db2.gz ZFTPHXWXSBPKPG-ZETCQYMHSA-N 1 2 245.273 2.052 20 0 BEADLO Cc1c[nH+]c(C)nc1NCc1ccccc1 ZINC000573410599 364824267 /nfs/dbraw/zinc/82/42/67/364824267.db2.gz CFSMFMZOJVMLSZ-UHFFFAOYSA-N 1 2 213.284 2.127 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1CCC[C@H]1F ZINC000573458595 364839787 /nfs/dbraw/zinc/83/97/87/364839787.db2.gz AVDFPYUQECLWDK-ZJUUUORDSA-N 1 2 209.268 2.396 20 0 BEADLO CC(C)C1CCN(C(=O)CCc2c[nH+]c[nH]2)CC1 ZINC000141424908 541388273 /nfs/dbraw/zinc/38/82/73/541388273.db2.gz PXHODHKTEDHXHO-UHFFFAOYSA-N 1 2 249.358 2.237 20 0 BEADLO CC(C)C1CCN(C(=O)CCc2c[nH]c[nH+]2)CC1 ZINC000141424908 541388278 /nfs/dbraw/zinc/38/82/78/541388278.db2.gz PXHODHKTEDHXHO-UHFFFAOYSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H](CC(=O)NCCC1(C)CC1)n1cc[nH+]c1 ZINC000573568425 364864441 /nfs/dbraw/zinc/86/44/41/364864441.db2.gz WIZDACYBAODMIU-NSHDSACASA-N 1 2 235.331 2.141 20 0 BEADLO Cc1noc([C@H](C)[N@@H+](C)CCOCC(C)C)n1 ZINC000573742256 364907781 /nfs/dbraw/zinc/90/77/81/364907781.db2.gz XTSURVFIFGBEGT-JTQLQIEISA-N 1 2 241.335 2.043 20 0 BEADLO Cc1noc([C@H](C)[N@H+](C)CCOCC(C)C)n1 ZINC000573742256 364907787 /nfs/dbraw/zinc/90/77/87/364907787.db2.gz XTSURVFIFGBEGT-JTQLQIEISA-N 1 2 241.335 2.043 20 0 BEADLO Cc1cc(C)nc(NCc2cc(C)[nH+]c(C)c2)n1 ZINC000573948542 364953328 /nfs/dbraw/zinc/95/33/28/364953328.db2.gz IUODMBQOMIGVRL-UHFFFAOYSA-N 1 2 242.326 2.139 20 0 BEADLO CC1(CC(=O)N2CC(n3cc[nH+]c3)C2)CCCC1 ZINC000574365874 365045781 /nfs/dbraw/zinc/04/57/81/365045781.db2.gz KEJLAZWDRXOIDD-UHFFFAOYSA-N 1 2 247.342 2.237 20 0 BEADLO C[N@H+](Cc1cc(C(C)(C)C)n[nH]1)Cc1ccno1 ZINC000574871960 365163934 /nfs/dbraw/zinc/16/39/34/365163934.db2.gz KQZMEYOIBHVKCG-UHFFFAOYSA-N 1 2 248.330 2.327 20 0 BEADLO C[N@@H+](Cc1cc(C(C)(C)C)n[nH]1)Cc1ccno1 ZINC000574871960 365163938 /nfs/dbraw/zinc/16/39/38/365163938.db2.gz KQZMEYOIBHVKCG-UHFFFAOYSA-N 1 2 248.330 2.327 20 0 BEADLO CC(C)[C@H]1C[N@H+](Cc2ncccn2)CCS1 ZINC000192049116 365272103 /nfs/dbraw/zinc/27/21/03/365272103.db2.gz NBINHMWAOMJBMK-LLVKDONJSA-N 1 2 237.372 2.050 20 0 BEADLO CC(C)[C@H]1C[N@@H+](Cc2ncccn2)CCS1 ZINC000192049116 365272106 /nfs/dbraw/zinc/27/21/06/365272106.db2.gz NBINHMWAOMJBMK-LLVKDONJSA-N 1 2 237.372 2.050 20 0 BEADLO c1cn(-c2ccc(CNc3ccon3)cc2)c[nH+]1 ZINC000182192385 366873889 /nfs/dbraw/zinc/87/38/89/366873889.db2.gz YZHZJWWESHNLJC-UHFFFAOYSA-N 1 2 240.266 2.472 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CCSC[C@@H]2C)o1 ZINC000172591989 365344264 /nfs/dbraw/zinc/34/42/64/365344264.db2.gz PZPOGAGIZMCKFV-VIFPVBQESA-N 1 2 241.360 2.130 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CCSC[C@@H]2C)o1 ZINC000172591989 365344273 /nfs/dbraw/zinc/34/42/73/365344273.db2.gz PZPOGAGIZMCKFV-VIFPVBQESA-N 1 2 241.360 2.130 20 0 BEADLO Fc1ccc([C@@H]([NH2+]CC2CC2)c2cn[nH]n2)cc1 ZINC000575877533 365401610 /nfs/dbraw/zinc/40/16/10/365401610.db2.gz XRPJVPYOZIHOPB-CYBMUJFWSA-N 1 2 246.289 2.033 20 0 BEADLO Fc1ccc([C@@H]([NH2+]CC2CC2)c2c[nH]nn2)cc1 ZINC000575877533 365401618 /nfs/dbraw/zinc/40/16/18/365401618.db2.gz XRPJVPYOZIHOPB-CYBMUJFWSA-N 1 2 246.289 2.033 20 0 BEADLO CC[C@@H]([NH2+][C@@H](C)[C@H](C)OC)C(=O)OC(C)(C)C ZINC000575969095 365427822 /nfs/dbraw/zinc/42/78/22/365427822.db2.gz WQPHOYBWVAQVDH-GARJFASQSA-N 1 2 245.363 2.120 20 0 BEADLO CCc1[nH+]c(C)ccc1OCc1cnnn1CC ZINC000576015404 365449746 /nfs/dbraw/zinc/44/97/46/365449746.db2.gz LNSVQRCFVSCQEK-UHFFFAOYSA-N 1 2 246.314 2.143 20 0 BEADLO c1n[nH]c([C@H]([NH2+]CC2CC2)C2CCCCC2)n1 ZINC000576174781 365512008 /nfs/dbraw/zinc/51/20/08/365512008.db2.gz NRYVHXCLQKMXDY-GFCCVEGCSA-N 1 2 234.347 2.426 20 0 BEADLO Cc1nnsc1C[N@H+](C)CCC(F)(F)F ZINC000579597758 366899701 /nfs/dbraw/zinc/89/97/01/366899701.db2.gz CPGUAOVVISTTJK-UHFFFAOYSA-N 1 2 239.266 2.231 20 0 BEADLO Cc1nnsc1C[N@@H+](C)CCC(F)(F)F ZINC000579597758 366899705 /nfs/dbraw/zinc/89/97/05/366899705.db2.gz CPGUAOVVISTTJK-UHFFFAOYSA-N 1 2 239.266 2.231 20 0 BEADLO CCC[C@H](CC)NC(=O)[C@@H]1CCc2c[nH+]cn2C1 ZINC000576111313 365490943 /nfs/dbraw/zinc/49/09/43/365490943.db2.gz UEGIWCOQFKCGFC-NEPJUHHUSA-N 1 2 249.358 2.140 20 0 BEADLO CC1=CCN(C(=O)C[C@@H](C)n2cc[nH+]c2)CC1 ZINC000576113235 365490981 /nfs/dbraw/zinc/49/09/81/365490981.db2.gz BVUJVLFHAIYTIA-GFCCVEGCSA-N 1 2 233.315 2.013 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000576164284 365506366 /nfs/dbraw/zinc/50/63/66/365506366.db2.gz SIVDXJUWDRQRRI-QJPTWQEYSA-N 1 2 237.347 2.385 20 0 BEADLO CC[C@H](NC(=O)C[NH+]1CC(C)(C)C1)C(C)(C)C ZINC000579610757 366907878 /nfs/dbraw/zinc/90/78/78/366907878.db2.gz JOYXDKRGOUBFFX-NSHDSACASA-N 1 2 240.391 2.269 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1ccc(F)cn1 ZINC000182632674 366924699 /nfs/dbraw/zinc/92/46/99/366924699.db2.gz ZEJCEFXPGGTQGJ-UHFFFAOYSA-N 1 2 231.230 2.176 20 0 BEADLO C[C@@H](Nc1ccc(N2CCOCC2)c[nH+]1)C1CC1 ZINC000182870515 366953378 /nfs/dbraw/zinc/95/33/78/366953378.db2.gz GHBFNBBMDQCOKQ-LLVKDONJSA-N 1 2 247.342 2.129 20 0 BEADLO CC[C@@H]1CCC[C@@H](C[N@H+](C)Cc2nnc[nH]2)C1 ZINC000183085110 366975699 /nfs/dbraw/zinc/97/56/99/366975699.db2.gz XRRYRWZWILODSO-VXGBXAGGSA-N 1 2 236.363 2.453 20 0 BEADLO CC[C@@H]1CCC[C@@H](C[N@@H+](C)Cc2nnc[nH]2)C1 ZINC000183085110 366975705 /nfs/dbraw/zinc/97/57/05/366975705.db2.gz XRRYRWZWILODSO-VXGBXAGGSA-N 1 2 236.363 2.453 20 0 BEADLO Cc1cc(NC(=O)NC[C@H]2CC23CC3)c(C)c[nH+]1 ZINC000579690751 366981674 /nfs/dbraw/zinc/98/16/74/366981674.db2.gz KXYVLPHDZKMCHE-LLVKDONJSA-N 1 2 245.326 2.042 20 0 BEADLO CC(C)C[C@@H](C)C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000579961373 367105118 /nfs/dbraw/zinc/10/51/18/367105118.db2.gz FYTUNBOKVARERR-SNVBAGLBSA-N 1 2 237.347 2.443 20 0 BEADLO FC1(F)[C@H]2CC[N@H+](Cc3cscn3)C[C@H]21 ZINC001642341656 1172345348 /nfs/dbraw/zinc/34/53/48/1172345348.db2.gz QAHYEDUXRPOVIU-DTWKUNHWSA-N 1 2 230.283 2.230 20 0 BEADLO FC1(F)[C@H]2CC[N@@H+](Cc3cscn3)C[C@H]21 ZINC001642341656 1172345355 /nfs/dbraw/zinc/34/53/55/1172345355.db2.gz QAHYEDUXRPOVIU-DTWKUNHWSA-N 1 2 230.283 2.230 20 0 BEADLO CC[C@H](NC(=O)[C@@]12C[C@@H]1CCC2)c1[nH]cc[nH+]1 ZINC000580768039 367159850 /nfs/dbraw/zinc/15/98/50/367159850.db2.gz HZNCELFIGOFNQI-KWBADKCTSA-N 1 2 233.315 2.167 20 0 BEADLO COc1cccc(C[N@@H+]2CCC[C@@H](F)C2)n1 ZINC000580898076 367201314 /nfs/dbraw/zinc/20/13/14/367201314.db2.gz UYDYBPZUDVNKCB-SNVBAGLBSA-N 1 2 224.279 2.024 20 0 BEADLO COc1cccc(C[N@H+]2CCC[C@@H](F)C2)n1 ZINC000580898076 367201317 /nfs/dbraw/zinc/20/13/17/367201317.db2.gz UYDYBPZUDVNKCB-SNVBAGLBSA-N 1 2 224.279 2.024 20 0 BEADLO COc1cc(C)ccc1C[NH2+]Cc1ncccn1 ZINC000581322031 367348382 /nfs/dbraw/zinc/34/83/82/367348382.db2.gz HEMJHOZRKUVNGB-UHFFFAOYSA-N 1 2 243.310 2.083 20 0 BEADLO CC[C@@H](C(=O)OC)[N@H+](C)Cc1cccc(F)c1 ZINC000194559191 367304767 /nfs/dbraw/zinc/30/47/67/367304767.db2.gz NAISFLCLJNZEIS-LBPRGKRZSA-N 1 2 239.290 2.209 20 0 BEADLO CC[C@@H](C(=O)OC)[N@@H+](C)Cc1cccc(F)c1 ZINC000194559191 367304771 /nfs/dbraw/zinc/30/47/71/367304771.db2.gz NAISFLCLJNZEIS-LBPRGKRZSA-N 1 2 239.290 2.209 20 0 BEADLO Cn1cc2c(n1)CCC[C@H]2[NH2+]CC(C)(F)F ZINC000382112456 367487012 /nfs/dbraw/zinc/48/70/12/367487012.db2.gz KXUZKYFSANPTOG-SECBINFHSA-N 1 2 229.274 2.042 20 0 BEADLO Cn1cc(C[NH2+]CC(C)(F)F)c(C(F)F)n1 ZINC000382299259 367505311 /nfs/dbraw/zinc/50/53/11/367505311.db2.gz MZUJBAFJFYOHQP-UHFFFAOYSA-N 1 2 239.216 2.103 20 0 BEADLO COc1ccc(NCc2[nH]c(C)c(C)[nH+]2)c(C)n1 ZINC000581677783 367707876 /nfs/dbraw/zinc/70/78/76/367707876.db2.gz OBSAFMNDSVPUSX-UHFFFAOYSA-N 1 2 246.314 2.351 20 0 BEADLO CCC[C@@H](O)C[N@H+](CCC)CC(F)F ZINC000385723269 367859114 /nfs/dbraw/zinc/85/91/14/367859114.db2.gz AFAOUHXUUBHQRM-SECBINFHSA-N 1 2 209.280 2.125 20 0 BEADLO CCC[C@@H](O)C[N@@H+](CCC)CC(F)F ZINC000385723269 367859121 /nfs/dbraw/zinc/85/91/21/367859121.db2.gz AFAOUHXUUBHQRM-SECBINFHSA-N 1 2 209.280 2.125 20 0 BEADLO CCc1nc(Nc2cnn(C(C)C)c2)cc(C)[nH+]1 ZINC000385458012 367831460 /nfs/dbraw/zinc/83/14/60/367831460.db2.gz SQVUQKWEIVERMD-UHFFFAOYSA-N 1 2 245.330 2.290 20 0 BEADLO COCC1(CCNc2cccc[nH+]2)CC1 ZINC000581817475 367831489 /nfs/dbraw/zinc/83/14/89/367831489.db2.gz KRTCYTFSFNMCCF-UHFFFAOYSA-N 1 2 206.289 2.310 20 0 BEADLO C[C@H](CC(=O)N(C)[C@@H](C)C1CC1)n1cc[nH+]c1 ZINC000581827494 367835709 /nfs/dbraw/zinc/83/57/09/367835709.db2.gz TWPXBLBNKJIUPU-MNOVXSKESA-N 1 2 235.331 2.091 20 0 BEADLO c1cc2c(o1)CCC[C@H]2[NH2+]Cc1ncccn1 ZINC000581835796 367841079 /nfs/dbraw/zinc/84/10/79/367841079.db2.gz KNTWCJWBQPNZPI-LLVKDONJSA-N 1 2 229.283 2.237 20 0 BEADLO CC[C@@H](C)N(C)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000566307565 326032003 /nfs/dbraw/zinc/03/20/03/326032003.db2.gz KYOBALMWWKROGP-MNOVXSKESA-N 1 2 223.320 2.091 20 0 BEADLO CC[C@H](Nc1ccc2ccccc2[nH+]1)[C@@H](C)O ZINC000386714658 368011682 /nfs/dbraw/zinc/01/16/82/368011682.db2.gz QJZHWHLMEHZFQH-PWSUYJOCSA-N 1 2 230.311 2.228 20 0 BEADLO CC(C)CCC(=O)NCc1cn2ccccc2[nH+]1 ZINC000028697416 368241828 /nfs/dbraw/zinc/24/18/28/368241828.db2.gz QHBAGXXHLYLLQV-UHFFFAOYSA-N 1 2 245.326 2.387 20 0 BEADLO O=C(C=C1CCCCC1)NCCCn1cc[nH+]c1 ZINC000056967164 368475784 /nfs/dbraw/zinc/47/57/84/368475784.db2.gz WJEMWSQYHIXIAM-UHFFFAOYSA-N 1 2 247.342 2.280 20 0 BEADLO CN(Cc1[nH+]ccn1C)Cc1ccccc1F ZINC000057592253 368493909 /nfs/dbraw/zinc/49/39/09/368493909.db2.gz OSWFRCKDOOIKMY-UHFFFAOYSA-N 1 2 233.290 2.191 20 0 BEADLO CCCCOCC[N@H+](C)Cc1cscn1 ZINC000064516953 368609162 /nfs/dbraw/zinc/60/91/62/368609162.db2.gz APHCKOMAEAQRRZ-UHFFFAOYSA-N 1 2 228.361 2.392 20 0 BEADLO CCCCOCC[N@@H+](C)Cc1cscn1 ZINC000064516953 368609165 /nfs/dbraw/zinc/60/91/65/368609165.db2.gz APHCKOMAEAQRRZ-UHFFFAOYSA-N 1 2 228.361 2.392 20 0 BEADLO CCCc1nc(C[N@H+](C)[C@H](C)C2CC2)no1 ZINC000065588446 368624890 /nfs/dbraw/zinc/62/48/90/368624890.db2.gz VPLLAXUJYUJEBJ-SECBINFHSA-N 1 2 223.320 2.252 20 0 BEADLO CCCc1nc(C[N@@H+](C)[C@H](C)C2CC2)no1 ZINC000065588446 368624897 /nfs/dbraw/zinc/62/48/97/368624897.db2.gz VPLLAXUJYUJEBJ-SECBINFHSA-N 1 2 223.320 2.252 20 0 BEADLO CC(C)(NC(=O)[C@H]1CCC1(C)C)c1[nH]cc[nH+]1 ZINC000615952868 368762845 /nfs/dbraw/zinc/76/28/45/368762845.db2.gz IKAAGRZHPQWSIF-SECBINFHSA-N 1 2 235.331 2.197 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)CC1(O)CCCCC1 ZINC000073471996 368806645 /nfs/dbraw/zinc/80/66/45/368806645.db2.gz XZUUVTNMSGEDIU-UHFFFAOYSA-N 1 2 248.326 2.414 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)C1CC2(CC2)C1 ZINC000615960200 368790812 /nfs/dbraw/zinc/79/08/12/368790812.db2.gz KDSVSWJDHDMKRK-JTQLQIEISA-N 1 2 247.342 2.270 20 0 BEADLO COc1cccc(NCc2[nH+]ccn2C)c1C ZINC000623645995 368965819 /nfs/dbraw/zinc/96/58/19/368965819.db2.gz XSAGYIKMGDSJLL-UHFFFAOYSA-N 1 2 231.299 2.349 20 0 BEADLO C[C@@H]1CCC(C)(C)N1C(=O)CCc1c[nH+]cn1C ZINC000616165312 369000434 /nfs/dbraw/zinc/00/04/34/369000434.db2.gz ORUNAMICXVZELQ-LLVKDONJSA-N 1 2 249.358 2.142 20 0 BEADLO CC[C@H](NC(=O)[C@@H](C)C1CCC1)c1[nH]cc[nH+]1 ZINC000457724257 203094663 /nfs/dbraw/zinc/09/46/63/203094663.db2.gz DZFPIJHELHXZRO-ONGXEEELSA-N 1 2 235.331 2.413 20 0 BEADLO CC[C@H](NC(=O)[C@H](C)C1CCC1)c1[nH]cc[nH+]1 ZINC000457724253 203095781 /nfs/dbraw/zinc/09/57/81/203095781.db2.gz DZFPIJHELHXZRO-KOLCDFICSA-N 1 2 235.331 2.413 20 0 BEADLO Cn1c[nH+]c(CCNC(=O)CCC2CCCC2)c1 ZINC000457871139 203115580 /nfs/dbraw/zinc/11/55/80/203115580.db2.gz BGVCGXCQZMSXSF-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO CCC[C@@H](NC(=O)c1c[nH+]c(C)[nH]1)C1CCC1 ZINC000458330797 203161283 /nfs/dbraw/zinc/16/12/83/203161283.db2.gz MLGJHUJGLIYVIR-LLVKDONJSA-N 1 2 235.331 2.417 20 0 BEADLO FC(F)(F)c1ccnc(C[NH2+]CC2(F)CC2)n1 ZINC000521580063 259536730 /nfs/dbraw/zinc/53/67/30/259536730.db2.gz VOACVDXPDFRMLI-UHFFFAOYSA-N 1 2 249.211 2.087 20 0 BEADLO CC[C@@](C)(NC(=O)C[NH+]1CC(C)(C)C1)C1CC1 ZINC000618960817 369249268 /nfs/dbraw/zinc/24/92/68/369249268.db2.gz KKUMJRDMYOYFFQ-CQSZACIVSA-N 1 2 238.375 2.023 20 0 BEADLO CCO[C@@H](C)C(=O)Nc1c[nH+]c2c(C)cccn12 ZINC000619013251 369257589 /nfs/dbraw/zinc/25/75/89/369257589.db2.gz NYBHSDGLMQRNHV-JTQLQIEISA-N 1 2 247.298 2.006 20 0 BEADLO C[N@H+](CCOCC1CCCC1)Cc1cc[nH]n1 ZINC000459335702 203262444 /nfs/dbraw/zinc/26/24/44/203262444.db2.gz CAIKVWQMXWNUAJ-UHFFFAOYSA-N 1 2 237.347 2.048 20 0 BEADLO C[N@@H+](CCOCC1CCCC1)Cc1cc[nH]n1 ZINC000459335702 203262447 /nfs/dbraw/zinc/26/24/47/203262447.db2.gz CAIKVWQMXWNUAJ-UHFFFAOYSA-N 1 2 237.347 2.048 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2C[C@]2(C)C(C)C)cc[nH+]1 ZINC000459477413 203286907 /nfs/dbraw/zinc/28/69/07/203286907.db2.gz HCUJTVWNDRXVMD-TZMCWYRMSA-N 1 2 247.342 2.368 20 0 BEADLO COCCCOC1C[NH+](Cc2ccc(C)cc2)C1 ZINC000459584105 203306124 /nfs/dbraw/zinc/30/61/24/203306124.db2.gz BCLJWNNEVCHHAV-UHFFFAOYSA-N 1 2 249.354 2.232 20 0 BEADLO CCCn1cc(C[NH2+]CC(F)(F)CC)cn1 ZINC000623680046 369381731 /nfs/dbraw/zinc/38/17/31/369381731.db2.gz VTUOFGXHLKEPDA-UHFFFAOYSA-N 1 2 231.290 2.428 20 0 BEADLO CCC(F)(F)CNCc1cn2ccccc2[nH+]1 ZINC000623679903 369381930 /nfs/dbraw/zinc/38/19/30/369381930.db2.gz OVLJMBOUSGZQGS-UHFFFAOYSA-N 1 2 239.269 2.469 20 0 BEADLO OCCC1C[NH+](Cc2ccc(Cl)c(F)c2)C1 ZINC000459588855 203308624 /nfs/dbraw/zinc/30/86/24/203308624.db2.gz HABLEFPXLCABSH-UHFFFAOYSA-N 1 2 243.709 2.293 20 0 BEADLO CCC1(CC)C[NH+](Cc2cn(C(C)C)nn2)C1 ZINC000459594217 203308706 /nfs/dbraw/zinc/30/87/06/203308706.db2.gz KJTUCDLAGRURKK-UHFFFAOYSA-N 1 2 236.363 2.481 20 0 BEADLO COC1(C)C[NH+](Cc2cnc(C(C)C)s2)C1 ZINC000459591860 203309039 /nfs/dbraw/zinc/30/90/39/203309039.db2.gz UJQRGLHCNFUPNT-UHFFFAOYSA-N 1 2 240.372 2.487 20 0 BEADLO COc1ccc(C)cc1C[NH+]1CC(C)(OC)C1 ZINC000459595533 203311790 /nfs/dbraw/zinc/31/17/90/203311790.db2.gz WZRUODQCOKZXDM-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO COc1cc(C)c(C[NH2+]CC(F)F)cc1OC ZINC000459551983 203299261 /nfs/dbraw/zinc/29/92/61/203299261.db2.gz XZUUAYUNNPHVJL-UHFFFAOYSA-N 1 2 245.269 2.367 20 0 BEADLO CCOC1C[NH+](Cc2cc3cccnc3o2)C1 ZINC000459609455 203315140 /nfs/dbraw/zinc/31/51/40/203315140.db2.gz QKPIFUNFUNCOKJ-UHFFFAOYSA-N 1 2 232.283 2.049 20 0 BEADLO COC1C[NH+](Cc2ccc(Cl)c(C)c2)C1 ZINC000459583390 203300988 /nfs/dbraw/zinc/30/09/88/203300988.db2.gz PIZBYDKYCCLMSU-UHFFFAOYSA-N 1 2 225.719 2.479 20 0 BEADLO CCOC1(C)C[NH+](Cc2ccc(OC)cc2)C1 ZINC000459618785 203319376 /nfs/dbraw/zinc/31/93/76/203319376.db2.gz SYLARNYWHCLCRQ-UHFFFAOYSA-N 1 2 235.327 2.306 20 0 BEADLO CCOC1(C)C[NH+](Cc2cccnc2C)C1 ZINC000459619880 203319886 /nfs/dbraw/zinc/31/98/86/203319886.db2.gz KZRROXGLILTYIS-UHFFFAOYSA-N 1 2 220.316 2.001 20 0 BEADLO CCOC1(C)C[NH+](Cc2cnn(C(C)C)c2)C1 ZINC000459627932 203320597 /nfs/dbraw/zinc/32/05/97/203320597.db2.gz XDVZPGIPHSTIRO-UHFFFAOYSA-N 1 2 237.347 2.075 20 0 BEADLO CC[C@H](F)C[N@@H+]1CCC[C@H]1C(=O)OC(C)C ZINC000619648847 369507113 /nfs/dbraw/zinc/50/71/13/369507113.db2.gz XLMZWUFERWGYSL-QWRGUYRKSA-N 1 2 231.311 2.151 20 0 BEADLO CC[C@H](F)C[N@H+]1CCC[C@H]1C(=O)OC(C)C ZINC000619648847 369507118 /nfs/dbraw/zinc/50/71/18/369507118.db2.gz XLMZWUFERWGYSL-QWRGUYRKSA-N 1 2 231.311 2.151 20 0 BEADLO C[C@@H](O)CNc1cc2ccccc2c[nH+]1 ZINC000631033639 370977369 /nfs/dbraw/zinc/97/73/69/370977369.db2.gz CCNXQBCJVOOASL-SECBINFHSA-N 1 2 202.257 2.028 20 0 BEADLO CCCCc1cc(NCCCOCC)nc[nH+]1 ZINC000631034320 370982144 /nfs/dbraw/zinc/98/21/44/370982144.db2.gz RIAXSWNKNXDJTP-UHFFFAOYSA-N 1 2 237.347 2.080 20 0 BEADLO CCCCc1cc(N[C@@H](C)COC)nc[nH+]1 ZINC000631033906 370984365 /nfs/dbraw/zinc/98/43/65/370984365.db2.gz CKVIZGVRNFWGNO-JTQLQIEISA-N 1 2 223.320 2.266 20 0 BEADLO O=C(C1CCCC1)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000082278171 370979126 /nfs/dbraw/zinc/97/91/26/370979126.db2.gz CVBNHAZPLDINIR-CYBMUJFWSA-N 1 2 247.342 2.237 20 0 BEADLO CCOCC[N@H+](CC)[C@H](C)c1nnc(CC)o1 ZINC000157462749 326276484 /nfs/dbraw/zinc/27/64/84/326276484.db2.gz NIRRMWIUKLPBMZ-SNVBAGLBSA-N 1 2 241.335 2.051 20 0 BEADLO CCOCC[N@@H+](CC)[C@H](C)c1nnc(CC)o1 ZINC000157462749 326276488 /nfs/dbraw/zinc/27/64/88/326276488.db2.gz NIRRMWIUKLPBMZ-SNVBAGLBSA-N 1 2 241.335 2.051 20 0 BEADLO Cc1[nH]c(C(=O)NC(C)(C2CC2)C2CC2)c[nH+]1 ZINC000620027646 369673029 /nfs/dbraw/zinc/67/30/29/369673029.db2.gz RMWWHXQRHMGJFU-UHFFFAOYSA-N 1 2 233.315 2.027 20 0 BEADLO C[C@@H](NC(=O)CCC(C)(C)C)c1[nH+]ccn1C ZINC000620600835 369950447 /nfs/dbraw/zinc/95/04/47/369950447.db2.gz QRVZZUWNMAYCNB-SNVBAGLBSA-N 1 2 237.347 2.424 20 0 BEADLO C[C@H](NC(=O)C[C@H]1CCC[C@@H]1C)c1[nH+]ccn1C ZINC000620604187 369951609 /nfs/dbraw/zinc/95/16/09/369951609.db2.gz PLWXYWWDNCOWNA-SDDRHHMPSA-N 1 2 249.358 2.424 20 0 BEADLO CCC(C)(CC)C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620604991 369953187 /nfs/dbraw/zinc/95/31/87/369953187.db2.gz XYEDLWNLRZRDCS-JTQLQIEISA-N 1 2 237.347 2.424 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620607022 369955528 /nfs/dbraw/zinc/95/55/28/369955528.db2.gz DKOQLXLRKOYGNC-IJLUTSLNSA-N 1 2 249.358 2.424 20 0 BEADLO Cc1sccc1C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620607575 369955844 /nfs/dbraw/zinc/95/58/44/369955844.db2.gz INWQKFNCCZETHO-QMMMGPOBSA-N 1 2 249.339 2.281 20 0 BEADLO CC[C@@H](C)CCC(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620607561 369956159 /nfs/dbraw/zinc/95/61/59/369956159.db2.gz IHZPSSYDJXRJEE-MNOVXSKESA-N 1 2 237.347 2.424 20 0 BEADLO C[C@H](NC(=O)[C@@H]1C[C@H]1C1CCC1)c1[nH+]ccn1C ZINC000620610873 369956998 /nfs/dbraw/zinc/95/69/98/369956998.db2.gz HZMOLBLXEXRYNQ-ZMLRMANQSA-N 1 2 247.342 2.034 20 0 BEADLO CCCC(C)(C)C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620611624 369957035 /nfs/dbraw/zinc/95/70/35/369957035.db2.gz MOEIWXHILZRPDM-JTQLQIEISA-N 1 2 237.347 2.424 20 0 BEADLO CCCC(C)(C)C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620611625 369957226 /nfs/dbraw/zinc/95/72/26/369957226.db2.gz MOEIWXHILZRPDM-SNVBAGLBSA-N 1 2 237.347 2.424 20 0 BEADLO C[C@H](NC(=O)[C@@H]1CCC1(C)C)c1[nH+]ccn1C ZINC000620612245 369957920 /nfs/dbraw/zinc/95/79/20/369957920.db2.gz SIHOPELHCRGUQD-UWVGGRQHSA-N 1 2 235.331 2.034 20 0 BEADLO Cc1cn2ccc(NC(=O)[C@@H]3CC34CC4)cc2[nH+]1 ZINC000620647814 369972328 /nfs/dbraw/zinc/97/23/28/369972328.db2.gz KCVCZCZFOVRGIN-NSHDSACASA-N 1 2 241.294 2.381 20 0 BEADLO Cc1cc(NC(=O)c2cccnc2)cc[nH+]1 ZINC000074705753 370004615 /nfs/dbraw/zinc/00/46/15/370004615.db2.gz RVNKKUXLQGJZMO-UHFFFAOYSA-N 1 2 213.240 2.037 20 0 BEADLO CC(=O)c1cc(C[N@@H+]2CCC23CCC3)on1 ZINC000568164798 326317544 /nfs/dbraw/zinc/31/75/44/326317544.db2.gz AMHYAAHXUKCESN-UHFFFAOYSA-N 1 2 220.272 2.006 20 0 BEADLO CC(=O)c1cc(C[N@H+]2CCC23CCC3)on1 ZINC000568164798 326317545 /nfs/dbraw/zinc/31/75/45/326317545.db2.gz AMHYAAHXUKCESN-UHFFFAOYSA-N 1 2 220.272 2.006 20 0 BEADLO CN(C[C@H]1CC1(C)C)C(=O)CCCn1cc[nH+]c1 ZINC000621050906 370084396 /nfs/dbraw/zinc/08/43/96/370084396.db2.gz UJRIZPZSWYEFMT-GFCCVEGCSA-N 1 2 249.358 2.168 20 0 BEADLO Clc1cncc(C[N@@H+]2CCc3cn[nH]c3C2)c1 ZINC000621269338 370201836 /nfs/dbraw/zinc/20/18/36/370201836.db2.gz RALPYACTWBJZNY-UHFFFAOYSA-N 1 2 248.717 2.016 20 0 BEADLO Clc1cncc(C[N@H+]2CCc3cn[nH]c3C2)c1 ZINC000621269338 370201840 /nfs/dbraw/zinc/20/18/40/370201840.db2.gz RALPYACTWBJZNY-UHFFFAOYSA-N 1 2 248.717 2.016 20 0 BEADLO CC[C@H]1C[N@@H+]([C@@H](C)c2nc(C)no2)CCS1 ZINC000076072384 370207685 /nfs/dbraw/zinc/20/76/85/370207685.db2.gz PQWIJHQKDFSMLV-WPRPVWTQSA-N 1 2 241.360 2.266 20 0 BEADLO CC[C@H]1C[N@H+]([C@@H](C)c2nc(C)no2)CCS1 ZINC000076072384 370207686 /nfs/dbraw/zinc/20/76/86/370207686.db2.gz PQWIJHQKDFSMLV-WPRPVWTQSA-N 1 2 241.360 2.266 20 0 BEADLO Cc1cc(NCCOCC2CCC2)nc[nH+]1 ZINC000309856362 370269752 /nfs/dbraw/zinc/26/97/52/370269752.db2.gz KNWHIAZBRUDGRT-UHFFFAOYSA-N 1 2 221.304 2.014 20 0 BEADLO Cc1cc(N2CC(CC3CC3)C2)nc[nH+]1 ZINC000621358712 370292392 /nfs/dbraw/zinc/29/23/92/370292392.db2.gz RGEREUGUIBTIGE-UHFFFAOYSA-N 1 2 203.289 2.021 20 0 BEADLO Cc1nc(N2CC(CC3CC3)C2)cc[nH+]1 ZINC000621359663 370293978 /nfs/dbraw/zinc/29/39/78/370293978.db2.gz RQWYJHNVEMWJMJ-UHFFFAOYSA-N 1 2 203.289 2.021 20 0 BEADLO c1ccc(N2CCOc3ccccc3C2)[nH+]c1 ZINC000076874400 370363585 /nfs/dbraw/zinc/36/35/85/370363585.db2.gz ZLBFYANSAYZPQU-UHFFFAOYSA-N 1 2 226.279 2.481 20 0 BEADLO CC[C@@H]([NH2+][C@@H](C(F)F)C1CCCCC1)C(N)=O ZINC000621403972 370340085 /nfs/dbraw/zinc/34/00/85/370340085.db2.gz FBOPAIOJTYJIFD-NXEZZACHSA-N 1 2 248.317 2.054 20 0 BEADLO Cc1ccncc1C[N@@H+](C)Cc1nccnc1C ZINC000621725078 370477486 /nfs/dbraw/zinc/47/74/86/370477486.db2.gz BREGJHWWZNAPAG-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccncc1C[N@H+](C)Cc1nccnc1C ZINC000621725078 370477489 /nfs/dbraw/zinc/47/74/89/370477489.db2.gz BREGJHWWZNAPAG-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1nccnc1C[N@H+](C)Cc1ccco1 ZINC000621709835 370453514 /nfs/dbraw/zinc/45/35/14/370453514.db2.gz HIYUDXYOUPHVHM-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1nccnc1C[N@@H+](C)Cc1ccco1 ZINC000621709835 370453515 /nfs/dbraw/zinc/45/35/15/370453515.db2.gz HIYUDXYOUPHVHM-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1nccnc1C[N@@H+]1CCn2cccc2[C@@H]1C ZINC000621709928 370456269 /nfs/dbraw/zinc/45/62/69/370456269.db2.gz LFUHEIBIHOCKMV-LBPRGKRZSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1nccnc1C[N@H+]1CCn2cccc2[C@@H]1C ZINC000621709928 370456271 /nfs/dbraw/zinc/45/62/71/370456271.db2.gz LFUHEIBIHOCKMV-LBPRGKRZSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2nccnc2C)o1 ZINC000621709798 370456319 /nfs/dbraw/zinc/45/63/19/370456319.db2.gz FDKGMKCNHFJGDN-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2nccnc2C)o1 ZINC000621709798 370456321 /nfs/dbraw/zinc/45/63/21/370456321.db2.gz FDKGMKCNHFJGDN-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1nccnc1C[NH+]1Cc2ccccc2C1 ZINC000621715288 370462638 /nfs/dbraw/zinc/46/26/38/370462638.db2.gz QGZMRSMYDNYTPX-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO Cc1nccnc1C[N@H+]1CCOC[C@@H]1CC(C)C ZINC000621715637 370463035 /nfs/dbraw/zinc/46/30/35/370463035.db2.gz BDLOBTKSUIPAOD-ZDUSSCGKSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1nccnc1C[N@@H+]1CCOC[C@@H]1CC(C)C ZINC000621715637 370463043 /nfs/dbraw/zinc/46/30/43/370463043.db2.gz BDLOBTKSUIPAOD-ZDUSSCGKSA-N 1 2 249.358 2.032 20 0 BEADLO c1cc(CC2C[NH+](Cc3cocn3)C2)cs1 ZINC000621741454 370501400 /nfs/dbraw/zinc/50/14/00/370501400.db2.gz SSBYCAGAVAYXAT-UHFFFAOYSA-N 1 2 234.324 2.411 20 0 BEADLO CC(C)=C[C@H]1[C@H](C(=O)NCc2[nH]cc[nH+]2)C1(C)C ZINC000114336441 370553998 /nfs/dbraw/zinc/55/39/98/370553998.db2.gz JTYMFIOIKZLSMB-CMPLNLGQSA-N 1 2 247.342 2.264 20 0 BEADLO C[C@H](CCC1CC1)NC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000621956878 370620051 /nfs/dbraw/zinc/62/00/51/370620051.db2.gz AOGOBAQWYBABMI-SNVBAGLBSA-N 1 2 249.358 2.382 20 0 BEADLO C[C@H]1CN(C(=O)C(C)(C)c2c[nH+]c[nH]2)CC[C@@H]1C ZINC000621938466 370610084 /nfs/dbraw/zinc/61/00/84/370610084.db2.gz BQQLIFMIDCMNSQ-QWRGUYRKSA-N 1 2 249.358 2.192 20 0 BEADLO CCCCc1cc(NCC[C@H]2CCCO2)nc[nH+]1 ZINC000631049405 371091053 /nfs/dbraw/zinc/09/10/53/371091053.db2.gz FQYAUTFTYWTEFX-CYBMUJFWSA-N 1 2 249.358 2.222 20 0 BEADLO COc1ccc[nH+]c1N1CCC[C@H](C)C1 ZINC000623788849 371094169 /nfs/dbraw/zinc/09/41/69/371094169.db2.gz SZXLDXIBVLEUTC-JTQLQIEISA-N 1 2 206.289 2.327 20 0 BEADLO c1cc(C[NH2+][C@H]2CCCc3scnc32)n[nH]1 ZINC000623889515 371141832 /nfs/dbraw/zinc/14/18/32/371141832.db2.gz ORQSMYWFUCATBZ-VIFPVBQESA-N 1 2 234.328 2.033 20 0 BEADLO CCCN(CC)C(=O)[C@@H]1CCn2cc(C)[nH+]c2C1 ZINC000623931857 371160513 /nfs/dbraw/zinc/16/05/13/371160513.db2.gz NMHQQRFDNPPJMJ-GFCCVEGCSA-N 1 2 249.358 2.012 20 0 BEADLO COc1ccc(N[C@H]2CC[C@@H]2SC)[nH+]c1 ZINC000389935790 371181911 /nfs/dbraw/zinc/18/19/11/371181911.db2.gz MWYWSRVHSCUFMA-UWVGGRQHSA-N 1 2 224.329 2.396 20 0 BEADLO CC1CN(c2nc3ccccc3n3c[nH+]cc23)C1 ZINC000624105344 371311128 /nfs/dbraw/zinc/31/11/28/371311128.db2.gz LRIXTWMABXUNBU-UHFFFAOYSA-N 1 2 238.294 2.339 20 0 BEADLO COc1ccc[nH+]c1N1CCC[C@H]2C[C@H]21 ZINC000624210688 371396758 /nfs/dbraw/zinc/39/67/58/371396758.db2.gz URCWWHXCEILAFO-VHSXEESVSA-N 1 2 204.273 2.079 20 0 BEADLO COc1ccc[nH+]c1N1CC[C@H](C(F)F)C1 ZINC000624183087 371373905 /nfs/dbraw/zinc/37/39/05/371373905.db2.gz BQEZPFGHPMAXCH-QMMMGPOBSA-N 1 2 228.242 2.182 20 0 BEADLO CC[C@@H](C)C[C@@H](CO)Nc1[nH+]cccc1OC ZINC000624330552 371484410 /nfs/dbraw/zinc/48/44/10/371484410.db2.gz YUJOFQLBICKFKQ-MNOVXSKESA-N 1 2 238.331 2.299 20 0 BEADLO CCC[C@H](CNc1cc(CC)[nH+]cn1)OCC ZINC000624437029 371509875 /nfs/dbraw/zinc/50/98/75/371509875.db2.gz PVJCUWUJVHKNOT-GFCCVEGCSA-N 1 2 237.347 2.078 20 0 BEADLO C[C@@H](C(=O)N1CCc2[nH]c[nH+]c2C1)C1CCCC1 ZINC000627369065 371588382 /nfs/dbraw/zinc/58/83/82/371588382.db2.gz JRLYQEMQOLUXJG-SNVBAGLBSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@@H](C(=O)N1CCc2[nH+]c[nH]c2C1)C1CCCC1 ZINC000627369065 371588389 /nfs/dbraw/zinc/58/83/89/371588389.db2.gz JRLYQEMQOLUXJG-SNVBAGLBSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@@H]1CCCC[C@H]1C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627373261 371592276 /nfs/dbraw/zinc/59/22/76/371592276.db2.gz MELSYANKAOYIFV-GHMZBOCLSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@@H]1CCCC[C@H]1C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627373261 371592286 /nfs/dbraw/zinc/59/22/86/371592286.db2.gz MELSYANKAOYIFV-GHMZBOCLSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@@H](c1cccc(F)c1)[NH+]1CCOCC1 ZINC000056267293 371627467 /nfs/dbraw/zinc/62/74/67/371627467.db2.gz UXCATGDZXAYVBM-JTQLQIEISA-N 1 2 209.264 2.219 20 0 BEADLO C[C@@H](NC(=O)C[C@H](C)C(F)(F)F)c1[nH]cc[nH+]1 ZINC000627465866 371637969 /nfs/dbraw/zinc/63/79/69/371637969.db2.gz QTXUOBRTUIGXEN-NKWVEPMBSA-N 1 2 249.236 2.175 20 0 BEADLO Cc1cc(C(=O)NCC[C@@H](C)F)c2[nH+]ccn2c1 ZINC000627535361 371688728 /nfs/dbraw/zinc/68/87/28/371688728.db2.gz KVGZACQZWRNRCV-SNVBAGLBSA-N 1 2 249.289 2.121 20 0 BEADLO COc1ccc[nH+]c1NCC(C)(C)CCCO ZINC000227924256 371958525 /nfs/dbraw/zinc/95/85/25/371958525.db2.gz GWENAFLWVWKDPX-UHFFFAOYSA-N 1 2 238.331 2.301 20 0 BEADLO COc1cncc(C[NH2+]CC(C)(F)F)c1C ZINC000631142161 372208621 /nfs/dbraw/zinc/20/86/21/372208621.db2.gz DNESZFQCKPEYOG-UHFFFAOYSA-N 1 2 230.258 2.143 20 0 BEADLO C[C@@H]1CN(c2cc3ccccc3c[nH+]2)C[C@@H]1O ZINC000631189042 372223247 /nfs/dbraw/zinc/22/32/47/372223247.db2.gz XEBOYRSRYVYUJS-MFKMUULPSA-N 1 2 228.295 2.052 20 0 BEADLO CN(C)c1c[nH+]cc(N[C@H]2CCCSC2)c1 ZINC000631204002 372233613 /nfs/dbraw/zinc/23/36/13/372233613.db2.gz WRWQGCFCRQTTEV-JTQLQIEISA-N 1 2 237.372 2.455 20 0 BEADLO CCOc1cccc(C[NH2+]Cc2conc2C)n1 ZINC000631208867 372236666 /nfs/dbraw/zinc/23/66/66/372236666.db2.gz MSSCGBBOIYMELU-UHFFFAOYSA-N 1 2 247.298 2.067 20 0 BEADLO Cc1ccc(C[NH2+]Cc2ccncc2F)o1 ZINC000631242619 372257093 /nfs/dbraw/zinc/25/70/93/372257093.db2.gz KLVJTIYDDCOHQQ-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO CCc1nocc1C[NH2+]Cc1ccc(C)o1 ZINC000631243067 372257219 /nfs/dbraw/zinc/25/72/19/372257219.db2.gz QNAYQFYJKXBJLV-UHFFFAOYSA-N 1 2 220.272 2.428 20 0 BEADLO CCC[C@@H](CCO)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000631426609 372356603 /nfs/dbraw/zinc/35/66/03/372356603.db2.gz KIGVHIGCURZOON-JTQLQIEISA-N 1 2 248.330 2.229 20 0 BEADLO CC[C@]1(O)CCCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000631485244 372388514 /nfs/dbraw/zinc/38/85/14/372388514.db2.gz AFKMVTVWYPLBND-AWEZNQCLSA-N 1 2 245.326 2.304 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@@H]1CCCc2ncccc21 ZINC000631598649 372450096 /nfs/dbraw/zinc/45/00/96/372450096.db2.gz LFNYJCHEITYZKX-CQSZACIVSA-N 1 2 242.326 2.280 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2cc(C)n(C)n2)o1 ZINC000631730544 372535319 /nfs/dbraw/zinc/53/53/19/372535319.db2.gz XBIODMDUMNSVIO-NSHDSACASA-N 1 2 233.315 2.481 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2cc(C)n(C)n2)o1 ZINC000631730543 372535630 /nfs/dbraw/zinc/53/56/30/372535630.db2.gz XBIODMDUMNSVIO-LLVKDONJSA-N 1 2 233.315 2.481 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+][C@@H]1C[C@H]1C(F)(F)F ZINC000631755055 372558438 /nfs/dbraw/zinc/55/84/38/372558438.db2.gz XOOMRGTWTRLOIJ-JISRMSBWSA-N 1 2 233.237 2.320 20 0 BEADLO CC(C)c1nc(NCC2CCOCC2)cc[nH+]1 ZINC000171887324 372812736 /nfs/dbraw/zinc/81/27/36/372812736.db2.gz ZFQHSGUXKGUOEP-UHFFFAOYSA-N 1 2 235.331 2.439 20 0 BEADLO O=C(Cn1cc[nH+]c1)N1CCC[C@H]2CCCC[C@H]21 ZINC000266308905 182070633 /nfs/dbraw/zinc/07/06/33/182070633.db2.gz SJYIPWWPFDEBHR-CHWSQXEVSA-N 1 2 247.342 2.064 20 0 BEADLO O=C(Cn1cc[nH+]c1)N1CCC[C@@H]2CCCC[C@H]21 ZINC000266308909 182071330 /nfs/dbraw/zinc/07/13/30/182071330.db2.gz SJYIPWWPFDEBHR-QWHCGFSZSA-N 1 2 247.342 2.064 20 0 BEADLO CCC[C@H](CC)NC(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000632950604 373230769 /nfs/dbraw/zinc/23/07/69/373230769.db2.gz NKDCUFYAHOAUJJ-JTQLQIEISA-N 1 2 238.335 2.130 20 0 BEADLO CCOC(=O)[C@@H]([NH2+]CCSCC)[C@@H](C)CC ZINC000181637577 205666213 /nfs/dbraw/zinc/66/62/13/205666213.db2.gz MPOCJRZFUJYYFE-QWRGUYRKSA-N 1 2 247.404 2.307 20 0 BEADLO O=C(NCCCCn1cc[nH+]c1)c1ccccc1 ZINC000027561760 182165411 /nfs/dbraw/zinc/16/54/11/182165411.db2.gz YKEQSYAXLGUHRF-UHFFFAOYSA-N 1 2 243.310 2.093 20 0 BEADLO O=C(NCCCn1cc[nH+]c1)Oc1ccccc1 ZINC000070237297 182177924 /nfs/dbraw/zinc/17/79/24/182177924.db2.gz ZRSJVOULCITCJY-UHFFFAOYSA-N 1 2 245.282 2.062 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2[C@H](C)[C@@H]2c2ccccc2)n1 ZINC000414649554 205767222 /nfs/dbraw/zinc/76/72/22/205767222.db2.gz XAFCETDAWWPNBQ-OASPWFOLSA-N 1 2 243.310 2.306 20 0 BEADLO CCC(C)(C)CCNC(=O)CCc1[nH]cc[nH+]1 ZINC000633968138 373868357 /nfs/dbraw/zinc/86/83/57/373868357.db2.gz DBNKOMDNHGDOSS-UHFFFAOYSA-N 1 2 237.347 2.285 20 0 BEADLO O=C(CCCn1cc[nH+]c1)N[C@]12C[C@H]1CCCC2 ZINC000634080001 373944040 /nfs/dbraw/zinc/94/40/40/373944040.db2.gz KDNRGVDVXCDXGO-TZMCWYRMSA-N 1 2 247.342 2.112 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@]12C[C@H]1CCCC2 ZINC000634086316 373953511 /nfs/dbraw/zinc/95/35/11/373953511.db2.gz MUKDCSFMEDGAII-JTNHKYCSSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@]12C[C@H]1CCCC2 ZINC000634086316 373953519 /nfs/dbraw/zinc/95/35/19/373953519.db2.gz MUKDCSFMEDGAII-JTNHKYCSSA-N 1 2 247.342 2.037 20 0 BEADLO Cn1cc[nH+]c1CNc1ccc(Cl)cn1 ZINC000070853851 374206436 /nfs/dbraw/zinc/20/64/36/374206436.db2.gz HJMKZOBHPMGENY-UHFFFAOYSA-N 1 2 222.679 2.081 20 0 BEADLO F[C@]1(c2ccccc2)C[C@H]1[NH2+]Cc1cc[nH]n1 ZINC000424194289 206035561 /nfs/dbraw/zinc/03/55/61/206035561.db2.gz LHKRUYXHNQIRRY-OLZOCXBDSA-N 1 2 231.274 2.137 20 0 BEADLO F[C@@]1(c2ccccc2)C[C@H]1[NH2+]Cc1cc[nH]n1 ZINC000424194287 206033989 /nfs/dbraw/zinc/03/39/89/206033989.db2.gz LHKRUYXHNQIRRY-CHWSQXEVSA-N 1 2 231.274 2.137 20 0 BEADLO O=C(N[C@@H]1CC=CCC1)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000370491139 182291423 /nfs/dbraw/zinc/29/14/23/182291423.db2.gz KNIZKYXNVQJEGU-GHMZBOCLSA-N 1 2 245.326 2.055 20 0 BEADLO O=C(N[C@@H]1CC=CCC1)[C@@H]1CCCc2[nH]c[nH+]c21 ZINC000370491139 182291426 /nfs/dbraw/zinc/29/14/26/182291426.db2.gz KNIZKYXNVQJEGU-GHMZBOCLSA-N 1 2 245.326 2.055 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)c1cscn1 ZINC000358774780 182374564 /nfs/dbraw/zinc/37/45/64/182374564.db2.gz BRKNRKLDDOCPMV-UHFFFAOYSA-N 1 2 244.279 2.043 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)[C@H]1CCCS1 ZINC000266691692 182374932 /nfs/dbraw/zinc/37/49/32/182374932.db2.gz VUJWQOBVIWJNCV-SECBINFHSA-N 1 2 247.323 2.168 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)[C@@H]1CCSC1 ZINC000336278584 182385075 /nfs/dbraw/zinc/38/50/75/182385075.db2.gz SOFHRPCMHFZFQT-SECBINFHSA-N 1 2 247.323 2.026 20 0 BEADLO O=C(Nc1cc[nH+]cc1O)c1ccsc1 ZINC000109889656 182388238 /nfs/dbraw/zinc/38/82/38/182388238.db2.gz ZKYZLPXJECDUBZ-UHFFFAOYSA-N 1 2 220.253 2.101 20 0 BEADLO CCCCOCCSc1nc(N)cc(C)[nH+]1 ZINC000108104702 168904297 /nfs/dbraw/zinc/90/42/97/168904297.db2.gz UJIIJXCJUROWFU-UHFFFAOYSA-N 1 2 241.360 2.276 20 0 BEADLO OC1(CCNc2cc[nH+]c(C3CC3)n2)CCC1 ZINC000286640906 183016498 /nfs/dbraw/zinc/01/64/98/183016498.db2.gz FQUXDBDJSKFABR-UHFFFAOYSA-N 1 2 233.315 2.071 20 0 BEADLO OC1(c2ccccc2)C[NH+](Cc2ccsc2)C1 ZINC000291492239 183023006 /nfs/dbraw/zinc/02/30/06/183023006.db2.gz GQYLLPZXJASULT-UHFFFAOYSA-N 1 2 245.347 2.452 20 0 BEADLO OCCC[C@H]([NH2+]Cc1cocn1)c1ccccc1 ZINC000192317653 183062681 /nfs/dbraw/zinc/06/26/81/183062681.db2.gz KPWRSPRZRLQADU-AWEZNQCLSA-N 1 2 246.310 2.278 20 0 BEADLO OC[C@@H]1CCCC[N@@H+]1Cc1csc(Cl)n1 ZINC000295419079 183115347 /nfs/dbraw/zinc/11/53/47/183115347.db2.gz DSZLBLDJEMYJDN-VIFPVBQESA-N 1 2 246.763 2.143 20 0 BEADLO OC[C@@H]1CCCC[N@H+]1Cc1csc(Cl)n1 ZINC000295419079 183115349 /nfs/dbraw/zinc/11/53/49/183115349.db2.gz DSZLBLDJEMYJDN-VIFPVBQESA-N 1 2 246.763 2.143 20 0 BEADLO OC[C@@]1(F)CCC[N@H+](Cc2ccccc2F)C1 ZINC000286766414 183134243 /nfs/dbraw/zinc/13/42/43/183134243.db2.gz GFXXBQSNNNUOLZ-CYBMUJFWSA-N 1 2 241.281 2.122 20 0 BEADLO OC[C@@]1(F)CCC[N@@H+](Cc2ccccc2F)C1 ZINC000286766414 183134245 /nfs/dbraw/zinc/13/42/45/183134245.db2.gz GFXXBQSNNNUOLZ-CYBMUJFWSA-N 1 2 241.281 2.122 20 0 BEADLO OC[C@H](CC1CCC1)Nc1cccc[nH+]1 ZINC000280267931 183137723 /nfs/dbraw/zinc/13/77/23/183137723.db2.gz OMMINHDJGJWOBQ-NSHDSACASA-N 1 2 206.289 2.045 20 0 BEADLO O[C@@H]1CCCC[C@@H]1Nc1cc[nH+]c2ccncc12 ZINC000267244562 183189665 /nfs/dbraw/zinc/18/96/65/183189665.db2.gz SMKKDJIEXFNQSP-UONOGXRCSA-N 1 2 243.310 2.345 20 0 BEADLO O[C@@H]1CCC[N@H+](Cc2ncc(Cl)s2)CC1 ZINC000336365108 183194151 /nfs/dbraw/zinc/19/41/51/183194151.db2.gz QAWWQDANGKKROE-MRVPVSSYSA-N 1 2 246.763 2.143 20 0 BEADLO O[C@@H]1CCC[N@@H+](Cc2ncc(Cl)s2)CC1 ZINC000336365108 183194152 /nfs/dbraw/zinc/19/41/52/183194152.db2.gz QAWWQDANGKKROE-MRVPVSSYSA-N 1 2 246.763 2.143 20 0 BEADLO O[C@H](CCOCc1[nH]cc[nH+]1)c1ccccc1 ZINC000285208527 183218799 /nfs/dbraw/zinc/21/87/99/183218799.db2.gz PGDKGPWKVYNHAD-GFCCVEGCSA-N 1 2 232.283 2.050 20 0 BEADLO CCC[N@H+](C)Cc1nc(C(=O)OCC)cs1 ZINC000292512610 169080780 /nfs/dbraw/zinc/08/07/80/169080780.db2.gz DFQFQJSNFQFWSO-UHFFFAOYSA-N 1 2 242.344 2.162 20 0 BEADLO CCC[N@@H+](C)Cc1nc(C(=O)OCC)cs1 ZINC000292512610 169080783 /nfs/dbraw/zinc/08/07/83/169080783.db2.gz DFQFQJSNFQFWSO-UHFFFAOYSA-N 1 2 242.344 2.162 20 0 BEADLO CCC[N@H+](C)[C@@H](C(=O)OC)c1ccc(F)cc1 ZINC000101547031 169086965 /nfs/dbraw/zinc/08/69/65/169086965.db2.gz NTBYERZZPBCHTA-GFCCVEGCSA-N 1 2 239.290 2.382 20 0 BEADLO CCC[N@@H+](C)[C@@H](C(=O)OC)c1ccc(F)cc1 ZINC000101547031 169086967 /nfs/dbraw/zinc/08/69/67/169086967.db2.gz NTBYERZZPBCHTA-GFCCVEGCSA-N 1 2 239.290 2.382 20 0 BEADLO CCC[N@H+](CC(=O)OC)Cc1ccsc1 ZINC000050066172 169101742 /nfs/dbraw/zinc/10/17/42/169101742.db2.gz XUYKUTCWRDJKKE-UHFFFAOYSA-N 1 2 227.329 2.133 20 0 BEADLO CCC[N@@H+](CC(=O)OC)Cc1ccsc1 ZINC000050066172 169101743 /nfs/dbraw/zinc/10/17/43/169101743.db2.gz XUYKUTCWRDJKKE-UHFFFAOYSA-N 1 2 227.329 2.133 20 0 BEADLO CCC[N@H+](CC(F)F)C[C@@H](O)C(C)(C)C ZINC000336719112 169109115 /nfs/dbraw/zinc/10/91/15/169109115.db2.gz YTQWAVXJTHTRCQ-SECBINFHSA-N 1 2 223.307 2.371 20 0 BEADLO CCC[N@@H+](CC(F)F)C[C@@H](O)C(C)(C)C ZINC000336719112 169109116 /nfs/dbraw/zinc/10/91/16/169109116.db2.gz YTQWAVXJTHTRCQ-SECBINFHSA-N 1 2 223.307 2.371 20 0 BEADLO CCC[N@H+](CC(F)F)C[C@H](O)C(C)(C)C ZINC000336719113 169109174 /nfs/dbraw/zinc/10/91/74/169109174.db2.gz YTQWAVXJTHTRCQ-VIFPVBQESA-N 1 2 223.307 2.371 20 0 BEADLO CCC[N@@H+](CC(F)F)C[C@H](O)C(C)(C)C ZINC000336719113 169109176 /nfs/dbraw/zinc/10/91/76/169109176.db2.gz YTQWAVXJTHTRCQ-VIFPVBQESA-N 1 2 223.307 2.371 20 0 BEADLO O[C@H]1CCC[N@H+](Cc2cc(F)c(F)cc2F)C1 ZINC000158790604 183235919 /nfs/dbraw/zinc/23/59/19/183235919.db2.gz HTLGWBCXKOVMFQ-VIFPVBQESA-N 1 2 245.244 2.061 20 0 BEADLO O[C@H]1CCC[N@@H+](Cc2cc(F)c(F)cc2F)C1 ZINC000158790604 183235922 /nfs/dbraw/zinc/23/59/22/183235922.db2.gz HTLGWBCXKOVMFQ-VIFPVBQESA-N 1 2 245.244 2.061 20 0 BEADLO CCC[N@H+](CC)Cc1noc(C(C)C)n1 ZINC000336645021 169131746 /nfs/dbraw/zinc/13/17/46/169131746.db2.gz HJRAXPDVMXRHLV-UHFFFAOYSA-N 1 2 211.309 2.425 20 0 BEADLO CCC[N@@H+](CC)Cc1noc(C(C)C)n1 ZINC000336645021 169131749 /nfs/dbraw/zinc/13/17/49/169131749.db2.gz HJRAXPDVMXRHLV-UHFFFAOYSA-N 1 2 211.309 2.425 20 0 BEADLO Oc1ccc2c(c1)OCC[N@@H+](C/C=C/Cl)C2 ZINC000285503682 183280053 /nfs/dbraw/zinc/28/00/53/183280053.db2.gz MYIVFGTZFUKZHV-DAFODLJHSA-N 1 2 239.702 2.339 20 0 BEADLO Oc1ccc2c(c1)OCC[N@H+](C/C=C/Cl)C2 ZINC000285503682 183280056 /nfs/dbraw/zinc/28/00/56/183280056.db2.gz MYIVFGTZFUKZHV-DAFODLJHSA-N 1 2 239.702 2.339 20 0 BEADLO CCCN(CCC)C(=O)[C@@H]1CCc2[nH+]ccn2C1 ZINC000371483732 169142792 /nfs/dbraw/zinc/14/27/92/169142792.db2.gz UUOHESARXZWSIG-GFCCVEGCSA-N 1 2 249.358 2.094 20 0 BEADLO CCC[N@H+](Cc1cnn[nH]1)Cc1ccccc1 ZINC000284289055 169176978 /nfs/dbraw/zinc/17/69/78/169176978.db2.gz NVVJBLBGVATRNU-UHFFFAOYSA-N 1 2 230.315 2.217 20 0 BEADLO CCC[N@@H+](Cc1cnn[nH]1)Cc1ccccc1 ZINC000284289055 169176981 /nfs/dbraw/zinc/17/69/81/169176981.db2.gz NVVJBLBGVATRNU-UHFFFAOYSA-N 1 2 230.315 2.217 20 0 BEADLO CCC[N@H+](Cc1c[nH]nn1)Cc1ccccc1 ZINC000284289055 169176983 /nfs/dbraw/zinc/17/69/83/169176983.db2.gz NVVJBLBGVATRNU-UHFFFAOYSA-N 1 2 230.315 2.217 20 0 BEADLO CCC[N@@H+](Cc1c[nH]nn1)Cc1ccccc1 ZINC000284289055 169176985 /nfs/dbraw/zinc/17/69/85/169176985.db2.gz NVVJBLBGVATRNU-UHFFFAOYSA-N 1 2 230.315 2.217 20 0 BEADLO CCC[N@H+](Cc1cn[nH]n1)Cc1ccccc1 ZINC000284289055 169176988 /nfs/dbraw/zinc/17/69/88/169176988.db2.gz NVVJBLBGVATRNU-UHFFFAOYSA-N 1 2 230.315 2.217 20 0 BEADLO CCC[N@@H+](Cc1cn[nH]n1)Cc1ccccc1 ZINC000284289055 169176990 /nfs/dbraw/zinc/17/69/90/169176990.db2.gz NVVJBLBGVATRNU-UHFFFAOYSA-N 1 2 230.315 2.217 20 0 BEADLO CCCN(CCO)c1cc(C(F)(F)F)cc[nH+]1 ZINC000090804275 169169584 /nfs/dbraw/zinc/16/95/84/169169584.db2.gz IHXIOIXBWKZKDT-UHFFFAOYSA-N 1 2 248.248 2.309 20 0 BEADLO CCCN(c1nc[nH+]c(N)c1Cl)C1CC1 ZINC000225820903 169183226 /nfs/dbraw/zinc/18/32/26/169183226.db2.gz ITKIIBNFGBPYKE-UHFFFAOYSA-N 1 2 226.711 2.091 20 0 BEADLO CCCN(c1[nH+]cnc(N)c1Cl)C1CC1 ZINC000225820903 169183228 /nfs/dbraw/zinc/18/32/28/169183228.db2.gz ITKIIBNFGBPYKE-UHFFFAOYSA-N 1 2 226.711 2.091 20 0 BEADLO c1c[nH+]c([C@H]2CCCCN2Cc2cocn2)[nH]1 ZINC000191072096 183326557 /nfs/dbraw/zinc/32/65/57/183326557.db2.gz IQHOOBRHRUXBAM-LLVKDONJSA-N 1 2 232.287 2.125 20 0 BEADLO c1c[nH+]c([C@@H]2CCCCN2Cc2cocn2)[nH]1 ZINC000191072080 183327049 /nfs/dbraw/zinc/32/70/49/183327049.db2.gz IQHOOBRHRUXBAM-NSHDSACASA-N 1 2 232.287 2.125 20 0 BEADLO CCCN(Cc1cc[nH+]c(N)c1)CC(F)(F)F ZINC000052723708 169179082 /nfs/dbraw/zinc/17/90/82/169179082.db2.gz PDLMILMAPWQHMH-UHFFFAOYSA-N 1 2 247.264 2.438 20 0 BEADLO c1cc(C[NH+]2CCN(C3CC3)CC2)cs1 ZINC000121024294 183344003 /nfs/dbraw/zinc/34/40/03/183344003.db2.gz JZMMWMOQUCHFDE-UHFFFAOYSA-N 1 2 222.357 2.028 20 0 BEADLO c1sc([C@H]2COCC[NH2+]2)nc1-c1ccccc1 ZINC000076136748 183382201 /nfs/dbraw/zinc/38/22/01/183382201.db2.gz WYLRTYVYEPJSMV-LLVKDONJSA-N 1 2 246.335 2.471 20 0 BEADLO c1cc(C[N@@H+]2CCC[C@H]2c2ccncc2)n[nH]1 ZINC000284215156 183360747 /nfs/dbraw/zinc/36/07/47/183360747.db2.gz ZNIRAWVAWZZJNO-ZDUSSCGKSA-N 1 2 228.299 2.142 20 0 BEADLO c1cc(C[N@H+]2CCC[C@H]2c2ccncc2)n[nH]1 ZINC000284215156 183360749 /nfs/dbraw/zinc/36/07/49/183360749.db2.gz ZNIRAWVAWZZJNO-ZDUSSCGKSA-N 1 2 228.299 2.142 20 0 BEADLO c1c[nH]c(C[NH+]2CCC(c3ccccn3)CC2)n1 ZINC000378259650 183390864 /nfs/dbraw/zinc/39/08/64/183390864.db2.gz KKGPGNRMOLORQH-UHFFFAOYSA-N 1 2 242.326 2.184 20 0 BEADLO CCCOC(=O)[C@H](C)[N@H+](C)Cc1ccccc1 ZINC000126635187 169299626 /nfs/dbraw/zinc/29/96/26/169299626.db2.gz LKHFHTOGEMBDDL-LBPRGKRZSA-N 1 2 235.327 2.460 20 0 BEADLO CCCOC(=O)[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000126635187 169299628 /nfs/dbraw/zinc/29/96/28/169299628.db2.gz LKHFHTOGEMBDDL-LBPRGKRZSA-N 1 2 235.327 2.460 20 0 BEADLO CCCOC(=O)[C@H](C)[N@H+](C)Cc1ccc(C)o1 ZINC000158358121 169299686 /nfs/dbraw/zinc/29/96/86/169299686.db2.gz NDCRENVHQZUJSD-NSHDSACASA-N 1 2 239.315 2.362 20 0 BEADLO CCCOC(=O)[C@H](C)[N@@H+](C)Cc1ccc(C)o1 ZINC000158358121 169299688 /nfs/dbraw/zinc/29/96/88/169299688.db2.gz NDCRENVHQZUJSD-NSHDSACASA-N 1 2 239.315 2.362 20 0 BEADLO CCC[C@@H](C)C(=O)N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000339472425 169349531 /nfs/dbraw/zinc/34/95/31/169349531.db2.gz YMGDRPZMQPHWAM-VXGBXAGGSA-N 1 2 249.358 2.172 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000282575470 169362104 /nfs/dbraw/zinc/36/21/04/169362104.db2.gz ASYIAZDYACGXJO-VQCYPWCPSA-N 1 2 221.304 2.070 20 0 BEADLO CCC[C@@H](CC)NC(=O)[C@H]1CCc2[nH+]ccn2C1 ZINC000364982966 169377428 /nfs/dbraw/zinc/37/74/28/169377428.db2.gz BCMISIVXWZTELW-NWDGAFQWSA-N 1 2 249.358 2.140 20 0 BEADLO CCC[C@@H]([NH2+]CC1(C(F)F)CC1)C(=O)OCC ZINC000360595047 169399339 /nfs/dbraw/zinc/39/93/39/169399339.db2.gz CMMUJVNSSIHAQG-SECBINFHSA-N 1 2 249.301 2.353 20 0 BEADLO CCC[C@@H]([NH2+]Cc1ccc(C)cc1)C(=O)OC ZINC000083362432 169402009 /nfs/dbraw/zinc/40/20/09/169402009.db2.gz ZAWJKHFUWYTIPV-CYBMUJFWSA-N 1 2 235.327 2.426 20 0 BEADLO CCc1cn(Cc2c(C)noc2C)c[nH+]1 ZINC001644228555 1172534757 /nfs/dbraw/zinc/53/47/57/1172534757.db2.gz YXZPEEYPOICKCF-UHFFFAOYSA-N 1 2 205.261 2.099 20 0 BEADLO CCOC(=O)CCCCn1c[nH+]c(CC)c1 ZINC001644227986 1172535973 /nfs/dbraw/zinc/53/59/73/1172535973.db2.gz RSFKGSUUWSDYKR-UHFFFAOYSA-N 1 2 224.304 2.179 20 0 BEADLO COc1nscc1C[N@@H+]1CCSC[C@@H]1C ZINC001644681670 1172590975 /nfs/dbraw/zinc/59/09/75/1172590975.db2.gz ICLQPNBLHJHPPB-QMMMGPOBSA-N 1 2 244.385 2.089 20 0 BEADLO COc1nscc1C[N@H+]1CCSC[C@@H]1C ZINC001644681670 1172590980 /nfs/dbraw/zinc/59/09/80/1172590980.db2.gz ICLQPNBLHJHPPB-QMMMGPOBSA-N 1 2 244.385 2.089 20 0 BEADLO CC(C)C[C@@H]1OCCC[C@@H]1[NH2+]Cc1ccn[nH]1 ZINC000185197746 134372683 /nfs/dbraw/zinc/37/26/83/134372683.db2.gz DMLCWVVDWDAWLE-STQMWFEESA-N 1 2 237.347 2.093 20 0 BEADLO C[C@H]([NH2+]Cc1ccsc1)c1nnc2n1CCC2 ZINC000035255286 383845684 /nfs/dbraw/zinc/84/56/84/383845684.db2.gz RYARXKSZNYAPKV-VIFPVBQESA-N 1 2 248.355 2.137 20 0 BEADLO Cc1[nH]ncc1C[NH2+]Cc1ccc(F)cc1 ZINC000035273936 383846719 /nfs/dbraw/zinc/84/67/19/383846719.db2.gz CWJCNLUWEOTMQJ-UHFFFAOYSA-N 1 2 219.263 2.147 20 0 BEADLO Cc1csc(C[N@@H+]2CCS[C@H](C)C2)n1 ZINC000088595517 383914214 /nfs/dbraw/zinc/91/42/14/383914214.db2.gz IUYZTACIVCBPPU-SECBINFHSA-N 1 2 228.386 2.389 20 0 BEADLO Cc1csc(C[N@H+]2CCS[C@H](C)C2)n1 ZINC000088595517 383914221 /nfs/dbraw/zinc/91/42/21/383914221.db2.gz IUYZTACIVCBPPU-SECBINFHSA-N 1 2 228.386 2.389 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2ccn(C)n2)o1 ZINC000112338867 383916868 /nfs/dbraw/zinc/91/68/68/383916868.db2.gz PSSSDIOLPSZMFX-SNVBAGLBSA-N 1 2 219.288 2.172 20 0 BEADLO C[C@@H](NC(=O)/C=C/c1[nH]cc[nH+]1)C1CCCC1 ZINC000493510198 533020418 /nfs/dbraw/zinc/02/04/18/533020418.db2.gz GQUHTMIBQWOWDT-VQCYPWCPSA-N 1 2 233.315 2.118 20 0 BEADLO Fc1ccc(CN2CCC[C@H]2c2[nH]cc[nH+]2)cn1 ZINC000375355540 383890095 /nfs/dbraw/zinc/89/00/95/383890095.db2.gz JSBYPTGODCJYGG-NSHDSACASA-N 1 2 246.289 2.281 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1c1nc[nH+]c(N)c1Cl ZINC000234079961 383904883 /nfs/dbraw/zinc/90/48/83/383904883.db2.gz RMFLBDXBXMQVEK-SFYZADRCSA-N 1 2 240.738 2.480 20 0 BEADLO C[C@@H]1CSC[C@@H]1[NH2+]Cc1nnsc1Cl ZINC000306438482 383981933 /nfs/dbraw/zinc/98/19/33/383981933.db2.gz GKZJCFLPNOTJGV-VDTYLAMSSA-N 1 2 249.792 2.033 20 0 BEADLO C[C@H]1CSC[C@H]1[NH2+]Cc1nnsc1Cl ZINC000306438475 383982959 /nfs/dbraw/zinc/98/29/59/383982959.db2.gz GKZJCFLPNOTJGV-CAHLUQPWSA-N 1 2 249.792 2.033 20 0 BEADLO C[C@@H]([NH2+]Cc1nccs1)c1nccs1 ZINC000070650439 383951973 /nfs/dbraw/zinc/95/19/73/383951973.db2.gz FOCQVHCMPXBZON-SSDOTTSWSA-N 1 2 225.342 2.450 20 0 BEADLO Cc1csc(C[N@@H+]2CCO[C@@H]3CCC[C@H]32)n1 ZINC000268000102 383952342 /nfs/dbraw/zinc/95/23/42/383952342.db2.gz CQILQUYEOOJKSH-GHMZBOCLSA-N 1 2 238.356 2.205 20 0 BEADLO Cc1csc(C[N@H+]2CCO[C@@H]3CCC[C@H]32)n1 ZINC000268000102 383952348 /nfs/dbraw/zinc/95/23/48/383952348.db2.gz CQILQUYEOOJKSH-GHMZBOCLSA-N 1 2 238.356 2.205 20 0 BEADLO Fc1ccc(C[N@@H+]2CCOCC23CC3)cc1 ZINC000334304776 383973482 /nfs/dbraw/zinc/97/34/82/383973482.db2.gz GEPGAHPSADCLHW-UHFFFAOYSA-N 1 2 221.275 2.191 20 0 BEADLO Fc1ccc(C[N@H+]2CCOCC23CC3)cc1 ZINC000334304776 383973488 /nfs/dbraw/zinc/97/34/88/383973488.db2.gz GEPGAHPSADCLHW-UHFFFAOYSA-N 1 2 221.275 2.191 20 0 BEADLO COc1ccc(C[N@@H+]2CCO[C@H](C)C2)c(F)c1 ZINC000516776206 383976337 /nfs/dbraw/zinc/97/63/37/383976337.db2.gz UWOGGCXCMTURKA-SNVBAGLBSA-N 1 2 239.290 2.055 20 0 BEADLO COc1ccc(C[N@H+]2CCO[C@H](C)C2)c(F)c1 ZINC000516776206 383976343 /nfs/dbraw/zinc/97/63/43/383976343.db2.gz UWOGGCXCMTURKA-SNVBAGLBSA-N 1 2 239.290 2.055 20 0 BEADLO Cc1csc(C[N@@H+]2CCOC[C@@H]2C2CC2)n1 ZINC000090009963 384021638 /nfs/dbraw/zinc/02/16/38/384021638.db2.gz GEMUZRBXUOQFKI-LLVKDONJSA-N 1 2 238.356 2.062 20 0 BEADLO Cc1csc(C[N@H+]2CCOC[C@@H]2C2CC2)n1 ZINC000090009963 384021643 /nfs/dbraw/zinc/02/16/43/384021643.db2.gz GEMUZRBXUOQFKI-LLVKDONJSA-N 1 2 238.356 2.062 20 0 BEADLO CN(CC1CCCC1)c1nc[nH+]c(N)c1Cl ZINC000234257742 384004528 /nfs/dbraw/zinc/00/45/28/384004528.db2.gz VISUSMRDYUJRHT-UHFFFAOYSA-N 1 2 240.738 2.339 20 0 BEADLO CN(CC1CCCC1)c1[nH+]cnc(N)c1Cl ZINC000234257742 384004533 /nfs/dbraw/zinc/00/45/33/384004533.db2.gz VISUSMRDYUJRHT-UHFFFAOYSA-N 1 2 240.738 2.339 20 0 BEADLO Cc1ccsc1[C@H](C)[NH2+]Cc1ncn(C)n1 ZINC000090970075 384086239 /nfs/dbraw/zinc/08/62/39/384086239.db2.gz DQTPQGZBDWJSQD-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO Cc1cccn2c(CNC(CF)CF)c[nH+]c12 ZINC000449380405 384089486 /nfs/dbraw/zinc/08/94/86/384089486.db2.gz MUXQFNYXGPTUHN-UHFFFAOYSA-N 1 2 239.269 2.040 20 0 BEADLO CC[C@H](C[N@@H+]1CCOC[C@H]1c1ccco1)OC ZINC000642687306 384066352 /nfs/dbraw/zinc/06/63/52/384066352.db2.gz GIFMUKZTALCGQS-NEPJUHHUSA-N 1 2 239.315 2.078 20 0 BEADLO CC[C@H](C[N@H+]1CCOC[C@H]1c1ccco1)OC ZINC000642687306 384066357 /nfs/dbraw/zinc/06/63/57/384066357.db2.gz GIFMUKZTALCGQS-NEPJUHHUSA-N 1 2 239.315 2.078 20 0 BEADLO CCCCC(=O)NCCCNc1cccc[nH+]1 ZINC000115162304 384070660 /nfs/dbraw/zinc/07/06/60/384070660.db2.gz ANZZFMPBVADQJQ-UHFFFAOYSA-N 1 2 235.331 2.190 20 0 BEADLO CC(C)(C)C(=O)NCCCNc1cccc[nH+]1 ZINC000115159707 384071837 /nfs/dbraw/zinc/07/18/37/384071837.db2.gz AUXIGOZEUQUYNA-UHFFFAOYSA-N 1 2 235.331 2.046 20 0 BEADLO C[C@@H](Nc1[nH+]cnc2c1cnn2C)C1CCCC1 ZINC000070307342 384099300 /nfs/dbraw/zinc/09/93/00/384099300.db2.gz KGCPGBCLSRRWTK-SECBINFHSA-N 1 2 245.330 2.354 20 0 BEADLO Cc1csc(C[N@@H+]2CCOC(C)(C)[C@H]2C)n1 ZINC000336552632 384114669 /nfs/dbraw/zinc/11/46/69/384114669.db2.gz LOIYQIIYFFNIRK-SNVBAGLBSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1csc(C[N@H+]2CCOC(C)(C)[C@H]2C)n1 ZINC000336552632 384114674 /nfs/dbraw/zinc/11/46/74/384114674.db2.gz LOIYQIIYFFNIRK-SNVBAGLBSA-N 1 2 240.372 2.451 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1nccs1)c1cnn(C)c1 ZINC000070717603 384133374 /nfs/dbraw/zinc/13/33/74/384133374.db2.gz TXUNOSWWKROIHV-BDAKNGLRSA-N 1 2 236.344 2.288 20 0 BEADLO CCOC(=O)c1coc(C[N@@H+]2CC[C@@H](F)C2)c1 ZINC000449390305 384147095 /nfs/dbraw/zinc/14/70/95/384147095.db2.gz GFNGYKHGZGGJJA-SNVBAGLBSA-N 1 2 241.262 2.000 20 0 BEADLO CCOC(=O)c1coc(C[N@H+]2CC[C@@H](F)C2)c1 ZINC000449390305 384147096 /nfs/dbraw/zinc/14/70/96/384147096.db2.gz GFNGYKHGZGGJJA-SNVBAGLBSA-N 1 2 241.262 2.000 20 0 BEADLO Cn1cc(C[N@@H+]2CCc3cc(F)ccc3C2)cn1 ZINC000091890568 384151901 /nfs/dbraw/zinc/15/19/01/384151901.db2.gz OGNGFIBKJORANL-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1cc(C[N@H+]2CCc3cc(F)ccc3C2)cn1 ZINC000091890568 384151903 /nfs/dbraw/zinc/15/19/03/384151903.db2.gz OGNGFIBKJORANL-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO CC(C)SCC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000565996397 384175882 /nfs/dbraw/zinc/17/58/82/384175882.db2.gz TXWVQOCTFLATNV-UHFFFAOYSA-N 1 2 249.339 2.414 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CC[C@@H](C)CC1)c1[nH]cc[nH+]1 ZINC000517391339 384163103 /nfs/dbraw/zinc/16/31/03/384163103.db2.gz QJOJBKGYNNTVDA-GMTAPVOTSA-N 1 2 235.331 2.413 20 0 BEADLO CCN(CC)CC[NH2+][C@H](C)c1ccc(F)cn1 ZINC000092195081 384167046 /nfs/dbraw/zinc/16/70/46/384167046.db2.gz VUCAPDKEVQDQHK-LLVKDONJSA-N 1 2 239.338 2.213 20 0 BEADLO CC[C@H](C[N@@H+]1CCC[C@H]1C(F)F)OC ZINC000642699294 384201084 /nfs/dbraw/zinc/20/10/84/384201084.db2.gz PHJACUMQMLMDEC-BDAKNGLRSA-N 1 2 207.264 2.141 20 0 BEADLO CC[C@H](C[N@H+]1CCC[C@H]1C(F)F)OC ZINC000642699294 384201090 /nfs/dbraw/zinc/20/10/90/384201090.db2.gz PHJACUMQMLMDEC-BDAKNGLRSA-N 1 2 207.264 2.141 20 0 BEADLO CCN(CC(C)(C)O)c1[nH]c2ccccc2[nH+]1 ZINC000092970408 384203207 /nfs/dbraw/zinc/20/32/07/384203207.db2.gz BQPIPWXOFRGDHS-UHFFFAOYSA-N 1 2 233.315 2.160 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cc[nH]n2)s1 ZINC000093049468 384206257 /nfs/dbraw/zinc/20/62/57/384206257.db2.gz ZCFFHTVEEITTFL-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cc[nH]n2)s1 ZINC000093049468 384206263 /nfs/dbraw/zinc/20/62/63/384206263.db2.gz ZCFFHTVEEITTFL-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1csc(C[N@H+](C)C[C@@H]2CCCCO2)n1 ZINC000118403341 384199417 /nfs/dbraw/zinc/19/94/17/384199417.db2.gz UXWBAKWQZGDSDL-NSHDSACASA-N 1 2 240.372 2.452 20 0 BEADLO Cc1csc(C[N@@H+](C)C[C@@H]2CCCCO2)n1 ZINC000118403341 384199423 /nfs/dbraw/zinc/19/94/23/384199423.db2.gz UXWBAKWQZGDSDL-NSHDSACASA-N 1 2 240.372 2.452 20 0 BEADLO Cc1csc(C[N@H+](C)C[C@H]2CCCCO2)n1 ZINC000118403342 384199876 /nfs/dbraw/zinc/19/98/76/384199876.db2.gz UXWBAKWQZGDSDL-LLVKDONJSA-N 1 2 240.372 2.452 20 0 BEADLO Cc1csc(C[N@@H+](C)C[C@H]2CCCCO2)n1 ZINC000118403342 384199880 /nfs/dbraw/zinc/19/98/80/384199880.db2.gz UXWBAKWQZGDSDL-LLVKDONJSA-N 1 2 240.372 2.452 20 0 BEADLO Cc1cc(C[N@H+]2CCS[C@H](C)[C@@H]2C)no1 ZINC000118419169 384200548 /nfs/dbraw/zinc/20/05/48/384200548.db2.gz NLSPRJVZVSDVQU-VHSXEESVSA-N 1 2 226.345 2.309 20 0 BEADLO Cc1cc(C[N@@H+]2CCS[C@H](C)[C@@H]2C)no1 ZINC000118419169 384200550 /nfs/dbraw/zinc/20/05/50/384200550.db2.gz NLSPRJVZVSDVQU-VHSXEESVSA-N 1 2 226.345 2.309 20 0 BEADLO CO[C@@H]1CCCC[C@H]1Nc1cc[nH+]c(C(C)C)n1 ZINC000361137798 384229875 /nfs/dbraw/zinc/22/98/75/384229875.db2.gz AZCCOXOIMBWVJY-VXGBXAGGSA-N 1 2 249.358 2.391 20 0 BEADLO C/C(Cl)=C\C[NH2+][C@H](C)c1nc(C)no1 ZINC000528446548 384239252 /nfs/dbraw/zinc/23/92/52/384239252.db2.gz ATRISZOCLKTIBQ-PTYLAXBQSA-N 1 2 215.684 2.171 20 0 BEADLO Cc1[nH]c(C(=O)NCC(C)(C)C(F)(F)F)c[nH+]1 ZINC000558710290 384256363 /nfs/dbraw/zinc/25/63/63/384256363.db2.gz MOWFLRSNONXNPE-UHFFFAOYSA-N 1 2 249.236 2.036 20 0 BEADLO CSC[C@@H](C)NC(=O)Nc1cc[nH+]c(C)c1 ZINC000119499615 384281097 /nfs/dbraw/zinc/28/10/97/384281097.db2.gz AUJWNYKGRDNWLU-SECBINFHSA-N 1 2 239.344 2.263 20 0 BEADLO CC[C@@H]1CCCN1C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000517748595 384281641 /nfs/dbraw/zinc/28/16/41/384281641.db2.gz NNJMTWMVALDFME-VXGBXAGGSA-N 1 2 235.331 2.235 20 0 BEADLO Cc1nc(C[NH+]2CCSCC2)cs1 ZINC000120475674 384355399 /nfs/dbraw/zinc/35/53/99/384355399.db2.gz WAEJBAXUAUUYOP-UHFFFAOYSA-N 1 2 214.359 2.000 20 0 BEADLO C[C@@H]1C[NH+](Cc2cnns2)C[C@@H](C)C1(F)F ZINC000625652352 384366724 /nfs/dbraw/zinc/36/67/24/384366724.db2.gz IYTGDKRVBXZDSY-HTQZYQBOSA-N 1 2 247.314 2.261 20 0 BEADLO C[C@@H]1C[C@@H](CO)CN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000335571256 384333548 /nfs/dbraw/zinc/33/35/48/384333548.db2.gz ZBQDPLXWWWRZKP-GHMZBOCLSA-N 1 2 245.326 2.018 20 0 BEADLO Fc1ccc(CNc2cccc[nH+]2)nc1 ZINC000335620260 384398316 /nfs/dbraw/zinc/39/83/16/384398316.db2.gz BSBIEFWXGAFHKU-UHFFFAOYSA-N 1 2 203.220 2.228 20 0 BEADLO C[C@H]1SCC[N@H+](Cc2ccon2)[C@H]1C ZINC000077317999 384401293 /nfs/dbraw/zinc/40/12/93/384401293.db2.gz SNTWSEGQJTZTGX-DTWKUNHWSA-N 1 2 212.318 2.000 20 0 BEADLO C[C@H]1SCC[N@@H+](Cc2ccon2)[C@H]1C ZINC000077317999 384401295 /nfs/dbraw/zinc/40/12/95/384401295.db2.gz SNTWSEGQJTZTGX-DTWKUNHWSA-N 1 2 212.318 2.000 20 0 BEADLO C[C@H]([NH2+][C@H]1CCc2ccccc21)c1ncn(C)n1 ZINC000275649273 384406564 /nfs/dbraw/zinc/40/65/64/384406564.db2.gz DKWDQWCCFQCLMN-GWCFXTLKSA-N 1 2 242.326 2.153 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2cccn2C)s1 ZINC000135000552 384406852 /nfs/dbraw/zinc/40/68/52/384406852.db2.gz CPCLDTLUIDOHJA-MRVPVSSYSA-N 1 2 236.344 2.036 20 0 BEADLO C[C@H]([NH2+]Cc1c[nH]cn1)c1ccccc1 ZINC000035776101 384423266 /nfs/dbraw/zinc/42/32/66/384423266.db2.gz RJSGQTHTVWZCDQ-JTQLQIEISA-N 1 2 201.273 2.261 20 0 BEADLO C[C@@H]1CCN(c2nc[nH+]c(N)c2Cl)C[C@@H]1C ZINC000235390490 384376472 /nfs/dbraw/zinc/37/64/72/384376472.db2.gz NXZCTWWDEYLYOR-SFYZADRCSA-N 1 2 240.738 2.195 20 0 BEADLO C[C@@H]1CCN(c2[nH+]cnc(N)c2Cl)C[C@@H]1C ZINC000235390490 384376475 /nfs/dbraw/zinc/37/64/75/384376475.db2.gz NXZCTWWDEYLYOR-SFYZADRCSA-N 1 2 240.738 2.195 20 0 BEADLO C(c1noc(C2CC2)n1)[N@@H+]1CCC[C@H]1C1CC1 ZINC000363386355 384387183 /nfs/dbraw/zinc/38/71/83/384387183.db2.gz NQQHTZUCDYCSDM-NSHDSACASA-N 1 2 233.315 2.321 20 0 BEADLO C(c1noc(C2CC2)n1)[N@H+]1CCC[C@H]1C1CC1 ZINC000363386355 384387192 /nfs/dbraw/zinc/38/71/92/384387192.db2.gz NQQHTZUCDYCSDM-NSHDSACASA-N 1 2 233.315 2.321 20 0 BEADLO CC(C)=CCC[C@H](C)NC(=O)Cn1cc[nH+]c1 ZINC000556671086 384447549 /nfs/dbraw/zinc/44/75/49/384447549.db2.gz FBVPRAZNGLZQBD-LBPRGKRZSA-N 1 2 235.331 2.134 20 0 BEADLO Cc1nc(N2CCc3cc(F)ccc3C2)cc[nH+]1 ZINC000121806472 384438937 /nfs/dbraw/zinc/43/89/37/384438937.db2.gz XFNWGDABIHDRRQ-UHFFFAOYSA-N 1 2 243.285 2.487 20 0 BEADLO CCCC[NH2+][C@H](C(=O)OC)c1ccccc1 ZINC000047979066 384471753 /nfs/dbraw/zinc/47/17/53/384471753.db2.gz FYQPIKBXSWVXMT-LBPRGKRZSA-N 1 2 221.300 2.290 20 0 BEADLO COC(=O)[C@@H]1CCCC[N@@H+]1Cc1occc1C ZINC000122292429 384472258 /nfs/dbraw/zinc/47/22/58/384472258.db2.gz GQRASBIORSXZGW-NSHDSACASA-N 1 2 237.299 2.116 20 0 BEADLO COC(=O)[C@@H]1CCCC[N@H+]1Cc1occc1C ZINC000122292429 384472263 /nfs/dbraw/zinc/47/22/63/384472263.db2.gz GQRASBIORSXZGW-NSHDSACASA-N 1 2 237.299 2.116 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC(C)(C)C(C)C ZINC000556769164 384476271 /nfs/dbraw/zinc/47/62/71/384476271.db2.gz FPDHNQRQYUEBKO-UHFFFAOYSA-N 1 2 235.331 2.368 20 0 BEADLO Cc1cn2cc(NC(=O)[C@@H]3CC34CC4)ccc2[nH+]1 ZINC000335006614 384479056 /nfs/dbraw/zinc/47/90/56/384479056.db2.gz SMYCLQOVZJPLPA-NSHDSACASA-N 1 2 241.294 2.381 20 0 BEADLO Cn1c2ccccc2[nH+]c1N[C@H]1CCCC[C@@H]1O ZINC000079046767 384482482 /nfs/dbraw/zinc/48/24/82/384482482.db2.gz FXYMPIBUTNZUKB-AAEUAGOBSA-N 1 2 245.326 2.289 20 0 BEADLO CCO[C@@H](C)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000097293816 384509511 /nfs/dbraw/zinc/50/95/11/384509511.db2.gz SGIOYOMBBFYBBK-NSHDSACASA-N 1 2 236.315 2.370 20 0 BEADLO CC(C)CC(=O)Nc1nc(C[NH+](C)C)cs1 ZINC000170513068 384510473 /nfs/dbraw/zinc/51/04/73/384510473.db2.gz QEYNGXXYEIQLKQ-UHFFFAOYSA-N 1 2 241.360 2.189 20 0 BEADLO Cc1cc(N2CCC[C@](C)(O)C2)nc(C(C)C)[nH+]1 ZINC000161635652 384511242 /nfs/dbraw/zinc/51/12/42/384511242.db2.gz RTIGVBOSIQOMDX-AWEZNQCLSA-N 1 2 249.358 2.260 20 0 BEADLO Cc1cnc(C[NH2+][C@H](C)c2cnn(C)c2)s1 ZINC000122932211 384523551 /nfs/dbraw/zinc/52/35/51/384523551.db2.gz UXQZILSBDUGNAC-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO CSCC[N@H+](C)Cc1nccn1C(F)F ZINC000097474091 384525796 /nfs/dbraw/zinc/52/57/96/384525796.db2.gz TVWMITZUYVWUQK-UHFFFAOYSA-N 1 2 235.303 2.073 20 0 BEADLO CSCC[N@@H+](C)Cc1nccn1C(F)F ZINC000097474091 384525798 /nfs/dbraw/zinc/52/57/98/384525798.db2.gz TVWMITZUYVWUQK-UHFFFAOYSA-N 1 2 235.303 2.073 20 0 BEADLO COC(C)(C)CNc1cc[nH+]c(C(C)C)n1 ZINC000172777237 384526583 /nfs/dbraw/zinc/52/65/83/384526583.db2.gz SDIVFUNBANJXJS-UHFFFAOYSA-N 1 2 223.320 2.437 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1cccnc1C ZINC000170991139 384544091 /nfs/dbraw/zinc/54/40/91/384544091.db2.gz GZEGCVBCWPFZKE-UHFFFAOYSA-N 1 2 243.266 2.046 20 0 BEADLO CC[C@H](NC(=O)CCCSC)c1[nH]cc[nH+]1 ZINC000354145384 384553744 /nfs/dbraw/zinc/55/37/44/384553744.db2.gz BOVMAOWWICEEAP-VIFPVBQESA-N 1 2 241.360 2.120 20 0 BEADLO Fc1ccc(F)c(NCc2[nH]cc[nH+]2)c1 ZINC000049714512 384556126 /nfs/dbraw/zinc/55/61/26/384556126.db2.gz IWGXRAZNNVGZRA-UHFFFAOYSA-N 1 2 209.199 2.300 20 0 BEADLO COC[C@H]([NH2+]Cc1ccccn1)c1ccc(C)o1 ZINC000080238334 384536846 /nfs/dbraw/zinc/53/68/46/384536846.db2.gz GDEHOQVIPFHYCA-ZDUSSCGKSA-N 1 2 246.310 2.460 20 0 BEADLO COC[C@H]([NH2+]Cc1cccc(O)c1)c1ccco1 ZINC000080240299 384539757 /nfs/dbraw/zinc/53/97/57/384539757.db2.gz ZYAZGBSHYRYWTG-ZDUSSCGKSA-N 1 2 247.294 2.463 20 0 BEADLO c1coc([C@@H]2C[N@H+](Cc3ccncc3)CCO2)c1 ZINC000151341357 384569041 /nfs/dbraw/zinc/56/90/41/384569041.db2.gz GXAYGZJTVNRNOD-AWEZNQCLSA-N 1 2 244.294 2.248 20 0 BEADLO c1coc([C@@H]2C[N@@H+](Cc3ccncc3)CCO2)c1 ZINC000151341357 384569050 /nfs/dbraw/zinc/56/90/50/384569050.db2.gz GXAYGZJTVNRNOD-AWEZNQCLSA-N 1 2 244.294 2.248 20 0 BEADLO C[C@@H]1SCC[N@H+](Cc2cscn2)[C@H]1C ZINC000172451831 384588997 /nfs/dbraw/zinc/58/89/97/384588997.db2.gz NJCJAPUEERXHON-IUCAKERBSA-N 1 2 228.386 2.469 20 0 BEADLO C[C@@H]1SCC[N@@H+](Cc2cscn2)[C@H]1C ZINC000172451831 384589005 /nfs/dbraw/zinc/58/90/05/384589005.db2.gz NJCJAPUEERXHON-IUCAKERBSA-N 1 2 228.386 2.469 20 0 BEADLO Cc1csc(C[N@H+](C)Cc2ccc[nH]2)n1 ZINC000176388109 384619454 /nfs/dbraw/zinc/61/94/54/384619454.db2.gz IBOLQHDPMCXGOL-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1csc(C[N@@H+](C)Cc2ccc[nH]2)n1 ZINC000176388109 384619463 /nfs/dbraw/zinc/61/94/63/384619463.db2.gz IBOLQHDPMCXGOL-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO CC[N@H+](CCO)Cc1csc(C(C)(C)C)n1 ZINC000047878793 384668416 /nfs/dbraw/zinc/66/84/16/384668416.db2.gz NBSVJPMDEMEFJC-UHFFFAOYSA-N 1 2 242.388 2.255 20 0 BEADLO CC[N@@H+](CCO)Cc1csc(C(C)(C)C)n1 ZINC000047878793 384668422 /nfs/dbraw/zinc/66/84/22/384668422.db2.gz NBSVJPMDEMEFJC-UHFFFAOYSA-N 1 2 242.388 2.255 20 0 BEADLO CCCC(=O)N1CC[C@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000124466865 384641158 /nfs/dbraw/zinc/64/11/58/384641158.db2.gz FOFBGLAUZXTVQK-NWDGAFQWSA-N 1 2 235.331 2.093 20 0 BEADLO CCCC(=O)N1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000124467269 384642044 /nfs/dbraw/zinc/64/20/44/384642044.db2.gz FOFBGLAUZXTVQK-RYUDHWBXSA-N 1 2 235.331 2.093 20 0 BEADLO Cc1[nH]c(C(=O)NC2CCCCCC2)c[nH+]1 ZINC000082268167 384657290 /nfs/dbraw/zinc/65/72/90/384657290.db2.gz RDGCUBNLDXTAHX-UHFFFAOYSA-N 1 2 221.304 2.171 20 0 BEADLO Cc1cc(C(=O)C[N@@H+]2CCC23CCC3)c(C)n1C ZINC000531016701 384662214 /nfs/dbraw/zinc/66/22/14/384662214.db2.gz HPKLYHNRMPMTRO-UHFFFAOYSA-N 1 2 246.354 2.453 20 0 BEADLO Cc1cc(C(=O)C[N@H+]2CCC23CCC3)c(C)n1C ZINC000531016701 384662219 /nfs/dbraw/zinc/66/22/19/384662219.db2.gz HPKLYHNRMPMTRO-UHFFFAOYSA-N 1 2 246.354 2.453 20 0 BEADLO CCc1ccccc1C[NH2+]Cc1ccn[nH]1 ZINC000052203025 384723992 /nfs/dbraw/zinc/72/39/92/384723992.db2.gz DCNKGVXPWYLOMP-UHFFFAOYSA-N 1 2 215.300 2.262 20 0 BEADLO C[C@@H](O)C[N@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000051837662 384694651 /nfs/dbraw/zinc/69/46/51/384694651.db2.gz MXPOJZMIRDLZQG-SECBINFHSA-N 1 2 242.388 2.253 20 0 BEADLO C[C@@H](O)C[N@@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000051837662 384694656 /nfs/dbraw/zinc/69/46/56/384694656.db2.gz MXPOJZMIRDLZQG-SECBINFHSA-N 1 2 242.388 2.253 20 0 BEADLO CC(C)(C)n1cc(C[N@@H+]2CCC23CCC3)nn1 ZINC000334698610 384694941 /nfs/dbraw/zinc/69/49/41/384694941.db2.gz LNRTVJPEBJKRBE-UHFFFAOYSA-N 1 2 234.347 2.162 20 0 BEADLO CC(C)(C)n1cc(C[N@H+]2CCC23CCC3)nn1 ZINC000334698610 384694946 /nfs/dbraw/zinc/69/49/46/384694946.db2.gz LNRTVJPEBJKRBE-UHFFFAOYSA-N 1 2 234.347 2.162 20 0 BEADLO C[N@H+](CCCCCn1cccn1)CC(F)F ZINC000104695205 384702553 /nfs/dbraw/zinc/70/25/53/384702553.db2.gz LQSUEGAWRQDALC-UHFFFAOYSA-N 1 2 231.290 2.250 20 0 BEADLO C[N@@H+](CCCCCn1cccn1)CC(F)F ZINC000104695205 384702560 /nfs/dbraw/zinc/70/25/60/384702560.db2.gz LQSUEGAWRQDALC-UHFFFAOYSA-N 1 2 231.290 2.250 20 0 BEADLO CC[N@H+](CCc1ccccc1)Cc1noc(C)n1 ZINC000051924296 384705302 /nfs/dbraw/zinc/70/53/02/384705302.db2.gz VRUPMVMBEPFKBI-UHFFFAOYSA-N 1 2 245.326 2.443 20 0 BEADLO CC[N@@H+](CCc1ccccc1)Cc1noc(C)n1 ZINC000051924296 384705308 /nfs/dbraw/zinc/70/53/08/384705308.db2.gz VRUPMVMBEPFKBI-UHFFFAOYSA-N 1 2 245.326 2.443 20 0 BEADLO CC[C@@H](NC(=O)CCC(C)C)c1[nH]cc[nH+]1 ZINC000125346444 384712668 /nfs/dbraw/zinc/71/26/68/384712668.db2.gz WPOXBVMSSDDDTD-SNVBAGLBSA-N 1 2 223.320 2.413 20 0 BEADLO Cc1cnc([C@H](C)[N@H+](C)CCOCC2CC2)o1 ZINC000357007334 384722271 /nfs/dbraw/zinc/72/22/71/384722271.db2.gz SYFKXRZWTMFZFB-NSHDSACASA-N 1 2 238.331 2.402 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+](C)CCOCC2CC2)o1 ZINC000357007334 384722282 /nfs/dbraw/zinc/72/22/82/384722282.db2.gz SYFKXRZWTMFZFB-NSHDSACASA-N 1 2 238.331 2.402 20 0 BEADLO COc1cc(C[N@H+](C)Cc2ncc[nH]2)ccc1C ZINC000643883142 384729827 /nfs/dbraw/zinc/72/98/27/384729827.db2.gz OHAZAMZJBFGNAJ-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2ncc[nH]2)ccc1C ZINC000643883142 384729834 /nfs/dbraw/zinc/72/98/34/384729834.db2.gz OHAZAMZJBFGNAJ-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1cc(CN(C)Cc2[nH]cc[nH+]2)ccc1C ZINC000643883142 384729844 /nfs/dbraw/zinc/72/98/44/384729844.db2.gz OHAZAMZJBFGNAJ-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COC(=O)C[N@H+](C)Cc1ccc(Cl)cc1C ZINC000185496606 384732026 /nfs/dbraw/zinc/73/20/26/384732026.db2.gz WLZIURORZSSGEK-UHFFFAOYSA-N 1 2 241.718 2.253 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1ccc(Cl)cc1C ZINC000185496606 384732034 /nfs/dbraw/zinc/73/20/34/384732034.db2.gz WLZIURORZSSGEK-UHFFFAOYSA-N 1 2 241.718 2.253 20 0 BEADLO Cc1csc([C@@H](C)[NH2+][C@@H]2CCn3ccnc32)n1 ZINC000335953142 384736918 /nfs/dbraw/zinc/73/69/18/384736918.db2.gz WMLMSVJHBMPZJF-NXEZZACHSA-N 1 2 248.355 2.444 20 0 BEADLO Cc1csc([C@@H](C)N[C@@H]2CCn3cc[nH+]c32)n1 ZINC000335953142 384736926 /nfs/dbraw/zinc/73/69/26/384736926.db2.gz WMLMSVJHBMPZJF-NXEZZACHSA-N 1 2 248.355 2.444 20 0 BEADLO Cc1csc([C@H](C)[NH2+][C@H]2CCn3ccnc32)n1 ZINC000335953143 384737175 /nfs/dbraw/zinc/73/71/75/384737175.db2.gz WMLMSVJHBMPZJF-UWVGGRQHSA-N 1 2 248.355 2.444 20 0 BEADLO Cc1csc([C@H](C)N[C@H]2CCn3cc[nH+]c32)n1 ZINC000335953143 384737183 /nfs/dbraw/zinc/73/71/83/384737183.db2.gz WMLMSVJHBMPZJF-UWVGGRQHSA-N 1 2 248.355 2.444 20 0 BEADLO c1csc(C[NH2+]Cc2cn3ccccc3n2)n1 ZINC000108782621 384737357 /nfs/dbraw/zinc/73/73/57/384737357.db2.gz ANZLRICSKSVZDP-UHFFFAOYSA-N 1 2 244.323 2.081 20 0 BEADLO Cc1ccc(NCc2csnn2)c(C)[nH+]1 ZINC000087151481 384741347 /nfs/dbraw/zinc/74/13/47/384741347.db2.gz QPGQHHVZJMYQTN-UHFFFAOYSA-N 1 2 220.301 2.162 20 0 BEADLO CCS[C@@H]1CCC[C@H]1[NH2+][C@H](CC)C(=O)OC ZINC000300393105 384748081 /nfs/dbraw/zinc/74/80/81/384748081.db2.gz WFFSXXJKKVFDJS-GMTAPVOTSA-N 1 2 245.388 2.202 20 0 BEADLO CC[C@H]([NH2+]Cc1ccc(C)cc1)C(=O)OC ZINC000083351364 384760834 /nfs/dbraw/zinc/76/08/34/384760834.db2.gz VJRIMLFIWXXRAD-LBPRGKRZSA-N 1 2 221.300 2.036 20 0 BEADLO CC[C@H]([NH2+]Cc1cccc(C)c1)C(=O)OC ZINC000083351367 384763593 /nfs/dbraw/zinc/76/35/93/384763593.db2.gz PNQLRDGCQYWEHI-LBPRGKRZSA-N 1 2 221.300 2.036 20 0 BEADLO COC[C@H](C)Nc1ccc([NH+](C)C)cc1 ZINC000053172986 384769874 /nfs/dbraw/zinc/76/98/74/384769874.db2.gz VAQDSTKRFLFUSM-JTQLQIEISA-N 1 2 208.305 2.199 20 0 BEADLO C[C@H](C(=O)N(C)Cc1[nH]cc[nH+]1)C(C)(C)C ZINC000360214372 384770316 /nfs/dbraw/zinc/77/03/16/384770316.db2.gz VWFJCLQACMELMN-SECBINFHSA-N 1 2 223.320 2.050 20 0 BEADLO CCN(CC)c1ccc(N[C@H](C)COC)c[nH+]1 ZINC000053173616 384770635 /nfs/dbraw/zinc/77/06/35/384770635.db2.gz AGOJZSXGHQGSOB-LLVKDONJSA-N 1 2 237.347 2.375 20 0 BEADLO COc1ncccc1C[NH2+]Cc1nc(C)cs1 ZINC000083704681 384792687 /nfs/dbraw/zinc/79/26/87/384792687.db2.gz BCFNYAIOMSKQGE-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO CC[C@@H](C)[C@@H]([NH2+]CCSC(C)C)C(=O)OC ZINC000310036775 384804336 /nfs/dbraw/zinc/80/43/36/384804336.db2.gz UOAUSJHBIFSBEL-GHMZBOCLSA-N 1 2 247.404 2.305 20 0 BEADLO CC[C@@H](C)[C@H]([NH2+]CCSC(C)C)C(=O)OC ZINC000310036776 384804402 /nfs/dbraw/zinc/80/44/02/384804402.db2.gz UOAUSJHBIFSBEL-MNOVXSKESA-N 1 2 247.404 2.305 20 0 BEADLO COC(=O)C[N@H+](C)Cc1cc2ccccc2o1 ZINC000175174213 384875569 /nfs/dbraw/zinc/87/55/69/384875569.db2.gz YEPYHRGCWBFDQM-UHFFFAOYSA-N 1 2 233.267 2.038 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1cc2ccccc2o1 ZINC000175174213 384875573 /nfs/dbraw/zinc/87/55/73/384875573.db2.gz YEPYHRGCWBFDQM-UHFFFAOYSA-N 1 2 233.267 2.038 20 0 BEADLO COC(C)(C)C[C@H](C)Nc1cc(C)[nH+]cn1 ZINC000301479494 384876497 /nfs/dbraw/zinc/87/64/97/384876497.db2.gz YCXJOOAMWCSWLX-JTQLQIEISA-N 1 2 223.320 2.401 20 0 BEADLO CCOc1cc(C[NH2+]CC(F)F)ccc1O ZINC000147345747 384839033 /nfs/dbraw/zinc/83/90/33/384839033.db2.gz MMBPKJIOKXYFEL-UHFFFAOYSA-N 1 2 231.242 2.146 20 0 BEADLO FCCC[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000151842680 384839431 /nfs/dbraw/zinc/83/94/31/384839431.db2.gz LMULYXQONRWRIR-NSHDSACASA-N 1 2 229.320 2.481 20 0 BEADLO FCCC[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000151842680 384839438 /nfs/dbraw/zinc/83/94/38/384839438.db2.gz LMULYXQONRWRIR-NSHDSACASA-N 1 2 229.320 2.481 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)OCCCF ZINC000497189805 384841016 /nfs/dbraw/zinc/84/10/16/384841016.db2.gz JQNABDUNONKTJB-VIFPVBQESA-N 1 2 243.282 2.050 20 0 BEADLO CC(=O)c1cc(C[N@@H+]2CCC=C(C)C2)on1 ZINC000564465139 384860600 /nfs/dbraw/zinc/86/06/00/384860600.db2.gz FOOIUYYNOKRAQN-UHFFFAOYSA-N 1 2 220.272 2.029 20 0 BEADLO CC(=O)c1cc(C[N@H+]2CCC=C(C)C2)on1 ZINC000564465139 384860607 /nfs/dbraw/zinc/86/06/07/384860607.db2.gz FOOIUYYNOKRAQN-UHFFFAOYSA-N 1 2 220.272 2.029 20 0 BEADLO CCC[C@H](C)C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000105337114 384862472 /nfs/dbraw/zinc/86/24/72/384862472.db2.gz SLHXRZVDEWISAP-LBPRGKRZSA-N 1 2 249.358 2.483 20 0 BEADLO CCC[C@@H](O)CNc1cc(C)[nH+]c(C(C)C)n1 ZINC000226231391 384949309 /nfs/dbraw/zinc/94/93/09/384949309.db2.gz LYLUPVRRNRYRPD-LLVKDONJSA-N 1 2 237.347 2.481 20 0 BEADLO CC(C)CC(C)(C)C(=O)NCCc1[nH]cc[nH+]1 ZINC000175397927 384905740 /nfs/dbraw/zinc/90/57/40/384905740.db2.gz WDKRIKFHCTVZJZ-UHFFFAOYSA-N 1 2 237.347 2.141 20 0 BEADLO CC(C)[C@@H](NC(=O)OC1CCC1)c1[nH]cc[nH+]1 ZINC000497243794 384908342 /nfs/dbraw/zinc/90/83/42/384908342.db2.gz NFTULQHXBVPPRZ-SNVBAGLBSA-N 1 2 237.303 2.386 20 0 BEADLO CCO[C@@H]1C[C@H](N(C)c2cc(C)[nH+]cn2)C1(C)C ZINC000156793051 384959303 /nfs/dbraw/zinc/95/93/03/384959303.db2.gz UJCZEFABBOBCDW-NWDGAFQWSA-N 1 2 249.358 2.425 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@H]1CC12CCCC2 ZINC000565752269 384924261 /nfs/dbraw/zinc/92/42/61/384924261.db2.gz DKGWLKJAAUIHHN-GFCCVEGCSA-N 1 2 245.326 2.266 20 0 BEADLO COC(=O)C(C)(C)[NH2+]CCc1cccc(C)c1 ZINC000258680130 384932350 /nfs/dbraw/zinc/93/23/50/384932350.db2.gz CCADYOGHDMGFIP-UHFFFAOYSA-N 1 2 235.327 2.079 20 0 BEADLO Cn1c[nH+]cc1CNc1cccc(OCCF)c1 ZINC000152096537 384941176 /nfs/dbraw/zinc/94/11/76/384941176.db2.gz WFTQJANUXQXEAM-UHFFFAOYSA-N 1 2 249.289 2.381 20 0 BEADLO CCc1[nH]c(CNC(=O)C=C2CCCCC2)c[nH+]1 ZINC001645212113 1172643098 /nfs/dbraw/zinc/64/30/98/1172643098.db2.gz DJQCFPDNFRJCQS-UHFFFAOYSA-N 1 2 247.342 2.479 20 0 BEADLO CCc1[nH]cc(CNC(=O)C=C2CCCCC2)[nH+]1 ZINC001645212113 1172643102 /nfs/dbraw/zinc/64/31/02/1172643102.db2.gz DJQCFPDNFRJCQS-UHFFFAOYSA-N 1 2 247.342 2.479 20 0 BEADLO CCC(F)(F)C[NH2+][C@@H](CO)c1ccccc1 ZINC000624147716 384964925 /nfs/dbraw/zinc/96/49/25/384964925.db2.gz IZOPITOYXHSPKI-NSHDSACASA-N 1 2 229.270 2.355 20 0 BEADLO Cc1nn(C)c(C)c1CNc1ccc(C)[nH+]c1 ZINC000128029892 384983462 /nfs/dbraw/zinc/98/34/62/384983462.db2.gz CXCFRYDDIPOKAO-UHFFFAOYSA-N 1 2 230.315 2.352 20 0 BEADLO Cc1csc(C(=O)N[C@@H](C)Cn2cc[nH+]c2)c1 ZINC000293822026 384985216 /nfs/dbraw/zinc/98/52/16/384985216.db2.gz ZOABRPVVLJMUKA-JTQLQIEISA-N 1 2 249.339 2.072 20 0 BEADLO CC[C@H]([NH2+]c1ccc(OCC(N)=O)cc1)C1CC1 ZINC000086117589 384987392 /nfs/dbraw/zinc/98/73/92/384987392.db2.gz CHXRUCHAQRYRGD-ZDUSSCGKSA-N 1 2 248.326 2.151 20 0 BEADLO CC(C)c1nc(NCCOC(C)(C)C)cc[nH+]1 ZINC000518367118 384990324 /nfs/dbraw/zinc/99/03/24/384990324.db2.gz ABIVEKDAZJDZQU-UHFFFAOYSA-N 1 2 237.347 2.249 20 0 BEADLO c1ccc(N[C@@H]2C[C@H]3OCCC[C@H]23)[nH+]c1 ZINC000302441873 384993089 /nfs/dbraw/zinc/99/30/89/384993089.db2.gz NFZQQCQQPNMXBT-GMTAPVOTSA-N 1 2 204.273 2.061 20 0 BEADLO COCCc1ccccc1NCc1[nH+]ccn1C ZINC000188049402 385006221 /nfs/dbraw/zinc/00/62/21/385006221.db2.gz DNDVHMVVFVSAGN-UHFFFAOYSA-N 1 2 245.326 2.221 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccns2)s1 ZINC000404469794 385013698 /nfs/dbraw/zinc/01/36/98/385013698.db2.gz XUXNFIHPFMQJOV-ZCFIWIBFSA-N 1 2 240.357 2.154 20 0 BEADLO CO[C@H](C)[C@H](C)Nc1cc[nH+]c(C(C)C)n1 ZINC000302723682 385015624 /nfs/dbraw/zinc/01/56/24/385015624.db2.gz QRQMUROLCKNILE-VHSXEESVSA-N 1 2 223.320 2.435 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)CC[C@H]1CCCO1 ZINC000107294004 384961613 /nfs/dbraw/zinc/96/16/13/384961613.db2.gz LKVONAXSYBJKFN-LLVKDONJSA-N 1 2 234.299 2.288 20 0 BEADLO CS[C@H](C)C(=O)Nc1cc[nH+]cc1C ZINC000107291706 384962957 /nfs/dbraw/zinc/96/29/57/384962957.db2.gz AWYQZKXMWINTHG-MRVPVSSYSA-N 1 2 210.302 2.080 20 0 BEADLO CSCCNc1nc(C)[nH+]c2c1CCCC2 ZINC000302063598 384963791 /nfs/dbraw/zinc/96/37/91/384963791.db2.gz UXWUNTTTXNFOCZ-UHFFFAOYSA-N 1 2 237.372 2.439 20 0 BEADLO Cc1cc[nH+]c(N[C@H](C)CCO)c1Cl ZINC000306535337 385059507 /nfs/dbraw/zinc/05/95/07/385059507.db2.gz JSNAAUAKKDIQRU-MRVPVSSYSA-N 1 2 214.696 2.226 20 0 BEADLO CC[NH+](CC)Cc1c(Br)cnn1C ZINC000279166891 385064820 /nfs/dbraw/zinc/06/48/20/385064820.db2.gz BYHSCHHBKXQQTD-UHFFFAOYSA-N 1 2 246.152 2.024 20 0 BEADLO Cc1csc(C[N@H+]2CCSC[C@H]2C)n1 ZINC000176379735 385077434 /nfs/dbraw/zinc/07/74/34/385077434.db2.gz OAQCJERRQJHRDR-SECBINFHSA-N 1 2 228.386 2.389 20 0 BEADLO Cc1csc(C[N@@H+]2CCSC[C@H]2C)n1 ZINC000176379735 385077438 /nfs/dbraw/zinc/07/74/38/385077438.db2.gz OAQCJERRQJHRDR-SECBINFHSA-N 1 2 228.386 2.389 20 0 BEADLO CCOC(=O)C[N@H+](C)CC(C)(C)c1ccccc1 ZINC000179672922 385024932 /nfs/dbraw/zinc/02/49/32/385024932.db2.gz NBQSMKAIDBMBAM-UHFFFAOYSA-N 1 2 249.354 2.459 20 0 BEADLO CCOC(=O)C[N@@H+](C)CC(C)(C)c1ccccc1 ZINC000179672922 385024943 /nfs/dbraw/zinc/02/49/43/385024943.db2.gz NBQSMKAIDBMBAM-UHFFFAOYSA-N 1 2 249.354 2.459 20 0 BEADLO Cc1ccc(NC(=O)CCOC(C)C)c(C)[nH+]1 ZINC000176188247 385034477 /nfs/dbraw/zinc/03/44/77/385034477.db2.gz NTZGTKRSKBNJEU-UHFFFAOYSA-N 1 2 236.315 2.452 20 0 BEADLO CC1(C)C[N@H+](Cc2cccc(F)c2N)CCO1 ZINC000156345676 385034934 /nfs/dbraw/zinc/03/49/34/385034934.db2.gz SQRNGKAMBHVTFW-UHFFFAOYSA-N 1 2 238.306 2.019 20 0 BEADLO CC1(C)C[N@@H+](Cc2cccc(F)c2N)CCO1 ZINC000156345676 385034943 /nfs/dbraw/zinc/03/49/43/385034943.db2.gz SQRNGKAMBHVTFW-UHFFFAOYSA-N 1 2 238.306 2.019 20 0 BEADLO CCO[C@@H]1C[C@@H]1C(=O)Nc1ccc(C)[nH+]c1C ZINC000176208762 385039874 /nfs/dbraw/zinc/03/98/74/385039874.db2.gz ZIBLHXDRCBREDI-CMPLNLGQSA-N 1 2 234.299 2.062 20 0 BEADLO FC(F)C[N@@H+]1CCSC[C@H]1C1CCC1 ZINC000642725835 385040485 /nfs/dbraw/zinc/04/04/85/385040485.db2.gz KROWHBUNCOCVAY-VIFPVBQESA-N 1 2 221.316 2.469 20 0 BEADLO FC(F)C[N@H+]1CCSC[C@H]1C1CCC1 ZINC000642725835 385040492 /nfs/dbraw/zinc/04/04/92/385040492.db2.gz KROWHBUNCOCVAY-VIFPVBQESA-N 1 2 221.316 2.469 20 0 BEADLO CC[C@H](SC)C(=O)Nc1c[nH+]ccc1OC ZINC000128561966 385047127 /nfs/dbraw/zinc/04/71/27/385047127.db2.gz MYXHWUHMVOYRMG-JTQLQIEISA-N 1 2 240.328 2.170 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1cc(F)ccc1C ZINC000129167416 385115755 /nfs/dbraw/zinc/11/57/55/385115755.db2.gz WKBAIFUYKRUKKR-UHFFFAOYSA-N 1 2 239.290 2.129 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1cc(F)ccc1C ZINC000129167416 385115759 /nfs/dbraw/zinc/11/57/59/385115759.db2.gz WKBAIFUYKRUKKR-UHFFFAOYSA-N 1 2 239.290 2.129 20 0 BEADLO CCC[C@@H]([NH2+][C@H](CC)CSC)C(=O)OCC ZINC000162120883 385119032 /nfs/dbraw/zinc/11/90/32/385119032.db2.gz YYOUGBHESUAPDW-GHMZBOCLSA-N 1 2 247.404 2.449 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)[C@H]2C[C@H]2C(C)C)[nH+]1 ZINC000516657464 385123825 /nfs/dbraw/zinc/12/38/25/385123825.db2.gz ZOYVMRCKPDZZBE-QWRGUYRKSA-N 1 2 249.358 2.362 20 0 BEADLO CCC[C@H]([NH2+][C@H]1C[C@@H]1C1CC1)C(=O)OCC ZINC000310039318 385130406 /nfs/dbraw/zinc/13/04/06/385130406.db2.gz WXKAQBLLINZEQI-WOPDTQHZSA-N 1 2 225.332 2.106 20 0 BEADLO CCC[C@@](C)([NH2+]CCSCC)C(=O)OC ZINC000119648452 385134801 /nfs/dbraw/zinc/13/48/01/385134801.db2.gz WINGFAKOJFZWSF-LLVKDONJSA-N 1 2 233.377 2.061 20 0 BEADLO c1ccc2c(C[NH2+][C@H]3CC34CC4)n[nH]c2c1 ZINC000643800119 385086639 /nfs/dbraw/zinc/08/66/39/385086639.db2.gz XMSQFAIBFRQMMZ-LBPRGKRZSA-N 1 2 213.284 2.205 20 0 BEADLO CC[C@H]1CN(c2cc(C)[nH+]c(C(C)C)n2)C[C@@H]1O ZINC000340574606 385091110 /nfs/dbraw/zinc/09/11/10/385091110.db2.gz PCOSISAITVMFAO-RYUDHWBXSA-N 1 2 249.358 2.116 20 0 BEADLO CC[C@H]([NH2+]Cc1c[nH]nn1)c1ccc(C)cc1 ZINC000398340516 385098641 /nfs/dbraw/zinc/09/86/41/385098641.db2.gz DBGBEXDHHPBAEG-ZDUSSCGKSA-N 1 2 230.315 2.354 20 0 BEADLO CC[C@H]([NH2+]Cc1cn[nH]n1)c1ccc(C)cc1 ZINC000398340516 385098651 /nfs/dbraw/zinc/09/86/51/385098651.db2.gz DBGBEXDHHPBAEG-ZDUSSCGKSA-N 1 2 230.315 2.354 20 0 BEADLO Cn1c[nH+]cc1CCC(=O)NCC1(C)CCCC1 ZINC000188963863 385106602 /nfs/dbraw/zinc/10/66/02/385106602.db2.gz UMZALZWZARNDSJ-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO Cc1csc([C@@H]2COCC[N@H+]2CC(C)C)n1 ZINC000189301132 385143101 /nfs/dbraw/zinc/14/31/01/385143101.db2.gz WAMDURBZBYIZFA-NSHDSACASA-N 1 2 240.372 2.481 20 0 BEADLO Cc1csc([C@@H]2COCC[N@@H+]2CC(C)C)n1 ZINC000189301132 385143107 /nfs/dbraw/zinc/14/31/07/385143107.db2.gz WAMDURBZBYIZFA-NSHDSACASA-N 1 2 240.372 2.481 20 0 BEADLO CCC[N@H+](Cc1ncnn1C)Cc1ccccc1 ZINC000157363454 385151212 /nfs/dbraw/zinc/15/12/12/385151212.db2.gz UTJYWFWOFKUISX-UHFFFAOYSA-N 1 2 244.342 2.227 20 0 BEADLO CCC[N@@H+](Cc1ncnn1C)Cc1ccccc1 ZINC000157363454 385151219 /nfs/dbraw/zinc/15/12/19/385151219.db2.gz UTJYWFWOFKUISX-UHFFFAOYSA-N 1 2 244.342 2.227 20 0 BEADLO Cc1cnccc1CNc1ccc(N(C)C)[nH+]c1 ZINC000294734061 385152785 /nfs/dbraw/zinc/15/27/85/385152785.db2.gz JGNCYIBACLPPBA-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO COC[C@@H](Nc1cc[nH+]c(C2CC2)n1)C1CC1 ZINC000129486909 385155199 /nfs/dbraw/zinc/15/51/99/385155199.db2.gz IJVPZBSJRRKZBI-LLVKDONJSA-N 1 2 233.315 2.191 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2cncc(C)c2)CCO1 ZINC000189975163 385200955 /nfs/dbraw/zinc/20/09/55/385200955.db2.gz WOYASKXGBRKERK-AWEZNQCLSA-N 1 2 234.343 2.391 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2cncc(C)c2)CCO1 ZINC000189975163 385200965 /nfs/dbraw/zinc/20/09/65/385200965.db2.gz WOYASKXGBRKERK-AWEZNQCLSA-N 1 2 234.343 2.391 20 0 BEADLO CN(CC1CC1)c1cc(N2CCCCC2)nc[nH+]1 ZINC000110242916 385223823 /nfs/dbraw/zinc/22/38/23/385223823.db2.gz ZNRRBRHVVCGCGR-UHFFFAOYSA-N 1 2 246.358 2.313 20 0 BEADLO CN(CC1CC1)c1cc(N2CCCCC2)[nH+]cn1 ZINC000110242916 385223827 /nfs/dbraw/zinc/22/38/27/385223827.db2.gz ZNRRBRHVVCGCGR-UHFFFAOYSA-N 1 2 246.358 2.313 20 0 BEADLO CC(=O)CC[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000157600863 385228612 /nfs/dbraw/zinc/22/86/12/385228612.db2.gz WSTCSDFKCWBGOE-LLVKDONJSA-N 1 2 239.340 2.101 20 0 BEADLO CC(=O)CC[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000157600863 385228620 /nfs/dbraw/zinc/22/86/20/385228620.db2.gz WSTCSDFKCWBGOE-LLVKDONJSA-N 1 2 239.340 2.101 20 0 BEADLO CC1=CCC[C@H](C)[C@H]1C[N@H+]1CC(=O)N(C2CC2)C1 ZINC000448262918 385230010 /nfs/dbraw/zinc/23/00/10/385230010.db2.gz GNARJJWVKJRZHI-JSGCOSHPSA-N 1 2 248.370 2.243 20 0 BEADLO CC1=CCC[C@H](C)[C@H]1C[N@@H+]1CC(=O)N(C2CC2)C1 ZINC000448262918 385230014 /nfs/dbraw/zinc/23/00/14/385230014.db2.gz GNARJJWVKJRZHI-JSGCOSHPSA-N 1 2 248.370 2.243 20 0 BEADLO FC(F)(F)[C@@H]([NH2+]C1CCOCC1)C1CC1 ZINC000308865294 385231837 /nfs/dbraw/zinc/23/18/37/385231837.db2.gz FBTHDQDQIFSQOX-VIFPVBQESA-N 1 2 223.238 2.096 20 0 BEADLO COC[C@H]1CC[N@H+](Cc2csc(Cl)n2)C1 ZINC000294823864 385243710 /nfs/dbraw/zinc/24/37/10/385243710.db2.gz AALPQVXYYFBHRA-QMMMGPOBSA-N 1 2 246.763 2.265 20 0 BEADLO COC[C@H]1CC[N@@H+](Cc2csc(Cl)n2)C1 ZINC000294823864 385243717 /nfs/dbraw/zinc/24/37/17/385243717.db2.gz AALPQVXYYFBHRA-QMMMGPOBSA-N 1 2 246.763 2.265 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@H](C)[C@@H](C)c1ccccc1 ZINC000177481243 385249913 /nfs/dbraw/zinc/24/99/13/385249913.db2.gz GLWJGVMAWUBBFY-UTUOFQBUSA-N 1 2 235.327 2.330 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@H](C)[C@H](C)c1ccccc1 ZINC000177481261 385250468 /nfs/dbraw/zinc/25/04/68/385250468.db2.gz GLWJGVMAWUBBFY-TUAOUCFPSA-N 1 2 235.327 2.330 20 0 BEADLO C[C@@H]1CCCC[C@H]1C[N@H+]1CC(=O)N(C2CC2)C1 ZINC000448283062 385302530 /nfs/dbraw/zinc/30/25/30/385302530.db2.gz WXGQMLWNZYPMDD-NEPJUHHUSA-N 1 2 236.359 2.077 20 0 BEADLO C[C@@H]1CCCC[C@H]1C[N@@H+]1CC(=O)N(C2CC2)C1 ZINC000448283062 385302536 /nfs/dbraw/zinc/30/25/36/385302536.db2.gz WXGQMLWNZYPMDD-NEPJUHHUSA-N 1 2 236.359 2.077 20 0 BEADLO C[C@H]1CCCC[C@@H]1C[N@H+]1CC(=O)N(C2CC2)C1 ZINC000448283063 385303197 /nfs/dbraw/zinc/30/31/97/385303197.db2.gz WXGQMLWNZYPMDD-NWDGAFQWSA-N 1 2 236.359 2.077 20 0 BEADLO C[C@H]1CCCC[C@@H]1C[N@@H+]1CC(=O)N(C2CC2)C1 ZINC000448283063 385303202 /nfs/dbraw/zinc/30/32/02/385303202.db2.gz WXGQMLWNZYPMDD-NWDGAFQWSA-N 1 2 236.359 2.077 20 0 BEADLO Fc1cnccc1C[NH+]1CC(CC(F)F)C1 ZINC000425365291 385324002 /nfs/dbraw/zinc/32/40/02/385324002.db2.gz JXFQHDHRSULQMA-UHFFFAOYSA-N 1 2 230.233 2.308 20 0 BEADLO Cc1ccc(N[C@@H](C)c2cnccn2)c[nH+]1 ZINC000154237072 385309557 /nfs/dbraw/zinc/30/95/57/385309557.db2.gz QFBDWPSATDPRDI-JTQLQIEISA-N 1 2 214.272 2.353 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2ccccn2)CCO1 ZINC000131236802 385320980 /nfs/dbraw/zinc/32/09/80/385320980.db2.gz HEFIDKCLAOEYSA-ZDUSSCGKSA-N 1 2 220.316 2.083 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2ccccn2)CCO1 ZINC000131236802 385320984 /nfs/dbraw/zinc/32/09/84/385320984.db2.gz HEFIDKCLAOEYSA-ZDUSSCGKSA-N 1 2 220.316 2.083 20 0 BEADLO C[N@H+](CCc1cccs1)Cc1csnn1 ZINC000131242242 385321680 /nfs/dbraw/zinc/32/16/80/385321680.db2.gz OELJTICZAGWZHU-UHFFFAOYSA-N 1 2 239.369 2.274 20 0 BEADLO C[N@@H+](CCc1cccs1)Cc1csnn1 ZINC000131242242 385321686 /nfs/dbraw/zinc/32/16/86/385321686.db2.gz OELJTICZAGWZHU-UHFFFAOYSA-N 1 2 239.369 2.274 20 0 BEADLO c1cn(CCCSC[C@H]2CCCO2)c[nH+]1 ZINC000191753003 385322208 /nfs/dbraw/zinc/32/22/08/385322208.db2.gz HUSAMQAOSRVFLL-LLVKDONJSA-N 1 2 226.345 2.185 20 0 BEADLO CC[C@@H](C)CC(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000190792999 385262135 /nfs/dbraw/zinc/26/21/35/385262135.db2.gz JCJLMZCTLGRHKQ-GFCCVEGCSA-N 1 2 249.358 2.483 20 0 BEADLO CCCCc1nc(C[N@H+](C)C[C@@H](C)O)cs1 ZINC000131268692 385322699 /nfs/dbraw/zinc/32/26/99/385322699.db2.gz ICJFEQUXYWCTLI-SNVBAGLBSA-N 1 2 242.388 2.298 20 0 BEADLO CCCCc1nc(C[N@@H+](C)C[C@@H](C)O)cs1 ZINC000131268692 385322706 /nfs/dbraw/zinc/32/27/06/385322706.db2.gz ICJFEQUXYWCTLI-SNVBAGLBSA-N 1 2 242.388 2.298 20 0 BEADLO CN(c1cc[nH+]c(C2CC2)n1)[C@@H]1CCSC1 ZINC000153776740 385279213 /nfs/dbraw/zinc/27/92/13/385279213.db2.gz ZJVPESGRBQYXLV-SNVBAGLBSA-N 1 2 235.356 2.296 20 0 BEADLO COC(=O)C[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1 ZINC000191354307 385299255 /nfs/dbraw/zinc/29/92/55/385299255.db2.gz IUZKEDLDHDIWRM-UONOGXRCSA-N 1 2 247.338 2.160 20 0 BEADLO C[C@H](NC(=O)CCc1c[nH+]cn1C)C1CCCC1 ZINC000193265281 385389472 /nfs/dbraw/zinc/38/94/72/385389472.db2.gz XNAXWHHCKUCRFB-NSHDSACASA-N 1 2 249.358 2.048 20 0 BEADLO CC[C@H]([NH2+][C@@H](C)[C@H]1CCOC1)C(F)(F)F ZINC000309026339 385368816 /nfs/dbraw/zinc/36/88/16/385368816.db2.gz ATPHGFRAVARJAG-CIUDSAMLSA-N 1 2 225.254 2.342 20 0 BEADLO CC(C)(O)COc1cccc(-n2cc[nH+]c2)c1 ZINC000155121957 385377371 /nfs/dbraw/zinc/37/73/71/385377371.db2.gz MHYIMTYZEHRLNM-UHFFFAOYSA-N 1 2 232.283 2.022 20 0 BEADLO Cc1cn[nH]c1CNc1[nH+]cccc1C ZINC000289766102 385393358 /nfs/dbraw/zinc/39/33/58/385393358.db2.gz GFAAQCYUZAXNMZ-UHFFFAOYSA-N 1 2 202.261 2.034 20 0 BEADLO CCN(CCO)c1cc[nH+]c2c(OC)cccc12 ZINC000193480337 385398450 /nfs/dbraw/zinc/39/84/50/385398450.db2.gz NCHWDHLTQYJNHY-UHFFFAOYSA-N 1 2 246.310 2.062 20 0 BEADLO CCOC(=O)[C@H]([NH2+]CCSCC)[C@@H](C)CC ZINC000181637612 385412071 /nfs/dbraw/zinc/41/20/71/385412071.db2.gz MPOCJRZFUJYYFE-WDEREUQCSA-N 1 2 247.404 2.307 20 0 BEADLO CC1(C)CCCC[C@H]1C(=O)NCCn1cc[nH+]c1 ZINC000193809855 385413327 /nfs/dbraw/zinc/41/33/27/385413327.db2.gz KOVVLZYCPHDPJG-LBPRGKRZSA-N 1 2 249.358 2.216 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cccc(F)c2N)CCO1 ZINC000156343498 385446291 /nfs/dbraw/zinc/44/62/91/385446291.db2.gz MSVPLVUDTAAZNU-NSHDSACASA-N 1 2 238.306 2.019 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cccc(F)c2N)CCO1 ZINC000156343498 385446293 /nfs/dbraw/zinc/44/62/93/385446293.db2.gz MSVPLVUDTAAZNU-NSHDSACASA-N 1 2 238.306 2.019 20 0 BEADLO C[C@@](O)(C[NH+]1Cc2ccccc2C1)C(F)(F)F ZINC000281869108 385454700 /nfs/dbraw/zinc/45/47/00/385454700.db2.gz CBFQZVBDXPWFSK-LLVKDONJSA-N 1 2 245.244 2.316 20 0 BEADLO CC[C@H]1CN(c2[nH]c3ccccc3[nH+]2)CCO1 ZINC000179281334 385456676 /nfs/dbraw/zinc/45/66/76/385456676.db2.gz GFIGICFNCWDKSW-JTQLQIEISA-N 1 2 231.299 2.178 20 0 BEADLO C[NH+](C)Cc1csc(NC(=O)C(C)(C)C)n1 ZINC000170484495 385430616 /nfs/dbraw/zinc/43/06/16/385430616.db2.gz MQGCRJILPWLOFM-UHFFFAOYSA-N 1 2 241.360 2.189 20 0 BEADLO Cc1cccc(CNC(=O)C=Cc2c[nH]c[nH+]2)c1 ZINC000492908552 385464939 /nfs/dbraw/zinc/46/49/39/385464939.db2.gz GHJNNBXFZJRBLV-AATRIKPKSA-N 1 2 241.294 2.048 20 0 BEADLO C[C@@H](C(=O)N(C)Cc1c[nH+]c[nH]1)c1ccccc1 ZINC000616927881 385487922 /nfs/dbraw/zinc/48/79/22/385487922.db2.gz SFGFSYVQGIUFTD-LLVKDONJSA-N 1 2 243.310 2.172 20 0 BEADLO C[C@@H](C(=O)N(C)Cc1c[nH]c[nH+]1)c1ccccc1 ZINC000616927881 385487925 /nfs/dbraw/zinc/48/79/25/385487925.db2.gz SFGFSYVQGIUFTD-LLVKDONJSA-N 1 2 243.310 2.172 20 0 BEADLO c1snnc1C[N@@H+]1CCCc2ccccc2C1 ZINC000179442805 385467993 /nfs/dbraw/zinc/46/79/93/385467993.db2.gz MILIDDAYFYANDE-UHFFFAOYSA-N 1 2 245.351 2.487 20 0 BEADLO c1snnc1C[N@H+]1CCCc2ccccc2C1 ZINC000179442805 385467998 /nfs/dbraw/zinc/46/79/98/385467998.db2.gz MILIDDAYFYANDE-UHFFFAOYSA-N 1 2 245.351 2.487 20 0 BEADLO COC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccc(C)o1 ZINC000157146091 385488473 /nfs/dbraw/zinc/48/84/73/385488473.db2.gz JJMQCXUQZSFWKB-LBPRGKRZSA-N 1 2 237.299 2.116 20 0 BEADLO COC(=O)[C@@H]1CCCC[N@H+]1Cc1ccc(C)o1 ZINC000157146091 385488476 /nfs/dbraw/zinc/48/84/76/385488476.db2.gz JJMQCXUQZSFWKB-LBPRGKRZSA-N 1 2 237.299 2.116 20 0 BEADLO OCc1cc[nH+]c(N2CCC(C(F)F)CC2)c1 ZINC000307850385 385480333 /nfs/dbraw/zinc/48/03/33/385480333.db2.gz AKADWQLMJZGBCS-UHFFFAOYSA-N 1 2 242.269 2.055 20 0 BEADLO C[C@@H](C1CC1)n1nccc1NCc1[nH]cc[nH+]1 ZINC000171377581 385481768 /nfs/dbraw/zinc/48/17/68/385481768.db2.gz WPZHZOREOWTGGC-VIFPVBQESA-N 1 2 231.303 2.189 20 0 BEADLO COCc1noc(C[NH2+][C@H](C)c2ccccc2)n1 ZINC000180233696 385513077 /nfs/dbraw/zinc/51/30/77/385513077.db2.gz GWCCACBORWTWBP-SNVBAGLBSA-N 1 2 247.298 2.067 20 0 BEADLO Cc1nnsc1CNc1cc2cc[nH]c2c[nH+]1 ZINC000644144159 385530537 /nfs/dbraw/zinc/53/05/37/385530537.db2.gz MBCNYPXEUAWMDU-UHFFFAOYSA-N 1 2 245.311 2.335 20 0 BEADLO Cn1cc[nH+]c1CN1CCc2cccc(F)c2C1 ZINC000158092069 385548061 /nfs/dbraw/zinc/54/80/61/385548061.db2.gz RHFUPPIOYPDHGT-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO O=C(OCC1CC1)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000364815077 385519783 /nfs/dbraw/zinc/51/97/83/385519783.db2.gz VDIGIBTUHYIXQZ-SNVBAGLBSA-N 1 2 235.287 2.093 20 0 BEADLO Cn1cc[nH+]c1CN1CCCC[C@@H]1C(F)F ZINC000334205427 385519837 /nfs/dbraw/zinc/51/98/37/385519837.db2.gz XTVGIZCWFRKISI-SECBINFHSA-N 1 2 229.274 2.040 20 0 BEADLO Cc1cnc(C[N@H+](C)C[C@@H]2CCCO2)s1 ZINC000180439785 385523517 /nfs/dbraw/zinc/52/35/17/385523517.db2.gz RHFULQKCJJXFAP-JTQLQIEISA-N 1 2 226.345 2.062 20 0 BEADLO Cc1cnc(C[N@@H+](C)C[C@@H]2CCCO2)s1 ZINC000180439785 385523521 /nfs/dbraw/zinc/52/35/21/385523521.db2.gz RHFULQKCJJXFAP-JTQLQIEISA-N 1 2 226.345 2.062 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1ccccn1 ZINC000107292114 385561778 /nfs/dbraw/zinc/56/17/78/385561778.db2.gz ZGBGMQAYJNTNRA-UHFFFAOYSA-N 1 2 213.240 2.037 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)Cc1ccccc1O ZINC000107357341 385565480 /nfs/dbraw/zinc/56/54/80/385565480.db2.gz PJZVAWKERFYDEX-UHFFFAOYSA-N 1 2 242.278 2.277 20 0 BEADLO CCc1nnc(COc2cc[nH+]cc2)s1 ZINC000644869626 385596456 /nfs/dbraw/zinc/59/64/56/385596456.db2.gz RKDPJLHNTGKLAS-UHFFFAOYSA-N 1 2 221.285 2.075 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493465698 385578383 /nfs/dbraw/zinc/57/83/83/385578383.db2.gz ZDIVMPFWOHVDBR-UXFRKABBSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ccccn1)c1ccon1 ZINC000309428203 385582094 /nfs/dbraw/zinc/58/20/94/385582094.db2.gz AZSXSNQRBFMWTK-UWVGGRQHSA-N 1 2 217.272 2.481 20 0 BEADLO CO[C@H](C)CCNc1cc[nH+]c(C(C)C)n1 ZINC000309450249 385583608 /nfs/dbraw/zinc/58/36/08/385583608.db2.gz KWULLAMYBUFSPV-SNVBAGLBSA-N 1 2 223.320 2.437 20 0 BEADLO FC(F)O[C@@H]1CCCC[C@H]1[NH2+]Cc1ccn[nH]1 ZINC000337306549 385593143 /nfs/dbraw/zinc/59/31/43/385593143.db2.gz RVXHQVGBGCWYJM-NXEZZACHSA-N 1 2 245.273 2.050 20 0 BEADLO CCCc1noc(C[N@@H+]2CCC=C(C)C2)n1 ZINC000280877930 385615736 /nfs/dbraw/zinc/61/57/36/385615736.db2.gz OXWBPCCDPJHTCK-UHFFFAOYSA-N 1 2 221.304 2.174 20 0 BEADLO CCCc1noc(C[N@H+]2CCC=C(C)C2)n1 ZINC000280877930 385615737 /nfs/dbraw/zinc/61/57/37/385615737.db2.gz OXWBPCCDPJHTCK-UHFFFAOYSA-N 1 2 221.304 2.174 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)NC1CCC(C)(C)CC1 ZINC000281056168 385629786 /nfs/dbraw/zinc/62/97/86/385629786.db2.gz YBIHEZPPUPHRNF-UHFFFAOYSA-N 1 2 249.358 2.346 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@H]3C[C@H]32)s1 ZINC000366562100 385634115 /nfs/dbraw/zinc/63/41/15/385634115.db2.gz VBJMQGBYTCMEJA-MNOVXSKESA-N 1 2 209.314 2.030 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@H]3C[C@H]32)s1 ZINC000366562100 385634116 /nfs/dbraw/zinc/63/41/16/385634116.db2.gz VBJMQGBYTCMEJA-MNOVXSKESA-N 1 2 209.314 2.030 20 0 BEADLO C[C@@H]([NH2+]Cc1ccc(Cl)cn1)c1cnccn1 ZINC000182125346 385634491 /nfs/dbraw/zinc/63/44/91/385634491.db2.gz GHPIBTXKSYXYIY-SECBINFHSA-N 1 2 248.717 2.376 20 0 BEADLO C/C=C(\CC)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000365126084 385607860 /nfs/dbraw/zinc/60/78/60/385607860.db2.gz PQOWDIZHCRXEGG-QQFGACLNSA-N 1 2 247.342 2.403 20 0 BEADLO C[C@H]1CN(c2[nH+]ccc3cc(F)ccc32)C[C@H]1O ZINC000645203962 385639975 /nfs/dbraw/zinc/63/99/75/385639975.db2.gz HCGFGXDBLHOGLI-TVQRCGJNSA-N 1 2 246.285 2.191 20 0 BEADLO C[C@H]1OCC[C@@H]1Sc1[nH+]cnc2[nH]ccc21 ZINC000269905192 385644816 /nfs/dbraw/zinc/64/48/16/385644816.db2.gz GQYRUFLQRIVTSY-APPZFPTMSA-N 1 2 235.312 2.227 20 0 BEADLO Cn1c[nH+]c2c1CCN(Cc1ccc(F)cc1)C2 ZINC000363808672 385647875 /nfs/dbraw/zinc/64/78/75/385647875.db2.gz AXKKMVXSGSVCMG-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1ncc(Cl)c1CNc1cc[nH+]cc1F ZINC000309521439 385658429 /nfs/dbraw/zinc/65/84/29/385658429.db2.gz BMLYCDNABJTFMO-UHFFFAOYSA-N 1 2 240.669 2.220 20 0 BEADLO CCCCCNC(=O)C[N@@H+]1CCC[C@@](C)(F)C1 ZINC000451122422 385659890 /nfs/dbraw/zinc/65/98/90/385659890.db2.gz RIIINDQQPDWGBA-CYBMUJFWSA-N 1 2 244.354 2.117 20 0 BEADLO CCCCCNC(=O)C[N@H+]1CCC[C@@](C)(F)C1 ZINC000451122422 385659894 /nfs/dbraw/zinc/65/98/94/385659894.db2.gz RIIINDQQPDWGBA-CYBMUJFWSA-N 1 2 244.354 2.117 20 0 BEADLO CO[C@@H](C)CN1CC[N@@H+](C)C[C@@H]1c1ccccc1 ZINC000182370120 385662758 /nfs/dbraw/zinc/66/27/58/385662758.db2.gz JSWHLMCOWQJHQG-DZGCQCFKSA-N 1 2 248.370 2.010 20 0 BEADLO COC(=O)c1occc1C[N@H+]1CC=C(C)CC1 ZINC000270129314 385671768 /nfs/dbraw/zinc/67/17/68/385671768.db2.gz GYJKNKDXAZKCJT-UHFFFAOYSA-N 1 2 235.283 2.218 20 0 BEADLO COC(=O)c1occc1C[N@@H+]1CC=C(C)CC1 ZINC000270129314 385671774 /nfs/dbraw/zinc/67/17/74/385671774.db2.gz GYJKNKDXAZKCJT-UHFFFAOYSA-N 1 2 235.283 2.218 20 0 BEADLO Cc1nc(C)c(C[N@@H+](C)Cc2ccncc2)o1 ZINC000647912574 385676097 /nfs/dbraw/zinc/67/60/97/385676097.db2.gz OALFXZLYRPDWRF-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1nc(C)c(C[N@H+](C)Cc2ccncc2)o1 ZINC000647912574 385676101 /nfs/dbraw/zinc/67/61/01/385676101.db2.gz OALFXZLYRPDWRF-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1nc(C)c(C[N@@H+](C)Cc2ccccn2)o1 ZINC000647912693 385678322 /nfs/dbraw/zinc/67/83/22/385678322.db2.gz UVBHWMPPPIEPTF-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1nc(C)c(C[N@H+](C)Cc2ccccn2)o1 ZINC000647912693 385678327 /nfs/dbraw/zinc/67/83/27/385678327.db2.gz UVBHWMPPPIEPTF-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CN(CC1CC1)c1[nH]c2ccccc2[nH+]1 ZINC000270538512 385717338 /nfs/dbraw/zinc/71/73/38/385717338.db2.gz BEYFABVJVJIAJA-UHFFFAOYSA-N 1 2 201.273 2.409 20 0 BEADLO CO[C@H]1CC[N@H+](Cc2csc(C3CC3)n2)C1 ZINC000270340156 385699050 /nfs/dbraw/zinc/69/90/50/385699050.db2.gz OHGVBTNATBFAJF-NSHDSACASA-N 1 2 238.356 2.241 20 0 BEADLO CO[C@H]1CC[N@@H+](Cc2csc(C3CC3)n2)C1 ZINC000270340156 385699052 /nfs/dbraw/zinc/69/90/52/385699052.db2.gz OHGVBTNATBFAJF-NSHDSACASA-N 1 2 238.356 2.241 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1cn(C(C)(C)C)nn1 ZINC000291798399 385715013 /nfs/dbraw/zinc/71/50/13/385715013.db2.gz WWOZVDKAWHGRMP-UHFFFAOYSA-N 1 2 248.330 2.224 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C1SCCS1 ZINC000270546899 385716374 /nfs/dbraw/zinc/71/63/74/385716374.db2.gz ZBYWSGSYAJDDJA-UHFFFAOYSA-N 1 2 240.353 2.135 20 0 BEADLO CCCc1noc(C[N@H+]2CC=C(C)CC2)n1 ZINC000270100182 385670639 /nfs/dbraw/zinc/67/06/39/385670639.db2.gz BQFRPDLATFPXTG-UHFFFAOYSA-N 1 2 221.304 2.174 20 0 BEADLO CCCc1noc(C[N@@H+]2CC=C(C)CC2)n1 ZINC000270100182 385670642 /nfs/dbraw/zinc/67/06/42/385670642.db2.gz BQFRPDLATFPXTG-UHFFFAOYSA-N 1 2 221.304 2.174 20 0 BEADLO Cn1nccc1[C@H]1CCCC[N@@H+]1Cc1ccon1 ZINC000281445070 385671399 /nfs/dbraw/zinc/67/13/99/385671399.db2.gz QGVXVWXZMBKUGX-CYBMUJFWSA-N 1 2 246.314 2.135 20 0 BEADLO Cn1nccc1[C@H]1CCCC[N@H+]1Cc1ccon1 ZINC000281445070 385671407 /nfs/dbraw/zinc/67/14/07/385671407.db2.gz QGVXVWXZMBKUGX-CYBMUJFWSA-N 1 2 246.314 2.135 20 0 BEADLO C[C@H]([NH2+]Cc1ncccn1)c1ccsc1 ZINC000061362732 385737574 /nfs/dbraw/zinc/73/75/74/385737574.db2.gz FJJJNFWAGOEVMV-VIFPVBQESA-N 1 2 219.313 2.389 20 0 BEADLO C[C@H]([NH2+][C@@H]1C[C@@H](C)[C@H]1C)C(=O)OC(C)(C)C ZINC000309608894 385740326 /nfs/dbraw/zinc/74/03/26/385740326.db2.gz ZKKPEVNVFFDLOY-CHWFTXMASA-N 1 2 227.348 2.351 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC[C@@H]1C[C@H]1C ZINC000271108240 385788220 /nfs/dbraw/zinc/78/82/20/385788220.db2.gz FOVQSGBZWBQWHJ-SCZZXKLOSA-N 1 2 219.288 2.168 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@@H+]1Cc1cc(O)cc(F)c1 ZINC000186228515 385749669 /nfs/dbraw/zinc/74/96/69/385749669.db2.gz ZYDWMAAZZAFEGM-ZJUUUORDSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1cc(O)cc(F)c1 ZINC000186228515 385749675 /nfs/dbraw/zinc/74/96/75/385749675.db2.gz ZYDWMAAZZAFEGM-ZJUUUORDSA-N 1 2 239.290 2.141 20 0 BEADLO COC[C@H](C)N(C)c1[nH+]c2ccccc2n1C ZINC000270565728 385719232 /nfs/dbraw/zinc/71/92/32/385719232.db2.gz LJGJQNCEOYKLQM-JTQLQIEISA-N 1 2 233.315 2.044 20 0 BEADLO FC(F)[C@@H]1CCC[N@@H+]1CCO[C@@H]1CCCCO1 ZINC000353197030 385721669 /nfs/dbraw/zinc/72/16/69/385721669.db2.gz VHGRLRAGSPJINW-WDEREUQCSA-N 1 2 249.301 2.259 20 0 BEADLO FC(F)[C@@H]1CCC[N@H+]1CCO[C@@H]1CCCCO1 ZINC000353197030 385721674 /nfs/dbraw/zinc/72/16/74/385721674.db2.gz VHGRLRAGSPJINW-WDEREUQCSA-N 1 2 249.301 2.259 20 0 BEADLO Cc1cc(N2C[C@@H](C)O[C@@H](C)C2)nc(C2CC2)[nH+]1 ZINC000182975568 385724420 /nfs/dbraw/zinc/72/44/20/385724420.db2.gz FMRWFBRASUQZQO-PHIMTYICSA-N 1 2 247.342 2.276 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2cccc(C)c2C)[nH]1 ZINC000271218320 385805472 /nfs/dbraw/zinc/80/54/72/385805472.db2.gz XWWLQNCIIHZKQR-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2cccc(C)c2C)[nH]1 ZINC000271218320 385805478 /nfs/dbraw/zinc/80/54/78/385805478.db2.gz XWWLQNCIIHZKQR-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@H]1CC[C@@H](c2ccccc2)C1 ZINC000271257317 385811084 /nfs/dbraw/zinc/81/10/84/385811084.db2.gz HKZUHFGFKZOVNM-YUTCNCBUSA-N 1 2 247.338 2.474 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@H]1CC[C@H](c2ccccc2)C1 ZINC000271257314 385811218 /nfs/dbraw/zinc/81/12/18/385811218.db2.gz HKZUHFGFKZOVNM-UBHSHLNASA-N 1 2 247.338 2.474 20 0 BEADLO C[C@H]([NH2+]Cc1cnn[nH]1)c1ccc(Cl)cc1 ZINC000283966463 385812593 /nfs/dbraw/zinc/81/25/93/385812593.db2.gz LVBAECNJGFKJKF-QMMMGPOBSA-N 1 2 236.706 2.309 20 0 BEADLO C[C@H]([NH2+]Cc1c[nH]nn1)c1ccc(Cl)cc1 ZINC000283966463 385812597 /nfs/dbraw/zinc/81/25/97/385812597.db2.gz LVBAECNJGFKJKF-QMMMGPOBSA-N 1 2 236.706 2.309 20 0 BEADLO C[C@H]([NH2+]Cc1cn[nH]n1)c1ccc(Cl)cc1 ZINC000283966463 385812601 /nfs/dbraw/zinc/81/26/01/385812601.db2.gz LVBAECNJGFKJKF-QMMMGPOBSA-N 1 2 236.706 2.309 20 0 BEADLO Cn1c[nH+]cc1COc1ccc2c(c1)CCC2=O ZINC000231760937 385820253 /nfs/dbraw/zinc/82/02/53/385820253.db2.gz CFGWBXUMQVOBSB-UHFFFAOYSA-N 1 2 242.278 2.128 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@@H]2CCCC2(C)C)c[nH+]1 ZINC000294219564 385824470 /nfs/dbraw/zinc/82/44/70/385824470.db2.gz QPISDKULDIFXPF-JTQLQIEISA-N 1 2 235.331 2.274 20 0 BEADLO CC[NH+](CC)Cc1c(Cl)ncnc1N(C)C ZINC000283595708 385825137 /nfs/dbraw/zinc/82/51/37/385825137.db2.gz QAPHOXHDGLLVKS-UHFFFAOYSA-N 1 2 242.754 2.038 20 0 BEADLO C[C@@H](F)CC[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000340457307 385836778 /nfs/dbraw/zinc/83/67/78/385836778.db2.gz CPFPOKREWZGBJL-PWSUYJOCSA-N 1 2 248.305 2.232 20 0 BEADLO C[C@@H](F)CC[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000340457308 385836993 /nfs/dbraw/zinc/83/69/93/385836993.db2.gz CPFPOKREWZGBJL-ZYHUDNBSSA-N 1 2 248.305 2.232 20 0 BEADLO c1ccc2[nH+]c(N3CCO[C@H]4CCC[C@@H]43)[nH]c2c1 ZINC000271571080 385837848 /nfs/dbraw/zinc/83/78/48/385837848.db2.gz BTYOZWAZKOODNE-STQMWFEESA-N 1 2 243.310 2.321 20 0 BEADLO COCC1CCN(c2cc[nH+]c(C(C)C)n2)CC1 ZINC000112333661 385840142 /nfs/dbraw/zinc/84/01/42/385840142.db2.gz AOTLYMXNLHLTHY-UHFFFAOYSA-N 1 2 249.358 2.463 20 0 BEADLO CC[C@]1(C)CCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000283922327 385841253 /nfs/dbraw/zinc/84/12/53/385841253.db2.gz KBIFOZUALOYETQ-VBROQKIQSA-N 1 2 247.342 2.462 20 0 BEADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1cc[nH]n1 ZINC000283931846 385841310 /nfs/dbraw/zinc/84/13/10/385841310.db2.gz KPKKCTUAPGTBNY-CYBMUJFWSA-N 1 2 230.315 2.388 20 0 BEADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1cc[nH]n1 ZINC000283931846 385841315 /nfs/dbraw/zinc/84/13/15/385841315.db2.gz KPKKCTUAPGTBNY-CYBMUJFWSA-N 1 2 230.315 2.388 20 0 BEADLO CCC[C@H]1CCC[C@H]1C(=O)NCc1[nH+]ccn1C ZINC000294503171 385858840 /nfs/dbraw/zinc/85/88/40/385858840.db2.gz HCIGBTDEPAZVNV-NWDGAFQWSA-N 1 2 249.358 2.253 20 0 BEADLO CS[C@@H]1CC[N@H+](Cc2ncc(Cl)n2C)C1 ZINC000294453467 385851258 /nfs/dbraw/zinc/85/12/58/385851258.db2.gz SKTMNNJWLMOUAK-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO CS[C@@H]1CC[N@@H+](Cc2ncc(Cl)n2C)C1 ZINC000294453467 385851263 /nfs/dbraw/zinc/85/12/63/385851263.db2.gz SKTMNNJWLMOUAK-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC1CC(C)C1 ZINC000271125401 385789807 /nfs/dbraw/zinc/78/98/07/385789807.db2.gz KTXGPRCHOFROQZ-UHFFFAOYSA-N 1 2 219.288 2.310 20 0 BEADLO FC(F)[C@H]1CCC[N@@H+]1CCc1ccccn1 ZINC000353197986 385796556 /nfs/dbraw/zinc/79/65/56/385796556.db2.gz XNSSGSNEGKWKSZ-LLVKDONJSA-N 1 2 226.270 2.354 20 0 BEADLO FC(F)[C@H]1CCC[N@H+]1CCc1ccccn1 ZINC000353197986 385796561 /nfs/dbraw/zinc/79/65/61/385796561.db2.gz XNSSGSNEGKWKSZ-LLVKDONJSA-N 1 2 226.270 2.354 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ccn(C)n2)s1 ZINC000271179180 385797386 /nfs/dbraw/zinc/79/73/86/385797386.db2.gz XZUHISVJROXATF-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ccn(C)n2)s1 ZINC000271179180 385797393 /nfs/dbraw/zinc/79/73/93/385797393.db2.gz XZUHISVJROXATF-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO C[C@H]1CCCC[C@@H]1Nc1nc[nH+]c2c1OCCN2 ZINC000647845910 385887177 /nfs/dbraw/zinc/88/71/77/385887177.db2.gz FKXIKBJBFCHEGQ-UWVGGRQHSA-N 1 2 248.330 2.272 20 0 BEADLO C[C@H]1CCCC[C@@H]1Nc1[nH+]cnc2c1OCCN2 ZINC000647845910 385887181 /nfs/dbraw/zinc/88/71/81/385887181.db2.gz FKXIKBJBFCHEGQ-UWVGGRQHSA-N 1 2 248.330 2.272 20 0 BEADLO CN(C[C@@H]1CCCC[C@H]1O)c1cccc[nH+]1 ZINC000272253251 385887659 /nfs/dbraw/zinc/88/76/59/385887659.db2.gz TWIAJNLGZNBKFW-NWDGAFQWSA-N 1 2 220.316 2.069 20 0 BEADLO C[N@H+](CCC(=O)c1ccccc1)Cc1ccon1 ZINC000272250414 385888296 /nfs/dbraw/zinc/88/82/96/385888296.db2.gz KWCZYLOQXOVXJY-UHFFFAOYSA-N 1 2 244.294 2.379 20 0 BEADLO C[N@@H+](CCC(=O)c1ccccc1)Cc1ccon1 ZINC000272250414 385888298 /nfs/dbraw/zinc/88/82/98/385888298.db2.gz KWCZYLOQXOVXJY-UHFFFAOYSA-N 1 2 244.294 2.379 20 0 BEADLO CCc1ccc[nH+]c1NCc1[nH]ncc1C ZINC000289470168 385928858 /nfs/dbraw/zinc/92/88/58/385928858.db2.gz IZPKOOKKGDQWMW-UHFFFAOYSA-N 1 2 216.288 2.288 20 0 BEADLO Cc1nc(C(C)C)oc1CNc1cc[nH+]c(C)n1 ZINC000647843258 385893245 /nfs/dbraw/zinc/89/32/45/385893245.db2.gz COKLGCWRPWYAKF-UHFFFAOYSA-N 1 2 246.314 2.239 20 0 BEADLO COC(=O)[C@@H](CC(C)C)[N@H+](C)Cc1ccco1 ZINC000285069533 385897558 /nfs/dbraw/zinc/89/75/58/385897558.db2.gz FAODMYVFOXEHLL-GFCCVEGCSA-N 1 2 239.315 2.299 20 0 BEADLO COC(=O)[C@@H](CC(C)C)[N@@H+](C)Cc1ccco1 ZINC000285069533 385897562 /nfs/dbraw/zinc/89/75/62/385897562.db2.gz FAODMYVFOXEHLL-GFCCVEGCSA-N 1 2 239.315 2.299 20 0 BEADLO CCOCCOC1C[NH+](Cc2ccc(C)cc2)C1 ZINC000272376129 385898196 /nfs/dbraw/zinc/89/81/96/385898196.db2.gz CWGUCMJBFJMCRS-UHFFFAOYSA-N 1 2 249.354 2.232 20 0 BEADLO CC[C@@H](C)CCC(=O)N(C)Cc1[nH+]ccn1C ZINC000285118579 385899856 /nfs/dbraw/zinc/89/98/56/385899856.db2.gz PSLMREDMSKRTFK-LLVKDONJSA-N 1 2 237.347 2.205 20 0 BEADLO CC(C)c1nnc([C@@H](C)[NH2+][C@@H](C)c2cn[nH]c2)[nH]1 ZINC000285157025 385903257 /nfs/dbraw/zinc/90/32/57/385903257.db2.gz MKVAZYHBDDOOSG-DTWKUNHWSA-N 1 2 248.334 2.063 20 0 BEADLO FC1=CCC[N@H+](CCc2cccnc2)C1 ZINC000272473459 385906053 /nfs/dbraw/zinc/90/60/53/385906053.db2.gz LOAZFKINCAURAV-UHFFFAOYSA-N 1 2 206.264 2.183 20 0 BEADLO FC1=CCC[N@@H+](CCc2cccnc2)C1 ZINC000272473459 385906057 /nfs/dbraw/zinc/90/60/57/385906057.db2.gz LOAZFKINCAURAV-UHFFFAOYSA-N 1 2 206.264 2.183 20 0 BEADLO CCCCOC(=O)CC[N@@H+]1CCC=C(F)C1 ZINC000272491045 385906214 /nfs/dbraw/zinc/90/62/14/385906214.db2.gz NANTVSOGCODNEH-UHFFFAOYSA-N 1 2 229.295 2.279 20 0 BEADLO CCCCOC(=O)CC[N@H+]1CCC=C(F)C1 ZINC000272491045 385906216 /nfs/dbraw/zinc/90/62/16/385906216.db2.gz NANTVSOGCODNEH-UHFFFAOYSA-N 1 2 229.295 2.279 20 0 BEADLO CS[C@@H]1CCN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000294903687 385911997 /nfs/dbraw/zinc/91/19/97/385911997.db2.gz FBBFAQMCSIXBBT-SNVBAGLBSA-N 1 2 235.356 2.296 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cnccn2)cs1 ZINC000294945707 385922451 /nfs/dbraw/zinc/92/24/51/385922451.db2.gz VHWTZFNCKVPCFA-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cnccn2)cs1 ZINC000294945707 385922457 /nfs/dbraw/zinc/92/24/57/385922457.db2.gz VHWTZFNCKVPCFA-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CC1(C(=O)NCc2[nH]cc[nH+]2)CCCCCC1 ZINC000272697434 385924878 /nfs/dbraw/zinc/92/48/78/385924878.db2.gz IHOMDRGKYRGLFK-UHFFFAOYSA-N 1 2 235.331 2.386 20 0 BEADLO C[C@H]1CCCC[C@H]1C(=O)Nc1ccc(N)[nH+]c1 ZINC000335036459 385926189 /nfs/dbraw/zinc/92/61/89/385926189.db2.gz DTHKVBYYIMVQPZ-GXSJLCMTSA-N 1 2 233.315 2.259 20 0 BEADLO C[NH2+]Cc1noc(CC2CCCCCC2)n1 ZINC000160996833 385926669 /nfs/dbraw/zinc/92/66/69/385926669.db2.gz OOLIMVIKRKATMU-UHFFFAOYSA-N 1 2 223.320 2.302 20 0 BEADLO Cc1cnc(C[NH2+][C@H](C)c2ccncc2F)cn1 ZINC000337950550 385859688 /nfs/dbraw/zinc/85/96/88/385859688.db2.gz HCNYXRRZUUNXJD-SNVBAGLBSA-N 1 2 246.289 2.170 20 0 BEADLO CC(C)CCC[S@](=O)Cc1c[nH+]cn1C ZINC000271990945 385865773 /nfs/dbraw/zinc/86/57/73/385865773.db2.gz ZGOJCCIEVKLRNR-HNNXBMFYSA-N 1 2 228.361 2.105 20 0 BEADLO c1csc([C@H]2CCC[N@H+]2Cc2cnn[nH]2)c1 ZINC000284410088 385869271 /nfs/dbraw/zinc/86/92/71/385869271.db2.gz XCBBJEPRGWWMHI-SNVBAGLBSA-N 1 2 234.328 2.203 20 0 BEADLO c1csc([C@H]2CCC[N@@H+]2Cc2cnn[nH]2)c1 ZINC000284410088 385869274 /nfs/dbraw/zinc/86/92/74/385869274.db2.gz XCBBJEPRGWWMHI-SNVBAGLBSA-N 1 2 234.328 2.203 20 0 BEADLO c1csc([C@H]2CCC[N@H+]2Cc2c[nH]nn2)c1 ZINC000284410088 385869276 /nfs/dbraw/zinc/86/92/76/385869276.db2.gz XCBBJEPRGWWMHI-SNVBAGLBSA-N 1 2 234.328 2.203 20 0 BEADLO c1csc([C@H]2CCC[N@@H+]2Cc2c[nH]nn2)c1 ZINC000284410088 385869278 /nfs/dbraw/zinc/86/92/78/385869278.db2.gz XCBBJEPRGWWMHI-SNVBAGLBSA-N 1 2 234.328 2.203 20 0 BEADLO c1csc([C@H]2CCC[N@H+]2Cc2cn[nH]n2)c1 ZINC000284410088 385869283 /nfs/dbraw/zinc/86/92/83/385869283.db2.gz XCBBJEPRGWWMHI-SNVBAGLBSA-N 1 2 234.328 2.203 20 0 BEADLO c1csc([C@H]2CCC[N@@H+]2Cc2cn[nH]n2)c1 ZINC000284410088 385869285 /nfs/dbraw/zinc/86/92/85/385869285.db2.gz XCBBJEPRGWWMHI-SNVBAGLBSA-N 1 2 234.328 2.203 20 0 BEADLO CCCC1(CNC(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000284548750 385874625 /nfs/dbraw/zinc/87/46/25/385874625.db2.gz XRAGKLKTBQBMPG-ONEGZZNKSA-N 1 2 233.315 2.119 20 0 BEADLO CCC[C@@H](C)CC(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000647736058 385877508 /nfs/dbraw/zinc/87/75/08/385877508.db2.gz YFYJZHUUTMJKJK-SNVBAGLBSA-N 1 2 235.331 2.121 20 0 BEADLO CCC[C@@H](C)CC(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000647736058 385877509 /nfs/dbraw/zinc/87/75/09/385877509.db2.gz YFYJZHUUTMJKJK-SNVBAGLBSA-N 1 2 235.331 2.121 20 0 BEADLO CC/C(C)=C/C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000294669017 385880209 /nfs/dbraw/zinc/88/02/09/385880209.db2.gz IXYCJWPAGCNMNL-ZHACJKMWSA-N 1 2 247.342 2.472 20 0 BEADLO C[N@H+](Cc1csc(Cl)n1)CC(C)(C)CO ZINC000295140882 385977498 /nfs/dbraw/zinc/97/74/98/385977498.db2.gz CFCYMPSNQGTGKO-UHFFFAOYSA-N 1 2 248.779 2.247 20 0 BEADLO C[N@@H+](Cc1csc(Cl)n1)CC(C)(C)CO ZINC000295140882 385977503 /nfs/dbraw/zinc/97/75/03/385977503.db2.gz CFCYMPSNQGTGKO-UHFFFAOYSA-N 1 2 248.779 2.247 20 0 BEADLO CC[C@@H]([NH2+]C[C@@H](SC)C(C)(C)C)C(=O)OC ZINC000336747638 385978961 /nfs/dbraw/zinc/97/89/61/385978961.db2.gz XKQJGFHQKBLNAZ-NXEZZACHSA-N 1 2 247.404 2.305 20 0 BEADLO CC(C)c1nc(N[C@@H]2CSC2(C)C)cc[nH+]1 ZINC000336748226 385984611 /nfs/dbraw/zinc/98/46/11/385984611.db2.gz SNKPZIWGXJIFRS-SECBINFHSA-N 1 2 237.372 2.328 20 0 BEADLO C[C@H]1c2ccccc2C[N@H+]1CC(=O)NC(C)(C)C ZINC000334321391 385986404 /nfs/dbraw/zinc/98/64/04/385986404.db2.gz HWHLEFJHTUQOCT-NSHDSACASA-N 1 2 246.354 2.478 20 0 BEADLO C[C@H]1c2ccccc2C[N@@H+]1CC(=O)NC(C)(C)C ZINC000334321391 385986409 /nfs/dbraw/zinc/98/64/09/385986409.db2.gz HWHLEFJHTUQOCT-NSHDSACASA-N 1 2 246.354 2.478 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@H]2CCCOCC2)[nH+]1 ZINC000345077562 385986807 /nfs/dbraw/zinc/98/68/07/385986807.db2.gz UVZLJPGOWQRFGI-JTQLQIEISA-N 1 2 246.314 2.247 20 0 BEADLO Cc1csc(C(=O)Nc2cc[nH+]cc2C)c1 ZINC000334515448 385932360 /nfs/dbraw/zinc/93/23/60/385932360.db2.gz SVZLXDGMYCPJPU-UHFFFAOYSA-N 1 2 232.308 2.434 20 0 BEADLO C[C@@H]([NH2+]Cc1ccoc1)c1cc2n(n1)CCC2 ZINC000414065501 385943173 /nfs/dbraw/zinc/94/31/73/385943173.db2.gz GYSHEHWILWUYRT-SNVBAGLBSA-N 1 2 231.299 2.273 20 0 BEADLO C[C@@H]([NH2+]c1ccc2c(c1)CCN2)[C@H]1CCOC1 ZINC000335052723 385952301 /nfs/dbraw/zinc/95/23/01/385952301.db2.gz GYONJAHVPPEKAP-PWSUYJOCSA-N 1 2 232.327 2.492 20 0 BEADLO C[C@@H](Nc1ccc2c(c1)CC[NH2+]2)[C@H]1CCOC1 ZINC000335052723 385952303 /nfs/dbraw/zinc/95/23/03/385952303.db2.gz GYONJAHVPPEKAP-PWSUYJOCSA-N 1 2 232.327 2.492 20 0 BEADLO C[C@H]1OCC[C@@H]1Nc1ccc2c(c1)CC[NH2+]2 ZINC000335054923 385953208 /nfs/dbraw/zinc/95/32/08/385953208.db2.gz ORPLUMIGZXMUIG-SKDRFNHKSA-N 1 2 218.300 2.244 20 0 BEADLO CC[N@H+](C)Cc1c(F)ccc(O)c1F ZINC000295057078 385954269 /nfs/dbraw/zinc/95/42/69/385954269.db2.gz ZOUIVUXHMZXSGP-UHFFFAOYSA-N 1 2 201.216 2.122 20 0 BEADLO CC[N@@H+](C)Cc1c(F)ccc(O)c1F ZINC000295057078 385954276 /nfs/dbraw/zinc/95/42/76/385954276.db2.gz ZOUIVUXHMZXSGP-UHFFFAOYSA-N 1 2 201.216 2.122 20 0 BEADLO Cc1cc(C2CC[NH+](Cc3ccon3)CC2)[nH]n1 ZINC000272965801 385955922 /nfs/dbraw/zinc/95/59/22/385955922.db2.gz OFVBNQYZJMZCQX-UHFFFAOYSA-N 1 2 246.314 2.086 20 0 BEADLO Cc1cc(C2CC[NH+](Cc3ccon3)CC2)n[nH]1 ZINC000272965801 385955927 /nfs/dbraw/zinc/95/59/27/385955927.db2.gz OFVBNQYZJMZCQX-UHFFFAOYSA-N 1 2 246.314 2.086 20 0 BEADLO CC(C)n1ccc(C[N@H+](C)Cc2ccccn2)n1 ZINC000295106178 385967314 /nfs/dbraw/zinc/96/73/14/385967314.db2.gz GZIPWEMFGQBQFW-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO CC(C)n1ccc(C[N@@H+](C)Cc2ccccn2)n1 ZINC000295106178 385967321 /nfs/dbraw/zinc/96/73/21/385967321.db2.gz GZIPWEMFGQBQFW-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO C[C@@H]([NH2+]Cc1ccno1)c1c(F)cncc1F ZINC000285817379 385967856 /nfs/dbraw/zinc/96/78/56/385967856.db2.gz VIFXDVGVNWDPCU-SSDOTTSWSA-N 1 2 239.225 2.199 20 0 BEADLO Cc1nc(C[NH2+][C@@H]2CCCc3cn[nH]c32)cs1 ZINC000335016785 385973363 /nfs/dbraw/zinc/97/33/63/385973363.db2.gz SHFPZUNQJFEURS-LLVKDONJSA-N 1 2 248.355 2.342 20 0 BEADLO Cc1nc(C[NH2+][C@@H]2CCCc3c[nH]nc32)cs1 ZINC000335016785 385973366 /nfs/dbraw/zinc/97/33/66/385973366.db2.gz SHFPZUNQJFEURS-LLVKDONJSA-N 1 2 248.355 2.342 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)/C=C\c1ccccc1 ZINC000216398129 386011989 /nfs/dbraw/zinc/01/19/89/386011989.db2.gz HOUGQSNZTNONLY-FPLPWBNLSA-N 1 2 241.294 2.082 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1ncnn1C(C)(C)C ZINC000335068648 386014379 /nfs/dbraw/zinc/01/43/79/386014379.db2.gz VGJLZGQWSUCSCO-AOOOYVTPSA-N 1 2 222.336 2.016 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1ncnn1C(C)(C)C ZINC000335068648 386014386 /nfs/dbraw/zinc/01/43/86/386014386.db2.gz VGJLZGQWSUCSCO-AOOOYVTPSA-N 1 2 222.336 2.016 20 0 BEADLO Cc1cc(NCCC2C[C@H](C)O[C@@H](C)C2)nc[nH+]1 ZINC000338489440 386019756 /nfs/dbraw/zinc/01/97/56/386019756.db2.gz OMDUVXKGPPBBFV-RYUDHWBXSA-N 1 2 249.358 2.213 20 0 BEADLO CCC[N@@H+]1CC(=O)N[C@]12CCC[C@H](C1CC1)C2 ZINC000414177184 386021157 /nfs/dbraw/zinc/02/11/57/386021157.db2.gz FRMWHXZFEVWJMS-GXTWGEPZSA-N 1 2 236.359 2.125 20 0 BEADLO CCC[N@H+]1CC(=O)N[C@]12CCC[C@H](C1CC1)C2 ZINC000414177184 386021163 /nfs/dbraw/zinc/02/11/63/386021163.db2.gz FRMWHXZFEVWJMS-GXTWGEPZSA-N 1 2 236.359 2.125 20 0 BEADLO CCCC[N@@H+]1CC(=O)N[C@]12CCC(C)(C)C2 ZINC000414181171 386022911 /nfs/dbraw/zinc/02/29/11/386022911.db2.gz MDOUDQDEBYWLAY-CYBMUJFWSA-N 1 2 224.348 2.125 20 0 BEADLO CCCC[N@H+]1CC(=O)N[C@]12CCC(C)(C)C2 ZINC000414181171 386022915 /nfs/dbraw/zinc/02/29/15/386022915.db2.gz MDOUDQDEBYWLAY-CYBMUJFWSA-N 1 2 224.348 2.125 20 0 BEADLO Cc1cc(C)c(CNC(=O)[C@H]2CC2(C)C)c[nH+]1 ZINC000335060614 386024068 /nfs/dbraw/zinc/02/40/68/386024068.db2.gz WUOAUTCFPQLMGV-GFCCVEGCSA-N 1 2 232.327 2.361 20 0 BEADLO CC(C)CCCC(=O)NCCNc1cccc[nH+]1 ZINC000295405901 386026566 /nfs/dbraw/zinc/02/65/66/386026566.db2.gz MOZQAWALTVEXDE-UHFFFAOYSA-N 1 2 249.358 2.436 20 0 BEADLO C[C@@]1(F)CCC[N@H+](Cc2cn3cccnc3n2)C1 ZINC000295400468 386026610 /nfs/dbraw/zinc/02/66/10/386026610.db2.gz LZYMLMOOZAHZPJ-CYBMUJFWSA-N 1 2 248.305 2.053 20 0 BEADLO C[C@@]1(F)CCC[N@@H+](Cc2cn3cccnc3n2)C1 ZINC000295400468 386026615 /nfs/dbraw/zinc/02/66/15/386026615.db2.gz LZYMLMOOZAHZPJ-CYBMUJFWSA-N 1 2 248.305 2.053 20 0 BEADLO CC1(C)[NH2+][C@H](C2CC2)N(CC2CCCC2)C1=O ZINC000414187881 386027125 /nfs/dbraw/zinc/02/71/25/386027125.db2.gz QVJHOKRKFDWXJK-LBPRGKRZSA-N 1 2 236.359 2.123 20 0 BEADLO CCC[N@@H+]1CC(=O)N[C@@]12CCC[C@@H](CC)C2 ZINC000414187106 386027532 /nfs/dbraw/zinc/02/75/32/386027532.db2.gz QAMWESMZELLKIN-YPMHNXCESA-N 1 2 224.348 2.125 20 0 BEADLO CCC[N@H+]1CC(=O)N[C@@]12CCC[C@@H](CC)C2 ZINC000414187106 386027538 /nfs/dbraw/zinc/02/75/38/386027538.db2.gz QAMWESMZELLKIN-YPMHNXCESA-N 1 2 224.348 2.125 20 0 BEADLO CC1(C)[NH2+][C@@H](C2CC2)N(CC2CCCC2)C1=O ZINC000414187877 386028744 /nfs/dbraw/zinc/02/87/44/386028744.db2.gz QVJHOKRKFDWXJK-GFCCVEGCSA-N 1 2 236.359 2.123 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2nccn2C)ccc1F ZINC000273771530 386032515 /nfs/dbraw/zinc/03/25/15/386032515.db2.gz QWVGEYOEJIBVMW-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2nccn2C)ccc1F ZINC000273771530 386032520 /nfs/dbraw/zinc/03/25/20/386032520.db2.gz QWVGEYOEJIBVMW-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO C[NH2+]Cc1ccc(NCc2cn[nH]c2C)cc1 ZINC000414977915 386037657 /nfs/dbraw/zinc/03/76/57/386037657.db2.gz QZNPUEAQJHJOCZ-UHFFFAOYSA-N 1 2 230.315 2.050 20 0 BEADLO CCC(CC)[C@@H](C)c1nc(C[NH2+]C)no1 ZINC000414642147 386042212 /nfs/dbraw/zinc/04/22/12/386042212.db2.gz KNPVKIKBSPXWBO-MRVPVSSYSA-N 1 2 211.309 2.329 20 0 BEADLO CC(=O)c1cccc(C[N@@H+](C(C)C)C2COC2)c1 ZINC000295556013 386051662 /nfs/dbraw/zinc/05/16/62/386051662.db2.gz XLWFZPZLLNHAEF-UHFFFAOYSA-N 1 2 247.338 2.498 20 0 BEADLO CC(=O)c1cccc(C[N@H+](C(C)C)C2COC2)c1 ZINC000295556013 386051665 /nfs/dbraw/zinc/05/16/65/386051665.db2.gz XLWFZPZLLNHAEF-UHFFFAOYSA-N 1 2 247.338 2.498 20 0 BEADLO Cc1nocc1C[N@@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000334432975 386052400 /nfs/dbraw/zinc/05/24/00/386052400.db2.gz LVZDZDFNFAJHEM-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1nocc1C[N@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000334432975 386052404 /nfs/dbraw/zinc/05/24/04/386052404.db2.gz LVZDZDFNFAJHEM-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@](C)(F)C2)on1 ZINC000295584991 386054613 /nfs/dbraw/zinc/05/46/13/386054613.db2.gz ZUSKYGSNTNSLAW-LLVKDONJSA-N 1 2 212.268 2.307 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@](C)(F)C2)on1 ZINC000295584991 386054619 /nfs/dbraw/zinc/05/46/19/386054619.db2.gz ZUSKYGSNTNSLAW-LLVKDONJSA-N 1 2 212.268 2.307 20 0 BEADLO CC(C)(C(=O)NCCNc1cccc[nH+]1)C1CC1 ZINC000287229362 386104551 /nfs/dbraw/zinc/10/45/51/386104551.db2.gz VVDILOOTRPEZDI-UHFFFAOYSA-N 1 2 247.342 2.046 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)[C@@H]1CCCC1(C)C ZINC000274584964 386123645 /nfs/dbraw/zinc/12/36/45/386123645.db2.gz GDWBLYUAIOUZSH-NEPJUHHUSA-N 1 2 249.358 2.214 20 0 BEADLO Cc1ccc(C[N@@H+](C)[C@H](C)c2nncn2C)cc1 ZINC000287267290 386109059 /nfs/dbraw/zinc/10/90/59/386109059.db2.gz LDJUTVHMWHBOJJ-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1ccc(C[N@H+](C)[C@H](C)c2nncn2C)cc1 ZINC000287267290 386109065 /nfs/dbraw/zinc/10/90/65/386109065.db2.gz LDJUTVHMWHBOJJ-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO CCc1ncc(CNc2c[nH+]ccc2C)cn1 ZINC000414306689 386110738 /nfs/dbraw/zinc/11/07/38/386110738.db2.gz DUGNUFLRIFPEBI-UHFFFAOYSA-N 1 2 228.299 2.355 20 0 BEADLO CCc1ncc(CNc2c[nH+]cc(C)c2)cn1 ZINC000414307268 386111188 /nfs/dbraw/zinc/11/11/88/386111188.db2.gz YMULIQKMNFMFFM-UHFFFAOYSA-N 1 2 228.299 2.355 20 0 BEADLO CC(C)[N@H+](Cc1cc(O)cc(F)c1)C1COC1 ZINC000295976420 386117608 /nfs/dbraw/zinc/11/76/08/386117608.db2.gz JCBNGHINIMIBAV-UHFFFAOYSA-N 1 2 239.290 2.141 20 0 BEADLO CC(C)[N@@H+](Cc1cc(O)cc(F)c1)C1COC1 ZINC000295976420 386117621 /nfs/dbraw/zinc/11/76/21/386117621.db2.gz JCBNGHINIMIBAV-UHFFFAOYSA-N 1 2 239.290 2.141 20 0 BEADLO CC[C@H]1CCCC[C@H]1c1nc(C[NH2+]C)no1 ZINC000414648029 386061119 /nfs/dbraw/zinc/06/11/19/386061119.db2.gz UWEPHNTZWIQORY-VHSXEESVSA-N 1 2 223.320 2.473 20 0 BEADLO CCc1cccc(C[N@H+](C)Cc2nncn2C)c1 ZINC000286700633 386065923 /nfs/dbraw/zinc/06/59/23/386065923.db2.gz DTHLYQOZCKOMEP-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO CCc1cccc(C[N@@H+](C)Cc2nncn2C)c1 ZINC000286700633 386065929 /nfs/dbraw/zinc/06/59/29/386065929.db2.gz DTHLYQOZCKOMEP-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO CC(=O)c1cccc(C[N@H+]2CCOC[C@H]2C)c1 ZINC000295663322 386068540 /nfs/dbraw/zinc/06/85/40/386068540.db2.gz AXLYICSRNLNDQZ-LLVKDONJSA-N 1 2 233.311 2.110 20 0 BEADLO CC(=O)c1cccc(C[N@@H+]2CCOC[C@H]2C)c1 ZINC000295663322 386068546 /nfs/dbraw/zinc/06/85/46/386068546.db2.gz AXLYICSRNLNDQZ-LLVKDONJSA-N 1 2 233.311 2.110 20 0 BEADLO CC[C@@]1(C)CN(c2nc(C)[nH+]c(C)c2C)CCO1 ZINC000189825640 386090960 /nfs/dbraw/zinc/09/09/60/386090960.db2.gz MJSHMXYSPPIGDL-AWEZNQCLSA-N 1 2 249.358 2.407 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000274761744 386146421 /nfs/dbraw/zinc/14/64/21/386146421.db2.gz NOIUYGWLFIENJL-DYEKYZERSA-N 1 2 249.358 2.070 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000274761742 386146450 /nfs/dbraw/zinc/14/64/50/386146450.db2.gz NOIUYGWLFIENJL-BZPMIXESSA-N 1 2 249.358 2.070 20 0 BEADLO C[N@@H+](Cc1ccon1)C[C@@H]1CCC(C)(C)O1 ZINC000274804998 386152624 /nfs/dbraw/zinc/15/26/24/386152624.db2.gz SIPVHVBEYHMEQB-NSHDSACASA-N 1 2 224.304 2.064 20 0 BEADLO C[N@H+](Cc1ccon1)C[C@@H]1CCC(C)(C)O1 ZINC000274804998 386152627 /nfs/dbraw/zinc/15/26/27/386152627.db2.gz SIPVHVBEYHMEQB-NSHDSACASA-N 1 2 224.304 2.064 20 0 BEADLO COC(=O)[C@H]1C[C@@H](C)CC[N@@H+]1C/C=C/Cl ZINC000274823268 386154032 /nfs/dbraw/zinc/15/40/32/386154032.db2.gz BPXJJQIIJGDVJV-AETUYUCGSA-N 1 2 231.723 2.012 20 0 BEADLO COC(=O)[C@H]1C[C@@H](C)CC[N@H+]1C/C=C/Cl ZINC000274823268 386154040 /nfs/dbraw/zinc/15/40/40/386154040.db2.gz BPXJJQIIJGDVJV-AETUYUCGSA-N 1 2 231.723 2.012 20 0 BEADLO c1nnc([C@@H]([NH2+]C2CCC2)c2ccccc2)[nH]1 ZINC000274824387 386154547 /nfs/dbraw/zinc/15/45/47/386154547.db2.gz HTFIPMDPINXYKZ-LBPRGKRZSA-N 1 2 228.299 2.036 20 0 BEADLO Cc1nc(N2CCOC[C@@H]2CC2CCC2)cc[nH+]1 ZINC000338831960 386155998 /nfs/dbraw/zinc/15/59/98/386155998.db2.gz TVXQAJDOYKYBLW-ZDUSSCGKSA-N 1 2 247.342 2.180 20 0 BEADLO CC(C)Cn1cc(N[C@@H]2CCn3cc[nH+]c32)cn1 ZINC000296257612 386156319 /nfs/dbraw/zinc/15/63/19/386156319.db2.gz BKYBGXIWWXADQC-GFCCVEGCSA-N 1 2 245.330 2.293 20 0 BEADLO CCc1ncc(C[N@H+](C)Cc2ccco2)cn1 ZINC000414370384 386157716 /nfs/dbraw/zinc/15/77/16/386157716.db2.gz LBOPXTDETLAPBK-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1ncc(C[N@@H+](C)Cc2ccco2)cn1 ZINC000414370384 386157721 /nfs/dbraw/zinc/15/77/21/386157721.db2.gz LBOPXTDETLAPBK-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2ccccc2C)o1 ZINC000263776552 386175130 /nfs/dbraw/zinc/17/51/30/386175130.db2.gz NLAFLOWXGKXXKV-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2ccccc2C)o1 ZINC000263776552 386175135 /nfs/dbraw/zinc/17/51/35/386175135.db2.gz NLAFLOWXGKXXKV-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](CCO)c2ccco2)nc1 ZINC000346225776 386175609 /nfs/dbraw/zinc/17/56/09/386175609.db2.gz SQAJUJBBHPCUIE-ZDUSSCGKSA-N 1 2 246.310 2.196 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@@H](CC)C2)nc1 ZINC000338906882 386176711 /nfs/dbraw/zinc/17/67/11/386176711.db2.gz WQDSPILGRYLGEM-AWEZNQCLSA-N 1 2 234.343 2.255 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@@H](CC)C2)nc1 ZINC000338906882 386176718 /nfs/dbraw/zinc/17/67/18/386176718.db2.gz WQDSPILGRYLGEM-AWEZNQCLSA-N 1 2 234.343 2.255 20 0 BEADLO Cc1ccc(N(C)C(=O)CCn2cc[nH+]c2)cc1 ZINC000263814279 386180856 /nfs/dbraw/zinc/18/08/56/386180856.db2.gz OYAMDVSBDDLDJW-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)C1CCCCCC1 ZINC000263818091 386180995 /nfs/dbraw/zinc/18/09/95/386180995.db2.gz PRKADKVNBUJBBD-LBPRGKRZSA-N 1 2 249.358 2.358 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cncc(F)c2)C[C@H](C)O1 ZINC000275121091 386183387 /nfs/dbraw/zinc/18/33/87/386183387.db2.gz JDQOSLBKVXKGAX-GWCFXTLKSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cncc(F)c2)C[C@H](C)O1 ZINC000275121091 386183392 /nfs/dbraw/zinc/18/33/92/386183392.db2.gz JDQOSLBKVXKGAX-GWCFXTLKSA-N 1 2 238.306 2.220 20 0 BEADLO CC(C)n1ccc(C[NH2+][C@H](C)c2cn[nH]c2)n1 ZINC000275159184 386187708 /nfs/dbraw/zinc/18/77/08/386187708.db2.gz IMKQRRIRLZGQCQ-SNVBAGLBSA-N 1 2 233.319 2.038 20 0 BEADLO CC1(C)C(CNC(=O)CCc2[nH]cc[nH+]2)C1(C)C ZINC000288349546 386188364 /nfs/dbraw/zinc/18/83/64/386188364.db2.gz ZBLDQYUMUCHWRW-UHFFFAOYSA-N 1 2 249.358 2.141 20 0 BEADLO CC[C@H]([NH2+][C@H](C)C(F)(F)F)[C@@H]1CCOC1 ZINC000336773646 386126391 /nfs/dbraw/zinc/12/63/91/386126391.db2.gz YXRRZJRIKGWTKO-HLTSFMKQSA-N 1 2 225.254 2.342 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1C[C@H]1C ZINC000287519943 386130233 /nfs/dbraw/zinc/13/02/33/386130233.db2.gz MSUKGXBAUHLMQR-PSASIEDQSA-N 1 2 219.288 2.228 20 0 BEADLO C[C@H]1C[N@H+](Cc2cnn(C)c2C(F)(F)F)[C@H]1C ZINC000334464850 386135788 /nfs/dbraw/zinc/13/57/88/386135788.db2.gz TVUDQUDXTMTUQS-YUMQZZPRSA-N 1 2 247.264 2.279 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cnn(C)c2C(F)(F)F)[C@H]1C ZINC000334464850 386135794 /nfs/dbraw/zinc/13/57/94/386135794.db2.gz TVUDQUDXTMTUQS-YUMQZZPRSA-N 1 2 247.264 2.279 20 0 BEADLO CC(=O)CCCC(=O)Nc1cc[nH+]c(C)c1 ZINC000274698945 386140101 /nfs/dbraw/zinc/14/01/01/386140101.db2.gz UITWWXCMFYCYOA-UHFFFAOYSA-N 1 2 220.272 2.088 20 0 BEADLO O=C(CCn1cc[nH+]c1)N1CCC[C@H]1C1CCC1 ZINC000264006610 386202559 /nfs/dbraw/zinc/20/25/59/386202559.db2.gz VMDUGAZTTDVJHB-ZDUSSCGKSA-N 1 2 247.342 2.064 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@H](C)O[C@@H](CC)C2)cn1 ZINC000414376445 386204701 /nfs/dbraw/zinc/20/47/01/386204701.db2.gz CHYYQMSVFKSPOD-AAEUAGOBSA-N 1 2 249.358 2.038 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@H](C)O[C@@H](CC)C2)cn1 ZINC000414376445 386204704 /nfs/dbraw/zinc/20/47/04/386204704.db2.gz CHYYQMSVFKSPOD-AAEUAGOBSA-N 1 2 249.358 2.038 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@@H](CC)O[C@@H](C)C2)cn1 ZINC000414376447 386205201 /nfs/dbraw/zinc/20/52/01/386205201.db2.gz CHYYQMSVFKSPOD-WCQYABFASA-N 1 2 249.358 2.038 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@@H](CC)O[C@@H](C)C2)cn1 ZINC000414376447 386205205 /nfs/dbraw/zinc/20/52/05/386205205.db2.gz CHYYQMSVFKSPOD-WCQYABFASA-N 1 2 249.358 2.038 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1csc(C)c1 ZINC000296887296 386208479 /nfs/dbraw/zinc/20/84/79/386208479.db2.gz QDYIRSZHLVRPIO-VIFPVBQESA-N 1 2 227.329 2.050 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1csc(C)c1 ZINC000296887296 386208490 /nfs/dbraw/zinc/20/84/90/386208490.db2.gz QDYIRSZHLVRPIO-VIFPVBQESA-N 1 2 227.329 2.050 20 0 BEADLO C[C@H](CF)[NH2+]Cc1ccn(-c2ccccc2)n1 ZINC000288508787 386209564 /nfs/dbraw/zinc/20/95/64/386209564.db2.gz STJSPHMHWPWZFD-LLVKDONJSA-N 1 2 233.290 2.320 20 0 BEADLO CC[C@@H](NC(=O)CCn1cc[nH+]c1)[C@H]1CC1(C)C ZINC000416072960 386214906 /nfs/dbraw/zinc/21/49/06/386214906.db2.gz FVQBBQNCOQKXLE-VXGBXAGGSA-N 1 2 249.358 2.214 20 0 BEADLO CC[C@H](NC(=O)CCn1cc[nH+]c1)[C@H]1CC1(C)C ZINC000416072957 386215553 /nfs/dbraw/zinc/21/55/53/386215553.db2.gz FVQBBQNCOQKXLE-NEPJUHHUSA-N 1 2 249.358 2.214 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)NC1CCC2(CC2)CC1 ZINC000288569252 386217346 /nfs/dbraw/zinc/21/73/46/386217346.db2.gz WJAUPIUNYZECDO-UHFFFAOYSA-N 1 2 247.342 2.181 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1C(=O)CCc1[nH]cc[nH+]1 ZINC000288608803 386219173 /nfs/dbraw/zinc/21/91/73/386219173.db2.gz UUWFSOFVRJXZJM-MNOVXSKESA-N 1 2 235.331 2.132 20 0 BEADLO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1ccn(C)n1 ZINC000288623823 386223557 /nfs/dbraw/zinc/22/35/57/386223557.db2.gz RXMRPZSFNXIEAN-HZMBPMFUSA-N 1 2 243.310 2.032 20 0 BEADLO CCc1ncc(C[N@H+](C)Cc2ccoc2)cn1 ZINC000414381715 386224897 /nfs/dbraw/zinc/22/48/97/386224897.db2.gz MWUFYCIONIGQLU-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1ncc(C[N@@H+](C)Cc2ccoc2)cn1 ZINC000414381715 386224902 /nfs/dbraw/zinc/22/49/02/386224902.db2.gz MWUFYCIONIGQLU-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO Fc1cc(F)cc(C[N@@H+]2CCc3n[nH]cc3C2)c1 ZINC000275632564 386225684 /nfs/dbraw/zinc/22/56/84/386225684.db2.gz QMLFKIATBVTTJP-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO Fc1cc(F)cc(C[N@H+]2CCc3n[nH]cc3C2)c1 ZINC000275632564 386225690 /nfs/dbraw/zinc/22/56/90/386225690.db2.gz QMLFKIATBVTTJP-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO CN(c1[nH]c2ccccc2[nH+]1)[C@H]1CC[C@H](O)CC1 ZINC000275994818 386260320 /nfs/dbraw/zinc/26/03/20/386260320.db2.gz ZQTXPJUQGUBPDN-XYPYZODXSA-N 1 2 245.326 2.303 20 0 BEADLO C[N@H+](Cc1ccc[nH]1)Cc1cncc(F)c1 ZINC000347049664 386231641 /nfs/dbraw/zinc/23/16/41/386231641.db2.gz IALBCZWLKLDNPK-UHFFFAOYSA-N 1 2 219.263 2.181 20 0 BEADLO C[N@@H+](Cc1ccc[nH]1)Cc1cncc(F)c1 ZINC000347049664 386231645 /nfs/dbraw/zinc/23/16/45/386231645.db2.gz IALBCZWLKLDNPK-UHFFFAOYSA-N 1 2 219.263 2.181 20 0 BEADLO Cn1cc(Cl)c(C[N@@H+]2CCC3(CCC3)C2)n1 ZINC000335388403 386238600 /nfs/dbraw/zinc/23/86/00/386238600.db2.gz XZVAVEQWVVXZQT-UHFFFAOYSA-N 1 2 239.750 2.450 20 0 BEADLO Cn1cc(Cl)c(C[N@H+]2CCC3(CCC3)C2)n1 ZINC000335388403 386238605 /nfs/dbraw/zinc/23/86/05/386238605.db2.gz XZVAVEQWVVXZQT-UHFFFAOYSA-N 1 2 239.750 2.450 20 0 BEADLO CCOc1ccc(C[NH+]2CC(OCC)C2)cc1 ZINC000297287691 386238793 /nfs/dbraw/zinc/23/87/93/386238793.db2.gz AFQLFSGVXKGDHZ-UHFFFAOYSA-N 1 2 235.327 2.306 20 0 BEADLO CCCCC(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000125319274 386246846 /nfs/dbraw/zinc/24/68/46/386246846.db2.gz JFEZEPVQHADQOH-SECBINFHSA-N 1 2 209.293 2.167 20 0 BEADLO CC[C@@H](NC(=O)CCc1[nH]cc[nH+]1)[C@@H]1CC1(C)C ZINC000416279137 386255348 /nfs/dbraw/zinc/25/53/48/386255348.db2.gz SSZMTQUYBTUFSF-WDEREUQCSA-N 1 2 249.358 2.283 20 0 BEADLO CCCC(C)(C)NC(=O)c1c[nH+]c(C)[nH]1 ZINC000264653456 386257659 /nfs/dbraw/zinc/25/76/59/386257659.db2.gz PECZSPXESCZSGA-UHFFFAOYSA-N 1 2 209.293 2.027 20 0 BEADLO Cc1ccc(NC[C@@H]2CCCOC2)c[nH+]1 ZINC000164688631 386191809 /nfs/dbraw/zinc/19/18/09/386191809.db2.gz RQQMGMNSZTWLFN-NSHDSACASA-N 1 2 206.289 2.229 20 0 BEADLO CCc1cc(NC[C@H](C)CC(F)F)nc[nH+]1 ZINC000645305489 386196096 /nfs/dbraw/zinc/19/60/96/386196096.db2.gz VVVHKUBWLKTAPB-MRVPVSSYSA-N 1 2 229.274 2.164 20 0 BEADLO CCc1cccc(C[NH2+][C@H](C)c2ncn(C)n2)c1 ZINC000276180046 386281765 /nfs/dbraw/zinc/28/17/65/386281765.db2.gz GSTIOGOYSIQDQG-LLVKDONJSA-N 1 2 244.342 2.228 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H](C)CCc2ccco2)c[nH+]1 ZINC000264891663 386281853 /nfs/dbraw/zinc/28/18/53/386281853.db2.gz VJOQZKILGVYEHS-SECBINFHSA-N 1 2 247.298 2.062 20 0 BEADLO CCN(CC1CCC1)C(=O)CCc1c[nH+]cn1C ZINC000339168408 386283129 /nfs/dbraw/zinc/28/31/29/386283129.db2.gz VUEZRNVVDBETAI-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO FC(F)COCCNc1cc[nH+]c(C2CC2)n1 ZINC000276193904 386283468 /nfs/dbraw/zinc/28/34/68/386283468.db2.gz HOQJVGJSEJTHOU-UHFFFAOYSA-N 1 2 243.257 2.048 20 0 BEADLO CCCC(=O)N[C@@H](c1[nH]cc[nH+]1)C(C)C ZINC000276446232 386324395 /nfs/dbraw/zinc/32/43/95/386324395.db2.gz AJKBJUBMWUCPCN-SNVBAGLBSA-N 1 2 209.293 2.023 20 0 BEADLO CCCc1nc(C[N@H+](C)CCCSC)no1 ZINC000336667915 386295151 /nfs/dbraw/zinc/29/51/51/386295151.db2.gz PSEWBDSUBGZFOU-UHFFFAOYSA-N 1 2 243.376 2.207 20 0 BEADLO CCCc1nc(C[N@@H+](C)CCCSC)no1 ZINC000336667915 386295156 /nfs/dbraw/zinc/29/51/56/386295156.db2.gz PSEWBDSUBGZFOU-UHFFFAOYSA-N 1 2 243.376 2.207 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@H]2CC[C@H](C)O2)cs1 ZINC000336667652 386296912 /nfs/dbraw/zinc/29/69/12/386296912.db2.gz MPCMMISPRXNHOX-JOYOIKCWSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@H]2CC[C@H](C)O2)cs1 ZINC000336667652 386296918 /nfs/dbraw/zinc/29/69/18/386296918.db2.gz MPCMMISPRXNHOX-JOYOIKCWSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1ccc(N[C@H](C)c2[nH+]ccn2C)cn1 ZINC000164790301 386299355 /nfs/dbraw/zinc/29/93/55/386299355.db2.gz OBLOKDHYDLUXFG-SNVBAGLBSA-N 1 2 216.288 2.297 20 0 BEADLO CCC[C@H](C)C(=O)NCCNc1cccc[nH+]1 ZINC000265059276 386301702 /nfs/dbraw/zinc/30/17/02/386301702.db2.gz LLWWYTGFZJMDSY-NSHDSACASA-N 1 2 235.331 2.046 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H](C)C2CCCC2)c[nH+]1 ZINC000265065399 386301713 /nfs/dbraw/zinc/30/17/13/386301713.db2.gz XFOMZHBXCHYXBB-MRVPVSSYSA-N 1 2 221.304 2.027 20 0 BEADLO Cc1cn[nH]c1C[NH2+][C@H]1c2ccccc2O[C@@H]1C ZINC000289441131 386305098 /nfs/dbraw/zinc/30/50/98/386305098.db2.gz ARWZAJXTMFLLHL-QMTHXVAHSA-N 1 2 243.310 2.330 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@H]1c2ccccc2O[C@@H]1C ZINC000289441131 386305101 /nfs/dbraw/zinc/30/51/01/386305101.db2.gz ARWZAJXTMFLLHL-QMTHXVAHSA-N 1 2 243.310 2.330 20 0 BEADLO O=C(CCC1CC1)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000265282112 386325001 /nfs/dbraw/zinc/32/50/01/386325001.db2.gz YDPCWNDLVYBVBE-LBPRGKRZSA-N 1 2 247.342 2.306 20 0 BEADLO CCc1cccc(C[NH2+]C(C)(C)C(=O)OC)c1 ZINC000276393867 386313779 /nfs/dbraw/zinc/31/37/79/386313779.db2.gz SHPTXBITAQUKBY-UHFFFAOYSA-N 1 2 235.327 2.290 20 0 BEADLO CCc1ccccc1CC[NH2+][C@@]1(C)CCOC1=O ZINC000289485915 386314294 /nfs/dbraw/zinc/31/42/94/386314294.db2.gz IQPBLBQWSKOFHE-HNNXBMFYSA-N 1 2 247.338 2.087 20 0 BEADLO Cc1cc(CNC(=O)N2CC[C@@H]2C)cc(C)[nH+]1 ZINC000643384064 386315777 /nfs/dbraw/zinc/31/57/77/386315777.db2.gz ODGBANZWFCIJSF-NSHDSACASA-N 1 2 233.315 2.002 20 0 BEADLO C/C=C(/CC)C(=O)N(C)CCCn1cc[nH+]c1 ZINC000276419694 386319365 /nfs/dbraw/zinc/31/93/65/386319365.db2.gz CEXONUFQWGNPIM-QCDXTXTGSA-N 1 2 235.331 2.088 20 0 BEADLO CCOc1nnc(C[N@H+](C)C[C@H](C)CC)s1 ZINC000336675069 386322075 /nfs/dbraw/zinc/32/20/75/386322075.db2.gz LXRRYDDJUCKPPP-SECBINFHSA-N 1 2 243.376 2.415 20 0 BEADLO CCOc1nnc(C[N@@H+](C)C[C@H](C)CC)s1 ZINC000336675069 386322088 /nfs/dbraw/zinc/32/20/88/386322088.db2.gz LXRRYDDJUCKPPP-SECBINFHSA-N 1 2 243.376 2.415 20 0 BEADLO CC[C@@H]([NH2+][C@@H](C)c1cn(C)nc1C)C(F)F ZINC000453245722 386271759 /nfs/dbraw/zinc/27/17/59/386271759.db2.gz LVENWIGGYWNNMM-OIBJUYFYSA-N 1 2 231.290 2.423 20 0 BEADLO CC[C@@H](C)CN(CC)C(=O)CCc1[nH]cc[nH+]1 ZINC000289202104 386273159 /nfs/dbraw/zinc/27/31/59/386273159.db2.gz MEOLHYJHSNFDPN-LLVKDONJSA-N 1 2 237.347 2.237 20 0 BEADLO C[C@@H](CCC1CC1)NC(=O)CCc1c[nH+]cn1C ZINC000339169935 386275819 /nfs/dbraw/zinc/27/58/19/386275819.db2.gz KJNQSESJVZLXCZ-NSHDSACASA-N 1 2 249.358 2.048 20 0 BEADLO Fc1ccc(CN2CCc3[nH+]c[nH]c3C2)cc1F ZINC000647933183 386340141 /nfs/dbraw/zinc/34/01/41/386340141.db2.gz DZTYGCVFPBYJFK-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO CCC[C@@H](C(=O)OCC)[N@@H+]1CC[C@](C)(F)C1 ZINC000347345738 386342004 /nfs/dbraw/zinc/34/20/04/386342004.db2.gz FEIGSWMNQXEMPC-JQWIXIFHSA-N 1 2 231.311 2.152 20 0 BEADLO CCC[C@@H](C(=O)OCC)[N@H+]1CC[C@](C)(F)C1 ZINC000347345738 386342007 /nfs/dbraw/zinc/34/20/07/386342007.db2.gz FEIGSWMNQXEMPC-JQWIXIFHSA-N 1 2 231.311 2.152 20 0 BEADLO CCc1ccc(C[N@@H+]2CCC[C@@](F)(CO)C2)o1 ZINC000289802398 386359035 /nfs/dbraw/zinc/35/90/35/386359035.db2.gz MWMBVCSFDFAILC-ZDUSSCGKSA-N 1 2 241.306 2.138 20 0 BEADLO CCc1ccc(C[N@H+]2CCC[C@@](F)(CO)C2)o1 ZINC000289802398 386359039 /nfs/dbraw/zinc/35/90/39/386359039.db2.gz MWMBVCSFDFAILC-ZDUSSCGKSA-N 1 2 241.306 2.138 20 0 BEADLO CCCCN(CC)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000276657679 386359585 /nfs/dbraw/zinc/35/95/85/386359585.db2.gz MFMYUCPVVJSNGM-VOTSOKGWSA-N 1 2 221.304 2.072 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1cn(C(C)(C)C)nn1 ZINC000335272457 386362672 /nfs/dbraw/zinc/36/26/72/386362672.db2.gz ULYHCOURPXEJFN-AOOOYVTPSA-N 1 2 222.336 2.016 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1cn(C(C)(C)C)nn1 ZINC000335272457 386362678 /nfs/dbraw/zinc/36/26/78/386362678.db2.gz ULYHCOURPXEJFN-AOOOYVTPSA-N 1 2 222.336 2.016 20 0 BEADLO CC(C)[C@@H](NC(=O)[C@H]1CC1(C)C)c1[nH]cc[nH+]1 ZINC000276716362 386367851 /nfs/dbraw/zinc/36/78/51/386367851.db2.gz RRDAKJFACNPOLJ-NXEZZACHSA-N 1 2 235.331 2.269 20 0 BEADLO Cc1[nH]c(C(=O)NC2C[C@H](C)C[C@@H](C)C2)c[nH+]1 ZINC000265780026 386369504 /nfs/dbraw/zinc/36/95/04/386369504.db2.gz FAOJXVJBANOCSW-RKDXNWHRSA-N 1 2 235.331 2.273 20 0 BEADLO C[N@H+](Cc1ccon1)Cc1ccc2c(c1)CCO2 ZINC000265787313 386371031 /nfs/dbraw/zinc/37/10/31/386371031.db2.gz LQQKUDVXKJTVLG-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO C[N@@H+](Cc1ccon1)Cc1ccc2c(c1)CCO2 ZINC000265787313 386371037 /nfs/dbraw/zinc/37/10/37/386371037.db2.gz LQQKUDVXKJTVLG-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CCc3ccccc3C2)o1 ZINC000298687198 386371311 /nfs/dbraw/zinc/37/13/11/386371311.db2.gz MJJUTWKXQZAJGD-SNVBAGLBSA-N 1 2 243.310 2.497 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CCc3ccccc3C2)o1 ZINC000298687198 386371318 /nfs/dbraw/zinc/37/13/18/386371318.db2.gz MJJUTWKXQZAJGD-SNVBAGLBSA-N 1 2 243.310 2.497 20 0 BEADLO c1ccc(NCc2nnc3n2CCCCC3)[nH+]c1 ZINC000298689283 386371448 /nfs/dbraw/zinc/37/14/48/386371448.db2.gz BLDVVGROTFHHPD-UHFFFAOYSA-N 1 2 243.314 2.012 20 0 BEADLO C[C@H]1C[C@@H](O)C[N@@H+]1Cc1cc(F)c(F)cc1F ZINC000334495647 386376244 /nfs/dbraw/zinc/37/62/44/386376244.db2.gz SVGAPPBMFVHAGR-IONNQARKSA-N 1 2 245.244 2.059 20 0 BEADLO C[C@H]1C[C@@H](O)C[N@H+]1Cc1cc(F)c(F)cc1F ZINC000334495647 386376245 /nfs/dbraw/zinc/37/62/45/386376245.db2.gz SVGAPPBMFVHAGR-IONNQARKSA-N 1 2 245.244 2.059 20 0 BEADLO CCOc1nnc(C[N@@H+]2C[C@H](C)[C@H](C)C2)s1 ZINC000336697168 386377733 /nfs/dbraw/zinc/37/77/33/386377733.db2.gz IAXYMYNNFJABHB-DTORHVGOSA-N 1 2 241.360 2.025 20 0 BEADLO CCOc1nnc(C[N@H+]2C[C@H](C)[C@H](C)C2)s1 ZINC000336697168 386377736 /nfs/dbraw/zinc/37/77/36/386377736.db2.gz IAXYMYNNFJABHB-DTORHVGOSA-N 1 2 241.360 2.025 20 0 BEADLO COC[C@@H]([NH2+]Cc1coc(C)n1)c1ccccc1 ZINC000647970439 386377918 /nfs/dbraw/zinc/37/79/18/386377918.db2.gz QKEOVBSUABMTPB-CQSZACIVSA-N 1 2 246.310 2.460 20 0 BEADLO CC(C)c1nnc(C[N@H+]2[C@H](C)C[C@@H]2C)o1 ZINC000334495900 386378018 /nfs/dbraw/zinc/37/80/18/386378018.db2.gz YHBINBVNVRMSQL-DTORHVGOSA-N 1 2 209.293 2.176 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2[C@H](C)C[C@@H]2C)o1 ZINC000334495900 386378022 /nfs/dbraw/zinc/37/80/22/386378022.db2.gz YHBINBVNVRMSQL-DTORHVGOSA-N 1 2 209.293 2.176 20 0 BEADLO CC(C)c1nnc(C[NH+]2[C@H](C)C[C@H]2C)o1 ZINC000334495902 386378110 /nfs/dbraw/zinc/37/81/10/386378110.db2.gz YHBINBVNVRMSQL-RKDXNWHRSA-N 1 2 209.293 2.176 20 0 BEADLO COC(=O)[C@H]([NH2+]C[C@H]1C[C@H]1C)c1cccs1 ZINC000336775421 386384349 /nfs/dbraw/zinc/38/43/49/386384349.db2.gz YYZGNEDTNVXLSK-FXPVBKGRSA-N 1 2 239.340 2.208 20 0 BEADLO Cc1ccc2[nH+]cc(CNCC(F)(F)F)n2c1 ZINC000276483499 386333686 /nfs/dbraw/zinc/33/36/86/386333686.db2.gz SNRBOCHTNKXRIT-UHFFFAOYSA-N 1 2 243.232 2.295 20 0 BEADLO CC(C)c1nc(NC[C@H]2C[C@H]2C)cc[nH+]1 ZINC000336773770 386334108 /nfs/dbraw/zinc/33/41/08/386334108.db2.gz ZCPUOJGCNGWLKE-NXEZZACHSA-N 1 2 205.305 2.090 20 0 BEADLO COc1cc([C@H](C)[NH2+]Cc2ncc(C)o2)ccn1 ZINC000347538224 386443686 /nfs/dbraw/zinc/44/36/86/386443686.db2.gz KWGCXYAZHKHFTG-JTQLQIEISA-N 1 2 247.298 2.237 20 0 BEADLO CC(C)[C@@H](O)CNc1cc[nH+]c2ccncc12 ZINC000290510073 386445340 /nfs/dbraw/zinc/44/53/40/386445340.db2.gz BKAFWHIXCPZVBZ-ZDUSSCGKSA-N 1 2 231.299 2.059 20 0 BEADLO COC(=O)C[N@H+](C)[C@H](C)c1ccc(C)cc1C ZINC000298838839 386389386 /nfs/dbraw/zinc/38/93/86/386389386.db2.gz DMLULQZAOVYJPJ-GFCCVEGCSA-N 1 2 235.327 2.469 20 0 BEADLO COC(=O)C[N@@H+](C)[C@H](C)c1ccc(C)cc1C ZINC000298838839 386389390 /nfs/dbraw/zinc/38/93/90/386389390.db2.gz DMLULQZAOVYJPJ-GFCCVEGCSA-N 1 2 235.327 2.469 20 0 BEADLO Cn1ncc(C[N@@H+]2CCC[C@H]2c2cccs2)n1 ZINC000290058190 386390386 /nfs/dbraw/zinc/39/03/86/386390386.db2.gz SGAOJJCDRKGLPQ-NSHDSACASA-N 1 2 248.355 2.214 20 0 BEADLO Cn1ncc(C[N@H+]2CCC[C@H]2c2cccs2)n1 ZINC000290058190 386390392 /nfs/dbraw/zinc/39/03/92/386390392.db2.gz SGAOJJCDRKGLPQ-NSHDSACASA-N 1 2 248.355 2.214 20 0 BEADLO CCOc1nnc(C[N@@H+]2C[C@H](C)C[C@@H]2C)s1 ZINC000336705384 386395079 /nfs/dbraw/zinc/39/50/79/386395079.db2.gz QEAQPWXNFDLPII-BDAKNGLRSA-N 1 2 241.360 2.167 20 0 BEADLO CCOc1nnc(C[N@H+]2C[C@H](C)C[C@@H]2C)s1 ZINC000336705384 386395084 /nfs/dbraw/zinc/39/50/84/386395084.db2.gz QEAQPWXNFDLPII-BDAKNGLRSA-N 1 2 241.360 2.167 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)C(C)(C)C(C)(C)C ZINC000310493532 386410742 /nfs/dbraw/zinc/41/07/42/386410742.db2.gz PCBKWXSHTVGINP-UHFFFAOYSA-N 1 2 237.347 2.440 20 0 BEADLO c1ccc(NCCCOC2CCOCC2)[nH+]c1 ZINC000266213775 386413540 /nfs/dbraw/zinc/41/35/40/386413540.db2.gz GPHKLBIPBQFVGX-UHFFFAOYSA-N 1 2 236.315 2.079 20 0 BEADLO CCc1ncc(C[N@H+](C)Cc2ccncc2)cn1 ZINC000414428874 386419936 /nfs/dbraw/zinc/41/99/36/386419936.db2.gz HGJCDSMLPGUPNY-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO CCc1ncc(C[N@@H+](C)Cc2ccncc2)cn1 ZINC000414428874 386419944 /nfs/dbraw/zinc/41/99/44/386419944.db2.gz HGJCDSMLPGUPNY-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@H]2CCCO2)c(C)s1 ZINC000336709493 386422858 /nfs/dbraw/zinc/42/28/58/386422858.db2.gz XIHHZTAFXVGTHC-LLVKDONJSA-N 1 2 240.372 2.371 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@H]2CCCO2)c(C)s1 ZINC000336709493 386422863 /nfs/dbraw/zinc/42/28/63/386422863.db2.gz XIHHZTAFXVGTHC-LLVKDONJSA-N 1 2 240.372 2.371 20 0 BEADLO CN(c1cc[nH+]c(C2CC2)n1)C1CCC1 ZINC000266282270 386422963 /nfs/dbraw/zinc/42/29/63/386422963.db2.gz UMZNNSCPPDMHKW-UHFFFAOYSA-N 1 2 203.289 2.343 20 0 BEADLO CC(C)C[C@@H](C)CC(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000347493589 386423234 /nfs/dbraw/zinc/42/32/34/386423234.db2.gz HELFACOMVITLDK-LLVKDONJSA-N 1 2 237.347 2.440 20 0 BEADLO Cc1cnn(C)c1C[N@@H+](C)[C@H](C)c1ccccn1 ZINC000290380811 386426497 /nfs/dbraw/zinc/42/64/97/386426497.db2.gz NWSMYHLFQGNPQF-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cnn(C)c1C[N@H+](C)[C@H](C)c1ccccn1 ZINC000290380811 386426500 /nfs/dbraw/zinc/42/65/00/386426500.db2.gz NWSMYHLFQGNPQF-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1C[C@H](C)[C@@H](C)[C@@H]1C ZINC000416963170 386429624 /nfs/dbraw/zinc/42/96/24/386429624.db2.gz VHMIAVDEIXFKJL-TUAOUCFPSA-N 1 2 247.342 2.320 20 0 BEADLO C[N@H+](Cc1nc(CC(F)(F)F)no1)C1CCC1 ZINC000336715165 386433466 /nfs/dbraw/zinc/43/34/66/386433466.db2.gz UJMVLAPKPBINMK-UHFFFAOYSA-N 1 2 249.236 2.159 20 0 BEADLO C[N@@H+](Cc1nc(CC(F)(F)F)no1)C1CCC1 ZINC000336715165 386433469 /nfs/dbraw/zinc/43/34/69/386433469.db2.gz UJMVLAPKPBINMK-UHFFFAOYSA-N 1 2 249.236 2.159 20 0 BEADLO O=C(c1ccoc1)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000299542830 386466065 /nfs/dbraw/zinc/46/60/65/386466065.db2.gz PIEOKLRQJRYWRD-UHFFFAOYSA-N 1 2 245.282 2.023 20 0 BEADLO CCCOc1cccc(C[NH+]2CC(C)(O)C2)c1 ZINC000639254395 386470659 /nfs/dbraw/zinc/47/06/59/386470659.db2.gz RSJDTIAAWMUKOT-UHFFFAOYSA-N 1 2 235.327 2.042 20 0 BEADLO CO[C@@H](C)[C@@H](C)Nc1[nH+]c2ccccc2n1C ZINC000290770655 386473696 /nfs/dbraw/zinc/47/36/96/386473696.db2.gz VIHYQZPVAYEFDP-ZJUUUORDSA-N 1 2 233.315 2.409 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2C[C@@H](C)[C@H]2C)s1 ZINC000339579278 386473881 /nfs/dbraw/zinc/47/38/81/386473881.db2.gz BLGZSECZOYHFCW-PRJMDXOYSA-N 1 2 211.334 2.248 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2C[C@@H](C)[C@H]2C)s1 ZINC000339579278 386473883 /nfs/dbraw/zinc/47/38/83/386473883.db2.gz BLGZSECZOYHFCW-PRJMDXOYSA-N 1 2 211.334 2.248 20 0 BEADLO C[C@H](C1CC1)N(C(=O)CCn1cc[nH+]c1)C1CC1 ZINC000299650701 386478359 /nfs/dbraw/zinc/47/83/59/386478359.db2.gz XGFFYYMYDONVFB-LLVKDONJSA-N 1 2 247.342 2.063 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)[C@H]1C[C@@H]1C1CC1 ZINC000645406625 386485503 /nfs/dbraw/zinc/48/55/03/386485503.db2.gz JBDXXHQAFRLXKY-NEPJUHHUSA-N 1 2 241.294 2.319 20 0 BEADLO O=C(C=C1CCCCC1)N1CCn2c[nH+]cc2C1 ZINC000290911256 386486834 /nfs/dbraw/zinc/48/68/34/386486834.db2.gz IXJLZTPGWAVXSC-UHFFFAOYSA-N 1 2 245.326 2.116 20 0 BEADLO O=C(CC1=CCCCC1)N1CCn2c[nH+]cc2C1 ZINC000290930878 386488368 /nfs/dbraw/zinc/48/83/68/386488368.db2.gz MKIZVGRGSPMAQD-UHFFFAOYSA-N 1 2 245.326 2.116 20 0 BEADLO CC(C)C[C@H](C)CC(=O)N1CCn2c[nH+]cc2C1 ZINC000290939053 386490594 /nfs/dbraw/zinc/49/05/94/386490594.db2.gz ODCGDVOGJRXITO-LBPRGKRZSA-N 1 2 249.358 2.298 20 0 BEADLO CC(C)CC(C)(C)C(=O)N1CCn2c[nH+]cc2C1 ZINC000290956919 386491173 /nfs/dbraw/zinc/49/11/73/386491173.db2.gz QYCXLVXTAQXENV-UHFFFAOYSA-N 1 2 249.358 2.298 20 0 BEADLO CC(C)C(C)(C)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000519555332 386492427 /nfs/dbraw/zinc/49/24/27/386492427.db2.gz OKMKRNPBOQKDQF-SECBINFHSA-N 1 2 223.320 2.269 20 0 BEADLO CCOCc1nc([C@@H](C)[NH2+]C2CC(C)C2)no1 ZINC000353610884 386493162 /nfs/dbraw/zinc/49/31/62/386493162.db2.gz OIRGNSZACCDADL-HWOCKDDLSA-N 1 2 239.319 2.055 20 0 BEADLO CN(CCCCCO)c1cc[nH+]c2ccncc21 ZINC000290953759 386493350 /nfs/dbraw/zinc/49/33/50/386493350.db2.gz NHHDTNYLENIHFL-UHFFFAOYSA-N 1 2 245.326 2.229 20 0 BEADLO CC[C@@H](C)C[NH2+][C@H](CC(F)(F)F)C(=O)OC ZINC000336749306 386493741 /nfs/dbraw/zinc/49/37/41/386493741.db2.gz YSBDUXWMGFYGAX-HTQZYQBOSA-N 1 2 241.253 2.116 20 0 BEADLO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2nccc(N)n2)o1 ZINC000647971131 386496792 /nfs/dbraw/zinc/49/67/92/386496792.db2.gz VDSACQVEYINQSO-UWVGGRQHSA-N 1 2 246.314 2.202 20 0 BEADLO CC(C)[C@@H](NCc1[nH]cc[nH+]1)C(F)(F)F ZINC000336772215 386498827 /nfs/dbraw/zinc/49/88/27/386498827.db2.gz XXEQDRUJGUCUMA-MRVPVSSYSA-N 1 2 221.226 2.086 20 0 BEADLO CC(C)(C)[C@@H](O)CNc1cc[nH+]c2ccncc12 ZINC000267206178 386509453 /nfs/dbraw/zinc/50/94/53/386509453.db2.gz KPFGDZAXSCVICB-ZDUSSCGKSA-N 1 2 245.326 2.449 20 0 BEADLO COc1ncccc1C[N@@H+]1CCC[C@H]1CF ZINC000339665010 386512318 /nfs/dbraw/zinc/51/23/18/386512318.db2.gz QGWRPMXDPCKIBP-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO COc1ncccc1C[N@H+]1CCC[C@H]1CF ZINC000339665010 386512323 /nfs/dbraw/zinc/51/23/23/386512323.db2.gz QGWRPMXDPCKIBP-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO Cc1nc(N2CCCCC[C@@H]2C[C@@H](C)O)cc[nH+]1 ZINC000286516993 386518101 /nfs/dbraw/zinc/51/81/01/386518101.db2.gz ZIBRBAVRXWZBQC-DGCLKSJQSA-N 1 2 249.358 2.305 20 0 BEADLO c1ncc(C[N@@H+]2CCOC[C@@H]2C2CCC2)s1 ZINC000335449470 386518933 /nfs/dbraw/zinc/51/89/33/386518933.db2.gz MJLPPDZDLCTJHU-GFCCVEGCSA-N 1 2 238.356 2.144 20 0 BEADLO c1ncc(C[N@H+]2CCOC[C@@H]2C2CCC2)s1 ZINC000335449470 386518936 /nfs/dbraw/zinc/51/89/36/386518936.db2.gz MJLPPDZDLCTJHU-GFCCVEGCSA-N 1 2 238.356 2.144 20 0 BEADLO CCCCC[C@@H](C)NC(=O)CCn1cc[nH+]c1 ZINC000072619752 386527217 /nfs/dbraw/zinc/52/72/17/386527217.db2.gz SCCHIZKXFHXTHM-GFCCVEGCSA-N 1 2 237.347 2.358 20 0 BEADLO CC[C@@H](C)C(=O)Nc1c[nH+]ccc1OC ZINC000299463156 386456390 /nfs/dbraw/zinc/45/63/90/386456390.db2.gz DBUMJMSGGUBTPN-MRVPVSSYSA-N 1 2 208.261 2.075 20 0 BEADLO CCC[C@H](C)CC(=O)N(C)Cc1[nH+]ccn1C ZINC000299535228 386464667 /nfs/dbraw/zinc/46/46/67/386464667.db2.gz SKCGMROYIYAUOF-NSHDSACASA-N 1 2 237.347 2.205 20 0 BEADLO Fc1cc(F)c(CNCc2[nH]cc[nH+]2)c(F)c1 ZINC000339522886 386464744 /nfs/dbraw/zinc/46/47/44/386464744.db2.gz FWZGBPGOQMSSGB-UHFFFAOYSA-N 1 2 241.216 2.117 20 0 BEADLO Cc1occc1C[NH2+]Cc1ncnn1C(C)(C)C ZINC000414457122 386576127 /nfs/dbraw/zinc/57/61/27/386576127.db2.gz UPSWNHVMVWAMHY-UHFFFAOYSA-N 1 2 248.330 2.224 20 0 BEADLO CC1(C)CCC(CNCC(F)(F)C[NH3+])CC1 ZINC000414921627 386579830 /nfs/dbraw/zinc/57/98/30/386579830.db2.gz AXABFLBHTYZTJF-UHFFFAOYSA-N 1 2 234.334 2.386 20 0 BEADLO CN(C(=O)Cc1cn2ccccc2[nH+]1)C(C)(C)C ZINC000335414345 386580291 /nfs/dbraw/zinc/58/02/91/386580291.db2.gz APGAHQIGBRCGEU-UHFFFAOYSA-N 1 2 245.326 2.134 20 0 BEADLO CCCc1nc(C)c(C[NH2+]Cc2[nH]ncc2C)o1 ZINC000291775664 386582879 /nfs/dbraw/zinc/58/28/79/386582879.db2.gz UHQJRRDPWWAGSA-UHFFFAOYSA-N 1 2 248.330 2.257 20 0 BEADLO CCCc1nc(C)c(C[NH2+]Cc2n[nH]cc2C)o1 ZINC000291775664 386582883 /nfs/dbraw/zinc/58/28/83/386582883.db2.gz UHQJRRDPWWAGSA-UHFFFAOYSA-N 1 2 248.330 2.257 20 0 BEADLO C[N@H+](CCF)Cc1cc(F)cc(F)c1 ZINC000278816309 386589768 /nfs/dbraw/zinc/58/97/68/386589768.db2.gz PJJDHSWYAMEWLE-UHFFFAOYSA-N 1 2 203.207 2.366 20 0 BEADLO C[N@@H+](CCF)Cc1cc(F)cc(F)c1 ZINC000278816309 386589773 /nfs/dbraw/zinc/58/97/73/386589773.db2.gz PJJDHSWYAMEWLE-UHFFFAOYSA-N 1 2 203.207 2.366 20 0 BEADLO CCc1ncc(C[NH2+][C@H](CC)C(F)F)cn1 ZINC000414459740 386590608 /nfs/dbraw/zinc/59/06/08/386590608.db2.gz OUVCXYXUSXQVSG-SECBINFHSA-N 1 2 229.274 2.172 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C=C1CCC(C)CC1 ZINC000267883442 386594918 /nfs/dbraw/zinc/59/49/18/386594918.db2.gz PUXAIGBMEKGICZ-UHFFFAOYSA-N 1 2 247.342 2.471 20 0 BEADLO C[C@@H](CC(=O)NC1(C)CCCC1)n1cc[nH+]c1 ZINC000519710193 386539789 /nfs/dbraw/zinc/53/97/89/386539789.db2.gz VUASMTFIXOMUJY-NSHDSACASA-N 1 2 235.331 2.283 20 0 BEADLO C[C@@H](O)CCCNc1cc[nH+]c2ccncc12 ZINC000278557344 386544773 /nfs/dbraw/zinc/54/47/73/386544773.db2.gz ANOVFMYIZVAZHZ-SNVBAGLBSA-N 1 2 231.299 2.203 20 0 BEADLO CCc1csc(NCCn2cc[nH+]c2)n1 ZINC000061894563 386553260 /nfs/dbraw/zinc/55/32/60/386553260.db2.gz HIYSITXJUPTQJH-UHFFFAOYSA-N 1 2 222.317 2.014 20 0 BEADLO Cc1cn[nH]c1C[N@@H+](C)Cc1ccc(O)cc1 ZINC000291517916 386554167 /nfs/dbraw/zinc/55/41/67/386554167.db2.gz IVDOYZWWZCQSGI-UHFFFAOYSA-N 1 2 231.299 2.056 20 0 BEADLO Cc1cn[nH]c1C[N@H+](C)Cc1ccc(O)cc1 ZINC000291517916 386554172 /nfs/dbraw/zinc/55/41/72/386554172.db2.gz IVDOYZWWZCQSGI-UHFFFAOYSA-N 1 2 231.299 2.056 20 0 BEADLO Cc1c[nH]nc1C[N@@H+](C)Cc1ccc(O)cc1 ZINC000291517916 386554178 /nfs/dbraw/zinc/55/41/78/386554178.db2.gz IVDOYZWWZCQSGI-UHFFFAOYSA-N 1 2 231.299 2.056 20 0 BEADLO Cc1c[nH]nc1C[N@H+](C)Cc1ccc(O)cc1 ZINC000291517916 386554185 /nfs/dbraw/zinc/55/41/85/386554185.db2.gz IVDOYZWWZCQSGI-UHFFFAOYSA-N 1 2 231.299 2.056 20 0 BEADLO CCCc1[nH+]ccn1Cc1nnc(C(C)C)[nH]1 ZINC000291591515 386558880 /nfs/dbraw/zinc/55/88/80/386558880.db2.gz HPERCIXPBGAHKR-UHFFFAOYSA-N 1 2 233.319 2.125 20 0 BEADLO CCc1ccc(C[N@@H+]2CC[C@@H](F)C2)cn1 ZINC000335405542 386564319 /nfs/dbraw/zinc/56/43/19/386564319.db2.gz CKSWPPXPDOAOEP-LLVKDONJSA-N 1 2 208.280 2.188 20 0 BEADLO CCc1ccc(C[N@H+]2CC[C@@H](F)C2)cn1 ZINC000335405542 386564323 /nfs/dbraw/zinc/56/43/23/386564323.db2.gz CKSWPPXPDOAOEP-LLVKDONJSA-N 1 2 208.280 2.188 20 0 BEADLO COc1ccc(F)cc1C[N@@H+]1CC[C@H](F)C1 ZINC000335406884 386565742 /nfs/dbraw/zinc/56/57/42/386565742.db2.gz QWLBYTGBGBYDSJ-NSHDSACASA-N 1 2 227.254 2.378 20 0 BEADLO COc1ccc(F)cc1C[N@H+]1CC[C@H](F)C1 ZINC000335406884 386565746 /nfs/dbraw/zinc/56/57/46/386565746.db2.gz QWLBYTGBGBYDSJ-NSHDSACASA-N 1 2 227.254 2.378 20 0 BEADLO COc1ccc(F)c(C[N@@H+]2CC[C@H](F)C2)c1 ZINC000335406867 386566962 /nfs/dbraw/zinc/56/69/62/386566962.db2.gz QBIGKZLOFADGCQ-JTQLQIEISA-N 1 2 227.254 2.378 20 0 BEADLO COc1ccc(F)c(C[N@H+]2CC[C@H](F)C2)c1 ZINC000335406867 386566969 /nfs/dbraw/zinc/56/69/69/386566969.db2.gz QBIGKZLOFADGCQ-JTQLQIEISA-N 1 2 227.254 2.378 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CCC[C@H](C2CC2)C1 ZINC000292130707 386624073 /nfs/dbraw/zinc/62/40/73/386624073.db2.gz RLRPIGLMXDOBLN-FYJFLYSWSA-N 1 2 245.326 2.072 20 0 BEADLO CCC[C@@H]1CCCN(C(=O)CCn2cc[nH+]c2)C1 ZINC000268147427 386624590 /nfs/dbraw/zinc/62/45/90/386624590.db2.gz VMBGXIOFLMWHDH-CYBMUJFWSA-N 1 2 249.358 2.312 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@@H](C)CC(C)C)no1 ZINC000337183150 386655639 /nfs/dbraw/zinc/65/56/39/386655639.db2.gz NMTOOPLPGQAXRR-JTQLQIEISA-N 1 2 225.336 2.492 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@@H](C)CC(C)C)no1 ZINC000337183150 386655642 /nfs/dbraw/zinc/65/56/42/386655642.db2.gz NMTOOPLPGQAXRR-JTQLQIEISA-N 1 2 225.336 2.492 20 0 BEADLO Cc1ccc([S@](=O)Cc2c[nH+]cn2C)cc1C ZINC000268233140 386634233 /nfs/dbraw/zinc/63/42/33/386634233.db2.gz VRLUYVXDTGEMLB-QGZVFWFLSA-N 1 2 248.351 2.345 20 0 BEADLO CCCCC[C@@H](C)NC(=O)CCc1[nH]cc[nH+]1 ZINC000279110161 386634791 /nfs/dbraw/zinc/63/47/91/386634791.db2.gz BWVNDQGOHTZVGU-LLVKDONJSA-N 1 2 237.347 2.427 20 0 BEADLO COC[C@@H](CC(C)C)[NH2+]C1(C(F)F)CC1 ZINC000336758386 386635593 /nfs/dbraw/zinc/63/55/93/386635593.db2.gz JSUIOOWWHGYZLQ-SECBINFHSA-N 1 2 221.291 2.435 20 0 BEADLO CC1=C[C@H](C)C[N@H+](Cc2nn(C)cc2Cl)C1 ZINC000335505358 386637474 /nfs/dbraw/zinc/63/74/74/386637474.db2.gz YMOUMTGHXUZJGE-VIFPVBQESA-N 1 2 239.750 2.472 20 0 BEADLO CC1=C[C@H](C)C[N@@H+](Cc2nn(C)cc2Cl)C1 ZINC000335505358 386637480 /nfs/dbraw/zinc/63/74/80/386637480.db2.gz YMOUMTGHXUZJGE-VIFPVBQESA-N 1 2 239.750 2.472 20 0 BEADLO CCCC1(CNC(=O)c2c[nH+]c(C)[nH]2)CC1 ZINC000268454702 386655997 /nfs/dbraw/zinc/65/59/97/386655997.db2.gz YSASGEBAOQIWLU-UHFFFAOYSA-N 1 2 221.304 2.028 20 0 BEADLO CCN(C[C@H](C)OC)c1cc[nH+]c(C2CC2)n1 ZINC000292238469 386638753 /nfs/dbraw/zinc/63/87/53/386638753.db2.gz GGDYHUYLICREEQ-JTQLQIEISA-N 1 2 235.331 2.215 20 0 BEADLO CCOc1ccccc1C[N@H+](C)CCF ZINC000268320083 386642063 /nfs/dbraw/zinc/64/20/63/386642063.db2.gz SSLFCZATLUKPCP-UHFFFAOYSA-N 1 2 211.280 2.487 20 0 BEADLO CCOc1ccccc1C[N@@H+](C)CCF ZINC000268320083 386642070 /nfs/dbraw/zinc/64/20/70/386642070.db2.gz SSLFCZATLUKPCP-UHFFFAOYSA-N 1 2 211.280 2.487 20 0 BEADLO FC[C@@H]1CCC[N@@H+]1Cc1nccs1 ZINC000292912999 386648267 /nfs/dbraw/zinc/64/82/67/386648267.db2.gz BGBCZGQGYUTFML-QMMMGPOBSA-N 1 2 200.282 2.077 20 0 BEADLO FC[C@@H]1CCC[N@H+]1Cc1nccs1 ZINC000292912999 386648271 /nfs/dbraw/zinc/64/82/71/386648271.db2.gz BGBCZGQGYUTFML-QMMMGPOBSA-N 1 2 200.282 2.077 20 0 BEADLO c1ccc(N2CCOC[C@@H](C3CCC3)C2)[nH+]c1 ZINC000292313407 386650644 /nfs/dbraw/zinc/65/06/44/386650644.db2.gz OIQFXNXBLPORGT-ZDUSSCGKSA-N 1 2 232.327 2.335 20 0 BEADLO CN(CC1CCCCC1)C(=O)CCc1[nH]cc[nH+]1 ZINC000279227128 386651750 /nfs/dbraw/zinc/65/17/50/386651750.db2.gz PVBXVOROKLPMEE-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO CCO[C@@H](CC)C(=O)Nc1c(C)cc[nH+]c1C ZINC000644972851 386651961 /nfs/dbraw/zinc/65/19/61/386651961.db2.gz MIYANNNNBXIABO-NSHDSACASA-N 1 2 236.315 2.452 20 0 BEADLO C[N@H+](CCCC(C)(C)C)Cc1nnc[nH]1 ZINC000337184365 386654588 /nfs/dbraw/zinc/65/45/88/386654588.db2.gz NSOFKGNTJFHCAN-UHFFFAOYSA-N 1 2 210.325 2.063 20 0 BEADLO C[N@@H+](CCCC(C)(C)C)Cc1nnc[nH]1 ZINC000337184365 386654591 /nfs/dbraw/zinc/65/45/91/386654591.db2.gz NSOFKGNTJFHCAN-UHFFFAOYSA-N 1 2 210.325 2.063 20 0 BEADLO C[C@@H](Nc1cc[nH+]c2ccncc12)[C@H]1CCOC1 ZINC000278874572 386600521 /nfs/dbraw/zinc/60/05/21/386600521.db2.gz ZRWROKHHAFBPDX-MNOVXSKESA-N 1 2 243.310 2.467 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CCC[C@H]2CCC[C@H]21 ZINC000278969024 386612759 /nfs/dbraw/zinc/61/27/59/386612759.db2.gz XKEPNUCUFAPWSY-DGCLKSJQSA-N 1 2 247.342 2.052 20 0 BEADLO C=Cc1ccc(CC[NH2+][C@@H](CC)C(=O)OC)cc1 ZINC000292041482 386613774 /nfs/dbraw/zinc/61/37/74/386613774.db2.gz YJYCBJKLIFMKSS-AWEZNQCLSA-N 1 2 247.338 2.413 20 0 BEADLO CC[C@]1(C(C)C)C[C@@H]1NC(=O)CCn1cc[nH+]c1 ZINC000457279039 386613944 /nfs/dbraw/zinc/61/39/44/386613944.db2.gz LJHLHDDKAOIZIU-GXTWGEPZSA-N 1 2 249.358 2.214 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1nc(C)cs1 ZINC000268047321 386614246 /nfs/dbraw/zinc/61/42/46/386614246.db2.gz SHMDQPKEFOESNS-MNOVXSKESA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1nc(C)cs1 ZINC000268047321 386614250 /nfs/dbraw/zinc/61/42/50/386614250.db2.gz SHMDQPKEFOESNS-MNOVXSKESA-N 1 2 240.372 2.451 20 0 BEADLO Cc1ccc2[nH+]c(CNCC(F)(F)F)cn2c1 ZINC000268073876 386616716 /nfs/dbraw/zinc/61/67/16/386616716.db2.gz SFXYARQLMATHLZ-UHFFFAOYSA-N 1 2 243.232 2.295 20 0 BEADLO CC[C@H](CCO)CNc1cc[nH+]c2ccncc12 ZINC000268063179 386617087 /nfs/dbraw/zinc/61/70/87/386617087.db2.gz ZNRUUVXIFZJMCX-LLVKDONJSA-N 1 2 245.326 2.450 20 0 BEADLO CC[C@H](O)CCNc1cc(C)[nH+]c(C2CC2)n1 ZINC000268686221 386682126 /nfs/dbraw/zinc/68/21/26/386682126.db2.gz NQXLEPRCBLGNKF-NSHDSACASA-N 1 2 235.331 2.235 20 0 BEADLO Cc1cc(NC(=O)N(C)[C@@H](C)C2CCC2)cc[nH+]1 ZINC000357005398 386682343 /nfs/dbraw/zinc/68/23/43/386682343.db2.gz BGQKXIMLSDIAEK-NSHDSACASA-N 1 2 247.342 2.464 20 0 BEADLO CC[C@H]([NH2+]C[C@H]1CCc2ccccc21)C(=O)OC ZINC000192847965 386676575 /nfs/dbraw/zinc/67/65/75/386676575.db2.gz HBFMHUIUURKIHT-OCCSQVGLSA-N 1 2 247.338 2.258 20 0 BEADLO C[C@@H](Nc1cccc[nH+]1)[C@H](O)Cc1ccccc1 ZINC000120645372 386677380 /nfs/dbraw/zinc/67/73/80/386677380.db2.gz GPPLTSRQQCLKMN-TZMCWYRMSA-N 1 2 242.322 2.486 20 0 BEADLO CC[C@H]([NH2+]CC(F)(F)CO)c1cccc(F)c1 ZINC000188477772 386678849 /nfs/dbraw/zinc/67/88/49/386678849.db2.gz SZDWJVWOUHTCDW-NSHDSACASA-N 1 2 247.260 2.494 20 0 BEADLO Cc1ncc(C[NH+]2CC(C)(CC(F)F)C2)cn1 ZINC000648058665 386679500 /nfs/dbraw/zinc/67/95/00/386679500.db2.gz XIOOHSHKCKDRGH-UHFFFAOYSA-N 1 2 241.285 2.262 20 0 BEADLO CCCCCCNC(=O)COc1cc[nH+]cc1 ZINC000292489890 386679743 /nfs/dbraw/zinc/67/97/43/386679743.db2.gz RLVXBCZYYXXTCT-UHFFFAOYSA-N 1 2 236.315 2.157 20 0 BEADLO CC[C@H]([NH2+]CCc1cc(C)cc(C)c1)C(=O)OC ZINC000192851397 386680172 /nfs/dbraw/zinc/68/01/72/386680172.db2.gz AGWGXMMRFPPUQN-AWEZNQCLSA-N 1 2 249.354 2.387 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1CCO[C@@H]1C ZINC000335531136 386680815 /nfs/dbraw/zinc/68/08/15/386680815.db2.gz WDLGSQLXNZBXNW-GHMZBOCLSA-N 1 2 234.299 2.062 20 0 BEADLO CC[C@H]1CCN1c1cc[nH+]c(C2CC2)n1 ZINC000292383589 386658307 /nfs/dbraw/zinc/65/83/07/386658307.db2.gz SUBRNNJBJLPYDN-JTQLQIEISA-N 1 2 203.289 2.343 20 0 BEADLO COC(=O)C(C)(C)CC[N@@H+]1CCC[C@H]1C(F)F ZINC000353194512 386709062 /nfs/dbraw/zinc/70/90/62/386709062.db2.gz PHRXAPSHAVDEQJ-VIFPVBQESA-N 1 2 249.301 2.305 20 0 BEADLO COC(=O)C(C)(C)CC[N@H+]1CCC[C@H]1C(F)F ZINC000353194512 386709068 /nfs/dbraw/zinc/70/90/68/386709068.db2.gz PHRXAPSHAVDEQJ-VIFPVBQESA-N 1 2 249.301 2.305 20 0 BEADLO COc1ccc(N[C@@H](C)[C@@]2(C)CCCO2)[nH+]c1 ZINC000645437403 386692229 /nfs/dbraw/zinc/69/22/29/386692229.db2.gz CBECRJHOGDLEFW-GXFFZTMASA-N 1 2 236.315 2.460 20 0 BEADLO CO[C@@H](CNc1cc[nH+]c(C(C)(C)C)n1)C1CC1 ZINC000645054372 386696225 /nfs/dbraw/zinc/69/62/25/386696225.db2.gz OVYMGYGZJLNHNN-NSHDSACASA-N 1 2 249.358 2.033 20 0 BEADLO CCc1cc(NCCC2(COC)CCC2)nc[nH+]1 ZINC000645045279 386696679 /nfs/dbraw/zinc/69/66/79/386696679.db2.gz GXHNYQOIUNNGTB-UHFFFAOYSA-N 1 2 249.358 2.080 20 0 BEADLO Cc1cnccc1CC[N@@H+]1CCC=C(F)C1 ZINC000335477420 386703406 /nfs/dbraw/zinc/70/34/06/386703406.db2.gz OHXKONCPQJGEAW-UHFFFAOYSA-N 1 2 220.291 2.492 20 0 BEADLO Cc1cnccc1CC[N@H+]1CCC=C(F)C1 ZINC000335477420 386703408 /nfs/dbraw/zinc/70/34/08/386703408.db2.gz OHXKONCPQJGEAW-UHFFFAOYSA-N 1 2 220.291 2.492 20 0 BEADLO Cn1c2cccc(F)c2[nH]c1=[NH+][C@@H]1C[C@H]2C[C@H]2C1 ZINC000425293162 386707648 /nfs/dbraw/zinc/70/76/48/386707648.db2.gz BGYREFQOJWEOOL-ILWJIGKKSA-N 1 2 245.301 2.345 20 0 BEADLO COC(=O)[C@@H](CC1CC1)[NH2+]Cc1ccc(C)cc1 ZINC000414489256 386707843 /nfs/dbraw/zinc/70/78/43/386707843.db2.gz MTQJWBCSUSIXBA-CQSZACIVSA-N 1 2 247.338 2.426 20 0 BEADLO CC[C@H]([NH2+][C@H]1C[C@@H]1Cc1ccccc1)C(=O)OC ZINC000279739339 386732255 /nfs/dbraw/zinc/73/22/55/386732255.db2.gz KKUJVVKFINNWOC-IHRRRGAJSA-N 1 2 247.338 2.159 20 0 BEADLO CC(C)c1nc(NCc2ccc(F)cn2)cc[nH+]1 ZINC000357187275 386734660 /nfs/dbraw/zinc/73/46/60/386734660.db2.gz YPAIHSRBOVOISA-UHFFFAOYSA-N 1 2 246.289 2.168 20 0 BEADLO C[C@@H]1[C@H](O)CCC[N@@H+]1Cc1cnc(Cl)s1 ZINC000296386950 386713669 /nfs/dbraw/zinc/71/36/69/386713669.db2.gz UBMTYXVAOYPLOE-VXNVDRBHSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H]1[C@H](O)CCC[N@H+]1Cc1cnc(Cl)s1 ZINC000296386950 386713676 /nfs/dbraw/zinc/71/36/76/386713676.db2.gz UBMTYXVAOYPLOE-VXNVDRBHSA-N 1 2 246.763 2.142 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@H](C)CCc1ccsc1 ZINC000336760318 386713786 /nfs/dbraw/zinc/71/37/86/386713786.db2.gz JOXXCHFORZBSQD-ZJUUUORDSA-N 1 2 241.356 2.220 20 0 BEADLO CC[C@@H](Nc1nc(C)[nH+]c2c1CCCC2)[C@H](C)O ZINC000450804275 386713737 /nfs/dbraw/zinc/71/37/37/386713737.db2.gz XYTZEOVEYGKCJN-JOYOIKCWSA-N 1 2 249.358 2.235 20 0 BEADLO COC(=O)CC1(C[N@@H+]2CCC[C@H]2C(F)F)CC1 ZINC000353194877 386714002 /nfs/dbraw/zinc/71/40/02/386714002.db2.gz PYWHVIWSSNFPPG-VIFPVBQESA-N 1 2 247.285 2.059 20 0 BEADLO COC(=O)CC1(C[N@H+]2CCC[C@H]2C(F)F)CC1 ZINC000353194877 386714007 /nfs/dbraw/zinc/71/40/07/386714007.db2.gz PYWHVIWSSNFPPG-VIFPVBQESA-N 1 2 247.285 2.059 20 0 BEADLO O[C@@H]1CC[C@@H]2CN(c3cccc[nH+]3)CC[C@@H]2C1 ZINC000450804678 386714445 /nfs/dbraw/zinc/71/44/45/386714445.db2.gz NHVDUNZPVYOUEO-JHJVBQTASA-N 1 2 232.327 2.069 20 0 BEADLO Cc1ccc(OCC[N@@H+](C)Cc2cocn2)cc1 ZINC000191923432 386717094 /nfs/dbraw/zinc/71/70/94/386717094.db2.gz GQYQNSZYLNANLK-UHFFFAOYSA-N 1 2 246.310 2.494 20 0 BEADLO Cc1ccc(OCC[N@H+](C)Cc2cocn2)cc1 ZINC000191923432 386717099 /nfs/dbraw/zinc/71/70/99/386717099.db2.gz GQYQNSZYLNANLK-UHFFFAOYSA-N 1 2 246.310 2.494 20 0 BEADLO CCN1CC[N@H+](C/C=C(/C)Cl)C(C)(C)C1=O ZINC000528463041 386740150 /nfs/dbraw/zinc/74/01/50/386740150.db2.gz FIRPKAAZKTVFKI-POHAHGRESA-N 1 2 244.766 2.072 20 0 BEADLO CCN1CC[N@@H+](C/C=C(/C)Cl)C(C)(C)C1=O ZINC000528463041 386740160 /nfs/dbraw/zinc/74/01/60/386740160.db2.gz FIRPKAAZKTVFKI-POHAHGRESA-N 1 2 244.766 2.072 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)CC1CCCCC1 ZINC000266940485 386722451 /nfs/dbraw/zinc/72/24/51/386722451.db2.gz BCFXRAFZGDVWAA-UHFFFAOYSA-N 1 2 235.331 2.305 20 0 BEADLO Cc1ccnc(C[NH2+]C2(C(N)=O)CCCCC2)n1 ZINC000330468163 386725624 /nfs/dbraw/zinc/72/56/24/386725624.db2.gz UDTYBCBDXOQRFN-UHFFFAOYSA-N 1 2 248.330 2.113 20 0 BEADLO CCC(CC)[C@H](C)C(=O)NCc1c[nH+]c[nH]1 ZINC000330513541 386744937 /nfs/dbraw/zinc/74/49/37/386744937.db2.gz CJYKYHPWBJLIFW-VIFPVBQESA-N 1 2 223.320 2.098 20 0 BEADLO CCC(CC)[C@H](C)C(=O)NCc1c[nH]c[nH+]1 ZINC000330513541 386744943 /nfs/dbraw/zinc/74/49/43/386744943.db2.gz CJYKYHPWBJLIFW-VIFPVBQESA-N 1 2 223.320 2.098 20 0 BEADLO C[C@H]([NH2+]CCF)c1nc(Cc2ccccc2)no1 ZINC000348530604 386750227 /nfs/dbraw/zinc/75/02/27/386750227.db2.gz JDCFYZSGIQDCCM-JTQLQIEISA-N 1 2 249.289 2.281 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2CC[C@H](C)C2)cc[nH+]1 ZINC000408441652 386750480 /nfs/dbraw/zinc/75/04/80/386750480.db2.gz FWNICKSIPKKKFD-GXSJLCMTSA-N 1 2 233.315 2.122 20 0 BEADLO COC[C@H]([NH2+]Cc1cocn1)c1ccccc1 ZINC000192313109 386752859 /nfs/dbraw/zinc/75/28/59/386752859.db2.gz HUDZFJQOYBRZFX-ZDUSSCGKSA-N 1 2 232.283 2.152 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[NH+]1CCCC1 ZINC000279964687 386759464 /nfs/dbraw/zinc/75/94/64/386759464.db2.gz IOPUSAXIMBFHND-JTQLQIEISA-N 1 2 225.313 2.058 20 0 BEADLO Cc1csc(C[N@@H+]2CCC[C@@H]2CF)n1 ZINC000292998677 386760977 /nfs/dbraw/zinc/76/09/77/386760977.db2.gz IWFYBGGUCYEABJ-SECBINFHSA-N 1 2 214.309 2.385 20 0 BEADLO Cc1csc(C[N@H+]2CCC[C@@H]2CF)n1 ZINC000292998677 386760985 /nfs/dbraw/zinc/76/09/85/386760985.db2.gz IWFYBGGUCYEABJ-SECBINFHSA-N 1 2 214.309 2.385 20 0 BEADLO CC[C@H]([NH2+]Cc1cocn1)c1ccncc1 ZINC000192317968 386762885 /nfs/dbraw/zinc/76/28/85/386762885.db2.gz NOHHDPYLJYJELS-LBPRGKRZSA-N 1 2 217.272 2.311 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@H](C)CCc1ccc(C)cc1 ZINC000279999217 386766168 /nfs/dbraw/zinc/76/61/68/386766168.db2.gz RSVGOMYAHFLMFY-OLZOCXBDSA-N 1 2 249.354 2.467 20 0 BEADLO CC1=CCC[N@@H+](Cc2nnc(C3CCC3)n2C)C1 ZINC000335537688 386742780 /nfs/dbraw/zinc/74/27/80/386742780.db2.gz VLRFZBSOFYABGC-UHFFFAOYSA-N 1 2 246.358 2.235 20 0 BEADLO CC1=CCC[N@H+](Cc2nnc(C3CCC3)n2C)C1 ZINC000335537688 386742788 /nfs/dbraw/zinc/74/27/88/386742788.db2.gz VLRFZBSOFYABGC-UHFFFAOYSA-N 1 2 246.358 2.235 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)C(C)(C)C(C)(C)C ZINC000339911936 386789887 /nfs/dbraw/zinc/78/98/87/386789887.db2.gz OHUVHIQUXGKBTD-UHFFFAOYSA-N 1 2 237.347 2.109 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@@H](C)c2ccccn2)ncn1 ZINC000293255736 386794552 /nfs/dbraw/zinc/79/45/52/386794552.db2.gz RRXWQENAMMJZCM-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cc(C[N@H+](C)[C@@H](C)c2ccccn2)ncn1 ZINC000293255736 386794555 /nfs/dbraw/zinc/79/45/55/386794555.db2.gz RRXWQENAMMJZCM-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO FC(F)(F)[C@@H]([NH2+]CC[C@H]1CCOC1)C1CC1 ZINC000336668795 386795239 /nfs/dbraw/zinc/79/52/39/386795239.db2.gz GJMZTLCTAGEIFP-WPRPVWTQSA-N 1 2 237.265 2.344 20 0 BEADLO Cc1nocc1C[NH2+]Cc1cc(C(C)C)no1 ZINC000645155799 386795601 /nfs/dbraw/zinc/79/56/01/386795601.db2.gz GYZMRSRRHZFACX-UHFFFAOYSA-N 1 2 235.287 2.384 20 0 BEADLO Cc1nn(C)c(C)c1Nc1cc(C)cc[nH+]1 ZINC000269275712 386771208 /nfs/dbraw/zinc/77/12/08/386771208.db2.gz IQUAUIFCTGZSPE-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO Cc1cnc(C[N@@H+]2CCCO[C@H](CF)C2)s1 ZINC000334637889 386775195 /nfs/dbraw/zinc/77/51/95/386775195.db2.gz SOAGHJQHKAHIHV-SNVBAGLBSA-N 1 2 244.335 2.012 20 0 BEADLO Cc1cnc(C[N@H+]2CCCO[C@H](CF)C2)s1 ZINC000334637889 386775199 /nfs/dbraw/zinc/77/51/99/386775199.db2.gz SOAGHJQHKAHIHV-SNVBAGLBSA-N 1 2 244.335 2.012 20 0 BEADLO CCC(CC)[C@H](C)C(=O)NCc1[nH]c[nH+]c1C ZINC000330536985 386779864 /nfs/dbraw/zinc/77/98/64/386779864.db2.gz PRILGTLRFDPGBV-VIFPVBQESA-N 1 2 237.347 2.407 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1cc(F)ccc1F ZINC000293453890 386817997 /nfs/dbraw/zinc/81/79/97/386817997.db2.gz CUEQJSWNSVBJPJ-LLVKDONJSA-N 1 2 227.254 2.186 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1cc(F)ccc1F ZINC000293453890 386818000 /nfs/dbraw/zinc/81/80/00/386818000.db2.gz CUEQJSWNSVBJPJ-LLVKDONJSA-N 1 2 227.254 2.186 20 0 BEADLO Cc1cc(N[C@@H](C)CF)nc(-c2ccncc2)[nH+]1 ZINC000340961597 386819535 /nfs/dbraw/zinc/81/95/35/386819535.db2.gz DTUPKPVHGUIDPL-JTQLQIEISA-N 1 2 246.289 2.039 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)CC2(C)CC2)c2[nH+]ccn21 ZINC000334770522 386822786 /nfs/dbraw/zinc/82/27/86/386822786.db2.gz QQUVJNKMWYGZTA-VHSXEESVSA-N 1 2 233.315 2.195 20 0 BEADLO COc1c(C)cc(C[N@@H+]2CCO[C@H]3C[C@H]32)cc1C ZINC000366543553 386798422 /nfs/dbraw/zinc/79/84/22/386798422.db2.gz IMQZXCLADFPYQV-KGLIPLIRSA-N 1 2 247.338 2.285 20 0 BEADLO COc1c(C)cc(C[N@H+]2CCO[C@H]3C[C@H]32)cc1C ZINC000366543553 386798423 /nfs/dbraw/zinc/79/84/23/386798423.db2.gz IMQZXCLADFPYQV-KGLIPLIRSA-N 1 2 247.338 2.285 20 0 BEADLO CCC[C@@](C)(CC)C(=O)NCc1[nH+]ccn1C ZINC000280590964 386824553 /nfs/dbraw/zinc/82/45/53/386824553.db2.gz SXUIGIYEUXBZKQ-CYBMUJFWSA-N 1 2 237.347 2.253 20 0 BEADLO C[C@H]1CCC[C@H](C[N@H+](CCO)CC(F)F)C1 ZINC000193026715 386812782 /nfs/dbraw/zinc/81/27/82/386812782.db2.gz BAGXLTMXBNVGAC-QWRGUYRKSA-N 1 2 235.318 2.372 20 0 BEADLO C[C@H]1CCC[C@H](C[N@@H+](CCO)CC(F)F)C1 ZINC000193026715 386812791 /nfs/dbraw/zinc/81/27/91/386812791.db2.gz BAGXLTMXBNVGAC-QWRGUYRKSA-N 1 2 235.318 2.372 20 0 BEADLO C[C@H](CC(C)(C)C)C(=O)Nc1cc[nH+]cc1O ZINC000357675241 386825491 /nfs/dbraw/zinc/82/54/91/386825491.db2.gz PWSZDKOXCQVGRX-SECBINFHSA-N 1 2 236.315 2.220 20 0 BEADLO CC1(C)C(CNC(=O)CCc2c[nH+]c[nH]2)C1(C)C ZINC000280629269 386829707 /nfs/dbraw/zinc/82/97/07/386829707.db2.gz SKNXRGMLHWGOJF-UHFFFAOYSA-N 1 2 249.358 2.141 20 0 BEADLO CC1(C)C(CNC(=O)CCc2c[nH]c[nH+]2)C1(C)C ZINC000280629269 386829713 /nfs/dbraw/zinc/82/97/13/386829713.db2.gz SKNXRGMLHWGOJF-UHFFFAOYSA-N 1 2 249.358 2.141 20 0 BEADLO Cc1noc([C@@H]2CCC[N@@H+]2Cc2conc2C)n1 ZINC000293519619 386830184 /nfs/dbraw/zinc/83/01/84/386830184.db2.gz AVUQJGMWNUEPMA-NSHDSACASA-N 1 2 248.286 2.012 20 0 BEADLO Cc1noc([C@@H]2CCC[N@H+]2Cc2conc2C)n1 ZINC000293519619 386830186 /nfs/dbraw/zinc/83/01/86/386830186.db2.gz AVUQJGMWNUEPMA-NSHDSACASA-N 1 2 248.286 2.012 20 0 BEADLO CC(C)n1c[nH+]cc1CN(C)Cc1ccon1 ZINC000425339439 386839333 /nfs/dbraw/zinc/83/93/33/386839333.db2.gz SBXMSOXRMPXPST-UHFFFAOYSA-N 1 2 234.303 2.084 20 0 BEADLO CC(C)n1cncc1C[N@H+](C)Cc1cccn1C ZINC000425340043 386840804 /nfs/dbraw/zinc/84/08/04/386840804.db2.gz UVCJQHGEENYDFE-UHFFFAOYSA-N 1 2 246.358 2.435 20 0 BEADLO CC(C)n1cncc1C[N@@H+](C)Cc1cccn1C ZINC000425340043 386840813 /nfs/dbraw/zinc/84/08/13/386840813.db2.gz UVCJQHGEENYDFE-UHFFFAOYSA-N 1 2 246.358 2.435 20 0 BEADLO CC(C)n1c[nH+]cc1CN(C)Cc1cccn1C ZINC000425340043 386840820 /nfs/dbraw/zinc/84/08/20/386840820.db2.gz UVCJQHGEENYDFE-UHFFFAOYSA-N 1 2 246.358 2.435 20 0 BEADLO CO[C@@]1(C)C[C@@H](Nc2cc(C)[nH+]cn2)C1(C)C ZINC000301427528 386842111 /nfs/dbraw/zinc/84/21/11/386842111.db2.gz MOFKIAYSUXSSKR-MFKMUULPSA-N 1 2 235.331 2.401 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1cc(F)cc(F)c1 ZINC000293578361 386842965 /nfs/dbraw/zinc/84/29/65/386842965.db2.gz NMGBOQISMGLZBD-LBPRGKRZSA-N 1 2 227.254 2.186 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1cc(F)cc(F)c1 ZINC000293578361 386842972 /nfs/dbraw/zinc/84/29/72/386842972.db2.gz NMGBOQISMGLZBD-LBPRGKRZSA-N 1 2 227.254 2.186 20 0 BEADLO Cc1nc(N(C)Cc2ccccn2)c(C)c(C)[nH+]1 ZINC000301445879 386844730 /nfs/dbraw/zinc/84/47/30/386844730.db2.gz PUHUJBFWXMDEHD-UHFFFAOYSA-N 1 2 242.326 2.433 20 0 BEADLO C[C@]1(CO)CCC[C@@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000301454741 386846477 /nfs/dbraw/zinc/84/64/77/386846477.db2.gz MNVZUAXIZNHQLV-SMDDNHRTSA-N 1 2 247.342 2.317 20 0 BEADLO CCCC[C@H]([NH2+][C@H]1CC[C@H]1SC)C(=O)OC ZINC000425335129 386848075 /nfs/dbraw/zinc/84/80/75/386848075.db2.gz HOPMXLXOTUNOOF-GARJFASQSA-N 1 2 245.388 2.202 20 0 BEADLO CCOCC(C)(C)[NH2+]Cc1n[nH]c2ccccc21 ZINC000645190770 386852598 /nfs/dbraw/zinc/85/25/98/386852598.db2.gz XOWGUZBBGZFEBS-UHFFFAOYSA-N 1 2 247.342 2.468 20 0 BEADLO CC(C)n1cncc1C[N@H+](C)Cc1ccncc1 ZINC000425345474 386855828 /nfs/dbraw/zinc/85/58/28/386855828.db2.gz VLTIGKWHCVBNHY-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO CC(C)n1cncc1C[N@@H+](C)Cc1ccncc1 ZINC000425345474 386855836 /nfs/dbraw/zinc/85/58/36/386855836.db2.gz VLTIGKWHCVBNHY-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO CC(C)n1c[nH+]cc1CN(C)Cc1ccncc1 ZINC000425345474 386855841 /nfs/dbraw/zinc/85/58/41/386855841.db2.gz VLTIGKWHCVBNHY-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO C[C@@H](Nc1cc[nH+]c(C(C)(C)C)n1)[C@H](C)CO ZINC000301556901 386856087 /nfs/dbraw/zinc/85/60/87/386856087.db2.gz HMVPZKMPTURRBG-NXEZZACHSA-N 1 2 237.347 2.203 20 0 BEADLO CS[C@@H]1CC[C@H]1[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000425344808 386856720 /nfs/dbraw/zinc/85/67/20/386856720.db2.gz UDKXHUNQBHEXND-IVZWLZJFSA-N 1 2 245.388 2.200 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC=C(F)C2)cn1 ZINC000335742352 386858429 /nfs/dbraw/zinc/85/84/29/386858429.db2.gz YZKFQACPUADHMQ-UHFFFAOYSA-N 1 2 206.264 2.449 20 0 BEADLO Cc1ccc(C[N@H+]2CCC=C(F)C2)cn1 ZINC000335742352 386858434 /nfs/dbraw/zinc/85/84/34/386858434.db2.gz YZKFQACPUADHMQ-UHFFFAOYSA-N 1 2 206.264 2.449 20 0 BEADLO CCC[C@H](O)CNc1cc[nH+]c(C(C)(C)C)n1 ZINC000301587306 386858994 /nfs/dbraw/zinc/85/89/94/386858994.db2.gz PJGXRKMBRPWRBX-JTQLQIEISA-N 1 2 237.347 2.347 20 0 BEADLO CCOC[C@@H]1CCN(c2nc(C)[nH+]c(C)c2C)C1 ZINC000301632124 386860032 /nfs/dbraw/zinc/86/00/32/386860032.db2.gz BUIUMNACAJIGAV-CYBMUJFWSA-N 1 2 249.358 2.265 20 0 BEADLO FC(F)(F)[C@H]1CCC[N@H+](Cc2cnccn2)C1 ZINC000334794717 386862146 /nfs/dbraw/zinc/86/21/46/386862146.db2.gz HYFQSLBAVLDWGO-VIFPVBQESA-N 1 2 245.248 2.251 20 0 BEADLO FC(F)(F)[C@H]1CCC[N@@H+](Cc2cnccn2)C1 ZINC000334794717 386862149 /nfs/dbraw/zinc/86/21/49/386862149.db2.gz HYFQSLBAVLDWGO-VIFPVBQESA-N 1 2 245.248 2.251 20 0 BEADLO FC(F)(F)[C@@H]1CCC[N@H+](Cc2cnccn2)C1 ZINC000334794716 386863647 /nfs/dbraw/zinc/86/36/47/386863647.db2.gz HYFQSLBAVLDWGO-SECBINFHSA-N 1 2 245.248 2.251 20 0 BEADLO FC(F)(F)[C@@H]1CCC[N@@H+](Cc2cnccn2)C1 ZINC000334794716 386863650 /nfs/dbraw/zinc/86/36/50/386863650.db2.gz HYFQSLBAVLDWGO-SECBINFHSA-N 1 2 245.248 2.251 20 0 BEADLO Cc1nc(N2C[C@@H](C)[C@H](C)C2)c(C)c(C)[nH+]1 ZINC000301682183 386868456 /nfs/dbraw/zinc/86/84/56/386868456.db2.gz KBIWGLGQBDGPOZ-RKDXNWHRSA-N 1 2 219.332 2.494 20 0 BEADLO Cc1c[nH+]c(CNc2ccnn2CC(C)C)n1C ZINC000341264786 386870375 /nfs/dbraw/zinc/87/03/75/386870375.db2.gz UAFQBIDJGVDZFS-UHFFFAOYSA-N 1 2 247.346 2.193 20 0 BEADLO CCC(=O)N1CC[N@H+](Cc2cc(C)ccc2C)C1 ZINC000425350782 386870849 /nfs/dbraw/zinc/87/08/49/386870849.db2.gz SQXSUUOQSCVZTL-UHFFFAOYSA-N 1 2 246.354 2.315 20 0 BEADLO CCC(=O)N1CC[N@@H+](Cc2cc(C)ccc2C)C1 ZINC000425350782 386870850 /nfs/dbraw/zinc/87/08/50/386870850.db2.gz SQXSUUOQSCVZTL-UHFFFAOYSA-N 1 2 246.354 2.315 20 0 BEADLO Cn1c[nH+]cc1Cc1noc(-c2ccccc2)n1 ZINC000357953840 386872050 /nfs/dbraw/zinc/87/20/50/386872050.db2.gz UGMCQFVTUDBYNO-UHFFFAOYSA-N 1 2 240.266 2.061 20 0 BEADLO Cc1c(NCc2[nH]cc[nH+]2)cnn1CC(C)C ZINC000341278399 386875473 /nfs/dbraw/zinc/87/54/73/386875473.db2.gz RVVDDQFFGREERC-UHFFFAOYSA-N 1 2 233.319 2.183 20 0 BEADLO CC(C)c1nc(N(C)C)nc(N[C@H](C)C2CC2)[nH+]1 ZINC000301945854 386894717 /nfs/dbraw/zinc/89/47/17/386894717.db2.gz XIEHKODTRFMWCM-SECBINFHSA-N 1 2 249.362 2.271 20 0 BEADLO CC(C)c1nc(N[C@H](C)C2CC2)nc(N(C)C)[nH+]1 ZINC000301945854 386894721 /nfs/dbraw/zinc/89/47/21/386894721.db2.gz XIEHKODTRFMWCM-SECBINFHSA-N 1 2 249.362 2.271 20 0 BEADLO Cc1nc(N2CCC[C@@H]2C[C@@H](C)O)c(C)c(C)[nH+]1 ZINC000301771021 386878062 /nfs/dbraw/zinc/87/80/62/386878062.db2.gz KSYHWUFBWQWWBJ-NOZJJQNGSA-N 1 2 249.358 2.142 20 0 BEADLO C[C@@H]1c2ccccc2C[N@H+]1C[C@H](O)C(F)(F)F ZINC000334839404 386882600 /nfs/dbraw/zinc/88/26/00/386882600.db2.gz YRKOTNBWQVEKDM-KCJUWKMLSA-N 1 2 245.244 2.486 20 0 BEADLO C[C@@H]1c2ccccc2C[N@@H+]1C[C@H](O)C(F)(F)F ZINC000334839404 386882603 /nfs/dbraw/zinc/88/26/03/386882603.db2.gz YRKOTNBWQVEKDM-KCJUWKMLSA-N 1 2 245.244 2.486 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](C)c2cncc(F)c2)n1C ZINC000341339934 386885600 /nfs/dbraw/zinc/88/56/00/386885600.db2.gz BOPAAKAFPLTGSC-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO Cc1c[nH+]c(CN[C@@H](C)c2cncc(F)c2)n1C ZINC000341339934 386885604 /nfs/dbraw/zinc/88/56/04/386885604.db2.gz BOPAAKAFPLTGSC-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO CN(CC1CCC1)c1nc(N)c2ccccc2[nH+]1 ZINC000301877519 386887696 /nfs/dbraw/zinc/88/76/96/386887696.db2.gz HESTVSUXKMVZBF-UHFFFAOYSA-N 1 2 242.326 2.448 20 0 BEADLO c1cncc(C[N@@H+]2C[C@]3(CCCO3)[C@H]2C2CC2)c1 ZINC000293839702 386889190 /nfs/dbraw/zinc/88/91/90/386889190.db2.gz AZRRLLASOACCIM-HUUCEWRRSA-N 1 2 244.338 2.225 20 0 BEADLO c1cncc(C[N@H+]2C[C@]3(CCCO3)[C@H]2C2CC2)c1 ZINC000293839702 386889192 /nfs/dbraw/zinc/88/91/92/386889192.db2.gz AZRRLLASOACCIM-HUUCEWRRSA-N 1 2 244.338 2.225 20 0 BEADLO Cc1cn[nH]c1C[NH2+][C@H](C)c1ccncc1F ZINC000352887006 386889654 /nfs/dbraw/zinc/88/96/54/386889654.db2.gz FRVWJQFGMSMRGW-SECBINFHSA-N 1 2 234.278 2.103 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@H](C)c1ccncc1F ZINC000352887006 386889659 /nfs/dbraw/zinc/88/96/59/386889659.db2.gz FRVWJQFGMSMRGW-SECBINFHSA-N 1 2 234.278 2.103 20 0 BEADLO C[C@@H]1C[C@@H](C)N1c1cc[nH+]c(C2CC2)n1 ZINC000335769123 386913969 /nfs/dbraw/zinc/91/39/69/386913969.db2.gz FBNSTHWQDOATTN-RKDXNWHRSA-N 1 2 203.289 2.341 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@@H](CF)C2)ccc1F ZINC000334864507 386918918 /nfs/dbraw/zinc/91/89/18/386918918.db2.gz PRWIYUKNRYXSFX-LBPRGKRZSA-N 1 2 241.281 2.304 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@@H](CF)C2)ccc1F ZINC000334864507 386918923 /nfs/dbraw/zinc/91/89/23/386918923.db2.gz PRWIYUKNRYXSFX-LBPRGKRZSA-N 1 2 241.281 2.304 20 0 BEADLO CC(C)[C@H]1CN(c2cccc[nH+]2)CCCO1 ZINC000293925815 386903469 /nfs/dbraw/zinc/90/34/69/386903469.db2.gz FASDAKLEGLOEJL-GFCCVEGCSA-N 1 2 220.316 2.333 20 0 BEADLO CCC[C@H](C)C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456371500 386904945 /nfs/dbraw/zinc/90/49/45/386904945.db2.gz IKCDYLXBYCEMIB-HBNTYKKESA-N 1 2 235.331 2.441 20 0 BEADLO O=[S@](Cc1cn2ccccc2[nH+]1)C1CCC1 ZINC000334854133 386905361 /nfs/dbraw/zinc/90/53/61/386905361.db2.gz DXSIHYQEVBMEBH-MRXNPFEDSA-N 1 2 234.324 2.136 20 0 BEADLO Cc1cc(NCc2cccc3cc[nH]c32)nc[nH+]1 ZINC000341487794 386912030 /nfs/dbraw/zinc/91/20/30/386912030.db2.gz ZCNIGNRIZUQHOG-UHFFFAOYSA-N 1 2 238.294 2.300 20 0 BEADLO CCCc1nc(C[N@@H+]2C[C@H]3CCCC[C@H]32)no1 ZINC000368001508 386927410 /nfs/dbraw/zinc/92/74/10/386927410.db2.gz PEMBQFUUODDANU-GHMZBOCLSA-N 1 2 235.331 2.397 20 0 BEADLO CCCc1nc(C[N@H+]2C[C@H]3CCCC[C@H]32)no1 ZINC000368001508 386927416 /nfs/dbraw/zinc/92/74/16/386927416.db2.gz PEMBQFUUODDANU-GHMZBOCLSA-N 1 2 235.331 2.397 20 0 BEADLO CCCn1ncnc1C[N@@H+]1C[C@H]2CCCC[C@H]21 ZINC000367999674 386929166 /nfs/dbraw/zinc/92/91/66/386929166.db2.gz DJWBZDVMGVSFLR-VXGBXAGGSA-N 1 2 234.347 2.063 20 0 BEADLO CCCn1ncnc1C[N@H+]1C[C@H]2CCCC[C@H]21 ZINC000367999674 386929170 /nfs/dbraw/zinc/92/91/70/386929170.db2.gz DJWBZDVMGVSFLR-VXGBXAGGSA-N 1 2 234.347 2.063 20 0 BEADLO CN(CC1CCC1)c1cc(N2CCCC2)nc[nH+]1 ZINC000302918517 386947536 /nfs/dbraw/zinc/94/75/36/386947536.db2.gz XUKIHXFVRVNWBR-UHFFFAOYSA-N 1 2 246.358 2.313 20 0 BEADLO CN(CC1CCC1)c1cc(N2CCCC2)[nH+]cn1 ZINC000302918517 386947538 /nfs/dbraw/zinc/94/75/38/386947538.db2.gz XUKIHXFVRVNWBR-UHFFFAOYSA-N 1 2 246.358 2.313 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CC[C@@H](C)C2)cc[nH+]1 ZINC000334886223 386958154 /nfs/dbraw/zinc/95/81/54/386958154.db2.gz OJPMPJLIEZFDES-MWLCHTKSSA-N 1 2 218.300 2.187 20 0 BEADLO Cn1cc[nH+]c1CN(CC(F)F)CC1CCC1 ZINC000341751794 386960831 /nfs/dbraw/zinc/96/08/31/386960831.db2.gz SFZSJVZLWMALPF-UHFFFAOYSA-N 1 2 243.301 2.287 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H](C)Cc2ccsc2)c[nH+]1 ZINC000518988952 386973074 /nfs/dbraw/zinc/97/30/74/386973074.db2.gz MMBLUXYKCIXKHX-QMMMGPOBSA-N 1 2 249.339 2.141 20 0 BEADLO COc1cccc(CNc2c[nH+]cc(C)c2)n1 ZINC000191541287 386973860 /nfs/dbraw/zinc/97/38/60/386973860.db2.gz ILXLGCWXLYJHCA-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO CS[C@H]1CC[C@H]1[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000425361247 386982316 /nfs/dbraw/zinc/98/23/16/386982316.db2.gz UDKXHUNQBHEXND-BBBLOLIVSA-N 1 2 245.388 2.200 20 0 BEADLO CS[C@H]1CC[C@H]1[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000425362114 386983085 /nfs/dbraw/zinc/98/30/85/386983085.db2.gz UDKXHUNQBHEXND-AEJSXWLSSA-N 1 2 245.388 2.200 20 0 BEADLO Cc1c[nH+]c(C)nc1NC[C@H]1CCOC(C)(C)C1 ZINC000519000197 386983267 /nfs/dbraw/zinc/98/32/67/386983267.db2.gz ZDLHRPCCTKDOOH-LBPRGKRZSA-N 1 2 249.358 2.132 20 0 BEADLO Cn1ncc2c1nc[nH+]c2NCc1ccsc1 ZINC000052129395 386990319 /nfs/dbraw/zinc/99/03/19/386990319.db2.gz XRVVTRUXHGXYPX-UHFFFAOYSA-N 1 2 245.311 2.037 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1nc(-c2ccoc2)no1 ZINC000334919066 386994822 /nfs/dbraw/zinc/99/48/22/386994822.db2.gz BFRXJNRCQOUPOQ-DTWKUNHWSA-N 1 2 233.271 2.170 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1nc(-c2ccoc2)no1 ZINC000334919066 386994824 /nfs/dbraw/zinc/99/48/24/386994824.db2.gz BFRXJNRCQOUPOQ-DTWKUNHWSA-N 1 2 233.271 2.170 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nc(-c3ccoc3)no2)[C@@H]1C ZINC000334919068 386995347 /nfs/dbraw/zinc/99/53/47/386995347.db2.gz BFRXJNRCQOUPOQ-RKDXNWHRSA-N 1 2 233.271 2.170 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nc(-c3ccoc3)no2)[C@@H]1C ZINC000334919068 386995350 /nfs/dbraw/zinc/99/53/50/386995350.db2.gz BFRXJNRCQOUPOQ-RKDXNWHRSA-N 1 2 233.271 2.170 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@H]3C[C@H]32)cc1 ZINC000368636556 386995390 /nfs/dbraw/zinc/99/53/90/386995390.db2.gz VONLUEDCQSUWDI-KGLIPLIRSA-N 1 2 217.312 2.222 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@H]3C[C@H]32)cc1 ZINC000368636556 386995394 /nfs/dbraw/zinc/99/53/94/386995394.db2.gz VONLUEDCQSUWDI-KGLIPLIRSA-N 1 2 217.312 2.222 20 0 BEADLO CO[C@@H](C)CCC(=O)Nc1c(C)cc[nH+]c1C ZINC000331234011 386997314 /nfs/dbraw/zinc/99/73/14/386997314.db2.gz CIYFGSLBDFIZRF-JTQLQIEISA-N 1 2 236.315 2.452 20 0 BEADLO CCOc1ccc(C[NH2+]Cc2cocn2)cc1 ZINC000264549929 387000218 /nfs/dbraw/zinc/00/02/18/387000218.db2.gz CMGJPTXYGZWIBC-UHFFFAOYSA-N 1 2 232.283 2.363 20 0 BEADLO CC[C@@H](NC(=O)[C@@H](C)C(F)(F)F)c1[nH]cc[nH+]1 ZINC000331262856 387000891 /nfs/dbraw/zinc/00/08/91/387000891.db2.gz DXFRAGHNRQYXNA-RNFRBKRXSA-N 1 2 249.236 2.175 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCC[C@H](OCC2CC2)C1 ZINC000368676033 387002081 /nfs/dbraw/zinc/00/20/81/387002081.db2.gz QRRWDLJRLKVWOR-ZDUSSCGKSA-N 1 2 249.358 2.109 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCC[C@H](OCC2CC2)C1 ZINC000368676033 387002083 /nfs/dbraw/zinc/00/20/83/387002083.db2.gz QRRWDLJRLKVWOR-ZDUSSCGKSA-N 1 2 249.358 2.109 20 0 BEADLO CCC(CC)C(=O)N[C@@H](c1[nH+]ccn1C)C1CC1 ZINC000341685459 386950005 /nfs/dbraw/zinc/95/00/05/386950005.db2.gz DHFBGYUFHCSBAI-GFCCVEGCSA-N 1 2 249.358 2.424 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@H]2CCC[C@@H](C)C2)c[nH+]1 ZINC000264827033 387038431 /nfs/dbraw/zinc/03/84/31/387038431.db2.gz IGIMELSKVOALJF-KOLCDFICSA-N 1 2 235.331 2.274 20 0 BEADLO CCc1c[nH]c(SCc2cc[nH+]c(N)c2)n1 ZINC000193092705 387066658 /nfs/dbraw/zinc/06/66/58/387066658.db2.gz VTXUKPSLYYTQSU-UHFFFAOYSA-N 1 2 234.328 2.242 20 0 BEADLO COc1c(O)cccc1C[NH2+]Cc1ccco1 ZINC000359048438 387049979 /nfs/dbraw/zinc/04/99/79/387049979.db2.gz BGMGVXPUIQJYOF-UHFFFAOYSA-N 1 2 233.267 2.284 20 0 BEADLO c1cc2[nH+]ccc(NC[C@@H]3CC34CC4)c2cn1 ZINC000334968506 387053285 /nfs/dbraw/zinc/05/32/85/387053285.db2.gz QXRQBJVOLOGJQC-JTQLQIEISA-N 1 2 225.295 2.264 20 0 BEADLO F[C@H]1CC[N@H+](Cc2cccc3c2OCCO3)C1 ZINC000336222896 387064041 /nfs/dbraw/zinc/06/40/41/387064041.db2.gz TXNZQQWGFUEKMW-NSHDSACASA-N 1 2 237.274 2.002 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2cccc3c2OCCO3)C1 ZINC000336222896 387064043 /nfs/dbraw/zinc/06/40/43/387064043.db2.gz TXNZQQWGFUEKMW-NSHDSACASA-N 1 2 237.274 2.002 20 0 BEADLO C[C@@H]1CC2(CCC2)CN1C(=O)CCc1[nH]cc[nH+]1 ZINC000334937601 387014685 /nfs/dbraw/zinc/01/46/85/387014685.db2.gz CBQPUBVYIOZINX-LLVKDONJSA-N 1 2 247.342 2.133 20 0 BEADLO Cc1cn2c([nH+]1)CN(C(=O)[C@H](C)CC(C)C)CC2 ZINC000368870866 387018547 /nfs/dbraw/zinc/01/85/47/387018547.db2.gz URKIDUJKZFRTIT-LLVKDONJSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1ccc(C[NH+]2Cc3ccccc3C2)nn1 ZINC000334880788 387023366 /nfs/dbraw/zinc/02/33/66/387023366.db2.gz FJQGLYZMGLQLFE-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO Cc1cc(F)c(C[NH+]2CC(CCO)C2)c(F)c1 ZINC000425367154 387024017 /nfs/dbraw/zinc/02/40/17/387024017.db2.gz HOMNHAMJWNKYST-UHFFFAOYSA-N 1 2 241.281 2.087 20 0 BEADLO Cc1cc(F)c(C[NH2+]CCF)c(F)c1 ZINC000425376699 387029975 /nfs/dbraw/zinc/02/99/75/387029975.db2.gz FOJIIDVFPBDLOO-UHFFFAOYSA-N 1 2 203.207 2.332 20 0 BEADLO Cc1cc(CNC(=O)N2CCC[C@H]2C)cc(C)[nH+]1 ZINC000334985548 387073278 /nfs/dbraw/zinc/07/32/78/387073278.db2.gz FJMRPLBUCPFPRK-GFCCVEGCSA-N 1 2 247.342 2.392 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@@H](C(C)C)C2)cn1 ZINC000334986844 387074825 /nfs/dbraw/zinc/07/48/25/387074825.db2.gz BFTOMNUOSBAOGC-CQSZACIVSA-N 1 2 234.343 2.247 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@@H](C(C)C)C2)cn1 ZINC000334986844 387074828 /nfs/dbraw/zinc/07/48/28/387074828.db2.gz BFTOMNUOSBAOGC-CQSZACIVSA-N 1 2 234.343 2.247 20 0 BEADLO CC[C@H]1C[N@H+](Cc2nnc(C)s2)CCS1 ZINC000336244813 387081330 /nfs/dbraw/zinc/08/13/30/387081330.db2.gz JCTLZJHMEJNVJG-VIFPVBQESA-N 1 2 243.401 2.174 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2nnc(C)s2)CCS1 ZINC000336244813 387081334 /nfs/dbraw/zinc/08/13/34/387081334.db2.gz JCTLZJHMEJNVJG-VIFPVBQESA-N 1 2 243.401 2.174 20 0 BEADLO Cc1ccc(C)c(NC(=O)NCc2[nH]cc[nH+]2)c1 ZINC000119076540 387093278 /nfs/dbraw/zinc/09/32/78/387093278.db2.gz NQSOUKQHQFECDR-UHFFFAOYSA-N 1 2 244.298 2.348 20 0 BEADLO c1c[nH]c(C[NH2+]Cc2nccc3ccccc32)n1 ZINC000067695158 387097301 /nfs/dbraw/zinc/09/73/01/387097301.db2.gz GOVYWTWMUOOOMU-UHFFFAOYSA-N 1 2 238.294 2.248 20 0 BEADLO CC(C)(C)OC(=O)NCc1cn2ccccc2[nH+]1 ZINC000071435389 387105590 /nfs/dbraw/zinc/10/55/90/387105590.db2.gz MKCBJVCLYMDQKC-UHFFFAOYSA-N 1 2 247.298 2.359 20 0 BEADLO COC[C@H]1CCN(c2cc(C)[nH+]c(C(C)C)n2)C1 ZINC000352364567 387113763 /nfs/dbraw/zinc/11/37/63/387113763.db2.gz FYDUINKKPYYNIN-LBPRGKRZSA-N 1 2 249.358 2.381 20 0 BEADLO OCC(F)(F)C[NH2+]Cc1cccc(C2CC2)c1 ZINC000228648164 387114963 /nfs/dbraw/zinc/11/49/63/387114963.db2.gz PHCOOIHWVRNZTH-UHFFFAOYSA-N 1 2 241.281 2.281 20 0 BEADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc[nH]n1 ZINC000336284537 387117912 /nfs/dbraw/zinc/11/79/12/387117912.db2.gz ZIXSULGYJOJFSA-CBAPKCEASA-N 1 2 233.237 2.182 20 0 BEADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1cc[nH]n1 ZINC000336284537 387117915 /nfs/dbraw/zinc/11/79/15/387117915.db2.gz ZIXSULGYJOJFSA-CBAPKCEASA-N 1 2 233.237 2.182 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)[C@H]1CCCC1(C)C ZINC000228905962 387127161 /nfs/dbraw/zinc/12/71/61/387127161.db2.gz BSGNYVZTNSLSHH-SNVBAGLBSA-N 1 2 235.331 2.194 20 0 BEADLO CCCn1cc(C[N@@H+]2CCO[C@@H]3CCC[C@@H]32)cn1 ZINC000352382722 387129747 /nfs/dbraw/zinc/12/97/47/387129747.db2.gz GBVJZYYHPYUUGF-UONOGXRCSA-N 1 2 249.358 2.046 20 0 BEADLO CCCn1cc(C[N@H+]2CCO[C@@H]3CCC[C@@H]32)cn1 ZINC000352382722 387129752 /nfs/dbraw/zinc/12/97/52/387129752.db2.gz GBVJZYYHPYUUGF-UONOGXRCSA-N 1 2 249.358 2.046 20 0 BEADLO CC[C@@H](C)CNc1ccc(Cn2cc[nH+]c2)cn1 ZINC000353133971 387142183 /nfs/dbraw/zinc/14/21/83/387142183.db2.gz GTOAILADGAUWTN-GFCCVEGCSA-N 1 2 244.342 2.206 20 0 BEADLO c1nc(N[C@H]2CCCOCC2)cc(NC2CC2)[nH+]1 ZINC000334025852 387149835 /nfs/dbraw/zinc/14/98/35/387149835.db2.gz HEEBBPDWSPIEGO-JTQLQIEISA-N 1 2 248.330 2.032 20 0 BEADLO c1nc(NC2CC2)cc(N[C@H]2CCCOCC2)[nH+]1 ZINC000334025852 387149843 /nfs/dbraw/zinc/14/98/43/387149843.db2.gz HEEBBPDWSPIEGO-JTQLQIEISA-N 1 2 248.330 2.032 20 0 BEADLO c1nc(N[C@@H]2CCCOCC2)cc(NC2CC2)[nH+]1 ZINC000334025853 387150546 /nfs/dbraw/zinc/15/05/46/387150546.db2.gz HEEBBPDWSPIEGO-SNVBAGLBSA-N 1 2 248.330 2.032 20 0 BEADLO c1nc(NC2CC2)cc(N[C@@H]2CCCOCC2)[nH+]1 ZINC000334025853 387150552 /nfs/dbraw/zinc/15/05/52/387150552.db2.gz HEEBBPDWSPIEGO-SNVBAGLBSA-N 1 2 248.330 2.032 20 0 BEADLO CCCCC(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000371177267 387162355 /nfs/dbraw/zinc/16/23/55/387162355.db2.gz RVWANICAZBQCCD-UHFFFAOYSA-N 1 2 235.331 2.306 20 0 BEADLO CCCCC(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000371177267 387162363 /nfs/dbraw/zinc/16/23/63/387162363.db2.gz RVWANICAZBQCCD-UHFFFAOYSA-N 1 2 235.331 2.306 20 0 BEADLO Cn1ccc(C[N@@H+]2CCC[C@H]2c2cccnc2)n1 ZINC000336338843 387163609 /nfs/dbraw/zinc/16/36/09/387163609.db2.gz DQXMNOFSGRUNCF-AWEZNQCLSA-N 1 2 242.326 2.152 20 0 BEADLO Cn1ccc(C[N@H+]2CCC[C@H]2c2cccnc2)n1 ZINC000336338843 387163612 /nfs/dbraw/zinc/16/36/12/387163612.db2.gz DQXMNOFSGRUNCF-AWEZNQCLSA-N 1 2 242.326 2.152 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCOC[C@H]1CC(F)F ZINC000353289345 387173369 /nfs/dbraw/zinc/17/33/69/387173369.db2.gz UCACLARGKDWXCB-RKDXNWHRSA-N 1 2 225.254 2.091 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCOC[C@H]1CC(F)F ZINC000353289345 387173377 /nfs/dbraw/zinc/17/33/77/387173377.db2.gz UCACLARGKDWXCB-RKDXNWHRSA-N 1 2 225.254 2.091 20 0 BEADLO CCc1ccc(C[N@@H+]2C[C@@H](C)OC[C@H]2C)cn1 ZINC000336346833 387176299 /nfs/dbraw/zinc/17/62/99/387176299.db2.gz YLLGXNOHGQLVJZ-VXGBXAGGSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1ccc(C[N@H+]2C[C@@H](C)OC[C@H]2C)cn1 ZINC000336346833 387176302 /nfs/dbraw/zinc/17/63/02/387176302.db2.gz YLLGXNOHGQLVJZ-VXGBXAGGSA-N 1 2 234.343 2.253 20 0 BEADLO Cc1ccc(C[N@@H+](C)[C@@H]2CCN(C3CC3)C2)o1 ZINC000353325934 387180371 /nfs/dbraw/zinc/18/03/71/387180371.db2.gz AUDDNZDLSPHDQF-CYBMUJFWSA-N 1 2 234.343 2.257 20 0 BEADLO Cc1ccc(C[N@H+](C)[C@@H]2CCN(C3CC3)C2)o1 ZINC000353325934 387180374 /nfs/dbraw/zinc/18/03/74/387180374.db2.gz AUDDNZDLSPHDQF-CYBMUJFWSA-N 1 2 234.343 2.257 20 0 BEADLO Cc1cn2c([nH+]1)[C@@H](CNC(=O)CC(C)C)CCC2 ZINC000371254868 387180516 /nfs/dbraw/zinc/18/05/16/387180516.db2.gz APETZTRFQBUYDD-GFCCVEGCSA-N 1 2 249.358 2.231 20 0 BEADLO C[C@H](CNC(=O)C1CC(C)(C)C1)Cn1cc[nH+]c1 ZINC000353367202 387190925 /nfs/dbraw/zinc/19/09/25/387190925.db2.gz YFEYKQUBWXQMMN-LLVKDONJSA-N 1 2 249.358 2.072 20 0 BEADLO CSc1ccc(NCc2c[nH+]cn2C)cn1 ZINC000119389761 387133207 /nfs/dbraw/zinc/13/32/07/387133207.db2.gz OMBLHGHBRIRWNH-UHFFFAOYSA-N 1 2 234.328 2.149 20 0 BEADLO c1csc(C[N@@H+]2CCC[C@H]2c2ncon2)c1 ZINC000371374164 387202067 /nfs/dbraw/zinc/20/20/67/387202067.db2.gz PTBYYPSZORVXRI-JTQLQIEISA-N 1 2 235.312 2.468 20 0 BEADLO c1csc(C[N@H+]2CCC[C@H]2c2ncon2)c1 ZINC000371374164 387202070 /nfs/dbraw/zinc/20/20/70/387202070.db2.gz PTBYYPSZORVXRI-JTQLQIEISA-N 1 2 235.312 2.468 20 0 BEADLO C[C@@H]1CC[C@H]1[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000571955892 387207587 /nfs/dbraw/zinc/20/75/87/387207587.db2.gz BEEGMFNVDPPIBJ-RTXFEEFZSA-N 1 2 242.326 2.282 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCO[C@H]2CCC[C@@H]21 ZINC000336378395 387209036 /nfs/dbraw/zinc/20/90/36/387209036.db2.gz CNLIFWGEEYGLRL-KBPBESRZSA-N 1 2 249.358 2.217 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCO[C@H]2CCC[C@@H]21 ZINC000336378395 387209038 /nfs/dbraw/zinc/20/90/38/387209038.db2.gz CNLIFWGEEYGLRL-KBPBESRZSA-N 1 2 249.358 2.217 20 0 BEADLO Cc1oncc1C[N@@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000336395588 387224709 /nfs/dbraw/zinc/22/47/09/387224709.db2.gz MQXFNNUSIADESI-GFCCVEGCSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1oncc1C[N@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000336395588 387224712 /nfs/dbraw/zinc/22/47/12/387224712.db2.gz MQXFNNUSIADESI-GFCCVEGCSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1csc(C[NH2+][C@H](C)c2nccnc2C)n1 ZINC000187735167 387231975 /nfs/dbraw/zinc/23/19/75/387231975.db2.gz ANTQRDIRGSMGNI-SNVBAGLBSA-N 1 2 248.355 2.401 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CCC23CCC3)o1 ZINC000336408319 387235535 /nfs/dbraw/zinc/23/55/35/387235535.db2.gz QKLGKMUKYNPMJN-UHFFFAOYSA-N 1 2 221.304 2.321 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CCC23CCC3)o1 ZINC000336408319 387235539 /nfs/dbraw/zinc/23/55/39/387235539.db2.gz QKLGKMUKYNPMJN-UHFFFAOYSA-N 1 2 221.304 2.321 20 0 BEADLO Cc1noc([C@@H](C)[NH2+]Cc2ccc(C)nc2C)n1 ZINC000360235143 387247658 /nfs/dbraw/zinc/24/76/58/387247658.db2.gz RYPFAMOJOXQWRG-SNVBAGLBSA-N 1 2 246.314 2.241 20 0 BEADLO CC/C=C(\C)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000360223507 387248381 /nfs/dbraw/zinc/24/83/81/387248381.db2.gz VVEXQUFPHWNDJA-YQJFHSMKSA-N 1 2 247.342 2.403 20 0 BEADLO Cc1cnn(C)c1CNc1ccc(C)[nH+]c1 ZINC000285018246 387249084 /nfs/dbraw/zinc/24/90/84/387249084.db2.gz FELVUQCCJIRHHV-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO C[C@@H]([NH2+][C@H](C(N)=O)c1ccccc1)c1ccco1 ZINC000120492578 387250432 /nfs/dbraw/zinc/25/04/32/387250432.db2.gz RPMKUSOHPMQKNU-MFKMUULPSA-N 1 2 244.294 2.157 20 0 BEADLO CC(C)[C@H]1CCCC[C@H]1NCC(F)(F)C[NH3+] ZINC000423347405 387197946 /nfs/dbraw/zinc/19/79/46/387197946.db2.gz QJJOGCOJFDDFOT-GHMZBOCLSA-N 1 2 234.334 2.385 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H]2[C@H](C)CCC[C@@H]2C)c[nH+]1 ZINC000267159258 387277245 /nfs/dbraw/zinc/27/72/45/387277245.db2.gz YOBSJUZVLCTKED-GDGBQDQQSA-N 1 2 235.331 2.273 20 0 BEADLO CCc1ccc(C[N@@H+]2CCOCC23CCC3)cn1 ZINC000336447507 387278201 /nfs/dbraw/zinc/27/82/01/387278201.db2.gz IXFOWGRYCBNWBS-UHFFFAOYSA-N 1 2 246.354 2.399 20 0 BEADLO CCc1ccc(C[N@H+]2CCOCC23CCC3)cn1 ZINC000336447507 387278205 /nfs/dbraw/zinc/27/82/05/387278205.db2.gz IXFOWGRYCBNWBS-UHFFFAOYSA-N 1 2 246.354 2.399 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2CCC[C@@H](O)C2)c(C)[nH+]1 ZINC000336452699 387280208 /nfs/dbraw/zinc/28/02/08/387280208.db2.gz NLGOEVFADLSMMU-NWDGAFQWSA-N 1 2 248.326 2.188 20 0 BEADLO C[N@H+](Cc1ccon1)Cc1cccc2c[nH]nc21 ZINC000353826258 387282284 /nfs/dbraw/zinc/28/22/84/387282284.db2.gz YTQUFJRAMMJAHO-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO C[N@@H+](Cc1ccon1)Cc1cccc2c[nH]nc21 ZINC000353826258 387282288 /nfs/dbraw/zinc/28/22/88/387282288.db2.gz YTQUFJRAMMJAHO-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@H]1CC[C@@H](C)C[C@@H]1C ZINC000514731648 387282308 /nfs/dbraw/zinc/28/23/08/387282308.db2.gz QMBVLPFLSJJMDK-JFGNBEQYSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@@H]1CC[C@@H](C)C[C@@H]1C ZINC000514731648 387282311 /nfs/dbraw/zinc/28/23/11/387282311.db2.gz QMBVLPFLSJJMDK-JFGNBEQYSA-N 1 2 249.358 2.202 20 0 BEADLO CO[C@H](C)C[N@H+](C)C/C(Cl)=C/Cl ZINC000285736202 387284118 /nfs/dbraw/zinc/28/41/18/387284118.db2.gz QDYQIFJGWQAGGM-UDGZVJEDSA-N 1 2 212.120 2.272 20 0 BEADLO CO[C@H](C)C[N@@H+](C)C/C(Cl)=C/Cl ZINC000285736202 387284123 /nfs/dbraw/zinc/28/41/23/387284123.db2.gz QDYQIFJGWQAGGM-UDGZVJEDSA-N 1 2 212.120 2.272 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N(C)c1ccccc1 ZINC000572254595 387287790 /nfs/dbraw/zinc/28/77/90/387287790.db2.gz TWCDMPLZHLDLQZ-LLVKDONJSA-N 1 2 243.310 2.251 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N(C)c1ccccc1 ZINC000572254595 387287795 /nfs/dbraw/zinc/28/77/95/387287795.db2.gz TWCDMPLZHLDLQZ-LLVKDONJSA-N 1 2 243.310 2.251 20 0 BEADLO Cc1ccc(CN2CCn3cc[nH+]c3C2)cc1F ZINC000336471912 387300856 /nfs/dbraw/zinc/30/08/56/387300856.db2.gz ABDKRELOECXFIW-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO COC[C@H](C)N(C)c1cc(C)[nH+]c(C(C)C)n1 ZINC000354039097 387318915 /nfs/dbraw/zinc/31/89/15/387318915.db2.gz PFZLRIDAXMYGPT-NSHDSACASA-N 1 2 237.347 2.380 20 0 BEADLO COc1nccnc1C[NH2+][C@H](C)c1ccsc1 ZINC000648571071 387356495 /nfs/dbraw/zinc/35/64/95/387356495.db2.gz BQQCUDWIUGGCPQ-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO C[C@@H]1C[C@H]1CC(=O)NCCCNc1cccc[nH+]1 ZINC000354379474 387367407 /nfs/dbraw/zinc/36/74/07/387367407.db2.gz CLJIMKHYKOTIFZ-NEPJUHHUSA-N 1 2 247.342 2.046 20 0 BEADLO Cc1nnc(C[N@@H+]2CC[C@H]2c2ccccc2)o1 ZINC000336552623 387373283 /nfs/dbraw/zinc/37/32/83/387373283.db2.gz HXSXKNKCWGMDDP-LBPRGKRZSA-N 1 2 229.283 2.325 20 0 BEADLO Cc1nnc(C[N@H+]2CC[C@H]2c2ccccc2)o1 ZINC000336552623 387373288 /nfs/dbraw/zinc/37/32/88/387373288.db2.gz HXSXKNKCWGMDDP-LBPRGKRZSA-N 1 2 229.283 2.325 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H]1C[C@H](c2ccccc2)[C@H]1C ZINC000373491669 387374727 /nfs/dbraw/zinc/37/47/27/387374727.db2.gz XBLAYPWFCOLABJ-MHDGFBEUSA-N 1 2 247.338 2.330 20 0 BEADLO Cn1ccnc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000336553383 387375508 /nfs/dbraw/zinc/37/55/08/387375508.db2.gz YHDJEJXEAPGEGO-CYBMUJFWSA-N 1 2 227.311 2.367 20 0 BEADLO Cn1ccnc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000336553383 387375512 /nfs/dbraw/zinc/37/55/12/387375512.db2.gz YHDJEJXEAPGEGO-CYBMUJFWSA-N 1 2 227.311 2.367 20 0 BEADLO CC[C@@H]1C[C@H](Nc2ccc(OC)c[nH+]2)CCO1 ZINC000648481892 387381183 /nfs/dbraw/zinc/38/11/83/387381183.db2.gz QXWLHLJYVQUGAR-GHMZBOCLSA-N 1 2 236.315 2.460 20 0 BEADLO CC[C@H]1COCCN1C(=O)Nc1cc[nH+]cc1C ZINC000121245272 387319936 /nfs/dbraw/zinc/31/99/36/387319936.db2.gz FIHBDADZHLPRLO-NSHDSACASA-N 1 2 249.314 2.033 20 0 BEADLO Cn1ncnc1C[NH+]1CCC(C2CCCC2)CC1 ZINC000372705040 387322082 /nfs/dbraw/zinc/32/20/82/387322082.db2.gz SQNJYHFWQYJKHR-UHFFFAOYSA-N 1 2 248.374 2.217 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCO[C@@H](C2CCC2)C1 ZINC000515071994 387332163 /nfs/dbraw/zinc/33/21/63/387332163.db2.gz GETFMRDVDYCDMB-CYBMUJFWSA-N 1 2 247.342 2.099 20 0 BEADLO Cc1nc2[nH]ccc2c(NC[C@@H]2C[C@H]2C2CC2)[nH+]1 ZINC000572353130 387341591 /nfs/dbraw/zinc/34/15/91/387341591.db2.gz IUOQCPSGHJRQCG-JQWIXIFHSA-N 1 2 242.326 2.146 20 0 BEADLO Cc1nnc(C[NH+]2CCC(C(F)F)CC2)s1 ZINC000336520759 387346612 /nfs/dbraw/zinc/34/66/12/387346612.db2.gz UPFNJYVFFWKMPZ-UHFFFAOYSA-N 1 2 247.314 2.324 20 0 BEADLO CC[C@H]1C[C@@H](C)CN1C(=O)Nc1cc[nH+]c(C)c1 ZINC000336528572 387353400 /nfs/dbraw/zinc/35/34/00/387353400.db2.gz VWUHWJMDMSLJIX-MFKMUULPSA-N 1 2 247.342 2.464 20 0 BEADLO COCc1ccc(C[N@@H+]2C[C@H](C)OC[C@@H]2C)o1 ZINC000271072751 387440868 /nfs/dbraw/zinc/44/08/68/387440868.db2.gz ORJCJFYPSUQIDF-QWRGUYRKSA-N 1 2 239.315 2.035 20 0 BEADLO COCc1ccc(C[N@H+]2C[C@H](C)OC[C@@H]2C)o1 ZINC000271072751 387440871 /nfs/dbraw/zinc/44/08/71/387440871.db2.gz ORJCJFYPSUQIDF-QWRGUYRKSA-N 1 2 239.315 2.035 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1cccc(F)c1 ZINC000336576931 387399675 /nfs/dbraw/zinc/39/96/75/387399675.db2.gz CQWDVZOQEKWLID-UHFFFAOYSA-N 1 2 244.269 2.457 20 0 BEADLO CC[C@H](O)CCCNc1cc(C)[nH+]c(C2CC2)n1 ZINC000361097526 387401442 /nfs/dbraw/zinc/40/14/42/387401442.db2.gz PJOMIJLXJBWZSK-LBPRGKRZSA-N 1 2 249.358 2.047 20 0 BEADLO C[N@@H+](Cc1ccoc1)Cc1cncs1 ZINC000352650492 387408317 /nfs/dbraw/zinc/40/83/17/387408317.db2.gz XXXREILHESNOTB-UHFFFAOYSA-N 1 2 208.286 2.368 20 0 BEADLO C[N@H+](Cc1ccoc1)Cc1cncs1 ZINC000352650492 387408320 /nfs/dbraw/zinc/40/83/20/387408320.db2.gz XXXREILHESNOTB-UHFFFAOYSA-N 1 2 208.286 2.368 20 0 BEADLO Cn1ncc(Cl)c1C[N@H+](C)[C@H]1CC1(C)C ZINC000336582839 387408459 /nfs/dbraw/zinc/40/84/59/387408459.db2.gz NLDDRMMPQCABJX-JTQLQIEISA-N 1 2 227.739 2.304 20 0 BEADLO Cn1ncc(Cl)c1C[N@@H+](C)[C@H]1CC1(C)C ZINC000336582839 387408462 /nfs/dbraw/zinc/40/84/62/387408462.db2.gz NLDDRMMPQCABJX-JTQLQIEISA-N 1 2 227.739 2.304 20 0 BEADLO Cc1c[nH+]c(C)nc1NCc1cccs1 ZINC000516517702 387518566 /nfs/dbraw/zinc/51/85/66/387518566.db2.gz YSKWNQYCLCBCQE-UHFFFAOYSA-N 1 2 219.313 2.189 20 0 BEADLO FC1(C[N@@H+]2CCc3ncsc3C2)CC1 ZINC000527234063 387543782 /nfs/dbraw/zinc/54/37/82/387543782.db2.gz LYZWVWADEJVWBZ-UHFFFAOYSA-N 1 2 212.293 2.003 20 0 BEADLO FC1(C[N@H+]2CCc3ncsc3C2)CC1 ZINC000527234063 387543787 /nfs/dbraw/zinc/54/37/87/387543787.db2.gz LYZWVWADEJVWBZ-UHFFFAOYSA-N 1 2 212.293 2.003 20 0 BEADLO CC(C)[N@H+](CCC1(O)CCC1)CC(F)F ZINC000396933584 387521678 /nfs/dbraw/zinc/52/16/78/387521678.db2.gz ZJNCFRBWPVIUMV-UHFFFAOYSA-N 1 2 221.291 2.267 20 0 BEADLO CC(C)[N@@H+](CCC1(O)CCC1)CC(F)F ZINC000396933584 387521682 /nfs/dbraw/zinc/52/16/82/387521682.db2.gz ZJNCFRBWPVIUMV-UHFFFAOYSA-N 1 2 221.291 2.267 20 0 BEADLO Cc1ccc(C[N@@H+]2CCOCC2(C)C)cn1 ZINC000122410752 387527717 /nfs/dbraw/zinc/52/77/17/387527717.db2.gz ZSUJSDVSWPNNKK-UHFFFAOYSA-N 1 2 220.316 2.001 20 0 BEADLO Cc1ccc(C[N@H+]2CCOCC2(C)C)cn1 ZINC000122410752 387527725 /nfs/dbraw/zinc/52/77/25/387527725.db2.gz ZSUJSDVSWPNNKK-UHFFFAOYSA-N 1 2 220.316 2.001 20 0 BEADLO Fc1ccc(CN2CCC[C@@H]2c2[nH]cc[nH+]2)cn1 ZINC000375355538 387531288 /nfs/dbraw/zinc/53/12/88/387531288.db2.gz JSBYPTGODCJYGG-LLVKDONJSA-N 1 2 246.289 2.281 20 0 BEADLO COC1(C[NH2+]Cc2ccn[nH]2)CCC(C)CC1 ZINC000355423853 387535428 /nfs/dbraw/zinc/53/54/28/387535428.db2.gz MNDQZUCGWCKKCY-UHFFFAOYSA-N 1 2 237.347 2.095 20 0 BEADLO Cc1ccnc(N2CC[NH+](CC3(F)CC3)CC2)c1 ZINC000527218575 387537964 /nfs/dbraw/zinc/53/79/64/387537964.db2.gz HQAKPVDJJAMIRB-UHFFFAOYSA-N 1 2 249.333 2.014 20 0 BEADLO CN(CCCn1cc[nH+]c1)c1cccc(O)c1 ZINC000516170605 387478237 /nfs/dbraw/zinc/47/82/37/387478237.db2.gz VLBOXWCYDGXWEC-UHFFFAOYSA-N 1 2 231.299 2.115 20 0 BEADLO Cc1cn2c([nH+]1)CN(C(=O)[C@H](C)C(C)(C)C)CC2 ZINC000374691196 387481425 /nfs/dbraw/zinc/48/14/25/387481425.db2.gz CODJQNZXUUJZIH-NSHDSACASA-N 1 2 249.358 2.216 20 0 BEADLO COC(=O)C[N@H+](Cc1ccc(C)cc1C)C1CC1 ZINC000355142533 387487711 /nfs/dbraw/zinc/48/77/11/387487711.db2.gz XBMAGBZXAVDODZ-UHFFFAOYSA-N 1 2 247.338 2.441 20 0 BEADLO COC(=O)C[N@@H+](Cc1ccc(C)cc1C)C1CC1 ZINC000355142533 387487716 /nfs/dbraw/zinc/48/77/16/387487716.db2.gz XBMAGBZXAVDODZ-UHFFFAOYSA-N 1 2 247.338 2.441 20 0 BEADLO COC1(C)C[NH+](Cc2ccc(F)cc2C)C1 ZINC000362315486 387595016 /nfs/dbraw/zinc/59/50/16/387595016.db2.gz AGAKYBRLYHAHGF-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO c1cn(CCCOc2ccc3c(c2)OCO3)c[nH+]1 ZINC000041297087 387595801 /nfs/dbraw/zinc/59/58/01/387595801.db2.gz CLIAJKZXBNXRAO-UHFFFAOYSA-N 1 2 246.266 2.081 20 0 BEADLO CC[C@@H](C)C(=O)N(C)Cc1cn2c([nH+]1)CCCC2 ZINC000375949087 387596259 /nfs/dbraw/zinc/59/62/59/387596259.db2.gz SCBQDYGKKRTLNG-LLVKDONJSA-N 1 2 249.358 2.224 20 0 BEADLO CCCc1nc(C[N@@H+]2CC3CCC2CC3)no1 ZINC000362339767 387599458 /nfs/dbraw/zinc/59/94/58/387599458.db2.gz IERKXGKYTUEHSX-UHFFFAOYSA-N 1 2 235.331 2.397 20 0 BEADLO CCCc1nc(C[N@H+]2CC3CCC2CC3)no1 ZINC000362339767 387599461 /nfs/dbraw/zinc/59/94/61/387599461.db2.gz IERKXGKYTUEHSX-UHFFFAOYSA-N 1 2 235.331 2.397 20 0 BEADLO Cc1noc([C@H](C)[N@H+](C)Cc2ccnc(C)c2)n1 ZINC000527539907 387609576 /nfs/dbraw/zinc/60/95/76/387609576.db2.gz YACYHFVOWVCUHJ-JTQLQIEISA-N 1 2 246.314 2.274 20 0 BEADLO Cc1noc([C@H](C)[N@@H+](C)Cc2ccnc(C)c2)n1 ZINC000527539907 387609580 /nfs/dbraw/zinc/60/95/80/387609580.db2.gz YACYHFVOWVCUHJ-JTQLQIEISA-N 1 2 246.314 2.274 20 0 BEADLO CC(C)(C)[C@H]1CCN(C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000356041243 387610373 /nfs/dbraw/zinc/61/03/73/387610373.db2.gz QZPCMANSKPHOST-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H](CC(C)(C)C)C(=O)NCCc1[nH]cc[nH+]1 ZINC000356089952 387616118 /nfs/dbraw/zinc/61/61/18/387616118.db2.gz GPXSRKHKBGCGOE-JTQLQIEISA-N 1 2 237.347 2.141 20 0 BEADLO FC(F)(F)COCCOc1cc[nH+]cc1 ZINC000356103454 387616350 /nfs/dbraw/zinc/61/63/50/387616350.db2.gz YFJZWVJSPDUDOO-UHFFFAOYSA-N 1 2 221.178 2.039 20 0 BEADLO CCc1ccc(C[N@H+](C)[C@H](C)C(=O)OC)s1 ZINC000527241719 387548267 /nfs/dbraw/zinc/54/82/67/387548267.db2.gz GLPKVUVRDOROMK-SECBINFHSA-N 1 2 241.356 2.304 20 0 BEADLO CCc1ccc(C[N@@H+](C)[C@H](C)C(=O)OC)s1 ZINC000527241719 387548271 /nfs/dbraw/zinc/54/82/71/387548271.db2.gz GLPKVUVRDOROMK-SECBINFHSA-N 1 2 241.356 2.304 20 0 BEADLO CC(C)c1nc(N[C@@H](C)[C@@H]2CCCOC2)cc[nH+]1 ZINC000355572113 387551786 /nfs/dbraw/zinc/55/17/86/387551786.db2.gz ZRAVWRYVKTZINL-NWDGAFQWSA-N 1 2 249.358 2.249 20 0 BEADLO Cc1nn(C)c(C)c1CNc1c[nH+]cc(C)c1 ZINC000119593249 387555754 /nfs/dbraw/zinc/55/57/54/387555754.db2.gz RCEGFGQRUHZNCV-UHFFFAOYSA-N 1 2 230.315 2.352 20 0 BEADLO c1cnn(-c2ccc([NH2+]C3CCOCC3)cc2)c1 ZINC000036977672 387558535 /nfs/dbraw/zinc/55/85/35/387558535.db2.gz RUBWQQMBZCXIAI-UHFFFAOYSA-N 1 2 243.310 2.463 20 0 BEADLO CCCc1csc(C[N@H+](C)[C@H]2CCOC2)n1 ZINC000426395696 387564550 /nfs/dbraw/zinc/56/45/50/387564550.db2.gz KMLLISKADSDAIX-NSHDSACASA-N 1 2 240.372 2.316 20 0 BEADLO CCCc1csc(C[N@@H+](C)[C@H]2CCOC2)n1 ZINC000426395696 387564554 /nfs/dbraw/zinc/56/45/54/387564554.db2.gz KMLLISKADSDAIX-NSHDSACASA-N 1 2 240.372 2.316 20 0 BEADLO c1ccc(N2CC[C@@]3(C2)CCCOC3)[nH+]c1 ZINC000376472668 387636236 /nfs/dbraw/zinc/63/62/36/387636236.db2.gz FHUFXACQAALYGC-CYBMUJFWSA-N 1 2 218.300 2.089 20 0 BEADLO CC[C@H](NC(=O)c1cccs1)c1[nH]cc[nH+]1 ZINC000125327581 387650826 /nfs/dbraw/zinc/65/08/26/387650826.db2.gz OAPKKZSNECOPES-QMMMGPOBSA-N 1 2 235.312 2.352 20 0 BEADLO C[C@@H](O)C[N@H+](C)Cc1ncc(Cl)cc1Cl ZINC000305812251 387654197 /nfs/dbraw/zinc/65/41/97/387654197.db2.gz JLXDENADIPWTPX-SSDOTTSWSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@@H](O)C[N@@H+](C)Cc1ncc(Cl)cc1Cl ZINC000305812251 387654202 /nfs/dbraw/zinc/65/42/02/387654202.db2.gz JLXDENADIPWTPX-SSDOTTSWSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@H](O)C[N@H+](C)Cc1ncc(Cl)cc1Cl ZINC000305812252 387655673 /nfs/dbraw/zinc/65/56/73/387655673.db2.gz JLXDENADIPWTPX-ZETCQYMHSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@H](O)C[N@@H+](C)Cc1ncc(Cl)cc1Cl ZINC000305812252 387655678 /nfs/dbraw/zinc/65/56/78/387655678.db2.gz JLXDENADIPWTPX-ZETCQYMHSA-N 1 2 249.141 2.201 20 0 BEADLO Cc1cc(C[NH2+]CC(C)(F)F)ccn1 ZINC000527710240 387670328 /nfs/dbraw/zinc/67/03/28/387670328.db2.gz AGAZAFMXJVZJEZ-UHFFFAOYSA-N 1 2 200.232 2.135 20 0 BEADLO CC[C@@H](F)C[N@H+](C)CC(=O)Nc1ccccc1 ZINC000440710255 387678958 /nfs/dbraw/zinc/67/89/58/387678958.db2.gz LGPSKGMQBRXYDT-LLVKDONJSA-N 1 2 238.306 2.305 20 0 BEADLO CC[C@@H](F)C[N@@H+](C)CC(=O)Nc1ccccc1 ZINC000440710255 387678963 /nfs/dbraw/zinc/67/89/63/387678963.db2.gz LGPSKGMQBRXYDT-LLVKDONJSA-N 1 2 238.306 2.305 20 0 BEADLO CCC[C@H]1C[N@H+](C[C@@H](F)CC)CCO1 ZINC000440771602 387688955 /nfs/dbraw/zinc/68/89/55/387688955.db2.gz RLCONZCVPIFULB-QWRGUYRKSA-N 1 2 203.301 2.235 20 0 BEADLO CCC[C@H]1C[N@@H+](C[C@@H](F)CC)CCO1 ZINC000440771602 387688959 /nfs/dbraw/zinc/68/89/59/387688959.db2.gz RLCONZCVPIFULB-QWRGUYRKSA-N 1 2 203.301 2.235 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCO[C@H]3C[C@H]32)cc1 ZINC000367831678 387756280 /nfs/dbraw/zinc/75/62/80/387756280.db2.gz JUAOFLZTUZFKNL-KGLIPLIRSA-N 1 2 233.311 2.058 20 0 BEADLO CCOc1ccc(C[N@H+]2CCO[C@H]3C[C@H]32)cc1 ZINC000367831678 387756287 /nfs/dbraw/zinc/75/62/87/387756287.db2.gz JUAOFLZTUZFKNL-KGLIPLIRSA-N 1 2 233.311 2.058 20 0 BEADLO CC[C@H]([NH2+]C[C@H]1C[C@@H]1c1ccccc1)C(=O)OC ZINC000192848239 387748180 /nfs/dbraw/zinc/74/81/80/387748180.db2.gz PDUFFQNDGXFHSZ-MCIONIFRSA-N 1 2 247.338 2.331 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC[C@@H]1CC[C@@H](C)C1 ZINC000521459025 387750413 /nfs/dbraw/zinc/75/04/13/387750413.db2.gz PZAYMWGBYMXXDH-IJLUTSLNSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC[C@@H]1CC[C@@H](C)C1 ZINC000521459025 387750418 /nfs/dbraw/zinc/75/04/18/387750418.db2.gz PZAYMWGBYMXXDH-IJLUTSLNSA-N 1 2 249.358 2.141 20 0 BEADLO c1c[nH]c(C[NH2+][C@@H](c2ccccn2)C2CCC2)n1 ZINC000527770013 387705234 /nfs/dbraw/zinc/70/52/34/387705234.db2.gz CDJAMALCUIXUGY-CQSZACIVSA-N 1 2 242.326 2.436 20 0 BEADLO C[C@@H]1CC[C@H]1[NH+]=c1[nH]c2ccc(F)cc2n1C ZINC000431414994 387708048 /nfs/dbraw/zinc/70/80/48/387708048.db2.gz PKGVDYAQWWMUBI-PSASIEDQSA-N 1 2 233.290 2.345 20 0 BEADLO CCCN(C)C(=O)NCc1c[nH+]c(C)cc1C ZINC000452045134 387709988 /nfs/dbraw/zinc/70/99/88/387709988.db2.gz SVSSGBHSQHMOGO-UHFFFAOYSA-N 1 2 235.331 2.250 20 0 BEADLO CC1(C)C[N@H+](Cc2ncccn2)[C@@H]2CCC[C@H]2O1 ZINC000440944370 387714165 /nfs/dbraw/zinc/71/41/65/387714165.db2.gz VRNNLZXXXTVEGV-VXGBXAGGSA-N 1 2 247.342 2.009 20 0 BEADLO CC1(C)C[N@@H+](Cc2ncccn2)[C@@H]2CCC[C@H]2O1 ZINC000440944370 387714170 /nfs/dbraw/zinc/71/41/70/387714170.db2.gz VRNNLZXXXTVEGV-VXGBXAGGSA-N 1 2 247.342 2.009 20 0 BEADLO Cc1noc(C)c1CCOc1cc[nH+]cc1 ZINC000431507411 387714459 /nfs/dbraw/zinc/71/44/59/387714459.db2.gz SUGVXCFVTNWCEZ-UHFFFAOYSA-N 1 2 218.256 2.308 20 0 BEADLO C[C@H]([NH2+]Cc1c[nH]nn1)[C@H]1CCC[C@H](C)C1 ZINC000452055454 387716964 /nfs/dbraw/zinc/71/69/64/387716964.db2.gz BYUOVVZJAGVXST-DCAQKATOSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@H]([NH2+]Cc1cn[nH]n1)[C@H]1CCC[C@H](C)C1 ZINC000452055454 387716969 /nfs/dbraw/zinc/71/69/69/387716969.db2.gz BYUOVVZJAGVXST-DCAQKATOSA-N 1 2 222.336 2.109 20 0 BEADLO Fc1ccc(C2([NH2+]Cc3cc[nH]n3)CC2)cc1 ZINC000356876326 387738024 /nfs/dbraw/zinc/73/80/24/387738024.db2.gz OMMMMFHXVYDVMI-UHFFFAOYSA-N 1 2 231.274 2.328 20 0 BEADLO Cc1noc([C@@H](C)[NH2+]Cc2cccc(F)c2)n1 ZINC000356889665 387741546 /nfs/dbraw/zinc/74/15/46/387741546.db2.gz FUECEKZCYQKHED-MRVPVSSYSA-N 1 2 235.262 2.368 20 0 BEADLO COc1ccc[nH+]c1NCCOCC1CCC1 ZINC000527965928 387811863 /nfs/dbraw/zinc/81/18/63/387811863.db2.gz JZLJDKOXBUAORN-UHFFFAOYSA-N 1 2 236.315 2.319 20 0 BEADLO CC[C@H]1CN(c2[nH+]cccc2OC)C[C@@H](C)O1 ZINC000527890160 387774587 /nfs/dbraw/zinc/77/45/87/387774587.db2.gz MZQGJWJNMMDFCB-MNOVXSKESA-N 1 2 236.315 2.094 20 0 BEADLO CC[C@@H]1CN(c2[nH+]cccc2OC)C[C@@H](C)O1 ZINC000527890159 387775130 /nfs/dbraw/zinc/77/51/30/387775130.db2.gz MZQGJWJNMMDFCB-GHMZBOCLSA-N 1 2 236.315 2.094 20 0 BEADLO Cc1cc(NC(=O)NC[C@@H]2CC[C@@H](C)C2)cc[nH+]1 ZINC000432269452 387779112 /nfs/dbraw/zinc/77/91/12/387779112.db2.gz JLRJMOIRBMUZNA-ZYHUDNBSSA-N 1 2 247.342 2.370 20 0 BEADLO Cc1cc(NC(=O)NC[C@@H]2CC[C@H](C)C2)cc[nH+]1 ZINC000432269449 387779452 /nfs/dbraw/zinc/77/94/52/387779452.db2.gz JLRJMOIRBMUZNA-CMPLNLGQSA-N 1 2 247.342 2.370 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC[C@@H]1CC[C@H](C)C1 ZINC000432269221 387779755 /nfs/dbraw/zinc/77/97/55/387779755.db2.gz JEBLKUYUDSXJGD-CMPLNLGQSA-N 1 2 247.342 2.370 20 0 BEADLO CCN(CC1CCC1)C(=O)Nc1cc[nH+]c(C)c1 ZINC000432264885 387779804 /nfs/dbraw/zinc/77/98/04/387779804.db2.gz ONIILWROLMJHFW-UHFFFAOYSA-N 1 2 247.342 2.466 20 0 BEADLO COc1ccc[nH+]c1NCc1ccn(C(C)C)n1 ZINC000527902031 387780521 /nfs/dbraw/zinc/78/05/21/387780521.db2.gz QOUXNLNTNIDYGB-UHFFFAOYSA-N 1 2 246.314 2.480 20 0 BEADLO CC(C)CC1(C(=O)N[C@H](C)Cn2cc[nH+]c2)CC1 ZINC000442287665 387792948 /nfs/dbraw/zinc/79/29/48/387792948.db2.gz BOIRFEHXAZXFGD-GFCCVEGCSA-N 1 2 249.358 2.214 20 0 BEADLO CSCC[N@H+](C)[C@@H](C)c1nc(C2CC2)no1 ZINC000151162657 387804936 /nfs/dbraw/zinc/80/49/36/387804936.db2.gz AKIQOYWCGIYGKV-QMMMGPOBSA-N 1 2 241.360 2.303 20 0 BEADLO CSCC[N@@H+](C)[C@@H](C)c1nc(C2CC2)no1 ZINC000151162657 387804939 /nfs/dbraw/zinc/80/49/39/387804939.db2.gz AKIQOYWCGIYGKV-QMMMGPOBSA-N 1 2 241.360 2.303 20 0 BEADLO O=C(Nc1c[nH+]c2n1CCCC2)[C@H]1[C@@H]2CCC[C@@H]21 ZINC000452335849 387807148 /nfs/dbraw/zinc/80/71/48/387807148.db2.gz RYPBVVSRYOFSJT-IWIIMEHWSA-N 1 2 245.326 2.204 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CCO[C@H](C2CC2)C1 ZINC000527961075 387809417 /nfs/dbraw/zinc/80/94/17/387809417.db2.gz AUTIIUXXSLKLKA-YPMHNXCESA-N 1 2 248.326 2.460 20 0 BEADLO CC1(CO)CN(c2[nH+]ccc3ccccc32)C1 ZINC000528028109 387832125 /nfs/dbraw/zinc/83/21/25/387832125.db2.gz LTOFEJQNZZEEKT-UHFFFAOYSA-N 1 2 228.295 2.053 20 0 BEADLO CC(C)c1nc(NCC[C@H]2CCCOC2)cc[nH+]1 ZINC000528075309 387836616 /nfs/dbraw/zinc/83/66/16/387836616.db2.gz XLVMORQDHICUDP-GFCCVEGCSA-N 1 2 249.358 2.251 20 0 BEADLO C[C@H](O)CCOc1cccc(-n2cc[nH+]c2)c1 ZINC000418886523 387839093 /nfs/dbraw/zinc/83/90/93/387839093.db2.gz RDNZHOGGHQJGNM-NSHDSACASA-N 1 2 232.283 2.022 20 0 BEADLO CC(=O)c1ccc2c(c1)C[N@@H+](C[C@H]1CCCO1)C2 ZINC000058011799 387840434 /nfs/dbraw/zinc/84/04/34/387840434.db2.gz PBRLWXVHYNNTOJ-OAHLLOKOSA-N 1 2 245.322 2.384 20 0 BEADLO CC(=O)c1ccc2c(c1)C[N@H+](C[C@H]1CCCO1)C2 ZINC000058011799 387840438 /nfs/dbraw/zinc/84/04/38/387840438.db2.gz PBRLWXVHYNNTOJ-OAHLLOKOSA-N 1 2 245.322 2.384 20 0 BEADLO COCC1(C)CN(c2cc(C)[nH+]c(C(C)C)n2)C1 ZINC000432931328 387844018 /nfs/dbraw/zinc/84/40/18/387844018.db2.gz BMVVEKUZRRMSGF-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO CCC(C)(C)OC1CN(c2cc(C)[nH+]cn2)C1 ZINC000528126218 387861788 /nfs/dbraw/zinc/86/17/88/387861788.db2.gz GCGGHNTVXZJPIF-UHFFFAOYSA-N 1 2 235.331 2.179 20 0 BEADLO Cc1ccc(CNc2nc[nH+]c(N)c2Cl)cn1 ZINC000235904389 387866153 /nfs/dbraw/zinc/86/61/53/387866153.db2.gz DJPDEWZOBIOWLC-UHFFFAOYSA-N 1 2 249.705 2.028 20 0 BEADLO Cc1cc(N[C@@H]2C[C@]2(C)OC(C)C)nc[nH+]1 ZINC000528202073 387869101 /nfs/dbraw/zinc/86/91/01/387869101.db2.gz BBFWFQFBFAAZCY-PWSUYJOCSA-N 1 2 221.304 2.153 20 0 BEADLO Cc1cc(N[C@H]2[C@@H](C)[C@H](C)O[C@H]2C)nc[nH+]1 ZINC000528203642 387869740 /nfs/dbraw/zinc/86/97/40/387869740.db2.gz DMLUEEGUTSUEKP-GMOBBJLQSA-N 1 2 221.304 2.009 20 0 BEADLO Cc1sccc1C[NH2+][C@H](C)c1ncn(C)n1 ZINC000293148258 387890182 /nfs/dbraw/zinc/89/01/82/387890182.db2.gz DMFUJYVDXQSWHC-MRVPVSSYSA-N 1 2 236.344 2.036 20 0 BEADLO C/C(Cl)=C/C[N@H+]1C[C@H](C)OC[C@H]1C ZINC000528339102 387895928 /nfs/dbraw/zinc/89/59/28/387895928.db2.gz IWTUYYPVJCXWBG-LTAOASPFSA-N 1 2 203.713 2.238 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1C[C@H](C)OC[C@H]1C ZINC000528339102 387895931 /nfs/dbraw/zinc/89/59/31/387895931.db2.gz IWTUYYPVJCXWBG-LTAOASPFSA-N 1 2 203.713 2.238 20 0 BEADLO CC(C)[N@H+](C)Cc1nc([C@H]2CC[C@@H](C)O2)no1 ZINC000528248045 387876497 /nfs/dbraw/zinc/87/64/97/387876497.db2.gz GQHNTOXUOLKBAZ-NXEZZACHSA-N 1 2 239.319 2.150 20 0 BEADLO CC(C)[N@@H+](C)Cc1nc([C@H]2CC[C@@H](C)O2)no1 ZINC000528248045 387876504 /nfs/dbraw/zinc/87/65/04/387876504.db2.gz GQHNTOXUOLKBAZ-NXEZZACHSA-N 1 2 239.319 2.150 20 0 BEADLO C[C@H]1CC[C@@H](Nc2ncnc3c2C[N@H+](C)CC3)C1 ZINC000443989615 387882302 /nfs/dbraw/zinc/88/23/02/387882302.db2.gz PCVBFBUXUSFGRO-WDEREUQCSA-N 1 2 246.358 2.065 20 0 BEADLO C[C@H]1CC[C@@H](Nc2ncnc3c2C[N@@H+](C)CC3)C1 ZINC000443989615 387882308 /nfs/dbraw/zinc/88/23/08/387882308.db2.gz PCVBFBUXUSFGRO-WDEREUQCSA-N 1 2 246.358 2.065 20 0 BEADLO COc1ccc(C[NH2+]CC(C)(F)F)cc1O ZINC000393230624 387882951 /nfs/dbraw/zinc/88/29/51/387882951.db2.gz BBRYIRXCMUFTED-UHFFFAOYSA-N 1 2 231.242 2.146 20 0 BEADLO CC[NH+](CC)Cc1nc([C@H]2CC[C@H](C)O2)no1 ZINC000528234468 387886043 /nfs/dbraw/zinc/88/60/43/387886043.db2.gz KMWYRVRMLSWLAT-VHSXEESVSA-N 1 2 239.319 2.151 20 0 BEADLO C[C@H]1C[N@H+](CCc2c(F)cccc2F)CCO1 ZINC000645764674 387888547 /nfs/dbraw/zinc/88/85/47/387888547.db2.gz RXTFELXVXOOFDU-JTQLQIEISA-N 1 2 241.281 2.228 20 0 BEADLO C[C@H]1C[N@@H+](CCc2c(F)cccc2F)CCO1 ZINC000645764674 387888553 /nfs/dbraw/zinc/88/85/53/387888553.db2.gz RXTFELXVXOOFDU-JTQLQIEISA-N 1 2 241.281 2.228 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H]1[C@H](C)[C@@H]1C1CC1 ZINC000528321320 387900930 /nfs/dbraw/zinc/90/09/30/387900930.db2.gz YJWAMONFDPWPRH-BZHVJNSISA-N 1 2 246.310 2.321 20 0 BEADLO CCn1cc[nH+]c1CN1CCn2cccc2[C@@H]1C ZINC000195514046 387921540 /nfs/dbraw/zinc/92/15/40/387921540.db2.gz NGIHDTYBLRSTJF-LBPRGKRZSA-N 1 2 244.342 2.281 20 0 BEADLO CCn1ccnc1C[N@@H+]1CCn2cccc2[C@@H]1C ZINC000195514046 387921544 /nfs/dbraw/zinc/92/15/44/387921544.db2.gz NGIHDTYBLRSTJF-LBPRGKRZSA-N 1 2 244.342 2.281 20 0 BEADLO CCn1ccnc1C[N@H+]1CCn2cccc2[C@@H]1C ZINC000195514046 387921547 /nfs/dbraw/zinc/92/15/47/387921547.db2.gz NGIHDTYBLRSTJF-LBPRGKRZSA-N 1 2 244.342 2.281 20 0 BEADLO Cc1csc(C[N@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)n1 ZINC000438350100 387924240 /nfs/dbraw/zinc/92/42/40/387924240.db2.gz DIZQNGZWUFLTOY-GARJFASQSA-N 1 2 240.372 2.449 20 0 BEADLO Cc1csc(C[N@@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)n1 ZINC000438350100 387924243 /nfs/dbraw/zinc/92/42/43/387924243.db2.gz DIZQNGZWUFLTOY-GARJFASQSA-N 1 2 240.372 2.449 20 0 BEADLO Cc1csc(C[N@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)n1 ZINC000438350098 387926204 /nfs/dbraw/zinc/92/62/04/387926204.db2.gz DIZQNGZWUFLTOY-DCAQKATOSA-N 1 2 240.372 2.449 20 0 BEADLO Cc1csc(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)n1 ZINC000438350098 387926208 /nfs/dbraw/zinc/92/62/08/387926208.db2.gz DIZQNGZWUFLTOY-DCAQKATOSA-N 1 2 240.372 2.449 20 0 BEADLO CCc1ccc(C[N@@H+]2C[C@H](C)OC[C@H]2C)o1 ZINC000245513001 387953569 /nfs/dbraw/zinc/95/35/69/387953569.db2.gz BTLKDFWOYMQXFY-MNOVXSKESA-N 1 2 223.316 2.451 20 0 BEADLO CCc1ccc(C[N@H+]2C[C@H](C)OC[C@H]2C)o1 ZINC000245513001 387953573 /nfs/dbraw/zinc/95/35/73/387953573.db2.gz BTLKDFWOYMQXFY-MNOVXSKESA-N 1 2 223.316 2.451 20 0 BEADLO FC(F)(F)[C@@H]1C[N@H+](CC2=CCCC2)CCO1 ZINC000645807598 387953631 /nfs/dbraw/zinc/95/36/31/387953631.db2.gz PNDJNVQRSGUSIW-JTQLQIEISA-N 1 2 235.249 2.360 20 0 BEADLO FC(F)(F)[C@@H]1C[N@@H+](CC2=CCCC2)CCO1 ZINC000645807598 387953635 /nfs/dbraw/zinc/95/36/35/387953635.db2.gz PNDJNVQRSGUSIW-JTQLQIEISA-N 1 2 235.249 2.360 20 0 BEADLO CCC[C@H](C)N(C)C(=O)[C@@H]1CCn2cc[nH+]c2C1 ZINC000438578412 387945856 /nfs/dbraw/zinc/94/58/56/387945856.db2.gz WLZDZJAMRHMQSX-NWDGAFQWSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1ccc(F)c(C[NH2+][C@@H](C)c2nncn2C)c1 ZINC000227286617 387958135 /nfs/dbraw/zinc/95/81/35/387958135.db2.gz KEPVMMPTNIQPMM-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)CC(C)(C)C1CC1 ZINC000293181698 387960242 /nfs/dbraw/zinc/96/02/42/387960242.db2.gz JYXQZSKQEIJFLG-UHFFFAOYSA-N 1 2 235.331 2.161 20 0 BEADLO CC(C)C[N@@H+]1CC(=O)N[C@@]12C[C@H](C)C[C@H](C)C2 ZINC000439142002 387981223 /nfs/dbraw/zinc/98/12/23/387981223.db2.gz NGJMYPMVQNJPLJ-IMRBUKKESA-N 1 2 238.375 2.227 20 0 BEADLO CC(C)C[N@H+]1CC(=O)N[C@@]12C[C@H](C)C[C@H](C)C2 ZINC000439142002 387981224 /nfs/dbraw/zinc/98/12/24/387981224.db2.gz NGJMYPMVQNJPLJ-IMRBUKKESA-N 1 2 238.375 2.227 20 0 BEADLO Cc1nc(N[C@@H](C)c2ccc(Cl)cn2)cc[nH+]1 ZINC000439118613 387981403 /nfs/dbraw/zinc/98/14/03/387981403.db2.gz LLCQJLYIMFZTNZ-QMMMGPOBSA-N 1 2 248.717 2.428 20 0 BEADLO C[C@@H](c1cnccn1)[N@@H+]1CCc2ncsc2C1 ZINC000445846754 387973144 /nfs/dbraw/zinc/97/31/44/387973144.db2.gz NIFAEHZRXLMNHM-VIFPVBQESA-N 1 2 246.339 2.052 20 0 BEADLO C[C@@H](c1cnccn1)[N@H+]1CCc2ncsc2C1 ZINC000445846754 387973149 /nfs/dbraw/zinc/97/31/49/387973149.db2.gz NIFAEHZRXLMNHM-VIFPVBQESA-N 1 2 246.339 2.052 20 0 BEADLO C[C@H](O)CCSc1[nH+]cc2ccccn21 ZINC000439277216 387989754 /nfs/dbraw/zinc/98/97/54/387989754.db2.gz OFBZHLBTQXKIPO-VIFPVBQESA-N 1 2 222.313 2.197 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)oc1C ZINC000446071238 387992720 /nfs/dbraw/zinc/99/27/20/387992720.db2.gz IXGLHXDSITVMKB-PEXQALLHSA-N 1 2 238.331 2.289 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)oc1C ZINC000446071238 387992733 /nfs/dbraw/zinc/99/27/33/387992733.db2.gz IXGLHXDSITVMKB-PEXQALLHSA-N 1 2 238.331 2.289 20 0 BEADLO C[C@H](Cn1cccn1)Nc1ccc2c(c1)CC[NH2+]2 ZINC000423215814 387997759 /nfs/dbraw/zinc/99/77/59/387997759.db2.gz NOCMDEGTYUNCQH-LLVKDONJSA-N 1 2 242.326 2.352 20 0 BEADLO CSCCC[N@H+](C)Cc1nnc(C)s1 ZINC000439468775 388001102 /nfs/dbraw/zinc/00/11/02/388001102.db2.gz LHKCZEYZAIDLND-UHFFFAOYSA-N 1 2 231.390 2.031 20 0 BEADLO CSCCC[N@@H+](C)Cc1nnc(C)s1 ZINC000439468775 388001107 /nfs/dbraw/zinc/00/11/07/388001107.db2.gz LHKCZEYZAIDLND-UHFFFAOYSA-N 1 2 231.390 2.031 20 0 BEADLO c1cn2c([nH+]1)[C@H](Nc1cccc3c1CCO3)CC2 ZINC000453201866 388008467 /nfs/dbraw/zinc/00/84/67/388008467.db2.gz BCXDZSXORNBSOT-GFCCVEGCSA-N 1 2 241.294 2.375 20 0 BEADLO CC[C@H]([NH2+][C@H]1CCCc2c1cnn2C)C(F)F ZINC000453233023 388017650 /nfs/dbraw/zinc/01/76/50/388017650.db2.gz GTVNPUNZZMNPBH-UWVGGRQHSA-N 1 2 243.301 2.431 20 0 BEADLO COC[C@@H](C)CC(=O)Nc1ccc(C)[nH+]c1C ZINC000446436581 388020662 /nfs/dbraw/zinc/02/06/62/388020662.db2.gz TWNPBXTXPUFFBZ-VIFPVBQESA-N 1 2 236.315 2.310 20 0 BEADLO CCCCc1noc(C[N@H+](C)C2CC2)n1 ZINC000046602659 388032992 /nfs/dbraw/zinc/03/29/92/388032992.db2.gz LFZNSVVCTSWNRQ-UHFFFAOYSA-N 1 2 209.293 2.006 20 0 BEADLO CCCCc1noc(C[N@@H+](C)C2CC2)n1 ZINC000046602659 388032994 /nfs/dbraw/zinc/03/29/94/388032994.db2.gz LFZNSVVCTSWNRQ-UHFFFAOYSA-N 1 2 209.293 2.006 20 0 BEADLO CO[C@@H]1C[C@@H](Nc2cc[nH+]c(C(C)C)n2)C1(C)C ZINC000440190583 388036244 /nfs/dbraw/zinc/03/62/44/388036244.db2.gz SKVFJYLGCMZEPN-GHMZBOCLSA-N 1 2 249.358 2.247 20 0 BEADLO COC(=O)c1ccc(-c2ccc[nH+]c2N)cc1 ZINC000082729964 388040895 /nfs/dbraw/zinc/04/08/95/388040895.db2.gz QHKHJYWKBPPHJH-UHFFFAOYSA-N 1 2 228.251 2.117 20 0 BEADLO CC[C@@H]([NH2+][C@@H](C)c1cnn(C)c1)C(F)F ZINC000453251412 388026856 /nfs/dbraw/zinc/02/68/56/388026856.db2.gz TWFRCUVSSGWPRO-IONNQARKSA-N 1 2 217.263 2.114 20 0 BEADLO O=C1N=NC([C@@H]2CCC[N@H+](CC3=CCCC3)C2)O1 ZINC000645897192 388057264 /nfs/dbraw/zinc/05/72/64/388057264.db2.gz ZATRNIAMPOPMJH-LLVKDONJSA-N 1 2 249.314 2.065 20 0 BEADLO O=C1N=NC([C@@H]2CCC[N@@H+](CC3=CCCC3)C2)O1 ZINC000645897192 388057269 /nfs/dbraw/zinc/05/72/69/388057269.db2.gz ZATRNIAMPOPMJH-LLVKDONJSA-N 1 2 249.314 2.065 20 0 BEADLO O=c1[nH]nc([C@@H]2CCC[N@H+](CC3=CCCC3)C2)o1 ZINC000645897192 388057271 /nfs/dbraw/zinc/05/72/71/388057271.db2.gz ZATRNIAMPOPMJH-LLVKDONJSA-N 1 2 249.314 2.065 20 0 BEADLO O=c1[nH]nc([C@@H]2CCC[N@@H+](CC3=CCCC3)C2)o1 ZINC000645897192 388057274 /nfs/dbraw/zinc/05/72/74/388057274.db2.gz ZATRNIAMPOPMJH-LLVKDONJSA-N 1 2 249.314 2.065 20 0 BEADLO Cc1nnc(C[NH2+]C2(c3ccccc3C)CC2)o1 ZINC000645979062 388114419 /nfs/dbraw/zinc/11/44/19/388114419.db2.gz SJBLXTIRDMMSPB-UHFFFAOYSA-N 1 2 243.310 2.465 20 0 BEADLO CCn1ncnc1C[NH2+][C@@H](C)c1ccsc1 ZINC000083978128 388068404 /nfs/dbraw/zinc/06/84/04/388068404.db2.gz AFABEQMHRQSNMN-VIFPVBQESA-N 1 2 236.344 2.210 20 0 BEADLO C[C@H]1CCCC[C@H]1C(=O)NCCCn1cc[nH+]c1 ZINC000424532691 388098605 /nfs/dbraw/zinc/09/86/05/388098605.db2.gz XOPSZRZEQWLPCS-QWHCGFSZSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@@H]1CC=C(C(=O)NCCCn2cc[nH+]c2)CC1 ZINC000454170048 388103335 /nfs/dbraw/zinc/10/33/35/388103335.db2.gz XIEXWGMDBXXTNC-GFCCVEGCSA-N 1 2 247.342 2.136 20 0 BEADLO COc1ccc(C[NH2+][C@H](C)c2nccs2)cn1 ZINC000086508160 388104514 /nfs/dbraw/zinc/10/45/14/388104514.db2.gz SDKFOHKHONXZDJ-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO Cn1cc[nH+]c1CNc1ncc(Cl)cc1F ZINC000086710725 388108052 /nfs/dbraw/zinc/10/80/52/388108052.db2.gz FLKKOVQJRMODNP-UHFFFAOYSA-N 1 2 240.669 2.220 20 0 BEADLO CC[C@H]([NH2+]Cc1cccc2cc[nH]c21)C(=O)OC ZINC000083375250 388050215 /nfs/dbraw/zinc/05/02/15/388050215.db2.gz GVRLLQZGKMLITQ-LBPRGKRZSA-N 1 2 246.310 2.209 20 0 BEADLO Cc1nocc1C[N@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000646153311 388157204 /nfs/dbraw/zinc/15/72/04/388157204.db2.gz CXYLAMKBAVHIAN-KWQFWETISA-N 1 2 212.268 2.163 20 0 BEADLO Cc1nocc1C[N@@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000646153311 388157206 /nfs/dbraw/zinc/15/72/06/388157206.db2.gz CXYLAMKBAVHIAN-KWQFWETISA-N 1 2 212.268 2.163 20 0 BEADLO Cc1sccc1C[N@@H+]1CCO[C@H]2C[C@H]21 ZINC000646206787 388164569 /nfs/dbraw/zinc/16/45/69/388164569.db2.gz UDQMLHFLKONCCC-MNOVXSKESA-N 1 2 209.314 2.030 20 0 BEADLO Cc1sccc1C[N@H+]1CCO[C@H]2C[C@H]21 ZINC000646206787 388164571 /nfs/dbraw/zinc/16/45/71/388164571.db2.gz UDQMLHFLKONCCC-MNOVXSKESA-N 1 2 209.314 2.030 20 0 BEADLO CCn1cc[nH+]c1CN(C)Cc1ccco1 ZINC000195513881 388165455 /nfs/dbraw/zinc/16/54/55/388165455.db2.gz BYDQMBDBZKJYIY-UHFFFAOYSA-N 1 2 219.288 2.128 20 0 BEADLO COc1cc(C[NH2+]C(CF)CF)ccc1C ZINC000449379680 388187981 /nfs/dbraw/zinc/18/79/81/388187981.db2.gz JKOUEERGLUSRFN-UHFFFAOYSA-N 1 2 229.270 2.401 20 0 BEADLO C[C@H]1CCC[C@@H](C(=O)N2CCc3[nH]c[nH+]c3C2)C1 ZINC000646260690 388171300 /nfs/dbraw/zinc/17/13/00/388171300.db2.gz ZRTHBNPCXUZQTL-WDEREUQCSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@H]1CCC[C@@H](C(=O)N2CCc3[nH+]c[nH]c3C2)C1 ZINC000646260690 388171303 /nfs/dbraw/zinc/17/13/03/388171303.db2.gz ZRTHBNPCXUZQTL-WDEREUQCSA-N 1 2 247.342 2.121 20 0 BEADLO CCCC[C@@H](C)C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000646257988 388171648 /nfs/dbraw/zinc/17/16/48/388171648.db2.gz WKBZOJYPGDZPGG-SNVBAGLBSA-N 1 2 235.331 2.121 20 0 BEADLO CCCC[C@@H](C)C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000646257988 388171649 /nfs/dbraw/zinc/17/16/49/388171649.db2.gz WKBZOJYPGDZPGG-SNVBAGLBSA-N 1 2 235.331 2.121 20 0 BEADLO COc1ccc(C)cc1C[N@H+](C1CC1)C1COC1 ZINC000449349752 388178861 /nfs/dbraw/zinc/17/88/61/388178861.db2.gz HASRECRVUFSQPV-UHFFFAOYSA-N 1 2 247.338 2.367 20 0 BEADLO COc1ccc(C)cc1C[N@@H+](C1CC1)C1COC1 ZINC000449349752 388178863 /nfs/dbraw/zinc/17/88/63/388178863.db2.gz HASRECRVUFSQPV-UHFFFAOYSA-N 1 2 247.338 2.367 20 0 BEADLO CC[C@H]([NH2+]Cc1cnc(N(C)C)s1)C(F)F ZINC000449360015 388181576 /nfs/dbraw/zinc/18/15/76/388181576.db2.gz INWBXIKZBZKOTE-QMMMGPOBSA-N 1 2 249.330 2.342 20 0 BEADLO CC(C)(NC(=O)CCc1[nH]cc[nH+]1)C1CCC1 ZINC000456175527 388182800 /nfs/dbraw/zinc/18/28/00/388182800.db2.gz WNHSQXBWVPMNOH-UHFFFAOYSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@@H]([NH2+]Cc1cccnc1)C(F)F ZINC000449366573 388182897 /nfs/dbraw/zinc/18/28/97/388182897.db2.gz ZCGRVRVWMKNBSN-SECBINFHSA-N 1 2 200.232 2.215 20 0 BEADLO COc1cccc(C[NH2+]C(CF)CF)c1OC ZINC000449373371 388185193 /nfs/dbraw/zinc/18/51/93/388185193.db2.gz QQQZWLFFISHFJU-UHFFFAOYSA-N 1 2 245.269 2.101 20 0 BEADLO FCC(CF)[NH2+]Cc1ccccc1F ZINC000449372280 388185296 /nfs/dbraw/zinc/18/52/96/388185296.db2.gz FOHQYPHAAQXRES-UHFFFAOYSA-N 1 2 203.207 2.223 20 0 BEADLO CC[C@H]1CCC[C@H]1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000448937800 388121405 /nfs/dbraw/zinc/12/14/05/388121405.db2.gz RJRHQAVLEDSKCO-WDEREUQCSA-N 1 2 235.331 2.194 20 0 BEADLO CCn1nnc(C)c1C[N@H+](C)Cc1ccc(C)o1 ZINC000449001185 388126714 /nfs/dbraw/zinc/12/67/14/388126714.db2.gz CMGZJQWLIIFQBC-UHFFFAOYSA-N 1 2 248.330 2.140 20 0 BEADLO CCn1nnc(C)c1C[N@@H+](C)Cc1ccc(C)o1 ZINC000449001185 388126717 /nfs/dbraw/zinc/12/67/17/388126717.db2.gz CMGZJQWLIIFQBC-UHFFFAOYSA-N 1 2 248.330 2.140 20 0 BEADLO COC(=O)C[N@H+](Cc1csc(C)c1)C1CC1 ZINC000449045743 388135170 /nfs/dbraw/zinc/13/51/70/388135170.db2.gz IYDLFRJUSYYYJL-UHFFFAOYSA-N 1 2 239.340 2.194 20 0 BEADLO COC(=O)C[N@@H+](Cc1csc(C)c1)C1CC1 ZINC000449045743 388135173 /nfs/dbraw/zinc/13/51/73/388135173.db2.gz IYDLFRJUSYYYJL-UHFFFAOYSA-N 1 2 239.340 2.194 20 0 BEADLO CC(C)OC(=O)[C@H](C)[NH2+]C1CC(C(C)C)C1 ZINC000449661603 388249106 /nfs/dbraw/zinc/24/91/06/388249106.db2.gz ITSHDAYFQKISKV-UNXYVOJBSA-N 1 2 227.348 2.351 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@H](F)C2)c(OC)c1 ZINC000449384267 388189482 /nfs/dbraw/zinc/18/94/82/388189482.db2.gz AQWLQVLUUDQULW-NSHDSACASA-N 1 2 239.290 2.248 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@H](F)C2)c(OC)c1 ZINC000449384267 388189484 /nfs/dbraw/zinc/18/94/84/388189484.db2.gz AQWLQVLUUDQULW-NSHDSACASA-N 1 2 239.290 2.248 20 0 BEADLO COc1cc(C[N@@H+]2CC[C@H](F)C2)cc(OC)c1 ZINC000449389517 388191558 /nfs/dbraw/zinc/19/15/58/388191558.db2.gz SMSVUMUHWHKVMH-NSHDSACASA-N 1 2 239.290 2.248 20 0 BEADLO COc1cc(C[N@H+]2CC[C@H](F)C2)cc(OC)c1 ZINC000449389517 388191559 /nfs/dbraw/zinc/19/15/59/388191559.db2.gz SMSVUMUHWHKVMH-NSHDSACASA-N 1 2 239.290 2.248 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)[C@H](C)C1CC1 ZINC000456340641 388195557 /nfs/dbraw/zinc/19/55/57/388195557.db2.gz CRIFZCAYVYYOMK-NXEZZACHSA-N 1 2 235.331 2.126 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@@H]1C[C@@H]1C(C)C ZINC000456349807 388196461 /nfs/dbraw/zinc/19/64/61/388196461.db2.gz JMLDFPAHMXXGPT-QJPTWQEYSA-N 1 2 249.358 2.372 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)CC(C)(F)F ZINC000456356433 388196958 /nfs/dbraw/zinc/19/69/58/388196958.db2.gz OUYWRGQROJEZEC-QMMMGPOBSA-N 1 2 245.273 2.126 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)CCC2CC2)c2[nH+]ccn21 ZINC000456361484 388197583 /nfs/dbraw/zinc/19/75/83/388197583.db2.gz DOJBZLPUBGYADK-GXSJLCMTSA-N 1 2 233.315 2.195 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)C[C@@H]1C=CCC1 ZINC000456375231 388198663 /nfs/dbraw/zinc/19/86/63/388198663.db2.gz GUEOXAYIWQFCFM-VXGBXAGGSA-N 1 2 247.342 2.437 20 0 BEADLO CC[C@]1(C)C[C@@H]1C(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456419150 388200075 /nfs/dbraw/zinc/20/00/75/388200075.db2.gz LMMCJPJLDJYPCY-NJBDSQKTSA-N 1 2 247.342 2.441 20 0 BEADLO C[C@H](NCc1cccc2[nH+]ccn21)C(C)(F)F ZINC000449417751 388200195 /nfs/dbraw/zinc/20/01/95/388200195.db2.gz ZGTOYUFNDXILSS-VIFPVBQESA-N 1 2 239.269 2.468 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)[C@H]2C[C@@H]2C2CC2)c2[nH+]ccn21 ZINC000456420424 388200424 /nfs/dbraw/zinc/20/04/24/388200424.db2.gz MNFSIMAFIOJZRY-YJQGPUDQSA-N 1 2 245.326 2.051 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456426854 388200963 /nfs/dbraw/zinc/20/09/63/388200963.db2.gz QRJOOAKRNQXBOR-GWOFURMSSA-N 1 2 233.315 2.051 20 0 BEADLO C[C@@H]1C[C@@H]1CC(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456431506 388200999 /nfs/dbraw/zinc/20/09/99/388200999.db2.gz SOAXCVLHSMQMPP-DBIOUOCHSA-N 1 2 233.315 2.051 20 0 BEADLO CC[N@H+](Cc1cc(C)ccc1OC)C1COC1 ZINC000449427297 388202529 /nfs/dbraw/zinc/20/25/29/388202529.db2.gz RMLJGXVWJZFAGZ-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO CC[N@@H+](Cc1cc(C)ccc1OC)C1COC1 ZINC000449427297 388202530 /nfs/dbraw/zinc/20/25/30/388202530.db2.gz RMLJGXVWJZFAGZ-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO CO[C@@H](C)c1noc(C[N@H+](C)[C@@H]2CC2(C)C)n1 ZINC000489467982 388216155 /nfs/dbraw/zinc/21/61/55/388216155.db2.gz WYTJZQUJDBXKGW-DTWKUNHWSA-N 1 2 239.319 2.007 20 0 BEADLO CO[C@@H](C)c1noc(C[N@@H+](C)[C@@H]2CC2(C)C)n1 ZINC000489467982 388216157 /nfs/dbraw/zinc/21/61/57/388216157.db2.gz WYTJZQUJDBXKGW-DTWKUNHWSA-N 1 2 239.319 2.007 20 0 BEADLO CC[C@@H]1CCCCN1c1nc(C)[nH+]c(N(C)C)n1 ZINC000489494487 388218878 /nfs/dbraw/zinc/21/88/78/388218878.db2.gz JQFIQFKRPSXRHJ-LLVKDONJSA-N 1 2 249.362 2.015 20 0 BEADLO CC[C@@H]1CCCCN1c1nc(N(C)C)nc(C)[nH+]1 ZINC000489494487 388218880 /nfs/dbraw/zinc/21/88/80/388218880.db2.gz JQFIQFKRPSXRHJ-LLVKDONJSA-N 1 2 249.362 2.015 20 0 BEADLO COC(=O)C[N@H+](C)[C@@H](C)c1ccc2c(c1)CCC2 ZINC000489560255 388221496 /nfs/dbraw/zinc/22/14/96/388221496.db2.gz MDCLEHCKATXECP-NSHDSACASA-N 1 2 247.338 2.341 20 0 BEADLO COC(=O)C[N@@H+](C)[C@@H](C)c1ccc2c(c1)CCC2 ZINC000489560255 388221497 /nfs/dbraw/zinc/22/14/97/388221497.db2.gz MDCLEHCKATXECP-NSHDSACASA-N 1 2 247.338 2.341 20 0 BEADLO c1snnc1C[N@@H+]1C[C@H](C2CC2)[C@H]1C1CC1 ZINC000449531371 388225554 /nfs/dbraw/zinc/22/55/54/388225554.db2.gz BPILDQAWKDHBNU-VXGBXAGGSA-N 1 2 235.356 2.159 20 0 BEADLO c1snnc1C[N@H+]1C[C@H](C2CC2)[C@H]1C1CC1 ZINC000449531371 388225557 /nfs/dbraw/zinc/22/55/57/388225557.db2.gz BPILDQAWKDHBNU-VXGBXAGGSA-N 1 2 235.356 2.159 20 0 BEADLO Cc1cc(C)c(CNC(=O)CC(C)C)c[nH+]1 ZINC000456837746 388226471 /nfs/dbraw/zinc/22/64/71/388226471.db2.gz BUBHKBRBFVQBER-UHFFFAOYSA-N 1 2 220.316 2.361 20 0 BEADLO Cc1cc(C)c(CNC(=O)[C@H]2C[C@@H]2C2CC2)c[nH+]1 ZINC000456846956 388227024 /nfs/dbraw/zinc/22/70/24/388227024.db2.gz UHDXREFCUNFQCL-KGLIPLIRSA-N 1 2 244.338 2.361 20 0 BEADLO Cc1cc(N2CCC[C@H]2CCO)nc(C2CC2)[nH+]1 ZINC000489996653 388230195 /nfs/dbraw/zinc/23/01/95/388230195.db2.gz XPOSFCLLACZUKR-LBPRGKRZSA-N 1 2 247.342 2.014 20 0 BEADLO FC(F)(F)[C@@H]([NH2+][C@H]1CCCOCC1)C1CC1 ZINC000336661881 388259916 /nfs/dbraw/zinc/25/99/16/388259916.db2.gz CTIPWSIXXIPCRO-UWVGGRQHSA-N 1 2 237.265 2.486 20 0 BEADLO Cc1ccccc1C[N@@H+](CC(F)F)C[C@H](C)O ZINC000449630924 388246347 /nfs/dbraw/zinc/24/63/47/388246347.db2.gz NXBDVDPPLCCNLE-NSHDSACASA-N 1 2 243.297 2.443 20 0 BEADLO Cc1ccccc1C[N@H+](CC(F)F)C[C@H](C)O ZINC000449630924 388246348 /nfs/dbraw/zinc/24/63/48/388246348.db2.gz NXBDVDPPLCCNLE-NSHDSACASA-N 1 2 243.297 2.443 20 0 BEADLO COc1cc(C)ccc1C[NH+]1CC(C)(OC)C1 ZINC000459577506 388246608 /nfs/dbraw/zinc/24/66/08/388246608.db2.gz GUVCHCUMPZDXGE-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO C[C@H](O)C[N@@H+](CC1=CCCCC1)CC(F)F ZINC000451826554 388299199 /nfs/dbraw/zinc/29/91/99/388299199.db2.gz FMLQYQVQDVXLJW-JTQLQIEISA-N 1 2 233.302 2.435 20 0 BEADLO C[C@H](O)C[N@H+](CC1=CCCCC1)CC(F)F ZINC000451826554 388299200 /nfs/dbraw/zinc/29/92/00/388299200.db2.gz FMLQYQVQDVXLJW-JTQLQIEISA-N 1 2 233.302 2.435 20 0 BEADLO CC[C@@H](NC(=O)/C=C\c1ccc[nH]1)c1[nH]cc[nH+]1 ZINC000491965184 388329852 /nfs/dbraw/zinc/32/98/52/388329852.db2.gz PNJAPXAQHWPTAG-ISALQUGTSA-N 1 2 244.298 2.019 20 0 BEADLO CC[C@H](NC(=O)/C=C/c1ccc[nH]1)c1[nH]cc[nH+]1 ZINC000491965186 388329858 /nfs/dbraw/zinc/32/98/58/388329858.db2.gz PNJAPXAQHWPTAG-QRGHLMKCSA-N 1 2 244.298 2.019 20 0 BEADLO Cc1cc(NC(=O)C=CC2CCC2)c(C)c[nH+]1 ZINC000492319490 388341309 /nfs/dbraw/zinc/34/13/09/388341309.db2.gz NJBSJSUNXITJFL-VOTSOKGWSA-N 1 2 230.311 2.415 20 0 BEADLO CC[C@H]1CCN(C(=O)/C=C/c2[nH+]ccn2CC)C1 ZINC000492411049 388343767 /nfs/dbraw/zinc/34/37/67/388343767.db2.gz SCKXQCWOUVGURC-FYJFLYSWSA-N 1 2 247.342 2.175 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)NC1(CC)CCC1 ZINC000492413946 388343899 /nfs/dbraw/zinc/34/38/99/388343899.db2.gz YUCDXOWNOWUXIQ-SREVYHEPSA-N 1 2 247.342 2.365 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2ncn(C)n2)s1 ZINC000275837770 388345985 /nfs/dbraw/zinc/34/59/85/388345985.db2.gz PHMZXSRYZKGNPQ-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO CC[N@H+](Cc1csc(NC(C)=O)n1)C(C)C ZINC000193415810 388347021 /nfs/dbraw/zinc/34/70/21/388347021.db2.gz YUHLMPFVOSYWSP-UHFFFAOYSA-N 1 2 241.360 2.332 20 0 BEADLO CC[N@@H+](Cc1csc(NC(C)=O)n1)C(C)C ZINC000193415810 388347023 /nfs/dbraw/zinc/34/70/23/388347023.db2.gz YUHLMPFVOSYWSP-UHFFFAOYSA-N 1 2 241.360 2.332 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2nc3c(s2)CCC3)C1 ZINC000648721618 388354809 /nfs/dbraw/zinc/35/48/09/388354809.db2.gz RESXNCWNRIWRQY-MRVPVSSYSA-N 1 2 226.320 2.176 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2nc3c(s2)CCC3)C1 ZINC000648721618 388354811 /nfs/dbraw/zinc/35/48/11/388354811.db2.gz RESXNCWNRIWRQY-MRVPVSSYSA-N 1 2 226.320 2.176 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000516582834 388358427 /nfs/dbraw/zinc/35/84/27/388358427.db2.gz MEOYULIEOGHXCH-GMTAPVOTSA-N 1 2 235.331 2.413 20 0 BEADLO CC1(C)COC[C@@H]1[NH2+]Cc1n[nH]c2ccccc21 ZINC000648795282 388364878 /nfs/dbraw/zinc/36/48/78/388364878.db2.gz MFCINSXCZIYMGO-ZDUSSCGKSA-N 1 2 245.326 2.078 20 0 BEADLO CN(Cc1ccccc1)c1nc[nH+]c(N)c1Cl ZINC000227840462 388371493 /nfs/dbraw/zinc/37/14/93/388371493.db2.gz AKVMXCSJAXQIPY-UHFFFAOYSA-N 1 2 248.717 2.349 20 0 BEADLO CN(Cc1ccccc1)c1[nH+]cnc(N)c1Cl ZINC000227840462 388371494 /nfs/dbraw/zinc/37/14/94/388371494.db2.gz AKVMXCSJAXQIPY-UHFFFAOYSA-N 1 2 248.717 2.349 20 0 BEADLO C[C@@H]1[C@H](O)CC[N@@H+]1Cc1cc(F)c(F)cc1F ZINC000648800789 388373424 /nfs/dbraw/zinc/37/34/24/388373424.db2.gz SNGFLKMSWRHSPT-JMCQJSRRSA-N 1 2 245.244 2.059 20 0 BEADLO C[C@@H]1[C@H](O)CC[N@H+]1Cc1cc(F)c(F)cc1F ZINC000648800789 388373426 /nfs/dbraw/zinc/37/34/26/388373426.db2.gz SNGFLKMSWRHSPT-JMCQJSRRSA-N 1 2 245.244 2.059 20 0 BEADLO CCC(CC)CC(=O)NCCCn1cc[nH+]c1 ZINC000164140961 388375133 /nfs/dbraw/zinc/37/51/33/388375133.db2.gz ZHQFICYRRDIWEN-UHFFFAOYSA-N 1 2 237.347 2.216 20 0 BEADLO Nc1[nH+]cnc(NC[C@@H]2CCCS2)c1Cl ZINC000236392099 388379000 /nfs/dbraw/zinc/37/90/00/388379000.db2.gz AMUARVOGAKNMDT-LURJTMIESA-N 1 2 244.751 2.020 20 0 BEADLO Nc1nc[nH+]c(NC[C@@H]2CCCS2)c1Cl ZINC000236392099 388379001 /nfs/dbraw/zinc/37/90/01/388379001.db2.gz AMUARVOGAKNMDT-LURJTMIESA-N 1 2 244.751 2.020 20 0 BEADLO CC[C@H](C)CC(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000164503841 388379795 /nfs/dbraw/zinc/37/97/95/388379795.db2.gz QXXUTPFXUFJVNM-DTWKUNHWSA-N 1 2 209.293 2.023 20 0 BEADLO CC[C@H]([NH3+])C(=O)N[C@@H](C)CCC(C)(C)C ZINC000236926043 388386775 /nfs/dbraw/zinc/38/67/75/388386775.db2.gz KNXIYERMTAFADQ-UWVGGRQHSA-N 1 2 214.353 2.055 20 0 BEADLO CC[C@@H](CC(=O)NC[C@H](C)C[NH2+]C)C(C)C ZINC000236924994 388386887 /nfs/dbraw/zinc/38/68/87/388386887.db2.gz MUSQXIGHOHKGHJ-NEPJUHHUSA-N 1 2 228.380 2.030 20 0 BEADLO CC[N@H+](C/C(Cl)=C/Cl)[C@@H](C)CO ZINC000293495633 388389344 /nfs/dbraw/zinc/38/93/44/388389344.db2.gz TZUITOIKPGDYRM-OJKBXMANSA-N 1 2 212.120 2.008 20 0 BEADLO CC[N@@H+](C/C(Cl)=C/Cl)[C@@H](C)CO ZINC000293495633 388389345 /nfs/dbraw/zinc/38/93/45/388389345.db2.gz TZUITOIKPGDYRM-OJKBXMANSA-N 1 2 212.120 2.008 20 0 BEADLO C[C@@H](C[NH2+]Cc1cccc(O)c1Cl)N(C)C ZINC000293449195 388389798 /nfs/dbraw/zinc/38/97/98/388389798.db2.gz CJRSWNFZBHDPGE-VIFPVBQESA-N 1 2 242.750 2.085 20 0 BEADLO Cc1ccc(N[C@@H]2CCn3cc[nH+]c32)cn1 ZINC000293862430 388392897 /nfs/dbraw/zinc/39/28/97/388392897.db2.gz DJCHQLOMRXHVDC-LLVKDONJSA-N 1 2 214.272 2.143 20 0 BEADLO Cc1ccoc1C[NH2+][C@H]1CCn2ccnc21 ZINC000293860350 388393174 /nfs/dbraw/zinc/39/31/74/388393174.db2.gz DGLNJCDXZVGRSL-JTQLQIEISA-N 1 2 217.272 2.019 20 0 BEADLO CC[N@@H+](CC[NH3+])Cc1cc(C)c(C)cc1C ZINC000300802053 388396336 /nfs/dbraw/zinc/39/63/36/388396336.db2.gz JGIZOOKFZNOWQJ-UHFFFAOYSA-N 1 2 220.360 2.392 20 0 BEADLO COc1nccc(C[NH2+][C@H](C)c2ccc(C)o2)n1 ZINC000294668236 388403472 /nfs/dbraw/zinc/40/34/72/388403472.db2.gz DFBYMAOZZIIKAL-SNVBAGLBSA-N 1 2 247.298 2.237 20 0 BEADLO C[N@H+](Cc1nccn1CC(F)(F)F)C1CC1 ZINC000171377010 388403647 /nfs/dbraw/zinc/40/36/47/388403647.db2.gz SQRIBQUVYKTTCS-UHFFFAOYSA-N 1 2 233.237 2.040 20 0 BEADLO C[N@@H+](Cc1nccn1CC(F)(F)F)C1CC1 ZINC000171377010 388403652 /nfs/dbraw/zinc/40/36/52/388403652.db2.gz SQRIBQUVYKTTCS-UHFFFAOYSA-N 1 2 233.237 2.040 20 0 BEADLO O=C(/C=C\C1CC1)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000492071885 388333874 /nfs/dbraw/zinc/33/38/74/388333874.db2.gz ZEXHVSHYJNSZJX-ARJAWSKDSA-N 1 2 245.326 2.082 20 0 BEADLO O=C(/C=C\C1CC1)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000492071885 388333875 /nfs/dbraw/zinc/33/38/75/388333875.db2.gz ZEXHVSHYJNSZJX-ARJAWSKDSA-N 1 2 245.326 2.082 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)/C=C\C1CCCCC1 ZINC000492111495 388335320 /nfs/dbraw/zinc/33/53/20/388335320.db2.gz RHIUDIHDEOJJRU-FPLPWBNLSA-N 1 2 247.342 2.471 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)NC1(C)CCCC1 ZINC000492275030 388340115 /nfs/dbraw/zinc/34/01/15/388340115.db2.gz KOAFIKDJFZBJIF-SREVYHEPSA-N 1 2 247.342 2.365 20 0 BEADLO Cn1ccnc1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC000072381908 388458004 /nfs/dbraw/zinc/45/80/04/388458004.db2.gz OIYFEUIJSZKAJW-ZDUSSCGKSA-N 1 2 242.326 2.152 20 0 BEADLO Cn1ccnc1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000072381908 388458006 /nfs/dbraw/zinc/45/80/06/388458006.db2.gz OIYFEUIJSZKAJW-ZDUSSCGKSA-N 1 2 242.326 2.152 20 0 BEADLO Cc1cc(NCC[C@@H](C)F)nc(C2CC2)[nH+]1 ZINC000338756043 388476673 /nfs/dbraw/zinc/47/66/73/388476673.db2.gz PGDUFDGMJQIZNW-MRVPVSSYSA-N 1 2 223.295 2.244 20 0 BEADLO Cc1nnc(NCCc2[nH+]cccc2C)s1 ZINC000295668833 388413531 /nfs/dbraw/zinc/41/35/31/388413531.db2.gz FSURVVWAGIHJSR-UHFFFAOYSA-N 1 2 234.328 2.205 20 0 BEADLO COc1ccc(N[C@H]2CCOC2(C)C)[nH+]c1 ZINC000328391286 388414418 /nfs/dbraw/zinc/41/44/18/388414418.db2.gz OFCDXPQSHVQVDR-JTQLQIEISA-N 1 2 222.288 2.070 20 0 BEADLO CC[C@H]([NH2+]Cc1c[nH]nn1)c1ccc(OC)cc1 ZINC000296284219 388420481 /nfs/dbraw/zinc/42/04/81/388420481.db2.gz LFWNHVKZNSARGC-ZDUSSCGKSA-N 1 2 246.314 2.054 20 0 BEADLO CC[C@H]([NH2+]Cc1cn[nH]n1)c1ccc(OC)cc1 ZINC000296284219 388420482 /nfs/dbraw/zinc/42/04/82/388420482.db2.gz LFWNHVKZNSARGC-ZDUSSCGKSA-N 1 2 246.314 2.054 20 0 BEADLO CC[C@@H](C)NC(=O)c1ccn2c(C)c[nH+]c2c1 ZINC000573134361 388423035 /nfs/dbraw/zinc/42/30/35/388423035.db2.gz HHLGOCPTCGMBBY-SECBINFHSA-N 1 2 231.299 2.171 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000245570462 388423951 /nfs/dbraw/zinc/42/39/51/388423951.db2.gz XARYWTPZIOIUER-WCQYABFASA-N 1 2 219.332 2.483 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000245570462 388423955 /nfs/dbraw/zinc/42/39/55/388423955.db2.gz XARYWTPZIOIUER-WCQYABFASA-N 1 2 219.332 2.483 20 0 BEADLO CC(C)C[C@@H](C)NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000573253924 388435978 /nfs/dbraw/zinc/43/59/78/388435978.db2.gz KHDNIKOLCRCISF-VXGBXAGGSA-N 1 2 237.347 2.385 20 0 BEADLO CC(C)C[C@@H](C)NC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000573253921 388436269 /nfs/dbraw/zinc/43/62/69/388436269.db2.gz KHDNIKOLCRCISF-NEPJUHHUSA-N 1 2 237.347 2.385 20 0 BEADLO C[C@@H]([NH2+]CC1(F)CC1)c1cscn1 ZINC000520841385 388547272 /nfs/dbraw/zinc/54/72/72/388547272.db2.gz PYVZIEQUKSSFKK-SSDOTTSWSA-N 1 2 200.282 2.296 20 0 BEADLO C/C=C/C=C/C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000135388831 388493970 /nfs/dbraw/zinc/49/39/70/388493970.db2.gz JZQUDTGHBWLTMH-LTGRZJNBSA-N 1 2 219.288 2.109 20 0 BEADLO Cc1cc(NCC2=CCCOC2)nc(C(C)C)[nH+]1 ZINC000340941420 388493946 /nfs/dbraw/zinc/49/39/46/388493946.db2.gz QIRNBNCLCOUIDB-UHFFFAOYSA-N 1 2 247.342 2.089 20 0 BEADLO CCOCCC[N@H+](CC(F)F)C(C)C ZINC000135404322 388494476 /nfs/dbraw/zinc/49/44/76/388494476.db2.gz DABYUOSQOGGGBX-UHFFFAOYSA-N 1 2 209.280 2.389 20 0 BEADLO CCOCCC[N@@H+](CC(F)F)C(C)C ZINC000135404322 388494478 /nfs/dbraw/zinc/49/44/78/388494478.db2.gz DABYUOSQOGGGBX-UHFFFAOYSA-N 1 2 209.280 2.389 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1cnccn1)c1cscn1 ZINC000576887953 388509181 /nfs/dbraw/zinc/50/91/81/388509181.db2.gz XVWQJZCLFRSTKY-RKDXNWHRSA-N 1 2 234.328 2.345 20 0 BEADLO CCCc1noc(C[N@H+]2[C@H](C)C[C@@H]2C)n1 ZINC000548096661 388510490 /nfs/dbraw/zinc/51/04/90/388510490.db2.gz FSOMZXCODRXPTB-DTORHVGOSA-N 1 2 209.293 2.005 20 0 BEADLO CCCc1noc(C[N@@H+]2[C@H](C)C[C@@H]2C)n1 ZINC000548096661 388510491 /nfs/dbraw/zinc/51/04/91/388510491.db2.gz FSOMZXCODRXPTB-DTORHVGOSA-N 1 2 209.293 2.005 20 0 BEADLO CC[C@H](CO)N(C)c1cc(C(F)(F)F)cc[nH+]1 ZINC000345824802 388516837 /nfs/dbraw/zinc/51/68/37/388516837.db2.gz CKRZTVZJLJRUAS-SECBINFHSA-N 1 2 248.248 2.308 20 0 BEADLO CC[C@H](CO)N(C)c1cc(C)[nH+]c(C(C)C)n1 ZINC000345834925 388517145 /nfs/dbraw/zinc/51/71/45/388517145.db2.gz MVHGPKQICHUNRT-LLVKDONJSA-N 1 2 237.347 2.116 20 0 BEADLO C/C(Cl)=C/C[N@@H+](C)Cc1cnccn1 ZINC000528399193 388519447 /nfs/dbraw/zinc/51/94/47/388519447.db2.gz RQVVLPBLSVNYOW-OQFOIZHKSA-N 1 2 211.696 2.051 20 0 BEADLO C/C(Cl)=C/C[N@H+](C)Cc1cnccn1 ZINC000528399193 388519450 /nfs/dbraw/zinc/51/94/50/388519450.db2.gz RQVVLPBLSVNYOW-OQFOIZHKSA-N 1 2 211.696 2.051 20 0 BEADLO CCCCN(CC)C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000520835032 388520253 /nfs/dbraw/zinc/52/02/53/388520253.db2.gz VTWIYXSZBFLKHN-NSHDSACASA-N 1 2 237.347 2.237 20 0 BEADLO CCCCN(CC)C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000520835032 388520254 /nfs/dbraw/zinc/52/02/54/388520254.db2.gz VTWIYXSZBFLKHN-NSHDSACASA-N 1 2 237.347 2.237 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1CCOCC12CCC2 ZINC000528420395 388521993 /nfs/dbraw/zinc/52/19/93/388521993.db2.gz JPOBDKGTGNRTSZ-KMKOMSMNSA-N 1 2 215.724 2.384 20 0 BEADLO C/C(Cl)=C/C[N@H+]1CCOCC12CCC2 ZINC000528420395 388521997 /nfs/dbraw/zinc/52/19/97/388521997.db2.gz JPOBDKGTGNRTSZ-KMKOMSMNSA-N 1 2 215.724 2.384 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1CCO[C@H](C2CC2)C1 ZINC000528456996 388528538 /nfs/dbraw/zinc/52/85/38/388528538.db2.gz BRKXEDKNJPYROW-VKJYCEFSSA-N 1 2 215.724 2.240 20 0 BEADLO C/C(Cl)=C\C[N@H+]1CCO[C@H](C2CC2)C1 ZINC000528456996 388528540 /nfs/dbraw/zinc/52/85/40/388528540.db2.gz BRKXEDKNJPYROW-VKJYCEFSSA-N 1 2 215.724 2.240 20 0 BEADLO CC[C@@H]1C(=O)N(CC)CC[N@H+]1C/C=C(\C)Cl ZINC000528463208 388529803 /nfs/dbraw/zinc/52/98/03/388529803.db2.gz GTGUZZYMVJWBBQ-CDCCAWJDSA-N 1 2 244.766 2.072 20 0 BEADLO CC[C@@H]1C(=O)N(CC)CC[N@@H+]1C/C=C(\C)Cl ZINC000528463208 388529805 /nfs/dbraw/zinc/52/98/05/388529805.db2.gz GTGUZZYMVJWBBQ-CDCCAWJDSA-N 1 2 244.766 2.072 20 0 BEADLO Cc1nc(C[N@H+](C)CCOCC2CC2)oc1C ZINC000088599033 388533406 /nfs/dbraw/zinc/53/34/06/388533406.db2.gz YYESQRQZQFKHNU-UHFFFAOYSA-N 1 2 238.331 2.150 20 0 BEADLO Cc1nc(C[N@@H+](C)CCOCC2CC2)oc1C ZINC000088599033 388533409 /nfs/dbraw/zinc/53/34/09/388533409.db2.gz YYESQRQZQFKHNU-UHFFFAOYSA-N 1 2 238.331 2.150 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N(C)C1CC(C)(C)C1 ZINC000517040757 388534718 /nfs/dbraw/zinc/53/47/18/388534718.db2.gz XJFDSGMFSZBUTK-JTQLQIEISA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N(C)C1CC(C)(C)C1 ZINC000517040757 388534719 /nfs/dbraw/zinc/53/47/19/388534719.db2.gz XJFDSGMFSZBUTK-JTQLQIEISA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H](c1csnn1)[N@@H+]1CCCOC(C)(C)C1 ZINC000649315898 388604775 /nfs/dbraw/zinc/60/47/75/388604775.db2.gz AEHFWZPDECEXFV-SECBINFHSA-N 1 2 241.360 2.100 20 0 BEADLO C[C@H](c1csnn1)[N@H+]1CCCOC(C)(C)C1 ZINC000649315898 388604779 /nfs/dbraw/zinc/60/47/79/388604779.db2.gz AEHFWZPDECEXFV-SECBINFHSA-N 1 2 241.360 2.100 20 0 BEADLO CCCc1nc(C[NH+]2C3CCC2CC3)no1 ZINC000517607795 388555804 /nfs/dbraw/zinc/55/58/04/388555804.db2.gz IVCKGXXURUXZJS-UHFFFAOYSA-N 1 2 221.304 2.149 20 0 BEADLO O=C(NCC1CCCC1)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000548738435 388556453 /nfs/dbraw/zinc/55/64/53/388556453.db2.gz HOYIBHWFIJDDJP-LLVKDONJSA-N 1 2 247.342 2.136 20 0 BEADLO O=C(NCC1CCCC1)[C@@H]1CCCc2[nH]c[nH+]c21 ZINC000548738435 388556454 /nfs/dbraw/zinc/55/64/54/388556454.db2.gz HOYIBHWFIJDDJP-LLVKDONJSA-N 1 2 247.342 2.136 20 0 BEADLO COC(=O)c1ccoc1C[NH+]1[C@H](C)C[C@H]1C ZINC000548754221 388557457 /nfs/dbraw/zinc/55/74/57/388557457.db2.gz IYFAEJFRSMCNCC-RKDXNWHRSA-N 1 2 223.272 2.049 20 0 BEADLO C[C@H](CC(=O)N[C@H]1CC12CCCC2)n1cc[nH+]c1 ZINC000521055102 388561393 /nfs/dbraw/zinc/56/13/93/388561393.db2.gz WFBOPMUHWGFGOU-NEPJUHHUSA-N 1 2 247.342 2.283 20 0 BEADLO CCCC[C@@H](C)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000548870526 388566569 /nfs/dbraw/zinc/56/65/69/388566569.db2.gz MBJIXWAUDIFDIH-LLVKDONJSA-N 1 2 235.331 2.093 20 0 BEADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1cnns1 ZINC000528772991 388571142 /nfs/dbraw/zinc/57/11/42/388571142.db2.gz NRAQNAXCQHHIPC-ZETCQYMHSA-N 1 2 233.287 2.158 20 0 BEADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1cnns1 ZINC000528772991 388571143 /nfs/dbraw/zinc/57/11/43/388571143.db2.gz NRAQNAXCQHHIPC-ZETCQYMHSA-N 1 2 233.287 2.158 20 0 BEADLO c1n[nH]c([C@@H]([NH2+]C2CC2)C2CCCCC2)n1 ZINC000328612325 388645321 /nfs/dbraw/zinc/64/53/21/388645321.db2.gz PGSPTIQONQSIGW-NSHDSACASA-N 1 2 220.320 2.178 20 0 BEADLO Oc1ccc(F)c(CNc2c[nH]c[nH+]2)c1F ZINC000552029068 388662438 /nfs/dbraw/zinc/66/24/38/388662438.db2.gz BGEFAWPDSLKZIO-UHFFFAOYSA-N 1 2 225.198 2.006 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@H]1[C@@H]2CCC[C@@H]21 ZINC000247339608 388663004 /nfs/dbraw/zinc/66/30/04/388663004.db2.gz NPLMRAFHQGQKBY-GDGBQDQQSA-N 1 2 232.283 2.075 20 0 BEADLO COc1ccc[nH+]c1NCCCc1c[nH]nc1C ZINC000127986689 388735477 /nfs/dbraw/zinc/73/54/77/388735477.db2.gz LCBSPDGNYDJCHE-UHFFFAOYSA-N 1 2 246.314 2.166 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1CCOC[C@@H]1C ZINC000194314251 388729132 /nfs/dbraw/zinc/72/91/32/388729132.db2.gz UKESWHGGHIRMGQ-WDEREUQCSA-N 1 2 234.299 2.001 20 0 BEADLO CCOC(=O)C[N@H+](CC)Cc1sccc1C ZINC000092399624 388802772 /nfs/dbraw/zinc/80/27/72/388802772.db2.gz SPQIIVNGURPGAY-UHFFFAOYSA-N 1 2 241.356 2.442 20 0 BEADLO CCOC(=O)C[N@@H+](CC)Cc1sccc1C ZINC000092399624 388802776 /nfs/dbraw/zinc/80/27/76/388802776.db2.gz SPQIIVNGURPGAY-UHFFFAOYSA-N 1 2 241.356 2.442 20 0 BEADLO Nc1[nH+]cnc(NCc2cccs2)c1Cl ZINC000227841546 388760501 /nfs/dbraw/zinc/76/05/01/388760501.db2.gz RVPWQLXPFCHXAD-UHFFFAOYSA-N 1 2 240.719 2.386 20 0 BEADLO Nc1nc[nH+]c(NCc2cccs2)c1Cl ZINC000227841546 388760504 /nfs/dbraw/zinc/76/05/04/388760504.db2.gz RVPWQLXPFCHXAD-UHFFFAOYSA-N 1 2 240.719 2.386 20 0 BEADLO CSC1(CNc2cc[nH+]c(C)n2)CCC1 ZINC000227986447 388764323 /nfs/dbraw/zinc/76/43/23/388764323.db2.gz GRGCRAZSNVNQOP-UHFFFAOYSA-N 1 2 223.345 2.483 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CCc2ccccc2CC1 ZINC000093385397 388835704 /nfs/dbraw/zinc/83/57/04/388835704.db2.gz NKWIPOPCGZCDGQ-UHFFFAOYSA-N 1 2 241.338 2.319 20 0 BEADLO CC[C@@](C)(CO)Nc1nc(C)[nH+]c2c1CCCC2 ZINC000541089231 388839843 /nfs/dbraw/zinc/83/98/43/388839843.db2.gz GCCBETMRJPMYDJ-AWEZNQCLSA-N 1 2 249.358 2.237 20 0 BEADLO FC(F)(F)C1C[NH+](CCc2cscn2)C1 ZINC000556218736 388871035 /nfs/dbraw/zinc/87/10/35/388871035.db2.gz DCKPRXBENROWMG-UHFFFAOYSA-N 1 2 236.262 2.180 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccc(O)c2)n(C)n1 ZINC000564552855 388877320 /nfs/dbraw/zinc/87/73/20/388877320.db2.gz XGMOTRMAMUEGOW-UHFFFAOYSA-N 1 2 245.326 2.066 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccc(O)c2)n(C)n1 ZINC000564552855 388877325 /nfs/dbraw/zinc/87/73/25/388877325.db2.gz XGMOTRMAMUEGOW-UHFFFAOYSA-N 1 2 245.326 2.066 20 0 BEADLO Cc1nnsc1C[N@H+](C)Cc1cccc(C)n1 ZINC000565047780 388910799 /nfs/dbraw/zinc/91/07/99/388910799.db2.gz WVOYVUXINZSZRY-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO Cc1nnsc1C[N@@H+](C)Cc1cccc(C)n1 ZINC000565047780 388910795 /nfs/dbraw/zinc/91/07/95/388910795.db2.gz WVOYVUXINZSZRY-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO CCCn1cc(C[N@@H+]2CCC[C@@H](F)C2)cn1 ZINC000565097847 388915514 /nfs/dbraw/zinc/91/55/14/388915514.db2.gz DFNDQOXGAGZCCG-GFCCVEGCSA-N 1 2 225.311 2.227 20 0 BEADLO CCCn1cc(C[N@H+]2CCC[C@@H](F)C2)cn1 ZINC000565097847 388915518 /nfs/dbraw/zinc/91/55/18/388915518.db2.gz DFNDQOXGAGZCCG-GFCCVEGCSA-N 1 2 225.311 2.227 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CC=CC[C@H]1C)c1[nH]cc[nH+]1 ZINC000565214647 388926462 /nfs/dbraw/zinc/92/64/62/388926462.db2.gz QZUDNOORZSIZTF-GMTAPVOTSA-N 1 2 233.315 2.189 20 0 BEADLO COc1cc([C@H](C)[NH2+]CC(C)(F)F)ccn1 ZINC000565216349 388927668 /nfs/dbraw/zinc/92/76/68/388927668.db2.gz FCCUJAAZOCRKMI-QMMMGPOBSA-N 1 2 230.258 2.396 20 0 BEADLO CC(C)c1nc(C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)no1 ZINC000153280909 388959253 /nfs/dbraw/zinc/95/92/53/388959253.db2.gz JPKRWVJSQBXVBF-PHIMTYICSA-N 1 2 235.331 2.425 20 0 BEADLO CC(C)c1nc(C[N@H+]2C[C@@H]3CCC[C@@H]3C2)no1 ZINC000153280909 388959256 /nfs/dbraw/zinc/95/92/56/388959256.db2.gz JPKRWVJSQBXVBF-PHIMTYICSA-N 1 2 235.331 2.425 20 0 BEADLO F[C@]1(c2ccccc2)C[C@@H]1[NH2+]Cc1cnccn1 ZINC000565418271 388942995 /nfs/dbraw/zinc/94/29/95/388942995.db2.gz ODZMRCZQSYEZQO-KBPBESRZSA-N 1 2 243.285 2.204 20 0 BEADLO COCc1ccc(C[N@@H+]2CCC[C@H](F)C2)o1 ZINC000565544047 388952445 /nfs/dbraw/zinc/95/24/45/388952445.db2.gz QFWJEIAPMGFLAS-JTQLQIEISA-N 1 2 227.279 2.360 20 0 BEADLO COCc1ccc(C[N@H+]2CCC[C@H](F)C2)o1 ZINC000565544047 388952448 /nfs/dbraw/zinc/95/24/48/388952448.db2.gz QFWJEIAPMGFLAS-JTQLQIEISA-N 1 2 227.279 2.360 20 0 BEADLO Cc1csc(CNCc2[nH]c(C)c(C)[nH+]2)n1 ZINC000565547809 388952504 /nfs/dbraw/zinc/95/25/04/388952504.db2.gz CYRGORCZQHOOIR-UHFFFAOYSA-N 1 2 236.344 2.081 20 0 BEADLO CC[C@H]1CCC[C@@H]1Nc1[nH+]cnc2c1cnn2C ZINC000268237120 389002318 /nfs/dbraw/zinc/00/23/18/389002318.db2.gz MQLHMWRWNVOXGQ-ONGXEEELSA-N 1 2 245.330 2.354 20 0 BEADLO Cn1ccc(C[NH2+][C@@H]2C[C@]2(F)c2ccccc2)n1 ZINC000566062730 388985807 /nfs/dbraw/zinc/98/58/07/388985807.db2.gz KGFLIXAGWGYUBL-KGLIPLIRSA-N 1 2 245.301 2.147 20 0 BEADLO c1ccc2sc(N3CCCC[NH2+]3)nc2c1 ZINC000289139404 388999840 /nfs/dbraw/zinc/99/98/40/388999840.db2.gz OEQUDLNZHXXXJJ-UHFFFAOYSA-N 1 2 219.313 2.401 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H](C)c1ccccc1 ZINC000273248480 389039599 /nfs/dbraw/zinc/03/95/99/389039599.db2.gz RGGZTQYGCCWDFX-SNVBAGLBSA-N 1 2 243.310 2.138 20 0 BEADLO C[C@@H](CC(C)(C)C)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493663640 533466386 /nfs/dbraw/zinc/46/63/86/533466386.db2.gz YFUSNQLCBGDKTG-OMMCCPJFSA-N 1 2 235.331 2.364 20 0 BEADLO Cc1cc(CNC(=O)/C=C/C2CC2)cc(C)[nH+]1 ZINC000493168262 533639756 /nfs/dbraw/zinc/63/97/56/533639756.db2.gz CDTJURIQMVKSEC-AATRIKPKSA-N 1 2 230.311 2.281 20 0 BEADLO C[C@@H]1CCN(c2cc(N3CCCCC3)[nH+]cn2)C1 ZINC000264306143 132179360 /nfs/dbraw/zinc/17/93/60/132179360.db2.gz FJUZJGHRZNMUPR-GFCCVEGCSA-N 1 2 246.358 2.313 20 0 BEADLO C[C@@H]1CCN(c2cc(N3CCCCC3)nc[nH+]2)C1 ZINC000264306143 132179362 /nfs/dbraw/zinc/17/93/62/132179362.db2.gz FJUZJGHRZNMUPR-GFCCVEGCSA-N 1 2 246.358 2.313 20 0 BEADLO Cc1noc([C@@H]2CCCN(c3cccc[nH+]3)C2)n1 ZINC000264930528 132181294 /nfs/dbraw/zinc/18/12/94/132181294.db2.gz PDRFVKCSGNNJGL-LLVKDONJSA-N 1 2 244.298 2.157 20 0 BEADLO CCC1(O)CCN(c2cc[nH+]c(C3CC3)n2)CC1 ZINC000266208066 132185410 /nfs/dbraw/zinc/18/54/10/132185410.db2.gz FRGBMMVLKRJIJW-UHFFFAOYSA-N 1 2 247.342 2.095 20 0 BEADLO c1ccc(N2CCCC3(CCOCC3)C2)[nH+]c1 ZINC000266267662 132185856 /nfs/dbraw/zinc/18/58/56/132185856.db2.gz QLYUCKHMSPUSBZ-UHFFFAOYSA-N 1 2 232.327 2.479 20 0 BEADLO CCC1CCN(c2cc[nH+]c(C)n2)CC1 ZINC000266327761 132186284 /nfs/dbraw/zinc/18/62/84/132186284.db2.gz GJVCEKPYKRREFY-UHFFFAOYSA-N 1 2 205.305 2.411 20 0 BEADLO CC[C@@H]1CO[C@@H](C)CN1c1cc[nH+]c(C2CC2)n1 ZINC000268024422 132191317 /nfs/dbraw/zinc/19/13/17/132191317.db2.gz IWAQJSXIXXIDMA-CMPLNLGQSA-N 1 2 247.342 2.358 20 0 BEADLO C[C@H]1OCCN(c2cc[nH+]c3ccncc32)[C@@H]1C ZINC000268782807 132192971 /nfs/dbraw/zinc/19/29/71/132192971.db2.gz CQHKCARZCPKMEF-GHMZBOCLSA-N 1 2 243.310 2.243 20 0 BEADLO Fc1cnc(N2CCCC[C@H]2c2[nH]cc[nH+]2)nc1 ZINC000269465222 132194587 /nfs/dbraw/zinc/19/45/87/132194587.db2.gz IAQXJLHFTBIBFT-JTQLQIEISA-N 1 2 247.277 2.070 20 0 BEADLO COc1cccc2c(N3CCOCC3)cc[nH+]c12 ZINC000275418660 132204614 /nfs/dbraw/zinc/20/46/14/132204614.db2.gz BQIGFAPOUYEEIG-UHFFFAOYSA-N 1 2 244.294 2.080 20 0 BEADLO CC1=CCN(c2cc(N3CCCC3)[nH+]cn2)CC1 ZINC000277281823 132207226 /nfs/dbraw/zinc/20/72/26/132207226.db2.gz ARIAMPKXLHHOOM-UHFFFAOYSA-N 1 2 244.342 2.233 20 0 BEADLO CC1=CCN(c2cc(N3CCCC3)nc[nH+]2)CC1 ZINC000277281823 132207229 /nfs/dbraw/zinc/20/72/29/132207229.db2.gz ARIAMPKXLHHOOM-UHFFFAOYSA-N 1 2 244.342 2.233 20 0 BEADLO CO[C@]1(C)CCCN(c2cccc[nH+]2)C1 ZINC000280602724 132211033 /nfs/dbraw/zinc/21/10/33/132211033.db2.gz XUPUSZBTJIIPEP-GFCCVEGCSA-N 1 2 206.289 2.087 20 0 BEADLO CCc1nc(N2CCC=C(F)C2)cc(C)[nH+]1 ZINC000286439484 132214788 /nfs/dbraw/zinc/21/47/88/132214788.db2.gz IPLMVPNZMHUZET-UHFFFAOYSA-N 1 2 221.279 2.411 20 0 BEADLO Cc1cc(N2CCCC[C@@H]2c2cc[nH]n2)nc[nH+]1 ZINC000333711815 132245089 /nfs/dbraw/zinc/24/50/89/132245089.db2.gz PZHRRCOZKQXDRO-GFCCVEGCSA-N 1 2 243.314 2.240 20 0 BEADLO Cc1cc(N2CCCC[C@H]2c2cc[nH]n2)nc[nH+]1 ZINC000333711824 132245700 /nfs/dbraw/zinc/24/57/00/132245700.db2.gz PZHRRCOZKQXDRO-LBPRGKRZSA-N 1 2 243.314 2.240 20 0 BEADLO c1ccc(N2CCC[C@@]3(CCOC3)C2)[nH+]c1 ZINC000336272907 132246028 /nfs/dbraw/zinc/24/60/28/132246028.db2.gz JPRLUGFXCWYWGX-CYBMUJFWSA-N 1 2 218.300 2.089 20 0 BEADLO Cc1cc(N2CCc3sccc3C2)nc[nH+]1 ZINC000301231610 132252243 /nfs/dbraw/zinc/25/22/43/132252243.db2.gz HXCSJJYCYQPBCP-UHFFFAOYSA-N 1 2 231.324 2.409 20 0 BEADLO Cc1cc(N2CCS[C@H](C)[C@@H]2C)nc[nH+]1 ZINC000301307303 132252554 /nfs/dbraw/zinc/25/25/54/132252554.db2.gz ZSCGFKSOMRLGLT-VHSXEESVSA-N 1 2 223.345 2.115 20 0 BEADLO Cc1cc(N2CCCC[C@H]2c2[nH]cc[nH+]2)ncn1 ZINC000301565234 132254799 /nfs/dbraw/zinc/25/47/99/132254799.db2.gz LXUOFQCLWSAUCC-NSHDSACASA-N 1 2 243.314 2.240 20 0 BEADLO c1ccc(N2CC[C@H]3OCCC[C@H]3C2)[nH+]c1 ZINC000301731031 132256952 /nfs/dbraw/zinc/25/69/52/132256952.db2.gz SKZXBTOAAZCYIY-NWDGAFQWSA-N 1 2 218.300 2.087 20 0 BEADLO CO[C@H]1CN(c2cc[nH+]c(C(C)C)n2)CC[C@@H]1C ZINC000302587599 132264621 /nfs/dbraw/zinc/26/46/21/132264621.db2.gz VRGNBQNWRUPBBC-RYUDHWBXSA-N 1 2 249.358 2.461 20 0 BEADLO CC[C@H]1COCCN1c1cc[nH+]c(C(C)C)n1 ZINC000115522163 132282159 /nfs/dbraw/zinc/28/21/59/132282159.db2.gz ORSQLUADWFPVOH-NSHDSACASA-N 1 2 235.331 2.215 20 0 BEADLO CC[C@H](C)CNc1ccc(N2CCOCC2)[nH+]c1 ZINC000037075996 132295681 /nfs/dbraw/zinc/29/56/81/132295681.db2.gz AVMZTKRNHHKGBT-LBPRGKRZSA-N 1 2 249.358 2.376 20 0 BEADLO CC1=C[C@H](C)CN(c2nc[nH+]c(N)c2Cl)C1 ZINC000309296488 132365539 /nfs/dbraw/zinc/36/55/39/132365539.db2.gz RRKBUWOSTWNQOB-ZETCQYMHSA-N 1 2 238.722 2.115 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)c2ccsc2)c2[nH+]ccn21 ZINC000334740237 133745778 /nfs/dbraw/zinc/74/57/78/133745778.db2.gz HWPFPBOZWQMZMI-WCBMZHEXSA-N 1 2 247.323 2.380 20 0 BEADLO C[NH2+]Cc1noc(CSc2ccccc2C)n1 ZINC000349900323 133925530 /nfs/dbraw/zinc/92/55/30/133925530.db2.gz XWXUMXBWQVUHPW-UHFFFAOYSA-N 1 2 249.339 2.390 20 0 BEADLO CC(C)[C@H](C)C(=O)N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000335838187 133933847 /nfs/dbraw/zinc/93/38/47/133933847.db2.gz QPKZJSKSVIKDCZ-RYUDHWBXSA-N 1 2 249.358 2.028 20 0 BEADLO Cc1c[nH]cc1C(=O)Nc1ccc[nH+]c1N(C)C ZINC000335942782 134018487 /nfs/dbraw/zinc/01/84/87/134018487.db2.gz HUHPBZRJLQFIAP-UHFFFAOYSA-N 1 2 244.298 2.036 20 0 BEADLO CC(C)(C)c1n[nH]cc1C[N@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC000335945300 134019713 /nfs/dbraw/zinc/01/97/13/134019713.db2.gz UKCODCDYVCIGHO-TXEJJXNPSA-N 1 2 249.358 2.070 20 0 BEADLO CC(C)(C)c1n[nH]cc1C[N@@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC000335945300 134019714 /nfs/dbraw/zinc/01/97/14/134019714.db2.gz UKCODCDYVCIGHO-TXEJJXNPSA-N 1 2 249.358 2.070 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+]2CCOC3(CCC3)C2)o1 ZINC000335946279 134019979 /nfs/dbraw/zinc/01/99/79/134019979.db2.gz JBWDDHGWHIIDOD-NSHDSACASA-N 1 2 236.315 2.299 20 0 BEADLO Cc1cnc([C@H](C)[N@H+]2CCOC3(CCC3)C2)o1 ZINC000335946279 134019980 /nfs/dbraw/zinc/01/99/80/134019980.db2.gz JBWDDHGWHIIDOD-NSHDSACASA-N 1 2 236.315 2.299 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CCC(F)(F)C1 ZINC000335957931 134023519 /nfs/dbraw/zinc/02/35/19/134023519.db2.gz NRHGUOXRTSSHAQ-UHFFFAOYSA-N 1 2 229.274 2.305 20 0 BEADLO CCOCC[N@H+](C)Cc1ncc(Cl)s1 ZINC000351976079 134025609 /nfs/dbraw/zinc/02/56/09/134025609.db2.gz SDIFFWSNBBTZNR-UHFFFAOYSA-N 1 2 234.752 2.265 20 0 BEADLO CCOCC[N@@H+](C)Cc1ncc(Cl)s1 ZINC000351976079 134025610 /nfs/dbraw/zinc/02/56/10/134025610.db2.gz SDIFFWSNBBTZNR-UHFFFAOYSA-N 1 2 234.752 2.265 20 0 BEADLO C[N@H+](Cc1ncc(Cl)s1)CC1(O)CCC1 ZINC000351989537 134026764 /nfs/dbraw/zinc/02/67/64/134026764.db2.gz UQDYIFXNVILHLD-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO C[N@@H+](Cc1ncc(Cl)s1)CC1(O)CCC1 ZINC000351989537 134026765 /nfs/dbraw/zinc/02/67/65/134026765.db2.gz UQDYIFXNVILHLD-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO C[C@@H]1CCCCCN1C(=O)CCc1[nH]cc[nH+]1 ZINC000335977185 134031648 /nfs/dbraw/zinc/03/16/48/134031648.db2.gz MEGVRNZYACKVRH-LLVKDONJSA-N 1 2 235.331 2.133 20 0 BEADLO COC[C@@H](C)[N@H+](C)Cc1ncc(Cl)s1 ZINC000352005936 134034743 /nfs/dbraw/zinc/03/47/43/134034743.db2.gz ZHBKWBNXDQFFDC-SSDOTTSWSA-N 1 2 234.752 2.263 20 0 BEADLO COC[C@@H](C)[N@@H+](C)Cc1ncc(Cl)s1 ZINC000352005936 134034744 /nfs/dbraw/zinc/03/47/44/134034744.db2.gz ZHBKWBNXDQFFDC-SSDOTTSWSA-N 1 2 234.752 2.263 20 0 BEADLO C[C@@H](F)CC[N@@H+]1CCO[C@H](c2nccs2)C1 ZINC000352007732 134035484 /nfs/dbraw/zinc/03/54/84/134035484.db2.gz YOLYUPJCBLSIND-ZJUUUORDSA-N 1 2 244.335 2.265 20 0 BEADLO C[C@@H](F)CC[N@H+]1CCO[C@H](c2nccs2)C1 ZINC000352007732 134035485 /nfs/dbraw/zinc/03/54/85/134035485.db2.gz YOLYUPJCBLSIND-ZJUUUORDSA-N 1 2 244.335 2.265 20 0 BEADLO Cc1cnc(C[N@@H+]2CCCc3occc3C2)nc1 ZINC000335993401 134041693 /nfs/dbraw/zinc/04/16/93/134041693.db2.gz AXJHUBSDWVCXNP-UHFFFAOYSA-N 1 2 243.310 2.326 20 0 BEADLO Cc1cnc(C[N@H+]2CCCc3occc3C2)nc1 ZINC000335993401 134041694 /nfs/dbraw/zinc/04/16/94/134041694.db2.gz AXJHUBSDWVCXNP-UHFFFAOYSA-N 1 2 243.310 2.326 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@H](C)[C@@H]2C)cn1 ZINC000335999412 134043715 /nfs/dbraw/zinc/04/37/15/134043715.db2.gz UFBWEUUNJKBENJ-NWDGAFQWSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@H](C)[C@@H]2C)cn1 ZINC000335999412 134043716 /nfs/dbraw/zinc/04/37/16/134043716.db2.gz UFBWEUUNJKBENJ-NWDGAFQWSA-N 1 2 234.343 2.253 20 0 BEADLO CC1(C)CC[C@@H](C(=O)N2CCn3c[nH+]cc3C2)C1 ZINC000336024914 134056802 /nfs/dbraw/zinc/05/68/02/134056802.db2.gz GZYOQRIQSLSZHS-LLVKDONJSA-N 1 2 247.342 2.052 20 0 BEADLO CC(C)N(C(=O)[C@@H]1CCCc2[nH+]c[nH]c21)C1CC1 ZINC000336051765 134065123 /nfs/dbraw/zinc/06/51/23/134065123.db2.gz SVEVFQFTFVHXJM-LLVKDONJSA-N 1 2 247.342 2.229 20 0 BEADLO CC1(C(=O)Nc2cccc3[nH+]ccn32)CC1 ZINC000336059799 134067670 /nfs/dbraw/zinc/06/76/70/134067670.db2.gz DMOYRXZHIDPUKE-UHFFFAOYSA-N 1 2 215.256 2.073 20 0 BEADLO CSCCC[N@H+](C)[C@@H](C)c1noc(C)n1 ZINC000352115516 134071812 /nfs/dbraw/zinc/07/18/12/134071812.db2.gz LVNAJCHYVUZSLC-QMMMGPOBSA-N 1 2 229.349 2.124 20 0 BEADLO C[C@H]1C[NH+](Cc2ccsc2)C[C@H](C)S1=O ZINC000336089304 134077748 /nfs/dbraw/zinc/07/77/48/134077748.db2.gz YJKDWADJQZINSX-UWVGGRQHSA-N 1 2 243.397 2.089 20 0 BEADLO CC1C[NH+](Cc2ccn(-c3ccccc3)n2)C1 ZINC000336131040 134094610 /nfs/dbraw/zinc/09/46/10/134094610.db2.gz CBBVNFADSQRRET-UHFFFAOYSA-N 1 2 227.311 2.324 20 0 BEADLO Cc1cc[nH]c1C(=O)Nc1ccc[nH+]c1N(C)C ZINC000336152563 134105031 /nfs/dbraw/zinc/10/50/31/134105031.db2.gz MHVKNBOSIJDFCO-UHFFFAOYSA-N 1 2 244.298 2.036 20 0 BEADLO CC(C)n1ccnc1C[N@H+](C)[C@H]1CCCOC1 ZINC000352214557 134108287 /nfs/dbraw/zinc/10/82/87/134108287.db2.gz ZTSNKTBYTNHAGS-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccnc1C[N@@H+](C)[C@H]1CCCOC1 ZINC000352214557 134108288 /nfs/dbraw/zinc/10/82/88/134108288.db2.gz ZTSNKTBYTNHAGS-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO C[C@H](c1csnn1)[N@@H+]1CCC[C@H](C)C1 ZINC000336189620 134122885 /nfs/dbraw/zinc/12/28/85/134122885.db2.gz IDEBEWODGPXZLQ-DTWKUNHWSA-N 1 2 211.334 2.331 20 0 BEADLO C[C@H](c1csnn1)[N@H+]1CCC[C@H](C)C1 ZINC000336189620 134122886 /nfs/dbraw/zinc/12/28/86/134122886.db2.gz IDEBEWODGPXZLQ-DTWKUNHWSA-N 1 2 211.334 2.331 20 0 BEADLO C[C@@H]1COCC[N@@H+]1Cc1cc2cccnc2o1 ZINC000336213125 134135867 /nfs/dbraw/zinc/13/58/67/134135867.db2.gz DHZTXNQMLIXOIU-SNVBAGLBSA-N 1 2 232.283 2.049 20 0 BEADLO C[C@@H]1COCC[N@H+]1Cc1cc2cccnc2o1 ZINC000336213125 134135868 /nfs/dbraw/zinc/13/58/68/134135868.db2.gz DHZTXNQMLIXOIU-SNVBAGLBSA-N 1 2 232.283 2.049 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc3cccnc3o2)CCO1 ZINC000336215939 134136905 /nfs/dbraw/zinc/13/69/05/134136905.db2.gz QXDRPHRSNQXFNR-SNVBAGLBSA-N 1 2 232.283 2.049 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc3cccnc3o2)CCO1 ZINC000336215939 134136906 /nfs/dbraw/zinc/13/69/06/134136906.db2.gz QXDRPHRSNQXFNR-SNVBAGLBSA-N 1 2 232.283 2.049 20 0 BEADLO Cc1cccc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)c1F ZINC000336219808 134138856 /nfs/dbraw/zinc/13/88/56/134138856.db2.gz XIIAVXBXILXILG-BETUJISGSA-N 1 2 235.302 2.497 20 0 BEADLO Cc1cccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c1F ZINC000336219808 134138857 /nfs/dbraw/zinc/13/88/57/134138857.db2.gz XIIAVXBXILXILG-BETUJISGSA-N 1 2 235.302 2.497 20 0 BEADLO NC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccncc1F ZINC000336219470 134139095 /nfs/dbraw/zinc/13/90/95/134139095.db2.gz FEZZTWSDDVIXAZ-NSHDSACASA-N 1 2 237.278 2.110 20 0 BEADLO NC(=O)[C@@H]1CCCC[N@H+]1Cc1ccncc1F ZINC000336219470 134139096 /nfs/dbraw/zinc/13/90/96/134139096.db2.gz FEZZTWSDDVIXAZ-NSHDSACASA-N 1 2 237.278 2.110 20 0 BEADLO C[C@H](CC1CC1)NC(=O)c1ccc2[nH+]ccn2c1 ZINC000171999063 134264154 /nfs/dbraw/zinc/26/41/54/134264154.db2.gz PRUGSUFHLZCZTP-SNVBAGLBSA-N 1 2 243.310 2.253 20 0 BEADLO O[C@@H](CNc1cccc[nH+]1)c1ccsc1 ZINC000218920468 134268806 /nfs/dbraw/zinc/26/88/06/134268806.db2.gz LAQOMFQAPHRBML-JTQLQIEISA-N 1 2 220.297 2.289 20 0 BEADLO COCCOc1cc[nH+]c2cc(OC)ccc21 ZINC000174124019 134279112 /nfs/dbraw/zinc/27/91/12/134279112.db2.gz FWYGTFDPSSTYOH-UHFFFAOYSA-N 1 2 233.267 2.269 20 0 BEADLO C[C@@H](CC1CCCC1)C(=O)NCCc1[nH]cc[nH+]1 ZINC000174757415 134283202 /nfs/dbraw/zinc/28/32/02/134283202.db2.gz HBRHLRPHBRRRAT-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO COC[C@H](C)N(C)c1nc(C)[nH+]c2c1CCCC2 ZINC000180428980 134327304 /nfs/dbraw/zinc/32/73/04/134327304.db2.gz ANGHCNLOFWXALS-JTQLQIEISA-N 1 2 249.358 2.135 20 0 BEADLO COCc1nc(C[NH2+][C@@H](C)c2ccccc2)no1 ZINC000182786881 134348046 /nfs/dbraw/zinc/34/80/46/134348046.db2.gz KZUITJPKMPYMTE-JTQLQIEISA-N 1 2 247.298 2.067 20 0 BEADLO Clc1cnc(C[NH2+]Cc2cccnc2)s1 ZINC000225294301 134351818 /nfs/dbraw/zinc/35/18/18/134351818.db2.gz VALLGGVKQHXMNH-UHFFFAOYSA-N 1 2 239.731 2.481 20 0 BEADLO CCn1cnnc1C[NH2+]Cc1cc(F)ccc1C ZINC000226507788 134363903 /nfs/dbraw/zinc/36/39/03/134363903.db2.gz CZOROZNQJSRYRU-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO COC[C@H](CNc1ccc2ccccc2[nH+]1)OC ZINC000227702827 134385163 /nfs/dbraw/zinc/38/51/63/134385163.db2.gz NRDPAWLTGBUTAX-LBPRGKRZSA-N 1 2 246.310 2.308 20 0 BEADLO CO[C@H]1C[C@H](Nc2cc(C)[nH+]cn2)C1(C)C ZINC000227822030 134389492 /nfs/dbraw/zinc/38/94/92/134389492.db2.gz GAIPUMOONUHYPJ-UWVGGRQHSA-N 1 2 221.304 2.010 20 0 BEADLO C1=C[C@H]2C[C@@H]1C[C@H]2CN1CC[NH+](CC2CC2)CC1 ZINC000130642841 134621712 /nfs/dbraw/zinc/62/17/12/134621712.db2.gz TUJXTIZBDIUIRD-PMPSAXMXSA-N 1 2 246.398 2.226 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)CCc1ccccc1 ZINC000070978874 134927590 /nfs/dbraw/zinc/92/75/90/134927590.db2.gz SEAZLTLTSFUMJT-UHFFFAOYSA-N 1 2 243.310 2.001 20 0 BEADLO Cc1csc([C@H](C)[NH2+]Cc2ccnn2C)n1 ZINC000070732501 135011014 /nfs/dbraw/zinc/01/10/14/135011014.db2.gz WBADAVJZQQZWDL-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO Cc1ncsc1C[NH2+]Cc1cscn1 ZINC000070836932 135014133 /nfs/dbraw/zinc/01/41/33/135014133.db2.gz GQUNKARWSNQQAL-UHFFFAOYSA-N 1 2 225.342 2.198 20 0 BEADLO C[C@@H]1C[C@H]1C(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000250289821 135052009 /nfs/dbraw/zinc/05/20/09/135052009.db2.gz QBGCEAOAHJSXAP-MXWKQRLJSA-N 1 2 233.315 2.119 20 0 BEADLO c1sc([C@H]2COCC[NH2+]2)nc1C1CCC1 ZINC000258251014 135132259 /nfs/dbraw/zinc/13/22/59/135132259.db2.gz NUIAYQUYPFKFLP-SECBINFHSA-N 1 2 224.329 2.072 20 0 BEADLO O=C(NCc1c[nH+]c[nH]1)c1sccc1Cl ZINC000087721769 135165442 /nfs/dbraw/zinc/16/54/42/135165442.db2.gz OJFDQIXWRGMGTF-UHFFFAOYSA-N 1 2 241.703 2.055 20 0 BEADLO O=C(NCc1c[nH]c[nH+]1)c1sccc1Cl ZINC000087721769 135165443 /nfs/dbraw/zinc/16/54/43/135165443.db2.gz OJFDQIXWRGMGTF-UHFFFAOYSA-N 1 2 241.703 2.055 20 0 BEADLO C[NH2+]Cc1noc([C@@H](C)c2ccsc2)n1 ZINC000261553470 135193210 /nfs/dbraw/zinc/19/32/10/135193210.db2.gz SMZDQBLJKIMZRI-ZETCQYMHSA-N 1 2 223.301 2.002 20 0 BEADLO Nc1ccc(NC(=O)C(C2CC2)C2CC2)c[nH+]1 ZINC000261564543 135206934 /nfs/dbraw/zinc/20/69/34/135206934.db2.gz XSEWXJAHWXCXDM-UHFFFAOYSA-N 1 2 231.299 2.039 20 0 BEADLO CO[C@H](C)[C@@H](C)Nc1cc(C)[nH+]c(C(C)C)n1 ZINC000342452445 135275474 /nfs/dbraw/zinc/27/54/74/135275474.db2.gz DGULAUVXIJOJCX-GHMZBOCLSA-N 1 2 237.347 2.166 20 0 BEADLO Cc1c[nH+]c(CN2Cc3ccccc3C2)n1C ZINC000342796021 135319422 /nfs/dbraw/zinc/31/94/22/135319422.db2.gz IZCSYLOXPKWFQM-UHFFFAOYSA-N 1 2 227.311 2.244 20 0 BEADLO Cc1cnc(C[NH+]2CCC(C(F)F)CC2)n1C ZINC000342799862 135320867 /nfs/dbraw/zinc/32/08/67/135320867.db2.gz PAGJJTMBLKCHLN-UHFFFAOYSA-N 1 2 243.301 2.206 20 0 BEADLO Cc1c[nH+]c(CN2CCC(C(F)F)CC2)n1C ZINC000342799862 135320869 /nfs/dbraw/zinc/32/08/69/135320869.db2.gz PAGJJTMBLKCHLN-UHFFFAOYSA-N 1 2 243.301 2.206 20 0 BEADLO C[C@H]1COC(C)(C)C[N@@H+]1Cc1cncc(F)c1 ZINC000334295088 135342343 /nfs/dbraw/zinc/34/23/43/135342343.db2.gz VNMNTRUULLTMKF-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H]1COC(C)(C)C[N@H+]1Cc1cncc(F)c1 ZINC000334295088 135342345 /nfs/dbraw/zinc/34/23/45/135342345.db2.gz VNMNTRUULLTMKF-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO Fc1ccc(C2([NH2+]Cc3ncc[nH]3)CC2)cc1 ZINC000342993296 135343043 /nfs/dbraw/zinc/34/30/43/135343043.db2.gz LMNZJORZYWGFEA-UHFFFAOYSA-N 1 2 231.274 2.328 20 0 BEADLO Fc1ccc(CN2CCC[C@H]2c2[nH]cc[nH+]2)nc1 ZINC000334305670 135348618 /nfs/dbraw/zinc/34/86/18/135348618.db2.gz GRJWITSHTPUKRH-LBPRGKRZSA-N 1 2 246.289 2.281 20 0 BEADLO Cc1csc([C@@H](C)[NH2+]Cc2ccnc(C)n2)n1 ZINC000080274985 135367692 /nfs/dbraw/zinc/36/76/92/135367692.db2.gz QFZKFEIGTHBPJC-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO COc1ccc(C[N@@H+]2CCOCC23CC3)cc1C ZINC000334385624 135382041 /nfs/dbraw/zinc/38/20/41/135382041.db2.gz NHYVSAYMYQIDRI-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO COc1ccc(C[N@H+]2CCOCC23CC3)cc1C ZINC000334385624 135382043 /nfs/dbraw/zinc/38/20/43/135382043.db2.gz NHYVSAYMYQIDRI-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO Cc1cn[nH]c1C[NH+]1CCC(C(F)F)CC1 ZINC000334390066 135383578 /nfs/dbraw/zinc/38/35/78/135383578.db2.gz SLWJJRBLVORFJC-UHFFFAOYSA-N 1 2 229.274 2.195 20 0 BEADLO C[N@H+](Cc1cnccn1)Cc1cccc(F)c1F ZINC000080965021 135384734 /nfs/dbraw/zinc/38/47/34/135384734.db2.gz XXCWLBYNHVUZOE-UHFFFAOYSA-N 1 2 249.264 2.387 20 0 BEADLO C[N@@H+](Cc1cnccn1)Cc1cccc(F)c1F ZINC000080965021 135384735 /nfs/dbraw/zinc/38/47/35/135384735.db2.gz XXCWLBYNHVUZOE-UHFFFAOYSA-N 1 2 249.264 2.387 20 0 BEADLO CCOC(=O)C[N@H+](CCC(F)(F)F)C(C)C ZINC000077111531 135391036 /nfs/dbraw/zinc/39/10/36/135391036.db2.gz CEKNJDIOCXFMQK-UHFFFAOYSA-N 1 2 241.253 2.212 20 0 BEADLO CCOC(=O)C[N@@H+](CCC(F)(F)F)C(C)C ZINC000077111531 135391038 /nfs/dbraw/zinc/39/10/38/135391038.db2.gz CEKNJDIOCXFMQK-UHFFFAOYSA-N 1 2 241.253 2.212 20 0 BEADLO Cc1cn2c([nH+]1)[C@H](CNC(=O)C(C)(C)C)CCC2 ZINC000334410538 135392586 /nfs/dbraw/zinc/39/25/86/135392586.db2.gz JUROAWVGKLVGSH-NSHDSACASA-N 1 2 249.358 2.231 20 0 BEADLO COC1C[NH+](Cc2cc(F)cc3cccnc32)C1 ZINC000334413323 135396599 /nfs/dbraw/zinc/39/65/99/135396599.db2.gz VUWSKOMCWYMWHU-UHFFFAOYSA-N 1 2 246.285 2.205 20 0 BEADLO Clc1ccc(CN2CCn3cc[nH+]c3C2)o1 ZINC000334427650 135398387 /nfs/dbraw/zinc/39/83/87/135398387.db2.gz XGIIOJLIMALDMW-UHFFFAOYSA-N 1 2 237.690 2.145 20 0 BEADLO COc1cccc(CN(C)c2cc(C)[nH+]cn2)c1 ZINC000346602822 135942470 /nfs/dbraw/zinc/94/24/70/135942470.db2.gz CWTJBWKJIPVOKN-UHFFFAOYSA-N 1 2 243.310 2.430 20 0 BEADLO C[C@@H]1CCC[C@@H]1CC(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000347711645 136003022 /nfs/dbraw/zinc/00/30/22/136003022.db2.gz UTYABCUHKQJQTG-GHMZBOCLSA-N 1 2 235.331 2.194 20 0 BEADLO CCC1CCN(c2cc(C)[nH+]cn2)CC1 ZINC000335295898 136006231 /nfs/dbraw/zinc/00/62/31/136006231.db2.gz DMFYPKIWELUSDJ-UHFFFAOYSA-N 1 2 205.305 2.411 20 0 BEADLO Cc1cnn(C)c1C[N@H+](C)CCC(F)(F)F ZINC000347848701 136012523 /nfs/dbraw/zinc/01/25/23/136012523.db2.gz MIYFCIHCCUOOIN-UHFFFAOYSA-N 1 2 235.253 2.113 20 0 BEADLO Cc1cnn(C)c1C[N@@H+](C)CCC(F)(F)F ZINC000347848701 136012524 /nfs/dbraw/zinc/01/25/24/136012524.db2.gz MIYFCIHCCUOOIN-UHFFFAOYSA-N 1 2 235.253 2.113 20 0 BEADLO Fc1ccc(CN2CCn3c[nH+]cc3C2)c(F)c1 ZINC000335325477 136051287 /nfs/dbraw/zinc/05/12/87/136051287.db2.gz RBLAFPYDHWKOGL-UHFFFAOYSA-N 1 2 249.264 2.177 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)[C@H]1CC[C@H](C)C1 ZINC000348270673 136058742 /nfs/dbraw/zinc/05/87/42/136058742.db2.gz GWOYSCVRRFXBPI-QWRGUYRKSA-N 1 2 248.326 2.143 20 0 BEADLO COc1cncc(C[N@@H+]2CC[C@](C)(F)C2)c1 ZINC000335352573 136069721 /nfs/dbraw/zinc/06/97/21/136069721.db2.gz ZFTHDKGSYYETIB-LBPRGKRZSA-N 1 2 224.279 2.024 20 0 BEADLO COc1cncc(C[N@H+]2CC[C@](C)(F)C2)c1 ZINC000335352573 136069722 /nfs/dbraw/zinc/06/97/22/136069722.db2.gz ZFTHDKGSYYETIB-LBPRGKRZSA-N 1 2 224.279 2.024 20 0 BEADLO CCc1ccc(C[N@H+](C)Cc2ccnn2C)cn1 ZINC000348364687 136073011 /nfs/dbraw/zinc/07/30/11/136073011.db2.gz CFIPYVXVEODEQB-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO CCc1ccc(C[N@@H+](C)Cc2ccnn2C)cn1 ZINC000348364687 136073012 /nfs/dbraw/zinc/07/30/12/136073012.db2.gz CFIPYVXVEODEQB-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO F[C@@H]1CCN(c2cc[nH+]c3ccncc32)C1 ZINC000335401911 136082306 /nfs/dbraw/zinc/08/23/06/136082306.db2.gz WPEQUDHGTSPWFB-SECBINFHSA-N 1 2 217.247 2.178 20 0 BEADLO Cc1cc(N[C@@H]2CCC[C@@H](F)C2)nc[nH+]1 ZINC000335382115 136087755 /nfs/dbraw/zinc/08/77/55/136087755.db2.gz YHPDVXZPNNRZOU-NXEZZACHSA-N 1 2 209.268 2.478 20 0 BEADLO Cc1cc(N[C@@H]2CCC[C@H](F)C2)nc[nH+]1 ZINC000335382117 136087917 /nfs/dbraw/zinc/08/79/17/136087917.db2.gz YHPDVXZPNNRZOU-VHSXEESVSA-N 1 2 209.268 2.478 20 0 BEADLO Cn1c2ccccc2[nH+]c1N1CC[C@@H](F)C1 ZINC000335398308 136093311 /nfs/dbraw/zinc/09/33/11/136093311.db2.gz IVWPIIBEZWVHKR-SECBINFHSA-N 1 2 219.263 2.122 20 0 BEADLO Cc1c(Cl)c(C[NH2+]C2CC(F)(F)C2)nn1C ZINC000335559131 136100321 /nfs/dbraw/zinc/10/03/21/136100321.db2.gz ODWLBZCBVAZQBM-UHFFFAOYSA-N 1 2 249.692 2.269 20 0 BEADLO Clc1ccc(C[N@@H+]2C[C@@H]3C[C@H]2CS3)nc1 ZINC000335584015 136101060 /nfs/dbraw/zinc/10/10/60/136101060.db2.gz NNKRQJORUITZPU-QWRGUYRKSA-N 1 2 240.759 2.425 20 0 BEADLO Clc1ccc(C[N@H+]2C[C@@H]3C[C@H]2CS3)nc1 ZINC000335584015 136101061 /nfs/dbraw/zinc/10/10/61/136101061.db2.gz NNKRQJORUITZPU-QWRGUYRKSA-N 1 2 240.759 2.425 20 0 BEADLO Cc1cc(CNC(=O)[C@H]2CC23CC3)cc(C)[nH+]1 ZINC000335593471 136103812 /nfs/dbraw/zinc/10/38/12/136103812.db2.gz CTGVRFKPTQKWFR-GFCCVEGCSA-N 1 2 230.311 2.115 20 0 BEADLO CC[C@@H]1CN(c2cccc[nH+]2)C[C@H](CC)O1 ZINC000335567492 136108238 /nfs/dbraw/zinc/10/82/38/136108238.db2.gz IYKAXPFWJDOLMD-TXEJJXNPSA-N 1 2 220.316 2.475 20 0 BEADLO Cc1cc(C(=O)C[N@@H+]2CC[C@@](C)(F)C2)c(C)[nH]1 ZINC000335568935 136108618 /nfs/dbraw/zinc/10/86/18/136108618.db2.gz HHTPKMQMFVRYOG-CYBMUJFWSA-N 1 2 238.306 2.248 20 0 BEADLO Cc1cc(C(=O)C[N@H+]2CC[C@@](C)(F)C2)c(C)[nH]1 ZINC000335568935 136108619 /nfs/dbraw/zinc/10/86/19/136108619.db2.gz HHTPKMQMFVRYOG-CYBMUJFWSA-N 1 2 238.306 2.248 20 0 BEADLO CC(C)[C@@H]1C[N@H+](Cc2cnns2)CCS1 ZINC000335570624 136109579 /nfs/dbraw/zinc/10/95/79/136109579.db2.gz WWJQJOBDIGZUBY-JTQLQIEISA-N 1 2 243.401 2.112 20 0 BEADLO CC(C)[C@@H]1C[N@@H+](Cc2cnns2)CCS1 ZINC000335570624 136109580 /nfs/dbraw/zinc/10/95/80/136109580.db2.gz WWJQJOBDIGZUBY-JTQLQIEISA-N 1 2 243.401 2.112 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@H](C)c2csnn2)CCS1 ZINC000335579082 136111702 /nfs/dbraw/zinc/11/17/02/136111702.db2.gz IMGHZNUCLBFILY-RKDXNWHRSA-N 1 2 243.401 2.427 20 0 BEADLO CC[C@@H]1C[N@H+]([C@H](C)c2csnn2)CCS1 ZINC000335579082 136111703 /nfs/dbraw/zinc/11/17/03/136111703.db2.gz IMGHZNUCLBFILY-RKDXNWHRSA-N 1 2 243.401 2.427 20 0 BEADLO CCC[C@H](CC)Nc1[nH+]cnc2c1cnn2C ZINC000050164905 322849436 /nfs/dbraw/zinc/84/94/36/322849436.db2.gz XHCIZJYJFDFUMX-VIFPVBQESA-N 1 2 233.319 2.354 20 0 BEADLO CCc1[nH]c(CNC(=O)C(C)(CC)CC)c[nH+]1 ZINC001646325316 1172731257 /nfs/dbraw/zinc/73/12/57/1172731257.db2.gz LYJPWEZJWLABTD-UHFFFAOYSA-N 1 2 237.347 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)C(C)(CC)CC)[nH+]1 ZINC001646325316 1172731265 /nfs/dbraw/zinc/73/12/65/1172731265.db2.gz LYJPWEZJWLABTD-UHFFFAOYSA-N 1 2 237.347 2.415 20 0 BEADLO CC1(C)CCC[C@@H](C[N@@H+]2CCn3nccc3C2)O1 ZINC001647856636 1172772284 /nfs/dbraw/zinc/77/22/84/1172772284.db2.gz IRVFRRKLRPNKOT-ZDUSSCGKSA-N 1 2 249.358 2.046 20 0 BEADLO CC1(C)CCC[C@@H](C[N@H+]2CCn3nccc3C2)O1 ZINC001647856636 1172772289 /nfs/dbraw/zinc/77/22/89/1172772289.db2.gz IRVFRRKLRPNKOT-ZDUSSCGKSA-N 1 2 249.358 2.046 20 0 BEADLO CCS[C@H](C)c1noc(C[N@H+](C)C2CC2)n1 ZINC000178304211 397845741 /nfs/dbraw/zinc/84/57/41/397845741.db2.gz FVDYXRIBCSDBPS-MRVPVSSYSA-N 1 2 241.360 2.478 20 0 BEADLO CCS[C@H](C)c1noc(C[N@@H+](C)C2CC2)n1 ZINC000178304211 397845745 /nfs/dbraw/zinc/84/57/45/397845745.db2.gz FVDYXRIBCSDBPS-MRVPVSSYSA-N 1 2 241.360 2.478 20 0 BEADLO Cc1c[nH+]cc(NCc2cn(C(C)(C)C)nn2)c1 ZINC000191541185 397890019 /nfs/dbraw/zinc/89/00/19/397890019.db2.gz AZDVVKUGLGIAEF-UHFFFAOYSA-N 1 2 245.330 2.349 20 0 BEADLO CCC1(C(=O)N2CCC[C@H](c3[nH]cc[nH+]3)C2)CC1 ZINC000267273485 397946213 /nfs/dbraw/zinc/94/62/13/397946213.db2.gz SKWUGOLIZPSWPR-NSHDSACASA-N 1 2 247.342 2.306 20 0 BEADLO C/C=C(\C=C\C(=O)N[C@@H](C)Cn1cc[nH+]c1)CC ZINC000268767932 397953875 /nfs/dbraw/zinc/95/38/75/397953875.db2.gz OKCLEINQTCERDL-BUBXUHRASA-N 1 2 247.342 2.300 20 0 BEADLO CCc1cc(N[C@@H](C)[C@H](OC)C2CC2)nc[nH+]1 ZINC000388245885 397954957 /nfs/dbraw/zinc/95/49/57/397954957.db2.gz SUJRXCUTCQENMX-ZANVPECISA-N 1 2 235.331 2.264 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C(C)(C)COC ZINC000270013242 397959368 /nfs/dbraw/zinc/95/93/68/397959368.db2.gz BJRMGEBCHZCXHC-UHFFFAOYSA-N 1 2 236.315 2.255 20 0 BEADLO O=C(Nc1cc[nH+]cc1O)C1CCCCCC1 ZINC000408166075 397962531 /nfs/dbraw/zinc/96/25/31/397962531.db2.gz WIWABIWJXAQWEH-UHFFFAOYSA-N 1 2 234.299 2.118 20 0 BEADLO C[C@@H](CC(=O)N1CC(C)(C)C[C@@H]1C)n1cc[nH+]c1 ZINC000650098568 397920777 /nfs/dbraw/zinc/92/07/77/397920777.db2.gz JIKDYAGSMGJHTA-RYUDHWBXSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@H](NCc1cn2ccccc2[nH+]1)C(F)F ZINC000389904827 397997882 /nfs/dbraw/zinc/99/78/82/397997882.db2.gz GFDBRTRGAPWALY-QMMMGPOBSA-N 1 2 225.242 2.078 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)o1 ZINC000302735657 398001236 /nfs/dbraw/zinc/00/12/36/398001236.db2.gz DDYHATZXSPZYBA-QMMMGPOBSA-N 1 2 249.236 2.152 20 0 BEADLO Cc1nnc(C[N@H+]2CCC[C@H](C(F)(F)F)C2)o1 ZINC000302735657 398001239 /nfs/dbraw/zinc/00/12/39/398001239.db2.gz DDYHATZXSPZYBA-QMMMGPOBSA-N 1 2 249.236 2.152 20 0 BEADLO CCc1cc[nH+]cc1NCc1cnc(C)nc1 ZINC000650243040 398005278 /nfs/dbraw/zinc/00/52/78/398005278.db2.gz IEXDVDFVMKKAKN-UHFFFAOYSA-N 1 2 228.299 2.355 20 0 BEADLO COCc1cc[nH+]c(NCc2ccn(C)c2)c1 ZINC000650243622 398006287 /nfs/dbraw/zinc/00/62/87/398006287.db2.gz IHCFZNBNTMXJKI-UHFFFAOYSA-N 1 2 231.299 2.179 20 0 BEADLO COCc1cc[nH+]c(NCC2(F)CC2)c1 ZINC000650243694 398006371 /nfs/dbraw/zinc/00/63/71/398006371.db2.gz LPGSKFCCRAAWRT-UHFFFAOYSA-N 1 2 210.252 2.142 20 0 BEADLO CCn1cc(CNc2cc(COC)cc[nH+]2)cn1 ZINC000650243500 398006688 /nfs/dbraw/zinc/00/66/88/398006688.db2.gz BBOWPQNIYXQFOL-UHFFFAOYSA-N 1 2 246.314 2.057 20 0 BEADLO COC(=O)C(C)(C)[NH2+]C[C@H](C)Cc1ccccc1 ZINC000274819245 398016844 /nfs/dbraw/zinc/01/68/44/398016844.db2.gz GMFALHGNQRQWDC-GFCCVEGCSA-N 1 2 249.354 2.406 20 0 BEADLO C(c1noc(C2CC2)n1)[N@@H+]1CCC12CCCC2 ZINC000649656664 398026957 /nfs/dbraw/zinc/02/69/57/398026957.db2.gz XEGBHMLOIYPYOU-UHFFFAOYSA-N 1 2 233.315 2.466 20 0 BEADLO C(c1noc(C2CC2)n1)[N@H+]1CCC12CCCC2 ZINC000649656664 398026959 /nfs/dbraw/zinc/02/69/59/398026959.db2.gz XEGBHMLOIYPYOU-UHFFFAOYSA-N 1 2 233.315 2.466 20 0 BEADLO Cc1nc(N(CC2CC2)CC2CC2)cc[nH+]1 ZINC000361033113 397969641 /nfs/dbraw/zinc/96/96/41/397969641.db2.gz RGQSLSIJXACQQJ-UHFFFAOYSA-N 1 2 217.316 2.411 20 0 BEADLO C[C@H]([NH2+]Cc1cc2n(n1)CCC2)c1ccccn1 ZINC000649581703 397969573 /nfs/dbraw/zinc/96/95/73/397969573.db2.gz JSYNRPAIELRPNV-NSHDSACASA-N 1 2 242.326 2.075 20 0 BEADLO C[C@@]1(NC(=O)C=Cc2c[nH]c[nH+]2)CC=CCC1 ZINC000493699266 397971566 /nfs/dbraw/zinc/97/15/66/397971566.db2.gz YBRZRNOWDJTGSD-URWSZGRFSA-N 1 2 231.299 2.038 20 0 BEADLO C[C@H]1c2ccccc2C[N@H+]1CC(=O)NCC1CC1 ZINC000361058409 397972727 /nfs/dbraw/zinc/97/27/27/397972727.db2.gz PLQZBWZMLZFYAM-NSHDSACASA-N 1 2 244.338 2.089 20 0 BEADLO C[C@H]1c2ccccc2C[N@@H+]1CC(=O)NCC1CC1 ZINC000361058409 397972729 /nfs/dbraw/zinc/97/27/29/397972729.db2.gz PLQZBWZMLZFYAM-NSHDSACASA-N 1 2 244.338 2.089 20 0 BEADLO CO[C@@H]1[C@@H](C)[C@@H](Nc2cc[nH+]c(C)n2)C1(C)C ZINC000271754777 397972931 /nfs/dbraw/zinc/97/29/31/397972931.db2.gz CPSGNYTURIVRSM-XXILOJSOSA-N 1 2 235.331 2.256 20 0 BEADLO CO[C@@H]1[C@H](C)[C@H](Nc2cc[nH+]c(C)n2)C1(C)C ZINC000271754773 397973145 /nfs/dbraw/zinc/97/31/45/397973145.db2.gz CPSGNYTURIVRSM-JFUSQASVSA-N 1 2 235.331 2.256 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H]1CCO[C@H](C)C1 ZINC000271979890 397976342 /nfs/dbraw/zinc/97/63/42/397976342.db2.gz OKNHGVWTPMKADM-MNOVXSKESA-N 1 2 234.299 2.144 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N1CCC[C@@H]2CCC[C@H]21 ZINC000279262254 398042680 /nfs/dbraw/zinc/04/26/80/398042680.db2.gz VEJRLFZARVQSKH-NWDGAFQWSA-N 1 2 247.342 2.133 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@@H+]1Cc1ncc(C)cn1 ZINC000649717039 398059393 /nfs/dbraw/zinc/05/93/93/398059393.db2.gz UOAXJMAZSAFYKM-GFCCVEGCSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@H+]1Cc1ncc(C)cn1 ZINC000649717039 398059395 /nfs/dbraw/zinc/05/93/95/398059395.db2.gz UOAXJMAZSAFYKM-GFCCVEGCSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ncc(C)o2)[C@H](CC)CO1 ZINC000649721249 398064872 /nfs/dbraw/zinc/06/48/72/398064872.db2.gz VAYIZQJWFBERGZ-VXGBXAGGSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ncc(C)o2)[C@H](CC)CO1 ZINC000649721249 398064874 /nfs/dbraw/zinc/06/48/74/398064874.db2.gz VAYIZQJWFBERGZ-VXGBXAGGSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C)on2)[C@H](CC)CO1 ZINC000649722331 398065606 /nfs/dbraw/zinc/06/56/06/398065606.db2.gz LYSJBQJVWVVDLQ-CHWSQXEVSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C)on2)[C@H](CC)CO1 ZINC000649722331 398065610 /nfs/dbraw/zinc/06/56/10/398065610.db2.gz LYSJBQJVWVVDLQ-CHWSQXEVSA-N 1 2 238.331 2.372 20 0 BEADLO OCC[N@H+](CC(F)F)CC1CCCCC1 ZINC000186799314 398073593 /nfs/dbraw/zinc/07/35/93/398073593.db2.gz AQFDQZVIZQNXNC-UHFFFAOYSA-N 1 2 221.291 2.126 20 0 BEADLO OCC[N@@H+](CC(F)F)CC1CCCCC1 ZINC000186799314 398073599 /nfs/dbraw/zinc/07/35/99/398073599.db2.gz AQFDQZVIZQNXNC-UHFFFAOYSA-N 1 2 221.291 2.126 20 0 BEADLO CC(C)(C)CCc1noc(Cn2cc[nH+]c2)n1 ZINC000284966152 398078207 /nfs/dbraw/zinc/07/82/07/398078207.db2.gz AVUZYIJKGMDZSN-UHFFFAOYSA-N 1 2 234.303 2.293 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccncc2F)[C@@H](C)CO1 ZINC000649737061 398079731 /nfs/dbraw/zinc/07/97/31/398079731.db2.gz QFSGCTNNKKLUNK-CMPLNLGQSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccncc2F)[C@@H](C)CO1 ZINC000649737061 398079735 /nfs/dbraw/zinc/07/97/35/398079735.db2.gz QFSGCTNNKKLUNK-CMPLNLGQSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C)no2)[C@H](CC)CO1 ZINC000649717770 398059002 /nfs/dbraw/zinc/05/90/02/398059002.db2.gz MEONBTUOTZSPLV-VXGBXAGGSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C)no2)[C@H](CC)CO1 ZINC000649717770 398059005 /nfs/dbraw/zinc/05/90/05/398059005.db2.gz MEONBTUOTZSPLV-VXGBXAGGSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@H](O)CNc1cc[nH+]c2c(OC)cccc12 ZINC000292228241 398103522 /nfs/dbraw/zinc/10/35/22/398103522.db2.gz IOCOEIWVQLIFSW-JTQLQIEISA-N 1 2 246.310 2.426 20 0 BEADLO CCn1cc(C[N@H+](Cc2ccno2)C(C)C)cn1 ZINC000649811874 398119838 /nfs/dbraw/zinc/11/98/38/398119838.db2.gz BBABYXZCOVQBOZ-UHFFFAOYSA-N 1 2 248.330 2.302 20 0 BEADLO CCn1cc(C[N@@H+](Cc2ccno2)C(C)C)cn1 ZINC000649811874 398119841 /nfs/dbraw/zinc/11/98/41/398119841.db2.gz BBABYXZCOVQBOZ-UHFFFAOYSA-N 1 2 248.330 2.302 20 0 BEADLO Cc1nc(N[C@@H]2[C@H]3CCO[C@H]3C23CCC3)cc[nH+]1 ZINC000246227141 398121304 /nfs/dbraw/zinc/12/13/04/398121304.db2.gz WFPODJAIOWQGJC-RAIGVLPGSA-N 1 2 245.326 2.155 20 0 BEADLO CCn1cc[nH+]c1CN(CC(F)F)C(C)C ZINC000135388460 398134309 /nfs/dbraw/zinc/13/43/09/398134309.db2.gz VHKBVRIVTXXCEB-UHFFFAOYSA-N 1 2 231.290 2.379 20 0 BEADLO CC(C)OC(=O)CC[N@@H+]1CCC[C@@H]1C(F)F ZINC000353170793 167154300 /nfs/dbraw/zinc/15/43/00/167154300.db2.gz LLPDRPMOHHJHSB-SECBINFHSA-N 1 2 235.274 2.058 20 0 BEADLO CC(C)OC(=O)CC[N@H+]1CCC[C@@H]1C(F)F ZINC000353170793 167154301 /nfs/dbraw/zinc/15/43/01/167154301.db2.gz LLPDRPMOHHJHSB-SECBINFHSA-N 1 2 235.274 2.058 20 0 BEADLO Cc1[nH]c([C@H]2CCCN2C(=O)CC2CC2)[nH+]c1C ZINC001649368858 1172872072 /nfs/dbraw/zinc/87/20/72/1172872072.db2.gz FBEVLWNKVAQVEI-GFCCVEGCSA-N 1 2 247.342 2.490 20 0 BEADLO C[C@@H]1CCC[C@H](OC(=O)[C@H]2CCCC[NH2+]2)C1 ZINC000085501067 1172884564 /nfs/dbraw/zinc/88/45/64/1172884564.db2.gz YTBDTTBTGHSCIV-GRYCIOLGSA-N 1 2 225.332 2.250 20 0 BEADLO Cc1cnc([C@H](C)[NH2+]Cc2ccc(C)nn2)s1 ZINC001650659608 1172888437 /nfs/dbraw/zinc/88/84/37/1172888437.db2.gz DALPMGSWAPMNTD-JTQLQIEISA-N 1 2 248.355 2.401 20 0 BEADLO COC[C@H]1CCCN1c1cc(C)[nH+]c(C2CC2)n1 ZINC000674413912 487573081 /nfs/dbraw/zinc/57/30/81/487573081.db2.gz QUFHTLDYNJVXQR-GFCCVEGCSA-N 1 2 247.342 2.278 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)C1(CCF)CC1 ZINC000685733811 487575435 /nfs/dbraw/zinc/57/54/35/487575435.db2.gz AUUVRVWAHKOMEA-UHFFFAOYSA-N 1 2 247.273 2.413 20 0 BEADLO C[C@H]1CC[C@H](C(=O)NCCCn2cc[nH+]c2)CC1 ZINC000564800124 322902903 /nfs/dbraw/zinc/90/29/03/322902903.db2.gz BHWJJFGPJURSMC-JOCQHMNTSA-N 1 2 249.358 2.216 20 0 BEADLO C=Cn1cc(C[NH2+][C@@H](C)c2nccn2CC)cn1 ZINC001651073939 1172919872 /nfs/dbraw/zinc/91/98/72/1172919872.db2.gz SQQNYKHWWPPNPP-NSHDSACASA-N 1 2 245.330 2.051 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2c(C)noc2C)nn1C ZINC000680384197 487581644 /nfs/dbraw/zinc/58/16/44/487581644.db2.gz WTHLMHZPXCHCFV-VIFPVBQESA-N 1 2 248.330 2.184 20 0 BEADLO Cc1cn[nH]c1C[N@@H+](C)Cc1cccc(O)c1 ZINC000685832947 487581687 /nfs/dbraw/zinc/58/16/87/487581687.db2.gz QQPNWNDELCANRR-UHFFFAOYSA-N 1 2 231.299 2.056 20 0 BEADLO Cc1cn[nH]c1C[N@H+](C)Cc1cccc(O)c1 ZINC000685832947 487581692 /nfs/dbraw/zinc/58/16/92/487581692.db2.gz QQPNWNDELCANRR-UHFFFAOYSA-N 1 2 231.299 2.056 20 0 BEADLO Cc1c[nH]nc1C[N@@H+](C)Cc1cccc(O)c1 ZINC000685832947 487581697 /nfs/dbraw/zinc/58/16/97/487581697.db2.gz QQPNWNDELCANRR-UHFFFAOYSA-N 1 2 231.299 2.056 20 0 BEADLO Cc1c[nH]nc1C[N@H+](C)Cc1cccc(O)c1 ZINC000685832947 487581700 /nfs/dbraw/zinc/58/17/00/487581700.db2.gz QQPNWNDELCANRR-UHFFFAOYSA-N 1 2 231.299 2.056 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1n[nH]cc1C ZINC000685835531 487584218 /nfs/dbraw/zinc/58/42/18/487584218.db2.gz NAZUVQBPKVQXRN-UHFFFAOYSA-N 1 2 219.288 2.333 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1n[nH]cc1C ZINC000685835531 487584223 /nfs/dbraw/zinc/58/42/23/487584223.db2.gz NAZUVQBPKVQXRN-UHFFFAOYSA-N 1 2 219.288 2.333 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1[nH]ncc1C ZINC000685835531 487584229 /nfs/dbraw/zinc/58/42/29/487584229.db2.gz NAZUVQBPKVQXRN-UHFFFAOYSA-N 1 2 219.288 2.333 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1[nH]ncc1C ZINC000685835531 487584236 /nfs/dbraw/zinc/58/42/36/487584236.db2.gz NAZUVQBPKVQXRN-UHFFFAOYSA-N 1 2 219.288 2.333 20 0 BEADLO C[C@H]([NH2+]Cc1nnc(C2CC2)[nH]1)c1ccoc1 ZINC000680422940 487591316 /nfs/dbraw/zinc/59/13/16/487591316.db2.gz AMUGRYRPUUBEIH-QMMMGPOBSA-N 1 2 232.287 2.126 20 0 BEADLO c1nc(N2CCC3(CC3)C2)cc(NCC2CC2)[nH+]1 ZINC000685918330 487596878 /nfs/dbraw/zinc/59/68/78/487596878.db2.gz AYOVLAGYRDPBFM-UHFFFAOYSA-N 1 2 244.342 2.289 20 0 BEADLO c1nc(NCC2CC2)cc(N2CCC3(CC3)C2)[nH+]1 ZINC000685918330 487596884 /nfs/dbraw/zinc/59/68/84/487596884.db2.gz AYOVLAGYRDPBFM-UHFFFAOYSA-N 1 2 244.342 2.289 20 0 BEADLO C[C@@H]1C[N@H+](CC2(F)CC2)C[C@](C)(C(F)F)O1 ZINC000668821628 487597149 /nfs/dbraw/zinc/59/71/49/487597149.db2.gz IRUXMNXZKQSZIP-PSASIEDQSA-N 1 2 237.265 2.233 20 0 BEADLO C[C@@H]1C[N@@H+](CC2(F)CC2)C[C@](C)(C(F)F)O1 ZINC000668821628 487597154 /nfs/dbraw/zinc/59/71/54/487597154.db2.gz IRUXMNXZKQSZIP-PSASIEDQSA-N 1 2 237.265 2.233 20 0 BEADLO Fc1cccnc1N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000674650514 487601170 /nfs/dbraw/zinc/60/11/70/487601170.db2.gz OQBNEXLZHJOYBG-NSHDSACASA-N 1 2 246.289 2.259 20 0 BEADLO C[C@H]1C[C@H](NC(=O)NC2(C)CCC2)c2[nH+]ccn21 ZINC000556769590 322922860 /nfs/dbraw/zinc/92/28/60/322922860.db2.gz QFZIHORETQHKJW-UWVGGRQHSA-N 1 2 248.330 2.131 20 0 BEADLO CC(C)SCC[N@H+](C)Cc1ccon1 ZINC000282985894 167324105 /nfs/dbraw/zinc/32/41/05/167324105.db2.gz DSCYAIRLMFWSCK-UHFFFAOYSA-N 1 2 214.334 2.248 20 0 BEADLO CC(C)SCC[N@@H+](C)Cc1ccon1 ZINC000282985894 167324107 /nfs/dbraw/zinc/32/41/07/167324107.db2.gz DSCYAIRLMFWSCK-UHFFFAOYSA-N 1 2 214.334 2.248 20 0 BEADLO C[C@H](CC(=O)N[C@@]1(C)CC=CCC1)n1cc[nH+]c1 ZINC000650092806 409526195 /nfs/dbraw/zinc/52/61/95/409526195.db2.gz VVLSUMMDVGNHMI-OCCSQVGLSA-N 1 2 247.342 2.449 20 0 BEADLO FC1(F)CC12CC[NH+](Cc1cocn1)CC2 ZINC000651953228 409571656 /nfs/dbraw/zinc/57/16/56/409571656.db2.gz XQCDXCFAXWYDCU-UHFFFAOYSA-N 1 2 228.242 2.296 20 0 BEADLO CC(C)c1cccc(C[N@H+]2CC(=O)N[C@@H](C)C2)c1 ZINC000660726408 409657074 /nfs/dbraw/zinc/65/70/74/409657074.db2.gz VMAZPMCWMZEYDY-LBPRGKRZSA-N 1 2 246.354 2.130 20 0 BEADLO CC(C)c1cccc(C[N@@H+]2CC(=O)N[C@@H](C)C2)c1 ZINC000660726408 409657086 /nfs/dbraw/zinc/65/70/86/409657086.db2.gz VMAZPMCWMZEYDY-LBPRGKRZSA-N 1 2 246.354 2.130 20 0 BEADLO CCn1nncc1CNc1[nH+]cccc1SC ZINC000651971886 409944538 /nfs/dbraw/zinc/94/45/38/409944538.db2.gz YXLHYJWQZHGTDS-UHFFFAOYSA-N 1 2 249.343 2.027 20 0 BEADLO CCO[C@@]1(C)C[C@H]1Nc1cc(CC)[nH+]cn1 ZINC000624556165 410041682 /nfs/dbraw/zinc/04/16/82/410041682.db2.gz XCBBSSYRHCTPIK-PWSUYJOCSA-N 1 2 221.304 2.018 20 0 BEADLO CCc1cc[nH+]cc1NCC[C@@H]1CCOC1 ZINC000651979406 410112510 /nfs/dbraw/zinc/11/25/10/410112510.db2.gz OYJZVHGCTUOWOO-LLVKDONJSA-N 1 2 220.316 2.483 20 0 BEADLO CCc1cc[nH+]cc1NCC[C@H]1CCOC1 ZINC000651979407 410112585 /nfs/dbraw/zinc/11/25/85/410112585.db2.gz OYJZVHGCTUOWOO-NSHDSACASA-N 1 2 220.316 2.483 20 0 BEADLO CN(Cc1cc(C(C)(C)C)on1)Cc1c[nH+]c[nH]1 ZINC000661089641 410157880 /nfs/dbraw/zinc/15/78/80/410157880.db2.gz DTITZKSDRVYXDR-UHFFFAOYSA-N 1 2 248.330 2.327 20 0 BEADLO CN(Cc1cc(C(C)(C)C)on1)Cc1c[nH]c[nH+]1 ZINC000661089641 410157889 /nfs/dbraw/zinc/15/78/89/410157889.db2.gz DTITZKSDRVYXDR-UHFFFAOYSA-N 1 2 248.330 2.327 20 0 BEADLO C[C@@H](NC(=O)[C@H]1C[C@@H]1C1CCCC1)c1[nH]cc[nH+]1 ZINC000655402740 410207576 /nfs/dbraw/zinc/20/75/76/410207576.db2.gz PIWNMOXDFYZQCC-JLLWLGSASA-N 1 2 247.342 2.413 20 0 BEADLO CC[C@@H](CO)N(C)c1[nH+]ccc2c(N)cccc21 ZINC000663948296 410397234 /nfs/dbraw/zinc/39/72/34/410397234.db2.gz WOEPKLNAOVTALX-JTQLQIEISA-N 1 2 245.326 2.024 20 0 BEADLO Cc1cc(NC[C@@]2(C)CC2(F)F)nc[nH+]1 ZINC000664398563 410577713 /nfs/dbraw/zinc/57/77/13/410577713.db2.gz PDYWFSGNPBTODA-SECBINFHSA-N 1 2 213.231 2.242 20 0 BEADLO Cc1cc(N[C@H](C)C2(CO)CC2)nc(C2CC2)[nH+]1 ZINC000664273891 410547604 /nfs/dbraw/zinc/54/76/04/410547604.db2.gz ZGCNHXUKDJOXPH-SNVBAGLBSA-N 1 2 247.342 2.235 20 0 BEADLO CCO[C@H]1C[C@H](Nc2cc(NC3CC3)[nH+]cn2)C1 ZINC000664281586 410550948 /nfs/dbraw/zinc/55/09/48/410550948.db2.gz HHMLNFMINCPQHL-XYPYZODXSA-N 1 2 248.330 2.030 20 0 BEADLO CCO[C@H]1C[C@H](Nc2cc(NC3CC3)nc[nH+]2)C1 ZINC000664281586 410550953 /nfs/dbraw/zinc/55/09/53/410550953.db2.gz HHMLNFMINCPQHL-XYPYZODXSA-N 1 2 248.330 2.030 20 0 BEADLO CCC[C@@H](C)NC(=O)Cc1cn2c([nH+]1)CCCC2 ZINC000651053738 410774292 /nfs/dbraw/zinc/77/42/92/410774292.db2.gz UMYRTCVZFXTMKL-LLVKDONJSA-N 1 2 249.358 2.067 20 0 BEADLO CC[C@H](C)N(C)C(=O)Cc1cn2c([nH+]1)CCCC2 ZINC000651219470 410867875 /nfs/dbraw/zinc/86/78/75/410867875.db2.gz WSLHSDAWALCSJM-NSHDSACASA-N 1 2 249.358 2.019 20 0 BEADLO CC(C)C[NH2+]c1ccc2c(c1)NC(=O)CO2 ZINC000020125535 167016270 /nfs/dbraw/zinc/01/62/70/167016270.db2.gz ZHJOFZFIARCQGE-UHFFFAOYSA-N 1 2 220.272 2.085 20 0 BEADLO COc1ccc(N[C@@H](C)c2ccncn2)[nH+]c1 ZINC000651300058 410907640 /nfs/dbraw/zinc/90/76/40/410907640.db2.gz MFSSVLLDCPBARG-VIFPVBQESA-N 1 2 230.271 2.053 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1C[C@@H](OC)C12CCC2 ZINC000651302511 410910980 /nfs/dbraw/zinc/91/09/80/410910980.db2.gz XGHADMAKMDUJHX-VXGBXAGGSA-N 1 2 248.326 2.460 20 0 BEADLO Cc1c[nH+]cc(N[C@H](C)Cc2cnccn2)c1 ZINC000651300921 410908371 /nfs/dbraw/zinc/90/83/71/410908371.db2.gz LLUJIFKPEMMXHG-LLVKDONJSA-N 1 2 228.299 2.223 20 0 BEADLO CC(C)Oc1ccc(NCc2c[nH+]cn2C)cn1 ZINC000269483499 167297522 /nfs/dbraw/zinc/29/75/22/167297522.db2.gz GOWFPZIGXLKTEO-UHFFFAOYSA-N 1 2 246.314 2.214 20 0 BEADLO CC(C)[C@@H](C)C(=O)N(C)CCCn1cc[nH+]c1 ZINC000178091801 167347052 /nfs/dbraw/zinc/34/70/52/167347052.db2.gz RSWHHUJMLFXHMK-GFCCVEGCSA-N 1 2 237.347 2.024 20 0 BEADLO CC(C)[C@@H](C)N(C(=O)CCn1cc[nH+]c1)C1CC1 ZINC000299663972 167361997 /nfs/dbraw/zinc/36/19/97/167361997.db2.gz NTKUHRNWGMVTIT-GFCCVEGCSA-N 1 2 249.358 2.309 20 0 BEADLO CC(C)CCN(C)c1cc(CO)cc[nH+]1 ZINC000042457680 411009891 /nfs/dbraw/zinc/00/98/91/411009891.db2.gz RYTGUENQLNMFEQ-UHFFFAOYSA-N 1 2 208.305 2.056 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1C[C@H]1C1CCCC1 ZINC000651427301 411015040 /nfs/dbraw/zinc/01/50/40/411015040.db2.gz SIRYVZARLGPJAM-NWDGAFQWSA-N 1 2 247.342 2.161 20 0 BEADLO CCCC(C)(C)C(=O)NCc1[nH]c[nH+]c1C ZINC000651427280 411015138 /nfs/dbraw/zinc/01/51/38/411015138.db2.gz RGXLRRJTEDDTMK-UHFFFAOYSA-N 1 2 223.320 2.161 20 0 BEADLO CCc1cccc(CNc2cc(C)[nH+]cn2)c1 ZINC000651462986 411046312 /nfs/dbraw/zinc/04/63/12/411046312.db2.gz HFBZEFYYBLBBFE-UHFFFAOYSA-N 1 2 227.311 2.381 20 0 BEADLO CO[C@@H]([C@@H](C)[NH2+][C@H](C)c1cn[nH]c1C)C1CC1 ZINC000651463720 411048618 /nfs/dbraw/zinc/04/86/18/411048618.db2.gz LSUVMHPZNMROCR-JQEORGNBSA-N 1 2 237.347 2.182 20 0 BEADLO C[C@@H](N(C)c1cc(CO)cc[nH+]1)C(C)(C)C ZINC000042779008 411042495 /nfs/dbraw/zinc/04/24/95/411042495.db2.gz YIENPXLIHRWBMP-SNVBAGLBSA-N 1 2 222.332 2.445 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc3cnccc3o2)CCO1 ZINC000651611063 411129829 /nfs/dbraw/zinc/12/98/29/411129829.db2.gz GVLJDCGUCHYGTR-SNVBAGLBSA-N 1 2 232.283 2.049 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc3cnccc3o2)CCO1 ZINC000651611063 411129831 /nfs/dbraw/zinc/12/98/31/411129831.db2.gz GVLJDCGUCHYGTR-SNVBAGLBSA-N 1 2 232.283 2.049 20 0 BEADLO C[C@H](CC(=O)N1CC[C@@H]2CCC[C@@H]21)n1cc[nH+]c1 ZINC000651781276 411143264 /nfs/dbraw/zinc/14/32/64/411143264.db2.gz GHJHNGRAYPTDSU-AGIUHOORSA-N 1 2 247.342 2.235 20 0 BEADLO CC(C)c1nc(C[N@H+](C)[C@H]2CCOC2)cs1 ZINC000106883374 167663800 /nfs/dbraw/zinc/66/38/00/167663800.db2.gz IIEMOZAVMAKQDS-NSHDSACASA-N 1 2 240.372 2.487 20 0 BEADLO CC(C)c1nc(C[N@@H+](C)[C@H]2CCOC2)cs1 ZINC000106883374 167663802 /nfs/dbraw/zinc/66/38/02/167663802.db2.gz IIEMOZAVMAKQDS-NSHDSACASA-N 1 2 240.372 2.487 20 0 BEADLO CC[C@@H](COC)Nc1cc(COC)cc[nH+]1 ZINC000652068196 411105443 /nfs/dbraw/zinc/10/54/43/411105443.db2.gz VSXFIPQUPHLYPK-NSHDSACASA-N 1 2 224.304 2.065 20 0 BEADLO Cc1nc(C[N@H+](C)CCOCC2CC2)c(C)o1 ZINC000659997626 411161807 /nfs/dbraw/zinc/16/18/07/411161807.db2.gz JYGVHBMWGCDLBW-UHFFFAOYSA-N 1 2 238.331 2.150 20 0 BEADLO Cc1nc(C[N@@H+](C)CCOCC2CC2)c(C)o1 ZINC000659997626 411161813 /nfs/dbraw/zinc/16/18/13/411161813.db2.gz JYGVHBMWGCDLBW-UHFFFAOYSA-N 1 2 238.331 2.150 20 0 BEADLO CCCC(C)(C)C(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000651546391 411118100 /nfs/dbraw/zinc/11/81/00/411118100.db2.gz RQHOSQIXRVPFQD-JTQLQIEISA-N 1 2 249.358 2.210 20 0 BEADLO CCCC(C)(C)C(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000651546391 411118104 /nfs/dbraw/zinc/11/81/04/411118104.db2.gz RQHOSQIXRVPFQD-JTQLQIEISA-N 1 2 249.358 2.210 20 0 BEADLO Cc1cnc(C[N@@H+]2CCOC(C)(C)[C@@H]2C)s1 ZINC000334373226 411123164 /nfs/dbraw/zinc/12/31/64/411123164.db2.gz SODLLHOFYOWFSG-JTQLQIEISA-N 1 2 240.372 2.451 20 0 BEADLO Cc1cnc(C[N@H+]2CCOC(C)(C)[C@@H]2C)s1 ZINC000334373226 411123167 /nfs/dbraw/zinc/12/31/67/411123167.db2.gz SODLLHOFYOWFSG-JTQLQIEISA-N 1 2 240.372 2.451 20 0 BEADLO c1cc2n(n1)CCC[C@@H]2Nc1cccc[nH+]1 ZINC000657940198 411175285 /nfs/dbraw/zinc/17/52/85/411175285.db2.gz HZNLPRDLWKXNLQ-JTQLQIEISA-N 1 2 214.272 2.225 20 0 BEADLO COc1c(C)[nH+]cnc1N1C[C@@H](C)C[C@H](C)C1 ZINC000656103713 411178935 /nfs/dbraw/zinc/17/89/35/411178935.db2.gz AHAJEYFQDFSUEI-UWVGGRQHSA-N 1 2 235.331 2.276 20 0 BEADLO COc1c(C)[nH+]cnc1N1C[C@H](C)C[C@@H](C)C1 ZINC000656103712 411179011 /nfs/dbraw/zinc/17/90/11/411179011.db2.gz AHAJEYFQDFSUEI-NXEZZACHSA-N 1 2 235.331 2.276 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCc1nccs1 ZINC000656113279 411180593 /nfs/dbraw/zinc/18/05/93/411180593.db2.gz QKZQSBXWFZLUID-UHFFFAOYSA-N 1 2 234.328 2.205 20 0 BEADLO COc1c(C)[nH+]cnc1NC[C@H](C)C1CC1 ZINC000656111484 411181037 /nfs/dbraw/zinc/18/10/37/411181037.db2.gz IODYUCSWTUXQPX-QMMMGPOBSA-N 1 2 221.304 2.252 20 0 BEADLO COc1c(C)[nH+]cnc1NC[C@@H](C)C1CC1 ZINC000656111483 411181098 /nfs/dbraw/zinc/18/10/98/411181098.db2.gz IODYUCSWTUXQPX-MRVPVSSYSA-N 1 2 221.304 2.252 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1CC=CCC1 ZINC000656127720 411183393 /nfs/dbraw/zinc/18/33/93/411183393.db2.gz YEFNUTQWOSQAAY-SNVBAGLBSA-N 1 2 219.288 2.314 20 0 BEADLO Cc1c[nH+]c(C)c(NCc2ccc(CO)o2)c1 ZINC000404777946 411184860 /nfs/dbraw/zinc/18/48/60/411184860.db2.gz PJEIJLWBMSKKBZ-UHFFFAOYSA-N 1 2 232.283 2.396 20 0 BEADLO COc1c(C)[nH+]cnc1N(C)CCC1CC1 ZINC000656149471 411186328 /nfs/dbraw/zinc/18/63/28/411186328.db2.gz VNPHEXOLSRRRDV-UHFFFAOYSA-N 1 2 221.304 2.030 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)C[C@@H]1CCCC[C@@H]1O ZINC000656152687 411186941 /nfs/dbraw/zinc/18/69/41/411186941.db2.gz CKINGXBBXUMSSP-STQMWFEESA-N 1 2 249.358 2.081 20 0 BEADLO c1cnc(C[N@@H+]2CCC[C@H](OC3CCC3)C2)nc1 ZINC000653811277 411188577 /nfs/dbraw/zinc/18/85/77/411188577.db2.gz CEBXJPBARFHGQY-ZDUSSCGKSA-N 1 2 247.342 2.010 20 0 BEADLO c1cnc(C[N@H+]2CCC[C@H](OC3CCC3)C2)nc1 ZINC000653811277 411188579 /nfs/dbraw/zinc/18/85/79/411188579.db2.gz CEBXJPBARFHGQY-ZDUSSCGKSA-N 1 2 247.342 2.010 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+][C@@H](C)COCC1CC1 ZINC000652287523 411190033 /nfs/dbraw/zinc/19/00/33/411190033.db2.gz ZHZVPUNVFBLXOU-VHSXEESVSA-N 1 2 237.347 2.184 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@H]2CCCn3nccc32)no1 ZINC000658005378 411195697 /nfs/dbraw/zinc/19/56/97/411195697.db2.gz ZGMRZKMJCNTTBL-MNOVXSKESA-N 1 2 246.314 2.365 20 0 BEADLO C[C@H]([NH2+][C@H]1C[C@@H](C)n2ncnc21)c1ccco1 ZINC000658097783 411244696 /nfs/dbraw/zinc/24/46/96/411244696.db2.gz JBXVZLPFJGZFHB-UTLUCORTSA-N 1 2 232.287 2.228 20 0 BEADLO Fc1cc2c(cc1F)CN(CCn1cc[nH+]c1)C2 ZINC000653831825 411196364 /nfs/dbraw/zinc/19/63/64/411196364.db2.gz NWCDHOODLDTKOW-UHFFFAOYSA-N 1 2 249.264 2.177 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@H]1CC[C@@H]1C ZINC000656188209 411196599 /nfs/dbraw/zinc/19/65/99/411196599.db2.gz ZRZUPVIJTNGIEP-CBAPKCEASA-N 1 2 207.277 2.004 20 0 BEADLO COC1(CCNc2nc(C)[nH+]cc2C)CCC1 ZINC000656191768 411198357 /nfs/dbraw/zinc/19/83/57/411198357.db2.gz PPFJOEDAHSIQEM-UHFFFAOYSA-N 1 2 235.331 2.465 20 0 BEADLO C[C@H]([NH2+][C@H]1C[C@H](C)n2ncnc21)c1ccco1 ZINC000658097776 411244956 /nfs/dbraw/zinc/24/49/56/411244956.db2.gz JBXVZLPFJGZFHB-GUBZILKMSA-N 1 2 232.287 2.228 20 0 BEADLO COCc1cc[nH+]c(N[C@H](C)c2ccnn2C)c1 ZINC000652330366 411202099 /nfs/dbraw/zinc/20/20/99/411202099.db2.gz DLMNZIRPLQPTAH-SNVBAGLBSA-N 1 2 246.314 2.135 20 0 BEADLO COCCC[C@@H](C)Nc1cc(COC)cc[nH+]1 ZINC000652330717 411202656 /nfs/dbraw/zinc/20/26/56/411202656.db2.gz NKHRGADFSFJQKZ-LLVKDONJSA-N 1 2 238.331 2.455 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1C[C@H]1c1ccco1 ZINC000656201530 411206189 /nfs/dbraw/zinc/20/61/89/411206189.db2.gz JJVIFSLUKSCWOG-NXEZZACHSA-N 1 2 245.282 2.355 20 0 BEADLO COc1c(C)[nH+]cnc1N1CC(C)(C)C[C@@H]1C ZINC000656201995 411206569 /nfs/dbraw/zinc/20/65/69/411206569.db2.gz YJPUADOTYVBRKJ-VIFPVBQESA-N 1 2 235.331 2.418 20 0 BEADLO COc1c(C)[nH+]cnc1N1C[C@H](C)[C@H](C)[C@H]1C ZINC000656204948 411207578 /nfs/dbraw/zinc/20/75/78/411207578.db2.gz QGVKPIOEQFQFEE-ATZCPNFKSA-N 1 2 235.331 2.274 20 0 BEADLO COc1c(C)[nH+]cnc1N1C[C@H](C)[C@@H](C)[C@@H]1C ZINC000656204950 411207884 /nfs/dbraw/zinc/20/78/84/411207884.db2.gz QGVKPIOEQFQFEE-NGZCFLSTSA-N 1 2 235.331 2.274 20 0 BEADLO COc1c(C)[nH+]cnc1N1C[C@H](C)[C@@H](C)[C@H]1C ZINC000656204949 411208021 /nfs/dbraw/zinc/20/80/21/411208021.db2.gz QGVKPIOEQFQFEE-IQJOONFLSA-N 1 2 235.331 2.274 20 0 BEADLO C[C@H]1C[C@H]1C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000048698146 411208884 /nfs/dbraw/zinc/20/88/84/411208884.db2.gz MOPBISHXAQHSDD-WDEREUQCSA-N 1 2 241.294 2.467 20 0 BEADLO C[C@H]([NH2+][C@@H]1C[C@H](C)n2ncnc21)c1ccccn1 ZINC000658101338 411245975 /nfs/dbraw/zinc/24/59/75/411245975.db2.gz LFQUVSBFYYEXGL-JBLDHEPKSA-N 1 2 243.314 2.030 20 0 BEADLO Cc1cnc(NCCc2[nH+]cc(C)cc2C)nc1 ZINC000656210863 411210878 /nfs/dbraw/zinc/21/08/78/411210878.db2.gz IZKUKILVUFRGHK-UHFFFAOYSA-N 1 2 242.326 2.451 20 0 BEADLO Cc1c[nH+]c(CCNc2ncccn2)c(C)c1 ZINC000656210640 411211443 /nfs/dbraw/zinc/21/14/43/411211443.db2.gz CBPANCBWFPEFDJ-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO COc1ccc2c(c1)CN(c1cc[nH+]c(C)n1)C2 ZINC000656222447 411214145 /nfs/dbraw/zinc/21/41/45/411214145.db2.gz HZMDZQRNVQJDJV-UHFFFAOYSA-N 1 2 241.294 2.314 20 0 BEADLO Cc1cc(C)c(CNC(=O)N2CC(C)(C)C2)c[nH+]1 ZINC000656253199 411218566 /nfs/dbraw/zinc/21/85/66/411218566.db2.gz ZRUNUEVYEAGUPW-UHFFFAOYSA-N 1 2 247.342 2.250 20 0 BEADLO Cc1noc(C)c1C[NH+]1CC2(CC2(F)F)C1 ZINC000656266096 411221608 /nfs/dbraw/zinc/22/16/08/411221608.db2.gz CHWUBPDTNUFGFO-UHFFFAOYSA-N 1 2 228.242 2.132 20 0 BEADLO FC1(F)CC12C[NH+](Cc1[nH]nc3ccccc31)C2 ZINC000656265585 411221844 /nfs/dbraw/zinc/22/18/44/411221844.db2.gz CNTWQOUMFBGNLI-UHFFFAOYSA-N 1 2 249.264 2.404 20 0 BEADLO FC1(F)CC12C[NH+](Cc1n[nH]c3ccccc31)C2 ZINC000656265585 411221845 /nfs/dbraw/zinc/22/18/45/411221845.db2.gz CNTWQOUMFBGNLI-UHFFFAOYSA-N 1 2 249.264 2.404 20 0 BEADLO CC[C@@]1(C)C[C@H]1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000652411835 411234110 /nfs/dbraw/zinc/23/41/10/411234110.db2.gz ZNNCLNAYTAZUQU-ZANVPECISA-N 1 2 235.331 2.197 20 0 BEADLO C=C/C(C)=C/CC(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000652412423 411234450 /nfs/dbraw/zinc/23/44/50/411234450.db2.gz CENILDDRSREKSL-UXBLZVDNSA-N 1 2 233.315 2.283 20 0 BEADLO CCc1cc(NCCC2(OC)CCC2)nc[nH+]1 ZINC000310362636 411235151 /nfs/dbraw/zinc/23/51/51/411235151.db2.gz UXHXTDGJMWLRAW-UHFFFAOYSA-N 1 2 235.331 2.410 20 0 BEADLO COCc1ccc(-c2[nH+]ccn2C)cc1F ZINC000656371701 411238494 /nfs/dbraw/zinc/23/84/94/411238494.db2.gz QBKWULGKJMEGOT-UHFFFAOYSA-N 1 2 220.247 2.373 20 0 BEADLO CC(C)(C)[C@@H]1CCC[N@H+](CCc2cnn[nH]2)C1 ZINC000660452976 411166473 /nfs/dbraw/zinc/16/64/73/411166473.db2.gz GLKVZYHWYJKHKT-LLVKDONJSA-N 1 2 236.363 2.105 20 0 BEADLO CC(C)(C)[C@@H]1CCC[N@@H+](CCc2cnn[nH]2)C1 ZINC000660452976 411166474 /nfs/dbraw/zinc/16/64/74/411166474.db2.gz GLKVZYHWYJKHKT-LLVKDONJSA-N 1 2 236.363 2.105 20 0 BEADLO Cc1c[nH]nc1C[NH2+]Cc1cc(F)cc(F)c1 ZINC000352827293 411261533 /nfs/dbraw/zinc/26/15/33/411261533.db2.gz YDSKJPPHJXUHNZ-UHFFFAOYSA-N 1 2 237.253 2.286 20 0 BEADLO CCCC[C@H](CC)[NH2+]Cc1nnc(COC)[nH]1 ZINC000658162854 411276307 /nfs/dbraw/zinc/27/63/07/411276307.db2.gz WLPLXWLLVMQINK-JTQLQIEISA-N 1 2 240.351 2.010 20 0 BEADLO C[C@H]1CC[N@H+](CCn2cc(Cl)cn2)C[C@@H]1F ZINC000656494607 411283677 /nfs/dbraw/zinc/28/36/77/411283677.db2.gz VYBHCSBFRGIAIH-ONGXEEELSA-N 1 2 245.729 2.216 20 0 BEADLO C[C@H]1CC[N@@H+](CCn2cc(Cl)cn2)C[C@@H]1F ZINC000656494607 411283680 /nfs/dbraw/zinc/28/36/80/411283680.db2.gz VYBHCSBFRGIAIH-ONGXEEELSA-N 1 2 245.729 2.216 20 0 BEADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2cnccn2)o1 ZINC000656490073 411285593 /nfs/dbraw/zinc/28/55/93/411285593.db2.gz IFNMNRBXCUFDDL-GXFFZTMASA-N 1 2 243.310 2.483 20 0 BEADLO FC(F)C1C[NH+](Cc2[nH]nc3ccccc32)C1 ZINC000656690349 411329997 /nfs/dbraw/zinc/32/99/97/411329997.db2.gz LAFRYYJJFUHDMK-UHFFFAOYSA-N 1 2 237.253 2.260 20 0 BEADLO FC(F)C1C[NH+](Cc2n[nH]c3ccccc32)C1 ZINC000656690349 411330000 /nfs/dbraw/zinc/33/00/00/411330000.db2.gz LAFRYYJJFUHDMK-UHFFFAOYSA-N 1 2 237.253 2.260 20 0 BEADLO CC(C)([NH2+]Cc1cnc(C2CC2)nc1)C(F)F ZINC000656582780 411303841 /nfs/dbraw/zinc/30/38/41/411303841.db2.gz OKMGUVCPHZVQFM-UHFFFAOYSA-N 1 2 241.285 2.487 20 0 BEADLO c1ccc2[nH+]c(NC3COCCOC3)ccc2c1 ZINC000310985704 411305051 /nfs/dbraw/zinc/30/50/51/411305051.db2.gz RSWUGGOJZVLUFG-UHFFFAOYSA-N 1 2 244.294 2.062 20 0 BEADLO Cc1cc(-n2cccn2)ccc1[NH2+]CC[C@@H](C)O ZINC000656650468 411315880 /nfs/dbraw/zinc/31/58/80/411315880.db2.gz AIYIISVYPSNBQF-GFCCVEGCSA-N 1 2 245.326 2.364 20 0 BEADLO CCOC1C[NH+](Cc2cc3ccccc3[nH]2)C1 ZINC000656657892 411317877 /nfs/dbraw/zinc/31/78/77/411317877.db2.gz HUJANPRGAAEMAC-UHFFFAOYSA-N 1 2 230.311 2.389 20 0 BEADLO Cc1cc(NC(=O)NC2(C)CC=CC2)cc[nH+]1 ZINC000654025978 411319586 /nfs/dbraw/zinc/31/95/86/411319586.db2.gz WZWXLLSZQHGWOA-UHFFFAOYSA-N 1 2 231.299 2.042 20 0 BEADLO FC1(F)CCC[C@H]1N[C@H]1CCCn2cc[nH+]c21 ZINC000655769298 411251300 /nfs/dbraw/zinc/25/13/00/411251300.db2.gz XIYIHTBYHRGFPL-VHSXEESVSA-N 1 2 241.285 2.495 20 0 BEADLO Cc1ccoc1C[NH2+][C@@H]1CCCn2ccnc21 ZINC000655769834 411251980 /nfs/dbraw/zinc/25/19/80/411251980.db2.gz POQCXAPHLXQOJG-LLVKDONJSA-N 1 2 231.299 2.409 20 0 BEADLO Cc1cc(NCc2[nH+]ccn2C(C)C)nnc1C ZINC000656772989 411354494 /nfs/dbraw/zinc/35/44/94/411354494.db2.gz IOQMXNANSAKALH-UHFFFAOYSA-N 1 2 245.330 2.483 20 0 BEADLO Cc1nc(C[NH2+]C2(CC(C)C)CC2)no1 ZINC000662068044 411355436 /nfs/dbraw/zinc/35/54/36/411355436.db2.gz AOQOQKMKCLDMSM-UHFFFAOYSA-N 1 2 209.293 2.046 20 0 BEADLO CC1(CO)C[NH+](Cc2cscc2Cl)C1 ZINC000656775810 411356864 /nfs/dbraw/zinc/35/68/64/411356864.db2.gz RZNFHZVEVLINFV-UHFFFAOYSA-N 1 2 231.748 2.216 20 0 BEADLO CC(C)n1cc[nH+]c1CNc1ccon1 ZINC000656767494 411362625 /nfs/dbraw/zinc/36/26/25/411362625.db2.gz MSIXBHLVMIETBD-UHFFFAOYSA-N 1 2 206.249 2.064 20 0 BEADLO c1cc(C[N@@H+]2CCc3nccnc3C2)cs1 ZINC000662119773 411362923 /nfs/dbraw/zinc/36/29/23/411362923.db2.gz VZDXAKMWHYRFDR-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1cc(C[N@H+]2CCc3nccnc3C2)cs1 ZINC000662119773 411362925 /nfs/dbraw/zinc/36/29/25/411362925.db2.gz VZDXAKMWHYRFDR-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO Cc1[nH+]cccc1NCc1cn(C2CCC2)nn1 ZINC000656767743 411362992 /nfs/dbraw/zinc/36/29/92/411362992.db2.gz AUOMWADKNVYDPK-UHFFFAOYSA-N 1 2 243.314 2.319 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2nccn2C)o1 ZINC000070008281 411365928 /nfs/dbraw/zinc/36/59/28/411365928.db2.gz OTDSQTUMVJHDMV-SNVBAGLBSA-N 1 2 219.288 2.172 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cncs1)c1nccn1C ZINC000658337666 411345057 /nfs/dbraw/zinc/34/50/57/411345057.db2.gz VNLFIQNVAGCFFZ-DTWKUNHWSA-N 1 2 236.344 2.288 20 0 BEADLO CC1(CCNc2nc[nH+]c(N)c2Cl)CC1 ZINC000281423373 168021852 /nfs/dbraw/zinc/02/18/52/168021852.db2.gz IWDUGWQSYFINAT-UHFFFAOYSA-N 1 2 226.711 2.314 20 0 BEADLO CC1(CCNc2[nH+]cnc(N)c2Cl)CC1 ZINC000281423373 168021854 /nfs/dbraw/zinc/02/18/54/168021854.db2.gz IWDUGWQSYFINAT-UHFFFAOYSA-N 1 2 226.711 2.314 20 0 BEADLO CC1(CNC(=O)C=Cc2c[nH]c[nH+]2)CCCC1 ZINC000276648939 168027577 /nfs/dbraw/zinc/02/75/77/168027577.db2.gz WIPVFWYLBKYIQZ-SNAWJCMRSA-N 1 2 233.315 2.119 20 0 BEADLO CC1(CNC(=O)CCc2[nH]cc[nH+]2)CCCC1 ZINC000332323253 168029207 /nfs/dbraw/zinc/02/92/07/168029207.db2.gz NWXOZMACQNRAIP-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO Cc1cc[nH+]cc1Cc1nc(CC2CC2)no1 ZINC000656751850 411348085 /nfs/dbraw/zinc/34/80/85/411348085.db2.gz XZHLFKNBMWWJPY-UHFFFAOYSA-N 1 2 229.283 2.316 20 0 BEADLO CC1(NC(=O)c2ccc3[nH+]ccn3c2)CCCC1 ZINC000264019481 168061377 /nfs/dbraw/zinc/06/13/77/168061377.db2.gz DPOQAPMEDWXSOB-UHFFFAOYSA-N 1 2 243.310 2.397 20 0 BEADLO CC1=C(C)C[N@H+](Cc2ncnn2C(C)C)CC1 ZINC000280757317 168085154 /nfs/dbraw/zinc/08/51/54/168085154.db2.gz NVKBKUBTOBWLRY-UHFFFAOYSA-N 1 2 234.347 2.401 20 0 BEADLO CC1=C(C)C[N@@H+](Cc2ncnn2C(C)C)CC1 ZINC000280757317 168085156 /nfs/dbraw/zinc/08/51/56/168085156.db2.gz NVKBKUBTOBWLRY-UHFFFAOYSA-N 1 2 234.347 2.401 20 0 BEADLO CC1=CCC[N@H+](Cc2nc(-c3ccco3)no2)C1 ZINC000280785109 168100017 /nfs/dbraw/zinc/10/00/17/168100017.db2.gz IQBKCGCRINITQS-UHFFFAOYSA-N 1 2 245.282 2.482 20 0 BEADLO CC1=CCC[N@@H+](Cc2nc(-c3ccco3)no2)C1 ZINC000280785109 168100019 /nfs/dbraw/zinc/10/00/19/168100019.db2.gz IQBKCGCRINITQS-UHFFFAOYSA-N 1 2 245.282 2.482 20 0 BEADLO CC1=CCC[N@@H+](Cc2c(Cl)cnn2C)C1 ZINC000281685618 168100783 /nfs/dbraw/zinc/10/07/83/168100783.db2.gz BDCFIDCGBYAJPN-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO CC1=CCC[N@H+](Cc2c(Cl)cnn2C)C1 ZINC000281685618 168100785 /nfs/dbraw/zinc/10/07/85/168100785.db2.gz BDCFIDCGBYAJPN-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO CC1=CC[N@H+](Cc2nc(-c3ccco3)no2)CC1 ZINC000270346518 168114198 /nfs/dbraw/zinc/11/41/98/168114198.db2.gz OXGAFSUCTMXNRT-UHFFFAOYSA-N 1 2 245.282 2.482 20 0 BEADLO CC1=CC[N@@H+](Cc2nc(-c3ccco3)no2)CC1 ZINC000270346518 168114200 /nfs/dbraw/zinc/11/42/00/168114200.db2.gz OXGAFSUCTMXNRT-UHFFFAOYSA-N 1 2 245.282 2.482 20 0 BEADLO CC1CCC(CNC(=O)CCc2c[nH+]c[nH]2)CC1 ZINC000192865929 168155424 /nfs/dbraw/zinc/15/54/24/168155424.db2.gz KDNKNTJQRIWOAE-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO CC1CCC(CNC(=O)CCc2c[nH]c[nH+]2)CC1 ZINC000192865929 168155427 /nfs/dbraw/zinc/15/54/27/168155427.db2.gz KDNKNTJQRIWOAE-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO CCC(=CC(=O)N[C@H](C)Cn1cc[nH+]c1)CC ZINC000268394477 168196181 /nfs/dbraw/zinc/19/61/81/168196181.db2.gz DMKLGXKPZSLNLW-LLVKDONJSA-N 1 2 235.331 2.134 20 0 BEADLO CCC(=O)CCSc1nc(N)cc(CC)[nH+]1 ZINC000279127824 168205067 /nfs/dbraw/zinc/20/50/67/168205067.db2.gz VOZLCCHLHKRLRZ-UHFFFAOYSA-N 1 2 239.344 2.083 20 0 BEADLO CCC(=O)N1CCCC[C@@H]1c1[nH+]ccn1CC ZINC000281476335 168216802 /nfs/dbraw/zinc/21/68/02/168216802.db2.gz CUXBWTWKZMSBSV-LLVKDONJSA-N 1 2 235.331 2.367 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C)nc(C)n2)C[C@@H](C)O1 ZINC000659918109 411382501 /nfs/dbraw/zinc/38/25/01/411382501.db2.gz JBZZNDQYVMDMAH-BXUZGUMPSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C)nc(C)n2)C[C@@H](C)O1 ZINC000659918109 411382504 /nfs/dbraw/zinc/38/25/04/411382504.db2.gz JBZZNDQYVMDMAH-BXUZGUMPSA-N 1 2 249.358 2.093 20 0 BEADLO c1nn[nH]c1CC[N@@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000659926783 411384071 /nfs/dbraw/zinc/38/40/71/411384071.db2.gz ORFPGLIAGNLLNF-AWEZNQCLSA-N 1 2 246.358 2.170 20 0 BEADLO c1nn[nH]c1CC[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000659926783 411384073 /nfs/dbraw/zinc/38/40/73/411384073.db2.gz ORFPGLIAGNLLNF-AWEZNQCLSA-N 1 2 246.358 2.170 20 0 BEADLO CCC(=O)[C@H](C)Sc1nc(N)cc(CC)[nH+]1 ZINC000279043382 168253289 /nfs/dbraw/zinc/25/32/89/168253289.db2.gz GEJDQSMUKHMFSY-ZETCQYMHSA-N 1 2 239.344 2.081 20 0 BEADLO CCC(C)(C)C(=O)NCCNc1cccc[nH+]1 ZINC000263733466 168265139 /nfs/dbraw/zinc/26/51/39/168265139.db2.gz MCPQVRJIRZJJSJ-UHFFFAOYSA-N 1 2 235.331 2.046 20 0 BEADLO CCC(C)(C)CC(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000362601465 168272055 /nfs/dbraw/zinc/27/20/55/168272055.db2.gz TYXOJCXEZIHUGA-UHFFFAOYSA-N 1 2 223.320 2.194 20 0 BEADLO O=C(CCCn1cc[nH+]c1)NC1CC2(CCC2)C1 ZINC000652972101 411387449 /nfs/dbraw/zinc/38/74/49/411387449.db2.gz QANOXKQNFHRKFL-UHFFFAOYSA-N 1 2 247.342 2.112 20 0 BEADLO Cc1nc(N[C@@H]2CCS[C@@H]2C)cc[nH+]1 ZINC000306676183 411456225 /nfs/dbraw/zinc/45/62/25/411456225.db2.gz VIUBBWXFVMYCQD-VXNVDRBHSA-N 1 2 209.318 2.091 20 0 BEADLO c1cc(C[NH2+]Cc2cn(C3CCC3)nn2)cs1 ZINC000657310838 411459426 /nfs/dbraw/zinc/45/94/26/411459426.db2.gz PAKMYTGRFQWKJA-UHFFFAOYSA-N 1 2 248.355 2.354 20 0 BEADLO CCn1cc([C@@H](C)Nc2cc(C)[nH+]cn2)cn1 ZINC000450879816 411393777 /nfs/dbraw/zinc/39/37/77/411393777.db2.gz VOOLYRAIBXSPPC-SNVBAGLBSA-N 1 2 231.303 2.175 20 0 BEADLO Cc1c[nH+]c(C)c(NCc2cocn2)c1 ZINC000404607574 411401211 /nfs/dbraw/zinc/40/12/11/411401211.db2.gz QCRJGSNQLQVYQR-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO COc1nccc(CNc2cc(C)c[nH+]c2C)n1 ZINC000404610643 411401311 /nfs/dbraw/zinc/40/13/11/411401311.db2.gz RZLAQCGAKZNMAI-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO Cc1nnc(C[NH2+][C@H](C)c2ccsc2)[nH]1 ZINC000129845693 411403309 /nfs/dbraw/zinc/40/33/09/411403309.db2.gz IIZDKCHWUFXZJV-SSDOTTSWSA-N 1 2 222.317 2.025 20 0 BEADLO Nc1ccc(NC(=O)[C@H]2C[C@H]2C2CCCC2)c[nH+]1 ZINC000653048574 411403673 /nfs/dbraw/zinc/40/36/73/411403673.db2.gz JMFZDCPAGSIZNW-RYUDHWBXSA-N 1 2 245.326 2.259 20 0 BEADLO Cc1noc(C[NH2+]C(C)(C)c2cccs2)n1 ZINC000336705893 411405107 /nfs/dbraw/zinc/40/51/07/411405107.db2.gz PQFRDZKWXKHRHM-UHFFFAOYSA-N 1 2 237.328 2.464 20 0 BEADLO Cc1cc(N[C@@H]2CCS[C@@H]2C)nc[nH+]1 ZINC000306925668 411462154 /nfs/dbraw/zinc/46/21/54/411462154.db2.gz NEAJNFCAYWGZRU-RKDXNWHRSA-N 1 2 209.318 2.091 20 0 BEADLO C[C@@H](CNC(=O)CCC1CCC1)Cn1cc[nH+]c1 ZINC000267266486 411420385 /nfs/dbraw/zinc/42/03/85/411420385.db2.gz PWVALISZOHWIDW-LBPRGKRZSA-N 1 2 249.358 2.216 20 0 BEADLO CC(=O)[C@H](C)CCSc1nc(N)cc(C)[nH+]1 ZINC000657236300 411423884 /nfs/dbraw/zinc/42/38/84/411423884.db2.gz IRTXWAYRMVSOHL-SSDOTTSWSA-N 1 2 239.344 2.075 20 0 BEADLO Cc1cc(C(C)C)nc(NCc2[nH+]ccn2C)n1 ZINC000122449247 411432918 /nfs/dbraw/zinc/43/29/18/411432918.db2.gz RAGBMLHTQVTVBH-UHFFFAOYSA-N 1 2 245.330 2.254 20 0 BEADLO CC(C)(C)C(=O)N1CCC[C@H](Cn2cc[nH+]c2)C1 ZINC000657254995 411435639 /nfs/dbraw/zinc/43/56/39/411435639.db2.gz GUKMMDSMBDBETG-GFCCVEGCSA-N 1 2 249.358 2.168 20 0 BEADLO CC(C)(C)C(=O)N1CCC[C@@H](Cn2cc[nH+]c2)C1 ZINC000657254997 411435810 /nfs/dbraw/zinc/43/58/10/411435810.db2.gz GUKMMDSMBDBETG-LBPRGKRZSA-N 1 2 249.358 2.168 20 0 BEADLO COc1ccc(N[C@@H]2CCCn3cc[nH+]c32)cn1 ZINC000655736829 411443733 /nfs/dbraw/zinc/44/37/33/411443733.db2.gz UKRWHCTUYFWMKG-LLVKDONJSA-N 1 2 244.298 2.234 20 0 BEADLO Cc1nn(C)c(C)c1N[C@@H]1CCCn2cc[nH+]c21 ZINC000655748172 411447789 /nfs/dbraw/zinc/44/77/89/411447789.db2.gz RNQFIVPEZSYIBN-LLVKDONJSA-N 1 2 245.330 2.180 20 0 BEADLO O=C(NCc1c[nH+]c[nH]1)c1cccc(C2CC2)c1 ZINC000654819391 411450545 /nfs/dbraw/zinc/45/05/45/411450545.db2.gz GYZZHWACEGXSCM-UHFFFAOYSA-N 1 2 241.294 2.217 20 0 BEADLO O=C(NCc1c[nH]c[nH+]1)c1cccc(C2CC2)c1 ZINC000654819391 411450549 /nfs/dbraw/zinc/45/05/49/411450549.db2.gz GYZZHWACEGXSCM-UHFFFAOYSA-N 1 2 241.294 2.217 20 0 BEADLO Cc1[nH]cc(-c2ccc3c(c2)CCO3)[nH+]1 ZINC000065375851 411467669 /nfs/dbraw/zinc/46/76/69/411467669.db2.gz IBFHLPKCEBOYMH-UHFFFAOYSA-N 1 2 200.241 2.320 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cc(C3CC3)no2)CCO1 ZINC000659837710 411470436 /nfs/dbraw/zinc/47/04/36/411470436.db2.gz HXETVEJLAIISPC-NSHDSACASA-N 1 2 236.315 2.163 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cc(C3CC3)no2)CCO1 ZINC000659837710 411470439 /nfs/dbraw/zinc/47/04/39/411470439.db2.gz HXETVEJLAIISPC-NSHDSACASA-N 1 2 236.315 2.163 20 0 BEADLO Cc1csc([C@H](C)NCc2[nH]cc(C)[nH+]2)n1 ZINC000657345747 411471144 /nfs/dbraw/zinc/47/11/44/411471144.db2.gz XVGLOXFWDCUZOR-VIFPVBQESA-N 1 2 236.344 2.334 20 0 BEADLO COc1cc(C[N@H+](C)[C@H](C)c2ccco2)on1 ZINC000659858474 411480288 /nfs/dbraw/zinc/48/02/88/411480288.db2.gz WHMLBOOXTQQJJC-SECBINFHSA-N 1 2 236.271 2.469 20 0 BEADLO COc1cc(C[N@@H+](C)[C@H](C)c2ccco2)on1 ZINC000659858474 411480291 /nfs/dbraw/zinc/48/02/91/411480291.db2.gz WHMLBOOXTQQJJC-SECBINFHSA-N 1 2 236.271 2.469 20 0 BEADLO COC[C@@H]([NH2+]Cc1nc(C)c[nH]1)c1ccccc1 ZINC000657369332 411480480 /nfs/dbraw/zinc/48/04/80/411480480.db2.gz YZPSFEALXKKQBJ-CYBMUJFWSA-N 1 2 245.326 2.195 20 0 BEADLO CCC[N@H+](CCO[C@@H]1CC1(F)F)CC(F)F ZINC000659868448 411483116 /nfs/dbraw/zinc/48/31/16/411483116.db2.gz OIWFSKGOKTZEFD-MRVPVSSYSA-N 1 2 243.244 2.388 20 0 BEADLO CCC[N@@H+](CCO[C@@H]1CC1(F)F)CC(F)F ZINC000659868448 411483119 /nfs/dbraw/zinc/48/31/19/411483119.db2.gz OIWFSKGOKTZEFD-MRVPVSSYSA-N 1 2 243.244 2.388 20 0 BEADLO CCc1cnc(CNCc2[nH]cc(C)[nH+]2)s1 ZINC000657377091 411486509 /nfs/dbraw/zinc/48/65/09/411486509.db2.gz ADLSVAMKTRECNY-UHFFFAOYSA-N 1 2 236.344 2.027 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@H](CO)c2ccccc2)co1 ZINC000659876272 411487324 /nfs/dbraw/zinc/48/73/24/411487324.db2.gz ZYLAXRRIJPQKJX-CQSZACIVSA-N 1 2 246.310 2.148 20 0 BEADLO Cc1nc(C[N@H+](C)[C@H](CO)c2ccccc2)co1 ZINC000659876272 411487326 /nfs/dbraw/zinc/48/73/26/411487326.db2.gz ZYLAXRRIJPQKJX-CQSZACIVSA-N 1 2 246.310 2.148 20 0 BEADLO CCOc1cccc(NCc2[nH]c(C)c(C)[nH+]2)n1 ZINC000657402155 411496204 /nfs/dbraw/zinc/49/62/04/411496204.db2.gz NSRFSRYKQQRJTP-UHFFFAOYSA-N 1 2 246.314 2.432 20 0 BEADLO CC[C@@H]1C[C@@H](Nc2ccc(C)[nH+]c2)CO1 ZINC000657402865 411497486 /nfs/dbraw/zinc/49/74/86/411497486.db2.gz KGFZLAJOJRCYTO-VXGBXAGGSA-N 1 2 206.289 2.369 20 0 BEADLO COc1ccc(NCc2[nH]cc(C)[nH+]2)c(C)n1 ZINC000657412483 411498717 /nfs/dbraw/zinc/49/87/17/411498717.db2.gz FWPDQKMRIJDAKN-UHFFFAOYSA-N 1 2 232.287 2.042 20 0 BEADLO Cc1cc(NCc2[nH+]ccn2C(C)C)nn1C ZINC000657412236 411498721 /nfs/dbraw/zinc/49/87/21/411498721.db2.gz GFQMSZKABBOVQE-UHFFFAOYSA-N 1 2 233.319 2.118 20 0 BEADLO CC(C)n1cc[nH+]c1CNCc1ncccc1F ZINC000657414707 411498875 /nfs/dbraw/zinc/49/88/75/411498875.db2.gz VKGMOBHPRZPDOS-UHFFFAOYSA-N 1 2 248.305 2.288 20 0 BEADLO Cc1nc(C[N@H+]2CCSC[C@H]2C)c(C)o1 ZINC000659945924 411506593 /nfs/dbraw/zinc/50/65/93/411506593.db2.gz WLWCSTLVOHKKEP-MRVPVSSYSA-N 1 2 226.345 2.229 20 0 BEADLO Cc1nc(C[N@@H+]2CCSC[C@H]2C)c(C)o1 ZINC000659945924 411506596 /nfs/dbraw/zinc/50/65/96/411506596.db2.gz WLWCSTLVOHKKEP-MRVPVSSYSA-N 1 2 226.345 2.229 20 0 BEADLO Cc1nc(C[N@H+]2CCSC[C@@H]2C)c(C)o1 ZINC000659945925 411507623 /nfs/dbraw/zinc/50/76/23/411507623.db2.gz WLWCSTLVOHKKEP-QMMMGPOBSA-N 1 2 226.345 2.229 20 0 BEADLO Cc1nc(C[N@@H+]2CCSC[C@@H]2C)c(C)o1 ZINC000659945925 411507624 /nfs/dbraw/zinc/50/76/24/411507624.db2.gz WLWCSTLVOHKKEP-QMMMGPOBSA-N 1 2 226.345 2.229 20 0 BEADLO Cc1c[nH]c(CNc2cnn([C@@H](C)C3CC3)c2)[nH+]1 ZINC000657440139 411508883 /nfs/dbraw/zinc/50/88/83/411508883.db2.gz NSDMWDTYBRPFKC-JTQLQIEISA-N 1 2 245.330 2.498 20 0 BEADLO COc1cc(C[N@H+](C)Cc2cccc(O)c2)on1 ZINC000659983467 411518676 /nfs/dbraw/zinc/51/86/76/411518676.db2.gz MYVJBPBLXWVHOW-UHFFFAOYSA-N 1 2 248.282 2.021 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2cccc(O)c2)on1 ZINC000659983467 411518679 /nfs/dbraw/zinc/51/86/79/411518679.db2.gz MYVJBPBLXWVHOW-UHFFFAOYSA-N 1 2 248.282 2.021 20 0 BEADLO Cc1c[nH]c(C[NH2+]C(C)(C)c2c(C)noc2C)n1 ZINC000657465709 411519118 /nfs/dbraw/zinc/51/91/18/411519118.db2.gz FERFDAMVBJOPGK-UHFFFAOYSA-N 1 2 248.330 2.348 20 0 BEADLO Cc1c[nH]c(CN[C@H](C2CC2)C(F)(F)F)[nH+]1 ZINC000657470186 411521980 /nfs/dbraw/zinc/52/19/80/411521980.db2.gz ZCSPNIMFOCPAPQ-SECBINFHSA-N 1 2 233.237 2.149 20 0 BEADLO CC[N@H+](Cc1cc(OC)no1)Cc1ccccn1 ZINC000660000421 411525430 /nfs/dbraw/zinc/52/54/30/411525430.db2.gz WOXCKQXOUWAEJE-UHFFFAOYSA-N 1 2 247.298 2.100 20 0 BEADLO CC[N@@H+](Cc1cc(OC)no1)Cc1ccccn1 ZINC000660000421 411525432 /nfs/dbraw/zinc/52/54/32/411525432.db2.gz WOXCKQXOUWAEJE-UHFFFAOYSA-N 1 2 247.298 2.100 20 0 BEADLO CC(C)n1cc[nH+]c1CN[C@@H](C)c1ccn(C)n1 ZINC000657491933 411532418 /nfs/dbraw/zinc/53/24/18/411532418.db2.gz NKLCJPLYPBHPCK-NSHDSACASA-N 1 2 247.346 2.048 20 0 BEADLO CC(C)n1ccnc1C[NH2+][C@@H](C)c1ccn(C)n1 ZINC000657491933 411532421 /nfs/dbraw/zinc/53/24/21/411532421.db2.gz NKLCJPLYPBHPCK-NSHDSACASA-N 1 2 247.346 2.048 20 0 BEADLO Cc1[nH]ncc1C[NH2+]C[C@H]1CCC2(CCCC2)O1 ZINC000655860247 411540196 /nfs/dbraw/zinc/54/01/96/411540196.db2.gz DIYUYTUILCRICF-CYBMUJFWSA-N 1 2 249.358 2.300 20 0 BEADLO CC[N@@H+]1C[C@H]([NH2+]CCCCSC)[C@@H](C)C1 ZINC000309058373 170035597 /nfs/dbraw/zinc/03/55/97/170035597.db2.gz VMFJAVAXSQSYAE-RYUDHWBXSA-N 1 2 230.421 2.059 20 0 BEADLO CCNC(=O)CNc1[nH+]c2ccccc2cc1C ZINC000063105763 170068021 /nfs/dbraw/zinc/06/80/21/170068021.db2.gz XBSQCLUVKCFRGU-UHFFFAOYSA-N 1 2 243.310 2.091 20 0 BEADLO Cn1cnc(C[N@@H+]2CCC[C@@H]2c2cccnc2)c1 ZINC000660136965 411543981 /nfs/dbraw/zinc/54/39/81/411543981.db2.gz DXOQKWZFMKVDTE-CQSZACIVSA-N 1 2 242.326 2.152 20 0 BEADLO Cn1cnc(C[N@H+]2CCC[C@@H]2c2cccnc2)c1 ZINC000660136965 411543983 /nfs/dbraw/zinc/54/39/83/411543983.db2.gz DXOQKWZFMKVDTE-CQSZACIVSA-N 1 2 242.326 2.152 20 0 BEADLO Cc1nc(C[NH2+][C@H](C)c2c(C)noc2C)co1 ZINC000660196180 411552830 /nfs/dbraw/zinc/55/28/30/411552830.db2.gz KLUZOYXGOBYYGU-SSDOTTSWSA-N 1 2 235.287 2.439 20 0 BEADLO C[C@H]1C[C@H]([NH2+]Cc2ccccc2F)c2ncnn21 ZINC000657566958 411552921 /nfs/dbraw/zinc/55/29/21/411552921.db2.gz GFKIBMXLMOIVRZ-CABZTGNLSA-N 1 2 246.289 2.213 20 0 BEADLO CCc1ccc(C[NH2+][C@H]2C[C@@H](C)n3ncnc32)o1 ZINC000657567845 411553330 /nfs/dbraw/zinc/55/33/30/411553330.db2.gz FOIHNCMCMIXVQK-SKDRFNHKSA-N 1 2 246.314 2.229 20 0 BEADLO Cn1c[nH+]c(CN(CC(F)F)CC2CCC2)c1 ZINC000660151128 411547121 /nfs/dbraw/zinc/54/71/21/411547121.db2.gz XKGURWOJVONXDZ-UHFFFAOYSA-N 1 2 243.301 2.287 20 0 BEADLO CC[C@]1(C)COCC[N@@H+]1Cc1nc(C)oc1C ZINC000660149350 411547573 /nfs/dbraw/zinc/54/75/73/411547573.db2.gz QMNXPJNMNPZRAL-CYBMUJFWSA-N 1 2 238.331 2.292 20 0 BEADLO CC[C@]1(C)COCC[N@H+]1Cc1nc(C)oc1C ZINC000660149350 411547574 /nfs/dbraw/zinc/54/75/74/411547574.db2.gz QMNXPJNMNPZRAL-CYBMUJFWSA-N 1 2 238.331 2.292 20 0 BEADLO CCOC(=O)C(C)(C)[NH2+][C@H]1C=CCCC1 ZINC000172825984 170187369 /nfs/dbraw/zinc/18/73/69/170187369.db2.gz AWBISXCKRYFKLF-JTQLQIEISA-N 1 2 211.305 2.026 20 0 BEADLO CCOC(=O)C[N@H+](Cc1ccsc1)C1CC1 ZINC000042469013 170218165 /nfs/dbraw/zinc/21/81/65/170218165.db2.gz DBQJCCPEMCJJQB-UHFFFAOYSA-N 1 2 239.340 2.276 20 0 BEADLO CCOC(=O)C[N@@H+](Cc1ccsc1)C1CC1 ZINC000042469013 170218166 /nfs/dbraw/zinc/21/81/66/170218166.db2.gz DBQJCCPEMCJJQB-UHFFFAOYSA-N 1 2 239.340 2.276 20 0 BEADLO CCOC(=O)C[NH2+][C@@H]1CCC[C@H]1c1ccccc1 ZINC000133497423 170226070 /nfs/dbraw/zinc/22/60/70/170226070.db2.gz LJMKGKDCPHFXQJ-UONOGXRCSA-N 1 2 247.338 2.475 20 0 BEADLO CCOC(=O)C[NH2+][C@H](CC)c1ccccc1 ZINC000037472482 170226860 /nfs/dbraw/zinc/22/68/60/170226860.db2.gz MABZWFSZOUFBEN-GFCCVEGCSA-N 1 2 221.300 2.290 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+](C)Cc1ccc(C)s1 ZINC000102772942 170247844 /nfs/dbraw/zinc/24/78/44/170247844.db2.gz IWCPQWQPRCTJFE-SNVBAGLBSA-N 1 2 241.356 2.440 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(C)s1 ZINC000102772942 170247846 /nfs/dbraw/zinc/24/78/46/170247846.db2.gz IWCPQWQPRCTJFE-SNVBAGLBSA-N 1 2 241.356 2.440 20 0 BEADLO Cc1cn[nH]c1C[NH2+][C@H](C)c1cscn1 ZINC000657600321 411558683 /nfs/dbraw/zinc/55/86/83/411558683.db2.gz OHWAYVJMBHZOAU-MRVPVSSYSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@H](C)c1cscn1 ZINC000657600321 411558684 /nfs/dbraw/zinc/55/86/84/411558684.db2.gz OHWAYVJMBHZOAU-MRVPVSSYSA-N 1 2 222.317 2.025 20 0 BEADLO CCOC(=O)[C@@H]1CCCC[N@@H+]1C/C=C/Cl ZINC000071816379 170257592 /nfs/dbraw/zinc/25/75/92/170257592.db2.gz PNTLJWJZMNLNPB-STUBTGCMSA-N 1 2 231.723 2.157 20 0 BEADLO CCOC(=O)[C@@H]1CCCC[N@H+]1C/C=C/Cl ZINC000071816379 170257593 /nfs/dbraw/zinc/25/75/93/170257593.db2.gz PNTLJWJZMNLNPB-STUBTGCMSA-N 1 2 231.723 2.157 20 0 BEADLO CCOC(CCNc1cccc[nH+]1)OCC ZINC000276211483 170314908 /nfs/dbraw/zinc/31/49/08/170314908.db2.gz LJFPMSXJJCMOTE-UHFFFAOYSA-N 1 2 224.304 2.283 20 0 BEADLO CCOC1CC(COc2cc[nH+]cc2)C1 ZINC000292625074 170326344 /nfs/dbraw/zinc/32/63/44/170326344.db2.gz DSGVVDWEPJLGKV-UHFFFAOYSA-N 1 2 207.273 2.276 20 0 BEADLO CCOC1C[NH+](Cc2cccc(C)c2F)C1 ZINC000297461643 170336923 /nfs/dbraw/zinc/33/69/23/170336923.db2.gz QDFJLTHZVJBGFJ-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO CCc1nocc1C[N@@H+]1C[C@H](C)O[C@H](C)[C@H]1C ZINC000660375860 411575019 /nfs/dbraw/zinc/57/50/19/411575019.db2.gz ZNVLETMTJMZVCF-HBNTYKKESA-N 1 2 238.331 2.235 20 0 BEADLO CCc1nocc1C[N@H+]1C[C@H](C)O[C@H](C)[C@H]1C ZINC000660375860 411575020 /nfs/dbraw/zinc/57/50/20/411575020.db2.gz ZNVLETMTJMZVCF-HBNTYKKESA-N 1 2 238.331 2.235 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)nc(C)n1 ZINC000660375752 411575095 /nfs/dbraw/zinc/57/50/95/411575095.db2.gz XMYDHIHJPVHVFA-TUAOUCFPSA-N 1 2 249.358 2.091 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)nc(C)n1 ZINC000660375752 411575097 /nfs/dbraw/zinc/57/50/97/411575097.db2.gz XMYDHIHJPVHVFA-TUAOUCFPSA-N 1 2 249.358 2.091 20 0 BEADLO CCOCC[N@H+](CC)[C@@H](C)c1nnc(C)s1 ZINC000338311544 170395844 /nfs/dbraw/zinc/39/58/44/170395844.db2.gz DYKFHKHUYBOPQP-VIFPVBQESA-N 1 2 243.376 2.266 20 0 BEADLO CCOCC[N@@H+](CC)[C@@H](C)c1nnc(C)s1 ZINC000338311544 170395845 /nfs/dbraw/zinc/39/58/45/170395845.db2.gz DYKFHKHUYBOPQP-VIFPVBQESA-N 1 2 243.376 2.266 20 0 BEADLO CCOCC[N@H+](CC)Cc1nccs1 ZINC000135061942 170396320 /nfs/dbraw/zinc/39/63/20/170396320.db2.gz DQPPRJNUVYXYEO-UHFFFAOYSA-N 1 2 214.334 2.002 20 0 BEADLO CCOCC[N@@H+](CC)Cc1nccs1 ZINC000135061942 170396321 /nfs/dbraw/zinc/39/63/21/170396321.db2.gz DQPPRJNUVYXYEO-UHFFFAOYSA-N 1 2 214.334 2.002 20 0 BEADLO CCOCC[N@H+](CC)Cc1ncc(C2CC2)o1 ZINC000340846985 170396583 /nfs/dbraw/zinc/39/65/83/170396583.db2.gz JULLLQFDIGLIPR-UHFFFAOYSA-N 1 2 238.331 2.410 20 0 BEADLO CCOCC[N@@H+](CC)Cc1ncc(C2CC2)o1 ZINC000340846985 170396585 /nfs/dbraw/zinc/39/65/85/170396585.db2.gz JULLLQFDIGLIPR-UHFFFAOYSA-N 1 2 238.331 2.410 20 0 BEADLO CCOCC[N@H+](CC)Cc1nnc(C(C)C)o1 ZINC000107680821 170396615 /nfs/dbraw/zinc/39/66/15/170396615.db2.gz JVTZCEYZNUFSFC-UHFFFAOYSA-N 1 2 241.335 2.051 20 0 BEADLO CCOCC[N@@H+](CC)Cc1nnc(C(C)C)o1 ZINC000107680821 170396616 /nfs/dbraw/zinc/39/66/16/170396616.db2.gz JVTZCEYZNUFSFC-UHFFFAOYSA-N 1 2 241.335 2.051 20 0 BEADLO CCOCCN(CC)c1[nH]c2ccccc2[nH+]1 ZINC000270546601 170397171 /nfs/dbraw/zinc/39/71/71/170397171.db2.gz DWMDSGXALUZPCQ-UHFFFAOYSA-N 1 2 233.315 2.426 20 0 BEADLO Cc1c(NCC2CC2)nc[nH+]c1NCC1CC1 ZINC000663374965 411640388 /nfs/dbraw/zinc/64/03/88/411640388.db2.gz IPEWPLRKCSKYKJ-UHFFFAOYSA-N 1 2 232.331 2.429 20 0 BEADLO CCc1nocc1C[N@@H+]1CC(C)(C)OC[C@@H]1C ZINC000660408216 411580853 /nfs/dbraw/zinc/58/08/53/411580853.db2.gz YVBBRMHVWJLOGD-JTQLQIEISA-N 1 2 238.331 2.236 20 0 BEADLO CCc1nocc1C[N@H+]1CC(C)(C)OC[C@@H]1C ZINC000660408216 411580855 /nfs/dbraw/zinc/58/08/55/411580855.db2.gz YVBBRMHVWJLOGD-JTQLQIEISA-N 1 2 238.331 2.236 20 0 BEADLO CC[C@@H](CC(F)F)C[N@H+](CCO)CC(F)F ZINC000660452712 411587355 /nfs/dbraw/zinc/58/73/55/411587355.db2.gz XXBDOUSGNUNEFW-QMMMGPOBSA-N 1 2 245.260 2.227 20 0 BEADLO CC[C@@H](CC(F)F)C[N@@H+](CCO)CC(F)F ZINC000660452712 411587356 /nfs/dbraw/zinc/58/73/56/411587356.db2.gz XXBDOUSGNUNEFW-QMMMGPOBSA-N 1 2 245.260 2.227 20 0 BEADLO CO[C@H](C[NH2+]Cc1cn[nH]c1C)C1CCCC1 ZINC000657768085 411593459 /nfs/dbraw/zinc/59/34/59/411593459.db2.gz VGAFGZVNOMKHSQ-CYBMUJFWSA-N 1 2 237.347 2.013 20 0 BEADLO CC(C)n1cncc1C[NH2+][C@H](C)c1nccn1C ZINC000657792764 411599001 /nfs/dbraw/zinc/59/90/01/411599001.db2.gz FVYMRKHDMRMEKS-LLVKDONJSA-N 1 2 247.346 2.048 20 0 BEADLO Cn1nccc1C[NH2+]CC(F)(F)C(C)(C)C ZINC000657793849 411599175 /nfs/dbraw/zinc/59/91/75/411599175.db2.gz QJZZEDXXBAVKES-UHFFFAOYSA-N 1 2 231.290 2.191 20 0 BEADLO Cc1nc(C[N@@H+]2CCC(F)(F)[C@H](C)C2)co1 ZINC000660565839 411601242 /nfs/dbraw/zinc/60/12/42/411601242.db2.gz HPPBEDGJFRMUHY-MRVPVSSYSA-N 1 2 230.258 2.460 20 0 BEADLO Cc1nc(C[N@H+]2CCC(F)(F)[C@H](C)C2)co1 ZINC000660565839 411601244 /nfs/dbraw/zinc/60/12/44/411601244.db2.gz HPPBEDGJFRMUHY-MRVPVSSYSA-N 1 2 230.258 2.460 20 0 BEADLO Cc1cn(C)nc1NCc1c[nH+]cn1C(C)C ZINC000657811527 411603378 /nfs/dbraw/zinc/60/33/78/411603378.db2.gz AZDMLKYZIQTRHL-UHFFFAOYSA-N 1 2 233.319 2.118 20 0 BEADLO Cc1nc(C[NH2+][C@@H]2CCCn3nccc32)cs1 ZINC000657845275 411611596 /nfs/dbraw/zinc/61/15/96/411611596.db2.gz UVYDODRAGNAXQK-LLVKDONJSA-N 1 2 248.355 2.273 20 0 BEADLO C[C@H]([NH2+]Cc1ccn[nH]1)C(C)(C)C(F)F ZINC000657875168 411615034 /nfs/dbraw/zinc/61/50/34/411615034.db2.gz HIFCDLGUDIQLJT-ZETCQYMHSA-N 1 2 217.263 2.179 20 0 BEADLO C[N@H+](CCCF)[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000660763705 411623027 /nfs/dbraw/zinc/62/30/27/411623027.db2.gz KJTTZAFMFXWBFG-GFCCVEGCSA-N 1 2 248.305 2.186 20 0 BEADLO C[N@@H+](CCCF)[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000660763705 411623030 /nfs/dbraw/zinc/62/30/30/411623030.db2.gz KJTTZAFMFXWBFG-GFCCVEGCSA-N 1 2 248.305 2.186 20 0 BEADLO C[N@H+](Cc1n[nH]c(=O)o1)[C@@H]1C=CCCCCC1 ZINC000660843059 411654913 /nfs/dbraw/zinc/65/49/13/411654913.db2.gz SZHNSFROINDHIB-SNVBAGLBSA-N 1 2 237.303 2.096 20 0 BEADLO C[N@@H+](Cc1n[nH]c(=O)o1)[C@@H]1C=CCCCCC1 ZINC000660843059 411654918 /nfs/dbraw/zinc/65/49/18/411654918.db2.gz SZHNSFROINDHIB-SNVBAGLBSA-N 1 2 237.303 2.096 20 0 BEADLO CCCC[C@H](CC)C[N@H+](C)Cc1n[nH]c(=O)o1 ZINC000660845198 411656983 /nfs/dbraw/zinc/65/69/83/411656983.db2.gz KTTSYBMCBKHPHA-JTQLQIEISA-N 1 2 241.335 2.423 20 0 BEADLO CCCC[C@H](CC)C[N@@H+](C)Cc1n[nH]c(=O)o1 ZINC000660845198 411656987 /nfs/dbraw/zinc/65/69/87/411656987.db2.gz KTTSYBMCBKHPHA-JTQLQIEISA-N 1 2 241.335 2.423 20 0 BEADLO Nc1cccc2c1cc[nH+]c2N1CCCOCC1 ZINC000663474391 411668103 /nfs/dbraw/zinc/66/81/03/411668103.db2.gz NYZDIVYNONSJFR-UHFFFAOYSA-N 1 2 243.310 2.044 20 0 BEADLO O=C(CCC(F)F)Nc1ccn2cc[nH+]c2c1 ZINC000660961763 411686673 /nfs/dbraw/zinc/68/66/73/411686673.db2.gz FJUYGDWMDMNPQY-UHFFFAOYSA-N 1 2 239.225 2.318 20 0 BEADLO CC(C)c1noc([C@H](C)N(C)Cc2c[nH+]c[nH]2)n1 ZINC000661086839 411698728 /nfs/dbraw/zinc/69/87/28/411698728.db2.gz JNVSYOINKSQTQV-VIFPVBQESA-N 1 2 249.318 2.109 20 0 BEADLO CC(C)c1noc([C@H](C)N(C)Cc2c[nH]c[nH+]2)n1 ZINC000661086839 411698730 /nfs/dbraw/zinc/69/87/30/411698730.db2.gz JNVSYOINKSQTQV-VIFPVBQESA-N 1 2 249.318 2.109 20 0 BEADLO CC(C)(C)CC[N@@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000661396357 411767231 /nfs/dbraw/zinc/76/72/31/411767231.db2.gz ADHXKLLEYZWNJX-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)(C)CC[N@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000661396357 411767234 /nfs/dbraw/zinc/76/72/34/411767234.db2.gz ADHXKLLEYZWNJX-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)=CCC[N@@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000661413072 411770967 /nfs/dbraw/zinc/77/09/67/411770967.db2.gz LJUOJHMFGFXTEI-SNVBAGLBSA-N 1 2 219.275 2.045 20 0 BEADLO CC(C)=CCC[N@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000661413072 411770969 /nfs/dbraw/zinc/77/09/69/411770969.db2.gz LJUOJHMFGFXTEI-SNVBAGLBSA-N 1 2 219.275 2.045 20 0 BEADLO Cc1nc2[nH]ccc2c(N2C[C@H](C)[C@H]2C)[nH+]1 ZINC000663947946 411787319 /nfs/dbraw/zinc/78/73/19/411787319.db2.gz SJRUYGIKUOAGMG-JGVFFNPUSA-N 1 2 216.288 2.111 20 0 BEADLO C[C@]1(C2CC2)C[N@H+](Cc2cncs2)CCO1 ZINC000661170869 411728303 /nfs/dbraw/zinc/72/83/03/411728303.db2.gz JICYFIJGKFDZFG-GFCCVEGCSA-N 1 2 238.356 2.144 20 0 BEADLO C[C@]1(C2CC2)C[N@@H+](Cc2cncs2)CCO1 ZINC000661170869 411728305 /nfs/dbraw/zinc/72/83/05/411728305.db2.gz JICYFIJGKFDZFG-GFCCVEGCSA-N 1 2 238.356 2.144 20 0 BEADLO Cc1nnc(C[N@@H+](C)[C@@H]2C[C@@H]2c2ccccc2)o1 ZINC000661528797 411795603 /nfs/dbraw/zinc/79/56/03/411795603.db2.gz LWKDRBPDCOXGQX-CHWSQXEVSA-N 1 2 243.310 2.366 20 0 BEADLO Cc1nnc(C[N@H+](C)[C@@H]2C[C@@H]2c2ccccc2)o1 ZINC000661528797 411795606 /nfs/dbraw/zinc/79/56/06/411795606.db2.gz LWKDRBPDCOXGQX-CHWSQXEVSA-N 1 2 243.310 2.366 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)Nc1ccc(C)nn1 ZINC000663972898 411796654 /nfs/dbraw/zinc/79/66/54/411796654.db2.gz BBQZQIKMEIBRPM-JTQLQIEISA-N 1 2 231.303 2.175 20 0 BEADLO Cc1cccc([C@H](C)[N@H+](C)Cc2cn(C)nn2)c1 ZINC000661746931 411865134 /nfs/dbraw/zinc/86/51/34/411865134.db2.gz KWQPKUKQIFBHMH-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cccc([C@H](C)[N@@H+](C)Cc2cn(C)nn2)c1 ZINC000661746931 411865139 /nfs/dbraw/zinc/86/51/39/411865139.db2.gz KWQPKUKQIFBHMH-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cc(COc2cc[nH+]cc2)nc(C)n1 ZINC000664017473 411816001 /nfs/dbraw/zinc/81/60/01/411816001.db2.gz YRBMOPKQSXNVHT-UHFFFAOYSA-N 1 2 215.256 2.067 20 0 BEADLO CCc1[nH+]c(C)ccc1OCc1ncnn1CC ZINC000664021372 411816411 /nfs/dbraw/zinc/81/64/11/411816411.db2.gz XVPUMTXAOXAZFP-UHFFFAOYSA-N 1 2 246.314 2.143 20 0 BEADLO Cc1[nH+]c2cc(OCC3(C)COC3)ccc2n1C ZINC000664046751 411827063 /nfs/dbraw/zinc/82/70/63/411827063.db2.gz OMWMGZACQXAUDW-UHFFFAOYSA-N 1 2 246.310 2.297 20 0 BEADLO CC(C)n1ccnc1C[N@H+](C)CC1=CCCOC1 ZINC000661656845 411829839 /nfs/dbraw/zinc/82/98/39/411829839.db2.gz WLHJYXJSPLMCFT-UHFFFAOYSA-N 1 2 249.358 2.243 20 0 BEADLO CC(C)n1ccnc1C[N@@H+](C)CC1=CCCOC1 ZINC000661656845 411829845 /nfs/dbraw/zinc/82/98/45/411829845.db2.gz WLHJYXJSPLMCFT-UHFFFAOYSA-N 1 2 249.358 2.243 20 0 BEADLO COCCC1CN(c2cc(C)[nH+]c(C3CC3)n2)C1 ZINC000664193385 411886234 /nfs/dbraw/zinc/88/62/34/411886234.db2.gz LIXMZYSZHOZBFI-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO Cc1cc(N[C@H](C)c2cscn2)nc[nH+]1 ZINC000664260385 411903069 /nfs/dbraw/zinc/90/30/69/411903069.db2.gz JDYBBGYJUIXWFB-MRVPVSSYSA-N 1 2 220.301 2.415 20 0 BEADLO Cc1cc(NCCc2ccoc2)nc[nH+]1 ZINC000664379987 411935172 /nfs/dbraw/zinc/93/51/72/411935172.db2.gz LMHQDMDEHBNRMP-UHFFFAOYSA-N 1 2 203.245 2.033 20 0 BEADLO C[C@@]1(C2CC2)CN(c2cccc[nH+]2)CCO1 ZINC000664176018 411881757 /nfs/dbraw/zinc/88/17/57/411881757.db2.gz DLRRFUHOQRFKDK-ZDUSSCGKSA-N 1 2 218.300 2.087 20 0 BEADLO Cc1nc(N2CC3(CCCC3)OC[C@@H]2C)cc[nH+]1 ZINC000664532975 411980375 /nfs/dbraw/zinc/98/03/75/411980375.db2.gz WEEABSZLOCGSFO-NSHDSACASA-N 1 2 247.342 2.323 20 0 BEADLO Cc1cc(NCCCc2ccco2)nc[nH+]1 ZINC000664584987 411991475 /nfs/dbraw/zinc/99/14/75/411991475.db2.gz XAOCSAXFEBKWNZ-UHFFFAOYSA-N 1 2 217.272 2.423 20 0 BEADLO C[C@H]1CN(c2[nH]c3ccccc3[nH+]2)C[C@]1(C)CO ZINC000664597402 411993827 /nfs/dbraw/zinc/99/38/27/411993827.db2.gz ZZPBWYAKNQFMSF-IINYFYTJSA-N 1 2 245.326 2.018 20 0 BEADLO Fc1ccccc1C[N@@H+]1CCc2nccnc2C1 ZINC000662125793 411994055 /nfs/dbraw/zinc/99/40/55/411994055.db2.gz SKQJBCRDISJYLR-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1ccccc1C[N@H+]1CCc2nccnc2C1 ZINC000662125793 411994057 /nfs/dbraw/zinc/99/40/57/411994057.db2.gz SKQJBCRDISJYLR-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1cccc(C[N@@H+]2CCc3nccnc3C2)c1 ZINC000662126976 411995193 /nfs/dbraw/zinc/99/51/93/411995193.db2.gz PNCQVPAUPUTOAB-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1cccc(C[N@H+]2CCc3nccnc3C2)c1 ZINC000662126976 411995196 /nfs/dbraw/zinc/99/51/96/411995196.db2.gz PNCQVPAUPUTOAB-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO CC1(C)OCC[C@H]1CNc1cccc[nH+]1 ZINC000664602122 411995581 /nfs/dbraw/zinc/99/55/81/411995581.db2.gz BONQUNPPUWDURM-JTQLQIEISA-N 1 2 206.289 2.309 20 0 BEADLO CO[C@@]1(C)C[C@H]1Nc1nc(C)[nH+]c2c1CCCC2 ZINC000664605011 411996847 /nfs/dbraw/zinc/99/68/47/411996847.db2.gz MRQHXWULCGTJAB-OCCSQVGLSA-N 1 2 247.342 2.253 20 0 BEADLO Cc1nc(NC[C@@H]2CCOC2(C)C)cc[nH+]1 ZINC000664606754 411998943 /nfs/dbraw/zinc/99/89/43/411998943.db2.gz ZSCRKZKUKFGKIK-JTQLQIEISA-N 1 2 221.304 2.012 20 0 BEADLO CC[C@@H]([NH2+]Cc1ncn(C)n1)c1ccc(F)cc1 ZINC000134212881 170905394 /nfs/dbraw/zinc/90/53/94/170905394.db2.gz WIHZWCMWQUHUDB-GFCCVEGCSA-N 1 2 248.305 2.195 20 0 BEADLO Cc1cc(N(C)C[C@H]2CC2(C)C)nc[nH+]1 ZINC000664670235 412000512 /nfs/dbraw/zinc/00/05/12/412000512.db2.gz MXFSYTAGDFHPOE-SNVBAGLBSA-N 1 2 205.305 2.267 20 0 BEADLO CC12CC(C1)CN2c1cc(NCC2CC2)[nH+]cn1 ZINC000664692714 412010244 /nfs/dbraw/zinc/01/02/44/412010244.db2.gz BCTYGNUFXWEPCH-UHFFFAOYSA-N 1 2 244.342 2.287 20 0 BEADLO CC12CC(C1)CN2c1cc(NCC2CC2)nc[nH+]1 ZINC000664692714 412010248 /nfs/dbraw/zinc/01/02/48/412010248.db2.gz BCTYGNUFXWEPCH-UHFFFAOYSA-N 1 2 244.342 2.287 20 0 BEADLO CC12CC(C1)CN2c1nc(N)c2ccccc2[nH+]1 ZINC000664694568 412012214 /nfs/dbraw/zinc/01/22/14/412012214.db2.gz UGJWKQXZCANIGU-UHFFFAOYSA-N 1 2 240.310 2.201 20 0 BEADLO CCc1cc(NC[C@]2(C)CC2(F)F)nc[nH+]1 ZINC000664400775 411944350 /nfs/dbraw/zinc/94/43/50/411944350.db2.gz OFGLEHZNBIPXQM-JTQLQIEISA-N 1 2 227.258 2.496 20 0 BEADLO C[C@H]1CCC(C)(C)N1C(=O)CCn1cc[nH+]c1 ZINC000662032744 411950517 /nfs/dbraw/zinc/95/05/17/411950517.db2.gz KNLNAOADEVVWHX-NSHDSACASA-N 1 2 235.331 2.063 20 0 BEADLO CCC(CC)CCC[N@H+](C)Cc1cnn[nH]1 ZINC000662039500 411954751 /nfs/dbraw/zinc/95/47/51/411954751.db2.gz WGVBEMDVBMCHSW-UHFFFAOYSA-N 1 2 224.352 2.453 20 0 BEADLO CCC(CC)CCC[N@@H+](C)Cc1cnn[nH]1 ZINC000662039500 411954756 /nfs/dbraw/zinc/95/47/56/411954756.db2.gz WGVBEMDVBMCHSW-UHFFFAOYSA-N 1 2 224.352 2.453 20 0 BEADLO CCC(CC)CCC[N@H+](C)Cc1c[nH]nn1 ZINC000662039500 411954760 /nfs/dbraw/zinc/95/47/60/411954760.db2.gz WGVBEMDVBMCHSW-UHFFFAOYSA-N 1 2 224.352 2.453 20 0 BEADLO CCC(CC)CCC[N@@H+](C)Cc1c[nH]nn1 ZINC000662039500 411954764 /nfs/dbraw/zinc/95/47/64/411954764.db2.gz WGVBEMDVBMCHSW-UHFFFAOYSA-N 1 2 224.352 2.453 20 0 BEADLO CCC(CC)CCC[N@H+](C)Cc1cn[nH]n1 ZINC000662039500 411954766 /nfs/dbraw/zinc/95/47/66/411954766.db2.gz WGVBEMDVBMCHSW-UHFFFAOYSA-N 1 2 224.352 2.453 20 0 BEADLO CCC(CC)CCC[N@@H+](C)Cc1cn[nH]n1 ZINC000662039500 411954772 /nfs/dbraw/zinc/95/47/72/411954772.db2.gz WGVBEMDVBMCHSW-UHFFFAOYSA-N 1 2 224.352 2.453 20 0 BEADLO Cc1nc([C@H](C)[NH+]2CCC3(CCC3)CC2)n[nH]1 ZINC000664445613 411959957 /nfs/dbraw/zinc/95/99/57/411959957.db2.gz NYIDGKHHSGDNKB-JTQLQIEISA-N 1 2 234.347 2.440 20 0 BEADLO Cc1nnc(C[N@@H+](C)[C@@H]2C=CCCC2)s1 ZINC000662261079 412054912 /nfs/dbraw/zinc/05/49/12/412054912.db2.gz SKIHPVCGYSHFBW-SNVBAGLBSA-N 1 2 223.345 2.387 20 0 BEADLO Cc1nnc(C[N@H+](C)[C@@H]2C=CCCC2)s1 ZINC000662261079 412054913 /nfs/dbraw/zinc/05/49/13/412054913.db2.gz SKIHPVCGYSHFBW-SNVBAGLBSA-N 1 2 223.345 2.387 20 0 BEADLO Cc1cc[nH+]cc1Cc1noc([C@@H]2C[C@@H]2C)n1 ZINC000664981577 412055369 /nfs/dbraw/zinc/05/53/69/412055369.db2.gz XJARBDXFRTZYAH-GXSJLCMTSA-N 1 2 229.283 2.487 20 0 BEADLO CO[C@H](C)c1nc(Cc2c[nH+]ccc2C)no1 ZINC000664980210 412055941 /nfs/dbraw/zinc/05/59/41/412055941.db2.gz FOHNQPQNLFYTLP-SECBINFHSA-N 1 2 233.271 2.071 20 0 BEADLO Cc1cc(C[N@H+](C)CC2=CCSC2)no1 ZINC000662265426 412056778 /nfs/dbraw/zinc/05/67/78/412056778.db2.gz ADNWLBKZXKBUAV-UHFFFAOYSA-N 1 2 224.329 2.088 20 0 BEADLO Cc1cc(C[N@@H+](C)CC2=CCSC2)no1 ZINC000662265426 412056781 /nfs/dbraw/zinc/05/67/81/412056781.db2.gz ADNWLBKZXKBUAV-UHFFFAOYSA-N 1 2 224.329 2.088 20 0 BEADLO CC[C@@H]1CC[N@@H+]([C@H](C(=O)OC)c2cccnc2)C1 ZINC000156770975 171014131 /nfs/dbraw/zinc/01/41/31/171014131.db2.gz MLVYJQSPTYQPRT-YPMHNXCESA-N 1 2 248.326 2.028 20 0 BEADLO CC[C@@H]1CC[N@H+]([C@H](C(=O)OC)c2cccnc2)C1 ZINC000156770975 171014135 /nfs/dbraw/zinc/01/41/35/171014135.db2.gz MLVYJQSPTYQPRT-YPMHNXCESA-N 1 2 248.326 2.028 20 0 BEADLO CC[C@@H]1CCN1C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000333157700 171017760 /nfs/dbraw/zinc/01/77/60/171017760.db2.gz GRNQWLSLCTUSME-HBNTYKKESA-N 1 2 248.330 2.083 20 0 BEADLO CC[C@H]1CC[C@H](C(=O)NCc2[nH]cc[nH+]2)CC1 ZINC000275701453 171030248 /nfs/dbraw/zinc/03/02/48/171030248.db2.gz JNXPCBVHIGFEGS-XYPYZODXSA-N 1 2 235.331 2.242 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1c1nc[nH+]c(N)c1Cl ZINC000233935607 171038112 /nfs/dbraw/zinc/03/81/12/171038112.db2.gz RMFLBDXBXMQVEK-HTQZYQBOSA-N 1 2 240.738 2.480 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1C(=O)CCc1c[nH+]cn1C ZINC000281283315 171051224 /nfs/dbraw/zinc/05/12/24/171051224.db2.gz SEAURSCXSRDNSU-NWDGAFQWSA-N 1 2 249.358 2.142 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccc(COC)o2)CCO1 ZINC000271049292 171088808 /nfs/dbraw/zinc/08/88/08/171088808.db2.gz UGSRDCPLAHXLEV-LLVKDONJSA-N 1 2 239.315 2.037 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccc(COC)o2)CCO1 ZINC000271049292 171088812 /nfs/dbraw/zinc/08/88/12/171088812.db2.gz UGSRDCPLAHXLEV-LLVKDONJSA-N 1 2 239.315 2.037 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cscn2)CCCO1 ZINC000281404444 171091631 /nfs/dbraw/zinc/09/16/31/171091631.db2.gz XRGFCPPHUNDZHB-LLVKDONJSA-N 1 2 226.345 2.144 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cscn2)CCCO1 ZINC000281404444 171091634 /nfs/dbraw/zinc/09/16/34/171091634.db2.gz XRGFCPPHUNDZHB-LLVKDONJSA-N 1 2 226.345 2.144 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nc(C)cs2)C[C@@H](C)O1 ZINC000268020111 171092280 /nfs/dbraw/zinc/09/22/80/171092280.db2.gz JBMJCKSIGNMADT-GHMZBOCLSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nc(C)cs2)C[C@@H](C)O1 ZINC000268020111 171092284 /nfs/dbraw/zinc/09/22/84/171092284.db2.gz JBMJCKSIGNMADT-GHMZBOCLSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nc(C)c(C)o2)C[C@H](C)O1 ZINC000111274169 171092574 /nfs/dbraw/zinc/09/25/74/171092574.db2.gz IDMCTOJZUMSNSW-JOYOIKCWSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nc(C)c(C)o2)C[C@H](C)O1 ZINC000111274169 171092578 /nfs/dbraw/zinc/09/25/78/171092578.db2.gz IDMCTOJZUMSNSW-JOYOIKCWSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@@H]1CN(c2[nH+]c3ccccc3n2C)CCO1 ZINC000270557785 171098268 /nfs/dbraw/zinc/09/82/68/171098268.db2.gz IJYYVMBVGCRDPH-LLVKDONJSA-N 1 2 245.326 2.189 20 0 BEADLO CC[C@@H]1COCCN1C(=O)Nc1cc[nH+]cc1C ZINC000121245088 171104324 /nfs/dbraw/zinc/10/43/24/171104324.db2.gz FIHBDADZHLPRLO-LLVKDONJSA-N 1 2 249.314 2.033 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1cncs1 ZINC000270988334 171113408 /nfs/dbraw/zinc/11/34/08/171113408.db2.gz GSEJNWGLYDQRDE-NXEZZACHSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1cncs1 ZINC000270988334 171113410 /nfs/dbraw/zinc/11/34/10/171113410.db2.gz GSEJNWGLYDQRDE-NXEZZACHSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1nccs1 ZINC000269676386 171113521 /nfs/dbraw/zinc/11/35/21/171113521.db2.gz SKGUBCCQGILTEI-NXEZZACHSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1nccs1 ZINC000269676386 171113524 /nfs/dbraw/zinc/11/35/24/171113524.db2.gz SKGUBCCQGILTEI-NXEZZACHSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1csc(C)n1 ZINC000268813628 171114110 /nfs/dbraw/zinc/11/41/10/171114110.db2.gz HEWOZQBXETWWRZ-BXKDBHETSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1csc(C)n1 ZINC000268813628 171114113 /nfs/dbraw/zinc/11/41/13/171114113.db2.gz HEWOZQBXETWWRZ-BXKDBHETSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[C@H](C)CN1C(=O)Nc1cc[nH+]cc1C ZINC000336527716 171126639 /nfs/dbraw/zinc/12/66/39/171126639.db2.gz SRAQJXOIMKWJGD-CMPLNLGQSA-N 1 2 247.342 2.464 20 0 BEADLO CC[C@@H]1C[C@H](C[N@H+](C)CC(F)F)CCO1 ZINC000356985981 171128483 /nfs/dbraw/zinc/12/84/83/171128483.db2.gz IRRDHRSQYBCHBU-NXEZZACHSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@@H]1C[C@H](C[N@@H+](C)CC(F)F)CCO1 ZINC000356985981 171128485 /nfs/dbraw/zinc/12/84/85/171128485.db2.gz IRRDHRSQYBCHBU-NXEZZACHSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@@H]1C[C@H]1NC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000290595675 171138250 /nfs/dbraw/zinc/13/82/50/171138250.db2.gz GTXALHINILIOFM-MWLCHTKSSA-N 1 2 244.298 2.254 20 0 BEADLO CC[C@@](C)([NH2+]CCc1ccccc1)C(=O)OC ZINC000265410132 171175545 /nfs/dbraw/zinc/17/55/45/171175545.db2.gz DPKVIACLJARJMA-CQSZACIVSA-N 1 2 235.327 2.160 20 0 BEADLO CC[C@H](C(=O)NCc1[nH]cc[nH+]1)c1ccccc1 ZINC000070990481 171231213 /nfs/dbraw/zinc/23/12/13/171231213.db2.gz VRFMLORTYFOFDX-LBPRGKRZSA-N 1 2 243.310 2.220 20 0 BEADLO CC[C@H](C)C(=O)NC[C@H]1CCCn2cc(C)[nH+]c21 ZINC000337289429 171251790 /nfs/dbraw/zinc/25/17/90/171251790.db2.gz BUCVUBBEFPKTEI-CMPLNLGQSA-N 1 2 249.358 2.231 20 0 BEADLO CC[C@H](C)N(CCO)c1cc[nH+]c(C(C)C)n1 ZINC000340927375 171315386 /nfs/dbraw/zinc/31/53/86/171315386.db2.gz XQAQIHZQRZKBHB-NSHDSACASA-N 1 2 237.347 2.197 20 0 BEADLO CC[C@H](C)N(OC)C(=O)c1ccc2[nH+]ccn2c1 ZINC000270880497 171317054 /nfs/dbraw/zinc/31/70/54/171317054.db2.gz OSLITUYHOPYIJZ-JTQLQIEISA-N 1 2 247.298 2.136 20 0 BEADLO CCc1cn(Cc2ccc(CC)cn2)c[nH+]1 ZINC001652205433 1173044476 /nfs/dbraw/zinc/04/44/76/1173044476.db2.gz FTBZQURDPYXKCB-UHFFFAOYSA-N 1 2 215.300 2.451 20 0 BEADLO CC[C@H](C)NC(=O)C[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000361072926 171326777 /nfs/dbraw/zinc/32/67/77/171326777.db2.gz HWTBRJPINPYEKX-RYUDHWBXSA-N 1 2 246.354 2.478 20 0 BEADLO CC[C@H](C)NC(=O)C[N@H+]1Cc2ccccc2[C@@H]1C ZINC000361072926 171326779 /nfs/dbraw/zinc/32/67/79/171326779.db2.gz HWTBRJPINPYEKX-RYUDHWBXSA-N 1 2 246.354 2.478 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000330940862 171361580 /nfs/dbraw/zinc/36/15/80/171361580.db2.gz CQEORQFWNAJBSE-VHSXEESVSA-N 1 2 237.347 2.238 20 0 BEADLO CC[C@H](C)[C@H]([NH2+]CCC(F)(F)F)C(=O)OC ZINC000309444161 171398959 /nfs/dbraw/zinc/39/89/59/171398959.db2.gz JHBKWAXCDJIZGX-YUMQZZPRSA-N 1 2 241.253 2.116 20 0 BEADLO CC[C@H](C)[C@H]([NH2+]Cc1ccsc1)C(=O)OC ZINC000037102725 171399787 /nfs/dbraw/zinc/39/97/87/171399787.db2.gz ILVDZUSDPCWOLX-ONGXEEELSA-N 1 2 241.356 2.425 20 0 BEADLO Cc1cc(-c2[nH+]ccn2C)cc(C)c1N ZINC000665181250 412120732 /nfs/dbraw/zinc/12/07/32/412120732.db2.gz MSIUQYUUWSAQLW-UHFFFAOYSA-N 1 2 201.273 2.286 20 0 BEADLO CC[C@H]([NH2+]CCCc1ccccc1)C(=O)OC ZINC000083362419 171520324 /nfs/dbraw/zinc/52/03/24/171520324.db2.gz PJPVJUDNVHFBRJ-ZDUSSCGKSA-N 1 2 235.327 2.160 20 0 BEADLO COCCCOc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000665217544 412154810 /nfs/dbraw/zinc/15/48/10/412154810.db2.gz NARPLYFTNGMNRX-UHFFFAOYSA-N 1 2 232.283 2.492 20 0 BEADLO CC[C@H]1CN(c2cc[nH+]c(C3CC3)n2)CCCO1 ZINC000341406812 171666469 /nfs/dbraw/zinc/66/64/69/171666469.db2.gz LGBHETJTLUDVAF-LBPRGKRZSA-N 1 2 247.342 2.359 20 0 BEADLO CCc1cn(CC(=O)[C@H]2Cc3ccccc32)c[nH+]1 ZINC001652206621 1173045643 /nfs/dbraw/zinc/04/56/43/1173045643.db2.gz ZKLJVFMQYSBCCI-AWEZNQCLSA-N 1 2 240.306 2.355 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@H](C)[C@@H]2C)o1 ZINC000093418141 171799503 /nfs/dbraw/zinc/79/95/03/171799503.db2.gz RCIYZWGFPWZQQP-WDEREUQCSA-N 1 2 223.316 2.451 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@H](C)[C@@H]2C)o1 ZINC000093418141 171799504 /nfs/dbraw/zinc/79/95/04/171799504.db2.gz RCIYZWGFPWZQQP-WDEREUQCSA-N 1 2 223.316 2.451 20 0 BEADLO CCc1nnc([C@@H](C)[NH2+]Cc2occc2C)[nH]1 ZINC000270627562 172002542 /nfs/dbraw/zinc/00/25/42/172002542.db2.gz DWEPQEXAKTUCRG-SECBINFHSA-N 1 2 234.303 2.119 20 0 BEADLO CCc1nc([C@H](C)[NH2+]Cc2cc[nH]n2)cs1 ZINC000111407172 172006104 /nfs/dbraw/zinc/00/61/04/172006104.db2.gz RRUXEUFLYFAVPV-QMMMGPOBSA-N 1 2 236.344 2.279 20 0 BEADLO CCc1[nH+]c2ccccc2n1C[C@H](O)CC ZINC000062807771 172014212 /nfs/dbraw/zinc/01/42/12/172014212.db2.gz MTOPYAGDFIIZDD-SNVBAGLBSA-N 1 2 218.300 2.370 20 0 BEADLO CCc1nnc(C[N@@H+]2CCCc3occc3C2)o1 ZINC000288829822 172051207 /nfs/dbraw/zinc/05/12/07/172051207.db2.gz NTTZCNNLUOIQLK-UHFFFAOYSA-N 1 2 247.298 2.173 20 0 BEADLO CCc1nnc(C[N@H+]2CCCc3occc3C2)o1 ZINC000288829822 172051210 /nfs/dbraw/zinc/05/12/10/172051210.db2.gz NTTZCNNLUOIQLK-UHFFFAOYSA-N 1 2 247.298 2.173 20 0 BEADLO CCc1nnc(C[NH2+]Cc2ccccc2)s1 ZINC000289962662 172051452 /nfs/dbraw/zinc/05/14/52/172051452.db2.gz YJIBBHVHDWAGJB-UHFFFAOYSA-N 1 2 233.340 2.390 20 0 BEADLO CCc1noc([C@H](C)[N@@H+]2CCC=C(C)C2)n1 ZINC000280962044 172090312 /nfs/dbraw/zinc/09/03/12/172090312.db2.gz ZCOYZEXCODDKQM-JTQLQIEISA-N 1 2 221.304 2.345 20 0 BEADLO CCc1noc([C@H](C)[N@H+]2CCC=C(C)C2)n1 ZINC000280962044 172090314 /nfs/dbraw/zinc/09/03/14/172090314.db2.gz ZCOYZEXCODDKQM-JTQLQIEISA-N 1 2 221.304 2.345 20 0 BEADLO CCc1noc([C@H](C)[N@H+]2CC=C(C)CC2)n1 ZINC000270340974 172090361 /nfs/dbraw/zinc/09/03/61/172090361.db2.gz NRRXXBKKASKQGX-JTQLQIEISA-N 1 2 221.304 2.345 20 0 BEADLO CCc1noc([C@H](C)[N@@H+]2CC=C(C)CC2)n1 ZINC000270340974 172090364 /nfs/dbraw/zinc/09/03/64/172090364.db2.gz NRRXXBKKASKQGX-JTQLQIEISA-N 1 2 221.304 2.345 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1ccc(F)cn1 ZINC000293474225 172095949 /nfs/dbraw/zinc/09/59/49/172095949.db2.gz RIRAUCZQFUWYHY-UHFFFAOYSA-N 1 2 249.289 2.403 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1ccc(F)cn1 ZINC000293474225 172095953 /nfs/dbraw/zinc/09/59/53/172095953.db2.gz RIRAUCZQFUWYHY-UHFFFAOYSA-N 1 2 249.289 2.403 20 0 BEADLO CCc1nocc1C[N@H+](C)[C@@H](C)c1cnccn1 ZINC000293386532 172096514 /nfs/dbraw/zinc/09/65/14/172096514.db2.gz KHPLDEYORNLFAD-JTQLQIEISA-N 1 2 246.314 2.220 20 0 BEADLO CCc1nocc1C[N@@H+](C)[C@@H](C)c1cnccn1 ZINC000293386532 172096515 /nfs/dbraw/zinc/09/65/15/172096515.db2.gz KHPLDEYORNLFAD-JTQLQIEISA-N 1 2 246.314 2.220 20 0 BEADLO CCc1nocc1C[N@@H+]1CCO[C@](C)(CC)C1 ZINC000353120640 172098490 /nfs/dbraw/zinc/09/84/90/172098490.db2.gz QWSXCBXTOLKOGF-CYBMUJFWSA-N 1 2 238.331 2.238 20 0 BEADLO CCc1nocc1C[N@H+]1CCO[C@](C)(CC)C1 ZINC000353120640 172098491 /nfs/dbraw/zinc/09/84/91/172098491.db2.gz QWSXCBXTOLKOGF-CYBMUJFWSA-N 1 2 238.331 2.238 20 0 BEADLO CCc1sc(C(=O)NCc2[nH]cc[nH+]2)cc1C ZINC000070990201 172127994 /nfs/dbraw/zinc/12/79/94/172127994.db2.gz ISNXZXFKOMNAOL-UHFFFAOYSA-N 1 2 249.339 2.272 20 0 BEADLO CCn1cc(CC[N@@H+]2CCC=C(F)C2)cn1 ZINC000284964882 172158531 /nfs/dbraw/zinc/15/85/31/172158531.db2.gz JSLBTKLUPGLGCC-UHFFFAOYSA-N 1 2 223.295 2.005 20 0 BEADLO CCn1cc(CC[N@H+]2CCC=C(F)C2)cn1 ZINC000284964882 172158533 /nfs/dbraw/zinc/15/85/33/172158533.db2.gz JSLBTKLUPGLGCC-UHFFFAOYSA-N 1 2 223.295 2.005 20 0 BEADLO CCn1cc(N[C@H](c2[nH+]ccn2C)C2CC2)cn1 ZINC000128789563 172188179 /nfs/dbraw/zinc/18/81/79/172188179.db2.gz YAYRVVULVUFJKA-LBPRGKRZSA-N 1 2 245.330 2.200 20 0 BEADLO CCn1cc([C@H](C)[NH2+]Cc2nccs2)cn1 ZINC000044500265 172197000 /nfs/dbraw/zinc/19/70/00/172197000.db2.gz CJZOOHAMSRYSKA-VIFPVBQESA-N 1 2 236.344 2.210 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@@H](C)CC(C)C ZINC000295711266 172222261 /nfs/dbraw/zinc/22/22/61/172222261.db2.gz JUWNVEBGTBLKHL-NSHDSACASA-N 1 2 237.347 2.201 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)/C=C/C(C)(C)C ZINC000297276917 172222655 /nfs/dbraw/zinc/22/26/55/172222655.db2.gz SKOXANLWTOVJQE-VOTSOKGWSA-N 1 2 235.331 2.122 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C[C@H]1CCC[C@H]1C ZINC000295592394 172222759 /nfs/dbraw/zinc/22/27/59/172222759.db2.gz HUGHSCIQNCUSIG-VXGBXAGGSA-N 1 2 249.358 2.346 20 0 BEADLO CCn1cc[nH+]c1CNc1ccc(C(C)=O)cn1 ZINC000295037183 172224502 /nfs/dbraw/zinc/22/45/02/172224502.db2.gz SJUZEXSFJOMDRF-UHFFFAOYSA-N 1 2 244.298 2.113 20 0 BEADLO CCn1ccnc1C[NH2+][C@@H](C)c1ccncc1F ZINC000337944368 172224679 /nfs/dbraw/zinc/22/46/79/172224679.db2.gz GYZOFVXFTFCQMM-JTQLQIEISA-N 1 2 248.305 2.288 20 0 BEADLO CCn1cnnc1C[NH2+][C@@H]1CCCc2occc21 ZINC000219257163 172236119 /nfs/dbraw/zinc/23/61/19/172236119.db2.gz LZVYHVDCRGKRBY-LLVKDONJSA-N 1 2 246.314 2.058 20 0 BEADLO CCn1cnnc1C[NH2+][C@@H](C)c1cccc(F)c1 ZINC000158467073 172236649 /nfs/dbraw/zinc/23/66/49/172236649.db2.gz BIOZBVJVOICRIO-JTQLQIEISA-N 1 2 248.305 2.288 20 0 BEADLO CCn1nc(C(F)(F)F)c2c[nH+]ccc21 ZINC000128428099 172242017 /nfs/dbraw/zinc/24/20/17/172242017.db2.gz NPOBSFYZJQEZEI-UHFFFAOYSA-N 1 2 215.178 2.470 20 0 BEADLO CCn1nccc1CC[N@H+](CC(F)F)C(C)C ZINC000284336957 172260680 /nfs/dbraw/zinc/26/06/80/172260680.db2.gz JBQCUHVWOPZXMV-UHFFFAOYSA-N 1 2 245.317 2.421 20 0 BEADLO CCn1nccc1CC[N@@H+](CC(F)F)C(C)C ZINC000284336957 172260682 /nfs/dbraw/zinc/26/06/82/172260682.db2.gz JBQCUHVWOPZXMV-UHFFFAOYSA-N 1 2 245.317 2.421 20 0 BEADLO CCn1nccc1C[N@H+](C)Cc1cncc(C)c1 ZINC000352341244 172263214 /nfs/dbraw/zinc/26/32/14/172263214.db2.gz GOGUXXNCTASMRQ-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1nccc1C[N@@H+](C)Cc1cncc(C)c1 ZINC000352341244 172263218 /nfs/dbraw/zinc/26/32/18/172263218.db2.gz GOGUXXNCTASMRQ-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1nccc1C[N@H+](C)[C@H](C)c1ccccn1 ZINC000183677858 172264916 /nfs/dbraw/zinc/26/49/16/172264916.db2.gz FAOQRTJRFGARRG-GFCCVEGCSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1nccc1C[N@@H+](C)[C@H](C)c1ccccn1 ZINC000183677858 172264917 /nfs/dbraw/zinc/26/49/17/172264917.db2.gz FAOQRTJRFGARRG-GFCCVEGCSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1nccc1CNc1ccc[nH+]c1C ZINC000119822034 172274503 /nfs/dbraw/zinc/27/45/03/172274503.db2.gz BOTJNYZUKUJZPK-UHFFFAOYSA-N 1 2 216.288 2.219 20 0 BEADLO CCn1nncc1C[N@@H+]1Cc2ccc(C)cc2C1 ZINC000334542622 172292539 /nfs/dbraw/zinc/29/25/39/172292539.db2.gz XJINNNHZRBNUNI-UHFFFAOYSA-N 1 2 242.326 2.122 20 0 BEADLO CCn1nncc1C[N@H+]1Cc2ccc(C)cc2C1 ZINC000334542622 172292541 /nfs/dbraw/zinc/29/25/41/172292541.db2.gz XJINNNHZRBNUNI-UHFFFAOYSA-N 1 2 242.326 2.122 20 0 BEADLO CN(C)c1ccc(-c2ccc(N)[nH+]c2)cc1 ZINC000052886375 172547964 /nfs/dbraw/zinc/54/79/64/172547964.db2.gz GQQZKJLMUQSQFK-UHFFFAOYSA-N 1 2 213.284 2.397 20 0 BEADLO CN(CCCCO)c1ccc2ccccc2[nH+]1 ZINC000350686487 172701686 /nfs/dbraw/zinc/70/16/86/172701686.db2.gz WMAKOSOVDOBRRJ-UHFFFAOYSA-N 1 2 230.311 2.444 20 0 BEADLO C[NH2+]Cc1noc(C2(C)CCCCC2)n1 ZINC000234449273 173399845 /nfs/dbraw/zinc/39/98/45/173399845.db2.gz JFEUIIODZGWDLX-UHFFFAOYSA-N 1 2 209.293 2.011 20 0 BEADLO COC1CC[NH+](Cc2cnc(Cl)s2)CC1 ZINC000086776464 174030369 /nfs/dbraw/zinc/03/03/69/174030369.db2.gz BNCSWLIYAXQXSC-UHFFFAOYSA-N 1 2 246.763 2.407 20 0 BEADLO COC1CCN(c2[nH]c3ccccc3[nH+]2)CC1 ZINC000287600313 174031697 /nfs/dbraw/zinc/03/16/97/174031697.db2.gz AARAVEKAOXNOAI-UHFFFAOYSA-N 1 2 231.299 2.178 20 0 BEADLO COC1C[NH+](Cc2ccccc2Cl)C1 ZINC000357909807 174035274 /nfs/dbraw/zinc/03/52/74/174035274.db2.gz JYSLZYZGISCNFK-UHFFFAOYSA-N 1 2 211.692 2.171 20 0 BEADLO COCC(C)(C)CNc1c[nH+]cc(C)c1 ZINC000308945550 174076430 /nfs/dbraw/zinc/07/64/30/174076430.db2.gz NQCZEEBSXUOUHM-UHFFFAOYSA-N 1 2 208.305 2.475 20 0 BEADLO COCC1(CNc2cc[nH+]c(C(C)C)n2)CCC1 ZINC000336948742 174100765 /nfs/dbraw/zinc/10/07/65/174100765.db2.gz OKNZRKBEAGZDPR-UHFFFAOYSA-N 1 2 249.358 2.251 20 0 BEADLO COCCC1(C(=O)Nc2cc[nH+]c(C)c2)CC1 ZINC000162112904 174151981 /nfs/dbraw/zinc/15/19/81/174151981.db2.gz YGYMGSSJOZBZMM-UHFFFAOYSA-N 1 2 234.299 2.145 20 0 BEADLO COCCCC(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC000338403358 174168658 /nfs/dbraw/zinc/16/86/58/174168658.db2.gz CBVYNAYSJWGGPQ-UHFFFAOYSA-N 1 2 247.298 2.236 20 0 BEADLO COCCCCC(=O)Nc1cccc2[nH+]ccn21 ZINC000266147773 174175206 /nfs/dbraw/zinc/17/52/06/174175206.db2.gz VIGPXVHAKLWSDW-UHFFFAOYSA-N 1 2 247.298 2.090 20 0 BEADLO COCC[N@H+](C)Cc1csc(C2CC2)n1 ZINC000270354306 174280356 /nfs/dbraw/zinc/28/03/56/174280356.db2.gz WHAFCSARMLXTAB-UHFFFAOYSA-N 1 2 226.345 2.099 20 0 BEADLO COCC[N@@H+](C)Cc1csc(C2CC2)n1 ZINC000270354306 174280358 /nfs/dbraw/zinc/28/03/58/174280358.db2.gz WHAFCSARMLXTAB-UHFFFAOYSA-N 1 2 226.345 2.099 20 0 BEADLO COCC[N@H+](Cc1nc(C)sc1C)C1CC1 ZINC000336700206 174301180 /nfs/dbraw/zinc/30/11/80/174301180.db2.gz KMCDOUWIGOHHAV-UHFFFAOYSA-N 1 2 240.372 2.371 20 0 BEADLO COCC[N@@H+](Cc1nc(C)sc1C)C1CC1 ZINC000336700206 174301182 /nfs/dbraw/zinc/30/11/82/174301182.db2.gz KMCDOUWIGOHHAV-UHFFFAOYSA-N 1 2 240.372 2.371 20 0 BEADLO COCC[N@H+](Cc1ncc(C)s1)C1CC1 ZINC000357293110 174302797 /nfs/dbraw/zinc/30/27/97/174302797.db2.gz HLRCSOSBYPWRDT-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO COCC[N@@H+](Cc1ncc(C)s1)C1CC1 ZINC000357293110 174302799 /nfs/dbraw/zinc/30/27/99/174302799.db2.gz HLRCSOSBYPWRDT-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO COCCOCCn1c[nH+]c2cc(C)c(C)cc21 ZINC000162946321 174360507 /nfs/dbraw/zinc/36/05/07/174360507.db2.gz ZTXZAWZGDLXJDX-UHFFFAOYSA-N 1 2 248.326 2.316 20 0 BEADLO COCCOc1cccc(C[NH2+]CC(F)F)c1 ZINC000362309497 174369523 /nfs/dbraw/zinc/36/95/23/174369523.db2.gz QPAHJYZHNPDQRA-UHFFFAOYSA-N 1 2 245.269 2.067 20 0 BEADLO COCC[C@@H](C)[NH2+]c1ccc2c(c1)CCO2 ZINC000045023986 174386437 /nfs/dbraw/zinc/38/64/37/174386437.db2.gz TXRMWEYIOPWWQM-SNVBAGLBSA-N 1 2 221.300 2.458 20 0 BEADLO CO[C@H](C)[C@H](C)Nc1nc(N)c2ccccc2[nH+]1 ZINC000302697511 174852785 /nfs/dbraw/zinc/85/27/85/174852785.db2.gz HCZSPNCOMIADGY-DTWKUNHWSA-N 1 2 246.314 2.047 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2CO[C@@H](C3CC3)C2)c1 ZINC000668293107 487629586 /nfs/dbraw/zinc/62/95/86/487629586.db2.gz UEQUNSKSXSJQAN-QWHCGFSZSA-N 1 2 248.326 2.207 20 0 BEADLO COc1ccc(C)[nH+]c1NCc1ncc(C)n1C ZINC000341276019 175083478 /nfs/dbraw/zinc/08/34/78/175083478.db2.gz HEBJSDMTPPBJLA-UHFFFAOYSA-N 1 2 246.314 2.053 20 0 BEADLO COc1ccc(F)c(C[N@@H+]2CCOC[C@H]2C)c1 ZINC000295453878 175124046 /nfs/dbraw/zinc/12/40/46/175124046.db2.gz VKVNIIXMMOVTGZ-SNVBAGLBSA-N 1 2 239.290 2.055 20 0 BEADLO COc1ccc(F)c(C[N@H+]2CCOC[C@H]2C)c1 ZINC000295453878 175124047 /nfs/dbraw/zinc/12/40/47/175124047.db2.gz VKVNIIXMMOVTGZ-SNVBAGLBSA-N 1 2 239.290 2.055 20 0 BEADLO COc1ccc(F)cc1-c1ccc(N)[nH+]c1 ZINC000052886425 175127592 /nfs/dbraw/zinc/12/75/92/175127592.db2.gz IHPFFWNUCDFYOW-UHFFFAOYSA-N 1 2 218.231 2.479 20 0 BEADLO COc1ccc(F)cc1C[N@@H+]1CCO[C@H](C)C1 ZINC000290483164 175128973 /nfs/dbraw/zinc/12/89/73/175128973.db2.gz VMBJUPRYKZDDNR-SNVBAGLBSA-N 1 2 239.290 2.055 20 0 BEADLO COc1ccc(F)cc1C[N@H+]1CCO[C@H](C)C1 ZINC000290483164 175128976 /nfs/dbraw/zinc/12/89/76/175128976.db2.gz VMBJUPRYKZDDNR-SNVBAGLBSA-N 1 2 239.290 2.055 20 0 BEADLO COc1ccc(NCc2[nH]cc[nH+]2)c(OC)c1 ZINC000049714477 175153147 /nfs/dbraw/zinc/15/31/47/175153147.db2.gz JQHBDABFHNUGKQ-UHFFFAOYSA-N 1 2 233.271 2.039 20 0 BEADLO COc1ccc(N[C@@H]2C[C@H](C)n3cc[nH+]c32)cn1 ZINC000294098682 175154891 /nfs/dbraw/zinc/15/48/91/175154891.db2.gz MMNJXWWJDDLCQS-GXSJLCMTSA-N 1 2 244.298 2.405 20 0 BEADLO COc1ccc2[nH+]c(N(C)C[C@@H](C)O)ccc2c1 ZINC000302614656 175228787 /nfs/dbraw/zinc/22/87/87/175228787.db2.gz CCYSSQQBPWQFIQ-SNVBAGLBSA-N 1 2 246.310 2.060 20 0 BEADLO COc1ccc2oc(C[NH+]3CCOCC3)cc2c1 ZINC000156386298 175230780 /nfs/dbraw/zinc/23/07/80/175230780.db2.gz ASJWYPIWFHBYGJ-UHFFFAOYSA-N 1 2 247.294 2.274 20 0 BEADLO COCc1cc[nH+]c(N[C@H]2CO[C@H](C3CC3)C2)c1 ZINC000668293106 487630153 /nfs/dbraw/zinc/63/01/53/487630153.db2.gz UEQUNSKSXSJQAN-OLZOCXBDSA-N 1 2 248.326 2.207 20 0 BEADLO COc1cccc(CNc2c[nH+]ccc2C)n1 ZINC000083356684 175268636 /nfs/dbraw/zinc/26/86/36/175268636.db2.gz AFUXVJLHGDFZKK-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO COc1cccc(CNc2cc(C)[nH+]cn2)c1 ZINC000040727265 175269031 /nfs/dbraw/zinc/26/90/31/175269031.db2.gz VRNWGQSRUNVVOD-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO COc1cccc(CNc2cccc[nH+]2)n1 ZINC000083348234 175269066 /nfs/dbraw/zinc/26/90/66/175269066.db2.gz NJFGWSWSODHBKC-UHFFFAOYSA-N 1 2 215.256 2.097 20 0 BEADLO COc1cccc(F)c1[C@@H](C)[NH2+]CCF ZINC000336687276 175274140 /nfs/dbraw/zinc/27/41/40/175274140.db2.gz LIRYGPOULNFMNL-MRVPVSSYSA-N 1 2 215.243 2.454 20 0 BEADLO COc1cccc(OC)c1OCc1c[nH+]cn1C ZINC000267805637 175282622 /nfs/dbraw/zinc/28/26/22/175282622.db2.gz RIRLTSAZAWYZCX-UHFFFAOYSA-N 1 2 248.282 2.016 20 0 BEADLO COc1cccc([C@@H](C)[NH2+]Cc2c[nH]cn2)c1 ZINC000054765031 175287086 /nfs/dbraw/zinc/28/70/86/175287086.db2.gz ZYHIJRSFBDHISN-SNVBAGLBSA-N 1 2 231.299 2.269 20 0 BEADLO COc1cccc2c(NC[C@H](C)CO)cc[nH+]c12 ZINC000275507222 175299844 /nfs/dbraw/zinc/29/98/44/175299844.db2.gz MURRKWJNBSWFEK-JTQLQIEISA-N 1 2 246.310 2.284 20 0 BEADLO COc1cccc2c(N[C@H]3C[C@@H](O)C3)cc[nH+]c12 ZINC000295432225 175300328 /nfs/dbraw/zinc/30/03/28/175300328.db2.gz UXNQJHHJXAPBGJ-AOOOYVTPSA-N 1 2 244.294 2.179 20 0 BEADLO COc1cc[nH+]c(CN(C)Cc2cscn2)c1 ZINC000106860122 175358725 /nfs/dbraw/zinc/35/87/25/175358725.db2.gz VZBPKZHGTOZUAD-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1cc[nH+]c(CN(CC(F)F)C2CC2)c1 ZINC000155689511 175359141 /nfs/dbraw/zinc/35/91/41/175359141.db2.gz PPHWKJDNUWWVPJ-UHFFFAOYSA-N 1 2 242.269 2.320 20 0 BEADLO COc1cc[nH+]c(CN2CCC[C@@H]2C(F)F)c1 ZINC000353172306 175359291 /nfs/dbraw/zinc/35/92/91/175359291.db2.gz NNKNVOLOYWUUSS-LLVKDONJSA-N 1 2 242.269 2.320 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)CC1CCCC1 ZINC000293262033 175369958 /nfs/dbraw/zinc/36/99/58/175369958.db2.gz FRRQGNXJHXHMMM-UHFFFAOYSA-N 1 2 248.326 2.287 20 0 BEADLO COc1ccncc1C[NH2+]Cc1csc(C)n1 ZINC000292498652 175371635 /nfs/dbraw/zinc/37/16/35/175371635.db2.gz CGPYFGQUZQSREK-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO COc1cc[nH+]cc1COc1c(C)nn(C)c1C ZINC000288649011 175372948 /nfs/dbraw/zinc/37/29/48/175372948.db2.gz QTPBQYCATGNLCF-UHFFFAOYSA-N 1 2 247.298 2.020 20 0 BEADLO COc1cc[nH+]cc1COC(=O)[C@@H](C)C(C)C ZINC000286883119 175373623 /nfs/dbraw/zinc/37/36/23/175373623.db2.gz FLPJCWBAKXYXRO-JTQLQIEISA-N 1 2 237.299 2.426 20 0 BEADLO COc1cc[nH+]cc1COC(=O)CCC1CC1 ZINC000287294986 175374147 /nfs/dbraw/zinc/37/41/47/175374147.db2.gz UYPQYKNIKZUVKB-UHFFFAOYSA-N 1 2 235.283 2.324 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1ccc(C)o1 ZINC000336322739 175376004 /nfs/dbraw/zinc/37/60/04/175376004.db2.gz YXWBZEAZAXHXKS-UHFFFAOYSA-N 1 2 232.239 2.244 20 0 BEADLO COc1ncc(C[N@H+](C)Cc2ccco2)c(C)n1 ZINC000337127727 175398091 /nfs/dbraw/zinc/39/80/91/175398091.db2.gz HLHIGFKOHSMDSH-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1ncc(C[N@@H+](C)Cc2ccco2)c(C)n1 ZINC000337127727 175398092 /nfs/dbraw/zinc/39/80/92/175398092.db2.gz HLHIGFKOHSMDSH-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO C[C@@H](CCO)Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000122296244 175682877 /nfs/dbraw/zinc/68/28/77/175682877.db2.gz HOETXCFKGBPPFE-ZETCQYMHSA-N 1 2 234.221 2.283 20 0 BEADLO C[C@@H](O)c1ncc(CNc2cccc[nH+]2)s1 ZINC000289290443 176000462 /nfs/dbraw/zinc/00/04/62/176000462.db2.gz PQHOXGRUFHFCLS-MRVPVSSYSA-N 1 2 235.312 2.204 20 0 BEADLO C[C@@H](c1cccc(F)c1)[N@H+](C)Cc1nncn1C ZINC000299656660 176017865 /nfs/dbraw/zinc/01/78/65/176017865.db2.gz ZJUVECWKPWSRMT-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO C[C@@H](c1cccc(F)c1)[N@@H+](C)Cc1nncn1C ZINC000299656660 176017867 /nfs/dbraw/zinc/01/78/67/176017867.db2.gz ZJUVECWKPWSRMT-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO C[C@@H](c1ccco1)N(C)C(=O)CCc1[nH]cc[nH+]1 ZINC000279299204 176030096 /nfs/dbraw/zinc/03/00/96/176030096.db2.gz ZQZFYFXVETVVCW-JTQLQIEISA-N 1 2 247.298 2.155 20 0 BEADLO C[C@@H](c1ccco1)[N@H+](Cc1cn(C)nn1)C1CC1 ZINC000336783957 176032680 /nfs/dbraw/zinc/03/26/80/176032680.db2.gz NAJHGMAQFIXYMR-JTQLQIEISA-N 1 2 246.314 2.134 20 0 BEADLO C[C@@H](c1ccco1)[N@@H+](Cc1cn(C)nn1)C1CC1 ZINC000336783957 176032682 /nfs/dbraw/zinc/03/26/82/176032682.db2.gz NAJHGMAQFIXYMR-JTQLQIEISA-N 1 2 246.314 2.134 20 0 BEADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1ccnn1C ZINC000091079569 176035859 /nfs/dbraw/zinc/03/58/59/176035859.db2.gz DUAMTIGWRCOUQP-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1ccnn1C ZINC000091079569 176035861 /nfs/dbraw/zinc/03/58/61/176035861.db2.gz DUAMTIGWRCOUQP-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1ccn(C)n1 ZINC000272068995 176036106 /nfs/dbraw/zinc/03/61/06/176036106.db2.gz UBWGNSXCIMAOFH-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1ccn(C)n1 ZINC000272068995 176036107 /nfs/dbraw/zinc/03/61/07/176036107.db2.gz UBWGNSXCIMAOFH-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H]1CCCC[C@@H]1CNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000283532746 176076418 /nfs/dbraw/zinc/07/64/18/176076418.db2.gz RMQXKEVXHSDSPR-BYAJROORSA-N 1 2 247.342 2.365 20 0 BEADLO C[C@@H]1CCCC[C@@H]1N(C)C(=O)CCc1[nH]cc[nH+]1 ZINC000279259316 176077828 /nfs/dbraw/zinc/07/78/28/176077828.db2.gz SZNCSSDGWJCADP-NEPJUHHUSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H]1CCCC[C@H]1c1noc(C[NH+](C)C)n1 ZINC000336181439 176090132 /nfs/dbraw/zinc/09/01/32/176090132.db2.gz ALYRSNTTWYIQCP-NXEZZACHSA-N 1 2 223.320 2.425 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)C=Cc2c[nH]c[nH+]2)[C@@H]1C ZINC000276567270 176121297 /nfs/dbraw/zinc/12/12/97/176121297.db2.gz KUPIRCTWBQHRLC-XFYHGXPUSA-N 1 2 247.342 2.364 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)CCc2[nH]cc[nH+]2)C1 ZINC000279289510 176122042 /nfs/dbraw/zinc/12/20/42/176122042.db2.gz YNCXMXCWEUWYMQ-GHMZBOCLSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H]1CCC[C@@]1(O)CNc1cc[nH+]c(C2CC2)n1 ZINC000294278746 176134409 /nfs/dbraw/zinc/13/44/09/176134409.db2.gz XOOMYPRWDICUJZ-QMTHXVAHSA-N 1 2 247.342 2.317 20 0 BEADLO C[C@@H]1CCC[C@H](CNC(=O)CCn2cc[nH+]c2)C1 ZINC000338052615 176138350 /nfs/dbraw/zinc/13/83/50/176138350.db2.gz QABSIQAWSVTQJI-OLZOCXBDSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)CCc2c[nH+]c[nH]2)CC1 ZINC000281936432 176141275 /nfs/dbraw/zinc/14/12/75/176141275.db2.gz RVWMRHCRUQYFNE-NEPJUHHUSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)CCc2c[nH]c[nH+]2)CC1 ZINC000281936432 176141276 /nfs/dbraw/zinc/14/12/76/176141276.db2.gz RVWMRHCRUQYFNE-NEPJUHHUSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@@H]1C[C@H](C)CCN(C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000287586368 176155381 /nfs/dbraw/zinc/15/53/81/176155381.db2.gz GUPZQAVOTSUADI-VXGBXAGGSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H]1CCN(c2cccc[nH+]2)CCS1 ZINC000276832544 176182001 /nfs/dbraw/zinc/18/20/01/176182001.db2.gz BHWQGRNPOFOXLS-SNVBAGLBSA-N 1 2 208.330 2.413 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)C[C@H]1CC[C@@H](C)C1 ZINC000268432639 176222845 /nfs/dbraw/zinc/22/28/45/176222845.db2.gz NRUNEAZKLIMWAA-UPJWGTAASA-N 1 2 249.358 2.214 20 0 BEADLO C[C@@H]1C[N@H+](Cc2c(Cl)cnn2C)CCS1 ZINC000187170235 176301300 /nfs/dbraw/zinc/30/13/00/176301300.db2.gz PLZKJQUBKRLBHX-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2c(Cl)cnn2C)CCS1 ZINC000187170235 176301302 /nfs/dbraw/zinc/30/13/02/176301302.db2.gz PLZKJQUBKRLBHX-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO C[C@@H]1C[NH+](Cc2cccc(Cl)n2)C[C@@H](C)O1 ZINC000085696683 176305929 /nfs/dbraw/zinc/30/59/29/176305929.db2.gz JCKOISLJLUDFIC-NXEZZACHSA-N 1 2 240.734 2.344 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nccs2)C[C@H](C2CC2)O1 ZINC000279302065 176312468 /nfs/dbraw/zinc/31/24/68/176312468.db2.gz MHOHXINFZYTRPH-MWLCHTKSSA-N 1 2 238.356 2.142 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nccs2)C[C@H](C2CC2)O1 ZINC000279302065 176312470 /nfs/dbraw/zinc/31/24/70/176312470.db2.gz MHOHXINFZYTRPH-MWLCHTKSSA-N 1 2 238.356 2.142 20 0 BEADLO C[C@H](c1nc(C2CC2)no1)[N@@H+]1C[C@@H](C)[C@H]1C ZINC000339573300 176318002 /nfs/dbraw/zinc/31/80/02/176318002.db2.gz AWQBQYAJEAXREU-IWSPIJDZSA-N 1 2 221.304 2.348 20 0 BEADLO C[C@H](c1nc(C2CC2)no1)[N@H+]1C[C@@H](C)[C@H]1C ZINC000339573300 176318003 /nfs/dbraw/zinc/31/80/03/176318003.db2.gz AWQBQYAJEAXREU-IWSPIJDZSA-N 1 2 221.304 2.348 20 0 BEADLO C[C@@H]1CN(c2[nH+]ccc3ccc(F)cc32)C[C@@H]1O ZINC000354874042 176320643 /nfs/dbraw/zinc/32/06/43/176320643.db2.gz GRAIBNXIBSEVIA-RNCFNFMXSA-N 1 2 246.285 2.191 20 0 BEADLO C[C@@H]1COCC[C@@H]1[NH2+][C@@H](C1CC1)C(F)(F)F ZINC000309822856 176341648 /nfs/dbraw/zinc/34/16/48/176341648.db2.gz WRUOAWDFUVYGAO-JEZHCXPESA-N 1 2 237.265 2.342 20 0 BEADLO C[C@@H]1C[C@@H](NCc2nccs2)c2[nH+]ccn21 ZINC000345362964 176377430 /nfs/dbraw/zinc/37/74/30/176377430.db2.gz VWHILRYBVNRVFA-RKDXNWHRSA-N 1 2 234.328 2.135 20 0 BEADLO C[C@@H]1C[C@@H](O)CN1c1[nH+]ccc2ccc(F)cc21 ZINC000336367893 176383233 /nfs/dbraw/zinc/38/32/33/176383233.db2.gz QXPSIJYABSGWJJ-BXKDBHETSA-N 1 2 246.285 2.333 20 0 BEADLO C[C@@H]1C[C@@H]1CC(=O)N[C@H](c1[nH+]ccn1C)C1CC1 ZINC000356498451 176390636 /nfs/dbraw/zinc/39/06/36/176390636.db2.gz RMDSGBPGWQSCHS-XWIASGKRSA-N 1 2 247.342 2.034 20 0 BEADLO C[C@@H]1C[C@@H]1CNC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000290592748 176395019 /nfs/dbraw/zinc/39/50/19/176395019.db2.gz GQMUPRUGFHOFCV-NXEZZACHSA-N 1 2 244.298 2.112 20 0 BEADLO CNc1ccccc1C[NH2+][C@H](C)c1nnc(C)[nH]1 ZINC001652387529 1173071058 /nfs/dbraw/zinc/07/10/58/1173071058.db2.gz BPKJUHOOGXGLGZ-SECBINFHSA-N 1 2 245.330 2.006 20 0 BEADLO C[C@H](CC1CC1)[NH2+]c1ccc(OCC(N)=O)cc1 ZINC000165062695 176614504 /nfs/dbraw/zinc/61/45/04/176614504.db2.gz NWBGQVKGSLTJLU-SNVBAGLBSA-N 1 2 248.326 2.151 20 0 BEADLO C[C@H](CNC(=O)CCC1CCC1)Cn1cc[nH+]c1 ZINC000267266485 176673074 /nfs/dbraw/zinc/67/30/74/176673074.db2.gz PWVALISZOHWIDW-GFCCVEGCSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@H](Nc1cc[nH+]c(C2CC2)n1)[C@@H]1CCCOC1 ZINC000355568909 176783998 /nfs/dbraw/zinc/78/39/98/176783998.db2.gz SKELKIDFCAOJKO-CMPLNLGQSA-N 1 2 247.342 2.003 20 0 BEADLO C[C@H](O)c1ncc(CNc2cccc[nH+]2)s1 ZINC000289290444 177019826 /nfs/dbraw/zinc/01/98/26/177019826.db2.gz PQHOXGRUFHFCLS-QMMMGPOBSA-N 1 2 235.312 2.204 20 0 BEADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1cnnn1C ZINC000129711510 177042066 /nfs/dbraw/zinc/04/20/66/177042066.db2.gz SOMJBJCTPCNBTM-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1cnnn1C ZINC000129711510 177042067 /nfs/dbraw/zinc/04/20/67/177042067.db2.gz SOMJBJCTPCNBTM-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO C[C@H](c1ccncc1)[N@H+](C)Cc1ccn(C)n1 ZINC000272068992 177049824 /nfs/dbraw/zinc/04/98/24/177049824.db2.gz UBWGNSXCIMAOFH-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1ccn(C)n1 ZINC000272068992 177049825 /nfs/dbraw/zinc/04/98/25/177049825.db2.gz UBWGNSXCIMAOFH-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H]1CCCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000283294581 177069781 /nfs/dbraw/zinc/06/97/81/177069781.db2.gz WZHOLOZKCARPOQ-QRGHLMKCSA-N 1 2 233.315 2.072 20 0 BEADLO C[C@H]1CCCCN1C(=O)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000336221852 177073271 /nfs/dbraw/zinc/07/32/71/177073271.db2.gz YOLJBYCJCXEWNB-WDEREUQCSA-N 1 2 247.342 2.231 20 0 BEADLO C[C@H]1CCCC[C@H]1Nc1[nH+]cnc2c1cnn2C ZINC000014207697 177089746 /nfs/dbraw/zinc/08/97/46/177089746.db2.gz HGCUIXQXJDMQEP-GXSJLCMTSA-N 1 2 245.330 2.354 20 0 BEADLO C[C@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000276635808 177091264 /nfs/dbraw/zinc/09/12/64/177091264.db2.gz UGVCPFRUHYUHQF-ZWNMCFTASA-N 1 2 233.315 2.072 20 0 BEADLO C[C@H]1CCC[C@@H](N(C)C(=O)CCn2cc[nH+]c2)C1 ZINC000299633008 177120789 /nfs/dbraw/zinc/12/07/89/177120789.db2.gz SRGCTSBROQERQY-QWHCGFSZSA-N 1 2 249.358 2.310 20 0 BEADLO C[C@H]1CCC[C@@H](NC(=O)CCc2[nH]cc[nH+]2)CC1 ZINC000289277641 177121236 /nfs/dbraw/zinc/12/12/36/177121236.db2.gz YXVCGXRMSXXCIA-NWDGAFQWSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@H]1CCC[C@@H]1NC(=O)c1ccc2[nH+]ccn2c1 ZINC000264394442 177125815 /nfs/dbraw/zinc/12/58/15/177125815.db2.gz TWQPTLJNNGKWCQ-JQWIXIFHSA-N 1 2 243.310 2.253 20 0 BEADLO C[C@H]1CCC[C@H](C)C1NC(=O)CCc1c[nH+]c[nH]1 ZINC000193285135 177129544 /nfs/dbraw/zinc/12/95/44/177129544.db2.gz IDHVBTHKKBUEQO-QWRGUYRKSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H]1CCC[C@H](C)C1NC(=O)CCc1c[nH]c[nH+]1 ZINC000193285135 177129546 /nfs/dbraw/zinc/12/95/46/177129546.db2.gz IDHVBTHKKBUEQO-QWRGUYRKSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H]1CCC[C@H](C)N(C(=O)CCn2cc[nH+]c2)C1 ZINC000336578798 177130029 /nfs/dbraw/zinc/13/00/29/177130029.db2.gz GLRBTIKCVMYFNC-STQMWFEESA-N 1 2 249.358 2.310 20 0 BEADLO C[C@H]1CCC[C@H](C)N1C(=O)COc1cc[nH+]cc1 ZINC000276402559 177131501 /nfs/dbraw/zinc/13/15/01/177131501.db2.gz DKGWECMGNVKQKE-RYUDHWBXSA-N 1 2 248.326 2.250 20 0 BEADLO C[C@H]1CCC[C@]1(C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000336245397 177143282 /nfs/dbraw/zinc/14/32/82/177143282.db2.gz AVSNPGAWEXZLMH-GWCFXTLKSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@H]1CCN(C(=O)C=Cc2c[nH]c[nH+]2)CC1(C)C ZINC000283195405 177145255 /nfs/dbraw/zinc/14/52/55/177145255.db2.gz QQYUVLZAIABURS-ZWNMCFTASA-N 1 2 247.342 2.318 20 0 BEADLO C[C@@H]1C[C@@H](C)CCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000283834264 177145391 /nfs/dbraw/zinc/14/53/91/177145391.db2.gz GLZDROKQMCAFTG-MJKAUQOVSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@H]1CCN(C(=O)c2ccc3[nH+]ccn3c2)[C@H]1C ZINC000177060836 177153667 /nfs/dbraw/zinc/15/36/67/177153667.db2.gz HDDCZHLKQLBOIU-QWRGUYRKSA-N 1 2 243.310 2.205 20 0 BEADLO C[C@H]1CCN(c2cc(N3CCCC3)[nH+]cn2)[C@H]1C ZINC000277908373 177171242 /nfs/dbraw/zinc/17/12/42/177171242.db2.gz UVWSRDJMNMOXNY-RYUDHWBXSA-N 1 2 246.358 2.312 20 0 BEADLO C[C@H]1CCN(c2cc(N3CCCC3)nc[nH+]2)[C@H]1C ZINC000277908373 177171243 /nfs/dbraw/zinc/17/12/43/177171243.db2.gz UVWSRDJMNMOXNY-RYUDHWBXSA-N 1 2 246.358 2.312 20 0 BEADLO C[C@@H]1CCN(c2cc(N3CC[C@H](C)C3)nc[nH+]2)C1 ZINC000270002906 177171251 /nfs/dbraw/zinc/17/12/51/177171251.db2.gz YQGQGWNPPSMGMK-TXEJJXNPSA-N 1 2 246.358 2.169 20 0 BEADLO C[C@@H]1CCN(c2cc(N3CC[C@H](C)C3)[nH+]cn2)C1 ZINC000270002906 177171252 /nfs/dbraw/zinc/17/12/52/177171252.db2.gz YQGQGWNPPSMGMK-TXEJJXNPSA-N 1 2 246.358 2.169 20 0 BEADLO C[C@H]1CCN(c2nc(N)c3ccccc3[nH+]2)[C@H]1C ZINC000301910277 177172061 /nfs/dbraw/zinc/17/20/61/177172061.db2.gz SBUVWBDMYMJTSR-UWVGGRQHSA-N 1 2 242.326 2.447 20 0 BEADLO C[C@H]1CC[C@@H](CC(=O)N(C)Cc2[nH+]ccn2C)C1 ZINC000268299929 177187420 /nfs/dbraw/zinc/18/74/20/177187420.db2.gz XQGSXQNZPURHSB-NWDGAFQWSA-N 1 2 249.358 2.205 20 0 BEADLO C[C@H]1C[N@H+](CC(=O)OCc2ccccc2)[C@H]1C ZINC000293025236 177244148 /nfs/dbraw/zinc/24/41/48/177244148.db2.gz PHMBYMGYMMUENQ-RYUDHWBXSA-N 1 2 233.311 2.070 20 0 BEADLO C[C@H]1C[N@@H+](CC(=O)OCc2ccccc2)[C@H]1C ZINC000293025236 177244149 /nfs/dbraw/zinc/24/41/49/177244149.db2.gz PHMBYMGYMMUENQ-RYUDHWBXSA-N 1 2 233.311 2.070 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccc(N)cc2Cl)CCO1 ZINC000049962940 177262963 /nfs/dbraw/zinc/26/29/63/177262963.db2.gz VBOKZOIZCMVRRR-VIFPVBQESA-N 1 2 240.734 2.143 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccc(N)cc2Cl)CCO1 ZINC000049962940 177262965 /nfs/dbraw/zinc/26/29/65/177262965.db2.gz VBOKZOIZCMVRRR-VIFPVBQESA-N 1 2 240.734 2.143 20 0 BEADLO C[C@H]1C[N@H+](Cc2cnns2)CCC1(F)F ZINC000336254018 177269912 /nfs/dbraw/zinc/26/99/12/177269912.db2.gz HZPZSBGSVKUYRA-ZETCQYMHSA-N 1 2 233.287 2.015 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cnns2)CCC1(F)F ZINC000336254018 177269914 /nfs/dbraw/zinc/26/99/14/177269914.db2.gz HZPZSBGSVKUYRA-ZETCQYMHSA-N 1 2 233.287 2.015 20 0 BEADLO C[C@H]1C[N@H+](Cc2nccs2)CC(C)(C)O1 ZINC000135005081 177271501 /nfs/dbraw/zinc/27/15/01/177271501.db2.gz MUBBIKYDUFGEIE-VIFPVBQESA-N 1 2 226.345 2.142 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nccs2)CC(C)(C)O1 ZINC000135005081 177271502 /nfs/dbraw/zinc/27/15/02/177271502.db2.gz MUBBIKYDUFGEIE-VIFPVBQESA-N 1 2 226.345 2.142 20 0 BEADLO C[C@H]1C[N@H+](Cc2nccn2C(F)F)[C@H]1C ZINC000292936469 177271549 /nfs/dbraw/zinc/27/15/49/177271549.db2.gz HLMNQDKIDZVXFL-YUMQZZPRSA-N 1 2 215.247 2.118 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nccn2C(F)F)[C@H]1C ZINC000292936469 177271552 /nfs/dbraw/zinc/27/15/52/177271552.db2.gz HLMNQDKIDZVXFL-YUMQZZPRSA-N 1 2 215.247 2.118 20 0 BEADLO C[C@H]1CN(c2cc[nH+]c3ccncc32)CCCO1 ZINC000267929714 177277096 /nfs/dbraw/zinc/27/70/96/177277096.db2.gz FGJLRKGVEJWKEU-NSHDSACASA-N 1 2 243.310 2.245 20 0 BEADLO CC1=C(C)C[C@@H](C(=O)NCc2c[nH+]cn2C)CC1 ZINC000335476149 487637774 /nfs/dbraw/zinc/63/77/74/487637774.db2.gz YYLKDGARJHEHJU-LBPRGKRZSA-N 1 2 247.342 2.173 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc(O)cc(F)c2)[C@@H](C)CO1 ZINC000223753446 177301710 /nfs/dbraw/zinc/30/17/10/177301710.db2.gz NHJXGDTVTDTMBL-VHSXEESVSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc(O)cc(F)c2)[C@@H](C)CO1 ZINC000223753446 177301711 /nfs/dbraw/zinc/30/17/11/177301711.db2.gz NHJXGDTVTDTMBL-VHSXEESVSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccnc(Cl)c2)[C@@H](C)CO1 ZINC000223908982 177302264 /nfs/dbraw/zinc/30/22/64/177302264.db2.gz RGDSORGSEBUQAI-VHSXEESVSA-N 1 2 240.734 2.344 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccnc(Cl)c2)[C@@H](C)CO1 ZINC000223908982 177302265 /nfs/dbraw/zinc/30/22/65/177302265.db2.gz RGDSORGSEBUQAI-VHSXEESVSA-N 1 2 240.734 2.344 20 0 BEADLO C[C@@H]1C[C@H](C)[C@H](C)N(C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000357126876 177310282 /nfs/dbraw/zinc/31/02/82/177310282.db2.gz UDGQQUCSTLZEPR-WOPDTQHZSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H]1C[C@H](NC(=O)CCn2cc[nH+]c2)C[C@@H](C)C1 ZINC000265722596 177318322 /nfs/dbraw/zinc/31/83/22/177318322.db2.gz NGVROCMMFUFNFG-ITGUQSILSA-N 1 2 249.358 2.214 20 0 BEADLO C[C@H]1C[C@H](NC(=O)CCc2[nH]cc[nH+]2)C[C@@H](C)C1 ZINC000287674970 177318419 /nfs/dbraw/zinc/31/84/19/177318419.db2.gz PHCLMQAIQDXPPA-GDNZZTSVSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1C[C@H](C)N1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000336233074 177320106 /nfs/dbraw/zinc/32/01/06/177320106.db2.gz ORYJPOMQCREFMK-AOOOYVTPSA-N 1 2 244.298 2.349 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)NC2CCCC2)c2[nH+]ccn21 ZINC000333880546 177328790 /nfs/dbraw/zinc/32/87/90/177328790.db2.gz WFPJDWMMMKHCDU-GXSJLCMTSA-N 1 2 248.330 2.131 20 0 BEADLO C[C@H]1C[C@@H](O)CC[N@@H+]1Cc1ncc(Cl)s1 ZINC000336123906 177335332 /nfs/dbraw/zinc/33/53/32/177335332.db2.gz TVYKODNHXPWZHJ-YUMQZZPRSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@H]1C[C@@H](O)CC[N@H+]1Cc1ncc(Cl)s1 ZINC000336123906 177335334 /nfs/dbraw/zinc/33/53/34/177335334.db2.gz TVYKODNHXPWZHJ-YUMQZZPRSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@H]1C[C@@H]1CC(=O)Nc1c[nH+]c2n1CCCC2 ZINC000336304862 177342503 /nfs/dbraw/zinc/34/25/03/177342503.db2.gz MKMXVWSRTXLZGO-VHSXEESVSA-N 1 2 233.315 2.204 20 0 BEADLO C[C@H]1C[C@H]([NH2+]Cc2ccco2)c2nccn21 ZINC000294284784 177371045 /nfs/dbraw/zinc/37/10/45/177371045.db2.gz YTKSHRXZNVNENH-ONGXEEELSA-N 1 2 217.272 2.272 20 0 BEADLO C[C@H]1C[C@H]1CC(=O)Nc1c[nH+]c2n1CCCC2 ZINC000336304861 177378715 /nfs/dbraw/zinc/37/87/15/177378715.db2.gz MKMXVWSRTXLZGO-UWVGGRQHSA-N 1 2 233.315 2.204 20 0 BEADLO C[C@]1(O)CCN(c2cc(C(F)(F)F)cc[nH+]2)C1 ZINC000230476769 177476414 /nfs/dbraw/zinc/47/64/14/177476414.db2.gz YWODWUJHXBJEEV-JTQLQIEISA-N 1 2 246.232 2.062 20 0 BEADLO Cc1ccc(Cc2noc([C@@H]3C[C@H]3C)n2)c[nH+]1 ZINC000680712794 487638916 /nfs/dbraw/zinc/63/89/16/487638916.db2.gz MXTMXDGDMUODRO-LDYMZIIASA-N 1 2 229.283 2.487 20 0 BEADLO CCc1[nH]c(CNC(=O)C[C@@H]2CC[C@@H](C)C2)c[nH+]1 ZINC001652464148 1173088086 /nfs/dbraw/zinc/08/80/86/1173088086.db2.gz VOZSITWNEPMGTC-GHMZBOCLSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)C[C@@H]2CC[C@@H](C)C2)[nH+]1 ZINC001652464148 1173088093 /nfs/dbraw/zinc/08/80/93/1173088093.db2.gz VOZSITWNEPMGTC-GHMZBOCLSA-N 1 2 249.358 2.415 20 0 BEADLO Cc1c(Nc2cc(C)[nH+]c(C(C)C)n2)cnn1C ZINC000471742930 225077596 /nfs/dbraw/zinc/07/75/96/225077596.db2.gz XVDUIERFQQOYBR-UHFFFAOYSA-N 1 2 245.330 2.116 20 0 BEADLO Cc1cccc(C)c1C[NH2+]Cc1ncccn1 ZINC000568275646 322932996 /nfs/dbraw/zinc/93/29/96/322932996.db2.gz ULEVKKXOHGFUSJ-UHFFFAOYSA-N 1 2 227.311 2.383 20 0 BEADLO C[C@H]1CN(C(=O)C=Cc2c[nH]c[nH+]2)CC(C)(C)C1 ZINC000492776531 226051614 /nfs/dbraw/zinc/05/16/14/226051614.db2.gz ZWBJANUFIRYUMS-SGUJLRQBSA-N 1 2 247.342 2.318 20 0 BEADLO C[C@@H]1CCCC[C@@H]1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492822360 226060199 /nfs/dbraw/zinc/06/01/99/226060199.db2.gz INNNRDWNORWUFW-BTTAUDESSA-N 1 2 233.315 2.118 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)Nc1ccccc1 ZINC000492820792 226060412 /nfs/dbraw/zinc/06/04/12/226060412.db2.gz CCCLOOTVXNUEOS-VOTSOKGWSA-N 1 2 213.240 2.062 20 0 BEADLO Cc1cc(O)ccc1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492868672 226071661 /nfs/dbraw/zinc/07/16/61/226071661.db2.gz TYKCINMQRVQWQK-DJWKRKHSSA-N 1 2 243.266 2.076 20 0 BEADLO C[C@@H]1CCC[C@H](N(C)C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492904996 226081038 /nfs/dbraw/zinc/08/10/38/226081038.db2.gz YJSRCLNRQJTJPT-YXZYKRAASA-N 1 2 247.342 2.460 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)NCCC1=CCCCC1 ZINC000492907134 226081831 /nfs/dbraw/zinc/08/18/31/226081831.db2.gz CREFACOPAAZKBF-SREVYHEPSA-N 1 2 245.326 2.430 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C=CC1CCCC1 ZINC000493088086 226123598 /nfs/dbraw/zinc/12/35/98/226123598.db2.gz UEZPFPORUVNRCZ-SREVYHEPSA-N 1 2 230.311 2.497 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)N[C@@H]1CC12CCCCC2 ZINC000493147697 226139135 /nfs/dbraw/zinc/13/91/35/226139135.db2.gz GXHAVWMIRLABBK-SGUJLRQBSA-N 1 2 245.326 2.262 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)NCC12CCC(CC1)C2 ZINC000493198547 226153848 /nfs/dbraw/zinc/15/38/48/226153848.db2.gz ZQCNZOVAPINIBY-OWOJBTEDSA-N 1 2 245.326 2.119 20 0 BEADLO CN(C(=O)/C=C/c1[nH]cc[nH+]1)C1(C)CCCC1 ZINC000493353480 226193570 /nfs/dbraw/zinc/19/35/70/226193570.db2.gz OYHPOKPYEXYCSI-AATRIKPKSA-N 1 2 233.315 2.214 20 0 BEADLO CN(C(=O)/C=C\c1[nH]cc[nH+]1)C1(C)CCCC1 ZINC000493353481 226194135 /nfs/dbraw/zinc/19/41/35/226194135.db2.gz OYHPOKPYEXYCSI-WAYWQWQTSA-N 1 2 233.315 2.214 20 0 BEADLO C[C@H](N(C)C(=O)C=Cc1c[nH]c[nH+]1)C1(C)CC1 ZINC000493380393 226200009 /nfs/dbraw/zinc/20/00/09/226200009.db2.gz FPUZUYSNYVKSFJ-LWTINBJPSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@@H]1CCN(C(=O)/C=C\c2[nH]cc[nH+]2)[C@H](C)C1 ZINC000493450985 226219705 /nfs/dbraw/zinc/21/97/05/226219705.db2.gz IUDZMDTTWNUYSM-ANDSXOESSA-N 1 2 233.315 2.070 20 0 BEADLO O=C(/C=C/C1CCCC1)NCCCn1cc[nH+]c1 ZINC000493520070 226238581 /nfs/dbraw/zinc/23/85/81/226238581.db2.gz JNLMHGDUNIVQFK-VOTSOKGWSA-N 1 2 247.342 2.136 20 0 BEADLO C[C@H](CC(C)(C)C)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493663639 226248234 /nfs/dbraw/zinc/24/82/34/226248234.db2.gz YFUSNQLCBGDKTG-BRAIEQGRSA-N 1 2 235.331 2.364 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)N1CCCCCCC1 ZINC000493802904 226254806 /nfs/dbraw/zinc/25/48/06/226254806.db2.gz LZCSYHIKOOWKQM-VOTSOKGWSA-N 1 2 233.315 2.216 20 0 BEADLO CN(C(=O)/C=C\c1[nH]cc[nH+]1)C1CC(C)(C)C1 ZINC000493812705 226255402 /nfs/dbraw/zinc/25/54/02/226255402.db2.gz CHZREXRWMMJVTF-PLNGDYQASA-N 1 2 233.315 2.070 20 0 BEADLO Cc1cc(C)c(CNC(=O)OC2CCC2)c[nH+]1 ZINC000496344254 226302528 /nfs/dbraw/zinc/30/25/28/226302528.db2.gz QFUGUAXOIPQFPS-UHFFFAOYSA-N 1 2 234.299 2.477 20 0 BEADLO Cn1cc[nH+]c1[C@H](NC(=O)OC1CCC1)C1CC1 ZINC000496643451 226310316 /nfs/dbraw/zinc/31/03/16/226310316.db2.gz NFDIAMOYQDCXHV-LLVKDONJSA-N 1 2 249.314 2.150 20 0 BEADLO Cc1cc(C)c(CNC(=O)OCC2CC2)c[nH+]1 ZINC000496999000 226319817 /nfs/dbraw/zinc/31/98/17/226319817.db2.gz DIHPAORTTUPKAT-UHFFFAOYSA-N 1 2 234.299 2.335 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)C(F)F)c1cccnc1 ZINC000228483483 487656707 /nfs/dbraw/zinc/65/67/07/487656707.db2.gz YGNASSQUHAMFFZ-SFYZADRCSA-N 1 2 200.232 2.386 20 0 BEADLO C[C@@H]([NH2+]Cc1ccc2c(c1)OCCO2)C(F)F ZINC000228482511 487656866 /nfs/dbraw/zinc/65/68/66/487656866.db2.gz HVGWCMYEQQVNBV-MRVPVSSYSA-N 1 2 243.253 2.201 20 0 BEADLO CCc1ccc(C[NH2+]CC(C)(F)F)cn1 ZINC000393464168 487662135 /nfs/dbraw/zinc/66/21/35/487662135.db2.gz BAPXBJWMLYQZMB-UHFFFAOYSA-N 1 2 214.259 2.389 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)c1ncc(Cl)s1 ZINC000680893990 487668146 /nfs/dbraw/zinc/66/81/46/487668146.db2.gz CQLZXADTURZZIG-UHFFFAOYSA-N 1 2 228.708 2.156 20 0 BEADLO CCc1cc(N[C@@H]2CCO[C@@H](C3CC3)C2)nc[nH+]1 ZINC000680899433 487670045 /nfs/dbraw/zinc/67/00/45/487670045.db2.gz MVNIWNJAHHXDOQ-CHWSQXEVSA-N 1 2 247.342 2.409 20 0 BEADLO CCc1cc(N[C@@H]2CCO[C@H](C3CC3)C2)nc[nH+]1 ZINC000680899434 487670174 /nfs/dbraw/zinc/67/01/74/487670174.db2.gz MVNIWNJAHHXDOQ-OLZOCXBDSA-N 1 2 247.342 2.409 20 0 BEADLO CO[C@@H]([C@H](C)Nc1cc[nH+]c(C(C)C)n1)C1CC1 ZINC000450867732 229166790 /nfs/dbraw/zinc/16/67/90/229166790.db2.gz ZTWKYUHJKHYBRB-GWCFXTLKSA-N 1 2 249.358 2.247 20 0 BEADLO O=C(Nc1ccsc1)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000668858929 487672742 /nfs/dbraw/zinc/67/27/42/487672742.db2.gz RWAXEALOADSLSM-QMMMGPOBSA-N 1 2 247.323 2.215 20 0 BEADLO O=C(Nc1ccsc1)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000668858929 487672751 /nfs/dbraw/zinc/67/27/51/487672751.db2.gz RWAXEALOADSLSM-QMMMGPOBSA-N 1 2 247.323 2.215 20 0 BEADLO O=C(/C=C/C1CCCCC1)NCCc1[nH]cc[nH+]1 ZINC000174755302 229393449 /nfs/dbraw/zinc/39/34/49/229393449.db2.gz ZSCQIKGVVGEFQH-VOTSOKGWSA-N 1 2 247.342 2.205 20 0 BEADLO Cn1c[nH+]cc1[C@@H]1C[C@H]1C(=O)Nc1ccsc1 ZINC000668858385 487672850 /nfs/dbraw/zinc/67/28/50/487672850.db2.gz CMCRYWZBFGMTHP-NXEZZACHSA-N 1 2 247.323 2.224 20 0 BEADLO CO[C@@H](CNc1ccc(C)[nH+]c1)C1CC1 ZINC000653469325 487673532 /nfs/dbraw/zinc/67/35/32/487673532.db2.gz WKLDDFGYYXBOPK-LBPRGKRZSA-N 1 2 206.289 2.227 20 0 BEADLO CCc1cc(C)nc(N[C@@H](C)Cn2cc[nH+]c2)n1 ZINC000680952949 487677557 /nfs/dbraw/zinc/67/75/57/487677557.db2.gz ZOAGOCRYVRSFFX-NSHDSACASA-N 1 2 245.330 2.045 20 0 BEADLO COc1ccc(N[C@H](C)c2cc(C)n(C)n2)[nH+]c1 ZINC000669702918 487700255 /nfs/dbraw/zinc/70/02/55/487700255.db2.gz WOMQIWKKWLHVRI-SNVBAGLBSA-N 1 2 246.314 2.305 20 0 BEADLO C[C@@H](c1cnccn1)[NH+]1CC2(C1)CC(F)(F)C2 ZINC000681023462 487700677 /nfs/dbraw/zinc/70/06/77/487700677.db2.gz HOQUBLKHYCISIN-VIFPVBQESA-N 1 2 239.269 2.269 20 0 BEADLO C[C@H](c1cnccn1)[NH+]1CC2(C1)CC(F)(F)C2 ZINC000681023440 487700638 /nfs/dbraw/zinc/70/06/38/487700638.db2.gz HOQUBLKHYCISIN-SECBINFHSA-N 1 2 239.269 2.269 20 0 BEADLO C[C@@H]1CO[C@H](C(F)(F)F)C[N@@H+]1CCCCF ZINC000671715561 487704312 /nfs/dbraw/zinc/70/43/12/487704312.db2.gz JDSYATFDGDSAOA-BDAKNGLRSA-N 1 2 243.244 2.388 20 0 BEADLO C[C@@H]1CO[C@H](C(F)(F)F)C[N@H+]1CCCCF ZINC000671715561 487704318 /nfs/dbraw/zinc/70/43/18/487704318.db2.gz JDSYATFDGDSAOA-BDAKNGLRSA-N 1 2 243.244 2.388 20 0 BEADLO Cc1cc([C@@H](C)N[C@@H](C)c2[nH+]ccn2C)no1 ZINC000669706429 487706392 /nfs/dbraw/zinc/70/63/92/487706392.db2.gz DOBFMRWUEPTSTL-ZJUUUORDSA-N 1 2 234.303 2.128 20 0 BEADLO CCC(C)(CC)C(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000681058429 487709375 /nfs/dbraw/zinc/70/93/75/487709375.db2.gz MJDAENBTBPPBQR-JTQLQIEISA-N 1 2 249.358 2.210 20 0 BEADLO CCC(C)(CC)C(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000681058429 487709378 /nfs/dbraw/zinc/70/93/78/487709378.db2.gz MJDAENBTBPPBQR-JTQLQIEISA-N 1 2 249.358 2.210 20 0 BEADLO Cn1ncc(C2CC2)c1C[N@H+](C)Cc1ccc[nH]1 ZINC000667687416 487719020 /nfs/dbraw/zinc/71/90/20/487719020.db2.gz LVQQZJXFIDLJQY-UHFFFAOYSA-N 1 2 244.342 2.258 20 0 BEADLO Cn1ncc(C2CC2)c1C[N@@H+](C)Cc1ccc[nH]1 ZINC000667687416 487719023 /nfs/dbraw/zinc/71/90/23/487719023.db2.gz LVQQZJXFIDLJQY-UHFFFAOYSA-N 1 2 244.342 2.258 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)Cc1ccc(Cl)o1 ZINC000668423360 487729402 /nfs/dbraw/zinc/72/94/02/487729402.db2.gz VZFCKUMVQYRNRQ-UHFFFAOYSA-N 1 2 225.679 2.288 20 0 BEADLO Cc1ccc(C[NH2+]Cc2ncnn2C(C)C)o1 ZINC000088591560 487736919 /nfs/dbraw/zinc/73/69/19/487736919.db2.gz AULIHWLYRKSMPM-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO Cc1nc(N2CCC[C@H](CCO)C2)c(C)c(C)[nH+]1 ZINC000675548709 487746787 /nfs/dbraw/zinc/74/67/87/487746787.db2.gz ZCTRWRZSLDZWNQ-CYBMUJFWSA-N 1 2 249.358 2.001 20 0 BEADLO CCc1cc(NC[C@@H]2C[C@H](C)O[C@H]2C)nc[nH+]1 ZINC000665747391 487748873 /nfs/dbraw/zinc/74/88/73/487748873.db2.gz OFBJQJLZXMQUDM-DCAQKATOSA-N 1 2 235.331 2.264 20 0 BEADLO CCN(CC(C)C)C(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000666182725 487749139 /nfs/dbraw/zinc/74/91/39/487749139.db2.gz KBRSXVYJBFHBBY-LLVKDONJSA-N 1 2 249.358 2.019 20 0 BEADLO CCN(CC(C)C)C(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000666182725 487749143 /nfs/dbraw/zinc/74/91/43/487749143.db2.gz KBRSXVYJBFHBBY-LLVKDONJSA-N 1 2 249.358 2.019 20 0 BEADLO CCc1nc(C[NH+]2C3CCCC2CCC3)n[nH]1 ZINC000681209349 487749262 /nfs/dbraw/zinc/74/92/62/487749262.db2.gz IUFPGEASVFSYCD-UHFFFAOYSA-N 1 2 234.347 2.274 20 0 BEADLO Cc1nc(C[NH2+]Cc2conc2C)cs1 ZINC000382326007 487761801 /nfs/dbraw/zinc/76/18/01/487761801.db2.gz VDDANIHBDYOBDD-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO CC[C@H]1[C@H](C)CCN1C(=O)CCCn1cc[nH+]c1 ZINC000681264602 487763534 /nfs/dbraw/zinc/76/35/34/487763534.db2.gz ZFRZRFPFEKDJCE-OLZOCXBDSA-N 1 2 249.358 2.310 20 0 BEADLO CC(=O)CCCC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000681272234 487765630 /nfs/dbraw/zinc/76/56/30/487765630.db2.gz DJEDFVWSHOVMJZ-UHFFFAOYSA-N 1 2 245.282 2.032 20 0 BEADLO COC1([C@H](C)[NH2+]CC(F)(F)C(F)F)CCC1 ZINC000839659686 585333540 /nfs/dbraw/zinc/33/35/40/585333540.db2.gz GNTJEOVJHNKHJW-ZETCQYMHSA-N 1 2 243.244 2.434 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CC[C@H](C)[C@@H](F)C2)[nH+]1 ZINC000679193930 487776843 /nfs/dbraw/zinc/77/68/43/487776843.db2.gz ZEFRGSXYCYFWNU-KWQFWETISA-N 1 2 248.305 2.451 20 0 BEADLO CCC[C@@H]1CCC[C@H]1C(=O)NCCn1cc[nH+]c1 ZINC000294623999 487777968 /nfs/dbraw/zinc/77/79/68/487777968.db2.gz WQZCQDXQTJMDHQ-CHWSQXEVSA-N 1 2 249.358 2.216 20 0 BEADLO Cn1c[nH+]cc1[C@@H]1C[C@H]1C(=O)NCCC(C)(C)C ZINC000666307663 487783148 /nfs/dbraw/zinc/78/31/48/487783148.db2.gz DJCWYEXGRRWRFP-GHMZBOCLSA-N 1 2 249.358 2.076 20 0 BEADLO Cc1cnc(CN2CCCC[C@@H]2c2[nH]cc[nH+]2)o1 ZINC000675893874 487788697 /nfs/dbraw/zinc/78/86/97/487788697.db2.gz UEXIVEKWLQBNDZ-LLVKDONJSA-N 1 2 246.314 2.433 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1nc2ccccc2c(=O)[nH]1 ZINC000684208359 487792611 /nfs/dbraw/zinc/79/26/11/487792611.db2.gz LQLVTRZZGGDTCF-AOOOYVTPSA-N 1 2 243.310 2.318 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1nc2ccccc2c(=O)[nH]1 ZINC000684208359 487792616 /nfs/dbraw/zinc/79/26/16/487792616.db2.gz LQLVTRZZGGDTCF-AOOOYVTPSA-N 1 2 243.310 2.318 20 0 BEADLO Cc1nnsc1CNc1c[nH+]cc(C)c1 ZINC000394732005 487808532 /nfs/dbraw/zinc/80/85/32/487808532.db2.gz SLLUJOJQPYNODU-UHFFFAOYSA-N 1 2 220.301 2.162 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@H](C(C)C)C1CC1 ZINC000666493623 487820370 /nfs/dbraw/zinc/82/03/70/487820370.db2.gz KKRHIIMFYJPBEI-CYBMUJFWSA-N 1 2 247.342 2.368 20 0 BEADLO Cc1nc(C[N@H+](C)CCOc2ccccc2)co1 ZINC000647957003 487820824 /nfs/dbraw/zinc/82/08/24/487820824.db2.gz ZMQRDPGMCSNHAY-UHFFFAOYSA-N 1 2 246.310 2.494 20 0 BEADLO Cc1nc(C[N@@H+](C)CCOc2ccccc2)co1 ZINC000647957003 487820828 /nfs/dbraw/zinc/82/08/28/487820828.db2.gz ZMQRDPGMCSNHAY-UHFFFAOYSA-N 1 2 246.310 2.494 20 0 BEADLO Cc1cc(NC(=O)N[C@@]2(C)CC2(C)C)cc[nH+]1 ZINC000666490216 487820992 /nfs/dbraw/zinc/82/09/92/487820992.db2.gz NFKYAKLBGLSPHI-ZDUSSCGKSA-N 1 2 233.315 2.122 20 0 BEADLO COc1ccc(NCc2cccnc2C)[nH+]c1 ZINC000676201298 487821241 /nfs/dbraw/zinc/82/12/41/487821241.db2.gz OWCPQCWDWYERDJ-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO Cc1ncc([C@H](C)[NH+]2C[C@H](C)O[C@@H](C)C2)c(C)n1 ZINC000681640157 487828600 /nfs/dbraw/zinc/82/86/00/487828600.db2.gz YSZDGJKMXINSSN-NHCYSSNCSA-N 1 2 249.358 2.264 20 0 BEADLO Cn1c(Cl)ncc1C[NH2+]C(C)(C)C(F)F ZINC000848550698 588395752 /nfs/dbraw/zinc/39/57/52/588395752.db2.gz UIWAYZYFABUGSG-UHFFFAOYSA-N 1 2 237.681 2.207 20 0 BEADLO C[N@H+](CCSC(C)(C)C)Cc1cnc[nH]1 ZINC000852288902 588676599 /nfs/dbraw/zinc/67/65/99/588676599.db2.gz VBDVUPWYOGTWHW-UHFFFAOYSA-N 1 2 227.377 2.373 20 0 BEADLO C[N@@H+](CCSC(C)(C)C)Cc1cnc[nH]1 ZINC000852288902 588676600 /nfs/dbraw/zinc/67/66/00/588676600.db2.gz VBDVUPWYOGTWHW-UHFFFAOYSA-N 1 2 227.377 2.373 20 0 BEADLO C[C@@H]1C[N@H+](C/C=C\Cl)C[C@@](C)(C(F)F)O1 ZINC000852781001 588702257 /nfs/dbraw/zinc/70/22/57/588702257.db2.gz QLIZFYUTNJBSMQ-WXBDLOEDSA-N 1 2 239.693 2.483 20 0 BEADLO C[C@@H]1C[N@@H+](C/C=C\Cl)C[C@@](C)(C(F)F)O1 ZINC000852781001 588702258 /nfs/dbraw/zinc/70/22/58/588702258.db2.gz QLIZFYUTNJBSMQ-WXBDLOEDSA-N 1 2 239.693 2.483 20 0 BEADLO CC(C)c1cccc(C(=O)NCc2c[nH+]c[nH]2)c1 ZINC000668995332 487844126 /nfs/dbraw/zinc/84/41/26/487844126.db2.gz LCCCPQNRILCLIM-UHFFFAOYSA-N 1 2 243.310 2.463 20 0 BEADLO CC(C)c1cccc(C(=O)NCc2c[nH]c[nH+]2)c1 ZINC000668995332 487844131 /nfs/dbraw/zinc/84/41/31/487844131.db2.gz LCCCPQNRILCLIM-UHFFFAOYSA-N 1 2 243.310 2.463 20 0 BEADLO CC[N@H+](C)Cc1cccnc1Br ZINC000876561236 590215942 /nfs/dbraw/zinc/21/59/42/590215942.db2.gz OCVYPNPFCYEKMK-UHFFFAOYSA-N 1 2 229.121 2.296 20 0 BEADLO CC[N@@H+](C)Cc1cccnc1Br ZINC000876561236 590215943 /nfs/dbraw/zinc/21/59/43/590215943.db2.gz OCVYPNPFCYEKMK-UHFFFAOYSA-N 1 2 229.121 2.296 20 0 BEADLO CCC[C@H]1C[N@H+](C/C=C\Cl)CCO1 ZINC000255504503 631835516 /nfs/dbraw/zinc/83/55/16/631835516.db2.gz RHHHWYIFSBWWBN-ATPLWMGHSA-N 1 2 203.713 2.240 20 0 BEADLO CCC[C@H]1C[N@@H+](C/C=C\Cl)CCO1 ZINC000255504503 631835519 /nfs/dbraw/zinc/83/55/19/631835519.db2.gz RHHHWYIFSBWWBN-ATPLWMGHSA-N 1 2 203.713 2.240 20 0 BEADLO CCC(C)(CC)C(=O)N[C@@H]1CCn2cc[nH+]c2C1 ZINC000681746480 487851558 /nfs/dbraw/zinc/85/15/58/487851558.db2.gz QDTVWUCLVIPMPD-LLVKDONJSA-N 1 2 249.358 2.140 20 0 BEADLO FCCCCC[N@@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000671241017 487873762 /nfs/dbraw/zinc/87/37/62/487873762.db2.gz PBVGJGDRAWBAPD-VIFPVBQESA-N 1 2 243.244 2.389 20 0 BEADLO FCCCCC[N@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000671241017 487873770 /nfs/dbraw/zinc/87/37/70/487873770.db2.gz PBVGJGDRAWBAPD-VIFPVBQESA-N 1 2 243.244 2.389 20 0 BEADLO Cc1nc(N2CCC2)c(Br)c(C)[nH+]1 ZINC000307055140 487875658 /nfs/dbraw/zinc/87/56/58/487875658.db2.gz YKBSHDZNHARZAG-UHFFFAOYSA-N 1 2 242.120 2.066 20 0 BEADLO Cc1[nH]c(C(=O)NC(C)(C)CC(F)(F)F)c[nH+]1 ZINC000682023756 487880005 /nfs/dbraw/zinc/88/00/05/487880005.db2.gz BTZHEXLDRQCBFF-UHFFFAOYSA-N 1 2 249.236 2.179 20 0 BEADLO CC[C@@H](NC(=O)[C@H]1CC12CCC2)c1[nH]cc[nH+]1 ZINC000682041450 487888317 /nfs/dbraw/zinc/88/83/17/487888317.db2.gz QVOIFWDDZQNQSC-NXEZZACHSA-N 1 2 233.315 2.167 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H](C)c2ccsc2)c[nH+]1 ZINC000669900063 487912343 /nfs/dbraw/zinc/91/23/43/487912343.db2.gz BFAIRORMTCQQDW-ZETCQYMHSA-N 1 2 235.312 2.271 20 0 BEADLO COCc1cc[nH+]c(N[C@H](C)c2cnccn2)c1 ZINC000652331148 487920868 /nfs/dbraw/zinc/92/08/68/487920868.db2.gz ZHXLHAZUHMCOFL-SNVBAGLBSA-N 1 2 244.298 2.191 20 0 BEADLO CCC[C@H](O)CC(=O)Nc1ccc(C)[nH+]c1C ZINC000676759432 487923160 /nfs/dbraw/zinc/92/31/60/487923160.db2.gz WEZWIKHBOZBGGE-NSHDSACASA-N 1 2 236.315 2.188 20 0 BEADLO Cc1cccc(C[N@@H+]2CCc3c[nH]nc3C2)c1 ZINC000676793955 487931269 /nfs/dbraw/zinc/93/12/69/487931269.db2.gz RVYAQZGZCGNYIR-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1cccc(C[N@H+]2CCc3c[nH]nc3C2)c1 ZINC000676793955 487931274 /nfs/dbraw/zinc/93/12/74/487931274.db2.gz RVYAQZGZCGNYIR-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1cccc(C[N@@H+]2CCc3cn[nH]c3C2)c1 ZINC000676793955 487931276 /nfs/dbraw/zinc/93/12/76/487931276.db2.gz RVYAQZGZCGNYIR-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1cccc(C[N@H+]2CCc3cn[nH]c3C2)c1 ZINC000676793955 487931280 /nfs/dbraw/zinc/93/12/80/487931280.db2.gz RVYAQZGZCGNYIR-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1nc(C(C)(C)[NH2+]Cc2ccc(O)cc2)no1 ZINC000682405558 487949709 /nfs/dbraw/zinc/94/97/09/487949709.db2.gz AKNJMHRZUXWBEF-UHFFFAOYSA-N 1 2 247.298 2.109 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CC[C@H]2C[C@H]2C1)c1[nH]cc[nH+]1 ZINC000569624111 322999765 /nfs/dbraw/zinc/99/97/65/322999765.db2.gz RDZIZZSOOKLSCF-YTWAJWBKSA-N 1 2 233.315 2.023 20 0 BEADLO Cc1c[nH+]c(C)nc1NC[C@@]1(C)CCCS1 ZINC000566485069 323001538 /nfs/dbraw/zinc/00/15/38/323001538.db2.gz XQLKQHURNAQOLL-GFCCVEGCSA-N 1 2 237.372 2.213 20 0 BEADLO COCC1(Nc2nc(C)[nH+]c3c2CCCC3)CC1 ZINC000562246171 323013730 /nfs/dbraw/zinc/01/37/30/323013730.db2.gz FXLLPAOOMKAFSL-UHFFFAOYSA-N 1 2 247.342 2.255 20 0 BEADLO Cc1cc(NC(=O)N2CC[C@@H]2C2CC2)c(C)c[nH+]1 ZINC000562596054 323025405 /nfs/dbraw/zinc/02/54/05/323025405.db2.gz AVBBUPTVDWNOBY-CYBMUJFWSA-N 1 2 245.326 2.137 20 0 BEADLO C=Cn1cc(C[NH2+]Cc2ccn(C(C)C)n2)cn1 ZINC000562613401 323025482 /nfs/dbraw/zinc/02/54/82/323025482.db2.gz BSZTUFQCOJJPRD-UHFFFAOYSA-N 1 2 245.330 2.051 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NCC1CCCCCC1 ZINC000562763740 323030119 /nfs/dbraw/zinc/03/01/19/323030119.db2.gz FJKPHBAPNDDHTE-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NCC1CCCCCC1 ZINC000562763740 323030120 /nfs/dbraw/zinc/03/01/20/323030120.db2.gz FJKPHBAPNDDHTE-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO CC1CC(C(=O)Nc2c[nH+]c3n2CCCC3)C1 ZINC000569676233 323036502 /nfs/dbraw/zinc/03/65/02/323036502.db2.gz NKKVPFICIXJMKC-UHFFFAOYSA-N 1 2 233.315 2.204 20 0 BEADLO CCn1cc[nH+]c1CN1CC2(CCC2(F)F)C1 ZINC000569774541 323040320 /nfs/dbraw/zinc/04/03/20/323040320.db2.gz OABZCZAKOJDADW-UHFFFAOYSA-N 1 2 241.285 2.134 20 0 BEADLO CC(C)[C@@H](C)N(C)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000569814435 323041368 /nfs/dbraw/zinc/04/13/68/323041368.db2.gz XEWYYMDDFKINCK-NWDGAFQWSA-N 1 2 237.347 2.337 20 0 BEADLO C[C@H](CC(=O)N1[C@H](C)CC[C@H]1C)n1cc[nH+]c1 ZINC000570048438 323048207 /nfs/dbraw/zinc/04/82/07/323048207.db2.gz VFUIDAWOLYTERJ-IJLUTSLNSA-N 1 2 235.331 2.234 20 0 BEADLO CCc1ccc(C[N@H+]2CCN(C)C[C@H]2CC)nc1 ZINC000570391569 323058254 /nfs/dbraw/zinc/05/82/54/323058254.db2.gz BCWOBADPOZKASD-OAHLLOKOSA-N 1 2 247.386 2.170 20 0 BEADLO CCc1ccc(C[N@@H+]2CCN(C)C[C@H]2CC)nc1 ZINC000570391569 323058255 /nfs/dbraw/zinc/05/82/55/323058255.db2.gz BCWOBADPOZKASD-OAHLLOKOSA-N 1 2 247.386 2.170 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@]1(C)CC=CCC1 ZINC000570460350 323060374 /nfs/dbraw/zinc/06/03/74/323060374.db2.gz SEHBLGVHILZSQL-BXUZGUMPSA-N 1 2 247.342 2.203 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@]1(C)CC=CCC1 ZINC000570460350 323060375 /nfs/dbraw/zinc/06/03/75/323060375.db2.gz SEHBLGVHILZSQL-BXUZGUMPSA-N 1 2 247.342 2.203 20 0 BEADLO COc1ccc(C[N@@H+]2CCC[C@@H](F)C2)cn1 ZINC000570689875 323067312 /nfs/dbraw/zinc/06/73/12/323067312.db2.gz YFIPTDVZKXGXLY-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO COc1ccc(C[N@H+]2CCC[C@@H](F)C2)cn1 ZINC000570689875 323067313 /nfs/dbraw/zinc/06/73/13/323067313.db2.gz YFIPTDVZKXGXLY-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2cccc(O)c2)o1 ZINC000181542922 323079012 /nfs/dbraw/zinc/07/90/12/323079012.db2.gz HTLYEHQNZFDMBL-IUCAKERBSA-N 1 2 247.298 2.495 20 0 BEADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2cccc(O)c2)o1 ZINC000181542954 323079050 /nfs/dbraw/zinc/07/90/50/323079050.db2.gz HTLYEHQNZFDMBL-BDAKNGLRSA-N 1 2 247.298 2.495 20 0 BEADLO CCc1cc(N2Cc3cccnc3C2)nc(C)[nH+]1 ZINC000563019578 323080068 /nfs/dbraw/zinc/08/00/68/323080068.db2.gz ILUALSZEALSTJG-UHFFFAOYSA-N 1 2 240.310 2.263 20 0 BEADLO C[C@@H]1CCCC[C@@H]1CC(=O)NCCc1[nH]cc[nH+]1 ZINC000531287295 323087034 /nfs/dbraw/zinc/08/70/34/323087034.db2.gz QIBSJHMMRAFJIO-VXGBXAGGSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H]1CCCC[C@@H]1CC(=O)NCCc1[nH]cc[nH+]1 ZINC000531287293 323087055 /nfs/dbraw/zinc/08/70/55/323087055.db2.gz QIBSJHMMRAFJIO-NWDGAFQWSA-N 1 2 249.358 2.285 20 0 BEADLO CC(C)n1ccc(C[NH2+][C@H](C)c2ccnn2C)n1 ZINC000571030588 323103985 /nfs/dbraw/zinc/10/39/85/323103985.db2.gz TVCPTCNIKQDJEP-LLVKDONJSA-N 1 2 247.346 2.048 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)c2cc[nH]c2C)[nH+]1 ZINC000563284879 323108316 /nfs/dbraw/zinc/10/83/16/323108316.db2.gz CIYKVDWYKYZQRO-UHFFFAOYSA-N 1 2 246.314 2.020 20 0 BEADLO Cc1ccc(C(=O)Nc2ccc[nH+]c2N(C)C)o1 ZINC000047976458 323113043 /nfs/dbraw/zinc/11/30/43/323113043.db2.gz YXHKWBCDFAWTIH-UHFFFAOYSA-N 1 2 245.282 2.301 20 0 BEADLO CCC1(C(=O)N2CC(n3cc[nH+]c3)C2)CCCC1 ZINC000531790623 323113415 /nfs/dbraw/zinc/11/34/15/323113415.db2.gz MMYAZMFTACQZSH-UHFFFAOYSA-N 1 2 247.342 2.237 20 0 BEADLO Cc1cc(NC(=O)Cc2ccsc2)c(C)c[nH+]1 ZINC000534299873 323115855 /nfs/dbraw/zinc/11/58/55/323115855.db2.gz HGWTXBCOGMXOTR-UHFFFAOYSA-N 1 2 246.335 2.363 20 0 BEADLO Cc1nsc(C)c1C[N@H+]1CCO[C@H](C)[C@H]1C ZINC000563350743 323120045 /nfs/dbraw/zinc/12/00/45/323120045.db2.gz QHGCUBJGCVOMIR-NXEZZACHSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nsc(C)c1C[N@@H+]1CCO[C@H](C)[C@H]1C ZINC000563350743 323120046 /nfs/dbraw/zinc/12/00/46/323120046.db2.gz QHGCUBJGCVOMIR-NXEZZACHSA-N 1 2 240.372 2.369 20 0 BEADLO CC(C)CN(C(=O)[C@@H](C)Cc1c[nH+]c[nH]1)C1CC1 ZINC000563372091 323121772 /nfs/dbraw/zinc/12/17/72/323121772.db2.gz UVTIKYLRNJWAJB-NSHDSACASA-N 1 2 249.358 2.235 20 0 BEADLO CC(C)CN(C(=O)[C@@H](C)Cc1c[nH]c[nH+]1)C1CC1 ZINC000563372091 323121773 /nfs/dbraw/zinc/12/17/73/323121773.db2.gz UVTIKYLRNJWAJB-NSHDSACASA-N 1 2 249.358 2.235 20 0 BEADLO CCn1cc[nH+]c1CNc1cn(C)nc1C(C)C ZINC000310640325 323133744 /nfs/dbraw/zinc/13/37/44/323133744.db2.gz BBKFXUSSXJYTQF-UHFFFAOYSA-N 1 2 247.346 2.372 20 0 BEADLO Cc1[nH]c(CN[C@@H](C)C(C)(F)F)[nH+]c1C ZINC000571106526 323135791 /nfs/dbraw/zinc/13/57/91/323135791.db2.gz JEYAHUAOLXESBX-QMMMGPOBSA-N 1 2 217.263 2.160 20 0 BEADLO FC1C[NH+](CC2Cc3ccccc3C2)C1 ZINC000571131610 323136107 /nfs/dbraw/zinc/13/61/07/323136107.db2.gz DTOLECNDOYZWQQ-UHFFFAOYSA-N 1 2 205.276 2.055 20 0 BEADLO C[NH2+]Cc1noc(Cc2cccc(C3CC3)c2)n1 ZINC000571413232 323144244 /nfs/dbraw/zinc/14/42/44/323144244.db2.gz PIJQNSRBGLCJLH-UHFFFAOYSA-N 1 2 243.310 2.257 20 0 BEADLO CCCN(CCC)C(=O)[C@H]1CCc2c[nH+]cn2C1 ZINC000571469627 323145752 /nfs/dbraw/zinc/14/57/52/323145752.db2.gz CMTYTDRYIXVJIW-LBPRGKRZSA-N 1 2 249.358 2.094 20 0 BEADLO Cc1ccnc(C[NH+]2CCC(OC(C)C)CC2)n1 ZINC000534470505 323152671 /nfs/dbraw/zinc/15/26/71/323152671.db2.gz QCRYMAPETCWVEM-UHFFFAOYSA-N 1 2 249.358 2.174 20 0 BEADLO Cc1cc(NC(=O)N2C3CCC2CC3)c(C)c[nH+]1 ZINC000535061283 323164952 /nfs/dbraw/zinc/16/49/52/323164952.db2.gz XQBXPMDFCLLACP-UHFFFAOYSA-N 1 2 245.326 2.279 20 0 BEADLO CC[C@]1(C)C[C@H]1C(=O)NCCCCn1cc[nH+]c1 ZINC000532069483 323171323 /nfs/dbraw/zinc/17/13/23/323171323.db2.gz HJQXOIXYHDGMLF-GXTWGEPZSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1cc(C(=O)Nc2ccc(C)[nH+]c2C)ncn1 ZINC000535435282 323172997 /nfs/dbraw/zinc/17/29/97/323172997.db2.gz ISSRQGJTPRRSRP-UHFFFAOYSA-N 1 2 242.282 2.049 20 0 BEADLO CCC[C@H]([NH2+]CCOC(C)(C)C)C(=O)OCC ZINC000308594749 323176092 /nfs/dbraw/zinc/17/60/92/323176092.db2.gz XVQGBKQJWHUIJN-NSHDSACASA-N 1 2 245.363 2.123 20 0 BEADLO CCCC[C@H]([NH2+]CCOC(C)(C)C)C(=O)OC ZINC000308595079 323176129 /nfs/dbraw/zinc/17/61/29/323176129.db2.gz YHPPSKLLCZKCQP-NSHDSACASA-N 1 2 245.363 2.123 20 0 BEADLO CC(=O)c1cc(C[N@H+]2CC=C(C)CC2)on1 ZINC000563852950 323180923 /nfs/dbraw/zinc/18/09/23/323180923.db2.gz WRWPJTKWDDSBTN-UHFFFAOYSA-N 1 2 220.272 2.029 20 0 BEADLO CC(=O)c1cc(C[N@@H+]2CC=C(C)CC2)on1 ZINC000563852950 323180924 /nfs/dbraw/zinc/18/09/24/323180924.db2.gz WRWPJTKWDDSBTN-UHFFFAOYSA-N 1 2 220.272 2.029 20 0 BEADLO Cc1nc(C)c(CNc2c[nH]c[nH+]2)s1 ZINC000307454017 323181887 /nfs/dbraw/zinc/18/18/87/323181887.db2.gz VZGPESAHAHOMND-UHFFFAOYSA-N 1 2 208.290 2.095 20 0 BEADLO CC[C@@]1(C)C[C@@H]1C(=O)Nc1cc(C)[nH+]cc1C ZINC000535748094 323190187 /nfs/dbraw/zinc/19/01/87/323190187.db2.gz VAMNQZSGZNPHIT-RISCZKNCSA-N 1 2 232.327 2.495 20 0 BEADLO Cc1cc(NC(=O)C(C2CC2)C2CC2)c(C)c[nH+]1 ZINC000535748398 323190297 /nfs/dbraw/zinc/19/02/97/323190297.db2.gz JWHQSAKZVGOBCZ-UHFFFAOYSA-N 1 2 244.338 2.495 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2CC=CCC2)c(C)c[nH+]1 ZINC000535772999 323190838 /nfs/dbraw/zinc/19/08/38/323190838.db2.gz ZMZWIFHNMSPSOX-GFCCVEGCSA-N 1 2 245.326 2.351 20 0 BEADLO Cc1cc(NC(=O)NC2CC(C)C2)c(C)c[nH+]1 ZINC000535772607 323190881 /nfs/dbraw/zinc/19/08/81/323190881.db2.gz JQGRTVRHHCJTFK-UHFFFAOYSA-N 1 2 233.315 2.040 20 0 BEADLO Cc1cc(NC(=O)N2C[C@H](C)[C@@H](C)C2)c(C)c[nH+]1 ZINC000535773614 323190915 /nfs/dbraw/zinc/19/09/15/323190915.db2.gz XYSUFSLRADZNSE-QWRGUYRKSA-N 1 2 247.342 2.240 20 0 BEADLO Cc1[nH]c(C(=O)NCCCc2cccs2)c[nH+]1 ZINC000535851318 323193670 /nfs/dbraw/zinc/19/36/70/323193670.db2.gz SLVMFRKORZWWFT-UHFFFAOYSA-N 1 2 249.339 2.142 20 0 BEADLO Cn1ccc(C[NH2+]Cc2cnc(C3CC3)s2)n1 ZINC000536552503 323197075 /nfs/dbraw/zinc/19/70/75/323197075.db2.gz BETFZQIWUVQZOK-UHFFFAOYSA-N 1 2 248.355 2.044 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2C[C@H]2C2CC2)c(C)c[nH+]1 ZINC000536574323 323197958 /nfs/dbraw/zinc/19/79/58/323197958.db2.gz BNYWAXLZRNUDCM-NWDGAFQWSA-N 1 2 230.311 2.105 20 0 BEADLO CCC(CC)NC(=O)Nc1cc(C)[nH+]cc1C ZINC000536620558 323198862 /nfs/dbraw/zinc/19/88/62/323198862.db2.gz TXRJNYVOMKLMDX-UHFFFAOYSA-N 1 2 235.331 2.430 20 0 BEADLO CCC(CC)CC(=O)N1CC(n2cc[nH+]c2)C1 ZINC000532342671 323253656 /nfs/dbraw/zinc/25/36/56/323253656.db2.gz WWVSPDQRVHICAA-UHFFFAOYSA-N 1 2 235.331 2.093 20 0 BEADLO CC(C)c1nc(N2[C@H](C)C[C@H]2C)nc(N(C)C)[nH+]1 ZINC000530379575 323383670 /nfs/dbraw/zinc/38/36/70/323383670.db2.gz HTTVFHVPEWXUQU-NXEZZACHSA-N 1 2 249.362 2.048 20 0 BEADLO C[C@H](CC(=O)N[C@H]1C=CCCC1)n1cc[nH+]c1 ZINC000571686600 323458192 /nfs/dbraw/zinc/45/81/92/323458192.db2.gz DIEGKNMUTBBXRZ-NEPJUHHUSA-N 1 2 233.315 2.059 20 0 BEADLO COc1ccc[nH+]c1N1CC[C@H](C)[C@H]1C ZINC000527909560 323718972 /nfs/dbraw/zinc/71/89/72/323718972.db2.gz CBCKRFMIAPAWRJ-VHSXEESVSA-N 1 2 206.289 2.325 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ncccc1F)c1cnccn1 ZINC000528035973 323744019 /nfs/dbraw/zinc/74/40/19/323744019.db2.gz NBBKBPPEEIAZTJ-UWVGGRQHSA-N 1 2 246.289 2.423 20 0 BEADLO COc1ccc[nH+]c1N1C[C@@H](C)OC2(CCC2)C1 ZINC000528038650 323745212 /nfs/dbraw/zinc/74/52/12/323745212.db2.gz ATUWSTXZQVKYNS-LLVKDONJSA-N 1 2 248.326 2.238 20 0 BEADLO CC[NH+](CC)Cc1nc([C@@H]2CC[C@@H](C)O2)no1 ZINC000528234469 323790706 /nfs/dbraw/zinc/79/07/06/323790706.db2.gz KMWYRVRMLSWLAT-ZJUUUORDSA-N 1 2 239.319 2.151 20 0 BEADLO CC(C)c1nc(N2CCC[C@H]([C@@H](C)O)C2)cc[nH+]1 ZINC000120151994 323979636 /nfs/dbraw/zinc/97/96/36/323979636.db2.gz PKVROEUTVWEYKJ-NEPJUHHUSA-N 1 2 249.358 2.197 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000572595547 324136704 /nfs/dbraw/zinc/13/67/04/324136704.db2.gz LVVYYWOPMVNSIX-YPMHNXCESA-N 1 2 247.342 2.093 20 0 BEADLO Cc1cc(NC(=O)NCC2CC=CC2)c(C)c[nH+]1 ZINC000529041881 324237582 /nfs/dbraw/zinc/23/75/82/324237582.db2.gz QOZQFTOQSNBTKM-UHFFFAOYSA-N 1 2 245.326 2.208 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CCCC12CC2)c1[nH]cc[nH+]1 ZINC000529414249 324290002 /nfs/dbraw/zinc/29/00/02/324290002.db2.gz TUCXESPAZRQDDF-ZJUUUORDSA-N 1 2 233.315 2.167 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@@H]1CCCC12CC2 ZINC000529448931 324301531 /nfs/dbraw/zinc/30/15/31/324301531.db2.gz WKWPVCBQDIWKGH-NSHDSACASA-N 1 2 247.342 2.100 20 0 BEADLO C[C@@H]1C[C@H]([NH2+]Cc2ccc(F)cn2)c2nccn21 ZINC000529594662 324357068 /nfs/dbraw/zinc/35/70/68/324357068.db2.gz FGGISTXTAFRXJM-SKDRFNHKSA-N 1 2 246.289 2.213 20 0 BEADLO CC(C)Cn1ncnc1C[NH+]1C2CCC1CC2 ZINC000538703340 324727324 /nfs/dbraw/zinc/72/73/24/324727324.db2.gz FLQDOCQEFQDAOO-UHFFFAOYSA-N 1 2 234.347 2.061 20 0 BEADLO c1ncc(CNc2c[nH+]c3c(c2)CCCC3)cn1 ZINC000542924523 325063433 /nfs/dbraw/zinc/06/34/33/325063433.db2.gz KISKSGOZOQFLQW-UHFFFAOYSA-N 1 2 240.310 2.363 20 0 BEADLO Cn1c[nH+]cc1Cc1noc(/C=C\C2CCC2)n1 ZINC000545843791 325239789 /nfs/dbraw/zinc/23/97/89/325239789.db2.gz PIAFLCFXYRZSBL-WAYWQWQTSA-N 1 2 244.298 2.207 20 0 BEADLO CCc1csc(NCCc2ccc(C)[nH+]c2)n1 ZINC000547471004 325359816 /nfs/dbraw/zinc/35/98/16/325359816.db2.gz WHAYWFWZJSZTRP-UHFFFAOYSA-N 1 2 247.367 2.485 20 0 BEADLO O=C(CCC1CCCCC1)NCCc1[nH]cc[nH+]1 ZINC000134499968 325361822 /nfs/dbraw/zinc/36/18/22/325361822.db2.gz RJHGKQNUNYUCIB-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO Cc1nnc(C[NH2+]Cc2ccc(Cl)o2)s1 ZINC000134663773 325370557 /nfs/dbraw/zinc/37/05/57/325370557.db2.gz CWRRLZXKFZDPAM-UHFFFAOYSA-N 1 2 243.719 2.383 20 0 BEADLO CCc1cc(C[NH2+]Cc2conc2CC)on1 ZINC000550156269 325524931 /nfs/dbraw/zinc/52/49/31/325524931.db2.gz PMHOZAMHVMYBLV-UHFFFAOYSA-N 1 2 235.287 2.077 20 0 BEADLO C[C@H]([NH2+]Cc1cc[nH]n1)c1nc2c(s1)CCC2 ZINC000551933446 325575097 /nfs/dbraw/zinc/57/50/97/325575097.db2.gz URNJSCKASOAORG-QMMMGPOBSA-N 1 2 248.355 2.206 20 0 BEADLO CCc1ccc(C[NH2+]Cc2ncccc2F)cn1 ZINC000552167555 325602717 /nfs/dbraw/zinc/60/27/17/325602717.db2.gz ZIUOCTPDLOUBND-UHFFFAOYSA-N 1 2 245.301 2.468 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H]2CSC[C@H]2C)[nH+]1 ZINC000553678514 325697727 /nfs/dbraw/zinc/69/77/27/325697727.db2.gz FCANZMWCOYSCDD-GMSGAONNSA-N 1 2 248.355 2.430 20 0 BEADLO CC1(C)CC[C@@H](C[N@@H+]2Cc3cccnc3C2)O1 ZINC000566138515 326001905 /nfs/dbraw/zinc/00/19/05/326001905.db2.gz HJQWMEJNSZMDHP-LBPRGKRZSA-N 1 2 232.327 2.355 20 0 BEADLO CC1(C)CC[C@@H](C[N@H+]2Cc3cccnc3C2)O1 ZINC000566138515 326001907 /nfs/dbraw/zinc/00/19/07/326001907.db2.gz HJQWMEJNSZMDHP-LBPRGKRZSA-N 1 2 232.327 2.355 20 0 BEADLO CC(C)Cn1cc(C[N@@H+]2CCC[C@H](F)C2)cn1 ZINC000566353909 326036263 /nfs/dbraw/zinc/03/62/63/326036263.db2.gz MTEKYSPFWGATMT-ZDUSSCGKSA-N 1 2 239.338 2.473 20 0 BEADLO CC(C)Cn1cc(C[N@H+]2CCC[C@H](F)C2)cn1 ZINC000566353909 326036264 /nfs/dbraw/zinc/03/62/64/326036264.db2.gz MTEKYSPFWGATMT-ZDUSSCGKSA-N 1 2 239.338 2.473 20 0 BEADLO CC(C)(NC(=O)[C@H]1[C@@H]2CCCC[C@@H]21)c1[nH]cc[nH+]1 ZINC000566363677 326037581 /nfs/dbraw/zinc/03/75/81/326037581.db2.gz RQQDDTZUXBMVHQ-URLYPYJESA-N 1 2 247.342 2.197 20 0 BEADLO O=C1CC[N@H+](Cc2ccncc2)C2(CCC2)C1 ZINC000566428651 326045040 /nfs/dbraw/zinc/04/50/40/326045040.db2.gz JEOHVVVAQWZDED-UHFFFAOYSA-N 1 2 230.311 2.169 20 0 BEADLO O=C1CC[N@@H+](Cc2ccncc2)C2(CCC2)C1 ZINC000566428651 326045042 /nfs/dbraw/zinc/04/50/42/326045042.db2.gz JEOHVVVAQWZDED-UHFFFAOYSA-N 1 2 230.311 2.169 20 0 BEADLO Cc1ccccc1[C@H](C)[N@@H+]1CCn2nncc2C1 ZINC000566430407 326045693 /nfs/dbraw/zinc/04/56/93/326045693.db2.gz RHHFKSONNZYGQR-LBPRGKRZSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1ccccc1[C@H](C)[N@H+]1CCn2nncc2C1 ZINC000566430407 326045695 /nfs/dbraw/zinc/04/56/95/326045695.db2.gz RHHFKSONNZYGQR-LBPRGKRZSA-N 1 2 242.326 2.163 20 0 BEADLO CCN(CC(C)C)C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000566432992 326046358 /nfs/dbraw/zinc/04/63/58/326046358.db2.gz NPXRTAZYPYALBJ-NSHDSACASA-N 1 2 237.347 2.093 20 0 BEADLO CCN(CC(C)C)C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000566432992 326046361 /nfs/dbraw/zinc/04/63/61/326046361.db2.gz NPXRTAZYPYALBJ-NSHDSACASA-N 1 2 237.347 2.093 20 0 BEADLO CCN(CC(C)C)C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000566432991 326046373 /nfs/dbraw/zinc/04/63/73/326046373.db2.gz NPXRTAZYPYALBJ-LLVKDONJSA-N 1 2 237.347 2.093 20 0 BEADLO CCN(CC(C)C)C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000566432991 326046375 /nfs/dbraw/zinc/04/63/75/326046375.db2.gz NPXRTAZYPYALBJ-LLVKDONJSA-N 1 2 237.347 2.093 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1C[C@H](C)CC[C@H]1C ZINC000566444563 326048378 /nfs/dbraw/zinc/04/83/78/326048378.db2.gz HXNRVTNMNSBVHW-GRYCIOLGSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1C[C@H](C)CC[C@H]1C ZINC000566444563 326048380 /nfs/dbraw/zinc/04/83/80/326048380.db2.gz HXNRVTNMNSBVHW-GRYCIOLGSA-N 1 2 249.358 2.235 20 0 BEADLO Cc1c[nH+]c(C)nc1N1C[C@@H](C)[C@H](C)C1 ZINC000566478421 326055403 /nfs/dbraw/zinc/05/54/03/326055403.db2.gz GIFIUKNCGUFZHI-NXEZZACHSA-N 1 2 205.305 2.186 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1C[C@H]2OCCC[C@H]12 ZINC000566484920 326057129 /nfs/dbraw/zinc/05/71/29/326057129.db2.gz UAGJJNRIGALENN-IJLUTSLNSA-N 1 2 233.315 2.073 20 0 BEADLO Cc1[nH]c(CNCc2ccnc(C)c2)[nH+]c1C ZINC000566499311 326059045 /nfs/dbraw/zinc/05/90/45/326059045.db2.gz PMXCJMZXYNTMDJ-UHFFFAOYSA-N 1 2 230.315 2.020 20 0 BEADLO c1nnc([C@@H]([NH2+][C@H]2CC23CC3)c2ccccc2)[nH]1 ZINC000566614720 326067729 /nfs/dbraw/zinc/06/77/29/326067729.db2.gz KTDFIDALVMHCEA-RYUDHWBXSA-N 1 2 240.310 2.036 20 0 BEADLO CC(C)[C@@H]1CCN(C(=O)[C@@H](C)Cc2c[nH+]c[nH]2)C1 ZINC000567288461 326156339 /nfs/dbraw/zinc/15/63/39/326156339.db2.gz PWBUDCGVFKXSKT-NWDGAFQWSA-N 1 2 249.358 2.093 20 0 BEADLO CC(C)[C@@H]1CCN(C(=O)[C@@H](C)Cc2c[nH]c[nH+]2)C1 ZINC000567288461 326156341 /nfs/dbraw/zinc/15/63/41/326156341.db2.gz PWBUDCGVFKXSKT-NWDGAFQWSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1cc([NH2+]C[C@H]2C[C@@H]2C)ccc1-n1cnnn1 ZINC000567302526 326159100 /nfs/dbraw/zinc/15/91/00/326159100.db2.gz ODGDXJQYRDRJBU-GXSJLCMTSA-N 1 2 243.314 2.039 20 0 BEADLO COc1ccc[nH+]c1NCc1ccn(C)c1 ZINC000309883511 326173028 /nfs/dbraw/zinc/17/30/28/326173028.db2.gz WWSJEMAFDPJBMQ-UHFFFAOYSA-N 1 2 217.272 2.041 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CCO[C@H](C)[C@@H]1C ZINC000155957010 326216040 /nfs/dbraw/zinc/21/60/40/326216040.db2.gz FZSDLRLXMSWISA-NWDGAFQWSA-N 1 2 237.347 2.073 20 0 BEADLO Cc1ncc(C[NH2+][C@H](C)c2cscn2)cn1 ZINC000567627869 326232395 /nfs/dbraw/zinc/23/23/95/326232395.db2.gz CLOPJPSQEAICQK-MRVPVSSYSA-N 1 2 234.328 2.092 20 0 BEADLO Cc1cccn2cc(CNC(=O)C3(C)CC3)[nH+]c12 ZINC000156732275 326241064 /nfs/dbraw/zinc/24/10/64/326241064.db2.gz JWHHRRODCHVTCH-UHFFFAOYSA-N 1 2 243.310 2.059 20 0 BEADLO CC1(C)CC[C@@H]1NC(=O)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000567772362 326256845 /nfs/dbraw/zinc/25/68/45/326256845.db2.gz AHGHFVGQTGHJES-ONGXEEELSA-N 1 2 247.342 2.134 20 0 BEADLO CC1(C)CC[C@@H]1NC(=O)[C@H]1CCCc2[nH]c[nH+]c21 ZINC000567772362 326256846 /nfs/dbraw/zinc/25/68/46/326256846.db2.gz AHGHFVGQTGHJES-ONGXEEELSA-N 1 2 247.342 2.134 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)NCC(C)C)ccn12 ZINC000568184681 326322505 /nfs/dbraw/zinc/32/25/05/326322505.db2.gz DYZBJKJVAKZJEF-UHFFFAOYSA-N 1 2 231.299 2.029 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N(C)CC3CC3)ccn12 ZINC000568193286 326324387 /nfs/dbraw/zinc/32/43/87/326324387.db2.gz FCJDRZOHJNGYSW-UHFFFAOYSA-N 1 2 243.310 2.125 20 0 BEADLO CCC(C)(C)CNC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000568205153 326325892 /nfs/dbraw/zinc/32/58/92/326325892.db2.gz FWXOMUSIAJPEGE-JTQLQIEISA-N 1 2 237.347 2.141 20 0 BEADLO CCC(C)(C)CNC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000568205153 326325895 /nfs/dbraw/zinc/32/58/95/326325895.db2.gz FWXOMUSIAJPEGE-JTQLQIEISA-N 1 2 237.347 2.141 20 0 BEADLO CCc1nc(C)c(CNCc2[nH]c(C)c(C)[nH+]2)o1 ZINC000568272922 326338864 /nfs/dbraw/zinc/33/88/64/326338864.db2.gz DDNKQOKXBRMMRW-UHFFFAOYSA-N 1 2 248.330 2.175 20 0 BEADLO CC[C@@H]1C[C@@H](C)CN1C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000568519453 326362113 /nfs/dbraw/zinc/36/21/13/326362113.db2.gz GTGFDYRQNVCJCP-JHJVBQTASA-N 1 2 249.358 2.481 20 0 BEADLO Cc1noc(C)c1NC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000568752259 326374943 /nfs/dbraw/zinc/37/49/43/326374943.db2.gz CTSSDIARAXNRPC-QMMMGPOBSA-N 1 2 248.286 2.078 20 0 BEADLO Oc1cc(F)cc(C[N@@H+]2CCC[C@@H](F)C2)c1 ZINC000568757486 326375344 /nfs/dbraw/zinc/37/53/44/326375344.db2.gz KLWYENVGPGLGBV-SNVBAGLBSA-N 1 2 227.254 2.465 20 0 BEADLO Oc1cc(F)cc(C[N@H+]2CCC[C@@H](F)C2)c1 ZINC000568757486 326375346 /nfs/dbraw/zinc/37/53/46/326375346.db2.gz KLWYENVGPGLGBV-SNVBAGLBSA-N 1 2 227.254 2.465 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NCCC1=CCCC1 ZINC000568880512 326380886 /nfs/dbraw/zinc/38/08/86/326380886.db2.gz LMMKMMSCEISFAN-LLVKDONJSA-N 1 2 247.342 2.205 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NCCC1=CCCC1 ZINC000568880512 326380888 /nfs/dbraw/zinc/38/08/88/326380888.db2.gz LMMKMMSCEISFAN-LLVKDONJSA-N 1 2 247.342 2.205 20 0 BEADLO Clc1ccc2[nH+]cc(CNc3c[nH]cn3)n2c1 ZINC000569044682 326387660 /nfs/dbraw/zinc/38/76/60/326387660.db2.gz MCHPUCLLFFJPHS-UHFFFAOYSA-N 1 2 247.689 2.323 20 0 BEADLO C[C@H](CC(=O)NC[C@H]1CCC[C@H]1C)n1cc[nH+]c1 ZINC000573123163 326430992 /nfs/dbraw/zinc/43/09/92/326430992.db2.gz BROHGNZUFAXQQM-JHJVBQTASA-N 1 2 249.358 2.387 20 0 BEADLO CCn1cc(C[N@H+](C)Cc2ccc(F)cn2)cn1 ZINC000682527412 487976652 /nfs/dbraw/zinc/97/66/52/487976652.db2.gz QBBXMFVPRJUELE-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO CCn1cc(C[N@@H+](C)Cc2ccc(F)cn2)cn1 ZINC000682527412 487976656 /nfs/dbraw/zinc/97/66/56/487976656.db2.gz QBBXMFVPRJUELE-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO Cc1cc(N[C@H](c2[nH]cc[nH+]2)C(C)C)ncn1 ZINC000670818210 487979647 /nfs/dbraw/zinc/97/96/47/487979647.db2.gz VJSYYCHHKYKYMA-NSHDSACASA-N 1 2 231.303 2.317 20 0 BEADLO CC1=CC[C@](C)(C(=O)NCCn2cc[nH+]c2)CC1 ZINC000666353229 487984286 /nfs/dbraw/zinc/98/42/86/487984286.db2.gz QEPKBYFDALVFRK-AWEZNQCLSA-N 1 2 247.342 2.136 20 0 BEADLO O[C@@H]1C[N@H+](CCC2CCCC2)CC(F)(F)C1 ZINC000682548867 487986945 /nfs/dbraw/zinc/98/69/45/487986945.db2.gz RQYOMPIYHHZGOR-NSHDSACASA-N 1 2 233.302 2.269 20 0 BEADLO O[C@@H]1C[N@@H+](CCC2CCCC2)CC(F)(F)C1 ZINC000682548867 487986949 /nfs/dbraw/zinc/98/69/49/487986949.db2.gz RQYOMPIYHHZGOR-NSHDSACASA-N 1 2 233.302 2.269 20 0 BEADLO CC/C=C\CNC(=O)Nc1cc(C)[nH+]cc1C ZINC000652797764 487988035 /nfs/dbraw/zinc/98/80/35/487988035.db2.gz AWICXUAJXOGDIP-WAYWQWQTSA-N 1 2 233.315 2.208 20 0 BEADLO CCc1cc(NC[C@H]2CCOC[C@@H]2C)nc[nH+]1 ZINC000672329359 487997581 /nfs/dbraw/zinc/99/75/81/487997581.db2.gz BCDLDBZTHNIOFR-WDEREUQCSA-N 1 2 235.331 2.124 20 0 BEADLO CCC[C@H](CC)NC(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000667423348 488000268 /nfs/dbraw/zinc/00/02/68/488000268.db2.gz MQQUZTJWSGWNHO-QJPTWQEYSA-N 1 2 249.358 2.219 20 0 BEADLO CC1(C)CN(Cc2[nH]cc[nH+]2)[C@H]1c1cccnc1 ZINC000644835433 488000845 /nfs/dbraw/zinc/00/08/45/488000845.db2.gz ZKXMKCIVOORYQX-ZDUSSCGKSA-N 1 2 242.326 2.388 20 0 BEADLO CCC[C@H](CC)NC(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000667423585 488000901 /nfs/dbraw/zinc/00/09/01/488000901.db2.gz QHIMPFSONRYPBS-MNOVXSKESA-N 1 2 249.358 2.210 20 0 BEADLO CCC[C@H](CC)NC(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000667423585 488000905 /nfs/dbraw/zinc/00/09/05/488000905.db2.gz QHIMPFSONRYPBS-MNOVXSKESA-N 1 2 249.358 2.210 20 0 BEADLO CC(C)(C)c1nc(N[C@@H](CO)CC2CC2)cc[nH+]1 ZINC000677237081 488004127 /nfs/dbraw/zinc/00/41/27/488004127.db2.gz OAXQVEITMMDNKV-LLVKDONJSA-N 1 2 249.358 2.347 20 0 BEADLO Cc1nc2[nH]ccc2c(N(C)[C@H]2CCSC2)[nH+]1 ZINC000677310476 488012465 /nfs/dbraw/zinc/01/24/65/488012465.db2.gz MUVZRKQMOOTVDA-VIFPVBQESA-N 1 2 248.355 2.208 20 0 BEADLO CC[C@@H]1CC[C@@H]1Nc1ccc(N(C)CCO)c[nH+]1 ZINC000672606831 488014011 /nfs/dbraw/zinc/01/40/11/488014011.db2.gz FKKHVGKMSWRJRP-YPMHNXCESA-N 1 2 249.358 2.111 20 0 BEADLO C[C@H]1CN(c2cc(CO)cc[nH+]2)CC[C@@H]1C ZINC000135206012 488021231 /nfs/dbraw/zinc/02/12/31/488021231.db2.gz LGNFOJCWVYRSMF-QWRGUYRKSA-N 1 2 220.316 2.056 20 0 BEADLO CC(C)(C)c1nc(NC[C@@H]2CC[C@@H](O)C2)cc[nH+]1 ZINC000682721540 488026318 /nfs/dbraw/zinc/02/63/18/488026318.db2.gz ZBKGXBQHUPXSLX-GHMZBOCLSA-N 1 2 249.358 2.347 20 0 BEADLO CCc1cc(N[C@H]2C[C@@H]2c2cccnc2)nc[nH+]1 ZINC000670325221 488048814 /nfs/dbraw/zinc/04/88/14/488048814.db2.gz FCAQXMRGIVMEEO-OLZOCXBDSA-N 1 2 240.310 2.402 20 0 BEADLO CC[C@H](C)CC(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000682891574 488061419 /nfs/dbraw/zinc/06/14/19/488061419.db2.gz ITLRIPZPRHOWDK-STQMWFEESA-N 1 2 249.358 2.483 20 0 BEADLO CC[C@H](NC(=O)[C@H]1CC=CCC1)c1[nH]cc[nH+]1 ZINC000140543165 488064073 /nfs/dbraw/zinc/06/40/73/488064073.db2.gz WTODVSICCOVMFP-QWRGUYRKSA-N 1 2 233.315 2.333 20 0 BEADLO Fc1cccc([C@@H]2CC[N@@H+]2Cc2cn[nH]c2)c1 ZINC000678284051 488067238 /nfs/dbraw/zinc/06/72/38/488067238.db2.gz UDCBCQURHYRAAH-ZDUSSCGKSA-N 1 2 231.274 2.496 20 0 BEADLO Fc1cccc([C@@H]2CC[N@H+]2Cc2cn[nH]c2)c1 ZINC000678284051 488067242 /nfs/dbraw/zinc/06/72/42/488067242.db2.gz UDCBCQURHYRAAH-ZDUSSCGKSA-N 1 2 231.274 2.496 20 0 BEADLO CCc1nnc([C@@H](C)[N@@H+]2CC[C@H](C(F)F)C2)o1 ZINC000677730325 488108633 /nfs/dbraw/zinc/10/86/33/488108633.db2.gz BSIRFYNQVNPZHM-SFYZADRCSA-N 1 2 245.273 2.280 20 0 BEADLO CCc1nnc([C@@H](C)[N@H+]2CC[C@H](C(F)F)C2)o1 ZINC000677730325 488108637 /nfs/dbraw/zinc/10/86/37/488108637.db2.gz BSIRFYNQVNPZHM-SFYZADRCSA-N 1 2 245.273 2.280 20 0 BEADLO CCc1nnc([C@@H](C)[N@@H+]2CC[C@@H](C(F)F)C2)o1 ZINC000677730322 488108208 /nfs/dbraw/zinc/10/82/08/488108208.db2.gz BSIRFYNQVNPZHM-HTQZYQBOSA-N 1 2 245.273 2.280 20 0 BEADLO CCc1nnc([C@@H](C)[N@H+]2CC[C@@H](C(F)F)C2)o1 ZINC000677730322 488108212 /nfs/dbraw/zinc/10/82/12/488108212.db2.gz BSIRFYNQVNPZHM-HTQZYQBOSA-N 1 2 245.273 2.280 20 0 BEADLO CCC[C@@H]1CCC[C@@H]1C(=O)NCc1c[nH+]cn1C ZINC000296147430 487536713 /nfs/dbraw/zinc/53/67/13/487536713.db2.gz SECBVVHMEDIOOG-YPMHNXCESA-N 1 2 249.358 2.253 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CC[C@@H](C(F)F)C2)o1 ZINC000677734512 488112773 /nfs/dbraw/zinc/11/27/73/488112773.db2.gz OCGXDYDXGLHLMA-MRVPVSSYSA-N 1 2 245.273 2.280 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CC[C@@H](C(F)F)C2)o1 ZINC000677734512 488112776 /nfs/dbraw/zinc/11/27/76/488112776.db2.gz OCGXDYDXGLHLMA-MRVPVSSYSA-N 1 2 245.273 2.280 20 0 BEADLO CCC(CC)CNC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000517390461 488122291 /nfs/dbraw/zinc/12/22/91/488122291.db2.gz DJSRLBXDPHVUHI-SNVBAGLBSA-N 1 2 237.347 2.141 20 0 BEADLO CCC(CC)CNC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000517390461 488122297 /nfs/dbraw/zinc/12/22/97/488122297.db2.gz DJSRLBXDPHVUHI-SNVBAGLBSA-N 1 2 237.347 2.141 20 0 BEADLO CC[C@@H]([NH2+]Cc1nnc(C)[nH]1)c1ccccc1F ZINC000392400879 487538759 /nfs/dbraw/zinc/53/87/59/487538759.db2.gz RLKPLPIPPKUIKM-GFCCVEGCSA-N 1 2 248.305 2.493 20 0 BEADLO Cc1nnc(C[N@@H+]2CCc3ccc(C)cc3C2)o1 ZINC000661371955 487539564 /nfs/dbraw/zinc/53/95/64/487539564.db2.gz UHIRWRZWXNVVNK-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1nnc(C[N@H+]2CCc3ccc(C)cc3C2)o1 ZINC000661371955 487539571 /nfs/dbraw/zinc/53/95/71/487539571.db2.gz UHIRWRZWXNVVNK-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO O=C(CCCn1cc[nH+]c1)N1CC2(C1)CCCC2 ZINC000681756383 487540600 /nfs/dbraw/zinc/54/06/00/487540600.db2.gz YMIOBIHYGOQVBC-UHFFFAOYSA-N 1 2 247.342 2.066 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2CC[C@@H](C(F)F)C2)no1 ZINC000685570159 487541780 /nfs/dbraw/zinc/54/17/80/487541780.db2.gz WRLXHGQKEBYBHI-POYBYMJQSA-N 1 2 231.246 2.026 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2CC[C@@H](C(F)F)C2)no1 ZINC000685570159 487541784 /nfs/dbraw/zinc/54/17/84/487541784.db2.gz WRLXHGQKEBYBHI-POYBYMJQSA-N 1 2 231.246 2.026 20 0 BEADLO Cc1nc(C)c(C[N@@H+](C)Cc2cccn2C)o1 ZINC000685566793 487547991 /nfs/dbraw/zinc/54/79/91/487547991.db2.gz VRSOCUDUOIQWEJ-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO Cc1nc(C)c(C[N@H+](C)Cc2cccn2C)o1 ZINC000685566793 487547996 /nfs/dbraw/zinc/54/79/96/487547996.db2.gz VRSOCUDUOIQWEJ-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO COC[C@H]1CCCN1C(=O)Nc1cc[nH+]c(C)c1 ZINC000119476578 487551058 /nfs/dbraw/zinc/55/10/58/487551058.db2.gz UKDDVQORGPETDN-GFCCVEGCSA-N 1 2 249.314 2.033 20 0 BEADLO CCCC[C@@H](C)C(=O)N[C@H]1CCc2c[nH+]cn2C1 ZINC000672154061 487553986 /nfs/dbraw/zinc/55/39/86/487553986.db2.gz HFWZYMVZFOOVML-NEPJUHHUSA-N 1 2 249.358 2.140 20 0 BEADLO CCc1nnc(C[N@@H+]2CCCSCC2)s1 ZINC000680071688 487531767 /nfs/dbraw/zinc/53/17/67/487531767.db2.gz VFIXYEIEPNXZMK-UHFFFAOYSA-N 1 2 243.401 2.039 20 0 BEADLO CCc1nnc(C[N@H+]2CCCSCC2)s1 ZINC000680071688 487531774 /nfs/dbraw/zinc/53/17/74/487531774.db2.gz VFIXYEIEPNXZMK-UHFFFAOYSA-N 1 2 243.401 2.039 20 0 BEADLO Cc1nnc(C[NH2+][C@@H](C)c2ccsc2)n1C ZINC000061363032 487471831 /nfs/dbraw/zinc/47/18/31/487471831.db2.gz DAOCUXMDLZHFSD-QMMMGPOBSA-N 1 2 236.344 2.036 20 0 BEADLO CC(C)(C)C(F)(F)C[NH2+]C1CSC1 ZINC000668747789 487474630 /nfs/dbraw/zinc/47/46/30/487474630.db2.gz LLUVMVYPZOETLT-UHFFFAOYSA-N 1 2 209.305 2.373 20 0 BEADLO Cc1cn2c([nH+]1)CN(C(=O)CCC(C)(C)C)CC2 ZINC000679894197 487482998 /nfs/dbraw/zinc/48/29/98/487482998.db2.gz JABBFQZCXYLNBF-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO O=C(NCc1c[nH+]c[nH]1)c1cc2occc2s1 ZINC000673935430 487486338 /nfs/dbraw/zinc/48/63/38/487486338.db2.gz NIAJPNPBOCTFBZ-UHFFFAOYSA-N 1 2 247.279 2.147 20 0 BEADLO O=C(NCc1c[nH]c[nH+]1)c1cc2occc2s1 ZINC000673935430 487486340 /nfs/dbraw/zinc/48/63/40/487486340.db2.gz NIAJPNPBOCTFBZ-UHFFFAOYSA-N 1 2 247.279 2.147 20 0 BEADLO CC(C)C[C@H](C)C[N@@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000685004703 487486614 /nfs/dbraw/zinc/48/66/14/487486614.db2.gz KBOREBHMMGSCQX-QWRGUYRKSA-N 1 2 235.318 2.371 20 0 BEADLO CC(C)C[C@H](C)C[N@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000685004703 487486616 /nfs/dbraw/zinc/48/66/16/487486616.db2.gz KBOREBHMMGSCQX-QWRGUYRKSA-N 1 2 235.318 2.371 20 0 BEADLO CC(C)C[C@@H](C)C[N@@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000685004702 487486840 /nfs/dbraw/zinc/48/68/40/487486840.db2.gz KBOREBHMMGSCQX-MNOVXSKESA-N 1 2 235.318 2.371 20 0 BEADLO CC(C)C[C@@H](C)C[N@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000685004702 487486842 /nfs/dbraw/zinc/48/68/42/487486842.db2.gz KBOREBHMMGSCQX-MNOVXSKESA-N 1 2 235.318 2.371 20 0 BEADLO OC[C@]1([NH2+]CC(F)F)CCCc2ccccc21 ZINC000685041650 487495871 /nfs/dbraw/zinc/49/58/71/487495871.db2.gz BBRIEQBQMRAAML-CYBMUJFWSA-N 1 2 241.281 2.065 20 0 BEADLO C1=CC[N@H+](Cc2nnc(C3CC3)n2C2CC2)CC1 ZINC000679935952 487498099 /nfs/dbraw/zinc/49/80/99/487498099.db2.gz UDIIFBQQQPBMLI-UHFFFAOYSA-N 1 2 244.342 2.252 20 0 BEADLO C1=CC[N@@H+](Cc2nnc(C3CC3)n2C2CC2)CC1 ZINC000679935952 487498104 /nfs/dbraw/zinc/49/81/04/487498104.db2.gz UDIIFBQQQPBMLI-UHFFFAOYSA-N 1 2 244.342 2.252 20 0 BEADLO Cc1noc([C@H](C)[NH2+][C@H](C)c2cnccc2C)n1 ZINC000679941361 487499493 /nfs/dbraw/zinc/49/94/93/487499493.db2.gz BTTSVSUGQUNXBX-ZJUUUORDSA-N 1 2 246.314 2.493 20 0 BEADLO C[N@H+](C/C(Cl)=C/Cl)[C@H]1CCOC1 ZINC000268697617 487502615 /nfs/dbraw/zinc/50/26/15/487502615.db2.gz UJTSUXIQHBAYKB-NZGHECTNSA-N 1 2 210.104 2.026 20 0 BEADLO C[N@@H+](C/C(Cl)=C/Cl)[C@H]1CCOC1 ZINC000268697617 487502621 /nfs/dbraw/zinc/50/26/21/487502621.db2.gz UJTSUXIQHBAYKB-NZGHECTNSA-N 1 2 210.104 2.026 20 0 BEADLO CCc1nnc(C[N@H+](C(C)C)C2CC2)s1 ZINC000680045434 487526082 /nfs/dbraw/zinc/52/60/82/487526082.db2.gz KMXVYUCWHPBJPB-UHFFFAOYSA-N 1 2 225.361 2.473 20 0 BEADLO CCc1nnc(C[N@@H+](C(C)C)C2CC2)s1 ZINC000680045434 487526090 /nfs/dbraw/zinc/52/60/90/487526090.db2.gz KMXVYUCWHPBJPB-UHFFFAOYSA-N 1 2 225.361 2.473 20 0 BEADLO CCCn1nccc1C[N@@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000667943148 488165051 /nfs/dbraw/zinc/16/50/51/488165051.db2.gz BHTQBXRKWRTWQC-AAEUAGOBSA-N 1 2 239.338 2.473 20 0 BEADLO CCCn1nccc1C[N@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000667943148 488165054 /nfs/dbraw/zinc/16/50/54/488165054.db2.gz BHTQBXRKWRTWQC-AAEUAGOBSA-N 1 2 239.338 2.473 20 0 BEADLO COCC1(Nc2cc[nH+]c(C(C)(C)C)n2)CC1 ZINC000685918334 487596561 /nfs/dbraw/zinc/59/65/61/487596561.db2.gz CJEAYUOLUHZPLI-UHFFFAOYSA-N 1 2 235.331 2.365 20 0 BEADLO Cc1cc(C(=O)Nc2cc[nH+]cc2C)cs1 ZINC000671706109 487699510 /nfs/dbraw/zinc/69/95/10/487699510.db2.gz TXOQFGDLJKJDNU-UHFFFAOYSA-N 1 2 232.308 2.434 20 0 BEADLO O=C(Cc1ccoc1)Nc1ccc2[nH+]ccn2c1 ZINC000681274835 487767337 /nfs/dbraw/zinc/76/73/37/487767337.db2.gz WIISIFGBAJBEOE-UHFFFAOYSA-N 1 2 241.250 2.109 20 0 BEADLO O=C(Cc1ccco1)Nc1ccc2[nH+]ccn2c1 ZINC000675795744 487780571 /nfs/dbraw/zinc/78/05/71/487780571.db2.gz ISRSRKYHKDLLOS-UHFFFAOYSA-N 1 2 241.250 2.109 20 0 BEADLO CC(C)(C)c1nc(NC2(CO)CCC2)cc[nH+]1 ZINC000676030313 487801097 /nfs/dbraw/zinc/80/10/97/487801097.db2.gz IHRDQHOEZJBNRX-UHFFFAOYSA-N 1 2 235.331 2.101 20 0 BEADLO Cc1cc(N2CCCOC[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000676492081 487856901 /nfs/dbraw/zinc/85/69/01/487856901.db2.gz ISKRPFMFDXCKGX-NSHDSACASA-N 1 2 247.342 2.278 20 0 BEADLO Cc1nc(NCC2(c3ccccn3)CC2)cc[nH+]1 ZINC000682235550 487932858 /nfs/dbraw/zinc/93/28/58/487932858.db2.gz SGKFUBSIPOTCIX-UHFFFAOYSA-N 1 2 240.310 2.324 20 0 BEADLO Cc1[nH]c2ccc(NC(=O)c3cnco3)cc2[nH+]1 ZINC000677506988 488057261 /nfs/dbraw/zinc/05/72/61/488057261.db2.gz RPHBKCAVMGTHSK-UHFFFAOYSA-N 1 2 242.238 2.112 20 0 BEADLO CNc1[nH+]cnc2c1cnn2CC1(C)CCC1 ZINC000663999266 488148173 /nfs/dbraw/zinc/14/81/73/488148173.db2.gz KCPIGYBHZITPLL-UHFFFAOYSA-N 1 2 231.303 2.058 20 0 BEADLO CCc1cc(N[C@@H]2CS[C@H](C)C2)nc[nH+]1 ZINC000397794602 488150128 /nfs/dbraw/zinc/15/01/28/488150128.db2.gz FPTBJOZYZZDHJX-SCZZXKLOSA-N 1 2 223.345 2.345 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CO[C@H](C2CC2)C1 ZINC000667918945 488158258 /nfs/dbraw/zinc/15/82/58/488158258.db2.gz QDBNHYAUQRKFDN-PWSUYJOCSA-N 1 2 234.299 2.070 20 0 BEADLO CCn1cc(C[NH2+][C@H](C)c2ccccc2F)nn1 ZINC000404484664 488163241 /nfs/dbraw/zinc/16/32/41/488163241.db2.gz AAHCOUBGFWMVJE-SNVBAGLBSA-N 1 2 248.305 2.288 20 0 BEADLO CCCNC(=O)Nc1c[nH+]c2c(C)cccn12 ZINC000667948092 488166180 /nfs/dbraw/zinc/16/61/80/488166180.db2.gz NSMGXBFQPFQFLO-UHFFFAOYSA-N 1 2 232.287 2.174 20 0 BEADLO Cc1cccn2c(NC(=O)N3CCCC3)c[nH+]c12 ZINC000667948275 488166546 /nfs/dbraw/zinc/16/65/46/488166546.db2.gz WPHRLLWHYASDCZ-UHFFFAOYSA-N 1 2 244.298 2.270 20 0 BEADLO CCn1cc(C[NH2+][C@@H](C)c2cccc(F)c2)nn1 ZINC000404515669 488166783 /nfs/dbraw/zinc/16/67/83/488166783.db2.gz VIYBHLXLWWWWOF-JTQLQIEISA-N 1 2 248.305 2.288 20 0 BEADLO COc1ccc(N[C@H]2CS[C@H](C)C2)[nH+]c1 ZINC000397908525 488169220 /nfs/dbraw/zinc/16/92/20/488169220.db2.gz YQMRXBYYFBBYGD-RKDXNWHRSA-N 1 2 224.329 2.396 20 0 BEADLO CC(C)n1cc[nH+]c1CN(C)Cc1ccncc1 ZINC000667976133 488172806 /nfs/dbraw/zinc/17/28/06/488172806.db2.gz HVISQQCSGVQEHW-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO Cc1csc(CNC(=O)CCc2c[nH+]c[nH]2)c1 ZINC000452756299 488173286 /nfs/dbraw/zinc/17/32/86/488173286.db2.gz KKQYGKLDJRHTGL-UHFFFAOYSA-N 1 2 249.339 2.029 20 0 BEADLO Cc1csc(CNC(=O)CCc2c[nH]c[nH+]2)c1 ZINC000452756299 488173291 /nfs/dbraw/zinc/17/32/91/488173291.db2.gz KKQYGKLDJRHTGL-UHFFFAOYSA-N 1 2 249.339 2.029 20 0 BEADLO Nc1cccc(C[N@@H+]2CCCC(F)(F)C2)c1 ZINC000259498601 488176334 /nfs/dbraw/zinc/17/63/34/488176334.db2.gz NSBICYHAVIBLII-UHFFFAOYSA-N 1 2 226.270 2.500 20 0 BEADLO Nc1cccc(C[N@H+]2CCCC(F)(F)C2)c1 ZINC000259498601 488176336 /nfs/dbraw/zinc/17/63/36/488176336.db2.gz NSBICYHAVIBLII-UHFFFAOYSA-N 1 2 226.270 2.500 20 0 BEADLO Cc1ccc(NC(=O)c2nccs2)c(C)[nH+]1 ZINC000683570616 488198794 /nfs/dbraw/zinc/19/87/94/488198794.db2.gz YNAFFUBRNXZQKV-UHFFFAOYSA-N 1 2 233.296 2.407 20 0 BEADLO c1coc(-c2noc(CCCn3cc[nH+]c3)n2)c1 ZINC000683590909 488201275 /nfs/dbraw/zinc/20/12/75/488201275.db2.gz DDUGJRDUENJRRR-UHFFFAOYSA-N 1 2 244.254 2.159 20 0 BEADLO CCn1c[nH+]cc1CNc1cnn(CC2CC2)c1 ZINC000669548212 488204937 /nfs/dbraw/zinc/20/49/37/488204937.db2.gz JEZFAYXDSDEGOZ-UHFFFAOYSA-N 1 2 245.330 2.122 20 0 BEADLO CCn1c[nH+]cc1CNc1nnc(C2CC2)s1 ZINC000668154498 488211182 /nfs/dbraw/zinc/21/11/82/488211182.db2.gz SIRDUJDZVPBLCP-UHFFFAOYSA-N 1 2 249.343 2.244 20 0 BEADLO CC[C@@H](Nc1nc[nH+]c(N)c1Cl)C1CC1 ZINC000323770721 488220907 /nfs/dbraw/zinc/22/09/07/488220907.db2.gz XSILPZORYQDPHO-SSDOTTSWSA-N 1 2 226.711 2.313 20 0 BEADLO CC[C@@H](Nc1[nH+]cnc(N)c1Cl)C1CC1 ZINC000323770721 488220911 /nfs/dbraw/zinc/22/09/11/488220911.db2.gz XSILPZORYQDPHO-SSDOTTSWSA-N 1 2 226.711 2.313 20 0 BEADLO Cn1ccc(C[N@@H+]2CCOC[C@H]2c2ccco2)c1 ZINC000678264505 488229330 /nfs/dbraw/zinc/22/93/30/488229330.db2.gz NLMVTUJRPABEKZ-ZDUSSCGKSA-N 1 2 246.310 2.192 20 0 BEADLO Cn1ccc(C[N@H+]2CCOC[C@H]2c2ccco2)c1 ZINC000678264505 488229332 /nfs/dbraw/zinc/22/93/32/488229332.db2.gz NLMVTUJRPABEKZ-ZDUSSCGKSA-N 1 2 246.310 2.192 20 0 BEADLO Cn1cnc(C[N@H+](C)Cc2ccc(F)cc2)c1 ZINC000683897090 488238933 /nfs/dbraw/zinc/23/89/33/488238933.db2.gz MACQNOHXNYHDIZ-UHFFFAOYSA-N 1 2 233.290 2.191 20 0 BEADLO Cn1cnc(C[N@@H+](C)Cc2ccc(F)cc2)c1 ZINC000683897090 488238935 /nfs/dbraw/zinc/23/89/35/488238935.db2.gz MACQNOHXNYHDIZ-UHFFFAOYSA-N 1 2 233.290 2.191 20 0 BEADLO C[C@H](c1cccnc1)[N@H+](C)Cc1cn(C)cn1 ZINC000683900242 488241855 /nfs/dbraw/zinc/24/18/55/488241855.db2.gz SATXVCBQVMPWMS-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1cn(C)cn1 ZINC000683900242 488241858 /nfs/dbraw/zinc/24/18/58/488241858.db2.gz SATXVCBQVMPWMS-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO Cc1n[nH]cc1CNc1cc2cc[nH]c2c[nH+]1 ZINC000672188726 488243830 /nfs/dbraw/zinc/24/38/30/488243830.db2.gz XLLAQVPXGQDXJJ-UHFFFAOYSA-N 1 2 227.271 2.207 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CCC[C@H]3C[C@H]32)[nH+]1 ZINC000672322904 488251099 /nfs/dbraw/zinc/25/10/99/488251099.db2.gz QVNATEFHYZBWHX-GXSJLCMTSA-N 1 2 228.299 2.255 20 0 BEADLO c1nc(N2CCC[C@@H]3C[C@@H]32)cc(NCC2CC2)[nH+]1 ZINC000672323772 488251556 /nfs/dbraw/zinc/25/15/56/488251556.db2.gz QRCMRUYXKBRHTE-NEPJUHHUSA-N 1 2 244.342 2.287 20 0 BEADLO c1nc(NCC2CC2)cc(N2CCC[C@@H]3C[C@@H]32)[nH+]1 ZINC000672323772 488251557 /nfs/dbraw/zinc/25/15/57/488251557.db2.gz QRCMRUYXKBRHTE-NEPJUHHUSA-N 1 2 244.342 2.287 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ccc(F)cn2)ncn1 ZINC000678604416 488271170 /nfs/dbraw/zinc/27/11/70/488271170.db2.gz DMAQPNAGNLKAFK-JTQLQIEISA-N 1 2 246.289 2.170 20 0 BEADLO CCOc1ncccc1CNc1cc[nH+]cc1F ZINC000678788915 488283109 /nfs/dbraw/zinc/28/31/09/488283109.db2.gz QRGJMQCNFLCCGN-UHFFFAOYSA-N 1 2 247.273 2.048 20 0 BEADLO CO[C@@H](CNc1cc[nH+]cc1F)c1ccccc1 ZINC000678787962 488283622 /nfs/dbraw/zinc/28/36/22/488283622.db2.gz BCDWUHQFYXXPRQ-AWEZNQCLSA-N 1 2 246.285 2.442 20 0 BEADLO Cc1cnc(C[NH2+][C@H](C)c2c(C)noc2C)o1 ZINC000678804929 488285262 /nfs/dbraw/zinc/28/52/62/488285262.db2.gz JYCIXPUXKHHICA-MRVPVSSYSA-N 1 2 235.287 2.439 20 0 BEADLO COc1ccc[nH+]c1N[C@H](C)C[C@H]1CCOC1 ZINC000679092319 488308690 /nfs/dbraw/zinc/30/86/90/488308690.db2.gz ZKIWHZWYSPHBLS-GHMZBOCLSA-N 1 2 236.315 2.317 20 0 BEADLO CN(C)c1ccccc1C[NH2+]Cc1ccon1 ZINC000673886286 488311135 /nfs/dbraw/zinc/31/11/35/488311135.db2.gz LWFNPNBBYWWFOJ-UHFFFAOYSA-N 1 2 231.299 2.030 20 0 BEADLO COc1cccc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)n1 ZINC000679219250 488316924 /nfs/dbraw/zinc/31/69/24/488316924.db2.gz FNYQUDOGHNOLMJ-JQWIXIFHSA-N 1 2 238.306 2.270 20 0 BEADLO COc1cccc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)n1 ZINC000679219250 488316926 /nfs/dbraw/zinc/31/69/26/488316926.db2.gz FNYQUDOGHNOLMJ-JQWIXIFHSA-N 1 2 238.306 2.270 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)cn1 ZINC000679217742 488317011 /nfs/dbraw/zinc/31/70/11/488317011.db2.gz AUEPIXRHKCZRFV-ZYHUDNBSSA-N 1 2 238.306 2.270 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)cn1 ZINC000679217742 488317013 /nfs/dbraw/zinc/31/70/13/488317013.db2.gz AUEPIXRHKCZRFV-ZYHUDNBSSA-N 1 2 238.306 2.270 20 0 BEADLO COc1cccc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)n1 ZINC000679219251 488317721 /nfs/dbraw/zinc/31/77/21/488317721.db2.gz FNYQUDOGHNOLMJ-PWSUYJOCSA-N 1 2 238.306 2.270 20 0 BEADLO COc1cccc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)n1 ZINC000679219251 488317722 /nfs/dbraw/zinc/31/77/22/488317722.db2.gz FNYQUDOGHNOLMJ-PWSUYJOCSA-N 1 2 238.306 2.270 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)oc1C ZINC000679221432 488319907 /nfs/dbraw/zinc/31/99/07/488319907.db2.gz KUNUOYZQWMDKTQ-KWQFWETISA-N 1 2 226.295 2.471 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)oc1C ZINC000679221432 488319909 /nfs/dbraw/zinc/31/99/09/488319909.db2.gz KUNUOYZQWMDKTQ-KWQFWETISA-N 1 2 226.295 2.471 20 0 BEADLO COc1cc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)ccn1 ZINC000679223569 488320472 /nfs/dbraw/zinc/32/04/72/488320472.db2.gz QSCXSNBICZDTFQ-CMPLNLGQSA-N 1 2 238.306 2.270 20 0 BEADLO COc1cc(C[N@H+]2CC[C@H](C)[C@H](F)C2)ccn1 ZINC000679223569 488320474 /nfs/dbraw/zinc/32/04/74/488320474.db2.gz QSCXSNBICZDTFQ-CMPLNLGQSA-N 1 2 238.306 2.270 20 0 BEADLO C[C@H]1CC[C@@H](CNC(=O)CCCn2cc[nH+]c2)C1 ZINC000684515134 488324717 /nfs/dbraw/zinc/32/47/17/488324717.db2.gz QNUYCJRCZNGEFX-QWHCGFSZSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1n[nH]cc1[C@@H](C)[NH2+]Cc1ccn(C(C)C)n1 ZINC000679340738 488341695 /nfs/dbraw/zinc/34/16/95/488341695.db2.gz NYJVKOLENUVPRS-SNVBAGLBSA-N 1 2 247.346 2.346 20 0 BEADLO Cc1n[nH]cc1[C@@H](C)[NH2+]Cc1ncccc1F ZINC000679357215 488343928 /nfs/dbraw/zinc/34/39/28/488343928.db2.gz ZFSKPQUUCSRHAI-MRVPVSSYSA-N 1 2 234.278 2.103 20 0 BEADLO COc1ccc(CNc2c[nH]c[nH+]2)c(OC)c1 ZINC000684836370 488347728 /nfs/dbraw/zinc/34/77/28/488347728.db2.gz VSMJDSPNSURCFH-UHFFFAOYSA-N 1 2 233.271 2.039 20 0 BEADLO Cc1nc(N2CC[C@@H]2C)c2c([nH+]1)CCCC2 ZINC000679837451 488367702 /nfs/dbraw/zinc/36/77/02/488367702.db2.gz RKRWOMOEBCWVOV-VIFPVBQESA-N 1 2 217.316 2.262 20 0 BEADLO Cc1cn2c([nH+]1)CN(c1ccc(Cl)cn1)CC2 ZINC000679845667 488368392 /nfs/dbraw/zinc/36/83/92/488368392.db2.gz CKSAYYHVNHRFQQ-UHFFFAOYSA-N 1 2 248.717 2.260 20 0 BEADLO Cc1ccc(NC(=O)C[N@H+]2CC=CCC2)cc1F ZINC000679322053 490113788 /nfs/dbraw/zinc/11/37/88/490113788.db2.gz SZEQGKDBJSAFSO-UHFFFAOYSA-N 1 2 248.301 2.335 20 0 BEADLO Cc1ccc(NC(=O)C[N@@H+]2CC=CCC2)cc1F ZINC000679322053 490113793 /nfs/dbraw/zinc/11/37/93/490113793.db2.gz SZEQGKDBJSAFSO-UHFFFAOYSA-N 1 2 248.301 2.335 20 0 BEADLO COc1ccc(C[N@@H+]2CCOC[C@@H]2C)c(F)c1 ZINC000651819198 490144763 /nfs/dbraw/zinc/14/47/63/490144763.db2.gz SBTDDBSSSGHUKW-JTQLQIEISA-N 1 2 239.290 2.055 20 0 BEADLO COc1ccc(C[N@H+]2CCOC[C@@H]2C)c(F)c1 ZINC000651819198 490144771 /nfs/dbraw/zinc/14/47/71/490144771.db2.gz SBTDDBSSSGHUKW-JTQLQIEISA-N 1 2 239.290 2.055 20 0 BEADLO C[C@@H]1CN(Cc2[nH]cc[nH+]2)CC2(CCCCC2)O1 ZINC000653906675 490156123 /nfs/dbraw/zinc/15/61/23/490156123.db2.gz WOLORTYILOSBFE-GFCCVEGCSA-N 1 2 249.358 2.333 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ncc[nH]2)CC2(CCCCC2)O1 ZINC000653906675 490156129 /nfs/dbraw/zinc/15/61/29/490156129.db2.gz WOLORTYILOSBFE-GFCCVEGCSA-N 1 2 249.358 2.333 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ncc[nH]2)CC2(CCCCC2)O1 ZINC000653906675 490156134 /nfs/dbraw/zinc/15/61/34/490156134.db2.gz WOLORTYILOSBFE-GFCCVEGCSA-N 1 2 249.358 2.333 20 0 BEADLO CC[C@@H]1CCC[N@H+](Cc2noc(C)n2)C1 ZINC000045943467 490157188 /nfs/dbraw/zinc/15/71/88/490157188.db2.gz SSOHRHYOXNYAGJ-SNVBAGLBSA-N 1 2 209.293 2.000 20 0 BEADLO CC[C@@H]1CCC[N@@H+](Cc2noc(C)n2)C1 ZINC000045943467 490157196 /nfs/dbraw/zinc/15/71/96/490157196.db2.gz SSOHRHYOXNYAGJ-SNVBAGLBSA-N 1 2 209.293 2.000 20 0 BEADLO Cc1nc(NCC2(CO)CCCCC2)cc[nH+]1 ZINC000122853387 490179557 /nfs/dbraw/zinc/17/95/57/490179557.db2.gz MFOKCHIGTUACHB-UHFFFAOYSA-N 1 2 235.331 2.140 20 0 BEADLO c1cn(-c2cccc(N[C@@H]3CCCOC3)c2)c[nH+]1 ZINC000070464093 490214992 /nfs/dbraw/zinc/21/49/92/490214992.db2.gz OOVMOIXBYYVVDO-CYBMUJFWSA-N 1 2 243.310 2.463 20 0 BEADLO CC(C)c1cc(N[C@H](C)c2[nH]cc[nH+]2)ncn1 ZINC000139853798 490277887 /nfs/dbraw/zinc/27/78/87/490277887.db2.gz PLXFTRYKQCKLSV-SECBINFHSA-N 1 2 231.303 2.496 20 0 BEADLO Cc1ccc(NC(=O)CCCn2cc[nH+]c2)cn1 ZINC000125081996 490412787 /nfs/dbraw/zinc/41/27/87/490412787.db2.gz TZQFCCVFCHTRCF-UHFFFAOYSA-N 1 2 244.298 2.005 20 0 BEADLO CC[C@H](Nc1ccc(C)nn1)c1[nH]cc[nH+]1 ZINC000125218673 490420055 /nfs/dbraw/zinc/42/00/55/490420055.db2.gz AJOIWXMZOZSQMU-VIFPVBQESA-N 1 2 217.276 2.071 20 0 BEADLO Cc1c(CNc2cc[nH+]c(C(C)C)n2)cnn1C ZINC000128850247 490592494 /nfs/dbraw/zinc/59/24/94/490592494.db2.gz BVCYCBBSNHMUQT-UHFFFAOYSA-N 1 2 245.330 2.254 20 0 BEADLO Clc1cnc(NCCn2cc[nH+]c2)s1 ZINC000306476990 490639309 /nfs/dbraw/zinc/63/93/09/490639309.db2.gz ZNFZBFNKTBMCCU-UHFFFAOYSA-N 1 2 228.708 2.105 20 0 BEADLO COc1cccc(CNc2c[nH]c[nH+]2)c1OC ZINC000519696485 491053775 /nfs/dbraw/zinc/05/37/75/491053775.db2.gz NPCDDDCGPKDCST-UHFFFAOYSA-N 1 2 233.271 2.039 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccns2)on1 ZINC000639787968 491064081 /nfs/dbraw/zinc/06/40/81/491064081.db2.gz UTDUVTNGQHIVCV-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccns2)on1 ZINC000639787968 491064082 /nfs/dbraw/zinc/06/40/82/491064082.db2.gz UTDUVTNGQHIVCV-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO CCc1cc(N[C@H]2CCOC(C)(C)C2)nc[nH+]1 ZINC000228087959 491089794 /nfs/dbraw/zinc/08/97/94/491089794.db2.gz KVTKBSQKSCFNSN-NSHDSACASA-N 1 2 235.331 2.409 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)Nc1nc(C2CC2)ns1 ZINC000087641227 491091240 /nfs/dbraw/zinc/09/12/40/491091240.db2.gz ORYWTYIUXVFFCY-MRVPVSSYSA-N 1 2 249.343 2.113 20 0 BEADLO CCc1cc(NCC[C@@H]2CCCCO2)nc[nH+]1 ZINC000227315563 491098746 /nfs/dbraw/zinc/09/87/46/491098746.db2.gz IKZUJGFCRCNSFL-LBPRGKRZSA-N 1 2 235.331 2.410 20 0 BEADLO CCc1cc(N[C@@H]2CCCC[C@H]2OC)nc[nH+]1 ZINC000078427187 491117063 /nfs/dbraw/zinc/11/70/63/491117063.db2.gz WFFOSEGQWOYYQC-VXGBXAGGSA-N 1 2 235.331 2.409 20 0 BEADLO CCc1cc(N[C@@H](C)C2CCOCC2)nc[nH+]1 ZINC000230218023 491128706 /nfs/dbraw/zinc/12/87/06/491128706.db2.gz KESOXPXTUWBHLI-JTQLQIEISA-N 1 2 235.331 2.266 20 0 BEADLO COc1ccc(NCC2(C)CCOCC2)[nH+]c1 ZINC000230685034 491130584 /nfs/dbraw/zinc/13/05/84/491130584.db2.gz HHARRZSIXKVUPT-UHFFFAOYSA-N 1 2 236.315 2.319 20 0 BEADLO Cn1cc[nH+]c1CNc1ncc(Cl)s1 ZINC000307495802 491133595 /nfs/dbraw/zinc/13/35/95/491133595.db2.gz INTMZEZFLLHYLK-UHFFFAOYSA-N 1 2 228.708 2.142 20 0 BEADLO C[C@H]1CCN(C(=O)CCCn2cc[nH+]c2)C[C@H]1C ZINC000132887064 491141567 /nfs/dbraw/zinc/14/15/67/491141567.db2.gz AUEPULOMWNZUBX-QWHCGFSZSA-N 1 2 249.358 2.168 20 0 BEADLO CC[C@H]([NH2+][C@H](C)CCCCO)C(F)(F)F ZINC000309032056 491142923 /nfs/dbraw/zinc/14/29/23/491142923.db2.gz FJZCSCIPYQQVSN-BDAKNGLRSA-N 1 2 227.270 2.468 20 0 BEADLO Cc1nc(N[C@H]2CCC(F)(F)C2)cc[nH+]1 ZINC000309078957 491144032 /nfs/dbraw/zinc/14/40/32/491144032.db2.gz NOVPPGFQRYFIAZ-QMMMGPOBSA-N 1 2 213.231 2.385 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]CCOC(C)(C)C ZINC000309516975 491149807 /nfs/dbraw/zinc/14/98/07/491149807.db2.gz YXXYYVNFTOHFLL-VIFPVBQESA-N 1 2 225.336 2.184 20 0 BEADLO C[C@@H](CCCCO)[NH2+][C@H](C1CC1)C(F)(F)F ZINC000309734650 491155292 /nfs/dbraw/zinc/15/52/92/491155292.db2.gz GCDCWUMHCCPFED-WCBMZHEXSA-N 1 2 239.281 2.468 20 0 BEADLO C[C@@H]1CCC[C@@H](N(C)C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493085563 533757212 /nfs/dbraw/zinc/75/72/12/533757212.db2.gz MZCLPNHXWMWONE-BYAJROORSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@@H](CC(=O)OC[C@H]1CC1(C)C)n1cc[nH+]c1 ZINC000845575067 582614226 /nfs/dbraw/zinc/61/42/26/582614226.db2.gz FUINUDOAMSTNBL-WDEREUQCSA-N 1 2 236.315 2.424 20 0 BEADLO C[C@@H]1CCC[C@H](C)C1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492812139 533819880 /nfs/dbraw/zinc/81/98/80/533819880.db2.gz MBAQQRWNEHEALJ-NDDQQYECSA-N 1 2 247.342 2.364 20 0 BEADLO C[C@@H]1CCC[C@H](CNC(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493481527 533841213 /nfs/dbraw/zinc/84/12/13/533841213.db2.gz MAESXFMDGBIOQB-AIIUZBJTSA-N 1 2 247.342 2.365 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)/C=C/c2[nH]cc[nH+]2)[C@@H]1C ZINC000493136969 533860476 /nfs/dbraw/zinc/86/04/76/533860476.db2.gz ZKJCMJKDEGBFJV-SBMYGGQKSA-N 1 2 247.342 2.364 20 0 BEADLO C[C@@H]1CCN(C(=O)/C=C/c2[nH]cc[nH+]2)[C@H](C)C1 ZINC000493450986 533911122 /nfs/dbraw/zinc/91/11/22/533911122.db2.gz IUDZMDTTWNUYSM-YIZUVKHSSA-N 1 2 233.315 2.070 20 0 BEADLO Cc1ccc(CNC(=O)C=Cc2c[nH]c[nH+]2)s1 ZINC000492810252 533966424 /nfs/dbraw/zinc/96/64/24/533966424.db2.gz HTHPNANBMYEKNK-HYXAFXHYSA-N 1 2 247.323 2.109 20 0 BEADLO Cc1ccc(CNC(=O)C=Cc2c[nH]c[nH+]2)cc1 ZINC000492823400 533966587 /nfs/dbraw/zinc/96/65/87/533966587.db2.gz NCDVFTSQAILMFA-VOTSOKGWSA-N 1 2 241.294 2.048 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)/C=C/C2CCCC2)S1 ZINC000493049082 534003405 /nfs/dbraw/zinc/00/34/05/534003405.db2.gz MZEDEKLKZYDMPM-UCUJLANTSA-N 1 2 238.356 2.340 20 0 BEADLO C[C@@H]1CC[N@H+](CC2(C)COC2)CC1(F)F ZINC000494259820 534028299 /nfs/dbraw/zinc/02/82/99/534028299.db2.gz OPFJVNAMYHZVRX-SECBINFHSA-N 1 2 219.275 2.000 20 0 BEADLO C[C@@H]1CC[N@@H+](CC2(C)COC2)CC1(F)F ZINC000494259820 534028304 /nfs/dbraw/zinc/02/83/04/534028304.db2.gz OPFJVNAMYHZVRX-SECBINFHSA-N 1 2 219.275 2.000 20 0 BEADLO C[C@H](CCO)[NH2+]c1ccc2c(c1)CCCO2 ZINC000779422643 582670479 /nfs/dbraw/zinc/67/04/79/582670479.db2.gz KCEQDUCJGIVJJZ-SNVBAGLBSA-N 1 2 221.300 2.194 20 0 BEADLO C[C@H](O)c1cccc(NCc2ccco2)[nH+]1 ZINC000891387807 582675751 /nfs/dbraw/zinc/67/57/51/582675751.db2.gz FHNAPYVULHUMAD-VIFPVBQESA-N 1 2 218.256 2.340 20 0 BEADLO CCOC(=O)C[N@H+](Cc1ccco1)C1CCC1 ZINC000261146844 535671308 /nfs/dbraw/zinc/67/13/08/535671308.db2.gz RHESHIGMAIVAIT-UHFFFAOYSA-N 1 2 237.299 2.197 20 0 BEADLO CCOC(=O)C[N@@H+](Cc1ccco1)C1CCC1 ZINC000261146844 535671313 /nfs/dbraw/zinc/67/13/13/535671313.db2.gz RHESHIGMAIVAIT-UHFFFAOYSA-N 1 2 237.299 2.197 20 0 BEADLO CCc1nc(N2C[C@H](C)OC[C@H]2CC)cc(C)[nH+]1 ZINC000287802640 536126126 /nfs/dbraw/zinc/12/61/26/536126126.db2.gz JUTAMUFAXBLPEZ-NWDGAFQWSA-N 1 2 249.358 2.351 20 0 BEADLO CC[C@H](C(=O)OC)[N@H+](C)Cc1ccccc1F ZINC000194559481 517800786 /nfs/dbraw/zinc/80/07/86/517800786.db2.gz KZTWZWVXRFDOCM-GFCCVEGCSA-N 1 2 239.290 2.209 20 0 BEADLO CC[C@H](C(=O)OC)[N@@H+](C)Cc1ccccc1F ZINC000194559481 517800797 /nfs/dbraw/zinc/80/07/97/517800797.db2.gz KZTWZWVXRFDOCM-GFCCVEGCSA-N 1 2 239.290 2.209 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)/C=C\[C@@H]1CCOC1 ZINC000493136250 534386639 /nfs/dbraw/zinc/38/66/39/534386639.db2.gz DBDSXUVWWPDIST-VSQXVHSFSA-N 1 2 246.310 2.230 20 0 BEADLO Cc1nc(NC(=O)C=Cc2c[nH]c[nH+]2)sc1C ZINC000492774228 534454229 /nfs/dbraw/zinc/45/42/29/534454229.db2.gz WSVWNLHWYZZIBM-ONEGZZNKSA-N 1 2 248.311 2.135 20 0 BEADLO CCn1ccc(C[NH2+]Cc2ccccc2F)n1 ZINC000020349102 523493139 /nfs/dbraw/zinc/49/31/39/523493139.db2.gz MAGXXNPNZIFQRA-UHFFFAOYSA-N 1 2 233.290 2.332 20 0 BEADLO CC(=O)c1cccc(C[N@H+]2CCO[C@H](C)[C@@H]2C)c1 ZINC000336196002 534888442 /nfs/dbraw/zinc/88/84/42/534888442.db2.gz KDTAWRPBMQYZIM-WCQYABFASA-N 1 2 247.338 2.498 20 0 BEADLO CC(=O)c1cccc(C[N@@H+]2CCO[C@H](C)[C@@H]2C)c1 ZINC000336196002 534888445 /nfs/dbraw/zinc/88/84/45/534888445.db2.gz KDTAWRPBMQYZIM-WCQYABFASA-N 1 2 247.338 2.498 20 0 BEADLO CC(C)c1nc(N2CCO[C@@H]3CCC[C@H]32)cc[nH+]1 ZINC000370388068 534909474 /nfs/dbraw/zinc/90/94/74/534909474.db2.gz ZRYSVKZWPKKNBL-VXGBXAGGSA-N 1 2 247.342 2.358 20 0 BEADLO CC(C)(C)[C@@H]1CCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493161638 526668400 /nfs/dbraw/zinc/66/84/00/526668400.db2.gz TWPYABURWWGDHK-SGUJLRQBSA-N 1 2 247.342 2.318 20 0 BEADLO C/C=C(/C=C\C(=O)N1CCn2c[nH+]cc2C1)CC ZINC000493271294 527558542 /nfs/dbraw/zinc/55/85/42/527558542.db2.gz MEBUIYPPOOOJFC-JQFMXUTPSA-N 1 2 245.326 2.138 20 0 BEADLO CC=CC=CC(=O)NC(C)(C)c1[nH]cc(C)[nH+]1 ZINC000493787763 527578900 /nfs/dbraw/zinc/57/89/00/527578900.db2.gz LARPZOMPBRFVSG-BSWSSELBSA-N 1 2 233.315 2.202 20 0 BEADLO C/C=C/C=C/C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000493097623 527581165 /nfs/dbraw/zinc/58/11/65/527581165.db2.gz QPYVMZSGMNPVHT-YTXTXJHMSA-N 1 2 230.311 2.447 20 0 BEADLO C/C=C/C=C/C(=O)N[C@@H](C)c1[nH+]ccn1CC ZINC000493424396 527582431 /nfs/dbraw/zinc/58/24/31/527582431.db2.gz SIFPVUYPSPCTSS-SBECFFPISA-N 1 2 233.315 2.213 20 0 BEADLO CC(C)CC[C@@H](C)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492855527 527798451 /nfs/dbraw/zinc/79/84/51/527798451.db2.gz AFNBEJIJWIQQSY-JMEBYUIHSA-N 1 2 235.331 2.364 20 0 BEADLO CC(C)CC[C@@H](C)NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493576271 527798985 /nfs/dbraw/zinc/79/89/85/527798985.db2.gz CGIZYXUDBZVSPI-XUIVZRPNSA-N 1 2 235.331 2.364 20 0 BEADLO CCCC(C)(C)NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493634446 527984437 /nfs/dbraw/zinc/98/44/37/527984437.db2.gz SFYCDTWICHKZGD-AATRIKPKSA-N 1 2 221.304 2.118 20 0 BEADLO CCC[C@H](C)N(C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492807019 528040425 /nfs/dbraw/zinc/04/04/25/528040425.db2.gz ASYIAZDYACGXJO-GFVADAIESA-N 1 2 221.304 2.070 20 0 BEADLO CCCCN(C(=O)/C=C/c1[nH]cc[nH+]1)C1CC1 ZINC000493186393 528296813 /nfs/dbraw/zinc/29/68/13/528296813.db2.gz IYLWPJIHMQJSEY-VOTSOKGWSA-N 1 2 233.315 2.214 20 0 BEADLO CCCCN(C(=O)C=Cc1c[nH]c[nH+]1)C1CC1 ZINC000492758418 528297112 /nfs/dbraw/zinc/29/71/12/528297112.db2.gz AJTQXXYAIRBIPT-DAXSKMNVSA-N 1 2 233.315 2.214 20 0 BEADLO CCCCN(CC)C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493096357 528381067 /nfs/dbraw/zinc/38/10/67/528381067.db2.gz WAIAPCZIVLFOGP-VOTSOKGWSA-N 1 2 221.304 2.072 20 0 BEADLO CCN(CCC1CC1)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492815823 528407389 /nfs/dbraw/zinc/40/73/89/528407389.db2.gz YJVLHJRUMMZIKD-AATRIKPKSA-N 1 2 233.315 2.072 20 0 BEADLO CC(C)N(CC1CC1)C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493303043 528870457 /nfs/dbraw/zinc/87/04/57/528870457.db2.gz OPDBUXBDGMZBEH-AATRIKPKSA-N 1 2 233.315 2.070 20 0 BEADLO CCN(C(=O)C=Cc1c[nH]c[nH+]1)[C@@H](C)C(C)C ZINC000493416299 528907774 /nfs/dbraw/zinc/90/77/74/528907774.db2.gz HMXGLHKMQAODCW-MLRMMBSGSA-N 1 2 235.331 2.316 20 0 BEADLO CCC[C@@H](CC)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493755026 528914019 /nfs/dbraw/zinc/91/40/19/528914019.db2.gz NRNPBCUPTHTYMM-JYESYGNLSA-N 1 2 221.304 2.118 20 0 BEADLO CC1(C)CC[C@H](NC(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493497397 529045428 /nfs/dbraw/zinc/04/54/28/529045428.db2.gz YAYXCUUOZWZDCF-XOULXFPDSA-N 1 2 233.315 2.118 20 0 BEADLO CC[C@H]1CC[C@H](NC(=O)c2c[nH+]c(C)[nH]2)CC1 ZINC000479444888 529257382 /nfs/dbraw/zinc/25/73/82/529257382.db2.gz KMVVTTZAMLBJLJ-XYPYZODXSA-N 1 2 235.331 2.417 20 0 BEADLO CC[C@@H]1CCC[C@@H]1CNC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493364235 529307581 /nfs/dbraw/zinc/30/75/81/529307581.db2.gz ZVPWVDBUPMTBTO-BYAJROORSA-N 1 2 247.342 2.365 20 0 BEADLO CC(C)c1nnc(C[NH+]2CCCC2)s1 ZINC000336189895 534970952 /nfs/dbraw/zinc/97/09/52/534970952.db2.gz USEHNEBBTCEKFL-UHFFFAOYSA-N 1 2 211.334 2.257 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCO[C@@H](C)[C@@H]1C ZINC000335307607 535146887 /nfs/dbraw/zinc/14/68/87/535146887.db2.gz VYSGKFPBKAXGRB-RYUDHWBXSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCO[C@@H](C)[C@@H]1C ZINC000335307607 535146889 /nfs/dbraw/zinc/14/68/89/535146889.db2.gz VYSGKFPBKAXGRB-RYUDHWBXSA-N 1 2 237.347 2.073 20 0 BEADLO CC[NH+](CC)Cc1nc([C@](C)(CC)OC)no1 ZINC000350453569 535614245 /nfs/dbraw/zinc/61/42/45/535614245.db2.gz PISRHQHHCGCYGZ-LBPRGKRZSA-N 1 2 241.335 2.183 20 0 BEADLO CCc1nocc1CNc1ccc(SC)c[nH+]1 ZINC000339307065 535906361 /nfs/dbraw/zinc/90/63/61/535906361.db2.gz HBMLTDUTEYEGES-UHFFFAOYSA-N 1 2 249.339 2.388 20 0 BEADLO CC[C@H](NCc1[nH]cc[nH+]1)c1nccs1 ZINC000070633907 535922476 /nfs/dbraw/zinc/92/24/76/535922476.db2.gz LSHJHGWTERSEKZ-QMMMGPOBSA-N 1 2 222.317 2.107 20 0 BEADLO CC[C@@]1(C)CC[N@H+](Cc2noc(C)n2)C1 ZINC000336218862 536049942 /nfs/dbraw/zinc/04/99/42/536049942.db2.gz NREMOPMKWPOWMP-NSHDSACASA-N 1 2 209.293 2.000 20 0 BEADLO CC[C@@]1(C)CC[N@@H+](Cc2noc(C)n2)C1 ZINC000336218862 536049947 /nfs/dbraw/zinc/04/99/47/536049947.db2.gz NREMOPMKWPOWMP-NSHDSACASA-N 1 2 209.293 2.000 20 0 BEADLO CC[C@H]1CCCN1C(=O)c1ccc2[nH+]ccn2c1 ZINC000335669471 536070403 /nfs/dbraw/zinc/07/04/03/536070403.db2.gz OIXUYWNHPSGUAM-LBPRGKRZSA-N 1 2 243.310 2.349 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1ccc(F)cc1 ZINC000335976631 536085800 /nfs/dbraw/zinc/08/58/00/536085800.db2.gz PCPAFMIDERJJBY-UHFFFAOYSA-N 1 2 244.269 2.457 20 0 BEADLO CCc1nc(N2C[C@@H](C)OC(C)(C)C2)cc(C)[nH+]1 ZINC000283747998 536125108 /nfs/dbraw/zinc/12/51/08/536125108.db2.gz KLRGAJQTSDDDBG-LLVKDONJSA-N 1 2 249.358 2.351 20 0 BEADLO CCc1nc(N2C[C@@H](C)OC[C@H]2CC)cc(C)[nH+]1 ZINC000287802651 536125133 /nfs/dbraw/zinc/12/51/33/536125133.db2.gz JUTAMUFAXBLPEZ-VXGBXAGGSA-N 1 2 249.358 2.351 20 0 BEADLO CCc1nc(N2C[C@H](C)O[C@@H](C)[C@H]2C)cc(C)[nH+]1 ZINC000342959626 536126232 /nfs/dbraw/zinc/12/62/32/536126232.db2.gz KVWUWISCXJNTTK-TUAOUCFPSA-N 1 2 249.358 2.350 20 0 BEADLO CCc1nc(N2C[C@H](C)OC(C)(C)C2)cc(C)[nH+]1 ZINC000283748000 536126822 /nfs/dbraw/zinc/12/68/22/536126822.db2.gz KLRGAJQTSDDDBG-NSHDSACASA-N 1 2 249.358 2.351 20 0 BEADLO c1cc(C[NH2+]Cc2ccc3cnccc3c2)[nH]n1 ZINC000232481499 538109946 /nfs/dbraw/zinc/10/99/46/538109946.db2.gz FWIWCIUHLUXFIY-UHFFFAOYSA-N 1 2 238.294 2.248 20 0 BEADLO CCOC1CC(Nc2ccc(OC)c[nH+]2)C1 ZINC000225836838 538114328 /nfs/dbraw/zinc/11/43/28/538114328.db2.gz UJZSUEBWOOFNDN-UHFFFAOYSA-N 1 2 222.288 2.070 20 0 BEADLO COc1ccc(N[C@H](C)[C@H]2CCCO2)[nH+]c1 ZINC000230404781 566311786 /nfs/dbraw/zinc/31/17/86/566311786.db2.gz VHTZCWIOBYNYQY-MWLCHTKSSA-N 1 2 222.288 2.070 20 0 BEADLO Cc1ccc(NC(=O)C(C)(F)F)c(C)[nH+]1 ZINC000295059317 566388427 /nfs/dbraw/zinc/38/84/27/566388427.db2.gz TZPGGHYEAQJHCX-UHFFFAOYSA-N 1 2 214.215 2.292 20 0 BEADLO C/C=C(\C)C(=O)O[C@@H]1CCn2c(C)c[nH+]c21 ZINC000893524702 583157218 /nfs/dbraw/zinc/15/72/18/583157218.db2.gz KKCZJUGGYHHKOB-VMKBVTSJSA-N 1 2 220.272 2.146 20 0 BEADLO Cc1cc[nH+]c(N)c1CN(CC(F)F)C1CC1 ZINC000894014615 583276076 /nfs/dbraw/zinc/27/60/76/583276076.db2.gz NMHWJOLWDVAGRX-UHFFFAOYSA-N 1 2 241.285 2.202 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@H]2CC[C@H](C)C2)c1 ZINC000853508536 588746633 /nfs/dbraw/zinc/74/66/33/588746633.db2.gz IPIHCPKQZHVRLY-JQWIXIFHSA-N 1 2 248.326 2.398 20 0 BEADLO C[N@@H+](CC1=CCSC1)Cn1cc(Cl)cn1 ZINC000853618358 588750439 /nfs/dbraw/zinc/75/04/39/588750439.db2.gz BVVXMBCGAQIHRF-UHFFFAOYSA-N 1 2 243.763 2.099 20 0 BEADLO C[N@H+](CC1=CCSC1)Cn1cc(Cl)cn1 ZINC000853618358 588750440 /nfs/dbraw/zinc/75/04/40/588750440.db2.gz BVVXMBCGAQIHRF-UHFFFAOYSA-N 1 2 243.763 2.099 20 0 BEADLO Cc1cccc(CCCNc2cnc(F)cn2)[nH+]1 ZINC000853608518 588750472 /nfs/dbraw/zinc/75/04/72/588750472.db2.gz CRUONYOIBAPQKF-UHFFFAOYSA-N 1 2 246.289 2.364 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@@H]2CCC2(C)C)c1 ZINC000853623091 588750785 /nfs/dbraw/zinc/75/07/85/588750785.db2.gz NTOZAEWDCKHVAY-LLVKDONJSA-N 1 2 248.326 2.398 20 0 BEADLO CC1=NO[C@H](CNc2cc[nH+]c(C(C)C)n2)C1 ZINC000853660616 588753511 /nfs/dbraw/zinc/75/35/11/588753511.db2.gz IFSAFRLBAMTFSI-JTQLQIEISA-N 1 2 234.303 2.177 20 0 BEADLO CC(C)[C@@H](C)O[NH+]=C(N)Cc1cccnc1 ZINC000853678872 588755233 /nfs/dbraw/zinc/75/52/33/588755233.db2.gz OPWIIPQSJZBTOV-SNVBAGLBSA-N 1 2 221.304 2.167 20 0 BEADLO C1=C[C@H](Nc2cc(N3CCCC3)nc[nH+]2)CC1 ZINC000853801299 588764241 /nfs/dbraw/zinc/76/42/41/588764241.db2.gz UMUXIEOFBDDXDH-NSHDSACASA-N 1 2 230.315 2.207 20 0 BEADLO C1=C[C@H](Nc2cc(N3CCCC3)[nH+]cn2)CC1 ZINC000853801299 588764242 /nfs/dbraw/zinc/76/42/42/588764242.db2.gz UMUXIEOFBDDXDH-NSHDSACASA-N 1 2 230.315 2.207 20 0 BEADLO COCCN(CCF)c1cc[nH+]c(C(C)C)n1 ZINC000853818128 588764748 /nfs/dbraw/zinc/76/47/48/588764748.db2.gz AVFXIONZWRJSMW-UHFFFAOYSA-N 1 2 241.310 2.022 20 0 BEADLO c1cc(N[C@H]2COC3(CCC3)C2)nc(C2CC2)[nH+]1 ZINC000853827386 588765225 /nfs/dbraw/zinc/76/52/25/588765225.db2.gz VAYLLYOXBNKNLJ-LLVKDONJSA-N 1 2 245.326 2.478 20 0 BEADLO CC(C)c1nc(N2C[C@@H](C)[C@H](O)[C@@H](C)C2)cc[nH+]1 ZINC000853833668 588765360 /nfs/dbraw/zinc/76/53/60/588765360.db2.gz KKDQVBCPOJJASI-PJXYFTJBSA-N 1 2 249.358 2.053 20 0 BEADLO CC[C@@H]1C[N@H+](C/C=C/Cl)C[C@H](C)O1 ZINC000111694499 588767464 /nfs/dbraw/zinc/76/74/64/588767464.db2.gz FTYIRQAPPWSEQP-OCIBVNFRSA-N 1 2 203.713 2.238 20 0 BEADLO CC[C@@H]1C[N@@H+](C/C=C/Cl)C[C@H](C)O1 ZINC000111694499 588767465 /nfs/dbraw/zinc/76/74/65/588767465.db2.gz FTYIRQAPPWSEQP-OCIBVNFRSA-N 1 2 203.713 2.238 20 0 BEADLO Cc1csc(C[N@H+]2CCCc3n[nH]cc3C2)n1 ZINC000854055165 588772626 /nfs/dbraw/zinc/77/26/26/588772626.db2.gz WZYOTOLEQMOEDN-UHFFFAOYSA-N 1 2 248.355 2.123 20 0 BEADLO CC[NH2+]Cc1noc([C@H]2CCC2(C)C)n1 ZINC000854132177 588775800 /nfs/dbraw/zinc/77/58/00/588775800.db2.gz OEKBTUKEKCIWOE-MRVPVSSYSA-N 1 2 209.293 2.083 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)[C@@H]1CCCC2(CC2)C1 ZINC000854498664 588789510 /nfs/dbraw/zinc/78/95/10/588789510.db2.gz IXXVSVXHRAFHOB-LLVKDONJSA-N 1 2 247.342 2.007 20 0 BEADLO CCC(C)=C(C)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000854594312 588796216 /nfs/dbraw/zinc/79/62/16/588796216.db2.gz ITSWNIDPEVGZBR-HSTULFTRSA-N 1 2 221.304 2.333 20 0 BEADLO CC/C(C)=C(/C)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000854594312 588796217 /nfs/dbraw/zinc/79/62/17/588796217.db2.gz ITSWNIDPEVGZBR-HSTULFTRSA-N 1 2 221.304 2.333 20 0 BEADLO CC(C(=O)N[C@H](C)c1[nH]cc[nH+]1)=C1CCC1 ZINC000854594402 588796485 /nfs/dbraw/zinc/79/64/85/588796485.db2.gz KPROCSRUEZREGA-SECBINFHSA-N 1 2 219.288 2.087 20 0 BEADLO CCC[C@H](NC(=O)Cc1[nH]cc[nH+]1)C(C)(C)C ZINC000854779813 588808966 /nfs/dbraw/zinc/80/89/66/588808966.db2.gz HUWMZIODHXDQAY-JTQLQIEISA-N 1 2 237.347 2.283 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)NCC1CCCCCC1 ZINC000854819368 588812047 /nfs/dbraw/zinc/81/20/47/588812047.db2.gz VXQSLXRKHWCVRH-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO C[C@@H]1CCCC[C@]1(C)NC(=O)Cc1[nH]cc[nH+]1 ZINC000854902469 588816155 /nfs/dbraw/zinc/81/61/55/588816155.db2.gz DUODNIZEIZZTLZ-MFKMUULPSA-N 1 2 235.331 2.037 20 0 BEADLO CCC/C(C)=C\C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000855134416 588822654 /nfs/dbraw/zinc/82/26/54/588822654.db2.gz NSRDYYTZLORZPF-POHAHGRESA-N 1 2 221.304 2.115 20 0 BEADLO CCC/C(C)=C\C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000855134416 588822655 /nfs/dbraw/zinc/82/26/55/588822655.db2.gz NSRDYYTZLORZPF-POHAHGRESA-N 1 2 221.304 2.115 20 0 BEADLO C[C@H]1CC/C(=C\C(=O)N(C)Cc2c[nH+]c[nH]2)C1 ZINC000855134170 588822992 /nfs/dbraw/zinc/82/29/92/588822992.db2.gz HNVSSYNUZTYHTG-OTXQMUPVSA-N 1 2 233.315 2.115 20 0 BEADLO C[C@H]1CC/C(=C\C(=O)N(C)Cc2c[nH]c[nH+]2)C1 ZINC000855134170 588822993 /nfs/dbraw/zinc/82/29/93/588822993.db2.gz HNVSSYNUZTYHTG-OTXQMUPVSA-N 1 2 233.315 2.115 20 0 BEADLO Cc1nc(N2CC[C@H]3C[C@H]32)c(C)c(C)[nH+]1 ZINC000804689406 582527016 /nfs/dbraw/zinc/52/70/16/582527016.db2.gz OIPMQLUIACHPNQ-WDEREUQCSA-N 1 2 203.289 2.000 20 0 BEADLO C[C@@H](CC(=O)N[C@@H]1CC=CC[C@H]1C)n1cc[nH+]c1 ZINC000890765595 582542527 /nfs/dbraw/zinc/54/25/27/582542527.db2.gz LUOWZAIKASAHSB-FRRDWIJNSA-N 1 2 247.342 2.305 20 0 BEADLO Cc1[nH+]c2ccccn2c1CNC(=O)C1(C)CC1 ZINC000890853093 582581007 /nfs/dbraw/zinc/58/10/07/582581007.db2.gz IBUVETBYPYPLPN-UHFFFAOYSA-N 1 2 243.310 2.059 20 0 BEADLO CCONC(=O)C[NH2+][C@H](C)C1CCCCCC1 ZINC000846091913 582644971 /nfs/dbraw/zinc/64/49/71/582644971.db2.gz QQHKGYJNHALMTB-LLVKDONJSA-N 1 2 242.363 2.003 20 0 BEADLO C[C@H](O)CNc1cc(C2CC2)[nH+]c(C2CC2)n1 ZINC000891437933 582685008 /nfs/dbraw/zinc/68/50/08/582685008.db2.gz YQKARNATXFQMPJ-QMMMGPOBSA-N 1 2 233.315 2.024 20 0 BEADLO Cn1nc2c(c1C[N@H+](C)Cc1ccco1)CCC2 ZINC000891486530 582692493 /nfs/dbraw/zinc/69/24/93/582692493.db2.gz AENVIMCVJLGZJN-UHFFFAOYSA-N 1 2 245.326 2.134 20 0 BEADLO Cn1nc2c(c1C[N@@H+](C)Cc1ccco1)CCC2 ZINC000891486530 582692494 /nfs/dbraw/zinc/69/24/94/582692494.db2.gz AENVIMCVJLGZJN-UHFFFAOYSA-N 1 2 245.326 2.134 20 0 BEADLO CCOc1ccc(C[N@H+](C)Cc2cnn(C)c2)o1 ZINC000891508448 582693597 /nfs/dbraw/zinc/69/35/97/582693597.db2.gz DCCHTGJONMURTG-UHFFFAOYSA-N 1 2 249.314 2.044 20 0 BEADLO CCOc1ccc(C[N@@H+](C)Cc2cnn(C)c2)o1 ZINC000891508448 582693598 /nfs/dbraw/zinc/69/35/98/582693598.db2.gz DCCHTGJONMURTG-UHFFFAOYSA-N 1 2 249.314 2.044 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccnn2C2CCC2)CCO1 ZINC000891561382 582697267 /nfs/dbraw/zinc/69/72/67/582697267.db2.gz ATAWWJZNDFJWOR-CQSZACIVSA-N 1 2 249.358 2.219 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccnn2C2CCC2)CCO1 ZINC000891561382 582697272 /nfs/dbraw/zinc/69/72/72/582697272.db2.gz ATAWWJZNDFJWOR-CQSZACIVSA-N 1 2 249.358 2.219 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cnc(F)c(C)c2)CCO1 ZINC000891561534 582697567 /nfs/dbraw/zinc/69/75/67/582697567.db2.gz CWXHTNVCTZBHOA-GFCCVEGCSA-N 1 2 238.306 2.140 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cnc(F)c(C)c2)CCO1 ZINC000891561534 582697569 /nfs/dbraw/zinc/69/75/69/582697569.db2.gz CWXHTNVCTZBHOA-GFCCVEGCSA-N 1 2 238.306 2.140 20 0 BEADLO Cc1cc(F)ncc1C[N@H+]1C[C@H](C)OC[C@H]1C ZINC000891672619 582708663 /nfs/dbraw/zinc/70/86/63/582708663.db2.gz WMVCGSCPBXHPTB-MNOVXSKESA-N 1 2 238.306 2.138 20 0 BEADLO Cc1cc(F)ncc1C[N@@H+]1C[C@H](C)OC[C@H]1C ZINC000891672619 582708664 /nfs/dbraw/zinc/70/86/64/582708664.db2.gz WMVCGSCPBXHPTB-MNOVXSKESA-N 1 2 238.306 2.138 20 0 BEADLO CCOc1ccc(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)o1 ZINC000891672350 582708774 /nfs/dbraw/zinc/70/87/74/582708774.db2.gz VRZAPJGYGXPWFW-WDEREUQCSA-N 1 2 239.315 2.288 20 0 BEADLO CCOc1ccc(C[N@H+]2C[C@@H](C)OC[C@@H]2C)o1 ZINC000891672350 582708775 /nfs/dbraw/zinc/70/87/75/582708775.db2.gz VRZAPJGYGXPWFW-WDEREUQCSA-N 1 2 239.315 2.288 20 0 BEADLO C[C@H](O)c1cccc(NCCc2cccnc2)[nH+]1 ZINC000891683913 582709884 /nfs/dbraw/zinc/70/98/84/582709884.db2.gz BFZGIAFSXBFAJA-NSHDSACASA-N 1 2 243.310 2.185 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1cnc(F)cc1C ZINC000891716315 582712889 /nfs/dbraw/zinc/71/28/89/582712889.db2.gz OCMVXCYNOZVZPL-LBPRGKRZSA-N 1 2 238.306 2.140 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1cnc(F)cc1C ZINC000891716315 582712890 /nfs/dbraw/zinc/71/28/90/582712890.db2.gz OCMVXCYNOZVZPL-LBPRGKRZSA-N 1 2 238.306 2.140 20 0 BEADLO CN(C)c1cc(NCC2CCCC2)[nH+]cn1 ZINC000891753955 582716847 /nfs/dbraw/zinc/71/68/47/582716847.db2.gz IXYXQYBUPHZZJQ-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO CN(C)c1cc(NCC2CCCC2)nc[nH+]1 ZINC000891753955 582716850 /nfs/dbraw/zinc/71/68/50/582716850.db2.gz IXYXQYBUPHZZJQ-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO C[C@H](Cc1ccco1)Nc1cc(N(C)C)nc[nH+]1 ZINC000891762246 582717461 /nfs/dbraw/zinc/71/74/61/582717461.db2.gz DNAOLZOYQKZBCG-SNVBAGLBSA-N 1 2 246.314 2.179 20 0 BEADLO C[C@H](Cc1ccco1)Nc1cc(N(C)C)[nH+]cn1 ZINC000891762246 582717462 /nfs/dbraw/zinc/71/74/62/582717462.db2.gz DNAOLZOYQKZBCG-SNVBAGLBSA-N 1 2 246.314 2.179 20 0 BEADLO CC[C@H]1CCCN(c2cc(N(C)C)[nH+]cn2)C1 ZINC000891784224 582721315 /nfs/dbraw/zinc/72/13/15/582721315.db2.gz VFWPTPAVCGZJEY-NSHDSACASA-N 1 2 234.347 2.169 20 0 BEADLO CC[C@H]1CCCN(c2cc(N(C)C)nc[nH+]2)C1 ZINC000891784224 582721318 /nfs/dbraw/zinc/72/13/18/582721318.db2.gz VFWPTPAVCGZJEY-NSHDSACASA-N 1 2 234.347 2.169 20 0 BEADLO CCc1cc(NCCCCOC)nc(CC)[nH+]1 ZINC000891849458 582730114 /nfs/dbraw/zinc/73/01/14/582730114.db2.gz HSLHFZMRSCUMOG-UHFFFAOYSA-N 1 2 237.347 2.440 20 0 BEADLO CCOCCNc1cc(CC)[nH+]c(CC)n1 ZINC000891886163 582734734 /nfs/dbraw/zinc/73/47/34/582734734.db2.gz ZWPXUPNXZGIVAX-UHFFFAOYSA-N 1 2 223.320 2.050 20 0 BEADLO Cc1cnc(Cl)c(C[N@@H+](C)[C@H]2CCOC2)c1 ZINC000891934273 582739687 /nfs/dbraw/zinc/73/96/87/582739687.db2.gz DVGQWEVYIBINFP-NSHDSACASA-N 1 2 240.734 2.264 20 0 BEADLO Cc1cnc(Cl)c(C[N@H+](C)[C@H]2CCOC2)c1 ZINC000891934273 582739688 /nfs/dbraw/zinc/73/96/88/582739688.db2.gz DVGQWEVYIBINFP-NSHDSACASA-N 1 2 240.734 2.264 20 0 BEADLO C[C@H](O)c1cccc(NC[C@@H]2CCCCO2)[nH+]1 ZINC000892003048 582759023 /nfs/dbraw/zinc/75/90/23/582759023.db2.gz YCPLBXQMHYRCRP-QWRGUYRKSA-N 1 2 236.315 2.116 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2C[C@@H]2[C@H]2C[C@@H]2C)c(C)c[nH+]1 ZINC000866860624 582766114 /nfs/dbraw/zinc/76/61/14/582766114.db2.gz ZGKAKYARTWEEEF-HWNAMQAFSA-N 1 2 244.338 2.351 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@@H](C)[C@@H]2C)cnc1F ZINC000892049261 582774121 /nfs/dbraw/zinc/77/41/21/582774121.db2.gz QKUUXBCNUZWNSM-QWRGUYRKSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@@H](C)[C@@H]2C)cnc1F ZINC000892049261 582774123 /nfs/dbraw/zinc/77/41/23/582774123.db2.gz QKUUXBCNUZWNSM-QWRGUYRKSA-N 1 2 238.306 2.138 20 0 BEADLO C[C@@H]1OCC[N@H+](Cc2cnn(C3CCC3)c2)[C@H]1C ZINC000892049178 582774438 /nfs/dbraw/zinc/77/44/38/582774438.db2.gz PGBJRCCIKAQHQV-RYUDHWBXSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@@H]1OCC[N@@H+](Cc2cnn(C3CCC3)c2)[C@H]1C ZINC000892049178 582774440 /nfs/dbraw/zinc/77/44/40/582774440.db2.gz PGBJRCCIKAQHQV-RYUDHWBXSA-N 1 2 249.358 2.217 20 0 BEADLO COc1ccc(C[N@@H+]2CCOCC23CCC3)o1 ZINC000892068431 582784400 /nfs/dbraw/zinc/78/44/00/582784400.db2.gz NLZJTCAQZFCCGJ-UHFFFAOYSA-N 1 2 237.299 2.043 20 0 BEADLO COc1ccc(C[N@H+]2CCOCC23CCC3)o1 ZINC000892068431 582784402 /nfs/dbraw/zinc/78/44/02/582784402.db2.gz NLZJTCAQZFCCGJ-UHFFFAOYSA-N 1 2 237.299 2.043 20 0 BEADLO COc1ccc(C[N@@H+]2CCOC(C)(C)[C@H]2C)o1 ZINC000892067922 582784867 /nfs/dbraw/zinc/78/48/67/582784867.db2.gz CMLVCFYJMIIGFF-SNVBAGLBSA-N 1 2 239.315 2.288 20 0 BEADLO COc1ccc(C[N@H+]2CCOC(C)(C)[C@H]2C)o1 ZINC000892067922 582784868 /nfs/dbraw/zinc/78/48/68/582784868.db2.gz CMLVCFYJMIIGFF-SNVBAGLBSA-N 1 2 239.315 2.288 20 0 BEADLO Cc1cccn2c(NC(=O)C(C)(F)F)c[nH+]c12 ZINC000855902110 588853215 /nfs/dbraw/zinc/85/32/15/588853215.db2.gz DFSQGINXGOUCQU-UHFFFAOYSA-N 1 2 239.225 2.236 20 0 BEADLO CCc1cc(N[C@@H]2CCCC[C@H]2O)nc(CC)[nH+]1 ZINC000892243852 582812783 /nfs/dbraw/zinc/81/27/83/582812783.db2.gz DMQYWYLDEIGTIE-VXGBXAGGSA-N 1 2 249.358 2.317 20 0 BEADLO CCc1cc(N[C@H](C)CCOC)nc(CC)[nH+]1 ZINC000892250582 582813264 /nfs/dbraw/zinc/81/32/64/582813264.db2.gz AUJUQQYHOBOLTA-SNVBAGLBSA-N 1 2 237.347 2.438 20 0 BEADLO C[C@@H]1CC[N@H+](Cn2sc3ccccc3c2=O)C1 ZINC000725777379 582848370 /nfs/dbraw/zinc/84/83/70/582848370.db2.gz FQMYGFYWWBAIQR-SNVBAGLBSA-N 1 2 248.351 2.362 20 0 BEADLO C[C@@H]1CC[N@@H+](Cn2sc3ccccc3c2=O)C1 ZINC000725777379 582848371 /nfs/dbraw/zinc/84/83/71/582848371.db2.gz FQMYGFYWWBAIQR-SNVBAGLBSA-N 1 2 248.351 2.362 20 0 BEADLO C[C@@H](CCO)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000892341687 582861645 /nfs/dbraw/zinc/86/16/45/582861645.db2.gz ZPGCNWWAFBVYFG-NSHDSACASA-N 1 2 245.326 2.270 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@H]1CCC(C)(C)C1 ZINC000781804541 582866361 /nfs/dbraw/zinc/86/63/61/582866361.db2.gz AABVJQVMCGRILF-JTQLQIEISA-N 1 2 236.315 2.290 20 0 BEADLO Cc1cc(N(C)[C@H]2CCOC2)nc(C2CCC2)[nH+]1 ZINC000892404795 582877628 /nfs/dbraw/zinc/87/76/28/582877628.db2.gz JQYVUIIKEWMKOT-LBPRGKRZSA-N 1 2 247.342 2.278 20 0 BEADLO CC[C@H](C)CN(C)c1nccn2c[nH+]cc12 ZINC000892455039 582891207 /nfs/dbraw/zinc/89/12/07/582891207.db2.gz XPNWEKLAILCWFB-JTQLQIEISA-N 1 2 218.304 2.212 20 0 BEADLO CCc1cc(CNc2cccc([C@@H](C)O)[nH+]2)[nH]n1 ZINC000892504745 582900883 /nfs/dbraw/zinc/90/08/83/582900883.db2.gz ALSLJMVLGQHSIV-SECBINFHSA-N 1 2 246.314 2.033 20 0 BEADLO C[C@@H](O)c1cccc(NCCc2cscn2)[nH+]1 ZINC000892597058 582924512 /nfs/dbraw/zinc/92/45/12/582924512.db2.gz NNLKLFXOQMLPCS-SECBINFHSA-N 1 2 249.339 2.246 20 0 BEADLO CCc1cc(N[C@H](CC)COC)nc(CC)[nH+]1 ZINC000892620548 582932249 /nfs/dbraw/zinc/93/22/49/582932249.db2.gz CBPVPYISTVIFPZ-LLVKDONJSA-N 1 2 237.347 2.438 20 0 BEADLO CCc1cc(N(C)Cc2ccon2)nc(CC)[nH+]1 ZINC000892637396 582936092 /nfs/dbraw/zinc/93/60/92/582936092.db2.gz PFIKXOHDWGTKSX-UHFFFAOYSA-N 1 2 246.314 2.226 20 0 BEADLO Cc1occc1C[NH2+]Cc1nccn1C1CC1 ZINC000892657864 582942573 /nfs/dbraw/zinc/94/25/73/582942573.db2.gz FCVUJIJUGBSFLI-UHFFFAOYSA-N 1 2 231.299 2.409 20 0 BEADLO C[C@@H](O)c1cccc(N[C@H](C)c2cnn(C)c2)[nH+]1 ZINC000892663743 582944160 /nfs/dbraw/zinc/94/41/60/582944160.db2.gz ULHMQFCZWQAONM-NXEZZACHSA-N 1 2 246.314 2.042 20 0 BEADLO C[C@H](O)c1cccc(N[C@@H](C)c2cnn(C)c2)[nH+]1 ZINC000892663744 582944292 /nfs/dbraw/zinc/94/42/92/582944292.db2.gz ULHMQFCZWQAONM-UWVGGRQHSA-N 1 2 246.314 2.042 20 0 BEADLO CCC(F)(F)COC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000851493193 582960519 /nfs/dbraw/zinc/96/05/19/582960519.db2.gz MGWWGJMNGGIZJU-VIFPVBQESA-N 1 2 246.257 2.423 20 0 BEADLO CC[C@@H]1CCC[C@H](C)N1C(=O)Cc1[nH]cc[nH+]1 ZINC000856273927 588866419 /nfs/dbraw/zinc/86/64/19/588866419.db2.gz UGPLKTLFNXVQCH-WDEREUQCSA-N 1 2 235.331 2.132 20 0 BEADLO C[C@H](NC(=O)C=C1CCCC1)c1[nH+]ccn1C ZINC000856277454 588866594 /nfs/dbraw/zinc/86/65/94/588866594.db2.gz JTKKJXNKDCSKGF-JTQLQIEISA-N 1 2 233.315 2.098 20 0 BEADLO CC(C(=O)N[C@@H](C)c1[nH+]ccn1C)=C1CCCC1 ZINC000856277489 588866630 /nfs/dbraw/zinc/86/66/30/588866630.db2.gz KMQGSJRGPROCSC-NSHDSACASA-N 1 2 247.342 2.488 20 0 BEADLO C[C@@H](NC(=O)C=C1CCCCC1)c1[nH+]ccn1C ZINC000856277684 588866720 /nfs/dbraw/zinc/86/67/20/588866720.db2.gz OLYLFEZUESTNBP-LLVKDONJSA-N 1 2 247.342 2.488 20 0 BEADLO CC/C(C)=C(\C)C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000856281387 588866931 /nfs/dbraw/zinc/86/69/31/588866931.db2.gz OBWJODKDMSNIAG-PBQZMEPESA-N 1 2 235.331 2.344 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2cnon2)cc1 ZINC000851893910 582977509 /nfs/dbraw/zinc/97/75/09/582977509.db2.gz MVWDZKVGNVCIOG-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO CC(C)[C@H](F)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000784112502 582978821 /nfs/dbraw/zinc/97/88/21/582978821.db2.gz LHVZESIVYKACJL-NSHDSACASA-N 1 2 235.262 2.267 20 0 BEADLO Cc1cn2ccc(NC(=O)C(C)(C)F)cc2[nH+]1 ZINC000856287537 588867375 /nfs/dbraw/zinc/86/73/75/588867375.db2.gz DKYVOUKVENBLSB-UHFFFAOYSA-N 1 2 235.262 2.329 20 0 BEADLO Cc1cn2ccc(NC(=O)C(C)(F)F)cc2[nH+]1 ZINC000856287406 588867407 /nfs/dbraw/zinc/86/74/07/588867407.db2.gz XXXACABGMJSFOI-UHFFFAOYSA-N 1 2 239.225 2.236 20 0 BEADLO CC1(C)OC[C@@H](C[N@@H+]2CCCC[C@H]2C(F)F)O1 ZINC000852016023 582993111 /nfs/dbraw/zinc/99/31/11/582993111.db2.gz SJNSRQMXUGGDJJ-ZJUUUORDSA-N 1 2 249.301 2.258 20 0 BEADLO CC1(C)OC[C@@H](C[N@H+]2CCCC[C@H]2C(F)F)O1 ZINC000852016023 582993114 /nfs/dbraw/zinc/99/31/14/582993114.db2.gz SJNSRQMXUGGDJJ-ZJUUUORDSA-N 1 2 249.301 2.258 20 0 BEADLO C[C@@H](N(C)c1nccn2c[nH+]cc12)C1(C)CC1 ZINC000892872152 582999959 /nfs/dbraw/zinc/99/99/59/582999959.db2.gz CLZQOVCOJHYHIY-SNVBAGLBSA-N 1 2 230.315 2.354 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cccc(F)n2)[C@H](C)CO1 ZINC000852211421 583009569 /nfs/dbraw/zinc/00/95/69/583009569.db2.gz JZZSCWFKSMBECR-ZYHUDNBSSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cccc(F)n2)[C@H](C)CO1 ZINC000852211421 583009570 /nfs/dbraw/zinc/00/95/70/583009570.db2.gz JZZSCWFKSMBECR-ZYHUDNBSSA-N 1 2 238.306 2.220 20 0 BEADLO Cc1cc(N[C@@H]2CCOC2)nc(C2CCC2)[nH+]1 ZINC000892953878 583018165 /nfs/dbraw/zinc/01/81/65/583018165.db2.gz MOXZGMDYIWWLML-LLVKDONJSA-N 1 2 233.315 2.253 20 0 BEADLO CCc1cc(N2CCOC[C@@H](C)C2)nc(CC)[nH+]1 ZINC000892973696 583023902 /nfs/dbraw/zinc/02/39/02/583023902.db2.gz VPEDGNUCBWJDTF-NSHDSACASA-N 1 2 249.358 2.074 20 0 BEADLO CCc1cc(N[C@]2(C)CCOC2)nc(CC)[nH+]1 ZINC000892986115 583025744 /nfs/dbraw/zinc/02/57/44/583025744.db2.gz SYTFLWPHOCBQEQ-CYBMUJFWSA-N 1 2 235.331 2.192 20 0 BEADLO CCc1cc(NC(C)(C)[C@H](C)O)nc(CC)[nH+]1 ZINC000893038746 583034570 /nfs/dbraw/zinc/03/45/70/583034570.db2.gz WPUACGLYLOZXAN-VIFPVBQESA-N 1 2 237.347 2.173 20 0 BEADLO C[C@H]1CCN(c2cc(N(C)C)[nH+]cn2)C[C@H]1C ZINC000893055487 583038370 /nfs/dbraw/zinc/03/83/70/583038370.db2.gz FCTAZIREGCACLP-WDEREUQCSA-N 1 2 234.347 2.025 20 0 BEADLO C[C@H]1CCN(c2cc(N(C)C)nc[nH+]2)C[C@H]1C ZINC000893055487 583038372 /nfs/dbraw/zinc/03/83/72/583038372.db2.gz FCTAZIREGCACLP-WDEREUQCSA-N 1 2 234.347 2.025 20 0 BEADLO C[C@@H]1CCN(c2nccn3c[nH+]cc23)C[C@H]1C ZINC000893055413 583038458 /nfs/dbraw/zinc/03/84/58/583038458.db2.gz CHWBWVPWGMISTO-GHMZBOCLSA-N 1 2 230.315 2.212 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1c1cc(N(C)C)[nH+]cn1 ZINC000893092805 583048517 /nfs/dbraw/zinc/04/85/17/583048517.db2.gz RWZZLNSTPQNULS-GHMZBOCLSA-N 1 2 234.347 2.310 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1c1cc(N(C)C)nc[nH+]1 ZINC000893092805 583048518 /nfs/dbraw/zinc/04/85/18/583048518.db2.gz RWZZLNSTPQNULS-GHMZBOCLSA-N 1 2 234.347 2.310 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)N1CCC[C@@H]2CCCC[C@@H]21 ZINC000856501051 588874131 /nfs/dbraw/zinc/87/41/31/588874131.db2.gz PTLWBVKEBFIUEM-RYUDHWBXSA-N 1 2 247.342 2.133 20 0 BEADLO CCc1cc(NCC[C@H]2CCOC2)nc(CC)[nH+]1 ZINC000893143614 583056350 /nfs/dbraw/zinc/05/63/50/583056350.db2.gz LXWMCFOIKIJTEP-NSHDSACASA-N 1 2 249.358 2.440 20 0 BEADLO Fc1cccnc1CNCc1[nH+]ccn1C1CC1 ZINC000893184328 583066686 /nfs/dbraw/zinc/06/66/86/583066686.db2.gz XFVZHFUZIOOZBJ-UHFFFAOYSA-N 1 2 246.289 2.042 20 0 BEADLO COc1cc[nH+]cc1NCc1nccn1C1CC1 ZINC000893198907 583069330 /nfs/dbraw/zinc/06/93/30/583069330.db2.gz ZLBFNJLFRYOFRD-UHFFFAOYSA-N 1 2 244.298 2.234 20 0 BEADLO c1nc(C[NH2+][C@H]2CCCc3cccnc32)co1 ZINC000397875826 583110389 /nfs/dbraw/zinc/11/03/89/583110389.db2.gz VSOKGFWEOVSKCY-LBPRGKRZSA-N 1 2 229.283 2.237 20 0 BEADLO CC[C@@H]([NH2+]Cc1cocn1)c1ccc(F)cn1 ZINC000397990071 583115021 /nfs/dbraw/zinc/11/50/21/583115021.db2.gz WMQWEHVDDGGCTF-LLVKDONJSA-N 1 2 235.262 2.450 20 0 BEADLO C[C@@H]1CC[C@@H](Nc2cc(N(C)C)nc[nH+]2)C1 ZINC000893369334 583128870 /nfs/dbraw/zinc/12/88/70/583128870.db2.gz RKMFBIKYKGLJMR-NXEZZACHSA-N 1 2 220.320 2.143 20 0 BEADLO C[C@@H]1CC[C@@H](Nc2cc(N(C)C)[nH+]cn2)C1 ZINC000893369334 583128872 /nfs/dbraw/zinc/12/88/72/583128872.db2.gz RKMFBIKYKGLJMR-NXEZZACHSA-N 1 2 220.320 2.143 20 0 BEADLO CNc1cc(N2CC3(CCC3)C[C@H]2C)nc[nH+]1 ZINC000893498942 583154071 /nfs/dbraw/zinc/15/40/71/583154071.db2.gz RFRZSZILTUCPSM-SNVBAGLBSA-N 1 2 232.331 2.287 20 0 BEADLO CNc1cc(N2CC3(CCC3)C[C@H]2C)[nH+]cn1 ZINC000893498942 583154073 /nfs/dbraw/zinc/15/40/73/583154073.db2.gz RFRZSZILTUCPSM-SNVBAGLBSA-N 1 2 232.331 2.287 20 0 BEADLO Cc1c[nH+]c2n1CC[C@@H]2OC(=O)C1CCCC1 ZINC000893514933 583155557 /nfs/dbraw/zinc/15/55/57/583155557.db2.gz CWZCZGBHITYDFK-NSHDSACASA-N 1 2 234.299 2.370 20 0 BEADLO Cc1c[nH+]c2n1CC[C@H]2OC(=O)C(C)(C)C ZINC000893517417 583155580 /nfs/dbraw/zinc/15/55/80/583155580.db2.gz FSZHUKLJSCVPDR-SECBINFHSA-N 1 2 222.288 2.226 20 0 BEADLO Cc1c[nH+]c2n1CC[C@H]2OC(=O)[C@H]1CC1(C)C ZINC000893524341 583157479 /nfs/dbraw/zinc/15/74/79/583157479.db2.gz IZEDKRUSZOWHRG-NXEZZACHSA-N 1 2 234.299 2.226 20 0 BEADLO Cn1cc(C[NH+]2CCC(F)(F)CC2)c(Cl)n1 ZINC000857042574 588883380 /nfs/dbraw/zinc/88/33/80/588883380.db2.gz QOYYMXHFQKESRR-UHFFFAOYSA-N 1 2 249.692 2.305 20 0 BEADLO Cc1nccnc1C[N@@H+]1CCC[C@](C)(F)C1 ZINC000857047417 588884241 /nfs/dbraw/zinc/88/42/41/588884241.db2.gz BTMQWNHWMBIQSZ-LBPRGKRZSA-N 1 2 223.295 2.109 20 0 BEADLO Cc1nccnc1C[N@H+]1CCC[C@](C)(F)C1 ZINC000857047417 588884242 /nfs/dbraw/zinc/88/42/42/588884242.db2.gz BTMQWNHWMBIQSZ-LBPRGKRZSA-N 1 2 223.295 2.109 20 0 BEADLO CCc1cc(NCCC2(O)CCC2)nc(CC)[nH+]1 ZINC000893743855 583217371 /nfs/dbraw/zinc/21/73/71/583217371.db2.gz JUQRHJDQJYBTFF-UHFFFAOYSA-N 1 2 249.358 2.318 20 0 BEADLO COc1ccc(F)c(C[NH2+][C@H](C)c2ncc[nH]2)c1 ZINC000857080903 588885915 /nfs/dbraw/zinc/88/59/15/588885915.db2.gz LMRKVJUXFKTNSL-SECBINFHSA-N 1 2 249.289 2.408 20 0 BEADLO c1[nH+]cn2ccnc(N3CCC[C@@H](C4CC4)C3)c12 ZINC000893885441 583240732 /nfs/dbraw/zinc/24/07/32/583240732.db2.gz NPWKNMBMMXMEIA-GFCCVEGCSA-N 1 2 242.326 2.356 20 0 BEADLO CCOCC[N@H+](CC)Cc1nc(C(C)C)c[nH]1 ZINC000893978911 583266800 /nfs/dbraw/zinc/26/68/00/583266800.db2.gz XXEMFIZANWURPT-UHFFFAOYSA-N 1 2 239.363 2.392 20 0 BEADLO CCOCC[N@@H+](CC)Cc1nc(C(C)C)c[nH]1 ZINC000893978911 583266803 /nfs/dbraw/zinc/26/68/03/583266803.db2.gz XXEMFIZANWURPT-UHFFFAOYSA-N 1 2 239.363 2.392 20 0 BEADLO CC[C@@H]1COCCN1Cc1[nH]cc(C(C)C)[nH+]1 ZINC000893995798 583268259 /nfs/dbraw/zinc/26/82/59/583268259.db2.gz SOANNWVATHZIQT-LLVKDONJSA-N 1 2 237.347 2.144 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+]2CCS[C@H](C)C2)n1 ZINC000894000681 583271364 /nfs/dbraw/zinc/27/13/64/583271364.db2.gz HPDHFJNMSMLPDY-SNVBAGLBSA-N 1 2 239.388 2.470 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+]2CCS[C@H](C)C2)n1 ZINC000894000681 583271366 /nfs/dbraw/zinc/27/13/66/583271366.db2.gz HPDHFJNMSMLPDY-SNVBAGLBSA-N 1 2 239.388 2.470 20 0 BEADLO CSC[C@@H]1CCC[N@@H+]1Cc1n[nH]c(C)c1C ZINC000894072137 583296347 /nfs/dbraw/zinc/29/63/47/583296347.db2.gz RDUYMCGTPGMFDA-NSHDSACASA-N 1 2 239.388 2.354 20 0 BEADLO CSC[C@@H]1CCC[N@H+]1Cc1n[nH]c(C)c1C ZINC000894072137 583296349 /nfs/dbraw/zinc/29/63/49/583296349.db2.gz RDUYMCGTPGMFDA-NSHDSACASA-N 1 2 239.388 2.354 20 0 BEADLO C[C@@H](O)c1cccc(NC[C@@H]2CC[C@@H](C)O2)[nH+]1 ZINC000894152030 583319208 /nfs/dbraw/zinc/31/92/08/583319208.db2.gz HXUQVCDBKISYBP-MXWKQRLJSA-N 1 2 236.315 2.114 20 0 BEADLO C[C@@H](O)c1cccc(N[C@@H](C)c2ccn(C)n2)[nH+]1 ZINC000894168030 583324706 /nfs/dbraw/zinc/32/47/06/583324706.db2.gz PSCJNLWKAKHVAS-VHSXEESVSA-N 1 2 246.314 2.042 20 0 BEADLO Cc1ncoc1C[NH2+]Cc1cccc2c1OCO2 ZINC000894198641 583336326 /nfs/dbraw/zinc/33/63/26/583336326.db2.gz DPULLNCKWSXIJO-UHFFFAOYSA-N 1 2 246.266 2.002 20 0 BEADLO CC1(O)C[NH+](CCc2ccc(F)cc2Cl)C1 ZINC000877580794 583338043 /nfs/dbraw/zinc/33/80/43/583338043.db2.gz IFIMDUFPLROLBS-UHFFFAOYSA-N 1 2 243.709 2.088 20 0 BEADLO Cc1ncsc1C[NH+]1CC(OC(C)(C)C)C1 ZINC000877770339 583347011 /nfs/dbraw/zinc/34/70/11/583347011.db2.gz UBNWSEDFVMXOFH-UHFFFAOYSA-N 1 2 240.372 2.451 20 0 BEADLO CO[C@H]1C[C@@H](C[N@H+](CCCO)c2ccccc2)C1 ZINC000878180530 583366563 /nfs/dbraw/zinc/36/65/63/583366563.db2.gz BQNUGLMJRUFAKD-OTVXOJSOSA-N 1 2 249.354 2.300 20 0 BEADLO CO[C@H]1C[C@@H](C[N@@H+](CCCO)c2ccccc2)C1 ZINC000878180530 583366567 /nfs/dbraw/zinc/36/65/67/583366567.db2.gz BQNUGLMJRUFAKD-OTVXOJSOSA-N 1 2 249.354 2.300 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OCc1ccc(Cl)s1 ZINC000747868493 583401570 /nfs/dbraw/zinc/40/15/70/583401570.db2.gz XFJVJXXTAHIHML-LURJTMIESA-N 1 2 248.735 2.435 20 0 BEADLO Cc1ncoc1C[NH2+][C@H](C)c1c(C)noc1C ZINC000894277171 583406274 /nfs/dbraw/zinc/40/62/74/583406274.db2.gz RCJQUZLVSSGZBL-MRVPVSSYSA-N 1 2 235.287 2.439 20 0 BEADLO C[C@H](O)c1cccc(N[C@@H]2C[C@H]3C[C@H]3C2)[nH+]1 ZINC000894281447 583408557 /nfs/dbraw/zinc/40/85/57/583408557.db2.gz QSVVRZNDSKWWKK-MMWGEVLESA-N 1 2 218.300 2.345 20 0 BEADLO O=C1CCN1C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000857231488 588897182 /nfs/dbraw/zinc/89/71/82/588897182.db2.gz KNHGXBCBULERDU-CYBMUJFWSA-N 1 2 248.301 2.152 20 0 BEADLO O=C1CCN1C[N@@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000857231488 588897183 /nfs/dbraw/zinc/89/71/83/588897183.db2.gz KNHGXBCBULERDU-CYBMUJFWSA-N 1 2 248.301 2.152 20 0 BEADLO Clc1cccc2c1OC[C@H]2[NH2+]Cc1cnc[nH]1 ZINC000894344344 583430362 /nfs/dbraw/zinc/43/03/62/583430362.db2.gz QKPBSFSYXQEFSK-LLVKDONJSA-N 1 2 249.701 2.286 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CCCC3(CC3)C2)c1C ZINC000894482452 583469088 /nfs/dbraw/zinc/46/90/88/583469088.db2.gz FVOKYKPFIFCIGD-UHFFFAOYSA-N 1 2 219.332 2.403 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CCCC3(CC3)C2)c1C ZINC000894482452 583469090 /nfs/dbraw/zinc/46/90/90/583469090.db2.gz FVOKYKPFIFCIGD-UHFFFAOYSA-N 1 2 219.332 2.403 20 0 BEADLO CC[C@]1(C)COCC[N@@H+]1Cc1[nH]nc(C)c1C ZINC000894486312 583472081 /nfs/dbraw/zinc/47/20/81/583472081.db2.gz XUHRYODQSRCBMW-CYBMUJFWSA-N 1 2 237.347 2.027 20 0 BEADLO CC[C@]1(C)COCC[N@H+]1Cc1[nH]nc(C)c1C ZINC000894486312 583472082 /nfs/dbraw/zinc/47/20/82/583472082.db2.gz XUHRYODQSRCBMW-CYBMUJFWSA-N 1 2 237.347 2.027 20 0 BEADLO Cc1noc([C@@H](C)[NH2+][C@H]2CCc3cccnc32)n1 ZINC000894542147 583480539 /nfs/dbraw/zinc/48/05/39/583480539.db2.gz GNGWHRZGSXOUPI-KCJUWKMLSA-N 1 2 244.298 2.111 20 0 BEADLO COc1cc(F)cc(CN(C)Cc2[nH]cc[nH+]2)c1 ZINC000894586942 583490173 /nfs/dbraw/zinc/49/01/73/583490173.db2.gz NICJDBBSISRMBZ-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1cc(O)cc(Cl)c1 ZINC000894613053 583494233 /nfs/dbraw/zinc/49/42/33/583494233.db2.gz QUQFOBYUTZVXLC-NSHDSACASA-N 1 2 241.718 2.266 20 0 BEADLO O[C@H]1C[C@H](Nc2ccc(-c3ccncc3)c[nH+]2)C1 ZINC000894640411 583499258 /nfs/dbraw/zinc/49/92/58/583499258.db2.gz CIDLDFJCXRIFNG-JOCQHMNTSA-N 1 2 241.294 2.079 20 0 BEADLO COc1cc(NCc2c[nH+]c[nH]2)c(C)c(OC)c1 ZINC000894664035 583502088 /nfs/dbraw/zinc/50/20/88/583502088.db2.gz DCWUHIFPHYFJQW-UHFFFAOYSA-N 1 2 247.298 2.347 20 0 BEADLO COc1cc(NCc2c[nH]c[nH+]2)c(C)c(OC)c1 ZINC000894664035 583502090 /nfs/dbraw/zinc/50/20/90/583502090.db2.gz DCWUHIFPHYFJQW-UHFFFAOYSA-N 1 2 247.298 2.347 20 0 BEADLO CCc1nc(CNCc2[nH+]ccn2C2CC2)co1 ZINC000894745458 583515510 /nfs/dbraw/zinc/51/55/10/583515510.db2.gz NJPWWNIIFLGWJF-UHFFFAOYSA-N 1 2 246.314 2.058 20 0 BEADLO CCc1nc(C[NH2+]Cc2cnc(F)cc2C)co1 ZINC000894751791 583515948 /nfs/dbraw/zinc/51/59/48/583515948.db2.gz ZNOQQRYKRIJSQS-UHFFFAOYSA-N 1 2 249.289 2.369 20 0 BEADLO Cc1ncccc1CNc1cccc([C@H](C)O)[nH+]1 ZINC000894753166 583516080 /nfs/dbraw/zinc/51/60/80/583516080.db2.gz JQURSZBQLHOIRH-NSHDSACASA-N 1 2 243.310 2.450 20 0 BEADLO CCCCc1cc(NCc2[nH]cc(C)[nH+]2)ncn1 ZINC000894791299 583520283 /nfs/dbraw/zinc/52/02/83/583520283.db2.gz XOSPVHSWGHCCNS-UHFFFAOYSA-N 1 2 245.330 2.463 20 0 BEADLO Cc1cc(C[NH+]2CC(C(F)F)C2)cnc1F ZINC000894827391 583526797 /nfs/dbraw/zinc/52/67/97/583526797.db2.gz BSECYEDNVFMZKZ-UHFFFAOYSA-N 1 2 230.233 2.226 20 0 BEADLO FC[C@@H]1CC[N@H+](Cc2noc(C3CCC3)n2)C1 ZINC000880301629 583527132 /nfs/dbraw/zinc/52/71/32/583527132.db2.gz VUBKKUGGQZYORA-VIFPVBQESA-N 1 2 239.294 2.129 20 0 BEADLO FC[C@@H]1CC[N@@H+](Cc2noc(C3CCC3)n2)C1 ZINC000880301629 583527133 /nfs/dbraw/zinc/52/71/33/583527133.db2.gz VUBKKUGGQZYORA-VIFPVBQESA-N 1 2 239.294 2.129 20 0 BEADLO COCC1(C)C[NH+](Cc2nc(C)c(C)s2)C1 ZINC000894840023 583529874 /nfs/dbraw/zinc/52/98/74/583529874.db2.gz ICRFJMIMJKTGHT-UHFFFAOYSA-N 1 2 240.372 2.228 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc(F)ncc2F)[C@@H]1C ZINC000894860151 583533769 /nfs/dbraw/zinc/53/37/69/583533769.db2.gz BUIDOABYGVLAFQ-HTQZYQBOSA-N 1 2 212.243 2.200 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc(F)ncc2F)[C@@H]1C ZINC000894860151 583533771 /nfs/dbraw/zinc/53/37/71/583533771.db2.gz BUIDOABYGVLAFQ-HTQZYQBOSA-N 1 2 212.243 2.200 20 0 BEADLO Cc1c(Cl)c(C[N@H+]2C[C@H](C)[C@H]2C)nn1C ZINC000894861242 583534403 /nfs/dbraw/zinc/53/44/03/583534403.db2.gz CJSASKNTBCCNFC-JGVFFNPUSA-N 1 2 227.739 2.222 20 0 BEADLO Cc1c(Cl)c(C[N@@H+]2C[C@H](C)[C@H]2C)nn1C ZINC000894861242 583534404 /nfs/dbraw/zinc/53/44/04/583534404.db2.gz CJSASKNTBCCNFC-JGVFFNPUSA-N 1 2 227.739 2.222 20 0 BEADLO Cc1cc(N[C@H]2C[C@@H](CO)C2)nc(C2CCC2)[nH+]1 ZINC000894867351 583538560 /nfs/dbraw/zinc/53/85/60/583538560.db2.gz LLOYTMDZRWYWJR-KLPPZKSPSA-N 1 2 247.342 2.235 20 0 BEADLO CCC[C@@H](CCO)Nc1cccc([C@H](C)O)[nH+]1 ZINC000894867831 583538682 /nfs/dbraw/zinc/53/86/82/583538682.db2.gz SHVUBDJYVOETKG-QWRGUYRKSA-N 1 2 238.331 2.098 20 0 BEADLO CC(C)n1cc(C[NH+]2CC(C(F)(F)F)C2)cn1 ZINC000894892393 583548522 /nfs/dbraw/zinc/54/85/22/583548522.db2.gz SYKGKFMSERFFIN-UHFFFAOYSA-N 1 2 247.264 2.458 20 0 BEADLO COC1C[NH+](C/C=C\c2cccc(F)c2)C1 ZINC000894969035 583560766 /nfs/dbraw/zinc/56/07/66/583560766.db2.gz CSFLYRUXOSTUHO-HYXAFXHYSA-N 1 2 221.275 2.170 20 0 BEADLO Cc1nc(CNc2cc(CO)cc[nH+]2)sc1C ZINC000894988780 583565524 /nfs/dbraw/zinc/56/55/24/583565524.db2.gz LROAVJBJJGOCAW-UHFFFAOYSA-N 1 2 249.339 2.259 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2CCOC[C@@H]2C2CCC2)c1C ZINC000895085637 583583767 /nfs/dbraw/zinc/58/37/67/583583767.db2.gz NTSXWJFEKICUJV-CQSZACIVSA-N 1 2 249.358 2.027 20 0 BEADLO Cc1n[nH]c(C[N@H+]2CCOC[C@@H]2C2CCC2)c1C ZINC000895085637 583583770 /nfs/dbraw/zinc/58/37/70/583583770.db2.gz NTSXWJFEKICUJV-CQSZACIVSA-N 1 2 249.358 2.027 20 0 BEADLO Fc1cccc(C[NH2+][C@H]2CCCc3cn[nH]c32)n1 ZINC000857857331 588914468 /nfs/dbraw/zinc/91/44/68/588914468.db2.gz BPJOFUQKBDJJIL-NSHDSACASA-N 1 2 246.289 2.111 20 0 BEADLO Fc1cccc(C[NH2+][C@H]2CCCc3c[nH]nc32)n1 ZINC000857857331 588914469 /nfs/dbraw/zinc/91/44/69/588914469.db2.gz BPJOFUQKBDJJIL-NSHDSACASA-N 1 2 246.289 2.111 20 0 BEADLO C/C=C\C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000727056341 583597078 /nfs/dbraw/zinc/59/70/78/583597078.db2.gz OFFJVRJNUHNDNK-ARJAWSKDSA-N 1 2 215.256 2.157 20 0 BEADLO COc1ccc(N[C@@H]2CCCc3c[nH]nc32)[nH+]c1 ZINC000857861853 588915202 /nfs/dbraw/zinc/91/52/02/588915202.db2.gz WWTGAQIQTIPILN-LLVKDONJSA-N 1 2 244.298 2.303 20 0 BEADLO CCc1cc(NC[C@H]2C[C@H](OC)C2)nc(CC)[nH+]1 ZINC000895131010 583600738 /nfs/dbraw/zinc/60/07/38/583600738.db2.gz FLMJUCQLGZZMOF-UMSPYCQHSA-N 1 2 249.358 2.438 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c1C ZINC000895149433 583605561 /nfs/dbraw/zinc/60/55/61/583605561.db2.gz GYUXOTRGVZNKNS-NSHDSACASA-N 1 2 241.285 2.258 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CC[C@]3(CC3(F)F)C2)c1C ZINC000895149433 583605562 /nfs/dbraw/zinc/60/55/62/583605562.db2.gz GYUXOTRGVZNKNS-NSHDSACASA-N 1 2 241.285 2.258 20 0 BEADLO F[C@@H]1CCC[N@H+](Cc2cn3ccnc3s2)C1 ZINC000895191608 583621963 /nfs/dbraw/zinc/62/19/63/583621963.db2.gz QLPLUKCWVUCXRS-SECBINFHSA-N 1 2 239.319 2.330 20 0 BEADLO F[C@@H]1CCC[N@@H+](Cc2cn3ccnc3s2)C1 ZINC000895191608 583621964 /nfs/dbraw/zinc/62/19/64/583621964.db2.gz QLPLUKCWVUCXRS-SECBINFHSA-N 1 2 239.319 2.330 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OCc1ccno1 ZINC000727399917 583640253 /nfs/dbraw/zinc/64/02/53/583640253.db2.gz NVWPETMBFWZAGD-UHFFFAOYSA-N 1 2 231.255 2.030 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N(C)CCCF)ccn12 ZINC000895305885 583643709 /nfs/dbraw/zinc/64/37/09/583643709.db2.gz ZEDLNSUDFUFSOZ-UHFFFAOYSA-N 1 2 249.289 2.074 20 0 BEADLO COc1cccc(NCc2[nH+]ccn2C2CC2)n1 ZINC000895302461 583644457 /nfs/dbraw/zinc/64/44/57/583644457.db2.gz ZAIQOCZXRJXGOI-UHFFFAOYSA-N 1 2 244.298 2.234 20 0 BEADLO Cc1coc(C[N@@H+]2CCO[C@@](C)(C(F)F)C2)c1 ZINC000895359170 583659134 /nfs/dbraw/zinc/65/91/34/583659134.db2.gz AVVVCSXMOAMIGK-GFCCVEGCSA-N 1 2 245.269 2.444 20 0 BEADLO Cc1coc(C[N@H+]2CCO[C@@](C)(C(F)F)C2)c1 ZINC000895359170 583659135 /nfs/dbraw/zinc/65/91/35/583659135.db2.gz AVVVCSXMOAMIGK-GFCCVEGCSA-N 1 2 245.269 2.444 20 0 BEADLO CSC1CC[NH+](Cc2n[nH]c(C)c2C)CC1 ZINC000895415930 583667426 /nfs/dbraw/zinc/66/74/26/583667426.db2.gz PBFGPPWVMDVSQS-UHFFFAOYSA-N 1 2 239.388 2.354 20 0 BEADLO COCC1(C[N@@H+]2CC[C@@H]2C(F)F)CCC1 ZINC000895430508 583669409 /nfs/dbraw/zinc/66/94/09/583669409.db2.gz FYROSZHFNJKGLL-SECBINFHSA-N 1 2 219.275 2.143 20 0 BEADLO COCC1(C[N@H+]2CC[C@@H]2C(F)F)CCC1 ZINC000895430508 583669412 /nfs/dbraw/zinc/66/94/12/583669412.db2.gz FYROSZHFNJKGLL-SECBINFHSA-N 1 2 219.275 2.143 20 0 BEADLO COCC1(C[N@@H+]2CC[C@H]2C(F)F)CCC1 ZINC000895430509 583669828 /nfs/dbraw/zinc/66/98/28/583669828.db2.gz FYROSZHFNJKGLL-VIFPVBQESA-N 1 2 219.275 2.143 20 0 BEADLO COCC1(C[N@H+]2CC[C@H]2C(F)F)CCC1 ZINC000895430509 583669829 /nfs/dbraw/zinc/66/98/29/583669829.db2.gz FYROSZHFNJKGLL-VIFPVBQESA-N 1 2 219.275 2.143 20 0 BEADLO CC(C)n1c[nH+]cc1CN1CC[C@H]1C(F)F ZINC000895431105 583670023 /nfs/dbraw/zinc/67/00/23/583670023.db2.gz JPXVNQAGQSVAKL-JTQLQIEISA-N 1 2 229.274 2.303 20 0 BEADLO CCC[C@H](C[N@@H+]1CC[C@H]1C(F)F)OC ZINC000895431959 583670595 /nfs/dbraw/zinc/67/05/95/583670595.db2.gz RZEGVSRCAIUWET-BDAKNGLRSA-N 1 2 207.264 2.141 20 0 BEADLO CCC[C@H](C[N@H+]1CC[C@H]1C(F)F)OC ZINC000895431959 583670596 /nfs/dbraw/zinc/67/05/96/583670596.db2.gz RZEGVSRCAIUWET-BDAKNGLRSA-N 1 2 207.264 2.141 20 0 BEADLO FC(F)[C@H]1CC[N@@H+]1C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000895432104 583670896 /nfs/dbraw/zinc/67/08/96/583670896.db2.gz USKJNMRWWDEKGR-UTINFBMNSA-N 1 2 201.260 2.372 20 0 BEADLO FC(F)[C@H]1CC[N@H+]1C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000895432104 583670897 /nfs/dbraw/zinc/67/08/97/583670897.db2.gz USKJNMRWWDEKGR-UTINFBMNSA-N 1 2 201.260 2.372 20 0 BEADLO C[C@@H]1C[C@@H](C[N@@H+]2CC[C@H]2C(F)F)CCO1 ZINC000895432796 583671599 /nfs/dbraw/zinc/67/15/99/583671599.db2.gz PXPOPNLHHHVGFE-UTLUCORTSA-N 1 2 219.275 2.141 20 0 BEADLO C[C@@H]1C[C@@H](C[N@H+]2CC[C@H]2C(F)F)CCO1 ZINC000895432796 583671606 /nfs/dbraw/zinc/67/16/06/583671606.db2.gz PXPOPNLHHHVGFE-UTLUCORTSA-N 1 2 219.275 2.141 20 0 BEADLO FC(F)[C@@H]1CCN1Cc1c[nH+]c2ccccn12 ZINC000895435576 583673067 /nfs/dbraw/zinc/67/30/67/583673067.db2.gz GXDHRDSGUYGLCM-JTQLQIEISA-N 1 2 237.253 2.174 20 0 BEADLO Cc1cn(C(C)(C)C(=O)NC2CCCCC2)c[nH+]1 ZINC000895440205 583675032 /nfs/dbraw/zinc/67/50/32/583675032.db2.gz QUXWLEUYZSEJQY-UHFFFAOYSA-N 1 2 249.358 2.376 20 0 BEADLO Cc1ccc(C[NH2+]Cc2ocnc2C)o1 ZINC000895447088 583675883 /nfs/dbraw/zinc/67/58/83/583675883.db2.gz JZWQTNSXZGGXKD-UHFFFAOYSA-N 1 2 206.245 2.174 20 0 BEADLO Cc1coc(C[N@@H+]2CCN(C)[C@@H](C(C)C)C2)c1 ZINC000895461192 583678066 /nfs/dbraw/zinc/67/80/66/583678066.db2.gz ZCVJFYYESXVBTB-CQSZACIVSA-N 1 2 236.359 2.360 20 0 BEADLO Cc1coc(C[N@H+]2CCN(C)[C@@H](C(C)C)C2)c1 ZINC000895461192 583678067 /nfs/dbraw/zinc/67/80/67/583678067.db2.gz ZCVJFYYESXVBTB-CQSZACIVSA-N 1 2 236.359 2.360 20 0 BEADLO COC[C@@H](C)CNc1c[nH+]c(C)c(C)c1 ZINC000895645151 583700601 /nfs/dbraw/zinc/70/06/01/583700601.db2.gz NNJRMEOMTSGQBG-VIFPVBQESA-N 1 2 208.305 2.393 20 0 BEADLO COc1cncc(NCc2[nH+]ccn2C2CC2)c1 ZINC000895692584 583707891 /nfs/dbraw/zinc/70/78/91/583707891.db2.gz TYICOPOSROHLEO-UHFFFAOYSA-N 1 2 244.298 2.234 20 0 BEADLO c1cnc([C@H](Nc2cccc[nH+]2)C2CC2)nc1 ZINC000895779325 583726511 /nfs/dbraw/zinc/72/65/11/583726511.db2.gz FPACZQRZQMANPW-GFCCVEGCSA-N 1 2 226.283 2.435 20 0 BEADLO Cc1nc(N[C@@H](c2ncccn2)C2CC2)cc[nH+]1 ZINC000895779830 583728886 /nfs/dbraw/zinc/72/88/86/583728886.db2.gz WLMSAGHWJKPSAY-GFCCVEGCSA-N 1 2 241.298 2.138 20 0 BEADLO C[C@@]1(C[NH2+][C@H]2CCOC2=O)C[C@H]1c1ccccc1 ZINC000895809426 583730476 /nfs/dbraw/zinc/73/04/76/583730476.db2.gz VVMRREVWUJHONW-YDHLFZDLSA-N 1 2 245.322 2.085 20 0 BEADLO CC(C)[C@@H](C[NH2+][C@H]1CCOC1=O)c1ccccc1 ZINC000895807162 583731922 /nfs/dbraw/zinc/73/19/22/583731922.db2.gz LCRMODDEMZDWNE-KGLIPLIRSA-N 1 2 247.338 2.331 20 0 BEADLO CC1(C)C[NH+](Cc2nccn2C2CC2)C1 ZINC000895825036 583734608 /nfs/dbraw/zinc/73/46/08/583734608.db2.gz DWUWAGUNWCHDKD-UHFFFAOYSA-N 1 2 205.305 2.060 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CC[C@@H]([C@@H]3CCCO3)C2)c1C ZINC000895845921 583736255 /nfs/dbraw/zinc/73/62/55/583736255.db2.gz RPLQDOHBDDAIDA-OCCSQVGLSA-N 1 2 249.358 2.027 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CC[C@@H]([C@@H]3CCCO3)C2)c1C ZINC000895845921 583736256 /nfs/dbraw/zinc/73/62/56/583736256.db2.gz RPLQDOHBDDAIDA-OCCSQVGLSA-N 1 2 249.358 2.027 20 0 BEADLO CCCCCCC(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857989103 588926171 /nfs/dbraw/zinc/92/61/71/588926171.db2.gz KQZBWQIORYGWAB-NSHDSACASA-N 1 2 235.331 2.415 20 0 BEADLO CO[C@@H]1CC[C@H](C)[N@H+](Cc2n[nH]c(C)c2C)C1 ZINC000895927652 583748349 /nfs/dbraw/zinc/74/83/49/583748349.db2.gz OJCVYCJGTHCDLX-JOYOIKCWSA-N 1 2 237.347 2.026 20 0 BEADLO CO[C@@H]1CC[C@H](C)[N@@H+](Cc2n[nH]c(C)c2C)C1 ZINC000895927652 583748351 /nfs/dbraw/zinc/74/83/51/583748351.db2.gz OJCVYCJGTHCDLX-JOYOIKCWSA-N 1 2 237.347 2.026 20 0 BEADLO C[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857976567 588926310 /nfs/dbraw/zinc/92/63/10/588926310.db2.gz HGCHLQMUAOCCNL-UTUOFQBUSA-N 1 2 247.342 2.270 20 0 BEADLO COc1ccc(C[NH2+][C@@H](C)c2nccnc2C)o1 ZINC000895942205 583750332 /nfs/dbraw/zinc/75/03/32/583750332.db2.gz GXAMJXUTOSKDOE-JTQLQIEISA-N 1 2 247.298 2.237 20 0 BEADLO O=C(/C=C\C1CCCC1)N[C@H]1CCn2c[nH+]cc21 ZINC000857976532 588926373 /nfs/dbraw/zinc/92/63/73/588926373.db2.gz GTKHJEXAUDXZKF-FJOGCWAESA-N 1 2 245.326 2.191 20 0 BEADLO COc1ccccc1C[NH+]1CC(OC(C)C)C1 ZINC000895951937 583751553 /nfs/dbraw/zinc/75/15/53/583751553.db2.gz JBMRVSYIJVSFOX-UHFFFAOYSA-N 1 2 235.327 2.304 20 0 BEADLO COc1ccsc1C[NH+]1CC(OC(C)C)C1 ZINC000895954598 583752236 /nfs/dbraw/zinc/75/22/36/583752236.db2.gz BPFBREJWYRPLPB-UHFFFAOYSA-N 1 2 241.356 2.366 20 0 BEADLO CCc1ccc(C[NH+]2CC(OC(C)C)C2)o1 ZINC000895954572 583752286 /nfs/dbraw/zinc/75/22/86/583752286.db2.gz AZQGPYOXCOTWEI-UHFFFAOYSA-N 1 2 223.316 2.451 20 0 BEADLO CC(C)OC1C[NH+](C[C@H]2CC2(Cl)Cl)C1 ZINC000895956031 583752863 /nfs/dbraw/zinc/75/28/63/583752863.db2.gz INPPVSQTULOWAD-MRVPVSSYSA-N 1 2 238.158 2.289 20 0 BEADLO CC1(CC(=O)N[C@H]2CCn3c[nH+]cc32)CCCC1 ZINC000857978640 588926602 /nfs/dbraw/zinc/92/66/02/588926602.db2.gz PGILOJKIJYOSNE-NSHDSACASA-N 1 2 247.342 2.415 20 0 BEADLO CCCC[C@H](C)C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857977422 588926735 /nfs/dbraw/zinc/92/67/35/588926735.db2.gz DTJWAJUCJQIGTR-QWRGUYRKSA-N 1 2 235.331 2.270 20 0 BEADLO CO[C@H]1C[N@H+](C/C(C)=C/c2ccccc2)CCO1 ZINC000895970809 583756205 /nfs/dbraw/zinc/75/62/05/583756205.db2.gz VHKAFFDBNWLSAX-NRMKIYEFSA-N 1 2 247.338 2.395 20 0 BEADLO CO[C@H]1C[N@@H+](C/C(C)=C/c2ccccc2)CCO1 ZINC000895970809 583756207 /nfs/dbraw/zinc/75/62/07/583756207.db2.gz VHKAFFDBNWLSAX-NRMKIYEFSA-N 1 2 247.338 2.395 20 0 BEADLO CC1(CC(=O)N[C@@H]2CCn3c[nH+]cc32)CCCC1 ZINC000857978639 588927018 /nfs/dbraw/zinc/92/70/18/588927018.db2.gz PGILOJKIJYOSNE-LLVKDONJSA-N 1 2 247.342 2.415 20 0 BEADLO CC/C(C)=C(/C)C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857979232 588927465 /nfs/dbraw/zinc/92/74/65/588927465.db2.gz ACDIPHAHQSFOGG-JUDLJHIGSA-N 1 2 233.315 2.191 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)C(F)F)cnc1F ZINC000896038103 583766378 /nfs/dbraw/zinc/76/63/78/583766378.db2.gz KYTWXFFOKMPXHM-ZETCQYMHSA-N 1 2 218.222 2.272 20 0 BEADLO CC(C)(CC(=O)N[C@H]1CCn2c[nH+]cc21)C1CC1 ZINC000857979667 588927596 /nfs/dbraw/zinc/92/75/96/588927596.db2.gz YEOSLHGRHRAQIZ-NSHDSACASA-N 1 2 247.342 2.270 20 0 BEADLO O=C(N[C@@H]1CCn2c[nH+]cc21)[C@H]1CC12CCCC2 ZINC000857982417 588927972 /nfs/dbraw/zinc/92/79/72/588927972.db2.gz INJRNABTEHGKHY-GHMZBOCLSA-N 1 2 245.326 2.024 20 0 BEADLO C[NH+](C)C1(c2nc([C@H]3CCCS3)no2)CC1 ZINC000896117142 583771974 /nfs/dbraw/zinc/77/19/74/583771974.db2.gz ONCKOPRVCRTNEM-MRVPVSSYSA-N 1 2 239.344 2.188 20 0 BEADLO C[NH+](C)C1(c2nc([C@@H]3CCCS3)no2)CC1 ZINC000896117143 583772028 /nfs/dbraw/zinc/77/20/28/583772028.db2.gz ONCKOPRVCRTNEM-QMMMGPOBSA-N 1 2 239.344 2.188 20 0 BEADLO CCC/C(C)=C/C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857982621 588928148 /nfs/dbraw/zinc/92/81/48/588928148.db2.gz KJOYHPGHVHMECZ-PFEDMVJOSA-N 1 2 233.315 2.191 20 0 BEADLO O=C(CCC1CCC1)N[C@@H]1CCn2c[nH+]cc21 ZINC000857984138 588928452 /nfs/dbraw/zinc/92/84/52/588928452.db2.gz YFLHNNCWNFKSMR-LLVKDONJSA-N 1 2 233.315 2.024 20 0 BEADLO C[C@@H]1CC/C(=C\C(=O)N[C@H]2CCn3c[nH+]cc32)C1 ZINC000857984034 588928459 /nfs/dbraw/zinc/92/84/59/588928459.db2.gz XBYIKKBRWFPMOV-TXCQAMFQSA-N 1 2 245.326 2.191 20 0 BEADLO C[C@@H]1CCC[C@H]1CC(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857983297 588928536 /nfs/dbraw/zinc/92/85/36/588928536.db2.gz ZPJNQBFYGWTROI-WOPDTQHZSA-N 1 2 247.342 2.270 20 0 BEADLO CCc1cc(NC[C@@]2(C)CCCCO2)nc[nH+]1 ZINC000896183429 583779085 /nfs/dbraw/zinc/77/90/85/583779085.db2.gz XUDFZXYYYPMVAT-CYBMUJFWSA-N 1 2 235.331 2.410 20 0 BEADLO CCC[C@H](O)CCNc1[nH+]cccc1OC ZINC000896184521 583780350 /nfs/dbraw/zinc/78/03/50/583780350.db2.gz XGBNPFMYHQNKPC-JTQLQIEISA-N 1 2 224.304 2.053 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857983237 588928798 /nfs/dbraw/zinc/92/87/98/588928798.db2.gz YFXALINFHYNFTI-GYSYKLTISA-N 1 2 247.342 2.126 20 0 BEADLO CSCC1CCN(c2cc[nH+]c(C)n2)CC1 ZINC000896210291 583783411 /nfs/dbraw/zinc/78/34/11/583783411.db2.gz FJOQNDODTIGHRA-UHFFFAOYSA-N 1 2 237.372 2.364 20 0 BEADLO Cc1c[nH+]c2c(c1)N(C(=O)C1CCCC1)CCN2 ZINC000857994146 588929716 /nfs/dbraw/zinc/92/97/16/588929716.db2.gz CTYOTMAKYZWTCE-UHFFFAOYSA-N 1 2 245.326 2.339 20 0 BEADLO O=C(CCC1CCCC1)N[C@H]1CCn2c[nH+]cc21 ZINC000857990081 588929804 /nfs/dbraw/zinc/92/98/04/588929804.db2.gz MUDJIZAKJFCPSG-LBPRGKRZSA-N 1 2 247.342 2.415 20 0 BEADLO OC1(C2CCC2)CCN(c2cccc[nH+]2)CC1 ZINC000896327281 583794328 /nfs/dbraw/zinc/79/43/28/583794328.db2.gz WTAXCSGGBFHXRO-UHFFFAOYSA-N 1 2 232.327 2.213 20 0 BEADLO Cc1c[nH+]c2c(c1)N(C(=O)CC(C)C)CCN2 ZINC000857994929 588930007 /nfs/dbraw/zinc/93/00/07/588930007.db2.gz UTOAYNFOWHCCPI-UHFFFAOYSA-N 1 2 233.315 2.195 20 0 BEADLO Cc1c[nH+]c2c(c1)N(C(=O)C1CC=CC1)CCN2 ZINC000857997622 588930239 /nfs/dbraw/zinc/93/02/39/588930239.db2.gz SIZZMSYQZGOCGG-UHFFFAOYSA-N 1 2 243.310 2.115 20 0 BEADLO CCn1c[nH+]c2c1CCN(c1ncc(C)s1)C2 ZINC000896653703 583821159 /nfs/dbraw/zinc/82/11/59/583821159.db2.gz FNAFXRMBFLWXTA-UHFFFAOYSA-N 1 2 248.355 2.231 20 0 BEADLO CC(C)(/C=C/Cl)[NH2+]Cc1ccon1 ZINC000896748503 583830295 /nfs/dbraw/zinc/83/02/95/583830295.db2.gz WHKDUKCQULWCMS-SNAWJCMRSA-N 1 2 200.669 2.295 20 0 BEADLO CC(C)n1cncc1C[N@@H+]1CCn2cccc2C1 ZINC000896760804 583831499 /nfs/dbraw/zinc/83/14/99/583831499.db2.gz GUDLWQIUCBETCM-UHFFFAOYSA-N 1 2 244.342 2.281 20 0 BEADLO CC(C)n1cncc1C[N@H+]1CCn2cccc2C1 ZINC000896760804 583831500 /nfs/dbraw/zinc/83/15/00/583831500.db2.gz GUDLWQIUCBETCM-UHFFFAOYSA-N 1 2 244.342 2.281 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccnc(F)c1)C(F)F ZINC000858169724 588936765 /nfs/dbraw/zinc/93/67/65/588936765.db2.gz COUGIMLUBBLQGP-MRVPVSSYSA-N 1 2 218.222 2.354 20 0 BEADLO Cc1[nH]c(CNC(=O)C[C@@H]2CCC[C@@H]2C)[nH+]c1C ZINC000896913109 583854005 /nfs/dbraw/zinc/85/40/05/583854005.db2.gz ADKVYNYPZWZEDW-CABZTGNLSA-N 1 2 249.358 2.469 20 0 BEADLO CCC[C@H](C)CC(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000896922212 583856983 /nfs/dbraw/zinc/85/69/83/583856983.db2.gz YHEXNXRRFPNRIK-VIFPVBQESA-N 1 2 237.347 2.469 20 0 BEADLO Cc1[nH]c(CNC(=O)CCC(C)(F)F)[nH+]c1C ZINC000896922546 583857243 /nfs/dbraw/zinc/85/72/43/583857243.db2.gz SRNJFSQNDBMMGC-UHFFFAOYSA-N 1 2 245.273 2.078 20 0 BEADLO C[C@@H](c1ccco1)c1noc(C2([NH+](C)C)CC2)n1 ZINC000896927113 583858730 /nfs/dbraw/zinc/85/87/30/583858730.db2.gz KCIZFPUHXBGWLH-VIFPVBQESA-N 1 2 247.298 2.365 20 0 BEADLO CONC(=O)C[NH2+][C@@H](C)CCC1CCCCC1 ZINC000896926361 583859379 /nfs/dbraw/zinc/85/93/79/583859379.db2.gz ITAVQJZOUMTGOJ-NSHDSACASA-N 1 2 242.363 2.003 20 0 BEADLO Cc1ccc(C(=O)NCc2[nH]c(C)c(C)[nH+]2)s1 ZINC000896929634 583859956 /nfs/dbraw/zinc/85/99/56/583859956.db2.gz LGAHIXSHBGUYHV-UHFFFAOYSA-N 1 2 249.339 2.326 20 0 BEADLO CCCCc1cc(N[C@H]2CC23CC(O)C3)nc[nH+]1 ZINC000897087000 583878396 /nfs/dbraw/zinc/87/83/96/583878396.db2.gz JKKKVVQLIUCCKQ-LXVYMNJGSA-N 1 2 247.342 2.145 20 0 BEADLO CCc1nc(N[C@H](CCO)C2CCCC2)cc[nH+]1 ZINC000897116710 583881609 /nfs/dbraw/zinc/88/16/09/583881609.db2.gz MPBMWLSQEKKMLY-GFCCVEGCSA-N 1 2 249.358 2.392 20 0 BEADLO CO[C@@H]1CC[C@@H]1N(C)c1cc(C)[nH+]c(C2CC2)n1 ZINC000897148559 583884380 /nfs/dbraw/zinc/88/43/80/583884380.db2.gz GMUXKXKMGUBSAG-NWDGAFQWSA-N 1 2 247.342 2.276 20 0 BEADLO Cc1cc(N[C@@H]2C[C@H]3CCC[C@@H]32)nc[nH+]1 ZINC000897176235 583889025 /nfs/dbraw/zinc/88/90/25/583889025.db2.gz QHPQTIJIMRSNCU-OUAUKWLOSA-N 1 2 203.289 2.386 20 0 BEADLO Cc1cc(N[C@@H]2C[C@@H]3CCC[C@H]23)nc[nH+]1 ZINC000897176232 583889100 /nfs/dbraw/zinc/88/91/00/583889100.db2.gz QHPQTIJIMRSNCU-GARJFASQSA-N 1 2 203.289 2.386 20 0 BEADLO CN(C)c1cc(N[C@@H]2C[C@H]3CCC[C@@H]32)[nH+]cn1 ZINC000897176627 583889605 /nfs/dbraw/zinc/88/96/05/583889605.db2.gz ASTYJCVRVDJBSB-OUAUKWLOSA-N 1 2 232.331 2.143 20 0 BEADLO CN(C)c1cc(N[C@@H]2C[C@H]3CCC[C@@H]32)nc[nH+]1 ZINC000897176627 583889607 /nfs/dbraw/zinc/88/96/07/583889607.db2.gz ASTYJCVRVDJBSB-OUAUKWLOSA-N 1 2 232.331 2.143 20 0 BEADLO OCc1cc[nH+]c(N[C@@H]2C[C@@H]3CCC[C@@H]23)c1 ZINC000897177631 583890418 /nfs/dbraw/zinc/89/04/18/583890418.db2.gz SKTPZDDISDVOML-QJPTWQEYSA-N 1 2 218.300 2.174 20 0 BEADLO C/C=C/C=C\C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000728542130 583896772 /nfs/dbraw/zinc/89/67/72/583896772.db2.gz MGLNFJFGSOBAGS-XMDQBQTPSA-N 1 2 245.326 2.179 20 0 BEADLO Cc1nc(C[NH2+]Cc2cncc(O)c2)sc1C ZINC000897305350 583913380 /nfs/dbraw/zinc/91/33/80/583913380.db2.gz UBXJXEPWPGVEET-UHFFFAOYSA-N 1 2 249.339 2.150 20 0 BEADLO Cc1cc(N[C@H]2CCOC23CCCC3)nc[nH+]1 ZINC000897320001 583921141 /nfs/dbraw/zinc/92/11/41/583921141.db2.gz GVXDRUYCVTXRQF-NSHDSACASA-N 1 2 233.315 2.299 20 0 BEADLO CCc1cc(C[NH2+]Cc2ccnn2C(C)C)on1 ZINC000526973399 583931660 /nfs/dbraw/zinc/93/16/60/583931660.db2.gz WVVUEJKCLWFVQD-UHFFFAOYSA-N 1 2 248.330 2.304 20 0 BEADLO O[C@@H]1CCN(c2[nH+]ccc3ccccc32)C[C@H]1F ZINC000897380310 583946872 /nfs/dbraw/zinc/94/68/72/583946872.db2.gz OOMBKEJGHXIASC-CHWSQXEVSA-N 1 2 246.285 2.144 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@H](C)c1ccns1 ZINC000858317197 588944505 /nfs/dbraw/zinc/94/45/05/588944505.db2.gz VINRRWFMUJPDSY-MRVPVSSYSA-N 1 2 222.317 2.025 20 0 BEADLO CC(C)c1nc(N[C@H]2COC[C@H]2C2CC2)cc[nH+]1 ZINC000897446066 583986629 /nfs/dbraw/zinc/98/66/29/583986629.db2.gz BSMSNSMNFZRMNP-RYUDHWBXSA-N 1 2 247.342 2.437 20 0 BEADLO CCC/C=C\C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000729350671 583993700 /nfs/dbraw/zinc/99/37/00/583993700.db2.gz GSQOKODVGMCOQC-PLNGDYQASA-N 1 2 247.342 2.403 20 0 BEADLO CCC/C=C/C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000729369887 583995367 /nfs/dbraw/zinc/99/53/67/583995367.db2.gz BIEPNFGLWILBMY-NTYUQYKDSA-N 1 2 247.342 2.472 20 0 BEADLO CCc1cc(N)nc(SCOCC(C)C)[nH+]1 ZINC000865366642 584017026 /nfs/dbraw/zinc/01/70/26/584017026.db2.gz IEVCOSSFCCOHIV-UHFFFAOYSA-N 1 2 241.360 2.343 20 0 BEADLO Cn1ccnc1CNc1ccc(C2CC2)c[nH+]1 ZINC000897711574 584042441 /nfs/dbraw/zinc/04/24/41/584042441.db2.gz DWKZJFDTHYZCDA-UHFFFAOYSA-N 1 2 228.299 2.305 20 0 BEADLO CC(C)c1c[nH+]cc(N[C@H](C)Cn2cncn2)c1 ZINC000897707715 584042507 /nfs/dbraw/zinc/04/25/07/584042507.db2.gz ZCZFNBKNNWLEQO-LLVKDONJSA-N 1 2 245.330 2.297 20 0 BEADLO CC(C)(C)c1coc(C[NH2+]Cc2cncnc2)n1 ZINC000897944799 584062740 /nfs/dbraw/zinc/06/27/40/584062740.db2.gz NGTZBLVGELMILH-UHFFFAOYSA-N 1 2 246.314 2.052 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cn(C)cn2)c(F)c1 ZINC000898041765 584079707 /nfs/dbraw/zinc/07/97/07/584079707.db2.gz AAGDDEHAHQCOKR-UHFFFAOYSA-N 1 2 233.290 2.157 20 0 BEADLO Cc1cccc(C[NH2+]Cc2cn(C)cn2)c1F ZINC000898043718 584081329 /nfs/dbraw/zinc/08/13/29/584081329.db2.gz YYBCUFRYSYXRQM-UHFFFAOYSA-N 1 2 233.290 2.157 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@H](O)[C@@H](F)C2)ccc1F ZINC000898191249 584095716 /nfs/dbraw/zinc/09/57/16/584095716.db2.gz AGMLSCIPLOZLAN-STQMWFEESA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@H](O)[C@@H](F)C2)ccc1F ZINC000898191249 584095717 /nfs/dbraw/zinc/09/57/17/584095717.db2.gz AGMLSCIPLOZLAN-STQMWFEESA-N 1 2 241.281 2.039 20 0 BEADLO COC(=O)[C@@H]([NH2+][C@H]1CC[C@H]1C)c1ccccc1 ZINC000898336592 584111788 /nfs/dbraw/zinc/11/17/88/584111788.db2.gz UJHICBNIEKQRAU-WXHSDQCUSA-N 1 2 233.311 2.289 20 0 BEADLO C[C@@H](c1ccncc1)[N@@H+]1CCO[C@@H](C(F)F)C1 ZINC000801567062 584127857 /nfs/dbraw/zinc/12/78/57/584127857.db2.gz HLUIGYAHWUWTJT-GXSJLCMTSA-N 1 2 242.269 2.109 20 0 BEADLO C[C@@H](c1ccncc1)[N@H+]1CCO[C@@H](C(F)F)C1 ZINC000801567062 584127858 /nfs/dbraw/zinc/12/78/58/584127858.db2.gz HLUIGYAHWUWTJT-GXSJLCMTSA-N 1 2 242.269 2.109 20 0 BEADLO CC(C)[C@@H]1C[C@H]1C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000898906242 584165023 /nfs/dbraw/zinc/16/50/23/584165023.db2.gz KKKZKRUVEVTUBB-NWDGAFQWSA-N 1 2 249.358 2.027 20 0 BEADLO CC(C)(C)CC(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000898893357 584165315 /nfs/dbraw/zinc/16/53/15/584165315.db2.gz HMTFLRBUOJEZBR-UHFFFAOYSA-N 1 2 237.347 2.171 20 0 BEADLO Cc1cn(C(C)(C)C(=O)NC[C@@H]2C=CCC2)c[nH+]1 ZINC000899200082 584180873 /nfs/dbraw/zinc/18/08/73/584180873.db2.gz MSHRMQXYFIBZAW-GFCCVEGCSA-N 1 2 247.342 2.009 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NC1(C2CC2)CCC1 ZINC000899823142 584239972 /nfs/dbraw/zinc/23/99/72/584239972.db2.gz WWDIJHAZHZKVPH-JTQLQIEISA-N 1 2 247.342 2.037 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NC1(C2CC2)CCC1 ZINC000899823142 584239973 /nfs/dbraw/zinc/23/99/73/584239973.db2.gz WWDIJHAZHZKVPH-JTQLQIEISA-N 1 2 247.342 2.037 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ncc[nH]1)c1ccns1 ZINC000858578036 588968497 /nfs/dbraw/zinc/96/84/97/588968497.db2.gz XAIPXHUJKMYHBB-SFYZADRCSA-N 1 2 222.317 2.278 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)NC1CCCCCCC1 ZINC000899929211 584256080 /nfs/dbraw/zinc/25/60/80/584256080.db2.gz GKRMDNOFWLEVFM-UHFFFAOYSA-N 1 2 235.331 2.181 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)NC1CCCCCCC1 ZINC000899929211 584256082 /nfs/dbraw/zinc/25/60/82/584256082.db2.gz GKRMDNOFWLEVFM-UHFFFAOYSA-N 1 2 235.331 2.181 20 0 BEADLO COc1ccccc1OC(=O)C[N@H+](C)C1CCC1 ZINC000900019810 584266879 /nfs/dbraw/zinc/26/68/79/584266879.db2.gz JGTFGGVCDKWJQQ-UHFFFAOYSA-N 1 2 249.310 2.085 20 0 BEADLO COc1ccccc1OC(=O)C[N@@H+](C)C1CCC1 ZINC000900019810 584266881 /nfs/dbraw/zinc/26/68/81/584266881.db2.gz JGTFGGVCDKWJQQ-UHFFFAOYSA-N 1 2 249.310 2.085 20 0 BEADLO CCCCCC[C@@H](C)NC(=O)Cc1c[nH]c[nH+]1 ZINC000900081524 584272516 /nfs/dbraw/zinc/27/25/16/584272516.db2.gz JAPCMKPQYREMDL-LLVKDONJSA-N 1 2 237.347 2.427 20 0 BEADLO CCCCCC[C@@H](C)NC(=O)Cc1c[nH+]c[nH]1 ZINC000900081524 584272518 /nfs/dbraw/zinc/27/25/18/584272518.db2.gz JAPCMKPQYREMDL-LLVKDONJSA-N 1 2 237.347 2.427 20 0 BEADLO COCOCCCNc1cc[nH+]c(C(C)C)n1 ZINC000858606245 588970685 /nfs/dbraw/zinc/97/06/85/588970685.db2.gz OIQSPJSPCOPMFC-UHFFFAOYSA-N 1 2 239.319 2.023 20 0 BEADLO CCN(C(=O)Cc1c[nH+]c[nH]1)c1ccccc1C ZINC000900254240 584289178 /nfs/dbraw/zinc/28/91/78/584289178.db2.gz CXZBNCATASLGJF-UHFFFAOYSA-N 1 2 243.310 2.314 20 0 BEADLO CCN(C(=O)Cc1c[nH]c[nH+]1)c1ccccc1C ZINC000900254240 584289179 /nfs/dbraw/zinc/28/91/79/584289179.db2.gz CXZBNCATASLGJF-UHFFFAOYSA-N 1 2 243.310 2.314 20 0 BEADLO CCC[C@H]1CCCC[C@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000900555892 584322971 /nfs/dbraw/zinc/32/29/71/584322971.db2.gz GYHOBPQIFRKPSX-WCQYABFASA-N 1 2 249.358 2.427 20 0 BEADLO CCC[C@H]1CCCC[C@H]1NC(=O)Cc1c[nH+]c[nH]1 ZINC000900555892 584322973 /nfs/dbraw/zinc/32/29/73/584322973.db2.gz GYHOBPQIFRKPSX-WCQYABFASA-N 1 2 249.358 2.427 20 0 BEADLO CCCC[C@@H]1CCC[C@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000900543168 584324386 /nfs/dbraw/zinc/32/43/86/584324386.db2.gz LUSVLCZRNVCAQF-DGCLKSJQSA-N 1 2 249.358 2.427 20 0 BEADLO CCCC[C@@H]1CCC[C@H]1NC(=O)Cc1c[nH+]c[nH]1 ZINC000900543168 584324387 /nfs/dbraw/zinc/32/43/87/584324387.db2.gz LUSVLCZRNVCAQF-DGCLKSJQSA-N 1 2 249.358 2.427 20 0 BEADLO Cc1[nH+]cccc1Cn1cc(C2CCC2)nn1 ZINC000900545382 584325238 /nfs/dbraw/zinc/32/52/38/584325238.db2.gz ZRZSXOBXZJKSHI-UHFFFAOYSA-N 1 2 228.299 2.297 20 0 BEADLO CC(C)c1nc(N(C)CC2(C)COC2)cc[nH+]1 ZINC000858706061 588974727 /nfs/dbraw/zinc/97/47/27/588974727.db2.gz PNZHSCSTCKCLAR-UHFFFAOYSA-N 1 2 235.331 2.073 20 0 BEADLO CC(=C(F)C(=O)Nc1cc[nH+]c(C)c1)C1CC1 ZINC000900672101 584339438 /nfs/dbraw/zinc/33/94/38/584339438.db2.gz LPOFNDKPPPAGMY-XFXZXTDPSA-N 1 2 234.274 2.404 20 0 BEADLO CC(=C(F)C(=O)Nc1cc[nH+]c(C)c1)C1CC1 ZINC000900672100 584339703 /nfs/dbraw/zinc/33/97/03/584339703.db2.gz LPOFNDKPPPAGMY-FMIVXFBMSA-N 1 2 234.274 2.404 20 0 BEADLO C[C@@H]1CCCN(C(=O)CNc2cccc[nH+]2)[C@@H]1C ZINC000900829085 584354855 /nfs/dbraw/zinc/35/48/55/584354855.db2.gz NDSRATNJXSWFJJ-VXGBXAGGSA-N 1 2 247.342 2.141 20 0 BEADLO CC[C@H](C)C[C@H](C)NC(=O)CNc1cccc[nH+]1 ZINC000900861688 584358609 /nfs/dbraw/zinc/35/86/09/584358609.db2.gz DJMXDFUBSXWIKI-RYUDHWBXSA-N 1 2 249.358 2.434 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)N[C@H]1C[C@@H]1C1CCCCC1 ZINC000900836527 584359151 /nfs/dbraw/zinc/35/91/51/584359151.db2.gz ORWGTQOUHPRCCM-OLZOCXBDSA-N 1 2 247.342 2.037 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)N[C@H]1C[C@@H]1C1CCCCC1 ZINC000900836527 584359153 /nfs/dbraw/zinc/35/91/53/584359153.db2.gz ORWGTQOUHPRCCM-OLZOCXBDSA-N 1 2 247.342 2.037 20 0 BEADLO Cc1[nH+]c2cc(NC(=O)CCF)ccc2n1C ZINC000900895561 584362599 /nfs/dbraw/zinc/36/25/99/584362599.db2.gz QLGZFJCYIYRSMA-UHFFFAOYSA-N 1 2 235.262 2.180 20 0 BEADLO CCC[C@@H]1[C@H](C)CCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC000900870520 584363550 /nfs/dbraw/zinc/36/35/50/584363550.db2.gz UEONNFVSYXSHFM-DGCLKSJQSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H]1c2ccccc2CN1C(=O)Cc1c[nH+]c[nH]1 ZINC000900924102 584365909 /nfs/dbraw/zinc/36/59/09/584365909.db2.gz VOANFDSHHKXULV-SNVBAGLBSA-N 1 2 241.294 2.056 20 0 BEADLO CC/C(C)=C(\C)C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000900997138 584374816 /nfs/dbraw/zinc/37/48/16/584374816.db2.gz JVOPHSCKCLFOFI-CMDGGOBGSA-N 1 2 235.331 2.389 20 0 BEADLO CCC(C)=C(C)C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000900997138 584374818 /nfs/dbraw/zinc/37/48/18/584374818.db2.gz JVOPHSCKCLFOFI-CMDGGOBGSA-N 1 2 235.331 2.389 20 0 BEADLO CC(C)C[C@@H]1CCCN(C(=O)Cc2c[nH+]c[nH]2)C1 ZINC000901038762 584376296 /nfs/dbraw/zinc/37/62/96/584376296.db2.gz KUCHNJVYCXPDCA-LBPRGKRZSA-N 1 2 249.358 2.237 20 0 BEADLO Cn1c[nH+]c(/C=C/C(=O)OC[C@@H]2CC=CCC2)c1 ZINC000901162997 584394289 /nfs/dbraw/zinc/39/42/89/584394289.db2.gz GFDZFOHDHCRTPA-ABZNLYFFSA-N 1 2 246.310 2.333 20 0 BEADLO CC1(C)CCC(CNC(=O)Cc2c[nH]c[nH+]2)CC1 ZINC000901232460 584404129 /nfs/dbraw/zinc/40/41/29/584404129.db2.gz CVVPFERPRNVCDV-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO CC1(C)CCC(CNC(=O)Cc2c[nH+]c[nH]2)CC1 ZINC000901232460 584404131 /nfs/dbraw/zinc/40/41/31/584404131.db2.gz CVVPFERPRNVCDV-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO CCCOC(=O)NCCc1cn2ccccc2[nH+]1 ZINC000858891545 588982344 /nfs/dbraw/zinc/98/23/44/588982344.db2.gz YRKFLVTZNYBFNK-UHFFFAOYSA-N 1 2 247.298 2.013 20 0 BEADLO CC1(C)CC[C@@H](NC(=O)CNc2cccc[nH+]2)C1 ZINC000901286036 584422282 /nfs/dbraw/zinc/42/22/82/584422282.db2.gz ICPOWANMRZLTHY-LLVKDONJSA-N 1 2 247.342 2.188 20 0 BEADLO CCc1ccc(NC(=O)Cc2c[nH+]c[nH]2)cc1C ZINC000901291511 584422457 /nfs/dbraw/zinc/42/24/57/584422457.db2.gz IUVAPQFYENUNDJ-UHFFFAOYSA-N 1 2 243.310 2.462 20 0 BEADLO CCc1ccc(NC(=O)Cc2c[nH]c[nH+]2)cc1C ZINC000901291511 584422458 /nfs/dbraw/zinc/42/24/58/584422458.db2.gz IUVAPQFYENUNDJ-UHFFFAOYSA-N 1 2 243.310 2.462 20 0 BEADLO C[C@@H](O)CC[NH2+]c1ccc2c(c1)C[C@H](C)O2 ZINC000901445413 584446643 /nfs/dbraw/zinc/44/66/43/584446643.db2.gz BBWBXLCTVYVSKX-ZJUUUORDSA-N 1 2 221.300 2.193 20 0 BEADLO Cc1cc(C)[nH+]c(Cn2nnnc2C(C)(C)C)c1 ZINC000901478318 584448873 /nfs/dbraw/zinc/44/88/73/584448873.db2.gz VWCVBSVQPZKSCF-UHFFFAOYSA-N 1 2 245.330 2.031 20 0 BEADLO Cc1[nH]c(C=Cc2nc(C)cc(=O)[nH]2)[nH+]c1C ZINC000901503625 584454921 /nfs/dbraw/zinc/45/49/21/584454921.db2.gz FMDXGZLPANZAPM-SNAWJCMRSA-N 1 2 230.271 2.001 20 0 BEADLO Cc1ccc(CSC2COC2)c(C)[nH+]1 ZINC000901633970 584472596 /nfs/dbraw/zinc/47/25/96/584472596.db2.gz FVHHWWVAFWESTL-UHFFFAOYSA-N 1 2 209.314 2.330 20 0 BEADLO COc1c(C)c[nH+]c(COc2cncnc2)c1C ZINC000901706342 584485972 /nfs/dbraw/zinc/48/59/72/584485972.db2.gz LSFGJLUXTDDPRB-UHFFFAOYSA-N 1 2 245.282 2.076 20 0 BEADLO Fc1ccc(NCc2[nH+]ccn2C2CC2)nc1 ZINC000902044200 584516040 /nfs/dbraw/zinc/51/60/40/584516040.db2.gz YOKYSGBHHLAMQA-UHFFFAOYSA-N 1 2 232.262 2.364 20 0 BEADLO Cc1[nH]c(CNc2cnc(C3CC3)nc2)[nH+]c1C ZINC000902089801 584524714 /nfs/dbraw/zinc/52/47/14/584524714.db2.gz FGPHABBVMOCIDK-UHFFFAOYSA-N 1 2 243.314 2.306 20 0 BEADLO Cc1cc(F)ncc1CNc1cc[nH+]c(C)n1 ZINC000902125874 584528912 /nfs/dbraw/zinc/52/89/12/584528912.db2.gz DAMQQKPPEIFKCE-UHFFFAOYSA-N 1 2 232.262 2.240 20 0 BEADLO Cc1coc(CNc2cc[nH+]c(C)n2)c1 ZINC000902127640 584529146 /nfs/dbraw/zinc/52/91/46/584529146.db2.gz VEVXKBHWCWOXMN-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO CCOc1ccc(CNc2[nH+]cccc2CO)o1 ZINC000902147352 584530816 /nfs/dbraw/zinc/53/08/16/584530816.db2.gz JVJNAZWJIOSFNB-UHFFFAOYSA-N 1 2 248.282 2.178 20 0 BEADLO C[C@H]1C[N@H+](CN2CCOC2=O)[C@H]1c1ccccc1 ZINC000902164438 584534011 /nfs/dbraw/zinc/53/40/11/584534011.db2.gz FPTYTQRVUFDPEZ-WCQYABFASA-N 1 2 246.310 2.089 20 0 BEADLO C[C@H]1C[N@@H+](CN2CCOC2=O)[C@H]1c1ccccc1 ZINC000902164438 584534012 /nfs/dbraw/zinc/53/40/12/584534012.db2.gz FPTYTQRVUFDPEZ-WCQYABFASA-N 1 2 246.310 2.089 20 0 BEADLO Cc1coc(CNc2cc(C)[nH+]cn2)c1 ZINC000902195323 584536417 /nfs/dbraw/zinc/53/64/17/584536417.db2.gz LZDKYOITKTZXSE-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO Cc1cc(NCc2ccnn2C2CCC2)nc[nH+]1 ZINC000902196900 584536908 /nfs/dbraw/zinc/53/69/08/584536908.db2.gz YEUYUBDYPADZNY-UHFFFAOYSA-N 1 2 243.314 2.319 20 0 BEADLO CCc1[nH+]c(C)ccc1OCc1nncs1 ZINC000902352806 584569686 /nfs/dbraw/zinc/56/96/86/584569686.db2.gz AQJGETNMVYSZKC-UHFFFAOYSA-N 1 2 235.312 2.383 20 0 BEADLO CCOc1ncccc1NCc1cn(CC)c[nH+]1 ZINC000902399033 584585882 /nfs/dbraw/zinc/58/58/82/584585882.db2.gz TUMNLTSIGSVPOJ-UHFFFAOYSA-N 1 2 246.314 2.309 20 0 BEADLO CN(C)c1ccc(Cn2cc(C3CC3)cn2)c[nH+]1 ZINC000902468392 584615676 /nfs/dbraw/zinc/61/56/76/584615676.db2.gz WPQDONMXQHEKES-UHFFFAOYSA-N 1 2 242.326 2.270 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2csc(N)n2)o1 ZINC000902486829 584625730 /nfs/dbraw/zinc/62/57/30/584625730.db2.gz CQFQUPWCAANHTH-MRVPVSSYSA-N 1 2 237.328 2.478 20 0 BEADLO C[C@H]([NH2+]Cc1csc(N)n1)c1cccc(O)c1 ZINC000902487709 584625924 /nfs/dbraw/zinc/62/59/24/584625924.db2.gz CYKDZQMCJSYBLH-QMMMGPOBSA-N 1 2 249.339 2.282 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2csc(N)n2)o1 ZINC000902486830 584626199 /nfs/dbraw/zinc/62/61/99/584626199.db2.gz CQFQUPWCAANHTH-QMMMGPOBSA-N 1 2 237.328 2.478 20 0 BEADLO COC/C(C)=C\CO[NH+]=C(N)c1ccccc1 ZINC000902685518 584655690 /nfs/dbraw/zinc/65/56/90/584655690.db2.gz QBCPGDZGMLVBLB-FLIBITNWSA-N 1 2 234.299 2.126 20 0 BEADLO CC(=O)c1nccn1Cc1cc(C)cc(C)[nH+]1 ZINC000902739495 584663390 /nfs/dbraw/zinc/66/33/90/584663390.db2.gz SCBQKASQJKXFRI-UHFFFAOYSA-N 1 2 229.283 2.146 20 0 BEADLO COC1(C(N)=[NH+]OCC2CC(C)C2)CCCC1 ZINC000902767662 584667073 /nfs/dbraw/zinc/66/70/73/584667073.db2.gz FWOKSYUZUPXAPV-UHFFFAOYSA-N 1 2 240.347 2.490 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1ccnc(F)c1 ZINC000859078228 588998128 /nfs/dbraw/zinc/99/81/28/588998128.db2.gz ZKUXZMYISQIKDX-PWSUYJOCSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1ccnc(F)c1 ZINC000859078228 588998129 /nfs/dbraw/zinc/99/81/29/588998129.db2.gz ZKUXZMYISQIKDX-PWSUYJOCSA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H]([NH2+][C@H]1CC[C@@H]2[C@H]3OCC[C@H]3[C@@H]21)C(F)(F)F ZINC000902995213 584708955 /nfs/dbraw/zinc/70/89/55/584708955.db2.gz WWJYBPVRWQCRCZ-IZOAKFFESA-N 1 2 249.276 2.340 20 0 BEADLO CCc1ncc(C[N@@H+]2CCC[C@@H](F)C2)o1 ZINC000902991266 584709241 /nfs/dbraw/zinc/70/92/41/584709241.db2.gz MOHJGOKNODSMHA-SECBINFHSA-N 1 2 212.268 2.171 20 0 BEADLO CCc1ncc(C[N@H+]2CCC[C@@H](F)C2)o1 ZINC000902991266 584709242 /nfs/dbraw/zinc/70/92/42/584709242.db2.gz MOHJGOKNODSMHA-SECBINFHSA-N 1 2 212.268 2.171 20 0 BEADLO CC[C@H](C)[C@H](C(=O)OC)[N@@H+]1CCC[C@@H](F)C1 ZINC000902990389 584709524 /nfs/dbraw/zinc/70/95/24/584709524.db2.gz BAGLTHQMFHDFPI-HBNTYKKESA-N 1 2 231.311 2.008 20 0 BEADLO CC[C@H](C)[C@H](C(=O)OC)[N@H+]1CCC[C@@H](F)C1 ZINC000902990389 584709525 /nfs/dbraw/zinc/70/95/25/584709525.db2.gz BAGLTHQMFHDFPI-HBNTYKKESA-N 1 2 231.311 2.008 20 0 BEADLO Cc1nnsc1[C@H](C)[N@@H+]1CCC[C@@H](F)C1 ZINC000902991453 584709722 /nfs/dbraw/zinc/70/97/22/584709722.db2.gz RQWZBKRYGXUOPR-DTWKUNHWSA-N 1 2 229.324 2.341 20 0 BEADLO Cc1nnsc1[C@H](C)[N@H+]1CCC[C@@H](F)C1 ZINC000902991453 584709723 /nfs/dbraw/zinc/70/97/23/584709723.db2.gz RQWZBKRYGXUOPR-DTWKUNHWSA-N 1 2 229.324 2.341 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+]2CCC[C@H](F)C2)cn1 ZINC000902992644 584710840 /nfs/dbraw/zinc/71/08/40/584710840.db2.gz MIGMTEQRYHGOEX-QWRGUYRKSA-N 1 2 223.295 2.280 20 0 BEADLO Cc1cnc([C@H](C)[N@H+]2CCC[C@H](F)C2)cn1 ZINC000902992644 584710841 /nfs/dbraw/zinc/71/08/41/584710841.db2.gz MIGMTEQRYHGOEX-QWRGUYRKSA-N 1 2 223.295 2.280 20 0 BEADLO OCc1ccc(F)c(C[N@@H+]2CCC[C@H](F)C2)c1 ZINC000902993066 584711161 /nfs/dbraw/zinc/71/11/61/584711161.db2.gz QCAMZPNYXJKEKR-LBPRGKRZSA-N 1 2 241.281 2.252 20 0 BEADLO OCc1ccc(F)c(C[N@H+]2CCC[C@H](F)C2)c1 ZINC000902993066 584711163 /nfs/dbraw/zinc/71/11/63/584711163.db2.gz QCAMZPNYXJKEKR-LBPRGKRZSA-N 1 2 241.281 2.252 20 0 BEADLO FC(F)Cn1cc[nH+]c1CN1CCC[C@H](F)C1 ZINC000902993562 584711340 /nfs/dbraw/zinc/71/13/40/584711340.db2.gz UYDZQFQLNXKNSP-VIFPVBQESA-N 1 2 247.264 2.082 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@H](F)C2)nc(C)n1 ZINC000902993726 584711584 /nfs/dbraw/zinc/71/15/84/584711584.db2.gz WOYHBXQLQBUVIO-LLVKDONJSA-N 1 2 223.295 2.027 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@H](F)C2)nc(C)n1 ZINC000902993726 584711585 /nfs/dbraw/zinc/71/15/85/584711585.db2.gz WOYHBXQLQBUVIO-LLVKDONJSA-N 1 2 223.295 2.027 20 0 BEADLO CCC(C)(C)NC(=O)[C@H](C)[N@@H+]1CCC[C@@H](F)C1 ZINC000903001708 584716358 /nfs/dbraw/zinc/71/63/58/584716358.db2.gz PUJLJNVUKTZNTL-WDEREUQCSA-N 1 2 244.354 2.114 20 0 BEADLO CCC(C)(C)NC(=O)[C@H](C)[N@H+]1CCC[C@@H](F)C1 ZINC000903001708 584716360 /nfs/dbraw/zinc/71/63/60/584716360.db2.gz PUJLJNVUKTZNTL-WDEREUQCSA-N 1 2 244.354 2.114 20 0 BEADLO CCCn1cc([C@H](C)[NH2+]C/C=C\Cl)nn1 ZINC000903444094 584768987 /nfs/dbraw/zinc/76/89/87/584768987.db2.gz MRHHDTFGSSSDED-WBSSQXGSSA-N 1 2 228.727 2.091 20 0 BEADLO Cl/C=C/C[NH2+][C@H]1CCCc2[nH]ncc21 ZINC000903444135 584768999 /nfs/dbraw/zinc/76/89/99/584768999.db2.gz NFEJTKYEGBQVGL-MAHOQKISSA-N 1 2 211.696 2.129 20 0 BEADLO Cc1cccc(C)c1OCCCN1CC=CC[NH2+]1 ZINC000903488455 584780420 /nfs/dbraw/zinc/78/04/20/584780420.db2.gz DSACJUGBTGVTRB-UHFFFAOYSA-N 1 2 246.354 2.449 20 0 BEADLO CCCN(C(=O)/C=C\c1cn(C)c[nH+]1)C(C)(C)C ZINC000903870704 584814808 /nfs/dbraw/zinc/81/48/08/584814808.db2.gz PDCMDMPUXOVYPT-FPLPWBNLSA-N 1 2 249.358 2.470 20 0 BEADLO Cc1[nH+]c(N)ccc1-c1noc(C2(C)CC2)n1 ZINC000904260363 584859583 /nfs/dbraw/zinc/85/95/83/584859583.db2.gz PTGJKDILFIDWCD-UHFFFAOYSA-N 1 2 230.271 2.074 20 0 BEADLO CC[C@H](C)N1CC[NH+](CCC(=O)C(C)C)CC1 ZINC000832188367 584911137 /nfs/dbraw/zinc/91/11/37/584911137.db2.gz ZFANLJJDHMJOCD-ZDUSSCGKSA-N 1 2 240.391 2.018 20 0 BEADLO CCCC(C)=CC(=O)Nc1cc[nH+]cc1C ZINC000730565417 584912778 /nfs/dbraw/zinc/91/27/78/584912778.db2.gz FKIRJLJJBZSFAA-NTMALXAHSA-N 1 2 218.300 2.497 20 0 BEADLO CC[N@@H+]1CCCC[C@@H]1C(=O)OC[C@H](C)SC ZINC000835684089 584929055 /nfs/dbraw/zinc/92/90/55/584929055.db2.gz CZISQKRQHFRATN-WDEREUQCSA-N 1 2 245.388 2.156 20 0 BEADLO CC[N@H+]1CCCC[C@@H]1C(=O)OC[C@H](C)SC ZINC000835684089 584929056 /nfs/dbraw/zinc/92/90/56/584929056.db2.gz CZISQKRQHFRATN-WDEREUQCSA-N 1 2 245.388 2.156 20 0 BEADLO C/C=C/COC(=O)c1ccc2[nH+]ccn2c1 ZINC000731907675 584930986 /nfs/dbraw/zinc/93/09/86/584930986.db2.gz KIUKZRQZHQBMBC-NSCUHMNNSA-N 1 2 216.240 2.067 20 0 BEADLO CCC/C(C)=C/C(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000764893729 584932504 /nfs/dbraw/zinc/93/25/04/584932504.db2.gz WWBHYEOSNLKZJW-PFEDMVJOSA-N 1 2 247.342 2.130 20 0 BEADLO CCCC(C)=CC(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000764893729 584932505 /nfs/dbraw/zinc/93/25/05/584932505.db2.gz WWBHYEOSNLKZJW-PFEDMVJOSA-N 1 2 247.342 2.130 20 0 BEADLO CC(C)c1nc(N2CCC[C@@H](CCO)C2)cc[nH+]1 ZINC000732039868 584933076 /nfs/dbraw/zinc/93/30/76/584933076.db2.gz YUBQAVPWGMCTOO-LBPRGKRZSA-N 1 2 249.358 2.199 20 0 BEADLO CCOC(C[N@@H+]1CCC[C@H]1C(F)F)OCC ZINC000767823665 584947273 /nfs/dbraw/zinc/94/72/73/584947273.db2.gz UQSRMXACTMCPOI-VIFPVBQESA-N 1 2 237.290 2.115 20 0 BEADLO CCOC(C[N@H+]1CCC[C@H]1C(F)F)OCC ZINC000767823665 584947274 /nfs/dbraw/zinc/94/72/74/584947274.db2.gz UQSRMXACTMCPOI-VIFPVBQESA-N 1 2 237.290 2.115 20 0 BEADLO Cc1cc(NC[C@H](O)CC(C)C)nc(C2CC2)[nH+]1 ZINC000734835536 584969055 /nfs/dbraw/zinc/96/90/55/584969055.db2.gz XWJNQQHLYJKNIJ-GFCCVEGCSA-N 1 2 249.358 2.481 20 0 BEADLO CC1=CC[N@H+](Cn2cccnc2=S)CC1 ZINC000755766085 584980720 /nfs/dbraw/zinc/98/07/20/584980720.db2.gz AALCYVPZJCIPHT-UHFFFAOYSA-N 1 2 221.329 2.222 20 0 BEADLO CC1=CC[N@@H+](Cn2cccnc2=S)CC1 ZINC000755766085 584980721 /nfs/dbraw/zinc/98/07/21/584980721.db2.gz AALCYVPZJCIPHT-UHFFFAOYSA-N 1 2 221.329 2.222 20 0 BEADLO C[C@]1(C(=O)OCc2cc[nH+]c(N)c2)CC=CCC1 ZINC000838184631 585049039 /nfs/dbraw/zinc/04/90/39/585049039.db2.gz SPSSAEBEIMXPPB-AWEZNQCLSA-N 1 2 246.310 2.453 20 0 BEADLO CC[C@H](C)OC(=O)c1ccc2[nH+]ccn2c1 ZINC000738650251 585050194 /nfs/dbraw/zinc/05/01/94/585050194.db2.gz NOABRFILGOLKDV-VIFPVBQESA-N 1 2 218.256 2.290 20 0 BEADLO C[C@H](C(=O)OCc1cc[nH+]c(N)c1)C1CCC1 ZINC000838389891 585055857 /nfs/dbraw/zinc/05/58/57/585055857.db2.gz UPIBXBNRKKXRNH-VIFPVBQESA-N 1 2 234.299 2.143 20 0 BEADLO C[C@H](C(=O)OCCCn1cc[nH+]c1)C1CCC1 ZINC000838389580 585055896 /nfs/dbraw/zinc/05/58/96/585055896.db2.gz SZLFEPQRNXDHHZ-NSHDSACASA-N 1 2 236.315 2.253 20 0 BEADLO C[N@H+](CCCCC1(C)OCCO1)CC(F)F ZINC000838817908 585071683 /nfs/dbraw/zinc/07/16/83/585071683.db2.gz CUVHNOSGZPGMJI-UHFFFAOYSA-N 1 2 237.290 2.117 20 0 BEADLO C[N@@H+](CCCCC1(C)OCCO1)CC(F)F ZINC000838817908 585071684 /nfs/dbraw/zinc/07/16/84/585071684.db2.gz CUVHNOSGZPGMJI-UHFFFAOYSA-N 1 2 237.290 2.117 20 0 BEADLO CCn1ncc(C[NH2+]Cc2ccc(C)c(F)c2)n1 ZINC000838895846 585079159 /nfs/dbraw/zinc/07/91/59/585079159.db2.gz USEONPVOASVMLG-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1ccc(C)nc1Cl ZINC000839026476 585088086 /nfs/dbraw/zinc/08/80/86/585088086.db2.gz XPQSBHJIVQFBBB-NSHDSACASA-N 1 2 240.734 2.264 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1ccc(C)nc1Cl ZINC000839026476 585088087 /nfs/dbraw/zinc/08/80/87/585088087.db2.gz XPQSBHJIVQFBBB-NSHDSACASA-N 1 2 240.734 2.264 20 0 BEADLO O[C@H](C[NH2+][C@H](c1ccccc1)C(F)F)C1CC1 ZINC000839029213 585088368 /nfs/dbraw/zinc/08/83/68/585088368.db2.gz XOTSWXOFUDYGRX-VXGBXAGGSA-N 1 2 241.281 2.353 20 0 BEADLO COC1(C)C[NH+](Cc2cc(C)oc2C)C1 ZINC000839102112 585090992 /nfs/dbraw/zinc/09/09/92/585090992.db2.gz KLZIFKKBRCGPAI-UHFFFAOYSA-N 1 2 209.289 2.117 20 0 BEADLO CCn1ncc(C[N@@H+]2CC(C)(C)[C@@H]2C(C)C)n1 ZINC000839115046 585091861 /nfs/dbraw/zinc/09/18/61/585091861.db2.gz YCDDHNGBRHCMJB-LBPRGKRZSA-N 1 2 236.363 2.164 20 0 BEADLO CCn1ncc(C[N@H+]2CC(C)(C)[C@@H]2C(C)C)n1 ZINC000839115046 585091862 /nfs/dbraw/zinc/09/18/62/585091862.db2.gz YCDDHNGBRHCMJB-LBPRGKRZSA-N 1 2 236.363 2.164 20 0 BEADLO COC1C[NH+](Cc2cncc3ccccc32)C1 ZINC000839130641 585093726 /nfs/dbraw/zinc/09/37/26/585093726.db2.gz DRDSGYQVMGAKBD-UHFFFAOYSA-N 1 2 228.295 2.065 20 0 BEADLO Cc1cc(C[NH+]2CC(O)(C(C)C)C2)ccc1F ZINC000839132589 585093947 /nfs/dbraw/zinc/09/39/47/585093947.db2.gz IYBHQDHMIVXHCR-UHFFFAOYSA-N 1 2 237.318 2.337 20 0 BEADLO CCOCCCO[NH+]=C(N)Cc1cccs1 ZINC000742359941 585124835 /nfs/dbraw/zinc/12/48/35/585124835.db2.gz UGINOXVSQHXKIT-UHFFFAOYSA-N 1 2 242.344 2.216 20 0 BEADLO Fc1cccc(N2CCC[C@H](n3cc[nH+]c3)C2)n1 ZINC000742400567 585125660 /nfs/dbraw/zinc/12/56/60/585125660.db2.gz DUYDRIKSQZXAQP-NSHDSACASA-N 1 2 246.289 2.259 20 0 BEADLO C/C(=C\C(=O)N1CC(n2cc[nH+]c2)C1)C(C)(C)C ZINC000742677477 585129845 /nfs/dbraw/zinc/12/98/45/585129845.db2.gz MSTKPMNGSAORBX-YRNVUSSQSA-N 1 2 247.342 2.259 20 0 BEADLO Cc1ccc(N(C)C(=O)Cn2cc[nH+]c2)cc1C ZINC000746144402 585163695 /nfs/dbraw/zinc/16/36/95/585163695.db2.gz DNRZFFGUZAYOJI-UHFFFAOYSA-N 1 2 243.310 2.163 20 0 BEADLO Cc1cccc(N2CC[NH+](CCF)CC2)c1 ZINC000746500016 585168768 /nfs/dbraw/zinc/16/87/68/585168768.db2.gz QUSWYYMIEWJXMP-UHFFFAOYSA-N 1 2 222.307 2.087 20 0 BEADLO O=c1sccn1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000746602851 585170771 /nfs/dbraw/zinc/17/07/71/585170771.db2.gz HAAOXXYGFDKWNX-LBPRGKRZSA-N 1 2 246.335 2.314 20 0 BEADLO O=c1sccn1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000746602851 585170772 /nfs/dbraw/zinc/17/07/72/585170772.db2.gz HAAOXXYGFDKWNX-LBPRGKRZSA-N 1 2 246.335 2.314 20 0 BEADLO CCO[NH+]=C(N)Cc1ccccc1Cl ZINC000746694675 585172275 /nfs/dbraw/zinc/17/22/75/585172275.db2.gz YMTOFGKJTZJMDO-UHFFFAOYSA-N 1 2 212.680 2.401 20 0 BEADLO C/C=C\C(=O)N(C)Cc1[nH+]cc(C)c(OC)c1C ZINC000746889307 585173127 /nfs/dbraw/zinc/17/31/27/585173127.db2.gz BQISEVDBYKWZPU-SREVYHEPSA-N 1 2 248.326 2.242 20 0 BEADLO CC(C)=CC(=O)Nc1cc(C)[nH+]cc1C ZINC000747106696 585175063 /nfs/dbraw/zinc/17/50/63/585175063.db2.gz FIUWUCKKJKQTRW-UHFFFAOYSA-N 1 2 204.273 2.025 20 0 BEADLO Cc1cc(NC(=O)COC2(C)CCC2)c(C)c[nH+]1 ZINC000747109195 585175158 /nfs/dbraw/zinc/17/51/58/585175158.db2.gz YSPJSSLXUMRZIT-UHFFFAOYSA-N 1 2 248.326 2.018 20 0 BEADLO Cn1c[nH+]cc1COC(=O)CCC1CCCC1 ZINC000747785042 585184337 /nfs/dbraw/zinc/18/43/37/585184337.db2.gz YUXCGKLVSPBTNW-UHFFFAOYSA-N 1 2 236.315 2.434 20 0 BEADLO C[N@H+](Cc1cn[nH]c1)Cc1ccc(Cl)nc1 ZINC000748039780 585186628 /nfs/dbraw/zinc/18/66/28/585186628.db2.gz WBKNHDUMWNHMII-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO C[N@@H+](Cc1cn[nH]c1)Cc1ccc(Cl)nc1 ZINC000748039780 585186629 /nfs/dbraw/zinc/18/66/29/585186629.db2.gz WBKNHDUMWNHMII-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO O=C(OCc1ccc(-n2cc[nH+]c2)cc1)C1CC1 ZINC000748495606 585193417 /nfs/dbraw/zinc/19/34/17/585193417.db2.gz UWDDJCWDZIUUHG-UHFFFAOYSA-N 1 2 242.278 2.326 20 0 BEADLO CCC(=O)OCc1ccc(-n2cc[nH+]c2)cc1 ZINC000748496177 585193562 /nfs/dbraw/zinc/19/35/62/585193562.db2.gz ZLZBLVXIZGDWOU-UHFFFAOYSA-N 1 2 230.267 2.326 20 0 BEADLO c1csc(N2CCC(n3cc[nH+]c3)CC2)n1 ZINC000748569467 585194283 /nfs/dbraw/zinc/19/42/83/585194283.db2.gz UFILBAZZQZRYEF-UHFFFAOYSA-N 1 2 234.328 2.181 20 0 BEADLO C[C@H](C(=O)NC1=[NH+]CCS1)C1CCCC1 ZINC000749335426 585201416 /nfs/dbraw/zinc/20/14/16/585201416.db2.gz MOAUFFYLMTZUNG-QMMMGPOBSA-N 1 2 226.345 2.032 20 0 BEADLO Cc1cc([C@H]2CCCN2Cc2[nH+]ccn2C)no1 ZINC000750517926 585216543 /nfs/dbraw/zinc/21/65/43/585216543.db2.gz LBIVQWMICQZAEG-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO CCC[N@H+](CC)Cn1ncc2ccccc2c1=O ZINC000750602934 585217901 /nfs/dbraw/zinc/21/79/01/585217901.db2.gz JVDNDKNIBBDDLV-UHFFFAOYSA-N 1 2 245.326 2.086 20 0 BEADLO CCC[N@@H+](CC)Cn1ncc2ccccc2c1=O ZINC000750602934 585217902 /nfs/dbraw/zinc/21/79/02/585217902.db2.gz JVDNDKNIBBDDLV-UHFFFAOYSA-N 1 2 245.326 2.086 20 0 BEADLO CS/C=C/C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000751582898 585233894 /nfs/dbraw/zinc/23/38/94/585233894.db2.gz WPASZCSMAKGOEJ-QPJJXVBHSA-N 1 2 233.296 2.150 20 0 BEADLO CCn1cnn(C[N@@H+]2CC[C@@H](C)[C@H]2C)c1=S ZINC000751940298 585239696 /nfs/dbraw/zinc/23/96/96/585239696.db2.gz HIQRNMGLIMEPOL-NXEZZACHSA-N 1 2 240.376 2.122 20 0 BEADLO CCn1cnn(C[N@H+]2CC[C@@H](C)[C@H]2C)c1=S ZINC000751940298 585239697 /nfs/dbraw/zinc/23/96/97/585239697.db2.gz HIQRNMGLIMEPOL-NXEZZACHSA-N 1 2 240.376 2.122 20 0 BEADLO C[C@H](C(=O)OCCn1cc[nH+]c1)c1ccccc1 ZINC000751974233 585240189 /nfs/dbraw/zinc/24/01/89/585240189.db2.gz PUFLXTJXINPRSL-LBPRGKRZSA-N 1 2 244.294 2.230 20 0 BEADLO C[C@@H](C(=O)OCCn1cc[nH+]c1)c1ccccc1 ZINC000751983757 585240447 /nfs/dbraw/zinc/24/04/47/585240447.db2.gz PUFLXTJXINPRSL-GFCCVEGCSA-N 1 2 244.294 2.230 20 0 BEADLO C[C@H]1CC/C(=C\C(=O)N(C)Cc2[nH]cc[nH+]2)C1 ZINC000753607999 585263744 /nfs/dbraw/zinc/26/37/44/585263744.db2.gz PBJOLDZSJQRUQH-NGPGYTDTSA-N 1 2 233.315 2.115 20 0 BEADLO Cc1cn2c([nH+]1)CN(CCC(=O)C(C)(C)C)CC2 ZINC000753749124 585268222 /nfs/dbraw/zinc/26/82/22/585268222.db2.gz OGYFRLYSSOPCDU-UHFFFAOYSA-N 1 2 249.358 2.012 20 0 BEADLO C/C(=C/C(=O)NCc1c[nH+]c[nH]1)C(C)(C)C ZINC000754296124 585282297 /nfs/dbraw/zinc/28/22/97/585282297.db2.gz MQVHEKQJGXNTHD-UITAMQMPSA-N 1 2 221.304 2.018 20 0 BEADLO CC(=CC(=O)NCc1c[nH]c[nH+]1)C(C)(C)C ZINC000754296124 585282298 /nfs/dbraw/zinc/28/22/98/585282298.db2.gz MQVHEKQJGXNTHD-UITAMQMPSA-N 1 2 221.304 2.018 20 0 BEADLO CCC/C(C)=C\C(=O)NCc1[nH]c[nH+]c1C ZINC000754347034 585282749 /nfs/dbraw/zinc/28/27/49/585282749.db2.gz XRFHBYIXGJDZTL-TWGQIWQCSA-N 1 2 221.304 2.081 20 0 BEADLO C[N@@H+](Cc1cn[nH]c1)Cc1cnc(Cl)s1 ZINC000754661155 585288831 /nfs/dbraw/zinc/28/88/31/585288831.db2.gz WYTYZGITYNGDEL-UHFFFAOYSA-N 1 2 242.735 2.152 20 0 BEADLO C[N@H+](Cc1cn[nH]c1)Cc1cnc(Cl)s1 ZINC000754661155 585288832 /nfs/dbraw/zinc/28/88/32/585288832.db2.gz WYTYZGITYNGDEL-UHFFFAOYSA-N 1 2 242.735 2.152 20 0 BEADLO Clc1cc2c(nc[nH+]c2N2CCCC2)[nH]1 ZINC000754671700 585289295 /nfs/dbraw/zinc/28/92/95/585289295.db2.gz OUOHSWMILXYXTM-UHFFFAOYSA-N 1 2 222.679 2.163 20 0 BEADLO C/C(=C\c1ccccc1)C[N@@H+](C)[C@@H]1CCOC1=O ZINC000755192437 585295849 /nfs/dbraw/zinc/29/58/49/585295849.db2.gz BUJIELDZSASPOY-IEZBTEQYSA-N 1 2 245.322 2.337 20 0 BEADLO C/C(=C\c1ccccc1)C[N@H+](C)[C@@H]1CCOC1=O ZINC000755192437 585295850 /nfs/dbraw/zinc/29/58/50/585295850.db2.gz BUJIELDZSASPOY-IEZBTEQYSA-N 1 2 245.322 2.337 20 0 BEADLO FCC[N@@H+]1CCO[C@@H](CCc2ccccc2)C1 ZINC000755261035 585296886 /nfs/dbraw/zinc/29/68/86/585296886.db2.gz IDPJYVWDHPADQB-AWEZNQCLSA-N 1 2 237.318 2.290 20 0 BEADLO FCC[N@H+]1CCO[C@@H](CCc2ccccc2)C1 ZINC000755261035 585296887 /nfs/dbraw/zinc/29/68/87/585296887.db2.gz IDPJYVWDHPADQB-AWEZNQCLSA-N 1 2 237.318 2.290 20 0 BEADLO O=C(C=C1CCC1)Nc1cccc2[nH+]ccn21 ZINC000755349155 585298200 /nfs/dbraw/zinc/29/82/00/585298200.db2.gz MMCMUTBTMMKFKT-UHFFFAOYSA-N 1 2 227.267 2.383 20 0 BEADLO CCC/C=C/C(=O)N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000756130409 585315055 /nfs/dbraw/zinc/31/50/55/585315055.db2.gz LWJADGLRBBOMCD-BTDICHCPSA-N 1 2 247.342 2.092 20 0 BEADLO Cl/C=C\C[N@@H+]1CCO[C@@H](C2CCC2)C1 ZINC000839623820 585332596 /nfs/dbraw/zinc/33/25/96/585332596.db2.gz UUXNRLALELMNBG-SRMRHOMVSA-N 1 2 215.724 2.240 20 0 BEADLO Cl/C=C\C[N@H+]1CCO[C@@H](C2CCC2)C1 ZINC000839623820 585332597 /nfs/dbraw/zinc/33/25/97/585332597.db2.gz UUXNRLALELMNBG-SRMRHOMVSA-N 1 2 215.724 2.240 20 0 BEADLO Cl/C=C/C[N@@H+]1CCO[C@H](C2CCC2)C1 ZINC000839623819 585332709 /nfs/dbraw/zinc/33/27/09/585332709.db2.gz UUXNRLALELMNBG-DGXRNCNBSA-N 1 2 215.724 2.240 20 0 BEADLO Cl/C=C/C[N@H+]1CCO[C@H](C2CCC2)C1 ZINC000839623819 585332710 /nfs/dbraw/zinc/33/27/10/585332710.db2.gz UUXNRLALELMNBG-DGXRNCNBSA-N 1 2 215.724 2.240 20 0 BEADLO CC[N@@H+](Cc1nonc1C)Cc1occc1C ZINC000839661853 585334041 /nfs/dbraw/zinc/33/40/41/585334041.db2.gz RPXNIZICJXBDRN-UHFFFAOYSA-N 1 2 235.287 2.302 20 0 BEADLO CC[N@H+](Cc1nonc1C)Cc1occc1C ZINC000839661853 585334042 /nfs/dbraw/zinc/33/40/42/585334042.db2.gz RPXNIZICJXBDRN-UHFFFAOYSA-N 1 2 235.287 2.302 20 0 BEADLO Cc1ccc2[nH+]c(COC(=O)[C@@H]3C[C@@H]3C)cn2c1 ZINC000758031817 585348602 /nfs/dbraw/zinc/34/86/02/585348602.db2.gz ZQQLSZYXRZICGA-CMPLNLGQSA-N 1 2 244.294 2.342 20 0 BEADLO NC(=[NH+]OCC[C@H]1CCCCO1)c1ccccc1 ZINC000758768687 585359794 /nfs/dbraw/zinc/35/97/94/585359794.db2.gz LJRHLXOPINQHCF-CYBMUJFWSA-N 1 2 248.326 2.492 20 0 BEADLO COCC[N@H+](Cc1ccoc1)Cc1ccccn1 ZINC000809734152 585371454 /nfs/dbraw/zinc/37/14/54/585371454.db2.gz AELYQWRPPMPQIO-UHFFFAOYSA-N 1 2 246.310 2.323 20 0 BEADLO COCC[N@@H+](Cc1ccoc1)Cc1ccccn1 ZINC000809734152 585371455 /nfs/dbraw/zinc/37/14/55/585371455.db2.gz AELYQWRPPMPQIO-UHFFFAOYSA-N 1 2 246.310 2.323 20 0 BEADLO COCC[N@H+](Cc1ccoc1)Cc1cccnc1 ZINC000809741531 585378646 /nfs/dbraw/zinc/37/86/46/585378646.db2.gz PHKZRRCETHHEDE-UHFFFAOYSA-N 1 2 246.310 2.323 20 0 BEADLO COCC[N@@H+](Cc1ccoc1)Cc1cccnc1 ZINC000809741531 585378647 /nfs/dbraw/zinc/37/86/47/585378647.db2.gz PHKZRRCETHHEDE-UHFFFAOYSA-N 1 2 246.310 2.323 20 0 BEADLO CCc1noc(C[N@@H+]2CC[C@H](C(F)(F)F)C2)n1 ZINC000761048328 585404023 /nfs/dbraw/zinc/40/40/23/585404023.db2.gz XEPKSDRLHCKQGE-ZETCQYMHSA-N 1 2 249.236 2.016 20 0 BEADLO CCc1noc(C[N@H+]2CC[C@H](C(F)(F)F)C2)n1 ZINC000761048328 585404024 /nfs/dbraw/zinc/40/40/24/585404024.db2.gz XEPKSDRLHCKQGE-ZETCQYMHSA-N 1 2 249.236 2.016 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)nn1C ZINC000761054842 585404619 /nfs/dbraw/zinc/40/46/19/585404619.db2.gz JXRFBOCSHRGNGS-SECBINFHSA-N 1 2 247.264 2.113 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@@H](C(F)(F)F)C2)nn1C ZINC000761054842 585404620 /nfs/dbraw/zinc/40/46/20/585404620.db2.gz JXRFBOCSHRGNGS-SECBINFHSA-N 1 2 247.264 2.113 20 0 BEADLO c1csc(-c2noc(C[N@@H+]3CC[C@H]4C[C@H]43)n2)c1 ZINC000761084659 585407517 /nfs/dbraw/zinc/40/75/17/585407517.db2.gz AYKYNXYYDZXPFD-DTWKUNHWSA-N 1 2 247.323 2.392 20 0 BEADLO c1csc(-c2noc(C[N@H+]3CC[C@H]4C[C@H]43)n2)c1 ZINC000761084659 585407518 /nfs/dbraw/zinc/40/75/18/585407518.db2.gz AYKYNXYYDZXPFD-DTWKUNHWSA-N 1 2 247.323 2.392 20 0 BEADLO FC(F)[C@H]1CC[N@H+](Cc2cscn2)C1 ZINC000761110713 585410378 /nfs/dbraw/zinc/41/03/78/585410378.db2.gz UPLSNMCCRXOATI-ZETCQYMHSA-N 1 2 218.272 2.230 20 0 BEADLO FC(F)[C@H]1CC[N@@H+](Cc2cscn2)C1 ZINC000761110713 585410379 /nfs/dbraw/zinc/41/03/79/585410379.db2.gz UPLSNMCCRXOATI-ZETCQYMHSA-N 1 2 218.272 2.230 20 0 BEADLO Cc1cccn2cc(COC(=O)C3(C)CC3)[nH+]c12 ZINC000761423600 585415387 /nfs/dbraw/zinc/41/53/87/585415387.db2.gz NISFAQWTKFMRGG-UHFFFAOYSA-N 1 2 244.294 2.486 20 0 BEADLO CC(=O)CC[N@H+](CC(F)F)CC1CCC1 ZINC000761720248 585418051 /nfs/dbraw/zinc/41/80/51/585418051.db2.gz HERREMWOVXSETD-UHFFFAOYSA-N 1 2 219.275 2.333 20 0 BEADLO CC(=O)CC[N@@H+](CC(F)F)CC1CCC1 ZINC000761720248 585418052 /nfs/dbraw/zinc/41/80/52/585418052.db2.gz HERREMWOVXSETD-UHFFFAOYSA-N 1 2 219.275 2.333 20 0 BEADLO Cc1cnc(C)c(NC[C@@H](C)Cn2cc[nH+]c2)n1 ZINC000762784526 585437153 /nfs/dbraw/zinc/43/71/53/585437153.db2.gz DNKXFZNEMHBDIV-SNVBAGLBSA-N 1 2 245.330 2.038 20 0 BEADLO Cc1ccsc1C(=O)OCCn1cc[nH+]c1 ZINC000763114253 585443265 /nfs/dbraw/zinc/44/32/65/585443265.db2.gz GOEHSXRXOXIPRZ-UHFFFAOYSA-N 1 2 236.296 2.110 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)C1CCCCC1 ZINC000763287314 585445935 /nfs/dbraw/zinc/44/59/35/585445935.db2.gz HWHGDZZAVSPNGN-UHFFFAOYSA-N 1 2 236.315 2.397 20 0 BEADLO Cc1ccc(NC(=O)[C@H](O)C(C)(C)C)c(C)[nH+]1 ZINC000765152039 585481627 /nfs/dbraw/zinc/48/16/27/585481627.db2.gz AAKPDGKPDFPSDO-NSHDSACASA-N 1 2 236.315 2.044 20 0 BEADLO CCc1nnc([C@H](C)[NH2+]Cc2cc(C)oc2C)[nH]1 ZINC000767394082 585518966 /nfs/dbraw/zinc/51/89/66/585518966.db2.gz YUGVFOUWSFCMFL-VIFPVBQESA-N 1 2 248.330 2.428 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@H](C)C2)c(C)o1 ZINC000768228486 585534143 /nfs/dbraw/zinc/53/41/43/585534143.db2.gz IXNKYHKAXVSJRA-SNVBAGLBSA-N 1 2 209.289 2.117 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@H](C)C2)c(C)o1 ZINC000768228486 585534144 /nfs/dbraw/zinc/53/41/44/585534144.db2.gz IXNKYHKAXVSJRA-SNVBAGLBSA-N 1 2 209.289 2.117 20 0 BEADLO C[C@H]1C[C@@H]1C(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000769369632 585554861 /nfs/dbraw/zinc/55/48/61/585554861.db2.gz MWMFPWSNFLFXFD-SDDRHHMPSA-N 1 2 249.358 2.070 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H](F)c1ccccc1 ZINC000769585674 585559953 /nfs/dbraw/zinc/55/99/53/585559953.db2.gz INTWLLCRPUCBBA-LBPRGKRZSA-N 1 2 247.273 2.045 20 0 BEADLO C[N@H+](CCF)Cc1nc2ccccc2o1 ZINC000770173424 585571278 /nfs/dbraw/zinc/57/12/78/585571278.db2.gz NIPADJVDQWBCFV-UHFFFAOYSA-N 1 2 208.236 2.229 20 0 BEADLO C[N@@H+](CCF)Cc1nc2ccccc2o1 ZINC000770173424 585571279 /nfs/dbraw/zinc/57/12/79/585571279.db2.gz NIPADJVDQWBCFV-UHFFFAOYSA-N 1 2 208.236 2.229 20 0 BEADLO COc1c(F)cc(F)cc1NCc1[nH]cc[nH+]1 ZINC000770563902 585576629 /nfs/dbraw/zinc/57/66/29/585576629.db2.gz QXEQPVAKQRUWGZ-UHFFFAOYSA-N 1 2 239.225 2.309 20 0 BEADLO C[C@@H]1C[C@@H]1C(=O)OCc1cccc2[nH+]ccn21 ZINC000770733473 585580589 /nfs/dbraw/zinc/58/05/89/585580589.db2.gz MLKPAYMRYUKYFU-KOLCDFICSA-N 1 2 230.267 2.034 20 0 BEADLO CC(C)(C)C(=O)OCc1cccc2[nH+]ccn21 ZINC000770922772 585584378 /nfs/dbraw/zinc/58/43/78/585584378.db2.gz RVWLSNIQHSUQNU-UHFFFAOYSA-N 1 2 232.283 2.424 20 0 BEADLO COc1cc[nH+]cc1COC(=O)/C=C(/C)C1CC1 ZINC000805420184 585591460 /nfs/dbraw/zinc/59/14/60/585591460.db2.gz UNGGWADZFIGCAT-YFHOEESVSA-N 1 2 247.294 2.490 20 0 BEADLO CC[C@@H](CC(=O)OCCn1cc[nH+]c1)C(C)C ZINC000771953926 585605447 /nfs/dbraw/zinc/60/54/47/585605447.db2.gz YQLUNTHQSRVJHZ-LBPRGKRZSA-N 1 2 238.331 2.499 20 0 BEADLO Cc1ccc([C@@H](C)C(=O)OCCn2cc[nH+]c2)o1 ZINC000771983969 585606216 /nfs/dbraw/zinc/60/62/16/585606216.db2.gz CRMGHOKQXBAETO-LLVKDONJSA-N 1 2 248.282 2.131 20 0 BEADLO C[C@@H]1CC[C@@H](CC(=O)OCCn2cc[nH+]c2)C1 ZINC000772002332 585606791 /nfs/dbraw/zinc/60/67/91/585606791.db2.gz HWTFSHNKQKMFFW-VXGBXAGGSA-N 1 2 236.315 2.253 20 0 BEADLO CC[C@H](OC)C(=O)OCc1ccc(C)[nH+]c1C ZINC000772063577 585607708 /nfs/dbraw/zinc/60/77/08/585607708.db2.gz IENTWQNBUFAJDK-LBPRGKRZSA-N 1 2 237.299 2.167 20 0 BEADLO Cc1ccc(COC(=O)C2=COCC2)c(C)[nH+]1 ZINC000772133797 585608799 /nfs/dbraw/zinc/60/87/99/585608799.db2.gz CSCDWUKGFFEDND-UHFFFAOYSA-N 1 2 233.267 2.046 20 0 BEADLO Cc1cc(NC(=O)C2(F)CCCC2)c(C)c[nH+]1 ZINC000772187161 585609839 /nfs/dbraw/zinc/60/98/39/585609839.db2.gz STPHKEADWMGHSO-UHFFFAOYSA-N 1 2 236.290 2.341 20 0 BEADLO Cc1ccc(COC(=O)[C@H]2CCO[C@H]2C)c(C)[nH+]1 ZINC000772237352 585610529 /nfs/dbraw/zinc/61/05/29/585610529.db2.gz XEZGJBNEFCJEOV-AAEUAGOBSA-N 1 2 249.310 2.167 20 0 BEADLO Cc1ccc(COC(=O)[C@@]2(C)CCOC2)c(C)[nH+]1 ZINC000772314691 585612485 /nfs/dbraw/zinc/61/24/85/585612485.db2.gz IDERBWVMIQZXQA-AWEZNQCLSA-N 1 2 249.310 2.168 20 0 BEADLO CC(C)c1nc(N2CCCOC[C@@H]2C)cc[nH+]1 ZINC000772908652 585627218 /nfs/dbraw/zinc/62/72/18/585627218.db2.gz DCRAPAUTFGODAJ-NSHDSACASA-N 1 2 235.331 2.215 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)NCc1c[nH+]c[nH]1 ZINC000773102553 585631485 /nfs/dbraw/zinc/63/14/85/585631485.db2.gz YWBLGRINLGJHFK-WEVVVXLNSA-N 1 2 221.304 2.018 20 0 BEADLO CC(=CC(C)(C)C)C(=O)NCc1c[nH]c[nH+]1 ZINC000773102553 585631486 /nfs/dbraw/zinc/63/14/86/585631486.db2.gz YWBLGRINLGJHFK-WEVVVXLNSA-N 1 2 221.304 2.018 20 0 BEADLO CCCC(C)=CC(=O)Nc1cc[nH+]cc1N(C)C ZINC000774094580 585650217 /nfs/dbraw/zinc/65/02/17/585650217.db2.gz HRQXBQSAOMFKPN-LUAWRHEFSA-N 1 2 247.342 2.254 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1C(=O)OCCn1cc[nH+]c1 ZINC000775085555 585671901 /nfs/dbraw/zinc/67/19/01/585671901.db2.gz XXSBERFNGVRKBD-DGCLKSJQSA-N 1 2 236.315 2.109 20 0 BEADLO CC(C)c1cnc(C[N@@H+]2CCOCC[C@H]2C)o1 ZINC000775569941 585680468 /nfs/dbraw/zinc/68/04/68/585680468.db2.gz JWCGMULSMFKDGK-LLVKDONJSA-N 1 2 238.331 2.409 20 0 BEADLO CC(C)c1cnc(C[N@H+]2CCOCC[C@H]2C)o1 ZINC000775569941 585680469 /nfs/dbraw/zinc/68/04/69/585680469.db2.gz JWCGMULSMFKDGK-LLVKDONJSA-N 1 2 238.331 2.409 20 0 BEADLO CCCC[C@H]([NH2+]C1CC(C(F)F)C1)C(=O)OC ZINC000775980618 585688835 /nfs/dbraw/zinc/68/88/35/585688835.db2.gz SAQBPCFJPBLJKN-RTBKNWGFSA-N 1 2 249.301 2.352 20 0 BEADLO COC(=O)[C@H]1C[C@@H](C)CC[N@@H+]1Cc1ccoc1 ZINC000775996958 585689296 /nfs/dbraw/zinc/68/92/96/585689296.db2.gz ATAPLWXBUOWALE-CMPLNLGQSA-N 1 2 237.299 2.053 20 0 BEADLO COC(=O)[C@H]1C[C@@H](C)CC[N@H+]1Cc1ccoc1 ZINC000775996958 585689297 /nfs/dbraw/zinc/68/92/97/585689297.db2.gz ATAPLWXBUOWALE-CMPLNLGQSA-N 1 2 237.299 2.053 20 0 BEADLO NC(=[NH+]OCCCO)c1cccc2ccccc21 ZINC000776297084 585695404 /nfs/dbraw/zinc/69/54/04/585695404.db2.gz LWLQBOPNNRXJRJ-UHFFFAOYSA-N 1 2 244.294 2.069 20 0 BEADLO CC[C@@H](C)[C@@H](C)NC(=O)c1cccc2[nH+]ccn21 ZINC000776851464 585706224 /nfs/dbraw/zinc/70/62/24/585706224.db2.gz CEXFHKDNBFBBQN-GHMZBOCLSA-N 1 2 245.326 2.499 20 0 BEADLO CC(C)c1cnc(C[NH2+][C@H](C)c2cn[nH]c2)o1 ZINC000778143483 585726091 /nfs/dbraw/zinc/72/60/91/585726091.db2.gz XHFLEKVOOOCYQH-SECBINFHSA-N 1 2 234.303 2.372 20 0 BEADLO CCc1cnc(CN2CCC[C@@H]2c2[nH]cc[nH+]2)o1 ZINC000778228752 585728599 /nfs/dbraw/zinc/72/85/99/585728599.db2.gz LCDIOUOSUDVFET-LLVKDONJSA-N 1 2 246.314 2.297 20 0 BEADLO Cc1cnc(=S)n(C[N@H+]2CC=CCC2)c1 ZINC000778577752 585737871 /nfs/dbraw/zinc/73/78/71/585737871.db2.gz XMRZMPMRBFATCP-UHFFFAOYSA-N 1 2 221.329 2.140 20 0 BEADLO Cc1cnc(=S)n(C[N@@H+]2CC=CCC2)c1 ZINC000778577752 585737872 /nfs/dbraw/zinc/73/78/72/585737872.db2.gz XMRZMPMRBFATCP-UHFFFAOYSA-N 1 2 221.329 2.140 20 0 BEADLO Cn1c[nH+]cc1COc1ccc(C(C)(C)O)cc1 ZINC000778595268 585737996 /nfs/dbraw/zinc/73/79/96/585737996.db2.gz NBSHPQCXUVYHRT-UHFFFAOYSA-N 1 2 246.310 2.227 20 0 BEADLO Cn1c[nH+]cc1COC(=O)C[C@H]1C=CCCC1 ZINC000778657244 585738455 /nfs/dbraw/zinc/73/84/55/585738455.db2.gz GIAXJLZHWNOIBE-NSHDSACASA-N 1 2 234.299 2.210 20 0 BEADLO O[C@H](C[N@@H+]1CCC=C(F)C1)c1cccc(F)c1 ZINC000778961440 585743088 /nfs/dbraw/zinc/74/30/88/585743088.db2.gz RCAQEQNCVNVTJT-CYBMUJFWSA-N 1 2 239.265 2.418 20 0 BEADLO O[C@H](C[N@H+]1CCC=C(F)C1)c1cccc(F)c1 ZINC000778961440 585743089 /nfs/dbraw/zinc/74/30/89/585743089.db2.gz RCAQEQNCVNVTJT-CYBMUJFWSA-N 1 2 239.265 2.418 20 0 BEADLO Cc1ccc([C@@H](O)C[NH2+][C@@H](C)c2cn[nH]c2C)o1 ZINC000779071252 585744570 /nfs/dbraw/zinc/74/45/70/585744570.db2.gz DBDWNGOWLXQPIP-CABZTGNLSA-N 1 2 249.314 2.004 20 0 BEADLO CCn1cc(C[N@H+](C)Cc2ccc(F)nc2)cn1 ZINC000779158041 585746207 /nfs/dbraw/zinc/74/62/07/585746207.db2.gz MJGCFTTVXWCTDJ-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO CCn1cc(C[N@@H+](C)Cc2ccc(F)nc2)cn1 ZINC000779158041 585746208 /nfs/dbraw/zinc/74/62/08/585746208.db2.gz MJGCFTTVXWCTDJ-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO CCN(CC)c1ccc(N[C@H](C)CCO)c[nH+]1 ZINC000779417691 585754462 /nfs/dbraw/zinc/75/44/62/585754462.db2.gz AZFFROCMROFLPD-LLVKDONJSA-N 1 2 237.347 2.111 20 0 BEADLO Cc1cc(C)nc(N2CCC[C@@H]2c2[nH]cc[nH+]2)n1 ZINC000779429635 585754986 /nfs/dbraw/zinc/75/49/86/585754986.db2.gz UUTMUVXMKJHBOC-LLVKDONJSA-N 1 2 243.314 2.158 20 0 BEADLO CCC(C)=C(C)C(=O)Nc1cc[nH+]cc1C ZINC000779926311 585770013 /nfs/dbraw/zinc/77/00/13/585770013.db2.gz SDMVPDIMNPANMT-PKNBQFBNSA-N 1 2 218.300 2.497 20 0 BEADLO CC[C@@H](C)[C@H](C)C(=O)OCCn1cc[nH+]c1 ZINC000780242681 585774459 /nfs/dbraw/zinc/77/44/59/585774459.db2.gz OCLQNLPHCCQREM-MNOVXSKESA-N 1 2 224.304 2.109 20 0 BEADLO Cc1cc(Nc2cnn(C)c2C2CC2)nc(C)[nH+]1 ZINC000780582422 585781830 /nfs/dbraw/zinc/78/18/30/585781830.db2.gz CURSIQHGDZHFMI-UHFFFAOYSA-N 1 2 243.314 2.448 20 0 BEADLO CC/C(C)=C(/C)C(=O)NCCCn1cc[nH+]c1 ZINC000780848727 585785312 /nfs/dbraw/zinc/78/53/12/585785312.db2.gz FZLPYGUNXWAHQU-QXMHVHEDSA-N 1 2 235.331 2.136 20 0 BEADLO CCc1cc(N2CCC[C@H]2c2[nH]cc[nH+]2)ncn1 ZINC000781667369 585801444 /nfs/dbraw/zinc/80/14/44/585801444.db2.gz BEQNQAJKUVRFHL-NSHDSACASA-N 1 2 243.314 2.104 20 0 BEADLO CCc1cc(N2CCC[C@@H]2c2[nH]cc[nH+]2)ncn1 ZINC000781667368 585801531 /nfs/dbraw/zinc/80/15/31/585801531.db2.gz BEQNQAJKUVRFHL-LLVKDONJSA-N 1 2 243.314 2.104 20 0 BEADLO CN(C)c1cc(COC(=O)C2=CCCC2)cc[nH+]1 ZINC000782147276 585808586 /nfs/dbraw/zinc/80/85/86/585808586.db2.gz PYNXVUFAVBVCBZ-UHFFFAOYSA-N 1 2 246.310 2.301 20 0 BEADLO CO[C@@H](C)CO[NH+]=C(N)Cc1ccccc1C ZINC000782337079 585815436 /nfs/dbraw/zinc/81/54/36/585815436.db2.gz NDXBLNSYGCMCTH-NSHDSACASA-N 1 2 236.315 2.071 20 0 BEADLO C/C(=C\C(=O)OCCCn1cc[nH+]c1)C1CC1 ZINC000783084982 585827554 /nfs/dbraw/zinc/82/75/54/585827554.db2.gz JWCXOZVVWSGSSP-PKNBQFBNSA-N 1 2 234.299 2.173 20 0 BEADLO C[C@@H](C(=O)OC1CC1)[N@@H+]1CCc2ccccc2C1 ZINC000783187512 585829212 /nfs/dbraw/zinc/82/92/12/585829212.db2.gz CSABEWIRPQCQKT-NSHDSACASA-N 1 2 245.322 2.139 20 0 BEADLO C[C@@H](C(=O)OC1CC1)[N@H+]1CCc2ccccc2C1 ZINC000783187512 585829213 /nfs/dbraw/zinc/82/92/13/585829213.db2.gz CSABEWIRPQCQKT-NSHDSACASA-N 1 2 245.322 2.139 20 0 BEADLO COc1cccc(C(N)=[NH+]OCCC2CC2)c1 ZINC000783557157 585836759 /nfs/dbraw/zinc/83/67/59/585836759.db2.gz QXICETGOPNTWES-UHFFFAOYSA-N 1 2 234.299 2.342 20 0 BEADLO CCCCCCO[NH+]=C(N)COC(C)C ZINC000783553187 585836813 /nfs/dbraw/zinc/83/68/13/585836813.db2.gz KHNOBWXRJVHFQY-UHFFFAOYSA-N 1 2 216.325 2.490 20 0 BEADLO CC(C)(C)/C=C/C(=O)OCCCn1cc[nH+]c1 ZINC000783633196 585838825 /nfs/dbraw/zinc/83/88/25/585838825.db2.gz IIOYPUFPKUMTMA-AATRIKPKSA-N 1 2 236.315 2.419 20 0 BEADLO C[C@@H](C(=O)OCCCn1cc[nH+]c1)C(C)(C)C ZINC000783682777 585840004 /nfs/dbraw/zinc/84/00/04/585840004.db2.gz OOGJOHSKMKUZLF-NSHDSACASA-N 1 2 238.331 2.499 20 0 BEADLO CC(C)[C@@H](F)C(=O)Nc1cccc2[nH+]ccn21 ZINC000784120354 585850314 /nfs/dbraw/zinc/85/03/14/585850314.db2.gz VMWYJLVJTYCFBK-LLVKDONJSA-N 1 2 235.262 2.267 20 0 BEADLO CC[C@]1(CO)CCC[N@H+]1CC(F)(F)C(F)F ZINC000784388117 585857884 /nfs/dbraw/zinc/85/78/84/585857884.db2.gz HFCSYTWMMMBGMP-SECBINFHSA-N 1 2 243.244 2.124 20 0 BEADLO CC[C@]1(CO)CCC[N@@H+]1CC(F)(F)C(F)F ZINC000784388117 585857883 /nfs/dbraw/zinc/85/78/83/585857883.db2.gz HFCSYTWMMMBGMP-SECBINFHSA-N 1 2 243.244 2.124 20 0 BEADLO CC(C)[C@H](F)C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000784459521 585860772 /nfs/dbraw/zinc/86/07/72/585860772.db2.gz KBKYJGUDBIISDS-ZJUUUORDSA-N 1 2 239.294 2.067 20 0 BEADLO CC(C)C(C)(C)C(=O)OCc1c[nH+]cn1C ZINC000784524288 585862370 /nfs/dbraw/zinc/86/23/70/585862370.db2.gz NDSWTXZYZSPBRL-UHFFFAOYSA-N 1 2 224.304 2.146 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)OCCCn1cc[nH+]c1 ZINC000784614454 585864818 /nfs/dbraw/zinc/86/48/18/585864818.db2.gz RMYMFRRPRWTSGG-RYUDHWBXSA-N 1 2 238.331 2.499 20 0 BEADLO CC(C)[C@@H]1C[C@H]1C(=O)OCCCn1cc[nH+]c1 ZINC000784785922 585866279 /nfs/dbraw/zinc/86/62/79/585866279.db2.gz HGSZKSFORHLSEM-NWDGAFQWSA-N 1 2 236.315 2.109 20 0 BEADLO O=C(OCC1CC1)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000785017603 585869823 /nfs/dbraw/zinc/86/98/23/585869823.db2.gz HMILPOGJLMVEFM-GFCCVEGCSA-N 1 2 249.314 2.067 20 0 BEADLO CC(C)/C=C\C(=O)OCc1cc[nH+]c(N(C)C)c1 ZINC000785048717 585870079 /nfs/dbraw/zinc/87/00/79/585870079.db2.gz BCCRKQCWGUHECP-WAYWQWQTSA-N 1 2 248.326 2.403 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OCC[C@@H]1CCCO1 ZINC000786731568 585896856 /nfs/dbraw/zinc/89/68/56/585896856.db2.gz CELUSBNYRXWHES-LBPRGKRZSA-N 1 2 248.326 2.411 20 0 BEADLO COc1ccc([NH2+]C[C@@H]2C[C@H]2C)cc1NC(N)=O ZINC000787317107 585906691 /nfs/dbraw/zinc/90/66/91/585906691.db2.gz YLLKJSGCWNVIDY-BDAKNGLRSA-N 1 2 249.314 2.254 20 0 BEADLO Cc1[nH+]c2cc(NC(=O)C(F)F)ccc2n1C ZINC000787401840 585908797 /nfs/dbraw/zinc/90/87/97/585908797.db2.gz HIFKTSYPUHQARX-UHFFFAOYSA-N 1 2 239.225 2.085 20 0 BEADLO CC(C)C[C@H](C)CO[NH+]=C(N)[C@H]1CCCO1 ZINC000789608701 585946228 /nfs/dbraw/zinc/94/62/28/585946228.db2.gz LDUGSNBDIOHMCZ-WDEREUQCSA-N 1 2 228.336 2.346 20 0 BEADLO NC(=[NH+]OCCC1CCCC1)[C@H]1CCCO1 ZINC000789626014 585947195 /nfs/dbraw/zinc/94/71/95/585947195.db2.gz CALYHRJRNTVQRQ-LLVKDONJSA-N 1 2 226.320 2.244 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+]C[C@H](C)Cc1ccccc1 ZINC000789744619 585949179 /nfs/dbraw/zinc/94/91/79/585949179.db2.gz WYDFUINJJVAMCR-CHWSQXEVSA-N 1 2 249.354 2.406 20 0 BEADLO CC(C)(C(=O)O[C@@H]1CC[N@H+](CCF)C1)C1CC1 ZINC000805937508 585970551 /nfs/dbraw/zinc/97/05/51/585970551.db2.gz DCEVBDABFFPBEE-LLVKDONJSA-N 1 2 243.322 2.010 20 0 BEADLO CC(C)(C(=O)O[C@@H]1CC[N@@H+](CCF)C1)C1CC1 ZINC000805937508 585970552 /nfs/dbraw/zinc/97/05/52/585970552.db2.gz DCEVBDABFFPBEE-LLVKDONJSA-N 1 2 243.322 2.010 20 0 BEADLO CC(C)=CCCNC(=O)c1cccc2[nH+]ccn21 ZINC000791005830 585972133 /nfs/dbraw/zinc/97/21/33/585972133.db2.gz ZOVJEVCOVZWLPV-UHFFFAOYSA-N 1 2 243.310 2.420 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1nnc(C(C)(C)C)o1 ZINC000791572370 585984286 /nfs/dbraw/zinc/98/42/86/585984286.db2.gz DZHCFROEBVOGGO-IUCAKERBSA-N 1 2 223.320 2.350 20 0 BEADLO C[C@@H](CC(=O)OCc1cc[nH+]c(N)c1)C1CC1 ZINC000791780224 585987811 /nfs/dbraw/zinc/98/78/11/585987811.db2.gz YVCAPQOSZFGHFI-VIFPVBQESA-N 1 2 234.299 2.143 20 0 BEADLO Cc1cc(C(=O)OCc2cc[nH+]c(N)c2)oc1C ZINC000792035458 585994265 /nfs/dbraw/zinc/99/42/65/585994265.db2.gz QCAWHYWINHAJFY-UHFFFAOYSA-N 1 2 246.266 2.231 20 0 BEADLO CC(C)C(C)(C)C(=O)OCc1cc[nH+]c(N)c1 ZINC000792170422 585996878 /nfs/dbraw/zinc/99/68/78/585996878.db2.gz KZLZAPNGTAGZED-UHFFFAOYSA-N 1 2 236.315 2.389 20 0 BEADLO C[C@@H]([NH2+]Cc1ncccn1)c1ccc(Cl)nc1 ZINC000792303003 585999404 /nfs/dbraw/zinc/99/94/04/585999404.db2.gz VFOZJVJZZAIABQ-SECBINFHSA-N 1 2 248.717 2.376 20 0 BEADLO CCC[C@@](C)(CC)C(=O)NC1=[NH+]CCS1 ZINC000792857369 586005909 /nfs/dbraw/zinc/00/59/09/586005909.db2.gz YWKHWQAVLMBTEU-LLVKDONJSA-N 1 2 228.361 2.422 20 0 BEADLO CC(C)=CC[NH+]1CC(O)(c2ccc(F)cc2)C1 ZINC000792875418 586006214 /nfs/dbraw/zinc/00/62/14/586006214.db2.gz KJZNLVZAFBXNAL-UHFFFAOYSA-N 1 2 235.302 2.295 20 0 BEADLO CCc1cc(C[NH2+][C@H](C)c2cc(C)nn2C)on1 ZINC000793533919 586021913 /nfs/dbraw/zinc/02/19/13/586021913.db2.gz LOPONSSTFFJHAQ-SNVBAGLBSA-N 1 2 248.330 2.130 20 0 BEADLO CC[C@@H]1CC[N@@H+]1Cn1nc(C)n(CC)c1=S ZINC000793824581 586027382 /nfs/dbraw/zinc/02/73/82/586027382.db2.gz UAXJLJTWTBGXEW-SNVBAGLBSA-N 1 2 240.376 2.184 20 0 BEADLO CC[C@@H]1CC[N@H+]1Cn1nc(C)n(CC)c1=S ZINC000793824581 586027383 /nfs/dbraw/zinc/02/73/83/586027383.db2.gz UAXJLJTWTBGXEW-SNVBAGLBSA-N 1 2 240.376 2.184 20 0 BEADLO CC[C@H](C)CCC(=O)NC1=[NH+]CCS1 ZINC000794823923 586049818 /nfs/dbraw/zinc/04/98/18/586049818.db2.gz MTTCAKDLIHJANE-QMMMGPOBSA-N 1 2 214.334 2.032 20 0 BEADLO CC[C@@H]([NH2+]Cc1cccnc1F)c1ccn(C)n1 ZINC000794833578 586050001 /nfs/dbraw/zinc/05/00/01/586050001.db2.gz GTYIFFOTLNISIN-LLVKDONJSA-N 1 2 248.305 2.195 20 0 BEADLO Cc1nc(N2[C@H](C)C[C@@H]2C)c(C)c(C)[nH+]1 ZINC000795195583 586071193 /nfs/dbraw/zinc/07/11/93/586071193.db2.gz WUKOEVBUIOMKMX-OCAPTIKFSA-N 1 2 205.305 2.389 20 0 BEADLO Fc1ccc(CC2C[NH+](Cc3cnc[nH]3)C2)cc1 ZINC000796449935 586103400 /nfs/dbraw/zinc/10/34/00/586103400.db2.gz NNHAGCPFQZXXOS-UHFFFAOYSA-N 1 2 245.301 2.223 20 0 BEADLO Cc1cc(C[NH+]2CCC(F)(F)CC2)no1 ZINC000796552147 586106739 /nfs/dbraw/zinc/10/67/39/586106739.db2.gz QPJBTDJZZKUNNB-UHFFFAOYSA-N 1 2 216.231 2.214 20 0 BEADLO C[C@H]([NH2+][C@H]1CCCc2[nH]ncc21)c1ccc[nH]1 ZINC000796845216 586114783 /nfs/dbraw/zinc/11/47/83/586114783.db2.gz HDHVGCNRDVHKPS-CABZTGNLSA-N 1 2 230.315 2.466 20 0 BEADLO CC1=C[C@H](C)C[N@H+](Cc2ncc(Cl)n2C)C1 ZINC000797525619 586128172 /nfs/dbraw/zinc/12/81/72/586128172.db2.gz BPGBVNTXRGKRFC-VIFPVBQESA-N 1 2 239.750 2.472 20 0 BEADLO CC1=C[C@H](C)C[N@@H+](Cc2ncc(Cl)n2C)C1 ZINC000797525619 586128173 /nfs/dbraw/zinc/12/81/73/586128173.db2.gz BPGBVNTXRGKRFC-VIFPVBQESA-N 1 2 239.750 2.472 20 0 BEADLO CC(C)=CC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000798261692 586142114 /nfs/dbraw/zinc/14/21/14/586142114.db2.gz FTGNHLDVDDRFGZ-UHFFFAOYSA-N 1 2 215.256 2.239 20 0 BEADLO Fc1cncc([C@@H]([NH2+]Cc2ccon2)C2CC2)c1 ZINC000798929106 586154079 /nfs/dbraw/zinc/15/40/79/586154079.db2.gz LNBXBVRRIXOUOL-ZDUSSCGKSA-N 1 2 247.273 2.450 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC[C@@H](c2ccccn2)C1 ZINC000798962971 586154563 /nfs/dbraw/zinc/15/45/63/586154563.db2.gz UULNDHRFQKFIHL-GFCCVEGCSA-N 1 2 242.326 2.103 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC[C@@H](c2ccccn2)C1 ZINC000798962971 586154564 /nfs/dbraw/zinc/15/45/64/586154564.db2.gz UULNDHRFQKFIHL-GFCCVEGCSA-N 1 2 242.326 2.103 20 0 BEADLO CS[C@@H]1CC[N@H+](Cc2cc(Cl)n(C)n2)C1 ZINC000859322205 589031742 /nfs/dbraw/zinc/03/17/42/589031742.db2.gz LDCXNFKHCWIANR-SECBINFHSA-N 1 2 245.779 2.011 20 0 BEADLO CS[C@@H]1CC[N@@H+](Cc2cc(Cl)n(C)n2)C1 ZINC000859322205 589031744 /nfs/dbraw/zinc/03/17/44/589031744.db2.gz LDCXNFKHCWIANR-SECBINFHSA-N 1 2 245.779 2.011 20 0 BEADLO CC(C)[C@H]1CC[N@@H+]1Cc1ncc(Cl)n1C ZINC000799734493 586195277 /nfs/dbraw/zinc/19/52/77/586195277.db2.gz ZTYOCLIBBYQUCX-SECBINFHSA-N 1 2 227.739 2.304 20 0 BEADLO CC(C)[C@H]1CC[N@H+]1Cc1ncc(Cl)n1C ZINC000799734493 586195278 /nfs/dbraw/zinc/19/52/78/586195278.db2.gz ZTYOCLIBBYQUCX-SECBINFHSA-N 1 2 227.739 2.304 20 0 BEADLO CCCC[C@H](C)C(=O)OCCn1cc[nH+]c1 ZINC000800275747 586207926 /nfs/dbraw/zinc/20/79/26/586207926.db2.gz CKXNJMYKHCRZTM-NSHDSACASA-N 1 2 224.304 2.253 20 0 BEADLO CC(C)(C)OC(=O)[C@@]1(C)CCC[N@@H+]1CCF ZINC000859381487 589035064 /nfs/dbraw/zinc/03/50/64/589035064.db2.gz QYRHYZRXNHBPSU-GFCCVEGCSA-N 1 2 231.311 2.152 20 0 BEADLO CC(C)(C)OC(=O)[C@@]1(C)CCC[N@H+]1CCF ZINC000859381487 589035065 /nfs/dbraw/zinc/03/50/65/589035065.db2.gz QYRHYZRXNHBPSU-GFCCVEGCSA-N 1 2 231.311 2.152 20 0 BEADLO Cc1nonc1C[N@@H+]1C[C@@H](C)C(F)(F)[C@@H](C)C1 ZINC000859414396 589036005 /nfs/dbraw/zinc/03/60/05/589036005.db2.gz WHEOXUIMZPSEAY-OCAPTIKFSA-N 1 2 245.273 2.101 20 0 BEADLO Cc1nonc1C[N@H+]1C[C@@H](C)C(F)(F)[C@@H](C)C1 ZINC000859414396 589036007 /nfs/dbraw/zinc/03/60/07/589036007.db2.gz WHEOXUIMZPSEAY-OCAPTIKFSA-N 1 2 245.273 2.101 20 0 BEADLO C[C@@H]1C[N@H+](C[C@@H]2CC2(Cl)Cl)CCC1=O ZINC000801944659 586281790 /nfs/dbraw/zinc/28/17/90/586281790.db2.gz HBCDLKUVVLYKSA-SFYZADRCSA-N 1 2 236.142 2.091 20 0 BEADLO C[C@@H]1C[N@@H+](C[C@@H]2CC2(Cl)Cl)CCC1=O ZINC000801944659 586281791 /nfs/dbraw/zinc/28/17/91/586281791.db2.gz HBCDLKUVVLYKSA-SFYZADRCSA-N 1 2 236.142 2.091 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)CCSC(C)(C)C ZINC000801953618 586283309 /nfs/dbraw/zinc/28/33/09/586283309.db2.gz SENQYYNRQPWYEE-SECBINFHSA-N 1 2 233.377 2.011 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)CCSC(C)(C)C ZINC000801953618 586283311 /nfs/dbraw/zinc/28/33/11/586283311.db2.gz SENQYYNRQPWYEE-SECBINFHSA-N 1 2 233.377 2.011 20 0 BEADLO CCC[C@H](C)C(=O)O[C@H]1CC[N@H+](CCF)C1 ZINC000802240424 586299303 /nfs/dbraw/zinc/29/93/03/586299303.db2.gz YGZAQMLOOYYHLY-QWRGUYRKSA-N 1 2 231.311 2.010 20 0 BEADLO CCC[C@H](C)C(=O)O[C@H]1CC[N@@H+](CCF)C1 ZINC000802240424 586299304 /nfs/dbraw/zinc/29/93/04/586299304.db2.gz YGZAQMLOOYYHLY-QWRGUYRKSA-N 1 2 231.311 2.010 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)O[C@H]1CC[N@H+](CCF)C1 ZINC000802238976 586299371 /nfs/dbraw/zinc/29/93/71/586299371.db2.gz LUCXYMPITNUTAP-TUAOUCFPSA-N 1 2 245.338 2.256 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)O[C@H]1CC[N@@H+](CCF)C1 ZINC000802238976 586299372 /nfs/dbraw/zinc/29/93/72/586299372.db2.gz LUCXYMPITNUTAP-TUAOUCFPSA-N 1 2 245.338 2.256 20 0 BEADLO CC(C)[C@@H](C)C(=O)OCCCc1[nH+]ccn1C ZINC000802790010 586314689 /nfs/dbraw/zinc/31/46/89/586314689.db2.gz PKWWVHGEVBTCQN-LLVKDONJSA-N 1 2 238.331 2.188 20 0 BEADLO C[C@H]1C(=O)N(C[NH+]2Cc3ccccc3C2)C[C@H]1C ZINC000839991253 586333442 /nfs/dbraw/zinc/33/34/42/586333442.db2.gz NERYBTCOLTYUCH-VXGBXAGGSA-N 1 2 244.338 2.074 20 0 BEADLO Cc1cc(CNc2cc3cc[nH]c3c[nH+]2)no1 ZINC000804376451 586393373 /nfs/dbraw/zinc/39/33/73/586393373.db2.gz CHJYEZNAGXENSV-UHFFFAOYSA-N 1 2 228.255 2.471 20 0 BEADLO CC[NH2+]Cc1noc(C[C@H]2CC[C@@H](C)C2)n1 ZINC000843144988 586436796 /nfs/dbraw/zinc/43/67/96/586436796.db2.gz RBQSUFDDWDZORE-ZJUUUORDSA-N 1 2 223.320 2.158 20 0 BEADLO CC1(C)CC(=O)N(C[NH+]2Cc3ccccc3C2)C1 ZINC000808155987 586465528 /nfs/dbraw/zinc/46/55/28/586465528.db2.gz XEYCSNVIUOKHNU-UHFFFAOYSA-N 1 2 244.338 2.218 20 0 BEADLO COc1cc[nH+]cc1COc1cc(C)c(C)nn1 ZINC000808256509 586468944 /nfs/dbraw/zinc/46/89/44/586468944.db2.gz CMNVRWXNVLUGER-UHFFFAOYSA-N 1 2 245.282 2.076 20 0 BEADLO Cc1cccc(F)c1C[NH2+]Cc1cn(C)cn1 ZINC000808392230 586470981 /nfs/dbraw/zinc/47/09/81/586470981.db2.gz XRLBJJXRQAZREK-UHFFFAOYSA-N 1 2 233.290 2.157 20 0 BEADLO Cn1c[nH+]c(CNCc2nc(C3CC3)cs2)c1 ZINC000808395724 586471281 /nfs/dbraw/zinc/47/12/81/586471281.db2.gz FSYIJOWSFWTXOA-UHFFFAOYSA-N 1 2 248.355 2.044 20 0 BEADLO Cn1cnc(C[NH2+]Cc2nc(C3CC3)cs2)c1 ZINC000808395724 586471283 /nfs/dbraw/zinc/47/12/83/586471283.db2.gz FSYIJOWSFWTXOA-UHFFFAOYSA-N 1 2 248.355 2.044 20 0 BEADLO C[C@H](O)c1cc(NCc2cn(C)c[nH+]2)ccc1F ZINC000808414562 586471563 /nfs/dbraw/zinc/47/15/63/586471563.db2.gz CJQPEWIVWNJBHX-VIFPVBQESA-N 1 2 249.289 2.225 20 0 BEADLO C[C@@H](C1CC1)n1cc(NCc2cn(C)c[nH+]2)cn1 ZINC000808407287 586471672 /nfs/dbraw/zinc/47/16/72/586471672.db2.gz SVHMTINJXUTNBU-JTQLQIEISA-N 1 2 245.330 2.200 20 0 BEADLO c1coc([C@H]2[N@H+](Cn3cnnc3)CC23CCC3)c1 ZINC000840138778 586473039 /nfs/dbraw/zinc/47/30/39/586473039.db2.gz GPOZVEQUGAMWTB-GFCCVEGCSA-N 1 2 244.298 2.056 20 0 BEADLO c1coc([C@H]2[N@@H+](Cn3cnnc3)CC23CCC3)c1 ZINC000840138778 586473041 /nfs/dbraw/zinc/47/30/41/586473041.db2.gz GPOZVEQUGAMWTB-GFCCVEGCSA-N 1 2 244.298 2.056 20 0 BEADLO Cc1nonc1C[NH2+]Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000809744254 586516715 /nfs/dbraw/zinc/51/67/15/586516715.db2.gz CSRVVAHQKADBLN-KCJUWKMLSA-N 1 2 247.298 2.384 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000810045378 586532686 /nfs/dbraw/zinc/53/26/86/586532686.db2.gz MKUZGJJDEGHLAQ-VHSXEESVSA-N 1 2 249.301 2.305 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000810045378 586532687 /nfs/dbraw/zinc/53/26/87/586532687.db2.gz MKUZGJJDEGHLAQ-VHSXEESVSA-N 1 2 249.301 2.305 20 0 BEADLO OCc1ccc(NCc2cccnc2Cl)[nH+]c1 ZINC000811501771 586559917 /nfs/dbraw/zinc/55/99/17/586559917.db2.gz WTNCCDCNQNBIBY-UHFFFAOYSA-N 1 2 249.701 2.234 20 0 BEADLO C/C(=C\C(=O)NCc1c[nH+]cn1C)C(C)(C)C ZINC000811588384 586561708 /nfs/dbraw/zinc/56/17/08/586561708.db2.gz ISUOCZWDAXCXSE-UXBLZVDNSA-N 1 2 235.331 2.029 20 0 BEADLO Fc1cccc(NCc2ccn3cc[nH+]c3c2)n1 ZINC000811817476 586567371 /nfs/dbraw/zinc/56/73/71/586567371.db2.gz VLYYJFZJWFPOKK-UHFFFAOYSA-N 1 2 242.257 2.481 20 0 BEADLO O=C(CCCC1CC1)OCCCn1cc[nH+]c1 ZINC000812601373 586580132 /nfs/dbraw/zinc/58/01/32/586580132.db2.gz WJRACBVZKQUBKM-UHFFFAOYSA-N 1 2 236.315 2.397 20 0 BEADLO c1nc(NC2CC2)cc(NCCOC2CCC2)[nH+]1 ZINC000840268011 586584165 /nfs/dbraw/zinc/58/41/65/586584165.db2.gz GKBVZHISEPRAMI-UHFFFAOYSA-N 1 2 248.330 2.032 20 0 BEADLO c1nc(NCCOC2CCC2)cc(NC2CC2)[nH+]1 ZINC000840268011 586584166 /nfs/dbraw/zinc/58/41/66/586584166.db2.gz GKBVZHISEPRAMI-UHFFFAOYSA-N 1 2 248.330 2.032 20 0 BEADLO C[C@H](C(=O)OCCCn1cc[nH+]c1)C(C)(F)F ZINC000815492466 586686332 /nfs/dbraw/zinc/68/63/32/586686332.db2.gz NRFHACPGRCBLMG-SECBINFHSA-N 1 2 246.257 2.108 20 0 BEADLO Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1cnn(C)n1 ZINC000815626126 586689175 /nfs/dbraw/zinc/68/91/75/586689175.db2.gz WMOIGPORMRJMBM-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO C[N@H+](CCF)Cc1c[nH]nc1C(C)(C)C ZINC000816639686 586746133 /nfs/dbraw/zinc/74/61/33/586746133.db2.gz BEVCQSDTFYIKFR-UHFFFAOYSA-N 1 2 213.300 2.109 20 0 BEADLO C[N@@H+](CCF)Cc1c[nH]nc1C(C)(C)C ZINC000816639686 586746134 /nfs/dbraw/zinc/74/61/34/586746134.db2.gz BEVCQSDTFYIKFR-UHFFFAOYSA-N 1 2 213.300 2.109 20 0 BEADLO Cc1cccn2c(C[N@H+](C)CCF)cnc12 ZINC000816640568 586747898 /nfs/dbraw/zinc/74/78/98/586747898.db2.gz NVQCAWIWEZLARR-UHFFFAOYSA-N 1 2 221.279 2.044 20 0 BEADLO Cc1cccn2c(C[N@@H+](C)CCF)cnc12 ZINC000816640568 586747901 /nfs/dbraw/zinc/74/79/01/586747901.db2.gz NVQCAWIWEZLARR-UHFFFAOYSA-N 1 2 221.279 2.044 20 0 BEADLO Cc1cccn2c(CN(C)CCF)c[nH+]c12 ZINC000816640568 586747904 /nfs/dbraw/zinc/74/79/04/586747904.db2.gz NVQCAWIWEZLARR-UHFFFAOYSA-N 1 2 221.279 2.044 20 0 BEADLO C/C(=C\C(=O)N1CCc2[nH]c[nH+]c2C1)C(C)(C)C ZINC000816651939 586752697 /nfs/dbraw/zinc/75/26/97/586752697.db2.gz UUCNBCAGEOCXDC-JXMROGBWSA-N 1 2 247.342 2.287 20 0 BEADLO C/C(=C\C(=O)N1CCc2[nH+]c[nH]c2C1)C(C)(C)C ZINC000816651939 586752699 /nfs/dbraw/zinc/75/26/99/586752699.db2.gz UUCNBCAGEOCXDC-JXMROGBWSA-N 1 2 247.342 2.287 20 0 BEADLO Cc1cc(C)cc(NC(=O)Cc2[nH]cc[nH+]2)c1 ZINC000816820609 586766394 /nfs/dbraw/zinc/76/63/94/586766394.db2.gz SQYXXJQIVPTCQP-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)NC1CCCCCCC1 ZINC000816820151 586766506 /nfs/dbraw/zinc/76/65/06/586766506.db2.gz AVDJXHTUYAJAEP-UHFFFAOYSA-N 1 2 235.331 2.181 20 0 BEADLO CSc1ccc(NC(=O)Cc2[nH]cc[nH+]2)cc1 ZINC000816833229 586766765 /nfs/dbraw/zinc/76/67/65/586766765.db2.gz BBJRLCGIMCXTOR-UHFFFAOYSA-N 1 2 247.323 2.313 20 0 BEADLO CC/C(C)=C(\C)C(=O)NCc1c[nH+]ccc1OC ZINC000817085789 586781143 /nfs/dbraw/zinc/78/11/43/586781143.db2.gz DUPREWZBLMFYDX-ZHACJKMWSA-N 1 2 248.326 2.453 20 0 BEADLO Cn1cnc(C[NH2+][C@@H]2C[C@]2(F)c2ccccc2)c1 ZINC000818229933 586880539 /nfs/dbraw/zinc/88/05/39/586880539.db2.gz IMGMUZVDUKWIFM-KGLIPLIRSA-N 1 2 245.301 2.147 20 0 BEADLO Cn1cnc(C[NH2+][C@@H]2C[C@@]2(F)c2ccccc2)c1 ZINC000818229935 586881135 /nfs/dbraw/zinc/88/11/35/586881135.db2.gz IMGMUZVDUKWIFM-ZIAGYGMSSA-N 1 2 245.301 2.147 20 0 BEADLO C[C@H](CC(=O)Nc1ccc(N)[nH+]c1)C1CC1 ZINC000818541252 586898772 /nfs/dbraw/zinc/89/87/72/586898772.db2.gz SPLPIGXVMRZCNC-MRVPVSSYSA-N 1 2 219.288 2.039 20 0 BEADLO Nc1ccc(NC(=O)C=C2CCCC2)c[nH+]1 ZINC000818541207 586899042 /nfs/dbraw/zinc/89/90/42/586899042.db2.gz OPNCLUSMSJQALO-UHFFFAOYSA-N 1 2 217.272 2.103 20 0 BEADLO CCC/C(C)=C/C(=O)Nc1ccc(N)[nH+]c1 ZINC000818541308 586899242 /nfs/dbraw/zinc/89/92/42/586899242.db2.gz ZURUTZMHZKGYSY-VQHVLOKHSA-N 1 2 219.288 2.349 20 0 BEADLO CC[C@@H](C)Oc1ccc([NH2+]CCC(N)=O)cc1 ZINC000819424978 586963155 /nfs/dbraw/zinc/96/31/55/586963155.db2.gz OPWWFWUOJZWZIA-SNVBAGLBSA-N 1 2 236.315 2.151 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)C(F)=C2CCC2)c2[nH+]ccn21 ZINC000819558295 586977199 /nfs/dbraw/zinc/97/71/99/586977199.db2.gz SLDNUKHNASXAHO-SCZZXKLOSA-N 1 2 249.289 2.413 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)C=C2CCCCC2)S1 ZINC000819766222 586991845 /nfs/dbraw/zinc/99/18/45/586991845.db2.gz NBOSALFEDWKHAG-SECBINFHSA-N 1 2 238.356 2.484 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)C(C)(C)C2CC2)S1 ZINC000819777148 586992319 /nfs/dbraw/zinc/99/23/19/586992319.db2.gz HTJAUPYRJJWPTK-SSDOTTSWSA-N 1 2 226.345 2.030 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819775894 586992810 /nfs/dbraw/zinc/99/28/10/586992810.db2.gz KMSCGQPUQLLYBV-XHNCKOQMSA-N 1 2 228.361 2.276 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819780169 586994054 /nfs/dbraw/zinc/99/40/54/586994054.db2.gz FRJHUZRSNSIGDK-OPRDCNLKSA-N 1 2 240.372 2.276 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)C2=CC[C@@H](C)CC2)S1 ZINC000819780715 586994078 /nfs/dbraw/zinc/99/40/78/586994078.db2.gz ITSLUBUCCPGVGZ-RKDXNWHRSA-N 1 2 238.356 2.340 20 0 BEADLO C[C@H](C(=O)NC1=[NH+]C[C@H](C)S1)C1CCC1 ZINC000819780087 586994129 /nfs/dbraw/zinc/99/41/29/586994129.db2.gz DADKYYJKROXFQI-YUMQZZPRSA-N 1 2 226.345 2.030 20 0 BEADLO C[C@@H](C(=O)NC1=[NH+]C[C@H](C)S1)C1CCC1 ZINC000819780085 586994165 /nfs/dbraw/zinc/99/41/65/586994165.db2.gz DADKYYJKROXFQI-JGVFFNPUSA-N 1 2 226.345 2.030 20 0 BEADLO C=C/C(C)=C/CC(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819783967 586994947 /nfs/dbraw/zinc/99/49/47/586994947.db2.gz VKIAPYGVUXLLDV-WHXYTISESA-N 1 2 224.329 2.116 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CC[C@@H]2C[C@@H]2CC1)c1[nH]cc[nH+]1 ZINC000820191405 587033614 /nfs/dbraw/zinc/03/36/14/587033614.db2.gz FEJWDCRCBCAWRP-KKOKHZNYSA-N 1 2 247.342 2.413 20 0 BEADLO CCC[C@@H](CC)C(=O)NCc1[nH]c[nH+]c1C ZINC000820511074 587052024 /nfs/dbraw/zinc/05/20/24/587052024.db2.gz VAAIBVOWJJODJY-SNVBAGLBSA-N 1 2 223.320 2.161 20 0 BEADLO Cc1cnc(NCCc2cn3ccccc3[nH+]2)o1 ZINC000820618219 587059860 /nfs/dbraw/zinc/05/98/60/587059860.db2.gz ZIXWUHRAXLNFKI-UHFFFAOYSA-N 1 2 242.282 2.285 20 0 BEADLO C[C@@H]1[C@@H](C)CN1C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000820657773 587063578 /nfs/dbraw/zinc/06/35/78/587063578.db2.gz YAVBKGXRNDSKGD-DTWKUNHWSA-N 1 2 229.283 2.043 20 0 BEADLO C[C@@H]1CN(C(=O)c2cc3c[nH+]ccc3[nH]2)[C@@H]1C ZINC000820657779 587063681 /nfs/dbraw/zinc/06/36/81/587063681.db2.gz YAVBKGXRNDSKGD-RKDXNWHRSA-N 1 2 229.283 2.043 20 0 BEADLO CN(C(=O)Cc1[nH]cc[nH+]1)C1CCCCCC1 ZINC000820726207 587068881 /nfs/dbraw/zinc/06/88/81/587068881.db2.gz ZBVRXMNSEZXFRI-UHFFFAOYSA-N 1 2 235.331 2.133 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@@]1(C)C=CCC1 ZINC000821309345 587106384 /nfs/dbraw/zinc/10/63/84/587106384.db2.gz RUDQTTJBUAIGPS-FZMZJTMJSA-N 1 2 247.342 2.437 20 0 BEADLO C[C@H]1C[C@@H]1C(=O)OCCc1cn2ccccc2[nH+]1 ZINC000821596088 587131603 /nfs/dbraw/zinc/13/16/03/587131603.db2.gz ZAAAZBKQKXDXKV-JQWIXIFHSA-N 1 2 244.294 2.076 20 0 BEADLO C[C@H]1C[C@H]1C(=O)OCCc1cn2ccccc2[nH+]1 ZINC000821596087 587131679 /nfs/dbraw/zinc/13/16/79/587131679.db2.gz ZAAAZBKQKXDXKV-CMPLNLGQSA-N 1 2 244.294 2.076 20 0 BEADLO CN(C)c1[nH+]cccc1COC(=O)c1ccco1 ZINC000821607755 587132317 /nfs/dbraw/zinc/13/23/17/587132317.db2.gz DEZUQUMLBMFNPM-UHFFFAOYSA-N 1 2 246.266 2.098 20 0 BEADLO CC[C@H]1CCCC[C@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000821830659 587141492 /nfs/dbraw/zinc/14/14/92/587141492.db2.gz NWNGJPAAERFDLV-WDEREUQCSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H]1CN(C(=O)Cc2[nH]cc[nH+]2)c2ccccc21 ZINC000822182359 587158113 /nfs/dbraw/zinc/15/81/13/587158113.db2.gz IETHSSGNQFKVTR-JTQLQIEISA-N 1 2 241.294 2.103 20 0 BEADLO C[C@@H]1CCC(C)(C)N1C(=O)/C=C/c1cn(C)c[nH+]1 ZINC000822191444 587158500 /nfs/dbraw/zinc/15/85/00/587158500.db2.gz XISCOHHSROCVAW-MVIFTORASA-N 1 2 247.342 2.223 20 0 BEADLO CC(C)(C(=O)NC1=[NH+]CCS1)C1CCC1 ZINC000822234103 587158941 /nfs/dbraw/zinc/15/89/41/587158941.db2.gz DHSQBFZXLHRWOO-UHFFFAOYSA-N 1 2 226.345 2.032 20 0 BEADLO C[C@H](CC(C)(C)C)NC(=O)/C=C\c1cn(C)c[nH+]1 ZINC000822276435 587160490 /nfs/dbraw/zinc/16/04/90/587160490.db2.gz FEYXCRMQOMQQJG-JMEBYUIHSA-N 1 2 249.358 2.374 20 0 BEADLO ClC1(Cl)C[C@@H]1CCn1cc[nH+]c1 ZINC000822696423 587181720 /nfs/dbraw/zinc/18/17/20/587181720.db2.gz OAXSSPGOPGLWPT-ZETCQYMHSA-N 1 2 205.088 2.467 20 0 BEADLO CC(C)C[C@@H](C(=O)N1CC2(CC2)C1)n1cc[nH+]c1 ZINC000823242660 587210820 /nfs/dbraw/zinc/21/08/20/587210820.db2.gz OEAAJJFOVNRBRO-LBPRGKRZSA-N 1 2 247.342 2.093 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)C[C@H]2CC=CCC2)S1 ZINC000823307405 587215657 /nfs/dbraw/zinc/21/56/57/587215657.db2.gz SXUSZPOJGBYOSG-ZJUUUORDSA-N 1 2 238.356 2.340 20 0 BEADLO CCn1nc(C)c(C[NH2+][C@@H](C)c2ccco2)n1 ZINC000823596917 587232419 /nfs/dbraw/zinc/23/24/19/587232419.db2.gz YQWGSCNESBLSCJ-JTQLQIEISA-N 1 2 234.303 2.050 20 0 BEADLO CCC[C@@H](CC)C(=O)NC1=[NH+]C[C@H](C)S1 ZINC000823806765 587241338 /nfs/dbraw/zinc/24/13/38/587241338.db2.gz IIDPQYSQDMHHLH-DTWKUNHWSA-N 1 2 228.361 2.420 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)/C=C/[C@@H]1CCCO1 ZINC000823837081 587242208 /nfs/dbraw/zinc/24/22/08/587242208.db2.gz XBGCOWJQWWTKKF-FYJFLYSWSA-N 1 2 246.310 2.372 20 0 BEADLO CO[C@@H](C)CC(=O)Nc1c(C)cc[nH+]c1C ZINC000823842537 587242361 /nfs/dbraw/zinc/24/23/61/587242361.db2.gz YLFUCKOJZBTQAH-VIFPVBQESA-N 1 2 222.288 2.062 20 0 BEADLO CC1C[NH+](Cc2ccnc(Cl)c2F)C1 ZINC000824314423 587265387 /nfs/dbraw/zinc/26/53/87/587265387.db2.gz KPUXVZVZRQFFBT-UHFFFAOYSA-N 1 2 214.671 2.326 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccc(F)nc1)C(F)F ZINC000824509915 587272229 /nfs/dbraw/zinc/27/22/29/587272229.db2.gz QBSUXAWQHWARML-MRVPVSSYSA-N 1 2 218.222 2.354 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)/C=C/c1cn(C)c[nH+]1 ZINC000824652284 587281466 /nfs/dbraw/zinc/28/14/66/587281466.db2.gz YXRSUHMIFHSOOC-WSKFYRRCSA-N 1 2 235.331 2.080 20 0 BEADLO CCC(C)(C)[C@@H](C)NC(=O)/C=C\c1cn(C)c[nH+]1 ZINC000824840527 587289936 /nfs/dbraw/zinc/28/99/36/587289936.db2.gz AUNBIOFSWMOKCB-SKVAFPRGSA-N 1 2 249.358 2.374 20 0 BEADLO CC1(CCCCOc2cc[nH+]cc2)OCCO1 ZINC000825101118 587304514 /nfs/dbraw/zinc/30/45/14/587304514.db2.gz DSVBLLKIGPCIBU-UHFFFAOYSA-N 1 2 237.299 2.394 20 0 BEADLO CC1(CCC(=O)N[C@H]2CCn3c[nH+]cc32)CC1 ZINC000825512311 587322389 /nfs/dbraw/zinc/32/23/89/587322389.db2.gz AYLUFAJUOLGGMH-JTQLQIEISA-N 1 2 233.315 2.024 20 0 BEADLO CCCCC1(C(=O)N[C@H]2CCn3c[nH+]cc32)CC1 ZINC000825512414 587322793 /nfs/dbraw/zinc/32/27/93/587322793.db2.gz DHHGOUDDPBCTGB-NSHDSACASA-N 1 2 247.342 2.415 20 0 BEADLO CCN(C(=O)Cc1[nH]cc[nH+]1)[C@H]1CCCC[C@@H]1C ZINC000825607797 587327207 /nfs/dbraw/zinc/32/72/07/587327207.db2.gz PMFNVBSDLHNHSP-RYUDHWBXSA-N 1 2 249.358 2.379 20 0 BEADLO CCC[C@H]1CCCC[C@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000825928115 587346139 /nfs/dbraw/zinc/34/61/39/587346139.db2.gz MUQDBYIKUWZOGB-NWDGAFQWSA-N 1 2 249.358 2.427 20 0 BEADLO CC(C)CC1(NC(=O)/C=C/c2cn(C)c[nH+]2)CC1 ZINC000825933671 587346207 /nfs/dbraw/zinc/34/62/07/587346207.db2.gz JXJBMAKGIDUFFC-SNAWJCMRSA-N 1 2 247.342 2.128 20 0 BEADLO COCC[N@H+](CCF)Cc1sccc1OC ZINC000827053996 587369182 /nfs/dbraw/zinc/36/91/82/587369182.db2.gz KMYKRSWAQJNEQC-UHFFFAOYSA-N 1 2 247.335 2.175 20 0 BEADLO COCC[N@@H+](CCF)Cc1sccc1OC ZINC000827053996 587369183 /nfs/dbraw/zinc/36/91/83/587369183.db2.gz KMYKRSWAQJNEQC-UHFFFAOYSA-N 1 2 247.335 2.175 20 0 BEADLO O=C(NCC1CC=CC1)c1cc2c[nH+]ccc2[nH]1 ZINC000827077778 587369655 /nfs/dbraw/zinc/36/96/55/587369655.db2.gz FKZAHINZIGKUBU-UHFFFAOYSA-N 1 2 241.294 2.259 20 0 BEADLO CC(C)[N@H+](C)Cc1nnc(C2CC2)s1 ZINC000828047670 587417898 /nfs/dbraw/zinc/41/78/98/587417898.db2.gz VGYNNFVXQGRCKH-UHFFFAOYSA-N 1 2 211.334 2.256 20 0 BEADLO CC(C)[N@@H+](C)Cc1nnc(C2CC2)s1 ZINC000828047670 587417899 /nfs/dbraw/zinc/41/78/99/587417899.db2.gz VGYNNFVXQGRCKH-UHFFFAOYSA-N 1 2 211.334 2.256 20 0 BEADLO C[C@H](CCC(C)(C)C)NC(=O)Cc1[nH]cc[nH+]1 ZINC000828224953 587425679 /nfs/dbraw/zinc/42/56/79/587425679.db2.gz OSWYOJCLXHTVQR-SNVBAGLBSA-N 1 2 237.347 2.283 20 0 BEADLO CC(C)c1ccccc1C(=O)NCc1c[nH+]c[nH]1 ZINC000828360773 587438490 /nfs/dbraw/zinc/43/84/90/587438490.db2.gz GWNOYRBBNIFYPH-UHFFFAOYSA-N 1 2 243.310 2.463 20 0 BEADLO CC(C)c1ccccc1C(=O)NCc1c[nH]c[nH+]1 ZINC000828360773 587438491 /nfs/dbraw/zinc/43/84/91/587438491.db2.gz GWNOYRBBNIFYPH-UHFFFAOYSA-N 1 2 243.310 2.463 20 0 BEADLO CC(C)CC(=O)N1CCc2[nH]c[nH+]c2C12CCC2 ZINC000829111715 587483456 /nfs/dbraw/zinc/48/34/56/587483456.db2.gz SDAOVVZQXMWPTG-UHFFFAOYSA-N 1 2 247.342 2.220 20 0 BEADLO O=C(NC[C@@H]1C=CCC1)c1cc2c[nH+]ccc2[nH]1 ZINC000829149414 587484958 /nfs/dbraw/zinc/48/49/58/587484958.db2.gz FMDXAPPKPVOBDZ-SNVBAGLBSA-N 1 2 241.294 2.259 20 0 BEADLO CC/C(C)=C/C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000829542042 587502796 /nfs/dbraw/zinc/50/27/96/587502796.db2.gz FJKDGXAJDDHDNC-DDXVTDLHSA-N 1 2 221.304 2.333 20 0 BEADLO CCC(C)=CC(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000829542042 587502798 /nfs/dbraw/zinc/50/27/98/587502798.db2.gz FJKDGXAJDDHDNC-DDXVTDLHSA-N 1 2 221.304 2.333 20 0 BEADLO C[C@@]1([NH2+]C[C@H]2CCCCC2(F)F)CCOC1=O ZINC000829962841 587528569 /nfs/dbraw/zinc/52/85/69/587528569.db2.gz UULAUIQTRRHCOX-MWLCHTKSSA-N 1 2 247.285 2.107 20 0 BEADLO CC1(C)CCCC[C@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000830010727 587532179 /nfs/dbraw/zinc/53/21/79/587532179.db2.gz ZQVUDINBHBVNNH-SNVBAGLBSA-N 1 2 235.331 2.037 20 0 BEADLO CCCCC[C@@H](C)NC(=O)C[N@@H+]1CC[C@H](F)C1 ZINC000830461607 587552035 /nfs/dbraw/zinc/55/20/35/587552035.db2.gz BKISOUOKWAMZMT-NEPJUHHUSA-N 1 2 244.354 2.115 20 0 BEADLO CCCCC[C@@H](C)NC(=O)C[N@H+]1CC[C@H](F)C1 ZINC000830461607 587552036 /nfs/dbraw/zinc/55/20/36/587552036.db2.gz BKISOUOKWAMZMT-NEPJUHHUSA-N 1 2 244.354 2.115 20 0 BEADLO O[C@H](C[N@@H+]1CC[C@@H](F)C1)c1ccc(F)cc1F ZINC000830467358 587552218 /nfs/dbraw/zinc/55/22/18/587552218.db2.gz KIAQOQBXKPKIQV-BXKDBHETSA-N 1 2 245.244 2.042 20 0 BEADLO O[C@H](C[N@H+]1CC[C@@H](F)C1)c1ccc(F)cc1F ZINC000830467358 587552219 /nfs/dbraw/zinc/55/22/19/587552219.db2.gz KIAQOQBXKPKIQV-BXKDBHETSA-N 1 2 245.244 2.042 20 0 BEADLO CC(C)CC[C@@H]1CCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC000830499187 587554516 /nfs/dbraw/zinc/55/45/16/587554516.db2.gz ULVHLMXJTRLUQP-LBPRGKRZSA-N 1 2 249.358 2.379 20 0 BEADLO O=C(/C=C/C1CCCC1)OCCn1cc[nH+]c1 ZINC000830792657 587570791 /nfs/dbraw/zinc/57/07/91/587570791.db2.gz GCBWEKGODITRDZ-AATRIKPKSA-N 1 2 234.299 2.173 20 0 BEADLO O=C(C1CC2(CC2)C1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000831606599 587622310 /nfs/dbraw/zinc/62/23/10/587622310.db2.gz FGBNAAQWCJZSEZ-NSHDSACASA-N 1 2 245.326 2.263 20 0 BEADLO C[C@H](O)C[N@H+](CCc1cccs1)CC(F)F ZINC000832196382 587649605 /nfs/dbraw/zinc/64/96/05/587649605.db2.gz UEWUZKOTHNNEMZ-VIFPVBQESA-N 1 2 249.326 2.239 20 0 BEADLO C[C@H](O)C[N@@H+](CCc1cccs1)CC(F)F ZINC000832196382 587649607 /nfs/dbraw/zinc/64/96/07/587649607.db2.gz UEWUZKOTHNNEMZ-VIFPVBQESA-N 1 2 249.326 2.239 20 0 BEADLO CC(C)C[C@@H](C)C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833278034 587703758 /nfs/dbraw/zinc/70/37/58/587703758.db2.gz LZTZEPKSCASIME-GHMZBOCLSA-N 1 2 235.331 2.126 20 0 BEADLO C[C@@H]1CCC[C@@H]1CC(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833279002 587703910 /nfs/dbraw/zinc/70/39/10/587703910.db2.gz WNTZWDNBEZFEFU-UTUOFQBUSA-N 1 2 247.342 2.270 20 0 BEADLO CC1(C)CC[C@@H](C(=O)N[C@H]2CCn3cc[nH+]c32)C1 ZINC000833277941 587703948 /nfs/dbraw/zinc/70/39/48/587703948.db2.gz KJUVHRXTQXLOAI-MNOVXSKESA-N 1 2 247.342 2.270 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833278753 587704005 /nfs/dbraw/zinc/70/40/05/587704005.db2.gz VBTLOLSTXSUQDB-DCAQKATOSA-N 1 2 235.331 2.126 20 0 BEADLO CC1(C)CC[C@H](C(=O)N[C@H]2CCn3cc[nH+]c32)C1 ZINC000833277942 587704026 /nfs/dbraw/zinc/70/40/26/587704026.db2.gz KJUVHRXTQXLOAI-QWRGUYRKSA-N 1 2 247.342 2.270 20 0 BEADLO O=C(CCCC1CC1)N[C@@H]1CCn2cc[nH+]c21 ZINC000833270919 587704109 /nfs/dbraw/zinc/70/41/09/587704109.db2.gz CPFRMPXTGJXHGM-LLVKDONJSA-N 1 2 233.315 2.024 20 0 BEADLO CCC(C)(C)CC(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833285460 587704672 /nfs/dbraw/zinc/70/46/72/587704672.db2.gz RGQVBWARJOMBCA-SNVBAGLBSA-N 1 2 235.331 2.270 20 0 BEADLO O=C(CC1CCCC1)N[C@H]1CCn2cc[nH+]c21 ZINC000833303820 587705182 /nfs/dbraw/zinc/70/51/82/587705182.db2.gz ASZXVVJZNFAFPV-NSHDSACASA-N 1 2 233.315 2.024 20 0 BEADLO C[C@H](C(=O)N[C@@H]1CCn2cc[nH+]c21)C(C)(C)C ZINC000833292883 587705276 /nfs/dbraw/zinc/70/52/76/587705276.db2.gz OGWYYHMPLMDKSK-NXEZZACHSA-N 1 2 235.331 2.126 20 0 BEADLO Cc1ccccc1C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833305396 587705324 /nfs/dbraw/zinc/70/53/24/587705324.db2.gz OEJKLPVXRRQJCS-LBPRGKRZSA-N 1 2 241.294 2.066 20 0 BEADLO CCCCCCC(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833302003 587705371 /nfs/dbraw/zinc/70/53/71/587705371.db2.gz WQHCOESYZQNLJF-NSHDSACASA-N 1 2 235.331 2.415 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)C(C)=C1CCC1 ZINC000833565701 587720718 /nfs/dbraw/zinc/72/07/18/587720718.db2.gz KYPQBZZSFYBVSF-UHFFFAOYSA-N 1 2 246.310 2.207 20 0 BEADLO O=C(CCn1cc[nH+]c1)NCCC[C@H]1C=CCC1 ZINC000834334210 587752365 /nfs/dbraw/zinc/75/23/65/587752365.db2.gz JIPAZSKCBVLJJP-ZDUSSCGKSA-N 1 2 247.342 2.136 20 0 BEADLO CCOC1C[NH+](C[C@@H](O)c2cc(C)cc(C)c2)C1 ZINC000834378009 587753495 /nfs/dbraw/zinc/75/34/95/587753495.db2.gz KXGGFEDGPQATMY-OAHLLOKOSA-N 1 2 249.354 2.058 20 0 BEADLO c1cn2c([nH+]1)[C@@H](Nc1cccc3c1OCO3)CC2 ZINC000834759380 587765947 /nfs/dbraw/zinc/76/59/47/587765947.db2.gz BDBCUZGTCUZEFL-JTQLQIEISA-N 1 2 243.266 2.169 20 0 BEADLO CCC1C[NH+](Cc2cnn(-c3ccccc3)n2)C1 ZINC000835073501 587780363 /nfs/dbraw/zinc/78/03/63/587780363.db2.gz BIRSIWVDUQPADC-UHFFFAOYSA-N 1 2 242.326 2.109 20 0 BEADLO C[C@H]1CCC[C@]1(C)C(=O)OCc1c[nH+]cn1C ZINC000835195734 587788551 /nfs/dbraw/zinc/78/85/51/587788551.db2.gz ZWNMYYTYHGHQRI-GWCFXTLKSA-N 1 2 236.315 2.290 20 0 BEADLO Cn1c[nH+]cc1COC(=O)C1(C2CCC2)CCC1 ZINC000835196334 587788579 /nfs/dbraw/zinc/78/85/79/587788579.db2.gz XKSSPRWBLDAJLC-UHFFFAOYSA-N 1 2 248.326 2.434 20 0 BEADLO CC(F)(F)C(C)(C)C(=O)OCCn1cc[nH+]c1 ZINC000835350963 587797901 /nfs/dbraw/zinc/79/79/01/587797901.db2.gz VOBHNKUAZKEUDM-UHFFFAOYSA-N 1 2 246.257 2.108 20 0 BEADLO C[C@@H]1CCC[C@@]1(C)C(=O)OCCn1cc[nH+]c1 ZINC000835349760 587798081 /nfs/dbraw/zinc/79/80/81/587798081.db2.gz KATXXTSQMNFGBC-DGCLKSJQSA-N 1 2 236.315 2.253 20 0 BEADLO Cc1[nH+]c2cc(OC(=O)[C@@H]3C[C@H]3C)ccc2n1C ZINC000835503227 587806072 /nfs/dbraw/zinc/80/60/72/587806072.db2.gz BZDNOHORDLORTG-LDYMZIIASA-N 1 2 244.294 2.443 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)N2CCCCC2)c2[nH+]ccn21 ZINC000836240931 587829503 /nfs/dbraw/zinc/82/95/03/587829503.db2.gz RWYVLSXIDWGJPI-MNOVXSKESA-N 1 2 248.330 2.084 20 0 BEADLO CCC(C)(C)c1noc(CCn2cc[nH+]c2)n1 ZINC000867173376 587830807 /nfs/dbraw/zinc/83/08/07/587830807.db2.gz AEFASJUDWDFZAK-UHFFFAOYSA-N 1 2 234.303 2.196 20 0 BEADLO CS/C=C/C(=O)NCc1c[nH+]c(C)cc1C ZINC000837105229 587854233 /nfs/dbraw/zinc/85/42/33/587854233.db2.gz RUZUFOKVNRLNMN-SNAWJCMRSA-N 1 2 236.340 2.191 20 0 BEADLO Cc1cc(C)c(CNC(=O)C=C2CCC2)c[nH+]1 ZINC000837105102 587854373 /nfs/dbraw/zinc/85/43/73/587854373.db2.gz PERSEIVBVAMZAB-UHFFFAOYSA-N 1 2 230.311 2.425 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1C(=O)OCc1cc[nH+]c(N)c1 ZINC000837975710 587906542 /nfs/dbraw/zinc/90/65/42/587906542.db2.gz WHOIVAQZOANSTB-VXGBXAGGSA-N 1 2 248.326 2.389 20 0 BEADLO Cc1ccc([S@](=O)Cc2c[nH+]cn2C)s1 ZINC000840878955 587927596 /nfs/dbraw/zinc/92/75/96/587927596.db2.gz SMJXINVAFSEUAH-OAHLLOKOSA-N 1 2 240.353 2.098 20 0 BEADLO Cc1ccc([S@@](=O)Cc2c[nH+]cn2C)s1 ZINC000840878953 587927759 /nfs/dbraw/zinc/92/77/59/587927759.db2.gz SMJXINVAFSEUAH-HNNXBMFYSA-N 1 2 240.353 2.098 20 0 BEADLO COc1ccc([NH2+]C[C@@H]2CCSC2)cc1N ZINC000841040357 587938704 /nfs/dbraw/zinc/93/87/04/587938704.db2.gz KTNFIEJOMFYJHS-VIFPVBQESA-N 1 2 238.356 2.442 20 0 BEADLO CC[C@@H](CO[NH+]=C(N)c1cccc(F)c1)OC ZINC000842026130 587989880 /nfs/dbraw/zinc/98/98/80/587989880.db2.gz HNRSSYKZLXDRAI-NSHDSACASA-N 1 2 240.278 2.097 20 0 BEADLO CC[C@H](CO[NH+]=C(N)Cc1cccs1)OC ZINC000842027237 587990339 /nfs/dbraw/zinc/99/03/39/587990339.db2.gz AFCBXTOBEFIOSG-SECBINFHSA-N 1 2 242.344 2.214 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OCc1sccc1Cl ZINC000842037295 587992012 /nfs/dbraw/zinc/99/20/12/587992012.db2.gz WMWDPACMHNOTPW-ZCFIWIBFSA-N 1 2 248.735 2.435 20 0 BEADLO Cc1ccc(CO[NH+]=C(N)[C@H]2CCCO2)c(C)c1 ZINC000842047471 587992988 /nfs/dbraw/zinc/99/29/88/587992988.db2.gz OMJCCXLAXJNPKF-CYBMUJFWSA-N 1 2 248.326 2.481 20 0 BEADLO CC[C@H](C)C(=O)OCC1CN(c2cccc[nH+]2)C1 ZINC000842892310 588071129 /nfs/dbraw/zinc/07/11/29/588071129.db2.gz AMIOCKXMVLTEQR-NSHDSACASA-N 1 2 248.326 2.107 20 0 BEADLO O=C(N[C@@H]1CCn2cc[nH+]c21)OC1CCCCC1 ZINC000867317194 588075931 /nfs/dbraw/zinc/07/59/31/588075931.db2.gz KQKAGVVJMXRNLU-LLVKDONJSA-N 1 2 249.314 2.387 20 0 BEADLO CC[NH2+]Cc1noc(Cc2ccccc2CC)n1 ZINC000843141002 588086285 /nfs/dbraw/zinc/08/62/85/588086285.db2.gz GVZZKTRXLXTXGJ-UHFFFAOYSA-N 1 2 245.326 2.332 20 0 BEADLO CCCCSCCc1nc(C[NH2+]CC)no1 ZINC000843144390 588086400 /nfs/dbraw/zinc/08/64/00/588086400.db2.gz BGCZMJWOCKDOPF-UHFFFAOYSA-N 1 2 243.376 2.255 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2CCC(C)(C)C2)n1 ZINC000843144662 588086655 /nfs/dbraw/zinc/08/66/55/588086655.db2.gz GLVDXQUVQZFFKU-SECBINFHSA-N 1 2 223.320 2.473 20 0 BEADLO CC[NH2+]Cc1noc(Cc2cccc(CC)c2)n1 ZINC000843145213 588086992 /nfs/dbraw/zinc/08/69/92/588086992.db2.gz XDFIHHXTKYUEOB-UHFFFAOYSA-N 1 2 245.326 2.332 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccc(F)cn2)[C@@H](C)CO1 ZINC000844391615 588188681 /nfs/dbraw/zinc/18/86/81/588188681.db2.gz SCGSQCKPAUESCF-GXFFZTMASA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccc(F)cn2)[C@@H](C)CO1 ZINC000844391615 588188683 /nfs/dbraw/zinc/18/86/83/588188683.db2.gz SCGSQCKPAUESCF-GXFFZTMASA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@H+](C/C=C/Cl)[C@H](C)CO1 ZINC000844390470 588189146 /nfs/dbraw/zinc/18/91/46/588189146.db2.gz XOZPSIWHBRHXFT-NUNSBDKSSA-N 1 2 203.713 2.238 20 0 BEADLO CC[C@@H]1C[N@@H+](C/C=C/Cl)[C@H](C)CO1 ZINC000844390470 588189147 /nfs/dbraw/zinc/18/91/47/588189147.db2.gz XOZPSIWHBRHXFT-NUNSBDKSSA-N 1 2 203.713 2.238 20 0 BEADLO CC(C)n1ccnc1C[N@@H+]1C[C@H]2[C@@H](C1)C2(F)F ZINC000844450042 588194959 /nfs/dbraw/zinc/19/49/59/588194959.db2.gz KBSXETKTFSJQJS-AOOOYVTPSA-N 1 2 241.285 2.161 20 0 BEADLO CC(C)n1ccnc1C[N@H+]1C[C@H]2[C@@H](C1)C2(F)F ZINC000844450042 588194960 /nfs/dbraw/zinc/19/49/60/588194960.db2.gz KBSXETKTFSJQJS-AOOOYVTPSA-N 1 2 241.285 2.161 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H]3[C@@H](C2)C3(F)F)sc1C ZINC000844453899 588195841 /nfs/dbraw/zinc/19/58/41/588195841.db2.gz LJXUPPNPHMBIAL-DTORHVGOSA-N 1 2 244.310 2.457 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)sc1C ZINC000844453899 588195843 /nfs/dbraw/zinc/19/58/43/588195843.db2.gz LJXUPPNPHMBIAL-DTORHVGOSA-N 1 2 244.310 2.457 20 0 BEADLO C[C@H](CC(=O)N[C@@H](C)c1ccc[nH]1)n1cc[nH+]c1 ZINC000844453894 588195945 /nfs/dbraw/zinc/19/59/45/588195945.db2.gz IMEFSMACTRICLK-MNOVXSKESA-N 1 2 246.314 2.040 20 0 BEADLO FC1(F)[C@H]2C[N@H+](Cc3ccc(Cl)cn3)C[C@H]21 ZINC000844457521 588196632 /nfs/dbraw/zinc/19/66/32/588196632.db2.gz LCOMUSKVVDTIQD-AOOOYVTPSA-N 1 2 244.672 2.432 20 0 BEADLO FC1(F)[C@H]2C[N@@H+](Cc3ccc(Cl)cn3)C[C@H]21 ZINC000844457521 588196633 /nfs/dbraw/zinc/19/66/33/588196633.db2.gz LCOMUSKVVDTIQD-AOOOYVTPSA-N 1 2 244.672 2.432 20 0 BEADLO COC/C(C)=C\C(=O)Nc1c(C)cc[nH+]c1C ZINC000844524915 588200300 /nfs/dbraw/zinc/20/03/00/588200300.db2.gz DWSQUOTVLXAJJI-CLFYSBASSA-N 1 2 234.299 2.230 20 0 BEADLO C[C@@H](CC(=O)OC/C=C/Cl)n1cc[nH+]c1 ZINC000845279448 588225274 /nfs/dbraw/zinc/22/52/74/588225274.db2.gz WOAUGRKVWXRPCI-HPOULIHZSA-N 1 2 228.679 2.130 20 0 BEADLO CC[C@@H](C)COC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000845281466 588225593 /nfs/dbraw/zinc/22/55/93/588225593.db2.gz HXIKEPQHGLXVGZ-MNOVXSKESA-N 1 2 224.304 2.424 20 0 BEADLO O=C(Cc1cn2c([nH+]1)CCCC2)O[C@@H]1C=CCC1 ZINC000845508916 588231343 /nfs/dbraw/zinc/23/13/43/588231343.db2.gz LELABJOVBICOQQ-GFCCVEGCSA-N 1 2 246.310 2.024 20 0 BEADLO C[C@@H](CC(=O)OCCc1ccoc1)n1cc[nH+]c1 ZINC000845521596 588231759 /nfs/dbraw/zinc/23/17/59/588231759.db2.gz HQSGVPSTCRKOIW-NSHDSACASA-N 1 2 248.282 2.213 20 0 BEADLO C[C@@H](CC(=O)OC1CC(C)C1)n1cc[nH+]c1 ZINC000845573549 588233635 /nfs/dbraw/zinc/23/36/35/588233635.db2.gz BADOGVCPEUAEFX-YVNMAJEFSA-N 1 2 222.288 2.176 20 0 BEADLO CS[C@H](C)COC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000845585582 588234175 /nfs/dbraw/zinc/23/41/75/588234175.db2.gz GIKQTUNGOYOHDE-NXEZZACHSA-N 1 2 242.344 2.129 20 0 BEADLO CCCC[C@@H]1CCC[C@@H]1[NH2+]CC(=O)NOCC ZINC000846090498 588256214 /nfs/dbraw/zinc/25/62/14/588256214.db2.gz BMTSMTKAYWGHEU-NEPJUHHUSA-N 1 2 242.363 2.003 20 0 BEADLO CCCC1CCC([NH2+]CC(=O)NOCC)CC1 ZINC000846090537 588256468 /nfs/dbraw/zinc/25/64/68/588256468.db2.gz HCJMDBJLLRQLFV-UHFFFAOYSA-N 1 2 242.363 2.003 20 0 BEADLO Fc1ccc(C[N@H+]2CCC[C@@H](F)C2)cn1 ZINC000846120829 588258241 /nfs/dbraw/zinc/25/82/41/588258241.db2.gz SSXFAGDDLFAYKQ-SNVBAGLBSA-N 1 2 212.243 2.155 20 0 BEADLO Fc1ccc(C[N@@H+]2CCC[C@@H](F)C2)cn1 ZINC000846120829 588258242 /nfs/dbraw/zinc/25/82/42/588258242.db2.gz SSXFAGDDLFAYKQ-SNVBAGLBSA-N 1 2 212.243 2.155 20 0 BEADLO C/C=C(/CC)C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000846245355 588262375 /nfs/dbraw/zinc/26/23/75/588262375.db2.gz WHZNUOPDUWXEHC-UITAMQMPSA-N 1 2 221.304 2.117 20 0 BEADLO C/C=C(\CC)C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000846245356 588262512 /nfs/dbraw/zinc/26/25/12/588262512.db2.gz WHZNUOPDUWXEHC-WEVVVXLNSA-N 1 2 221.304 2.117 20 0 BEADLO C[C@H](CC(=O)NC(C)(C)c1[nH]cc[nH+]1)C1CC1 ZINC000846247120 588262606 /nfs/dbraw/zinc/26/26/06/588262606.db2.gz VBMHCTRGIVKGEV-SECBINFHSA-N 1 2 235.331 2.197 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)[C@@H]2CC[C@@H](C)CC2)S1 ZINC000846270610 588263531 /nfs/dbraw/zinc/26/35/31/588263531.db2.gz JXHPQDAOSRPYCQ-OPRDCNLKSA-N 1 2 240.372 2.420 20 0 BEADLO C[C@H]1Cc2cc(NCc3c[nH+]cn3C)ccc2O1 ZINC000846749494 588284815 /nfs/dbraw/zinc/28/48/15/588284815.db2.gz BTSQKSJFBWWFTP-JTQLQIEISA-N 1 2 243.310 2.356 20 0 BEADLO c1coc([C@H]2CC[N@@H+](Cc3cnsn3)C2)c1 ZINC000846801558 588289124 /nfs/dbraw/zinc/28/91/24/588289124.db2.gz CHACLHLYYYYFKZ-VIFPVBQESA-N 1 2 235.312 2.121 20 0 BEADLO c1coc([C@H]2CC[N@H+](Cc3cnsn3)C2)c1 ZINC000846801558 588289125 /nfs/dbraw/zinc/28/91/25/588289125.db2.gz CHACLHLYYYYFKZ-VIFPVBQESA-N 1 2 235.312 2.121 20 0 BEADLO c1nsnc1C[N@@H+]1CCCc2ccccc2C1 ZINC000846804719 588289635 /nfs/dbraw/zinc/28/96/35/588289635.db2.gz YGKKSCZELZXMMJ-UHFFFAOYSA-N 1 2 245.351 2.487 20 0 BEADLO c1nsnc1C[N@H+]1CCCc2ccccc2C1 ZINC000846804719 588289636 /nfs/dbraw/zinc/28/96/36/588289636.db2.gz YGKKSCZELZXMMJ-UHFFFAOYSA-N 1 2 245.351 2.487 20 0 BEADLO C[C@H]1CCC[N@H+](Cc2cnsn2)[C@H]1C ZINC000846806960 588289833 /nfs/dbraw/zinc/28/98/33/588289833.db2.gz RTJKHMWEPOZLDB-IUCAKERBSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@H]1CCC[N@@H+](Cc2cnsn2)[C@H]1C ZINC000846806960 588289834 /nfs/dbraw/zinc/28/98/34/588289834.db2.gz RTJKHMWEPOZLDB-IUCAKERBSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]1CC[C@H](C)C[N@H+]1Cc1cnsn1 ZINC000846808118 588290064 /nfs/dbraw/zinc/29/00/64/588290064.db2.gz PZRGMVCSDNSQFD-DTWKUNHWSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1cnsn1 ZINC000846808118 588290065 /nfs/dbraw/zinc/29/00/65/588290065.db2.gz PZRGMVCSDNSQFD-DTWKUNHWSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@H]1CCCCC[N@@H+]1Cc1cnsn1 ZINC000846807864 588290076 /nfs/dbraw/zinc/29/00/76/588290076.db2.gz IRCBYSQGSSABPZ-VIFPVBQESA-N 1 2 211.334 2.303 20 0 BEADLO C[C@H]1CCCCC[N@H+]1Cc1cnsn1 ZINC000846807864 588290077 /nfs/dbraw/zinc/29/00/77/588290077.db2.gz IRCBYSQGSSABPZ-VIFPVBQESA-N 1 2 211.334 2.303 20 0 BEADLO c1nsnc1C[NH2+]C1(c2ccccc2)CC1 ZINC000846843840 588292541 /nfs/dbraw/zinc/29/25/41/588292541.db2.gz IPTFOYVNAOBAQY-UHFFFAOYSA-N 1 2 231.324 2.317 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cnsn2)C[C@@H]1C ZINC000846841467 588292709 /nfs/dbraw/zinc/29/27/09/588292709.db2.gz OEVYOQSYDYFSKQ-BDAKNGLRSA-N 1 2 211.334 2.016 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cnsn2)C[C@@H]1C ZINC000846841467 588292710 /nfs/dbraw/zinc/29/27/10/588292710.db2.gz OEVYOQSYDYFSKQ-BDAKNGLRSA-N 1 2 211.334 2.016 20 0 BEADLO c1nsnc1C[NH2+][C@H](c1cccnc1)C1CC1 ZINC000846848328 588292952 /nfs/dbraw/zinc/29/29/52/588292952.db2.gz BJUQLILDDUDFBX-LBPRGKRZSA-N 1 2 246.339 2.174 20 0 BEADLO CC(=O)c1cc(C[NH+]2CCC(F)(F)CC2)on1 ZINC000846882360 588295293 /nfs/dbraw/zinc/29/52/93/588295293.db2.gz JJEDZDYCMJKEST-UHFFFAOYSA-N 1 2 244.241 2.108 20 0 BEADLO CCCCOC(=O)[C@@H](C)[NH2+][C@H]1CCC1(C)C ZINC000846959482 588298609 /nfs/dbraw/zinc/29/86/09/588298609.db2.gz IXBWYWHUYAQSNY-MNOVXSKESA-N 1 2 227.348 2.496 20 0 BEADLO FC1(F)CC12CC[NH+](Cc1cnsn1)CC2 ZINC000847014882 588301587 /nfs/dbraw/zinc/30/15/87/588301587.db2.gz UNCLGJIUBQLMSL-UHFFFAOYSA-N 1 2 245.298 2.159 20 0 BEADLO CCCCCCNC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000847311882 588310581 /nfs/dbraw/zinc/31/05/81/588310581.db2.gz CVIHFAUCINEYCT-NSHDSACASA-N 1 2 237.347 2.285 20 0 BEADLO CCCCCCNC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000847311882 588310582 /nfs/dbraw/zinc/31/05/82/588310582.db2.gz CVIHFAUCINEYCT-NSHDSACASA-N 1 2 237.347 2.285 20 0 BEADLO CCc1nc(CN[C@H]2CCCn3cc[nH+]c32)co1 ZINC000848553668 588396324 /nfs/dbraw/zinc/39/63/24/588396324.db2.gz NFFDJKUXIFDWOA-NSHDSACASA-N 1 2 246.314 2.058 20 0 BEADLO CC[NH2+]Cc1noc(/C(C)=C\c2ccccn2)n1 ZINC000848617806 588402014 /nfs/dbraw/zinc/40/20/14/588402014.db2.gz MZKGAOIAYJCMJW-NTMALXAHSA-N 1 2 244.298 2.135 20 0 BEADLO CC[NH2+]Cc1noc(/C(C)=C\c2ccco2)n1 ZINC000848618624 588402343 /nfs/dbraw/zinc/40/23/43/588402343.db2.gz UUGXNXDTBDOZEE-CLFYSBASSA-N 1 2 233.271 2.333 20 0 BEADLO CCc1cc(N2Cc3ccncc3C2)nc(C)[nH+]1 ZINC000848726825 588408892 /nfs/dbraw/zinc/40/88/92/588408892.db2.gz JWKZWSWYJQXTNJ-UHFFFAOYSA-N 1 2 240.310 2.263 20 0 BEADLO CC1(C)CC[C@@H]1C(=O)OCCCn1cc[nH+]c1 ZINC000850071190 588518164 /nfs/dbraw/zinc/51/81/64/588518164.db2.gz OJSHHZBPMBREMC-LLVKDONJSA-N 1 2 236.315 2.253 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)CCCF)c1 ZINC000850195712 588526784 /nfs/dbraw/zinc/52/67/84/588526784.db2.gz YWMBGCMZUBSBLI-UHFFFAOYSA-N 1 2 241.262 2.192 20 0 BEADLO Cc1ccc(COC(=O)CCCF)c(C)[nH+]1 ZINC000850195722 588526960 /nfs/dbraw/zinc/52/69/60/588526960.db2.gz ZMBIASOIYKYYDF-UHFFFAOYSA-N 1 2 225.263 2.491 20 0 BEADLO COc1ccc(F)cc1NCc1[nH]cc(C)[nH+]1 ZINC000850234967 588530810 /nfs/dbraw/zinc/53/08/10/588530810.db2.gz OPXBFIFJQDQJSV-UHFFFAOYSA-N 1 2 235.262 2.478 20 0 BEADLO C[C@@H](CCO)[NH2+]CC(F)(F)c1cccc(F)c1 ZINC000850504209 588552689 /nfs/dbraw/zinc/55/26/89/588552689.db2.gz XDIDVEGRIXZMOO-VIFPVBQESA-N 1 2 247.260 2.278 20 0 BEADLO Cc1ccc(COC(=O)[C@H]2C[C@@H](C)CO2)c(C)[nH+]1 ZINC000885577118 588562055 /nfs/dbraw/zinc/56/20/55/588562055.db2.gz UWZAGEDGTOFGOD-NOZJJQNGSA-N 1 2 249.310 2.167 20 0 BEADLO Cc1ccccc1C[N@H+](C)Cc1cnon1 ZINC000851711732 588615198 /nfs/dbraw/zinc/61/51/98/588615198.db2.gz FHCONBVSSASVAO-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ccccc1C[N@@H+](C)Cc1cnon1 ZINC000851711732 588615199 /nfs/dbraw/zinc/61/51/99/588615199.db2.gz FHCONBVSSASVAO-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO C[C@H]1c2ccsc2CC[N@H+]1Cc1cnon1 ZINC000851717775 588616323 /nfs/dbraw/zinc/61/63/23/588616323.db2.gz OYFYNJNPJPPHRF-QMMMGPOBSA-N 1 2 235.312 2.250 20 0 BEADLO C[C@H]1c2ccsc2CC[N@@H+]1Cc1cnon1 ZINC000851717775 588616324 /nfs/dbraw/zinc/61/63/24/588616324.db2.gz OYFYNJNPJPPHRF-QMMMGPOBSA-N 1 2 235.312 2.250 20 0 BEADLO c1csc(C[N@H+](Cc2cnon2)C2CC2)c1 ZINC000851717850 588616447 /nfs/dbraw/zinc/61/64/47/588616447.db2.gz ZFGRPXHZNUPKOW-UHFFFAOYSA-N 1 2 235.312 2.296 20 0 BEADLO c1csc(C[N@@H+](Cc2cnon2)C2CC2)c1 ZINC000851717850 588616448 /nfs/dbraw/zinc/61/64/48/588616448.db2.gz ZFGRPXHZNUPKOW-UHFFFAOYSA-N 1 2 235.312 2.296 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)Cc1cccc(F)n1 ZINC000851725614 588618206 /nfs/dbraw/zinc/61/82/06/588618206.db2.gz CESDUESDHJQNNJ-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)Cc1cccc(F)n1 ZINC000851725614 588618207 /nfs/dbraw/zinc/61/82/07/588618207.db2.gz CESDUESDHJQNNJ-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cccc(F)n2)C[C@@H](C)O1 ZINC000851767631 588624976 /nfs/dbraw/zinc/62/49/76/588624976.db2.gz BMGMFSISEVADGI-PWSUYJOCSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cccc(F)n2)C[C@@H](C)O1 ZINC000851767631 588624977 /nfs/dbraw/zinc/62/49/77/588624977.db2.gz BMGMFSISEVADGI-PWSUYJOCSA-N 1 2 238.306 2.220 20 0 BEADLO Cn1c[nH+]c(CN2CCc3c(F)cccc3C2)c1 ZINC000851870048 588637389 /nfs/dbraw/zinc/63/73/89/588637389.db2.gz YWYRJRWFJGLGPQ-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1cnc(C[N@@H+]2CCc3c(F)cccc3C2)c1 ZINC000851870048 588637390 /nfs/dbraw/zinc/63/73/90/588637390.db2.gz YWYRJRWFJGLGPQ-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1cnc(C[N@H+]2CCc3c(F)cccc3C2)c1 ZINC000851870048 588637391 /nfs/dbraw/zinc/63/73/91/588637391.db2.gz YWYRJRWFJGLGPQ-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO COCC1([N@H+](C)CC=C(Cl)Cl)CC1 ZINC000851878789 588638972 /nfs/dbraw/zinc/63/89/72/588638972.db2.gz QCICJRHSAMPRLV-UHFFFAOYSA-N 1 2 224.131 2.416 20 0 BEADLO COCC1([N@@H+](C)CC=C(Cl)Cl)CC1 ZINC000851878789 588638973 /nfs/dbraw/zinc/63/89/73/588638973.db2.gz QCICJRHSAMPRLV-UHFFFAOYSA-N 1 2 224.131 2.416 20 0 BEADLO C[N@@H+](CC=C(Cl)Cl)CCc1cnccn1 ZINC000851890204 588640778 /nfs/dbraw/zinc/64/07/78/588640778.db2.gz VFFOZAUDDNGZKX-UHFFFAOYSA-N 1 2 246.141 2.270 20 0 BEADLO C[N@H+](CC=C(Cl)Cl)CCc1cnccn1 ZINC000851890204 588640779 /nfs/dbraw/zinc/64/07/79/588640779.db2.gz VFFOZAUDDNGZKX-UHFFFAOYSA-N 1 2 246.141 2.270 20 0 BEADLO C[C@H](C[S@@](C)=O)[N@H+](C)CC=C(Cl)Cl ZINC000851923489 588644282 /nfs/dbraw/zinc/64/42/82/588644282.db2.gz RESVRPRIFYFEIK-FUXBKTLASA-N 1 2 244.187 2.004 20 0 BEADLO C[C@H](C[S@@](C)=O)[N@@H+](C)CC=C(Cl)Cl ZINC000851923489 588644283 /nfs/dbraw/zinc/64/42/83/588644283.db2.gz RESVRPRIFYFEIK-FUXBKTLASA-N 1 2 244.187 2.004 20 0 BEADLO C[C@H]1C[C@@H](c2cccnc2)[N@H+](Cc2cnon2)C1 ZINC000851934194 588645469 /nfs/dbraw/zinc/64/54/69/588645469.db2.gz GCTBLZZCMBRUFZ-GWCFXTLKSA-N 1 2 244.298 2.048 20 0 BEADLO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cnon2)C1 ZINC000851934194 588645470 /nfs/dbraw/zinc/64/54/70/588645470.db2.gz GCTBLZZCMBRUFZ-GWCFXTLKSA-N 1 2 244.298 2.048 20 0 BEADLO CC[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cnon1 ZINC000851939580 588646257 /nfs/dbraw/zinc/64/62/57/588646257.db2.gz FSLHMHGFTAZXIZ-CQSZACIVSA-N 1 2 243.310 2.407 20 0 BEADLO CC[C@@H]1Cc2ccccc2C[N@H+]1Cc1cnon1 ZINC000851939580 588646258 /nfs/dbraw/zinc/64/62/58/588646258.db2.gz FSLHMHGFTAZXIZ-CQSZACIVSA-N 1 2 243.310 2.407 20 0 BEADLO CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cnon1 ZINC000851974800 588650322 /nfs/dbraw/zinc/65/03/22/588650322.db2.gz IXUXFSAXANLTKU-QMMMGPOBSA-N 1 2 249.236 2.232 20 0 BEADLO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1cnon1 ZINC000851974800 588650323 /nfs/dbraw/zinc/65/03/23/588650323.db2.gz IXUXFSAXANLTKU-QMMMGPOBSA-N 1 2 249.236 2.232 20 0 BEADLO Cc1cc(F)ccc1C[N@H+](C)Cc1cnon1 ZINC000851981913 588650840 /nfs/dbraw/zinc/65/08/40/588650840.db2.gz ADHRVDHXUYEYAV-UHFFFAOYSA-N 1 2 235.262 2.149 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1cnon1 ZINC000851981913 588650841 /nfs/dbraw/zinc/65/08/41/588650841.db2.gz ADHRVDHXUYEYAV-UHFFFAOYSA-N 1 2 235.262 2.149 20 0 BEADLO C[C@H]1COC(C)(C)C[N@@H+]1Cc1cccc(F)n1 ZINC000851983262 588651522 /nfs/dbraw/zinc/65/15/22/588651522.db2.gz VHJZLUUBSCVSKI-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H]1COC(C)(C)C[N@H+]1Cc1cccc(F)n1 ZINC000851983262 588651523 /nfs/dbraw/zinc/65/15/23/588651523.db2.gz VHJZLUUBSCVSKI-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO O[C@]1(C(F)F)CC[N@H+](CC=C(Cl)Cl)C1 ZINC000852121406 588665050 /nfs/dbraw/zinc/66/50/50/588665050.db2.gz QJRFJNHNZUSMQW-MRVPVSSYSA-N 1 2 246.084 2.007 20 0 BEADLO O[C@]1(C(F)F)CC[N@@H+](CC=C(Cl)Cl)C1 ZINC000852121406 588665051 /nfs/dbraw/zinc/66/50/51/588665051.db2.gz QJRFJNHNZUSMQW-MRVPVSSYSA-N 1 2 246.084 2.007 20 0 BEADLO c1nn[nH]c1CC[NH+]1CCCCCCCC1 ZINC000852141142 588666731 /nfs/dbraw/zinc/66/67/31/588666731.db2.gz REQKCTDPMULKAU-UHFFFAOYSA-N 1 2 222.336 2.003 20 0 BEADLO Cc1cc(=O)[nH]c(C(C)(C)[NH2+]C/C=C/Cl)n1 ZINC000852147396 588667011 /nfs/dbraw/zinc/66/70/11/588667011.db2.gz QGGJNIAGJOOUJX-SNAWJCMRSA-N 1 2 241.722 2.068 20 0 BEADLO ClC(Cl)=CC[N@@H+]1C[C@@H]2C[C@H]1CS2 ZINC000852165108 588668876 /nfs/dbraw/zinc/66/88/76/588668876.db2.gz ZJMPBCOKEVKLKN-BQBZGAKWSA-N 1 2 224.156 2.495 20 0 BEADLO ClC(Cl)=CC[N@H+]1C[C@@H]2C[C@H]1CS2 ZINC000852165108 588668877 /nfs/dbraw/zinc/66/88/77/588668877.db2.gz ZJMPBCOKEVKLKN-BQBZGAKWSA-N 1 2 224.156 2.495 20 0 BEADLO COC(=O)C1([N@H+](C/C=C\Cl)C2CC2)CCC1 ZINC000852177800 588669578 /nfs/dbraw/zinc/66/95/78/588669578.db2.gz SNPUOYVSLNVZRL-BAQGIRSFSA-N 1 2 243.734 2.299 20 0 BEADLO COC(=O)C1([N@@H+](C/C=C\Cl)C2CC2)CCC1 ZINC000852177800 588669579 /nfs/dbraw/zinc/66/95/79/588669579.db2.gz SNPUOYVSLNVZRL-BAQGIRSFSA-N 1 2 243.734 2.299 20 0 BEADLO CC(C)c1cnc(CN(C)Cc2c[nH+]c[nH]2)o1 ZINC000852286283 588675935 /nfs/dbraw/zinc/67/59/35/588675935.db2.gz BRLULZNALGCJDY-UHFFFAOYSA-N 1 2 234.303 2.153 20 0 BEADLO CC(C)c1cnc(CN(C)Cc2c[nH]c[nH+]2)o1 ZINC000852286283 588675936 /nfs/dbraw/zinc/67/59/36/588675936.db2.gz BRLULZNALGCJDY-UHFFFAOYSA-N 1 2 234.303 2.153 20 0 BEADLO CCc1ccc(C[N@H+](CCF)CCOC)nc1 ZINC000852480245 588683573 /nfs/dbraw/zinc/68/35/73/588683573.db2.gz RWFMQIQMXFTWFX-UHFFFAOYSA-N 1 2 240.322 2.062 20 0 BEADLO CCc1ccc(C[N@@H+](CCF)CCOC)nc1 ZINC000852480245 588683574 /nfs/dbraw/zinc/68/35/74/588683574.db2.gz RWFMQIQMXFTWFX-UHFFFAOYSA-N 1 2 240.322 2.062 20 0 BEADLO COCC[N@H+](CCF)Cc1ccc(Cl)cn1 ZINC000852480373 588683577 /nfs/dbraw/zinc/68/35/77/588683577.db2.gz TWJCGZAUCAMWNH-UHFFFAOYSA-N 1 2 246.713 2.153 20 0 BEADLO COCC[N@@H+](CCF)Cc1ccc(Cl)cn1 ZINC000852480373 588683578 /nfs/dbraw/zinc/68/35/78/588683578.db2.gz TWJCGZAUCAMWNH-UHFFFAOYSA-N 1 2 246.713 2.153 20 0 BEADLO C/C(=C/C(C)(C)C)C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000861762591 589177142 /nfs/dbraw/zinc/17/71/42/589177142.db2.gz ZCLBUYRLFRTPET-YFHOEESVSA-N 1 2 247.342 2.287 20 0 BEADLO C/C(=C/C(C)(C)C)C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000861762591 589177143 /nfs/dbraw/zinc/17/71/43/589177143.db2.gz ZCLBUYRLFRTPET-YFHOEESVSA-N 1 2 247.342 2.287 20 0 BEADLO Cc1[nH]c(CN2CCC[C@H]2c2ncc[nH]2)[nH+]c1C ZINC000862325314 589201464 /nfs/dbraw/zinc/20/14/64/589201464.db2.gz AGNWICYSVSOWTB-NSHDSACASA-N 1 2 245.330 2.087 20 0 BEADLO CCc1nc(C[NH2+]Cc2oc(C)nc2C)co1 ZINC000862387664 589207297 /nfs/dbraw/zinc/20/72/97/589207297.db2.gz POOGGYUQVZWZBN-UHFFFAOYSA-N 1 2 235.287 2.132 20 0 BEADLO Cc1[nH]c(CN2CC(CC(F)F)C2)[nH+]c1C ZINC000862397198 589208817 /nfs/dbraw/zinc/20/88/17/589208817.db2.gz CZKLVYSRSACELM-UHFFFAOYSA-N 1 2 229.274 2.114 20 0 BEADLO Cn1c(Cl)nc(Cl)c1C[N@@H+]1C[C@@H]2C[C@@H]2C1 ZINC000862439964 589212916 /nfs/dbraw/zinc/21/29/16/589212916.db2.gz CNAPBHSFKCKVSS-KNVOCYPGSA-N 1 2 246.141 2.179 20 0 BEADLO Cn1c(Cl)nc(Cl)c1C[N@H+]1C[C@@H]2C[C@@H]2C1 ZINC000862439964 589212917 /nfs/dbraw/zinc/21/29/17/589212917.db2.gz CNAPBHSFKCKVSS-KNVOCYPGSA-N 1 2 246.141 2.179 20 0 BEADLO CCCCO[NH+]=C(N)C1(OC)CCCC1 ZINC000863476922 589291929 /nfs/dbraw/zinc/29/19/29/589291929.db2.gz CYIJBWGEHOQUNM-UHFFFAOYSA-N 1 2 214.309 2.244 20 0 BEADLO COC1(C(N)=[NH+]OC2CCCC2)CCCC1 ZINC000863477951 589292179 /nfs/dbraw/zinc/29/21/79/589292179.db2.gz DEESFWMYPURKNH-UHFFFAOYSA-N 1 2 226.320 2.387 20 0 BEADLO Cc1[nH]cc(-c2cnn([C@@H]3CCCCO3)c2)[nH+]1 ZINC000863727946 589313485 /nfs/dbraw/zinc/31/34/85/589313485.db2.gz OQAHLQRSKUPUNT-LBPRGKRZSA-N 1 2 232.287 2.281 20 0 BEADLO Cc1[nH+]cc(-c2cccc3c2OCC3)n1C ZINC000863974764 589331122 /nfs/dbraw/zinc/33/11/22/589331122.db2.gz PRDNSAJPYJFCGP-UHFFFAOYSA-N 1 2 214.268 2.330 20 0 BEADLO C[C@H](O)c1cccc(N[C@@H]2CO[C@@H](C3CC3)C2)[nH+]1 ZINC000864090605 589343319 /nfs/dbraw/zinc/34/33/19/589343319.db2.gz GTYUFZNTFUFCME-XHVZSJERSA-N 1 2 248.326 2.114 20 0 BEADLO OCc1cc[nH+]c(NCC[C@H]2CCCS2)c1 ZINC000864093131 589344376 /nfs/dbraw/zinc/34/43/76/589344376.db2.gz HYPMNNFGMAHDDP-LLVKDONJSA-N 1 2 238.356 2.272 20 0 BEADLO CCO[C@@]1(C)C[C@H]1Nc1cccc([C@@H](C)O)[nH+]1 ZINC000864093323 589344518 /nfs/dbraw/zinc/34/45/18/589344518.db2.gz NHMMDPDIOWTGIQ-XWIASGKRSA-N 1 2 236.315 2.114 20 0 BEADLO CC1=NO[C@@H](CNc2cc(CC(C)C)[nH+]cn2)C1 ZINC000864234082 589348561 /nfs/dbraw/zinc/34/85/61/589348561.db2.gz PSFMSGYZGVTCOZ-GFCCVEGCSA-N 1 2 248.330 2.252 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)[C@@H]1C[C@H]1C(C)(C)C ZINC000864883635 589399977 /nfs/dbraw/zinc/39/99/77/589399977.db2.gz DMSQOFPCCUNISZ-QJPTWQEYSA-N 1 2 249.358 2.070 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C ZINC000865069447 589407461 /nfs/dbraw/zinc/40/74/61/589407461.db2.gz GVEWBXCYXMAQKE-UKKRHICBSA-N 1 2 246.310 2.321 20 0 BEADLO Cc1ccc(CNc2c[nH+]cc(N(C)C)c2)cn1 ZINC000865294655 589420243 /nfs/dbraw/zinc/42/02/43/589420243.db2.gz OGKIZMSCRJVODO-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO CC(C)(C)c1cn(C[C@H]2CC3(CC3)C(=O)O2)c[nH+]1 ZINC000865376468 589428768 /nfs/dbraw/zinc/42/87/68/589428768.db2.gz OLWVQHJMZGNXKK-SNVBAGLBSA-N 1 2 248.326 2.276 20 0 BEADLO c1coc(C[NH2+]Cc2cn(C3CC3)cn2)c1 ZINC000865401416 589432924 /nfs/dbraw/zinc/43/29/24/589432924.db2.gz UCEQGLJDELGGJY-UHFFFAOYSA-N 1 2 217.272 2.101 20 0 BEADLO CN(C)c1ccc(F)cc1C[NH2+]Cc1ccon1 ZINC000865481343 589440330 /nfs/dbraw/zinc/44/03/30/589440330.db2.gz ORINOAUVPUXGJN-UHFFFAOYSA-N 1 2 249.289 2.170 20 0 BEADLO COc1ncccc1NCc1cn(C2CC2)c[nH+]1 ZINC000865506113 589441430 /nfs/dbraw/zinc/44/14/30/589441430.db2.gz OTMNPNZRIXLDSS-UHFFFAOYSA-N 1 2 244.298 2.234 20 0 BEADLO CCC[C@H](O)CNc1cc(CC(C)C)[nH+]cn1 ZINC000865536474 589444027 /nfs/dbraw/zinc/44/40/27/589444027.db2.gz ZWPLJWFOYIAWKO-LBPRGKRZSA-N 1 2 237.347 2.248 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@]12C[C@@H]1CCCC2 ZINC000865574789 589447959 /nfs/dbraw/zinc/44/79/59/589447959.db2.gz DJPDSLKATCQHEM-FZMZJTMJSA-N 1 2 230.311 2.331 20 0 BEADLO CCCCc1cc(NCc2ccon2)nc[nH+]1 ZINC000865580099 589448791 /nfs/dbraw/zinc/44/87/91/589448791.db2.gz RHYQORHLHIZIMM-UHFFFAOYSA-N 1 2 232.287 2.419 20 0 BEADLO FCC(CF)[NH2+]Cc1ccc(C(F)F)nc1 ZINC000865583759 589449389 /nfs/dbraw/zinc/44/93/89/589449389.db2.gz VJPIFZQRXPCABV-UHFFFAOYSA-N 1 2 236.212 2.416 20 0 BEADLO CC(C)Cc1cc(N[C@@H](C)CCCO)nc[nH+]1 ZINC000865605968 589450375 /nfs/dbraw/zinc/45/03/75/589450375.db2.gz LEIOJALSIVMDJD-NSHDSACASA-N 1 2 237.347 2.248 20 0 BEADLO CC(C)Cc1cc(NCC(C)(C)CO)nc[nH+]1 ZINC000865627188 589452612 /nfs/dbraw/zinc/45/26/12/589452612.db2.gz FVMZNJKKSIWUCV-UHFFFAOYSA-N 1 2 237.347 2.106 20 0 BEADLO Cc1cncc(CNc2ccc([C@@H](C)O)c[nH+]2)c1 ZINC000865647348 589454150 /nfs/dbraw/zinc/45/41/50/589454150.db2.gz BMEACJKRUNWAHI-LLVKDONJSA-N 1 2 243.310 2.450 20 0 BEADLO CC(C)(F)C[NH2+]Cc1cn(-c2ccccc2)nn1 ZINC000865655063 589454640 /nfs/dbraw/zinc/45/46/40/589454640.db2.gz ZTDGSWPGTARKDN-UHFFFAOYSA-N 1 2 248.305 2.105 20 0 BEADLO C[C@H](O)c1ccc(N2CC[C@@H](C)[C@H](F)C2)[nH+]c1 ZINC000865662526 589454871 /nfs/dbraw/zinc/45/48/71/589454871.db2.gz APLNGWVYGWGHOX-JFGNBEQYSA-N 1 2 238.306 2.319 20 0 BEADLO CCCn1cc(C[NH2+][C@@H]2CCCC[C@@H]2F)nn1 ZINC000865697084 589457010 /nfs/dbraw/zinc/45/70/10/589457010.db2.gz RZEKZSNXGMGPHC-NWDGAFQWSA-N 1 2 240.326 2.058 20 0 BEADLO CC(C)Cc1cc(NC[C@H]2CC[C@@H](O)C2)nc[nH+]1 ZINC000865720756 589458171 /nfs/dbraw/zinc/45/81/71/589458171.db2.gz KGNUGKDPEKAJSD-WCQYABFASA-N 1 2 249.358 2.248 20 0 BEADLO CC(C)Cc1cc(NCCC2CC(O)C2)nc[nH+]1 ZINC000865730637 589458962 /nfs/dbraw/zinc/45/89/62/589458962.db2.gz YJBMELSBWZYEIK-UHFFFAOYSA-N 1 2 249.358 2.248 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2C[C@@H]2[C@@H]2C[C@H]2C)cc[nH+]1 ZINC000865741579 589459981 /nfs/dbraw/zinc/45/99/81/589459981.db2.gz PYRILMGHWMLNBC-HUXSOILUSA-N 1 2 230.311 2.043 20 0 BEADLO Cc1cccc(CCCNc2ccc(F)nn2)[nH+]1 ZINC000865792203 589462184 /nfs/dbraw/zinc/46/21/84/589462184.db2.gz AFKSVMZGLLTULV-UHFFFAOYSA-N 1 2 246.289 2.364 20 0 BEADLO CC(C)Cc1cc(NCc2c[nH+]cn2C)ncn1 ZINC000865814551 589462878 /nfs/dbraw/zinc/46/28/78/589462878.db2.gz KNEYTGXADKBIMB-UHFFFAOYSA-N 1 2 245.330 2.021 20 0 BEADLO CN(C)c1ccc([NH2+]CC2(C)COC2)cc1F ZINC000865865092 589465786 /nfs/dbraw/zinc/46/57/86/589465786.db2.gz WPNVIZHUPILKEB-UHFFFAOYSA-N 1 2 238.306 2.340 20 0 BEADLO C[C@H](O)c1ccc(N[C@@H](C)c2ccn(C)n2)[nH+]c1 ZINC000865872717 589466419 /nfs/dbraw/zinc/46/64/19/589466419.db2.gz STROQGWAZCSVSH-UWVGGRQHSA-N 1 2 246.314 2.042 20 0 BEADLO CC[C@@H](C)COC(=O)[C@H](C)[NH+]1CCSCC1 ZINC000120794524 589466464 /nfs/dbraw/zinc/46/64/64/589466464.db2.gz YFFONYYRGBQAIV-MNOVXSKESA-N 1 2 245.388 2.013 20 0 BEADLO C/C=C/CNc1nc(N)[nH+]c(C2CCCC2)n1 ZINC000865972512 589470946 /nfs/dbraw/zinc/47/09/46/589470946.db2.gz WURXDJUDJFHGAU-NSCUHMNNSA-N 1 2 233.319 2.099 20 0 BEADLO C/C=C/CNc1nc(N)nc(C2CCCC2)[nH+]1 ZINC000865972512 589470947 /nfs/dbraw/zinc/47/09/47/589470947.db2.gz WURXDJUDJFHGAU-NSCUHMNNSA-N 1 2 233.319 2.099 20 0 BEADLO C[C@@H](O)c1ccc(NCC(C)(C)F)[nH+]c1 ZINC000865984872 589471261 /nfs/dbraw/zinc/47/12/61/589471261.db2.gz HQEHDTGASMWDEZ-MRVPVSSYSA-N 1 2 212.268 2.295 20 0 BEADLO Cc1cc(N[C@@H]2CCCC[C@@H]2F)nc[nH+]1 ZINC000866046491 589473975 /nfs/dbraw/zinc/47/39/75/589473975.db2.gz ZUHTWPJTOLQHJS-VHSXEESVSA-N 1 2 209.268 2.478 20 0 BEADLO CCc1cc(N[C@@H]2CC(C)(C)CC[C@H]2O)nc[nH+]1 ZINC000866049181 589474273 /nfs/dbraw/zinc/47/42/73/589474273.db2.gz GVFPJUBYSJMDNP-VXGBXAGGSA-N 1 2 249.358 2.391 20 0 BEADLO CC[C@@]1(O)CCCN(c2cc[nH+]c(C(C)C)n2)C1 ZINC000866067951 589474693 /nfs/dbraw/zinc/47/46/93/589474693.db2.gz ZSBSPFFXGRGPFM-CQSZACIVSA-N 1 2 249.358 2.341 20 0 BEADLO CCc1nc(N2C[C@@H](OC)CC[C@@H]2C)cc(C)[nH+]1 ZINC000866072664 589474784 /nfs/dbraw/zinc/47/47/84/589474784.db2.gz LXRLPEXWMUVXIB-RYUDHWBXSA-N 1 2 249.358 2.351 20 0 BEADLO Cn1cc(C(F)F)c(CNc2cccc[nH+]2)n1 ZINC000866194159 589479509 /nfs/dbraw/zinc/47/95/09/589479509.db2.gz SRKRYUXBHFVBHI-UHFFFAOYSA-N 1 2 238.241 2.365 20 0 BEADLO CC(C)c1nc(N2C[C@@H](O)CC(C)(C)C2)cc[nH+]1 ZINC000866226459 589481373 /nfs/dbraw/zinc/48/13/73/589481373.db2.gz KXAFIBLGVCMAHX-NSHDSACASA-N 1 2 249.358 2.197 20 0 BEADLO CC[C@@H](C[C@@H](C)O)Nc1cc[nH+]c(C2CC2)n1 ZINC000866299380 589484866 /nfs/dbraw/zinc/48/48/66/589484866.db2.gz JRBSIXNSUWSGCM-KOLCDFICSA-N 1 2 235.331 2.315 20 0 BEADLO CCC=C(F)C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000867459793 589520670 /nfs/dbraw/zinc/52/06/70/589520670.db2.gz ZICJHNFQHZZEOL-BZJXQOFCSA-N 1 2 225.267 2.240 20 0 BEADLO CC/C=C(\F)C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000867459793 589520672 /nfs/dbraw/zinc/52/06/72/589520672.db2.gz ZICJHNFQHZZEOL-BZJXQOFCSA-N 1 2 225.267 2.240 20 0 BEADLO CCCC(=O)OCc1cc(OC)cc(C)[nH+]1 ZINC000122269209 589574268 /nfs/dbraw/zinc/57/42/68/589574268.db2.gz NKZLESWGHUZVTK-UHFFFAOYSA-N 1 2 223.272 2.242 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)c2ccco2)c1 ZINC000122271837 589574336 /nfs/dbraw/zinc/57/43/36/589574336.db2.gz QWEVZTMPFCEHKL-UHFFFAOYSA-N 1 2 247.250 2.349 20 0 BEADLO CC/C=C(/F)C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000868738071 589575034 /nfs/dbraw/zinc/57/50/34/589575034.db2.gz HDLDNLFKEBHANV-ICDUHSAJSA-N 1 2 237.278 2.269 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)[C@@H]2C[C@H]2C(C)(C)C)S1 ZINC000868970600 589584309 /nfs/dbraw/zinc/58/43/09/589584309.db2.gz SMWHYZXHLZGAED-DJLDLDEBSA-N 1 2 240.372 2.276 20 0 BEADLO Cc1ccc(NC(=O)c2cc[nH]c2)c(N(C)C)[nH+]1 ZINC000122783493 589631940 /nfs/dbraw/zinc/63/19/40/589631940.db2.gz QFHWIXIYFIOZSZ-UHFFFAOYSA-N 1 2 244.298 2.036 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)C2CC=CC2)c1 ZINC000122947118 589645147 /nfs/dbraw/zinc/64/51/47/589645147.db2.gz AGGHKGIAMYTNFD-UHFFFAOYSA-N 1 2 247.294 2.408 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@@]12C[C@@H]1CCCC2 ZINC000870219965 589650263 /nfs/dbraw/zinc/65/02/63/589650263.db2.gz KPORKKBNHNNEKA-GWCFXTLKSA-N 1 2 234.299 2.044 20 0 BEADLO CC(C)[C@@H](C)O[NH+]=C(N)COC1CCC1 ZINC000871778509 589813662 /nfs/dbraw/zinc/81/36/62/589813662.db2.gz KUMAZIKMUVUWAV-SECBINFHSA-N 1 2 214.309 2.098 20 0 BEADLO CC(C)SCCO[NH+]=C(N)COC1CCC1 ZINC000871778464 589813810 /nfs/dbraw/zinc/81/38/10/589813810.db2.gz JHFWYBAHEBRABX-UHFFFAOYSA-N 1 2 246.376 2.196 20 0 BEADLO CC(C)[C@H]([NH2+][C@H]1CCOC1=O)c1ccccc1 ZINC000123849038 589828761 /nfs/dbraw/zinc/82/87/61/589828761.db2.gz YENXMOKEMQETEE-STQMWFEESA-N 1 2 233.311 2.289 20 0 BEADLO CC(C)[C@@H]([NH2+][C@H]1CCOC1=O)c1ccccc1 ZINC000123849202 589829615 /nfs/dbraw/zinc/82/96/15/589829615.db2.gz YENXMOKEMQETEE-QWHCGFSZSA-N 1 2 233.311 2.289 20 0 BEADLO CS[C@H]1C[C@H]([NH2+][C@H](C)C(=O)OC(C)(C)C)C1 ZINC000871916466 589832255 /nfs/dbraw/zinc/83/22/55/589832255.db2.gz MEYWHGPFOYUNEM-OPRDCNLKSA-N 1 2 245.388 2.200 20 0 BEADLO CC(C)(C)c1cn(C[C@@H](O)c2ccccn2)c[nH+]1 ZINC000871988979 589853637 /nfs/dbraw/zinc/85/36/37/589853637.db2.gz JATVWMMIEJLGCN-GFCCVEGCSA-N 1 2 245.326 2.309 20 0 BEADLO C[C@H]([NH2+]Cc1nccn1C)c1cc(O)ccc1F ZINC000872032453 589857463 /nfs/dbraw/zinc/85/74/63/589857463.db2.gz ULSGUILOVDETPX-VIFPVBQESA-N 1 2 249.289 2.116 20 0 BEADLO C[C@H](NCc1[nH+]ccn1C)c1cc(O)ccc1F ZINC000872032453 589857465 /nfs/dbraw/zinc/85/74/65/589857465.db2.gz ULSGUILOVDETPX-VIFPVBQESA-N 1 2 249.289 2.116 20 0 BEADLO C[C@@H]([NH2+]Cc1nccn1C)c1cc(O)ccc1F ZINC000872032452 589857635 /nfs/dbraw/zinc/85/76/35/589857635.db2.gz ULSGUILOVDETPX-SECBINFHSA-N 1 2 249.289 2.116 20 0 BEADLO C[C@@H](NCc1[nH+]ccn1C)c1cc(O)ccc1F ZINC000872032452 589857637 /nfs/dbraw/zinc/85/76/37/589857637.db2.gz ULSGUILOVDETPX-SECBINFHSA-N 1 2 249.289 2.116 20 0 BEADLO C[C@H]([NH2+]Cc1cc[nH]n1)c1cccc(O)c1F ZINC000872035765 589858341 /nfs/dbraw/zinc/85/83/41/589858341.db2.gz YQNVXCASCWSTPX-QMMMGPOBSA-N 1 2 235.262 2.105 20 0 BEADLO C[C@H]([NH2+]Cc1ccon1)c1cccc(O)c1F ZINC000872040120 589859215 /nfs/dbraw/zinc/85/92/15/589859215.db2.gz KGDOJNHXQNWDMK-QMMMGPOBSA-N 1 2 236.246 2.370 20 0 BEADLO CCC[C@H]([NH2+]Cc1nonc1C)c1cccnc1 ZINC000872136783 589879152 /nfs/dbraw/zinc/87/91/52/589879152.db2.gz OXDVPXKHAGKMSX-LBPRGKRZSA-N 1 2 246.314 2.404 20 0 BEADLO CCn1ncc(N[C@H]2CCCn3cc[nH+]c32)c1C ZINC000872139310 589880135 /nfs/dbraw/zinc/88/01/35/589880135.db2.gz JFDQDMSIJXALOO-NSHDSACASA-N 1 2 245.330 2.355 20 0 BEADLO Cc1cc(NC[C@@H]2C[C@@H]3CCC[C@H]3O2)nc[nH+]1 ZINC000872694762 589962488 /nfs/dbraw/zinc/96/24/88/589962488.db2.gz AZOXPCFENMZHPX-SDDRHHMPSA-N 1 2 233.315 2.155 20 0 BEADLO c1ccc(NC[C@@H]2C[C@@H]3CCC[C@H]3O2)[nH+]c1 ZINC000872699877 589963062 /nfs/dbraw/zinc/96/30/62/589963062.db2.gz VJUYCHDSVDOBPM-SDDRHHMPSA-N 1 2 218.300 2.451 20 0 BEADLO Cc1cc(N[C@H](C)c2nccnc2C)nc[nH+]1 ZINC000872767685 589967000 /nfs/dbraw/zinc/96/70/00/589967000.db2.gz CBHYWCBZIYGGDN-SNVBAGLBSA-N 1 2 229.287 2.057 20 0 BEADLO c1cc2[nH+]ccc(N[C@@H]3CC34CCC4)c2cn1 ZINC000872775726 589968100 /nfs/dbraw/zinc/96/81/00/589968100.db2.gz XTJZVCDWCGIJOQ-CYBMUJFWSA-N 1 2 225.295 2.406 20 0 BEADLO CCC[C@H](CC)C(=O)O[C@H]1CC[N@H+](CCF)C1 ZINC000873525595 590054234 /nfs/dbraw/zinc/05/42/34/590054234.db2.gz XYEWHTNCCZYLOZ-RYUDHWBXSA-N 1 2 245.338 2.400 20 0 BEADLO CCC[C@H](CC)C(=O)O[C@H]1CC[N@@H+](CCF)C1 ZINC000873525595 590054237 /nfs/dbraw/zinc/05/42/37/590054237.db2.gz XYEWHTNCCZYLOZ-RYUDHWBXSA-N 1 2 245.338 2.400 20 0 BEADLO Cc1nc(CN[C@@H](C)c2[nH]cc[nH+]2)cs1 ZINC000124766375 590084420 /nfs/dbraw/zinc/08/44/20/590084420.db2.gz ZYINWGDFNDZGCP-ZETCQYMHSA-N 1 2 222.317 2.025 20 0 BEADLO CSC[C@H](C)[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000125236636 590157189 /nfs/dbraw/zinc/15/71/89/590157189.db2.gz YUFNAROYHHAZEY-IUCAKERBSA-N 1 2 233.377 2.058 20 0 BEADLO CSC[C@@H](C)[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000125236811 590157452 /nfs/dbraw/zinc/15/74/52/590157452.db2.gz YUFNAROYHHAZEY-BDAKNGLRSA-N 1 2 233.377 2.058 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CCCC3(CC3)C2)c[nH+]1 ZINC000888703031 590188755 /nfs/dbraw/zinc/18/87/55/590188755.db2.gz SQLTXJIULJYYON-SNVBAGLBSA-N 1 2 233.315 2.171 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H]2CCCC3(CC3)C2)c[nH+]1 ZINC000888703030 590189031 /nfs/dbraw/zinc/18/90/31/590189031.db2.gz SQLTXJIULJYYON-JTQLQIEISA-N 1 2 233.315 2.171 20 0 BEADLO CCC[C@@H](CC)C(=O)Nc1ccc(N)[nH+]c1 ZINC000876523502 590207870 /nfs/dbraw/zinc/20/78/70/590207870.db2.gz YFOHPHVCZGIYCD-SECBINFHSA-N 1 2 221.304 2.429 20 0 BEADLO CO[C@H]1CCC[N@H+](Cc2nc(Cl)cs2)C1 ZINC000876610244 590221625 /nfs/dbraw/zinc/22/16/25/590221625.db2.gz UFICABLIQVXZDQ-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO CO[C@H]1CCC[N@@H+](Cc2nc(Cl)cs2)C1 ZINC000876610244 590221626 /nfs/dbraw/zinc/22/16/26/590221626.db2.gz UFICABLIQVXZDQ-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1csc(C)c1C ZINC000876686321 590230790 /nfs/dbraw/zinc/23/07/90/590230790.db2.gz UXXTYFPBXRMRSE-UHFFFAOYSA-N 1 2 241.356 2.360 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1csc(C)c1C ZINC000876686321 590230791 /nfs/dbraw/zinc/23/07/91/590230791.db2.gz UXXTYFPBXRMRSE-UHFFFAOYSA-N 1 2 241.356 2.360 20 0 BEADLO COC[C@H]1CC[N@H+](Cc2nc(Cl)cs2)C1 ZINC000876724869 590233194 /nfs/dbraw/zinc/23/31/94/590233194.db2.gz AUINKJDDWBEUTP-QMMMGPOBSA-N 1 2 246.763 2.265 20 0 BEADLO COC[C@H]1CC[N@@H+](Cc2nc(Cl)cs2)C1 ZINC000876724869 590233196 /nfs/dbraw/zinc/23/31/96/590233196.db2.gz AUINKJDDWBEUTP-QMMMGPOBSA-N 1 2 246.763 2.265 20 0 BEADLO C[C@@H]1COCC[N@H+](Cc2nc(Cl)cs2)C1 ZINC000876752570 590238278 /nfs/dbraw/zinc/23/82/78/590238278.db2.gz TWHGFPIDJPTWKM-QMMMGPOBSA-N 1 2 246.763 2.265 20 0 BEADLO C[C@@H]1COCC[N@@H+](Cc2nc(Cl)cs2)C1 ZINC000876752570 590238279 /nfs/dbraw/zinc/23/82/79/590238279.db2.gz TWHGFPIDJPTWKM-QMMMGPOBSA-N 1 2 246.763 2.265 20 0 BEADLO CCCCC[C@H]([NH2+][C@H](C)[C@H](C)OC)C(=O)OC ZINC000877469327 590333804 /nfs/dbraw/zinc/33/38/04/590333804.db2.gz MYIKGSDCSHPABD-WOPDTQHZSA-N 1 2 245.363 2.121 20 0 BEADLO CC1C[NH+](Cc2cnc(Cl)c(F)c2)C1 ZINC000877487108 590338911 /nfs/dbraw/zinc/33/89/11/590338911.db2.gz CGEXKZRDBCARJZ-UHFFFAOYSA-N 1 2 214.671 2.326 20 0 BEADLO CC[C@H]1CC[N@@H+]1Cc1cc(OC)cnc1F ZINC000877547714 590354376 /nfs/dbraw/zinc/35/43/76/590354376.db2.gz HOGFTIDUFVSNQE-JTQLQIEISA-N 1 2 224.279 2.214 20 0 BEADLO CC[C@H]1CC[N@H+]1Cc1cc(OC)cnc1F ZINC000877547714 590354378 /nfs/dbraw/zinc/35/43/78/590354378.db2.gz HOGFTIDUFVSNQE-JTQLQIEISA-N 1 2 224.279 2.214 20 0 BEADLO COc1ncc(C[N@@H+]2CCC[C@](C)(F)C2)s1 ZINC000877557738 590358638 /nfs/dbraw/zinc/35/86/38/590358638.db2.gz PKMSASNNQZOZTO-NSHDSACASA-N 1 2 244.335 2.476 20 0 BEADLO COc1ncc(C[N@H+]2CCC[C@](C)(F)C2)s1 ZINC000877557738 590358640 /nfs/dbraw/zinc/35/86/40/590358640.db2.gz PKMSASNNQZOZTO-NSHDSACASA-N 1 2 244.335 2.476 20 0 BEADLO C[C@]1(F)CCC[N@H+](Cc2ccns2)C1 ZINC000877557950 590359275 /nfs/dbraw/zinc/35/92/75/590359275.db2.gz SGQABUYRIJSVOO-JTQLQIEISA-N 1 2 214.309 2.467 20 0 BEADLO C[C@]1(F)CCC[N@@H+](Cc2ccns2)C1 ZINC000877557950 590359278 /nfs/dbraw/zinc/35/92/78/590359278.db2.gz SGQABUYRIJSVOO-JTQLQIEISA-N 1 2 214.309 2.467 20 0 BEADLO COC1C[NH+](Cc2cc3ccccc3n2C)C1 ZINC000877580763 590365427 /nfs/dbraw/zinc/36/54/27/590365427.db2.gz YAGPNDFOJASYKT-UHFFFAOYSA-N 1 2 230.311 2.009 20 0 BEADLO Cc1ncc(C[NH2+]Cc2nc(Cl)cs2)o1 ZINC000877585779 590368003 /nfs/dbraw/zinc/36/80/03/590368003.db2.gz WOWUHSDPKFYPRC-UHFFFAOYSA-N 1 2 243.719 2.383 20 0 BEADLO FC(F)CC1C[NH+](Cc2ccc(Cl)nn2)C1 ZINC000877598519 590370966 /nfs/dbraw/zinc/37/09/66/590370966.db2.gz HCDTUYDIDFSOBJ-UHFFFAOYSA-N 1 2 247.676 2.217 20 0 BEADLO C[C@H]([NH2+]Cc1cc(C2CC2)no1)c1ccnn1C ZINC000877761958 590419371 /nfs/dbraw/zinc/41/93/71/590419371.db2.gz VIEIFFXEDGRNTG-VIFPVBQESA-N 1 2 246.314 2.136 20 0 BEADLO C[C@H]1CCC[C@@H](C2C[NH+](Cc3cnn(C)n3)C2)C1 ZINC000877763951 590420741 /nfs/dbraw/zinc/42/07/41/590420741.db2.gz OOXWWXIYLZSKDA-NWDGAFQWSA-N 1 2 248.374 2.073 20 0 BEADLO Cc1ccncc1C[NH+]1CC(OC(C)(C)C)C1 ZINC000877769608 590421661 /nfs/dbraw/zinc/42/16/61/590421661.db2.gz FXDBFOVEVJJBHX-UHFFFAOYSA-N 1 2 234.343 2.389 20 0 BEADLO COC[C@H](COc1cc[nH+]cc1)C(C)C ZINC000877880993 590436851 /nfs/dbraw/zinc/43/68/51/590436851.db2.gz BOZNVZOMORCXRK-LLVKDONJSA-N 1 2 209.289 2.379 20 0 BEADLO CO[C@H]1CCC[N@H+](Cc2scnc2Cl)C1 ZINC000878046922 590480907 /nfs/dbraw/zinc/48/09/07/590480907.db2.gz MDZONVWBADFHPB-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO CO[C@H]1CCC[N@@H+](Cc2scnc2Cl)C1 ZINC000878046922 590480909 /nfs/dbraw/zinc/48/09/09/590480909.db2.gz MDZONVWBADFHPB-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO COCC[N@H+](CCCC1CC1)CC(F)F ZINC000878052455 590484065 /nfs/dbraw/zinc/48/40/65/590484065.db2.gz SCSILTUGYLXIIN-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO COCC[N@@H+](CCCC1CC1)CC(F)F ZINC000878052455 590484066 /nfs/dbraw/zinc/48/40/66/590484066.db2.gz SCSILTUGYLXIIN-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO Cc1conc1C[N@H+](C)Cc1scnc1C ZINC000878089226 590490543 /nfs/dbraw/zinc/49/05/43/590490543.db2.gz CPBMCTOHYWFARN-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1conc1C[N@@H+](C)Cc1scnc1C ZINC000878089226 590490544 /nfs/dbraw/zinc/49/05/44/590490544.db2.gz CPBMCTOHYWFARN-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)C[C@@H]1CCCC(C)(C)O1 ZINC000878098327 590493070 /nfs/dbraw/zinc/49/30/70/590493070.db2.gz WRVXNZKARIOWNA-LBPRGKRZSA-N 1 2 237.347 2.189 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)C[C@@H]1CCCC(C)(C)O1 ZINC000878098327 590493072 /nfs/dbraw/zinc/49/30/72/590493072.db2.gz WRVXNZKARIOWNA-LBPRGKRZSA-N 1 2 237.347 2.189 20 0 BEADLO C=C/C=C/CC[N@@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000878123315 590500348 /nfs/dbraw/zinc/50/03/48/590500348.db2.gz WRBDUXPOLIDHMD-FSIBCCDJSA-N 1 2 235.249 2.382 20 0 BEADLO C=C/C=C/CC[N@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000878123315 590500352 /nfs/dbraw/zinc/50/03/52/590500352.db2.gz WRBDUXPOLIDHMD-FSIBCCDJSA-N 1 2 235.249 2.382 20 0 BEADLO Cc1conc1C[N@@H+]1CCc2ccc(O)cc2C1 ZINC000878252554 590529717 /nfs/dbraw/zinc/52/97/17/590529717.db2.gz OOVGWVWNELCRPL-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO Cc1conc1C[N@H+]1CCc2ccc(O)cc2C1 ZINC000878252554 590529720 /nfs/dbraw/zinc/52/97/20/590529720.db2.gz OOVGWVWNELCRPL-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCOCC[C@H]1C ZINC000878374601 590555308 /nfs/dbraw/zinc/55/53/08/590555308.db2.gz VFDLXMFVMOBRKW-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CCC(F)(F)C[N@H+]1CCOCC[C@H]1C ZINC000878374601 590555310 /nfs/dbraw/zinc/55/53/10/590555310.db2.gz VFDLXMFVMOBRKW-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO C[C@H]([NH2+]Cc1nc2c(o1)CCCC2)c1cn[nH]c1 ZINC000878426704 590565264 /nfs/dbraw/zinc/56/52/64/590565264.db2.gz NTDBUFYERXZNGR-VIFPVBQESA-N 1 2 246.314 2.127 20 0 BEADLO c1cnc2c(c1)C[N@@H+](C[C@H]1CCC3(CCC3)O1)C2 ZINC000878548781 590590869 /nfs/dbraw/zinc/59/08/69/590590869.db2.gz SRZUKYNCZAXVPP-CYBMUJFWSA-N 1 2 244.338 2.499 20 0 BEADLO c1cnc2c(c1)C[N@H+](C[C@H]1CCC3(CCC3)O1)C2 ZINC000878548781 590590870 /nfs/dbraw/zinc/59/08/70/590590870.db2.gz SRZUKYNCZAXVPP-CYBMUJFWSA-N 1 2 244.338 2.499 20 0 BEADLO CC1(C)CO[C@H](C[N@@H+]2Cc3ccncc3C2)C1 ZINC000878608931 590595651 /nfs/dbraw/zinc/59/56/51/590595651.db2.gz IHBRYICLBXAOFL-ZDUSSCGKSA-N 1 2 232.327 2.212 20 0 BEADLO CC1(C)CO[C@H](C[N@H+]2Cc3ccncc3C2)C1 ZINC000878608931 590595652 /nfs/dbraw/zinc/59/56/52/590595652.db2.gz IHBRYICLBXAOFL-ZDUSSCGKSA-N 1 2 232.327 2.212 20 0 BEADLO CO[C@H](C)C[N@H+](C)Cc1scnc1Cl ZINC000878613707 590596751 /nfs/dbraw/zinc/59/67/51/590596751.db2.gz VKLWKJUECJHOMV-SSDOTTSWSA-N 1 2 234.752 2.263 20 0 BEADLO CO[C@H](C)C[N@@H+](C)Cc1scnc1Cl ZINC000878613707 590596752 /nfs/dbraw/zinc/59/67/52/590596752.db2.gz VKLWKJUECJHOMV-SSDOTTSWSA-N 1 2 234.752 2.263 20 0 BEADLO FC1(F)C[C@@H]1OCC[N@@H+]1CCC=C(Cl)C1 ZINC000878790754 590622425 /nfs/dbraw/zinc/62/24/25/590622425.db2.gz UPDOHGDZPSNVKD-VIFPVBQESA-N 1 2 237.677 2.239 20 0 BEADLO FC1(F)C[C@@H]1OCC[N@H+]1CCC=C(Cl)C1 ZINC000878790754 590622426 /nfs/dbraw/zinc/62/24/26/590622426.db2.gz UPDOHGDZPSNVKD-VIFPVBQESA-N 1 2 237.677 2.239 20 0 BEADLO Cc1ncc(C[N@@H+]2CCC=C(Cl)C2)cn1 ZINC000878790205 590622498 /nfs/dbraw/zinc/62/24/98/590622498.db2.gz FNFIYENERYBSFZ-UHFFFAOYSA-N 1 2 223.707 2.113 20 0 BEADLO Cc1ncc(C[N@H+]2CCC=C(Cl)C2)cn1 ZINC000878790205 590622499 /nfs/dbraw/zinc/62/24/99/590622499.db2.gz FNFIYENERYBSFZ-UHFFFAOYSA-N 1 2 223.707 2.113 20 0 BEADLO CC[C@H](C)NC(=O)[C@H](C)[N@@H+]1CCC=C(Cl)C1 ZINC000878793113 590624231 /nfs/dbraw/zinc/62/42/31/590624231.db2.gz FPOMVXISGQLTSM-UWVGGRQHSA-N 1 2 244.766 2.118 20 0 BEADLO CC[C@H](C)NC(=O)[C@H](C)[N@H+]1CCC=C(Cl)C1 ZINC000878793113 590624232 /nfs/dbraw/zinc/62/42/32/590624232.db2.gz FPOMVXISGQLTSM-UWVGGRQHSA-N 1 2 244.766 2.118 20 0 BEADLO CC[C@H](C)NC(=O)[C@@H](C)[N@@H+]1CCC=C(Cl)C1 ZINC000878793114 590624480 /nfs/dbraw/zinc/62/44/80/590624480.db2.gz FPOMVXISGQLTSM-VHSXEESVSA-N 1 2 244.766 2.118 20 0 BEADLO CC[C@H](C)NC(=O)[C@@H](C)[N@H+]1CCC=C(Cl)C1 ZINC000878793114 590624481 /nfs/dbraw/zinc/62/44/81/590624481.db2.gz FPOMVXISGQLTSM-VHSXEESVSA-N 1 2 244.766 2.118 20 0 BEADLO Cc1oncc1C[N@H+](C)Cc1ccns1 ZINC000878900125 590642903 /nfs/dbraw/zinc/64/29/03/590642903.db2.gz WFTIATKPUHIZEI-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO Cc1oncc1C[N@@H+](C)Cc1ccns1 ZINC000878900125 590642907 /nfs/dbraw/zinc/64/29/07/590642907.db2.gz WFTIATKPUHIZEI-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO C[N@H+](C/C=C/Cl)Cc1ccns1 ZINC000878899513 590643284 /nfs/dbraw/zinc/64/32/84/590643284.db2.gz SDVNCZKKFPQJNZ-DUXPYHPUSA-N 1 2 202.710 2.327 20 0 BEADLO C[N@@H+](C/C=C/Cl)Cc1ccns1 ZINC000878899513 590643288 /nfs/dbraw/zinc/64/32/88/590643288.db2.gz SDVNCZKKFPQJNZ-DUXPYHPUSA-N 1 2 202.710 2.327 20 0 BEADLO Cc1conc1C[N@H+]1CC2(CCC2)OC[C@@H]1C ZINC000878918755 590652074 /nfs/dbraw/zinc/65/20/74/590652074.db2.gz WVDUCPACXRGOGB-NSHDSACASA-N 1 2 236.315 2.126 20 0 BEADLO Cc1conc1C[N@@H+]1CC2(CCC2)OC[C@@H]1C ZINC000878918755 590652077 /nfs/dbraw/zinc/65/20/77/590652077.db2.gz WVDUCPACXRGOGB-NSHDSACASA-N 1 2 236.315 2.126 20 0 BEADLO CO[C@@H]1C[N@H+](Cc2ccc(C3CC3)cc2)CCO1 ZINC000878968783 590662793 /nfs/dbraw/zinc/66/27/93/590662793.db2.gz AYKYPBKIHJKOIL-HNNXBMFYSA-N 1 2 247.338 2.369 20 0 BEADLO CO[C@@H]1C[N@@H+](Cc2ccc(C3CC3)cc2)CCO1 ZINC000878968783 590662797 /nfs/dbraw/zinc/66/27/97/590662797.db2.gz AYKYPBKIHJKOIL-HNNXBMFYSA-N 1 2 247.338 2.369 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2CC23CCC3)c(C)c[nH+]1 ZINC000879075866 590693000 /nfs/dbraw/zinc/69/30/00/590693000.db2.gz ROOXIPOWPCKCGZ-GFCCVEGCSA-N 1 2 245.326 2.184 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)C[C@@H]1C[C@@H]2CCC[C@@H]2O1 ZINC000879188244 590710049 /nfs/dbraw/zinc/71/00/49/590710049.db2.gz IQWITVIXKCRGLG-UBHSHLNASA-N 1 2 249.358 2.108 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)C[C@@H]1C[C@@H]2CCC[C@@H]2O1 ZINC000879188244 590710052 /nfs/dbraw/zinc/71/00/52/590710052.db2.gz IQWITVIXKCRGLG-UBHSHLNASA-N 1 2 249.358 2.108 20 0 BEADLO CO[C@H](CC(C)C)C[N@H+](C)Cc1cn[nH]c1C ZINC000879188655 590710807 /nfs/dbraw/zinc/71/08/07/590710807.db2.gz PHNQBPYJZPZSQL-CYBMUJFWSA-N 1 2 239.363 2.211 20 0 BEADLO CO[C@H](CC(C)C)C[N@@H+](C)Cc1cn[nH]c1C ZINC000879188655 590710809 /nfs/dbraw/zinc/71/08/09/590710809.db2.gz PHNQBPYJZPZSQL-CYBMUJFWSA-N 1 2 239.363 2.211 20 0 BEADLO CCC(F)(F)C[N@@H+]1C[C@@H](O)CC(C)(C)C1 ZINC000879624109 590838622 /nfs/dbraw/zinc/83/86/22/590838622.db2.gz MJQPJMIBBURKRT-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO CCC(F)(F)C[N@H+]1C[C@@H](O)CC(C)(C)C1 ZINC000879624109 590838625 /nfs/dbraw/zinc/83/86/25/590838625.db2.gz MJQPJMIBBURKRT-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO Cc1noc(C[N@@H+]2CC[C@@](C)(C(F)(F)F)C2)n1 ZINC000879999614 590903988 /nfs/dbraw/zinc/90/39/88/590903988.db2.gz GDZAESGFHUUEBI-SECBINFHSA-N 1 2 249.236 2.152 20 0 BEADLO Cc1noc(C[N@H+]2CC[C@@](C)(C(F)(F)F)C2)n1 ZINC000879999614 590903990 /nfs/dbraw/zinc/90/39/90/590903990.db2.gz GDZAESGFHUUEBI-SECBINFHSA-N 1 2 249.236 2.152 20 0 BEADLO CCCCOC(=O)[C@H](C)[NH+]1CCC(F)CC1 ZINC000880242059 590975312 /nfs/dbraw/zinc/97/53/12/590975312.db2.gz NMXDKOKRORZELH-JTQLQIEISA-N 1 2 231.311 2.152 20 0 BEADLO CCc1noc([C@H](C)[NH+]2CCC(F)CC2)n1 ZINC000880242805 590976483 /nfs/dbraw/zinc/97/64/83/590976483.db2.gz LQLNTQAIURBZCI-QMMMGPOBSA-N 1 2 227.283 2.127 20 0 BEADLO c1ccc(C[NH2+]C2(c3ncccn3)CCC2)nc1 ZINC000880365475 591010590 /nfs/dbraw/zinc/01/05/90/591010590.db2.gz MJFPSYLZMOAUCP-UHFFFAOYSA-N 1 2 240.310 2.041 20 0 BEADLO C[C@@H]1c2sccc2CC[N@H+]1Cc1cnon1 ZINC000880376062 591015418 /nfs/dbraw/zinc/01/54/18/591015418.db2.gz CMXMCQXVYSAWIS-MRVPVSSYSA-N 1 2 235.312 2.250 20 0 BEADLO C[C@@H]1c2sccc2CC[N@@H+]1Cc1cnon1 ZINC000880376062 591015420 /nfs/dbraw/zinc/01/54/20/591015420.db2.gz CMXMCQXVYSAWIS-MRVPVSSYSA-N 1 2 235.312 2.250 20 0 BEADLO CC(=O)CC[N@@H+]1CCc2cc(F)c(F)cc2C1 ZINC000880448817 591047581 /nfs/dbraw/zinc/04/75/81/591047581.db2.gz VKXKQUMYRJECBO-UHFFFAOYSA-N 1 2 239.265 2.302 20 0 BEADLO CC(=O)CC[N@H+]1CCc2cc(F)c(F)cc2C1 ZINC000880448817 591047582 /nfs/dbraw/zinc/04/75/82/591047582.db2.gz VKXKQUMYRJECBO-UHFFFAOYSA-N 1 2 239.265 2.302 20 0 BEADLO OC[C@H]1C=CC[N@@H+]1Cc1cccc(Cl)c1F ZINC000880490830 591067924 /nfs/dbraw/zinc/06/79/24/591067924.db2.gz DRTTYKJZYKPXFS-SNVBAGLBSA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@H]1C=CC[N@H+]1Cc1cccc(Cl)c1F ZINC000880490830 591067933 /nfs/dbraw/zinc/06/79/33/591067933.db2.gz DRTTYKJZYKPXFS-SNVBAGLBSA-N 1 2 241.693 2.212 20 0 BEADLO C[C@@H](NC(=O)C[C@@H]1C[C@H]1C1CC1)c1[nH+]ccn1C ZINC000880722152 591127196 /nfs/dbraw/zinc/12/71/96/591127196.db2.gz IBBCRJNJBJMYDO-USWWRNFRSA-N 1 2 247.342 2.034 20 0 BEADLO O=C(NC[C@H]1C=CCC1)c1cccc2[nH+]ccn21 ZINC000881495820 591218606 /nfs/dbraw/zinc/21/86/06/591218606.db2.gz ORAMJWVAVBTXBY-NSHDSACASA-N 1 2 241.294 2.030 20 0 BEADLO CCC[C@H](C)CCNC(=O)CCn1cc[nH+]c1 ZINC000881528932 591229942 /nfs/dbraw/zinc/22/99/42/591229942.db2.gz IMGMBYIPSPUTOG-LBPRGKRZSA-N 1 2 237.347 2.216 20 0 BEADLO C=C/C=C\CCNC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000881570941 591244949 /nfs/dbraw/zinc/24/49/49/591244949.db2.gz WVABXIVXHZXKJO-RXNFCKPNSA-N 1 2 233.315 2.083 20 0 BEADLO Cc1noc(C)c1CN(C)c1nc[nH+]c(C)c1C ZINC000881797700 591271976 /nfs/dbraw/zinc/27/19/76/591271976.db2.gz UJIXQUMSQZTREU-UHFFFAOYSA-N 1 2 246.314 2.335 20 0 BEADLO Cc1[nH+]cnc(N2CCCSCC2)c1C ZINC000881813149 591273347 /nfs/dbraw/zinc/27/33/47/591273347.db2.gz VFHUHYPHZQNAQV-UHFFFAOYSA-N 1 2 223.345 2.037 20 0 BEADLO CC[C@H](C)[C@](C)(O)CNc1nc[nH+]c(C)c1C ZINC000881978072 591284884 /nfs/dbraw/zinc/28/48/84/591284884.db2.gz XNLNNJLOACZUEJ-TVQRCGJNSA-N 1 2 237.347 2.302 20 0 BEADLO CCC(CC)[C@H](O)CNc1nc[nH+]c(C)c1C ZINC000881969009 591284903 /nfs/dbraw/zinc/28/49/03/591284903.db2.gz AUFPDXKYTBICQP-GFCCVEGCSA-N 1 2 237.347 2.302 20 0 BEADLO Cc1[nH+]cnc(NCC(C)(C)C[C@H](C)O)c1C ZINC000882016428 591287985 /nfs/dbraw/zinc/28/79/85/591287985.db2.gz NRWNEMAFWGQDSS-VIFPVBQESA-N 1 2 237.347 2.302 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2CCSC2)c1C ZINC000882029367 591288947 /nfs/dbraw/zinc/28/89/47/591288947.db2.gz DKKXFQFBWUSMNT-SECBINFHSA-N 1 2 209.318 2.011 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2CCOC(C)(C)C2)c1C ZINC000882131450 591303766 /nfs/dbraw/zinc/30/37/66/591303766.db2.gz GNOXTUHLRBZOPV-LLVKDONJSA-N 1 2 235.331 2.463 20 0 BEADLO C[C@@H]1CSC(SCc2cn(C)c[nH+]2)=N1 ZINC000882149609 591306298 /nfs/dbraw/zinc/30/62/98/591306298.db2.gz GQBMRKMBDUFEFZ-SSDOTTSWSA-N 1 2 227.358 2.145 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2CCO[C@H](C)C2)c1C ZINC000882154341 591307718 /nfs/dbraw/zinc/30/77/18/591307718.db2.gz YKEDERMAPFIFBA-LDYMZIIASA-N 1 2 221.304 2.073 20 0 BEADLO Cc1[nH+]cnc(NCCc2ccc[nH]2)c1C ZINC000882157429 591308594 /nfs/dbraw/zinc/30/85/94/591308594.db2.gz WUGXWGDXAVJUHZ-UHFFFAOYSA-N 1 2 216.288 2.076 20 0 BEADLO CO[C@@H]1CCC[C@@H]1CNc1nc[nH+]c(C)c1C ZINC000882159552 591308954 /nfs/dbraw/zinc/30/89/54/591308954.db2.gz CBBKHKCWOPUHPT-VXGBXAGGSA-N 1 2 235.331 2.320 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2CCCOCC2)c1C ZINC000882163690 591309688 /nfs/dbraw/zinc/30/96/88/591309688.db2.gz ZXUBCLXUDFBZAV-LLVKDONJSA-N 1 2 221.304 2.074 20 0 BEADLO CSCCCN(C)c1nc[nH+]c(C)c1C ZINC000882309303 591328114 /nfs/dbraw/zinc/32/81/14/591328114.db2.gz BNYGJOMZGQNZOX-UHFFFAOYSA-N 1 2 225.361 2.283 20 0 BEADLO c1cn2c([nH+]1)[C@@H](Nc1cc(C3CC3)ncn1)CC2 ZINC000882407210 591344005 /nfs/dbraw/zinc/34/40/05/591344005.db2.gz IGNHAIAKIBYSLY-JTQLQIEISA-N 1 2 241.298 2.107 20 0 BEADLO COC[C@@H]1CCCN(c2nc[nH+]c(C)c2C)CC1 ZINC000882435165 591348723 /nfs/dbraw/zinc/34/87/23/591348723.db2.gz XQXWQGOLHMKHBE-CYBMUJFWSA-N 1 2 249.358 2.346 20 0 BEADLO Cc1[nH+]cnc(N2CC[C@]3(CC3(F)F)C2)c1C ZINC000882532137 591382975 /nfs/dbraw/zinc/38/29/75/591382975.db2.gz GEDMKUAIADNGNY-NSHDSACASA-N 1 2 239.269 2.329 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2CCC[C@@H](C)O2)c1C ZINC000882620674 591401198 /nfs/dbraw/zinc/40/11/98/591401198.db2.gz RLOUKODRNWXBNA-SKDRFNHKSA-N 1 2 235.331 2.463 20 0 BEADLO Cc1[nH+]cnc(N2CC(CC3CC3)C2)c1C ZINC000882645242 591406066 /nfs/dbraw/zinc/40/60/66/591406066.db2.gz NHRZKHVQBVKFLK-UHFFFAOYSA-N 1 2 217.316 2.330 20 0 BEADLO CO[C@H]1CC[C@@H](C)N(c2cc[nH+]cc2F)C1 ZINC000882683016 591411026 /nfs/dbraw/zinc/41/10/26/591411026.db2.gz PAEIUDDNRDSNIO-ZJUUUORDSA-N 1 2 224.279 2.224 20 0 BEADLO CO[C@@H]1CC[C@@H](C)N(c2cc[nH+]cc2F)C1 ZINC000882683013 591411180 /nfs/dbraw/zinc/41/11/80/591411180.db2.gz PAEIUDDNRDSNIO-NXEZZACHSA-N 1 2 224.279 2.224 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2C[C@@H](C)O[C@H]2C)c1C ZINC000882682124 591411344 /nfs/dbraw/zinc/41/13/44/591411344.db2.gz VSQHNKAVGUAJBX-PPKCKEKNSA-N 1 2 221.304 2.071 20 0 BEADLO CC[C@H](C[C@H](C)O)Nc1nc[nH+]c(C)c1C ZINC000882708240 591415998 /nfs/dbraw/zinc/41/59/98/591415998.db2.gz WKDHUVVTJQUAQZ-GZMMTYOYSA-N 1 2 223.320 2.055 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2C[C@@H]3CCC[C@@H]3O2)c1C ZINC000882715000 591417627 /nfs/dbraw/zinc/41/76/27/591417627.db2.gz GODIJULETMSRAO-AVGNSLFASA-N 1 2 247.342 2.463 20 0 BEADLO C1=C[C@H](CNc2cc[nH+]c3ccncc23)CC1 ZINC000882758171 591431797 /nfs/dbraw/zinc/43/17/97/591431797.db2.gz XNTYCVBQYGJXGF-NSHDSACASA-N 1 2 225.295 2.430 20 0 BEADLO Nc1nc(N2CCC(F)CC2)[nH+]c2ccccc12 ZINC000882806627 591445895 /nfs/dbraw/zinc/44/58/95/591445895.db2.gz JOUCQPPJBZSGFP-UHFFFAOYSA-N 1 2 246.289 2.150 20 0 BEADLO OCc1cc[nH+]c(N[C@@H]2CCC[C@]23CCCO3)c1 ZINC000882982386 591492666 /nfs/dbraw/zinc/49/26/66/591492666.db2.gz KEIBAPLKAGSAFQ-OCCSQVGLSA-N 1 2 248.326 2.088 20 0 BEADLO NC(CO)=[NH+]OCc1ccc(C2CCCC2)cc1 ZINC000883012937 591512160 /nfs/dbraw/zinc/51/21/60/591512160.db2.gz ZARPDRGKWWFPSW-UHFFFAOYSA-N 1 2 248.326 2.335 20 0 BEADLO CSc1ccc(C[NH2+]Cc2ccon2)o1 ZINC000883028035 591519451 /nfs/dbraw/zinc/51/94/51/591519451.db2.gz YGOOPPOYVOEHBE-UHFFFAOYSA-N 1 2 224.285 2.279 20 0 BEADLO Cc1ccccc1C(N)=[NH+]O[C@H]1COC(C)(C)C1 ZINC000883059181 591531323 /nfs/dbraw/zinc/53/13/23/591531323.db2.gz OAGOBZPYAGGEMI-LLVKDONJSA-N 1 2 248.326 2.409 20 0 BEADLO CC(C)c1c[nH]c(C[NH2+]Cc2cccc(F)n2)n1 ZINC000883073130 591535386 /nfs/dbraw/zinc/53/53/86/591535386.db2.gz HUEDLZDDPCTNDR-UHFFFAOYSA-N 1 2 248.305 2.357 20 0 BEADLO CC(C)c1c[nH]c(CNc2cc(CO)cc[nH+]2)n1 ZINC000883147836 591552127 /nfs/dbraw/zinc/55/21/27/591552127.db2.gz KOPUTKDCIJLRGS-UHFFFAOYSA-N 1 2 246.314 2.033 20 0 BEADLO C[C@@H](O)c1ccc(-c2[nH+]ccn2C)cc1 ZINC000214362485 591554170 /nfs/dbraw/zinc/55/41/70/591554170.db2.gz ZFTMXARSZXZHGT-SECBINFHSA-N 1 2 202.257 2.140 20 0 BEADLO Cc1n[nH]cc1CNc1c[nH+]c(C)c(C)c1 ZINC000883342330 591621693 /nfs/dbraw/zinc/62/16/93/591621693.db2.gz SSYRIDIYAXJZGC-UHFFFAOYSA-N 1 2 216.288 2.342 20 0 BEADLO Cc1cc(NCc2ccc(CO)o2)c[nH+]c1C ZINC000883342019 591621734 /nfs/dbraw/zinc/62/17/34/591621734.db2.gz HTCWSLMPFAKLBX-UHFFFAOYSA-N 1 2 232.283 2.396 20 0 BEADLO Cc1cc(NCc2cnc(N)s2)c[nH+]c1C ZINC000883342047 591622345 /nfs/dbraw/zinc/62/23/45/591622345.db2.gz IVRDVBPMLMIZGF-UHFFFAOYSA-N 1 2 234.328 2.349 20 0 BEADLO C[C@@H]1C[C@H]([NH3+])C[N@@H+]1CC[C@H]1CCCC1(F)F ZINC000883438483 591667675 /nfs/dbraw/zinc/66/76/75/591667675.db2.gz UIVHTCINBGANIO-MXWKQRLJSA-N 1 2 232.318 2.233 20 0 BEADLO Cc1cccc([C@@H](C)C(=O)NC2=[NH+]CCS2)c1 ZINC000132859860 591743195 /nfs/dbraw/zinc/74/31/95/591743195.db2.gz SAXBAMHPLALTFM-SNVBAGLBSA-N 1 2 248.351 2.318 20 0 BEADLO C[C@H]1CCN(C(=O)N2CCC[C@H]2c2[nH]cc[nH+]2)C1 ZINC000800105974 591823991 /nfs/dbraw/zinc/82/39/91/591823991.db2.gz ZDZZGHJIPOEFJA-QWRGUYRKSA-N 1 2 248.330 2.008 20 0 BEADLO CCc1nc(N2CCS[C@@H](C)CC2)cc[nH+]1 ZINC000884485717 591954437 /nfs/dbraw/zinc/95/44/37/591954437.db2.gz FNMZRDKMKIXHCS-JTQLQIEISA-N 1 2 237.372 2.371 20 0 BEADLO CCc1nc(N2CCCC[C@@H]2C[C@H](C)O)cc[nH+]1 ZINC000884490982 591955054 /nfs/dbraw/zinc/95/50/54/591955054.db2.gz KPLIFPXMZHHNQZ-NWDGAFQWSA-N 1 2 249.358 2.169 20 0 BEADLO CCc1nc(N2CCCO[C@H](CC)C2)cc[nH+]1 ZINC000884496560 591956510 /nfs/dbraw/zinc/95/65/10/591956510.db2.gz ZUXJCOCSEXPYSW-LLVKDONJSA-N 1 2 235.331 2.044 20 0 BEADLO CCc1nc(N(C)CCCSC)cc[nH+]1 ZINC000884495874 591957056 /nfs/dbraw/zinc/95/70/56/591957056.db2.gz GTWSLEKTNBZDDZ-UHFFFAOYSA-N 1 2 225.361 2.228 20 0 BEADLO CCc1nc(N2CC[C@]3(C2)CCCOC3)cc[nH+]1 ZINC000884500193 591958189 /nfs/dbraw/zinc/95/81/89/591958189.db2.gz ZBHCKPNPEHJIPR-AWEZNQCLSA-N 1 2 247.342 2.046 20 0 BEADLO CCc1nc(NC[C@H]2CCOC[C@@H]2C)cc[nH+]1 ZINC000884506775 591960387 /nfs/dbraw/zinc/96/03/87/591960387.db2.gz MRBCZDVQGGIYPJ-WDEREUQCSA-N 1 2 235.331 2.124 20 0 BEADLO CCc1nc(NC[C@@H]2CCOC[C@@H]2C)cc[nH+]1 ZINC000884506774 591960486 /nfs/dbraw/zinc/96/04/86/591960486.db2.gz MRBCZDVQGGIYPJ-QWRGUYRKSA-N 1 2 235.331 2.124 20 0 BEADLO CCc1nc(NC[C@@](C)(OC)C2CC2)cc[nH+]1 ZINC000884513074 591961988 /nfs/dbraw/zinc/96/19/88/591961988.db2.gz YOIRORLZQPTTRA-CYBMUJFWSA-N 1 2 235.331 2.266 20 0 BEADLO CCc1nc(NC[C@]2(O)CCC[C@H]2C)cc[nH+]1 ZINC000884516182 591963070 /nfs/dbraw/zinc/96/30/70/591963070.db2.gz DPRSKHMAOMKWNC-ZWNOBZJWSA-N 1 2 235.331 2.002 20 0 BEADLO CCc1nc(CNc2cc[nH+]c(CC)n2)co1 ZINC000884522669 591965558 /nfs/dbraw/zinc/96/55/58/591965558.db2.gz DXHRASBCWCRRIZ-UHFFFAOYSA-N 1 2 232.287 2.202 20 0 BEADLO CCc1nc(N[C@H](C)c2cnn(CC)c2)cc[nH+]1 ZINC000884524197 591965752 /nfs/dbraw/zinc/96/57/52/591965752.db2.gz RDUJPXWVMDCMEH-SNVBAGLBSA-N 1 2 245.330 2.429 20 0 BEADLO CCc1nc(NC[C@@H]2C[C@H]2C2CC2)cc[nH+]1 ZINC000884525549 591965771 /nfs/dbraw/zinc/96/57/71/591965771.db2.gz XVHOZZABYSXDDX-QWRGUYRKSA-N 1 2 217.316 2.497 20 0 BEADLO CCc1nc(NC[C@H]2CC[C@@H](C)O2)cc[nH+]1 ZINC000884527008 591966785 /nfs/dbraw/zinc/96/67/85/591966785.db2.gz HVCFJIHIHIHLQC-NXEZZACHSA-N 1 2 221.304 2.018 20 0 BEADLO CCc1nc(N2CCO[C@@H](C3CCC3)C2)cc[nH+]1 ZINC000884529874 591967702 /nfs/dbraw/zinc/96/77/02/591967702.db2.gz YIWCNMFVZONPJZ-GFCCVEGCSA-N 1 2 247.342 2.044 20 0 BEADLO CCc1nc(N[C@H](C)c2csnn2)cc[nH+]1 ZINC000884531840 591968660 /nfs/dbraw/zinc/96/86/60/591968660.db2.gz WRONPRYYWKLTTI-SSDOTTSWSA-N 1 2 235.316 2.064 20 0 BEADLO CCc1nc(N[C@H]2CCO[C@@H](CC)C2)cc[nH+]1 ZINC000884533601 591969507 /nfs/dbraw/zinc/96/95/07/591969507.db2.gz NEHUSSPMQCMKMF-QWRGUYRKSA-N 1 2 235.331 2.409 20 0 BEADLO CCc1nc(N[C@H]2CCO[C@H](CC)C2)cc[nH+]1 ZINC000884533602 591969934 /nfs/dbraw/zinc/96/99/34/591969934.db2.gz NEHUSSPMQCMKMF-WDEREUQCSA-N 1 2 235.331 2.409 20 0 BEADLO CCC[C@@H](C)[C@H](CO)Nc1cc[nH+]c(CC)n1 ZINC000884544770 591973209 /nfs/dbraw/zinc/97/32/09/591973209.db2.gz PCBZIWUKONSHQL-MNOVXSKESA-N 1 2 237.347 2.248 20 0 BEADLO CCc1nc(N2C[C@@H](CC)OC[C@H]2C)cc[nH+]1 ZINC000884544585 591973221 /nfs/dbraw/zinc/97/32/21/591973221.db2.gz KPFJYHVQKIBFIW-GHMZBOCLSA-N 1 2 235.331 2.043 20 0 BEADLO CCc1nc(N[C@@H]2CCS[C@@H]2C)cc[nH+]1 ZINC000884544001 591973616 /nfs/dbraw/zinc/97/36/16/591973616.db2.gz SYSJTQRLBHWLCD-RKDXNWHRSA-N 1 2 223.345 2.345 20 0 BEADLO CCc1nc(N2CCC[C@@H](OC(C)C)C2)cc[nH+]1 ZINC000884544988 591974692 /nfs/dbraw/zinc/97/46/92/591974692.db2.gz WAANSZDNXLDULY-GFCCVEGCSA-N 1 2 249.358 2.433 20 0 BEADLO CCc1nc(N2CC[C@@]3(CC3(F)F)C2)cc[nH+]1 ZINC000884546671 591975200 /nfs/dbraw/zinc/97/52/00/591975200.db2.gz QWWZXLMJXJXQGT-LLVKDONJSA-N 1 2 239.269 2.275 20 0 BEADLO CCc1nc(NC[C@@]2(C)CC2(F)F)cc[nH+]1 ZINC000884556950 591978114 /nfs/dbraw/zinc/97/81/14/591978114.db2.gz DFJJVAGYULHCHF-SNVBAGLBSA-N 1 2 227.258 2.496 20 0 BEADLO CCc1nc(N[C@H]2COC3(CCC3)C2)cc[nH+]1 ZINC000884555942 591978197 /nfs/dbraw/zinc/97/81/97/591978197.db2.gz DRXSPECHVQMODS-SNVBAGLBSA-N 1 2 233.315 2.163 20 0 BEADLO CCc1nc(NC[C@H]2CCOC2(C)C)cc[nH+]1 ZINC000884560385 591980667 /nfs/dbraw/zinc/98/06/67/591980667.db2.gz WOPYBRMCLUAMLZ-SNVBAGLBSA-N 1 2 235.331 2.266 20 0 BEADLO CCc1nc(N2CCC(=O)CC(C)(C)C2)cc[nH+]1 ZINC000884564207 591982679 /nfs/dbraw/zinc/98/26/79/591982679.db2.gz AFEOGNTUPRDDCH-UHFFFAOYSA-N 1 2 247.342 2.235 20 0 BEADLO CCc1nc(N[C@@H]2CC(C)(C)CC[C@H]2O)cc[nH+]1 ZINC000884570033 591983253 /nfs/dbraw/zinc/98/32/53/591983253.db2.gz FKZCFYNCAUZHNV-GHMZBOCLSA-N 1 2 249.358 2.391 20 0 BEADLO CCc1nc(N2C[C@H](OC)CC[C@H]2C)cc[nH+]1 ZINC000884571022 591984125 /nfs/dbraw/zinc/98/41/25/591984125.db2.gz FJROHGYONPDMBA-GHMZBOCLSA-N 1 2 235.331 2.043 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2CC3(CCC3)CO2)c1C ZINC000884659738 592006411 /nfs/dbraw/zinc/00/64/11/592006411.db2.gz CFOJKQPDPWFJFA-LBPRGKRZSA-N 1 2 247.342 2.465 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@H]([C@@H]2CCCO2)C1 ZINC000884743421 592016365 /nfs/dbraw/zinc/01/63/65/592016365.db2.gz YJMAHUZLBIJASC-GWCFXTLKSA-N 1 2 236.290 2.226 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)/C=C\c1cccs1 ZINC000216418208 592030686 /nfs/dbraw/zinc/03/06/86/592030686.db2.gz DPAOEKXTPAUJRE-PLNGDYQASA-N 1 2 247.323 2.143 20 0 BEADLO C[N@H+](CCOC1CCCCC1)Cc1ccon1 ZINC000886018567 592131933 /nfs/dbraw/zinc/13/19/33/592131933.db2.gz CODKUUSNURCBTH-UHFFFAOYSA-N 1 2 238.331 2.456 20 0 BEADLO C[N@@H+](CCOC1CCCCC1)Cc1ccon1 ZINC000886018567 592131935 /nfs/dbraw/zinc/13/19/35/592131935.db2.gz CODKUUSNURCBTH-UHFFFAOYSA-N 1 2 238.331 2.456 20 0 BEADLO COc1cc[nH+]cc1NCc1[nH]nc(C)c1C ZINC000886041932 592139177 /nfs/dbraw/zinc/13/91/77/592139177.db2.gz SLMHUEOHPQFNKU-UHFFFAOYSA-N 1 2 232.287 2.042 20 0 BEADLO OCC(F)(F)C[NH2+]C/C=C\c1cccc(F)c1 ZINC000886068042 592143072 /nfs/dbraw/zinc/14/30/72/592143072.db2.gz REFDSSDVBZSSJI-RQOWECAXSA-N 1 2 245.244 2.056 20 0 BEADLO Clc1ccc(C[NH2+][C@@H]2CCn3ccnc32)nc1 ZINC000886130223 592159481 /nfs/dbraw/zinc/15/94/81/592159481.db2.gz YXAFWAFHIPVZGF-LLVKDONJSA-N 1 2 248.717 2.166 20 0 BEADLO c1cc2c(cn1)C[N@H+](C[C@H]1CC[C@H](C3CC3)O1)C2 ZINC000886203526 592175525 /nfs/dbraw/zinc/17/55/25/592175525.db2.gz XEILHSZPURKDRN-HUUCEWRRSA-N 1 2 244.338 2.355 20 0 BEADLO c1cc2c(cn1)C[N@@H+](C[C@H]1CC[C@H](C3CC3)O1)C2 ZINC000886203526 592175527 /nfs/dbraw/zinc/17/55/27/592175527.db2.gz XEILHSZPURKDRN-HUUCEWRRSA-N 1 2 244.338 2.355 20 0 BEADLO Cc1ncc(C[NH2+][C@H](C)c2ccn(C)n2)s1 ZINC000886243177 592183822 /nfs/dbraw/zinc/18/38/22/592183822.db2.gz QGDCKCGQXYRYGV-MRVPVSSYSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1ccncc1C[NH2+][C@@H](C)c1ncco1 ZINC000886272401 592192786 /nfs/dbraw/zinc/19/27/86/592192786.db2.gz ORNQKHMKTOFTHX-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO O[C@H]1CC[N@H+](CC[C@@H]2C[C@H]2C2CC2)CC1(F)F ZINC000886277610 592196061 /nfs/dbraw/zinc/19/60/61/592196061.db2.gz WOKYHBAVYSFIPC-WOPDTQHZSA-N 1 2 245.313 2.125 20 0 BEADLO O[C@H]1CC[N@@H+](CC[C@@H]2C[C@H]2C2CC2)CC1(F)F ZINC000886277610 592196064 /nfs/dbraw/zinc/19/60/64/592196064.db2.gz WOKYHBAVYSFIPC-WOPDTQHZSA-N 1 2 245.313 2.125 20 0 BEADLO CCOC(=O)C[NH2+][C@H](Cc1ccccc1)C(C)C ZINC000886422580 592224323 /nfs/dbraw/zinc/22/43/23/592224323.db2.gz SNCMTAQFUNDXQE-CQSZACIVSA-N 1 2 249.354 2.406 20 0 BEADLO Fc1cccnc1C[NH2+][C@@H]1CCc2cccnc21 ZINC000886555559 592259164 /nfs/dbraw/zinc/25/91/64/592259164.db2.gz WDUBTEVRUIFLRB-GFCCVEGCSA-N 1 2 243.285 2.393 20 0 BEADLO COC(=O)[C@H]1CC[C@@H](Nc2ccc[nH+]c2C)C1 ZINC000886578442 592267045 /nfs/dbraw/zinc/26/70/45/592267045.db2.gz XDHVJTNBDIBBIV-WDEREUQCSA-N 1 2 234.299 2.144 20 0 BEADLO COC(=O)[C@H]1CC[C@@H](Nc2ccc(C)[nH+]c2C)C1 ZINC000886578407 592267423 /nfs/dbraw/zinc/26/74/23/592267423.db2.gz VBBBYJVUJQVDBS-NWDGAFQWSA-N 1 2 248.326 2.452 20 0 BEADLO CC[C@H](C)CC(=O)N1CCc2c([nH+]cn2CC)C1 ZINC000886614745 592275290 /nfs/dbraw/zinc/27/52/90/592275290.db2.gz IWMFKZUQBGZKGW-NSHDSACASA-N 1 2 249.358 2.224 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCc2cccnc21)c1ccn(C)n1 ZINC000886625719 592280980 /nfs/dbraw/zinc/28/09/80/592280980.db2.gz YJCQEAJGRMXHIY-ZWNOBZJWSA-N 1 2 242.326 2.153 20 0 BEADLO CC(C)(C)C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000075552495 592312779 /nfs/dbraw/zinc/31/27/79/592312779.db2.gz YZSZTNOVGYYXCP-SNVBAGLBSA-N 1 2 235.331 2.162 20 0 BEADLO Fc1cccc2c1CC[C@H]2[NH2+]Cc1cnsn1 ZINC000886928667 592397544 /nfs/dbraw/zinc/39/75/44/592397544.db2.gz JNRWJVYAGDTVGB-GFCCVEGCSA-N 1 2 249.314 2.454 20 0 BEADLO COC(=O)[C@H]1CSCC[N@@H+]1CCCC(C)C ZINC000887077437 592435824 /nfs/dbraw/zinc/43/58/24/592435824.db2.gz MBRYYFKRESIXJO-LLVKDONJSA-N 1 2 245.388 2.013 20 0 BEADLO COC(=O)[C@H]1CSCC[N@H+]1CCCC(C)C ZINC000887077437 592435826 /nfs/dbraw/zinc/43/58/26/592435826.db2.gz MBRYYFKRESIXJO-LLVKDONJSA-N 1 2 245.388 2.013 20 0 BEADLO FC(F)C[N@H+](C[C@@H]1CCCO1)C1CCC1 ZINC000887098868 592441645 /nfs/dbraw/zinc/44/16/45/592441645.db2.gz FNXJVBAXRTZKPC-JTQLQIEISA-N 1 2 219.275 2.285 20 0 BEADLO FC(F)C[N@@H+](C[C@@H]1CCCO1)C1CCC1 ZINC000887098868 592441647 /nfs/dbraw/zinc/44/16/47/592441647.db2.gz FNXJVBAXRTZKPC-JTQLQIEISA-N 1 2 219.275 2.285 20 0 BEADLO C=C=CCNC(=O)Nc1ccc(C)[nH+]c1C ZINC000887878418 592555815 /nfs/dbraw/zinc/55/58/15/592555815.db2.gz DHPXSXXGKPNOKW-UHFFFAOYSA-N 1 2 217.272 2.161 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N1CC[C@@H]1C1CCCC1 ZINC000889407127 592609425 /nfs/dbraw/zinc/60/94/25/592609425.db2.gz JTBWYJJITJXQJM-GFCCVEGCSA-N 1 2 247.342 2.133 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)NC[C@H]1CCC=CCCC1 ZINC000890044717 592671013 /nfs/dbraw/zinc/67/10/13/592671013.db2.gz GQFZSOXDCGHJHG-LBPRGKRZSA-N 1 2 247.342 2.205 20 0 BEADLO Cn1c[nH+]c(CNC(=O)CC2CCCCCC2)c1 ZINC000890109412 592682785 /nfs/dbraw/zinc/68/27/85/592682785.db2.gz BBXZQRQYHFGZIF-UHFFFAOYSA-N 1 2 249.358 2.397 20 0 BEADLO CCCC1(C(=O)NCc2cn(C)c[nH+]2)CCC1 ZINC000890109755 592684263 /nfs/dbraw/zinc/68/42/63/592684263.db2.gz GACFLAVHWJBSQI-UHFFFAOYSA-N 1 2 235.331 2.007 20 0 BEADLO Cc1cc(C(=O)NCc2cn(C)c[nH+]2)sc1C ZINC000890117568 592685640 /nfs/dbraw/zinc/68/56/40/592685640.db2.gz QDUUATMGBGETHQ-UHFFFAOYSA-N 1 2 249.339 2.028 20 0 BEADLO CCCC[C@@H](CC)C(=O)NCc1cn(C)c[nH+]1 ZINC000890117380 592685911 /nfs/dbraw/zinc/68/59/11/592685911.db2.gz PTAZZAKDPUQKEQ-LLVKDONJSA-N 1 2 237.347 2.253 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1C[C@@H](C)CO1 ZINC000890492714 592702842 /nfs/dbraw/zinc/70/28/42/592702842.db2.gz PSFDQPYPVRHXIX-KCJUWKMLSA-N 1 2 234.299 2.062 20 0 BEADLO C[N@H+](CCSC(F)(F)F)Cc1cc[nH]n1 ZINC000687803735 985385055 /nfs/dbraw/zinc/38/50/55/985385055.db2.gz NDWFZPQZXXSIBD-UHFFFAOYSA-N 1 2 239.266 2.095 20 0 BEADLO C[N@@H+](CCSC(F)(F)F)Cc1cc[nH]n1 ZINC000687803735 985385065 /nfs/dbraw/zinc/38/50/65/985385065.db2.gz NDWFZPQZXXSIBD-UHFFFAOYSA-N 1 2 239.266 2.095 20 0 BEADLO CCc1ncc(C[N@H+]2Cc3c[nH]nc3[C@H](C)C2)o1 ZINC000931467706 634465052 /nfs/dbraw/zinc/46/50/52/634465052.db2.gz QPTKBVKKTXNNAR-SECBINFHSA-N 1 2 246.314 2.079 20 0 BEADLO CCc1ncc(C[N@@H+]2Cc3c[nH]nc3[C@H](C)C2)o1 ZINC000931467706 634465055 /nfs/dbraw/zinc/46/50/55/634465055.db2.gz QPTKBVKKTXNNAR-SECBINFHSA-N 1 2 246.314 2.079 20 0 BEADLO CCc1cc(N[C@@H]2CCOC[C@H]2C)nc(CC)[nH+]1 ZINC000893503197 634540212 /nfs/dbraw/zinc/54/02/12/634540212.db2.gz YTNMPLWGRVIHKJ-ZYHUDNBSSA-N 1 2 249.358 2.438 20 0 BEADLO Nc1[nH+]cccc1COC(=O)C[C@H]1CC=CCC1 ZINC000924249133 635555639 /nfs/dbraw/zinc/55/56/39/635555639.db2.gz DZAQZXXDJXMFSM-NSHDSACASA-N 1 2 246.310 2.453 20 0 BEADLO CC[C@]1(C)C[N@H+](C/C=C\Cl)CCO1 ZINC000308240961 631216534 /nfs/dbraw/zinc/21/65/34/631216534.db2.gz STKLBFSYGTXXFN-UMCURTJPSA-N 1 2 203.713 2.240 20 0 BEADLO CC[C@]1(C)C[N@@H+](C/C=C\Cl)CCO1 ZINC000308240961 631216536 /nfs/dbraw/zinc/21/65/36/631216536.db2.gz STKLBFSYGTXXFN-UMCURTJPSA-N 1 2 203.713 2.240 20 0 BEADLO C[C@@H]1C[N@H+](C/C(Cl)=C\Cl)CCCO1 ZINC000255321802 631222897 /nfs/dbraw/zinc/22/28/97/631222897.db2.gz IIRFJPPOIZVYOW-CBVZUMJXSA-N 1 2 224.131 2.416 20 0 BEADLO C[C@@H]1C[N@@H+](C/C(Cl)=C\Cl)CCCO1 ZINC000255321802 631222904 /nfs/dbraw/zinc/22/29/04/631222904.db2.gz IIRFJPPOIZVYOW-CBVZUMJXSA-N 1 2 224.131 2.416 20 0 BEADLO CC(C)=CC[N@@H+]1CC(=O)NC[C@H]1c1ccccc1 ZINC000933322233 631246864 /nfs/dbraw/zinc/24/68/64/631246864.db2.gz HQTCFIMRAXNANS-AWEZNQCLSA-N 1 2 244.338 2.126 20 0 BEADLO CC(C)=CC[N@H+]1CC(=O)NC[C@H]1c1ccccc1 ZINC000933322233 631246871 /nfs/dbraw/zinc/24/68/71/631246871.db2.gz HQTCFIMRAXNANS-AWEZNQCLSA-N 1 2 244.338 2.126 20 0 BEADLO CCOCCCNc1cc(CC)[nH+]c(CC)n1 ZINC000891437336 631252631 /nfs/dbraw/zinc/25/26/31/631252631.db2.gz WWTQYHGVSFTPNT-UHFFFAOYSA-N 1 2 237.347 2.440 20 0 BEADLO CCc1csc(NCc2ccc(N)[nH+]c2)n1 ZINC000308385096 631308312 /nfs/dbraw/zinc/30/83/12/631308312.db2.gz GKXSGXCTFUUHTB-UHFFFAOYSA-N 1 2 234.328 2.295 20 0 BEADLO CNc1cc(NC(C2CC2)C2CC2)nc[nH+]1 ZINC000087823140 631483354 /nfs/dbraw/zinc/48/33/54/631483354.db2.gz ODTLIEQXZTULMM-UHFFFAOYSA-N 1 2 218.304 2.119 20 0 BEADLO CNc1cc(NC(C2CC2)C2CC2)[nH+]cn1 ZINC000087823140 631483359 /nfs/dbraw/zinc/48/33/59/631483359.db2.gz ODTLIEQXZTULMM-UHFFFAOYSA-N 1 2 218.304 2.119 20 0 BEADLO Cc1cccc(C)c1C[N@@H+](C)Cc1cnn(C)n1 ZINC000933764293 631507539 /nfs/dbraw/zinc/50/75/39/631507539.db2.gz OWKDATWMYYXEDL-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cccc(C)c1C[N@H+](C)Cc1cnn(C)n1 ZINC000933764293 631507543 /nfs/dbraw/zinc/50/75/43/631507543.db2.gz OWKDATWMYYXEDL-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO C[C@H](c1c(F)cccc1F)[N@@H+]1CC[C@H]1CO ZINC000934024760 631600022 /nfs/dbraw/zinc/60/00/22/631600022.db2.gz ABLNJBSVTNJYBT-BDAKNGLRSA-N 1 2 227.254 2.092 20 0 BEADLO C[C@H](c1c(F)cccc1F)[N@H+]1CC[C@H]1CO ZINC000934024760 631600029 /nfs/dbraw/zinc/60/00/29/631600029.db2.gz ABLNJBSVTNJYBT-BDAKNGLRSA-N 1 2 227.254 2.092 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@H+](C)[C@@H](C)c1nnc(C)s1 ZINC000934113683 631689010 /nfs/dbraw/zinc/68/90/10/631689010.db2.gz DMTCAZOMOUNCHV-FXBDTBDDSA-N 1 2 241.360 2.017 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@@H+](C)[C@@H](C)c1nnc(C)s1 ZINC000934113683 631689012 /nfs/dbraw/zinc/68/90/12/631689012.db2.gz DMTCAZOMOUNCHV-FXBDTBDDSA-N 1 2 241.360 2.017 20 0 BEADLO CC[C@@H]([NH2+]CCSC(C)(C)C)C(=O)OC ZINC000308900709 631723660 /nfs/dbraw/zinc/72/36/60/631723660.db2.gz BSLDELIWNKRKEF-SECBINFHSA-N 1 2 233.377 2.059 20 0 BEADLO CC[C@H]1CCN(C(=O)c2cc3c[nH+]ccc3[nH]2)C1 ZINC000934462534 631854496 /nfs/dbraw/zinc/85/44/96/631854496.db2.gz XIUCQFZZWITFBS-JTQLQIEISA-N 1 2 243.310 2.435 20 0 BEADLO C[C@@H]([NH2+][C@H]1CC[C@@H]1C)C(=O)OC(C)(C)C ZINC000309087008 631875599 /nfs/dbraw/zinc/87/55/99/631875599.db2.gz YZDVNJGAMRPDCC-AEJSXWLSSA-N 1 2 213.321 2.105 20 0 BEADLO O[C@@H]1CC[N@H+](CCCCC(F)(F)F)C[C@@H]1F ZINC000934564525 631928769 /nfs/dbraw/zinc/92/87/69/631928769.db2.gz DBYRRNPOZYWECJ-DTWKUNHWSA-N 1 2 243.244 2.124 20 0 BEADLO O[C@@H]1CC[N@@H+](CCCCC(F)(F)F)C[C@@H]1F ZINC000934564525 631928773 /nfs/dbraw/zinc/92/87/73/631928773.db2.gz DBYRRNPOZYWECJ-DTWKUNHWSA-N 1 2 243.244 2.124 20 0 BEADLO O[C@H]1CC[N@H+](Cc2cc3ccccc3o2)C[C@H]1F ZINC000934575560 631948057 /nfs/dbraw/zinc/94/80/57/631948057.db2.gz KEBFSZIDGDBAKB-OLZOCXBDSA-N 1 2 249.285 2.338 20 0 BEADLO O[C@H]1CC[N@@H+](Cc2cc3ccccc3o2)C[C@H]1F ZINC000934575560 631948065 /nfs/dbraw/zinc/94/80/65/631948065.db2.gz KEBFSZIDGDBAKB-OLZOCXBDSA-N 1 2 249.285 2.338 20 0 BEADLO C[C@H](c1cccc(F)c1)[N@@H+]1CC[C@@H](O)[C@@H](F)C1 ZINC000934579092 631950324 /nfs/dbraw/zinc/95/03/24/631950324.db2.gz GRXQJDFPNWQPOX-JIMOISOXSA-N 1 2 241.281 2.291 20 0 BEADLO C[C@H](c1cccc(F)c1)[N@H+]1CC[C@@H](O)[C@@H](F)C1 ZINC000934579092 631950328 /nfs/dbraw/zinc/95/03/28/631950328.db2.gz GRXQJDFPNWQPOX-JIMOISOXSA-N 1 2 241.281 2.291 20 0 BEADLO Cn1c(Cl)cnc1CNc1cccc[nH+]1 ZINC000308860896 631974271 /nfs/dbraw/zinc/97/42/71/631974271.db2.gz BJJJJDLDWZWXCE-UHFFFAOYSA-N 1 2 222.679 2.081 20 0 BEADLO c1snnc1C[NH2+][C@H](c1ccncc1)C1CC1 ZINC000934695621 632018753 /nfs/dbraw/zinc/01/87/53/632018753.db2.gz AAOUOGIJLHXGBZ-LBPRGKRZSA-N 1 2 246.339 2.174 20 0 BEADLO c1[nH]cc([C@@H]2C[C@H]2c2nc(CC3CCC3)no2)[nH+]1 ZINC000924064299 632059733 /nfs/dbraw/zinc/05/97/33/632059733.db2.gz UCMHRJJZBDHNGJ-NXEZZACHSA-N 1 2 244.298 2.406 20 0 BEADLO CNc1cc(N[C@@H](C)c2ccccn2)nc[nH+]1 ZINC000129290510 632424227 /nfs/dbraw/zinc/42/42/27/632424227.db2.gz DFSBTRVUHIZLIK-VIFPVBQESA-N 1 2 229.287 2.086 20 0 BEADLO CNc1cc(N[C@@H](C)c2ccccn2)[nH+]cn1 ZINC000129290510 632424231 /nfs/dbraw/zinc/42/42/31/632424231.db2.gz DFSBTRVUHIZLIK-VIFPVBQESA-N 1 2 229.287 2.086 20 0 BEADLO C[C@@H](O)C[NH2+][C@H](C)C(F)(F)c1ccccc1 ZINC000924528237 632696407 /nfs/dbraw/zinc/69/64/07/632696407.db2.gz MSCHEGIIQTYKSY-NXEZZACHSA-N 1 2 229.270 2.137 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cncc(F)c1)c1ncc[nH]1 ZINC000235521885 632773904 /nfs/dbraw/zinc/77/39/04/632773904.db2.gz VFYIAUAIMMABIJ-DTWKUNHWSA-N 1 2 234.278 2.356 20 0 BEADLO Cc1nonc1[C@H](C)[NH2+]Cc1ccccc1 ZINC000924541021 632784564 /nfs/dbraw/zinc/78/45/64/632784564.db2.gz IAPDIBLIWAXDKB-VIFPVBQESA-N 1 2 217.272 2.229 20 0 BEADLO COc1cc([C@@H](C)[NH2+][C@@H](C)c2ccccn2)on1 ZINC000924543803 632796514 /nfs/dbraw/zinc/79/65/14/632796514.db2.gz SCCFRYVRIPDHAU-VHSXEESVSA-N 1 2 247.298 2.490 20 0 BEADLO Cc1ccc(NC(=O)[C@H](C)C2CC2)c(N(C)C)[nH+]1 ZINC000152731941 632806483 /nfs/dbraw/zinc/80/64/83/632806483.db2.gz FWCVSXXIYMLKKT-SNVBAGLBSA-N 1 2 247.342 2.441 20 0 BEADLO Clc1cnc(C[NH2+]Cc2ccncc2)s1 ZINC000236054384 632870518 /nfs/dbraw/zinc/87/05/18/632870518.db2.gz OXXURXMPKZVEPP-UHFFFAOYSA-N 1 2 239.731 2.481 20 0 BEADLO O=C(OCC1CC1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000180775952 633051442 /nfs/dbraw/zinc/05/14/42/633051442.db2.gz XGEBWCXSVRWZJS-UHFFFAOYSA-N 1 2 242.278 2.439 20 0 BEADLO CC(C)n1cc([C@@H](C)[NH2+]CC(C)(C)F)nn1 ZINC000926781695 633058086 /nfs/dbraw/zinc/05/80/86/633058086.db2.gz YBHRVBGLSWTUKH-SECBINFHSA-N 1 2 228.315 2.258 20 0 BEADLO O=C(c1cc2c[nH+]ccc2[nH]1)N1CCC[C@H]2C[C@H]21 ZINC000935922158 633104772 /nfs/dbraw/zinc/10/47/72/633104772.db2.gz DXYQBFBSOAMDIX-TVQRCGJNSA-N 1 2 241.294 2.187 20 0 BEADLO Cc1cc(NC[C@H](C)CCO)nc(C2CCC2)[nH+]1 ZINC000892730354 633205826 /nfs/dbraw/zinc/20/58/26/633205826.db2.gz GXYPCBVSUYUKNS-SNVBAGLBSA-N 1 2 249.358 2.483 20 0 BEADLO CC[NH2+]Cc1noc(C(C2CC2)C2CC2)n1 ZINC000303676543 635932998 /nfs/dbraw/zinc/93/29/98/635932998.db2.gz WQQHKOADCSBLET-UHFFFAOYSA-N 1 2 221.304 2.083 20 0 BEADLO CC1(C)C[N@H+](C/C(Cl)=C/Cl)C[C@H]1O ZINC000306755705 635975706 /nfs/dbraw/zinc/97/57/06/635975706.db2.gz LJHHJBLUTWGCAJ-LSFDQVSLSA-N 1 2 224.131 2.008 20 0 BEADLO CC1(C)C[N@@H+](C/C(Cl)=C/Cl)C[C@H]1O ZINC000306755705 635975708 /nfs/dbraw/zinc/97/57/08/635975708.db2.gz LJHHJBLUTWGCAJ-LSFDQVSLSA-N 1 2 224.131 2.008 20 0 BEADLO CC1(C)C[N@H+](C/C(Cl)=C/Cl)CC[C@H]1O ZINC000307303992 635985062 /nfs/dbraw/zinc/98/50/62/635985062.db2.gz GWYLTTDOXNDZGW-BZJXQOFCSA-N 1 2 238.158 2.398 20 0 BEADLO CC1(C)C[N@@H+](C/C(Cl)=C/Cl)CC[C@H]1O ZINC000307303992 635985070 /nfs/dbraw/zinc/98/50/70/635985070.db2.gz GWYLTTDOXNDZGW-BZJXQOFCSA-N 1 2 238.158 2.398 20 0 BEADLO COC1CC[NH+](C/C(Cl)=C/Cl)CC1 ZINC000307301250 635985252 /nfs/dbraw/zinc/98/52/52/635985252.db2.gz XLJWLCKPTIOFBX-VURMDHGXSA-N 1 2 224.131 2.416 20 0 BEADLO Clc1cnc(C[NH+]2CCCCC2)cn1 ZINC000231275204 636054062 /nfs/dbraw/zinc/05/40/62/636054062.db2.gz LWEWMHYRBKMKPK-UHFFFAOYSA-N 1 2 211.696 2.116 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+][C@H]1CCc2ccccc2C1 ZINC000049371572 636077323 /nfs/dbraw/zinc/07/73/23/636077323.db2.gz JFCMNFRBDVBLKX-RISCZKNCSA-N 1 2 247.338 2.085 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1c1nccn2c[nH+]cc12 ZINC000893091347 633828860 /nfs/dbraw/zinc/82/88/60/633828860.db2.gz AFRJJUDBSHSMTF-GHMZBOCLSA-N 1 2 230.315 2.497 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1c1nccn2c[nH+]cc12 ZINC000893091350 633829024 /nfs/dbraw/zinc/82/90/24/633829024.db2.gz AFRJJUDBSHSMTF-MNOVXSKESA-N 1 2 230.315 2.497 20 0 BEADLO CSC1(C[NH2+][C@@H](C)C(=O)OCC(C)C)CC1 ZINC000309892569 633909380 /nfs/dbraw/zinc/90/93/80/633909380.db2.gz DGZZOPAUUUEYFH-JTQLQIEISA-N 1 2 245.388 2.059 20 0 BEADLO CCc1onc(C)c1C[N@@H+]1CC[C@@H](F)C1 ZINC000930603693 633928830 /nfs/dbraw/zinc/92/88/30/633928830.db2.gz QBGYGPGZHJWLIW-SECBINFHSA-N 1 2 212.268 2.089 20 0 BEADLO CCc1onc(C)c1C[N@H+]1CC[C@@H](F)C1 ZINC000930603693 633928836 /nfs/dbraw/zinc/92/88/36/633928836.db2.gz QBGYGPGZHJWLIW-SECBINFHSA-N 1 2 212.268 2.089 20 0 BEADLO CCCNc1cc(NCC[C@@H](C)OC)nc[nH+]1 ZINC000310355853 634131017 /nfs/dbraw/zinc/13/10/17/634131017.db2.gz RVPNGJNJCKEDHR-SNVBAGLBSA-N 1 2 238.335 2.135 20 0 BEADLO CCCNc1cc(NCC[C@@H](C)OC)[nH+]cn1 ZINC000310355853 634131020 /nfs/dbraw/zinc/13/10/20/634131020.db2.gz RVPNGJNJCKEDHR-SNVBAGLBSA-N 1 2 238.335 2.135 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1[nH]nc(C)c1C ZINC000893897204 635637854 /nfs/dbraw/zinc/63/78/54/635637854.db2.gz PNDPZOASNOKBQY-JOYOIKCWSA-N 1 2 237.347 2.026 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1[nH]nc(C)c1C ZINC000893897204 635637861 /nfs/dbraw/zinc/63/78/61/635637861.db2.gz PNDPZOASNOKBQY-JOYOIKCWSA-N 1 2 237.347 2.026 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1[nH]nc(C)c1C ZINC000893897203 635638415 /nfs/dbraw/zinc/63/84/15/635638415.db2.gz PNDPZOASNOKBQY-CABZTGNLSA-N 1 2 237.347 2.026 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1[nH]nc(C)c1C ZINC000893897203 635638419 /nfs/dbraw/zinc/63/84/19/635638419.db2.gz PNDPZOASNOKBQY-CABZTGNLSA-N 1 2 237.347 2.026 20 0 BEADLO CNc1cc(N2CCCc3occc3C2)nc[nH+]1 ZINC000893896956 635638941 /nfs/dbraw/zinc/63/89/41/635638941.db2.gz LBXVPUIZSAWRTL-UHFFFAOYSA-N 1 2 244.298 2.064 20 0 BEADLO CNc1cc(N2CCCc3occc3C2)[nH+]cn1 ZINC000893896956 635638947 /nfs/dbraw/zinc/63/89/47/635638947.db2.gz LBXVPUIZSAWRTL-UHFFFAOYSA-N 1 2 244.298 2.064 20 0 BEADLO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)C(F)F)[C@H]1SC ZINC000895725753 636174946 /nfs/dbraw/zinc/17/49/46/636174946.db2.gz SMBDMJNOEZOKOR-RBXMUDONSA-N 1 2 239.331 2.139 20 0 BEADLO CO[C@H](C[NH2+][C@H](C)C(F)F)Cc1ccccc1 ZINC000895725732 636175092 /nfs/dbraw/zinc/17/50/92/636175092.db2.gz SEWBLJZCZKBDCG-PWSUYJOCSA-N 1 2 243.297 2.487 20 0 BEADLO OCc1cc[nH+]c(NC[C@]23C[C@H]2CCC3)c1 ZINC000896545858 636202487 /nfs/dbraw/zinc/20/24/87/636202487.db2.gz PZIUHXZUQULACW-YPMHNXCESA-N 1 2 218.300 2.176 20 0 BEADLO CC(C)(CNC(=O)Cc1c[nH]c[nH+]1)C1=CCCC1 ZINC000909552888 636244645 /nfs/dbraw/zinc/24/46/45/636244645.db2.gz NMQGOWVJJAKTGO-UHFFFAOYSA-N 1 2 247.342 2.205 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)CO)C(F)(F)c1ccccc1 ZINC000925162864 636344783 /nfs/dbraw/zinc/34/47/83/636344783.db2.gz XFTHXICCRIYVKG-VHSXEESVSA-N 1 2 229.270 2.137 20 0 BEADLO C[C@@H](c1nc(Cc2ccccc2F)no1)[NH+](C)C ZINC000350602441 636433822 /nfs/dbraw/zinc/43/38/22/636433822.db2.gz UHZGYOZJLUCAAC-VIFPVBQESA-N 1 2 249.289 2.422 20 0 BEADLO N#Cc1ccc(C(=O)/C=C/c2[nH]cc[nH+]2)cc1 ZINC000067647662 636757820 /nfs/dbraw/zinc/75/78/20/636757820.db2.gz WALOWCAKFBASLV-AATRIKPKSA-N 1 2 223.235 2.177 20 0 BEADLO CC[C@H](C)NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000929104629 636804053 /nfs/dbraw/zinc/80/40/53/636804053.db2.gz WWMSUTGUHNQDCR-QMMMGPOBSA-N 1 2 217.272 2.091 20 0 BEADLO C[C@H]([NH2+][C@H]1CCCc2occc21)c1cnn(C)n1 ZINC000924645015 636970898 /nfs/dbraw/zinc/97/08/98/636970898.db2.gz UJPJABYVEDTJHG-ONGXEEELSA-N 1 2 246.314 2.136 20 0 BEADLO CNc1cc(N[C@@H]2CC[C@@H](C)C2)[nH+]cn1 ZINC000128148874 637008420 /nfs/dbraw/zinc/00/84/20/637008420.db2.gz QOWXHBNGAGUWHI-RKDXNWHRSA-N 1 2 206.293 2.119 20 0 BEADLO CC(C)(CNC(=O)[C@H]1CCC1(C)C)n1cc[nH+]c1 ZINC000898910558 637064336 /nfs/dbraw/zinc/06/43/36/637064336.db2.gz SPFSOVXHLXKDQJ-LLVKDONJSA-N 1 2 249.358 2.171 20 0 BEADLO C[C@H](C(=O)NCC(C)(C)n1cc[nH+]c1)C1CCC1 ZINC000898909486 637064641 /nfs/dbraw/zinc/06/46/41/637064641.db2.gz QOZBDAGJWJFEAX-NSHDSACASA-N 1 2 249.358 2.171 20 0 BEADLO CCn1nc(C)c([C@H](C)[NH2+]Cc2ccoc2)n1 ZINC000924747001 637071692 /nfs/dbraw/zinc/07/16/92/637071692.db2.gz HTPCRBWFRQNZGC-VIFPVBQESA-N 1 2 234.303 2.050 20 0 BEADLO C[C@H](c1ccccc1)N(C)C(=O)Cc1c[nH+]c[nH]1 ZINC000900023933 637168125 /nfs/dbraw/zinc/16/81/25/637168125.db2.gz AKJDJEVDQIAWQM-LLVKDONJSA-N 1 2 243.310 2.172 20 0 BEADLO CCC(CC)(CC)NC(=O)Cc1c[nH]c[nH+]1 ZINC000900826949 637192303 /nfs/dbraw/zinc/19/23/03/637192303.db2.gz DSGLVFLSBCIVRY-UHFFFAOYSA-N 1 2 223.320 2.037 20 0 BEADLO C[C@@H]1CC[C@@H](C)N(C(=O)CNc2cccc[nH+]2)C1 ZINC000900903425 637196526 /nfs/dbraw/zinc/19/65/26/637196526.db2.gz HWASMPOUHXZRRR-VXGBXAGGSA-N 1 2 247.342 2.141 20 0 BEADLO CC[C@H](C)C(=O)N1CCC[C@H](c2[nH+]ccn2C)C1 ZINC000347416141 637380064 /nfs/dbraw/zinc/38/00/64/637380064.db2.gz IYGUADNSJDDDOV-RYUDHWBXSA-N 1 2 249.358 2.172 20 0 BEADLO CC(C)c1[nH+]cc(-c2cccc(C(N)=O)c2)n1C ZINC000904895548 637526302 /nfs/dbraw/zinc/52/63/02/637526302.db2.gz SJMFSVOMIHWENX-UHFFFAOYSA-N 1 2 243.310 2.309 20 0 BEADLO CCC(F)(F)C[NH2+]C[C@@](O)(CC)C(F)(F)F ZINC000905383884 637784242 /nfs/dbraw/zinc/78/42/42/637784242.db2.gz JMKXPMNHEBBXIQ-ZETCQYMHSA-N 1 2 249.223 2.325 20 0 BEADLO CCC(F)(F)C[NH2+]C[C@](O)(CC)C(F)(F)F ZINC000905383883 637784488 /nfs/dbraw/zinc/78/44/88/637784488.db2.gz JMKXPMNHEBBXIQ-SSDOTTSWSA-N 1 2 249.223 2.325 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NC[C@@]12C[C@@H]1CCCC2 ZINC000927439366 637882777 /nfs/dbraw/zinc/88/27/77/637882777.db2.gz YWCFWLFSWJLNAV-SMDDNHRTSA-N 1 2 247.342 2.039 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NC[C@@]12C[C@@H]1CCCC2 ZINC000927439366 637882786 /nfs/dbraw/zinc/88/27/86/637882786.db2.gz YWCFWLFSWJLNAV-SMDDNHRTSA-N 1 2 247.342 2.039 20 0 BEADLO CC[C@H](C)[C@H]([NH2+][C@@H]1CC12CCC2)C(=O)OC ZINC000905779784 637908303 /nfs/dbraw/zinc/90/83/03/637908303.db2.gz ZMDJUULDDPXUOH-AXFHLTTASA-N 1 2 225.332 2.106 20 0 BEADLO CC[C@H](C)[C@H]([NH2+][C@H]1CCC(F)(F)C1)C(=O)OC ZINC000905768008 637923232 /nfs/dbraw/zinc/92/32/32/637923232.db2.gz POOZETGGQZGBDR-GUBZILKMSA-N 1 2 249.301 2.352 20 0 BEADLO Cc1cc(C)c(C(=O)NCC(F)(F)F)c(C)[nH+]1 ZINC000905865360 637952648 /nfs/dbraw/zinc/95/26/48/637952648.db2.gz WCBNPFRIDVBCEX-UHFFFAOYSA-N 1 2 246.232 2.299 20 0 BEADLO CCC(C)(C)CNC(=O)CNc1cccc[nH+]1 ZINC000907737219 638459975 /nfs/dbraw/zinc/45/99/75/638459975.db2.gz ICWZNPJBEDOCFM-UHFFFAOYSA-N 1 2 235.331 2.046 20 0 BEADLO CN(C(=O)CNc1cccc[nH+]1)C1(C)CCCC1 ZINC000907822127 638476894 /nfs/dbraw/zinc/47/68/94/638476894.db2.gz TZLYLIUNJCTNSB-UHFFFAOYSA-N 1 2 247.342 2.285 20 0 BEADLO Cc1cc(C)c(C(=O)N2CC(C3CC3)C2)c(C)[nH+]1 ZINC000908318982 638641999 /nfs/dbraw/zinc/64/19/99/638641999.db2.gz PSTFQVNWLMACFW-UHFFFAOYSA-N 1 2 244.338 2.489 20 0 BEADLO CC[C@H]1CCCC[C@H]1CNC(=O)Cc1c[nH]c[nH+]1 ZINC000908551240 639010657 /nfs/dbraw/zinc/01/06/57/639010657.db2.gz JTXFLORZWBIKDC-RYUDHWBXSA-N 1 2 249.358 2.285 20 0 BEADLO CC[C@H]1CCCC[C@@H]1CNC(=O)Cc1c[nH]c[nH+]1 ZINC000908551239 639011037 /nfs/dbraw/zinc/01/10/37/639011037.db2.gz JTXFLORZWBIKDC-NWDGAFQWSA-N 1 2 249.358 2.285 20 0 BEADLO CCC1(NC(=O)Cc2c[nH]c[nH+]2)CCCCC1 ZINC000909032299 639121317 /nfs/dbraw/zinc/12/13/17/639121317.db2.gz BAFYBFHOFBMHQL-UHFFFAOYSA-N 1 2 235.331 2.181 20 0 BEADLO CCC[C@@H](NC(=O)Cc1c[nH]c[nH+]1)C1CCCC1 ZINC000909928836 639278439 /nfs/dbraw/zinc/27/84/39/639278439.db2.gz IZTPGFHDSILGDV-CYBMUJFWSA-N 1 2 249.358 2.427 20 0 BEADLO CCc1ncc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)o1 ZINC000930243778 639651062 /nfs/dbraw/zinc/65/10/62/639651062.db2.gz IJCCSAFDTGXAHW-MWLCHTKSSA-N 1 2 226.295 2.417 20 0 BEADLO CCc1ncc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)o1 ZINC000930243778 639651070 /nfs/dbraw/zinc/65/10/70/639651070.db2.gz IJCCSAFDTGXAHW-MWLCHTKSSA-N 1 2 226.295 2.417 20 0 BEADLO CCN(C(=O)c1cc2c[nH+]ccc2[nH]1)C(C)C ZINC000930311257 639695214 /nfs/dbraw/zinc/69/52/14/639695214.db2.gz FRXRMGALUPCNCY-UHFFFAOYSA-N 1 2 231.299 2.433 20 0 BEADLO CN(C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)c1ccsc1 ZINC000912004967 639919815 /nfs/dbraw/zinc/91/98/15/639919815.db2.gz XRGIVXPNWXTPJL-NXEZZACHSA-N 1 2 247.323 2.238 20 0 BEADLO CN(C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)c1ccsc1 ZINC000912004967 639919820 /nfs/dbraw/zinc/91/98/20/639919820.db2.gz XRGIVXPNWXTPJL-NXEZZACHSA-N 1 2 247.323 2.238 20 0 BEADLO CC(C)=CCC[NH2+][C@]1(C)CC(C)(C)OC1=O ZINC000930872170 639962458 /nfs/dbraw/zinc/96/24/58/639962458.db2.gz WEBCLJSZPUOPLL-CYBMUJFWSA-N 1 2 225.332 2.417 20 0 BEADLO C[N@H+](CCSc1ccncc1)Cc1cnc[nH]1 ZINC000930917206 639989399 /nfs/dbraw/zinc/98/93/99/639989399.db2.gz UYBMSXMTQRMHFX-UHFFFAOYSA-N 1 2 248.355 2.029 20 0 BEADLO C[N@@H+](CCSc1ccncc1)Cc1cnc[nH]1 ZINC000930917206 639989405 /nfs/dbraw/zinc/98/94/05/639989405.db2.gz UYBMSXMTQRMHFX-UHFFFAOYSA-N 1 2 248.355 2.029 20 0 BEADLO COCC[N@H+](CCF)[C@@H](C)c1ccc(F)nc1 ZINC000930973335 640003506 /nfs/dbraw/zinc/00/35/06/640003506.db2.gz IRLNRIZKJOPETB-JTQLQIEISA-N 1 2 244.285 2.200 20 0 BEADLO COCC[N@@H+](CCF)[C@@H](C)c1ccc(F)nc1 ZINC000930973335 640003508 /nfs/dbraw/zinc/00/35/08/640003508.db2.gz IRLNRIZKJOPETB-JTQLQIEISA-N 1 2 244.285 2.200 20 0 BEADLO COC/C(C)=C\C[N@@H+]1Cc2ccc(O)cc2C1 ZINC000931164531 640084420 /nfs/dbraw/zinc/08/44/20/640084420.db2.gz AQPZKBWQBVLYGF-WZUFQYTHSA-N 1 2 233.311 2.301 20 0 BEADLO COC/C(C)=C\C[N@H+]1Cc2ccc(O)cc2C1 ZINC000931164531 640084425 /nfs/dbraw/zinc/08/44/25/640084425.db2.gz AQPZKBWQBVLYGF-WZUFQYTHSA-N 1 2 233.311 2.301 20 0 BEADLO C/C(=C(/F)C(=O)N[C@@H]1CCn2c[nH+]cc21)C1CC1 ZINC000912585706 640120051 /nfs/dbraw/zinc/12/00/51/640120051.db2.gz ZJUDKMCFQODMSY-BKLZJWBFSA-N 1 2 249.289 2.098 20 0 BEADLO C[C@H]1CCN(C(=O)c2cc3c[nH+]ccc3[nH]2)C1 ZINC000931429487 640200104 /nfs/dbraw/zinc/20/01/04/640200104.db2.gz UFDFRNAVGGSIRU-VIFPVBQESA-N 1 2 229.283 2.045 20 0 BEADLO CCc1nocc1C[N@H+]1Cc2c[nH]nc2[C@H](C)C1 ZINC000931462014 640224520 /nfs/dbraw/zinc/22/45/20/640224520.db2.gz ITXNIOGETXDSHJ-SECBINFHSA-N 1 2 246.314 2.079 20 0 BEADLO CCc1nocc1C[N@@H+]1Cc2c[nH]nc2[C@H](C)C1 ZINC000931462014 640224530 /nfs/dbraw/zinc/22/45/30/640224530.db2.gz ITXNIOGETXDSHJ-SECBINFHSA-N 1 2 246.314 2.079 20 0 BEADLO COC(C)(C)[C@H](C)[NH2+]Cc1nnsc1Cl ZINC000932368769 640502106 /nfs/dbraw/zinc/50/21/06/640502106.db2.gz XWUYTMLGBWZPCB-LURJTMIESA-N 1 2 249.767 2.095 20 0 BEADLO CC(C)n1ccc(C[N@@H+]2CCn3cccc3C2)n1 ZINC000932529728 640569438 /nfs/dbraw/zinc/56/94/38/640569438.db2.gz YIVUCWIXPOTNQJ-UHFFFAOYSA-N 1 2 244.342 2.281 20 0 BEADLO CC(C)n1ccc(C[N@H+]2CCn3cccc3C2)n1 ZINC000932529728 640569440 /nfs/dbraw/zinc/56/94/40/640569440.db2.gz YIVUCWIXPOTNQJ-UHFFFAOYSA-N 1 2 244.342 2.281 20 0 BEADLO CCCCC1(C(=O)N2CC(n3cc[nH+]c3)C2)CC1 ZINC000932827749 640614827 /nfs/dbraw/zinc/61/48/27/640614827.db2.gz YLDYQTJHNQTUPU-UHFFFAOYSA-N 1 2 247.342 2.237 20 0 BEADLO CNc1cc(N(C)[C@H](C)CCSC)nc[nH+]1 ZINC000157229861 640641193 /nfs/dbraw/zinc/64/11/93/640641193.db2.gz KNOHJJIIHZPOAX-SECBINFHSA-N 1 2 240.376 2.096 20 0 BEADLO CNc1cc(N(C)[C@H](C)CCSC)[nH+]cn1 ZINC000157229861 640641197 /nfs/dbraw/zinc/64/11/97/640641197.db2.gz KNOHJJIIHZPOAX-SECBINFHSA-N 1 2 240.376 2.096 20 0 BEADLO C[C@H]([NH2+][C@H]1COCc2ccccc21)c1ncc[nH]1 ZINC000226011301 640722789 /nfs/dbraw/zinc/72/27/89/640722789.db2.gz IVVPZYUGWZHOKB-GWCFXTLKSA-N 1 2 243.310 2.332 20 0 BEADLO C[C@H](CSC(C)(C)C)[NH2+]Cc1ccn[nH]1 ZINC000167434780 640723438 /nfs/dbraw/zinc/72/34/38/640723438.db2.gz VYDQGSGNIQULSN-SECBINFHSA-N 1 2 227.377 2.420 20 0 BEADLO CC(C)=CC[NH+]1CC(NC(=O)C(C)=C2CCC2)C1 ZINC001030289458 640731138 /nfs/dbraw/zinc/73/11/38/640731138.db2.gz UVIWDGNXLPOBIL-UHFFFAOYSA-N 1 2 248.370 2.253 20 0 BEADLO Cl/C=C\C[N@@H+]1CCOC[C@@H]1C[C@H]1CCCO1 ZINC000933669396 640741091 /nfs/dbraw/zinc/74/10/91/640741091.db2.gz CAYOCKIUSCIAJG-OEDKFZARSA-N 1 2 245.750 2.009 20 0 BEADLO Cl/C=C\C[N@H+]1CCOC[C@@H]1C[C@H]1CCCO1 ZINC000933669396 640741097 /nfs/dbraw/zinc/74/10/97/640741097.db2.gz CAYOCKIUSCIAJG-OEDKFZARSA-N 1 2 245.750 2.009 20 0 BEADLO C[C@@H](c1nc(CC2CCCC2)no1)[NH+](C)C ZINC000349708623 640741314 /nfs/dbraw/zinc/74/13/14/640741314.db2.gz CFKCHDWBFNVOET-VIFPVBQESA-N 1 2 223.320 2.425 20 0 BEADLO C[C@H](c1cc(F)ccc1F)[N@@H+]1CC[C@H]1CO ZINC000934027496 640808878 /nfs/dbraw/zinc/80/88/78/640808878.db2.gz VAFCWTUJPRKLRT-SCZZXKLOSA-N 1 2 227.254 2.092 20 0 BEADLO C[C@H](c1cc(F)ccc1F)[N@H+]1CC[C@H]1CO ZINC000934027496 640808883 /nfs/dbraw/zinc/80/88/83/640808883.db2.gz VAFCWTUJPRKLRT-SCZZXKLOSA-N 1 2 227.254 2.092 20 0 BEADLO OC[C@H]1CCCC[N@@H+]1C/C(Cl)=C\Cl ZINC000227493987 640836524 /nfs/dbraw/zinc/83/65/24/640836524.db2.gz ZFTQGHTZWGNLIC-WHXYTISESA-N 1 2 224.131 2.152 20 0 BEADLO OC[C@H]1CCCC[N@H+]1C/C(Cl)=C\Cl ZINC000227493987 640836527 /nfs/dbraw/zinc/83/65/27/640836527.db2.gz ZFTQGHTZWGNLIC-WHXYTISESA-N 1 2 224.131 2.152 20 0 BEADLO CCCNc1cc(N2CC[C@H](C)C2)nc[nH+]1 ZINC000087820885 641055675 /nfs/dbraw/zinc/05/56/75/641055675.db2.gz WIVCAYQVXJRCNP-JTQLQIEISA-N 1 2 220.320 2.145 20 0 BEADLO CCCNc1cc(N2CC[C@H](C)C2)[nH+]cn1 ZINC000087820885 641055676 /nfs/dbraw/zinc/05/56/76/641055676.db2.gz WIVCAYQVXJRCNP-JTQLQIEISA-N 1 2 220.320 2.145 20 0 BEADLO CNc1cc(N(C)CC2CCCC2)nc[nH+]1 ZINC000087830154 641064089 /nfs/dbraw/zinc/06/40/89/641064089.db2.gz TYTUWUCWTYGIMN-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO CNc1cc(N(C)CC2CCCC2)[nH+]cn1 ZINC000087830154 641064095 /nfs/dbraw/zinc/06/40/95/641064095.db2.gz TYTUWUCWTYGIMN-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@H+](C)C/C(Cl)=C/Cl ZINC000934113545 641076851 /nfs/dbraw/zinc/07/68/51/641076851.db2.gz BITAXJPEPUAQEA-QRJDUPJOSA-N 1 2 224.131 2.415 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@@H+](C)C/C(Cl)=C/Cl ZINC000934113545 641076854 /nfs/dbraw/zinc/07/68/54/641076854.db2.gz BITAXJPEPUAQEA-QRJDUPJOSA-N 1 2 224.131 2.415 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@H+](C)Cc1scnc1Cl ZINC000934107993 641071990 /nfs/dbraw/zinc/07/19/90/641071990.db2.gz YIEMEWUUDQQDCJ-HTQZYQBOSA-N 1 2 246.763 2.406 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@@H+](C)Cc1scnc1Cl ZINC000934107993 641071994 /nfs/dbraw/zinc/07/19/94/641071994.db2.gz YIEMEWUUDQQDCJ-HTQZYQBOSA-N 1 2 246.763 2.406 20 0 BEADLO CO[C@H]1CC[C@H]1[N@H+](C)Cc1ncc(C(C)C)o1 ZINC000934111031 641073662 /nfs/dbraw/zinc/07/36/62/641073662.db2.gz QHPQLZWYUMRAPU-MNOVXSKESA-N 1 2 238.331 2.407 20 0 BEADLO CO[C@H]1CC[C@H]1[N@@H+](C)Cc1ncc(C(C)C)o1 ZINC000934111031 641073667 /nfs/dbraw/zinc/07/36/67/641073667.db2.gz QHPQLZWYUMRAPU-MNOVXSKESA-N 1 2 238.331 2.407 20 0 BEADLO CCc1nc(C[N@H+](C)[C@@H]2CC[C@H]2OC)cs1 ZINC000934128179 641086487 /nfs/dbraw/zinc/08/64/87/641086487.db2.gz QKXWKMIIGLEBRB-GHMZBOCLSA-N 1 2 240.372 2.315 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@@H]2CC[C@H]2OC)cs1 ZINC000934128179 641086489 /nfs/dbraw/zinc/08/64/89/641086489.db2.gz QKXWKMIIGLEBRB-GHMZBOCLSA-N 1 2 240.372 2.315 20 0 BEADLO COc1ccc([C@H]2CCC[N@@H+]2CCF)nc1 ZINC000934343426 641129431 /nfs/dbraw/zinc/12/94/31/641129431.db2.gz KSZCQCWLWCSBLR-GFCCVEGCSA-N 1 2 224.279 2.197 20 0 BEADLO COc1ccc([C@H]2CCC[N@H+]2CCF)nc1 ZINC000934343426 641129437 /nfs/dbraw/zinc/12/94/37/641129437.db2.gz KSZCQCWLWCSBLR-GFCCVEGCSA-N 1 2 224.279 2.197 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccsc2)CCC1=O ZINC000063152931 641141452 /nfs/dbraw/zinc/14/14/52/641141452.db2.gz PBIWZBXMMBBMJX-SECBINFHSA-N 1 2 209.314 2.159 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccsc2)CCC1=O ZINC000063152931 641141454 /nfs/dbraw/zinc/14/14/54/641141454.db2.gz PBIWZBXMMBBMJX-SECBINFHSA-N 1 2 209.314 2.159 20 0 BEADLO C[C@]1(C2CC2)COCC[N@@H+]1Cc1ccns1 ZINC000934474464 641167303 /nfs/dbraw/zinc/16/73/03/641167303.db2.gz DNIUYRCRGSYGNC-GFCCVEGCSA-N 1 2 238.356 2.144 20 0 BEADLO C[C@]1(C2CC2)COCC[N@H+]1Cc1ccns1 ZINC000934474464 641167308 /nfs/dbraw/zinc/16/73/08/641167308.db2.gz DNIUYRCRGSYGNC-GFCCVEGCSA-N 1 2 238.356 2.144 20 0 BEADLO C[C@@H]1CCC[N@@H+]1Cn1cc(Br)cn1 ZINC000173529992 641182844 /nfs/dbraw/zinc/18/28/44/641182844.db2.gz LXCJAPZKPIOBQU-MRVPVSSYSA-N 1 2 244.136 2.087 20 0 BEADLO C[C@@H]1CCC[N@H+]1Cn1cc(Br)cn1 ZINC000173529992 641182849 /nfs/dbraw/zinc/18/28/49/641182849.db2.gz LXCJAPZKPIOBQU-MRVPVSSYSA-N 1 2 244.136 2.087 20 0 BEADLO c1cc(C[NH2+][C@@H](c2ccncc2)C2CC2)no1 ZINC000934691245 641246839 /nfs/dbraw/zinc/24/68/39/641246839.db2.gz GXBVDKGMIJJPCI-CYBMUJFWSA-N 1 2 229.283 2.311 20 0 BEADLO C[C@@H](c1noc([C@H](C)[NH+](C)C)n1)C1CC1 ZINC000350600054 641372616 /nfs/dbraw/zinc/37/26/16/641372616.db2.gz SJXUSLQJGFBBRU-SFYZADRCSA-N 1 2 209.293 2.206 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@@H](CC)O[C@@H](C)C2)o1 ZINC000929620152 641378254 /nfs/dbraw/zinc/37/82/54/641378254.db2.gz OBVJVJZVZRIMJL-WDEREUQCSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@@H](CC)O[C@@H](C)C2)o1 ZINC000929620152 641378259 /nfs/dbraw/zinc/37/82/59/641378259.db2.gz OBVJVJZVZRIMJL-WDEREUQCSA-N 1 2 238.331 2.236 20 0 BEADLO C[C@H]1CC[C@@H](NC(=O)c2cc3c[nH+]ccc3[nH]2)C1 ZINC000935540793 641424927 /nfs/dbraw/zinc/42/49/27/641424927.db2.gz MUOAIDCJHVIDDA-GXSJLCMTSA-N 1 2 243.310 2.481 20 0 BEADLO Cc1cc(C)c(C(=O)N2CC[C@H]2C)c(C)[nH+]1 ZINC000914164492 641600400 /nfs/dbraw/zinc/60/04/00/641600400.db2.gz HJKZJEYFCUOTGZ-SNVBAGLBSA-N 1 2 218.300 2.241 20 0 BEADLO CC1(C)C[C@]1(C)CNC(=O)CNc1cccc[nH+]1 ZINC000914379136 641653618 /nfs/dbraw/zinc/65/36/18/641653618.db2.gz PXOAMXLMPOQKEI-CQSZACIVSA-N 1 2 247.342 2.046 20 0 BEADLO Cc1ccc(NC(=O)c2ccoc2)c(N(C)C)[nH+]1 ZINC000152872293 641664730 /nfs/dbraw/zinc/66/47/30/641664730.db2.gz ZCEAXTPKZTWEHI-UHFFFAOYSA-N 1 2 245.282 2.301 20 0 BEADLO CCCC[C@H]([NH2+]C[C@@H]1CCC=CO1)C(=O)OC ZINC000187732847 641721310 /nfs/dbraw/zinc/72/13/10/641721310.db2.gz NVGXKDIFPFZRBH-RYUDHWBXSA-N 1 2 241.331 2.001 20 0 BEADLO CC(C)COC(=O)[C@H](C)[NH2+][C@H]1CCCSC1 ZINC000187904543 641732027 /nfs/dbraw/zinc/73/20/27/641732027.db2.gz JLSSMTHCASCATP-QWRGUYRKSA-N 1 2 245.388 2.059 20 0 BEADLO CC(C)COC(=O)[C@H](C)[NH2+]C1CCSCC1 ZINC000187912077 641733675 /nfs/dbraw/zinc/73/36/75/641733675.db2.gz PORRNEUKPKVLDQ-JTQLQIEISA-N 1 2 245.388 2.059 20 0 BEADLO CN(C)c1ccc(Nc2nccs2)c[nH+]1 ZINC000914862526 641776100 /nfs/dbraw/zinc/77/61/00/641776100.db2.gz JUYVOXAHJYAVHC-UHFFFAOYSA-N 1 2 220.301 2.348 20 0 BEADLO C[C@@H](c1ncccn1)[N@H+](C)CCOC(C)(C)C ZINC000929856258 641785851 /nfs/dbraw/zinc/78/58/51/641785851.db2.gz UXUSIRLQBOMJAS-NSHDSACASA-N 1 2 237.347 2.285 20 0 BEADLO C[C@@H](c1ncccn1)[N@@H+](C)CCOC(C)(C)C ZINC000929856258 641785855 /nfs/dbraw/zinc/78/58/55/641785855.db2.gz UXUSIRLQBOMJAS-NSHDSACASA-N 1 2 237.347 2.285 20 0 BEADLO C[C@H]1CCSCC[N@@H+]1Cn1cc(Cl)cn1 ZINC000189912705 641824875 /nfs/dbraw/zinc/82/48/75/641824875.db2.gz XDJMESBQOMLWCX-VIFPVBQESA-N 1 2 245.779 2.321 20 0 BEADLO C[C@H]1CCSCC[N@H+]1Cn1cc(Cl)cn1 ZINC000189912705 641824878 /nfs/dbraw/zinc/82/48/78/641824878.db2.gz XDJMESBQOMLWCX-VIFPVBQESA-N 1 2 245.779 2.321 20 0 BEADLO CCCC(C)=CC(=O)Nc1cc[nH+]c(C)c1 ZINC000732766080 641869053 /nfs/dbraw/zinc/86/90/53/641869053.db2.gz NHDOQSRIYABTIB-NTMALXAHSA-N 1 2 218.300 2.497 20 0 BEADLO CC[C@H]1CC[C@H](C(=O)NC2C[NH+](CC)C2)CC1 ZINC001031284779 641873720 /nfs/dbraw/zinc/87/37/20/641873720.db2.gz RQNNDQVDESRASZ-HAQNSBGRSA-N 1 2 238.375 2.023 20 0 BEADLO COc1ccc(O)c(CNc2cc[nH+]c(C)n2)c1 ZINC000078260590 641908143 /nfs/dbraw/zinc/90/81/43/641908143.db2.gz ASGLERKHFPIJPB-UHFFFAOYSA-N 1 2 245.282 2.111 20 0 BEADLO CCc1c[nH]c(SCc2ccc(N)[nH+]c2)n1 ZINC000917221057 642033383 /nfs/dbraw/zinc/03/33/83/642033383.db2.gz LQJCLMYGYKHGHP-UHFFFAOYSA-N 1 2 234.328 2.242 20 0 BEADLO C[C@H]1Cc2[nH+]cn(COC(=O)C3CC3)c2C[C@@H]1C ZINC000917788712 642124309 /nfs/dbraw/zinc/12/43/09/642124309.db2.gz FAXPYFPDFZQMGP-UWVGGRQHSA-N 1 2 248.326 2.165 20 0 BEADLO CC(C)(C(=O)N1CCCC(C)(C)C1)c1c[nH+]c[nH]1 ZINC000670475867 642212997 /nfs/dbraw/zinc/21/29/97/642212997.db2.gz SRORWRASXMFUDB-UHFFFAOYSA-N 1 2 249.358 2.336 20 0 BEADLO CC/C=C(\C)C(=O)NCCCCn1cc[nH+]c1 ZINC000918706431 642253625 /nfs/dbraw/zinc/25/36/25/642253625.db2.gz STQPPOOVXYQPLN-WUXMJOGZSA-N 1 2 235.331 2.136 20 0 BEADLO Cc1nc2c(o1)CCC[C@H]2[NH2+]Cc1c[nH]nc1C ZINC000925462460 642316912 /nfs/dbraw/zinc/31/69/12/642316912.db2.gz KWOJKUPWBHUQAQ-LLVKDONJSA-N 1 2 246.314 2.182 20 0 BEADLO CCn1cc[nH+]c1Cn1ccnc1C(F)(F)F ZINC000919925054 642405772 /nfs/dbraw/zinc/40/57/72/642405772.db2.gz CZYYRQPTHPROCX-UHFFFAOYSA-N 1 2 244.220 2.167 20 0 BEADLO CCc1cc(NC[C@@H]2CCCO2)nc(CC)[nH+]1 ZINC000891396911 642470155 /nfs/dbraw/zinc/47/01/55/642470155.db2.gz GYPRZYBWOOGQIA-NSHDSACASA-N 1 2 235.331 2.192 20 0 BEADLO Cc1cc(C)cc([C@H](O)Cn2cc[nH+]c2)c1 ZINC000097986985 642652157 /nfs/dbraw/zinc/65/21/57/642652157.db2.gz DPXVUVCFCOIUAP-CYBMUJFWSA-N 1 2 216.284 2.234 20 0 BEADLO CC(C)C(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000064440379 642657715 /nfs/dbraw/zinc/65/77/15/642657715.db2.gz AYBHAUPAGRQCOP-LLVKDONJSA-N 1 2 237.347 2.070 20 0 BEADLO CC[N@H+](C)[C@H](C(=O)OCCF)c1ccccc1 ZINC000175474961 642686103 /nfs/dbraw/zinc/68/61/03/642686103.db2.gz GLEVQUJYQGXUGW-LBPRGKRZSA-N 1 2 239.290 2.192 20 0 BEADLO CC[N@@H+](C)[C@H](C(=O)OCCF)c1ccccc1 ZINC000175474961 642686108 /nfs/dbraw/zinc/68/61/08/642686108.db2.gz GLEVQUJYQGXUGW-LBPRGKRZSA-N 1 2 239.290 2.192 20 0 BEADLO CC1CCN(C(=O)c2cc3c[nH+]ccc3[nH]2)CC1 ZINC000929211077 642767582 /nfs/dbraw/zinc/76/75/82/642767582.db2.gz FSSAXWJCONVORQ-UHFFFAOYSA-N 1 2 243.310 2.435 20 0 BEADLO C/C=C/COC(=O)[C@H](c1ccccc1)[NH+](C)C ZINC000181972768 642933972 /nfs/dbraw/zinc/93/39/72/642933972.db2.gz KDYNSSDEISLNCO-IHVVCDCBSA-N 1 2 233.311 2.409 20 0 BEADLO C[C@@H]([NH2+]Cc1ccc(Cl)nc1)c1ncc[nH]1 ZINC000285978802 643088957 /nfs/dbraw/zinc/08/89/57/643088957.db2.gz HNEYTJWGMGJYTG-MRVPVSSYSA-N 1 2 236.706 2.309 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2ncccc2Cl)CCO1 ZINC000932337009 643130833 /nfs/dbraw/zinc/13/08/33/643130833.db2.gz URLATAJNIBJHFS-SNVBAGLBSA-N 1 2 240.734 2.346 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2ncccc2Cl)CCO1 ZINC000932337009 643130835 /nfs/dbraw/zinc/13/08/35/643130835.db2.gz URLATAJNIBJHFS-SNVBAGLBSA-N 1 2 240.734 2.346 20 0 BEADLO C[C@@H]1C[N@H+](C/C(Cl)=C/Cl)CC[C@H]1O ZINC000253284284 643190158 /nfs/dbraw/zinc/19/01/58/643190158.db2.gz MTEACHRVVGCXFZ-NMTTVDAISA-N 1 2 224.131 2.008 20 0 BEADLO C[C@@H]1C[N@@H+](C/C(Cl)=C/Cl)CC[C@H]1O ZINC000253284284 643190159 /nfs/dbraw/zinc/19/01/59/643190159.db2.gz MTEACHRVVGCXFZ-NMTTVDAISA-N 1 2 224.131 2.008 20 0 BEADLO C[C@@H](CO)[N@H+](C)Cc1ccc(Cl)nc1Cl ZINC000235136962 643281379 /nfs/dbraw/zinc/28/13/79/643281379.db2.gz CHOISMIUHOEWSV-ZETCQYMHSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@@H](CO)[N@@H+](C)Cc1ccc(Cl)nc1Cl ZINC000235136962 643281383 /nfs/dbraw/zinc/28/13/83/643281383.db2.gz CHOISMIUHOEWSV-ZETCQYMHSA-N 1 2 249.141 2.201 20 0 BEADLO C/C=C/C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000082275563 643291273 /nfs/dbraw/zinc/29/12/73/643291273.db2.gz QDVDIHZUCAFZRJ-GORDUTHDSA-N 1 2 227.267 2.387 20 0 BEADLO C/C=C/C=C/C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000733872301 643475562 /nfs/dbraw/zinc/47/55/62/643475562.db2.gz LVPSUDDIJAQUEX-MQQKCMAXSA-N 1 2 227.267 2.405 20 0 BEADLO CCCCC[C@H]([NH2+][C@H]1CCSC1)C(=O)OC ZINC000187886366 643548018 /nfs/dbraw/zinc/54/80/18/643548018.db2.gz RWOAVTKSDDKHOA-QWRGUYRKSA-N 1 2 245.388 2.203 20 0 BEADLO CNc1cc(N2CC[C@H](CC(C)C)C2)nc[nH+]1 ZINC000307793234 643649361 /nfs/dbraw/zinc/64/93/61/643649361.db2.gz JFXXDNUCIIAMNA-LLVKDONJSA-N 1 2 234.347 2.391 20 0 BEADLO CNc1cc(N2CC[C@H](CC(C)C)C2)[nH+]cn1 ZINC000307793234 643649365 /nfs/dbraw/zinc/64/93/65/643649365.db2.gz JFXXDNUCIIAMNA-LLVKDONJSA-N 1 2 234.347 2.391 20 0 BEADLO CC[C@@H](C)CN(C)c1cc(NC)[nH+]cn1 ZINC000087809571 643675876 /nfs/dbraw/zinc/67/58/76/643675876.db2.gz LVBMXVZDTMCOHK-SECBINFHSA-N 1 2 208.309 2.001 20 0 BEADLO CC[C@@H](C)CN(C)c1cc(NC)nc[nH+]1 ZINC000087809571 643675879 /nfs/dbraw/zinc/67/58/79/643675879.db2.gz LVBMXVZDTMCOHK-SECBINFHSA-N 1 2 208.309 2.001 20 0 BEADLO COc1ccc[nH+]c1NCc1ccc(O)cc1 ZINC000166331905 643683854 /nfs/dbraw/zinc/68/38/54/643683854.db2.gz STIQSWXQNOOUIT-UHFFFAOYSA-N 1 2 230.267 2.408 20 0 BEADLO Cn1c[nH+]cc1COc1cccnc1Cl ZINC000085191516 643690381 /nfs/dbraw/zinc/69/03/81/643690381.db2.gz CSKZFEJUFBUHFT-UHFFFAOYSA-N 1 2 223.663 2.048 20 0 BEADLO O=c1cc(C[NH2+][C@H]2CCCC2(F)F)cc[nH]1 ZINC000922128564 643867385 /nfs/dbraw/zinc/86/73/85/643867385.db2.gz IUWMSYTZYCPIHE-VIFPVBQESA-N 1 2 228.242 2.065 20 0 BEADLO CC(C)(C)CC(=O)OCc1ccc[nH+]c1N ZINC000922180225 643893510 /nfs/dbraw/zinc/89/35/10/643893510.db2.gz XAIDFVTTWOVBRS-UHFFFAOYSA-N 1 2 222.288 2.143 20 0 BEADLO Nc1[nH+]cccc1COC(=O)CC1CCCC1 ZINC000922179562 643893609 /nfs/dbraw/zinc/89/36/09/643893609.db2.gz XPRPYHHMOJLDJG-UHFFFAOYSA-N 1 2 234.299 2.287 20 0 BEADLO CC/C=C(\C)C(=O)OCc1ccc[nH+]c1N ZINC000922229747 643911298 /nfs/dbraw/zinc/91/12/98/643911298.db2.gz MBRVPFXNYQOGHP-WEVVVXLNSA-N 1 2 220.272 2.063 20 0 BEADLO CCC/C(C)=C\C(=O)OCc1ccc(N)[nH+]c1 ZINC000922384042 643983169 /nfs/dbraw/zinc/98/31/69/643983169.db2.gz ZVWPIMNUVVBNNZ-YFHOEESVSA-N 1 2 234.299 2.453 20 0 BEADLO CCC/C(C)=C\C(=O)OCc1ccc[nH+]c1N ZINC000922381487 643983882 /nfs/dbraw/zinc/98/38/82/643983882.db2.gz DIPAUFFGRXXNSK-NTMALXAHSA-N 1 2 234.299 2.453 20 0 BEADLO C[C@@H]1CC/C(=C/C(=O)OCc2ccc(N)[nH+]c2)C1 ZINC000922516445 644006607 /nfs/dbraw/zinc/00/66/07/644006607.db2.gz HQFMYNFDJLTWBO-PAKSIRSJSA-N 1 2 246.310 2.453 20 0 BEADLO CCCC1(C(=O)OCc2ccc[nH+]c2N)CC1 ZINC000922528920 644017127 /nfs/dbraw/zinc/01/71/27/644017127.db2.gz HEKBETJOGKMAHT-UHFFFAOYSA-N 1 2 234.299 2.287 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@H](c2ccccn2)C2CC2)n1 ZINC000922583122 644033901 /nfs/dbraw/zinc/03/39/01/644033901.db2.gz UIDGAQTWBOVKON-AWEZNQCLSA-N 1 2 242.326 2.354 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)OCc1ccc(N)[nH+]c1 ZINC000922594133 644038215 /nfs/dbraw/zinc/03/82/15/644038215.db2.gz UCAXTJQKZJOWOJ-UWVGGRQHSA-N 1 2 236.315 2.389 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1C(=O)OCc1ccc[nH+]c1N ZINC000922625388 644044897 /nfs/dbraw/zinc/04/48/97/644044897.db2.gz ZQWYTNBNKDBGDB-BXUZGUMPSA-N 1 2 248.326 2.389 20 0 BEADLO COCc1cc(C[NH2+]C(C)(C)/C=C/Cl)no1 ZINC000922643774 644048655 /nfs/dbraw/zinc/04/86/55/644048655.db2.gz CKGDSSOMLPLXTP-SNAWJCMRSA-N 1 2 244.722 2.442 20 0 BEADLO COc1nccnc1C[NH2+]C(C)(C)/C=C\Cl ZINC000922645171 644051855 /nfs/dbraw/zinc/05/18/55/644051855.db2.gz NQPBDNFEJNKMNG-PLNGDYQASA-N 1 2 241.722 2.106 20 0 BEADLO CC/C(C)=C\C(=O)OCc1ccc(N)[nH+]c1 ZINC000922777446 644092888 /nfs/dbraw/zinc/09/28/88/644092888.db2.gz SPOADZOPGOEVAN-TWGQIWQCSA-N 1 2 220.272 2.063 20 0 BEADLO CC(C(=O)OCc1ccc[nH+]c1N)=C1CCC1 ZINC000922788398 644096594 /nfs/dbraw/zinc/09/65/94/644096594.db2.gz WHWOCEGBABWGRL-UHFFFAOYSA-N 1 2 232.283 2.207 20 0 BEADLO Nc1[nH+]cccc1COC(=O)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000922811218 644099197 /nfs/dbraw/zinc/09/91/97/644099197.db2.gz OXNQFIWDVORBGF-CKYFFXLPSA-N 1 2 246.310 2.143 20 0 BEADLO Nc1[nH+]cccc1COC(=O)C1CC2(CCC2)C1 ZINC000922834325 644112441 /nfs/dbraw/zinc/11/24/41/644112441.db2.gz KTLKLZVCXKZTKJ-UHFFFAOYSA-N 1 2 246.310 2.287 20 0 BEADLO CC1(C)CC[C@H]1C(=O)OCc1ccc[nH+]c1N ZINC000922865866 644120629 /nfs/dbraw/zinc/12/06/29/644120629.db2.gz KRLRTTHFUDLLOE-JTQLQIEISA-N 1 2 234.299 2.143 20 0 BEADLO CC[C@@H](C)[C@@H](C(=O)OC)[N@H+](C)Cc1ccoc1 ZINC000929328127 644146483 /nfs/dbraw/zinc/14/64/83/644146483.db2.gz OIEHJHAUAFRCAX-PWSUYJOCSA-N 1 2 239.315 2.299 20 0 BEADLO CC[C@@H](C)[C@@H](C(=O)OC)[N@@H+](C)Cc1ccoc1 ZINC000929328127 644146486 /nfs/dbraw/zinc/14/64/86/644146486.db2.gz OIEHJHAUAFRCAX-PWSUYJOCSA-N 1 2 239.315 2.299 20 0 BEADLO Nc1[nH+]cccc1COC(=O)C1CCC=CCC1 ZINC000922923235 644188884 /nfs/dbraw/zinc/18/88/84/644188884.db2.gz AJRAEGNDOZESQT-UHFFFAOYSA-N 1 2 246.310 2.453 20 0 BEADLO Cc1cc(F)c(C[NH2+]Cc2cn[nH]c2)c(F)c1 ZINC000922948035 644199102 /nfs/dbraw/zinc/19/91/02/644199102.db2.gz VMCGFWSDIBPYPS-UHFFFAOYSA-N 1 2 237.253 2.286 20 0 BEADLO CCc1onc(C)c1C[NH2+]Cc1cnc(C)o1 ZINC000922982039 644214815 /nfs/dbraw/zinc/21/48/15/644214815.db2.gz MDVZTCAFJSVQHH-UHFFFAOYSA-N 1 2 235.287 2.132 20 0 BEADLO Cc1cc(NC(=O)C[C@H]2CCCOC2)cc[nH+]1 ZINC000193241063 644224902 /nfs/dbraw/zinc/22/49/02/644224902.db2.gz HXIKZKIZKZGGBG-LLVKDONJSA-N 1 2 234.299 2.145 20 0 BEADLO c1ccc(C[NH2+]Cc2noc3c2COCC3)cc1 ZINC000923015258 644234308 /nfs/dbraw/zinc/23/43/08/644234308.db2.gz PUORQZVSHZRMGB-UHFFFAOYSA-N 1 2 244.294 2.037 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC[C@@H](C)C(C)(C)C ZINC000923333858 644355720 /nfs/dbraw/zinc/35/57/20/644355720.db2.gz YFRBIZQVIOXOCT-SECBINFHSA-N 1 2 237.347 2.059 20 0 BEADLO O=C(OCCn1cc[nH+]c1)C1(C2CC2)CCC1 ZINC000923336743 644357230 /nfs/dbraw/zinc/35/72/30/644357230.db2.gz JLCWSWMLGTYWSL-UHFFFAOYSA-N 1 2 234.299 2.007 20 0 BEADLO Cc1cc(F)cc(C(=O)OCc2c[nH+]cn2C)c1 ZINC000085987091 644454665 /nfs/dbraw/zinc/45/46/65/644454665.db2.gz XPHDBLXPUHAKOD-UHFFFAOYSA-N 1 2 248.257 2.225 20 0 BEADLO CCc1noc(-c2ccc(-n3cc[nH+]c3)cc2)n1 ZINC000199298768 644473627 /nfs/dbraw/zinc/47/36/27/644473627.db2.gz XLVDLJIASSXXQX-UHFFFAOYSA-N 1 2 240.266 2.485 20 0 BEADLO C[C@H](C(=O)O[C@@H]1CC[N@H+](CCF)C1)C1CCC1 ZINC000838875540 644546928 /nfs/dbraw/zinc/54/69/28/644546928.db2.gz YJZDMBFLLIZOCH-CMPLNLGQSA-N 1 2 243.322 2.010 20 0 BEADLO C[C@H](C(=O)O[C@@H]1CC[N@@H+](CCF)C1)C1CCC1 ZINC000838875540 644546930 /nfs/dbraw/zinc/54/69/30/644546930.db2.gz YJZDMBFLLIZOCH-CMPLNLGQSA-N 1 2 243.322 2.010 20 0 BEADLO C[C@@H](C(=O)O[C@H]1CC[N@H+](CCF)C1)C1CCC1 ZINC000838875543 644547362 /nfs/dbraw/zinc/54/73/62/644547362.db2.gz YJZDMBFLLIZOCH-PWSUYJOCSA-N 1 2 243.322 2.010 20 0 BEADLO C[C@@H](C(=O)O[C@H]1CC[N@@H+](CCF)C1)C1CCC1 ZINC000838875543 644547371 /nfs/dbraw/zinc/54/73/71/644547371.db2.gz YJZDMBFLLIZOCH-PWSUYJOCSA-N 1 2 243.322 2.010 20 0 BEADLO CC[C@@H](C)[C@@H](C)C(=O)OCc1c[nH+]cn1C ZINC000780400776 644730365 /nfs/dbraw/zinc/73/03/65/644730365.db2.gz LTZYNZMVDYEORE-NXEZZACHSA-N 1 2 224.304 2.146 20 0 BEADLO C[C@H]1CC[C@@H]1Nc1ccc(N2CCOCC2)c[nH+]1 ZINC000783279632 644751724 /nfs/dbraw/zinc/75/17/24/644751724.db2.gz YTYKCIMIVIHMTL-AAEUAGOBSA-N 1 2 247.342 2.129 20 0 BEADLO CCC(C)(C)CC(=O)OCCc1c[nH+]cn1C ZINC000793238867 644801295 /nfs/dbraw/zinc/80/12/95/644801295.db2.gz RIDPRJGHLBATHN-UHFFFAOYSA-N 1 2 238.331 2.332 20 0 BEADLO C[C@H]1CC/C(=C/C(=O)OCCc2c[nH+]cn2C)C1 ZINC000793237896 644801441 /nfs/dbraw/zinc/80/14/41/644801441.db2.gz LEOZEJNOYDHNKH-LCFDYFRESA-N 1 2 248.326 2.252 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)C1(C)CCCC1 ZINC000793240497 644801633 /nfs/dbraw/zinc/80/16/33/644801633.db2.gz FUIDYEUWVUVLHX-UHFFFAOYSA-N 1 2 236.315 2.086 20 0 BEADLO CC1=C(C(=O)OCCc2c[nH+]cn2C)CCC1 ZINC000793238418 644801735 /nfs/dbraw/zinc/80/17/35/644801735.db2.gz NRFMDBAOLVFOFY-UHFFFAOYSA-N 1 2 234.299 2.006 20 0 BEADLO Cc1cc(F)cc2c1C[N@H+](CCF)CC2 ZINC000800471549 644834678 /nfs/dbraw/zinc/83/46/78/644834678.db2.gz BFCRXTQLXARVPA-UHFFFAOYSA-N 1 2 211.255 2.462 20 0 BEADLO Cc1cc(F)cc2c1C[N@@H+](CCF)CC2 ZINC000800471549 644834684 /nfs/dbraw/zinc/83/46/84/644834684.db2.gz BFCRXTQLXARVPA-UHFFFAOYSA-N 1 2 211.255 2.462 20 0 BEADLO COC(=O)[C@H]([NH2+]CCSC(C)(C)C)C(C)C ZINC000304448441 644909347 /nfs/dbraw/zinc/90/93/47/644909347.db2.gz VCHFJUDQPMCCAQ-SNVBAGLBSA-N 1 2 247.404 2.305 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2CC23CC3)c(N(C)C)[nH+]1 ZINC000817438881 644980530 /nfs/dbraw/zinc/98/05/30/644980530.db2.gz FLTCYLYAVDUQDL-JTQLQIEISA-N 1 2 245.326 2.195 20 0 BEADLO COc1cc(C)ccc1C[N@H+](C)CCF ZINC000824440356 645055998 /nfs/dbraw/zinc/05/59/98/645055998.db2.gz ZMLJIUPYKZHDGS-UHFFFAOYSA-N 1 2 211.280 2.405 20 0 BEADLO COc1cc(C)ccc1C[N@@H+](C)CCF ZINC000824440356 645056001 /nfs/dbraw/zinc/05/60/01/645056001.db2.gz ZMLJIUPYKZHDGS-UHFFFAOYSA-N 1 2 211.280 2.405 20 0 BEADLO CCCCN(C(=O)Cc1[nH]cc[nH+]1)[C@H](C)CC ZINC000826883641 645068215 /nfs/dbraw/zinc/06/82/15/645068215.db2.gz YLCRTNNVTMJZAX-LLVKDONJSA-N 1 2 237.347 2.379 20 0 BEADLO C[C@@H](CC(=O)OC[C@H]1C[C@H]1C)n1cc[nH+]c1 ZINC000845453826 645364001 /nfs/dbraw/zinc/36/40/01/645364001.db2.gz VZDKLQHGKOZFIN-OUAUKWLOSA-N 1 2 222.288 2.033 20 0 BEADLO CCn1nc(C)c([C@H](C)[NH2+]CC(C)(C)F)n1 ZINC000926780712 645427441 /nfs/dbraw/zinc/42/74/41/645427441.db2.gz RMAJAOAQVOVYQA-QMMMGPOBSA-N 1 2 228.315 2.005 20 0 BEADLO Cc1noc([C@@H](C)[N@H+](C)C[C@@H]2CCC=CO2)n1 ZINC000848926573 645444082 /nfs/dbraw/zinc/44/40/82/645444082.db2.gz ZTNVGIKOAOFOIW-KOLCDFICSA-N 1 2 237.303 2.064 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+](C)C[C@@H]2CCC=CO2)n1 ZINC000848926573 645444091 /nfs/dbraw/zinc/44/40/91/645444091.db2.gz ZTNVGIKOAOFOIW-KOLCDFICSA-N 1 2 237.303 2.064 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)o1 ZINC000930251578 645535554 /nfs/dbraw/zinc/53/55/54/645535554.db2.gz LNWUFCVVKCHHFP-AXFHLTTASA-N 1 2 238.331 2.235 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)o1 ZINC000930251578 645535561 /nfs/dbraw/zinc/53/55/61/645535561.db2.gz LNWUFCVVKCHHFP-AXFHLTTASA-N 1 2 238.331 2.235 20 0 BEADLO CCc1onc(C)c1C[NH2+][C@H](C)c1cn(C)cn1 ZINC000927130065 645562387 /nfs/dbraw/zinc/56/23/87/645562387.db2.gz BTUYHGAWLPTKBY-SNVBAGLBSA-N 1 2 248.330 2.130 20 0 BEADLO CCC[C@H](CC)C(=O)NCc1ccc(N)[nH+]c1 ZINC000927778140 645654342 /nfs/dbraw/zinc/65/43/42/645654342.db2.gz TWGCXAKRDRIBRJ-NSHDSACASA-N 1 2 235.331 2.106 20 0 BEADLO CO[C@H]1C[C@@H]([N@H+](C)Cc2scnc2Cl)C1 ZINC000878600530 645820671 /nfs/dbraw/zinc/82/06/71/645820671.db2.gz ACEPVPRSRDTCLF-OCAPTIKFSA-N 1 2 246.763 2.406 20 0 BEADLO CO[C@H]1C[C@@H]([N@@H+](C)Cc2scnc2Cl)C1 ZINC000878600530 645820674 /nfs/dbraw/zinc/82/06/74/645820674.db2.gz ACEPVPRSRDTCLF-OCAPTIKFSA-N 1 2 246.763 2.406 20 0 BEADLO CC(C)c1ccc(NC(=O)Cc2[nH]cc[nH+]2)cn1 ZINC000928617937 645849033 /nfs/dbraw/zinc/84/90/33/645849033.db2.gz CCIXBXQMLUTYBP-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO C[C@H](c1ccc(F)nc1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000929124472 645959465 /nfs/dbraw/zinc/95/94/65/645959465.db2.gz JFHCJCHQESAPCM-OUAUKWLOSA-N 1 2 238.306 2.391 20 0 BEADLO C[C@H](c1ccc(F)nc1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000929124472 645959473 /nfs/dbraw/zinc/95/94/73/645959473.db2.gz JFHCJCHQESAPCM-OUAUKWLOSA-N 1 2 238.306 2.391 20 0 BEADLO CCN(CC)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000929141315 645968989 /nfs/dbraw/zinc/96/89/89/645968989.db2.gz GJTXYOWHYHVJJJ-UHFFFAOYSA-N 1 2 217.272 2.045 20 0 BEADLO C[C@H](c1nc(CC2CCCC2)no1)[NH+](C)C ZINC000924082769 645975363 /nfs/dbraw/zinc/97/53/63/645975363.db2.gz CFKCHDWBFNVOET-SECBINFHSA-N 1 2 223.320 2.425 20 0 BEADLO O=C(OCCn1cc[nH+]c1)[C@@H]1CC[C@@H]2C[C@@H]2CC1 ZINC000924369217 646025077 /nfs/dbraw/zinc/02/50/77/646025077.db2.gz LDACCZMFMHGBPJ-XYYAHUGASA-N 1 2 248.326 2.253 20 0 BEADLO CC[N@H+](Cc1c(F)cncc1F)C1CC1 ZINC000929255553 646035549 /nfs/dbraw/zinc/03/55/49/646035549.db2.gz RDIAKUITSWJUEQ-UHFFFAOYSA-N 1 2 212.243 2.344 20 0 BEADLO CC[N@@H+](Cc1c(F)cncc1F)C1CC1 ZINC000929255553 646035558 /nfs/dbraw/zinc/03/55/58/646035558.db2.gz RDIAKUITSWJUEQ-UHFFFAOYSA-N 1 2 212.243 2.344 20 0 BEADLO C[C@@H]([NH2+]Cc1ccc2c(c1)OCO2)c1ncco1 ZINC000924538166 646057353 /nfs/dbraw/zinc/05/73/53/646057353.db2.gz TXLJOBRQKMWQSV-SECBINFHSA-N 1 2 246.266 2.254 20 0 BEADLO Cc1nc(C[NH2+][C@@H](C)c2ccnnc2)cs1 ZINC000924720945 646095168 /nfs/dbraw/zinc/09/51/68/646095168.db2.gz BYXLASPWTBBWFP-QMMMGPOBSA-N 1 2 234.328 2.092 20 0 BEADLO CC(C)n1cc([C@@H](C)[NH2+]Cc2ccoc2)nn1 ZINC000924747829 646100106 /nfs/dbraw/zinc/10/01/06/646100106.db2.gz MCFZNJLEBBLZBN-SNVBAGLBSA-N 1 2 234.303 2.303 20 0 BEADLO COc1ccnc([C@@H](C)[NH2+]Cc2cc(C)no2)c1 ZINC000924959819 646144108 /nfs/dbraw/zinc/14/41/08/646144108.db2.gz MHFLHHJPEASTFD-SNVBAGLBSA-N 1 2 247.298 2.237 20 0 BEADLO C[C@@H]([NH2+]Cc1cccc(CO)c1)c1ncco1 ZINC000924972647 646147490 /nfs/dbraw/zinc/14/74/90/646147490.db2.gz NQEBMTANPHCZCF-SNVBAGLBSA-N 1 2 232.283 2.018 20 0 BEADLO Clc1ccnc2c1CC[C@@H]2[NH2+]Cc1cc[nH]n1 ZINC000924993175 646152877 /nfs/dbraw/zinc/15/28/77/646152877.db2.gz PIYUQRZASGLSJV-NSHDSACASA-N 1 2 248.717 2.235 20 0 BEADLO C[C@@H]([NH2+]Cc1cc[nH]n1)c1cc(O)cc(F)c1 ZINC000924994945 646155983 /nfs/dbraw/zinc/15/59/83/646155983.db2.gz YMTMCHBLQNEVSD-MRVPVSSYSA-N 1 2 235.262 2.105 20 0 BEADLO CCc1onc(C)c1C[N@H+]1CCOC[C@H]1CC ZINC000929659368 646229332 /nfs/dbraw/zinc/22/93/32/646229332.db2.gz HMYGYJSTRNNAGA-LLVKDONJSA-N 1 2 238.331 2.156 20 0 BEADLO CCc1onc(C)c1C[N@@H+]1CCOC[C@H]1CC ZINC000929659368 646229338 /nfs/dbraw/zinc/22/93/38/646229338.db2.gz HMYGYJSTRNNAGA-LLVKDONJSA-N 1 2 238.331 2.156 20 0 BEADLO Fc1cncc(F)c1C[N@H+]1CC[C@H](C(F)F)C1 ZINC000930127596 646450573 /nfs/dbraw/zinc/45/05/73/646450573.db2.gz VEEPFLCWRJDQHL-ZETCQYMHSA-N 1 2 248.223 2.447 20 0 BEADLO Fc1cncc(F)c1C[N@@H+]1CC[C@H](C(F)F)C1 ZINC000930127596 646450577 /nfs/dbraw/zinc/45/05/77/646450577.db2.gz VEEPFLCWRJDQHL-ZETCQYMHSA-N 1 2 248.223 2.447 20 0 BEADLO C[C@H]([NH2+]Cc1cocn1)c1cnn(C2CCC2)c1 ZINC000925869491 646520913 /nfs/dbraw/zinc/52/09/13/646520913.db2.gz MCILSEAODKNYQO-JTQLQIEISA-N 1 2 246.314 2.447 20 0 BEADLO COc1ccc[nH+]c1NC1CC2(C1)CO[C@@H](C)C2 ZINC000925955985 646548133 /nfs/dbraw/zinc/54/81/33/646548133.db2.gz KTCFLVLCKFQAJP-IFQILLTASA-N 1 2 248.326 2.460 20 0 BEADLO C[C@@H]([NH2+]C1CC(F)(F)C1)c1ncco1 ZINC000926285518 646611646 /nfs/dbraw/zinc/61/16/46/646611646.db2.gz QMMBPRLWVHXJOA-ZCFIWIBFSA-N 1 2 202.204 2.123 20 0 BEADLO O[C@H](C[N@H+](Cc1ccoc1)C1CC1)C(F)(F)F ZINC000723768412 711536951 /nfs/dbraw/zinc/53/69/51/711536951.db2.gz CTDBHTPJWMUBDK-SNVBAGLBSA-N 1 2 249.232 2.167 20 0 BEADLO O[C@H](C[N@@H+](Cc1ccoc1)C1CC1)C(F)(F)F ZINC000723768412 711536954 /nfs/dbraw/zinc/53/69/54/711536954.db2.gz CTDBHTPJWMUBDK-SNVBAGLBSA-N 1 2 249.232 2.167 20 0 BEADLO CC(C)CCN(C(=O)C[C@H]([NH3+])C(F)F)C1CC1 ZINC000724760537 711610817 /nfs/dbraw/zinc/61/08/17/711610817.db2.gz YIUKKHKYYWZHTA-JTQLQIEISA-N 1 2 248.317 2.006 20 0 BEADLO Cc1[nH]c(CN(C)C[C@H]2CCCCO2)c(C)[nH+]1 ZINC000724782502 711612647 /nfs/dbraw/zinc/61/26/47/711612647.db2.gz CHTXLUCTLHQQAS-GFCCVEGCSA-N 1 2 237.347 2.027 20 0 BEADLO Cc1ncoc1C[N@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000894420216 711771378 /nfs/dbraw/zinc/77/13/78/711771378.db2.gz LXQACCNQJJNIIV-WPRPVWTQSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1ncoc1C[N@@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000894420216 711771380 /nfs/dbraw/zinc/77/13/80/711771380.db2.gz LXQACCNQJJNIIV-WPRPVWTQSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1conc1C[NH2+][C@@H](C)c1cncs1 ZINC000708237706 712183898 /nfs/dbraw/zinc/18/38/98/712183898.db2.gz YOEAMRNPDNUPHX-QMMMGPOBSA-N 1 2 223.301 2.290 20 0 BEADLO CCCOC(=O)[C@@H](C)[NH2+]C1(C(C)C)CC1 ZINC000378863054 712364631 /nfs/dbraw/zinc/36/46/31/712364631.db2.gz UTYSUAOBWKFSIJ-SNVBAGLBSA-N 1 2 213.321 2.106 20 0 BEADLO C[N@H+](C/C(Cl)=C/Cl)CC1(CO)CC1 ZINC000379353820 712375306 /nfs/dbraw/zinc/37/53/06/712375306.db2.gz GLMZGSYAIHCIKE-YWEYNIOJSA-N 1 2 224.131 2.010 20 0 BEADLO C[N@@H+](C/C(Cl)=C/Cl)CC1(CO)CC1 ZINC000379353820 712375308 /nfs/dbraw/zinc/37/53/08/712375308.db2.gz GLMZGSYAIHCIKE-YWEYNIOJSA-N 1 2 224.131 2.010 20 0 BEADLO c1cn(C[C@H]2CCC3(CCC3)CO2)c[nH+]1 ZINC000716287725 712553597 /nfs/dbraw/zinc/55/35/97/712553597.db2.gz VQHIPDZNLWHAFN-LLVKDONJSA-N 1 2 206.289 2.232 20 0 BEADLO Fc1cccc(C[NH2+]Cc2ccco2)n1 ZINC000390008650 712693836 /nfs/dbraw/zinc/69/38/36/712693836.db2.gz YAHSAZHSRHCXDP-UHFFFAOYSA-N 1 2 206.220 2.104 20 0 BEADLO Cc1ncc(C[NH2+]Cc2cnc(Cl)s2)o1 ZINC000718837200 712784987 /nfs/dbraw/zinc/78/49/87/712784987.db2.gz QVUWQFJTFRTJGV-UHFFFAOYSA-N 1 2 243.719 2.383 20 0 BEADLO C[C@H]1CC[N@H+](Cc2cnc(Cl)s2)CCO1 ZINC000720495405 712847487 /nfs/dbraw/zinc/84/74/87/712847487.db2.gz LSOWZRLJYNAQAU-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2cnc(Cl)s2)CCO1 ZINC000720495405 712847490 /nfs/dbraw/zinc/84/74/90/712847490.db2.gz LSOWZRLJYNAQAU-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO CCOC1CC2(C[C@H]2Nc2cc[nH+]cc2F)C1 ZINC000721202007 712898437 /nfs/dbraw/zinc/89/84/37/712898437.db2.gz NXFXVPCGUKRFKC-BKDHPRRPSA-N 1 2 236.290 2.012 20 0 BEADLO CC[C@@H]1CC[C@@H]1[NH2+][C@@H](C)C(=O)OCC(C)C ZINC000381407773 710634412 /nfs/dbraw/zinc/63/44/12/710634412.db2.gz SVZJWMGCRWBGFO-TUAOUCFPSA-N 1 2 227.348 2.352 20 0 BEADLO Cc1occc1C[NH2+]Cc1ncc(Cl)n1C ZINC000381501153 710647844 /nfs/dbraw/zinc/64/78/44/710647844.db2.gz PCJKJPFAHIZUPS-UHFFFAOYSA-N 1 2 239.706 2.265 20 0 BEADLO CC[NH2+]Cc1noc(/C=C/C(C)(C)C)n1 ZINC000381637735 710665804 /nfs/dbraw/zinc/66/58/04/710665804.db2.gz XPOBKHMUMWQGDL-VOTSOKGWSA-N 1 2 209.293 2.238 20 0 BEADLO CCc1cccc(NC(=O)C[C@H]([NH3+])C(F)F)c1 ZINC000724763336 710746410 /nfs/dbraw/zinc/74/64/10/710746410.db2.gz XTHDCLZYKYZFTN-JTQLQIEISA-N 1 2 242.269 2.170 20 0 BEADLO CCn1ccnc1C[NH2+][C@@H](C)c1cncs1 ZINC000385437451 711013475 /nfs/dbraw/zinc/01/34/75/711013475.db2.gz GORQNPBYXXKZLJ-VIFPVBQESA-N 1 2 236.344 2.210 20 0 BEADLO Cc1nc(C)c(C[NH2+][C@H](C)c2nccnc2C)o1 ZINC000385539903 711015364 /nfs/dbraw/zinc/01/53/64/711015364.db2.gz UFSNSPFDHHJUOT-SNVBAGLBSA-N 1 2 246.314 2.241 20 0 BEADLO CC1(C)C[N@H+](C/C(Cl)=C\Cl)CC[C@H]1O ZINC000393688900 711169859 /nfs/dbraw/zinc/16/98/59/711169859.db2.gz GWYLTTDOXNDZGW-WHXYTISESA-N 1 2 238.158 2.398 20 0 BEADLO CC1(C)C[N@@H+](C/C(Cl)=C\Cl)CC[C@H]1O ZINC000393688900 711169861 /nfs/dbraw/zinc/16/98/61/711169861.db2.gz GWYLTTDOXNDZGW-WHXYTISESA-N 1 2 238.158 2.398 20 0 BEADLO O[C@@H](C[NH2+][C@H]1CCCC1(F)F)c1ccccc1 ZINC000398140558 711403136 /nfs/dbraw/zinc/40/31/36/711403136.db2.gz WFUMPAXVEMOSAA-RYUDHWBXSA-N 1 2 241.281 2.497 20 0 BEADLO CC(C)CSCCC[NH2+][C@@]1(C)CCOC1=O ZINC000381463540 710640360 /nfs/dbraw/zinc/64/03/60/710640360.db2.gz KLPQVDFFTNMDAP-LBPRGKRZSA-N 1 2 245.388 2.061 20 0 BEADLO CC[C@H]([NH2+]Cc1cnn(C)n1)c1ccccc1F ZINC000389818700 711090371 /nfs/dbraw/zinc/09/03/71/711090371.db2.gz WOEBVRZCAFSTFO-ZDUSSCGKSA-N 1 2 248.305 2.195 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2nnc(C)[nH]2)cs1 ZINC000392472909 711149306 /nfs/dbraw/zinc/14/93/06/711149306.db2.gz RFJLONCOKUZSOK-QMMMGPOBSA-N 1 2 236.344 2.334 20 0 BEADLO Cn1ncc(CNc2cccc[nH+]2)c1Cl ZINC000393479920 711491985 /nfs/dbraw/zinc/49/19/85/711491985.db2.gz NRZFXRYCQYZSPD-UHFFFAOYSA-N 1 2 222.679 2.081 20 0 BEADLO CC[C@@H](Nc1cc[nH+]cc1F)[C@@H]1CCCOC1 ZINC000723843896 711538712 /nfs/dbraw/zinc/53/87/12/711538712.db2.gz VEBDQDMHESMOHK-ZYHUDNBSSA-N 1 2 238.306 2.260 20 0 BEADLO CNc1cc(N[C@@H]2CC[C@@H](SC)C2)[nH+]cn1 ZINC000234524604 711558898 /nfs/dbraw/zinc/55/88/98/711558898.db2.gz BAUBUIUXQNCDFA-RKDXNWHRSA-N 1 2 238.360 2.214 20 0 BEADLO C[C@@H](CNc1nccs1)Cn1cc[nH+]c1 ZINC000382391879 711584244 /nfs/dbraw/zinc/58/42/44/711584244.db2.gz VFAGGXMOUMKARM-VIFPVBQESA-N 1 2 222.317 2.088 20 0 BEADLO Cc1nc(N[C@@H](CCO)C2CCCC2)cc[nH+]1 ZINC000725035460 711645597 /nfs/dbraw/zinc/64/55/97/711645597.db2.gz BFSPQNAMYFGKKH-LBPRGKRZSA-N 1 2 235.331 2.138 20 0 BEADLO CC(C)=CC[NH2+][C@@H]1CCCc2[nH]ncc21 ZINC000335632738 711728360 /nfs/dbraw/zinc/72/83/60/711728360.db2.gz DBDIYHASXUHKNU-LLVKDONJSA-N 1 2 205.305 2.343 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1CC[C@H](C2CC2)O1 ZINC000722326657 711737806 /nfs/dbraw/zinc/73/78/06/711737806.db2.gz WKVOSMMINGEYMS-NWDGAFQWSA-N 1 2 248.326 2.460 20 0 BEADLO CC[C@H]1CC[N@@H+]1Cc1ccc(Cl)nn1 ZINC000725648576 711758589 /nfs/dbraw/zinc/75/85/89/711758589.db2.gz ZHUBIWHNWNCSOA-VIFPVBQESA-N 1 2 211.696 2.114 20 0 BEADLO CC[C@H]1CC[N@H+]1Cc1ccc(Cl)nn1 ZINC000725648576 711758592 /nfs/dbraw/zinc/75/85/92/711758592.db2.gz ZHUBIWHNWNCSOA-VIFPVBQESA-N 1 2 211.696 2.114 20 0 BEADLO COCC[N@H+](C)Cc1nc(Cl)ccc1Cl ZINC000061630592 711759177 /nfs/dbraw/zinc/75/91/77/711759177.db2.gz NESRMSJZKCOFKU-UHFFFAOYSA-N 1 2 249.141 2.467 20 0 BEADLO COCC[N@@H+](C)Cc1nc(Cl)ccc1Cl ZINC000061630592 711759178 /nfs/dbraw/zinc/75/91/78/711759178.db2.gz NESRMSJZKCOFKU-UHFFFAOYSA-N 1 2 249.141 2.467 20 0 BEADLO CCCSC[C@@H](C)[NH2+][C@@H](C)C(=O)OC(C)C ZINC000894759363 711772145 /nfs/dbraw/zinc/77/21/45/711772145.db2.gz XMWGXFZQOIXVPO-MNOVXSKESA-N 1 2 247.404 2.448 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3ncncc3C2)c(C)o1 ZINC000895723664 711781390 /nfs/dbraw/zinc/78/13/90/711781390.db2.gz ZKPHABKREXRABX-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1cc(C[N@H+]2CCc3ncncc3C2)c(C)o1 ZINC000895723664 711781391 /nfs/dbraw/zinc/78/13/91/711781391.db2.gz ZKPHABKREXRABX-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@]23C[C@H]2CCCC3)[nH+]c1C ZINC000896905450 711783717 /nfs/dbraw/zinc/78/37/17/711783717.db2.gz HNZYUIGBTGFHGD-BXUZGUMPSA-N 1 2 247.342 2.223 20 0 BEADLO CC(C)=CC[NH+]1CC(NC(=O)[C@@]2(C)C=CCC2)C1 ZINC001030798877 711843233 /nfs/dbraw/zinc/84/32/33/711843233.db2.gz UVDULNADUMFEIV-HNNXBMFYSA-N 1 2 248.370 2.109 20 0 BEADLO COCC[N@H+](C)Cn1ccn(C(C)C)c1=S ZINC000921048146 711882084 /nfs/dbraw/zinc/88/20/84/711882084.db2.gz LAMIOIRDGNJMMA-UHFFFAOYSA-N 1 2 243.376 2.136 20 0 BEADLO COCC[N@@H+](C)Cn1ccn(C(C)C)c1=S ZINC000921048146 711882086 /nfs/dbraw/zinc/88/20/86/711882086.db2.gz LAMIOIRDGNJMMA-UHFFFAOYSA-N 1 2 243.376 2.136 20 0 BEADLO C[C@H]1CC=C(C(=O)OCc2ccc(N)[nH+]c2)CC1 ZINC000922793078 711976878 /nfs/dbraw/zinc/97/68/78/711976878.db2.gz ATHJDWMAOCKXDY-JTQLQIEISA-N 1 2 246.310 2.453 20 0 BEADLO C[C@@H](F)CC[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000702552779 712055111 /nfs/dbraw/zinc/05/51/11/712055111.db2.gz CSTHDISJZSRUKR-RKDXNWHRSA-N 1 2 219.300 2.054 20 0 BEADLO COc1ccc[nH+]c1NC1CCC(C)(O)CC1 ZINC000703587370 712079940 /nfs/dbraw/zinc/07/99/40/712079940.db2.gz VNYFEBQKFVJYTO-UHFFFAOYSA-N 1 2 236.315 2.196 20 0 BEADLO COC(C)(C)[C@@H](C)[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000707230259 712166998 /nfs/dbraw/zinc/16/69/98/712166998.db2.gz ORMZQVLWDLBQNH-NXEZZACHSA-N 1 2 245.363 2.120 20 0 BEADLO COC[C@H]([NH2+]Cc1nocc1C)c1ccccc1 ZINC000708334658 712188253 /nfs/dbraw/zinc/18/82/53/712188253.db2.gz KMFFQQWMNAQQKZ-AWEZNQCLSA-N 1 2 246.310 2.460 20 0 BEADLO Cc1ccoc1C[NH2+][C@@H](C)c1cn(C)cn1 ZINC000710006908 712239575 /nfs/dbraw/zinc/23/95/75/712239575.db2.gz ORAHHIWZEWWEKL-JTQLQIEISA-N 1 2 219.288 2.172 20 0 BEADLO CNc1cc(NC[C@@H]2CCC3(CCC3)O2)[nH+]cn1 ZINC000711414420 712298670 /nfs/dbraw/zinc/29/86/70/712298670.db2.gz LGALLOWYEAQBHW-JTQLQIEISA-N 1 2 248.330 2.032 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1C=CCC1 ZINC000711786341 712330184 /nfs/dbraw/zinc/33/01/84/712330184.db2.gz MYKXZBFGOHFTRI-JTQLQIEISA-N 1 2 204.273 2.468 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C(=O)NCc1ccc(N)[nH+]c1 ZINC000714404289 712485053 /nfs/dbraw/zinc/48/50/53/712485053.db2.gz LBTNWJXSGXPDIA-PWSUYJOCSA-N 1 2 247.342 2.106 20 0 BEADLO CCCn1cc(C[NH2+]Cc2ccsc2)nn1 ZINC000714509359 712493150 /nfs/dbraw/zinc/49/31/50/712493150.db2.gz SOGYPQMNRDLOPZ-UHFFFAOYSA-N 1 2 236.344 2.039 20 0 BEADLO Nc1cccc2c1cc[nH+]c2N1C[C@@H](F)[C@@H](F)C1 ZINC000714649917 712495064 /nfs/dbraw/zinc/49/50/64/712495064.db2.gz XSHFEZHMRPYZQQ-PHIMTYICSA-N 1 2 249.264 2.313 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2cc[nH]n2)o1 ZINC000036960562 712517643 /nfs/dbraw/zinc/51/76/43/712517643.db2.gz NVBCDNXGLOPXTA-SECBINFHSA-N 1 2 205.261 2.162 20 0 BEADLO C[C@@H]([NH2+]Cc1nccs1)c1ccns1 ZINC000715946018 712545200 /nfs/dbraw/zinc/54/52/00/712545200.db2.gz WBDNDCFOPIGFSH-SSDOTTSWSA-N 1 2 225.342 2.450 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccns1)c1cn(C)cn1 ZINC000716034231 712547169 /nfs/dbraw/zinc/54/71/69/712547169.db2.gz QLKXUGVXSWVMGC-BDAKNGLRSA-N 1 2 236.344 2.288 20 0 BEADLO CC(C)(O)C1CCN(c2cc[nH+]cc2F)CC1 ZINC000716332164 712554933 /nfs/dbraw/zinc/55/49/33/712554933.db2.gz PAYJGYRDCCSWBR-UHFFFAOYSA-N 1 2 238.306 2.208 20 0 BEADLO Cc1n[nH]c(C[NH2+][C@H](C)c2cscn2)c1C ZINC000716452964 712561832 /nfs/dbraw/zinc/56/18/32/712561832.db2.gz YNLGWVJQDPKOQL-SECBINFHSA-N 1 2 236.344 2.334 20 0 BEADLO CC1(C[N@H+](CCO)CC(F)F)CCCC1 ZINC000380033133 712683687 /nfs/dbraw/zinc/68/36/87/712683687.db2.gz QYXZEBQHHPQKEI-UHFFFAOYSA-N 1 2 221.291 2.126 20 0 BEADLO CC1(C[N@@H+](CCO)CC(F)F)CCCC1 ZINC000380033133 712683689 /nfs/dbraw/zinc/68/36/89/712683689.db2.gz QYXZEBQHHPQKEI-UHFFFAOYSA-N 1 2 221.291 2.126 20 0 BEADLO Cn1ncc2c1nc[nH+]c2NC1CCC=CCC1 ZINC000718091856 712742380 /nfs/dbraw/zinc/74/23/80/712742380.db2.gz ANYMXHSLXPFMDV-UHFFFAOYSA-N 1 2 243.314 2.274 20 0 BEADLO CO[C@@]1(CNc2cccc[nH+]2)CCSC1 ZINC000719276844 712803149 /nfs/dbraw/zinc/80/31/49/712803149.db2.gz SYUGFQGUNVJZKC-LLVKDONJSA-N 1 2 224.329 2.016 20 0 BEADLO Fc1c[nH+]ccc1NCc1nc2c(s1)CCC2 ZINC000719534180 712809344 /nfs/dbraw/zinc/80/93/44/712809344.db2.gz ICEKDSQPWUBPEJ-UHFFFAOYSA-N 1 2 249.314 2.200 20 0 BEADLO F[C@H]1C[N@H+](C[C@H]2CCCCO2)CCC1(F)F ZINC001207954762 956892116 /nfs/dbraw/zinc/89/21/16/956892116.db2.gz UEQYRCJFLSKAMG-ZJUUUORDSA-N 1 2 237.265 2.235 20 0 BEADLO F[C@H]1C[N@@H+](C[C@H]2CCCCO2)CCC1(F)F ZINC001207954762 956892123 /nfs/dbraw/zinc/89/21/23/956892123.db2.gz UEQYRCJFLSKAMG-ZJUUUORDSA-N 1 2 237.265 2.235 20 0 BEADLO Cn1ncc2c1C[N@@H+](CCC1CCCC1)C2 ZINC001208694103 957131462 /nfs/dbraw/zinc/13/14/62/957131462.db2.gz KIDSMVQYLPTJLC-UHFFFAOYSA-N 1 2 219.332 2.316 20 0 BEADLO FC1CC[NH+](Cc2cnc(Cl)nc2)CC1 ZINC001139987191 957298815 /nfs/dbraw/zinc/29/88/15/957298815.db2.gz JLBPEYXONSQFFN-UHFFFAOYSA-N 1 2 229.686 2.064 20 0 BEADLO C[C@@H]1CC(OCC[NH+]2CCOCC2)C[C@@H](C)C1 ZINC001210206832 957672887 /nfs/dbraw/zinc/67/28/87/957672887.db2.gz JSYJNQBHQVSTTC-STQMWFEESA-N 1 2 241.375 2.160 20 0 BEADLO COc1cc(F)c(F)cc1C[NH+]1CC(C)C1 ZINC001143387403 958210449 /nfs/dbraw/zinc/21/04/49/958210449.db2.gz GZRFOGGGZAURCT-UHFFFAOYSA-N 1 2 227.254 2.425 20 0 BEADLO C[N@H+](Cc1ccc(O)c(F)c1F)C1CC1 ZINC001140889167 960045851 /nfs/dbraw/zinc/04/58/51/960045851.db2.gz ACEIIVOWNSHFGQ-UHFFFAOYSA-N 1 2 213.227 2.265 20 0 BEADLO C[N@@H+](Cc1ccc(O)c(F)c1F)C1CC1 ZINC001140889167 960045865 /nfs/dbraw/zinc/04/58/65/960045865.db2.gz ACEIIVOWNSHFGQ-UHFFFAOYSA-N 1 2 213.227 2.265 20 0 BEADLO CO[C@@H]1C[N@@H+](Cc2ccc(F)cc2C)C[C@@H]1F ZINC001140777301 960561101 /nfs/dbraw/zinc/56/11/01/960561101.db2.gz LKWODOBDMYWRKC-QWHCGFSZSA-N 1 2 241.281 2.303 20 0 BEADLO CCCOC1CC[NH+](Cc2cocn2)CC1 ZINC001141129859 960876989 /nfs/dbraw/zinc/87/69/89/960876989.db2.gz NYROWKFDASEKAM-UHFFFAOYSA-N 1 2 224.304 2.066 20 0 BEADLO CN(Cc1cccn2cc[nH+]c12)CC(F)F ZINC001142962273 961858311 /nfs/dbraw/zinc/85/83/11/961858311.db2.gz GNKGQFLXMIHJHD-UHFFFAOYSA-N 1 2 225.242 2.031 20 0 BEADLO CO[C@H]1C[N@H+](Cc2cc(C)cc(F)c2)C[C@@H]1F ZINC001143580711 963169549 /nfs/dbraw/zinc/16/95/49/963169549.db2.gz SWSDMPCHVBOPJD-STQMWFEESA-N 1 2 241.281 2.303 20 0 BEADLO CO[C@H]1C[N@@H+](Cc2cc(C)cc(F)c2)C[C@@H]1F ZINC001143580711 963169556 /nfs/dbraw/zinc/16/95/56/963169556.db2.gz SWSDMPCHVBOPJD-STQMWFEESA-N 1 2 241.281 2.303 20 0 BEADLO COc1cccc2c1ccnc2NC=[NH2+] ZINC001157080316 963523110 /nfs/dbraw/zinc/52/31/10/963523110.db2.gz SGEUNDFESZNDMI-UHFFFAOYSA-N 1 2 201.229 2.262 20 0 BEADLO CCC1(Nc2cc(SC)cc[nH+]2)COC1 ZINC001157539643 963653587 /nfs/dbraw/zinc/65/35/87/963653587.db2.gz ADRJBJQTZLSIKT-UHFFFAOYSA-N 1 2 224.329 2.394 20 0 BEADLO CN(C)c1ccc(NCCOC(F)(F)F)[nH+]c1 ZINC001168175308 963916095 /nfs/dbraw/zinc/91/60/95/963916095.db2.gz UKNFCUKZKYOPBK-UHFFFAOYSA-N 1 2 249.236 2.096 20 0 BEADLO CC1CCC([N@@H+]2CCC(=O)[C@H](F)C2)CC1 ZINC001168220644 963994370 /nfs/dbraw/zinc/99/43/70/963994370.db2.gz ZVVVJUDWQSVMQI-VQXHTEKXSA-N 1 2 213.296 2.178 20 0 BEADLO CC1CCC([N@H+]2CCC(=O)[C@H](F)C2)CC1 ZINC001168220644 963994376 /nfs/dbraw/zinc/99/43/76/963994376.db2.gz ZVVVJUDWQSVMQI-VQXHTEKXSA-N 1 2 213.296 2.178 20 0 BEADLO CC[C@H](COC)Nc1[nH+]cc(OC)cc1C ZINC001160936875 964450721 /nfs/dbraw/zinc/45/07/21/964450721.db2.gz ASLCZVQVPBHCPI-SNVBAGLBSA-N 1 2 224.304 2.236 20 0 BEADLO CCC1(CNc2c[nH+]ccc2C)COC1 ZINC001168327459 964456939 /nfs/dbraw/zinc/45/69/39/964456939.db2.gz OBNVVIDGEPTUMT-UHFFFAOYSA-N 1 2 206.289 2.229 20 0 BEADLO FC(F)(F)CNc1ccn2cc[nH+]c2c1 ZINC001161629902 964651237 /nfs/dbraw/zinc/65/12/37/964651237.db2.gz TYLYQHJZUQWDGS-UHFFFAOYSA-N 1 2 215.178 2.309 20 0 BEADLO CC(F)(F)CNc1ccc2c([nH+]1)CCOC2 ZINC001162228167 964883646 /nfs/dbraw/zinc/88/36/46/964883646.db2.gz KTADFSVVGSUBDM-UHFFFAOYSA-N 1 2 228.242 2.221 20 0 BEADLO Cc1cnsc1C[N@@H+](C)Cc1ccncc1 ZINC001233318109 965485623 /nfs/dbraw/zinc/48/56/23/965485623.db2.gz QGGFOZIMHINQGH-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cnsc1C[N@H+](C)Cc1ccncc1 ZINC001233318109 965485630 /nfs/dbraw/zinc/48/56/30/965485630.db2.gz QGGFOZIMHINQGH-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CS[C@H]1CC[C@H]([N@H+](C)Cc2noc(C)n2)C1 ZINC000075919253 1165784560 /nfs/dbraw/zinc/78/45/60/1165784560.db2.gz LXEDGSRCHLCHET-UWVGGRQHSA-N 1 2 241.360 2.094 20 0 BEADLO CS[C@H]1CC[C@H]([N@@H+](C)Cc2noc(C)n2)C1 ZINC000075919253 1165784566 /nfs/dbraw/zinc/78/45/66/1165784566.db2.gz LXEDGSRCHLCHET-UWVGGRQHSA-N 1 2 241.360 2.094 20 0 BEADLO CCc1cc(F)ccc1C[NH+]1CCOCC1 ZINC001249932090 967172706 /nfs/dbraw/zinc/17/27/06/967172706.db2.gz GKFCEGHXKTZGJP-UHFFFAOYSA-N 1 2 223.291 2.220 20 0 BEADLO Cc1cc(C[C@H](C)Nc2c[nH+]c(C)c(N)c2)on1 ZINC001210284691 1165863214 /nfs/dbraw/zinc/86/32/14/1165863214.db2.gz JGNGVAIPUZOWJJ-QMMMGPOBSA-N 1 2 246.314 2.312 20 0 BEADLO Cc1cc(C[C@@H](C)Nc2c[nH+]c(C)c(N)c2)on1 ZINC001210284688 1165863476 /nfs/dbraw/zinc/86/34/76/1165863476.db2.gz JGNGVAIPUZOWJJ-MRVPVSSYSA-N 1 2 246.314 2.312 20 0 BEADLO CNc1cc(F)cc(CCn2cc[nH+]c2)c1 ZINC001250320512 967696763 /nfs/dbraw/zinc/69/67/63/967696763.db2.gz NCOCZLKTUOQURH-UHFFFAOYSA-N 1 2 219.263 2.307 20 0 BEADLO CC(C)CC[C@@H](C)[NH2+]CC(=O)OC(C)C ZINC000068944679 1165894282 /nfs/dbraw/zinc/89/42/82/1165894282.db2.gz AXHORBPIUNGBFS-LLVKDONJSA-N 1 2 215.337 2.352 20 0 BEADLO CCOC(=O)[C@@H]([NH2+][C@@H]1C=CCCC1)C1CC1 ZINC001118229191 968056930 /nfs/dbraw/zinc/05/69/30/968056930.db2.gz YJAPGWCLJFHVFF-NEPJUHHUSA-N 1 2 223.316 2.026 20 0 BEADLO Cn1ccc(C[N@@H+]2CCCC[C@](C)(F)C2)n1 ZINC001206265035 968183413 /nfs/dbraw/zinc/18/34/13/968183413.db2.gz XVGCBXIHBWXEIM-LBPRGKRZSA-N 1 2 225.311 2.134 20 0 BEADLO Cn1ccc(C[N@H+]2CCCC[C@](C)(F)C2)n1 ZINC001206265035 968183420 /nfs/dbraw/zinc/18/34/20/968183420.db2.gz XVGCBXIHBWXEIM-LBPRGKRZSA-N 1 2 225.311 2.134 20 0 BEADLO Cc1ncc(C[NH2+][C@H]2CCc3cccnc32)o1 ZINC000397936892 1165959925 /nfs/dbraw/zinc/95/99/25/1165959925.db2.gz GXGPKCNLDYVWAY-LBPRGKRZSA-N 1 2 229.283 2.155 20 0 BEADLO Nc1[nH+]cccc1-c1cccc(C2OCCO2)c1 ZINC000168034588 1165968371 /nfs/dbraw/zinc/96/83/71/1165968371.db2.gz QLJKJKIERXMDCP-UHFFFAOYSA-N 1 2 242.278 2.376 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2c(c1)OCO2 ZINC000082371195 1166036361 /nfs/dbraw/zinc/03/63/61/1166036361.db2.gz ZUQLFYDIQQWMQO-UHFFFAOYSA-N 1 2 214.224 2.060 20 0 BEADLO CCC[C@@H](O)C[N@@H+]1CCC[C@H](F)C(F)(F)C1 ZINC001252779420 968951016 /nfs/dbraw/zinc/95/10/16/968951016.db2.gz QEOJHMGECKHNSO-ZJUUUORDSA-N 1 2 239.281 2.217 20 0 BEADLO CCC[C@@H](O)C[N@H+]1CCC[C@H](F)C(F)(F)C1 ZINC001252779420 968951027 /nfs/dbraw/zinc/95/10/27/968951027.db2.gz QEOJHMGECKHNSO-ZJUUUORDSA-N 1 2 239.281 2.217 20 0 BEADLO COC(=O)C[NH2+][C@H](C)Cc1ccc(Cl)cc1 ZINC000224352185 1166239990 /nfs/dbraw/zinc/23/99/90/1166239990.db2.gz UWQVXWBBHCPGNT-SECBINFHSA-N 1 2 241.718 2.034 20 0 BEADLO CCCCC[C@@H](O)C[N@@H+]1C[C@@H](F)C[C@H]1CF ZINC001253525222 969202366 /nfs/dbraw/zinc/20/23/66/969202366.db2.gz LDWBRGNUSUERJB-SDDRHHMPSA-N 1 2 235.318 2.310 20 0 BEADLO CCCCC[C@@H](O)C[N@H+]1C[C@@H](F)C[C@H]1CF ZINC001253525222 969202370 /nfs/dbraw/zinc/20/23/70/969202370.db2.gz LDWBRGNUSUERJB-SDDRHHMPSA-N 1 2 235.318 2.310 20 0 BEADLO CC[C@H](CCC(=O)OC)C[N@H+](C)CC(F)F ZINC001208788170 969236336 /nfs/dbraw/zinc/23/63/36/969236336.db2.gz JUOOTNFUMCFYHV-SECBINFHSA-N 1 2 237.290 2.163 20 0 BEADLO CC[C@H](CCC(=O)OC)C[N@@H+](C)CC(F)F ZINC001208788170 969236344 /nfs/dbraw/zinc/23/63/44/969236344.db2.gz JUOOTNFUMCFYHV-SECBINFHSA-N 1 2 237.290 2.163 20 0 BEADLO O=C1CCC[N@@H+](C2CCC(F)(F)CC2)C1 ZINC001254224303 969545462 /nfs/dbraw/zinc/54/54/62/969545462.db2.gz VNPSBRZCPKYSFI-UHFFFAOYSA-N 1 2 217.259 2.229 20 0 BEADLO O=C1CCC[N@H+](C2CCC(F)(F)CC2)C1 ZINC001254224303 969545467 /nfs/dbraw/zinc/54/54/67/969545467.db2.gz VNPSBRZCPKYSFI-UHFFFAOYSA-N 1 2 217.259 2.229 20 0 BEADLO CC(C)(C)OC(=O)C(C)(C)[NH2+][C@@H]1CCSC1 ZINC001255271781 970021869 /nfs/dbraw/zinc/02/18/69/970021869.db2.gz IJVGHRJBNYCFPE-SECBINFHSA-N 1 2 245.388 2.202 20 0 BEADLO CCC[C@@](C)(CC)C(=O)NC1C[NH+](CC)C1 ZINC001267663239 1166605614 /nfs/dbraw/zinc/60/56/14/1166605614.db2.gz LCWBDQHCOBWEDJ-CYBMUJFWSA-N 1 2 226.364 2.023 20 0 BEADLO C[C@H](CC(F)(F)F)[NH+]1CC2(C1)CCCO2 ZINC001255652012 970429440 /nfs/dbraw/zinc/42/94/40/970429440.db2.gz MTAXZXXALSSETA-MRVPVSSYSA-N 1 2 223.238 2.192 20 0 BEADLO CC[N@H+]([C@@H](C)CC(F)(F)F)[C@@H](C)C(=O)OC ZINC001255662988 970442886 /nfs/dbraw/zinc/44/28/86/970442886.db2.gz WYJCZIQPBKJRML-YUMQZZPRSA-N 1 2 241.253 2.211 20 0 BEADLO CC[N@@H+]([C@@H](C)CC(F)(F)F)[C@@H](C)C(=O)OC ZINC001255662988 970442890 /nfs/dbraw/zinc/44/28/90/970442890.db2.gz WYJCZIQPBKJRML-YUMQZZPRSA-N 1 2 241.253 2.211 20 0 BEADLO C[C@@H](C(=O)N1C[C@@H](C)CC1(C)C)n1cc[nH+]c1 ZINC001354113318 1166741384 /nfs/dbraw/zinc/74/13/84/1166741384.db2.gz VVDVKINVYZYHKW-QWRGUYRKSA-N 1 2 235.331 2.091 20 0 BEADLO Cc1cc(N(C)[C@@H](C)CO)[nH+]c2ccccc12 ZINC000379864787 1166804733 /nfs/dbraw/zinc/80/47/33/1166804733.db2.gz MAWBLNFPEZOOJT-NSHDSACASA-N 1 2 230.311 2.360 20 0 BEADLO COC[C@H](C)Nc1cc(C)c2ccccc2[nH+]1 ZINC000379873711 1166807562 /nfs/dbraw/zinc/80/75/62/1166807562.db2.gz QQUBOJRWXCIUFN-NSHDSACASA-N 1 2 230.311 2.412 20 0 BEADLO COC(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000238323734 1166848883 /nfs/dbraw/zinc/84/88/83/1166848883.db2.gz ILMGTPDRXSLKFO-UHFFFAOYSA-N 1 2 217.228 2.051 20 0 BEADLO Cc1cc(N2CC[C@H](CO)C2)[nH+]c2ccccc12 ZINC000380619611 1166883805 /nfs/dbraw/zinc/88/38/05/1166883805.db2.gz NAIBWOIYFUTBKG-LBPRGKRZSA-N 1 2 242.322 2.362 20 0 BEADLO CC/C=C\C[NH2+][C@@H]1CCCc2[nH]ncc21 ZINC000401599153 970709648 /nfs/dbraw/zinc/70/96/48/970709648.db2.gz YYDNTAYCXFZATD-DLRQAJBASA-N 1 2 205.305 2.343 20 0 BEADLO CC[C@H]1CC[C@@H]([N@@H+]2C[C@H](F)C[C@H]2C(=O)OC)C1 ZINC001173280303 975235276 /nfs/dbraw/zinc/23/52/76/975235276.db2.gz LMPNYZJSFHQFPH-QCNOEVLYSA-N 1 2 243.322 2.151 20 0 BEADLO CC[C@H]1CC[C@@H]([N@H+]2C[C@H](F)C[C@H]2C(=O)OC)C1 ZINC001173280303 975235284 /nfs/dbraw/zinc/23/52/84/975235284.db2.gz LMPNYZJSFHQFPH-QCNOEVLYSA-N 1 2 243.322 2.151 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H]2CCCC2(C)C)[nH+]c1C ZINC000896914203 1167334928 /nfs/dbraw/zinc/33/49/28/1167334928.db2.gz UIXUHGLEPSAOBJ-NSHDSACASA-N 1 2 249.358 2.469 20 0 BEADLO CC[NH+]1CC(Oc2ncccc2C2CC2)C1 ZINC001229019858 976659748 /nfs/dbraw/zinc/65/97/48/976659748.db2.gz GTNUEWBVUYWWHX-UHFFFAOYSA-N 1 2 218.300 2.042 20 0 BEADLO CCn1cc(Nc2c[nH+]ccc2OC)cn1 ZINC001174567128 976885225 /nfs/dbraw/zinc/88/52/25/976885225.db2.gz NYHIKBGEIPXKTP-UHFFFAOYSA-N 1 2 218.260 2.050 20 0 BEADLO COc1ccc(F)c(OC2C[NH+](C(C)C)C2)c1 ZINC001228788949 1167415488 /nfs/dbraw/zinc/41/54/88/1167415488.db2.gz WTBIGOHPRPQFOK-UHFFFAOYSA-N 1 2 239.290 2.306 20 0 BEADLO C[Si](C)(C)c1ccc[nH+]c1NC1CSC1 ZINC001168359782 1167538726 /nfs/dbraw/zinc/53/87/26/1167538726.db2.gz MFAPBKDDXSGART-UHFFFAOYSA-N 1 2 238.432 2.154 20 0 BEADLO CC(=O)Nc1cc(Nc2cscn2)cc[nH+]1 ZINC001175939992 977800604 /nfs/dbraw/zinc/80/06/04/977800604.db2.gz ATZOAFWRBUPKQV-UHFFFAOYSA-N 1 2 234.284 2.240 20 0 BEADLO Cc1cc(F)ncc1C[N@@H+]1C[C@@H](C)[C@@H](F)C1 ZINC001231979936 977823300 /nfs/dbraw/zinc/82/33/00/977823300.db2.gz LUSQMBHCFWIUOT-KOLCDFICSA-N 1 2 226.270 2.319 20 0 BEADLO Clc1cnc(Cl)c(Nc2[nH]cc[nH+]2)n1 ZINC001176082220 977880551 /nfs/dbraw/zinc/88/05/51/977880551.db2.gz ZXZLECRWIGGULA-UHFFFAOYSA-N 1 2 230.058 2.250 20 0 BEADLO C[N@H+](Cc1nc(Cl)ccc1F)[C@@H]1CCOC1 ZINC001232158922 977898607 /nfs/dbraw/zinc/89/86/07/977898607.db2.gz AAPLJNPKVGXWPR-MRVPVSSYSA-N 1 2 244.697 2.095 20 0 BEADLO C[N@@H+](Cc1nc(Cl)ccc1F)[C@@H]1CCOC1 ZINC001232158922 977898609 /nfs/dbraw/zinc/89/86/09/977898609.db2.gz AAPLJNPKVGXWPR-MRVPVSSYSA-N 1 2 244.697 2.095 20 0 BEADLO Cc1scnc1C[NH+]1CC2(CCC2)C1 ZINC001232211277 977940201 /nfs/dbraw/zinc/94/02/01/977940201.db2.gz ZZHQREPIUIXFDR-UHFFFAOYSA-N 1 2 208.330 2.437 20 0 BEADLO F[C@@H]1CCCC[N@H+](Cc2cnsc2)C1 ZINC001232224220 977952146 /nfs/dbraw/zinc/95/21/46/977952146.db2.gz IBHMYOLVFJOZIE-SNVBAGLBSA-N 1 2 214.309 2.467 20 0 BEADLO F[C@@H]1CCCC[N@@H+](Cc2cnsc2)C1 ZINC001232224220 977952151 /nfs/dbraw/zinc/95/21/51/977952151.db2.gz IBHMYOLVFJOZIE-SNVBAGLBSA-N 1 2 214.309 2.467 20 0 BEADLO Cc1c(F)cc(C[N@@H+](C)C2(C)COC2)cc1F ZINC001232422651 978057630 /nfs/dbraw/zinc/05/76/30/978057630.db2.gz DZZXZKJYTZKWAD-UHFFFAOYSA-N 1 2 241.281 2.494 20 0 BEADLO Cc1c(F)cc(C[N@H+](C)C2(C)COC2)cc1F ZINC001232422651 978057640 /nfs/dbraw/zinc/05/76/40/978057640.db2.gz DZZXZKJYTZKWAD-UHFFFAOYSA-N 1 2 241.281 2.494 20 0 BEADLO O[C@H]1CCC[N@H+](Cc2ccc(C(F)(F)F)o2)C1 ZINC001232441028 978075860 /nfs/dbraw/zinc/07/58/60/978075860.db2.gz KNEZBRFGZDDTPH-QMMMGPOBSA-N 1 2 249.232 2.255 20 0 BEADLO O[C@H]1CCC[N@@H+](Cc2ccc(C(F)(F)F)o2)C1 ZINC001232441028 978075868 /nfs/dbraw/zinc/07/58/68/978075868.db2.gz KNEZBRFGZDDTPH-QMMMGPOBSA-N 1 2 249.232 2.255 20 0 BEADLO O[C@@H]1CCC[N@H+](Cc2ccc(C(F)(F)F)o2)C1 ZINC001232442839 978079871 /nfs/dbraw/zinc/07/98/71/978079871.db2.gz KNEZBRFGZDDTPH-MRVPVSSYSA-N 1 2 249.232 2.255 20 0 BEADLO O[C@@H]1CCC[N@@H+](Cc2ccc(C(F)(F)F)o2)C1 ZINC001232442839 978079886 /nfs/dbraw/zinc/07/98/86/978079886.db2.gz KNEZBRFGZDDTPH-MRVPVSSYSA-N 1 2 249.232 2.255 20 0 BEADLO Cc1[nH]c(CN2CC[C@H](C)C(F)(F)C2)c[nH+]1 ZINC001232460457 978103604 /nfs/dbraw/zinc/10/36/04/978103604.db2.gz QWSCURQQCCETGA-QMMMGPOBSA-N 1 2 229.274 2.195 20 0 BEADLO Cc1[nH]cc(CN2CC[C@H](C)C(F)(F)C2)[nH+]1 ZINC001232460457 978103613 /nfs/dbraw/zinc/10/36/13/978103613.db2.gz QWSCURQQCCETGA-QMMMGPOBSA-N 1 2 229.274 2.195 20 0 BEADLO CC[C@H](C)[C@H](C(=O)OC)[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC001168466340 1167758255 /nfs/dbraw/zinc/75/82/55/1167758255.db2.gz NEHRWNPWTSCIPL-WHOHXGKFSA-N 1 2 245.338 2.254 20 0 BEADLO CC[C@H](C)[C@H](C(=O)OC)[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC001168466340 1167758260 /nfs/dbraw/zinc/75/82/60/1167758260.db2.gz NEHRWNPWTSCIPL-WHOHXGKFSA-N 1 2 245.338 2.254 20 0 BEADLO C[C@@H]1C[N@H+](CCc2ccc(F)cc2F)CCO1 ZINC001337566260 978407349 /nfs/dbraw/zinc/40/73/49/978407349.db2.gz HLOGZMSFSWKYCN-SNVBAGLBSA-N 1 2 241.281 2.228 20 0 BEADLO C[C@@H]1C[N@@H+](CCc2ccc(F)cc2F)CCO1 ZINC001337566260 978407360 /nfs/dbraw/zinc/40/73/60/978407360.db2.gz HLOGZMSFSWKYCN-SNVBAGLBSA-N 1 2 241.281 2.228 20 0 BEADLO O[C@@H]1C[N@H+](Cc2ccsc2Cl)CC[C@H]1F ZINC001233053394 978449350 /nfs/dbraw/zinc/44/93/50/978449350.db2.gz ILRFLOJGJKBHOU-RKDXNWHRSA-N 1 2 249.738 2.306 20 0 BEADLO O[C@@H]1C[N@@H+](Cc2ccsc2Cl)CC[C@H]1F ZINC001233053394 978449357 /nfs/dbraw/zinc/44/93/57/978449357.db2.gz ILRFLOJGJKBHOU-RKDXNWHRSA-N 1 2 249.738 2.306 20 0 BEADLO OC1CC2(C1)C[NH+](Cc1ccsc1Cl)C2 ZINC001233054964 978450466 /nfs/dbraw/zinc/45/04/66/978450466.db2.gz HOMZYCFXLSTHOD-UHFFFAOYSA-N 1 2 243.759 2.358 20 0 BEADLO CCc1cccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)n1 ZINC001235251903 1167784834 /nfs/dbraw/zinc/78/48/34/1167784834.db2.gz VHLBPCLUFKZTAG-VXGBXAGGSA-N 1 2 234.343 2.253 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc(F)c(F)cc2N)C[C@@H]1F ZINC001233378341 978591066 /nfs/dbraw/zinc/59/10/66/978591066.db2.gz OZWZMUUXTRDABU-HQJQHLMTSA-N 1 2 244.260 2.337 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc(F)c(F)cc2N)C[C@@H]1F ZINC001233378341 978591072 /nfs/dbraw/zinc/59/10/72/978591072.db2.gz OZWZMUUXTRDABU-HQJQHLMTSA-N 1 2 244.260 2.337 20 0 BEADLO FC1CC[NH+](Cc2cncc(Cl)n2)CC1 ZINC001233447046 978608252 /nfs/dbraw/zinc/60/82/52/978608252.db2.gz RKTNVIWESVVVGX-UHFFFAOYSA-N 1 2 229.686 2.064 20 0 BEADLO FC1(F)CCN(Cc2cccn3cc[nH+]c23)C1 ZINC001142944002 1168276089 /nfs/dbraw/zinc/27/60/89/1168276089.db2.gz GAFBIUHIYLVFNF-UHFFFAOYSA-N 1 2 237.253 2.175 20 0 BEADLO Clc1nccnc1C[NH+]1CCCCC1 ZINC001236607512 979678381 /nfs/dbraw/zinc/67/83/81/979678381.db2.gz IIPZTXIYCBEJPS-UHFFFAOYSA-N 1 2 211.696 2.116 20 0 BEADLO Cc1cc(Cl)cc(C[N@H+](C)CCF)n1 ZINC001236635968 979685001 /nfs/dbraw/zinc/68/50/01/979685001.db2.gz GZQYFBWKUZVTNX-UHFFFAOYSA-N 1 2 216.687 2.445 20 0 BEADLO Cc1cc(Cl)cc(C[N@@H+](C)CCF)n1 ZINC001236635968 979685003 /nfs/dbraw/zinc/68/50/03/979685003.db2.gz GZQYFBWKUZVTNX-UHFFFAOYSA-N 1 2 216.687 2.445 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc(F)c(O)c2)C[C@@H]1F ZINC001236700980 979697611 /nfs/dbraw/zinc/69/76/11/979697611.db2.gz ACQMBJOCVRZLHW-KCJUWKMLSA-N 1 2 227.254 2.321 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc(F)c(O)c2)C[C@@H]1F ZINC001236700980 979697614 /nfs/dbraw/zinc/69/76/14/979697614.db2.gz ACQMBJOCVRZLHW-KCJUWKMLSA-N 1 2 227.254 2.321 20 0 BEADLO CC[C@@H]1CCCCN1C(=O)[C@H](C)n1cc[nH+]c1 ZINC000053898615 1168329144 /nfs/dbraw/zinc/32/91/44/1168329144.db2.gz AOPTUFZYZGYKKC-NWDGAFQWSA-N 1 2 235.331 2.235 20 0 BEADLO Cc1coc(C[N@@H+]2CCC(F)(F)[C@H](C)C2)n1 ZINC001237635512 979984973 /nfs/dbraw/zinc/98/49/73/979984973.db2.gz OQKTYUPALTYTPN-MRVPVSSYSA-N 1 2 230.258 2.460 20 0 BEADLO Cc1coc(C[N@H+]2CCC(F)(F)[C@H](C)C2)n1 ZINC001237635512 979984985 /nfs/dbraw/zinc/98/49/85/979984985.db2.gz OQKTYUPALTYTPN-MRVPVSSYSA-N 1 2 230.258 2.460 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@H]2C)c(Cl)n1 ZINC001237791257 980048046 /nfs/dbraw/zinc/04/80/46/980048046.db2.gz FOYCMIIUHDPBSQ-MRVPVSSYSA-N 1 2 226.707 2.338 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@H]2C)c(Cl)n1 ZINC001237791257 980048054 /nfs/dbraw/zinc/04/80/54/980048054.db2.gz FOYCMIIUHDPBSQ-MRVPVSSYSA-N 1 2 226.707 2.338 20 0 BEADLO Fc1c[nH+]ccc1NC[C@H]1CCC2(CCC2)O1 ZINC000711481245 1168406707 /nfs/dbraw/zinc/40/67/07/1168406707.db2.gz KWEQNQAKZFMQEM-SNVBAGLBSA-N 1 2 236.290 2.156 20 0 BEADLO Cc1cc(C[NH+]2CC(CO)C2)c(F)cc1Cl ZINC001238303576 980235219 /nfs/dbraw/zinc/23/52/19/980235219.db2.gz QTJNQFRDPNRHGA-UHFFFAOYSA-N 1 2 243.709 2.212 20 0 BEADLO COc1c(F)c(F)ccc1C[NH+]1CC=CC1 ZINC001238467571 980273308 /nfs/dbraw/zinc/27/33/08/980273308.db2.gz TXJJQGZISFHGMO-UHFFFAOYSA-N 1 2 225.238 2.345 20 0 BEADLO Cc1cc(C[NH2+]Cc2cscn2)ccn1 ZINC000391194694 1168487205 /nfs/dbraw/zinc/48/72/05/1168487205.db2.gz VCOVNAIXQKPUFM-UHFFFAOYSA-N 1 2 219.313 2.136 20 0 BEADLO C[NH+](C)Cc1nnc([C@@H]2C[C@H]2C2CCC2)o1 ZINC001346662409 980877849 /nfs/dbraw/zinc/87/78/49/980877849.db2.gz MVSAHATULWZFKV-VHSXEESVSA-N 1 2 221.304 2.035 20 0 BEADLO C[C@H](C(=O)N[C@@H](C)CC(C)(C)C)n1cc[nH+]c1 ZINC001348024999 981253500 /nfs/dbraw/zinc/25/35/00/981253500.db2.gz XXDQEKSDWWRUOG-WDEREUQCSA-N 1 2 237.347 2.385 20 0 BEADLO Oc1cccc2sc(Nc3[nH]cc[nH+]3)nc21 ZINC001176080189 1168702878 /nfs/dbraw/zinc/70/28/78/1168702878.db2.gz QRKPCUARGSPUNG-UHFFFAOYSA-N 1 2 232.268 2.469 20 0 BEADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1ncc[nH]1 ZINC001203980043 1168846888 /nfs/dbraw/zinc/84/68/88/1168846888.db2.gz KGFZCHTZTVFORQ-NSHDSACASA-N 1 2 227.311 2.357 20 0 BEADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1ncc[nH]1 ZINC001203980043 1168846899 /nfs/dbraw/zinc/84/68/99/1168846899.db2.gz KGFZCHTZTVFORQ-NSHDSACASA-N 1 2 227.311 2.357 20 0 BEADLO Cc1n[nH]c(C[N@H+]2C[C@@H](C)OC(C)(C)C2)c1C ZINC001353582379 982897334 /nfs/dbraw/zinc/89/73/34/982897334.db2.gz SNRSAXBACWUGIK-SECBINFHSA-N 1 2 237.347 2.026 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2C[C@@H](C)OC(C)(C)C2)c1C ZINC001353582379 982897335 /nfs/dbraw/zinc/89/73/35/982897335.db2.gz SNRSAXBACWUGIK-SECBINFHSA-N 1 2 237.347 2.026 20 0 BEADLO CCc1ncsc1Nc1ccc(N)[nH+]c1 ZINC001201284710 983156764 /nfs/dbraw/zinc/15/67/64/983156764.db2.gz XGWXMDBLJKZJST-UHFFFAOYSA-N 1 2 220.301 2.426 20 0 BEADLO Cc1cc(F)cc(N2CCO[C@@H](C(C)C)C2)[nH+]1 ZINC001354153726 983176770 /nfs/dbraw/zinc/17/67/70/983176770.db2.gz WVPNWFQYAGNNTF-GFCCVEGCSA-N 1 2 238.306 2.390 20 0 BEADLO CCC[C@@H](C)C[NH+]1CC(O)(C(F)(F)F)C1 ZINC001201539061 983293144 /nfs/dbraw/zinc/29/31/44/983293144.db2.gz OPKUAUPIXZWOEJ-MRVPVSSYSA-N 1 2 225.254 2.032 20 0 BEADLO COC(=O)[C@@H]1C[C@@H](F)C[N@@H+]1[C@H](C)CCC(C)C ZINC001256363120 970765348 /nfs/dbraw/zinc/76/53/48/970765348.db2.gz GWQPJXMUHQVYQU-UTUOFQBUSA-N 1 2 245.338 2.397 20 0 BEADLO COC(=O)[C@@H]1C[C@@H](F)C[N@H+]1[C@H](C)CCC(C)C ZINC001256363120 970765358 /nfs/dbraw/zinc/76/53/58/970765358.db2.gz GWQPJXMUHQVYQU-UTUOFQBUSA-N 1 2 245.338 2.397 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2[nH]nc(C)c2C)[C@@H](C)CO1 ZINC001331548633 974757898 /nfs/dbraw/zinc/75/78/98/974757898.db2.gz MJUBDVGPNQHSSS-JOYOIKCWSA-N 1 2 237.347 2.026 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2[nH]nc(C)c2C)[C@@H](C)CO1 ZINC001331548633 974757904 /nfs/dbraw/zinc/75/79/04/974757904.db2.gz MJUBDVGPNQHSSS-JOYOIKCWSA-N 1 2 237.347 2.026 20 0 BEADLO CC[NH+]1CC(Oc2cc(C(F)(F)F)ccn2)C1 ZINC001226005061 974756754 /nfs/dbraw/zinc/75/67/54/974756754.db2.gz GVPCFFSYGBYIBW-UHFFFAOYSA-N 1 2 246.232 2.183 20 0 BEADLO CC(C)COCC[C@H](C)[NH+]1CC(C)(F)C1 ZINC001172474014 974769818 /nfs/dbraw/zinc/76/98/18/974769818.db2.gz NRCLDSOQWBWZOQ-NSHDSACASA-N 1 2 217.328 2.481 20 0 BEADLO CCC[C@H](C)[C@@H]1CCC[N@@H+]1Cc1nc[nH]n1 ZINC001327545936 972624565 /nfs/dbraw/zinc/62/45/65/972624565.db2.gz HONXKUUCNNOUSH-QWRGUYRKSA-N 1 2 222.336 2.205 20 0 BEADLO CCC[C@H](C)[C@@H]1CCC[N@H+]1Cc1nc[nH]n1 ZINC001327545936 972624573 /nfs/dbraw/zinc/62/45/73/972624573.db2.gz HONXKUUCNNOUSH-QWRGUYRKSA-N 1 2 222.336 2.205 20 0 BEADLO CSCC[N@H+](C)Cc1cc(F)c(O)cc1F ZINC001144660038 972937822 /nfs/dbraw/zinc/93/78/22/972937822.db2.gz VIHKZEFLVFAQPL-UHFFFAOYSA-N 1 2 247.310 2.465 20 0 BEADLO CSCC[N@@H+](C)Cc1cc(F)c(O)cc1F ZINC001144660038 972937829 /nfs/dbraw/zinc/93/78/29/972937829.db2.gz VIHKZEFLVFAQPL-UHFFFAOYSA-N 1 2 247.310 2.465 20 0 BEADLO COc1ncc(-c2ccc[nH+]c2N)c2cc[nH]c21 ZINC001243474047 970765626 /nfs/dbraw/zinc/76/56/26/970765626.db2.gz IGKYXJXBPULSMO-UHFFFAOYSA-N 1 2 240.266 2.216 20 0 BEADLO CC1CC(N(C)C(=O)c2cc3c[nH+]ccc3[nH]2)C1 ZINC001151968229 1169412076 /nfs/dbraw/zinc/41/20/76/1169412076.db2.gz DKUFIUAVJXOYJT-UHFFFAOYSA-N 1 2 243.310 2.433 20 0 BEADLO Nc1[nH+]cccc1-c1ccc(-c2nnco2)cc1 ZINC001243476354 970771269 /nfs/dbraw/zinc/77/12/69/970771269.db2.gz QCAMBDMZTUBMHS-UHFFFAOYSA-N 1 2 238.250 2.381 20 0 BEADLO COCc1cc[nH+]c(NCCCOC(C)C)c1 ZINC001157870666 970847847 /nfs/dbraw/zinc/84/78/47/970847847.db2.gz NCSIAEWUDGWYBL-UHFFFAOYSA-N 1 2 238.331 2.455 20 0 BEADLO Cc1cc(CO)cc(-c2nc3[nH]ccc3c[nH+]2)c1 ZINC001243697762 970851450 /nfs/dbraw/zinc/85/14/50/970851450.db2.gz HHJRRQCTJRQOPD-UHFFFAOYSA-N 1 2 239.278 2.377 20 0 BEADLO CCOC(=O)c1cc(C)cnc1C1=C[NH2+]CCC1 ZINC001243946973 971036564 /nfs/dbraw/zinc/03/65/64/971036564.db2.gz CBVRLZIVSYSSKB-UHFFFAOYSA-N 1 2 246.310 2.291 20 0 BEADLO CC[C@@H](CCC(=O)OC)C[N@@H+]1CCC(F)(F)C1 ZINC001208776949 1169506003 /nfs/dbraw/zinc/50/60/03/1169506003.db2.gz AALARJDXCXGVDV-JTQLQIEISA-N 1 2 249.301 2.307 20 0 BEADLO CC[C@@H](CCC(=O)OC)C[N@H+]1CCC(F)(F)C1 ZINC001208776949 1169506014 /nfs/dbraw/zinc/50/60/14/1169506014.db2.gz AALARJDXCXGVDV-JTQLQIEISA-N 1 2 249.301 2.307 20 0 BEADLO CC[C@@H](CCC(=O)OC)C[NH+]1CC(C)(F)C1 ZINC001208776356 1169507582 /nfs/dbraw/zinc/50/75/82/1169507582.db2.gz DJRYLIHVTYJTRA-JTQLQIEISA-N 1 2 231.311 2.010 20 0 BEADLO Cc1cc(Cl)ncc1C[N@H+](C)CCF ZINC001209635158 1169515811 /nfs/dbraw/zinc/51/58/11/1169515811.db2.gz BPTUFFVFRJTRSI-UHFFFAOYSA-N 1 2 216.687 2.445 20 0 BEADLO Cc1cc(Cl)ncc1C[N@@H+](C)CCF ZINC001209635158 1169515813 /nfs/dbraw/zinc/51/58/13/1169515813.db2.gz BPTUFFVFRJTRSI-UHFFFAOYSA-N 1 2 216.687 2.445 20 0 BEADLO Cc1ccc(NC2=CCCOC2)c(C)[nH+]1 ZINC001216504606 971102137 /nfs/dbraw/zinc/10/21/37/971102137.db2.gz HQFHFXWZCIQNCE-UHFFFAOYSA-N 1 2 204.273 2.415 20 0 BEADLO Cc1cn2cccc(NC3=CCCOC3)c2[nH+]1 ZINC001216505346 971106095 /nfs/dbraw/zinc/10/60/95/971106095.db2.gz RRONOUIQFSQCJN-UHFFFAOYSA-N 1 2 229.283 2.359 20 0 BEADLO c1nnc(Nc2c[nH+]cn2Cc2ccccc2)o1 ZINC001216550433 971123776 /nfs/dbraw/zinc/12/37/76/971123776.db2.gz XJYDVVCUUCVGRT-UHFFFAOYSA-N 1 2 241.254 2.058 20 0 BEADLO CC(=O)c1ccc(Nc2[nH+]cc(C)cc2N)cn1 ZINC001210269942 1169521381 /nfs/dbraw/zinc/52/13/81/1169521381.db2.gz CZLKRQJTORFPBT-UHFFFAOYSA-N 1 2 242.282 2.313 20 0 BEADLO C[C@H](C(=O)NCCC1=CCCCC1)n1cc[nH+]c1 ZINC000053898742 971166692 /nfs/dbraw/zinc/16/66/92/971166692.db2.gz MIUFGSSCIUIHHU-GFCCVEGCSA-N 1 2 247.342 2.451 20 0 BEADLO Cc1ccc(CN2CC[NH2+]CC(F)(F)C2)s1 ZINC001210814951 1169529736 /nfs/dbraw/zinc/52/97/36/1169529736.db2.gz LWLBZPMRYKVXTM-UHFFFAOYSA-N 1 2 246.326 2.097 20 0 BEADLO Cc1csc(CN2CC[NH2+]CC(F)(F)C2)c1 ZINC001210814463 1169529975 /nfs/dbraw/zinc/52/99/75/1169529975.db2.gz DHLCCYRTTLFCCG-UHFFFAOYSA-N 1 2 246.326 2.097 20 0 BEADLO CCOC(=O)[C@H](CC)[NH+]1CCC(F)(F)CC1 ZINC000405054032 971188851 /nfs/dbraw/zinc/18/88/51/971188851.db2.gz JUXSZTOAWSFFDH-VIFPVBQESA-N 1 2 235.274 2.059 20 0 BEADLO CCCC[C@H](C(=O)OC)[NH+]1CCC(F)(F)CC1 ZINC000405063432 971193665 /nfs/dbraw/zinc/19/36/65/971193665.db2.gz QIELGRJCBMROSR-SNVBAGLBSA-N 1 2 249.301 2.449 20 0 BEADLO CCCCCC[C@H](C)[N@@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001257374051 971291360 /nfs/dbraw/zinc/29/13/60/971291360.db2.gz YPCAQHWPSAOGSN-SRVKXCTJSA-N 1 2 225.332 2.345 20 0 BEADLO CCCCCC[C@H](C)[N@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001257374051 971291366 /nfs/dbraw/zinc/29/13/66/971291366.db2.gz YPCAQHWPSAOGSN-SRVKXCTJSA-N 1 2 225.332 2.345 20 0 BEADLO CCCC[C@H](CC)[NH2+]C1(C(=O)OC)CC1 ZINC001257410386 971302929 /nfs/dbraw/zinc/30/29/29/971302929.db2.gz RZVICRIDIDZLNK-JTQLQIEISA-N 1 2 213.321 2.250 20 0 BEADLO CCCc1nnc([C@H](COC(C)(C)C)[NH2+]C)o1 ZINC001217718385 971357668 /nfs/dbraw/zinc/35/76/68/971357668.db2.gz VXAPTXVEMHIHQH-VIFPVBQESA-N 1 2 241.335 2.098 20 0 BEADLO Cc1cc(-c2ccc(CO)cc2C)c[nH+]c1N ZINC001244582220 971360467 /nfs/dbraw/zinc/36/04/67/971360467.db2.gz WDBRZZMGUOPZPJ-UHFFFAOYSA-N 1 2 228.295 2.440 20 0 BEADLO CCCCC[C@H](C)N1CC[NH2+]CC(F)(F)C1 ZINC001257511335 971433621 /nfs/dbraw/zinc/43/36/21/971433621.db2.gz IGFHQBROEXVFNM-NSHDSACASA-N 1 2 234.334 2.496 20 0 BEADLO CCCCC[C@H](C)[N@@H+]1CCNCC(F)(F)C1 ZINC001257511335 971433625 /nfs/dbraw/zinc/43/36/25/971433625.db2.gz IGFHQBROEXVFNM-NSHDSACASA-N 1 2 234.334 2.496 20 0 BEADLO CCCCC[C@H](C)[N@H+]1CCNCC(F)(F)C1 ZINC001257511335 971433629 /nfs/dbraw/zinc/43/36/29/971433629.db2.gz IGFHQBROEXVFNM-NSHDSACASA-N 1 2 234.334 2.496 20 0 BEADLO C[C@@H](c1nnc(C2CCCC2)o1)[NH+](C)C ZINC001257533136 971449791 /nfs/dbraw/zinc/44/97/91/971449791.db2.gz ZMHNMNGWBNFHCW-QMMMGPOBSA-N 1 2 209.293 2.350 20 0 BEADLO C[NH+](C)Cc1ncccc1O[C@H]1CCCCC1=O ZINC001225281694 1169584843 /nfs/dbraw/zinc/58/48/43/1169584843.db2.gz ILBYUBJAJORWLQ-AWEZNQCLSA-N 1 2 248.326 2.034 20 0 BEADLO FC1(C2CC2)C[NH+]([C@H]2CCCSC2)C1 ZINC001257668964 971472360 /nfs/dbraw/zinc/47/23/60/971472360.db2.gz XRMCFVOJPRUSAO-JTQLQIEISA-N 1 2 215.337 2.316 20 0 BEADLO Cc1ccc(O[C@@H]2CC[NH2+]CC2(F)F)nc1C ZINC001218008107 971570654 /nfs/dbraw/zinc/57/06/54/971570654.db2.gz WXTKNEFYUFODRI-SNVBAGLBSA-N 1 2 242.269 2.074 20 0 BEADLO Cc1cc(O[C@H]2C[NH2+]CC2(F)F)ncc1Cl ZINC001218237517 971645933 /nfs/dbraw/zinc/64/59/33/971645933.db2.gz VEFUNXQCUPIQOQ-QMMMGPOBSA-N 1 2 248.660 2.029 20 0 BEADLO C[C@H](Oc1cc[nH+]cc1)C1CCOCC1 ZINC001225289698 974361368 /nfs/dbraw/zinc/36/13/68/974361368.db2.gz NFPMJGDMLWMCND-JTQLQIEISA-N 1 2 207.273 2.276 20 0 BEADLO CC[NH+]1CC(Oc2ccc(C(F)(F)F)cn2)C1 ZINC001225326216 974402156 /nfs/dbraw/zinc/40/21/56/974402156.db2.gz ZCJWWGHBFVXYAQ-UHFFFAOYSA-N 1 2 246.232 2.183 20 0 BEADLO CCOC(=O)C1([NH2+][C@@H]2CC[C@@H](C)[C@H](C)C2)CC1 ZINC001172358645 974626469 /nfs/dbraw/zinc/62/64/69/974626469.db2.gz JGZUFHYYHOAISU-IJLUTSLNSA-N 1 2 239.359 2.496 20 0 BEADLO C[N@@H+]1CCC=C(c2cc(F)cc(F)n2)C1 ZINC001241571409 1169733476 /nfs/dbraw/zinc/73/34/76/1169733476.db2.gz YJYLCXJWPOCYFF-UHFFFAOYSA-N 1 2 210.227 2.079 20 0 BEADLO C[N@H+]1CCC=C(c2cc(F)cc(F)n2)C1 ZINC001241571409 1169733482 /nfs/dbraw/zinc/73/34/82/1169733482.db2.gz YJYLCXJWPOCYFF-UHFFFAOYSA-N 1 2 210.227 2.079 20 0 BEADLO CCc1[nH+]ccc(C)c1Nc1ccn(C)c(=O)c1 ZINC001206097923 972224157 /nfs/dbraw/zinc/22/41/57/972224157.db2.gz ILHXYVRETLGNJJ-UHFFFAOYSA-N 1 2 243.310 2.395 20 0 BEADLO COCCn1nccc1Nc1c[nH+]c(C)cc1C ZINC001213510431 957062492 /nfs/dbraw/zinc/06/24/92/957062492.db2.gz CFKHGRRYFJBWQL-UHFFFAOYSA-N 1 2 246.314 2.285 20 0 BEADLO Cn1ncc2c1C[N@H+](CCC1CCCC1)C2 ZINC001208694103 957131454 /nfs/dbraw/zinc/13/14/54/957131454.db2.gz KIDSMVQYLPTJLC-UHFFFAOYSA-N 1 2 219.332 2.316 20 0 BEADLO COCCCC[N@@H+]1CC[C@@H](CF)C(F)(F)C1 ZINC001209214086 957355457 /nfs/dbraw/zinc/35/54/57/957355457.db2.gz KSJGCCJHODETJY-JTQLQIEISA-N 1 2 239.281 2.340 20 0 BEADLO COCCCC[N@H+]1CC[C@@H](CF)C(F)(F)C1 ZINC001209214086 957355464 /nfs/dbraw/zinc/35/54/64/957355464.db2.gz KSJGCCJHODETJY-JTQLQIEISA-N 1 2 239.281 2.340 20 0 BEADLO Cc1cccc2c1C[N@H+](Cc1cncnc1)C2 ZINC001137663502 972264759 /nfs/dbraw/zinc/26/47/59/972264759.db2.gz FZXIKANDIOOGLS-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO Cc1cccc2c1C[N@@H+](Cc1cncnc1)C2 ZINC001137663502 972264763 /nfs/dbraw/zinc/26/47/63/972264763.db2.gz FZXIKANDIOOGLS-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO C[C@H]1C[C@@H]1C[N@@H+]1CCN(C(=O)OC(C)(C)C)C1 ZINC001209429420 957454149 /nfs/dbraw/zinc/45/41/49/957454149.db2.gz WQBMYYMBRSNPFL-WDEREUQCSA-N 1 2 240.347 2.153 20 0 BEADLO C[C@H]1C[C@@H]1C[N@H+]1CCN(C(=O)OC(C)(C)C)C1 ZINC001209429420 957454153 /nfs/dbraw/zinc/45/41/53/957454153.db2.gz WQBMYYMBRSNPFL-WDEREUQCSA-N 1 2 240.347 2.153 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N1C(=O)CCc1[nH+]ccn1C ZINC001346411573 957533676 /nfs/dbraw/zinc/53/36/76/957533676.db2.gz UVCXNTSBWUJRSA-VXGBXAGGSA-N 1 2 249.358 2.142 20 0 BEADLO COc1ccc(C)[nH+]c1N1CC[C@@H]2OCC[C@H]2C1 ZINC001167212783 957545010 /nfs/dbraw/zinc/54/50/10/957545010.db2.gz GPAJLKORMBFWEO-RYUDHWBXSA-N 1 2 248.326 2.014 20 0 BEADLO Cc1nc(N2CC[C@@H]3OCC[C@H]3C2)c(C)c(C)[nH+]1 ZINC001167219515 957550686 /nfs/dbraw/zinc/55/06/86/957550686.db2.gz YOSDFYQRGRKJHO-STQMWFEESA-N 1 2 247.342 2.017 20 0 BEADLO CCOc1ccc[nH+]c1N[C@H](COC)C1CC1 ZINC000397329735 957598089 /nfs/dbraw/zinc/59/80/89/957598089.db2.gz QFYPFLMLPVSLPI-LLVKDONJSA-N 1 2 236.315 2.317 20 0 BEADLO Cc1ccc(Nc2c[nH+]c(C)c(N)c2)cn1 ZINC001210286178 957714601 /nfs/dbraw/zinc/71/46/01/957714601.db2.gz WXANHLXTGRVPHI-UHFFFAOYSA-N 1 2 214.272 2.419 20 0 BEADLO Cc1ccncc1Nc1c[nH+]c(C)c(N)c1 ZINC001210285856 957715814 /nfs/dbraw/zinc/71/58/14/957715814.db2.gz UCFYGQNDYWHIOE-UHFFFAOYSA-N 1 2 214.272 2.419 20 0 BEADLO CCc1[nH+]ccc(C)c1Nc1ccn(C)n1 ZINC001210351087 957729826 /nfs/dbraw/zinc/72/98/26/957729826.db2.gz LIXKYQJWMVYNSF-UHFFFAOYSA-N 1 2 216.288 2.430 20 0 BEADLO c1c(C[NH+]2CC3(CCC3)C2)nc2ccccn12 ZINC001136876106 972288073 /nfs/dbraw/zinc/28/80/73/972288073.db2.gz PVEVEVABXCXCPF-UHFFFAOYSA-N 1 2 227.311 2.320 20 0 BEADLO O=C1CC(Nc2ccc(Cn3cc[nH+]c3)cc2)C1 ZINC001167341117 957796436 /nfs/dbraw/zinc/79/64/36/957796436.db2.gz PLWUPKNYEHSLAX-UHFFFAOYSA-N 1 2 241.294 2.075 20 0 BEADLO COc1cc(Nc2cnoc2C)[nH+]cc1C ZINC001210577998 957800168 /nfs/dbraw/zinc/80/01/68/957800168.db2.gz CRMSSGWLDLDCLZ-UHFFFAOYSA-N 1 2 219.244 2.439 20 0 BEADLO Cc1ccc(Nc2cc3c(cc2N)OCO3)[nH+]c1 ZINC001211011816 957984764 /nfs/dbraw/zinc/98/47/64/957984764.db2.gz CQESEYFJUAXVAG-UHFFFAOYSA-N 1 2 243.266 2.445 20 0 BEADLO COc1c(F)ccc(C[NH+]2CC(C)C2)c1F ZINC001143320874 972308924 /nfs/dbraw/zinc/30/89/24/972308924.db2.gz NRXHPVVUKUTWII-UHFFFAOYSA-N 1 2 227.254 2.425 20 0 BEADLO COC1C[NH+](Cc2c[nH]c3cccc(F)c23)C1 ZINC001136976673 972310780 /nfs/dbraw/zinc/31/07/80/972310780.db2.gz KMRKAKUVLDDAKH-UHFFFAOYSA-N 1 2 234.274 2.138 20 0 BEADLO Clc1cncc(C[N@@H+]2CC[C@@]23CCOC3)c1 ZINC001136997978 972319330 /nfs/dbraw/zinc/31/93/30/972319330.db2.gz YDRPLMCCNYYECP-LBPRGKRZSA-N 1 2 238.718 2.100 20 0 BEADLO Clc1cncc(C[N@H+]2CC[C@@]23CCOC3)c1 ZINC001136997978 972319333 /nfs/dbraw/zinc/31/93/33/972319333.db2.gz YDRPLMCCNYYECP-LBPRGKRZSA-N 1 2 238.718 2.100 20 0 BEADLO Cc1ccc(C[NH2+]Cc2csnn2)cc1C ZINC000398501925 958284346 /nfs/dbraw/zinc/28/43/46/958284346.db2.gz ZXWRORSIZKVERT-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO CC[C@@H](CC(C)C)N[C@H]1C[NH2+]CC1(F)F ZINC001246461279 972335807 /nfs/dbraw/zinc/33/58/07/972335807.db2.gz OMBFGBZIYFMXJN-UWVGGRQHSA-N 1 2 220.307 2.008 20 0 BEADLO COc1ccc(C[N@@H+]2CCCC[C@H]2C(C)=O)cn1 ZINC001137037620 972337659 /nfs/dbraw/zinc/33/76/59/972337659.db2.gz MLJDHAGZEPBKIL-ZDUSSCGKSA-N 1 2 248.326 2.034 20 0 BEADLO COc1ccc(C[N@H+]2CCCC[C@H]2C(C)=O)cn1 ZINC001137037620 972337666 /nfs/dbraw/zinc/33/76/66/972337666.db2.gz MLJDHAGZEPBKIL-ZDUSSCGKSA-N 1 2 248.326 2.034 20 0 BEADLO Cc1cc(N2CCC[C@@H](O)C2)nc(C2CCC2)[nH+]1 ZINC000891430590 958368226 /nfs/dbraw/zinc/36/82/26/958368226.db2.gz HYEFGAWZUSFQSJ-GFCCVEGCSA-N 1 2 247.342 2.014 20 0 BEADLO Cc1ccc(F)c(Cc2nnc(C[NH+](C)C)o2)c1 ZINC001327042115 972377355 /nfs/dbraw/zinc/37/73/55/972377355.db2.gz KJITUTFOWXDOEG-UHFFFAOYSA-N 1 2 249.289 2.170 20 0 BEADLO CC[C@H](C)CCc1nnc(C[NH+](C)C)o1 ZINC001327043293 972378258 /nfs/dbraw/zinc/37/82/58/972378258.db2.gz XYRCMEKIFZRKTD-VIFPVBQESA-N 1 2 211.309 2.110 20 0 BEADLO C[C@@H](OCCn1cc[nH+]c1)c1ccncc1 ZINC001222134544 972379923 /nfs/dbraw/zinc/37/99/23/972379923.db2.gz GBAXVJKCAZIZGA-LLVKDONJSA-N 1 2 217.272 2.056 20 0 BEADLO CC1=CC[C@H](CC[N@@H+]2C[C@@H]3C[C@H]2C(=O)O3)C1(C)C ZINC001207277874 958859222 /nfs/dbraw/zinc/85/92/22/958859222.db2.gz WSYMALZZMIYHBV-AGIUHOORSA-N 1 2 249.354 2.369 20 0 BEADLO CC1=CC[C@H](CC[N@H+]2C[C@@H]3C[C@H]2C(=O)O3)C1(C)C ZINC001207277874 958859233 /nfs/dbraw/zinc/85/92/33/958859233.db2.gz WSYMALZZMIYHBV-AGIUHOORSA-N 1 2 249.354 2.369 20 0 BEADLO CCCC(=O)[C@@H](CCC)OCCn1cc[nH+]c1 ZINC001222134988 972383871 /nfs/dbraw/zinc/38/38/71/972383871.db2.gz UUYTWQSIOFTQKI-CYBMUJFWSA-N 1 2 238.331 2.438 20 0 BEADLO C[C@H](OCCn1cc[nH+]c1)c1ccncc1F ZINC001222139948 972386438 /nfs/dbraw/zinc/38/64/38/972386438.db2.gz ZCPQFEZYLNDPCF-JTQLQIEISA-N 1 2 235.262 2.195 20 0 BEADLO CSCc1cc[nH+]c(NC2CSC2)c1 ZINC000306929076 958928398 /nfs/dbraw/zinc/92/83/98/958928398.db2.gz ATZXOGFQIHGJQQ-UHFFFAOYSA-N 1 2 226.370 2.472 20 0 BEADLO C[C@H]([NH2+]Cc1cnsn1)c1cccs1 ZINC000399801541 958982259 /nfs/dbraw/zinc/98/22/59/958982259.db2.gz VYIUIHYPKBQLAJ-ZETCQYMHSA-N 1 2 225.342 2.450 20 0 BEADLO Cc1cnc(Cl)nc1NCc1cc[nH+]c(N)c1 ZINC001167615849 959078643 /nfs/dbraw/zinc/07/86/43/959078643.db2.gz YDZKQYPKCBHBKM-UHFFFAOYSA-N 1 2 249.705 2.028 20 0 BEADLO Nc1cc(CNc2ccc3cnoc3c2)cc[nH+]1 ZINC001167617360 959082157 /nfs/dbraw/zinc/08/21/57/959082157.db2.gz KPCGUVMDDRHVSC-UHFFFAOYSA-N 1 2 240.266 2.417 20 0 BEADLO CC(C)=CC(=O)NCc1c[nH+]cn1C1CCC1 ZINC001143931734 972425739 /nfs/dbraw/zinc/42/57/39/972425739.db2.gz HGOZDDSEQILMJH-UHFFFAOYSA-N 1 2 233.315 2.191 20 0 BEADLO CC[C@H](CSC)N(C)c1cc(NC)[nH+]cn1 ZINC000167843507 959422453 /nfs/dbraw/zinc/42/24/53/959422453.db2.gz RHNHPYCZEUMNNL-SECBINFHSA-N 1 2 240.376 2.096 20 0 BEADLO CC[C@H](CSC)N(C)c1cc(NC)nc[nH+]1 ZINC000167843507 959422456 /nfs/dbraw/zinc/42/24/56/959422456.db2.gz RHNHPYCZEUMNNL-SECBINFHSA-N 1 2 240.376 2.096 20 0 BEADLO COc1ccc2c(c1)CN(Cc1c[nH+]c(C)[nH]1)C2 ZINC000724782476 959486646 /nfs/dbraw/zinc/48/66/46/959486646.db2.gz AYFPUUWWFSHPOZ-UHFFFAOYSA-N 1 2 243.310 2.243 20 0 BEADLO COc1ccc2c(c1)CN(Cc1c[nH]c(C)[nH+]1)C2 ZINC000724782476 959486653 /nfs/dbraw/zinc/48/66/53/959486653.db2.gz AYFPUUWWFSHPOZ-UHFFFAOYSA-N 1 2 243.310 2.243 20 0 BEADLO O=C1CC[NH+](Cc2ccnc3ccccc23)CC1 ZINC000092347865 959685781 /nfs/dbraw/zinc/68/57/81/959685781.db2.gz LHGJBDFEUMJYKG-UHFFFAOYSA-N 1 2 240.306 2.400 20 0 BEADLO C[C@H]([NH2+]CCCO)C(F)(F)c1ccccc1 ZINC000924536194 959755882 /nfs/dbraw/zinc/75/58/82/959755882.db2.gz LUBJDEPWEARVKP-JTQLQIEISA-N 1 2 229.270 2.139 20 0 BEADLO Nc1cc(N2CC[C@@H](C3CCCCC3)C2)[nH+]cn1 ZINC000708824001 959857584 /nfs/dbraw/zinc/85/75/84/959857584.db2.gz YNKIFUKDOAFMRB-GFCCVEGCSA-N 1 2 246.358 2.465 20 0 BEADLO Nc1cccc2c1cc[nH+]c2N1C[C@@H]2C[C@@H]2C1 ZINC000694675852 959960707 /nfs/dbraw/zinc/96/07/07/959960707.db2.gz ZPYYYRDKLNXJBD-AOOOYVTPSA-N 1 2 225.295 2.273 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1CC[C@H]2[C@@H](C1)C2(F)F ZINC001353016276 960070207 /nfs/dbraw/zinc/07/02/07/960070207.db2.gz ABWLANFASKLRBM-HRDYMLBCSA-N 1 2 242.244 2.488 20 0 BEADLO c1ncc(C[N@@H+]2CCOc3ccccc3C2)o1 ZINC001140931795 960097341 /nfs/dbraw/zinc/09/73/41/960097341.db2.gz RVPPDRKJSTZCPQ-UHFFFAOYSA-N 1 2 230.267 2.069 20 0 BEADLO c1ncc(C[N@H+]2CCOc3ccccc3C2)o1 ZINC001140931795 960097356 /nfs/dbraw/zinc/09/73/56/960097356.db2.gz RVPPDRKJSTZCPQ-UHFFFAOYSA-N 1 2 230.267 2.069 20 0 BEADLO Cc1cnc(C)c(NCC(C)(C)n2cc[nH+]c2)n1 ZINC000692606198 960336431 /nfs/dbraw/zinc/33/64/31/960336431.db2.gz NPJIRCGWCDGQML-UHFFFAOYSA-N 1 2 245.330 2.137 20 0 BEADLO Cc1nc(NC2(C3CCOCC3)CC2)cc[nH+]1 ZINC001167743839 960440924 /nfs/dbraw/zinc/44/09/24/960440924.db2.gz QOJSTHWWZNTZRJ-UHFFFAOYSA-N 1 2 233.315 2.156 20 0 BEADLO C[N@H+](Cc1cc(Cl)ncc1F)[C@H]1CCOC1 ZINC001140610768 960459925 /nfs/dbraw/zinc/45/99/25/960459925.db2.gz MLDAFYWENLIRKE-VIFPVBQESA-N 1 2 244.697 2.095 20 0 BEADLO C[N@@H+](Cc1cc(Cl)ncc1F)[C@H]1CCOC1 ZINC001140610768 960459933 /nfs/dbraw/zinc/45/99/33/960459933.db2.gz MLDAFYWENLIRKE-VIFPVBQESA-N 1 2 244.697 2.095 20 0 BEADLO c1cc2ccncc2c(C[NH+]2CC3(CCO3)C2)c1 ZINC001140644008 960475132 /nfs/dbraw/zinc/47/51/32/960475132.db2.gz URCVPKDBSLIKRE-UHFFFAOYSA-N 1 2 240.306 2.210 20 0 BEADLO c1cc2ccncc2c(C[N@@H+]2CCO[C@@H]3C[C@@H]32)c1 ZINC001140648752 960475735 /nfs/dbraw/zinc/47/57/35/960475735.db2.gz LXKJKOJJPOIXTH-LSDHHAIUSA-N 1 2 240.306 2.208 20 0 BEADLO c1cc2ccncc2c(C[N@H+]2CCO[C@@H]3C[C@@H]32)c1 ZINC001140648752 960475742 /nfs/dbraw/zinc/47/57/42/960475742.db2.gz LXKJKOJJPOIXTH-LSDHHAIUSA-N 1 2 240.306 2.208 20 0 BEADLO CC[C@@H](C)NC(=S)Nc1ccc2[nH+]ccn2c1 ZINC001200468173 960505785 /nfs/dbraw/zinc/50/57/85/960505785.db2.gz CYYGCVZQTSKIKW-SECBINFHSA-N 1 2 248.355 2.419 20 0 BEADLO C[N@H+](CC(=O)c1ccccc1)Cc1cc[nH]c1 ZINC001140708022 960524258 /nfs/dbraw/zinc/52/42/58/960524258.db2.gz NEGPQNPIAIAPMZ-UHFFFAOYSA-N 1 2 228.295 2.329 20 0 BEADLO C[N@@H+](CC(=O)c1ccccc1)Cc1cc[nH]c1 ZINC001140708022 960524271 /nfs/dbraw/zinc/52/42/71/960524271.db2.gz NEGPQNPIAIAPMZ-UHFFFAOYSA-N 1 2 228.295 2.329 20 0 BEADLO CO[C@@H]1C[N@H+](Cc2ccc(F)cc2C)C[C@@H]1F ZINC001140777301 960561096 /nfs/dbraw/zinc/56/10/96/960561096.db2.gz LKWODOBDMYWRKC-QWHCGFSZSA-N 1 2 241.281 2.303 20 0 BEADLO CC[N@H+](Cc1cc(C)n[nH]1)Cc1ccncc1 ZINC001203066481 960571519 /nfs/dbraw/zinc/57/15/19/960571519.db2.gz FOGRFCCKHSWBHC-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CC[N@@H+](Cc1cc(C)n[nH]1)Cc1ccncc1 ZINC001203066481 960571533 /nfs/dbraw/zinc/57/15/33/960571533.db2.gz FOGRFCCKHSWBHC-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO C[C@@H]1C[N@H+](Cc2c[nH]c3ccncc23)[C@@H](C)CO1 ZINC001140805385 960601914 /nfs/dbraw/zinc/60/19/14/960601914.db2.gz CQUFZHMAQGTTSR-WDEREUQCSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2c[nH]c3ccncc23)[C@@H](C)CO1 ZINC001140805385 960601923 /nfs/dbraw/zinc/60/19/23/960601923.db2.gz CQUFZHMAQGTTSR-WDEREUQCSA-N 1 2 245.326 2.172 20 0 BEADLO COc1cc(F)c(C[NH+]2CC(C)C2)c(F)c1 ZINC001140823742 960615638 /nfs/dbraw/zinc/61/56/38/960615638.db2.gz PRKFYNOEGULHBE-UHFFFAOYSA-N 1 2 227.254 2.425 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2[nH]cc(C)c2C)n(C)n1 ZINC001140859964 960637130 /nfs/dbraw/zinc/63/71/30/960637130.db2.gz IZJPXEZUXBFYNK-UHFFFAOYSA-N 1 2 246.358 2.305 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2[nH]cc(C)c2C)n(C)n1 ZINC001140859964 960637139 /nfs/dbraw/zinc/63/71/39/960637139.db2.gz IZJPXEZUXBFYNK-UHFFFAOYSA-N 1 2 246.358 2.305 20 0 BEADLO Cc1c[nH]c(C[N@@H+](C)Cc2cncnc2)c1C ZINC001140863836 960649971 /nfs/dbraw/zinc/64/99/71/960649971.db2.gz CWMAAWCIKSDGFJ-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1c[nH]c(C[N@H+](C)Cc2cncnc2)c1C ZINC001140863836 960649977 /nfs/dbraw/zinc/64/99/77/960649977.db2.gz CWMAAWCIKSDGFJ-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Nc1cccc(F)c1C[N@@H+]1C[C@@H]2C[C@@H]2[C@H](F)C1 ZINC001140873012 960662998 /nfs/dbraw/zinc/66/29/98/960662998.db2.gz PTZWEDCWZBWPKB-HOTUBEGUSA-N 1 2 238.281 2.198 20 0 BEADLO Nc1cccc(F)c1C[N@H+]1C[C@@H]2C[C@@H]2[C@H](F)C1 ZINC001140873012 960663016 /nfs/dbraw/zinc/66/30/16/960663016.db2.gz PTZWEDCWZBWPKB-HOTUBEGUSA-N 1 2 238.281 2.198 20 0 BEADLO Fc1ccc2c(c1)CC[N@@H+](Cc1cnco1)C2 ZINC001140933797 960717729 /nfs/dbraw/zinc/71/77/29/960717729.db2.gz JIADGNGLCAQNTH-UHFFFAOYSA-N 1 2 232.258 2.372 20 0 BEADLO Fc1ccc2c(c1)CC[N@H+](Cc1cnco1)C2 ZINC001140933797 960717732 /nfs/dbraw/zinc/71/77/32/960717732.db2.gz JIADGNGLCAQNTH-UHFFFAOYSA-N 1 2 232.258 2.372 20 0 BEADLO Cn1c[nH+]cc1CO[C@H]1CCC(=O)CC1(C)C ZINC001222595319 960720991 /nfs/dbraw/zinc/72/09/91/960720991.db2.gz WMSHFZKEGQMBAP-LBPRGKRZSA-N 1 2 236.315 2.085 20 0 BEADLO C[C@H](OCc1c[nH+]cn1C)c1cccnc1F ZINC001222601113 960722974 /nfs/dbraw/zinc/72/29/74/960722974.db2.gz XXHGDPHIWUFQFR-VIFPVBQESA-N 1 2 235.262 2.232 20 0 BEADLO CC(C)OCCOC1C[NH+](Cc2ccccc2)C1 ZINC001222670384 960756247 /nfs/dbraw/zinc/75/62/47/960756247.db2.gz YZZDJJYRROOEGW-UHFFFAOYSA-N 1 2 249.354 2.312 20 0 BEADLO FC1(F)CC[C@@H]2C[N@H+](Cc3csnn3)C[C@@H]21 ZINC001140992632 960780838 /nfs/dbraw/zinc/78/08/38/960780838.db2.gz NUWNPJNOHIRANA-APPZFPTMSA-N 1 2 245.298 2.015 20 0 BEADLO FC1(F)CC[C@@H]2C[N@@H+](Cc3csnn3)C[C@@H]21 ZINC001140992632 960780851 /nfs/dbraw/zinc/78/08/51/960780851.db2.gz NUWNPJNOHIRANA-APPZFPTMSA-N 1 2 245.298 2.015 20 0 BEADLO FC1(F)C[C@H]2C[N@@H+](Cc3csnn3)C[C@H]2C1 ZINC001140992777 960789563 /nfs/dbraw/zinc/78/95/63/960789563.db2.gz WWBSTXIQFOXVBA-OCAPTIKFSA-N 1 2 245.298 2.015 20 0 BEADLO FC1(F)C[C@H]2C[N@H+](Cc3csnn3)C[C@H]2C1 ZINC001140992777 960789587 /nfs/dbraw/zinc/78/95/87/960789587.db2.gz WWBSTXIQFOXVBA-OCAPTIKFSA-N 1 2 245.298 2.015 20 0 BEADLO c1coc(C[N@@H+]2CCC[C@@H]2c2ccccn2)n1 ZINC001141008957 960805256 /nfs/dbraw/zinc/80/52/56/960805256.db2.gz QUMVZQMMZFNVIQ-GFCCVEGCSA-N 1 2 229.283 2.407 20 0 BEADLO c1coc(C[N@H+]2CCC[C@@H]2c2ccccn2)n1 ZINC001141008957 960805257 /nfs/dbraw/zinc/80/52/57/960805257.db2.gz QUMVZQMMZFNVIQ-GFCCVEGCSA-N 1 2 229.283 2.407 20 0 BEADLO CCCCc1[nH]c(CN2CCC(=O)[C@H](C)C2)c[nH+]1 ZINC001141068004 960859318 /nfs/dbraw/zinc/85/93/18/960859318.db2.gz VJWBXMIVJKNIRK-LLVKDONJSA-N 1 2 249.358 2.163 20 0 BEADLO CCCCc1[nH]cc(CN2CCC(=O)[C@H](C)C2)[nH+]1 ZINC001141068004 960859322 /nfs/dbraw/zinc/85/93/22/960859322.db2.gz VJWBXMIVJKNIRK-LLVKDONJSA-N 1 2 249.358 2.163 20 0 BEADLO Cc1ccc(C[N@@H+]2CCCC23COC3)c(F)c1 ZINC001141194561 960932483 /nfs/dbraw/zinc/93/24/83/960932483.db2.gz CVUFXUMMJKGRBW-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1ccc(C[N@H+]2CCCC23COC3)c(F)c1 ZINC001141194561 960932511 /nfs/dbraw/zinc/93/25/11/960932511.db2.gz CVUFXUMMJKGRBW-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO c1cn(-c2cccc(CN3CCCCO3)c2)c[nH+]1 ZINC001141238605 961019685 /nfs/dbraw/zinc/01/96/85/961019685.db2.gz NPCDMNZKDIPMNA-UHFFFAOYSA-N 1 2 243.310 2.400 20 0 BEADLO Cc1cncc(C[N@@H+]2CCCC[C@H](F)C2)n1 ZINC001203161268 961098742 /nfs/dbraw/zinc/09/87/42/961098742.db2.gz GTYLDEKGGOCPEY-NSHDSACASA-N 1 2 223.295 2.109 20 0 BEADLO Cc1cncc(C[N@H+]2CCCC[C@H](F)C2)n1 ZINC001203161268 961098763 /nfs/dbraw/zinc/09/87/63/961098763.db2.gz GTYLDEKGGOCPEY-NSHDSACASA-N 1 2 223.295 2.109 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1ccc2cc(F)ccc2n1 ZINC001141640184 961134148 /nfs/dbraw/zinc/13/41/48/961134148.db2.gz QBIQLUGPBNNZIK-UHFFFAOYSA-N 1 2 246.285 2.395 20 0 BEADLO CC(=O)C[N@H+](C)Cc1ccc2cc(F)ccc2n1 ZINC001141640184 961134154 /nfs/dbraw/zinc/13/41/54/961134154.db2.gz QBIQLUGPBNNZIK-UHFFFAOYSA-N 1 2 246.285 2.395 20 0 BEADLO O=C(CCF)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001141767947 961145642 /nfs/dbraw/zinc/14/56/42/961145642.db2.gz IKVCNPAYABBLJH-UHFFFAOYSA-N 1 2 233.246 2.170 20 0 BEADLO COc1ccc2cccnc2c1NC=[NH2+] ZINC001167865541 961341606 /nfs/dbraw/zinc/34/16/06/961341606.db2.gz PWDIFNDGYNRXRN-UHFFFAOYSA-N 1 2 201.229 2.262 20 0 BEADLO COCOCCc1[nH]c2c(cc(F)cc2C)[nH+]1 ZINC001250591648 1169788195 /nfs/dbraw/zinc/78/81/95/1169788195.db2.gz UWQLJILFRLIHIX-UHFFFAOYSA-N 1 2 238.262 2.173 20 0 BEADLO CSc1ncc(C[N@H+](C)C2CC2)c(Cl)n1 ZINC001142408204 961427593 /nfs/dbraw/zinc/42/75/93/961427593.db2.gz BLDDNSIQYJYREH-UHFFFAOYSA-N 1 2 243.763 2.446 20 0 BEADLO CSc1ncc(C[N@@H+](C)C2CC2)c(Cl)n1 ZINC001142408204 961427599 /nfs/dbraw/zinc/42/75/99/961427599.db2.gz BLDDNSIQYJYREH-UHFFFAOYSA-N 1 2 243.763 2.446 20 0 BEADLO O=C(C[NH2+][C@@H]1C[C@H]2C[C@H]2C1)OCc1ccccc1 ZINC001167898585 961530248 /nfs/dbraw/zinc/53/02/48/961530248.db2.gz SQOGNWIZWGIDAF-BTTYYORXSA-N 1 2 245.322 2.118 20 0 BEADLO CC(C)/C=C/C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC001142659933 961564704 /nfs/dbraw/zinc/56/47/04/961564704.db2.gz XOSDETCDVCNTBD-ONEGZZNKSA-N 1 2 247.342 2.328 20 0 BEADLO CC(C)/C=C/C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC001142659933 961564728 /nfs/dbraw/zinc/56/47/28/961564728.db2.gz XOSDETCDVCNTBD-ONEGZZNKSA-N 1 2 247.342 2.328 20 0 BEADLO CC(C)(C)C(=O)NCc1c[nH+]cn1C1CCC1 ZINC001142780924 961745857 /nfs/dbraw/zinc/74/58/57/961745857.db2.gz WLXMLCDYAKLLCL-UHFFFAOYSA-N 1 2 235.331 2.270 20 0 BEADLO COc1cc(C)cc(C[N@@H+]2CCC(=O)[C@H](C)C2)c1 ZINC001143150473 961891964 /nfs/dbraw/zinc/89/19/64/961891964.db2.gz PWJGFMALYMJQLO-GFCCVEGCSA-N 1 2 247.338 2.415 20 0 BEADLO COc1cc(C)cc(C[N@H+]2CCC(=O)[C@H](C)C2)c1 ZINC001143150473 961891965 /nfs/dbraw/zinc/89/19/65/961891965.db2.gz PWJGFMALYMJQLO-GFCCVEGCSA-N 1 2 247.338 2.415 20 0 BEADLO c1ccc2c(c1)C[C@H](COc1cc[nH+]cc1)O2 ZINC001225291409 962048121 /nfs/dbraw/zinc/04/81/21/962048121.db2.gz ULCODWUNILRTJB-CYBMUJFWSA-N 1 2 227.263 2.464 20 0 BEADLO CC(C)[C@@H](O)CNc1ccccc1-n1cc[nH+]c1 ZINC001253752145 1169809296 /nfs/dbraw/zinc/80/92/96/1169809296.db2.gz IBSRZFMCSJMYJI-AWEZNQCLSA-N 1 2 245.326 2.301 20 0 BEADLO C[C@@H](C(=O)Nc1ccc(F)cc1)n1cc[nH+]c1 ZINC000049247800 962580942 /nfs/dbraw/zinc/58/09/42/962580942.db2.gz IKJRNKRHAAKQRI-VIFPVBQESA-N 1 2 233.246 2.222 20 0 BEADLO C[C@H](NC(=O)Cc1[nH]cc[nH+]1)C1CCCCCC1 ZINC001153919587 962662988 /nfs/dbraw/zinc/66/29/88/962662988.db2.gz AXGUOODMMYODKQ-NSHDSACASA-N 1 2 249.358 2.427 20 0 BEADLO FC(F)(F)CNc1ccc2c([nH+]1)CCOC2 ZINC001161625144 962733625 /nfs/dbraw/zinc/73/36/25/962733625.db2.gz BGYFRHSWKVRCCH-UHFFFAOYSA-N 1 2 232.205 2.129 20 0 BEADLO C[C@@H](C(=O)N1CCCCC[C@H]1C)n1cc[nH+]c1 ZINC001154674972 962831792 /nfs/dbraw/zinc/83/17/92/962831792.db2.gz KYRBIERCVXLMRI-NEPJUHHUSA-N 1 2 235.331 2.235 20 0 BEADLO CCc1coc(CNc2cc(COC)cc[nH+]2)n1 ZINC001154778078 962841546 /nfs/dbraw/zinc/84/15/46/962841546.db2.gz AZMMVDPEPXMJRQ-UHFFFAOYSA-N 1 2 247.298 2.391 20 0 BEADLO CCCCNc1cc(CC(=O)OCC)cc[nH+]1 ZINC001154832081 962862184 /nfs/dbraw/zinc/86/21/84/962862184.db2.gz ULYGNWCBOQFGET-UHFFFAOYSA-N 1 2 236.315 2.399 20 0 BEADLO COCc1cc[nH+]c(NCC(C)(F)F)c1 ZINC001154854888 962873021 /nfs/dbraw/zinc/87/30/21/962873021.db2.gz GAGVIPYLVAQOCH-UHFFFAOYSA-N 1 2 216.231 2.295 20 0 BEADLO CCN(CC)c1cc(NCC(C)(F)F)[nH+]cn1 ZINC001154858607 962875509 /nfs/dbraw/zinc/87/55/09/962875509.db2.gz OOHHLFOJNPSVCC-UHFFFAOYSA-N 1 2 244.289 2.390 20 0 BEADLO CCN(CC)c1cc(NCC(C)(F)F)nc[nH+]1 ZINC001154858607 962875517 /nfs/dbraw/zinc/87/55/17/962875517.db2.gz OOHHLFOJNPSVCC-UHFFFAOYSA-N 1 2 244.289 2.390 20 0 BEADLO Cc1oncc1CNc1cc(N)cc(Cl)[nH+]1 ZINC001154883728 962881645 /nfs/dbraw/zinc/88/16/45/962881645.db2.gz FZZPTEMNSOSBGC-UHFFFAOYSA-N 1 2 238.678 2.226 20 0 BEADLO Cc1c[nH+]c(NCCN2CCCCO2)c(C)c1 ZINC001155002064 962936172 /nfs/dbraw/zinc/93/61/72/962936172.db2.gz JAPJGMVBLMRZAK-UHFFFAOYSA-N 1 2 235.331 2.138 20 0 BEADLO COCCOc1cc(NCC(C)C)cc[nH+]1 ZINC001161650409 963031049 /nfs/dbraw/zinc/03/10/49/963031049.db2.gz DVMGPHLIDOZSDA-UHFFFAOYSA-N 1 2 224.304 2.175 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(F)(F)[C@H](N)C2)oc1C ZINC001206654902 963041575 /nfs/dbraw/zinc/04/15/75/963041575.db2.gz FKXIQDZQOXOWPJ-LLVKDONJSA-N 1 2 244.285 2.065 20 0 BEADLO Cc1cc(C[N@H+]2CCC(F)(F)[C@H](N)C2)oc1C ZINC001206654902 963041591 /nfs/dbraw/zinc/04/15/91/963041591.db2.gz FKXIQDZQOXOWPJ-LLVKDONJSA-N 1 2 244.285 2.065 20 0 BEADLO Cc1cccc(CN2CCC(F)(F)[C@@H]([NH3+])C2)c1 ZINC001206655344 963078859 /nfs/dbraw/zinc/07/88/59/963078859.db2.gz HKOSVVHMETXUMG-LBPRGKRZSA-N 1 2 240.297 2.163 20 0 BEADLO Cc1cc(F)cc(C[N@@H+]2CCO[C@@H](C)C2)c1 ZINC001143580412 963159603 /nfs/dbraw/zinc/15/96/03/963159603.db2.gz IXHXVXPCDIJOLN-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cc(F)cc(C[N@H+]2CCO[C@@H](C)C2)c1 ZINC001143580412 963159611 /nfs/dbraw/zinc/15/96/11/963159611.db2.gz IXHXVXPCDIJOLN-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO COc1cc(C)c[nH+]c1NC[C@H]1CCCCO1 ZINC001156377138 963328128 /nfs/dbraw/zinc/32/81/28/963328128.db2.gz AOPICIDLXVFEJI-LLVKDONJSA-N 1 2 236.315 2.380 20 0 BEADLO CC(C)c1ccc(NC2CC(=O)C2)[nH+]c1 ZINC001156616863 963414461 /nfs/dbraw/zinc/41/44/61/963414461.db2.gz UDLCLQRNEROVTL-UHFFFAOYSA-N 1 2 204.273 2.348 20 0 BEADLO CC(C)c1cncnc1NCc1cc[nH+]c(N)c1 ZINC001156757102 963453868 /nfs/dbraw/zinc/45/38/68/963453868.db2.gz LSZFKCGAMMAIJK-UHFFFAOYSA-N 1 2 243.314 2.189 20 0 BEADLO CCCc1ccc(NCc2cc[nH+]c(N)c2)nn1 ZINC001156760073 963453973 /nfs/dbraw/zinc/45/39/73/963453973.db2.gz CDTQVYNUKRVFBN-UHFFFAOYSA-N 1 2 243.314 2.018 20 0 BEADLO Cc1cc(Cl)nc(NCc2cc[nH+]c(N)c2)n1 ZINC001156756159 963454454 /nfs/dbraw/zinc/45/44/54/963454454.db2.gz PVGJNZVRODMMQW-UHFFFAOYSA-N 1 2 249.705 2.028 20 0 BEADLO CCCc1cncnc1NCc1cc[nH+]c(N)c1 ZINC001156757595 963455346 /nfs/dbraw/zinc/45/53/46/963455346.db2.gz XMIGNPPHWZVIRP-UHFFFAOYSA-N 1 2 243.314 2.018 20 0 BEADLO Cc1nc(N2CC3CC(C3)C2)c(C)c(C)[nH+]1 ZINC001156901859 963490245 /nfs/dbraw/zinc/49/02/45/963490245.db2.gz CQEPHXPCUGGWNK-UHFFFAOYSA-N 1 2 217.316 2.248 20 0 BEADLO Cc1cc(NC(C)(C)CCO)nc(C2CC2)[nH+]1 ZINC001156912170 963495370 /nfs/dbraw/zinc/49/53/70/963495370.db2.gz KOMBBNGEFXOXLS-UHFFFAOYSA-N 1 2 235.331 2.235 20 0 BEADLO COc1cc(C)c[nH+]c1NCc1cc(C)n(C)n1 ZINC001156954174 963496986 /nfs/dbraw/zinc/49/69/86/963496986.db2.gz PAQRMEOKSWZACW-UHFFFAOYSA-N 1 2 246.314 2.053 20 0 BEADLO COc1cc(C)c[nH+]c1NC1(CO)CCCC1 ZINC001157009201 963513685 /nfs/dbraw/zinc/51/36/85/963513685.db2.gz ZYDVDKXMJCLJNI-UHFFFAOYSA-N 1 2 236.315 2.116 20 0 BEADLO CCc1ccc(C)[nH+]c1NC1=CCOC1 ZINC001203379522 963522002 /nfs/dbraw/zinc/52/20/02/963522002.db2.gz BROOKUVMRDJASK-UHFFFAOYSA-N 1 2 204.273 2.278 20 0 BEADLO C1=C(Nc2ccc(N3CCCCC3)[nH+]c2)COC1 ZINC001203379614 963524590 /nfs/dbraw/zinc/52/45/90/963524590.db2.gz JYXQBUVDBMCOKC-UHFFFAOYSA-N 1 2 245.326 2.398 20 0 BEADLO CCCOCCNc1ccc(Cl)c(N)[nH+]1 ZINC001157087476 963528820 /nfs/dbraw/zinc/52/88/20/963528820.db2.gz AKDUHVFVVQCPKV-UHFFFAOYSA-N 1 2 229.711 2.156 20 0 BEADLO Cc1c[nH+]c(N2CCC[C@H]3C[C@H]32)nc1NC1CC1 ZINC001157131357 963538563 /nfs/dbraw/zinc/53/85/63/963538563.db2.gz BZIUWPXNDXTMTP-CMPLNLGQSA-N 1 2 244.342 2.348 20 0 BEADLO CN(CCO)c1cc(-c2ccccc2)cc[nH+]1 ZINC001157387287 963591528 /nfs/dbraw/zinc/59/15/28/963591528.db2.gz ZOJCIQZTNNTKKU-UHFFFAOYSA-N 1 2 228.295 2.177 20 0 BEADLO Nc1[nH+]c(NC[C@H]2C[C@H](F)C2)ccc1Cl ZINC001157457927 963617852 /nfs/dbraw/zinc/61/78/52/963617852.db2.gz QSKNBIITUXQSOS-LJGSYFOKSA-N 1 2 229.686 2.477 20 0 BEADLO Cc1c(F)cc[nH+]c1NCc1ccc(=O)[nH]c1 ZINC001157516731 963639885 /nfs/dbraw/zinc/63/98/85/963639885.db2.gz NYDYLXFLCQGSNP-UHFFFAOYSA-N 1 2 233.246 2.242 20 0 BEADLO CSc1cc[nH+]c(NC2CSC2)c1 ZINC001157579468 963668845 /nfs/dbraw/zinc/66/88/45/963668845.db2.gz KRANTGVBTDGYRI-UHFFFAOYSA-N 1 2 212.343 2.331 20 0 BEADLO Cc1nc(NC[C@@H]2CC(C)(C)O2)c2c([nH+]1)CCC2 ZINC001157660328 963693036 /nfs/dbraw/zinc/69/30/36/963693036.db2.gz JKEZHWPOYUZADJ-JTQLQIEISA-N 1 2 247.342 2.253 20 0 BEADLO FC1(CNc2cc3cc[nH]c3c[nH+]2)CCOCC1 ZINC001168122745 963790265 /nfs/dbraw/zinc/79/02/65/963790265.db2.gz MRLXUBQRWIZNFS-UHFFFAOYSA-N 1 2 249.289 2.494 20 0 BEADLO Cc1cc[nH+]c(NCCC2CCC2)c1C(N)=O ZINC001158051802 963800106 /nfs/dbraw/zinc/80/01/06/963800106.db2.gz NFXLLPKYAYZNFU-UHFFFAOYSA-N 1 2 233.315 2.091 20 0 BEADLO COc1cccc(NC(=O)[C@@H](C)n2cc[nH+]c2)c1 ZINC000053898626 963845591 /nfs/dbraw/zinc/84/55/91/963845591.db2.gz UUGPPWSUCOUTHV-SNVBAGLBSA-N 1 2 245.282 2.091 20 0 BEADLO c1nc(C[N@@H+]2CC[C@@H]3CCCO[C@H]3C2)cs1 ZINC001137592681 963880619 /nfs/dbraw/zinc/88/06/19/963880619.db2.gz YZERJLBQTRNQIP-JQWIXIFHSA-N 1 2 238.356 2.144 20 0 BEADLO c1nc(C[N@H+]2CC[C@@H]3CCCO[C@H]3C2)cs1 ZINC001137592681 963880625 /nfs/dbraw/zinc/88/06/25/963880625.db2.gz YZERJLBQTRNQIP-JQWIXIFHSA-N 1 2 238.356 2.144 20 0 BEADLO CN(c1cccc(C2CC2)[nH+]1)[C@H]1CCOC1 ZINC001158573777 963890794 /nfs/dbraw/zinc/89/07/94/963890794.db2.gz IPVNMAKGTFPWJB-NSHDSACASA-N 1 2 218.300 2.184 20 0 BEADLO COc1c[nH+]c(NCc2ncccc2O)c(C)c1 ZINC001158774218 963924081 /nfs/dbraw/zinc/92/40/81/963924081.db2.gz GROUBAFPKRXNEQ-UHFFFAOYSA-N 1 2 245.282 2.111 20 0 BEADLO CC1CCC([N@@H+]2CCC(=O)[C@@H](F)C2)CC1 ZINC001168220643 963995273 /nfs/dbraw/zinc/99/52/73/963995273.db2.gz ZVVVJUDWQSVMQI-ILDUYXDCSA-N 1 2 213.296 2.178 20 0 BEADLO CC1CCC([N@H+]2CCC(=O)[C@@H](F)C2)CC1 ZINC001168220643 963995282 /nfs/dbraw/zinc/99/52/82/963995282.db2.gz ZVVVJUDWQSVMQI-ILDUYXDCSA-N 1 2 213.296 2.178 20 0 BEADLO CC1CCC([N@@H+]2CC[C@H](O)C(F)(F)C2)CC1 ZINC001168219797 963998557 /nfs/dbraw/zinc/99/85/57/963998557.db2.gz OOIARCRYVOGAIE-ILDUYXDCSA-N 1 2 233.302 2.267 20 0 BEADLO CC1CCC([N@H+]2CC[C@H](O)C(F)(F)C2)CC1 ZINC001168219797 963998566 /nfs/dbraw/zinc/99/85/66/963998566.db2.gz OOIARCRYVOGAIE-ILDUYXDCSA-N 1 2 233.302 2.267 20 0 BEADLO CC(C)Oc1cc(N[C@H]2C[C@@H](CO)C2)cc[nH+]1 ZINC001168243999 964049899 /nfs/dbraw/zinc/04/98/99/964049899.db2.gz WPNWGGNTFYBPEX-KLPPZKSPSA-N 1 2 236.315 2.052 20 0 BEADLO Cc1c(F)cc[nH+]c1N[C@@H]1CCOC[C@H]1C ZINC001159711877 964162113 /nfs/dbraw/zinc/16/21/13/964162113.db2.gz URGFZQMNQNHODH-LDYMZIIASA-N 1 2 224.279 2.366 20 0 BEADLO Cc1nc(N[C@@H]2CCOC[C@H]2C)c2c([nH+]1)CCC2 ZINC001159712789 964163785 /nfs/dbraw/zinc/16/37/85/964163785.db2.gz ANPZBPBKYPRULA-BXKDBHETSA-N 1 2 247.342 2.111 20 0 BEADLO CCc1ccc(C[N@@H+]2CC[C@@](C)(O)[C@@H](F)C2)o1 ZINC001204389213 964223509 /nfs/dbraw/zinc/22/35/09/964223509.db2.gz MFRJRAUFUNHGHZ-QWHCGFSZSA-N 1 2 241.306 2.137 20 0 BEADLO CCc1ccc(C[N@H+]2CC[C@@](C)(O)[C@@H](F)C2)o1 ZINC001204389213 964223522 /nfs/dbraw/zinc/22/35/22/964223522.db2.gz MFRJRAUFUNHGHZ-QWHCGFSZSA-N 1 2 241.306 2.137 20 0 BEADLO Cc1ccc(F)c(-c2noc(C[NH+]3CCC3)n2)c1 ZINC001212093108 964250353 /nfs/dbraw/zinc/25/03/53/964250353.db2.gz GGXRBIRVZBOKAY-UHFFFAOYSA-N 1 2 247.273 2.390 20 0 BEADLO Cc1cc(F)ccc1-c1noc(C[NH+]2CCC2)n1 ZINC001212093514 964251159 /nfs/dbraw/zinc/25/11/59/964251159.db2.gz YQLAYIJPCIDSRL-UHFFFAOYSA-N 1 2 247.273 2.390 20 0 BEADLO C=Cc1ccc(NCCC(=O)NC(C)(C)C)[nH+]c1 ZINC001160411515 964299883 /nfs/dbraw/zinc/29/98/83/964299883.db2.gz JSNUCIMXGUZVHA-UHFFFAOYSA-N 1 2 247.342 2.441 20 0 BEADLO CSc1cc[nH+]c(NCC[C@@H](C)CO)c1 ZINC001160608553 964356819 /nfs/dbraw/zinc/35/68/19/964356819.db2.gz XFCNRMOSNDLXFJ-SECBINFHSA-N 1 2 226.345 2.234 20 0 BEADLO Cc1c[nH+]cc(NCc2ccc(=O)[nH]c2)c1C ZINC001168302997 964395261 /nfs/dbraw/zinc/39/52/61/964395261.db2.gz BNWZTBMZIGSNDT-UHFFFAOYSA-N 1 2 229.283 2.411 20 0 BEADLO c1nocc1Nc1cccc2[nH+]c[nH]c21 ZINC001213027004 964421321 /nfs/dbraw/zinc/42/13/21/964421321.db2.gz CWEDUISBYBKWDJ-UHFFFAOYSA-N 1 2 200.201 2.295 20 0 BEADLO CCC1(Nc2cc3cc[nH]c3c[nH+]2)COC1 ZINC001168316308 964436234 /nfs/dbraw/zinc/43/62/34/964436234.db2.gz GHSGEXQSVZSLMG-UHFFFAOYSA-N 1 2 217.272 2.154 20 0 BEADLO Cc1cc2[nH+]ccn2cc1NC1CN(C(C)C)C1 ZINC001168316090 964436411 /nfs/dbraw/zinc/43/64/11/964436411.db2.gz UYWZCMOCCZWSQU-UHFFFAOYSA-N 1 2 244.342 2.147 20 0 BEADLO COc1ncc(Nc2cccc3[nH+]c[nH]c32)cn1 ZINC001213027990 964455915 /nfs/dbraw/zinc/45/59/15/964455915.db2.gz DIEXPLAGWOYTDK-UHFFFAOYSA-N 1 2 241.254 2.105 20 0 BEADLO Cc1ccnnc1NCc1c[nH+]cn1C(C)C ZINC001161562786 964642003 /nfs/dbraw/zinc/64/20/03/964642003.db2.gz FUGCFKWMSIQAHM-UHFFFAOYSA-N 1 2 231.303 2.175 20 0 BEADLO Cc1cnc(C)nc1NCc1c[nH+]cn1C(C)C ZINC001161565918 964643440 /nfs/dbraw/zinc/64/34/40/964643440.db2.gz VZRZWQFEMRKIPN-UHFFFAOYSA-N 1 2 245.330 2.483 20 0 BEADLO c1cc2nc(NCCCn3cc[nH+]c3)ccc2[nH]1 ZINC001161681008 964683494 /nfs/dbraw/zinc/68/34/94/964683494.db2.gz FPUGZUKTDSIHAU-UHFFFAOYSA-N 1 2 241.298 2.262 20 0 BEADLO COc1c[nH+]c(N[C@H]2CCO[C@H](C)C2)c(C)c1 ZINC001161690618 964687359 /nfs/dbraw/zinc/68/73/59/964687359.db2.gz JEUIMAAPDBQDAQ-MNOVXSKESA-N 1 2 236.315 2.378 20 0 BEADLO COc1c[nH+]c(N[C@H]2CCO[C@@H](C)C2)c(C)c1 ZINC001161690619 964688628 /nfs/dbraw/zinc/68/86/28/964688628.db2.gz JEUIMAAPDBQDAQ-QWRGUYRKSA-N 1 2 236.315 2.378 20 0 BEADLO Cc1c[nH+]cc(NCc2cnn(C)c2)c1C ZINC001161855408 964793852 /nfs/dbraw/zinc/79/38/52/964793852.db2.gz FGXFACIWMBHBCP-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO Cc1cc2cc(NC3CCOCC3)[nH+]cc2[nH]1 ZINC001161861655 964796437 /nfs/dbraw/zinc/79/64/37/964796437.db2.gz NZSCUZDEZVGSBI-UHFFFAOYSA-N 1 2 231.299 2.462 20 0 BEADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cnn[nH]2)c1 ZINC001203195700 964810861 /nfs/dbraw/zinc/81/08/61/964810861.db2.gz KUQCSKQIRSTMET-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2cnn[nH]2)c1 ZINC001203195700 964810866 /nfs/dbraw/zinc/81/08/66/964810866.db2.gz KUQCSKQIRSTMET-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2c[nH]nn2)c1 ZINC001203195700 964810869 /nfs/dbraw/zinc/81/08/69/964810869.db2.gz KUQCSKQIRSTMET-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2c[nH]nn2)c1 ZINC001203195700 964810873 /nfs/dbraw/zinc/81/08/73/964810873.db2.gz KUQCSKQIRSTMET-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cn[nH]n2)c1 ZINC001203195700 964810878 /nfs/dbraw/zinc/81/08/78/964810878.db2.gz KUQCSKQIRSTMET-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2cn[nH]n2)c1 ZINC001203195700 964810879 /nfs/dbraw/zinc/81/08/79/964810879.db2.gz KUQCSKQIRSTMET-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cnn[nH]2)c1 ZINC001203195699 964810942 /nfs/dbraw/zinc/81/09/42/964810942.db2.gz KUQCSKQIRSTMET-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cnn[nH]2)c1 ZINC001203195699 964810947 /nfs/dbraw/zinc/81/09/47/964810947.db2.gz KUQCSKQIRSTMET-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2c[nH]nn2)c1 ZINC001203195699 964810951 /nfs/dbraw/zinc/81/09/51/964810951.db2.gz KUQCSKQIRSTMET-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2c[nH]nn2)c1 ZINC001203195699 964810952 /nfs/dbraw/zinc/81/09/52/964810952.db2.gz KUQCSKQIRSTMET-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cn[nH]n2)c1 ZINC001203195699 964810957 /nfs/dbraw/zinc/81/09/57/964810957.db2.gz KUQCSKQIRSTMET-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cn[nH]n2)c1 ZINC001203195699 964810961 /nfs/dbraw/zinc/81/09/61/964810961.db2.gz KUQCSKQIRSTMET-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO CCc1coc(CNc2ccc(NC)[nH+]c2)n1 ZINC001162137890 964855396 /nfs/dbraw/zinc/85/53/96/964855396.db2.gz MKKIYYWFRRITQW-UHFFFAOYSA-N 1 2 232.287 2.286 20 0 BEADLO Cn1c[nH+]c2ccc(NC3CC(F)C3)cc21 ZINC001162212112 964873022 /nfs/dbraw/zinc/87/30/22/964873022.db2.gz CDNNTXQBILSWPK-UHFFFAOYSA-N 1 2 219.263 2.486 20 0 BEADLO Cc1oncc1CNc1ccc(N(C)C)c[nH+]1 ZINC001162272399 964898756 /nfs/dbraw/zinc/89/87/56/964898756.db2.gz IYSNFLSHPZIQNJ-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO Fc1ccc2c[nH+]c(NCc3ncon3)cc2c1 ZINC001162275853 964904002 /nfs/dbraw/zinc/90/40/02/964904002.db2.gz MVKKGVKBLPBFMB-UHFFFAOYSA-N 1 2 244.229 2.369 20 0 BEADLO Cc1cc(NCCN2CCCCO2)c[nH+]c1C ZINC001162422475 964974197 /nfs/dbraw/zinc/97/41/97/964974197.db2.gz KOEFOXNSNSRRTN-UHFFFAOYSA-N 1 2 235.331 2.138 20 0 BEADLO C1=C[C@H]([NH2+][C@@H]2CCCc3[nH]ncc32)CC1 ZINC000698203044 965098381 /nfs/dbraw/zinc/09/83/81/965098381.db2.gz DNMWTPQOGANDPC-GXSJLCMTSA-N 1 2 203.289 2.095 20 0 BEADLO O=c1ccc2c([nH]1)CC[C@H](Nc1cccc[nH+]1)C2 ZINC001163547871 965443691 /nfs/dbraw/zinc/44/36/91/965443691.db2.gz QBBKMMWPLJVYNU-NSHDSACASA-N 1 2 241.294 2.152 20 0 BEADLO OC[C@@H]1CCCCN1c1cccc(C2CC2)[nH+]1 ZINC001163558662 965450574 /nfs/dbraw/zinc/45/05/74/965450574.db2.gz GQAYASJWJYOFIR-LBPRGKRZSA-N 1 2 232.327 2.310 20 0 BEADLO Cc1nc(N(C)C(C)C)c2c([nH+]1)CCC2 ZINC001163621365 965482648 /nfs/dbraw/zinc/48/26/48/965482648.db2.gz DAOIGDBPLZIRRJ-UHFFFAOYSA-N 1 2 205.305 2.118 20 0 BEADLO CCCN(CCOC)c1cc(N)cc(Cl)[nH+]1 ZINC001163647143 965494870 /nfs/dbraw/zinc/49/48/70/965494870.db2.gz GKOYAYYWJICHHG-UHFFFAOYSA-N 1 2 243.738 2.180 20 0 BEADLO CNc1ccc(Nc2ccnn2CC2CC2)c[nH+]1 ZINC001203449910 965518223 /nfs/dbraw/zinc/51/82/23/965518223.db2.gz OLAFLQDSPPDCLL-UHFFFAOYSA-N 1 2 243.314 2.473 20 0 BEADLO COCC1CN(c2cc3ccccc3c[nH+]2)C1 ZINC001163730293 965545237 /nfs/dbraw/zinc/54/52/37/965545237.db2.gz MDENBZKHNLZTKR-UHFFFAOYSA-N 1 2 228.295 2.317 20 0 BEADLO CSCCCNc1ccc(N(C)C)c[nH+]1 ZINC001163875507 965604444 /nfs/dbraw/zinc/60/44/44/965604444.db2.gz HZHCVDFLYDCMFU-UHFFFAOYSA-N 1 2 225.361 2.313 20 0 BEADLO COc1ccc(C)[nH+]c1N1CC(F)(C2CC2)C1 ZINC001163967557 965666684 /nfs/dbraw/zinc/66/66/84/965666684.db2.gz DTUACOTUHZLKTR-UHFFFAOYSA-N 1 2 236.290 2.337 20 0 BEADLO Nc1cc(Cl)[nH+]c(N2CC(F)(C3CC3)C2)c1 ZINC001163968198 965667122 /nfs/dbraw/zinc/66/71/22/965667122.db2.gz PRZOKVHDQVKMRA-UHFFFAOYSA-N 1 2 241.697 2.256 20 0 BEADLO Cc1nonc1CNc1c[nH+]c(C)c(C)c1 ZINC001164059493 965719842 /nfs/dbraw/zinc/71/98/42/965719842.db2.gz SUZWAYVVKYKBHW-UHFFFAOYSA-N 1 2 218.260 2.002 20 0 BEADLO CCCc1cc(N2C[C@H](O)CC[C@H]2C)nc(C)[nH+]1 ZINC001164121107 965744320 /nfs/dbraw/zinc/74/43/20/965744320.db2.gz GITKCNQIUAOVAV-ZWNOBZJWSA-N 1 2 249.358 2.087 20 0 BEADLO C[C@H]1C[C@@H](CO)N(c2[nH+]ccc3ccccc32)C1 ZINC001164148390 965761226 /nfs/dbraw/zinc/76/12/26/965761226.db2.gz KMWLBJOEDMYIPP-AAEUAGOBSA-N 1 2 242.322 2.442 20 0 BEADLO CC(C)c1[nH]cc(CNc2cnc(F)cn2)[nH+]1 ZINC001164220374 965802111 /nfs/dbraw/zinc/80/21/11/965802111.db2.gz HPVZCNGZJREXGD-UHFFFAOYSA-N 1 2 235.266 2.074 20 0 BEADLO CC(C)c1[nH]c(CNc2cnc(F)cn2)c[nH+]1 ZINC001164220374 965802121 /nfs/dbraw/zinc/80/21/21/965802121.db2.gz HPVZCNGZJREXGD-UHFFFAOYSA-N 1 2 235.266 2.074 20 0 BEADLO COC1C[NH+]([C@@H](C)Cc2cccc(F)c2)C1 ZINC001168474008 965855176 /nfs/dbraw/zinc/85/51/76/965855176.db2.gz JXKNSUXELHKXCY-JTQLQIEISA-N 1 2 223.291 2.087 20 0 BEADLO COc1ccc(C)[nH+]c1N1CC[C@@]2(CCOC2)C1 ZINC001165251230 966005053 /nfs/dbraw/zinc/00/50/53/966005053.db2.gz MRTGXQCSNZTTDX-CQSZACIVSA-N 1 2 248.326 2.015 20 0 BEADLO Cn1c[nH+]cc1CCCOC(=O)[C@]1(C)C=CCC1 ZINC001122974093 966015137 /nfs/dbraw/zinc/01/51/37/966015137.db2.gz SENVIGPDBKJOMR-CQSZACIVSA-N 1 2 248.326 2.252 20 0 BEADLO Cc1nc(NCCCc2ccncc2)cc[nH+]1 ZINC001165534627 966121529 /nfs/dbraw/zinc/12/15/29/966121529.db2.gz OVVAPYRPYAJQDE-UHFFFAOYSA-N 1 2 228.299 2.225 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C ZINC001123472536 966184375 /nfs/dbraw/zinc/18/43/75/966184375.db2.gz IBPMABYUNRZXQP-WKSBVSIWSA-N 1 2 248.326 2.238 20 0 BEADLO CC(C)[C@H](O)Cn1c[nH+]c(Cc2ccccc2)c1 ZINC000919150189 966296305 /nfs/dbraw/zinc/29/63/05/966296305.db2.gz INCSGUACXYTCPR-OAHLLOKOSA-N 1 2 244.338 2.491 20 0 BEADLO CCSc1cc[nH+]c(N2CC[C@H](CO)C2)c1 ZINC001166551314 966297448 /nfs/dbraw/zinc/29/74/48/966297448.db2.gz VMZGZYIMWWXMHV-JTQLQIEISA-N 1 2 238.356 2.012 20 0 BEADLO Nc1ccc(-c2ccc3ocnc3c2)c[nH+]1 ZINC001236313125 966362400 /nfs/dbraw/zinc/36/24/00/966362400.db2.gz JTFOZTFZORVEQU-UHFFFAOYSA-N 1 2 211.224 2.472 20 0 BEADLO Cc1cn2cccc(Nc3cc[nH]c(=O)c3)c2[nH+]1 ZINC001212267004 966388376 /nfs/dbraw/zinc/38/83/76/966388376.db2.gz FGAMKTIWPMRUQG-UHFFFAOYSA-N 1 2 240.266 2.487 20 0 BEADLO CC(C)c1ccc(N2C[C@@H]3C[C@H]2CO3)[nH+]c1 ZINC001166757028 966398626 /nfs/dbraw/zinc/39/86/26/966398626.db2.gz YCTZQGGAGWBJAN-RYUDHWBXSA-N 1 2 218.300 2.183 20 0 BEADLO CCc1cn(Cc2noc(C(C)C)n2)c[nH+]1 ZINC001166822064 966423370 /nfs/dbraw/zinc/42/33/70/966423370.db2.gz IQEAVWDSGMPCHF-UHFFFAOYSA-N 1 2 220.276 2.000 20 0 BEADLO CCc1cn(Cc2cccc3c2OCCO3)c[nH+]1 ZINC001166823515 966427740 /nfs/dbraw/zinc/42/77/40/966427740.db2.gz VOTRCMVPNAEQRG-UHFFFAOYSA-N 1 2 244.294 2.265 20 0 BEADLO C#CC[NH+](CC#C)Cc1cccc(Cl)c1O ZINC000180294843 966443315 /nfs/dbraw/zinc/44/33/15/966443315.db2.gz GNZWHRFOOIGWIR-UHFFFAOYSA-N 1 2 233.698 2.114 20 0 BEADLO c1ccc2cc(N3CC4(CCO4)C3)[nH+]cc2c1 ZINC001166941292 966461593 /nfs/dbraw/zinc/46/15/93/966461593.db2.gz NPXNDBBQJVWBOU-UHFFFAOYSA-N 1 2 226.279 2.214 20 0 BEADLO CCN(c1ccc(C(C)C)c[nH+]1)C1COC1 ZINC001166942557 966465036 /nfs/dbraw/zinc/46/50/36/966465036.db2.gz NWOSSSVBBRJABA-UHFFFAOYSA-N 1 2 220.316 2.430 20 0 BEADLO COc1cc(C)c[nH+]c1N1C[C@H](C)O[C@@H](C)C1 ZINC001166967760 966493050 /nfs/dbraw/zinc/49/30/50/966493050.db2.gz VHEIAKKCLZANEQ-QWRGUYRKSA-N 1 2 236.315 2.012 20 0 BEADLO C[N@H+](Cc1cn[nH]n1)C12CC3CC(CC(C3)C1)C2 ZINC001203205876 966545869 /nfs/dbraw/zinc/54/58/69/966545869.db2.gz NLVJMWZHXDCENO-UHFFFAOYSA-N 1 2 246.358 2.205 20 0 BEADLO C[N@@H+](Cc1cn[nH]n1)C12CC3CC(CC(C3)C1)C2 ZINC001203205876 966545875 /nfs/dbraw/zinc/54/58/75/966545875.db2.gz NLVJMWZHXDCENO-UHFFFAOYSA-N 1 2 246.358 2.205 20 0 BEADLO C[N@H+](Cc1cn[nH]n1)C(C)(C)Cc1ccccc1 ZINC001203212724 966559098 /nfs/dbraw/zinc/55/90/98/966559098.db2.gz VYGGTAMWIKGCNA-UHFFFAOYSA-N 1 2 244.342 2.258 20 0 BEADLO C[N@@H+](Cc1cn[nH]n1)C(C)(C)Cc1ccccc1 ZINC001203212724 966559105 /nfs/dbraw/zinc/55/91/05/966559105.db2.gz VYGGTAMWIKGCNA-UHFFFAOYSA-N 1 2 244.342 2.258 20 0 BEADLO Cc1c[nH+]c(NC=CC(C)(C)O)c(C)c1 ZINC001203215093 966559482 /nfs/dbraw/zinc/55/94/82/966559482.db2.gz QZOWKDXPPRTTBM-AATRIKPKSA-N 1 2 206.289 2.395 20 0 BEADLO CNc1ccc(Nc2cc(OC)cc[nH+]2)c(F)n1 ZINC001203349941 966608817 /nfs/dbraw/zinc/60/88/17/966608817.db2.gz FRTJDPHTVJYFFS-UHFFFAOYSA-N 1 2 248.261 2.410 20 0 BEADLO Cc1ccc(Nc2nc(N)cnc2Cl)c(C)[nH+]1 ZINC001203370297 966618394 /nfs/dbraw/zinc/61/83/94/966618394.db2.gz KSJNNLCRLVVLOL-UHFFFAOYSA-N 1 2 249.705 2.468 20 0 BEADLO COc1cncc(Nc2ccc(C)[nH+]c2C)n1 ZINC001203367574 966620779 /nfs/dbraw/zinc/62/07/79/966620779.db2.gz MOEHWXNISLYOFC-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO CCn1nccc1Nc1ccc(NC)[nH+]c1 ZINC001203448312 966646988 /nfs/dbraw/zinc/64/69/88/966646988.db2.gz WPZAVIFRUVRLAZ-UHFFFAOYSA-N 1 2 217.276 2.083 20 0 BEADLO CNc1ccc(Nc2noc3cnccc32)c[nH+]1 ZINC001203449549 966650952 /nfs/dbraw/zinc/65/09/52/966650952.db2.gz IOXVRHKHIBDEMT-UHFFFAOYSA-N 1 2 241.254 2.403 20 0 BEADLO CNc1ccc(Nc2ccnc(OC)c2F)c[nH+]1 ZINC001203455827 966653775 /nfs/dbraw/zinc/65/37/75/966653775.db2.gz WDQPTKLDAMOVQC-UHFFFAOYSA-N 1 2 248.261 2.410 20 0 BEADLO CCOc1ccccc1C[N@@H+]1CCOC2(CC2)C1 ZINC001203545730 966678129 /nfs/dbraw/zinc/67/81/29/966678129.db2.gz QVGNCNGZODVGTI-UHFFFAOYSA-N 1 2 247.338 2.450 20 0 BEADLO CCOc1ccccc1C[N@H+]1CCOC2(CC2)C1 ZINC001203545730 966678140 /nfs/dbraw/zinc/67/81/40/966678140.db2.gz QVGNCNGZODVGTI-UHFFFAOYSA-N 1 2 247.338 2.450 20 0 BEADLO Nc1ccc(Nc2ccn3cc[nH+]c3c2)c(F)n1 ZINC001203615598 966708914 /nfs/dbraw/zinc/70/89/14/966708914.db2.gz UHVFDCFJGWUBAI-UHFFFAOYSA-N 1 2 243.245 2.194 20 0 BEADLO Cc1nonc1Nc1cc(C)c[nH+]c1C ZINC001203654907 966721620 /nfs/dbraw/zinc/72/16/20/966721620.db2.gz RUBNWOSSTONMEU-UHFFFAOYSA-N 1 2 204.233 2.133 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2cnc3cnccn32)c1 ZINC001203656942 966722224 /nfs/dbraw/zinc/72/22/24/966722224.db2.gz FCSCXZYPYJCDNU-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2cccnc2CO)c1 ZINC001203657322 966722814 /nfs/dbraw/zinc/72/28/14/966722814.db2.gz LCNRCUIFTKKSBT-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO COc1cc(C)c(C[NH+]2CCC(=O)CC2)cc1C ZINC001203756020 966771704 /nfs/dbraw/zinc/77/17/04/966771704.db2.gz QCNXWKFRAMXYSN-UHFFFAOYSA-N 1 2 247.338 2.477 20 0 BEADLO Cn1ncc2c1C[N@H+](Cc1cccc(F)c1)CC2 ZINC001203790281 966779391 /nfs/dbraw/zinc/77/93/91/966779391.db2.gz RBXMLERGSJCCRL-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1ncc2c1C[N@@H+](Cc1cccc(F)c1)CC2 ZINC001203790281 966779393 /nfs/dbraw/zinc/77/93/93/966779393.db2.gz RBXMLERGSJCCRL-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Fc1cccc(C[N@@H+]2CCOC3(CC3)C2)c1 ZINC001203788593 966781597 /nfs/dbraw/zinc/78/15/97/966781597.db2.gz OWRFIZJRTHCAHW-UHFFFAOYSA-N 1 2 221.275 2.191 20 0 BEADLO Fc1cccc(C[N@H+]2CCOC3(CC3)C2)c1 ZINC001203788593 966781603 /nfs/dbraw/zinc/78/16/03/966781603.db2.gz OWRFIZJRTHCAHW-UHFFFAOYSA-N 1 2 221.275 2.191 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2ccc[nH]2)C[C@H]1F ZINC001204006846 966845437 /nfs/dbraw/zinc/84/54/37/966845437.db2.gz MKIFAJBBVOOPSJ-GHMZBOCLSA-N 1 2 214.259 2.287 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2ccc[nH]2)C[C@H]1F ZINC001204006846 966845439 /nfs/dbraw/zinc/84/54/39/966845439.db2.gz MKIFAJBBVOOPSJ-GHMZBOCLSA-N 1 2 214.259 2.287 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1c[nH]c2ccccc12 ZINC001204043653 966868506 /nfs/dbraw/zinc/86/85/06/966868506.db2.gz WXBSYRCKXLJYAQ-JTQLQIEISA-N 1 2 246.310 2.161 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1c[nH]c2ccccc12 ZINC001204043653 966868513 /nfs/dbraw/zinc/86/85/13/966868513.db2.gz WXBSYRCKXLJYAQ-JTQLQIEISA-N 1 2 246.310 2.161 20 0 BEADLO F[C@@H]1CCC[N@@H+](Cc2ccc3c(c2)OCO3)C1 ZINC001204052106 966871495 /nfs/dbraw/zinc/87/14/95/966871495.db2.gz FDZMMXUYFBQQHE-LLVKDONJSA-N 1 2 237.274 2.349 20 0 BEADLO F[C@@H]1CCC[N@H+](Cc2ccc3c(c2)OCO3)C1 ZINC001204052106 966871492 /nfs/dbraw/zinc/87/14/92/966871492.db2.gz FDZMMXUYFBQQHE-LLVKDONJSA-N 1 2 237.274 2.349 20 0 BEADLO Cn1c[nH+]c2ccc(N[C@@H](CO)C(C)(C)C)cc21 ZINC001168554831 966878261 /nfs/dbraw/zinc/87/82/61/966878261.db2.gz YRXRPSJQOVEVAA-ZDUSSCGKSA-N 1 2 247.342 2.392 20 0 BEADLO Cc1nc2c(s1)C[N@H+](Cc1cccnc1)CC2 ZINC001204075563 966882641 /nfs/dbraw/zinc/88/26/41/966882641.db2.gz JPOASOZXMDITQK-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1nc2c(s1)C[N@@H+](Cc1cccnc1)CC2 ZINC001204075563 966882644 /nfs/dbraw/zinc/88/26/44/966882644.db2.gz JPOASOZXMDITQK-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO CCc1ccc(C[N@@H+]2CCOC3(CC3)C2)o1 ZINC001204394995 966990772 /nfs/dbraw/zinc/99/07/72/966990772.db2.gz XPZXUDGRTAGDLK-UHFFFAOYSA-N 1 2 221.300 2.207 20 0 BEADLO CCc1ccc(C[N@H+]2CCOC3(CC3)C2)o1 ZINC001204394995 966990783 /nfs/dbraw/zinc/99/07/83/966990783.db2.gz XPZXUDGRTAGDLK-UHFFFAOYSA-N 1 2 221.300 2.207 20 0 BEADLO Cc1c(F)cccc1C[N@@H+]1CCO[C@@H](C)C1 ZINC001204507789 967013682 /nfs/dbraw/zinc/01/36/82/967013682.db2.gz KQOMNQQZWPNGMV-JTQLQIEISA-N 1 2 223.291 2.355 20 0 BEADLO Cc1c(F)cccc1C[N@H+]1CCO[C@@H](C)C1 ZINC001204507789 967013691 /nfs/dbraw/zinc/01/36/91/967013691.db2.gz KQOMNQQZWPNGMV-JTQLQIEISA-N 1 2 223.291 2.355 20 0 BEADLO CC(=O)[C@@H]1C[N@H+](Cc2cc(C)cc(C)c2)CCO1 ZINC001204527037 967026141 /nfs/dbraw/zinc/02/61/41/967026141.db2.gz NGLSTXBQESWFSH-HNNXBMFYSA-N 1 2 247.338 2.093 20 0 BEADLO CC(=O)[C@@H]1C[N@@H+](Cc2cc(C)cc(C)c2)CCO1 ZINC001204527037 967026149 /nfs/dbraw/zinc/02/61/49/967026149.db2.gz NGLSTXBQESWFSH-HNNXBMFYSA-N 1 2 247.338 2.093 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccncn2)oc1C ZINC001204541600 967040479 /nfs/dbraw/zinc/04/04/79/967040479.db2.gz MXHWADGCWIRWBU-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccncn2)oc1C ZINC001204541600 967040490 /nfs/dbraw/zinc/04/04/90/967040490.db2.gz MXHWADGCWIRWBU-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1[nH+]c[nH]c1CN1Cc2ccc(F)cc2C1 ZINC001204589959 967072223 /nfs/dbraw/zinc/07/22/23/967072223.db2.gz LXAFKJNDSDQZFM-UHFFFAOYSA-N 1 2 231.274 2.373 20 0 BEADLO Cc1nc[nH]c1C[N@@H+](C)Cc1ccc(C)nc1 ZINC001204592907 967087531 /nfs/dbraw/zinc/08/75/31/967087531.db2.gz CAOMQFDYBNPROD-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1nc[nH]c1C[N@H+](C)Cc1ccc(C)nc1 ZINC001204592907 967087539 /nfs/dbraw/zinc/08/75/39/967087539.db2.gz CAOMQFDYBNPROD-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO COc1ccc(C[N@@H+]2CCC[C@H](F)C2)nc1C ZINC001249903658 967140158 /nfs/dbraw/zinc/14/01/58/967140158.db2.gz ZPJJVTQHBCEQGY-NSHDSACASA-N 1 2 238.306 2.333 20 0 BEADLO COc1ccc(C[N@H+]2CCC[C@H](F)C2)nc1C ZINC001249903658 967140166 /nfs/dbraw/zinc/14/01/66/967140166.db2.gz ZPJJVTQHBCEQGY-NSHDSACASA-N 1 2 238.306 2.333 20 0 BEADLO COc1ccc(C[N@@H+]2CCC[C@@H](F)C2)nc1C ZINC001249903657 967143000 /nfs/dbraw/zinc/14/30/00/967143000.db2.gz ZPJJVTQHBCEQGY-LLVKDONJSA-N 1 2 238.306 2.333 20 0 BEADLO COc1ccc(C[N@H+]2CCC[C@@H](F)C2)nc1C ZINC001249903657 967143004 /nfs/dbraw/zinc/14/30/04/967143004.db2.gz ZPJJVTQHBCEQGY-LLVKDONJSA-N 1 2 238.306 2.333 20 0 BEADLO CCc1cc(C[NH+]2CCOCC2)ccc1OC ZINC001249932168 967170437 /nfs/dbraw/zinc/17/04/37/967170437.db2.gz KDVLEOPAOZBPIV-UHFFFAOYSA-N 1 2 235.327 2.090 20 0 BEADLO Cc1cc(Nc2ccn3cc[nH+]c3c2)on1 ZINC001204943350 967246951 /nfs/dbraw/zinc/24/69/51/967246951.db2.gz ILZLPJLGKOBKDD-UHFFFAOYSA-N 1 2 214.228 2.374 20 0 BEADLO CCOc1cc(C[N@@H+]2C[C@@H](F)C[C@H]2C)ccn1 ZINC001249998159 967250924 /nfs/dbraw/zinc/25/09/24/967250924.db2.gz MZZMIIKFJJLMMP-PWSUYJOCSA-N 1 2 238.306 2.413 20 0 BEADLO CCOc1cc(C[N@H+]2C[C@@H](F)C[C@H]2C)ccn1 ZINC001249998159 967250934 /nfs/dbraw/zinc/25/09/34/967250934.db2.gz MZZMIIKFJJLMMP-PWSUYJOCSA-N 1 2 238.306 2.413 20 0 BEADLO Oc1cc(F)cnc1Nc1ccn2cc[nH+]c2c1 ZINC001204966804 967267625 /nfs/dbraw/zinc/26/76/25/967267625.db2.gz YCNVMZAIAVSDCL-UHFFFAOYSA-N 1 2 244.229 2.318 20 0 BEADLO CCN(CC)C(=O)Cc1c[nH+]c(C)cc1C ZINC001250011488 967270447 /nfs/dbraw/zinc/27/04/47/967270447.db2.gz IPSHMMASMHOINN-UHFFFAOYSA-N 1 2 220.316 2.109 20 0 BEADLO Cn1c[nH+]cc1CCC(=O)c1ccc(F)cc1 ZINC001250028501 967280126 /nfs/dbraw/zinc/28/01/26/967280126.db2.gz WZTCWWBIFZZJTI-UHFFFAOYSA-N 1 2 232.258 2.375 20 0 BEADLO CC[N@H+](CCO)Cc1cncc(Cl)c1Cl ZINC001205101537 967337213 /nfs/dbraw/zinc/33/72/13/967337213.db2.gz SHHKCUWKHBUPQA-UHFFFAOYSA-N 1 2 249.141 2.203 20 0 BEADLO CC[N@@H+](CCO)Cc1cncc(Cl)c1Cl ZINC001205101537 967337224 /nfs/dbraw/zinc/33/72/24/967337224.db2.gz SHHKCUWKHBUPQA-UHFFFAOYSA-N 1 2 249.141 2.203 20 0 BEADLO c1cn2ccc(C[C@@H]3CCCO3)cc2[nH+]1 ZINC001250104500 967380281 /nfs/dbraw/zinc/38/02/81/967380281.db2.gz UFEFDKNOQUBHAJ-NSHDSACASA-N 1 2 202.257 2.056 20 0 BEADLO Cn1cnc2ccnc(-c3ccc4[nH+]ccn4c3)c21 ZINC001240213441 967424346 /nfs/dbraw/zinc/42/43/46/967424346.db2.gz FHOCMPZUTKSLFA-UHFFFAOYSA-N 1 2 249.277 2.283 20 0 BEADLO CCN(Cc1ccc(C)c(F)c1)C1C[NH+](C)C1 ZINC001205251856 967437321 /nfs/dbraw/zinc/43/73/21/967437321.db2.gz QCLOEBRAYFUWDH-UHFFFAOYSA-N 1 2 236.334 2.270 20 0 BEADLO CN1CCOc2cc(CCC(F)(F)F)c[nH+]c21 ZINC001250149356 967440140 /nfs/dbraw/zinc/44/01/40/967440140.db2.gz XONSFTRYLWHYIM-UHFFFAOYSA-N 1 2 246.232 2.405 20 0 BEADLO CCn1nccc1Nc1cccn2cc[nH+]c12 ZINC001205274540 967465348 /nfs/dbraw/zinc/46/53/48/967465348.db2.gz MVZLFLBMNJLGBQ-UHFFFAOYSA-N 1 2 227.271 2.294 20 0 BEADLO Nc1cn2ccc(-c3csc(CO)c3)cc2[nH+]1 ZINC001205290078 967482667 /nfs/dbraw/zinc/48/26/67/967482667.db2.gz CGJLWXLLAASRRF-UHFFFAOYSA-N 1 2 245.307 2.137 20 0 BEADLO CCN(C)c1ccc(Nc2ccnn2CC)c[nH+]1 ZINC001205288766 967483694 /nfs/dbraw/zinc/48/36/94/967483694.db2.gz CQFFIMHLMKMEIZ-UHFFFAOYSA-N 1 2 245.330 2.498 20 0 BEADLO Cc1c[nH+]c(C)c(C[C@@H]2COC(C)(C)O2)c1 ZINC001250186235 967493389 /nfs/dbraw/zinc/49/33/89/967493389.db2.gz PKJBEIHZJRJEMB-GFCCVEGCSA-N 1 2 221.300 2.392 20 0 BEADLO Cc1cc(-c2csc(CO)c2)c[nH+]c1N ZINC001205306057 967501085 /nfs/dbraw/zinc/50/10/85/967501085.db2.gz YARYAGIJLSPXCL-UHFFFAOYSA-N 1 2 220.297 2.193 20 0 BEADLO Nc1ccc(CC(=O)c2cccc(F)c2)c[nH+]1 ZINC001250235559 967546394 /nfs/dbraw/zinc/54/63/94/967546394.db2.gz RPABPCFJOXHKFX-UHFFFAOYSA-N 1 2 230.242 2.228 20 0 BEADLO Clc1cccc2c1C[C@H]([NH+]1CCOCC1)C2 ZINC001168718775 967623161 /nfs/dbraw/zinc/62/31/61/967623161.db2.gz RVLRCPVRKNZVLX-LLVKDONJSA-N 1 2 237.730 2.139 20 0 BEADLO CC(=O)Nc1cccc(CCn2cc[nH+]c2)c1 ZINC001250315919 967678656 /nfs/dbraw/zinc/67/86/56/967678656.db2.gz WZLADXFUGUVGAW-UHFFFAOYSA-N 1 2 229.283 2.084 20 0 BEADLO COc1ccc(CCn2cc[nH+]c2)c(F)c1 ZINC001250315103 967678706 /nfs/dbraw/zinc/67/87/06/967678706.db2.gz FISUFUWISZVKKL-UHFFFAOYSA-N 1 2 220.247 2.274 20 0 BEADLO c1cn(CCc2cncc(C3CC3)c2)c[nH+]1 ZINC001250316140 967681241 /nfs/dbraw/zinc/68/12/41/967681241.db2.gz BRRPLEKYCQUFCJ-UHFFFAOYSA-N 1 2 213.284 2.398 20 0 BEADLO c1cn(CCc2cnn([C@H]3CCCCO3)c2)c[nH+]1 ZINC001250315844 967681447 /nfs/dbraw/zinc/68/14/47/967681447.db2.gz STUPKEYZPMIOQH-CYBMUJFWSA-N 1 2 246.314 2.021 20 0 BEADLO CC(=O)c1ccc(CCn2cc[nH+]c2)cc1 ZINC001250315191 967681662 /nfs/dbraw/zinc/68/16/62/967681662.db2.gz GOSKZERCRLXRSR-UHFFFAOYSA-N 1 2 214.268 2.328 20 0 BEADLO Clc1ccncc1CCn1cc[nH+]c1 ZINC001250318351 967684237 /nfs/dbraw/zinc/68/42/37/967684237.db2.gz DJHAPQLNDVNEBX-UHFFFAOYSA-N 1 2 207.664 2.174 20 0 BEADLO COCOc1ccccc1CCn1cc[nH+]c1 ZINC001250318498 967685545 /nfs/dbraw/zinc/68/55/45/967685545.db2.gz GHRZHBBIAZGDRM-UHFFFAOYSA-N 1 2 232.283 2.109 20 0 BEADLO COc1ccc(CCn2cc[nH+]c2)c(Cl)n1 ZINC001250318511 967686695 /nfs/dbraw/zinc/68/66/95/967686695.db2.gz BKBKVFXTFHYCRN-UHFFFAOYSA-N 1 2 237.690 2.183 20 0 BEADLO COc1c(F)c(F)ccc1CCn1cc[nH+]c1 ZINC001250318302 967690257 /nfs/dbraw/zinc/69/02/57/967690257.db2.gz AQIMJJOZYPJNJL-UHFFFAOYSA-N 1 2 238.237 2.413 20 0 BEADLO COc1ccc(C(C)=O)cc1CCn1cc[nH+]c1 ZINC001250318659 967694084 /nfs/dbraw/zinc/69/40/84/967694084.db2.gz JILOTADZONSEQY-UHFFFAOYSA-N 1 2 244.294 2.337 20 0 BEADLO COCOc1ccc(CCn2cc[nH+]c2)c(C)c1 ZINC001250318672 967694373 /nfs/dbraw/zinc/69/43/73/967694373.db2.gz KBSUTMBLESPKQE-UHFFFAOYSA-N 1 2 246.310 2.417 20 0 BEADLO COCOc1c(C)cccc1CCn1cc[nH+]c1 ZINC001250320495 967696560 /nfs/dbraw/zinc/69/65/60/967696560.db2.gz MSNNGOKMKKLWHY-UHFFFAOYSA-N 1 2 246.310 2.417 20 0 BEADLO Cc1cc(CCn2cc[nH+]c2)cc(C)c1CO ZINC001250320418 967696844 /nfs/dbraw/zinc/69/68/44/967696844.db2.gz KXJHLMHFOKRHGO-UHFFFAOYSA-N 1 2 230.311 2.235 20 0 BEADLO CCn1ncc2cc(CCn3cc[nH+]c3)ccc21 ZINC001250320906 967698806 /nfs/dbraw/zinc/69/88/06/967698806.db2.gz SGPBSFGFMAIXPW-UHFFFAOYSA-N 1 2 240.310 2.495 20 0 BEADLO COCOc1ccc(C)c(CCn2cc[nH+]c2)c1 ZINC001250321240 967699154 /nfs/dbraw/zinc/69/91/54/967699154.db2.gz YSIDTMGENWCVLP-UHFFFAOYSA-N 1 2 246.310 2.417 20 0 BEADLO c1cn(CCc2cncc(OCC3CC3)c2)c[nH+]1 ZINC001250320873 967700489 /nfs/dbraw/zinc/70/04/89/967700489.db2.gz RQQDCVSLEPHPNV-UHFFFAOYSA-N 1 2 243.310 2.310 20 0 BEADLO CCOc1ccc(CCn2cc[nH+]c2)c(C)n1 ZINC001250321279 967700569 /nfs/dbraw/zinc/70/05/69/967700569.db2.gz ZPDHYVSCLXQTHW-UHFFFAOYSA-N 1 2 231.299 2.228 20 0 BEADLO CCCCNc1ccn2cc(N)[nH+]c2c1 ZINC001162204300 967737924 /nfs/dbraw/zinc/73/79/24/967737924.db2.gz ZCBAWNZPYIKQBP-UHFFFAOYSA-N 1 2 204.277 2.129 20 0 BEADLO COc1ccc2c(c1)C[N@@H+](Cc1cnoc1)CC2 ZINC001205670142 967755840 /nfs/dbraw/zinc/75/58/40/967755840.db2.gz JYPXGADWFCVXMX-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1ccc2c(c1)C[N@H+](Cc1cnoc1)CC2 ZINC001205670142 967755863 /nfs/dbraw/zinc/75/58/63/967755863.db2.gz JYPXGADWFCVXMX-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO Cc1cc(Cc2ccc3[nH+]ccn3c2)on1 ZINC001250364364 967772578 /nfs/dbraw/zinc/77/25/78/967772578.db2.gz JHOZZECPGBUJPD-UHFFFAOYSA-N 1 2 213.240 2.222 20 0 BEADLO Cc1cccc2c1C[N@H+](Cc1cnoc1)C2 ZINC001205678324 967772877 /nfs/dbraw/zinc/77/28/77/967772877.db2.gz XNOGKIMRYDMLTG-UHFFFAOYSA-N 1 2 214.268 2.499 20 0 BEADLO Cc1cccc2c1C[N@@H+](Cc1cnoc1)C2 ZINC001205678324 967772884 /nfs/dbraw/zinc/77/28/84/967772884.db2.gz XNOGKIMRYDMLTG-UHFFFAOYSA-N 1 2 214.268 2.499 20 0 BEADLO CNc1ccc(Nc2nc(C)ccc2O)c[nH+]1 ZINC001203448907 967775929 /nfs/dbraw/zinc/77/59/29/967775929.db2.gz QJYMWFNWALHSAY-UHFFFAOYSA-N 1 2 230.271 2.276 20 0 BEADLO Fc1ccc2c(c1)CC[N@@H+](Cc1cnoc1)C2 ZINC001205724248 967802871 /nfs/dbraw/zinc/80/28/71/967802871.db2.gz LBGNMKSSPZHBMG-UHFFFAOYSA-N 1 2 232.258 2.372 20 0 BEADLO Fc1ccc2c(c1)CC[N@H+](Cc1cnoc1)C2 ZINC001205724248 967802872 /nfs/dbraw/zinc/80/28/72/967802872.db2.gz LBGNMKSSPZHBMG-UHFFFAOYSA-N 1 2 232.258 2.372 20 0 BEADLO C[C@@]1(O)CC[C@@H](Nc2ccn3cc[nH+]c3c2)CC1 ZINC001162359601 967811317 /nfs/dbraw/zinc/81/13/17/967811317.db2.gz BEJSXVQPYPQOLK-YEORSEQZSA-N 1 2 245.326 2.440 20 0 BEADLO OCCCCC[N@@H+]1CCC[C@@H](F)C(F)(F)C1 ZINC001205796490 967824531 /nfs/dbraw/zinc/82/45/31/967824531.db2.gz RTGYQLKIIWEVLH-SNVBAGLBSA-N 1 2 239.281 2.218 20 0 BEADLO OCCCCC[N@H+]1CCC[C@@H](F)C(F)(F)C1 ZINC001205796490 967824535 /nfs/dbraw/zinc/82/45/35/967824535.db2.gz RTGYQLKIIWEVLH-SNVBAGLBSA-N 1 2 239.281 2.218 20 0 BEADLO Cc1cc(Cc2cc(C)[nH+]c(C)c2)n(C)n1 ZINC001250418593 967827709 /nfs/dbraw/zinc/82/77/09/967827709.db2.gz XLFQYCNTLJIVAP-UHFFFAOYSA-N 1 2 215.300 2.331 20 0 BEADLO Cc1cccc(Cc2ccc(N(C)C)[nH+]c2)n1 ZINC001250423464 967834188 /nfs/dbraw/zinc/83/41/88/967834188.db2.gz TWTZWNKCCPVVBT-UHFFFAOYSA-N 1 2 227.311 2.442 20 0 BEADLO CCc1[nH]c2ccc(OCOC)cc2[nH+]1 ZINC001250426622 967841950 /nfs/dbraw/zinc/84/19/50/967841950.db2.gz NZVVQQKTLAZCBN-UHFFFAOYSA-N 1 2 206.245 2.108 20 0 BEADLO COc1ccc2c(c1)[nH+]c(CCSC)n2C ZINC001250426511 967843856 /nfs/dbraw/zinc/84/38/56/967843856.db2.gz HKKUHSSWWMALJE-UHFFFAOYSA-N 1 2 236.340 2.487 20 0 BEADLO Cc1c[nH+]cc(Cc2ccnn2C)c1C ZINC001250436963 967857510 /nfs/dbraw/zinc/85/75/10/967857510.db2.gz ZAKNLOHESUXVAK-UHFFFAOYSA-N 1 2 201.273 2.023 20 0 BEADLO COC(=[NH2+])c1cccc(-c2cnc(C)nc2)c1 ZINC001205864775 967863288 /nfs/dbraw/zinc/86/32/88/967863288.db2.gz VYNFDMCTXAGBCT-UHFFFAOYSA-N 1 2 227.267 2.424 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@H](C(F)(F)F)C2)co1 ZINC001206067643 968034578 /nfs/dbraw/zinc/03/45/78/968034578.db2.gz GRLSCOWZKLNEGU-QMMMGPOBSA-N 1 2 234.221 2.367 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@H](C(F)(F)F)C2)co1 ZINC001206067643 968034589 /nfs/dbraw/zinc/03/45/89/968034589.db2.gz GRLSCOWZKLNEGU-QMMMGPOBSA-N 1 2 234.221 2.367 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2C[C@H]3CC[C@@H]2CO3)s1 ZINC001206191974 968121218 /nfs/dbraw/zinc/12/12/18/968121218.db2.gz AKKGIIQTMGZRTN-GHMZBOCLSA-N 1 2 238.356 2.123 20 0 BEADLO Cc1nc(C)c(C[N@H+]2C[C@H]3CC[C@@H]2CO3)s1 ZINC001206191974 968121223 /nfs/dbraw/zinc/12/12/23/968121223.db2.gz AKKGIIQTMGZRTN-GHMZBOCLSA-N 1 2 238.356 2.123 20 0 BEADLO COCCc1[nH]c2cc3c(cc2[nH+]1)CCC3 ZINC001250596645 968129883 /nfs/dbraw/zinc/12/98/83/968129883.db2.gz YHNPUWFSOFARGI-UHFFFAOYSA-N 1 2 216.284 2.241 20 0 BEADLO COc1cc(C)c[nH+]c1N1CCCO[C@@H](C)C1 ZINC001163961928 968148286 /nfs/dbraw/zinc/14/82/86/968148286.db2.gz CGBQBTPAPKGIMY-NSHDSACASA-N 1 2 236.315 2.014 20 0 BEADLO C[C@@H]1C[C@@H]1c1[nH]c2cc3c(cc2[nH+]1)OCO3 ZINC001250614141 968161818 /nfs/dbraw/zinc/16/18/18/968161818.db2.gz GMFJFORSBSOPSG-RQJHMYQMSA-N 1 2 216.240 2.415 20 0 BEADLO C[C@@H]1C[C@@H]1c1[nH]c2cc3c(cc2[nH+]1)OCC(=O)N3 ZINC001250616111 968163675 /nfs/dbraw/zinc/16/36/75/968163675.db2.gz WXFIFHPZKSMDNL-RQJHMYQMSA-N 1 2 243.266 2.017 20 0 BEADLO COc1cc(-c2ccc3[nH+]ccn3c2)ccn1 ZINC001250650226 968190528 /nfs/dbraw/zinc/19/05/28/968190528.db2.gz LHYOWDMRVOVJLO-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO c1ccn(CCNc2ccc3c([nH+]2)CCOC3)c1 ZINC001164443046 968235279 /nfs/dbraw/zinc/23/52/79/968235279.db2.gz LBBDPXFCJYFIQN-UHFFFAOYSA-N 1 2 243.310 2.068 20 0 BEADLO C[NH+](C)CCn1cc(-c2ccccc2S)cn1 ZINC001206348374 968248453 /nfs/dbraw/zinc/24/84/53/968248453.db2.gz PATUJMGQBITJLQ-UHFFFAOYSA-N 1 2 247.367 2.400 20 0 BEADLO C[C@@H](C(=O)NC[C@H]1CCC[C@@H](C)C1)n1cc[nH+]c1 ZINC001251289282 968280393 /nfs/dbraw/zinc/28/03/93/968280393.db2.gz ZVZLYEORKCBIGO-AGIUHOORSA-N 1 2 249.358 2.387 20 0 BEADLO COc1cnccc1C[N@@H+]1C[C@H](F)C[C@H]1C ZINC001206438035 968294791 /nfs/dbraw/zinc/29/47/91/968294791.db2.gz KKXIAGKJBKXESV-MWLCHTKSSA-N 1 2 224.279 2.023 20 0 BEADLO COc1cnccc1C[N@H+]1C[C@H](F)C[C@H]1C ZINC001206438035 968294799 /nfs/dbraw/zinc/29/47/99/968294799.db2.gz KKXIAGKJBKXESV-MWLCHTKSSA-N 1 2 224.279 2.023 20 0 BEADLO CC[C@@H](O)CNc1ccc[nH+]c1N1CCCCC1 ZINC001251756596 968312126 /nfs/dbraw/zinc/31/21/26/968312126.db2.gz AYLOVTBNPKYTHI-GFCCVEGCSA-N 1 2 249.358 2.255 20 0 BEADLO Clc1cccc2c1C[N@H+](CCc1cn[nH]n1)C2 ZINC001119710596 968456615 /nfs/dbraw/zinc/45/66/15/968456615.db2.gz FAOVAWWEKCTYNH-UHFFFAOYSA-N 1 2 248.717 2.016 20 0 BEADLO Clc1cccc2c1C[N@@H+](CCc1cn[nH]n1)C2 ZINC001119710596 968456618 /nfs/dbraw/zinc/45/66/18/968456618.db2.gz FAOVAWWEKCTYNH-UHFFFAOYSA-N 1 2 248.717 2.016 20 0 BEADLO Cc1nc(C[NH+]2CC3(C2)CCOCC3)cs1 ZINC001206799949 968481751 /nfs/dbraw/zinc/48/17/51/968481751.db2.gz VJNNRDOOBBBNMC-UHFFFAOYSA-N 1 2 238.356 2.064 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1cc(C)ccn1 ZINC001206853293 968500717 /nfs/dbraw/zinc/50/07/17/968500717.db2.gz PUOZMKXVJGYNKN-AWEZNQCLSA-N 1 2 232.327 2.334 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@H+]1Cc1cc(C)ccn1 ZINC001206853293 968500721 /nfs/dbraw/zinc/50/07/21/968500721.db2.gz PUOZMKXVJGYNKN-AWEZNQCLSA-N 1 2 232.327 2.334 20 0 BEADLO CCN(CC)Cc1[nH+]cc2ccccn21 ZINC001207048497 968579280 /nfs/dbraw/zinc/57/92/80/968579280.db2.gz RSTNXZYVQUICGR-UHFFFAOYSA-N 1 2 203.289 2.176 20 0 BEADLO c1[nH+]c(CN2CCCC23CC3)n2ccccc12 ZINC001207048692 968580806 /nfs/dbraw/zinc/58/08/06/968580806.db2.gz ITOOXSVOJBLKIU-UHFFFAOYSA-N 1 2 227.311 2.463 20 0 BEADLO c1[nH+]c(CN2CCC[C@@H]3C[C@@H]32)n2ccccc12 ZINC001207055488 968584605 /nfs/dbraw/zinc/58/46/05/968584605.db2.gz YLSRWPDSLDUIPI-YPMHNXCESA-N 1 2 227.311 2.319 20 0 BEADLO CC[C@@]12C[C@@H](CO1)[N@H+](Cc1cnc(C)s1)C2 ZINC001207061698 968591290 /nfs/dbraw/zinc/59/12/90/968591290.db2.gz HOFAPASENBUYHS-JQWIXIFHSA-N 1 2 238.356 2.205 20 0 BEADLO CC[C@@]12C[C@@H](CO1)[N@@H+](Cc1cnc(C)s1)C2 ZINC001207061698 968591297 /nfs/dbraw/zinc/59/12/97/968591297.db2.gz HOFAPASENBUYHS-JQWIXIFHSA-N 1 2 238.356 2.205 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2cccc(=O)[nH]2)C[C@H]1F ZINC001207065134 968598197 /nfs/dbraw/zinc/59/81/97/968598197.db2.gz IULZONLJJCPOHZ-ZYHUDNBSSA-N 1 2 242.269 2.059 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2cccc(=O)[nH]2)C[C@H]1F ZINC001207065134 968598203 /nfs/dbraw/zinc/59/82/03/968598203.db2.gz IULZONLJJCPOHZ-ZYHUDNBSSA-N 1 2 242.269 2.059 20 0 BEADLO CCc1nccc(C[N@@H+]2CCC[C@@](C)(F)C2)n1 ZINC001207083564 968617314 /nfs/dbraw/zinc/61/73/14/968617314.db2.gz BNAUDGGQTDATNO-CYBMUJFWSA-N 1 2 237.322 2.363 20 0 BEADLO CCc1nccc(C[N@H+]2CCC[C@@](C)(F)C2)n1 ZINC001207083564 968617320 /nfs/dbraw/zinc/61/73/20/968617320.db2.gz BNAUDGGQTDATNO-CYBMUJFWSA-N 1 2 237.322 2.363 20 0 BEADLO CC(C)(O)CNc1cccc(Cn2cc[nH+]c2)c1 ZINC001252359335 968637011 /nfs/dbraw/zinc/63/70/11/968637011.db2.gz YZNKQGPERGOYAF-UHFFFAOYSA-N 1 2 245.326 2.114 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCC(=O)[C@H](C)CC1 ZINC001207133099 968648726 /nfs/dbraw/zinc/64/87/26/968648726.db2.gz HJQMHLRRNKHEFB-SECBINFHSA-N 1 2 236.315 2.092 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCC(=O)[C@H](C)CC1 ZINC001207133099 968648732 /nfs/dbraw/zinc/64/87/32/968648732.db2.gz HJQMHLRRNKHEFB-SECBINFHSA-N 1 2 236.315 2.092 20 0 BEADLO CCn1nccc1-c1cn2cc[nH+]c2cc1OC ZINC001240710039 968657510 /nfs/dbraw/zinc/65/75/10/968657510.db2.gz DOHXTTMUDMHYNJ-UHFFFAOYSA-N 1 2 242.282 2.226 20 0 BEADLO Cc1nonc1[C@@H](C)[NH2+]Cc1cccc(F)c1 ZINC000826616541 968674851 /nfs/dbraw/zinc/67/48/51/968674851.db2.gz DNSXMMUAELQJOP-MRVPVSSYSA-N 1 2 235.262 2.368 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCCC(=O)[C@H](C)C1 ZINC001207170819 968678528 /nfs/dbraw/zinc/67/85/28/968678528.db2.gz CNZVXVZVPIQLFR-GFCCVEGCSA-N 1 2 249.358 2.265 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCCC(=O)[C@H](C)C1 ZINC001207170819 968678537 /nfs/dbraw/zinc/67/85/37/968678537.db2.gz CNZVXVZVPIQLFR-GFCCVEGCSA-N 1 2 249.358 2.265 20 0 BEADLO CCO[C@H](C)n1cc(-c2c[nH+]c(N)c(C)c2)cn1 ZINC001240757329 968679704 /nfs/dbraw/zinc/67/97/04/968679704.db2.gz BCVQWYUZVDTHHN-SNVBAGLBSA-N 1 2 246.314 2.391 20 0 BEADLO CC(=O)[C@@H]1CCC[N@H+]1Cc1ccnn1C(C)C ZINC001207176498 968683558 /nfs/dbraw/zinc/68/35/58/968683558.db2.gz ISYURVLXBJMEBG-ZDUSSCGKSA-N 1 2 235.331 2.017 20 0 BEADLO CC(=O)[C@@H]1CCC[N@@H+]1Cc1ccnn1C(C)C ZINC001207176498 968683563 /nfs/dbraw/zinc/68/35/63/968683563.db2.gz ISYURVLXBJMEBG-ZDUSSCGKSA-N 1 2 235.331 2.017 20 0 BEADLO CC1(F)C[NH+](CC2CCSCC2)C1 ZINC001207696863 968865146 /nfs/dbraw/zinc/86/51/46/968865146.db2.gz OVYTXAGDXCFHBL-UHFFFAOYSA-N 1 2 203.326 2.173 20 0 BEADLO Nc1cn2ccc(-c3ccccc3N)cc2[nH+]1 ZINC001241066493 968885601 /nfs/dbraw/zinc/88/56/01/968885601.db2.gz LBEKXIWRNKEWID-UHFFFAOYSA-N 1 2 224.267 2.166 20 0 BEADLO Cc1nc(NCc2cccn2C)c2c([nH+]1)CCC2 ZINC001155212683 968927032 /nfs/dbraw/zinc/92/70/32/968927032.db2.gz BCURQSBPYSDGRZ-UHFFFAOYSA-N 1 2 242.326 2.224 20 0 BEADLO CSc1cncc(-c2cc[nH+]c(N)c2)c1 ZINC001241163140 968943702 /nfs/dbraw/zinc/94/37/02/968943702.db2.gz POZBFBDIVAWUPZ-UHFFFAOYSA-N 1 2 217.297 2.448 20 0 BEADLO Nc1cc(-c2ccc3c(c2)COC3=O)cc[nH+]1 ZINC001241163229 968944965 /nfs/dbraw/zinc/94/49/65/968944965.db2.gz RCUKLQKCQMQGGT-UHFFFAOYSA-N 1 2 226.235 2.001 20 0 BEADLO CCC[C@H](O)CNc1ccc2[nH+]cn(C)c2c1 ZINC001252791379 968972802 /nfs/dbraw/zinc/97/28/02/968972802.db2.gz SMDNCTVWNKIMFE-NSHDSACASA-N 1 2 233.315 2.146 20 0 BEADLO c1[nH]cc(Cc2nnc(-c3ccccc3)o2)[nH+]1 ZINC001253065644 969073519 /nfs/dbraw/zinc/07/35/19/969073519.db2.gz BZVSMCWZNCBUMM-UHFFFAOYSA-N 1 2 226.239 2.051 20 0 BEADLO CCOC1C[NH+](CCc2cccc(F)c2)C1 ZINC001208195108 969121077 /nfs/dbraw/zinc/12/10/77/969121077.db2.gz CQFBCSVKUMZZIC-UHFFFAOYSA-N 1 2 223.291 2.089 20 0 BEADLO CCCCC[C@H](O)C[N@@H+]1Cc2ccncc2C1 ZINC001253535635 969206946 /nfs/dbraw/zinc/20/69/46/969206946.db2.gz NDYDVTZEHHOCJZ-AWEZNQCLSA-N 1 2 234.343 2.338 20 0 BEADLO CCCCC[C@H](O)C[N@H+]1Cc2ccncc2C1 ZINC001253535635 969206954 /nfs/dbraw/zinc/20/69/54/969206954.db2.gz NDYDVTZEHHOCJZ-AWEZNQCLSA-N 1 2 234.343 2.338 20 0 BEADLO CC(=O)N1CCC[C@@H](C[NH2+]c2ccc(O)cc2)C1 ZINC001168782448 969212175 /nfs/dbraw/zinc/21/21/75/969212175.db2.gz VVBCGQPFDAFLAW-LBPRGKRZSA-N 1 2 248.326 2.063 20 0 BEADLO COc1ccc(-c2ccc(N)[nH+]c2)cc1O ZINC001242173072 969213471 /nfs/dbraw/zinc/21/34/71/969213471.db2.gz RRDJRMHETZZBMN-UHFFFAOYSA-N 1 2 216.240 2.045 20 0 BEADLO CC(C)CCC[N@@H+]1CCC[C@H](F)C(=O)C1 ZINC001208734441 969221060 /nfs/dbraw/zinc/22/10/60/969221060.db2.gz YIZMULBTHHHGTL-NSHDSACASA-N 1 2 215.312 2.426 20 0 BEADLO CC(C)CCC[N@H+]1CCC[C@H](F)C(=O)C1 ZINC001208734441 969221068 /nfs/dbraw/zinc/22/10/68/969221068.db2.gz YIZMULBTHHHGTL-NSHDSACASA-N 1 2 215.312 2.426 20 0 BEADLO CC(C)CCC[N@@H+]1CCCC(=O)[C@H](F)C1 ZINC001208734191 969222176 /nfs/dbraw/zinc/22/21/76/969222176.db2.gz RDPRJCNINNLHNQ-LLVKDONJSA-N 1 2 215.312 2.426 20 0 BEADLO CC(C)CCC[N@H+]1CCCC(=O)[C@H](F)C1 ZINC001208734191 969222186 /nfs/dbraw/zinc/22/21/86/969222186.db2.gz RDPRJCNINNLHNQ-LLVKDONJSA-N 1 2 215.312 2.426 20 0 BEADLO CCc1ncsc1N=C1CC[NH+](C)CC1 ZINC001208839214 969248714 /nfs/dbraw/zinc/24/87/14/969248714.db2.gz YYBCHFAITANIBQ-UHFFFAOYSA-N 1 2 223.345 2.337 20 0 BEADLO O=C1COc2c[nH+]c(NCCC3CCC3)cc2N1 ZINC001168883354 969258732 /nfs/dbraw/zinc/25/87/32/969258732.db2.gz LRIKDHPTWSHACN-UHFFFAOYSA-N 1 2 247.298 2.015 20 0 BEADLO Cc1c[nH+]cc(NC2COC(C)(C)OC2)c1C ZINC001168909613 969263352 /nfs/dbraw/zinc/26/33/52/969263352.db2.gz IGDNQFOFNJJFCX-UHFFFAOYSA-N 1 2 236.315 2.262 20 0 BEADLO CCC(=O)C(C)(C)C[N@@H+]1CCn2c(C)ncc2C1 ZINC001208918298 969304479 /nfs/dbraw/zinc/30/44/79/969304479.db2.gz MTNNRPPYNCSWKG-UHFFFAOYSA-N 1 2 249.358 2.012 20 0 BEADLO CCC(=O)C(C)(C)C[N@H+]1CCn2c(C)ncc2C1 ZINC001208918298 969304484 /nfs/dbraw/zinc/30/44/84/969304484.db2.gz MTNNRPPYNCSWKG-UHFFFAOYSA-N 1 2 249.358 2.012 20 0 BEADLO CC(C)[C@@H](O)CNc1ccc(N2CCCC2)[nH+]c1 ZINC001253757495 969377005 /nfs/dbraw/zinc/37/70/05/969377005.db2.gz KSCVKQPESGLBPH-ZDUSSCGKSA-N 1 2 249.358 2.111 20 0 BEADLO CC(C)[C@H](O)CNc1cccc(-n2cc[nH+]c2)c1 ZINC001253769256 969390030 /nfs/dbraw/zinc/39/00/30/969390030.db2.gz MVJNIDLFQZJUCH-CQSZACIVSA-N 1 2 245.326 2.301 20 0 BEADLO CCCC1=NNC(=c2ccnc3c2=CC=[NH+]3)O1 ZINC001253981933 969438098 /nfs/dbraw/zinc/43/80/98/969438098.db2.gz AVQHSWWONIIAIW-SECBINFHSA-N 1 2 228.255 2.042 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1C[C@H]2[C@H](CCC2(F)F)C1 ZINC001209554746 969538058 /nfs/dbraw/zinc/53/80/58/969538058.db2.gz XBZRFLACPIBHIF-KOLCDFICSA-N 1 2 241.285 2.195 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1C[C@H]2[C@H](CCC2(F)F)C1 ZINC001209554746 969538065 /nfs/dbraw/zinc/53/80/65/969538065.db2.gz XBZRFLACPIBHIF-KOLCDFICSA-N 1 2 241.285 2.195 20 0 BEADLO F[C@@H]1CSC2(C[NH+](Cc3cncs3)C2)C1 ZINC001209550014 969539294 /nfs/dbraw/zinc/53/92/94/969539294.db2.gz ZBLJTVPRCJGGML-QMMMGPOBSA-N 1 2 244.360 2.173 20 0 BEADLO Cc1n[nH]cc1C[N@@H+]1CCC(=O)[C@H]2CCCC[C@@H]21 ZINC001209554911 969543807 /nfs/dbraw/zinc/54/38/07/969543807.db2.gz QQKKSUJUSBZCCN-STQMWFEESA-N 1 2 247.342 2.052 20 0 BEADLO Cc1n[nH]cc1C[N@H+]1CCC(=O)[C@H]2CCCC[C@@H]21 ZINC001209554911 969543808 /nfs/dbraw/zinc/54/38/08/969543808.db2.gz QQKKSUJUSBZCCN-STQMWFEESA-N 1 2 247.342 2.052 20 0 BEADLO COc1cc[nH+]cc1NCCc1cc(C)ccn1 ZINC001169317879 969565915 /nfs/dbraw/zinc/56/59/15/969565915.db2.gz ILWNAKRUDRPRAT-UHFFFAOYSA-N 1 2 243.310 2.448 20 0 BEADLO Nc1[nH+]c(NCCn2cccc2)ccc1Cl ZINC001156302860 969621352 /nfs/dbraw/zinc/62/13/52/969621352.db2.gz GLZLZTSZKABKLN-UHFFFAOYSA-N 1 2 236.706 2.231 20 0 BEADLO Cc1c[nH+]cc(NC[C@H](O)C(F)(F)F)c1C ZINC001169455733 969643710 /nfs/dbraw/zinc/64/37/10/969643710.db2.gz KVEUJMASZYFHTA-VIFPVBQESA-N 1 2 234.221 2.034 20 0 BEADLO c1[nH]c2ccc(Nc3ccncn3)cc2[nH+]1 ZINC001209841575 969652413 /nfs/dbraw/zinc/65/24/13/969652413.db2.gz VYPXXFYLOKPTAI-UHFFFAOYSA-N 1 2 211.228 2.097 20 0 BEADLO c1[nH]c2ccc(Nc3cccnn3)cc2[nH+]1 ZINC001209841412 969653472 /nfs/dbraw/zinc/65/34/72/969653472.db2.gz NLQNEXJOSIKKDX-UHFFFAOYSA-N 1 2 211.228 2.097 20 0 BEADLO OCc1cccnc1Nc1ccc2[nH]c[nH+]c2c1 ZINC001209843896 969654985 /nfs/dbraw/zinc/65/49/85/969654985.db2.gz JBYNCLIONXESNZ-UHFFFAOYSA-N 1 2 240.266 2.194 20 0 BEADLO COc1cc(Nc2ccc3[nH]c[nH+]c3c2)ncn1 ZINC001209842839 969657502 /nfs/dbraw/zinc/65/75/02/969657502.db2.gz QQCXRMGBXNFIPL-UHFFFAOYSA-N 1 2 241.254 2.105 20 0 BEADLO COc1ccc(CNc2c[nH+]c(C)c(C)c2)nn1 ZINC001169468868 969669883 /nfs/dbraw/zinc/66/98/83/969669883.db2.gz DEUPKTWQJWDYQE-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO Cn1c2ccccc2[nH+]c1Nc1ccnnc1 ZINC001209954558 969711168 /nfs/dbraw/zinc/71/11/68/969711168.db2.gz KSXVXHZZODOFIE-UHFFFAOYSA-N 1 2 225.255 2.107 20 0 BEADLO C[C@H](OCC[NH+]1CCOCC1)c1cccs1 ZINC001210191745 969824636 /nfs/dbraw/zinc/82/46/36/969824636.db2.gz HTAAISQXOHATEH-NSHDSACASA-N 1 2 241.356 2.158 20 0 BEADLO C[C@@H]1CC[C@H](C)[C@H](OCC[NH+]2CCOCC2)C1 ZINC001210209032 969832465 /nfs/dbraw/zinc/83/24/65/969832465.db2.gz YAVJOHIJCGYRDB-HZSPNIEDSA-N 1 2 241.375 2.160 20 0 BEADLO CCC[C@@H](OCC[NH+]1CCOCC1)C(C)C ZINC001210208456 969833142 /nfs/dbraw/zinc/83/31/42/969833142.db2.gz SOXLJJKXXKPSTE-CYBMUJFWSA-N 1 2 229.364 2.160 20 0 BEADLO Cn1cc(Nc2cccc3cc[nH+]cc32)nn1 ZINC001210224880 969837490 /nfs/dbraw/zinc/83/74/90/969837490.db2.gz ZHXUVFNRLWCPDM-UHFFFAOYSA-N 1 2 225.255 2.107 20 0 BEADLO COc1ccc(NCc2ncccc2O)[nH+]c1C ZINC001169733102 969838057 /nfs/dbraw/zinc/83/80/57/969838057.db2.gz SLCJSEVCWLFQDF-UHFFFAOYSA-N 1 2 245.282 2.111 20 0 BEADLO Oc1cccnc1CNc1ccc2[nH]c[nH+]c2c1 ZINC001169732664 969838656 /nfs/dbraw/zinc/83/86/56/969838656.db2.gz OQLSBGCQEPKVTA-UHFFFAOYSA-N 1 2 240.266 2.276 20 0 BEADLO Cc1cnc(Nc2c[nH+]c(C)c(N)c2)nc1C ZINC001210285339 969850972 /nfs/dbraw/zinc/85/09/72/969850972.db2.gz PBNYAVDOMAGRIX-UHFFFAOYSA-N 1 2 229.287 2.123 20 0 BEADLO Cc1ncc(Nc2c[nH+]c(C)c(N)c2)c(C)n1 ZINC001210287318 969854232 /nfs/dbraw/zinc/85/42/32/969854232.db2.gz QVAKAKWOHPGHRK-UHFFFAOYSA-N 1 2 229.287 2.123 20 0 BEADLO Cc1cnc(Nc2c[nH+]c(C)c(N)c2)c(Cl)n1 ZINC001210287170 969854489 /nfs/dbraw/zinc/85/44/89/969854489.db2.gz NBOPOXUCWLIIRM-UHFFFAOYSA-N 1 2 249.705 2.468 20 0 BEADLO Cc1[nH+]cc(Nc2cncc(Cl)n2)cc1N ZINC001210287437 969854929 /nfs/dbraw/zinc/85/49/29/969854929.db2.gz UBBMNPSFMDHFGF-UHFFFAOYSA-N 1 2 235.678 2.159 20 0 BEADLO Cc1[nH+]cc(-n2ccc3cccc(N)c32)cc1N ZINC001210291967 969858428 /nfs/dbraw/zinc/85/84/28/969858428.db2.gz WNWWODJNMFMTCM-UHFFFAOYSA-N 1 2 238.294 2.498 20 0 BEADLO Cc1[nH+]cc(Nc2c(F)cccc2CO)cc1N ZINC001210291097 969859698 /nfs/dbraw/zinc/85/96/98/969859698.db2.gz JWZMBOXGNVPUFF-UHFFFAOYSA-N 1 2 247.273 2.347 20 0 BEADLO FC[C@H]1CC[N@@H+](C2CCOCC2)CC1(F)F ZINC001255038993 969861479 /nfs/dbraw/zinc/86/14/79/969861479.db2.gz QWOHGGPBQZRMJB-SECBINFHSA-N 1 2 237.265 2.092 20 0 BEADLO FC[C@H]1CC[N@H+](C2CCOCC2)CC1(F)F ZINC001255038993 969861483 /nfs/dbraw/zinc/86/14/83/969861483.db2.gz QWOHGGPBQZRMJB-SECBINFHSA-N 1 2 237.265 2.092 20 0 BEADLO Cc1c[nH+]c(Nc2cncc(N)c2)c(C)c1 ZINC001210437524 969887821 /nfs/dbraw/zinc/88/78/21/969887821.db2.gz ZGIKLNSGZIIESP-UHFFFAOYSA-N 1 2 214.272 2.419 20 0 BEADLO C[C@@H](O)c1cccc(N(C)c2[nH+]cccc2N)c1 ZINC001210502442 969911160 /nfs/dbraw/zinc/91/11/60/969911160.db2.gz AEMRTTMWDAOINJ-SNVBAGLBSA-N 1 2 243.310 2.485 20 0 BEADLO Cc1ncc(-c2c[nH+]c3c(c2)CCCN3)cc1N ZINC001242411430 969924841 /nfs/dbraw/zinc/92/48/41/969924841.db2.gz KTUDVIZLQQMOAP-UHFFFAOYSA-N 1 2 240.310 2.035 20 0 BEADLO CSCc1cc[nH+]c(NC2CC(=O)C2)c1 ZINC001156618501 969945049 /nfs/dbraw/zinc/94/50/49/969945049.db2.gz OULRQTCVTIDPLD-UHFFFAOYSA-N 1 2 222.313 2.088 20 0 BEADLO CCc1nnc(-c2cccc(-n3cc[nH+]c3)c2)o1 ZINC001255131588 969946517 /nfs/dbraw/zinc/94/65/17/969946517.db2.gz FEBRLGKGNOLCIO-UHFFFAOYSA-N 1 2 240.266 2.485 20 0 BEADLO C[N@@H+]1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC001255189324 969999872 /nfs/dbraw/zinc/99/98/72/969999872.db2.gz UEMWTOZLULSBCV-SNVBAGLBSA-N 1 2 221.304 2.494 20 0 BEADLO C[N@H+]1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC001255189324 969999877 /nfs/dbraw/zinc/99/98/77/969999877.db2.gz UEMWTOZLULSBCV-SNVBAGLBSA-N 1 2 221.304 2.494 20 0 BEADLO C[N@@H+]1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC001255189323 969999952 /nfs/dbraw/zinc/99/99/52/969999952.db2.gz UEMWTOZLULSBCV-JTQLQIEISA-N 1 2 221.304 2.494 20 0 BEADLO C[N@H+]1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC001255189323 969999955 /nfs/dbraw/zinc/99/99/55/969999955.db2.gz UEMWTOZLULSBCV-JTQLQIEISA-N 1 2 221.304 2.494 20 0 BEADLO COc1cc(Nc2conc2C)cc(C)[nH+]1 ZINC001210779031 970028385 /nfs/dbraw/zinc/02/83/85/970028385.db2.gz CNUCCOHFLPBDQR-UHFFFAOYSA-N 1 2 219.244 2.439 20 0 BEADLO FC1(F)C[NH2+]CCN(CC2CCCCC2)C1 ZINC001210815632 970047730 /nfs/dbraw/zinc/04/77/30/970047730.db2.gz YBWZQAISCLOFNN-UHFFFAOYSA-N 1 2 232.318 2.107 20 0 BEADLO CC(C)(C)c1noc(-c2ccnc(NC=[NH2+])c2)n1 ZINC001157078285 970080494 /nfs/dbraw/zinc/08/04/94/970080494.db2.gz KJLCOKXOKYAHJU-UHFFFAOYSA-N 1 2 245.286 2.448 20 0 BEADLO Cc1cc2ncnc(NC=[NH2+])c2cc1C ZINC001157079802 970081010 /nfs/dbraw/zinc/08/10/10/970081010.db2.gz BXBNIQJHTLCDFE-UHFFFAOYSA-N 1 2 200.245 2.266 20 0 BEADLO COC(=O)C1([NH2+][C@H](C)CCCC(C)C)CC1 ZINC001170057816 970102906 /nfs/dbraw/zinc/10/29/06/970102906.db2.gz OFBYTHAWTXINMC-LLVKDONJSA-N 1 2 227.348 2.496 20 0 BEADLO CCCC[C@@H](C)[N@@H+]1CC(F)(F)C[C@H]1CO ZINC001255323964 970104750 /nfs/dbraw/zinc/10/47/50/970104750.db2.gz XFAHYBKECLDUFE-ZJUUUORDSA-N 1 2 221.291 2.267 20 0 BEADLO CCCC[C@@H](C)[N@H+]1CC(F)(F)C[C@H]1CO ZINC001255323964 970104753 /nfs/dbraw/zinc/10/47/53/970104753.db2.gz XFAHYBKECLDUFE-ZJUUUORDSA-N 1 2 221.291 2.267 20 0 BEADLO CCOC(=O)[C@H]1CCC[C@@H]([N@H+](C)CC(F)F)C1 ZINC001255379940 970129180 /nfs/dbraw/zinc/12/91/80/970129180.db2.gz YQIPBHQZZNWDEA-VHSXEESVSA-N 1 2 249.301 2.305 20 0 BEADLO CCOC(=O)[C@H]1CCC[C@@H]([N@@H+](C)CC(F)F)C1 ZINC001255379940 970129183 /nfs/dbraw/zinc/12/91/83/970129183.db2.gz YQIPBHQZZNWDEA-VHSXEESVSA-N 1 2 249.301 2.305 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC23COC3)s1 ZINC001204033249 970140788 /nfs/dbraw/zinc/14/07/88/970140788.db2.gz MZQKCZSSSVKRPO-UHFFFAOYSA-N 1 2 209.314 2.031 20 0 BEADLO Cc1ccc(C[N@H+]2CCC23COC3)s1 ZINC001204033249 970140794 /nfs/dbraw/zinc/14/07/94/970140794.db2.gz MZQKCZSSSVKRPO-UHFFFAOYSA-N 1 2 209.314 2.031 20 0 BEADLO Cc1cc(-c2cncc(CO)c2)cn2cc[nH+]c12 ZINC001242972543 970187670 /nfs/dbraw/zinc/18/76/70/970187670.db2.gz VZKDJHPYLFXTAW-UHFFFAOYSA-N 1 2 239.278 2.197 20 0 BEADLO Cc1c(F)cc[nH+]c1NCC1(F)CCOCC1 ZINC001157350798 970199955 /nfs/dbraw/zinc/19/99/55/970199955.db2.gz IZSUJWAJMVKGDW-UHFFFAOYSA-N 1 2 242.269 2.460 20 0 BEADLO CCCNc1ccc(CC(=O)OCC)c[nH+]1 ZINC001157357542 970201829 /nfs/dbraw/zinc/20/18/29/970201829.db2.gz PYHBIQYSKIVYJJ-UHFFFAOYSA-N 1 2 222.288 2.009 20 0 BEADLO COc1cccc(Nc2ccn3cc[nH+]c3c2)n1 ZINC001211299560 970225695 /nfs/dbraw/zinc/22/56/95/970225695.db2.gz KBKHXOCVAWENMD-UHFFFAOYSA-N 1 2 240.266 2.482 20 0 BEADLO Cn1cncc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243067675 970254882 /nfs/dbraw/zinc/25/48/82/970254882.db2.gz NCRGKFWWOGICLV-UHFFFAOYSA-N 1 2 238.294 2.332 20 0 BEADLO COC(=O)c1cc(-c2c[nH+]cn2C)ccc1C ZINC001243066830 970256992 /nfs/dbraw/zinc/25/69/92/970256992.db2.gz MYJHUDQBKBHBQN-UHFFFAOYSA-N 1 2 230.267 2.182 20 0 BEADLO CCOC(=O)c1cc(F)cc(-c2c[nH+]cn2C)c1 ZINC001243070346 970273587 /nfs/dbraw/zinc/27/35/87/970273587.db2.gz SZEOGIALSPEJJQ-UHFFFAOYSA-N 1 2 248.257 2.403 20 0 BEADLO COc1cc(Nc2c[nH+]cc(C)c2C)no1 ZINC001213525483 970340196 /nfs/dbraw/zinc/34/01/96/970340196.db2.gz ZEDZFJATPLAAKM-UHFFFAOYSA-N 1 2 219.244 2.439 20 0 BEADLO Cc1cnn(C)c1Nc1c[nH+]cc(C)c1C ZINC001213525399 970346427 /nfs/dbraw/zinc/34/64/27/970346427.db2.gz USBMNEHVMLDWOU-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO C[C@H](CC(F)(F)F)[NH2+]C1(c2ncccn2)CC1 ZINC001255643521 970415508 /nfs/dbraw/zinc/41/55/08/970415508.db2.gz QHSWIEJODQFRSU-MRVPVSSYSA-N 1 2 245.248 2.396 20 0 BEADLO Cc1cc(N)ccc1Nc1[nH+]cccc1N ZINC001214106054 970435841 /nfs/dbraw/zinc/43/58/41/970435841.db2.gz UGCNCHODSPHPNT-UHFFFAOYSA-N 1 2 214.272 2.298 20 0 BEADLO CC[N@@H+]([C@H](C)CC(F)(F)F)[C@@H](C)C(=O)OC ZINC001255662986 970442541 /nfs/dbraw/zinc/44/25/41/970442541.db2.gz WYJCZIQPBKJRML-SFYZADRCSA-N 1 2 241.253 2.211 20 0 BEADLO CC[N@H+]([C@H](C)CC(F)(F)F)[C@@H](C)C(=O)OC ZINC001255662986 970442537 /nfs/dbraw/zinc/44/25/37/970442537.db2.gz WYJCZIQPBKJRML-SFYZADRCSA-N 1 2 241.253 2.211 20 0 BEADLO CC[C@H]([NH2+][C@@H](C)Cc1ccc(C)cc1)C(=O)OC ZINC001255773882 970480617 /nfs/dbraw/zinc/48/06/17/970480617.db2.gz RJHHNEONJFACSG-JSGCOSHPSA-N 1 2 249.354 2.467 20 0 BEADLO CCCOC(=O)C[NH2+][C@H](C)Cc1ccc(C)cc1 ZINC001255782800 970487379 /nfs/dbraw/zinc/48/73/79/970487379.db2.gz JTHDUGRKAGGNOA-CYBMUJFWSA-N 1 2 249.354 2.469 20 0 BEADLO CCOC1C[NH+]([C@H](C)Cc2ccccc2F)C1 ZINC001255841032 970513361 /nfs/dbraw/zinc/51/33/61/970513361.db2.gz BBJBNVYOGRXGSW-LLVKDONJSA-N 1 2 237.318 2.477 20 0 BEADLO CCCCCCc1nnc(C[NH+](C)C)o1 ZINC001256313272 970731342 /nfs/dbraw/zinc/73/13/42/970731342.db2.gz OPLYIGVYALBVTD-UHFFFAOYSA-N 1 2 211.309 2.254 20 0 BEADLO C[C@H]1C[C@@H](Nc2ccc(N3CCCC3)[nH+]c2)CO1 ZINC000401805910 970734335 /nfs/dbraw/zinc/73/43/35/970734335.db2.gz BTSSTIPHQUYBOV-WCQYABFASA-N 1 2 247.342 2.271 20 0 BEADLO CC(C)CCCc1nnc(C[NH+](C)C)o1 ZINC001327355710 972558138 /nfs/dbraw/zinc/55/81/38/972558138.db2.gz XLDZZRLGLDOGLG-UHFFFAOYSA-N 1 2 211.309 2.110 20 0 BEADLO Cn1c[nH+]cc1CO[C@@H]1C[C@@H]2CC[C@H]1C2 ZINC001222600643 972597931 /nfs/dbraw/zinc/59/79/31/972597931.db2.gz SYLARTPXIOJRCI-JFGNBEQYSA-N 1 2 206.289 2.125 20 0 BEADLO C[C@H](OCc1c[nH+]cn1C)c1ncccc1F ZINC001222600088 972600225 /nfs/dbraw/zinc/60/02/25/972600225.db2.gz IHZVBBVPPMNNNB-VIFPVBQESA-N 1 2 235.262 2.232 20 0 BEADLO CC(C)[C@@H]1CCC[N@H+](Cc2nnc[nH]2)CC1 ZINC001327511614 972606505 /nfs/dbraw/zinc/60/65/05/972606505.db2.gz IPUQHPYGRXEJMB-LLVKDONJSA-N 1 2 222.336 2.063 20 0 BEADLO CC(C)[C@@H]1CCC[N@@H+](Cc2nnc[nH]2)CC1 ZINC001327511614 972606515 /nfs/dbraw/zinc/60/65/15/972606515.db2.gz IPUQHPYGRXEJMB-LLVKDONJSA-N 1 2 222.336 2.063 20 0 BEADLO C[C@@H]([NH2+]Cc1ncn[nH]1)[C@H](C)c1ccccc1 ZINC001327553913 972634188 /nfs/dbraw/zinc/63/41/88/972634188.db2.gz KABKLHZAZXTLRS-WDEREUQCSA-N 1 2 230.315 2.087 20 0 BEADLO C[C@H](c1ccccc1)[C@H](C)[NH2+]Cc1ncn[nH]1 ZINC001327553912 972637322 /nfs/dbraw/zinc/63/73/22/972637322.db2.gz KABKLHZAZXTLRS-QWRGUYRKSA-N 1 2 230.315 2.087 20 0 BEADLO C[NH+](C)Cc1nnc(CCCC(F)(F)F)o1 ZINC001327808131 972736173 /nfs/dbraw/zinc/73/61/73/972736173.db2.gz JDODIESWTHCQEW-UHFFFAOYSA-N 1 2 237.225 2.016 20 0 BEADLO CCOC(=O)c1[nH]ccc1C[NH+]1CC2(CCC2)C1 ZINC001144328612 972779601 /nfs/dbraw/zinc/77/96/01/972779601.db2.gz ZZFXSKCYORGDJE-UHFFFAOYSA-N 1 2 248.326 2.177 20 0 BEADLO CC[NH+]1CC(OCc2csc(C(C)C)n2)C1 ZINC001222988892 972785689 /nfs/dbraw/zinc/78/56/89/972785689.db2.gz HBNVMCRLQLLNED-UHFFFAOYSA-N 1 2 240.372 2.487 20 0 BEADLO FC(F)(F)c1ncccc1C[NH+]1CC=CC1 ZINC001144520211 972853117 /nfs/dbraw/zinc/85/31/17/972853117.db2.gz LPNWQYAJQJJVJF-UHFFFAOYSA-N 1 2 228.217 2.472 20 0 BEADLO Oc1cc(F)c(C[N@@H+]2C[C@@H]3C[C@@H]3C2)c(F)c1 ZINC001144544825 972858157 /nfs/dbraw/zinc/85/81/57/972858157.db2.gz IVZZNWMISIRBRN-OCAPTIKFSA-N 1 2 225.238 2.122 20 0 BEADLO Oc1cc(F)c(C[N@H+]2C[C@@H]3C[C@@H]3C2)c(F)c1 ZINC001144544825 972858161 /nfs/dbraw/zinc/85/81/61/972858161.db2.gz IVZZNWMISIRBRN-OCAPTIKFSA-N 1 2 225.238 2.122 20 0 BEADLO C[C@H](C(=O)N[C@H]1CC[C@@H](C)C[C@H]1C)n1cc[nH+]c1 ZINC001328074860 972866287 /nfs/dbraw/zinc/86/62/87/972866287.db2.gz FHFDMTZPFAXPAT-LPWJVIDDSA-N 1 2 249.358 2.385 20 0 BEADLO C[C@@H](c1nnc(C[NH+](C)C)o1)c1ccccc1F ZINC001328433522 973056441 /nfs/dbraw/zinc/05/64/41/973056441.db2.gz NWUHUNCUVWZFLC-SECBINFHSA-N 1 2 249.289 2.422 20 0 BEADLO O=C(N[C@@H]1C=CCC1)c1cc2c[nH+]ccc2[nH]1 ZINC001146395734 973151172 /nfs/dbraw/zinc/15/11/72/973151172.db2.gz GGWKHACBQNEMLM-SNVBAGLBSA-N 1 2 227.267 2.011 20 0 BEADLO O=C(N[C@H]1C=CCC1)c1cc2c[nH+]ccc2[nH]1 ZINC001146395733 973153024 /nfs/dbraw/zinc/15/30/24/973153024.db2.gz GGWKHACBQNEMLM-JTQLQIEISA-N 1 2 227.267 2.011 20 0 BEADLO O=C(Nc1cc[nH+]c2c1CCC2)C1=CCCCC1 ZINC001146707786 973224371 /nfs/dbraw/zinc/22/43/71/973224371.db2.gz BEQJFAGRKLRQLT-UHFFFAOYSA-N 1 2 242.322 2.431 20 0 BEADLO CC[C@H](OC1C[NH+](C)C1)c1ccccc1 ZINC001223709739 973232651 /nfs/dbraw/zinc/23/26/51/973232651.db2.gz YKUOQFMVHUEUCD-ZDUSSCGKSA-N 1 2 205.301 2.468 20 0 BEADLO C[NH+]1CC(OCc2ccc3ncccc3c2)C1 ZINC001223799707 973283989 /nfs/dbraw/zinc/28/39/89/973283989.db2.gz VZRFTMIOYIXAHZ-UHFFFAOYSA-N 1 2 228.295 2.065 20 0 BEADLO C[C@@H](C(=O)NC(C)(C1CC1)C1CC1)n1cc[nH+]c1 ZINC001328826547 973362124 /nfs/dbraw/zinc/36/21/24/973362124.db2.gz HAEOFSZVXFJOIJ-JTQLQIEISA-N 1 2 247.342 2.139 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N(C(=O)[C@H](C)n2cc[nH+]c2)C1 ZINC001328827670 973364409 /nfs/dbraw/zinc/36/44/09/973364409.db2.gz LZHPDEYDDADXMJ-FRRDWIJNSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1cc(NC(=O)C2(C(C)(F)F)CC2)cc[nH+]1 ZINC001328882171 973382260 /nfs/dbraw/zinc/38/22/60/973382260.db2.gz NSJSOUKDLCYCKH-UHFFFAOYSA-N 1 2 240.253 2.186 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1COCc2ccccc21 ZINC001171293342 973395442 /nfs/dbraw/zinc/39/54/42/973395442.db2.gz FHNRGHIFCDNZQP-CQSZACIVSA-N 1 2 244.269 2.326 20 0 BEADLO C[C@@H](C(=O)NCC[C@@H]1CC=CCC1)n1cc[nH+]c1 ZINC001329182993 973550400 /nfs/dbraw/zinc/55/04/00/973550400.db2.gz FUROLROQQUXEKA-QWHCGFSZSA-N 1 2 247.342 2.307 20 0 BEADLO C[C@H](C(=O)NC[C@H]1CCCC12CC2)n1cc[nH+]c1 ZINC001329280708 973637928 /nfs/dbraw/zinc/63/79/28/973637928.db2.gz JIIFIGMWYCHGGK-VXGBXAGGSA-N 1 2 247.342 2.141 20 0 BEADLO CO[C@@H]1CCCC[C@H]1[NH2+]CC(F)(F)C(F)F ZINC000234781705 973743499 /nfs/dbraw/zinc/74/34/99/973743499.db2.gz KTFZMYUUDZMWGE-HTQZYQBOSA-N 1 2 243.244 2.434 20 0 BEADLO CC(C)(C)c1cn(CC(=O)NC2CCCC2)c[nH+]1 ZINC001329723110 973898447 /nfs/dbraw/zinc/89/84/47/973898447.db2.gz KKCNZBUSHGNNJD-UHFFFAOYSA-N 1 2 249.358 2.239 20 0 BEADLO c1c2n(nc1C1CC1)CCN(c1cccc[nH+]1)C2 ZINC000585384939 973910684 /nfs/dbraw/zinc/91/06/84/973910684.db2.gz GFVIVNPJZMWFGM-UHFFFAOYSA-N 1 2 240.310 2.176 20 0 BEADLO CC(C)C[C@H](C(=O)NC1(C)CC1)n1cc[nH+]c1 ZINC001329794298 973934050 /nfs/dbraw/zinc/93/40/50/973934050.db2.gz ZTNFFKWZEILAEP-LLVKDONJSA-N 1 2 235.331 2.139 20 0 BEADLO CC(C)(Nc1cc[nH+]cc1F)c1ccncc1 ZINC001171514910 974091207 /nfs/dbraw/zinc/09/12/07/974091207.db2.gz YPIRUSHZPXCMMW-UHFFFAOYSA-N 1 2 231.274 2.385 20 0 BEADLO CCOC(=O)C[NH2+][C@H]1CCc2c(C)cccc2C1 ZINC001171557838 974101631 /nfs/dbraw/zinc/10/16/31/974101631.db2.gz WZNDPUBQSVPXBN-ZDUSSCGKSA-N 1 2 247.338 2.005 20 0 BEADLO CCOC(=O)C[NH2+][C@@H]1CCc2c(C)cccc2C1 ZINC001171557836 974101669 /nfs/dbraw/zinc/10/16/69/974101669.db2.gz WZNDPUBQSVPXBN-CYBMUJFWSA-N 1 2 247.338 2.005 20 0 BEADLO C[C@H](c1csnn1)[N@@H+]1C[C@H]2CCCC[C@H]21 ZINC001171755911 974145496 /nfs/dbraw/zinc/14/54/96/974145496.db2.gz AGJRLCPKUOQOME-FXPVBKGRSA-N 1 2 223.345 2.474 20 0 BEADLO C[C@H](c1csnn1)[N@H+]1C[C@H]2CCCC[C@H]21 ZINC001171755911 974145507 /nfs/dbraw/zinc/14/55/07/974145507.db2.gz AGJRLCPKUOQOME-FXPVBKGRSA-N 1 2 223.345 2.474 20 0 BEADLO C[C@H]1CC(=O)CC[N@@H+]1[C@@H]1Cc2cccc(F)c2C1 ZINC001171792655 974187698 /nfs/dbraw/zinc/18/76/98/974187698.db2.gz IDRYJYIHZSJRDE-CMPLNLGQSA-N 1 2 247.313 2.346 20 0 BEADLO C[C@H]1CC(=O)CC[N@H+]1[C@@H]1Cc2cccc(F)c2C1 ZINC001171792655 974187710 /nfs/dbraw/zinc/18/77/10/974187710.db2.gz IDRYJYIHZSJRDE-CMPLNLGQSA-N 1 2 247.313 2.346 20 0 BEADLO Cc1ncc(Cn2c[nH+]c(C(C)(C)C)c2)cn1 ZINC001330322491 974233468 /nfs/dbraw/zinc/23/34/68/974233468.db2.gz CZRVIXBNBROEEX-UHFFFAOYSA-N 1 2 230.315 2.327 20 0 BEADLO Cc1c([C@@H](C)Oc2cc[nH+]cc2)cnn1C ZINC001225289741 974361179 /nfs/dbraw/zinc/36/11/79/974361179.db2.gz OLGYKUOAJMIDCU-SNVBAGLBSA-N 1 2 217.272 2.264 20 0 BEADLO CC(C)[NH+]1CC(Oc2ccc(F)cc2F)C1 ZINC001225312961 974388808 /nfs/dbraw/zinc/38/88/08/974388808.db2.gz BPDLXPJRPSUHLE-UHFFFAOYSA-N 1 2 227.254 2.436 20 0 BEADLO CC[C@@](C)([NH2+]Cc1nnc[nH]1)c1ccc(F)cc1 ZINC001330687805 974414088 /nfs/dbraw/zinc/41/40/88/974414088.db2.gz CXAXCBMXAAAWIL-CYBMUJFWSA-N 1 2 248.305 2.359 20 0 BEADLO CCc1nn(C[N@@H+]2CC[C@@H](C)C2)c(=S)o1 ZINC001331006747 974555373 /nfs/dbraw/zinc/55/53/73/974555373.db2.gz CKFCORMQVLUKOA-MRVPVSSYSA-N 1 2 227.333 2.067 20 0 BEADLO CCc1nn(C[N@H+]2CC[C@@H](C)C2)c(=S)o1 ZINC001331006747 974555383 /nfs/dbraw/zinc/55/53/83/974555383.db2.gz CKFCORMQVLUKOA-MRVPVSSYSA-N 1 2 227.333 2.067 20 0 BEADLO C[C@@H]1CC[C@H]([N@@H+]2CCC(=O)[C@@H](F)C2)C[C@H]1C ZINC001172374713 974577396 /nfs/dbraw/zinc/57/73/96/974577396.db2.gz AMBPSZKPZIFONI-WYUUTHIRSA-N 1 2 227.323 2.424 20 0 BEADLO C[C@@H]1CC[C@H]([N@H+]2CCC(=O)[C@@H](F)C2)C[C@H]1C ZINC001172374713 974577410 /nfs/dbraw/zinc/57/74/10/974577410.db2.gz AMBPSZKPZIFONI-WYUUTHIRSA-N 1 2 227.323 2.424 20 0 BEADLO CC[C@H](C)OCC[C@H](C)[N@@H+]1Cc2cncnc2C1 ZINC001172341744 974607488 /nfs/dbraw/zinc/60/74/88/974607488.db2.gz VATXHVJGZSJAID-RYUDHWBXSA-N 1 2 249.358 2.386 20 0 BEADLO CC[C@H](C)OCC[C@H](C)[N@H+]1Cc2cncnc2C1 ZINC001172341744 974607495 /nfs/dbraw/zinc/60/74/95/974607495.db2.gz VATXHVJGZSJAID-RYUDHWBXSA-N 1 2 249.358 2.386 20 0 BEADLO COC(=O)C1([NH2+][C@@H]2CC[C@H](C)[C@@H](C)C2)CC1 ZINC001172361480 974633592 /nfs/dbraw/zinc/63/35/92/974633592.db2.gz XJZBPKHRPSJKST-GARJFASQSA-N 1 2 225.332 2.106 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@H]2OCCC[C@H]2C1 ZINC001331272426 974668158 /nfs/dbraw/zinc/66/81/58/974668158.db2.gz UZBFYIBYAXQXDG-GXFFZTMASA-N 1 2 236.290 2.226 20 0 BEADLO CCCCOC(=O)[C@H](C)[NH2+][C@H](C)CCOCC ZINC001172412211 974677496 /nfs/dbraw/zinc/67/74/96/974677496.db2.gz VMDGQCLLNMOABZ-NEPJUHHUSA-N 1 2 245.363 2.123 20 0 BEADLO Cc1ccc(Cl)cc1OC1C[NH+](C)C1 ZINC001225874461 974709688 /nfs/dbraw/zinc/70/96/88/974709688.db2.gz QAFYLNMJFUWVPU-UHFFFAOYSA-N 1 2 211.692 2.341 20 0 BEADLO C[NH+]1CC(Oc2ccc(F)c(Cl)c2)C1 ZINC001225917011 974727959 /nfs/dbraw/zinc/72/79/59/974727959.db2.gz DFKDQTZNROEUTJ-UHFFFAOYSA-N 1 2 215.655 2.172 20 0 BEADLO CC[NH+]1CC(Oc2cc(F)ccc2C)C1 ZINC001225988379 974751251 /nfs/dbraw/zinc/75/12/51/974751251.db2.gz OQZKPOKKAUGZOS-UHFFFAOYSA-N 1 2 209.264 2.217 20 0 BEADLO COC(=O)C[NH2+][C@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172537266 974875097 /nfs/dbraw/zinc/87/50/97/974875097.db2.gz JTVMJZNXRXUXFZ-KGLIPLIRSA-N 1 2 247.338 2.475 20 0 BEADLO Cc1cc(N[C@@H](C)Cn2cccn2)c[nH+]c1C ZINC001331933858 974875362 /nfs/dbraw/zinc/87/53/62/974875362.db2.gz TXDQPDVGUHRXPD-NSHDSACASA-N 1 2 230.315 2.396 20 0 BEADLO CC[NH+]1CC(Oc2ccc3ncsc3c2)C1 ZINC001226636921 974988290 /nfs/dbraw/zinc/98/82/90/974988290.db2.gz HATJZMUFXDQKID-UHFFFAOYSA-N 1 2 234.324 2.379 20 0 BEADLO FC1C[NH+](C2CCC3(CCOCC3)CC2)C1 ZINC001173043392 975013530 /nfs/dbraw/zinc/01/35/30/975013530.db2.gz JKXKEAQSLAXZTL-UHFFFAOYSA-N 1 2 227.323 2.380 20 0 BEADLO CCc1ccc(C[C@H](C)[NH2+][C@@H](C)C(=O)OC)cc1 ZINC001173235101 975077703 /nfs/dbraw/zinc/07/77/03/975077703.db2.gz IRQOLZHWXWBNMS-RYUDHWBXSA-N 1 2 249.354 2.331 20 0 BEADLO Cc1ccc(N[C@H](C)c2cc(CO)on2)c(C)[nH+]1 ZINC001332432950 975116289 /nfs/dbraw/zinc/11/62/89/975116289.db2.gz AIWYSOUHIUHXRG-SNVBAGLBSA-N 1 2 247.298 2.352 20 0 BEADLO C[NH+]1CC(Oc2cccc3cc(O)ccc32)C1 ZINC001226862968 975129730 /nfs/dbraw/zinc/12/97/30/975129730.db2.gz UYVMBYQWUJMQRU-UHFFFAOYSA-N 1 2 229.279 2.238 20 0 BEADLO CCc1ccc(C[C@H](C)[NH2+][C@H]2CCOC2=O)cc1 ZINC001173239940 975165621 /nfs/dbraw/zinc/16/56/21/975165621.db2.gz VEIHEUVFNFUKQW-FZMZJTMJSA-N 1 2 247.338 2.085 20 0 BEADLO CC[C@H]1CC[C@H]([N@H+]2C[C@@H](F)C[C@H]2C(=O)OC)C1 ZINC001173280297 975235261 /nfs/dbraw/zinc/23/52/61/975235261.db2.gz LMPNYZJSFHQFPH-BJDJZHNGSA-N 1 2 243.322 2.151 20 0 BEADLO CC[C@H]1CC[C@H]([N@@H+]2C[C@@H](F)C[C@H]2C(=O)OC)C1 ZINC001173280297 975235251 /nfs/dbraw/zinc/23/52/51/975235251.db2.gz LMPNYZJSFHQFPH-BJDJZHNGSA-N 1 2 243.322 2.151 20 0 BEADLO CC[NH+]1CC(Oc2ccnc(C(F)(F)F)c2)C1 ZINC001227074226 975253689 /nfs/dbraw/zinc/25/36/89/975253689.db2.gz UYHPJOGEOPNRKP-UHFFFAOYSA-N 1 2 246.232 2.183 20 0 BEADLO Cc1nocc1-n1c(C)[nH+]c2ccc(N)cc21 ZINC001212722218 975266839 /nfs/dbraw/zinc/26/68/39/975266839.db2.gz SUQVHEOKZNVJEL-UHFFFAOYSA-N 1 2 228.255 2.213 20 0 BEADLO CCCc1ccc(O)cc1OC1C[NH+](CC)C1 ZINC001227148624 975295274 /nfs/dbraw/zinc/29/52/74/975295274.db2.gz UCBIEKRYYNSVNY-UHFFFAOYSA-N 1 2 235.327 2.428 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CC(C)(C)C1(C)C ZINC001332893781 975310930 /nfs/dbraw/zinc/31/09/30/975310930.db2.gz PKCDPHGVIWFASD-SNVBAGLBSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CC(C)(C)C1(C)C ZINC001332893781 975310937 /nfs/dbraw/zinc/31/09/37/975310937.db2.gz PKCDPHGVIWFASD-SNVBAGLBSA-N 1 2 249.358 2.235 20 0 BEADLO COc1nnc(C[N@@H+]2CCCC[C@@H](C)C2)s1 ZINC001332924230 975321414 /nfs/dbraw/zinc/32/14/14/975321414.db2.gz XRGGQFOVAPLUMJ-SECBINFHSA-N 1 2 241.360 2.169 20 0 BEADLO COc1nnc(C[N@H+]2CCCC[C@@H](C)C2)s1 ZINC001332924230 975321423 /nfs/dbraw/zinc/32/14/23/975321423.db2.gz XRGGQFOVAPLUMJ-SECBINFHSA-N 1 2 241.360 2.169 20 0 BEADLO COc1cccc(C[N@@H+]2CCC(=O)[C@H](C)C2)c1C ZINC001332937432 975328456 /nfs/dbraw/zinc/32/84/56/975328456.db2.gz MJVSUVDSDGFIJU-LLVKDONJSA-N 1 2 247.338 2.415 20 0 BEADLO COc1cccc(C[N@H+]2CCC(=O)[C@H](C)C2)c1C ZINC001332937432 975328466 /nfs/dbraw/zinc/32/84/66/975328466.db2.gz MJVSUVDSDGFIJU-LLVKDONJSA-N 1 2 247.338 2.415 20 0 BEADLO COc1cccc(C[N@@H+]2CCC(=O)[C@@H](C)C2)c1C ZINC001332937433 975329347 /nfs/dbraw/zinc/32/93/47/975329347.db2.gz MJVSUVDSDGFIJU-NSHDSACASA-N 1 2 247.338 2.415 20 0 BEADLO COc1cccc(C[N@H+]2CCC(=O)[C@@H](C)C2)c1C ZINC001332937433 975329354 /nfs/dbraw/zinc/32/93/54/975329354.db2.gz MJVSUVDSDGFIJU-NSHDSACASA-N 1 2 247.338 2.415 20 0 BEADLO CC(=O)N1CCC(Oc2c(C)cc[nH+]c2C)CC1 ZINC001227260374 975335205 /nfs/dbraw/zinc/33/52/05/975335205.db2.gz QEWCAICYYZPGTI-UHFFFAOYSA-N 1 2 248.326 2.088 20 0 BEADLO COC(=O)[C@@]1(C)C[C@@H](Oc2c(C)cc[nH+]c2C)C1 ZINC001227262734 975337239 /nfs/dbraw/zinc/33/72/39/975337239.db2.gz VNWDJIWQPRNKGV-VDISTLRHSA-N 1 2 249.310 2.419 20 0 BEADLO Cc1cc[nH+]c(C)c1O[C@@H]1C(=O)OCC1(C)C ZINC001227263724 975338486 /nfs/dbraw/zinc/33/84/86/975338486.db2.gz HIOISDBKXHYAPE-LLVKDONJSA-N 1 2 235.283 2.029 20 0 BEADLO CO[C@H](C[NH2+][C@@H](C)c1noc(C)n1)CC(C)C ZINC001332961836 975342652 /nfs/dbraw/zinc/34/26/52/975342652.db2.gz OUYTUICNYUQHDP-ONGXEEELSA-N 1 2 241.335 2.090 20 0 BEADLO COC(=O)CCCC[C@@H](C)[NH+]1CC(C)(F)C1 ZINC001173448218 975391562 /nfs/dbraw/zinc/39/15/62/975391562.db2.gz VKQALNTUJQHIBU-SNVBAGLBSA-N 1 2 231.311 2.152 20 0 BEADLO O=C1Cc2cc(-c3cccn4cc[nH+]c34)ccc2N1 ZINC001206202912 975418097 /nfs/dbraw/zinc/41/80/97/975418097.db2.gz LXICOHLCENXIQH-UHFFFAOYSA-N 1 2 249.273 2.496 20 0 BEADLO Cc1cc(C)c(C)c(OC2C[NH+](C)C2)c1 ZINC001227509586 975492659 /nfs/dbraw/zinc/49/26/59/975492659.db2.gz MDGZENSJSACEOQ-UHFFFAOYSA-N 1 2 205.301 2.305 20 0 BEADLO C[NH+]1CC(Oc2cccc3ccc(O)cc32)C1 ZINC001227569503 975554151 /nfs/dbraw/zinc/55/41/51/975554151.db2.gz GDWFPTYDTHTOOD-UHFFFAOYSA-N 1 2 229.279 2.238 20 0 BEADLO CNc1cc(N[C@@H]2CCOC3(CCC3)C2)[nH+]cn1 ZINC001333670112 975961583 /nfs/dbraw/zinc/96/15/83/975961583.db2.gz DLVVCTYNTWHADW-SNVBAGLBSA-N 1 2 248.330 2.032 20 0 BEADLO CC[C@@H](C)[N@H+](CC(=O)OC)Cc1cc(C)co1 ZINC001333712821 976021016 /nfs/dbraw/zinc/02/10/16/976021016.db2.gz CFMAKDZSHSHKLU-LLVKDONJSA-N 1 2 239.315 2.362 20 0 BEADLO CC[C@@H](C)[N@@H+](CC(=O)OC)Cc1cc(C)co1 ZINC001333712821 976021029 /nfs/dbraw/zinc/02/10/29/976021029.db2.gz CFMAKDZSHSHKLU-LLVKDONJSA-N 1 2 239.315 2.362 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+]2CCOC[C@H](C)C2)n1 ZINC001333732367 976040090 /nfs/dbraw/zinc/04/00/90/976040090.db2.gz FCDOAJKIAFAIBR-LLVKDONJSA-N 1 2 237.347 2.001 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+]2CCOC[C@H](C)C2)n1 ZINC001333732367 976040105 /nfs/dbraw/zinc/04/01/05/976040105.db2.gz FCDOAJKIAFAIBR-LLVKDONJSA-N 1 2 237.347 2.001 20 0 BEADLO c1cn(CCSCc2cncs2)c[nH+]1 ZINC001333737096 976048140 /nfs/dbraw/zinc/04/81/40/976048140.db2.gz PJAZNVCSNVNBFZ-UHFFFAOYSA-N 1 2 225.342 2.273 20 0 BEADLO CC[NH+]1CC(Oc2ccc3nc(C)oc3c2)C1 ZINC001228338438 976127137 /nfs/dbraw/zinc/12/71/37/976127137.db2.gz IIMBPDXIHWBRSZ-UHFFFAOYSA-N 1 2 232.283 2.219 20 0 BEADLO CN(c1ccc2c(c1)CCO2)c1[nH+]cccc1N ZINC001174008548 976169466 /nfs/dbraw/zinc/16/94/66/976169466.db2.gz AJSUMFBIGCBIAF-UHFFFAOYSA-N 1 2 241.294 2.367 20 0 BEADLO CCCc1cccc(OC2C[NH+](C)C2)c1 ZINC001228447626 976215129 /nfs/dbraw/zinc/21/51/29/976215129.db2.gz QBOMDFIFRJOGPQ-UHFFFAOYSA-N 1 2 205.301 2.332 20 0 BEADLO CCc1[nH+]ccc(C)c1Nc1cnc(OC)nc1 ZINC001174034609 976236368 /nfs/dbraw/zinc/23/63/68/976236368.db2.gz CXPPBYMZRBLGKT-UHFFFAOYSA-N 1 2 244.298 2.495 20 0 BEADLO COc1cc[nH+]c(Nc2cncc(OC)c2)c1 ZINC001174088474 976355655 /nfs/dbraw/zinc/35/56/55/976355655.db2.gz YYAZZVLHQNQSIN-UHFFFAOYSA-N 1 2 231.255 2.237 20 0 BEADLO CCc1cc(N[C@@H](CC)[C@@H](C)O)nc(CC)[nH+]1 ZINC001334265152 976416087 /nfs/dbraw/zinc/41/60/87/976416087.db2.gz QFEJPBWOIMYQPW-KOLCDFICSA-N 1 2 237.347 2.173 20 0 BEADLO COc1cc[nH+]c(Nc2c(C)nn(C)c2C)c1 ZINC001174223985 976421149 /nfs/dbraw/zinc/42/11/49/976421149.db2.gz KFKVGRJIDBFWTR-UHFFFAOYSA-N 1 2 232.287 2.184 20 0 BEADLO CCOc1ccc(C)c(OC2C[NH+](C)C2)c1 ZINC001228722284 976454938 /nfs/dbraw/zinc/45/49/38/976454938.db2.gz AAAOBGQOJICSKI-UHFFFAOYSA-N 1 2 221.300 2.087 20 0 BEADLO Cc1cn2cccc(Nc3cn[nH]c3)c2[nH+]1 ZINC001174293858 976469723 /nfs/dbraw/zinc/46/97/23/976469723.db2.gz HIVJSJLDMLVNMM-UHFFFAOYSA-N 1 2 213.244 2.109 20 0 BEADLO COc1cc(Nc2cccc3[nH+]ccn32)ccn1 ZINC001174305880 976517929 /nfs/dbraw/zinc/51/79/29/976517929.db2.gz RKLDSBPLDKGQII-UHFFFAOYSA-N 1 2 240.266 2.482 20 0 BEADLO COc1cc(N[C@H](C)Cc2cc(C)no2)cc[nH+]1 ZINC001174306225 976518875 /nfs/dbraw/zinc/51/88/75/976518875.db2.gz XKCBWHUKQKFSJK-SECBINFHSA-N 1 2 247.298 2.430 20 0 BEADLO CCc1[nH+]ccc(C)c1Nc1cnn(C)c1 ZINC001174331451 976538395 /nfs/dbraw/zinc/53/83/95/976538395.db2.gz SZCMUQNCUHLDQR-UHFFFAOYSA-N 1 2 216.288 2.430 20 0 BEADLO Nc1ccc[nH+]c1Nc1cnc2[nH]ccc2c1 ZINC001174394271 976585984 /nfs/dbraw/zinc/58/59/84/976585984.db2.gz IMKKSFUKXSRAHU-UHFFFAOYSA-N 1 2 225.255 2.235 20 0 BEADLO Cc1c[nH+]c(Nc2ccc(=O)n(C)c2)c(C)c1 ZINC001174355534 976596033 /nfs/dbraw/zinc/59/60/33/976596033.db2.gz DGGBDRJBCGOOBU-UHFFFAOYSA-N 1 2 229.283 2.141 20 0 BEADLO Cc1c[nH+]c(Nc2ccc3ncnn3c2)c(C)c1 ZINC001174372394 976609131 /nfs/dbraw/zinc/60/91/31/976609131.db2.gz GJAJVTDVHKAXHS-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO c1cn(-c2ccc(Nc3cncnc3)cc2)c[nH+]1 ZINC001174384824 976622454 /nfs/dbraw/zinc/62/24/54/976622454.db2.gz PVQDWBKYIHEYCU-UHFFFAOYSA-N 1 2 237.266 2.406 20 0 BEADLO Cc1c(Nc2cccn3cc[nH+]c23)cnn1C ZINC001174388099 976637235 /nfs/dbraw/zinc/63/72/35/976637235.db2.gz KLQGUSKKPXBGIG-UHFFFAOYSA-N 1 2 227.271 2.120 20 0 BEADLO Cc1n[nH]cc1Nc1c[nH+]c(C)cc1C ZINC001174469843 976770209 /nfs/dbraw/zinc/77/02/09/976770209.db2.gz GCVFFJLPHBCDGH-UHFFFAOYSA-N 1 2 202.261 2.474 20 0 BEADLO Cc1nc2ccc(OC3C[NH+](C)C3)cc2s1 ZINC001229315231 976811742 /nfs/dbraw/zinc/81/17/42/976811742.db2.gz WULQNYBYDXCBGO-UHFFFAOYSA-N 1 2 234.324 2.298 20 0 BEADLO Cc1cc(NC(=O)[C@H](C)n2cc[nH+]c2)cnc1C ZINC001335150535 976865893 /nfs/dbraw/zinc/86/58/93/976865893.db2.gz MQFANEFLAGGLIM-NSHDSACASA-N 1 2 244.298 2.095 20 0 BEADLO Cc1cc(O)c(C)c(C)c1OC1C[NH+](C)C1 ZINC001229769299 976985077 /nfs/dbraw/zinc/98/50/77/976985077.db2.gz MTLIOZBMRYTCOW-UHFFFAOYSA-N 1 2 221.300 2.010 20 0 BEADLO CCOc1cc[nH+]cc1Nc1cc(C)nn1C ZINC001174821911 977076533 /nfs/dbraw/zinc/07/65/33/977076533.db2.gz YHBVGIROLLPYGJ-UHFFFAOYSA-N 1 2 232.287 2.266 20 0 BEADLO C[C@H](c1ncccn1)[NH+]1CC(C)(C)OC(C)(C)C1 ZINC001335907865 977358945 /nfs/dbraw/zinc/35/89/45/977358945.db2.gz WOUFHCRMMLDKAN-LLVKDONJSA-N 1 2 249.358 2.427 20 0 BEADLO Cc1nocc1Nc1ccc(N(C)C)[nH+]c1 ZINC001175341895 977364920 /nfs/dbraw/zinc/36/49/20/977364920.db2.gz WPQCJPHWWQZHFB-UHFFFAOYSA-N 1 2 218.260 2.188 20 0 BEADLO Cc1ncc(Nc2ccc(N(C)C)[nH+]c2)nc1C ZINC001175342050 977366000 /nfs/dbraw/zinc/36/60/00/977366000.db2.gz ZFRBQLQOYWJGCV-UHFFFAOYSA-N 1 2 243.314 2.298 20 0 BEADLO Cc1noc(Nc2ccc(N(C)C)[nH+]c2)c1C ZINC001175337731 977383736 /nfs/dbraw/zinc/38/37/36/977383736.db2.gz LBKWHLZHGHMXCA-UHFFFAOYSA-N 1 2 232.287 2.496 20 0 BEADLO CC[C@H](F)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001335994557 977416526 /nfs/dbraw/zinc/41/65/26/977416526.db2.gz QDAAUWWWRIWCBB-NSHDSACASA-N 1 2 224.279 2.063 20 0 BEADLO CC(C)c1oncc1NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001336052134 977467986 /nfs/dbraw/zinc/46/79/86/977467986.db2.gz GMJGXULVERSKFH-SECBINFHSA-N 1 2 248.286 2.194 20 0 BEADLO C[C@H]1COC[C@@H]1Oc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001231083375 977474858 /nfs/dbraw/zinc/47/48/58/977474858.db2.gz JUCWNPCIGPRKTA-GWCFXTLKSA-N 1 2 244.294 2.490 20 0 BEADLO CCOc1ncc(Nc2c[nH+]ccc2OC)cn1 ZINC001175555774 977539852 /nfs/dbraw/zinc/53/98/52/977539852.db2.gz KVJFIHHXGTZXNU-UHFFFAOYSA-N 1 2 246.270 2.023 20 0 BEADLO C[N@@H+]1CCC=C(Nc2cc[nH]c(=O)c2Cl)C1 ZINC001175577451 977588959 /nfs/dbraw/zinc/58/89/59/977588959.db2.gz TUPJPDFKVKEKTN-UHFFFAOYSA-N 1 2 239.706 2.072 20 0 BEADLO C[N@H+]1CCC=C(Nc2cc[nH]c(=O)c2Cl)C1 ZINC001175577451 977588964 /nfs/dbraw/zinc/58/89/64/977588964.db2.gz TUPJPDFKVKEKTN-UHFFFAOYSA-N 1 2 239.706 2.072 20 0 BEADLO C[N@@H+]1CCC=C(Nc2c[nH]c(Cl)cc2=O)C1 ZINC001175577291 977590607 /nfs/dbraw/zinc/59/06/07/977590607.db2.gz PZNKFNPYAFJNFU-UHFFFAOYSA-N 1 2 239.706 2.072 20 0 BEADLO C[N@H+]1CCC=C(Nc2c[nH]c(Cl)cc2=O)C1 ZINC001175577291 977590616 /nfs/dbraw/zinc/59/06/16/977590616.db2.gz PZNKFNPYAFJNFU-UHFFFAOYSA-N 1 2 239.706 2.072 20 0 BEADLO C[C@H]1CC(=O)CC[N@@H+]1Cc1c[nH]c2cnccc12 ZINC001231514548 977623050 /nfs/dbraw/zinc/62/30/50/977623050.db2.gz SLJVIIGZKDWCQI-JTQLQIEISA-N 1 2 243.310 2.116 20 0 BEADLO C[C@H]1CC(=O)CC[N@H+]1Cc1c[nH]c2cnccc12 ZINC001231514548 977623053 /nfs/dbraw/zinc/62/30/53/977623053.db2.gz SLJVIIGZKDWCQI-JTQLQIEISA-N 1 2 243.310 2.116 20 0 BEADLO CC(C)Oc1ccc(C[N@@H+]2CC[C@H](F)C2)cn1 ZINC001231532242 977629536 /nfs/dbraw/zinc/62/95/36/977629536.db2.gz SBSSCPFLDZQIGT-LBPRGKRZSA-N 1 2 238.306 2.413 20 0 BEADLO CC(C)Oc1ccc(C[N@H+]2CC[C@H](F)C2)cn1 ZINC001231532242 977629550 /nfs/dbraw/zinc/62/95/50/977629550.db2.gz SBSSCPFLDZQIGT-LBPRGKRZSA-N 1 2 238.306 2.413 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCC[C@H](F)C2)cn1 ZINC001231652736 977666417 /nfs/dbraw/zinc/66/64/17/977666417.db2.gz IUCUJZGSGIOJDK-LBPRGKRZSA-N 1 2 238.306 2.414 20 0 BEADLO CCOc1ccc(C[N@H+]2CCC[C@H](F)C2)cn1 ZINC001231652736 977666424 /nfs/dbraw/zinc/66/64/24/977666424.db2.gz IUCUJZGSGIOJDK-LBPRGKRZSA-N 1 2 238.306 2.414 20 0 BEADLO Nc1cc(C(F)(F)F)c(Nc2ccon2)c[nH+]1 ZINC001175707693 977690554 /nfs/dbraw/zinc/69/05/54/977690554.db2.gz KFLCNPASMMGCAO-UHFFFAOYSA-N 1 2 244.176 2.414 20 0 BEADLO CCOc1ncccc1C[N@@H+]1C[C@@H](C)[C@@H](F)C1 ZINC001231758609 977736078 /nfs/dbraw/zinc/73/60/78/977736078.db2.gz AXLHQGPNVKMPCU-PWSUYJOCSA-N 1 2 238.306 2.270 20 0 BEADLO CCOc1ncccc1C[N@H+]1C[C@@H](C)[C@@H](F)C1 ZINC001231758609 977736093 /nfs/dbraw/zinc/73/60/93/977736093.db2.gz AXLHQGPNVKMPCU-PWSUYJOCSA-N 1 2 238.306 2.270 20 0 BEADLO CSc1ccccc1C[N@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001231785727 977752511 /nfs/dbraw/zinc/75/25/11/977752511.db2.gz BKWSHWNSCMWYDW-TXEJJXNPSA-N 1 2 235.352 2.382 20 0 BEADLO CSc1ccccc1C[N@@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001231785727 977752523 /nfs/dbraw/zinc/75/25/23/977752523.db2.gz BKWSHWNSCMWYDW-TXEJJXNPSA-N 1 2 235.352 2.382 20 0 BEADLO CCc1ccc(N(CCCCO)C2CC2)[nH+]c1 ZINC001336533633 977760532 /nfs/dbraw/zinc/76/05/32/977760532.db2.gz FEVNFDJJKSOHLQ-UHFFFAOYSA-N 1 2 234.343 2.385 20 0 BEADLO C[C@H](C(=O)NCC1(C)CCCC1)n1cc[nH+]c1 ZINC000066430877 977770393 /nfs/dbraw/zinc/77/03/93/977770393.db2.gz VXVUXVPXGGDYCH-LLVKDONJSA-N 1 2 235.331 2.141 20 0 BEADLO CC1(C)CN(c2cc(N)nc[nH+]2)CC(C)(C)C1 ZINC001336585810 977795316 /nfs/dbraw/zinc/79/53/16/977795316.db2.gz XLAYGCKGOYNFKE-UHFFFAOYSA-N 1 2 234.347 2.321 20 0 BEADLO Nc1cc(N2CCCC3(CCCC3)C2)[nH+]cn1 ZINC001336592747 977801385 /nfs/dbraw/zinc/80/13/85/977801385.db2.gz STGBWKDRSDOFGB-UHFFFAOYSA-N 1 2 232.331 2.219 20 0 BEADLO COc1ccnc(C[N@@H+]2CCCC[C@@H](F)C2)c1 ZINC001231967203 977815305 /nfs/dbraw/zinc/81/53/05/977815305.db2.gz VOPHBHBTFNBCRI-LLVKDONJSA-N 1 2 238.306 2.414 20 0 BEADLO COc1ccnc(C[N@H+]2CCCC[C@@H](F)C2)c1 ZINC001231967203 977815309 /nfs/dbraw/zinc/81/53/09/977815309.db2.gz VOPHBHBTFNBCRI-LLVKDONJSA-N 1 2 238.306 2.414 20 0 BEADLO CCc1ccc(N(C)[C@H]2C[C@@H](OC)C2)[nH+]c1 ZINC001336623251 977817112 /nfs/dbraw/zinc/81/71/12/977817112.db2.gz JTRIFNCPKMDHKE-TXEJJXNPSA-N 1 2 220.316 2.258 20 0 BEADLO COc1cc[nH+]cc1Nc1cnn(C2CC2)c1 ZINC001175956801 977819980 /nfs/dbraw/zinc/81/99/80/977819980.db2.gz FVCMQAWUXOUEPX-UHFFFAOYSA-N 1 2 230.271 2.365 20 0 BEADLO Cc1cc(F)ncc1C[N@H+]1C[C@@H](C)[C@@H](F)C1 ZINC001231979936 977823297 /nfs/dbraw/zinc/82/32/97/977823297.db2.gz LUSQMBHCFWIUOT-KOLCDFICSA-N 1 2 226.270 2.319 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccncn2)cc(C)n1 ZINC001232002841 977835411 /nfs/dbraw/zinc/83/54/11/977835411.db2.gz FINQASQJQDNMEW-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccncn2)cc(C)n1 ZINC001232002841 977835413 /nfs/dbraw/zinc/83/54/13/977835413.db2.gz FINQASQJQDNMEW-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO CC(=O)N1CC=C(Nc2ccc(C)[nH+]c2C)CC1 ZINC001176025714 977860120 /nfs/dbraw/zinc/86/01/20/977860120.db2.gz CYQBPGGFSFEOFL-UHFFFAOYSA-N 1 2 245.326 2.246 20 0 BEADLO Oc1cncc(C[N@@H+]2CCc3sccc3C2)c1 ZINC001232040453 977865469 /nfs/dbraw/zinc/86/54/69/977865469.db2.gz ILDMEDMDPKAGIJ-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO Oc1cncc(C[N@H+]2CCc3sccc3C2)c1 ZINC001232040453 977865482 /nfs/dbraw/zinc/86/54/82/977865482.db2.gz ILDMEDMDPKAGIJ-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO Cc1[nH]c([C@H]2CCCN2CCF)[nH+]c1C ZINC001176076657 977871067 /nfs/dbraw/zinc/87/10/67/977871067.db2.gz GZQMPBJCXHPDLB-SNVBAGLBSA-N 1 2 211.284 2.133 20 0 BEADLO Nc1ccc(N(c2[nH]cc[nH+]2)C2CCC2)nc1 ZINC001176082295 977880840 /nfs/dbraw/zinc/88/08/40/977880840.db2.gz DFEPAIYZGIWHSL-UHFFFAOYSA-N 1 2 229.287 2.078 20 0 BEADLO c1c[nH+]c(Nc2nsc3ncccc23)[nH]1 ZINC001176082137 977880868 /nfs/dbraw/zinc/88/08/68/977880868.db2.gz VRKXCFQWRLIJDI-UHFFFAOYSA-N 1 2 217.257 2.158 20 0 BEADLO Cc1nc(Cl)c(Nc2[nH]cc[nH+]2)nc1C ZINC001176082115 977881424 /nfs/dbraw/zinc/88/14/24/977881424.db2.gz UNDMKRIGMNQOOR-UHFFFAOYSA-N 1 2 223.667 2.214 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ccno2)c(C)n1 ZINC001232084306 977885437 /nfs/dbraw/zinc/88/54/37/977885437.db2.gz GYVLUJCCKFYYDC-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ccno2)c(C)n1 ZINC001232084306 977885438 /nfs/dbraw/zinc/88/54/38/977885438.db2.gz GYVLUJCCKFYYDC-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO C[C@@H]1C[NH+](Cc2cc3ccncc3[nH]2)C[C@@H](C)O1 ZINC001232089105 977890785 /nfs/dbraw/zinc/89/07/85/977890785.db2.gz QIJRKUMTSJTTJB-GHMZBOCLSA-N 1 2 245.326 2.172 20 0 BEADLO Cc1cc2ccc(N)cc2n1-c1[nH]cc[nH+]1 ZINC001176091383 977893204 /nfs/dbraw/zinc/89/32/04/977893204.db2.gz ZLSVNZYTIRNJLT-UHFFFAOYSA-N 1 2 212.256 2.244 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc3ccncc3[nH]2)[C@H](C)CO1 ZINC001232095380 977894084 /nfs/dbraw/zinc/89/40/84/977894084.db2.gz FSKADKQCGRYWDG-GHMZBOCLSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc3ccncc3[nH]2)[C@H](C)CO1 ZINC001232095380 977894087 /nfs/dbraw/zinc/89/40/87/977894087.db2.gz FSKADKQCGRYWDG-GHMZBOCLSA-N 1 2 245.326 2.172 20 0 BEADLO F[C@@H]1CCCC[N@H+](Cc2ccns2)C1 ZINC001232189265 977908650 /nfs/dbraw/zinc/90/86/50/977908650.db2.gz YQQINWUOBYZYBU-SECBINFHSA-N 1 2 214.309 2.467 20 0 BEADLO F[C@@H]1CCCC[N@@H+](Cc2ccns2)C1 ZINC001232189265 977908658 /nfs/dbraw/zinc/90/86/58/977908658.db2.gz YQQINWUOBYZYBU-SECBINFHSA-N 1 2 214.309 2.467 20 0 BEADLO FC[C@H]1CCC[N@@H+]1Cc1ccns1 ZINC001232195999 977915313 /nfs/dbraw/zinc/91/53/13/977915313.db2.gz VOKSVFCGNSDADO-MRVPVSSYSA-N 1 2 200.282 2.077 20 0 BEADLO FC[C@H]1CCC[N@H+]1Cc1ccns1 ZINC001232195999 977915326 /nfs/dbraw/zinc/91/53/26/977915326.db2.gz VOKSVFCGNSDADO-MRVPVSSYSA-N 1 2 200.282 2.077 20 0 BEADLO Cc1cn2c(cccc2NC2=CCOCC2)[nH+]1 ZINC001176139786 977918880 /nfs/dbraw/zinc/91/88/80/977918880.db2.gz YFDCIEHCMOUVHD-UHFFFAOYSA-N 1 2 229.283 2.359 20 0 BEADLO Cc1scnc1C[N@H+](C)C[C@H]1CCCCO1 ZINC001232203493 977921601 /nfs/dbraw/zinc/92/16/01/977921601.db2.gz DWJAMOBLUKIBKE-LLVKDONJSA-N 1 2 240.372 2.452 20 0 BEADLO Cc1scnc1C[N@@H+](C)C[C@H]1CCCCO1 ZINC001232203493 977921611 /nfs/dbraw/zinc/92/16/11/977921611.db2.gz DWJAMOBLUKIBKE-LLVKDONJSA-N 1 2 240.372 2.452 20 0 BEADLO COc1cc[nH+]cc1Nc1ccnc(F)c1 ZINC001176116810 977945106 /nfs/dbraw/zinc/94/51/06/977945106.db2.gz LEEQCVWXLBIEFD-UHFFFAOYSA-N 1 2 219.219 2.368 20 0 BEADLO COC(=O)c1occc1Nc1c[nH+]ccc1OC ZINC001176116823 977947215 /nfs/dbraw/zinc/94/72/15/977947215.db2.gz LNQBYEQRTIGVKA-UHFFFAOYSA-N 1 2 248.238 2.213 20 0 BEADLO C[N@H+](Cc1cnsc1)Cc1cccc(O)c1 ZINC001232225252 977947790 /nfs/dbraw/zinc/94/77/90/977947790.db2.gz YQIUKWLUXVONBE-UHFFFAOYSA-N 1 2 234.324 2.481 20 0 BEADLO C[N@@H+](Cc1cnsc1)Cc1cccc(O)c1 ZINC001232225252 977947801 /nfs/dbraw/zinc/94/78/01/977947801.db2.gz YQIUKWLUXVONBE-UHFFFAOYSA-N 1 2 234.324 2.481 20 0 BEADLO C[N@H+](Cc1cnsc1)C1CC(F)(F)C1 ZINC001232225269 977949362 /nfs/dbraw/zinc/94/93/62/977949362.db2.gz ZJQYIKQZUMGHAB-UHFFFAOYSA-N 1 2 218.272 2.373 20 0 BEADLO C[N@@H+](Cc1cnsc1)C1CC(F)(F)C1 ZINC001232225269 977949370 /nfs/dbraw/zinc/94/93/70/977949370.db2.gz ZJQYIKQZUMGHAB-UHFFFAOYSA-N 1 2 218.272 2.373 20 0 BEADLO COc1cc[nH+]cc1Nc1cncc(N(C)C)c1 ZINC001176119650 977951266 /nfs/dbraw/zinc/95/12/66/977951266.db2.gz XVXLATXKOCSJPE-UHFFFAOYSA-N 1 2 244.298 2.295 20 0 BEADLO COc1cc[nH+]cc1Nc1ccnn1CC1CC1 ZINC001176118706 977952792 /nfs/dbraw/zinc/95/27/92/977952792.db2.gz PHLYMQYPBICBSJ-UHFFFAOYSA-N 1 2 244.298 2.440 20 0 BEADLO COc1cc[nH+]cc1Nc1cn(CC2CC2)cn1 ZINC001176118586 977953584 /nfs/dbraw/zinc/95/35/84/977953584.db2.gz JKCLZJBHNJGZOC-UHFFFAOYSA-N 1 2 244.298 2.440 20 0 BEADLO COc1cc[nH+]cc1Nc1cc([C@@H](C)O)ccn1 ZINC001176121959 977955457 /nfs/dbraw/zinc/95/54/57/977955457.db2.gz VGSYNRAFCXDHCU-SECBINFHSA-N 1 2 245.282 2.282 20 0 BEADLO Cc1cccc(Nc2ccc(=O)[nH]c2)[nH+]1 ZINC001176123699 977955785 /nfs/dbraw/zinc/95/57/85/977955785.db2.gz FELKYMPDSXVOGO-UHFFFAOYSA-N 1 2 201.229 2.234 20 0 BEADLO COc1cc[nH+]cc1-n1cc2cccc(N)c2n1 ZINC001176121591 977958194 /nfs/dbraw/zinc/95/81/94/977958194.db2.gz ZBMLIMNNWFWCOE-UHFFFAOYSA-N 1 2 240.266 2.011 20 0 BEADLO O=c1ccc(Nc2cccn3cc[nH+]c23)c[nH]1 ZINC001176126338 977961107 /nfs/dbraw/zinc/96/11/07/977961107.db2.gz IACDKYRRVHIMSL-UHFFFAOYSA-N 1 2 226.239 2.179 20 0 BEADLO CSc1ccc(C[NH+]2CCSCC2)cn1 ZINC001232327850 978004379 /nfs/dbraw/zinc/00/43/79/978004379.db2.gz UYJPILGOSWDOTI-UHFFFAOYSA-N 1 2 240.397 2.352 20 0 BEADLO COc1ccc(C[N@@H+]2CCC[C@@H](F)C2)c(C)n1 ZINC001232332948 978010864 /nfs/dbraw/zinc/01/08/64/978010864.db2.gz LTBHOQXFKHFNER-GFCCVEGCSA-N 1 2 238.306 2.333 20 0 BEADLO COc1ccc(C[N@H+]2CCC[C@@H](F)C2)c(C)n1 ZINC001232332948 978010872 /nfs/dbraw/zinc/01/08/72/978010872.db2.gz LTBHOQXFKHFNER-GFCCVEGCSA-N 1 2 238.306 2.333 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2ccno2)c(C)n1 ZINC001232337310 978012842 /nfs/dbraw/zinc/01/28/42/978012842.db2.gz JAYDEXAMGZLWLH-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2ccno2)c(C)n1 ZINC001232337310 978012852 /nfs/dbraw/zinc/01/28/52/978012852.db2.gz JAYDEXAMGZLWLH-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO OC1CC[NH+](Cc2ccc(C(F)(F)F)o2)CC1 ZINC001232443067 978077032 /nfs/dbraw/zinc/07/70/32/978077032.db2.gz LSZDBHOEPAGRFX-UHFFFAOYSA-N 1 2 249.232 2.255 20 0 BEADLO CCc1ccc(N(C)Cc2ncc[nH]2)[nH+]c1 ZINC001337042900 978139029 /nfs/dbraw/zinc/13/90/29/978139029.db2.gz SMONEEHZXFPXIT-UHFFFAOYSA-N 1 2 216.288 2.004 20 0 BEADLO CC(C)CCN(C(=O)[C@@H](C)n1cc[nH+]c1)C1CC1 ZINC000066942590 978145367 /nfs/dbraw/zinc/14/53/67/978145367.db2.gz UUNGVLGAINFTMM-GFCCVEGCSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1ccc(Nc2cnc3nonc3c2)c(C)[nH+]1 ZINC001176687406 978150478 /nfs/dbraw/zinc/15/04/78/978150478.db2.gz AKSRTIFHTCFFNW-UHFFFAOYSA-N 1 2 241.254 2.373 20 0 BEADLO CCOC(=O)[C@H](C)CNc1ccc(CC)c[nH+]1 ZINC001337066766 978151082 /nfs/dbraw/zinc/15/10/82/978151082.db2.gz KYYFZSHYOCKKMS-SNVBAGLBSA-N 1 2 236.315 2.255 20 0 BEADLO CC(=O)C1CC[NH+](Cc2cc(F)ccn2)CC1 ZINC001232496203 978151764 /nfs/dbraw/zinc/15/17/64/978151764.db2.gz PXLWOVINPKJIEU-UHFFFAOYSA-N 1 2 236.290 2.022 20 0 BEADLO c1c[nH+]c(N2CCCC2)c(Nc2ccnnc2)c1 ZINC001176750891 978169199 /nfs/dbraw/zinc/16/91/99/978169199.db2.gz ZCSPIDNCGWOLQA-UHFFFAOYSA-N 1 2 241.298 2.215 20 0 BEADLO c1c[nH+]c(N2CCCC2)c(Nc2cnccn2)c1 ZINC001176744250 978170240 /nfs/dbraw/zinc/17/02/40/978170240.db2.gz RNLPCUJASBPDIP-UHFFFAOYSA-N 1 2 241.298 2.215 20 0 BEADLO Nc1cccn1-c1ccc[nH+]c1N1CCCC1 ZINC001176749934 978171309 /nfs/dbraw/zinc/17/13/09/978171309.db2.gz NZRODNGCYMHPTL-UHFFFAOYSA-N 1 2 228.299 2.055 20 0 BEADLO CC1(C)COCC[N@@H+]1Cc1cc2ccoc2cn1 ZINC001232553495 978176673 /nfs/dbraw/zinc/17/66/73/978176673.db2.gz WDCLRZZDTOWOFQ-UHFFFAOYSA-N 1 2 246.310 2.439 20 0 BEADLO CC1(C)COCC[N@H+]1Cc1cc2ccoc2cn1 ZINC001232553495 978176680 /nfs/dbraw/zinc/17/66/80/978176680.db2.gz WDCLRZZDTOWOFQ-UHFFFAOYSA-N 1 2 246.310 2.439 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1cc2ccoc2cn1 ZINC001232553655 978178395 /nfs/dbraw/zinc/17/83/95/978178395.db2.gz BFAVUPOULUBNRK-CYBMUJFWSA-N 1 2 246.310 2.439 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1cc2ccoc2cn1 ZINC001232553655 978178401 /nfs/dbraw/zinc/17/84/01/978178401.db2.gz BFAVUPOULUBNRK-CYBMUJFWSA-N 1 2 246.310 2.439 20 0 BEADLO C[N@H+](CCF)Cc1cc2ccoc2cn1 ZINC001232554683 978181324 /nfs/dbraw/zinc/18/13/24/978181324.db2.gz HPBCXCUBSPVZLX-UHFFFAOYSA-N 1 2 208.236 2.229 20 0 BEADLO C[N@@H+](CCF)Cc1cc2ccoc2cn1 ZINC001232554683 978181332 /nfs/dbraw/zinc/18/13/32/978181332.db2.gz HPBCXCUBSPVZLX-UHFFFAOYSA-N 1 2 208.236 2.229 20 0 BEADLO C[N@H+](Cc1cc2ccoc2cn1)C1(C)COC1 ZINC001232553813 978182530 /nfs/dbraw/zinc/18/25/30/978182530.db2.gz GFGYCCRZFKVYFN-UHFFFAOYSA-N 1 2 232.283 2.049 20 0 BEADLO C[N@@H+](Cc1cc2ccoc2cn1)C1(C)COC1 ZINC001232553813 978182542 /nfs/dbraw/zinc/18/25/42/978182542.db2.gz GFGYCCRZFKVYFN-UHFFFAOYSA-N 1 2 232.283 2.049 20 0 BEADLO CCOc1ccnc(C[N@@H+]2C[C@H](F)C[C@H]2C)c1 ZINC001232579281 978186823 /nfs/dbraw/zinc/18/68/23/978186823.db2.gz MCNVTLNLJKRNIX-GHMZBOCLSA-N 1 2 238.306 2.413 20 0 BEADLO CCOc1ccnc(C[N@H+]2C[C@H](F)C[C@H]2C)c1 ZINC001232579281 978186825 /nfs/dbraw/zinc/18/68/25/978186825.db2.gz MCNVTLNLJKRNIX-GHMZBOCLSA-N 1 2 238.306 2.413 20 0 BEADLO CCN(Cc1c(C)cccc1OC)C1C[NH+](C)C1 ZINC001232622764 978199622 /nfs/dbraw/zinc/19/96/22/978199622.db2.gz ABEWZKPSVOKJOE-UHFFFAOYSA-N 1 2 248.370 2.140 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1cscc1C ZINC001596689765 978247882 /nfs/dbraw/zinc/24/78/82/978247882.db2.gz PPBMOTSOHDXKLQ-JTQLQIEISA-N 1 2 224.329 2.089 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1cscc1C ZINC001596689765 978247894 /nfs/dbraw/zinc/24/78/94/978247894.db2.gz PPBMOTSOHDXKLQ-JTQLQIEISA-N 1 2 224.329 2.089 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1cc(C)c(F)cc1F ZINC001232785053 978279594 /nfs/dbraw/zinc/27/95/94/978279594.db2.gz UAGQZQUMQQCAHR-NSHDSACASA-N 1 2 241.281 2.494 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1cc(C)c(F)cc1F ZINC001232785053 978279609 /nfs/dbraw/zinc/27/96/09/978279609.db2.gz UAGQZQUMQQCAHR-NSHDSACASA-N 1 2 241.281 2.494 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC[C@@H]1CCC[C@@H](C)C1 ZINC001597575093 978339824 /nfs/dbraw/zinc/33/98/24/978339824.db2.gz QBARJWPQZUCEAN-ZYHUDNBSSA-N 1 2 249.358 2.203 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H](C)c1ccco1 ZINC001337510860 978381598 /nfs/dbraw/zinc/38/15/98/978381598.db2.gz XBGOIWTUWNMHTH-NSHDSACASA-N 1 2 244.294 2.456 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)CC[C@H]1CCCO1 ZINC001337509829 978382143 /nfs/dbraw/zinc/38/21/43/978382143.db2.gz MRJRADCQKJZUCU-GFCCVEGCSA-N 1 2 248.326 2.018 20 0 BEADLO Cc1cc(C)c(C[N@H+](C)Cc2ccno2)cn1 ZINC001233010757 978405563 /nfs/dbraw/zinc/40/55/63/978405563.db2.gz ARJQZUZJBOLGAR-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cc(C)c(C[N@@H+](C)Cc2ccno2)cn1 ZINC001233010757 978405575 /nfs/dbraw/zinc/40/55/75/978405575.db2.gz ARJQZUZJBOLGAR-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CCOC(=O)c1ccsc1C[NH+]1CCC1 ZINC001233017673 978414844 /nfs/dbraw/zinc/41/48/44/978414844.db2.gz JMQQNWDADDCIFE-UHFFFAOYSA-N 1 2 225.313 2.131 20 0 BEADLO C[N@@H+](Cc1cc(Cl)ncc1O)CC1CC1 ZINC001233033921 978417562 /nfs/dbraw/zinc/41/75/62/978417562.db2.gz XUPLXEJYABUOBY-UHFFFAOYSA-N 1 2 226.707 2.282 20 0 BEADLO C[N@H+](Cc1cc(Cl)ncc1O)CC1CC1 ZINC001233033921 978417572 /nfs/dbraw/zinc/41/75/72/978417572.db2.gz XUPLXEJYABUOBY-UHFFFAOYSA-N 1 2 226.707 2.282 20 0 BEADLO Oc1cnc(Cl)cc1C[NH+]1CC2CC(C2)C1 ZINC001233037947 978421150 /nfs/dbraw/zinc/42/11/50/978421150.db2.gz KZTKBXDTPLIGGS-UHFFFAOYSA-N 1 2 238.718 2.282 20 0 BEADLO C[C@@H]1C[C@@H](O)CC[N@@H+]1Cc1scnc1Cl ZINC000721941848 978431333 /nfs/dbraw/zinc/43/13/33/978431333.db2.gz JENKJWFKBHZJKK-SFYZADRCSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H]1C[C@@H](O)CC[N@H+]1Cc1scnc1Cl ZINC000721941848 978431345 /nfs/dbraw/zinc/43/13/45/978431345.db2.gz JENKJWFKBHZJKK-SFYZADRCSA-N 1 2 246.763 2.142 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC3(CC3)C2)cnc1C ZINC001233162450 978480116 /nfs/dbraw/zinc/48/01/16/978480116.db2.gz HBKOKJBKZGSGEF-UHFFFAOYSA-N 1 2 232.327 2.063 20 0 BEADLO Cc1cc(C[N@H+]2CCOC3(CC3)C2)cnc1C ZINC001233162450 978480124 /nfs/dbraw/zinc/48/01/24/978480124.db2.gz HBKOKJBKZGSGEF-UHFFFAOYSA-N 1 2 232.327 2.063 20 0 BEADLO CC(C)(CNC(=O)CCc1[nH]cc[nH+]1)CC1CC1 ZINC001178000468 978487122 /nfs/dbraw/zinc/48/71/22/978487122.db2.gz PJOOYJGBYJQINB-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO Cc1ccc(C[N@@H+]2CCOC3(CC3)C2)cc1O ZINC001233235546 978506033 /nfs/dbraw/zinc/50/60/33/978506033.db2.gz XRUGYPWHQJGZRH-UHFFFAOYSA-N 1 2 233.311 2.065 20 0 BEADLO Cc1ccc(C[N@H+]2CCOC3(CC3)C2)cc1O ZINC001233235546 978506040 /nfs/dbraw/zinc/50/60/40/978506040.db2.gz XRUGYPWHQJGZRH-UHFFFAOYSA-N 1 2 233.311 2.065 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H](F)C[C@H]2C)sn1 ZINC001233309996 978535920 /nfs/dbraw/zinc/53/59/20/978535920.db2.gz MADKHZIMHRHDKS-RKDXNWHRSA-N 1 2 214.309 2.384 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H](F)C[C@H]2C)sn1 ZINC001233309996 978535929 /nfs/dbraw/zinc/53/59/29/978535929.db2.gz MADKHZIMHRHDKS-RKDXNWHRSA-N 1 2 214.309 2.384 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3ccncc3C2)sn1 ZINC001233312425 978541770 /nfs/dbraw/zinc/54/17/70/978541770.db2.gz RHBJSDWFXPIESJ-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cc(C[N@H+]2CCc3ccncc3C2)sn1 ZINC001233312425 978541773 /nfs/dbraw/zinc/54/17/73/978541773.db2.gz RHBJSDWFXPIESJ-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO CC[C@H](C)c1ccc[nH+]c1N1CCOCC1 ZINC001249864310 978544202 /nfs/dbraw/zinc/54/42/02/978544202.db2.gz ANWSOKBORCGQDQ-NSHDSACASA-N 1 2 220.316 2.432 20 0 BEADLO Cc1cnsc1C[N@@H+]1CCc2cccnc2C1 ZINC001233321866 978560036 /nfs/dbraw/zinc/56/00/36/978560036.db2.gz HOOQIYAQTJRZKK-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cnsc1C[N@H+]1CCc2cccnc2C1 ZINC001233321866 978560047 /nfs/dbraw/zinc/56/00/47/978560047.db2.gz HOOQIYAQTJRZKK-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cc(F)cc(N2C[C@H]3[C@@H](C2)C3(F)F)[nH+]1 ZINC001337917062 978561271 /nfs/dbraw/zinc/56/12/71/978561271.db2.gz PUDHJZDVCQZKTI-DTORHVGOSA-N 1 2 228.217 2.230 20 0 BEADLO CC[C@@]12C[C@@H](CO1)[N@H+](Cc1sncc1C)C2 ZINC001233322099 978563083 /nfs/dbraw/zinc/56/30/83/978563083.db2.gz RPRPBXUCVDVEMT-JQWIXIFHSA-N 1 2 238.356 2.205 20 0 BEADLO CC[C@@]12C[C@@H](CO1)[N@@H+](Cc1sncc1C)C2 ZINC001233322099 978563086 /nfs/dbraw/zinc/56/30/86/978563086.db2.gz RPRPBXUCVDVEMT-JQWIXIFHSA-N 1 2 238.356 2.205 20 0 BEADLO COc1cc(F)c(C[NH+]2CC(C)C2)cc1F ZINC001233340952 978566485 /nfs/dbraw/zinc/56/64/85/978566485.db2.gz XRLZXQPANKCAMX-UHFFFAOYSA-N 1 2 227.254 2.425 20 0 BEADLO COC1C[NH+](Cc2cc3cccnc3s2)C1 ZINC001233345162 978567590 /nfs/dbraw/zinc/56/75/90/978567590.db2.gz IWUYPPOSWSTAMP-UHFFFAOYSA-N 1 2 234.324 2.127 20 0 BEADLO FC1(C2CC2)CN(Cc2cccc3[nH+]ccn32)C1 ZINC001233360766 978571562 /nfs/dbraw/zinc/57/15/62/978571562.db2.gz CULJBELUKXTYLV-UHFFFAOYSA-N 1 2 245.301 2.268 20 0 BEADLO Cc1ncc(C[N@@H+]2CCC(=O)[C@@H]3CCCC[C@@H]32)o1 ZINC001233364810 978571848 /nfs/dbraw/zinc/57/18/48/978571848.db2.gz DVTZIOOGYYZOCB-OLZOCXBDSA-N 1 2 248.326 2.317 20 0 BEADLO Cc1ncc(C[N@H+]2CCC(=O)[C@@H]3CCCC[C@@H]32)o1 ZINC001233364810 978571856 /nfs/dbraw/zinc/57/18/56/978571856.db2.gz DVTZIOOGYYZOCB-OLZOCXBDSA-N 1 2 248.326 2.317 20 0 BEADLO CNc1cc(N[C@@H](C)c2ncccc2C)nc[nH+]1 ZINC001338155526 978621485 /nfs/dbraw/zinc/62/14/85/978621485.db2.gz OYAUPHCDVQZGDW-JTQLQIEISA-N 1 2 243.314 2.395 20 0 BEADLO CNc1cc(N[C@@H](C)c2ncccc2C)[nH+]cn1 ZINC001338155526 978621491 /nfs/dbraw/zinc/62/14/91/978621491.db2.gz OYAUPHCDVQZGDW-JTQLQIEISA-N 1 2 243.314 2.395 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)CCc1ccco1 ZINC001338241064 978639155 /nfs/dbraw/zinc/63/91/55/978639155.db2.gz GPSQOYAXQOTNQY-UHFFFAOYSA-N 1 2 244.294 2.285 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H]1C[C@H]1C(C)C ZINC001338244292 978641762 /nfs/dbraw/zinc/64/17/62/978641762.db2.gz UXBOUFIBRWKKHH-NWDGAFQWSA-N 1 2 232.327 2.351 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H]1C[C@@H]1C(C)C ZINC001338244289 978644075 /nfs/dbraw/zinc/64/40/75/978644075.db2.gz UXBOUFIBRWKKHH-NEPJUHHUSA-N 1 2 232.327 2.351 20 0 BEADLO COc1ccccc1CNc1cc(CO)cc[nH+]1 ZINC001178992015 978659606 /nfs/dbraw/zinc/65/96/06/978659606.db2.gz JDCMNNSDAUEQAR-UHFFFAOYSA-N 1 2 244.294 2.195 20 0 BEADLO CC[NH+]1CC(Oc2cccc3onc(C)c32)C1 ZINC001233664890 978664865 /nfs/dbraw/zinc/66/48/65/978664865.db2.gz QZLZDRUWTSXSIF-UHFFFAOYSA-N 1 2 232.283 2.219 20 0 BEADLO C[N@@H+]1CCO[C@@H](COc2ccc3occc3c2)C1 ZINC001233676521 978669059 /nfs/dbraw/zinc/66/90/59/978669059.db2.gz HPSIRNFPFUKSEE-CYBMUJFWSA-N 1 2 247.294 2.142 20 0 BEADLO C[N@H+]1CCO[C@@H](COc2ccc3occc3c2)C1 ZINC001233676521 978669064 /nfs/dbraw/zinc/66/90/64/978669064.db2.gz HPSIRNFPFUKSEE-CYBMUJFWSA-N 1 2 247.294 2.142 20 0 BEADLO C[NH+]1CC(Oc2ccc(-c3ncco3)cc2)C1 ZINC001233734467 978681252 /nfs/dbraw/zinc/68/12/52/978681252.db2.gz LVQDZGLGAWZVPI-UHFFFAOYSA-N 1 2 230.267 2.034 20 0 BEADLO CC[N@@H+]1CC[C@@H](Oc2cc3[nH]ncc3c(C)c2)C1 ZINC001233740806 978685095 /nfs/dbraw/zinc/68/50/95/978685095.db2.gz WSHCBHLMSUGJOR-LLVKDONJSA-N 1 2 245.326 2.344 20 0 BEADLO CC[N@H+]1CC[C@@H](Oc2cc3[nH]ncc3c(C)c2)C1 ZINC001233740806 978685105 /nfs/dbraw/zinc/68/51/05/978685105.db2.gz WSHCBHLMSUGJOR-LLVKDONJSA-N 1 2 245.326 2.344 20 0 BEADLO Cc1c[nH]c(CCNC(=O)C2C(C)(C)C2(C)C)[nH+]1 ZINC001179696500 978741041 /nfs/dbraw/zinc/74/10/41/978741041.db2.gz ALWPYHGCALDMRW-UHFFFAOYSA-N 1 2 249.358 2.059 20 0 BEADLO Cl/C=C\C[NH2+]Cc1cn(-c2ccccc2)nn1 ZINC001179747278 978749582 /nfs/dbraw/zinc/74/95/82/978749582.db2.gz IVJYJAHWBWVWRM-DAXSKMNVSA-N 1 2 248.717 2.109 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)Nc1c(C)c[nH+]cc1C ZINC001338991435 978768319 /nfs/dbraw/zinc/76/83/19/978768319.db2.gz GJIRBLAYOSYAFH-GHMZBOCLSA-N 1 2 218.300 2.105 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H](F)C(C)C ZINC001339101914 978792954 /nfs/dbraw/zinc/79/29/54/978792954.db2.gz FAHBWTUAOKKIRY-JTQLQIEISA-N 1 2 224.279 2.053 20 0 BEADLO CC(C)[C@@H]1CCCCN1C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001339187445 978814454 /nfs/dbraw/zinc/81/44/54/978814454.db2.gz DYWPFKBMEZMAAR-OLZOCXBDSA-N 1 2 249.358 2.481 20 0 BEADLO CCCn1cncc1C[N@H+](C)Cc1cccn1C ZINC001180147439 978834445 /nfs/dbraw/zinc/83/44/45/978834445.db2.gz HVZWYSQOYOTPDF-UHFFFAOYSA-N 1 2 246.358 2.264 20 0 BEADLO CCCn1cncc1C[N@@H+](C)Cc1cccn1C ZINC001180147439 978834449 /nfs/dbraw/zinc/83/44/49/978834449.db2.gz HVZWYSQOYOTPDF-UHFFFAOYSA-N 1 2 246.358 2.264 20 0 BEADLO CC[NH+]1CC(Oc2ccc(NC(C)=O)cc2C)C1 ZINC001234601334 978868571 /nfs/dbraw/zinc/86/85/71/978868571.db2.gz NHXRQLNMOOIFKH-UHFFFAOYSA-N 1 2 248.326 2.036 20 0 BEADLO CCC[C@H]1CCCN(C(=O)[C@@H](C)n2cc[nH+]c2)C1 ZINC001340272579 979000985 /nfs/dbraw/zinc/00/09/85/979000985.db2.gz FUEMCKLLCSIVJA-OLZOCXBDSA-N 1 2 249.358 2.483 20 0 BEADLO CCc1cccc(C[N@H+](C)Cc2cnn(C)c2)n1 ZINC001235248811 979005852 /nfs/dbraw/zinc/00/58/52/979005852.db2.gz FVVVRXKYHXXNGA-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO CCc1cccc(C[N@@H+](C)Cc2cnn(C)c2)n1 ZINC001235248811 979005857 /nfs/dbraw/zinc/00/58/57/979005857.db2.gz FVVVRXKYHXXNGA-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO CCc1cccc(C[N@H+](C)Cc2cnccn2)n1 ZINC001235260651 979013731 /nfs/dbraw/zinc/01/37/31/979013731.db2.gz MLYXDKAHBXDMQG-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO CCc1cccc(C[N@@H+](C)Cc2cnccn2)n1 ZINC001235260651 979013736 /nfs/dbraw/zinc/01/37/36/979013736.db2.gz MLYXDKAHBXDMQG-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO CCc1cccc(C[N@@H+]2CCCC(=O)CC2)n1 ZINC001235261293 979014625 /nfs/dbraw/zinc/01/46/25/979014625.db2.gz XJIMXJAYZRNDOE-UHFFFAOYSA-N 1 2 232.327 2.199 20 0 BEADLO CCc1cccc(C[N@H+]2CCCC(=O)CC2)n1 ZINC001235261293 979014631 /nfs/dbraw/zinc/01/46/31/979014631.db2.gz XJIMXJAYZRNDOE-UHFFFAOYSA-N 1 2 232.327 2.199 20 0 BEADLO Cc1cnc(F)c(C[N@H+]2[C@@H]3CC[C@H]2CC(=O)C3)c1 ZINC001235329205 979024437 /nfs/dbraw/zinc/02/44/37/979024437.db2.gz QHBJSWTZWDTRCN-TXEJJXNPSA-N 1 2 248.301 2.225 20 0 BEADLO Cc1cnc(F)c(C[N@@H+]2[C@@H]3CC[C@H]2CC(=O)C3)c1 ZINC001235329205 979024439 /nfs/dbraw/zinc/02/44/39/979024439.db2.gz QHBJSWTZWDTRCN-TXEJJXNPSA-N 1 2 248.301 2.225 20 0 BEADLO CC[C@H](C)C[C@@H](C)NC(=O)Cc1cc[nH+]c(N)c1 ZINC001181265714 979029326 /nfs/dbraw/zinc/02/93/26/979029326.db2.gz RQPLUXJFEZDHMS-WDEREUQCSA-N 1 2 249.358 2.147 20 0 BEADLO Cc1cnc(F)c(C[N@@H+]2CCC[C@@H]2CF)c1 ZINC001235342801 979031565 /nfs/dbraw/zinc/03/15/65/979031565.db2.gz KYASIYVAVAYGHL-LLVKDONJSA-N 1 2 226.270 2.463 20 0 BEADLO Cc1cnc(F)c(C[N@H+]2CCC[C@@H]2CF)c1 ZINC001235342801 979031568 /nfs/dbraw/zinc/03/15/68/979031568.db2.gz KYASIYVAVAYGHL-LLVKDONJSA-N 1 2 226.270 2.463 20 0 BEADLO CCOc1cc(O)cc(C[N@@H+]2CC[C@H](F)C2)c1 ZINC001235394679 979036202 /nfs/dbraw/zinc/03/62/02/979036202.db2.gz VFNMXJNZYXYHQG-NSHDSACASA-N 1 2 239.290 2.335 20 0 BEADLO CCOc1cc(O)cc(C[N@H+]2CC[C@H](F)C2)c1 ZINC001235394679 979036206 /nfs/dbraw/zinc/03/62/06/979036206.db2.gz VFNMXJNZYXYHQG-NSHDSACASA-N 1 2 239.290 2.335 20 0 BEADLO Cc1[nH+]cn(C)c1CN1CC[C@@H](C)C(F)(F)C1 ZINC001235535812 979071080 /nfs/dbraw/zinc/07/10/80/979071080.db2.gz AMHZTHKBYSUKFX-SECBINFHSA-N 1 2 243.301 2.206 20 0 BEADLO Cc1ncn(C)c1C[N@H+](C)Cc1ccccc1F ZINC001235543542 979086208 /nfs/dbraw/zinc/08/62/08/979086208.db2.gz NTDHLSIOQWMTFR-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1ncn(C)c1C[N@@H+](C)Cc1ccccc1F ZINC001235543542 979086219 /nfs/dbraw/zinc/08/62/19/979086219.db2.gz NTDHLSIOQWMTFR-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO CC(C)[C@H](C)C(=O)Nc1cc[nH+]c2c1CCC2 ZINC001181471886 979115712 /nfs/dbraw/zinc/11/57/12/979115712.db2.gz RVEQKHJRQBGBGY-JTQLQIEISA-N 1 2 232.327 2.223 20 0 BEADLO CC1C[NH+](Cc2nc3cc(F)ccc3[nH]2)C1 ZINC001235682486 979116026 /nfs/dbraw/zinc/11/60/26/979116026.db2.gz KKFAIPNARCLXGA-UHFFFAOYSA-N 1 2 219.263 2.154 20 0 BEADLO C[C@@H]1C[C@H]1C[N@@H+]1CCNC[C@@H]1c1ccc(F)cc1 ZINC001236126934 979404372 /nfs/dbraw/zinc/40/43/72/979404372.db2.gz FNNQDQDNGWVUCT-OSAQELSMSA-N 1 2 248.345 2.428 20 0 BEADLO C[C@@H]1C[C@H]1C[N@H+]1CCNC[C@@H]1c1ccc(F)cc1 ZINC001236126934 979404385 /nfs/dbraw/zinc/40/43/85/979404385.db2.gz FNNQDQDNGWVUCT-OSAQELSMSA-N 1 2 248.345 2.428 20 0 BEADLO c1cc(C2CC2)ccc1OCC[NH+]1CCOCC1 ZINC001250032482 979420008 /nfs/dbraw/zinc/42/00/08/979420008.db2.gz NKBMMPMGNSEXGZ-UHFFFAOYSA-N 1 2 247.338 2.275 20 0 BEADLO Nc1ccc(-c2ccc3nsnc3c2)c[nH+]1 ZINC001236313101 979520861 /nfs/dbraw/zinc/52/08/61/979520861.db2.gz IPFBNOXSQMKVAL-UHFFFAOYSA-N 1 2 228.280 2.336 20 0 BEADLO Nc1ccc(-c2ccc3oncc3c2)c[nH+]1 ZINC001236313329 979521345 /nfs/dbraw/zinc/52/13/45/979521345.db2.gz OHOUBXLKAQENCM-UHFFFAOYSA-N 1 2 211.224 2.472 20 0 BEADLO COC(=[NH2+])c1cccc(-c2ccc(N)nc2)c1 ZINC001236315088 979523829 /nfs/dbraw/zinc/52/38/29/979523829.db2.gz HACVUKSBZSQUJS-UHFFFAOYSA-N 1 2 227.267 2.303 20 0 BEADLO Nc1ccc(-c2ccc3c(c2)COCC3)c[nH+]1 ZINC001236314566 979524892 /nfs/dbraw/zinc/52/48/92/979524892.db2.gz BUIFYTUTEBUBEE-UHFFFAOYSA-N 1 2 226.279 2.404 20 0 BEADLO Nc1ccc(-c2cccc3c2COC3)c[nH+]1 ZINC001236316591 979528880 /nfs/dbraw/zinc/52/88/80/979528880.db2.gz OBECKHDRPLMVHY-UHFFFAOYSA-N 1 2 212.252 2.361 20 0 BEADLO Nc1ccc(-c2ccc3ccnnc3c2)c[nH+]1 ZINC001236318683 979532640 /nfs/dbraw/zinc/53/26/40/979532640.db2.gz ZXIYWWOXNBVXNQ-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO Cc1cn2cc(-c3cncc(O)c3)ccc2[nH+]1 ZINC001236580161 979654932 /nfs/dbraw/zinc/65/49/32/979654932.db2.gz IBIPTLLKDDOYIM-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO FC[C@H]1CCC[N@H+](Cc2nccnc2Cl)C1 ZINC001236616339 979682243 /nfs/dbraw/zinc/68/22/43/979682243.db2.gz ZJQMOAYWCBYVGD-SECBINFHSA-N 1 2 243.713 2.312 20 0 BEADLO FC[C@H]1CCC[N@@H+](Cc2nccnc2Cl)C1 ZINC001236616339 979682248 /nfs/dbraw/zinc/68/22/48/979682248.db2.gz ZJQMOAYWCBYVGD-SECBINFHSA-N 1 2 243.713 2.312 20 0 BEADLO CC(=O)OC1C[NH+](Cc2cccc3ccoc32)C1 ZINC001236739356 979716032 /nfs/dbraw/zinc/71/60/32/979716032.db2.gz YOXCQRWNDOVBNS-UHFFFAOYSA-N 1 2 245.278 2.180 20 0 BEADLO CC(C)(C)Oc1cccc(C[NH+]2CC(O)C2)c1 ZINC001237098079 979813531 /nfs/dbraw/zinc/81/35/31/979813531.db2.gz GPUPIRXGYLQYSA-UHFFFAOYSA-N 1 2 235.327 2.040 20 0 BEADLO Nc1cccc(C[N@@H+]2Cc3ccncc3C2)c1 ZINC001237221261 979852226 /nfs/dbraw/zinc/85/22/26/979852226.db2.gz JYUCNFZQCFEANS-UHFFFAOYSA-N 1 2 225.295 2.180 20 0 BEADLO Nc1cccc(C[N@H+]2Cc3ccncc3C2)c1 ZINC001237221261 979852230 /nfs/dbraw/zinc/85/22/30/979852230.db2.gz JYUCNFZQCFEANS-UHFFFAOYSA-N 1 2 225.295 2.180 20 0 BEADLO Oc1cc(F)cc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)c1 ZINC001237278436 979859707 /nfs/dbraw/zinc/85/97/07/979859707.db2.gz XXSORCRNLFPFRK-XDTLVQLUSA-N 1 2 239.265 2.321 20 0 BEADLO Oc1cc(F)cc(C[N@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)c1 ZINC001237278436 979859711 /nfs/dbraw/zinc/85/97/11/979859711.db2.gz XXSORCRNLFPFRK-XDTLVQLUSA-N 1 2 239.265 2.321 20 0 BEADLO CCc1cc(N2CCCOC[C@H]2C)nc(CC)[nH+]1 ZINC001342948126 979954670 /nfs/dbraw/zinc/95/46/70/979954670.db2.gz UKOZZEDYGQRERD-LLVKDONJSA-N 1 2 249.358 2.217 20 0 BEADLO Cc1coc(C[NH+]2CC3(C2)CCCC3)n1 ZINC001237639646 979988899 /nfs/dbraw/zinc/98/88/99/979988899.db2.gz TYPXPSQTMQIBFY-UHFFFAOYSA-N 1 2 206.289 2.359 20 0 BEADLO c1ccc(OC2C[NH+](C[C@H]3CCC=CO3)C2)cc1 ZINC001184429612 980086108 /nfs/dbraw/zinc/08/61/08/980086108.db2.gz YRNYZDQBRCAPHZ-CQSZACIVSA-N 1 2 245.322 2.442 20 0 BEADLO COc1ccoc1C[N@@H+]1CCC[C@@H]1CF ZINC001237870351 980104638 /nfs/dbraw/zinc/10/46/38/980104638.db2.gz BYSPGNZIHLPMCD-SECBINFHSA-N 1 2 213.252 2.222 20 0 BEADLO COc1ccoc1C[N@H+]1CCC[C@@H]1CF ZINC001237870351 980104642 /nfs/dbraw/zinc/10/46/42/980104642.db2.gz BYSPGNZIHLPMCD-SECBINFHSA-N 1 2 213.252 2.222 20 0 BEADLO Cn1c[nH+]cc1COC(=O)C[C@H]1CC=CCC1 ZINC001343466854 980117047 /nfs/dbraw/zinc/11/70/47/980117047.db2.gz CADIGAZWGYOQBX-NSHDSACASA-N 1 2 234.299 2.210 20 0 BEADLO COCC[N@H+](C)Cc1cncc(Cl)c1Cl ZINC001238009767 980126719 /nfs/dbraw/zinc/12/67/19/980126719.db2.gz ZBKZTUMXZIFJGC-UHFFFAOYSA-N 1 2 249.141 2.467 20 0 BEADLO COCC[N@@H+](C)Cc1cncc(Cl)c1Cl ZINC001238009767 980126725 /nfs/dbraw/zinc/12/67/25/980126725.db2.gz ZBKZTUMXZIFJGC-UHFFFAOYSA-N 1 2 249.141 2.467 20 0 BEADLO OCc1cc(-c2cc[nH+]c3c2CCN3)cs1 ZINC001205322792 980167119 /nfs/dbraw/zinc/16/71/19/980167119.db2.gz DEBQFYYWOJNHPN-UHFFFAOYSA-N 1 2 232.308 2.270 20 0 BEADLO c1ncc(C2CC2)cc1C[N@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC001238181930 980211476 /nfs/dbraw/zinc/21/14/76/980211476.db2.gz NKAYCBVTTFOVMY-GASCZTMLSA-N 1 2 244.338 2.322 20 0 BEADLO c1ncc(C2CC2)cc1C[N@@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC001238181930 980211486 /nfs/dbraw/zinc/21/14/86/980211486.db2.gz NKAYCBVTTFOVMY-GASCZTMLSA-N 1 2 244.338 2.322 20 0 BEADLO C[N@H+](Cc1cncc(C2CC2)c1)C1(C)COC1 ZINC001238190633 980218148 /nfs/dbraw/zinc/21/81/48/980218148.db2.gz UPDKEKWKKBIXHW-UHFFFAOYSA-N 1 2 232.327 2.180 20 0 BEADLO C[N@@H+](Cc1cncc(C2CC2)c1)C1(C)COC1 ZINC001238190633 980218156 /nfs/dbraw/zinc/21/81/56/980218156.db2.gz UPDKEKWKKBIXHW-UHFFFAOYSA-N 1 2 232.327 2.180 20 0 BEADLO c1ncc(C2CC2)cc1C[N@@H+]1CCCC12COC2 ZINC001238187425 980220488 /nfs/dbraw/zinc/22/04/88/980220488.db2.gz JOPUNOWIVROFLF-UHFFFAOYSA-N 1 2 244.338 2.324 20 0 BEADLO c1ncc(C2CC2)cc1C[N@H+]1CCCC12COC2 ZINC001238187425 980220497 /nfs/dbraw/zinc/22/04/97/980220497.db2.gz JOPUNOWIVROFLF-UHFFFAOYSA-N 1 2 244.338 2.324 20 0 BEADLO Cn1c[nH+]cc1CCCOC(=O)C1CCCC1 ZINC001343725440 980221416 /nfs/dbraw/zinc/22/14/16/980221416.db2.gz NLJSZEZIMZXQSF-UHFFFAOYSA-N 1 2 236.315 2.086 20 0 BEADLO Cn1c[nH+]c2cc(Nc3nccnc3F)ccc21 ZINC001185534909 980249905 /nfs/dbraw/zinc/24/99/05/980249905.db2.gz JWBZMNFHKYMFHR-UHFFFAOYSA-N 1 2 243.245 2.246 20 0 BEADLO Cc1cnc(C[N@@H+]2CCOCC23CC3)c(C)c1 ZINC001238440316 980266308 /nfs/dbraw/zinc/26/63/08/980266308.db2.gz LVNGFFKOHUAESJ-UHFFFAOYSA-N 1 2 232.327 2.063 20 0 BEADLO Cc1cnc(C[N@H+]2CCOCC23CC3)c(C)c1 ZINC001238440316 980266316 /nfs/dbraw/zinc/26/63/16/980266316.db2.gz LVNGFFKOHUAESJ-UHFFFAOYSA-N 1 2 232.327 2.063 20 0 BEADLO CSc1cc(C)cc(C[NH+]2CC(C)(O)C2)c1 ZINC001238676250 980306548 /nfs/dbraw/zinc/30/65/48/980306548.db2.gz UJYLWNFCLYIKTK-UHFFFAOYSA-N 1 2 237.368 2.284 20 0 BEADLO CC(C)[C@H]1N(C(=O)[C@@H](C)n2cc[nH+]c2)CC1(C)C ZINC001343998057 980307771 /nfs/dbraw/zinc/30/77/71/980307771.db2.gz PWXICBKEUQRIPF-VXGBXAGGSA-N 1 2 249.358 2.337 20 0 BEADLO CCOc1ccc(C)c(C[NH+]2CC3(CCO3)C2)c1 ZINC001238709112 980315346 /nfs/dbraw/zinc/31/53/46/980315346.db2.gz TWWSIFMUJOXFKK-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO CCCn1ncnc1C[N@@H+]1CC(C)(C)C1(C)C ZINC001344099721 980349830 /nfs/dbraw/zinc/34/98/30/980349830.db2.gz VIPZCCBWSQWHMT-UHFFFAOYSA-N 1 2 236.363 2.309 20 0 BEADLO CCCn1ncnc1C[N@H+]1CC(C)(C)C1(C)C ZINC001344099721 980349835 /nfs/dbraw/zinc/34/98/35/980349835.db2.gz VIPZCCBWSQWHMT-UHFFFAOYSA-N 1 2 236.363 2.309 20 0 BEADLO Nc1cn2ccc(-c3cnn(C(F)F)c3)cc2[nH+]1 ZINC001238866229 980353796 /nfs/dbraw/zinc/35/37/96/980353796.db2.gz XXTZMYIYHKSWKM-UHFFFAOYSA-N 1 2 249.224 2.175 20 0 BEADLO Cc1cn2c(cccc2NC(=O)NCC2CC2)[nH+]1 ZINC001186575181 980407283 /nfs/dbraw/zinc/40/72/83/980407283.db2.gz LKMLSZMRBLOGKP-UHFFFAOYSA-N 1 2 244.298 2.174 20 0 BEADLO Cc1nnc(-c2ccc(-c3c[nH+]cn3C)cc2)o1 ZINC001239016896 980411531 /nfs/dbraw/zinc/41/15/31/980411531.db2.gz SSELXJLJRPTPMV-UHFFFAOYSA-N 1 2 240.266 2.446 20 0 BEADLO Cc1ccc(-c2[nH+]ncc3c2OCCN3C)cc1 ZINC001239478087 980617359 /nfs/dbraw/zinc/61/73/59/980617359.db2.gz FMDKWNFYNBFIEY-UHFFFAOYSA-N 1 2 241.294 2.281 20 0 BEADLO C[C@H]1CCC[C@H](NC(=O)CCc2[nH+]ccn2C)C1 ZINC001345589033 980637248 /nfs/dbraw/zinc/63/72/48/980637248.db2.gz RQHKFBXPUFTOFY-RYUDHWBXSA-N 1 2 249.358 2.048 20 0 BEADLO CCn1c[nH+]cc1COC(=O)Cc1ccccc1 ZINC001345609725 980646460 /nfs/dbraw/zinc/64/64/60/980646460.db2.gz GUIADPNTARPLEB-UHFFFAOYSA-N 1 2 244.294 2.189 20 0 BEADLO Fc1cc2[nH]ccc2c(CC[NH+]2CCOCC2)c1 ZINC001250278289 980651216 /nfs/dbraw/zinc/65/12/16/980651216.db2.gz ZSDQMGNFVJTIOA-UHFFFAOYSA-N 1 2 248.301 2.182 20 0 BEADLO C[C@H](c1nnc(C[NH+](C)C)o1)C1CCCC1 ZINC001345942230 980714910 /nfs/dbraw/zinc/71/49/10/980714910.db2.gz YTUCJJCQCIVZKY-VIFPVBQESA-N 1 2 223.320 2.425 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@H]1CCC1(C)C ZINC001345995907 980726522 /nfs/dbraw/zinc/72/65/22/980726522.db2.gz KHHIKGYZAIRHKV-LLVKDONJSA-N 1 2 236.315 2.382 20 0 BEADLO COC(=O)c1cc(C)cc(CCn2cc[nH+]c2)c1 ZINC001250319957 980760462 /nfs/dbraw/zinc/76/04/62/980760462.db2.gz WAXGZEDZAARKFX-UHFFFAOYSA-N 1 2 244.294 2.221 20 0 BEADLO Cc1nc(Cl)ccc1CCn1cc[nH+]c1 ZINC001250321089 980762358 /nfs/dbraw/zinc/76/23/58/980762358.db2.gz VVUHHWRHTIJWHS-UHFFFAOYSA-N 1 2 221.691 2.483 20 0 BEADLO Cc1cc(Cc2ccc(N(C)C)[nH+]c2)on1 ZINC001250365668 980866598 /nfs/dbraw/zinc/86/65/98/980866598.db2.gz YPSZXRAUADAAHK-UHFFFAOYSA-N 1 2 217.272 2.035 20 0 BEADLO c1cnc(Cc2ccc(N3CCCC3)[nH+]c2)cn1 ZINC001250372355 980870580 /nfs/dbraw/zinc/87/05/80/980870580.db2.gz MHRWSDGJNXDFIZ-UHFFFAOYSA-N 1 2 240.310 2.063 20 0 BEADLO C[NH+](C)Cc1nnc([C@H]2CCCC2(C)C)o1 ZINC001346662062 980878058 /nfs/dbraw/zinc/87/80/58/980878058.db2.gz JKHANOHBGCSWFH-SECBINFHSA-N 1 2 223.320 2.425 20 0 BEADLO CC/C(C)=C/C(=O)OCc1c[nH+]cn1CC ZINC001346748399 980898390 /nfs/dbraw/zinc/89/83/90/980898390.db2.gz UNWOGUWMHVUNLY-UXBLZVDNSA-N 1 2 222.288 2.303 20 0 BEADLO CC/C(C)=C\C(=O)OCc1c[nH+]cn1CC ZINC001346748398 980898999 /nfs/dbraw/zinc/89/89/99/980898999.db2.gz UNWOGUWMHVUNLY-POHAHGRESA-N 1 2 222.288 2.303 20 0 BEADLO CCc1nc(OC)ccc1-c1ccc[nH+]c1N ZINC001239772257 980909503 /nfs/dbraw/zinc/90/95/03/980909503.db2.gz HFBJLOSNSUTHEZ-UHFFFAOYSA-N 1 2 229.283 2.297 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc2c(c1)CCO2 ZINC001239806011 980945373 /nfs/dbraw/zinc/94/53/73/980945373.db2.gz MTINAOONYGARQV-GBWIQOKOSA-N 1 2 201.269 2.497 20 0 BEADLO CC(C)(C)[C@@H]1CCC[N@H+](Cc2nnc[nH]2)C1 ZINC001347113941 980976063 /nfs/dbraw/zinc/97/60/63/980976063.db2.gz MNWQYLVSJAXSDR-SNVBAGLBSA-N 1 2 222.336 2.063 20 0 BEADLO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2nnc[nH]2)C1 ZINC001347113941 980976067 /nfs/dbraw/zinc/97/60/67/980976067.db2.gz MNWQYLVSJAXSDR-SNVBAGLBSA-N 1 2 222.336 2.063 20 0 BEADLO NC(=O)c1cccc(-c2cccn3cc[nH+]c23)c1 ZINC001239882737 981017410 /nfs/dbraw/zinc/01/74/10/981017410.db2.gz KWQSEFBQMLGNLD-UHFFFAOYSA-N 1 2 237.262 2.100 20 0 BEADLO Cc1nc(NC2CC3(CC3(F)F)C2)cc[nH+]1 ZINC001347272370 981026073 /nfs/dbraw/zinc/02/60/73/981026073.db2.gz XHLVLPWYAKNDGE-UHFFFAOYSA-N 1 2 225.242 2.385 20 0 BEADLO Cc1cccc(Cc2c[nH+]c(C)c(N)c2)n1 ZINC001250424508 981030827 /nfs/dbraw/zinc/03/08/27/981030827.db2.gz MOLACRBPYAZTRW-UHFFFAOYSA-N 1 2 213.284 2.266 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cccc(C(=O)N(C)C)c1 ZINC001239924807 981033144 /nfs/dbraw/zinc/03/31/44/981033144.db2.gz YBNJMZZKBUDSDW-MPEOSAONSA-N 1 2 230.311 2.264 20 0 BEADLO O=C(Nc1ccccc1-n1cc[nH+]c1)NC1CC1 ZINC001191442543 981033680 /nfs/dbraw/zinc/03/36/80/981033680.db2.gz ZCUZRRMUIDSWJB-UHFFFAOYSA-N 1 2 242.282 2.156 20 0 BEADLO Cc1nc([C@H](C)[NH2+][C@H](C)CSCCF)no1 ZINC001347393682 981066361 /nfs/dbraw/zinc/06/63/61/981066361.db2.gz BZZYQGOKVJQKGF-SFYZADRCSA-N 1 2 247.339 2.120 20 0 BEADLO Cn1cc[nH+]c1CCC(=O)NCCCCC1CC1 ZINC001347463044 981086069 /nfs/dbraw/zinc/08/60/69/981086069.db2.gz GZJHOLULSBNUDI-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2cncnc2c1 ZINC001239986492 981087722 /nfs/dbraw/zinc/08/77/22/981087722.db2.gz NMWNOMYCUCEPQM-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO CC(C)C(NC(=O)[C@H](C)n1cc[nH+]c1)C(C)C ZINC001347523018 981104907 /nfs/dbraw/zinc/10/49/07/981104907.db2.gz LBTKLGWAPXUNQO-NSHDSACASA-N 1 2 237.347 2.241 20 0 BEADLO C[C@H](C(=O)N1CC(C)(C)[C@H]1C1CC1)n1cc[nH+]c1 ZINC001347526348 981108319 /nfs/dbraw/zinc/10/83/19/981108319.db2.gz HVJIXYRYRWSLTI-ZYHUDNBSSA-N 1 2 247.342 2.091 20 0 BEADLO COc1ccc(F)c(-c2ccc[nH+]c2N)c1 ZINC001240118523 981115251 /nfs/dbraw/zinc/11/52/51/981115251.db2.gz WWWOOKOWDQDNBI-UHFFFAOYSA-N 1 2 218.231 2.479 20 0 BEADLO CCCn1cc(-c2cc[nH+]c3c2CCN3)cn1 ZINC001240135976 981138626 /nfs/dbraw/zinc/13/86/26/981138626.db2.gz ZEIDJWNFDHGKPJ-UHFFFAOYSA-N 1 2 228.299 2.323 20 0 BEADLO CC(=O)NCc1ccc(/C(C)=C/C=C/[NH3+])cc1 ZINC001240151408 981149714 /nfs/dbraw/zinc/14/97/14/981149714.db2.gz VSDHLCKIINUQRF-FSCUZGFYSA-N 1 2 230.311 2.198 20 0 BEADLO C[C@@H](C(=O)N[C@H]1CC2CCC1CC2)n1cc[nH+]c1 ZINC001347729995 981155879 /nfs/dbraw/zinc/15/58/79/981155879.db2.gz YZTHHPDTOXVCCE-WTIISPKJSA-N 1 2 247.342 2.139 20 0 BEADLO COc1nnc(-c2ccc3[nH+]ccn3c2)cc1C ZINC001240214076 981161211 /nfs/dbraw/zinc/16/12/11/981161211.db2.gz KXFKRVJQZCXTBF-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO c1cc2ncnc(-c3ccc4[nH+]ccn4c3)c2[nH]1 ZINC001240214404 981161249 /nfs/dbraw/zinc/16/12/49/981161249.db2.gz KJVKBOHFPKSXGS-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO CN(C)c1ccc(-c2ccc3[nH+]ccn3c2)nc1 ZINC001240213917 981161427 /nfs/dbraw/zinc/16/14/27/981161427.db2.gz IFYRYHDPDSFPCI-UHFFFAOYSA-N 1 2 238.294 2.462 20 0 BEADLO Cc1cnc(-c2ccc3[nH+]ccn3c2)c(C)n1 ZINC001240214546 981163088 /nfs/dbraw/zinc/16/30/88/981163088.db2.gz LEBKTUBMAIDPMA-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO O=C1Cc2cccc(-c3ccc4[nH+]ccn4c3)c2N1 ZINC001240217949 981167019 /nfs/dbraw/zinc/16/70/19/981167019.db2.gz SQXBXTCFKDUZMA-UHFFFAOYSA-N 1 2 249.273 2.496 20 0 BEADLO Cc1cc(-c2ccc3[nH+]ccn3c2)c2ncnn2c1 ZINC001240218060 981167086 /nfs/dbraw/zinc/16/70/86/981167086.db2.gz YJNWVWZDLVPDFV-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO Cc1c(-c2ccc3[nH+]ccn3c2)ccc2ncnn21 ZINC001240219382 981168807 /nfs/dbraw/zinc/16/88/07/981168807.db2.gz JMTXXYYMLDNTKR-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO Cn1ccc2nc(-c3ccc4[nH+]ccn4c3)cnc21 ZINC001240219878 981168837 /nfs/dbraw/zinc/16/88/37/981168837.db2.gz YOGDFYBCBBWXSH-UHFFFAOYSA-N 1 2 249.277 2.283 20 0 BEADLO c1cn2cc(-c3cccc4nncn43)ccc2[nH+]1 ZINC001240219590 981169273 /nfs/dbraw/zinc/16/92/73/981169273.db2.gz PCVONIUQRUWUJP-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO CNc1ccc(-c2ccc3[nH+]ccn3c2)cn1 ZINC001240219862 981170019 /nfs/dbraw/zinc/17/00/19/981170019.db2.gz XYDKOYDYRKFPHP-UHFFFAOYSA-N 1 2 224.267 2.438 20 0 BEADLO c1cn2cc(-c3c[nH]cc4ncnc3-4)ccc2[nH+]1 ZINC001240219196 981170066 /nfs/dbraw/zinc/17/00/66/981170066.db2.gz FFJQZWPXUWMGAK-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO c1cc2c(-c3ccc4[nH+]ccn4c3)ncnn2c1 ZINC001240218784 981170111 /nfs/dbraw/zinc/17/01/11/981170111.db2.gz ZEPONYLHXOLVGZ-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO CCn1cc(-c2ccc3[nH+]ccn3c2)ccc1=O ZINC001240218393 981171962 /nfs/dbraw/zinc/17/19/62/981171962.db2.gz MHMVWXNEGKCJMZ-UHFFFAOYSA-N 1 2 239.278 2.183 20 0 BEADLO C=Cc1ncc(-c2ccc3[nH+]ccn3c2)cn1 ZINC001240221862 981176045 /nfs/dbraw/zinc/17/60/45/981176045.db2.gz WPQXAEDASVTVII-UHFFFAOYSA-N 1 2 222.251 2.434 20 0 BEADLO Fc1cncc(-c2cc[nH+]c3c2CCN3)c1 ZINC001240237334 981203979 /nfs/dbraw/zinc/20/39/79/981203979.db2.gz GUULTDWQQHJGGR-UHFFFAOYSA-N 1 2 215.231 2.251 20 0 BEADLO COc1cc(-c2ccc(C)c(N)[nH+]2)ccn1 ZINC001240255408 981228447 /nfs/dbraw/zinc/22/84/47/981228447.db2.gz GVGWTIXAYYVTLG-UHFFFAOYSA-N 1 2 215.256 2.043 20 0 BEADLO CCCC[C@H](C)NC(=O)Nc1c[nH+]c(C)n1C ZINC001193031247 981231419 /nfs/dbraw/zinc/23/14/19/981231419.db2.gz CKCQLOXXWSPSKZ-VIFPVBQESA-N 1 2 238.335 2.429 20 0 BEADLO CC(C)C[C@@H]1CCCCN1c1cc(N)nc[nH+]1 ZINC001348031369 981253288 /nfs/dbraw/zinc/25/32/88/981253288.db2.gz LCTFEACEFBZFJT-NSHDSACASA-N 1 2 234.347 2.464 20 0 BEADLO Cc1nn(C)cc1-c1c[nH+]c(N(C)C)cc1C ZINC001240300685 981258836 /nfs/dbraw/zinc/25/88/36/981258836.db2.gz QEOSVFMNODJZGF-UHFFFAOYSA-N 1 2 230.315 2.165 20 0 BEADLO CCc1ccc(N(C)CC2(O)CCCC2)[nH+]c1 ZINC001348053305 981264222 /nfs/dbraw/zinc/26/42/22/981264222.db2.gz ZEJKTYWPJAYVLE-UHFFFAOYSA-N 1 2 234.343 2.385 20 0 BEADLO Cc1nn(C)cc1-c1cc(C)c2[nH+]ccn2c1 ZINC001240302710 981266547 /nfs/dbraw/zinc/26/65/47/981266547.db2.gz QKDCNJOEMIHDBI-UHFFFAOYSA-N 1 2 226.283 2.352 20 0 BEADLO Cc1cc(F)cc(N2CC[C@H](CCCO)C2)[nH+]1 ZINC001348206443 981309338 /nfs/dbraw/zinc/30/93/38/981309338.db2.gz NGDSJIRFYJESTL-NSHDSACASA-N 1 2 238.306 2.128 20 0 BEADLO Cc1c(-c2ccc3ncnn3c2)ccc2[nH+]ccn21 ZINC001240358978 981315214 /nfs/dbraw/zinc/31/52/14/981315214.db2.gz ATMLJNXRGVOLOL-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO CC(C)OC(=O)Nc1cccc2[nH+]ccn21 ZINC001193446210 981320423 /nfs/dbraw/zinc/32/04/23/981320423.db2.gz OCOZEQUYOCCYLO-UHFFFAOYSA-N 1 2 219.244 2.291 20 0 BEADLO CCc1ccc(N2C[C@@H]3CCC[C@]3(CO)C2)[nH+]c1 ZINC001348269432 981321511 /nfs/dbraw/zinc/32/15/11/981321511.db2.gz DLTYZDOHHMXRRI-DZGCQCFKSA-N 1 2 246.354 2.243 20 0 BEADLO Cc1c(-c2cncnc2)ccc2[nH+]ccn21 ZINC001240378317 981331615 /nfs/dbraw/zinc/33/16/15/981331615.db2.gz FCAUVOUHCIOJFM-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO Cn1cc[nH+]c1CCC(=O)NC1CCCCCC1 ZINC001348424119 981362528 /nfs/dbraw/zinc/36/25/28/981362528.db2.gz KFLWFCCJEBNXNQ-UHFFFAOYSA-N 1 2 249.358 2.192 20 0 BEADLO CC(C)OC(=O)NCc1c[nH+]cn1C1CCC1 ZINC001193520820 981369155 /nfs/dbraw/zinc/36/91/55/981369155.db2.gz CFDGDHQSYVIBLK-UHFFFAOYSA-N 1 2 237.303 2.243 20 0 BEADLO CC[C@@H](C)C(=O)N1CCC(Cc2c[nH]c[nH+]2)CC1 ZINC001348557755 981391868 /nfs/dbraw/zinc/39/18/68/981391868.db2.gz HDDUTECZLYMNFK-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO CC[C@H](C)Cc1noc([C@H](C)n2cc[nH+]c2)n1 ZINC001348573323 981395875 /nfs/dbraw/zinc/39/58/75/981395875.db2.gz GNRPNOXJPRYDCV-UWVGGRQHSA-N 1 2 234.303 2.464 20 0 BEADLO CC[C@H](C)Cc1noc([C@@H](C)n2cc[nH+]c2)n1 ZINC001348573325 981396989 /nfs/dbraw/zinc/39/69/89/981396989.db2.gz GNRPNOXJPRYDCV-VHSXEESVSA-N 1 2 234.303 2.464 20 0 BEADLO CC[C@@H]1C[NH+](Cc2cc(C)n[nH]2)C[C@@H](CC)O1 ZINC001348634650 981412657 /nfs/dbraw/zinc/41/26/57/981412657.db2.gz VOTFCJNBXWBLEZ-CHWSQXEVSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1ncc(F)c(-c2ccn3cc[nH+]c3c2)n1 ZINC001240497033 981417259 /nfs/dbraw/zinc/41/72/59/981417259.db2.gz WLQKJHJJVQMSDG-UHFFFAOYSA-N 1 2 228.230 2.239 20 0 BEADLO c1cn2ccc(-c3cnc4cccnc4n3)cc2[nH+]1 ZINC001240496254 981417475 /nfs/dbraw/zinc/41/74/75/981417475.db2.gz JYMAHNXMZGZZJX-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO CCOc1cncc(-c2ccn3cc[nH+]c3c2)n1 ZINC001240497344 981417836 /nfs/dbraw/zinc/41/78/36/981417836.db2.gz XHAAPEJPUCVKHX-UHFFFAOYSA-N 1 2 240.266 2.190 20 0 BEADLO COc1nnc(-c2ccn3cc[nH+]c3c2)cc1C ZINC001240497538 981417989 /nfs/dbraw/zinc/41/79/89/981417989.db2.gz SEICRHVKMWXZHJ-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO c1cn2cc(-c3ccn4cc[nH+]c4c3)cnc2n1 ZINC001240508630 981433553 /nfs/dbraw/zinc/43/35/53/981433553.db2.gz GIRPPBMWGHUOKC-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO Cc1ncncc1-c1ccn2cc[nH+]c2c1 ZINC001240508625 981435001 /nfs/dbraw/zinc/43/50/01/981435001.db2.gz GFBGKSTUQYDGQW-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO c1nn(CC2CC2)cc1-c1cc[nH+]c2c1CCN2 ZINC001240516770 981443615 /nfs/dbraw/zinc/44/36/15/981443615.db2.gz IFDZSXIWSXETFD-UHFFFAOYSA-N 1 2 240.310 2.323 20 0 BEADLO Nc1cn2ccc(-c3ccc(N)cc3F)cc2[nH+]1 ZINC001240524390 981460255 /nfs/dbraw/zinc/46/02/55/981460255.db2.gz DGXBOCIJWMNQGS-UHFFFAOYSA-N 1 2 242.257 2.305 20 0 BEADLO CCn1cc(-c2cc(-n3ccnc3)cc[nH+]2)cn1 ZINC001240649594 981550980 /nfs/dbraw/zinc/55/09/80/981550980.db2.gz XECSHNFYQYBIJG-UHFFFAOYSA-N 1 2 239.282 2.151 20 0 BEADLO CCCOC(=O)NCc1c[nH+]c2ccc(C)cn12 ZINC001194130057 981563678 /nfs/dbraw/zinc/56/36/78/981563678.db2.gz HHBJEZLDXUOCCX-UHFFFAOYSA-N 1 2 247.298 2.279 20 0 BEADLO CCO[C@H](C)n1cc(-c2ccc[nH+]c2N)cn1 ZINC001240752436 981805859 /nfs/dbraw/zinc/80/58/59/981805859.db2.gz DLJXVCKKIODGML-SECBINFHSA-N 1 2 232.287 2.082 20 0 BEADLO CCO[C@@H](C)n1cc(-c2ccc[nH+]c2N)cn1 ZINC001240752437 981806504 /nfs/dbraw/zinc/80/65/04/981806504.db2.gz DLJXVCKKIODGML-VIFPVBQESA-N 1 2 232.287 2.082 20 0 BEADLO CCO[C@H](C)n1cc(/C(C)=C/C=C/[NH3+])cn1 ZINC001240755916 981807526 /nfs/dbraw/zinc/80/75/26/981807526.db2.gz POGAROAXYXMICV-SDTVIGHBSA-N 1 2 221.304 2.314 20 0 BEADLO CC[C@H](CC(F)F)c1nnc(C[NH+](C)C)o1 ZINC001349986965 981836876 /nfs/dbraw/zinc/83/68/76/981836876.db2.gz SVKIPBBXPDNRIP-SSDOTTSWSA-N 1 2 233.262 2.280 20 0 BEADLO Cc1cc(C(=O)Nc2c(C)c[nH+]cc2C)ccn1 ZINC001584257385 981862572 /nfs/dbraw/zinc/86/25/72/981862572.db2.gz QCRHNUBSABEYGH-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO CCC(CC)N(C(=O)Cc1[nH]c[nH+]c1C)C1CC1 ZINC001584437057 981870945 /nfs/dbraw/zinc/87/09/45/981870945.db2.gz BOENWXORJYSFSX-UHFFFAOYSA-N 1 2 249.358 2.440 20 0 BEADLO Cc1cc(-c2c[nH+]c(N(C)C)cc2C)n(C)n1 ZINC001240858123 981885073 /nfs/dbraw/zinc/88/50/73/981885073.db2.gz GNLWZXGKNOCPCZ-UHFFFAOYSA-N 1 2 230.315 2.165 20 0 BEADLO CCCCCC(=O)N1CCC[N@H+](CCF)CC1 ZINC001194876202 981950248 /nfs/dbraw/zinc/95/02/48/981950248.db2.gz LNBPTWRMYCNDKE-UHFFFAOYSA-N 1 2 244.354 2.071 20 0 BEADLO CCCCCC(=O)N1CCC[N@@H+](CCF)CC1 ZINC001194876202 981950250 /nfs/dbraw/zinc/95/02/50/981950250.db2.gz LNBPTWRMYCNDKE-UHFFFAOYSA-N 1 2 244.354 2.071 20 0 BEADLO CC(C)C[C@@]1(C)CCC[N@@H+]1Cc1nc[nH]n1 ZINC001350378499 981953024 /nfs/dbraw/zinc/95/30/24/981953024.db2.gz XLCBAZWZDRRKFY-GFCCVEGCSA-N 1 2 222.336 2.205 20 0 BEADLO CC(C)C[C@@]1(C)CCC[N@H+]1Cc1nc[nH]n1 ZINC001350378499 981953036 /nfs/dbraw/zinc/95/30/36/981953036.db2.gz XLCBAZWZDRRKFY-GFCCVEGCSA-N 1 2 222.336 2.205 20 0 BEADLO Oc1cccc(-c2c[nH+]c3c(c2)CCCN3)c1 ZINC001240926142 981995449 /nfs/dbraw/zinc/99/54/49/981995449.db2.gz NEVKANRAWVIKST-UHFFFAOYSA-N 1 2 226.279 2.455 20 0 BEADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)OCCF ZINC001194964313 982004346 /nfs/dbraw/zinc/00/43/46/982004346.db2.gz QIHJZPRXFNHAKK-UHFFFAOYSA-N 1 2 249.245 2.390 20 0 BEADLO CCC[C@@H](C)CCNC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001350847085 982101934 /nfs/dbraw/zinc/10/19/34/982101934.db2.gz GNNGOFGHKISKHK-VXGBXAGGSA-N 1 2 237.347 2.387 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1ccc[nH]c1=O ZINC001241112957 982224180 /nfs/dbraw/zinc/22/41/80/982224180.db2.gz ZKPCYGNJPRBZCE-UHFFFAOYSA-N 1 2 229.283 2.224 20 0 BEADLO Nc1cc(-c2cnc3cc[nH]c3c2)cc[nH+]1 ZINC001241162429 982296996 /nfs/dbraw/zinc/29/69/96/982296996.db2.gz IYVOCJQVSGAXCD-UHFFFAOYSA-N 1 2 210.240 2.207 20 0 BEADLO Nc1cc(-c2cnc(F)c(F)c2)cc[nH+]1 ZINC001241162850 982301576 /nfs/dbraw/zinc/30/15/76/982301576.db2.gz NNRJKXAHIWOOFB-UHFFFAOYSA-N 1 2 207.183 2.004 20 0 BEADLO Cc1cc(-c2cc[nH+]c(N)c2)cc(F)n1 ZINC001241163406 982303726 /nfs/dbraw/zinc/30/37/26/982303726.db2.gz OPLDIZZDGJCELL-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO Nc1cc(-c2cccc(C3OCCO3)c2)cc[nH+]1 ZINC001241163578 982305259 /nfs/dbraw/zinc/30/52/59/982305259.db2.gz WKVQBIGNMBTQFF-UHFFFAOYSA-N 1 2 242.278 2.376 20 0 BEADLO Nc1cc(-c2ccc3c(c2)NC(=O)CC3)cc[nH+]1 ZINC001241163890 982305832 /nfs/dbraw/zinc/30/58/32/982305832.db2.gz TVHPZDGVXIQSOX-UHFFFAOYSA-N 1 2 239.278 2.216 20 0 BEADLO COc1cc(C)c(-c2cc[nH+]c(N)c2)cn1 ZINC001241164200 982305858 /nfs/dbraw/zinc/30/58/58/982305858.db2.gz YDZBEXUZAAEVCS-UHFFFAOYSA-N 1 2 215.256 2.043 20 0 BEADLO COc1cc(C)c(-c2cc[nH+]c(N)c2)c(C)n1 ZINC001241170531 982315700 /nfs/dbraw/zinc/31/57/00/982315700.db2.gz MTYQBWJHSMXQMN-UHFFFAOYSA-N 1 2 229.283 2.351 20 0 BEADLO COc1cnc(C)c(-c2cc[nH+]c(N)c2)c1 ZINC001241170529 982319361 /nfs/dbraw/zinc/31/93/61/982319361.db2.gz MQCJJCDJZIMAEA-UHFFFAOYSA-N 1 2 215.256 2.043 20 0 BEADLO C[C@@H](C(=O)N1CC[C@H]1C1CCCC1)n1cc[nH+]c1 ZINC001351842114 982398020 /nfs/dbraw/zinc/39/80/20/982398020.db2.gz JLMSCHHZXPHSEE-AAEUAGOBSA-N 1 2 247.342 2.235 20 0 BEADLO Nc1[nH+]cccc1-c1cc(O)cc(F)c1 ZINC001241267389 982402438 /nfs/dbraw/zinc/40/24/38/982402438.db2.gz URTIOONCICVRHV-UHFFFAOYSA-N 1 2 204.204 2.176 20 0 BEADLO CC[C@H](C)C[C@H](C)NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC000080691995 982485909 /nfs/dbraw/zinc/48/59/09/982485909.db2.gz NEZJMMYIHAFUEI-SDDRHHMPSA-N 1 2 237.347 2.385 20 0 BEADLO C[S@](=O)c1ccccc1-c1cc[nH+]c(N)c1 ZINC001241341999 982503390 /nfs/dbraw/zinc/50/33/90/982503390.db2.gz QVWOLWWGJUZANU-INIZCTEOSA-N 1 2 232.308 2.068 20 0 BEADLO Cc1sccc1NC(=O)CCc1[nH+]ccn1C ZINC001352496368 982537839 /nfs/dbraw/zinc/53/78/39/982537839.db2.gz LCTUFSHNNWCQGY-UHFFFAOYSA-N 1 2 249.339 2.361 20 0 BEADLO COc1cc(-c2ccc[nH+]c2N)ccc1F ZINC001241418658 982568956 /nfs/dbraw/zinc/56/89/56/982568956.db2.gz SOMZBYLJAMSPSC-UHFFFAOYSA-N 1 2 218.231 2.479 20 0 BEADLO CNC(=O)c1cc(-c2cc(C)[nH+]c(C)c2)ccn1 ZINC001241429715 982584272 /nfs/dbraw/zinc/58/42/72/982584272.db2.gz ANMKZQNEVCRBJM-UHFFFAOYSA-N 1 2 241.294 2.120 20 0 BEADLO C[S@](=O)c1ccc(-c2ccc[nH+]c2N)cc1 ZINC001241483672 982634795 /nfs/dbraw/zinc/63/47/95/982634795.db2.gz YNPXBOCSUNTXQR-INIZCTEOSA-N 1 2 232.308 2.068 20 0 BEADLO CCOc1cccc(C[NH2+]Cc2cc(C)no2)n1 ZINC001200244033 982740163 /nfs/dbraw/zinc/74/01/63/982740163.db2.gz PDEHYVNRFMMVJJ-UHFFFAOYSA-N 1 2 247.298 2.067 20 0 BEADLO CC[C@H](C)CNC(=S)Nc1c[nH+]c(C)n1C ZINC001200244940 982740883 /nfs/dbraw/zinc/74/08/83/982740883.db2.gz KUCWZOMVSLGBKG-QMMMGPOBSA-N 1 2 240.376 2.061 20 0 BEADLO Cn1ccc2c[nH+]c(-c3ccc(CO)cc3)nc21 ZINC001241556951 982778284 /nfs/dbraw/zinc/77/82/84/982778284.db2.gz WXWKXUBSCNFWII-UHFFFAOYSA-N 1 2 239.278 2.128 20 0 BEADLO O=C(C1=CC=CC1)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC001199693844 982994890 /nfs/dbraw/zinc/99/48/90/982994890.db2.gz SSETYYBGDKBKTH-UHFFFAOYSA-N 1 2 243.310 2.002 20 0 BEADLO O=C(C1=CC=CC1)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC001199693844 982994902 /nfs/dbraw/zinc/99/49/02/982994902.db2.gz SSETYYBGDKBKTH-UHFFFAOYSA-N 1 2 243.310 2.002 20 0 BEADLO CC(C)(CNC(=O)C[C@H]1C=CCC1)n1cc[nH+]c1 ZINC001353867014 983035559 /nfs/dbraw/zinc/03/55/59/983035559.db2.gz XJHVFRAUUSZDDC-LBPRGKRZSA-N 1 2 247.342 2.091 20 0 BEADLO COc1cccc(C[N@@H+]2C[C@H](F)C[C@H]2C)n1 ZINC001137528675 983052434 /nfs/dbraw/zinc/05/24/34/983052434.db2.gz PCVUTEKQHZEBBI-NXEZZACHSA-N 1 2 224.279 2.023 20 0 BEADLO COc1cccc(C[N@H+]2C[C@H](F)C[C@H]2C)n1 ZINC001137528675 983052440 /nfs/dbraw/zinc/05/24/40/983052440.db2.gz PCVUTEKQHZEBBI-NXEZZACHSA-N 1 2 224.279 2.023 20 0 BEADLO CC(C)(C)[C@@H]1CCN1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC001353979504 983106902 /nfs/dbraw/zinc/10/69/02/983106902.db2.gz UNJIDYCCJAYIIT-FOGDFJRCSA-N 1 2 247.342 2.160 20 0 BEADLO CC(C)(C)[C@@H]1CCN1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC001353979504 983106909 /nfs/dbraw/zinc/10/69/09/983106909.db2.gz UNJIDYCCJAYIIT-FOGDFJRCSA-N 1 2 247.342 2.160 20 0 BEADLO c1cn2c(cccc2-c2ccc3n[nH]nc3c2)[nH+]1 ZINC001241940651 983154187 /nfs/dbraw/zinc/15/41/87/983154187.db2.gz MHFNZUPRNDAIIQ-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO Cc1ccc(CO)cc1Nc1ccc(N)[nH+]c1 ZINC001201284546 983156559 /nfs/dbraw/zinc/15/65/59/983156559.db2.gz RNBOJKZXBJKTAI-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO Nc1ccc(Nc2cccc3c2OCO3)c[nH+]1 ZINC001201283715 983158616 /nfs/dbraw/zinc/15/86/16/983158616.db2.gz FEVQMEQQMYAIFZ-UHFFFAOYSA-N 1 2 229.239 2.136 20 0 BEADLO C[C@@H](O)c1cccc(Nc2ccc(N)[nH+]c2)c1 ZINC001201284160 983158934 /nfs/dbraw/zinc/15/89/34/983158934.db2.gz KRQVRGCNBSWUCV-SECBINFHSA-N 1 2 229.283 2.461 20 0 BEADLO Nc1ccc(Nc2cccc3nccnc32)c[nH+]1 ZINC001201285215 983159912 /nfs/dbraw/zinc/15/99/12/983159912.db2.gz CTPUXZDABHNQCH-UHFFFAOYSA-N 1 2 237.266 2.351 20 0 BEADLO Cn1ncc2cccc(Nc3ccc(N)[nH+]c3)c21 ZINC001201287000 983163172 /nfs/dbraw/zinc/16/31/72/983163172.db2.gz NDXOKLXXLCHUGE-UHFFFAOYSA-N 1 2 239.282 2.294 20 0 BEADLO Cn1cc2ccc(Nc3ccc(N)[nH+]c3)cc2n1 ZINC001201286951 983163364 /nfs/dbraw/zinc/16/33/64/983163364.db2.gz JSFHBSZDRWAHSF-UHFFFAOYSA-N 1 2 239.282 2.294 20 0 BEADLO Nc1ccc(Nc2cc(F)c(O)c(F)c2)c[nH+]1 ZINC001201286985 983164308 /nfs/dbraw/zinc/16/43/08/983164308.db2.gz MEMKJOCUEARYEC-UHFFFAOYSA-N 1 2 237.209 2.391 20 0 BEADLO Nc1ccc(Nc2ccc3o[nH]c(=O)c3c2)c[nH+]1 ZINC001201291969 983168823 /nfs/dbraw/zinc/16/88/23/983168823.db2.gz RGDQZHMIIUBXPK-UHFFFAOYSA-N 1 2 242.238 2.254 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@@H]2C[C@@H](C)O)[nH+]1 ZINC001354141352 983170055 /nfs/dbraw/zinc/17/00/55/983170055.db2.gz OQFLVRXXMQWKJW-ZYHUDNBSSA-N 1 2 238.306 2.269 20 0 BEADLO COc1nccc(C)c1Nc1ccc(N)[nH+]c1 ZINC001201271793 983171083 /nfs/dbraw/zinc/17/10/83/983171083.db2.gz CUPPZAJMUOJUMG-UHFFFAOYSA-N 1 2 230.271 2.119 20 0 BEADLO Nc1ccc(Nc2nc3c(s2)CCC3)c[nH+]1 ZINC001201271778 983173811 /nfs/dbraw/zinc/17/38/11/983173811.db2.gz BWKOQYPLWTVVBN-UHFFFAOYSA-N 1 2 232.312 2.353 20 0 BEADLO Nc1ccc(Nc2ccc(Cl)nc2)c[nH+]1 ZINC001201272097 983174070 /nfs/dbraw/zinc/17/40/70/983174070.db2.gz IVBPEQUOTOFGJO-UHFFFAOYSA-N 1 2 220.663 2.456 20 0 BEADLO COC(=O)c1cc(Nc2ccc(N)[nH+]c2)cs1 ZINC001201276350 983175038 /nfs/dbraw/zinc/17/50/38/983175038.db2.gz UPXLPSMXHJLBNE-UHFFFAOYSA-N 1 2 249.295 2.256 20 0 BEADLO Nc1ccc(Nc2ccnc(Cl)c2)c[nH+]1 ZINC001201272886 983175625 /nfs/dbraw/zinc/17/56/25/983175625.db2.gz VSADHGNLYGNPAW-UHFFFAOYSA-N 1 2 220.663 2.456 20 0 BEADLO Nc1ccc(Nc2cnc(Cl)cc2N)c[nH+]1 ZINC001201276288 983175934 /nfs/dbraw/zinc/17/59/34/983175934.db2.gz SISTUNHROOCJIF-UHFFFAOYSA-N 1 2 235.678 2.038 20 0 BEADLO Cn1nc(C(C)(C)C)cc1Nc1ccc(N)[nH+]c1 ZINC001201276294 983176203 /nfs/dbraw/zinc/17/62/03/983176203.db2.gz SKIWEKQLNGXDCF-UHFFFAOYSA-N 1 2 245.330 2.438 20 0 BEADLO CC(=O)N1CC=C(c2cc(C)[nH+]cc2C)CC1 ZINC001241968069 983176632 /nfs/dbraw/zinc/17/66/32/983176632.db2.gz ASNLUPHGYFBJLH-UHFFFAOYSA-N 1 2 230.311 2.334 20 0 BEADLO CCc1cccnc1Nc1ccc(N)[nH+]c1 ZINC001201275393 983176553 /nfs/dbraw/zinc/17/65/53/983176553.db2.gz DQGORXOQTOEPDM-UHFFFAOYSA-N 1 2 214.272 2.365 20 0 BEADLO Nc1ccc(Nc2ccc(CO)c(F)c2)c[nH+]1 ZINC001201300774 983180347 /nfs/dbraw/zinc/18/03/47/983180347.db2.gz WPIVYIHLIPOYJK-UHFFFAOYSA-N 1 2 233.246 2.039 20 0 BEADLO COc1c(O)cccc1Nc1ccc(N)[nH+]c1 ZINC001201300711 983181591 /nfs/dbraw/zinc/18/15/91/983181591.db2.gz VJIRYTNQEKGSID-UHFFFAOYSA-N 1 2 231.255 2.122 20 0 BEADLO Cc1cn(-c2ccc(N)[nH+]c2)c2cc(N)ccc12 ZINC001201294485 983182483 /nfs/dbraw/zinc/18/24/83/983182483.db2.gz AOTUHRWJICEXFD-UHFFFAOYSA-N 1 2 238.294 2.498 20 0 BEADLO Cc1cc(-c2c[nH]c3c[nH]c(=O)c-3c2)cc(C)[nH+]1 ZINC001241995244 983187246 /nfs/dbraw/zinc/18/72/46/983187246.db2.gz PAJCBRKQFIQLKF-UHFFFAOYSA-N 1 2 239.278 2.004 20 0 BEADLO c1c[nH+]c(-c2ccc(C3OCCO3)cc2)[nH]1 ZINC001242015844 983215501 /nfs/dbraw/zinc/21/55/01/983215501.db2.gz OLSVBEUIQAKNFF-UHFFFAOYSA-N 1 2 216.240 2.122 20 0 BEADLO Fc1ccc(-c2[nH]cc[nH+]2)cc1C1OCCO1 ZINC001242018339 983220071 /nfs/dbraw/zinc/22/00/71/983220071.db2.gz JCWWSVSGAHQBFJ-UHFFFAOYSA-N 1 2 234.230 2.261 20 0 BEADLO CC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1C ZINC001242018336 983221673 /nfs/dbraw/zinc/22/16/73/983221673.db2.gz JAFLFQMJIWDTGZ-UHFFFAOYSA-N 1 2 215.256 2.344 20 0 BEADLO COCOc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001242019070 983223495 /nfs/dbraw/zinc/22/34/95/983223495.db2.gz YHKQRZQVRICLHM-UHFFFAOYSA-N 1 2 204.229 2.059 20 0 BEADLO CC(C)(C)C[N@@H+]1CC(F)(F)C[C@@]1(C)CO ZINC001201433000 983228261 /nfs/dbraw/zinc/22/82/61/983228261.db2.gz OZVZJAPTIVKJNO-JTQLQIEISA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)(C)C[N@H+]1CC(F)(F)C[C@@]1(C)CO ZINC001201433000 983228269 /nfs/dbraw/zinc/22/82/69/983228269.db2.gz OZVZJAPTIVKJNO-JTQLQIEISA-N 1 2 221.291 2.125 20 0 BEADLO C[C@H](C(=O)NC[C@@]12C[C@@H]1CCCC2)n1cc[nH+]c1 ZINC001354269565 983244450 /nfs/dbraw/zinc/24/44/50/983244450.db2.gz JQIKYWOJTYEEOO-MBNYWOFBSA-N 1 2 247.342 2.141 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@@H](C)C2(C)CC2)c1 ZINC001354289577 983259010 /nfs/dbraw/zinc/25/90/10/983259010.db2.gz HMQCMJIMIIGWAA-JTQLQIEISA-N 1 2 248.326 2.398 20 0 BEADLO COc1ccncc1-c1c[nH+]c(C)cc1OC ZINC001242058869 983268722 /nfs/dbraw/zinc/26/87/22/983268722.db2.gz VEZCAGURINOAGN-UHFFFAOYSA-N 1 2 230.267 2.469 20 0 BEADLO Cc1cc(NC(=S)NC2CCCCC2)cc[nH+]1 ZINC001200640156 983294889 /nfs/dbraw/zinc/29/48/89/983294889.db2.gz DUMSQPPWRANCGL-UHFFFAOYSA-N 1 2 249.383 2.431 20 0 BEADLO Cn1nc(C(F)(F)F)cc1C[N@@H+]1CC[C@@H]2C[C@@H]21 ZINC001354461797 983310796 /nfs/dbraw/zinc/31/07/96/983310796.db2.gz ZVGPEDNJRIRYCK-APPZFPTMSA-N 1 2 245.248 2.033 20 0 BEADLO Cn1nc(C(F)(F)F)cc1C[N@H+]1CC[C@@H]2C[C@@H]21 ZINC001354461797 983310800 /nfs/dbraw/zinc/31/08/00/983310800.db2.gz ZVGPEDNJRIRYCK-APPZFPTMSA-N 1 2 245.248 2.033 20 0 BEADLO CCNc1ccc(Nc2ncncc2C)c[nH+]1 ZINC001354484500 983312044 /nfs/dbraw/zinc/31/20/44/983312044.db2.gz FKWMFWBPBOHPLH-UHFFFAOYSA-N 1 2 229.287 2.355 20 0 BEADLO CCCn1cncc1C[NH2+]Cc1cc(CC)no1 ZINC001200703982 983324786 /nfs/dbraw/zinc/32/47/86/983324786.db2.gz QMUHWVOFJBNPJD-UHFFFAOYSA-N 1 2 248.330 2.133 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1nccnc1OC(C)C ZINC001242077900 983325607 /nfs/dbraw/zinc/32/56/07/983325607.db2.gz KOHKJUMJSWQUFE-UHFFFAOYSA-N 1 2 244.298 2.216 20 0 BEADLO CCCC[C@@H](O)CNc1c[nH+]ccc1OC ZINC001252078881 983332825 /nfs/dbraw/zinc/33/28/25/983332825.db2.gz CAHAMAJQFPJNEL-SNVBAGLBSA-N 1 2 224.304 2.053 20 0 BEADLO CC[N@@H+]1Cc2cnc(-c3ccccc3)nc2C1 ZINC001201587363 983351098 /nfs/dbraw/zinc/35/10/98/983351098.db2.gz HWFXEOURVSCENR-UHFFFAOYSA-N 1 2 225.295 2.479 20 0 BEADLO CC[N@H+]1Cc2cnc(-c3ccccc3)nc2C1 ZINC001201587363 983351103 /nfs/dbraw/zinc/35/11/03/983351103.db2.gz HWFXEOURVSCENR-UHFFFAOYSA-N 1 2 225.295 2.479 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc(C(=O)N(C)C)cc1F ZINC001242124840 983366703 /nfs/dbraw/zinc/36/67/03/983366703.db2.gz XWDWQVIVZBCQIL-DXNUHORPSA-N 1 2 248.301 2.403 20 0 BEADLO Oc1cncc(Nc2cccc3[nH+]ccn32)c1 ZINC001201629012 983384334 /nfs/dbraw/zinc/38/43/34/983384334.db2.gz MYVAZWNLJOFNKR-UHFFFAOYSA-N 1 2 226.239 2.179 20 0 BEADLO Cn1ncc2c1C[N@H+](CCCc1ccccc1)C2 ZINC001201663893 983408187 /nfs/dbraw/zinc/40/81/87/983408187.db2.gz NYIPQOPUGBCIFR-UHFFFAOYSA-N 1 2 241.338 2.369 20 0 BEADLO Cn1ncc2c1C[N@@H+](CCCc1ccccc1)C2 ZINC001201663893 983408192 /nfs/dbraw/zinc/40/81/92/983408192.db2.gz NYIPQOPUGBCIFR-UHFFFAOYSA-N 1 2 241.338 2.369 20 0 BEADLO CCCC[N@@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001201717224 983422463 /nfs/dbraw/zinc/42/24/63/983422463.db2.gz GSQISBDNLLPJKH-UHFFFAOYSA-N 1 2 249.358 2.350 20 0 BEADLO CCCC[N@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001201717224 983422466 /nfs/dbraw/zinc/42/24/66/983422466.db2.gz GSQISBDNLLPJKH-UHFFFAOYSA-N 1 2 249.358 2.350 20 0 BEADLO CCCCCC[N@@H+]1Cc2cncnc2C1 ZINC001201743535 983451823 /nfs/dbraw/zinc/45/18/23/983451823.db2.gz SPWGRVZUGOSHJW-UHFFFAOYSA-N 1 2 205.305 2.373 20 0 BEADLO CCCCCC[N@H+]1Cc2cncnc2C1 ZINC001201743535 983451831 /nfs/dbraw/zinc/45/18/31/983451831.db2.gz SPWGRVZUGOSHJW-UHFFFAOYSA-N 1 2 205.305 2.373 20 0 BEADLO Cc1c[nH+]c(-c2cccc(F)c2O)cc1N ZINC001242349695 983614279 /nfs/dbraw/zinc/61/42/79/983614279.db2.gz XIWQVJKKHQETCC-UHFFFAOYSA-N 1 2 218.231 2.484 20 0 BEADLO CCOC1C[NH+](CCCC(F)(F)F)C1 ZINC001202377377 983642237 /nfs/dbraw/zinc/64/22/37/983642237.db2.gz DNOLLBFLCNSPTH-UHFFFAOYSA-N 1 2 211.227 2.050 20 0 BEADLO CC(C)n1cc(-c2cc[nH+]c3c2CCN3)cn1 ZINC001242438636 983743097 /nfs/dbraw/zinc/74/30/97/983743097.db2.gz KHIOVTSDLLKRGW-UHFFFAOYSA-N 1 2 228.299 2.494 20 0 BEADLO Cc1nccnc1[C@@H](C)[NH2+]Cc1ccncc1F ZINC000873187086 983899495 /nfs/dbraw/zinc/89/94/95/983899495.db2.gz KXSILBDBWKARIA-SNVBAGLBSA-N 1 2 246.289 2.170 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cccc2c1OCO2 ZINC001242587675 983900367 /nfs/dbraw/zinc/90/03/67/983900367.db2.gz IWJJDVOJMZZCRW-DDEWIXKASA-N 1 2 203.241 2.291 20 0 BEADLO CC(C)n1cc(C[N@H+]2CCC(=O)[C@H](C)CC2)cn1 ZINC001137072864 983905246 /nfs/dbraw/zinc/90/52/46/983905246.db2.gz KZDPWESGSJZQRF-GFCCVEGCSA-N 1 2 249.358 2.265 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CCC(=O)[C@H](C)CC2)cn1 ZINC001137072864 983905258 /nfs/dbraw/zinc/90/52/58/983905258.db2.gz KZDPWESGSJZQRF-GFCCVEGCSA-N 1 2 249.358 2.265 20 0 BEADLO Cc1cccc2c(C[N@H+]3CCOC[C@@H]3C)[nH]nc21 ZINC001137141628 983967513 /nfs/dbraw/zinc/96/75/13/983967513.db2.gz CVUNCZRYZXXQMF-NSHDSACASA-N 1 2 245.326 2.092 20 0 BEADLO Cc1cccc2c(C[N@@H+]3CCOC[C@@H]3C)[nH]nc21 ZINC001137141628 983967525 /nfs/dbraw/zinc/96/75/25/983967525.db2.gz CVUNCZRYZXXQMF-NSHDSACASA-N 1 2 245.326 2.092 20 0 BEADLO C[C@H](O)c1ccc(-c2ccc[nH+]c2N)cc1 ZINC001242646567 984019225 /nfs/dbraw/zinc/01/92/25/984019225.db2.gz SIUPAIDIUASCLG-VIFPVBQESA-N 1 2 214.268 2.384 20 0 BEADLO Clc1ccc(C[N@@H+]2CC[C@]23CCOC3)cn1 ZINC001137169818 984022393 /nfs/dbraw/zinc/02/23/93/984022393.db2.gz XKNYCVMPAHBDFM-GFCCVEGCSA-N 1 2 238.718 2.100 20 0 BEADLO Clc1ccc(C[N@H+]2CC[C@]23CCOC3)cn1 ZINC001137169818 984022400 /nfs/dbraw/zinc/02/24/00/984022400.db2.gz XKNYCVMPAHBDFM-GFCCVEGCSA-N 1 2 238.718 2.100 20 0 BEADLO c1cnc2c(c1)cccc2C[NH+]1CC2(CCO2)C1 ZINC001137176724 984024401 /nfs/dbraw/zinc/02/44/01/984024401.db2.gz IOBKWIUSIYDVFG-UHFFFAOYSA-N 1 2 240.306 2.210 20 0 BEADLO Cc1ccc(-c2cc(CO)ccc2C)[nH+]c1N ZINC001242666913 984031836 /nfs/dbraw/zinc/03/18/36/984031836.db2.gz ZNGMFCPVZJNARI-UHFFFAOYSA-N 1 2 228.295 2.440 20 0 BEADLO Cc1ccc(CO)cc1-c1ccc[nH+]c1N ZINC001242668194 984036106 /nfs/dbraw/zinc/03/61/06/984036106.db2.gz BWDPQYVYOXHXKX-UHFFFAOYSA-N 1 2 214.268 2.132 20 0 BEADLO Cc1ccc(CO)cc1-c1c[nH+]c(N)c(C)c1 ZINC001242669625 984039543 /nfs/dbraw/zinc/03/95/43/984039543.db2.gz SXEJGADGHJTDBY-UHFFFAOYSA-N 1 2 228.295 2.440 20 0 BEADLO Cn1c[nH+]cc1-c1ccccc1-n1cccn1 ZINC001242711538 984061795 /nfs/dbraw/zinc/06/17/95/984061795.db2.gz SOQMOECAQOAHPK-UHFFFAOYSA-N 1 2 224.267 2.273 20 0 BEADLO CCCCC[C@@H](O)CNc1c[nH+]ccc1OC ZINC001253521975 984192852 /nfs/dbraw/zinc/19/28/52/984192852.db2.gz YKPBZMOTNMNFSQ-LLVKDONJSA-N 1 2 238.331 2.443 20 0 BEADLO [NH3+]Cc1ccnc(-c2cccc(S)c2)c1 ZINC001242865266 984209210 /nfs/dbraw/zinc/20/92/10/984209210.db2.gz SPGORNJRUSWNCW-UHFFFAOYSA-N 1 2 216.309 2.496 20 0 BEADLO c1csc(-c2cc(-n3cc[nH+]c3)ccn2)n1 ZINC001242895922 984251746 /nfs/dbraw/zinc/25/17/46/984251746.db2.gz SMSIKUNLIZMNGJ-UHFFFAOYSA-N 1 2 228.280 2.391 20 0 BEADLO c1cn(-c2ccc(-c3ccncn3)cc2)c[nH+]1 ZINC001242918330 984292500 /nfs/dbraw/zinc/29/25/00/984292500.db2.gz PESIIFWJMZWQSD-UHFFFAOYSA-N 1 2 222.251 2.329 20 0 BEADLO Cc1c(CO)cccc1-c1ccc(N)[nH+]c1 ZINC001243015246 984370502 /nfs/dbraw/zinc/37/05/02/984370502.db2.gz JHXUFRMJVYDFRA-UHFFFAOYSA-N 1 2 214.268 2.132 20 0 BEADLO Cc1cc(-c2cccc(CO)c2C)c[nH+]c1N ZINC001243015773 984374486 /nfs/dbraw/zinc/37/44/86/984374486.db2.gz CIWCMXLVLDBTKG-UHFFFAOYSA-N 1 2 228.295 2.440 20 0 BEADLO COC(OC)c1ccccc1-c1c[nH+]cn1C ZINC001243066515 984478282 /nfs/dbraw/zinc/47/82/82/984478282.db2.gz HYKBEUDHTFBCJF-UHFFFAOYSA-N 1 2 232.283 2.379 20 0 BEADLO CC(C)Oc1cc(-c2c[nH+]cn2C)ccn1 ZINC001243066951 984478860 /nfs/dbraw/zinc/47/88/60/984478860.db2.gz PIHFHJUVXOFPHK-UHFFFAOYSA-N 1 2 217.272 2.269 20 0 BEADLO CCOc1ccc(-c2c[nH+]cn2C)c(C)n1 ZINC001243066833 984480217 /nfs/dbraw/zinc/48/02/17/984480217.db2.gz BBZCTIDBKWCPGQ-UHFFFAOYSA-N 1 2 217.272 2.189 20 0 BEADLO Cn1c[nH+]cc1-c1cccc(C2COC2)c1 ZINC001243067363 984483863 /nfs/dbraw/zinc/48/38/63/984483863.db2.gz KFSIABZXCDEGPV-UHFFFAOYSA-N 1 2 214.268 2.201 20 0 BEADLO Cc1ccc(N(C)C)c(-c2c[nH+]cn2C)c1 ZINC001243069201 984489080 /nfs/dbraw/zinc/48/90/80/984489080.db2.gz CEZLYWUGAIIIEK-UHFFFAOYSA-N 1 2 215.300 2.462 20 0 BEADLO COC(=O)c1c(C)cc(-c2c[nH+]cn2C)cc1C ZINC001243068452 984489994 /nfs/dbraw/zinc/48/99/94/984489994.db2.gz YBHGBADZTRWHEG-UHFFFAOYSA-N 1 2 244.294 2.491 20 0 BEADLO Cn1cncc1-c1ccccc1Cn1cc[nH+]c1 ZINC001243068422 984490993 /nfs/dbraw/zinc/49/09/93/984490993.db2.gz WQHOIIXPYDLWQQ-UHFFFAOYSA-N 1 2 238.294 2.332 20 0 BEADLO Cc1cn2c(cccc2-c2cncn2C)[nH+]1 ZINC001243069865 984492003 /nfs/dbraw/zinc/49/20/03/984492003.db2.gz ZPJKLLLJXWSOJL-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO Cc1cc(-c2c[nH+]cn2C)cc2c1NC(=O)CC2 ZINC001243070522 984495321 /nfs/dbraw/zinc/49/53/21/984495321.db2.gz GWXFGLHHBHKAJT-UHFFFAOYSA-N 1 2 241.294 2.280 20 0 BEADLO Cc1cc(-c2c[nH+]cn2C)cc(OC(F)F)n1 ZINC001243070669 984495761 /nfs/dbraw/zinc/49/57/61/984495761.db2.gz VXGSBUJFCVCCBH-UHFFFAOYSA-N 1 2 239.225 2.392 20 0 BEADLO CN(C)c1ccc(F)cc1-c1c[nH+]cn1C ZINC001243072163 984505649 /nfs/dbraw/zinc/50/56/49/984505649.db2.gz JVLPEAZZASBPKA-UHFFFAOYSA-N 1 2 219.263 2.292 20 0 BEADLO CC[C@H](C)CN(CC)C(=O)Cc1[nH]c[nH+]c1C ZINC001445218316 984583075 /nfs/dbraw/zinc/58/30/75/984583075.db2.gz DJCZTVJNCWCDEH-JTQLQIEISA-N 1 2 237.347 2.155 20 0 BEADLO CC[C@@H](C)CN(CC)C(=O)Cc1[nH]c[nH+]c1C ZINC001445218319 984587218 /nfs/dbraw/zinc/58/72/18/984587218.db2.gz DJCZTVJNCWCDEH-SNVBAGLBSA-N 1 2 237.347 2.155 20 0 BEADLO Cc1cnc(F)c(-c2c[nH+]c(N)c(C)c2)c1 ZINC001243167817 984627204 /nfs/dbraw/zinc/62/72/04/984627204.db2.gz VOXZESKDGNFJPZ-UHFFFAOYSA-N 1 2 217.247 2.482 20 0 BEADLO Cc1cc(C[NH+]2CC(C3CCCC3)C2)n[nH]1 ZINC001326796239 984823465 /nfs/dbraw/zinc/82/34/65/984823465.db2.gz DOSQLAOAUUMOET-UHFFFAOYSA-N 1 2 219.332 2.340 20 0 BEADLO CC[C@@H](C)[NH2+][C@H](C(=O)OC)[C@@H](C)OC(C)(C)C ZINC001257430118 985000879 /nfs/dbraw/zinc/00/08/79/985000879.db2.gz FJCVMXVKDSYUCS-MXWKQRLJSA-N 1 2 245.363 2.120 20 0 BEADLO COC(=[NH2+])c1cccc(-c2ccc(CO)nc2)c1 ZINC001243469529 985003885 /nfs/dbraw/zinc/00/38/85/985003885.db2.gz BJCOGLQYNWSSDH-UHFFFAOYSA-N 1 2 242.278 2.213 20 0 BEADLO Nc1[nH+]cccc1-c1cccc2c1CCC(=O)N2 ZINC001243475105 985030577 /nfs/dbraw/zinc/03/05/77/985030577.db2.gz DSSXAGSNVNMEJG-UHFFFAOYSA-N 1 2 239.278 2.216 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2c(c1)NC(=O)CC2 ZINC001243474513 985031320 /nfs/dbraw/zinc/03/13/20/985031320.db2.gz MVAFQWHLBUWWLE-UHFFFAOYSA-N 1 2 239.278 2.216 20 0 BEADLO CCc1c(F)cncc1-c1ccc[nH+]c1N ZINC001243476861 985035123 /nfs/dbraw/zinc/03/51/23/985035123.db2.gz VSJNRIKKXKSPAX-UHFFFAOYSA-N 1 2 217.247 2.427 20 0 BEADLO COc1c(F)ccc(-c2ccc[nH+]c2N)c1OC ZINC001243477859 985035652 /nfs/dbraw/zinc/03/56/52/985035652.db2.gz PZBDGMZZLZHGMD-UHFFFAOYSA-N 1 2 248.257 2.487 20 0 BEADLO COc1cc(-c2ccc[nH+]c2N)c2cc[nH]c2n1 ZINC001243477038 985037687 /nfs/dbraw/zinc/03/76/87/985037687.db2.gz HYPCGIVEBFJEJM-UHFFFAOYSA-N 1 2 240.266 2.216 20 0 BEADLO CCC(=O)Nc1cc(-c2ccc[nH+]c2N)ccn1 ZINC001243477411 985038302 /nfs/dbraw/zinc/03/83/02/985038302.db2.gz MXHIPSZQAJAPTD-UHFFFAOYSA-N 1 2 242.282 2.074 20 0 BEADLO Nc1[nH+]cccc1-c1cccc2cnncc21 ZINC001243477998 985044964 /nfs/dbraw/zinc/04/49/64/985044964.db2.gz WFIMPRXGXUNWCR-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO CCc1[nH]c(CNC(=O)/C=C2\CC[C@H](C)C2)c[nH+]1 ZINC001456144752 985115254 /nfs/dbraw/zinc/11/52/54/985115254.db2.gz XPAVEMQICFXJHN-VUBLIPMDSA-N 1 2 247.342 2.335 20 0 BEADLO CCc1[nH]cc(CNC(=O)C=C2CC[C@H](C)C2)[nH+]1 ZINC001456144752 985115262 /nfs/dbraw/zinc/11/52/62/985115262.db2.gz XPAVEMQICFXJHN-VUBLIPMDSA-N 1 2 247.342 2.335 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2ccc(C)cc2F)[nH]1 ZINC000686505574 985124560 /nfs/dbraw/zinc/12/45/60/985124560.db2.gz DKIXUZJQEXNKBW-VIFPVBQESA-N 1 2 248.305 2.411 20 0 BEADLO CC=C(C)C(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001456346471 985133017 /nfs/dbraw/zinc/13/30/17/985133017.db2.gz SFNMCKONPFPAGN-WEVVVXLNSA-N 1 2 221.304 2.116 20 0 BEADLO C/C=C(\C)C(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001456346471 985133025 /nfs/dbraw/zinc/13/30/25/985133025.db2.gz SFNMCKONPFPAGN-WEVVVXLNSA-N 1 2 221.304 2.116 20 0 BEADLO CC=C(C)C(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001456346469 985134493 /nfs/dbraw/zinc/13/44/93/985134493.db2.gz SFNMCKONPFPAGN-UITAMQMPSA-N 1 2 221.304 2.116 20 0 BEADLO C/C=C(/C)C(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001456346469 985134499 /nfs/dbraw/zinc/13/44/99/985134499.db2.gz SFNMCKONPFPAGN-UITAMQMPSA-N 1 2 221.304 2.116 20 0 BEADLO Cc1cc(CO)cc(-c2ccc(N)[nH+]c2)c1 ZINC001243699137 985231409 /nfs/dbraw/zinc/23/14/09/985231409.db2.gz VQMSSGRGSXMUQN-UHFFFAOYSA-N 1 2 214.268 2.132 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1cccc(=O)[nH]1 ZINC001243738073 985280187 /nfs/dbraw/zinc/28/01/87/985280187.db2.gz MWYXHHDPFWZLNI-UHFFFAOYSA-N 1 2 229.283 2.224 20 0 BEADLO CCOc1ncc(-c2cc[nH+]c(N)c2)cc1F ZINC001243773159 985310474 /nfs/dbraw/zinc/31/04/74/985310474.db2.gz WDTMTTFTFYGNSL-UHFFFAOYSA-N 1 2 233.246 2.264 20 0 BEADLO CCOC(=O)C1([NH2+]C2C[C@@H](C)C[C@H](C)C2)CC1 ZINC001258152417 985471938 /nfs/dbraw/zinc/47/19/38/985471938.db2.gz WMJZLUGSNJFYJL-QWRGUYRKSA-N 1 2 239.359 2.496 20 0 BEADLO [NH3+]Cc1cccc(-c2cccc3nc[nH]c32)n1 ZINC001243928818 985598066 /nfs/dbraw/zinc/59/80/66/985598066.db2.gz HZHGNFKOCIBZHO-UHFFFAOYSA-N 1 2 224.267 2.084 20 0 BEADLO Fc1ccc2c(cnnc2C2=C[NH2+]CCC2)c1 ZINC001243947233 985622178 /nfs/dbraw/zinc/62/21/78/985622178.db2.gz FVRHBISDZUPLBZ-UHFFFAOYSA-N 1 2 229.258 2.493 20 0 BEADLO CCOC(=O)c1cc(C)nc(C2=C[NH2+]CCC2)c1 ZINC001243948274 985631694 /nfs/dbraw/zinc/63/16/94/985631694.db2.gz XVFSZUBCNIPPAV-UHFFFAOYSA-N 1 2 246.310 2.291 20 0 BEADLO CCCc1nccnc1C1=C[NH2+]CCC1 ZINC001243950296 985635017 /nfs/dbraw/zinc/63/50/17/985635017.db2.gz WVFYEZXFEGLCAA-UHFFFAOYSA-N 1 2 203.289 2.153 20 0 BEADLO c1nc(C2=C[NH2+]CCC2)cc(C2CCC2)n1 ZINC001243950287 985643411 /nfs/dbraw/zinc/64/34/11/985643411.db2.gz WLNKMPLIBKPPEK-UHFFFAOYSA-N 1 2 215.300 2.468 20 0 BEADLO CCOC(=O)CC[C@@H](C)[N@@H+]1Cc2cccnc2C1 ZINC001258489897 985953636 /nfs/dbraw/zinc/95/36/36/985953636.db2.gz UAWHHHWDRBHTIU-LLVKDONJSA-N 1 2 248.326 2.129 20 0 BEADLO CCOC(=O)CC[C@@H](C)[N@H+]1Cc2cccnc2C1 ZINC001258489897 985953650 /nfs/dbraw/zinc/95/36/50/985953650.db2.gz UAWHHHWDRBHTIU-LLVKDONJSA-N 1 2 248.326 2.129 20 0 BEADLO c1cc(C[NH2+]Cc2cc3cnccc3o2)no1 ZINC001461263684 986033773 /nfs/dbraw/zinc/03/37/73/986033773.db2.gz JWTYDXKPDHAYIR-UHFFFAOYSA-N 1 2 229.239 2.106 20 0 BEADLO COc1ccc(CNc2cc(CO)cc[nH+]2)cc1 ZINC001461593700 986090332 /nfs/dbraw/zinc/09/03/32/986090332.db2.gz JOXPTRZOCWPYDD-UHFFFAOYSA-N 1 2 244.294 2.195 20 0 BEADLO Cc1cc(CNc2cnn(CCF)c2)cc(C)[nH+]1 ZINC001461641518 986097698 /nfs/dbraw/zinc/09/76/98/986097698.db2.gz KFWWXYBPQCWTJJ-UHFFFAOYSA-N 1 2 248.305 2.477 20 0 BEADLO Cc1ccc(-c2ccc(N)[nH+]c2)c(CO)c1 ZINC001244490524 986124743 /nfs/dbraw/zinc/12/47/43/986124743.db2.gz NWTDEDMVKAPTET-UHFFFAOYSA-N 1 2 214.268 2.132 20 0 BEADLO Cc1cccc(OC(=O)C[NH2+]CC(C)C)c1C ZINC001579771926 986216210 /nfs/dbraw/zinc/21/62/10/986216210.db2.gz LQYCQHIVNIRDII-UHFFFAOYSA-N 1 2 235.327 2.454 20 0 BEADLO C[C@@H]1CCC[C@H]([N@@H+]2CC[C@H](O)C(F)(F)C2)C1 ZINC001258826337 986289036 /nfs/dbraw/zinc/28/90/36/986289036.db2.gz JBFJSJDGUQLRTR-VWYCJHECSA-N 1 2 233.302 2.267 20 0 BEADLO C[C@@H]1CCC[C@H]([N@H+]2CC[C@H](O)C(F)(F)C2)C1 ZINC001258826337 986289049 /nfs/dbraw/zinc/28/90/49/986289049.db2.gz JBFJSJDGUQLRTR-VWYCJHECSA-N 1 2 233.302 2.267 20 0 BEADLO Cc1cc(CN2CCCc3n[nH]cc32)cc(C)[nH+]1 ZINC001462164458 986301893 /nfs/dbraw/zinc/30/18/93/986301893.db2.gz QXFAWVROQGXLED-UHFFFAOYSA-N 1 2 242.326 2.374 20 0 BEADLO COC1(C)C[NH+](Cc2ccc3c(c2)C[C@@H](C)O3)C1 ZINC001462211151 986313995 /nfs/dbraw/zinc/31/39/95/986313995.db2.gz VMRDSAZRLZWJEY-LLVKDONJSA-N 1 2 247.338 2.231 20 0 BEADLO Fc1cccnc1C[N@@H+]1CC[C@H]2[C@@H](C1)C2(F)F ZINC001462333114 986356304 /nfs/dbraw/zinc/35/63/04/986356304.db2.gz NTCUAOAOUZNTPP-DTWKUNHWSA-N 1 2 242.244 2.308 20 0 BEADLO Fc1cccnc1C[N@H+]1CC[C@H]2[C@@H](C1)C2(F)F ZINC001462333114 986356307 /nfs/dbraw/zinc/35/63/07/986356307.db2.gz NTCUAOAOUZNTPP-DTWKUNHWSA-N 1 2 242.244 2.308 20 0 BEADLO CC(C)[C@H](O)C[N@@H+]1CCC[C@@H](F)C(F)(F)C1 ZINC001253757563 986383212 /nfs/dbraw/zinc/38/32/12/986383212.db2.gz PVUVGWXHQWEMQX-NXEZZACHSA-N 1 2 239.281 2.073 20 0 BEADLO CC(C)[C@H](O)C[N@H+]1CCC[C@@H](F)C(F)(F)C1 ZINC001253757563 986383221 /nfs/dbraw/zinc/38/32/21/986383221.db2.gz PVUVGWXHQWEMQX-NXEZZACHSA-N 1 2 239.281 2.073 20 0 BEADLO CNc1cc(-c2cccc(C(N)=O)c2C)cc[nH+]1 ZINC001244971138 986541211 /nfs/dbraw/zinc/54/12/11/986541211.db2.gz FHGNRHDLBDGQRW-UHFFFAOYSA-N 1 2 241.294 2.198 20 0 BEADLO CNc1cc(-c2ccc3ncnn3c2C)cc[nH+]1 ZINC001244972379 986547643 /nfs/dbraw/zinc/54/76/43/986547643.db2.gz FXITZXFOMBSQSZ-UHFFFAOYSA-N 1 2 239.282 2.141 20 0 BEADLO CNc1cc(-c2ccc(OC)cc2N)cc[nH+]1 ZINC001244976019 986562198 /nfs/dbraw/zinc/56/21/98/986562198.db2.gz NADYNOJUICUGCX-UHFFFAOYSA-N 1 2 229.283 2.381 20 0 BEADLO COC(=O)[C@H](CC(C)C)[N@@H+]1CCC[C@@H](F)C1 ZINC000689423637 986583289 /nfs/dbraw/zinc/58/32/89/986583289.db2.gz CUOFZGSRUGYFIZ-MNOVXSKESA-N 1 2 231.311 2.008 20 0 BEADLO COC(=O)[C@H](CC(C)C)[N@H+]1CCC[C@@H](F)C1 ZINC000689423637 986583304 /nfs/dbraw/zinc/58/33/04/986583304.db2.gz CUOFZGSRUGYFIZ-MNOVXSKESA-N 1 2 231.311 2.008 20 0 BEADLO O[C@@H](C[N@@H+]1CCC[C@@H](F)C1)c1ccccc1F ZINC000689439230 986608584 /nfs/dbraw/zinc/60/85/84/986608584.db2.gz XPUSHVBTTUEDIM-MFKMUULPSA-N 1 2 241.281 2.293 20 0 BEADLO O[C@@H](C[N@H+]1CCC[C@@H](F)C1)c1ccccc1F ZINC000689439230 986608600 /nfs/dbraw/zinc/60/86/00/986608600.db2.gz XPUSHVBTTUEDIM-MFKMUULPSA-N 1 2 241.281 2.293 20 0 BEADLO Cc1cc(C2=CCCOC2)c2[nH+]ccn2c1 ZINC001245159339 986698279 /nfs/dbraw/zinc/69/82/79/986698279.db2.gz WMDSAQGIGUAFNH-UHFFFAOYSA-N 1 2 214.268 2.446 20 0 BEADLO Cc1c(C[NH+]2CCSCC2)nc2ccccn21 ZINC001137268341 986707372 /nfs/dbraw/zinc/70/73/72/986707372.db2.gz TZYMOYOKHMCPRU-UHFFFAOYSA-N 1 2 247.367 2.192 20 0 BEADLO c1ccc2ncc(C[N@H+]3C[C@H]4C[C@@H](C3)O4)cc2c1 ZINC001137283071 986721695 /nfs/dbraw/zinc/72/16/95/986721695.db2.gz TVWIIUYQHCDVCX-OKILXGFUSA-N 1 2 240.306 2.208 20 0 BEADLO c1ccc2ncc(C[N@@H+]3C[C@H]4C[C@@H](C3)O4)cc2c1 ZINC001137283071 986721704 /nfs/dbraw/zinc/72/17/04/986721704.db2.gz TVWIIUYQHCDVCX-OKILXGFUSA-N 1 2 240.306 2.208 20 0 BEADLO CC(C)CNC(=S)Nc1ccn2cc[nH+]c2c1 ZINC001245213201 986733124 /nfs/dbraw/zinc/73/31/24/986733124.db2.gz ZDDIJVRMFVELRH-UHFFFAOYSA-N 1 2 248.355 2.277 20 0 BEADLO CN1C[C@@H]2C[C@H]1C[N@@H+]2Cc1cc2ccccc2[nH]1 ZINC001137319821 986760221 /nfs/dbraw/zinc/76/02/21/986760221.db2.gz PBPZHGFEWPOSIG-KBPBESRZSA-N 1 2 241.338 2.056 20 0 BEADLO CN1C[C@@H]2C[C@H]1C[N@H+]2Cc1cc2ccccc2[nH]1 ZINC001137319821 986760227 /nfs/dbraw/zinc/76/02/27/986760227.db2.gz PBPZHGFEWPOSIG-KBPBESRZSA-N 1 2 241.338 2.056 20 0 BEADLO Cc1cc(C)c(C[N@@H+](C)Cc2cnccn2)[nH]1 ZINC001137329877 986787210 /nfs/dbraw/zinc/78/72/10/986787210.db2.gz SWLQOCJYRNNSNZ-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1cc(C)c(C[N@H+](C)Cc2cnccn2)[nH]1 ZINC001137329877 986787221 /nfs/dbraw/zinc/78/72/21/986787221.db2.gz SWLQOCJYRNNSNZ-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO COC(=O)c1cc(OC)cc(/C(C)=C/C=C/[NH3+])c1 ZINC001245355274 986817759 /nfs/dbraw/zinc/81/77/59/986817759.db2.gz BOHCHNBIPHGPML-GQYICFGZSA-N 1 2 247.294 2.358 20 0 BEADLO Nc1[nH+]cccc1-c1cnn(CC(F)(F)F)c1 ZINC001245391019 986829521 /nfs/dbraw/zinc/82/95/21/986829521.db2.gz VHFVFUXDWRCYDJ-UHFFFAOYSA-N 1 2 242.204 2.090 20 0 BEADLO Nc1cn2ccc(-c3cc4cccnc4[nH]3)cc2[nH+]1 ZINC001245399516 986837958 /nfs/dbraw/zinc/83/79/58/986837958.db2.gz FYBZBTSJCLXTDO-UHFFFAOYSA-N 1 2 249.277 2.460 20 0 BEADLO Cn1cc(-c2ccc[nH+]c2N)c2ccncc21 ZINC001245489335 986867507 /nfs/dbraw/zinc/86/75/07/986867507.db2.gz KKJSFEDABYFRGW-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO COc1cc(-c2cc[nH+]c(N(C)C)c2)ccc1N ZINC001245502168 986883737 /nfs/dbraw/zinc/88/37/37/986883737.db2.gz LAWKGZFGETZCJZ-UHFFFAOYSA-N 1 2 243.310 2.405 20 0 BEADLO Nc1ncc(-c2ccn3cc[nH+]c3c2)cc1F ZINC001245518861 986898217 /nfs/dbraw/zinc/89/82/17/986898217.db2.gz BNPSGFBTEJUNFB-UHFFFAOYSA-N 1 2 228.230 2.118 20 0 BEADLO CCOc1ccnc(-c2c[nH+]c(N)c(C)c2)c1 ZINC001245535292 986909539 /nfs/dbraw/zinc/90/95/39/986909539.db2.gz HUINMIZPUOGTJB-UHFFFAOYSA-N 1 2 229.283 2.433 20 0 BEADLO Cc1cc(-c2c[nH+]c(N)c(C)c2)cc(F)n1 ZINC001245536386 986912381 /nfs/dbraw/zinc/91/23/81/986912381.db2.gz JMVDQIIEEJZYIF-UHFFFAOYSA-N 1 2 217.247 2.482 20 0 BEADLO CSc1nccc(-c2c[nH+]c(N)c(C)c2)n1 ZINC001245536234 986912733 /nfs/dbraw/zinc/91/27/33/986912733.db2.gz NFGVSAIDQKVKNP-UHFFFAOYSA-N 1 2 232.312 2.151 20 0 BEADLO COc1cc(-c2c[nH+]c(N)c(C)c2)cnc1C ZINC001245536759 986915524 /nfs/dbraw/zinc/91/55/24/986915524.db2.gz LWCOZLPLSOPYEW-UHFFFAOYSA-N 1 2 229.283 2.351 20 0 BEADLO Cc1cc(-c2ccc3c(n2)COC3)c[nH+]c1N ZINC001245538298 986920452 /nfs/dbraw/zinc/92/04/52/986920452.db2.gz MAMOYIAXKRJLOJ-UHFFFAOYSA-N 1 2 227.267 2.064 20 0 BEADLO Cc1cc(-c2cc3nc[nH]c3nc2C)c[nH+]c1N ZINC001245537931 986921636 /nfs/dbraw/zinc/92/16/36/986921636.db2.gz HTRFIIHYHIFCPB-UHFFFAOYSA-N 1 2 239.282 2.219 20 0 BEADLO CCc1nc(C)cc(-c2c[nH+]c(N)c(C)c2)n1 ZINC001245537267 986922596 /nfs/dbraw/zinc/92/25/96/986922596.db2.gz HVEJIJCYHXSYGB-UHFFFAOYSA-N 1 2 228.299 2.300 20 0 BEADLO c1cn2c(cccc2-c2ccc3nncn3c2)[nH+]1 ZINC001245659021 987046919 /nfs/dbraw/zinc/04/69/19/987046919.db2.gz CJCGWBZFDSXCBB-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO Cc1cc(-c2c[nH+]cn2C)c(C)cc1CO ZINC001245698461 987067855 /nfs/dbraw/zinc/06/78/55/987067855.db2.gz CUBHJJSZPFOKEC-UHFFFAOYSA-N 1 2 216.284 2.196 20 0 BEADLO C/C(=C\C=C\[NH3+])c1c(F)ccc(CO)c1F ZINC001245852781 987094626 /nfs/dbraw/zinc/09/46/26/987094626.db2.gz ZXHZXOJSOPJIDQ-YALUOGEHSA-N 1 2 225.238 2.333 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@H]2CCCC2(C)C)c[nH+]1 ZINC001472021444 987163466 /nfs/dbraw/zinc/16/34/66/987163466.db2.gz WJPVQBAKRKRFKG-LLVKDONJSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@H]2CCCC2(C)C)[nH+]1 ZINC001472021444 987163478 /nfs/dbraw/zinc/16/34/78/987163478.db2.gz WJPVQBAKRKRFKG-LLVKDONJSA-N 1 2 249.358 2.415 20 0 BEADLO CCOC(=O)C1([NH2+][C@H](C)CCC(C)C)CC1 ZINC001256353695 987175519 /nfs/dbraw/zinc/17/55/19/987175519.db2.gz YIIOFBAERHXXSG-LLVKDONJSA-N 1 2 227.348 2.496 20 0 BEADLO Cn1cc[nH+]c1Cn1[nH]c(C2CCCC2)cc1=O ZINC001245928263 987185083 /nfs/dbraw/zinc/18/50/83/987185083.db2.gz DVWSFDCRBHBHHJ-UHFFFAOYSA-N 1 2 246.314 2.028 20 0 BEADLO CCn1ccnc1SCc1ccc[nH+]c1N ZINC000689763496 987205605 /nfs/dbraw/zinc/20/56/05/987205605.db2.gz HVFWVKNAWIDVOL-UHFFFAOYSA-N 1 2 234.328 2.173 20 0 BEADLO C[C@@H]1C[C@@H]1C1=NNC(=c2ccnc3c2=CC=[NH+]3)O1 ZINC001256688989 987266184 /nfs/dbraw/zinc/26/61/84/987266184.db2.gz BWFUMCMSVWBRKV-QNSHHTMESA-N 1 2 240.266 2.213 20 0 BEADLO CS[C@H]1CC[C@H](Nc2cc[nH+]cc2F)C1 ZINC000699602464 987378224 /nfs/dbraw/zinc/37/82/24/987378224.db2.gz VLHLAHFQDNZGAW-IUCAKERBSA-N 1 2 226.320 2.339 20 0 BEADLO Cc1cccc(N(C)C(=O)[C@H](C)n2cc[nH+]c2)c1 ZINC001115960592 987420708 /nfs/dbraw/zinc/42/07/08/987420708.db2.gz XBVLZPDZKRPNTJ-LBPRGKRZSA-N 1 2 243.310 2.416 20 0 BEADLO Cc1cccc(C[NH2+][C@H](CCO)c2ccco2)n1 ZINC001473412900 987429742 /nfs/dbraw/zinc/42/97/42/987429742.db2.gz QKUDSMPWMNJISN-CYBMUJFWSA-N 1 2 246.310 2.196 20 0 BEADLO C[C@@H](C(=O)N1C[C@H](C)CCC[C@H]1C)n1cc[nH+]c1 ZINC001116120529 987448285 /nfs/dbraw/zinc/44/82/85/987448285.db2.gz FOEXMVYFVKNCBS-UPJWGTAASA-N 1 2 249.358 2.481 20 0 BEADLO C[C@@H](C(=O)N1C[C@@H]2CCCC[C@@H]2C1)n1cc[nH+]c1 ZINC001116210854 987478824 /nfs/dbraw/zinc/47/88/24/987478824.db2.gz QWRBOMLOFGMBEI-RWMBFGLXSA-N 1 2 247.342 2.093 20 0 BEADLO CSCC[C@@H](C)[N@H+](C)Cc1cc(C)[nH]n1 ZINC001116445228 987576109 /nfs/dbraw/zinc/57/61/09/987576109.db2.gz IQARCOOVQMFDLT-SNVBAGLBSA-N 1 2 227.377 2.292 20 0 BEADLO CSCC[C@@H](C)[N@@H+](C)Cc1cc(C)[nH]n1 ZINC001116445228 987576131 /nfs/dbraw/zinc/57/61/31/987576131.db2.gz IQARCOOVQMFDLT-SNVBAGLBSA-N 1 2 227.377 2.292 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1C(=O)[C@H](C)n1cc[nH+]c1 ZINC001116464206 987590436 /nfs/dbraw/zinc/59/04/36/987590436.db2.gz TYLPUJOIPHAJJM-SDDRHHMPSA-N 1 2 235.331 2.234 20 0 BEADLO C[C@@H]1CC[C@H](N[C@H]2C[NH2+]CC[C@H]2F)C[C@@H]1C ZINC001246218274 987617510 /nfs/dbraw/zinc/61/75/10/987617510.db2.gz RUKUIMGTZSITBT-SJHCENCUSA-N 1 2 228.355 2.101 20 0 BEADLO C[C@@H]1CC[C@H]([NH2+][C@H]2CNCC[C@H]2F)C[C@@H]1C ZINC001246218274 987617519 /nfs/dbraw/zinc/61/75/19/987617519.db2.gz RUKUIMGTZSITBT-SJHCENCUSA-N 1 2 228.355 2.101 20 0 BEADLO CCc1ncc(C[NH2+][C@@H]2CCn3ccnc32)s1 ZINC001474155669 987649544 /nfs/dbraw/zinc/64/95/44/987649544.db2.gz NBFBZPJZNQHXKB-SNVBAGLBSA-N 1 2 248.355 2.137 20 0 BEADLO CC(C)[C@H]1CCCN(C(=O)[C@@H](C)n2cc[nH+]c2)C1 ZINC001116695873 987673942 /nfs/dbraw/zinc/67/39/42/987673942.db2.gz YLYRMSWFWJRHMK-OLZOCXBDSA-N 1 2 249.358 2.339 20 0 BEADLO CSc1ccc(C[NH2+]Cc2cnccn2)o1 ZINC001474297698 987677922 /nfs/dbraw/zinc/67/79/22/987677922.db2.gz DVWCEMCUWALEGF-UHFFFAOYSA-N 1 2 235.312 2.081 20 0 BEADLO C[C@@H](O)c1ncc(C[NH+]2CC3(CCC3)C2)s1 ZINC001474569039 987761046 /nfs/dbraw/zinc/76/10/46/987761046.db2.gz URPNEHLUTYLWTR-SECBINFHSA-N 1 2 238.356 2.182 20 0 BEADLO C[NH+](C)Cc1nnc(/C=C/C(C)(C)C)o1 ZINC001117228854 987795811 /nfs/dbraw/zinc/79/58/11/987795811.db2.gz GSSZVLJRFMFCJP-VOTSOKGWSA-N 1 2 209.293 2.191 20 0 BEADLO Cc1ccc(Cl)c(N2CCn3c[nH+]cc3C2)n1 ZINC001117689295 987864259 /nfs/dbraw/zinc/86/42/59/987864259.db2.gz RVBKTUANJBYDJC-UHFFFAOYSA-N 1 2 248.717 2.260 20 0 BEADLO CN(C)c1cc(CS[C@H]2CCOC2)cc[nH+]1 ZINC001118037645 987995654 /nfs/dbraw/zinc/99/56/54/987995654.db2.gz IUXSLGPOKACNCG-NSHDSACASA-N 1 2 238.356 2.170 20 0 BEADLO CC[C@@H]1CCC[C@H]1c1nnc(C[NH+](C)C)o1 ZINC001118371894 988272992 /nfs/dbraw/zinc/27/29/92/988272992.db2.gz JCKXVZNAWGANLC-NXEZZACHSA-N 1 2 223.320 2.425 20 0 BEADLO Cc1ccc(NC(=O)[C@@H](C)n2cc[nH+]c2)c(C)n1 ZINC001322472301 988287999 /nfs/dbraw/zinc/28/79/99/988287999.db2.gz WJRYQMOEEMPSIA-LLVKDONJSA-N 1 2 244.298 2.095 20 0 BEADLO CC(C)C[C@H](C)Cc1nnc(C[NH+](C)C)o1 ZINC001322583848 988335835 /nfs/dbraw/zinc/33/58/35/988335835.db2.gz WNEHCRSRANDVKM-JTQLQIEISA-N 1 2 225.336 2.356 20 0 BEADLO C[NH+](C)Cc1nnc([C@H]2C[C@H]2C2CCCC2)o1 ZINC001118432853 988345893 /nfs/dbraw/zinc/34/58/93/988345893.db2.gz MPGHTEXCYLDILW-QWRGUYRKSA-N 1 2 235.331 2.425 20 0 BEADLO C[NH+](C)Cc1nnc([C@@H]2C[C@@H]2C2CCCC2)o1 ZINC001118432847 988346577 /nfs/dbraw/zinc/34/65/77/988346577.db2.gz MPGHTEXCYLDILW-GHMZBOCLSA-N 1 2 235.331 2.425 20 0 BEADLO C[C@@H]1CCCC[C@H]1c1nnc(C[NH+](C)C)o1 ZINC001118433567 988347014 /nfs/dbraw/zinc/34/70/14/988347014.db2.gz VWYHBWWKJFTSGA-NXEZZACHSA-N 1 2 223.320 2.425 20 0 BEADLO C[C@@H]1CCC[C@]1(C)c1nnc(C[NH+](C)C)o1 ZINC001118432795 988348643 /nfs/dbraw/zinc/34/86/43/988348643.db2.gz LRMCYIBLOXIDRX-SKDRFNHKSA-N 1 2 223.320 2.209 20 0 BEADLO CC(C)CC[C@H]1CCC[N@@H+]1Cc1nnc[nH]1 ZINC001118495846 988384424 /nfs/dbraw/zinc/38/44/24/988384424.db2.gz DXOGYBJQZGCGNR-LLVKDONJSA-N 1 2 222.336 2.205 20 0 BEADLO CC(C)CC[C@H]1CCC[N@H+]1Cc1nnc[nH]1 ZINC001118495846 988384439 /nfs/dbraw/zinc/38/44/39/988384439.db2.gz DXOGYBJQZGCGNR-LLVKDONJSA-N 1 2 222.336 2.205 20 0 BEADLO C[NH+](C)Cc1nnc(CC(C2CC2)C2CC2)o1 ZINC001322983790 988424364 /nfs/dbraw/zinc/42/43/64/988424364.db2.gz PZHDRQBZDYOCAH-UHFFFAOYSA-N 1 2 235.331 2.110 20 0 BEADLO Cc1cc(NC(=O)[C@H](C)C(F)(F)F)cc(C)[nH+]1 ZINC001323080546 988445471 /nfs/dbraw/zinc/44/54/71/988445471.db2.gz VBTGPSJPQNTZKU-QMMMGPOBSA-N 1 2 246.232 2.257 20 0 BEADLO Cc1cc(C[N@@H+]2CC(C)(C)OCC2(C)C)[nH]n1 ZINC001323311776 988495064 /nfs/dbraw/zinc/49/50/64/988495064.db2.gz UPFSVKADWFVVNH-UHFFFAOYSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1cc(C[N@H+]2CC(C)(C)OCC2(C)C)[nH]n1 ZINC001323311776 988495074 /nfs/dbraw/zinc/49/50/74/988495074.db2.gz UPFSVKADWFVVNH-UHFFFAOYSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H](C)C(=O)N(C)C1C[NH+](CC=C(C)C)C1 ZINC001323887910 988647134 /nfs/dbraw/zinc/64/71/34/988647134.db2.gz XUDZSJVAGLIAOX-GFCCVEGCSA-N 1 2 238.375 2.141 20 0 BEADLO CC(C)(C)c1cn(Cc2ncccn2)c[nH+]1 ZINC001118986910 988773915 /nfs/dbraw/zinc/77/39/15/988773915.db2.gz OKUZOXYLAZIAEB-UHFFFAOYSA-N 1 2 216.288 2.019 20 0 BEADLO CO[C@@H]1C[C@@H]([N@H+](C)Cc2cc(C)[nH]n2)C12CCC2 ZINC001324439370 988843253 /nfs/dbraw/zinc/84/32/53/988843253.db2.gz VWSAHNBHPDYWKE-CHWSQXEVSA-N 1 2 249.358 2.108 20 0 BEADLO CO[C@@H]1C[C@@H]([N@@H+](C)Cc2cc(C)[nH]n2)C12CCC2 ZINC001324439370 988843258 /nfs/dbraw/zinc/84/32/58/988843258.db2.gz VWSAHNBHPDYWKE-CHWSQXEVSA-N 1 2 249.358 2.108 20 0 BEADLO CO[C@H]1C[C@H]([N@H+](C)Cc2cc(C)[nH]n2)C12CCC2 ZINC001324439373 988844203 /nfs/dbraw/zinc/84/42/03/988844203.db2.gz VWSAHNBHPDYWKE-STQMWFEESA-N 1 2 249.358 2.108 20 0 BEADLO CO[C@H]1C[C@H]([N@@H+](C)Cc2cc(C)[nH]n2)C12CCC2 ZINC001324439373 988844219 /nfs/dbraw/zinc/84/42/19/988844219.db2.gz VWSAHNBHPDYWKE-STQMWFEESA-N 1 2 249.358 2.108 20 0 BEADLO CCn1c(CCCO)[nH+]c2ccc(F)c(F)c21 ZINC001247042475 988847895 /nfs/dbraw/zinc/84/78/95/988847895.db2.gz YAYOKYMGEAGFKA-UHFFFAOYSA-N 1 2 240.253 2.259 20 0 BEADLO CC(C)C[C@@H]1CCN(C(=O)[C@@H](C)n2cc[nH+]c2)C1 ZINC001324675552 988926232 /nfs/dbraw/zinc/92/62/32/988926232.db2.gz AIEGKEOVTAVYNL-OLZOCXBDSA-N 1 2 249.358 2.339 20 0 BEADLO CC(C)n1ncnc1C[N@@H+]1CC(C)(C)C1(C)C ZINC001324877852 989012046 /nfs/dbraw/zinc/01/20/46/989012046.db2.gz RVSZCFSFNVIWGJ-UHFFFAOYSA-N 1 2 236.363 2.479 20 0 BEADLO CC(C)n1ncnc1C[N@H+]1CC(C)(C)C1(C)C ZINC001324877852 989012058 /nfs/dbraw/zinc/01/20/58/989012058.db2.gz RVSZCFSFNVIWGJ-UHFFFAOYSA-N 1 2 236.363 2.479 20 0 BEADLO FC[C@@H]1CCC[N@H+](Cn2cc(Cl)cn2)C1 ZINC001119387529 989026123 /nfs/dbraw/zinc/02/61/23/989026123.db2.gz AJYWAZJENRNIFS-VIFPVBQESA-N 1 2 231.702 2.176 20 0 BEADLO FC[C@@H]1CCC[N@@H+](Cn2cc(Cl)cn2)C1 ZINC001119387529 989026133 /nfs/dbraw/zinc/02/61/33/989026133.db2.gz AJYWAZJENRNIFS-VIFPVBQESA-N 1 2 231.702 2.176 20 0 BEADLO Cc1cc(NC(=S)NCC(C)(C)C)cc[nH+]1 ZINC001247930881 989036128 /nfs/dbraw/zinc/03/61/28/989036128.db2.gz IADHRSUIUKOQRQ-UHFFFAOYSA-N 1 2 237.372 2.144 20 0 BEADLO CCc1ccc(N2CCC[C@@H]2C[C@H](C)O)[nH+]c1 ZINC001515582725 989070219 /nfs/dbraw/zinc/07/02/19/989070219.db2.gz SXDALFBAPVACBN-WCQYABFASA-N 1 2 234.343 2.384 20 0 BEADLO CCc1ccc(N2CCC(OC(C)=O)CC2)[nH+]c1 ZINC001515581159 989070392 /nfs/dbraw/zinc/07/03/92/989070392.db2.gz JLLVMIMYVVOTAI-UHFFFAOYSA-N 1 2 248.326 2.176 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@H]2C(C)(C)O)[nH+]1 ZINC001515595949 989076632 /nfs/dbraw/zinc/07/66/32/989076632.db2.gz STNVVCIKBRKCFY-NSHDSACASA-N 1 2 238.306 2.269 20 0 BEADLO CCOCCN(C)c1ccc(CC)c[nH+]1 ZINC001515607611 989077244 /nfs/dbraw/zinc/07/72/44/989077244.db2.gz VFGDNSGDIMZRNE-UHFFFAOYSA-N 1 2 208.305 2.117 20 0 BEADLO Cc1noc2ccc(C[N@@H+]3C[C@@H]4C[C@H]3CO4)cc12 ZINC001248705474 989132874 /nfs/dbraw/zinc/13/28/74/989132874.db2.gz BHMWKSOYRJBIOQ-RYUDHWBXSA-N 1 2 244.294 2.109 20 0 BEADLO Cc1noc2ccc(C[N@H+]3C[C@@H]4C[C@H]3CO4)cc12 ZINC001248705474 989132880 /nfs/dbraw/zinc/13/28/80/989132880.db2.gz BHMWKSOYRJBIOQ-RYUDHWBXSA-N 1 2 244.294 2.109 20 0 BEADLO C[C@H](C(=O)NCC(C)(C)C1CCC1)n1cc[nH+]c1 ZINC001325292310 989146674 /nfs/dbraw/zinc/14/66/74/989146674.db2.gz MMTNUCAEHOOVAY-LLVKDONJSA-N 1 2 249.358 2.387 20 0 BEADLO Cc1nc(NC2([C@@H]3CCCO3)CCC2)cc[nH+]1 ZINC001516470331 989154961 /nfs/dbraw/zinc/15/49/61/989154961.db2.gz IMGHLQPEMJDXLV-NSHDSACASA-N 1 2 233.315 2.299 20 0 BEADLO Cc1ccc2[nH]c(C[N@@H+](C)[C@H]3CCOC3)nc2c1 ZINC001248842191 989190516 /nfs/dbraw/zinc/19/05/16/989190516.db2.gz JXQYLBXVZJBGAQ-NSHDSACASA-N 1 2 245.326 2.092 20 0 BEADLO Cc1ccc2[nH]c(C[N@H+](C)[C@H]3CCOC3)nc2c1 ZINC001248842191 989190524 /nfs/dbraw/zinc/19/05/24/989190524.db2.gz JXQYLBXVZJBGAQ-NSHDSACASA-N 1 2 245.326 2.092 20 0 BEADLO Cc1ccc2nc(C[N@@H+](C)[C@H]3CCOC3)[nH]c2c1 ZINC001248842191 989190530 /nfs/dbraw/zinc/19/05/30/989190530.db2.gz JXQYLBXVZJBGAQ-NSHDSACASA-N 1 2 245.326 2.092 20 0 BEADLO Cc1ccc2nc(C[N@H+](C)[C@H]3CCOC3)[nH]c2c1 ZINC001248842191 989190537 /nfs/dbraw/zinc/19/05/37/989190537.db2.gz JXQYLBXVZJBGAQ-NSHDSACASA-N 1 2 245.326 2.092 20 0 BEADLO CC(C)c1ocnc1C[N@@H+]1CC[C@@]12CCOC2 ZINC001325759508 989251411 /nfs/dbraw/zinc/25/14/11/989251411.db2.gz CUZGUWFIJLUUDZ-ZDUSSCGKSA-N 1 2 236.315 2.163 20 0 BEADLO CC(C)c1ocnc1C[N@H+]1CC[C@@]12CCOC2 ZINC001325759508 989251422 /nfs/dbraw/zinc/25/14/22/989251422.db2.gz CUZGUWFIJLUUDZ-ZDUSSCGKSA-N 1 2 236.315 2.163 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@H]1CC[C@@H](C)C1 ZINC001518049739 989272108 /nfs/dbraw/zinc/27/21/08/989272108.db2.gz XFBHOOKGPKPGSZ-MNOVXSKESA-N 1 2 236.315 2.382 20 0 BEADLO CCn1c[nH+]cc1COC(=O)c1cccs1 ZINC001518047953 989276614 /nfs/dbraw/zinc/27/66/14/989276614.db2.gz KOYOGIZLAKAJLN-UHFFFAOYSA-N 1 2 236.296 2.322 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H](C)C(C)(F)F ZINC001518365157 989297879 /nfs/dbraw/zinc/29/78/79/989297879.db2.gz KBNQNTAIWCQBOZ-VIFPVBQESA-N 1 2 242.269 2.350 20 0 BEADLO Cc1cc(C[N@@H+]2CCCO[C@@H](C)C2)ns1 ZINC001249571039 989311489 /nfs/dbraw/zinc/31/14/89/989311489.db2.gz JBRGDUBOHOXXNN-VIFPVBQESA-N 1 2 226.345 2.062 20 0 BEADLO Cc1cc(C[N@H+]2CCCO[C@@H](C)C2)ns1 ZINC001249571039 989311500 /nfs/dbraw/zinc/31/15/00/989311500.db2.gz JBRGDUBOHOXXNN-VIFPVBQESA-N 1 2 226.345 2.062 20 0 BEADLO COC(=O)c1cc(F)ccc1C[N@@H+]1CC[C@H]1C ZINC001249600542 989323140 /nfs/dbraw/zinc/32/31/40/989323140.db2.gz PPSQCVYSQCZHMY-SECBINFHSA-N 1 2 237.274 2.207 20 0 BEADLO COC(=O)c1cc(F)ccc1C[N@H+]1CC[C@H]1C ZINC001249600542 989323142 /nfs/dbraw/zinc/32/31/42/989323142.db2.gz PPSQCVYSQCZHMY-SECBINFHSA-N 1 2 237.274 2.207 20 0 BEADLO CSCC[N@H+](C)Cc1cc(C)sn1 ZINC001249592675 989323417 /nfs/dbraw/zinc/32/34/17/989323417.db2.gz PVJNQOIPGFDIBV-UHFFFAOYSA-N 1 2 216.375 2.246 20 0 BEADLO CSCC[N@@H+](C)Cc1cc(C)sn1 ZINC001249592675 989323436 /nfs/dbraw/zinc/32/34/36/989323436.db2.gz PVJNQOIPGFDIBV-UHFFFAOYSA-N 1 2 216.375 2.246 20 0 BEADLO CCn1ccc(CN(C)Cc2[nH]c(C)[nH+]c2C)c1 ZINC001119767145 989383290 /nfs/dbraw/zinc/38/32/90/989383290.db2.gz OOJBBQRSGJXKCM-UHFFFAOYSA-N 1 2 246.358 2.480 20 0 BEADLO CC(C)(COC(=O)c1ccco1)n1cc[nH+]c1 ZINC001519583538 989436643 /nfs/dbraw/zinc/43/66/43/989436643.db2.gz IOCHNJDEBCWABN-UHFFFAOYSA-N 1 2 234.255 2.068 20 0 BEADLO C[C@@H](CC(=O)N1CC(C)(C)C1(C)C)n1cc[nH+]c1 ZINC001326451323 989563879 /nfs/dbraw/zinc/56/38/79/989563879.db2.gz BNCUPPISYKBYJL-NSHDSACASA-N 1 2 249.358 2.481 20 0 BEADLO C[C@@H](CNc1cc(N(C)C)nc[nH+]1)C1CC1 ZINC001120018502 989568429 /nfs/dbraw/zinc/56/84/29/989568429.db2.gz SVYRRTSXRNUDOY-VIFPVBQESA-N 1 2 220.320 2.001 20 0 BEADLO C[C@@H](CNc1cc(N(C)C)[nH+]cn1)C1CC1 ZINC001120018502 989568435 /nfs/dbraw/zinc/56/84/35/989568435.db2.gz SVYRRTSXRNUDOY-VIFPVBQESA-N 1 2 220.320 2.001 20 0 BEADLO Fc1cnccc1-c1c[nH+]c2n1CCCC2 ZINC001120243985 989613175 /nfs/dbraw/zinc/61/31/75/989613175.db2.gz KRSUNOCEGFSWPD-UHFFFAOYSA-N 1 2 217.247 2.421 20 0 BEADLO C[C@@H](NC(=O)[C@H](C)n1cc[nH+]c1)C1CCCC1 ZINC001326731612 989665738 /nfs/dbraw/zinc/66/57/38/989665738.db2.gz ZOWQKPRQMJHPBK-MNOVXSKESA-N 1 2 235.331 2.139 20 0 BEADLO C[C@@H](c1ccccc1)[C@H](O)C[NH2+]CC(F)F ZINC001120583878 989755524 /nfs/dbraw/zinc/75/55/24/989755524.db2.gz ZSKTURGXNCXXNY-GXSJLCMTSA-N 1 2 229.270 2.006 20 0 BEADLO C[NH+](C)Cc1nnc([C@@H]2CC[C@H]3C[C@H]3C2)o1 ZINC001326987026 989801361 /nfs/dbraw/zinc/80/13/61/989801361.db2.gz GBSYXDQMWLJKLJ-AEJSXWLSSA-N 1 2 221.304 2.035 20 0 BEADLO CCC[C@@H]1CCCN1C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC001120712757 989842577 /nfs/dbraw/zinc/84/25/77/989842577.db2.gz SUESBZDIXOHWNV-DGCLKSJQSA-N 1 2 249.358 2.379 20 0 BEADLO CCC[C@@H]1CCCN1C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC001120712757 989842578 /nfs/dbraw/zinc/84/25/78/989842578.db2.gz SUESBZDIXOHWNV-DGCLKSJQSA-N 1 2 249.358 2.379 20 0 BEADLO CCc1ccc(N2CC[C@H]3C[C@H]3C2)[nH+]c1 ZINC001120863482 989933539 /nfs/dbraw/zinc/93/35/39/989933539.db2.gz ZTXVZFFDMVURMA-RYUDHWBXSA-N 1 2 202.301 2.490 20 0 BEADLO FC(F)CCNc1cc(NC2CC2)nc[nH+]1 ZINC001120922181 989968550 /nfs/dbraw/zinc/96/85/50/989968550.db2.gz JDQQBNRGHAJOCC-UHFFFAOYSA-N 1 2 228.246 2.118 20 0 BEADLO FC(F)CCNc1cc(NC2CC2)[nH+]cn1 ZINC001120922181 989968557 /nfs/dbraw/zinc/96/85/57/989968557.db2.gz JDQQBNRGHAJOCC-UHFFFAOYSA-N 1 2 228.246 2.118 20 0 BEADLO CO[C@@H]1CC[C@@H]1N(C)c1cc(F)cc(C)[nH+]1 ZINC001120965216 989991920 /nfs/dbraw/zinc/99/19/20/989991920.db2.gz FMBDFJQIWAVRAU-WDEREUQCSA-N 1 2 224.279 2.143 20 0 BEADLO CC[C@H](C)C(=O)Nc1c(C)c[nH+]cc1C ZINC001121141125 990023974 /nfs/dbraw/zinc/02/39/74/990023974.db2.gz YRXBGXNDSIYJON-QMMMGPOBSA-N 1 2 206.289 2.105 20 0 BEADLO CC[C@@H](SC)C(=O)Nc1c(C)c[nH+]cc1C ZINC001121232107 990039184 /nfs/dbraw/zinc/03/91/84/990039184.db2.gz VGGYYKQVBKLKPU-SNVBAGLBSA-N 1 2 238.356 2.200 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C ZINC001121231226 990053925 /nfs/dbraw/zinc/05/39/25/990053925.db2.gz JOGLEDQJZREQOA-HWNAMQAFSA-N 1 2 244.338 2.351 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@H]1C[C@@H]1C(C)C ZINC001527012039 990199461 /nfs/dbraw/zinc/19/94/61/990199461.db2.gz OXEKPFJLKMYJDT-NEPJUHHUSA-N 1 2 236.315 2.238 20 0 BEADLO CCn1c[nH+]cc1COC(=O)CCC1CC1 ZINC001527012572 990201015 /nfs/dbraw/zinc/20/10/15/990201015.db2.gz UQUNGSPIFXVJMS-UHFFFAOYSA-N 1 2 222.288 2.136 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)c1ccsn1 ZINC001539935731 990586399 /nfs/dbraw/zinc/58/63/99/990586399.db2.gz RQSSFDLJUFUHJW-UHFFFAOYSA-N 1 2 244.279 2.043 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C ZINC001123472531 990588753 /nfs/dbraw/zinc/58/87/53/990588753.db2.gz IBPMABYUNRZXQP-FTYKPCCVSA-N 1 2 248.326 2.238 20 0 BEADLO CCn1c[nH+]cc1COC(=O)C[C@H]1C=CCC1 ZINC001123469878 990591123 /nfs/dbraw/zinc/59/11/23/990591123.db2.gz OJGLKYFBSMBLKY-NSHDSACASA-N 1 2 234.299 2.303 20 0 BEADLO O=C(CCF)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001542442402 990664263 /nfs/dbraw/zinc/66/42/63/990664263.db2.gz VDRFULNDOIVGPA-UHFFFAOYSA-N 1 2 233.246 2.375 20 0 BEADLO C[C@@H]1C[C@H](C)CN1C(=O)c1cccc2[nH+]ccn21 ZINC001544455993 990725622 /nfs/dbraw/zinc/72/56/22/990725622.db2.gz LQNSRYWCOHKLSK-WDEREUQCSA-N 1 2 243.310 2.205 20 0 BEADLO CC[C@@H]1CCN(C(=O)[C@@H](C)n2cc[nH+]c2)[C@H]1C ZINC001556273594 990816308 /nfs/dbraw/zinc/81/63/08/990816308.db2.gz ULTBDIHHELGIPX-QJPTWQEYSA-N 1 2 235.331 2.091 20 0 BEADLO C[C@@H]1C[C@H](O)C[N@@H+]1Cc1cc(F)cc(F)c1F ZINC001137869003 990862848 /nfs/dbraw/zinc/86/28/48/990862848.db2.gz YTOFSXZVRAVIJX-XCBNKYQSSA-N 1 2 245.244 2.059 20 0 BEADLO C[C@@H]1C[C@H](O)C[N@H+]1Cc1cc(F)cc(F)c1F ZINC001137869003 990862849 /nfs/dbraw/zinc/86/28/49/990862849.db2.gz YTOFSXZVRAVIJX-XCBNKYQSSA-N 1 2 245.244 2.059 20 0 BEADLO Cc1cccc(F)c1NC(=O)CCn1cc[nH+]c1 ZINC001137877439 990864902 /nfs/dbraw/zinc/86/49/02/990864902.db2.gz PLROSZGYKVAUPQ-UHFFFAOYSA-N 1 2 247.273 2.359 20 0 BEADLO Oc1cc(O)cc(C[N@@H+]2CCCC[C@@H](F)C2)c1 ZINC001138324628 990917444 /nfs/dbraw/zinc/91/74/44/990917444.db2.gz TUAGPXFHZOITHI-LLVKDONJSA-N 1 2 239.290 2.422 20 0 BEADLO Oc1cc(O)cc(C[N@H+]2CCCC[C@@H](F)C2)c1 ZINC001138324628 990917446 /nfs/dbraw/zinc/91/74/46/990917446.db2.gz TUAGPXFHZOITHI-LLVKDONJSA-N 1 2 239.290 2.422 20 0 BEADLO Cc1c2ccccc2[nH]c1C[NH+]1CC(C)(O)C1 ZINC001138396739 990938436 /nfs/dbraw/zinc/93/84/36/990938436.db2.gz DQTYNIQQCYCNLT-UHFFFAOYSA-N 1 2 230.311 2.043 20 0 BEADLO Cc1c2cc(F)ccc2[nH]c1C[NH+]1CC(C)(O)C1 ZINC001138410071 990941460 /nfs/dbraw/zinc/94/14/60/990941460.db2.gz RMUPHLHLYHTEQT-UHFFFAOYSA-N 1 2 248.301 2.182 20 0 BEADLO COc1c(F)cc(C[NH+]2CC(C)C2)cc1F ZINC001138421666 990944652 /nfs/dbraw/zinc/94/46/52/990944652.db2.gz SXSFJKKYUSTTDV-UHFFFAOYSA-N 1 2 227.254 2.425 20 0 BEADLO Cc1ccc2[nH]c(C[N@H+]3C[C@H]4C[C@@H](C3)O4)cc2c1 ZINC001138420114 990945801 /nfs/dbraw/zinc/94/58/01/990945801.db2.gz OLNHLFDUXVFONX-OKILXGFUSA-N 1 2 242.322 2.449 20 0 BEADLO Cc1ccc2[nH]c(C[N@@H+]3C[C@H]4C[C@@H](C3)O4)cc2c1 ZINC001138420114 990945810 /nfs/dbraw/zinc/94/58/10/990945810.db2.gz OLNHLFDUXVFONX-OKILXGFUSA-N 1 2 242.322 2.449 20 0 BEADLO CC(C)=C(C)C(=O)NCc1[nH]c2c([nH+]1)CCCC2 ZINC001558537645 990964463 /nfs/dbraw/zinc/96/44/63/990964463.db2.gz PWABHHHMCWZGFZ-UHFFFAOYSA-N 1 2 247.342 2.261 20 0 BEADLO CCCn1c[nH+]cc1CNC(C)(C)C(F)F ZINC001308391647 990977504 /nfs/dbraw/zinc/97/75/04/990977504.db2.gz WKOFHGJYDYBKCC-UHFFFAOYSA-N 1 2 231.290 2.426 20 0 BEADLO Cc1cc(CNc2ncccc2CO)cc(C)[nH+]1 ZINC001308493697 991011087 /nfs/dbraw/zinc/01/10/87/991011087.db2.gz YQCUOESKHPMEEZ-UHFFFAOYSA-N 1 2 243.310 2.198 20 0 BEADLO C[C@H]1CC(=O)CC[N@@H+]1Cc1cnc2[nH]ccc2c1 ZINC001138736935 991021994 /nfs/dbraw/zinc/02/19/94/991021994.db2.gz KFHHKRIJYIQRGO-JTQLQIEISA-N 1 2 243.310 2.116 20 0 BEADLO C[C@H]1CC(=O)CC[N@H+]1Cc1cnc2[nH]ccc2c1 ZINC001138736935 991022002 /nfs/dbraw/zinc/02/20/02/991022002.db2.gz KFHHKRIJYIQRGO-JTQLQIEISA-N 1 2 243.310 2.116 20 0 BEADLO c1nnc(C[NH2+]Cc2ccc(C3CCC3)cc2)[nH]1 ZINC001308559302 991041728 /nfs/dbraw/zinc/04/17/28/991041728.db2.gz XZPVNQIETZDVAO-UHFFFAOYSA-N 1 2 242.326 2.362 20 0 BEADLO Fc1ncccc1C[N@@H+]1CCn2cccc2C1 ZINC001138788861 991050887 /nfs/dbraw/zinc/05/08/87/991050887.db2.gz LGJOBBCDFVQSMG-UHFFFAOYSA-N 1 2 231.274 2.038 20 0 BEADLO Fc1ncccc1C[N@H+]1CCn2cccc2C1 ZINC001138788861 991050895 /nfs/dbraw/zinc/05/08/95/991050895.db2.gz LGJOBBCDFVQSMG-UHFFFAOYSA-N 1 2 231.274 2.038 20 0 BEADLO C[C@H]1CC([N@@H+]2CCC(=O)[C@@H](F)C2)C[C@H](C)C1 ZINC001258167036 991059941 /nfs/dbraw/zinc/05/99/41/991059941.db2.gz FSMIZVMQLIQCTB-FOGDFJRCSA-N 1 2 227.323 2.424 20 0 BEADLO C[C@H]1CC([N@H+]2CCC(=O)[C@@H](F)C2)C[C@H](C)C1 ZINC001258167036 991059945 /nfs/dbraw/zinc/05/99/45/991059945.db2.gz FSMIZVMQLIQCTB-FOGDFJRCSA-N 1 2 227.323 2.424 20 0 BEADLO F[C@@H]1CCC[N@H+](Cc2cccc3ccnn32)C1 ZINC001138806844 991065812 /nfs/dbraw/zinc/06/58/12/991065812.db2.gz QZCUORCHGXSJNQ-LLVKDONJSA-N 1 2 233.290 2.268 20 0 BEADLO F[C@@H]1CCC[N@@H+](Cc2cccc3ccnn32)C1 ZINC001138806844 991065820 /nfs/dbraw/zinc/06/58/20/991065820.db2.gz QZCUORCHGXSJNQ-LLVKDONJSA-N 1 2 233.290 2.268 20 0 BEADLO C[N@H+](Cc1ccnc(Cl)c1)Cc1cncnc1 ZINC001138821409 991072775 /nfs/dbraw/zinc/07/27/75/991072775.db2.gz QFISFYVVJQKKFG-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[N@@H+](Cc1ccnc(Cl)c1)Cc1cncnc1 ZINC001138821409 991072786 /nfs/dbraw/zinc/07/27/86/991072786.db2.gz QFISFYVVJQKKFG-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO c1cc2cc(C[N@@H+]3CCC34COC4)ccc2o1 ZINC001138824972 991074006 /nfs/dbraw/zinc/07/40/06/991074006.db2.gz OMEZZVCMMVWEFG-UHFFFAOYSA-N 1 2 229.279 2.408 20 0 BEADLO c1cc2cc(C[N@H+]3CCC34COC4)ccc2o1 ZINC001138824972 991074017 /nfs/dbraw/zinc/07/40/17/991074017.db2.gz OMEZZVCMMVWEFG-UHFFFAOYSA-N 1 2 229.279 2.408 20 0 BEADLO Clc1cc(C[N@@H+]2CC[C@]23CCOC3)ccn1 ZINC001138821488 991075720 /nfs/dbraw/zinc/07/57/20/991075720.db2.gz UKVITZDVGBGDDR-GFCCVEGCSA-N 1 2 238.718 2.100 20 0 BEADLO Clc1cc(C[N@H+]2CC[C@]23CCOC3)ccn1 ZINC001138821488 991075734 /nfs/dbraw/zinc/07/57/34/991075734.db2.gz UKVITZDVGBGDDR-GFCCVEGCSA-N 1 2 238.718 2.100 20 0 BEADLO CC(C)C[N@H+](C)Cc1n[nH]cc1Br ZINC001139018554 991125295 /nfs/dbraw/zinc/12/52/95/991125295.db2.gz GJJQQFDGNBYOFV-UHFFFAOYSA-N 1 2 246.152 2.260 20 0 BEADLO CC(C)C[N@@H+](C)Cc1n[nH]cc1Br ZINC001139018554 991125300 /nfs/dbraw/zinc/12/53/00/991125300.db2.gz GJJQQFDGNBYOFV-UHFFFAOYSA-N 1 2 246.152 2.260 20 0 BEADLO CCCn1cc(C[N@@H+]2CCCCC23COC3)cn1 ZINC001139040966 991130667 /nfs/dbraw/zinc/13/06/67/991130667.db2.gz XLXJFCDFJUQCGB-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CCCn1cc(C[N@H+]2CCCCC23COC3)cn1 ZINC001139040966 991130672 /nfs/dbraw/zinc/13/06/72/991130672.db2.gz XLXJFCDFJUQCGB-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CCCn1cc(C[N@@H+]2CCCC[C@H]2C(C)=O)cn1 ZINC001139041841 991133113 /nfs/dbraw/zinc/13/31/13/991133113.db2.gz XOCRKKSNBCOHFN-AWEZNQCLSA-N 1 2 249.358 2.237 20 0 BEADLO CCCn1cc(C[N@H+]2CCCC[C@H]2C(C)=O)cn1 ZINC001139041841 991133118 /nfs/dbraw/zinc/13/31/18/991133118.db2.gz XOCRKKSNBCOHFN-AWEZNQCLSA-N 1 2 249.358 2.237 20 0 BEADLO CSCC[C@H](C)[N@@H+]1CCCC(=O)[C@H](F)C1 ZINC001258215896 991135588 /nfs/dbraw/zinc/13/55/88/991135588.db2.gz RZGXJBHEXMJPNJ-VHSXEESVSA-N 1 2 233.352 2.131 20 0 BEADLO CSCC[C@H](C)[N@H+]1CCCC(=O)[C@H](F)C1 ZINC001258215896 991135590 /nfs/dbraw/zinc/13/55/90/991135590.db2.gz RZGXJBHEXMJPNJ-VHSXEESVSA-N 1 2 233.352 2.131 20 0 BEADLO COc1cc(O)ccc1C[N@@H+]1CCC[C@H](F)C1 ZINC001139139777 991164647 /nfs/dbraw/zinc/16/46/47/991164647.db2.gz AQLTXBGYMJVDRP-NSHDSACASA-N 1 2 239.290 2.335 20 0 BEADLO COc1cc(O)ccc1C[N@H+]1CCC[C@H](F)C1 ZINC001139139777 991164663 /nfs/dbraw/zinc/16/46/63/991164663.db2.gz AQLTXBGYMJVDRP-NSHDSACASA-N 1 2 239.290 2.335 20 0 BEADLO Cc1c(NCc2ccc[nH+]c2N)n[nH]c1C(C)C ZINC001308835464 991166472 /nfs/dbraw/zinc/16/64/72/991166472.db2.gz LKNXKSADLCFGMO-UHFFFAOYSA-N 1 2 245.330 2.431 20 0 BEADLO Cn1ccc2cc(C[NH+]3CC4(CCO4)C3)ccc21 ZINC001139190817 991189337 /nfs/dbraw/zinc/18/93/37/991189337.db2.gz YGLKBPAFUHVYPG-UHFFFAOYSA-N 1 2 242.322 2.153 20 0 BEADLO CC(=O)C[NH2+][C@@H](c1ccccc1)c1ccccn1 ZINC001559629681 991193070 /nfs/dbraw/zinc/19/30/70/991193070.db2.gz RQQKDBYERBZPMS-HNNXBMFYSA-N 1 2 240.306 2.350 20 0 BEADLO COC(=O)C1([NH2+][C@H]2CCCC(C)(C)C2)CC1 ZINC001258275310 991198793 /nfs/dbraw/zinc/19/87/93/991198793.db2.gz JTTAYMACHSYYGW-JTQLQIEISA-N 1 2 225.332 2.250 20 0 BEADLO CCCCOCC[NH2+][C@@H](CC)c1noc(C)n1 ZINC001559736567 991235832 /nfs/dbraw/zinc/23/58/32/991235832.db2.gz OIKCXZAHZQSQLH-NSHDSACASA-N 1 2 241.335 2.235 20 0 BEADLO Clc1cccc(C[N@@H+]2CC[C@@]23CCOC3)n1 ZINC001139552758 991268226 /nfs/dbraw/zinc/26/82/26/991268226.db2.gz UWVMSHICQWIGBG-LBPRGKRZSA-N 1 2 238.718 2.100 20 0 BEADLO Clc1cccc(C[N@H+]2CC[C@@]23CCOC3)n1 ZINC001139552758 991268241 /nfs/dbraw/zinc/26/82/41/991268241.db2.gz UWVMSHICQWIGBG-LBPRGKRZSA-N 1 2 238.718 2.100 20 0 BEADLO COc1cc(C[N@H+](C)CC(C)=O)ccc1Cl ZINC001139612122 991291603 /nfs/dbraw/zinc/29/16/03/991291603.db2.gz NUIUPSVLABGKST-UHFFFAOYSA-N 1 2 241.718 2.369 20 0 BEADLO COc1cc(C[N@@H+](C)CC(C)=O)ccc1Cl ZINC001139612122 991291618 /nfs/dbraw/zinc/29/16/18/991291618.db2.gz NUIUPSVLABGKST-UHFFFAOYSA-N 1 2 241.718 2.369 20 0 BEADLO COc1ncc(C[N@@H+]2CCCC[C@H](F)C2)s1 ZINC001139814382 991382034 /nfs/dbraw/zinc/38/20/34/991382034.db2.gz BWANTHIUXCDHJW-VIFPVBQESA-N 1 2 244.335 2.476 20 0 BEADLO COc1ncc(C[N@H+]2CCCC[C@H](F)C2)s1 ZINC001139814382 991382040 /nfs/dbraw/zinc/38/20/40/991382040.db2.gz BWANTHIUXCDHJW-VIFPVBQESA-N 1 2 244.335 2.476 20 0 BEADLO Cc1cnc(C[NH+]2CC3(C2)CCOCC3)s1 ZINC001139814494 991382584 /nfs/dbraw/zinc/38/25/84/991382584.db2.gz NRAYUWNODQTZPZ-UHFFFAOYSA-N 1 2 238.356 2.064 20 0 BEADLO Cc1cccc([C@H]2CC[N@H+](Cc3nnc[nH]3)C2)c1 ZINC001328392964 991387813 /nfs/dbraw/zinc/38/78/13/991387813.db2.gz CHOVYWVYIXNNLY-ZDUSSCGKSA-N 1 2 242.326 2.103 20 0 BEADLO Cc1cccc([C@H]2CC[N@@H+](Cc3nnc[nH]3)C2)c1 ZINC001328392964 991387821 /nfs/dbraw/zinc/38/78/21/991387821.db2.gz CHOVYWVYIXNNLY-ZDUSSCGKSA-N 1 2 242.326 2.103 20 0 BEADLO CC(C)[C@@H]1COCC[N@@H+]1Cc1ccnc(F)c1 ZINC001139834592 991390618 /nfs/dbraw/zinc/39/06/18/991390618.db2.gz OVAYLEKNDXARGJ-LBPRGKRZSA-N 1 2 238.306 2.078 20 0 BEADLO CC(C)[C@@H]1COCC[N@H+]1Cc1ccnc(F)c1 ZINC001139834592 991390624 /nfs/dbraw/zinc/39/06/24/991390624.db2.gz OVAYLEKNDXARGJ-LBPRGKRZSA-N 1 2 238.306 2.078 20 0 BEADLO CC[C@@H](CO)[NH2+]CC(F)(F)c1ccc(F)cc1 ZINC001560148813 991392127 /nfs/dbraw/zinc/39/21/27/991392127.db2.gz KMDWSAOIDHWRID-NSHDSACASA-N 1 2 247.260 2.278 20 0 BEADLO Cc1ccc(C[N@@H+]2CCCCC23COC3)nc1 ZINC001139838623 991395687 /nfs/dbraw/zinc/39/56/87/991395687.db2.gz LKHCSOLHNIDUAK-UHFFFAOYSA-N 1 2 232.327 2.145 20 0 BEADLO Cc1ccc(C[N@H+]2CCCCC23COC3)nc1 ZINC001139838623 991395695 /nfs/dbraw/zinc/39/56/95/991395695.db2.gz LKHCSOLHNIDUAK-UHFFFAOYSA-N 1 2 232.327 2.145 20 0 BEADLO c1coc(C[N@H+](Cc2cccnn2)C2CC2)c1 ZINC001139973662 991444745 /nfs/dbraw/zinc/44/47/45/991444745.db2.gz CSMDPLAUCWIIBV-UHFFFAOYSA-N 1 2 229.283 2.234 20 0 BEADLO c1coc(C[N@@H+](Cc2cccnn2)C2CC2)c1 ZINC001139973662 991444749 /nfs/dbraw/zinc/44/47/49/991444749.db2.gz CSMDPLAUCWIIBV-UHFFFAOYSA-N 1 2 229.283 2.234 20 0 BEADLO CC1(C)CC[C@@H]([NH+]2CC(O)(C(F)(F)F)C2)C1 ZINC001258601794 991508126 /nfs/dbraw/zinc/50/81/26/991508126.db2.gz FCDKFOPYEZHGIS-MRVPVSSYSA-N 1 2 237.265 2.174 20 0 BEADLO CC1(C)CC[C@@H]([N@@H+]2CC[C@H](O)C(F)(F)C2)C1 ZINC001258604420 991516192 /nfs/dbraw/zinc/51/61/92/991516192.db2.gz CQZSZTHWFUVUHL-ZJUUUORDSA-N 1 2 233.302 2.267 20 0 BEADLO CC1(C)CC[C@@H]([N@H+]2CC[C@H](O)C(F)(F)C2)C1 ZINC001258604420 991516203 /nfs/dbraw/zinc/51/62/03/991516203.db2.gz CQZSZTHWFUVUHL-ZJUUUORDSA-N 1 2 233.302 2.267 20 0 BEADLO Oc1cc(Cl)cc(C[NH2+]Cc2cnccn2)c1 ZINC001560618528 991524634 /nfs/dbraw/zinc/52/46/34/991524634.db2.gz VGLDMOKWVVWZIH-UHFFFAOYSA-N 1 2 249.701 2.125 20 0 BEADLO Cc1cc(C[NH+]2CCC(=O)CC2)c(C)cc1O ZINC001140196793 991558661 /nfs/dbraw/zinc/55/86/61/991558661.db2.gz ACYPEXGQEJCFQG-UHFFFAOYSA-N 1 2 233.311 2.174 20 0 BEADLO C[C@H](Cc1cccnc1)[N@@H+]1C[C@@H](F)C[C@H]1CF ZINC001258622857 991560455 /nfs/dbraw/zinc/56/04/55/991560455.db2.gz SVNSNPGYVBTXRX-WXHSDQCUSA-N 1 2 240.297 2.395 20 0 BEADLO C[C@H](Cc1cccnc1)[N@H+]1C[C@@H](F)C[C@H]1CF ZINC001258622857 991560462 /nfs/dbraw/zinc/56/04/62/991560462.db2.gz SVNSNPGYVBTXRX-WXHSDQCUSA-N 1 2 240.297 2.395 20 0 BEADLO C[C@@H]1COCC[N@@H+]1Cc1c[nH]c2cccc(O)c12 ZINC001140229884 991567685 /nfs/dbraw/zinc/56/76/85/991567685.db2.gz JBIJHTPEOMPZKJ-SNVBAGLBSA-N 1 2 246.310 2.094 20 0 BEADLO C[C@@H]1COCC[N@H+]1Cc1c[nH]c2cccc(O)c12 ZINC001140229884 991567696 /nfs/dbraw/zinc/56/76/96/991567696.db2.gz JBIJHTPEOMPZKJ-SNVBAGLBSA-N 1 2 246.310 2.094 20 0 BEADLO C[NH+](C)C1(c2nnc(CC3CCCC3)o2)CC1 ZINC001258643985 991584134 /nfs/dbraw/zinc/58/41/34/991584134.db2.gz AXQFEBICOZIKGO-UHFFFAOYSA-N 1 2 235.331 2.353 20 0 BEADLO CCC[C@H](Cc1ccccc1)[NH2+][C@H]1CCOC1=O ZINC001258650348 991587289 /nfs/dbraw/zinc/58/72/89/991587289.db2.gz ZWQMSBVTGKBCGQ-KGLIPLIRSA-N 1 2 247.338 2.303 20 0 BEADLO Cc1ccc2n[nH]c(C[N@@H+](C)C3(C)COC3)c2c1 ZINC001140329951 991609507 /nfs/dbraw/zinc/60/95/07/991609507.db2.gz FZAUPSFMSOMQEG-UHFFFAOYSA-N 1 2 245.326 2.092 20 0 BEADLO Cc1ccc2n[nH]c(C[N@H+](C)C3(C)COC3)c2c1 ZINC001140329951 991609514 /nfs/dbraw/zinc/60/95/14/991609514.db2.gz FZAUPSFMSOMQEG-UHFFFAOYSA-N 1 2 245.326 2.092 20 0 BEADLO Cc1cccc2c1C[N@H+](Cc1ccncn1)C2 ZINC001140344520 991615584 /nfs/dbraw/zinc/61/55/84/991615584.db2.gz COYRXYRMEVANHV-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO Cc1cccc2c1C[N@@H+](Cc1ccncn1)C2 ZINC001140344520 991615587 /nfs/dbraw/zinc/61/55/87/991615587.db2.gz COYRXYRMEVANHV-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO C[N@H+](Cc1ccsc1)Cc1ccncn1 ZINC001140347723 991617322 /nfs/dbraw/zinc/61/73/22/991617322.db2.gz SATNFMBSYUBGQA-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO C[N@@H+](Cc1ccsc1)Cc1ccncn1 ZINC001140347723 991617325 /nfs/dbraw/zinc/61/73/25/991617325.db2.gz SATNFMBSYUBGQA-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO CC(C)OC1C[NH+](Cc2ccc3n[nH]cc3c2)C1 ZINC001140388338 991630431 /nfs/dbraw/zinc/63/04/31/991630431.db2.gz QMUVIVTVLYRVTH-UHFFFAOYSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H](C(=O)N1CCC(C)(C)CC1)n1cc[nH+]c1 ZINC001318180403 991631187 /nfs/dbraw/zinc/63/11/87/991631187.db2.gz BTQUXFXINJQIQS-NSHDSACASA-N 1 2 235.331 2.093 20 0 BEADLO Cc1cccc2c1CC[N@@H+](CC(=O)OC(C)C)C2 ZINC001318280854 991641437 /nfs/dbraw/zinc/64/14/37/991641437.db2.gz KRBFVNQOYCDDOB-UHFFFAOYSA-N 1 2 247.338 2.305 20 0 BEADLO Cc1cccc2c1CC[N@H+](CC(=O)OC(C)C)C2 ZINC001318280854 991641442 /nfs/dbraw/zinc/64/14/42/991641442.db2.gz KRBFVNQOYCDDOB-UHFFFAOYSA-N 1 2 247.338 2.305 20 0 BEADLO C[C@@]1(O)CC[N@H+](Cc2c(F)cc(F)cc2F)C1 ZINC001140529446 991662517 /nfs/dbraw/zinc/66/25/17/991662517.db2.gz CGGXFMYHZUQTTO-GFCCVEGCSA-N 1 2 245.244 2.061 20 0 BEADLO C[C@@]1(O)CC[N@@H+](Cc2c(F)cc(F)cc2F)C1 ZINC001140529446 991662521 /nfs/dbraw/zinc/66/25/21/991662521.db2.gz CGGXFMYHZUQTTO-GFCCVEGCSA-N 1 2 245.244 2.061 20 0 BEADLO COC(=O)Oc1cccc(-n2cc[nH+]c2)c1 ZINC001561270964 991718061 /nfs/dbraw/zinc/71/80/61/991718061.db2.gz CCFCSJJVIUGZMR-UHFFFAOYSA-N 1 2 218.212 2.018 20 0 BEADLO C[C@@H](C(=O)N1C[C@H](C)CC[C@@H]1C)n1cc[nH+]c1 ZINC001318913621 991734303 /nfs/dbraw/zinc/73/43/03/991734303.db2.gz UDKSVJJIAMNFKV-WOPDTQHZSA-N 1 2 235.331 2.091 20 0 BEADLO CC[C@@H]1C[C@@H](C)CN1C(=O)[C@H](C)n1cc[nH+]c1 ZINC001318941920 991744674 /nfs/dbraw/zinc/74/46/74/991744674.db2.gz QJSHPXLIEUXLQA-GRYCIOLGSA-N 1 2 235.331 2.091 20 0 BEADLO CC[C@H](Cc1ccccc1)[N@@H+]1CCC(=O)C1 ZINC001258851430 991882584 /nfs/dbraw/zinc/88/25/84/991882584.db2.gz PNAJKSJTIWNCQT-CYBMUJFWSA-N 1 2 217.312 2.283 20 0 BEADLO CC[C@H](Cc1ccccc1)[N@H+]1CCC(=O)C1 ZINC001258851430 991882586 /nfs/dbraw/zinc/88/25/86/991882586.db2.gz PNAJKSJTIWNCQT-CYBMUJFWSA-N 1 2 217.312 2.283 20 0 BEADLO CC[C@@]1(C)CCN(C(=O)[C@H](C)n2cc[nH+]c2)C1 ZINC001319610025 991909606 /nfs/dbraw/zinc/90/96/06/991909606.db2.gz PEYMFJSTBQCUBR-AAEUAGOBSA-N 1 2 235.331 2.093 20 0 BEADLO C[C@@H](C(=O)N(C)C[C@@H]1CC=CCC1)n1cc[nH+]c1 ZINC001320057483 992094162 /nfs/dbraw/zinc/09/41/62/992094162.db2.gz CABKBNIURMAMIB-QWHCGFSZSA-N 1 2 247.342 2.259 20 0 BEADLO CC[C@@H]1[C@H](C)CCN1C(=O)[C@H](C)n1cc[nH+]c1 ZINC001320521693 992233401 /nfs/dbraw/zinc/23/34/01/992233401.db2.gz RFCAQDCXJIVXQA-GRYCIOLGSA-N 1 2 235.331 2.091 20 0 BEADLO Cc1cc(C[NH+]2CCC([C@@H]3CCCO3)CC2)n[nH]1 ZINC001320589366 992261899 /nfs/dbraw/zinc/26/18/99/992261899.db2.gz LWLKPWPRXHDZKN-AWEZNQCLSA-N 1 2 249.358 2.109 20 0 BEADLO C[NH+](C)Cc1nnc(C(C2CC2)C2CC2)o1 ZINC001261429628 992299278 /nfs/dbraw/zinc/29/92/78/992299278.db2.gz ISEJHHMQMQYONE-UHFFFAOYSA-N 1 2 221.304 2.035 20 0 BEADLO CCc1cc(C[NH2+]Cc2ncccc2C)on1 ZINC001320872603 992386758 /nfs/dbraw/zinc/38/67/58/992386758.db2.gz APDVYAUWQLILSL-UHFFFAOYSA-N 1 2 231.299 2.230 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(C)=C(C)C2)n[nH]1 ZINC001321118255 992448286 /nfs/dbraw/zinc/44/82/86/992448286.db2.gz MDUPAGROZSCLRQ-UHFFFAOYSA-N 1 2 205.305 2.260 20 0 BEADLO Cc1ncccc1[C@@H](C)OC(=O)[C@@H]1CCCC[NH2+]1 ZINC001574192095 992819980 /nfs/dbraw/zinc/81/99/80/992819980.db2.gz OPYSRPNJLDHYKG-YPMHNXCESA-N 1 2 248.326 2.136 20 0 BEADLO Cc1cc(C[C@H](C)Nc2cccc[nH+]2)n[nH]1 ZINC001262687851 993030767 /nfs/dbraw/zinc/03/07/67/993030767.db2.gz ZFBHHENUFMDPIR-VIFPVBQESA-N 1 2 216.288 2.156 20 0 BEADLO Cc1cc(C[C@H](C)Nc2cccc[nH+]2)[nH]n1 ZINC001262687851 993030772 /nfs/dbraw/zinc/03/07/72/993030772.db2.gz ZFBHHENUFMDPIR-VIFPVBQESA-N 1 2 216.288 2.156 20 0 BEADLO CCN(C[C@@H]1CCOC1)c1cc(F)cc(C)[nH+]1 ZINC001262687936 993031050 /nfs/dbraw/zinc/03/10/50/993031050.db2.gz BIDMWIWIOHYBLO-NSHDSACASA-N 1 2 238.306 2.392 20 0 BEADLO CC(C)=CCC[C@H](C)NC(=O)C[C@H]([NH3+])C(F)F ZINC001575390017 993033201 /nfs/dbraw/zinc/03/32/01/993033201.db2.gz NUXIHBDPLFCIBD-UWVGGRQHSA-N 1 2 248.317 2.220 20 0 BEADLO CCc1ccc(N2C[C@H](C)C[C@H](CO)C2)[nH+]c1 ZINC001262699973 993038733 /nfs/dbraw/zinc/03/87/33/993038733.db2.gz RDCQIEXRYKLSOT-YPMHNXCESA-N 1 2 234.343 2.099 20 0 BEADLO CCc1ccc(N2C[C@@H](C)C[C@H](CO)C2)[nH+]c1 ZINC001262699970 993042555 /nfs/dbraw/zinc/04/25/55/993042555.db2.gz RDCQIEXRYKLSOT-AAEUAGOBSA-N 1 2 234.343 2.099 20 0 BEADLO CC[C@H]([NH2+][C@@H]1C[C@@H]2CC[C@@H](C2)C1)c1cn[nH]n1 ZINC001576288599 993255405 /nfs/dbraw/zinc/25/54/05/993255405.db2.gz HSMWWHKYDUAWIY-USZNOCQGSA-N 1 2 234.347 2.424 20 0 BEADLO CC[C@H]([NH2+][C@@H]1C[C@@H]2CC[C@@H](C2)C1)c1c[nH]nn1 ZINC001576288599 993255417 /nfs/dbraw/zinc/25/54/17/993255417.db2.gz HSMWWHKYDUAWIY-USZNOCQGSA-N 1 2 234.347 2.424 20 0 BEADLO C[C@H](Cc1ccco1)[N@@H+]1Cc2cncnc2C1 ZINC000585332274 993256639 /nfs/dbraw/zinc/25/66/39/993256639.db2.gz PLYVRWLHYCORSS-SNVBAGLBSA-N 1 2 229.283 2.016 20 0 BEADLO C[C@H](Cc1ccco1)[N@H+]1Cc2cncnc2C1 ZINC000585332274 993256646 /nfs/dbraw/zinc/25/66/46/993256646.db2.gz PLYVRWLHYCORSS-SNVBAGLBSA-N 1 2 229.283 2.016 20 0 BEADLO Cn1cc[nH+]c1CCCOC(=O)[C@]12C[C@H]1CCC2 ZINC001263470445 993328859 /nfs/dbraw/zinc/32/88/59/993328859.db2.gz CSGDPUBHPOSLDI-BXUZGUMPSA-N 1 2 248.326 2.086 20 0 BEADLO CC(C)[C@H](C)C(=O)OCCCc1c[nH+]cn1C ZINC001263510081 993350517 /nfs/dbraw/zinc/35/05/17/993350517.db2.gz QCUXMEHMLMGHQT-NSHDSACASA-N 1 2 238.331 2.188 20 0 BEADLO CCCCCC(=O)OCCCc1c[nH+]cn1C ZINC001263510035 993351536 /nfs/dbraw/zinc/35/15/36/993351536.db2.gz OVZNDLBLNHCKLJ-UHFFFAOYSA-N 1 2 238.331 2.476 20 0 BEADLO CC[C@@H]([NH2+]Cc1ncn[nH]1)C1CCCCC1 ZINC000381551155 993405654 /nfs/dbraw/zinc/40/56/54/993405654.db2.gz MUBDBJSSTKGFNJ-LLVKDONJSA-N 1 2 222.336 2.253 20 0 BEADLO C[N@@H+](Cc1cn[nH]n1)C[C@@H]1CCCC(C)(C)C1 ZINC001576859575 993439995 /nfs/dbraw/zinc/43/99/95/993439995.db2.gz KDEACQXSQITBDQ-LLVKDONJSA-N 1 2 236.363 2.453 20 0 BEADLO C[N@H+](Cc1cn[nH]n1)C[C@@H]1CCCC(C)(C)C1 ZINC001576859575 993439999 /nfs/dbraw/zinc/43/99/99/993439999.db2.gz KDEACQXSQITBDQ-LLVKDONJSA-N 1 2 236.363 2.453 20 0 BEADLO CC[C@@H](SC)C(=O)OCc1c[nH+]cn1CC ZINC001263662516 993454068 /nfs/dbraw/zinc/45/40/68/993454068.db2.gz FAVSHLCZXLWKLU-SNVBAGLBSA-N 1 2 242.344 2.088 20 0 BEADLO CC[C@](C)(NC(=O)CCc1[nH+]ccn1C)C1CC1 ZINC001263862531 993563593 /nfs/dbraw/zinc/56/35/93/993563593.db2.gz MEBRVUJLUYTASM-AWEZNQCLSA-N 1 2 249.358 2.048 20 0 BEADLO Cc1ccnc(C[NH2+][C@H]2C[C@@H](C)n3ccnc32)c1 ZINC000385979381 993675225 /nfs/dbraw/zinc/67/52/25/993675225.db2.gz NWYYTBWSTFVRQS-YPMHNXCESA-N 1 2 242.326 2.382 20 0 BEADLO Cc1nc([C@@H](C)[NH2+][C@@H]2C=CCCC2)no1 ZINC000393743016 993998008 /nfs/dbraw/zinc/99/80/08/993998008.db2.gz LXHNDHCUAGBJKO-PSASIEDQSA-N 1 2 207.277 2.137 20 0 BEADLO Cc1nc([C@H](C)[NH2+][C@@H]2C=CCCC2)no1 ZINC000393743018 994000302 /nfs/dbraw/zinc/00/03/02/994000302.db2.gz LXHNDHCUAGBJKO-WCBMZHEXSA-N 1 2 207.277 2.137 20 0 BEADLO Cc1ncc(C[NH+]2CCC(OC(C)C)CC2)[nH]1 ZINC000724786020 994073600 /nfs/dbraw/zinc/07/36/00/994073600.db2.gz OWIGRFVBLFKHEZ-UHFFFAOYSA-N 1 2 237.347 2.108 20 0 BEADLO C[C@H]1CC[C@@H]1NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001333969985 994552436 /nfs/dbraw/zinc/55/24/36/994552436.db2.gz SNTUYKWHKWTQQF-WPRPVWTQSA-N 1 2 229.283 2.091 20 0 BEADLO CCC=CCNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001298519857 994929584 /nfs/dbraw/zinc/92/95/84/994929584.db2.gz SDKOAYPLWRYUAQ-ARJAWSKDSA-N 1 2 229.283 2.259 20 0 BEADLO Cn1cc[nH+]c1CCC(=O)NCCCC1CCC1 ZINC001300976237 995064337 /nfs/dbraw/zinc/06/43/37/995064337.db2.gz JOLFJSNDRDKNIR-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO CCOC(=O)CCc1ccc(C)[nH+]c1C ZINC000669369533 995217842 /nfs/dbraw/zinc/21/78/42/995217842.db2.gz ZLZJQEMGKSOVFQ-UHFFFAOYSA-N 1 2 207.273 2.194 20 0 BEADLO CCc1cn(Cc2ccc3c(c2)OCCO3)c[nH+]1 ZINC001307397819 995343544 /nfs/dbraw/zinc/34/35/44/995343544.db2.gz VQCOQERNKFUYQN-UHFFFAOYSA-N 1 2 244.294 2.265 20 0 BEADLO Cc1cn[nH]c1C[NH2+][C@@H](C)c1ncccc1C ZINC001308152641 995575803 /nfs/dbraw/zinc/57/58/03/995575803.db2.gz HYTCFVGMHUCUKT-NSHDSACASA-N 1 2 230.315 2.272 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@@H](C)c1ncccc1C ZINC001308152641 995575810 /nfs/dbraw/zinc/57/58/10/995575810.db2.gz HYTCFVGMHUCUKT-NSHDSACASA-N 1 2 230.315 2.272 20 0 BEADLO CCc1cn(CC(=O)Nc2ccccc2C)c[nH+]1 ZINC001614960034 1170501474 /nfs/dbraw/zinc/50/14/74/1170501474.db2.gz JZEFYMJZCMEYGQ-UHFFFAOYSA-N 1 2 243.310 2.393 20 0 BEADLO C[C@@H](O)CCC[N@@H+]1CC(F)(F)CC[C@@H]1C ZINC001620664312 1170699583 /nfs/dbraw/zinc/69/95/83/1170699583.db2.gz CMDXKTQYZPCODZ-VHSXEESVSA-N 1 2 221.291 2.267 20 0 BEADLO C[C@@H](O)CCC[N@H+]1CC(F)(F)CC[C@@H]1C ZINC001620664312 1170699587 /nfs/dbraw/zinc/69/95/87/1170699587.db2.gz CMDXKTQYZPCODZ-VHSXEESVSA-N 1 2 221.291 2.267 20 0 BEADLO CSc1cccnc1NCc1ccc[nH+]c1N ZINC001621422964 1170804461 /nfs/dbraw/zinc/80/44/61/1170804461.db2.gz JNCSZEQNSRNURU-UHFFFAOYSA-N 1 2 246.339 2.393 20 0 BEADLO CC(C)CCC[NH2+]C1(c2ncon2)CC1 ZINC001621538471 1170838212 /nfs/dbraw/zinc/83/82/12/1170838212.db2.gz JVLPLXCWRFHGTJ-UHFFFAOYSA-N 1 2 209.293 2.085 20 0 BEADLO O=C(NCc1[nH]c2c([nH+]1)CCCC2)OC1CCC1 ZINC001622622456 1170895394 /nfs/dbraw/zinc/89/53/94/1170895394.db2.gz AQXATAGSJSDOGL-UHFFFAOYSA-N 1 2 249.314 2.067 20 0 BEADLO CCCC1(CNC(=O)Cc2[nH]c[nH+]c2C)CCC1 ZINC001622878853 1170901675 /nfs/dbraw/zinc/90/16/75/1170901675.db2.gz IGWXBTUCSRLKGF-UHFFFAOYSA-N 1 2 249.358 2.347 20 0 BEADLO CCCCC[C@@H](C)[NH2+]CC(=O)OCC ZINC000037394116 1170941704 /nfs/dbraw/zinc/94/17/04/1170941704.db2.gz YZXTUNHKXGAWCJ-SNVBAGLBSA-N 1 2 201.310 2.108 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)[C@H]1CCC[C@@H](C)C1 ZINC001623929411 1170986120 /nfs/dbraw/zinc/98/61/20/1170986120.db2.gz FXIFJFLBJVQBKW-PWSUYJOCSA-N 1 2 249.358 2.298 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC1C[C@H](C)C[C@@H](C)C1 ZINC001629577830 1171327426 /nfs/dbraw/zinc/32/74/26/1171327426.db2.gz RFOVLCXHLWGWIN-NXEZZACHSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CCC2(CCCC2)C1 ZINC001629922564 1171357020 /nfs/dbraw/zinc/35/70/20/1171357020.db2.gz SXSPOEOOHHRNKG-UHFFFAOYSA-N 1 2 247.342 2.053 20 0 BEADLO CCCN(CCC)C(=O)[C@@H](C)n1cc[nH+]c1 ZINC000045080080 1171433710 /nfs/dbraw/zinc/43/37/10/1171433710.db2.gz UARPHFXTAZPLHO-LLVKDONJSA-N 1 2 223.320 2.093 20 0 BEADLO Cc1cc(NC(=O)CCCn2cccc2)cc[nH+]1 ZINC001633611662 1171593606 /nfs/dbraw/zinc/59/36/06/1171593606.db2.gz LKVNJGUAIJIREI-UHFFFAOYSA-N 1 2 243.310 2.032 20 0 BEADLO C[C@H](C(=O)Nc1cccc(F)c1)n1cc[nH+]c1 ZINC000049215301 1171681982 /nfs/dbraw/zinc/68/19/82/1171681982.db2.gz GBLBUHCEJJXFRI-SECBINFHSA-N 1 2 233.246 2.222 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@H]2CC23CCCC3)c[nH+]1 ZINC001635606199 1171742411 /nfs/dbraw/zinc/74/24/11/1171742411.db2.gz DXSAIMAFFNLFCJ-LLVKDONJSA-N 1 2 247.342 2.169 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@H]2CC23CCCC3)[nH+]1 ZINC001635606199 1171742413 /nfs/dbraw/zinc/74/24/13/1171742413.db2.gz DXSAIMAFFNLFCJ-LLVKDONJSA-N 1 2 247.342 2.169 20 0 BEADLO C[C@H](C(=O)N(C)[C@@H]1CCCC[C@H]1C)n1cc[nH+]c1 ZINC000052433169 1171963745 /nfs/dbraw/zinc/96/37/45/1171963745.db2.gz OCPCYRWPOKFAIP-JHJVBQTASA-N 1 2 249.358 2.481 20 0 BEADLO C[N@H+](CCO)Cc1csc(Cl)c1Cl ZINC000336651050 398140013 /nfs/dbraw/zinc/14/00/13/398140013.db2.gz JBTVPDCYEKYFOK-UHFFFAOYSA-N 1 2 240.155 2.479 20 0 BEADLO C[N@@H+](CCO)Cc1csc(Cl)c1Cl ZINC000336651050 398140017 /nfs/dbraw/zinc/14/00/17/398140017.db2.gz JBTVPDCYEKYFOK-UHFFFAOYSA-N 1 2 240.155 2.479 20 0 BEADLO O=C(Nc1ccsc1)[C@H]1CCn2cc[nH+]c2C1 ZINC000161730028 349491285 /nfs/dbraw/zinc/49/12/85/349491285.db2.gz YXDCOXPLBAWZGA-VIFPVBQESA-N 1 2 247.323 2.146 20 0 BEADLO COc1cc[nH+]cc1NC(=O)Cc1cccs1 ZINC000139800640 349473680 /nfs/dbraw/zinc/47/36/80/349473680.db2.gz AGCBYMPZWUNCSP-UHFFFAOYSA-N 1 2 248.307 2.333 20 0 BEADLO CC(C)n1cc([C@@H](C)[NH2+]Cc2cc[nH]n2)cn1 ZINC000602287029 349493520 /nfs/dbraw/zinc/49/35/20/349493520.db2.gz UGCXTTBDAQHQPS-SNVBAGLBSA-N 1 2 233.319 2.038 20 0 BEADLO CCn1cc([C@@H](C)[NH2+][C@@H](C)C(F)F)cn1 ZINC000389925550 398149311 /nfs/dbraw/zinc/14/93/11/398149311.db2.gz VVHHDNMZJDTQCD-SFYZADRCSA-N 1 2 217.263 2.207 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)no1 ZINC000298433796 178003220 /nfs/dbraw/zinc/00/32/20/178003220.db2.gz YQBPKBGSNSZUJO-WDEREUQCSA-N 1 2 242.269 2.460 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)no1 ZINC000298433796 178003221 /nfs/dbraw/zinc/00/32/21/178003221.db2.gz YQBPKBGSNSZUJO-WDEREUQCSA-N 1 2 242.269 2.460 20 0 BEADLO Cc1cc(C[N@@H+]2CCn3cccc3[C@@H]2C)on1 ZINC000052723239 178006334 /nfs/dbraw/zinc/00/63/34/178006334.db2.gz LBXSPHYOKJKJJJ-NSHDSACASA-N 1 2 231.299 2.361 20 0 BEADLO Cc1cc(C[N@H+]2CCn3cccc3[C@@H]2C)on1 ZINC000052723239 178006336 /nfs/dbraw/zinc/00/63/36/178006336.db2.gz LBXSPHYOKJKJJJ-NSHDSACASA-N 1 2 231.299 2.361 20 0 BEADLO C[C@@H]([NH2+]Cc1cccc(F)c1N)C(F)F ZINC000390023967 398155489 /nfs/dbraw/zinc/15/54/89/398155489.db2.gz NRENIHVFCIEJHM-ZCFIWIBFSA-N 1 2 218.222 2.151 20 0 BEADLO C[C@H]([NH2+]Cc1cccc(F)c1N)C(F)F ZINC000390023966 398155683 /nfs/dbraw/zinc/15/56/83/398155683.db2.gz NRENIHVFCIEJHM-LURJTMIESA-N 1 2 218.222 2.151 20 0 BEADLO COc1cc(NCc2c[nH+]c(C)cc2C)ncn1 ZINC000396996277 398168947 /nfs/dbraw/zinc/16/89/47/398168947.db2.gz XFMBMQUSUOMYDJ-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO Cc1cc(C[NH2+]Cc2cnn(C(C)(C)C)c2)on1 ZINC000044987318 178026905 /nfs/dbraw/zinc/02/69/05/178026905.db2.gz HLMCOEHJOKMDJT-UHFFFAOYSA-N 1 2 248.330 2.224 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ccncc2F)ncn1 ZINC000340312718 178031112 /nfs/dbraw/zinc/03/11/12/178031112.db2.gz MLUZFHWFGPXQJO-JTQLQIEISA-N 1 2 246.289 2.170 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ccc(F)cn2)on1 ZINC000133994755 178031869 /nfs/dbraw/zinc/03/18/69/178031869.db2.gz NRFWMJVTLRQWOW-VIFPVBQESA-N 1 2 235.262 2.368 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ccncc2F)no1 ZINC000338354254 178032330 /nfs/dbraw/zinc/03/23/30/178032330.db2.gz IYEXQIDVWNCHFY-VIFPVBQESA-N 1 2 235.262 2.368 20 0 BEADLO CCc1cc(N[C@@H]2CCS[C@@H]2C)nc[nH+]1 ZINC000379916089 398174251 /nfs/dbraw/zinc/17/42/51/398174251.db2.gz CGVLMKUKEFTYRM-PSASIEDQSA-N 1 2 223.345 2.345 20 0 BEADLO C[C@H]1SCC[C@H]1Nc1nc[nH+]c(N)c1Cl ZINC000379982540 398179704 /nfs/dbraw/zinc/17/97/04/398179704.db2.gz IGMOJZUIIOLEAC-PHDIDXHHSA-N 1 2 244.751 2.018 20 0 BEADLO C[C@H]1SCC[C@H]1Nc1[nH+]cnc(N)c1Cl ZINC000379982540 398179707 /nfs/dbraw/zinc/17/97/07/398179707.db2.gz IGMOJZUIIOLEAC-PHDIDXHHSA-N 1 2 244.751 2.018 20 0 BEADLO Cc1cc(F)c(C[NH+]2CC(C)(CO)C2)c(F)c1 ZINC000335546936 178074771 /nfs/dbraw/zinc/07/47/71/178074771.db2.gz VWXWYLRVBBLFFI-UHFFFAOYSA-N 1 2 241.281 2.087 20 0 BEADLO Cc1cc(F)ccc1C[NH+]1CCN(C2CC2)CC1 ZINC000127923925 178084912 /nfs/dbraw/zinc/08/49/12/178084912.db2.gz LAHGPCJQXRRKGF-UHFFFAOYSA-N 1 2 248.345 2.414 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+]1CCO[C@H]2C[C@H]21 ZINC000368635176 178085654 /nfs/dbraw/zinc/08/56/54/178085654.db2.gz RHMLCZRKJYDNQB-OLZOCXBDSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1cc(F)ccc1C[N@H+]1CCO[C@H]2C[C@H]21 ZINC000368635176 178085655 /nfs/dbraw/zinc/08/56/55/178085655.db2.gz RHMLCZRKJYDNQB-OLZOCXBDSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1cc(F)ccc1NC(=O)CCn1cc[nH+]c1 ZINC000338008537 178088318 /nfs/dbraw/zinc/08/83/18/178088318.db2.gz TWPJGXXUGQAIHI-UHFFFAOYSA-N 1 2 247.273 2.359 20 0 BEADLO CCC(CC)C(=O)NCc1c[nH+]ccc1OC ZINC000294377081 168338769 /nfs/dbraw/zinc/33/87/69/168338769.db2.gz CQKNBEIXZRMBNH-UHFFFAOYSA-N 1 2 236.315 2.143 20 0 BEADLO Cc1cc(N(C)CC2(O)CCC2)nc(C2CC2)[nH+]1 ZINC000353282680 178096020 /nfs/dbraw/zinc/09/60/20/178096020.db2.gz PXMZZGPDOFNTNL-UHFFFAOYSA-N 1 2 247.342 2.014 20 0 BEADLO Cc1cc(N(C)CC2(O)CCC2)nc(C(C)C)[nH+]1 ZINC000353272189 178096760 /nfs/dbraw/zinc/09/67/60/178096760.db2.gz AMMRLXVZJCPXJA-UHFFFAOYSA-N 1 2 249.358 2.260 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1ccsc1 ZINC000334196570 398193784 /nfs/dbraw/zinc/19/37/84/398193784.db2.gz KHQHABYUGKQLPT-UHFFFAOYSA-N 1 2 234.280 2.404 20 0 BEADLO Cc1cc(N)nc(S[C@H](C)c2cnccn2)[nH+]1 ZINC000185331577 178109017 /nfs/dbraw/zinc/10/90/17/178109017.db2.gz UGGKPPXYMGBUAG-MRVPVSSYSA-N 1 2 247.327 2.011 20 0 BEADLO Cc1cc(N)nc(SCCc2ccccn2)[nH+]1 ZINC000023106348 178110269 /nfs/dbraw/zinc/11/02/69/178110269.db2.gz DMEAESYTJHZLQT-UHFFFAOYSA-N 1 2 246.339 2.097 20 0 BEADLO CCC(=O)N(C)Cc1[nH+]cc(C)c(OC)c1C ZINC000058958682 398201241 /nfs/dbraw/zinc/20/12/41/398201241.db2.gz POMCFHXDJSNRAO-UHFFFAOYSA-N 1 2 236.315 2.075 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2cccc(F)c2N)[C@H]1C ZINC000380586050 398201496 /nfs/dbraw/zinc/20/14/96/398201496.db2.gz QSBKJKVSVHDJFC-VHSXEESVSA-N 1 2 238.306 2.017 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2cccc(F)c2N)[C@H]1C ZINC000380586050 398201498 /nfs/dbraw/zinc/20/14/98/398201498.db2.gz QSBKJKVSVHDJFC-VHSXEESVSA-N 1 2 238.306 2.017 20 0 BEADLO Cc1cc(N2C[C@@H](C)CC2(C)C)nc[nH+]1 ZINC000336415079 178120313 /nfs/dbraw/zinc/12/03/13/178120313.db2.gz HDPVZFHFOWSEFT-VIFPVBQESA-N 1 2 205.305 2.410 20 0 BEADLO Cc1cc(N2C[C@@H]3CCC[C@H]3C2)nc[nH+]1 ZINC000301587042 178120973 /nfs/dbraw/zinc/12/09/73/178120973.db2.gz BOLMYUQMTZWCOB-QWRGUYRKSA-N 1 2 203.289 2.021 20 0 BEADLO Cc1cc(N2Cc3ccccc3C2)nc[nH+]1 ZINC000110586279 178122377 /nfs/dbraw/zinc/12/23/77/178122377.db2.gz NNPQPCRSZMOZIU-UHFFFAOYSA-N 1 2 211.268 2.305 20 0 BEADLO Cc1cc(NC(=O)C2=CCCC2)cc[nH+]1 ZINC000120885394 178125540 /nfs/dbraw/zinc/12/55/40/178125540.db2.gz CIWQKYBITIHGCG-UHFFFAOYSA-N 1 2 202.257 2.439 20 0 BEADLO Cc1cc(NC(=O)C2SCCS2)cc[nH+]1 ZINC000270455479 178126863 /nfs/dbraw/zinc/12/68/63/178126863.db2.gz DNYAUVRZOCONGM-UHFFFAOYSA-N 1 2 240.353 2.135 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H](C)C1CC1 ZINC000175319538 365544258 /nfs/dbraw/zinc/54/42/58/365544258.db2.gz DLKDNHYLLPMHLE-VIFPVBQESA-N 1 2 204.273 2.375 20 0 BEADLO Cc1cc(NC(=O)NC2CCC2)cc[nH+]1 ZINC000074641297 178139706 /nfs/dbraw/zinc/13/97/06/178139706.db2.gz IXYUJKKWCJNBOM-UHFFFAOYSA-N 1 2 205.261 2.064 20 0 BEADLO Cc1cc(NC(=O)CCOCC(F)F)cc[nH+]1 ZINC000191633442 178128052 /nfs/dbraw/zinc/12/80/52/178128052.db2.gz PETIAFMIIZUMLY-UHFFFAOYSA-N 1 2 244.241 2.000 20 0 BEADLO Cc1cc(NC(=O)NC2CC(F)(F)C2)cc[nH+]1 ZINC000277068929 178139224 /nfs/dbraw/zinc/13/92/24/178139224.db2.gz KSOGDJWIANTWIR-UHFFFAOYSA-N 1 2 241.241 2.309 20 0 BEADLO Cc1cc(NC(=O)C[C@H]2CCC(=O)[C@@H]2C)cc[nH+]1 ZINC000280629140 178134875 /nfs/dbraw/zinc/13/48/75/178134875.db2.gz XDBKIMDFRULIHV-GHMZBOCLSA-N 1 2 246.310 2.334 20 0 BEADLO CCc1cc(N2C[C@@H](C)OC[C@@H]2CC)nc(C)[nH+]1 ZINC000272811270 538926223 /nfs/dbraw/zinc/92/62/23/538926223.db2.gz COBBIAYFYPKFOH-MFKMUULPSA-N 1 2 249.358 2.351 20 0 BEADLO Cc1cc(NC(=O)N2CCC[C@H]2C)cc[nH+]1 ZINC000119710656 178136760 /nfs/dbraw/zinc/13/67/60/178136760.db2.gz WTZRQQCHQDHABN-SNVBAGLBSA-N 1 2 219.288 2.406 20 0 BEADLO COCc1ccc(COCc2[nH]cc[nH+]2)cc1 ZINC000338555609 187327838 /nfs/dbraw/zinc/32/78/38/187327838.db2.gz BHRWALPBWJMDOD-UHFFFAOYSA-N 1 2 232.283 2.273 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CCC(=O)C[C@@H]2C)cc[nH+]1 ZINC000126056137 178147649 /nfs/dbraw/zinc/14/76/49/178147649.db2.gz UMKJFUOQDRRGKU-ZANVPECISA-N 1 2 246.310 2.334 20 0 BEADLO C1=CC[N@H+](Cc2nnc(C3CC3)s2)CC1 ZINC000649417296 398217840 /nfs/dbraw/zinc/21/78/40/398217840.db2.gz UUPNTFXNEILBRR-UHFFFAOYSA-N 1 2 221.329 2.177 20 0 BEADLO C1=CC[N@@H+](Cc2nnc(C3CC3)s2)CC1 ZINC000649417296 398217843 /nfs/dbraw/zinc/21/78/43/398217843.db2.gz UUPNTFXNEILBRR-UHFFFAOYSA-N 1 2 221.329 2.177 20 0 BEADLO Cc1cc([NH2+]C2(CO)CCCC2)ccc1N ZINC000053045199 178153426 /nfs/dbraw/zinc/15/34/26/178153426.db2.gz SDVCLXIXKXVNNR-UHFFFAOYSA-N 1 2 220.316 2.294 20 0 BEADLO CSCCCSCc1c[nH+]cn1C ZINC000413012854 398210725 /nfs/dbraw/zinc/21/07/25/398210725.db2.gz XTVIYWXZQKWFSE-UHFFFAOYSA-N 1 2 216.375 2.406 20 0 BEADLO Cc1cc(C)n(CCCNc2cc(C)[nH+]cn2)n1 ZINC000134506905 178159458 /nfs/dbraw/zinc/15/94/58/178159458.db2.gz XAPNOKUZWQJXRX-UHFFFAOYSA-N 1 2 245.330 2.101 20 0 BEADLO Cc1cc(NCCn2cccn2)nc(C(C)C)[nH+]1 ZINC000042541752 178163116 /nfs/dbraw/zinc/16/31/16/178163116.db2.gz QVSYWBZLLPXWDW-UHFFFAOYSA-N 1 2 245.330 2.217 20 0 BEADLO Cc1cc(NC[C@@H](CCO)CC(C)C)nc[nH+]1 ZINC000301445598 178164476 /nfs/dbraw/zinc/16/44/76/178164476.db2.gz YAEAHSGHTQZPLS-LBPRGKRZSA-N 1 2 237.347 2.242 20 0 BEADLO Cc1cc(NC[C@@](C)(O)c2cccs2)nc[nH+]1 ZINC000301345544 178166534 /nfs/dbraw/zinc/16/65/34/178166534.db2.gz ICCJSCYSQZNEHC-GFCCVEGCSA-N 1 2 249.339 2.166 20 0 BEADLO Cc1cc(NC[C@@](C)(O)c2ccccc2)nc[nH+]1 ZINC000301262427 178166738 /nfs/dbraw/zinc/16/67/38/178166738.db2.gz HDJWSZPQXBUBJK-CQSZACIVSA-N 1 2 243.310 2.105 20 0 BEADLO Cc1cc(NC[C@H]2CCC(C)(C)O2)nc[nH+]1 ZINC000302479702 178168378 /nfs/dbraw/zinc/16/83/78/178168378.db2.gz XJWSUYMOESPCMV-SNVBAGLBSA-N 1 2 221.304 2.155 20 0 BEADLO Cc1cc(NC[C@H](O)c2ccccc2C)nc[nH+]1 ZINC000301251875 178168425 /nfs/dbraw/zinc/16/84/25/178168425.db2.gz RZWASFQZSQKOQC-ZDUSSCGKSA-N 1 2 243.310 2.239 20 0 BEADLO Cc1cc(NC[C@H](C)CCO)nc(C2CC2)[nH+]1 ZINC000266215000 178168451 /nfs/dbraw/zinc/16/84/51/178168451.db2.gz OOEYHUCDORNPPW-SECBINFHSA-N 1 2 235.331 2.093 20 0 BEADLO Cc1cc(NC[C@H](O)C(C)C)nc(C2CC2)[nH+]1 ZINC000172641606 178169242 /nfs/dbraw/zinc/16/92/42/178169242.db2.gz RKSXMUSDNHDOAA-NSHDSACASA-N 1 2 235.331 2.091 20 0 BEADLO Cc1cc(NCc2ccc3c(c2)OCO3)nc[nH+]1 ZINC000061674950 178173452 /nfs/dbraw/zinc/17/34/52/178173452.db2.gz CUXKXDLXCJEHJR-UHFFFAOYSA-N 1 2 243.266 2.126 20 0 BEADLO Cc1cc(NCc2cccc(N(C)C)c2)nc[nH+]1 ZINC000301221826 178173843 /nfs/dbraw/zinc/17/38/43/178173843.db2.gz BVHVLKHTKIYBJC-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO Cc1cc(N[C@@H](CO)c2cccc(F)c2)nc[nH+]1 ZINC000341510182 178179793 /nfs/dbraw/zinc/17/97/93/178179793.db2.gz YNSCSVNSDKWSNS-LBPRGKRZSA-N 1 2 247.273 2.070 20 0 BEADLO Cc1cc(N[C@@H]2CCC(=O)N[C@H]2C2CC2)nc[nH+]1 ZINC000329185946 178181249 /nfs/dbraw/zinc/18/12/49/178181249.db2.gz GHIJYIHFJYBMDN-MFKMUULPSA-N 1 2 246.314 2.094 20 0 BEADLO Cc1cc(N[C@@H]2CCO[C@@H]2C)nc(C(C)C)[nH+]1 ZINC000149981104 178183520 /nfs/dbraw/zinc/18/35/20/178183520.db2.gz ZGQNWUQKDCBDKQ-GHMZBOCLSA-N 1 2 235.331 2.498 20 0 BEADLO Cc1cc(N[C@@H]2C[C@H](C)n3ccnc32)nc[nH+]1 ZINC000333742324 178183629 /nfs/dbraw/zinc/18/36/29/178183629.db2.gz WCXQNHMJBCIWFK-VHSXEESVSA-N 1 2 229.287 2.099 20 0 BEADLO Cc1cc(N[C@H](C)Cc2ccco2)nc[nH+]1 ZINC000040727398 178186022 /nfs/dbraw/zinc/18/60/22/178186022.db2.gz BCSSDRJCORBXBO-SNVBAGLBSA-N 1 2 217.272 2.421 20 0 BEADLO Cc1cc(OCC(=O)N(C)C)c2ccccc2[nH+]1 ZINC000289320869 178207589 /nfs/dbraw/zinc/20/75/89/178207589.db2.gz CHMCZVBQVULPDJ-UHFFFAOYSA-N 1 2 244.294 2.010 20 0 BEADLO COCC1(CNc2ccc(N(C)C)[nH+]c2)CCC1 ZINC000387256553 398228779 /nfs/dbraw/zinc/22/87/79/398228779.db2.gz ZTFHGXJXSKXKJX-UHFFFAOYSA-N 1 2 249.358 2.376 20 0 BEADLO Cc1cc(OCCCO)c2ccccc2[nH+]1 ZINC000192191946 178210611 /nfs/dbraw/zinc/21/06/11/178210611.db2.gz PNKRBMKOXZISAT-UHFFFAOYSA-N 1 2 217.268 2.304 20 0 BEADLO CC[C@H]1C[NH+](Cc2conc2C)C[C@H](CC)O1 ZINC000421392704 192328603 /nfs/dbraw/zinc/32/86/03/192328603.db2.gz RDMWBXWVCHPJLQ-STQMWFEESA-N 1 2 238.331 2.372 20 0 BEADLO COCc1cc(-c2[nH]cc[nH+]2)ccc1OC ZINC000649428839 398230104 /nfs/dbraw/zinc/23/01/04/398230104.db2.gz CPMGFANCWRSMLW-UHFFFAOYSA-N 1 2 218.256 2.232 20 0 BEADLO CC(C)c1noc(C[NH+]2CCCCC2)n1 ZINC000073598394 343988928 /nfs/dbraw/zinc/98/89/28/343988928.db2.gz NCBGAUVHAUOHHV-UHFFFAOYSA-N 1 2 209.293 2.179 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2cccn2C)no1 ZINC000282779228 178228456 /nfs/dbraw/zinc/22/84/56/178228456.db2.gz VOWIEJCKGIPOOL-SNVBAGLBSA-N 1 2 219.288 2.172 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2cc[nH]n2)c(C)o1 ZINC000041014843 178229792 /nfs/dbraw/zinc/22/97/92/178229792.db2.gz JXNBFNKWOAJWJX-SECBINFHSA-N 1 2 219.288 2.470 20 0 BEADLO Cc1cc([C@@H]2CCCN2Cc2c[nH+]cn2C)no1 ZINC000364374982 178240756 /nfs/dbraw/zinc/24/07/56/178240756.db2.gz IYKKJLNNVFFFKM-ZDUSSCGKSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1ccnc(NCCc2cccc(C)[nH+]2)n1 ZINC000280520502 538937582 /nfs/dbraw/zinc/93/75/82/538937582.db2.gz QTFWKCBUZYTWCR-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO C(c1noc(C2CCC2)n1)[N@@H+]1CC[C@@H]2C[C@@H]2C1 ZINC000625556302 343989934 /nfs/dbraw/zinc/98/99/34/343989934.db2.gz DVPFFKFWFVKLKC-GHMZBOCLSA-N 1 2 233.315 2.179 20 0 BEADLO C(c1noc(C2CCC2)n1)[N@H+]1CC[C@@H]2C[C@@H]2C1 ZINC000625556302 343989936 /nfs/dbraw/zinc/98/99/36/343989936.db2.gz DVPFFKFWFVKLKC-GHMZBOCLSA-N 1 2 233.315 2.179 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2cc[nH]n2)c(C)o1 ZINC000041014845 178250565 /nfs/dbraw/zinc/25/05/65/178250565.db2.gz JXNBFNKWOAJWJX-VIFPVBQESA-N 1 2 219.288 2.470 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2ccco2)no1 ZINC000280891674 178252274 /nfs/dbraw/zinc/25/22/74/178252274.db2.gz DEJJGVLLSIAPDR-VIFPVBQESA-N 1 2 206.245 2.427 20 0 BEADLO Cc1cccc(CCNc2nnc(C3CC3)o2)[nH+]1 ZINC000280600909 538937968 /nfs/dbraw/zinc/93/79/68/538937968.db2.gz XRQLGPOHUOICFI-UHFFFAOYSA-N 1 2 244.298 2.305 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@H](C)c2nncn2C)oc1C ZINC000282078838 178258363 /nfs/dbraw/zinc/25/83/63/178258363.db2.gz HMTIWLXIWRXQEU-VHSXEESVSA-N 1 2 248.330 2.437 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@H](C)c2cn(C)nc2C)no1 ZINC000337568782 178258624 /nfs/dbraw/zinc/25/86/24/178258624.db2.gz ZSVNOTKVGHSNFF-KOLCDFICSA-N 1 2 248.330 2.437 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2ccon2)cn1 ZINC000336775824 398240836 /nfs/dbraw/zinc/24/08/36/398240836.db2.gz CTXAUCGZZYPIBS-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO Cc1cc2ccccc2[nH+]c1NC[C@H](C)O ZINC000063105707 178298692 /nfs/dbraw/zinc/29/86/92/178298692.db2.gz AHYNYKNDJYELAA-JTQLQIEISA-N 1 2 216.284 2.336 20 0 BEADLO Cc1cc2[nH+]cn(CC[C@@H](C)O)c2cc1C ZINC000044183875 178305429 /nfs/dbraw/zinc/30/54/29/178305429.db2.gz VTBLZDHMLBXYEG-LLVKDONJSA-N 1 2 218.300 2.424 20 0 BEADLO CCc1nnc(C[NH2+][C@@H](C)c2ccncc2)s1 ZINC000343699836 365621512 /nfs/dbraw/zinc/62/15/12/365621512.db2.gz VPKDHXIKQXHHMH-VIFPVBQESA-N 1 2 248.355 2.346 20 0 BEADLO Cc1cc2c(cc1NCc1c[nH+]cn1C)OCO2 ZINC000180424283 178291812 /nfs/dbraw/zinc/29/18/12/178291812.db2.gz VPENGFVVRCEJLM-UHFFFAOYSA-N 1 2 245.282 2.069 20 0 BEADLO C[C@@H](NC(=O)C[C@H]1CCC[C@@H]1C)c1[nH]cc[nH+]1 ZINC000580901944 398250927 /nfs/dbraw/zinc/25/09/27/398250927.db2.gz DDGGURZPKHQMHP-HBNTYKKESA-N 1 2 235.331 2.413 20 0 BEADLO C[C@H](CC1CCC1)NC(=O)CCc1c[nH+]c[nH]1 ZINC000634369433 361824341 /nfs/dbraw/zinc/82/43/41/361824341.db2.gz AGHSXRJVMATJOY-SNVBAGLBSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H](CC1CCC1)NC(=O)CCc1c[nH]c[nH+]1 ZINC000634369433 361824346 /nfs/dbraw/zinc/82/43/46/361824346.db2.gz AGHSXRJVMATJOY-SNVBAGLBSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H](N[C@@H](C1CC1)C(F)(F)F)c1[nH]cc[nH+]1 ZINC000287379733 538945196 /nfs/dbraw/zinc/94/51/96/538945196.db2.gz PIWCESDNDKGWJO-XPUUQOCRSA-N 1 2 233.237 2.401 20 0 BEADLO CCC(CC)Cc1nc(Cc2c[nH+]cn2C)no1 ZINC000357943369 168367429 /nfs/dbraw/zinc/36/74/29/168367429.db2.gz BXXQHKNWCOHFPK-UHFFFAOYSA-N 1 2 248.330 2.373 20 0 BEADLO C[C@@H](N[C@@H](C1CC1)C(F)(F)F)c1[nH]cc[nH+]1 ZINC000287379729 538945205 /nfs/dbraw/zinc/94/52/05/538945205.db2.gz PIWCESDNDKGWJO-SVRRBLITSA-N 1 2 233.237 2.401 20 0 BEADLO Cc1ccc(-n2cc[nH+]c2)c(C(=O)NC(C)C)c1 ZINC000118753770 178346964 /nfs/dbraw/zinc/34/69/64/178346964.db2.gz DGINQCAKEBGYAD-UHFFFAOYSA-N 1 2 243.310 2.319 20 0 BEADLO Cc1cc([NH2+]CC2(O)CCC2)cc(C)c1O ZINC000576747923 365675607 /nfs/dbraw/zinc/67/56/07/365675607.db2.gz YYRBUAKVPMAUSR-UHFFFAOYSA-N 1 2 221.300 2.336 20 0 BEADLO COC[C@H](Cc1ccccc1)Nc1c[nH]c[nH+]1 ZINC000576772316 365681877 /nfs/dbraw/zinc/68/18/77/365681877.db2.gz HDQOQCSRQBVOFK-LBPRGKRZSA-N 1 2 231.299 2.079 20 0 BEADLO CC12CC(C1)C[N@@H+]2Cc1noc(C2CCC2)n1 ZINC000625565739 343998190 /nfs/dbraw/zinc/99/81/90/343998190.db2.gz ZTSLFWLYBGRWID-UHFFFAOYSA-N 1 2 233.315 2.321 20 0 BEADLO CC12CC(C1)C[N@H+]2Cc1noc(C2CCC2)n1 ZINC000625565739 343998192 /nfs/dbraw/zinc/99/81/92/343998192.db2.gz ZTSLFWLYBGRWID-UHFFFAOYSA-N 1 2 233.315 2.321 20 0 BEADLO C[N@H+](Cc1cncnc1)Cc1ccccc1F ZINC000179606877 538955752 /nfs/dbraw/zinc/95/57/52/538955752.db2.gz BKXBXCTZLBLKEB-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[N@@H+](Cc1cncnc1)Cc1ccccc1F ZINC000179606877 538955753 /nfs/dbraw/zinc/95/57/53/538955753.db2.gz BKXBXCTZLBLKEB-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[N@H+](Cc1ccc[nH]1)Cc1ccncc1F ZINC000449039538 398273056 /nfs/dbraw/zinc/27/30/56/398273056.db2.gz ZRNTYCFBHAYHPG-UHFFFAOYSA-N 1 2 219.263 2.181 20 0 BEADLO C[N@@H+](Cc1ccc[nH]1)Cc1ccncc1F ZINC000449039538 398273057 /nfs/dbraw/zinc/27/30/57/398273057.db2.gz ZRNTYCFBHAYHPG-UHFFFAOYSA-N 1 2 219.263 2.181 20 0 BEADLO Cc1cc([C@@H](C)NC(=O)c2c[nH+]c(C)[nH]2)c(C)o1 ZINC000335065351 398276417 /nfs/dbraw/zinc/27/64/17/398276417.db2.gz PHNCMPYUUZREEZ-MRVPVSSYSA-N 1 2 247.298 2.419 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1ccc2cc[nH]c2c1 ZINC000600112617 342670971 /nfs/dbraw/zinc/67/09/71/342670971.db2.gz SLERNLQTFCKHPY-UHFFFAOYSA-N 1 2 246.310 2.163 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1ccc2cc[nH]c2c1 ZINC000600112617 342670972 /nfs/dbraw/zinc/67/09/72/342670972.db2.gz SLERNLQTFCKHPY-UHFFFAOYSA-N 1 2 246.310 2.163 20 0 BEADLO CSCc1cnc(C[N@@H+]2C[C@@H]3C[C@@H]3C2)s1 ZINC000600189260 342698955 /nfs/dbraw/zinc/69/89/55/342698955.db2.gz DQXZWMAUCHCUKQ-DTORHVGOSA-N 1 2 240.397 2.458 20 0 BEADLO CSCc1cnc(C[N@H+]2C[C@@H]3C[C@@H]3C2)s1 ZINC000600189260 342698957 /nfs/dbraw/zinc/69/89/57/342698957.db2.gz DQXZWMAUCHCUKQ-DTORHVGOSA-N 1 2 240.397 2.458 20 0 BEADLO C[C@H](c1ccccn1)[N@H+](C)Cc1cncnc1 ZINC000182063643 538961652 /nfs/dbraw/zinc/96/16/52/538961652.db2.gz VYRDMKFFCZOJBD-LLVKDONJSA-N 1 2 228.299 2.065 20 0 BEADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1cncnc1 ZINC000182063643 538961653 /nfs/dbraw/zinc/96/16/53/538961653.db2.gz VYRDMKFFCZOJBD-LLVKDONJSA-N 1 2 228.299 2.065 20 0 BEADLO C[C@H]1[C@@H](C)N(c2nc[nH+]c(N)c2Cl)C[C@H]1C ZINC000399742145 342742197 /nfs/dbraw/zinc/74/21/97/342742197.db2.gz JJXLKACYPYJJIL-BWZBUEFSSA-N 1 2 240.738 2.193 20 0 BEADLO C[C@H]1[C@@H](C)N(c2[nH+]cnc(N)c2Cl)C[C@H]1C ZINC000399742145 342742199 /nfs/dbraw/zinc/74/21/99/342742199.db2.gz JJXLKACYPYJJIL-BWZBUEFSSA-N 1 2 240.738 2.193 20 0 BEADLO CCCCOCC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000605306170 342746576 /nfs/dbraw/zinc/74/65/76/342746576.db2.gz GOQYEXQRFGFECG-UHFFFAOYSA-N 1 2 247.298 2.090 20 0 BEADLO CC(C)c1nc(NC2CC(F)(F)C2)cc[nH+]1 ZINC000335606821 136236489 /nfs/dbraw/zinc/23/64/89/136236489.db2.gz QRWPEKOAQRZCAB-UHFFFAOYSA-N 1 2 227.258 2.232 20 0 BEADLO Cc1cc(CNC(=O)N2C[C@H](C)[C@H]2C)cc(C)[nH+]1 ZINC000335610657 136236721 /nfs/dbraw/zinc/23/67/21/136236721.db2.gz IQVKFUZRKWIGFY-JOYOIKCWSA-N 1 2 247.342 2.248 20 0 BEADLO C[C@@H](C[N@H+](C)CC(F)F)C(=O)OC(C)(C)C ZINC000320131212 342732425 /nfs/dbraw/zinc/73/24/25/342732425.db2.gz GOCQDIKPRMTAPP-QMMMGPOBSA-N 1 2 237.290 2.161 20 0 BEADLO C[C@@H](C[N@@H+](C)CC(F)F)C(=O)OC(C)(C)C ZINC000320131212 342732426 /nfs/dbraw/zinc/73/24/26/342732426.db2.gz GOCQDIKPRMTAPP-QMMMGPOBSA-N 1 2 237.290 2.161 20 0 BEADLO CC[C@]1(C(C)C)C[C@@H]1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493449184 529388499 /nfs/dbraw/zinc/38/84/99/529388499.db2.gz GDTWJHPKURYMDI-UGAQRHAQSA-N 1 2 247.342 2.364 20 0 BEADLO CCC1(CNc2cc[nH+]c(C(C)(C)C)n2)COC1 ZINC000649486772 398284557 /nfs/dbraw/zinc/28/45/57/398284557.db2.gz OANYMPQQVWSSEW-UHFFFAOYSA-N 1 2 249.358 2.035 20 0 BEADLO CC1(C)CCCN1C(=O)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000336224053 342785614 /nfs/dbraw/zinc/78/56/14/342785614.db2.gz QNSYZNZKNBTPPB-SNVBAGLBSA-N 1 2 247.342 2.231 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000421482432 192344542 /nfs/dbraw/zinc/34/45/42/192344542.db2.gz XWMVUJJTIAWTEB-XQQFMLRXSA-N 1 2 244.338 2.441 20 0 BEADLO Cc1cc[nH+]cc1Cc1noc(C23CC(C2)C3)n1 ZINC000624655219 342809458 /nfs/dbraw/zinc/80/94/58/342809458.db2.gz NBSIZKNWFMUJIA-UHFFFAOYSA-N 1 2 241.294 2.415 20 0 BEADLO C/C=C/CNc1cc(N2CCCCC2)nc[nH+]1 ZINC000624655224 342809634 /nfs/dbraw/zinc/80/96/34/342809634.db2.gz NJKQXBBXVBYADJ-NSCUHMNNSA-N 1 2 232.331 2.455 20 0 BEADLO C/C=C/CNc1cc(N2CCCCC2)[nH+]cn1 ZINC000624655224 342809636 /nfs/dbraw/zinc/80/96/36/342809636.db2.gz NJKQXBBXVBYADJ-NSCUHMNNSA-N 1 2 232.331 2.455 20 0 BEADLO C/C=C/CNc1[nH+]c(C)nc2[nH]ccc21 ZINC000624656064 342809929 /nfs/dbraw/zinc/80/99/29/342809929.db2.gz FBSWFZWFADQCOE-ONEGZZNKSA-N 1 2 202.261 2.206 20 0 BEADLO Cc1oncc1-c1c[nH+]c2n1CCCC2 ZINC000630050623 361913162 /nfs/dbraw/zinc/91/31/62/361913162.db2.gz DHCFADCHJRLQKN-UHFFFAOYSA-N 1 2 203.245 2.183 20 0 BEADLO Cc1cnc(C[NH2+]Cc2ccco2)s1 ZINC000022863791 342815769 /nfs/dbraw/zinc/81/57/69/342815769.db2.gz XZPPTCCAKFHGFA-UHFFFAOYSA-N 1 2 208.286 2.334 20 0 BEADLO CC1CCC(N(C)C(=O)CCc2c[nH+]c[nH]2)CC1 ZINC000188549663 538979331 /nfs/dbraw/zinc/97/93/31/538979331.db2.gz NMWIESHBLJEDCV-UHFFFAOYSA-N 1 2 249.358 2.379 20 0 BEADLO CC1CCC(N(C)C(=O)CCc2c[nH]c[nH+]2)CC1 ZINC000188549663 538979333 /nfs/dbraw/zinc/97/93/33/538979333.db2.gz NMWIESHBLJEDCV-UHFFFAOYSA-N 1 2 249.358 2.379 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H](C)OC3(CCC3)C2)on1 ZINC000335464010 398288852 /nfs/dbraw/zinc/28/88/52/398288852.db2.gz UESFSWIVRBBLKN-NSHDSACASA-N 1 2 236.315 2.126 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H](C)OC3(CCC3)C2)on1 ZINC000335464010 398288854 /nfs/dbraw/zinc/28/88/54/398288854.db2.gz UESFSWIVRBBLKN-NSHDSACASA-N 1 2 236.315 2.126 20 0 BEADLO CC(C)N(C)c1ccc(-c2[nH+]ccn2C)cn1 ZINC000630053384 361923820 /nfs/dbraw/zinc/92/38/20/361923820.db2.gz UFJWZOJVZUDAAH-UHFFFAOYSA-N 1 2 230.315 2.327 20 0 BEADLO CC1(c2noc(CCn3cc[nH+]c3)n2)CCCC1 ZINC000624756116 342825051 /nfs/dbraw/zinc/82/50/51/342825051.db2.gz VYAJAYJEGZKIJB-UHFFFAOYSA-N 1 2 246.314 2.341 20 0 BEADLO C[C@@H]1CC[S@@](=O)CC[N@@H+]1Cc1cccs1 ZINC000335464480 398289746 /nfs/dbraw/zinc/28/97/46/398289746.db2.gz LFZJMARYXLBYBF-MEBBXXQBSA-N 1 2 243.397 2.091 20 0 BEADLO C[C@@H]1CC[S@@](=O)CC[N@H+]1Cc1cccs1 ZINC000335464480 398289747 /nfs/dbraw/zinc/28/97/47/398289747.db2.gz LFZJMARYXLBYBF-MEBBXXQBSA-N 1 2 243.397 2.091 20 0 BEADLO COc1cnccc1[C@@H](C)[NH2+]Cc1ncc(C)o1 ZINC000187064570 538975843 /nfs/dbraw/zinc/97/58/43/538975843.db2.gz LUZFAZTTXCLGNR-SNVBAGLBSA-N 1 2 247.298 2.237 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+][C@@H]1CSC1(C)C ZINC000380115076 538985542 /nfs/dbraw/zinc/98/55/42/538985542.db2.gz PGXDDESFHLEHLL-GMSGAONNSA-N 1 2 225.361 2.263 20 0 BEADLO Cn1ccc(C[NH2+][C@H]2CCCC2(F)F)c1 ZINC000380168190 538986469 /nfs/dbraw/zinc/98/64/69/538986469.db2.gz FTAGZUVGSVLDKH-JTQLQIEISA-N 1 2 214.259 2.303 20 0 BEADLO C[C@@H](O)[C@@H](C)n1cc[nH+]c1-c1ccccc1 ZINC000044186918 538987618 /nfs/dbraw/zinc/98/76/18/538987618.db2.gz DWJCYQSLAZIJJS-GHMZBOCLSA-N 1 2 216.284 2.492 20 0 BEADLO C[C@H]1CCCC[C@H]1NC(=O)CCc1c[nH+]c[nH]1 ZINC000188846044 538979921 /nfs/dbraw/zinc/97/99/21/538979921.db2.gz HLGFNCSTBOFFKC-CMPLNLGQSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H]1CCCC[C@H]1NC(=O)CCc1c[nH]c[nH+]1 ZINC000188846044 538979922 /nfs/dbraw/zinc/97/99/22/538979922.db2.gz HLGFNCSTBOFFKC-CMPLNLGQSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H]1CCC[C@H](C)N(C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000189429869 538982495 /nfs/dbraw/zinc/98/24/95/538982495.db2.gz NFEKMZYJNSNQPU-NEPJUHHUSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H]1CCC[C@H](C)N(C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000189429869 538982496 /nfs/dbraw/zinc/98/24/96/538982496.db2.gz NFEKMZYJNSNQPU-NEPJUHHUSA-N 1 2 249.358 2.379 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N1CCC[C@H]2CCC[C@@H]21 ZINC000189439312 538983075 /nfs/dbraw/zinc/98/30/75/538983075.db2.gz HSAQIBPBUMGZAY-YPMHNXCESA-N 1 2 247.342 2.133 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N1CCC[C@H]2CCC[C@@H]21 ZINC000189439312 538983076 /nfs/dbraw/zinc/98/30/76/538983076.db2.gz HSAQIBPBUMGZAY-YPMHNXCESA-N 1 2 247.342 2.133 20 0 BEADLO CCn1cc[nH+]c1CN[C@@H]1CCCC1(F)F ZINC000381489591 539002302 /nfs/dbraw/zinc/00/23/02/539002302.db2.gz WVBNCNGLIPNAQD-SECBINFHSA-N 1 2 229.274 2.180 20 0 BEADLO Cc1n[nH]cc1C[NH2+]C1(C(F)F)CCCC1 ZINC000381556491 539003584 /nfs/dbraw/zinc/00/35/84/539003584.db2.gz PDWLANOVXKIUKQ-UHFFFAOYSA-N 1 2 229.274 2.386 20 0 BEADLO CSc1ccncc1NCc1c[nH+]cn1C ZINC000381574165 539004271 /nfs/dbraw/zinc/00/42/71/539004271.db2.gz ZAJDLJBZLHSHIG-UHFFFAOYSA-N 1 2 234.328 2.149 20 0 BEADLO COc1ccc(CNc2c[nH]c[nH+]2)cc1C ZINC000381594103 539004830 /nfs/dbraw/zinc/00/48/30/539004830.db2.gz KSQFYTKRCZTKAL-UHFFFAOYSA-N 1 2 217.272 2.339 20 0 BEADLO Cc1c(C(=O)Nc2cc[nH+]cc2C)ccn1C ZINC000195249757 539010017 /nfs/dbraw/zinc/01/00/17/539010017.db2.gz OMIKDSAOMIGYLM-UHFFFAOYSA-N 1 2 229.283 2.289 20 0 BEADLO C[C@H](C[N@@H+]1CCC(=O)C1)c1ccccc1 ZINC000127085393 342839251 /nfs/dbraw/zinc/83/92/51/342839251.db2.gz WSBWRSXBQLAGIV-LLVKDONJSA-N 1 2 203.285 2.065 20 0 BEADLO C[C@H](C[N@H+]1CCC(=O)C1)c1ccccc1 ZINC000127085393 342839252 /nfs/dbraw/zinc/83/92/52/342839252.db2.gz WSBWRSXBQLAGIV-LLVKDONJSA-N 1 2 203.285 2.065 20 0 BEADLO CCc1cc(N[C@H](CO)C2CCCC2)nc[nH+]1 ZINC000386344864 539013468 /nfs/dbraw/zinc/01/34/68/539013468.db2.gz MDBBSXKALAZYHP-GFCCVEGCSA-N 1 2 235.331 2.002 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2nccs2)ncn1 ZINC000381257178 538997053 /nfs/dbraw/zinc/99/70/53/538997053.db2.gz QYQIJYOLKJCYCR-SECBINFHSA-N 1 2 234.328 2.092 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2nccs2)ncn1 ZINC000381257179 538997272 /nfs/dbraw/zinc/99/72/72/538997272.db2.gz QYQIJYOLKJCYCR-VIFPVBQESA-N 1 2 234.328 2.092 20 0 BEADLO C[C@H]1CCC[C@H](CNC(=O)CCc2c[nH+]c[nH]2)C1 ZINC000192865222 538998748 /nfs/dbraw/zinc/99/87/48/538998748.db2.gz YUMDTPXVKQSMRP-RYUDHWBXSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H]1CCC[C@H](CNC(=O)CCc2c[nH]c[nH+]2)C1 ZINC000192865222 538998749 /nfs/dbraw/zinc/99/87/49/538998749.db2.gz YUMDTPXVKQSMRP-RYUDHWBXSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1CCC[C@@H](CNC(=O)CCc2c[nH+]c[nH]2)C1 ZINC000192865233 538998892 /nfs/dbraw/zinc/99/88/92/538998892.db2.gz YUMDTPXVKQSMRP-VXGBXAGGSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1CCC[C@@H](CNC(=O)CCc2c[nH]c[nH+]2)C1 ZINC000192865233 538998893 /nfs/dbraw/zinc/99/88/93/538998893.db2.gz YUMDTPXVKQSMRP-VXGBXAGGSA-N 1 2 249.358 2.285 20 0 BEADLO CC[C@H](C)NC(=O)[C@@H](C)[N@H+](C)Cc1ccco1 ZINC000042334349 361980226 /nfs/dbraw/zinc/98/02/26/361980226.db2.gz LZBADLYMKNYQRR-WDEREUQCSA-N 1 2 238.331 2.015 20 0 BEADLO CC[C@H](C)NC(=O)[C@@H](C)[N@@H+](C)Cc1ccco1 ZINC000042334349 361980235 /nfs/dbraw/zinc/98/02/35/361980235.db2.gz LZBADLYMKNYQRR-WDEREUQCSA-N 1 2 238.331 2.015 20 0 BEADLO CC[C@H](C)NC(=O)[C@H](C)[N@H+](C)Cc1ccco1 ZINC000042334353 361980376 /nfs/dbraw/zinc/98/03/76/361980376.db2.gz LZBADLYMKNYQRR-QWRGUYRKSA-N 1 2 238.331 2.015 20 0 BEADLO CC[C@H](C)NC(=O)[C@H](C)[N@@H+](C)Cc1ccco1 ZINC000042334353 361980380 /nfs/dbraw/zinc/98/03/80/361980380.db2.gz LZBADLYMKNYQRR-QWRGUYRKSA-N 1 2 238.331 2.015 20 0 BEADLO CC[C@@H]([NH2+]CC(F)F)c1c(C)nn(C)c1C ZINC000390791369 539027420 /nfs/dbraw/zinc/02/74/20/539027420.db2.gz CFODTRKXHMZKQE-SECBINFHSA-N 1 2 231.290 2.343 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1CCO[C@@H](C)C1 ZINC000388717922 539015129 /nfs/dbraw/zinc/01/51/29/539015129.db2.gz NBPKPLNLYZEOKA-WDEREUQCSA-N 1 2 236.315 2.317 20 0 BEADLO CC[N@H+](Cc1scnc1C1CC1)C1COC1 ZINC000449421485 398298321 /nfs/dbraw/zinc/29/83/21/398298321.db2.gz AMURMLGLRPHPDG-UHFFFAOYSA-N 1 2 238.356 2.241 20 0 BEADLO CC[N@@H+](Cc1scnc1C1CC1)C1COC1 ZINC000449421485 398298322 /nfs/dbraw/zinc/29/83/22/398298322.db2.gz AMURMLGLRPHPDG-UHFFFAOYSA-N 1 2 238.356 2.241 20 0 BEADLO CCc1cc(N[C@@H](C)[C@@H]2CCCOC2)nc[nH+]1 ZINC000388898159 539015532 /nfs/dbraw/zinc/01/55/32/539015532.db2.gz MDCLDOWRCYBHDO-WDEREUQCSA-N 1 2 235.331 2.266 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1snnc1C ZINC000649505268 398300250 /nfs/dbraw/zinc/30/02/50/398300250.db2.gz BBSPZSFBOOZMDC-UHFFFAOYSA-N 1 2 237.328 2.462 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1snnc1C ZINC000649505268 398300251 /nfs/dbraw/zinc/30/02/51/398300251.db2.gz BBSPZSFBOOZMDC-UHFFFAOYSA-N 1 2 237.328 2.462 20 0 BEADLO CC[NH+](CC)Cc1noc(C2CCC2)n1 ZINC000625061179 342847345 /nfs/dbraw/zinc/84/73/45/342847345.db2.gz LRZQJLSMCVXDRF-UHFFFAOYSA-N 1 2 209.293 2.179 20 0 BEADLO C(c1noc(C2CCC2)n1)[NH+]1C2CCC1CC2 ZINC000625078463 342849616 /nfs/dbraw/zinc/84/96/16/342849616.db2.gz RNVNZSMCBPIUTE-UHFFFAOYSA-N 1 2 233.315 2.464 20 0 BEADLO C[C@H](c1ccccc1)[N@@H+]1CCN(C2CC2)C(=O)C1 ZINC000335646353 136243982 /nfs/dbraw/zinc/24/39/82/136243982.db2.gz GUOJYNZDMMUGKU-GFCCVEGCSA-N 1 2 244.338 2.054 20 0 BEADLO C[C@H](c1ccccc1)[N@H+]1CCN(C2CC2)C(=O)C1 ZINC000335646353 136243983 /nfs/dbraw/zinc/24/39/83/136243983.db2.gz GUOJYNZDMMUGKU-GFCCVEGCSA-N 1 2 244.338 2.054 20 0 BEADLO Cc1nccnc1C[NH2+][C@@H](C)c1ccccn1 ZINC000621326045 342867976 /nfs/dbraw/zinc/86/79/76/342867976.db2.gz WFWMRAQKAFHUHA-JTQLQIEISA-N 1 2 228.299 2.031 20 0 BEADLO CC[C@@H](C)[NH2+][C@H](Cc1ccccc1)C(=O)OC ZINC000038066894 342875116 /nfs/dbraw/zinc/87/51/16/342875116.db2.gz YRSMFCKMTZFEFW-DGCLKSJQSA-N 1 2 235.327 2.159 20 0 BEADLO Cc1nc(N2CCc3ccccc3CC2)cc[nH+]1 ZINC000078265227 398309119 /nfs/dbraw/zinc/30/91/19/398309119.db2.gz UJORTZPVBSCVSO-UHFFFAOYSA-N 1 2 239.322 2.390 20 0 BEADLO COc1cncc(C[NH+]2Cc3ccccc3C2)n1 ZINC000625149273 342893986 /nfs/dbraw/zinc/89/39/86/342893986.db2.gz HZHIPGDXUWDSFI-UHFFFAOYSA-N 1 2 241.294 2.001 20 0 BEADLO CC[C@@H](C)C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000336342825 398318055 /nfs/dbraw/zinc/31/80/55/398318055.db2.gz KOYBOSVHNNRALI-ZJUUUORDSA-N 1 2 221.304 2.119 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2noc(C3CCC3)n2)C1 ZINC000625127870 342881462 /nfs/dbraw/zinc/88/14/62/342881462.db2.gz SMJDIRGIRKRDSL-SECBINFHSA-N 1 2 221.304 2.179 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2noc(C3CCC3)n2)C1 ZINC000625127870 342881463 /nfs/dbraw/zinc/88/14/63/342881463.db2.gz SMJDIRGIRKRDSL-SECBINFHSA-N 1 2 221.304 2.179 20 0 BEADLO FC(F)C[NH2+]Cc1ccc(C(F)F)nc1 ZINC000631134977 342883763 /nfs/dbraw/zinc/88/37/63/342883763.db2.gz RBTPYOORUXLRIA-UHFFFAOYSA-N 1 2 222.185 2.374 20 0 BEADLO C[C@H]1CCC[N@@H+]1Cc1noc(C2CCC2)n1 ZINC000625202038 342910020 /nfs/dbraw/zinc/91/00/20/342910020.db2.gz AKBSUJYAGLVMMZ-VIFPVBQESA-N 1 2 221.304 2.321 20 0 BEADLO C[C@H]1CCC[N@H+]1Cc1noc(C2CCC2)n1 ZINC000625202038 342910021 /nfs/dbraw/zinc/91/00/21/342910021.db2.gz AKBSUJYAGLVMMZ-VIFPVBQESA-N 1 2 221.304 2.321 20 0 BEADLO COc1ccc(C[NH2+][C@@H](C)c2ccon2)cc1O ZINC000351572274 136247111 /nfs/dbraw/zinc/24/71/11/136247111.db2.gz CMMQOYUOSNOQGF-VIFPVBQESA-N 1 2 248.282 2.240 20 0 BEADLO CCC(F)(F)CNc1cc[nH+]c(C2CC2)n1 ZINC000624560046 344010186 /nfs/dbraw/zinc/01/01/86/344010186.db2.gz KZPUVRULCZMORE-UHFFFAOYSA-N 1 2 227.258 2.233 20 0 BEADLO CC[C@@H](CC(=O)NCCc1[nH]cc[nH+]1)C(C)C ZINC000174759219 529450206 /nfs/dbraw/zinc/45/02/06/529450206.db2.gz UONBOQNNCBUIIR-NSHDSACASA-N 1 2 237.347 2.141 20 0 BEADLO CC[C@H]([NH2+]Cc1nnc(C)[nH]1)c1ccccc1F ZINC000392400881 398330148 /nfs/dbraw/zinc/33/01/48/398330148.db2.gz RLKPLPIPPKUIKM-LBPRGKRZSA-N 1 2 248.305 2.493 20 0 BEADLO CC[C@H](NC(=O)C1CC(C)(C)C1)c1[nH]cc[nH+]1 ZINC000354774301 398330275 /nfs/dbraw/zinc/33/02/75/398330275.db2.gz VCXBHVPZJSAXIZ-JTQLQIEISA-N 1 2 235.331 2.413 20 0 BEADLO Cc1[nH]c(CN2C[C@H](C)OC(C)(C)C2)[nH+]c1C ZINC000628154180 398336273 /nfs/dbraw/zinc/33/62/73/398336273.db2.gz PDOCKLMLOXMMGA-VIFPVBQESA-N 1 2 237.347 2.026 20 0 BEADLO CC(C)c1nc(C[N@H+](C)[C@@H]2CCSC2)no1 ZINC000119903293 398333113 /nfs/dbraw/zinc/33/31/13/398333113.db2.gz BFNXEGSXQAEFHI-SECBINFHSA-N 1 2 241.360 2.130 20 0 BEADLO CC(C)c1nc(C[N@@H+](C)[C@@H]2CCSC2)no1 ZINC000119903293 398333114 /nfs/dbraw/zinc/33/31/14/398333114.db2.gz BFNXEGSXQAEFHI-SECBINFHSA-N 1 2 241.360 2.130 20 0 BEADLO Cc1nc([C@H]2CCC[N@H+]2CC[C@@H](C)F)no1 ZINC000351759871 136252220 /nfs/dbraw/zinc/25/22/20/136252220.db2.gz MSHVZOUPPZMKJF-PSASIEDQSA-N 1 2 227.283 2.263 20 0 BEADLO Cc1nc([C@H]2CCC[N@@H+]2CC[C@@H](C)F)no1 ZINC000351759871 136252221 /nfs/dbraw/zinc/25/22/21/136252221.db2.gz MSHVZOUPPZMKJF-PSASIEDQSA-N 1 2 227.283 2.263 20 0 BEADLO CO[C@]1(C)C[C@@H](N(C)c2cc(C)[nH+]cn2)C1(C)C ZINC000301550163 187205636 /nfs/dbraw/zinc/20/56/36/187205636.db2.gz GMGKETULRRRCEF-BXUZGUMPSA-N 1 2 249.358 2.425 20 0 BEADLO CC(C)(C)c1nc(NCc2ccon2)cc[nH+]1 ZINC000301605564 187205804 /nfs/dbraw/zinc/20/58/04/187205804.db2.gz YFBIKSGRDOTWAL-UHFFFAOYSA-N 1 2 232.287 2.374 20 0 BEADLO CCc1cc(C)c(C(=O)N(C)Cc2[nH]cc[nH+]2)o1 ZINC000487610972 529522201 /nfs/dbraw/zinc/52/22/01/529522201.db2.gz UIDNBFQQEMDEIC-UHFFFAOYSA-N 1 2 247.298 2.146 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N1CCCC1(C)C ZINC000492684513 529551367 /nfs/dbraw/zinc/55/13/67/529551367.db2.gz VBFYKACVOXITMQ-VOTSOKGWSA-N 1 2 247.342 2.317 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)NC[C@@H](C)C(C)C ZINC000492465787 529559444 /nfs/dbraw/zinc/55/94/44/529559444.db2.gz ZDJVPJLEEGVPCU-ZHRWSRJISA-N 1 2 249.358 2.325 20 0 BEADLO O=C1CC[NH+](Cc2ccc3ccccc3n2)CC1 ZINC000020246587 342978588 /nfs/dbraw/zinc/97/85/88/342978588.db2.gz CDWVSLBYEKADAY-UHFFFAOYSA-N 1 2 240.306 2.400 20 0 BEADLO Cc1cnc(C[N@@H+]2CC[C@](C)(F)C2)s1 ZINC000335901097 136259170 /nfs/dbraw/zinc/25/91/70/136259170.db2.gz BKFMOIASEHTOGR-JTQLQIEISA-N 1 2 214.309 2.385 20 0 BEADLO Cc1cnc(C[N@H+]2CC[C@](C)(F)C2)s1 ZINC000335901097 136259171 /nfs/dbraw/zinc/25/91/71/136259171.db2.gz BKFMOIASEHTOGR-JTQLQIEISA-N 1 2 214.309 2.385 20 0 BEADLO CC(C)[C@@H]1C[C@H]1C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000357577764 187214545 /nfs/dbraw/zinc/21/45/45/187214545.db2.gz DUEAKSSIXDEMER-QJPTWQEYSA-N 1 2 247.342 2.365 20 0 BEADLO COC(=O)c1coc([C@@H](C)[N@H+]2[C@H](C)C[C@@H]2C)n1 ZINC000602821413 349762208 /nfs/dbraw/zinc/76/22/08/349762208.db2.gz LVOZTAIBFNWLKG-HRDYMLBCSA-N 1 2 238.287 2.005 20 0 BEADLO COC(=O)c1coc([C@@H](C)[N@@H+]2[C@H](C)C[C@@H]2C)n1 ZINC000602821413 349762212 /nfs/dbraw/zinc/76/22/12/349762212.db2.gz LVOZTAIBFNWLKG-HRDYMLBCSA-N 1 2 238.287 2.005 20 0 BEADLO COC(=O)C[N@H+](Cc1ccccc1F)C(C)C ZINC000049949261 343019187 /nfs/dbraw/zinc/01/91/87/343019187.db2.gz VKYALCQUYHQNST-UHFFFAOYSA-N 1 2 239.290 2.209 20 0 BEADLO COC(=O)C[N@@H+](Cc1ccccc1F)C(C)C ZINC000049949261 343019190 /nfs/dbraw/zinc/01/91/90/343019190.db2.gz VKYALCQUYHQNST-UHFFFAOYSA-N 1 2 239.290 2.209 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)[C@]12C[C@H]1CCC2 ZINC000421537060 192348865 /nfs/dbraw/zinc/34/88/65/192348865.db2.gz ACIZEAPCENKZBR-QMTHXVAHSA-N 1 2 241.294 2.463 20 0 BEADLO Cc1cc(NCCOC(C)(C)C)nc[nH+]1 ZINC000309097095 259342343 /nfs/dbraw/zinc/34/23/43/259342343.db2.gz FHGDKRIMSVVICK-UHFFFAOYSA-N 1 2 209.293 2.012 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCC[C@](C)(C(=O)OC)C1 ZINC000602844506 349781712 /nfs/dbraw/zinc/78/17/12/349781712.db2.gz AHMLBHQOBOKTGE-NSHDSACASA-N 1 2 249.301 2.307 20 0 BEADLO CCC(F)(F)C[N@H+]1CCC[C@](C)(C(=O)OC)C1 ZINC000602844506 349781713 /nfs/dbraw/zinc/78/17/13/349781713.db2.gz AHMLBHQOBOKTGE-NSHDSACASA-N 1 2 249.301 2.307 20 0 BEADLO CC(C)=CC(=O)N1CCC[C@H](c2[nH+]ccn2C)C1 ZINC000373045897 187222923 /nfs/dbraw/zinc/22/29/23/187222923.db2.gz UCKBKZHWWCEMLT-LBPRGKRZSA-N 1 2 247.342 2.092 20 0 BEADLO C[C@@H]1C[NH+](Cc2cnc[nH]2)C[C@@H](C)C1(F)F ZINC000625656006 344025504 /nfs/dbraw/zinc/02/55/04/344025504.db2.gz YKXNODSSSLEMOC-RKDXNWHRSA-N 1 2 229.274 2.133 20 0 BEADLO Cn1cc[nH+]c1CSc1ccc(O)cc1 ZINC000038078865 343059674 /nfs/dbraw/zinc/05/96/74/343059674.db2.gz QEAZLUVPHKYYBZ-UHFFFAOYSA-N 1 2 220.297 2.418 20 0 BEADLO CCOc1cccc(OCc2c[nH+]cn2C)c1 ZINC000634555090 362045365 /nfs/dbraw/zinc/04/53/65/362045365.db2.gz ZSSUXBWEULJQJW-UHFFFAOYSA-N 1 2 232.283 2.398 20 0 BEADLO FC1(F)C[C@H]1CC[NH+]=c1[nH]c2ccccc2[nH]1 ZINC000621344643 343105964 /nfs/dbraw/zinc/10/59/64/343105964.db2.gz OMURWECFDRRIJM-MRVPVSSYSA-N 1 2 237.253 2.442 20 0 BEADLO CC[C@H](Cc1cccs1)[NH2+][C@@H](C)C(=O)OC ZINC000310019408 343180243 /nfs/dbraw/zinc/18/02/43/343180243.db2.gz MKFSHYJAFAMAON-VHSXEESVSA-N 1 2 241.356 2.220 20 0 BEADLO CC[C@@H](Cc1cccs1)[NH2+][C@H](C)C(=O)OC ZINC000310019409 343180261 /nfs/dbraw/zinc/18/02/61/343180261.db2.gz MKFSHYJAFAMAON-ZJUUUORDSA-N 1 2 241.356 2.220 20 0 BEADLO CSc1ccc([C@@H](C)[NH2+]Cc2cnn[nH]2)cc1 ZINC000295486401 187241565 /nfs/dbraw/zinc/24/15/65/187241565.db2.gz ZAAHVNMLLYNSIC-SECBINFHSA-N 1 2 248.355 2.377 20 0 BEADLO CSc1ccc([C@@H](C)[NH2+]Cc2c[nH]nn2)cc1 ZINC000295486401 187241567 /nfs/dbraw/zinc/24/15/67/187241567.db2.gz ZAAHVNMLLYNSIC-SECBINFHSA-N 1 2 248.355 2.377 20 0 BEADLO CSc1ccc([C@@H](C)[NH2+]Cc2cn[nH]n2)cc1 ZINC000295486401 187241569 /nfs/dbraw/zinc/24/15/69/187241569.db2.gz ZAAHVNMLLYNSIC-SECBINFHSA-N 1 2 248.355 2.377 20 0 BEADLO CC1CCN(c2cc(NC3CC3)[nH+]cn2)CC1 ZINC000240646137 259353592 /nfs/dbraw/zinc/35/35/92/259353592.db2.gz AEXQYQHBQPBGFX-UHFFFAOYSA-N 1 2 232.331 2.287 20 0 BEADLO CC1CCN(c2cc(NC3CC3)nc[nH+]2)CC1 ZINC000240646137 259353593 /nfs/dbraw/zinc/35/35/93/259353593.db2.gz AEXQYQHBQPBGFX-UHFFFAOYSA-N 1 2 232.331 2.287 20 0 BEADLO CCn1cc[nH+]c1CNc1ccc(C)nc1 ZINC000149805365 323038242 /nfs/dbraw/zinc/03/82/42/323038242.db2.gz TXGWTWRCVIDEEC-UHFFFAOYSA-N 1 2 216.288 2.219 20 0 BEADLO CCO[C@@H](C[N@@H+]1CCC(F)(F)C1)C1CC1 ZINC000625302092 343227594 /nfs/dbraw/zinc/22/75/94/343227594.db2.gz DIFZBVHNJXQBMC-JTQLQIEISA-N 1 2 219.275 2.143 20 0 BEADLO CCO[C@@H](C[N@H+]1CCC(F)(F)C1)C1CC1 ZINC000625302092 343227596 /nfs/dbraw/zinc/22/75/96/343227596.db2.gz DIFZBVHNJXQBMC-JTQLQIEISA-N 1 2 219.275 2.143 20 0 BEADLO COc1cc[nH+]c(Cn2cc(C(C)(C)C)nn2)c1 ZINC000641030826 362145512 /nfs/dbraw/zinc/14/55/12/362145512.db2.gz LLZXNZRIZWIVGR-UHFFFAOYSA-N 1 2 246.314 2.028 20 0 BEADLO c1cn(-c2cccc(Oc3ncccn3)c2)c[nH+]1 ZINC000077982046 343253093 /nfs/dbraw/zinc/25/30/93/343253093.db2.gz APDJIQXXCJVVAQ-UHFFFAOYSA-N 1 2 238.250 2.455 20 0 BEADLO COc1ccc(C[N@@H+]2CCOC[C@H]2C)cc1F ZINC000046774369 343259847 /nfs/dbraw/zinc/25/98/47/343259847.db2.gz OBSZKYUVLBPGBJ-SNVBAGLBSA-N 1 2 239.290 2.055 20 0 BEADLO COc1ccc(C[N@H+]2CCOC[C@H]2C)cc1F ZINC000046774369 343259850 /nfs/dbraw/zinc/25/98/50/343259850.db2.gz OBSZKYUVLBPGBJ-SNVBAGLBSA-N 1 2 239.290 2.055 20 0 BEADLO COc1ccccc1CNc1ccc(CO)c[nH+]1 ZINC000340573890 136291080 /nfs/dbraw/zinc/29/10/80/136291080.db2.gz HQNIYWVRHSQTAD-UHFFFAOYSA-N 1 2 244.294 2.195 20 0 BEADLO CN(C)c1ccc(NC2CCSCC2)c[nH+]1 ZINC000036989147 343329639 /nfs/dbraw/zinc/32/96/39/343329639.db2.gz GLXOOKKAQWQWRG-UHFFFAOYSA-N 1 2 237.372 2.455 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H](C)CCc1ccccc1 ZINC000037074004 343332803 /nfs/dbraw/zinc/33/28/03/343332803.db2.gz CVDPSKOARRFWKX-RYUDHWBXSA-N 1 2 235.327 2.159 20 0 BEADLO C/C=C/c1cn(Cc2ccc[nH+]c2C)nn1 ZINC000641051210 362164510 /nfs/dbraw/zinc/16/45/10/362164510.db2.gz ISUXGGXCCJFWCA-HWKANZROSA-N 1 2 214.272 2.063 20 0 BEADLO CCOc1cccc(C[NH2+]Cc2cn[nH]c2C)c1 ZINC000037996020 343364230 /nfs/dbraw/zinc/36/42/30/343364230.db2.gz QGBDJZCTFHGNCV-UHFFFAOYSA-N 1 2 245.326 2.407 20 0 BEADLO C[C@@H]1CC(C(=O)NCc2[nH+]ccn2C)C[C@@H](C)C1 ZINC000272614358 187337435 /nfs/dbraw/zinc/33/74/35/187337435.db2.gz ZXFBLFZOCICHTF-QWRGUYRKSA-N 1 2 249.358 2.109 20 0 BEADLO CC(C)CC(=O)Nc1ccc(-n2cc[nH+]c2)nc1 ZINC000037170499 343337853 /nfs/dbraw/zinc/33/78/53/343337853.db2.gz CTCDXZLOVHBGHD-UHFFFAOYSA-N 1 2 244.298 2.252 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@@H](C)C[C@H]2C(N)=O)on1 ZINC000335673908 136317227 /nfs/dbraw/zinc/31/72/27/136317227.db2.gz BIQMWNACRYZBOR-KCJUWKMLSA-N 1 2 237.303 2.119 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@@H](C)C[C@H]2C(N)=O)on1 ZINC000335673908 136317228 /nfs/dbraw/zinc/31/72/28/136317228.db2.gz BIQMWNACRYZBOR-KCJUWKMLSA-N 1 2 237.303 2.119 20 0 BEADLO CC(C)c1noc(C[N@H+]2[C@H](C)C[C@@H]2C)n1 ZINC000335689912 136324709 /nfs/dbraw/zinc/32/47/09/136324709.db2.gz FCUWHMSQQGHXJU-DTORHVGOSA-N 1 2 209.293 2.176 20 0 BEADLO CC(C)c1noc(C[N@@H+]2[C@H](C)C[C@@H]2C)n1 ZINC000335689912 136324710 /nfs/dbraw/zinc/32/47/10/136324710.db2.gz FCUWHMSQQGHXJU-DTORHVGOSA-N 1 2 209.293 2.176 20 0 BEADLO OC[C@H]1CCC[N@H+](Cc2ncc(Cl)s2)C1 ZINC000335692551 136325913 /nfs/dbraw/zinc/32/59/13/136325913.db2.gz JPSLVLULYQUMLK-QMMMGPOBSA-N 1 2 246.763 2.001 20 0 BEADLO OC[C@H]1CCC[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000335692551 136325914 /nfs/dbraw/zinc/32/59/14/136325914.db2.gz JPSLVLULYQUMLK-QMMMGPOBSA-N 1 2 246.763 2.001 20 0 BEADLO Cc1cc(NC(=O)N2CC(C)=C[C@H](C)C2)cc[nH+]1 ZINC000335697712 136327297 /nfs/dbraw/zinc/32/72/97/136327297.db2.gz GKORDNUUBKDSCW-JTQLQIEISA-N 1 2 245.326 2.242 20 0 BEADLO Cc1[nH+]cc(CN2CCC(F)(F)[C@@H](C)C2)n1C ZINC000668178334 488215171 /nfs/dbraw/zinc/21/51/71/488215171.db2.gz TYDRJBALIZAGPC-VIFPVBQESA-N 1 2 243.301 2.206 20 0 BEADLO CSC[C@H](C)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000081000895 343415510 /nfs/dbraw/zinc/41/55/10/343415510.db2.gz OQVFFXSESDUKCB-ZETCQYMHSA-N 1 2 236.344 2.430 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC[C@H]2c2ncc[nH]2)cn1 ZINC000335720475 136345909 /nfs/dbraw/zinc/34/59/09/136345909.db2.gz ZFPCBFFCBMHEID-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc(C[N@H+]2CCC[C@H]2c2ncc[nH]2)cn1 ZINC000335720475 136345910 /nfs/dbraw/zinc/34/59/10/136345910.db2.gz ZFPCBFFCBMHEID-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Nc1ccc(NC(=O)[C@H]2CC23CCCC3)c[nH+]1 ZINC000335730115 136348616 /nfs/dbraw/zinc/34/86/16/136348616.db2.gz GEBSGFLSWJFEPD-SNVBAGLBSA-N 1 2 231.299 2.013 20 0 BEADLO CC(C)n1cc[nH+]c1CN[C@H](C)c1ccon1 ZINC000349249396 136333168 /nfs/dbraw/zinc/33/31/68/136333168.db2.gz XGBSUTRJDGFMTN-SNVBAGLBSA-N 1 2 234.303 2.303 20 0 BEADLO C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)S1=O ZINC000335709022 136337057 /nfs/dbraw/zinc/33/70/57/136337057.db2.gz ZQOISCGHBOBKNC-RYUDHWBXSA-N 1 2 237.368 2.028 20 0 BEADLO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ncc[nH]1 ZINC000335714877 136338661 /nfs/dbraw/zinc/33/86/61/136338661.db2.gz SRKNYTQNAFUZRK-JGVFFNPUSA-N 1 2 233.237 2.182 20 0 BEADLO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ncc[nH]1 ZINC000335714877 136338662 /nfs/dbraw/zinc/33/86/62/136338662.db2.gz SRKNYTQNAFUZRK-JGVFFNPUSA-N 1 2 233.237 2.182 20 0 BEADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1nccn1C ZINC000335714848 136338761 /nfs/dbraw/zinc/33/87/61/136338761.db2.gz PSEADFFKOKGPNF-RKDXNWHRSA-N 1 2 247.264 2.193 20 0 BEADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1nccn1C ZINC000335714848 136338762 /nfs/dbraw/zinc/33/87/62/136338762.db2.gz PSEADFFKOKGPNF-RKDXNWHRSA-N 1 2 247.264 2.193 20 0 BEADLO C[C@H]1C[C@@H]1CC(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000335842934 136354542 /nfs/dbraw/zinc/35/45/42/136354542.db2.gz FRSVHNFYJGOAIT-CMPLNLGQSA-N 1 2 247.342 2.162 20 0 BEADLO C[C@H]1C[C@@H]1CC(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000335842934 136354543 /nfs/dbraw/zinc/35/45/43/136354543.db2.gz FRSVHNFYJGOAIT-CMPLNLGQSA-N 1 2 247.342 2.162 20 0 BEADLO CC[C@@H](C)NC(=O)c1ccc2[nH+]c(C)n(C)c2c1 ZINC000335843391 136354742 /nfs/dbraw/zinc/35/47/42/136354742.db2.gz DBHCJXAPPBNNJJ-SECBINFHSA-N 1 2 245.326 2.410 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CCC23CCC3)[nH]1 ZINC000335879402 136356503 /nfs/dbraw/zinc/35/65/03/136356503.db2.gz YNGYOFHVIPEKOT-UHFFFAOYSA-N 1 2 220.320 2.057 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CCC23CCC3)[nH]1 ZINC000335879402 136356504 /nfs/dbraw/zinc/35/65/04/136356504.db2.gz YNGYOFHVIPEKOT-UHFFFAOYSA-N 1 2 220.320 2.057 20 0 BEADLO Cc1cc(C)c(NC(=O)NCC(F)F)c(C)[nH+]1 ZINC000335897788 136359613 /nfs/dbraw/zinc/35/96/13/136359613.db2.gz JUNYRJUGJCNGJD-UHFFFAOYSA-N 1 2 243.257 2.393 20 0 BEADLO CC[C@](C)([NH2+]C[C@@H]1CCOC1)C(F)(F)F ZINC000379931647 365744205 /nfs/dbraw/zinc/74/42/05/365744205.db2.gz OXHTXBSVMOTFAK-IUCAKERBSA-N 1 2 225.254 2.344 20 0 BEADLO CC[C@](C)([NH2+]C[C@H]1CCOC1)C(F)(F)F ZINC000379931641 365744446 /nfs/dbraw/zinc/74/44/46/365744446.db2.gz OXHTXBSVMOTFAK-BDAKNGLRSA-N 1 2 225.254 2.344 20 0 BEADLO C[C@H]([NH2+]Cc1cnn2ccccc12)c1ccon1 ZINC000351573559 136369234 /nfs/dbraw/zinc/36/92/34/136369234.db2.gz KVKKFIAGDFXIID-JTQLQIEISA-N 1 2 242.282 2.173 20 0 BEADLO C[C@@H](CC(=O)NCC1=CCCC1)n1cc[nH+]c1 ZINC000619999803 343544717 /nfs/dbraw/zinc/54/47/17/343544717.db2.gz AARDMDOUMLPSGC-NSHDSACASA-N 1 2 233.315 2.061 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C)C(C)(C)C ZINC000616561943 343504902 /nfs/dbraw/zinc/50/49/02/343504902.db2.gz OHGQMZWTVUQKNJ-GMTAPVOTSA-N 1 2 249.358 2.074 20 0 BEADLO CC(C)C[C@H]1CCN(C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000279318805 187341950 /nfs/dbraw/zinc/34/19/50/187341950.db2.gz BOSSHKOCIBFMOM-GFCCVEGCSA-N 1 2 249.358 2.237 20 0 BEADLO COC(=O)C[N@H+](C)Cc1ccc(C(C)C)cc1 ZINC000048584116 343584264 /nfs/dbraw/zinc/58/42/64/343584264.db2.gz KENGUJDKFOIWLV-UHFFFAOYSA-N 1 2 235.327 2.415 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1ccc(C(C)C)cc1 ZINC000048584116 343584265 /nfs/dbraw/zinc/58/42/65/343584265.db2.gz KENGUJDKFOIWLV-UHFFFAOYSA-N 1 2 235.327 2.415 20 0 BEADLO COc1ccc(C)cc1C[NH2+]Cc1nccn1C ZINC000071140839 343622124 /nfs/dbraw/zinc/62/21/24/343622124.db2.gz CZLHKXVOFGPZNK-UHFFFAOYSA-N 1 2 245.326 2.027 20 0 BEADLO CC(C)[C@H](NC(=O)CC1CC1)c1[nH]cc[nH+]1 ZINC000283051178 187343591 /nfs/dbraw/zinc/34/35/91/187343591.db2.gz QDUMLLIHOIIQNK-NSHDSACASA-N 1 2 221.304 2.023 20 0 BEADLO CC(C)(C)OC(=O)C[NH2+][C@H]1CCC1(C)C ZINC000379795483 343626706 /nfs/dbraw/zinc/62/67/06/343626706.db2.gz KHLPGPITWISKNL-VIFPVBQESA-N 1 2 213.321 2.106 20 0 BEADLO COc1ccccc1CNc1c[nH]c[nH+]1 ZINC000309067065 349825640 /nfs/dbraw/zinc/82/56/40/349825640.db2.gz AQRGKKKSXIAUOX-UHFFFAOYSA-N 1 2 203.245 2.030 20 0 BEADLO CCCC[C@H]([NH2+][C@@H]1CCC(F)(F)C1)C(=O)OC ZINC000379907991 343654194 /nfs/dbraw/zinc/65/41/94/343654194.db2.gz LCYBQOYGXRJGTK-ZJUUUORDSA-N 1 2 249.301 2.496 20 0 BEADLO CCCC[C@@H]([NH2+][C@@H]1CCC(F)(F)C1)C(=O)OC ZINC000379907986 343654225 /nfs/dbraw/zinc/65/42/25/343654225.db2.gz LCYBQOYGXRJGTK-NXEZZACHSA-N 1 2 249.301 2.496 20 0 BEADLO CCc1cc(NCC(F)(F)C(F)F)nc[nH+]1 ZINC000230715554 346956273 /nfs/dbraw/zinc/95/62/73/346956273.db2.gz DRIHVVYAZJNTBP-UHFFFAOYSA-N 1 2 237.200 2.351 20 0 BEADLO Cc1c[nH+]cc(N[C@@H]2CCCOCC2)c1 ZINC000225853114 346957053 /nfs/dbraw/zinc/95/70/53/346957053.db2.gz PWDQZVUPRDZZTE-LLVKDONJSA-N 1 2 206.289 2.371 20 0 BEADLO CC[N@H+](Cc1nnc(C)o1)Cc1ccccc1 ZINC000062639343 343743323 /nfs/dbraw/zinc/74/33/23/343743323.db2.gz LWKBGLKADBFWBK-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1nnc(C)o1)Cc1ccccc1 ZINC000062639343 343743326 /nfs/dbraw/zinc/74/33/26/343743326.db2.gz LWKBGLKADBFWBK-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccco2)C[C@@H](C)[S@]1=O ZINC000289254330 187347133 /nfs/dbraw/zinc/34/71/33/187347133.db2.gz FHNYPQURCVIEKR-NSODJVPESA-N 1 2 241.356 2.011 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccco2)C[C@@H](C)[S@]1=O ZINC000289254330 187347136 /nfs/dbraw/zinc/34/71/36/187347136.db2.gz FHNYPQURCVIEKR-NSODJVPESA-N 1 2 241.356 2.011 20 0 BEADLO CCC1(CC)CCN(C(=O)CCn2cc[nH+]c2)C1 ZINC000267948245 168454767 /nfs/dbraw/zinc/45/47/67/168454767.db2.gz ABVXARKXKMVUBE-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO COCCSCCC[N@@H+]1OC2CCC1CC2 ZINC000603033566 349860492 /nfs/dbraw/zinc/86/04/92/349860492.db2.gz ZYEIYYOYIPIUGS-UHFFFAOYSA-N 1 2 245.388 2.315 20 0 BEADLO COCCSCCC[N@H+]1OC2CCC1CC2 ZINC000603033566 349860494 /nfs/dbraw/zinc/86/04/94/349860494.db2.gz ZYEIYYOYIPIUGS-UHFFFAOYSA-N 1 2 245.388 2.315 20 0 BEADLO CSCCC[N@@H+]1OC2CCC1CC2 ZINC000603032536 349860631 /nfs/dbraw/zinc/86/06/31/349860631.db2.gz MHRZVRFEMQNABS-UHFFFAOYSA-N 1 2 201.335 2.298 20 0 BEADLO CSCCC[N@H+]1OC2CCC1CC2 ZINC000603032536 349860636 /nfs/dbraw/zinc/86/06/36/349860636.db2.gz MHRZVRFEMQNABS-UHFFFAOYSA-N 1 2 201.335 2.298 20 0 BEADLO CC1(C)COCC[N@@H+]1Cc1cccc(F)c1 ZINC000064247665 343756640 /nfs/dbraw/zinc/75/66/40/343756640.db2.gz NSSMGJVYRRFBLM-UHFFFAOYSA-N 1 2 223.291 2.437 20 0 BEADLO CC1(C)COCC[N@H+]1Cc1cccc(F)c1 ZINC000064247665 343756641 /nfs/dbraw/zinc/75/66/41/343756641.db2.gz NSSMGJVYRRFBLM-UHFFFAOYSA-N 1 2 223.291 2.437 20 0 BEADLO CCCCc1cc(N[C@@H](C)C(C)(C)O)nc[nH+]1 ZINC000631087633 343761483 /nfs/dbraw/zinc/76/14/83/343761483.db2.gz ZNHXFEBJOKNTCV-JTQLQIEISA-N 1 2 237.347 2.391 20 0 BEADLO CC(C)[C@@H]1N(C(=O)C=Cc2c[nH]c[nH+]2)CC1(C)C ZINC000294021193 187350570 /nfs/dbraw/zinc/35/05/70/187350570.db2.gz UABINJFSERHZPY-GFUIURDCSA-N 1 2 247.342 2.316 20 0 BEADLO CC[N@H+](Cc1cnc[nH]1)Cc1ccc(OC)cc1 ZINC000179327736 346981560 /nfs/dbraw/zinc/98/15/60/346981560.db2.gz SHVDSYGSZWTKDK-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO CCCCCCC(=O)N(C)Cc1[nH+]ccn1C ZINC000298202458 187352997 /nfs/dbraw/zinc/35/29/97/187352997.db2.gz ZDJMHSMBLCTMIR-UHFFFAOYSA-N 1 2 237.347 2.349 20 0 BEADLO CC(C)=CC(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000299694253 187353302 /nfs/dbraw/zinc/35/33/02/187353302.db2.gz XDKKJNOCUBTZQR-UHFFFAOYSA-N 1 2 233.315 2.082 20 0 BEADLO CC(C)(C)c1nc(NCc2ccns2)cc[nH+]1 ZINC000624436386 343868275 /nfs/dbraw/zinc/86/82/75/343868275.db2.gz FDQUVOPUGXXDLZ-UHFFFAOYSA-N 1 2 248.355 2.265 20 0 BEADLO Clc1cccnc1C[N@@H+]1C[C@@H]2C[C@H]1CS2 ZINC000625468591 343871422 /nfs/dbraw/zinc/87/14/22/343871422.db2.gz QHFACYRWWGUNAZ-IUCAKERBSA-N 1 2 240.759 2.425 20 0 BEADLO Clc1cccnc1C[N@H+]1C[C@@H]2C[C@H]1CS2 ZINC000625468591 343871424 /nfs/dbraw/zinc/87/14/24/343871424.db2.gz QHFACYRWWGUNAZ-IUCAKERBSA-N 1 2 240.759 2.425 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccon2)CCS1 ZINC000076072601 187278873 /nfs/dbraw/zinc/27/88/73/187278873.db2.gz LRMUHJMICNOVDH-SNVBAGLBSA-N 1 2 212.318 2.002 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccon2)CCS1 ZINC000076072601 187278875 /nfs/dbraw/zinc/27/88/75/187278875.db2.gz LRMUHJMICNOVDH-SNVBAGLBSA-N 1 2 212.318 2.002 20 0 BEADLO CCc1nc(CN[C@H]2CCn3cc[nH+]c32)cs1 ZINC000345358201 343907730 /nfs/dbraw/zinc/90/77/30/343907730.db2.gz WGUSHDASJJTSLR-JTQLQIEISA-N 1 2 248.355 2.137 20 0 BEADLO CCC[C@@H](C)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000603246568 349898605 /nfs/dbraw/zinc/89/86/05/349898605.db2.gz IPYRVCIRDLRXMM-OLZOCXBDSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1[nH]c(CN2CCn3cccc3[C@H]2C)[nH+]c1C ZINC000628119233 343970740 /nfs/dbraw/zinc/97/07/40/343970740.db2.gz ICEDFQPILCUFCL-GFCCVEGCSA-N 1 2 244.342 2.405 20 0 BEADLO CC(C)[C@@H](C)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000603246595 349899397 /nfs/dbraw/zinc/89/93/97/349899397.db2.gz NFPILSJQFOSSEY-CHWSQXEVSA-N 1 2 249.358 2.339 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2nccn2C)c1 ZINC000070977424 343958350 /nfs/dbraw/zinc/95/83/50/343958350.db2.gz RQSZWTAHPMARHA-UHFFFAOYSA-N 1 2 245.326 2.061 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2nccn2C)c1 ZINC000070977424 343958351 /nfs/dbraw/zinc/95/83/51/343958351.db2.gz RQSZWTAHPMARHA-UHFFFAOYSA-N 1 2 245.326 2.061 20 0 BEADLO CC[C@@H]1CO[C@H](C)CN1Cc1[nH]c(C)c(C)[nH+]1 ZINC000628119817 343967957 /nfs/dbraw/zinc/96/79/57/343967957.db2.gz LXZNVSKNNMWHMU-BXKDBHETSA-N 1 2 237.347 2.026 20 0 BEADLO CC[C@H]1CO[C@H](C)CN1Cc1[nH]c(C)c(C)[nH+]1 ZINC000628119820 343968191 /nfs/dbraw/zinc/96/81/91/343968191.db2.gz LXZNVSKNNMWHMU-SKDRFNHKSA-N 1 2 237.347 2.026 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)n1 ZINC000628119904 343968696 /nfs/dbraw/zinc/96/86/96/343968696.db2.gz PMBXGOCRMOGRMT-VIFPVBQESA-N 1 2 247.264 2.492 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC[C@H](C(F)(F)F)C2)n1 ZINC000628119904 343968698 /nfs/dbraw/zinc/96/86/98/343968698.db2.gz PMBXGOCRMOGRMT-VIFPVBQESA-N 1 2 247.264 2.492 20 0 BEADLO CCn1cc[nH+]c1CN1Cc2ccc(O)cc2C1 ZINC000625727203 344058745 /nfs/dbraw/zinc/05/87/45/344058745.db2.gz RSAPPCRNFLZGCX-UHFFFAOYSA-N 1 2 243.310 2.124 20 0 BEADLO FC1(F)CCC[N@H+](Cc2cnns2)CC1 ZINC000625770961 344067068 /nfs/dbraw/zinc/06/70/68/344067068.db2.gz ZMKRDNZJIRWVSI-UHFFFAOYSA-N 1 2 233.287 2.159 20 0 BEADLO FC1(F)CCC[N@@H+](Cc2cnns2)CC1 ZINC000625770961 344067070 /nfs/dbraw/zinc/06/70/70/344067070.db2.gz ZMKRDNZJIRWVSI-UHFFFAOYSA-N 1 2 233.287 2.159 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CCCC(F)(F)CC2)[nH]1 ZINC000625771149 344067144 /nfs/dbraw/zinc/06/71/44/344067144.db2.gz BMKLVXURJLHKFI-QMMMGPOBSA-N 1 2 244.289 2.295 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CCCC(F)(F)CC2)[nH]1 ZINC000625771149 344067145 /nfs/dbraw/zinc/06/71/45/344067145.db2.gz BMKLVXURJLHKFI-QMMMGPOBSA-N 1 2 244.289 2.295 20 0 BEADLO CCc1nnc(C[N@@H+]2CCCC(F)(F)CC2)o1 ZINC000625767352 344068277 /nfs/dbraw/zinc/06/82/77/344068277.db2.gz PVEIGRCGIVWAJG-UHFFFAOYSA-N 1 2 245.273 2.253 20 0 BEADLO CCc1nnc(C[N@H+]2CCCC(F)(F)CC2)o1 ZINC000625767352 344068278 /nfs/dbraw/zinc/06/82/78/344068278.db2.gz PVEIGRCGIVWAJG-UHFFFAOYSA-N 1 2 245.273 2.253 20 0 BEADLO Cc1nc(CCNc2cc[nH+]cc2F)cs1 ZINC000641276505 362341080 /nfs/dbraw/zinc/34/10/80/362341080.db2.gz JWYMOXDWOKKKPX-UHFFFAOYSA-N 1 2 237.303 2.062 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000570693284 323067383 /nfs/dbraw/zinc/06/73/83/323067383.db2.gz BKRNPYGVRXIFSU-HBNTYKKESA-N 1 2 237.347 2.139 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000570693284 323067384 /nfs/dbraw/zinc/06/73/84/323067384.db2.gz BKRNPYGVRXIFSU-HBNTYKKESA-N 1 2 237.347 2.139 20 0 BEADLO OCc1cc[nH+]c(NCCc2cccs2)c1 ZINC000641277737 362342930 /nfs/dbraw/zinc/34/29/30/362342930.db2.gz MVHDUBQNFKKCHD-UHFFFAOYSA-N 1 2 234.324 2.290 20 0 BEADLO CC(C)(C)c1nnc(C[NH+](C2CC2)C2CC2)[nH]1 ZINC000625841297 344094839 /nfs/dbraw/zinc/09/48/39/344094839.db2.gz KEOYTONMBKXWQO-UHFFFAOYSA-N 1 2 234.347 2.229 20 0 BEADLO CCCCc1cc(NCCOCC2CC2)nc[nH+]1 ZINC000631112574 344170593 /nfs/dbraw/zinc/17/05/93/344170593.db2.gz WDKCHFFQRWHBMV-UHFFFAOYSA-N 1 2 249.358 2.080 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)CCCC1CCCC1 ZINC000080006191 344122091 /nfs/dbraw/zinc/12/20/91/344122091.db2.gz CZVKJGOSZYBLSL-UHFFFAOYSA-N 1 2 249.358 2.397 20 0 BEADLO Cc1cnc(C[N@H+]2CCSC[C@@H]2C)s1 ZINC000180504597 347030807 /nfs/dbraw/zinc/03/08/07/347030807.db2.gz RJHCVGREFZPPJC-QMMMGPOBSA-N 1 2 228.386 2.389 20 0 BEADLO Cc1cnc(C[N@@H+]2CCSC[C@@H]2C)s1 ZINC000180504597 347030811 /nfs/dbraw/zinc/03/08/11/347030811.db2.gz RJHCVGREFZPPJC-QMMMGPOBSA-N 1 2 228.386 2.389 20 0 BEADLO CN(C[C@@H]1CCCO1)c1cc[nH+]c2ccncc21 ZINC000085661184 344207659 /nfs/dbraw/zinc/20/76/59/344207659.db2.gz GVEAIZXAXAKFBK-NSHDSACASA-N 1 2 243.310 2.245 20 0 BEADLO COC[C@@H]1CCN(c2cc[nH+]c3ccncc32)C1 ZINC000085687827 344208093 /nfs/dbraw/zinc/20/80/93/344208093.db2.gz OKTFFKLCYRTCCV-LLVKDONJSA-N 1 2 243.310 2.103 20 0 BEADLO Nc1[nH+]cnc(N[C@H]2CCCC23CC3)c1Cl ZINC000631419567 344208144 /nfs/dbraw/zinc/20/81/44/344208144.db2.gz WEBBQSLBUBEJJY-ZETCQYMHSA-N 1 2 238.722 2.457 20 0 BEADLO Nc1nc[nH+]c(N[C@H]2CCCC23CC3)c1Cl ZINC000631419567 344208145 /nfs/dbraw/zinc/20/81/45/344208145.db2.gz WEBBQSLBUBEJJY-ZETCQYMHSA-N 1 2 238.722 2.457 20 0 BEADLO CCCCNC(=O)C[N@H+](C)Cc1ccsc1 ZINC000588928515 344214335 /nfs/dbraw/zinc/21/43/35/344214335.db2.gz HIVYSSZJEAXHTE-UHFFFAOYSA-N 1 2 240.372 2.096 20 0 BEADLO CCCCNC(=O)C[N@@H+](C)Cc1ccsc1 ZINC000588928515 344214336 /nfs/dbraw/zinc/21/43/36/344214336.db2.gz HIVYSSZJEAXHTE-UHFFFAOYSA-N 1 2 240.372 2.096 20 0 BEADLO CC[C@H](C)NC(=O)C[N@H+](C)Cc1ccsc1 ZINC000588928597 344216683 /nfs/dbraw/zinc/21/66/83/344216683.db2.gz JFELCHKYCLPCCM-JTQLQIEISA-N 1 2 240.372 2.095 20 0 BEADLO CC[C@H](C)NC(=O)C[N@@H+](C)Cc1ccsc1 ZINC000588928597 344216685 /nfs/dbraw/zinc/21/66/85/344216685.db2.gz JFELCHKYCLPCCM-JTQLQIEISA-N 1 2 240.372 2.095 20 0 BEADLO COc1ccc[nH+]c1NCCC1CCOCC1 ZINC000310112795 344234121 /nfs/dbraw/zinc/23/41/21/344234121.db2.gz BBRDTERHSVXQIK-UHFFFAOYSA-N 1 2 236.315 2.319 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H](C)OCC1CC1 ZINC000107288925 344238408 /nfs/dbraw/zinc/23/84/08/344238408.db2.gz JAQVSRWGUCUUIM-SNVBAGLBSA-N 1 2 234.299 2.144 20 0 BEADLO COc1cc[nH+]cc1CSC[C@@H](C)OC ZINC000588918202 344200002 /nfs/dbraw/zinc/20/00/02/344200002.db2.gz MIGLAJDNOWKDFN-SECBINFHSA-N 1 2 227.329 2.358 20 0 BEADLO C[C@@H](c1ccccn1)N(C)c1cc(CO)cc[nH+]1 ZINC000641339421 362370239 /nfs/dbraw/zinc/37/02/39/362370239.db2.gz NRUWMMPQVKTRSV-NSHDSACASA-N 1 2 243.310 2.166 20 0 BEADLO C[C@@H](CO)CSCc1ccc(N(C)C)[nH+]c1 ZINC000600524416 344256069 /nfs/dbraw/zinc/25/60/69/344256069.db2.gz KWHOROCXISQBJQ-JTQLQIEISA-N 1 2 240.372 2.009 20 0 BEADLO COCCSCc1ccc(N(C)C)[nH+]c1 ZINC000600537610 344262958 /nfs/dbraw/zinc/26/29/58/344262958.db2.gz RIAYUPFPKPCTRM-UHFFFAOYSA-N 1 2 226.345 2.027 20 0 BEADLO CCc1nc(CNc2cc(CO)cc[nH+]2)cs1 ZINC000641362998 362377212 /nfs/dbraw/zinc/37/72/12/362377212.db2.gz JQWBACCVGGQCQN-UHFFFAOYSA-N 1 2 249.339 2.205 20 0 BEADLO CCc1cnc(CN(C)Cc2c[nH+]c[nH]2)s1 ZINC000093807582 344322871 /nfs/dbraw/zinc/32/28/71/344322871.db2.gz ADYPEZKTCLZJEE-UHFFFAOYSA-N 1 2 236.344 2.061 20 0 BEADLO CCc1cnc(CN(C)Cc2c[nH]c[nH+]2)s1 ZINC000093807582 344322872 /nfs/dbraw/zinc/32/28/72/344322872.db2.gz ADYPEZKTCLZJEE-UHFFFAOYSA-N 1 2 236.344 2.061 20 0 BEADLO C[C@H](NC(=O)[C@@H]1CCC[C@@H](C)C1)c1[nH+]ccn1C ZINC000620598905 344333907 /nfs/dbraw/zinc/33/39/07/344333907.db2.gz AAMWNVGMNRDFGV-GRYCIOLGSA-N 1 2 249.358 2.424 20 0 BEADLO C/C=C\C[NH2+][C@@H](CC(C)C)C(=O)OCC ZINC000600615438 344337316 /nfs/dbraw/zinc/33/73/16/344337316.db2.gz VXEUKQGXOYBFAA-XOIDGJRKSA-N 1 2 213.321 2.130 20 0 BEADLO c1c[nH]c(C[N@@H+]2CCCc3sccc3C2)n1 ZINC000600646166 344351090 /nfs/dbraw/zinc/35/10/90/344351090.db2.gz YODUETXHKSUIAJ-UHFFFAOYSA-N 1 2 233.340 2.420 20 0 BEADLO c1c[nH]c(C[N@H+]2CCCc3sccc3C2)n1 ZINC000600646166 344351093 /nfs/dbraw/zinc/35/10/93/344351093.db2.gz YODUETXHKSUIAJ-UHFFFAOYSA-N 1 2 233.340 2.420 20 0 BEADLO CC[C@H](C)[C@H](C)Nc1cc(CO)cc[nH+]1 ZINC000641383730 362384896 /nfs/dbraw/zinc/38/48/96/362384896.db2.gz DOEBJJZRLMXFRB-UWVGGRQHSA-N 1 2 208.305 2.420 20 0 BEADLO CCCC[C@@H](COC)Nc1cc[nH+]cc1F ZINC000641383510 362384950 /nfs/dbraw/zinc/38/49/50/362384950.db2.gz AMXXDZDVPUYZIW-JTQLQIEISA-N 1 2 226.295 2.260 20 0 BEADLO CCn1cc(CN(C)c2cc[nH+]cc2F)cn1 ZINC000641376464 362381257 /nfs/dbraw/zinc/38/12/57/362381257.db2.gz FEYDPYHTGCXZOD-UHFFFAOYSA-N 1 2 234.278 2.074 20 0 BEADLO CCc1cc(NCc2ccco2)nc[nH+]1 ZINC000040764994 344305441 /nfs/dbraw/zinc/30/54/41/344305441.db2.gz VDXMNZQRILFFQN-UHFFFAOYSA-N 1 2 203.245 2.244 20 0 BEADLO CCSCC[NH2+][C@H](C[C@H](C)CC)C(=O)OC ZINC000584292361 344426787 /nfs/dbraw/zinc/42/67/87/344426787.db2.gz LCTLILJYLYGKMC-GHMZBOCLSA-N 1 2 247.404 2.307 20 0 BEADLO CCCC(O)(CCC)CNc1cc[nH+]cc1F ZINC000641385561 362387037 /nfs/dbraw/zinc/38/70/37/362387037.db2.gz PUQNXWBYOPSCHI-UHFFFAOYSA-N 1 2 240.322 2.386 20 0 BEADLO CCN1CC[NH+](Cc2cc(C)c(O)c(C)c2)CC1 ZINC000096942577 344384267 /nfs/dbraw/zinc/38/42/67/344384267.db2.gz CUIRTIPSVKIUOC-UHFFFAOYSA-N 1 2 248.370 2.147 20 0 BEADLO CCCC(=O)Nc1ccn2cc(C)[nH+]c2c1 ZINC000620648139 344435507 /nfs/dbraw/zinc/43/55/07/344435507.db2.gz VMSNDFQKCZSXAX-UHFFFAOYSA-N 1 2 217.272 2.381 20 0 BEADLO Cc1ccc(C[NH2+]Cc2ccn[nH]2)s1 ZINC000041014634 344411868 /nfs/dbraw/zinc/41/18/68/344411868.db2.gz SLTYDHBIZQPTLS-UHFFFAOYSA-N 1 2 207.302 2.069 20 0 BEADLO CC(C)CCN(C(=O)CCc1[nH]cc[nH+]1)C1CC1 ZINC000288558501 537845891 /nfs/dbraw/zinc/84/58/91/537845891.db2.gz WRSROTFOTQTETN-UHFFFAOYSA-N 1 2 249.358 2.379 20 0 BEADLO CC[C@@H](c1ccccc1)[N@@H+]1CCn2cnnc2C1 ZINC000105880822 344471163 /nfs/dbraw/zinc/47/11/63/344471163.db2.gz UUJPVHKNQPXDPS-ZDUSSCGKSA-N 1 2 242.326 2.245 20 0 BEADLO CC[C@@H](c1ccccc1)[N@H+]1CCn2cnnc2C1 ZINC000105880822 344471164 /nfs/dbraw/zinc/47/11/64/344471164.db2.gz UUJPVHKNQPXDPS-ZDUSSCGKSA-N 1 2 242.326 2.245 20 0 BEADLO Cc1c[nH+]c(C)nc1N1C2CCC1CC2 ZINC000577388018 344524810 /nfs/dbraw/zinc/52/48/10/344524810.db2.gz AANQDMGMPAAUEO-UHFFFAOYSA-N 1 2 203.289 2.225 20 0 BEADLO CCOC(=O)C[N@H+](C)CCc1ccc(CC)cc1 ZINC000259238348 344556604 /nfs/dbraw/zinc/55/66/04/344556604.db2.gz YZTBOVZDNJQQAA-UHFFFAOYSA-N 1 2 249.354 2.286 20 0 BEADLO CCOC(=O)C[N@@H+](C)CCc1ccc(CC)cc1 ZINC000259238348 344556606 /nfs/dbraw/zinc/55/66/06/344556606.db2.gz YZTBOVZDNJQQAA-UHFFFAOYSA-N 1 2 249.354 2.286 20 0 BEADLO Fc1c[nH+]ccc1NCCC(F)(F)F ZINC000641406601 362398745 /nfs/dbraw/zinc/39/87/45/362398745.db2.gz NWGXJMRXIQQXFM-UHFFFAOYSA-N 1 2 208.158 2.007 20 0 BEADLO c1ccc(N2CC[C@H]3OCCC[C@@H]3C2)[nH+]c1 ZINC000152434335 344564063 /nfs/dbraw/zinc/56/40/63/344564063.db2.gz SKZXBTOAAZCYIY-VXGBXAGGSA-N 1 2 218.300 2.087 20 0 BEADLO CCN(C[C@@H]1CCOC1)c1cc[nH+]cc1F ZINC000641450952 362425350 /nfs/dbraw/zinc/42/53/50/362425350.db2.gz NERWYCXJHGACNU-JTQLQIEISA-N 1 2 224.279 2.084 20 0 BEADLO C[C@H]1CCN(c2cc(CO)cc[nH+]2)C[C@@H](C)C1 ZINC000641456546 362429901 /nfs/dbraw/zinc/42/99/01/362429901.db2.gz QKCGJIYBPDCIQT-RYUDHWBXSA-N 1 2 234.343 2.446 20 0 BEADLO CC(C)CSCCNc1cc[nH+]cc1F ZINC000603320179 349913715 /nfs/dbraw/zinc/91/37/15/349913715.db2.gz KJBYIFBJAOFPMJ-UHFFFAOYSA-N 1 2 228.336 2.444 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2 ZINC000641461948 362436351 /nfs/dbraw/zinc/43/63/51/362436351.db2.gz ZNZLDZFAMIPKQN-WQAKAFBOSA-N 1 2 248.301 2.012 20 0 BEADLO CCc1nc(C[NH2+][C@H](C)c2ccccc2)no1 ZINC000181356125 347056239 /nfs/dbraw/zinc/05/62/39/347056239.db2.gz KHGDWXDFWPDNOM-SNVBAGLBSA-N 1 2 231.299 2.483 20 0 BEADLO COC1(C)CCN(c2cc[nH+]cc2F)CC1 ZINC000641480664 362451376 /nfs/dbraw/zinc/45/13/76/362451376.db2.gz SUSAQRPMGHORDA-UHFFFAOYSA-N 1 2 224.279 2.226 20 0 BEADLO C[C@@H]1CN(c2cc(CO)cc[nH+]2)CC(C)(C)C1 ZINC000641487446 362454670 /nfs/dbraw/zinc/45/46/70/362454670.db2.gz JXFZNJOXKSZZMV-NSHDSACASA-N 1 2 234.343 2.446 20 0 BEADLO Fc1c[nH+]ccc1NCC1(c2ccccn2)CC1 ZINC000641487237 362455128 /nfs/dbraw/zinc/45/51/28/362455128.db2.gz NBEWYCJOAMRPSY-UHFFFAOYSA-N 1 2 243.285 2.181 20 0 BEADLO C[C@@H]1C[C@H](CCNc2cc[nH+]cc2F)CCO1 ZINC000641487908 362455187 /nfs/dbraw/zinc/45/51/87/362455187.db2.gz XBAJWZDATBBDAX-GHMZBOCLSA-N 1 2 238.306 2.260 20 0 BEADLO CCOC[C@H](Nc1cc[nH+]cc1F)C(C)C ZINC000641545343 362492452 /nfs/dbraw/zinc/49/24/52/362492452.db2.gz JZMGHNGRDFIJKT-LBPRGKRZSA-N 1 2 226.295 2.116 20 0 BEADLO C[C@H](CC(F)(F)F)Nc1cc(CO)cc[nH+]1 ZINC000641494201 362460891 /nfs/dbraw/zinc/46/08/91/362460891.db2.gz ROFUZOGXLNCNQK-SSDOTTSWSA-N 1 2 234.221 2.327 20 0 BEADLO CC(C)C[C@H](CO)N(C)c1cc[nH+]cc1F ZINC000641496713 362461801 /nfs/dbraw/zinc/46/18/01/362461801.db2.gz KSWSUUFLDIEGNI-SNVBAGLBSA-N 1 2 226.295 2.064 20 0 BEADLO C[C@H]1CCN(c2cc(CO)cc[nH+]2)CC1(C)C ZINC000641510603 362470299 /nfs/dbraw/zinc/47/02/99/362470299.db2.gz FHJXGDLZMJWPGM-NSHDSACASA-N 1 2 234.343 2.446 20 0 BEADLO CC[C@]1(C)CN(c2cc[nH+]cc2F)CCO1 ZINC000641523256 362480223 /nfs/dbraw/zinc/48/02/23/362480223.db2.gz GVUNUSLLFLTAEQ-GFCCVEGCSA-N 1 2 224.279 2.226 20 0 BEADLO C[C@H](c1ccccn1)[N@@H+]1CCO[C@H](CCF)C1 ZINC000626004263 344666283 /nfs/dbraw/zinc/66/62/83/344666283.db2.gz COGPRFVZLGOFCP-VXGBXAGGSA-N 1 2 238.306 2.203 20 0 BEADLO C[C@H](c1ccccn1)[N@H+]1CCO[C@H](CCF)C1 ZINC000626004263 344666284 /nfs/dbraw/zinc/66/62/84/344666284.db2.gz COGPRFVZLGOFCP-VXGBXAGGSA-N 1 2 238.306 2.203 20 0 BEADLO C[C@@H]([NH2+]CC(C)(F)F)c1cncs1 ZINC000382005982 347063474 /nfs/dbraw/zinc/06/34/74/347063474.db2.gz BCBIVHDKKORHDP-ZCFIWIBFSA-N 1 2 206.261 2.449 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)/C=C/C1CCCC1 ZINC000493186113 530027154 /nfs/dbraw/zinc/02/71/54/530027154.db2.gz JZEMYDYTXXDVKJ-BQYQJAHWSA-N 1 2 247.342 2.125 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccncc2)sn1 ZINC000684163644 488271189 /nfs/dbraw/zinc/27/11/89/488271189.db2.gz SHOPBDZLWRLQAK-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccncc2)sn1 ZINC000684163644 488271193 /nfs/dbraw/zinc/27/11/93/488271193.db2.gz SHOPBDZLWRLQAK-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CC[C@H](C)C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000075552087 344779146 /nfs/dbraw/zinc/77/91/46/344779146.db2.gz PHFPYZSOJXHNMY-QWRGUYRKSA-N 1 2 235.331 2.162 20 0 BEADLO CC(C)c1nc(C[NH+]2C[C@H](C)[C@@H](C)C2)no1 ZINC000076111822 344795580 /nfs/dbraw/zinc/79/55/80/344795580.db2.gz SOLGOSUCOWNHJM-UWVGGRQHSA-N 1 2 223.320 2.281 20 0 BEADLO C[C@H]1C[N@H+](Cc2cnc(C3CC3)o2)[C@@H](C)CO1 ZINC000628140510 344805601 /nfs/dbraw/zinc/80/56/01/344805601.db2.gz NOQUEDDGNQNDRM-UWVGGRQHSA-N 1 2 236.315 2.161 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cnc(C3CC3)o2)[C@@H](C)CO1 ZINC000628140510 344805603 /nfs/dbraw/zinc/80/56/03/344805603.db2.gz NOQUEDDGNQNDRM-UWVGGRQHSA-N 1 2 236.315 2.161 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2ccno2)s1 ZINC000077184993 344810230 /nfs/dbraw/zinc/81/02/30/344810230.db2.gz APMNMQXBPHHBPT-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2ccno2)s1 ZINC000077184993 344810231 /nfs/dbraw/zinc/81/02/31/344810231.db2.gz APMNMQXBPHHBPT-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO Cc1c[nH]c(CN2CCOc3ccccc3C2)[nH+]1 ZINC000628150354 344837929 /nfs/dbraw/zinc/83/79/29/344837929.db2.gz ONFULTUVRCPBRO-UHFFFAOYSA-N 1 2 243.310 2.113 20 0 BEADLO Cc1cn2ccc(NC(=O)C34CC(C3)C4)cc2[nH+]1 ZINC000628150867 344839341 /nfs/dbraw/zinc/83/93/41/344839341.db2.gz HALGOVBECCYTQB-UHFFFAOYSA-N 1 2 241.294 2.381 20 0 BEADLO CCCN(Cc1[nH]cc(C)[nH+]1)CC(F)(F)F ZINC000628145086 344824620 /nfs/dbraw/zinc/82/46/20/344824620.db2.gz CLQGKGCHXOOPMJ-UHFFFAOYSA-N 1 2 235.253 2.492 20 0 BEADLO Cc1ncc(C[N@@H+]2CCC[C@@H](c3ccn[nH]3)C2)o1 ZINC000628147886 344832038 /nfs/dbraw/zinc/83/20/38/344832038.db2.gz ZSNZNRLBHFKXNC-LLVKDONJSA-N 1 2 246.314 2.086 20 0 BEADLO Cc1ncc(C[N@H+]2CCC[C@@H](c3ccn[nH]3)C2)o1 ZINC000628147886 344832040 /nfs/dbraw/zinc/83/20/40/344832040.db2.gz ZSNZNRLBHFKXNC-LLVKDONJSA-N 1 2 246.314 2.086 20 0 BEADLO C[N@H+](CC(F)F)C[C@@]1(C)CCCS1 ZINC000628155968 344846329 /nfs/dbraw/zinc/84/63/29/344846329.db2.gz VZDYKLPZZBDILH-SECBINFHSA-N 1 2 209.305 2.469 20 0 BEADLO C[N@@H+](CC(F)F)C[C@@]1(C)CCCS1 ZINC000628155968 344846330 /nfs/dbraw/zinc/84/63/30/344846330.db2.gz VZDYKLPZZBDILH-SECBINFHSA-N 1 2 209.305 2.469 20 0 BEADLO COCC[N@H+](CC(F)F)CC1(C)CCC1 ZINC000432822314 537869401 /nfs/dbraw/zinc/86/94/01/537869401.db2.gz MTBQCGOPPDXFAB-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO COCC[N@@H+](CC(F)F)CC1(C)CCC1 ZINC000432822314 537869407 /nfs/dbraw/zinc/86/94/07/537869407.db2.gz MTBQCGOPPDXFAB-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO Cc1nc(N2C[C@H](C)S[C@@H](C)C2)cc[nH+]1 ZINC000078495281 344876172 /nfs/dbraw/zinc/87/61/72/344876172.db2.gz WXUMFOCDECHGHG-IUCAKERBSA-N 1 2 223.345 2.115 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ccnn1C)c1cscn1 ZINC000583392761 344879297 /nfs/dbraw/zinc/87/92/97/344879297.db2.gz PCGGOIABZDHXQX-RKDXNWHRSA-N 1 2 236.344 2.288 20 0 BEADLO Cc1nc(N2CCS[C@H](C(C)C)C2)cc[nH+]1 ZINC000078578579 344886101 /nfs/dbraw/zinc/88/61/01/344886101.db2.gz NGJFYSQNYMLTCG-NSHDSACASA-N 1 2 237.372 2.363 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2cnc(C3CC3)o2)[C@@H]1C ZINC000628175913 344900085 /nfs/dbraw/zinc/90/00/85/344900085.db2.gz NVOWFTFMNMYNDV-NXEZZACHSA-N 1 2 236.315 2.161 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2cnc(C3CC3)o2)[C@@H]1C ZINC000628175913 344900087 /nfs/dbraw/zinc/90/00/87/344900087.db2.gz NVOWFTFMNMYNDV-NXEZZACHSA-N 1 2 236.315 2.161 20 0 BEADLO CC[C@H]1C[N@H+](Cc2nc(C)c(C)[nH]2)CCS1 ZINC000628178992 344913490 /nfs/dbraw/zinc/91/34/90/344913490.db2.gz KHRCVCFQYYGANR-NSHDSACASA-N 1 2 239.388 2.354 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2nc(C)c(C)[nH]2)CCS1 ZINC000628178992 344913492 /nfs/dbraw/zinc/91/34/92/344913492.db2.gz KHRCVCFQYYGANR-NSHDSACASA-N 1 2 239.388 2.354 20 0 BEADLO CC[C@H]1CN(Cc2[nH]c(C)c(C)[nH+]2)CCS1 ZINC000628178992 344913493 /nfs/dbraw/zinc/91/34/93/344913493.db2.gz KHRCVCFQYYGANR-NSHDSACASA-N 1 2 239.388 2.354 20 0 BEADLO Cc1nc(C[N@H+]2CCS[C@H](C)[C@@H]2C)[nH]c1C ZINC000628179208 344914088 /nfs/dbraw/zinc/91/40/88/344914088.db2.gz RCYDZRHXEJJFKZ-WDEREUQCSA-N 1 2 239.388 2.352 20 0 BEADLO Cc1nc(C[N@@H+]2CCS[C@H](C)[C@@H]2C)[nH]c1C ZINC000628179208 344914090 /nfs/dbraw/zinc/91/40/90/344914090.db2.gz RCYDZRHXEJJFKZ-WDEREUQCSA-N 1 2 239.388 2.352 20 0 BEADLO Cc1[nH]c(CN2CCS[C@H](C)[C@@H]2C)[nH+]c1C ZINC000628179208 344914092 /nfs/dbraw/zinc/91/40/92/344914092.db2.gz RCYDZRHXEJJFKZ-WDEREUQCSA-N 1 2 239.388 2.352 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCSC(C)(C)C2)n1 ZINC000628179306 344914496 /nfs/dbraw/zinc/91/44/96/344914496.db2.gz VUFABGSQOCRDGA-UHFFFAOYSA-N 1 2 225.361 2.046 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCSC(C)(C)C2)n1 ZINC000628179306 344914498 /nfs/dbraw/zinc/91/44/98/344914498.db2.gz VUFABGSQOCRDGA-UHFFFAOYSA-N 1 2 225.361 2.046 20 0 BEADLO Cc1[nH]c(CN2CCCOC(C)(C)C2)[nH+]c1C ZINC000628180645 344918125 /nfs/dbraw/zinc/91/81/25/344918125.db2.gz XZHREDOIBLPILG-UHFFFAOYSA-N 1 2 237.347 2.027 20 0 BEADLO C[C@H]1OCC[C@@H]1SCc1ccc[nH+]c1N ZINC000235642079 344964671 /nfs/dbraw/zinc/96/46/71/344964671.db2.gz KRLLODBSPHNWLA-SCZZXKLOSA-N 1 2 224.329 2.074 20 0 BEADLO C[C@H]1OCC[C@H]1SCc1ccc[nH+]c1N ZINC000235652805 344971658 /nfs/dbraw/zinc/97/16/58/344971658.db2.gz KRLLODBSPHNWLA-PSASIEDQSA-N 1 2 224.329 2.074 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCS[C@@H](C(C)C)C2)n1 ZINC000628188925 344941170 /nfs/dbraw/zinc/94/11/70/344941170.db2.gz MRIICAOEHPMEIA-LLVKDONJSA-N 1 2 239.388 2.292 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCS[C@@H](C(C)C)C2)n1 ZINC000628188925 344941171 /nfs/dbraw/zinc/94/11/71/344941171.db2.gz MRIICAOEHPMEIA-LLVKDONJSA-N 1 2 239.388 2.292 20 0 BEADLO CCn1nccc1C[N@H+](CC)Cc1ccccn1 ZINC000124805123 345053800 /nfs/dbraw/zinc/05/38/00/345053800.db2.gz IWVLWXXMXKAXOV-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CCn1nccc1C[N@@H+](CC)Cc1ccccn1 ZINC000124805123 345053803 /nfs/dbraw/zinc/05/38/03/345053803.db2.gz IWVLWXXMXKAXOV-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CC(C)(CNc1cc[nH+]cc1F)c1ccccn1 ZINC000641615017 362547653 /nfs/dbraw/zinc/54/76/53/362547653.db2.gz FAYTYGBKSMLYNN-UHFFFAOYSA-N 1 2 245.301 2.427 20 0 BEADLO Fc1c[nH+]ccc1NC[C@H]1CCCC1(F)F ZINC000641618522 362551666 /nfs/dbraw/zinc/55/16/66/362551666.db2.gz GNJCEEUNIPUXBE-MRVPVSSYSA-N 1 2 230.233 2.490 20 0 BEADLO Cc1cncnc1N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000641622373 362554272 /nfs/dbraw/zinc/55/42/72/362554272.db2.gz SYRZQIYKWWOLRJ-UWVGGRQHSA-N 1 2 229.287 2.099 20 0 BEADLO OCc1cc[nH+]c(N2CCC[C@@H](C3CC3)C2)c1 ZINC000641599731 362540240 /nfs/dbraw/zinc/54/02/40/362540240.db2.gz ZGAXDYKWQMYKAW-CYBMUJFWSA-N 1 2 232.327 2.200 20 0 BEADLO CCCCCCNC(=O)[C@H]1CCn2cc[nH+]c2C1 ZINC000155946906 345116128 /nfs/dbraw/zinc/11/61/28/345116128.db2.gz NISLFGWTBBGNRI-LBPRGKRZSA-N 1 2 249.358 2.142 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CCCCC[C@@H]1C ZINC001638956794 1172058222 /nfs/dbraw/zinc/05/82/22/1172058222.db2.gz JEWOZTJJWKWPCN-JTQLQIEISA-N 1 2 235.331 2.052 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000641648883 362575982 /nfs/dbraw/zinc/57/59/82/362575982.db2.gz RSYOAJAODPOLTK-LPEHRKFASA-N 1 2 206.264 2.243 20 0 BEADLO OCc1cc[nH+]c(N2CCC[C@H](CCF)C2)c1 ZINC000641660299 362580344 /nfs/dbraw/zinc/58/03/44/362580344.db2.gz WUBOSEQBVNGOGL-LLVKDONJSA-N 1 2 238.306 2.150 20 0 BEADLO OCc1cc[nH+]c(NCCC2CC(F)(F)C2)c1 ZINC000641624134 362556544 /nfs/dbraw/zinc/55/65/44/362556544.db2.gz FGSZGGHUVJOTKY-UHFFFAOYSA-N 1 2 242.269 2.421 20 0 BEADLO CN(C)c1ccc(CC(F)(F)F)c[nH+]1 ZINC000307179763 345134616 /nfs/dbraw/zinc/13/46/16/345134616.db2.gz MSDOTMIATGYYPZ-UHFFFAOYSA-N 1 2 204.195 2.252 20 0 BEADLO CC1(C)CCc2sc([C@@H]3COCC[NH2+]3)nc21 ZINC000226468090 345228476 /nfs/dbraw/zinc/22/84/76/345228476.db2.gz WQXYAEPXPOMTMR-QMMMGPOBSA-N 1 2 238.356 2.028 20 0 BEADLO CCc1c[nH]c(CC(=O)Nc2ccc(C)cc2)[nH+]1 ZINC000635060345 345231439 /nfs/dbraw/zinc/23/14/39/345231439.db2.gz FFOOJMZEQBQVCF-UHFFFAOYSA-N 1 2 243.310 2.462 20 0 BEADLO CC[C@@H](SC)C(=O)Nc1c[nH+]ccc1OC ZINC000128562219 345240383 /nfs/dbraw/zinc/24/03/83/345240383.db2.gz MYXHWUHMVOYRMG-SNVBAGLBSA-N 1 2 240.328 2.170 20 0 BEADLO CC(C)C[C@H](C(=O)N[C@@H](C)C1CC1)n1cc[nH+]c1 ZINC000635126285 345252243 /nfs/dbraw/zinc/25/22/43/345252243.db2.gz ZBYFGHAFJFDVSN-WCQYABFASA-N 1 2 249.358 2.385 20 0 BEADLO C[C@H](CNc1nc[nH+]c(N)c1Cl)C1CC1 ZINC000235449837 537894059 /nfs/dbraw/zinc/89/40/59/537894059.db2.gz NMXIKXZDMYWSEV-ZCFIWIBFSA-N 1 2 226.711 2.170 20 0 BEADLO C[C@H](CNc1[nH+]cnc(N)c1Cl)C1CC1 ZINC000235449837 537894070 /nfs/dbraw/zinc/89/40/70/537894070.db2.gz NMXIKXZDMYWSEV-ZCFIWIBFSA-N 1 2 226.711 2.170 20 0 BEADLO Cc1cn2ccc(C(=O)NC[C@H]3C[C@H]3C)cc2[nH+]1 ZINC000635300597 345299258 /nfs/dbraw/zinc/29/92/58/345299258.db2.gz MYJAXLSMQDVNIT-BXKDBHETSA-N 1 2 243.310 2.029 20 0 BEADLO CC(C)=C(C)CC(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000635326011 345308472 /nfs/dbraw/zinc/30/84/72/345308472.db2.gz ADEJLRYSUGPANW-LBPRGKRZSA-N 1 2 235.331 2.134 20 0 BEADLO CNc1nc(N[C@@H]2CC23CC3)[nH+]c2ccccc21 ZINC000425275257 192087890 /nfs/dbraw/zinc/08/78/90/192087890.db2.gz TVUGEFHJTMBNND-LLVKDONJSA-N 1 2 240.310 2.058 20 0 BEADLO Cc1cccc(NC(=O)[C@@H](C)n2cc[nH+]c2)c1 ZINC000053898552 1172060629 /nfs/dbraw/zinc/06/06/29/1172060629.db2.gz QIHIPIIURGHUTO-LLVKDONJSA-N 1 2 229.283 2.391 20 0 BEADLO Cc1cc(NC(C)(C)[C@H](C)O)nc(C(C)C)[nH+]1 ZINC000158790151 345377063 /nfs/dbraw/zinc/37/70/63/345377063.db2.gz MDCNDFQYMSESMO-JTQLQIEISA-N 1 2 237.347 2.480 20 0 BEADLO CC(C)c1cc(N[C@@H]2CC[C@H]2O)nc(C(C)C)[nH+]1 ZINC000425280744 192088739 /nfs/dbraw/zinc/08/87/39/192088739.db2.gz ILHCHKWWWKJDPK-ZYHUDNBSSA-N 1 2 249.358 2.081 20 0 BEADLO C[C@@H]1CCN(C(=O)C2(C)CC2)C[C@H]1n1cc[nH+]c1 ZINC000159092059 345409295 /nfs/dbraw/zinc/40/92/95/345409295.db2.gz YSFIALZLBPAHHM-VXGBXAGGSA-N 1 2 247.342 2.093 20 0 BEADLO CCN(CCc1nccs1)c1cc(C)[nH+]cn1 ZINC000159259705 345420793 /nfs/dbraw/zinc/42/07/93/345420793.db2.gz ONWZTKHFDPQORS-UHFFFAOYSA-N 1 2 248.355 2.311 20 0 BEADLO Cc1nc(N2CCC[C@]3(CCCOC3)C2)cc[nH+]1 ZINC000080689284 345436027 /nfs/dbraw/zinc/43/60/27/345436027.db2.gz CQIGMIOQJAVPDI-AWEZNQCLSA-N 1 2 247.342 2.182 20 0 BEADLO CO[C@H](CNc1cc[nH+]c(C)n1)C(C)(C)C ZINC000080697651 345442083 /nfs/dbraw/zinc/44/20/83/345442083.db2.gz PXSVIDJRNVRPQC-SNVBAGLBSA-N 1 2 223.320 2.258 20 0 BEADLO C[C@@]1(CCNc2cc[nH+]cc2F)CC1(F)F ZINC000641658477 362583473 /nfs/dbraw/zinc/58/34/73/362583473.db2.gz GZOGTTQHRVQMEF-SNVBAGLBSA-N 1 2 230.233 2.490 20 0 BEADLO C[C@@H]1COC2(CCC2)CN1c1cc[nH+]cc1F ZINC000641659907 362585756 /nfs/dbraw/zinc/58/57/56/362585756.db2.gz WYTQPMWFGGYDBA-SNVBAGLBSA-N 1 2 236.290 2.369 20 0 BEADLO C[C@@H](Nc1cc(CO)cc[nH+]1)c1cscn1 ZINC000641659759 362585790 /nfs/dbraw/zinc/58/57/90/362585790.db2.gz UROHKTDCHYTFCP-MRVPVSSYSA-N 1 2 235.312 2.204 20 0 BEADLO CC1(C)[C@@H](CNc2cc[nH+]cc2F)C1(F)F ZINC000641665897 362587416 /nfs/dbraw/zinc/58/74/16/362587416.db2.gz PTTSRPFTVLXFAY-SECBINFHSA-N 1 2 230.233 2.346 20 0 BEADLO OCc1cc[nH+]c(NCC2=CCCC2)c1 ZINC000641666216 362589131 /nfs/dbraw/zinc/58/91/31/362589131.db2.gz VNXJIRMZWGFILE-UHFFFAOYSA-N 1 2 204.273 2.096 20 0 BEADLO Cc1nc2[nH]ccc2c(NC[C@@](C)(O)C(C)C)[nH+]1 ZINC000080982567 345458144 /nfs/dbraw/zinc/45/81/44/345458144.db2.gz DRBAMJYPAAUJIB-CYBMUJFWSA-N 1 2 248.330 2.085 20 0 BEADLO CCC[C@@H]([NH2+]C1(C2CC2)CC1)C(=O)OCC ZINC000381354551 345459534 /nfs/dbraw/zinc/45/95/34/345459534.db2.gz CSUDMDJVOQEDBR-LLVKDONJSA-N 1 2 225.332 2.250 20 0 BEADLO O=C(c1ccc2[nH+]ccn2c1)N1CCC12CCC2 ZINC000081417415 345474069 /nfs/dbraw/zinc/47/40/69/345474069.db2.gz SJIVUGDIHCAJGD-UHFFFAOYSA-N 1 2 241.294 2.103 20 0 BEADLO CC1(CNC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)CCCC1 ZINC000635540655 345520777 /nfs/dbraw/zinc/52/07/77/345520777.db2.gz IHQDNDTTXOLYAZ-GHMZBOCLSA-N 1 2 247.342 2.210 20 0 BEADLO CC1(CNC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)CCCC1 ZINC000635540655 345520781 /nfs/dbraw/zinc/52/07/81/345520781.db2.gz IHQDNDTTXOLYAZ-GHMZBOCLSA-N 1 2 247.342 2.210 20 0 BEADLO CC[C@H](C)[C@@H](O)CNc1cc[nH+]c2ccncc12 ZINC000085686789 345529091 /nfs/dbraw/zinc/52/90/91/345529091.db2.gz GTKXLNHWGGEJHP-HZMBPMFUSA-N 1 2 245.326 2.449 20 0 BEADLO CC(C)[C@H]([NH2+]C1CCOCC1)C(F)(F)F ZINC000308848491 187307331 /nfs/dbraw/zinc/30/73/31/187307331.db2.gz NCRKPUDPEFNYJP-VIFPVBQESA-N 1 2 225.254 2.342 20 0 BEADLO CC[C@H](C)CN(C)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635545478 345568791 /nfs/dbraw/zinc/56/87/91/345568791.db2.gz CKESKZLQGFKJRF-HBNTYKKESA-N 1 2 235.331 2.018 20 0 BEADLO CC[C@H](C)CN(C)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635545478 345568795 /nfs/dbraw/zinc/56/87/95/345568795.db2.gz CKESKZLQGFKJRF-HBNTYKKESA-N 1 2 235.331 2.018 20 0 BEADLO CCN(Cc1ccccn1)c1cc[nH+]c(C)n1 ZINC000084488846 345515366 /nfs/dbraw/zinc/51/53/66/345515366.db2.gz BNNOUMCZWCYEKP-UHFFFAOYSA-N 1 2 228.299 2.207 20 0 BEADLO COc1ccsc1C[N@@H+]1C[C@H](C)OC[C@H]1C ZINC000092017415 345614483 /nfs/dbraw/zinc/61/44/83/345614483.db2.gz WYRHBEDYBJQTJB-ZJUUUORDSA-N 1 2 241.356 2.366 20 0 BEADLO COc1ccsc1C[N@H+]1C[C@H](C)OC[C@H]1C ZINC000092017415 345614486 /nfs/dbraw/zinc/61/44/86/345614486.db2.gz WYRHBEDYBJQTJB-ZJUUUORDSA-N 1 2 241.356 2.366 20 0 BEADLO Cc1cc(C)c(NC(=O)[C@@H]2CCO[C@H]2C)c(C)[nH+]1 ZINC000092303427 345628321 /nfs/dbraw/zinc/62/83/21/345628321.db2.gz SQDBBTRMFFBRPB-NWDGAFQWSA-N 1 2 248.326 2.370 20 0 BEADLO COCc1cc(C[NH2+][C@@H](C)c2cccnc2)no1 ZINC000641703639 362614397 /nfs/dbraw/zinc/61/43/97/362614397.db2.gz ZJQUOKIIJNZGRC-JTQLQIEISA-N 1 2 247.298 2.067 20 0 BEADLO C[C@H]1CC[N@H+](Cc2ncn(-c3ccccc3)n2)C1 ZINC000092795536 345643136 /nfs/dbraw/zinc/64/31/36/345643136.db2.gz GVLYLTJQBFSUOS-LBPRGKRZSA-N 1 2 242.326 2.109 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2ncn(-c3ccccc3)n2)C1 ZINC000092795536 345643137 /nfs/dbraw/zinc/64/31/37/345643137.db2.gz GVLYLTJQBFSUOS-LBPRGKRZSA-N 1 2 242.326 2.109 20 0 BEADLO Cc1cc(N2CC[C@H](C)[C@H](O)C2)nc(C(C)C)[nH+]1 ZINC000092978001 345650516 /nfs/dbraw/zinc/65/05/16/345650516.db2.gz OXCNAXFSWMGPOB-CMPLNLGQSA-N 1 2 249.358 2.116 20 0 BEADLO CCC(F)(F)CNc1cc(CO)cc[nH+]1 ZINC000641677911 362600202 /nfs/dbraw/zinc/60/02/02/362600202.db2.gz OEHIZNOWDRFODS-UHFFFAOYSA-N 1 2 216.231 2.031 20 0 BEADLO Cc1cc(N[C@@H]2C[C@@H](C)O[C@H]2C)nc(C2CC2)[nH+]1 ZINC000631463190 345776645 /nfs/dbraw/zinc/77/66/45/345776645.db2.gz ATQMZZOHCNGQHW-JFGNBEQYSA-N 1 2 247.342 2.062 20 0 BEADLO CC(C)=C(C)CC(=O)N1CC(n2cc[nH+]c2)C1 ZINC000635565393 345789935 /nfs/dbraw/zinc/78/99/35/345789935.db2.gz NMLJRBJFPUMGOK-UHFFFAOYSA-N 1 2 233.315 2.013 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1CC[C@@H](c2n[nH]c(C)n2)C1 ZINC000528529337 323096635 /nfs/dbraw/zinc/09/66/35/323096635.db2.gz ZUSAXQQZYUWKKN-WPKZPIIRSA-N 1 2 240.738 2.045 20 0 BEADLO C[C@@H](NC(=O)CC1=CCCCC1)c1[nH]cc[nH+]1 ZINC000140952649 345826034 /nfs/dbraw/zinc/82/60/34/345826034.db2.gz WZGMWLJNRVWWAI-SNVBAGLBSA-N 1 2 233.315 2.477 20 0 BEADLO COC(=O)[C@@H]([NH2+][C@@H]1C[C@@H]1c1ccccc1)C1CC1 ZINC000227769291 345890889 /nfs/dbraw/zinc/89/08/89/345890889.db2.gz RSRPHSOCWFUFIN-MCIONIFRSA-N 1 2 245.322 2.084 20 0 BEADLO CC(C)C[C@H](C(=O)N(C)C1CCC1)n1cc[nH+]c1 ZINC000635613784 345892824 /nfs/dbraw/zinc/89/28/24/345892824.db2.gz IAWOAOONLNZQAK-CYBMUJFWSA-N 1 2 249.358 2.481 20 0 BEADLO CC[C@@H](C)C[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635614740 345893818 /nfs/dbraw/zinc/89/38/18/345893818.db2.gz FHJKIRMOGMZQRQ-DDHJBXDOSA-N 1 2 249.358 2.454 20 0 BEADLO CC[C@@H](C)C[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635614740 345893822 /nfs/dbraw/zinc/89/38/22/345893822.db2.gz FHJKIRMOGMZQRQ-DDHJBXDOSA-N 1 2 249.358 2.454 20 0 BEADLO Cc1cn2ccc(C(=O)NCCC3CC3)cc2[nH+]1 ZINC000635617859 345895235 /nfs/dbraw/zinc/89/52/35/345895235.db2.gz MNIHAZKNAXVCKH-UHFFFAOYSA-N 1 2 243.310 2.173 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1C(=O)NCCCn1cc[nH+]c1 ZINC000185168715 187310527 /nfs/dbraw/zinc/31/05/27/187310527.db2.gz SQZJNYBUXJDMEX-TZMCWYRMSA-N 1 2 249.358 2.072 20 0 BEADLO CC(C)=C(C)CC(=O)NC[C@@H](C)Cn1cc[nH+]c1 ZINC000635591761 345884879 /nfs/dbraw/zinc/88/48/79/345884879.db2.gz GUTZEMFRARBZAO-GFCCVEGCSA-N 1 2 249.358 2.382 20 0 BEADLO Cc1cn2ccc(C(=O)N3CCC[C@@H]3C)cc2[nH+]1 ZINC000635628715 345903304 /nfs/dbraw/zinc/90/33/04/345903304.db2.gz QLXAGTVDAOXVSW-NSHDSACASA-N 1 2 243.310 2.267 20 0 BEADLO CC(C)C[C@H](C(=O)N1CCC[C@H]1C)n1cc[nH+]c1 ZINC000635628865 345903317 /nfs/dbraw/zinc/90/33/17/345903317.db2.gz RVGRGVDWCYFAEB-CHWSQXEVSA-N 1 2 249.358 2.481 20 0 BEADLO CC[C@H]1C[C@H](C)CN1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635634322 345908416 /nfs/dbraw/zinc/90/84/16/345908416.db2.gz DGZFBVAFPGPYJJ-NNYUYHANSA-N 1 2 247.342 2.160 20 0 BEADLO CC[C@H]1C[C@H](C)CN1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635634322 345908419 /nfs/dbraw/zinc/90/84/19/345908419.db2.gz DGZFBVAFPGPYJJ-NNYUYHANSA-N 1 2 247.342 2.160 20 0 BEADLO CCc1c[nH]c(CC(=O)N2C[C@H](C)C[C@@H]2CC)[nH+]1 ZINC000635636172 345910733 /nfs/dbraw/zinc/91/07/33/345910733.db2.gz XXZQPUANBYZOLJ-PWSUYJOCSA-N 1 2 249.358 2.162 20 0 BEADLO C[C@@H]1CC[C@@H](C)N(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635632861 345911226 /nfs/dbraw/zinc/91/12/26/345911226.db2.gz VEZKOZDZOZMUMA-DDHJBXDOSA-N 1 2 247.342 2.160 20 0 BEADLO C[C@@H]1CC[C@@H](C)N(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635632861 345911229 /nfs/dbraw/zinc/91/12/29/345911229.db2.gz VEZKOZDZOZMUMA-DDHJBXDOSA-N 1 2 247.342 2.160 20 0 BEADLO CC[C@](C)(C[NH2+][C@H](C)C(=O)OC(C)(C)C)OC ZINC000322640000 345957017 /nfs/dbraw/zinc/95/70/17/345957017.db2.gz UBSNZAJVLCEXEF-ZWNOBZJWSA-N 1 2 245.363 2.121 20 0 BEADLO COc1cccc2c1CC[C@H]2[NH2+]Cc1cocn1 ZINC000182078132 345933093 /nfs/dbraw/zinc/93/30/93/345933093.db2.gz REWWDDDOHUWKAN-CYBMUJFWSA-N 1 2 244.294 2.460 20 0 BEADLO CNc1cc(N2C[C@H](C)C[C@@H](C)C2)nc[nH+]1 ZINC000087805637 345941177 /nfs/dbraw/zinc/94/11/77/345941177.db2.gz VPJCYVVGOPRABG-NXEZZACHSA-N 1 2 220.320 2.001 20 0 BEADLO CNc1cc(N2C[C@H](C)C[C@@H](C)C2)[nH+]cn1 ZINC000087805637 345941179 /nfs/dbraw/zinc/94/11/79/345941179.db2.gz VPJCYVVGOPRABG-NXEZZACHSA-N 1 2 220.320 2.001 20 0 BEADLO CC[C@H]1CCCCN1c1cc(NC)[nH+]cn1 ZINC000087808997 345942282 /nfs/dbraw/zinc/94/22/82/345942282.db2.gz VFQBOABEDSHERY-JTQLQIEISA-N 1 2 220.320 2.287 20 0 BEADLO CC[C@H]1CCCCN1c1cc(NC)nc[nH+]1 ZINC000087808997 345942283 /nfs/dbraw/zinc/94/22/83/345942283.db2.gz VFQBOABEDSHERY-JTQLQIEISA-N 1 2 220.320 2.287 20 0 BEADLO Cc1nc(N2CCC(OC3CCC3)CC2)cc[nH+]1 ZINC000418978145 192093518 /nfs/dbraw/zinc/09/35/18/192093518.db2.gz YCZYORUEBRUKAC-UHFFFAOYSA-N 1 2 247.342 2.323 20 0 BEADLO C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)CC[C@@H]1C ZINC000635754089 346050303 /nfs/dbraw/zinc/05/03/03/346050303.db2.gz UNYSKLUFOAEETD-NNYUYHANSA-N 1 2 247.342 2.018 20 0 BEADLO C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)CC[C@@H]1C ZINC000635754089 346050306 /nfs/dbraw/zinc/05/03/06/346050306.db2.gz UNYSKLUFOAEETD-NNYUYHANSA-N 1 2 247.342 2.018 20 0 BEADLO C[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C[C@H]1C ZINC000635754087 346050712 /nfs/dbraw/zinc/05/07/12/346050712.db2.gz UNYSKLUFOAEETD-IRCOFANPSA-N 1 2 247.342 2.018 20 0 BEADLO C[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C[C@H]1C ZINC000635754087 346050714 /nfs/dbraw/zinc/05/07/14/346050714.db2.gz UNYSKLUFOAEETD-IRCOFANPSA-N 1 2 247.342 2.018 20 0 BEADLO CC(C)c1cnc(C[N@H+](C)[C@@H]2CCOC2)s1 ZINC000346135042 187363421 /nfs/dbraw/zinc/36/34/21/187363421.db2.gz GNFMMULMUPPXQA-SNVBAGLBSA-N 1 2 240.372 2.487 20 0 BEADLO CC(C)c1cnc(C[N@@H+](C)[C@@H]2CCOC2)s1 ZINC000346135042 187363423 /nfs/dbraw/zinc/36/34/23/187363423.db2.gz GNFMMULMUPPXQA-SNVBAGLBSA-N 1 2 240.372 2.487 20 0 BEADLO CC[C@@H]1C[N@H+](CCC(F)(F)F)CCO1 ZINC000148565895 346036582 /nfs/dbraw/zinc/03/65/82/346036582.db2.gz SVWPXTGGSXKBAX-MRVPVSSYSA-N 1 2 211.227 2.050 20 0 BEADLO CC[C@@H]1C[N@@H+](CCC(F)(F)F)CCO1 ZINC000148565895 346036584 /nfs/dbraw/zinc/03/65/84/346036584.db2.gz SVWPXTGGSXKBAX-MRVPVSSYSA-N 1 2 211.227 2.050 20 0 BEADLO CC[C@@H]1[C@H](C)CCN1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635815435 346071317 /nfs/dbraw/zinc/07/13/17/346071317.db2.gz AYXMIFWIITTZNV-PRULPYPASA-N 1 2 247.342 2.160 20 0 BEADLO CC[C@@H]1[C@H](C)CCN1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635815435 346071320 /nfs/dbraw/zinc/07/13/20/346071320.db2.gz AYXMIFWIITTZNV-PRULPYPASA-N 1 2 247.342 2.160 20 0 BEADLO CC[C@H]1[C@@H](C)CCN1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635815438 346071575 /nfs/dbraw/zinc/07/15/75/346071575.db2.gz AYXMIFWIITTZNV-WGBDABJCSA-N 1 2 247.342 2.160 20 0 BEADLO CC[C@H]1[C@@H](C)CCN1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635815438 346071578 /nfs/dbraw/zinc/07/15/78/346071578.db2.gz AYXMIFWIITTZNV-WGBDABJCSA-N 1 2 247.342 2.160 20 0 BEADLO CC(C)C(C)(C)CNC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635836000 346081626 /nfs/dbraw/zinc/08/16/26/346081626.db2.gz RYOKKYDTIISNHR-GHMZBOCLSA-N 1 2 249.358 2.312 20 0 BEADLO CC(C)C(C)(C)CNC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635836000 346081627 /nfs/dbraw/zinc/08/16/27/346081627.db2.gz RYOKKYDTIISNHR-GHMZBOCLSA-N 1 2 249.358 2.312 20 0 BEADLO FC1(C[N@H+]2CCC[C@@H](c3ccn[nH]3)C2)CC1 ZINC000684357134 488300077 /nfs/dbraw/zinc/30/00/77/488300077.db2.gz XWLHIKFYLSYPSY-SNVBAGLBSA-N 1 2 223.295 2.091 20 0 BEADLO CCc1c[nH]c(CC(=O)N(C)C2(C)CCCC2)[nH+]1 ZINC000635869854 346092406 /nfs/dbraw/zinc/09/24/06/346092406.db2.gz SYQSTLCXYGMPGC-UHFFFAOYSA-N 1 2 249.358 2.306 20 0 BEADLO CCc1[nH]c(CNC(=O)C[C@@H](C)CC)c[nH+]1 ZINC001639093568 1172073943 /nfs/dbraw/zinc/07/39/43/1172073943.db2.gz JDCKCLGETAADJK-VIFPVBQESA-N 1 2 223.320 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)C[C@@H](C)CC)[nH+]1 ZINC001639093568 1172073951 /nfs/dbraw/zinc/07/39/51/1172073951.db2.gz JDCKCLGETAADJK-VIFPVBQESA-N 1 2 223.320 2.025 20 0 BEADLO Cc1cn2ccc(C(=O)N3[C@@H](C)C[C@@H]3C)cc2[nH+]1 ZINC000635875809 346096071 /nfs/dbraw/zinc/09/60/71/346096071.db2.gz PURBCVMFDURGKT-QWRGUYRKSA-N 1 2 243.310 2.266 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CCC(C)=C(C)C2)[nH+]1 ZINC000635887610 346098316 /nfs/dbraw/zinc/09/83/16/346098316.db2.gz XTJVYOXNHDQKQF-UHFFFAOYSA-N 1 2 247.342 2.083 20 0 BEADLO CC[C@@H]1C[C@H]1NC(=O)c1ccn2cc(C)[nH+]c2c1 ZINC000635889492 346099774 /nfs/dbraw/zinc/09/97/74/346099774.db2.gz MNEPBDNWVWOBKL-ZYHUDNBSSA-N 1 2 243.310 2.171 20 0 BEADLO Cc1cn2ccc(C(=O)N[C@@H]3CC[C@@H]3C)cc2[nH+]1 ZINC000635924916 346116097 /nfs/dbraw/zinc/11/60/97/346116097.db2.gz FNEGRSDGRNDTBT-JOYOIKCWSA-N 1 2 243.310 2.171 20 0 BEADLO CCN(C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)[C@@H](C)C(C)C ZINC000635940860 346124039 /nfs/dbraw/zinc/12/40/39/346124039.db2.gz AAISOWVPCCGWED-QJPTWQEYSA-N 1 2 249.358 2.406 20 0 BEADLO CCN(C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)[C@@H](C)C(C)C ZINC000635940860 346124043 /nfs/dbraw/zinc/12/40/43/346124043.db2.gz AAISOWVPCCGWED-QJPTWQEYSA-N 1 2 249.358 2.406 20 0 BEADLO CO[C@H](CNc1cc[nH+]c(C2CC2)n1)CC(C)C ZINC000419000817 192097079 /nfs/dbraw/zinc/09/70/79/192097079.db2.gz YLSAKEVQGDUKAT-LBPRGKRZSA-N 1 2 249.358 2.249 20 0 BEADLO CC[C@@H]1CCN1C(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC000635958288 346132240 /nfs/dbraw/zinc/13/22/40/346132240.db2.gz WFAFDFCMZULVOS-OLZOCXBDSA-N 1 2 249.358 2.481 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CC(CC)(CC)C2)[nH+]1 ZINC000635962084 346134088 /nfs/dbraw/zinc/13/40/88/346134088.db2.gz FUEYCQHQICKAFV-UHFFFAOYSA-N 1 2 249.358 2.163 20 0 BEADLO Cc1ncc(CNc2ccc(N(C)C)c[nH+]2)o1 ZINC000628229309 346178279 /nfs/dbraw/zinc/17/82/79/346178279.db2.gz QISFGQAMZFEBOG-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO CCc1noc(CC)c1C[NH2+]Cc1cnc(C)o1 ZINC000628229143 346177641 /nfs/dbraw/zinc/17/76/41/346177641.db2.gz KPNHYTHXNTWHOL-UHFFFAOYSA-N 1 2 249.314 2.386 20 0 BEADLO C[C@@]1(NC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)CC=CCC1 ZINC000636021198 346159186 /nfs/dbraw/zinc/15/91/86/346159186.db2.gz KVTJOAZDZAHZLL-JTNHKYCSSA-N 1 2 245.326 2.128 20 0 BEADLO C[C@@]1(NC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)CC=CCC1 ZINC000636021198 346159188 /nfs/dbraw/zinc/15/91/88/346159188.db2.gz KVTJOAZDZAHZLL-JTNHKYCSSA-N 1 2 245.326 2.128 20 0 BEADLO Cc1[nH]c(CN2C[C@H](C)O[C@@H](C)[C@@H]2C)[nH+]c1C ZINC000628244681 346209484 /nfs/dbraw/zinc/20/94/84/346209484.db2.gz RSPLSDAMPUVPHY-UWJYBYFXSA-N 1 2 237.347 2.024 20 0 BEADLO Cc1ncc(C[NH2+][C@@H](C)c2nnc(C(C)C)[nH]2)o1 ZINC000628231550 346184187 /nfs/dbraw/zinc/18/41/87/346184187.db2.gz SJYJXVWSDQHSIL-QMMMGPOBSA-N 1 2 249.318 2.075 20 0 BEADLO Cc1[nH]c(CN2CCC=C(F)C2)[nH+]c1C ZINC000628235681 346189652 /nfs/dbraw/zinc/18/96/52/346189652.db2.gz YRGMCFSEHJWISC-UHFFFAOYSA-N 1 2 209.268 2.086 20 0 BEADLO OCc1ccc(NCc2cnc(C3CC3)o2)[nH+]c1 ZINC000628259485 346259185 /nfs/dbraw/zinc/25/91/85/346259185.db2.gz WLHKGQPAOQKWSA-UHFFFAOYSA-N 1 2 245.282 2.051 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CC(C)(C)[C@H]2[C@H]2CCCO2)n1 ZINC000628284205 346296242 /nfs/dbraw/zinc/29/62/42/346296242.db2.gz CQSKTCLHSPAGLM-DGCLKSJQSA-N 1 2 249.358 2.108 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CC(C)(C)[C@H]2[C@H]2CCCO2)n1 ZINC000628284205 346296244 /nfs/dbraw/zinc/29/62/44/346296244.db2.gz CQSKTCLHSPAGLM-DGCLKSJQSA-N 1 2 249.358 2.108 20 0 BEADLO CC(C)C[C@H](C(=O)N[C@H]1CC12CC2)n1cc[nH+]c1 ZINC000636056194 346302918 /nfs/dbraw/zinc/30/29/18/346302918.db2.gz KHHFRYNJYVPTLC-NEPJUHHUSA-N 1 2 247.342 2.139 20 0 BEADLO CCOC1CC(N(C)Cc2[nH]c(C)c(C)[nH+]2)C1 ZINC000628281703 346291859 /nfs/dbraw/zinc/29/18/59/346291859.db2.gz QISJBNYEBVXLLC-UHFFFAOYSA-N 1 2 237.347 2.026 20 0 BEADLO CCc1c[nH]c(CC(=O)NCC[C@H](C)CC)[nH+]1 ZINC000636169059 346344821 /nfs/dbraw/zinc/34/48/21/346344821.db2.gz GXWIWSLIVAEAHB-SNVBAGLBSA-N 1 2 237.347 2.067 20 0 BEADLO CC(C)=C(C)CC(=O)N[C@H](C)c1[nH+]ccn1C ZINC000636211402 346354775 /nfs/dbraw/zinc/35/47/75/346354775.db2.gz FBCBULUTDFNECX-LLVKDONJSA-N 1 2 235.331 2.344 20 0 BEADLO CCc1c[nH]c(CC(=O)N(C)C[C@H]2CC2(C)C)[nH+]1 ZINC000636236698 346366015 /nfs/dbraw/zinc/36/60/15/346366015.db2.gz BTLPIAXREUEOQL-SNVBAGLBSA-N 1 2 249.358 2.019 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636156492 346338124 /nfs/dbraw/zinc/33/81/24/346338124.db2.gz SSJZQRWMQMIUNF-GMTAPVOTSA-N 1 2 235.331 2.160 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636156492 346338127 /nfs/dbraw/zinc/33/81/27/346338127.db2.gz SSJZQRWMQMIUNF-GMTAPVOTSA-N 1 2 235.331 2.160 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)CC(=O)OC(C)(C)C)C(F)F ZINC000603431476 349953477 /nfs/dbraw/zinc/95/34/77/349953477.db2.gz YCBPBMCELHSUBK-JGVFFNPUSA-N 1 2 237.290 2.350 20 0 BEADLO Cc1ccc2c(c1)CC[N@@H+](Cc1nccn1C)C2 ZINC000336309684 187367365 /nfs/dbraw/zinc/36/73/65/187367365.db2.gz LEXLOKFWCRADGO-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO Cc1ccc2c(c1)CC[N@H+](Cc1nccn1C)C2 ZINC000336309684 187367366 /nfs/dbraw/zinc/36/73/66/187367366.db2.gz LEXLOKFWCRADGO-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO Cc1cccc(C[N@@H+](C)[C@@H]2CCOC2=O)c1C ZINC000298453047 179068252 /nfs/dbraw/zinc/06/82/52/179068252.db2.gz ZZMACUMWQZRRED-CYBMUJFWSA-N 1 2 233.311 2.051 20 0 BEADLO Cc1cccc(C[N@H+](C)[C@@H]2CCOC2=O)c1C ZINC000298453047 179068256 /nfs/dbraw/zinc/06/82/56/179068256.db2.gz ZZMACUMWQZRRED-CYBMUJFWSA-N 1 2 233.311 2.051 20 0 BEADLO C[C@H]1CC[N@H+](Cc2nccs2)C[C@H]1F ZINC000679218167 488318026 /nfs/dbraw/zinc/31/80/26/488318026.db2.gz CEZJPICTZSJVNM-DTWKUNHWSA-N 1 2 214.309 2.323 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2nccs2)C[C@H]1F ZINC000679218167 488318027 /nfs/dbraw/zinc/31/80/27/488318027.db2.gz CEZJPICTZSJVNM-DTWKUNHWSA-N 1 2 214.309 2.323 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2ncccn2)c1 ZINC000361698128 179069316 /nfs/dbraw/zinc/06/93/16/179069316.db2.gz BZKGTENZUUHHHR-UHFFFAOYSA-N 1 2 227.311 2.417 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2ncccn2)c1 ZINC000361698128 179069318 /nfs/dbraw/zinc/06/93/18/179069318.db2.gz BZKGTENZUUHHHR-UHFFFAOYSA-N 1 2 227.311 2.417 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2nncn2C)c1C ZINC000290266987 179069419 /nfs/dbraw/zinc/06/94/19/179069419.db2.gz XJTWGRSCGZHWQS-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2nncn2C)c1C ZINC000290266987 179069421 /nfs/dbraw/zinc/06/94/21/179069421.db2.gz XJTWGRSCGZHWQS-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cccc(C[N@@H+](C)[C@H]2CCOC2=O)c1C ZINC000298453050 179071216 /nfs/dbraw/zinc/07/12/16/179071216.db2.gz ZZMACUMWQZRRED-ZDUSSCGKSA-N 1 2 233.311 2.051 20 0 BEADLO Cc1cccc(C[N@H+](C)[C@H]2CCOC2=O)c1C ZINC000298453050 179071218 /nfs/dbraw/zinc/07/12/18/179071218.db2.gz ZZMACUMWQZRRED-ZDUSSCGKSA-N 1 2 233.311 2.051 20 0 BEADLO CCC1(C)CN(c2nc(C)[nH+]cc2C)C1 ZINC000574927595 346415778 /nfs/dbraw/zinc/41/57/78/346415778.db2.gz PCZXFYFIFKXDEI-UHFFFAOYSA-N 1 2 205.305 2.330 20 0 BEADLO COc1cc([C@@H](C)[NH2+][C@H](C)C(F)F)ccn1 ZINC000641792465 362727810 /nfs/dbraw/zinc/72/78/10/362727810.db2.gz VUXDNCGOSMFGHM-HTQZYQBOSA-N 1 2 230.258 2.394 20 0 BEADLO Cc1cccc(C[N@@H+]2CCOCC2(C)C)n1 ZINC000335709761 179080140 /nfs/dbraw/zinc/08/01/40/179080140.db2.gz ROZCXMPFHZJOMF-UHFFFAOYSA-N 1 2 220.316 2.001 20 0 BEADLO Cc1cccc(C[N@H+]2CCOCC2(C)C)n1 ZINC000335709761 179080142 /nfs/dbraw/zinc/08/01/42/179080142.db2.gz ROZCXMPFHZJOMF-UHFFFAOYSA-N 1 2 220.316 2.001 20 0 BEADLO c1cc(C[NH2+]C23CC(c4ccccc4)(C2)C3)[nH]n1 ZINC000641790699 362728520 /nfs/dbraw/zinc/72/85/20/362728520.db2.gz QPNPIZVSVCHTSE-UHFFFAOYSA-N 1 2 239.322 2.374 20 0 BEADLO C[C@H](NCc1c[nH+]c2ccccn12)C(F)F ZINC000641793016 362728971 /nfs/dbraw/zinc/72/89/71/362728971.db2.gz ALQFFUMDLYVFTG-QMMMGPOBSA-N 1 2 225.242 2.078 20 0 BEADLO CC(=O)Nc1cccc(C[NH2+][C@H](C)C(F)F)c1 ZINC000641794340 362733976 /nfs/dbraw/zinc/73/39/76/362733976.db2.gz NDRAQADSUGTZNW-MRVPVSSYSA-N 1 2 242.269 2.388 20 0 BEADLO C[C@H]([NH2+]Cc1c2c(nn1C)CCCC2)C(F)F ZINC000641795166 362738691 /nfs/dbraw/zinc/73/86/91/362738691.db2.gz VFOIKIYUMPJGIF-QMMMGPOBSA-N 1 2 243.301 2.042 20 0 BEADLO FCC1([NH2+]Cc2cscn2)CCC1 ZINC000577105900 365817170 /nfs/dbraw/zinc/81/71/70/365817170.db2.gz CJEVFYKEBWCMKL-UHFFFAOYSA-N 1 2 200.282 2.125 20 0 BEADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1nc(C)no1 ZINC000162545586 346526632 /nfs/dbraw/zinc/52/66/32/346526632.db2.gz ISVPBBBFKHFEMG-LBPRGKRZSA-N 1 2 246.314 2.356 20 0 BEADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1nc(C)no1 ZINC000162545586 346526637 /nfs/dbraw/zinc/52/66/37/346526637.db2.gz ISVPBBBFKHFEMG-LBPRGKRZSA-N 1 2 246.314 2.356 20 0 BEADLO Cc1cc(C)cc(NC(=O)Cc2c[nH+]cn2C)c1 ZINC000186776858 346537139 /nfs/dbraw/zinc/53/71/39/346537139.db2.gz CZXPENBGGZQAMM-UHFFFAOYSA-N 1 2 243.310 2.218 20 0 BEADLO CC[C@@H]([NH2+]Cc1cnc[nH]1)c1nc(C)cs1 ZINC000163908843 346581984 /nfs/dbraw/zinc/58/19/84/346581984.db2.gz CQXHAXKMLORLLH-SNVBAGLBSA-N 1 2 236.344 2.416 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N(C)C[C@@H]1CC1(C)C ZINC000621043575 346585625 /nfs/dbraw/zinc/58/56/25/346585625.db2.gz FANJCYDRCVCDPI-MNOVXSKESA-N 1 2 249.358 2.093 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N(C)C[C@@H]1CC1(C)C ZINC000621043575 346585626 /nfs/dbraw/zinc/58/56/26/346585626.db2.gz FANJCYDRCVCDPI-MNOVXSKESA-N 1 2 249.358 2.093 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1cnc(C)nc1 ZINC000588169487 346645064 /nfs/dbraw/zinc/64/50/64/346645064.db2.gz HLRFCYAJPFXTJT-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1cnc(C)nc1 ZINC000588169487 346645065 /nfs/dbraw/zinc/64/50/65/346645065.db2.gz HLRFCYAJPFXTJT-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO c1ccc2c(C[NH2+]Cc3cccnc3)n[nH]c2c1 ZINC000589634217 346719992 /nfs/dbraw/zinc/71/99/92/346719992.db2.gz RTKMOFIFWIIRIP-UHFFFAOYSA-N 1 2 238.294 2.248 20 0 BEADLO COCC(C)(C)[NH2+]Cc1n[nH]c2ccccc21 ZINC000589650550 346724050 /nfs/dbraw/zinc/72/40/50/346724050.db2.gz MWFPWVUUBKEXED-UHFFFAOYSA-N 1 2 233.315 2.078 20 0 BEADLO CC[C@H](C(=O)OC)[N@@H+]1CCc2sccc2C1 ZINC000193050886 259393172 /nfs/dbraw/zinc/39/31/72/259393172.db2.gz PXFKEBCSVVRHIK-SNVBAGLBSA-N 1 2 239.340 2.058 20 0 BEADLO CC[C@H](C(=O)OC)[N@H+]1CCc2sccc2C1 ZINC000193050886 259393174 /nfs/dbraw/zinc/39/31/74/259393174.db2.gz PXFKEBCSVVRHIK-SNVBAGLBSA-N 1 2 239.340 2.058 20 0 BEADLO CC(C)(C)CC(=O)N1CC(Oc2cc[nH+]cc2)C1 ZINC000589987812 346761346 /nfs/dbraw/zinc/76/13/46/346761346.db2.gz JEZBLKRPCWOENS-UHFFFAOYSA-N 1 2 248.326 2.107 20 0 BEADLO C[C@@H]1CN(c2[nH+]ccc3ccccc32)C[C@@H]1O ZINC000387846225 347109810 /nfs/dbraw/zinc/10/98/10/347109810.db2.gz CCMGQNNJWQEPSH-MFKMUULPSA-N 1 2 228.295 2.052 20 0 BEADLO CCc1nc(C)c(C[NH2+]Cc2oc(C)nc2C)o1 ZINC000628293065 347117643 /nfs/dbraw/zinc/11/76/43/347117643.db2.gz KGJYYASXZXJZMK-UHFFFAOYSA-N 1 2 249.314 2.440 20 0 BEADLO CCc1nc(C[NH2+][C@H](C)c2cn[nH]c2)cs1 ZINC000309957776 347205700 /nfs/dbraw/zinc/20/57/00/347205700.db2.gz JJLCJFSMSOUAMB-MRVPVSSYSA-N 1 2 236.344 2.279 20 0 BEADLO Cc1cccc([C@@H](C)C(=O)NCc2[nH]cc[nH+]2)c1 ZINC000122156684 179179322 /nfs/dbraw/zinc/17/93/22/179179322.db2.gz URFSZOJIPJDNRS-LLVKDONJSA-N 1 2 243.310 2.138 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CCO[C@H]3CCC[C@H]32)cn1 ZINC000334346762 535058934 /nfs/dbraw/zinc/05/89/34/535058934.db2.gz WJFPRNGQDWIMFE-KGLIPLIRSA-N 1 2 249.358 2.217 20 0 BEADLO CC(C)n1cc(C[N@H+]2CCO[C@H]3CCC[C@H]32)cn1 ZINC000334346762 535058939 /nfs/dbraw/zinc/05/89/39/535058939.db2.gz WJFPRNGQDWIMFE-KGLIPLIRSA-N 1 2 249.358 2.217 20 0 BEADLO Cc1cccc([C@@H](O)CNc2cc(C)[nH+]cn2)c1 ZINC000132589080 179189010 /nfs/dbraw/zinc/18/90/10/179189010.db2.gz UJHHLTGZBXYJNM-ZDUSSCGKSA-N 1 2 243.310 2.239 20 0 BEADLO Cc1ncc(C[N@@H+]2C[C@]3(CCCO3)[C@H]2C2CC2)o1 ZINC000628297121 347244450 /nfs/dbraw/zinc/24/44/50/347244450.db2.gz KMXQKJQYNOLDCR-ZIAGYGMSSA-N 1 2 248.326 2.126 20 0 BEADLO Cc1ncc(C[N@H+]2C[C@]3(CCCO3)[C@H]2C2CC2)o1 ZINC000628297121 347244452 /nfs/dbraw/zinc/24/44/52/347244452.db2.gz KMXQKJQYNOLDCR-ZIAGYGMSSA-N 1 2 248.326 2.126 20 0 BEADLO CC[C@H]1CCC[C@H]1C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627372832 347256596 /nfs/dbraw/zinc/25/65/96/347256596.db2.gz XWRYOGNQTCSCMA-WDEREUQCSA-N 1 2 247.342 2.121 20 0 BEADLO CC[C@H]1CCC[C@H]1C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627372832 347256598 /nfs/dbraw/zinc/25/65/98/347256598.db2.gz XWRYOGNQTCSCMA-WDEREUQCSA-N 1 2 247.342 2.121 20 0 BEADLO CO[C@@H]([C@@H](C)Nc1cccc[nH+]1)C1CC1 ZINC000388268656 347279380 /nfs/dbraw/zinc/27/93/80/347279380.db2.gz GIFLFTNCMGKECM-SKDRFNHKSA-N 1 2 206.289 2.307 20 0 BEADLO C[C@H]1CCC[C@@]1(C)C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627373473 347373697 /nfs/dbraw/zinc/37/36/97/347373697.db2.gz SIGWDTXVEHAUNH-IINYFYTJSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@H]1CCC[C@@]1(C)C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627373473 347373698 /nfs/dbraw/zinc/37/36/98/347373698.db2.gz SIGWDTXVEHAUNH-IINYFYTJSA-N 1 2 247.342 2.121 20 0 BEADLO CC(C)(C)[C@@H]1CCN(c2cc(CO)cc[nH+]2)C1 ZINC000161561124 362822554 /nfs/dbraw/zinc/82/25/54/362822554.db2.gz GIXKYPHWJAATHD-GFCCVEGCSA-N 1 2 234.343 2.446 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)[C@@H]1C[C@H]1CC(C)(C)C ZINC000616921140 347450177 /nfs/dbraw/zinc/45/01/77/347450177.db2.gz GPULETGCFGKKSE-CMPLNLGQSA-N 1 2 249.358 2.440 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)[C@@H]1C[C@H]1CC(C)(C)C ZINC000616921140 347450179 /nfs/dbraw/zinc/45/01/79/347450179.db2.gz GPULETGCFGKKSE-CMPLNLGQSA-N 1 2 249.358 2.440 20 0 BEADLO Cc1cccc2[nH+]cc(CNCC(F)(F)F)n21 ZINC000340557189 179230834 /nfs/dbraw/zinc/23/08/34/179230834.db2.gz KHVMRKQYVRTRHI-UHFFFAOYSA-N 1 2 243.232 2.295 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)[C@@H]1CCCC2(CC2)C1 ZINC000616922143 347452697 /nfs/dbraw/zinc/45/26/97/347452697.db2.gz QVKNYYLEBULOIF-LLVKDONJSA-N 1 2 247.342 2.339 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)[C@@H]1CCCC2(CC2)C1 ZINC000616922143 347452698 /nfs/dbraw/zinc/45/26/98/347452698.db2.gz QVKNYYLEBULOIF-LLVKDONJSA-N 1 2 247.342 2.339 20 0 BEADLO CCc1ccc(C(=O)N(C)Cc2c[nH+]c[nH]2)cc1 ZINC000616922123 347452703 /nfs/dbraw/zinc/45/27/03/347452703.db2.gz QIAJLDYHTLKSRC-UHFFFAOYSA-N 1 2 243.310 2.244 20 0 BEADLO CCc1ccc(C(=O)N(C)Cc2c[nH]c[nH+]2)cc1 ZINC000616922123 347452704 /nfs/dbraw/zinc/45/27/04/347452704.db2.gz QIAJLDYHTLKSRC-UHFFFAOYSA-N 1 2 243.310 2.244 20 0 BEADLO C[C@H](C(=O)N(C)Cc1c[nH+]c[nH]1)c1ccsc1 ZINC000616925356 347455557 /nfs/dbraw/zinc/45/55/57/347455557.db2.gz FILFGHSXPHOLRR-VIFPVBQESA-N 1 2 249.339 2.233 20 0 BEADLO C[C@H](C(=O)N(C)Cc1c[nH]c[nH+]1)c1ccsc1 ZINC000616925356 347455559 /nfs/dbraw/zinc/45/55/59/347455559.db2.gz FILFGHSXPHOLRR-VIFPVBQESA-N 1 2 249.339 2.233 20 0 BEADLO CC[C@@H](C)[C@@H]([NH2+]CCc1ccccc1)C(=O)OC ZINC000035044497 358453065 /nfs/dbraw/zinc/45/30/65/358453065.db2.gz YNYWNHSEWFELCZ-TZMCWYRMSA-N 1 2 249.354 2.406 20 0 BEADLO CC[C@@H](C)CCC(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616928726 347494913 /nfs/dbraw/zinc/49/49/13/347494913.db2.gz JYDBGNRVZMVLCL-SNVBAGLBSA-N 1 2 223.320 2.194 20 0 BEADLO CC[C@@H](C)CCC(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616928726 347494916 /nfs/dbraw/zinc/49/49/16/347494916.db2.gz JYDBGNRVZMVLCL-SNVBAGLBSA-N 1 2 223.320 2.194 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)CC(C)(C)C1CC1 ZINC000616928543 347495257 /nfs/dbraw/zinc/49/52/57/347495257.db2.gz DVMXIEUGYHLZAU-UHFFFAOYSA-N 1 2 235.331 2.194 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)CC(C)(C)C1CC1 ZINC000616928543 347495260 /nfs/dbraw/zinc/49/52/60/347495260.db2.gz DVMXIEUGYHLZAU-UHFFFAOYSA-N 1 2 235.331 2.194 20 0 BEADLO CCC(C)(C)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000590727041 347496709 /nfs/dbraw/zinc/49/67/09/347496709.db2.gz IAQQOTGRKDYZAE-LBPRGKRZSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1cc(C(=O)N(C)Cc2c[nH+]c[nH]2)cs1 ZINC000616929388 347497496 /nfs/dbraw/zinc/49/74/96/347497496.db2.gz ZZQWIBDXMSZFDF-UHFFFAOYSA-N 1 2 235.312 2.052 20 0 BEADLO Cc1cc(C(=O)N(C)Cc2c[nH]c[nH+]2)cs1 ZINC000616929388 347497497 /nfs/dbraw/zinc/49/74/97/347497497.db2.gz ZZQWIBDXMSZFDF-UHFFFAOYSA-N 1 2 235.312 2.052 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000616973857 347544949 /nfs/dbraw/zinc/54/49/49/347544949.db2.gz FCANZJBJJQZNSR-GHMZBOCLSA-N 1 2 237.347 2.235 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000616973857 347544952 /nfs/dbraw/zinc/54/49/52/347544952.db2.gz FCANZJBJJQZNSR-GHMZBOCLSA-N 1 2 237.347 2.235 20 0 BEADLO Cc1ccccc1CCC[N@@H+](C)Cc1nnc[nH]1 ZINC000175912441 179261273 /nfs/dbraw/zinc/26/12/73/179261273.db2.gz GSIFPBUPWFTIHG-UHFFFAOYSA-N 1 2 244.342 2.178 20 0 BEADLO Cc1ccccc1CCC[N@H+](C)Cc1nnc[nH]1 ZINC000175912441 179261276 /nfs/dbraw/zinc/26/12/76/179261276.db2.gz GSIFPBUPWFTIHG-UHFFFAOYSA-N 1 2 244.342 2.178 20 0 BEADLO Cc1cccn2cc(CN(C)CC(F)F)[nH+]c12 ZINC000590942668 347590807 /nfs/dbraw/zinc/59/08/07/347590807.db2.gz MPIJWJUAEZSCEI-UHFFFAOYSA-N 1 2 239.269 2.340 20 0 BEADLO Cc1ccncc1NC(=O)CCCn1cc[nH+]c1 ZINC000591241285 347633053 /nfs/dbraw/zinc/63/30/53/347633053.db2.gz WAWYWTCADBJGET-UHFFFAOYSA-N 1 2 244.298 2.005 20 0 BEADLO CCC(CC)CNC(=O)CCCn1cc[nH+]c1 ZINC000591291475 347638041 /nfs/dbraw/zinc/63/80/41/347638041.db2.gz FQHUHQBXVHNOLS-UHFFFAOYSA-N 1 2 237.347 2.216 20 0 BEADLO Cc1cc(NC(=O)C[C@H](C)n2cccc2)cc[nH+]1 ZINC000591421731 347657737 /nfs/dbraw/zinc/65/77/37/347657737.db2.gz NDELIACUGSWDMG-LBPRGKRZSA-N 1 2 243.310 2.203 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@H](n3ccnc3)C2)no1 ZINC000591866728 347707403 /nfs/dbraw/zinc/70/74/03/347707403.db2.gz DQCXOLIPHMGUFM-ZDUSSCGKSA-N 1 2 246.314 2.017 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@H](n3ccnc3)C2)no1 ZINC000591866728 347707404 /nfs/dbraw/zinc/70/74/04/347707404.db2.gz DQCXOLIPHMGUFM-ZDUSSCGKSA-N 1 2 246.314 2.017 20 0 BEADLO CCOC[C@H](C)[NH2+][C@@H](CC)C(=O)OC(C)(C)C ZINC000592399324 347777156 /nfs/dbraw/zinc/77/71/56/347777156.db2.gz GJZOCKZYDZXSFF-QWRGUYRKSA-N 1 2 245.363 2.121 20 0 BEADLO CC[N@H+](CCSC)Cc1nnc(C(C)C)[nH]1 ZINC000592202975 347754483 /nfs/dbraw/zinc/75/44/83/347754483.db2.gz UEGCKAVWCXCUOR-UHFFFAOYSA-N 1 2 242.392 2.113 20 0 BEADLO CC[N@@H+](CCSC)Cc1nnc(C(C)C)[nH]1 ZINC000592202975 347754486 /nfs/dbraw/zinc/75/44/86/347754486.db2.gz UEGCKAVWCXCUOR-UHFFFAOYSA-N 1 2 242.392 2.113 20 0 BEADLO Cc1ccccc1C[S@@](=O)Cc1c[nH+]cn1C ZINC000268153107 179291634 /nfs/dbraw/zinc/29/16/34/179291634.db2.gz LFYGCFXLGRSRSZ-QGZVFWFLSA-N 1 2 248.351 2.177 20 0 BEADLO Cc1nnc(C[N@@H+]2CCCc3sccc3C2)o1 ZINC000592982951 347841694 /nfs/dbraw/zinc/84/16/94/347841694.db2.gz LXUQZUKKFBPHRF-UHFFFAOYSA-N 1 2 249.339 2.388 20 0 BEADLO Cc1nnc(C[N@H+]2CCCc3sccc3C2)o1 ZINC000592982951 347841695 /nfs/dbraw/zinc/84/16/95/347841695.db2.gz LXUQZUKKFBPHRF-UHFFFAOYSA-N 1 2 249.339 2.388 20 0 BEADLO Cc1cc(NC(=O)[C@H](C)C2CC2)c(C)c[nH+]1 ZINC000535035525 323164229 /nfs/dbraw/zinc/16/42/29/323164229.db2.gz BNTBTWJCSBVIQR-SNVBAGLBSA-N 1 2 218.300 2.105 20 0 BEADLO COC(=O)[C@@H](c1ccsc1)[N@H+]1[C@H](C)C[C@@H]1C ZINC000532064176 323170668 /nfs/dbraw/zinc/17/06/68/323170668.db2.gz QYAWXCKLROMKNV-WCABBAIRSA-N 1 2 239.340 2.445 20 0 BEADLO COC(=O)[C@@H](c1ccsc1)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000532064176 323170669 /nfs/dbraw/zinc/17/06/69/323170669.db2.gz QYAWXCKLROMKNV-WCABBAIRSA-N 1 2 239.340 2.445 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1CC[C@@H](F)C1 ZINC000577411878 365949670 /nfs/dbraw/zinc/94/96/70/365949670.db2.gz LDXQDJKAPXSSBV-ZJUUUORDSA-N 1 2 209.268 2.396 20 0 BEADLO C[C@H](CNc1cccc[nH+]1)C(=O)OC(C)(C)C ZINC000594595075 348080031 /nfs/dbraw/zinc/08/00/31/348080031.db2.gz FGOXLUKZNMIXSP-SNVBAGLBSA-N 1 2 236.315 2.471 20 0 BEADLO Cc1ccccc1[C@H]([NH2+][C@@H]1CCOC1=O)C1CC1 ZINC000271976062 179345835 /nfs/dbraw/zinc/34/58/35/179345835.db2.gz DBBBMNYVYKANEO-ZIAGYGMSSA-N 1 2 245.322 2.351 20 0 BEADLO Cc1cccnc1CNc1nc[nH+]c(N)c1Cl ZINC000235801474 179384739 /nfs/dbraw/zinc/38/47/39/179384739.db2.gz RVAJQKVTFGUMAR-UHFFFAOYSA-N 1 2 249.705 2.028 20 0 BEADLO Cc1cccnc1CNc1[nH+]cnc(N)c1Cl ZINC000235801474 179384741 /nfs/dbraw/zinc/38/47/41/179384741.db2.gz RVAJQKVTFGUMAR-UHFFFAOYSA-N 1 2 249.705 2.028 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+][C@@H]1Cc2ccccc2[C@@H]1C ZINC000595706770 348319905 /nfs/dbraw/zinc/31/99/05/348319905.db2.gz KMQNZDDHXCJYAE-MISXGVKJSA-N 1 2 247.338 2.256 20 0 BEADLO Cc1cc(NCC(C)(C)O)nc(C(C)C)[nH+]1 ZINC000082686957 348343369 /nfs/dbraw/zinc/34/33/69/348343369.db2.gz YLSIXFDGHDDAAI-UHFFFAOYSA-N 1 2 223.320 2.091 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)[C@@H](C)C2CC2)[nH+]1 ZINC001639423360 1172104865 /nfs/dbraw/zinc/10/48/65/1172104865.db2.gz GWUQCXPOUVSBNW-VIFPVBQESA-N 1 2 235.331 2.195 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)[C@@H](C)C2CC2)c[nH+]1 ZINC001639423360 1172104870 /nfs/dbraw/zinc/10/48/70/1172104870.db2.gz GWUQCXPOUVSBNW-VIFPVBQESA-N 1 2 235.331 2.195 20 0 BEADLO COC(=O)[C@@H]([NH2+]C[C@@H]1CC12CC2)c1ccccc1 ZINC000419333217 192124954 /nfs/dbraw/zinc/12/49/54/192124954.db2.gz FEEFRUUPIXMAGV-STQMWFEESA-N 1 2 245.322 2.290 20 0 BEADLO Cc1cc(C)nc(N[C@@H]2C[C@@H](C)n3cc[nH+]c32)n1 ZINC000577459917 365957725 /nfs/dbraw/zinc/95/77/25/365957725.db2.gz POSQUXPROQCAGU-GHMZBOCLSA-N 1 2 243.314 2.408 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@@H]2CCC[C@H]2C)c1 ZINC000596115286 348442513 /nfs/dbraw/zinc/44/25/13/348442513.db2.gz UDPVGJWTZARHIS-ZYHUDNBSSA-N 1 2 248.326 2.398 20 0 BEADLO COC(=O)Cc1cc[nH+]c(NC[C@H]2CC2(C)C)c1 ZINC000596124637 348445637 /nfs/dbraw/zinc/44/56/37/348445637.db2.gz YHGHTSMHPBEXRX-LLVKDONJSA-N 1 2 248.326 2.255 20 0 BEADLO C[C@H](O)CCSCc1cn2ccccc2[nH+]1 ZINC000596343761 348500909 /nfs/dbraw/zinc/50/09/09/348500909.db2.gz KBRYMNAIBLEEBY-JTQLQIEISA-N 1 2 236.340 2.338 20 0 BEADLO C[S@](=O)[C@H]1CCC[C@H](Nc2cccc[nH+]2)C1 ZINC000596372863 348514380 /nfs/dbraw/zinc/51/43/80/348514380.db2.gz GUZDSWCDDZCWOO-MMPTUQATSA-N 1 2 238.356 2.183 20 0 BEADLO COc1cc[nH+]cc1CSCC[C@H](C)O ZINC000596363894 348525896 /nfs/dbraw/zinc/52/58/96/348525896.db2.gz LPJRPZJMEAFFJG-VIFPVBQESA-N 1 2 227.329 2.094 20 0 BEADLO CSC1(C[N@H+](C)Cc2noc(C)n2)CCC1 ZINC000597256632 348709886 /nfs/dbraw/zinc/70/98/86/348709886.db2.gz WQNFHMOMONLUGV-UHFFFAOYSA-N 1 2 241.360 2.096 20 0 BEADLO CSC1(C[N@@H+](C)Cc2noc(C)n2)CCC1 ZINC000597256632 348709888 /nfs/dbraw/zinc/70/98/88/348709888.db2.gz WQNFHMOMONLUGV-UHFFFAOYSA-N 1 2 241.360 2.096 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)CSC1CC1 ZINC000294581677 179707812 /nfs/dbraw/zinc/70/78/12/179707812.db2.gz KVXCGWUGJHSAKA-UHFFFAOYSA-N 1 2 222.313 2.224 20 0 BEADLO CCN(Cc1[nH+]ccn1C)c1cccc(OC)c1 ZINC000299574981 352540433 /nfs/dbraw/zinc/54/04/33/352540433.db2.gz HUZZHFUWWSXZQG-UHFFFAOYSA-N 1 2 245.326 2.455 20 0 BEADLO CC[C@H](C)CN(C)C(=O)CCCn1cc[nH+]c1 ZINC000599590484 349222131 /nfs/dbraw/zinc/22/21/31/349222131.db2.gz VJLLSORSZZQVBF-LBPRGKRZSA-N 1 2 237.347 2.168 20 0 BEADLO COC(=O)CCCC[N@@H+]1CCCC(F)(F)C1 ZINC000599451252 349198222 /nfs/dbraw/zinc/19/82/22/349198222.db2.gz UVTSKWAVIFFRKE-UHFFFAOYSA-N 1 2 235.274 2.061 20 0 BEADLO COC(=O)CCCC[N@H+]1CCCC(F)(F)C1 ZINC000599451252 349198224 /nfs/dbraw/zinc/19/82/24/349198224.db2.gz UVTSKWAVIFFRKE-UHFFFAOYSA-N 1 2 235.274 2.061 20 0 BEADLO Cc1cccc(OCc2c[nH+]cn2C)c1 ZINC000090233678 191001270 /nfs/dbraw/zinc/00/12/70/191001270.db2.gz MBYXQIVXZWBIHM-UHFFFAOYSA-N 1 2 202.257 2.308 20 0 BEADLO Cc1c[nH]cc1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000603882286 350047464 /nfs/dbraw/zinc/04/74/64/350047464.db2.gz ORYIAEBTFRYDKT-UHFFFAOYSA-N 1 2 240.266 2.223 20 0 BEADLO O=C(CCC1CC1)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000604326318 350103155 /nfs/dbraw/zinc/10/31/55/350103155.db2.gz QMNYTSDEHRYSHX-ZDUSSCGKSA-N 1 2 247.342 2.237 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2CCC(C)(C)C2)no1 ZINC000336455784 180033070 /nfs/dbraw/zinc/03/30/70/180033070.db2.gz SFGOZQKNBZDZIO-MRVPVSSYSA-N 1 2 209.293 2.171 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2CCC(C)(C)C2)no1 ZINC000336455784 180033072 /nfs/dbraw/zinc/03/30/72/180033072.db2.gz SFGOZQKNBZDZIO-MRVPVSSYSA-N 1 2 209.293 2.171 20 0 BEADLO Cc1nc(NCC2(C)CC2)c2c([nH+]1)CCCC2 ZINC000359722838 180067495 /nfs/dbraw/zinc/06/74/95/180067495.db2.gz BXNNCUDTVFUAAA-UHFFFAOYSA-N 1 2 231.343 2.298 20 0 BEADLO Cc1nc([C@@H](C)[NH2+]Cc2cc[nH]n2)c(C)s1 ZINC000041014828 180038188 /nfs/dbraw/zinc/03/81/88/180038188.db2.gz PQKXIVAQBNTUOU-SSDOTTSWSA-N 1 2 236.344 2.334 20 0 BEADLO Cc1nc(NCC(F)F)c2c([nH+]1)CCCC2 ZINC000272831512 180067579 /nfs/dbraw/zinc/06/75/79/180067579.db2.gz GXBWPXKYKMGIGY-UHFFFAOYSA-N 1 2 227.258 2.341 20 0 BEADLO Cc1nc([C@H](C)[NH2+]Cc2ccnn2C)cs1 ZINC000070904112 180051164 /nfs/dbraw/zinc/05/11/64/180051164.db2.gz CMWYAMOJJYNCTJ-QMMMGPOBSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1[nH]c2ccc(NC(=O)C(C)C)cc2[nH+]1 ZINC000065006360 180081310 /nfs/dbraw/zinc/08/13/10/180081310.db2.gz SRCMLEOJZUCDOI-UHFFFAOYSA-N 1 2 217.272 2.466 20 0 BEADLO Cc1nc(NC[C@H]2C[C@H]2C)c2c([nH+]1)CCCC2 ZINC000359716922 180068454 /nfs/dbraw/zinc/06/84/54/180068454.db2.gz NHJQSXXWKZKKOI-MWLCHTKSSA-N 1 2 231.343 2.154 20 0 BEADLO Cc1nc(NC(C)(C)[C@H](C)O)c2c([nH+]1)CCCC2 ZINC000272922559 180068468 /nfs/dbraw/zinc/06/84/68/180068468.db2.gz UBNVXRIARWZLDF-VIFPVBQESA-N 1 2 249.358 2.235 20 0 BEADLO Cc1nc(NC[C@H](O)C(C)C)c2c([nH+]1)CCCC2 ZINC000272849730 180070886 /nfs/dbraw/zinc/07/08/86/180070886.db2.gz KDNOCWQIIHUSRM-ZDUSSCGKSA-N 1 2 249.358 2.093 20 0 BEADLO Fc1cc(Cl)ccc1C[NH2+]Cc1cc[nH]n1 ZINC000133048019 191036937 /nfs/dbraw/zinc/03/69/37/191036937.db2.gz HNMATDMNLNIARZ-UHFFFAOYSA-N 1 2 239.681 2.492 20 0 BEADLO Cc1[nH+]c2ccccc2n1CC(=O)NCC(C)C ZINC000005627779 180104433 /nfs/dbraw/zinc/10/44/33/180104433.db2.gz BJWBNKWTDODPES-UHFFFAOYSA-N 1 2 245.326 2.117 20 0 BEADLO Cc1ccsc1CCNC(=O)c1c[nH+]c(C)[nH]1 ZINC000358677312 180130589 /nfs/dbraw/zinc/13/05/89/180130589.db2.gz KMPSKLSKDLFBME-UHFFFAOYSA-N 1 2 249.339 2.061 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H](C)CCC2CC2)c[nH+]1 ZINC000331413274 180132257 /nfs/dbraw/zinc/13/22/57/180132257.db2.gz BSMFAHNECGNZSZ-QMMMGPOBSA-N 1 2 221.304 2.027 20 0 BEADLO Cc1ncc(C[N@@H+](C(C)C)C2COC2)s1 ZINC000296067200 180137069 /nfs/dbraw/zinc/13/70/69/180137069.db2.gz PPFSYZRSGKCTFM-UHFFFAOYSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ncc(C[N@H+](C(C)C)C2COC2)s1 ZINC000296067200 180137072 /nfs/dbraw/zinc/13/70/72/180137072.db2.gz PPFSYZRSGKCTFM-UHFFFAOYSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)Nc1cccc(F)c1 ZINC000336606667 180118640 /nfs/dbraw/zinc/11/86/40/180118640.db2.gz DDHBMOURNVVKMT-UHFFFAOYSA-N 1 2 233.246 2.038 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N([C@H](C)C(C)C)C1CC1 ZINC000346292813 180120000 /nfs/dbraw/zinc/12/00/00/180120000.db2.gz XVAWWDQBFFLPNJ-LLVKDONJSA-N 1 2 249.358 2.296 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H](C)CC(C)(C)C ZINC000356741319 180120816 /nfs/dbraw/zinc/12/08/16/180120816.db2.gz RCWJFRJFTIGDDW-VIFPVBQESA-N 1 2 237.347 2.407 20 0 BEADLO Cc1nc(N2C[C@@H]3CCC[C@H]3C2)cc[nH+]1 ZINC000129088491 180194456 /nfs/dbraw/zinc/19/44/56/180194456.db2.gz KEKABRWHWKVDMK-QWRGUYRKSA-N 1 2 203.289 2.021 20 0 BEADLO Cc1nc(N2CCS[C@@H](C)CC2)cc[nH+]1 ZINC000191846768 180195203 /nfs/dbraw/zinc/19/52/03/180195203.db2.gz GXLNECRNASSAOT-VIFPVBQESA-N 1 2 223.345 2.117 20 0 BEADLO Cc1nc(N2CCSCC[C@@H]2C)cc[nH+]1 ZINC000189752680 180195214 /nfs/dbraw/zinc/19/52/14/180195214.db2.gz PYNCPIMCFHSKCT-VIFPVBQESA-N 1 2 223.345 2.117 20 0 BEADLO Cc1nc(NCC2([C@@H](C)CCO)CCC2)cc[nH+]1 ZINC000271756109 180199335 /nfs/dbraw/zinc/19/93/35/180199335.db2.gz CUBJVTZLJKBMTG-NSHDSACASA-N 1 2 249.358 2.386 20 0 BEADLO Cc1noc(C)c1CNc1cc[nH+]c(C)n1 ZINC000085485869 180199898 /nfs/dbraw/zinc/19/98/98/180199898.db2.gz HMMHMQRXYQXVDI-UHFFFAOYSA-N 1 2 218.260 2.002 20 0 BEADLO Cc1nc(NCc2ccc(Cl)cn2)cc[nH+]1 ZINC000309710537 180200467 /nfs/dbraw/zinc/20/04/67/180200467.db2.gz QMULBJLHAMSCEU-UHFFFAOYSA-N 1 2 234.690 2.446 20 0 BEADLO Cc1nc(NCc2ccc([C@@H](C)O)cc2)cc[nH+]1 ZINC000266457505 180200553 /nfs/dbraw/zinc/20/05/53/180200553.db2.gz YDELBEWNTBAMHC-SNVBAGLBSA-N 1 2 243.310 2.450 20 0 BEADLO Cc1nc(NC[C@@H]2CCO[C@@H](C)C2)cc[nH+]1 ZINC000271289123 180200883 /nfs/dbraw/zinc/20/08/83/180200883.db2.gz DQVIAQAFVXWGHI-GXSJLCMTSA-N 1 2 221.304 2.012 20 0 BEADLO Cc1nc(N[C@@H]2CCC[C@H]2OC(F)F)cc[nH+]1 ZINC000336919287 180203197 /nfs/dbraw/zinc/20/31/97/180203197.db2.gz PXCLJMGNZHPWTK-RKDXNWHRSA-N 1 2 243.257 2.357 20 0 BEADLO Cc1ncc(CNc2cc[nH+]c(C)n2)s1 ZINC000054936121 180203725 /nfs/dbraw/zinc/20/37/25/180203725.db2.gz RXBKRWUWWOEZFZ-UHFFFAOYSA-N 1 2 220.301 2.162 20 0 BEADLO Cc1nc(N[C@@H]2CCCc3nn(C)cc32)cc[nH+]1 ZINC000374587607 180203793 /nfs/dbraw/zinc/20/37/93/180203793.db2.gz XEQNCEDASQTBAT-LLVKDONJSA-N 1 2 243.314 2.008 20 0 BEADLO Cc1nc(NCCC2C[C@H](C)O[C@@H](C)C2)cc[nH+]1 ZINC000338485180 180179966 /nfs/dbraw/zinc/17/99/66/180179966.db2.gz QTDRDWCXHKAWBO-QWRGUYRKSA-N 1 2 249.358 2.213 20 0 BEADLO Cc1nc(NCCCc2cccc(F)c2)cc[nH+]1 ZINC000361041557 180181155 /nfs/dbraw/zinc/18/11/55/180181155.db2.gz XDXQOGDLVUMRPW-UHFFFAOYSA-N 1 2 245.301 2.391 20 0 BEADLO Cc1nc(NC[C@@H]2C[C@@H]2c2ccccc2)cc[nH+]1 ZINC000338769776 180181205 /nfs/dbraw/zinc/18/12/05/180181205.db2.gz LVLVRWSSPJMYRK-UONOGXRCSA-N 1 2 239.322 2.423 20 0 BEADLO Cc1nc(N[C@@H](C)CCC2CC2)cc[nH+]1 ZINC000336769491 180181701 /nfs/dbraw/zinc/18/17/01/180181701.db2.gz VOJZBBYGSUDCNB-VIFPVBQESA-N 1 2 205.305 2.198 20 0 BEADLO Cc1nc(NC[C@H]2CCCC2(F)F)cc[nH+]1 ZINC000336232742 180181985 /nfs/dbraw/zinc/18/19/85/180181985.db2.gz NZUCBHZDKCKSCP-SECBINFHSA-N 1 2 227.258 2.054 20 0 BEADLO Cc1[nH+]cccc1NCc1cccn1C ZINC000085726773 180225761 /nfs/dbraw/zinc/22/57/61/180225761.db2.gz CVHIDXMSBNDMEO-UHFFFAOYSA-N 1 2 201.273 2.341 20 0 BEADLO Cc1[nH+]cccc1NCc1cncs1 ZINC000085726807 180226561 /nfs/dbraw/zinc/22/65/61/180226561.db2.gz KLVHBIVDAXBNNJ-UHFFFAOYSA-N 1 2 205.286 2.459 20 0 BEADLO Cc1nc(NCCCn2cc[nH+]c2)sc1C ZINC000083532660 350237678 /nfs/dbraw/zinc/23/76/78/350237678.db2.gz MWCCDVKIYAMKIO-UHFFFAOYSA-N 1 2 236.344 2.459 20 0 BEADLO Cc1nc(NCc2[nH+]ccn2C)sc1C ZINC000083532920 350241094 /nfs/dbraw/zinc/24/10/94/350241094.db2.gz HJZRMDDTFTTWAA-UHFFFAOYSA-N 1 2 222.317 2.106 20 0 BEADLO CSCCc1[nH+]c2ccccc2n1C ZINC000223165076 350267657 /nfs/dbraw/zinc/26/76/57/350267657.db2.gz AVXGNGXZAMWVRF-UHFFFAOYSA-N 1 2 206.314 2.479 20 0 BEADLO Cc1ncsc1CCOc1cc[nH+]cc1 ZINC000292471364 180311308 /nfs/dbraw/zinc/31/13/08/180311308.db2.gz PUJKALALXIUAEU-UHFFFAOYSA-N 1 2 220.297 2.468 20 0 BEADLO CCCN(C)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606583049 350372973 /nfs/dbraw/zinc/37/29/73/350372973.db2.gz NOQUWPCVJKEHCR-UHFFFAOYSA-N 1 2 232.287 2.208 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@H](C)c2cnc(C)cn2)C[C@@H](C)O1 ZINC000428218437 191100749 /nfs/dbraw/zinc/10/07/49/191100749.db2.gz BMMVDYGKOGQTBJ-JHJVBQTASA-N 1 2 249.358 2.345 20 0 BEADLO CC[C@@H]1C[N@H+]([C@H](C)c2cnc(C)cn2)C[C@@H](C)O1 ZINC000428218437 191100752 /nfs/dbraw/zinc/10/07/52/191100752.db2.gz BMMVDYGKOGQTBJ-JHJVBQTASA-N 1 2 249.358 2.345 20 0 BEADLO Cc1ncsc1CNc1cc[nH+]cc1F ZINC000335701385 180318649 /nfs/dbraw/zinc/31/86/49/180318649.db2.gz ANLAGEJJJQZDQC-UHFFFAOYSA-N 1 2 223.276 2.020 20 0 BEADLO Cc1ncsc1C[NH2+][C@@H](C)c1ccon1 ZINC000336768682 180322752 /nfs/dbraw/zinc/32/27/52/180322752.db2.gz UVMYRHNXGZYAHC-ZETCQYMHSA-N 1 2 223.301 2.290 20 0 BEADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cc[nH]n2)o1 ZINC000041014024 350403479 /nfs/dbraw/zinc/40/34/79/350403479.db2.gz UKPUPEWLYHCFKX-SKDRFNHKSA-N 1 2 231.299 2.416 20 0 BEADLO CCC[C@@H](C)CC(=O)N[C@H]1CCn2cc[nH+]c2C1 ZINC000427989991 191104156 /nfs/dbraw/zinc/10/41/56/191104156.db2.gz CBESJTIGBAXDAJ-NEPJUHHUSA-N 1 2 249.358 2.140 20 0 BEADLO CCc1cnc(C[N@H+](C)[C@@H]2CCCOC2)s1 ZINC000336673306 350431566 /nfs/dbraw/zinc/43/15/66/350431566.db2.gz KOUWWCQLQKBUCK-SNVBAGLBSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1cnc(C[N@@H+](C)[C@@H]2CCCOC2)s1 ZINC000336673306 350431571 /nfs/dbraw/zinc/43/15/71/350431571.db2.gz KOUWWCQLQKBUCK-SNVBAGLBSA-N 1 2 240.372 2.316 20 0 BEADLO CC[N@H+](Cc1noc(C)n1)CC(C)(C)C ZINC000336698946 350452737 /nfs/dbraw/zinc/45/27/37/350452737.db2.gz OSPVNRXRSSKWHJ-UHFFFAOYSA-N 1 2 211.309 2.246 20 0 BEADLO CC[N@@H+](Cc1noc(C)n1)CC(C)(C)C ZINC000336698946 350452741 /nfs/dbraw/zinc/45/27/41/350452741.db2.gz OSPVNRXRSSKWHJ-UHFFFAOYSA-N 1 2 211.309 2.246 20 0 BEADLO Cc1nn(C)cc1[C@H](C)[NH2+]Cc1nccs1 ZINC000082432822 180383266 /nfs/dbraw/zinc/38/32/66/180383266.db2.gz IISVDRAMMYGUMK-QMMMGPOBSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cnc(C)o2)o1 ZINC000397940158 362962290 /nfs/dbraw/zinc/96/22/90/362962290.db2.gz ZNDUJGTUXCEIFE-UHFFFAOYSA-N 1 2 206.245 2.174 20 0 BEADLO CCCC[C@H](C)C(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000337540984 350593898 /nfs/dbraw/zinc/59/38/98/350593898.db2.gz YZXYETZVGUJTOG-QWRGUYRKSA-N 1 2 249.358 2.210 20 0 BEADLO CCCC[C@H](C)C(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000337540984 350593900 /nfs/dbraw/zinc/59/39/00/350593900.db2.gz YZXYETZVGUJTOG-QWRGUYRKSA-N 1 2 249.358 2.210 20 0 BEADLO CCCC[C@H](C)C(=O)N[C@@H]1CCn2cc[nH+]c2C1 ZINC000337589689 350598434 /nfs/dbraw/zinc/59/84/34/350598434.db2.gz HKFNQCYKHCSRFF-NWDGAFQWSA-N 1 2 249.358 2.140 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCO[C@@H](C)[C@H]1C ZINC000335307604 535145932 /nfs/dbraw/zinc/14/59/32/535145932.db2.gz VYSGKFPBKAXGRB-NEPJUHHUSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCO[C@@H](C)[C@H]1C ZINC000335307604 535145934 /nfs/dbraw/zinc/14/59/34/535145934.db2.gz VYSGKFPBKAXGRB-NEPJUHHUSA-N 1 2 237.347 2.073 20 0 BEADLO CC1(C)Cc2cccc(C[NH+]3CCOCC3)c2O1 ZINC000154501392 191115677 /nfs/dbraw/zinc/11/56/77/191115677.db2.gz QTTAQIVVNIKVRG-UHFFFAOYSA-N 1 2 247.338 2.232 20 0 BEADLO CC(C)=CC[N@@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000606905760 350627828 /nfs/dbraw/zinc/62/78/28/350627828.db2.gz ZZCSXMWTWPEUSZ-VIFPVBQESA-N 1 2 223.238 2.216 20 0 BEADLO CC(C)=CC[N@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000606905760 350627830 /nfs/dbraw/zinc/62/78/30/350627830.db2.gz ZZCSXMWTWPEUSZ-VIFPVBQESA-N 1 2 223.238 2.216 20 0 BEADLO Cc1ncc(C[NH2+][C@H](C)c2cscn2)o1 ZINC000397976024 362976246 /nfs/dbraw/zinc/97/62/46/362976246.db2.gz FTGHAJPCZSYOIJ-SSDOTTSWSA-N 1 2 223.301 2.290 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)c1ccccc1Cl ZINC000335715586 538098965 /nfs/dbraw/zinc/09/89/65/538098965.db2.gz AQKODCWTWRUPCI-UHFFFAOYSA-N 1 2 249.701 2.004 20 0 BEADLO CC[C@@H](O)C[N@@H+]1CCn2c(Cl)ccc2[C@H]1C ZINC000366383841 350759272 /nfs/dbraw/zinc/75/92/72/350759272.db2.gz HVOHQQRYIMCIIC-NXEZZACHSA-N 1 2 242.750 2.289 20 0 BEADLO CC[C@@H](O)C[N@H+]1CCn2c(Cl)ccc2[C@H]1C ZINC000366383841 350759277 /nfs/dbraw/zinc/75/92/77/350759277.db2.gz HVOHQQRYIMCIIC-NXEZZACHSA-N 1 2 242.750 2.289 20 0 BEADLO CC(C)C[NH+]=c1[nH]c2cccc(F)c2n1C ZINC000336685466 350938506 /nfs/dbraw/zinc/93/85/06/350938506.db2.gz UFPRNBVXCPRZGU-UHFFFAOYSA-N 1 2 221.279 2.202 20 0 BEADLO CC[N@H+](CCC(F)(F)F)Cc1nc(C)no1 ZINC000623121453 351053162 /nfs/dbraw/zinc/05/31/62/351053162.db2.gz XMHUYZQENCHSEG-UHFFFAOYSA-N 1 2 237.225 2.152 20 0 BEADLO CC[N@@H+](CCC(F)(F)F)Cc1nc(C)no1 ZINC000623121453 351053166 /nfs/dbraw/zinc/05/31/66/351053166.db2.gz XMHUYZQENCHSEG-UHFFFAOYSA-N 1 2 237.225 2.152 20 0 BEADLO Cc1oncc1C[N@@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000336511399 180554408 /nfs/dbraw/zinc/55/44/08/180554408.db2.gz POBSXGUXSFOTNO-CYBMUJFWSA-N 1 2 246.314 2.433 20 0 BEADLO Cc1oncc1C[N@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000336511399 180554409 /nfs/dbraw/zinc/55/44/09/180554409.db2.gz POBSXGUXSFOTNO-CYBMUJFWSA-N 1 2 246.314 2.433 20 0 BEADLO CC(C)[C@@H]1CCC[C@H]([NH2+]Cc2c[nH]nn2)C1 ZINC000398413602 351141544 /nfs/dbraw/zinc/14/15/44/351141544.db2.gz ROALTWSCYWFCSV-MNOVXSKESA-N 1 2 222.336 2.109 20 0 BEADLO CC(C)[C@@H]1CCC[C@H]([NH2+]Cc2cn[nH]n2)C1 ZINC000398413602 351141549 /nfs/dbraw/zinc/14/15/49/351141549.db2.gz ROALTWSCYWFCSV-MNOVXSKESA-N 1 2 222.336 2.109 20 0 BEADLO COc1ccc2c(c1)CN(Cc1[nH]cc(C)[nH+]1)C2 ZINC000628327756 351264615 /nfs/dbraw/zinc/26/46/15/351264615.db2.gz OLBCQNFWCBUMOL-UHFFFAOYSA-N 1 2 243.310 2.243 20 0 BEADLO Cc1[nH]c(CN2C[C@@H](C)OC3(CCC3)C2)[nH+]c1C ZINC000628322687 351211606 /nfs/dbraw/zinc/21/16/06/351211606.db2.gz INRQFAXPELMFAP-SNVBAGLBSA-N 1 2 249.358 2.170 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H](C)SC ZINC000265034020 351262079 /nfs/dbraw/zinc/26/20/79/351262079.db2.gz UOOGERHNDITUDQ-MRVPVSSYSA-N 1 2 224.329 2.334 20 0 BEADLO Cc1[nH]c(CN2CC[C@@H](C)O[C@@H](C)C2)[nH+]c1C ZINC000628342679 351289059 /nfs/dbraw/zinc/28/90/59/351289059.db2.gz NYJYDMZMVBHQST-ZJUUUORDSA-N 1 2 237.347 2.026 20 0 BEADLO CC[C@H](CC(=O)NCc1[nH]cc[nH+]1)C(C)(C)C ZINC000631240095 351292319 /nfs/dbraw/zinc/29/23/19/351292319.db2.gz ZZYMSMVFLASQFS-SNVBAGLBSA-N 1 2 237.347 2.488 20 0 BEADLO CC[C@@H](CC(=O)NCc1[nH]cc[nH+]1)C(C)(C)C ZINC000631240094 351292351 /nfs/dbraw/zinc/29/23/51/351292351.db2.gz ZZYMSMVFLASQFS-JTQLQIEISA-N 1 2 237.347 2.488 20 0 BEADLO Cc1nc(C[NH+]2CC(CC3CC3)C2)[nH]c1C ZINC000628361682 351334284 /nfs/dbraw/zinc/33/42/84/351334284.db2.gz PHNRAGQVCCIVRN-UHFFFAOYSA-N 1 2 219.332 2.258 20 0 BEADLO Cc1[nH]c(CN2CC(CC3CC3)C2)[nH+]c1C ZINC000628361682 351334285 /nfs/dbraw/zinc/33/42/85/351334285.db2.gz PHNRAGQVCCIVRN-UHFFFAOYSA-N 1 2 219.332 2.258 20 0 BEADLO Cn1cc[nH+]c1CNc1cc(F)ccc1F ZINC000036804565 358462186 /nfs/dbraw/zinc/46/21/86/358462186.db2.gz KGZIBPUPIRVAKX-UHFFFAOYSA-N 1 2 223.226 2.310 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@]1(C)CCCO1 ZINC000268063877 351327289 /nfs/dbraw/zinc/32/72/89/351327289.db2.gz YZLDNESYIOABHH-CYBMUJFWSA-N 1 2 234.299 2.152 20 0 BEADLO CC1(C)C[C@H]1C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000269744763 351366873 /nfs/dbraw/zinc/36/68/73/351366873.db2.gz MXLVKWAZMYBVJZ-MNOVXSKESA-N 1 2 247.342 2.162 20 0 BEADLO Cc1cnc(C[NH2+]Cc2ccns2)s1 ZINC000404457841 351459866 /nfs/dbraw/zinc/45/98/66/351459866.db2.gz LMVGHFIQXQNBBR-UHFFFAOYSA-N 1 2 225.342 2.198 20 0 BEADLO CC1(C)CCC[C@H](NC(=O)CCn2cc[nH+]c2)C1 ZINC000275976019 351607516 /nfs/dbraw/zinc/60/75/16/351607516.db2.gz KNBPUYZJPBEFIW-LBPRGKRZSA-N 1 2 249.358 2.358 20 0 BEADLO CN(C)c1ccc(NCc2cccnc2)c[nH+]1 ZINC000036988862 358465538 /nfs/dbraw/zinc/46/55/38/358465538.db2.gz SOYSFRHIAGACFZ-UHFFFAOYSA-N 1 2 228.299 2.155 20 0 BEADLO Nc1ccc(NC(=O)[C@@H]2CCCC23CC3)c[nH+]1 ZINC000637828835 351677344 /nfs/dbraw/zinc/67/73/44/351677344.db2.gz HPCBKRGOJBKEKL-JTQLQIEISA-N 1 2 231.299 2.013 20 0 BEADLO CC(C)CN(C)c1cc(N2CCCC2)nc[nH+]1 ZINC000277448144 351706601 /nfs/dbraw/zinc/70/66/01/351706601.db2.gz NEFLYNKVNILCTG-UHFFFAOYSA-N 1 2 234.347 2.169 20 0 BEADLO CC(C)CN(C)c1cc(N2CCCC2)[nH+]cn1 ZINC000277448144 351706607 /nfs/dbraw/zinc/70/66/07/351706607.db2.gz NEFLYNKVNILCTG-UHFFFAOYSA-N 1 2 234.347 2.169 20 0 BEADLO COc1ncc(C[N@H+](C)Cc2ccco2)s1 ZINC000637859725 351721471 /nfs/dbraw/zinc/72/14/71/351721471.db2.gz GMVJAYHGWUQGFK-UHFFFAOYSA-N 1 2 238.312 2.377 20 0 BEADLO COc1ncc(C[N@@H+](C)Cc2ccco2)s1 ZINC000637859725 351721473 /nfs/dbraw/zinc/72/14/73/351721473.db2.gz GMVJAYHGWUQGFK-UHFFFAOYSA-N 1 2 238.312 2.377 20 0 BEADLO Cc1nc2[nH]ccc2c(NCCC2(F)CCC2)[nH+]1 ZINC000577793785 366062578 /nfs/dbraw/zinc/06/25/78/366062578.db2.gz XSMXXLFKYIFJMX-UHFFFAOYSA-N 1 2 248.305 2.382 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cnn(C)c2)c(F)c1 ZINC000637870944 351737489 /nfs/dbraw/zinc/73/74/89/351737489.db2.gz GVVAUYALOQBFLI-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cnn(C)c2)c(F)c1 ZINC000637870944 351737490 /nfs/dbraw/zinc/73/74/90/351737490.db2.gz GVVAUYALOQBFLI-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO CC1(C)C[N@H+](Cc2cocn2)CCS1 ZINC000278000792 351741464 /nfs/dbraw/zinc/74/14/64/351741464.db2.gz LKQUXZRNVOOZMI-UHFFFAOYSA-N 1 2 212.318 2.002 20 0 BEADLO CC1(C)C[N@@H+](Cc2cocn2)CCS1 ZINC000278000792 351741467 /nfs/dbraw/zinc/74/14/67/351741467.db2.gz LKQUXZRNVOOZMI-UHFFFAOYSA-N 1 2 212.318 2.002 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1ccns1 ZINC000637851610 351710200 /nfs/dbraw/zinc/71/02/00/351710200.db2.gz JHYTUQUFSMJJSZ-UWVGGRQHSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1ccns1 ZINC000637851610 351710203 /nfs/dbraw/zinc/71/02/03/351710203.db2.gz JHYTUQUFSMJJSZ-UWVGGRQHSA-N 1 2 226.345 2.142 20 0 BEADLO C[N@H+](Cc1noc(C2CC2)n1)C(C)(C)C ZINC000577815311 366069347 /nfs/dbraw/zinc/06/93/47/366069347.db2.gz PCHZXWPFFJHNKO-UHFFFAOYSA-N 1 2 209.293 2.177 20 0 BEADLO C[N@@H+](Cc1noc(C2CC2)n1)C(C)(C)C ZINC000577815311 366069357 /nfs/dbraw/zinc/06/93/57/366069357.db2.gz PCHZXWPFFJHNKO-UHFFFAOYSA-N 1 2 209.293 2.177 20 0 BEADLO C[C@H]1CCC[C@@H](C(=O)N2CC(n3cc[nH+]c3)C2)C1 ZINC000607651303 351826946 /nfs/dbraw/zinc/82/69/46/351826946.db2.gz PEKHUNVKGNHMLG-NWDGAFQWSA-N 1 2 247.342 2.093 20 0 BEADLO Cc1nc(NC[C@H]2CC2(Cl)Cl)cc[nH+]1 ZINC000307288451 351854549 /nfs/dbraw/zinc/85/45/49/351854549.db2.gz WZPUIDZCWYQAJH-SSDOTTSWSA-N 1 2 232.114 2.391 20 0 BEADLO CC[C@@H](C)[C@H](C[N@H+](C)CC(F)F)OC ZINC000637974487 351850151 /nfs/dbraw/zinc/85/01/51/351850151.db2.gz UZGXYTRIWBWYFS-BDAKNGLRSA-N 1 2 209.280 2.244 20 0 BEADLO CC[C@@H](C)[C@H](C[N@@H+](C)CC(F)F)OC ZINC000637974487 351850153 /nfs/dbraw/zinc/85/01/53/351850153.db2.gz UZGXYTRIWBWYFS-BDAKNGLRSA-N 1 2 209.280 2.244 20 0 BEADLO CC[N@H+](Cc1ncnn1-c1ccccc1)C1CC1 ZINC000281888467 351914066 /nfs/dbraw/zinc/91/40/66/351914066.db2.gz DOVIRCRHUBCTQR-UHFFFAOYSA-N 1 2 242.326 2.252 20 0 BEADLO CC[N@@H+](Cc1ncnn1-c1ccccc1)C1CC1 ZINC000281888467 351914073 /nfs/dbraw/zinc/91/40/73/351914073.db2.gz DOVIRCRHUBCTQR-UHFFFAOYSA-N 1 2 242.326 2.252 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2cc(C)ns2)CCO1 ZINC000638096950 351976834 /nfs/dbraw/zinc/97/68/34/351976834.db2.gz UOMCMFWALPMWRJ-LLVKDONJSA-N 1 2 240.372 2.452 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2cc(C)ns2)CCO1 ZINC000638096950 351976836 /nfs/dbraw/zinc/97/68/36/351976836.db2.gz UOMCMFWALPMWRJ-LLVKDONJSA-N 1 2 240.372 2.452 20 0 BEADLO CCC[N@@H+](CC1=CCCOC1)CC(F)F ZINC000092737556 352143072 /nfs/dbraw/zinc/14/30/72/352143072.db2.gz OLESPTSOGZMNCO-UHFFFAOYSA-N 1 2 219.275 2.310 20 0 BEADLO CCC[N@H+](CC1=CCCOC1)CC(F)F ZINC000092737556 352143074 /nfs/dbraw/zinc/14/30/74/352143074.db2.gz OLESPTSOGZMNCO-UHFFFAOYSA-N 1 2 219.275 2.310 20 0 BEADLO COc1cccc(C)c1C[NH2+]Cc1cc[nH]n1 ZINC000638329799 352149874 /nfs/dbraw/zinc/14/98/74/352149874.db2.gz RNODSHRLVJQNRP-UHFFFAOYSA-N 1 2 231.299 2.017 20 0 BEADLO Cc1nnc([C@H](C)[N@H+](C)Cc2cccs2)[nH]1 ZINC000411149902 191164167 /nfs/dbraw/zinc/16/41/67/191164167.db2.gz UBGRDSRWMIRECG-QMMMGPOBSA-N 1 2 236.344 2.368 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+](C)Cc2cccs2)[nH]1 ZINC000411149902 191164168 /nfs/dbraw/zinc/16/41/68/191164168.db2.gz UBGRDSRWMIRECG-QMMMGPOBSA-N 1 2 236.344 2.368 20 0 BEADLO CCc1nnc(C[NH+]2CCC(C)(F)CC2)s1 ZINC000630073039 363156291 /nfs/dbraw/zinc/15/62/91/363156291.db2.gz PMELBFYUSWFNHF-UHFFFAOYSA-N 1 2 243.351 2.425 20 0 BEADLO CCc1nc(CNc2ccc(CO)c[nH+]2)cs1 ZINC000291711565 352287023 /nfs/dbraw/zinc/28/70/23/352287023.db2.gz ZWHUIZKKEUWEEE-UHFFFAOYSA-N 1 2 249.339 2.205 20 0 BEADLO CCCC[C@@H](C)N(C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000292050424 352299869 /nfs/dbraw/zinc/29/98/69/352299869.db2.gz SNNNHVIEJYIRHW-WSKFYRRCSA-N 1 2 235.331 2.460 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000294371467 352376595 /nfs/dbraw/zinc/37/65/95/352376595.db2.gz GUTHRILTEKPLHG-JHJVBQTASA-N 1 2 249.358 2.214 20 0 BEADLO CCCC[C@@H](C)C(=O)NCc1[nH+]ccn1CC ZINC000295507354 352415842 /nfs/dbraw/zinc/41/58/42/352415842.db2.gz HBVZLHPDHUQQHY-LLVKDONJSA-N 1 2 237.347 2.346 20 0 BEADLO CCC[N@H+](C[C@H](F)CC)[C@H](C)C(=O)OCC ZINC000411653210 191201304 /nfs/dbraw/zinc/20/13/04/191201304.db2.gz WHWYHYDBVUVMDQ-GHMZBOCLSA-N 1 2 233.327 2.398 20 0 BEADLO CCC[N@@H+](C[C@H](F)CC)[C@H](C)C(=O)OCC ZINC000411653210 191201307 /nfs/dbraw/zinc/20/13/07/191201307.db2.gz WHWYHYDBVUVMDQ-GHMZBOCLSA-N 1 2 233.327 2.398 20 0 BEADLO CC(C)=C[C@H]1[C@H](C(=O)NCc2c[nH+]c[nH]2)C1(C)C ZINC000607948772 352454629 /nfs/dbraw/zinc/45/46/29/352454629.db2.gz SFEPOBZCACEQSG-NWDGAFQWSA-N 1 2 247.342 2.264 20 0 BEADLO CC(C)=C[C@H]1[C@H](C(=O)NCc2c[nH]c[nH+]2)C1(C)C ZINC000607948772 352454634 /nfs/dbraw/zinc/45/46/34/352454634.db2.gz SFEPOBZCACEQSG-NWDGAFQWSA-N 1 2 247.342 2.264 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H](C)c1cccc(C)c1 ZINC000037303157 358471929 /nfs/dbraw/zinc/47/19/29/358471929.db2.gz HXQWGGDBTSBVOT-QWRGUYRKSA-N 1 2 221.300 2.207 20 0 BEADLO CC[C@@H](NC(=O)[C@H]1[C@@H]2CCCC[C@@H]21)c1[nH]cc[nH+]1 ZINC000252982434 538104028 /nfs/dbraw/zinc/10/40/28/538104028.db2.gz WIOXDMLKHUNPRI-KXNHARMFSA-N 1 2 247.342 2.413 20 0 BEADLO C[C@H]1CCC[C@H](CCNC(=O)Cn2cc[nH+]c2)C1 ZINC000073732224 352672591 /nfs/dbraw/zinc/67/25/91/352672591.db2.gz GWGASHRHXMIQBK-QWHCGFSZSA-N 1 2 249.358 2.216 20 0 BEADLO CCOC1CCN(c2[nH+]cccc2OC)CC1 ZINC000623882763 352701311 /nfs/dbraw/zinc/70/13/11/352701311.db2.gz IHGGFBVXEJPGJE-UHFFFAOYSA-N 1 2 236.315 2.096 20 0 BEADLO Cc1cc(C[NH2+][C@@H]2CCCc3cn[nH]c32)sn1 ZINC000638768946 352710501 /nfs/dbraw/zinc/71/05/01/352710501.db2.gz HPTOZSACTIFDSH-LLVKDONJSA-N 1 2 248.355 2.342 20 0 BEADLO CC[N@H+](Cc1cn(C)nn1)Cc1ccccc1C ZINC000341611930 352714596 /nfs/dbraw/zinc/71/45/96/352714596.db2.gz HETJEPZQVIDTBC-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CC[N@@H+](Cc1cn(C)nn1)Cc1ccccc1C ZINC000341611930 352714600 /nfs/dbraw/zinc/71/46/00/352714600.db2.gz HETJEPZQVIDTBC-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CC[N@H+](Cc1cn(C)nn1)Cc1ccc(C)cc1 ZINC000341604902 352714692 /nfs/dbraw/zinc/71/46/92/352714692.db2.gz ACCKKSVFDLIROP-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CC[N@@H+](Cc1cn(C)nn1)Cc1ccc(C)cc1 ZINC000341604902 352714694 /nfs/dbraw/zinc/71/46/94/352714694.db2.gz ACCKKSVFDLIROP-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO Cc1c[nH+]cc(N[C@@H](C)C[C@H]2CCCC(=O)N2)c1 ZINC000638787527 352743565 /nfs/dbraw/zinc/74/35/65/352743565.db2.gz KIOAQOJAUKQZPL-NWDGAFQWSA-N 1 2 247.342 2.249 20 0 BEADLO CCC1(CC)CN(c2cc(C)[nH+]cn2)C1 ZINC000334179873 352766878 /nfs/dbraw/zinc/76/68/78/352766878.db2.gz DODIIICXBYBABL-UHFFFAOYSA-N 1 2 205.305 2.411 20 0 BEADLO Cc1ccc(C[N@@H+]2CCOCC23CC3)c(C)n1 ZINC000334188511 352778361 /nfs/dbraw/zinc/77/83/61/352778361.db2.gz HMWLLNFKLMNCBD-UHFFFAOYSA-N 1 2 232.327 2.063 20 0 BEADLO Cc1ccc(C[N@H+]2CCOCC23CC3)c(C)n1 ZINC000334188511 352778362 /nfs/dbraw/zinc/77/83/62/352778362.db2.gz HMWLLNFKLMNCBD-UHFFFAOYSA-N 1 2 232.327 2.063 20 0 BEADLO Cn1c[nH+]cc1CN1CCc2c1c(F)ccc2F ZINC000334204824 352799539 /nfs/dbraw/zinc/79/95/39/352799539.db2.gz STCOXGJFZHPOPX-UHFFFAOYSA-N 1 2 249.264 2.261 20 0 BEADLO Cc1nocc1C[N@@H+]1C[C@@]2(CCCO2)[C@H]1C1CC1 ZINC000334205430 352799998 /nfs/dbraw/zinc/79/99/98/352799998.db2.gz XTVNYGAYCDBRII-KGLIPLIRSA-N 1 2 248.326 2.126 20 0 BEADLO Cc1nocc1C[N@H+]1C[C@@]2(CCCO2)[C@H]1C1CC1 ZINC000334205430 352800002 /nfs/dbraw/zinc/80/00/02/352800002.db2.gz XTVNYGAYCDBRII-KGLIPLIRSA-N 1 2 248.326 2.126 20 0 BEADLO c1nnsc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000334210265 352807457 /nfs/dbraw/zinc/80/74/57/352807457.db2.gz NVKCNHIRIMLRGN-LBPRGKRZSA-N 1 2 231.324 2.485 20 0 BEADLO c1nnsc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000334210265 352807460 /nfs/dbraw/zinc/80/74/60/352807460.db2.gz NVKCNHIRIMLRGN-LBPRGKRZSA-N 1 2 231.324 2.485 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)n1C ZINC000342809813 352861193 /nfs/dbraw/zinc/86/11/93/352861193.db2.gz UNWBKUUWTYHBPD-ZDUSSCGKSA-N 1 2 244.342 2.394 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)n1C ZINC000342809813 352861195 /nfs/dbraw/zinc/86/11/95/352861195.db2.gz UNWBKUUWTYHBPD-ZDUSSCGKSA-N 1 2 244.342 2.394 20 0 BEADLO Cc1c[nH+]c(CN2CCC[C@H]2c2ccc[nH]2)n1C ZINC000342809813 352861197 /nfs/dbraw/zinc/86/11/97/352861197.db2.gz UNWBKUUWTYHBPD-ZDUSSCGKSA-N 1 2 244.342 2.394 20 0 BEADLO Cc1c[nH+]c(CN(C)Cc2cccc(C)n2)n1C ZINC000342810517 352862507 /nfs/dbraw/zinc/86/25/07/352862507.db2.gz WSENVIYEMSYIBN-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cc(C(=O)NCc2c[nH+]c[nH]2)cc(C)c1F ZINC000334243984 352833007 /nfs/dbraw/zinc/83/30/07/352833007.db2.gz ZADJTDKTOPTFJS-UHFFFAOYSA-N 1 2 247.273 2.096 20 0 BEADLO Cc1cc(C(=O)NCc2c[nH]c[nH+]2)cc(C)c1F ZINC000334243984 352833008 /nfs/dbraw/zinc/83/30/08/352833008.db2.gz ZADJTDKTOPTFJS-UHFFFAOYSA-N 1 2 247.273 2.096 20 0 BEADLO CC(C)c1noc(C[N@@H+]2C[C@@H](C)[C@@H]2C)n1 ZINC000334229064 352845936 /nfs/dbraw/zinc/84/59/36/352845936.db2.gz HSDKLHJDBJWYHC-BDAKNGLRSA-N 1 2 209.293 2.033 20 0 BEADLO CC(C)c1noc(C[N@H+]2C[C@@H](C)[C@@H]2C)n1 ZINC000334229064 352845941 /nfs/dbraw/zinc/84/59/41/352845941.db2.gz HSDKLHJDBJWYHC-BDAKNGLRSA-N 1 2 209.293 2.033 20 0 BEADLO NC(=O)[C@@H]1CCC[N@@H+]1Cc1ccc(Cl)o1 ZINC000334281682 352922797 /nfs/dbraw/zinc/92/27/97/352922797.db2.gz XNCPGJJYUBDALE-QMMMGPOBSA-N 1 2 228.679 2.433 20 0 BEADLO NC(=O)[C@@H]1CCC[N@H+]1Cc1ccc(Cl)o1 ZINC000334281682 352922799 /nfs/dbraw/zinc/92/27/99/352922799.db2.gz XNCPGJJYUBDALE-QMMMGPOBSA-N 1 2 228.679 2.433 20 0 BEADLO Cc1c[nH+]c(CN2CCCC[C@@H]2C(F)F)n1C ZINC000342861516 352879387 /nfs/dbraw/zinc/87/93/87/352879387.db2.gz QXCPHRUVVAVGDC-SNVBAGLBSA-N 1 2 243.301 2.348 20 0 BEADLO Cc1ccc(C[N@@H+]2CC[S@@](=O)[C@@H](C)C2)s1 ZINC000334263438 352897509 /nfs/dbraw/zinc/89/75/09/352897509.db2.gz WGDRGZLJTHZMCH-ZUZCIYMTSA-N 1 2 243.397 2.009 20 0 BEADLO Cc1ccc(C[N@H+]2CC[S@@](=O)[C@@H](C)C2)s1 ZINC000334263438 352897512 /nfs/dbraw/zinc/89/75/12/352897512.db2.gz WGDRGZLJTHZMCH-ZUZCIYMTSA-N 1 2 243.397 2.009 20 0 BEADLO CC[C@H]1C[N@H+](Cc2nc(C)sc2C)CCO1 ZINC000334311367 352942480 /nfs/dbraw/zinc/94/24/80/352942480.db2.gz RFIFCJBCOWLQAE-NSHDSACASA-N 1 2 240.372 2.371 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2nc(C)sc2C)CCO1 ZINC000334311367 352942485 /nfs/dbraw/zinc/94/24/85/352942485.db2.gz RFIFCJBCOWLQAE-NSHDSACASA-N 1 2 240.372 2.371 20 0 BEADLO Cn1cc[nH+]c1[C@@H](C1CC1)N1CCC(F)(F)C1 ZINC000638842662 353019278 /nfs/dbraw/zinc/01/92/78/353019278.db2.gz XSKQMROQMMMWNV-SNVBAGLBSA-N 1 2 241.285 2.212 20 0 BEADLO CCOC1CC(CNc2[nH+]cccc2OC)C1 ZINC000638822872 353004369 /nfs/dbraw/zinc/00/43/69/353004369.db2.gz HJUHWBYLLSFATA-UHFFFAOYSA-N 1 2 236.315 2.317 20 0 BEADLO COC[C@@H](Nc1cc(C)[nH+]c(C2CC2)n1)C(C)C ZINC000608088080 353062985 /nfs/dbraw/zinc/06/29/85/353062985.db2.gz BPFKYTQFBIOASC-GFCCVEGCSA-N 1 2 249.358 2.167 20 0 BEADLO CSc1cc(C[NH2+]Cc2ncc(C)o2)ccn1 ZINC000638902373 353063769 /nfs/dbraw/zinc/06/37/69/353063769.db2.gz NYRJZMUTEZIDGP-UHFFFAOYSA-N 1 2 249.339 2.390 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2ccns2)C[C@H]1F ZINC000638910915 353075457 /nfs/dbraw/zinc/07/54/57/353075457.db2.gz WCECPHQDAVVUAV-PSASIEDQSA-N 1 2 214.309 2.323 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2ccns2)C[C@H]1F ZINC000638910915 353075459 /nfs/dbraw/zinc/07/54/59/353075459.db2.gz WCECPHQDAVVUAV-PSASIEDQSA-N 1 2 214.309 2.323 20 0 BEADLO CC(C)[C@H](NCc1[nH+]ccn1C)C(F)(F)F ZINC000336756908 188000772 /nfs/dbraw/zinc/00/07/72/188000772.db2.gz YSCIIWOCAACOCG-VIFPVBQESA-N 1 2 235.253 2.097 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1ccnn1C ZINC000092935929 538107985 /nfs/dbraw/zinc/10/79/85/538107985.db2.gz IPSOTQYBTKLKHV-UHFFFAOYSA-N 1 2 219.288 2.035 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1ccnn1C ZINC000092935929 538107986 /nfs/dbraw/zinc/10/79/86/538107986.db2.gz IPSOTQYBTKLKHV-UHFFFAOYSA-N 1 2 219.288 2.035 20 0 BEADLO Cc1cc(N[C@H]2CSC[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000334408198 353089815 /nfs/dbraw/zinc/08/98/15/353089815.db2.gz HVOKWKSQEZVOPS-KWQFWETISA-N 1 2 249.383 2.248 20 0 BEADLO Cc1ncc(C[N@@H+]2CCO[C@@H](C(C)C)C2)s1 ZINC000334418843 353102846 /nfs/dbraw/zinc/10/28/46/353102846.db2.gz RYMPAXGIRBWPJE-GFCCVEGCSA-N 1 2 240.372 2.308 20 0 BEADLO Cc1ncc(C[N@H+]2CCO[C@@H](C(C)C)C2)s1 ZINC000334418843 353102848 /nfs/dbraw/zinc/10/28/48/353102848.db2.gz RYMPAXGIRBWPJE-GFCCVEGCSA-N 1 2 240.372 2.308 20 0 BEADLO Cc1ccc(Cc2noc([C@H]3CCCO3)n2)c[nH+]1 ZINC000273863435 188027479 /nfs/dbraw/zinc/02/74/79/188027479.db2.gz DWVWGINUKSLQTR-LLVKDONJSA-N 1 2 245.282 2.215 20 0 BEADLO CC[C@@]1(C)C[N@H+](Cc2ccc(F)cn2)CCO1 ZINC000276174106 188029239 /nfs/dbraw/zinc/02/92/39/188029239.db2.gz FVACSXKTUJADQT-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO CC[C@@]1(C)C[N@@H+](Cc2ccc(F)cn2)CCO1 ZINC000276174106 188029241 /nfs/dbraw/zinc/02/92/41/188029241.db2.gz FVACSXKTUJADQT-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO CC(C)C(=O)Nc1ccc2[nH]c(N(C)C)[nH+]c2c1 ZINC000278545512 188030464 /nfs/dbraw/zinc/03/04/64/188030464.db2.gz GITUCLWUYIGYTK-UHFFFAOYSA-N 1 2 246.314 2.223 20 0 BEADLO C=Cn1cc(C[N@@H+]2CCO[C@H](C(C)(C)C)C2)cn1 ZINC000280411953 188031658 /nfs/dbraw/zinc/03/16/58/188031658.db2.gz IAELWLKFZAMIEG-ZDUSSCGKSA-N 1 2 249.358 2.231 20 0 BEADLO C=Cn1cc(C[N@H+]2CCO[C@H](C(C)(C)C)C2)cn1 ZINC000280411953 188031660 /nfs/dbraw/zinc/03/16/60/188031660.db2.gz IAELWLKFZAMIEG-ZDUSSCGKSA-N 1 2 249.358 2.231 20 0 BEADLO CC(C)[N@H+](Cc1ccccc1F)C1COC1 ZINC000296005114 188039258 /nfs/dbraw/zinc/03/92/58/188039258.db2.gz LDBLPRQXGXGWRH-UHFFFAOYSA-N 1 2 223.291 2.435 20 0 BEADLO CC(C)[N@@H+](Cc1ccccc1F)C1COC1 ZINC000296005114 188039260 /nfs/dbraw/zinc/03/92/60/188039260.db2.gz LDBLPRQXGXGWRH-UHFFFAOYSA-N 1 2 223.291 2.435 20 0 BEADLO COc1nccc(C[N@H+](C)Cc2occc2C)n1 ZINC000295960895 188039288 /nfs/dbraw/zinc/03/92/88/188039288.db2.gz HVCWFXKAWZZKEO-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1nccc(C[N@@H+](C)Cc2occc2C)n1 ZINC000295960895 188039289 /nfs/dbraw/zinc/03/92/89/188039289.db2.gz HVCWFXKAWZZKEO-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO CC(C)=CC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000299470383 188041559 /nfs/dbraw/zinc/04/15/59/188041559.db2.gz XDEOWSJPFHCMFR-NSHDSACASA-N 1 2 233.315 2.430 20 0 BEADLO CN(C(=O)CCn1cc[nH+]c1)C1CCCCCC1 ZINC000299592344 188042488 /nfs/dbraw/zinc/04/24/88/188042488.db2.gz LHTFFAZPCXKMAP-UHFFFAOYSA-N 1 2 249.358 2.454 20 0 BEADLO Cc1nc(N(C)Cc2ccccc2)cc[nH+]1 ZINC000336597970 188058180 /nfs/dbraw/zinc/05/81/80/188058180.db2.gz KXNKVLPAZWGLSC-UHFFFAOYSA-N 1 2 213.284 2.421 20 0 BEADLO CC(C)[C@H](C)C(=O)N[C@@H](c1[nH+]ccn1C)C1CC1 ZINC000341717015 188045169 /nfs/dbraw/zinc/04/51/69/188045169.db2.gz IBMLUYOSRKKPQS-CMPLNLGQSA-N 1 2 249.358 2.280 20 0 BEADLO CCN(C(=O)CCc1c[nH+]c[nH]1)C1CCCC1 ZINC000276466594 538110235 /nfs/dbraw/zinc/11/02/35/538110235.db2.gz POXXMUDMSKLOIV-UHFFFAOYSA-N 1 2 235.331 2.133 20 0 BEADLO CCN(C(=O)CCc1c[nH]c[nH+]1)C1CCCC1 ZINC000276466594 538110236 /nfs/dbraw/zinc/11/02/36/538110236.db2.gz POXXMUDMSKLOIV-UHFFFAOYSA-N 1 2 235.331 2.133 20 0 BEADLO CC[C@@H](NC(=O)[C@@H](CC)SC)c1[nH]cc[nH+]1 ZINC000331031913 353216990 /nfs/dbraw/zinc/21/69/90/353216990.db2.gz GYAXHJJXRBTMTJ-RKDXNWHRSA-N 1 2 241.360 2.119 20 0 BEADLO CCOc1cccc(C[NH2+]Cc2csnn2)c1 ZINC000037679540 358476410 /nfs/dbraw/zinc/47/64/10/358476410.db2.gz BONCLTUNDCCUQZ-UHFFFAOYSA-N 1 2 249.339 2.227 20 0 BEADLO CCc1cc(NCC2(CCOC)CC2)nc[nH+]1 ZINC000225373866 538112520 /nfs/dbraw/zinc/11/25/20/538112520.db2.gz UNNZVXDHKRKWHX-UHFFFAOYSA-N 1 2 235.331 2.268 20 0 BEADLO FC1(F)CC[N@H+](CCCO[C@@H]2CCCCO2)C1 ZINC000338293899 180917575 /nfs/dbraw/zinc/91/75/75/180917575.db2.gz CCRHHUASYAGORQ-LLVKDONJSA-N 1 2 249.301 2.261 20 0 BEADLO FC1(F)CC[N@@H+](CCCO[C@@H]2CCCCO2)C1 ZINC000338293899 180917577 /nfs/dbraw/zinc/91/75/77/180917577.db2.gz CCRHHUASYAGORQ-LLVKDONJSA-N 1 2 249.301 2.261 20 0 BEADLO CCCCOCC[NH2+][C@H](C)c1cn[nH]c1C ZINC000134554651 538113163 /nfs/dbraw/zinc/11/31/63/538113163.db2.gz YJZXKGKZNDZCHU-SNVBAGLBSA-N 1 2 225.336 2.185 20 0 BEADLO CN(c1cc[nH+]c2ccncc21)[C@H]1CCCOC1 ZINC000343268462 353281063 /nfs/dbraw/zinc/28/10/63/353281063.db2.gz DYQSCPPJQTYKLC-NSHDSACASA-N 1 2 243.310 2.245 20 0 BEADLO Cc1cc(N(C)[C@H]2CCC[C@@H]2O)nc(C2CC2)[nH+]1 ZINC000343268740 353285033 /nfs/dbraw/zinc/28/50/33/353285033.db2.gz WTPUKVKBMGTGQX-RYUDHWBXSA-N 1 2 247.342 2.012 20 0 BEADLO COc1ccc(N[C@@H](C)C2CCOCC2)[nH+]c1 ZINC000225835472 538114199 /nfs/dbraw/zinc/11/41/99/538114199.db2.gz GXGTVSLJXURZNU-JTQLQIEISA-N 1 2 236.315 2.317 20 0 BEADLO CC(C)CC[C@@H](O)C[N@@H+]1CCC(F)(F)C1 ZINC000361321128 188243850 /nfs/dbraw/zinc/24/38/50/188243850.db2.gz MGHXHHAZUOKNHW-SNVBAGLBSA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)CC[C@@H](O)C[N@H+]1CCC(F)(F)C1 ZINC000361321128 188243851 /nfs/dbraw/zinc/24/38/51/188243851.db2.gz MGHXHHAZUOKNHW-SNVBAGLBSA-N 1 2 221.291 2.125 20 0 BEADLO C/C=C(\CC)C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000372765317 188249268 /nfs/dbraw/zinc/24/92/68/188249268.db2.gz ITPNZPZYQZFRDK-JNZVDCKRSA-N 1 2 233.315 2.430 20 0 BEADLO CC(=O)c1ccc(NCc2[nH+]ccn2C)cc1 ZINC000096969065 188271451 /nfs/dbraw/zinc/27/14/51/188271451.db2.gz SJBIPQKKAQOZQR-UHFFFAOYSA-N 1 2 229.283 2.235 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2ccon2)cc1O ZINC000080963818 188312158 /nfs/dbraw/zinc/31/21/58/188312158.db2.gz BTFBOTLQMCDYMC-UHFFFAOYSA-N 1 2 248.282 2.021 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2ccon2)cc1O ZINC000080963818 188312160 /nfs/dbraw/zinc/31/21/60/188312160.db2.gz BTFBOTLQMCDYMC-UHFFFAOYSA-N 1 2 248.282 2.021 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccccn2)on1 ZINC000639041930 353322212 /nfs/dbraw/zinc/32/22/12/353322212.db2.gz PYJLVHWBFSRYSS-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccccn2)on1 ZINC000639041930 353322215 /nfs/dbraw/zinc/32/22/15/353322215.db2.gz PYJLVHWBFSRYSS-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO C[N@H+](Cc1ccns1)Cc1ccncc1 ZINC000639040148 353322275 /nfs/dbraw/zinc/32/22/75/353322275.db2.gz CEKDODCQHNCXFF-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO C[N@@H+](Cc1ccns1)Cc1ccncc1 ZINC000639040148 353322278 /nfs/dbraw/zinc/32/22/78/353322278.db2.gz CEKDODCQHNCXFF-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO CC(C)COc1ccc(NCc2[nH]cc[nH+]2)cn1 ZINC000119712959 188328369 /nfs/dbraw/zinc/32/83/69/188328369.db2.gz UNQJEOWHOVZOIP-UHFFFAOYSA-N 1 2 246.314 2.452 20 0 BEADLO Cn1ccnc1C[N@H+](C)Cc1cccs1 ZINC000153394497 188332474 /nfs/dbraw/zinc/33/24/74/188332474.db2.gz VXVDXTUMAVQQFN-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO Cn1ccnc1C[N@@H+](C)Cc1cccs1 ZINC000153394497 188332475 /nfs/dbraw/zinc/33/24/75/188332475.db2.gz VXVDXTUMAVQQFN-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO CN(Cc1cccs1)Cc1[nH+]ccn1C ZINC000153394497 188332477 /nfs/dbraw/zinc/33/24/77/188332477.db2.gz VXVDXTUMAVQQFN-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO C[C@H]1CCC[C@@H](CC(=O)NCc2[nH+]ccn2C)C1 ZINC000343283297 353344553 /nfs/dbraw/zinc/34/45/53/353344553.db2.gz ASSFNEXCEGMDEI-NWDGAFQWSA-N 1 2 249.358 2.253 20 0 BEADLO C/C=C(\C=C\C(=O)NC1=[NH+]CCS1)CC ZINC000157581012 188334111 /nfs/dbraw/zinc/33/41/11/188334111.db2.gz SBPZBTQTZUXDKS-CGALLOPASA-N 1 2 224.329 2.118 20 0 BEADLO C[C@H](C(N)=O)[N@@H+]1CCO[C@H](C2CCCCC2)C1 ZINC000334503727 353351379 /nfs/dbraw/zinc/35/13/79/353351379.db2.gz XJBRRAYLMLVQBQ-PWSUYJOCSA-N 1 2 240.347 2.191 20 0 BEADLO C[C@H](C(N)=O)[N@H+]1CCO[C@H](C2CCCCC2)C1 ZINC000334503727 353351383 /nfs/dbraw/zinc/35/13/83/353351383.db2.gz XJBRRAYLMLVQBQ-PWSUYJOCSA-N 1 2 240.347 2.191 20 0 BEADLO CC[C@H](C[C@@H](C)CC)[NH2+]Cc1c[nH]nn1 ZINC000398330124 363219188 /nfs/dbraw/zinc/21/91/88/363219188.db2.gz HPOPIFDEJPKEHD-VHSXEESVSA-N 1 2 210.325 2.109 20 0 BEADLO CC[C@H](C[C@@H](C)CC)[NH2+]Cc1cn[nH]n1 ZINC000398330124 363219190 /nfs/dbraw/zinc/21/91/90/363219190.db2.gz HPOPIFDEJPKEHD-VHSXEESVSA-N 1 2 210.325 2.109 20 0 BEADLO CCN(CC(F)F)[C@@H](c1[nH+]ccn1C)C1CC1 ZINC000639063499 353374650 /nfs/dbraw/zinc/37/46/50/353374650.db2.gz WXWPDFHDROQBFP-LLVKDONJSA-N 1 2 243.301 2.458 20 0 BEADLO CC[C@@H](C)C[C@H](CC)[NH2+]Cc1c[nH]nn1 ZINC000398330126 363220163 /nfs/dbraw/zinc/22/01/63/363220163.db2.gz HPOPIFDEJPKEHD-ZJUUUORDSA-N 1 2 210.325 2.109 20 0 BEADLO CC[C@@H](C)C[C@H](CC)[NH2+]Cc1cn[nH]n1 ZINC000398330126 363220167 /nfs/dbraw/zinc/22/01/67/363220167.db2.gz HPOPIFDEJPKEHD-ZJUUUORDSA-N 1 2 210.325 2.109 20 0 BEADLO C/C=C\C[C@H]([NH2+]CCSCC)C(=O)OCC ZINC000336781079 188354104 /nfs/dbraw/zinc/35/41/04/188354104.db2.gz TWLYNVSMFXTQNQ-IBHLPDHGSA-N 1 2 245.388 2.227 20 0 BEADLO CC(C)[C@H](C)C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000264988872 188371999 /nfs/dbraw/zinc/37/19/99/188371999.db2.gz JMJJYARNJQRQRG-NSHDSACASA-N 1 2 249.358 2.408 20 0 BEADLO C[C@H](CCC1CC1)NC(=O)CCc1c[nH+]cn1C ZINC000339169934 188367742 /nfs/dbraw/zinc/36/77/42/188367742.db2.gz KJNQSESJVZLXCZ-LLVKDONJSA-N 1 2 249.358 2.048 20 0 BEADLO C[C@@H]1CC(C(=O)NCc2[nH]cc[nH+]2)C[C@@H](C)C1 ZINC000272564989 188377190 /nfs/dbraw/zinc/37/71/90/188377190.db2.gz RGJHWUNDIWVYDU-UWVGGRQHSA-N 1 2 235.331 2.098 20 0 BEADLO Cc1nc(F)ccc1C[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000279624480 188382313 /nfs/dbraw/zinc/38/23/13/188382313.db2.gz YNNXLMKZIKJBHB-UWVGGRQHSA-N 1 2 238.306 2.138 20 0 BEADLO O=C(CC1CCC1)Nc1ccn2cc[nH+]c2c1 ZINC000280670475 188383605 /nfs/dbraw/zinc/38/36/05/188383605.db2.gz BHHFMUDRBURHAB-UHFFFAOYSA-N 1 2 229.283 2.463 20 0 BEADLO CC(=O)c1ccc(C[N@H+]2CCO[C@@H](C)[C@@H]2C)cc1 ZINC000296840620 188395303 /nfs/dbraw/zinc/39/53/03/188395303.db2.gz STEGSHWCUBNVBN-AAEUAGOBSA-N 1 2 247.338 2.498 20 0 BEADLO CC(=O)c1ccc(C[N@@H+]2CCO[C@@H](C)[C@@H]2C)cc1 ZINC000296840620 188395305 /nfs/dbraw/zinc/39/53/05/188395305.db2.gz STEGSHWCUBNVBN-AAEUAGOBSA-N 1 2 247.338 2.498 20 0 BEADLO CC(C)[N@H+](Cc1cccc2c1OCO2)C1COC1 ZINC000296005405 188394420 /nfs/dbraw/zinc/39/44/20/188394420.db2.gz LFKGYXPQQMCACK-UHFFFAOYSA-N 1 2 249.310 2.025 20 0 BEADLO CC(C)[N@@H+](Cc1cccc2c1OCO2)C1COC1 ZINC000296005405 188394422 /nfs/dbraw/zinc/39/44/22/188394422.db2.gz LFKGYXPQQMCACK-UHFFFAOYSA-N 1 2 249.310 2.025 20 0 BEADLO CCC[C@H](CC)NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000577862736 366090151 /nfs/dbraw/zinc/09/01/51/366090151.db2.gz HKLVEXZLXWLDAX-QWRGUYRKSA-N 1 2 237.347 2.283 20 0 BEADLO CCC[C@H](CC)NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000577862736 366090154 /nfs/dbraw/zinc/09/01/54/366090154.db2.gz HKLVEXZLXWLDAX-QWRGUYRKSA-N 1 2 237.347 2.283 20 0 BEADLO Fc1cccc2c1CC[N@H+](Cc1ccno1)C2 ZINC000270196535 181004712 /nfs/dbraw/zinc/00/47/12/181004712.db2.gz OGNCIXQHOPSXDG-UHFFFAOYSA-N 1 2 232.258 2.372 20 0 BEADLO Fc1cccc2c1CC[N@@H+](Cc1ccno1)C2 ZINC000270196535 181004713 /nfs/dbraw/zinc/00/47/13/181004713.db2.gz OGNCIXQHOPSXDG-UHFFFAOYSA-N 1 2 232.258 2.372 20 0 BEADLO Fc1cccc2c1CC[C@@H]2[NH2+]Cc1ccn[nH]1 ZINC000112344071 181004799 /nfs/dbraw/zinc/00/47/99/181004799.db2.gz KSCOYFGUUVUKBL-ZDUSSCGKSA-N 1 2 231.274 2.326 20 0 BEADLO C[C@@H]([NH2+]Cc1c[nH]nn1)[C@@H]1CC2CCC1CC2 ZINC000398472247 363250789 /nfs/dbraw/zinc/25/07/89/363250789.db2.gz XOOMLSMTHYOKMK-PGHLRGPGSA-N 1 2 234.347 2.109 20 0 BEADLO C[C@@H]([NH2+]Cc1cn[nH]n1)[C@@H]1CC2CCC1CC2 ZINC000398472247 363250793 /nfs/dbraw/zinc/25/07/93/363250793.db2.gz XOOMLSMTHYOKMK-PGHLRGPGSA-N 1 2 234.347 2.109 20 0 BEADLO CCC[C@H](C)N(C)C(=O)[C@@H]1CCn2c[nH+]cc2C1 ZINC000343325659 353713067 /nfs/dbraw/zinc/71/30/67/353713067.db2.gz SXTPJNKVCIEFOM-NWDGAFQWSA-N 1 2 249.358 2.093 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)[C@H]1CCn2c[nH+]cc2C1 ZINC000343325657 353713365 /nfs/dbraw/zinc/71/33/65/353713365.db2.gz SXTPJNKVCIEFOM-NEPJUHHUSA-N 1 2 249.358 2.093 20 0 BEADLO Fc1cccc(F)c1CN1CCn2c[nH+]cc2C1 ZINC000291700925 181000736 /nfs/dbraw/zinc/00/07/36/181000736.db2.gz ZBIWZQXXXRIWAB-UHFFFAOYSA-N 1 2 249.264 2.177 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](C)c2cnccn2)s1 ZINC000224186025 324215085 /nfs/dbraw/zinc/21/50/85/324215085.db2.gz YPJOZRFCQRZXEF-VIFPVBQESA-N 1 2 234.328 2.092 20 0 BEADLO Fc1cccc2oc(-n3cc[nH+]c3)nc21 ZINC000362556881 181007885 /nfs/dbraw/zinc/00/78/85/181007885.db2.gz XHGDFCLCPRFTSC-UHFFFAOYSA-N 1 2 203.176 2.153 20 0 BEADLO Fc1cncc(NCc2cn3ccccc3[nH+]2)c1 ZINC000306002621 181021067 /nfs/dbraw/zinc/02/10/67/181021067.db2.gz WCTSHMPQARTBGZ-UHFFFAOYSA-N 1 2 242.257 2.481 20 0 BEADLO Cn1cc[nH+]c1[C@H](NC1(C(F)F)CC1)C1CC1 ZINC000639140446 353848742 /nfs/dbraw/zinc/84/87/42/353848742.db2.gz XQSDWRAYTHSORQ-SECBINFHSA-N 1 2 241.285 2.259 20 0 BEADLO CC[C@@H]1C[C@H](Nc2cccc[nH+]2)CCO1 ZINC000334534121 353914111 /nfs/dbraw/zinc/91/41/11/353914111.db2.gz LCKSCNQNWBJBTJ-GHMZBOCLSA-N 1 2 206.289 2.451 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2CCSC[C@@H](C)C2)no1 ZINC000334534801 353914684 /nfs/dbraw/zinc/91/46/84/353914684.db2.gz GISRIPNZNNIXRQ-DTWKUNHWSA-N 1 2 241.360 2.124 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2CCSC[C@@H](C)C2)no1 ZINC000334534801 353914685 /nfs/dbraw/zinc/91/46/85/353914685.db2.gz GISRIPNZNNIXRQ-DTWKUNHWSA-N 1 2 241.360 2.124 20 0 BEADLO FC(F)OC[C@H]1CCN(c2cccc[nH+]2)C1 ZINC000343541277 353917070 /nfs/dbraw/zinc/91/70/70/353917070.db2.gz LXBXUMDXBWYJSY-VIFPVBQESA-N 1 2 228.242 2.147 20 0 BEADLO COc1ccncc1C[N@@H+]1CC[C@@](C)(F)C1 ZINC000334536862 353923562 /nfs/dbraw/zinc/92/35/62/353923562.db2.gz BVSCTMJSLRUSNX-GFCCVEGCSA-N 1 2 224.279 2.024 20 0 BEADLO COc1ccncc1C[N@H+]1CC[C@@](C)(F)C1 ZINC000334536862 353923564 /nfs/dbraw/zinc/92/35/64/353923564.db2.gz BVSCTMJSLRUSNX-GFCCVEGCSA-N 1 2 224.279 2.024 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2cncc(F)c2)C1 ZINC000334536920 353924029 /nfs/dbraw/zinc/92/40/29/353924029.db2.gz NHLGKIPUXSWESG-LLVKDONJSA-N 1 2 212.243 2.155 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2cncc(F)c2)C1 ZINC000334536920 353924031 /nfs/dbraw/zinc/92/40/31/353924031.db2.gz NHLGKIPUXSWESG-LLVKDONJSA-N 1 2 212.243 2.155 20 0 BEADLO CC(C)c1nc(NC[C@H]2CCOC[C@@H]2C)cc[nH+]1 ZINC000343558252 353934439 /nfs/dbraw/zinc/93/44/39/353934439.db2.gz UVGYXTQAHQBZAU-NWDGAFQWSA-N 1 2 249.358 2.106 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CCSC(C)(C)C2)[nH]1 ZINC000334547123 353985138 /nfs/dbraw/zinc/98/51/38/353985138.db2.gz DTZLENMOTYDQGC-MRVPVSSYSA-N 1 2 240.376 2.002 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CCSC(C)(C)C2)[nH]1 ZINC000334547123 353985140 /nfs/dbraw/zinc/98/51/40/353985140.db2.gz DTZLENMOTYDQGC-MRVPVSSYSA-N 1 2 240.376 2.002 20 0 BEADLO CC1(C)C[N@H+](Cc2ccc3c(n2)CCC3)CCO1 ZINC000334552505 353994060 /nfs/dbraw/zinc/99/40/60/353994060.db2.gz DDRDGSJFPTXROI-UHFFFAOYSA-N 1 2 246.354 2.181 20 0 BEADLO CC1(C)C[N@@H+](Cc2ccc3c(n2)CCC3)CCO1 ZINC000334552505 353994063 /nfs/dbraw/zinc/99/40/63/353994063.db2.gz DDRDGSJFPTXROI-UHFFFAOYSA-N 1 2 246.354 2.181 20 0 BEADLO C[C@H]1CC[C@@H]1[NH+]=c1[nH]c2cccc(F)c2n1C ZINC000343807576 354010521 /nfs/dbraw/zinc/01/05/21/354010521.db2.gz LPAIPLOVKKVILF-WPRPVWTQSA-N 1 2 233.290 2.345 20 0 BEADLO c1ccc(N[C@H]2CCO[C@@H]2C2CC2)[nH+]c1 ZINC000230307486 363303583 /nfs/dbraw/zinc/30/35/83/363303583.db2.gz FGRGCCPYAKYMND-CMPLNLGQSA-N 1 2 204.273 2.061 20 0 BEADLO C[C@H]1CC[N@H+](C[C@H](O)C(C)(C)C)CC1(F)F ZINC000343938945 354048426 /nfs/dbraw/zinc/04/84/26/354048426.db2.gz UDNBDFFFHXLNRP-UWVGGRQHSA-N 1 2 235.318 2.371 20 0 BEADLO C[C@H]1CC[N@@H+](C[C@H](O)C(C)(C)C)CC1(F)F ZINC000343938945 354048430 /nfs/dbraw/zinc/04/84/30/354048430.db2.gz UDNBDFFFHXLNRP-UWVGGRQHSA-N 1 2 235.318 2.371 20 0 BEADLO Cc1nc(NCC2(C(F)(F)F)CCC2)cc[nH+]1 ZINC000343975602 354056185 /nfs/dbraw/zinc/05/61/85/354056185.db2.gz KCCMQAFSKVQDDS-UHFFFAOYSA-N 1 2 245.248 2.351 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)no1 ZINC000334574449 354104995 /nfs/dbraw/zinc/10/49/95/354104995.db2.gz FSCIJAPCOXYCHX-QMMMGPOBSA-N 1 2 230.258 2.460 20 0 BEADLO Cc1cc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)no1 ZINC000334574449 354104997 /nfs/dbraw/zinc/10/49/97/354104997.db2.gz FSCIJAPCOXYCHX-QMMMGPOBSA-N 1 2 230.258 2.460 20 0 BEADLO CC[C@H]1C[N@@H+]([C@H](C)c2nnc(C)[nH]2)CCS1 ZINC000334561746 354116549 /nfs/dbraw/zinc/11/65/49/354116549.db2.gz FAKRYPYEWZUXOZ-SCZZXKLOSA-N 1 2 240.376 2.002 20 0 BEADLO CC[C@H]1C[N@H+]([C@H](C)c2nnc(C)[nH]2)CCS1 ZINC000334561746 354116552 /nfs/dbraw/zinc/11/65/52/354116552.db2.gz FAKRYPYEWZUXOZ-SCZZXKLOSA-N 1 2 240.376 2.002 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@@H](C)c2nnc(C)[nH]2)CCS1 ZINC000334561749 354116676 /nfs/dbraw/zinc/11/66/76/354116676.db2.gz FAKRYPYEWZUXOZ-WCBMZHEXSA-N 1 2 240.376 2.002 20 0 BEADLO CC[C@@H]1C[N@H+]([C@@H](C)c2nnc(C)[nH]2)CCS1 ZINC000334561749 354116678 /nfs/dbraw/zinc/11/66/78/354116678.db2.gz FAKRYPYEWZUXOZ-WCBMZHEXSA-N 1 2 240.376 2.002 20 0 BEADLO COc1ccc(C2([NH2+]Cc3c[nH]cn3)CC2)cc1 ZINC000344175951 354173931 /nfs/dbraw/zinc/17/39/31/354173931.db2.gz IZDLITJWFFQONB-UHFFFAOYSA-N 1 2 243.310 2.197 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)Nc1ccsc1 ZINC000344207403 354164038 /nfs/dbraw/zinc/16/40/38/354164038.db2.gz TWZFFRJFMAUDEW-UHFFFAOYSA-N 1 2 221.285 2.043 20 0 BEADLO CCC[C@H](C)CC(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000344253591 354190749 /nfs/dbraw/zinc/19/07/49/354190749.db2.gz RWIQUJJWPBWJDT-WDEREUQCSA-N 1 2 249.358 2.210 20 0 BEADLO CCC[C@H](C)CC(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000344253591 354190750 /nfs/dbraw/zinc/19/07/50/354190750.db2.gz RWIQUJJWPBWJDT-WDEREUQCSA-N 1 2 249.358 2.210 20 0 BEADLO CC(C)[C@H](C)CC(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000344256077 354191431 /nfs/dbraw/zinc/19/14/31/354191431.db2.gz VSFARCCRDQQRDO-GHMZBOCLSA-N 1 2 249.358 2.065 20 0 BEADLO CC(C)[C@H](C)CC(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000344256077 354191432 /nfs/dbraw/zinc/19/14/32/354191432.db2.gz VSFARCCRDQQRDO-GHMZBOCLSA-N 1 2 249.358 2.065 20 0 BEADLO Fc1ccc(C2([NH2+]Cc3csnn3)CC2)cc1 ZINC000344276594 354197948 /nfs/dbraw/zinc/19/79/48/354197948.db2.gz SQZGZENWNXENMO-UHFFFAOYSA-N 1 2 249.314 2.456 20 0 BEADLO CCc1cnc(C[NH+]2CCSCC2)s1 ZINC000334588009 354214548 /nfs/dbraw/zinc/21/45/48/354214548.db2.gz MMZMGHLWQBNNMT-UHFFFAOYSA-N 1 2 228.386 2.254 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC(C)(C)[C@@H]1C1CC1 ZINC000334608426 354315500 /nfs/dbraw/zinc/31/55/00/354315500.db2.gz UILMDEBDIIBFMS-LBPRGKRZSA-N 1 2 219.332 2.339 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC(C)(C)[C@@H]1C1CC1 ZINC000334608426 354315503 /nfs/dbraw/zinc/31/55/03/354315503.db2.gz UILMDEBDIIBFMS-LBPRGKRZSA-N 1 2 219.332 2.339 20 0 BEADLO CC[C@@H]([NH2+]Cc1c[nH]cn1)c1c(C)nn(C)c1C ZINC000344754526 354350661 /nfs/dbraw/zinc/35/06/61/354350661.db2.gz BFMHFKFFUGPZFA-GFCCVEGCSA-N 1 2 247.346 2.001 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000580401625 358487117 /nfs/dbraw/zinc/48/71/17/358487117.db2.gz ZDYHLZKVQWOBLC-JGPRNRPPSA-N 1 2 236.315 2.458 20 0 BEADLO Cc1cc(N2C[C@H](C3CC3)[C@@H]2C2CC2)nc[nH+]1 ZINC000334688379 354434336 /nfs/dbraw/zinc/43/43/36/354434336.db2.gz ZUPCCPICEDMIQA-OCCSQVGLSA-N 1 2 229.327 2.410 20 0 BEADLO O[C@@H]1C[C@H](c2ccccc2)N(c2cccc[nH+]2)C1 ZINC000334644873 354403701 /nfs/dbraw/zinc/40/37/01/354403701.db2.gz KLRFTBDXNRNTOB-ZIAGYGMSSA-N 1 2 240.306 2.394 20 0 BEADLO C[C@@H]1CCC[C@]1(C)C(=O)N1CCn2cc[nH+]c2C1 ZINC000334667047 354406382 /nfs/dbraw/zinc/40/63/82/354406382.db2.gz WMYPVLHNKNRAFY-RISCZKNCSA-N 1 2 247.342 2.052 20 0 BEADLO c1nc(C[N@@H+]2CCSC[C@H]2C2CC2)cs1 ZINC000334679836 354426183 /nfs/dbraw/zinc/42/61/83/354426183.db2.gz UNDAFGAGPQODCF-NSHDSACASA-N 1 2 240.397 2.471 20 0 BEADLO c1nc(C[N@H+]2CCSC[C@H]2C2CC2)cs1 ZINC000334679836 354426184 /nfs/dbraw/zinc/42/61/84/354426184.db2.gz UNDAFGAGPQODCF-NSHDSACASA-N 1 2 240.397 2.471 20 0 BEADLO Cc1cc(C)c(CNC(=O)N2CC[C@@H](C)C2)c[nH+]1 ZINC000334680969 354427138 /nfs/dbraw/zinc/42/71/38/354427138.db2.gz LEPURYZRFHMERD-SNVBAGLBSA-N 1 2 247.342 2.250 20 0 BEADLO CC1=CC[N@H+]([C@@H](C)c2csnn2)CC1 ZINC000334654653 354447836 /nfs/dbraw/zinc/44/78/36/354447836.db2.gz QQUVBAGGHXKEIL-VIFPVBQESA-N 1 2 209.318 2.251 20 0 BEADLO CC1=CC[N@@H+]([C@@H](C)c2csnn2)CC1 ZINC000334654653 354447839 /nfs/dbraw/zinc/44/78/39/354447839.db2.gz QQUVBAGGHXKEIL-VIFPVBQESA-N 1 2 209.318 2.251 20 0 BEADLO O=C(Nc1c[nH+]c2n1CCCC2)[C@@H]1C[C@H]1C1CC1 ZINC000334655613 354449280 /nfs/dbraw/zinc/44/92/80/354449280.db2.gz VASOAIYTXHTTKL-WDEREUQCSA-N 1 2 245.326 2.204 20 0 BEADLO Cc1ccc2c(c1)[C@H]([NH2+]Cc1cocn1)CO2 ZINC000578074693 366222621 /nfs/dbraw/zinc/22/26/21/366222621.db2.gz XTMVFJQGWSQHJX-GFCCVEGCSA-N 1 2 230.267 2.206 20 0 BEADLO CC(=O)c1ccc(C[N@H+]2CCN(C)C[C@H]2C)cc1 ZINC000334661304 354460782 /nfs/dbraw/zinc/46/07/82/354460782.db2.gz DCPYEBSNBGATIY-GFCCVEGCSA-N 1 2 246.354 2.025 20 0 BEADLO CC(=O)c1ccc(C[N@@H+]2CCN(C)C[C@H]2C)cc1 ZINC000334661304 354460784 /nfs/dbraw/zinc/46/07/84/354460784.db2.gz DCPYEBSNBGATIY-GFCCVEGCSA-N 1 2 246.354 2.025 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CC(C)(C)[C@H]1[C@@H]1CCCO1 ZINC000334695824 354486772 /nfs/dbraw/zinc/48/67/72/354486772.db2.gz WIWSROCESCWIDH-QWHCGFSZSA-N 1 2 249.358 2.108 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CC(C)(C)[C@H]1[C@@H]1CCCO1 ZINC000334695824 354486774 /nfs/dbraw/zinc/48/67/74/354486774.db2.gz WIWSROCESCWIDH-QWHCGFSZSA-N 1 2 249.358 2.108 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CC(C)(C)[C@H]1[C@H]1CCCO1 ZINC000334695821 354487241 /nfs/dbraw/zinc/48/72/41/354487241.db2.gz WIWSROCESCWIDH-CHWSQXEVSA-N 1 2 249.358 2.108 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CC(C)(C)[C@H]1[C@H]1CCCO1 ZINC000334695821 354487245 /nfs/dbraw/zinc/48/72/45/354487245.db2.gz WIWSROCESCWIDH-CHWSQXEVSA-N 1 2 249.358 2.108 20 0 BEADLO O=C(Nc1c[nH+]c2n1CCCC2)c1ccco1 ZINC000334696275 354487891 /nfs/dbraw/zinc/48/78/91/354487891.db2.gz MPHRLHAFZAMMEV-UHFFFAOYSA-N 1 2 231.255 2.065 20 0 BEADLO Cc1cc(C)c(CNC(=O)N2CCC[C@H]2C)c[nH+]1 ZINC000334717913 354517046 /nfs/dbraw/zinc/51/70/46/354517046.db2.gz ASGWWXTWLVJFEY-GFCCVEGCSA-N 1 2 247.342 2.392 20 0 BEADLO COC1(C)CN(c2cc(C(F)(F)F)cc[nH+]2)C1 ZINC000334800818 354556309 /nfs/dbraw/zinc/55/63/09/354556309.db2.gz AMKWTRBHUZVKCS-UHFFFAOYSA-N 1 2 246.232 2.326 20 0 BEADLO C[C@@H]1C[C@@H](Nc2cc[nH+]c(C3CC3)n2)CS1 ZINC000334808226 354564967 /nfs/dbraw/zinc/56/49/67/354564967.db2.gz WTDYAOFLNPCCTE-PSASIEDQSA-N 1 2 235.356 2.082 20 0 BEADLO C[C@@H]1C[C@H](Nc2cc[nH+]c(C3CC3)n2)CS1 ZINC000334808228 354565119 /nfs/dbraw/zinc/56/51/19/354565119.db2.gz WTDYAOFLNPCCTE-SCZZXKLOSA-N 1 2 235.356 2.082 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)CC(C)(C)C)c2[nH+]ccn21 ZINC000334756067 354577944 /nfs/dbraw/zinc/57/79/44/354577944.db2.gz SEVFCYVDAPJMOW-NXEZZACHSA-N 1 2 235.331 2.441 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC[C@H]2c2ncc[nH]2)nc1 ZINC000334771499 354591089 /nfs/dbraw/zinc/59/10/89/354591089.db2.gz ZLFBQEUOLAIKDB-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc(C[N@H+]2CCC[C@H]2c2ncc[nH]2)nc1 ZINC000334771499 354591090 /nfs/dbraw/zinc/59/10/90/354591090.db2.gz ZLFBQEUOLAIKDB-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)C2CCCC2)c2[nH+]ccn21 ZINC000334744481 354548187 /nfs/dbraw/zinc/54/81/87/354548187.db2.gz SGNUOYPAARLOSM-KOLCDFICSA-N 1 2 233.315 2.195 20 0 BEADLO C[C@@]1(C(=O)Nc2cccc3[nH+]ccn32)C[C@@H]1F ZINC000335094784 354632864 /nfs/dbraw/zinc/63/28/64/354632864.db2.gz KNBQAPABADCGSG-QPUJVOFHSA-N 1 2 233.246 2.021 20 0 BEADLO C[C@@H]1CCC[C@H](CC(=O)NCCn2cc[nH+]c2)C1 ZINC000345368103 354638809 /nfs/dbraw/zinc/63/88/09/354638809.db2.gz ATECQULQLKYVNA-OLZOCXBDSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H]1CCCC[C@H]1C ZINC000335105582 354690217 /nfs/dbraw/zinc/69/02/17/354690217.db2.gz VPTNXERHVHXQDQ-KOLCDFICSA-N 1 2 235.331 2.161 20 0 BEADLO CC(C)n1c[nH+]cc1CN1CCCc2n[nH]cc21 ZINC000335109888 354696234 /nfs/dbraw/zinc/69/62/34/354696234.db2.gz KCIBSVFDHHHVRC-UHFFFAOYSA-N 1 2 245.330 2.140 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C(=O)N1CCn2c[nH+]cc2C1 ZINC000335111987 354698659 /nfs/dbraw/zinc/69/86/59/354698659.db2.gz AYEQNBIFERDTNK-YPMHNXCESA-N 1 2 247.342 2.052 20 0 BEADLO Cc1cn2cc(NC(=O)[C@@]3(C)C[C@H]3F)ccc2[nH+]1 ZINC000335102401 354714108 /nfs/dbraw/zinc/71/41/08/354714108.db2.gz FYUDNFAYEMRBGH-MFKMUULPSA-N 1 2 247.273 2.329 20 0 BEADLO CCC[C@@H](C)CC(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000345606338 354728080 /nfs/dbraw/zinc/72/80/80/354728080.db2.gz IRFZQJXUPNCFIC-NEPJUHHUSA-N 1 2 237.347 2.214 20 0 BEADLO CCC(CC)CC(=O)NCCNc1cccc[nH+]1 ZINC000345545026 354678114 /nfs/dbraw/zinc/67/81/14/354678114.db2.gz KORPHWLVXRGAPT-UHFFFAOYSA-N 1 2 249.358 2.436 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1cc(C)sn1 ZINC000345742427 354749743 /nfs/dbraw/zinc/74/97/43/354749743.db2.gz NYSICLUUBLEPFB-UHFFFAOYSA-N 1 2 249.295 2.107 20 0 BEADLO CCc1ccc(C[N@@H+]2CCN(C)CC[C@H]2C)cn1 ZINC000335134389 354782921 /nfs/dbraw/zinc/78/29/21/354782921.db2.gz YNGNVMYVGYVSCH-CYBMUJFWSA-N 1 2 247.386 2.170 20 0 BEADLO CCc1ccc(C[N@H+]2CCN(C)CC[C@H]2C)cn1 ZINC000335134389 354782923 /nfs/dbraw/zinc/78/29/23/354782923.db2.gz YNGNVMYVGYVSCH-CYBMUJFWSA-N 1 2 247.386 2.170 20 0 BEADLO Cc1ncc([C@H](C)[N@H+](C2CC2)C2COC2)c(C)n1 ZINC000639215668 354821945 /nfs/dbraw/zinc/82/19/45/354821945.db2.gz FDWABQZWJJZPOM-JTQLQIEISA-N 1 2 247.342 2.018 20 0 BEADLO Cc1ncc([C@H](C)[N@@H+](C2CC2)C2COC2)c(C)n1 ZINC000639215668 354821946 /nfs/dbraw/zinc/82/19/46/354821946.db2.gz FDWABQZWJJZPOM-JTQLQIEISA-N 1 2 247.342 2.018 20 0 BEADLO Cc1sccc1C[N@@H+]1CC[S@@](=O)[C@H](C)C1 ZINC000335942417 134018231 /nfs/dbraw/zinc/01/82/31/134018231.db2.gz MZSHBQOSOUVZBX-RFAUZJTJSA-N 1 2 243.397 2.009 20 0 BEADLO Cc1sccc1C[N@H+]1CC[S@@](=O)[C@H](C)C1 ZINC000335942417 134018232 /nfs/dbraw/zinc/01/82/32/134018232.db2.gz MZSHBQOSOUVZBX-RFAUZJTJSA-N 1 2 243.397 2.009 20 0 BEADLO CC[C@@H](C)CN(C)C(=O)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000346303776 354890771 /nfs/dbraw/zinc/89/07/71/354890771.db2.gz MJYFKESZYCPALQ-MNOVXSKESA-N 1 2 249.358 2.334 20 0 BEADLO Cc1cc(C)c(CNC(=O)C2=CCC2)c[nH+]1 ZINC000335173908 354940399 /nfs/dbraw/zinc/94/03/99/354940399.db2.gz KIEXIAQOXGAETB-UHFFFAOYSA-N 1 2 216.284 2.035 20 0 BEADLO C[C@H](CNC(=O)[C@H]1CC[C@@H](C)C1)Cn1cc[nH+]c1 ZINC000346525658 354975769 /nfs/dbraw/zinc/97/57/69/354975769.db2.gz LAYQNEMLEDKZLQ-UPJWGTAASA-N 1 2 249.358 2.072 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H]1CCC(C)(C)C1 ZINC000335960991 134027139 /nfs/dbraw/zinc/02/71/39/134027139.db2.gz CHQOHFLOXANQJE-JTQLQIEISA-N 1 2 235.331 2.161 20 0 BEADLO CC(C)c1nc(N2C[C@@H](C)OC[C@H]2C)cc[nH+]1 ZINC000346591538 354987053 /nfs/dbraw/zinc/98/70/53/354987053.db2.gz JDRJNMJOFQAHLW-GHMZBOCLSA-N 1 2 235.331 2.214 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CCC[C@H](F)C2)cc[nH+]1 ZINC000335228062 355069949 /nfs/dbraw/zinc/06/99/49/355069949.db2.gz ANXFTZKDCWDYLF-QWRGUYRKSA-N 1 2 236.290 2.279 20 0 BEADLO Cc1cc(C[NH+]2CC3(CCC3(F)F)C2)no1 ZINC000335216990 355055603 /nfs/dbraw/zinc/05/56/03/355055603.db2.gz VGOSHAXBJBWIAN-UHFFFAOYSA-N 1 2 228.242 2.214 20 0 BEADLO CCC1(C(=O)N2CCC(n3cc[nH+]c3)CC2)CC1 ZINC000335186234 355084441 /nfs/dbraw/zinc/08/44/41/355084441.db2.gz YPCOUHYWSOAWQJ-UHFFFAOYSA-N 1 2 247.342 2.237 20 0 BEADLO OC[C@H](Cc1ccc(F)cc1)Nc1cccc[nH+]1 ZINC000346702807 355092923 /nfs/dbraw/zinc/09/29/23/355092923.db2.gz UUSJMRJUURRPDC-ZDUSSCGKSA-N 1 2 246.285 2.236 20 0 BEADLO C[C@@H](CC(=O)N1CCn2c[nH+]cc2C1)C(C)(C)C ZINC000335237804 355099469 /nfs/dbraw/zinc/09/94/69/355099469.db2.gz BGHYXKWKOVRWPY-NSHDSACASA-N 1 2 249.358 2.298 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1cccc(C)n1 ZINC000346719243 355103285 /nfs/dbraw/zinc/10/32/85/355103285.db2.gz JTKJPGRVQZPEEH-UHFFFAOYSA-N 1 2 243.266 2.046 20 0 BEADLO Cc1nc(N2CC[C@H](C(C)C)C2)cc[nH+]1 ZINC000335245000 355159709 /nfs/dbraw/zinc/15/97/09/355159709.db2.gz NJGQWIKOEBFKDP-NSHDSACASA-N 1 2 205.305 2.267 20 0 BEADLO NC(=O)[C@@H]1CCC[N@@H+]1Cc1ccc(Cl)cn1 ZINC000335246119 355160748 /nfs/dbraw/zinc/16/07/48/355160748.db2.gz BILAGMFGGXKYMM-JTQLQIEISA-N 1 2 239.706 2.235 20 0 BEADLO NC(=O)[C@@H]1CCC[N@H+]1Cc1ccc(Cl)cn1 ZINC000335246119 355160751 /nfs/dbraw/zinc/16/07/51/355160751.db2.gz BILAGMFGGXKYMM-JTQLQIEISA-N 1 2 239.706 2.235 20 0 BEADLO Cc1cc(NC(=O)C2C(C)(C)C2(C)C)cc[nH+]1 ZINC000346842640 355134942 /nfs/dbraw/zinc/13/49/42/355134942.db2.gz LNTWPCQLYLFOKG-UHFFFAOYSA-N 1 2 232.327 2.433 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc(F)cn2)[C@H](C)[C@@H](C)O1 ZINC000346971234 355207618 /nfs/dbraw/zinc/20/76/18/355207618.db2.gz GNEDWXOCGMNKMK-GMTAPVOTSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc(F)cn2)[C@H](C)[C@@H](C)O1 ZINC000346971234 355207619 /nfs/dbraw/zinc/20/76/19/355207619.db2.gz GNEDWXOCGMNKMK-GMTAPVOTSA-N 1 2 238.306 2.218 20 0 BEADLO COc1cccnc1C[NH2+]Cc1cc(C)ns1 ZINC000639239804 355224154 /nfs/dbraw/zinc/22/41/54/355224154.db2.gz FMQOCHQWWLTNIP-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO CCC[N@H+](CCO)Cc1ncc(Cl)s1 ZINC000352011725 134035379 /nfs/dbraw/zinc/03/53/79/134035379.db2.gz UHAUQLUZYYGAJT-UHFFFAOYSA-N 1 2 234.752 2.001 20 0 BEADLO CCC[N@@H+](CCO)Cc1ncc(Cl)s1 ZINC000352011725 134035380 /nfs/dbraw/zinc/03/53/80/134035380.db2.gz UHAUQLUZYYGAJT-UHFFFAOYSA-N 1 2 234.752 2.001 20 0 BEADLO c1coc(CCNc2cc(NC3CC3)nc[nH+]2)c1 ZINC000413023533 191343821 /nfs/dbraw/zinc/34/38/21/191343821.db2.gz AYHADOLEVFEIQE-UHFFFAOYSA-N 1 2 244.298 2.299 20 0 BEADLO c1coc(CCNc2cc(NC3CC3)[nH+]cn2)c1 ZINC000413023533 191343824 /nfs/dbraw/zinc/34/38/24/191343824.db2.gz AYHADOLEVFEIQE-UHFFFAOYSA-N 1 2 244.298 2.299 20 0 BEADLO CCC[N@H+](CC(F)F)C[C@@H](CC)OC ZINC000412975638 191345831 /nfs/dbraw/zinc/34/58/31/191345831.db2.gz GIIWDZWWEPIRGC-SECBINFHSA-N 1 2 209.280 2.389 20 0 BEADLO CCC[N@@H+](CC(F)F)C[C@@H](CC)OC ZINC000412975638 191345833 /nfs/dbraw/zinc/34/58/33/191345833.db2.gz GIIWDZWWEPIRGC-SECBINFHSA-N 1 2 209.280 2.389 20 0 BEADLO CC1(C)C[C@H]1Nc1cc(NC2CC2)[nH+]cn1 ZINC000413072170 191351578 /nfs/dbraw/zinc/35/15/78/191351578.db2.gz MLJSCWXSHSVTFR-SECBINFHSA-N 1 2 218.304 2.261 20 0 BEADLO CC1(C)C[C@H]1Nc1cc(NC2CC2)nc[nH+]1 ZINC000413072170 191351580 /nfs/dbraw/zinc/35/15/80/191351580.db2.gz MLJSCWXSHSVTFR-SECBINFHSA-N 1 2 218.304 2.261 20 0 BEADLO CN(Cc1ccoc1)c1cc(NC2CC2)[nH+]cn1 ZINC000413066272 191351825 /nfs/dbraw/zinc/35/18/25/191351825.db2.gz ITNWYFGJGWLQBU-UHFFFAOYSA-N 1 2 244.298 2.280 20 0 BEADLO CN(Cc1ccoc1)c1cc(NC2CC2)nc[nH+]1 ZINC000413066272 191351828 /nfs/dbraw/zinc/35/18/28/191351828.db2.gz ITNWYFGJGWLQBU-UHFFFAOYSA-N 1 2 244.298 2.280 20 0 BEADLO CO[C@@H]1C[C@@H](Nc2cc(C)[nH+]cn2)C12CCC2 ZINC000413446155 191384296 /nfs/dbraw/zinc/38/42/96/191384296.db2.gz PHORKNYGMOMJPU-GHMZBOCLSA-N 1 2 233.315 2.155 20 0 BEADLO COCC[C@@H](C)C[NH+]=c1[nH]c2ccccc2[nH]1 ZINC000413489507 191388911 /nfs/dbraw/zinc/38/89/11/191388911.db2.gz GYYNRHYITABVLR-SNVBAGLBSA-N 1 2 233.315 2.069 20 0 BEADLO C[C@@H]1C[C@H](CNc2cc[nH+]c(C3CC3)n2)[C@@H](C)O1 ZINC000413534543 191393785 /nfs/dbraw/zinc/39/37/85/191393785.db2.gz OXQVJHLOPZDBEF-CKYFFXLPSA-N 1 2 247.342 2.001 20 0 BEADLO Cc1nc(N2CC[C@H](C)C(F)(F)C2)cc[nH+]1 ZINC000335292597 355269762 /nfs/dbraw/zinc/26/97/62/355269762.db2.gz GHUBUJXCVGYAHR-QMMMGPOBSA-N 1 2 227.258 2.267 20 0 BEADLO C[C@@H]1C[C@@H](CNc2cc[nH+]c(C3CC3)n2)[C@@H](C)O1 ZINC000413534545 191393845 /nfs/dbraw/zinc/39/38/45/191393845.db2.gz OXQVJHLOPZDBEF-FOGDFJRCSA-N 1 2 247.342 2.001 20 0 BEADLO COC1([C@@H](C)Nc2cc(C)[nH+]cn2)CCC1 ZINC000413555664 191396784 /nfs/dbraw/zinc/39/67/84/191396784.db2.gz CYRFDQAVKJRNCU-SNVBAGLBSA-N 1 2 221.304 2.155 20 0 BEADLO C[C@@H]1CC[C@H](C)N1c1cc(NC2CC2)[nH+]cn1 ZINC000413186931 191361957 /nfs/dbraw/zinc/36/19/57/191361957.db2.gz CWHQMIOOTJCLPS-AOOOYVTPSA-N 1 2 232.331 2.428 20 0 BEADLO C[C@@H]1CC[C@H](C)N1c1cc(NC2CC2)nc[nH+]1 ZINC000413186931 191361959 /nfs/dbraw/zinc/36/19/59/191361959.db2.gz CWHQMIOOTJCLPS-AOOOYVTPSA-N 1 2 232.331 2.428 20 0 BEADLO CC(C)[C@@H]1C[C@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000413434707 191380566 /nfs/dbraw/zinc/38/05/66/191380566.db2.gz KMHIXLHEFOUGKI-WDEREUQCSA-N 1 2 217.316 2.232 20 0 BEADLO c1cc(N[C@@H]2CCC[C@@H]3C[C@@H]32)nc(C2CC2)[nH+]1 ZINC000413459428 191381276 /nfs/dbraw/zinc/38/12/76/191381276.db2.gz NDVAQBTUQWQXOG-GRYCIOLGSA-N 1 2 229.327 2.376 20 0 BEADLO Cc1cc[nH+]c(NCc2n[nH]c(C(C)(C)C)n2)c1 ZINC000413417802 191381674 /nfs/dbraw/zinc/38/16/74/191381674.db2.gz QGCWWFVGTMDMFD-UHFFFAOYSA-N 1 2 245.330 2.418 20 0 BEADLO Cc1cc(Cl)cc(C[NH+]2CC(C)(O)C2)c1 ZINC000639253257 355290124 /nfs/dbraw/zinc/29/01/24/355290124.db2.gz BZXWTNPKHSQATE-UHFFFAOYSA-N 1 2 225.719 2.215 20 0 BEADLO C[C@@H](C[NH+]1CC(C)(O)C1)c1cc(F)cc(F)c1 ZINC000639253311 355290655 /nfs/dbraw/zinc/29/06/55/355290655.db2.gz DLEVZZMWEZSAMJ-VIFPVBQESA-N 1 2 241.281 2.135 20 0 BEADLO Cc1cc(Cl)ccc1C[NH+]1CC(C)(O)C1 ZINC000639253595 355291840 /nfs/dbraw/zinc/29/18/40/355291840.db2.gz KPLJNQPKOFRMGB-UHFFFAOYSA-N 1 2 225.719 2.215 20 0 BEADLO CC1(O)C[NH+](Cc2ccc(OCC3CC3)cc2)C1 ZINC000639253645 355291920 /nfs/dbraw/zinc/29/19/20/355291920.db2.gz LYOUCOHJXDXODL-UHFFFAOYSA-N 1 2 247.338 2.042 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@H](CF)C2)c(F)c1 ZINC000639261865 355314872 /nfs/dbraw/zinc/31/48/72/355314872.db2.gz SPEIZRPFUUZDER-GFCCVEGCSA-N 1 2 241.281 2.304 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@H](CF)C2)c(F)c1 ZINC000639261865 355314875 /nfs/dbraw/zinc/31/48/75/355314875.db2.gz SPEIZRPFUUZDER-GFCCVEGCSA-N 1 2 241.281 2.304 20 0 BEADLO CCCC[C@@H]([NH2+]CC=C(C)C)C(=O)OC ZINC000191119078 355317483 /nfs/dbraw/zinc/31/74/83/355317483.db2.gz DJOCQRTYDRQULX-LLVKDONJSA-N 1 2 213.321 2.274 20 0 BEADLO CC(C)c1nc(N2CCC[C@@H](CO)[C@H]2C)cc[nH+]1 ZINC000413599632 191398932 /nfs/dbraw/zinc/39/89/32/191398932.db2.gz XKAXXVPRAOSCGP-NEPJUHHUSA-N 1 2 249.358 2.197 20 0 BEADLO CC(C)c1nc(N2CCC[C@H](CO)[C@@H]2C)cc[nH+]1 ZINC000413599833 191399050 /nfs/dbraw/zinc/39/90/50/191399050.db2.gz XKAXXVPRAOSCGP-NWDGAFQWSA-N 1 2 249.358 2.197 20 0 BEADLO CCn1c[nH+]cc1CN1CCCC(F)(F)C1 ZINC000651896478 491077533 /nfs/dbraw/zinc/07/75/33/491077533.db2.gz UGPPWCSJUQNREL-UHFFFAOYSA-N 1 2 229.274 2.134 20 0 BEADLO COc1ncc(C[NH+]2CC3(CC(F)C3)C2)s1 ZINC000639252279 355286614 /nfs/dbraw/zinc/28/66/14/355286614.db2.gz CPUCJDMSGLUPQX-UHFFFAOYSA-N 1 2 242.319 2.086 20 0 BEADLO COc1ncc(C[NH+]2CC(CC(F)F)C2)s1 ZINC000639278856 355363947 /nfs/dbraw/zinc/36/39/47/355363947.db2.gz SXYULGCOALGONB-UHFFFAOYSA-N 1 2 248.298 2.239 20 0 BEADLO CCc1cc(N[C@H](CC)C[C@H](C)CO)nc[nH+]1 ZINC000608369416 355381043 /nfs/dbraw/zinc/38/10/43/355381043.db2.gz WSCYNLQFZSBPHD-CMPLNLGQSA-N 1 2 237.347 2.248 20 0 BEADLO CC(C)c1nc(N[C@H](C)c2csnn2)cc[nH+]1 ZINC000582168594 355410834 /nfs/dbraw/zinc/41/08/34/355410834.db2.gz JHUMEJXHAOZNLF-MRVPVSSYSA-N 1 2 249.343 2.047 20 0 BEADLO C[NH2+]Cc1noc(CNc2c(C)cccc2C)n1 ZINC000414498691 191524601 /nfs/dbraw/zinc/52/46/01/191524601.db2.gz IRNXNRGGMGHBQX-UHFFFAOYSA-N 1 2 246.314 2.018 20 0 BEADLO Cc1cnc(C[NH+]2Cc3ccccc3C2)cn1 ZINC000335813271 355501366 /nfs/dbraw/zinc/50/13/66/355501366.db2.gz CFNBRIJFMAMQNF-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCCc2c1cnn2C)c1ccon1 ZINC000349830954 355488151 /nfs/dbraw/zinc/48/81/51/355488151.db2.gz GMLSQDIPJAGAKY-BXKDBHETSA-N 1 2 246.314 2.136 20 0 BEADLO CCc1cc[nH+]cc1NC[C@H](OC)C1CC1 ZINC000639294190 355554607 /nfs/dbraw/zinc/55/46/07/355554607.db2.gz JBXBGBDGCCFBJV-ZDUSSCGKSA-N 1 2 220.316 2.481 20 0 BEADLO C[NH2+]Cc1noc([C@H](c2ccccc2)C2CC2)n1 ZINC000349886579 355519496 /nfs/dbraw/zinc/51/94/96/355519496.db2.gz XKRUOAPQSDUKGB-CYBMUJFWSA-N 1 2 243.310 2.331 20 0 BEADLO C[NH2+]Cc1noc(CC(C)(C)c2ccccc2)n1 ZINC000349888974 355520483 /nfs/dbraw/zinc/52/04/83/355520483.db2.gz JSCLUYMTRZTIRK-UHFFFAOYSA-N 1 2 245.326 2.309 20 0 BEADLO C[NH2+]Cc1noc(Cc2c(C)cc(C)cc2C)n1 ZINC000349907376 355524137 /nfs/dbraw/zinc/52/41/37/355524137.db2.gz ICOTUAFUDWRVMZ-UHFFFAOYSA-N 1 2 245.326 2.305 20 0 BEADLO C[NH2+]Cc1noc(C(C)(C)c2cccs2)n1 ZINC000349921678 355527535 /nfs/dbraw/zinc/52/75/35/355527535.db2.gz NTTVVYXAVZPHLE-UHFFFAOYSA-N 1 2 237.328 2.176 20 0 BEADLO Nc1c(F)cccc1C[NH+]1CC2(CC2(F)F)C1 ZINC000639297239 355602047 /nfs/dbraw/zinc/60/20/47/355602047.db2.gz QDMGALQDSGJRDH-UHFFFAOYSA-N 1 2 242.244 2.249 20 0 BEADLO CC(C)C[N@@H+]1CC(=O)N[C@@H]1[C@H]1CCC[C@H](C)C1 ZINC000350129104 355610874 /nfs/dbraw/zinc/61/08/74/355610874.db2.gz YUUPCZMFRNTIAP-OBJOEFQTSA-N 1 2 238.375 2.227 20 0 BEADLO CC(C)C[N@H+]1CC(=O)N[C@@H]1[C@H]1CCC[C@H](C)C1 ZINC000350129104 355610878 /nfs/dbraw/zinc/61/08/78/355610878.db2.gz YUUPCZMFRNTIAP-OBJOEFQTSA-N 1 2 238.375 2.227 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C)ns2)[C@H](C)CO1 ZINC000639298614 355613536 /nfs/dbraw/zinc/61/35/36/355613536.db2.gz ZZHRLVSJTFKBCV-GHMZBOCLSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C)ns2)[C@H](C)CO1 ZINC000639298614 355613539 /nfs/dbraw/zinc/61/35/39/355613539.db2.gz ZZHRLVSJTFKBCV-GHMZBOCLSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C)ns2)[C@@H](C)CO1 ZINC000639298617 355613626 /nfs/dbraw/zinc/61/36/26/355613626.db2.gz ZZHRLVSJTFKBCV-WDEREUQCSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C)ns2)[C@@H](C)CO1 ZINC000639298617 355613628 /nfs/dbraw/zinc/61/36/28/355613628.db2.gz ZZHRLVSJTFKBCV-WDEREUQCSA-N 1 2 240.372 2.451 20 0 BEADLO CCc1cc[nH+]cc1N[C@H](C)[C@@H](C)OC ZINC000639295108 355577812 /nfs/dbraw/zinc/57/78/12/355577812.db2.gz NDOLCUFVCROPGA-NXEZZACHSA-N 1 2 208.305 2.479 20 0 BEADLO CCc1cc[nH+]cc1N[C@@H](C)[C@@H](C)OC ZINC000639295112 355577907 /nfs/dbraw/zinc/57/79/07/355577907.db2.gz NDOLCUFVCROPGA-VHSXEESVSA-N 1 2 208.305 2.479 20 0 BEADLO NC(=O)c1cccc(C[N@@H+]2CC[C@H](F)C2)c1 ZINC000336222793 181206538 /nfs/dbraw/zinc/20/65/38/181206538.db2.gz KQZNTQPJGKLKPU-NSHDSACASA-N 1 2 222.263 2.114 20 0 BEADLO NC(=O)c1cccc(C[N@H+]2CC[C@H](F)C2)c1 ZINC000336222793 181206541 /nfs/dbraw/zinc/20/65/41/181206541.db2.gz KQZNTQPJGKLKPU-NSHDSACASA-N 1 2 222.263 2.114 20 0 BEADLO CC[C@@](C)(CNc1cc(COC)cc[nH+]1)OC ZINC000639313651 355692046 /nfs/dbraw/zinc/69/20/46/355692046.db2.gz UZAWTBPBZJORDJ-ZDUSSCGKSA-N 1 2 238.331 2.455 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2CC(C)=C[C@@H](C)C2)no1 ZINC000336006837 134049590 /nfs/dbraw/zinc/04/95/90/134049590.db2.gz QLHBYTWWIFGTOZ-PSASIEDQSA-N 1 2 221.304 2.337 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2CC(C)=C[C@@H](C)C2)no1 ZINC000336006837 134049591 /nfs/dbraw/zinc/04/95/91/134049591.db2.gz QLHBYTWWIFGTOZ-PSASIEDQSA-N 1 2 221.304 2.337 20 0 BEADLO Cc1ccsc1C[N@@H+]1Cc2cnn(C)c2C1 ZINC000639323861 355717414 /nfs/dbraw/zinc/71/74/14/355717414.db2.gz FPEKXZUYHPCMMI-UHFFFAOYSA-N 1 2 233.340 2.306 20 0 BEADLO Cc1ccsc1C[N@H+]1Cc2cnn(C)c2C1 ZINC000639323861 355717417 /nfs/dbraw/zinc/71/74/17/355717417.db2.gz FPEKXZUYHPCMMI-UHFFFAOYSA-N 1 2 233.340 2.306 20 0 BEADLO c1csc(C[N@@H+]2CCOCC3(CCC3)C2)n1 ZINC000336003386 134048030 /nfs/dbraw/zinc/04/80/30/134048030.db2.gz ZRLCVYCXKVOPHP-UHFFFAOYSA-N 1 2 238.356 2.146 20 0 BEADLO c1csc(C[N@H+]2CCOCC3(CCC3)C2)n1 ZINC000336003386 134048031 /nfs/dbraw/zinc/04/80/31/134048031.db2.gz ZRLCVYCXKVOPHP-UHFFFAOYSA-N 1 2 238.356 2.146 20 0 BEADLO Cc1cc(N[C@@H]2C[C@H]3C[C@H]3C2)nc(C2CC2)[nH+]1 ZINC000425303052 191797153 /nfs/dbraw/zinc/79/71/53/191797153.db2.gz OFRDCCXGJPQAGV-ZSBIGDGJSA-N 1 2 229.327 2.295 20 0 BEADLO Cc1occc1C[N@@H+](C)Cc1ccnc(C)n1 ZINC000350684117 355740509 /nfs/dbraw/zinc/74/05/09/355740509.db2.gz WKTYOVZUSKJILF-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1occc1C[N@H+](C)Cc1ccnc(C)n1 ZINC000350684117 355740511 /nfs/dbraw/zinc/74/05/11/355740511.db2.gz WKTYOVZUSKJILF-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CO[C@H]1CC[C@H](Nc2cc[nH+]c3ccncc23)C1 ZINC000350700578 355743446 /nfs/dbraw/zinc/74/34/46/355743446.db2.gz KBKTUXZPIUNCHN-QWRGUYRKSA-N 1 2 243.310 2.031 20 0 BEADLO CCc1nocc1C[N@@H+]1C[C@H](C)O[C@@H](CC)C1 ZINC000350699733 355743778 /nfs/dbraw/zinc/74/37/78/355743778.db2.gz LQOGUJCWUNNCDN-JQWIXIFHSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1nocc1C[N@H+]1C[C@H](C)O[C@@H](CC)C1 ZINC000350699733 355743780 /nfs/dbraw/zinc/74/37/80/355743780.db2.gz LQOGUJCWUNNCDN-JQWIXIFHSA-N 1 2 238.331 2.236 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](c2ccccc2)[C@H](C)O)o1 ZINC000639333646 355763194 /nfs/dbraw/zinc/76/31/94/355763194.db2.gz YQONGVGGXXENAV-SMDDNHRTSA-N 1 2 246.310 2.195 20 0 BEADLO C/C=C/CNC(=O)Nc1ccc(C)[nH+]c1C ZINC000626432720 355766291 /nfs/dbraw/zinc/76/62/91/355766291.db2.gz AXXHXWKGCMZIOE-SNAWJCMRSA-N 1 2 219.288 2.396 20 0 BEADLO Cc1ccc(C[N@@H+]2CCc3n[nH]cc3C2)c(F)c1 ZINC000639344562 355781749 /nfs/dbraw/zinc/78/17/49/355781749.db2.gz XBYVVFWJPZFGFK-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1ccc(C[N@H+]2CCc3n[nH]cc3C2)c(F)c1 ZINC000639344562 355781752 /nfs/dbraw/zinc/78/17/52/355781752.db2.gz XBYVVFWJPZFGFK-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO CC1=C(C)C[C@H]([C@@H](C)[NH2+]Cc2c[nH]nn2)CC1 ZINC000639341239 355783039 /nfs/dbraw/zinc/78/30/39/355783039.db2.gz JLAWDXITKJBBBA-VXGBXAGGSA-N 1 2 234.347 2.419 20 0 BEADLO CC1=C(C)C[C@H]([C@@H](C)[NH2+]Cc2cn[nH]n2)CC1 ZINC000639341239 355783042 /nfs/dbraw/zinc/78/30/42/355783042.db2.gz JLAWDXITKJBBBA-VXGBXAGGSA-N 1 2 234.347 2.419 20 0 BEADLO COc1cccc(C)c1C[NH+]1CC2(C1)CCCO2 ZINC000639348103 355789196 /nfs/dbraw/zinc/78/91/96/355789196.db2.gz UITJJDVGCJDTER-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO FC(F)CC1C[NH+](Cc2cscn2)C1 ZINC000425366177 191828410 /nfs/dbraw/zinc/82/84/10/191828410.db2.gz OMZWUDQSEWBGGU-UHFFFAOYSA-N 1 2 218.272 2.230 20 0 BEADLO CN(C)c1c[nH+]cc(N[C@@H]2CCCOCC2)c1 ZINC000639363155 355818500 /nfs/dbraw/zinc/81/85/00/355818500.db2.gz AGNSQHHWQQSVEB-LLVKDONJSA-N 1 2 235.331 2.129 20 0 BEADLO CN(C)c1c[nH+]cc(N[C@H]2CO[C@H](C3CC3)C2)c1 ZINC000639362937 355818688 /nfs/dbraw/zinc/81/86/88/355818688.db2.gz MXOBPJBWSZZBGH-OCCSQVGLSA-N 1 2 247.342 2.127 20 0 BEADLO CN(C)c1c[nH+]cc(N[C@@H]2CO[C@H](C3CC3)C2)c1 ZINC000639362936 355818973 /nfs/dbraw/zinc/81/89/73/355818973.db2.gz MXOBPJBWSZZBGH-JSGCOSHPSA-N 1 2 247.342 2.127 20 0 BEADLO C[C@H](Nc1c[nH+]cc(N(C)C)c1)C1CCOCC1 ZINC000639364369 355833958 /nfs/dbraw/zinc/83/39/58/355833958.db2.gz HXHVZXMETDYDCE-NSHDSACASA-N 1 2 249.358 2.375 20 0 BEADLO Cc1ccc(C[NH2+]Cc2ncc[nH]2)c(F)c1 ZINC000639365101 355837567 /nfs/dbraw/zinc/83/75/67/355837567.db2.gz AVSOQBLCHNEOFY-UHFFFAOYSA-N 1 2 219.263 2.147 20 0 BEADLO CCC[C@H](CNc1c[nH+]cc(N(C)C)c1)OC ZINC000639365646 355838315 /nfs/dbraw/zinc/83/83/15/355838315.db2.gz QNBYXOFGOTVWRX-CYBMUJFWSA-N 1 2 237.347 2.375 20 0 BEADLO CC[C@H]1C[C@H](C)CN1c1cc(C)[nH+]cn1 ZINC000336039603 134060678 /nfs/dbraw/zinc/06/06/78/134060678.db2.gz HALZSQULZPNMEX-ONGXEEELSA-N 1 2 205.305 2.410 20 0 BEADLO C[C@H](Nc1c[nH+]cc(N(C)C)c1)[C@H]1CCCOC1 ZINC000639366502 355844622 /nfs/dbraw/zinc/84/46/22/355844622.db2.gz WTGSBPLWELUXQW-RYUDHWBXSA-N 1 2 249.358 2.375 20 0 BEADLO CC(C)c1cnc(CNCc2[nH]cc[nH+]2)s1 ZINC000639372470 355871123 /nfs/dbraw/zinc/87/11/23/355871123.db2.gz PXMJVXFWNYODBK-UHFFFAOYSA-N 1 2 236.344 2.279 20 0 BEADLO C[C@@H]1C[C@@H](Nc2c[nH+]cc(N(C)C)c2)CS1 ZINC000639363695 355829457 /nfs/dbraw/zinc/82/94/57/355829457.db2.gz FAJZNFJSUPVAFD-MWLCHTKSSA-N 1 2 237.372 2.454 20 0 BEADLO C[C@@H]1C[C@@H](Nc2c[nH+]cc(N(C)C)c2)CCO1 ZINC000639364056 355832449 /nfs/dbraw/zinc/83/24/49/355832449.db2.gz GMOMQIUXXZAXTD-MNOVXSKESA-N 1 2 235.331 2.127 20 0 BEADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]C2(C)COC2)o1 ZINC000639382450 355928717 /nfs/dbraw/zinc/92/87/17/355928717.db2.gz QELBIGGYTAKORK-MWLCHTKSSA-N 1 2 221.300 2.282 20 0 BEADLO Cc1cc(N(C)Cc2ccccc2)nc[nH+]1 ZINC000000265268 355893635 /nfs/dbraw/zinc/89/36/35/355893635.db2.gz JOSMWDWQQYLBIT-UHFFFAOYSA-N 1 2 213.284 2.421 20 0 BEADLO C[C@@H]1CN(c2cccc[nH+]2)C[C@H](C(F)(F)F)O1 ZINC000608754119 355975393 /nfs/dbraw/zinc/97/53/93/355975393.db2.gz WDAQDGPQHGGPCZ-RKDXNWHRSA-N 1 2 246.232 2.238 20 0 BEADLO c1cn(-c2ccc(NCc3cocn3)cc2)c[nH+]1 ZINC000351323875 355978835 /nfs/dbraw/zinc/97/88/35/355978835.db2.gz GJBUMHDNIOVBKN-UHFFFAOYSA-N 1 2 240.266 2.472 20 0 BEADLO COCc1cc(C[NH2+]Cc2ccc(C)o2)no1 ZINC000639387576 356002864 /nfs/dbraw/zinc/00/28/64/356002864.db2.gz SLUCOIYEQPKTOK-UHFFFAOYSA-N 1 2 236.271 2.012 20 0 BEADLO CCc1ccc(CNc2cc[nH+]cc2F)cn1 ZINC000351543863 356013125 /nfs/dbraw/zinc/01/31/25/356013125.db2.gz GZUHFHHFGHXWPY-UHFFFAOYSA-N 1 2 231.274 2.212 20 0 BEADLO Cc1cn[nH]c1C[NH+]1CC2(C1)CCCC2 ZINC000335911454 356125365 /nfs/dbraw/zinc/12/53/65/356125365.db2.gz BREZJHFUQHJJDS-UHFFFAOYSA-N 1 2 205.305 2.094 20 0 BEADLO COC(=O)C[NH2+][C@@]1(C)CCCc2ccccc21 ZINC000351716134 356067854 /nfs/dbraw/zinc/06/78/54/356067854.db2.gz BKDOZFXLLMGZLU-AWEZNQCLSA-N 1 2 233.311 2.001 20 0 BEADLO Cc1nc([C@@H](C)[N@H+](C)CCC2CC2)no1 ZINC000351714409 356068549 /nfs/dbraw/zinc/06/85/49/356068549.db2.gz DFXVWVXTRWURRQ-MRVPVSSYSA-N 1 2 209.293 2.171 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+](C)CCC2CC2)no1 ZINC000351714409 356068554 /nfs/dbraw/zinc/06/85/54/356068554.db2.gz DFXVWVXTRWURRQ-MRVPVSSYSA-N 1 2 209.293 2.171 20 0 BEADLO CCC[C@](C)(CC)C(=O)N[C@H]1Cc2c[nH+]cn2C1 ZINC000623259707 356090377 /nfs/dbraw/zinc/09/03/77/356090377.db2.gz IVFMIKQLARLZOC-FZMZJTMJSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1ncc(C[N@H+](C)CCC(F)(F)F)cn1 ZINC000351866080 356101539 /nfs/dbraw/zinc/10/15/39/356101539.db2.gz AGYIPNSWDDGCDE-UHFFFAOYSA-N 1 2 233.237 2.169 20 0 BEADLO Cc1ncc(C[N@@H+](C)CCC(F)(F)F)cn1 ZINC000351866080 356101544 /nfs/dbraw/zinc/10/15/44/356101544.db2.gz AGYIPNSWDDGCDE-UHFFFAOYSA-N 1 2 233.237 2.169 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1ccncc1C ZINC000336053792 134076151 /nfs/dbraw/zinc/07/61/51/134076151.db2.gz CYQUOONLTFJLRD-UHFFFAOYSA-N 1 2 241.294 2.022 20 0 BEADLO CC[C@H](C)CCNC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000617643208 356258796 /nfs/dbraw/zinc/25/87/96/356258796.db2.gz OUYWXXRNUQELDO-WDEREUQCSA-N 1 2 237.347 2.141 20 0 BEADLO CC[C@H](C)CCNC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000617643208 356258798 /nfs/dbraw/zinc/25/87/98/356258798.db2.gz OUYWXXRNUQELDO-WDEREUQCSA-N 1 2 237.347 2.141 20 0 BEADLO C[N@@H+](Cc1cscn1)C[C@H]1CC(C)(C)CO1 ZINC000639460254 356248048 /nfs/dbraw/zinc/24/80/48/356248048.db2.gz HIJQFFCEFZGOMC-LLVKDONJSA-N 1 2 240.372 2.390 20 0 BEADLO C[N@H+](Cc1cscn1)C[C@H]1CC(C)(C)CO1 ZINC000639460254 356248051 /nfs/dbraw/zinc/24/80/51/356248051.db2.gz HIJQFFCEFZGOMC-LLVKDONJSA-N 1 2 240.372 2.390 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCSC[C@@H]1C ZINC000639497581 356325780 /nfs/dbraw/zinc/32/57/80/356325780.db2.gz SSABVIUVHXKFDO-QMMMGPOBSA-N 1 2 209.305 2.469 20 0 BEADLO CCC(F)(F)C[N@H+]1CCSC[C@@H]1C ZINC000639497581 356325781 /nfs/dbraw/zinc/32/57/81/356325781.db2.gz SSABVIUVHXKFDO-QMMMGPOBSA-N 1 2 209.305 2.469 20 0 BEADLO Cc1cc(C)c(C[N@H+](C)Cc2cc[nH]n2)c(C)n1 ZINC000639486823 356302141 /nfs/dbraw/zinc/30/21/41/356302141.db2.gz ABNSSNMYCDPWOA-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO Cc1cc(C)c(C[N@@H+](C)Cc2cc[nH]n2)c(C)n1 ZINC000639486823 356302144 /nfs/dbraw/zinc/30/21/44/356302144.db2.gz ABNSSNMYCDPWOA-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO CC(=O)C[NH+]1CCN(c2cc(C)ccc2C)CC1 ZINC000639518182 356361289 /nfs/dbraw/zinc/36/12/89/356361289.db2.gz BBDBYWWARYQTJH-UHFFFAOYSA-N 1 2 246.354 2.014 20 0 BEADLO CC(C)[N@@H+](Cc1cc[nH]c(=O)c1)CC(F)F ZINC000639519868 356364760 /nfs/dbraw/zinc/36/47/60/356364760.db2.gz LIOWYLQMRXFTOT-UHFFFAOYSA-N 1 2 230.258 2.263 20 0 BEADLO CC(C)[N@H+](Cc1cc[nH]c(=O)c1)CC(F)F ZINC000639519868 356364765 /nfs/dbraw/zinc/36/47/65/356364765.db2.gz LIOWYLQMRXFTOT-UHFFFAOYSA-N 1 2 230.258 2.263 20 0 BEADLO CCc1nc(C)c(C[N@@H+]2CCOCC2(C)C)o1 ZINC000336516443 356384248 /nfs/dbraw/zinc/38/42/48/356384248.db2.gz SCNLAVRAIZCRTA-UHFFFAOYSA-N 1 2 238.331 2.156 20 0 BEADLO CCc1nc(C)c(C[N@H+]2CCOCC2(C)C)o1 ZINC000336516443 356384251 /nfs/dbraw/zinc/38/42/51/356384251.db2.gz SCNLAVRAIZCRTA-UHFFFAOYSA-N 1 2 238.331 2.156 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000042229773 356414680 /nfs/dbraw/zinc/41/46/80/356414680.db2.gz GGMDXINXOTWOCY-MFKMUULPSA-N 1 2 233.311 2.289 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCC[C@H]([C@@H](C)O)C1 ZINC000639543732 356403037 /nfs/dbraw/zinc/40/30/37/356403037.db2.gz OCMSLYHMDJVXFQ-ZJUUUORDSA-N 1 2 221.291 2.125 20 0 BEADLO CCC(F)(F)C[N@H+]1CCC[C@H]([C@@H](C)O)C1 ZINC000639543732 356403041 /nfs/dbraw/zinc/40/30/41/356403041.db2.gz OCMSLYHMDJVXFQ-ZJUUUORDSA-N 1 2 221.291 2.125 20 0 BEADLO C[N@H+](Cc1cncs1)Cc1cccc(O)c1 ZINC000580395741 356481330 /nfs/dbraw/zinc/48/13/30/356481330.db2.gz CXGHOQPJAALJCG-UHFFFAOYSA-N 1 2 234.324 2.481 20 0 BEADLO C[N@@H+](Cc1cncs1)Cc1cccc(O)c1 ZINC000580395741 356481333 /nfs/dbraw/zinc/48/13/33/356481333.db2.gz CXGHOQPJAALJCG-UHFFFAOYSA-N 1 2 234.324 2.481 20 0 BEADLO CC[C@H]1CN(c2cc[nH+]c(C)n2)C[C@H](CC)O1 ZINC000420640608 192253487 /nfs/dbraw/zinc/25/34/87/192253487.db2.gz YYBONEDDQLJEKB-RYUDHWBXSA-N 1 2 235.331 2.179 20 0 BEADLO CCC(F)(F)C[N@H+](C)C[C@@H]1CCC[C@@H]1O ZINC000639567891 356490712 /nfs/dbraw/zinc/49/07/12/356490712.db2.gz QLRHXHYVDNUZHL-UWVGGRQHSA-N 1 2 221.291 2.125 20 0 BEADLO CCC(F)(F)C[N@@H+](C)C[C@@H]1CCC[C@@H]1O ZINC000639567891 356490715 /nfs/dbraw/zinc/49/07/15/356490715.db2.gz QLRHXHYVDNUZHL-UWVGGRQHSA-N 1 2 221.291 2.125 20 0 BEADLO CCN(CC)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000420695125 192257144 /nfs/dbraw/zinc/25/71/44/192257144.db2.gz DFXIYSCTWMBDCM-UHFFFAOYSA-N 1 2 235.331 2.250 20 0 BEADLO CC(=O)C[NH2+][C@H](c1nc(C)cs1)C1CC1 ZINC000639568589 356494393 /nfs/dbraw/zinc/49/43/93/356494393.db2.gz BSTDNLXHXLASSO-JTQLQIEISA-N 1 2 224.329 2.081 20 0 BEADLO CC1(C)CO[C@H](C[N@@H+]2CCC(F)(F)C2)C1 ZINC000639570854 356495344 /nfs/dbraw/zinc/49/53/44/356495344.db2.gz REKOGSDHJNIOHH-VIFPVBQESA-N 1 2 219.275 2.143 20 0 BEADLO CC1(C)CO[C@H](C[N@H+]2CCC(F)(F)C2)C1 ZINC000639570854 356495347 /nfs/dbraw/zinc/49/53/47/356495347.db2.gz REKOGSDHJNIOHH-VIFPVBQESA-N 1 2 219.275 2.143 20 0 BEADLO CC[C@H]([NH2+]CC(C)=O)c1nc(C)cs1 ZINC000639578955 356500024 /nfs/dbraw/zinc/50/00/24/356500024.db2.gz VOQAOCXRADLYQC-VIFPVBQESA-N 1 2 212.318 2.081 20 0 BEADLO C[C@H]1CCCN(C(=O)CCCn2cc[nH+]c2)CC1 ZINC000623290966 356504731 /nfs/dbraw/zinc/50/47/31/356504731.db2.gz LGPKBYALSCOBNT-ZDUSSCGKSA-N 1 2 249.358 2.312 20 0 BEADLO CCC(F)(F)C[NH2+]C(C)(C)c1cnn(C)c1 ZINC000639584138 356507039 /nfs/dbraw/zinc/50/70/39/356507039.db2.gz JYGRERWZYQYQGN-UHFFFAOYSA-N 1 2 231.290 2.290 20 0 BEADLO Cn1c[nH+]cc1Cc1noc(C(C)(C)C2CC2)n1 ZINC000350203399 366261619 /nfs/dbraw/zinc/26/16/19/366261619.db2.gz HHZQENYFJRVBMR-UHFFFAOYSA-N 1 2 246.314 2.082 20 0 BEADLO CC[C@H]1C[NH+](Cc2cnc(C)cn2)C[C@H](CC)O1 ZINC000420955248 192278530 /nfs/dbraw/zinc/27/85/30/192278530.db2.gz LDXMILUVWMEPMW-KBPBESRZSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nccc(C)n2)C[C@H](CC)O1 ZINC000420958433 192280294 /nfs/dbraw/zinc/28/02/94/192280294.db2.gz PELQMSSNQGPVFM-BETUJISGSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nccc(C)n2)C[C@H](CC)O1 ZINC000420958433 192280296 /nfs/dbraw/zinc/28/02/96/192280296.db2.gz PELQMSSNQGPVFM-BETUJISGSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[NH+](Cc2ccnc(C)n2)C[C@@H](CC)O1 ZINC000420959699 192280915 /nfs/dbraw/zinc/28/09/15/192280915.db2.gz QPLWAMJUAQYQMR-ZIAGYGMSSA-N 1 2 249.358 2.174 20 0 BEADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccc(CO)o1 ZINC000179566899 366271906 /nfs/dbraw/zinc/27/19/06/366271906.db2.gz OYHACRUZTDVDIZ-LLVKDONJSA-N 1 2 246.310 2.150 20 0 BEADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1ccc(CO)o1 ZINC000179566899 366271909 /nfs/dbraw/zinc/27/19/09/366271909.db2.gz OYHACRUZTDVDIZ-LLVKDONJSA-N 1 2 246.310 2.150 20 0 BEADLO CSc1ccccc1C[N@H+](C)CC(C)=O ZINC000639620067 356540277 /nfs/dbraw/zinc/54/02/77/356540277.db2.gz BINFRXYVSBWDOB-UHFFFAOYSA-N 1 2 223.341 2.429 20 0 BEADLO CSc1ccccc1C[N@@H+](C)CC(C)=O ZINC000639620067 356540278 /nfs/dbraw/zinc/54/02/78/356540278.db2.gz BINFRXYVSBWDOB-UHFFFAOYSA-N 1 2 223.341 2.429 20 0 BEADLO CC(C)n1cc(C[N@@H+]2C[C@H](C)OC[C@H]2C)cn1 ZINC000179518990 366265925 /nfs/dbraw/zinc/26/59/25/366265925.db2.gz QKEUDTCHGQEEFI-NEPJUHHUSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)n1cc(C[N@H+]2C[C@H](C)OC[C@H]2C)cn1 ZINC000179518990 366265932 /nfs/dbraw/zinc/26/59/32/366265932.db2.gz QKEUDTCHGQEEFI-NEPJUHHUSA-N 1 2 237.347 2.073 20 0 BEADLO CCC(F)(F)C[N@@H+]1CC[C@@H](n2cc(C)cn2)C1 ZINC000639648420 356555262 /nfs/dbraw/zinc/55/52/62/356555262.db2.gz IKZHMVSTFSJXME-LLVKDONJSA-N 1 2 243.301 2.484 20 0 BEADLO CCC(F)(F)C[N@H+]1CC[C@@H](n2cc(C)cn2)C1 ZINC000639648420 356555266 /nfs/dbraw/zinc/55/52/66/356555266.db2.gz IKZHMVSTFSJXME-LLVKDONJSA-N 1 2 243.301 2.484 20 0 BEADLO CC[C@@H](C)CCC(=O)N[C@@H]1CCn2c[nH+]cc2C1 ZINC000623299831 356559545 /nfs/dbraw/zinc/55/95/45/356559545.db2.gz DISBQNLPTOQKLB-VXGBXAGGSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1cccc(C[N@@H+]2CCC=C(F)C2)n1 ZINC000336201233 134130246 /nfs/dbraw/zinc/13/02/46/134130246.db2.gz ACSHTZNSEKFXLR-UHFFFAOYSA-N 1 2 206.264 2.449 20 0 BEADLO Cc1cccc(C[N@H+]2CCC=C(F)C2)n1 ZINC000336201233 134130247 /nfs/dbraw/zinc/13/02/47/134130247.db2.gz ACSHTZNSEKFXLR-UHFFFAOYSA-N 1 2 206.264 2.449 20 0 BEADLO CCC[C@@H](C)CC(=O)N[C@@H]1CCn2c[nH+]cc2C1 ZINC000623304030 356594724 /nfs/dbraw/zinc/59/47/24/356594724.db2.gz PMWCMDTZLMMZSJ-VXGBXAGGSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1cc(N[C@@H]2CCCC2(F)F)nc[nH+]1 ZINC000379926042 538462721 /nfs/dbraw/zinc/46/27/21/538462721.db2.gz LICJZTSQJVBWNP-MRVPVSSYSA-N 1 2 213.231 2.385 20 0 BEADLO CCC(F)(F)C[NH+]1CCC([C@@H](C)CO)CC1 ZINC000639732499 356626112 /nfs/dbraw/zinc/62/61/12/356626112.db2.gz RRBCDNIWXZNFCO-JTQLQIEISA-N 1 2 235.318 2.372 20 0 BEADLO CN(C[C@@H]1CC1(C)C)c1cc(CO)cc[nH+]1 ZINC000630094356 363536592 /nfs/dbraw/zinc/53/65/92/363536592.db2.gz GMPDVQVMEZTVNB-NSHDSACASA-N 1 2 220.316 2.056 20 0 BEADLO CC[N@H+](C[C@@H]1CCCO1)[C@H](C)c1csnn1 ZINC000450322770 202127442 /nfs/dbraw/zinc/12/74/42/202127442.db2.gz BLRNTJPUWYPUBR-ZJUUUORDSA-N 1 2 241.360 2.100 20 0 BEADLO CC[N@@H+](C[C@@H]1CCCO1)[C@H](C)c1csnn1 ZINC000450322770 202127444 /nfs/dbraw/zinc/12/74/44/202127444.db2.gz BLRNTJPUWYPUBR-ZJUUUORDSA-N 1 2 241.360 2.100 20 0 BEADLO CCC[C@H](C)[C@@H](CO)Nc1cccc[nH+]1 ZINC000578136527 366311356 /nfs/dbraw/zinc/31/13/56/366311356.db2.gz RJEUPSXJXXMCQC-WDEREUQCSA-N 1 2 208.305 2.291 20 0 BEADLO C[C@@H](Oc1ccccc1)c1noc(C[NH+](C)C)n1 ZINC000350643750 366314373 /nfs/dbraw/zinc/31/43/73/366314373.db2.gz DCKIAENETDNEQA-SNVBAGLBSA-N 1 2 247.298 2.271 20 0 BEADLO C[C@H](N[C@@H](C)C(C)(F)F)c1[nH+]ccn1C ZINC000389458876 356678790 /nfs/dbraw/zinc/67/87/90/356678790.db2.gz DBIQZQRVFCZGFG-YUMQZZPRSA-N 1 2 217.263 2.114 20 0 BEADLO C[C@H](c1nccc(N)n1)[N@H+](C)Cc1cccs1 ZINC000578140748 366319187 /nfs/dbraw/zinc/31/91/87/366319187.db2.gz SJBPSAXQKDQTDH-SECBINFHSA-N 1 2 248.355 2.144 20 0 BEADLO C[C@H](c1nccc(N)n1)[N@@H+](C)Cc1cccs1 ZINC000578140748 366319191 /nfs/dbraw/zinc/31/91/91/366319191.db2.gz SJBPSAXQKDQTDH-SECBINFHSA-N 1 2 248.355 2.144 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)C(C)(F)F)c1cn[nH]c1 ZINC000389464924 356679265 /nfs/dbraw/zinc/67/92/65/356679265.db2.gz JPAYFRSDKUJWAT-RQJHMYQMSA-N 1 2 203.236 2.104 20 0 BEADLO C[C@H]([NH2+]Cc1cncc(F)c1)C(C)(F)F ZINC000389495512 356694274 /nfs/dbraw/zinc/69/42/74/356694274.db2.gz XZEFLMFMNPPXOW-ZETCQYMHSA-N 1 2 218.222 2.354 20 0 BEADLO C[C@@H]([NH2+]Cc1cncc(F)c1)C(C)(F)F ZINC000389495509 356694645 /nfs/dbraw/zinc/69/46/45/356694645.db2.gz XZEFLMFMNPPXOW-SSDOTTSWSA-N 1 2 218.222 2.354 20 0 BEADLO Cn1c[nH+]cc1CC(=O)N[C@H]1CCCCC1(C)C ZINC000582259993 356695132 /nfs/dbraw/zinc/69/51/32/356695132.db2.gz UAOKZXVUQNVPBI-LBPRGKRZSA-N 1 2 249.358 2.048 20 0 BEADLO CCn1cc(C[NH2+][C@@H](C)C(C)(F)F)cn1 ZINC000389475592 356684906 /nfs/dbraw/zinc/68/49/06/356684906.db2.gz YVJBQRLWCOYMLY-QMMMGPOBSA-N 1 2 217.263 2.036 20 0 BEADLO CCc1cnc(C[N@@H+]2CCC[C@H]2c2cn[nH]c2)o1 ZINC000639778302 356723542 /nfs/dbraw/zinc/72/35/42/356723542.db2.gz LEFWKLZZUUISJN-LBPRGKRZSA-N 1 2 246.314 2.297 20 0 BEADLO CCc1cnc(C[N@H+]2CCC[C@H]2c2cn[nH]c2)o1 ZINC000639778302 356723545 /nfs/dbraw/zinc/72/35/45/356723545.db2.gz LEFWKLZZUUISJN-LBPRGKRZSA-N 1 2 246.314 2.297 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@H]2c2cn[nH]c2)no1 ZINC000639776071 356717011 /nfs/dbraw/zinc/71/70/11/356717011.db2.gz JWUIYPGGNJWCSU-LBPRGKRZSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@H]2c2cn[nH]c2)no1 ZINC000639776071 356717012 /nfs/dbraw/zinc/71/70/12/356717012.db2.gz JWUIYPGGNJWCSU-LBPRGKRZSA-N 1 2 232.287 2.043 20 0 BEADLO CCc1nnc(C[N@H+](C)Cc2cccc(C)c2)[nH]1 ZINC000354843184 356745294 /nfs/dbraw/zinc/74/52/94/356745294.db2.gz VFXUZCHHYJNXRJ-UHFFFAOYSA-N 1 2 244.342 2.308 20 0 BEADLO CCc1nnc(C[N@@H+](C)Cc2cccc(C)c2)[nH]1 ZINC000354843184 356745295 /nfs/dbraw/zinc/74/52/95/356745295.db2.gz VFXUZCHHYJNXRJ-UHFFFAOYSA-N 1 2 244.342 2.308 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2C[C@H]3C[C@H]3C2)c(C)c[nH+]1 ZINC000578188366 366373431 /nfs/dbraw/zinc/37/34/31/366373431.db2.gz PJWOMXAYRIGTPP-ZSBIGDGJSA-N 1 2 245.326 2.040 20 0 BEADLO CC[N@H+](CC(=O)OC)[C@H](C)c1ccc(F)cc1 ZINC000054340930 363567171 /nfs/dbraw/zinc/56/71/71/363567171.db2.gz UYFNLSGCCSJEKV-SNVBAGLBSA-N 1 2 239.290 2.382 20 0 BEADLO CC[N@@H+](CC(=O)OC)[C@H](C)c1ccc(F)cc1 ZINC000054340930 363567177 /nfs/dbraw/zinc/56/71/77/363567177.db2.gz UYFNLSGCCSJEKV-SNVBAGLBSA-N 1 2 239.290 2.382 20 0 BEADLO CO[C@H]1C[N@H+](Cc2cc(C)sc2C)CCO1 ZINC000639832220 356817029 /nfs/dbraw/zinc/81/70/29/356817029.db2.gz DKDFSWFJGDNFBL-GFCCVEGCSA-N 1 2 241.356 2.170 20 0 BEADLO CO[C@H]1C[N@@H+](Cc2cc(C)sc2C)CCO1 ZINC000639832220 356817032 /nfs/dbraw/zinc/81/70/32/356817032.db2.gz DKDFSWFJGDNFBL-GFCCVEGCSA-N 1 2 241.356 2.170 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1[C@@H](C)CCC[C@@H]1C ZINC000654713901 538697144 /nfs/dbraw/zinc/69/71/44/538697144.db2.gz XKCWYFJMEHMHSJ-WOPDTQHZSA-N 1 2 249.358 2.378 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1[C@@H](C)CCC[C@@H]1C ZINC000654713901 538697154 /nfs/dbraw/zinc/69/71/54/538697154.db2.gz XKCWYFJMEHMHSJ-WOPDTQHZSA-N 1 2 249.358 2.378 20 0 BEADLO C[N@H+](Cc1ccns1)Cc1cncc(F)c1 ZINC000639809432 356783775 /nfs/dbraw/zinc/78/37/75/356783775.db2.gz TUVQTEJUTAFNTO-UHFFFAOYSA-N 1 2 237.303 2.309 20 0 BEADLO C[N@@H+](Cc1ccns1)Cc1cncc(F)c1 ZINC000639809432 356783780 /nfs/dbraw/zinc/78/37/80/356783780.db2.gz TUVQTEJUTAFNTO-UHFFFAOYSA-N 1 2 237.303 2.309 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CC(C(C)(C)C)C1 ZINC000655140927 538729114 /nfs/dbraw/zinc/72/91/14/538729114.db2.gz AJQIPPNQQXYVIX-SNVBAGLBSA-N 1 2 249.358 2.093 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CC(C(C)(C)C)C1 ZINC000655140927 538729121 /nfs/dbraw/zinc/72/91/21/538729121.db2.gz AJQIPPNQQXYVIX-SNVBAGLBSA-N 1 2 249.358 2.093 20 0 BEADLO CC[N@H+](Cc1nc(CCC2CC2)no1)C1CC1 ZINC000357621065 356839214 /nfs/dbraw/zinc/83/92/14/356839214.db2.gz JSYWFQDOHWCDCE-UHFFFAOYSA-N 1 2 235.331 2.397 20 0 BEADLO CC[N@@H+](Cc1nc(CCC2CC2)no1)C1CC1 ZINC000357621065 356839216 /nfs/dbraw/zinc/83/92/16/356839216.db2.gz JSYWFQDOHWCDCE-UHFFFAOYSA-N 1 2 235.331 2.397 20 0 BEADLO CC(C)CCC1CC[NH+](Cc2cnn[nH]2)CC1 ZINC000450492874 202185913 /nfs/dbraw/zinc/18/59/13/202185913.db2.gz XNVXMVQFBQWUQJ-UHFFFAOYSA-N 1 2 236.363 2.453 20 0 BEADLO CC(C)CCC1CC[NH+](Cc2c[nH]nn2)CC1 ZINC000450492874 202185916 /nfs/dbraw/zinc/18/59/16/202185916.db2.gz XNVXMVQFBQWUQJ-UHFFFAOYSA-N 1 2 236.363 2.453 20 0 BEADLO CC(C)CCC1CC[NH+](Cc2cn[nH]n2)CC1 ZINC000450492874 202185919 /nfs/dbraw/zinc/18/59/19/202185919.db2.gz XNVXMVQFBQWUQJ-UHFFFAOYSA-N 1 2 236.363 2.453 20 0 BEADLO COc1ccc(N[C@@H]2CCCSC2)[nH+]c1 ZINC000228807995 491105029 /nfs/dbraw/zinc/10/50/29/491105029.db2.gz ISCMQZUVYNIADC-SECBINFHSA-N 1 2 224.329 2.398 20 0 BEADLO CC[N@H+](Cc1ncc(Cl)s1)[C@H]1CCOC1 ZINC000361252113 356922940 /nfs/dbraw/zinc/92/29/40/356922940.db2.gz PPBWUOHITGQASP-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO CC[N@@H+](Cc1ncc(Cl)s1)[C@H]1CCOC1 ZINC000361252113 356922943 /nfs/dbraw/zinc/92/29/43/356922943.db2.gz PPBWUOHITGQASP-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO CC[N@@H+](Cc1nnc(C(C)C)o1)C[C@H](C)OC ZINC000361568420 356933746 /nfs/dbraw/zinc/93/37/46/356933746.db2.gz ZAQLLFFRUJAZDU-JTQLQIEISA-N 1 2 241.335 2.050 20 0 BEADLO CC[N@H+](Cc1nnc(C(C)C)o1)C[C@H](C)OC ZINC000361568420 356933750 /nfs/dbraw/zinc/93/37/50/356933750.db2.gz ZAQLLFFRUJAZDU-JTQLQIEISA-N 1 2 241.335 2.050 20 0 BEADLO C[C@@H]([NH2+]Cc1cscn1)c1cccnc1 ZINC000040421129 356938460 /nfs/dbraw/zinc/93/84/60/356938460.db2.gz JHTSGZBJLUEFPA-SECBINFHSA-N 1 2 219.313 2.389 20 0 BEADLO CC(C)C[N@@H+]1CC(=O)N[C@@]12CCCC(C)(C)C2 ZINC000362892498 356950635 /nfs/dbraw/zinc/95/06/35/356950635.db2.gz LKQCYZWRGIFCAK-AWEZNQCLSA-N 1 2 238.375 2.371 20 0 BEADLO CC(C)C[N@H+]1CC(=O)N[C@@]12CCCC(C)(C)C2 ZINC000362892498 356950639 /nfs/dbraw/zinc/95/06/39/356950639.db2.gz LKQCYZWRGIFCAK-AWEZNQCLSA-N 1 2 238.375 2.371 20 0 BEADLO CCc1nc(C[NH+]2CCC3(CCC3)CC2)no1 ZINC000367604510 356956932 /nfs/dbraw/zinc/95/69/32/356956932.db2.gz ULIGEKKDQXSXBK-UHFFFAOYSA-N 1 2 235.331 2.398 20 0 BEADLO COc1cc(CNc2c[nH]c[nH+]2)ccc1C ZINC000390559028 357104257 /nfs/dbraw/zinc/10/42/57/357104257.db2.gz RLFWZFMHXFRFLX-UHFFFAOYSA-N 1 2 217.272 2.339 20 0 BEADLO C[C@@H]1CCC[C@H](CC(=O)NCc2c[nH+]cn2C)C1 ZINC000355258157 538790679 /nfs/dbraw/zinc/79/06/79/538790679.db2.gz RXMGCEMHUYIUMY-NEPJUHHUSA-N 1 2 249.358 2.253 20 0 BEADLO COC1(C[C@@H](C)Nc2c[nH]c[nH+]2)CCC1 ZINC000389975292 357076611 /nfs/dbraw/zinc/07/66/11/357076611.db2.gz FBGXZIIXMBXAPB-SECBINFHSA-N 1 2 209.293 2.169 20 0 BEADLO C[C@@H]([NH2+]Cc1cc[nH]n1)c1ccc(Cl)cn1 ZINC000390413496 357092361 /nfs/dbraw/zinc/09/23/61/357092361.db2.gz GBNKVMZOECSFED-MRVPVSSYSA-N 1 2 236.706 2.309 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccncc2C)s1 ZINC000391874598 357135325 /nfs/dbraw/zinc/13/53/25/357135325.db2.gz NRNOQDPNCWOESS-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO C(c1noc(C[NH+](C2CC2)C2CC2)n1)C1CC1 ZINC000639892071 357218146 /nfs/dbraw/zinc/21/81/46/357218146.db2.gz FPNQABIMDPTVAJ-UHFFFAOYSA-N 1 2 233.315 2.149 20 0 BEADLO Cn1cccc1C[N@@H+]1Cc2ccc(O)cc2C1 ZINC000628418939 357238677 /nfs/dbraw/zinc/23/86/77/357238677.db2.gz FOLYRZQJYQOEBU-UHFFFAOYSA-N 1 2 228.295 2.247 20 0 BEADLO Cn1cccc1C[N@H+]1Cc2ccc(O)cc2C1 ZINC000628418939 357238680 /nfs/dbraw/zinc/23/86/80/357238680.db2.gz FOLYRZQJYQOEBU-UHFFFAOYSA-N 1 2 228.295 2.247 20 0 BEADLO CCc1nc(C[N@@H+]2CC[C@@H](C)[C@H](C)C2)no1 ZINC000122473756 357177976 /nfs/dbraw/zinc/17/79/76/357177976.db2.gz VZXIZAANUVZYTJ-NXEZZACHSA-N 1 2 223.320 2.110 20 0 BEADLO CCc1nc(C[N@H+]2CC[C@@H](C)[C@H](C)C2)no1 ZINC000122473756 357177981 /nfs/dbraw/zinc/17/79/81/357177981.db2.gz VZXIZAANUVZYTJ-NXEZZACHSA-N 1 2 223.320 2.110 20 0 BEADLO C[C@@H]1C[NH+](Cc2cocn2)C[C@@H](C)C1(F)F ZINC000628392293 357188436 /nfs/dbraw/zinc/18/84/36/357188436.db2.gz NPHGQTCGUCXDKD-RKDXNWHRSA-N 1 2 230.258 2.398 20 0 BEADLO C[C@@H]1C[C@H](C)[C@H](C)N(C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000357146626 538825673 /nfs/dbraw/zinc/82/56/73/538825673.db2.gz ZBZQUQNLBWYAID-WOPDTQHZSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H]1C[C@H](C)[C@H](C)N(C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000357146626 538825680 /nfs/dbraw/zinc/82/56/80/538825680.db2.gz ZBZQUQNLBWYAID-WOPDTQHZSA-N 1 2 249.358 2.235 20 0 BEADLO O=C(Cn1cc[nH+]c1)Nc1ccsc1Cl ZINC000582469092 357305869 /nfs/dbraw/zinc/30/58/69/357305869.db2.gz AHFXHDOTYMTLRE-UHFFFAOYSA-N 1 2 241.703 2.237 20 0 BEADLO Fc1ccc(C[NH+]2CC3(C2)CCCO3)cc1 ZINC000628426942 357257765 /nfs/dbraw/zinc/25/77/65/357257765.db2.gz WQELOHFZUABGSN-UHFFFAOYSA-N 1 2 221.275 2.191 20 0 BEADLO CC(C)[C@H](CO)CNc1ccc2ccccc2[nH+]1 ZINC000394066024 357325482 /nfs/dbraw/zinc/32/54/82/357325482.db2.gz FXZGPSRHSCDYQF-ZDUSSCGKSA-N 1 2 244.338 2.333 20 0 BEADLO CCOc1cc(C)ccc1[NH2+]C[C@@H](C)CO ZINC000157967382 538844291 /nfs/dbraw/zinc/84/42/91/538844291.db2.gz WQWQLODPQNFEKZ-LLVKDONJSA-N 1 2 223.316 2.434 20 0 BEADLO CCN(Cc1ccoc1)Cc1[nH+]ccn1C ZINC000102408019 357388129 /nfs/dbraw/zinc/38/81/29/357388129.db2.gz WGGBPNKSTYSSCE-UHFFFAOYSA-N 1 2 219.288 2.035 20 0 BEADLO Cc1nc(N2CCC[C@@H]2[C@H]2CCCOC2)cc[nH+]1 ZINC000582902734 357425983 /nfs/dbraw/zinc/42/59/83/357425983.db2.gz KWDNRIPBQMULBE-QWHCGFSZSA-N 1 2 247.342 2.180 20 0 BEADLO Cc1ncncc1[C@H](C)[NH2+][C@@H](C)C(C)(F)F ZINC000582914280 357435676 /nfs/dbraw/zinc/43/56/76/357435676.db2.gz FJDWOKCNWNCCKX-IUCAKERBSA-N 1 2 229.274 2.479 20 0 BEADLO c1c[nH]c([C@H]([NH2+][C@@H]2CC23CC3)c2cccnc2)n1 ZINC000583019211 357450001 /nfs/dbraw/zinc/45/00/01/357450001.db2.gz XHSFBSPYGPWQTC-VXGBXAGGSA-N 1 2 240.310 2.036 20 0 BEADLO CCCCN(C)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000583028706 357463258 /nfs/dbraw/zinc/46/32/58/357463258.db2.gz SPFUBZSXSSHBOG-NSHDSACASA-N 1 2 223.320 2.093 20 0 BEADLO CCCCN(C)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000583028705 357463454 /nfs/dbraw/zinc/46/34/54/357463454.db2.gz SPFUBZSXSSHBOG-LLVKDONJSA-N 1 2 223.320 2.093 20 0 BEADLO C[C@@H](CC(=O)NC[C@@H]1CC=CCC1)n1cc[nH+]c1 ZINC000583028204 357463720 /nfs/dbraw/zinc/46/37/20/357463720.db2.gz KIWBJESBMUZRBX-QWHCGFSZSA-N 1 2 247.342 2.307 20 0 BEADLO Cc1csc(C[NH2+]Cc2cncc(F)c2)n1 ZINC000230938590 357581355 /nfs/dbraw/zinc/58/13/55/357581355.db2.gz LMFUEYOIKLLHTD-UHFFFAOYSA-N 1 2 237.303 2.275 20 0 BEADLO CCCC[N@H+](C)Cc1nnc(OCC)s1 ZINC000063481888 357659344 /nfs/dbraw/zinc/65/93/44/357659344.db2.gz DCKBLYZMMLDHRR-UHFFFAOYSA-N 1 2 229.349 2.169 20 0 BEADLO CCCC[N@@H+](C)Cc1nnc(OCC)s1 ZINC000063481888 357659349 /nfs/dbraw/zinc/65/93/49/357659349.db2.gz DCKBLYZMMLDHRR-UHFFFAOYSA-N 1 2 229.349 2.169 20 0 BEADLO CCS[C@@H]1CCC[C@@H]1[NH2+][C@@H](CC)C(=O)OC ZINC000234002908 357768493 /nfs/dbraw/zinc/76/84/93/357768493.db2.gz WFFSXXJKKVFDJS-GARJFASQSA-N 1 2 245.388 2.202 20 0 BEADLO C[C@H](c1ccncc1)[N@H+](C)Cc1ncccn1 ZINC000192135325 357824498 /nfs/dbraw/zinc/82/44/98/357824498.db2.gz DAUGOPNFOXINHE-LLVKDONJSA-N 1 2 228.299 2.065 20 0 BEADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1ncccn1 ZINC000192135325 357824500 /nfs/dbraw/zinc/82/45/00/357824500.db2.gz DAUGOPNFOXINHE-LLVKDONJSA-N 1 2 228.299 2.065 20 0 BEADLO Cc1ncc(C[NH2+]Cc2ccncc2Cl)o1 ZINC000397920398 357806471 /nfs/dbraw/zinc/80/64/71/357806471.db2.gz NAHPLHBOSCZZOX-UHFFFAOYSA-N 1 2 237.690 2.321 20 0 BEADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1ncccn1 ZINC000192103753 357823014 /nfs/dbraw/zinc/82/30/14/357823014.db2.gz GEBJUWZDJBNBQZ-NSHDSACASA-N 1 2 243.310 2.375 20 0 BEADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1ncccn1 ZINC000192103753 357823016 /nfs/dbraw/zinc/82/30/16/357823016.db2.gz GEBJUWZDJBNBQZ-NSHDSACASA-N 1 2 243.310 2.375 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](Cc1ccco1)C1CCC1 ZINC000191653172 357781325 /nfs/dbraw/zinc/78/13/25/357781325.db2.gz LYADLWOEMDCAEW-SNVBAGLBSA-N 1 2 237.299 2.196 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](Cc1ccco1)C1CCC1 ZINC000191653172 357781331 /nfs/dbraw/zinc/78/13/31/357781331.db2.gz LYADLWOEMDCAEW-SNVBAGLBSA-N 1 2 237.299 2.196 20 0 BEADLO C[C@H]([NH2+]Cc1nc(C2CC2)no1)c1cccnc1 ZINC000193110005 357860992 /nfs/dbraw/zinc/86/09/92/357860992.db2.gz IHWOLRYXAGOSQS-VIFPVBQESA-N 1 2 244.298 2.193 20 0 BEADLO COc1cccc2c1cc[nH+]c2NC[C@@H](C)CO ZINC000234912744 357836716 /nfs/dbraw/zinc/83/67/16/357836716.db2.gz DQLISKUONMZJQY-SNVBAGLBSA-N 1 2 246.310 2.284 20 0 BEADLO COc1cccc([C@@H](C)[NH2+]Cc2nnc(C)o2)c1 ZINC000234978017 357837472 /nfs/dbraw/zinc/83/74/72/357837472.db2.gz VAFKNPIWXWUSMM-SECBINFHSA-N 1 2 247.298 2.237 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1CC[C@H](C)O1 ZINC000398118542 357843064 /nfs/dbraw/zinc/84/30/64/357843064.db2.gz VVTWNPAKCXEFGD-VHSXEESVSA-N 1 2 222.288 2.070 20 0 BEADLO Cc1cnccc1C[NH2+][C@H](C)c1csnn1 ZINC000398291398 357882731 /nfs/dbraw/zinc/88/27/31/357882731.db2.gz IKPZWNMEJFXLOT-SECBINFHSA-N 1 2 234.328 2.092 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC000020453952 357933844 /nfs/dbraw/zinc/93/38/44/357933844.db2.gz QPOYPHZVTUMAPC-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000020453952 357933846 /nfs/dbraw/zinc/93/38/46/357933846.db2.gz QPOYPHZVTUMAPC-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CC12CCCC2)c1[nH]cc[nH+]1 ZINC000583762799 357938069 /nfs/dbraw/zinc/93/80/69/357938069.db2.gz GVFGGKXAHJTZGX-NXEZZACHSA-N 1 2 233.315 2.167 20 0 BEADLO COc1c(C)[nH+]c(C2CC2)nc1NC[C@@H]1C[C@@H]1C ZINC000583763432 357938273 /nfs/dbraw/zinc/93/82/73/357938273.db2.gz YRWROOZAKGVQIS-KWQFWETISA-N 1 2 247.342 2.161 20 0 BEADLO Fc1ccc(C=CC[NH2+]Cc2ccn[nH]2)cc1F ZINC000584450342 357962956 /nfs/dbraw/zinc/96/29/56/357962956.db2.gz ZVPKJVUBWZKUEZ-UPHRSURJSA-N 1 2 249.264 2.491 20 0 BEADLO Cc1cnc([C@H](C)[N@H+](C)Cc2c[nH]nc2C)o1 ZINC000639971227 358021929 /nfs/dbraw/zinc/02/19/29/358021929.db2.gz OQJVZJVIQJYJQS-JTQLQIEISA-N 1 2 234.303 2.208 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+](C)Cc2c[nH]nc2C)o1 ZINC000639971227 358021930 /nfs/dbraw/zinc/02/19/30/358021930.db2.gz OQJVZJVIQJYJQS-JTQLQIEISA-N 1 2 234.303 2.208 20 0 BEADLO CNC(=O)C[N@H+](C)[C@H](C)c1ccccc1Cl ZINC000053148279 358106649 /nfs/dbraw/zinc/10/66/49/358106649.db2.gz WPFHSXUYHUOSNC-SECBINFHSA-N 1 2 240.734 2.079 20 0 BEADLO CNC(=O)C[N@@H+](C)[C@H](C)c1ccccc1Cl ZINC000053148279 358106652 /nfs/dbraw/zinc/10/66/52/358106652.db2.gz WPFHSXUYHUOSNC-SECBINFHSA-N 1 2 240.734 2.079 20 0 BEADLO Cc1occc1C[N@@H+]1CCO[C@H](CCF)C1 ZINC000628458856 358093769 /nfs/dbraw/zinc/09/37/69/358093769.db2.gz GPIADFWTRIVIBQ-GFCCVEGCSA-N 1 2 227.279 2.148 20 0 BEADLO Cc1occc1C[N@H+]1CCO[C@H](CCF)C1 ZINC000628458856 358093770 /nfs/dbraw/zinc/09/37/70/358093770.db2.gz GPIADFWTRIVIBQ-GFCCVEGCSA-N 1 2 227.279 2.148 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)Nc1nc(C)cc(C)n1 ZINC000584701593 358154523 /nfs/dbraw/zinc/15/45/23/358154523.db2.gz PVBBNTWEDNUSLS-NSHDSACASA-N 1 2 245.330 2.483 20 0 BEADLO Cc1nc([C@H](C)[NH+]2CCC(C)(F)CC2)no1 ZINC000640071281 358154864 /nfs/dbraw/zinc/15/48/64/358154864.db2.gz HVVVFRKHBYDCEL-QMMMGPOBSA-N 1 2 227.283 2.263 20 0 BEADLO CCc1nnc([C@H](C)[NH+]2CCC(C)(F)CC2)[nH]1 ZINC000640071928 358161182 /nfs/dbraw/zinc/16/11/82/358161182.db2.gz BKCAAHSASPRJIJ-VIFPVBQESA-N 1 2 240.326 2.252 20 0 BEADLO CC[C@H]([NH2+]Cc1ncccn1)c1ccc(F)cn1 ZINC000584851562 358209218 /nfs/dbraw/zinc/20/92/18/358209218.db2.gz XEODZZCRYWLKBW-NSHDSACASA-N 1 2 246.289 2.252 20 0 BEADLO FC1(F)C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cnns1 ZINC000625675888 491125428 /nfs/dbraw/zinc/12/54/28/491125428.db2.gz DBPKIVQVTUNLKM-OCAPTIKFSA-N 1 2 245.298 2.300 20 0 BEADLO FC1(F)C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cnns1 ZINC000625675888 491125429 /nfs/dbraw/zinc/12/54/29/491125429.db2.gz DBPKIVQVTUNLKM-OCAPTIKFSA-N 1 2 245.298 2.300 20 0 BEADLO Cc1cc(C)c(NC(=O)N2CC=CC2)c(C)[nH+]1 ZINC000640141996 358235897 /nfs/dbraw/zinc/23/58/97/358235897.db2.gz VRJZZAJAVXACHM-UHFFFAOYSA-N 1 2 231.299 2.411 20 0 BEADLO CC(C)[C@@H]1C[N@H+](Cc2csnn2)CCS1 ZINC000180246062 366402753 /nfs/dbraw/zinc/40/27/53/366402753.db2.gz FAXRDEIBEWOOCU-JTQLQIEISA-N 1 2 243.401 2.112 20 0 BEADLO CC(C)[C@@H]1C[N@@H+](Cc2csnn2)CCS1 ZINC000180246062 366402758 /nfs/dbraw/zinc/40/27/58/366402758.db2.gz FAXRDEIBEWOOCU-JTQLQIEISA-N 1 2 243.401 2.112 20 0 BEADLO Cc1nnc(C[NH2+][C@H](C)c2ccco2)s1 ZINC000134719779 325373400 /nfs/dbraw/zinc/37/34/00/325373400.db2.gz YATBMPOSELBCIK-SSDOTTSWSA-N 1 2 223.301 2.290 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@H](C)[C@H](F)C2)on1 ZINC000225250295 491128999 /nfs/dbraw/zinc/12/89/99/491128999.db2.gz YENOPGCNZFXNHH-GZMMTYOYSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)on1 ZINC000225250295 491129000 /nfs/dbraw/zinc/12/90/00/491129000.db2.gz YENOPGCNZFXNHH-GZMMTYOYSA-N 1 2 212.268 2.163 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1CCSC1 ZINC000226386487 358338250 /nfs/dbraw/zinc/33/82/50/358338250.db2.gz YGYOSKXXVHRLSX-SECBINFHSA-N 1 2 224.329 2.255 20 0 BEADLO CCC[C@@H](OC)c1noc(C[N@H+](C)C(C)C)n1 ZINC000351132688 366416677 /nfs/dbraw/zinc/41/66/77/366416677.db2.gz KTGAWJQYICDRRD-SNVBAGLBSA-N 1 2 241.335 2.397 20 0 BEADLO CCC[C@@H](OC)c1noc(C[N@@H+](C)C(C)C)n1 ZINC000351132688 366416681 /nfs/dbraw/zinc/41/66/81/366416681.db2.gz KTGAWJQYICDRRD-SNVBAGLBSA-N 1 2 241.335 2.397 20 0 BEADLO CCc1cn(CCCOC(F)(F)F)c[nH+]1 ZINC001641418878 1172246290 /nfs/dbraw/zinc/24/62/90/1172246290.db2.gz SDGQKDYCQQIJPB-UHFFFAOYSA-N 1 2 222.210 2.372 20 0 BEADLO Cc1ccc(F)c(Cc2noc(C[NH+](C)C)n2)c1 ZINC000351164173 366436171 /nfs/dbraw/zinc/43/61/71/366436171.db2.gz ZVIDNLSHQDATQK-UHFFFAOYSA-N 1 2 249.289 2.170 20 0 BEADLO CCO[C@@H](C)c1nc(Cc2ccc[nH+]c2C)no1 ZINC000351231494 366455878 /nfs/dbraw/zinc/45/58/78/366455878.db2.gz JGOJTRSQCUEPBU-JTQLQIEISA-N 1 2 247.298 2.461 20 0 BEADLO Fc1cc(F)c(C[NH2+]Cc2ccno2)cc1F ZINC000230973143 358413529 /nfs/dbraw/zinc/41/35/29/358413529.db2.gz NAZGWDLZOKDKMK-UHFFFAOYSA-N 1 2 242.200 2.382 20 0 BEADLO CCc1nnc([C@H](C)[N@@H+]2[C@H](C)C[C@@H]2C)o1 ZINC000547768464 325394281 /nfs/dbraw/zinc/39/42/81/325394281.db2.gz NPLPVPZDPCUEHH-YIZRAAEISA-N 1 2 209.293 2.176 20 0 BEADLO CC(C)C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000048698105 358649193 /nfs/dbraw/zinc/64/91/93/358649193.db2.gz XUPCRWZZIWPUMD-UHFFFAOYSA-N 1 2 229.283 2.467 20 0 BEADLO CCn1nccc1C[N@H+](C)Cc1c(C)noc1C ZINC000131408842 358675077 /nfs/dbraw/zinc/67/50/77/358675077.db2.gz GQAIPCCOTGPOGO-UHFFFAOYSA-N 1 2 248.330 2.140 20 0 BEADLO CCn1nccc1C[N@@H+](C)Cc1c(C)noc1C ZINC000131408842 358675079 /nfs/dbraw/zinc/67/50/79/358675079.db2.gz GQAIPCCOTGPOGO-UHFFFAOYSA-N 1 2 248.330 2.140 20 0 BEADLO CCOC(=O)[C@@H]1CCC[N@@H+]1Cc1ccc(C)o1 ZINC000050064518 358711662 /nfs/dbraw/zinc/71/16/62/358711662.db2.gz ZLUFEQRZTDWLCG-LBPRGKRZSA-N 1 2 237.299 2.116 20 0 BEADLO CCOC(=O)[C@@H]1CCC[N@H+]1Cc1ccc(C)o1 ZINC000050064518 358711664 /nfs/dbraw/zinc/71/16/64/358711664.db2.gz ZLUFEQRZTDWLCG-LBPRGKRZSA-N 1 2 237.299 2.116 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccsc1)c1nncn1C ZINC000050341746 358724559 /nfs/dbraw/zinc/72/45/59/358724559.db2.gz DDUIHKREWQQAOS-DTWKUNHWSA-N 1 2 236.344 2.288 20 0 BEADLO CCCCN(CCO)c1cc[nH+]c(C(C)C)n1 ZINC000176734305 134292659 /nfs/dbraw/zinc/29/26/59/134292659.db2.gz XDROMSQUBGRDLW-UHFFFAOYSA-N 1 2 237.347 2.199 20 0 BEADLO COC(=O)C[N@@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000052455727 358782922 /nfs/dbraw/zinc/78/29/22/358782922.db2.gz GSWKRPQYPJBVLB-GFCCVEGCSA-N 1 2 237.274 2.136 20 0 BEADLO COC(=O)C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000052455727 358782924 /nfs/dbraw/zinc/78/29/24/358782924.db2.gz GSWKRPQYPJBVLB-GFCCVEGCSA-N 1 2 237.274 2.136 20 0 BEADLO Cc1nnsc1C[N@@H+](C)[C@@H](C)c1ccccn1 ZINC000578239960 366467203 /nfs/dbraw/zinc/46/72/03/366467203.db2.gz ARJKRUIKTLSVMR-JTQLQIEISA-N 1 2 248.355 2.435 20 0 BEADLO Cc1nnsc1C[N@H+](C)[C@@H](C)c1ccccn1 ZINC000578239960 366467209 /nfs/dbraw/zinc/46/72/09/366467209.db2.gz ARJKRUIKTLSVMR-JTQLQIEISA-N 1 2 248.355 2.435 20 0 BEADLO C[C@H]1C[C@H](C)C[NH+](Cc2noc(C3CC3)n2)C1 ZINC000053602346 358835663 /nfs/dbraw/zinc/83/56/63/358835663.db2.gz VDSOVKWJOPEXIC-UWVGGRQHSA-N 1 2 235.331 2.425 20 0 BEADLO C(c1noc(C2CC2)n1)[NH+]1CCCCCC1 ZINC000053602143 358836310 /nfs/dbraw/zinc/83/63/10/358836310.db2.gz ZLAGTBQUOCMUSS-UHFFFAOYSA-N 1 2 221.304 2.323 20 0 BEADLO C[C@@H]1C[C@H](C)C[N@@H+](Cc2noc(C3CC3)n2)C1 ZINC000053602344 358836404 /nfs/dbraw/zinc/83/64/04/358836404.db2.gz VDSOVKWJOPEXIC-AOOOYVTPSA-N 1 2 235.331 2.425 20 0 BEADLO C[C@@H]1C[C@H](C)C[N@H+](Cc2noc(C3CC3)n2)C1 ZINC000053602344 358836407 /nfs/dbraw/zinc/83/64/07/358836407.db2.gz VDSOVKWJOPEXIC-AOOOYVTPSA-N 1 2 235.331 2.425 20 0 BEADLO CCCC[N@H+](CC)Cc1noc(CC)n1 ZINC000054315800 358856203 /nfs/dbraw/zinc/85/62/03/358856203.db2.gz RHLOWGXXNPAJAG-UHFFFAOYSA-N 1 2 211.309 2.254 20 0 BEADLO CCCC[N@@H+](CC)Cc1noc(CC)n1 ZINC000054315800 358856208 /nfs/dbraw/zinc/85/62/08/358856208.db2.gz RHLOWGXXNPAJAG-UHFFFAOYSA-N 1 2 211.309 2.254 20 0 BEADLO Cc1cncc(NC(=O)C[C@H](C)n2cc[nH+]c2)c1 ZINC000578326919 366516065 /nfs/dbraw/zinc/51/60/65/366516065.db2.gz KUCPWTZVNGRZBZ-NSHDSACASA-N 1 2 244.298 2.176 20 0 BEADLO CC(C)Cc1noc(C[C@H](C)n2cc[nH+]c2)n1 ZINC000351395865 366521626 /nfs/dbraw/zinc/52/16/26/366521626.db2.gz DHKRPJDXLTVYKV-JTQLQIEISA-N 1 2 234.303 2.268 20 0 BEADLO Cc1ccc(C(=O)N(C)Cc2[nH]cc[nH+]2)c(C)c1 ZINC000070979172 359067677 /nfs/dbraw/zinc/06/76/77/359067677.db2.gz JRKVNOZWWYTNLV-UHFFFAOYSA-N 1 2 243.310 2.299 20 0 BEADLO CCc1ccsc1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000070978993 359067990 /nfs/dbraw/zinc/06/79/90/359067990.db2.gz YEXWXLSGCSOHMB-UHFFFAOYSA-N 1 2 249.339 2.306 20 0 BEADLO C[C@@H](Nc1ccc(CCO)cc1)c1[nH+]ccn1C ZINC000070445261 359055462 /nfs/dbraw/zinc/05/54/62/359055462.db2.gz AIANRBKXUIWLCB-LLVKDONJSA-N 1 2 245.326 2.128 20 0 BEADLO C[C@H](Nc1ccc(CCO)cc1)c1[nH+]ccn1C ZINC000070445260 359055651 /nfs/dbraw/zinc/05/56/51/359055651.db2.gz AIANRBKXUIWLCB-NSHDSACASA-N 1 2 245.326 2.128 20 0 BEADLO Cc1[nH+]c2cc(NC(=O)C3CC3)ccc2n1C ZINC000074985639 359137436 /nfs/dbraw/zinc/13/74/36/359137436.db2.gz NRVUPBOBVDSGHW-UHFFFAOYSA-N 1 2 229.283 2.230 20 0 BEADLO CCc1nc(C[N@@H+]2C[C@@H](C)CC[C@H]2C)no1 ZINC000247552341 359232921 /nfs/dbraw/zinc/23/29/21/359232921.db2.gz QBPDSPHQNVMNDO-VHSXEESVSA-N 1 2 223.320 2.252 20 0 BEADLO CCc1nc(C[N@H+]2C[C@@H](C)CC[C@H]2C)no1 ZINC000247552341 359232924 /nfs/dbraw/zinc/23/29/24/359232924.db2.gz QBPDSPHQNVMNDO-VHSXEESVSA-N 1 2 223.320 2.252 20 0 BEADLO CC[C@H](C)C(=O)N1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000247685565 359240652 /nfs/dbraw/zinc/24/06/52/359240652.db2.gz SBYAQSCPLYVKQA-AVGNSLFASA-N 1 2 249.358 2.339 20 0 BEADLO FC1(F)CCC[C@H]1[NH2+]Cc1cccnc1 ZINC000308872092 491139438 /nfs/dbraw/zinc/13/94/38/491139438.db2.gz KSOOXEFXQULZNG-SNVBAGLBSA-N 1 2 212.243 2.359 20 0 BEADLO CCCC[C@H](C(=O)OC)[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000611501613 359383780 /nfs/dbraw/zinc/38/37/80/359383780.db2.gz FUDQYADZTHFAME-GRYCIOLGSA-N 1 2 245.338 2.398 20 0 BEADLO CCCC[C@H](C(=O)OC)[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000611501613 359383789 /nfs/dbraw/zinc/38/37/89/359383789.db2.gz FUDQYADZTHFAME-GRYCIOLGSA-N 1 2 245.338 2.398 20 0 BEADLO C[C@@H](C(=O)OC(C)(C)C)[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000611502492 359384508 /nfs/dbraw/zinc/38/45/08/359384508.db2.gz UEDYBLHZQYPSGU-OUAUKWLOSA-N 1 2 245.338 2.397 20 0 BEADLO C[C@@H](C(=O)OC(C)(C)C)[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000611502492 359384513 /nfs/dbraw/zinc/38/45/13/359384513.db2.gz UEDYBLHZQYPSGU-OUAUKWLOSA-N 1 2 245.338 2.397 20 0 BEADLO Clc1ncc(C[N@@H+]2CC[C@H]3C[C@H]32)s1 ZINC000306263996 359485572 /nfs/dbraw/zinc/48/55/72/359485572.db2.gz NXTXCLSCOLKQGD-POYBYMJQSA-N 1 2 214.721 2.391 20 0 BEADLO Clc1ncc(C[N@H+]2CC[C@H]3C[C@H]32)s1 ZINC000306263996 359485576 /nfs/dbraw/zinc/48/55/76/359485576.db2.gz NXTXCLSCOLKQGD-POYBYMJQSA-N 1 2 214.721 2.391 20 0 BEADLO CC1(F)CCN(c2nc[nH+]c(N)c2Cl)CC1 ZINC000631514185 359606645 /nfs/dbraw/zinc/60/66/45/359606645.db2.gz FABKDLWDXLLUTL-UHFFFAOYSA-N 1 2 244.701 2.041 20 0 BEADLO CC1(F)CCN(c2[nH+]cnc(N)c2Cl)CC1 ZINC000631514185 359606650 /nfs/dbraw/zinc/60/66/50/359606650.db2.gz FABKDLWDXLLUTL-UHFFFAOYSA-N 1 2 244.701 2.041 20 0 BEADLO CC(C)n1cc([C@H](C)[NH2+]CC(F)F)cn1 ZINC000309011278 491142379 /nfs/dbraw/zinc/14/23/79/491142379.db2.gz RXGKIWOIEMQCRX-QMMMGPOBSA-N 1 2 217.263 2.380 20 0 BEADLO Cc1nc(C(C)(C)[NH2+]CCC(F)(F)F)no1 ZINC000077282929 359695597 /nfs/dbraw/zinc/69/55/97/359695597.db2.gz RZLMXKYEBOXJLJ-UHFFFAOYSA-N 1 2 237.225 2.155 20 0 BEADLO Cc1ccncc1CNc1cc[nH+]c(C2CC2)n1 ZINC000450805048 202270877 /nfs/dbraw/zinc/27/08/77/202270877.db2.gz ZKKCIPNAGXTENX-UHFFFAOYSA-N 1 2 240.310 2.091 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)Nc1ncc(F)cn1 ZINC000450825234 202277778 /nfs/dbraw/zinc/27/77/78/202277778.db2.gz DXIXUOSTSXROCE-MRVPVSSYSA-N 1 2 235.266 2.005 20 0 BEADLO C[C@@H]1C[C@H](Nc2ncncc2Cl)c2[nH+]ccn21 ZINC000450833875 202280991 /nfs/dbraw/zinc/28/09/91/202280991.db2.gz UFNSMQORIBRMFP-APPZFPTMSA-N 1 2 249.705 2.444 20 0 BEADLO CCC1(CNc2cc(C)[nH+]c(C(C)C)n2)COC1 ZINC000450844969 202285132 /nfs/dbraw/zinc/28/51/32/202285132.db2.gz LXQBJDDUDGNZOX-UHFFFAOYSA-N 1 2 249.358 2.169 20 0 BEADLO CCC[C@H](O)C[N@@H+]1CC[C@H](C)C(F)(F)C1 ZINC000450842776 202286579 /nfs/dbraw/zinc/28/65/79/202286579.db2.gz CDPUHJWWTWGJEM-UWVGGRQHSA-N 1 2 221.291 2.125 20 0 BEADLO CCC[C@H](O)C[N@H+]1CC[C@H](C)C(F)(F)C1 ZINC000450842776 202286583 /nfs/dbraw/zinc/28/65/83/202286583.db2.gz CDPUHJWWTWGJEM-UWVGGRQHSA-N 1 2 221.291 2.125 20 0 BEADLO c1cc(NC[C@@H]2C[C@H]2C2CC2)nc(C2CC2)[nH+]1 ZINC000450928081 202311764 /nfs/dbraw/zinc/31/17/64/202311764.db2.gz QZCCOILZOXPNBN-RYUDHWBXSA-N 1 2 229.327 2.234 20 0 BEADLO CC[C@@]1(C)CN(c2nc(C)[nH+]cc2C)CCO1 ZINC000578453251 366573132 /nfs/dbraw/zinc/57/31/32/366573132.db2.gz KYZRHYJHBABBTC-ZDUSSCGKSA-N 1 2 235.331 2.099 20 0 BEADLO CC[C@@H](C(=O)OC(C)(C)C)[N@@H+]1CC[C@@H](F)C1 ZINC000451202571 202380221 /nfs/dbraw/zinc/38/02/21/202380221.db2.gz XJERMZVMRHVDME-ZJUUUORDSA-N 1 2 231.311 2.151 20 0 BEADLO CC[C@@H](C(=O)OC(C)(C)C)[N@H+]1CC[C@@H](F)C1 ZINC000451202571 202380225 /nfs/dbraw/zinc/38/02/25/202380225.db2.gz XJERMZVMRHVDME-ZJUUUORDSA-N 1 2 231.311 2.151 20 0 BEADLO Cc1cc[nH+]c(NCC(C)(C)CO)c1Cl ZINC000309176168 491145846 /nfs/dbraw/zinc/14/58/46/491145846.db2.gz MSOXAPZBKXDFTH-UHFFFAOYSA-N 1 2 228.723 2.474 20 0 BEADLO CCNc1nc(N(C)C)c2ccccc2[nH+]1 ZINC000087806487 359930297 /nfs/dbraw/zinc/93/02/97/359930297.db2.gz UPWLYWYLTDHFOG-UHFFFAOYSA-N 1 2 216.288 2.128 20 0 BEADLO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1cnccn1 ZINC000578615228 366607944 /nfs/dbraw/zinc/60/79/44/366607944.db2.gz ZJHXRKCBFDXSAE-IINYFYTJSA-N 1 2 241.294 2.088 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)C[C@@H]2C[C@@H]2C)[nH+]1 ZINC000578875836 366664537 /nfs/dbraw/zinc/66/45/37/366664537.db2.gz YJVOTMMGVWFQDT-WPRPVWTQSA-N 1 2 235.331 2.116 20 0 BEADLO COC(=O)[C@H]([NH2+]CCC1CC1)c1ccccc1 ZINC000088490746 359963633 /nfs/dbraw/zinc/96/36/33/359963633.db2.gz AFZSDYIQYVRIOU-CYBMUJFWSA-N 1 2 233.311 2.290 20 0 BEADLO CC(C)n1ncnc1C[NH2+][C@H](C)c1cccnc1 ZINC000088589275 359968238 /nfs/dbraw/zinc/96/82/38/359968238.db2.gz QQGXQNJVJVBWTK-LLVKDONJSA-N 1 2 245.330 2.105 20 0 BEADLO O=C(CCCc1ccccc1)NCc1c[nH+]c[nH]1 ZINC000088753004 359975307 /nfs/dbraw/zinc/97/53/07/359975307.db2.gz VMZAGVOOHCQNAA-UHFFFAOYSA-N 1 2 243.310 2.049 20 0 BEADLO O=C(CCCc1ccccc1)NCc1c[nH]c[nH+]1 ZINC000088753004 359975311 /nfs/dbraw/zinc/97/53/11/359975311.db2.gz VMZAGVOOHCQNAA-UHFFFAOYSA-N 1 2 243.310 2.049 20 0 BEADLO CC[C@@H](C(=O)NCc1c[nH+]c[nH]1)c1ccccc1 ZINC000088752964 359975518 /nfs/dbraw/zinc/97/55/18/359975518.db2.gz CNSJNWCHFROKHZ-CYBMUJFWSA-N 1 2 243.310 2.220 20 0 BEADLO CC[C@@H](C(=O)NCc1c[nH]c[nH+]1)c1ccccc1 ZINC000088752964 359975521 /nfs/dbraw/zinc/97/55/21/359975521.db2.gz CNSJNWCHFROKHZ-CYBMUJFWSA-N 1 2 243.310 2.220 20 0 BEADLO CC(C)n1ccc(C[C@H](C)Nc2c[nH]c[nH+]2)n1 ZINC000578944301 366677830 /nfs/dbraw/zinc/67/78/30/366677830.db2.gz ZFSASVDLPBLJIP-JTQLQIEISA-N 1 2 233.319 2.230 20 0 BEADLO CCOc1ncccc1NCc1c[nH+]cn1CC ZINC000090170908 360060984 /nfs/dbraw/zinc/06/09/84/360060984.db2.gz DDLOVEPFVUFFJF-UHFFFAOYSA-N 1 2 246.314 2.309 20 0 BEADLO C[C@@H]([NH2+]C1CCSCC1)C(=O)OC(C)(C)C ZINC000090451851 360073236 /nfs/dbraw/zinc/07/32/36/360073236.db2.gz GFBAXHRXRCYSGP-SECBINFHSA-N 1 2 245.388 2.202 20 0 BEADLO CC(C)C[C@@H](C)NC(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000612841026 360103953 /nfs/dbraw/zinc/10/39/53/360103953.db2.gz WJBVUHXSXBCJJE-GHMZBOCLSA-N 1 2 249.358 2.065 20 0 BEADLO CC(C)C[C@@H](C)NC(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000612841026 360103958 /nfs/dbraw/zinc/10/39/58/360103958.db2.gz WJBVUHXSXBCJJE-GHMZBOCLSA-N 1 2 249.358 2.065 20 0 BEADLO C[C@H]([NH2+]C1CCSCC1)C(=O)OC(C)(C)C ZINC000090579115 360078462 /nfs/dbraw/zinc/07/84/62/360078462.db2.gz GFBAXHRXRCYSGP-VIFPVBQESA-N 1 2 245.388 2.202 20 0 BEADLO c1c[nH+]c(CNc2cnn(-c3ccccc3)c2)[nH]1 ZINC000092568490 360180836 /nfs/dbraw/zinc/18/08/36/360180836.db2.gz CVJMCXGHJWOAOJ-UHFFFAOYSA-N 1 2 239.282 2.208 20 0 BEADLO Cc1cc(NC(=O)NCc2ccccn2)cc[nH+]1 ZINC000096713142 360353476 /nfs/dbraw/zinc/35/34/76/360353476.db2.gz OCSSCHJHIGLNPE-UHFFFAOYSA-N 1 2 242.282 2.107 20 0 BEADLO O=C(Nc1ccccc1)[C@H]1CCn2cc[nH+]c2C1 ZINC000096642057 360351423 /nfs/dbraw/zinc/35/14/23/360351423.db2.gz RHCLZLYAAIEWHY-NSHDSACASA-N 1 2 241.294 2.084 20 0 BEADLO Cc1ccc(NC(=O)c2cncc(O)c2)c(C)[nH+]1 ZINC000094666425 360314638 /nfs/dbraw/zinc/31/46/38/360314638.db2.gz DYQJVRANJBNSSY-UHFFFAOYSA-N 1 2 243.266 2.051 20 0 BEADLO CCC1(C(=O)N(C)Cc2[nH]cc[nH+]2)CCCC1 ZINC000094905612 360326474 /nfs/dbraw/zinc/32/64/74/360326474.db2.gz ZNABZSWDNFGJTJ-UHFFFAOYSA-N 1 2 235.331 2.339 20 0 BEADLO CCC[C@@H]([NH2+]CCC(F)(F)F)C(=O)OCC ZINC000097988549 360385285 /nfs/dbraw/zinc/38/52/85/360385285.db2.gz ZTOICEBVPLTEMI-MRVPVSSYSA-N 1 2 241.253 2.260 20 0 BEADLO CC(=O)c1ccc(C[N@@H+]2CC[C@@H](F)C2)cc1 ZINC000148150618 360561968 /nfs/dbraw/zinc/56/19/68/360561968.db2.gz QSUQTSLFHYNSNB-CYBMUJFWSA-N 1 2 221.275 2.433 20 0 BEADLO CC(=O)c1ccc(C[N@H+]2CC[C@@H](F)C2)cc1 ZINC000148150618 360561972 /nfs/dbraw/zinc/56/19/72/360561972.db2.gz QSUQTSLFHYNSNB-CYBMUJFWSA-N 1 2 221.275 2.433 20 0 BEADLO Cc1nn(C(C)C)cc1C[N@H+](C1CC1)C1COC1 ZINC000449353061 219835459 /nfs/dbraw/zinc/83/54/59/219835459.db2.gz ZWBOGRYJRKUAGK-UHFFFAOYSA-N 1 2 249.358 2.136 20 0 BEADLO Cc1nn(C(C)C)cc1C[N@@H+](C1CC1)C1COC1 ZINC000449353061 219835462 /nfs/dbraw/zinc/83/54/62/219835462.db2.gz ZWBOGRYJRKUAGK-UHFFFAOYSA-N 1 2 249.358 2.136 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NCC[C@@H]1CC=CCC1 ZINC000628889037 360729172 /nfs/dbraw/zinc/72/91/72/360729172.db2.gz GLBFRZIIOIXSHZ-GFCCVEGCSA-N 1 2 247.342 2.205 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NCC[C@@H]1CC=CCC1 ZINC000628889037 360729177 /nfs/dbraw/zinc/72/91/77/360729177.db2.gz GLBFRZIIOIXSHZ-GFCCVEGCSA-N 1 2 247.342 2.205 20 0 BEADLO C[C@@H](O)[C@@H]1CCN(c2cc3ccccc3c[nH+]2)C1 ZINC000631200435 360789582 /nfs/dbraw/zinc/78/95/82/360789582.db2.gz HERNHJIYGPAXGJ-BXUZGUMPSA-N 1 2 242.322 2.442 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCCC1(F)F)c1ccnn1C ZINC000309554456 491151346 /nfs/dbraw/zinc/15/13/46/491151346.db2.gz JGMXOHRLBTUAEK-WCBMZHEXSA-N 1 2 229.274 2.259 20 0 BEADLO C[C@@H]1C[C@H](Nc2c[nH+]cc(N(C)C)c2)[C@H](C)O1 ZINC000631203594 360900366 /nfs/dbraw/zinc/90/03/66/360900366.db2.gz QQJZTAWVRUHPCC-NRUUGDAUSA-N 1 2 235.331 2.125 20 0 BEADLO CN(C)c1ccc(CSc2ncc[nH]2)c[nH+]1 ZINC000629158512 360908223 /nfs/dbraw/zinc/90/82/23/360908223.db2.gz KMUZEASINMNHQR-UHFFFAOYSA-N 1 2 234.328 2.163 20 0 BEADLO CC[C@@H]1C[C@H](Nc2c[nH+]cc(N(C)C)c2)CO1 ZINC000631203730 360910932 /nfs/dbraw/zinc/91/09/32/360910932.db2.gz TUFVMMIMDIJRKI-WCQYABFASA-N 1 2 235.331 2.127 20 0 BEADLO Cc1cc(C(C)C)nc(N(C)Cc2[nH]cc[nH+]2)n1 ZINC000631121297 360985488 /nfs/dbraw/zinc/98/54/88/360985488.db2.gz PRZDVISIMQNEIG-UHFFFAOYSA-N 1 2 245.330 2.268 20 0 BEADLO COC[C@H](C)CNc1cc2cc[nH]c2c[nH+]1 ZINC000309677755 491154013 /nfs/dbraw/zinc/15/40/13/491154013.db2.gz YJNPBYCQDFKIEA-SECBINFHSA-N 1 2 219.288 2.257 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2ccco2)ncn1 ZINC000309660661 491153898 /nfs/dbraw/zinc/15/38/98/491153898.db2.gz AVDCYIGKQYFFHM-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO Cc1nocc1C[NH2+]Cc1nc2c(s1)CCC2 ZINC000631209651 361074086 /nfs/dbraw/zinc/07/40/86/361074086.db2.gz XZXRZIQOKDRLSR-UHFFFAOYSA-N 1 2 249.339 2.218 20 0 BEADLO Cc1sccc1NC(=O)CCc1c[nH+]cn1C ZINC000634218520 361082658 /nfs/dbraw/zinc/08/26/58/361082658.db2.gz XZCXYKXOTQSQNX-UHFFFAOYSA-N 1 2 249.339 2.361 20 0 BEADLO Cc1ncsc1C[N@@H+](C)Cc1cnc(C)cn1 ZINC000066564720 361304611 /nfs/dbraw/zinc/30/46/11/361304611.db2.gz UBJQFJIPEMTEEF-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO Cc1ncsc1C[N@H+](C)Cc1cnc(C)cn1 ZINC000066564720 361304618 /nfs/dbraw/zinc/30/46/18/361304618.db2.gz UBJQFJIPEMTEEF-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO COc1ccc(C2([NH2+]Cc3cocn3)CC2)cc1 ZINC000428859832 201045274 /nfs/dbraw/zinc/04/52/74/201045274.db2.gz JLUOVDBICQJCJL-UHFFFAOYSA-N 1 2 244.294 2.462 20 0 BEADLO O=C(CCCF)Nc1ccn2cc[nH+]c2c1 ZINC000614276156 363767651 /nfs/dbraw/zinc/76/76/51/363767651.db2.gz NJTRLARWVSBQKQ-UHFFFAOYSA-N 1 2 221.235 2.023 20 0 BEADLO COCCN(C)c1ccc2cc(OC)ccc2[nH+]1 ZINC000614310361 363778597 /nfs/dbraw/zinc/77/85/97/363778597.db2.gz UZFXZPFVILHNHJ-UHFFFAOYSA-N 1 2 246.310 2.326 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)CC1CC(C)(C)C1 ZINC000429836742 201132302 /nfs/dbraw/zinc/13/23/02/201132302.db2.gz CEMXOEXLLHYFGV-LLVKDONJSA-N 1 2 249.358 2.214 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[NH2+][C@@H]1C[C@H]1C1CC1 ZINC000429794499 201132317 /nfs/dbraw/zinc/13/23/17/201132317.db2.gz VNDGVYJXXWHURB-YNEHKIRRSA-N 1 2 239.359 2.352 20 0 BEADLO Cc1cc(NCc2cccc3[nH+]ccn32)no1 ZINC000181462796 366813411 /nfs/dbraw/zinc/81/34/11/366813411.db2.gz QKCXRWSOPKDOLX-UHFFFAOYSA-N 1 2 228.255 2.243 20 0 BEADLO CC[C@H]1CC[N@@H+]1Cc1cn(C(C)(C)C)nn1 ZINC000430188945 201150347 /nfs/dbraw/zinc/15/03/47/201150347.db2.gz CAKOSKFBWSVFST-NSHDSACASA-N 1 2 222.336 2.017 20 0 BEADLO CC[C@H]1CC[N@H+]1Cc1cn(C(C)(C)C)nn1 ZINC000430188945 201150350 /nfs/dbraw/zinc/15/03/50/201150350.db2.gz CAKOSKFBWSVFST-NSHDSACASA-N 1 2 222.336 2.017 20 0 BEADLO c1n[nH]cc1CSc1[nH+]cc2ccccn21 ZINC000430086250 201143257 /nfs/dbraw/zinc/14/32/57/201143257.db2.gz CRFGRRRULXVKQL-UHFFFAOYSA-N 1 2 230.296 2.350 20 0 BEADLO CC(C)[C@H](O)C[N@@H+]1CCCC[C@H]1C(F)F ZINC000433189898 201164984 /nfs/dbraw/zinc/16/49/84/201164984.db2.gz TXLDWYMAPAYOHY-VHSXEESVSA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)[C@H](O)C[N@H+]1CCCC[C@H]1C(F)F ZINC000433189898 201164986 /nfs/dbraw/zinc/16/49/86/201164986.db2.gz TXLDWYMAPAYOHY-VHSXEESVSA-N 1 2 221.291 2.123 20 0 BEADLO CCC(F)(F)C[NH2+]C[C@@H](O)Cc1ccccc1 ZINC000629595705 361483217 /nfs/dbraw/zinc/48/32/17/361483217.db2.gz VHCUZEIDUNSFGM-LBPRGKRZSA-N 1 2 243.297 2.225 20 0 BEADLO C[C@]12CCCC[C@H]1CN2C(=O)CCn1cc[nH+]c1 ZINC000629613055 361506694 /nfs/dbraw/zinc/50/66/94/361506694.db2.gz KWADTFHCVVPXGU-JSGCOSHPSA-N 1 2 247.342 2.064 20 0 BEADLO C[C@@H](O)C1CC[NH+](C/C(Cl)=C\Cl)CC1 ZINC000381637540 361506738 /nfs/dbraw/zinc/50/67/38/361506738.db2.gz FWLKHAHFNIUSOX-VSBFRKNKSA-N 1 2 238.158 2.398 20 0 BEADLO CS[C@H]1CC[N@H+](Cc2nnc(C(C)C)o2)C1 ZINC000448545658 201199087 /nfs/dbraw/zinc/19/90/87/201199087.db2.gz IMYOTXSDHLRKLM-VIFPVBQESA-N 1 2 241.360 2.130 20 0 BEADLO CS[C@H]1CC[N@@H+](Cc2nnc(C(C)C)o2)C1 ZINC000448545658 201199091 /nfs/dbraw/zinc/19/90/91/201199091.db2.gz IMYOTXSDHLRKLM-VIFPVBQESA-N 1 2 241.360 2.130 20 0 BEADLO C[NH2+]c1ccc(NCc2n[nH]cc2C)cc1 ZINC000629653708 361552708 /nfs/dbraw/zinc/55/27/08/361552708.db2.gz FQSHRWRXWQQUKT-UHFFFAOYSA-N 1 2 216.288 2.372 20 0 BEADLO Cc1nc2[nH]ccc2c(NC[C@@H]2CC=CCC2)[nH+]1 ZINC000433796906 201193476 /nfs/dbraw/zinc/19/34/76/201193476.db2.gz RKJBVTLQPVAGDA-LLVKDONJSA-N 1 2 242.326 2.456 20 0 BEADLO CC[C@H](O)CCCNc1[nH+]c(C)nc2[nH]ccc21 ZINC000433782555 201194595 /nfs/dbraw/zinc/19/45/95/201194595.db2.gz KXTRSMKFGLVTAS-JTQLQIEISA-N 1 2 248.330 2.181 20 0 BEADLO O=C(CCn1cc[nH+]c1)N1CCCC2(CC2)CC1 ZINC000629646108 361534574 /nfs/dbraw/zinc/53/45/74/361534574.db2.gz MJJADBLJFVXQHK-UHFFFAOYSA-N 1 2 247.342 2.066 20 0 BEADLO CCC1(C(=O)NC[C@@H](C)Cn2cc[nH+]c2)CCC1 ZINC000434265802 201211176 /nfs/dbraw/zinc/21/11/76/201211176.db2.gz XLVVTPUNMSIVIQ-GFCCVEGCSA-N 1 2 249.358 2.216 20 0 BEADLO CCC1(C(=O)NCCNc2cccc[nH+]2)CCC1 ZINC000434221835 201209001 /nfs/dbraw/zinc/20/90/01/201209001.db2.gz CDUFUOHVAYKDHJ-UHFFFAOYSA-N 1 2 247.342 2.190 20 0 BEADLO Nc1cncc(-c2ccc(N3CCCC3)[nH+]c2)c1 ZINC000629710312 361645318 /nfs/dbraw/zinc/64/53/18/361645318.db2.gz QBCJWTBDAUQCRX-UHFFFAOYSA-N 1 2 240.310 2.326 20 0 BEADLO C[C@@H](CO)Nc1ccc(-c2ccoc2)c[nH+]1 ZINC000629714353 361651070 /nfs/dbraw/zinc/65/10/70/361651070.db2.gz DINGAOISJOSAOT-VIFPVBQESA-N 1 2 218.256 2.134 20 0 BEADLO C[C@@H]1CCC[C@@]1(C)C(=O)NCCCn1cc[nH+]c1 ZINC000448564606 201288233 /nfs/dbraw/zinc/28/82/33/201288233.db2.gz HDXBXTWMOUQNQN-TZMCWYRMSA-N 1 2 249.358 2.216 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)NCCCn1cc[nH+]c1 ZINC000448565628 201289711 /nfs/dbraw/zinc/28/97/11/201289711.db2.gz MQFORUIHWXGIPT-CHWSQXEVSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1cocc1-c1ccc(NCCCCO)[nH+]c1 ZINC000629739082 361676229 /nfs/dbraw/zinc/67/62/29/361676229.db2.gz VDSRXFJCXMTUCR-UHFFFAOYSA-N 1 2 246.310 2.256 20 0 BEADLO CCC[C@H]([NH2+]C[C@@H](C)SC)C(=O)OCC ZINC000155097395 201300821 /nfs/dbraw/zinc/30/08/21/201300821.db2.gz FPCJUPJSNLIDHJ-ZJUUUORDSA-N 1 2 233.377 2.059 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1C(=O)N(C)Cc1[nH+]ccn1C ZINC000448594862 201384462 /nfs/dbraw/zinc/38/44/62/201384462.db2.gz NYRGSYYOSKURGA-VXGBXAGGSA-N 1 2 249.358 2.061 20 0 BEADLO Cc1ccnc(CNc2nc[nH+]c(N)c2Cl)c1 ZINC000328236854 363862854 /nfs/dbraw/zinc/86/28/54/363862854.db2.gz GCIDTIWZLAZAPN-UHFFFAOYSA-N 1 2 249.705 2.028 20 0 BEADLO Cc1ccnc(CNc2[nH+]cnc(N)c2Cl)c1 ZINC000328236854 363862856 /nfs/dbraw/zinc/86/28/56/363862856.db2.gz GCIDTIWZLAZAPN-UHFFFAOYSA-N 1 2 249.705 2.028 20 0 BEADLO CC(C)CNC(=O)c1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000630410773 364147285 /nfs/dbraw/zinc/14/72/85/364147285.db2.gz GTHJYIKPTYYCBZ-UHFFFAOYSA-N 1 2 243.310 2.463 20 0 BEADLO COc1ccnc(C(=O)Nc2cc[nH+]cc2C)c1 ZINC000116195141 370744328 /nfs/dbraw/zinc/74/43/28/370744328.db2.gz APRXTRLSGDTUOZ-UHFFFAOYSA-N 1 2 243.266 2.046 20 0 BEADLO CSCCNc1cc(C)[nH+]c(C2CC2)n1 ZINC000116259841 370748978 /nfs/dbraw/zinc/74/89/78/370748978.db2.gz KDISMXOTFOYSHR-UHFFFAOYSA-N 1 2 223.345 2.437 20 0 BEADLO CCc1cc(N[C@H](CC)c2[nH]cc[nH+]2)ncn1 ZINC000139841276 541345088 /nfs/dbraw/zinc/34/50/88/541345088.db2.gz WCNHLXUNJZGJKF-SNVBAGLBSA-N 1 2 231.303 2.325 20 0 BEADLO CCc1cc(N2C[C@H](C)O[C@@H](C)[C@H]2C)nc(C)[nH+]1 ZINC000445670905 541349924 /nfs/dbraw/zinc/34/99/24/541349924.db2.gz YDRAXPHEJVSQBW-AXFHLTTASA-N 1 2 249.358 2.350 20 0 BEADLO CC(=O)c1ccc(NC(=O)[C@H](C)[NH+](C)C)cc1C ZINC000615009031 364354010 /nfs/dbraw/zinc/35/40/10/364354010.db2.gz PNRFSMFYWGOABG-JTQLQIEISA-N 1 2 248.326 2.086 20 0 BEADLO Cc1cc(C[NH2+][C@@H]2COCc3ccccc32)on1 ZINC000225996600 541361577 /nfs/dbraw/zinc/36/15/77/541361577.db2.gz SNFBXIMTNQJQCV-CQSZACIVSA-N 1 2 244.294 2.344 20 0 BEADLO CCCC[C@@H]([NH2+]CCC(C)(F)F)C(=O)OC ZINC000357692437 366862226 /nfs/dbraw/zinc/86/22/26/366862226.db2.gz APWFDBRPFLPFHP-SECBINFHSA-N 1 2 237.290 2.353 20 0 BEADLO CCc1cc(N[C@H]2C[C@H](OC)C2(C)C)nc[nH+]1 ZINC000227820245 541372034 /nfs/dbraw/zinc/37/20/34/541372034.db2.gz HAWIXIBNIMRWIC-QWRGUYRKSA-N 1 2 235.331 2.264 20 0 BEADLO CCc1ccsc1C(=O)NCc1[nH]c[nH+]c1C ZINC000267003431 364725892 /nfs/dbraw/zinc/72/58/92/364725892.db2.gz ZOKVVFCPOUZPPZ-UHFFFAOYSA-N 1 2 249.339 2.272 20 0 BEADLO Cc1nnsc1C[N@H+](C)Cc1ccco1 ZINC000573310071 364794503 /nfs/dbraw/zinc/79/45/03/364794503.db2.gz WVYRKVWZQCZGGG-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO Cc1nnsc1C[N@@H+](C)Cc1ccco1 ZINC000573310071 364794509 /nfs/dbraw/zinc/79/45/09/364794509.db2.gz WVYRKVWZQCZGGG-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO Cc1cc(N2CCC[C@H]2[C@@H]2CCCOC2)nc[nH+]1 ZINC000567767346 364754297 /nfs/dbraw/zinc/75/42/97/364754297.db2.gz JSTOWVDLISMTFN-OLZOCXBDSA-N 1 2 247.342 2.180 20 0 BEADLO CCc1nnc(C[NH2+][C@H](C)c2ccc(F)cc2)[nH]1 ZINC000274667459 364757828 /nfs/dbraw/zinc/75/78/28/364757828.db2.gz RKWMPOSSBDQNBK-SECBINFHSA-N 1 2 248.305 2.357 20 0 BEADLO Cc1ccc(NCc2cnccn2)c(C)[nH+]1 ZINC000087151755 364766662 /nfs/dbraw/zinc/76/66/62/364766662.db2.gz ORUHDAQDTMXVBY-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO CCc1nc(C)c(C[NH2+]Cc2c(C)noc2C)o1 ZINC000336815330 364785453 /nfs/dbraw/zinc/78/54/53/364785453.db2.gz HOQQXIBKYIFJKS-UHFFFAOYSA-N 1 2 249.314 2.440 20 0 BEADLO CCC[C@@H](C)Nc1[nH+]cnc(N)c1Cl ZINC000233281309 541382169 /nfs/dbraw/zinc/38/21/69/541382169.db2.gz YDKCCAHESQGPPX-ZCFIWIBFSA-N 1 2 214.700 2.313 20 0 BEADLO CCC[C@@H](C)Nc1nc[nH+]c(N)c1Cl ZINC000233281309 541382168 /nfs/dbraw/zinc/38/21/68/541382168.db2.gz YDKCCAHESQGPPX-ZCFIWIBFSA-N 1 2 214.700 2.313 20 0 BEADLO CCOc1ccc(C[NH2+]Cc2ncccn2)cc1 ZINC000573579101 364869179 /nfs/dbraw/zinc/86/91/79/364869179.db2.gz OFWDDROCQDSVPO-UHFFFAOYSA-N 1 2 243.310 2.165 20 0 BEADLO CC(C)n1ccc(C[NH2+][C@@H](C)c2cnccn2)n1 ZINC000573866452 364935317 /nfs/dbraw/zinc/93/53/17/364935317.db2.gz SBDZIDCXSUGVSM-NSHDSACASA-N 1 2 245.330 2.105 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NCCC(C)(C)C ZINC000574216066 365011905 /nfs/dbraw/zinc/01/19/05/365011905.db2.gz ASFUCQWJYQJSQX-JTQLQIEISA-N 1 2 237.347 2.141 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NCCC(C)(C)C ZINC000574216066 365011909 /nfs/dbraw/zinc/01/19/09/365011909.db2.gz ASFUCQWJYQJSQX-JTQLQIEISA-N 1 2 237.347 2.141 20 0 BEADLO CC(C)C[C@@H](C)NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000574216940 365013453 /nfs/dbraw/zinc/01/34/53/365013453.db2.gz NCKGVVNIYLXSTJ-WDEREUQCSA-N 1 2 237.347 2.139 20 0 BEADLO CC(C)C[C@@H](C)NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000574216940 365013458 /nfs/dbraw/zinc/01/34/58/365013458.db2.gz NCKGVVNIYLXSTJ-WDEREUQCSA-N 1 2 237.347 2.139 20 0 BEADLO CO[C@@H](c1ccccc1)[C@H](C)[NH2+]Cc1ccn[nH]1 ZINC000574389332 365049811 /nfs/dbraw/zinc/04/98/11/365049811.db2.gz GMXVMGYRNXHQIC-SMDDNHRTSA-N 1 2 245.326 2.276 20 0 BEADLO CO[C@@]1(C)CCCN(c2nc(C)[nH+]cc2C)C1 ZINC000574413693 365058203 /nfs/dbraw/zinc/05/82/03/365058203.db2.gz HMSRLVHRYAPUSE-ZDUSSCGKSA-N 1 2 235.331 2.099 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2ccc(CO)o2)n1 ZINC000169069318 365067669 /nfs/dbraw/zinc/06/76/69/365067669.db2.gz JBJDKIBVXUQRSF-UHFFFAOYSA-N 1 2 246.310 2.107 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2ccc(CO)o2)n1 ZINC000169069318 365067675 /nfs/dbraw/zinc/06/76/75/365067675.db2.gz JBJDKIBVXUQRSF-UHFFFAOYSA-N 1 2 246.310 2.107 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CC[C@H](C)[C@@H]1C ZINC000574465670 365069711 /nfs/dbraw/zinc/06/97/11/365069711.db2.gz OMQZCIGZYUOSDK-WPRPVWTQSA-N 1 2 205.305 2.328 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)C[C@@H]2C=CCC2)[nH+]1 ZINC000574524903 365083271 /nfs/dbraw/zinc/08/32/71/365083271.db2.gz KYTRJFLEHFXWMA-LLVKDONJSA-N 1 2 247.342 2.426 20 0 BEADLO Cc1noc(C)c1CC[N@@H+]1Cc2cccnc2C1 ZINC000574567726 365090764 /nfs/dbraw/zinc/09/07/64/365090764.db2.gz UMBZKIMKGRPFHL-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1noc(C)c1CC[N@H+]1Cc2cccnc2C1 ZINC000574567726 365090768 /nfs/dbraw/zinc/09/07/68/365090768.db2.gz UMBZKIMKGRPFHL-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO CC1CC(CNC(=O)c2ccc3[nH+]ccn3c2)C1 ZINC000622240169 370790214 /nfs/dbraw/zinc/79/02/14/370790214.db2.gz FIVBFJPXBIFCPR-UHFFFAOYSA-N 1 2 243.310 2.110 20 0 BEADLO COCC[N@H+](Cc1cc[nH]n1)Cc1ccccc1 ZINC000171685190 365226100 /nfs/dbraw/zinc/22/61/00/365226100.db2.gz LKEBCRVBXAAGRO-UHFFFAOYSA-N 1 2 245.326 2.058 20 0 BEADLO COCC[N@@H+](Cc1cc[nH]n1)Cc1ccccc1 ZINC000171685190 365226103 /nfs/dbraw/zinc/22/61/03/365226103.db2.gz LKEBCRVBXAAGRO-UHFFFAOYSA-N 1 2 245.326 2.058 20 0 BEADLO Cn1c2c(cccc2F)[nH]c1=[NH+]CC1CCC1 ZINC000443508538 193023363 /nfs/dbraw/zinc/02/33/63/193023363.db2.gz ISVACEBBEIKXGT-UHFFFAOYSA-N 1 2 233.290 2.346 20 0 BEADLO Fc1ccc(/C=C\C[NH+]2CCOCC2)cc1F ZINC000575586814 365332592 /nfs/dbraw/zinc/33/25/92/365332592.db2.gz GQNADLHNDMABFA-UPHRSURJSA-N 1 2 239.265 2.310 20 0 BEADLO Cc1c[nH+]c(C)nc1N1C[C@@H]2[C@H](C1)C2(C)C ZINC000575757905 365355372 /nfs/dbraw/zinc/35/53/72/365355372.db2.gz QOPRXATYZMCDMB-PHIMTYICSA-N 1 2 217.316 2.186 20 0 BEADLO CC(C)c1noc(C[N@@H+]2CCSC[C@@H]2C)n1 ZINC000172590165 365344241 /nfs/dbraw/zinc/34/42/41/365344241.db2.gz ILBINPVSZIABAK-VIFPVBQESA-N 1 2 241.360 2.130 20 0 BEADLO CC(C)c1noc(C[N@H+]2CCSC[C@@H]2C)n1 ZINC000172590165 365344249 /nfs/dbraw/zinc/34/42/49/365344249.db2.gz ILBINPVSZIABAK-VIFPVBQESA-N 1 2 241.360 2.130 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@H](C)[C@@H]2C)no1 ZINC000172859456 365384634 /nfs/dbraw/zinc/38/46/34/365384634.db2.gz QQAXSGPRRHMYSW-UWVGGRQHSA-N 1 2 223.320 2.252 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@H](C)[C@@H]2C)no1 ZINC000172859456 365384636 /nfs/dbraw/zinc/38/46/36/365384636.db2.gz QQAXSGPRRHMYSW-UWVGGRQHSA-N 1 2 223.320 2.252 20 0 BEADLO COc1ccccc1C1([NH2+]Cc2ccno2)CC1 ZINC000645998596 541460941 /nfs/dbraw/zinc/46/09/41/541460941.db2.gz HOAVEQCNJAXVJV-UHFFFAOYSA-N 1 2 244.294 2.462 20 0 BEADLO COc1ccc2c(c1)C[C@@H](Nc1c[nH]c[nH+]1)CC2 ZINC000576156373 365503417 /nfs/dbraw/zinc/50/34/17/365503417.db2.gz MILKHBZLWHADMQ-LBPRGKRZSA-N 1 2 243.310 2.388 20 0 BEADLO CC(C)[C@H](C)Nc1ccc(N2CCOCC2)c[nH+]1 ZINC000182874735 366954100 /nfs/dbraw/zinc/95/41/00/366954100.db2.gz JMTCNBVWMABGEB-LBPRGKRZSA-N 1 2 249.358 2.375 20 0 BEADLO COc1ccc([C@@H](C)CN2CC[NH+](C)CC2)cc1 ZINC000183369041 367018573 /nfs/dbraw/zinc/01/85/73/367018573.db2.gz GXUARVXQFDWDRZ-ZDUSSCGKSA-N 1 2 248.370 2.046 20 0 BEADLO CC[C@H](Nc1cnn(CC)c1)c1[nH+]ccn1C ZINC000183369058 367018672 /nfs/dbraw/zinc/01/86/72/367018672.db2.gz ZPFIQUMOSYRXOI-NSHDSACASA-N 1 2 233.319 2.200 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000579805648 367013890 /nfs/dbraw/zinc/01/38/90/367013890.db2.gz HWXHVLQEEURDOT-NTZNESFSSA-N 1 2 245.326 2.122 20 0 BEADLO CCC1C[NH+](Cc2cc(C(F)(F)F)n[nH]2)C1 ZINC000453611632 202783467 /nfs/dbraw/zinc/78/34/67/202783467.db2.gz KWAIYVKFXQLRBK-UHFFFAOYSA-N 1 2 233.237 2.270 20 0 BEADLO CCN(C(=O)C[C@H](C)n1cc[nH+]c1)C1CCC1 ZINC000579957480 367102318 /nfs/dbraw/zinc/10/23/18/367102318.db2.gz CCRQFXINDWNZII-NSHDSACASA-N 1 2 235.331 2.235 20 0 BEADLO Fc1ccc2cc(C[NH2+]Cc3ccn[nH]3)[nH]c2c1 ZINC000580809290 367171936 /nfs/dbraw/zinc/17/19/36/367171936.db2.gz QALCJADUWPCHAQ-UHFFFAOYSA-N 1 2 244.273 2.320 20 0 BEADLO COc1cccc(C[NH+]2CC(C(F)(F)F)C2)n1 ZINC000580814928 367175545 /nfs/dbraw/zinc/17/55/45/367175545.db2.gz VAKOHWXESHYEFH-UHFFFAOYSA-N 1 2 246.232 2.084 20 0 BEADLO Cc1ccccc1[C@H]1C[N@@H+]([C@@H]2CCOC2)CCO1 ZINC000580730335 367153274 /nfs/dbraw/zinc/15/32/74/367153274.db2.gz MRUMERYPIJIKLO-UKRRQHHQSA-N 1 2 247.338 2.157 20 0 BEADLO Cc1ccccc1[C@H]1C[N@H+]([C@@H]2CCOC2)CCO1 ZINC000580730335 367153278 /nfs/dbraw/zinc/15/32/78/367153278.db2.gz MRUMERYPIJIKLO-UKRRQHHQSA-N 1 2 247.338 2.157 20 0 BEADLO CC[C@H](NC(=O)[C@]12C[C@H]1CCC2)c1[nH]cc[nH+]1 ZINC000580768037 367160422 /nfs/dbraw/zinc/16/04/22/367160422.db2.gz HZNCELFIGOFNQI-GBIKHYSHSA-N 1 2 233.315 2.167 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)NC3CCCC3)ccn12 ZINC000580782853 367164765 /nfs/dbraw/zinc/16/47/65/367164765.db2.gz LIXKUAXIYVZCDO-UHFFFAOYSA-N 1 2 243.310 2.315 20 0 BEADLO Cc1noc(C[N@H+](C)CCc2ccccc2F)n1 ZINC000068865573 370854586 /nfs/dbraw/zinc/85/45/86/370854586.db2.gz MQKYWQQYZDKERJ-UHFFFAOYSA-N 1 2 249.289 2.192 20 0 BEADLO Cc1noc(C[N@@H+](C)CCc2ccccc2F)n1 ZINC000068865573 370854592 /nfs/dbraw/zinc/85/45/92/370854592.db2.gz MQKYWQQYZDKERJ-UHFFFAOYSA-N 1 2 249.289 2.192 20 0 BEADLO COc1cccc(C[N@@H+]2CCC[C@H](F)C2)n1 ZINC000580898075 367201530 /nfs/dbraw/zinc/20/15/30/367201530.db2.gz UYDYBPZUDVNKCB-JTQLQIEISA-N 1 2 224.279 2.024 20 0 BEADLO COc1cccc(C[N@H+]2CCC[C@H](F)C2)n1 ZINC000580898075 367201536 /nfs/dbraw/zinc/20/15/36/367201536.db2.gz UYDYBPZUDVNKCB-JTQLQIEISA-N 1 2 224.279 2.024 20 0 BEADLO CCN(CCC1CC1)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000580956614 367216843 /nfs/dbraw/zinc/21/68/43/367216843.db2.gz CYKKKXRPICZESB-GFCCVEGCSA-N 1 2 249.358 2.483 20 0 BEADLO CC[C@H](C(=O)OC)[N@H+](C)Cc1cccc(F)c1 ZINC000194559207 367304944 /nfs/dbraw/zinc/30/49/44/367304944.db2.gz NAISFLCLJNZEIS-GFCCVEGCSA-N 1 2 239.290 2.209 20 0 BEADLO CC[C@H](C(=O)OC)[N@@H+](C)Cc1cccc(F)c1 ZINC000194559207 367304948 /nfs/dbraw/zinc/30/49/48/367304948.db2.gz NAISFLCLJNZEIS-GFCCVEGCSA-N 1 2 239.290 2.209 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2CCOC[C@H]2C)c(C)[nH+]1 ZINC000194658496 367316641 /nfs/dbraw/zinc/31/66/41/367316641.db2.gz WMTGBJBAAFUUCY-BXKDBHETSA-N 1 2 248.326 2.310 20 0 BEADLO Cc1nc(NCC(C)(C)C(F)(F)F)cc[nH+]1 ZINC000381415098 367398171 /nfs/dbraw/zinc/39/81/71/367398171.db2.gz VSPYWVPCNJNFIJ-UHFFFAOYSA-N 1 2 233.237 2.207 20 0 BEADLO CC(F)(F)C[NH2+]Cc1cnn(C(C)(C)C)c1 ZINC000382322004 367507930 /nfs/dbraw/zinc/50/79/30/367507930.db2.gz UCESCFMMWJFKAF-UHFFFAOYSA-N 1 2 231.290 2.383 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N(C)CC(C)(C)C ZINC000581556291 367588859 /nfs/dbraw/zinc/58/88/59/367588859.db2.gz BGAXMDPKRZHJMR-SNVBAGLBSA-N 1 2 237.347 2.093 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N(C)CC(C)(C)C ZINC000581556291 367588863 /nfs/dbraw/zinc/58/88/63/367588863.db2.gz BGAXMDPKRZHJMR-SNVBAGLBSA-N 1 2 237.347 2.093 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N(C)CC(C)(C)C ZINC000581556290 367588982 /nfs/dbraw/zinc/58/89/82/367588982.db2.gz BGAXMDPKRZHJMR-JTQLQIEISA-N 1 2 237.347 2.093 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N(C)CC(C)(C)C ZINC000581556290 367588988 /nfs/dbraw/zinc/58/89/88/367588988.db2.gz BGAXMDPKRZHJMR-JTQLQIEISA-N 1 2 237.347 2.093 20 0 BEADLO C[C@@H](NC(=O)C1=CC[C@@H](C)CC1)c1[nH]cc[nH+]1 ZINC000581618074 367638459 /nfs/dbraw/zinc/63/84/59/367638459.db2.gz PCUHLMKRYQQAPN-NXEZZACHSA-N 1 2 233.315 2.333 20 0 BEADLO FC(F)Cn1cc(C[N@@H+]2CCC[C@H](F)C2)cn1 ZINC000581612908 367634975 /nfs/dbraw/zinc/63/49/75/367634975.db2.gz JHKCJZMIURJRJS-JTQLQIEISA-N 1 2 247.264 2.082 20 0 BEADLO FC(F)Cn1cc(C[N@H+]2CCC[C@H](F)C2)cn1 ZINC000581612908 367634979 /nfs/dbraw/zinc/63/49/79/367634979.db2.gz JHKCJZMIURJRJS-JTQLQIEISA-N 1 2 247.264 2.082 20 0 BEADLO CC/C=C\C[NH2+][C@H](CCC)C(=O)OCC ZINC000384710561 367719604 /nfs/dbraw/zinc/71/96/04/367719604.db2.gz DIMZYQVIWFONSP-SKVAFPRGSA-N 1 2 213.321 2.274 20 0 BEADLO Cc1ccc(N[C@@H]2C[C@H](C)O[C@@H]2C)c[nH+]1 ZINC000384650973 367712026 /nfs/dbraw/zinc/71/20/26/367712026.db2.gz UNQPYYKGBGQIOZ-HOSYDEDBSA-N 1 2 206.289 2.368 20 0 BEADLO CCCN(C(=O)Nc1cc[nH+]c(C)c1)C(C)C ZINC000581734565 367798171 /nfs/dbraw/zinc/79/81/71/367798171.db2.gz PKPSAMCXZOOJMT-UHFFFAOYSA-N 1 2 235.331 2.464 20 0 BEADLO CCc1cccc(C(=O)Nc2cc[nH+]c(C)c2)n1 ZINC000622368170 370872745 /nfs/dbraw/zinc/87/27/45/370872745.db2.gz LBGSOFXJVSZCFB-UHFFFAOYSA-N 1 2 241.294 2.022 20 0 BEADLO CCC(CC)(CNc1nc(C)[nH+]cc1C)OC ZINC000581737105 367800029 /nfs/dbraw/zinc/80/00/29/367800029.db2.gz WZPNFXALQYUTKH-UHFFFAOYSA-N 1 2 237.347 2.132 20 0 BEADLO CCC[C@H](O)C[N@H+](CCC)CC(F)F ZINC000385723271 367858559 /nfs/dbraw/zinc/85/85/59/367858559.db2.gz AFAOUHXUUBHQRM-VIFPVBQESA-N 1 2 209.280 2.125 20 0 BEADLO CCC[C@H](O)C[N@@H+](CCC)CC(F)F ZINC000385723271 367858561 /nfs/dbraw/zinc/85/85/61/367858561.db2.gz AFAOUHXUUBHQRM-VIFPVBQESA-N 1 2 209.280 2.125 20 0 BEADLO CCn1cc[nH+]c1CN[C@@H](C)c1cscn1 ZINC000385472753 367832475 /nfs/dbraw/zinc/83/24/75/367832475.db2.gz MSUZBYCJVBACNU-VIFPVBQESA-N 1 2 236.344 2.210 20 0 BEADLO c1cc2c(o1)CCC[C@@H]2[NH2+]Cc1ncccn1 ZINC000581835797 367840716 /nfs/dbraw/zinc/84/07/16/367840716.db2.gz KNTWCJWBQPNZPI-NSHDSACASA-N 1 2 229.283 2.237 20 0 BEADLO c1cn(Cc2cccc3c2CCOC3)c[nH+]1 ZINC000631013046 370891383 /nfs/dbraw/zinc/89/13/83/370891383.db2.gz RMTYNFMSPYFOSA-UHFFFAOYSA-N 1 2 214.268 2.004 20 0 BEADLO Cc1cc(C)c(C(=O)NCc2[nH+]ccn2C)s1 ZINC000630921005 367948603 /nfs/dbraw/zinc/94/86/03/367948603.db2.gz BXKNWQSHARMMKH-UHFFFAOYSA-N 1 2 249.339 2.028 20 0 BEADLO CCn1cc[nH+]c1CNc1nccc(SC)n1 ZINC000386523711 367985357 /nfs/dbraw/zinc/98/53/57/367985357.db2.gz YDELPHPOLFEUBJ-UHFFFAOYSA-N 1 2 249.343 2.027 20 0 BEADLO CN(C)c1c[nH+]cc(NCc2cncs2)c1 ZINC000630956117 368149459 /nfs/dbraw/zinc/14/94/59/368149459.db2.gz LYPPUCGPZSAKJL-UHFFFAOYSA-N 1 2 234.328 2.216 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)[C@H]2C[C@@H]2C2CC2)c2[nH+]ccn21 ZINC000456420421 202943002 /nfs/dbraw/zinc/94/30/02/202943002.db2.gz MNFSIMAFIOJZRY-KXGXSXBTSA-N 1 2 245.326 2.051 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccc(C)nc2)CCO1 ZINC000153727366 326110271 /nfs/dbraw/zinc/11/02/71/326110271.db2.gz KQVFYSMPFXVFJD-ZDUSSCGKSA-N 1 2 220.316 2.001 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccc(C)nc2)CCO1 ZINC000153727366 326110273 /nfs/dbraw/zinc/11/02/73/326110273.db2.gz KQVFYSMPFXVFJD-ZDUSSCGKSA-N 1 2 220.316 2.001 20 0 BEADLO CC[C@H](C)C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456356508 202937414 /nfs/dbraw/zinc/93/74/14/202937414.db2.gz BDVRLNHQALLDOO-IVZWLZJFSA-N 1 2 221.304 2.051 20 0 BEADLO CC(C)C[N@H+](C)Cc1noc(C2CC2)n1 ZINC000065960924 368636631 /nfs/dbraw/zinc/63/66/31/368636631.db2.gz ZLFSAMKUMVBXFU-UHFFFAOYSA-N 1 2 209.293 2.035 20 0 BEADLO CC(C)C[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000065960924 368636633 /nfs/dbraw/zinc/63/66/33/368636633.db2.gz ZLFSAMKUMVBXFU-UHFFFAOYSA-N 1 2 209.293 2.035 20 0 BEADLO Cc1ncsc1CN(C)c1cccc[nH+]1 ZINC000066467501 368649756 /nfs/dbraw/zinc/64/97/56/368649756.db2.gz PTNSOTJSHVEGNE-UHFFFAOYSA-N 1 2 219.313 2.483 20 0 BEADLO CN(CCc1ccccn1)c1cccc[nH+]1 ZINC000067949664 368708712 /nfs/dbraw/zinc/70/87/12/368708712.db2.gz JGUHSHJTJOTBQC-UHFFFAOYSA-N 1 2 213.284 2.156 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@H](C)CC(C)(C)C ZINC000457189022 203014914 /nfs/dbraw/zinc/01/49/14/203014914.db2.gz GVTNLGWIXRPBJI-VIFPVBQESA-N 1 2 237.347 2.202 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@@H](C)CC(C)(C)C ZINC000457189022 203014916 /nfs/dbraw/zinc/01/49/16/203014916.db2.gz GVTNLGWIXRPBJI-VIFPVBQESA-N 1 2 237.347 2.202 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)CCn2cc[nH+]c2)[C@@H]1C ZINC000072621090 368775328 /nfs/dbraw/zinc/77/53/28/368775328.db2.gz RVTYRIBZDDXCDN-UPJWGTAASA-N 1 2 249.358 2.214 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)[C@@H]2CCC2(C)C)c2[nH+]ccn21 ZINC000615963974 368800932 /nfs/dbraw/zinc/80/09/32/368800932.db2.gz UTWMJRCDCSKNRB-OUAUKWLOSA-N 1 2 247.342 2.441 20 0 BEADLO CC[C@@H]1CCCCCN1C(=O)Cn1cc[nH+]c1 ZINC000073904021 368819972 /nfs/dbraw/zinc/81/99/72/368819972.db2.gz ZYBIBYOAYINMIZ-GFCCVEGCSA-N 1 2 235.331 2.064 20 0 BEADLO CC1(C)CCC(CNC(=O)Cn2cc[nH+]c2)CC1 ZINC000089314980 368942386 /nfs/dbraw/zinc/94/23/86/368942386.db2.gz KQUXGFLTDXXXBK-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@@H](CNC(=O)[C@@H](C)C1CCC1)Cn1cc[nH+]c1 ZINC000457568522 203074794 /nfs/dbraw/zinc/07/47/94/203074794.db2.gz FNXFDAZBBXHIJE-RYUDHWBXSA-N 1 2 249.358 2.072 20 0 BEADLO CCCC[C@H]([NH2+]C1(C2CC2)CC1)C(=O)OC ZINC000310020470 326179709 /nfs/dbraw/zinc/17/97/09/326179709.db2.gz NAXKIQWNTKEBGK-NSHDSACASA-N 1 2 225.332 2.250 20 0 BEADLO C[C@H](C(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21)C1CCC1 ZINC000457889798 203117950 /nfs/dbraw/zinc/11/79/50/203117950.db2.gz YTGBYGKOVHRKAV-NHCYSSNCSA-N 1 2 247.342 2.441 20 0 BEADLO CCC[C@@H](NC(=O)Cc1[nH]c[nH+]c1C)C1CCC1 ZINC000458349238 203164568 /nfs/dbraw/zinc/16/45/68/203164568.db2.gz ZDNKHPROZODKDO-GFCCVEGCSA-N 1 2 249.358 2.346 20 0 BEADLO CCC[C@@H](NC(=O)Cc1[nH+]c[nH]c1C)C1CCC1 ZINC000458349238 203164572 /nfs/dbraw/zinc/16/45/72/203164572.db2.gz ZDNKHPROZODKDO-GFCCVEGCSA-N 1 2 249.358 2.346 20 0 BEADLO Cc1cccn2c(NC(=O)CC3CC3)c[nH+]c12 ZINC000619012500 369256920 /nfs/dbraw/zinc/25/69/20/369256920.db2.gz CBEFMLGBWKXFPF-UHFFFAOYSA-N 1 2 229.283 2.381 20 0 BEADLO FC(F)C[N@H+](CCc1cn[nH]c1)CC1CCC1 ZINC000459383093 203271315 /nfs/dbraw/zinc/27/13/15/203271315.db2.gz FCSBXQGKDQPOAP-UHFFFAOYSA-N 1 2 243.301 2.319 20 0 BEADLO FC(F)C[N@@H+](CCc1cn[nH]c1)CC1CCC1 ZINC000459383093 203271318 /nfs/dbraw/zinc/27/13/18/203271318.db2.gz FCSBXQGKDQPOAP-UHFFFAOYSA-N 1 2 243.301 2.319 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N(C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000619135575 369293954 /nfs/dbraw/zinc/29/39/54/369293954.db2.gz UZCHMYIWKBVPFX-VXGBXAGGSA-N 1 2 249.358 2.379 20 0 BEADLO C[N@H+](CCOCC1CCCC1)Cc1ccon1 ZINC000459336606 203262506 /nfs/dbraw/zinc/26/25/06/203262506.db2.gz IFZPUAGURXQKGQ-UHFFFAOYSA-N 1 2 238.331 2.313 20 0 BEADLO C[N@@H+](CCOCC1CCCC1)Cc1ccon1 ZINC000459336606 203262510 /nfs/dbraw/zinc/26/25/10/203262510.db2.gz IFZPUAGURXQKGQ-UHFFFAOYSA-N 1 2 238.331 2.313 20 0 BEADLO Cc1cc(NC(=O)N[C@@]2(C)CC=CCC2)cc[nH+]1 ZINC000459479051 203287720 /nfs/dbraw/zinc/28/77/20/203287720.db2.gz JHFVNKAKECHAAO-AWEZNQCLSA-N 1 2 245.326 2.432 20 0 BEADLO CCC(F)(F)C[NH2+]Cc1c(C)n[nH]c1C ZINC000623680142 369381606 /nfs/dbraw/zinc/38/16/06/369381606.db2.gz ZJSHUBVFKSJILU-UHFFFAOYSA-N 1 2 217.263 2.161 20 0 BEADLO COC1C[NH+](C/C=C/c2ccc(F)c(F)c2)C1 ZINC000459587494 203306903 /nfs/dbraw/zinc/30/69/03/203306903.db2.gz VJXVOEPKKHKQHB-NSCUHMNNSA-N 1 2 239.265 2.309 20 0 BEADLO CCC(F)(F)C[NH2+]Cc1c(C)nn(C)c1C ZINC000623680373 369389172 /nfs/dbraw/zinc/38/91/72/369389172.db2.gz JMSZJLWCPSRBIQ-UHFFFAOYSA-N 1 2 231.290 2.172 20 0 BEADLO CCOC1(C)C[NH+](Cc2ccccc2OC)C1 ZINC000459609926 203314952 /nfs/dbraw/zinc/31/49/52/203314952.db2.gz JNCYQEHPSKCSFG-UHFFFAOYSA-N 1 2 235.327 2.306 20 0 BEADLO CCC1(CC)C[NH+](Cc2cc(COC)on2)C1 ZINC000459596143 203311297 /nfs/dbraw/zinc/31/12/97/203311297.db2.gz NKJJRQNFUFXVJA-UHFFFAOYSA-N 1 2 238.331 2.443 20 0 BEADLO FC(F)COC1C[NH+](Cc2ccccc2)C1 ZINC000459597855 203312412 /nfs/dbraw/zinc/31/24/12/203312412.db2.gz VYILYHRRMZCION-UHFFFAOYSA-N 1 2 227.254 2.153 20 0 BEADLO CCOC1(C)C[NH+](Cc2ccc(COC)o2)C1 ZINC000459611598 203315971 /nfs/dbraw/zinc/31/59/71/203315971.db2.gz AIUGXLOKYPESKN-UHFFFAOYSA-N 1 2 239.315 2.037 20 0 BEADLO FC(F)OC1C[NH+](Cc2cccs2)C1 ZINC000459627028 203320616 /nfs/dbraw/zinc/32/06/16/203320616.db2.gz JZVRPEGGMFVSLG-UHFFFAOYSA-N 1 2 219.256 2.172 20 0 BEADLO CCOC1CC[NH+](Cc2cscn2)CC1 ZINC000060484709 369487960 /nfs/dbraw/zinc/48/79/60/369487960.db2.gz BMRDACRBAWMLBO-UHFFFAOYSA-N 1 2 226.345 2.144 20 0 BEADLO CCCCc1cc(NCc2ccncc2)nc[nH+]1 ZINC000631030607 370963351 /nfs/dbraw/zinc/96/33/51/370963351.db2.gz RYYBCRSGFIJICE-UHFFFAOYSA-N 1 2 242.326 2.248 20 0 BEADLO CCCCc1cc(NCc2cccnc2)nc[nH+]1 ZINC000631030750 370963417 /nfs/dbraw/zinc/96/34/17/370963417.db2.gz YEQJODAQHXIQSV-UHFFFAOYSA-N 1 2 242.326 2.248 20 0 BEADLO CC(C)(C)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000082277447 370978363 /nfs/dbraw/zinc/97/83/63/370978363.db2.gz XVLOEPCOIRLBAH-LLVKDONJSA-N 1 2 235.331 2.093 20 0 BEADLO CC(C)C[C@H](CO)Nc1cc[nH+]c(C(C)C)n1 ZINC000110587306 369870998 /nfs/dbraw/zinc/87/09/98/369870998.db2.gz AAUZMNAKJSQHBN-LLVKDONJSA-N 1 2 237.347 2.419 20 0 BEADLO CC1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1c[nH+]c[nH]1 ZINC000620429395 369873117 /nfs/dbraw/zinc/87/31/17/369873117.db2.gz NBXWRWSNXCGIER-VGPLMAKISA-N 1 2 247.342 2.132 20 0 BEADLO CC1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1c[nH]c[nH+]1 ZINC000620429395 369873120 /nfs/dbraw/zinc/87/31/20/369873120.db2.gz NBXWRWSNXCGIER-VGPLMAKISA-N 1 2 247.342 2.132 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)CCCn1cc[nH+]c1 ZINC000620500183 369897252 /nfs/dbraw/zinc/89/72/52/369897252.db2.gz YTZJLXRAPPYYRG-GFCCVEGCSA-N 1 2 237.347 2.310 20 0 BEADLO CCC[C@H](C)C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620599356 369948944 /nfs/dbraw/zinc/94/89/44/369948944.db2.gz FHSFOCCWJSLHJA-UWVGGRQHSA-N 1 2 223.320 2.034 20 0 BEADLO C[C@H](NC(=O)[C@H]1[C@@H]2CCCC[C@@H]21)c1[nH+]ccn1C ZINC000620600790 369950193 /nfs/dbraw/zinc/95/01/93/369950193.db2.gz QNGXQCKBWTUPJJ-NNYUYHANSA-N 1 2 247.342 2.034 20 0 BEADLO C[C@H](NC(=O)C[C@@H]1CCC[C@H]1C)c1[nH+]ccn1C ZINC000620604193 369951817 /nfs/dbraw/zinc/95/18/17/369951817.db2.gz PLWXYWWDNCOWNA-WOPDTQHZSA-N 1 2 249.358 2.424 20 0 BEADLO C[C@H](NC(=O)C[C@@H]1CC[C@@H](C)C1)c1[nH+]ccn1C ZINC000620603645 369952019 /nfs/dbraw/zinc/95/20/19/369952019.db2.gz MHDLTLZTUMVMBB-GRYCIOLGSA-N 1 2 249.358 2.424 20 0 BEADLO C[C@H](NC(=O)[C@@H]1CC12CCCC2)c1[nH+]ccn1C ZINC000620603906 369952153 /nfs/dbraw/zinc/95/21/53/369952153.db2.gz OLLLUOGYFIXHCO-QWRGUYRKSA-N 1 2 247.342 2.178 20 0 BEADLO C[C@@H](NC(=O)C1=CCCCC1)c1[nH+]ccn1C ZINC000620605881 369954370 /nfs/dbraw/zinc/95/43/70/369954370.db2.gz LZRFZGSXHYHJGR-SNVBAGLBSA-N 1 2 233.315 2.098 20 0 BEADLO C[C@@H](NC(=O)CCCC1CC1)c1[nH+]ccn1C ZINC000620606874 369956221 /nfs/dbraw/zinc/95/62/21/369956221.db2.gz ANQOJERYDLQQEO-SNVBAGLBSA-N 1 2 235.331 2.178 20 0 BEADLO Cc1csc(C(=O)N[C@H](C)c2[nH+]ccn2C)c1 ZINC000620608970 369957297 /nfs/dbraw/zinc/95/72/97/369957297.db2.gz QNIKAYQPAWKPHE-SECBINFHSA-N 1 2 249.339 2.281 20 0 BEADLO C[C@H](NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]21)c1[nH+]ccn1C ZINC000620609558 369957350 /nfs/dbraw/zinc/95/73/50/369957350.db2.gz SOYZXWBRFOIANK-USZNOCQGSA-N 1 2 247.342 2.034 20 0 BEADLO C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)c1[nH+]ccn1C ZINC000620611182 369957959 /nfs/dbraw/zinc/95/79/59/369957959.db2.gz ZXKBGYWEZMEIAU-UHIISALHSA-N 1 2 249.358 2.424 20 0 BEADLO C[C@H](NC(=O)[C@@]1(C)CCC[C@H]1C)c1[nH+]ccn1C ZINC000620611180 369958133 /nfs/dbraw/zinc/95/81/33/369958133.db2.gz ZXKBGYWEZMEIAU-SUNKGSAMSA-N 1 2 249.358 2.424 20 0 BEADLO C[C@H](NC(=O)C1CC2(CCC2)C1)c1[nH+]ccn1C ZINC000620612226 369958252 /nfs/dbraw/zinc/95/82/52/369958252.db2.gz SAIMIANJTOPDDI-JTQLQIEISA-N 1 2 247.342 2.178 20 0 BEADLO Cc1cn2ccc(NC(=O)[C@@H]3C[C@@H]3C)cc2[nH+]1 ZINC000620648007 369972046 /nfs/dbraw/zinc/97/20/46/369972046.db2.gz QMMAFEVGMXGXAJ-GZMMTYOYSA-N 1 2 229.283 2.237 20 0 BEADLO CCC[C@H](C)CC(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620594313 369946797 /nfs/dbraw/zinc/94/67/97/369946797.db2.gz BXPQXERKYXPIDR-WDEREUQCSA-N 1 2 237.347 2.424 20 0 BEADLO CCc1cc(NC[C@@H](OC)C(C)C)nc[nH+]1 ZINC000075062694 370073590 /nfs/dbraw/zinc/07/35/90/370073590.db2.gz VDNIFNYQDNARAN-LLVKDONJSA-N 1 2 223.320 2.122 20 0 BEADLO CCc1noc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)n1 ZINC000063507407 370171971 /nfs/dbraw/zinc/17/19/71/370171971.db2.gz PNELVCVICSRISE-LLVKDONJSA-N 1 2 246.314 2.297 20 0 BEADLO CCc1noc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)n1 ZINC000063507407 370171976 /nfs/dbraw/zinc/17/19/76/370171976.db2.gz PNELVCVICSRISE-LLVKDONJSA-N 1 2 246.314 2.297 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2cncc(Cl)c2)C1 ZINC000621298791 370223574 /nfs/dbraw/zinc/22/35/74/370223574.db2.gz JRYFUWNJYGGAOV-SNVBAGLBSA-N 1 2 214.671 2.279 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2cncc(Cl)c2)C1 ZINC000621298791 370223576 /nfs/dbraw/zinc/22/35/76/370223576.db2.gz JRYFUWNJYGGAOV-SNVBAGLBSA-N 1 2 214.671 2.279 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@@H](C)c2nc(C)no2)CCS1 ZINC000076072383 370207927 /nfs/dbraw/zinc/20/79/27/370207927.db2.gz PQWIJHQKDFSMLV-WCBMZHEXSA-N 1 2 241.360 2.266 20 0 BEADLO CC[C@@H]1C[N@H+]([C@@H](C)c2nc(C)no2)CCS1 ZINC000076072383 370207931 /nfs/dbraw/zinc/20/79/31/370207931.db2.gz PQWIJHQKDFSMLV-WCBMZHEXSA-N 1 2 241.360 2.266 20 0 BEADLO CCOc1cncc(C[NH2+]Cc2nccs2)c1 ZINC000621329807 370262206 /nfs/dbraw/zinc/26/22/06/370262206.db2.gz POSFQWQVYMZEIS-UHFFFAOYSA-N 1 2 249.339 2.227 20 0 BEADLO CCOc1cncc(C[NH2+]CC(C)(F)F)c1 ZINC000621357376 370291025 /nfs/dbraw/zinc/29/10/25/370291025.db2.gz MIVOSVIVOFQTHQ-UHFFFAOYSA-N 1 2 230.258 2.225 20 0 BEADLO Cc1nccnc1C[NH2+][C@@H](C)c1cscn1 ZINC000621370232 370306389 /nfs/dbraw/zinc/30/63/89/370306389.db2.gz DYAUKRIXYYGBQL-VIFPVBQESA-N 1 2 234.328 2.092 20 0 BEADLO CC[C@H]([NH2+]Cc1cccc2[nH]ccc21)C(=O)OC ZINC000310875215 370369051 /nfs/dbraw/zinc/36/90/51/370369051.db2.gz SKVYQPUUCORVQJ-LBPRGKRZSA-N 1 2 246.310 2.209 20 0 BEADLO Cc1nccnc1C[N@@H+]1CCc2sccc2C1 ZINC000621710441 370456250 /nfs/dbraw/zinc/45/62/50/370456250.db2.gz BBYIDSHPKBTMLJ-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1nccnc1C[N@H+]1CCc2sccc2C1 ZINC000621710441 370456251 /nfs/dbraw/zinc/45/62/51/370456251.db2.gz BBYIDSHPKBTMLJ-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO CC[C@@H]1C[NH+](Cc2nccnc2C)C[C@@H](CC)O1 ZINC000621731488 370486310 /nfs/dbraw/zinc/48/63/10/370486310.db2.gz PSDXWNFCBBXFQC-CHWSQXEVSA-N 1 2 249.358 2.174 20 0 BEADLO C[C@H](CC(=O)OC(C)(C)C)[NH2+]CC(C)(F)F ZINC000378875455 371024043 /nfs/dbraw/zinc/02/40/43/371024043.db2.gz ZDHHPRULIHIDMD-MRVPVSSYSA-N 1 2 237.290 2.352 20 0 BEADLO CCc1cc(NC[C@H](C)C2CC2)nc[nH+]1 ZINC000123462908 371072451 /nfs/dbraw/zinc/07/24/51/371072451.db2.gz XCJLAQRTYCYFIZ-VIFPVBQESA-N 1 2 205.305 2.497 20 0 BEADLO CCCCN(CC)C(=O)[C@H]1CCn2c[nH+]cc2C1 ZINC000372175302 168795931 /nfs/dbraw/zinc/79/59/31/168795931.db2.gz HHEKIGFDIYABFP-LBPRGKRZSA-N 1 2 249.358 2.094 20 0 BEADLO COc1ccc(N[C@@H]2CC[C@H]2SC)[nH+]c1 ZINC000389935789 371182069 /nfs/dbraw/zinc/18/20/69/371182069.db2.gz MWYWSRVHSCUFMA-NXEZZACHSA-N 1 2 224.329 2.396 20 0 BEADLO COc1ccc(N[C@H]2CC[C@H]2SC)[nH+]c1 ZINC000389935791 371182439 /nfs/dbraw/zinc/18/24/39/371182439.db2.gz MWYWSRVHSCUFMA-VHSXEESVSA-N 1 2 224.329 2.396 20 0 BEADLO CCn1ccnc1[C@H](C)[NH2+]Cc1ccns1 ZINC000624047165 371272434 /nfs/dbraw/zinc/27/24/34/371272434.db2.gz YGLSJNMZQWXJAI-VIFPVBQESA-N 1 2 236.344 2.210 20 0 BEADLO COc1ccc[nH+]c1N(C)CCOC(C)(C)C ZINC000624048016 371273250 /nfs/dbraw/zinc/27/32/50/371273250.db2.gz ZTYAITJHKJHZHQ-UHFFFAOYSA-N 1 2 238.331 2.342 20 0 BEADLO COc1ccc[nH+]c1N1CCS[C@@H](C)CC1 ZINC000624157453 371351950 /nfs/dbraw/zinc/35/19/50/371351950.db2.gz LWJVFYXRDBLOEG-JTQLQIEISA-N 1 2 238.356 2.422 20 0 BEADLO CC(C)c1nc(NC[C@@H](C)C[C@@H](C)O)cc[nH+]1 ZINC000156708823 371493043 /nfs/dbraw/zinc/49/30/43/371493043.db2.gz HHCOZSOVPWPIPP-WDEREUQCSA-N 1 2 237.347 2.419 20 0 BEADLO Cc1nc(N2CC[C@H]3CC[C@@H](C2)S3)cc[nH+]1 ZINC000624523353 371530725 /nfs/dbraw/zinc/53/07/25/371530725.db2.gz OTMBIORSKDLSAZ-MNOVXSKESA-N 1 2 235.356 2.259 20 0 BEADLO Oc1ccc(C[NH2+]Cc2nccs2)cc1F ZINC000217825455 372017300 /nfs/dbraw/zinc/01/73/00/372017300.db2.gz OUNHOKQDVKYWKJ-UHFFFAOYSA-N 1 2 238.287 2.278 20 0 BEADLO CCC[N@H+](CCCc1cnn(C)c1)CC(F)F ZINC000133297853 372018955 /nfs/dbraw/zinc/01/89/55/372018955.db2.gz URZLKKXNXZFIMX-UHFFFAOYSA-N 1 2 245.317 2.330 20 0 BEADLO CCC[N@@H+](CCCc1cnn(C)c1)CC(F)F ZINC000133297853 372018959 /nfs/dbraw/zinc/01/89/59/372018959.db2.gz URZLKKXNXZFIMX-UHFFFAOYSA-N 1 2 245.317 2.330 20 0 BEADLO CSc1ccc(NC2CSC2)[nH+]c1 ZINC000306500616 372027512 /nfs/dbraw/zinc/02/75/12/372027512.db2.gz YLRWINAXXGBEJW-UHFFFAOYSA-N 1 2 212.343 2.331 20 0 BEADLO Cc1cccc(C[N@@H+]2CCCC(=O)C2)c1 ZINC000134152853 372168327 /nfs/dbraw/zinc/16/83/27/372168327.db2.gz GKHDQHAKMSRQEF-UHFFFAOYSA-N 1 2 203.285 2.160 20 0 BEADLO Cc1cccc(C[N@H+]2CCCC(=O)C2)c1 ZINC000134152853 372168333 /nfs/dbraw/zinc/16/83/33/372168333.db2.gz GKHDQHAKMSRQEF-UHFFFAOYSA-N 1 2 203.285 2.160 20 0 BEADLO C[C@@]1(O)CCN(c2cc3ccccc3c[nH+]2)C1 ZINC000631146846 372207946 /nfs/dbraw/zinc/20/79/46/372207946.db2.gz LMZMNCFLLUZRLI-CQSZACIVSA-N 1 2 228.295 2.196 20 0 BEADLO CCCCc1cc(NC(C)(C)[C@@H](C)O)nc[nH+]1 ZINC000631185341 372221555 /nfs/dbraw/zinc/22/15/55/372221555.db2.gz WBQVITYYVCEPSO-SNVBAGLBSA-N 1 2 237.347 2.391 20 0 BEADLO CCCCc1cc(N[C@H](C)C[C@H](C)O)nc[nH+]1 ZINC000631203341 372234055 /nfs/dbraw/zinc/23/40/55/372234055.db2.gz OVDQBNGRLRUCMG-MNOVXSKESA-N 1 2 237.347 2.391 20 0 BEADLO O=c1ccc(C[NH2+][C@H]2CCCC2(F)F)c[nH]1 ZINC000631136222 372204604 /nfs/dbraw/zinc/20/46/04/372204604.db2.gz JQPGSPCBNYFQDV-VIFPVBQESA-N 1 2 228.242 2.065 20 0 BEADLO CCCCc1cc(NCCCCF)nc[nH+]1 ZINC000631279527 372275537 /nfs/dbraw/zinc/27/55/37/372275537.db2.gz LVKYDUYLKDRIDG-UHFFFAOYSA-N 1 2 225.311 2.403 20 0 BEADLO O[C@H]1C[C@@H](CNc2cc3ccccc3c[nH+]2)C1 ZINC000631390875 372332812 /nfs/dbraw/zinc/33/28/12/372332812.db2.gz CYRKCDBYWALFGQ-GSJFWJNXSA-N 1 2 228.295 2.418 20 0 BEADLO CC[C@H](CC(=O)NCc1c[nH+]c[nH]1)C(C)(C)C ZINC000631413116 372346873 /nfs/dbraw/zinc/34/68/73/372346873.db2.gz AOENVGVEKLTBHR-SNVBAGLBSA-N 1 2 237.347 2.488 20 0 BEADLO CC[C@H](CC(=O)NCc1c[nH]c[nH+]1)C(C)(C)C ZINC000631413116 372346881 /nfs/dbraw/zinc/34/68/81/372346881.db2.gz AOENVGVEKLTBHR-SNVBAGLBSA-N 1 2 237.347 2.488 20 0 BEADLO Cc1nc(N2CCC(C)(F)CC2)cc[nH+]1 ZINC000631515595 372403925 /nfs/dbraw/zinc/40/39/25/372403925.db2.gz JAFJHOWQQHJXOS-UHFFFAOYSA-N 1 2 209.268 2.113 20 0 BEADLO Cc1cc(N[C@H](C)c2ncccc2F)nc[nH+]1 ZINC000631539714 372414029 /nfs/dbraw/zinc/41/40/29/372414029.db2.gz CWNJXCSRKVTDJU-SECBINFHSA-N 1 2 232.262 2.492 20 0 BEADLO C=C/C=C/CC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001643075088 1172431907 /nfs/dbraw/zinc/43/19/07/1172431907.db2.gz AFIOZLJXZTUOJC-AATRIKPKSA-N 1 2 230.311 2.447 20 0 BEADLO O=C(C[C@@H]1C=CCC1)Nc1cc[nH+]cc1O ZINC000109890892 182014858 /nfs/dbraw/zinc/01/48/58/182014858.db2.gz DFVMDMDVOMIMCP-SECBINFHSA-N 1 2 218.256 2.082 20 0 BEADLO O=C(Cc1ccccc1F)Nc1cc[nH+]cc1O ZINC000109890274 182045458 /nfs/dbraw/zinc/04/54/58/182045458.db2.gz SPMJTUFOUDKSMM-UHFFFAOYSA-N 1 2 246.241 2.108 20 0 BEADLO CCOC(C)(C)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000632810446 373158085 /nfs/dbraw/zinc/15/80/85/373158085.db2.gz IEMPAQCVVMLZFK-UHFFFAOYSA-N 1 2 247.298 2.088 20 0 BEADLO C[C@@H](CC(=O)N[C@@H]1CCCC12CC2)n1cc[nH+]c1 ZINC000633781572 373756862 /nfs/dbraw/zinc/75/68/62/373756862.db2.gz XXLNGENCSGWCIY-NWDGAFQWSA-N 1 2 247.342 2.283 20 0 BEADLO Cc1sccc1NC(=O)CCc1c[nH+]c[nH]1 ZINC000634218085 374039386 /nfs/dbraw/zinc/03/93/86/374039386.db2.gz NSFBUFIFAJPNGF-UHFFFAOYSA-N 1 2 235.312 2.351 20 0 BEADLO Cc1sccc1NC(=O)CCc1c[nH]c[nH+]1 ZINC000634218085 374039392 /nfs/dbraw/zinc/03/93/92/374039392.db2.gz NSFBUFIFAJPNGF-UHFFFAOYSA-N 1 2 235.312 2.351 20 0 BEADLO C[C@@H](CC1CCC1)NC(=O)CCCn1cc[nH+]c1 ZINC000634367804 374213338 /nfs/dbraw/zinc/21/33/38/374213338.db2.gz RCIDVARTLIORRH-LBPRGKRZSA-N 1 2 249.358 2.358 20 0 BEADLO O=C(NCc1cn2ccccc2[nH+]1)C1CCCC1 ZINC000007798870 182268941 /nfs/dbraw/zinc/26/89/41/182268941.db2.gz MEXFFNMJEBHKJN-UHFFFAOYSA-N 1 2 243.310 2.141 20 0 BEADLO CC[C@@H](O)C[NH2+][C@H](Cc1ccccc1)C(F)F ZINC000421879635 206026813 /nfs/dbraw/zinc/02/68/13/206026813.db2.gz PGHPOSOTDIJGIC-VXGBXAGGSA-N 1 2 243.297 2.223 20 0 BEADLO COc1cccc(CCNc2cccc[nH+]2)n1 ZINC000441815930 206081850 /nfs/dbraw/zinc/08/18/50/206081850.db2.gz QFHKJJINAWLMFL-UHFFFAOYSA-N 1 2 229.283 2.140 20 0 BEADLO CC[N@H+](Cc1cc(OC)ccc1F)C1COC1 ZINC000449425445 206097734 /nfs/dbraw/zinc/09/77/34/206097734.db2.gz MSXOIOSDMZBOIM-UHFFFAOYSA-N 1 2 239.290 2.055 20 0 BEADLO CC[N@@H+](Cc1cc(OC)ccc1F)C1COC1 ZINC000449425445 206097739 /nfs/dbraw/zinc/09/77/39/206097739.db2.gz MSXOIOSDMZBOIM-UHFFFAOYSA-N 1 2 239.290 2.055 20 0 BEADLO O=C(Nc1ccsc1)[C@H]1CCc2[nH+]ccn2C1 ZINC000372470211 182390216 /nfs/dbraw/zinc/39/02/16/182390216.db2.gz DOQKNJVHTNPKHD-VIFPVBQESA-N 1 2 247.323 2.146 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)NC1CCCC1 ZINC000281105476 182385736 /nfs/dbraw/zinc/38/57/36/182385736.db2.gz WITLCICDOWYHKJ-UHFFFAOYSA-N 1 2 244.298 2.398 20 0 BEADLO O=C(Nc1cc[nH+]cc1O)c1ccccc1 ZINC000109889276 182388026 /nfs/dbraw/zinc/38/80/26/182388026.db2.gz GBPKFTIEKNEWAM-UHFFFAOYSA-N 1 2 214.224 2.040 20 0 BEADLO O=C(Nc1cc[nH+]cc1O)c1ccc(F)cc1 ZINC000109889564 182388045 /nfs/dbraw/zinc/38/80/45/182388045.db2.gz UMWKOKQBJXNKIN-UHFFFAOYSA-N 1 2 232.214 2.179 20 0 BEADLO O=C(Nc1cc[nH+]cc1O)[C@@H]1CC=CCC1 ZINC000109889244 182388229 /nfs/dbraw/zinc/38/82/29/182388229.db2.gz NODIZMXLOUUCQY-SECBINFHSA-N 1 2 218.256 2.082 20 0 BEADLO OC1C[C@H]2CC[C@@H](C1)N2c1[nH]c2ccccc2[nH+]1 ZINC000111392812 183032536 /nfs/dbraw/zinc/03/25/36/183032536.db2.gz UXBWPRQWMSVSQF-ZACCUICWSA-N 1 2 243.310 2.055 20 0 BEADLO OCC1(Nc2cc[nH+]c(C3CC3)n2)CCCC1 ZINC000301583445 183039733 /nfs/dbraw/zinc/03/97/33/183039733.db2.gz QLWOCPFBRFWLBU-UHFFFAOYSA-N 1 2 233.315 2.071 20 0 BEADLO OCCC[C@@H]([NH2+]Cc1ccon1)c1ccccc1 ZINC000179746317 183063100 /nfs/dbraw/zinc/06/31/00/183063100.db2.gz DOMGQQLYYYABNZ-CQSZACIVSA-N 1 2 246.310 2.278 20 0 BEADLO OCC[N@@H+]1CCc2c(Cl)cc(Cl)cc2C1 ZINC000074449319 183077147 /nfs/dbraw/zinc/07/71/47/183077147.db2.gz DUTYIQFGKZBKNX-UHFFFAOYSA-N 1 2 246.137 2.344 20 0 BEADLO OCC[N@H+]1CCc2c(Cl)cc(Cl)cc2C1 ZINC000074449319 183077148 /nfs/dbraw/zinc/07/71/48/183077148.db2.gz DUTYIQFGKZBKNX-UHFFFAOYSA-N 1 2 246.137 2.344 20 0 BEADLO CCCC[C@H]([NH2+][C@H]1C[C@@H]1CC)C(=O)OC ZINC000300389998 169012723 /nfs/dbraw/zinc/01/27/23/169012723.db2.gz SUSKKCCMRBHPJF-DCAQKATOSA-N 1 2 213.321 2.106 20 0 BEADLO CCCC[C@H]([NH2+][C@@H]1C[C@H]1CC)C(=O)OC ZINC000300390000 169012830 /nfs/dbraw/zinc/01/28/30/169012830.db2.gz SUSKKCCMRBHPJF-OUAUKWLOSA-N 1 2 213.321 2.106 20 0 BEADLO CCCC[C@H]([NH2+][C@@H]1C[C@@H]1C1CC1)C(=O)OC ZINC000310016229 169013351 /nfs/dbraw/zinc/01/33/51/169013351.db2.gz LAWAOYUOLRJIJL-GRYCIOLGSA-N 1 2 225.332 2.106 20 0 BEADLO OC[C@H](Nc1cccc[nH+]1)c1ccccc1 ZINC000063001332 183142128 /nfs/dbraw/zinc/14/21/28/183142128.db2.gz JIVAIDYQEZQKRX-LBPRGKRZSA-N 1 2 214.268 2.227 20 0 BEADLO CCCCc1noc(C[N@@H+]2C[C@@H](C)[C@H]2C)n1 ZINC000339575908 169030738 /nfs/dbraw/zinc/03/07/38/169030738.db2.gz UPQFBEKAWQFDSU-NXEZZACHSA-N 1 2 223.320 2.252 20 0 BEADLO CCCCc1noc(C[N@H+]2C[C@@H](C)[C@H]2C)n1 ZINC000339575908 169030741 /nfs/dbraw/zinc/03/07/41/169030741.db2.gz UPQFBEKAWQFDSU-NXEZZACHSA-N 1 2 223.320 2.252 20 0 BEADLO OC[C@H]1CC(F)(F)C[N@@H+]1CCC1CCCC1 ZINC000372501342 183146703 /nfs/dbraw/zinc/14/67/03/183146703.db2.gz DOADJCOZTDAUSZ-LLVKDONJSA-N 1 2 233.302 2.269 20 0 BEADLO OC[C@H]1CC(F)(F)C[N@H+]1CCC1CCCC1 ZINC000372501342 183146706 /nfs/dbraw/zinc/14/67/06/183146706.db2.gz DOADJCOZTDAUSZ-LLVKDONJSA-N 1 2 233.302 2.269 20 0 BEADLO CCCCn1cc(C[NH2+]Cc2ncc[nH]2)c(C)n1 ZINC000358520508 169036988 /nfs/dbraw/zinc/03/69/88/169036988.db2.gz VOONULAHDLHGDL-UHFFFAOYSA-N 1 2 247.346 2.005 20 0 BEADLO OCc1ccc(-c2ccc3[nH+]ccn3c2)cc1 ZINC000061908665 183161583 /nfs/dbraw/zinc/16/15/83/183161583.db2.gz UTZHNBVMEALLHV-UHFFFAOYSA-N 1 2 224.263 2.494 20 0 BEADLO O[C@H](CCn1cc[nH+]c1)c1ccccc1 ZINC000034061516 183219713 /nfs/dbraw/zinc/21/97/13/183219713.db2.gz WNXUJXHLJQCNMZ-GFCCVEGCSA-N 1 2 202.257 2.007 20 0 BEADLO CCC[N@H+](C)Cc1nn(C)cc1Br ZINC000292629825 169083033 /nfs/dbraw/zinc/08/30/33/169083033.db2.gz NMYIAQWLEBDXIF-UHFFFAOYSA-N 1 2 246.152 2.024 20 0 BEADLO CCC[N@@H+](C)Cc1nn(C)cc1Br ZINC000292629825 169083035 /nfs/dbraw/zinc/08/30/35/169083035.db2.gz NMYIAQWLEBDXIF-UHFFFAOYSA-N 1 2 246.152 2.024 20 0 BEADLO CCCN(C)c1nc(N(C)CCC)c(C)c[nH+]1 ZINC000301538616 169089668 /nfs/dbraw/zinc/08/96/68/169089668.db2.gz BKOPCMDTGBAVPU-UHFFFAOYSA-N 1 2 236.363 2.477 20 0 BEADLO O[C@]1(CNc2cccc[nH+]2)CCc2ccccc21 ZINC000377135659 183251292 /nfs/dbraw/zinc/25/12/92/183251292.db2.gz FTHJXXFMJXCEIP-HNNXBMFYSA-N 1 2 240.306 2.328 20 0 BEADLO CCCN(CC)c1cc(N2CCCC2)nc[nH+]1 ZINC000290842471 169131830 /nfs/dbraw/zinc/13/18/30/169131830.db2.gz WEUSJBZOHMOGPE-UHFFFAOYSA-N 1 2 234.347 2.313 20 0 BEADLO CCCN(CC)c1cc(N2CCCC2)[nH+]cn1 ZINC000290842471 169131833 /nfs/dbraw/zinc/13/18/33/169131833.db2.gz WEUSJBZOHMOGPE-UHFFFAOYSA-N 1 2 234.347 2.313 20 0 BEADLO CCC[N@H+](CCC[C@H](C)O)CC(F)F ZINC000308566301 169155141 /nfs/dbraw/zinc/15/51/41/169155141.db2.gz HUXTYCSOTPIHJE-VIFPVBQESA-N 1 2 209.280 2.125 20 0 BEADLO CCC[N@@H+](CCC[C@H](C)O)CC(F)F ZINC000308566301 169155143 /nfs/dbraw/zinc/15/51/43/169155143.db2.gz HUXTYCSOTPIHJE-VIFPVBQESA-N 1 2 209.280 2.125 20 0 BEADLO c1c[nH+]c(CN2CCOC3(C2)CCCCCC3)[nH]1 ZINC000119566255 183326091 /nfs/dbraw/zinc/32/60/91/183326091.db2.gz MFRZZQDKWPRRDV-UHFFFAOYSA-N 1 2 249.358 2.335 20 0 BEADLO c1cc(-c2nc(C[NH+]3CCCCC3)no2)co1 ZINC000354397155 183330734 /nfs/dbraw/zinc/33/07/34/183330734.db2.gz WQUICLNTPRZEOL-UHFFFAOYSA-N 1 2 233.271 2.316 20 0 BEADLO c1cc(-c2noc([C@H]3CSC[NH2+]3)n2)cs1 ZINC000229003267 183333023 /nfs/dbraw/zinc/33/30/23/183333023.db2.gz ATEKRFXZPKUQGJ-SSDOTTSWSA-N 1 2 239.325 2.133 20 0 BEADLO c1cc(C2CC[NH+](Cc3cnn[nH]3)CC2)cs1 ZINC000294893768 183337147 /nfs/dbraw/zinc/33/71/47/183337147.db2.gz ACXVEBQKLNYJOO-UHFFFAOYSA-N 1 2 248.355 2.246 20 0 BEADLO c1cc(C2CC[NH+](Cc3c[nH]nn3)CC2)cs1 ZINC000294893768 183337148 /nfs/dbraw/zinc/33/71/48/183337148.db2.gz ACXVEBQKLNYJOO-UHFFFAOYSA-N 1 2 248.355 2.246 20 0 BEADLO c1cc(C2CC[NH+](Cc3cn[nH]n3)CC2)cs1 ZINC000294893768 183337151 /nfs/dbraw/zinc/33/71/51/183337151.db2.gz ACXVEBQKLNYJOO-UHFFFAOYSA-N 1 2 248.355 2.246 20 0 BEADLO c1cnn(-c2cccc(Cn3cc[nH+]c3)c2)c1 ZINC000371893774 183356085 /nfs/dbraw/zinc/35/60/85/183356085.db2.gz KKPBEIPRNNSWBV-UHFFFAOYSA-N 1 2 224.267 2.117 20 0 BEADLO c1cc(N[C@H]2CCCOCC2)nc(C2CC2)[nH+]1 ZINC000183003266 183358812 /nfs/dbraw/zinc/35/88/12/183358812.db2.gz YMEYXZXTBOWFCM-NSHDSACASA-N 1 2 233.315 2.335 20 0 BEADLO c1cc([C@H]2CCC[N@H+]2Cc2cnn[nH]2)cs1 ZINC000295458468 183363308 /nfs/dbraw/zinc/36/33/08/183363308.db2.gz HPTVLAPSGYXWPU-LLVKDONJSA-N 1 2 234.328 2.203 20 0 BEADLO c1cc([C@H]2CCC[N@@H+]2Cc2cnn[nH]2)cs1 ZINC000295458468 183363311 /nfs/dbraw/zinc/36/33/11/183363311.db2.gz HPTVLAPSGYXWPU-LLVKDONJSA-N 1 2 234.328 2.203 20 0 BEADLO c1cc([C@H]2CCC[N@H+]2Cc2c[nH]nn2)cs1 ZINC000295458468 183363312 /nfs/dbraw/zinc/36/33/12/183363312.db2.gz HPTVLAPSGYXWPU-LLVKDONJSA-N 1 2 234.328 2.203 20 0 BEADLO c1cc([C@H]2CCC[N@@H+]2Cc2c[nH]nn2)cs1 ZINC000295458468 183363314 /nfs/dbraw/zinc/36/33/14/183363314.db2.gz HPTVLAPSGYXWPU-LLVKDONJSA-N 1 2 234.328 2.203 20 0 BEADLO c1csc(CNc2cc[nH+]c3ccncc23)n1 ZINC000359453586 183363808 /nfs/dbraw/zinc/36/38/08/183363808.db2.gz BTOVSUCSKUJSNJ-UHFFFAOYSA-N 1 2 242.307 2.120 20 0 BEADLO CCCNC(=O)Nc1c(C)cc[nH+]c1C ZINC000287543235 169239169 /nfs/dbraw/zinc/23/91/69/169239169.db2.gz OJGFGDXUVWTVIC-UHFFFAOYSA-N 1 2 207.277 2.230 20 0 BEADLO CCCNC(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000074904711 169239890 /nfs/dbraw/zinc/23/98/90/169239890.db2.gz RPWHZFPGDZOSJG-UHFFFAOYSA-N 1 2 232.287 2.174 20 0 BEADLO c1cc(C[NH2+]CC2(c3ccccn3)CCC2)[nH]n1 ZINC000367597399 183388225 /nfs/dbraw/zinc/38/82/25/183388225.db2.gz NBPAOWNMGWHPLZ-UHFFFAOYSA-N 1 2 242.326 2.016 20 0 BEADLO c1cc(C[NH2+]C2(c3ccccc3)CC2)no1 ZINC000309411223 183389412 /nfs/dbraw/zinc/38/94/12/183389412.db2.gz WQFJWDMDTWCDPW-UHFFFAOYSA-N 1 2 214.268 2.454 20 0 BEADLO CCCOc1cccc(C[NH+]2CCOCC2)c1 ZINC000154491480 169324883 /nfs/dbraw/zinc/32/48/83/169324883.db2.gz ZLUKHMWQTKOZDE-UHFFFAOYSA-N 1 2 235.327 2.308 20 0 BEADLO CCCOc1ncccc1C[NH2+]Cc1cocn1 ZINC000192296607 169328999 /nfs/dbraw/zinc/32/89/99/169328999.db2.gz ITAXJSLIPXPSOK-UHFFFAOYSA-N 1 2 247.298 2.148 20 0 BEADLO CCC[C@@H](C)C[N@@H+]1CC(F)(F)C[C@H]1CO ZINC000372638885 169357404 /nfs/dbraw/zinc/35/74/04/169357404.db2.gz KRENLXVXSYBUCV-ZJUUUORDSA-N 1 2 221.291 2.125 20 0 BEADLO CCC[C@@H](C)C[N@H+]1CC(F)(F)C[C@H]1CO ZINC000372638885 169357406 /nfs/dbraw/zinc/35/74/06/169357406.db2.gz KRENLXVXSYBUCV-ZJUUUORDSA-N 1 2 221.291 2.125 20 0 BEADLO CCC[C@@H](CC)NC(=O)[C@@H]1CCc2[nH+]ccn2C1 ZINC000364983412 169377778 /nfs/dbraw/zinc/37/77/78/169377778.db2.gz BCMISIVXWZTELW-VXGBXAGGSA-N 1 2 249.358 2.140 20 0 BEADLO CCC[C@@H](CNc1cc[nH+]c(C)n1)OC ZINC000293582674 169385833 /nfs/dbraw/zinc/38/58/33/169385833.db2.gz FKNZBLUCHMKKEC-JTQLQIEISA-N 1 2 209.293 2.012 20 0 BEADLO CCC[C@@H]([NH2+]C1Cc2ccccc2C1)C(=O)OC ZINC000354931624 169399241 /nfs/dbraw/zinc/39/92/41/169399241.db2.gz OXZYWFFSKSMDBY-CQSZACIVSA-N 1 2 247.338 2.085 20 0 BEADLO CCc1cn(Cc2cnoc2C2CC2)c[nH+]1 ZINC001644227715 1172534400 /nfs/dbraw/zinc/53/44/00/1172534400.db2.gz NRBZUEIRKUXUOA-UHFFFAOYSA-N 1 2 217.272 2.359 20 0 BEADLO CCC[C@](C)(O)CNc1cc[nH+]c(C2CC2)n1 ZINC000264790510 169554045 /nfs/dbraw/zinc/55/40/45/169554045.db2.gz KOMABEWYJTVEKU-ZDUSSCGKSA-N 1 2 235.331 2.317 20 0 BEADLO C[C@@H]([NH2+]Cc1ncc(Cl)s1)c1cn[nH]c1 ZINC000225376261 134354732 /nfs/dbraw/zinc/35/47/32/134354732.db2.gz ZEBFLNRGQOPMGG-ZCFIWIBFSA-N 1 2 242.735 2.370 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C[C@H]1CCCCO1 ZINC000087322208 383826175 /nfs/dbraw/zinc/82/61/75/383826175.db2.gz HSPKEAIKAHBRHT-LLVKDONJSA-N 1 2 234.299 2.288 20 0 BEADLO Cc1ccnc(NCCc2[nH+]cccc2C)n1 ZINC000295836707 383861709 /nfs/dbraw/zinc/86/17/09/383861709.db2.gz WOWFAAFACDHLQZ-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO C[C@H]([NH2+]Cc1ccon1)c1cccc(O)c1 ZINC000088052599 383877143 /nfs/dbraw/zinc/87/71/43/383877143.db2.gz JOKXFHRJZLUZOQ-VIFPVBQESA-N 1 2 218.256 2.231 20 0 BEADLO Cn1ccc(C[NH2+]Cc2ccccc2Cl)n1 ZINC000112337342 383915242 /nfs/dbraw/zinc/91/52/42/383915242.db2.gz ARIUCTAQPKUARS-UHFFFAOYSA-N 1 2 235.718 2.363 20 0 BEADLO C[C@@H]1CSC[C@H]1[NH2+]Cc1nnsc1Cl ZINC000306438481 383981491 /nfs/dbraw/zinc/98/14/91/383981491.db2.gz GKZJCFLPNOTJGV-IYSWYEEDSA-N 1 2 249.792 2.033 20 0 BEADLO CC[C@](C)(CNc1[nH+]cccc1OC)OC ZINC000323178961 383982428 /nfs/dbraw/zinc/98/24/28/383982428.db2.gz ZENGKRMHLQPUJT-GFCCVEGCSA-N 1 2 224.304 2.317 20 0 BEADLO Cc1cc(C)n(Cc2[nH+]ccn2C(F)F)n1 ZINC000113592329 383997459 /nfs/dbraw/zinc/99/74/59/383997459.db2.gz XYHCLUMLZPUFHH-UHFFFAOYSA-N 1 2 226.230 2.140 20 0 BEADLO CC(C)(C)OC(=O)C[N@@H+]1CCc2ccccc2C1 ZINC000070921111 383960516 /nfs/dbraw/zinc/96/05/16/383960516.db2.gz PKRKEAMWYYTMNI-UHFFFAOYSA-N 1 2 247.338 2.386 20 0 BEADLO CC(C)(C)OC(=O)C[N@H+]1CCc2ccccc2C1 ZINC000070921111 383960522 /nfs/dbraw/zinc/96/05/22/383960522.db2.gz PKRKEAMWYYTMNI-UHFFFAOYSA-N 1 2 247.338 2.386 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccnn1CC)C(F)F ZINC000449357085 383964450 /nfs/dbraw/zinc/96/44/50/383964450.db2.gz BLFFXJWVZJGGCX-SECBINFHSA-N 1 2 217.263 2.036 20 0 BEADLO c1ccc2nc(C[NH+]3CCOCC3)ccc2c1 ZINC000072816287 384024647 /nfs/dbraw/zinc/02/46/47/384024647.db2.gz FKOIGGMKPCRMPX-UHFFFAOYSA-N 1 2 228.295 2.067 20 0 BEADLO Cc1ccoc1C[NH2+][C@H](C)c1cnccn1 ZINC000293888359 384009681 /nfs/dbraw/zinc/00/96/81/384009681.db2.gz ZBAMMIVOMMAICL-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO CCCCNC(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000024050183 384051850 /nfs/dbraw/zinc/05/18/50/384051850.db2.gz ULXKWEMXCOOPNO-UHFFFAOYSA-N 1 2 243.310 2.402 20 0 BEADLO CC(C)C(C[N@H+]1CC(=O)N(C2CC2)C1)C(C)C ZINC000560276179 384033137 /nfs/dbraw/zinc/03/31/37/384033137.db2.gz JOQVLCWSBLJJKV-UHFFFAOYSA-N 1 2 238.375 2.179 20 0 BEADLO CC(C)C(C[N@@H+]1CC(=O)N(C2CC2)C1)C(C)C ZINC000560276179 384033145 /nfs/dbraw/zinc/03/31/45/384033145.db2.gz JOQVLCWSBLJJKV-UHFFFAOYSA-N 1 2 238.375 2.179 20 0 BEADLO CCC[C@H]([NH2+]Cc1ncn(C)n1)c1ccccc1 ZINC000090969175 384085640 /nfs/dbraw/zinc/08/56/40/384085640.db2.gz ARXCZQNPRCAGNK-ZDUSSCGKSA-N 1 2 244.342 2.446 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2ncn(C)n2)c(C)c1 ZINC000090969168 384085831 /nfs/dbraw/zinc/08/58/31/384085831.db2.gz BKQPJCZCVJTOOV-LBPRGKRZSA-N 1 2 244.342 2.283 20 0 BEADLO Cc1nonc1C[NH2+][C@H](C)c1ccccc1 ZINC000069794436 384063641 /nfs/dbraw/zinc/06/36/41/384063641.db2.gz GFJAIFWWPYVEQA-SECBINFHSA-N 1 2 217.272 2.229 20 0 BEADLO Cn1c2cc(F)ccc2[nH]c1=[NH+]CC1(F)CC1 ZINC000530474441 384108925 /nfs/dbraw/zinc/10/89/25/384108925.db2.gz NEKDDTRSLROCBH-UHFFFAOYSA-N 1 2 237.253 2.048 20 0 BEADLO C(c1noc(C2CC2)n1)[NH+]1C[C@H]2CCC[C@@H]2C1 ZINC000152991374 384124343 /nfs/dbraw/zinc/12/43/43/384124343.db2.gz KHKUQRCWZRZCKS-GHMZBOCLSA-N 1 2 233.315 2.179 20 0 BEADLO CC(C)[C@@H]([NH2+]Cc1ncn(C)n1)c1ccccc1 ZINC000091409994 384126632 /nfs/dbraw/zinc/12/66/32/384126632.db2.gz BDHVAPRGOLBVIC-CQSZACIVSA-N 1 2 244.342 2.302 20 0 BEADLO CC[C@@H](Cc1ccccc1)[NH2+][C@H](C)C(=O)OC ZINC000116386842 384129981 /nfs/dbraw/zinc/12/99/81/384129981.db2.gz HTEJEKCFBZISRP-YPMHNXCESA-N 1 2 235.327 2.159 20 0 BEADLO CCc1ccc(C[N@@H+]2CCOC[C@@H]2C)o1 ZINC000091810355 384147485 /nfs/dbraw/zinc/14/74/85/384147485.db2.gz JGDRIDWRANFWAT-JTQLQIEISA-N 1 2 209.289 2.063 20 0 BEADLO CCc1ccc(C[N@H+]2CCOC[C@@H]2C)o1 ZINC000091810355 384147488 /nfs/dbraw/zinc/14/74/88/384147488.db2.gz JGDRIDWRANFWAT-JTQLQIEISA-N 1 2 209.289 2.063 20 0 BEADLO CCOCCNc1cc(C)[nH+]c(C(C)C)n1 ZINC000036229997 384184562 /nfs/dbraw/zinc/18/45/62/384184562.db2.gz GVEZPMKAHGBULJ-UHFFFAOYSA-N 1 2 223.320 2.357 20 0 BEADLO Cc1ccc([C@H](C)[N@H+](C)Cc2n[nH]c(=O)[nH]2)cc1 ZINC000092617476 384185961 /nfs/dbraw/zinc/18/59/61/384185961.db2.gz XESWEHBGKXYUTH-JTQLQIEISA-N 1 2 246.314 2.012 20 0 BEADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2n[nH]c(=O)[nH]2)cc1 ZINC000092617476 384185962 /nfs/dbraw/zinc/18/59/62/384185962.db2.gz XESWEHBGKXYUTH-JTQLQIEISA-N 1 2 246.314 2.012 20 0 BEADLO CCN(CC(C)(C)O)c1[nH+]c2ccccc2n1C ZINC000092970438 384203146 /nfs/dbraw/zinc/20/31/46/384203146.db2.gz SEQGHZZRXVLLPJ-UHFFFAOYSA-N 1 2 247.342 2.171 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2cccc3c2OCO3)[C@H]1C ZINC000093417974 384234648 /nfs/dbraw/zinc/23/46/48/384234648.db2.gz RQZBXNASQJACQK-WDEREUQCSA-N 1 2 249.310 2.025 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2cccc3c2OCO3)[C@H]1C ZINC000093417974 384234654 /nfs/dbraw/zinc/23/46/54/384234654.db2.gz RQZBXNASQJACQK-WDEREUQCSA-N 1 2 249.310 2.025 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@@H+]1Cc1cccc2c1OCO2 ZINC000093417971 384236502 /nfs/dbraw/zinc/23/65/02/384236502.db2.gz RQZBXNASQJACQK-MNOVXSKESA-N 1 2 249.310 2.025 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1cccc2c1OCO2 ZINC000093417971 384236506 /nfs/dbraw/zinc/23/65/06/384236506.db2.gz RQZBXNASQJACQK-MNOVXSKESA-N 1 2 249.310 2.025 20 0 BEADLO CC1(C(=O)N2CCn3c[nH+]cc3C2)CCCCC1 ZINC000336600710 384209039 /nfs/dbraw/zinc/20/90/39/384209039.db2.gz LLIGJUBQDYSNKT-UHFFFAOYSA-N 1 2 247.342 2.196 20 0 BEADLO CC[C@H]([NH2+]Cc1ccco1)c1nccn1C ZINC000132084479 384214946 /nfs/dbraw/zinc/21/49/46/384214946.db2.gz DKMFVBBDEGETLJ-NSHDSACASA-N 1 2 219.288 2.254 20 0 BEADLO Cc1cc(N2CCC(c3ncco3)CC2)nc[nH+]1 ZINC000585577383 384219010 /nfs/dbraw/zinc/21/90/10/384219010.db2.gz VDYDHEMOKPDSSI-UHFFFAOYSA-N 1 2 244.298 2.157 20 0 BEADLO CCc1cc(N[C@H]2[C@@H](C)[C@H](C)O[C@H]2C)nc[nH+]1 ZINC000624635071 384221164 /nfs/dbraw/zinc/22/11/64/384221164.db2.gz ZTDPNDDMCRQTDQ-YVNDNENWSA-N 1 2 235.331 2.263 20 0 BEADLO CSC1(C[NH2+][C@@H](C)C(=O)OC(C)(C)C)CC1 ZINC000227936043 134399885 /nfs/dbraw/zinc/39/98/85/134399885.db2.gz HKZYLZPLPNRLNB-VIFPVBQESA-N 1 2 245.388 2.202 20 0 BEADLO COC(=O)[C@H](c1ccccc1F)[NH+]1CCCC1 ZINC000072555242 384225632 /nfs/dbraw/zinc/22/56/32/384225632.db2.gz ASLFAEFTQAHOJT-LBPRGKRZSA-N 1 2 237.274 2.136 20 0 BEADLO CC(C)n1cc[nH+]c1CN(C)Cc1cccnc1 ZINC000119053592 384226718 /nfs/dbraw/zinc/22/67/18/384226718.db2.gz KECDSSDCZDFILH-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO Cc1cnccc1C[NH+]1C[C@@H](C)C(=O)[C@H](C)C1 ZINC000625553787 384256513 /nfs/dbraw/zinc/25/65/13/384256513.db2.gz POLIJTGFGIMAAE-VXGBXAGGSA-N 1 2 232.327 2.047 20 0 BEADLO CC[C@@H](C)CC(=O)N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000358940731 384305433 /nfs/dbraw/zinc/30/54/33/384305433.db2.gz WXCZDIOEIYXFSW-VXGBXAGGSA-N 1 2 249.358 2.172 20 0 BEADLO O=C1OCC[C@H]1[NH2+][C@@H]1CCC[C@H]1c1ccccc1 ZINC000133840982 384312749 /nfs/dbraw/zinc/31/27/49/384312749.db2.gz RXOBDHXPNJRYJJ-BFHYXJOUSA-N 1 2 245.322 2.228 20 0 BEADLO CC(=O)NCc1ccc2c(c1)[nH+]c(C1CC1)n2C ZINC000074999119 384316541 /nfs/dbraw/zinc/31/65/41/384316541.db2.gz VMWQZONHVOMPQC-UHFFFAOYSA-N 1 2 243.310 2.087 20 0 BEADLO Fc1ccc2c(c1)CN(Cc1[nH]cc[nH+]1)CC2 ZINC000133940699 384320034 /nfs/dbraw/zinc/32/00/34/384320034.db2.gz CTLCHYHPSXKVKE-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO CCN(CC)C(=O)Nc1cc[nH+]c(C)c1 ZINC000119552740 384284598 /nfs/dbraw/zinc/28/45/98/384284598.db2.gz VLSNCOSTGMYWKT-UHFFFAOYSA-N 1 2 207.277 2.264 20 0 BEADLO C[C@H]1CCCC[N@H+](CCOC[C@@H]2CCCO2)C1 ZINC000558786881 384289833 /nfs/dbraw/zinc/28/98/33/384289833.db2.gz ZEHJDQUCMXJRHV-KBPBESRZSA-N 1 2 241.375 2.304 20 0 BEADLO C[C@H]1CCCC[N@@H+](CCOC[C@@H]2CCCO2)C1 ZINC000558786881 384289849 /nfs/dbraw/zinc/28/98/49/384289849.db2.gz ZEHJDQUCMXJRHV-KBPBESRZSA-N 1 2 241.375 2.304 20 0 BEADLO COc1ccc(C[NH2+]CC(F)F)cc1F ZINC000147401336 384295117 /nfs/dbraw/zinc/29/51/17/384295117.db2.gz LYKKIXNUKLZTTQ-UHFFFAOYSA-N 1 2 219.206 2.189 20 0 BEADLO Cc1cnc(C[N@H+]2CCS[C@@H](C)[C@@H]2C)o1 ZINC000075748950 384336058 /nfs/dbraw/zinc/33/60/58/384336058.db2.gz JTTHPDBOZDSYHQ-UWVGGRQHSA-N 1 2 226.345 2.309 20 0 BEADLO Cc1cnc(C[N@@H+]2CCS[C@@H](C)[C@@H]2C)o1 ZINC000075748950 384336061 /nfs/dbraw/zinc/33/60/61/384336061.db2.gz JTTHPDBOZDSYHQ-UWVGGRQHSA-N 1 2 226.345 2.309 20 0 BEADLO CS[C@@H](C)CNC(=O)Nc1cc[nH+]c(C)c1 ZINC000120254821 384340703 /nfs/dbraw/zinc/34/07/03/384340703.db2.gz MMRYCNRAQBHJNQ-VIFPVBQESA-N 1 2 239.344 2.263 20 0 BEADLO Nc1[nH+]cnc(N[C@H]2CCC[C@@H]3C[C@@H]32)c1Cl ZINC000560821182 384369452 /nfs/dbraw/zinc/36/94/52/384369452.db2.gz KQVLKQOJDRTBTP-CSMHCCOUSA-N 1 2 238.722 2.313 20 0 BEADLO Nc1nc[nH+]c(N[C@H]2CCC[C@@H]3C[C@@H]32)c1Cl ZINC000560821182 384369457 /nfs/dbraw/zinc/36/94/57/384369457.db2.gz KQVLKQOJDRTBTP-CSMHCCOUSA-N 1 2 238.722 2.313 20 0 BEADLO CCC1(CC)CN(C(=O)CCCn2cc[nH+]c2)C1 ZINC000647225905 384374944 /nfs/dbraw/zinc/37/49/44/384374944.db2.gz SKRVNVZCRBEIBZ-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO CC[N@@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000143483544 384324481 /nfs/dbraw/zinc/32/44/81/384324481.db2.gz LYUVEEPASYTAOU-LBPRGKRZSA-N 1 2 227.254 2.358 20 0 BEADLO CC[N@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000143483544 384324483 /nfs/dbraw/zinc/32/44/83/384324483.db2.gz LYUVEEPASYTAOU-LBPRGKRZSA-N 1 2 227.254 2.358 20 0 BEADLO C[C@@H]1OCC[C@@H]1Nc1ccc([NH+](C)C)cc1 ZINC000134086526 384331332 /nfs/dbraw/zinc/33/13/32/384331332.db2.gz CVTSBAJUQSYEHV-GWCFXTLKSA-N 1 2 220.316 2.342 20 0 BEADLO Cn1c[nH+]cc1COc1cc(F)ccc1F ZINC000334212615 384393030 /nfs/dbraw/zinc/39/30/30/384393030.db2.gz RSWCNHSXXJYSFJ-UHFFFAOYSA-N 1 2 224.210 2.277 20 0 BEADLO C[N@@H+](Cc1nccs1)C[C@H](O)c1ccccc1 ZINC000175071339 384393204 /nfs/dbraw/zinc/39/32/04/384393204.db2.gz MPBDFXRLSCGYNP-LBPRGKRZSA-N 1 2 248.351 2.309 20 0 BEADLO C[N@H+](Cc1nccs1)C[C@H](O)c1ccccc1 ZINC000175071339 384393212 /nfs/dbraw/zinc/39/32/12/384393212.db2.gz MPBDFXRLSCGYNP-LBPRGKRZSA-N 1 2 248.351 2.309 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2cncc(C)c2)s1 ZINC000276004352 384427189 /nfs/dbraw/zinc/42/71/89/384427189.db2.gz IKFKQJSLNGDYCD-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2ncn(C)n2)cc1F ZINC000275874860 384422604 /nfs/dbraw/zinc/42/26/04/384422604.db2.gz WBONFDRPZBUZJK-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO Fc1cccn2cc(C[NH+]3CC(C4CC4)C3)nc12 ZINC000643346068 384423276 /nfs/dbraw/zinc/42/32/76/384423276.db2.gz ZBGCLUUSIUDMJI-UHFFFAOYSA-N 1 2 245.301 2.315 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CCC[C@H]1C ZINC000121520373 384423714 /nfs/dbraw/zinc/42/37/14/384423714.db2.gz UGGRUFALNXBHOQ-SNVBAGLBSA-N 1 2 219.288 2.406 20 0 BEADLO Cc1nc(CN[C@H]2C[C@@H](C)n3cc[nH+]c32)cs1 ZINC000334190543 384382174 /nfs/dbraw/zinc/38/21/74/384382174.db2.gz HILWBYJASABZGC-KCJUWKMLSA-N 1 2 248.355 2.444 20 0 BEADLO Cc1nc(N2CCc3ccc(F)cc3C2)cc[nH+]1 ZINC000135558593 384451320 /nfs/dbraw/zinc/45/13/20/384451320.db2.gz RNCNKDRWODTXRH-UHFFFAOYSA-N 1 2 243.285 2.487 20 0 BEADLO C[C@H](O)CCNc1cc(C(F)(F)F)cc[nH+]1 ZINC000078612491 384451798 /nfs/dbraw/zinc/45/17/98/384451798.db2.gz JYWKQWNHMZTOPW-ZETCQYMHSA-N 1 2 234.221 2.283 20 0 BEADLO CCCCCc1nc(Cc2c[nH+]cn2C)no1 ZINC000357940842 384453226 /nfs/dbraw/zinc/45/32/26/384453226.db2.gz XHFLPZVOJITVGN-UHFFFAOYSA-N 1 2 234.303 2.127 20 0 BEADLO Cc1nc(NC[C@](C)(O)c2ccccc2)cc[nH+]1 ZINC000078260768 384438407 /nfs/dbraw/zinc/43/84/07/384438407.db2.gz AQCSGXXUFXGUHP-AWEZNQCLSA-N 1 2 243.310 2.105 20 0 BEADLO CC[C@]1(CO)CCCN(c2nc(C)[nH+]cc2C)C1 ZINC000564585378 384439135 /nfs/dbraw/zinc/43/91/35/384439135.db2.gz JPLIMXBJCLYKIK-AWEZNQCLSA-N 1 2 249.358 2.082 20 0 BEADLO CCC[C@H](C(=O)OCC)[N@H+](C)Cc1ccco1 ZINC000096593397 384468212 /nfs/dbraw/zinc/46/82/12/384468212.db2.gz KSKTWYTYJINRTQ-GFCCVEGCSA-N 1 2 239.315 2.443 20 0 BEADLO CCC[C@H](C(=O)OCC)[N@@H+](C)Cc1ccco1 ZINC000096593397 384468220 /nfs/dbraw/zinc/46/82/20/384468220.db2.gz KSKTWYTYJINRTQ-GFCCVEGCSA-N 1 2 239.315 2.443 20 0 BEADLO COC[C@H](C)[NH2+]CC(F)(F)c1ccccc1 ZINC000161166152 384469735 /nfs/dbraw/zinc/46/97/35/384469735.db2.gz UYPQCCVIKHYSQM-JTQLQIEISA-N 1 2 229.270 2.403 20 0 BEADLO COC[C@H](C)Sc1[nH+]cc2ccccn21 ZINC000078940715 384473682 /nfs/dbraw/zinc/47/36/82/384473682.db2.gz CMYSQRYPRFLROX-VIFPVBQESA-N 1 2 222.313 2.461 20 0 BEADLO Cc1cn2cc(NC(=O)[C@H]3CC34CC4)ccc2[nH+]1 ZINC000335006613 384478607 /nfs/dbraw/zinc/47/86/07/384478607.db2.gz SMYCLQOVZJPLPA-LLVKDONJSA-N 1 2 241.294 2.381 20 0 BEADLO COC(=O)[C@H]([NH2+]C(C)C)c1ccccc1C ZINC000037445976 384497967 /nfs/dbraw/zinc/49/79/67/384497967.db2.gz ZDDJQLMVOGRMHE-GFCCVEGCSA-N 1 2 221.300 2.207 20 0 BEADLO FC(F)(F)C1C[NH+](CCc2cncs2)C1 ZINC000556809831 384500160 /nfs/dbraw/zinc/50/01/60/384500160.db2.gz DKXWURHZOYVUBP-UHFFFAOYSA-N 1 2 236.262 2.180 20 0 BEADLO C[C@@H]1CC(C)(C)CC[C@H]1NC(=O)Cn1cc[nH+]c1 ZINC000517793646 384509352 /nfs/dbraw/zinc/50/93/52/384509352.db2.gz JFNXMCPIFQMPMK-VXGBXAGGSA-N 1 2 249.358 2.214 20 0 BEADLO CCCc1nc(C[N@@H+]2CC[C@H](C3CC3)C2)no1 ZINC000363491104 384486841 /nfs/dbraw/zinc/48/68/41/384486841.db2.gz SFTJBCKITFLDQX-NSHDSACASA-N 1 2 235.331 2.254 20 0 BEADLO CCCc1nc(C[N@H+]2CC[C@H](C3CC3)C2)no1 ZINC000363491104 384486845 /nfs/dbraw/zinc/48/68/45/384486845.db2.gz SFTJBCKITFLDQX-NSHDSACASA-N 1 2 235.331 2.254 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)CC(F)(F)F ZINC000049315984 384530255 /nfs/dbraw/zinc/53/02/55/384530255.db2.gz ORBLKYRNBBVYIO-UHFFFAOYSA-N 1 2 247.220 2.039 20 0 BEADLO c1nc(C[N@@H+]2CCOCC23CCCC3)cs1 ZINC000270658239 384541960 /nfs/dbraw/zinc/54/19/60/384541960.db2.gz PZTBGSRYOIBVEU-UHFFFAOYSA-N 1 2 238.356 2.288 20 0 BEADLO c1nc(C[N@H+]2CCOCC23CCCC3)cs1 ZINC000270658239 384541964 /nfs/dbraw/zinc/54/19/64/384541964.db2.gz PZTBGSRYOIBVEU-UHFFFAOYSA-N 1 2 238.356 2.288 20 0 BEADLO CC[C@H](CC(F)(F)F)[NH2+][C@@H](CC)C(=O)OC ZINC000309713873 384556494 /nfs/dbraw/zinc/55/64/94/384556494.db2.gz RXZANDMCPBAYPD-SFYZADRCSA-N 1 2 241.253 2.259 20 0 BEADLO Cc1nc(N[C@H]2CCCCC2(C)C)nc(N)[nH+]1 ZINC000306075709 384569400 /nfs/dbraw/zinc/56/94/00/384569400.db2.gz FZECCWJDTOMMLZ-VIFPVBQESA-N 1 2 235.335 2.143 20 0 BEADLO Cc1nc(N)nc(N[C@H]2CCCCC2(C)C)[nH+]1 ZINC000306075709 384569406 /nfs/dbraw/zinc/56/94/06/384569406.db2.gz FZECCWJDTOMMLZ-VIFPVBQESA-N 1 2 235.335 2.143 20 0 BEADLO CCc1cc(N2CCC[C@@H]2CF)nc(C)[nH+]1 ZINC000294275935 384587662 /nfs/dbraw/zinc/58/76/62/384587662.db2.gz XNAFVXXICBUNMW-LLVKDONJSA-N 1 2 223.295 2.286 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000041075547 384606717 /nfs/dbraw/zinc/60/67/17/384606717.db2.gz GGMDXINXOTWOCY-GWCFXTLKSA-N 1 2 233.311 2.289 20 0 BEADLO CC(C)n1ccc(C[N@@H+]2CCSC[C@H]2C)n1 ZINC000172589610 384608480 /nfs/dbraw/zinc/60/84/80/384608480.db2.gz XLSZLJIRFGBLMA-LLVKDONJSA-N 1 2 239.388 2.401 20 0 BEADLO CC(C)n1ccc(C[N@H+]2CCSC[C@H]2C)n1 ZINC000172589610 384608487 /nfs/dbraw/zinc/60/84/87/384608487.db2.gz XLSZLJIRFGBLMA-LLVKDONJSA-N 1 2 239.388 2.401 20 0 BEADLO Cn1cc[nH+]c1CN1CC2(CC2)c2ccccc21 ZINC000172641478 384610933 /nfs/dbraw/zinc/61/09/33/384610933.db2.gz MVUHTIYRXLDERF-UHFFFAOYSA-N 1 2 239.322 2.472 20 0 BEADLO CN(CC[N@H+](C)Cc1ccon1)c1ccccc1 ZINC000172656551 384614201 /nfs/dbraw/zinc/61/42/01/384614201.db2.gz QNYLJKPEFQFOTA-UHFFFAOYSA-N 1 2 245.326 2.243 20 0 BEADLO CN(CC[N@@H+](C)Cc1ccon1)c1ccccc1 ZINC000172656551 384614210 /nfs/dbraw/zinc/61/42/10/384614210.db2.gz QNYLJKPEFQFOTA-UHFFFAOYSA-N 1 2 245.326 2.243 20 0 BEADLO CC(C)C[C@H](C)C(=O)NCCCn1cc[nH+]c1 ZINC000184641770 384630484 /nfs/dbraw/zinc/63/04/84/384630484.db2.gz BVLZYQFELNCMQL-LBPRGKRZSA-N 1 2 237.347 2.072 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1C[C@H]1C1CCC1)c1[nH]cc[nH+]1 ZINC000517961345 384592427 /nfs/dbraw/zinc/59/24/27/384592427.db2.gz PYHUWBXWQZRFJM-DVVUODLYSA-N 1 2 233.315 2.023 20 0 BEADLO Cc1ccc(COCc2[nH]cc[nH+]2)cc1 ZINC000123885713 384595726 /nfs/dbraw/zinc/59/57/26/384595726.db2.gz LGVQBHWLEADQIX-UHFFFAOYSA-N 1 2 202.257 2.435 20 0 BEADLO C[N@H+](Cc1ccc(Cl)nc1)Cc1cnccn1 ZINC000080965413 384598381 /nfs/dbraw/zinc/59/83/81/384598381.db2.gz ZQHRAXHDQYEBFF-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[N@@H+](Cc1ccc(Cl)nc1)Cc1cnccn1 ZINC000080965413 384598389 /nfs/dbraw/zinc/59/83/89/384598389.db2.gz ZQHRAXHDQYEBFF-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO CSCC[N@@H+]1CCCC[C@H]1C(F)F ZINC000336657724 384670344 /nfs/dbraw/zinc/67/03/44/384670344.db2.gz RFMDBOXOPHDLMA-QMMMGPOBSA-N 1 2 209.305 2.469 20 0 BEADLO CSCC[N@H+]1CCCC[C@H]1C(F)F ZINC000336657724 384670347 /nfs/dbraw/zinc/67/03/47/384670347.db2.gz RFMDBOXOPHDLMA-QMMMGPOBSA-N 1 2 209.305 2.469 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2cc[nH]c2)s1 ZINC000336749098 384676484 /nfs/dbraw/zinc/67/64/84/384676484.db2.gz DUJCZZGWINYEOT-SSDOTTSWSA-N 1 2 222.317 2.025 20 0 BEADLO C[C@H]([NH2+]CC(F)(F)CO)c1cccc(F)c1 ZINC000184690431 384636312 /nfs/dbraw/zinc/63/63/12/384636312.db2.gz OFGAILZYNGVPMG-QMMMGPOBSA-N 1 2 233.233 2.104 20 0 BEADLO CC[C@@]1(C)C[C@H]1C(=O)Nc1ccc(N)[nH+]c1 ZINC000151655350 384675073 /nfs/dbraw/zinc/67/50/73/384675073.db2.gz KNNQVXVVDABOJS-CABZTGNLSA-N 1 2 219.288 2.039 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]CC(F)(F)CO)cc1 ZINC000184702910 384638662 /nfs/dbraw/zinc/63/86/62/384638662.db2.gz RGIXNPUHWLNABY-JTQLQIEISA-N 1 2 229.270 2.273 20 0 BEADLO Cc1cc(N[C@@H]2CC[C@H]3C[C@H]3C2)nc[nH+]1 ZINC000403342031 384639217 /nfs/dbraw/zinc/63/92/17/384639217.db2.gz GLUHDDIKXXCGCN-GARJFASQSA-N 1 2 203.289 2.386 20 0 BEADLO CC[C@@H](C)C[N@@H+]1CCOCC(F)(F)C1 ZINC000367988419 384646455 /nfs/dbraw/zinc/64/64/55/384646455.db2.gz KNNJKYCLOURFIU-SECBINFHSA-N 1 2 207.264 2.000 20 0 BEADLO CC[C@@H](C)C[N@H+]1CCOCC(F)(F)C1 ZINC000367988419 384646462 /nfs/dbraw/zinc/64/64/62/384646462.db2.gz KNNJKYCLOURFIU-SECBINFHSA-N 1 2 207.264 2.000 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CCO[C@@H](C)C1 ZINC000225869238 384652567 /nfs/dbraw/zinc/65/25/67/384652567.db2.gz AECSODVLXSMCGU-VHSXEESVSA-N 1 2 222.288 2.070 20 0 BEADLO O=C(c1ccc[nH]1)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000082277636 384660993 /nfs/dbraw/zinc/66/09/93/384660993.db2.gz VOPLBJLXXAYFHL-NSHDSACASA-N 1 2 244.298 2.105 20 0 BEADLO O=C(c1ccco1)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000082277782 384661111 /nfs/dbraw/zinc/66/11/11/384661111.db2.gz YSACLTZOBSWQGO-JTQLQIEISA-N 1 2 245.282 2.023 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC[C@@H]2c2ccncc2)o1 ZINC000162746910 384680719 /nfs/dbraw/zinc/68/07/19/384680719.db2.gz UFGRBMVROJMMON-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1nnc(C[N@H+]2CCC[C@@H]2c2ccncc2)o1 ZINC000162746910 384680726 /nfs/dbraw/zinc/68/07/26/384680726.db2.gz UFGRBMVROJMMON-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+]Cc2cnn(C)c2)s1 ZINC000125188414 384701389 /nfs/dbraw/zinc/70/13/89/384701389.db2.gz MDNQQOUSQBWEQS-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO CCSCCCNc1cc(C)[nH+]cn1 ZINC000300922674 384710831 /nfs/dbraw/zinc/71/08/31/384710831.db2.gz LLWRNDHVYIYDAY-UHFFFAOYSA-N 1 2 211.334 2.340 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)CC1CCC1 ZINC000173740963 384714092 /nfs/dbraw/zinc/71/40/92/384714092.db2.gz CPNBGHGRDSBCAF-UHFFFAOYSA-N 1 2 233.315 2.276 20 0 BEADLO COC[C@@H](C)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000309918172 384714237 /nfs/dbraw/zinc/71/42/37/384714237.db2.gz QOCRXQOBPRVQIJ-SECBINFHSA-N 1 2 221.304 2.109 20 0 BEADLO CC[C@@H](C)C(=O)N1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000125557142 384729272 /nfs/dbraw/zinc/72/92/72/384729272.db2.gz SBYAQSCPLYVKQA-JHJVBQTASA-N 1 2 249.358 2.339 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1CCC[C@@H](O)C1 ZINC000227692806 384741343 /nfs/dbraw/zinc/74/13/43/384741343.db2.gz FSGGNIOCQPLCCD-GHMZBOCLSA-N 1 2 236.315 2.053 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1CCC[C@H](O)C1 ZINC000227692814 384743433 /nfs/dbraw/zinc/74/34/33/384743433.db2.gz FSGGNIOCQPLCCD-MNOVXSKESA-N 1 2 236.315 2.053 20 0 BEADLO CN(c1cc(N(C)C2CCC2)[nH+]cn1)C1CCC1 ZINC000125722782 384745624 /nfs/dbraw/zinc/74/56/24/384745624.db2.gz UEVIWOFXQDQOMV-UHFFFAOYSA-N 1 2 246.358 2.454 20 0 BEADLO CSc1ccc(N[C@H]2CO[C@H](C)C2)[nH+]c1 ZINC000647193508 384754574 /nfs/dbraw/zinc/75/45/74/384754574.db2.gz CYAPURHCHYEPGM-RKDXNWHRSA-N 1 2 224.329 2.393 20 0 BEADLO C[C@@H](C(=O)N(C)Cc1[nH]cc[nH+]1)C(C)(C)C ZINC000360214373 384770606 /nfs/dbraw/zinc/77/06/06/384770606.db2.gz VWFJCLQACMELMN-VIFPVBQESA-N 1 2 223.320 2.050 20 0 BEADLO CC(C)[C@@H](C)C(=O)N(C)c1ccc[nH+]c1N(C)C ZINC000176785553 384772279 /nfs/dbraw/zinc/77/22/79/384772279.db2.gz BBBOGJQQKRCTER-LLVKDONJSA-N 1 2 249.358 2.403 20 0 BEADLO C/C=C/C[S@@](=O)Cc1cn2ccccc2[nH+]1 ZINC000083952899 384822949 /nfs/dbraw/zinc/82/29/49/384822949.db2.gz KMABEZGKQFQIGA-KZSQQDEKSA-N 1 2 234.324 2.159 20 0 BEADLO CCN(CC)c1ncc(C[NH2+]CC(F)F)s1 ZINC000147303587 384833168 /nfs/dbraw/zinc/83/31/68/384833168.db2.gz WSYLUHWAYNIJMJ-UHFFFAOYSA-N 1 2 249.330 2.344 20 0 BEADLO CCC[C@H]([NH2+][C@H]1CC[C@@H](F)C1)C(=O)OCC ZINC000310007704 384781255 /nfs/dbraw/zinc/78/12/55/384781255.db2.gz HKHGAEGDENFGAD-VWYCJHECSA-N 1 2 231.311 2.198 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ncc(C)o2)CCS1 ZINC000174357388 384782058 /nfs/dbraw/zinc/78/20/58/384782058.db2.gz ISVGHCCGTBSIEN-JTQLQIEISA-N 1 2 226.345 2.310 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ncc(C)o2)CCS1 ZINC000174357388 384782062 /nfs/dbraw/zinc/78/20/62/384782062.db2.gz ISVGHCCGTBSIEN-JTQLQIEISA-N 1 2 226.345 2.310 20 0 BEADLO CCC[C@@H](CC)NC(=O)[C@@H]1CCn2c[nH+]cc2C1 ZINC000151804246 384796696 /nfs/dbraw/zinc/79/66/96/384796696.db2.gz VYKKRKZHJDXQJC-VXGBXAGGSA-N 1 2 249.358 2.140 20 0 BEADLO COC(=O)[C@@H]([NH2+]CC=C(C)C)C(C)(C)C ZINC000119125696 384800683 /nfs/dbraw/zinc/80/06/83/384800683.db2.gz RCADCCMUUFMLPE-SNVBAGLBSA-N 1 2 213.321 2.130 20 0 BEADLO Cc1ccc(C(=O)CC[N@@H+]2CCO[C@@H](C)C2)cc1 ZINC000053934868 384812458 /nfs/dbraw/zinc/81/24/58/384812458.db2.gz QUKKEXVBRCEPOD-ZDUSSCGKSA-N 1 2 247.338 2.289 20 0 BEADLO Cc1ccc(C(=O)CC[N@H+]2CCO[C@@H](C)C2)cc1 ZINC000053934868 384812463 /nfs/dbraw/zinc/81/24/63/384812463.db2.gz QUKKEXVBRCEPOD-ZDUSSCGKSA-N 1 2 247.338 2.289 20 0 BEADLO C[C@@H](CNc1cccc[nH+]1)Cn1cccn1 ZINC000301290881 384872147 /nfs/dbraw/zinc/87/21/47/384872147.db2.gz WOWZXZJMLAKIHJ-NSHDSACASA-N 1 2 216.288 2.026 20 0 BEADLO CO[C@@H]1CCCC[C@@H]1Nc1cc(C)[nH+]cn1 ZINC000301475223 384875662 /nfs/dbraw/zinc/87/56/62/384875662.db2.gz VVUUSXKNXXGTOV-WDEREUQCSA-N 1 2 221.304 2.155 20 0 BEADLO C[C@H](CCc1ccccc1)[N@H+](C)Cc1nnc[nH]1 ZINC000177140292 384884446 /nfs/dbraw/zinc/88/44/46/384884446.db2.gz OUICKWDZZOJMEI-GFCCVEGCSA-N 1 2 244.342 2.258 20 0 BEADLO C[C@H](CCc1ccccc1)[N@@H+](C)Cc1nnc[nH]1 ZINC000177140292 384884452 /nfs/dbraw/zinc/88/44/52/384884452.db2.gz OUICKWDZZOJMEI-GFCCVEGCSA-N 1 2 244.342 2.258 20 0 BEADLO CCC(=O)N1CC[N@H+](Cc2csc(C)c2)C1 ZINC000335513315 384886940 /nfs/dbraw/zinc/88/69/40/384886940.db2.gz SDJLVRPVCMOIDG-UHFFFAOYSA-N 1 2 238.356 2.068 20 0 BEADLO CCC(=O)N1CC[N@@H+](Cc2csc(C)c2)C1 ZINC000335513315 384886946 /nfs/dbraw/zinc/88/69/46/384886946.db2.gz SDJLVRPVCMOIDG-UHFFFAOYSA-N 1 2 238.356 2.068 20 0 BEADLO FCCC[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000151842753 384839631 /nfs/dbraw/zinc/83/96/31/384839631.db2.gz LMULYXQONRWRIR-LLVKDONJSA-N 1 2 229.320 2.481 20 0 BEADLO FCCC[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000151842753 384839636 /nfs/dbraw/zinc/83/96/36/384839636.db2.gz LMULYXQONRWRIR-LLVKDONJSA-N 1 2 229.320 2.481 20 0 BEADLO CCC[C@@H]1CCC[C@H]1C(=O)NCc1c[nH+]c[nH]1 ZINC000449907797 384843661 /nfs/dbraw/zinc/84/36/61/384843661.db2.gz PUVQORUPDRXQBN-ZYHUDNBSSA-N 1 2 235.331 2.242 20 0 BEADLO CCC[C@@H]1CCC[C@H]1C(=O)NCc1c[nH]c[nH+]1 ZINC000449907797 384843668 /nfs/dbraw/zinc/84/36/68/384843668.db2.gz PUVQORUPDRXQBN-ZYHUDNBSSA-N 1 2 235.331 2.242 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1cccc(F)c1N ZINC000156343209 384845011 /nfs/dbraw/zinc/84/50/11/384845011.db2.gz MXMONYHUSKVQCX-ZJUUUORDSA-N 1 2 238.306 2.017 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1cccc(F)c1N ZINC000156343209 384845015 /nfs/dbraw/zinc/84/50/15/384845015.db2.gz MXMONYHUSKVQCX-ZJUUUORDSA-N 1 2 238.306 2.017 20 0 BEADLO CCC[C@H](O)CNc1cc(C)[nH+]c(C(C)C)n1 ZINC000226231398 384949536 /nfs/dbraw/zinc/94/95/36/384949536.db2.gz LYLUPVRRNRYRPD-NSHDSACASA-N 1 2 237.347 2.481 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2cnn[nH]2)cc1F ZINC000398309595 384897379 /nfs/dbraw/zinc/89/73/79/384897379.db2.gz XDSWELIASIOEMR-SECBINFHSA-N 1 2 234.278 2.103 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2c[nH]nn2)cc1F ZINC000398309595 384897383 /nfs/dbraw/zinc/89/73/83/384897383.db2.gz XDSWELIASIOEMR-SECBINFHSA-N 1 2 234.278 2.103 20 0 BEADLO CC[C@H]1CC[C@H](C)N1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635765688 384905344 /nfs/dbraw/zinc/90/53/44/384905344.db2.gz SOQMPKJYCLLFQP-NNYUYHANSA-N 1 2 247.342 2.303 20 0 BEADLO CC[C@H]1CC[C@H](C)N1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635765688 384905351 /nfs/dbraw/zinc/90/53/51/384905351.db2.gz SOQMPKJYCLLFQP-NNYUYHANSA-N 1 2 247.342 2.303 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C[C@@H]1CC[C@H]2C[C@H]21 ZINC000448933442 384921110 /nfs/dbraw/zinc/92/11/10/384921110.db2.gz QEXYELIOZZESJL-SDDRHHMPSA-N 1 2 230.311 2.187 20 0 BEADLO C[N@H+](Cc1cc(-c2ccco2)on1)[C@H]1CCOC1 ZINC000106886238 384940778 /nfs/dbraw/zinc/94/07/78/384940778.db2.gz QYRTZADNVXBAEH-NSHDSACASA-N 1 2 248.282 2.155 20 0 BEADLO C[N@@H+](Cc1cc(-c2ccco2)on1)[C@H]1CCOC1 ZINC000106886238 384940786 /nfs/dbraw/zinc/94/07/86/384940786.db2.gz QYRTZADNVXBAEH-NSHDSACASA-N 1 2 248.282 2.155 20 0 BEADLO CCCc1nc(C[N@H+](C)[C@H]2CCOC2)cs1 ZINC000106936990 384945622 /nfs/dbraw/zinc/94/56/22/384945622.db2.gz GSKGTSOHGVERCE-NSHDSACASA-N 1 2 240.372 2.316 20 0 BEADLO CCCc1nc(C[N@@H+](C)[C@H]2CCOC2)cs1 ZINC000106936990 384945627 /nfs/dbraw/zinc/94/56/27/384945627.db2.gz GSKGTSOHGVERCE-NSHDSACASA-N 1 2 240.372 2.316 20 0 BEADLO C[C@@H](Cc1ccoc1)[NH2+]Cc1noc(C2CC2)n1 ZINC000449298575 384947194 /nfs/dbraw/zinc/94/71/94/384947194.db2.gz KLVNDUSABKAKJW-VIFPVBQESA-N 1 2 247.298 2.261 20 0 BEADLO CCn1cc[nH+]c1CNc1n[nH]c(C(C)C)c1C ZINC000647240772 384948068 /nfs/dbraw/zinc/94/80/68/384948068.db2.gz NLABZUIULSTQCY-UHFFFAOYSA-N 1 2 247.346 2.092 20 0 BEADLO CCC[C@H](CCO)CNc1[nH+]cccc1OC ZINC000227455044 384966174 /nfs/dbraw/zinc/96/61/74/384966174.db2.gz RGZJHCASFOSGFE-LLVKDONJSA-N 1 2 238.331 2.301 20 0 BEADLO CCc1cc(=NCc2c[nH+]cn2C(C)C)[nH]o1 ZINC000644587037 384985803 /nfs/dbraw/zinc/98/58/03/384985803.db2.gz PUXUXALLOVHANS-UHFFFAOYSA-N 1 2 234.303 2.048 20 0 BEADLO C[C@H]([NH2+]Cc1ccccc1)c1csnn1 ZINC000307527214 385051696 /nfs/dbraw/zinc/05/16/96/385051696.db2.gz KIAURHODIMZZKK-VIFPVBQESA-N 1 2 219.313 2.389 20 0 BEADLO CC(C)c1nc(N2CC[C@@H](C)C2)cc[nH+]1 ZINC000334148344 385053849 /nfs/dbraw/zinc/05/38/49/385053849.db2.gz FZURGEFALORLNP-SNVBAGLBSA-N 1 2 205.305 2.446 20 0 BEADLO C[N@H+](Cc1ccon1)Cc1cccc(F)c1 ZINC000150872630 385069549 /nfs/dbraw/zinc/06/95/49/385069549.db2.gz QCPDAUIGKLJFSD-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO C[N@@H+](Cc1ccon1)Cc1cccc(F)c1 ZINC000150872630 385069555 /nfs/dbraw/zinc/06/95/55/385069555.db2.gz QCPDAUIGKLJFSD-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO c1cc(C[N@@H+]2CCC[C@@H]2c2ccccn2)no1 ZINC000530724599 385025760 /nfs/dbraw/zinc/02/57/60/385025760.db2.gz XGUWHNFMZRJHQL-CYBMUJFWSA-N 1 2 229.283 2.407 20 0 BEADLO c1cc(C[N@H+]2CCC[C@@H]2c2ccccn2)no1 ZINC000530724599 385025767 /nfs/dbraw/zinc/02/57/67/385025767.db2.gz XGUWHNFMZRJHQL-CYBMUJFWSA-N 1 2 229.283 2.407 20 0 BEADLO Cc1ocnc1C(=O)Nc1ccc(C)[nH+]c1C ZINC000176192527 385038156 /nfs/dbraw/zinc/03/81/56/385038156.db2.gz DKDAQGOMBCQHFH-UHFFFAOYSA-N 1 2 231.255 2.247 20 0 BEADLO Cc1csc(C2([NH2+]CCF)CCC2)n1 ZINC000308738745 385046736 /nfs/dbraw/zinc/04/67/36/385046736.db2.gz NEKNGJQGWDOLGE-UHFFFAOYSA-N 1 2 214.309 2.390 20 0 BEADLO Cc1n[nH]cc1CNc1c[nH+]cc(C)c1 ZINC000119632791 385133714 /nfs/dbraw/zinc/13/37/14/385133714.db2.gz IQRINMSOXNUZBZ-UHFFFAOYSA-N 1 2 202.261 2.034 20 0 BEADLO CSCCC[N@H+](C)Cc1nnc(C2CC2)o1 ZINC000559702094 385138472 /nfs/dbraw/zinc/13/84/72/385138472.db2.gz BOJFIRQJOCVVHV-UHFFFAOYSA-N 1 2 241.360 2.132 20 0 BEADLO CSCCC[N@@H+](C)Cc1nnc(C2CC2)o1 ZINC000559702094 385138481 /nfs/dbraw/zinc/13/84/81/385138481.db2.gz BOJFIRQJOCVVHV-UHFFFAOYSA-N 1 2 241.360 2.132 20 0 BEADLO c1ccc2c(C[NH2+][C@@H]3CC34CC4)n[nH]c2c1 ZINC000643800118 385087329 /nfs/dbraw/zinc/08/73/29/385087329.db2.gz XMSQFAIBFRQMMZ-GFCCVEGCSA-N 1 2 213.284 2.205 20 0 BEADLO C[C@H]([NH2+]c1ccc2c(c1)CCO2)[C@@H]1CCOC1 ZINC000165287617 385097264 /nfs/dbraw/zinc/09/72/64/385097264.db2.gz IGONCHIZHCKQQQ-CMPLNLGQSA-N 1 2 233.311 2.458 20 0 BEADLO Cc1nc(CC[N@@H+]2Cc3cccnc3C2)cs1 ZINC000559758728 385152857 /nfs/dbraw/zinc/15/28/57/385152857.db2.gz AUKFMROGPUIASR-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1nc(CC[N@H+]2Cc3cccnc3C2)cs1 ZINC000559758728 385152863 /nfs/dbraw/zinc/15/28/63/385152863.db2.gz AUKFMROGPUIASR-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO COC[C@H](Nc1cc[nH+]c(C2CC2)n1)C1CC1 ZINC000129486677 385153629 /nfs/dbraw/zinc/15/36/29/385153629.db2.gz IJVPZBSJRRKZBI-NSHDSACASA-N 1 2 233.315 2.191 20 0 BEADLO Cn1c(Cl)cnc1C[N@@H+]1CCC2(CCC2)C1 ZINC000176936981 385162207 /nfs/dbraw/zinc/16/22/07/385162207.db2.gz APLLDYXBZOIQLB-UHFFFAOYSA-N 1 2 239.750 2.450 20 0 BEADLO Cn1c(Cl)cnc1C[N@H+]1CCC2(CCC2)C1 ZINC000176936981 385162212 /nfs/dbraw/zinc/16/22/12/385162212.db2.gz APLLDYXBZOIQLB-UHFFFAOYSA-N 1 2 239.750 2.450 20 0 BEADLO O=C1OCC[C@]12CCC[N@@H+]2Cc1ccsc1 ZINC000190038926 385208173 /nfs/dbraw/zinc/20/81/73/385208173.db2.gz RCCYZDSVHQAMGI-GFCCVEGCSA-N 1 2 237.324 2.030 20 0 BEADLO O=C1OCC[C@]12CCC[N@H+]2Cc1ccsc1 ZINC000190038926 385208185 /nfs/dbraw/zinc/20/81/85/385208185.db2.gz RCCYZDSVHQAMGI-GFCCVEGCSA-N 1 2 237.324 2.030 20 0 BEADLO CN(Cc1c[nH+]cn1C)Cc1ccccc1F ZINC000177260465 385209461 /nfs/dbraw/zinc/20/94/61/385209461.db2.gz LOFUUWZGGKVPEV-UHFFFAOYSA-N 1 2 233.290 2.191 20 0 BEADLO CSCC[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000177280272 385213404 /nfs/dbraw/zinc/21/34/04/385213404.db2.gz HHZBNQGMQUWCKR-LLVKDONJSA-N 1 2 243.397 2.484 20 0 BEADLO CSCC[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000177280272 385213407 /nfs/dbraw/zinc/21/34/07/385213407.db2.gz HHZBNQGMQUWCKR-LLVKDONJSA-N 1 2 243.397 2.484 20 0 BEADLO Fc1cccc(C2([NH2+]Cc3cc[nH]n3)CC2)c1 ZINC000152873373 385219609 /nfs/dbraw/zinc/21/96/09/385219609.db2.gz LLWSXGWWGCMXJM-UHFFFAOYSA-N 1 2 231.274 2.328 20 0 BEADLO CC1=CCC[C@@H](C)[C@H]1C[N@H+]1CC(=O)N(C2CC2)C1 ZINC000448262919 385229173 /nfs/dbraw/zinc/22/91/73/385229173.db2.gz GNARJJWVKJRZHI-OCCSQVGLSA-N 1 2 248.370 2.243 20 0 BEADLO CC1=CCC[C@@H](C)[C@H]1C[N@@H+]1CC(=O)N(C2CC2)C1 ZINC000448262919 385229178 /nfs/dbraw/zinc/22/91/78/385229178.db2.gz GNARJJWVKJRZHI-OCCSQVGLSA-N 1 2 248.370 2.243 20 0 BEADLO Cn1nncc1C[N@H+](Cc1cccs1)C1CC1 ZINC000130237718 385229757 /nfs/dbraw/zinc/22/97/57/385229757.db2.gz RVNOOCFFGHZBOC-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO Cn1nncc1C[N@@H+](Cc1cccs1)C1CC1 ZINC000130237718 385229761 /nfs/dbraw/zinc/22/97/61/385229761.db2.gz RVNOOCFFGHZBOC-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO Cc1nc(C[NH2+][C@@H](CO)c2ccccc2)oc1C ZINC000063003066 385202825 /nfs/dbraw/zinc/20/28/25/385202825.db2.gz GSZOGPRJOLIAJH-ZDUSSCGKSA-N 1 2 246.310 2.115 20 0 BEADLO C[N@H+](Cc1ccnc(Cl)c1)Cc1cnccn1 ZINC000177232133 385205202 /nfs/dbraw/zinc/20/52/02/385205202.db2.gz DXDRSMUYNDNMNB-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[N@@H+](Cc1ccnc(Cl)c1)Cc1cnccn1 ZINC000177232133 385205206 /nfs/dbraw/zinc/20/52/06/385205206.db2.gz DXDRSMUYNDNMNB-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1Cc1cnc[nH]1 ZINC000191602429 385309104 /nfs/dbraw/zinc/30/91/04/385309104.db2.gz NGLIUIBUGMIEAC-GFCCVEGCSA-N 1 2 245.330 2.087 20 0 BEADLO CO[C@@H]1CCC[C@@H]1CNc1cccc[nH+]1 ZINC000308966971 385317944 /nfs/dbraw/zinc/31/79/44/385317944.db2.gz WJVKWNJGVFLOHR-GHMZBOCLSA-N 1 2 206.289 2.309 20 0 BEADLO C[C@@H](CNC(=O)c1ccsc1)Cn1cc[nH+]c1 ZINC000153557391 385263928 /nfs/dbraw/zinc/26/39/28/385263928.db2.gz OUSXDNZVKAGMMS-JTQLQIEISA-N 1 2 249.339 2.011 20 0 BEADLO C/C=C(/C=C/C(=O)N[C@@H](C)Cn1cc[nH+]c1)CC ZINC000492137212 385269866 /nfs/dbraw/zinc/26/98/66/385269866.db2.gz OKCLEINQTCERDL-WSOKOPDSSA-N 1 2 247.342 2.300 20 0 BEADLO C[C@H]([NH2+]Cc1ccccc1F)c1ccn(C)n1 ZINC000020349320 385273506 /nfs/dbraw/zinc/27/35/06/385273506.db2.gz CJLNAZQDPDCYLE-JTQLQIEISA-N 1 2 233.290 2.410 20 0 BEADLO Cn1c2ccccc2[nH+]c1N[C@@H]1COCC1(C)C ZINC000313056426 385282435 /nfs/dbraw/zinc/28/24/35/385282435.db2.gz BAGAXWPRGWUPNC-GFCCVEGCSA-N 1 2 245.326 2.410 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)Cc1ccccc1 ZINC000154474322 385329455 /nfs/dbraw/zinc/32/94/55/385329455.db2.gz JBPVVQIVXRGEOE-UHFFFAOYSA-N 1 2 215.300 2.350 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)Cc1ccccc1 ZINC000154474322 385329459 /nfs/dbraw/zinc/32/94/59/385329459.db2.gz JBPVVQIVXRGEOE-UHFFFAOYSA-N 1 2 215.300 2.350 20 0 BEADLO FC(F)(F)[C@@H]1CCC[N@H+](Cc2cocn2)C1 ZINC000191921064 385335172 /nfs/dbraw/zinc/33/51/72/385335172.db2.gz IKKHTPRKSABORZ-MRVPVSSYSA-N 1 2 234.221 2.449 20 0 BEADLO FC(F)(F)[C@@H]1CCC[N@@H+](Cc2cocn2)C1 ZINC000191921064 385335176 /nfs/dbraw/zinc/33/51/76/385335176.db2.gz IKKHTPRKSABORZ-MRVPVSSYSA-N 1 2 234.221 2.449 20 0 BEADLO CCC1(CNC(=O)c2ccc3[nH+]ccn3c2)CC1 ZINC000178189700 385344032 /nfs/dbraw/zinc/34/40/32/385344032.db2.gz ZTZRWMFWAIISKT-UHFFFAOYSA-N 1 2 243.310 2.254 20 0 BEADLO Cc1c(C[NH2+][C@H](C)c2cscn2)cnn1C ZINC000131563738 385344329 /nfs/dbraw/zinc/34/43/29/385344329.db2.gz DQQUAUJEGXKYNC-MRVPVSSYSA-N 1 2 236.344 2.036 20 0 BEADLO Nc1[nH+]cnc(NC[C@H]2CC=CCC2)c1Cl ZINC000192287281 385349112 /nfs/dbraw/zinc/34/91/12/385349112.db2.gz MBUPDNBNOGYXKS-QMMMGPOBSA-N 1 2 238.722 2.480 20 0 BEADLO Nc1nc[nH+]c(NC[C@H]2CC=CCC2)c1Cl ZINC000192287281 385349114 /nfs/dbraw/zinc/34/91/14/385349114.db2.gz MBUPDNBNOGYXKS-QMMMGPOBSA-N 1 2 238.722 2.480 20 0 BEADLO Cc1ccc(N[C@@H](C)c2ccnn2C)c[nH+]1 ZINC000192252571 385349794 /nfs/dbraw/zinc/34/97/94/385349794.db2.gz CFPYINUXHDZNCJ-JTQLQIEISA-N 1 2 216.288 2.297 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)c2ccc(C)o2)[nH+]1 ZINC000516656703 385350605 /nfs/dbraw/zinc/35/06/05/385350605.db2.gz KUQKMMXKHSOQMI-UHFFFAOYSA-N 1 2 247.298 2.285 20 0 BEADLO CCC1CCC(NC(=O)CCc2c[nH+]c[nH]2)CC1 ZINC000192575809 385362904 /nfs/dbraw/zinc/36/29/04/385362904.db2.gz VIKUPXXCZWPRLA-UHFFFAOYSA-N 1 2 249.358 2.427 20 0 BEADLO CCC1CCC(NC(=O)CCc2c[nH]c[nH+]2)CC1 ZINC000192575809 385362909 /nfs/dbraw/zinc/36/29/09/385362909.db2.gz VIKUPXXCZWPRLA-UHFFFAOYSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@@H]([NH2+][C@H](C)C(F)(F)F)C1CCOCC1 ZINC000309022739 385364615 /nfs/dbraw/zinc/36/46/15/385364615.db2.gz YFOUXBAYOMWWOL-HTQZYQBOSA-N 1 2 225.254 2.342 20 0 BEADLO COC(=O)C1([N@H+](C)C/C=C\Cl)CCCC1 ZINC000178399896 385367664 /nfs/dbraw/zinc/36/76/64/385367664.db2.gz BGTMBSPQNPSEIY-YVMONPNESA-N 1 2 231.723 2.157 20 0 BEADLO COC(=O)C1([N@@H+](C)C/C=C\Cl)CCCC1 ZINC000178399896 385367668 /nfs/dbraw/zinc/36/76/68/385367668.db2.gz BGTMBSPQNPSEIY-YVMONPNESA-N 1 2 231.723 2.157 20 0 BEADLO CC[C@H]([NH2+][C@H](C)[C@H]1CCOC1)C(F)(F)F ZINC000309026341 385369854 /nfs/dbraw/zinc/36/98/54/385369854.db2.gz ATPHGFRAVARJAG-VGMNWLOBSA-N 1 2 225.254 2.342 20 0 BEADLO CC[C@@H]([NH2+]CC1(c2ccccc2)CC1)C(=O)OC ZINC000192830226 385372088 /nfs/dbraw/zinc/37/20/88/385372088.db2.gz OBCRIZDUQOEISE-CYBMUJFWSA-N 1 2 247.338 2.259 20 0 BEADLO COc1cc(C)[nH+]c(CSC[C@H](C)CO)c1 ZINC000168878501 385391272 /nfs/dbraw/zinc/39/12/72/385391272.db2.gz VOAWBWPWYYQEMT-SECBINFHSA-N 1 2 241.356 2.260 20 0 BEADLO Cn1ncc2c1nc[nH+]c2NCC1=CCCCC1 ZINC000295009404 385375409 /nfs/dbraw/zinc/37/54/09/385375409.db2.gz SPPCYKMBONLEHN-UHFFFAOYSA-N 1 2 243.314 2.276 20 0 BEADLO CC[C@H]([NH2+][C@H]1CCOC[C@H]1C)C(F)(F)F ZINC000309064201 385390613 /nfs/dbraw/zinc/39/06/13/385390613.db2.gz YIZDSNFDOGUDQA-VGMNWLOBSA-N 1 2 225.254 2.342 20 0 BEADLO CC[C@H]([NH2+]CC[C@@H]1CCOC1)C(F)(F)F ZINC000309035922 385382097 /nfs/dbraw/zinc/38/20/97/385382097.db2.gz IBWAIGSHPQHBDA-BDAKNGLRSA-N 1 2 225.254 2.344 20 0 BEADLO FCC[NH2+][C@@H](c1ncc[nH]1)c1ccccc1 ZINC000280916048 385382535 /nfs/dbraw/zinc/38/25/35/385382535.db2.gz DJYMUHINQDJXOC-LLVKDONJSA-N 1 2 219.263 2.058 20 0 BEADLO FCCN[C@@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000280916048 385382540 /nfs/dbraw/zinc/38/25/40/385382540.db2.gz DJYMUHINQDJXOC-LLVKDONJSA-N 1 2 219.263 2.058 20 0 BEADLO COCCCCNc1cc[nH+]c(C(C)C)n1 ZINC000110213988 385387797 /nfs/dbraw/zinc/38/77/97/385387797.db2.gz MGHNEASZXFFZNC-UHFFFAOYSA-N 1 2 223.320 2.439 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)NCCC(C)(C)C ZINC000492525691 385394949 /nfs/dbraw/zinc/39/49/49/385394949.db2.gz BDVYDNKGMDAJJO-SREVYHEPSA-N 1 2 249.358 2.469 20 0 BEADLO Cc1[nH]c2ccc(NC(=O)[C@H]3C[C@@H]3C)cc2[nH+]1 ZINC000647661120 385398547 /nfs/dbraw/zinc/39/85/47/385398547.db2.gz RZVPMFZJIKFQEW-XVKPBYJWSA-N 1 2 229.283 2.466 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H]2CCC2(C)C)c[nH+]1 ZINC001645215204 1172645187 /nfs/dbraw/zinc/64/51/87/1172645187.db2.gz OAHQXQKKEZHUKT-JTQLQIEISA-N 1 2 235.331 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H]2CCC2(C)C)[nH+]1 ZINC001645215204 1172645190 /nfs/dbraw/zinc/64/51/90/1172645190.db2.gz OAHQXQKKEZHUKT-JTQLQIEISA-N 1 2 235.331 2.025 20 0 BEADLO Cc1c[nH+]cc(NCC[C@H]2CCOC2)c1 ZINC000309090577 385412658 /nfs/dbraw/zinc/41/26/58/385412658.db2.gz BZEZACSSJVWYNW-NSHDSACASA-N 1 2 206.289 2.229 20 0 BEADLO CC[C@@H]1[C@H](C)CCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492810150 385440080 /nfs/dbraw/zinc/44/00/80/385440080.db2.gz HNIKPECGYBQFLY-ZHLVKLTDSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@@H]1C[C@H]1C(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000120749921 385442960 /nfs/dbraw/zinc/44/29/60/385442960.db2.gz QBGCEAOAHJSXAP-GMTAPVOTSA-N 1 2 233.315 2.119 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1cccc(F)c1N ZINC000156346074 385446366 /nfs/dbraw/zinc/44/63/66/385446366.db2.gz MRNRVNRZTAWVJT-NSHDSACASA-N 1 2 238.306 2.019 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1cccc(F)c1N ZINC000156346074 385446371 /nfs/dbraw/zinc/44/63/71/385446371.db2.gz MRNRVNRZTAWVJT-NSHDSACASA-N 1 2 238.306 2.019 20 0 BEADLO COC[C@@H](C)N(C)c1[nH]c2ccccc2[nH+]1 ZINC000179283926 385457948 /nfs/dbraw/zinc/45/79/48/385457948.db2.gz BAHIPKYOLOEEPM-SECBINFHSA-N 1 2 219.288 2.034 20 0 BEADLO CC[C@H]([NH2+]Cc1nccs1)c1nccn1C ZINC000182527002 385451066 /nfs/dbraw/zinc/45/10/66/385451066.db2.gz KVQCAULOEJRPRF-VIFPVBQESA-N 1 2 236.344 2.118 20 0 BEADLO CC[C@H](NCc1nccs1)c1[nH+]ccn1C ZINC000182527002 385451070 /nfs/dbraw/zinc/45/10/70/385451070.db2.gz KVQCAULOEJRPRF-VIFPVBQESA-N 1 2 236.344 2.118 20 0 BEADLO CCCCNc1[nH+]c(C)nc2[nH]ccc21 ZINC000309176322 385452014 /nfs/dbraw/zinc/45/20/14/385452014.db2.gz MUPMTVIQZXUZKA-UHFFFAOYSA-N 1 2 204.277 2.478 20 0 BEADLO Cc1c[nH+]c(CNCc2ccsc2)n1C ZINC000309183879 385453641 /nfs/dbraw/zinc/45/36/41/385453641.db2.gz OGLQLEAMGMDTQK-UHFFFAOYSA-N 1 2 221.329 2.080 20 0 BEADLO Cc1ccoc1C[NH2+][C@H](C)c1ccon1 ZINC000309140781 385433042 /nfs/dbraw/zinc/43/30/42/385433042.db2.gz SYQCSTCGQOTHDS-SECBINFHSA-N 1 2 206.245 2.427 20 0 BEADLO Cc1ccc(NC(=O)C2CCC(O)CC2)c(C)[nH+]1 ZINC000194397338 385433490 /nfs/dbraw/zinc/43/34/90/385433490.db2.gz KSBXVQLUQWATJW-UHFFFAOYSA-N 1 2 248.326 2.188 20 0 BEADLO C[C@@H](CNc1cc[nH+]c(C2CC2)n1)C[C@H](C)O ZINC000156699601 385466041 /nfs/dbraw/zinc/46/60/41/385466041.db2.gz CISZPGIRWQGADB-ZJUUUORDSA-N 1 2 235.331 2.173 20 0 BEADLO CC[C@@H](C)[C@@H](C)NC(=O)c1ccc2[nH+]ccn2c1 ZINC000171160218 385471540 /nfs/dbraw/zinc/47/15/40/385471540.db2.gz XHKLBVIGGNFQGR-GHMZBOCLSA-N 1 2 245.326 2.499 20 0 BEADLO CC[C@@H](C)[C@H](C)NC(=O)c1ccc2[nH+]ccn2c1 ZINC000171160227 385471682 /nfs/dbraw/zinc/47/16/82/385471682.db2.gz XHKLBVIGGNFQGR-MNOVXSKESA-N 1 2 245.326 2.499 20 0 BEADLO Cc1nc(N2CC[C@H](CC(C)(C)C)C2)nc(N)[nH+]1 ZINC000307836335 385475431 /nfs/dbraw/zinc/47/54/31/385475431.db2.gz PMUOIZWSFJWCFN-SNVBAGLBSA-N 1 2 249.362 2.025 20 0 BEADLO Cc1nc(N)nc(N2CC[C@H](CC(C)(C)C)C2)[nH+]1 ZINC000307836335 385475437 /nfs/dbraw/zinc/47/54/37/385475437.db2.gz PMUOIZWSFJWCFN-SNVBAGLBSA-N 1 2 249.362 2.025 20 0 BEADLO CCc1ccc(C[NH+]2C[C@H](C)O[C@@H](C)C2)nc1 ZINC000336246062 385476377 /nfs/dbraw/zinc/47/63/77/385476377.db2.gz WXQWMJNQVXPHJU-RYUDHWBXSA-N 1 2 234.343 2.253 20 0 BEADLO CC[C@H](O)COc1cccc(-n2cc[nH+]c2)c1 ZINC000157031545 385482569 /nfs/dbraw/zinc/48/25/69/385482569.db2.gz UXXMZLXJYKJTEJ-LBPRGKRZSA-N 1 2 232.283 2.022 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616927887 385488696 /nfs/dbraw/zinc/48/86/96/385488696.db2.gz SGWYIFWZTMRTSM-UWVGGRQHSA-N 1 2 223.320 2.050 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616927887 385488698 /nfs/dbraw/zinc/48/86/98/385488698.db2.gz SGWYIFWZTMRTSM-UWVGGRQHSA-N 1 2 223.320 2.050 20 0 BEADLO Cc1cccc(CNC(=O)C=Cc2c[nH]c[nH+]2)c1 ZINC000492908554 385463389 /nfs/dbraw/zinc/46/33/89/385463389.db2.gz GHJNNBXFZJRBLV-WAYWQWQTSA-N 1 2 241.294 2.048 20 0 BEADLO Cc1nc(COCc2[nH]cc[nH+]2)sc1C ZINC000180050704 385505407 /nfs/dbraw/zinc/50/54/07/385505407.db2.gz NPDLQGMWVPLKTQ-UHFFFAOYSA-N 1 2 223.301 2.200 20 0 BEADLO CCOCC[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000157646206 385511797 /nfs/dbraw/zinc/51/17/97/385511797.db2.gz IRACFKVZAVWOMF-LLVKDONJSA-N 1 2 241.356 2.158 20 0 BEADLO CCOCC[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000157646206 385511801 /nfs/dbraw/zinc/51/18/01/385511801.db2.gz IRACFKVZAVWOMF-LLVKDONJSA-N 1 2 241.356 2.158 20 0 BEADLO CC[N@H+](Cc1ncnn1C)Cc1ccccc1C ZINC000157653421 385514072 /nfs/dbraw/zinc/51/40/72/385514072.db2.gz ROUNYAZFTBWVCD-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CC[N@@H+](Cc1ncnn1C)Cc1ccccc1C ZINC000157653421 385514075 /nfs/dbraw/zinc/51/40/75/385514075.db2.gz ROUNYAZFTBWVCD-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO Cc1cnc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)s1 ZINC000180304283 385517310 /nfs/dbraw/zinc/51/73/10/385517310.db2.gz SNPMTOWRDXMPRJ-DTORHVGOSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1cnc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)s1 ZINC000180304283 385517313 /nfs/dbraw/zinc/51/73/13/385517313.db2.gz SNPMTOWRDXMPRJ-DTORHVGOSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@H]1CCCOCC1 ZINC000180609768 385532960 /nfs/dbraw/zinc/53/29/60/385532960.db2.gz MORUHIFPYNBTMH-NSHDSACASA-N 1 2 249.314 2.081 20 0 BEADLO CSCC[N@@H+]1CCOC[C@H]1c1ccc(C)o1 ZINC000172098457 385551002 /nfs/dbraw/zinc/55/10/02/385551002.db2.gz KPLAFQHTVXIGRE-NSHDSACASA-N 1 2 241.356 2.324 20 0 BEADLO CSCC[N@H+]1CCOC[C@H]1c1ccc(C)o1 ZINC000172098457 385551007 /nfs/dbraw/zinc/55/10/07/385551007.db2.gz KPLAFQHTVXIGRE-NSHDSACASA-N 1 2 241.356 2.324 20 0 BEADLO Cc1cnc(C[N@@H+]2CCOC[C@@H]2C2CC2)s1 ZINC000180840596 385551028 /nfs/dbraw/zinc/55/10/28/385551028.db2.gz OUWOTUXOUMUMJJ-LLVKDONJSA-N 1 2 238.356 2.062 20 0 BEADLO Cc1cnc(C[N@H+]2CCOC[C@@H]2C2CC2)s1 ZINC000180840596 385551033 /nfs/dbraw/zinc/55/10/33/385551033.db2.gz OUWOTUXOUMUMJJ-LLVKDONJSA-N 1 2 238.356 2.062 20 0 BEADLO CC(=O)c1c[nH]c(C(=O)Nc2cc[nH+]cc2C)c1 ZINC000107285561 385562845 /nfs/dbraw/zinc/56/28/45/385562845.db2.gz XYYOFIDPBKQRBL-UHFFFAOYSA-N 1 2 243.266 2.173 20 0 BEADLO COC[C@@H]([NH2+]Cc1ncc(C)o1)c1ccccc1 ZINC000181679773 385593876 /nfs/dbraw/zinc/59/38/76/385593876.db2.gz DRZJJEOBCKSVLM-CYBMUJFWSA-N 1 2 246.310 2.460 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)NCCC1CCCC1 ZINC000280788906 385604533 /nfs/dbraw/zinc/60/45/33/385604533.db2.gz OBKJGHVFWHVVHG-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO C[C@H]1SCC[N@H+](Cc2nccs2)[C@@H]1C ZINC000269672248 385623882 /nfs/dbraw/zinc/62/38/82/385623882.db2.gz AUFCBDMUTSTTKP-RKDXNWHRSA-N 1 2 228.386 2.469 20 0 BEADLO C[C@H]1SCC[N@@H+](Cc2nccs2)[C@@H]1C ZINC000269672248 385623892 /nfs/dbraw/zinc/62/38/92/385623892.db2.gz AUFCBDMUTSTTKP-RKDXNWHRSA-N 1 2 228.386 2.469 20 0 BEADLO COCc1cccc(C[N@H+](C)Cc2ccon2)c1 ZINC000269693502 385627376 /nfs/dbraw/zinc/62/73/76/385627376.db2.gz JAWRCVJKPYRNMQ-UHFFFAOYSA-N 1 2 246.310 2.453 20 0 BEADLO COCc1cccc(C[N@@H+](C)Cc2ccon2)c1 ZINC000269693502 385627380 /nfs/dbraw/zinc/62/73/80/385627380.db2.gz JAWRCVJKPYRNMQ-UHFFFAOYSA-N 1 2 246.310 2.453 20 0 BEADLO CC1(C)C[C@H]1C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000269757816 385634106 /nfs/dbraw/zinc/63/41/06/385634106.db2.gz VRVGPDAUKLFUBG-NSHDSACASA-N 1 2 247.342 2.162 20 0 BEADLO C[C@H]([NH2+]Cc1ccc(Cl)cn1)c1cnccn1 ZINC000182125326 385636016 /nfs/dbraw/zinc/63/60/16/385636016.db2.gz GHPIBTXKSYXYIY-VIFPVBQESA-N 1 2 248.717 2.376 20 0 BEADLO CCN(C)C(=O)CNc1ccc2ccccc2[nH+]1 ZINC000229573684 385638053 /nfs/dbraw/zinc/63/80/53/385638053.db2.gz OLSLUFHGXNODKJ-UHFFFAOYSA-N 1 2 243.310 2.125 20 0 BEADLO COC(=O)[C@@H](CC(F)F)[NH2+]CCCC(C)C ZINC000309501916 385639906 /nfs/dbraw/zinc/63/99/06/385639906.db2.gz AAYSINIWYJKZMF-SECBINFHSA-N 1 2 237.290 2.209 20 0 BEADLO CC[C@@H](C)CNc1cc2cc[nH]c2c[nH+]1 ZINC000643191698 385641140 /nfs/dbraw/zinc/64/11/40/385641140.db2.gz NDQVNNSOFSHFFS-SECBINFHSA-N 1 2 203.289 2.443 20 0 BEADLO C[C@H](NC(=O)CCc1[nH]cc[nH+]1)c1cccs1 ZINC000281179562 385641546 /nfs/dbraw/zinc/64/15/46/385641546.db2.gz JJDGBXKBLLMLNI-VIFPVBQESA-N 1 2 249.339 2.281 20 0 BEADLO C[C@@H](NC(=O)CCc1[nH]cc[nH+]1)c1cccs1 ZINC000281179559 385642033 /nfs/dbraw/zinc/64/20/33/385642033.db2.gz JJDGBXKBLLMLNI-SECBINFHSA-N 1 2 249.339 2.281 20 0 BEADLO CC[C@@H](C)[N@H+](CC(=O)OC)Cc1occc1C ZINC000281190191 385642715 /nfs/dbraw/zinc/64/27/15/385642715.db2.gz IGNMGXXRXRVKCV-LLVKDONJSA-N 1 2 239.315 2.362 20 0 BEADLO CC[C@@H](C)[N@@H+](CC(=O)OC)Cc1occc1C ZINC000281190191 385642722 /nfs/dbraw/zinc/64/27/22/385642722.db2.gz IGNMGXXRXRVKCV-LLVKDONJSA-N 1 2 239.315 2.362 20 0 BEADLO FC(F)[C@@H]1CCCC[N@@H+]1CCn1cccn1 ZINC000337417233 385644463 /nfs/dbraw/zinc/64/44/63/385644463.db2.gz SAUGNCKZSYJNSC-JTQLQIEISA-N 1 2 229.274 2.003 20 0 BEADLO FC(F)[C@@H]1CCCC[N@H+]1CCn1cccn1 ZINC000337417233 385644465 /nfs/dbraw/zinc/64/44/65/385644465.db2.gz SAUGNCKZSYJNSC-JTQLQIEISA-N 1 2 229.274 2.003 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@H](C)c1cccs1 ZINC000281209072 385645242 /nfs/dbraw/zinc/64/52/42/385645242.db2.gz LNVMBUQHGZBDBX-VIFPVBQESA-N 1 2 249.339 2.200 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@@H](C)c1cccs1 ZINC000281209072 385645250 /nfs/dbraw/zinc/64/52/50/385645250.db2.gz LNVMBUQHGZBDBX-VIFPVBQESA-N 1 2 249.339 2.200 20 0 BEADLO CC[C@H]1CC[C@H](C)N1C(=O)CCc1c[nH+]cn1C ZINC000281283319 385652191 /nfs/dbraw/zinc/65/21/91/385652191.db2.gz SEAURSCXSRDNSU-RYUDHWBXSA-N 1 2 249.358 2.142 20 0 BEADLO CC(C)CCC[S@](=O)Cc1[nH+]ccn1C ZINC000182297024 385654660 /nfs/dbraw/zinc/65/46/60/385654660.db2.gz BQIZKFNTJINTKP-HNNXBMFYSA-N 1 2 228.361 2.105 20 0 BEADLO Cn1cc(CC[N@@H+]2CCCC[C@@H]2C(F)F)cn1 ZINC000337423679 385656339 /nfs/dbraw/zinc/65/63/39/385656339.db2.gz VQXNQGAZXKPQRB-LLVKDONJSA-N 1 2 243.301 2.082 20 0 BEADLO Cn1cc(CC[N@H+]2CCCC[C@@H]2C(F)F)cn1 ZINC000337423679 385656344 /nfs/dbraw/zinc/65/63/44/385656344.db2.gz VQXNQGAZXKPQRB-LLVKDONJSA-N 1 2 243.301 2.082 20 0 BEADLO COC(=O)[C@@H](C)[NH2+]C1CC(C)(c2ccccc2)C1 ZINC000281322179 385658220 /nfs/dbraw/zinc/65/82/20/385658220.db2.gz VFYNMHFLYYVUNJ-NUYPLMSZSA-N 1 2 247.338 2.258 20 0 BEADLO C[C@]1(F)CCC[N@H+](CCOCC(F)(F)F)C1 ZINC000451118741 385659780 /nfs/dbraw/zinc/65/97/80/385659780.db2.gz YSVOGYSNRVJUJZ-VIFPVBQESA-N 1 2 243.244 2.389 20 0 BEADLO C[C@]1(F)CCC[N@@H+](CCOCC(F)(F)F)C1 ZINC000451118741 385659782 /nfs/dbraw/zinc/65/97/82/385659782.db2.gz YSVOGYSNRVJUJZ-VIFPVBQESA-N 1 2 243.244 2.389 20 0 BEADLO CCC[C@H](CNc1cc[nH+]c(C)n1)OC ZINC000293582677 385662156 /nfs/dbraw/zinc/66/21/56/385662156.db2.gz FKNZBLUCHMKKEC-SNVBAGLBSA-N 1 2 209.293 2.012 20 0 BEADLO Cc1nnsc1C[NH2+][C@H](C)c1ccco1 ZINC000293607056 385681679 /nfs/dbraw/zinc/68/16/79/385681679.db2.gz JCGGQMYXNKAIAE-SSDOTTSWSA-N 1 2 223.301 2.290 20 0 BEADLO Cc1cnc(NCCc2cc[nH+]cc2C)nc1 ZINC000270215670 385687758 /nfs/dbraw/zinc/68/77/58/385687758.db2.gz HDAUYARRPKHAIQ-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO CO[C@@](C)(CNc1cccc[nH+]1)C1CC1 ZINC000292378599 385703044 /nfs/dbraw/zinc/70/30/44/385703044.db2.gz QAHDSNOEBUEFKR-LBPRGKRZSA-N 1 2 206.289 2.309 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H]1CS[C@H](C(C)(C)C)C1 ZINC000309578226 385711570 /nfs/dbraw/zinc/71/15/70/385711570.db2.gz POMAPUZLIXQZPH-GUBZILKMSA-N 1 2 245.388 2.058 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H]1CS[C@@H](C(C)(C)C)C1 ZINC000309578231 385712079 /nfs/dbraw/zinc/71/20/79/385712079.db2.gz POMAPUZLIXQZPH-LPEHRKFASA-N 1 2 245.388 2.058 20 0 BEADLO CC[C@@H](O)CCCNc1[nH+]ccc(C)c1Cl ZINC000336734666 385671101 /nfs/dbraw/zinc/67/11/01/385671101.db2.gz LAFJLYFGXQPUTB-SNVBAGLBSA-N 1 2 242.750 2.428 20 0 BEADLO CCN(CCOC)c1cc(C)[nH+]c(C(C)C)n1 ZINC000337649627 385734962 /nfs/dbraw/zinc/73/49/62/385734962.db2.gz KEBIJYHFIBGWQR-UHFFFAOYSA-N 1 2 237.347 2.381 20 0 BEADLO FC(F)C[N@H+](CCCn1cc[nH+]c1)C1CC1 ZINC000183176643 385739749 /nfs/dbraw/zinc/73/97/49/385739749.db2.gz LWWCFYCGWOLIOX-UHFFFAOYSA-N 1 2 229.274 2.003 20 0 BEADLO FC(F)CN(CCCn1cc[nH+]c1)C1CC1 ZINC000183176643 385739758 /nfs/dbraw/zinc/73/97/58/385739758.db2.gz LWWCFYCGWOLIOX-UHFFFAOYSA-N 1 2 229.274 2.003 20 0 BEADLO CC(C)=CC[N@@H+](C)Cc1ncc(Cl)n1C ZINC000183251057 385747282 /nfs/dbraw/zinc/74/72/82/385747282.db2.gz NBKCKPSQCAJRCX-UHFFFAOYSA-N 1 2 227.739 2.472 20 0 BEADLO CC(C)=CC[N@H+](C)Cc1ncc(Cl)n1C ZINC000183251057 385747288 /nfs/dbraw/zinc/74/72/88/385747288.db2.gz NBKCKPSQCAJRCX-UHFFFAOYSA-N 1 2 227.739 2.472 20 0 BEADLO C[NH+](C)Cc1nc([C@@H]2C[C@H]2c2ccccc2)no1 ZINC000282272903 385748415 /nfs/dbraw/zinc/74/84/15/385748415.db2.gz AQXJQFXHJOKWEX-NWDGAFQWSA-N 1 2 243.310 2.402 20 0 BEADLO CCC[C@H](C(=O)NCc1[nH]c[nH+]c1C)C(C)C ZINC000270895266 385758755 /nfs/dbraw/zinc/75/87/55/385758755.db2.gz NNBGGUOTJBHEHV-NSHDSACASA-N 1 2 237.347 2.407 20 0 BEADLO CCc1cc(N)nc(SC[C@@H](F)CC)[nH+]1 ZINC000336700046 385762084 /nfs/dbraw/zinc/76/20/84/385762084.db2.gz PELPBJRUJDBVJH-ZETCQYMHSA-N 1 2 229.324 2.292 20 0 BEADLO CCc1ccc(C[NH2+]Cc2nccs2)cn1 ZINC000309639423 385763896 /nfs/dbraw/zinc/76/38/96/385763896.db2.gz KJHSYSQWNBPEEU-UHFFFAOYSA-N 1 2 233.340 2.390 20 0 BEADLO Fc1ccc2c(c1)CCN2CCCn1cc[nH+]c1 ZINC000282521522 385769442 /nfs/dbraw/zinc/76/94/42/385769442.db2.gz UAIIBWSYNXVPHK-UHFFFAOYSA-N 1 2 245.301 2.475 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)Cc1cccs1 ZINC000271019029 385771720 /nfs/dbraw/zinc/77/17/20/385771720.db2.gz SZLOUOYPKRLXII-UHFFFAOYSA-N 1 2 207.302 2.103 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)Cc1cccs1 ZINC000271019029 385771729 /nfs/dbraw/zinc/77/17/29/385771729.db2.gz SZLOUOYPKRLXII-UHFFFAOYSA-N 1 2 207.302 2.103 20 0 BEADLO Cc1nonc1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC000271040809 385775445 /nfs/dbraw/zinc/77/54/45/385775445.db2.gz SUXQJCVBSQFKCW-ZDUSSCGKSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1nonc1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000271040809 385775450 /nfs/dbraw/zinc/77/54/50/385775450.db2.gz SUXQJCVBSQFKCW-ZDUSSCGKSA-N 1 2 244.298 2.110 20 0 BEADLO CC[C@H]1C[N@H+](Cc2sccc2OC)CCO1 ZINC000271053279 385779598 /nfs/dbraw/zinc/77/95/98/385779598.db2.gz XRDRCHZCPPLYAS-JTQLQIEISA-N 1 2 241.356 2.368 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2sccc2OC)CCO1 ZINC000271053279 385779603 /nfs/dbraw/zinc/77/96/03/385779603.db2.gz XRDRCHZCPPLYAS-JTQLQIEISA-N 1 2 241.356 2.368 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N(C1CCC1)C1CCC1 ZINC000293988209 385780684 /nfs/dbraw/zinc/78/06/84/385780684.db2.gz WDTCZYAXNZAMOA-BQYQJAHWSA-N 1 2 245.326 2.357 20 0 BEADLO Cc1cc(C)c(CNc2ncccn2)c[nH+]1 ZINC000397011070 385781903 /nfs/dbraw/zinc/78/19/03/385781903.db2.gz IJFFPUDXTYJXSK-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO COC[C@H]1CCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000270591236 385721390 /nfs/dbraw/zinc/72/13/90/385721390.db2.gz SRWJPVSKSGGDAY-JTQLQIEISA-N 1 2 231.299 2.036 20 0 BEADLO C[C@@H]([NH2+]c1ccc(N(C)CCO)cc1)C1CC1 ZINC000182952344 385725681 /nfs/dbraw/zinc/72/56/81/385725681.db2.gz MOHPQFAUPYQFMD-LLVKDONJSA-N 1 2 234.343 2.326 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CCC[C@H]1C1CCC1 ZINC000282956233 385800399 /nfs/dbraw/zinc/80/03/99/385800399.db2.gz FINROYZPSLLVPU-ZDUSSCGKSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CCC[C@@H]1C1CCC1 ZINC000282956231 385800703 /nfs/dbraw/zinc/80/07/03/385800703.db2.gz FINROYZPSLLVPU-CYBMUJFWSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1ccc(C)c(C[NH2+]CC(F)(F)CO)c1 ZINC000183877187 385801473 /nfs/dbraw/zinc/80/14/73/385801473.db2.gz IISRPFPVBNJCGN-UHFFFAOYSA-N 1 2 229.270 2.021 20 0 BEADLO FC(F)(F)C1=CC[N@H+](Cc2cc[nH]n2)CC1 ZINC000271205246 385804454 /nfs/dbraw/zinc/80/44/54/385804454.db2.gz RIMCNTLYPYETGT-UHFFFAOYSA-N 1 2 231.221 2.104 20 0 BEADLO FC(F)(F)C1=CC[N@@H+](Cc2cc[nH]n2)CC1 ZINC000271205246 385804455 /nfs/dbraw/zinc/80/44/55/385804455.db2.gz RIMCNTLYPYETGT-UHFFFAOYSA-N 1 2 231.221 2.104 20 0 BEADLO Cc1cc(C(=O)N[C@@H](c2[nH]cc[nH+]2)C(C)C)co1 ZINC000283137591 385810912 /nfs/dbraw/zinc/81/09/12/385810912.db2.gz XOZYCYFIVROHFE-LLVKDONJSA-N 1 2 247.298 2.438 20 0 BEADLO C[C@@H]([NH2+]Cc1cnn[nH]1)c1ccc(Cl)cc1 ZINC000283966462 385812977 /nfs/dbraw/zinc/81/29/77/385812977.db2.gz LVBAECNJGFKJKF-MRVPVSSYSA-N 1 2 236.706 2.309 20 0 BEADLO C[C@@H]([NH2+]Cc1c[nH]nn1)c1ccc(Cl)cc1 ZINC000283966462 385812981 /nfs/dbraw/zinc/81/29/81/385812981.db2.gz LVBAECNJGFKJKF-MRVPVSSYSA-N 1 2 236.706 2.309 20 0 BEADLO C[C@@H]([NH2+]Cc1cn[nH]n1)c1ccc(Cl)cc1 ZINC000283966462 385812982 /nfs/dbraw/zinc/81/29/82/385812982.db2.gz LVBAECNJGFKJKF-MRVPVSSYSA-N 1 2 236.706 2.309 20 0 BEADLO Cc1ocnc1CNc1cc[nH+]c(C2CC2)n1 ZINC000271303541 385815839 /nfs/dbraw/zinc/81/58/39/385815839.db2.gz HCRPUQSNEPUQQB-UHFFFAOYSA-N 1 2 230.271 2.263 20 0 BEADLO c1ccc(NC[C@@H]2COC3(CCCC3)O2)[nH+]c1 ZINC000271336563 385818257 /nfs/dbraw/zinc/81/82/57/385818257.db2.gz BVUOXRHQPIBTAO-LLVKDONJSA-N 1 2 234.299 2.179 20 0 BEADLO CC(C)(C)n1ncnc1CNc1cccc[nH+]1 ZINC000283419700 385818926 /nfs/dbraw/zinc/81/89/26/385818926.db2.gz GNEMLBPCJZJTMR-UHFFFAOYSA-N 1 2 231.303 2.040 20 0 BEADLO Cc1nsc(N2CCCC[C@H]2c2[nH]cc[nH+]2)n1 ZINC000271344913 385819625 /nfs/dbraw/zinc/81/96/25/385819625.db2.gz NAQDOQKSLHRIMT-VIFPVBQESA-N 1 2 249.343 2.301 20 0 BEADLO C[C@H]([NH2+]Cc1c[nH]nn1)[C@@H](C)c1ccccc1 ZINC000283618756 385824588 /nfs/dbraw/zinc/82/45/88/385824588.db2.gz AMBTXVAMYGTJIE-MNOVXSKESA-N 1 2 230.315 2.087 20 0 BEADLO C[C@H]([NH2+]Cc1cn[nH]n1)[C@@H](C)c1ccccc1 ZINC000283618756 385824590 /nfs/dbraw/zinc/82/45/90/385824590.db2.gz AMBTXVAMYGTJIE-MNOVXSKESA-N 1 2 230.315 2.087 20 0 BEADLO C[C@H](c1ccccc1)[C@H](C)[NH2+]Cc1c[nH]nn1 ZINC000283618758 385825250 /nfs/dbraw/zinc/82/52/50/385825250.db2.gz AMBTXVAMYGTJIE-QWRGUYRKSA-N 1 2 230.315 2.087 20 0 BEADLO C[C@H](c1ccccc1)[C@H](C)[NH2+]Cc1cn[nH]n1 ZINC000283618758 385825256 /nfs/dbraw/zinc/82/52/56/385825256.db2.gz AMBTXVAMYGTJIE-QWRGUYRKSA-N 1 2 230.315 2.087 20 0 BEADLO Clc1cc(C[NH+]2CCSCC2)ccn1 ZINC000052709108 385830121 /nfs/dbraw/zinc/83/01/21/385830121.db2.gz SMHDIXITJXHAHL-UHFFFAOYSA-N 1 2 228.748 2.284 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1ccsc1C ZINC000294500392 385858142 /nfs/dbraw/zinc/85/81/42/385858142.db2.gz BMNXDKPOVYXNFR-QMMMGPOBSA-N 1 2 227.329 2.050 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1ccsc1C ZINC000294500392 385858144 /nfs/dbraw/zinc/85/81/44/385858144.db2.gz BMNXDKPOVYXNFR-QMMMGPOBSA-N 1 2 227.329 2.050 20 0 BEADLO CC(C)CCCC(=O)N(C)Cc1[nH+]ccn1C ZINC000294299710 385835216 /nfs/dbraw/zinc/83/52/16/385835216.db2.gz GJJKKQPFLSEBJC-UHFFFAOYSA-N 1 2 237.347 2.205 20 0 BEADLO COC[C@@H]([NH2+][C@@H](C)c1cn[nH]c1)c1ccc(C)o1 ZINC000283953044 385841096 /nfs/dbraw/zinc/84/10/96/385841096.db2.gz FXDKDOPSOIVKEQ-CMPLNLGQSA-N 1 2 249.314 2.349 20 0 BEADLO CCCC[C@](C)(CO)Nc1cc[nH+]c(C)n1 ZINC000645343388 385841767 /nfs/dbraw/zinc/84/17/67/385841767.db2.gz BTFXSVFUXQQHQW-GFCCVEGCSA-N 1 2 223.320 2.138 20 0 BEADLO CC[C@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000284023945 385846481 /nfs/dbraw/zinc/84/64/81/385846481.db2.gz OVDUTWWGMBIFIR-FYJFLYSWSA-N 1 2 247.342 2.462 20 0 BEADLO CCN(CC)C(=S)SCc1[nH+]ccn1C ZINC000294416650 385847835 /nfs/dbraw/zinc/84/78/35/385847835.db2.gz FNPHUJRAQCFFKS-UHFFFAOYSA-N 1 2 243.401 2.280 20 0 BEADLO c1snnc1C[NH2+][C@@H]1CSc2ccccc21 ZINC000309688741 385791920 /nfs/dbraw/zinc/79/19/20/385791920.db2.gz OWWZNABFJUORFR-SNVBAGLBSA-N 1 2 249.364 2.475 20 0 BEADLO Cc1cc[nH+]c(NCc2cnn(C)c2)c1Cl ZINC000309688987 385792052 /nfs/dbraw/zinc/79/20/52/385792052.db2.gz IMHJPCKIDPBFEI-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO c1nc(NC2CCCCCC2)c2c([nH+]1)NCCO2 ZINC000647845470 385885649 /nfs/dbraw/zinc/88/56/49/385885649.db2.gz LCXNFRUYXIGGEN-UHFFFAOYSA-N 1 2 248.330 2.416 20 0 BEADLO c1nc2c(c(NC3CCCCCC3)[nH+]1)OCCN2 ZINC000647845470 385885651 /nfs/dbraw/zinc/88/56/51/385885651.db2.gz LCXNFRUYXIGGEN-UHFFFAOYSA-N 1 2 248.330 2.416 20 0 BEADLO CN(C[C@H]1CCCC[C@@H]1O)c1cccc[nH+]1 ZINC000272253250 385888716 /nfs/dbraw/zinc/88/87/16/385888716.db2.gz TWIAJNLGZNBKFW-NEPJUHHUSA-N 1 2 220.316 2.069 20 0 BEADLO Cc1cc(C)n(CC[N@@H+]2CCC=C(F)C2)n1 ZINC000272422721 385901886 /nfs/dbraw/zinc/90/18/86/385901886.db2.gz GTCYOEKEUVNYCC-UHFFFAOYSA-N 1 2 223.295 2.059 20 0 BEADLO Cc1cc(C)n(CC[N@H+]2CCC=C(F)C2)n1 ZINC000272422721 385901888 /nfs/dbraw/zinc/90/18/88/385901888.db2.gz GTCYOEKEUVNYCC-UHFFFAOYSA-N 1 2 223.295 2.059 20 0 BEADLO COC(C)(C)c1noc(Cc2ccc[nH+]c2C)n1 ZINC000285281707 385911915 /nfs/dbraw/zinc/91/19/15/385911915.db2.gz IMOIXPVKAQKQFR-UHFFFAOYSA-N 1 2 247.298 2.245 20 0 BEADLO CCCc1nc(C[N@H+](C)C2(CO)CC2)cs1 ZINC000285360333 385918622 /nfs/dbraw/zinc/91/86/22/385918622.db2.gz BLQYLAAQHWZJGN-UHFFFAOYSA-N 1 2 240.372 2.052 20 0 BEADLO CCCc1nc(C[N@@H+](C)C2(CO)CC2)cs1 ZINC000285360333 385918630 /nfs/dbraw/zinc/91/86/30/385918630.db2.gz BLQYLAAQHWZJGN-UHFFFAOYSA-N 1 2 240.372 2.052 20 0 BEADLO Cn1ccnc1C[N@@H+]1CCC=C(c2ccco2)C1 ZINC000285402943 385924914 /nfs/dbraw/zinc/92/49/14/385924914.db2.gz UCWSTGPKBFXOOI-UHFFFAOYSA-N 1 2 243.310 2.302 20 0 BEADLO Cn1ccnc1C[N@H+]1CCC=C(c2ccco2)C1 ZINC000285402943 385924921 /nfs/dbraw/zinc/92/49/21/385924921.db2.gz UCWSTGPKBFXOOI-UHFFFAOYSA-N 1 2 243.310 2.302 20 0 BEADLO Cc1c[nH]nc1CNc1ccc(C)[nH+]c1C ZINC000289464005 385926926 /nfs/dbraw/zinc/92/69/26/385926926.db2.gz IJCNMUJKNJNADS-UHFFFAOYSA-N 1 2 216.288 2.342 20 0 BEADLO Cc1c[nH+]cc(N[C@@H](C)Cn2cccn2)c1 ZINC000123177266 385866840 /nfs/dbraw/zinc/86/68/40/385866840.db2.gz SWKOVCISLVUDAX-NSHDSACASA-N 1 2 216.288 2.087 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@H](C)c1cccc(CO)c1 ZINC000272010562 385868298 /nfs/dbraw/zinc/86/82/98/385868298.db2.gz UGQXCOUJIAZJOZ-SNVBAGLBSA-N 1 2 245.326 2.061 20 0 BEADLO Fc1ccc([C@@H]([NH2+]C2CCC2)c2nnc[nH]2)cc1 ZINC000294564467 385868544 /nfs/dbraw/zinc/86/85/44/385868544.db2.gz BPUZWKLUXZINHH-GFCCVEGCSA-N 1 2 246.289 2.175 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)NCC1(C2CC2)CCC1 ZINC000284519906 385873943 /nfs/dbraw/zinc/87/39/43/385873943.db2.gz WDSUOGVKDWHGMJ-SNAWJCMRSA-N 1 2 245.326 2.119 20 0 BEADLO Cc1nc(C)c(C[NH2+][C@@H]2CCCc3c[nH]nc32)o1 ZINC000647925858 385975541 /nfs/dbraw/zinc/97/55/41/385975541.db2.gz ASBDEOHCPUVSRC-LLVKDONJSA-N 1 2 246.314 2.182 20 0 BEADLO CO[C@@H](C[N@H+](CC(F)F)C(C)C)C1CC1 ZINC000425413229 385982643 /nfs/dbraw/zinc/98/26/43/385982643.db2.gz GILOQDNRFXNNJO-JTQLQIEISA-N 1 2 221.291 2.387 20 0 BEADLO CO[C@@H](C[N@@H+](CC(F)F)C(C)C)C1CC1 ZINC000425413229 385982648 /nfs/dbraw/zinc/98/26/48/385982648.db2.gz GILOQDNRFXNNJO-JTQLQIEISA-N 1 2 221.291 2.387 20 0 BEADLO C[C@@H]1c2ccccc2C[N@H+]1CC(=O)NC(C)(C)C ZINC000334321390 385985823 /nfs/dbraw/zinc/98/58/23/385985823.db2.gz HWHLEFJHTUQOCT-LLVKDONJSA-N 1 2 246.354 2.478 20 0 BEADLO C[C@@H]1c2ccccc2C[N@@H+]1CC(=O)NC(C)(C)C ZINC000334321390 385985828 /nfs/dbraw/zinc/98/58/28/385985828.db2.gz HWHLEFJHTUQOCT-LLVKDONJSA-N 1 2 246.354 2.478 20 0 BEADLO COC(=O)c1occc1C[N@H+](C)Cc1ccoc1 ZINC000345088938 385991913 /nfs/dbraw/zinc/99/19/13/385991913.db2.gz GANALXINGXDAJX-UHFFFAOYSA-N 1 2 249.266 2.291 20 0 BEADLO COC(=O)c1occc1C[N@@H+](C)Cc1ccoc1 ZINC000345088938 385991922 /nfs/dbraw/zinc/99/19/22/385991922.db2.gz GANALXINGXDAJX-UHFFFAOYSA-N 1 2 249.266 2.291 20 0 BEADLO Cc1cc(C)c(CNC(=O)C2CC=CC2)c[nH+]1 ZINC000335043765 385935855 /nfs/dbraw/zinc/93/58/55/385935855.db2.gz KNTNAWIBXXWFHN-UHFFFAOYSA-N 1 2 230.311 2.281 20 0 BEADLO C[C@H]([NH2+]Cc1ccoc1)c1cc2n(n1)CCC2 ZINC000414065499 385941151 /nfs/dbraw/zinc/94/11/51/385941151.db2.gz GYSHEHWILWUYRT-JTQLQIEISA-N 1 2 231.299 2.273 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+]2CCO[C@@H](C3CC3)C2)o1 ZINC000335853994 385948068 /nfs/dbraw/zinc/94/80/68/385948068.db2.gz CSUJNNGRZOVUIN-CMPLNLGQSA-N 1 2 236.315 2.155 20 0 BEADLO Cc1cnc([C@H](C)[N@H+]2CCO[C@@H](C3CC3)C2)o1 ZINC000335853994 385948074 /nfs/dbraw/zinc/94/80/74/385948074.db2.gz CSUJNNGRZOVUIN-CMPLNLGQSA-N 1 2 236.315 2.155 20 0 BEADLO C[C@@H]1COCC[C@H]1[NH2+]c1ccc2c(c1)CCN2 ZINC000335051674 385949012 /nfs/dbraw/zinc/94/90/12/385949012.db2.gz CDOXZVLVWJLHSI-ZWNOBZJWSA-N 1 2 232.327 2.492 20 0 BEADLO C[C@@H]1COCC[C@H]1Nc1ccc2c(c1)CC[NH2+]2 ZINC000335051674 385949019 /nfs/dbraw/zinc/94/90/19/385949019.db2.gz CDOXZVLVWJLHSI-ZWNOBZJWSA-N 1 2 232.327 2.492 20 0 BEADLO C[C@H](CC(C)(C)O)Nc1cc[nH+]c(C2CC2)n1 ZINC000295040422 385950104 /nfs/dbraw/zinc/95/01/04/385950104.db2.gz SRXYGGDHXSAQLF-SECBINFHSA-N 1 2 235.331 2.315 20 0 BEADLO COC(=O)c1ccoc1C[N@H+](C)Cc1ccoc1 ZINC000345090863 385993593 /nfs/dbraw/zinc/99/35/93/385993593.db2.gz LRQLELQDAODJNX-UHFFFAOYSA-N 1 2 249.266 2.291 20 0 BEADLO COC(=O)c1ccoc1C[N@@H+](C)Cc1ccoc1 ZINC000345090863 385993596 /nfs/dbraw/zinc/99/35/96/385993596.db2.gz LRQLELQDAODJNX-UHFFFAOYSA-N 1 2 249.266 2.291 20 0 BEADLO CCO[C@@H](C)c1noc(C[NH+](CC)CC)n1 ZINC000115939236 385956811 /nfs/dbraw/zinc/95/68/11/385956811.db2.gz RCSLQTVZQQCIDM-VIFPVBQESA-N 1 2 227.308 2.009 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)C1(C)CCCCCC1 ZINC000272992408 385958095 /nfs/dbraw/zinc/95/80/95/385958095.db2.gz QPLIHJVDLHSNDG-UHFFFAOYSA-N 1 2 249.358 2.397 20 0 BEADLO Cc1cc(CNc2ccc[nH+]c2C)on1 ZINC000309095443 385959277 /nfs/dbraw/zinc/95/92/77/385959277.db2.gz GMVRRLDIBQVFBE-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO COC(=O)[C@H]([NH2+]Cc1c(C)cccc1C)C1CC1 ZINC000273022592 385961269 /nfs/dbraw/zinc/96/12/69/385961269.db2.gz XBIGRMLGLZOPSR-CQSZACIVSA-N 1 2 247.338 2.345 20 0 BEADLO FCC1CC[NH+](Cc2nccn2C(F)F)CC1 ZINC000295099708 385965763 /nfs/dbraw/zinc/96/57/63/385965763.db2.gz SOJWRLJQCMLFAD-UHFFFAOYSA-N 1 2 247.264 2.460 20 0 BEADLO Cn1c(Cl)cnc1C[NH+]1CCC(CF)CC1 ZINC000295108907 385969905 /nfs/dbraw/zinc/96/99/05/385969905.db2.gz URSNWUZOHCDTMU-UHFFFAOYSA-N 1 2 245.729 2.255 20 0 BEADLO Cc1nc(C)c(C[NH2+][C@H]2CCCc3c[nH]nc32)o1 ZINC000647925859 385975203 /nfs/dbraw/zinc/97/52/03/385975203.db2.gz ASBDEOHCPUVSRC-NSHDSACASA-N 1 2 246.314 2.182 20 0 BEADLO CCC[C@@H]1CCCCN1C(=O)CCn1cc[nH+]c1 ZINC000273427437 385998502 /nfs/dbraw/zinc/99/85/02/385998502.db2.gz SRKYZQCYHGKJOX-CYBMUJFWSA-N 1 2 249.358 2.454 20 0 BEADLO FC(F)(F)CC[N@@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000286126781 385999209 /nfs/dbraw/zinc/99/92/09/385999209.db2.gz MKIPGNCPHXUIIE-SECBINFHSA-N 1 2 233.237 2.499 20 0 BEADLO FC(F)(F)CC[N@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000286126781 385999214 /nfs/dbraw/zinc/99/92/14/385999214.db2.gz MKIPGNCPHXUIIE-SECBINFHSA-N 1 2 233.237 2.499 20 0 BEADLO CCS[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)C(=O)OC ZINC000189517045 386017707 /nfs/dbraw/zinc/01/77/07/386017707.db2.gz NVBDKOXOSAOVPM-HBNTYKKESA-N 1 2 245.388 2.202 20 0 BEADLO Cc1cnc(C[N@@H+]2CC[C@@](C)(F)C2)s1 ZINC000335901098 386026554 /nfs/dbraw/zinc/02/65/54/386026554.db2.gz BKFMOIASEHTOGR-SNVBAGLBSA-N 1 2 214.309 2.385 20 0 BEADLO Cc1cnc(C[N@H+]2CC[C@@](C)(F)C2)s1 ZINC000335901098 386026558 /nfs/dbraw/zinc/02/65/58/386026558.db2.gz BKFMOIASEHTOGR-SNVBAGLBSA-N 1 2 214.309 2.385 20 0 BEADLO C[NH2+]Cc1noc([C@@H](C)CC(C)(C)C)n1 ZINC000414638331 386026786 /nfs/dbraw/zinc/02/67/86/386026786.db2.gz DUDQMYGOIFRCDI-QMMMGPOBSA-N 1 2 211.309 2.329 20 0 BEADLO C[NH2+]Cc1noc(Cc2ccc(Cl)s2)n1 ZINC000414639872 386030714 /nfs/dbraw/zinc/03/07/14/386030714.db2.gz HKWMHYTWXQZFOH-UHFFFAOYSA-N 1 2 243.719 2.095 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@@]12CCC[C@@H](C)C2 ZINC000414196457 386034962 /nfs/dbraw/zinc/03/49/62/386034962.db2.gz OWYDLMAUSMLGBO-MFKMUULPSA-N 1 2 224.348 2.123 20 0 BEADLO CO[C@H](C)CN(C)c1[nH]c2ccccc2[nH+]1 ZINC000286413914 386035730 /nfs/dbraw/zinc/03/57/30/386035730.db2.gz ODFFXNHYCYDODM-SECBINFHSA-N 1 2 219.288 2.034 20 0 BEADLO COc1ccncc1C[N@@H+]1CCC[C@@](C)(F)C1 ZINC000295498957 386042730 /nfs/dbraw/zinc/04/27/30/386042730.db2.gz SKHFXNYDEGKHCU-CYBMUJFWSA-N 1 2 238.306 2.414 20 0 BEADLO COc1ccncc1C[N@H+]1CCC[C@@](C)(F)C1 ZINC000295498957 386042740 /nfs/dbraw/zinc/04/27/40/386042740.db2.gz SKHFXNYDEGKHCU-CYBMUJFWSA-N 1 2 238.306 2.414 20 0 BEADLO CO[C@H](C[N@H+](C)Cc1ccon1)c1ccccc1 ZINC000338548313 386042687 /nfs/dbraw/zinc/04/26/87/386042687.db2.gz SJKNPLMWWLTMKG-CQSZACIVSA-N 1 2 246.310 2.494 20 0 BEADLO CO[C@H](C[N@@H+](C)Cc1ccon1)c1ccccc1 ZINC000338548313 386042693 /nfs/dbraw/zinc/04/26/93/386042693.db2.gz SJKNPLMWWLTMKG-CQSZACIVSA-N 1 2 246.310 2.494 20 0 BEADLO Cc1cc(CNC(=O)[C@H]2CC2(C)C)cc(C)[nH+]1 ZINC000335075676 386044939 /nfs/dbraw/zinc/04/49/39/386044939.db2.gz UFAHCKWZMWJXIF-GFCCVEGCSA-N 1 2 232.327 2.361 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000335076249 386045493 /nfs/dbraw/zinc/04/54/93/386045493.db2.gz KIBDZYSDENGWIW-MNOVXSKESA-N 1 2 235.331 2.194 20 0 BEADLO Cc1ccc(Cc2noc(C3CC3)n2)c[nH+]1 ZINC000273880134 386046458 /nfs/dbraw/zinc/04/64/58/386046458.db2.gz GXFGSQGKBHQEIO-UHFFFAOYSA-N 1 2 215.256 2.241 20 0 BEADLO CO[C@H](C)CCC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000355304272 386047856 /nfs/dbraw/zinc/04/78/56/386047856.db2.gz HMHRGACBLCZEBY-SNVBAGLBSA-N 1 2 247.298 2.088 20 0 BEADLO Cc1ccc(Cc2noc(C(C)C)n2)c[nH+]1 ZINC000273894789 386048316 /nfs/dbraw/zinc/04/83/16/386048316.db2.gz ILASAMOWGIDISR-UHFFFAOYSA-N 1 2 217.272 2.487 20 0 BEADLO Cc1ccc(Cc2noc([C@]3(C)C[C@H]3F)n2)c[nH+]1 ZINC000335078666 386051871 /nfs/dbraw/zinc/05/18/71/386051871.db2.gz RILKLVBBSPABKF-ZWNOBZJWSA-N 1 2 247.273 2.363 20 0 BEADLO CCC(C)(C)NC(=O)C[N@H+](C)Cc1ccoc1 ZINC000345101173 385996122 /nfs/dbraw/zinc/99/61/22/385996122.db2.gz UEVVPUNMJFFYKM-UHFFFAOYSA-N 1 2 238.331 2.016 20 0 BEADLO CCC(C)(C)NC(=O)C[N@@H+](C)Cc1ccoc1 ZINC000345101173 385996128 /nfs/dbraw/zinc/99/61/28/385996128.db2.gz UEVVPUNMJFFYKM-UHFFFAOYSA-N 1 2 238.331 2.016 20 0 BEADLO CO[C@H]1C[C@@H](N(C)C(=O)Nc2cc[nH+]cc2C)C1 ZINC000287206786 386103908 /nfs/dbraw/zinc/10/39/08/386103908.db2.gz UKSPFDSCCBWMAH-PHIMTYICSA-N 1 2 249.314 2.031 20 0 BEADLO CC[C@H]1CCC[C@H]1C(=O)N1CCn2c[nH+]cc2C1 ZINC000295898910 386104030 /nfs/dbraw/zinc/10/40/30/386104030.db2.gz CYHDEQRMIWFKHA-WCQYABFASA-N 1 2 247.342 2.052 20 0 BEADLO CCO[C@H](C)c1noc(C[N@H+](C)C2CCC2)n1 ZINC000075840678 386104447 /nfs/dbraw/zinc/10/44/47/386104447.db2.gz TVPAFVYOUCVGFY-SECBINFHSA-N 1 2 239.319 2.151 20 0 BEADLO CCO[C@H](C)c1noc(C[N@@H+](C)C2CCC2)n1 ZINC000075840678 386104452 /nfs/dbraw/zinc/10/44/52/386104452.db2.gz TVPAFVYOUCVGFY-SECBINFHSA-N 1 2 239.319 2.151 20 0 BEADLO CC[C@@H](C)[NH2+][C@@H](c1cccs1)c1nnc[nH]1 ZINC000295964888 386114440 /nfs/dbraw/zinc/11/44/40/386114440.db2.gz MKCKCFHSCSRFDC-SCZZXKLOSA-N 1 2 236.344 2.344 20 0 BEADLO Cc1cnc(CCN(C)c2cc(C)[nH+]cn2)s1 ZINC000166019796 386116762 /nfs/dbraw/zinc/11/67/62/386116762.db2.gz MMUUKHCSWVXNLY-UHFFFAOYSA-N 1 2 248.355 2.229 20 0 BEADLO C[N@H+](CCOC1CCC1)Cc1cscn1 ZINC000287407248 386119070 /nfs/dbraw/zinc/11/90/70/386119070.db2.gz SBPWQCHROPPHKZ-UHFFFAOYSA-N 1 2 226.345 2.144 20 0 BEADLO C[N@@H+](CCOC1CCC1)Cc1cscn1 ZINC000287407248 386119077 /nfs/dbraw/zinc/11/90/77/386119077.db2.gz SBPWQCHROPPHKZ-UHFFFAOYSA-N 1 2 226.345 2.144 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)[C@H]1CCCC1(C)C ZINC000274584977 386124173 /nfs/dbraw/zinc/12/41/73/386124173.db2.gz GDWBLYUAIOUZSH-VXGBXAGGSA-N 1 2 249.358 2.214 20 0 BEADLO CCCCC(=O)OCc1c[nH+]ccc1OC ZINC000286630222 386061324 /nfs/dbraw/zinc/06/13/24/386061324.db2.gz AVJLJXIDWQEXPZ-UHFFFAOYSA-N 1 2 223.272 2.324 20 0 BEADLO C/C=C(/C=C\c1nc(C[NH2+]C)no1)CC ZINC000414647553 386061891 /nfs/dbraw/zinc/06/18/91/386061891.db2.gz UMCNBHVTPYVEBO-WSISTYIOSA-N 1 2 207.277 2.159 20 0 BEADLO Cc1nocc1C[N@H+]1CC[C@H](C)C[C@@H]1C(N)=O ZINC000334444047 386066397 /nfs/dbraw/zinc/06/63/97/386066397.db2.gz MTOIEHMYEXCDMA-GZMMTYOYSA-N 1 2 237.303 2.119 20 0 BEADLO Cc1nocc1C[N@@H+]1CC[C@H](C)C[C@@H]1C(N)=O ZINC000334444047 386066401 /nfs/dbraw/zinc/06/64/01/386066401.db2.gz MTOIEHMYEXCDMA-GZMMTYOYSA-N 1 2 237.303 2.119 20 0 BEADLO CCCCC(=O)N(C)Cc1cn2c([nH+]1)CCCC2 ZINC000365410508 386083143 /nfs/dbraw/zinc/08/31/43/386083143.db2.gz MDVPYTSEQMXDSA-UHFFFAOYSA-N 1 2 249.358 2.368 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@@H](n3cccn3)C2)o1 ZINC000334450451 386089927 /nfs/dbraw/zinc/08/99/27/386089927.db2.gz TVJULFVENHJDJD-GFCCVEGCSA-N 1 2 246.314 2.017 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@@H](n3cccn3)C2)o1 ZINC000334450451 386089935 /nfs/dbraw/zinc/08/99/35/386089935.db2.gz TVJULFVENHJDJD-GFCCVEGCSA-N 1 2 246.314 2.017 20 0 BEADLO C[C@@H](C(N)=O)[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000287006964 386090219 /nfs/dbraw/zinc/09/02/19/386090219.db2.gz QKMDGLLGKXIHLP-WCBMZHEXSA-N 1 2 238.356 2.005 20 0 BEADLO C[C@@H](C(N)=O)[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000287006964 386090227 /nfs/dbraw/zinc/09/02/27/386090227.db2.gz QKMDGLLGKXIHLP-WCBMZHEXSA-N 1 2 238.356 2.005 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)N(C)CCCn2cc[nH+]c2)C1 ZINC000345287075 386091236 /nfs/dbraw/zinc/09/12/36/386091236.db2.gz OFUOUGJRJBHROD-OLZOCXBDSA-N 1 2 249.358 2.168 20 0 BEADLO COC[C@@H]([NH2+]Cc1cc(C)no1)c1ccccc1 ZINC000223718675 386096093 /nfs/dbraw/zinc/09/60/93/386096093.db2.gz LXEJLJHXXRTWFG-CQSZACIVSA-N 1 2 246.310 2.460 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NCCNc2cccc[nH+]2)C1 ZINC000345307888 386098755 /nfs/dbraw/zinc/09/87/55/386098755.db2.gz FZFSQIKEEABVQW-VXGBXAGGSA-N 1 2 247.342 2.046 20 0 BEADLO FC1=CCC[N@H+](CCc2cscn2)C1 ZINC000296205204 386150955 /nfs/dbraw/zinc/15/09/55/386150955.db2.gz FRBVBJOSVPHNPH-UHFFFAOYSA-N 1 2 212.293 2.245 20 0 BEADLO FC1=CCC[N@@H+](CCc2cscn2)C1 ZINC000296205204 386150957 /nfs/dbraw/zinc/15/09/57/386150957.db2.gz FRBVBJOSVPHNPH-UHFFFAOYSA-N 1 2 212.293 2.245 20 0 BEADLO CO[C@H](C[N@@H+]1CC[C@H](C)C(F)(F)C1)C1CC1 ZINC000425482268 386152150 /nfs/dbraw/zinc/15/21/50/386152150.db2.gz QKBOZROPHJIUBD-GXSJLCMTSA-N 1 2 233.302 2.389 20 0 BEADLO CO[C@H](C[N@H+]1CC[C@H](C)C(F)(F)C1)C1CC1 ZINC000425482268 386152155 /nfs/dbraw/zinc/15/21/55/386152155.db2.gz QKBOZROPHJIUBD-GXSJLCMTSA-N 1 2 233.302 2.389 20 0 BEADLO CCOc1cccc([C@H](C)[NH2+]Cc2cnn[nH]2)c1 ZINC000296341200 386163145 /nfs/dbraw/zinc/16/31/45/386163145.db2.gz QFBWJTXVEQIDJG-JTQLQIEISA-N 1 2 246.314 2.054 20 0 BEADLO CCOc1cccc([C@H](C)[NH2+]Cc2c[nH]nn2)c1 ZINC000296341200 386163147 /nfs/dbraw/zinc/16/31/47/386163147.db2.gz QFBWJTXVEQIDJG-JTQLQIEISA-N 1 2 246.314 2.054 20 0 BEADLO CC[C@H]1CCC[C@H](Nc2nc(C)[nH+]c(N)n2)C1 ZINC000310214255 386164735 /nfs/dbraw/zinc/16/47/35/386164735.db2.gz FMRPRCKCABCLEO-UWVGGRQHSA-N 1 2 235.335 2.143 20 0 BEADLO CC[C@H]1CCC[C@H](Nc2nc(N)nc(C)[nH+]2)C1 ZINC000310214255 386164738 /nfs/dbraw/zinc/16/47/38/386164738.db2.gz FMRPRCKCABCLEO-UWVGGRQHSA-N 1 2 235.335 2.143 20 0 BEADLO CCN(CC(C)C)C(=O)C(C)(C)c1c[nH+]c[nH]1 ZINC000346139380 386165047 /nfs/dbraw/zinc/16/50/47/386165047.db2.gz ROEBZYJZYRMANJ-UHFFFAOYSA-N 1 2 237.347 2.192 20 0 BEADLO Cc1[nH]c(C(=O)NCC(C)(C)C2CCC2)c[nH+]1 ZINC000296399505 386169651 /nfs/dbraw/zinc/16/96/51/386169651.db2.gz JJDPZFQHTGBDEW-UHFFFAOYSA-N 1 2 235.331 2.274 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)C(C)(C)C1CC1 ZINC000288132765 386171440 /nfs/dbraw/zinc/17/14/40/386171440.db2.gz KHLHCAPUAGGLRJ-UHFFFAOYSA-N 1 2 249.358 2.168 20 0 BEADLO C[C@@H](CNc1cc[nH+]c(C2CC2)n1)CC(F)F ZINC000645304894 386172765 /nfs/dbraw/zinc/17/27/65/386172765.db2.gz NCRHEINLVGOMAK-MRVPVSSYSA-N 1 2 241.285 2.479 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@@H](C)OC[C@H]2CC)cn1 ZINC000414372615 386174517 /nfs/dbraw/zinc/17/45/17/386174517.db2.gz PXTCMZBAWFEZRD-DGCLKSJQSA-N 1 2 249.358 2.038 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@@H](C)OC[C@H]2CC)cn1 ZINC000414372615 386174524 /nfs/dbraw/zinc/17/45/24/386174524.db2.gz PXTCMZBAWFEZRD-DGCLKSJQSA-N 1 2 249.358 2.038 20 0 BEADLO CC1(C)CCCC[C@@H]1NC(=O)CCc1[nH]cc[nH+]1 ZINC000288270371 386180099 /nfs/dbraw/zinc/18/00/99/386180099.db2.gz GGWSCBYFCVSKLW-NSHDSACASA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@]1(C)CCCN(C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000288294396 386182965 /nfs/dbraw/zinc/18/29/65/386182965.db2.gz YCGGHSLLMBIIIE-CQSZACIVSA-N 1 2 249.358 2.381 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1c[nH]c2ccccc12 ZINC000190484172 386186391 /nfs/dbraw/zinc/18/63/91/386186391.db2.gz JESRYOXTAMAQPQ-UHFFFAOYSA-N 1 2 246.310 2.163 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1c[nH]c2ccccc12 ZINC000190484172 386186399 /nfs/dbraw/zinc/18/63/99/386186399.db2.gz JESRYOXTAMAQPQ-UHFFFAOYSA-N 1 2 246.310 2.163 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2cncc(F)c2)CCO1 ZINC000275174978 386188636 /nfs/dbraw/zinc/18/86/36/386188636.db2.gz YSEYMCJAOKTTOG-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2cncc(F)c2)CCO1 ZINC000275174978 386188637 /nfs/dbraw/zinc/18/86/37/386188637.db2.gz YSEYMCJAOKTTOG-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO COC(C[N@@H+]1Cc2cccc(Cl)c2C1)OC ZINC000287492433 386126625 /nfs/dbraw/zinc/12/66/25/386126625.db2.gz SVYHBKUEKXBQSJ-UHFFFAOYSA-N 1 2 241.718 2.275 20 0 BEADLO COC(C[N@H+]1Cc2cccc(Cl)c2C1)OC ZINC000287492433 386126633 /nfs/dbraw/zinc/12/66/33/386126633.db2.gz SVYHBKUEKXBQSJ-UHFFFAOYSA-N 1 2 241.718 2.275 20 0 BEADLO Cc1nc(CN2CCC[C@H]2c2[nH]cc[nH+]2)oc1C ZINC000334466895 386129950 /nfs/dbraw/zinc/12/99/50/386129950.db2.gz VWQDEXNBILLCKL-NSHDSACASA-N 1 2 246.314 2.352 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnn(C)c2C(F)(F)F)[C@H]1C ZINC000334464849 386135857 /nfs/dbraw/zinc/13/58/57/386135857.db2.gz TVUDQUDXTMTUQS-SFYZADRCSA-N 1 2 247.264 2.279 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnn(C)c2C(F)(F)F)[C@H]1C ZINC000334464849 386135861 /nfs/dbraw/zinc/13/58/61/386135861.db2.gz TVUDQUDXTMTUQS-SFYZADRCSA-N 1 2 247.264 2.279 20 0 BEADLO Cc1cc(C[N@H+](C2CC2)C2COC2)cs1 ZINC000296098553 386137445 /nfs/dbraw/zinc/13/74/45/386137445.db2.gz RRXYQVPWCLAGHE-UHFFFAOYSA-N 1 2 223.341 2.420 20 0 BEADLO Cc1cc(C[N@@H+](C2CC2)C2COC2)cs1 ZINC000296098553 386137448 /nfs/dbraw/zinc/13/74/48/386137448.db2.gz RRXYQVPWCLAGHE-UHFFFAOYSA-N 1 2 223.341 2.420 20 0 BEADLO CCO[C@H](C)c1noc(C[NH+]2CCCCC2)n1 ZINC000076715151 386138854 /nfs/dbraw/zinc/13/88/54/386138854.db2.gz FXXVNONDDZLEPW-SNVBAGLBSA-N 1 2 239.319 2.153 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)C[C@H]1C=CCCC1 ZINC000275169349 386189460 /nfs/dbraw/zinc/18/94/60/386189460.db2.gz UFDTXCDTFAOIKE-OLZOCXBDSA-N 1 2 247.342 2.134 20 0 BEADLO C[N@H+](CCOC1CCC1)Cc1nccs1 ZINC000287720627 386141922 /nfs/dbraw/zinc/14/19/22/386141922.db2.gz KBUUYXBKLMQAAK-UHFFFAOYSA-N 1 2 226.345 2.144 20 0 BEADLO C[N@@H+](CCOC1CCC1)Cc1nccs1 ZINC000287720627 386141926 /nfs/dbraw/zinc/14/19/26/386141926.db2.gz KBUUYXBKLMQAAK-UHFFFAOYSA-N 1 2 226.345 2.144 20 0 BEADLO Cc1cc(N[C@H]2CC2(C)C)nc(C2CC2)[nH+]1 ZINC000336742697 386205413 /nfs/dbraw/zinc/20/54/13/386205413.db2.gz SFCIVJHGENMFAD-JTQLQIEISA-N 1 2 217.316 2.295 20 0 BEADLO C[C@@H](C[N@H+](C)Cc1nnc[nH]1)C1CCCCC1 ZINC000339017996 386211809 /nfs/dbraw/zinc/21/18/09/386211809.db2.gz YJKDUZCHMUHNAC-NSHDSACASA-N 1 2 236.363 2.453 20 0 BEADLO C[C@@H](C[N@@H+](C)Cc1nnc[nH]1)C1CCCCC1 ZINC000339017996 386211816 /nfs/dbraw/zinc/21/18/16/386211816.db2.gz YJKDUZCHMUHNAC-NSHDSACASA-N 1 2 236.363 2.453 20 0 BEADLO Cc1cc(CNC(=O)CCC(F)F)cc(C)[nH+]1 ZINC000643319023 386219466 /nfs/dbraw/zinc/21/94/66/386219466.db2.gz SDDBJZNXSZZCRH-UHFFFAOYSA-N 1 2 242.269 2.360 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)NN1CCCCC1 ZINC000297043369 386220067 /nfs/dbraw/zinc/22/00/67/386220067.db2.gz MQQOYRYDQFCEQB-UHFFFAOYSA-N 1 2 248.330 2.221 20 0 BEADLO Cc1ccc(NC(=O)N[C@@H](C)CF)c(C)[nH+]1 ZINC000288967736 386246164 /nfs/dbraw/zinc/24/61/64/386246164.db2.gz CJULZSXFMAFVAN-QMMMGPOBSA-N 1 2 225.267 2.178 20 0 BEADLO CN(C)c1ccccc1C[NH2+]Cc1cocn1 ZINC000264539911 386246802 /nfs/dbraw/zinc/24/68/02/386246802.db2.gz ALLOSLYTKQYZDC-UHFFFAOYSA-N 1 2 231.299 2.030 20 0 BEADLO Nc1[nH+]cnc(N2CCCCCCC2)c1Cl ZINC000236389222 386261047 /nfs/dbraw/zinc/26/10/47/386261047.db2.gz IMPIIQCYKZUNMS-UHFFFAOYSA-N 1 2 240.738 2.483 20 0 BEADLO Nc1nc[nH+]c(N2CCCCCCC2)c1Cl ZINC000236389222 386261050 /nfs/dbraw/zinc/26/10/50/386261050.db2.gz IMPIIQCYKZUNMS-UHFFFAOYSA-N 1 2 240.738 2.483 20 0 BEADLO Cn1ccc(CSc2[nH+]cc3ccccn32)n1 ZINC000339119497 386250379 /nfs/dbraw/zinc/25/03/79/386250379.db2.gz SYXMSXVRPGSBAW-UHFFFAOYSA-N 1 2 244.323 2.360 20 0 BEADLO Cc1ccc(C[N@H+]2CCOC[C@H]2CC(C)C)nn1 ZINC000414390060 386252751 /nfs/dbraw/zinc/25/27/51/386252751.db2.gz VFLSUBXHMLJPGW-CQSZACIVSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1ccc(C[N@@H+]2CCOC[C@H]2CC(C)C)nn1 ZINC000414390060 386252752 /nfs/dbraw/zinc/25/27/52/386252752.db2.gz VFLSUBXHMLJPGW-CQSZACIVSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H](C)CCc2ccco2)c[nH+]1 ZINC000264891665 386281642 /nfs/dbraw/zinc/28/16/42/386281642.db2.gz VJOQZKILGVYEHS-VIFPVBQESA-N 1 2 247.298 2.062 20 0 BEADLO CC(C)[C@H](C)C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000264968034 386289836 /nfs/dbraw/zinc/28/98/36/386289836.db2.gz GHMGIAWGHCMDBS-RYUDHWBXSA-N 1 2 249.358 2.408 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2nonc2C)cc1 ZINC000264988248 386292221 /nfs/dbraw/zinc/29/22/21/386292221.db2.gz APURPRBRODXBIN-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2nonc2C)cc1 ZINC000264988248 386292226 /nfs/dbraw/zinc/29/22/26/386292226.db2.gz APURPRBRODXBIN-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO FC(F)CNCc1c[nH+]c2ccc(Cl)cn12 ZINC000298050770 386295528 /nfs/dbraw/zinc/29/55/28/386295528.db2.gz ISBHNADPOSBSNL-UHFFFAOYSA-N 1 2 245.660 2.342 20 0 BEADLO COC(=O)[C@H]([NH2+]Cc1cc(C)ccc1C)C1CC1 ZINC000276281038 386297218 /nfs/dbraw/zinc/29/72/18/386297218.db2.gz FHOZSIOKYZUETM-CQSZACIVSA-N 1 2 247.338 2.345 20 0 BEADLO Clc1ccc2c(c1)[C@@H](NCc1[nH]cc[nH+]1)CO2 ZINC000334481352 386300505 /nfs/dbraw/zinc/30/05/05/386300505.db2.gz WGULFEHHPVHWOY-JTQLQIEISA-N 1 2 249.701 2.286 20 0 BEADLO Clc1ccc2c(c1)[C@@H]([NH2+]Cc1ncc[nH]1)CO2 ZINC000334481352 386300508 /nfs/dbraw/zinc/30/05/08/386300508.db2.gz WGULFEHHPVHWOY-JTQLQIEISA-N 1 2 249.701 2.286 20 0 BEADLO CCn1c[nH+]cc1CNc1ncc(C)s1 ZINC000416426826 386304075 /nfs/dbraw/zinc/30/40/75/386304075.db2.gz NNYZFESMNJMPHQ-UHFFFAOYSA-N 1 2 222.317 2.280 20 0 BEADLO C[C@@H](C(=O)Nc1ccc(N)[nH+]c1)C(C)(C)C ZINC000262553849 386308326 /nfs/dbraw/zinc/30/83/26/386308326.db2.gz URWGYUARFTYGSL-QMMMGPOBSA-N 1 2 221.304 2.285 20 0 BEADLO Cc1cc(CNC(=O)NC2(C)CCC2)cc(C)[nH+]1 ZINC000643384261 386310703 /nfs/dbraw/zinc/31/07/03/386310703.db2.gz VEGNKOJCEXWNRD-UHFFFAOYSA-N 1 2 247.342 2.440 20 0 BEADLO COC[C@@H](C)SCc1c[nH+]ccc1OC ZINC000289485119 386314085 /nfs/dbraw/zinc/31/40/85/386314085.db2.gz XRXUYUYPWFDYGQ-SECBINFHSA-N 1 2 227.329 2.358 20 0 BEADLO COC(C)(C)c1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000289144713 386266767 /nfs/dbraw/zinc/26/67/67/386266767.db2.gz OMYLMLPDLPSPOT-UHFFFAOYSA-N 1 2 247.298 2.245 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cncc(F)c2)[C@H](C)[C@@H](C)O1 ZINC000347181065 386271702 /nfs/dbraw/zinc/27/17/02/386271702.db2.gz JTVDTSWPNZCXTD-GMTAPVOTSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cncc(F)c2)[C@H](C)[C@@H](C)O1 ZINC000347181065 386271705 /nfs/dbraw/zinc/27/17/05/386271705.db2.gz JTVDTSWPNZCXTD-GMTAPVOTSA-N 1 2 238.306 2.218 20 0 BEADLO CC(C)[C@H](C)C(=O)NCc1cn2ccccc2[nH+]1 ZINC000264820153 386273348 /nfs/dbraw/zinc/27/33/48/386273348.db2.gz DDAOOAQMDLCEJA-NSHDSACASA-N 1 2 245.326 2.243 20 0 BEADLO CCOc1nnc(C[N@@H+]2CC[C@@H](C)[C@@H]2C)s1 ZINC000336659577 386276859 /nfs/dbraw/zinc/27/68/59/386276859.db2.gz ADAIPPBRZIWPSQ-BDAKNGLRSA-N 1 2 241.360 2.167 20 0 BEADLO CCOc1nnc(C[N@H+]2CC[C@@H](C)[C@@H]2C)s1 ZINC000336659577 386276860 /nfs/dbraw/zinc/27/68/60/386276860.db2.gz ADAIPPBRZIWPSQ-BDAKNGLRSA-N 1 2 241.360 2.167 20 0 BEADLO CCOc1nnc(C[N@@H+]2CC[C@H](C)[C@H]2C)s1 ZINC000336659579 386277007 /nfs/dbraw/zinc/27/70/07/386277007.db2.gz ADAIPPBRZIWPSQ-DTWKUNHWSA-N 1 2 241.360 2.167 20 0 BEADLO CCOc1nnc(C[N@H+]2CC[C@H](C)[C@H]2C)s1 ZINC000336659579 386277009 /nfs/dbraw/zinc/27/70/09/386277009.db2.gz ADAIPPBRZIWPSQ-DTWKUNHWSA-N 1 2 241.360 2.167 20 0 BEADLO CC(C)C[C@@H]1CCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000276538858 386340166 /nfs/dbraw/zinc/34/01/66/386340166.db2.gz FZSAMCMQTMQCBE-PCAWENJQSA-N 1 2 247.342 2.318 20 0 BEADLO CC(C)[C@H](NC(=O)c1ccoc1)c1[nH]cc[nH+]1 ZINC000276537770 386340298 /nfs/dbraw/zinc/34/02/98/386340298.db2.gz DRFGWZWZGLOQLY-JTQLQIEISA-N 1 2 233.271 2.130 20 0 BEADLO Cc1ccc(C(=O)N[C@@H](c2[nH]cc[nH+]2)C(C)C)o1 ZINC000276560244 386343166 /nfs/dbraw/zinc/34/31/66/386343166.db2.gz HJIMBJZBKPTUFW-LLVKDONJSA-N 1 2 247.298 2.438 20 0 BEADLO CC[C@@H](C)CC(=O)NC[C@@H](C)Cn1cc[nH+]c1 ZINC000276563424 386343864 /nfs/dbraw/zinc/34/38/64/386343864.db2.gz AEAFHZIRTZPGBB-VXGBXAGGSA-N 1 2 237.347 2.072 20 0 BEADLO COC1CC[NH+]([C@H](C)c2nnc(C)s2)CC1 ZINC000347350952 386345653 /nfs/dbraw/zinc/34/56/53/386345653.db2.gz QVMHTWZYGLCQRV-MRVPVSSYSA-N 1 2 241.360 2.018 20 0 BEADLO Cc1[nH+]cccc1Cc1nc([C@H]2C[C@@H]2C)no1 ZINC000334491684 386347909 /nfs/dbraw/zinc/34/79/09/386347909.db2.gz JIYBESACRWDCRA-KWQFWETISA-N 1 2 229.283 2.487 20 0 BEADLO CC1(C)CCCC[C@H]1C(=O)NCc1[nH]cc[nH+]1 ZINC000226627679 386349060 /nfs/dbraw/zinc/34/90/60/386349060.db2.gz SIRYYDJYTWEGBR-JTQLQIEISA-N 1 2 235.331 2.242 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccc(C)n2)on1 ZINC000336688119 386350657 /nfs/dbraw/zinc/35/06/57/386350657.db2.gz GVVSNKROVPUFAJ-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccc(C)n2)on1 ZINC000336688119 386350664 /nfs/dbraw/zinc/35/06/64/386350664.db2.gz GVVSNKROVPUFAJ-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1cccc(F)c1)c1ncnn1C ZINC000276624731 386355187 /nfs/dbraw/zinc/35/51/87/386355187.db2.gz NFWCENJVCWHOHH-NXEZZACHSA-N 1 2 248.305 2.366 20 0 BEADLO CCc1ccc(C[N@@H+]2CCC[C@](F)(CO)C2)o1 ZINC000289802394 386358807 /nfs/dbraw/zinc/35/88/07/386358807.db2.gz MWMBVCSFDFAILC-CYBMUJFWSA-N 1 2 241.306 2.138 20 0 BEADLO CCc1ccc(C[N@H+]2CCC[C@](F)(CO)C2)o1 ZINC000289802394 386358813 /nfs/dbraw/zinc/35/88/13/386358813.db2.gz MWMBVCSFDFAILC-CYBMUJFWSA-N 1 2 241.306 2.138 20 0 BEADLO Cc1nc(NCC2CCC(C)CC2)nc(N)[nH+]1 ZINC000310085308 386360540 /nfs/dbraw/zinc/36/05/40/386360540.db2.gz AACBVXLKSHBHOA-UHFFFAOYSA-N 1 2 235.335 2.000 20 0 BEADLO Cc1nc(N)nc(NCC2CCC(C)CC2)[nH+]1 ZINC000310085308 386360545 /nfs/dbraw/zinc/36/05/45/386360545.db2.gz AACBVXLKSHBHOA-UHFFFAOYSA-N 1 2 235.335 2.000 20 0 BEADLO Cc1cn2cc(NC(=O)NC3CCC3)ccc2[nH+]1 ZINC000265704517 386361812 /nfs/dbraw/zinc/36/18/12/386361812.db2.gz JKXIOXZQUQUOAU-UHFFFAOYSA-N 1 2 244.298 2.317 20 0 BEADLO COC(=O)c1coc(C[N@@H+]2CC[C@](C)(F)C2)c1 ZINC000347372771 386369788 /nfs/dbraw/zinc/36/97/88/386369788.db2.gz KGDAIARAQCFWJE-LBPRGKRZSA-N 1 2 241.262 2.000 20 0 BEADLO COC(=O)c1coc(C[N@H+]2CC[C@](C)(F)C2)c1 ZINC000347372771 386369794 /nfs/dbraw/zinc/36/97/94/386369794.db2.gz KGDAIARAQCFWJE-LBPRGKRZSA-N 1 2 241.262 2.000 20 0 BEADLO CCCCCC(=O)NC[C@H](C)Cn1cc[nH+]c1 ZINC000265816111 386372558 /nfs/dbraw/zinc/37/25/58/386372558.db2.gz NHAULSNNIUKVNF-LBPRGKRZSA-N 1 2 237.347 2.216 20 0 BEADLO CCCCCC(=O)NC[C@@H](C)Cn1cc[nH+]c1 ZINC000265816110 386373321 /nfs/dbraw/zinc/37/33/21/386373321.db2.gz NHAULSNNIUKVNF-GFCCVEGCSA-N 1 2 237.347 2.216 20 0 BEADLO C[C@@H]1C[C@H](O)C[N@@H+]1Cc1cc(F)c(F)cc1F ZINC000334495631 386376823 /nfs/dbraw/zinc/37/68/23/386376823.db2.gz SVGAPPBMFVHAGR-APPZFPTMSA-N 1 2 245.244 2.059 20 0 BEADLO C[C@@H]1C[C@H](O)C[N@H+]1Cc1cc(F)c(F)cc1F ZINC000334495631 386376825 /nfs/dbraw/zinc/37/68/25/386376825.db2.gz SVGAPPBMFVHAGR-APPZFPTMSA-N 1 2 245.244 2.059 20 0 BEADLO CC(C)c1nnc(C[NH+]2[C@@H](C)C[C@@H]2C)o1 ZINC000334495901 386378610 /nfs/dbraw/zinc/37/86/10/386378610.db2.gz YHBINBVNVRMSQL-IUCAKERBSA-N 1 2 209.293 2.176 20 0 BEADLO C[C@H](C(=O)OC(C)(C)C)[N@@H+]1CC[C@@](C)(F)C1 ZINC000347395708 386381536 /nfs/dbraw/zinc/38/15/36/386381536.db2.gz SXPNREUBPYDCQF-BXKDBHETSA-N 1 2 231.311 2.151 20 0 BEADLO C[C@H](C(=O)OC(C)(C)C)[N@H+]1CC[C@@](C)(F)C1 ZINC000347395708 386381541 /nfs/dbraw/zinc/38/15/41/386381541.db2.gz SXPNREUBPYDCQF-BXKDBHETSA-N 1 2 231.311 2.151 20 0 BEADLO CCCC[C@@H](C(=O)OC)[N@@H+]1CC[C@@](C)(F)C1 ZINC000347395444 386382123 /nfs/dbraw/zinc/38/21/23/386382123.db2.gz XJAUIVZTLWZQAQ-CMPLNLGQSA-N 1 2 231.311 2.152 20 0 BEADLO CCCC[C@@H](C(=O)OC)[N@H+]1CC[C@@](C)(F)C1 ZINC000347395444 386382127 /nfs/dbraw/zinc/38/21/27/386382127.db2.gz XJAUIVZTLWZQAQ-CMPLNLGQSA-N 1 2 231.311 2.152 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CCCC(C)(C)C2)c[nH+]1 ZINC000276863308 386383598 /nfs/dbraw/zinc/38/35/98/386383598.db2.gz CWXVXNAVJQCIAG-SNVBAGLBSA-N 1 2 235.331 2.417 20 0 BEADLO COC(=O)[C@H]([NH2+]Cc1cc(C)cc(C)c1)C1CC1 ZINC000276474932 386329903 /nfs/dbraw/zinc/32/99/03/386329903.db2.gz QZIPEYKYISWCRT-CQSZACIVSA-N 1 2 247.338 2.345 20 0 BEADLO CCN(CC(C)(C)O)c1cc(C)[nH+]c(C2CC2)n1 ZINC000265387309 386333254 /nfs/dbraw/zinc/33/32/54/386333254.db2.gz SNJFVRWDECAWBD-UHFFFAOYSA-N 1 2 249.358 2.260 20 0 BEADLO Cc1cc(C)c(C[NH2+][C@@]2(C)CCOC2=O)c(C)c1 ZINC000289625104 386335048 /nfs/dbraw/zinc/33/50/48/386335048.db2.gz RPYITZSHUBIMGS-HNNXBMFYSA-N 1 2 247.338 2.407 20 0 BEADLO CCc1ncc(C[N@H+](C)Cc2ccccn2)cn1 ZINC000414434651 386443917 /nfs/dbraw/zinc/44/39/17/386443917.db2.gz PYHYVWXXVGHAKW-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO CCc1ncc(C[N@@H+](C)Cc2ccccn2)cn1 ZINC000414434651 386443919 /nfs/dbraw/zinc/44/39/19/386443919.db2.gz PYHYVWXXVGHAKW-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO C[C@@H]1C[C@H]1CNc1cc(N2CCCC2)nc[nH+]1 ZINC000277593154 386449974 /nfs/dbraw/zinc/44/99/74/386449974.db2.gz UKQAIHUNYNZLJF-MNOVXSKESA-N 1 2 232.331 2.145 20 0 BEADLO C[C@@H]1C[C@H]1CNc1cc(N2CCCC2)[nH+]cn1 ZINC000277593154 386449984 /nfs/dbraw/zinc/44/99/84/386449984.db2.gz UKQAIHUNYNZLJF-MNOVXSKESA-N 1 2 232.331 2.145 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)CCn2cc[nH+]c2)[C@H]1C ZINC000298809556 386387895 /nfs/dbraw/zinc/38/78/95/386387895.db2.gz RVTYRIBZDDXCDN-AGIUHOORSA-N 1 2 249.358 2.214 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@H]2Cc2ccccc2)no1 ZINC000336703929 386393709 /nfs/dbraw/zinc/39/37/09/386393709.db2.gz ISVHNWNSWVDOAX-ZDUSSCGKSA-N 1 2 243.310 2.195 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@H]2Cc2ccccc2)no1 ZINC000336703929 386393712 /nfs/dbraw/zinc/39/37/12/386393712.db2.gz ISVHNWNSWVDOAX-ZDUSSCGKSA-N 1 2 243.310 2.195 20 0 BEADLO Cc1nc(C[NH2+][C@H](C)c2cccnc2)co1 ZINC000647970542 386394290 /nfs/dbraw/zinc/39/42/90/386394290.db2.gz WMXWOOZXFOEVCQ-SECBINFHSA-N 1 2 217.272 2.229 20 0 BEADLO Cc1ccoc1C[N@@H+](C)Cc1cnc(C)cn1 ZINC000336705948 386399447 /nfs/dbraw/zinc/39/94/47/386399447.db2.gz LIQNOMGWFUSTRU-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ccoc1C[N@H+](C)Cc1cnc(C)cn1 ZINC000336705948 386399451 /nfs/dbraw/zinc/39/94/51/386399451.db2.gz LIQNOMGWFUSTRU-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1nc(N(Cc2ccccn2)C2CC2)cc[nH+]1 ZINC000266142186 386402653 /nfs/dbraw/zinc/40/26/53/386402653.db2.gz HJOMPQBPBSADSK-UHFFFAOYSA-N 1 2 240.310 2.349 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2ccoc2)cn1 ZINC000336702829 386408012 /nfs/dbraw/zinc/40/80/12/386408012.db2.gz OCUZDSZHUDOZRH-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2ccoc2)cn1 ZINC000336702829 386408017 /nfs/dbraw/zinc/40/80/17/386408017.db2.gz OCUZDSZHUDOZRH-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1nocc1C[NH2+][C@H](C)c1ccncc1F ZINC000339397179 386408431 /nfs/dbraw/zinc/40/84/31/386408431.db2.gz QIJIGBGHZLFQGA-SECBINFHSA-N 1 2 235.262 2.368 20 0 BEADLO C[C@H](Nc1cc[nH+]c(C2CC2)n1)[C@H]1CCOC1 ZINC000266187931 386408988 /nfs/dbraw/zinc/40/89/88/386408988.db2.gz AZWKEXAIPPCJFE-ONGXEEELSA-N 1 2 233.315 2.191 20 0 BEADLO Cc1cnc(C[N@H+]2CC[C@H](OCC(C)C)C2)nc1 ZINC000336708604 386417351 /nfs/dbraw/zinc/41/73/51/386417351.db2.gz LGONCMYBSCFJAC-ZDUSSCGKSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1cnc(C[N@@H+]2CC[C@H](OCC(C)C)C2)nc1 ZINC000336708604 386417360 /nfs/dbraw/zinc/41/73/60/386417360.db2.gz LGONCMYBSCFJAC-ZDUSSCGKSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1ccc(N[C@@H](C)Cn2cccn2)c(C)[nH+]1 ZINC000347412102 386418601 /nfs/dbraw/zinc/41/86/01/386418601.db2.gz NHWGQTXHLOQECS-NSHDSACASA-N 1 2 230.315 2.396 20 0 BEADLO Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1Cc1cocn1 ZINC000290318791 386419333 /nfs/dbraw/zinc/41/93/33/386419333.db2.gz CTYPIWZOMUPFRI-GFCCVEGCSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1Cc1cocn1 ZINC000290318791 386419339 /nfs/dbraw/zinc/41/93/39/386419339.db2.gz CTYPIWZOMUPFRI-GFCCVEGCSA-N 1 2 246.314 2.352 20 0 BEADLO COC1(CC(=O)Nc2cc[nH+]c(C)c2)CCC1 ZINC000277268009 386421667 /nfs/dbraw/zinc/42/16/67/386421667.db2.gz OGFBOBVAMBIBAS-UHFFFAOYSA-N 1 2 234.299 2.288 20 0 BEADLO Fc1ccc(CN2CCc3[nH+]c[nH]c3C2)c(F)c1 ZINC000647933941 386425987 /nfs/dbraw/zinc/42/59/87/386425987.db2.gz PNXGTEVDALEQJN-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO Cc1cnc(C[N@@H+](C)[C@H](C)c2ccncc2)nc1 ZINC000336710236 386426195 /nfs/dbraw/zinc/42/61/95/386426195.db2.gz MSMILOJCGQTBOL-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cnc(C[N@H+](C)[C@H](C)c2ccncc2)nc1 ZINC000336710236 386426201 /nfs/dbraw/zinc/42/62/01/386426201.db2.gz MSMILOJCGQTBOL-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1c[nH]nc1C[N@@H+](C)Cc1ccccc1F ZINC000290364335 386426581 /nfs/dbraw/zinc/42/65/81/386426581.db2.gz HBZXJTJYKJXVIZ-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1c[nH]nc1C[N@H+](C)Cc1ccccc1F ZINC000290364335 386426585 /nfs/dbraw/zinc/42/65/85/386426585.db2.gz HBZXJTJYKJXVIZ-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1cn[nH]c1C[N@H+](C)Cc1cccs1 ZINC000290389587 386429024 /nfs/dbraw/zinc/42/90/24/386429024.db2.gz JIDPVKNOFAVVQF-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1cn[nH]c1C[N@@H+](C)Cc1cccs1 ZINC000290389587 386429027 /nfs/dbraw/zinc/42/90/27/386429027.db2.gz JIDPVKNOFAVVQF-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1c[nH]nc1C[N@H+](C)Cc1cccs1 ZINC000290389587 386429032 /nfs/dbraw/zinc/42/90/32/386429032.db2.gz JIDPVKNOFAVVQF-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1c[nH]nc1C[N@@H+](C)Cc1cccs1 ZINC000290389587 386429033 /nfs/dbraw/zinc/42/90/33/386429033.db2.gz JIDPVKNOFAVVQF-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1C[C@H](C)[C@@H](C)[C@H]1C ZINC000416963162 386429113 /nfs/dbraw/zinc/42/91/13/386429113.db2.gz VHMIAVDEIXFKJL-QJPTWQEYSA-N 1 2 247.342 2.320 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1C[C@H]1C1CC1 ZINC000340339398 386435115 /nfs/dbraw/zinc/43/51/15/386435115.db2.gz JIAAJBSDLQBZNL-NWDGAFQWSA-N 1 2 230.311 2.051 20 0 BEADLO COCc1nc(C[N@@H+]2C[C@H](C)[C@H]2C)cs1 ZINC000339574021 386471732 /nfs/dbraw/zinc/47/17/32/386471732.db2.gz OWDHOJXPDSVHOZ-DTWKUNHWSA-N 1 2 226.345 2.130 20 0 BEADLO COCc1nc(C[N@H+]2C[C@H](C)[C@H]2C)cs1 ZINC000339574021 386471733 /nfs/dbraw/zinc/47/17/33/386471733.db2.gz OWDHOJXPDSVHOZ-DTWKUNHWSA-N 1 2 226.345 2.130 20 0 BEADLO Cc1cc(N2C[C@@H](O)CC[C@H]2C)nc(C(C)C)[nH+]1 ZINC000399268016 386471983 /nfs/dbraw/zinc/47/19/83/386471983.db2.gz SMRFCNWIWROLCO-NEPJUHHUSA-N 1 2 249.358 2.258 20 0 BEADLO Cn1c[nH+]cc1Cn1cc(-c2ccccc2)cn1 ZINC000336734852 386473165 /nfs/dbraw/zinc/47/31/65/386473165.db2.gz WKOLPGLDOCHTSP-UHFFFAOYSA-N 1 2 238.294 2.332 20 0 BEADLO C[C@H](c1nc(C2CC2)no1)[N@@H+]1C[C@@H](C)[C@@H]1C ZINC000339573299 386473836 /nfs/dbraw/zinc/47/38/36/386473836.db2.gz AWQBQYAJEAXREU-HRDYMLBCSA-N 1 2 221.304 2.348 20 0 BEADLO C[C@H](c1nc(C2CC2)no1)[N@H+]1C[C@@H](C)[C@@H]1C ZINC000339573299 386473839 /nfs/dbraw/zinc/47/38/39/386473839.db2.gz AWQBQYAJEAXREU-HRDYMLBCSA-N 1 2 221.304 2.348 20 0 BEADLO CC[C@H](CCO)Nc1cc(C)[nH+]c(C(C)C)n1 ZINC000134964574 386476670 /nfs/dbraw/zinc/47/66/70/386476670.db2.gz MYUNYQYNZKDOLI-LLVKDONJSA-N 1 2 237.347 2.481 20 0 BEADLO Cc1nc(C[NH2+]Cc2ccnc(C)c2)cs1 ZINC000391220024 386483151 /nfs/dbraw/zinc/48/31/51/386483151.db2.gz YQPAHJLCUVNCOU-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO C[C@@H]1CN(c2cccc[nH+]2)CC2(CCC2)O1 ZINC000335430765 386485612 /nfs/dbraw/zinc/48/56/12/386485612.db2.gz UWFPQFHMJMPFED-LLVKDONJSA-N 1 2 218.300 2.229 20 0 BEADLO CC(C)(C)n1cc(C[NH2+][C@@H]2CCC[C@H]2F)nn1 ZINC000339583848 386489547 /nfs/dbraw/zinc/48/95/47/386489547.db2.gz JLRBZMHTNZCWSO-GHMZBOCLSA-N 1 2 240.326 2.013 20 0 BEADLO CC[C@@H]([NH2+]CC[C@H]1CCOC1)C(F)(F)F ZINC000336755677 386492040 /nfs/dbraw/zinc/49/20/40/386492040.db2.gz IBWAIGSHPQHBDA-DTWKUNHWSA-N 1 2 225.254 2.344 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C[C@H](C)CC(C)C ZINC000267067938 386492193 /nfs/dbraw/zinc/49/21/93/386492193.db2.gz AVQYORAICHRBPZ-SNVBAGLBSA-N 1 2 237.347 2.407 20 0 BEADLO C[C@@H](CO)[N@H+](C)Cc1ccnc(Cl)c1Cl ZINC000290997362 386496343 /nfs/dbraw/zinc/49/63/43/386496343.db2.gz AOALGYKSIVSBJZ-ZETCQYMHSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@@H](CO)[N@@H+](C)Cc1ccnc(Cl)c1Cl ZINC000290997362 386496347 /nfs/dbraw/zinc/49/63/47/386496347.db2.gz AOALGYKSIVSBJZ-ZETCQYMHSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@@H](C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1)C1CC1 ZINC000267128019 386497243 /nfs/dbraw/zinc/49/72/43/386497243.db2.gz LDYMQNACSAABJU-ZYHUDNBSSA-N 1 2 247.342 2.162 20 0 BEADLO C[C@H](C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1)C1CC1 ZINC000267128017 386498793 /nfs/dbraw/zinc/49/87/93/386498793.db2.gz LDYMQNACSAABJU-JQWIXIFHSA-N 1 2 247.342 2.162 20 0 BEADLO C[N@@H+](Cc1ncc(C2CC2)o1)C[C@@H]1CCCO1 ZINC000340660567 386506074 /nfs/dbraw/zinc/50/60/74/386506074.db2.gz RWUAYBVNIAVZEX-NSHDSACASA-N 1 2 236.315 2.163 20 0 BEADLO C[N@H+](Cc1ncc(C2CC2)o1)C[C@@H]1CCCO1 ZINC000340660567 386506082 /nfs/dbraw/zinc/50/60/82/386506082.db2.gz RWUAYBVNIAVZEX-NSHDSACASA-N 1 2 236.315 2.163 20 0 BEADLO Cc1cscc1C(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000267179558 386507124 /nfs/dbraw/zinc/50/71/24/386507124.db2.gz GYKZQSUXUYYBMG-JTQLQIEISA-N 1 2 249.339 2.072 20 0 BEADLO Cc1cscc1C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000267179560 386507644 /nfs/dbraw/zinc/50/76/44/386507644.db2.gz GYKZQSUXUYYBMG-SNVBAGLBSA-N 1 2 249.339 2.072 20 0 BEADLO c1csc(C[N@@H+]2CCOC[C@@H]2C2CCC2)n1 ZINC000335445247 386510145 /nfs/dbraw/zinc/51/01/45/386510145.db2.gz BBXBQPJAZMZUBF-LLVKDONJSA-N 1 2 238.356 2.144 20 0 BEADLO c1csc(C[N@H+]2CCOC[C@@H]2C2CCC2)n1 ZINC000335445247 386510148 /nfs/dbraw/zinc/51/01/48/386510148.db2.gz BBXBQPJAZMZUBF-LLVKDONJSA-N 1 2 238.356 2.144 20 0 BEADLO COc1cc(C[N@@H+]2CCOC[C@@H]2C)ccc1C ZINC000278307233 386511525 /nfs/dbraw/zinc/51/15/25/386511525.db2.gz WKFBBLLCSJWLCL-LBPRGKRZSA-N 1 2 235.327 2.224 20 0 BEADLO COc1cc(C[N@H+]2CCOC[C@@H]2C)ccc1C ZINC000278307233 386511532 /nfs/dbraw/zinc/51/15/32/386511532.db2.gz WKFBBLLCSJWLCL-LBPRGKRZSA-N 1 2 235.327 2.224 20 0 BEADLO CCN(C)C(=O)[C@H]1CCc2[nH+]c(C(C)C)[nH]c2C1 ZINC000335447062 386514087 /nfs/dbraw/zinc/51/40/87/386514087.db2.gz FPRUMMBPVIHSFY-JTQLQIEISA-N 1 2 249.358 2.116 20 0 BEADLO CCN(C)C(=O)[C@H]1CCc2[nH]c(C(C)C)[nH+]c2C1 ZINC000335447062 386514091 /nfs/dbraw/zinc/51/40/91/386514091.db2.gz FPRUMMBPVIHSFY-JTQLQIEISA-N 1 2 249.358 2.116 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@H](CC3CC3)C2)no1 ZINC000339678910 386514251 /nfs/dbraw/zinc/51/42/51/386514251.db2.gz OPIHGLFUACKQIM-LLVKDONJSA-N 1 2 221.304 2.000 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@H](CC3CC3)C2)no1 ZINC000339678910 386514258 /nfs/dbraw/zinc/51/42/58/386514258.db2.gz OPIHGLFUACKQIM-LLVKDONJSA-N 1 2 221.304 2.000 20 0 BEADLO Cc1nc(N2CC(C)(C)[C@H]2[C@@H]2CCCO2)cc[nH+]1 ZINC000291141934 386515506 /nfs/dbraw/zinc/51/55/06/386515506.db2.gz OANZEDYVNUMNDI-WCQYABFASA-N 1 2 247.342 2.179 20 0 BEADLO Cc1cscc1C(=O)N(C)Cc1[nH+]ccn1C ZINC000267275348 386521759 /nfs/dbraw/zinc/52/17/59/386521759.db2.gz TZLHPCWZSIDHIU-UHFFFAOYSA-N 1 2 249.339 2.062 20 0 BEADLO FC(F)(F)C[C@@H]1CC[N@H+](Cc2cocn2)C1 ZINC000278413352 386522735 /nfs/dbraw/zinc/52/27/35/386522735.db2.gz QJJNKEBPVFFDMA-QMMMGPOBSA-N 1 2 234.221 2.449 20 0 BEADLO FC(F)(F)C[C@@H]1CC[N@@H+](Cc2cocn2)C1 ZINC000278413352 386522741 /nfs/dbraw/zinc/52/27/41/386522741.db2.gz QJJNKEBPVFFDMA-QMMMGPOBSA-N 1 2 234.221 2.449 20 0 BEADLO CC(C)=CC[N@@H+](C)[C@H](C)c1nc(C)no1 ZINC000519648773 386525511 /nfs/dbraw/zinc/52/55/11/386525511.db2.gz ORHSNRNFWAFUHN-SECBINFHSA-N 1 2 209.293 2.337 20 0 BEADLO CC(C)=CC[N@H+](C)[C@H](C)c1nc(C)no1 ZINC000519648773 386525515 /nfs/dbraw/zinc/52/55/15/386525515.db2.gz ORHSNRNFWAFUHN-SECBINFHSA-N 1 2 209.293 2.337 20 0 BEADLO C[N@H+](Cc1ccon1)[C@@H](CCO)c1ccccc1 ZINC000266586798 386453640 /nfs/dbraw/zinc/45/36/40/386453640.db2.gz KJZJXTMHVUFQAC-AWEZNQCLSA-N 1 2 246.310 2.230 20 0 BEADLO C[N@@H+](Cc1ccon1)[C@@H](CCO)c1ccccc1 ZINC000266586798 386453646 /nfs/dbraw/zinc/45/36/46/386453646.db2.gz KJZJXTMHVUFQAC-AWEZNQCLSA-N 1 2 246.310 2.230 20 0 BEADLO Cc1cc(CN(C)Cc2[nH+]ccn2C(C)C)no1 ZINC000299543380 386465059 /nfs/dbraw/zinc/46/50/59/386465059.db2.gz ATYXWKJFKMTYAC-UHFFFAOYSA-N 1 2 248.330 2.392 20 0 BEADLO C[C@H]1COCC[N@@H+]1CCc1cccc(F)c1F ZINC000335412207 386575419 /nfs/dbraw/zinc/57/54/19/386575419.db2.gz IDLOVVKHWUVDGM-JTQLQIEISA-N 1 2 241.281 2.228 20 0 BEADLO C[C@H]1COCC[N@H+]1CCc1cccc(F)c1F ZINC000335412207 386575420 /nfs/dbraw/zinc/57/54/20/386575420.db2.gz IDLOVVKHWUVDGM-JTQLQIEISA-N 1 2 241.281 2.228 20 0 BEADLO CC(C(=O)N1CCn2c[nH+]cc2C1)=C1CCCC1 ZINC000291815831 386587594 /nfs/dbraw/zinc/58/75/94/386587594.db2.gz DKVJPJWNVDSCCM-UHFFFAOYSA-N 1 2 245.326 2.116 20 0 BEADLO CC(C)n1ccnc1SCc1c[nH+]cn1C ZINC000267799177 386587942 /nfs/dbraw/zinc/58/79/42/386587942.db2.gz PMJOWVOCXHLOQK-UHFFFAOYSA-N 1 2 236.344 2.490 20 0 BEADLO CC1(C(=O)N2CCC(c3[nH]cc[nH+]3)CC2)CCC1 ZINC000267338931 386530835 /nfs/dbraw/zinc/53/08/35/386530835.db2.gz JHPZCHVAXXRWQG-UHFFFAOYSA-N 1 2 247.342 2.306 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1cc(Cl)cs1 ZINC000278493210 386532747 /nfs/dbraw/zinc/53/27/47/386532747.db2.gz UKXKVFGFLMFMFM-UHFFFAOYSA-N 1 2 247.747 2.396 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1cc(Cl)cs1 ZINC000278493210 386532754 /nfs/dbraw/zinc/53/27/54/386532754.db2.gz UKXKVFGFLMFMFM-UHFFFAOYSA-N 1 2 247.747 2.396 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@@H](C(C)(C)C)C2)nn1 ZINC000414451164 386538388 /nfs/dbraw/zinc/53/83/88/386538388.db2.gz ZTGBCUDLQIVEPV-CYBMUJFWSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@@H](C(C)(C)C)C2)nn1 ZINC000414451164 386538393 /nfs/dbraw/zinc/53/83/93/386538393.db2.gz ZTGBCUDLQIVEPV-CYBMUJFWSA-N 1 2 249.358 2.032 20 0 BEADLO CCc1ccccc1NC(=O)Cc1[nH]c[nH+]c1C ZINC000278530139 386541529 /nfs/dbraw/zinc/54/15/29/386541529.db2.gz DTMGFSCPFJCECV-UHFFFAOYSA-N 1 2 243.310 2.462 20 0 BEADLO C[C@H]1C[N@H+](Cc2cscn2)CC2(CCC2)O1 ZINC000335462091 386546539 /nfs/dbraw/zinc/54/65/39/386546539.db2.gz KRZDJZPNFVVQPE-JTQLQIEISA-N 1 2 238.356 2.287 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cscn2)CC2(CCC2)O1 ZINC000335462091 386546545 /nfs/dbraw/zinc/54/65/45/386546545.db2.gz KRZDJZPNFVVQPE-JTQLQIEISA-N 1 2 238.356 2.287 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)[C@@H](C)c1ccco1 ZINC000278563202 386547897 /nfs/dbraw/zinc/54/78/97/386547897.db2.gz IATBCINWBVHJQX-JTQLQIEISA-N 1 2 247.298 2.073 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCC[C@H]1c1cc[nH]n1 ZINC000278564124 386549645 /nfs/dbraw/zinc/54/96/45/386549645.db2.gz IPFNPPGLXYUOST-ZDUSSCGKSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCC[C@H]1c1cc[nH]n1 ZINC000278564124 386549650 /nfs/dbraw/zinc/54/96/50/386549650.db2.gz IPFNPPGLXYUOST-ZDUSSCGKSA-N 1 2 246.314 2.352 20 0 BEADLO C/C=C(\C)C(=O)NCc1cn2cc(C)ccc2[nH+]1 ZINC000267546181 386550816 /nfs/dbraw/zinc/55/08/16/386550816.db2.gz CAQKYLNHWLSEPM-NYYWCZLTSA-N 1 2 243.310 2.225 20 0 BEADLO COc1cccnc1C[NH2+]Cc1ccoc1C ZINC000414454197 386551529 /nfs/dbraw/zinc/55/15/29/386551529.db2.gz DDYBWKAPPWKVJG-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@H](C)CCC(C)C ZINC000278588244 386552238 /nfs/dbraw/zinc/55/22/38/386552238.db2.gz KGRKWQRTXFSKOO-JTQLQIEISA-N 1 2 237.347 2.202 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@@H](C)CCC(C)C ZINC000278588244 386552245 /nfs/dbraw/zinc/55/22/45/386552245.db2.gz KGRKWQRTXFSKOO-JTQLQIEISA-N 1 2 237.347 2.202 20 0 BEADLO Cc1c[nH]nc1C[N@H+](Cc1cccnc1)C1CC1 ZINC000291532401 386556443 /nfs/dbraw/zinc/55/64/43/386556443.db2.gz KJINKGZDZAKGES-UHFFFAOYSA-N 1 2 242.326 2.278 20 0 BEADLO Cc1c[nH]nc1C[N@@H+](Cc1cccnc1)C1CC1 ZINC000291532401 386556449 /nfs/dbraw/zinc/55/64/49/386556449.db2.gz KJINKGZDZAKGES-UHFFFAOYSA-N 1 2 242.326 2.278 20 0 BEADLO O=C(Cn1cc[nH+]c1)N1CCC2(C1)CCCCC2 ZINC000074031079 386564406 /nfs/dbraw/zinc/56/44/06/386564406.db2.gz XQDFAQIICLKPTB-UHFFFAOYSA-N 1 2 247.342 2.066 20 0 BEADLO CCC1(C(=O)NCc2[nH+]ccn2C)CCCC1 ZINC000268142745 386624395 /nfs/dbraw/zinc/62/43/95/386624395.db2.gz NPNPKXMZXPOIJO-UHFFFAOYSA-N 1 2 235.331 2.007 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1CCC[C@H](F)C1 ZINC000335499117 386625192 /nfs/dbraw/zinc/62/51/92/386625192.db2.gz AYBGTDYRNKSGKJ-MNOVXSKESA-N 1 2 236.290 2.279 20 0 BEADLO c1csc(N2CC[NH+](Cc3ccno3)CC2)c1 ZINC000268151108 386626417 /nfs/dbraw/zinc/62/64/17/386626417.db2.gz HFUNCAQIHDZTMV-UHFFFAOYSA-N 1 2 249.339 2.058 20 0 BEADLO CN(CCC1CCOCC1)c1cccc[nH+]1 ZINC000268187727 386628915 /nfs/dbraw/zinc/62/89/15/386628915.db2.gz UYRRYQGXTMZAQL-UHFFFAOYSA-N 1 2 220.316 2.335 20 0 BEADLO Cn1cc(Cl)c(C[N@H+](C)[C@@H]2CC2(C)C)n1 ZINC000335502191 386630833 /nfs/dbraw/zinc/63/08/33/386630833.db2.gz IQQHRSJSGLXADY-SNVBAGLBSA-N 1 2 227.739 2.304 20 0 BEADLO Cn1cc(Cl)c(C[N@@H+](C)[C@@H]2CC2(C)C)n1 ZINC000335502191 386630836 /nfs/dbraw/zinc/63/08/36/386630836.db2.gz IQQHRSJSGLXADY-SNVBAGLBSA-N 1 2 227.739 2.304 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1nn(C)cc1Cl ZINC000335503526 386631638 /nfs/dbraw/zinc/63/16/38/386631638.db2.gz NKRNIVAKQFRBFG-OCAPTIKFSA-N 1 2 213.712 2.056 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1nn(C)cc1Cl ZINC000335503526 386631641 /nfs/dbraw/zinc/63/16/41/386631641.db2.gz NKRNIVAKQFRBFG-OCAPTIKFSA-N 1 2 213.712 2.056 20 0 BEADLO CC[C@@H](C)C[C@H](CO)Nc1cccc[nH+]1 ZINC000645354665 386633117 /nfs/dbraw/zinc/63/31/17/386633117.db2.gz AVAXGFPUGMJFAI-GHMZBOCLSA-N 1 2 208.305 2.291 20 0 BEADLO Cc1nnc(C[N@H+](Cc2cccs2)C2CC2)[nH]1 ZINC000292210683 386633531 /nfs/dbraw/zinc/63/35/31/386633531.db2.gz PTQSATRUBAIRKE-UHFFFAOYSA-N 1 2 248.355 2.339 20 0 BEADLO Cc1nnc(C[N@@H+](Cc2cccs2)C2CC2)[nH]1 ZINC000292210683 386633537 /nfs/dbraw/zinc/63/35/37/386633537.db2.gz PTQSATRUBAIRKE-UHFFFAOYSA-N 1 2 248.355 2.339 20 0 BEADLO Cc1nnc(C[N@H+](Cc2ccccc2)C2CC2)[nH]1 ZINC000292217057 386635993 /nfs/dbraw/zinc/63/59/93/386635993.db2.gz QGYQVXRLCWYIOH-UHFFFAOYSA-N 1 2 242.326 2.278 20 0 BEADLO Cc1nnc(C[N@@H+](Cc2ccccc2)C2CC2)[nH]1 ZINC000292217057 386635999 /nfs/dbraw/zinc/63/59/99/386635999.db2.gz QGYQVXRLCWYIOH-UHFFFAOYSA-N 1 2 242.326 2.278 20 0 BEADLO COC[C@H](CC(C)C)[NH2+]C1(C(F)F)CC1 ZINC000336758387 386636117 /nfs/dbraw/zinc/63/61/17/386636117.db2.gz JSUIOOWWHGYZLQ-VIFPVBQESA-N 1 2 221.291 2.435 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NCC1CCC(C)CC1 ZINC000279132568 386637702 /nfs/dbraw/zinc/63/77/02/386637702.db2.gz CAUXJKKWJMXJSK-UHFFFAOYSA-N 1 2 249.358 2.203 20 0 BEADLO CCc1cc(N[C@H](CO)C[C@@H](C)CC)nc[nH+]1 ZINC000645355001 386641461 /nfs/dbraw/zinc/64/14/61/386641461.db2.gz FOOYZLPSTZDCHJ-JQWIXIFHSA-N 1 2 237.347 2.248 20 0 BEADLO Cc1[nH+]cccc1Cc1noc([C@@]2(C)C[C@H]2F)n1 ZINC000335509696 386642607 /nfs/dbraw/zinc/64/26/07/386642607.db2.gz GSQFLKDPOXZSNF-MFKMUULPSA-N 1 2 247.273 2.363 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@H]1CCC[C@@H](C)[C@@H]1C ZINC000279195595 386645821 /nfs/dbraw/zinc/64/58/21/386645821.db2.gz KEXPZUPKNHHOPX-JFGNBEQYSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@@H]1CCC[C@@H](C)[C@@H]1C ZINC000279195595 386645826 /nfs/dbraw/zinc/64/58/26/386645826.db2.gz KEXPZUPKNHHOPX-JFGNBEQYSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CC[C@@H]2CCCC[C@@H]21 ZINC000335513346 386649724 /nfs/dbraw/zinc/64/97/24/386649724.db2.gz MDSJNIPUKBVSEP-AAEUAGOBSA-N 1 2 247.342 2.052 20 0 BEADLO CCn1cncc1C[N@H+](C)CCC(F)(F)F ZINC000417749732 386652032 /nfs/dbraw/zinc/65/20/32/386652032.db2.gz FWZBECLXLKQVGY-UHFFFAOYSA-N 1 2 235.253 2.287 20 0 BEADLO CCn1cncc1C[N@@H+](C)CCC(F)(F)F ZINC000417749732 386652036 /nfs/dbraw/zinc/65/20/36/386652036.db2.gz FWZBECLXLKQVGY-UHFFFAOYSA-N 1 2 235.253 2.287 20 0 BEADLO CCn1c[nH+]cc1CN(C)CCC(F)(F)F ZINC000417749732 386652043 /nfs/dbraw/zinc/65/20/43/386652043.db2.gz FWZBECLXLKQVGY-UHFFFAOYSA-N 1 2 235.253 2.287 20 0 BEADLO CCCCN(c1[nH+]cnc2c1cnn2C)C1CC1 ZINC000268559145 386660518 /nfs/dbraw/zinc/66/05/18/386660518.db2.gz DWVJKIOGBZICCW-UHFFFAOYSA-N 1 2 245.330 2.132 20 0 BEADLO C[C@H](NC(=O)CCc1[nH]cc[nH+]1)c1ccccc1 ZINC000279300613 386660950 /nfs/dbraw/zinc/66/09/50/386660950.db2.gz ZSLBPUFZTNJTJN-NSHDSACASA-N 1 2 243.310 2.220 20 0 BEADLO CCCc1[nH+]ccn1Cc1nnc(C(C)(C)C)[nH]1 ZINC000292396998 386661659 /nfs/dbraw/zinc/66/16/59/386661659.db2.gz IQWGEGQAQQLJQP-UHFFFAOYSA-N 1 2 247.346 2.300 20 0 BEADLO CC[C@@H]([NH2+]CCc1cc(C)cc(C)c1)C(=O)OC ZINC000192851403 386682247 /nfs/dbraw/zinc/68/22/47/386682247.db2.gz AGWGXMMRFPPUQN-CQSZACIVSA-N 1 2 249.354 2.387 20 0 BEADLO CCCCNc1cc(C)[nH+]c(C2CC2)n1 ZINC000336759632 386668975 /nfs/dbraw/zinc/66/89/75/386668975.db2.gz KXCSBJINFRPDIR-UHFFFAOYSA-N 1 2 205.305 2.296 20 0 BEADLO CC(C)n1ccc(COc2cc[nH+]cc2)n1 ZINC000292442159 386669861 /nfs/dbraw/zinc/66/98/61/386669861.db2.gz MOPOPNVAIQKQIL-UHFFFAOYSA-N 1 2 217.272 2.438 20 0 BEADLO COC(=O)[C@H](CC(C)C)[N@H+](C)C/C=C/Cl ZINC000292440914 386671206 /nfs/dbraw/zinc/67/12/06/386671206.db2.gz OKADDBZMEHSZHN-PORFMDCZSA-N 1 2 233.739 2.258 20 0 BEADLO COC(=O)[C@H](CC(C)C)[N@@H+](C)C/C=C/Cl ZINC000292440914 386671213 /nfs/dbraw/zinc/67/12/13/386671213.db2.gz OKADDBZMEHSZHN-PORFMDCZSA-N 1 2 233.739 2.258 20 0 BEADLO CCn1cncc1C[NH+]1CC(C)(CC(F)F)C1 ZINC000648059069 386676000 /nfs/dbraw/zinc/67/60/00/386676000.db2.gz TZGHXZXPNBUFLO-UHFFFAOYSA-N 1 2 243.301 2.380 20 0 BEADLO C[C@H](Nc1cccc[nH+]1)[C@H](O)Cc1ccccc1 ZINC000120645269 386676067 /nfs/dbraw/zinc/67/60/67/386676067.db2.gz GPPLTSRQQCLKMN-GXTWGEPZSA-N 1 2 242.322 2.486 20 0 BEADLO CCn1c[nH+]cc1CN1CC(C)(CC(F)F)C1 ZINC000648059069 386676004 /nfs/dbraw/zinc/67/60/04/386676004.db2.gz TZGHXZXPNBUFLO-UHFFFAOYSA-N 1 2 243.301 2.380 20 0 BEADLO CC[C@@H]([NH2+]C/C=C/c1ccccc1)C(=O)OC ZINC000192848806 386676506 /nfs/dbraw/zinc/67/65/06/386676506.db2.gz WNODKHWMYPYSNS-UTSBKAFOSA-N 1 2 233.311 2.241 20 0 BEADLO CC[C@H](F)C[NH2+][C@@H](C)c1ncc(C)o1 ZINC000336648116 386679742 /nfs/dbraw/zinc/67/97/42/386679742.db2.gz GGTJCSJHNLIUOW-IUCAKERBSA-N 1 2 200.257 2.382 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1CCO[C@@H]1C ZINC000335531140 386679935 /nfs/dbraw/zinc/67/99/35/386679935.db2.gz WDLGSQLXNZBXNW-MNOVXSKESA-N 1 2 234.299 2.062 20 0 BEADLO COC[C@H](C)CC(=O)Nc1c(C)cc[nH+]c1C ZINC000425591463 386681635 /nfs/dbraw/zinc/68/16/35/386681635.db2.gz ZNTIULNXAWLPDM-SECBINFHSA-N 1 2 236.315 2.310 20 0 BEADLO Cc1nc(C[NH+]2CCC(C)(C)CC2)no1 ZINC000335521186 386658717 /nfs/dbraw/zinc/65/87/17/386658717.db2.gz FOGJVMJEPLFTNR-UHFFFAOYSA-N 1 2 209.293 2.000 20 0 BEADLO C[C@@H]1[C@H](O)CCC[N@@H+]1Cc1csc(Cl)n1 ZINC000296061721 386710255 /nfs/dbraw/zinc/71/02/55/386710255.db2.gz GEHPNYQHXNYFMI-VXNVDRBHSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H]1[C@H](O)CCC[N@H+]1Cc1csc(Cl)n1 ZINC000296061721 386710266 /nfs/dbraw/zinc/71/02/66/386710266.db2.gz GEHPNYQHXNYFMI-VXNVDRBHSA-N 1 2 246.763 2.142 20 0 BEADLO CC(C)c1[nH+]ccn1Cc1nnc(C(C)(C)C)[nH]1 ZINC000292539893 386688171 /nfs/dbraw/zinc/68/81/71/386688171.db2.gz WIAPRBHQPLFNFI-UHFFFAOYSA-N 1 2 247.346 2.470 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)NCCCCn1cc[nH+]c1 ZINC000520514095 386692476 /nfs/dbraw/zinc/69/24/76/386692476.db2.gz JOXYCUNWRVTHOJ-CHWSQXEVSA-N 1 2 249.358 2.216 20 0 BEADLO CC[C@@H]([NH2+][C@H]1CC12CCCCC2)C(=O)OC ZINC000192862256 386694085 /nfs/dbraw/zinc/69/40/85/386694085.db2.gz VSHHZPFGRQJBSX-MNOVXSKESA-N 1 2 225.332 2.250 20 0 BEADLO CCn1ccc(C[NH2+]Cc2ccoc2C)n1 ZINC000414483285 386694937 /nfs/dbraw/zinc/69/49/37/386694937.db2.gz OCTZLYZQECREQT-UHFFFAOYSA-N 1 2 219.288 2.094 20 0 BEADLO CCC1CCN(C(=O)CCc2c[nH+]cn2C)CC1 ZINC000279551302 386698708 /nfs/dbraw/zinc/69/87/08/386698708.db2.gz AOWGHSZNEUFNOL-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO CC[C@@H]1C[C@H](C)CN1C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000520606847 386704682 /nfs/dbraw/zinc/70/46/82/386704682.db2.gz WDSNXNSKTIXXMF-DMDPSCGWSA-N 1 2 249.358 2.235 20 0 BEADLO CC[C@@H]1C[C@H](C)CN1C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000520606847 386704687 /nfs/dbraw/zinc/70/46/87/386704687.db2.gz WDSNXNSKTIXXMF-DMDPSCGWSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H]1[C@@H](O)CCC[N@@H+]1Cc1cnc(Cl)s1 ZINC000296386945 386712288 /nfs/dbraw/zinc/71/22/88/386712288.db2.gz UBMTYXVAOYPLOE-CBAPKCEASA-N 1 2 246.763 2.142 20 0 BEADLO C[C@H]1[C@@H](O)CCC[N@H+]1Cc1cnc(Cl)s1 ZINC000296386945 386712296 /nfs/dbraw/zinc/71/22/96/386712296.db2.gz UBMTYXVAOYPLOE-CBAPKCEASA-N 1 2 246.763 2.142 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@@H]2C[C@@H]2c2ccccc2)no1 ZINC000268978623 386730826 /nfs/dbraw/zinc/73/08/26/386730826.db2.gz QAEFURQJQKTFLM-CHWSQXEVSA-N 1 2 243.310 2.366 20 0 BEADLO Cc1nc(C[N@H+](C)[C@@H]2C[C@@H]2c2ccccc2)no1 ZINC000268978623 386730831 /nfs/dbraw/zinc/73/08/31/386730831.db2.gz QAEFURQJQKTFLM-CHWSQXEVSA-N 1 2 243.310 2.366 20 0 BEADLO C[NH2+]Cc1noc([C@H](SC)c2ccccc2)n1 ZINC000414494646 386735680 /nfs/dbraw/zinc/73/56/80/386735680.db2.gz ADXJTSQMSKZJPB-LLVKDONJSA-N 1 2 249.339 2.241 20 0 BEADLO C[N@H+](CCCF)Cc1cnn(-c2ccccc2)n1 ZINC000268888486 386713831 /nfs/dbraw/zinc/71/38/31/386713831.db2.gz JITZFLXJZSTDAY-UHFFFAOYSA-N 1 2 248.305 2.059 20 0 BEADLO C[N@@H+](CCCF)Cc1cnn(-c2ccccc2)n1 ZINC000268888486 386713839 /nfs/dbraw/zinc/71/38/39/386713839.db2.gz JITZFLXJZSTDAY-UHFFFAOYSA-N 1 2 248.305 2.059 20 0 BEADLO Cc1[nH+]c(C(C)C)ccc1Cn1ncsc1=O ZINC000292742132 386716270 /nfs/dbraw/zinc/71/62/70/386716270.db2.gz UVPOEFYXZNHXFE-UHFFFAOYSA-N 1 2 249.339 2.180 20 0 BEADLO CCc1ccc([C@@H](C)[NH2+][C@@H](C)c2nncn2C)o1 ZINC000268930058 386719220 /nfs/dbraw/zinc/71/92/20/386719220.db2.gz SLDRCJUKAKNPAR-ZJUUUORDSA-N 1 2 248.330 2.382 20 0 BEADLO CCc1ccc([C@H](C)[NH2+][C@H](C)c2nncn2C)o1 ZINC000268930055 386720070 /nfs/dbraw/zinc/72/00/70/386720070.db2.gz SLDRCJUKAKNPAR-VHSXEESVSA-N 1 2 248.330 2.382 20 0 BEADLO COc1cc(C[NH2+][C@@H](C)c2cc(C)on2)ccn1 ZINC000279690867 386721282 /nfs/dbraw/zinc/72/12/82/386721282.db2.gz UKIXHZHLUKDGEC-JTQLQIEISA-N 1 2 247.298 2.237 20 0 BEADLO CC1CC[NH+](Cc2nn(C)cc2Cl)CC1 ZINC000335541754 386722809 /nfs/dbraw/zinc/72/28/09/386722809.db2.gz CGSHTKMVJZSART-UHFFFAOYSA-N 1 2 227.739 2.305 20 0 BEADLO C[C@H](c1ccncc1)[N@H+](C)Cc1cocn1 ZINC000191975836 386726224 /nfs/dbraw/zinc/72/62/24/386726224.db2.gz UEQHXZKGEFGMPX-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1cocn1 ZINC000191975836 386726226 /nfs/dbraw/zinc/72/62/26/386726226.db2.gz UEQHXZKGEFGMPX-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO CC(C)n1ccnc1C[N@@H+]1CCC[C@@H]1CF ZINC000293037608 386769333 /nfs/dbraw/zinc/76/93/33/386769333.db2.gz LTXLZHCCDRGLSL-LLVKDONJSA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1ccnc1C[N@H+]1CCC[C@@H]1CF ZINC000293037608 386769338 /nfs/dbraw/zinc/76/93/38/386769338.db2.gz LTXLZHCCDRGLSL-LLVKDONJSA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CCC[C@@H]1CF ZINC000293037608 386769341 /nfs/dbraw/zinc/76/93/41/386769341.db2.gz LTXLZHCCDRGLSL-LLVKDONJSA-N 1 2 225.311 2.398 20 0 BEADLO CCC[C@H](C(=O)NCc1c[nH+]c[nH]1)C(C)C ZINC000330519422 386747726 /nfs/dbraw/zinc/74/77/26/386747726.db2.gz GWKVWGGCSMTKOK-NSHDSACASA-N 1 2 223.320 2.098 20 0 BEADLO CCC[C@H](C(=O)NCc1c[nH]c[nH+]1)C(C)C ZINC000330519422 386747730 /nfs/dbraw/zinc/74/77/30/386747730.db2.gz GWKVWGGCSMTKOK-NSHDSACASA-N 1 2 223.320 2.098 20 0 BEADLO COC1(C[N@@H+]2CCC(F)(F)C2)CCCC1 ZINC000335539825 386748387 /nfs/dbraw/zinc/74/83/87/386748387.db2.gz NGKAUXPIZBAAOW-UHFFFAOYSA-N 1 2 219.275 2.287 20 0 BEADLO COC1(C[N@H+]2CCC(F)(F)C2)CCCC1 ZINC000335539825 386748394 /nfs/dbraw/zinc/74/83/94/386748394.db2.gz NGKAUXPIZBAAOW-UHFFFAOYSA-N 1 2 219.275 2.287 20 0 BEADLO Cc1ccc(Cc2nc([C@H]3C[C@H]3C)no2)c[nH+]1 ZINC000334153005 386751454 /nfs/dbraw/zinc/75/14/54/386751454.db2.gz NEIQMCUEZAWGAF-KCJUWKMLSA-N 1 2 229.283 2.487 20 0 BEADLO C[C@@H]1CCCCCN1C(=O)CCc1c[nH+]cn1C ZINC000334153991 386752477 /nfs/dbraw/zinc/75/24/77/386752477.db2.gz QBPDOQIZFCDGCE-GFCCVEGCSA-N 1 2 249.358 2.144 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H](C)CCc1ccc(C)cc1 ZINC000279999220 386767126 /nfs/dbraw/zinc/76/71/26/386767126.db2.gz RSVGOMYAHFLMFY-STQMWFEESA-N 1 2 249.354 2.467 20 0 BEADLO Cc1nnc(C[N@@H+](C)[C@H](C)c2cccc(O)c2)[nH]1 ZINC000293023913 386767631 /nfs/dbraw/zinc/76/76/31/386767631.db2.gz CQLXSZVBTZHESO-SECBINFHSA-N 1 2 246.314 2.012 20 0 BEADLO CCCC1(CNC(=O)CCc2c[nH+]cn2C)CC1 ZINC000280001352 386767498 /nfs/dbraw/zinc/76/74/98/386767498.db2.gz SBGLKXYCCXHTJW-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO Cc1nnc(C[N@H+](C)[C@H](C)c2cccc(O)c2)[nH]1 ZINC000293023913 386767637 /nfs/dbraw/zinc/76/76/37/386767637.db2.gz CQLXSZVBTZHESO-SECBINFHSA-N 1 2 246.314 2.012 20 0 BEADLO Cn1ccc(C[N@@H+]2CC[C@H]2c2ccccc2)n1 ZINC000334145230 386743939 /nfs/dbraw/zinc/74/39/39/386743939.db2.gz KRULFGAKMYNQEH-AWEZNQCLSA-N 1 2 227.311 2.367 20 0 BEADLO Cn1ccc(C[N@H+]2CC[C@H]2c2ccccc2)n1 ZINC000334145230 386743945 /nfs/dbraw/zinc/74/39/45/386743945.db2.gz KRULFGAKMYNQEH-AWEZNQCLSA-N 1 2 227.311 2.367 20 0 BEADLO CCC[C@@](C)(CC)C(=O)NCCn1cc[nH+]c1 ZINC000280252729 386795142 /nfs/dbraw/zinc/79/51/42/386795142.db2.gz KTKIPTTZMPKODB-CYBMUJFWSA-N 1 2 237.347 2.216 20 0 BEADLO CC[C@H]1C[C@@H](C[NH2+]CC(F)(F)F)CCO1 ZINC000336744069 386796008 /nfs/dbraw/zinc/79/60/08/386796008.db2.gz YVTXFYKADOTOJM-IUCAKERBSA-N 1 2 225.254 2.344 20 0 BEADLO CCC1CCC(NCC(F)(F)C[NH3+])CC1 ZINC000414932292 386770839 /nfs/dbraw/zinc/77/08/39/386770839.db2.gz RQXWOHFDOBPLSQ-UHFFFAOYSA-N 1 2 220.307 2.139 20 0 BEADLO FC(F)(F)[C@@H]([NH2+]CC[C@@H]1CCOC1)C1CC1 ZINC000336668792 386796300 /nfs/dbraw/zinc/79/63/00/386796300.db2.gz GJMZTLCTAGEIFP-SCZZXKLOSA-N 1 2 237.265 2.344 20 0 BEADLO Fc1ccc(C[NH2+]Cc2cocn2)cc1F ZINC000336667151 386779854 /nfs/dbraw/zinc/77/98/54/386779854.db2.gz FOCXZENISCNPJV-UHFFFAOYSA-N 1 2 224.210 2.243 20 0 BEADLO COC(=O)c1occc1C[N@@H+]1CCC[C@H]1CF ZINC000293157531 386782778 /nfs/dbraw/zinc/78/27/78/386782778.db2.gz UOPZKRKNJFMWKL-JTQLQIEISA-N 1 2 241.262 2.000 20 0 BEADLO COC(=O)c1occc1C[N@H+]1CCC[C@H]1CF ZINC000293157531 386782783 /nfs/dbraw/zinc/78/27/83/386782783.db2.gz UOPZKRKNJFMWKL-JTQLQIEISA-N 1 2 241.262 2.000 20 0 BEADLO Cc1ccc(C(=O)Nc2cccc3[nH+]ccn32)o1 ZINC000357447259 386784221 /nfs/dbraw/zinc/78/42/21/386784221.db2.gz CMEAEGHIJHPCSB-UHFFFAOYSA-N 1 2 241.250 2.488 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1csc(C2CC2)n1 ZINC000293427822 386817148 /nfs/dbraw/zinc/81/71/48/386817148.db2.gz AXVVUVLPIBXXOY-NSHDSACASA-N 1 2 238.356 2.241 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1csc(C2CC2)n1 ZINC000293427822 386817152 /nfs/dbraw/zinc/81/71/52/386817152.db2.gz AXVVUVLPIBXXOY-NSHDSACASA-N 1 2 238.356 2.241 20 0 BEADLO Cc1cnc(C[NH2+]C(C)(C)c2nccs2)cn1 ZINC000330666389 386817244 /nfs/dbraw/zinc/81/72/44/386817244.db2.gz ICIQPMUZLBIEFM-UHFFFAOYSA-N 1 2 248.355 2.266 20 0 BEADLO CC[C@H]1CCCC[C@H]1NC(=O)CCc1c[nH+]c[nH]1 ZINC000280461366 386817373 /nfs/dbraw/zinc/81/73/73/386817373.db2.gz ZUSVYDWXUJWGJT-WCQYABFASA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@H]1CCCC[C@H]1NC(=O)CCc1c[nH]c[nH+]1 ZINC000280461366 386817377 /nfs/dbraw/zinc/81/73/77/386817377.db2.gz ZUSVYDWXUJWGJT-WCQYABFASA-N 1 2 249.358 2.427 20 0 BEADLO c1c2ccccc2[nH]c1C[N@@H+]1CCO[C@H]2C[C@H]21 ZINC000366545145 386821730 /nfs/dbraw/zinc/82/17/30/386821730.db2.gz OFFOIBVDVZONSQ-KGLIPLIRSA-N 1 2 228.295 2.141 20 0 BEADLO c1c2ccccc2[nH]c1C[N@H+]1CCO[C@H]2C[C@H]21 ZINC000366545145 386821737 /nfs/dbraw/zinc/82/17/37/386821737.db2.gz OFFOIBVDVZONSQ-KGLIPLIRSA-N 1 2 228.295 2.141 20 0 BEADLO CN(Cc1[nH+]ccn1C)c1ncccc1Cl ZINC000280263257 386798342 /nfs/dbraw/zinc/79/83/42/386798342.db2.gz PXTRMNXTEIXMAU-UHFFFAOYSA-N 1 2 236.706 2.105 20 0 BEADLO CCCCC[C@@H]1CCC[N@@H+]1Cc1n[nH]c(=O)[nH]1 ZINC000340938407 386802421 /nfs/dbraw/zinc/80/24/21/386802421.db2.gz ZLLNBSYTYPDLCX-SNVBAGLBSA-N 1 2 238.335 2.055 20 0 BEADLO CCCCC[C@@H]1CCC[N@H+]1Cc1n[nH]c(=O)[nH]1 ZINC000340938407 386802428 /nfs/dbraw/zinc/80/24/28/386802428.db2.gz ZLLNBSYTYPDLCX-SNVBAGLBSA-N 1 2 238.335 2.055 20 0 BEADLO Cc1nocc1C[NH2+][C@H](C)c1nnc(C(C)C)[nH]1 ZINC000293382666 386809085 /nfs/dbraw/zinc/80/90/85/386809085.db2.gz WFKBPNVHDYIZSO-SECBINFHSA-N 1 2 249.318 2.075 20 0 BEADLO C[C@@H]1CCC[C@H](C[N@H+](CCO)CC(F)F)C1 ZINC000193026703 386813763 /nfs/dbraw/zinc/81/37/63/386813763.db2.gz BAGXLTMXBNVGAC-MNOVXSKESA-N 1 2 235.318 2.372 20 0 BEADLO C[C@@H]1CCC[C@H](C[N@@H+](CCO)CC(F)F)C1 ZINC000193026703 386813768 /nfs/dbraw/zinc/81/37/68/386813768.db2.gz BAGXLTMXBNVGAC-MNOVXSKESA-N 1 2 235.318 2.372 20 0 BEADLO CC[C@H]1CCCC[C@@H]1C(=O)NCc1[nH+]ccn1C ZINC000280584477 386826515 /nfs/dbraw/zinc/82/65/15/386826515.db2.gz SIKDTASIXGDUQO-RYUDHWBXSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1nocc1C[N@@H+](C)Cc1ccncc1 ZINC000293581216 386841751 /nfs/dbraw/zinc/84/17/51/386841751.db2.gz JTHXRORLEDOFDS-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1nocc1C[N@H+](C)Cc1ccncc1 ZINC000293581216 386841758 /nfs/dbraw/zinc/84/17/58/386841758.db2.gz JTHXRORLEDOFDS-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO CO[C@]1(C)C[C@@H](Nc2cc(C)[nH+]cn2)C1(C)C ZINC000301427530 386843889 /nfs/dbraw/zinc/84/38/89/386843889.db2.gz MOFKIAYSUXSSKR-ZWNOBZJWSA-N 1 2 235.331 2.401 20 0 BEADLO CO[C@](C)(CNc1cc[nH+]c(C)n1)C1CC1 ZINC000292324954 386853710 /nfs/dbraw/zinc/85/37/10/386853710.db2.gz MQIFJHFMMQSUMH-GFCCVEGCSA-N 1 2 221.304 2.012 20 0 BEADLO CCCC[C@H]([NH2+][C@@H]1CC[C@H]1SC)C(=O)OC ZINC000425335130 386847453 /nfs/dbraw/zinc/84/74/53/386847453.db2.gz HOPMXLXOTUNOOF-OUAUKWLOSA-N 1 2 245.388 2.202 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CCC(CF)CC2)[nH+]1 ZINC000334787559 386849336 /nfs/dbraw/zinc/84/93/36/386849336.db2.gz KTFWMRXXDPRQJL-UHFFFAOYSA-N 1 2 248.305 2.452 20 0 BEADLO CO[C@@](C)(CNc1cc[nH+]c(C)n1)C1CC1 ZINC000292324958 386852398 /nfs/dbraw/zinc/85/23/98/386852398.db2.gz MQIFJHFMMQSUMH-LBPRGKRZSA-N 1 2 221.304 2.012 20 0 BEADLO c1coc(C[N@@H+]2C[C@]3(CCCO3)[C@@H]2C2CC2)c1 ZINC000293862126 386891327 /nfs/dbraw/zinc/89/13/27/386891327.db2.gz CBKKWDULSWSILZ-UONOGXRCSA-N 1 2 233.311 2.423 20 0 BEADLO c1coc(C[N@H+]2C[C@]3(CCCO3)[C@@H]2C2CC2)c1 ZINC000293862126 386891330 /nfs/dbraw/zinc/89/13/30/386891330.db2.gz CBKKWDULSWSILZ-UONOGXRCSA-N 1 2 233.311 2.423 20 0 BEADLO CC(C)[C@@H](CO)Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000301584982 386856238 /nfs/dbraw/zinc/85/62/38/386856238.db2.gz VVGUOVOEDQEOJK-SNVBAGLBSA-N 1 2 237.347 2.203 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc3c(n2)CCC3)[C@H](C)CO1 ZINC000334791908 386857682 /nfs/dbraw/zinc/85/76/82/386857682.db2.gz DXOPUUQDRXPNIQ-VXGBXAGGSA-N 1 2 246.354 2.180 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc3c(n2)CCC3)[C@H](C)CO1 ZINC000334791908 386857684 /nfs/dbraw/zinc/85/76/84/386857684.db2.gz DXOPUUQDRXPNIQ-VXGBXAGGSA-N 1 2 246.354 2.180 20 0 BEADLO CC[C@@H](CCO)Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000301586675 386858526 /nfs/dbraw/zinc/85/85/26/386858526.db2.gz PCSBVSKAGPJWED-JTQLQIEISA-N 1 2 237.347 2.347 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ccncc1)c1ccon1 ZINC000336744525 386859633 /nfs/dbraw/zinc/85/96/33/386859633.db2.gz QCVSNASAGCUTSK-UWVGGRQHSA-N 1 2 217.272 2.481 20 0 BEADLO Cc1c(C[N@@H+]2Cc3cccc(F)c3C2)cnn1C ZINC000334793303 386860398 /nfs/dbraw/zinc/86/03/98/386860398.db2.gz YQCPGYCEDTXJMP-UHFFFAOYSA-N 1 2 245.301 2.383 20 0 BEADLO Cc1c(C[N@H+]2Cc3cccc(F)c3C2)cnn1C ZINC000334793303 386860404 /nfs/dbraw/zinc/86/04/04/386860404.db2.gz YQCPGYCEDTXJMP-UHFFFAOYSA-N 1 2 245.301 2.383 20 0 BEADLO CC[C@H](O)CCNc1cc[nH+]c(C(C)(C)C)n1 ZINC000301639027 386863409 /nfs/dbraw/zinc/86/34/09/386863409.db2.gz AUDNSPBHSYFQRZ-JTQLQIEISA-N 1 2 237.347 2.347 20 0 BEADLO Cc1ccc(C[NH+]2CC(O)(C(F)F)C2)c(C)c1 ZINC000425349799 386867786 /nfs/dbraw/zinc/86/77/86/386867786.db2.gz QLGPEDNFHJJLNX-UHFFFAOYSA-N 1 2 241.281 2.115 20 0 BEADLO Cc1c(NCc2[nH+]ccn2C)cnn1CC(C)C ZINC000341278425 386874187 /nfs/dbraw/zinc/87/41/87/386874187.db2.gz SBTYBKFITDKJQV-UHFFFAOYSA-N 1 2 247.346 2.193 20 0 BEADLO CC(C)(C)n1ncc2c1nc[nH+]c2NCC1CC1 ZINC000301875192 386887313 /nfs/dbraw/zinc/88/73/13/386887313.db2.gz IJAOQKKZPPPRGQ-UHFFFAOYSA-N 1 2 245.330 2.403 20 0 BEADLO c1cncc(C[N@@H+]2C[C@@]3(CCCO3)[C@@H]2C2CC2)c1 ZINC000293839690 386889444 /nfs/dbraw/zinc/88/94/44/386889444.db2.gz AZRRLLASOACCIM-GJZGRUSLSA-N 1 2 244.338 2.225 20 0 BEADLO c1cncc(C[N@H+]2C[C@@]3(CCCO3)[C@@H]2C2CC2)c1 ZINC000293839690 386889449 /nfs/dbraw/zinc/88/94/49/386889449.db2.gz AZRRLLASOACCIM-GJZGRUSLSA-N 1 2 244.338 2.225 20 0 BEADLO Cc1cccc(C[N@@H+]2CCO[C@@H](CF)C2)c1F ZINC000334860340 386913946 /nfs/dbraw/zinc/91/39/46/386913946.db2.gz YRUBRANRBNHBGE-LBPRGKRZSA-N 1 2 241.281 2.304 20 0 BEADLO Cc1cccc(C[N@H+]2CCO[C@@H](CF)C2)c1F ZINC000334860340 386913953 /nfs/dbraw/zinc/91/39/53/386913953.db2.gz YRUBRANRBNHBGE-LBPRGKRZSA-N 1 2 241.281 2.304 20 0 BEADLO C[C@@H]1C[C@H](C)N1c1cc[nH+]c(C2CC2)n1 ZINC000335769121 386914259 /nfs/dbraw/zinc/91/42/59/386914259.db2.gz FBNSTHWQDOATTN-DTORHVGOSA-N 1 2 203.289 2.341 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)C1CCC(C)(C)CC1 ZINC000334852576 386902524 /nfs/dbraw/zinc/90/25/24/386902524.db2.gz SNGKEKRLBNUEOP-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO O=[S@@](Cc1cn2ccccc2[nH+]1)C1CCC1 ZINC000334854132 386904371 /nfs/dbraw/zinc/90/43/71/386904371.db2.gz DXSIHYQEVBMEBH-INIZCTEOSA-N 1 2 234.324 2.136 20 0 BEADLO CC(C)(C)C(C)(C)C(=O)N1CCn2c[nH+]cc2C1 ZINC000335764282 386904955 /nfs/dbraw/zinc/90/49/55/386904955.db2.gz RADKQFZRKKKYHS-UHFFFAOYSA-N 1 2 249.358 2.298 20 0 BEADLO CC(C)(C(=O)N1CCCCCC1)c1c[nH+]c[nH]1 ZINC000335768970 386913484 /nfs/dbraw/zinc/91/34/84/386913484.db2.gz GYAGFYUNRUWLRC-UHFFFAOYSA-N 1 2 235.331 2.090 20 0 BEADLO CC(C)(C)c1nc(NCC2(CCO)CC2)cc[nH+]1 ZINC000302420606 386922750 /nfs/dbraw/zinc/92/27/50/386922750.db2.gz IVIVLUGROBNMDZ-UHFFFAOYSA-N 1 2 249.358 2.349 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CC(C)(C)[C@@H]2C2CC2)nn1 ZINC000367975696 386922911 /nfs/dbraw/zinc/92/29/11/386922911.db2.gz ZXYDBFKYCAQRPE-ZDUSSCGKSA-N 1 2 248.374 2.479 20 0 BEADLO CC(C)n1cc(C[N@H+]2CC(C)(C)[C@@H]2C2CC2)nn1 ZINC000367975696 386922913 /nfs/dbraw/zinc/92/29/13/386922913.db2.gz ZXYDBFKYCAQRPE-ZDUSSCGKSA-N 1 2 248.374 2.479 20 0 BEADLO Cc1ccc2c(c1)C[N@H+]([C@@H](C)C(N)=O)C2 ZINC000334877900 386938419 /nfs/dbraw/zinc/93/84/19/386938419.db2.gz ZLCDJWQIZZEMQJ-VIFPVBQESA-N 1 2 204.273 2.234 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+]([C@@H](C)C(N)=O)C2 ZINC000334877900 386938422 /nfs/dbraw/zinc/93/84/22/386938422.db2.gz ZLCDJWQIZZEMQJ-VIFPVBQESA-N 1 2 204.273 2.234 20 0 BEADLO CC[C@H](NC(=O)[C@H](CC)SC)c1[nH]cc[nH+]1 ZINC000331031912 386958217 /nfs/dbraw/zinc/95/82/17/386958217.db2.gz GYAXHJJXRBTMTJ-IUCAKERBSA-N 1 2 241.360 2.119 20 0 BEADLO Cc1nnc([C@H](C)[N@H+](C)Cc2cnccc2C)o1 ZINC000331102688 386963186 /nfs/dbraw/zinc/96/31/86/386963186.db2.gz CYGCTAZKOXUTNZ-JTQLQIEISA-N 1 2 246.314 2.274 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+](C)Cc2cnccc2C)o1 ZINC000331102688 386963188 /nfs/dbraw/zinc/96/31/88/386963188.db2.gz CYGCTAZKOXUTNZ-JTQLQIEISA-N 1 2 246.314 2.274 20 0 BEADLO CC(C)c1nc(C[N@H+](C)C2(CO)CC2)cs1 ZINC000353025809 386979524 /nfs/dbraw/zinc/97/95/24/386979524.db2.gz JBPAIRFVXMQJRS-UHFFFAOYSA-N 1 2 240.372 2.223 20 0 BEADLO CC(C)c1nc(C[N@@H+](C)C2(CO)CC2)cs1 ZINC000353025809 386979529 /nfs/dbraw/zinc/97/95/29/386979529.db2.gz JBPAIRFVXMQJRS-UHFFFAOYSA-N 1 2 240.372 2.223 20 0 BEADLO Cc1ccc(C)c(C[NH2+]Cc2ccn[nH]2)c1 ZINC000049670314 386994055 /nfs/dbraw/zinc/99/40/55/386994055.db2.gz PQEKSMKVFDVERS-UHFFFAOYSA-N 1 2 215.300 2.316 20 0 BEADLO C[C@H]1C[N@H+](CCc2cnn[nH]2)[C@H]1c1ccccc1 ZINC000647966392 386997473 /nfs/dbraw/zinc/99/74/73/386997473.db2.gz QSVWZASQMRQPRD-SMDDNHRTSA-N 1 2 242.326 2.040 20 0 BEADLO C[C@H]1C[N@@H+](CCc2cnn[nH]2)[C@H]1c1ccccc1 ZINC000647966392 386997477 /nfs/dbraw/zinc/99/74/77/386997477.db2.gz QSVWZASQMRQPRD-SMDDNHRTSA-N 1 2 242.326 2.040 20 0 BEADLO Cn1cc[nH+]c1[C@@H](NC(=O)[C@@H]1CC1(C)C)C1CC1 ZINC000341686747 386950269 /nfs/dbraw/zinc/95/02/69/386950269.db2.gz GFKKMOVBXNGTNG-QWRGUYRKSA-N 1 2 247.342 2.034 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1C[C@]12CCOC2 ZINC000333361677 387030075 /nfs/dbraw/zinc/03/00/75/387030075.db2.gz HHPZSGGRYGWVSY-RISCZKNCSA-N 1 2 246.310 2.064 20 0 BEADLO CC(C)CC(=O)N1CCC[C@@H](c2[nH+]ccn2C)C1 ZINC000369351970 387040241 /nfs/dbraw/zinc/04/02/41/387040241.db2.gz GYNSIOUOXLQQRA-GFCCVEGCSA-N 1 2 249.358 2.172 20 0 BEADLO Cc1cc(N2CCC(=O)[C@H](C)C2)nc(C2CC2)[nH+]1 ZINC000188549033 387042055 /nfs/dbraw/zinc/04/20/55/387042055.db2.gz VZIZWIHVUOZYBC-SECBINFHSA-N 1 2 245.326 2.078 20 0 BEADLO Cc1noc(-c2cccc(-n3cc[nH+]c3)c2)n1 ZINC000118167360 387042958 /nfs/dbraw/zinc/04/29/58/387042958.db2.gz ONJRLTLDWFUMCY-UHFFFAOYSA-N 1 2 226.239 2.231 20 0 BEADLO Cc1cc(N[C@@H](C)CCO)nc(C(C)C)[nH+]1 ZINC000096867084 387054403 /nfs/dbraw/zinc/05/44/03/387054403.db2.gz SFRMBIADFQJVLP-VIFPVBQESA-N 1 2 223.320 2.091 20 0 BEADLO COC(=O)c1occc1C[NH+]1CC2(C1)CCCC2 ZINC000459566611 387058571 /nfs/dbraw/zinc/05/85/71/387058571.db2.gz URHVNGBQINNWLE-UHFFFAOYSA-N 1 2 249.310 2.442 20 0 BEADLO Cc1cc(CNC(=O)N2CCCC2)cc(C)[nH+]1 ZINC000334974435 387060345 /nfs/dbraw/zinc/06/03/45/387060345.db2.gz LFXRFDSBYVODQR-UHFFFAOYSA-N 1 2 233.315 2.004 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CC[C@H](F)C2)cn1 ZINC000336223386 387063672 /nfs/dbraw/zinc/06/36/72/387063672.db2.gz ZCJKVJADTSLQGK-NSHDSACASA-N 1 2 211.284 2.008 20 0 BEADLO CC(C)n1cc(C[N@H+]2CC[C@H](F)C2)cn1 ZINC000336223386 387063675 /nfs/dbraw/zinc/06/36/75/387063675.db2.gz ZCJKVJADTSLQGK-NSHDSACASA-N 1 2 211.284 2.008 20 0 BEADLO CSCCCC(=O)Nc1cccc2[nH+]ccn21 ZINC000358768493 387009404 /nfs/dbraw/zinc/00/94/04/387009404.db2.gz PQJTWVDBDVAQSZ-UHFFFAOYSA-N 1 2 249.339 2.416 20 0 BEADLO COC[C@@H](C)[N@@H+]1CCn2c(cc3ccccc32)C1 ZINC000336029885 387010987 /nfs/dbraw/zinc/01/09/87/387010987.db2.gz CBSXLQXAJXVMFN-GFCCVEGCSA-N 1 2 244.338 2.492 20 0 BEADLO COC[C@@H](C)[N@H+]1CCn2c(cc3ccccc32)C1 ZINC000336029885 387010991 /nfs/dbraw/zinc/01/09/91/387010991.db2.gz CBSXLQXAJXVMFN-GFCCVEGCSA-N 1 2 244.338 2.492 20 0 BEADLO CCC[N@@H+](Cc1cc[nH]c(=O)c1)CC(F)F ZINC000639469900 387015083 /nfs/dbraw/zinc/01/50/83/387015083.db2.gz ZFYQYFPTVKTHKS-UHFFFAOYSA-N 1 2 230.258 2.264 20 0 BEADLO CCC[N@H+](Cc1cc[nH]c(=O)c1)CC(F)F ZINC000639469900 387015086 /nfs/dbraw/zinc/01/50/86/387015086.db2.gz ZFYQYFPTVKTHKS-UHFFFAOYSA-N 1 2 230.258 2.264 20 0 BEADLO CCCN(CC)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000519163024 387025849 /nfs/dbraw/zinc/02/58/49/387025849.db2.gz NSRPNRVETSPVNC-NSHDSACASA-N 1 2 223.320 2.093 20 0 BEADLO C[C@@H]1C[C@@H]1NC(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000117785151 387028895 /nfs/dbraw/zinc/02/88/95/387028895.db2.gz MJEHCYJLTPRQTJ-MFKMUULPSA-N 1 2 241.294 2.011 20 0 BEADLO Cc1c(Cl)c(C[NH+]2[C@@H](C)C[C@@H]2C)nn1C ZINC000334982466 387069835 /nfs/dbraw/zinc/06/98/35/387069835.db2.gz ONSPOUHWRFMRPX-YUMQZZPRSA-N 1 2 227.739 2.365 20 0 BEADLO Cc1c(Cl)c(C[N@H+]2[C@H](C)C[C@@H]2C)nn1C ZINC000334982465 387070148 /nfs/dbraw/zinc/07/01/48/387070148.db2.gz ONSPOUHWRFMRPX-OCAPTIKFSA-N 1 2 227.739 2.365 20 0 BEADLO Cc1c(Cl)c(C[N@@H+]2[C@H](C)C[C@@H]2C)nn1C ZINC000334982465 387070154 /nfs/dbraw/zinc/07/01/54/387070154.db2.gz ONSPOUHWRFMRPX-OCAPTIKFSA-N 1 2 227.739 2.365 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@H](C(C)C)C2)cn1 ZINC000334986843 387075728 /nfs/dbraw/zinc/07/57/28/387075728.db2.gz BFTOMNUOSBAOGC-AWEZNQCLSA-N 1 2 234.343 2.247 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@H](C(C)C)C2)cn1 ZINC000334986843 387075733 /nfs/dbraw/zinc/07/57/33/387075733.db2.gz BFTOMNUOSBAOGC-AWEZNQCLSA-N 1 2 234.343 2.247 20 0 BEADLO COC(=O)C1([NH2+]CCc2ccccc2)CCCC1 ZINC000118862050 387077909 /nfs/dbraw/zinc/07/79/09/387077909.db2.gz DIJMUDFAIKGWKK-UHFFFAOYSA-N 1 2 247.338 2.305 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@]1(C)CC1(F)F ZINC000334994429 387083917 /nfs/dbraw/zinc/08/39/17/387083917.db2.gz WUCIMAUVFPNVKJ-NSHDSACASA-N 1 2 240.253 2.050 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@]1(C)CC1(F)F ZINC000334995307 387086386 /nfs/dbraw/zinc/08/63/86/387086386.db2.gz IRFCCRLTDYGWII-JTQLQIEISA-N 1 2 242.225 2.074 20 0 BEADLO Cc1nc(C[NH+]2[C@@H](C)CCC[C@@H]2C)no1 ZINC000066531623 387087138 /nfs/dbraw/zinc/08/71/38/387087138.db2.gz HLXZHWQVMSUDBO-IUCAKERBSA-N 1 2 209.293 2.141 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1CC12CCCC2 ZINC000336256349 387088453 /nfs/dbraw/zinc/08/84/53/387088453.db2.gz BGNJMJNKBVGFSS-NSHDSACASA-N 1 2 230.311 2.331 20 0 BEADLO CC[C@@H](NCc1c[nH+]cn1CC)C(F)F ZINC000418078320 387089344 /nfs/dbraw/zinc/08/93/44/387089344.db2.gz NZVBBVPMIPQYLM-SECBINFHSA-N 1 2 217.263 2.036 20 0 BEADLO COc1ncccc1C[N@@H+]1CCC[C@](C)(F)C1 ZINC000336275222 387105856 /nfs/dbraw/zinc/10/58/56/387105856.db2.gz DUBSBKUHGVXIOJ-ZDUSSCGKSA-N 1 2 238.306 2.414 20 0 BEADLO COc1ncccc1C[N@H+]1CCC[C@](C)(F)C1 ZINC000336275222 387105859 /nfs/dbraw/zinc/10/58/59/387105859.db2.gz DUBSBKUHGVXIOJ-ZDUSSCGKSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cc(C[N@@H+]2CCC[C@](C)(F)C2)ccn1 ZINC000336275160 387105875 /nfs/dbraw/zinc/10/58/75/387105875.db2.gz AOXCILCGDCSKOO-ZDUSSCGKSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cc(C[N@H+]2CCC[C@](C)(F)C2)ccn1 ZINC000336275160 387105879 /nfs/dbraw/zinc/10/58/79/387105879.db2.gz AOXCILCGDCSKOO-ZDUSSCGKSA-N 1 2 238.306 2.414 20 0 BEADLO Cc1cc(C)c(CNC(=O)N[C@H]2CC[C@@H]2C)c[nH+]1 ZINC000334945814 387108498 /nfs/dbraw/zinc/10/84/98/387108498.db2.gz PHDZVFUMTYESGF-ZANVPECISA-N 1 2 247.342 2.296 20 0 BEADLO C[C@@H]1CC=C(C(=O)N(C)Cc2[nH]cc[nH+]2)CC1 ZINC000336286832 387120603 /nfs/dbraw/zinc/12/06/03/387120603.db2.gz BJZXYEIDWKTLPJ-SNVBAGLBSA-N 1 2 233.315 2.115 20 0 BEADLO COc1ncccc1C[N@@H+]1CC[C@](C)(F)C1 ZINC000336302832 387132224 /nfs/dbraw/zinc/13/22/24/387132224.db2.gz GEIIMEFODJEJFF-LBPRGKRZSA-N 1 2 224.279 2.024 20 0 BEADLO COc1ncccc1C[N@H+]1CC[C@](C)(F)C1 ZINC000336302832 387132228 /nfs/dbraw/zinc/13/22/28/387132228.db2.gz GEIIMEFODJEJFF-LBPRGKRZSA-N 1 2 224.279 2.024 20 0 BEADLO Cc1noc(C[NH2+][C@H](c2cccnc2)C2CC2)n1 ZINC000543448173 387129661 /nfs/dbraw/zinc/12/96/61/387129661.db2.gz XKTILIINCKWYHM-ZDUSSCGKSA-N 1 2 244.298 2.014 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCc2cn[nH]c2C1)c1cscn1 ZINC000336316314 387141884 /nfs/dbraw/zinc/14/18/84/387141884.db2.gz SOELHCXWCCPQKN-SCZZXKLOSA-N 1 2 248.355 2.074 20 0 BEADLO Cc1oncc1CN1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000336315744 387142064 /nfs/dbraw/zinc/14/20/64/387142064.db2.gz HCKIIQJHUZTPST-LLVKDONJSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1oncc1C[N@@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000336315744 387142069 /nfs/dbraw/zinc/14/20/69/387142069.db2.gz HCKIIQJHUZTPST-LLVKDONJSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1oncc1C[N@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000336315744 387142072 /nfs/dbraw/zinc/14/20/72/387142072.db2.gz HCKIIQJHUZTPST-LLVKDONJSA-N 1 2 232.287 2.043 20 0 BEADLO CCc1ccccc1NC(=O)NCc1[nH]cc[nH+]1 ZINC000119564568 387142089 /nfs/dbraw/zinc/14/20/89/387142089.db2.gz FUWQNNFESCWTJA-UHFFFAOYSA-N 1 2 244.298 2.294 20 0 BEADLO COC(=O)C(C)(C)[N@H+](C)Cc1ccc(Cl)o1 ZINC000353140305 387145954 /nfs/dbraw/zinc/14/59/54/387145954.db2.gz AYYCHKJQWVURFG-UHFFFAOYSA-N 1 2 245.706 2.316 20 0 BEADLO COC(=O)C(C)(C)[N@@H+](C)Cc1ccc(Cl)o1 ZINC000353140305 387145960 /nfs/dbraw/zinc/14/59/60/387145960.db2.gz AYYCHKJQWVURFG-UHFFFAOYSA-N 1 2 245.706 2.316 20 0 BEADLO CO[C@H](C)C[N@H+](C)Cc1ncc(Cl)s1 ZINC000353224271 387160778 /nfs/dbraw/zinc/16/07/78/387160778.db2.gz YLLPCFYMWIGQHR-SSDOTTSWSA-N 1 2 234.752 2.263 20 0 BEADLO CO[C@H](C)C[N@@H+](C)Cc1ncc(Cl)s1 ZINC000353224271 387160784 /nfs/dbraw/zinc/16/07/84/387160784.db2.gz YLLPCFYMWIGQHR-SSDOTTSWSA-N 1 2 234.752 2.263 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1coc2ccccc12 ZINC000353284944 387174866 /nfs/dbraw/zinc/17/48/66/387174866.db2.gz GGSOZPTYFRYBNM-UHFFFAOYSA-N 1 2 247.294 2.428 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1coc2ccccc12 ZINC000353284944 387174870 /nfs/dbraw/zinc/17/48/70/387174870.db2.gz GGSOZPTYFRYBNM-UHFFFAOYSA-N 1 2 247.294 2.428 20 0 BEADLO CCO[C@@H](C)C(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC000353309935 387176026 /nfs/dbraw/zinc/17/60/26/387176026.db2.gz QWHTUYAOXOMWBD-QMMMGPOBSA-N 1 2 247.298 2.235 20 0 BEADLO CCO[C@@H](C)C(=O)Nc1ccc2[nH+]c(C)[nH]c2c1 ZINC000353309935 387176031 /nfs/dbraw/zinc/17/60/31/387176031.db2.gz QWHTUYAOXOMWBD-QMMMGPOBSA-N 1 2 247.298 2.235 20 0 BEADLO CC(C)c1nc(N2CCC[C@@H]([C@@H](C)O)C2)cc[nH+]1 ZINC000120152154 387179808 /nfs/dbraw/zinc/17/98/08/387179808.db2.gz PKVROEUTVWEYKJ-VXGBXAGGSA-N 1 2 249.358 2.197 20 0 BEADLO CCCCC(=O)NC[C@H]1CCCn2cc(C)[nH+]c21 ZINC000371254915 387180458 /nfs/dbraw/zinc/18/04/58/387180458.db2.gz BCDBADGSNAZOPF-GFCCVEGCSA-N 1 2 249.358 2.375 20 0 BEADLO CCCCC(=O)NC[C@@H]1CCCn2cc(C)[nH+]c21 ZINC000371254916 387182230 /nfs/dbraw/zinc/18/22/30/387182230.db2.gz BCDBADGSNAZOPF-LBPRGKRZSA-N 1 2 249.358 2.375 20 0 BEADLO CC[C@H](NC(=O)CCc1[nH]cc[nH+]1)C(C)(C)C ZINC000353338662 387183097 /nfs/dbraw/zinc/18/30/97/387183097.db2.gz OZCWRLDJAMYTTA-JTQLQIEISA-N 1 2 237.347 2.283 20 0 BEADLO CCOC1(C)C[NH+](Cc2ccc3c(c2)CCO3)C1 ZINC000459624972 387135496 /nfs/dbraw/zinc/13/54/96/387135496.db2.gz RYRHPYUXQKLJSV-UHFFFAOYSA-N 1 2 247.338 2.232 20 0 BEADLO CCc1ccc([C@@H](CO)[NH2+]Cc2ccon2)cc1 ZINC000359616787 387136229 /nfs/dbraw/zinc/13/62/29/387136229.db2.gz KPQUFGZHYYCJSY-CQSZACIVSA-N 1 2 246.310 2.060 20 0 BEADLO C[C@@H]1CC[C@@H]1[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000571955893 387207114 /nfs/dbraw/zinc/20/71/14/387207114.db2.gz BEEGMFNVDPPIBJ-WXHSDQCUSA-N 1 2 242.326 2.282 20 0 BEADLO CC[C@@H](O)CNc1ccc2ccccc2[nH+]1 ZINC000229993800 387210681 /nfs/dbraw/zinc/21/06/81/387210681.db2.gz RDPPYKSUUPHRON-LLVKDONJSA-N 1 2 216.284 2.418 20 0 BEADLO COc1cc(C)[nH+]c(CS[C@@H](C)[C@H](C)O)c1 ZINC000229863398 387212053 /nfs/dbraw/zinc/21/20/53/387212053.db2.gz PIRZBKQAHRMIDM-UWVGGRQHSA-N 1 2 241.356 2.401 20 0 BEADLO COc1cc(C)[nH+]c(CS[C@@H](C)[C@@H](C)O)c1 ZINC000229863384 387212793 /nfs/dbraw/zinc/21/27/93/387212793.db2.gz PIRZBKQAHRMIDM-ZJUUUORDSA-N 1 2 241.356 2.401 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000092485921 387213435 /nfs/dbraw/zinc/21/34/35/387213435.db2.gz XARYWTPZIOIUER-AAEUAGOBSA-N 1 2 219.332 2.483 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000092485921 387213439 /nfs/dbraw/zinc/21/34/39/387213439.db2.gz XARYWTPZIOIUER-AAEUAGOBSA-N 1 2 219.332 2.483 20 0 BEADLO Cc1cc(NCCCc2ccccc2F)nc[nH+]1 ZINC000360064523 387222985 /nfs/dbraw/zinc/22/29/85/387222985.db2.gz UTAWEIGHFPUBFC-UHFFFAOYSA-N 1 2 245.301 2.391 20 0 BEADLO Cc1cc(N[C@@H]2CCCOCC2)nc(C(C)C)[nH+]1 ZINC000336796272 387232644 /nfs/dbraw/zinc/23/26/44/387232644.db2.gz RCAPPAPVJNTUJF-GFCCVEGCSA-N 1 2 249.358 2.311 20 0 BEADLO CC(C)c1nc(N2CCOCC3(CC3)C2)cc[nH+]1 ZINC000360184450 387240975 /nfs/dbraw/zinc/24/09/75/387240975.db2.gz LBHGSVGZDPZUFG-UHFFFAOYSA-N 1 2 247.342 2.217 20 0 BEADLO CSCCCC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000360218473 387245711 /nfs/dbraw/zinc/24/57/11/387245711.db2.gz FRJHQNNNGWKQKJ-UHFFFAOYSA-N 1 2 249.339 2.416 20 0 BEADLO Cc1ccc(/C=C/C(=O)Nc2cc[nH+]cc2O)o1 ZINC000120925542 387198574 /nfs/dbraw/zinc/19/85/74/387198574.db2.gz JCDMTOFKOQMEHA-SNAWJCMRSA-N 1 2 244.250 2.341 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)[C@H]1CCCC[C@@H]1C ZINC000424590349 387199118 /nfs/dbraw/zinc/19/91/18/387199118.db2.gz LCULRSXJALJWMJ-XQQFMLRXSA-N 1 2 249.358 2.214 20 0 BEADLO Cc1ccnc(N(C)Cc2[nH]cc[nH+]2)c1Cl ZINC000336370149 387202025 /nfs/dbraw/zinc/20/20/25/387202025.db2.gz XIGILSQTRDVVLL-UHFFFAOYSA-N 1 2 236.706 2.403 20 0 BEADLO CC[C@H]([NH2+]Cc1ncn(C)n1)c1cccc(C)c1 ZINC000286177134 387316374 /nfs/dbraw/zinc/31/63/74/387316374.db2.gz QFEBMPHBCSGMLZ-ZDUSSCGKSA-N 1 2 244.342 2.364 20 0 BEADLO COC(=O)c1occc1C[N@@H+]1CCC12CCC2 ZINC000353663627 387254053 /nfs/dbraw/zinc/25/40/53/387254053.db2.gz DLBHHRMLKVLPND-UHFFFAOYSA-N 1 2 235.283 2.195 20 0 BEADLO COC(=O)c1occc1C[N@H+]1CCC12CCC2 ZINC000353663627 387254057 /nfs/dbraw/zinc/25/40/57/387254057.db2.gz DLBHHRMLKVLPND-UHFFFAOYSA-N 1 2 235.283 2.195 20 0 BEADLO C[C@@H](CC(=O)NCCCC1CC1)n1cc[nH+]c1 ZINC000572165666 387255570 /nfs/dbraw/zinc/25/55/70/387255570.db2.gz XTLKCHRQGZHYJU-NSHDSACASA-N 1 2 235.331 2.141 20 0 BEADLO CC[C@@H](CC(C)C)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000514709946 387276172 /nfs/dbraw/zinc/27/61/72/387276172.db2.gz JFXAYHHYPPBWNV-LBPRGKRZSA-N 1 2 249.358 2.339 20 0 BEADLO CN(CC1CCC1)C(=O)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000336492805 387317820 /nfs/dbraw/zinc/31/78/20/387317820.db2.gz DLWRAEDENRVAJC-NSHDSACASA-N 1 2 247.342 2.088 20 0 BEADLO C[C@@H](N[C@@H](C1CC1)C(F)(F)F)c1[nH+]ccn1C ZINC000352519734 387286195 /nfs/dbraw/zinc/28/61/95/387286195.db2.gz RGUMQLZNLQXPNA-APPZFPTMSA-N 1 2 247.264 2.412 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N(C)c1ccccc1 ZINC000572254596 387287879 /nfs/dbraw/zinc/28/78/79/387287879.db2.gz TWCDMPLZHLDLQZ-NSHDSACASA-N 1 2 243.310 2.251 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N(C)c1ccccc1 ZINC000572254596 387287885 /nfs/dbraw/zinc/28/78/85/387287885.db2.gz TWCDMPLZHLDLQZ-NSHDSACASA-N 1 2 243.310 2.251 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1CCC[C@H](CO)C1 ZINC000572257140 387288255 /nfs/dbraw/zinc/28/82/55/387288255.db2.gz FCPXQPZOKVOEDW-RYUDHWBXSA-N 1 2 235.331 2.056 20 0 BEADLO CC(C)c1nc(C[N@@H+]2CC[C@H](C3CC3)C2)no1 ZINC000372338478 387291510 /nfs/dbraw/zinc/29/15/10/387291510.db2.gz IYSGYRSGADNCKV-NSHDSACASA-N 1 2 235.331 2.425 20 0 BEADLO CC(C)c1nc(C[N@H+]2CC[C@H](C3CC3)C2)no1 ZINC000372338478 387291514 /nfs/dbraw/zinc/29/15/14/387291514.db2.gz IYSGYRSGADNCKV-NSHDSACASA-N 1 2 235.331 2.425 20 0 BEADLO Cc1cnc(C[N@@H+]2CCn3cccc3[C@@H]2C)cn1 ZINC000336469376 387298593 /nfs/dbraw/zinc/29/85/93/387298593.db2.gz LJAVTWWGHPYXAY-LBPRGKRZSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1cnc(C[N@H+]2CCn3cccc3[C@@H]2C)cn1 ZINC000336469376 387298596 /nfs/dbraw/zinc/29/85/96/387298596.db2.gz LJAVTWWGHPYXAY-LBPRGKRZSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)C2CC=CC2)[nH+]1 ZINC000514866055 387300091 /nfs/dbraw/zinc/30/00/91/387300091.db2.gz FVDKLHTXJWLWFS-UHFFFAOYSA-N 1 2 233.315 2.036 20 0 BEADLO CC(C)CC(=O)N1CC[C@H](Oc2cc[nH+]cc2)C1 ZINC000121171031 387303598 /nfs/dbraw/zinc/30/35/98/387303598.db2.gz FYNPZWSMCVTGMR-ZDUSSCGKSA-N 1 2 248.326 2.107 20 0 BEADLO CC[C@H]([NH2+]Cc1ncc[nH]1)c1c(C)noc1C ZINC000121180614 387306916 /nfs/dbraw/zinc/30/69/16/387306916.db2.gz KZTXVXXSYOQACG-JTQLQIEISA-N 1 2 234.303 2.255 20 0 BEADLO CC/C=C(\C)C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000360891013 387362702 /nfs/dbraw/zinc/36/27/02/387362702.db2.gz WARLPFCHLNTJSL-NYYWCZLTSA-N 1 2 247.342 2.472 20 0 BEADLO CC/C=C(\C)C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000360891013 387362705 /nfs/dbraw/zinc/36/27/05/387362705.db2.gz WARLPFCHLNTJSL-NYYWCZLTSA-N 1 2 247.342 2.472 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)cs1 ZINC000648592441 387364089 /nfs/dbraw/zinc/36/40/89/387364089.db2.gz DXAHJCFBWDNBHK-WDEREUQCSA-N 1 2 209.314 2.030 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@@H]3C[C@@H]32)cs1 ZINC000648592441 387364093 /nfs/dbraw/zinc/36/40/93/387364093.db2.gz DXAHJCFBWDNBHK-WDEREUQCSA-N 1 2 209.314 2.030 20 0 BEADLO Cc1nnc(C[N@@H+]2CC[C@@H]2c2ccccc2)o1 ZINC000336552622 387373629 /nfs/dbraw/zinc/37/36/29/387373629.db2.gz HXSXKNKCWGMDDP-GFCCVEGCSA-N 1 2 229.283 2.325 20 0 BEADLO Cc1nnc(C[N@H+]2CC[C@@H]2c2ccccc2)o1 ZINC000336552622 387373631 /nfs/dbraw/zinc/37/36/31/387373631.db2.gz HXSXKNKCWGMDDP-GFCCVEGCSA-N 1 2 229.283 2.325 20 0 BEADLO Cc1nc(N(C)Cc2cscn2)c(C)c(C)[nH+]1 ZINC000354465316 387381556 /nfs/dbraw/zinc/38/15/56/387381556.db2.gz PPJLFHURRVGODU-UHFFFAOYSA-N 1 2 248.355 2.495 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1ccc(Cl)o1 ZINC000354058270 387321775 /nfs/dbraw/zinc/32/17/75/387321775.db2.gz FUBUWDPWXHIJTH-QMMMGPOBSA-N 1 2 215.680 2.154 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1ccc(Cl)o1 ZINC000354058270 387321779 /nfs/dbraw/zinc/32/17/79/387321779.db2.gz FUBUWDPWXHIJTH-QMMMGPOBSA-N 1 2 215.680 2.154 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCS[C@@H](C)C1 ZINC000515021681 387325466 /nfs/dbraw/zinc/32/54/66/387325466.db2.gz IJMCVMTXVTYWJJ-VIFPVBQESA-N 1 2 223.345 2.035 20 0 BEADLO C[C@@H](NC(=O)CCc1[nH]cc[nH+]1)C1CCCCC1 ZINC000354094844 387329655 /nfs/dbraw/zinc/32/96/55/387329655.db2.gz WXMXQGAAOOSOCF-LLVKDONJSA-N 1 2 249.358 2.427 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccc(O)cc2)no1 ZINC000354137333 387333782 /nfs/dbraw/zinc/33/37/82/387333782.db2.gz MUMKZUIKDSGSCA-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccc(O)cc2)no1 ZINC000354137333 387333786 /nfs/dbraw/zinc/33/37/86/387333786.db2.gz MUMKZUIKDSGSCA-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H]2[C@@H]3CCC[C@@H]32)[nH+]1 ZINC000515195746 387344866 /nfs/dbraw/zinc/34/48/66/387344866.db2.gz BQJRHCHAIAKUKK-DOFRTFSJSA-N 1 2 228.299 2.477 20 0 BEADLO CC[C@@H](C)CCC(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000354233897 387349287 /nfs/dbraw/zinc/34/92/87/387349287.db2.gz ALXFDDGVWHJGOI-GHMZBOCLSA-N 1 2 249.358 2.210 20 0 BEADLO CC[C@@H](C)CCC(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000354233897 387349293 /nfs/dbraw/zinc/34/92/93/387349293.db2.gz ALXFDDGVWHJGOI-GHMZBOCLSA-N 1 2 249.358 2.210 20 0 BEADLO CC[C@H]1C[C@H](C)CN1C(=O)Nc1cc[nH+]c(C)c1 ZINC000336528570 387353138 /nfs/dbraw/zinc/35/31/38/387353138.db2.gz VWUHWJMDMSLJIX-GWCFXTLKSA-N 1 2 247.342 2.464 20 0 BEADLO FC1C[NH+](C[C@H]2C[C@@H]2c2ccccc2)C1 ZINC000336618729 387461408 /nfs/dbraw/zinc/46/14/08/387461408.db2.gz XYKUUIIFOUSZRQ-DGCLKSJQSA-N 1 2 205.276 2.444 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1CC[C@H](CO)CC1 ZINC000515869327 387439106 /nfs/dbraw/zinc/43/91/06/387439106.db2.gz BNOLNHUKRZJVOM-HAQNSBGRSA-N 1 2 235.331 2.056 20 0 BEADLO Fc1ccc(F)c2c1CC[C@H]2[NH2+]Cc1cc[nH]n1 ZINC000336603052 387446679 /nfs/dbraw/zinc/44/66/79/387446679.db2.gz PLSVGBKIVGIDAK-GFCCVEGCSA-N 1 2 249.264 2.465 20 0 BEADLO CC[C@]1(C)CCN(c2cc(C)[nH+]cn2)C1 ZINC000336575110 387397603 /nfs/dbraw/zinc/39/76/03/387397603.db2.gz LLNRMTNECCNNJA-GFCCVEGCSA-N 1 2 205.305 2.411 20 0 BEADLO Cc1noc([C@@H](C)[NH2+][C@@H](C)c2cccnc2)n1 ZINC000361094953 387400784 /nfs/dbraw/zinc/40/07/84/387400784.db2.gz FJMXMXCBSCCZFN-DTWKUNHWSA-N 1 2 232.287 2.185 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](C)c2cccnc2)nc1 ZINC000361088353 387400992 /nfs/dbraw/zinc/40/09/92/387400992.db2.gz XMJSCOAJCGDNEM-NSHDSACASA-N 1 2 228.299 2.031 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC[C@]1(C)CCCO1 ZINC000121720508 387401876 /nfs/dbraw/zinc/40/18/76/387401876.db2.gz SCDKITJPEWRMLQ-ZDUSSCGKSA-N 1 2 249.314 2.081 20 0 BEADLO Cc1noc([C@H](C)[NH2+][C@H](C)c2cccnc2)n1 ZINC000361094952 387402007 /nfs/dbraw/zinc/40/20/07/387402007.db2.gz FJMXMXCBSCCZFN-BDAKNGLRSA-N 1 2 232.287 2.185 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](C)c2ccccn2)nc1 ZINC000361149976 387405838 /nfs/dbraw/zinc/40/58/38/387405838.db2.gz XDVPEHDZVXXHSG-NSHDSACASA-N 1 2 228.299 2.031 20 0 BEADLO FC1CN(Cc2cc(-n3cc[nH+]c3)cs2)C1 ZINC000336618724 387460689 /nfs/dbraw/zinc/46/06/89/387460689.db2.gz VLLLKZWGEMREQX-UHFFFAOYSA-N 1 2 237.303 2.088 20 0 BEADLO COC(=O)c1occc1C[NH2+][C@@H]1CCC[C@@H]1F ZINC000354647700 387411276 /nfs/dbraw/zinc/41/12/76/387411276.db2.gz CSNGTBFNBYPTGW-VHSXEESVSA-N 1 2 241.262 2.046 20 0 BEADLO CC(C)(C)OC(=O)NCCCCn1cc[nH+]c1 ZINC000083502399 387411625 /nfs/dbraw/zinc/41/16/25/387411625.db2.gz AAWIYMCEQRIJQB-UHFFFAOYSA-N 1 2 239.319 2.188 20 0 BEADLO C[C@@H]1C[C@@H](C)[C@H](C)N(C(=O)CCn2cc[nH+]c2)C1 ZINC000354702856 387419128 /nfs/dbraw/zinc/41/91/28/387419128.db2.gz GKUSGJSXLJBYGG-UPJWGTAASA-N 1 2 249.358 2.166 20 0 BEADLO COC(=O)Cc1cccc(NCC(C)(C)C)[nH+]1 ZINC000191601536 387494317 /nfs/dbraw/zinc/49/43/17/387494317.db2.gz XKABGAUMEZKDQL-UHFFFAOYSA-N 1 2 236.315 2.255 20 0 BEADLO CCN(CCC1CC1)C(=O)Nc1cc[nH+]cc1C ZINC000355189630 387494741 /nfs/dbraw/zinc/49/47/41/387494741.db2.gz NXBQSIFUAZDQKL-UHFFFAOYSA-N 1 2 247.342 2.466 20 0 BEADLO CCc1cc(NCCOCC(F)(F)F)nc[nH+]1 ZINC000104450046 387495271 /nfs/dbraw/zinc/49/52/71/387495271.db2.gz WWQHFVIYDFBMGB-UHFFFAOYSA-N 1 2 249.236 2.030 20 0 BEADLO Cc1nc(C)c(NCCCn2cc[nH+]c2)nc1C ZINC000396869506 387504796 /nfs/dbraw/zinc/50/47/96/387504796.db2.gz WUKMXRKMFNMZOD-UHFFFAOYSA-N 1 2 245.330 2.101 20 0 BEADLO CCc1noc(C)c1C[N@@H+]1C[C@@H](C)OC[C@@H]1C ZINC000162751406 387514490 /nfs/dbraw/zinc/51/44/90/387514490.db2.gz NIHHKQGPTHYHKD-VHSXEESVSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1noc(C)c1C[N@H+]1C[C@@H](C)OC[C@@H]1C ZINC000162751406 387514492 /nfs/dbraw/zinc/51/44/92/387514492.db2.gz NIHHKQGPTHYHKD-VHSXEESVSA-N 1 2 238.331 2.155 20 0 BEADLO CC[C@H](NCc1c[nH+]c2ccccn12)C(F)F ZINC000648619196 387583270 /nfs/dbraw/zinc/58/32/70/387583270.db2.gz ATVZREZNKBXLMW-JTQLQIEISA-N 1 2 239.269 2.468 20 0 BEADLO CC[C@H]([NH2+]Cc1cnc2ccccn12)C(F)F ZINC000648619196 387583273 /nfs/dbraw/zinc/58/32/73/387583273.db2.gz ATVZREZNKBXLMW-JTQLQIEISA-N 1 2 239.269 2.468 20 0 BEADLO c1cn(CCNc2nc3ccccc3o2)c[nH+]1 ZINC000041065939 387589064 /nfs/dbraw/zinc/58/90/64/387589064.db2.gz DHJLNWGFJFJBDN-UHFFFAOYSA-N 1 2 228.255 2.136 20 0 BEADLO CN(C[C@@H]1CC=CCC1)C(=O)CCc1[nH]cc[nH+]1 ZINC000355917634 387594912 /nfs/dbraw/zinc/59/49/12/387594912.db2.gz YQTZRKUXDULQNR-GFCCVEGCSA-N 1 2 247.342 2.157 20 0 BEADLO CC[C@@H](C)CCC(=O)N1CCn2cc(C)[nH+]c2C1 ZINC000376050106 387602909 /nfs/dbraw/zinc/60/29/09/387602909.db2.gz JMDCHJFPKCZBQO-LLVKDONJSA-N 1 2 249.358 2.360 20 0 BEADLO Cc1cc(C[N@@H+]2CCC=C(F)C2)ccn1 ZINC000527538747 387605580 /nfs/dbraw/zinc/60/55/80/387605580.db2.gz LPZZSYDMNDJNQV-UHFFFAOYSA-N 1 2 206.264 2.449 20 0 BEADLO Cc1cc(C[N@H+]2CCC=C(F)C2)ccn1 ZINC000527538747 387605584 /nfs/dbraw/zinc/60/55/84/387605584.db2.gz LPZZSYDMNDJNQV-UHFFFAOYSA-N 1 2 206.264 2.449 20 0 BEADLO CCSCC[C@H](C)[N@H+](C)Cc1noc(C)n1 ZINC000362456452 387613417 /nfs/dbraw/zinc/61/34/17/387613417.db2.gz VWUGAHIMGNBXLD-VIFPVBQESA-N 1 2 243.376 2.342 20 0 BEADLO CCSCC[C@H](C)[N@@H+](C)Cc1noc(C)n1 ZINC000362456452 387613420 /nfs/dbraw/zinc/61/34/20/387613420.db2.gz VWUGAHIMGNBXLD-VIFPVBQESA-N 1 2 243.376 2.342 20 0 BEADLO Cc1ccc(NCc2c[nH]c3nccnc23)c[nH+]1 ZINC000356088861 387615546 /nfs/dbraw/zinc/61/55/46/387615546.db2.gz CMXJNZNHKSVEDG-UHFFFAOYSA-N 1 2 239.282 2.225 20 0 BEADLO Cc1ccncc1C[NH2+]Cc1ncccc1F ZINC000527240083 387547614 /nfs/dbraw/zinc/54/76/14/387547614.db2.gz IVYYSUCVOHVLGQ-UHFFFAOYSA-N 1 2 231.274 2.214 20 0 BEADLO CSCCC[N@@H+]1CCOC[C@H]1c1ccco1 ZINC000361941490 387554028 /nfs/dbraw/zinc/55/40/28/387554028.db2.gz DRMSWBYKLOPNTM-NSHDSACASA-N 1 2 241.356 2.406 20 0 BEADLO CSCCC[N@H+]1CCOC[C@H]1c1ccco1 ZINC000361941490 387554031 /nfs/dbraw/zinc/55/40/31/387554031.db2.gz DRMSWBYKLOPNTM-NSHDSACASA-N 1 2 241.356 2.406 20 0 BEADLO CCCC(=O)N1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000119372962 387554700 /nfs/dbraw/zinc/55/47/00/387554700.db2.gz XMAYHHZTIYVXNT-GFCCVEGCSA-N 1 2 249.358 2.001 20 0 BEADLO CCc1cc(N)nc(SCC(F)(F)F)[nH+]1 ZINC000279120038 387561361 /nfs/dbraw/zinc/56/13/61/387561361.db2.gz UIVRKMOZPXYTPA-UHFFFAOYSA-N 1 2 237.250 2.276 20 0 BEADLO Cc1nc(C[N@@H+](C)CC2=CCCOC2)cs1 ZINC000125060713 387640842 /nfs/dbraw/zinc/64/08/42/387640842.db2.gz HAMQSPAMOCIGLD-UHFFFAOYSA-N 1 2 238.356 2.230 20 0 BEADLO Cc1nc(C[N@H+](C)CC2=CCCOC2)cs1 ZINC000125060713 387640847 /nfs/dbraw/zinc/64/08/47/387640847.db2.gz HAMQSPAMOCIGLD-UHFFFAOYSA-N 1 2 238.356 2.230 20 0 BEADLO Clc1cncc(N2CCC[C@@H]2c2[nH]cc[nH+]2)n1 ZINC000377144915 387695030 /nfs/dbraw/zinc/69/50/30/387695030.db2.gz MKLSVDHOAOJOED-MRVPVSSYSA-N 1 2 249.705 2.195 20 0 BEADLO CC[C@H](Nc1cc(C)ncn1)c1[nH]cc[nH+]1 ZINC000125215493 387645177 /nfs/dbraw/zinc/64/51/77/387645177.db2.gz KISOBOBISHGOSB-VIFPVBQESA-N 1 2 217.276 2.071 20 0 BEADLO CC(C)CC(=O)N1CC[C@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000125579013 387660933 /nfs/dbraw/zinc/66/09/33/387660933.db2.gz SAHZZSJOYLQGIY-QWHCGFSZSA-N 1 2 249.358 2.339 20 0 BEADLO C[C@@H]1C[C@H]1CC(=O)N[C@H](c1[nH+]ccn1C)C1CC1 ZINC000356498448 387665243 /nfs/dbraw/zinc/66/52/43/387665243.db2.gz RMDSGBPGWQSCHS-CDMKHQONSA-N 1 2 247.342 2.034 20 0 BEADLO Cn1c2cc(F)ccc2[nH]c1=[NH+]C1CCCC1 ZINC000431037063 387673202 /nfs/dbraw/zinc/67/32/02/387673202.db2.gz LDAODHGMBQRZFN-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO C[C@H](CC(C)(C)C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000356594072 387679188 /nfs/dbraw/zinc/67/91/88/387679188.db2.gz JDUHRCGIRRMYPO-SNVBAGLBSA-N 1 2 237.347 2.440 20 0 BEADLO CC(C)C(C)(C)[S@](=O)Cc1[nH+]ccn1C ZINC000431198448 387684250 /nfs/dbraw/zinc/68/42/50/387684250.db2.gz OKJWVFZSOZBWSL-OAHLLOKOSA-N 1 2 228.361 2.103 20 0 BEADLO Cc1nc(N2CC3(C2)CCCOC3)c(C)c(C)[nH+]1 ZINC000377141081 387691309 /nfs/dbraw/zinc/69/13/09/387691309.db2.gz MRKIHASLGFWBGT-UHFFFAOYSA-N 1 2 247.342 2.019 20 0 BEADLO CC[C@@H](F)C[N@H+](C)[C@@H](C)C(=O)OC(C)(C)C ZINC000440776230 387691676 /nfs/dbraw/zinc/69/16/76/387691676.db2.gz BRUJBFGKMFAZHO-VHSXEESVSA-N 1 2 233.327 2.397 20 0 BEADLO CC[C@@H](F)C[N@@H+](C)[C@@H](C)C(=O)OC(C)(C)C ZINC000440776230 387691687 /nfs/dbraw/zinc/69/16/87/387691687.db2.gz BRUJBFGKMFAZHO-VHSXEESVSA-N 1 2 233.327 2.397 20 0 BEADLO Cc1cnn(C)c1C[NH2+][C@@H](C)c1ncccc1F ZINC000527827633 387748888 /nfs/dbraw/zinc/74/88/88/387748888.db2.gz HKZWDWSHSDNWTI-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCN(C[C@@H](F)CC)[C@@H](C)C1 ZINC000440788690 387700524 /nfs/dbraw/zinc/70/05/24/387700524.db2.gz ZXLIGMBOLTUARW-XQQFMLRXSA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCN(C[C@@H](F)CC)[C@@H](C)C1 ZINC000440788690 387700528 /nfs/dbraw/zinc/70/05/28/387700528.db2.gz ZXLIGMBOLTUARW-XQQFMLRXSA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@@H](F)CN1CC[N@H+](C[C@@H](F)CC)[C@@H](C)C1 ZINC000440788690 387700531 /nfs/dbraw/zinc/70/05/31/387700531.db2.gz ZXLIGMBOLTUARW-XQQFMLRXSA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@@H](F)CN1CC[N@@H+](C[C@@H](F)CC)[C@@H](C)C1 ZINC000440788690 387700534 /nfs/dbraw/zinc/70/05/34/387700534.db2.gz ZXLIGMBOLTUARW-XQQFMLRXSA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@H](F)C[N@@H+]1C[C@@H](C)N(CC)C[C@H]1C ZINC000440790285 387700605 /nfs/dbraw/zinc/70/06/05/387700605.db2.gz KKWDGQLPJRDZAQ-UTUOFQBUSA-N 1 2 216.344 2.149 20 0 BEADLO CC[C@H](F)C[N@H+]1C[C@@H](C)N(CC)C[C@H]1C ZINC000440790285 387700612 /nfs/dbraw/zinc/70/06/12/387700612.db2.gz KKWDGQLPJRDZAQ-UTUOFQBUSA-N 1 2 216.344 2.149 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCN(C[C@@H](F)CC)[C@H](C)C1 ZINC000440798169 387706154 /nfs/dbraw/zinc/70/61/54/387706154.db2.gz ZXLIGMBOLTUARW-UPJWGTAASA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCN(C[C@@H](F)CC)[C@H](C)C1 ZINC000440798169 387706159 /nfs/dbraw/zinc/70/61/59/387706159.db2.gz ZXLIGMBOLTUARW-UPJWGTAASA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@@H](F)CN1CC[N@H+](C[C@@H](F)CC)[C@H](C)C1 ZINC000440798169 387706162 /nfs/dbraw/zinc/70/61/62/387706162.db2.gz ZXLIGMBOLTUARW-UPJWGTAASA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@@H](F)CN1CC[N@@H+](C[C@@H](F)CC)[C@H](C)C1 ZINC000440798169 387706167 /nfs/dbraw/zinc/70/61/67/387706167.db2.gz ZXLIGMBOLTUARW-UPJWGTAASA-N 1 2 248.361 2.489 20 0 BEADLO C[C@H]1CC[C@H]1[NH+]=c1[nH]c2ccc(F)cc2n1C ZINC000431414997 387708910 /nfs/dbraw/zinc/70/89/10/387708910.db2.gz PKGVDYAQWWMUBI-WCBMZHEXSA-N 1 2 233.290 2.345 20 0 BEADLO CC[C@H](O)CCNc1cc(C)[nH+]c(C(C)C)n1 ZINC000127260634 387709336 /nfs/dbraw/zinc/70/93/36/387709336.db2.gz DPZSZFWQMMTYMX-NSHDSACASA-N 1 2 237.347 2.481 20 0 BEADLO c1cc(OCc2ccc3c(c2)OCCO3)cc[nH+]1 ZINC000431497392 387714222 /nfs/dbraw/zinc/71/42/22/387714222.db2.gz XEOTXGBMRTVWOW-UHFFFAOYSA-N 1 2 243.262 2.432 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@H](C3CC3)C2)no1 ZINC000377522214 387722518 /nfs/dbraw/zinc/72/25/18/387722518.db2.gz CXEDOGQJIRIAHN-NSHDSACASA-N 1 2 235.331 2.254 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@H](C3CC3)C2)no1 ZINC000377522214 387722525 /nfs/dbraw/zinc/72/25/25/387722525.db2.gz CXEDOGQJIRIAHN-NSHDSACASA-N 1 2 235.331 2.254 20 0 BEADLO Cn1ccnc1C[NH2+]C1(c2ccc(F)cc2)CC1 ZINC000356864496 387736685 /nfs/dbraw/zinc/73/66/85/387736685.db2.gz GMVJWCDNAUENNY-UHFFFAOYSA-N 1 2 245.301 2.338 20 0 BEADLO COc1ccc[nH+]c1NCCc1c(C)noc1C ZINC000527886851 387772541 /nfs/dbraw/zinc/77/25/41/387772541.db2.gz XPFIRIUEUWFFSD-UHFFFAOYSA-N 1 2 247.298 2.350 20 0 BEADLO COc1ccc[nH+]c1NCCc1ccncc1C ZINC000527940297 387781952 /nfs/dbraw/zinc/78/19/52/387781952.db2.gz WXGJGMQXULJUAR-UHFFFAOYSA-N 1 2 243.310 2.448 20 0 BEADLO c1cnn(-c2ccc(NCc3[nH]cc[nH+]3)cc2)c1 ZINC000049715031 387787374 /nfs/dbraw/zinc/78/73/74/387787374.db2.gz DOQIBVXHNGEFQX-UHFFFAOYSA-N 1 2 239.282 2.208 20 0 BEADLO CC[N@H+](Cc1noc(C(C)C)n1)C(C)C ZINC000193722582 387802792 /nfs/dbraw/zinc/80/27/92/387802792.db2.gz WBOXJIUWGOADGU-UHFFFAOYSA-N 1 2 211.309 2.423 20 0 BEADLO CC[N@@H+](Cc1noc(C(C)C)n1)C(C)C ZINC000193722582 387802796 /nfs/dbraw/zinc/80/27/96/387802796.db2.gz WBOXJIUWGOADGU-UHFFFAOYSA-N 1 2 211.309 2.423 20 0 BEADLO COc1ccc[nH+]c1N1CC(C)=C[C@H](C)C1 ZINC000527994980 387805388 /nfs/dbraw/zinc/80/53/88/387805388.db2.gz KCIGUWYWVLGPCI-JTQLQIEISA-N 1 2 218.300 2.493 20 0 BEADLO COc1ccc[nH+]c1N1CCOCC2(CCC2)C1 ZINC000527960574 387809567 /nfs/dbraw/zinc/80/95/67/387809567.db2.gz CLUZNWKUUMPBSW-UHFFFAOYSA-N 1 2 248.326 2.097 20 0 BEADLO COc1ccc[nH+]c1N(C)Cc1ccoc1 ZINC000527856936 387757140 /nfs/dbraw/zinc/75/71/40/387757140.db2.gz FJALUPHIEMTASF-UHFFFAOYSA-N 1 2 218.256 2.320 20 0 BEADLO CC[C@H]1C[C@@H](C[N@H+](C)CC(F)F)CCO1 ZINC000356985989 387760059 /nfs/dbraw/zinc/76/00/59/387760059.db2.gz IRRDHRSQYBCHBU-UWVGGRQHSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@H]1C[C@@H](C[N@@H+](C)CC(F)F)CCO1 ZINC000356985989 387760063 /nfs/dbraw/zinc/76/00/63/387760063.db2.gz IRRDHRSQYBCHBU-UWVGGRQHSA-N 1 2 221.291 2.389 20 0 BEADLO Cc1cc(NCC[C@@H]2CC=CCC2)nc[nH+]1 ZINC000528184183 387873248 /nfs/dbraw/zinc/87/32/48/387873248.db2.gz XSGZBZRAOOFWBL-GFCCVEGCSA-N 1 2 217.316 2.365 20 0 BEADLO C[C@@H](O)CCOc1cccc(-n2cc[nH+]c2)c1 ZINC000418886522 387839345 /nfs/dbraw/zinc/83/93/45/387839345.db2.gz RDNZHOGGHQJGNM-LLVKDONJSA-N 1 2 232.283 2.022 20 0 BEADLO O[C@@H]1C[C@H]2CN(c3[nH+]ccc4ccccc43)C[C@@H]12 ZINC000528057380 387839479 /nfs/dbraw/zinc/83/94/79/387839479.db2.gz HFZDWJZDFPUIPP-IACUBPJLSA-N 1 2 240.306 2.052 20 0 BEADLO Cn1cc[nH+]c1CNc1cc(F)c(F)c(F)c1 ZINC000061096111 387841766 /nfs/dbraw/zinc/84/17/66/387841766.db2.gz KYCAAEHSXVJHIV-UHFFFAOYSA-N 1 2 241.216 2.450 20 0 BEADLO c1cn(-c2nccc(Oc3ccccc3)n2)c[nH+]1 ZINC000433025530 387851892 /nfs/dbraw/zinc/85/18/92/387851892.db2.gz LMJPUHFLGKCWGN-UHFFFAOYSA-N 1 2 238.250 2.455 20 0 BEADLO CCO[C@@]1(C)C[C@H]1Nc1cc[nH+]c(C(C)C)n1 ZINC000528152927 387856064 /nfs/dbraw/zinc/85/60/64/387856064.db2.gz AOHXHLLXUBXSEH-MFKMUULPSA-N 1 2 235.331 2.001 20 0 BEADLO CCO[C@@]1(C)C[C@H]1Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000528157478 387858316 /nfs/dbraw/zinc/85/83/16/387858316.db2.gz XAZOBQYEPMDACF-MFKMUULPSA-N 1 2 246.314 2.246 20 0 BEADLO Cc1nc(N[C@@H]2C[C@]2(C)OC(C)C)cc[nH+]1 ZINC000528202932 387868774 /nfs/dbraw/zinc/86/87/74/387868774.db2.gz JVYGWNMFKWHKKJ-PWSUYJOCSA-N 1 2 221.304 2.153 20 0 BEADLO Cc1cc(F)c(CNCC[NH+]2CCC2)c(F)c1 ZINC000424154607 387815377 /nfs/dbraw/zinc/81/53/77/387815377.db2.gz JWOVUEKIEXRBHM-UHFFFAOYSA-N 1 2 240.297 2.069 20 0 BEADLO Cc1nc(NCC[C@H]2CC=CCC2)cc[nH+]1 ZINC000528182383 387872688 /nfs/dbraw/zinc/87/26/88/387872688.db2.gz DWFCBCGPSVZLOR-LBPRGKRZSA-N 1 2 217.316 2.365 20 0 BEADLO C[C@@H](N[C@@H](C)c1ncccc1F)c1[nH+]ccn1C ZINC000528036413 387817665 /nfs/dbraw/zinc/81/76/65/387817665.db2.gz RLXLJXZXQNCROL-VHSXEESVSA-N 1 2 248.305 2.366 20 0 BEADLO Cc1c(NCc2c[nH+]cn2C(C)C)cnn1C ZINC000424179020 387890229 /nfs/dbraw/zinc/89/02/29/387890229.db2.gz SEYBPEBISYFTSV-UHFFFAOYSA-N 1 2 233.319 2.118 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000448709506 387896216 /nfs/dbraw/zinc/89/62/16/387896216.db2.gz PZLPVEQZDFRFNJ-YNEHKIRRSA-N 1 2 249.358 2.070 20 0 BEADLO COC[C@H](Nc1ccc(C)[nH+]c1)C(C)C ZINC000154259646 387897972 /nfs/dbraw/zinc/89/79/72/387897972.db2.gz NMJJQMPWJRBILP-LBPRGKRZSA-N 1 2 208.305 2.473 20 0 BEADLO Cc1ncccc1CNc1cc[nH+]c(C2CC2)n1 ZINC000528184782 387875118 /nfs/dbraw/zinc/87/51/18/387875118.db2.gz DGDHRTAKOTUVML-UHFFFAOYSA-N 1 2 240.310 2.091 20 0 BEADLO C[C@H]1CCC[C@@H](C(=O)Nc2ccc(N)[nH+]c2)C1 ZINC000151669761 387875233 /nfs/dbraw/zinc/87/52/33/387875233.db2.gz WUSSOXLFDHCXPT-VHSXEESVSA-N 1 2 233.315 2.429 20 0 BEADLO CCC[N@H+](C)Cc1nc([C@@H]2CC[C@H](C)O2)no1 ZINC000528227800 387883799 /nfs/dbraw/zinc/88/37/99/387883799.db2.gz AHIKVFVASRJRPF-UWVGGRQHSA-N 1 2 239.319 2.151 20 0 BEADLO CCC[N@@H+](C)Cc1nc([C@@H]2CC[C@H](C)O2)no1 ZINC000528227800 387883803 /nfs/dbraw/zinc/88/38/03/387883803.db2.gz AHIKVFVASRJRPF-UWVGGRQHSA-N 1 2 239.319 2.151 20 0 BEADLO CC[NH+](CC)Cc1nc([C@@H]2CC[C@H](C)O2)no1 ZINC000528234465 387885775 /nfs/dbraw/zinc/88/57/75/387885775.db2.gz KMWYRVRMLSWLAT-UWVGGRQHSA-N 1 2 239.319 2.151 20 0 BEADLO CO[C@@H](Cc1ccc(F)cc1)Cn1cc[nH+]c1 ZINC000528404145 387887796 /nfs/dbraw/zinc/88/77/96/387887796.db2.gz OKSRCVJCRAPBCD-ZDUSSCGKSA-N 1 2 234.274 2.280 20 0 BEADLO FC1=CCC[N@H+](CCO[C@@H]2CCCCO2)C1 ZINC000444667514 387904062 /nfs/dbraw/zinc/90/40/62/387904062.db2.gz AFNMQVRSEPTPJY-GFCCVEGCSA-N 1 2 229.295 2.089 20 0 BEADLO FC1=CCC[N@@H+](CCO[C@@H]2CCCCO2)C1 ZINC000444667514 387904065 /nfs/dbraw/zinc/90/40/65/387904065.db2.gz AFNMQVRSEPTPJY-GFCCVEGCSA-N 1 2 229.295 2.089 20 0 BEADLO FC(F)(F)C[C@@H]1CC[N@H+](Cc2ncccn2)C1 ZINC000444706265 387905455 /nfs/dbraw/zinc/90/54/55/387905455.db2.gz WCBFZGLFEYFZMO-VIFPVBQESA-N 1 2 245.248 2.251 20 0 BEADLO FC(F)(F)C[C@@H]1CC[N@@H+](Cc2ncccn2)C1 ZINC000444706265 387905458 /nfs/dbraw/zinc/90/54/58/387905458.db2.gz WCBFZGLFEYFZMO-VIFPVBQESA-N 1 2 245.248 2.251 20 0 BEADLO CC[C@@H]1C[C@H]1CNC(=O)c1ccc2[nH+]ccn2c1 ZINC000452770828 387912512 /nfs/dbraw/zinc/91/25/12/387912512.db2.gz FFFPFSZOXKFRET-PWSUYJOCSA-N 1 2 243.310 2.110 20 0 BEADLO Cc1csc(C[N@H+]2C[C@H](C)O[C@H](C)[C@H]2C)n1 ZINC000438350102 387923590 /nfs/dbraw/zinc/92/35/90/387923590.db2.gz DIZQNGZWUFLTOY-HBNTYKKESA-N 1 2 240.372 2.449 20 0 BEADLO Cc1csc(C[N@@H+]2C[C@H](C)O[C@H](C)[C@H]2C)n1 ZINC000438350102 387923600 /nfs/dbraw/zinc/92/36/00/387923600.db2.gz DIZQNGZWUFLTOY-HBNTYKKESA-N 1 2 240.372 2.449 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nccs2)[C@H](C)[C@@H](C)O1 ZINC000438359281 387927947 /nfs/dbraw/zinc/92/79/47/387927947.db2.gz PWNLTDVLWSVYAD-OPRDCNLKSA-N 1 2 226.345 2.141 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nccs2)[C@H](C)[C@@H](C)O1 ZINC000438359281 387927950 /nfs/dbraw/zinc/92/79/50/387927950.db2.gz PWNLTDVLWSVYAD-OPRDCNLKSA-N 1 2 226.345 2.141 20 0 BEADLO CN(CCCCCO)c1[nH+]c2ccccc2n1C ZINC000227110555 387953340 /nfs/dbraw/zinc/95/33/40/387953340.db2.gz IYUJQGZIAKSDTR-UHFFFAOYSA-N 1 2 247.342 2.172 20 0 BEADLO COC(=O)[C@H](C)[N@@H+]1C[C@H](C)[C@@H]1c1ccccc1 ZINC000245431311 387945985 /nfs/dbraw/zinc/94/59/85/387945985.db2.gz NYMYSHKKOFDPQR-GMXVVIOVSA-N 1 2 233.311 2.241 20 0 BEADLO COC(=O)[C@H](C)[N@H+]1C[C@H](C)[C@@H]1c1ccccc1 ZINC000245431311 387945992 /nfs/dbraw/zinc/94/59/92/387945992.db2.gz NYMYSHKKOFDPQR-GMXVVIOVSA-N 1 2 233.311 2.241 20 0 BEADLO CC(C)[C@H](NC(=O)Cc1ccco1)c1[nH]cc[nH+]1 ZINC000283012800 387949937 /nfs/dbraw/zinc/94/99/37/387949937.db2.gz MYLHQDDHZGRESX-LBPRGKRZSA-N 1 2 247.298 2.059 20 0 BEADLO Cc1ncsc1C[N@H+]1C[C@@H](C)OC[C@H]1C ZINC000245546813 387958635 /nfs/dbraw/zinc/95/86/35/387958635.db2.gz VVFSMJUMUCLYKZ-RKDXNWHRSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ncsc1C[N@@H+]1C[C@@H](C)OC[C@H]1C ZINC000245546813 387958639 /nfs/dbraw/zinc/95/86/39/387958639.db2.gz VVFSMJUMUCLYKZ-RKDXNWHRSA-N 1 2 226.345 2.061 20 0 BEADLO CC(C)Cn1ccnc1C[NH2+][C@@H](C)c1cn[nH]c1 ZINC000438830206 387958794 /nfs/dbraw/zinc/95/87/94/387958794.db2.gz NCKZVVYLPWRYFN-NSHDSACASA-N 1 2 247.346 2.113 20 0 BEADLO C[C@H](c1ccccc1)[C@H](O)C[N@H+](C)CC(F)F ZINC000450352232 387956846 /nfs/dbraw/zinc/95/68/46/387956846.db2.gz BNZWXUAVUZKOFP-ZYHUDNBSSA-N 1 2 243.297 2.348 20 0 BEADLO C[C@H](c1ccccc1)[C@H](O)C[N@@H+](C)CC(F)F ZINC000450352232 387956853 /nfs/dbraw/zinc/95/68/53/387956853.db2.gz BNZWXUAVUZKOFP-ZYHUDNBSSA-N 1 2 243.297 2.348 20 0 BEADLO CC[C@@H]([NH2+][C@@H](C)C(F)(F)F)[C@@H]1CCOC1 ZINC000424334655 387979057 /nfs/dbraw/zinc/97/90/57/387979057.db2.gz YXRRZJRIKGWTKO-DJLDLDEBSA-N 1 2 225.254 2.342 20 0 BEADLO CC[C@@H](C)[NH2+][C@@H](c1cn[nH]n1)c1ccc(F)cc1 ZINC000453056853 387975479 /nfs/dbraw/zinc/97/54/79/387975479.db2.gz LVRXTHCLZXFWMW-NOZJJQNGSA-N 1 2 248.305 2.421 20 0 BEADLO CC[C@@H](C)[NH2+][C@@H](c1c[nH]nn1)c1ccc(F)cc1 ZINC000453056853 387975482 /nfs/dbraw/zinc/97/54/82/387975482.db2.gz LVRXTHCLZXFWMW-NOZJJQNGSA-N 1 2 248.305 2.421 20 0 BEADLO CC[N@H+](Cc1nc(C(C)C)no1)C1CC1 ZINC000045771085 387993935 /nfs/dbraw/zinc/99/39/35/387993935.db2.gz GVKYLOCALLMPBJ-UHFFFAOYSA-N 1 2 209.293 2.177 20 0 BEADLO CC[N@@H+](Cc1nc(C(C)C)no1)C1CC1 ZINC000045771085 387993939 /nfs/dbraw/zinc/99/39/39/387993939.db2.gz GVKYLOCALLMPBJ-UHFFFAOYSA-N 1 2 209.293 2.177 20 0 BEADLO Cc1ncsc1C[N@H+]1CCO[C@@H](C)[C@H]1C ZINC000245782582 387981898 /nfs/dbraw/zinc/98/18/98/387981898.db2.gz UMMOSZIQGZJNLO-ZJUUUORDSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ncsc1C[N@@H+]1CCO[C@@H](C)[C@H]1C ZINC000245782582 387981903 /nfs/dbraw/zinc/98/19/03/387981903.db2.gz UMMOSZIQGZJNLO-ZJUUUORDSA-N 1 2 226.345 2.061 20 0 BEADLO CO[C@H](C)[C@@H](C)Nc1ccc2c(c1)CC[NH2+]2 ZINC000423214211 387996925 /nfs/dbraw/zinc/99/69/25/387996925.db2.gz KYWBXKYZUDONIT-NXEZZACHSA-N 1 2 220.316 2.490 20 0 BEADLO CC(C)CCc1csc([C@@H]2COCC[NH2+]2)n1 ZINC000446136407 388003179 /nfs/dbraw/zinc/00/31/79/388003179.db2.gz KETIYYGVLBSCDK-NSHDSACASA-N 1 2 240.372 2.393 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1nnc(C2CC2)n1C1CC1 ZINC000548754611 388009605 /nfs/dbraw/zinc/00/96/05/388009605.db2.gz AYOFVANKICTVLS-NXEZZACHSA-N 1 2 246.358 2.473 20 0 BEADLO Cc1cc(Nc2ccc3c(c2)[nH+]cn3C)ncn1 ZINC000439695318 388012328 /nfs/dbraw/zinc/01/23/28/388012328.db2.gz KURKRFCKMJYCPW-UHFFFAOYSA-N 1 2 239.282 2.415 20 0 BEADLO CC[C@H]([NH2+][C@@H](C)c1ccnn1C)C(F)F ZINC000453243639 388012870 /nfs/dbraw/zinc/01/28/70/388012870.db2.gz JAKRNFNHDXCZCQ-YUMQZZPRSA-N 1 2 217.263 2.114 20 0 BEADLO CC[C@@H]([NH2+][C@H](C)c1cn[nH]c1)C(F)F ZINC000453227714 388016348 /nfs/dbraw/zinc/01/63/48/388016348.db2.gz BGDIRMPTCSRWNE-HTRCEHHLSA-N 1 2 203.236 2.104 20 0 BEADLO Cc1[nH]c2ccc(NC(=O)c3ccc[nH]3)cc2[nH+]1 ZINC000082277607 388020562 /nfs/dbraw/zinc/02/05/62/388020562.db2.gz NWIGKPYCQPMNRU-UHFFFAOYSA-N 1 2 240.266 2.452 20 0 BEADLO Cc1[nH]c2cc(NC(=O)c3ccc[nH]3)ccc2[nH+]1 ZINC000082277607 388020566 /nfs/dbraw/zinc/02/05/66/388020566.db2.gz NWIGKPYCQPMNRU-UHFFFAOYSA-N 1 2 240.266 2.452 20 0 BEADLO CCC1(CC)CC[N@H+](Cc2noc(C)n2)C1 ZINC000446735879 388034857 /nfs/dbraw/zinc/03/48/57/388034857.db2.gz QXNYZEJGBDXXLL-UHFFFAOYSA-N 1 2 223.320 2.390 20 0 BEADLO CCC1(CC)CC[N@@H+](Cc2noc(C)n2)C1 ZINC000446735879 388034861 /nfs/dbraw/zinc/03/48/61/388034861.db2.gz QXNYZEJGBDXXLL-UHFFFAOYSA-N 1 2 223.320 2.390 20 0 BEADLO CC[C@H]1C[NH+](Cc2ccc(C)nn2)C[C@H](CC)O1 ZINC000421390250 388029419 /nfs/dbraw/zinc/02/94/19/388029419.db2.gz NRKGVXQUGCDIQO-KBPBESRZSA-N 1 2 249.358 2.174 20 0 BEADLO CC(C)c1nc(N2CCC[C@H]([C@H](C)O)C2)cc[nH+]1 ZINC000533330390 388051495 /nfs/dbraw/zinc/05/14/95/388051495.db2.gz PKVROEUTVWEYKJ-RYUDHWBXSA-N 1 2 249.358 2.197 20 0 BEADLO Cc1cc(N2CC(C)(C)O[C@@H]3CCC[C@H]32)nc[nH+]1 ZINC000440543321 388052306 /nfs/dbraw/zinc/05/23/06/388052306.db2.gz BBJLPXUBKZIYJP-VXGBXAGGSA-N 1 2 247.342 2.321 20 0 BEADLO COc1ccc(C[NH2+][C@@H](C)c2nccs2)cn1 ZINC000086508157 388104253 /nfs/dbraw/zinc/10/42/53/388104253.db2.gz SDKFOHKHONXZDJ-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO FC(F)C[N@@H+]1CC[C@@H](c2cccnc2)C1 ZINC000645982249 388115970 /nfs/dbraw/zinc/11/59/70/388115970.db2.gz SDMQKNXVFHFWBL-SNVBAGLBSA-N 1 2 212.243 2.136 20 0 BEADLO FC(F)C[N@H+]1CC[C@@H](c2cccnc2)C1 ZINC000645982249 388115971 /nfs/dbraw/zinc/11/59/71/388115971.db2.gz SDMQKNXVFHFWBL-SNVBAGLBSA-N 1 2 212.243 2.136 20 0 BEADLO Cc1cc(C)c(CNC(=O)NCC2CCC2)c[nH+]1 ZINC000454269528 388111213 /nfs/dbraw/zinc/11/12/13/388111213.db2.gz VKELWXNNFQTRCT-UHFFFAOYSA-N 1 2 247.342 2.298 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+](C[C@@H](F)CC)C1CC1 ZINC000440512670 388047580 /nfs/dbraw/zinc/04/75/80/388047580.db2.gz NIATVKDLZLPVPD-UWVGGRQHSA-N 1 2 231.311 2.151 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+](C[C@@H](F)CC)C1CC1 ZINC000440512670 388047583 /nfs/dbraw/zinc/04/75/83/388047583.db2.gz NIATVKDLZLPVPD-UWVGGRQHSA-N 1 2 231.311 2.151 20 0 BEADLO CC/C=C\CNC(=O)NCc1c[nH+]c(C)cc1C ZINC000455316555 388155674 /nfs/dbraw/zinc/15/56/74/388155674.db2.gz DMMNXYWIFYCDGQ-WAYWQWQTSA-N 1 2 247.342 2.464 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ccnc(C)n2)nc1 ZINC000646173281 388159601 /nfs/dbraw/zinc/15/96/01/388159601.db2.gz BTXJDSYVNTUWMZ-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ccnc(C)n2)nc1 ZINC000646173281 388159602 /nfs/dbraw/zinc/15/96/02/388159602.db2.gz BTXJDSYVNTUWMZ-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cc(NC(=O)C2=CC[C@H](C)CC2)cc[nH+]1 ZINC000455642117 388165998 /nfs/dbraw/zinc/16/59/98/388165998.db2.gz MBFRWYKBYHOIAG-JTQLQIEISA-N 1 2 230.311 2.497 20 0 BEADLO Cc1nc(N2CCCC[C@H]2c2ncc[nH]2)cc[nH+]1 ZINC000152233472 388177795 /nfs/dbraw/zinc/17/77/95/388177795.db2.gz XISBNOVMJPKZHU-NSHDSACASA-N 1 2 243.314 2.240 20 0 BEADLO CC[C@H]([NH2+]Cc1c[nH]c2nccnc12)C(F)F ZINC000449357107 388181030 /nfs/dbraw/zinc/18/10/30/388181030.db2.gz BMVRUNOKVDRATN-QMMMGPOBSA-N 1 2 240.257 2.043 20 0 BEADLO CCCn1cc(C[NH2+][C@@H](CC)C(F)F)cn1 ZINC000449357387 388181867 /nfs/dbraw/zinc/18/18/67/388181867.db2.gz CUMRNMBBJGFTBH-JTQLQIEISA-N 1 2 231.290 2.426 20 0 BEADLO Cc1ccsc1C[NH2+]C(CF)CF ZINC000449372857 388184788 /nfs/dbraw/zinc/18/47/88/388184788.db2.gz LSEIFRFZYOCQTQ-UHFFFAOYSA-N 1 2 205.273 2.454 20 0 BEADLO CCOc1ccccc1C[NH2+]C(CF)CF ZINC000449372673 388185173 /nfs/dbraw/zinc/18/51/73/388185173.db2.gz KNAPACKWUKLLMP-UHFFFAOYSA-N 1 2 229.270 2.483 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)N(C)Cc2[nH]cc[nH+]2)C[C@@H]1C ZINC000448935981 388121151 /nfs/dbraw/zinc/12/11/51/388121151.db2.gz KRLFURVULMAVPX-WOPDTQHZSA-N 1 2 249.358 2.440 20 0 BEADLO Cc1nc(NC(C2CCC2)C2CCC2)nc(N)[nH+]1 ZINC000324943576 388127940 /nfs/dbraw/zinc/12/79/40/388127940.db2.gz ZUPHTGNVSLAKJI-UHFFFAOYSA-N 1 2 247.346 2.143 20 0 BEADLO Cc1nc(N)nc(NC(C2CCC2)C2CCC2)[nH+]1 ZINC000324943576 388127941 /nfs/dbraw/zinc/12/79/41/388127941.db2.gz ZUPHTGNVSLAKJI-UHFFFAOYSA-N 1 2 247.346 2.143 20 0 BEADLO FCC(CF)[NH2+]Cc1cc2cccnc2o1 ZINC000449377986 388186833 /nfs/dbraw/zinc/18/68/33/388186833.db2.gz CEVNOVBSWMQEAY-UHFFFAOYSA-N 1 2 226.226 2.225 20 0 BEADLO CC(C)OC(=O)[C@H](C)[NH2+][C@H](C)Cc1ccoc1 ZINC000449659393 388249886 /nfs/dbraw/zinc/24/98/86/388249886.db2.gz BFFCXIOJOBFQGI-MNOVXSKESA-N 1 2 239.315 2.140 20 0 BEADLO COc1cccc(C[N@@H+]2CC[C@H](F)C2)c1OC ZINC000449389795 388191575 /nfs/dbraw/zinc/19/15/75/388191575.db2.gz UBVDKYHVBFHNBO-NSHDSACASA-N 1 2 239.290 2.248 20 0 BEADLO COc1cccc(C[N@H+]2CC[C@H](F)C2)c1OC ZINC000449389795 388191578 /nfs/dbraw/zinc/19/15/78/388191578.db2.gz UBVDKYHVBFHNBO-NSHDSACASA-N 1 2 239.290 2.248 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)c1cccs1 ZINC000456340373 388195739 /nfs/dbraw/zinc/19/57/39/388195739.db2.gz DIJPTLIYKKHKIW-SECBINFHSA-N 1 2 249.339 2.456 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@H](C)C(C)C ZINC000456344962 388195743 /nfs/dbraw/zinc/19/57/43/388195743.db2.gz GEURYRPVAMEZEJ-MNOVXSKESA-N 1 2 237.347 2.372 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)C1CCCC1 ZINC000456344588 388195772 /nfs/dbraw/zinc/19/57/72/388195772.db2.gz HGFJYNLFHBPMJQ-SNVBAGLBSA-N 1 2 235.331 2.270 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@H]1C[C@H]1C(C)C ZINC000456349809 388196327 /nfs/dbraw/zinc/19/63/27/388196327.db2.gz JMLDFPAHMXXGPT-SRVKXCTJSA-N 1 2 249.358 2.372 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@@H]1C[C@H]1C(C)C ZINC000456349808 388196892 /nfs/dbraw/zinc/19/68/92/388196892.db2.gz JMLDFPAHMXXGPT-SDDRHHMPSA-N 1 2 249.358 2.372 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@@H]1CC1(C)C ZINC000456361227 388196978 /nfs/dbraw/zinc/19/69/78/388196978.db2.gz RWDLRXHRUSXPLX-UWVGGRQHSA-N 1 2 235.331 2.126 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)c1ccc(C)o1 ZINC000456375360 388198160 /nfs/dbraw/zinc/19/81/60/388198160.db2.gz HANRXNZQOMGJJA-JTQLQIEISA-N 1 2 247.298 2.295 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)c1ccsc1 ZINC000456402214 388199217 /nfs/dbraw/zinc/19/92/17/388199217.db2.gz WELNMAJBTBTLQQ-SECBINFHSA-N 1 2 249.339 2.456 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)c1ccsc1 ZINC000456402216 388199411 /nfs/dbraw/zinc/19/94/11/388199411.db2.gz WELNMAJBTBTLQQ-VIFPVBQESA-N 1 2 249.339 2.456 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456403300 388199660 /nfs/dbraw/zinc/19/96/60/388199660.db2.gz FNLBLUVQZNCQKK-IRCOFANPSA-N 1 2 247.342 2.441 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)[C@H]2C[C@H]2C2CC2)c2[nH+]ccn21 ZINC000456420423 388200138 /nfs/dbraw/zinc/20/01/38/388200138.db2.gz MNFSIMAFIOJZRY-QTKMDUPCSA-N 1 2 245.326 2.051 20 0 BEADLO CC(C)[C@@H]1C[C@@H]1C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456423721 388200231 /nfs/dbraw/zinc/20/02/31/388200231.db2.gz OXOADPHCNLGVQG-NOOOWODRSA-N 1 2 247.342 2.297 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)N[C@@H]2C[C@H](C)n3cc[nH+]c32)C1 ZINC000456437196 388201069 /nfs/dbraw/zinc/20/10/69/388201069.db2.gz WVLSDEDTCNZLJM-NOOOWODRSA-N 1 2 247.342 2.441 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456426855 388201155 /nfs/dbraw/zinc/20/11/55/388201155.db2.gz QRJOOAKRNQXBOR-LNFKQOIKSA-N 1 2 233.315 2.051 20 0 BEADLO CC[N@H+](Cc1cc(F)ccc1F)C1COC1 ZINC000449423191 388201674 /nfs/dbraw/zinc/20/16/74/388201674.db2.gz GWWIFNSFXBWEEF-UHFFFAOYSA-N 1 2 227.254 2.186 20 0 BEADLO CC[N@@H+](Cc1cc(F)ccc1F)C1COC1 ZINC000449423191 388201677 /nfs/dbraw/zinc/20/16/77/388201677.db2.gz GWWIFNSFXBWEEF-UHFFFAOYSA-N 1 2 227.254 2.186 20 0 BEADLO CC[N@H+](Cc1ccc(Cl)o1)C1COC1 ZINC000449424978 388202091 /nfs/dbraw/zinc/20/20/91/388202091.db2.gz LJMSCTLDFBJROE-UHFFFAOYSA-N 1 2 215.680 2.154 20 0 BEADLO CC[N@@H+](Cc1ccc(Cl)o1)C1COC1 ZINC000449424978 388202094 /nfs/dbraw/zinc/20/20/94/388202094.db2.gz LJMSCTLDFBJROE-UHFFFAOYSA-N 1 2 215.680 2.154 20 0 BEADLO CCCn1c(C)nnc1C[N@H+](C)[C@H]1CC1(C)C ZINC000489407183 388211755 /nfs/dbraw/zinc/21/17/55/388211755.db2.gz QRHGIIUXKVHLPQ-NSHDSACASA-N 1 2 236.363 2.227 20 0 BEADLO CCCn1c(C)nnc1C[N@@H+](C)[C@H]1CC1(C)C ZINC000489407183 388211758 /nfs/dbraw/zinc/21/17/58/388211758.db2.gz QRHGIIUXKVHLPQ-NSHDSACASA-N 1 2 236.363 2.227 20 0 BEADLO CC[C@@H](NC(=O)CCn1cc[nH+]c1)C1CCCC1 ZINC000456656334 388213198 /nfs/dbraw/zinc/21/31/98/388213198.db2.gz IZCCCAXNPPSYJG-CYBMUJFWSA-N 1 2 249.358 2.358 20 0 BEADLO CC(C)c1noc(C[N@H+](C)[C@@H]2CC2(C)C)n1 ZINC000489433762 388213353 /nfs/dbraw/zinc/21/33/53/388213353.db2.gz IZVSVPGREUJAQL-SECBINFHSA-N 1 2 223.320 2.423 20 0 BEADLO CC(C)c1noc(C[N@@H+](C)[C@@H]2CC2(C)C)n1 ZINC000489433762 388213356 /nfs/dbraw/zinc/21/33/56/388213356.db2.gz IZVSVPGREUJAQL-SECBINFHSA-N 1 2 223.320 2.423 20 0 BEADLO CC[C@H](NC(=O)Cc1[nH]c[nH+]c1C)C1CCCC1 ZINC000456666013 388213786 /nfs/dbraw/zinc/21/37/86/388213786.db2.gz STGNGFQRKAIFSV-LBPRGKRZSA-N 1 2 249.358 2.346 20 0 BEADLO CC[C@H](NC(=O)Cc1[nH+]c[nH]c1C)C1CCCC1 ZINC000456666013 388213790 /nfs/dbraw/zinc/21/37/90/388213790.db2.gz STGNGFQRKAIFSV-LBPRGKRZSA-N 1 2 249.358 2.346 20 0 BEADLO CC(C)Cn1ncnc1C[N@H+](C)[C@@H]1CC1(C)C ZINC000489496953 388218221 /nfs/dbraw/zinc/21/82/21/388218221.db2.gz NIRFNEUGNODPJZ-LLVKDONJSA-N 1 2 236.363 2.164 20 0 BEADLO CC(C)Cn1ncnc1C[N@@H+](C)[C@@H]1CC1(C)C ZINC000489496953 388218222 /nfs/dbraw/zinc/21/82/22/388218222.db2.gz NIRFNEUGNODPJZ-LLVKDONJSA-N 1 2 236.363 2.164 20 0 BEADLO CC(C)OC(=O)[C@@H]([NH2+]Cc1cc[nH]c1)C(C)C ZINC000449498947 388219811 /nfs/dbraw/zinc/21/98/11/388219811.db2.gz BVXRADCDJMQJSR-LBPRGKRZSA-N 1 2 238.331 2.081 20 0 BEADLO c1snnc1C[N@@H+]1C[C@@H](C2CC2)[C@H]1C1CC1 ZINC000449531369 388224904 /nfs/dbraw/zinc/22/49/04/388224904.db2.gz BPILDQAWKDHBNU-NWDGAFQWSA-N 1 2 235.356 2.159 20 0 BEADLO c1snnc1C[N@H+]1C[C@@H](C2CC2)[C@H]1C1CC1 ZINC000449531369 388224906 /nfs/dbraw/zinc/22/49/06/388224906.db2.gz BPILDQAWKDHBNU-NWDGAFQWSA-N 1 2 235.356 2.159 20 0 BEADLO Cc1nc(N2CCC[C@@H](OCC3CC3)C2)cc[nH+]1 ZINC000489935986 388228630 /nfs/dbraw/zinc/22/86/30/388228630.db2.gz XBWBULJZFPAMKP-CYBMUJFWSA-N 1 2 247.342 2.180 20 0 BEADLO CCCCC[N@H+](C)Cc1ncnn1CC(F)F ZINC000490103074 388235726 /nfs/dbraw/zinc/23/57/26/388235726.db2.gz LTGNHXYYOZAZJN-UHFFFAOYSA-N 1 2 246.305 2.165 20 0 BEADLO CCCCC[N@@H+](C)Cc1ncnn1CC(F)F ZINC000490103074 388235729 /nfs/dbraw/zinc/23/57/29/388235729.db2.gz LTGNHXYYOZAZJN-UHFFFAOYSA-N 1 2 246.305 2.165 20 0 BEADLO Cc1[nH]c(CNc2ccc(CCO)cc2)[nH+]c1C ZINC000521372018 256518819 /nfs/dbraw/zinc/51/88/19/256518819.db2.gz UNKBFAQYCBHXMZ-UHFFFAOYSA-N 1 2 245.326 2.173 20 0 BEADLO C/C=C/C=C\C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000491462168 388296398 /nfs/dbraw/zinc/29/63/98/388296398.db2.gz FIUBIOAHEJUWFF-FBKDILCMSA-N 1 2 245.326 2.248 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)/C=C\c1ccsc1 ZINC000491625363 388305736 /nfs/dbraw/zinc/30/57/36/388305736.db2.gz BYPMPMQZOUPBQH-IHWYPQMZSA-N 1 2 247.323 2.143 20 0 BEADLO O=C(/C=C\C1CC1)N1CCC(n2cc[nH+]c2)CC1 ZINC000491907475 388327075 /nfs/dbraw/zinc/32/70/75/388327075.db2.gz UIXRRANNLHRBCL-ARJAWSKDSA-N 1 2 245.326 2.013 20 0 BEADLO C/C=C/C=C\C(=O)Nc1cccc2[nH+]ccn21 ZINC000491906367 388327157 /nfs/dbraw/zinc/32/71/57/388327157.db2.gz QRDXHVCURFRLHG-HOJFPOIOSA-N 1 2 227.267 2.405 20 0 BEADLO CC[C@@H](C)N(C)C(=O)/C=C\c1[nH+]ccn1CC ZINC000492301013 388340546 /nfs/dbraw/zinc/34/05/46/388340546.db2.gz SNLHMSMBLUFPAD-SKVAFPRGSA-N 1 2 235.331 2.173 20 0 BEADLO C/C=C(/C=C/C(=O)N(C)Cc1[nH+]ccn1C)CC ZINC000492301328 388340811 /nfs/dbraw/zinc/34/08/11/388340811.db2.gz LZAPKVAALHHYAP-FUSVFIKZSA-N 1 2 247.342 2.291 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ncn(C)n1)c1ccc(F)cc1 ZINC000275617978 388344835 /nfs/dbraw/zinc/34/48/35/388344835.db2.gz KRURIWUTXXBYKB-ZJUUUORDSA-N 1 2 248.305 2.366 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ncn(C)n1)c1ccccc1 ZINC000275598860 388345079 /nfs/dbraw/zinc/34/50/79/388345079.db2.gz IZRAHRFYFDTMTQ-MNOVXSKESA-N 1 2 230.315 2.227 20 0 BEADLO CCc1ccc(C[NH2+][C@@H](C)c2ncn(C)n2)cc1 ZINC000275852994 388345692 /nfs/dbraw/zinc/34/56/92/388345692.db2.gz RXJQHWNYHORBCJ-NSHDSACASA-N 1 2 244.342 2.228 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ncn(C)n1)c1ccsc1 ZINC000275706000 388345881 /nfs/dbraw/zinc/34/58/81/388345881.db2.gz LPDMAPUUGVQABY-IUCAKERBSA-N 1 2 236.344 2.288 20 0 BEADLO CCC(CC)N(C(=O)CCn1cc[nH+]c1)C1CC1 ZINC000524255485 388353014 /nfs/dbraw/zinc/35/30/14/388353014.db2.gz UCWAWJWXULNCFH-UHFFFAOYSA-N 1 2 249.358 2.453 20 0 BEADLO Cn1nc(C[N@@H+]2CC[C@@H](F)C2)c2ccccc21 ZINC000648721370 388353065 /nfs/dbraw/zinc/35/30/65/388353065.db2.gz MJPNNZUEEJRAED-SNVBAGLBSA-N 1 2 233.290 2.117 20 0 BEADLO Cn1nc(C[N@H+]2CC[C@@H](F)C2)c2ccccc21 ZINC000648721370 388353067 /nfs/dbraw/zinc/35/30/67/388353067.db2.gz MJPNNZUEEJRAED-SNVBAGLBSA-N 1 2 233.290 2.117 20 0 BEADLO c1nc(N2CCCC2)cc(NC2CCC2)[nH+]1 ZINC000277307494 388353764 /nfs/dbraw/zinc/35/37/64/388353764.db2.gz CNHGGVADGAVOFQ-UHFFFAOYSA-N 1 2 218.304 2.041 20 0 BEADLO c1nc(NC2CCC2)cc(N2CCCC2)[nH+]1 ZINC000277307494 388353766 /nfs/dbraw/zinc/35/37/66/388353766.db2.gz CNHGGVADGAVOFQ-UHFFFAOYSA-N 1 2 218.304 2.041 20 0 BEADLO C[C@H]1CCCC[C@@H]1CC(=O)NCc1[nH]cc[nH+]1 ZINC000524406771 388358209 /nfs/dbraw/zinc/35/82/09/388358209.db2.gz NXQMXLPBSFYEAS-WDEREUQCSA-N 1 2 235.331 2.242 20 0 BEADLO CC[C@H]1CCC[C@H]1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000516582836 388358318 /nfs/dbraw/zinc/35/83/18/388358318.db2.gz MEOYULIEOGHXCH-OUAUKWLOSA-N 1 2 235.331 2.413 20 0 BEADLO O=C(NCc1c[nH+]c[nH]1)[C@@H]1CCCC[C@@H]1C1CC1 ZINC000648791595 388359868 /nfs/dbraw/zinc/35/98/68/388359868.db2.gz FNSLPOVWGNGOPR-CHWSQXEVSA-N 1 2 247.342 2.242 20 0 BEADLO O=C(NCc1c[nH]c[nH+]1)[C@@H]1CCCC[C@@H]1C1CC1 ZINC000648791595 388359872 /nfs/dbraw/zinc/35/98/72/388359872.db2.gz FNSLPOVWGNGOPR-CHWSQXEVSA-N 1 2 247.342 2.242 20 0 BEADLO CC(C)(C)C[C@@H]1C[C@H]1C(=O)NCc1c[nH+]c[nH]1 ZINC000648791611 388360016 /nfs/dbraw/zinc/36/00/16/388360016.db2.gz GCAMXAHNNBATFZ-GXSJLCMTSA-N 1 2 235.331 2.098 20 0 BEADLO CC(C)(C)C[C@@H]1C[C@H]1C(=O)NCc1c[nH]c[nH+]1 ZINC000648791611 388360022 /nfs/dbraw/zinc/36/00/22/388360022.db2.gz GCAMXAHNNBATFZ-GXSJLCMTSA-N 1 2 235.331 2.098 20 0 BEADLO COc1ccc2[nH+]c(NC[C@@H](C)CO)ccc2c1 ZINC000193523466 388366358 /nfs/dbraw/zinc/36/63/58/388366358.db2.gz PLWOKLVQRQWDAF-SNVBAGLBSA-N 1 2 246.310 2.284 20 0 BEADLO Cc1ccc(N[C@H]2CCn3cc[nH+]c32)cn1 ZINC000293862432 388392931 /nfs/dbraw/zinc/39/29/31/388392931.db2.gz DJCHQLOMRXHVDC-NSHDSACASA-N 1 2 214.272 2.143 20 0 BEADLO Cc1noc([C@@H](C)[N@H+](C)Cc2cccnc2C)n1 ZINC000520248307 256668337 /nfs/dbraw/zinc/66/83/37/256668337.db2.gz YHNLLQRYCILYPW-SNVBAGLBSA-N 1 2 246.314 2.274 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+](C)Cc2cccnc2C)n1 ZINC000520248307 256668338 /nfs/dbraw/zinc/66/83/38/256668338.db2.gz YHNLLQRYCILYPW-SNVBAGLBSA-N 1 2 246.314 2.274 20 0 BEADLO CC[C@@H](CO)[N@H+](C)C/C(Cl)=C/Cl ZINC000294000312 388394510 /nfs/dbraw/zinc/39/45/10/388394510.db2.gz XFUJQMIDMBYVOK-NZGHECTNSA-N 1 2 212.120 2.008 20 0 BEADLO CC[C@@H](CO)[N@@H+](C)C/C(Cl)=C/Cl ZINC000294000312 388394511 /nfs/dbraw/zinc/39/45/11/388394511.db2.gz XFUJQMIDMBYVOK-NZGHECTNSA-N 1 2 212.120 2.008 20 0 BEADLO Fc1ccc(F)c(C[NH2+]Cc2cocn2)c1 ZINC000237752606 388398370 /nfs/dbraw/zinc/39/83/70/388398370.db2.gz RHSRDYZMGYFGJE-UHFFFAOYSA-N 1 2 224.210 2.243 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H](C)OC[C@H]2C)sc1C ZINC000246243332 388441244 /nfs/dbraw/zinc/44/12/44/388441244.db2.gz OHYUFNGGJCFGOY-BDAKNGLRSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H](C)OC[C@H]2C)sc1C ZINC000246243332 388441247 /nfs/dbraw/zinc/44/12/47/388441247.db2.gz OHYUFNGGJCFGOY-BDAKNGLRSA-N 1 2 240.372 2.369 20 0 BEADLO CCC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000074829941 388462134 /nfs/dbraw/zinc/46/21/34/388462134.db2.gz NNFOCQDNSUQALR-UHFFFAOYSA-N 1 2 215.256 2.425 20 0 BEADLO c1coc(CNc2cc(NC3CC3)[nH+]cn2)c1 ZINC000242990169 388476501 /nfs/dbraw/zinc/47/65/01/388476501.db2.gz HTMXWXVDPVXGIY-UHFFFAOYSA-N 1 2 230.271 2.256 20 0 BEADLO c1coc(CNc2cc(NC3CC3)nc[nH+]2)c1 ZINC000242990169 388476503 /nfs/dbraw/zinc/47/65/03/388476503.db2.gz HTMXWXVDPVXGIY-UHFFFAOYSA-N 1 2 230.271 2.256 20 0 BEADLO CO[C@H](C)C[N@H+](C)Cc1csc(Cl)n1 ZINC000295161618 388409886 /nfs/dbraw/zinc/40/98/86/388409886.db2.gz GYLZIOBZWJGHMQ-SSDOTTSWSA-N 1 2 234.752 2.263 20 0 BEADLO CO[C@H](C)C[N@@H+](C)Cc1csc(Cl)n1 ZINC000295161618 388409887 /nfs/dbraw/zinc/40/98/87/388409887.db2.gz GYLZIOBZWJGHMQ-SSDOTTSWSA-N 1 2 234.752 2.263 20 0 BEADLO Cc1ccc[nH+]c1CCNc1ncc(C)c(C)n1 ZINC000295671012 388413849 /nfs/dbraw/zinc/41/38/49/388413849.db2.gz GATAXFPVOKHGGV-UHFFFAOYSA-N 1 2 242.326 2.451 20 0 BEADLO CCc1ccc([C@@H](C)[NH2+]Cc2c[nH]nn2)cc1 ZINC000296281879 388420521 /nfs/dbraw/zinc/42/05/21/388420521.db2.gz KZGOETXVZKRVRX-SNVBAGLBSA-N 1 2 230.315 2.218 20 0 BEADLO CCc1ccc([C@@H](C)[NH2+]Cc2cn[nH]n2)cc1 ZINC000296281879 388420523 /nfs/dbraw/zinc/42/05/23/388420523.db2.gz KZGOETXVZKRVRX-SNVBAGLBSA-N 1 2 230.315 2.218 20 0 BEADLO CCc1ccc([C@H](C)[NH2+]Cc2c[nH]nn2)cc1 ZINC000296281876 388420849 /nfs/dbraw/zinc/42/08/49/388420849.db2.gz KZGOETXVZKRVRX-JTQLQIEISA-N 1 2 230.315 2.218 20 0 BEADLO CCc1ccc([C@H](C)[NH2+]Cc2cn[nH]n2)cc1 ZINC000296281876 388420852 /nfs/dbraw/zinc/42/08/52/388420852.db2.gz KZGOETXVZKRVRX-JTQLQIEISA-N 1 2 230.315 2.218 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@H]2CCC[C@H]21 ZINC000245570460 388424180 /nfs/dbraw/zinc/42/41/80/388424180.db2.gz XARYWTPZIOIUER-DGCLKSJQSA-N 1 2 219.332 2.483 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@H]2CCC[C@H]21 ZINC000245570460 388424183 /nfs/dbraw/zinc/42/41/83/388424183.db2.gz XARYWTPZIOIUER-DGCLKSJQSA-N 1 2 219.332 2.483 20 0 BEADLO Cc1nc(N2CC[C@H](C)[C@@H](C)C2)cc[nH+]1 ZINC000245756297 388431142 /nfs/dbraw/zinc/43/11/42/388431142.db2.gz PBAJDWJZESXJLI-UWVGGRQHSA-N 1 2 205.305 2.267 20 0 BEADLO C[C@H]1CN(c2[nH+]ccc3ccccc32)CC[C@@H]1O ZINC000167116396 388438475 /nfs/dbraw/zinc/43/84/75/388438475.db2.gz AICDUZRHWPLHLW-FZMZJTMJSA-N 1 2 242.322 2.442 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1CC[S@](=O)C(C)(C)CC1 ZINC000528520203 388541404 /nfs/dbraw/zinc/54/14/04/388541404.db2.gz PKTGNRHAMNONKB-HGZZYMOZSA-N 1 2 249.807 2.362 20 0 BEADLO C/C(Cl)=C/C[N@H+]1CC[S@](=O)C(C)(C)CC1 ZINC000528520203 388541405 /nfs/dbraw/zinc/54/14/05/388541405.db2.gz PKTGNRHAMNONKB-HGZZYMOZSA-N 1 2 249.807 2.362 20 0 BEADLO Cc1cc(NC(=O)N[C@@H](C)C2CC2)c(C)c[nH+]1 ZINC000517218329 388542032 /nfs/dbraw/zinc/54/20/32/388542032.db2.gz HPOYGTZNFUOXPK-JTQLQIEISA-N 1 2 233.315 2.040 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H](C)c1cccc(O)c1 ZINC000520839885 388543229 /nfs/dbraw/zinc/54/32/29/388543229.db2.gz VVULKKVUWFTDHW-JTQLQIEISA-N 1 2 243.310 2.394 20 0 BEADLO C/C(Cl)=C\C[NH2+][C@@H](C)c1csnn1 ZINC000528529351 388543361 /nfs/dbraw/zinc/54/33/61/388543361.db2.gz ZYGGHKSKEVSLOP-ZAXDUSRUSA-N 1 2 217.725 2.331 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2[C@H](C)[C@@H]2C2CC2)cc[nH+]1 ZINC000528533344 388543541 /nfs/dbraw/zinc/54/35/41/388543541.db2.gz JHFQRZNXLDPORT-OASPWFOLSA-N 1 2 230.311 2.043 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CCCC23CC3)cc[nH+]1 ZINC000528532955 388544086 /nfs/dbraw/zinc/54/40/86/388544086.db2.gz DGIYAFLMHCNONK-GFCCVEGCSA-N 1 2 230.311 2.331 20 0 BEADLO C[C@@]1(CNc2ccc3ccccc3[nH+]2)CCOC1 ZINC000354092660 388544184 /nfs/dbraw/zinc/54/41/84/388544184.db2.gz OTUFFHQFYFLAMX-HNNXBMFYSA-N 1 2 242.322 2.495 20 0 BEADLO FC1(F)[C@H]2C[N@H+](Cc3ncccc3Cl)C[C@H]21 ZINC000528535860 388545111 /nfs/dbraw/zinc/54/51/11/388545111.db2.gz XGPDRIUHLHFMDI-OCAPTIKFSA-N 1 2 244.672 2.432 20 0 BEADLO FC1(F)[C@H]2C[N@@H+](Cc3ncccc3Cl)C[C@H]21 ZINC000528535860 388545114 /nfs/dbraw/zinc/54/51/14/388545114.db2.gz XGPDRIUHLHFMDI-OCAPTIKFSA-N 1 2 244.672 2.432 20 0 BEADLO CC(C)(O)CCOc1ccccc1-n1cc[nH+]c1 ZINC000548612811 388548290 /nfs/dbraw/zinc/54/82/90/388548290.db2.gz NCMZODGTTLNLPH-UHFFFAOYSA-N 1 2 246.310 2.412 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2ccco2)s1 ZINC000135000016 388482979 /nfs/dbraw/zinc/48/29/79/388482979.db2.gz NONRDNIYVOLESX-ZETCQYMHSA-N 1 2 223.301 2.290 20 0 BEADLO CCCC[C@H]([NH2+]C[C@H]1CCCS1)C(=O)OC ZINC000135245235 388487107 /nfs/dbraw/zinc/48/71/07/388487107.db2.gz QLGKNYREAKVHRI-MNOVXSKESA-N 1 2 245.388 2.203 20 0 BEADLO CCCC[C@@H]([NH2+]C[C@@H](C)SC)C(=O)OC ZINC000135255996 388488198 /nfs/dbraw/zinc/48/81/98/388488198.db2.gz LWNNMTMICGMTQR-NXEZZACHSA-N 1 2 233.377 2.059 20 0 BEADLO Cc1cc(NC[C@H]2CC[C@H](C)O2)nc(C(C)C)[nH+]1 ZINC000397856605 388506147 /nfs/dbraw/zinc/50/61/47/388506147.db2.gz BJAVGNLKGZEWNV-NWDGAFQWSA-N 1 2 249.358 2.310 20 0 BEADLO CCO[C@@H](C)c1noc(C[N@H+]2[C@H](C)C[C@@H]2C)n1 ZINC000548096222 388510678 /nfs/dbraw/zinc/51/06/78/388510678.db2.gz IRXCMXUIRFZVQC-AEJSXWLSSA-N 1 2 239.319 2.150 20 0 BEADLO CCO[C@@H](C)c1noc(C[N@@H+]2[C@H](C)C[C@@H]2C)n1 ZINC000548096222 388510682 /nfs/dbraw/zinc/51/06/82/388510682.db2.gz IRXCMXUIRFZVQC-AEJSXWLSSA-N 1 2 239.319 2.150 20 0 BEADLO CC(C)CCC(=O)NCCCCn1cc[nH+]c1 ZINC000516712962 388515182 /nfs/dbraw/zinc/51/51/82/388515182.db2.gz NDFWNWLWTFBLTH-UHFFFAOYSA-N 1 2 237.347 2.216 20 0 BEADLO C/C(Cl)=C/C[N@H+]1CCO[C@H](C)[C@H]1C ZINC000528404850 388520553 /nfs/dbraw/zinc/52/05/53/388520553.db2.gz OCWQMYIRGNMTGE-QPGUZKIZSA-N 1 2 203.713 2.238 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1CCO[C@H](C)[C@H]1C ZINC000528404850 388520556 /nfs/dbraw/zinc/52/05/56/388520556.db2.gz OCWQMYIRGNMTGE-QPGUZKIZSA-N 1 2 203.713 2.238 20 0 BEADLO CCC1(NC(=O)[C@@H](C)Cc2c[nH+]c[nH]2)CCC1 ZINC000520836205 388525135 /nfs/dbraw/zinc/52/51/35/388525135.db2.gz JACXSZDBWXWOTN-JTQLQIEISA-N 1 2 235.331 2.037 20 0 BEADLO CCC1(NC(=O)[C@@H](C)Cc2c[nH]c[nH+]2)CCC1 ZINC000520836205 388525137 /nfs/dbraw/zinc/52/51/37/388525137.db2.gz JACXSZDBWXWOTN-JTQLQIEISA-N 1 2 235.331 2.037 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1CCO[C@@H](C2CC2)C1 ZINC000528456994 388528532 /nfs/dbraw/zinc/52/85/32/388528532.db2.gz BRKXEDKNJPYROW-VCFDLTMXSA-N 1 2 215.724 2.240 20 0 BEADLO C/C(Cl)=C\C[N@H+]1CCO[C@@H](C2CC2)C1 ZINC000528456994 388528534 /nfs/dbraw/zinc/52/85/34/388528534.db2.gz BRKXEDKNJPYROW-VCFDLTMXSA-N 1 2 215.724 2.240 20 0 BEADLO C[C@H]1CCC[N@H+](Cc2csnn2)[C@H]1C ZINC000245554721 388589054 /nfs/dbraw/zinc/58/90/54/388589054.db2.gz HIDDLOUPRMNOSJ-IUCAKERBSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@H]1CCC[N@@H+](Cc2csnn2)[C@H]1C ZINC000245554721 388589057 /nfs/dbraw/zinc/58/90/57/388589057.db2.gz HIDDLOUPRMNOSJ-IUCAKERBSA-N 1 2 211.334 2.159 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H]2CC3CCC2CC3)c[nH+]1 ZINC000550153819 388600375 /nfs/dbraw/zinc/60/03/75/388600375.db2.gz ZMQDVIZPSRCQLX-ILDUYXDCSA-N 1 2 233.315 2.027 20 0 BEADLO c1cc(C[N@H+]2CCOC[C@@H]2CC2CCC2)on1 ZINC000550140278 388600675 /nfs/dbraw/zinc/60/06/75/388600675.db2.gz BCPHTNMLVARCKD-LBPRGKRZSA-N 1 2 236.315 2.066 20 0 BEADLO c1cc(C[N@@H+]2CCOC[C@@H]2CC2CCC2)on1 ZINC000550140278 388600676 /nfs/dbraw/zinc/60/06/76/388600676.db2.gz BCPHTNMLVARCKD-LBPRGKRZSA-N 1 2 236.315 2.066 20 0 BEADLO Cc1ccccc1[C@@H]1NC(=O)[C@H]2C[C@@H](C)CC[N@H+]21 ZINC000186590029 388601108 /nfs/dbraw/zinc/60/11/08/388601108.db2.gz SOLISKPZZKGICU-ZLKJLUDKSA-N 1 2 244.338 2.224 20 0 BEADLO Cc1ccccc1[C@@H]1NC(=O)[C@H]2C[C@@H](C)CC[N@@H+]21 ZINC000186590029 388601110 /nfs/dbraw/zinc/60/11/10/388601110.db2.gz SOLISKPZZKGICU-ZLKJLUDKSA-N 1 2 244.338 2.224 20 0 BEADLO O=C(Cn1cc[nH+]c1C1CC1)c1ccc(O)cc1 ZINC000530131991 388615203 /nfs/dbraw/zinc/61/52/03/388615203.db2.gz RZCHGJYGPLVUGT-UHFFFAOYSA-N 1 2 242.278 2.349 20 0 BEADLO c1nonc1C[NH2+][C@H](c1ccccn1)C1CCC1 ZINC000528649959 388555288 /nfs/dbraw/zinc/55/52/88/388555288.db2.gz BFAWRRDURVYJCJ-ZDUSSCGKSA-N 1 2 244.298 2.096 20 0 BEADLO COC(=O)[C@H]([NH2+][C@H]1CC12CCCCC2)C1CC1 ZINC000358824785 388555484 /nfs/dbraw/zinc/55/54/84/388555484.db2.gz XBXRFLKTDDYVPS-NWDGAFQWSA-N 1 2 237.343 2.250 20 0 BEADLO CC(C)Cc1noc(C[N@H+]2[C@H](C)C[C@@H]2C)n1 ZINC000548754311 388556886 /nfs/dbraw/zinc/55/68/86/388556886.db2.gz TVRNLKUAXKOQHB-AOOOYVTPSA-N 1 2 223.320 2.251 20 0 BEADLO CC(C)Cc1noc(C[N@@H+]2[C@H](C)C[C@@H]2C)n1 ZINC000548754311 388556887 /nfs/dbraw/zinc/55/68/87/388556887.db2.gz TVRNLKUAXKOQHB-AOOOYVTPSA-N 1 2 223.320 2.251 20 0 BEADLO CC(C)[N@H+](CCC(C)(C)O)CC(F)F ZINC000360450799 388558478 /nfs/dbraw/zinc/55/84/78/388558478.db2.gz XMMKPSBVLUNFND-UHFFFAOYSA-N 1 2 209.280 2.123 20 0 BEADLO CC(C)[N@@H+](CCC(C)(C)O)CC(F)F ZINC000360450799 388558480 /nfs/dbraw/zinc/55/84/80/388558480.db2.gz XMMKPSBVLUNFND-UHFFFAOYSA-N 1 2 209.280 2.123 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC[C@@H]1CCC[C@H]1C ZINC000521067100 388561269 /nfs/dbraw/zinc/56/12/69/388561269.db2.gz YWUZQCHWAQEYJI-UTUOFQBUSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC[C@@H]1CCC[C@H]1C ZINC000521067100 388561271 /nfs/dbraw/zinc/56/12/71/388561271.db2.gz YWUZQCHWAQEYJI-UTUOFQBUSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1ccon1 ZINC000528766141 388569103 /nfs/dbraw/zinc/56/91/03/388569103.db2.gz JUOKEUCUMUYCDY-MRVPVSSYSA-N 1 2 216.231 2.294 20 0 BEADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1ccon1 ZINC000528766141 388569106 /nfs/dbraw/zinc/56/91/06/388569106.db2.gz JUOKEUCUMUYCDY-MRVPVSSYSA-N 1 2 216.231 2.294 20 0 BEADLO Fc1ccc(C[N@H+]2CC[C@H](OC(F)F)C2)nc1 ZINC000549414003 388579469 /nfs/dbraw/zinc/57/94/69/388579469.db2.gz HYJRHYRHCLIEEN-JTQLQIEISA-N 1 2 246.232 2.034 20 0 BEADLO Fc1ccc(C[N@@H+]2CC[C@H](OC(F)F)C2)nc1 ZINC000549414003 388579472 /nfs/dbraw/zinc/57/94/72/388579472.db2.gz HYJRHYRHCLIEEN-JTQLQIEISA-N 1 2 246.232 2.034 20 0 BEADLO COCCCn1c[nH+]c2cc(F)c(F)cc21 ZINC000124915128 388667112 /nfs/dbraw/zinc/66/71/12/388667112.db2.gz XNUNXHQYDIXLHE-UHFFFAOYSA-N 1 2 226.226 2.351 20 0 BEADLO Cc1cc(NC(=O)C2CC(C)(C)C2)c(C)c[nH+]1 ZINC000552114460 388670817 /nfs/dbraw/zinc/67/08/17/388670817.db2.gz LDNGWVXJZRZKAF-UHFFFAOYSA-N 1 2 232.327 2.495 20 0 BEADLO CCc1ccc(C[NH2+]Cc2nnc(C)s2)cn1 ZINC000552158770 388673910 /nfs/dbraw/zinc/67/39/10/388673910.db2.gz HKUDBLYQJJYXCG-UHFFFAOYSA-N 1 2 248.355 2.094 20 0 BEADLO O[C@H](C[N@H+](CC(F)F)C1CC1)CC(F)(F)F ZINC000189241604 388628506 /nfs/dbraw/zinc/62/85/06/388628506.db2.gz JONYUYGHEGMOEW-ZETCQYMHSA-N 1 2 247.207 2.029 20 0 BEADLO O[C@H](C[N@@H+](CC(F)F)C1CC1)CC(F)(F)F ZINC000189241604 388628508 /nfs/dbraw/zinc/62/85/08/388628508.db2.gz JONYUYGHEGMOEW-ZETCQYMHSA-N 1 2 247.207 2.029 20 0 BEADLO Cc1c[nH+]c(C)nc1NCc1ccsc1 ZINC000521898930 388640722 /nfs/dbraw/zinc/64/07/22/388640722.db2.gz CYOKPAQYFCTEGI-UHFFFAOYSA-N 1 2 219.313 2.189 20 0 BEADLO CC[C@@H](C(=O)OC)[N@H+](C)Cc1ccccc1F ZINC000194559464 388735179 /nfs/dbraw/zinc/73/51/79/388735179.db2.gz KZTWZWVXRFDOCM-LBPRGKRZSA-N 1 2 239.290 2.209 20 0 BEADLO CC[C@@H](C(=O)OC)[N@@H+](C)Cc1ccccc1F ZINC000194559464 388735182 /nfs/dbraw/zinc/73/51/82/388735182.db2.gz KZTWZWVXRFDOCM-LBPRGKRZSA-N 1 2 239.290 2.209 20 0 BEADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ncc[nH]2)o1 ZINC000067670393 388738185 /nfs/dbraw/zinc/73/81/85/388738185.db2.gz WKPNPZFPLSTAOS-KOLCDFICSA-N 1 2 231.299 2.416 20 0 BEADLO C[C@@H]1C[C@@H]1c1ccc(CNCc2[nH]cc[nH+]2)o1 ZINC000067670393 388738188 /nfs/dbraw/zinc/73/81/88/388738188.db2.gz WKPNPZFPLSTAOS-KOLCDFICSA-N 1 2 231.299 2.416 20 0 BEADLO CCC[C@@H](C)CC(=O)N1CC(n2cc[nH+]c2)C1 ZINC000522258485 388739079 /nfs/dbraw/zinc/73/90/79/388739079.db2.gz DPNIHBKDGTVFJZ-LLVKDONJSA-N 1 2 235.331 2.093 20 0 BEADLO Cc1ccc(NC(=O)NCCCF)c(C)[nH+]1 ZINC000126476706 388696378 /nfs/dbraw/zinc/69/63/78/388696378.db2.gz CGLGZYPWYFSBHU-UHFFFAOYSA-N 1 2 225.267 2.180 20 0 BEADLO Cc1cnc(C)c(NCCCCn2cc[nH+]c2)n1 ZINC000088057937 388718573 /nfs/dbraw/zinc/71/85/73/388718573.db2.gz HGXFZGPMYZVWST-UHFFFAOYSA-N 1 2 245.330 2.182 20 0 BEADLO CC(C)[C@@H](C)C(=O)NCCCCn1cc[nH+]c1 ZINC000522214486 388722640 /nfs/dbraw/zinc/72/26/40/388722640.db2.gz CRVDWDLQEAWSNZ-GFCCVEGCSA-N 1 2 237.347 2.072 20 0 BEADLO C[C@H](N(C)C(=O)CCc1[nH]cc[nH+]1)C(C)(C)C ZINC000554299213 388806671 /nfs/dbraw/zinc/80/66/71/388806671.db2.gz CVIYJBMXKWSFBN-JTQLQIEISA-N 1 2 237.347 2.235 20 0 BEADLO C[C@H]1CC[C@H](C(=O)NCCCCn2cc[nH+]c2)C1 ZINC000540690026 388814505 /nfs/dbraw/zinc/81/45/05/388814505.db2.gz JNPOMDPEOAQKJB-STQMWFEESA-N 1 2 249.358 2.216 20 0 BEADLO Cn1cc(Cl)c(C[NH2+]Cc2ccsc2)n1 ZINC000393361939 388816006 /nfs/dbraw/zinc/81/60/06/388816006.db2.gz GKXJSORCPQEICD-UHFFFAOYSA-N 1 2 241.747 2.425 20 0 BEADLO COc1ccc[nH+]c1NCc1cnccc1C ZINC000163035220 388816257 /nfs/dbraw/zinc/81/62/57/388816257.db2.gz YWEIZYRHHFUEPU-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1cncc(F)c1 ZINC000129103759 388818916 /nfs/dbraw/zinc/81/89/16/388818916.db2.gz GSCQOZIVAZEKDJ-UHFFFAOYSA-N 1 2 231.230 2.176 20 0 BEADLO Cc1cc(NC(=O)N2CC[C@H](C(C)C)C2)cc[nH+]1 ZINC000336587360 177701607 /nfs/dbraw/zinc/70/16/07/177701607.db2.gz AHESRZVEEMKEGD-LBPRGKRZSA-N 1 2 247.342 2.322 20 0 BEADLO CC(C)c1nc(N[C@H]2C[C@H](O)C2(C)C)cc[nH+]1 ZINC000302480900 388846297 /nfs/dbraw/zinc/84/62/97/388846297.db2.gz XPEFSOUOWOSJEE-UWVGGRQHSA-N 1 2 235.331 2.171 20 0 BEADLO C[C@@H]1CN(C)CC[N@@H+]1C/C=C\c1ccccc1 ZINC000523636945 388848991 /nfs/dbraw/zinc/84/89/91/388848991.db2.gz ZXRPSVBXAXSQBX-DEBLGDTFSA-N 1 2 230.355 2.336 20 0 BEADLO COC(=O)CSCCc1[nH+]cc(C)cc1C ZINC000564798222 388889769 /nfs/dbraw/zinc/88/97/69/388889769.db2.gz PLSYVMPDCHWADO-UHFFFAOYSA-N 1 2 239.340 2.147 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1CC12CC2 ZINC000564886884 388896331 /nfs/dbraw/zinc/89/63/31/388896331.db2.gz UTNQDEGOTORFGO-SNVBAGLBSA-N 1 2 231.299 2.372 20 0 BEADLO CC[C@@H](NC(=O)CCc1c[nH+]c[nH]1)C1CCCC1 ZINC000564539196 388877135 /nfs/dbraw/zinc/87/71/35/388877135.db2.gz YXGQNYBNVLQUBF-CYBMUJFWSA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@@H](NC(=O)CCc1c[nH]c[nH+]1)C1CCCC1 ZINC000564539196 388877140 /nfs/dbraw/zinc/87/71/40/388877140.db2.gz YXGQNYBNVLQUBF-CYBMUJFWSA-N 1 2 249.358 2.427 20 0 BEADLO Cc1nnsc1C[N@H+](C)Cc1cccc(O)c1 ZINC000565047304 388910667 /nfs/dbraw/zinc/91/06/67/388910667.db2.gz PKJNNOHCJRBUIY-UHFFFAOYSA-N 1 2 249.339 2.184 20 0 BEADLO Cc1nnsc1C[N@@H+](C)Cc1cccc(O)c1 ZINC000565047304 388910664 /nfs/dbraw/zinc/91/06/64/388910664.db2.gz PKJNNOHCJRBUIY-UHFFFAOYSA-N 1 2 249.339 2.184 20 0 BEADLO Cc1cncc(C[N@H+]2CCC(=O)CC23CCC3)c1 ZINC000565172875 388921550 /nfs/dbraw/zinc/92/15/50/388921550.db2.gz RMMWXQBANDQCQC-UHFFFAOYSA-N 1 2 244.338 2.478 20 0 BEADLO Cc1cncc(C[N@@H+]2CCC(=O)CC23CCC3)c1 ZINC000565172875 388921548 /nfs/dbraw/zinc/92/15/48/388921548.db2.gz RMMWXQBANDQCQC-UHFFFAOYSA-N 1 2 244.338 2.478 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N[C@H]1CC12CCCC2 ZINC000565190027 388922646 /nfs/dbraw/zinc/92/26/46/388922646.db2.gz JTVLLTWJJYMQSL-JQWIXIFHSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N[C@H]1CC12CCCC2 ZINC000565190027 388922644 /nfs/dbraw/zinc/92/26/44/388922644.db2.gz JTVLLTWJJYMQSL-JQWIXIFHSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@H]1CC12CCCC2 ZINC000565190029 388923040 /nfs/dbraw/zinc/92/30/40/388923040.db2.gz JTVLLTWJJYMQSL-ZYHUDNBSSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@H]1CC12CCCC2 ZINC000565190029 388923036 /nfs/dbraw/zinc/92/30/36/388923036.db2.gz JTVLLTWJJYMQSL-ZYHUDNBSSA-N 1 2 247.342 2.037 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000565191918 388923746 /nfs/dbraw/zinc/92/37/46/388923746.db2.gz LNALSHXVVRKKPE-GMXVVIOVSA-N 1 2 249.358 2.378 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000565191918 388923742 /nfs/dbraw/zinc/92/37/42/388923742.db2.gz LNALSHXVVRKKPE-GMXVVIOVSA-N 1 2 249.358 2.378 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1CS[C@@H](C)C1 ZINC000565225201 388928452 /nfs/dbraw/zinc/92/84/52/388928452.db2.gz BYXNOMRCXHLPQX-WCBMZHEXSA-N 1 2 223.345 2.399 20 0 BEADLO CC[C@@H]([NH2+][C@H](C)c1cncnc1C)C(F)F ZINC000565219653 388928585 /nfs/dbraw/zinc/92/85/85/388928585.db2.gz XLRKMMZVOXKLDV-PSASIEDQSA-N 1 2 229.274 2.479 20 0 BEADLO CCOc1cccc(C[N@@H+]2CCC[C@@H](F)C2)n1 ZINC000565366668 388941018 /nfs/dbraw/zinc/94/10/18/388941018.db2.gz UYGUNALFSZMUCB-LLVKDONJSA-N 1 2 238.306 2.414 20 0 BEADLO CCOc1cccc(C[N@H+]2CCC[C@@H](F)C2)n1 ZINC000565366668 388941021 /nfs/dbraw/zinc/94/10/21/388941021.db2.gz UYGUNALFSZMUCB-LLVKDONJSA-N 1 2 238.306 2.414 20 0 BEADLO COc1ccc(C[N@@H+]2CCOC[C@H]2C)c(F)c1 ZINC000565368864 388941064 /nfs/dbraw/zinc/94/10/64/388941064.db2.gz SBTDDBSSSGHUKW-SNVBAGLBSA-N 1 2 239.290 2.055 20 0 BEADLO COc1ccc(C[N@H+]2CCOC[C@H]2C)c(F)c1 ZINC000565368864 388941065 /nfs/dbraw/zinc/94/10/65/388941065.db2.gz SBTDDBSSSGHUKW-SNVBAGLBSA-N 1 2 239.290 2.055 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@H]1CCCC[C@@H]1C ZINC000565434095 388945154 /nfs/dbraw/zinc/94/51/54/388945154.db2.gz SVSZOBQJUSYBQL-DMDPSCGWSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@H]1CCCC[C@@H]1C ZINC000565434095 388945156 /nfs/dbraw/zinc/94/51/56/388945156.db2.gz SVSZOBQJUSYBQL-DMDPSCGWSA-N 1 2 249.358 2.283 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)Cc1ccncc1 ZINC000565548774 388954162 /nfs/dbraw/zinc/95/41/62/388954162.db2.gz NAEALKGWACGWLZ-UHFFFAOYSA-N 1 2 228.299 2.125 20 0 BEADLO Cn1c[nH+]cc1CC(=O)NC1CCC(C)(C)CC1 ZINC000565557021 388954582 /nfs/dbraw/zinc/95/45/82/388954582.db2.gz JKWNQLVEJQLPDW-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO Cc1nc(C(C)(C)[NH2+]Cc2cccs2)no1 ZINC000264251828 388992090 /nfs/dbraw/zinc/99/20/90/388992090.db2.gz AYPKDTCERWZFLM-UHFFFAOYSA-N 1 2 237.328 2.464 20 0 BEADLO C[C@@](O)(CNc1cccc[nH+]1)c1cccs1 ZINC000265803621 388994106 /nfs/dbraw/zinc/99/41/06/388994106.db2.gz KLFOFHUPINQHOO-GFCCVEGCSA-N 1 2 234.324 2.463 20 0 BEADLO c1nc(NC2CCC2)cc(NC2CCC2)[nH+]1 ZINC000274649607 389047995 /nfs/dbraw/zinc/04/79/95/389047995.db2.gz FZVIOWLFZRQPRR-UHFFFAOYSA-N 1 2 218.304 2.405 20 0 BEADLO Cc1cnc(C[NH2+][C@H](C)c2cn[nH]c2)s1 ZINC000275132950 389051716 /nfs/dbraw/zinc/05/17/16/389051716.db2.gz CBMQPJWVHNCEIZ-MRVPVSSYSA-N 1 2 222.317 2.025 20 0 BEADLO C[C@@H]1CCCC[C@H]1N(C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492889076 533599880 /nfs/dbraw/zinc/59/98/80/533599880.db2.gz AGGYOLFAXFJBAJ-FZJVHEGESA-N 1 2 247.342 2.460 20 0 BEADLO C[C@@H]1CCCN(C(=O)/C=C/c2[nH]cc[nH+]2)[C@H]1C ZINC000493283367 533637755 /nfs/dbraw/zinc/63/77/55/533637755.db2.gz HMXMNCGKUCESTG-PVTPVBHGSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@@H](CC(=O)NC1CCCCC1)n1cc[nH+]c1 ZINC000551909294 322829114 /nfs/dbraw/zinc/82/91/14/322829114.db2.gz AMBYHCIKASPADZ-NSHDSACASA-N 1 2 235.331 2.283 20 0 BEADLO Cn1ncc2c1CCC[C@H]2[NH2+]Cc1cscn1 ZINC000040504731 322832936 /nfs/dbraw/zinc/83/29/36/322832936.db2.gz DRISYPYYRBFWPW-LLVKDONJSA-N 1 2 248.355 2.044 20 0 BEADLO Cc1nc(N2CCCC(C)(C)C2)cc[nH+]1 ZINC000266197609 132185077 /nfs/dbraw/zinc/18/50/77/132185077.db2.gz CPSZPDPQQKWFQH-UHFFFAOYSA-N 1 2 205.305 2.411 20 0 BEADLO C[C@@H]1CN(c2cc[nH+]c3ccncc32)C[C@H](C)O1 ZINC000267196074 132188723 /nfs/dbraw/zinc/18/87/23/132188723.db2.gz IHOCYCSZORLJLU-PHIMTYICSA-N 1 2 243.310 2.243 20 0 BEADLO Cc1nc(N2CC[C@@H](C(C)(C)C)[C@@H](O)C2)cc[nH+]1 ZINC000273353978 132201970 /nfs/dbraw/zinc/20/19/70/132201970.db2.gz VQSZIJMNOAPXDW-NEPJUHHUSA-N 1 2 249.358 2.018 20 0 BEADLO CO[C@H]1CN(c2cc[nH+]c(C3CC3)n2)CC[C@H]1C ZINC000276013995 132205799 /nfs/dbraw/zinc/20/57/99/132205799.db2.gz MKMRQUQPGGXAFV-PWSUYJOCSA-N 1 2 247.342 2.215 20 0 BEADLO CC1=CCCN(c2cc(NCC3CC3)[nH+]cn2)C1 ZINC000280743051 132210829 /nfs/dbraw/zinc/21/08/29/132210829.db2.gz LLODVTYRUULBCG-UHFFFAOYSA-N 1 2 244.342 2.455 20 0 BEADLO CC1=CCCN(c2cc(NCC3CC3)nc[nH+]2)C1 ZINC000280743051 132210832 /nfs/dbraw/zinc/21/08/32/132210832.db2.gz LLODVTYRUULBCG-UHFFFAOYSA-N 1 2 244.342 2.455 20 0 BEADLO Cc1nc(N2CCC(C)=C(C)C2)cc[nH+]1 ZINC000281038297 132211317 /nfs/dbraw/zinc/21/13/17/132211317.db2.gz QZXQMFJSXQOOJH-UHFFFAOYSA-N 1 2 203.289 2.332 20 0 BEADLO CCc1nc(N2CCOC3(CCC3)C2)cc(C)[nH+]1 ZINC000286454659 132214915 /nfs/dbraw/zinc/21/49/15/132214915.db2.gz JSHJJDWGXMMASI-UHFFFAOYSA-N 1 2 247.342 2.107 20 0 BEADLO C[C@@H]1CCCCN1c1cc(N2CCCC2)[nH+]cn1 ZINC000286842081 132215583 /nfs/dbraw/zinc/21/55/83/132215583.db2.gz FVQPCNMGAYVDPS-GFCCVEGCSA-N 1 2 246.358 2.456 20 0 BEADLO C[C@@H]1CCCCN1c1cc(N2CCCC2)nc[nH+]1 ZINC000286842081 132215585 /nfs/dbraw/zinc/21/55/85/132215585.db2.gz FVQPCNMGAYVDPS-GFCCVEGCSA-N 1 2 246.358 2.456 20 0 BEADLO CCO[C@@H]1CCN(c2cccc[nH+]2)C[C@H]1C ZINC000336261353 132245688 /nfs/dbraw/zinc/24/56/88/132245688.db2.gz FNJPMFBJRFHJLN-VXGBXAGGSA-N 1 2 220.316 2.333 20 0 BEADLO Cc1cc(N2CCOC[C@H]2C)nc(C(C)C)[nH+]1 ZINC000301069058 132250880 /nfs/dbraw/zinc/25/08/80/132250880.db2.gz DSYANHLXXOTEEU-LLVKDONJSA-N 1 2 235.331 2.134 20 0 BEADLO Cc1cc(N2CCOC3(CCCCC3)C2)nc[nH+]1 ZINC000301426390 132253510 /nfs/dbraw/zinc/25/35/10/132253510.db2.gz DRPSCWJOEDGJPL-UHFFFAOYSA-N 1 2 247.342 2.325 20 0 BEADLO Cc1nc(N2C[C@@H](C)O[C@H](C)C2)c(C)c(C)[nH+]1 ZINC000301452627 132254022 /nfs/dbraw/zinc/25/40/22/132254022.db2.gz UVVKORBILMJYLM-RKDXNWHRSA-N 1 2 235.331 2.015 20 0 BEADLO COC1CCN(c2nc(C)[nH+]c(C)c2C)CC1 ZINC000301668890 132255799 /nfs/dbraw/zinc/25/57/99/132255799.db2.gz DJSVFDGCVLZABK-UHFFFAOYSA-N 1 2 235.331 2.017 20 0 BEADLO CO[C@H]1CN(c2nc(C)[nH+]c(C)c2C)CC[C@@H]1C ZINC000302570893 132264594 /nfs/dbraw/zinc/26/45/94/132264594.db2.gz QIWLAEPBUDKNPO-ZANVPECISA-N 1 2 249.358 2.263 20 0 BEADLO COCC1(C)CCN(c2cc(C)[nH+]cn2)CC1 ZINC000358458382 132275482 /nfs/dbraw/zinc/27/54/82/132275482.db2.gz PUJHJRPCSGEBOM-UHFFFAOYSA-N 1 2 235.331 2.038 20 0 BEADLO CO[C@@]1(C)CCCN(c2nc(C)[nH+]c(C)c2C)C1 ZINC000359747300 132277542 /nfs/dbraw/zinc/27/75/42/132277542.db2.gz ORHPICQNCHQGEU-AWEZNQCLSA-N 1 2 249.358 2.407 20 0 BEADLO Cc1nc(N2CCO[C@@H](C3CC3)C2)c(C)c(C)[nH+]1 ZINC000372259988 132286031 /nfs/dbraw/zinc/28/60/31/132286031.db2.gz FDYJJRCGAVNXHF-CYBMUJFWSA-N 1 2 247.342 2.017 20 0 BEADLO Cc1nc(N2CCC3(CCO3)CC2)c(C)c(C)[nH+]1 ZINC000374545885 132287299 /nfs/dbraw/zinc/28/72/99/132287299.db2.gz ZLIZGGIAKAYAIP-UHFFFAOYSA-N 1 2 247.342 2.161 20 0 BEADLO C[C@@H](Nc1ccc(N2CCOCC2)[nH+]c1)C1CC1 ZINC000037076084 132295621 /nfs/dbraw/zinc/29/56/21/132295621.db2.gz IBMGXVKNFQFFDG-LLVKDONJSA-N 1 2 247.342 2.129 20 0 BEADLO Cc1cc(N2CCC(C)(O)CC2)nc(C(C)C)[nH+]1 ZINC000126755970 132298113 /nfs/dbraw/zinc/29/81/13/132298113.db2.gz IZLKFMSAXCWYPL-UHFFFAOYSA-N 1 2 249.358 2.260 20 0 BEADLO Cn1c[nH+]cc1CN1CCCC[C@H]1C(F)F ZINC000334185445 133578898 /nfs/dbraw/zinc/57/88/98/133578898.db2.gz GJPLKJJVOYQJTO-JTQLQIEISA-N 1 2 229.274 2.040 20 0 BEADLO CC(C)c1nc(NC[C@@H]2CCOC[C@H]2C)cc[nH+]1 ZINC000343558251 133695958 /nfs/dbraw/zinc/69/59/58/133695958.db2.gz UVGYXTQAHQBZAU-NEPJUHHUSA-N 1 2 249.358 2.106 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC(=O)[C@H](C)C2)c(C)n1 ZINC000335926610 134009180 /nfs/dbraw/zinc/00/91/80/134009180.db2.gz RVIBZIQYBKTQID-SNVBAGLBSA-N 1 2 232.327 2.109 20 0 BEADLO Cc1ccc(C[N@H+]2CCC(=O)[C@H](C)C2)c(C)n1 ZINC000335926610 134009181 /nfs/dbraw/zinc/00/91/81/134009181.db2.gz RVIBZIQYBKTQID-SNVBAGLBSA-N 1 2 232.327 2.109 20 0 BEADLO c1c[nH+]c([C@H]2CCCN2Cc2cscn2)[nH]1 ZINC000335965783 134028060 /nfs/dbraw/zinc/02/80/60/134028060.db2.gz FMKCPSHHFBPTOR-SNVBAGLBSA-N 1 2 234.328 2.203 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(F)(F)[C@H](C)C2)nn1C ZINC000351992642 134031872 /nfs/dbraw/zinc/03/18/72/134031872.db2.gz FFEVTPSAVBGSIZ-SECBINFHSA-N 1 2 243.301 2.206 20 0 BEADLO Cc1cc(C[N@H+]2CCC(F)(F)[C@H](C)C2)nn1C ZINC000351992642 134031873 /nfs/dbraw/zinc/03/18/73/134031873.db2.gz FFEVTPSAVBGSIZ-SECBINFHSA-N 1 2 243.301 2.206 20 0 BEADLO C[C@H]1C[N@H+](CC(=O)OC(C)(C)C)CCC1(F)F ZINC000352018312 134036444 /nfs/dbraw/zinc/03/64/44/134036444.db2.gz PKOANIQRHBMVSF-VIFPVBQESA-N 1 2 249.301 2.305 20 0 BEADLO C[C@H]1C[N@@H+](CC(=O)OC(C)(C)C)CCC1(F)F ZINC000352018312 134036445 /nfs/dbraw/zinc/03/64/45/134036445.db2.gz PKOANIQRHBMVSF-VIFPVBQESA-N 1 2 249.301 2.305 20 0 BEADLO C[C@@H]1CCN(C(=O)CCn2cc[nH+]c2)CC1(C)C ZINC000336004587 134048609 /nfs/dbraw/zinc/04/86/09/134048609.db2.gz BOLHJMGDBXTMSP-GFCCVEGCSA-N 1 2 249.358 2.168 20 0 BEADLO Cc1noc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)n1 ZINC000336006186 134048954 /nfs/dbraw/zinc/04/89/54/134048954.db2.gz NKYDBNVROIDYBL-HTRCEHHLSA-N 1 2 249.236 2.151 20 0 BEADLO Cc1noc(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)n1 ZINC000336006186 134048955 /nfs/dbraw/zinc/04/89/55/134048955.db2.gz NKYDBNVROIDYBL-HTRCEHHLSA-N 1 2 249.236 2.151 20 0 BEADLO C[C@@H]1CCCC[C@@H]1CNC(=O)CCc1[nH]cc[nH+]1 ZINC000352059247 134054358 /nfs/dbraw/zinc/05/43/58/134054358.db2.gz HJZRFUOKNXPQSC-VXGBXAGGSA-N 1 2 249.358 2.285 20 0 BEADLO CC[C@@H]1C[C@H](C)CN1c1cc(C)[nH+]cn1 ZINC000336039600 134060776 /nfs/dbraw/zinc/06/07/76/134060776.db2.gz HALZSQULZPNMEX-GXSJLCMTSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1cscc1CNC(=O)c1c[nH+]c(C)[nH]1 ZINC000336059636 134067626 /nfs/dbraw/zinc/06/76/26/134067626.db2.gz UQGHXCVQVJUVQI-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO C(c1nnc2n1CCCCC2)[N@@H+]1CCC12CCC2 ZINC000336076609 134073491 /nfs/dbraw/zinc/07/34/91/134073491.db2.gz JFVXIJLDMFTOOP-UHFFFAOYSA-N 1 2 246.358 2.133 20 0 BEADLO C(c1nnc2n1CCCCC2)[N@H+]1CCC12CCC2 ZINC000336076609 134073492 /nfs/dbraw/zinc/07/34/92/134073492.db2.gz JFVXIJLDMFTOOP-UHFFFAOYSA-N 1 2 246.358 2.133 20 0 BEADLO Cc1nc(N2CC[C@@H]3CCC[C@@H]32)cc[nH+]1 ZINC000336090948 134078319 /nfs/dbraw/zinc/07/83/19/134078319.db2.gz MWKNKFOIWPPCBI-QWRGUYRKSA-N 1 2 203.289 2.164 20 0 BEADLO Cc1cnc(C[N@H+]2CC(C)(C)OC[C@@H]2C)s1 ZINC000336096404 134080519 /nfs/dbraw/zinc/08/05/19/134080519.db2.gz XTWLYDGZMWJBGR-VIFPVBQESA-N 1 2 240.372 2.451 20 0 BEADLO Cc1cnc(C[N@@H+]2CC(C)(C)OC[C@@H]2C)s1 ZINC000336096404 134080520 /nfs/dbraw/zinc/08/05/20/134080520.db2.gz XTWLYDGZMWJBGR-VIFPVBQESA-N 1 2 240.372 2.451 20 0 BEADLO Cn1cc[nH+]c1CNC1(C(F)F)CCCCC1 ZINC000352221700 134109675 /nfs/dbraw/zinc/10/96/75/134109675.db2.gz NQONZCIFTRVDJL-UHFFFAOYSA-N 1 2 243.301 2.478 20 0 BEADLO O=C([C@@H]1CC=CCC1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000336168397 134113754 /nfs/dbraw/zinc/11/37/54/134113754.db2.gz OQQNQMOEHRPSQD-NEPJUHHUSA-N 1 2 245.326 2.430 20 0 BEADLO O=C([C@@H]1CC=CCC1)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000336168400 134113823 /nfs/dbraw/zinc/11/38/23/134113823.db2.gz OQQNQMOEHRPSQD-VXGBXAGGSA-N 1 2 245.326 2.430 20 0 BEADLO C[C@H]1CCCC[C@@H]1c1noc(C[NH+](C)C)n1 ZINC000336181440 134119887 /nfs/dbraw/zinc/11/98/87/134119887.db2.gz ALYRSNTTWYIQCP-UWVGGRQHSA-N 1 2 223.320 2.425 20 0 BEADLO C[C@H]1C[C@H](C)N(C(=O)c2ccc3[nH+]ccn3c2)C1 ZINC000336183759 134120592 /nfs/dbraw/zinc/12/05/92/134120592.db2.gz ZICCGRXLAZXQEH-QWRGUYRKSA-N 1 2 243.310 2.205 20 0 BEADLO C[C@@H]1C[C@H](C)N(C(=O)c2ccc3[nH+]ccn3c2)C1 ZINC000336183757 134120814 /nfs/dbraw/zinc/12/08/14/134120814.db2.gz ZICCGRXLAZXQEH-MNOVXSKESA-N 1 2 243.310 2.205 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+]1CCC[C@@H](C)C1 ZINC000336189618 134122893 /nfs/dbraw/zinc/12/28/93/134122893.db2.gz IDEBEWODGPXZLQ-BDAKNGLRSA-N 1 2 211.334 2.331 20 0 BEADLO C[C@@H](c1csnn1)[N@H+]1CCC[C@@H](C)C1 ZINC000336189618 134122894 /nfs/dbraw/zinc/12/28/94/134122894.db2.gz IDEBEWODGPXZLQ-BDAKNGLRSA-N 1 2 211.334 2.331 20 0 BEADLO CC(C)n1cc[nH+]c1CN1C[C@@H](C)OC[C@H]1C ZINC000336208978 134133699 /nfs/dbraw/zinc/13/36/99/134133699.db2.gz VGSITOOHKNKRIO-VXGBXAGGSA-N 1 2 237.347 2.073 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@]1(C)CCC[C@@H]1C ZINC000336210886 134134083 /nfs/dbraw/zinc/13/40/83/134134083.db2.gz PWGZIYDPXVVIRQ-TVQRCGJNSA-N 1 2 235.331 2.161 20 0 BEADLO Cc1cnccc1C[N@@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000336212807 134135306 /nfs/dbraw/zinc/13/53/06/134135306.db2.gz OKIKQUWDEGIWGD-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cnccc1C[N@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000336212807 134135307 /nfs/dbraw/zinc/13/53/07/134135307.db2.gz OKIKQUWDEGIWGD-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc2[nH+]cc(CNc3ccon3)n2c1 ZINC000167807544 134154165 /nfs/dbraw/zinc/15/41/65/134154165.db2.gz HREAOYOYJQGGRW-UHFFFAOYSA-N 1 2 228.255 2.243 20 0 BEADLO CCCN(CCC)C(=O)[C@@H]1CCn2c[nH+]cc2C1 ZINC000170249910 134252267 /nfs/dbraw/zinc/25/22/67/134252267.db2.gz ARYHJPUHXTWIPO-GFCCVEGCSA-N 1 2 249.358 2.094 20 0 BEADLO Cc1nccnc1[C@H](C)[NH2+]Cc1nccs1 ZINC000219104581 134274700 /nfs/dbraw/zinc/27/47/00/134274700.db2.gz CXIGXUBMVFNDSY-VIFPVBQESA-N 1 2 234.328 2.092 20 0 BEADLO C[C@H](CC1CCCC1)C(=O)NCCc1[nH]cc[nH+]1 ZINC000174757423 134283294 /nfs/dbraw/zinc/28/32/94/134283294.db2.gz HBRHLRPHBRRRAT-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1C[N@H+](CCc2ccc(F)c(F)c2)CCO1 ZINC000177946772 134302172 /nfs/dbraw/zinc/30/21/72/134302172.db2.gz LQVOMLCXNWYIMF-SNVBAGLBSA-N 1 2 241.281 2.228 20 0 BEADLO C[C@@H]1C[N@@H+](CCc2ccc(F)c(F)c2)CCO1 ZINC000177946772 134302173 /nfs/dbraw/zinc/30/21/73/134302173.db2.gz LQVOMLCXNWYIMF-SNVBAGLBSA-N 1 2 241.281 2.228 20 0 BEADLO O=C(CC1CCC1)NCc1ccn2cc[nH+]c2c1 ZINC000178348873 134308907 /nfs/dbraw/zinc/30/89/07/134308907.db2.gz HATPHQYWLXBQKC-UHFFFAOYSA-N 1 2 243.310 2.141 20 0 BEADLO Cc1scc(C(=O)NCCc2[nH]cc[nH+]2)c1C ZINC000180120833 134323302 /nfs/dbraw/zinc/32/33/02/134323302.db2.gz OPARJCBUDJAWIG-UHFFFAOYSA-N 1 2 249.339 2.061 20 0 BEADLO COC[C@@H](C)N(C)c1nc(C)[nH+]c2c1CCCC2 ZINC000180428996 134327308 /nfs/dbraw/zinc/32/73/08/134327308.db2.gz ANGHCNLOFWXALS-SNVBAGLBSA-N 1 2 249.358 2.135 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nc3ccccc3o2)C[C@H](C)O1 ZINC000180316000 134329047 /nfs/dbraw/zinc/32/90/47/134329047.db2.gz AQXNVIQRZBEJDD-PHIMTYICSA-N 1 2 246.310 2.437 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nc3ccccc3o2)C[C@H](C)O1 ZINC000180316000 134329048 /nfs/dbraw/zinc/32/90/48/134329048.db2.gz AQXNVIQRZBEJDD-PHIMTYICSA-N 1 2 246.310 2.437 20 0 BEADLO CCOCC[N@H+](C)Cc1ccncc1Cl ZINC000181035964 134333289 /nfs/dbraw/zinc/33/32/89/134333289.db2.gz JSZKDWOGHLLKFY-UHFFFAOYSA-N 1 2 228.723 2.203 20 0 BEADLO CCOCC[N@@H+](C)Cc1ccncc1Cl ZINC000181035964 134333290 /nfs/dbraw/zinc/33/32/90/134333290.db2.gz JSZKDWOGHLLKFY-UHFFFAOYSA-N 1 2 228.723 2.203 20 0 BEADLO C[C@H]1CC(C(=O)NCCn2cc[nH+]c2)C[C@H](C)C1 ZINC000182532714 134345815 /nfs/dbraw/zinc/34/58/15/134345815.db2.gz XDRARPFMHQIBQN-VXGBXAGGSA-N 1 2 249.358 2.072 20 0 BEADLO CC1CC[NH+](Cc2noc(C3CC3)n2)CC1 ZINC000053602484 134745291 /nfs/dbraw/zinc/74/52/91/134745291.db2.gz UPQBXQNXACDCHZ-UHFFFAOYSA-N 1 2 221.304 2.179 20 0 BEADLO O[C@H](CNc1ccc2ccccc2[nH+]1)C(F)F ZINC000236560325 134830423 /nfs/dbraw/zinc/83/04/23/134830423.db2.gz TVYXNTLBDWAFBZ-SNVBAGLBSA-N 1 2 238.237 2.273 20 0 BEADLO CCOC(=O)C[N@@H+]1C[C@H](C)C[C@H]1c1cccnc1 ZINC000248391137 135001335 /nfs/dbraw/zinc/00/13/35/135001335.db2.gz CSUAXBZBRVXPPA-YPMHNXCESA-N 1 2 248.326 2.028 20 0 BEADLO CCOC(=O)C[N@H+]1C[C@H](C)C[C@H]1c1cccnc1 ZINC000248391137 135001336 /nfs/dbraw/zinc/00/13/36/135001336.db2.gz CSUAXBZBRVXPPA-YPMHNXCESA-N 1 2 248.326 2.028 20 0 BEADLO CCOC(=O)C[N@@H+]1C[C@@H](C)C[C@H]1c1cccnc1 ZINC000248391136 135002228 /nfs/dbraw/zinc/00/22/28/135002228.db2.gz CSUAXBZBRVXPPA-AAEUAGOBSA-N 1 2 248.326 2.028 20 0 BEADLO CCOC(=O)C[N@H+]1C[C@@H](C)C[C@H]1c1cccnc1 ZINC000248391136 135002230 /nfs/dbraw/zinc/00/22/30/135002230.db2.gz CSUAXBZBRVXPPA-AAEUAGOBSA-N 1 2 248.326 2.028 20 0 BEADLO CO[C@H](C)C[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000248424924 135008112 /nfs/dbraw/zinc/00/81/12/135008112.db2.gz NSUZWRLHICRHAT-ZYHUDNBSSA-N 1 2 241.356 2.156 20 0 BEADLO CO[C@H](C)C[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000248424924 135008114 /nfs/dbraw/zinc/00/81/14/135008114.db2.gz NSUZWRLHICRHAT-ZYHUDNBSSA-N 1 2 241.356 2.156 20 0 BEADLO CCc1nc(C[N@@H+]2C[C@H](C)CC[C@@H]2C)no1 ZINC000076149305 135013285 /nfs/dbraw/zinc/01/32/85/135013285.db2.gz QBPDSPHQNVMNDO-ZJUUUORDSA-N 1 2 223.320 2.252 20 0 BEADLO CCc1nc(C[N@H+]2C[C@H](C)CC[C@@H]2C)no1 ZINC000076149305 135013286 /nfs/dbraw/zinc/01/32/86/135013286.db2.gz QBPDSPHQNVMNDO-ZJUUUORDSA-N 1 2 223.320 2.252 20 0 BEADLO CCC[C@H]1C[N@@H+]([C@H](C)c2cnccn2)CCO1 ZINC000248617311 135017370 /nfs/dbraw/zinc/01/73/70/135017370.db2.gz KSVKCJSJRXCDBG-NEPJUHHUSA-N 1 2 235.331 2.039 20 0 BEADLO CCC[C@H]1C[N@H+]([C@H](C)c2cnccn2)CCO1 ZINC000248617311 135017371 /nfs/dbraw/zinc/01/73/71/135017371.db2.gz KSVKCJSJRXCDBG-NEPJUHHUSA-N 1 2 235.331 2.039 20 0 BEADLO C[C@H](c1cnccn1)[N@@H+]1C[C@@H](C)OC(C)(C)C1 ZINC000248639409 135017636 /nfs/dbraw/zinc/01/76/36/135017636.db2.gz XQKBGVJBRZUECV-GHMZBOCLSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H](c1cnccn1)[N@H+]1C[C@@H](C)OC(C)(C)C1 ZINC000248639409 135017638 /nfs/dbraw/zinc/01/76/38/135017638.db2.gz XQKBGVJBRZUECV-GHMZBOCLSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@@H](Nc1ncncc1Cl)c1[nH]cc[nH+]1 ZINC000163656721 135036318 /nfs/dbraw/zinc/03/63/18/135036318.db2.gz HVUBGABRCWDAQV-MRVPVSSYSA-N 1 2 237.694 2.416 20 0 BEADLO C[C@H](c1cccnc1)[N@@H+]1CCC(=O)[C@H](C)C1 ZINC000251855539 135079140 /nfs/dbraw/zinc/07/91/40/135079140.db2.gz RYARLZWOMNSDHU-GHMZBOCLSA-N 1 2 218.300 2.054 20 0 BEADLO C[C@H](c1cccnc1)[N@H+]1CCC(=O)[C@H](C)C1 ZINC000251855539 135079143 /nfs/dbraw/zinc/07/91/43/135079143.db2.gz RYARLZWOMNSDHU-GHMZBOCLSA-N 1 2 218.300 2.054 20 0 BEADLO c1coc([C@@H]2C[N@H+](C[C@H]3CCC=CO3)CCO2)c1 ZINC000253309344 135126052 /nfs/dbraw/zinc/12/60/52/135126052.db2.gz DNPKBLFWVIZNIV-OCCSQVGLSA-N 1 2 249.310 2.346 20 0 BEADLO c1coc([C@@H]2C[N@@H+](C[C@H]3CCC=CO3)CCO2)c1 ZINC000253309344 135126054 /nfs/dbraw/zinc/12/60/54/135126054.db2.gz DNPKBLFWVIZNIV-OCCSQVGLSA-N 1 2 249.310 2.346 20 0 BEADLO Fc1ccc2cc(C[NH+]3CCOCC3)[nH]c2c1 ZINC000257904345 135132199 /nfs/dbraw/zinc/13/21/99/135132199.db2.gz BKCYQXXMMVLCSA-UHFFFAOYSA-N 1 2 234.274 2.139 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C1CCSCC1 ZINC000264895781 135140303 /nfs/dbraw/zinc/14/03/03/135140303.db2.gz HRZHPXHJQAFKGG-UHFFFAOYSA-N 1 2 236.340 2.472 20 0 BEADLO C[C@@H](O)CCNc1ccc2ccccc2[nH+]1 ZINC000078771271 135150232 /nfs/dbraw/zinc/15/02/32/135150232.db2.gz KSEVXCKQYZGCOE-SNVBAGLBSA-N 1 2 216.284 2.418 20 0 BEADLO Cc1cc(NC[C@@H]2CCCCS2)nc[nH+]1 ZINC000087686125 135165364 /nfs/dbraw/zinc/16/53/64/135165364.db2.gz GMKIFKWMIKOXIO-JTQLQIEISA-N 1 2 223.345 2.483 20 0 BEADLO Cc1cc(N[C@H]2CCOC2)nc(C(C)C)[nH+]1 ZINC000087787914 135171340 /nfs/dbraw/zinc/17/13/40/135171340.db2.gz VEJGDNYURZPKSF-JTQLQIEISA-N 1 2 221.304 2.109 20 0 BEADLO C[NH2+]Cc1noc([C@H]2CCC(C)(C)C2)n1 ZINC000261543730 135184917 /nfs/dbraw/zinc/18/49/17/135184917.db2.gz IAOLTHVCJMFINS-QMMMGPOBSA-N 1 2 209.293 2.083 20 0 BEADLO COC(=O)[C@@H](C1CC1)[N@H+](C)Cc1cccs1 ZINC000084093459 135185791 /nfs/dbraw/zinc/18/57/91/135185791.db2.gz HOOMZAZQJNQETI-LLVKDONJSA-N 1 2 239.340 2.132 20 0 BEADLO COC(=O)[C@@H](C1CC1)[N@@H+](C)Cc1cccs1 ZINC000084093459 135185793 /nfs/dbraw/zinc/18/57/93/135185793.db2.gz HOOMZAZQJNQETI-LLVKDONJSA-N 1 2 239.340 2.132 20 0 BEADLO C[C@@H](c1cnccn1)[N@H+](C)Cc1ccoc1 ZINC000342271184 135259461 /nfs/dbraw/zinc/25/94/61/135259461.db2.gz HRQPQXLWUZUJKM-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@@H](c1cnccn1)[N@@H+](C)Cc1ccoc1 ZINC000342271184 135259462 /nfs/dbraw/zinc/25/94/62/135259462.db2.gz HRQPQXLWUZUJKM-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)Cc1cccc2c1NCC2 ZINC000262011141 135272162 /nfs/dbraw/zinc/27/21/62/135272162.db2.gz VDVVADAZIAMEEX-UHFFFAOYSA-N 1 2 242.326 2.010 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)Cc1cccc2c1NCC2 ZINC000262011141 135272164 /nfs/dbraw/zinc/27/21/64/135272164.db2.gz VDVVADAZIAMEEX-UHFFFAOYSA-N 1 2 242.326 2.010 20 0 BEADLO Cc1c[nH+]c(CN(C)[C@H](C)c2ccccn2)n1C ZINC000342795661 135319923 /nfs/dbraw/zinc/31/99/23/135319923.db2.gz HCIPAYJYJQKEEX-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1c[nH+]c(CN(C)Cc2cccc(F)c2)n1C ZINC000342799812 135320425 /nfs/dbraw/zinc/32/04/25/135320425.db2.gz OPHFVMKPFKYULA-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO COC(=O)[C@H](C)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000334278283 135333778 /nfs/dbraw/zinc/33/37/78/135333778.db2.gz DVSSENGBJWNDQB-UWVGGRQHSA-N 1 2 219.284 2.125 20 0 BEADLO COC(=O)[C@H](C)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000334278283 135333779 /nfs/dbraw/zinc/33/37/79/135333779.db2.gz DVSSENGBJWNDQB-UWVGGRQHSA-N 1 2 219.284 2.125 20 0 BEADLO COCc1cnc(C[N@H+](C)CCSC)s1 ZINC000342939943 135337632 /nfs/dbraw/zinc/33/76/32/135337632.db2.gz QTQUENLNUDPXAK-UHFFFAOYSA-N 1 2 246.401 2.084 20 0 BEADLO COCc1cnc(C[N@@H+](C)CCSC)s1 ZINC000342939943 135337633 /nfs/dbraw/zinc/33/76/33/135337633.db2.gz QTQUENLNUDPXAK-UHFFFAOYSA-N 1 2 246.401 2.084 20 0 BEADLO COc1c(O)cccc1C[N@@H+]1CC[C@@](C)(F)C1 ZINC000334330257 135354559 /nfs/dbraw/zinc/35/45/59/135354559.db2.gz OIVCQVOQRXUGRX-CYBMUJFWSA-N 1 2 239.290 2.335 20 0 BEADLO COc1c(O)cccc1C[N@H+]1CC[C@@](C)(F)C1 ZINC000334330257 135354561 /nfs/dbraw/zinc/35/45/61/135354561.db2.gz OIVCQVOQRXUGRX-CYBMUJFWSA-N 1 2 239.290 2.335 20 0 BEADLO CCN(c1nc(C)[nH+]c(N(C)C)n1)C1CCCC1 ZINC000343157407 135363189 /nfs/dbraw/zinc/36/31/89/135363189.db2.gz HXZMDUGAAJLWLG-UHFFFAOYSA-N 1 2 249.362 2.015 20 0 BEADLO CCN(c1nc(N(C)C)nc(C)[nH+]1)C1CCCC1 ZINC000343157407 135363190 /nfs/dbraw/zinc/36/31/90/135363190.db2.gz HXZMDUGAAJLWLG-UHFFFAOYSA-N 1 2 249.362 2.015 20 0 BEADLO C[C@H]1c2ccccc2C[N@H+]1Cc1ccnn1C ZINC000334349756 135367728 /nfs/dbraw/zinc/36/77/28/135367728.db2.gz APHBJOPPUXXQHW-NSHDSACASA-N 1 2 227.311 2.497 20 0 BEADLO C[C@H]1c2ccccc2C[N@@H+]1Cc1ccnn1C ZINC000334349756 135367730 /nfs/dbraw/zinc/36/77/30/135367730.db2.gz APHBJOPPUXXQHW-NSHDSACASA-N 1 2 227.311 2.497 20 0 BEADLO C1CCC2(C1)CC[NH+]([C@H]1CCOC1)CC2 ZINC000334357840 135370312 /nfs/dbraw/zinc/37/03/12/135370312.db2.gz RACARAXQIHTCHJ-LBPRGKRZSA-N 1 2 209.333 2.432 20 0 BEADLO FC1(F)CCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000334374776 135376954 /nfs/dbraw/zinc/37/69/54/135376954.db2.gz UMCKZLWNOJKBOG-UHFFFAOYSA-N 1 2 223.226 2.408 20 0 BEADLO Cc1cc(N2CC[C@@H](C)[C@H]2CO)nc(C(C)C)[nH+]1 ZINC000299963638 135383366 /nfs/dbraw/zinc/38/33/66/135383366.db2.gz KXKQZSBDAKTQRB-ZYHUDNBSSA-N 1 2 249.358 2.116 20 0 BEADLO Cc1nnc(C[N@@H+]2CCc3cc(C)ccc3C2)o1 ZINC000334402717 135390891 /nfs/dbraw/zinc/39/08/91/135390891.db2.gz GDKXDTRCIWUBTC-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1nnc(C[N@H+]2CCc3cc(C)ccc3C2)o1 ZINC000334402717 135390892 /nfs/dbraw/zinc/39/08/92/135390892.db2.gz GDKXDTRCIWUBTC-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO C[C@H](O)CC[N@H+](C)Cc1ncc(C(C)(C)C)o1 ZINC000075780579 135391567 /nfs/dbraw/zinc/39/15/67/135391567.db2.gz KYLZVIULMJHUEY-JTQLQIEISA-N 1 2 240.347 2.175 20 0 BEADLO C[C@H](O)CC[N@@H+](C)Cc1ncc(C(C)(C)C)o1 ZINC000075780579 135391568 /nfs/dbraw/zinc/39/15/68/135391568.db2.gz KYLZVIULMJHUEY-JTQLQIEISA-N 1 2 240.347 2.175 20 0 BEADLO c1nc(CNCc2cn3ccccc3[nH+]2)cs1 ZINC000078720904 135395047 /nfs/dbraw/zinc/39/50/47/135395047.db2.gz JWAKWUCXMHJBAW-UHFFFAOYSA-N 1 2 244.323 2.081 20 0 BEADLO Cc1nc2cc(NCc3c[nH+]cn3C)ccc2o1 ZINC000078779953 135395351 /nfs/dbraw/zinc/39/53/51/135395351.db2.gz QMJJICRFJYCIJB-UHFFFAOYSA-N 1 2 242.282 2.482 20 0 BEADLO CC[C@H](C)C[N@H+](CCOC)CC(F)F ZINC000088506109 135522634 /nfs/dbraw/zinc/52/26/34/135522634.db2.gz IRBRYWFDTLNNDN-VIFPVBQESA-N 1 2 209.280 2.246 20 0 BEADLO CC[C@H](C)C[N@@H+](CCOC)CC(F)F ZINC000088506109 135522635 /nfs/dbraw/zinc/52/26/35/135522635.db2.gz IRBRYWFDTLNNDN-VIFPVBQESA-N 1 2 209.280 2.246 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)[C@@H]1CCn2c[nH+]cc2C1 ZINC000343325664 135655174 /nfs/dbraw/zinc/65/51/74/135655174.db2.gz SXTPJNKVCIEFOM-VXGBXAGGSA-N 1 2 249.358 2.093 20 0 BEADLO C[C@H]1CC[C@H]1[NH+]=c1[nH]c2c(cccc2F)n1C ZINC000343842682 135703292 /nfs/dbraw/zinc/70/32/92/135703292.db2.gz HIBAIYCGASFOLF-WCBMZHEXSA-N 1 2 233.290 2.345 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H]2C[C@@H]2c2ccccc2)c[nH+]1 ZINC000335002046 135862845 /nfs/dbraw/zinc/86/28/45/135862845.db2.gz BKTOWWMSZIFNIU-NEPJUHHUSA-N 1 2 241.294 2.004 20 0 BEADLO C[C@@]12CC[N@H+](Cc3csnn3)C[C@@H]1C2(F)F ZINC000335283646 136001665 /nfs/dbraw/zinc/00/16/65/136001665.db2.gz FBFOCTPMHYLDEA-DTWKUNHWSA-N 1 2 245.298 2.015 20 0 BEADLO C[C@@]12CC[N@@H+](Cc3csnn3)C[C@@H]1C2(F)F ZINC000335283646 136001666 /nfs/dbraw/zinc/00/16/66/136001666.db2.gz FBFOCTPMHYLDEA-DTWKUNHWSA-N 1 2 245.298 2.015 20 0 BEADLO C[C@H]1CCC[C@@H]1CC(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000347711655 136002903 /nfs/dbraw/zinc/00/29/03/136002903.db2.gz UTYABCUHKQJQTG-WDEREUQCSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@H]1CCC[C@H]1CC(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000347711649 136003275 /nfs/dbraw/zinc/00/32/75/136003275.db2.gz UTYABCUHKQJQTG-QWRGUYRKSA-N 1 2 235.331 2.194 20 0 BEADLO Cc1nc(N2CC[C@H](C3CC3)C2)cc[nH+]1 ZINC000335315667 136024567 /nfs/dbraw/zinc/02/45/67/136024567.db2.gz IKSNDRAKGZVIIU-NSHDSACASA-N 1 2 203.289 2.021 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@@H](C(C)C)C2)nc1 ZINC000335316443 136025290 /nfs/dbraw/zinc/02/52/90/136025290.db2.gz QGEKHGZWUSHRPG-CQSZACIVSA-N 1 2 234.343 2.247 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@@H](C(C)C)C2)nc1 ZINC000335316443 136025291 /nfs/dbraw/zinc/02/52/91/136025291.db2.gz QGEKHGZWUSHRPG-CQSZACIVSA-N 1 2 234.343 2.247 20 0 BEADLO CC[C@H](F)C[N@@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000348147606 136039461 /nfs/dbraw/zinc/03/94/61/136039461.db2.gz GTLAJBBCRNGMDN-GXSJLCMTSA-N 1 2 211.284 2.295 20 0 BEADLO CC[C@H](F)C[N@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000348147606 136039462 /nfs/dbraw/zinc/03/94/62/136039462.db2.gz GTLAJBBCRNGMDN-GXSJLCMTSA-N 1 2 211.284 2.295 20 0 BEADLO Cc1nccc(C[N@@H+]2CCn3cccc3[C@@H]2C)n1 ZINC000335327464 136052155 /nfs/dbraw/zinc/05/21/55/136052155.db2.gz KQMQVMGKLDIEMR-NSHDSACASA-N 1 2 242.326 2.163 20 0 BEADLO Cc1nccc(C[N@H+]2CCn3cccc3[C@@H]2C)n1 ZINC000335327464 136052156 /nfs/dbraw/zinc/05/21/56/136052156.db2.gz KQMQVMGKLDIEMR-NSHDSACASA-N 1 2 242.326 2.163 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)[C@@H]1CC[C@H](C)C1 ZINC000348270675 136058882 /nfs/dbraw/zinc/05/88/82/136058882.db2.gz GWOYSCVRRFXBPI-WDEREUQCSA-N 1 2 248.326 2.143 20 0 BEADLO CCc1ccccc1C[N@H+](CC(=O)OC)C1CC1 ZINC000348237674 136061186 /nfs/dbraw/zinc/06/11/86/136061186.db2.gz ZTFMGYHSMNPSJJ-UHFFFAOYSA-N 1 2 247.338 2.386 20 0 BEADLO CCc1ccccc1C[N@@H+](CC(=O)OC)C1CC1 ZINC000348237674 136061187 /nfs/dbraw/zinc/06/11/87/136061187.db2.gz ZTFMGYHSMNPSJJ-UHFFFAOYSA-N 1 2 247.338 2.386 20 0 BEADLO Cn1c[nH+]cc1COc1cccc2c1OCCC2 ZINC000335347697 136067060 /nfs/dbraw/zinc/06/70/60/136067060.db2.gz VJXCKLBWQWQCPM-UHFFFAOYSA-N 1 2 244.294 2.324 20 0 BEADLO CO[C@@H]1CCN(c2cc(C)[nH+]c(C(C)C)n2)C1 ZINC000348362389 136072469 /nfs/dbraw/zinc/07/24/69/136072469.db2.gz IAUDWKHEFZEZBS-LLVKDONJSA-N 1 2 235.331 2.134 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1ccc(F)cc1 ZINC000335369618 136082782 /nfs/dbraw/zinc/08/27/82/136082782.db2.gz FMUSTJUTJMEZDM-UHFFFAOYSA-N 1 2 246.241 2.482 20 0 BEADLO Cc1cc(N[C@H]2CCC[C@H](F)C2)nc[nH+]1 ZINC000335382116 136087646 /nfs/dbraw/zinc/08/76/46/136087646.db2.gz YHPDVXZPNNRZOU-UWVGGRQHSA-N 1 2 209.268 2.478 20 0 BEADLO CC1(C(N)=O)C[NH+](Cc2nc3ccccc3o2)C1 ZINC000335390831 136090588 /nfs/dbraw/zinc/09/05/88/136090588.db2.gz XQPDTWYMJMMYIU-UHFFFAOYSA-N 1 2 245.282 2.185 20 0 BEADLO CCn1cncc1C[NH+]1CC2(CCC2(F)F)C1 ZINC000335595691 136104642 /nfs/dbraw/zinc/10/46/42/136104642.db2.gz MSSUKAMKQOTVSF-UHFFFAOYSA-N 1 2 241.285 2.134 20 0 BEADLO CCn1c[nH+]cc1CN1CC2(CCC2(F)F)C1 ZINC000335595691 136104643 /nfs/dbraw/zinc/10/46/43/136104643.db2.gz MSSUKAMKQOTVSF-UHFFFAOYSA-N 1 2 241.285 2.134 20 0 BEADLO Cc1cc(C)c(CNC(=O)N2C[C@@H](C)[C@@H]2C)c[nH+]1 ZINC000335579462 136112037 /nfs/dbraw/zinc/11/20/37/136112037.db2.gz KBMBAWYWYDKHRX-PWSUYJOCSA-N 1 2 247.342 2.248 20 0 BEADLO C[C@H]([NH2+]c1ccc(OCC(N)=O)cc1)C1CCC1 ZINC000182931614 397828569 /nfs/dbraw/zinc/82/85/69/397828569.db2.gz SOKRFKAAAQOUAX-JTQLQIEISA-N 1 2 248.326 2.151 20 0 BEADLO FC(F)(F)C1CC[NH+](Cc2c[nH]cn2)CC1 ZINC000179963834 397854813 /nfs/dbraw/zinc/85/48/13/397854813.db2.gz JKYQPFGWBNNHBB-UHFFFAOYSA-N 1 2 233.237 2.184 20 0 BEADLO FC(F)(F)C1CC[NH+](Cc2cnc[nH]2)CC1 ZINC000179963834 397854818 /nfs/dbraw/zinc/85/48/18/397854818.db2.gz JKYQPFGWBNNHBB-UHFFFAOYSA-N 1 2 233.237 2.184 20 0 BEADLO Cn1cc[nH+]c1[C@@H](NCC(C)(F)F)C1CC1 ZINC000382170156 397873071 /nfs/dbraw/zinc/87/30/71/397873071.db2.gz WCLRBNOLSVWAEB-VIFPVBQESA-N 1 2 229.274 2.116 20 0 BEADLO C[C@H]([NH2+]Cc1ncccn1)c1cccs1 ZINC000054459209 397964969 /nfs/dbraw/zinc/96/49/69/397964969.db2.gz UUDKXAMUPKTZAF-VIFPVBQESA-N 1 2 219.313 2.389 20 0 BEADLO CC[C@@H](F)CN(C)Cc1cn2c([nH+]1)CCCC2 ZINC000440528484 397931025 /nfs/dbraw/zinc/93/10/25/397931025.db2.gz BXYPEAZJIAKMRZ-LLVKDONJSA-N 1 2 239.338 2.399 20 0 BEADLO CCCN1CC[N@H+](C[C@H](F)CC)C(C)(C)C1=O ZINC000440528145 397931417 /nfs/dbraw/zinc/93/14/17/397931417.db2.gz CXVKGRHSGCYERX-LLVKDONJSA-N 1 2 244.354 2.067 20 0 BEADLO CCCN1CC[N@@H+](C[C@H](F)CC)C(C)(C)C1=O ZINC000440528145 397931422 /nfs/dbraw/zinc/93/14/22/397931422.db2.gz CXVKGRHSGCYERX-LLVKDONJSA-N 1 2 244.354 2.067 20 0 BEADLO CC(C)c1occc1C(=O)NCCc1[nH]cc[nH+]1 ZINC000359496799 397954351 /nfs/dbraw/zinc/95/43/51/397954351.db2.gz WZOGPLIFXJABBL-UHFFFAOYSA-N 1 2 247.298 2.099 20 0 BEADLO Nc1ccc(NC(=O)C=C2CCCCC2)c[nH+]1 ZINC000269148142 397956569 /nfs/dbraw/zinc/95/65/69/397956569.db2.gz JYFTUSCUUAYFSU-UHFFFAOYSA-N 1 2 231.299 2.493 20 0 BEADLO Cc1nc(NC[C@H]2CCC[C@H](C)C2)nc(N)[nH+]1 ZINC000302631034 397957478 /nfs/dbraw/zinc/95/74/78/397957478.db2.gz QOAGAYHKKVIKAV-WPRPVWTQSA-N 1 2 235.335 2.000 20 0 BEADLO Cc1nc(N)nc(NC[C@H]2CCC[C@H](C)C2)[nH+]1 ZINC000302631034 397957480 /nfs/dbraw/zinc/95/74/80/397957480.db2.gz QOAGAYHKKVIKAV-WPRPVWTQSA-N 1 2 235.335 2.000 20 0 BEADLO CO[C@@H]1C[C@H]([N@H+](C)CC(F)F)C12CCC2 ZINC000650184795 397961582 /nfs/dbraw/zinc/96/15/82/397961582.db2.gz QQMWJUQEMFUVEW-DTWKUNHWSA-N 1 2 219.275 2.141 20 0 BEADLO CO[C@@H]1C[C@H]([N@@H+](C)CC(F)F)C12CCC2 ZINC000650184795 397961584 /nfs/dbraw/zinc/96/15/84/397961584.db2.gz QQMWJUQEMFUVEW-DTWKUNHWSA-N 1 2 219.275 2.141 20 0 BEADLO CC(C)CN(C(=O)C[C@@H](C)n1cc[nH+]c1)C1CC1 ZINC000649580238 397968494 /nfs/dbraw/zinc/96/84/94/397968494.db2.gz ZFOYTAGWRPLJCT-GFCCVEGCSA-N 1 2 249.358 2.481 20 0 BEADLO CC[C@@H]1CN(c2cc[nH+]c(C(C)C)n2)CCO1 ZINC000110127478 397902983 /nfs/dbraw/zinc/90/29/83/397902983.db2.gz RQNAEUJURGAPFF-LLVKDONJSA-N 1 2 235.331 2.215 20 0 BEADLO CCCCCCNC(=O)[C@@H]1CCc2[nH+]ccn2C1 ZINC000368797550 397918985 /nfs/dbraw/zinc/91/89/85/397918985.db2.gz LCNKEHWHCUOQDC-GFCCVEGCSA-N 1 2 249.358 2.142 20 0 BEADLO COCc1cc[nH+]c(NCc2cncs2)c1 ZINC000650243471 398006603 /nfs/dbraw/zinc/00/66/03/398006603.db2.gz AFKQXPWEBPNORJ-UHFFFAOYSA-N 1 2 235.312 2.297 20 0 BEADLO C[C@@H]1CC[N@@H+]1Cc1cnc(Cl)s1 ZINC000575596045 398008460 /nfs/dbraw/zinc/00/84/60/398008460.db2.gz PLTUJNKFFGJCGB-ZCFIWIBFSA-N 1 2 202.710 2.391 20 0 BEADLO C[C@@H]1CC[N@H+]1Cc1cnc(Cl)s1 ZINC000575596045 398008463 /nfs/dbraw/zinc/00/84/63/398008463.db2.gz PLTUJNKFFGJCGB-ZCFIWIBFSA-N 1 2 202.710 2.391 20 0 BEADLO COC(=O)c1occc1C[N@H+](C)Cc1ccc[nH]1 ZINC000354033408 398046345 /nfs/dbraw/zinc/04/63/45/398046345.db2.gz LCZSEPZZFHRXQM-UHFFFAOYSA-N 1 2 248.282 2.026 20 0 BEADLO COC(=O)c1occc1C[N@@H+](C)Cc1ccc[nH]1 ZINC000354033408 398046348 /nfs/dbraw/zinc/04/63/48/398046348.db2.gz LCZSEPZZFHRXQM-UHFFFAOYSA-N 1 2 248.282 2.026 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2conc2C)cn1 ZINC000646160190 398021389 /nfs/dbraw/zinc/02/13/89/398021389.db2.gz YBBIDMWHJNFVLI-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2conc2C)cn1 ZINC000646160190 398021394 /nfs/dbraw/zinc/02/13/94/398021394.db2.gz YBBIDMWHJNFVLI-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO C[C@@H]([NH2+]Cc1nccn1C)c1ccccc1F ZINC000042224964 398030813 /nfs/dbraw/zinc/03/08/13/398030813.db2.gz HMHFODSFVDMACF-SNVBAGLBSA-N 1 2 233.290 2.410 20 0 BEADLO C[N@@H+](Cc1cocn1)Cc1cccs1 ZINC000277954677 398034680 /nfs/dbraw/zinc/03/46/80/398034680.db2.gz IRTRHERBRMJCDL-UHFFFAOYSA-N 1 2 208.286 2.368 20 0 BEADLO C[N@H+](Cc1cocn1)Cc1cccs1 ZINC000277954677 398034685 /nfs/dbraw/zinc/03/46/85/398034685.db2.gz IRTRHERBRMJCDL-UHFFFAOYSA-N 1 2 208.286 2.368 20 0 BEADLO C[C@@H]([NH2+]Cc1cccc(O)c1)C(F)F ZINC000383913314 398049263 /nfs/dbraw/zinc/04/92/63/398049263.db2.gz FWNFOERORZQQQT-SSDOTTSWSA-N 1 2 201.216 2.135 20 0 BEADLO COc1c(C)[nH+]c(C2CC2)nc1NCC(C)C ZINC000555008214 397988637 /nfs/dbraw/zinc/98/86/37/397988637.db2.gz URNQSIWJULIQOB-UHFFFAOYSA-N 1 2 235.331 2.161 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2oc(C)nc2C)[C@@H](C)CO1 ZINC000649735807 398076845 /nfs/dbraw/zinc/07/68/45/398076845.db2.gz QSPKNDPLIMUJOE-JOYOIKCWSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2oc(C)nc2C)[C@@H](C)CO1 ZINC000649735807 398076851 /nfs/dbraw/zinc/07/68/51/398076851.db2.gz QSPKNDPLIMUJOE-JOYOIKCWSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccncc2F)[C@H](C)CO1 ZINC000649737063 398079552 /nfs/dbraw/zinc/07/95/52/398079552.db2.gz QFSGCTNNKKLUNK-PWSUYJOCSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccncc2F)[C@H](C)CO1 ZINC000649737063 398079555 /nfs/dbraw/zinc/07/95/55/398079555.db2.gz QFSGCTNNKKLUNK-PWSUYJOCSA-N 1 2 238.306 2.220 20 0 BEADLO CC[N@H+](Cc1cscn1)[C@H]1CCCOC1 ZINC000649758965 398089133 /nfs/dbraw/zinc/08/91/33/398089133.db2.gz BGALRERYWTXISE-NSHDSACASA-N 1 2 226.345 2.144 20 0 BEADLO CC[N@@H+](Cc1cscn1)[C@H]1CCCOC1 ZINC000649758965 398089134 /nfs/dbraw/zinc/08/91/34/398089134.db2.gz BGALRERYWTXISE-NSHDSACASA-N 1 2 226.345 2.144 20 0 BEADLO Cc1occc1CNC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000649715716 398056811 /nfs/dbraw/zinc/05/68/11/398056811.db2.gz KIJFBUWNOCDROQ-SNVBAGLBSA-N 1 2 247.298 2.052 20 0 BEADLO C[C@@H](CC(=O)N1CCC2(CC2)CC1)n1cc[nH+]c1 ZINC000649715434 398056931 /nfs/dbraw/zinc/05/69/31/398056931.db2.gz BPIDQGRJGXPTDX-LBPRGKRZSA-N 1 2 247.342 2.237 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@@H+]1Cc1ncc(C)cn1 ZINC000649717040 398059139 /nfs/dbraw/zinc/05/91/39/398059139.db2.gz UOAXJMAZSAFYKM-LBPRGKRZSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@H+]1Cc1ncc(C)cn1 ZINC000649717040 398059143 /nfs/dbraw/zinc/05/91/43/398059143.db2.gz UOAXJMAZSAFYKM-LBPRGKRZSA-N 1 2 249.358 2.174 20 0 BEADLO CCn1cc[nH+]c1CN[C@H](C)C(C)(F)F ZINC000389473895 398096904 /nfs/dbraw/zinc/09/69/04/398096904.db2.gz WDNUKXGRKHXAKK-MRVPVSSYSA-N 1 2 217.263 2.036 20 0 BEADLO CCc1csc(N[C@@H](C)Cn2cc[nH+]c2)n1 ZINC000061894601 398109600 /nfs/dbraw/zinc/10/96/00/398109600.db2.gz BETWORKVPZOPFK-VIFPVBQESA-N 1 2 236.344 2.403 20 0 BEADLO Fc1ccc(C[NH2+]Cc2cocn2)cc1 ZINC000237747382 398112426 /nfs/dbraw/zinc/11/24/26/398112426.db2.gz LUIUWMBBRCIVNF-UHFFFAOYSA-N 1 2 206.220 2.104 20 0 BEADLO CC(C)[C@@H]1CCC[C@H](NC(=O)Cn2cc[nH+]c2)C1 ZINC000073387414 398112910 /nfs/dbraw/zinc/11/29/10/398112910.db2.gz LVUOJJRDPYZFOD-OLZOCXBDSA-N 1 2 249.358 2.214 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H](C)OCC23CCC3)no1 ZINC000649825626 398128082 /nfs/dbraw/zinc/12/80/82/398128082.db2.gz CXNSPEXJYXAIPO-NSHDSACASA-N 1 2 236.315 2.126 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H](C)OCC23CCC3)no1 ZINC000649825626 398128084 /nfs/dbraw/zinc/12/80/84/398128084.db2.gz CXNSPEXJYXAIPO-NSHDSACASA-N 1 2 236.315 2.126 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)C(F)F)ccn1 ZINC000391128668 398135246 /nfs/dbraw/zinc/13/52/46/398135246.db2.gz FKTYMBZWNJKPJB-QMMMGPOBSA-N 1 2 200.232 2.133 20 0 BEADLO CC(C)CNc1nc(N)c2ccccc2[nH+]1 ZINC000301861842 167018561 /nfs/dbraw/zinc/01/85/61/167018561.db2.gz FZGYBPHCUVSFHU-UHFFFAOYSA-N 1 2 216.288 2.280 20 0 BEADLO COc1nscc1C[NH+]1CCC(F)CC1 ZINC001648169360 1172809273 /nfs/dbraw/zinc/80/92/73/1172809273.db2.gz UCIXSTWHJKNXGZ-UHFFFAOYSA-N 1 2 230.308 2.086 20 0 BEADLO CCCCCC[N@@H+]1CCSC[C@H]1C(=O)OC ZINC001648336457 1172826978 /nfs/dbraw/zinc/82/69/78/1172826978.db2.gz KUNNFAOPKKIOCA-NSHDSACASA-N 1 2 245.388 2.157 20 0 BEADLO CCCCCC[N@H+]1CCSC[C@H]1C(=O)OC ZINC001648336457 1172826988 /nfs/dbraw/zinc/82/69/88/1172826988.db2.gz KUNNFAOPKKIOCA-NSHDSACASA-N 1 2 245.388 2.157 20 0 BEADLO Cn1cc[nH+]c1CCNC(=O)CC1CCCCC1 ZINC000063487644 1172829471 /nfs/dbraw/zinc/82/94/71/1172829471.db2.gz OBRHMRQIIOHVQM-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO C/C=C\C(=O)N1CCC[C@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001649369514 1172873676 /nfs/dbraw/zinc/87/36/76/1172873676.db2.gz IGLOOAOBEKSMFL-QZPNVGJNSA-N 1 2 233.315 2.266 20 0 BEADLO COc1ccc(C)cc1C[NH2+]Cc1[nH]ncc1C ZINC000685612602 487564650 /nfs/dbraw/zinc/56/46/50/487564650.db2.gz GFHUOQZADJDFPU-UHFFFAOYSA-N 1 2 245.326 2.325 20 0 BEADLO COc1ccc(C)cc1C[NH2+]Cc1n[nH]cc1C ZINC000685612602 487564653 /nfs/dbraw/zinc/56/46/53/487564653.db2.gz GFHUOQZADJDFPU-UHFFFAOYSA-N 1 2 245.326 2.325 20 0 BEADLO C[C@@H]1CCC[C@@H](OC(=O)[C@H]2CCCC[NH2+]2)C1 ZINC000085501069 1172883275 /nfs/dbraw/zinc/88/32/75/1172883275.db2.gz YTBDTTBTGHSCIV-IJLUTSLNSA-N 1 2 225.332 2.250 20 0 BEADLO CC[C@@H](C)CCC(=O)N[C@@H]1CCc2c[nH+]cn2C1 ZINC000672156781 487589283 /nfs/dbraw/zinc/58/92/83/487589283.db2.gz UNKGRKLIYQPZFB-VXGBXAGGSA-N 1 2 249.358 2.140 20 0 BEADLO Cn1c[nH+]c2cc(Nc3cnc(F)cn3)ccc21 ZINC001651572156 1172959164 /nfs/dbraw/zinc/95/91/64/1172959164.db2.gz FGHAZWAIQRRSJO-UHFFFAOYSA-N 1 2 243.245 2.246 20 0 BEADLO c1n[nH]cc1C[N@@H+]1CCO[C@@H](C2CCCCC2)C1 ZINC000680487118 487604854 /nfs/dbraw/zinc/60/48/54/487604854.db2.gz RLQKDVUXAVZJEF-CQSZACIVSA-N 1 2 249.358 2.191 20 0 BEADLO c1n[nH]cc1C[N@H+]1CCO[C@@H](C2CCCCC2)C1 ZINC000680487118 487604859 /nfs/dbraw/zinc/60/48/59/487604859.db2.gz RLQKDVUXAVZJEF-CQSZACIVSA-N 1 2 249.358 2.191 20 0 BEADLO CCCCOCC[N@H+](C)Cc1nnc(C)s1 ZINC000662263040 409555210 /nfs/dbraw/zinc/55/52/10/409555210.db2.gz YXIHTGVFGYSAMZ-UHFFFAOYSA-N 1 2 243.376 2.095 20 0 BEADLO CCCCOCC[N@@H+](C)Cc1nnc(C)s1 ZINC000662263040 409555220 /nfs/dbraw/zinc/55/52/20/409555220.db2.gz YXIHTGVFGYSAMZ-UHFFFAOYSA-N 1 2 243.376 2.095 20 0 BEADLO Cc1occc1C[N@@H+]1CCO[C@@](C)(C(F)F)C1 ZINC000668826484 487610299 /nfs/dbraw/zinc/61/02/99/487610299.db2.gz CTGDBHCOFQZJEL-GFCCVEGCSA-N 1 2 245.269 2.444 20 0 BEADLO Cc1occc1C[N@H+]1CCO[C@@](C)(C(F)F)C1 ZINC000668826484 487610301 /nfs/dbraw/zinc/61/03/01/487610301.db2.gz CTGDBHCOFQZJEL-GFCCVEGCSA-N 1 2 245.269 2.444 20 0 BEADLO C[N@@H+](Cc1noc(C2CC2)n1)C[C@H]1CC1(C)C ZINC000662348153 409668485 /nfs/dbraw/zinc/66/84/85/409668485.db2.gz QTFABCUXJRGVGK-SNVBAGLBSA-N 1 2 235.331 2.425 20 0 BEADLO C[N@H+](Cc1noc(C2CC2)n1)C[C@H]1CC1(C)C ZINC000662348153 409668491 /nfs/dbraw/zinc/66/84/91/409668491.db2.gz QTFABCUXJRGVGK-SNVBAGLBSA-N 1 2 235.331 2.425 20 0 BEADLO Cc1nn(CCCn2cc[nH+]c2)c(C)c1C ZINC000680522941 487611016 /nfs/dbraw/zinc/61/10/16/487611016.db2.gz FCWPTRLGUHAVBY-UHFFFAOYSA-N 1 2 218.304 2.095 20 0 BEADLO C[N@H+](CCCC1CCCC1)Cc1n[nH]c(=O)o1 ZINC000660848918 409860306 /nfs/dbraw/zinc/86/03/06/409860306.db2.gz RTYMMKNWMLFDSV-UHFFFAOYSA-N 1 2 239.319 2.177 20 0 BEADLO C[N@@H+](CCCC1CCCC1)Cc1n[nH]c(=O)o1 ZINC000660848918 409860315 /nfs/dbraw/zinc/86/03/15/409860315.db2.gz RTYMMKNWMLFDSV-UHFFFAOYSA-N 1 2 239.319 2.177 20 0 BEADLO CCn1nccc1C[N@@H+]1C[C@H](C)OCC12CCC2 ZINC000651974931 409962919 /nfs/dbraw/zinc/96/29/19/409962919.db2.gz UVJXVISYCTYBMB-LBPRGKRZSA-N 1 2 249.358 2.046 20 0 BEADLO CCn1nccc1C[N@H+]1C[C@H](C)OCC12CCC2 ZINC000651974931 409962927 /nfs/dbraw/zinc/96/29/27/409962927.db2.gz UVJXVISYCTYBMB-LBPRGKRZSA-N 1 2 249.358 2.046 20 0 BEADLO CSc1ccc[nH+]c1N[C@H]1CCCOC1 ZINC000651971436 409942431 /nfs/dbraw/zinc/94/24/31/409942431.db2.gz FNTJTWVQNCYVIU-VIFPVBQESA-N 1 2 224.329 2.394 20 0 BEADLO CSc1ccc[nH+]c1NCc1cn(C)nc1C ZINC000651971410 409942751 /nfs/dbraw/zinc/94/27/51/409942751.db2.gz DRZORCYJOKNCIF-UHFFFAOYSA-N 1 2 248.355 2.458 20 0 BEADLO CCOC[C@@H](C)Nc1c[nH+]ccc1CC ZINC000651979350 410112693 /nfs/dbraw/zinc/11/26/93/410112693.db2.gz KYNPOZOZDLFFSW-SNVBAGLBSA-N 1 2 208.305 2.481 20 0 BEADLO CCc1cc[nH+]cc1N[C@H](C)CCOC ZINC000651979343 410112747 /nfs/dbraw/zinc/11/27/47/410112747.db2.gz KCQDWBFISUPYBP-SNVBAGLBSA-N 1 2 208.305 2.481 20 0 BEADLO CCc1cc[nH+]cc1N[C@@H](C)[C@H]1CCOC1 ZINC000651979790 410114595 /nfs/dbraw/zinc/11/45/95/410114595.db2.gz JQGDJQFCUHXALQ-JQWIXIFHSA-N 1 2 220.316 2.481 20 0 BEADLO Cc1ccc(NCCCNc2cccc[nH+]2)nn1 ZINC000663392684 410178663 /nfs/dbraw/zinc/17/86/63/410178663.db2.gz NBVLDMUMNPLUAL-UHFFFAOYSA-N 1 2 243.314 2.094 20 0 BEADLO CN(Cc1ccsc1)Cc1[nH]cc[nH+]1 ZINC000111195047 410218965 /nfs/dbraw/zinc/21/89/65/410218965.db2.gz URVIQDJIGDGISS-UHFFFAOYSA-N 1 2 207.302 2.103 20 0 BEADLO Brc1cnc(Cn2cc[nH+]c2)s1 ZINC000307538830 166104918 /nfs/dbraw/zinc/10/49/18/166104918.db2.gz SQFDXHSUSKOXKN-UHFFFAOYSA-N 1 2 244.117 2.150 20 0 BEADLO COC[C@@H](Cn1c[nH+]c2cc(C)c(C)cc21)OC ZINC000663931559 410385323 /nfs/dbraw/zinc/38/53/23/410385323.db2.gz CAMCAZDTGGEZJL-GFCCVEGCSA-N 1 2 248.326 2.315 20 0 BEADLO CCc1cc(NC2(COC)CCCC2)nc[nH+]1 ZINC000664159354 410470091 /nfs/dbraw/zinc/47/00/91/410470091.db2.gz DMQQMENPHXCPPP-UHFFFAOYSA-N 1 2 235.331 2.410 20 0 BEADLO CCCC(C)(C)NC(=O)Cc1[nH]cc(CC)[nH+]1 ZINC000635455650 410439614 /nfs/dbraw/zinc/43/96/14/410439614.db2.gz GPIURJYAECPAKJ-UHFFFAOYSA-N 1 2 237.347 2.210 20 0 BEADLO C(=C\c1cccc2[nH+]ccn21)\c1ccncn1 ZINC000354257163 166227654 /nfs/dbraw/zinc/22/76/54/166227654.db2.gz XRYQQQCJINLHDJ-PLNGDYQASA-N 1 2 222.251 2.295 20 0 BEADLO C[C@@]1(CNc2nc[nH+]c(N)c2Cl)CC1(F)F ZINC000664400796 410577784 /nfs/dbraw/zinc/57/77/84/410577784.db2.gz OHPDYNLNQPCUOC-QMMMGPOBSA-N 1 2 248.664 2.169 20 0 BEADLO C[C@@]1(CNc2[nH+]cnc(N)c2Cl)CC1(F)F ZINC000664400796 410577787 /nfs/dbraw/zinc/57/77/87/410577787.db2.gz OHPDYNLNQPCUOC-QMMMGPOBSA-N 1 2 248.664 2.169 20 0 BEADLO CC(C)CCC[N@@H+]1CC[C@H](O)C(F)(F)C1 ZINC000661407132 410620534 /nfs/dbraw/zinc/62/05/34/410620534.db2.gz MIWNEODMPHCVMT-JTQLQIEISA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)CCC[N@H+]1CC[C@H](O)C(F)(F)C1 ZINC000661407132 410620539 /nfs/dbraw/zinc/62/05/39/410620539.db2.gz MIWNEODMPHCVMT-JTQLQIEISA-N 1 2 221.291 2.125 20 0 BEADLO CCC(C)(C)NC(=O)Cc1cn2c([nH+]1)CCCC2 ZINC000651058126 410775985 /nfs/dbraw/zinc/77/59/85/410775985.db2.gz FKUUGZXRIJUPLN-UHFFFAOYSA-N 1 2 249.358 2.067 20 0 BEADLO CCCCN(C)C(=O)Cc1cn2c([nH+]1)CCCC2 ZINC000651058924 410776968 /nfs/dbraw/zinc/77/69/68/410776968.db2.gz LTPWZKLWHLNOEQ-UHFFFAOYSA-N 1 2 249.358 2.020 20 0 BEADLO C[C@@H]1CC[N@H+](CC(=O)c2ccccc2F)C1 ZINC000040719196 410885113 /nfs/dbraw/zinc/88/51/13/410885113.db2.gz CJDOTFNTDYIXOS-SNVBAGLBSA-N 1 2 221.275 2.350 20 0 BEADLO C[C@@H]1CC[N@@H+](CC(=O)c2ccccc2F)C1 ZINC000040719196 410885122 /nfs/dbraw/zinc/88/51/22/410885122.db2.gz CJDOTFNTDYIXOS-SNVBAGLBSA-N 1 2 221.275 2.350 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)Nc1ccc(OC)cn1 ZINC000651299858 410906278 /nfs/dbraw/zinc/90/62/78/410906278.db2.gz ZYAANCPDLZLUCP-JTQLQIEISA-N 1 2 246.314 2.480 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)Nc1ccc(OC)cn1 ZINC000651299859 410906771 /nfs/dbraw/zinc/90/67/71/410906771.db2.gz ZYAANCPDLZLUCP-SNVBAGLBSA-N 1 2 246.314 2.480 20 0 BEADLO CC(C)OCCC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000280746614 167202659 /nfs/dbraw/zinc/20/26/59/167202659.db2.gz KOAIXZXZSJNUDT-UHFFFAOYSA-N 1 2 247.298 2.088 20 0 BEADLO CC(C)OCC[N@@H+]1CCOC[C@H]1c1ccco1 ZINC000375798130 167234995 /nfs/dbraw/zinc/23/49/95/167234995.db2.gz WXLJYAHYPLUIHX-LBPRGKRZSA-N 1 2 239.315 2.078 20 0 BEADLO CC(C)OCC[N@H+]1CCOC[C@H]1c1ccco1 ZINC000375798130 167234996 /nfs/dbraw/zinc/23/49/96/167234996.db2.gz WXLJYAHYPLUIHX-LBPRGKRZSA-N 1 2 239.315 2.078 20 0 BEADLO CC(C)O[C@H]1C[C@H]([NH2+]Cc2ccn[nH]2)C1(C)C ZINC000361238163 167282686 /nfs/dbraw/zinc/28/26/86/167282686.db2.gz SIOBFOVLFCHGQV-RYUDHWBXSA-N 1 2 237.347 2.091 20 0 BEADLO CC(C)Oc1ccccc1C[NH2+]Cc1ncc[nH]1 ZINC000067667707 167310876 /nfs/dbraw/zinc/31/08/76/167310876.db2.gz GUGISDAEAKTSSO-UHFFFAOYSA-N 1 2 245.326 2.487 20 0 BEADLO CC(C)[C@@H](C)N(C(=O)C=Cc1c[nH]c[nH+]1)C1CC1 ZINC000276596771 167361479 /nfs/dbraw/zinc/36/14/79/167361479.db2.gz NUZQYCQTCBOVJT-TZOMUSMUSA-N 1 2 247.342 2.458 20 0 BEADLO CC(C)[C@@H](C)Cc1nc(Cc2c[nH+]cn2C)no1 ZINC000357930113 167363033 /nfs/dbraw/zinc/36/30/33/167363033.db2.gz DZFRMQFWKASANS-JTQLQIEISA-N 1 2 248.330 2.229 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCCC1(F)F)c1cn[nH]c1 ZINC000398025859 410939844 /nfs/dbraw/zinc/93/98/44/410939844.db2.gz DTVMPMYXWDNFRS-VXNVDRBHSA-N 1 2 215.247 2.248 20 0 BEADLO C[C@H]1C[N@H+](Cc2cc3cnccc3o2)CCO1 ZINC000651611062 411129889 /nfs/dbraw/zinc/12/98/89/411129889.db2.gz GVLJDCGUCHYGTR-JTQLQIEISA-N 1 2 232.283 2.049 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cc3cnccc3o2)CCO1 ZINC000651611062 411129890 /nfs/dbraw/zinc/12/98/90/411129890.db2.gz GVLJDCGUCHYGTR-JTQLQIEISA-N 1 2 232.283 2.049 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cc(C)on2)o1 ZINC000044692210 411139356 /nfs/dbraw/zinc/13/93/56/411139356.db2.gz WTTOKUUFEBBDGX-UHFFFAOYSA-N 1 2 206.245 2.174 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@@H](CC)OC[C@@H]2C)cn1 ZINC000651932184 411150698 /nfs/dbraw/zinc/15/06/98/411150698.db2.gz NKBPJSUWYNRQLL-WCQYABFASA-N 1 2 249.358 2.038 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@@H](CC)OC[C@@H]2C)cn1 ZINC000651932184 411150699 /nfs/dbraw/zinc/15/06/99/411150699.db2.gz NKBPJSUWYNRQLL-WCQYABFASA-N 1 2 249.358 2.038 20 0 BEADLO CC(C)c1nc(NC[C@@H]2CCOC2)cc[nH+]1 ZINC000110278678 167689695 /nfs/dbraw/zinc/68/96/95/167689695.db2.gz QYANFRCHGIRNRL-JTQLQIEISA-N 1 2 221.304 2.048 20 0 BEADLO COCc1cc[nH+]c(N[C@H](C)[C@H]2CCOC2)c1 ZINC000652067659 411103348 /nfs/dbraw/zinc/10/33/48/411103348.db2.gz BZSRCFQOWDIFLY-PWSUYJOCSA-N 1 2 236.315 2.065 20 0 BEADLO COCc1cc[nH+]c(N[C@H]2CSC[C@@H]2C)c1 ZINC000652068288 411105020 /nfs/dbraw/zinc/10/50/20/411105020.db2.gz XYBOBYDLDRDUIB-ONGXEEELSA-N 1 2 238.356 2.391 20 0 BEADLO CC(C)Cn1nccc1C[N@@H+]1CCC[C@H](F)C1 ZINC000652076225 411107784 /nfs/dbraw/zinc/10/77/84/411107784.db2.gz UKAJYBAUWKYGGR-LBPRGKRZSA-N 1 2 239.338 2.473 20 0 BEADLO CC(C)Cn1nccc1C[N@H+]1CCC[C@H](F)C1 ZINC000652076225 411107785 /nfs/dbraw/zinc/10/77/85/411107785.db2.gz UKAJYBAUWKYGGR-LBPRGKRZSA-N 1 2 239.338 2.473 20 0 BEADLO F[C@H]1CCC[N@H+](Cc2[nH]nc3ccccc32)C1 ZINC000652077770 411109481 /nfs/dbraw/zinc/10/94/81/411109481.db2.gz QHBHGRWBBYVCGQ-JTQLQIEISA-N 1 2 233.290 2.497 20 0 BEADLO F[C@H]1CCC[N@@H+](Cc2[nH]nc3ccccc32)C1 ZINC000652077770 411109487 /nfs/dbraw/zinc/10/94/87/411109487.db2.gz QHBHGRWBBYVCGQ-JTQLQIEISA-N 1 2 233.290 2.497 20 0 BEADLO F[C@H]1CCC[N@H+](Cc2n[nH]c3ccccc32)C1 ZINC000652077770 411109488 /nfs/dbraw/zinc/10/94/88/411109488.db2.gz QHBHGRWBBYVCGQ-JTQLQIEISA-N 1 2 233.290 2.497 20 0 BEADLO F[C@H]1CCC[N@@H+](Cc2n[nH]c3ccccc32)C1 ZINC000652077770 411109490 /nfs/dbraw/zinc/10/94/90/411109490.db2.gz QHBHGRWBBYVCGQ-JTQLQIEISA-N 1 2 233.290 2.497 20 0 BEADLO CCC(C)(CC)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616928003 411115165 /nfs/dbraw/zinc/11/51/65/411115165.db2.gz VQTBEDZTEBRGGV-UHFFFAOYSA-N 1 2 223.320 2.194 20 0 BEADLO CCC(C)(CC)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616928003 411115168 /nfs/dbraw/zinc/11/51/68/411115168.db2.gz VQTBEDZTEBRGGV-UHFFFAOYSA-N 1 2 223.320 2.194 20 0 BEADLO Cc1nc(C[NH+]2CCC(C(F)F)CC2)co1 ZINC000660012387 411174365 /nfs/dbraw/zinc/17/43/65/411174365.db2.gz CFGCTYIQPHHKEH-UHFFFAOYSA-N 1 2 230.258 2.460 20 0 BEADLO Cc1nc(C[N@H+](C)CCOC(C)(C)C)co1 ZINC000660016959 411176720 /nfs/dbraw/zinc/17/67/20/411176720.db2.gz KILADTZYBWOJJP-UHFFFAOYSA-N 1 2 226.320 2.230 20 0 BEADLO Cc1nc(C[N@@H+](C)CCOC(C)(C)C)co1 ZINC000660016959 411176721 /nfs/dbraw/zinc/17/67/21/411176721.db2.gz KILADTZYBWOJJP-UHFFFAOYSA-N 1 2 226.320 2.230 20 0 BEADLO COc1c(C)[nH+]cnc1N(C)Cc1ccsc1 ZINC000656106498 411179807 /nfs/dbraw/zinc/17/98/07/411179807.db2.gz ANJPULHXJBTYCO-UHFFFAOYSA-N 1 2 249.339 2.492 20 0 BEADLO CC[C@H]1CCCN(c2nc[nH+]c(C)c2OC)C1 ZINC000656108077 411179868 /nfs/dbraw/zinc/17/98/68/411179868.db2.gz MGVMQABEKZPFNB-NSHDSACASA-N 1 2 235.331 2.420 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCOCC(F)(F)F ZINC000656107435 411180399 /nfs/dbraw/zinc/18/03/99/411180399.db2.gz VUURQIOLGOCRGE-UHFFFAOYSA-N 1 2 249.236 2.084 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1CC1(C)C ZINC000656111069 411180426 /nfs/dbraw/zinc/18/04/26/411180426.db2.gz CBPFJUIXADWVCU-MRVPVSSYSA-N 1 2 207.277 2.004 20 0 BEADLO COc1c(C)[nH+]cnc1N(C)CCC(C)C ZINC000656110780 411180808 /nfs/dbraw/zinc/18/08/08/411180808.db2.gz NVRCWYSRZQZFLA-UHFFFAOYSA-N 1 2 223.320 2.276 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@H]1CC=CCC1 ZINC000656127719 411183473 /nfs/dbraw/zinc/18/34/73/411183473.db2.gz YEFNUTQWOSQAAY-JTQLQIEISA-N 1 2 219.288 2.314 20 0 BEADLO COc1c(C)[nH+]cnc1N1CC[C@@H](C)[C@@H](C)C1 ZINC000656152042 411187230 /nfs/dbraw/zinc/18/72/30/411187230.db2.gz CYPLTCRLIOQUBW-ZJUUUORDSA-N 1 2 235.331 2.276 20 0 BEADLO CO[C@@H]1CC[C@@H](Nc2nc(C)[nH+]cc2C)C1 ZINC000656176045 411193467 /nfs/dbraw/zinc/19/34/67/411193467.db2.gz UIMXELKVCZBALL-GHMZBOCLSA-N 1 2 221.304 2.073 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1[C@@H]2CCC[C@@H]21 ZINC000656182202 411194303 /nfs/dbraw/zinc/19/43/03/411194303.db2.gz UPRRVYQDGAGYRH-URLYPYJESA-N 1 2 203.289 2.304 20 0 BEADLO C[C@H](O)CC[NH+]1Cc2cc(F)c(F)cc2C1 ZINC000653830967 411195995 /nfs/dbraw/zinc/19/59/95/411195995.db2.gz PINHMXJHBAGPFY-QMMMGPOBSA-N 1 2 227.254 2.051 20 0 BEADLO COc1c(C)[nH+]cnc1NCc1oc(C)nc1C ZINC000656188325 411197262 /nfs/dbraw/zinc/19/72/62/411197262.db2.gz BQUPYLAFWRHXLM-UHFFFAOYSA-N 1 2 248.286 2.011 20 0 BEADLO COc1c(C)[nH+]cnc1N1CCC(C2CC2)CC1 ZINC000656189271 411197532 /nfs/dbraw/zinc/19/75/32/411197532.db2.gz IAVGVPISXSLQTI-UHFFFAOYSA-N 1 2 247.342 2.420 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H](C)CCCCO ZINC000656195051 411201004 /nfs/dbraw/zinc/20/10/04/411201004.db2.gz STMGQEGSAJJNHZ-JTQLQIEISA-N 1 2 223.320 2.056 20 0 BEADLO CCN(Cc1ccc(C)[nH+]c1C)c1cnn(C)c1 ZINC000653865655 411202258 /nfs/dbraw/zinc/20/22/58/411202258.db2.gz PKULUTOOFXGMAQ-UHFFFAOYSA-N 1 2 244.342 2.458 20 0 BEADLO FC1(F)CC12CN(c1cc[nH+]c(C3CC3)n1)C2 ZINC000656204870 411208541 /nfs/dbraw/zinc/20/85/41/411208541.db2.gz XIJMDYCMEXXSLU-UHFFFAOYSA-N 1 2 237.253 2.199 20 0 BEADLO C[C@H]([NH2+][C@H]1C[C@H](C)n2ncnc21)c1ccoc1 ZINC000658101935 411246026 /nfs/dbraw/zinc/24/60/26/411246026.db2.gz NOTLIARIOCWGLU-QXEWZRGKSA-N 1 2 232.287 2.228 20 0 BEADLO C[C@H]([NH2+][C@H]1C[C@@H](C)n2ncnc21)c1ccccn1 ZINC000658101341 411246199 /nfs/dbraw/zinc/24/61/99/411246199.db2.gz LFQUVSBFYYEXGL-SCVCMEIPSA-N 1 2 243.314 2.030 20 0 BEADLO FC1(F)CC12C[NH+](Cc1cccc3nccn31)C2 ZINC000656265624 411221830 /nfs/dbraw/zinc/22/18/30/411221830.db2.gz FHFHRTCXHOVWGC-UHFFFAOYSA-N 1 2 249.264 2.175 20 0 BEADLO FC1(F)CC12CN(Cc1cccc3[nH+]ccn31)C2 ZINC000656265624 411221832 /nfs/dbraw/zinc/22/18/32/411221832.db2.gz FHFHRTCXHOVWGC-UHFFFAOYSA-N 1 2 249.264 2.175 20 0 BEADLO c1nc(C[N@@H+]2CCC[C@@H](OC3CCC3)C2)co1 ZINC000656272146 411222642 /nfs/dbraw/zinc/22/26/42/411222642.db2.gz PPGWFHVHWIQOEQ-CYBMUJFWSA-N 1 2 236.315 2.208 20 0 BEADLO c1nc(C[N@H+]2CCC[C@@H](OC3CCC3)C2)co1 ZINC000656272146 411222643 /nfs/dbraw/zinc/22/26/43/411222643.db2.gz PPGWFHVHWIQOEQ-CYBMUJFWSA-N 1 2 236.315 2.208 20 0 BEADLO COc1ccc2c(c1)C[N@@H+](Cc1c[nH]nc1C)C2 ZINC000656275776 411224648 /nfs/dbraw/zinc/22/46/48/411224648.db2.gz YKUOYHXZMRHXJU-UHFFFAOYSA-N 1 2 243.310 2.243 20 0 BEADLO COc1ccc2c(c1)C[N@H+](Cc1c[nH]nc1C)C2 ZINC000656275776 411224651 /nfs/dbraw/zinc/22/46/51/411224651.db2.gz YKUOYHXZMRHXJU-UHFFFAOYSA-N 1 2 243.310 2.243 20 0 BEADLO Cn1cc[nH+]c1-c1cccc2c1OCCCC2=O ZINC000656371355 411236277 /nfs/dbraw/zinc/23/62/77/411236277.db2.gz FUSXWFKVQJUZTL-UHFFFAOYSA-N 1 2 242.278 2.442 20 0 BEADLO Cn1cc[nH+]c1-c1ccc(CC(C)(C)O)cc1 ZINC000656371360 411236475 /nfs/dbraw/zinc/23/64/75/411236475.db2.gz GAKZOPZLRWFTQK-UHFFFAOYSA-N 1 2 230.311 2.401 20 0 BEADLO Cn1cc[nH+]c1-c1cccc2c1CCCC(=O)N2 ZINC000656371364 411236543 /nfs/dbraw/zinc/23/65/43/411236543.db2.gz GFTYIVJKRJOLSX-UHFFFAOYSA-N 1 2 241.294 2.362 20 0 BEADLO COCCOc1ccc(-c2[nH+]ccn2C)cc1 ZINC000656369702 411236837 /nfs/dbraw/zinc/23/68/37/411236837.db2.gz ZOGCLJXWEQRHFT-UHFFFAOYSA-N 1 2 232.283 2.112 20 0 BEADLO C[C@H](CC(=O)N1CCC12CCCC2)n1cc[nH+]c1 ZINC000652565170 411272890 /nfs/dbraw/zinc/27/28/90/411272890.db2.gz ZMSIPOOFDUYVNL-GFCCVEGCSA-N 1 2 247.342 2.379 20 0 BEADLO Cc1ncc(CNc2ccc(C)[nH+]c2)o1 ZINC000653466608 411286048 /nfs/dbraw/zinc/28/60/48/411286048.db2.gz ONCNFMBEFATTEY-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO CCOc1cccc(C[NH+]2CC(C(F)F)C2)n1 ZINC000656689850 411328970 /nfs/dbraw/zinc/32/89/70/411328970.db2.gz BDXYDTFDNTYGIE-UHFFFAOYSA-N 1 2 242.269 2.177 20 0 BEADLO COc1cc[nH+]cc1COc1cnn(C(C)C)c1 ZINC000310918704 411290454 /nfs/dbraw/zinc/29/04/54/411290454.db2.gz QTLNTUDUJSUSFA-UHFFFAOYSA-N 1 2 247.298 2.447 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@@H]1CCC[C@H](C)O1 ZINC000658219555 411298554 /nfs/dbraw/zinc/29/85/54/411298554.db2.gz NJLDVFLUERWZLB-NHCYSSNCSA-N 1 2 237.347 2.326 20 0 BEADLO Cc1nccnc1[C@@H](C)[NH2+]Cc1ccc(F)cn1 ZINC000446930309 411308702 /nfs/dbraw/zinc/30/87/02/411308702.db2.gz NMEIWNKMINWATP-SNVBAGLBSA-N 1 2 246.289 2.170 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)[C@@H]1CC12CCC2 ZINC000654002463 411310654 /nfs/dbraw/zinc/31/06/54/411310654.db2.gz AWILWDCGZBNFIN-MNOVXSKESA-N 1 2 247.342 2.270 20 0 BEADLO Cn1cc[nH+]c1CNc1ccc2c(c1)CCOC2 ZINC000656666234 411319859 /nfs/dbraw/zinc/31/98/59/411319859.db2.gz YUFMFJVCFHOYSF-UHFFFAOYSA-N 1 2 243.310 2.105 20 0 BEADLO c1n[nH]cc1CNc1c[nH+]cc2c1CCCC2 ZINC000656776124 411356826 /nfs/dbraw/zinc/35/68/26/411356826.db2.gz HOMYUBMPJQMVJN-UHFFFAOYSA-N 1 2 228.299 2.296 20 0 BEADLO CC(C)n1ccnc1CNc1cccc[nH+]1 ZINC000656767742 411363075 /nfs/dbraw/zinc/36/30/75/411363075.db2.gz PNZMWAYNFAOWDN-UHFFFAOYSA-N 1 2 216.288 2.471 20 0 BEADLO Cc1ccc(NCc2cnn3c2CCC3)c(C)[nH+]1 ZINC000656771365 411364274 /nfs/dbraw/zinc/36/42/74/411364274.db2.gz PBSCBAVUDDEHGW-UHFFFAOYSA-N 1 2 242.326 2.453 20 0 BEADLO CC1(CCNC(=O)c2ccc3[nH+]ccn3c2)CC1 ZINC000280091413 168019833 /nfs/dbraw/zinc/01/98/33/168019833.db2.gz RVZXQNFUSTUOFQ-UHFFFAOYSA-N 1 2 243.310 2.254 20 0 BEADLO CC1(CNC(=O)CCn2cc[nH+]c2)CCCCC1 ZINC000268131157 168029655 /nfs/dbraw/zinc/02/96/55/168029655.db2.gz PSYKRBWCCDRFFV-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO CC1(NC(=O)Nc2ccn3cc[nH+]c3c2)CCC1 ZINC000280988138 168057649 /nfs/dbraw/zinc/05/76/49/168057649.db2.gz LNWOOPRHKMSRDQ-UHFFFAOYSA-N 1 2 244.298 2.398 20 0 BEADLO CC1(O)CC[NH+](Cc2ncc(Cl)s2)CC1 ZINC000336576660 168066917 /nfs/dbraw/zinc/06/69/17/168066917.db2.gz IJPPEQXWZBELMF-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO CC1=C(c2ccco2)C[N@@H+]([C@@H]2CCOC2=O)CC1 ZINC000374512037 168090306 /nfs/dbraw/zinc/09/03/06/168090306.db2.gz FHUHSHBHWIJACX-GFCCVEGCSA-N 1 2 247.294 2.074 20 0 BEADLO CC1=C(c2ccco2)C[N@H+]([C@@H]2CCOC2=O)CC1 ZINC000374512037 168090308 /nfs/dbraw/zinc/09/03/08/168090308.db2.gz FHUHSHBHWIJACX-GFCCVEGCSA-N 1 2 247.294 2.074 20 0 BEADLO CC1=CCC[N@H+](CC(=O)OCc2ccccc2)C1 ZINC000280704644 168097416 /nfs/dbraw/zinc/09/74/16/168097416.db2.gz CQAYIANBVOENNM-UHFFFAOYSA-N 1 2 245.322 2.382 20 0 BEADLO CC1=CCC[N@@H+](CC(=O)OCc2ccccc2)C1 ZINC000280704644 168097418 /nfs/dbraw/zinc/09/74/18/168097418.db2.gz CQAYIANBVOENNM-UHFFFAOYSA-N 1 2 245.322 2.382 20 0 BEADLO CC1=CCC[N@@H+](Cc2ncc(Cl)n2C)C1 ZINC000280912753 168099402 /nfs/dbraw/zinc/09/94/02/168099402.db2.gz SIGHJRBQOBAXJR-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO CC1=CCC[N@H+](Cc2ncc(Cl)n2C)C1 ZINC000280912753 168099404 /nfs/dbraw/zinc/09/94/04/168099404.db2.gz SIGHJRBQOBAXJR-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO CC1=CC[N@H+](Cc2c(Cl)cnn2C)CC1 ZINC000275656987 168115647 /nfs/dbraw/zinc/11/56/47/168115647.db2.gz CYXKTEPMVNKRRE-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO CC1=CC[N@@H+](Cc2c(Cl)cnn2C)CC1 ZINC000275656987 168115650 /nfs/dbraw/zinc/11/56/50/168115650.db2.gz CYXKTEPMVNKRRE-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO CC1=C[C@@H](C)C[C@@H](C[N@H+](C)Cc2nnc[nH]2)C1 ZINC000290312042 168123792 /nfs/dbraw/zinc/12/37/92/168123792.db2.gz AQRQFTQLOINFNP-ZYHUDNBSSA-N 1 2 234.347 2.229 20 0 BEADLO CC1=C[C@@H](C)C[C@@H](C[N@@H+](C)Cc2nnc[nH]2)C1 ZINC000290312042 168123795 /nfs/dbraw/zinc/12/37/95/168123795.db2.gz AQRQFTQLOINFNP-ZYHUDNBSSA-N 1 2 234.347 2.229 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC(C)=C[C@H](C)C1 ZINC000336316704 168128347 /nfs/dbraw/zinc/12/83/47/168128347.db2.gz ZJNBSYDDVIXRPA-VIFPVBQESA-N 1 2 205.305 2.116 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC(C)=C[C@H](C)C1 ZINC000336316704 168128349 /nfs/dbraw/zinc/12/83/49/168128349.db2.gz ZJNBSYDDVIXRPA-VIFPVBQESA-N 1 2 205.305 2.116 20 0 BEADLO CC1CCC(=CC(=O)NCc2[nH+]ccn2C)CC1 ZINC000265367946 168148991 /nfs/dbraw/zinc/14/89/91/168148991.db2.gz YMHLWUHLKASUJS-UHFFFAOYSA-N 1 2 247.342 2.173 20 0 BEADLO CC1CCC(C)(NC(=O)CCn2cc[nH+]c2)CC1 ZINC000263647286 168150645 /nfs/dbraw/zinc/15/06/45/168150645.db2.gz AKDZBMSFEJUBNI-UHFFFAOYSA-N 1 2 249.358 2.358 20 0 BEADLO CC1CCC(N(C)C(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000276512987 168157954 /nfs/dbraw/zinc/15/79/54/168157954.db2.gz JGAASGBDPYIUET-VMPITWQZSA-N 1 2 247.342 2.460 20 0 BEADLO CC1CCN(C(=O)c2ccc3[nH+]ccn3c2)CC1 ZINC000068371025 168175839 /nfs/dbraw/zinc/17/58/39/168175839.db2.gz LNUPCMLUIFTTCR-UHFFFAOYSA-N 1 2 243.310 2.206 20 0 BEADLO CC1C[NH+](Cc2nccn2Cc2ccccc2)C1 ZINC000338958570 168191451 /nfs/dbraw/zinc/19/14/51/168191451.db2.gz UOULUEGSLBTPHW-UHFFFAOYSA-N 1 2 241.338 2.383 20 0 BEADLO CCC(C)(C)C(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000335158492 168267469 /nfs/dbraw/zinc/26/74/69/168267469.db2.gz ZHDDUSZYVNPYSD-ZJUUUORDSA-N 1 2 235.331 2.441 20 0 BEADLO CCC(C)(C)C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000335158491 168267723 /nfs/dbraw/zinc/26/77/23/168267723.db2.gz ZHDDUSZYVNPYSD-VHSXEESVSA-N 1 2 235.331 2.441 20 0 BEADLO CCC(C)(CC)NC(=O)CCc1c[nH+]c[nH]1 ZINC000189004438 168307070 /nfs/dbraw/zinc/30/70/70/168307070.db2.gz OCDPDHQDJZHGCG-UHFFFAOYSA-N 1 2 223.320 2.037 20 0 BEADLO CCC(C)(CC)NC(=O)CCc1c[nH]c[nH+]1 ZINC000189004438 168307071 /nfs/dbraw/zinc/30/70/71/168307071.db2.gz OCDPDHQDJZHGCG-UHFFFAOYSA-N 1 2 223.320 2.037 20 0 BEADLO CC(C)n1ccc(C[N@@H+]2CCC[C@@H]3COC[C@@H]32)n1 ZINC000657304087 411456739 /nfs/dbraw/zinc/45/67/39/411456739.db2.gz HKMNXKVERULHHU-OCCSQVGLSA-N 1 2 249.358 2.075 20 0 BEADLO CC(C)n1ccc(C[N@H+]2CCC[C@@H]3COC[C@@H]32)n1 ZINC000657304087 411456741 /nfs/dbraw/zinc/45/67/41/411456741.db2.gz HKMNXKVERULHHU-OCCSQVGLSA-N 1 2 249.358 2.075 20 0 BEADLO CCCC(C)(C)NC(=O)[C@H]1CCc2c[nH+]cn2C1 ZINC000653030507 411398979 /nfs/dbraw/zinc/39/89/79/411398979.db2.gz BTVSLKJQXMDFEG-NSHDSACASA-N 1 2 249.358 2.140 20 0 BEADLO CCCCN(C(=O)[C@H](C)Cc1c[nH+]c[nH]1)C1CC1 ZINC000654458568 411400115 /nfs/dbraw/zinc/40/01/15/411400115.db2.gz JVMJZSZNKQYGAK-LLVKDONJSA-N 1 2 249.358 2.379 20 0 BEADLO CCCCN(C(=O)[C@H](C)Cc1c[nH]c[nH+]1)C1CC1 ZINC000654458568 411400119 /nfs/dbraw/zinc/40/01/19/411400119.db2.gz JVMJZSZNKQYGAK-LLVKDONJSA-N 1 2 249.358 2.379 20 0 BEADLO CCCCN(C(=O)[C@@H](C)Cc1c[nH+]c[nH]1)C1CC1 ZINC000654458569 411400249 /nfs/dbraw/zinc/40/02/49/411400249.db2.gz JVMJZSZNKQYGAK-NSHDSACASA-N 1 2 249.358 2.379 20 0 BEADLO CCCCN(C(=O)[C@@H](C)Cc1c[nH]c[nH+]1)C1CC1 ZINC000654458569 411400251 /nfs/dbraw/zinc/40/02/51/411400251.db2.gz JVMJZSZNKQYGAK-NSHDSACASA-N 1 2 249.358 2.379 20 0 BEADLO CC(C)CCN(C)C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000654470785 411401202 /nfs/dbraw/zinc/40/12/02/411401202.db2.gz ULKWIEBJCJDIGI-LLVKDONJSA-N 1 2 237.347 2.093 20 0 BEADLO CC(C)CCN(C)C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000654470785 411401203 /nfs/dbraw/zinc/40/12/03/411401203.db2.gz ULKWIEBJCJDIGI-LLVKDONJSA-N 1 2 237.347 2.093 20 0 BEADLO CC(C)(CNC(=O)Cn1cc[nH+]c1)C1=CCCC1 ZINC000654595559 411416913 /nfs/dbraw/zinc/41/69/13/411416913.db2.gz ZVPRBEINIIHPIA-UHFFFAOYSA-N 1 2 247.342 2.136 20 0 BEADLO Cc1nsc(C)c1C[N@H+](C)Cc1cn[nH]c1 ZINC000653583522 411426288 /nfs/dbraw/zinc/42/62/88/411426288.db2.gz HSHSZFYUZDYXPI-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1nsc(C)c1C[N@@H+](C)Cc1cn[nH]c1 ZINC000653583522 411426290 /nfs/dbraw/zinc/42/62/90/411426290.db2.gz HSHSZFYUZDYXPI-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO COc1cc(C[N@H+](C)Cc2ccsc2)on1 ZINC000659820569 411463308 /nfs/dbraw/zinc/46/33/08/411463308.db2.gz IKBRJOKKKVOJJO-UHFFFAOYSA-N 1 2 238.312 2.377 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2ccsc2)on1 ZINC000659820569 411463310 /nfs/dbraw/zinc/46/33/10/411463310.db2.gz IKBRJOKKKVOJJO-UHFFFAOYSA-N 1 2 238.312 2.377 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H]1CC[C@@H](c2ccccc2)C1 ZINC000280192185 411451315 /nfs/dbraw/zinc/45/13/15/411451315.db2.gz HKZUHFGFKZOVNM-MRVWCRGKSA-N 1 2 247.338 2.474 20 0 BEADLO Cn1nc(C(F)(F)F)cc1C[NH+]1CCCC1 ZINC000657295184 411454724 /nfs/dbraw/zinc/45/47/24/411454724.db2.gz KFIQDLUHEPLIIZ-UHFFFAOYSA-N 1 2 233.237 2.035 20 0 BEADLO Cc1c[nH]c(CNc2ccnn2[C@H](C)C2CC2)[nH+]1 ZINC000657344191 411469256 /nfs/dbraw/zinc/46/92/56/411469256.db2.gz YRJMGKYDWIKTLY-SNVBAGLBSA-N 1 2 245.330 2.498 20 0 BEADLO COCc1csc(C[NH2+]Cc2cocn2)c1 ZINC000657355537 411478007 /nfs/dbraw/zinc/47/80/07/411478007.db2.gz SUTJRZVNAAPQMZ-UHFFFAOYSA-N 1 2 238.312 2.172 20 0 BEADLO Cc1c[nH]c(CN[C@@H](C)c2ncc(C)s2)[nH+]1 ZINC000657389439 411491115 /nfs/dbraw/zinc/49/11/15/411491115.db2.gz VSIYWIXLMATOAK-VIFPVBQESA-N 1 2 236.344 2.334 20 0 BEADLO CC(C)n1ccnc1C[NH2+]Cc1ccc(F)cn1 ZINC000657398256 411495301 /nfs/dbraw/zinc/49/53/01/411495301.db2.gz KOJWCQWYCWIJLD-UHFFFAOYSA-N 1 2 248.305 2.288 20 0 BEADLO CC[C@@H]1C[C@H](Nc2ccc(C)[nH+]c2)CO1 ZINC000657402863 411497657 /nfs/dbraw/zinc/49/76/57/411497657.db2.gz KGFZLAJOJRCYTO-NWDGAFQWSA-N 1 2 206.289 2.369 20 0 BEADLO Cc1c[nH]c(CNc2ccc(C)[nH+]c2C)n1 ZINC000657412584 411498647 /nfs/dbraw/zinc/49/86/47/411498647.db2.gz HGHGNRUSYOZJEK-UHFFFAOYSA-N 1 2 216.288 2.342 20 0 BEADLO CC[C@@H]1C[C@@H](Nc2c[nH+]cc(C)c2)CO1 ZINC000657412554 411498690 /nfs/dbraw/zinc/49/86/90/411498690.db2.gz GRYMUYWYYUFAGZ-VXGBXAGGSA-N 1 2 206.289 2.369 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC(C)(C)C1CCC1 ZINC000655129018 411500716 /nfs/dbraw/zinc/50/07/16/411500716.db2.gz KLCHUCJPAASXFY-SNVBAGLBSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC(C)(C)C1CCC1 ZINC000655129018 411500718 /nfs/dbraw/zinc/50/07/18/411500718.db2.gz KLCHUCJPAASXFY-SNVBAGLBSA-N 1 2 249.358 2.283 20 0 BEADLO Cc1[nH]c(CNc2cnn(CC3CC3)c2)[nH+]c1C ZINC000657420229 411501865 /nfs/dbraw/zinc/50/18/65/411501865.db2.gz MNDSJAWVQUBJGO-UHFFFAOYSA-N 1 2 245.330 2.245 20 0 BEADLO Cc1nc(C[N@@H+]2CC(C)(C)OCC2(C)C)co1 ZINC000659931958 411502487 /nfs/dbraw/zinc/50/24/87/411502487.db2.gz VQFTVHFKLTWQHT-UHFFFAOYSA-N 1 2 238.331 2.372 20 0 BEADLO Cc1nc(C[N@H+]2CC(C)(C)OCC2(C)C)co1 ZINC000659931958 411502488 /nfs/dbraw/zinc/50/24/88/411502488.db2.gz VQFTVHFKLTWQHT-UHFFFAOYSA-N 1 2 238.331 2.372 20 0 BEADLO COc1cccnc1NCc1[nH]c(C)c(C)[nH+]1 ZINC000657422641 411502762 /nfs/dbraw/zinc/50/27/62/411502762.db2.gz XSIWWGHHYQIAJB-UHFFFAOYSA-N 1 2 232.287 2.042 20 0 BEADLO COc1ccc(F)cc1C[NH2+]Cc1nc(C)c[nH]1 ZINC000657440694 411509064 /nfs/dbraw/zinc/50/90/64/411509064.db2.gz WJHPRBGENOTNGG-UHFFFAOYSA-N 1 2 249.289 2.156 20 0 BEADLO Cc1c[nH]c(CNc2cn(C)nc2C(C)C)[nH+]1 ZINC000657456496 411516652 /nfs/dbraw/zinc/51/66/52/411516652.db2.gz ZGRMUKAONWWVKP-UHFFFAOYSA-N 1 2 233.319 2.187 20 0 BEADLO Cc1c[nH]c(CN[C@@H](C2CC2)C(F)(F)F)[nH+]1 ZINC000657470187 411522051 /nfs/dbraw/zinc/52/20/51/411522051.db2.gz ZCSPNIMFOCPAPQ-VIFPVBQESA-N 1 2 233.237 2.149 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1cn(C2CCC2)nn1 ZINC000657472327 411523173 /nfs/dbraw/zinc/52/31/73/411523173.db2.gz PKBDHNWINLBFGK-UHFFFAOYSA-N 1 2 246.314 2.194 20 0 BEADLO Cc1[nH]c(CNc2cn(C)nc2C2CC2)[nH+]c1C ZINC000657472628 411523513 /nfs/dbraw/zinc/52/35/13/411523513.db2.gz PTXBYKBDQSZMAL-UHFFFAOYSA-N 1 2 245.330 2.250 20 0 BEADLO CCOc1ncc(C)cc1NCc1[nH]cc(C)[nH+]1 ZINC000657476916 411523992 /nfs/dbraw/zinc/52/39/92/411523992.db2.gz GFDXSSMBAXHXEW-UHFFFAOYSA-N 1 2 246.314 2.432 20 0 BEADLO COc1cc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)on1 ZINC000660032795 411529926 /nfs/dbraw/zinc/52/99/26/411529926.db2.gz SEKBVADTDOIJMY-LBPRGKRZSA-N 1 2 247.298 2.348 20 0 BEADLO COc1cc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)on1 ZINC000660032795 411529929 /nfs/dbraw/zinc/52/99/29/411529929.db2.gz SEKBVADTDOIJMY-LBPRGKRZSA-N 1 2 247.298 2.348 20 0 BEADLO CC[C@](C)(NCc1cn(C)c[nH+]1)C(F)(F)F ZINC000660084722 411535318 /nfs/dbraw/zinc/53/53/18/411535318.db2.gz YGJCXFQQTHFJQE-VIFPVBQESA-N 1 2 235.253 2.241 20 0 BEADLO CC[N@@H+]1C[C@H]([NH2+]CC2CCCC2)[C@@H](C)C1 ZINC000336744974 170035504 /nfs/dbraw/zinc/03/55/04/170035504.db2.gz ABPHBZRUYRRUHD-AAEUAGOBSA-N 1 2 210.365 2.106 20 0 BEADLO CC[N@@H+]1C[C@H]([NH2+]CCc2ccc(C)cc2)[C@@H](C)C1 ZINC000358152082 170035970 /nfs/dbraw/zinc/03/59/70/170035970.db2.gz DOIKQVCCFZRCGU-HOCLYGCPSA-N 1 2 246.398 2.467 20 0 BEADLO Cc1nc(C[N@@H+](C)Cc2cccnc2)c(C)o1 ZINC000660125794 411541089 /nfs/dbraw/zinc/54/10/89/411541089.db2.gz KXISLCLGOHBXMQ-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1nc(C[N@H+](C)Cc2cccnc2)c(C)o1 ZINC000660125794 411541091 /nfs/dbraw/zinc/54/10/91/411541091.db2.gz KXISLCLGOHBXMQ-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO C[C@@H]1C[C@H]([NH2+]Cc2ccc(F)cc2)c2ncnn21 ZINC000657567522 411553382 /nfs/dbraw/zinc/55/33/82/411553382.db2.gz SAGVVZNZSAMVAZ-SKDRFNHKSA-N 1 2 246.289 2.213 20 0 BEADLO Cc1nc(C[N@H+](C)CCC2CCC2)no1 ZINC000660213739 411554708 /nfs/dbraw/zinc/55/47/08/411554708.db2.gz ANPPWGLFLFUODM-UHFFFAOYSA-N 1 2 209.293 2.000 20 0 BEADLO Cc1nc(C[N@@H+](C)CCC2CCC2)no1 ZINC000660213739 411554710 /nfs/dbraw/zinc/55/47/10/411554710.db2.gz ANPPWGLFLFUODM-UHFFFAOYSA-N 1 2 209.293 2.000 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@@H]2CC[C@@H]3C[C@@H]3C2)no1 ZINC000660217229 411554984 /nfs/dbraw/zinc/55/49/84/411554984.db2.gz OJCWNIXFGLPBLG-UTUOFQBUSA-N 1 2 235.331 2.246 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@@H]2CC[C@@H]3C[C@@H]3C2)no1 ZINC000660217229 411554986 /nfs/dbraw/zinc/55/49/86/411554986.db2.gz OJCWNIXFGLPBLG-UTUOFQBUSA-N 1 2 235.331 2.246 20 0 BEADLO CCC(CC)C[N@H+](C)Cc1noc(C)n1 ZINC000660217428 411555502 /nfs/dbraw/zinc/55/55/02/411555502.db2.gz WCKLUVCWECSPIM-UHFFFAOYSA-N 1 2 211.309 2.246 20 0 BEADLO CCC(CC)C[N@@H+](C)Cc1noc(C)n1 ZINC000660217428 411555503 /nfs/dbraw/zinc/55/55/03/411555503.db2.gz WCKLUVCWECSPIM-UHFFFAOYSA-N 1 2 211.309 2.246 20 0 BEADLO CCc1nocc1C[NH+]1CC2(C1)CC(F)(F)C2 ZINC000660146834 411545632 /nfs/dbraw/zinc/54/56/32/411545632.db2.gz KOLRXIDXMCDISY-UHFFFAOYSA-N 1 2 242.269 2.468 20 0 BEADLO CCOC(=O)C(C)(C)[N@H+](C)C[C@@H](F)CC ZINC000339795136 170186286 /nfs/dbraw/zinc/18/62/86/170186286.db2.gz RKXDUXXBQSNHDM-VIFPVBQESA-N 1 2 219.300 2.008 20 0 BEADLO CCOC(=O)C(C)(C)[N@@H+](C)C[C@@H](F)CC ZINC000339795136 170186287 /nfs/dbraw/zinc/18/62/87/170186287.db2.gz RKXDUXXBQSNHDM-VIFPVBQESA-N 1 2 219.300 2.008 20 0 BEADLO CCOC(=O)C(C)(C)[N@H+](C)C[C@H](F)CC ZINC000339795135 170186511 /nfs/dbraw/zinc/18/65/11/170186511.db2.gz RKXDUXXBQSNHDM-SECBINFHSA-N 1 2 219.300 2.008 20 0 BEADLO CCOC(=O)C(C)(C)[N@@H+](C)C[C@H](F)CC ZINC000339795135 170186512 /nfs/dbraw/zinc/18/65/12/170186512.db2.gz RKXDUXXBQSNHDM-SECBINFHSA-N 1 2 219.300 2.008 20 0 BEADLO CCOC(=O)CC(C)(C)CCn1cc[nH+]c1 ZINC000286505750 170198221 /nfs/dbraw/zinc/19/82/21/170198221.db2.gz MGJGPYQPIMFGBG-UHFFFAOYSA-N 1 2 224.304 2.253 20 0 BEADLO CCOC(=O)CCC[N@@H+]1CCCC[C@H]1C(F)F ZINC000337515230 170200678 /nfs/dbraw/zinc/20/06/78/170200678.db2.gz LINKEUJIWAGKER-JTQLQIEISA-N 1 2 249.301 2.449 20 0 BEADLO CCOC(=O)CCC[N@H+]1CCCC[C@H]1C(F)F ZINC000337515230 170200679 /nfs/dbraw/zinc/20/06/79/170200679.db2.gz LINKEUJIWAGKER-JTQLQIEISA-N 1 2 249.301 2.449 20 0 BEADLO CCOC(=O)CCC[N@@H+]1CCC[C@@H]1C(F)F ZINC000353173923 170200807 /nfs/dbraw/zinc/20/08/07/170200807.db2.gz PVWVFZUXEGXGGW-SECBINFHSA-N 1 2 235.274 2.059 20 0 BEADLO CCOC(=O)CCC[N@H+]1CCC[C@@H]1C(F)F ZINC000353173923 170200809 /nfs/dbraw/zinc/20/08/09/170200809.db2.gz PVWVFZUXEGXGGW-SECBINFHSA-N 1 2 235.274 2.059 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1ccc(F)cc1C ZINC000127974090 170215320 /nfs/dbraw/zinc/21/53/20/170215320.db2.gz XOPSZIKZKMFFMV-UHFFFAOYSA-N 1 2 239.290 2.129 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1ccc(F)cc1C ZINC000127974090 170215322 /nfs/dbraw/zinc/21/53/22/170215322.db2.gz XOPSZIKZKMFFMV-UHFFFAOYSA-N 1 2 239.290 2.129 20 0 BEADLO CCOC(=O)C[N@H+](C)[C@H](C)c1cccs1 ZINC000042227130 170215832 /nfs/dbraw/zinc/21/58/32/170215832.db2.gz ZDYDRAFGFKHEON-SECBINFHSA-N 1 2 227.329 2.304 20 0 BEADLO CCOC(=O)C[N@@H+](C)[C@H](C)c1cccs1 ZINC000042227130 170215834 /nfs/dbraw/zinc/21/58/34/170215834.db2.gz ZDYDRAFGFKHEON-SECBINFHSA-N 1 2 227.329 2.304 20 0 BEADLO CCOC(=O)C[NH2+]C(C)(C)c1cccc(C)c1 ZINC000179584136 170225178 /nfs/dbraw/zinc/22/51/78/170225178.db2.gz NDFSVSYXIVPQKN-UHFFFAOYSA-N 1 2 235.327 2.383 20 0 BEADLO CCOC(=O)C[NH2+][C@@]1(C)CCCc2ccccc21 ZINC000341882322 170226449 /nfs/dbraw/zinc/22/64/49/170226449.db2.gz KTXQAJOHWIUACX-HNNXBMFYSA-N 1 2 247.338 2.391 20 0 BEADLO Cc1nc(C[NH2+][C@H](C)c2ccccn2)co1 ZINC000660243660 411558223 /nfs/dbraw/zinc/55/82/23/411558223.db2.gz KCBBJAYRBVJQOW-SECBINFHSA-N 1 2 217.272 2.229 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+](C)Cc1ccc(F)cc1 ZINC000043638672 170247248 /nfs/dbraw/zinc/24/72/48/170247248.db2.gz YEETZPAJTFZSBR-SNVBAGLBSA-N 1 2 239.290 2.209 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(F)cc1 ZINC000043638672 170247250 /nfs/dbraw/zinc/24/72/50/170247250.db2.gz YEETZPAJTFZSBR-SNVBAGLBSA-N 1 2 239.290 2.209 20 0 BEADLO Cc1nc(C[NH2+][C@@H](C)c2cncc(F)c2)co1 ZINC000660242515 411558363 /nfs/dbraw/zinc/55/83/63/411558363.db2.gz OJQWPYASCKOHLA-QMMMGPOBSA-N 1 2 235.262 2.368 20 0 BEADLO CCOC(=O)[C@@H](Cc1ccccc1)[NH2+]C(C)C ZINC000037446337 170253001 /nfs/dbraw/zinc/25/30/01/170253001.db2.gz NHKXTIJWACZDPX-CYBMUJFWSA-N 1 2 235.327 2.159 20 0 BEADLO CCOC(=O)[C@H](CC)[NH+]1Cc2ccccc2C1 ZINC000084120861 170271343 /nfs/dbraw/zinc/27/13/43/170271343.db2.gz MUBNHHJSSKMVMY-ZDUSSCGKSA-N 1 2 233.311 2.344 20 0 BEADLO CCOC(=O)[C@H](Cc1ccccc1)[NH2+]C(C)C ZINC000037446338 170274324 /nfs/dbraw/zinc/27/43/24/170274324.db2.gz NHKXTIJWACZDPX-ZDUSSCGKSA-N 1 2 235.327 2.159 20 0 BEADLO CCOC(=O)[C@H]1CCCC[N@@H+]1Cc1ccco1 ZINC000071928395 170280050 /nfs/dbraw/zinc/28/00/50/170280050.db2.gz MEZCIQXJZAUUFE-GFCCVEGCSA-N 1 2 237.299 2.197 20 0 BEADLO CCOC(=O)[C@H]1CCCC[N@H+]1Cc1ccco1 ZINC000071928395 170280052 /nfs/dbraw/zinc/28/00/52/170280052.db2.gz MEZCIQXJZAUUFE-GFCCVEGCSA-N 1 2 237.299 2.197 20 0 BEADLO CCOC(=O)[C@H]1CCC[N@@H+]1Cc1occc1C ZINC000274370896 170280740 /nfs/dbraw/zinc/28/07/40/170280740.db2.gz QAZHTGPXNFITDB-LLVKDONJSA-N 1 2 237.299 2.116 20 0 BEADLO CCOC(=O)[C@H]1CCC[N@H+]1Cc1occc1C ZINC000274370896 170280741 /nfs/dbraw/zinc/28/07/41/170280741.db2.gz QAZHTGPXNFITDB-LLVKDONJSA-N 1 2 237.299 2.116 20 0 BEADLO CCOC(=O)c1ccc(C[NH2+]Cc2ccco2)o1 ZINC000181510348 170295113 /nfs/dbraw/zinc/29/51/13/170295113.db2.gz UJAOMXGPKAPSTA-UHFFFAOYSA-N 1 2 249.266 2.339 20 0 BEADLO CC1(C)C[NH+](CCc2cnn[nH]2)CC(C)(C)C1 ZINC000660289446 411565552 /nfs/dbraw/zinc/56/55/52/411565552.db2.gz ITXUGTOUVYJUGG-UHFFFAOYSA-N 1 2 236.363 2.105 20 0 BEADLO CC(C)=CCC[N@@H+]1CC(F)(F)C[C@H]1CO ZINC000660369290 411573417 /nfs/dbraw/zinc/57/34/17/411573417.db2.gz QOTNPEXNNGRYTO-JTQLQIEISA-N 1 2 219.275 2.045 20 0 BEADLO CC(C)=CCC[N@H+]1CC(F)(F)C[C@H]1CO ZINC000660369290 411573419 /nfs/dbraw/zinc/57/34/19/411573419.db2.gz QOTNPEXNNGRYTO-JTQLQIEISA-N 1 2 219.275 2.045 20 0 BEADLO CCOC1CC(Nc2ccc[nH+]c2C)C1 ZINC000163723891 170330370 /nfs/dbraw/zinc/33/03/70/170330370.db2.gz JKWBVIQOWLGHPI-UHFFFAOYSA-N 1 2 206.289 2.369 20 0 BEADLO CCOC1C[NH+](Cc2ccc(F)cc2)C1 ZINC000297377224 170337197 /nfs/dbraw/zinc/33/71/97/170337197.db2.gz IFMGHCHTKQEVQR-UHFFFAOYSA-N 1 2 209.264 2.046 20 0 BEADLO CCc1nocc1C[N@@H+]1C[C@H](C)O[C@@H](C)[C@@H]1C ZINC000660375858 411575446 /nfs/dbraw/zinc/57/54/46/411575446.db2.gz ZNVLETMTJMZVCF-DCAQKATOSA-N 1 2 238.331 2.235 20 0 BEADLO CCc1nocc1C[N@H+]1C[C@H](C)O[C@@H](C)[C@@H]1C ZINC000660375858 411575448 /nfs/dbraw/zinc/57/54/48/411575448.db2.gz ZNVLETMTJMZVCF-DCAQKATOSA-N 1 2 238.331 2.235 20 0 BEADLO CCOCC(C)(C)CNc1cc[nH+]c(C)n1 ZINC000288832943 170352487 /nfs/dbraw/zinc/35/24/87/170352487.db2.gz IJSYZOMMEPGRTR-UHFFFAOYSA-N 1 2 223.320 2.260 20 0 BEADLO CCOCCCC(=O)Nc1c(C)cc[nH+]c1C ZINC000362400789 170366488 /nfs/dbraw/zinc/36/64/88/170366488.db2.gz GQENAADYPYMKPW-UHFFFAOYSA-N 1 2 236.315 2.454 20 0 BEADLO CCOCCN(C)c1[nH+]c2ccccc2n1C ZINC000271304705 170391626 /nfs/dbraw/zinc/39/16/26/170391626.db2.gz CSTYTQSIWZTGEW-UHFFFAOYSA-N 1 2 233.315 2.046 20 0 BEADLO CCOCC[N@H+](CC)[C@H](C)c1nnc(C)s1 ZINC000338311542 170395837 /nfs/dbraw/zinc/39/58/37/170395837.db2.gz DYKFHKHUYBOPQP-SECBINFHSA-N 1 2 243.376 2.266 20 0 BEADLO CCOCC[N@@H+](CC)[C@H](C)c1nnc(C)s1 ZINC000338311542 170395839 /nfs/dbraw/zinc/39/58/39/170395839.db2.gz DYKFHKHUYBOPQP-SECBINFHSA-N 1 2 243.376 2.266 20 0 BEADLO CC(C)(C)C(F)(F)C[NH2+]C[C@@H](O)C(F)(F)F ZINC000663379780 411642673 /nfs/dbraw/zinc/64/26/73/411642673.db2.gz VLUMDRIUGINTEP-ZCFIWIBFSA-N 1 2 249.223 2.181 20 0 BEADLO CC[C@@]1(C)C[N@H+](Cc2nc(C)oc2C)CCO1 ZINC000660380077 411576179 /nfs/dbraw/zinc/57/61/79/411576179.db2.gz JMBHYMOVRXDAJK-ZDUSSCGKSA-N 1 2 238.331 2.292 20 0 BEADLO CC[C@@]1(C)C[N@@H+](Cc2nc(C)oc2C)CCO1 ZINC000660380077 411576180 /nfs/dbraw/zinc/57/61/80/411576180.db2.gz JMBHYMOVRXDAJK-ZDUSSCGKSA-N 1 2 238.331 2.292 20 0 BEADLO CCOC[C@@H](Nc1cc(C)[nH+]cn1)C(C)C ZINC000233761033 170434730 /nfs/dbraw/zinc/43/47/30/170434730.db2.gz NEDGULVBSQLFSR-LLVKDONJSA-N 1 2 223.320 2.258 20 0 BEADLO CCc1nocc1C[N@@H+]1CCC[C@H]1c1cc[nH]n1 ZINC000660428319 411583589 /nfs/dbraw/zinc/58/35/89/411583589.db2.gz CJDICILTOMLQOU-ZDUSSCGKSA-N 1 2 246.314 2.297 20 0 BEADLO CCc1nocc1C[N@H+]1CCC[C@H]1c1cc[nH]n1 ZINC000660428319 411583591 /nfs/dbraw/zinc/58/35/91/411583591.db2.gz CJDICILTOMLQOU-ZDUSSCGKSA-N 1 2 246.314 2.297 20 0 BEADLO CC[C@H](CC(F)F)C[N@H+](CCO)CC(F)F ZINC000660452707 411587276 /nfs/dbraw/zinc/58/72/76/411587276.db2.gz XXBDOUSGNUNEFW-MRVPVSSYSA-N 1 2 245.260 2.227 20 0 BEADLO CC[C@H](CC(F)F)C[N@@H+](CCO)CC(F)F ZINC000660452707 411587278 /nfs/dbraw/zinc/58/72/78/411587278.db2.gz XXBDOUSGNUNEFW-MRVPVSSYSA-N 1 2 245.260 2.227 20 0 BEADLO CCOc1ccc(NCc2nccn2C)[nH+]c1C ZINC000657792596 411598392 /nfs/dbraw/zinc/59/83/92/411598392.db2.gz KYGUAYNNYGLFSN-UHFFFAOYSA-N 1 2 246.314 2.134 20 0 BEADLO CCc1ccc(C[NH2+][C@@H](C)c2nccn2C)o1 ZINC000657794071 411598799 /nfs/dbraw/zinc/59/87/99/411598799.db2.gz NUAVCYRCUHUQCV-JTQLQIEISA-N 1 2 233.315 2.426 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccccn2)nc(C)n1 ZINC000660678944 411616693 /nfs/dbraw/zinc/61/66/93/411616693.db2.gz HDAYZWGQHSFJTH-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccccn2)nc(C)n1 ZINC000660678944 411616694 /nfs/dbraw/zinc/61/66/94/411616694.db2.gz HDAYZWGQHSFJTH-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO CN(c1[nH+]ccc2c(N)cccc21)[C@H]1CCOC1 ZINC000663572028 411703969 /nfs/dbraw/zinc/70/39/69/411703969.db2.gz SNNWOPSPPVWDOM-JTQLQIEISA-N 1 2 243.310 2.042 20 0 BEADLO CC[C@H]1C[NH+](Cc2coc(C)n2)C[C@H](CC)O1 ZINC000660834605 411651685 /nfs/dbraw/zinc/65/16/85/411651685.db2.gz ZLTYBPRYGOZCBD-STQMWFEESA-N 1 2 238.331 2.372 20 0 BEADLO CCO[C@H]1C[C@H](N(C)c2cc[nH+]c(C)n2)C1(C)C ZINC000361042719 170510362 /nfs/dbraw/zinc/51/03/62/170510362.db2.gz CEWUYSRFQCMRMY-RYUDHWBXSA-N 1 2 249.358 2.425 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2n[nH]c(=O)o2)cc1C ZINC000660842464 411654696 /nfs/dbraw/zinc/65/46/96/411654696.db2.gz PDQUOGPPAWRHNR-UHFFFAOYSA-N 1 2 247.298 2.024 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2n[nH]c(=O)o2)cc1C ZINC000660842464 411654700 /nfs/dbraw/zinc/65/47/00/411654700.db2.gz PDQUOGPPAWRHNR-UHFFFAOYSA-N 1 2 247.298 2.024 20 0 BEADLO Cc1ccc(C)c(C[N@H+](C)Cc2n[nH]c(=O)o2)c1 ZINC000660841479 411654836 /nfs/dbraw/zinc/65/48/36/411654836.db2.gz FHXZXJIYKPXWSW-UHFFFAOYSA-N 1 2 247.298 2.024 20 0 BEADLO Cc1ccc(C)c(C[N@@H+](C)Cc2n[nH]c(=O)o2)c1 ZINC000660841479 411654838 /nfs/dbraw/zinc/65/48/38/411654838.db2.gz FHXZXJIYKPXWSW-UHFFFAOYSA-N 1 2 247.298 2.024 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C)nc(C)n2)[C@H](C)CO1 ZINC000660912629 411668765 /nfs/dbraw/zinc/66/87/65/411668765.db2.gz LNYXKKWBJVVPLU-BXUZGUMPSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C)nc(C)n2)[C@H](C)CO1 ZINC000660912629 411668767 /nfs/dbraw/zinc/66/87/67/411668767.db2.gz LNYXKKWBJVVPLU-BXUZGUMPSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@@H+]1Cc1coc(C)n1 ZINC000660912803 411669298 /nfs/dbraw/zinc/66/92/98/411669298.db2.gz NCSAQACBHRFBSY-GFCCVEGCSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@H+]1Cc1coc(C)n1 ZINC000660912803 411669302 /nfs/dbraw/zinc/66/93/02/411669302.db2.gz NCSAQACBHRFBSY-GFCCVEGCSA-N 1 2 238.331 2.372 20 0 BEADLO CC1(C)C[C@H]([N@@H+]2CCCC(F)(F)C2)CO1 ZINC000660911027 411669399 /nfs/dbraw/zinc/66/93/99/411669399.db2.gz DSQQPIUOGSZZON-VIFPVBQESA-N 1 2 219.275 2.285 20 0 BEADLO CC1(C)C[C@H]([N@H+]2CCCC(F)(F)C2)CO1 ZINC000660911027 411669401 /nfs/dbraw/zinc/66/94/01/411669401.db2.gz DSQQPIUOGSZZON-VIFPVBQESA-N 1 2 219.275 2.285 20 0 BEADLO CC(C)=CCC[N@H+]1CCOC[C@H]1c1ccnn1C ZINC000660921206 411672315 /nfs/dbraw/zinc/67/23/15/411672315.db2.gz DKLYHKINYGMOTM-AWEZNQCLSA-N 1 2 249.358 2.150 20 0 BEADLO CC(C)=CCC[N@@H+]1CCOC[C@H]1c1ccnn1C ZINC000660921206 411672319 /nfs/dbraw/zinc/67/23/19/411672319.db2.gz DKLYHKINYGMOTM-AWEZNQCLSA-N 1 2 249.358 2.150 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H](C)OCC23CCC3)co1 ZINC000660921916 411674995 /nfs/dbraw/zinc/67/49/95/411674995.db2.gz ZQWGSJBNHJBBAI-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H](C)OCC23CCC3)co1 ZINC000660921916 411674997 /nfs/dbraw/zinc/67/49/97/411674997.db2.gz ZQWGSJBNHJBBAI-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)NCCC1=CCCC1 ZINC000660945552 411686110 /nfs/dbraw/zinc/68/61/10/411686110.db2.gz JEZMRVJXTLLCBZ-UHFFFAOYSA-N 1 2 248.330 2.052 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)NCCC1=CCCC1 ZINC000660945552 411686116 /nfs/dbraw/zinc/68/61/16/411686116.db2.gz JEZMRVJXTLLCBZ-UHFFFAOYSA-N 1 2 248.330 2.052 20 0 BEADLO CC(F)(F)CC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000660962676 411686809 /nfs/dbraw/zinc/68/68/09/411686809.db2.gz PLOYDRYEZHYVPM-UHFFFAOYSA-N 1 2 239.225 2.318 20 0 BEADLO CCC1(C(=O)Nc2ccn3cc[nH+]c3c2)CC1 ZINC000660955319 411687067 /nfs/dbraw/zinc/68/70/67/411687067.db2.gz NEWZJYYOIPYAFZ-UHFFFAOYSA-N 1 2 229.283 2.463 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)NCC1=CCCCC1 ZINC000661250721 411743599 /nfs/dbraw/zinc/74/35/99/411743599.db2.gz HIPZXODWVXICCX-UHFFFAOYSA-N 1 2 248.330 2.052 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)NCC1=CCCCC1 ZINC000661250721 411743602 /nfs/dbraw/zinc/74/36/02/411743602.db2.gz HIPZXODWVXICCX-UHFFFAOYSA-N 1 2 248.330 2.052 20 0 BEADLO Cc1cc(C[NH2+]CC(C)(F)F)cnc1F ZINC000894625294 583497465 /nfs/dbraw/zinc/49/74/65/583497465.db2.gz RYLHUGNPACMONB-UHFFFAOYSA-N 1 2 218.222 2.274 20 0 BEADLO Cc1noc(C[N@@H+]2CCc3ccc(C)cc3C2)n1 ZINC000661372215 411756351 /nfs/dbraw/zinc/75/63/51/411756351.db2.gz ZZWSCQJVZKWQIN-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1noc(C[N@H+]2CCc3ccc(C)cc3C2)n1 ZINC000661372215 411756357 /nfs/dbraw/zinc/75/63/57/411756357.db2.gz ZZWSCQJVZKWQIN-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1ccc(NCCc2cccc(C)[nH+]2)nn1 ZINC000663858105 411763024 /nfs/dbraw/zinc/76/30/24/411763024.db2.gz MKQZXIMJGXCJDX-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO CC(C)c1cc(NCc2ccc[nH+]c2N)ncn1 ZINC000663963886 411793276 /nfs/dbraw/zinc/79/32/76/411793276.db2.gz ZRQUNOAOEXSIBU-UHFFFAOYSA-N 1 2 243.314 2.189 20 0 BEADLO CC(C)C[C@H](C)[N@@H+]1CC[C@H](O)C(F)(F)C1 ZINC000661411775 411770794 /nfs/dbraw/zinc/77/07/94/411770794.db2.gz AQEYFLDBTRYJGF-UWVGGRQHSA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)C[C@H](C)[N@H+]1CC[C@H](O)C(F)(F)C1 ZINC000661411775 411770796 /nfs/dbraw/zinc/77/07/96/411770796.db2.gz AQEYFLDBTRYJGF-UWVGGRQHSA-N 1 2 221.291 2.123 20 0 BEADLO Cc1cnc(C[N@H+]2CC3(CCC3)OC[C@H]2C)o1 ZINC000661464968 411782844 /nfs/dbraw/zinc/78/28/44/411782844.db2.gz CUSSESTWCJEUKK-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1cnc(C[N@@H+]2CC3(CCC3)OC[C@H]2C)o1 ZINC000661464968 411782847 /nfs/dbraw/zinc/78/28/47/411782847.db2.gz CUSSESTWCJEUKK-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO C[C@H](c1cnccn1)[N@@H+]1CCO[C@](C)(C2CC2)C1 ZINC000661169949 411725498 /nfs/dbraw/zinc/72/54/98/411725498.db2.gz VMDRTYUFVYLMQQ-RISCZKNCSA-N 1 2 247.342 2.039 20 0 BEADLO C[C@H](c1cnccn1)[N@H+]1CCO[C@](C)(C2CC2)C1 ZINC000661169949 411725504 /nfs/dbraw/zinc/72/55/04/411725504.db2.gz VMDRTYUFVYLMQQ-RISCZKNCSA-N 1 2 247.342 2.039 20 0 BEADLO Cc1cnc([C@H](C)[NH+]2C[C@@H](C)C(=O)[C@H](C)C2)cn1 ZINC000661538841 411798507 /nfs/dbraw/zinc/79/85/07/411798507.db2.gz LBVGXIFXHBOCPI-FOGDFJRCSA-N 1 2 247.342 2.003 20 0 BEADLO Cc1ccc(C[NH+]2C[C@@H](C)C(=O)[C@H](C)C2)nc1 ZINC000661547029 411799473 /nfs/dbraw/zinc/79/94/73/411799473.db2.gz RCUUWYMBKHWQPV-VXGBXAGGSA-N 1 2 232.327 2.047 20 0 BEADLO CC[C@@H](C)NC(=O)[C@@H](C)[NH+]1Cc2ccccc2C1 ZINC000178646262 170744350 /nfs/dbraw/zinc/74/43/50/170744350.db2.gz GCABMSSHHXZILG-VXGBXAGGSA-N 1 2 246.354 2.305 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cscn2)C[C@H](C)O1 ZINC000661855428 411904556 /nfs/dbraw/zinc/90/45/56/411904556.db2.gz HAHXSRFJKBWWTA-ZJUUUORDSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cscn2)C[C@H](C)O1 ZINC000661855428 411904558 /nfs/dbraw/zinc/90/45/58/411904558.db2.gz HAHXSRFJKBWWTA-ZJUUUORDSA-N 1 2 226.345 2.142 20 0 BEADLO CCO[C@H]1C[C@H](Nc2cc(CC)[nH+]cn2)C1 ZINC000664281652 411911627 /nfs/dbraw/zinc/91/16/27/411911627.db2.gz SWKRGESNPNJPTE-XYPYZODXSA-N 1 2 221.304 2.018 20 0 BEADLO CCO[C@H]1C[C@H](Nc2[nH+]c(C)nc3[nH]ccc32)C1 ZINC000664280014 411911900 /nfs/dbraw/zinc/91/19/00/411911900.db2.gz DYLHHIBNMPBATR-MGCOHNPYSA-N 1 2 246.314 2.246 20 0 BEADLO COCC1(C2CCC2)CN(c2cc[nH+]c(C)n2)C1 ZINC000664284613 411911972 /nfs/dbraw/zinc/91/19/72/411911972.db2.gz RROPXQISHHLELR-UHFFFAOYSA-N 1 2 247.342 2.038 20 0 BEADLO CN(c1ccccc1)[C@@H]1CC[N@H+](CC(F)F)C1 ZINC000662023241 411942851 /nfs/dbraw/zinc/94/28/51/411942851.db2.gz XXHOIXMLSCCIOA-GFCCVEGCSA-N 1 2 240.297 2.462 20 0 BEADLO CN(c1ccccc1)[C@@H]1CC[N@@H+](CC(F)F)C1 ZINC000662023241 411942856 /nfs/dbraw/zinc/94/28/56/411942856.db2.gz XXHOIXMLSCCIOA-GFCCVEGCSA-N 1 2 240.297 2.462 20 0 BEADLO CC[C@@H](C)n1ncc(NCc2[nH]cc[nH+]2)c1C ZINC000359811342 170811123 /nfs/dbraw/zinc/81/11/23/170811123.db2.gz DOBDYLGQZOGGRK-SECBINFHSA-N 1 2 233.319 2.498 20 0 BEADLO Cc1nc(NC[C@@H](C)c2ccccn2)cc[nH+]1 ZINC000664148903 411872454 /nfs/dbraw/zinc/87/24/54/411872454.db2.gz PZTNAHIZJZWEOY-SNVBAGLBSA-N 1 2 228.299 2.396 20 0 BEADLO C[C@@H]1CN(c2[nH]c3ccccc3[nH+]2)C[C@@]1(C)CO ZINC000664597406 411994327 /nfs/dbraw/zinc/99/43/27/411994327.db2.gz ZZPBWYAKNQFMSF-YGRLFVJLSA-N 1 2 245.326 2.018 20 0 BEADLO C[C@@H](Nc1ccnc(C2CC2)n1)c1[nH+]ccn1C ZINC000664609474 411998402 /nfs/dbraw/zinc/99/84/02/411998402.db2.gz ZWXANNBTNKBRNM-SECBINFHSA-N 1 2 243.314 2.261 20 0 BEADLO CCc1cc(C)nc(N[C@H](C)c2[nH+]ccn2C)n1 ZINC000664608954 411998730 /nfs/dbraw/zinc/99/87/30/411998730.db2.gz RAQZMVSKZKDVBL-SNVBAGLBSA-N 1 2 245.330 2.254 20 0 BEADLO Cc1nc(N[C@@H](c2ccccc2)[C@@H](C)O)cc[nH+]1 ZINC000664658124 412006148 /nfs/dbraw/zinc/00/61/48/412006148.db2.gz QYMQTFULFVNMMM-QMTHXVAHSA-N 1 2 243.310 2.319 20 0 BEADLO Cc1cc(N[C@@H](c2ccccc2)[C@@H](C)O)nc[nH+]1 ZINC000664653738 412006855 /nfs/dbraw/zinc/00/68/55/412006855.db2.gz CAGHESHDQKFRLE-BXUZGUMPSA-N 1 2 243.310 2.319 20 0 BEADLO c1nn[nH]c1CC[N@@H+]1CCCC[C@@H]1CC1CCC1 ZINC000662156919 412011847 /nfs/dbraw/zinc/01/18/47/412011847.db2.gz NCUHVRXCBCYLIH-CQSZACIVSA-N 1 2 248.374 2.392 20 0 BEADLO c1nn[nH]c1CC[N@H+]1CCCC[C@@H]1CC1CCC1 ZINC000662156919 412011850 /nfs/dbraw/zinc/01/18/50/412011850.db2.gz NCUHVRXCBCYLIH-CQSZACIVSA-N 1 2 248.374 2.392 20 0 BEADLO CCc1cc(NC[C@@]2(C)CC2(F)F)nc[nH+]1 ZINC000664400777 411944848 /nfs/dbraw/zinc/94/48/48/411944848.db2.gz OFGLEHZNBIPXQM-SNVBAGLBSA-N 1 2 227.258 2.496 20 0 BEADLO c1cc(C[NH+]2CCC(c3ccon3)CC2)no1 ZINC000662046771 411962520 /nfs/dbraw/zinc/96/25/20/411962520.db2.gz OHRYCTPSWJYKRN-UHFFFAOYSA-N 1 2 233.271 2.042 20 0 BEADLO CC[C@H](c1nc(C[NH2+]C)no1)c1ccccc1 ZINC000051848692 170955441 /nfs/dbraw/zinc/95/54/41/170955441.db2.gz VYVQDRGVWTYLOH-NSHDSACASA-N 1 2 231.299 2.331 20 0 BEADLO CC1(C)CN(Cc2c[nH+]c[nH]2)[C@H]1c1cccnc1 ZINC000664821599 412026784 /nfs/dbraw/zinc/02/67/84/412026784.db2.gz FECLVKBYACVSLU-ZDUSSCGKSA-N 1 2 242.326 2.388 20 0 BEADLO Cc1nc(C[N@@H+]2CCCc3n[nH]cc3C2)cs1 ZINC000664861865 412034451 /nfs/dbraw/zinc/03/44/51/412034451.db2.gz FGJWVGSHVGFTKI-UHFFFAOYSA-N 1 2 248.355 2.123 20 0 BEADLO Cc1nc(C[N@H+]2CCCc3n[nH]cc3C2)cs1 ZINC000664861865 412034456 /nfs/dbraw/zinc/03/44/56/412034456.db2.gz FGJWVGSHVGFTKI-UHFFFAOYSA-N 1 2 248.355 2.123 20 0 BEADLO c1csc(C[N@@H+]2CCCc3[nH]ncc3C2)c1 ZINC000664862513 412034727 /nfs/dbraw/zinc/03/47/27/412034727.db2.gz QBOUQIBQQHHZNH-UHFFFAOYSA-N 1 2 233.340 2.420 20 0 BEADLO c1csc(C[N@H+]2CCCc3[nH]ncc3C2)c1 ZINC000664862513 412034730 /nfs/dbraw/zinc/03/47/30/412034730.db2.gz QBOUQIBQQHHZNH-UHFFFAOYSA-N 1 2 233.340 2.420 20 0 BEADLO COC(C)(C)CC[N@H+](C)Cc1nnc(C)s1 ZINC000662256210 412051393 /nfs/dbraw/zinc/05/13/93/412051393.db2.gz HBEUATPXOLVIKZ-UHFFFAOYSA-N 1 2 243.376 2.093 20 0 BEADLO COC(C)(C)CC[N@@H+](C)Cc1nnc(C)s1 ZINC000662256210 412051395 /nfs/dbraw/zinc/05/13/95/412051395.db2.gz HBEUATPXOLVIKZ-UHFFFAOYSA-N 1 2 243.376 2.093 20 0 BEADLO CC[C@H](OC)c1nc(Cc2c[nH+]ccc2C)no1 ZINC000664982337 412055119 /nfs/dbraw/zinc/05/51/19/412055119.db2.gz SQSJCZPPXXFLQZ-NSHDSACASA-N 1 2 247.298 2.461 20 0 BEADLO Cc1cc[nH+]cc1Cc1noc([C@H]2C[C@@H]2C)n1 ZINC000664981652 412055132 /nfs/dbraw/zinc/05/51/32/412055132.db2.gz XJARBDXFRTZYAH-ONGXEEELSA-N 1 2 229.283 2.487 20 0 BEADLO Cc1nn2c(C[NH+]3CC4(CC4)C3)c(C)nc2s1 ZINC000335382714 487621452 /nfs/dbraw/zinc/62/14/52/487621452.db2.gz CNMMWSLOXDBAOT-UHFFFAOYSA-N 1 2 248.355 2.003 20 0 BEADLO CC[C@H]1CC[C@H](C(=O)NCCn2cc[nH+]c2)CC1 ZINC000188000955 171030184 /nfs/dbraw/zinc/03/01/84/171030184.db2.gz VEEAQIHCHQKJLH-BETUJISGSA-N 1 2 249.358 2.216 20 0 BEADLO CC[C@@H]1CC[C@@H]1[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000309620890 171045473 /nfs/dbraw/zinc/04/54/73/171045473.db2.gz DFUSKTLBWFSTHX-MXWKQRLJSA-N 1 2 227.348 2.495 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1c1nc(C)[nH+]c(N(C)C)n1 ZINC000357297046 171056364 /nfs/dbraw/zinc/05/63/64/171056364.db2.gz YXEXSHQOSFVOSN-GXSJLCMTSA-N 1 2 249.362 2.013 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1c1nc(N(C)C)nc(C)[nH+]1 ZINC000357297046 171056367 /nfs/dbraw/zinc/05/63/67/171056367.db2.gz YXEXSHQOSFVOSN-GXSJLCMTSA-N 1 2 249.362 2.013 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2csc(C)n2)C[C@@H](C)O1 ZINC000247073249 171090683 /nfs/dbraw/zinc/09/06/83/171090683.db2.gz YSDBXIONNCANPA-BXKDBHETSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2csc(C)n2)C[C@@H](C)O1 ZINC000247073249 171090686 /nfs/dbraw/zinc/09/06/86/171090686.db2.gz YSDBXIONNCANPA-BXKDBHETSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2[nH]ncc2C)CCS1 ZINC000290569419 171091842 /nfs/dbraw/zinc/09/18/42/171091842.db2.gz YKDQHYKIHIVXFW-SNVBAGLBSA-N 1 2 225.361 2.046 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2[nH]ncc2C)CCS1 ZINC000290569419 171091845 /nfs/dbraw/zinc/09/18/45/171091845.db2.gz YKDQHYKIHIVXFW-SNVBAGLBSA-N 1 2 225.361 2.046 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2scnc2C)CCO1 ZINC000271055230 171094953 /nfs/dbraw/zinc/09/49/53/171094953.db2.gz ZDPVXQFNZGIGIG-SNVBAGLBSA-N 1 2 226.345 2.062 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2scnc2C)CCO1 ZINC000271055230 171094956 /nfs/dbraw/zinc/09/49/56/171094956.db2.gz ZDPVXQFNZGIGIG-SNVBAGLBSA-N 1 2 226.345 2.062 20 0 BEADLO CC[C@@H]1CN(c2cc(C)[nH+]c(C(C)C)n2)C[C@H]1O ZINC000340574624 171098293 /nfs/dbraw/zinc/09/82/93/171098293.db2.gz PCOSISAITVMFAO-VXGBXAGGSA-N 1 2 249.358 2.116 20 0 BEADLO CCO[C@@H](CC)c1noc(C[NH+](CC)CC)n1 ZINC000665038468 412064783 /nfs/dbraw/zinc/06/47/83/412064783.db2.gz HSKUMYIDXQBSLA-JTQLQIEISA-N 1 2 241.335 2.399 20 0 BEADLO CC[C@@](C)(OC)C(=O)Nc1ccc(C)[nH+]c1C ZINC000280333761 171191894 /nfs/dbraw/zinc/19/18/94/171191894.db2.gz LOSIFFLIGJGBEU-CYBMUJFWSA-N 1 2 236.315 2.452 20 0 BEADLO CC[C@@H](NC(=O)[C@@H](C)CC)c1[nH]cc[nH+]1 ZINC000125339829 171253780 /nfs/dbraw/zinc/25/37/80/171253780.db2.gz QXMLJJMLUYPPRE-DTWKUNHWSA-N 1 2 209.293 2.023 20 0 BEADLO CC[C@H](C)C(=O)OCc1c[nH+]ccc1OC ZINC000288639522 171256312 /nfs/dbraw/zinc/25/63/12/171256312.db2.gz KXXAZJAIHPHLTH-VIFPVBQESA-N 1 2 223.272 2.180 20 0 BEADLO CC[C@H](C)CC(=O)NCCNc1cccc[nH+]1 ZINC000276734162 171259739 /nfs/dbraw/zinc/25/97/39/171259739.db2.gz BXUXPYZADNTIGJ-NSHDSACASA-N 1 2 235.331 2.046 20 0 BEADLO CC[C@H](C)CCC(=O)N1CCn2cc(C)[nH+]c2C1 ZINC000376050107 171265967 /nfs/dbraw/zinc/26/59/67/171265967.db2.gz JMDCHJFPKCZBQO-NSHDSACASA-N 1 2 249.358 2.360 20 0 BEADLO CC[C@H](C)C[C@@H](C)NC(=O)CCc1[nH]cc[nH+]1 ZINC000288621609 171294610 /nfs/dbraw/zinc/29/46/10/171294610.db2.gz DKUXMVVDRRJYMJ-WDEREUQCSA-N 1 2 237.347 2.283 20 0 BEADLO CC[C@H](C)C[C@H](C)NC(=O)c1c[nH+]c(C)[nH]1 ZINC000266470827 171298366 /nfs/dbraw/zinc/29/83/66/171298366.db2.gz JDQDBKRNTMZNQZ-IUCAKERBSA-N 1 2 223.320 2.273 20 0 BEADLO CC[C@H](C)[N@H+](CCC(F)(F)F)CC(=O)OC ZINC000337223344 171312469 /nfs/dbraw/zinc/31/24/69/171312469.db2.gz DBQRENXBQGTINI-QMMMGPOBSA-N 1 2 241.253 2.212 20 0 BEADLO CC[C@H](C)[N@@H+](CCC(F)(F)F)CC(=O)OC ZINC000337223344 171312472 /nfs/dbraw/zinc/31/24/72/171312472.db2.gz DBQRENXBQGTINI-QMMMGPOBSA-N 1 2 241.253 2.212 20 0 BEADLO CC[C@H](C)[NH2+][C@](C)(C(=O)OC)c1ccccc1 ZINC000038067053 171348705 /nfs/dbraw/zinc/34/87/05/171348705.db2.gz GXBHQYXHKJAQJL-FZMZJTMJSA-N 1 2 235.327 2.463 20 0 BEADLO CC[C@H](C)[NH2+][C@@H](c1nnc[nH]1)c1ccc(F)cc1 ZINC000295895230 171348930 /nfs/dbraw/zinc/34/89/30/171348930.db2.gz IKRXCXQGIUHACO-JOYOIKCWSA-N 1 2 248.305 2.421 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)NCCNc1cccc[nH+]1 ZINC000272579121 171384086 /nfs/dbraw/zinc/38/40/86/171384086.db2.gz OAWWRXDGGSSJCZ-RYUDHWBXSA-N 1 2 249.358 2.292 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)NCc1[nH]c[nH+]c1C ZINC000272687522 171384605 /nfs/dbraw/zinc/38/46/05/171384605.db2.gz PMOHCSVQNIDWIF-IUCAKERBSA-N 1 2 223.320 2.017 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)NCc1[nH+]ccn1CC ZINC000295544888 171384946 /nfs/dbraw/zinc/38/49/46/171384946.db2.gz DAMSRFGHVNUIFK-QWRGUYRKSA-N 1 2 237.347 2.201 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000272502568 171385207 /nfs/dbraw/zinc/38/52/07/171385207.db2.gz DUZZZFWKYJQWHZ-TUAOUCFPSA-N 1 2 237.347 2.070 20 0 BEADLO FC(F)C[N@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000662310094 412094545 /nfs/dbraw/zinc/09/45/45/412094545.db2.gz OVFYBIMOZDXANF-TXEJJXNPSA-N 1 2 231.286 2.144 20 0 BEADLO FC(F)C[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000662310094 412094547 /nfs/dbraw/zinc/09/45/47/412094547.db2.gz OVFYBIMOZDXANF-TXEJJXNPSA-N 1 2 231.286 2.144 20 0 BEADLO C[N@@H+](Cc1csnn1)C[C@@H]1CC1(C)C ZINC000662345059 412114019 /nfs/dbraw/zinc/11/40/19/412114019.db2.gz VGNRBEWADGCLHI-QMMMGPOBSA-N 1 2 211.334 2.016 20 0 BEADLO C[N@H+](Cc1csnn1)C[C@@H]1CC1(C)C ZINC000662345059 412114022 /nfs/dbraw/zinc/11/40/22/412114022.db2.gz VGNRBEWADGCLHI-QMMMGPOBSA-N 1 2 211.334 2.016 20 0 BEADLO Cc1nc([C@@H](C)[N@H+](C)C[C@@H]2CC2(C)C)no1 ZINC000662346004 412115091 /nfs/dbraw/zinc/11/50/91/412115091.db2.gz PUZLUYDDSSCBFX-SCZZXKLOSA-N 1 2 223.320 2.417 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+](C)C[C@@H]2CC2(C)C)no1 ZINC000662346004 412115094 /nfs/dbraw/zinc/11/50/94/412115094.db2.gz PUZLUYDDSSCBFX-SCZZXKLOSA-N 1 2 223.320 2.417 20 0 BEADLO c1c[nH+]c(-c2ccc3c(c2)CCCO3)[nH]1 ZINC000665183859 412122485 /nfs/dbraw/zinc/12/24/85/412122485.db2.gz FRUFXEGHLFXJGZ-UHFFFAOYSA-N 1 2 200.241 2.402 20 0 BEADLO Cn1c[nH+]cc1-c1cccc2c1OCCCO2 ZINC000665202418 412134939 /nfs/dbraw/zinc/13/49/39/412134939.db2.gz CLBGIUKBPSWSRE-UHFFFAOYSA-N 1 2 230.267 2.248 20 0 BEADLO CC[C@H](F)C[NH2+][C@@H](COC)c1ccco1 ZINC000336771040 171475220 /nfs/dbraw/zinc/47/52/20/171475220.db2.gz WFFFHNKHVNPVHK-UWVGGRQHSA-N 1 2 215.268 2.305 20 0 BEADLO CC[C@H]([NH2+][C@H]1CCCC(F)(F)C1)C(=O)OC ZINC000309505295 171547742 /nfs/dbraw/zinc/54/77/42/171547742.db2.gz BTVHDPNBJUHDKU-IUCAKERBSA-N 1 2 235.274 2.106 20 0 BEADLO CC[C@H]1CC[N@@H+]1Cc1nccn1C(F)F ZINC000292422173 171637455 /nfs/dbraw/zinc/63/74/55/171637455.db2.gz MWVKSYZCJWJBSP-QMMMGPOBSA-N 1 2 215.247 2.263 20 0 BEADLO CC[C@H]1CC[N@H+]1Cc1nccn1C(F)F ZINC000292422173 171637456 /nfs/dbraw/zinc/63/74/56/171637456.db2.gz MWVKSYZCJWJBSP-QMMMGPOBSA-N 1 2 215.247 2.263 20 0 BEADLO c1cn(Cc2nc3c(s2)CCCC3)c[nH+]1 ZINC000663220698 412394248 /nfs/dbraw/zinc/39/42/48/412394248.db2.gz UQNUNQIWKCLWJW-UHFFFAOYSA-N 1 2 219.313 2.267 20 0 BEADLO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2ccncc2)[nH]1 ZINC000358245262 172001528 /nfs/dbraw/zinc/00/15/28/172001528.db2.gz HJSNBSHBQURGBE-NXEZZACHSA-N 1 2 245.330 2.174 20 0 BEADLO CCc1nnc([C@H](C)[NH2+]Cc2occc2C)[nH]1 ZINC000270627564 172006234 /nfs/dbraw/zinc/00/62/34/172006234.db2.gz DWEPQEXAKTUCRG-VIFPVBQESA-N 1 2 234.303 2.119 20 0 BEADLO CCc1nnc(C[N@H+](C)[C@@H](C)c2ccncc2)o1 ZINC000162439135 172047834 /nfs/dbraw/zinc/04/78/34/172047834.db2.gz TUQYXMUDNRYQNB-JTQLQIEISA-N 1 2 246.314 2.220 20 0 BEADLO CCc1nnc(C[N@@H+](C)[C@@H](C)c2ccncc2)o1 ZINC000162439135 172047835 /nfs/dbraw/zinc/04/78/35/172047835.db2.gz TUQYXMUDNRYQNB-JTQLQIEISA-N 1 2 246.314 2.220 20 0 BEADLO CCc1nnc([C@H](C)[N@@H+]2C[C@H](C)[C@H]2C)o1 ZINC000339581757 172066399 /nfs/dbraw/zinc/06/63/99/172066399.db2.gz XGLFNCYVGYRSAB-YIZRAAEISA-N 1 2 209.293 2.033 20 0 BEADLO CCc1nnc([C@H](C)[N@H+]2C[C@H](C)[C@H]2C)o1 ZINC000339581757 172066400 /nfs/dbraw/zinc/06/64/00/172066400.db2.gz XGLFNCYVGYRSAB-YIZRAAEISA-N 1 2 209.293 2.033 20 0 BEADLO CCc1noc(C)c1C[N@H+]1CCOC[C@@H]1CC ZINC000119232346 172078333 /nfs/dbraw/zinc/07/83/33/172078333.db2.gz YHACRMZJEZSSIB-NSHDSACASA-N 1 2 238.331 2.156 20 0 BEADLO CCc1noc(C)c1C[N@@H+]1CCOC[C@@H]1CC ZINC000119232346 172078336 /nfs/dbraw/zinc/07/83/36/172078336.db2.gz YHACRMZJEZSSIB-NSHDSACASA-N 1 2 238.331 2.156 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1ccccn1 ZINC000293537331 172094543 /nfs/dbraw/zinc/09/45/43/172094543.db2.gz XPJJSSOPNOUPKA-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1ccccn1 ZINC000293537331 172094546 /nfs/dbraw/zinc/09/45/46/172094546.db2.gz XPJJSSOPNOUPKA-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1nocc1C[NH2+]Cc1nc(C)cs1 ZINC000339184547 172101357 /nfs/dbraw/zinc/10/13/57/172101357.db2.gz WCHOJZJDTPKWBQ-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO CC(C)[C@H]1CCN(C(=O)CCCn2cc[nH+]c2)C1 ZINC000674810348 487624018 /nfs/dbraw/zinc/62/40/18/487624018.db2.gz HOSZHCSZNCUVNU-ZDUSSCGKSA-N 1 2 249.358 2.168 20 0 BEADLO CCn1cc(C(=O)Nc2ccc(C)[nH+]c2C)cn1 ZINC000119173570 172156290 /nfs/dbraw/zinc/15/62/90/172156290.db2.gz AHQWIUDLIJZLLF-UHFFFAOYSA-N 1 2 244.298 2.167 20 0 BEADLO CCn1cc(C[NH2+][C@@H](C)c2cscn2)cn1 ZINC000129689167 172173855 /nfs/dbraw/zinc/17/38/55/172173855.db2.gz IKUKEILQCOPZPS-VIFPVBQESA-N 1 2 236.344 2.210 20 0 BEADLO CCn1cc(CNc2c[nH+]ccc2C)cn1 ZINC000119016897 172175407 /nfs/dbraw/zinc/17/54/07/172175407.db2.gz ACDFRDQUTISGKT-UHFFFAOYSA-N 1 2 216.288 2.219 20 0 BEADLO CCn1cc([C@@H](C)[NH2+]Cc2nccs2)cn1 ZINC000044500263 172195180 /nfs/dbraw/zinc/19/51/80/172195180.db2.gz CJZOOHAMSRYSKA-SECBINFHSA-N 1 2 236.344 2.210 20 0 BEADLO CCn1cc([C@@H](C)Nc2cc[nH+]c(C)n2)cn1 ZINC000295486377 172195190 /nfs/dbraw/zinc/19/51/90/172195190.db2.gz AFESQZHKZXJVKD-SECBINFHSA-N 1 2 231.303 2.175 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)OC1CCCC1 ZINC000295477954 172221715 /nfs/dbraw/zinc/22/17/15/172221715.db2.gz MIZSPIKMFLCDEZ-UHFFFAOYSA-N 1 2 237.303 2.072 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C=C1CCCCC1 ZINC000295748816 172221843 /nfs/dbraw/zinc/22/18/43/172221843.db2.gz NELVWOQIFYQDFX-UHFFFAOYSA-N 1 2 247.342 2.410 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C1CCCCCC1 ZINC000295789311 172221854 /nfs/dbraw/zinc/22/18/54/172221854.db2.gz QTLRNBLMLKYDEJ-UHFFFAOYSA-N 1 2 249.358 2.490 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C[C@@H]1CCC[C@H]1C ZINC000295590349 172221929 /nfs/dbraw/zinc/22/19/29/172221929.db2.gz HUGHSCIQNCUSIG-NEPJUHHUSA-N 1 2 249.358 2.346 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)CCC1CCC1 ZINC000295551121 172222903 /nfs/dbraw/zinc/22/29/03/172222903.db2.gz DQBPWSVXZWDIQN-UHFFFAOYSA-N 1 2 235.331 2.100 20 0 BEADLO CCn1cc[nH+]c1CNc1ccc(F)cn1 ZINC000271929724 172224265 /nfs/dbraw/zinc/22/42/65/172224265.db2.gz KNWIEQASNOHEBJ-UHFFFAOYSA-N 1 2 220.251 2.049 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)Nc1ccc(OC)nc1 ZINC000296701447 172229344 /nfs/dbraw/zinc/22/93/44/172229344.db2.gz HROTWWDCGWEXOA-SNVBAGLBSA-N 1 2 246.314 2.480 20 0 BEADLO CCn1nccc1CNc1c[nH+]cc(C)c1 ZINC000119825878 172274196 /nfs/dbraw/zinc/27/41/96/172274196.db2.gz OAGHIFMYTSLVLN-UHFFFAOYSA-N 1 2 216.288 2.219 20 0 BEADLO CCn1ncnc1C[N@H+](C)Cc1cccc(C)c1 ZINC000278556598 172278291 /nfs/dbraw/zinc/27/82/91/172278291.db2.gz UZIUUWULHMRCAR-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1ncnc1C[N@@H+](C)Cc1cccc(C)c1 ZINC000278556598 172278293 /nfs/dbraw/zinc/27/82/93/172278293.db2.gz UZIUUWULHMRCAR-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1ncnc1C[NH2+]Cc1cc(F)ccc1C ZINC000355602308 172282563 /nfs/dbraw/zinc/28/25/63/172282563.db2.gz VCOONOCNKSHYBH-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO CN(C)c1cccnc1C[NH2+]Cc1ccco1 ZINC000289855164 172572633 /nfs/dbraw/zinc/57/26/33/172572633.db2.gz PXDFYTJDQQCPGZ-UHFFFAOYSA-N 1 2 231.299 2.030 20 0 BEADLO CN1CC[N@H+](Cc2cocn2)Cc2ccccc21 ZINC000278174940 173090540 /nfs/dbraw/zinc/09/05/40/173090540.db2.gz PHBOXWZAVFEBCC-UHFFFAOYSA-N 1 2 243.310 2.127 20 0 BEADLO CN1CC[N@@H+](Cc2cocn2)Cc2ccccc21 ZINC000278174940 173090541 /nfs/dbraw/zinc/09/05/41/173090541.db2.gz PHBOXWZAVFEBCC-UHFFFAOYSA-N 1 2 243.310 2.127 20 0 BEADLO C[NH2+]Cc1noc(CSCCC(C)C)n1 ZINC000336719415 173399264 /nfs/dbraw/zinc/39/92/64/173399264.db2.gz YEKRPJWAPMETMH-UHFFFAOYSA-N 1 2 229.349 2.068 20 0 BEADLO COC1CC(Nc2ccc(SC)c[nH+]2)C1 ZINC000308944606 174019603 /nfs/dbraw/zinc/01/96/03/174019603.db2.gz NFONUCJHNONYCB-UHFFFAOYSA-N 1 2 224.329 2.393 20 0 BEADLO COCC(=O)OCc1ccc(C(C)C)[nH+]c1C ZINC000293450767 174062557 /nfs/dbraw/zinc/06/25/57/174062557.db2.gz PIEMBMVCFRNYNN-UHFFFAOYSA-N 1 2 237.299 2.203 20 0 BEADLO COCCC(C)(C)Nc1cc[nH+]c(C)n1 ZINC000336770249 174147756 /nfs/dbraw/zinc/14/77/56/174147756.db2.gz VLVFFMXLYXJRCV-UHFFFAOYSA-N 1 2 209.293 2.012 20 0 BEADLO COCCC1(C)CN(c2nc(C)[nH+]c(C)c2C)C1 ZINC000341116462 174154684 /nfs/dbraw/zinc/15/46/84/174154684.db2.gz KYCUKHSOGRTDIE-UHFFFAOYSA-N 1 2 249.358 2.265 20 0 BEADLO COCCC1(CNc2cc[nH+]c(C)n2)CC1 ZINC000152497147 174158383 /nfs/dbraw/zinc/15/83/83/174158383.db2.gz OWVJPYATGJVSAS-UHFFFAOYSA-N 1 2 221.304 2.014 20 0 BEADLO COCCCN1CC[N@H+](C)C[C@@H]1c1ccccc1 ZINC000245697625 174231817 /nfs/dbraw/zinc/23/18/17/174231817.db2.gz WZPYDQJMRPJBPZ-OAHLLOKOSA-N 1 2 248.370 2.012 20 0 BEADLO COCCCN1CC[N@@H+](C)C[C@@H]1c1ccccc1 ZINC000245697625 174231820 /nfs/dbraw/zinc/23/18/20/174231820.db2.gz WZPYDQJMRPJBPZ-OAHLLOKOSA-N 1 2 248.370 2.012 20 0 BEADLO COCCC[C@H](C)C(=O)Nc1cc[nH+]c(C)c1 ZINC000179861615 174263048 /nfs/dbraw/zinc/26/30/48/174263048.db2.gz RFVARDRSAPLGLO-JTQLQIEISA-N 1 2 236.315 2.391 20 0 BEADLO COCC[N@H+](C)Cc1cc(C(C)(C)C)on1 ZINC000284380185 174280820 /nfs/dbraw/zinc/28/08/20/174280820.db2.gz UVDZNFZQNMAPQN-UHFFFAOYSA-N 1 2 226.320 2.050 20 0 BEADLO COCC[N@@H+](C)Cc1cc(C(C)(C)C)on1 ZINC000284380185 174280821 /nfs/dbraw/zinc/28/08/21/174280821.db2.gz UVDZNFZQNMAPQN-UHFFFAOYSA-N 1 2 226.320 2.050 20 0 BEADLO COCC[N@H+](C)Cc1c(Cl)cccc1OC ZINC000338236156 174280896 /nfs/dbraw/zinc/28/08/96/174280896.db2.gz JJXYOBBLOTUKCE-UHFFFAOYSA-N 1 2 243.734 2.427 20 0 BEADLO COCC[N@@H+](C)Cc1c(Cl)cccc1OC ZINC000338236156 174280897 /nfs/dbraw/zinc/28/08/97/174280897.db2.gz JJXYOBBLOTUKCE-UHFFFAOYSA-N 1 2 243.734 2.427 20 0 BEADLO COCC[N@H+](Cc1csc(C)n1)C1CC1 ZINC000336643645 174300343 /nfs/dbraw/zinc/30/03/43/174300343.db2.gz DCEPKUGRFJHPOD-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO COCC[N@@H+](Cc1csc(C)n1)C1CC1 ZINC000336643645 174300345 /nfs/dbraw/zinc/30/03/45/174300345.db2.gz DCEPKUGRFJHPOD-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO COCC[N@@H+]1Cc2cccc(Cl)c2C1 ZINC000287272071 174318258 /nfs/dbraw/zinc/31/82/58/174318258.db2.gz HSRMCGZSFFOANH-UHFFFAOYSA-N 1 2 211.692 2.302 20 0 BEADLO COCC[N@H+]1Cc2cccc(Cl)c2C1 ZINC000287272071 174318260 /nfs/dbraw/zinc/31/82/60/174318260.db2.gz HSRMCGZSFFOANH-UHFFFAOYSA-N 1 2 211.692 2.302 20 0 BEADLO COCCNc1nc(C)[nH+]c2ccc(OC)cc21 ZINC000301953590 174341953 /nfs/dbraw/zinc/34/19/53/174341953.db2.gz JWNCTAJHFVHXBB-UHFFFAOYSA-N 1 2 247.298 2.005 20 0 BEADLO COCCOCCNc1[nH+]ccc(C)c1Cl ZINC000336724080 174359222 /nfs/dbraw/zinc/35/92/22/174359222.db2.gz AZJOOHAYYNABBW-UHFFFAOYSA-N 1 2 244.722 2.118 20 0 BEADLO COCC[C@@H]1CCCCN(c2cc[nH+]c(C)n2)C1 ZINC000377258533 174395182 /nfs/dbraw/zinc/39/51/82/174395182.db2.gz SFKRFIGSKMAISY-ZDUSSCGKSA-N 1 2 249.358 2.428 20 0 BEADLO COC[C@H](Nc1cc[nH+]c(C)n1)c1ccc(C)o1 ZINC000176947259 174587805 /nfs/dbraw/zinc/58/78/05/174587805.db2.gz FWOZTBCAIYCZCQ-NSHDSACASA-N 1 2 247.298 2.486 20 0 BEADLO COc1ccc(C(=O)Nc2cc[nH+]cc2O)cc1 ZINC000109889272 175063453 /nfs/dbraw/zinc/06/34/53/175063453.db2.gz CQJYVRQJXNXIDP-UHFFFAOYSA-N 1 2 244.250 2.048 20 0 BEADLO COc1ccc(C)cc1NCc1c[nH+]cn1C ZINC000090153476 175078464 /nfs/dbraw/zinc/07/84/64/175078464.db2.gz VOLWBXRQUNJWFO-UHFFFAOYSA-N 1 2 231.299 2.349 20 0 BEADLO COc1ccc(C2([NH2+]Cc3ccon3)CC2)cc1 ZINC000341685105 175084522 /nfs/dbraw/zinc/08/45/22/175084522.db2.gz QNXKMYMEKDPPEA-UHFFFAOYSA-N 1 2 244.294 2.462 20 0 BEADLO COc1ccc([NH2+]C2CCN(C=O)CC2)c(C)c1 ZINC000278846189 175149135 /nfs/dbraw/zinc/14/91/35/175149135.db2.gz VEVHKGIMZNWNTI-UHFFFAOYSA-N 1 2 248.326 2.036 20 0 BEADLO COc1ccc(NCc2c[nH+]c[nH]2)c(C)c1 ZINC000061566714 175151746 /nfs/dbraw/zinc/15/17/46/175151746.db2.gz AKVRHUBRVBVTEB-UHFFFAOYSA-N 1 2 217.272 2.339 20 0 BEADLO COc1ccc(NCc2c[nH]c[nH+]2)c(C)c1 ZINC000061566714 175151747 /nfs/dbraw/zinc/15/17/47/175151747.db2.gz AKVRHUBRVBVTEB-UHFFFAOYSA-N 1 2 217.272 2.339 20 0 BEADLO COc1ccc(NCc2[nH+]ccn2C)cc1F ZINC000037290613 175153610 /nfs/dbraw/zinc/15/36/10/175153610.db2.gz VDQAGBNRVUDQHP-UHFFFAOYSA-N 1 2 235.262 2.180 20 0 BEADLO COc1ccc(OC)c(NCc2[nH]cc[nH+]2)c1 ZINC000049714521 175166823 /nfs/dbraw/zinc/16/68/23/175166823.db2.gz ORZDIWBIGXODLD-UHFFFAOYSA-N 1 2 233.271 2.039 20 0 BEADLO COc1ccc2c(c1)C[N@@H+](Cc1ccon1)CC2 ZINC000077270445 175210648 /nfs/dbraw/zinc/21/06/48/175210648.db2.gz HNMPEUBYDDVTCG-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1ccc2c(c1)C[N@H+](Cc1ccon1)CC2 ZINC000077270445 175210650 /nfs/dbraw/zinc/21/06/50/175210650.db2.gz HNMPEUBYDDVTCG-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1ccc2nc(C[NH+]3CCCC3)[nH]c2c1 ZINC000043258037 175228283 /nfs/dbraw/zinc/22/82/83/175228283.db2.gz NDZLNAXQZPIXLN-UHFFFAOYSA-N 1 2 231.299 2.167 20 0 BEADLO COc1cccc(C(F)(F)C[NH2+]C(C)C)n1 ZINC000336717948 175247303 /nfs/dbraw/zinc/24/73/03/175247303.db2.gz XDPCIDITHKZHJU-UHFFFAOYSA-N 1 2 230.258 2.180 20 0 BEADLO COc1cccc(C[NH2+]CC(F)F)c1 ZINC000037755943 175263658 /nfs/dbraw/zinc/26/36/58/175263658.db2.gz CRYGCZOAXFGVLM-UHFFFAOYSA-N 1 2 201.216 2.050 20 0 BEADLO COc1cccc(N[C@H]2CCn3cc[nH+]c32)c1 ZINC000293884621 175279606 /nfs/dbraw/zinc/27/96/06/175279606.db2.gz FXUGLSGHPAZLCH-LBPRGKRZSA-N 1 2 229.283 2.449 20 0 BEADLO COc1ccccc1/C=C/C[N@@H+]1CCO[C@@H](C)C1 ZINC000179864570 175313714 /nfs/dbraw/zinc/31/37/14/175313714.db2.gz WYQFVWNMHCKAIH-IYNGYCSASA-N 1 2 247.338 2.429 20 0 BEADLO COc1ccccc1/C=C/C[N@H+]1CCO[C@@H](C)C1 ZINC000179864570 175313715 /nfs/dbraw/zinc/31/37/15/175313715.db2.gz WYQFVWNMHCKAIH-IYNGYCSASA-N 1 2 247.338 2.429 20 0 BEADLO COc1ccccc1C(C)(C)[NH2+]Cc1ncc[nH]1 ZINC000066593776 175319807 /nfs/dbraw/zinc/31/98/07/175319807.db2.gz YPIPESOXPOLSEU-UHFFFAOYSA-N 1 2 245.326 2.443 20 0 BEADLO COc1ccccc1NCc1c[nH+]c[nH]1 ZINC000054762940 175338092 /nfs/dbraw/zinc/33/80/92/175338092.db2.gz XEMBCBVZZZWDTQ-UHFFFAOYSA-N 1 2 203.245 2.030 20 0 BEADLO COc1ccccc1NCc1c[nH]c[nH+]1 ZINC000054762940 175338094 /nfs/dbraw/zinc/33/80/94/175338094.db2.gz XEMBCBVZZZWDTQ-UHFFFAOYSA-N 1 2 203.245 2.030 20 0 BEADLO COc1ccnc(C[N@H+](C)Cc2ccccn2)c1 ZINC000295255815 175358903 /nfs/dbraw/zinc/35/89/03/175358903.db2.gz ZQHVQIURDHCULN-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1ccnc(C[N@@H+](C)Cc2ccccn2)c1 ZINC000295255815 175358906 /nfs/dbraw/zinc/35/89/06/175358906.db2.gz ZQHVQIURDHCULN-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1cc[nH+]c(CN(C)Cc2ccccn2)c1 ZINC000295255815 175358908 /nfs/dbraw/zinc/35/89/08/175358908.db2.gz ZQHVQIURDHCULN-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)[C@H]1CC=CCC1 ZINC000293278944 175372482 /nfs/dbraw/zinc/37/24/82/175372482.db2.gz GYGBTYOQYQXERI-NSHDSACASA-N 1 2 246.310 2.063 20 0 BEADLO COc1cc[nH+]cc1COC(=O)C1CC=CC1 ZINC000286957763 175373249 /nfs/dbraw/zinc/37/32/49/175373249.db2.gz KYMXWPNVIOIHRK-UHFFFAOYSA-N 1 2 233.267 2.100 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@H](C)C(C)C ZINC000171934215 175374659 /nfs/dbraw/zinc/37/46/59/175374659.db2.gz CUUVMGVRNWLMCH-SECBINFHSA-N 1 2 222.288 2.321 20 0 BEADLO COc1cc[nH+]cc1NC(=O)CC(C)(F)F ZINC000277130626 175374666 /nfs/dbraw/zinc/37/46/66/175374666.db2.gz BDLSBALLUXCIJC-UHFFFAOYSA-N 1 2 230.214 2.074 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C=C1CCC1 ZINC000087218276 175375603 /nfs/dbraw/zinc/37/56/03/175375603.db2.gz AKTDKAVMYAOHAU-UHFFFAOYSA-N 1 2 218.256 2.139 20 0 BEADLO COc1nc(C)cc(C)c1C[N@@H+]1CC[C@H](F)C1 ZINC000336263134 175390376 /nfs/dbraw/zinc/39/03/76/175390376.db2.gz SYVLOGQUEASURB-NSHDSACASA-N 1 2 238.306 2.251 20 0 BEADLO COc1nc(C)cc(C)c1C[N@H+]1CC[C@H](F)C1 ZINC000336263134 175390377 /nfs/dbraw/zinc/39/03/77/175390377.db2.gz SYVLOGQUEASURB-NSHDSACASA-N 1 2 238.306 2.251 20 0 BEADLO C[C@@H](CC1CCCC1)C(=O)NCCn1cc[nH+]c1 ZINC000074400120 175657084 /nfs/dbraw/zinc/65/70/84/175657084.db2.gz YDVHVMVBJSAMMO-LBPRGKRZSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ccncc1F)c1cnccn1 ZINC000338006944 175921567 /nfs/dbraw/zinc/92/15/67/175921567.db2.gz DSGJMVVHSVJPNA-NXEZZACHSA-N 1 2 246.289 2.423 20 0 BEADLO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1cnnn1C ZINC000271028110 176016194 /nfs/dbraw/zinc/01/61/94/176016194.db2.gz FJQMMMUHDZLFFL-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1cnnn1C ZINC000271028110 176016197 /nfs/dbraw/zinc/01/61/97/176016197.db2.gz FJQMMMUHDZLFFL-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO C[C@@H](c1ccccc1)[N@H+](C)Cc1ncnn1C ZINC000157422266 176020111 /nfs/dbraw/zinc/02/01/11/176020111.db2.gz UZEDDWRAFNEVJJ-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1ccccc1)[N@@H+](C)Cc1ncnn1C ZINC000157422266 176020113 /nfs/dbraw/zinc/02/01/13/176020113.db2.gz UZEDDWRAFNEVJJ-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1ccnn1C ZINC000091079572 176026196 /nfs/dbraw/zinc/02/61/96/176026196.db2.gz IQXJERWLMPAZEZ-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1ccnn1C ZINC000091079572 176026198 /nfs/dbraw/zinc/02/61/98/176026198.db2.gz IQXJERWLMPAZEZ-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1ccco1)N(C)C(=O)CCn1cc[nH+]c1 ZINC000299595716 176030518 /nfs/dbraw/zinc/03/05/18/176030518.db2.gz LWXJQQFVNFEZGR-NSHDSACASA-N 1 2 247.298 2.086 20 0 BEADLO C[C@@H](c1ccco1)[N@H+](C)Cc1ccon1 ZINC000077272430 176031282 /nfs/dbraw/zinc/03/12/82/176031282.db2.gz FQNCDWGLIWHHJC-VIFPVBQESA-N 1 2 206.245 2.461 20 0 BEADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1ccon1 ZINC000077272430 176031284 /nfs/dbraw/zinc/03/12/84/176031284.db2.gz FQNCDWGLIWHHJC-VIFPVBQESA-N 1 2 206.245 2.461 20 0 BEADLO C[C@@H](c1cnccn1)[N@@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000279821156 176036658 /nfs/dbraw/zinc/03/66/58/176036658.db2.gz QMXBZTDYRPMWNJ-WCQYABFASA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H](c1cnccn1)[N@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000279821156 176036660 /nfs/dbraw/zinc/03/66/60/176036660.db2.gz QMXBZTDYRPMWNJ-WCQYABFASA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H](c1cnn(C)c1)N(C)c1cccc[nH+]1 ZINC000302698404 176037268 /nfs/dbraw/zinc/03/72/68/176037268.db2.gz WWKPEYXEORGIBR-JTQLQIEISA-N 1 2 216.288 2.013 20 0 BEADLO C[C@@H](c1nc(C2CC2)no1)[N@@H+]1C[C@@H](C)[C@H]1C ZINC000339573298 176038171 /nfs/dbraw/zinc/03/81/71/176038171.db2.gz AWQBQYAJEAXREU-HLTSFMKQSA-N 1 2 221.304 2.348 20 0 BEADLO C[C@@H](c1nc(C2CC2)no1)[N@H+]1C[C@@H](C)[C@H]1C ZINC000339573298 176038172 /nfs/dbraw/zinc/03/81/72/176038172.db2.gz AWQBQYAJEAXREU-HLTSFMKQSA-N 1 2 221.304 2.348 20 0 BEADLO C[C@@H](c1nncn1C)[N@H+](C)Cc1ccccc1 ZINC000287333001 176039248 /nfs/dbraw/zinc/03/92/48/176039248.db2.gz OEXQDGFCJWBANK-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1nncn1C)[N@@H+](C)Cc1ccccc1 ZINC000287333001 176039249 /nfs/dbraw/zinc/03/92/49/176039249.db2.gz OEXQDGFCJWBANK-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H]1CC(NC(=O)C=Cc2c[nH]c[nH+]2)C[C@@H](C)C1 ZINC000284172183 176053224 /nfs/dbraw/zinc/05/32/24/176053224.db2.gz XVKDBZJRDJEBBY-SEUFLZDSSA-N 1 2 247.342 2.364 20 0 BEADLO C[C@@H]1CC2(CCC2)CN1C(=O)CCn1cc[nH+]c1 ZINC000336574079 176057476 /nfs/dbraw/zinc/05/74/76/176057476.db2.gz PBAYABARZAIFGV-GFCCVEGCSA-N 1 2 247.342 2.064 20 0 BEADLO C[C@@H]1CCCC[C@H]1CNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000283532776 176084903 /nfs/dbraw/zinc/08/49/03/176084903.db2.gz RMQXKEVXHSDSPR-JIVBQCDMSA-N 1 2 247.342 2.365 20 0 BEADLO C[C@@H]1CCCN1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000290807921 176106476 /nfs/dbraw/zinc/10/64/76/176106476.db2.gz VYRQXCMYNMXWJL-SNVBAGLBSA-N 1 2 244.298 2.351 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N1C(=O)CCc1c[nH+]cn1C ZINC000280467361 176114612 /nfs/dbraw/zinc/11/46/12/176114612.db2.gz HWFDOFUZKJUYRA-VXGBXAGGSA-N 1 2 249.358 2.142 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N1C(=O)CCn1cc[nH+]c1 ZINC000264654617 176114734 /nfs/dbraw/zinc/11/47/34/176114734.db2.gz QCSXSYQLNXUFTK-VXGBXAGGSA-N 1 2 235.331 2.063 20 0 BEADLO C[C@@H]1CCC[C@@H](CC(=O)NCCc2[nH]cc[nH+]2)C1 ZINC000330895167 176116722 /nfs/dbraw/zinc/11/67/22/176116722.db2.gz KMHADLKHOOYDLM-VXGBXAGGSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1CCC[C@H](CNC(=O)Cn2cc[nH+]c2)[C@@H]1C ZINC000360470329 176138700 /nfs/dbraw/zinc/13/87/00/176138700.db2.gz SQEZKVKLWDUHED-JHJVBQTASA-N 1 2 249.358 2.072 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)CCc2[nH]cc[nH+]2)[C@@H]1C ZINC000279213486 176141410 /nfs/dbraw/zinc/14/14/10/176141410.db2.gz MSOATDINGRWLDZ-UTUOFQBUSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2ccsc2)CC[S@]1=O ZINC000277384321 176177031 /nfs/dbraw/zinc/17/70/31/176177031.db2.gz GAVUSARKWJKKTC-MEBBXXQBSA-N 1 2 243.397 2.091 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2ccsc2)CC[S@]1=O ZINC000277384321 176177032 /nfs/dbraw/zinc/17/70/32/176177032.db2.gz GAVUSARKWJKKTC-MEBBXXQBSA-N 1 2 243.397 2.091 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2ccsc2)CC[S@@]1=O ZINC000277384327 176178034 /nfs/dbraw/zinc/17/80/34/176178034.db2.gz GAVUSARKWJKKTC-BMIGLBTASA-N 1 2 243.397 2.091 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2ccsc2)CC[S@@]1=O ZINC000277384327 176178035 /nfs/dbraw/zinc/17/80/35/176178035.db2.gz GAVUSARKWJKKTC-BMIGLBTASA-N 1 2 243.397 2.091 20 0 BEADLO C[C@@H]1CC[C@@H](Nc2nc[nH+]c(N)c2Cl)C1 ZINC000235331605 176215432 /nfs/dbraw/zinc/21/54/32/176215432.db2.gz JFPPLNDDPYQPQG-RNFRBKRXSA-N 1 2 226.711 2.313 20 0 BEADLO C[C@@H]1CC[C@@H](Nc2[nH+]cnc(N)c2Cl)C1 ZINC000235331605 176215433 /nfs/dbraw/zinc/21/54/33/176215433.db2.gz JFPPLNDDPYQPQG-RNFRBKRXSA-N 1 2 226.711 2.313 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)NCc2[nH]cc[nH+]2)C[C@H]1C ZINC000294717215 176221434 /nfs/dbraw/zinc/22/14/34/176221434.db2.gz UWINCQCSUYMSLZ-MXWKQRLJSA-N 1 2 235.331 2.098 20 0 BEADLO C[C@@H]1CC[C@H](CC(=O)N2CCn3c[nH+]cc3C2)C1 ZINC000290950687 176222229 /nfs/dbraw/zinc/22/22/29/176222229.db2.gz PXAHUJAPSVGQHS-NEPJUHHUSA-N 1 2 247.342 2.052 20 0 BEADLO C[C@@H]1CC[C@H](CC(=O)Nc2ccc(N)[nH+]c2)C1 ZINC000151668117 176222794 /nfs/dbraw/zinc/22/27/94/176222794.db2.gz PHSWGSGRLYPDBR-ZJUUUORDSA-N 1 2 233.315 2.429 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc(O)cc(F)c2)[C@H](C)CO1 ZINC000184148051 176300937 /nfs/dbraw/zinc/30/09/37/176300937.db2.gz NHJXGDTVTDTMBL-NXEZZACHSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc(O)cc(F)c2)[C@H](C)CO1 ZINC000184148051 176300939 /nfs/dbraw/zinc/30/09/39/176300939.db2.gz NHJXGDTVTDTMBL-NXEZZACHSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cccc(F)c2)CCC1=O ZINC000049693670 176306075 /nfs/dbraw/zinc/30/60/75/176306075.db2.gz KWKRGQDDBCQASF-SNVBAGLBSA-N 1 2 221.275 2.237 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cccc(F)c2)CCC1=O ZINC000049693670 176306078 /nfs/dbraw/zinc/30/60/78/176306078.db2.gz KWKRGQDDBCQASF-SNVBAGLBSA-N 1 2 221.275 2.237 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nc(-c3ccco3)no2)[C@@H]1C ZINC000292926738 176310229 /nfs/dbraw/zinc/31/02/29/176310229.db2.gz GRABDIMWKJIZPN-RKDXNWHRSA-N 1 2 233.271 2.170 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nc(-c3ccco3)no2)[C@@H]1C ZINC000292926738 176310231 /nfs/dbraw/zinc/31/02/31/176310231.db2.gz GRABDIMWKJIZPN-RKDXNWHRSA-N 1 2 233.271 2.170 20 0 BEADLO C[C@@H]1CSCCN(c2cccc[nH+]2)C1 ZINC000276759341 176350045 /nfs/dbraw/zinc/35/00/45/176350045.db2.gz AAAPSLCDLZDQAC-JTQLQIEISA-N 1 2 208.330 2.271 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1nncn1-c1ccccc1 ZINC000336460986 176363995 /nfs/dbraw/zinc/36/39/95/176363995.db2.gz VEGNHOUQGHDZIN-VXGBXAGGSA-N 1 2 242.326 2.250 20 0 BEADLO C[C@@H]1C[C@@H]([NH2+]Cc2cncs2)c2nccn21 ZINC000345365603 176377652 /nfs/dbraw/zinc/37/76/52/176377652.db2.gz YRVAAGPDAUSEAJ-PSASIEDQSA-N 1 2 234.328 2.135 20 0 BEADLO C[C@@H]1C[C@@H](Nc2cc[nH+]c(C3CC3)n2)CCO1 ZINC000271377050 176380460 /nfs/dbraw/zinc/38/04/60/176380460.db2.gz JMJAXEQXMYQLRF-KOLCDFICSA-N 1 2 233.315 2.333 20 0 BEADLO C[C@@H]1C[C@@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000029951527 176387195 /nfs/dbraw/zinc/38/71/95/176387195.db2.gz JWPQYGYGFMLHLX-MFKMUULPSA-N 1 2 241.294 2.467 20 0 BEADLO C[C@@H]1C[C@@H]1CC(=O)Nc1ccc[nH+]c1N(C)C ZINC000361551854 176390811 /nfs/dbraw/zinc/39/08/11/176390811.db2.gz QVKCFADRUUFQDW-NXEZZACHSA-N 1 2 233.315 2.132 20 0 BEADLO C[C@@H]1C[C@@H]1CC(=O)Nc1c[nH+]c2n1CCCC2 ZINC000336304860 176391689 /nfs/dbraw/zinc/39/16/89/176391689.db2.gz MKMXVWSRTXLZGO-NXEZZACHSA-N 1 2 233.315 2.204 20 0 BEADLO C[C@@H]1C[C@@H]1CNc1cc(NC[C@H]2C[C@H]2C)[nH+]cn1 ZINC000357314259 176392396 /nfs/dbraw/zinc/39/23/96/176392396.db2.gz LLNWTMGKRLUQJI-DDHJBXDOSA-N 1 2 246.358 2.034 20 0 BEADLO C[C@H]([NH2+][C@@H](C)C(F)(F)F)C1CCOCC1 ZINC000309022742 176886434 /nfs/dbraw/zinc/88/64/34/176886434.db2.gz YFOUXBAYOMWWOL-YUMQZZPRSA-N 1 2 225.254 2.342 20 0 BEADLO C[C@H](Nc1cccc[nH+]1)[C@@H]1CCCCO1 ZINC000272014593 176936474 /nfs/dbraw/zinc/93/64/74/176936474.db2.gz NXDPNXUKRBNCGQ-QWRGUYRKSA-N 1 2 206.289 2.451 20 0 BEADLO C[C@H](O)[C@@H]1CCCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000301882495 177008044 /nfs/dbraw/zinc/00/80/44/177008044.db2.gz MXWDVJXPQPHCRR-WDEREUQCSA-N 1 2 245.326 2.160 20 0 BEADLO C[C@H](O)c1cc(NCc2[nH+]ccn2C)ccc1F ZINC000285445972 177016538 /nfs/dbraw/zinc/01/65/38/177016538.db2.gz INHBRVGGLCJHMA-VIFPVBQESA-N 1 2 249.289 2.225 20 0 BEADLO C[C@H](c1cccs1)[N@H+](C)Cc1cnn(C)n1 ZINC000290060481 177048525 /nfs/dbraw/zinc/04/85/25/177048525.db2.gz SMSZCJCFOFVSBZ-SECBINFHSA-N 1 2 236.344 2.070 20 0 BEADLO C[C@H](c1cccs1)[N@@H+](C)Cc1cnn(C)n1 ZINC000290060481 177048527 /nfs/dbraw/zinc/04/85/27/177048527.db2.gz SMSZCJCFOFVSBZ-SECBINFHSA-N 1 2 236.344 2.070 20 0 BEADLO C[C@H](c1ccncc1)[N@H+](C)Cc1ccnn1C ZINC000091079570 177049865 /nfs/dbraw/zinc/04/98/65/177049865.db2.gz DUAMTIGWRCOUQP-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1ccnn1C ZINC000091079570 177049866 /nfs/dbraw/zinc/04/98/66/177049866.db2.gz DUAMTIGWRCOUQP-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H]1CC(C(=O)Nc2cc[nH+]cc2O)C[C@H](C)C1 ZINC000356556749 177063403 /nfs/dbraw/zinc/06/34/03/177063403.db2.gz YNJGKMKBLKQWOK-NXEZZACHSA-N 1 2 248.326 2.220 20 0 BEADLO C[C@H]1CCCC[C@H]1N(C)C(=O)CCn1cc[nH+]c1 ZINC000299619729 177087130 /nfs/dbraw/zinc/08/71/30/177087130.db2.gz QAXFRJWKCXQMFG-QWHCGFSZSA-N 1 2 249.358 2.310 20 0 BEADLO C[C@H]1CCCN1c1cc(N2CCC[C@@H]2C)[nH+]cn1 ZINC000267589043 177111637 /nfs/dbraw/zinc/11/16/37/177111637.db2.gz CPGRTHLBUAOCDY-RYUDHWBXSA-N 1 2 246.358 2.454 20 0 BEADLO C[C@@H]1CCC[C@H](C)N1C(=O)CCc1c[nH+]c[nH]1 ZINC000074726949 177115335 /nfs/dbraw/zinc/11/53/35/177115335.db2.gz NKOPRJQQPIPSGB-PHIMTYICSA-N 1 2 235.331 2.132 20 0 BEADLO C[C@@H]1CCC[C@H](C)N1C(=O)CCc1c[nH]c[nH+]1 ZINC000074726949 177115337 /nfs/dbraw/zinc/11/53/37/177115337.db2.gz NKOPRJQQPIPSGB-PHIMTYICSA-N 1 2 235.331 2.132 20 0 BEADLO C[C@@H]1CCC[C@H](C)[C@H]1NC(=O)CCn1cc[nH+]c1 ZINC000264606215 177117446 /nfs/dbraw/zinc/11/74/46/177117446.db2.gz ARAFNJUAYDNSKL-IMRBUKKESA-N 1 2 249.358 2.214 20 0 BEADLO C[C@H]1CCC[C@@]1(C)C(=O)N(C)Cc1[nH+]ccn1C ZINC000336236290 177127725 /nfs/dbraw/zinc/12/77/25/177127725.db2.gz ACCIHBZVCBHKCH-SMDDNHRTSA-N 1 2 249.358 2.205 20 0 BEADLO C[C@H]1CCC[C@@]1(O)CNc1cc[nH+]c(C2CC2)n1 ZINC000294278743 177128425 /nfs/dbraw/zinc/12/84/25/177128425.db2.gz XOOMYPRWDICUJZ-IINYFYTJSA-N 1 2 247.342 2.317 20 0 BEADLO C[C@H]1CCC[C@H](C)C1NC(=O)CCn1cc[nH+]c1 ZINC000264606216 177129141 /nfs/dbraw/zinc/12/91/41/177129141.db2.gz ARAFNJUAYDNSKL-RYUDHWBXSA-N 1 2 249.358 2.214 20 0 BEADLO C[C@H]1CCC[C@H](C)N1C(=O)CCc1c[nH+]c[nH]1 ZINC000074726951 177130598 /nfs/dbraw/zinc/13/05/98/177130598.db2.gz NKOPRJQQPIPSGB-QWRGUYRKSA-N 1 2 235.331 2.132 20 0 BEADLO C[C@H]1CCC[C@H](C)N1C(=O)CCc1c[nH]c[nH+]1 ZINC000074726951 177130599 /nfs/dbraw/zinc/13/05/99/177130599.db2.gz NKOPRJQQPIPSGB-QWRGUYRKSA-N 1 2 235.331 2.132 20 0 BEADLO C[C@H]1CCC[C@H]1CC(=O)N1CCn2c[nH+]cc2C1 ZINC000290955796 177139929 /nfs/dbraw/zinc/13/99/29/177139929.db2.gz QUUYQMXPVJMAOC-RYUDHWBXSA-N 1 2 247.342 2.052 20 0 BEADLO C[C@H]1CC[C@@H](C[N@H+](C)Cc2nccs2)O1 ZINC000188559002 177189478 /nfs/dbraw/zinc/18/94/78/177189478.db2.gz BBYASFUGOMMMME-UWVGGRQHSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@H]1CC[C@@H](C[N@@H+](C)Cc2nccs2)O1 ZINC000188559002 177189480 /nfs/dbraw/zinc/18/94/80/177189480.db2.gz BBYASFUGOMMMME-UWVGGRQHSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@H]1CC[C@@](C)(C(=O)NCc2[nH]cc[nH+]2)C1(C)C ZINC000336308623 177195931 /nfs/dbraw/zinc/19/59/31/177195931.db2.gz XWZDPXZTPDUMRU-HZMBPMFUSA-N 1 2 249.358 2.488 20 0 BEADLO C[C@H]1CC[C@H](C[N@H+](C)Cc2nccs2)O1 ZINC000188558957 177200529 /nfs/dbraw/zinc/20/05/29/177200529.db2.gz BBYASFUGOMMMME-VHSXEESVSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@H]1CC[C@H](C[N@@H+](C)Cc2nccs2)O1 ZINC000188558957 177200530 /nfs/dbraw/zinc/20/05/30/177200530.db2.gz BBYASFUGOMMMME-VHSXEESVSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1CC(=O)OCc1ccccc1 ZINC000293025235 177243474 /nfs/dbraw/zinc/24/34/74/177243474.db2.gz PHMBYMGYMMUENQ-NWDGAFQWSA-N 1 2 233.311 2.070 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1CC(=O)OCc1ccccc1 ZINC000293025235 177243475 /nfs/dbraw/zinc/24/34/75/177243475.db2.gz PHMBYMGYMMUENQ-NWDGAFQWSA-N 1 2 233.311 2.070 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc(O)cc(F)c2)C[C@H](C)O1 ZINC000157561286 177260937 /nfs/dbraw/zinc/26/09/37/177260937.db2.gz AQGHBPSSQFBACY-AOOOYVTPSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc(O)cc(F)c2)C[C@H](C)O1 ZINC000157561286 177260938 /nfs/dbraw/zinc/26/09/38/177260938.db2.gz AQGHBPSSQFBACY-AOOOYVTPSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccccc2F)CCC1=O ZINC000049693561 177266032 /nfs/dbraw/zinc/26/60/32/177266032.db2.gz ITOUFCQKTAFBNY-JTQLQIEISA-N 1 2 221.275 2.237 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccccc2F)CCC1=O ZINC000049693561 177266034 /nfs/dbraw/zinc/26/60/34/177266034.db2.gz ITOUFCQKTAFBNY-JTQLQIEISA-N 1 2 221.275 2.237 20 0 BEADLO C[C@H]1C[NH+](Cc2ccnc(Cl)c2)C[C@H](C)O1 ZINC000050165735 177268439 /nfs/dbraw/zinc/26/84/39/177268439.db2.gz VRYRBXWZQRSPNX-UWVGGRQHSA-N 1 2 240.734 2.344 20 0 BEADLO C[C@H]1C[N@H+](Cc2nc(-c3ccco3)no2)[C@H]1C ZINC000292926737 177270618 /nfs/dbraw/zinc/27/06/18/177270618.db2.gz GRABDIMWKJIZPN-IUCAKERBSA-N 1 2 233.271 2.170 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nc(-c3ccco3)no2)[C@H]1C ZINC000292926737 177270620 /nfs/dbraw/zinc/27/06/20/177270620.db2.gz GRABDIMWKJIZPN-IUCAKERBSA-N 1 2 233.271 2.170 20 0 BEADLO C[C@H]1C[N@H+](Cc2cocn2)CCC1(F)F ZINC000291574386 177271300 /nfs/dbraw/zinc/27/13/00/177271300.db2.gz OFAQBDRKCWUCED-QMMMGPOBSA-N 1 2 216.231 2.152 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cocn2)CCC1(F)F ZINC000291574386 177271302 /nfs/dbraw/zinc/27/13/02/177271302.db2.gz OFAQBDRKCWUCED-QMMMGPOBSA-N 1 2 216.231 2.152 20 0 BEADLO C[C@H]1C[N@H+](Cc2nnc(C3CC3)s2)[C@H]1C ZINC000336266938 177271488 /nfs/dbraw/zinc/27/14/88/177271488.db2.gz OAGIXCRHOHDBLS-YUMQZZPRSA-N 1 2 223.345 2.256 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nnc(C3CC3)s2)[C@H]1C ZINC000336266938 177271489 /nfs/dbraw/zinc/27/14/89/177271489.db2.gz OAGIXCRHOHDBLS-YUMQZZPRSA-N 1 2 223.345 2.256 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1nnc(-c2ccco2)o1 ZINC000293043557 177271615 /nfs/dbraw/zinc/27/16/15/177271615.db2.gz QXOBHCAZMNJYKH-DTWKUNHWSA-N 1 2 233.271 2.170 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1nnc(-c2ccco2)o1 ZINC000293043557 177271616 /nfs/dbraw/zinc/27/16/16/177271616.db2.gz QXOBHCAZMNJYKH-DTWKUNHWSA-N 1 2 233.271 2.170 20 0 BEADLO C[C@H]1C[N@H+](Cc2nccs2)C[C@@H](C2CC2)O1 ZINC000279302067 177272208 /nfs/dbraw/zinc/27/22/08/177272208.db2.gz MHOHXINFZYTRPH-ONGXEEELSA-N 1 2 238.356 2.142 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nccs2)C[C@@H](C2CC2)O1 ZINC000279302067 177272209 /nfs/dbraw/zinc/27/22/09/177272209.db2.gz MHOHXINFZYTRPH-ONGXEEELSA-N 1 2 238.356 2.142 20 0 BEADLO C[C@H]1C[N@H+](Cc2ncn(-c3ccccc3)n2)[C@H]1C ZINC000293425391 177272373 /nfs/dbraw/zinc/27/23/73/177272373.db2.gz NJJSPCNWGDAQQJ-RYUDHWBXSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ncn(-c3ccccc3)n2)[C@H]1C ZINC000293425391 177272375 /nfs/dbraw/zinc/27/23/75/177272375.db2.gz NJJSPCNWGDAQQJ-RYUDHWBXSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@H]1CN(c2cc(NCC3CC3)[nH+]cn2)C[C@@H]1C ZINC000301835872 177276360 /nfs/dbraw/zinc/27/63/60/177276360.db2.gz UTDSRJZVRUCAQS-QWRGUYRKSA-N 1 2 246.358 2.391 20 0 BEADLO C[C@H]1CN(c2cc(NCC3CC3)nc[nH+]2)C[C@@H]1C ZINC000301835872 177276362 /nfs/dbraw/zinc/27/63/62/177276362.db2.gz UTDSRJZVRUCAQS-QWRGUYRKSA-N 1 2 246.358 2.391 20 0 BEADLO C[C@H]1CN(c2nc(N)c3ccccc3[nH+]2)C[C@@H]1C ZINC000301859975 177277870 /nfs/dbraw/zinc/27/78/70/177277870.db2.gz CACWUQQSTPYNHP-UWVGGRQHSA-N 1 2 242.326 2.304 20 0 BEADLO C[C@H]1CSCC[N@@H+]1Cc1cscn1 ZINC000172435363 177304664 /nfs/dbraw/zinc/30/46/64/177304664.db2.gz WSRVUSSFLORPLT-QMMMGPOBSA-N 1 2 214.359 2.080 20 0 BEADLO C[C@H]1CSCC[N@H+]1Cc1cscn1 ZINC000172435363 177304665 /nfs/dbraw/zinc/30/46/65/177304665.db2.gz WSRVUSSFLORPLT-QMMMGPOBSA-N 1 2 214.359 2.080 20 0 BEADLO C[C@H]1C[C@@H](Nc2cc[nH+]c(C3CC3)n2)CCO1 ZINC000271377096 177334382 /nfs/dbraw/zinc/33/43/82/177334382.db2.gz JMJAXEQXMYQLRF-ONGXEEELSA-N 1 2 233.315 2.333 20 0 BEADLO C[C@H]1C[C@@H]1CNc1cc(N2CCCC2)nc[nH+]1 ZINC000277593157 177345717 /nfs/dbraw/zinc/34/57/17/177345717.db2.gz UKQAIHUNYNZLJF-WDEREUQCSA-N 1 2 232.331 2.145 20 0 BEADLO C[C@H]1C[C@@H]1CNc1cc(N2CCCC2)[nH+]cn1 ZINC000277593157 177345719 /nfs/dbraw/zinc/34/57/19/177345719.db2.gz UKQAIHUNYNZLJF-WDEREUQCSA-N 1 2 232.331 2.145 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)CCn2cc[nH+]c2)[C@@H](C)C1 ZINC000264967651 177355784 /nfs/dbraw/zinc/35/57/84/177355784.db2.gz FQBBKGYFUHTUHY-AGIUHOORSA-N 1 2 249.358 2.214 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)CCn2cc[nH+]c2)[C@H]1C ZINC000298809561 177425358 /nfs/dbraw/zinc/42/53/58/177425358.db2.gz RVTYRIBZDDXCDN-FRRDWIJNSA-N 1 2 249.358 2.214 20 0 BEADLO C[C@](O)(CNc1cccc[nH+]1)c1cccs1 ZINC000265803623 177451084 /nfs/dbraw/zinc/45/10/84/177451084.db2.gz KLFOFHUPINQHOO-LBPRGKRZSA-N 1 2 234.324 2.463 20 0 BEADLO Cc1ccc(NC(=O)CCc2[nH]cc[nH+]2)cc1 ZINC000479442408 225184773 /nfs/dbraw/zinc/18/47/73/225184773.db2.gz PTUXVJNSKFIGBM-UHFFFAOYSA-N 1 2 229.283 2.289 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccc(F)cc2)nn1C ZINC000487392773 225303924 /nfs/dbraw/zinc/30/39/24/225303924.db2.gz BGHBHRMECGFLFA-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccc(F)cc2)nn1C ZINC000487392773 225303927 /nfs/dbraw/zinc/30/39/27/225303927.db2.gz BGHBHRMECGFLFA-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1cc(NC(=O)C=CC2CC2)c(C)c[nH+]1 ZINC000492295215 225972044 /nfs/dbraw/zinc/97/20/44/225972044.db2.gz LKSFWWRERPCIDF-AATRIKPKSA-N 1 2 216.284 2.025 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)Nc1cccc(F)c1F ZINC000492766473 226049637 /nfs/dbraw/zinc/04/96/37/226049637.db2.gz MTGMWXAHXGWYCC-SNAWJCMRSA-N 1 2 249.220 2.340 20 0 BEADLO Cc1ccc(NC(=O)C=Cc2c[nH]c[nH+]2)c(O)c1 ZINC000492857290 226069340 /nfs/dbraw/zinc/06/93/40/226069340.db2.gz DEKUEQZCUDUIBP-HWKANZROSA-N 1 2 243.266 2.076 20 0 BEADLO C[C@H]1CCN(C(=O)C=Cc2c[nH]c[nH+]2)CC1(C)C ZINC000492902302 226079654 /nfs/dbraw/zinc/07/96/54/226079654.db2.gz QQYUVLZAIABURS-WYGGZMRJSA-N 1 2 247.342 2.318 20 0 BEADLO C[C@@H]1CCC[C@H](N(C)C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493085564 226121681 /nfs/dbraw/zinc/12/16/81/226121681.db2.gz MZCLPNHXWMWONE-JIVBQCDMSA-N 1 2 247.342 2.460 20 0 BEADLO CN(C(=O)/C=C/c1[nH]cc[nH+]1)C(C1CC1)C1CC1 ZINC000493164909 226142911 /nfs/dbraw/zinc/14/29/11/226142911.db2.gz XARXDXYRHWMZJA-VOTSOKGWSA-N 1 2 245.326 2.070 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CC[C@@H]2CCCC[C@@H]21 ZINC000493172813 226145823 /nfs/dbraw/zinc/14/58/23/226145823.db2.gz SHZRXLGVCASAJE-DSAOOCMMSA-N 1 2 245.326 2.214 20 0 BEADLO CN(C(=O)/C=C/c1[nH]cc[nH+]1)C1CCCCC1 ZINC000493207868 226154715 /nfs/dbraw/zinc/15/47/15/226154715.db2.gz OXWUTKAEZHLIRL-BQYQJAHWSA-N 1 2 233.315 2.214 20 0 BEADLO O=C(/C=C\c1[nH]cc[nH+]1)N1CCC[C@@H]2CCC[C@@H]21 ZINC000493273851 226173010 /nfs/dbraw/zinc/17/30/10/226173010.db2.gz ZAMDXAZERLRGFK-MVSYMCDOSA-N 1 2 245.326 2.214 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)/C=C/C1CCCCC1 ZINC000493522774 226238760 /nfs/dbraw/zinc/23/87/60/226238760.db2.gz KFZPAHRMBKEPFC-BQYQJAHWSA-N 1 2 247.342 2.173 20 0 BEADLO O=C(/C=C\c1[nH]cc[nH+]1)N1CCC[C@@H]1C1CCC1 ZINC000493588519 226244937 /nfs/dbraw/zinc/24/49/37/226244937.db2.gz MEPMBYKZEXMING-ZHRWSRJISA-N 1 2 245.326 2.214 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)N1CCC[C@@H]1C1CCC1 ZINC000493588514 226245015 /nfs/dbraw/zinc/24/50/15/226245015.db2.gz MEPMBYKZEXMING-NNNHXZLVSA-N 1 2 245.326 2.214 20 0 BEADLO C[C@H]1CCCCCN1C(=O)/C=C\c1[nH]cc[nH+]1 ZINC000493609637 226245905 /nfs/dbraw/zinc/24/59/05/226245905.db2.gz IBZBBZHQZAEQDZ-ZADCQDASSA-N 1 2 233.315 2.214 20 0 BEADLO COCCC[N@@H+]1CC[C@H](C)C(F)(F)C1 ZINC000494223086 226262386 /nfs/dbraw/zinc/26/23/86/226262386.db2.gz KGJCFNWODGTJPW-VIFPVBQESA-N 1 2 207.264 2.000 20 0 BEADLO COCCC[N@H+]1CC[C@H](C)C(F)(F)C1 ZINC000494223086 226262387 /nfs/dbraw/zinc/26/23/87/226262387.db2.gz KGJCFNWODGTJPW-VIFPVBQESA-N 1 2 207.264 2.000 20 0 BEADLO O=C(OC1CCC1)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000496363392 226303182 /nfs/dbraw/zinc/30/31/82/226303182.db2.gz OJWIUFJAZRDWMV-SNVBAGLBSA-N 1 2 249.314 2.278 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)c2[nH+]ccn21 ZINC000496625131 226309856 /nfs/dbraw/zinc/30/98/56/226309856.db2.gz NFFPXHZDZAJOTK-BDAKNGLRSA-N 1 2 237.303 2.414 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)c2[nH+]ccn21 ZINC000496625132 226309981 /nfs/dbraw/zinc/30/99/81/226309981.db2.gz NFFPXHZDZAJOTK-DTWKUNHWSA-N 1 2 237.303 2.414 20 0 BEADLO Cn1cc[nH+]c1[C@@H](NC(=O)OC1CCC1)C1CC1 ZINC000496643452 226310380 /nfs/dbraw/zinc/31/03/80/226310380.db2.gz NFDIAMOYQDCXHV-NSHDSACASA-N 1 2 249.314 2.150 20 0 BEADLO C[C@H]1C[C@H](NC(=O)OC2CCC2)c2[nH+]ccn21 ZINC000496828904 226315197 /nfs/dbraw/zinc/31/51/97/226315197.db2.gz PVYHDOOANXHNLV-WPRPVWTQSA-N 1 2 235.287 2.168 20 0 BEADLO C[C@@H]([NH2+][C@H](C)C(F)F)c1cccnc1 ZINC000228483498 487656768 /nfs/dbraw/zinc/65/67/68/487656768.db2.gz YGNASSQUHAMFFZ-HTQZYQBOSA-N 1 2 200.232 2.386 20 0 BEADLO COc1ccc(C[NH2+][C@H](C)C(F)F)cc1 ZINC000228479247 487656869 /nfs/dbraw/zinc/65/68/69/487656869.db2.gz MSEZVOVKAGNSFB-MRVPVSSYSA-N 1 2 215.243 2.438 20 0 BEADLO C[C@@H]([NH2+][C@H](C)C(F)F)c1ccncc1 ZINC000228482562 487656883 /nfs/dbraw/zinc/65/68/83/487656883.db2.gz NJIUIJWKHHNXAZ-HTQZYQBOSA-N 1 2 200.232 2.386 20 0 BEADLO COc1cc(C)ccc1[NH2+]CC[C@H](C)O ZINC000383686114 487661254 /nfs/dbraw/zinc/66/12/54/487661254.db2.gz DFJIDKJTQWEQFI-JTQLQIEISA-N 1 2 209.289 2.186 20 0 BEADLO COc1cc(C)ccc1[NH2+]CC[C@@H](C)O ZINC000383686115 487661285 /nfs/dbraw/zinc/66/12/85/487661285.db2.gz DFJIDKJTQWEQFI-SNVBAGLBSA-N 1 2 209.289 2.186 20 0 BEADLO CN(Cc1[nH+]ccn1C)c1ncc(Cl)s1 ZINC000680889271 487665687 /nfs/dbraw/zinc/66/56/87/487665687.db2.gz QDEORBYHQXYHPD-UHFFFAOYSA-N 1 2 242.735 2.166 20 0 BEADLO CCc1nn(C)cc1C[N@@H+]1CCC=C(F)C1 ZINC000679630579 487666416 /nfs/dbraw/zinc/66/64/16/487666416.db2.gz TZWFZMIZLQHEDX-UHFFFAOYSA-N 1 2 223.295 2.042 20 0 BEADLO CCc1nn(C)cc1C[N@H+]1CCC=C(F)C1 ZINC000679630579 487666421 /nfs/dbraw/zinc/66/64/21/487666421.db2.gz TZWFZMIZLQHEDX-UHFFFAOYSA-N 1 2 223.295 2.042 20 0 BEADLO FC(F)C[N@@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000680891197 487666877 /nfs/dbraw/zinc/66/68/77/487666877.db2.gz VXKOJLZUXDMQQS-NSHDSACASA-N 1 2 226.270 2.211 20 0 BEADLO FC(F)C[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000680891197 487666881 /nfs/dbraw/zinc/66/68/81/487666881.db2.gz VXKOJLZUXDMQQS-NSHDSACASA-N 1 2 226.270 2.211 20 0 BEADLO FC(F)C[N@@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000680891193 487667088 /nfs/dbraw/zinc/66/70/88/487667088.db2.gz VXKOJLZUXDMQQS-LLVKDONJSA-N 1 2 226.270 2.211 20 0 BEADLO FC(F)C[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000680891193 487667093 /nfs/dbraw/zinc/66/70/93/487667093.db2.gz VXKOJLZUXDMQQS-LLVKDONJSA-N 1 2 226.270 2.211 20 0 BEADLO Cc1cnccc1C[NH2+][C@H](C)C(F)F ZINC000228522642 487671300 /nfs/dbraw/zinc/67/13/00/487671300.db2.gz PDBFZHGFJFCIDJ-MRVPVSSYSA-N 1 2 200.232 2.133 20 0 BEADLO CCNc1nc(NCC)c(Br)c[nH+]1 ZINC000087807447 487688648 /nfs/dbraw/zinc/68/86/48/487688648.db2.gz FWSODUYSQFOVMX-UHFFFAOYSA-N 1 2 245.124 2.103 20 0 BEADLO Cc1cc(N2CC(CC(F)(F)F)C2)nc[nH+]1 ZINC000675295714 487694945 /nfs/dbraw/zinc/69/49/45/487694945.db2.gz ZJEPEXVNHBRNKG-UHFFFAOYSA-N 1 2 231.221 2.174 20 0 BEADLO Cc1c(C[NH2+][C@@H](C)c2ncccc2F)cnn1C ZINC000527826459 262887565 /nfs/dbraw/zinc/88/75/65/262887565.db2.gz MMQWAZWYZZJZKL-VIFPVBQESA-N 1 2 248.305 2.113 20 0 BEADLO CCC(O)(CC)CCNc1[nH+]cccc1OC ZINC000527981867 262897869 /nfs/dbraw/zinc/89/78/69/262897869.db2.gz HOBCCLXPQBKRDC-UHFFFAOYSA-N 1 2 238.331 2.443 20 0 BEADLO COc1ccc[nH+]c1N1CCC[C@@](C)(OC)C1 ZINC000527991227 262899260 /nfs/dbraw/zinc/89/92/60/262899260.db2.gz AHEICDXOWPUTAP-CYBMUJFWSA-N 1 2 236.315 2.096 20 0 BEADLO Cc1cc(NC(=O)c2occ3c2CCC3)cc[nH+]1 ZINC000671720853 487707145 /nfs/dbraw/zinc/70/71/45/487707145.db2.gz KTUVHYUMIDTLCZ-UHFFFAOYSA-N 1 2 242.278 2.146 20 0 BEADLO CCC(CC)(CC)C(=O)NCc1[nH]cc[nH+]1 ZINC000675460608 487735947 /nfs/dbraw/zinc/73/59/47/487735947.db2.gz SIPIPELQMNRSTK-UHFFFAOYSA-N 1 2 223.320 2.242 20 0 BEADLO CCC(CC)(CC)C(=O)NCc1c[nH+]c[nH]1 ZINC000675472241 487737843 /nfs/dbraw/zinc/73/78/43/487737843.db2.gz NCHOKWLULZWAJW-UHFFFAOYSA-N 1 2 223.320 2.242 20 0 BEADLO CCC(CC)(CC)C(=O)NCc1c[nH]c[nH+]1 ZINC000675472241 487737848 /nfs/dbraw/zinc/73/78/48/487737848.db2.gz NCHOKWLULZWAJW-UHFFFAOYSA-N 1 2 223.320 2.242 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1c1nc[nH+]c2c1OCCN2 ZINC000665710096 487737585 /nfs/dbraw/zinc/73/75/85/487737585.db2.gz WATKEEKLNRRMGP-VHSXEESVSA-N 1 2 248.330 2.048 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1c1[nH+]cnc2c1OCCN2 ZINC000665710096 487737589 /nfs/dbraw/zinc/73/75/89/487737589.db2.gz WATKEEKLNRRMGP-VHSXEESVSA-N 1 2 248.330 2.048 20 0 BEADLO CC1(C)OCC[C@H]1Nc1cc(NC2CC2)[nH+]cn1 ZINC000665721369 487740259 /nfs/dbraw/zinc/74/02/59/487740259.db2.gz IJXIDMGGBYEXKO-SNVBAGLBSA-N 1 2 248.330 2.030 20 0 BEADLO CC1(C)OCC[C@H]1Nc1cc(NC2CC2)nc[nH+]1 ZINC000665721369 487740266 /nfs/dbraw/zinc/74/02/66/487740266.db2.gz IJXIDMGGBYEXKO-SNVBAGLBSA-N 1 2 248.330 2.030 20 0 BEADLO CCN(CC(C)C)C(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000666182952 487749036 /nfs/dbraw/zinc/74/90/36/487749036.db2.gz LHRJPDKOPGLANB-VXGBXAGGSA-N 1 2 249.358 2.028 20 0 BEADLO COc1ccc(N[C@H]2CO[C@@H](C3CC3)C2)[nH+]c1 ZINC000667907507 487759992 /nfs/dbraw/zinc/75/99/92/487759992.db2.gz RTTQGUWMSZNWCO-ZYHUDNBSSA-N 1 2 234.299 2.070 20 0 BEADLO C[C@@H]1[C@H](C)CN(C(=O)CCCn2cc[nH+]c2)[C@H]1C ZINC000667912484 487760478 /nfs/dbraw/zinc/76/04/78/487760478.db2.gz BZMKLMDKAUKGOH-UPJWGTAASA-N 1 2 249.358 2.166 20 0 BEADLO CC[C@@H]1[C@H](C)CCN1C(=O)CCCn1cc[nH+]c1 ZINC000681264601 487764001 /nfs/dbraw/zinc/76/40/01/487764001.db2.gz ZFRZRFPFEKDJCE-CHWSQXEVSA-N 1 2 249.358 2.310 20 0 BEADLO CCCN(CCC)C(=O)CCCn1cc[nH+]c1 ZINC000197446856 487769306 /nfs/dbraw/zinc/76/93/06/487769306.db2.gz VLTLBWAKFUGETL-UHFFFAOYSA-N 1 2 237.347 2.312 20 0 BEADLO CCc1cc(N[C@H]2CCCc3c[nH]nc32)nc[nH+]1 ZINC000675801333 487780412 /nfs/dbraw/zinc/78/04/12/487780412.db2.gz FOWRFQPDVBAUPZ-NSHDSACASA-N 1 2 243.314 2.252 20 0 BEADLO CCc1ncc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)cn1 ZINC000666353543 487793185 /nfs/dbraw/zinc/79/31/85/487793185.db2.gz BAADCMFQOIQWLO-PWSUYJOCSA-N 1 2 237.322 2.219 20 0 BEADLO CCc1ncc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)cn1 ZINC000666353543 487793192 /nfs/dbraw/zinc/79/31/92/487793192.db2.gz BAADCMFQOIQWLO-PWSUYJOCSA-N 1 2 237.322 2.219 20 0 BEADLO CC(C)n1ccc(C[N@H+](C)CC2=CCCOC2)n1 ZINC000661655709 487809505 /nfs/dbraw/zinc/80/95/05/487809505.db2.gz SKYMCEOPDQMUTG-UHFFFAOYSA-N 1 2 249.358 2.243 20 0 BEADLO CC(C)n1ccc(C[N@@H+](C)CC2=CCCOC2)n1 ZINC000661655709 487809511 /nfs/dbraw/zinc/80/95/11/487809511.db2.gz SKYMCEOPDQMUTG-UHFFFAOYSA-N 1 2 249.358 2.243 20 0 BEADLO Cc1cc(NC(=O)NC2CC(C)(C)C2)c(C)c[nH+]1 ZINC000666496539 487815898 /nfs/dbraw/zinc/81/58/98/487815898.db2.gz ZIIIJHUAUATPBX-UHFFFAOYSA-N 1 2 247.342 2.430 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OCCSC(C)(C)C ZINC000802731456 586311238 /nfs/dbraw/zinc/31/12/38/586311238.db2.gz PURCGLHGSNLTJP-MRVPVSSYSA-N 1 2 234.365 2.051 20 0 BEADLO CC[C@H]1C[N@@H+]([C@@H](C)c2cnc(C)nc2C)CCO1 ZINC000681658038 487832696 /nfs/dbraw/zinc/83/26/96/487832696.db2.gz VNPOBPCIDDUPHP-AAEUAGOBSA-N 1 2 249.358 2.265 20 0 BEADLO CC[C@H]1C[N@H+]([C@@H](C)c2cnc(C)nc2C)CCO1 ZINC000681658038 487832702 /nfs/dbraw/zinc/83/27/02/487832702.db2.gz VNPOBPCIDDUPHP-AAEUAGOBSA-N 1 2 249.358 2.265 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2[C@@H](C=C(C)C)C2(C)C)n1 ZINC000666572906 487833818 /nfs/dbraw/zinc/83/38/18/487833818.db2.gz VCECYPSHNFZPHI-KOLCDFICSA-N 1 2 235.331 2.495 20 0 BEADLO C[C@H]1CC[N@H+](Cc2cncc(F)c2)C[C@H]1F ZINC000681751021 487844076 /nfs/dbraw/zinc/84/40/76/487844076.db2.gz PVTLUAZDJIWGCI-JOYOIKCWSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2cncc(F)c2)C[C@H]1F ZINC000681751021 487844079 /nfs/dbraw/zinc/84/40/79/487844079.db2.gz PVTLUAZDJIWGCI-JOYOIKCWSA-N 1 2 226.270 2.401 20 0 BEADLO Cc1ccoc1C[NH2+][C@@H](C)c1ncc[nH]1 ZINC000124702103 487847889 /nfs/dbraw/zinc/84/78/89/487847889.db2.gz YKWKLVHMZGFCOB-VIFPVBQESA-N 1 2 205.261 2.162 20 0 BEADLO O[C@@H]1CC[N@H+](C[C@@H]2CC=CCC2)CC1(F)F ZINC000668500482 487857544 /nfs/dbraw/zinc/85/75/44/487857544.db2.gz ZTBWGUTVCMEJOE-GHMZBOCLSA-N 1 2 231.286 2.045 20 0 BEADLO O[C@@H]1CC[N@@H+](C[C@@H]2CC=CCC2)CC1(F)F ZINC000668500482 487857545 /nfs/dbraw/zinc/85/75/45/487857545.db2.gz ZTBWGUTVCMEJOE-GHMZBOCLSA-N 1 2 231.286 2.045 20 0 BEADLO C[C@@H]1CN(c2cc[nH+]c(C(C)(C)C)n2)CCC1=O ZINC000681803271 487864433 /nfs/dbraw/zinc/86/44/33/487864433.db2.gz KPBMXLMEYPPDDP-SNVBAGLBSA-N 1 2 247.342 2.189 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cncs2)[C@H](C)CO1 ZINC000651930991 487869453 /nfs/dbraw/zinc/86/94/53/487869453.db2.gz IRMCUMMVBZWEFG-ZJUUUORDSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cncs2)[C@H](C)CO1 ZINC000651930991 487869458 /nfs/dbraw/zinc/86/94/58/487869458.db2.gz IRMCUMMVBZWEFG-ZJUUUORDSA-N 1 2 226.345 2.142 20 0 BEADLO CCc1cc(N[C@@H]2CSC2(C)C)nc[nH+]1 ZINC000379972006 487875949 /nfs/dbraw/zinc/87/59/49/487875949.db2.gz BRDMPWIRMKKSDF-SECBINFHSA-N 1 2 223.345 2.345 20 0 BEADLO CC[C@H](NC(=O)[C@H]1CC12CCC2)c1[nH]cc[nH+]1 ZINC000682041455 487888473 /nfs/dbraw/zinc/88/84/73/487888473.db2.gz QVOIFWDDZQNQSC-ZJUUUORDSA-N 1 2 233.315 2.167 20 0 BEADLO CCCC(C)(C)C(=O)N1CCn2c[nH+]cc2C1 ZINC000652243716 487890131 /nfs/dbraw/zinc/89/01/31/487890131.db2.gz FSICXPJLMOCQCT-UHFFFAOYSA-N 1 2 235.331 2.052 20 0 BEADLO CC[C@@H](C)[N@@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000682074498 487895050 /nfs/dbraw/zinc/89/50/50/487895050.db2.gz UVKBFJIDFLHOBS-SFYZADRCSA-N 1 2 211.227 2.048 20 0 BEADLO CC[C@@H](C)[N@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000682074498 487895052 /nfs/dbraw/zinc/89/50/52/487895052.db2.gz UVKBFJIDFLHOBS-SFYZADRCSA-N 1 2 211.227 2.048 20 0 BEADLO OC[C@]1(F)CC[N@H+](Cc2cscc2Cl)C1 ZINC000670273440 487896767 /nfs/dbraw/zinc/89/67/67/487896767.db2.gz VYKMEYNAMZNASX-JTQLQIEISA-N 1 2 249.738 2.308 20 0 BEADLO OC[C@]1(F)CC[N@@H+](Cc2cscc2Cl)C1 ZINC000670273440 487896770 /nfs/dbraw/zinc/89/67/70/487896770.db2.gz VYKMEYNAMZNASX-JTQLQIEISA-N 1 2 249.738 2.308 20 0 BEADLO C[C@H](NC(=O)CCc1c[nH+]c[nH]1)c1ccsc1 ZINC000669919323 487924028 /nfs/dbraw/zinc/92/40/28/487924028.db2.gz UBBGIAXNNFKEHT-VIFPVBQESA-N 1 2 249.339 2.281 20 0 BEADLO C[C@H](NC(=O)CCc1c[nH]c[nH+]1)c1ccsc1 ZINC000669919323 487924032 /nfs/dbraw/zinc/92/40/32/487924032.db2.gz UBBGIAXNNFKEHT-VIFPVBQESA-N 1 2 249.339 2.281 20 0 BEADLO COc1ccc(N[C@@H]2COC(C)(C)C2)[nH+]c1 ZINC000396531057 487940194 /nfs/dbraw/zinc/94/01/94/487940194.db2.gz HBCNZYGXZDYROH-VIFPVBQESA-N 1 2 222.288 2.070 20 0 BEADLO Oc1ccc(C[N@@H+]2CCC[C@H]2c2ncon2)cc1 ZINC000682405824 487949698 /nfs/dbraw/zinc/94/96/98/487949698.db2.gz XCNUPQCKNUJTIW-LBPRGKRZSA-N 1 2 245.282 2.112 20 0 BEADLO Oc1ccc(C[N@H+]2CCC[C@H]2c2ncon2)cc1 ZINC000682405824 487949700 /nfs/dbraw/zinc/94/97/00/487949700.db2.gz XCNUPQCKNUJTIW-LBPRGKRZSA-N 1 2 245.282 2.112 20 0 BEADLO CCC(C)(C)NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000556687834 322919550 /nfs/dbraw/zinc/91/95/50/322919550.db2.gz FSSIERCDRYWHBA-SNVBAGLBSA-N 1 2 223.320 2.139 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)[C@]23C[C@H]2CCC3)[nH+]1 ZINC000569464091 322967031 /nfs/dbraw/zinc/96/70/31/322967031.db2.gz WPRDUHMHYHBIMQ-QMTHXVAHSA-N 1 2 247.342 2.260 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1CCCOCC1 ZINC000569500931 322968172 /nfs/dbraw/zinc/96/81/72/322968172.db2.gz BXBAVWISXKYRJK-LLVKDONJSA-N 1 2 221.304 2.074 20 0 BEADLO Cc1cc(NC(=O)N2CCC23CCC3)c(C)c[nH+]1 ZINC000560412410 322986953 /nfs/dbraw/zinc/98/69/53/322986953.db2.gz SNHAECZDDNTAHF-UHFFFAOYSA-N 1 2 245.326 2.281 20 0 BEADLO Cc1[nH]c(CN[C@H](C2CC2)C(F)(F)F)[nH+]c1C ZINC000566499523 323003486 /nfs/dbraw/zinc/00/34/86/323003486.db2.gz WRPABAIZDZOJMW-SNVBAGLBSA-N 1 2 247.264 2.457 20 0 BEADLO C[C@H](CC(=O)N1CC[C@@H](C2CC2)C1)n1cc[nH+]c1 ZINC000565046012 323005912 /nfs/dbraw/zinc/00/59/12/323005912.db2.gz HRMHSDAPEHNZEX-DGCLKSJQSA-N 1 2 247.342 2.093 20 0 BEADLO C[C@@H](NC(=O)CC1CC(F)(F)C1)c1[nH]cc[nH+]1 ZINC000564738165 323015707 /nfs/dbraw/zinc/01/57/07/323015707.db2.gz YWRHXTFIJZKEHT-SSDOTTSWSA-N 1 2 243.257 2.022 20 0 BEADLO C[C@@H](O)C[N@H+](Cc1cocn1)Cc1ccccc1 ZINC000562418628 323019375 /nfs/dbraw/zinc/01/93/75/323019375.db2.gz YGZSQSGBITXDFC-GFCCVEGCSA-N 1 2 246.310 2.058 20 0 BEADLO C[C@@H](O)C[N@@H+](Cc1cocn1)Cc1ccccc1 ZINC000562418628 323019376 /nfs/dbraw/zinc/01/93/76/323019376.db2.gz YGZSQSGBITXDFC-GFCCVEGCSA-N 1 2 246.310 2.058 20 0 BEADLO Cc1cc(NC(=O)[C@@]2(C)CCCCO2)c(C)c[nH+]1 ZINC000562654774 323026255 /nfs/dbraw/zinc/02/62/55/323026255.db2.gz RCUWRLCDWOFQKR-CQSZACIVSA-N 1 2 248.326 2.018 20 0 BEADLO C[C@@H](NC(=O)C[C@@H]1C=CCCC1)c1[nH]cc[nH+]1 ZINC000566983903 323030571 /nfs/dbraw/zinc/03/05/71/323030571.db2.gz UBSAGWDLXQPQTI-GHMZBOCLSA-N 1 2 233.315 2.333 20 0 BEADLO CC[C@]1(C(C)C)C[C@@H]1NC(=O)CCc1c[nH+]c[nH]1 ZINC000562962523 323036490 /nfs/dbraw/zinc/03/64/90/323036490.db2.gz UNOCZVPKVGMABD-GXTWGEPZSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@]1(C(C)C)C[C@@H]1NC(=O)CCc1c[nH]c[nH+]1 ZINC000562962523 323036491 /nfs/dbraw/zinc/03/64/91/323036491.db2.gz UNOCZVPKVGMABD-GXTWGEPZSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H]1CC[C@H](C(=O)N(C)Cc2[nH+]ccn2C)CC1 ZINC000569852085 323042871 /nfs/dbraw/zinc/04/28/71/323042871.db2.gz QECHXZCHLKNLSL-HAQNSBGRSA-N 1 2 249.358 2.205 20 0 BEADLO C[C@H](CC(=O)N1[C@H](C)CC[C@@H]1C)n1cc[nH+]c1 ZINC000570048437 323048077 /nfs/dbraw/zinc/04/80/77/323048077.db2.gz VFUIDAWOLYTERJ-GRYCIOLGSA-N 1 2 235.331 2.234 20 0 BEADLO C[C@@H](NC(=O)C[C@@H]1CC[C@@H](C)C1)c1[nH]cc[nH+]1 ZINC000570647990 323066075 /nfs/dbraw/zinc/06/60/75/323066075.db2.gz JUKXAQMYAXRLHX-GMTAPVOTSA-N 1 2 235.331 2.413 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000570688884 323067187 /nfs/dbraw/zinc/06/71/87/323067187.db2.gz DFOKNPSUKBFQIO-NXEZZACHSA-N 1 2 235.331 2.197 20 0 BEADLO C[C@@H](c1ccccc1)[C@H](O)C[NH2+]CC(C)(F)F ZINC000563001503 323079229 /nfs/dbraw/zinc/07/92/29/323079229.db2.gz VSRCGGSSAAQLRC-CMPLNLGQSA-N 1 2 243.297 2.396 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)[C@H]1CCCC[C@H]1C1CC1 ZINC000563180002 323100331 /nfs/dbraw/zinc/10/03/31/323100331.db2.gz IARMCWMQBXNPGZ-RYUDHWBXSA-N 1 2 247.342 2.242 20 0 BEADLO CC(C)CCCNC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000563223235 323104778 /nfs/dbraw/zinc/10/47/78/323104778.db2.gz WZQKPZFWVUHHCK-GFCCVEGCSA-N 1 2 237.347 2.387 20 0 BEADLO O=C(Nc1cc[nH+]cc1O)[C@@H]1CC12CCCCC2 ZINC000531673976 323111383 /nfs/dbraw/zinc/11/13/83/323111383.db2.gz QBRXOUPIOVULKS-JTQLQIEISA-N 1 2 246.310 2.118 20 0 BEADLO CC[C@@H](SC)C(=O)Nc1cc(C)[nH+]cc1C ZINC000534299623 323115928 /nfs/dbraw/zinc/11/59/28/323115928.db2.gz WDMBNNJNHZVTMK-LLVKDONJSA-N 1 2 238.356 2.200 20 0 BEADLO COC(=O)[C@](C)([NH2+]Cc1cccc(C)c1)C1CC1 ZINC000534315621 323116420 /nfs/dbraw/zinc/11/64/20/323116420.db2.gz YYIMMKQIIFSFBV-OAHLLOKOSA-N 1 2 247.338 2.426 20 0 BEADLO Cc1cc(NC(=O)NC2CCCC2)c(C)c[nH+]1 ZINC000534324114 323116560 /nfs/dbraw/zinc/11/65/60/323116560.db2.gz NAYJNMOHRBADMC-UHFFFAOYSA-N 1 2 233.315 2.184 20 0 BEADLO Cc1cc(NC(=O)N2C[C@H](C)C[C@@H]2C)c(C)c[nH+]1 ZINC000534324426 323116613 /nfs/dbraw/zinc/11/66/13/323116613.db2.gz VDKQCWXBEVNEIP-SKDRFNHKSA-N 1 2 247.342 2.383 20 0 BEADLO C[NH2+]Cc1noc(CCCc2ccc(F)cc2)n1 ZINC000563359584 323119760 /nfs/dbraw/zinc/11/97/60/323119760.db2.gz WZLOZOVVXDSBGM-UHFFFAOYSA-N 1 2 249.289 2.103 20 0 BEADLO CC[C@@H]1C[C@H]1NC(=O)c1ccn2c(C)c[nH+]c2c1 ZINC000563392979 323122533 /nfs/dbraw/zinc/12/25/33/323122533.db2.gz SEEBEEXOIOTSNV-ZYHUDNBSSA-N 1 2 243.310 2.171 20 0 BEADLO Cc1noc([C@H](C)[N@H+](C)Cc2ccncc2C)n1 ZINC000563550039 323129893 /nfs/dbraw/zinc/12/98/93/323129893.db2.gz OWDWGXAKXLIYKM-JTQLQIEISA-N 1 2 246.314 2.274 20 0 BEADLO Cc1noc([C@H](C)[N@@H+](C)Cc2ccncc2C)n1 ZINC000563550039 323129894 /nfs/dbraw/zinc/12/98/94/323129894.db2.gz OWDWGXAKXLIYKM-JTQLQIEISA-N 1 2 246.314 2.274 20 0 BEADLO CC(C)(C)n1cc(C[N@@H+]2CCC2(C)C)nn1 ZINC000563582608 323130433 /nfs/dbraw/zinc/13/04/33/323130433.db2.gz XTCBFMBOPABCTC-UHFFFAOYSA-N 1 2 222.336 2.017 20 0 BEADLO CC(C)(C)n1cc(C[N@H+]2CCC2(C)C)nn1 ZINC000563582608 323130434 /nfs/dbraw/zinc/13/04/34/323130434.db2.gz XTCBFMBOPABCTC-UHFFFAOYSA-N 1 2 222.336 2.017 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)Nc1ccsc1 ZINC000563636512 323133187 /nfs/dbraw/zinc/13/31/87/323133187.db2.gz MCUYEVMUOLTMFN-MRVPVSSYSA-N 1 2 235.312 2.289 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)Nc1ccsc1 ZINC000563636512 323133188 /nfs/dbraw/zinc/13/31/88/323133188.db2.gz MCUYEVMUOLTMFN-MRVPVSSYSA-N 1 2 235.312 2.289 20 0 BEADLO CC[C@@H](C)CC(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000571291811 323140453 /nfs/dbraw/zinc/14/04/53/323140453.db2.gz VSIVWMBYSRFKPB-SECBINFHSA-N 1 2 223.320 2.197 20 0 BEADLO CN(C(=O)c1ccc(-n2cc[nH+]c2)cc1)C1CC1 ZINC000049249229 323159339 /nfs/dbraw/zinc/15/93/39/323159339.db2.gz JQDBQJOMWVZRHJ-UHFFFAOYSA-N 1 2 241.294 2.107 20 0 BEADLO CCC[C@@H](C(=O)N1CC(n2cc[nH+]c2)C1)C(C)C ZINC000535005657 323162748 /nfs/dbraw/zinc/16/27/48/323162748.db2.gz QRPRNSPIHVNBIK-CYBMUJFWSA-N 1 2 249.358 2.339 20 0 BEADLO Cc1cc(NC(=O)[C@H]2[C@@H]3CCCC[C@@H]32)c(C)c[nH+]1 ZINC000535035783 323164202 /nfs/dbraw/zinc/16/42/02/323164202.db2.gz HIEPUGDQLRVABF-IMRBUKKESA-N 1 2 244.338 2.495 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CC=CCC2)c(C)c[nH+]1 ZINC000535035977 323164210 /nfs/dbraw/zinc/16/42/10/323164210.db2.gz JWKJAKDEEUPIRS-LBPRGKRZSA-N 1 2 230.311 2.415 20 0 BEADLO Cc1cc(NC(=O)NC2(C3CC3)CC2)c(C)c[nH+]1 ZINC000535060670 323164875 /nfs/dbraw/zinc/16/48/75/323164875.db2.gz KNTCWKOSYZCSSK-UHFFFAOYSA-N 1 2 245.326 2.184 20 0 BEADLO Cc1cc(NC(=O)N2CCC[C@@H]2C)c(C)c[nH+]1 ZINC000535059877 323164882 /nfs/dbraw/zinc/16/48/82/323164882.db2.gz XGHFOADIWODAKT-NSHDSACASA-N 1 2 233.315 2.137 20 0 BEADLO COc1ccccc1C[NH2+][C@@H](C)c1csnn1 ZINC000398489076 323185997 /nfs/dbraw/zinc/18/59/97/323185997.db2.gz VIZCPYRKXLWTSI-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO C[C@H](CC(=O)N1CCC2(CCC2)C1)n1cc[nH+]c1 ZINC000563890563 323186584 /nfs/dbraw/zinc/18/65/84/323186584.db2.gz RMCCEFZFYPMMGR-GFCCVEGCSA-N 1 2 247.342 2.237 20 0 BEADLO Cc1cc(NC(=O)N2CC[C@H](C)[C@H]2C)c(C)c[nH+]1 ZINC000535773058 323190896 /nfs/dbraw/zinc/19/08/96/323190896.db2.gz DAVZSKPJAWECOY-JOYOIKCWSA-N 1 2 247.342 2.383 20 0 BEADLO Cc1cc(NC(=O)N2CC[C@H](C)[C@@H]2C)c(C)c[nH+]1 ZINC000535773057 323190923 /nfs/dbraw/zinc/19/09/23/323190923.db2.gz DAVZSKPJAWECOY-CABZTGNLSA-N 1 2 247.342 2.383 20 0 BEADLO c1cc(C[NH2+][C@@H](c2cccnc2)C2CC2)[nH]n1 ZINC000536163918 323196259 /nfs/dbraw/zinc/19/62/59/323196259.db2.gz SJWJXHUJCMZLOT-CYBMUJFWSA-N 1 2 228.299 2.046 20 0 BEADLO Cc1cc(NC(=O)[C@H]2C[C@H]2C2CC2)c(C)c[nH+]1 ZINC000536574324 323197874 /nfs/dbraw/zinc/19/78/74/323197874.db2.gz BNYWAXLZRNUDCM-RYUDHWBXSA-N 1 2 230.311 2.105 20 0 BEADLO Cc1cc(NC(=O)[C@@H](C)C(C)C)c(C)c[nH+]1 ZINC000536574717 323198076 /nfs/dbraw/zinc/19/80/76/323198076.db2.gz CUXDJFOHROEWRI-NSHDSACASA-N 1 2 220.316 2.351 20 0 BEADLO Cc1cc(NC(=O)[C@@H](C)C(F)(F)F)c(C)c[nH+]1 ZINC000536575220 323198088 /nfs/dbraw/zinc/19/80/88/323198088.db2.gz JFBLGLTUJRLEFE-MRVPVSSYSA-N 1 2 246.232 2.257 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2CCC[C@@H]2C)c(C)c[nH+]1 ZINC000536619810 323198779 /nfs/dbraw/zinc/19/87/79/323198779.db2.gz CXLMLMSDYDMVRD-JOYOIKCWSA-N 1 2 247.342 2.430 20 0 BEADLO CCN(CC1CC1)C(=O)Nc1cc(C)[nH+]cc1C ZINC000536620276 323198782 /nfs/dbraw/zinc/19/87/82/323198782.db2.gz VQWHNROHKMLPLL-UHFFFAOYSA-N 1 2 247.342 2.384 20 0 BEADLO Cn1ccc(C[N@@H+]2CCC[C@@H]2c2ccccn2)n1 ZINC000536629437 323198786 /nfs/dbraw/zinc/19/87/86/323198786.db2.gz KNPAVQVPCMRCDB-CQSZACIVSA-N 1 2 242.326 2.152 20 0 BEADLO Cn1ccc(C[N@H+]2CCC[C@@H]2c2ccccn2)n1 ZINC000536629437 323198787 /nfs/dbraw/zinc/19/87/87/323198787.db2.gz KNPAVQVPCMRCDB-CQSZACIVSA-N 1 2 242.326 2.152 20 0 BEADLO O=C(NC1(C2CC2)CC1)c1ccc2[nH+]ccn2c1 ZINC000532123732 323206258 /nfs/dbraw/zinc/20/62/58/323206258.db2.gz WKVJJZYHEPIGNY-UHFFFAOYSA-N 1 2 241.294 2.007 20 0 BEADLO Cn1ncc(Cl)c1C[N@@H+]1CCC1(C)C ZINC000526123840 323234168 /nfs/dbraw/zinc/23/41/68/323234168.db2.gz SLFCFODHDAPRMV-UHFFFAOYSA-N 1 2 213.712 2.058 20 0 BEADLO Cn1ncc(Cl)c1C[N@H+]1CCC1(C)C ZINC000526123840 323234171 /nfs/dbraw/zinc/23/41/71/323234171.db2.gz SLFCFODHDAPRMV-UHFFFAOYSA-N 1 2 213.712 2.058 20 0 BEADLO COC(C)(C)CN(C)c1cc[nH+]c2ccncc21 ZINC000532327213 323251009 /nfs/dbraw/zinc/25/10/09/323251009.db2.gz DKHYXSVMFCFSDP-UHFFFAOYSA-N 1 2 245.326 2.491 20 0 BEADLO COC(C)(C)C[N@H+](C)Cc1nnc(C(C)C)o1 ZINC000532340707 323252974 /nfs/dbraw/zinc/25/29/74/323252974.db2.gz LWOFXLVPYILPLM-UHFFFAOYSA-N 1 2 241.335 2.050 20 0 BEADLO COC(C)(C)C[N@@H+](C)Cc1nnc(C(C)C)o1 ZINC000532340707 323252977 /nfs/dbraw/zinc/25/29/77/323252977.db2.gz LWOFXLVPYILPLM-UHFFFAOYSA-N 1 2 241.335 2.050 20 0 BEADLO Cc1ccc(N[C@@H](C)c2ccncn2)c[nH+]1 ZINC000395915226 323263771 /nfs/dbraw/zinc/26/37/71/323263771.db2.gz MJNRKYPQIRNBLY-JTQLQIEISA-N 1 2 214.272 2.353 20 0 BEADLO C[C@@H]([NH2+]C1(C2CC2)CC1)C(=O)OC(C)(C)C ZINC000309375688 323349399 /nfs/dbraw/zinc/34/93/99/323349399.db2.gz COUYDDAKKOUMML-SECBINFHSA-N 1 2 225.332 2.249 20 0 BEADLO CCc1nnc(C[NH2+]Cc2ccoc2C)s1 ZINC000321570251 323385273 /nfs/dbraw/zinc/38/52/73/323385273.db2.gz UQJXBGOATPQMJL-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO Cc1nn(C)cc1[C@H](C)[NH2+]Cc1ncccc1F ZINC000530418918 323386078 /nfs/dbraw/zinc/38/60/78/323386078.db2.gz NDBRYFZTZXVSAI-VIFPVBQESA-N 1 2 248.305 2.113 20 0 BEADLO CO[C@@H]1CCN(c2nc(C)[nH+]cc2C)CC1(C)C ZINC000567290473 323419070 /nfs/dbraw/zinc/41/90/70/323419070.db2.gz GPUXZEQRRPCYGE-GFCCVEGCSA-N 1 2 249.358 2.345 20 0 BEADLO COc1ccc[nH+]c1N(C)Cc1cscn1 ZINC000527862958 323702212 /nfs/dbraw/zinc/70/22/12/323702212.db2.gz PMGRLBSMYXWJEW-UHFFFAOYSA-N 1 2 235.312 2.183 20 0 BEADLO COc1ccc[nH+]c1NCCc1nc(C)oc1C ZINC000527941775 323722138 /nfs/dbraw/zinc/72/21/38/323722138.db2.gz QJEMMGLZEUFGEH-UHFFFAOYSA-N 1 2 247.298 2.350 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1CCC[C@H]1OC ZINC000527945383 323722799 /nfs/dbraw/zinc/72/27/99/323722799.db2.gz IOBGOUFOUJGREZ-GHMZBOCLSA-N 1 2 236.315 2.317 20 0 BEADLO CC1(C)OC[C@@H]2C[C@@]21Nc1cc[nH+]c(C2CC2)n1 ZINC000528127533 323771179 /nfs/dbraw/zinc/77/11/79/323771179.db2.gz LQEFNMRRYCLUSJ-IINYFYTJSA-N 1 2 245.326 2.333 20 0 BEADLO Cc1cc(N[C@H]2[C@@H](C)[C@@H](C)O[C@H]2C)nc[nH+]1 ZINC000528203651 323779145 /nfs/dbraw/zinc/77/91/45/323779145.db2.gz DMLUEEGUTSUEKP-WYFGTUCQSA-N 1 2 221.304 2.009 20 0 BEADLO C[C@H]1CCCC[C@@H]1C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000572595544 324136835 /nfs/dbraw/zinc/13/68/35/324136835.db2.gz LVVYYWOPMVNSIX-AAEUAGOBSA-N 1 2 247.342 2.093 20 0 BEADLO CC(C)OC(=O)[C@H](C)[NH2+]C1CC2(CCC2)C1 ZINC000459576222 324148772 /nfs/dbraw/zinc/14/87/72/324148772.db2.gz UYPWZHQDRRAMAN-JTQLQIEISA-N 1 2 225.332 2.249 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CCCC12CC2)c1[nH]cc[nH+]1 ZINC000529414247 324290167 /nfs/dbraw/zinc/29/01/67/324290167.db2.gz TUCXESPAZRQDDF-NXEZZACHSA-N 1 2 233.315 2.167 20 0 BEADLO Cc1cocc1C(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000529457826 324304941 /nfs/dbraw/zinc/30/49/41/324304941.db2.gz MDAXUQMJPODNEP-KOLCDFICSA-N 1 2 245.282 2.220 20 0 BEADLO CC[N@H+](CCO)Cc1c(F)ccc(F)c1Cl ZINC000529515404 324317119 /nfs/dbraw/zinc/31/71/19/324317119.db2.gz GJLFRRADYDPCDC-UHFFFAOYSA-N 1 2 249.688 2.432 20 0 BEADLO CC[N@@H+](CCO)Cc1c(F)ccc(F)c1Cl ZINC000529515404 324317122 /nfs/dbraw/zinc/31/71/22/324317122.db2.gz GJLFRRADYDPCDC-UHFFFAOYSA-N 1 2 249.688 2.432 20 0 BEADLO Cc1cc(C[NH+]2CC(Cc3ccco3)C2)no1 ZINC000529650311 324371688 /nfs/dbraw/zinc/37/16/88/324371688.db2.gz YTBKOMIOQIZDTM-UHFFFAOYSA-N 1 2 232.283 2.251 20 0 BEADLO CC1(C)C[C@@H]1C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000677083875 487963718 /nfs/dbraw/zinc/96/37/18/487963718.db2.gz BZUQNUFDQSWBIS-NWDGAFQWSA-N 1 2 247.342 2.093 20 0 BEADLO CCc1cnc(C[NH2+][C@@H](CO)c2ccccc2)o1 ZINC000541023612 324942668 /nfs/dbraw/zinc/94/26/68/324942668.db2.gz DCGMXZJEYLJWMK-ZDUSSCGKSA-N 1 2 246.310 2.060 20 0 BEADLO CC(C)CCn1ccc(NCc2c[nH+]cn2C)n1 ZINC000130176108 325021060 /nfs/dbraw/zinc/02/10/60/325021060.db2.gz FJIPBIMLAREXKL-UHFFFAOYSA-N 1 2 247.346 2.275 20 0 BEADLO CCC(CC)[C@@H](O)CNc1[nH+]cccc1OC ZINC000230646109 325043882 /nfs/dbraw/zinc/04/38/82/325043882.db2.gz KNNMGBAUNBLDNI-NSHDSACASA-N 1 2 238.331 2.299 20 0 BEADLO COC[C@@H]([NH2+]Cc1cnoc1C)c1ccco1 ZINC000130409942 325049295 /nfs/dbraw/zinc/04/92/95/325049295.db2.gz MOBULMXPEVYZJW-LLVKDONJSA-N 1 2 236.271 2.053 20 0 BEADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2nccn2C)o1 ZINC000071138767 325057513 /nfs/dbraw/zinc/05/75/13/325057513.db2.gz IYVGEPYNFOYWFG-JQWIXIFHSA-N 1 2 245.326 2.426 20 0 BEADLO CCc1cc(C[NH2+][C@@H](CC)c2ccn(C)n2)on1 ZINC000543592098 325095894 /nfs/dbraw/zinc/09/58/94/325095894.db2.gz TZQONMDVXKNNDO-LBPRGKRZSA-N 1 2 248.330 2.211 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2ccc(C)cn2)CCO1 ZINC000131502866 325157305 /nfs/dbraw/zinc/15/73/05/325157305.db2.gz YFMPDSVJRGDHEC-AWEZNQCLSA-N 1 2 234.343 2.391 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2ccc(C)cn2)CCO1 ZINC000131502866 325157306 /nfs/dbraw/zinc/15/73/06/325157306.db2.gz YFMPDSVJRGDHEC-AWEZNQCLSA-N 1 2 234.343 2.391 20 0 BEADLO Cc1cc(NC(=O)CC[C@H]2CCCO2)cc[nH+]1 ZINC000073688576 325209951 /nfs/dbraw/zinc/20/99/51/325209951.db2.gz DIRXWXWYSLFYAK-GFCCVEGCSA-N 1 2 234.299 2.288 20 0 BEADLO Cc1cc(NC(=O)CC[C@@H]2CCCO2)cc[nH+]1 ZINC000073688574 325210081 /nfs/dbraw/zinc/21/00/81/325210081.db2.gz DIRXWXWYSLFYAK-LBPRGKRZSA-N 1 2 234.299 2.288 20 0 BEADLO COCCCCNc1nc(N)c2ccccc2[nH+]1 ZINC000132372846 325213245 /nfs/dbraw/zinc/21/32/45/325213245.db2.gz UWLSOUSBPFAHIH-UHFFFAOYSA-N 1 2 246.314 2.051 20 0 BEADLO CCc1nc(Cc2cn3cccc(C)c3[nH+]2)no1 ZINC000546386963 325279819 /nfs/dbraw/zinc/27/98/19/325279819.db2.gz LINZOXJDNPQRRJ-UHFFFAOYSA-N 1 2 242.282 2.179 20 0 BEADLO Cn1c[nH+]cc1Cc1noc(C2(C)CCCC2)n1 ZINC000546551234 325287164 /nfs/dbraw/zinc/28/71/64/325287164.db2.gz RBXPZGQDPKKMIA-UHFFFAOYSA-N 1 2 246.314 2.226 20 0 BEADLO C/C(=C\c1nc(Cc2c[nH+]cn2C)no1)C1CC1 ZINC000546552493 325287278 /nfs/dbraw/zinc/28/72/78/325287278.db2.gz CTHAZLDHNIDBNF-WEVVVXLNSA-N 1 2 244.298 2.207 20 0 BEADLO CC(C)(C)[C@@H](NCCn1cc[nH+]c1)C(F)(F)F ZINC000546628806 325295848 /nfs/dbraw/zinc/29/58/48/325295848.db2.gz BLJSPKWKWNINCE-SECBINFHSA-N 1 2 249.280 2.450 20 0 BEADLO Cc1cccc([C@H](C)[NH+]2CCS(=O)CC2)c1 ZINC000075720616 325308027 /nfs/dbraw/zinc/30/80/27/325308027.db2.gz RJDVSVQGCIBNJL-LBPRGKRZSA-N 1 2 237.368 2.120 20 0 BEADLO Cn1c[nH+]cc1CC(=O)NCCCC1CCCC1 ZINC000547603440 325373839 /nfs/dbraw/zinc/37/38/39/325373839.db2.gz FNGPWLJTLGBVAZ-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO CCc1nnc([C@H](C)[N@H+]2[C@H](C)C[C@@H]2C)o1 ZINC000547768464 325394279 /nfs/dbraw/zinc/39/42/79/325394279.db2.gz NPLPVPZDPCUEHH-YIZRAAEISA-N 1 2 209.293 2.176 20 0 BEADLO CCc1nnc([C@H](C)[NH+]2[C@@H](C)C[C@@H]2C)o1 ZINC000547768461 325394502 /nfs/dbraw/zinc/39/45/02/325394502.db2.gz NPLPVPZDPCUEHH-CIUDSAMLSA-N 1 2 209.293 2.176 20 0 BEADLO CCCC[C@@H]([NH2+]CCc1ccco1)C(=O)OC ZINC000135130808 325396598 /nfs/dbraw/zinc/39/65/98/325396598.db2.gz HPYJEAHKYMIHSY-GFCCVEGCSA-N 1 2 239.315 2.144 20 0 BEADLO C[C@H](O)CCN(C)c1[nH+]ccc2ccccc21 ZINC000135629025 325420640 /nfs/dbraw/zinc/42/06/40/325420640.db2.gz PMFPDLRKVQPIMO-NSHDSACASA-N 1 2 230.311 2.442 20 0 BEADLO CC(C)[C@@H]1C[C@@H]1C(=O)NCCCCn1cc[nH+]c1 ZINC000548121312 325432597 /nfs/dbraw/zinc/43/25/97/325432597.db2.gz GVNAAXDAYBJTKT-STQMWFEESA-N 1 2 249.358 2.072 20 0 BEADLO CCCC1(C(=O)NCCc2c[nH+]cn2C)CCC1 ZINC000548460404 325460544 /nfs/dbraw/zinc/46/05/44/325460544.db2.gz DHMUVZZYSAUKDA-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO Cc1cc(NC(=O)[C@]2(C)C[C@H]3C[C@H]3C2)c(C)c[nH+]1 ZINC000551721239 325565729 /nfs/dbraw/zinc/56/57/29/325565729.db2.gz VPOVDODSHPIAEL-JJLQDPRZSA-N 1 2 244.338 2.495 20 0 BEADLO CCC(C)(C)[N@H+](C)Cc1nnn(C(C)(C)C)n1 ZINC000653580185 487969583 /nfs/dbraw/zinc/96/95/83/487969583.db2.gz BNGJCXNCBBGJRV-UHFFFAOYSA-N 1 2 239.367 2.049 20 0 BEADLO CCC(C)(C)[N@@H+](C)Cc1nnn(C(C)(C)C)n1 ZINC000653580185 487969587 /nfs/dbraw/zinc/96/95/87/487969587.db2.gz BNGJCXNCBBGJRV-UHFFFAOYSA-N 1 2 239.367 2.049 20 0 BEADLO C[C@H]1CC=C(C(=O)N2CC(n3cc[nH+]c3)C2)CC1 ZINC000564535499 325795235 /nfs/dbraw/zinc/79/52/35/325795235.db2.gz SJUNFYHLWXXEOL-NSHDSACASA-N 1 2 245.326 2.013 20 0 BEADLO CC[C@@H](C)[C@H](C)N(C(=O)Cn1cc[nH+]c1)C1CC1 ZINC000564639845 325800113 /nfs/dbraw/zinc/80/01/13/325800113.db2.gz ICWBHMWFCGLZMK-NEPJUHHUSA-N 1 2 249.358 2.309 20 0 BEADLO CC(C)(NC(=O)C1CCCCC1)c1[nH]cc[nH+]1 ZINC000565108797 325858982 /nfs/dbraw/zinc/85/89/82/325858982.db2.gz RFKPXLAXKSOLTB-UHFFFAOYSA-N 1 2 235.331 2.341 20 0 BEADLO Cc1c[nH+]c(C)nc1NCC1=CCCCC1 ZINC000565225954 325880528 /nfs/dbraw/zinc/88/05/28/325880528.db2.gz HQBPKMLSKRQDIW-UHFFFAOYSA-N 1 2 217.316 2.428 20 0 BEADLO CC(C)C(NC(=O)C[NH+]1CC(C)(C)C1)C(C)C ZINC000654928006 487971264 /nfs/dbraw/zinc/97/12/64/487971264.db2.gz RUFRGSVHYZTZGD-UHFFFAOYSA-N 1 2 240.391 2.125 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N(C)C1(C)CCCC1 ZINC000566453694 326050280 /nfs/dbraw/zinc/05/02/80/326050280.db2.gz UPMVYTFRNDFMMH-NSHDSACASA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N(C)C1(C)CCCC1 ZINC000566453694 326050281 /nfs/dbraw/zinc/05/02/81/326050281.db2.gz UPMVYTFRNDFMMH-NSHDSACASA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@H](C)C1CCCC1 ZINC000566465917 326051662 /nfs/dbraw/zinc/05/16/62/326051662.db2.gz MPPGWPUXBUMDGT-MNOVXSKESA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@H](C)C1CCCC1 ZINC000566465917 326051665 /nfs/dbraw/zinc/05/16/65/326051665.db2.gz MPPGWPUXBUMDGT-MNOVXSKESA-N 1 2 249.358 2.283 20 0 BEADLO F[C@H]1CCC[C@@H](Nc2cc[nH+]c(C3CC3)n2)C1 ZINC000566971405 326097826 /nfs/dbraw/zinc/09/78/26/326097826.db2.gz KYMLESUONRDZIE-WDEREUQCSA-N 1 2 235.306 2.469 20 0 BEADLO F[C@@H]1CCC[C@H](Nc2cc[nH+]c(C3CC3)n2)C1 ZINC000566971401 326097878 /nfs/dbraw/zinc/09/78/78/326097878.db2.gz KYMLESUONRDZIE-MNOVXSKESA-N 1 2 235.306 2.469 20 0 BEADLO CC(C)[C@H]1CCCN1C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000567059674 326109069 /nfs/dbraw/zinc/10/90/69/326109069.db2.gz DKQGJBYKBVECKR-WCQYABFASA-N 1 2 249.358 2.235 20 0 BEADLO CC(C)[C@H]1CCCN1C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000567059674 326109071 /nfs/dbraw/zinc/10/90/71/326109071.db2.gz DKQGJBYKBVECKR-WCQYABFASA-N 1 2 249.358 2.235 20 0 BEADLO Cc1ccc(C[N@@H+]2CCOCC23CCC3)cn1 ZINC000153923775 326120778 /nfs/dbraw/zinc/12/07/78/326120778.db2.gz QNAIOLYXGXWMPH-UHFFFAOYSA-N 1 2 232.327 2.145 20 0 BEADLO Cc1ccc(C[N@H+]2CCOCC23CCC3)cn1 ZINC000153923775 326120779 /nfs/dbraw/zinc/12/07/79/326120779.db2.gz QNAIOLYXGXWMPH-UHFFFAOYSA-N 1 2 232.327 2.145 20 0 BEADLO CC(C)[C@H]1CCN(C(=O)[C@H](C)Cc2c[nH+]c[nH]2)C1 ZINC000567288460 326156389 /nfs/dbraw/zinc/15/63/89/326156389.db2.gz PWBUDCGVFKXSKT-NEPJUHHUSA-N 1 2 249.358 2.093 20 0 BEADLO CC(C)[C@H]1CCN(C(=O)[C@H](C)Cc2c[nH]c[nH+]2)C1 ZINC000567288460 326156390 /nfs/dbraw/zinc/15/63/90/326156390.db2.gz PWBUDCGVFKXSKT-NEPJUHHUSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CC[C@H](O)CC(C)(C)C1 ZINC000567291310 326156945 /nfs/dbraw/zinc/15/69/45/326156945.db2.gz XOJKEILBRZSXOZ-LBPRGKRZSA-N 1 2 249.358 2.081 20 0 BEADLO CC[C@@H](O)C[NH2+][C@@H](c1ccccc1)C(F)F ZINC000309841944 326171612 /nfs/dbraw/zinc/17/16/12/326171612.db2.gz QANGGJHWANCJNB-MNOVXSKESA-N 1 2 229.270 2.353 20 0 BEADLO Cc1cc(NC(=O)Cc2c[nH+]cn2C)ccc1F ZINC000567369355 326176366 /nfs/dbraw/zinc/17/63/66/326176366.db2.gz YZNLISDNZPCMBE-UHFFFAOYSA-N 1 2 247.273 2.049 20 0 BEADLO CC[C@H]1CCCCN1C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000567403353 326184568 /nfs/dbraw/zinc/18/45/68/326184568.db2.gz MPAHAPKYTMFOTC-YPMHNXCESA-N 1 2 249.358 2.379 20 0 BEADLO CC[C@H]1CCCCN1C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000567403353 326184569 /nfs/dbraw/zinc/18/45/69/326184569.db2.gz MPAHAPKYTMFOTC-YPMHNXCESA-N 1 2 249.358 2.379 20 0 BEADLO CCn1cc[nH+]c1CN1Cc2ccccc2C1 ZINC000155493252 326197517 /nfs/dbraw/zinc/19/75/17/326197517.db2.gz WEHRGRPEXZGMEY-UHFFFAOYSA-N 1 2 227.311 2.419 20 0 BEADLO CCc1ncc(C[NH2+]Cc2cncn2C(C)C)o1 ZINC000567463219 326197684 /nfs/dbraw/zinc/19/76/84/326197684.db2.gz HZLKZQSXOLLBBZ-UHFFFAOYSA-N 1 2 248.330 2.304 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CCO[C@@H](C)[C@H]1C ZINC000155956656 326215902 /nfs/dbraw/zinc/21/59/02/326215902.db2.gz FZSDLRLXMSWISA-NEPJUHHUSA-N 1 2 237.347 2.073 20 0 BEADLO CC[C@H]1CCCC[N@@H+]1Cc1csnn1 ZINC000157463498 326276601 /nfs/dbraw/zinc/27/66/01/326276601.db2.gz MGPDNBSQLZKONY-JTQLQIEISA-N 1 2 211.334 2.303 20 0 BEADLO CC[C@H]1CCCC[N@H+]1Cc1csnn1 ZINC000157463498 326276603 /nfs/dbraw/zinc/27/66/03/326276603.db2.gz MGPDNBSQLZKONY-JTQLQIEISA-N 1 2 211.334 2.303 20 0 BEADLO CCOCC[N@H+](CC)[C@H](C)c1nc(CC)no1 ZINC000157485462 326277903 /nfs/dbraw/zinc/27/79/03/326277903.db2.gz PBLMOJUQGCCWQY-SNVBAGLBSA-N 1 2 241.335 2.051 20 0 BEADLO CCOCC[N@@H+](CC)[C@H](C)c1nc(CC)no1 ZINC000157485462 326277905 /nfs/dbraw/zinc/27/79/05/326277905.db2.gz PBLMOJUQGCCWQY-SNVBAGLBSA-N 1 2 241.335 2.051 20 0 BEADLO C[C@@H](CC(=O)N1CCCC2(CC2)C1)n1cc[nH+]c1 ZINC000568032461 326298594 /nfs/dbraw/zinc/29/85/94/326298594.db2.gz DRPGEDGKLAPLBI-LBPRGKRZSA-N 1 2 247.342 2.237 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N[C@H]3CC[C@@H]3C)ccn12 ZINC000568212126 326327155 /nfs/dbraw/zinc/32/71/55/326327155.db2.gz UJPPUGUYGKTWGE-CABZTGNLSA-N 1 2 243.310 2.171 20 0 BEADLO Cc1ncncc1[C@@H](C)[NH2+]Cc1ncccc1F ZINC000568238458 326332193 /nfs/dbraw/zinc/33/21/93/326332193.db2.gz VICGTHPFYRBMRQ-SECBINFHSA-N 1 2 246.289 2.170 20 0 BEADLO Cc1ncncc1[C@H](C)[NH2+]Cc1ncccc1F ZINC000568238459 326332354 /nfs/dbraw/zinc/33/23/54/326332354.db2.gz VICGTHPFYRBMRQ-VIFPVBQESA-N 1 2 246.289 2.170 20 0 BEADLO C[C@H](NC(=O)Cn1cc[nH+]c1)[C@@H]1CCC[C@@H](C)C1 ZINC000568956344 326383601 /nfs/dbraw/zinc/38/36/01/326383601.db2.gz BXQUSMSMRNBAJT-FRRDWIJNSA-N 1 2 249.358 2.214 20 0 BEADLO CCc1nc(C)c(C[NH2+][C@@H](C)c2ccon2)o1 ZINC000569066031 326388196 /nfs/dbraw/zinc/38/81/96/326388196.db2.gz KJFSKGIUIGBQHO-QMMMGPOBSA-N 1 2 235.287 2.384 20 0 BEADLO C[C@@H](CC(=O)N1CCC(C)CC1)n1cc[nH+]c1 ZINC000573124952 326430985 /nfs/dbraw/zinc/43/09/85/326430985.db2.gz QPFJTEVSRMIDQV-LBPRGKRZSA-N 1 2 235.331 2.093 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CC3(CC(F)C3)C2)[nH+]1 ZINC000677124504 487976003 /nfs/dbraw/zinc/97/60/03/487976003.db2.gz LBZGNJZGQCGAJG-UHFFFAOYSA-N 1 2 246.289 2.205 20 0 BEADLO O[C@H]1C[N@H+](C[C@H]2CC=CCC2)CC(F)(F)C1 ZINC000682559385 487984958 /nfs/dbraw/zinc/98/49/58/487984958.db2.gz UYIJULDDOXHYMN-WDEREUQCSA-N 1 2 231.286 2.045 20 0 BEADLO O[C@H]1C[N@@H+](C[C@H]2CC=CCC2)CC(F)(F)C1 ZINC000682559385 487984964 /nfs/dbraw/zinc/98/49/64/487984964.db2.gz UYIJULDDOXHYMN-WDEREUQCSA-N 1 2 231.286 2.045 20 0 BEADLO CCC[C@@H](C)C[N@@H+]1C[C@H](O)CC(F)(F)C1 ZINC000682558780 487989152 /nfs/dbraw/zinc/98/91/52/487989152.db2.gz PEADHUCFNNWNLK-NXEZZACHSA-N 1 2 221.291 2.125 20 0 BEADLO CCC[C@@H](C)C[N@H+]1C[C@H](O)CC(F)(F)C1 ZINC000682558780 487989156 /nfs/dbraw/zinc/98/91/56/487989156.db2.gz PEADHUCFNNWNLK-NXEZZACHSA-N 1 2 221.291 2.125 20 0 BEADLO Cc1c([C@@H](C)Nc2cc(C)[nH+]cn2)cnn1C ZINC000602541975 487995173 /nfs/dbraw/zinc/99/51/73/487995173.db2.gz ODEMLMRIDNYSTM-SECBINFHSA-N 1 2 231.303 2.000 20 0 BEADLO CCC[C@@H](CC)NC(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000667423587 488000076 /nfs/dbraw/zinc/00/00/76/488000076.db2.gz QHIMPFSONRYPBS-WDEREUQCSA-N 1 2 249.358 2.210 20 0 BEADLO CCC[C@@H](CC)NC(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000667423587 488000083 /nfs/dbraw/zinc/00/00/83/488000083.db2.gz QHIMPFSONRYPBS-WDEREUQCSA-N 1 2 249.358 2.210 20 0 BEADLO Cc1[nH]c(C(=O)NC(C(C)C)C(C)C)c[nH+]1 ZINC000677293850 488009771 /nfs/dbraw/zinc/00/97/71/488009771.db2.gz YLLNLTVDOSFXNH-UHFFFAOYSA-N 1 2 223.320 2.129 20 0 BEADLO CCN(C[C@H]1CCOC1)c1[nH]c2ccccc2[nH+]1 ZINC000682393753 488019855 /nfs/dbraw/zinc/01/98/55/488019855.db2.gz FEGXHVDFGBSGDR-LLVKDONJSA-N 1 2 245.326 2.426 20 0 BEADLO CN(Cc1ccco1)Cc1c[nH+]c2n1CCC2 ZINC000667479520 488022462 /nfs/dbraw/zinc/02/24/62/488022462.db2.gz HZJLVYCPPRVXDR-UHFFFAOYSA-N 1 2 231.299 2.054 20 0 BEADLO Cc1cc(NC(=O)N(C)C[C@@H]2CC2(C)C)cc[nH+]1 ZINC000666489100 488026285 /nfs/dbraw/zinc/02/62/85/488026285.db2.gz AACFWBDAAQUIEV-NSHDSACASA-N 1 2 247.342 2.322 20 0 BEADLO CCc1cc(NCC2(COC)CCC2)nc[nH+]1 ZINC000310466553 488028974 /nfs/dbraw/zinc/02/89/74/488028974.db2.gz ZSDMNTXDVDLAGU-UHFFFAOYSA-N 1 2 235.331 2.268 20 0 BEADLO CN(Cc1csc(C2CC2)n1)Cc1[nH]cc[nH+]1 ZINC000682842719 488052697 /nfs/dbraw/zinc/05/26/97/488052697.db2.gz PPWPBEUVWFPQNA-UHFFFAOYSA-N 1 2 248.355 2.376 20 0 BEADLO c1cc([C@@H]2C[N@H+](Cc3cn[nH]c3)CCO2)cs1 ZINC000678284838 488067691 /nfs/dbraw/zinc/06/76/91/488067691.db2.gz JVEJMXAPHNSFSP-LBPRGKRZSA-N 1 2 249.339 2.045 20 0 BEADLO c1cc([C@@H]2C[N@@H+](Cc3cn[nH]c3)CCO2)cs1 ZINC000678284838 488067696 /nfs/dbraw/zinc/06/76/96/488067696.db2.gz JVEJMXAPHNSFSP-LBPRGKRZSA-N 1 2 249.339 2.045 20 0 BEADLO COc1ccc(-c2[nH+]ccn2C)c(C)c1 ZINC000656369591 488081668 /nfs/dbraw/zinc/08/16/68/488081668.db2.gz FTVKJDBYFCALFK-UHFFFAOYSA-N 1 2 202.257 2.404 20 0 BEADLO CCn1ccc(C[N@H+](C)[C@H](C)c2nc(C)no2)c1 ZINC000683029822 488100500 /nfs/dbraw/zinc/10/05/00/488100500.db2.gz RTMPHWUQVDBNFA-SNVBAGLBSA-N 1 2 248.330 2.392 20 0 BEADLO CCn1ccc(C[N@@H+](C)[C@H](C)c2nc(C)no2)c1 ZINC000683029822 488100507 /nfs/dbraw/zinc/10/05/07/488100507.db2.gz RTMPHWUQVDBNFA-SNVBAGLBSA-N 1 2 248.330 2.392 20 0 BEADLO COCC1([N@H+](C)Cc2ccncc2Cl)CC1 ZINC000677728547 488106358 /nfs/dbraw/zinc/10/63/58/488106358.db2.gz HUANPBAJDOMGLG-UHFFFAOYSA-N 1 2 240.734 2.346 20 0 BEADLO COCC1([N@@H+](C)Cc2ccncc2Cl)CC1 ZINC000677728547 488106362 /nfs/dbraw/zinc/10/63/62/488106362.db2.gz HUANPBAJDOMGLG-UHFFFAOYSA-N 1 2 240.734 2.346 20 0 BEADLO CCCc1noc(C[N@@H+]2CC[C@H](C(F)F)C2)n1 ZINC000677734559 488112955 /nfs/dbraw/zinc/11/29/55/488112955.db2.gz OGRMGDSOKIIJRZ-QMMMGPOBSA-N 1 2 245.273 2.109 20 0 BEADLO CCCc1noc(C[N@H+]2CC[C@H](C(F)F)C2)n1 ZINC000677734559 488112959 /nfs/dbraw/zinc/11/29/59/488112959.db2.gz OGRMGDSOKIIJRZ-QMMMGPOBSA-N 1 2 245.273 2.109 20 0 BEADLO C[C@H](CO)C[N@@H+](Cc1ccccc1)CC(F)F ZINC000121137104 490077234 /nfs/dbraw/zinc/07/72/34/490077234.db2.gz QFUHAYCJHMNDDQ-NSHDSACASA-N 1 2 243.297 2.382 20 0 BEADLO C[C@H](CO)C[N@H+](Cc1ccccc1)CC(F)F ZINC000121137104 490077238 /nfs/dbraw/zinc/07/72/38/490077238.db2.gz QFUHAYCJHMNDDQ-NSHDSACASA-N 1 2 243.297 2.382 20 0 BEADLO CCc1cc(N[C@H]2C[C@@H](OC(C)C)C2)nc[nH+]1 ZINC000665730426 487540606 /nfs/dbraw/zinc/54/06/06/487540606.db2.gz YGOVIRAJNDFGRW-TXEJJXNPSA-N 1 2 235.331 2.407 20 0 BEADLO O=c1[nH]c2ccc(CNc3cccc[nH+]3)cc2[nH]1 ZINC000680062641 487529917 /nfs/dbraw/zinc/52/99/17/487529917.db2.gz RNRYWERTLOVDAE-UHFFFAOYSA-N 1 2 240.266 2.276 20 0 BEADLO CCc1nc(C[NH+]2CC3(CC3)C2)cs1 ZINC000334742960 487551120 /nfs/dbraw/zinc/55/11/20/487551120.db2.gz OSJGBMZCNDHTEJ-UHFFFAOYSA-N 1 2 208.330 2.301 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCO[C@@H](C(C)C)C2)o1 ZINC000685571659 487552508 /nfs/dbraw/zinc/55/25/08/487552508.db2.gz CURDPORTJVHSBG-GFCCVEGCSA-N 1 2 238.331 2.148 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCO[C@@H](C(C)C)C2)o1 ZINC000685571659 487552509 /nfs/dbraw/zinc/55/25/09/487552509.db2.gz CURDPORTJVHSBG-GFCCVEGCSA-N 1 2 238.331 2.148 20 0 BEADLO CCc1cc(NCC2CCC(O)CC2)nc[nH+]1 ZINC000227706240 487471338 /nfs/dbraw/zinc/47/13/38/487471338.db2.gz GBGMMRGZEZGCDE-UHFFFAOYSA-N 1 2 235.331 2.002 20 0 BEADLO Cc1cc(N(C)Cc2ncc[nH]2)nc(C2CC2)[nH+]1 ZINC000673896075 487472506 /nfs/dbraw/zinc/47/25/06/487472506.db2.gz VLMHNTIIKUSYBC-UHFFFAOYSA-N 1 2 243.314 2.022 20 0 BEADLO O[C@@H]1CCCC[C@H]1[N@@H+]1CCCC(F)(F)C1 ZINC000405083325 487473605 /nfs/dbraw/zinc/47/36/05/487473605.db2.gz QVOQVKHZWZPFPH-NXEZZACHSA-N 1 2 219.275 2.021 20 0 BEADLO O[C@@H]1CCCC[C@H]1[N@H+]1CCCC(F)(F)C1 ZINC000405083325 487473608 /nfs/dbraw/zinc/47/36/08/487473608.db2.gz QVOQVKHZWZPFPH-NXEZZACHSA-N 1 2 219.275 2.021 20 0 BEADLO CCC(C)(C)CC(=O)N1CCn2cc(C)[nH+]c2C1 ZINC000679894984 487482610 /nfs/dbraw/zinc/48/26/10/487482610.db2.gz XFMNQEIBJMACNK-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO CCc1cc(NC[C@]2(C)CCCC[C@H]2O)nc[nH+]1 ZINC000673933462 487484076 /nfs/dbraw/zinc/48/40/76/487484076.db2.gz UGAKCASWFREULE-OCCSQVGLSA-N 1 2 249.358 2.392 20 0 BEADLO COc1ccc(N[C@H]2COC3(CCC3)C2)[nH+]c1 ZINC000657951207 487480564 /nfs/dbraw/zinc/48/05/64/487480564.db2.gz YNTXNUSPSGIPCO-SNVBAGLBSA-N 1 2 234.299 2.214 20 0 BEADLO Cc1nc(N[C@@H](C)C[C@H](C)O)c2c([nH+]1)CCCC2 ZINC000679932674 487495994 /nfs/dbraw/zinc/49/59/94/487495994.db2.gz MMXOJPVPPGHGRX-UWVGGRQHSA-N 1 2 249.358 2.235 20 0 BEADLO CCOC1C[NH+](Cc2cc(COC)cs2)C1 ZINC000668231133 487496483 /nfs/dbraw/zinc/49/64/83/487496483.db2.gz NNVDLSZHDBJYGG-UHFFFAOYSA-N 1 2 241.356 2.115 20 0 BEADLO CCCN(CCC)C(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000220513897 487509544 /nfs/dbraw/zinc/50/95/44/487509544.db2.gz HBWWMOOBMJDQSZ-LLVKDONJSA-N 1 2 249.358 2.163 20 0 BEADLO CCCN(CCC)C(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000220513897 487509548 /nfs/dbraw/zinc/50/95/48/487509548.db2.gz HBWWMOOBMJDQSZ-LLVKDONJSA-N 1 2 249.358 2.163 20 0 BEADLO CCOC(=O)[C@H](Cc1ccccc1)[NH2+]CC1CC1 ZINC000037968211 487517948 /nfs/dbraw/zinc/51/79/48/487517948.db2.gz GIADLRCUWSMKOK-AWEZNQCLSA-N 1 2 247.338 2.160 20 0 BEADLO CCc1nnc(C[N@@H+](CC)C2CC2)s1 ZINC000680046385 487526001 /nfs/dbraw/zinc/52/60/01/487526001.db2.gz WWBQEKNTLFSSSB-UHFFFAOYSA-N 1 2 211.334 2.085 20 0 BEADLO CCc1nnc(C[N@H+](CC)C2CC2)s1 ZINC000680046385 487526010 /nfs/dbraw/zinc/52/60/10/487526010.db2.gz WWBQEKNTLFSSSB-UHFFFAOYSA-N 1 2 211.334 2.085 20 0 BEADLO Cn1c[nH+]c(CCNc2ncc(Cl)s2)c1 ZINC000665729630 487527280 /nfs/dbraw/zinc/52/72/80/487527280.db2.gz WUXOYMQEPYVKJU-UHFFFAOYSA-N 1 2 242.735 2.185 20 0 BEADLO Cc1nnc(C[NH2+]C2(c3ccccc3)CC2)o1 ZINC000264026082 518193963 /nfs/dbraw/zinc/19/39/63/518193963.db2.gz YGHKRDWKYIAMDZ-UHFFFAOYSA-N 1 2 229.283 2.157 20 0 BEADLO Cc1nnc(-c2ccc(Cn3cc[nH+]c3)cc2)o1 ZINC000680328885 487563470 /nfs/dbraw/zinc/56/34/70/487563470.db2.gz JLTKXQCJSRUGLG-UHFFFAOYSA-N 1 2 240.266 2.290 20 0 BEADLO COc1ccc(F)c(C[NH+]2CC3(CC3)C2)c1 ZINC000335374892 487621703 /nfs/dbraw/zinc/62/17/03/487621703.db2.gz BIAGYENKHQZUNU-UHFFFAOYSA-N 1 2 221.275 2.430 20 0 BEADLO C[C@H](Cc1nc(-c2ccco2)no1)n1cc[nH+]c1 ZINC000351425840 487660641 /nfs/dbraw/zinc/66/06/41/487660641.db2.gz XORBUCCDPHPCBR-SECBINFHSA-N 1 2 244.254 2.330 20 0 BEADLO C[C@H](Cc1nc(C2(C)CC2)no1)n1cc[nH+]c1 ZINC000351458472 487669951 /nfs/dbraw/zinc/66/99/51/487669951.db2.gz SSLNISWJMVFXLY-SECBINFHSA-N 1 2 232.287 2.121 20 0 BEADLO C[C@@H](Cc1nc(-c2ccoc2)no1)n1cc[nH+]c1 ZINC000351513514 487679644 /nfs/dbraw/zinc/67/96/44/487679644.db2.gz PWTJAALQPXALKL-VIFPVBQESA-N 1 2 244.254 2.330 20 0 BEADLO c1n[nH]c2c1CC[N@@H+]([C@@H]1CCc3ccccc31)C2 ZINC000682070374 487891579 /nfs/dbraw/zinc/89/15/79/487891579.db2.gz COPGIHZRIJSUFQ-OAHLLOKOSA-N 1 2 239.322 2.455 20 0 BEADLO c1n[nH]c2c1CC[N@H+]([C@@H]1CCc3ccccc31)C2 ZINC000682070374 487891584 /nfs/dbraw/zinc/89/15/84/487891584.db2.gz COPGIHZRIJSUFQ-OAHLLOKOSA-N 1 2 239.322 2.455 20 0 BEADLO C[C@H]([NH2+]Cc1n[nH]c2ccccc21)c1cn[nH]c1 ZINC000677425399 488034360 /nfs/dbraw/zinc/03/43/60/488034360.db2.gz BILVLXOYDYXFHM-VIFPVBQESA-N 1 2 241.298 2.137 20 0 BEADLO CC[C@H](C)CC(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000682891573 488061375 /nfs/dbraw/zinc/06/13/75/488061375.db2.gz ITLRIPZPRHOWDK-QWHCGFSZSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1[nH]ccc1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000670379182 488122804 /nfs/dbraw/zinc/12/28/04/488122804.db2.gz IAMQOKBWHOFSCW-UHFFFAOYSA-N 1 2 240.266 2.223 20 0 BEADLO c1nc(C[N@@H+]2CCOCC3(CCCC3)C2)co1 ZINC000683355084 488147915 /nfs/dbraw/zinc/14/79/15/488147915.db2.gz OLBKJESGCSPHLB-UHFFFAOYSA-N 1 2 236.315 2.067 20 0 BEADLO c1nc(C[N@H+]2CCOCC3(CCCC3)C2)co1 ZINC000683355084 488147920 /nfs/dbraw/zinc/14/79/20/488147920.db2.gz OLBKJESGCSPHLB-UHFFFAOYSA-N 1 2 236.315 2.067 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@H]2CCOC[C@@H]2C)[nH+]1 ZINC000683354416 488152311 /nfs/dbraw/zinc/15/23/11/488152311.db2.gz ZUHOWFDJJYYYTP-KWQFWETISA-N 1 2 246.314 2.103 20 0 BEADLO Cc1ccc(N[C@H]2CO[C@H](C3CC3)C2)c[nH+]1 ZINC000667909619 488153318 /nfs/dbraw/zinc/15/33/18/488153318.db2.gz YLQDLKIYHXETMK-OLZOCXBDSA-N 1 2 218.300 2.369 20 0 BEADLO COc1ccc(N[C@@H]2CO[C@@H](C3CC3)C2)[nH+]c1 ZINC000667907504 488153737 /nfs/dbraw/zinc/15/37/37/488153737.db2.gz RTTQGUWMSZNWCO-CMPLNLGQSA-N 1 2 234.299 2.070 20 0 BEADLO Cc1ccc(N[C@H]2CO[C@@H](C3CC3)C2)c[nH+]1 ZINC000667909618 488153795 /nfs/dbraw/zinc/15/37/95/488153795.db2.gz YLQDLKIYHXETMK-CHWSQXEVSA-N 1 2 218.300 2.369 20 0 BEADLO CCCn1nccc1C[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000667943149 488164534 /nfs/dbraw/zinc/16/45/34/488164534.db2.gz BHTQBXRKWRTWQC-DGCLKSJQSA-N 1 2 239.338 2.473 20 0 BEADLO CCCn1nccc1C[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000667943149 488164538 /nfs/dbraw/zinc/16/45/38/488164538.db2.gz BHTQBXRKWRTWQC-DGCLKSJQSA-N 1 2 239.338 2.473 20 0 BEADLO Cc1nc(N[C@@H](CO)CC2CCCC2)cc[nH+]1 ZINC000677957715 488165728 /nfs/dbraw/zinc/16/57/28/488165728.db2.gz WESMNLJSOROBNI-GFCCVEGCSA-N 1 2 235.331 2.138 20 0 BEADLO Oc1ccc2c(c1)C[N@@H+](CC1(F)CC1)CCO2 ZINC000668724480 488165976 /nfs/dbraw/zinc/16/59/76/488165976.db2.gz QXWUKRFHUJUWLB-UHFFFAOYSA-N 1 2 237.274 2.089 20 0 BEADLO Oc1ccc2c(c1)C[N@H+](CC1(F)CC1)CCO2 ZINC000668724480 488165981 /nfs/dbraw/zinc/16/59/81/488165981.db2.gz QXWUKRFHUJUWLB-UHFFFAOYSA-N 1 2 237.274 2.089 20 0 BEADLO Cc1cccn2c(NC(=O)NCC3CC3)c[nH+]c12 ZINC000667948168 488166286 /nfs/dbraw/zinc/16/62/86/488166286.db2.gz QWHDHBKBLNCSSG-UHFFFAOYSA-N 1 2 244.298 2.174 20 0 BEADLO Cc1cccn2c(NC(=O)N3CC(C)C3)c[nH+]c12 ZINC000667956158 488167313 /nfs/dbraw/zinc/16/73/13/488167313.db2.gz WXKXYIKVRFNZGF-UHFFFAOYSA-N 1 2 244.298 2.126 20 0 BEADLO CC(C)(CC(=O)N1CCc2[nH]c[nH+]c2C1)C1CC1 ZINC000627372064 488182443 /nfs/dbraw/zinc/18/24/43/488182443.db2.gz BFXXTPCSLMVRDQ-UHFFFAOYSA-N 1 2 247.342 2.121 20 0 BEADLO CC(C)(CC(=O)N1CCc2[nH+]c[nH]c2C1)C1CC1 ZINC000627372064 488182446 /nfs/dbraw/zinc/18/24/46/488182446.db2.gz BFXXTPCSLMVRDQ-UHFFFAOYSA-N 1 2 247.342 2.121 20 0 BEADLO CCC[C@@H](C)NC(=O)Nc1cc[nH+]cc1C ZINC000678095644 488197604 /nfs/dbraw/zinc/19/76/04/488197604.db2.gz HSAZTEJRLTWTTA-SNVBAGLBSA-N 1 2 221.304 2.122 20 0 BEADLO C[C@H](c1noc(Cn2cc[nH+]c2)n1)C(C)(C)C ZINC000683580557 488199533 /nfs/dbraw/zinc/19/95/33/488199533.db2.gz JDNGBLVQXBXRCO-SECBINFHSA-N 1 2 234.303 2.464 20 0 BEADLO CCc1cc(NC[C@](C)(CC)OC)nc[nH+]1 ZINC000323168783 488204730 /nfs/dbraw/zinc/20/47/30/488204730.db2.gz VQXGMSAPFXXJOB-LBPRGKRZSA-N 1 2 223.320 2.266 20 0 BEADLO CCCNC(=O)Nc1ccn2cc(C)[nH+]c2c1 ZINC000668151215 488210118 /nfs/dbraw/zinc/21/01/18/488210118.db2.gz WPHRXMGOPMHGFU-UHFFFAOYSA-N 1 2 232.287 2.174 20 0 BEADLO Cc1cnc(C[NH2+]CCC(F)(F)F)o1 ZINC000231650906 488219400 /nfs/dbraw/zinc/21/94/00/488219400.db2.gz JNJFMAKCXQWIBM-UHFFFAOYSA-N 1 2 208.183 2.025 20 0 BEADLO CC[N@H+](Cc1cnn(C)c1)Cc1oc(C)nc1C ZINC000683898601 488240258 /nfs/dbraw/zinc/24/02/58/488240258.db2.gz PEKDRJWTBDMAJG-UHFFFAOYSA-N 1 2 248.330 2.047 20 0 BEADLO CC[N@@H+](Cc1cnn(C)c1)Cc1oc(C)nc1C ZINC000683898601 488240260 /nfs/dbraw/zinc/24/02/60/488240260.db2.gz PEKDRJWTBDMAJG-UHFFFAOYSA-N 1 2 248.330 2.047 20 0 BEADLO Fc1ccc(N2CCC[C@@H](n3cc[nH+]c3)C2)nc1 ZINC000672207640 488244724 /nfs/dbraw/zinc/24/47/24/488244724.db2.gz MYPSXAMQBDPQHV-GFCCVEGCSA-N 1 2 246.289 2.259 20 0 BEADLO CCCCNc1cc(NC2CC=CC2)nc(N)[nH+]1 ZINC000672236444 488247029 /nfs/dbraw/zinc/24/70/29/488247029.db2.gz UGHOOLUWSDTUFI-UHFFFAOYSA-N 1 2 247.346 2.401 20 0 BEADLO CCCCNc1cc(NC2CC=CC2)[nH+]c(N)n1 ZINC000672236444 488247032 /nfs/dbraw/zinc/24/70/32/488247032.db2.gz UGHOOLUWSDTUFI-UHFFFAOYSA-N 1 2 247.346 2.401 20 0 BEADLO Cc1nc(N2CC[C@@H](C(F)F)C2)c(C)c(C)[nH+]1 ZINC000672275276 488249509 /nfs/dbraw/zinc/24/95/09/488249509.db2.gz OHFIPNKZDIZWHH-SNVBAGLBSA-N 1 2 241.285 2.493 20 0 BEADLO COc1ccncc1C[N@@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000672553077 488259530 /nfs/dbraw/zinc/25/95/30/488259530.db2.gz ZNBKLAMHYMUTEY-JQWIXIFHSA-N 1 2 238.306 2.270 20 0 BEADLO COc1ccncc1C[N@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000672553077 488259532 /nfs/dbraw/zinc/25/95/32/488259532.db2.gz ZNBKLAMHYMUTEY-JQWIXIFHSA-N 1 2 238.306 2.270 20 0 BEADLO Cn1c[nH+]cc1CC(=O)NCCC1CCCCC1 ZINC000672741174 488265183 /nfs/dbraw/zinc/26/51/83/488265183.db2.gz UUFJQWZIRGDMEV-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO CC[C@H]1CCC[C@H](NC(=O)Cc2c[nH+]cn2C)C1 ZINC000672918930 488269007 /nfs/dbraw/zinc/26/90/07/488269007.db2.gz BCHMNQNMPJJCNR-RYUDHWBXSA-N 1 2 249.358 2.048 20 0 BEADLO Cc1noc([C@@H](C)[NH2+][C@H](C)c2cccc(O)c2)n1 ZINC000678761686 488279622 /nfs/dbraw/zinc/27/96/22/488279622.db2.gz YYUUPDZZIOBZGC-RKDXNWHRSA-N 1 2 247.298 2.495 20 0 BEADLO Cc1noc([C@@H](C)[NH2+][C@@H](C)c2cccc(O)c2)n1 ZINC000678761684 488280786 /nfs/dbraw/zinc/28/07/86/488280786.db2.gz YYUUPDZZIOBZGC-DTWKUNHWSA-N 1 2 247.298 2.495 20 0 BEADLO Fc1c[nH+]ccc1N1CCC[C@H](c2cc[nH]n2)C1 ZINC000678789169 488283181 /nfs/dbraw/zinc/28/31/81/488283181.db2.gz SNDFUOIMLHEWJP-JTQLQIEISA-N 1 2 246.289 2.328 20 0 BEADLO Fc1ccc(CCNc2cc[nH+]cc2F)cc1 ZINC000678788647 488283556 /nfs/dbraw/zinc/28/35/56/488283556.db2.gz LYBPEVUCKWAZLN-UHFFFAOYSA-N 1 2 234.249 2.436 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2c(C)noc2C)no1 ZINC000678804729 488285364 /nfs/dbraw/zinc/28/53/64/488285364.db2.gz RPMFWTOTTXLQIR-MRVPVSSYSA-N 1 2 235.287 2.439 20 0 BEADLO Cc1occc1C[NH2+]Cc1cn(C(C)C)nn1 ZINC000673600640 488296480 /nfs/dbraw/zinc/29/64/80/488296480.db2.gz BDNDNYPGEARIFF-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO Cn1cnc(C[NH2+][C@@H]2CSc3ccccc32)c1 ZINC000673602197 488297173 /nfs/dbraw/zinc/29/71/73/488297173.db2.gz SNJPIGMJCLIJTJ-GFCCVEGCSA-N 1 2 245.351 2.357 20 0 BEADLO FC1(C[N@@H+]2CCC[C@@H](c3ccn[nH]3)C2)CC1 ZINC000684357134 488300075 /nfs/dbraw/zinc/30/00/75/488300075.db2.gz XWLHIKFYLSYPSY-SNVBAGLBSA-N 1 2 223.295 2.091 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CCC[C@@H](OC)C1 ZINC000684391630 488304500 /nfs/dbraw/zinc/30/45/00/488304500.db2.gz CTDVXQBAHWNMRC-GHMZBOCLSA-N 1 2 236.315 2.460 20 0 BEADLO CCn1cc([C@@H](C)Nc2ccc(OC)c[nH+]2)cn1 ZINC000679069382 488305633 /nfs/dbraw/zinc/30/56/33/488305633.db2.gz HKHBIYMFSJKKDP-SNVBAGLBSA-N 1 2 246.314 2.480 20 0 BEADLO CCn1cc[nH+]c1CN[C@@H](C1CC1)C(F)(F)F ZINC000673722643 488306041 /nfs/dbraw/zinc/30/60/41/488306041.db2.gz KDKFSLSGBJPSSX-JTQLQIEISA-N 1 2 247.264 2.334 20 0 BEADLO FC1(F)CC[NH+](Cc2nccs2)CC1 ZINC000684428205 488306289 /nfs/dbraw/zinc/30/62/89/488306289.db2.gz BKAUQDFGBWYJFX-UHFFFAOYSA-N 1 2 218.272 2.374 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1cn2cccc(F)c2n1 ZINC000684411077 488309020 /nfs/dbraw/zinc/30/90/20/488309020.db2.gz FPLPUYGKFBMIDT-NXEZZACHSA-N 1 2 233.290 2.456 20 0 BEADLO c1cc(-c2noc(C[N@H+]3CC=CCC3)n2)co1 ZINC000679323596 488337083 /nfs/dbraw/zinc/33/70/83/488337083.db2.gz FCXYDLZJPWHESS-UHFFFAOYSA-N 1 2 231.255 2.092 20 0 BEADLO c1cc(-c2noc(C[N@@H+]3CC=CCC3)n2)co1 ZINC000679323596 488337086 /nfs/dbraw/zinc/33/70/86/488337086.db2.gz FCXYDLZJPWHESS-UHFFFAOYSA-N 1 2 231.255 2.092 20 0 BEADLO O=C(CCC(F)F)Nc1ccc2[nH+]ccn2c1 ZINC000684440480 488313337 /nfs/dbraw/zinc/31/33/37/488313337.db2.gz LIVOLDNVPCVDSN-UHFFFAOYSA-N 1 2 239.225 2.318 20 0 BEADLO CCn1cc[nH+]c1CN1CC[C@@H](C)[C@H](F)C1 ZINC000679228448 488322949 /nfs/dbraw/zinc/32/29/49/488322949.db2.gz XOGCEBRZHICYRJ-GHMZBOCLSA-N 1 2 225.311 2.083 20 0 BEADLO CCc1ccccc1NC(=O)C[N@H+]1CC=CCC1 ZINC000679324054 488337534 /nfs/dbraw/zinc/33/75/34/488337534.db2.gz MYPZEEPNRLPKGH-UHFFFAOYSA-N 1 2 244.338 2.449 20 0 BEADLO CCc1ccccc1NC(=O)C[N@@H+]1CC=CCC1 ZINC000679324054 488337536 /nfs/dbraw/zinc/33/75/36/488337536.db2.gz MYPZEEPNRLPKGH-UHFFFAOYSA-N 1 2 244.338 2.449 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]Cc1cccc(CO)c1 ZINC000679341034 488342177 /nfs/dbraw/zinc/34/21/77/488342177.db2.gz WBSAUJSYENUNDX-SNVBAGLBSA-N 1 2 245.326 2.061 20 0 BEADLO COc1ccc(N[C@@H](C)c2c[nH]nc2C)[nH+]c1 ZINC000679359613 488345713 /nfs/dbraw/zinc/34/57/13/488345713.db2.gz PFNJCDQJHFCNHE-QMMMGPOBSA-N 1 2 232.287 2.295 20 0 BEADLO CCCCNc1cc(N2CC[C@H](C)C2)nc(N)[nH+]1 ZINC000684839802 488348392 /nfs/dbraw/zinc/34/83/92/488348392.db2.gz SZXLWHRAJGSADY-JTQLQIEISA-N 1 2 249.362 2.117 20 0 BEADLO CCCCNc1cc(N2CC[C@H](C)C2)[nH+]c(N)n1 ZINC000684839802 488348393 /nfs/dbraw/zinc/34/83/93/488348393.db2.gz SZXLWHRAJGSADY-JTQLQIEISA-N 1 2 249.362 2.117 20 0 BEADLO c1coc(-c2nnc(C[N@H+]3CC=CCC3)o2)c1 ZINC000679322054 490113814 /nfs/dbraw/zinc/11/38/14/490113814.db2.gz SZJVRXLROALCRS-UHFFFAOYSA-N 1 2 231.255 2.092 20 0 BEADLO c1coc(-c2nnc(C[N@@H+]3CC=CCC3)o2)c1 ZINC000679322054 490113819 /nfs/dbraw/zinc/11/38/19/490113819.db2.gz SZJVRXLROALCRS-UHFFFAOYSA-N 1 2 231.255 2.092 20 0 BEADLO COC[C@H]([NH2+]Cc1cc(C)ccn1)c1ccco1 ZINC000683022491 490155323 /nfs/dbraw/zinc/15/53/23/490155323.db2.gz USTMUUUBJLJTSU-ZDUSSCGKSA-N 1 2 246.310 2.460 20 0 BEADLO CC(C)N(C(=O)C[C@H](C)n1cc[nH+]c1)C(C)C ZINC000649688613 490200216 /nfs/dbraw/zinc/20/02/16/490200216.db2.gz IOUMCCIKWPRZJD-LBPRGKRZSA-N 1 2 237.347 2.480 20 0 BEADLO Cc1ccnc(NCc2cc(C)[nH+]c(C)c2)n1 ZINC000515411234 490244030 /nfs/dbraw/zinc/24/40/30/490244030.db2.gz BVDDFWZWDCQJBU-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO CC[C@@H](Nc1ccc(C)nn1)c1[nH]cc[nH+]1 ZINC000125218886 490420014 /nfs/dbraw/zinc/42/00/14/490420014.db2.gz AJOIWXMZOZSQMU-SECBINFHSA-N 1 2 217.276 2.071 20 0 BEADLO Cc1cncc(NC(=O)CCCn2cc[nH+]c2)c1 ZINC000079581575 490453488 /nfs/dbraw/zinc/45/34/88/490453488.db2.gz HJEVAEDBTDRFQZ-UHFFFAOYSA-N 1 2 244.298 2.005 20 0 BEADLO CO[C@]1(C)C[C@H]([N@H+](C)CC(F)F)C1(C)C ZINC000076151941 490550889 /nfs/dbraw/zinc/55/08/89/490550889.db2.gz XNTPRFORDVFLST-GZMMTYOYSA-N 1 2 221.291 2.387 20 0 BEADLO CO[C@]1(C)C[C@H]([N@@H+](C)CC(F)F)C1(C)C ZINC000076151941 490550892 /nfs/dbraw/zinc/55/08/92/490550892.db2.gz XNTPRFORDVFLST-GZMMTYOYSA-N 1 2 221.291 2.387 20 0 BEADLO CO[C@@]1(C)C[C@@H]([N@H+](C)CC(F)F)C1(C)C ZINC000076151943 490550950 /nfs/dbraw/zinc/55/09/50/490550950.db2.gz XNTPRFORDVFLST-KCJUWKMLSA-N 1 2 221.291 2.387 20 0 BEADLO CO[C@@]1(C)C[C@@H]([N@@H+](C)CC(F)F)C1(C)C ZINC000076151943 490550953 /nfs/dbraw/zinc/55/09/53/490550953.db2.gz XNTPRFORDVFLST-KCJUWKMLSA-N 1 2 221.291 2.387 20 0 BEADLO CCc1cc(N[C@@H]2CCCSC2)nc[nH+]1 ZINC000129215986 490608540 /nfs/dbraw/zinc/60/85/40/490608540.db2.gz YGLNYHMEDQZLIO-SNVBAGLBSA-N 1 2 223.345 2.347 20 0 BEADLO C[C@H]1CC[C@@H]1NC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000672668757 490615960 /nfs/dbraw/zinc/61/59/60/490615960.db2.gz PIYSPQRGLJOZJA-ONGXEEELSA-N 1 2 244.298 2.254 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)Nc1ccccc1F ZINC000080526845 490641828 /nfs/dbraw/zinc/64/18/28/490641828.db2.gz DGVRAFXGRBWPBG-UHFFFAOYSA-N 1 2 248.261 2.213 20 0 BEADLO C[N@@H+](Cc1ccc(F)c(F)c1)Cc1cncnc1 ZINC000130446157 491075628 /nfs/dbraw/zinc/07/56/28/491075628.db2.gz HEEIULQMPGTEIL-UHFFFAOYSA-N 1 2 249.264 2.387 20 0 BEADLO COc1cccc(C[NH2+]Cc2ncc(C)o2)c1 ZINC000227084081 491054795 /nfs/dbraw/zinc/05/47/95/491054795.db2.gz NGBCATGVWNQTLH-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO C[N@H+](Cc1ccc(F)c(F)c1)Cc1cncnc1 ZINC000130446157 491075631 /nfs/dbraw/zinc/07/56/31/491075631.db2.gz HEEIULQMPGTEIL-UHFFFAOYSA-N 1 2 249.264 2.387 20 0 BEADLO C[C@@H](CC(=O)NCc1c[nH+]c[nH]1)CC(C)(C)C ZINC000088753604 491108308 /nfs/dbraw/zinc/10/83/08/491108308.db2.gz XIAPFAZWTGRRGE-JTQLQIEISA-N 1 2 237.347 2.488 20 0 BEADLO C[C@@H](CC(=O)NCc1c[nH]c[nH+]1)CC(C)(C)C ZINC000088753604 491108309 /nfs/dbraw/zinc/10/83/09/491108309.db2.gz XIAPFAZWTGRRGE-JTQLQIEISA-N 1 2 237.347 2.488 20 0 BEADLO CC[C@](C)(C[NH2+]C(C)(C)c1noc(C)n1)OC ZINC000638523378 491114261 /nfs/dbraw/zinc/11/42/61/491114261.db2.gz GAJZYYWMHRPJMX-GFCCVEGCSA-N 1 2 241.335 2.018 20 0 BEADLO Cc1cn2ccc(NC(=O)N3CCCC3)cc2[nH+]1 ZINC000668150276 491117226 /nfs/dbraw/zinc/11/72/26/491117226.db2.gz ULQRKQAPESKPPC-UHFFFAOYSA-N 1 2 244.298 2.270 20 0 BEADLO CC(C)(C)C[C@@H]1C[C@H]1NC(=O)CCn1cc[nH+]c1 ZINC000650392843 491121943 /nfs/dbraw/zinc/12/19/43/491121943.db2.gz KNDKELCANAURBO-NWDGAFQWSA-N 1 2 249.358 2.214 20 0 BEADLO Cc1cnc(C[NH2+]Cc2ccc(C)c(C)n2)o1 ZINC000639270943 491122735 /nfs/dbraw/zinc/12/27/35/491122735.db2.gz INLOTGMGXQOCOC-UHFFFAOYSA-N 1 2 231.299 2.285 20 0 BEADLO C[C@@H](Nc1ncnc2c1CCCC2)c1[nH]cc[nH+]1 ZINC000139855734 491123600 /nfs/dbraw/zinc/12/36/00/491123600.db2.gz NZMXDUJWOUYPSD-SECBINFHSA-N 1 2 243.314 2.252 20 0 BEADLO COc1ccsc1CNc1c[nH]c[nH+]1 ZINC000306210576 491125712 /nfs/dbraw/zinc/12/57/12/491125712.db2.gz ITXNKSAYEZYCAZ-UHFFFAOYSA-N 1 2 209.274 2.092 20 0 BEADLO C[C@H]1CN(C(=O)CCCn2cc[nH+]c2)CC[C@@H]1C ZINC000132886703 491141532 /nfs/dbraw/zinc/14/15/32/491141532.db2.gz AUEPULOMWNZUBX-STQMWFEESA-N 1 2 249.358 2.168 20 0 BEADLO Cc1cnc([C@@H](C)NCc2cn(C)c[nH+]2)s1 ZINC000309416579 491148964 /nfs/dbraw/zinc/14/89/64/491148964.db2.gz GZBBLUFYOBEPNP-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+]Cc2cn(C)cn2)s1 ZINC000309416579 491148965 /nfs/dbraw/zinc/14/89/65/491148965.db2.gz GZBBLUFYOBEPNP-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO COC(=O)[C@@H]1CCC[C@@H]([NH+]2CC(C)(F)C2)CC1 ZINC001172779042 974938382 /nfs/dbraw/zinc/93/83/82/974938382.db2.gz ADVJAYVPGJIHQJ-GHMZBOCLSA-N 1 2 243.322 2.152 20 0 BEADLO COC(=O)[C@H]1CCC[C@@H]([NH+]2CC(C)(F)C2)CC1 ZINC001172779046 974939401 /nfs/dbraw/zinc/93/94/01/974939401.db2.gz ADVJAYVPGJIHQJ-WDEREUQCSA-N 1 2 243.322 2.152 20 0 BEADLO C[C@@H]1CCC[C@@H](C)C1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492812138 533726258 /nfs/dbraw/zinc/72/62/58/533726258.db2.gz MBAQQRWNEHEALJ-GYHQZXBOSA-N 1 2 247.342 2.364 20 0 BEADLO C[C@H]1CC[C@H](NC(=O)/C=C/c2[nH]cc[nH+]2)CC1 ZINC000493293806 533754130 /nfs/dbraw/zinc/75/41/30/533754130.db2.gz LWKXNQZPHDUKEY-GLJYJBGDSA-N 1 2 233.315 2.118 20 0 BEADLO C[C@@H]1CCN(C(=O)/C=C/c2[nH]cc[nH+]2)C[C@@H](C)C1 ZINC000493592346 533911289 /nfs/dbraw/zinc/91/12/89/533911289.db2.gz RBNCQTPJMYMHTP-LXYZTQFVSA-N 1 2 247.342 2.318 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)/C=C\C2CCCC2)S1 ZINC000493049081 534004316 /nfs/dbraw/zinc/00/43/16/534004316.db2.gz MZEDEKLKZYDMPM-NMTCXDENSA-N 1 2 238.356 2.340 20 0 BEADLO COc1ccc(NC(=O)C=Cc2c[nH]c[nH+]2)cc1 ZINC000493550520 534027918 /nfs/dbraw/zinc/02/79/18/534027918.db2.gz IVAVRZWHNUZROK-DAXSKMNVSA-N 1 2 243.266 2.070 20 0 BEADLO COC(=O)NCCNc1ccc2ccccc2[nH+]1 ZINC000308345006 534123129 /nfs/dbraw/zinc/12/31/29/534123129.db2.gz UMWWBCUOFMRQSW-UHFFFAOYSA-N 1 2 245.282 2.003 20 0 BEADLO C[C@@H]1CC2(CCC2)CN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492856264 534152723 /nfs/dbraw/zinc/15/27/23/534152723.db2.gz BLBCSHZLKITXSD-DLRQAJBASA-N 1 2 245.326 2.214 20 0 BEADLO COc1ccc(C[N@@H+]2C[C@H](C)OC(C)(C)C2)o1 ZINC000891797937 582722815 /nfs/dbraw/zinc/72/28/15/582722815.db2.gz MHZDFTLKVOLDOM-JTQLQIEISA-N 1 2 239.315 2.288 20 0 BEADLO COc1ccc(C[N@H+]2C[C@H](C)OC(C)(C)C2)o1 ZINC000891797937 582722816 /nfs/dbraw/zinc/72/28/16/582722816.db2.gz MHZDFTLKVOLDOM-JTQLQIEISA-N 1 2 239.315 2.288 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)/C=C/[C@H]1CCOC1 ZINC000493136249 534386788 /nfs/dbraw/zinc/38/67/88/534386788.db2.gz DBDSXUVWWPDIST-PCAWENJQSA-N 1 2 246.310 2.230 20 0 BEADLO c1ccc(NCCC[C@@H]2CCOC2)[nH+]c1 ZINC000402218790 534497663 /nfs/dbraw/zinc/49/76/63/534497663.db2.gz NWYXHSOYSJVJCZ-LLVKDONJSA-N 1 2 206.289 2.310 20 0 BEADLO CCCCC1(NC(=O)CCc2c[nH+]c[nH]2)CC1 ZINC000889528246 582820513 /nfs/dbraw/zinc/82/05/13/582820513.db2.gz CGFNRJLROIIDTR-UHFFFAOYSA-N 1 2 235.331 2.181 20 0 BEADLO CCCCC1(NC(=O)CCc2c[nH]c[nH+]2)CC1 ZINC000889528246 582820517 /nfs/dbraw/zinc/82/05/17/582820517.db2.gz CGFNRJLROIIDTR-UHFFFAOYSA-N 1 2 235.331 2.181 20 0 BEADLO COc1ccc(NCC2(SC)CC2)[nH+]c1 ZINC000234976017 582821865 /nfs/dbraw/zinc/82/18/65/582821865.db2.gz SNDPOVLKRNNQRZ-UHFFFAOYSA-N 1 2 224.329 2.398 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)N1CC[C@@H]2CCCC[C@@H]21 ZINC000493246573 534787118 /nfs/dbraw/zinc/78/71/18/534787118.db2.gz BGZYMXSBJNYTST-WTIVYXKASA-N 1 2 245.326 2.214 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)Nc1ccc(Cl)nc1 ZINC000493364359 534804946 /nfs/dbraw/zinc/80/49/46/534804946.db2.gz DEZXRAJSCYRFDL-RQOWECAXSA-N 1 2 248.673 2.110 20 0 BEADLO Cc1ccc(-c2noc([C@@H]3CSC[NH2+]3)n2)cc1 ZINC000229002784 525884529 /nfs/dbraw/zinc/88/45/29/525884529.db2.gz HPCKKZXRBSIPBY-JTQLQIEISA-N 1 2 247.323 2.380 20 0 BEADLO CC1(C)C[C@H]1C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000347997258 534902938 /nfs/dbraw/zinc/90/29/38/534902938.db2.gz RIMGQICJISLHFJ-VHSXEESVSA-N 1 2 233.315 2.119 20 0 BEADLO CCc1cc(NCC2(C)COC2)nc(CC)[nH+]1 ZINC000892505761 582901069 /nfs/dbraw/zinc/90/10/69/582901069.db2.gz JSPJPEBWXHPLOG-UHFFFAOYSA-N 1 2 235.331 2.050 20 0 BEADLO CC(C)(C)C(C)(C)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492901611 527617616 /nfs/dbraw/zinc/61/76/16/527617616.db2.gz ZDQNULOFGJNODJ-VOTSOKGWSA-N 1 2 235.331 2.364 20 0 BEADLO CC(C)(C)CCCC(=O)NCCc1[nH]cc[nH+]1 ZINC000174765048 527656202 /nfs/dbraw/zinc/65/62/02/527656202.db2.gz UVUDQVRHDOYJKA-UHFFFAOYSA-N 1 2 237.347 2.285 20 0 BEADLO CC(C)CC1(CNC(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000492903744 527689929 /nfs/dbraw/zinc/68/99/29/527689929.db2.gz USVPPPBOKQGHEG-ARJAWSKDSA-N 1 2 247.342 2.365 20 0 BEADLO CCCN(C(=O)C=Cc1c[nH]c[nH+]1)C(C)C ZINC000493616670 527719222 /nfs/dbraw/zinc/71/92/22/527719222.db2.gz TYVAQLPNOXZYBX-AATRIKPKSA-N 1 2 221.304 2.070 20 0 BEADLO CCC1(NC(=O)/C=C/c2[nH]cc[nH+]2)CCCC1 ZINC000493097527 527770756 /nfs/dbraw/zinc/77/07/56/527770756.db2.gz XRUVPDJNFQQYFO-AATRIKPKSA-N 1 2 233.315 2.262 20 0 BEADLO CC(C)OC(=O)N[C@H](c1[nH+]ccn1C)C1CC1 ZINC000496764742 527829289 /nfs/dbraw/zinc/82/92/89/527829289.db2.gz BQBDPOCOECOGCH-JTQLQIEISA-N 1 2 237.303 2.006 20 0 BEADLO CCCN(CC(C)C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492869874 527918195 /nfs/dbraw/zinc/91/81/95/527918195.db2.gz ZQPVAOCLBGWPRZ-WAYWQWQTSA-N 1 2 235.331 2.318 20 0 BEADLO CC1(NC(=O)/C=C/c2[nH]cc[nH+]2)CCCCC1 ZINC000493717778 528018940 /nfs/dbraw/zinc/01/89/40/528018940.db2.gz FFLJXYJGKFYBCU-AATRIKPKSA-N 1 2 233.315 2.262 20 0 BEADLO CC1(NC(=O)C=Cc2c[nH]c[nH+]2)CCCCC1 ZINC000493428598 528019010 /nfs/dbraw/zinc/01/90/10/528019010.db2.gz WPGDEIFQZHIXBL-WAYWQWQTSA-N 1 2 233.315 2.262 20 0 BEADLO CC(C)C[C@@H]1CCN(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493108567 528382363 /nfs/dbraw/zinc/38/23/63/528382363.db2.gz SLOYJROVWHYYOC-PCAWENJQSA-N 1 2 247.342 2.318 20 0 BEADLO CCC(C)(C)N(C)C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493568018 528536727 /nfs/dbraw/zinc/53/67/27/528536727.db2.gz NLAZVVDNWCTKIL-VOTSOKGWSA-N 1 2 221.304 2.070 20 0 BEADLO CCO/C=C\C(=O)Nc1ccc(C)[nH+]c1C ZINC000492963626 528539769 /nfs/dbraw/zinc/53/97/69/528539769.db2.gz RXICXEMOODUMJF-FPLPWBNLSA-N 1 2 220.272 2.187 20 0 BEADLO CCCC[C@H](C)N(C)C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493195629 528886945 /nfs/dbraw/zinc/88/69/45/528886945.db2.gz VXHYQTWHNBVKHA-AEZGRPFRSA-N 1 2 235.331 2.460 20 0 BEADLO CCN(C(=O)/C=C/c1[nH]cc[nH+]1)[C@H](C)C(C)C ZINC000493233695 528907634 /nfs/dbraw/zinc/90/76/34/528907634.db2.gz OAMJLBDNZKAGPQ-XUIVZRPNSA-N 1 2 235.331 2.316 20 0 BEADLO CCN(C(=O)C=Cc1c[nH]c[nH+]1)[C@H](C)C(C)C ZINC000493416300 528908327 /nfs/dbraw/zinc/90/83/27/528908327.db2.gz HMXGLHKMQAODCW-XUIVZRPNSA-N 1 2 235.331 2.316 20 0 BEADLO CC1(C)CCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493609906 528923493 /nfs/dbraw/zinc/92/34/93/528923493.db2.gz IWDNQNRKRGDTEX-PLNGDYQASA-N 1 2 233.315 2.072 20 0 BEADLO CC(C)[C@H](C)N(C(=O)C=Cc1c[nH]c[nH+]1)C1CC1 ZINC000492767659 528950905 /nfs/dbraw/zinc/95/09/05/528950905.db2.gz NUZQYCQTCBOVJT-IBHLPDHGSA-N 1 2 247.342 2.458 20 0 BEADLO CC[C@@H]1CCC[C@@H]1CNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493066200 529307386 /nfs/dbraw/zinc/30/73/86/529307386.db2.gz RXTURYDQOLSWIF-BYAJROORSA-N 1 2 247.342 2.365 20 0 BEADLO CC[C@@H]1CC[C@H](C)N(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493512793 529340621 /nfs/dbraw/zinc/34/06/21/529340621.db2.gz GMKALJFZKJOCOM-FNSAGKMKSA-N 1 2 247.342 2.460 20 0 BEADLO CC1(C)C[S@@](=O)CC[N@@H+]1Cc1ccccc1 ZINC000336061772 534941304 /nfs/dbraw/zinc/94/13/04/534941304.db2.gz DYCOAVIIBOWHOM-INIZCTEOSA-N 1 2 237.368 2.030 20 0 BEADLO CC1(C)C[S@@](=O)CC[N@H+]1Cc1ccccc1 ZINC000336061772 534941310 /nfs/dbraw/zinc/94/13/10/534941310.db2.gz DYCOAVIIBOWHOM-INIZCTEOSA-N 1 2 237.368 2.030 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CCC23CCC3)n1C ZINC000334168884 534970710 /nfs/dbraw/zinc/97/07/10/534970710.db2.gz ASOUTMVZLLHSGD-UHFFFAOYSA-N 1 2 234.347 2.067 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CCC23CCC3)n1C ZINC000334168884 534970713 /nfs/dbraw/zinc/97/07/13/534970713.db2.gz ASOUTMVZLLHSGD-UHFFFAOYSA-N 1 2 234.347 2.067 20 0 BEADLO CC(C)[N@H+](Cc1cc[nH]n1)Cc1cccnc1 ZINC000349275300 535087556 /nfs/dbraw/zinc/08/75/56/535087556.db2.gz GRSXMSUMNWKKAK-UHFFFAOYSA-N 1 2 230.315 2.215 20 0 BEADLO CC(C)[N@@H+](Cc1cc[nH]n1)Cc1cccnc1 ZINC000349275300 535087563 /nfs/dbraw/zinc/08/75/63/535087563.db2.gz GRSXMSUMNWKKAK-UHFFFAOYSA-N 1 2 230.315 2.215 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCO[C@H](C)[C@@H]1C ZINC000335307605 535146856 /nfs/dbraw/zinc/14/68/56/535146856.db2.gz VYSGKFPBKAXGRB-NWDGAFQWSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCO[C@H](C)[C@@H]1C ZINC000335307605 535146859 /nfs/dbraw/zinc/14/68/59/535146859.db2.gz VYSGKFPBKAXGRB-NWDGAFQWSA-N 1 2 237.347 2.073 20 0 BEADLO CC1(C)CCCC[C@H]1C(=O)NCc1c[nH+]c[nH]1 ZINC000226627777 535294175 /nfs/dbraw/zinc/29/41/75/535294175.db2.gz KZESDALDBBDBCC-NSHDSACASA-N 1 2 235.331 2.242 20 0 BEADLO CC1(C)CCCC[C@H]1C(=O)NCc1c[nH]c[nH+]1 ZINC000226627777 535294180 /nfs/dbraw/zinc/29/41/80/535294180.db2.gz KZESDALDBBDBCC-NSHDSACASA-N 1 2 235.331 2.242 20 0 BEADLO CC[C@@H]([NH2+]Cc1c(C)noc1C)c1ccn(C)n1 ZINC000349457818 535805147 /nfs/dbraw/zinc/80/51/47/535805147.db2.gz PCDPCMAUESPFKZ-GFCCVEGCSA-N 1 2 248.330 2.266 20 0 BEADLO CCc1noc([C@H](C)[N@@H+]2CC[C@@](C)(F)C2)n1 ZINC000335940435 535899191 /nfs/dbraw/zinc/89/91/91/535899191.db2.gz HPNULLPGYSWVML-GZMMTYOYSA-N 1 2 227.283 2.127 20 0 BEADLO CCc1noc([C@H](C)[N@H+]2CC[C@@](C)(F)C2)n1 ZINC000335940435 535899195 /nfs/dbraw/zinc/89/91/95/535899195.db2.gz HPNULLPGYSWVML-GZMMTYOYSA-N 1 2 227.283 2.127 20 0 BEADLO CC[C@]1(C)COCC[N@@H+]1Cc1cncc(F)c1 ZINC000336121623 535924456 /nfs/dbraw/zinc/92/44/56/535924456.db2.gz VQLAEEPEJOCICV-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO CC[C@]1(C)COCC[N@H+]1Cc1cncc(F)c1 ZINC000336121623 535924460 /nfs/dbraw/zinc/92/44/60/535924460.db2.gz VQLAEEPEJOCICV-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO CCc1nc(N2C[C@@H](C)O[C@H](CC)C2)cc(C)[nH+]1 ZINC000342228243 536126568 /nfs/dbraw/zinc/12/65/68/536126568.db2.gz WRHGWJVIIRMCJS-VXGBXAGGSA-N 1 2 249.358 2.351 20 0 BEADLO COC(=O)C(C)(C)[N@H+](C)Cc1cccs1 ZINC000258728456 536427532 /nfs/dbraw/zinc/42/75/32/536427532.db2.gz GUUCSLLGZIGLGS-UHFFFAOYSA-N 1 2 227.329 2.132 20 0 BEADLO COC(=O)C(C)(C)[N@@H+](C)Cc1cccs1 ZINC000258728456 536427535 /nfs/dbraw/zinc/42/75/35/536427535.db2.gz GUUCSLLGZIGLGS-UHFFFAOYSA-N 1 2 227.329 2.132 20 0 BEADLO C[N@H+](Cc1csnn1)C1CC(C)(C)C1 ZINC000335658168 536486016 /nfs/dbraw/zinc/48/60/16/536486016.db2.gz XELJORCHOHGCQI-UHFFFAOYSA-N 1 2 211.334 2.159 20 0 BEADLO C[N@@H+](Cc1csnn1)C1CC(C)(C)C1 ZINC000335658168 536486017 /nfs/dbraw/zinc/48/60/17/536486017.db2.gz XELJORCHOHGCQI-UHFFFAOYSA-N 1 2 211.334 2.159 20 0 BEADLO CC[C@H](NC(=O)CCc1c[nH+]c[nH]1)C(C)(C)C ZINC000353336063 566474741 /nfs/dbraw/zinc/47/47/41/566474741.db2.gz LFKWMUDKACLFLL-NSHDSACASA-N 1 2 237.347 2.283 20 0 BEADLO CC[C@H](NC(=O)CCc1c[nH]c[nH+]1)C(C)(C)C ZINC000353336063 566474751 /nfs/dbraw/zinc/47/47/51/566474751.db2.gz LFKWMUDKACLFLL-NSHDSACASA-N 1 2 237.347 2.283 20 0 BEADLO C[C@H](O)c1cccc(N[C@H]2CCSC2)[nH+]1 ZINC000892702675 582960656 /nfs/dbraw/zinc/96/06/56/582960656.db2.gz GODTZHDYFAHZCS-IUCAKERBSA-N 1 2 224.329 2.052 20 0 BEADLO CSC(C)(C)CNc1cc(N(C)C)nc[nH+]1 ZINC000892745920 582975248 /nfs/dbraw/zinc/97/52/48/582975248.db2.gz UJFQATWHOPBVCL-UHFFFAOYSA-N 1 2 240.376 2.096 20 0 BEADLO CSC(C)(C)CNc1cc(N(C)C)[nH+]cn1 ZINC000892745920 582975251 /nfs/dbraw/zinc/97/52/51/582975251.db2.gz UJFQATWHOPBVCL-UHFFFAOYSA-N 1 2 240.376 2.096 20 0 BEADLO CN(C)c1cc(NCC2(C)CCC2)[nH+]cn1 ZINC000892847845 582994709 /nfs/dbraw/zinc/99/47/09/582994709.db2.gz QWERHHSMASTCHQ-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO CN(C)c1cc(NCC2(C)CCC2)nc[nH+]1 ZINC000892847845 582994712 /nfs/dbraw/zinc/99/47/12/582994712.db2.gz QWERHHSMASTCHQ-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO COC(OC)[C@H](C)Nc1cc[nH+]c(C(C)C)n1 ZINC000853681991 583061376 /nfs/dbraw/zinc/06/13/76/583061376.db2.gz YEEUQQTYZAXVPQ-VIFPVBQESA-N 1 2 239.319 2.019 20 0 BEADLO COC[C@H]([NH3+])c1nc([C@H]2CCC[C@@H](C)C2)no1 ZINC000220115459 583176234 /nfs/dbraw/zinc/17/62/34/583176234.db2.gz PPFVIYZVEXINHV-UTLUCORTSA-N 1 2 239.319 2.010 20 0 BEADLO CCO[C@@H]1CCC[N@H+](Cc2n[nH]c(C)c2C)C1 ZINC000893864231 583234637 /nfs/dbraw/zinc/23/46/37/583234637.db2.gz UTCFIANEQDRBRA-GFCCVEGCSA-N 1 2 237.347 2.027 20 0 BEADLO CCO[C@@H]1CCC[N@@H+](Cc2n[nH]c(C)c2C)C1 ZINC000893864231 583234640 /nfs/dbraw/zinc/23/46/40/583234640.db2.gz UTCFIANEQDRBRA-GFCCVEGCSA-N 1 2 237.347 2.027 20 0 BEADLO Cc1coc(C[N@H+]2C[C@@H](C)OC[C@H]2C)c1 ZINC000893953836 583261099 /nfs/dbraw/zinc/26/10/99/583261099.db2.gz ZSMZHLPFCIOZPC-GHMZBOCLSA-N 1 2 209.289 2.197 20 0 BEADLO Cc1coc(C[N@@H+]2C[C@@H](C)OC[C@H]2C)c1 ZINC000893953836 583261100 /nfs/dbraw/zinc/26/11/00/583261100.db2.gz ZSMZHLPFCIOZPC-GHMZBOCLSA-N 1 2 209.289 2.197 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CCCC2(C)C)c1C ZINC000893985333 583269163 /nfs/dbraw/zinc/26/91/63/583269163.db2.gz BPQOWVGKTWCFTF-UHFFFAOYSA-N 1 2 207.321 2.401 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CCCC2(C)C)c1C ZINC000893985333 583269164 /nfs/dbraw/zinc/26/91/64/583269164.db2.gz BPQOWVGKTWCFTF-UHFFFAOYSA-N 1 2 207.321 2.401 20 0 BEADLO Cc1cccc(CCCNc2cc(F)ncn2)[nH+]1 ZINC000853609212 588750484 /nfs/dbraw/zinc/75/04/84/588750484.db2.gz LWSFGSTZKDWELL-UHFFFAOYSA-N 1 2 246.289 2.364 20 0 BEADLO Cc1ncoc1CNc1cc[nH+]c(C2CC2)n1 ZINC000853640495 588751539 /nfs/dbraw/zinc/75/15/39/588751539.db2.gz IXQVIQTULFJUON-UHFFFAOYSA-N 1 2 230.271 2.263 20 0 BEADLO CC(C)c1nccc(NCc2ccc[nH+]c2N)n1 ZINC000853658726 588752895 /nfs/dbraw/zinc/75/28/95/588752895.db2.gz SSCXPBXBZZJTDH-UHFFFAOYSA-N 1 2 243.314 2.189 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OC[C@@H]1CCCC[C@@H]1C ZINC000853673126 588754688 /nfs/dbraw/zinc/75/46/88/588754688.db2.gz AZPKVQMZYSLDPB-AXFHLTTASA-N 1 2 228.336 2.346 20 0 BEADLO CC[C@@H](CO[NH+]=C(N)[C@H](C)OC)CC(F)F ZINC000853674340 588754935 /nfs/dbraw/zinc/75/49/35/588754935.db2.gz WQXNGSCIRYONQO-JGVFFNPUSA-N 1 2 238.278 2.201 20 0 BEADLO CCc1cc(NCc2cnc(Cl)cn2)nc[nH+]1 ZINC000853685674 588755814 /nfs/dbraw/zinc/75/58/14/588755814.db2.gz ZVVDJEJGPHQAKK-UHFFFAOYSA-N 1 2 249.705 2.095 20 0 BEADLO CC(C)(C)OCC(N)=[NH+]OCC1(C)CCC1 ZINC000853688643 588756659 /nfs/dbraw/zinc/75/66/59/588756659.db2.gz RQKMGZPWLHDIIU-UHFFFAOYSA-N 1 2 228.336 2.490 20 0 BEADLO NC(=[NH+]OCC12CCC(CC1)C2)[C@H]1CCCO1 ZINC000853698402 588757574 /nfs/dbraw/zinc/75/75/74/588757574.db2.gz QLDWTOOKGYFJLM-QWKFWESOSA-N 1 2 238.331 2.244 20 0 BEADLO NC(=[NH+]OC[C@@H]1CC[C@@H]2C[C@@H]2C1)[C@H]1CCCO1 ZINC000853698377 588757695 /nfs/dbraw/zinc/75/76/95/588757695.db2.gz PNMDTAUSGKEYLL-WISYIIOYSA-N 1 2 238.331 2.100 20 0 BEADLO CC(C)c1nc(N[C@H]2C[C@@H](O)C23CCC3)cc[nH+]1 ZINC000853870250 588766821 /nfs/dbraw/zinc/76/68/21/588766821.db2.gz JLWLTAVRYJEEDW-WDEREUQCSA-N 1 2 247.342 2.315 20 0 BEADLO CC(C)c1nc(N2CC[C@H]3COC[C@H]3C2)cc[nH+]1 ZINC000853934491 588769726 /nfs/dbraw/zinc/76/97/26/588769726.db2.gz RHJDKORWFYMUHZ-NWDGAFQWSA-N 1 2 247.342 2.073 20 0 BEADLO CC(C)c1nc(N2C[C@H](C)[C@](C)(CO)C2)cc[nH+]1 ZINC000853965216 588770380 /nfs/dbraw/zinc/77/03/80/588770380.db2.gz VMHVZRTVSCWFEG-FZMZJTMJSA-N 1 2 249.358 2.055 20 0 BEADLO C[C@H](c1ccccc1)N(C)C(=O)Cc1[nH]cc[nH+]1 ZINC000854324171 588783517 /nfs/dbraw/zinc/78/35/17/588783517.db2.gz RVVFXRROFUWSPJ-LLVKDONJSA-N 1 2 243.310 2.172 20 0 BEADLO CC1=CC[C@@](C)(C(=O)NCc2c[nH+]cn2C)CC1 ZINC000854499018 588789483 /nfs/dbraw/zinc/78/94/83/588789483.db2.gz PUGHUKMXWHJVIT-CQSZACIVSA-N 1 2 247.342 2.173 20 0 BEADLO CCC(C)=C(C)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000854594311 588796301 /nfs/dbraw/zinc/79/63/01/588796301.db2.gz ITSWNIDPEVGZBR-AAXQSMANSA-N 1 2 221.304 2.333 20 0 BEADLO CC/C(C)=C(\C)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000854594311 588796302 /nfs/dbraw/zinc/79/63/02/588796302.db2.gz ITSWNIDPEVGZBR-AAXQSMANSA-N 1 2 221.304 2.333 20 0 BEADLO Cn1cnn(C[N@@H+]2CCCC(C)(C)C2)c1=S ZINC000112695192 588812783 /nfs/dbraw/zinc/81/27/83/588812783.db2.gz DQGMEFFHWBXPHC-UHFFFAOYSA-N 1 2 240.376 2.031 20 0 BEADLO Cn1cnn(C[N@H+]2CCCC(C)(C)C2)c1=S ZINC000112695192 588812784 /nfs/dbraw/zinc/81/27/84/588812784.db2.gz DQGMEFFHWBXPHC-UHFFFAOYSA-N 1 2 240.376 2.031 20 0 BEADLO C/C(=C/C(=O)N(C)Cc1c[nH+]c[nH]1)C(C)(C)C ZINC000855135733 588823093 /nfs/dbraw/zinc/82/30/93/588823093.db2.gz VBWYUCVCUCUOQV-POHAHGRESA-N 1 2 235.331 2.361 20 0 BEADLO C/C(=C/C(=O)N(C)Cc1c[nH]c[nH+]1)C(C)(C)C ZINC000855135733 588823094 /nfs/dbraw/zinc/82/30/94/588823094.db2.gz VBWYUCVCUCUOQV-POHAHGRESA-N 1 2 235.331 2.361 20 0 BEADLO C[C@@H]1CC(CNC(=O)Cc2[nH]cc[nH+]2)C[C@@H](C)C1 ZINC000855394912 588831074 /nfs/dbraw/zinc/83/10/74/588831074.db2.gz PDMYWQLODYSZFP-QWRGUYRKSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@H]1CC(CNC(=O)Cc2[nH]cc[nH+]2)C[C@H](C)C1 ZINC000855394911 588831135 /nfs/dbraw/zinc/83/11/35/588831135.db2.gz PDMYWQLODYSZFP-GHMZBOCLSA-N 1 2 249.358 2.141 20 0 BEADLO Cc1cc(N2CC[C@H]3C[C@H]32)nc(C2CC2)[nH+]1 ZINC000804689350 582526912 /nfs/dbraw/zinc/52/69/12/582526912.db2.gz NOHRLBFEQZLWLJ-WDEREUQCSA-N 1 2 215.300 2.261 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC1(C)C(C)(C)C1(C)C ZINC000891163199 582617683 /nfs/dbraw/zinc/61/76/83/582617683.db2.gz RBFOCLLBRMDCGK-UHFFFAOYSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)NC1(C)C(C)(C)C1(C)C ZINC000891163199 582617684 /nfs/dbraw/zinc/61/76/84/582617684.db2.gz RBFOCLLBRMDCGK-UHFFFAOYSA-N 1 2 249.358 2.202 20 0 BEADLO CCc1cc(N2CCCC2)nc(CC)[nH+]1 ZINC000891393494 582676839 /nfs/dbraw/zinc/67/68/39/582676839.db2.gz GVGVCLJCUJETOF-UHFFFAOYSA-N 1 2 205.305 2.202 20 0 BEADLO COc1cccc2c[nH+]c(NC[C@H](C)O)cc21 ZINC000891435922 582684602 /nfs/dbraw/zinc/68/46/02/582684602.db2.gz IBXBUEXUXZBUAH-VIFPVBQESA-N 1 2 232.283 2.036 20 0 BEADLO C[C@H]1C[N@H+](Cc2nccc3c2CCCC3)CCO1 ZINC000891542122 582695488 /nfs/dbraw/zinc/69/54/88/582695488.db2.gz IKKMUXOEJQALDX-LBPRGKRZSA-N 1 2 246.354 2.181 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nccc3c2CCCC3)CCO1 ZINC000891542122 582695489 /nfs/dbraw/zinc/69/54/89/582695489.db2.gz IKKMUXOEJQALDX-LBPRGKRZSA-N 1 2 246.354 2.181 20 0 BEADLO CCc1[nH]nc(Cl)c1C[N@H+](CC)CCOC ZINC000891585129 582699633 /nfs/dbraw/zinc/69/96/33/582699633.db2.gz YAWCIBLHDDBIMT-UHFFFAOYSA-N 1 2 245.754 2.094 20 0 BEADLO CCc1[nH]nc(Cl)c1C[N@@H+](CC)CCOC ZINC000891585129 582699634 /nfs/dbraw/zinc/69/96/34/582699634.db2.gz YAWCIBLHDDBIMT-UHFFFAOYSA-N 1 2 245.754 2.094 20 0 BEADLO Cc1cc(NC(C)(C)CO)nc(C2CCC2)[nH+]1 ZINC000891592121 582700448 /nfs/dbraw/zinc/70/04/48/582700448.db2.gz NMSFEABRQLNUKF-UHFFFAOYSA-N 1 2 235.331 2.235 20 0 BEADLO Cc1cc(F)ncc1C[N@H+]1C[C@@H](C)OC[C@@H]1C ZINC000891672621 582708539 /nfs/dbraw/zinc/70/85/39/582708539.db2.gz WMVCGSCPBXHPTB-WDEREUQCSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1cc(F)ncc1C[N@@H+]1C[C@@H](C)OC[C@@H]1C ZINC000891672621 582708543 /nfs/dbraw/zinc/70/85/43/582708543.db2.gz WMVCGSCPBXHPTB-WDEREUQCSA-N 1 2 238.306 2.138 20 0 BEADLO CCOc1ccc(C[N@@H+]2C[C@H](C)OC[C@H]2C)o1 ZINC000891672348 582708655 /nfs/dbraw/zinc/70/86/55/582708655.db2.gz VRZAPJGYGXPWFW-MNOVXSKESA-N 1 2 239.315 2.288 20 0 BEADLO CCOc1ccc(C[N@H+]2C[C@H](C)OC[C@H]2C)o1 ZINC000891672348 582708656 /nfs/dbraw/zinc/70/86/56/582708656.db2.gz VRZAPJGYGXPWFW-MNOVXSKESA-N 1 2 239.315 2.288 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1ccnn1C1CCC1 ZINC000891669235 582709011 /nfs/dbraw/zinc/70/90/11/582709011.db2.gz AQRNTASXVNPYCQ-NEPJUHHUSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccnn1C1CCC1 ZINC000891669235 582709012 /nfs/dbraw/zinc/70/90/12/582709012.db2.gz AQRNTASXVNPYCQ-NEPJUHHUSA-N 1 2 249.358 2.217 20 0 BEADLO CC1(C)C[N@H+](Cc2ccnn2C2CCC2)CCO1 ZINC000891704858 582711500 /nfs/dbraw/zinc/71/15/00/582711500.db2.gz AMHOFPZHVHPGNP-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO CC1(C)C[N@@H+](Cc2ccnn2C2CCC2)CCO1 ZINC000891704858 582711502 /nfs/dbraw/zinc/71/15/02/582711502.db2.gz AMHOFPZHVHPGNP-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1cnn(C2CCC2)c1 ZINC000891715811 582712794 /nfs/dbraw/zinc/71/27/94/582712794.db2.gz HBFYVTSAANDRKY-ZDUSSCGKSA-N 1 2 249.358 2.219 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1cnn(C2CCC2)c1 ZINC000891715811 582712795 /nfs/dbraw/zinc/71/27/95/582712795.db2.gz HBFYVTSAANDRKY-ZDUSSCGKSA-N 1 2 249.358 2.219 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1cnc(F)c(C)c1 ZINC000891716566 582712840 /nfs/dbraw/zinc/71/28/40/582712840.db2.gz SNHSKXFSMJPVLI-GFCCVEGCSA-N 1 2 238.306 2.140 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1cnc(F)c(C)c1 ZINC000891716566 582712841 /nfs/dbraw/zinc/71/28/41/582712841.db2.gz SNHSKXFSMJPVLI-GFCCVEGCSA-N 1 2 238.306 2.140 20 0 BEADLO CCn1cc(C[N@H+](C)Cc2ccoc2)c(C)n1 ZINC000891780113 582719009 /nfs/dbraw/zinc/71/90/09/582719009.db2.gz TYPXGPXTJUTNMH-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CCn1cc(C[N@@H+](C)Cc2ccoc2)c(C)n1 ZINC000891780113 582719010 /nfs/dbraw/zinc/71/90/10/582719010.db2.gz TYPXGPXTJUTNMH-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccc(OC)o2)C[C@@H](C)O1 ZINC000891805163 582724396 /nfs/dbraw/zinc/72/43/96/582724396.db2.gz FBONXBLEIPRMMB-MNOVXSKESA-N 1 2 239.315 2.288 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccc(OC)o2)C[C@@H](C)O1 ZINC000891805163 582724398 /nfs/dbraw/zinc/72/43/98/582724398.db2.gz FBONXBLEIPRMMB-MNOVXSKESA-N 1 2 239.315 2.288 20 0 BEADLO CCC1CCN(c2cc(N(C)C)[nH+]cn2)CC1 ZINC000891917074 582738231 /nfs/dbraw/zinc/73/82/31/582738231.db2.gz FSYNVJQQJFLQJP-UHFFFAOYSA-N 1 2 234.347 2.169 20 0 BEADLO CCC1CCN(c2cc(N(C)C)nc[nH+]2)CC1 ZINC000891917074 582738233 /nfs/dbraw/zinc/73/82/33/582738233.db2.gz FSYNVJQQJFLQJP-UHFFFAOYSA-N 1 2 234.347 2.169 20 0 BEADLO Cc1noc(C)c1CNc1cccc([C@@H](C)O)[nH+]1 ZINC000892000326 582758046 /nfs/dbraw/zinc/75/80/46/582758046.db2.gz OUUQIJRKWAKAGK-SECBINFHSA-N 1 2 247.298 2.352 20 0 BEADLO COc1ccc2ccc(N(C)C[C@H](C)O)[nH+]c2c1 ZINC000892004640 582759780 /nfs/dbraw/zinc/75/97/80/582759780.db2.gz KAUPWAKMJZLRMR-JTQLQIEISA-N 1 2 246.310 2.060 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2cnn(C3CCC3)c2)[C@@H]1C ZINC000892049181 582773749 /nfs/dbraw/zinc/77/37/49/582773749.db2.gz PGBJRCCIKAQHQV-VXGBXAGGSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2cnn(C3CCC3)c2)[C@@H]1C ZINC000892049181 582773750 /nfs/dbraw/zinc/77/37/50/582773750.db2.gz PGBJRCCIKAQHQV-VXGBXAGGSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@@H]1N(Cc2[nH+]ccn2C2CC2)CCOC1(C)C ZINC000892068063 582784291 /nfs/dbraw/zinc/78/42/91/582784291.db2.gz DFSWHPPSLYTPPI-NSHDSACASA-N 1 2 249.358 2.217 20 0 BEADLO CC[C@@H](NC(=O)c1cccc2[nH+]ccn21)C1CC1 ZINC000855857817 588851572 /nfs/dbraw/zinc/85/15/72/588851572.db2.gz LNSXSBBRIOZSNP-LLVKDONJSA-N 1 2 243.310 2.253 20 0 BEADLO COc1ccc(C[N@@H+]2CCOC3(CCC3)C2)o1 ZINC000892105678 582792874 /nfs/dbraw/zinc/79/28/74/582792874.db2.gz NQWVHSZTDYXYHV-UHFFFAOYSA-N 1 2 237.299 2.043 20 0 BEADLO COc1ccc(C[N@H+]2CCOC3(CCC3)C2)o1 ZINC000892105678 582792875 /nfs/dbraw/zinc/79/28/75/582792875.db2.gz NQWVHSZTDYXYHV-UHFFFAOYSA-N 1 2 237.299 2.043 20 0 BEADLO CCc1cc(N2CC[C@@H](C)C2)nc(CC)[nH+]1 ZINC000892254365 582814090 /nfs/dbraw/zinc/81/40/90/582814090.db2.gz LKBPJEIZZVLYOP-SNVBAGLBSA-N 1 2 219.332 2.448 20 0 BEADLO O=C(Cc1cn2ccccc2[nH+]1)O[C@@H]1C=CCC1 ZINC000780553708 582833970 /nfs/dbraw/zinc/83/39/70/582833970.db2.gz ZQLLVERXTFLOKI-GFCCVEGCSA-N 1 2 242.278 2.139 20 0 BEADLO Cc1noc(C)c1[C@@H](C)[NH2+][C@H](C)c1cnccn1 ZINC000092327000 582855423 /nfs/dbraw/zinc/85/54/23/582855423.db2.gz GTYOFTDVPOUYLG-RKDXNWHRSA-N 1 2 246.314 2.493 20 0 BEADLO Cc1cc(CO[NH+]=C(N)c2cccc(F)c2)on1 ZINC000725794035 582856602 /nfs/dbraw/zinc/85/66/02/582856602.db2.gz ZXVCWXREEDAGFP-UHFFFAOYSA-N 1 2 249.245 2.169 20 0 BEADLO Cc1cc(N(C)[C@@H]2CCOC2)nc(C2CCC2)[nH+]1 ZINC000892404792 582877335 /nfs/dbraw/zinc/87/73/35/582877335.db2.gz JQYVUIIKEWMKOT-GFCCVEGCSA-N 1 2 247.342 2.278 20 0 BEADLO CCc1cc(CNc2cccc([C@H](C)O)[nH+]2)[nH]n1 ZINC000892504746 582900820 /nfs/dbraw/zinc/90/08/20/582900820.db2.gz ALSLJMVLGQHSIV-VIFPVBQESA-N 1 2 246.314 2.033 20 0 BEADLO CCc1cc(NCc2cc(C)n[nH]2)nc(CC)[nH+]1 ZINC000892526270 582906341 /nfs/dbraw/zinc/90/63/41/582906341.db2.gz FNKPAHQHODCBCN-UHFFFAOYSA-N 1 2 245.330 2.245 20 0 BEADLO CCc1cc(NCc2cc(C)[nH]n2)nc(CC)[nH+]1 ZINC000892526270 582906343 /nfs/dbraw/zinc/90/63/43/582906343.db2.gz FNKPAHQHODCBCN-UHFFFAOYSA-N 1 2 245.330 2.245 20 0 BEADLO Cc1cc(NCC[C@H](C)O)nc(C2CCC2)[nH+]1 ZINC000892540661 582908501 /nfs/dbraw/zinc/90/85/01/582908501.db2.gz OUJHESZWAPRXNJ-JTQLQIEISA-N 1 2 235.331 2.235 20 0 BEADLO C[C@H](O)CCNc1ccc(-c2ccncc2)c[nH+]1 ZINC000892540701 582908609 /nfs/dbraw/zinc/90/86/09/582908609.db2.gz PUECOENUDFYBPJ-NSHDSACASA-N 1 2 243.310 2.326 20 0 BEADLO COc1ccc(C[NH2+]Cc2cccc(C)n2)o1 ZINC000892596579 582924477 /nfs/dbraw/zinc/92/44/77/582924477.db2.gz QHMSBVKAJJZHCI-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO CN(C)c1cc(NCCCC2CC2)[nH+]cn1 ZINC000892602821 582925920 /nfs/dbraw/zinc/92/59/20/582925920.db2.gz FITGCIRBQLWPAW-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO CN(C)c1cc(NCCCC2CC2)nc[nH+]1 ZINC000892602821 582925923 /nfs/dbraw/zinc/92/59/23/582925923.db2.gz FITGCIRBQLWPAW-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO CNc1cc(N[C@@H](C)CC(C)(C)OC)[nH+]cn1 ZINC000892678761 582951963 /nfs/dbraw/zinc/95/19/63/582951963.db2.gz HPZSFZXUEUFBEK-VIFPVBQESA-N 1 2 238.335 2.134 20 0 BEADLO C[C@H]1CC[C@H]1Nc1ccc(N2CCOCC2)c[nH+]1 ZINC000783279634 582955457 /nfs/dbraw/zinc/95/54/57/582955457.db2.gz YTYKCIMIVIHMTL-WCQYABFASA-N 1 2 247.342 2.129 20 0 BEADLO C[C@@H]1CN(c2nccn3c[nH+]cc23)C[C@H](C)S1 ZINC000892697523 582957991 /nfs/dbraw/zinc/95/79/91/582957991.db2.gz SAKYSRDJYRCTFF-AOOOYVTPSA-N 1 2 248.355 2.060 20 0 BEADLO CCC/C(C)=C\C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000856277634 588866471 /nfs/dbraw/zinc/86/64/71/588866471.db2.gz NHWMUFTWZCBYAX-DWOQACPDSA-N 1 2 235.331 2.344 20 0 BEADLO CCC/C(C)=C\C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000856277635 588866487 /nfs/dbraw/zinc/86/64/87/588866487.db2.gz NHWMUFTWZCBYAX-JUDLJHIGSA-N 1 2 235.331 2.344 20 0 BEADLO CCc1c[nH]c2nc[nH+]c(SCCOC)c12 ZINC000892745918 582974830 /nfs/dbraw/zinc/97/48/30/582974830.db2.gz UCGUAFSBMKPCPA-UHFFFAOYSA-N 1 2 237.328 2.259 20 0 BEADLO CCc1cc(NCC(F)F)nc(CC)[nH+]1 ZINC000892751401 582975797 /nfs/dbraw/zinc/97/57/97/582975797.db2.gz VZZBJOKJRJDCEA-UHFFFAOYSA-N 1 2 215.247 2.278 20 0 BEADLO CC/C(C)=C(/C)C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000856281383 588867025 /nfs/dbraw/zinc/86/70/25/588867025.db2.gz OBWJODKDMSNIAG-DWOQACPDSA-N 1 2 235.331 2.344 20 0 BEADLO C[C@H]1CC[C@H](C)N1c1nccn2c[nH+]cc12 ZINC000892899454 583006715 /nfs/dbraw/zinc/00/67/15/583006715.db2.gz LYYJWBMYJIGXKJ-UWVGGRQHSA-N 1 2 216.288 2.107 20 0 BEADLO CCc1cc(N2CCO[C@H](C)[C@@H]2C)nc(CC)[nH+]1 ZINC000892941664 583013666 /nfs/dbraw/zinc/01/36/66/583013666.db2.gz GJJGZHQASXVGQS-WDEREUQCSA-N 1 2 249.358 2.215 20 0 BEADLO c1c(N[C@H]2CCOC2)nc(C2CC2)[nH+]c1C1CC1 ZINC000892953769 583018435 /nfs/dbraw/zinc/01/84/35/583018435.db2.gz JCLBNJARHZWGHG-NSHDSACASA-N 1 2 245.326 2.432 20 0 BEADLO CC[C@@H]([NH2+]Cc1nnc(C)s1)c1ccncc1 ZINC000893032438 583034641 /nfs/dbraw/zinc/03/46/41/583034641.db2.gz NVUFRBNWLZZDKA-LLVKDONJSA-N 1 2 248.355 2.482 20 0 BEADLO Cn1ccc(C[NH2+]Cc2nnc(C3CC3)s2)c1 ZINC000893100284 583049830 /nfs/dbraw/zinc/04/98/30/583049830.db2.gz FGTHHTTXPOWRNT-UHFFFAOYSA-N 1 2 248.355 2.044 20 0 BEADLO CCc1cc(N[C@@H]2C[C@H](O)C2(C)C)nc(CC)[nH+]1 ZINC000893264830 583080817 /nfs/dbraw/zinc/08/08/17/583080817.db2.gz HQQZWNSMZGMJGA-MNOVXSKESA-N 1 2 249.358 2.173 20 0 BEADLO CCc1cc(N[C@H]2C[C@H](O)C2(C)C)nc(CC)[nH+]1 ZINC000893264831 583080906 /nfs/dbraw/zinc/08/09/06/583080906.db2.gz HQQZWNSMZGMJGA-QWRGUYRKSA-N 1 2 249.358 2.173 20 0 BEADLO C=Cn1cc(C[NH2+]C(C)(C)C(F)F)cn1 ZINC000393634033 583098423 /nfs/dbraw/zinc/09/84/23/583098423.db2.gz UKEIEMZPTJOSAW-UHFFFAOYSA-N 1 2 215.247 2.117 20 0 BEADLO CC[C@H]([NH2+]Cc1cocn1)c1ccc(F)cn1 ZINC000397990074 583114777 /nfs/dbraw/zinc/11/47/77/583114777.db2.gz WMQWEHVDDGGCTF-NSHDSACASA-N 1 2 235.262 2.450 20 0 BEADLO Cc1ccc(O)c(C[NH2+][C@@H]2CCCC2(F)F)n1 ZINC000398013957 583116897 /nfs/dbraw/zinc/11/68/97/583116897.db2.gz UZWAFKJXZNWXPE-LLVKDONJSA-N 1 2 242.269 2.373 20 0 BEADLO COc1nc(C)cc(C)c1C[N@H+](C)CCF ZINC000856812451 588878857 /nfs/dbraw/zinc/87/88/57/588878857.db2.gz OKNVBFIESUMHKR-UHFFFAOYSA-N 1 2 226.295 2.108 20 0 BEADLO COc1nc(C)cc(C)c1C[N@@H+](C)CCF ZINC000856812451 588878858 /nfs/dbraw/zinc/87/88/58/588878858.db2.gz OKNVBFIESUMHKR-UHFFFAOYSA-N 1 2 226.295 2.108 20 0 BEADLO FC(F)[C@H]([NH2+]CC1OCCO1)C1CCCCC1 ZINC000856824056 588879074 /nfs/dbraw/zinc/87/90/74/588879074.db2.gz YOVPNIFTUSPLCN-LLVKDONJSA-N 1 2 249.301 2.163 20 0 BEADLO CCOCC[N@H+](C)Cc1nc(C(C)(C)C)co1 ZINC000893428038 583141524 /nfs/dbraw/zinc/14/15/24/583141524.db2.gz SENHVQBWZQPDOS-UHFFFAOYSA-N 1 2 240.347 2.440 20 0 BEADLO CCOCC[N@@H+](C)Cc1nc(C(C)(C)C)co1 ZINC000893428038 583141527 /nfs/dbraw/zinc/14/15/27/583141527.db2.gz SENHVQBWZQPDOS-UHFFFAOYSA-N 1 2 240.347 2.440 20 0 BEADLO Cn1ncc(C[N@@H+]2CCC=C(F)C2)c1C1CC1 ZINC000893436989 583142983 /nfs/dbraw/zinc/14/29/83/583142983.db2.gz NIAUQXNORMDQHB-UHFFFAOYSA-N 1 2 235.306 2.357 20 0 BEADLO Cn1ncc(C[N@H+]2CCC=C(F)C2)c1C1CC1 ZINC000893436989 583142986 /nfs/dbraw/zinc/14/29/86/583142986.db2.gz NIAUQXNORMDQHB-UHFFFAOYSA-N 1 2 235.306 2.357 20 0 BEADLO C[C@H]1CC2(CCC2)CN1c1nccn2c[nH+]cc12 ZINC000893499519 583154116 /nfs/dbraw/zinc/15/41/16/583154116.db2.gz STJPZNVETZIAKV-NSHDSACASA-N 1 2 242.326 2.498 20 0 BEADLO C[C@@H]1CC2(CCC2)CN1c1cc(N(C)C)[nH+]cn1 ZINC000893500629 583154273 /nfs/dbraw/zinc/15/42/73/583154273.db2.gz YXHGDBIASGVOSC-LLVKDONJSA-N 1 2 246.358 2.312 20 0 BEADLO C[C@@H]1CC2(CCC2)CN1c1cc(N(C)C)nc[nH+]1 ZINC000893500629 583154274 /nfs/dbraw/zinc/15/42/74/583154274.db2.gz YXHGDBIASGVOSC-LLVKDONJSA-N 1 2 246.358 2.312 20 0 BEADLO Cc1ccc(C(=O)O[C@@H]2CCn3c(C)c[nH+]c32)o1 ZINC000893520429 583156232 /nfs/dbraw/zinc/15/62/32/583156232.db2.gz XEJCYDNLEFHWJY-SNVBAGLBSA-N 1 2 246.266 2.395 20 0 BEADLO C/C=C(/C)C(=O)O[C@@H]1CCn2c(C)c[nH+]c21 ZINC000893524700 583157372 /nfs/dbraw/zinc/15/73/72/583157372.db2.gz KKCZJUGGYHHKOB-NAXAJZLFSA-N 1 2 220.272 2.146 20 0 BEADLO Cc1c[nH+]c2n1CC[C@H]2OC(=O)[C@@H]1CC1(C)C ZINC000893524344 583157406 /nfs/dbraw/zinc/15/74/06/583157406.db2.gz IZEDKRUSZOWHRG-VHSXEESVSA-N 1 2 234.299 2.226 20 0 BEADLO Cc1c[nH+]c2n1CC[C@H]2OC(=O)C1=CCCC1 ZINC000893524717 583157467 /nfs/dbraw/zinc/15/74/67/583157467.db2.gz KQETZHNMWXGXRS-LLVKDONJSA-N 1 2 232.283 2.290 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)O[C@H]1CCn2c(C)c[nH+]c21 ZINC000893527695 583157935 /nfs/dbraw/zinc/15/79/35/583157935.db2.gz GCJAHLIVXWUESH-MXWKQRLJSA-N 1 2 234.299 2.226 20 0 BEADLO Cc1cc(NCCCCO)nc(C2CCC2)[nH+]1 ZINC000893545704 583161731 /nfs/dbraw/zinc/16/17/31/583161731.db2.gz WSZBBQNLXBYTGB-UHFFFAOYSA-N 1 2 235.331 2.237 20 0 BEADLO CCn1cc(C[N@H+](C)Cc2ccccn2)c(C)n1 ZINC000893547292 583162224 /nfs/dbraw/zinc/16/22/24/583162224.db2.gz WNISWYHBPDLMEX-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1cc(C[N@@H+](C)Cc2ccccn2)c(C)n1 ZINC000893547292 583162225 /nfs/dbraw/zinc/16/22/25/583162225.db2.gz WNISWYHBPDLMEX-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CC1=CC[N@H+](Cc2cn(C)nc2Cl)CC1 ZINC000857020418 588882530 /nfs/dbraw/zinc/88/25/30/588882530.db2.gz CDCUSNHOHBZVAA-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO CC1=CC[N@@H+](Cc2cn(C)nc2Cl)CC1 ZINC000857020418 588882531 /nfs/dbraw/zinc/88/25/31/588882531.db2.gz CDCUSNHOHBZVAA-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO CC1=C(C)CN(c2cc(N(C)C)[nH+]cn2)CC1 ZINC000893640400 583184102 /nfs/dbraw/zinc/18/41/02/583184102.db2.gz CHOHLQIWHGYOMT-UHFFFAOYSA-N 1 2 232.331 2.089 20 0 BEADLO CC1=C(C)CN(c2cc(N(C)C)nc[nH+]2)CC1 ZINC000893640400 583184105 /nfs/dbraw/zinc/18/41/05/583184105.db2.gz CHOHLQIWHGYOMT-UHFFFAOYSA-N 1 2 232.331 2.089 20 0 BEADLO Cc1ncoc1C[N@@H+]1CCn2cccc2[C@H]1C ZINC000893879031 583240249 /nfs/dbraw/zinc/24/02/49/583240249.db2.gz CAUVKMYGYCYTSQ-LLVKDONJSA-N 1 2 231.299 2.361 20 0 BEADLO Cc1ncoc1C[N@H+]1CCn2cccc2[C@H]1C ZINC000893879031 583240251 /nfs/dbraw/zinc/24/02/51/583240251.db2.gz CAUVKMYGYCYTSQ-LLVKDONJSA-N 1 2 231.299 2.361 20 0 BEADLO CNc1cc(N2CCC[C@H](C3CC3)C2)nc[nH+]1 ZINC000893883476 583240835 /nfs/dbraw/zinc/24/08/35/583240835.db2.gz LNJDWCPLIWTHMI-NSHDSACASA-N 1 2 232.331 2.145 20 0 BEADLO CNc1cc(N2CCC[C@H](C3CC3)C2)[nH+]cn1 ZINC000893883476 583240837 /nfs/dbraw/zinc/24/08/37/583240837.db2.gz LNJDWCPLIWTHMI-NSHDSACASA-N 1 2 232.331 2.145 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C)co2)CCO1 ZINC000893921050 583247643 /nfs/dbraw/zinc/24/76/43/583247643.db2.gz ZOTIUBVAVRMNSB-LLVKDONJSA-N 1 2 209.289 2.199 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C)co2)CCO1 ZINC000893921050 583247645 /nfs/dbraw/zinc/24/76/45/583247645.db2.gz ZOTIUBVAVRMNSB-LLVKDONJSA-N 1 2 209.289 2.199 20 0 BEADLO C[C@H](O)c1cccc(NCCCCF)[nH+]1 ZINC000893926755 583249197 /nfs/dbraw/zinc/24/91/97/583249197.db2.gz VTPZTMYSTZPRBM-VIFPVBQESA-N 1 2 212.268 2.297 20 0 BEADLO Cc1coc(C[N@@H+]2CCOCC2(C)C)c1 ZINC000893970072 583263852 /nfs/dbraw/zinc/26/38/52/583263852.db2.gz YWFDVFWLABCNPO-UHFFFAOYSA-N 1 2 209.289 2.199 20 0 BEADLO Cc1coc(C[N@H+]2CCOCC2(C)C)c1 ZINC000893970072 583263856 /nfs/dbraw/zinc/26/38/56/583263856.db2.gz YWFDVFWLABCNPO-UHFFFAOYSA-N 1 2 209.289 2.199 20 0 BEADLO Cc1cc(NC2(CCO)CC2)nc(C2CCC2)[nH+]1 ZINC000893971228 583263959 /nfs/dbraw/zinc/26/39/59/583263959.db2.gz SAYPCUHLTGCFKX-UHFFFAOYSA-N 1 2 247.342 2.379 20 0 BEADLO COC[C@@H]1CCN1c1cc(C)[nH+]c(C2CCC2)n1 ZINC000893975793 583264808 /nfs/dbraw/zinc/26/48/08/583264808.db2.gz IZSFFFIQVYADEC-LBPRGKRZSA-N 1 2 247.342 2.278 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CCC3(CCC3)C2)c1C ZINC000894030762 583276619 /nfs/dbraw/zinc/27/66/19/583276619.db2.gz KCWLNCZTLOFBPF-UHFFFAOYSA-N 1 2 219.332 2.403 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CCC3(CCC3)C2)c1C ZINC000894030762 583276622 /nfs/dbraw/zinc/27/66/22/583276622.db2.gz KCWLNCZTLOFBPF-UHFFFAOYSA-N 1 2 219.332 2.403 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2CCOC(C)(C)[C@H]2C)c1C ZINC000894035116 583279728 /nfs/dbraw/zinc/27/97/28/583279728.db2.gz DPEHDUKRHGOFES-LLVKDONJSA-N 1 2 237.347 2.026 20 0 BEADLO Cc1n[nH]c(C[N@H+]2CCOC(C)(C)[C@H]2C)c1C ZINC000894035116 583279731 /nfs/dbraw/zinc/27/97/31/583279731.db2.gz DPEHDUKRHGOFES-LLVKDONJSA-N 1 2 237.347 2.026 20 0 BEADLO CCn1cc(C[N@H+](C)Cc2cc(C)co2)cn1 ZINC000894026454 583280377 /nfs/dbraw/zinc/28/03/77/583280377.db2.gz GZXVZSXYVPCSOK-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CCn1cc(C[N@@H+](C)Cc2cc(C)co2)cn1 ZINC000894026454 583280379 /nfs/dbraw/zinc/28/03/79/583280379.db2.gz GZXVZSXYVPCSOK-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+]2CCSC[C@@H]2C)n1 ZINC000894025870 583281057 /nfs/dbraw/zinc/28/10/57/583281057.db2.gz JBULUPCPOKWODV-JTQLQIEISA-N 1 2 239.388 2.470 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+]2CCSC[C@@H]2C)n1 ZINC000894025870 583281060 /nfs/dbraw/zinc/28/10/60/583281060.db2.gz JBULUPCPOKWODV-JTQLQIEISA-N 1 2 239.388 2.470 20 0 BEADLO C[C@@H](O)c1cccc(N[C@@H](C)CCCCO)[nH+]1 ZINC000894037465 583282969 /nfs/dbraw/zinc/28/29/69/583282969.db2.gz NLUFRYFZIXVQHR-WDEREUQCSA-N 1 2 238.331 2.098 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2C[C@@H](C)C[C@@H]2C)c1C ZINC000894046352 583287510 /nfs/dbraw/zinc/28/75/10/583287510.db2.gz WGFYIVZTWBBUQV-IUCAKERBSA-N 1 2 207.321 2.257 20 0 BEADLO Cc1[nH]nc(C[N@H+]2C[C@@H](C)C[C@@H]2C)c1C ZINC000894046352 583287512 /nfs/dbraw/zinc/28/75/12/583287512.db2.gz WGFYIVZTWBBUQV-IUCAKERBSA-N 1 2 207.321 2.257 20 0 BEADLO C[C@H](O)c1cccc(N[C@@H]2CC23CCOCC3)[nH+]1 ZINC000894081504 583294159 /nfs/dbraw/zinc/29/41/59/583294159.db2.gz ZKBVZYDXIODYME-CMPLNLGQSA-N 1 2 248.326 2.116 20 0 BEADLO CO[C@@H]1CCC[C@H]1Nc1cccc([C@@H](C)O)[nH+]1 ZINC000894073602 583296372 /nfs/dbraw/zinc/29/63/72/583296372.db2.gz XIVSNQDVWZEXBD-YUSALJHKSA-N 1 2 236.315 2.114 20 0 BEADLO CCc1nc(CNc2cccc([C@H](C)O)[nH+]2)co1 ZINC000894098430 583302542 /nfs/dbraw/zinc/30/25/42/583302542.db2.gz RHYLMSYZEBYWRM-VIFPVBQESA-N 1 2 247.298 2.297 20 0 BEADLO CCc1cc(NC[C@H](O)C2CCC2)nc(CC)[nH+]1 ZINC000894119341 583311009 /nfs/dbraw/zinc/31/10/09/583311009.db2.gz NKWJKPWIVCBELY-LBPRGKRZSA-N 1 2 249.358 2.174 20 0 BEADLO Cc1ncoc1C[NH2+]C[C@H](CC(C)C)N(C)C ZINC000894168341 583324648 /nfs/dbraw/zinc/32/46/48/583324648.db2.gz QWELVLGIVYTSCO-LBPRGKRZSA-N 1 2 239.363 2.049 20 0 BEADLO COCC[C@@H](C)CNc1cccc([C@H](C)O)[nH+]1 ZINC000894184760 583332395 /nfs/dbraw/zinc/33/23/95/583332395.db2.gz GADMCVBDHHZDBZ-MNOVXSKESA-N 1 2 238.331 2.219 20 0 BEADLO C[C@H](O)c1cccc(N[C@@H]2CS[C@H](C)C2)[nH+]1 ZINC000894194065 583334042 /nfs/dbraw/zinc/33/40/42/583334042.db2.gz JHGZQVQWHSEPQL-UTLUCORTSA-N 1 2 238.356 2.441 20 0 BEADLO CNc1cc(N[C@@H]2C[C@H]2c2ccco2)nc[nH+]1 ZINC000894219275 583381483 /nfs/dbraw/zinc/38/14/83/583381483.db2.gz AAAVLMOKDLWHTC-RKDXNWHRSA-N 1 2 230.271 2.079 20 0 BEADLO CNc1cc(N[C@@H]2C[C@H]2c2ccco2)[nH+]cn1 ZINC000894219275 583381486 /nfs/dbraw/zinc/38/14/86/583381486.db2.gz AAAVLMOKDLWHTC-RKDXNWHRSA-N 1 2 230.271 2.079 20 0 BEADLO CCOc1ccc(CNc2ccc(CO)c[nH+]2)o1 ZINC000894227162 583383753 /nfs/dbraw/zinc/38/37/53/583383753.db2.gz QAAXAMTZLCUOFY-UHFFFAOYSA-N 1 2 248.282 2.178 20 0 BEADLO CN(C)c1cc(N2CC[C@@H](C3CCC3)C2)nc[nH+]1 ZINC000894226515 583383939 /nfs/dbraw/zinc/38/39/39/583383939.db2.gz JQBRMZGFUTUPRY-GFCCVEGCSA-N 1 2 246.358 2.169 20 0 BEADLO CN(C)c1cc(N2CC[C@@H](C3CCC3)C2)[nH+]cn1 ZINC000894226515 583383941 /nfs/dbraw/zinc/38/39/41/583383941.db2.gz JQBRMZGFUTUPRY-GFCCVEGCSA-N 1 2 246.358 2.169 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1nc2c(o1)CCCC2 ZINC000878652127 583389006 /nfs/dbraw/zinc/38/90/06/583389006.db2.gz MGPMEPAUPHIMJW-VHSXEESVSA-N 1 2 220.316 2.394 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1nc2c(o1)CCCC2 ZINC000878652127 583389009 /nfs/dbraw/zinc/38/90/09/583389009.db2.gz MGPMEPAUPHIMJW-VHSXEESVSA-N 1 2 220.316 2.394 20 0 BEADLO Cc1ncoc1C[NH2+]Cc1ccn(C(C)C)n1 ZINC000894289364 583412333 /nfs/dbraw/zinc/41/23/33/583412333.db2.gz MQWXNUYNMJBKBV-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO Clc1ccc2c(c1)[C@@H]([NH2+]Cc1cnc[nH]1)CO2 ZINC000894333600 583425840 /nfs/dbraw/zinc/42/58/40/583425840.db2.gz OYWBPLFYDNXJRB-NSHDSACASA-N 1 2 249.701 2.286 20 0 BEADLO Cc1ncoc1CNc1ccc(N(C)C)c[nH+]1 ZINC000894346729 583431295 /nfs/dbraw/zinc/43/12/95/583431295.db2.gz USSPETSCKHYEOF-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO CCc1cc(N[C@@H]2C[C@H]3CC[C@@H]2O3)nc(CC)[nH+]1 ZINC000894389744 583446099 /nfs/dbraw/zinc/44/60/99/583446099.db2.gz WSZJWXVFUIXKOF-UTUOFQBUSA-N 1 2 247.342 2.333 20 0 BEADLO CCc1cc(NCC2(COC)CC2)nc(CC)[nH+]1 ZINC000894426383 583457161 /nfs/dbraw/zinc/45/71/61/583457161.db2.gz NVXHNQFNNGANPQ-UHFFFAOYSA-N 1 2 249.358 2.440 20 0 BEADLO Cc1noc([C@@H](C)NCc2[nH]cc(C(C)C)[nH+]2)n1 ZINC000894542201 583481119 /nfs/dbraw/zinc/48/11/19/583481119.db2.gz HMNCZWIWDTZFML-MRVPVSSYSA-N 1 2 249.318 2.075 20 0 BEADLO CC[C@@H](C)n1ncc(NCc2c[nH+]c[nH]2)c1C ZINC000894553511 583483515 /nfs/dbraw/zinc/48/35/15/583483515.db2.gz LAHWWXJWRRICOZ-SECBINFHSA-N 1 2 233.319 2.498 20 0 BEADLO CC[C@@H](C)n1ncc(NCc2c[nH]c[nH+]2)c1C ZINC000894553511 583483517 /nfs/dbraw/zinc/48/35/17/583483517.db2.gz LAHWWXJWRRICOZ-SECBINFHSA-N 1 2 233.319 2.498 20 0 BEADLO C(c1nnc(C2CC2)s1)[NH+]1CC(C2CC2)C1 ZINC000894564483 583484339 /nfs/dbraw/zinc/48/43/39/583484339.db2.gz CKIBYPYANCBEGE-UHFFFAOYSA-N 1 2 235.356 2.257 20 0 BEADLO COc1cccc(CN(C)Cc2[nH]cc[nH+]2)c1F ZINC000894585050 583488984 /nfs/dbraw/zinc/48/89/84/583488984.db2.gz BEXSMTQZHCBTFH-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO Cc1n[nH]c(C[N@@H+](C)Cc2cnccc2C)c1C ZINC000894622869 583496183 /nfs/dbraw/zinc/49/61/83/583496183.db2.gz PYKFCMIOUVMKKC-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO Cc1n[nH]c(C[N@H+](C)Cc2cnccc2C)c1C ZINC000894622869 583496185 /nfs/dbraw/zinc/49/61/85/583496185.db2.gz PYKFCMIOUVMKKC-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO CC(F)(F)C[NH2+]Cc1cn2ccnc2s1 ZINC000894625250 583496464 /nfs/dbraw/zinc/49/64/64/583496464.db2.gz QOBBIPXXUMLQQY-UHFFFAOYSA-N 1 2 231.271 2.141 20 0 BEADLO CCOc1ccc(C[NH2+][C@@H]2CCn3ccnc32)o1 ZINC000894667582 583502105 /nfs/dbraw/zinc/50/21/05/583502105.db2.gz IBLHEEIJKBBRSR-LLVKDONJSA-N 1 2 247.298 2.109 20 0 BEADLO CC1CC(CNc2cc(N(C)C)nc[nH+]2)C1 ZINC000894680268 583505268 /nfs/dbraw/zinc/50/52/68/583505268.db2.gz VNGXMDBNUUOCAI-UHFFFAOYSA-N 1 2 220.320 2.001 20 0 BEADLO CC1CC(CNc2cc(N(C)C)[nH+]cn2)C1 ZINC000894680268 583505271 /nfs/dbraw/zinc/50/52/71/583505271.db2.gz VNGXMDBNUUOCAI-UHFFFAOYSA-N 1 2 220.320 2.001 20 0 BEADLO Cc1c[nH]c(CNc2ncc(Cl)s2)[nH+]1 ZINC000894791263 583520157 /nfs/dbraw/zinc/52/01/57/583520157.db2.gz VNHKXJFFPAYAPX-UHFFFAOYSA-N 1 2 228.708 2.440 20 0 BEADLO Cc1nnc(C[NH+]2CC(C3CCCC3)C2)s1 ZINC000894835017 583528952 /nfs/dbraw/zinc/52/89/52/583528952.db2.gz HQLNXZKVZDKJDD-UHFFFAOYSA-N 1 2 237.372 2.469 20 0 BEADLO CCNc1cc(CNc2cc(F)ncn2)cc[nH+]1 ZINC000894873280 583539436 /nfs/dbraw/zinc/53/94/36/583539436.db2.gz QBYUSCNHJHVFTP-UHFFFAOYSA-N 1 2 247.277 2.055 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CC[C@@H]2C2CC2)c1C ZINC000894880024 583543864 /nfs/dbraw/zinc/54/38/64/583543864.db2.gz ASSQIYZHGQKFAJ-GFCCVEGCSA-N 1 2 205.305 2.011 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CC[C@@H]2C2CC2)c1C ZINC000894880024 583543865 /nfs/dbraw/zinc/54/38/65/583543865.db2.gz ASSQIYZHGQKFAJ-GFCCVEGCSA-N 1 2 205.305 2.011 20 0 BEADLO Cn1cccc1C[NH+]1CC(C(F)(F)F)C1 ZINC000894892325 583548667 /nfs/dbraw/zinc/54/86/67/583548667.db2.gz QMSHAUHTMHIPKQ-UHFFFAOYSA-N 1 2 218.222 2.019 20 0 BEADLO CCn1ccnc1[C@H](C)[NH2+]Cc1ocnc1C ZINC000894911988 583554754 /nfs/dbraw/zinc/55/47/54/583554754.db2.gz PQGUSFUFAWRTDX-JTQLQIEISA-N 1 2 234.303 2.050 20 0 BEADLO Cc1nnc(C[NH2+][C@@H]2CCCC[C@H]2F)s1 ZINC000894912297 583554818 /nfs/dbraw/zinc/55/48/18/583554818.db2.gz DDHHZIWOIJJFRL-RKDXNWHRSA-N 1 2 229.324 2.217 20 0 BEADLO CCn1ccnc1[C@H](C)[NH2+][C@H](C)c1cnccn1 ZINC000894911955 583554873 /nfs/dbraw/zinc/55/48/73/583554873.db2.gz OXORMSPXLLOZGB-MNOVXSKESA-N 1 2 245.330 2.105 20 0 BEADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1ocnc1C ZINC000894911989 583554930 /nfs/dbraw/zinc/55/49/30/583554930.db2.gz PQGUSFUFAWRTDX-SNVBAGLBSA-N 1 2 234.303 2.050 20 0 BEADLO CNc1cc(N[C@@H]2CCCC[C@@H]2F)nc[nH+]1 ZINC000894925090 583556841 /nfs/dbraw/zinc/55/68/41/583556841.db2.gz GUXZEXKPBGBZHV-DTWKUNHWSA-N 1 2 224.283 2.211 20 0 BEADLO CNc1cc(N[C@@H]2CCCC[C@@H]2F)[nH+]cn1 ZINC000894925090 583556843 /nfs/dbraw/zinc/55/68/43/583556843.db2.gz GUXZEXKPBGBZHV-DTWKUNHWSA-N 1 2 224.283 2.211 20 0 BEADLO c1ncc(C[NH+]2CC3(C2)CCCCC3)[nH]1 ZINC000894970587 583560341 /nfs/dbraw/zinc/56/03/41/583560341.db2.gz IBCYOYUAVNGICX-UHFFFAOYSA-N 1 2 205.305 2.176 20 0 BEADLO CC(C)c1c[nH]c(C[NH+]2CC3(C2)CCCOC3)n1 ZINC000894976615 583562368 /nfs/dbraw/zinc/56/23/68/583562368.db2.gz LTOBDTGWNCUTSF-UHFFFAOYSA-N 1 2 249.358 2.146 20 0 BEADLO COC(C)(C)CCNc1cccc([C@H](C)O)[nH+]1 ZINC000895001086 583565559 /nfs/dbraw/zinc/56/55/59/583565559.db2.gz WFWMTCBVQXVZRP-JTQLQIEISA-N 1 2 238.331 2.362 20 0 BEADLO CC(C)c1nc(N(C)Cc2ncccn2)cc[nH+]1 ZINC000895061300 583577213 /nfs/dbraw/zinc/57/72/13/583577213.db2.gz BVTVAHLUAQQIBU-UHFFFAOYSA-N 1 2 243.314 2.026 20 0 BEADLO C[C@@H]([NH2+]Cc1cccnc1F)c1ccccn1 ZINC000793282025 583580526 /nfs/dbraw/zinc/58/05/26/583580526.db2.gz UDPTXBAUCJFWSX-SNVBAGLBSA-N 1 2 231.274 2.467 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2CCC[C@H]2CCO)c1C ZINC000882214755 583598538 /nfs/dbraw/zinc/59/85/38/583598538.db2.gz ZAWNANSUNUUIMZ-NWDGAFQWSA-N 1 2 235.331 2.056 20 0 BEADLO Cc1cc[nH+]c(N)c1CN1CCCC(F)(F)C1 ZINC000895134967 583602072 /nfs/dbraw/zinc/60/20/72/583602072.db2.gz OMCHVKHOUCFZKG-UHFFFAOYSA-N 1 2 241.285 2.203 20 0 BEADLO CCc1cc[nH+]cc1N[C@@H]1COCC1(C)C ZINC000895141454 583603305 /nfs/dbraw/zinc/60/33/05/583603305.db2.gz APNLXLHLYOIOLZ-GFCCVEGCSA-N 1 2 220.316 2.481 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccc(OC)o2)[C@H](C)CO1 ZINC000895147111 583605038 /nfs/dbraw/zinc/60/50/38/583605038.db2.gz NNTUEZBFRAEXTA-MNOVXSKESA-N 1 2 239.315 2.288 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccc(OC)o2)[C@H](C)CO1 ZINC000895147111 583605040 /nfs/dbraw/zinc/60/50/40/583605040.db2.gz NNTUEZBFRAEXTA-MNOVXSKESA-N 1 2 239.315 2.288 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccc(OC)o2)[C@@H](C)CO1 ZINC000895147113 583605123 /nfs/dbraw/zinc/60/51/23/583605123.db2.gz NNTUEZBFRAEXTA-WDEREUQCSA-N 1 2 239.315 2.288 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccc(OC)o2)[C@@H](C)CO1 ZINC000895147113 583605124 /nfs/dbraw/zinc/60/51/24/583605124.db2.gz NNTUEZBFRAEXTA-WDEREUQCSA-N 1 2 239.315 2.288 20 0 BEADLO F[C@H]1CCC[N@H+](Cc2cn3ccnc3s2)C1 ZINC000895191609 583621707 /nfs/dbraw/zinc/62/17/07/583621707.db2.gz QLPLUKCWVUCXRS-VIFPVBQESA-N 1 2 239.319 2.330 20 0 BEADLO F[C@H]1CCC[N@@H+](Cc2cn3ccnc3s2)C1 ZINC000895191609 583621709 /nfs/dbraw/zinc/62/17/09/583621709.db2.gz QLPLUKCWVUCXRS-VIFPVBQESA-N 1 2 239.319 2.330 20 0 BEADLO C[C@@H]1C[C@@H]1C(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000727496313 583661652 /nfs/dbraw/zinc/66/16/52/583661652.db2.gz MWMFPWSNFLFXFD-GRYCIOLGSA-N 1 2 249.358 2.070 20 0 BEADLO CO[C@](C)(C[N@@H+]1CC[C@@H]1C(F)F)C1CC1 ZINC000895432057 583670558 /nfs/dbraw/zinc/67/05/58/583670558.db2.gz UATMGBUZMNSZSA-MWLCHTKSSA-N 1 2 219.275 2.141 20 0 BEADLO CO[C@](C)(C[N@H+]1CC[C@@H]1C(F)F)C1CC1 ZINC000895432057 583670559 /nfs/dbraw/zinc/67/05/59/583670559.db2.gz UATMGBUZMNSZSA-MWLCHTKSSA-N 1 2 219.275 2.141 20 0 BEADLO CO[C@@](C)(C[N@@H+]1CC[C@@H]1C(F)F)C1CC1 ZINC000895432056 583670578 /nfs/dbraw/zinc/67/05/78/583670578.db2.gz UATMGBUZMNSZSA-KOLCDFICSA-N 1 2 219.275 2.141 20 0 BEADLO CO[C@@](C)(C[N@H+]1CC[C@@H]1C(F)F)C1CC1 ZINC000895432056 583670579 /nfs/dbraw/zinc/67/05/79/583670579.db2.gz UATMGBUZMNSZSA-KOLCDFICSA-N 1 2 219.275 2.141 20 0 BEADLO CC(C)c1c[nH]c(C[NH+]2CC(C)(C)C2)n1 ZINC000895458846 583677060 /nfs/dbraw/zinc/67/70/60/583677060.db2.gz ZZJKDFBWFQBBBL-UHFFFAOYSA-N 1 2 207.321 2.375 20 0 BEADLO CCCCN(C)C(=O)C(C)(C)n1c[nH+]c(C)c1 ZINC000895523836 583686382 /nfs/dbraw/zinc/68/63/82/583686382.db2.gz FDWHKEAWNUGMJJ-UHFFFAOYSA-N 1 2 237.347 2.185 20 0 BEADLO Oc1ccc(F)c(C[N@@H+]2CC[C@@H](CF)C2)c1F ZINC000895572815 583692486 /nfs/dbraw/zinc/69/24/86/583692486.db2.gz LTFMITFNKPXAJH-QMMMGPOBSA-N 1 2 245.244 2.462 20 0 BEADLO Oc1ccc(F)c(C[N@H+]2CC[C@@H](CF)C2)c1F ZINC000895572815 583692490 /nfs/dbraw/zinc/69/24/90/583692490.db2.gz LTFMITFNKPXAJH-QMMMGPOBSA-N 1 2 245.244 2.462 20 0 BEADLO Cc1cc(NCCCc2cnn(C)c2)c[nH+]c1C ZINC000895646017 583701410 /nfs/dbraw/zinc/70/14/10/583701410.db2.gz ULOQYMYVHXGHOS-UHFFFAOYSA-N 1 2 244.342 2.477 20 0 BEADLO CC(C)([NH2+]Cc1ccn[nH]1)[C@H](O)c1ccccc1 ZINC000895659327 583701586 /nfs/dbraw/zinc/70/15/86/583701586.db2.gz VKMNAFNJTCGIMR-CYBMUJFWSA-N 1 2 245.326 2.012 20 0 BEADLO OC[C@H](CCc1ccccc1)Nc1cccc[nH+]1 ZINC000895678424 583704760 /nfs/dbraw/zinc/70/47/60/583704760.db2.gz DIKBFUDBZUTLNY-AWEZNQCLSA-N 1 2 242.322 2.487 20 0 BEADLO Cc1cn(C(C)(C)C(=O)NCC2CCCC2)c[nH+]1 ZINC000895676832 583704821 /nfs/dbraw/zinc/70/48/21/583704821.db2.gz DFDRHXXEZJWHFK-UHFFFAOYSA-N 1 2 249.358 2.233 20 0 BEADLO CN(C)c1c[nH+]cc(NC2CCC(C)(O)CC2)c1 ZINC000895699976 583709638 /nfs/dbraw/zinc/70/96/38/583709638.db2.gz PNCUKXKWPMCTBI-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO CCc1nn(C)c(CC)c1C[NH2+][C@@H](C)C(F)F ZINC000895728926 583713522 /nfs/dbraw/zinc/71/35/22/583713522.db2.gz BXJWKWXHXJMVRA-QMMMGPOBSA-N 1 2 245.317 2.288 20 0 BEADLO FC(F)c1noc(C[NH2+]Cc2cccs2)n1 ZINC000895730184 583713564 /nfs/dbraw/zinc/71/35/64/583713564.db2.gz USJGOQRHEFNEQW-UHFFFAOYSA-N 1 2 245.254 2.359 20 0 BEADLO FC(F)c1noc(C[NH2+]Cc2ccccc2)n1 ZINC000895727297 583713687 /nfs/dbraw/zinc/71/36/87/583713687.db2.gz AYIKVHHQPCQIRH-UHFFFAOYSA-N 1 2 239.225 2.297 20 0 BEADLO CCc1nnc(C[NH2+][C@@H]2CCCC[C@@H]2F)s1 ZINC000895746869 583716434 /nfs/dbraw/zinc/71/64/34/583716434.db2.gz QZQNHJLGYFBMOY-DTWKUNHWSA-N 1 2 243.351 2.471 20 0 BEADLO Cc1cc(N2CCO[C@@H](C)CC2)nc(C2CC2)[nH+]1 ZINC000895758847 583721223 /nfs/dbraw/zinc/72/12/23/583721223.db2.gz ZGIGSJMOPMXCRZ-NSHDSACASA-N 1 2 247.342 2.278 20 0 BEADLO COc1cccc(NCc2c[nH+]c[nH]2)c1OC ZINC000895775730 583726158 /nfs/dbraw/zinc/72/61/58/583726158.db2.gz VPGDOTODSNSLOA-UHFFFAOYSA-N 1 2 233.271 2.039 20 0 BEADLO COc1cccc(NCc2c[nH]c[nH+]2)c1OC ZINC000895775730 583726161 /nfs/dbraw/zinc/72/61/61/583726161.db2.gz VPGDOTODSNSLOA-UHFFFAOYSA-N 1 2 233.271 2.039 20 0 BEADLO Cc1cc(N[C@@H](c2ncccn2)C2CC2)nc[nH+]1 ZINC000895776911 583726745 /nfs/dbraw/zinc/72/67/45/583726745.db2.gz OAMAAHBQBSGZSI-GFCCVEGCSA-N 1 2 241.298 2.138 20 0 BEADLO CCC(=CC(=O)N[C@@H]1CCn2c[nH+]cc2C1)CC ZINC000857951313 588924946 /nfs/dbraw/zinc/92/49/46/588924946.db2.gz OKGKEQIUFJZNSG-GFCCVEGCSA-N 1 2 247.342 2.061 20 0 BEADLO O=C1OCC[C@@H]1[NH2+][C@@H]1CC[C@H](c2ccccc2)C1 ZINC000895803032 583731456 /nfs/dbraw/zinc/73/14/56/583731456.db2.gz AIQQJDRCOHTGII-MJBXVCDLSA-N 1 2 245.322 2.228 20 0 BEADLO Cc1nc(N[C@H]2COC[C@H]2C)c2c([nH+]1)CCCC2 ZINC000895908666 583745454 /nfs/dbraw/zinc/74/54/54/583745454.db2.gz JNMLPNAZGROAHL-RNCFNFMXSA-N 1 2 247.342 2.111 20 0 BEADLO C[C@H](C(=O)N[C@@H]1CCn2c[nH+]cc21)C(C)(C)C ZINC000857987645 588926080 /nfs/dbraw/zinc/92/60/80/588926080.db2.gz XMUJXGBCECTMPC-NXEZZACHSA-N 1 2 235.331 2.126 20 0 BEADLO CO[C@H]1CC[C@H](C)[N@H+](Cc2n[nH]c(C)c2C)C1 ZINC000895927650 583748725 /nfs/dbraw/zinc/74/87/25/583748725.db2.gz OJCVYCJGTHCDLX-CABZTGNLSA-N 1 2 237.347 2.026 20 0 BEADLO CO[C@H]1CC[C@H](C)[N@@H+](Cc2n[nH]c(C)c2C)C1 ZINC000895927650 583748726 /nfs/dbraw/zinc/74/87/26/583748726.db2.gz OJCVYCJGTHCDLX-CABZTGNLSA-N 1 2 237.347 2.026 20 0 BEADLO CCCC(C)(C)C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857976177 588926240 /nfs/dbraw/zinc/92/62/40/588926240.db2.gz YYFHRBFWBLREEX-SNVBAGLBSA-N 1 2 235.331 2.270 20 0 BEADLO C[C@H]1CC=C(C(=O)N[C@@H]2CCn3c[nH+]cc32)CC1 ZINC000857976311 588926360 /nfs/dbraw/zinc/92/63/60/588926360.db2.gz AZIOTDHPHOQBLU-CMPLNLGQSA-N 1 2 245.326 2.191 20 0 BEADLO CO[C@H]1C[N@H+](Cc2cccc(C3CC3)c2)CCO1 ZINC000895961715 583750867 /nfs/dbraw/zinc/75/08/67/583750867.db2.gz CQHROLBITCUTKS-OAHLLOKOSA-N 1 2 247.338 2.369 20 0 BEADLO CO[C@H]1C[N@@H+](Cc2cccc(C3CC3)c2)CCO1 ZINC000895961715 583750868 /nfs/dbraw/zinc/75/08/68/583750868.db2.gz CQHROLBITCUTKS-OAHLLOKOSA-N 1 2 247.338 2.369 20 0 BEADLO CC(C)OC1C[NH+](Cc2cccs2)C1 ZINC000895951953 583751630 /nfs/dbraw/zinc/75/16/30/583751630.db2.gz JGQOHPTVLHRLKF-UHFFFAOYSA-N 1 2 211.330 2.357 20 0 BEADLO CC(C)OC1C[NH+](Cc2ccccc2F)C1 ZINC000895953407 583752072 /nfs/dbraw/zinc/75/20/72/583752072.db2.gz XMFUQXSWXURXBZ-UHFFFAOYSA-N 1 2 223.291 2.435 20 0 BEADLO COCC1C[NH+](Cc2ccsc2Cl)C1 ZINC000895969721 583755336 /nfs/dbraw/zinc/75/53/36/583755336.db2.gz MBOHDJSGEMLZET-UHFFFAOYSA-N 1 2 231.748 2.480 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857979314 588927237 /nfs/dbraw/zinc/92/72/37/588927237.db2.gz AYKBSGPTLDTYRD-HUYFXPKMSA-N 1 2 247.342 2.437 20 0 BEADLO CCS[C@H](C)c1noc(C2([NH+](C)C)CC2)n1 ZINC000896144181 583774299 /nfs/dbraw/zinc/77/42/99/583774299.db2.gz PZIUWOFRRZWXKS-MRVPVSSYSA-N 1 2 241.360 2.434 20 0 BEADLO O=C(C[C@@H]1C=CCCC1)N[C@H]1CCn2c[nH+]cc21 ZINC000857981121 588928249 /nfs/dbraw/zinc/92/82/49/588928249.db2.gz ACBZNPGYURUWSO-NEPJUHHUSA-N 1 2 245.326 2.191 20 0 BEADLO c1ccc(NC[C@H]2CCC3(CCOCC3)O2)[nH+]c1 ZINC000896170027 583776973 /nfs/dbraw/zinc/77/69/73/583776973.db2.gz JNEZODNDJOQORR-GFCCVEGCSA-N 1 2 248.326 2.222 20 0 BEADLO CCC[C@H](O)CCNc1ccc([C@@H](C)O)c[nH+]1 ZINC000896181849 583778298 /nfs/dbraw/zinc/77/82/98/583778298.db2.gz GLQXWSYCFGHGNZ-PWSUYJOCSA-N 1 2 238.331 2.098 20 0 BEADLO Cc1cscc1C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857983580 588928587 /nfs/dbraw/zinc/92/85/87/588928587.db2.gz STMBGAFLFSCLRO-SNVBAGLBSA-N 1 2 247.323 2.128 20 0 BEADLO CCC[C@H](O)CCNc1nc[nH+]c(C)c1C ZINC000896183945 583779555 /nfs/dbraw/zinc/77/95/55/583779555.db2.gz RCFQRGNPRJPDCL-NSHDSACASA-N 1 2 223.320 2.056 20 0 BEADLO Cc1[nH+]cnc(NC[C@@]2(C)CCCCO2)c1C ZINC000896179935 583779765 /nfs/dbraw/zinc/77/97/65/583779765.db2.gz BGMMVCWAOCEFJG-CYBMUJFWSA-N 1 2 235.331 2.465 20 0 BEADLO CCc1nc(NC[C@@]2(C)CCCCO2)cc[nH+]1 ZINC000896179638 583779811 /nfs/dbraw/zinc/77/98/11/583779811.db2.gz WBYVWDLGXZENBI-CYBMUJFWSA-N 1 2 235.331 2.410 20 0 BEADLO CC1(C)C(C(=O)N[C@@H]2CCn3c[nH+]cc32)C1(C)C ZINC000857983573 588928796 /nfs/dbraw/zinc/92/87/96/588928796.db2.gz SSKRXMOKBMBGKV-SECBINFHSA-N 1 2 247.342 2.126 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N[C@H]2CCC[C@H]2C)c[nH+]1 ZINC000896187511 583780819 /nfs/dbraw/zinc/78/08/19/583780819.db2.gz PUOGSRMEIAGJQF-PWSUYJOCSA-N 1 2 249.358 2.231 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N[C@@H]2CCC[C@@H]2C)c[nH+]1 ZINC000896187509 583780823 /nfs/dbraw/zinc/78/08/23/583780823.db2.gz PUOGSRMEIAGJQF-CMPLNLGQSA-N 1 2 249.358 2.231 20 0 BEADLO C[C@@H]1CCC[C@@H]1CC(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857983296 588928856 /nfs/dbraw/zinc/92/88/56/588928856.db2.gz ZPJNQBFYGWTROI-UTUOFQBUSA-N 1 2 247.342 2.270 20 0 BEADLO O=C(C=C1CCCCC1)N[C@H]1CCn2c[nH+]cc21 ZINC000857983174 588928927 /nfs/dbraw/zinc/92/89/27/588928927.db2.gz PKQRPGADXMIQGT-LBPRGKRZSA-N 1 2 245.326 2.335 20 0 BEADLO Cc1nc(N[C@@H]2CCS[C@@H](C)C2)cc[nH+]1 ZINC000896246642 583784963 /nfs/dbraw/zinc/78/49/63/583784963.db2.gz QJYPUUIBFHRICY-WCBMZHEXSA-N 1 2 223.345 2.481 20 0 BEADLO CC(C)(C)/C=C/C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857985963 588929178 /nfs/dbraw/zinc/92/91/78/588929178.db2.gz MTNHCXTVHRXTMY-DFVUYQKZSA-N 1 2 233.315 2.046 20 0 BEADLO O=C(N[C@@H]1CCn2c[nH+]cc21)C1CCCCCC1 ZINC000857985942 588929366 /nfs/dbraw/zinc/92/93/66/588929366.db2.gz SDZHHPOGWFBOFS-GFCCVEGCSA-N 1 2 247.342 2.415 20 0 BEADLO CCCCC(=O)N1CCNc2[nH+]cc(C)cc21 ZINC000857996295 588929825 /nfs/dbraw/zinc/92/98/25/588929825.db2.gz XAGNFTBZXTUUJZ-UHFFFAOYSA-N 1 2 233.315 2.339 20 0 BEADLO CC[C@@H](C)C(=O)N1CCNc2[nH+]cc(C)cc21 ZINC000857995782 588929897 /nfs/dbraw/zinc/92/98/97/588929897.db2.gz GZJSFBNDUXJLMQ-SNVBAGLBSA-N 1 2 233.315 2.195 20 0 BEADLO CC1(C)O[C@@H]2C[C@@H](Nc3cccc[nH+]3)C[C@@H]2O1 ZINC000896372711 583797706 /nfs/dbraw/zinc/79/77/06/583797706.db2.gz ZJBXCWSVBDTOLJ-RTCCRHLQSA-N 1 2 234.299 2.176 20 0 BEADLO CCO[C@H]1CCN(c2cc[nH+]c3ccncc32)C1 ZINC000896407353 583800633 /nfs/dbraw/zinc/80/06/33/583800633.db2.gz SFFNSXDMXGOQAS-NSHDSACASA-N 1 2 243.310 2.245 20 0 BEADLO COC[C@@H](CNc1cc[nH+]c(C)n1)C(C)C ZINC000896503046 583807876 /nfs/dbraw/zinc/80/78/76/583807876.db2.gz MNYXKVZXNNJAGS-LLVKDONJSA-N 1 2 223.320 2.116 20 0 BEADLO Cc1ccc(C[N@@H+]2CCn3cccc3C2)o1 ZINC000896759482 583831122 /nfs/dbraw/zinc/83/11/22/583831122.db2.gz BEALOVOJQYFEEH-UHFFFAOYSA-N 1 2 216.284 2.405 20 0 BEADLO Cc1ccc(C[N@H+]2CCn3cccc3C2)o1 ZINC000896759482 583831123 /nfs/dbraw/zinc/83/11/23/583831123.db2.gz BEALOVOJQYFEEH-UHFFFAOYSA-N 1 2 216.284 2.405 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCn3cccc3C2)o1 ZINC000896763791 583831394 /nfs/dbraw/zinc/83/13/94/583831394.db2.gz RMWWTAADZHIHIW-UHFFFAOYSA-N 1 2 246.310 2.496 20 0 BEADLO CCOc1ccc(C[N@H+]2CCn3cccc3C2)o1 ZINC000896763791 583831396 /nfs/dbraw/zinc/83/13/96/583831396.db2.gz RMWWTAADZHIHIW-UHFFFAOYSA-N 1 2 246.310 2.496 20 0 BEADLO CC[NH+](CC)Cc1nc(C2(SC)CC2)no1 ZINC000896780737 583832647 /nfs/dbraw/zinc/83/26/47/583832647.db2.gz CBSPDTJPQVDADX-UHFFFAOYSA-N 1 2 241.360 2.264 20 0 BEADLO CC(C)(CNc1nc(N)[nH+]c(C2CC2)n1)C1CC1 ZINC000896782997 583833237 /nfs/dbraw/zinc/83/32/37/583833237.db2.gz IBBMIKOHBHZABL-UHFFFAOYSA-N 1 2 247.346 2.179 20 0 BEADLO CC(C)(CNc1nc(N)nc(C2CC2)[nH+]1)C1CC1 ZINC000896782997 583833238 /nfs/dbraw/zinc/83/32/38/583833238.db2.gz IBBMIKOHBHZABL-UHFFFAOYSA-N 1 2 247.346 2.179 20 0 BEADLO CCc1nc(NC[C@H]2CC[C@@H](C3CC3)O2)cc[nH+]1 ZINC000896800215 583834790 /nfs/dbraw/zinc/83/47/90/583834790.db2.gz ZHIIBODALMMFKC-NEPJUHHUSA-N 1 2 247.342 2.409 20 0 BEADLO C[C@@H]1C[C@@H]([NH2+]Cc2ccnc(F)c2)c2nccn21 ZINC000858171741 588936679 /nfs/dbraw/zinc/93/66/79/588936679.db2.gz BTSSCYVJONLTCB-MWLCHTKSSA-N 1 2 246.289 2.213 20 0 BEADLO Cc1[nH]c(CNC(=O)C(C)(C)C2CC2)[nH+]c1C ZINC000896909998 583852641 /nfs/dbraw/zinc/85/26/41/583852641.db2.gz KAQSTOIHGQDSOI-UHFFFAOYSA-N 1 2 235.331 2.079 20 0 BEADLO CCc1occc1C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000896910977 583852998 /nfs/dbraw/zinc/85/29/98/583852998.db2.gz VRSQBKNKKDDTIU-UHFFFAOYSA-N 1 2 247.298 2.112 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@H]2CC[C@@H](C)C2)[nH+]c1C ZINC000896913270 583853948 /nfs/dbraw/zinc/85/39/48/583853948.db2.gz QASYSNRRJCSNAX-KCJUWKMLSA-N 1 2 235.331 2.079 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H](C)CC(C)C)[nH+]c1C ZINC000896913349 583854139 /nfs/dbraw/zinc/85/41/39/583854139.db2.gz DRCJZJLBHASVLZ-VIFPVBQESA-N 1 2 237.347 2.325 20 0 BEADLO Cc1cc(C)c(C(=O)NCc2[nH]c(C)c(C)[nH+]2)o1 ZINC000896916576 583855077 /nfs/dbraw/zinc/85/50/77/583855077.db2.gz ZUXMRSVUEFJEJG-UHFFFAOYSA-N 1 2 247.298 2.166 20 0 BEADLO CCC(CC)CC(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000896916847 583855541 /nfs/dbraw/zinc/85/55/41/583855541.db2.gz LPIWYQIMCDMTQD-UHFFFAOYSA-N 1 2 237.347 2.469 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@H]2CCC[C@H](C)C2)[nH+]c1C ZINC000896918703 583856071 /nfs/dbraw/zinc/85/60/71/583856071.db2.gz FJSVYOFZJNHDHN-CABZTGNLSA-N 1 2 249.358 2.469 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H](C)c2ccco2)[nH+]c1C ZINC000896918770 583856178 /nfs/dbraw/zinc/85/61/78/583856178.db2.gz HFFIOTYQNOXNHA-QMMMGPOBSA-N 1 2 247.298 2.039 20 0 BEADLO CONC(=O)C[NH2+][C@H](C)CCC1CCCCC1 ZINC000896926360 583859569 /nfs/dbraw/zinc/85/95/69/583859569.db2.gz ITAVQJZOUMTGOJ-LLVKDONJSA-N 1 2 242.363 2.003 20 0 BEADLO Cc1ccsc1C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000896930150 583860603 /nfs/dbraw/zinc/86/06/03/583860603.db2.gz UTCIKRAKPZHIOH-UHFFFAOYSA-N 1 2 249.339 2.326 20 0 BEADLO CC(C)Cc1cc(N[C@@H]2CCC[C@@H]2CO)nc[nH+]1 ZINC000896965403 583865023 /nfs/dbraw/zinc/86/50/23/583865023.db2.gz IHGRMPILWJGKRS-DGCLKSJQSA-N 1 2 249.358 2.248 20 0 BEADLO C[C@H]1CC2(CC(Nc3cc[nH+]cc3F)C2)CO1 ZINC000897046840 583872767 /nfs/dbraw/zinc/87/27/67/583872767.db2.gz WEBWZIVCKWXNBD-JBLZRFIASA-N 1 2 236.290 2.012 20 0 BEADLO C[C@H](CCO)[NH2+]c1ccc2c(c1)C[C@@H](C)O2 ZINC000897107181 583880786 /nfs/dbraw/zinc/88/07/86/583880786.db2.gz BPVNAWQSSAIPOB-NXEZZACHSA-N 1 2 221.300 2.193 20 0 BEADLO C[C@H](CCO)[NH2+]c1ccc2c(c1)C[C@H](C)O2 ZINC000897107184 583881011 /nfs/dbraw/zinc/88/10/11/583881011.db2.gz BPVNAWQSSAIPOB-ZJUUUORDSA-N 1 2 221.300 2.193 20 0 BEADLO CO[C@H]1CC[C@@H]1N(C)c1cc(C)[nH+]c(C2CC2)n1 ZINC000897148560 583884440 /nfs/dbraw/zinc/88/44/40/583884440.db2.gz GMUXKXKMGUBSAG-RYUDHWBXSA-N 1 2 247.342 2.276 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N2CC(C(C)C)C2)c[nH+]1 ZINC000897184098 583888776 /nfs/dbraw/zinc/88/87/76/583888776.db2.gz OHBOLVKEAPVAEA-UHFFFAOYSA-N 1 2 249.358 2.041 20 0 BEADLO Nc1[nH+]cnc(N[C@@H]2C[C@H]3CCC[C@H]32)c1Cl ZINC000897179711 583891214 /nfs/dbraw/zinc/89/12/14/583891214.db2.gz JUZNCGIBWWBFSS-BWZBUEFSSA-N 1 2 238.722 2.313 20 0 BEADLO Nc1nc[nH+]c(N[C@@H]2C[C@H]3CCC[C@H]32)c1Cl ZINC000897179711 583891215 /nfs/dbraw/zinc/89/12/15/583891215.db2.gz JUZNCGIBWWBFSS-BWZBUEFSSA-N 1 2 238.722 2.313 20 0 BEADLO C[C@H](Cc1cccnc1)Nc1cc(CO)cc[nH+]1 ZINC000897194393 583893918 /nfs/dbraw/zinc/89/39/18/583893918.db2.gz DPVZVXDMDLQSLT-LLVKDONJSA-N 1 2 243.310 2.012 20 0 BEADLO Cc1nc(C[NH2+]Cc2ccnc(F)c2)cs1 ZINC000858102033 588933298 /nfs/dbraw/zinc/93/32/98/588933298.db2.gz OZPWJPVTQQYZMP-UHFFFAOYSA-N 1 2 237.303 2.275 20 0 BEADLO C/C=C/C=C\C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000728542128 583896485 /nfs/dbraw/zinc/89/64/85/583896485.db2.gz MGLNFJFGSOBAGS-XGZIJWKSSA-N 1 2 245.326 2.179 20 0 BEADLO CC/C=C(/C)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000728539254 583897247 /nfs/dbraw/zinc/89/72/47/583897247.db2.gz VVEXQUFPHWNDJA-XLVZXTRVSA-N 1 2 247.342 2.403 20 0 BEADLO CC(C)(C)c1nc(NC2CC(CCO)C2)cc[nH+]1 ZINC000897234112 583898867 /nfs/dbraw/zinc/89/88/67/583898867.db2.gz KEDSFVRZLPRRMR-UHFFFAOYSA-N 1 2 249.358 2.347 20 0 BEADLO CC1(C)CCC[C@@H](CNc2cc[nH+]cc2F)O1 ZINC000897253989 583903777 /nfs/dbraw/zinc/90/37/77/583903777.db2.gz JSTVHUCAJXPJFG-JTQLQIEISA-N 1 2 238.306 2.402 20 0 BEADLO CCc1nc(N2CC[C@@H]3CCC[C@@H]32)cc[nH+]1 ZINC000897289139 583910328 /nfs/dbraw/zinc/91/03/28/583910328.db2.gz IBWPLNFWUOGLOQ-QWRGUYRKSA-N 1 2 217.316 2.418 20 0 BEADLO C[C@@H]([NH2+]Cc1cc2n(n1)CCC2)c1ccns1 ZINC000858319003 588945069 /nfs/dbraw/zinc/94/50/69/588945069.db2.gz WHJYTKTUORGSOQ-SECBINFHSA-N 1 2 248.355 2.137 20 0 BEADLO CC[C@H](C)Oc1cc(-n2cc[nH+]c2)nc(C)n1 ZINC000858324512 588945767 /nfs/dbraw/zinc/94/57/67/588945767.db2.gz SDYNFCKQLIEPEY-VIFPVBQESA-N 1 2 232.287 2.148 20 0 BEADLO CC(C)c1nc(N[C@@H]2COC[C@H]2C2CC2)cc[nH+]1 ZINC000897446065 583986688 /nfs/dbraw/zinc/98/66/88/583986688.db2.gz BSMSNSMNFZRMNP-NWDGAFQWSA-N 1 2 247.342 2.437 20 0 BEADLO CCC/C=C/C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000729350672 583993751 /nfs/dbraw/zinc/99/37/51/583993751.db2.gz GSQOKODVGMCOQC-SNAWJCMRSA-N 1 2 247.342 2.403 20 0 BEADLO Cl/C=C\CNc1cc(N2CCCC2)nc[nH+]1 ZINC000897505097 583998313 /nfs/dbraw/zinc/99/83/13/583998313.db2.gz IUBRKERPFZAOHA-ARJAWSKDSA-N 1 2 238.722 2.241 20 0 BEADLO Cl/C=C\CNc1cc(N2CCCC2)[nH+]cn1 ZINC000897505097 583998314 /nfs/dbraw/zinc/99/83/14/583998314.db2.gz IUBRKERPFZAOHA-ARJAWSKDSA-N 1 2 238.722 2.241 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N2CCC=C(C)C2)c[nH+]1 ZINC000897641123 584034814 /nfs/dbraw/zinc/03/48/14/584034814.db2.gz WAIKADJGGSFNIM-UHFFFAOYSA-N 1 2 247.342 2.105 20 0 BEADLO Cn1cncc1C[NH2+][C@@H]1CCCc2scnc21 ZINC000858418315 588952952 /nfs/dbraw/zinc/95/29/52/588952952.db2.gz PXNWDTOCAZONDY-SNVBAGLBSA-N 1 2 248.355 2.044 20 0 BEADLO Cc1ccc(F)c(C[NH2+]Cc2cn(C)cn2)c1 ZINC000898045006 584073034 /nfs/dbraw/zinc/07/30/34/584073034.db2.gz GBPNBAMEBMNUEE-UHFFFAOYSA-N 1 2 233.290 2.157 20 0 BEADLO Fc1nccnc1N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000858437293 588954741 /nfs/dbraw/zinc/95/47/41/588954741.db2.gz XLXMWABXKZJWOW-VIFPVBQESA-N 1 2 247.277 2.070 20 0 BEADLO Fc1cnccc1C[NH+]1CC(Cc2ccoc2)C1 ZINC000898160290 584087859 /nfs/dbraw/zinc/08/78/59/584087859.db2.gz YNVRLARQLCBWLN-UHFFFAOYSA-N 1 2 246.285 2.488 20 0 BEADLO Cc1ccc(C[N@@H+]2CC[C@@H](O)[C@@H](F)C2)c(F)c1 ZINC000898184540 584092857 /nfs/dbraw/zinc/09/28/57/584092857.db2.gz UQPSFQJETWIFIH-QWHCGFSZSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1ccc(C[N@H+]2CC[C@@H](O)[C@@H](F)C2)c(F)c1 ZINC000898184540 584092859 /nfs/dbraw/zinc/09/28/59/584092859.db2.gz UQPSFQJETWIFIH-QWHCGFSZSA-N 1 2 241.281 2.039 20 0 BEADLO O[C@@H]1CC[N@H+](Cc2ccc3occc3c2)C[C@H]1F ZINC000898187552 584094379 /nfs/dbraw/zinc/09/43/79/584094379.db2.gz GVQBUEOSCKIMSQ-CHWSQXEVSA-N 1 2 249.285 2.338 20 0 BEADLO O[C@@H]1CC[N@@H+](Cc2ccc3occc3c2)C[C@H]1F ZINC000898187552 584094381 /nfs/dbraw/zinc/09/43/81/584094381.db2.gz GVQBUEOSCKIMSQ-CHWSQXEVSA-N 1 2 249.285 2.338 20 0 BEADLO C[C@H]1CC[C@@H](C(=O)NCC(C)(C)n2cc[nH+]c2)C1 ZINC000898905865 584164981 /nfs/dbraw/zinc/16/49/81/584164981.db2.gz HXSYLYBYRKTGOF-NWDGAFQWSA-N 1 2 249.358 2.171 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NCC(C)(C)n2cc[nH+]c2)C1 ZINC000898905868 584164987 /nfs/dbraw/zinc/16/49/87/584164987.db2.gz HXSYLYBYRKTGOF-VXGBXAGGSA-N 1 2 249.358 2.171 20 0 BEADLO CC(C)[C@H]1C[C@H]1C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000898906246 584165277 /nfs/dbraw/zinc/16/52/77/584165277.db2.gz KKKZKRUVEVTUBB-VXGBXAGGSA-N 1 2 249.358 2.027 20 0 BEADLO CCC[C@@H](C)CCNC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000899203773 584180947 /nfs/dbraw/zinc/18/09/47/584180947.db2.gz SYTPAVTXMZDNNG-IJLUTSLNSA-N 1 2 249.358 2.456 20 0 BEADLO CCC[C@@H](C)CCNC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000899203773 584180948 /nfs/dbraw/zinc/18/09/48/584180948.db2.gz SYTPAVTXMZDNNG-IJLUTSLNSA-N 1 2 249.358 2.456 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccn(C)n1)c1ccns1 ZINC000858577925 588968381 /nfs/dbraw/zinc/96/83/81/588968381.db2.gz VWWVVVNDWIUCJD-DTWKUNHWSA-N 1 2 236.344 2.288 20 0 BEADLO O=C(CNc1cccc[nH+]1)NC1CCCCCC1 ZINC000899930415 584255812 /nfs/dbraw/zinc/25/58/12/584255812.db2.gz DTTCNBMYQDIQPH-UHFFFAOYSA-N 1 2 247.342 2.333 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)Nc1ccc2c(c1)CCC2 ZINC000899941163 584258890 /nfs/dbraw/zinc/25/88/90/584258890.db2.gz ACTUKVZZGFFWPM-UHFFFAOYSA-N 1 2 241.294 2.080 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)Nc1ccc2c(c1)CCC2 ZINC000899941163 584258892 /nfs/dbraw/zinc/25/88/92/584258892.db2.gz ACTUKVZZGFFWPM-UHFFFAOYSA-N 1 2 241.294 2.080 20 0 BEADLO Cc1ccccc1[C@@H](C)NC(=O)Cc1c[nH]c[nH+]1 ZINC000899964851 584261246 /nfs/dbraw/zinc/26/12/46/584261246.db2.gz ODGGWXMLVKHUOJ-LLVKDONJSA-N 1 2 243.310 2.138 20 0 BEADLO Cc1ccccc1[C@@H](C)NC(=O)Cc1c[nH+]c[nH]1 ZINC000899964851 584261249 /nfs/dbraw/zinc/26/12/49/584261249.db2.gz ODGGWXMLVKHUOJ-LLVKDONJSA-N 1 2 243.310 2.138 20 0 BEADLO CCC[C@@H](CC)C(=O)OCCc1c[nH+]cn1C ZINC000873422425 584266718 /nfs/dbraw/zinc/26/67/18/584266718.db2.gz YKZRQCDJUNHRCA-LLVKDONJSA-N 1 2 238.331 2.332 20 0 BEADLO O=C(CNc1cccc[nH+]1)N1CCCCCCC1 ZINC000900052339 584268599 /nfs/dbraw/zinc/26/85/99/584268599.db2.gz GPJOPDSKWANRQP-UHFFFAOYSA-N 1 2 247.342 2.286 20 0 BEADLO CC(C)CCC[C@@H](C)NC(=O)Cc1c[nH]c[nH+]1 ZINC000900096526 584273755 /nfs/dbraw/zinc/27/37/55/584273755.db2.gz GUGXNOLKICSODJ-LLVKDONJSA-N 1 2 237.347 2.283 20 0 BEADLO CC(C)CCC[C@@H](C)NC(=O)Cc1c[nH+]c[nH]1 ZINC000900096526 584273757 /nfs/dbraw/zinc/27/37/57/584273757.db2.gz GUGXNOLKICSODJ-LLVKDONJSA-N 1 2 237.347 2.283 20 0 BEADLO C[C@@H](N(C)C(=O)CNc1cccc[nH+]1)C(C)(C)C ZINC000900119995 584274758 /nfs/dbraw/zinc/27/47/58/584274758.db2.gz UKLOWRSTGQLXHA-LLVKDONJSA-N 1 2 249.358 2.387 20 0 BEADLO CC(C)(C)CCNC(=O)CNc1cccc[nH+]1 ZINC000900183073 584283671 /nfs/dbraw/zinc/28/36/71/584283671.db2.gz PXIUEOGGKHIBLQ-UHFFFAOYSA-N 1 2 235.331 2.046 20 0 BEADLO CCCCCN(C(=O)Cc1c[nH+]c[nH]1)C(C)C ZINC000900301437 584292588 /nfs/dbraw/zinc/29/25/88/584292588.db2.gz QXSKIUKIJPJBAV-UHFFFAOYSA-N 1 2 237.347 2.379 20 0 BEADLO CCCC1CCC(NC(=O)Cc2c[nH]c[nH+]2)CC1 ZINC000900344365 584296422 /nfs/dbraw/zinc/29/64/22/584296422.db2.gz HVUCWXRWOHMAQQ-UHFFFAOYSA-N 1 2 249.358 2.427 20 0 BEADLO CCCC1CCC(NC(=O)Cc2c[nH+]c[nH]2)CC1 ZINC000900344365 584296423 /nfs/dbraw/zinc/29/64/23/584296423.db2.gz HVUCWXRWOHMAQQ-UHFFFAOYSA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)CNc1cccc[nH+]1 ZINC000900365669 584296914 /nfs/dbraw/zinc/29/69/14/584296914.db2.gz PVILJBRHRSBEBQ-WDEREUQCSA-N 1 2 235.331 2.044 20 0 BEADLO CC(C)[C@@H]1CCCN1C(=O)CNc1cccc[nH+]1 ZINC000900378358 584299236 /nfs/dbraw/zinc/29/92/36/584299236.db2.gz IIWHSQIEMUNMFD-LBPRGKRZSA-N 1 2 247.342 2.141 20 0 BEADLO C[C@H]1CCCN(C(=O)CNc2cccc[nH+]2)CC1 ZINC000900418544 584306378 /nfs/dbraw/zinc/30/63/78/584306378.db2.gz YFRVYCWECNZOMR-LBPRGKRZSA-N 1 2 247.342 2.142 20 0 BEADLO C[C@H]1CCCC[C@@H]1CCNC(=O)Cc1c[nH]c[nH+]1 ZINC000900718085 584344632 /nfs/dbraw/zinc/34/46/32/584344632.db2.gz JSPLGRJNYUDVJZ-NWDGAFQWSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H]1CCCC[C@@H]1CCNC(=O)Cc1c[nH+]c[nH]1 ZINC000900718085 584344633 /nfs/dbraw/zinc/34/46/33/584344633.db2.gz JSPLGRJNYUDVJZ-NWDGAFQWSA-N 1 2 249.358 2.285 20 0 BEADLO CCC(C)(C)N(C)C(=O)CNc1cccc[nH+]1 ZINC000900758862 584345997 /nfs/dbraw/zinc/34/59/97/584345997.db2.gz RAMHGARLQAKCLI-UHFFFAOYSA-N 1 2 235.331 2.141 20 0 BEADLO C[C@H]1CCCN(C(=O)CNc2cccc[nH+]2)[C@H]1C ZINC000900829084 584354994 /nfs/dbraw/zinc/35/49/94/584354994.db2.gz NDSRATNJXSWFJJ-RYUDHWBXSA-N 1 2 247.342 2.141 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)N1CCC2(C1)CCCCC2 ZINC000900845604 584356642 /nfs/dbraw/zinc/35/66/42/584356642.db2.gz UNVZTUFGACZXHX-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)N[C@@H]1CC[C@H]2CCC[C@@H]2C1 ZINC000900851144 584357289 /nfs/dbraw/zinc/35/72/89/584357289.db2.gz AGLSPGWPQQUHEP-IJLUTSLNSA-N 1 2 247.342 2.037 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)N[C@@H]1CC[C@H]2CCC[C@@H]2C1 ZINC000900851144 584357291 /nfs/dbraw/zinc/35/72/91/584357291.db2.gz AGLSPGWPQQUHEP-IJLUTSLNSA-N 1 2 247.342 2.037 20 0 BEADLO CC[C@@H](C)C[C@@H](C)NC(=O)CNc1cccc[nH+]1 ZINC000900861689 584358465 /nfs/dbraw/zinc/35/84/65/584358465.db2.gz DJMXDFUBSXWIKI-VXGBXAGGSA-N 1 2 249.358 2.434 20 0 BEADLO CCC[C@]1(C)CCCN(C(=O)Cc2c[nH+]c[nH]2)C1 ZINC000900897095 584362474 /nfs/dbraw/zinc/36/24/74/584362474.db2.gz KHHXOLWUSQRBHR-CQSZACIVSA-N 1 2 249.358 2.381 20 0 BEADLO CC[C@H](O)[C@@H](C)C(=O)Nc1ccc(C)[nH+]c1C ZINC000901014597 584374339 /nfs/dbraw/zinc/37/43/39/584374339.db2.gz VJQULUIBPDKWRZ-SKDRFNHKSA-N 1 2 236.315 2.044 20 0 BEADLO CC[C@@H](O)[C@H](C)C(=O)Nc1ccc(C)[nH+]c1C ZINC000901014396 584374474 /nfs/dbraw/zinc/37/44/74/584374474.db2.gz VJQULUIBPDKWRZ-JOYOIKCWSA-N 1 2 236.315 2.044 20 0 BEADLO CCC(CC)(CC)CNC(=O)Cc1c[nH]c[nH+]1 ZINC000901041357 584376880 /nfs/dbraw/zinc/37/68/80/584376880.db2.gz PHOULJZCIGPXLC-UHFFFAOYSA-N 1 2 237.347 2.285 20 0 BEADLO CCC(CC)(CC)CNC(=O)Cc1c[nH+]c[nH]1 ZINC000901041357 584376882 /nfs/dbraw/zinc/37/68/82/584376882.db2.gz PHOULJZCIGPXLC-UHFFFAOYSA-N 1 2 237.347 2.285 20 0 BEADLO O=C(CNc1cccc[nH+]1)NCCC1=CCCC1 ZINC000901192507 584396667 /nfs/dbraw/zinc/39/66/67/584396667.db2.gz MVJDWDYJDMSUEJ-UHFFFAOYSA-N 1 2 245.326 2.110 20 0 BEADLO CNc1[nH+]c(C)ccc1C(=O)NOC1CCCC1 ZINC000901329902 584424388 /nfs/dbraw/zinc/42/43/88/584424388.db2.gz NQFNRWCBAWMUDE-UHFFFAOYSA-N 1 2 249.314 2.036 20 0 BEADLO CC(C)[C@H]([NH2+]CCCCCO)C(F)(F)F ZINC000901414156 584441685 /nfs/dbraw/zinc/44/16/85/584441685.db2.gz ORBLJUNOKQKZOC-VIFPVBQESA-N 1 2 227.270 2.326 20 0 BEADLO Cc1nc(Cl)n(Cc2cc(C)cc(C)[nH+]2)n1 ZINC000901594674 584465795 /nfs/dbraw/zinc/46/57/95/584465795.db2.gz KWHLQRXKHFBWML-UHFFFAOYSA-N 1 2 236.706 2.300 20 0 BEADLO c1cn(CCSCc2ccncc2)c[nH+]1 ZINC000901629868 584470493 /nfs/dbraw/zinc/47/04/93/584470493.db2.gz GYKHZMGPHWCICN-UHFFFAOYSA-N 1 2 219.313 2.212 20 0 BEADLO Cn1c(CCSC2COC2)[nH+]c2ccccc21 ZINC000901642627 584474264 /nfs/dbraw/zinc/47/42/64/584474264.db2.gz PLHMMPUHYHDECK-UHFFFAOYSA-N 1 2 248.351 2.248 20 0 BEADLO Cc1cc(CSCc2[nH+]ccn2C)no1 ZINC000901715372 584487728 /nfs/dbraw/zinc/48/77/28/584487728.db2.gz TXSKRESOIVBCTM-UHFFFAOYSA-N 1 2 223.301 2.150 20 0 BEADLO CCn1cnc(C[NH2+][C@@H](C)c2ccccn2)c1 ZINC000902029515 584513527 /nfs/dbraw/zinc/51/35/27/584513527.db2.gz YKKQZBJSUQVWAW-NSHDSACASA-N 1 2 230.315 2.149 20 0 BEADLO CCn1cnc(C[NH2+][C@H](C)c2ccccn2)c1 ZINC000902029514 584513536 /nfs/dbraw/zinc/51/35/36/584513536.db2.gz YKKQZBJSUQVWAW-LLVKDONJSA-N 1 2 230.315 2.149 20 0 BEADLO Cc1cnc(NCc2[nH]c(C)c(C)[nH+]2)s1 ZINC000902043611 584516024 /nfs/dbraw/zinc/51/60/24/584516024.db2.gz YXXXEICLYFWKBL-UHFFFAOYSA-N 1 2 222.317 2.404 20 0 BEADLO COCc1ccc(CNc2cc[nH+]c(C)n2)o1 ZINC000902124779 584529168 /nfs/dbraw/zinc/52/91/68/584529168.db2.gz KUSXTSMQXYASJG-UHFFFAOYSA-N 1 2 233.271 2.137 20 0 BEADLO CCCn1nccc1CNc1cc[nH+]c(C)n1 ZINC000902127472 584529300 /nfs/dbraw/zinc/52/93/00/584529300.db2.gz SJUVHZPZOPMNAU-UHFFFAOYSA-N 1 2 231.303 2.004 20 0 BEADLO C[C@@H]1C[N@H+](CN2CCOC2=O)[C@H]1c1ccccc1 ZINC000902164436 584533512 /nfs/dbraw/zinc/53/35/12/584533512.db2.gz FPTYTQRVUFDPEZ-DGCLKSJQSA-N 1 2 246.310 2.089 20 0 BEADLO C[C@@H]1C[N@@H+](CN2CCOC2=O)[C@H]1c1ccccc1 ZINC000902164436 584533515 /nfs/dbraw/zinc/53/35/15/584533515.db2.gz FPTYTQRVUFDPEZ-DGCLKSJQSA-N 1 2 246.310 2.089 20 0 BEADLO Cc1cc(NCc2cn(C)nc2C2CC2)nc[nH+]1 ZINC000902196384 584536660 /nfs/dbraw/zinc/53/66/60/584536660.db2.gz TVRHEEXBXGVASQ-UHFFFAOYSA-N 1 2 243.314 2.008 20 0 BEADLO Cc1cc(NCc2cnn(C(C)(C)C)c2)nc[nH+]1 ZINC000902198853 584537395 /nfs/dbraw/zinc/53/73/95/584537395.db2.gz JCTFAYASXMJJHO-UHFFFAOYSA-N 1 2 245.330 2.349 20 0 BEADLO CC(C)OCC(N)=[NH+]OC[C@H]1C[C@H]2C=C[C@@H]1C2 ZINC000902220503 584540339 /nfs/dbraw/zinc/54/03/39/584540339.db2.gz GCAPKHZMICODIM-QJPTWQEYSA-N 1 2 238.331 2.122 20 0 BEADLO NC(=[NH+]OCC[C@@H]1C[C@H]1C1CC1)[C@H]1CCCO1 ZINC000902381194 584576831 /nfs/dbraw/zinc/57/68/31/584576831.db2.gz LQRCMFLDURMTQU-GRYCIOLGSA-N 1 2 238.331 2.100 20 0 BEADLO CC(F)(F)CCCOCc1[nH]cc[nH+]1 ZINC000902396887 584585601 /nfs/dbraw/zinc/58/56/01/584585601.db2.gz LAQQTOXXHDECPX-UHFFFAOYSA-N 1 2 204.220 2.362 20 0 BEADLO C[N@H+](Cc1ccoc1)Cc1ccnc(F)c1 ZINC000859089276 588999892 /nfs/dbraw/zinc/99/98/92/588999892.db2.gz NKIFZTBKUKFLFI-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO C[N@@H+](Cc1ccoc1)Cc1ccnc(F)c1 ZINC000859089276 588999894 /nfs/dbraw/zinc/99/98/94/588999894.db2.gz NKIFZTBKUKFLFI-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccnc(F)c2)CC(C)(C)O1 ZINC000859091381 589000231 /nfs/dbraw/zinc/00/02/31/589000231.db2.gz LJBMHWRHGPCTEE-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccnc(F)c2)CC(C)(C)O1 ZINC000859091381 589000233 /nfs/dbraw/zinc/00/02/33/589000233.db2.gz LJBMHWRHGPCTEE-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO CNc1ccccc1C[NH2+]C(CF)CF ZINC000902578246 584637931 /nfs/dbraw/zinc/63/79/31/584637931.db2.gz POFPGUFQHHCXCR-UHFFFAOYSA-N 1 2 214.259 2.126 20 0 BEADLO NC(Cc1ccccc1F)=[NH+]OCC1CC1 ZINC000902623219 584645420 /nfs/dbraw/zinc/64/54/20/584645420.db2.gz OHTFWAAXUUCFLR-UHFFFAOYSA-N 1 2 222.263 2.277 20 0 BEADLO COC/C(C)=C/CO[NH+]=C(N)Cc1ccccc1 ZINC000902699602 584654925 /nfs/dbraw/zinc/65/49/25/584654925.db2.gz KGPSOPMFFKICCL-XYOKQWHBSA-N 1 2 248.326 2.320 20 0 BEADLO C[C@H](O[NH+]=C(N)[C@@H]1CCCO1)c1ccccc1 ZINC000902738713 584663073 /nfs/dbraw/zinc/66/30/73/584663073.db2.gz LRRKIKLNEXMGMG-JQWIXIFHSA-N 1 2 234.299 2.425 20 0 BEADLO C[C@@H](O[NH+]=C(N)[C@@H]1CCCO1)c1ccccc1 ZINC000902738715 584663267 /nfs/dbraw/zinc/66/32/67/584663267.db2.gz LRRKIKLNEXMGMG-PWSUYJOCSA-N 1 2 234.299 2.425 20 0 BEADLO Cn1c[nH+]c2cc(OCC3CCOCC3)ccc21 ZINC000902780549 584669520 /nfs/dbraw/zinc/66/95/20/584669520.db2.gz ZCTMABWBVISSOA-UHFFFAOYSA-N 1 2 246.310 2.379 20 0 BEADLO CSCCOc1ccc2c(c1)[nH+]cn2C ZINC000902779577 584669694 /nfs/dbraw/zinc/66/96/94/584669694.db2.gz DROOBLCKGDFGHM-UHFFFAOYSA-N 1 2 222.313 2.315 20 0 BEADLO Cn1c[nH+]c2cc(OC[C@@H]3CCCOC3)ccc21 ZINC000902781294 584670306 /nfs/dbraw/zinc/67/03/06/584670306.db2.gz MWZRCFXLRRHDDQ-LLVKDONJSA-N 1 2 246.310 2.379 20 0 BEADLO CC(C)OCCOc1ccc2c(c1)[nH+]cn2C ZINC000902781165 584670361 /nfs/dbraw/zinc/67/03/61/584670361.db2.gz HYOZDMAZDHDOPU-UHFFFAOYSA-N 1 2 234.299 2.377 20 0 BEADLO CC[C@H](C)[C@@H](C(=O)OC)[N@@H+]1CCC[C@@H](F)C1 ZINC000902990385 584709204 /nfs/dbraw/zinc/70/92/04/584709204.db2.gz BAGLTHQMFHDFPI-AXFHLTTASA-N 1 2 231.311 2.008 20 0 BEADLO CC[C@H](C)[C@@H](C(=O)OC)[N@H+]1CCC[C@@H](F)C1 ZINC000902990385 584709205 /nfs/dbraw/zinc/70/92/05/584709205.db2.gz BAGLTHQMFHDFPI-AXFHLTTASA-N 1 2 231.311 2.008 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+]2CCC[C@@H](F)C2)cn1 ZINC000902992645 584710592 /nfs/dbraw/zinc/71/05/92/584710592.db2.gz MIGMTEQRYHGOEX-WDEREUQCSA-N 1 2 223.295 2.280 20 0 BEADLO Cc1cnc([C@H](C)[N@H+]2CCC[C@@H](F)C2)cn1 ZINC000902992645 584710593 /nfs/dbraw/zinc/71/05/93/584710593.db2.gz MIGMTEQRYHGOEX-WDEREUQCSA-N 1 2 223.295 2.280 20 0 BEADLO OCc1ccc(F)c(C[N@@H+]2CCC[C@@H](F)C2)c1 ZINC000902993065 584710747 /nfs/dbraw/zinc/71/07/47/584710747.db2.gz QCAMZPNYXJKEKR-GFCCVEGCSA-N 1 2 241.281 2.252 20 0 BEADLO OCc1ccc(F)c(C[N@H+]2CCC[C@@H](F)C2)c1 ZINC000902993065 584710748 /nfs/dbraw/zinc/71/07/48/584710748.db2.gz QCAMZPNYXJKEKR-GFCCVEGCSA-N 1 2 241.281 2.252 20 0 BEADLO O=C(C[N@H+]1CCC[C@@H](F)C1)Nc1ccccc1 ZINC000903000340 584715496 /nfs/dbraw/zinc/71/54/96/584715496.db2.gz FGQRJLVCWOGVOG-LLVKDONJSA-N 1 2 236.290 2.059 20 0 BEADLO O=C(C[N@@H+]1CCC[C@@H](F)C1)Nc1ccccc1 ZINC000903000340 584715497 /nfs/dbraw/zinc/71/54/97/584715497.db2.gz FGQRJLVCWOGVOG-LLVKDONJSA-N 1 2 236.290 2.059 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccnc(F)c2)C[C@@H](C)O1 ZINC000859134077 589007162 /nfs/dbraw/zinc/00/71/62/589007162.db2.gz DCKWOORYTOSOBY-PWSUYJOCSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccnc(F)c2)C[C@@H](C)O1 ZINC000859134077 589007168 /nfs/dbraw/zinc/00/71/68/589007168.db2.gz DCKWOORYTOSOBY-PWSUYJOCSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccnc(F)c2)C[C@H](C)O1 ZINC000859134076 589007407 /nfs/dbraw/zinc/00/74/07/589007407.db2.gz DCKWOORYTOSOBY-JQWIXIFHSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccnc(F)c2)C[C@H](C)O1 ZINC000859134076 589007408 /nfs/dbraw/zinc/00/74/08/589007408.db2.gz DCKWOORYTOSOBY-JQWIXIFHSA-N 1 2 238.306 2.220 20 0 BEADLO CCCn1cc([C@H](C)[NH2+]C/C=C/Cl)nn1 ZINC000903444082 584768547 /nfs/dbraw/zinc/76/85/47/584768547.db2.gz MRHHDTFGSSSDED-MOVJSRMASA-N 1 2 228.727 2.091 20 0 BEADLO C1=CCN(CCOC2CCCCCC2)[NH2+]C1 ZINC000903488537 584780416 /nfs/dbraw/zinc/78/04/16/584780416.db2.gz ISRLRGXRYUETMO-UHFFFAOYSA-N 1 2 224.348 2.102 20 0 BEADLO c1cc(CCCN2CC=CC[NH2+]2)cs1 ZINC000903489000 584780492 /nfs/dbraw/zinc/78/04/92/584780492.db2.gz BQIJMDJKQCGKLO-UHFFFAOYSA-N 1 2 208.330 2.057 20 0 BEADLO Cc1ccccc1CCCN1CC=CC[NH2+]1 ZINC000903488578 584780659 /nfs/dbraw/zinc/78/06/59/584780659.db2.gz LNFZJJYTRFFKOH-UHFFFAOYSA-N 1 2 216.328 2.304 20 0 BEADLO c1ccc([C@H]2CC[C@H](CN3CC=CC[NH2+]3)O2)cc1 ZINC000903490797 584781022 /nfs/dbraw/zinc/78/10/22/584781022.db2.gz IMILHPSYGFEWAQ-HUUCEWRRSA-N 1 2 244.338 2.283 20 0 BEADLO CC1=NO[C@@](C)(C(=O)Nc2ccc(C)[nH+]c2C)C1 ZINC000903886758 584818883 /nfs/dbraw/zinc/81/88/83/584818883.db2.gz ICQNIOWEMZRKND-CYBMUJFWSA-N 1 2 247.298 2.192 20 0 BEADLO CC1=NO[C@](C)(C(=O)Nc2ccc(C)[nH+]c2C)C1 ZINC000903886760 584819244 /nfs/dbraw/zinc/81/92/44/584819244.db2.gz ICQNIOWEMZRKND-ZDUSSCGKSA-N 1 2 247.298 2.192 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1noc([C@H]2C[C@H]2C)n1 ZINC000904272529 584858422 /nfs/dbraw/zinc/85/84/22/584858422.db2.gz FMLSWESRIDRHSS-SVRRBLITSA-N 1 2 230.271 2.146 20 0 BEADLO Cc1[nH+]c(N)ccc1-c1noc(C2CCC2)n1 ZINC000904257293 584859199 /nfs/dbraw/zinc/85/91/99/584859199.db2.gz UOMLZKOJTJZVNQ-UHFFFAOYSA-N 1 2 230.271 2.290 20 0 BEADLO Cc1cccc(C[NH2+]Cc2ccc(Cl)nn2)n1 ZINC000876935989 584888000 /nfs/dbraw/zinc/88/80/00/584888000.db2.gz FYMXNFVVSHISTG-UHFFFAOYSA-N 1 2 248.717 2.123 20 0 BEADLO Cc1cc([C@H]2CCCN2c2cc(C)[nH+]cn2)no1 ZINC000731921040 584931517 /nfs/dbraw/zinc/93/15/17/584931517.db2.gz ZIARMICGLIKIBV-GFCCVEGCSA-N 1 2 244.298 2.423 20 0 BEADLO Cc1cc(NC(=O)c2ncoc2C(C)C)cc[nH+]1 ZINC000732262725 584935152 /nfs/dbraw/zinc/93/51/52/584935152.db2.gz XHCCTSUMAOXNIV-UHFFFAOYSA-N 1 2 245.282 2.176 20 0 BEADLO CC(C)c1cnc(C[NH+]2CCSCC2)o1 ZINC000733307721 584946763 /nfs/dbraw/zinc/94/67/63/584946763.db2.gz PUUIOMPDYTZMJL-UHFFFAOYSA-N 1 2 226.345 2.347 20 0 BEADLO CO[C@@H]1CCC[N@H+](Cc2ncc(C(C)C)o2)C1 ZINC000733309134 584946840 /nfs/dbraw/zinc/94/68/40/584946840.db2.gz BHFBHPBARIBTEO-LLVKDONJSA-N 1 2 238.331 2.409 20 0 BEADLO CO[C@@H]1CCC[N@@H+](Cc2ncc(C(C)C)o2)C1 ZINC000733309134 584946841 /nfs/dbraw/zinc/94/68/41/584946841.db2.gz BHFBHPBARIBTEO-LLVKDONJSA-N 1 2 238.331 2.409 20 0 BEADLO C/C(=C\C(=O)NCc1[nH]cc[nH+]1)c1ccccc1 ZINC000733876699 584954023 /nfs/dbraw/zinc/95/40/23/584954023.db2.gz FUWHPZSNEREPCL-PKNBQFBNSA-N 1 2 241.294 2.129 20 0 BEADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2nonc2C)on1 ZINC000734147750 584957243 /nfs/dbraw/zinc/95/72/43/584957243.db2.gz YDBDWVSPFALXAA-NSHDSACASA-N 1 2 248.286 2.012 20 0 BEADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2nonc2C)on1 ZINC000734147750 584957244 /nfs/dbraw/zinc/95/72/44/584957244.db2.gz YDBDWVSPFALXAA-NSHDSACASA-N 1 2 248.286 2.012 20 0 BEADLO Cc1nonc1C[NH2+]C1(c2ccc(F)cc2)CC1 ZINC000734148898 584957686 /nfs/dbraw/zinc/95/76/86/584957686.db2.gz PSBLFEDOCJUEOV-UHFFFAOYSA-N 1 2 247.273 2.296 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+]C[C@@H]1CCc2ccccc21 ZINC000734158663 584959276 /nfs/dbraw/zinc/95/92/76/584959276.db2.gz KCWLLRNKAJNAGH-AAEUAGOBSA-N 1 2 247.338 2.258 20 0 BEADLO CCC/C=C/C(=O)NCCCNc1cccc[nH+]1 ZINC000736196323 584991263 /nfs/dbraw/zinc/99/12/63/584991263.db2.gz VNPMIZZCLRCQLD-RUDMXATFSA-N 1 2 247.342 2.356 20 0 BEADLO CS[C@H](C)CCC(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819775443 585006781 /nfs/dbraw/zinc/00/67/81/585006781.db2.gz GIRCJEQAMMJRCT-SFYZADRCSA-N 1 2 246.401 2.126 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)[C@@H]2CCCC[C@@H]2C)S1 ZINC000819784513 585007283 /nfs/dbraw/zinc/00/72/83/585007283.db2.gz ROTMWBHNTHVJAL-IVZWLZJFSA-N 1 2 240.372 2.420 20 0 BEADLO CCN(C(=O)Cc1[nH]cc[nH+]1)C1CCCCC1 ZINC000820999130 585015122 /nfs/dbraw/zinc/01/51/22/585015122.db2.gz LJLHSWNDKQXWTP-UHFFFAOYSA-N 1 2 235.331 2.133 20 0 BEADLO CCC(CC)[C@H](C)C(=O)NCc1cn(C)c[nH+]1 ZINC000890109104 585023767 /nfs/dbraw/zinc/02/37/67/585023767.db2.gz BUBUDNMHYIWBSV-JTQLQIEISA-N 1 2 237.347 2.109 20 0 BEADLO O=C(O[C@@H]1CC[N@@H+](CCF)C1)C1CCCCC1 ZINC000788085749 585039153 /nfs/dbraw/zinc/03/91/53/585039153.db2.gz WMKGNIHZPJLQJG-GFCCVEGCSA-N 1 2 243.322 2.154 20 0 BEADLO O=C(O[C@@H]1CC[N@H+](CCF)C1)C1CCCCC1 ZINC000788085749 585039154 /nfs/dbraw/zinc/03/91/54/585039154.db2.gz WMKGNIHZPJLQJG-GFCCVEGCSA-N 1 2 243.322 2.154 20 0 BEADLO CCn1ncc(C[N@H+](C)Cc2ccc(C)cc2)n1 ZINC000838782582 585069835 /nfs/dbraw/zinc/06/98/35/585069835.db2.gz CEMHIRCTIWJKRW-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1ncc(C[N@@H+](C)Cc2ccc(C)cc2)n1 ZINC000838782582 585069836 /nfs/dbraw/zinc/06/98/36/585069836.db2.gz CEMHIRCTIWJKRW-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1ncc(C[N@H+](C)Cc2cccc(C)c2)n1 ZINC000838790161 585070481 /nfs/dbraw/zinc/07/04/81/585070481.db2.gz XUSSUKIYZQKBJT-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1ncc(C[N@@H+](C)Cc2cccc(C)c2)n1 ZINC000838790161 585070482 /nfs/dbraw/zinc/07/04/82/585070482.db2.gz XUSSUKIYZQKBJT-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1ncc(C[NH2+]Cc2ccc(F)c(C)c2)n1 ZINC000838893821 585078741 /nfs/dbraw/zinc/07/87/41/585078741.db2.gz ACNWAVPJTVCVSJ-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO C/C=C(\C)C(=O)OCc1ccc[nH+]c1N(C)C ZINC000838958268 585080871 /nfs/dbraw/zinc/08/08/71/585080871.db2.gz XBWZTMCJHZCUCO-BJMVGYQFSA-N 1 2 234.299 2.157 20 0 BEADLO O[C@H](C[NH2+][C@@H](c1ccccc1)C(F)F)C1CC1 ZINC000839029210 585088306 /nfs/dbraw/zinc/08/83/06/585088306.db2.gz XOTSWXOFUDYGRX-NEPJUHHUSA-N 1 2 241.281 2.353 20 0 BEADLO CC(C)C1(O)C[NH+](Cc2cc3ccccc3[nH]2)C1 ZINC000839133227 585094135 /nfs/dbraw/zinc/09/41/35/585094135.db2.gz NAFFONRIJGEIKG-UHFFFAOYSA-N 1 2 244.338 2.371 20 0 BEADLO c1oc(C2CC2)nc1C[N@@H+]1CCC[C@@H]2COC[C@@H]21 ZINC000839187473 585097150 /nfs/dbraw/zinc/09/71/50/585097150.db2.gz JRRCUVHWZSEHNM-YPMHNXCESA-N 1 2 248.326 2.163 20 0 BEADLO c1oc(C2CC2)nc1C[N@H+]1CCC[C@@H]2COC[C@@H]21 ZINC000839187473 585097151 /nfs/dbraw/zinc/09/71/51/585097151.db2.gz JRRCUVHWZSEHNM-YPMHNXCESA-N 1 2 248.326 2.163 20 0 BEADLO Clc1ccc(C[N@@H+]2C[C@@H]3C[C@H]2CS3)cn1 ZINC000839191145 585097555 /nfs/dbraw/zinc/09/75/55/585097555.db2.gz FGIOYKGWSUQEEV-UWVGGRQHSA-N 1 2 240.759 2.425 20 0 BEADLO Clc1ccc(C[N@H+]2C[C@@H]3C[C@H]2CS3)cn1 ZINC000839191145 585097556 /nfs/dbraw/zinc/09/75/56/585097556.db2.gz FGIOYKGWSUQEEV-UWVGGRQHSA-N 1 2 240.759 2.425 20 0 BEADLO CC(C)c1cnc(C[N@@H+]2C[C@@H]3C[C@H]2CS3)o1 ZINC000839202098 585099508 /nfs/dbraw/zinc/09/95/08/585099508.db2.gz YHOKCNFAEJDMQQ-UWVGGRQHSA-N 1 2 238.356 2.488 20 0 BEADLO CC(C)c1cnc(C[N@H+]2C[C@@H]3C[C@H]2CS3)o1 ZINC000839202098 585099509 /nfs/dbraw/zinc/09/95/09/585099509.db2.gz YHOKCNFAEJDMQQ-UWVGGRQHSA-N 1 2 238.356 2.488 20 0 BEADLO C[N@@H+](Cc1ccon1)C[C@@H]1CC1(Cl)Cl ZINC000740423474 585101626 /nfs/dbraw/zinc/10/16/26/585101626.db2.gz IEOOVXKCPYIULV-ZETCQYMHSA-N 1 2 235.114 2.300 20 0 BEADLO C[N@H+](Cc1ccon1)C[C@@H]1CC1(Cl)Cl ZINC000740423474 585101627 /nfs/dbraw/zinc/10/16/27/585101627.db2.gz IEOOVXKCPYIULV-ZETCQYMHSA-N 1 2 235.114 2.300 20 0 BEADLO CC(C)c1nc(N[C@H](CCO)C2CC2)cc[nH+]1 ZINC000741243344 585111712 /nfs/dbraw/zinc/11/17/12/585111712.db2.gz YLQVIIZYEJWYTM-LLVKDONJSA-N 1 2 235.331 2.173 20 0 BEADLO Cc1ccc([C@@H](C)C(=O)Nc2cc[nH+]c(C)c2)o1 ZINC000742664470 585129579 /nfs/dbraw/zinc/12/95/79/585129579.db2.gz DIVUVAVFCIKGIC-LLVKDONJSA-N 1 2 244.294 2.456 20 0 BEADLO C[C@H]1C[NH+](Cn2cc(Cl)cn2)C[C@H](C)S1 ZINC000743377008 585136322 /nfs/dbraw/zinc/13/63/22/585136322.db2.gz WSVWSTUVSXQBFM-IUCAKERBSA-N 1 2 245.779 2.320 20 0 BEADLO O=C1CCCN1C[N@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000743391980 585136377 /nfs/dbraw/zinc/13/63/77/585136377.db2.gz YVSNJCVVWKGXBD-CYBMUJFWSA-N 1 2 248.301 2.152 20 0 BEADLO O=C1CCCN1C[N@@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000743391980 585136378 /nfs/dbraw/zinc/13/63/78/585136378.db2.gz YVSNJCVVWKGXBD-CYBMUJFWSA-N 1 2 248.301 2.152 20 0 BEADLO C[C@@H](O)CC[N@@H+]1CCn2c(Cl)ccc2[C@H]1C ZINC000839527725 585139573 /nfs/dbraw/zinc/13/95/73/585139573.db2.gz HFJISHPYFDIQFH-NXEZZACHSA-N 1 2 242.750 2.289 20 0 BEADLO C[C@@H](O)CC[N@H+]1CCn2c(Cl)ccc2[C@H]1C ZINC000839527725 585139574 /nfs/dbraw/zinc/13/95/74/585139574.db2.gz HFJISHPYFDIQFH-NXEZZACHSA-N 1 2 242.750 2.289 20 0 BEADLO O=C(OCCC1CC1)c1ccc2[nH+]ccn2c1 ZINC000744996226 585155120 /nfs/dbraw/zinc/15/51/20/585155120.db2.gz LAGYXRDQFDHCLG-UHFFFAOYSA-N 1 2 230.267 2.291 20 0 BEADLO C[C@@H]1C[N@H+](CCF)C[C@H](c2ccccc2)O1 ZINC000746503909 585169111 /nfs/dbraw/zinc/16/91/11/585169111.db2.gz PMMSYVULLVRROE-DGCLKSJQSA-N 1 2 223.291 2.418 20 0 BEADLO C[C@@H]1C[N@@H+](CCF)C[C@H](c2ccccc2)O1 ZINC000746503909 585169112 /nfs/dbraw/zinc/16/91/12/585169112.db2.gz PMMSYVULLVRROE-DGCLKSJQSA-N 1 2 223.291 2.418 20 0 BEADLO CC(C)CC[N@H+](Cn1ccsc1=O)C1CC1 ZINC000746602963 585170896 /nfs/dbraw/zinc/17/08/96/585170896.db2.gz JRTVWCQZFOLMOH-UHFFFAOYSA-N 1 2 240.372 2.378 20 0 BEADLO CC(C)CC[N@@H+](Cn1ccsc1=O)C1CC1 ZINC000746602963 585170897 /nfs/dbraw/zinc/17/08/97/585170897.db2.gz JRTVWCQZFOLMOH-UHFFFAOYSA-N 1 2 240.372 2.378 20 0 BEADLO Cc1cccc(C(=O)OCc2c[nH+]cn2C)c1 ZINC000747782761 585184126 /nfs/dbraw/zinc/18/41/26/585184126.db2.gz JYPUFXYIRSXZMU-UHFFFAOYSA-N 1 2 230.267 2.086 20 0 BEADLO Cn1c[nH+]cc1COC(=O)C1CCCCC1 ZINC000747780646 585184136 /nfs/dbraw/zinc/18/41/36/585184136.db2.gz FDSZDJATPKWVHN-UHFFFAOYSA-N 1 2 222.288 2.044 20 0 BEADLO CCc1cc(NCc2cccc(F)n2)nc[nH+]1 ZINC000747847773 585185097 /nfs/dbraw/zinc/18/50/97/585185097.db2.gz QQVFVEWSQFTMMC-UHFFFAOYSA-N 1 2 232.262 2.185 20 0 BEADLO Cc1ccc(NC(=O)NC2CCC2)c(N(C)C)[nH+]1 ZINC000750413762 585214353 /nfs/dbraw/zinc/21/43/53/585214353.db2.gz ZCNZFYXZRLYHJJ-UHFFFAOYSA-N 1 2 248.330 2.130 20 0 BEADLO Clc1ncccc1C[N@@H+]1CCc2cn[nH]c2C1 ZINC000750720073 585218826 /nfs/dbraw/zinc/21/88/26/585218826.db2.gz MECZEBTXUVYZDJ-UHFFFAOYSA-N 1 2 248.717 2.016 20 0 BEADLO Clc1ncccc1C[N@H+]1CCc2cn[nH]c2C1 ZINC000750720073 585218827 /nfs/dbraw/zinc/21/88/27/585218827.db2.gz MECZEBTXUVYZDJ-UHFFFAOYSA-N 1 2 248.717 2.016 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C(C)=C(C)C ZINC000751192578 585225496 /nfs/dbraw/zinc/22/54/96/585225496.db2.gz IWYBPTQLQGEAJI-UHFFFAOYSA-N 1 2 220.272 2.385 20 0 BEADLO C/C=C(/C)C(=O)NCc1[nH+]cc(C)c(OC)c1C ZINC000751366280 585227735 /nfs/dbraw/zinc/22/77/35/585227735.db2.gz WOURTDKPSAGEOI-TWGQIWQCSA-N 1 2 248.326 2.289 20 0 BEADLO C/C=C(\C)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000751377454 585228333 /nfs/dbraw/zinc/22/83/33/585228333.db2.gz UULFLGRXXQKTSS-JPOQUURFSA-N 1 2 233.315 2.013 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CC2(C)C)c(C)c[nH+]1 ZINC000752141817 585242578 /nfs/dbraw/zinc/24/25/78/585242578.db2.gz ATMCWXJINRPLTP-JTQLQIEISA-N 1 2 218.300 2.105 20 0 BEADLO CC(=O)CC[N@@H+]1CCc2c(F)ccc(F)c2C1 ZINC000752355773 585245026 /nfs/dbraw/zinc/24/50/26/585245026.db2.gz XHURWYDHJOQHQS-UHFFFAOYSA-N 1 2 239.265 2.302 20 0 BEADLO CC(=O)CC[N@H+]1CCc2c(F)ccc(F)c2C1 ZINC000752355773 585245027 /nfs/dbraw/zinc/24/50/27/585245027.db2.gz XHURWYDHJOQHQS-UHFFFAOYSA-N 1 2 239.265 2.302 20 0 BEADLO Cc1ccc(C(=O)Nc2cc(C)[nH+]cc2C)nc1 ZINC000753125140 585253830 /nfs/dbraw/zinc/25/38/30/585253830.db2.gz UGNVGNVBRUFMPU-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO Cc1ccc(C(=O)OCc2c[nH+]cn2C)c(C)c1 ZINC000753147344 585254226 /nfs/dbraw/zinc/25/42/26/585254226.db2.gz PSRUQHMTJMZOOM-UHFFFAOYSA-N 1 2 244.294 2.394 20 0 BEADLO Cc1cscc1C(=O)OCc1c[nH+]cn1C ZINC000754683521 585289596 /nfs/dbraw/zinc/28/95/96/585289596.db2.gz GGQWMEIHCRJBNP-UHFFFAOYSA-N 1 2 236.296 2.147 20 0 BEADLO C/C(=C/c1ccccc1)C[N@@H+](C)[C@H]1CCOC1=O ZINC000755192436 585295873 /nfs/dbraw/zinc/29/58/73/585295873.db2.gz BUJIELDZSASPOY-HCYCVZQXSA-N 1 2 245.322 2.337 20 0 BEADLO C/C(=C/c1ccccc1)C[N@H+](C)[C@H]1CCOC1=O ZINC000755192436 585295874 /nfs/dbraw/zinc/29/58/74/585295874.db2.gz BUJIELDZSASPOY-HCYCVZQXSA-N 1 2 245.322 2.337 20 0 BEADLO CN(C)c1cc(COC(=O)CCC2CC2)cc[nH+]1 ZINC000755885957 585309209 /nfs/dbraw/zinc/30/92/09/585309209.db2.gz HRAXBQQVUGQSBR-UHFFFAOYSA-N 1 2 248.326 2.381 20 0 BEADLO C[C@@H](NC(=O)c1cccc2[nH+]ccn21)C1CCC1 ZINC000756098872 585314430 /nfs/dbraw/zinc/31/44/30/585314430.db2.gz PERPPJRSLZDEHP-SNVBAGLBSA-N 1 2 243.310 2.253 20 0 BEADLO CC/C=C(/C)C(=O)N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000756131250 585314952 /nfs/dbraw/zinc/31/49/52/585314952.db2.gz QRMXUBNAHLNOJU-QJGQKNTRSA-N 1 2 247.342 2.092 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2c(C)cccc2C)[nH]1 ZINC000756896964 585325057 /nfs/dbraw/zinc/32/50/57/585325057.db2.gz WHFFBPHONMVSCI-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2c(C)cccc2C)[nH]1 ZINC000756896964 585325058 /nfs/dbraw/zinc/32/50/58/585325058.db2.gz WHFFBPHONMVSCI-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO FCC[NH+]1CCN(c2cc(F)ccc2F)CC1 ZINC000759347326 585370389 /nfs/dbraw/zinc/37/03/89/585370389.db2.gz RUVZGNWGWHDRQQ-UHFFFAOYSA-N 1 2 244.260 2.056 20 0 BEADLO FCC[N@@H+]1CCOC[C@H]1c1ccccc1 ZINC000759348599 585370772 /nfs/dbraw/zinc/37/07/72/585370772.db2.gz YBABMJPDGNCUSM-LBPRGKRZSA-N 1 2 209.264 2.029 20 0 BEADLO FCC[N@H+]1CCOC[C@H]1c1ccccc1 ZINC000759348599 585370773 /nfs/dbraw/zinc/37/07/73/585370773.db2.gz YBABMJPDGNCUSM-LBPRGKRZSA-N 1 2 209.264 2.029 20 0 BEADLO Cc1csc(C[NH+]2CC(C(F)F)C2)n1 ZINC000759843997 585381404 /nfs/dbraw/zinc/38/14/04/585381404.db2.gz PBRFVLANPYBVPF-UHFFFAOYSA-N 1 2 218.272 2.148 20 0 BEADLO COCCCCO[NH+]=C(N)Cc1cccs1 ZINC000760352324 585391277 /nfs/dbraw/zinc/39/12/77/585391277.db2.gz HWXMTLGMEPWSPW-UHFFFAOYSA-N 1 2 242.344 2.216 20 0 BEADLO C/C=C(/C)C(=O)OCc1cccc2[nH+]ccn21 ZINC000761008607 585403407 /nfs/dbraw/zinc/40/34/07/585403407.db2.gz VDJFMJWYNFRECD-KMKOMSMNSA-N 1 2 230.267 2.344 20 0 BEADLO C/C=C(\C)C(=O)OCc1cccc2[nH+]ccn21 ZINC000761008608 585403519 /nfs/dbraw/zinc/40/35/19/585403519.db2.gz VDJFMJWYNFRECD-XCVCLJGOSA-N 1 2 230.267 2.344 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CC[C@@H](C(F)(F)F)C2)o1 ZINC000761053940 585404444 /nfs/dbraw/zinc/40/44/44/585404444.db2.gz IFJVCAOXTJXZRD-HTRCEHHLSA-N 1 2 249.236 2.323 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CC[C@@H](C(F)(F)F)C2)o1 ZINC000761053940 585404445 /nfs/dbraw/zinc/40/44/45/585404445.db2.gz IFJVCAOXTJXZRD-HTRCEHHLSA-N 1 2 249.236 2.323 20 0 BEADLO FC(F)(F)[C@@H]1CC[N@H+](Cc2ccon2)C1 ZINC000761054655 585404469 /nfs/dbraw/zinc/40/44/69/585404469.db2.gz TUHAFWJFVQGDMV-SSDOTTSWSA-N 1 2 220.194 2.059 20 0 BEADLO FC(F)(F)[C@@H]1CC[N@@H+](Cc2ccon2)C1 ZINC000761054655 585404470 /nfs/dbraw/zinc/40/44/70/585404470.db2.gz TUHAFWJFVQGDMV-SSDOTTSWSA-N 1 2 220.194 2.059 20 0 BEADLO FC(F)(F)[C@H]1CC[N@H+](Cc2ccon2)C1 ZINC000761054657 585404611 /nfs/dbraw/zinc/40/46/11/585404611.db2.gz TUHAFWJFVQGDMV-ZETCQYMHSA-N 1 2 220.194 2.059 20 0 BEADLO FC(F)(F)[C@H]1CC[N@@H+](Cc2ccon2)C1 ZINC000761054657 585404612 /nfs/dbraw/zinc/40/46/12/585404612.db2.gz TUHAFWJFVQGDMV-ZETCQYMHSA-N 1 2 220.194 2.059 20 0 BEADLO COC(=O)[C@H](c1ccccc1F)[N@@H+]1CC[C@@H]2C[C@@H]21 ZINC000761098340 585408737 /nfs/dbraw/zinc/40/87/37/585408737.db2.gz UUXWTGMTNCRNCK-ICCXJUOJSA-N 1 2 249.285 2.134 20 0 BEADLO COC(=O)[C@H](c1ccccc1F)[N@H+]1CC[C@@H]2C[C@@H]21 ZINC000761098340 585408738 /nfs/dbraw/zinc/40/87/38/585408738.db2.gz UUXWTGMTNCRNCK-ICCXJUOJSA-N 1 2 249.285 2.134 20 0 BEADLO FC(F)[C@@H]1CC[N@H+](Cc2cscn2)C1 ZINC000761110711 585410225 /nfs/dbraw/zinc/41/02/25/585410225.db2.gz UPLSNMCCRXOATI-SSDOTTSWSA-N 1 2 218.272 2.230 20 0 BEADLO FC(F)[C@@H]1CC[N@@H+](Cc2cscn2)C1 ZINC000761110711 585410226 /nfs/dbraw/zinc/41/02/26/585410226.db2.gz UPLSNMCCRXOATI-SSDOTTSWSA-N 1 2 218.272 2.230 20 0 BEADLO CCC(CC)[C@@H](C)C(=O)NC1=[NH+]CCS1 ZINC000761222550 585412390 /nfs/dbraw/zinc/41/23/90/585412390.db2.gz HYTSBZLMTWTKRH-MRVPVSSYSA-N 1 2 228.361 2.278 20 0 BEADLO CCCC[C@@H]([NH2+][C@@H](C)c1ccc[nH]1)C(=O)OC ZINC000762557343 585434039 /nfs/dbraw/zinc/43/40/39/585434039.db2.gz DHQPXIOQVZCGDP-CMPLNLGQSA-N 1 2 238.331 2.397 20 0 BEADLO CC(C)CCC(=O)OCCCn1cc[nH+]c1 ZINC000763286796 585445996 /nfs/dbraw/zinc/44/59/96/585445996.db2.gz IWTNZPJCHDNVQC-UHFFFAOYSA-N 1 2 224.304 2.253 20 0 BEADLO Cc1cc(C(=O)OCCCn2cc[nH+]c2)c(C)o1 ZINC000763289558 585446183 /nfs/dbraw/zinc/44/61/83/585446183.db2.gz SMDNJFIVJRBUCQ-UHFFFAOYSA-N 1 2 248.282 2.340 20 0 BEADLO C[N@H+](CCCF)CC(=O)OCc1ccccc1 ZINC000887138803 585447012 /nfs/dbraw/zinc/44/70/12/585447012.db2.gz MPKLCOAWFNPERN-UHFFFAOYSA-N 1 2 239.290 2.021 20 0 BEADLO C[N@@H+](CCCF)CC(=O)OCc1ccccc1 ZINC000887138803 585447013 /nfs/dbraw/zinc/44/70/13/585447013.db2.gz MPKLCOAWFNPERN-UHFFFAOYSA-N 1 2 239.290 2.021 20 0 BEADLO CS/C=C\C(=O)Nc1cccc2[nH+]ccn21 ZINC000764261941 585463215 /nfs/dbraw/zinc/46/32/15/585463215.db2.gz JBQBLXUEGIGXGS-YVMONPNESA-N 1 2 233.296 2.150 20 0 BEADLO Cc1ccc(NC(=O)[C@@H](O)C(C)(C)C)c(C)[nH+]1 ZINC000765152035 585482103 /nfs/dbraw/zinc/48/21/03/585482103.db2.gz AAKPDGKPDFPSDO-LLVKDONJSA-N 1 2 236.315 2.044 20 0 BEADLO CC(C)C[C@H](C)C(=O)OCCn1cc[nH+]c1 ZINC000765551499 585489615 /nfs/dbraw/zinc/48/96/15/585489615.db2.gz SQIVQRNNDDVTNS-NSHDSACASA-N 1 2 224.304 2.109 20 0 BEADLO c1csc(-c2ccn(C[N@H+]3CC=CCC3)n2)n1 ZINC000766089432 585497643 /nfs/dbraw/zinc/49/76/43/585497643.db2.gz UUORMEHIHQPOHB-UHFFFAOYSA-N 1 2 246.339 2.226 20 0 BEADLO c1csc(-c2ccn(C[N@@H+]3CC=CCC3)n2)n1 ZINC000766089432 585497644 /nfs/dbraw/zinc/49/76/44/585497644.db2.gz UUORMEHIHQPOHB-UHFFFAOYSA-N 1 2 246.339 2.226 20 0 BEADLO C[C@@H]1CCN1c1[nH+]cnc2c1cnn2C(C)(C)C ZINC000766405994 585502013 /nfs/dbraw/zinc/50/20/13/585502013.db2.gz XKCXUCCFDHKIEG-SECBINFHSA-N 1 2 245.330 2.180 20 0 BEADLO C/C=C/C=C\C(=O)OCc1c[nH+]ccc1OC ZINC000805340828 585513285 /nfs/dbraw/zinc/51/32/85/585513285.db2.gz ITDIOGAOSDOLDW-ICWBMWKASA-N 1 2 233.267 2.266 20 0 BEADLO C[C@@H]1CC[C@H](OC(=O)CCCn2cc[nH+]c2)C1 ZINC000767519377 585521809 /nfs/dbraw/zinc/52/18/09/585521809.db2.gz UXAJUTIASWWPCH-NEPJUHHUSA-N 1 2 236.315 2.395 20 0 BEADLO CN(Cc1[nH+]ccn1C)C[C@@H]1CC1(Cl)Cl ZINC000767550088 585522447 /nfs/dbraw/zinc/52/24/47/585522447.db2.gz OVXIRCXGNXKZBA-QMMMGPOBSA-N 1 2 248.157 2.046 20 0 BEADLO Cn1ccnc1C[N@H+](C)C[C@@H]1CC1(Cl)Cl ZINC000767550088 585522448 /nfs/dbraw/zinc/52/24/48/585522448.db2.gz OVXIRCXGNXKZBA-QMMMGPOBSA-N 1 2 248.157 2.046 20 0 BEADLO Cn1ccnc1C[N@@H+](C)C[C@@H]1CC1(Cl)Cl ZINC000767550088 585522449 /nfs/dbraw/zinc/52/24/49/585522449.db2.gz OVXIRCXGNXKZBA-QMMMGPOBSA-N 1 2 248.157 2.046 20 0 BEADLO CC/C=C\CCOC(=O)CCc1ccc(N)[nH+]c1 ZINC000767582136 585522777 /nfs/dbraw/zinc/52/27/77/585522777.db2.gz APKFUZNCVJNNQL-ARJAWSKDSA-N 1 2 248.326 2.496 20 0 BEADLO CCc1cc(C)c(C(=O)OCc2c[nH+]cn2C)o1 ZINC000768175651 585533059 /nfs/dbraw/zinc/53/30/59/585533059.db2.gz IJHMMCFZUCKEGC-UHFFFAOYSA-N 1 2 248.282 2.241 20 0 BEADLO c1coc(C[NH+]2CCN(Cc3ccoc3)CC2)c1 ZINC000768214427 585534100 /nfs/dbraw/zinc/53/41/00/585534100.db2.gz KWPUTMGOPWWLKA-UHFFFAOYSA-N 1 2 246.310 2.190 20 0 BEADLO c1coc(CN2CC[NH+](Cc3ccoc3)CC2)c1 ZINC000768214427 585534101 /nfs/dbraw/zinc/53/41/01/585534101.db2.gz KWPUTMGOPWWLKA-UHFFFAOYSA-N 1 2 246.310 2.190 20 0 BEADLO CC[N@H+](CCOC)Cc1coc(C2CC2)n1 ZINC000768251803 585534905 /nfs/dbraw/zinc/53/49/05/585534905.db2.gz LHLCABKURGRBOB-UHFFFAOYSA-N 1 2 224.304 2.020 20 0 BEADLO CC[N@@H+](CCOC)Cc1coc(C2CC2)n1 ZINC000768251803 585534906 /nfs/dbraw/zinc/53/49/06/585534906.db2.gz LHLCABKURGRBOB-UHFFFAOYSA-N 1 2 224.304 2.020 20 0 BEADLO CO[C@@H]1CCC[N@H+](Cc2coc(C3CC3)n2)C1 ZINC000768752031 585542310 /nfs/dbraw/zinc/54/23/10/585542310.db2.gz BPTAZXVZZYYHHL-GFCCVEGCSA-N 1 2 236.315 2.163 20 0 BEADLO CO[C@@H]1CCC[N@@H+](Cc2coc(C3CC3)n2)C1 ZINC000768752031 585542311 /nfs/dbraw/zinc/54/23/11/585542311.db2.gz BPTAZXVZZYYHHL-GFCCVEGCSA-N 1 2 236.315 2.163 20 0 BEADLO CCOCC[N@H+](CC)Cc1coc(C2CC2)n1 ZINC000769139563 585549693 /nfs/dbraw/zinc/54/96/93/585549693.db2.gz JYRCQDZEBBESHD-UHFFFAOYSA-N 1 2 238.331 2.410 20 0 BEADLO CCOCC[N@@H+](CC)Cc1coc(C2CC2)n1 ZINC000769139563 585549694 /nfs/dbraw/zinc/54/96/94/585549694.db2.gz JYRCQDZEBBESHD-UHFFFAOYSA-N 1 2 238.331 2.410 20 0 BEADLO O=C(OCCn1cc[nH+]c1)[C@@H](F)c1ccccc1 ZINC000769171055 585550570 /nfs/dbraw/zinc/55/05/70/585550570.db2.gz ZOLWTDHOQMPVBO-LBPRGKRZSA-N 1 2 248.257 2.137 20 0 BEADLO C[C@H]1CCC[C@@H]1CC(=O)OCc1c[nH+]cn1C ZINC000769303206 585553022 /nfs/dbraw/zinc/55/30/22/585553022.db2.gz HBPPEBPWZDMNRZ-WDEREUQCSA-N 1 2 236.315 2.290 20 0 BEADLO CC(C)=C(C)C(=O)N(C)CCCn1cc[nH+]c1 ZINC000769308219 585553348 /nfs/dbraw/zinc/55/33/48/585553348.db2.gz UXFWNWZUCNQJDP-UHFFFAOYSA-N 1 2 235.331 2.088 20 0 BEADLO C[C@H]1CSCC[N@@H+]1Cc1coc(C2CC2)n1 ZINC000769429289 585556474 /nfs/dbraw/zinc/55/64/74/585556474.db2.gz WUAFVWVFFIRGQK-VIFPVBQESA-N 1 2 238.356 2.489 20 0 BEADLO C[C@H]1CSCC[N@H+]1Cc1coc(C2CC2)n1 ZINC000769429289 585556475 /nfs/dbraw/zinc/55/64/75/585556475.db2.gz WUAFVWVFFIRGQK-VIFPVBQESA-N 1 2 238.356 2.489 20 0 BEADLO Cc1nonc1C[N@@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000769864451 585565261 /nfs/dbraw/zinc/56/52/61/585565261.db2.gz KUWALUSDNFMOLR-QMMMGPOBSA-N 1 2 249.236 2.152 20 0 BEADLO Cc1nonc1C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000769864451 585565262 /nfs/dbraw/zinc/56/52/62/585565262.db2.gz KUWALUSDNFMOLR-QMMMGPOBSA-N 1 2 249.236 2.152 20 0 BEADLO Cc1nonc1C[N@@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000769864439 585565354 /nfs/dbraw/zinc/56/53/54/585565354.db2.gz KUWALUSDNFMOLR-MRVPVSSYSA-N 1 2 249.236 2.152 20 0 BEADLO Cc1nonc1C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000769864439 585565355 /nfs/dbraw/zinc/56/53/55/585565355.db2.gz KUWALUSDNFMOLR-MRVPVSSYSA-N 1 2 249.236 2.152 20 0 BEADLO CCC[C@@]1(C(=O)OCC)CCC[N@@H+]1CCF ZINC000769998879 585568912 /nfs/dbraw/zinc/56/89/12/585568912.db2.gz DGZGMOVJURKXCJ-LBPRGKRZSA-N 1 2 231.311 2.154 20 0 BEADLO CCC[C@@]1(C(=O)OCC)CCC[N@H+]1CCF ZINC000769998879 585568913 /nfs/dbraw/zinc/56/89/13/585568913.db2.gz DGZGMOVJURKXCJ-LBPRGKRZSA-N 1 2 231.311 2.154 20 0 BEADLO CC[C@@H](C)CN(C)C(=O)c1cccc2[nH+]ccn21 ZINC000770416076 585573909 /nfs/dbraw/zinc/57/39/09/585573909.db2.gz JUWGHQYGQMXFSS-LLVKDONJSA-N 1 2 245.326 2.452 20 0 BEADLO C[C@H]1CCC[C@@H]1NC(=O)c1cccc2[nH+]ccn21 ZINC000770417793 585574028 /nfs/dbraw/zinc/57/40/28/585574028.db2.gz NZEPYSUYWSZSHM-QWRGUYRKSA-N 1 2 243.310 2.253 20 0 BEADLO O=C(OCc1cccc2[nH+]ccn21)c1ccoc1 ZINC000770733873 585580424 /nfs/dbraw/zinc/58/04/24/585580424.db2.gz PTQHEAGKMWFFFV-UHFFFAOYSA-N 1 2 242.234 2.284 20 0 BEADLO CC[C@@H](C)C(=O)OCc1cccc2[nH+]ccn21 ZINC000770732103 585580722 /nfs/dbraw/zinc/58/07/22/585580722.db2.gz CMPLQFRJUJWVAN-SNVBAGLBSA-N 1 2 232.283 2.424 20 0 BEADLO CC(C)=CC(=O)OCc1cccc2[nH+]ccn21 ZINC000770734904 585581024 /nfs/dbraw/zinc/58/10/24/585581024.db2.gz XLNFAAGHPKWYEA-UHFFFAOYSA-N 1 2 230.267 2.344 20 0 BEADLO CS/C=C/C(=O)OCc1cccc2[nH+]ccn21 ZINC000771639027 585598301 /nfs/dbraw/zinc/59/83/01/585598301.db2.gz WMGHZOGHUSYKHE-VMPITWQZSA-N 1 2 248.307 2.254 20 0 BEADLO C[C@H](CC(C)(C)C)C(=O)NC1=[NH+]CCS1 ZINC000771928341 585604637 /nfs/dbraw/zinc/60/46/37/585604637.db2.gz LNKJUQPJBFCLKK-MRVPVSSYSA-N 1 2 228.361 2.278 20 0 BEADLO CCC[C@@H](C)CC(=O)OCCn1cc[nH+]c1 ZINC000771940139 585605164 /nfs/dbraw/zinc/60/51/64/585605164.db2.gz VZRICQCVDXJBNG-LLVKDONJSA-N 1 2 224.304 2.253 20 0 BEADLO C[C@@H]1CCC[C@H](C(=O)OCCn2cc[nH+]c2)C1 ZINC000771977727 585605987 /nfs/dbraw/zinc/60/59/87/585605987.db2.gz QAQMYLHZAAQXOP-NEPJUHHUSA-N 1 2 236.315 2.253 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C1(F)CCCC1 ZINC000771994451 585606462 /nfs/dbraw/zinc/60/64/62/585606462.db2.gz QLAAXEJRXOQCFN-UHFFFAOYSA-N 1 2 238.262 2.311 20 0 BEADLO CCC(=CC(=O)OCCn1cc[nH+]c1)CC ZINC000772002377 585606662 /nfs/dbraw/zinc/60/66/62/585606662.db2.gz IIGGHSOUXMRYSO-UHFFFAOYSA-N 1 2 222.288 2.173 20 0 BEADLO Cc1ccc(COC(=O)C[C@@H]2CCCO2)c(C)[nH+]1 ZINC000772016907 585606995 /nfs/dbraw/zinc/60/69/95/585606995.db2.gz SJXCTUJAIZIKNT-ZDUSSCGKSA-N 1 2 249.310 2.311 20 0 BEADLO Cc1ccc(COC(=O)[C@]2(C)CCCO2)c(C)[nH+]1 ZINC000772187632 585609903 /nfs/dbraw/zinc/60/99/03/585609903.db2.gz VYFNVWQEZAGMRZ-AWEZNQCLSA-N 1 2 249.310 2.311 20 0 BEADLO Cc1ccc(COC(=O)[C@]2(C)CCOC2)c(C)[nH+]1 ZINC000772314696 585612665 /nfs/dbraw/zinc/61/26/65/585612665.db2.gz IDERBWVMIQZXQA-CQSZACIVSA-N 1 2 249.310 2.168 20 0 BEADLO CCc1noc(C)c1[C@H](C)[NH2+]Cc1ccn(C)n1 ZINC000773131963 585632375 /nfs/dbraw/zinc/63/23/75/585632375.db2.gz NFRKDWBIGLILKQ-VIFPVBQESA-N 1 2 248.330 2.130 20 0 BEADLO C[N@@H+]1CCCC[C@@H]1C(=O)OCc1ccsc1 ZINC000774106806 585650540 /nfs/dbraw/zinc/65/05/40/585650540.db2.gz SBVHGOZJFYXHEE-LLVKDONJSA-N 1 2 239.340 2.276 20 0 BEADLO C[N@H+]1CCCC[C@@H]1C(=O)OCc1ccsc1 ZINC000774106806 585650541 /nfs/dbraw/zinc/65/05/41/585650541.db2.gz SBVHGOZJFYXHEE-LLVKDONJSA-N 1 2 239.340 2.276 20 0 BEADLO Cn1c[nH+]cc1COC(=O)c1ccoc1Cl ZINC000774123132 585651048 /nfs/dbraw/zinc/65/10/48/585651048.db2.gz NDWWYFUUJDDJGZ-UHFFFAOYSA-N 1 2 240.646 2.024 20 0 BEADLO FC1(F)CC[N@H+](C[C@H]2CCC=CO2)C1 ZINC000775053468 585670998 /nfs/dbraw/zinc/67/09/98/585670998.db2.gz ZAXNOFWHNXCFJS-SECBINFHSA-N 1 2 203.232 2.020 20 0 BEADLO FC1(F)CC[N@@H+](C[C@H]2CCC=CO2)C1 ZINC000775053468 585670999 /nfs/dbraw/zinc/67/09/99/585670999.db2.gz ZAXNOFWHNXCFJS-SECBINFHSA-N 1 2 203.232 2.020 20 0 BEADLO COc1cc[nH+]cc1COC(=O)CC1(C)CC1 ZINC000805538054 585673397 /nfs/dbraw/zinc/67/33/97/585673397.db2.gz IQQKEZKCBHOXDF-UHFFFAOYSA-N 1 2 235.283 2.324 20 0 BEADLO CC1(COC(=O)Cc2cn3ccccc3[nH+]2)CC1 ZINC000790805582 585702856 /nfs/dbraw/zinc/70/28/56/585702856.db2.gz NSYWONYLOIUEDV-UHFFFAOYSA-N 1 2 244.294 2.220 20 0 BEADLO O=C(NCCCC1CC1)c1cccc2[nH+]ccn21 ZINC000776935435 585706952 /nfs/dbraw/zinc/70/69/52/585706952.db2.gz CGGCRHUDNCPOHL-UHFFFAOYSA-N 1 2 243.310 2.254 20 0 BEADLO O=C(NC1(C2CC2)CC1)c1cccc2[nH+]ccn21 ZINC000777018686 585707342 /nfs/dbraw/zinc/70/73/42/585707342.db2.gz GXNOEKASPMEUNX-UHFFFAOYSA-N 1 2 241.294 2.007 20 0 BEADLO C/C=C/C=C\C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000777454158 585712537 /nfs/dbraw/zinc/71/25/37/585712537.db2.gz UTKSTDKCNLEJSZ-KQHAGXDOSA-N 1 2 231.299 2.206 20 0 BEADLO c1c[nH+]c(COCc2ccc3c(c2)COC3)[nH]1 ZINC000777935535 585724108 /nfs/dbraw/zinc/72/41/08/585724108.db2.gz OSVHXVVRSDEITE-UHFFFAOYSA-N 1 2 230.267 2.157 20 0 BEADLO O=C(C[C@H]1C=CCCC1)OCCn1cc[nH+]c1 ZINC000778394841 585733436 /nfs/dbraw/zinc/73/34/36/585733436.db2.gz HINUOCLKAOWLEU-LBPRGKRZSA-N 1 2 234.299 2.173 20 0 BEADLO CCC1(CC)CN(C[N@H+]2CC=CCC2)C(=O)O1 ZINC000778576079 585737306 /nfs/dbraw/zinc/73/73/06/585737306.db2.gz FBXSLQZOLAOSQL-UHFFFAOYSA-N 1 2 238.331 2.217 20 0 BEADLO CCC1(CC)CN(C[N@@H+]2CC=CCC2)C(=O)O1 ZINC000778576079 585737307 /nfs/dbraw/zinc/73/73/07/585737307.db2.gz FBXSLQZOLAOSQL-UHFFFAOYSA-N 1 2 238.331 2.217 20 0 BEADLO CC(C)c1nc(N2CC=CCC2)cc[nH+]1 ZINC000778591613 585737645 /nfs/dbraw/zinc/73/76/45/585737645.db2.gz KTOKSUOUFTXFIA-UHFFFAOYSA-N 1 2 203.289 2.366 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NOC1CCCCC1 ZINC000779445063 585755093 /nfs/dbraw/zinc/75/50/93/585755093.db2.gz LDUBULYJPCNLPC-UHFFFAOYSA-N 1 2 249.314 2.198 20 0 BEADLO CC[C@@H](C)[C@@H](C)C(=O)OCCn1cc[nH+]c1 ZINC000780242680 585774516 /nfs/dbraw/zinc/77/45/16/585774516.db2.gz OCLQNLPHCCQREM-GHMZBOCLSA-N 1 2 224.304 2.109 20 0 BEADLO Cc1nc2[nH]ccc2c(NC[C@@H]2CCC=CO2)[nH+]1 ZINC000780621592 585782481 /nfs/dbraw/zinc/78/24/81/585782481.db2.gz GUTMNLCPBSAIBS-JTQLQIEISA-N 1 2 244.298 2.371 20 0 BEADLO CC/C(C)=C(\C)C(=O)NC[C@H](C)Cn1cc[nH+]c1 ZINC000780951379 585787078 /nfs/dbraw/zinc/78/70/78/585787078.db2.gz WUDOYGYNVGERPV-UMAGAQSHSA-N 1 2 249.358 2.382 20 0 BEADLO CC/C(C)=C(\C)C(=O)NCc1[nH]c[nH+]c1C ZINC000780957092 585787238 /nfs/dbraw/zinc/78/72/38/585787238.db2.gz VZXYHBZIKFLTPY-CMDGGOBGSA-N 1 2 221.304 2.081 20 0 BEADLO CC(C)(C(=O)OCc1cc[nH+]c(N)c1)C1CC1 ZINC000805703814 585803093 /nfs/dbraw/zinc/80/30/93/585803093.db2.gz VCZJNBUQQRRTGM-UHFFFAOYSA-N 1 2 234.299 2.143 20 0 BEADLO C[C@H](CO)CSCc1cc[nH+]c(N(C)C)c1 ZINC000782111903 585808019 /nfs/dbraw/zinc/80/80/19/585808019.db2.gz LGXMFXNJEFCTRA-SNVBAGLBSA-N 1 2 240.372 2.009 20 0 BEADLO Cc1oncc1C[N@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000782532190 585819539 /nfs/dbraw/zinc/81/95/39/585819539.db2.gz YZTJILAGOVSHGD-KWQFWETISA-N 1 2 212.268 2.163 20 0 BEADLO Cc1oncc1C[N@@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000782532190 585819540 /nfs/dbraw/zinc/81/95/40/585819540.db2.gz YZTJILAGOVSHGD-KWQFWETISA-N 1 2 212.268 2.163 20 0 BEADLO CC/C(C)=C(\C)C(=O)N1CCn2cc(C)[nH+]c2C1 ZINC000782821763 585824735 /nfs/dbraw/zinc/82/47/35/585824735.db2.gz GFARSKDIDALNBI-ZRDIBKRKSA-N 1 2 247.342 2.280 20 0 BEADLO C(c1nnc(C2CC2)n1C1CC1)[N@@H+]1CC[C@H]2C[C@H]21 ZINC000782960615 585826661 /nfs/dbraw/zinc/82/66/61/585826661.db2.gz SVMDAWXVXGLVAD-CMPLNLGQSA-N 1 2 244.342 2.085 20 0 BEADLO C(c1nnc(C2CC2)n1C1CC1)[N@H+]1CC[C@H]2C[C@H]21 ZINC000782960615 585826662 /nfs/dbraw/zinc/82/66/62/585826662.db2.gz SVMDAWXVXGLVAD-CMPLNLGQSA-N 1 2 244.342 2.085 20 0 BEADLO CCc1cnccc1[C@H](C)[NH2+]Cc1nonc1C ZINC000783015702 585826841 /nfs/dbraw/zinc/82/68/41/585826841.db2.gz GATIIHHJPIBRNZ-VIFPVBQESA-N 1 2 246.314 2.186 20 0 BEADLO CC[N@H+](C)[C@H](C(=O)OC1CC1)c1ccccc1 ZINC000783190290 585829515 /nfs/dbraw/zinc/82/95/15/585829515.db2.gz XYFQPKXJIUYUFA-ZDUSSCGKSA-N 1 2 233.311 2.385 20 0 BEADLO CC[N@@H+](C)[C@H](C(=O)OC1CC1)c1ccccc1 ZINC000783190290 585829516 /nfs/dbraw/zinc/82/95/16/585829516.db2.gz XYFQPKXJIUYUFA-ZDUSSCGKSA-N 1 2 233.311 2.385 20 0 BEADLO CC(C)OCC(N)=[NH+]OCCC(C)(C)C ZINC000783553956 585836332 /nfs/dbraw/zinc/83/63/32/585836332.db2.gz UKZFDVSOKAVSEW-UHFFFAOYSA-N 1 2 216.325 2.346 20 0 BEADLO Cc1nonc1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC000805747902 585837467 /nfs/dbraw/zinc/83/74/67/585837467.db2.gz JCMIHYXMNZCKJM-CYBMUJFWSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1nonc1C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC000805747902 585837468 /nfs/dbraw/zinc/83/74/68/585837468.db2.gz JCMIHYXMNZCKJM-CYBMUJFWSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1cc(NC(=O)[C@@H](F)C(C)C)c(C)c[nH+]1 ZINC000784145178 585851523 /nfs/dbraw/zinc/85/15/23/585851523.db2.gz NKVZGTMEFKWNCF-NSHDSACASA-N 1 2 224.279 2.053 20 0 BEADLO Cc1ccc(COC(=O)[C@H]2CO[C@@H](C)C2)c(C)[nH+]1 ZINC000784271943 585854043 /nfs/dbraw/zinc/85/40/43/585854043.db2.gz OHORXPJNMGJVRT-GXFFZTMASA-N 1 2 249.310 2.167 20 0 BEADLO C[C@H]1CC[C@H](C(=O)OCCCn2cc[nH+]c2)C1 ZINC000784568073 585863566 /nfs/dbraw/zinc/86/35/66/585863566.db2.gz PZMZBRVIBLZRHT-RYUDHWBXSA-N 1 2 236.315 2.253 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccc(F)nc2C)no1 ZINC000785435736 585873873 /nfs/dbraw/zinc/87/38/73/585873873.db2.gz UHIKADXZUPYZEF-UHFFFAOYSA-N 1 2 235.262 2.115 20 0 BEADLO C[C@@H](c1nc(Cc2cccs2)no1)[NH+](C)C ZINC000785561579 585875430 /nfs/dbraw/zinc/87/54/30/585875430.db2.gz YHOLBRZMVUOFLA-QMMMGPOBSA-N 1 2 237.328 2.345 20 0 BEADLO Cc1cccn2cc(COC(=O)[C@@H]3C[C@H]3C)[nH+]c12 ZINC000786376674 585890496 /nfs/dbraw/zinc/89/04/96/585890496.db2.gz AWSYOKNKYXQFDO-ZYHUDNBSSA-N 1 2 244.294 2.342 20 0 BEADLO CC[N@@H+]1CCCC[C@@H]1C(=O)O[C@@H](C)C(F)F ZINC000786517853 585893839 /nfs/dbraw/zinc/89/38/39/585893839.db2.gz YNULSEYHNNCUEY-DTWKUNHWSA-N 1 2 235.274 2.058 20 0 BEADLO CC[N@H+]1CCCC[C@@H]1C(=O)O[C@@H](C)C(F)F ZINC000786517853 585893840 /nfs/dbraw/zinc/89/38/40/585893840.db2.gz YNULSEYHNNCUEY-DTWKUNHWSA-N 1 2 235.274 2.058 20 0 BEADLO COC(C)(C)CCO[NH+]=C(N)c1ccccc1 ZINC000786731988 585896901 /nfs/dbraw/zinc/89/69/01/585896901.db2.gz JXHKEDNSKGFBJF-UHFFFAOYSA-N 1 2 236.315 2.348 20 0 BEADLO COC(C)(C)CCO[NH+]=C(N)COC(C)(C)C ZINC000786747228 585897066 /nfs/dbraw/zinc/89/70/66/585897066.db2.gz BNIBIUDWULSCCP-UHFFFAOYSA-N 1 2 246.351 2.115 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1ccc(F)nc1C ZINC000787111244 585901437 /nfs/dbraw/zinc/90/14/37/585901437.db2.gz CRPJTPBGADXSDF-LBPRGKRZSA-N 1 2 238.306 2.140 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1ccc(F)nc1C ZINC000787111244 585901438 /nfs/dbraw/zinc/90/14/38/585901438.db2.gz CRPJTPBGADXSDF-LBPRGKRZSA-N 1 2 238.306 2.140 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2ccc(F)cn2)C[C@@H]1F ZINC000787279165 585904636 /nfs/dbraw/zinc/90/46/36/585904636.db2.gz HVEJQSSOJXMLNB-SKDRFNHKSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2ccc(F)cn2)C[C@@H]1F ZINC000787279165 585904637 /nfs/dbraw/zinc/90/46/37/585904637.db2.gz HVEJQSSOJXMLNB-SKDRFNHKSA-N 1 2 226.270 2.401 20 0 BEADLO NC(Cc1ccccc1)=[NH+]OC1CCC1 ZINC000787904570 585917302 /nfs/dbraw/zinc/91/73/02/585917302.db2.gz DOLUHDGIUHJXGP-UHFFFAOYSA-N 1 2 204.273 2.280 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)Cc1cccc(Cl)n1 ZINC000788456515 585924778 /nfs/dbraw/zinc/92/47/78/585924778.db2.gz TVIQIXLRPVBVGC-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO CC(C)(C)SCCO[NH+]=C(N)[C@H]1CCCO1 ZINC000789607879 585946327 /nfs/dbraw/zinc/94/63/27/585946327.db2.gz IWKXBINOPQEMKZ-SECBINFHSA-N 1 2 246.376 2.196 20 0 BEADLO C[C@@H]1CCC[C@@H](CO[NH+]=C(N)[C@@H]2CCCO2)C1 ZINC000789608544 585946356 /nfs/dbraw/zinc/94/63/56/585946356.db2.gz KMIHTKOCLACRKJ-UTUOFQBUSA-N 1 2 240.347 2.490 20 0 BEADLO C/C=C(\CC)C(=O)N1CC(Oc2cc[nH+]cc2)C1 ZINC000789754210 585949144 /nfs/dbraw/zinc/94/91/44/585949144.db2.gz DOAUFENVKWUNJW-QDEBKDIKSA-N 1 2 246.310 2.028 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)CC1CCCC1 ZINC000789771336 585949536 /nfs/dbraw/zinc/94/95/36/585949536.db2.gz HLZFOBZGIWIEAF-UHFFFAOYSA-N 1 2 236.315 2.086 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)C1CCCCC1 ZINC000789770523 585949544 /nfs/dbraw/zinc/94/95/44/585949544.db2.gz AKLBRVCAIWICMX-UHFFFAOYSA-N 1 2 236.315 2.086 20 0 BEADLO Cn1cc[nH+]c1CCCOC(=O)C=C1CCC1 ZINC000789791257 585950392 /nfs/dbraw/zinc/95/03/92/585950392.db2.gz IENXWPXJYGKAJQ-UHFFFAOYSA-N 1 2 234.299 2.006 20 0 BEADLO Cc1cnc(C[N@@H+]2CCO[C@@H](C(C)(C)C)C2)cn1 ZINC000790434080 585964568 /nfs/dbraw/zinc/96/45/68/585964568.db2.gz YIEYSMPFSYFNMU-CYBMUJFWSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1cnc(C[N@H+]2CCO[C@@H](C(C)(C)C)C2)cn1 ZINC000790434080 585964569 /nfs/dbraw/zinc/96/45/69/585964569.db2.gz YIEYSMPFSYFNMU-CYBMUJFWSA-N 1 2 249.358 2.032 20 0 BEADLO CCC/C(C)=C\C(=O)OCc1cc[nH+]c(N)c1 ZINC000791778035 585987712 /nfs/dbraw/zinc/98/77/12/585987712.db2.gz LJLOGZJJVAPEAG-YFHOEESVSA-N 1 2 234.299 2.453 20 0 BEADLO C[C@H]1C[C@H](C)N1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000791821597 585988821 /nfs/dbraw/zinc/98/88/21/585988821.db2.gz HEWPDFHJXOJZBV-UWVGGRQHSA-N 1 2 244.298 2.349 20 0 BEADLO C[C@@H]1CC/C(=C/C(=O)OCc2cc[nH+]c(N)c2)C1 ZINC000791994940 585992879 /nfs/dbraw/zinc/99/28/79/585992879.db2.gz JXWLIPQBJQLYTB-UBYNWHESSA-N 1 2 246.310 2.453 20 0 BEADLO CC[C@@H](C)[C@H](C)C(=O)OCc1cc[nH+]c(N)c1 ZINC000792119230 585996020 /nfs/dbraw/zinc/99/60/20/585996020.db2.gz SMPVJLWYMUVQPF-ZJUUUORDSA-N 1 2 236.315 2.389 20 0 BEADLO COC(=O)[C@H](C)[N@H+](Cc1ccoc1)C1CCC1 ZINC000792185354 585997239 /nfs/dbraw/zinc/99/72/39/585997239.db2.gz JXGBEDFFUZPFPA-JTQLQIEISA-N 1 2 237.299 2.196 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](Cc1ccoc1)C1CCC1 ZINC000792185354 585997240 /nfs/dbraw/zinc/99/72/40/585997240.db2.gz JXGBEDFFUZPFPA-JTQLQIEISA-N 1 2 237.299 2.196 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)CC1(F)CC1 ZINC000792794246 586005431 /nfs/dbraw/zinc/00/54/31/586005431.db2.gz JPCQZPDAUSLLND-UHFFFAOYSA-N 1 2 212.268 2.225 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)CC1(F)CC1 ZINC000792794246 586005432 /nfs/dbraw/zinc/00/54/32/586005432.db2.gz JPCQZPDAUSLLND-UHFFFAOYSA-N 1 2 212.268 2.225 20 0 BEADLO CC[C@@H](C)[C@@H](C)C(=O)OCCc1c[nH+]cn1C ZINC000793253875 586015146 /nfs/dbraw/zinc/01/51/46/586015146.db2.gz UHJCBGSKKHWPGH-GHMZBOCLSA-N 1 2 238.331 2.188 20 0 BEADLO CCC/C(C)=C/C(=O)OCCc1c[nH+]cn1C ZINC000793249376 586015158 /nfs/dbraw/zinc/01/51/58/586015158.db2.gz FCCKUJFVGYOVIQ-DHZHZOJOSA-N 1 2 236.315 2.252 20 0 BEADLO CC(C)C(C)(C)C(=O)OCCc1c[nH+]cn1C ZINC000793254253 586015224 /nfs/dbraw/zinc/01/52/24/586015224.db2.gz BUPBRAOTECQURK-UHFFFAOYSA-N 1 2 238.331 2.188 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)/C=C/C(C)(C)C ZINC000793257547 586015299 /nfs/dbraw/zinc/01/52/99/586015299.db2.gz INHLYZCXJYGFAR-FNORWQNLSA-N 1 2 236.315 2.108 20 0 BEADLO Fc1cncc(C[NH+]2CCC(F)(F)CC2)c1 ZINC000793360168 586017426 /nfs/dbraw/zinc/01/74/26/586017426.db2.gz RFRBTTOGWKDDDS-UHFFFAOYSA-N 1 2 230.233 2.452 20 0 BEADLO CC1=C[C@@H](C)C[N@H+](Cc2cc(Cl)n(C)n2)C1 ZINC000859289556 589027678 /nfs/dbraw/zinc/02/76/78/589027678.db2.gz FPBVTXABXSMWAV-SECBINFHSA-N 1 2 239.750 2.472 20 0 BEADLO CC1=C[C@@H](C)C[N@@H+](Cc2cc(Cl)n(C)n2)C1 ZINC000859289556 589027680 /nfs/dbraw/zinc/02/76/80/589027680.db2.gz FPBVTXABXSMWAV-SECBINFHSA-N 1 2 239.750 2.472 20 0 BEADLO CC[C@@H]([NH2+]Cc1cccnc1F)c1nccn1C ZINC000794835335 586049696 /nfs/dbraw/zinc/04/96/96/586049696.db2.gz LFBQGPLMTHUJGZ-LLVKDONJSA-N 1 2 248.305 2.195 20 0 BEADLO Cc1nc(N2[C@@H](C)C[C@@H]2C)c(C)c(C)[nH+]1 ZINC000795195584 586071327 /nfs/dbraw/zinc/07/13/27/586071327.db2.gz WUKOEVBUIOMKMX-YUMQZZPRSA-N 1 2 205.305 2.389 20 0 BEADLO c1ncc(C[NH+]2CC(Cc3ccccc3)C2)[nH]1 ZINC000796448448 586103259 /nfs/dbraw/zinc/10/32/59/586103259.db2.gz JWKGAGZFAXQGBU-UHFFFAOYSA-N 1 2 227.311 2.084 20 0 BEADLO CCCOC(=O)[C@@H](C)[NH+]1CCC(F)(F)CC1 ZINC000796548117 586106771 /nfs/dbraw/zinc/10/67/71/586106771.db2.gz AKFJCOWWIDSXCW-SECBINFHSA-N 1 2 235.274 2.059 20 0 BEADLO Cc1cc[nH]c1C(=O)Nc1cc(C)[nH+]cc1C ZINC000797948570 586134605 /nfs/dbraw/zinc/13/46/05/586134605.db2.gz UGWIRTSMSUXYHD-UHFFFAOYSA-N 1 2 229.283 2.009 20 0 BEADLO CC[NH2+]c1ccc(O[C@H]2CCN(C)C2=O)cc1C ZINC000798392730 586143400 /nfs/dbraw/zinc/14/34/00/586143400.db2.gz UMEJMZGGJAAJKB-ZDUSSCGKSA-N 1 2 248.326 2.036 20 0 BEADLO Cc1nc(N2CC[C@H](c3ccccn3)C2)cc[nH+]1 ZINC000798416375 586143643 /nfs/dbraw/zinc/14/36/43/586143643.db2.gz OSCWQZNWRPNHPG-LBPRGKRZSA-N 1 2 240.310 2.174 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2CCC=CO2)c(C)[nH+]1 ZINC000799683395 586191550 /nfs/dbraw/zinc/19/15/50/586191550.db2.gz OTFCVDDVJHLHNX-LBPRGKRZSA-N 1 2 232.283 2.330 20 0 BEADLO O=C1OCC[C@H]1CC[N@H+]1CCCC[C@H]1C(F)F ZINC000800445774 586220045 /nfs/dbraw/zinc/22/00/45/586220045.db2.gz KXTSUYPBUCIKAK-ZJUUUORDSA-N 1 2 247.285 2.059 20 0 BEADLO O=C1OCC[C@H]1CC[N@@H+]1CCCC[C@H]1C(F)F ZINC000800445774 586220048 /nfs/dbraw/zinc/22/00/48/586220048.db2.gz KXTSUYPBUCIKAK-ZJUUUORDSA-N 1 2 247.285 2.059 20 0 BEADLO O=C1OCC[C@H]1CC[N@H+]1CCCC[C@@H]1C(F)F ZINC000800445769 586220139 /nfs/dbraw/zinc/22/01/39/586220139.db2.gz KXTSUYPBUCIKAK-NXEZZACHSA-N 1 2 247.285 2.059 20 0 BEADLO O=C1OCC[C@H]1CC[N@@H+]1CCCC[C@@H]1C(F)F ZINC000800445769 586220140 /nfs/dbraw/zinc/22/01/40/586220140.db2.gz KXTSUYPBUCIKAK-NXEZZACHSA-N 1 2 247.285 2.059 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2cccnc2F)nn1C ZINC000800490368 586223106 /nfs/dbraw/zinc/22/31/06/586223106.db2.gz DNEBSUOWPOMILK-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ccnn2C)no1 ZINC000800502994 586223921 /nfs/dbraw/zinc/22/39/21/586223921.db2.gz KCBLZNXRRSRQGP-ZJUUUORDSA-N 1 2 234.303 2.128 20 0 BEADLO Cc1cn2c([nH+]1)CN(c1cccc(Cl)n1)CC2 ZINC000800862170 586234765 /nfs/dbraw/zinc/23/47/65/586234765.db2.gz JVWIUAIEPMDEAW-UHFFFAOYSA-N 1 2 248.717 2.260 20 0 BEADLO C[C@H](c1ccccn1)[N@@H+]1CCO[C@H](C(F)F)C1 ZINC000801559172 586261596 /nfs/dbraw/zinc/26/15/96/586261596.db2.gz FBCQQLRYLZMBER-KOLCDFICSA-N 1 2 242.269 2.109 20 0 BEADLO C[C@H](c1ccccn1)[N@H+]1CCO[C@H](C(F)F)C1 ZINC000801559172 586261597 /nfs/dbraw/zinc/26/15/97/586261597.db2.gz FBCQQLRYLZMBER-KOLCDFICSA-N 1 2 242.269 2.109 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@H](C(F)F)C2)cc1 ZINC000801566422 586264033 /nfs/dbraw/zinc/26/40/33/586264033.db2.gz NLQLOQZCYFPPRU-LBPRGKRZSA-N 1 2 241.281 2.461 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@H](C(F)F)C2)cc1 ZINC000801566422 586264036 /nfs/dbraw/zinc/26/40/36/586264036.db2.gz NLQLOQZCYFPPRU-LBPRGKRZSA-N 1 2 241.281 2.461 20 0 BEADLO ClC1(Cl)C[C@H]1C[N@@H+]1CCOCC12CC2 ZINC000801981208 586284974 /nfs/dbraw/zinc/28/49/74/586284974.db2.gz KUBCFUJLRGYDSN-QMMMGPOBSA-N 1 2 236.142 2.045 20 0 BEADLO ClC1(Cl)C[C@H]1C[N@H+]1CCOCC12CC2 ZINC000801981208 586284976 /nfs/dbraw/zinc/28/49/76/586284976.db2.gz KUBCFUJLRGYDSN-QMMMGPOBSA-N 1 2 236.142 2.045 20 0 BEADLO CCC[C@H](C)C(=O)O[C@@H]1CC[N@H+](CCF)C1 ZINC000802240425 586298617 /nfs/dbraw/zinc/29/86/17/586298617.db2.gz YGZAQMLOOYYHLY-WDEREUQCSA-N 1 2 231.311 2.010 20 0 BEADLO CCC[C@H](C)C(=O)O[C@@H]1CC[N@@H+](CCF)C1 ZINC000802240425 586298619 /nfs/dbraw/zinc/29/86/19/586298619.db2.gz YGZAQMLOOYYHLY-WDEREUQCSA-N 1 2 231.311 2.010 20 0 BEADLO CC(C)OCC(N)=[NH+]OCCSC(C)(C)C ZINC000802730575 586311079 /nfs/dbraw/zinc/31/10/79/586311079.db2.gz XGDOFKKQHGIRDM-UHFFFAOYSA-N 1 2 248.392 2.442 20 0 BEADLO Cn1cc[nH+]c1CCCOC(=O)C=C1CCCC1 ZINC000802784390 586313902 /nfs/dbraw/zinc/31/39/02/586313902.db2.gz NVMBAAGWXRRILC-UHFFFAOYSA-N 1 2 248.326 2.396 20 0 BEADLO CCC/C=C\C(=O)OCCCc1[nH+]ccn1C ZINC000802785054 586313931 /nfs/dbraw/zinc/31/39/31/586313931.db2.gz ZGIHLHIYMBXCAM-YVMONPNESA-N 1 2 236.315 2.252 20 0 BEADLO CCC[C@@H](C)C(=O)OCCCc1[nH+]ccn1C ZINC000802786570 586314147 /nfs/dbraw/zinc/31/41/47/586314147.db2.gz UKYFQZZWNYXZRG-LLVKDONJSA-N 1 2 238.331 2.332 20 0 BEADLO Cn1cc[nH+]c1CCCOC(=O)C1=CCCCC1 ZINC000802789149 586314313 /nfs/dbraw/zinc/31/43/13/586314313.db2.gz ZTYFMSORGKLPBV-UHFFFAOYSA-N 1 2 248.326 2.396 20 0 BEADLO C[C@H]1CN(C[NH+]2Cc3ccccc3C2)C(=O)[C@H]1C ZINC000839991250 586333350 /nfs/dbraw/zinc/33/33/50/586333350.db2.gz NERYBTCOLTYUCH-RYUDHWBXSA-N 1 2 244.338 2.074 20 0 BEADLO C[C@@H]1CN(C[NH+]2Cc3ccccc3C2)C(=O)[C@H]1C ZINC000839991246 586333408 /nfs/dbraw/zinc/33/34/08/586333408.db2.gz NERYBTCOLTYUCH-NEPJUHHUSA-N 1 2 244.338 2.074 20 0 BEADLO CCCCCCC(=O)N[C@H]1CCc2c[nH+]cn2C1 ZINC000804332708 586391638 /nfs/dbraw/zinc/39/16/38/586391638.db2.gz PRLHTEKPCIDXHD-LBPRGKRZSA-N 1 2 249.358 2.285 20 0 BEADLO CC[NH2+]Cc1noc(CCc2ccc(F)cc2)n1 ZINC000843145260 586444905 /nfs/dbraw/zinc/44/49/05/586444905.db2.gz HBQHDKGKWWDTBN-UHFFFAOYSA-N 1 2 249.289 2.103 20 0 BEADLO CC1(C)CCN(C[N@@H+]2CCC[C@](C)(F)C2)C1=O ZINC000840097149 586445910 /nfs/dbraw/zinc/44/59/10/586445910.db2.gz AVOMMNCWKZQXOP-ZDUSSCGKSA-N 1 2 242.338 2.026 20 0 BEADLO CC1(C)CCN(C[N@H+]2CCC[C@](C)(F)C2)C1=O ZINC000840097149 586445912 /nfs/dbraw/zinc/44/59/12/586445912.db2.gz AVOMMNCWKZQXOP-ZDUSSCGKSA-N 1 2 242.338 2.026 20 0 BEADLO CS[C@H]1CC[N@H+](Cn2ncc(Cl)c2C)C1 ZINC000840114759 586449043 /nfs/dbraw/zinc/44/90/43/586449043.db2.gz SAIBHVYSNCYGAP-VIFPVBQESA-N 1 2 245.779 2.240 20 0 BEADLO CS[C@H]1CC[N@@H+](Cn2ncc(Cl)c2C)C1 ZINC000840114759 586449044 /nfs/dbraw/zinc/44/90/44/586449044.db2.gz SAIBHVYSNCYGAP-VIFPVBQESA-N 1 2 245.779 2.240 20 0 BEADLO C[C@@H]1CC[N@H+](CN2C(=O)CCC2(C)C)C[C@@H]1F ZINC000808177590 586466490 /nfs/dbraw/zinc/46/64/90/586466490.db2.gz VFZMKCLOXPWNOF-MNOVXSKESA-N 1 2 242.338 2.025 20 0 BEADLO C[C@@H]1CC[N@@H+](CN2C(=O)CCC2(C)C)C[C@@H]1F ZINC000808177590 586466492 /nfs/dbraw/zinc/46/64/92/586466492.db2.gz VFZMKCLOXPWNOF-MNOVXSKESA-N 1 2 242.338 2.025 20 0 BEADLO CCC[C@@H]([NH2+]Cc1cn(C)cn1)c1ccccn1 ZINC000808386515 586469995 /nfs/dbraw/zinc/46/99/95/586469995.db2.gz GOAKIVAQBBXLKH-CYBMUJFWSA-N 1 2 244.342 2.446 20 0 BEADLO C[C@@H](O)c1cc(NCc2cn(C)c[nH+]2)ccc1F ZINC000808414561 586471448 /nfs/dbraw/zinc/47/14/48/586471448.db2.gz CJQPEWIVWNJBHX-SECBINFHSA-N 1 2 249.289 2.225 20 0 BEADLO CC1(CC(=O)OCCn2cc[nH+]c2)CCCC1 ZINC000808620798 586480441 /nfs/dbraw/zinc/48/04/41/586480441.db2.gz AEWIJLADVMJUST-UHFFFAOYSA-N 1 2 236.315 2.397 20 0 BEADLO CC(C)C(=O)CC[N@@H+]1CCC[C@@H](c2ccn[nH]2)C1 ZINC000808710346 586484027 /nfs/dbraw/zinc/48/40/27/586484027.db2.gz HZKUDZGWIXPJNH-GFCCVEGCSA-N 1 2 249.358 2.204 20 0 BEADLO CC(C)C(=O)CC[N@H+]1CCC[C@@H](c2ccn[nH]2)C1 ZINC000808710346 586484028 /nfs/dbraw/zinc/48/40/28/586484028.db2.gz HZKUDZGWIXPJNH-GFCCVEGCSA-N 1 2 249.358 2.204 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccoc2)C[C@H](C)[S@@]1=O ZINC000809699424 586514107 /nfs/dbraw/zinc/51/41/07/586514107.db2.gz OCOHFLLARUMPIQ-IETSOEAISA-N 1 2 241.356 2.011 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccoc2)C[C@H](C)[S@@]1=O ZINC000809699424 586514109 /nfs/dbraw/zinc/51/41/09/586514109.db2.gz OCOHFLLARUMPIQ-IETSOEAISA-N 1 2 241.356 2.011 20 0 BEADLO CO[C@H](C)C[N@H+](C)Cc1coc(C2CC2)n1 ZINC000809717769 586514964 /nfs/dbraw/zinc/51/49/64/586514964.db2.gz NAEFJAONIBUUGC-SECBINFHSA-N 1 2 224.304 2.019 20 0 BEADLO CO[C@H](C)C[N@@H+](C)Cc1coc(C2CC2)n1 ZINC000809717769 586514966 /nfs/dbraw/zinc/51/49/66/586514966.db2.gz NAEFJAONIBUUGC-SECBINFHSA-N 1 2 224.304 2.019 20 0 BEADLO CC[N@H+](Cc1cnn(C)n1)Cc1ccccc1C ZINC000809933872 586524644 /nfs/dbraw/zinc/52/46/44/586524644.db2.gz YJAVFAMEYOUCAI-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CC[N@@H+](Cc1cnn(C)n1)Cc1ccccc1C ZINC000809933872 586524646 /nfs/dbraw/zinc/52/46/46/586524646.db2.gz YJAVFAMEYOUCAI-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO Cc1ccccc1[C@@H](C)[N@H+](C)Cc1cnn(C)n1 ZINC000809935187 586524690 /nfs/dbraw/zinc/52/46/90/586524690.db2.gz PVOLCURJGOWKPM-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1ccccc1[C@@H](C)[N@@H+](C)Cc1cnn(C)n1 ZINC000809935187 586524692 /nfs/dbraw/zinc/52/46/92/586524692.db2.gz PVOLCURJGOWKPM-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1ncsc1CO[NH+]=C(N)c1ccccc1 ZINC000809990825 586529581 /nfs/dbraw/zinc/52/95/81/586529581.db2.gz IQJUDHMMLLXVET-UHFFFAOYSA-N 1 2 247.323 2.498 20 0 BEADLO CC[C@H](O)c1nccn1Cc1ccc(C)[nH+]c1C ZINC000810005248 586530768 /nfs/dbraw/zinc/53/07/68/586530768.db2.gz KCKLSWLZGGBOIP-ZDUSSCGKSA-N 1 2 245.326 2.387 20 0 BEADLO CC1CCC(=CC(=O)NCc2c[nH+]cn2C)CC1 ZINC000811924584 586568514 /nfs/dbraw/zinc/56/85/14/586568514.db2.gz BFMAHMWRBJVAHV-UHFFFAOYSA-N 1 2 247.342 2.173 20 0 BEADLO C/C(=C/C(C)(C)C)C(=O)NCc1c[nH+]cn1C ZINC000811924975 586568633 /nfs/dbraw/zinc/56/86/33/586568633.db2.gz UZTGUHNYKBDGDC-POHAHGRESA-N 1 2 235.331 2.029 20 0 BEADLO C/C(=C/C(=O)N1CCn2c[nH+]cc2C1)C(C)(C)C ZINC000811934228 586568957 /nfs/dbraw/zinc/56/89/57/586568957.db2.gz YQARXRIYVQPGCY-XFFZJAGNSA-N 1 2 247.342 2.218 20 0 BEADLO CSCc1nn(C[NH+]2CCCC2)c(=S)o1 ZINC000813022626 586589972 /nfs/dbraw/zinc/58/99/72/586589972.db2.gz DLRQCDRGIMSSTN-UHFFFAOYSA-N 1 2 245.373 2.122 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)CCCC1CC1 ZINC000813088454 586591171 /nfs/dbraw/zinc/59/11/71/586591171.db2.gz RKNIASZUVJSLFH-UHFFFAOYSA-N 1 2 236.315 2.086 20 0 BEADLO Cc1ccoc1C[N@@H+](C)[C@@H]1CC(C)(C)OC1=O ZINC000814179488 586615758 /nfs/dbraw/zinc/61/57/58/586615758.db2.gz DCTJGSBWSZLVQX-SNVBAGLBSA-N 1 2 237.299 2.114 20 0 BEADLO Cc1ccoc1C[N@H+](C)[C@@H]1CC(C)(C)OC1=O ZINC000814179488 586615759 /nfs/dbraw/zinc/61/57/59/586615759.db2.gz DCTJGSBWSZLVQX-SNVBAGLBSA-N 1 2 237.299 2.114 20 0 BEADLO CCc1nocc1C[NH2+]Cc1cccc(F)n1 ZINC000815131473 586668545 /nfs/dbraw/zinc/66/85/45/586668545.db2.gz FMQZCZBQWXGQMA-UHFFFAOYSA-N 1 2 235.262 2.061 20 0 BEADLO C[C@H]1C[N@H+](Cc2nnc(C(C)(C)C)o2)[C@H]1C ZINC000815162000 586672029 /nfs/dbraw/zinc/67/20/29/586672029.db2.gz FYUPPFBWLPEFTG-IUCAKERBSA-N 1 2 223.320 2.207 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nnc(C(C)(C)C)o2)[C@H]1C ZINC000815162000 586672030 /nfs/dbraw/zinc/67/20/30/586672030.db2.gz FYUPPFBWLPEFTG-IUCAKERBSA-N 1 2 223.320 2.207 20 0 BEADLO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1ncn(C)n1 ZINC000815599902 586688759 /nfs/dbraw/zinc/68/87/59/586688759.db2.gz FQMZDZMDINTOIY-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO Cc1nocc1C[N@@H+](C)Cc1c(C)noc1C ZINC000816491701 586736752 /nfs/dbraw/zinc/73/67/52/586736752.db2.gz VXBRISFIBXFYOM-UHFFFAOYSA-N 1 2 235.287 2.220 20 0 BEADLO Cc1nocc1C[N@H+](C)Cc1c(C)noc1C ZINC000816491701 586736754 /nfs/dbraw/zinc/73/67/54/586736754.db2.gz VXBRISFIBXFYOM-UHFFFAOYSA-N 1 2 235.287 2.220 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cnn(C)c2Cl)C[C@H]1F ZINC000816564564 586740753 /nfs/dbraw/zinc/74/07/53/586740753.db2.gz JTPIAVUMFRWEAH-PSASIEDQSA-N 1 2 245.729 2.253 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cnn(C)c2Cl)C[C@H]1F ZINC000816564564 586740754 /nfs/dbraw/zinc/74/07/54/586740754.db2.gz JTPIAVUMFRWEAH-PSASIEDQSA-N 1 2 245.729 2.253 20 0 BEADLO C[N@H+](CCF)Cc1cc(-c2ccccc2)n[nH]1 ZINC000816640158 586747335 /nfs/dbraw/zinc/74/73/35/586747335.db2.gz WYNJUYAQPWOTCG-UHFFFAOYSA-N 1 2 233.290 2.478 20 0 BEADLO C[N@@H+](CCF)Cc1cc(-c2ccccc2)n[nH]1 ZINC000816640158 586747337 /nfs/dbraw/zinc/74/73/37/586747337.db2.gz WYNJUYAQPWOTCG-UHFFFAOYSA-N 1 2 233.290 2.478 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1ccc(F)nc1 ZINC000816652626 586752344 /nfs/dbraw/zinc/75/23/44/586752344.db2.gz OVTUUMAGWBPNMH-UHFFFAOYSA-N 1 2 249.289 2.403 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1ccc(F)nc1 ZINC000816652626 586752346 /nfs/dbraw/zinc/75/23/46/586752346.db2.gz OVTUUMAGWBPNMH-UHFFFAOYSA-N 1 2 249.289 2.403 20 0 BEADLO C/C(=C/C(=O)N1CCc2[nH]c[nH+]c2C1)C(C)(C)C ZINC000816651940 586752912 /nfs/dbraw/zinc/75/29/12/586752912.db2.gz UUCNBCAGEOCXDC-YFHOEESVSA-N 1 2 247.342 2.287 20 0 BEADLO C/C(=C/C(=O)N1CCc2[nH+]c[nH]c2C1)C(C)(C)C ZINC000816651940 586752914 /nfs/dbraw/zinc/75/29/14/586752914.db2.gz UUCNBCAGEOCXDC-YFHOEESVSA-N 1 2 247.342 2.287 20 0 BEADLO Cc1ccccc1[C@@H](C)NC(=O)Cc1[nH]cc[nH+]1 ZINC000816811162 586765245 /nfs/dbraw/zinc/76/52/45/586765245.db2.gz OYPBPWJQNKJJGT-LLVKDONJSA-N 1 2 243.310 2.138 20 0 BEADLO CCC(CC)CN(CC)C(=O)Cc1[nH]cc[nH+]1 ZINC000816870907 586767399 /nfs/dbraw/zinc/76/73/99/586767399.db2.gz SQVMLRASQYONLG-UHFFFAOYSA-N 1 2 237.347 2.237 20 0 BEADLO Nc1cc(COC(=O)[C@@H]2CC[C@H]3C[C@H]3C2)cc[nH+]1 ZINC000817204401 586785773 /nfs/dbraw/zinc/78/57/73/586785773.db2.gz YDKALQNEAXWHDY-TUAOUCFPSA-N 1 2 246.310 2.143 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000817204423 586785965 /nfs/dbraw/zinc/78/59/65/586785965.db2.gz YJSUENPUYVLACQ-JHJVBQTASA-N 1 2 248.326 2.253 20 0 BEADLO Nc1cc(COC(=O)[C@@H]2CC[C@@H]3C[C@@H]3C2)cc[nH+]1 ZINC000817204399 586785971 /nfs/dbraw/zinc/78/59/71/586785971.db2.gz YDKALQNEAXWHDY-IJLUTSLNSA-N 1 2 246.310 2.143 20 0 BEADLO Cn1ccc(N[C@@H]2CCc3ccc[nH+]c3CC2)n1 ZINC000817579062 586812958 /nfs/dbraw/zinc/81/29/58/586812958.db2.gz SXIAPCTVNGTWNP-GFCCVEGCSA-N 1 2 242.326 2.175 20 0 BEADLO CC(C)c1nc(N2CCC[C@@H]3COC[C@@H]32)cc[nH+]1 ZINC000840345367 586815359 /nfs/dbraw/zinc/81/53/59/586815359.db2.gz KWKKCYRLCBEWBG-NEPJUHHUSA-N 1 2 247.342 2.215 20 0 BEADLO Cc1cc([NH+](C)C)ccc1NC[C@H](O)C1CC1 ZINC000819410062 586962035 /nfs/dbraw/zinc/96/20/35/586962035.db2.gz VYOAAQPIHZNELF-AWEZNQCLSA-N 1 2 234.343 2.244 20 0 BEADLO Cc1cc([NH2+]CCC(N)=O)ccc1OC(C)C ZINC000819448667 586964922 /nfs/dbraw/zinc/96/49/22/586964922.db2.gz ADJUVFWAMGDCBO-UHFFFAOYSA-N 1 2 236.315 2.070 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)CSC(C)(C)C)S1 ZINC000819763326 586990726 /nfs/dbraw/zinc/99/07/26/586990726.db2.gz NQZZTEFYXXZJCY-SSDOTTSWSA-N 1 2 246.401 2.126 20 0 BEADLO C[C@H](CC(=O)NC1=[NH+]C[C@@H](C)S1)C1CC1 ZINC000819766431 586991832 /nfs/dbraw/zinc/99/18/32/586991832.db2.gz OGJFVNHVXUFCAM-HTQZYQBOSA-N 1 2 226.345 2.030 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)C=C2CCCCC2)S1 ZINC000819766225 586991895 /nfs/dbraw/zinc/99/18/95/586991895.db2.gz NBOSALFEDWKHAG-VIFPVBQESA-N 1 2 238.356 2.484 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)NC2=[NH+]C[C@H](C)S2)C1 ZINC000819775396 586992478 /nfs/dbraw/zinc/99/24/78/586992478.db2.gz FTVHIESABJHTJJ-VGMNWLOBSA-N 1 2 226.345 2.030 20 0 BEADLO CCC(C)(CC)C(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819775571 586992702 /nfs/dbraw/zinc/99/27/02/586992702.db2.gz HMFZJEOIIRLFJP-QMMMGPOBSA-N 1 2 228.361 2.420 20 0 BEADLO CC/C(C)=C(\C)C(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819777911 586993427 /nfs/dbraw/zinc/99/34/27/586993427.db2.gz WHINDJJIBANVMH-INTFFVIUSA-N 1 2 226.345 2.340 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)[C@@]2(C)CC=CCC2)S1 ZINC000819781078 586993778 /nfs/dbraw/zinc/99/37/78/586993778.db2.gz LDXIPNIRNWMULJ-SKDRFNHKSA-N 1 2 238.356 2.340 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)C2=CC[C@H](C)CC2)S1 ZINC000819780714 586993802 /nfs/dbraw/zinc/99/38/02/586993802.db2.gz ITSLUBUCCPGVGZ-IUCAKERBSA-N 1 2 238.356 2.340 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)C2=CC[C@@H](C)CC2)S1 ZINC000819780712 586993947 /nfs/dbraw/zinc/99/39/47/586993947.db2.gz ITSLUBUCCPGVGZ-BDAKNGLRSA-N 1 2 238.356 2.340 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)C2=CC[C@H](C)CC2)S1 ZINC000819780713 586994291 /nfs/dbraw/zinc/99/42/91/586994291.db2.gz ITSLUBUCCPGVGZ-DTWKUNHWSA-N 1 2 238.356 2.340 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)[C@H]2CCCC[C@@H]2C)S1 ZINC000819784511 586994629 /nfs/dbraw/zinc/99/46/29/586994629.db2.gz ROTMWBHNTHVJAL-AEJSXWLSSA-N 1 2 240.372 2.420 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)C2=CCCCCC2)S1 ZINC000819784020 586994656 /nfs/dbraw/zinc/99/46/56/586994656.db2.gz WJLXZFBGRSKLDQ-VIFPVBQESA-N 1 2 238.356 2.484 20 0 BEADLO CC(C)C(C)(C)C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819783365 586994782 /nfs/dbraw/zinc/99/47/82/586994782.db2.gz SIZZBXUUAFFTEL-MRVPVSSYSA-N 1 2 228.361 2.276 20 0 BEADLO Cc1cn2ccc(C(=O)N3CCC3(C)C)cc2[nH+]1 ZINC000820176964 587032539 /nfs/dbraw/zinc/03/25/39/587032539.db2.gz LJBPTPAEKKMIQG-UHFFFAOYSA-N 1 2 243.310 2.267 20 0 BEADLO C[C@@H](F)CCNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000820630009 587060178 /nfs/dbraw/zinc/06/01/78/587060178.db2.gz HTIGVRZJNFZLSV-MRVPVSSYSA-N 1 2 235.262 2.041 20 0 BEADLO Cc1cnc(N2CCC(n3cc[nH+]c3)CC2)o1 ZINC000820645044 587061231 /nfs/dbraw/zinc/06/12/31/587061231.db2.gz NPDHTOUBCYMBAD-UHFFFAOYSA-N 1 2 232.287 2.021 20 0 BEADLO C[C@@H]1CCN(c2nccs2)C[C@H]1n1cc[nH+]c1 ZINC000820674831 587064995 /nfs/dbraw/zinc/06/49/95/587064995.db2.gz CDEKKPBZBHHOBF-GHMZBOCLSA-N 1 2 248.355 2.427 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C[C@H]1CC=CCC1 ZINC000821239595 587103255 /nfs/dbraw/zinc/10/32/55/587103255.db2.gz SYVBQWOXAYEYRO-LBPRGKRZSA-N 1 2 247.342 2.266 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)CCC1(C)CC1 ZINC000821239452 587103302 /nfs/dbraw/zinc/10/33/02/587103302.db2.gz RHKODIHOCGXUEF-UHFFFAOYSA-N 1 2 235.331 2.100 20 0 BEADLO CC[C@@H](C)C(=O)OCc1ccc[nH+]c1N(C)C ZINC000821608253 587132535 /nfs/dbraw/zinc/13/25/35/587132535.db2.gz ZFVZLXBGRWBASP-SNVBAGLBSA-N 1 2 236.315 2.237 20 0 BEADLO CC(C)CC(=O)OCc1ccc[nH+]c1N(C)C ZINC000821608005 587132545 /nfs/dbraw/zinc/13/25/45/587132545.db2.gz ONGJEFJCAOKUHE-UHFFFAOYSA-N 1 2 236.315 2.237 20 0 BEADLO CN(C)c1[nH+]cccc1COC(=O)[C@@H]1CC1(C)C ZINC000821608939 587132591 /nfs/dbraw/zinc/13/25/91/587132591.db2.gz AQTYAXBQBDVCJY-NSHDSACASA-N 1 2 248.326 2.237 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)[C@@]2(C)C=CCC2)c2[nH+]ccn21 ZINC000821786943 587138182 /nfs/dbraw/zinc/13/81/82/587138182.db2.gz PJNURRMEIMXTRH-GYSYKLTISA-N 1 2 245.326 2.361 20 0 BEADLO CC(C)(C)c1[nH+]c[nH]c1COC(=O)c1cocn1 ZINC000822315626 587161719 /nfs/dbraw/zinc/16/17/19/587161719.db2.gz PEOMMEMPJFNUND-UHFFFAOYSA-N 1 2 249.270 2.052 20 0 BEADLO CC(C)[C@@H]1C[C@H]1NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000822442050 587168701 /nfs/dbraw/zinc/16/87/01/587168701.db2.gz FKZXGUNPRBRDNG-CMPLNLGQSA-N 1 2 243.310 2.337 20 0 BEADLO CN(C(=O)/C=C\c1cn(C)c[nH+]1)C1CC(C)(C)C1 ZINC000822456934 587169504 /nfs/dbraw/zinc/16/95/04/587169504.db2.gz HUEFFLNDEPJZEH-WAYWQWQTSA-N 1 2 247.342 2.080 20 0 BEADLO Cn1c[nH+]c(/C=C/C(=O)N[C@]2(C)CC=CCC2)c1 ZINC000822492795 587171727 /nfs/dbraw/zinc/17/17/27/587171727.db2.gz IHHHXEWKUGCDLZ-PSKZRQQASA-N 1 2 245.326 2.048 20 0 BEADLO CCC[C@@H](CC)C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000823237432 587210657 /nfs/dbraw/zinc/21/06/57/587210657.db2.gz VNOBPHOLWIYUNN-MNOVXSKESA-N 1 2 235.331 2.270 20 0 BEADLO C[C@@H]1CCC[N@H+](CCF)[C@@H]1C(=O)OC(C)(C)C ZINC000823509652 587228695 /nfs/dbraw/zinc/22/86/95/587228695.db2.gz PTDOZFWQFSTHBB-MNOVXSKESA-N 1 2 245.338 2.398 20 0 BEADLO C[C@@H]1CCC[N@@H+](CCF)[C@@H]1C(=O)OC(C)(C)C ZINC000823509652 587228696 /nfs/dbraw/zinc/22/86/96/587228696.db2.gz PTDOZFWQFSTHBB-MNOVXSKESA-N 1 2 245.338 2.398 20 0 BEADLO C[C@H]1CCC[N@H+](CCF)[C@H]1C(=O)OC(C)(C)C ZINC000823509654 587228762 /nfs/dbraw/zinc/22/87/62/587228762.db2.gz PTDOZFWQFSTHBB-WDEREUQCSA-N 1 2 245.338 2.398 20 0 BEADLO C[C@H]1CCC[N@@H+](CCF)[C@H]1C(=O)OC(C)(C)C ZINC000823509654 587228763 /nfs/dbraw/zinc/22/87/63/587228763.db2.gz PTDOZFWQFSTHBB-WDEREUQCSA-N 1 2 245.338 2.398 20 0 BEADLO Cn1nc(C2CC2)cc1CNc1cccc[nH+]1 ZINC000823676802 587235953 /nfs/dbraw/zinc/23/59/53/587235953.db2.gz IZUZMXLNYZPKSS-UHFFFAOYSA-N 1 2 228.299 2.305 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)C[C@@H]1CCCOC1 ZINC000823837091 587242152 /nfs/dbraw/zinc/24/21/52/587242152.db2.gz XUZNDXMQRVJJRS-LBPRGKRZSA-N 1 2 248.326 2.454 20 0 BEADLO Fc1cc(C[NH+]2CC(C3CC3)C2)c(F)cn1 ZINC000824424139 587270059 /nfs/dbraw/zinc/27/00/59/587270059.db2.gz YYLUYKBXMRGURK-UHFFFAOYSA-N 1 2 224.254 2.202 20 0 BEADLO CC[C@H]([NH2+]Cc1ccc(F)nc1)C(F)F ZINC000824509918 587272456 /nfs/dbraw/zinc/27/24/56/587272456.db2.gz QBSUXAWQHWARML-QMMMGPOBSA-N 1 2 218.222 2.354 20 0 BEADLO COc1cccc(C[NH+]2CC3(CC3)C2)c1F ZINC000824533741 587274206 /nfs/dbraw/zinc/27/42/06/587274206.db2.gz MEDWVRFTNLTSEL-UHFFFAOYSA-N 1 2 221.275 2.430 20 0 BEADLO Cc1cc(C[NH2+]C(CF)CF)c(C)o1 ZINC000824554292 587276003 /nfs/dbraw/zinc/27/60/03/587276003.db2.gz DXWHJJIOABOFBI-UHFFFAOYSA-N 1 2 203.232 2.294 20 0 BEADLO Fc1cc(C[N@@H+]2CC[C@H]2C2CC2)c(F)cn1 ZINC000824653684 587281462 /nfs/dbraw/zinc/28/14/62/587281462.db2.gz FILPJAZDRYFYKJ-NSHDSACASA-N 1 2 224.254 2.344 20 0 BEADLO Fc1cc(C[N@H+]2CC[C@H]2C2CC2)c(F)cn1 ZINC000824653684 587281463 /nfs/dbraw/zinc/28/14/63/587281463.db2.gz FILPJAZDRYFYKJ-NSHDSACASA-N 1 2 224.254 2.344 20 0 BEADLO C[C@@]1(C[NH2+]Cc2ccn[nH]2)CC1(Cl)Cl ZINC000824765507 587286491 /nfs/dbraw/zinc/28/64/91/587286491.db2.gz MNWRUVVILMBXOP-QMMMGPOBSA-N 1 2 234.130 2.083 20 0 BEADLO CC1(C[NH2+]c2ccc(O[C@@H]3CC(=O)N3)cc2)CC1 ZINC000825000291 587297986 /nfs/dbraw/zinc/29/79/86/587297986.db2.gz YPNMOFGTPLTYIV-CYBMUJFWSA-N 1 2 246.310 2.123 20 0 BEADLO CC[C@H](C)C[NH2+]c1ccc(O[C@H]2CC(=O)N2)cc1 ZINC000824998812 587298157 /nfs/dbraw/zinc/29/81/57/587298157.db2.gz CWVADDHGWPAAED-HZMBPMFUSA-N 1 2 248.326 2.369 20 0 BEADLO CCC(CC)N(C(=O)Cc1[nH]cc[nH+]1)C1CC1 ZINC000825326722 587315468 /nfs/dbraw/zinc/31/54/68/587315468.db2.gz SHZSMNLXLWWDKY-UHFFFAOYSA-N 1 2 235.331 2.132 20 0 BEADLO O=C(C[C@@H]1CC=CCC1)N[C@H]1CCn2c[nH+]cc21 ZINC000825514315 587322325 /nfs/dbraw/zinc/32/23/25/587322325.db2.gz ZWDFRZFQPRCLCP-NEPJUHHUSA-N 1 2 245.326 2.191 20 0 BEADLO O=C(c1cc2c[nH+]ccc2[nH]1)N1CC[C@H]2C[C@H]2C1 ZINC000825603875 587327018 /nfs/dbraw/zinc/32/70/18/587327018.db2.gz GMDFQXVPGKGWKY-ONGXEEELSA-N 1 2 241.294 2.045 20 0 BEADLO CCCC[C@@H]1CCC[C@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000825773732 587338155 /nfs/dbraw/zinc/33/81/55/587338155.db2.gz OKJANQIQOGGRDW-VXGBXAGGSA-N 1 2 249.358 2.427 20 0 BEADLO CCCC[C@H]1CCC[C@@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000825773731 587338556 /nfs/dbraw/zinc/33/85/56/587338556.db2.gz OKJANQIQOGGRDW-RYUDHWBXSA-N 1 2 249.358 2.427 20 0 BEADLO CC(C)[C@H]1CCCC[C@@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000826043940 587349276 /nfs/dbraw/zinc/34/92/76/587349276.db2.gz WMOJLSPLCPFXTK-NEPJUHHUSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@@H](C)C(=O)NC[C@H]1c2ccccc2C[N@H+]1C ZINC000826731806 587360515 /nfs/dbraw/zinc/36/05/15/587360515.db2.gz ZMXNFLRYTRZERZ-RISCZKNCSA-N 1 2 246.354 2.335 20 0 BEADLO CC[C@@H](C)C(=O)NC[C@H]1c2ccccc2C[N@@H+]1C ZINC000826731806 587360516 /nfs/dbraw/zinc/36/05/16/587360516.db2.gz ZMXNFLRYTRZERZ-RISCZKNCSA-N 1 2 246.354 2.335 20 0 BEADLO C[N@@H+]1Cc2ccccc2[C@@H]1CNC(=O)C(C)(C)C ZINC000826731313 587360561 /nfs/dbraw/zinc/36/05/61/587360561.db2.gz USONTAPZLSEBNG-ZDUSSCGKSA-N 1 2 246.354 2.335 20 0 BEADLO C[N@H+]1Cc2ccccc2[C@@H]1CNC(=O)C(C)(C)C ZINC000826731313 587360562 /nfs/dbraw/zinc/36/05/62/587360562.db2.gz USONTAPZLSEBNG-ZDUSSCGKSA-N 1 2 246.354 2.335 20 0 BEADLO C[N@@H+]1Cc2ccccc2[C@H]1CNC(=O)C1CCC1 ZINC000826736006 587360658 /nfs/dbraw/zinc/36/06/58/587360658.db2.gz GXTCLKBFGJHVMU-CQSZACIVSA-N 1 2 244.338 2.089 20 0 BEADLO C[N@H+]1Cc2ccccc2[C@H]1CNC(=O)C1CCC1 ZINC000826736006 587360659 /nfs/dbraw/zinc/36/06/59/587360659.db2.gz GXTCLKBFGJHVMU-CQSZACIVSA-N 1 2 244.338 2.089 20 0 BEADLO COCC[N@H+](CCF)Cc1ccoc1C ZINC000827048940 587368805 /nfs/dbraw/zinc/36/88/05/587368805.db2.gz SLXYXACUQUFXNK-UHFFFAOYSA-N 1 2 215.268 2.006 20 0 BEADLO COCC[N@@H+](CCF)Cc1ccoc1C ZINC000827048940 587368806 /nfs/dbraw/zinc/36/88/06/587368806.db2.gz SLXYXACUQUFXNK-UHFFFAOYSA-N 1 2 215.268 2.006 20 0 BEADLO CCc1ncc(C[N@H+](CCF)CCOC)s1 ZINC000827053786 587369247 /nfs/dbraw/zinc/36/92/47/587369247.db2.gz GJVKZENSJKZFFU-UHFFFAOYSA-N 1 2 246.351 2.123 20 0 BEADLO CCc1ncc(C[N@@H+](CCF)CCOC)s1 ZINC000827053786 587369248 /nfs/dbraw/zinc/36/92/48/587369248.db2.gz GJVKZENSJKZFFU-UHFFFAOYSA-N 1 2 246.351 2.123 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)C[C@]1(C)CC1(Cl)Cl ZINC000827804228 587402955 /nfs/dbraw/zinc/40/29/55/587402955.db2.gz XKHRSOASHKWKNE-VIFPVBQESA-N 1 2 248.157 2.425 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)C[C@]1(C)CC1(Cl)Cl ZINC000827804228 587402957 /nfs/dbraw/zinc/40/29/57/587402957.db2.gz XKHRSOASHKWKNE-VIFPVBQESA-N 1 2 248.157 2.425 20 0 BEADLO Cc1cc(C[NH2+][C@H](c2ccccc2)[C@H](C)O)no1 ZINC000827855600 587405829 /nfs/dbraw/zinc/40/58/29/587405829.db2.gz FULOQCQMRJMVLI-FZMZJTMJSA-N 1 2 246.310 2.195 20 0 BEADLO CC(C)CC1CC[NH+](Cc2cnn[nH]2)CC1 ZINC000828047353 587417487 /nfs/dbraw/zinc/41/74/87/587417487.db2.gz LERDPVGUBYDKIW-UHFFFAOYSA-N 1 2 222.336 2.063 20 0 BEADLO CC(C)CC1CC[NH+](Cc2c[nH]nn2)CC1 ZINC000828047353 587417489 /nfs/dbraw/zinc/41/74/89/587417489.db2.gz LERDPVGUBYDKIW-UHFFFAOYSA-N 1 2 222.336 2.063 20 0 BEADLO CC(C)CC1CC[NH+](Cc2cn[nH]n2)CC1 ZINC000828047353 587417491 /nfs/dbraw/zinc/41/74/91/587417491.db2.gz LERDPVGUBYDKIW-UHFFFAOYSA-N 1 2 222.336 2.063 20 0 BEADLO CC/C(C)=C\C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000828316158 587434204 /nfs/dbraw/zinc/43/42/04/587434204.db2.gz DRJCSMKANNAQQE-JUDLJHIGSA-N 1 2 233.315 2.430 20 0 BEADLO CC[C@@H]1CCCCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC000828444068 587442817 /nfs/dbraw/zinc/44/28/17/587442817.db2.gz UHFXUMBNJVVBOR-LLVKDONJSA-N 1 2 235.331 2.133 20 0 BEADLO CCc1nc(CNc2cc(CC)[nH+]cn2)co1 ZINC000829183449 587486855 /nfs/dbraw/zinc/48/68/55/587486855.db2.gz ANLNQBYMAPTWSB-UHFFFAOYSA-N 1 2 232.287 2.202 20 0 BEADLO C[C@H]1CC(C)(C)CC[C@@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000829663329 587508396 /nfs/dbraw/zinc/50/83/96/587508396.db2.gz FEMNWRARRDFAKH-QWRGUYRKSA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)CC(C)(C)CNC(=O)Cc1[nH]cc[nH+]1 ZINC000829807253 587517646 /nfs/dbraw/zinc/51/76/46/587517646.db2.gz YYOYMKYMPGOASV-UHFFFAOYSA-N 1 2 237.347 2.141 20 0 BEADLO Cc1ccc(SCC[NH+]2CCOCC2)s1 ZINC000830043131 587533361 /nfs/dbraw/zinc/53/33/61/587533361.db2.gz KBWJNKWHMRWKJH-UHFFFAOYSA-N 1 2 243.397 2.481 20 0 BEADLO O[C@@H](C[N@@H+]1CC[C@@H](F)C1)c1c(F)cccc1F ZINC000830467229 587552449 /nfs/dbraw/zinc/55/24/49/587552449.db2.gz JCONXCMWDZHTJU-KCJUWKMLSA-N 1 2 245.244 2.042 20 0 BEADLO O[C@@H](C[N@H+]1CC[C@@H](F)C1)c1c(F)cccc1F ZINC000830467229 587552451 /nfs/dbraw/zinc/55/24/51/587552451.db2.gz JCONXCMWDZHTJU-KCJUWKMLSA-N 1 2 245.244 2.042 20 0 BEADLO O[C@@H](C[N@@H+]1CC[C@H](F)C1)c1c(F)cccc1F ZINC000830467230 587552541 /nfs/dbraw/zinc/55/25/41/587552541.db2.gz JCONXCMWDZHTJU-KWQFWETISA-N 1 2 245.244 2.042 20 0 BEADLO O[C@@H](C[N@H+]1CC[C@H](F)C1)c1c(F)cccc1F ZINC000830467230 587552543 /nfs/dbraw/zinc/55/25/43/587552543.db2.gz JCONXCMWDZHTJU-KWQFWETISA-N 1 2 245.244 2.042 20 0 BEADLO CCC[C@@H](C)[C@@H]1CCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC000830498827 587554643 /nfs/dbraw/zinc/55/46/43/587554643.db2.gz RBCOJDQICCRSLV-NEPJUHHUSA-N 1 2 249.358 2.379 20 0 BEADLO CC(C)CC[C@H]1CCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC000830499185 587554733 /nfs/dbraw/zinc/55/47/33/587554733.db2.gz ULVHLMXJTRLUQP-GFCCVEGCSA-N 1 2 249.358 2.379 20 0 BEADLO O[C@@H](C[N@@H+]1CC[C@H](F)C1)c1cc(F)ccc1F ZINC000831187470 587590703 /nfs/dbraw/zinc/59/07/03/587590703.db2.gz GHGSVTYGTZUMBA-CABZTGNLSA-N 1 2 245.244 2.042 20 0 BEADLO O[C@@H](C[N@H+]1CC[C@H](F)C1)c1cc(F)ccc1F ZINC000831187470 587590705 /nfs/dbraw/zinc/59/07/05/587590705.db2.gz GHGSVTYGTZUMBA-CABZTGNLSA-N 1 2 245.244 2.042 20 0 BEADLO CCC(F)(F)C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000831607803 587623092 /nfs/dbraw/zinc/62/30/92/587623092.db2.gz WPUGIEXYYLXEAN-MRVPVSSYSA-N 1 2 243.257 2.119 20 0 BEADLO CCc1cc(NC(=O)Cc2[nH]cc[nH+]2)ccc1C ZINC000831807728 587632956 /nfs/dbraw/zinc/63/29/56/587632956.db2.gz WRVBSHOTEBSBHF-UHFFFAOYSA-N 1 2 243.310 2.462 20 0 BEADLO c1coc([C@@H]2[N@H+](CC3OCCO3)CC23CCC3)c1 ZINC000832236147 587651832 /nfs/dbraw/zinc/65/18/32/587651832.db2.gz GDNWVULFTBWROE-ZDUSSCGKSA-N 1 2 249.310 2.180 20 0 BEADLO c1coc([C@@H]2[N@@H+](CC3OCCO3)CC23CCC3)c1 ZINC000832236147 587651834 /nfs/dbraw/zinc/65/18/34/587651834.db2.gz GDNWVULFTBWROE-ZDUSSCGKSA-N 1 2 249.310 2.180 20 0 BEADLO O=C(N[C@H]1CCn2cc[nH+]c21)C1=CCCCCC1 ZINC000833271300 587703520 /nfs/dbraw/zinc/70/35/20/587703520.db2.gz GELARPPOYPYNRL-LBPRGKRZSA-N 1 2 245.326 2.335 20 0 BEADLO CCCC[C@H](C)C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833273089 587703709 /nfs/dbraw/zinc/70/37/09/587703709.db2.gz XLFIMOIKQYBVIM-WDEREUQCSA-N 1 2 235.331 2.270 20 0 BEADLO Cc1csc(C(=O)N[C@H]2CCn3cc[nH+]c32)c1 ZINC000833271337 587703826 /nfs/dbraw/zinc/70/38/26/587703826.db2.gz GTVRWABKQQZRNP-VIFPVBQESA-N 1 2 247.323 2.128 20 0 BEADLO C[C@@H]1CCC[C@H]1CC(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833279000 587703890 /nfs/dbraw/zinc/70/38/90/587703890.db2.gz WNTZWDNBEZFEFU-GRYCIOLGSA-N 1 2 247.342 2.270 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833278755 587704202 /nfs/dbraw/zinc/70/42/02/587704202.db2.gz VBTLOLSTXSUQDB-HBNTYKKESA-N 1 2 235.331 2.126 20 0 BEADLO O=C(CC1=CCCCC1)N[C@@H]1CCn2cc[nH+]c21 ZINC000833292688 587704609 /nfs/dbraw/zinc/70/46/09/587704609.db2.gz KGLBGSLOFLIXLC-GFCCVEGCSA-N 1 2 245.326 2.335 20 0 BEADLO CCC(=CC(=O)N[C@H]1CCn2cc[nH+]c21)CC ZINC000833284172 587704653 /nfs/dbraw/zinc/70/46/53/587704653.db2.gz HGYRFEVFAKIABL-NSHDSACASA-N 1 2 233.315 2.191 20 0 BEADLO CCC(CC)CC(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833283712 587704660 /nfs/dbraw/zinc/70/46/60/587704660.db2.gz DWXVDQXOLQWAGY-LLVKDONJSA-N 1 2 235.331 2.270 20 0 BEADLO CCC/C(C)=C/C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833285317 587704664 /nfs/dbraw/zinc/70/46/64/587704664.db2.gz QHJDBHJZOADGLR-PBQZMEPESA-N 1 2 233.315 2.191 20 0 BEADLO CCC(C)(C)CC(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833285458 587704727 /nfs/dbraw/zinc/70/47/27/587704727.db2.gz RGQVBWARJOMBCA-JTQLQIEISA-N 1 2 235.331 2.270 20 0 BEADLO CCCC1(C(=O)N[C@@H]2CCn3cc[nH+]c32)CC1 ZINC000833284714 587704908 /nfs/dbraw/zinc/70/49/08/587704908.db2.gz KFNATXUAXBDELR-SNVBAGLBSA-N 1 2 233.315 2.024 20 0 BEADLO Cc1ccc(C(=O)N[C@@H]2CCn3cc[nH+]c32)s1 ZINC000833305145 587705112 /nfs/dbraw/zinc/70/51/12/587705112.db2.gz KOXPYIGSVPXZLT-SECBINFHSA-N 1 2 247.323 2.128 20 0 BEADLO Cc1[nH]c(C(=O)NCCC[C@H]2C=CCC2)c[nH+]1 ZINC000834335039 587752504 /nfs/dbraw/zinc/75/25/04/587752504.db2.gz SPBWKOLMYRFDPY-NSHDSACASA-N 1 2 233.315 2.194 20 0 BEADLO C=CC(=O)N1CCCC[C@@H]1c1c[nH+]cn1CC ZINC000834395115 587754267 /nfs/dbraw/zinc/75/42/67/587754267.db2.gz MAJIVHNXTZFIKE-LLVKDONJSA-N 1 2 233.315 2.143 20 0 BEADLO CCC[N@H+](C)Cn1nc(C(C)C)n(C)c1=S ZINC000101903364 587779677 /nfs/dbraw/zinc/77/96/77/587779677.db2.gz KHBVHPODCZSYID-UHFFFAOYSA-N 1 2 242.392 2.374 20 0 BEADLO CCC[N@@H+](C)Cn1nc(C(C)C)n(C)c1=S ZINC000101903364 587779678 /nfs/dbraw/zinc/77/96/78/587779678.db2.gz KHBVHPODCZSYID-UHFFFAOYSA-N 1 2 242.392 2.374 20 0 BEADLO Cc1csc(C(=O)OCc2c[nH+]cn2C)c1 ZINC000835194964 587788238 /nfs/dbraw/zinc/78/82/38/587788238.db2.gz VFXMMHFUMZPKER-UHFFFAOYSA-N 1 2 236.296 2.147 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@@]1(C)CC=CCC1 ZINC000835196344 587788486 /nfs/dbraw/zinc/78/84/86/587788486.db2.gz XMVNLHKMJRUGKG-ZDUSSCGKSA-N 1 2 234.299 2.210 20 0 BEADLO C[C@@H]1CCC[C@@]1(C)C(=O)OCc1c[nH+]cn1C ZINC000835195746 587788564 /nfs/dbraw/zinc/78/85/64/587788564.db2.gz ZWNMYYTYHGHQRI-ZWNOBZJWSA-N 1 2 236.315 2.290 20 0 BEADLO C[C@@H]1CC=C(C(=O)OCCc2c[nH+]cn2C)CC1 ZINC000835323416 587796281 /nfs/dbraw/zinc/79/62/81/587796281.db2.gz MKXPJIZRLAWUFO-LLVKDONJSA-N 1 2 248.326 2.252 20 0 BEADLO CC[C@H]1CCC[C@@H]1C(=O)OCCn1cc[nH+]c1 ZINC000835348882 587797706 /nfs/dbraw/zinc/79/77/06/587797706.db2.gz DHWDGMVIFAEKJX-RYUDHWBXSA-N 1 2 236.315 2.253 20 0 BEADLO C[C@@H]1CC=C(C(=O)OCCn2cc[nH+]c2)CC1 ZINC000835349380 587797853 /nfs/dbraw/zinc/79/78/53/587797853.db2.gz GNNVXAOGOWGHTR-LLVKDONJSA-N 1 2 234.299 2.173 20 0 BEADLO Cc1[nH+]c2cc(OC(=O)[C@H]3C[C@H]3C)ccc2n1C ZINC000835505507 587806242 /nfs/dbraw/zinc/80/62/42/587806242.db2.gz BZDNOHORDLORTG-KCJUWKMLSA-N 1 2 244.294 2.443 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)N2CCCCC2)c2[nH+]ccn21 ZINC000836240928 587829482 /nfs/dbraw/zinc/82/94/82/587829482.db2.gz RWYVLSXIDWGJPI-GHMZBOCLSA-N 1 2 248.330 2.084 20 0 BEADLO CC/C=C(\F)C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000867179767 587834853 /nfs/dbraw/zinc/83/48/53/587834853.db2.gz PUBIGEGPOPNJIB-ZUYFITGHSA-N 1 2 237.278 2.337 20 0 BEADLO C[C@H](CC(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21)C1CC1 ZINC000836954569 587843701 /nfs/dbraw/zinc/84/37/01/587843701.db2.gz LYPXJPYEQYPAGC-CKYFFXLPSA-N 1 2 247.342 2.441 20 0 BEADLO C/C=C(\CC)C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000836962486 587844305 /nfs/dbraw/zinc/84/43/05/587844305.db2.gz ZTRZUCAFWATEID-YWFSICMQSA-N 1 2 233.315 2.361 20 0 BEADLO Cc1cc(C)c(CNC(=O)[C@H]2CCC=CO2)c[nH+]1 ZINC000837104852 587854180 /nfs/dbraw/zinc/85/41/80/587854180.db2.gz NJKGBJSSEJZFAR-CYBMUJFWSA-N 1 2 246.310 2.007 20 0 BEADLO CC[C@@H](CC(=O)NC1=[NH+]CCS1)C(C)C ZINC000104213229 587949076 /nfs/dbraw/zinc/94/90/76/587949076.db2.gz ZPBBGGHJKUQKHO-VIFPVBQESA-N 1 2 228.361 2.278 20 0 BEADLO O=C(OCCCF)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000841510607 587957166 /nfs/dbraw/zinc/95/71/66/587957166.db2.gz HGXGEVNEEWVNOD-SECBINFHSA-N 1 2 241.266 2.043 20 0 BEADLO Cc1cc(C[NH+]2CC(CC(F)(F)F)C2)n(C)n1 ZINC000841887272 587981116 /nfs/dbraw/zinc/98/11/16/587981116.db2.gz KGXHPRHHBFWWAL-UHFFFAOYSA-N 1 2 247.264 2.113 20 0 BEADLO CC(C)C[C@H](C)O[NH+]=C(N)COC(C)C ZINC000842025846 587990090 /nfs/dbraw/zinc/99/00/90/587990090.db2.gz VUULNRLGEZOYGA-JTQLQIEISA-N 1 2 216.325 2.344 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OCCC1=CCCCC1 ZINC000842037394 587992200 /nfs/dbraw/zinc/99/22/00/587992200.db2.gz YUZDZFXVBGATBK-SNVBAGLBSA-N 1 2 226.320 2.410 20 0 BEADLO NC(=[NH+]OC[C@H]1CCC(F)(F)C1)[C@H]1CCCO1 ZINC000842046278 587992394 /nfs/dbraw/zinc/99/23/94/587992394.db2.gz BBCQNNCBMNNPGY-DTWKUNHWSA-N 1 2 248.273 2.099 20 0 BEADLO Cn1c[nH+]cc1COC(=O)C1CC2(CCC2)C1 ZINC000842725916 588056131 /nfs/dbraw/zinc/05/61/31/588056131.db2.gz OUPYENZXQRGEIS-UHFFFAOYSA-N 1 2 234.299 2.044 20 0 BEADLO CC[NH2+]Cc1noc(/C=C2/CC[C@H](C)C2)n1 ZINC000843144621 588086031 /nfs/dbraw/zinc/08/60/31/588086031.db2.gz DYYQESGHONYASU-CBFJXKFUSA-N 1 2 221.304 2.383 20 0 BEADLO CC[NH2+]Cc1noc(/C=C/c2cncc(C)c2)n1 ZINC000843144433 588086095 /nfs/dbraw/zinc/08/60/95/588086095.db2.gz BZCSQHCYUDEUPM-SNAWJCMRSA-N 1 2 244.298 2.053 20 0 BEADLO CC[NH2+]Cc1noc(/C=C2\CC[C@H](C)C2)n1 ZINC000843144622 588086311 /nfs/dbraw/zinc/08/63/11/588086311.db2.gz DYYQESGHONYASU-HZAKCSEPSA-N 1 2 221.304 2.383 20 0 BEADLO CC[NH2+]Cc1noc([C@H](F)Cc2ccccc2)n1 ZINC000843145193 588086468 /nfs/dbraw/zinc/08/64/68/588086468.db2.gz WAFLSEQRHZURBN-LLVKDONJSA-N 1 2 249.289 2.432 20 0 BEADLO CC[NH2+]Cc1noc([C@@H](F)Cc2ccccc2)n1 ZINC000843145194 588086615 /nfs/dbraw/zinc/08/66/15/588086615.db2.gz WAFLSEQRHZURBN-NSHDSACASA-N 1 2 249.289 2.432 20 0 BEADLO C[C@@H](CCO)[N@H+](C)C/C(Cl)=C\Cl ZINC000844453054 588190581 /nfs/dbraw/zinc/19/05/81/588190581.db2.gz YTNBNUPZEVOSMY-QAZRXNLGSA-N 1 2 212.120 2.008 20 0 BEADLO C[C@@H](CCO)[N@@H+](C)C/C(Cl)=C\Cl ZINC000844453054 588190583 /nfs/dbraw/zinc/19/05/83/588190583.db2.gz YTNBNUPZEVOSMY-QAZRXNLGSA-N 1 2 212.120 2.008 20 0 BEADLO CCON(C(=O)c1ccc2[nH+]ccn2c1)C(C)C ZINC000844078280 588161455 /nfs/dbraw/zinc/16/14/55/588161455.db2.gz YCNJAFFVJWBBCP-UHFFFAOYSA-N 1 2 247.298 2.136 20 0 BEADLO CC(C)OCC(N)=[NH+]OCC=C(Cl)Cl ZINC000844235104 588176338 /nfs/dbraw/zinc/17/63/38/588176338.db2.gz AOKPTRYOQWGAIB-UHFFFAOYSA-N 1 2 241.118 2.229 20 0 BEADLO C[C@]1(F)CCC[N@H+](Cc2cc3n(n2)CCC3)C1 ZINC000844333338 588186031 /nfs/dbraw/zinc/18/60/31/588186031.db2.gz HQUABDPLQWAMGY-ZDUSSCGKSA-N 1 2 237.322 2.153 20 0 BEADLO C[C@]1(F)CCC[N@@H+](Cc2cc3n(n2)CCC3)C1 ZINC000844333338 588186032 /nfs/dbraw/zinc/18/60/32/588186032.db2.gz HQUABDPLQWAMGY-ZDUSSCGKSA-N 1 2 237.322 2.153 20 0 BEADLO C[C@H](CC(=O)NCCC1CCC1)n1cc[nH+]c1 ZINC000844423726 588191605 /nfs/dbraw/zinc/19/16/05/588191605.db2.gz WRCIAUSZBARMQY-LLVKDONJSA-N 1 2 235.331 2.141 20 0 BEADLO FC1(F)C[C@]12CCC[N@H+](Cc1ncccn1)C2 ZINC000844438809 588193788 /nfs/dbraw/zinc/19/37/88/588193788.db2.gz FNFYJZOVMKGMKO-NSHDSACASA-N 1 2 239.269 2.098 20 0 BEADLO FC1(F)C[C@]12CCC[N@@H+](Cc1ncccn1)C2 ZINC000844438809 588193789 /nfs/dbraw/zinc/19/37/89/588193789.db2.gz FNFYJZOVMKGMKO-NSHDSACASA-N 1 2 239.269 2.098 20 0 BEADLO CC(C)c1cnc(C[N@@H+]2C[C@H]3[C@@H](C2)C3(F)F)o1 ZINC000844450019 588194971 /nfs/dbraw/zinc/19/49/71/588194971.db2.gz JWMKURGMIKZAFW-DTORHVGOSA-N 1 2 242.269 2.495 20 0 BEADLO CC(C)c1cnc(C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)o1 ZINC000844450019 588194972 /nfs/dbraw/zinc/19/49/72/588194972.db2.gz JWMKURGMIKZAFW-DTORHVGOSA-N 1 2 242.269 2.495 20 0 BEADLO FC1(F)C[C@@]12CC[N@H+](Cn1cc(Cl)cn1)C2 ZINC000844756265 588216205 /nfs/dbraw/zinc/21/62/05/588216205.db2.gz JJMBONXRSRHHGB-SECBINFHSA-N 1 2 247.676 2.225 20 0 BEADLO FC1(F)C[C@@]12CC[N@@H+](Cn1cc(Cl)cn1)C2 ZINC000844756265 588216206 /nfs/dbraw/zinc/21/62/06/588216206.db2.gz JJMBONXRSRHHGB-SECBINFHSA-N 1 2 247.676 2.225 20 0 BEADLO COC/C(C)=C/C(=O)OCc1ccc(C)[nH+]c1C ZINC000845242235 588224660 /nfs/dbraw/zinc/22/46/60/588224660.db2.gz HYYJWEGIBYNFEF-JXMROGBWSA-N 1 2 249.310 2.334 20 0 BEADLO CCSCCOC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000845280334 588225340 /nfs/dbraw/zinc/22/53/40/588225340.db2.gz AJJCJWRNZBTKLA-SNVBAGLBSA-N 1 2 242.344 2.131 20 0 BEADLO CC[C@@H](C)COC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000845281465 588225370 /nfs/dbraw/zinc/22/53/70/588225370.db2.gz HXIKEPQHGLXVGZ-GHMZBOCLSA-N 1 2 224.304 2.424 20 0 BEADLO C[C@H](CC(=O)OCCCCF)n1cc[nH+]c1 ZINC000845286164 588225930 /nfs/dbraw/zinc/22/59/30/588225930.db2.gz WBNVJTOQLJTATN-SNVBAGLBSA-N 1 2 228.267 2.127 20 0 BEADLO C[C@@H](CC(=O)OC1(C2CC2)CC1)n1cc[nH+]c1 ZINC000845477111 588229913 /nfs/dbraw/zinc/22/99/13/588229913.db2.gz LFRBYRJYRIBALI-JTQLQIEISA-N 1 2 234.299 2.320 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@@H]1C[C@H]1C1CCCC1 ZINC000845479530 588230071 /nfs/dbraw/zinc/23/00/71/588230071.db2.gz POBVPBOEIQSIEY-QWHCGFSZSA-N 1 2 248.326 2.290 20 0 BEADLO C[C@H](CC(=O)O[C@@H]1C=CCC1)n1cc[nH+]c1 ZINC000845508463 588231279 /nfs/dbraw/zinc/23/12/79/588231279.db2.gz HIOKWFMDQRFIBK-GHMZBOCLSA-N 1 2 220.272 2.096 20 0 BEADLO C[C@H](COC(=O)C[C@H](C)n1cc[nH+]c1)C1CC1 ZINC000845546607 588232829 /nfs/dbraw/zinc/23/28/29/588232829.db2.gz WMONMDLUADYNQE-MNOVXSKESA-N 1 2 236.315 2.424 20 0 BEADLO C[C@@H](COC(=O)C[C@@H](C)n1cc[nH+]c1)C1CC1 ZINC000845546609 588232999 /nfs/dbraw/zinc/23/29/99/588232999.db2.gz WMONMDLUADYNQE-WDEREUQCSA-N 1 2 236.315 2.424 20 0 BEADLO Cc1nc(N2CCC[C@]3(CC3(F)F)C2)cc[nH+]1 ZINC000845743862 588243483 /nfs/dbraw/zinc/24/34/83/588243483.db2.gz YSJSYLYNAAHERX-NSHDSACASA-N 1 2 239.269 2.411 20 0 BEADLO C[C@H](Cn1cccn1)Nc1ccc([NH+](C)C)cc1 ZINC000121587931 588246781 /nfs/dbraw/zinc/24/67/81/588246781.db2.gz GEZOBIMAMJYEQP-GFCCVEGCSA-N 1 2 244.342 2.450 20 0 BEADLO Cc1nonc1C[NH2+]Cc1cccc2c1CCC2 ZINC000845969860 588252017 /nfs/dbraw/zinc/25/20/17/588252017.db2.gz HYELSYUHHYNFOW-UHFFFAOYSA-N 1 2 243.310 2.157 20 0 BEADLO FC1(F)CCC[N@H+](C[C@@H]2CCC=CO2)C1 ZINC000846012825 588253401 /nfs/dbraw/zinc/25/34/01/588253401.db2.gz DYLAOJMBTWZGGO-JTQLQIEISA-N 1 2 217.259 2.410 20 0 BEADLO FC1(F)CCC[N@@H+](C[C@@H]2CCC=CO2)C1 ZINC000846012825 588253402 /nfs/dbraw/zinc/25/34/02/588253402.db2.gz DYLAOJMBTWZGGO-JTQLQIEISA-N 1 2 217.259 2.410 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccc(F)nc2)[C@@H](C)CO1 ZINC000846043583 588254703 /nfs/dbraw/zinc/25/47/03/588254703.db2.gz LQZSBUKPTCYTTQ-CMPLNLGQSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccc(F)nc2)[C@@H](C)CO1 ZINC000846043583 588254704 /nfs/dbraw/zinc/25/47/04/588254704.db2.gz LQZSBUKPTCYTTQ-CMPLNLGQSA-N 1 2 238.306 2.220 20 0 BEADLO Cc1nc(F)ccc1C[N@@H+]1CCC[C@H](F)C1 ZINC000846119957 588258261 /nfs/dbraw/zinc/25/82/61/588258261.db2.gz LIFVGNCMRXRHLS-NSHDSACASA-N 1 2 226.270 2.463 20 0 BEADLO Cc1nc(F)ccc1C[N@H+]1CCC[C@H](F)C1 ZINC000846119957 588258262 /nfs/dbraw/zinc/25/82/62/588258262.db2.gz LIFVGNCMRXRHLS-NSHDSACASA-N 1 2 226.270 2.463 20 0 BEADLO CCC/C=C/C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000846245256 588262408 /nfs/dbraw/zinc/26/24/08/588262408.db2.gz ZLZQEMXZJNKFEQ-VOTSOKGWSA-N 1 2 221.304 2.117 20 0 BEADLO CCON(C(=O)C[C@@H](C)n1cc[nH+]c1)C(C)C ZINC000846276979 588263639 /nfs/dbraw/zinc/26/36/39/588263639.db2.gz CDVPPZKPMXJPTJ-LLVKDONJSA-N 1 2 239.319 2.023 20 0 BEADLO Cc1ccc(NCc2cnc(Cl)n2C)c[nH+]1 ZINC000846773033 588286244 /nfs/dbraw/zinc/28/62/44/588286244.db2.gz CZQFROUBZXYWEU-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO C[N@H+](Cc1cnsn1)C1Cc2ccccc2C1 ZINC000846782341 588287886 /nfs/dbraw/zinc/28/78/86/588287886.db2.gz GPRPUWAOIUDSIV-UHFFFAOYSA-N 1 2 245.351 2.137 20 0 BEADLO C[N@@H+](Cc1cnsn1)C1Cc2ccccc2C1 ZINC000846782341 588287887 /nfs/dbraw/zinc/28/78/87/588287887.db2.gz GPRPUWAOIUDSIV-UHFFFAOYSA-N 1 2 245.351 2.137 20 0 BEADLO CC1(C)CC[NH+](Cc2cnsn2)CC1 ZINC000846794990 588288762 /nfs/dbraw/zinc/28/87/62/588288762.db2.gz DWCGYLPSULALOU-UHFFFAOYSA-N 1 2 211.334 2.160 20 0 BEADLO C[C@@H]1CCCCC[N@@H+]1Cc1cnsn1 ZINC000846807863 588290100 /nfs/dbraw/zinc/29/01/00/588290100.db2.gz IRCBYSQGSSABPZ-SECBINFHSA-N 1 2 211.334 2.303 20 0 BEADLO C[C@@H]1CCCCC[N@H+]1Cc1cnsn1 ZINC000846807863 588290101 /nfs/dbraw/zinc/29/01/01/588290101.db2.gz IRCBYSQGSSABPZ-SECBINFHSA-N 1 2 211.334 2.303 20 0 BEADLO CC[C@@]1(C)CC[N@H+](Cc2cnsn2)C1 ZINC000846814885 588290898 /nfs/dbraw/zinc/29/08/98/588290898.db2.gz HAWNVLGZLNWBJB-JTQLQIEISA-N 1 2 211.334 2.160 20 0 BEADLO CC[C@@]1(C)CC[N@@H+](Cc2cnsn2)C1 ZINC000846814885 588290899 /nfs/dbraw/zinc/29/08/99/588290899.db2.gz HAWNVLGZLNWBJB-JTQLQIEISA-N 1 2 211.334 2.160 20 0 BEADLO CC[C@@H](CSC)[N@H+](C)Cc1cnsn1 ZINC000846839130 588292406 /nfs/dbraw/zinc/29/24/06/588292406.db2.gz DBHKKCAAZRYBIT-VIFPVBQESA-N 1 2 231.390 2.112 20 0 BEADLO CC[C@@H](CSC)[N@@H+](C)Cc1cnsn1 ZINC000846839130 588292407 /nfs/dbraw/zinc/29/24/07/588292407.db2.gz DBHKKCAAZRYBIT-VIFPVBQESA-N 1 2 231.390 2.112 20 0 BEADLO CCc1cnccc1[C@@H](C)[NH2+]Cc1cnsn1 ZINC000846852327 588293506 /nfs/dbraw/zinc/29/35/06/588293506.db2.gz XRMGLBRNSQPBKB-SECBINFHSA-N 1 2 248.355 2.346 20 0 BEADLO CC1(C)CC[N@H+](Cc2cnsn2)CCS1 ZINC000846878479 588294689 /nfs/dbraw/zinc/29/46/89/588294689.db2.gz FNHUZZUIXKMTMC-UHFFFAOYSA-N 1 2 243.401 2.256 20 0 BEADLO CC1(C)CC[N@@H+](Cc2cnsn2)CCS1 ZINC000846878479 588294690 /nfs/dbraw/zinc/29/46/90/588294690.db2.gz FNHUZZUIXKMTMC-UHFFFAOYSA-N 1 2 243.401 2.256 20 0 BEADLO C[C@@H]1CCC[C@@H](CNC(=O)Cc2[nH]cc[nH+]2)[C@@H]1C ZINC000846986358 588300485 /nfs/dbraw/zinc/30/04/85/588300485.db2.gz JXBUYNDYDGNGPX-UTUOFQBUSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1CCCCCCC1 ZINC000847308212 588310711 /nfs/dbraw/zinc/31/07/11/588310711.db2.gz FRYULSJJALGLAL-LBPRGKRZSA-N 1 2 249.358 2.381 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1CCCCCCC1 ZINC000847308212 588310712 /nfs/dbraw/zinc/31/07/12/588310712.db2.gz FRYULSJJALGLAL-LBPRGKRZSA-N 1 2 249.358 2.381 20 0 BEADLO Cn1c(C[NH2+][C@H]2CCCC2(F)F)cnc1Cl ZINC000848553094 588394623 /nfs/dbraw/zinc/39/46/23/588394623.db2.gz QGKCMBAFKSJBKE-QMMMGPOBSA-N 1 2 249.692 2.351 20 0 BEADLO CCCn1cc(N[C@H]2CCCn3cc[nH+]c32)cn1 ZINC000848540492 588394762 /nfs/dbraw/zinc/39/47/62/588394762.db2.gz OKJBAQCEPLVBMK-LBPRGKRZSA-N 1 2 245.330 2.437 20 0 BEADLO CC[NH2+]Cc1noc(/C(C)=C\c2ccncc2)n1 ZINC000848618311 588402451 /nfs/dbraw/zinc/40/24/51/588402451.db2.gz RXQPGPQLLMPFFN-NTMALXAHSA-N 1 2 244.298 2.135 20 0 BEADLO Cn1c(C[N@@H+]2CCC2(C)C)cnc1Cl ZINC000848887464 588416957 /nfs/dbraw/zinc/41/69/57/588416957.db2.gz XBBHGDMPJOBRPI-UHFFFAOYSA-N 1 2 213.712 2.058 20 0 BEADLO Cn1c(C[N@H+]2CCC2(C)C)cnc1Cl ZINC000848887464 588416958 /nfs/dbraw/zinc/41/69/58/588416958.db2.gz XBBHGDMPJOBRPI-UHFFFAOYSA-N 1 2 213.712 2.058 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[NH2+][C@@H]1C=CCC1 ZINC000849322043 588472257 /nfs/dbraw/zinc/47/22/57/588472257.db2.gz GJYJFZMKQQAEKZ-NEPJUHHUSA-N 1 2 225.332 2.272 20 0 BEADLO CC(C)=CCCOC(=O)CCc1ccc(N)[nH+]c1 ZINC000849747625 588493084 /nfs/dbraw/zinc/49/30/84/588493084.db2.gz TYRYMXBYJAJCMH-UHFFFAOYSA-N 1 2 248.326 2.496 20 0 BEADLO CCc1cc(N)nc(S[C@H]2CCSC2)[nH+]1 ZINC000849894883 588508476 /nfs/dbraw/zinc/50/84/76/588508476.db2.gz IGGBVOBSJCZBTB-QMMMGPOBSA-N 1 2 241.385 2.219 20 0 BEADLO CCc1cc(N)nc(S[C@@H]2CCSC2)[nH+]1 ZINC000849894882 588508806 /nfs/dbraw/zinc/50/88/06/588508806.db2.gz IGGBVOBSJCZBTB-MRVPVSSYSA-N 1 2 241.385 2.219 20 0 BEADLO O=C(OCCn1cc[nH+]c1)C1CCC2(CC2)CC1 ZINC000850267255 588534269 /nfs/dbraw/zinc/53/42/69/588534269.db2.gz UEZRHDZRHAHORO-UHFFFAOYSA-N 1 2 248.326 2.397 20 0 BEADLO Cn1ncc(C2CCC2)c1C[NH2+]C(CF)CF ZINC000850312782 588536208 /nfs/dbraw/zinc/53/62/08/588536208.db2.gz CBMBIWNJUJLXHS-UHFFFAOYSA-N 1 2 243.301 2.085 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+][C@H]1COC2(CCC2)C1 ZINC000850523908 588556770 /nfs/dbraw/zinc/55/67/70/588556770.db2.gz DQHYVDAYSGHCGX-MWLCHTKSSA-N 1 2 235.331 2.080 20 0 BEADLO CCc1noc(C)c1[C@@H](C)[NH2+]Cc1ncccn1 ZINC000850552038 588559913 /nfs/dbraw/zinc/55/99/13/588559913.db2.gz JTYRQVAXMDQTKX-SECBINFHSA-N 1 2 246.314 2.186 20 0 BEADLO Cc1ccc(COC(=O)[C@H]2C[C@H](C)CO2)c(C)[nH+]1 ZINC000885577125 588562299 /nfs/dbraw/zinc/56/22/99/588562299.db2.gz UWZAGEDGTOFGOD-TVQRCGJNSA-N 1 2 249.310 2.167 20 0 BEADLO CCCC[C@](C)(F)C(=O)OCc1c[nH+]cn1C ZINC000850868264 588571979 /nfs/dbraw/zinc/57/19/79/588571979.db2.gz BKEVDDVHNHLHKY-LBPRGKRZSA-N 1 2 242.294 2.382 20 0 BEADLO CCC(=O)OCC1CCN(c2cccc[nH+]2)CC1 ZINC000851400675 588603818 /nfs/dbraw/zinc/60/38/18/588603818.db2.gz LVYQZQFDCBSWST-UHFFFAOYSA-N 1 2 248.326 2.251 20 0 BEADLO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1cnon1 ZINC000851710959 588615207 /nfs/dbraw/zinc/61/52/07/588615207.db2.gz SCPITQUMPOEYLF-SECBINFHSA-N 1 2 235.262 2.402 20 0 BEADLO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1cnon1 ZINC000851710959 588615208 /nfs/dbraw/zinc/61/52/08/588615208.db2.gz SCPITQUMPOEYLF-SECBINFHSA-N 1 2 235.262 2.402 20 0 BEADLO COc1ccc([C@H](C)[N@H+](C)Cc2cnon2)cc1 ZINC000851712809 588615833 /nfs/dbraw/zinc/61/58/33/588615833.db2.gz UKIDBTXIJILGKL-JTQLQIEISA-N 1 2 247.298 2.271 20 0 BEADLO COc1ccc([C@H](C)[N@@H+](C)Cc2cnon2)cc1 ZINC000851712809 588615834 /nfs/dbraw/zinc/61/58/34/588615834.db2.gz UKIDBTXIJILGKL-JTQLQIEISA-N 1 2 247.298 2.271 20 0 BEADLO CC[N@@H+](Cc1cnon1)Cc1cccs1 ZINC000851713198 588615970 /nfs/dbraw/zinc/61/59/70/588615970.db2.gz BZPMWMRMQQXDON-UHFFFAOYSA-N 1 2 223.301 2.153 20 0 BEADLO CC[N@H+](Cc1cnon1)Cc1cccs1 ZINC000851713198 588615971 /nfs/dbraw/zinc/61/59/71/588615971.db2.gz BZPMWMRMQQXDON-UHFFFAOYSA-N 1 2 223.301 2.153 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1cccc(F)n1 ZINC000851729243 588618808 /nfs/dbraw/zinc/61/88/08/588618808.db2.gz IXIITCKJMJUTOD-CMPLNLGQSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1cccc(F)n1 ZINC000851729243 588618809 /nfs/dbraw/zinc/61/88/09/588618809.db2.gz IXIITCKJMJUTOD-CMPLNLGQSA-N 1 2 238.306 2.220 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2cnon2)c1 ZINC000851732025 588619457 /nfs/dbraw/zinc/61/94/57/588619457.db2.gz HIDMPWKFLJGDBV-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2cnon2)c1 ZINC000851732025 588619458 /nfs/dbraw/zinc/61/94/58/588619458.db2.gz HIDMPWKFLJGDBV-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnon2)[C@H]1c1ccccc1 ZINC000851799405 588630198 /nfs/dbraw/zinc/63/01/98/588630198.db2.gz AEHUBPCMJQDVNO-ZWNOBZJWSA-N 1 2 229.283 2.263 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnon2)[C@H]1c1ccccc1 ZINC000851799405 588630199 /nfs/dbraw/zinc/63/01/99/588630199.db2.gz AEHUBPCMJQDVNO-ZWNOBZJWSA-N 1 2 229.283 2.263 20 0 BEADLO C[C@@H](NC(=O)OC(C)(C)C)c1[nH+]ccn1C ZINC000851856078 588635478 /nfs/dbraw/zinc/63/54/78/588635478.db2.gz GUCSXCIARNUJIQ-MRVPVSSYSA-N 1 2 225.292 2.006 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C[C@H]1CC1(Cl)Cl ZINC000851875988 588637928 /nfs/dbraw/zinc/63/79/28/588637928.db2.gz SFNSUGDXFMMPEV-SSDOTTSWSA-N 1 2 234.130 2.035 20 0 BEADLO CC[C@@]1(C)COCC[N@@H+]1Cc1cccc(F)n1 ZINC000851879288 588638867 /nfs/dbraw/zinc/63/88/67/588638867.db2.gz YZZXWEWZFCFJBQ-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO CC[C@@]1(C)COCC[N@H+]1Cc1cccc(F)n1 ZINC000851879288 588638868 /nfs/dbraw/zinc/63/88/68/588638868.db2.gz YZZXWEWZFCFJBQ-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO CC1(C)c2ccccc2CC[N@H+]1Cc1cnon1 ZINC000851891753 588641440 /nfs/dbraw/zinc/64/14/40/588641440.db2.gz BDYUZHSDJRROKS-UHFFFAOYSA-N 1 2 243.310 2.363 20 0 BEADLO CC1(C)c2ccccc2CC[N@@H+]1Cc1cnon1 ZINC000851891753 588641441 /nfs/dbraw/zinc/64/14/41/588641441.db2.gz BDYUZHSDJRROKS-UHFFFAOYSA-N 1 2 243.310 2.363 20 0 BEADLO Cc1cc(NC[C@@H](O)c2cccc(F)c2)nc[nH+]1 ZINC000110306308 588645420 /nfs/dbraw/zinc/64/54/20/588645420.db2.gz NPTBRIHPPCJTFJ-GFCCVEGCSA-N 1 2 247.273 2.070 20 0 BEADLO Fc1cccc(C[N@@H+]2CCC[C@@H]2c2cc[nH]n2)n1 ZINC000851995687 588653454 /nfs/dbraw/zinc/65/34/54/588653454.db2.gz WAEVMLHDCDAADR-GFCCVEGCSA-N 1 2 246.289 2.281 20 0 BEADLO Fc1cccc(C[N@H+]2CCC[C@@H]2c2cc[nH]n2)n1 ZINC000851995687 588653455 /nfs/dbraw/zinc/65/34/55/588653455.db2.gz WAEVMLHDCDAADR-GFCCVEGCSA-N 1 2 246.289 2.281 20 0 BEADLO c1nonc1C[N@@H+]1CCC=C(c2ccccc2)C1 ZINC000852023617 588656491 /nfs/dbraw/zinc/65/64/91/588656491.db2.gz VNZJASIBWQPZPG-UHFFFAOYSA-N 1 2 241.294 2.359 20 0 BEADLO c1nonc1C[N@H+]1CCC=C(c2ccccc2)C1 ZINC000852023617 588656492 /nfs/dbraw/zinc/65/64/92/588656492.db2.gz VNZJASIBWQPZPG-UHFFFAOYSA-N 1 2 241.294 2.359 20 0 BEADLO COc1cc(C[N@@H+]2CCC[C@@](C)(F)C2)sn1 ZINC000852096093 588661864 /nfs/dbraw/zinc/66/18/64/588661864.db2.gz IDAABLBNPRLBDF-LLVKDONJSA-N 1 2 244.335 2.476 20 0 BEADLO COc1cc(C[N@H+]2CCC[C@@](C)(F)C2)sn1 ZINC000852096093 588661865 /nfs/dbraw/zinc/66/18/65/588661865.db2.gz IDAABLBNPRLBDF-LLVKDONJSA-N 1 2 244.335 2.476 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1cccc(F)n1 ZINC000852094718 588661997 /nfs/dbraw/zinc/66/19/97/588661997.db2.gz CXJOBEAPHHUDCB-UHFFFAOYSA-N 1 2 249.289 2.403 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1cccc(F)n1 ZINC000852094718 588661998 /nfs/dbraw/zinc/66/19/98/588661998.db2.gz CXJOBEAPHHUDCB-UHFFFAOYSA-N 1 2 249.289 2.403 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)Cc1cccnc1Cl ZINC000852284653 588676036 /nfs/dbraw/zinc/67/60/36/588676036.db2.gz QGQFYYHZCRSJNS-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)Cc1cccnc1Cl ZINC000852284653 588676037 /nfs/dbraw/zinc/67/60/37/588676037.db2.gz QGQFYYHZCRSJNS-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO Cc1nonc1C[N@@H+]1CCc2ccc(C)cc2C1 ZINC000852404578 588681115 /nfs/dbraw/zinc/68/11/15/588681115.db2.gz QRQNPIWIYIYFHZ-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1nonc1C[N@H+]1CCc2ccc(C)cc2C1 ZINC000852404578 588681116 /nfs/dbraw/zinc/68/11/16/588681116.db2.gz QRQNPIWIYIYFHZ-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO COCC[N@H+](CCF)[C@@H](C)c1ccncc1 ZINC000852484028 588684970 /nfs/dbraw/zinc/68/49/70/588684970.db2.gz WADQSSWTHILPTP-NSHDSACASA-N 1 2 226.295 2.061 20 0 BEADLO COCC[N@@H+](CCF)[C@@H](C)c1ccncc1 ZINC000852484028 588684971 /nfs/dbraw/zinc/68/49/71/588684971.db2.gz WADQSSWTHILPTP-NSHDSACASA-N 1 2 226.295 2.061 20 0 BEADLO COCC[N@H+](CCF)[C@H](C)c1ccncc1 ZINC000852484027 588685194 /nfs/dbraw/zinc/68/51/94/588685194.db2.gz WADQSSWTHILPTP-LLVKDONJSA-N 1 2 226.295 2.061 20 0 BEADLO COCC[N@@H+](CCF)[C@H](C)c1ccncc1 ZINC000852484027 588685195 /nfs/dbraw/zinc/68/51/95/588685195.db2.gz WADQSSWTHILPTP-LLVKDONJSA-N 1 2 226.295 2.061 20 0 BEADLO FCC[C@@H]1CCC[N@H+](Cc2cnsn2)C1 ZINC000852531543 588688303 /nfs/dbraw/zinc/68/83/03/588688303.db2.gz QCQXRRPOKVCYRU-VIFPVBQESA-N 1 2 229.324 2.110 20 0 BEADLO FCC[C@@H]1CCC[N@@H+](Cc2cnsn2)C1 ZINC000852531543 588688304 /nfs/dbraw/zinc/68/83/04/588688304.db2.gz QCQXRRPOKVCYRU-VIFPVBQESA-N 1 2 229.324 2.110 20 0 BEADLO CC(C)(C)c1nnc(C[N@@H+]2CC[C@@H]3C[C@@H]3C2)o1 ZINC000852634097 588693317 /nfs/dbraw/zinc/69/33/17/588693317.db2.gz FYGYNDYBKFHYED-NXEZZACHSA-N 1 2 235.331 2.209 20 0 BEADLO CC(C)(C)c1nnc(C[N@H+]2CC[C@@H]3C[C@@H]3C2)o1 ZINC000852634097 588693318 /nfs/dbraw/zinc/69/33/18/588693318.db2.gz FYGYNDYBKFHYED-NXEZZACHSA-N 1 2 235.331 2.209 20 0 BEADLO Cl/C=C(\Cl)C[N@@H+]1CCC2(COC2)C1 ZINC000852683376 588695265 /nfs/dbraw/zinc/69/52/65/588695265.db2.gz JKXVFQKXNFBJFV-BAQGIRSFSA-N 1 2 222.115 2.028 20 0 BEADLO Cl/C=C(\Cl)C[N@H+]1CCC2(COC2)C1 ZINC000852683376 588695266 /nfs/dbraw/zinc/69/52/66/588695266.db2.gz JKXVFQKXNFBJFV-BAQGIRSFSA-N 1 2 222.115 2.028 20 0 BEADLO CC/C(C)=C(\C)C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000861761347 589176881 /nfs/dbraw/zinc/17/68/81/589176881.db2.gz DDCWPINVLUBENO-MDZDMXLPSA-N 1 2 233.315 2.041 20 0 BEADLO CC/C(C)=C(\C)C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000861761347 589176882 /nfs/dbraw/zinc/17/68/82/589176882.db2.gz DDCWPINVLUBENO-MDZDMXLPSA-N 1 2 233.315 2.041 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccnc(F)c2C)CCO1 ZINC000862216558 589194408 /nfs/dbraw/zinc/19/44/08/589194408.db2.gz ZOYRFRLSHZVWFP-GFCCVEGCSA-N 1 2 238.306 2.140 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccnc(F)c2C)CCO1 ZINC000862216558 589194410 /nfs/dbraw/zinc/19/44/10/589194410.db2.gz ZOYRFRLSHZVWFP-GFCCVEGCSA-N 1 2 238.306 2.140 20 0 BEADLO Cc1c(C[N@H+]2C[C@H](C)OC[C@@H]2C)ccnc1F ZINC000862223538 589195919 /nfs/dbraw/zinc/19/59/19/589195919.db2.gz QPSJPFAOIMGEAC-UWVGGRQHSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1c(C[N@@H+]2C[C@H](C)OC[C@@H]2C)ccnc1F ZINC000862223538 589195920 /nfs/dbraw/zinc/19/59/20/589195920.db2.gz QPSJPFAOIMGEAC-UWVGGRQHSA-N 1 2 238.306 2.138 20 0 BEADLO Clc1cnccc1C[NH+]1CC2(CC2)C1 ZINC000862382533 589206793 /nfs/dbraw/zinc/20/67/93/589206793.db2.gz VCELUUHOLYUXAE-UHFFFAOYSA-N 1 2 208.692 2.331 20 0 BEADLO Cc1c(C[NH+]2CC(C(F)F)C2)ccnc1F ZINC000862390617 589207845 /nfs/dbraw/zinc/20/78/45/589207845.db2.gz YUTBASXBCOSGOW-UHFFFAOYSA-N 1 2 230.233 2.226 20 0 BEADLO CC1(C)CCC(C)(NC(=O)Cc2[nH]cc[nH+]2)CC1 ZINC000862968084 589249613 /nfs/dbraw/zinc/24/96/13/589249613.db2.gz GTAAPAQXBYDSJN-UHFFFAOYSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@H]1C[C@H]1CO[NH+]=C(N)Cc1ccccc1 ZINC000863453668 589288993 /nfs/dbraw/zinc/28/89/93/589288993.db2.gz LUHNGJHKHJFDEI-JQWIXIFHSA-N 1 2 218.300 2.384 20 0 BEADLO CC(C)CO[C@H](C)C(N)=[NH+]OC[C@H]1C[C@H]1C ZINC000863456945 589289509 /nfs/dbraw/zinc/28/95/09/589289509.db2.gz ABDFPKQWRYVFSP-GMTAPVOTSA-N 1 2 228.336 2.202 20 0 BEADLO COC1(C(N)=[NH+]OC[C@@H]2C[C@@H]2C)CCCC1 ZINC000863477520 589291939 /nfs/dbraw/zinc/29/19/39/589291939.db2.gz NSHLVYVJWTUQFY-UWVGGRQHSA-N 1 2 226.320 2.100 20 0 BEADLO C/C=C\C[C@@H]1CCCN(C(=O)Cc2[nH]cc[nH+]2)C1 ZINC000863817302 589321480 /nfs/dbraw/zinc/32/14/80/589321480.db2.gz JVPVBNJORAVJOG-ZZKXABKFSA-N 1 2 247.342 2.157 20 0 BEADLO OC1(c2ccc(-c3c[nH]c[nH+]3)cc2)CCC1 ZINC000863978023 589331778 /nfs/dbraw/zinc/33/17/78/589331778.db2.gz YVTLNUSNAKHRQU-UHFFFAOYSA-N 1 2 214.268 2.448 20 0 BEADLO Cc1ncc(C[N@H+]2CC3(CCC3)OC[C@@H]2C)o1 ZINC000864051961 589335157 /nfs/dbraw/zinc/33/51/57/589335157.db2.gz WXOWXVPNKNHHMQ-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO Cc1ncc(C[N@@H+]2CC3(CCC3)OC[C@@H]2C)o1 ZINC000864051961 589335159 /nfs/dbraw/zinc/33/51/59/589335159.db2.gz WXOWXVPNKNHHMQ-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO C[C@H](NC(=O)Cc1c[nH]c[nH+]1)[C@]12C[C@H]1CCCC2 ZINC000864081111 589341435 /nfs/dbraw/zinc/34/14/35/589341435.db2.gz RONOLNZSUCAQHF-WDMOLILDSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H](NC(=O)Cc1c[nH+]c[nH]1)[C@]12C[C@H]1CCCC2 ZINC000864081111 589341436 /nfs/dbraw/zinc/34/14/36/589341436.db2.gz RONOLNZSUCAQHF-WDMOLILDSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H](O)c1cccc(N[C@H]2C[C@@H](C)O[C@@H]2C)[nH+]1 ZINC000864088906 589342908 /nfs/dbraw/zinc/34/29/08/589342908.db2.gz IMDKZBLCDPPWPH-KLBPJQLPSA-N 1 2 236.315 2.113 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1C[C@H](SC)C1 ZINC000864092374 589343733 /nfs/dbraw/zinc/34/37/33/589343733.db2.gz ZXRKPDKMZUJLLA-KYZUINATSA-N 1 2 224.329 2.396 20 0 BEADLO C(=C\c1cnccn1)\c1cn(C2CC2)c[nH+]1 ZINC000865217973 589414884 /nfs/dbraw/zinc/41/48/84/589414884.db2.gz LGLYDKVYSZKPDR-UPHRSURJSA-N 1 2 212.256 2.178 20 0 BEADLO CC(C)(C)c1cn(Cc2cnsn2)c[nH+]1 ZINC000865376342 589428338 /nfs/dbraw/zinc/42/83/38/589428338.db2.gz JXEQWAHNSYLQJR-UHFFFAOYSA-N 1 2 222.317 2.080 20 0 BEADLO CC(C)(C)c1cn(CCOCC(F)F)c[nH+]1 ZINC000865376366 589428376 /nfs/dbraw/zinc/42/83/76/589428376.db2.gz KUTJEVQZSHDRNA-UHFFFAOYSA-N 1 2 232.274 2.462 20 0 BEADLO Cc1cnc(Cn2c[nH+]c(C(C)(C)C)c2)nc1 ZINC000865376303 589428420 /nfs/dbraw/zinc/42/84/20/589428420.db2.gz IHJLNKLEOOSOKO-UHFFFAOYSA-N 1 2 230.315 2.327 20 0 BEADLO CCn1nnc(C)c1Cn1c[nH+]c(C(C)(C)C)c1 ZINC000865376655 589428952 /nfs/dbraw/zinc/42/89/52/589428952.db2.gz XPQQTQFLONCZPW-UHFFFAOYSA-N 1 2 247.346 2.149 20 0 BEADLO CCCCN(C)c1nc(N)[nH+]c(C2CCCC2)n1 ZINC000865397457 589432038 /nfs/dbraw/zinc/43/20/38/589432038.db2.gz HMPGEVZKGCBNRK-UHFFFAOYSA-N 1 2 249.362 2.348 20 0 BEADLO CCCCN(C)c1nc(N)nc(C2CCCC2)[nH+]1 ZINC000865397457 589432040 /nfs/dbraw/zinc/43/20/40/589432040.db2.gz HMPGEVZKGCBNRK-UHFFFAOYSA-N 1 2 249.362 2.348 20 0 BEADLO Cc1cc(C(F)(F)F)c[nH+]c1NCCCO ZINC000865398457 589432455 /nfs/dbraw/zinc/43/24/55/589432455.db2.gz XMWORPZTBSOLJD-UHFFFAOYSA-N 1 2 234.221 2.203 20 0 BEADLO Cc1noc(C)c1C[NH2+]Cc1cn(C2CC2)cn1 ZINC000865430039 589435491 /nfs/dbraw/zinc/43/54/91/589435491.db2.gz ALKLGOAJCRBCKU-UHFFFAOYSA-N 1 2 246.314 2.113 20 0 BEADLO Cc1cc(C(F)(F)F)c[nH+]c1N[C@@H](C)CO ZINC000865430394 589435586 /nfs/dbraw/zinc/43/55/86/589435586.db2.gz URCOXPIJGXWSGX-ZETCQYMHSA-N 1 2 234.221 2.202 20 0 BEADLO C[C@@H]1C[C@H]1CNc1nc(N)[nH+]c(C2CCCC2)n1 ZINC000865443037 589435904 /nfs/dbraw/zinc/43/59/04/589435904.db2.gz WKSTXEDNYMYLHC-SCZZXKLOSA-N 1 2 247.346 2.179 20 0 BEADLO C[C@@H]1C[C@H]1CNc1nc(N)nc(C2CCCC2)[nH+]1 ZINC000865443037 589435905 /nfs/dbraw/zinc/43/59/05/589435905.db2.gz WKSTXEDNYMYLHC-SCZZXKLOSA-N 1 2 247.346 2.179 20 0 BEADLO CN(CC(F)F)c1[nH+]cnc2[nH]c(Cl)cc21 ZINC000865507825 589442151 /nfs/dbraw/zinc/44/21/51/589442151.db2.gz ASOZRBXBTWESDA-UHFFFAOYSA-N 1 2 246.648 2.264 20 0 BEADLO CN(c1nc(N)[nH+]c(C2CCCC2)n1)C1CCC1 ZINC000865562509 589447039 /nfs/dbraw/zinc/44/70/39/589447039.db2.gz GGBPLIZNNWWIHJ-UHFFFAOYSA-N 1 2 247.346 2.100 20 0 BEADLO CN(c1nc(N)nc(C2CCCC2)[nH+]1)C1CCC1 ZINC000865562509 589447041 /nfs/dbraw/zinc/44/70/41/589447041.db2.gz GGBPLIZNNWWIHJ-UHFFFAOYSA-N 1 2 247.346 2.100 20 0 BEADLO FC1(F)CCC[C@H]1NCc1cn(C2CC2)c[nH+]1 ZINC000865569452 589447317 /nfs/dbraw/zinc/44/73/17/589447317.db2.gz PQEGMROXLNCNSP-LLVKDONJSA-N 1 2 241.285 2.495 20 0 BEADLO CCCCc1cc(N[C@](C)(CO)C2CC2)nc[nH+]1 ZINC000865614274 589451332 /nfs/dbraw/zinc/45/13/32/589451332.db2.gz BYVPIMRWFCTELX-CQSZACIVSA-N 1 2 249.358 2.392 20 0 BEADLO CCCNc1cc(N2CCC=C(F)C2)nc[nH+]1 ZINC000865663813 589455087 /nfs/dbraw/zinc/45/50/87/589455087.db2.gz ZVLRQERWEUFNAW-UHFFFAOYSA-N 1 2 236.294 2.362 20 0 BEADLO CCCNc1cc(N2CCC=C(F)C2)[nH+]cn1 ZINC000865663813 589455088 /nfs/dbraw/zinc/45/50/88/589455088.db2.gz ZVLRQERWEUFNAW-UHFFFAOYSA-N 1 2 236.294 2.362 20 0 BEADLO CCON(C)c1cc[nH+]cc1C(F)(F)F ZINC000865710160 589457697 /nfs/dbraw/zinc/45/76/97/589457697.db2.gz KECDJVQBUJCHHL-UHFFFAOYSA-N 1 2 220.194 2.488 20 0 BEADLO CCCNc1cc(NC[C@H]2CCC=CO2)nc[nH+]1 ZINC000865708842 589457764 /nfs/dbraw/zinc/45/77/64/589457764.db2.gz BZZUIJYLQZUYFT-LLVKDONJSA-N 1 2 248.330 2.403 20 0 BEADLO CCCNc1cc(NC[C@H]2CCC=CO2)[nH+]cn1 ZINC000865708842 589457765 /nfs/dbraw/zinc/45/77/65/589457765.db2.gz BZZUIJYLQZUYFT-LLVKDONJSA-N 1 2 248.330 2.403 20 0 BEADLO CCCNc1cc(N[C@@H](C)[C@H](C)OC)nc[nH+]1 ZINC000865717415 589458211 /nfs/dbraw/zinc/45/82/11/589458211.db2.gz YEQNLVQJGZULQY-UWVGGRQHSA-N 1 2 238.335 2.134 20 0 BEADLO CCCNc1cc(N[C@@H](C)[C@H](C)OC)[nH+]cn1 ZINC000865717415 589458212 /nfs/dbraw/zinc/45/82/12/589458212.db2.gz YEQNLVQJGZULQY-UWVGGRQHSA-N 1 2 238.335 2.134 20 0 BEADLO CC(C)Cc1cc(NCC2=CCCOC2)nc[nH+]1 ZINC000865810202 589462823 /nfs/dbraw/zinc/46/28/23/589462823.db2.gz LIVGNQPIXXFEKQ-UHFFFAOYSA-N 1 2 247.342 2.434 20 0 BEADLO Cn1cc(C(F)F)c(C[NH2+]Cc2ccco2)n1 ZINC000865811137 589463036 /nfs/dbraw/zinc/46/30/36/589463036.db2.gz WTLZHJKKZLVCQA-UHFFFAOYSA-N 1 2 241.241 2.241 20 0 BEADLO C[C@H](O)c1ccc(N2CCC[C@@](C)(F)C2)[nH+]c1 ZINC000865840088 589464353 /nfs/dbraw/zinc/46/43/53/589464353.db2.gz DDRFJISBXBPBJQ-GXFFZTMASA-N 1 2 238.306 2.463 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C ZINC000865859525 589465579 /nfs/dbraw/zinc/46/55/79/589465579.db2.gz BLUBSLGCSXLUAO-OJAKKHQRSA-N 1 2 244.338 2.297 20 0 BEADLO CCC1CN(c2[nH+]cnc3[nH]c(Cl)cc32)C1 ZINC000865868001 589466072 /nfs/dbraw/zinc/46/60/72/589466072.db2.gz UMNAAMLTXFVYDU-UHFFFAOYSA-N 1 2 236.706 2.409 20 0 BEADLO C[C@@H](O)c1ccc(N[C@H](C)c2ccn(C)n2)[nH+]c1 ZINC000865872716 589466322 /nfs/dbraw/zinc/46/63/22/589466322.db2.gz STROQGWAZCSVSH-NXEZZACHSA-N 1 2 246.314 2.042 20 0 BEADLO Cc1cc(CNc2ccc(F)nn2)cc(C)[nH+]1 ZINC000865883043 589467317 /nfs/dbraw/zinc/46/73/17/589467317.db2.gz FUNJUWZHEVYXQO-UHFFFAOYSA-N 1 2 232.262 2.240 20 0 BEADLO COc1cccc2[nH+]c(NCC3(C)COC3)[nH]c21 ZINC000865890323 589467435 /nfs/dbraw/zinc/46/74/35/589467435.db2.gz IDOBXOWQXHBPGK-UHFFFAOYSA-N 1 2 247.298 2.020 20 0 BEADLO COc1cccc2[nH]c(NCC3(C)COC3)[nH+]c21 ZINC000865890323 589467436 /nfs/dbraw/zinc/46/74/36/589467436.db2.gz IDOBXOWQXHBPGK-UHFFFAOYSA-N 1 2 247.298 2.020 20 0 BEADLO Cc1n[nH]cc1CN(C)c1nc(C)[nH+]c(C)c1C ZINC000865900923 589467686 /nfs/dbraw/zinc/46/76/86/589467686.db2.gz IARARQSDGDNBLM-UHFFFAOYSA-N 1 2 245.330 2.070 20 0 BEADLO CCN(CCSC)c1ccc([C@@H](C)O)c[nH+]1 ZINC000865902816 589468020 /nfs/dbraw/zinc/46/80/20/589468020.db2.gz HYKKHIHHRYXPBF-SNVBAGLBSA-N 1 2 240.372 2.324 20 0 BEADLO Cc1cc(N2CCC=C(Cl)C2)nc[nH+]1 ZINC000865905766 589468034 /nfs/dbraw/zinc/46/80/34/589468034.db2.gz VRHSOPNXFVLYRM-UHFFFAOYSA-N 1 2 209.680 2.118 20 0 BEADLO CCO[C@H]1C[C@H](Nc2ccc([C@H](C)O)c[nH+]2)C1 ZINC000865937979 589469593 /nfs/dbraw/zinc/46/95/93/589469593.db2.gz HKEJPCOOJOJLNP-DLOVCJGASA-N 1 2 236.315 2.114 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1CCCC[C@@H]1F ZINC000866045619 589473969 /nfs/dbraw/zinc/47/39/69/589473969.db2.gz NPPANYIMYOHHIR-VHSXEESVSA-N 1 2 239.294 2.486 20 0 BEADLO Nc1ccc2c(c1)OCC[N@@H+](C/C=C\Cl)C2 ZINC000866688847 589512060 /nfs/dbraw/zinc/51/20/60/589512060.db2.gz AJCFEEDTTXFGQH-RJRFIUFISA-N 1 2 238.718 2.216 20 0 BEADLO Nc1ccc2c(c1)OCC[N@H+](C/C=C\Cl)C2 ZINC000866688847 589512061 /nfs/dbraw/zinc/51/20/61/589512061.db2.gz AJCFEEDTTXFGQH-RJRFIUFISA-N 1 2 238.718 2.216 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)OC1CCCCC1 ZINC000867494569 589522383 /nfs/dbraw/zinc/52/23/83/589522383.db2.gz DGJPTGCOEVFENR-UHFFFAOYSA-N 1 2 237.303 2.311 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)OC1CCCCC1 ZINC000867494569 589522384 /nfs/dbraw/zinc/52/23/84/589522384.db2.gz DGJPTGCOEVFENR-UHFFFAOYSA-N 1 2 237.303 2.311 20 0 BEADLO O=C(CCCn1cc[nH+]c1)N1CCCCCCC1 ZINC000121683363 589526459 /nfs/dbraw/zinc/52/64/59/589526459.db2.gz HSTANKFJCVDKHS-UHFFFAOYSA-N 1 2 249.358 2.456 20 0 BEADLO CC/C=C(/F)C(=O)N[C@@H](C)c1[nH+]ccn1CC ZINC000868679870 589572660 /nfs/dbraw/zinc/57/26/60/589572660.db2.gz YIGHLMGLJBHKKB-CMWXKVOJSA-N 1 2 239.294 2.344 20 0 BEADLO CC(C)(C)[C@@H]1C[C@H]1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000868731325 589574826 /nfs/dbraw/zinc/57/48/26/589574826.db2.gz GSKYYQPGJNDQGQ-NXEZZACHSA-N 1 2 249.358 2.443 20 0 BEADLO CC/C=C(\F)C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000868730875 589574916 /nfs/dbraw/zinc/57/49/16/589574916.db2.gz BBAHUKZOZYSLPX-YVMONPNESA-N 1 2 225.267 2.024 20 0 BEADLO O=C(Cc1cn2cc(F)ccc2[nH+]1)OC1CCC1 ZINC000870217752 589649645 /nfs/dbraw/zinc/64/96/45/589649645.db2.gz CQIMUKAAIHLPOL-UHFFFAOYSA-N 1 2 248.257 2.112 20 0 BEADLO Cl/C=C/CN1CC[NH+](C/C=C/Cl)CC1 ZINC000123648139 589761882 /nfs/dbraw/zinc/76/18/82/589761882.db2.gz FHCCSKDPFKOADL-ZPUQHVIOSA-N 1 2 235.158 2.109 20 0 BEADLO CCc1cc(N)nc(S[C@H](CC)C(C)=O)[nH+]1 ZINC000871667990 589785882 /nfs/dbraw/zinc/78/58/82/589785882.db2.gz GCEKARMDZLPFKD-SECBINFHSA-N 1 2 239.344 2.081 20 0 BEADLO CCc1cc(N)nc(S[C@@H](CC)C(C)=O)[nH+]1 ZINC000871667991 589786299 /nfs/dbraw/zinc/78/62/99/589786299.db2.gz GCEKARMDZLPFKD-VIFPVBQESA-N 1 2 239.344 2.081 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OC[C@@H]1CCO[C@@H]1C ZINC000871719476 589798002 /nfs/dbraw/zinc/79/80/02/589798002.db2.gz WXNUZRAPMPRWJA-NEPJUHHUSA-N 1 2 248.326 2.267 20 0 BEADLO C[C@H]1OCC[C@@H]1CO[NH+]=C(N)Cc1ccccc1 ZINC000871727672 589799831 /nfs/dbraw/zinc/79/98/31/589799831.db2.gz JOKCVAIHYNEYQW-DGCLKSJQSA-N 1 2 248.326 2.153 20 0 BEADLO CC(C)=CCCO[NH+]=C(N)COC1CCC1 ZINC000871778647 589813537 /nfs/dbraw/zinc/81/35/37/589813537.db2.gz RCZBGTMJUZECLD-UHFFFAOYSA-N 1 2 226.320 2.410 20 0 BEADLO Cc1ccccc1OCCOCc1[nH]cc[nH+]1 ZINC000123784001 589813637 /nfs/dbraw/zinc/81/36/37/589813637.db2.gz QFOMYTCBHVXCTK-UHFFFAOYSA-N 1 2 232.283 2.314 20 0 BEADLO CC(C)CCCO[NH+]=C(N)COC1CCC1 ZINC000871778452 589814334 /nfs/dbraw/zinc/81/43/34/589814334.db2.gz IYWQMCUYWBCHBC-UHFFFAOYSA-N 1 2 228.336 2.490 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2cc(O)ccc2F)[nH]n1 ZINC000872037291 589858535 /nfs/dbraw/zinc/85/85/35/589858535.db2.gz DHOQLJHUKVHFRG-SECBINFHSA-N 1 2 249.289 2.414 20 0 BEADLO C[C@H]([NH2+]Cc1ccn(C)n1)c1cc(O)ccc1F ZINC000872053970 589861546 /nfs/dbraw/zinc/86/15/46/589861546.db2.gz NXUHVDILPZULII-VIFPVBQESA-N 1 2 249.289 2.116 20 0 BEADLO Cc1nonc1C[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000872135722 589879444 /nfs/dbraw/zinc/87/94/44/589879444.db2.gz IHNPKGFDXLIWAL-LBPRGKRZSA-N 1 2 247.273 2.294 20 0 BEADLO CCC[C@@H]([NH2+]Cc1nonc1C)c1ccccn1 ZINC000872137624 589879879 /nfs/dbraw/zinc/87/98/79/589879879.db2.gz UUFBJHZJAMDSEW-LLVKDONJSA-N 1 2 246.314 2.404 20 0 BEADLO CCC[C@H](CC)c1nc(C[NH2+]CC)no1 ZINC000872172174 589888096 /nfs/dbraw/zinc/88/80/96/589888096.db2.gz ZPDHTDUXDDRWJZ-VIFPVBQESA-N 1 2 211.309 2.473 20 0 BEADLO FC(F)(F)[C@@H]1CCN(c2cccc[nH+]2)CCO1 ZINC000872751758 589966561 /nfs/dbraw/zinc/96/65/61/589966561.db2.gz ROEDWBHXHLEYMW-VIFPVBQESA-N 1 2 246.232 2.239 20 0 BEADLO c1nc(N[C@H]2CC23CCC3)cc(NC2CC2)[nH+]1 ZINC000872775125 589968054 /nfs/dbraw/zinc/96/80/54/589968054.db2.gz QHODFLUZVRVJLT-JTQLQIEISA-N 1 2 230.315 2.405 20 0 BEADLO c1nc(NC2CC2)cc(N[C@H]2CC23CCC3)[nH+]1 ZINC000872775125 589968055 /nfs/dbraw/zinc/96/80/55/589968055.db2.gz QHODFLUZVRVJLT-JTQLQIEISA-N 1 2 230.315 2.405 20 0 BEADLO CCn1ncc(Nc2cc(C)[nH+]c(C)n2)c1C ZINC000872778091 589968972 /nfs/dbraw/zinc/96/89/72/589968972.db2.gz AFUGQYXCWNSNOA-UHFFFAOYSA-N 1 2 231.303 2.362 20 0 BEADLO COc1ccc([NH2+][C@H]2CCNC(=O)CC2)c(C)c1 ZINC000873082521 589983561 /nfs/dbraw/zinc/98/35/61/589983561.db2.gz FCWCLSFQXXXCEV-LLVKDONJSA-N 1 2 248.326 2.084 20 0 BEADLO CC[C@@H]([NH2+][C@H]1CCOC1=O)c1ccc(C)cc1 ZINC000019876562 590025599 /nfs/dbraw/zinc/02/55/99/590025599.db2.gz PHFLDFAJBWASOR-OLZOCXBDSA-N 1 2 233.311 2.351 20 0 BEADLO O=C(OCCn1cc[nH+]c1)C1CCC=CCC1 ZINC000873428723 590043153 /nfs/dbraw/zinc/04/31/53/590043153.db2.gz KZCFJDADBIUYAJ-UHFFFAOYSA-N 1 2 234.299 2.173 20 0 BEADLO CCC[C@@H](CC)C(=O)NCCCn1cc[nH+]c1 ZINC000873733604 590069106 /nfs/dbraw/zinc/06/91/06/590069106.db2.gz ULEKBQUWKSHEDR-GFCCVEGCSA-N 1 2 237.347 2.216 20 0 BEADLO CCCCCCNC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000873912395 590079124 /nfs/dbraw/zinc/07/91/24/590079124.db2.gz IVEQUVFCTLEFNX-GHMZBOCLSA-N 1 2 235.331 2.210 20 0 BEADLO CCCCCCNC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000873912395 590079126 /nfs/dbraw/zinc/07/91/26/590079126.db2.gz IVEQUVFCTLEFNX-GHMZBOCLSA-N 1 2 235.331 2.210 20 0 BEADLO COC(=O)[C@@H]1CCC[N@@H+]1Cc1cc(C)oc1C ZINC000124799561 590085694 /nfs/dbraw/zinc/08/56/94/590085694.db2.gz JAQOXEHLHYENGI-LBPRGKRZSA-N 1 2 237.299 2.034 20 0 BEADLO COC(=O)[C@@H]1CCC[N@H+]1Cc1cc(C)oc1C ZINC000124799561 590085696 /nfs/dbraw/zinc/08/56/96/590085696.db2.gz JAQOXEHLHYENGI-LBPRGKRZSA-N 1 2 237.299 2.034 20 0 BEADLO CCC[C@H](CC)C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000874049588 590087884 /nfs/dbraw/zinc/08/78/84/590087884.db2.gz IRJXQQYFAQTVEE-NEPJUHHUSA-N 1 2 237.347 2.214 20 0 BEADLO C[N@H+](Cn1ncsc1=S)[C@@H]1CCSC1 ZINC000125040944 590115722 /nfs/dbraw/zinc/11/57/22/590115722.db2.gz DCCLYIZWSJULQT-SSDOTTSWSA-N 1 2 247.414 2.069 20 0 BEADLO C[N@@H+](Cn1ncsc1=S)[C@@H]1CCSC1 ZINC000125040944 590115724 /nfs/dbraw/zinc/11/57/24/590115724.db2.gz DCCLYIZWSJULQT-SSDOTTSWSA-N 1 2 247.414 2.069 20 0 BEADLO C[N@H+](Cc1ccc(Cl)nc1)Cc1cncnc1 ZINC000125701208 590181972 /nfs/dbraw/zinc/18/19/72/590181972.db2.gz NSZYVKUQZFSKMA-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[N@@H+](Cc1ccc(Cl)nc1)Cc1cncnc1 ZINC000125701208 590181973 /nfs/dbraw/zinc/18/19/73/590181973.db2.gz NSZYVKUQZFSKMA-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO COCC[N@H+](C)Cc1c(Cl)cncc1Cl ZINC000876564490 590216545 /nfs/dbraw/zinc/21/65/45/590216545.db2.gz LZIDZTLVLNXVAY-UHFFFAOYSA-N 1 2 249.141 2.467 20 0 BEADLO COCC[N@@H+](C)Cc1c(Cl)cncc1Cl ZINC000876564490 590216546 /nfs/dbraw/zinc/21/65/46/590216546.db2.gz LZIDZTLVLNXVAY-UHFFFAOYSA-N 1 2 249.141 2.467 20 0 BEADLO C[C@@H]([NH2+]Cc1ccc(Cl)nn1)c1ccccn1 ZINC000876887701 590254386 /nfs/dbraw/zinc/25/43/86/590254386.db2.gz DQWSCMRKGAQMBO-SECBINFHSA-N 1 2 248.717 2.376 20 0 BEADLO COc1cnc(F)c(C[NH2+]Cc2ccoc2)c1 ZINC000876962503 590262034 /nfs/dbraw/zinc/26/20/34/590262034.db2.gz QVIOLIMUDGLZLD-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO CCn1ncnc1C[NH2+]Cc1c(C)cccc1F ZINC000877068820 590277331 /nfs/dbraw/zinc/27/73/31/590277331.db2.gz TWSNHZALQNPBQU-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO CCOCC[N@H+](C)Cc1nc(Cl)cs1 ZINC000877172354 590296229 /nfs/dbraw/zinc/29/62/29/590296229.db2.gz PHERKOWELABPGT-UHFFFAOYSA-N 1 2 234.752 2.265 20 0 BEADLO CCOCC[N@@H+](C)Cc1nc(Cl)cs1 ZINC000877172354 590296230 /nfs/dbraw/zinc/29/62/30/590296230.db2.gz PHERKOWELABPGT-UHFFFAOYSA-N 1 2 234.752 2.265 20 0 BEADLO C[N@H+](Cc1nc(Cl)cs1)[C@@H]1CCCOC1 ZINC000877515698 590345376 /nfs/dbraw/zinc/34/53/76/590345376.db2.gz MJSODLOLBGAICD-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO C[N@@H+](Cc1nc(Cl)cs1)[C@@H]1CCCOC1 ZINC000877515698 590345379 /nfs/dbraw/zinc/34/53/79/590345379.db2.gz MJSODLOLBGAICD-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO CO[C@@H](C)C[N@H+](C)Cc1nc(Cl)cs1 ZINC000877524319 590347206 /nfs/dbraw/zinc/34/72/06/590347206.db2.gz UVYGEXMDQRDGTM-ZETCQYMHSA-N 1 2 234.752 2.263 20 0 BEADLO CO[C@@H](C)C[N@@H+](C)Cc1nc(Cl)cs1 ZINC000877524319 590347208 /nfs/dbraw/zinc/34/72/08/590347208.db2.gz UVYGEXMDQRDGTM-ZETCQYMHSA-N 1 2 234.752 2.263 20 0 BEADLO C[C@@H](CF)[NH2+]Cc1nc(Cl)cs1 ZINC000877548004 590354205 /nfs/dbraw/zinc/35/42/05/590354205.db2.gz CKHGMRAYKGYZRI-YFKPBYRVSA-N 1 2 208.689 2.244 20 0 BEADLO C[C@@]1(F)CCC[N@@H+](Cc2ccns2)C1 ZINC000877557951 590358583 /nfs/dbraw/zinc/35/85/83/590358583.db2.gz SGQABUYRIJSVOO-SNVBAGLBSA-N 1 2 214.309 2.467 20 0 BEADLO C[C@@]1(F)CCC[N@H+](Cc2ccns2)C1 ZINC000877557951 590358581 /nfs/dbraw/zinc/35/85/81/590358581.db2.gz SGQABUYRIJSVOO-SNVBAGLBSA-N 1 2 214.309 2.467 20 0 BEADLO Nc1c(Cl)cccc1C[NH2+]C(CF)CF ZINC000877559849 590358897 /nfs/dbraw/zinc/35/88/97/590358897.db2.gz XRBNQBDPXFDRCK-UHFFFAOYSA-N 1 2 234.677 2.319 20 0 BEADLO FC1CC2(C1)C[NH+](Cc1ccc(Cl)nn1)C2 ZINC000877581374 590365450 /nfs/dbraw/zinc/36/54/50/590365450.db2.gz ZQXSKPDMGXYFES-UHFFFAOYSA-N 1 2 241.697 2.064 20 0 BEADLO Cc1cc(C[NH2+]Cc2ncc[nH]2)cnc1Cl ZINC000877674997 590390111 /nfs/dbraw/zinc/39/01/11/590390111.db2.gz YOGHLXCFAPIUOC-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO Cc1cc(C[NH2+][C@@H]2C[C@H]2C(F)(F)F)no1 ZINC000877703510 590397064 /nfs/dbraw/zinc/39/70/64/590397064.db2.gz MORJYCBUUWHUFK-HTQZYQBOSA-N 1 2 220.194 2.023 20 0 BEADLO C[C@H]1CCC[C@@H](C2C[NH+](Cc3ncnn3C)C2)C1 ZINC000877763581 590420414 /nfs/dbraw/zinc/42/04/14/590420414.db2.gz CRJZNNZSFLBUSN-NWDGAFQWSA-N 1 2 248.374 2.073 20 0 BEADLO C[C@@H]1CCC[C@@H](C2C[NH+](Cc3cnn(C)n3)C2)C1 ZINC000877763953 590420728 /nfs/dbraw/zinc/42/07/28/590420728.db2.gz OOXWWXIYLZSKDA-VXGBXAGGSA-N 1 2 248.374 2.073 20 0 BEADLO Cc1cnccc1C[NH+]1CC(OC(C)(C)C)C1 ZINC000877770087 590421255 /nfs/dbraw/zinc/42/12/55/590421255.db2.gz PAPLCCFDWZDGJA-UHFFFAOYSA-N 1 2 234.343 2.389 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CC[C@@](C)(C(F)(F)F)C1 ZINC000877811855 590426879 /nfs/dbraw/zinc/42/68/79/590426879.db2.gz ADYLXGMPGUYCCN-SNVBAGLBSA-N 1 2 247.264 2.492 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CC[C@@](C)(C(F)(F)F)C1 ZINC000877811855 590426880 /nfs/dbraw/zinc/42/68/80/590426880.db2.gz ADYLXGMPGUYCCN-SNVBAGLBSA-N 1 2 247.264 2.492 20 0 BEADLO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2cocn2)C1 ZINC000877813064 590427143 /nfs/dbraw/zinc/42/71/43/590427143.db2.gz VVANLWRTUMFMCN-SECBINFHSA-N 1 2 234.221 2.449 20 0 BEADLO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2cocn2)C1 ZINC000877813064 590427144 /nfs/dbraw/zinc/42/71/44/590427144.db2.gz VVANLWRTUMFMCN-SECBINFHSA-N 1 2 234.221 2.449 20 0 BEADLO FC(F)(F)[C@H]1CC[N@H+](Cc2ccco2)CCO1 ZINC000877822825 590428227 /nfs/dbraw/zinc/42/82/27/590428227.db2.gz SQVCUWNMDWKABE-SNVBAGLBSA-N 1 2 249.232 2.433 20 0 BEADLO FC(F)(F)[C@H]1CC[N@@H+](Cc2ccco2)CCO1 ZINC000877822825 590428230 /nfs/dbraw/zinc/42/82/30/590428230.db2.gz SQVCUWNMDWKABE-SNVBAGLBSA-N 1 2 249.232 2.433 20 0 BEADLO FC(F)(F)[C@@H]1CC[N@H+](Cc2ccco2)CCO1 ZINC000877822823 590428457 /nfs/dbraw/zinc/42/84/57/590428457.db2.gz SQVCUWNMDWKABE-JTQLQIEISA-N 1 2 249.232 2.433 20 0 BEADLO FC(F)(F)[C@@H]1CC[N@@H+](Cc2ccco2)CCO1 ZINC000877822823 590428458 /nfs/dbraw/zinc/42/84/58/590428458.db2.gz SQVCUWNMDWKABE-JTQLQIEISA-N 1 2 249.232 2.433 20 0 BEADLO c1cn(-c2ccccc2OCCOC2CC2)c[nH+]1 ZINC000877877887 590436098 /nfs/dbraw/zinc/43/60/98/590436098.db2.gz HSBVESXLNUAGIX-UHFFFAOYSA-N 1 2 244.294 2.430 20 0 BEADLO FC(F)Cn1ccnc1C[NH+]1CCCCC1 ZINC000877944410 590454037 /nfs/dbraw/zinc/45/40/37/590454037.db2.gz CEMKOTSWDLWNGN-UHFFFAOYSA-N 1 2 229.274 2.134 20 0 BEADLO FC(F)Cn1ccnc1C[NH+]1C2CCC1CC2 ZINC000877952073 590455801 /nfs/dbraw/zinc/45/58/01/590455801.db2.gz ZKRLWPVNSCDUAQ-UHFFFAOYSA-N 1 2 241.285 2.275 20 0 BEADLO CC[C@@H]1CCC[C@]1(C)C(=O)NC1=[NH+]CCS1 ZINC000877963035 590459770 /nfs/dbraw/zinc/45/97/70/590459770.db2.gz FCUYUDCXGNALMQ-SKDRFNHKSA-N 1 2 240.372 2.422 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)C[C@@H]1CCC(C)(C)CO1 ZINC000878097892 590493077 /nfs/dbraw/zinc/49/30/77/590493077.db2.gz PIDGFUTZEVXRMB-LBPRGKRZSA-N 1 2 237.347 2.047 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)C[C@@H]1CCC(C)(C)CO1 ZINC000878097892 590493079 /nfs/dbraw/zinc/49/30/79/590493079.db2.gz PIDGFUTZEVXRMB-LBPRGKRZSA-N 1 2 237.347 2.047 20 0 BEADLO CC[C@H]1CCC[C@@]1(C)C(=O)NCCn1cc[nH+]c1 ZINC000878223185 590525714 /nfs/dbraw/zinc/52/57/14/590525714.db2.gz LXZPRZNGRSZDRI-GXTWGEPZSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@@H]1COCCC[N@@H+]1Cc1scnc1Cl ZINC000878287114 590534720 /nfs/dbraw/zinc/53/47/20/590534720.db2.gz WVJMJRGTWFGKOE-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@@H]1COCCC[N@H+]1Cc1scnc1Cl ZINC000878287114 590534723 /nfs/dbraw/zinc/53/47/23/590534723.db2.gz WVJMJRGTWFGKOE-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO Cc1conc1CN1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000878338513 590550341 /nfs/dbraw/zinc/55/03/41/590550341.db2.gz WQRDKIRXRQFBKU-LLVKDONJSA-N 1 2 232.287 2.043 20 0 BEADLO C=C/C=C/CC[NH+]1CC(O)(c2ccc(F)cc2)C1 ZINC000878453139 590569978 /nfs/dbraw/zinc/56/99/78/590569978.db2.gz QJGFOCXNMROLMF-ONEGZZNKSA-N 1 2 247.313 2.461 20 0 BEADLO C[N@H+](Cc1scnc1Cl)CC1(CO)CC1 ZINC000878481417 590576732 /nfs/dbraw/zinc/57/67/32/590576732.db2.gz CTEKNUPZVLQWQH-UHFFFAOYSA-N 1 2 246.763 2.001 20 0 BEADLO C[N@@H+](Cc1scnc1Cl)CC1(CO)CC1 ZINC000878481417 590576733 /nfs/dbraw/zinc/57/67/33/590576733.db2.gz CTEKNUPZVLQWQH-UHFFFAOYSA-N 1 2 246.763 2.001 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1nccn1CC(F)F ZINC000878533703 590587902 /nfs/dbraw/zinc/58/79/02/590587902.db2.gz RGRVEBFVOVPKPF-RKDXNWHRSA-N 1 2 229.274 2.131 20 0 BEADLO C=C/C=C/CC[N@@H+]1CCC[C@@H](C2N=NC(=O)O2)C1 ZINC000878549357 590590270 /nfs/dbraw/zinc/59/02/70/590590270.db2.gz FHKQVBZNMROLGM-PGLGOXFNSA-N 1 2 249.314 2.087 20 0 BEADLO C=C/C=C/CC[N@H+]1CCC[C@@H](C2N=NC(=O)O2)C1 ZINC000878549357 590590273 /nfs/dbraw/zinc/59/02/73/590590273.db2.gz FHKQVBZNMROLGM-PGLGOXFNSA-N 1 2 249.314 2.087 20 0 BEADLO c1cnc2c(c1)C[N@@H+](C[C@@H]1C[C@@H]3CCC[C@@H]3O1)C2 ZINC000878548931 590590504 /nfs/dbraw/zinc/59/05/04/590590504.db2.gz YVJNYUOFEDXHRQ-WHOFXGATSA-N 1 2 244.338 2.355 20 0 BEADLO c1cnc2c(c1)C[N@H+](C[C@@H]1C[C@@H]3CCC[C@@H]3O1)C2 ZINC000878548931 590590505 /nfs/dbraw/zinc/59/05/05/590590505.db2.gz YVJNYUOFEDXHRQ-WHOFXGATSA-N 1 2 244.338 2.355 20 0 BEADLO c1cnc2c(c1)C[N@@H+](C[C@@H]1C[C@@H]3CCC[C@H]3O1)C2 ZINC000878548929 590590519 /nfs/dbraw/zinc/59/05/19/590590519.db2.gz YVJNYUOFEDXHRQ-CORIIIEPSA-N 1 2 244.338 2.355 20 0 BEADLO c1cnc2c(c1)C[N@H+](C[C@@H]1C[C@@H]3CCC[C@H]3O1)C2 ZINC000878548929 590590520 /nfs/dbraw/zinc/59/05/20/590590520.db2.gz YVJNYUOFEDXHRQ-CORIIIEPSA-N 1 2 244.338 2.355 20 0 BEADLO CC1=CCC[N@H+](Cc2nccn2CC(F)F)C1 ZINC000878548319 590590934 /nfs/dbraw/zinc/59/09/34/590590934.db2.gz KHINVAJQPMVTOO-UHFFFAOYSA-N 1 2 241.285 2.300 20 0 BEADLO CC1=CCC[N@@H+](Cc2nccn2CC(F)F)C1 ZINC000878548319 590590935 /nfs/dbraw/zinc/59/09/35/590590935.db2.gz KHINVAJQPMVTOO-UHFFFAOYSA-N 1 2 241.285 2.300 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nocc2C)C[C@H](CC)O1 ZINC000878719476 590615906 /nfs/dbraw/zinc/61/59/06/590615906.db2.gz BYLRSTPNETVFCQ-TXEJJXNPSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nocc2C)C[C@H](CC)O1 ZINC000878719476 590615908 /nfs/dbraw/zinc/61/59/08/590615908.db2.gz BYLRSTPNETVFCQ-TXEJJXNPSA-N 1 2 238.331 2.372 20 0 BEADLO CCN(CC)C(=O)[C@@H](C)[N@@H+]1CCC=C(Cl)C1 ZINC000878793232 590622030 /nfs/dbraw/zinc/62/20/30/590622030.db2.gz JIUUBMNJHFRTAG-SNVBAGLBSA-N 1 2 244.766 2.072 20 0 BEADLO CCN(CC)C(=O)[C@@H](C)[N@H+]1CCC=C(Cl)C1 ZINC000878793232 590622031 /nfs/dbraw/zinc/62/20/31/590622031.db2.gz JIUUBMNJHFRTAG-SNVBAGLBSA-N 1 2 244.766 2.072 20 0 BEADLO FC1(F)C[C@H]1OCC[N@@H+]1CCC=C(Cl)C1 ZINC000878790746 590622471 /nfs/dbraw/zinc/62/24/71/590622471.db2.gz UPDOHGDZPSNVKD-SECBINFHSA-N 1 2 237.677 2.239 20 0 BEADLO FC1(F)C[C@H]1OCC[N@H+]1CCC=C(Cl)C1 ZINC000878790746 590622472 /nfs/dbraw/zinc/62/24/72/590622472.db2.gz UPDOHGDZPSNVKD-SECBINFHSA-N 1 2 237.677 2.239 20 0 BEADLO Cc1cc(C[N@@H+]2CCC=C(Cl)C2)ncn1 ZINC000878790768 590622543 /nfs/dbraw/zinc/62/25/43/590622543.db2.gz VHIQZTNVPLFJAJ-UHFFFAOYSA-N 1 2 223.707 2.113 20 0 BEADLO Cc1cc(C[N@H+]2CCC=C(Cl)C2)ncn1 ZINC000878790768 590622544 /nfs/dbraw/zinc/62/25/44/590622544.db2.gz VHIQZTNVPLFJAJ-UHFFFAOYSA-N 1 2 223.707 2.113 20 0 BEADLO C[C@@H](c1cnccn1)[N@@H+]1CCC=C(Cl)C1 ZINC000878791069 590623017 /nfs/dbraw/zinc/62/30/17/590623017.db2.gz CIVQUTUKDDLREM-VIFPVBQESA-N 1 2 223.707 2.366 20 0 BEADLO C[C@@H](c1cnccn1)[N@H+]1CCC=C(Cl)C1 ZINC000878791069 590623018 /nfs/dbraw/zinc/62/30/18/590623018.db2.gz CIVQUTUKDDLREM-VIFPVBQESA-N 1 2 223.707 2.366 20 0 BEADLO ClC1=CCC[N@H+](Cc2cccnc2)C1 ZINC000878793516 590624306 /nfs/dbraw/zinc/62/43/06/590624306.db2.gz FJRGSLJKTQLBOY-UHFFFAOYSA-N 1 2 208.692 2.410 20 0 BEADLO ClC1=CCC[N@@H+](Cc2cccnc2)C1 ZINC000878793516 590624308 /nfs/dbraw/zinc/62/43/08/590624308.db2.gz FJRGSLJKTQLBOY-UHFFFAOYSA-N 1 2 208.692 2.410 20 0 BEADLO CC[C@@H]1CCC[C@@]1(C)C(=O)NCc1[nH]cc[nH+]1 ZINC000878816934 590627125 /nfs/dbraw/zinc/62/71/25/590627125.db2.gz XYBYDEKMAWAMDD-ZWNOBZJWSA-N 1 2 235.331 2.242 20 0 BEADLO C[N@H+](Cc1ccns1)Cc1ccc(F)cn1 ZINC000878899364 590643970 /nfs/dbraw/zinc/64/39/70/590643970.db2.gz HHPOUUFSPKXMHY-UHFFFAOYSA-N 1 2 237.303 2.309 20 0 BEADLO C[N@@H+](Cc1ccns1)Cc1ccc(F)cn1 ZINC000878899364 590643972 /nfs/dbraw/zinc/64/39/72/590643972.db2.gz HHPOUUFSPKXMHY-UHFFFAOYSA-N 1 2 237.303 2.309 20 0 BEADLO COC(=O)[C@@](C)(CCF)[NH2+]CCCC1CC1 ZINC000878950906 590660406 /nfs/dbraw/zinc/66/04/06/590660406.db2.gz CRACBYDKIRQMNZ-GFCCVEGCSA-N 1 2 231.311 2.058 20 0 BEADLO Cl/C=C\C[N@@H+]1CCC[C@@H]1c1ncccn1 ZINC000878976425 590664517 /nfs/dbraw/zinc/66/45/17/590664517.db2.gz DFIQKCNKVCAGFP-XJIUSYNZSA-N 1 2 223.707 2.366 20 0 BEADLO Cl/C=C\C[N@H+]1CCC[C@@H]1c1ncccn1 ZINC000878976425 590664520 /nfs/dbraw/zinc/66/45/20/590664520.db2.gz DFIQKCNKVCAGFP-XJIUSYNZSA-N 1 2 223.707 2.366 20 0 BEADLO Cc1oncc1C[N@@H+]1CCC[C@H]1c1ncccn1 ZINC000878978978 590666041 /nfs/dbraw/zinc/66/60/41/590666041.db2.gz TWCAXFCRLYFAOR-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1oncc1C[N@H+]1CCC[C@H]1c1ncccn1 ZINC000878978978 590666044 /nfs/dbraw/zinc/66/60/44/590666044.db2.gz TWCAXFCRLYFAOR-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)C[C@@H]1CC2(CCC2)CO1 ZINC000879188285 590709730 /nfs/dbraw/zinc/70/97/30/590709730.db2.gz JOHZQINWMCGRNH-ZDUSSCGKSA-N 1 2 249.358 2.109 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)C[C@@H]1CC2(CCC2)CO1 ZINC000879188285 590709735 /nfs/dbraw/zinc/70/97/35/590709735.db2.gz JOHZQINWMCGRNH-ZDUSSCGKSA-N 1 2 249.358 2.109 20 0 BEADLO C=C/C=C\CC[N@@H+](C)Cc1cn[nH]c1C ZINC000879188946 590712105 /nfs/dbraw/zinc/71/21/05/590712105.db2.gz UDNPUMYMQZQEHK-WAYWQWQTSA-N 1 2 205.305 2.282 20 0 BEADLO C=C/C=C\CC[N@H+](C)Cc1cn[nH]c1C ZINC000879188946 590712109 /nfs/dbraw/zinc/71/21/09/590712109.db2.gz UDNPUMYMQZQEHK-WAYWQWQTSA-N 1 2 205.305 2.282 20 0 BEADLO C[C@]1(C(F)(F)F)C[N@H+](CCCCF)CCO1 ZINC000879502327 590783505 /nfs/dbraw/zinc/78/35/05/590783505.db2.gz ZELGPKKWUKHDPR-SECBINFHSA-N 1 2 243.244 2.389 20 0 BEADLO C[C@]1(C(F)(F)F)C[N@@H+](CCCCF)CCO1 ZINC000879502327 590783507 /nfs/dbraw/zinc/78/35/07/590783507.db2.gz ZELGPKKWUKHDPR-SECBINFHSA-N 1 2 243.244 2.389 20 0 BEADLO CC1(C)C[C@H](O)C[N@H+](C/C(Cl)=C\Cl)C1 ZINC000879622863 590835881 /nfs/dbraw/zinc/83/58/81/590835881.db2.gz SRLRXOSRKACSMZ-SGDMMICCSA-N 1 2 238.158 2.398 20 0 BEADLO CC1(C)C[C@H](O)C[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000879622863 590835885 /nfs/dbraw/zinc/83/58/85/590835885.db2.gz SRLRXOSRKACSMZ-SGDMMICCSA-N 1 2 238.158 2.398 20 0 BEADLO CCOC(=O)C[N@@H+]1CCC[C@H]1c1cncc(C)c1 ZINC000879749195 590861416 /nfs/dbraw/zinc/86/14/16/590861416.db2.gz UIADATXTCLVZSP-ZDUSSCGKSA-N 1 2 248.326 2.090 20 0 BEADLO CCOC(=O)C[N@H+]1CCC[C@H]1c1cncc(C)c1 ZINC000879749195 590861427 /nfs/dbraw/zinc/86/14/27/590861427.db2.gz UIADATXTCLVZSP-ZDUSSCGKSA-N 1 2 248.326 2.090 20 0 BEADLO Cc1cncc([C@@H]2CCC[N@@H+]2Cc2cnon2)c1 ZINC000879751081 590863230 /nfs/dbraw/zinc/86/32/30/590863230.db2.gz DNUGRJRWGWOURS-ZDUSSCGKSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1cncc([C@@H]2CCC[N@H+]2Cc2cnon2)c1 ZINC000879751081 590863234 /nfs/dbraw/zinc/86/32/34/590863234.db2.gz DNUGRJRWGWOURS-ZDUSSCGKSA-N 1 2 244.298 2.110 20 0 BEADLO CC1(C)OC[C@@H](CC[N@@H+]2OC3CCC2CC3)O1 ZINC000879800350 590878109 /nfs/dbraw/zinc/87/81/09/590878109.db2.gz POJWNXPJCVFGQV-HTAVTVPLSA-N 1 2 241.331 2.086 20 0 BEADLO CC1(C)OC[C@@H](CC[N@H+]2OC3CCC2CC3)O1 ZINC000879800350 590878113 /nfs/dbraw/zinc/87/81/13/590878113.db2.gz POJWNXPJCVFGQV-HTAVTVPLSA-N 1 2 241.331 2.086 20 0 BEADLO CCOC(=O)[C@@H](CC1CC1)[NH2+][C@@H]1C=CCCC1 ZINC000879982562 590903542 /nfs/dbraw/zinc/90/35/42/590903542.db2.gz GYQSUFUBUXMFDX-CHWSQXEVSA-N 1 2 237.343 2.417 20 0 BEADLO CC[C@H]1CCC[C@@]1(C)C(=O)NCc1c[nH+]cn1C ZINC000880026143 590912278 /nfs/dbraw/zinc/91/22/78/590912278.db2.gz FSPRWURQGKLOKR-SMDDNHRTSA-N 1 2 249.358 2.253 20 0 BEADLO FC(F)(F)[C@H]1CC[N@H+](C/C=C\Cl)CCO1 ZINC000880044906 590913850 /nfs/dbraw/zinc/91/38/50/590913850.db2.gz UUYZTEJJPUFJMQ-XKKRXVNHSA-N 1 2 243.656 2.392 20 0 BEADLO FC(F)(F)[C@H]1CC[N@@H+](C/C=C\Cl)CCO1 ZINC000880044906 590913853 /nfs/dbraw/zinc/91/38/53/590913853.db2.gz UUYZTEJJPUFJMQ-XKKRXVNHSA-N 1 2 243.656 2.392 20 0 BEADLO C[C@H](c1csnn1)[N@@H+]1CCC[C@H](CF)C1 ZINC000880238905 590971466 /nfs/dbraw/zinc/97/14/66/590971466.db2.gz YWBJVAXPWBCMRQ-RKDXNWHRSA-N 1 2 229.324 2.281 20 0 BEADLO C[C@H](c1csnn1)[N@H+]1CCC[C@H](CF)C1 ZINC000880238905 590971467 /nfs/dbraw/zinc/97/14/67/590971467.db2.gz YWBJVAXPWBCMRQ-RKDXNWHRSA-N 1 2 229.324 2.281 20 0 BEADLO COCc1nc(C[NH+]2CCC(F)CC2)cs1 ZINC000880242095 590974962 /nfs/dbraw/zinc/97/49/62/590974962.db2.gz PEGPDONWEXGTQO-UHFFFAOYSA-N 1 2 244.335 2.223 20 0 BEADLO CC(C)Cc1noc(C[NH+]2CCC(F)CC2)n1 ZINC000880243697 590976176 /nfs/dbraw/zinc/97/61/76/590976176.db2.gz QRRBBFPIZDJRDD-UHFFFAOYSA-N 1 2 241.310 2.202 20 0 BEADLO FC[C@H]1CC[N@H+](Cc2noc(C3CCC3)n2)C1 ZINC000880301628 590998696 /nfs/dbraw/zinc/99/86/96/590998696.db2.gz VUBKKUGGQZYORA-SECBINFHSA-N 1 2 239.294 2.129 20 0 BEADLO FC[C@H]1CC[N@@H+](Cc2noc(C3CCC3)n2)C1 ZINC000880301628 590998700 /nfs/dbraw/zinc/99/87/00/590998700.db2.gz VUBKKUGGQZYORA-SECBINFHSA-N 1 2 239.294 2.129 20 0 BEADLO c1cnc(C2([NH2+]Cc3cccnc3)CCC2)nc1 ZINC000880365420 591010111 /nfs/dbraw/zinc/01/01/11/591010111.db2.gz KKFIFSMIRQMTKV-UHFFFAOYSA-N 1 2 240.310 2.041 20 0 BEADLO c1cnc(C2([NH2+]Cc3ccncc3)CCC2)nc1 ZINC000880365732 591010763 /nfs/dbraw/zinc/01/07/63/591010763.db2.gz RRYPNGZPBKLFRB-UHFFFAOYSA-N 1 2 240.310 2.041 20 0 BEADLO OC[C@@H]1C=CC[N@@H+]1Cc1ccsc1Cl ZINC000880494970 591068137 /nfs/dbraw/zinc/06/81/37/591068137.db2.gz XEIPEOOLSWRRON-VIFPVBQESA-N 1 2 229.732 2.134 20 0 BEADLO OC[C@@H]1C=CC[N@H+]1Cc1ccsc1Cl ZINC000880494970 591068140 /nfs/dbraw/zinc/06/81/40/591068140.db2.gz XEIPEOOLSWRRON-VIFPVBQESA-N 1 2 229.732 2.134 20 0 BEADLO OC[C@@H]1C=CC[N@@H+]1Cc1ccc(Cl)s1 ZINC000880487453 591063223 /nfs/dbraw/zinc/06/32/23/591063223.db2.gz ZKKVCIQXJRVEMS-QMMMGPOBSA-N 1 2 229.732 2.134 20 0 BEADLO OC[C@@H]1C=CC[N@H+]1Cc1ccc(Cl)s1 ZINC000880487453 591063225 /nfs/dbraw/zinc/06/32/25/591063225.db2.gz ZKKVCIQXJRVEMS-QMMMGPOBSA-N 1 2 229.732 2.134 20 0 BEADLO OC[C@H]1C=CC[N@@H+]1Cc1nc2ccccc2s1 ZINC000880487071 591064823 /nfs/dbraw/zinc/06/48/23/591064823.db2.gz WGVPGPDRNSHRMF-SNVBAGLBSA-N 1 2 246.335 2.029 20 0 BEADLO OC[C@H]1C=CC[N@H+]1Cc1nc2ccccc2s1 ZINC000880487071 591064827 /nfs/dbraw/zinc/06/48/27/591064827.db2.gz WGVPGPDRNSHRMF-SNVBAGLBSA-N 1 2 246.335 2.029 20 0 BEADLO OC[C@@H]1C=CC[N@@H+]1Cc1ccc(Cl)cc1F ZINC000880489631 591066262 /nfs/dbraw/zinc/06/62/62/591066262.db2.gz WENGLVXGTWDPIT-NSHDSACASA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@@H]1C=CC[N@H+]1Cc1ccc(Cl)cc1F ZINC000880489631 591066266 /nfs/dbraw/zinc/06/62/66/591066266.db2.gz WENGLVXGTWDPIT-NSHDSACASA-N 1 2 241.693 2.212 20 0 BEADLO C/C=C\C(=O)NCCn1c(C)[nH+]c2ccccc21 ZINC000211397460 591164374 /nfs/dbraw/zinc/16/43/74/591164374.db2.gz STNDHLCMZRWWRG-UTCJRWHESA-N 1 2 243.310 2.037 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)NCC1(CC2CC2)CC1 ZINC000881520276 591228324 /nfs/dbraw/zinc/22/83/24/591228324.db2.gz KNKQUFHEPVJJFX-UHFFFAOYSA-N 1 2 247.342 2.039 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NC[C@]1(C)CC1(C)C ZINC000881545783 591237668 /nfs/dbraw/zinc/23/76/68/591237668.db2.gz OGIBFWQWTZEVPD-HZMBPMFUSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NC[C@]1(C)CC1(C)C ZINC000881545783 591237669 /nfs/dbraw/zinc/23/76/69/591237669.db2.gz OGIBFWQWTZEVPD-HZMBPMFUSA-N 1 2 249.358 2.141 20 0 BEADLO Cc1[nH+]cnc(N2CCC[C@H](C)C2)c1C ZINC000881733998 591268164 /nfs/dbraw/zinc/26/81/64/591268164.db2.gz CAOOJAWYUXBGHZ-VIFPVBQESA-N 1 2 205.305 2.330 20 0 BEADLO Cc1[nH+]cnc(NCCc2ccc(O)cc2)c1C ZINC000881835126 591273700 /nfs/dbraw/zinc/27/37/00/591273700.db2.gz RKKOJXPMXBQSPZ-UHFFFAOYSA-N 1 2 243.310 2.454 20 0 BEADLO Cc1noc(C)c1CNc1nc[nH+]c(C)c1C ZINC000881845527 591274551 /nfs/dbraw/zinc/27/45/51/591274551.db2.gz QCPSJGJLCCZFBM-UHFFFAOYSA-N 1 2 232.287 2.310 20 0 BEADLO Fc1c[nH+]ccc1N1CCC(c2cn[nH]c2)CC1 ZINC000881881480 591276128 /nfs/dbraw/zinc/27/61/28/591276128.db2.gz LYMCMBYLSNPLEK-UHFFFAOYSA-N 1 2 246.289 2.328 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H](O)C2CCCCC2)c1C ZINC000881913194 591278154 /nfs/dbraw/zinc/27/81/54/591278154.db2.gz ZHPZSHUZFSPDQT-CYBMUJFWSA-N 1 2 249.358 2.447 20 0 BEADLO Cc1cccnc1CNc1nc[nH+]c(C)c1C ZINC000881924206 591278703 /nfs/dbraw/zinc/27/87/03/591278703.db2.gz YKFHRLUDBFPZLE-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO Cc1[nH+]cnc(N(C)CC2CCC2)c1C ZINC000881967931 591284588 /nfs/dbraw/zinc/28/45/88/591284588.db2.gz NBMXPESAQRMUIH-UHFFFAOYSA-N 1 2 205.305 2.330 20 0 BEADLO Cc1[nH+]cnc(NCCn2cccc2)c1C ZINC000882057407 591293273 /nfs/dbraw/zinc/29/32/73/591293273.db2.gz BCSPZTWFTXJWIX-UHFFFAOYSA-N 1 2 216.288 2.007 20 0 BEADLO Cc1[nH+]cnc(N2CC(CC(F)(F)F)C2)c1C ZINC000882090933 591295765 /nfs/dbraw/zinc/29/57/65/591295765.db2.gz WQQMHQQHEWXHKJ-UHFFFAOYSA-N 1 2 245.248 2.482 20 0 BEADLO Cc1[nH+]cnc(N[C@@H](C)C[C@@H]2CCOC2)c1C ZINC000882088806 591295824 /nfs/dbraw/zinc/29/58/24/591295824.db2.gz MSGVRTGZSZOHQA-CABZTGNLSA-N 1 2 235.331 2.320 20 0 BEADLO Cc1[nH+]cnc(N(C)CCOC(C)(C)C)c1C ZINC000882108740 591299039 /nfs/dbraw/zinc/29/90/39/591299039.db2.gz DLFFVDJOVGSNDB-UHFFFAOYSA-N 1 2 237.347 2.345 20 0 BEADLO Cc1ncc(CCNc2cc[nH+]cc2F)s1 ZINC000882116852 591300632 /nfs/dbraw/zinc/30/06/32/591300632.db2.gz GJOCJDZWJHBMFO-UHFFFAOYSA-N 1 2 237.303 2.062 20 0 BEADLO C[C@H](Nc1cc(CO)cc[nH+]1)c1ccc[nH]1 ZINC000882139249 591304950 /nfs/dbraw/zinc/30/49/50/591304950.db2.gz UIYYKXPSUCZRHL-VIFPVBQESA-N 1 2 217.272 2.075 20 0 BEADLO Cc1[nH+]cnc(N(C)C[C@H]2CCCC[C@@H]2O)c1C ZINC000882165547 591309880 /nfs/dbraw/zinc/30/98/80/591309880.db2.gz AZQDWFXWZZKVFP-OLZOCXBDSA-N 1 2 249.358 2.081 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2CCC(C)(C)O2)c1C ZINC000882212943 591317574 /nfs/dbraw/zinc/31/75/74/591317574.db2.gz YEFCSTPGRNRFPG-NSHDSACASA-N 1 2 235.331 2.463 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2CSC2(C)C)c1C ZINC000882241138 591319706 /nfs/dbraw/zinc/31/97/06/591319706.db2.gz CAIHACSHMXZOTB-VIFPVBQESA-N 1 2 223.345 2.399 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2CCSC2)c1C ZINC000882280928 591326122 /nfs/dbraw/zinc/32/61/22/591326122.db2.gz OPUAOUHPQWLSQB-JTQLQIEISA-N 1 2 223.345 2.258 20 0 BEADLO Cc1[nH+]cnc(N2CC3(C2)CC(F)(F)C3)c1C ZINC000882312443 591328430 /nfs/dbraw/zinc/32/84/30/591328430.db2.gz PGVKDFQMGPTPEF-UHFFFAOYSA-N 1 2 239.269 2.329 20 0 BEADLO Cc1[nH+]cnc(N[C@@H](C)CCCCO)c1C ZINC000882410880 591344277 /nfs/dbraw/zinc/34/42/77/591344277.db2.gz NNVYUBYQRFSQBU-VIFPVBQESA-N 1 2 223.320 2.056 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2CCCC[C@H]2O)c1C ZINC000882427503 591346869 /nfs/dbraw/zinc/34/68/69/591346869.db2.gz RATVKXAHXIUBEC-NWDGAFQWSA-N 1 2 235.331 2.056 20 0 BEADLO COCC[C@@H](C)CNc1nc[nH+]c(C)c1C ZINC000882453636 591351089 /nfs/dbraw/zinc/35/10/89/591351089.db2.gz VXEQOCBBIWRAJS-SECBINFHSA-N 1 2 223.320 2.178 20 0 BEADLO COCC1(CCNc2nc[nH+]c(C)c2C)CC1 ZINC000882512522 591380803 /nfs/dbraw/zinc/38/08/03/591380803.db2.gz AWYCQOCZQKYGOI-UHFFFAOYSA-N 1 2 235.331 2.322 20 0 BEADLO Cc1[nH+]cnc(NCC(O)(C2CC2)C2CC2)c1C ZINC000882622227 591401233 /nfs/dbraw/zinc/40/12/33/591401233.db2.gz QDOWZEDNMIELTH-UHFFFAOYSA-N 1 2 247.342 2.056 20 0 BEADLO Cc1cnc(C)c(N[C@@H](C)c2[nH+]ccn2C)n1 ZINC000882626076 591402696 /nfs/dbraw/zinc/40/26/96/591402696.db2.gz SWMRADVKCOQQNE-JTQLQIEISA-N 1 2 231.303 2.000 20 0 BEADLO Cc1[nH+]cnc(NCc2ccnc(F)c2)c1C ZINC000882686733 591411878 /nfs/dbraw/zinc/41/18/78/591411878.db2.gz QUOLFJHQPLGVEV-UHFFFAOYSA-N 1 2 232.262 2.240 20 0 BEADLO Cc1[nH+]cnc(N2CC[C@H]3CSC[C@H]3C2)c1C ZINC000882697855 591413248 /nfs/dbraw/zinc/41/32/48/591413248.db2.gz HEIQVPRJMKHGDP-NWDGAFQWSA-N 1 2 249.383 2.283 20 0 BEADLO CC[C@@H](C[C@@H](C)O)Nc1nc[nH+]c(C)c1C ZINC000882708241 591415647 /nfs/dbraw/zinc/41/56/47/591415647.db2.gz WKDHUVVTJQUAQZ-KCJUWKMLSA-N 1 2 223.320 2.055 20 0 BEADLO Fc1c[nH+]ccc1NC[C@@H]1C[C@@H]2CCC[C@@H]2O1 ZINC000882715498 591419567 /nfs/dbraw/zinc/41/95/67/591419567.db2.gz DXDFXZJVRVETBG-KWBADKCTSA-N 1 2 236.290 2.012 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2CC23CCC3)c1C ZINC000882720526 591420215 /nfs/dbraw/zinc/42/02/15/591420215.db2.gz ZTRWSGBJLXFWNY-SNVBAGLBSA-N 1 2 203.289 2.448 20 0 BEADLO CCC[C@H](C)CCNc1nc(C)[nH+]c(N)n1 ZINC000882777850 591436975 /nfs/dbraw/zinc/43/69/75/591436975.db2.gz UIADMJGVOLRCDK-QMMMGPOBSA-N 1 2 223.324 2.000 20 0 BEADLO CCC[C@H](C)CCNc1nc(N)nc(C)[nH+]1 ZINC000882777850 591436980 /nfs/dbraw/zinc/43/69/80/591436980.db2.gz UIADMJGVOLRCDK-QMMMGPOBSA-N 1 2 223.324 2.000 20 0 BEADLO CO[C@H]1C[C@H](CNc2cc(C)[nH+]c(C3CC3)n2)C1 ZINC000882798564 591442618 /nfs/dbraw/zinc/44/26/18/591442618.db2.gz SLDRQNLCXYKDHM-UMSPYCQHSA-N 1 2 247.342 2.499 20 0 BEADLO Cc1[nH+]cnc(N2CCC(F)CC2)c1C ZINC000882804176 591444798 /nfs/dbraw/zinc/44/47/98/591444798.db2.gz VTPKADAHTOJCDV-UHFFFAOYSA-N 1 2 209.268 2.032 20 0 BEADLO COC[C@H]1C[C@@H](Nc2cc[nH+]c(C(C)C)n2)C1 ZINC000882905953 591472429 /nfs/dbraw/zinc/47/24/29/591472429.db2.gz BCWNXKWWQMBPQS-PHIMTYICSA-N 1 2 235.331 2.437 20 0 BEADLO C=C/C=C/CCO[NH+]=C(N)COC(C)C ZINC000882960878 591486769 /nfs/dbraw/zinc/48/67/69/591486769.db2.gz YKESWYKLLLPLFO-AATRIKPKSA-N 1 2 212.293 2.042 20 0 BEADLO CC(C)c1c[nH]c(C[NH2+][C@@H](C)c2cn[nH]c2)n1 ZINC000883076860 591535666 /nfs/dbraw/zinc/53/56/66/591535666.db2.gz PJYAWOVMIWVQSA-VIFPVBQESA-N 1 2 233.319 2.107 20 0 BEADLO CC(C)c1c[nH]c(CNc2cnccc2CO)[nH+]1 ZINC000883073227 591535695 /nfs/dbraw/zinc/53/56/95/591535695.db2.gz KFORYDUEVDFYAO-UHFFFAOYSA-N 1 2 246.314 2.033 20 0 BEADLO CC(C)c1c[nH]c(CNC2(C(F)F)CC2)[nH+]1 ZINC000883112473 591541760 /nfs/dbraw/zinc/54/17/60/591541760.db2.gz NFYLWQROUWTEED-UHFFFAOYSA-N 1 2 229.274 2.420 20 0 BEADLO C[C@H](O)c1ccc(-c2[nH+]ccn2C)cc1 ZINC000214362432 591554291 /nfs/dbraw/zinc/55/42/91/591554291.db2.gz ZFTMXARSZXZHGT-VIFPVBQESA-N 1 2 202.257 2.140 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1cccc(F)n1 ZINC000131269871 591580634 /nfs/dbraw/zinc/58/06/34/591580634.db2.gz YTEKAHPJCZIUAU-UHFFFAOYSA-N 1 2 231.230 2.176 20 0 BEADLO Cc1cc(N[C@H]2CCO[C@@H]2C)c[nH+]c1C ZINC000883341251 591620240 /nfs/dbraw/zinc/62/02/40/591620240.db2.gz LGHDVWIHLSHIMD-PWSUYJOCSA-N 1 2 206.289 2.288 20 0 BEADLO Cc1cc(NCc2cnccn2)c[nH+]c1C ZINC000883341119 591620343 /nfs/dbraw/zinc/62/03/43/591620343.db2.gz ITHGVHUSWDDFKV-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO Cc1nnsc1CNc1c[nH+]c(C)c(C)c1 ZINC000883341262 591620543 /nfs/dbraw/zinc/62/05/43/591620543.db2.gz LQBCUEXFURPNGT-UHFFFAOYSA-N 1 2 234.328 2.470 20 0 BEADLO Cc1nn(C)cc1CNc1c[nH+]c(C)c(C)c1 ZINC000883341192 591620563 /nfs/dbraw/zinc/62/05/63/591620563.db2.gz KICSBPFIFATTBW-UHFFFAOYSA-N 1 2 230.315 2.352 20 0 BEADLO Cc1cc(N[C@@H]2CCO[C@@H]2C)c[nH+]c1C ZINC000883341252 591620751 /nfs/dbraw/zinc/62/07/51/591620751.db2.gz LGHDVWIHLSHIMD-ZYHUDNBSSA-N 1 2 206.289 2.288 20 0 BEADLO Cc1cc(NCc2ncnn2C(C)C)c[nH+]c1C ZINC000883341377 591620871 /nfs/dbraw/zinc/62/08/71/591620871.db2.gz OVCLPBGMTGALQJ-UHFFFAOYSA-N 1 2 245.330 2.483 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@H]1CCC2(CCC2)O1 ZINC000883356114 591627131 /nfs/dbraw/zinc/62/71/31/591627131.db2.gz GAYWIELZOKGCAL-CMPLNLGQSA-N 1 2 249.358 2.470 20 0 BEADLO CCC[C@H]1C[N@H+](C/C=C/Cl)CCO1 ZINC000131723949 591649712 /nfs/dbraw/zinc/64/97/12/591649712.db2.gz RHHHWYIFSBWWBN-GFAPAMAISA-N 1 2 203.713 2.240 20 0 BEADLO CCC[C@H]1C[N@@H+](C/C=C/Cl)CCO1 ZINC000131723949 591649713 /nfs/dbraw/zinc/64/97/13/591649713.db2.gz RHHHWYIFSBWWBN-GFAPAMAISA-N 1 2 203.713 2.240 20 0 BEADLO Cc1nc(F)ccc1C[NH2+][C@H](C)C(F)F ZINC000883407077 591651781 /nfs/dbraw/zinc/65/17/81/591651781.db2.gz KHSQXUKRVXXIBK-SSDOTTSWSA-N 1 2 218.222 2.272 20 0 BEADLO C[C@@H]([NH2+]Cc1ccc2oc(=O)oc2c1)C(F)F ZINC000883407721 591651895 /nfs/dbraw/zinc/65/18/95/591651895.db2.gz DBVRVMKEARIZHC-ZCFIWIBFSA-N 1 2 243.209 2.129 20 0 BEADLO CCCNc1cc(NCCCCOC)nc[nH+]1 ZINC000131988667 591682093 /nfs/dbraw/zinc/68/20/93/591682093.db2.gz JMWOEFMMCPXOQW-UHFFFAOYSA-N 1 2 238.335 2.137 20 0 BEADLO CCCNc1cc(NCCCCOC)[nH+]cn1 ZINC000131988667 591682097 /nfs/dbraw/zinc/68/20/97/591682097.db2.gz JMWOEFMMCPXOQW-UHFFFAOYSA-N 1 2 238.335 2.137 20 0 BEADLO COc1ccc([NH2+]CC[C@H](C)O)c(C)c1 ZINC000133616288 591842560 /nfs/dbraw/zinc/84/25/60/591842560.db2.gz RLFQNIDRPMCDNF-JTQLQIEISA-N 1 2 209.289 2.186 20 0 BEADLO Cn1cc[nH+]c1-c1ccc(C(C)(C)O)cc1 ZINC000215437211 591947286 /nfs/dbraw/zinc/94/72/86/591947286.db2.gz XXODMFODPWATHI-UHFFFAOYSA-N 1 2 216.284 2.315 20 0 BEADLO CCc1nc(N[C@@H]2CSC[C@H]2C)cc[nH+]1 ZINC000884505287 591959572 /nfs/dbraw/zinc/95/95/72/591959572.db2.gz CWLUHWKBABYEQN-RKDXNWHRSA-N 1 2 223.345 2.202 20 0 BEADLO CCc1nc(NCC(C)(C)COC)cc[nH+]1 ZINC000884513566 591962063 /nfs/dbraw/zinc/96/20/63/591962063.db2.gz LXFKZXCSINJLBE-UHFFFAOYSA-N 1 2 223.320 2.124 20 0 BEADLO CCc1nc(N2CCCO[C@H](C(C)C)C2)cc[nH+]1 ZINC000884517185 591963862 /nfs/dbraw/zinc/96/38/62/591963862.db2.gz GXJZMJFEFDXQCI-LBPRGKRZSA-N 1 2 249.358 2.290 20 0 BEADLO CCc1nc(NCCC(C)(F)F)cc[nH+]1 ZINC000884517015 591964095 /nfs/dbraw/zinc/96/40/95/591964095.db2.gz AQCPNTNZRZYIEI-UHFFFAOYSA-N 1 2 215.247 2.496 20 0 BEADLO CCc1nc(N2CC[C@@H](OC)C(C)(C)C2)cc[nH+]1 ZINC000884521198 591964758 /nfs/dbraw/zinc/96/47/58/591964758.db2.gz PYWFIWLDYWAKMU-LLVKDONJSA-N 1 2 249.358 2.290 20 0 BEADLO CCc1nc(NC[C@](C)(CC)OC)cc[nH+]1 ZINC000884521469 591965162 /nfs/dbraw/zinc/96/51/62/591965162.db2.gz XWEUCVZMFWMRSF-LBPRGKRZSA-N 1 2 223.320 2.266 20 0 BEADLO CCc1nc(NC[C@H]2CC[C@H](C)O2)cc[nH+]1 ZINC000884527010 591966500 /nfs/dbraw/zinc/96/65/00/591966500.db2.gz HVCFJIHIHIHLQC-VHSXEESVSA-N 1 2 221.304 2.018 20 0 BEADLO CCc1nc(N[C@H]2C[C@@H](OC(C)C)C2)cc[nH+]1 ZINC000884527155 591966774 /nfs/dbraw/zinc/96/67/74/591966774.db2.gz KIUGIEHIJDZMBX-PHIMTYICSA-N 1 2 235.331 2.407 20 0 BEADLO CCc1nc(NC[C@@H]2CC[C@H](C)O2)cc[nH+]1 ZINC000884527009 591967095 /nfs/dbraw/zinc/96/70/95/591967095.db2.gz HVCFJIHIHIHLQC-UWVGGRQHSA-N 1 2 221.304 2.018 20 0 BEADLO CCOC[C@@H]1CCCCN1c1cc[nH+]c(CC)n1 ZINC000884528544 591967952 /nfs/dbraw/zinc/96/79/52/591967952.db2.gz RZZPVRXAOGABGQ-LBPRGKRZSA-N 1 2 249.358 2.434 20 0 BEADLO CCc1nc(NC[C@@H]2C[C@H](C)O[C@H]2C)cc[nH+]1 ZINC000884530228 591968546 /nfs/dbraw/zinc/96/85/46/591968546.db2.gz HVRAIKJZYWATCR-DCAQKATOSA-N 1 2 235.331 2.264 20 0 BEADLO CCc1nc(N[C@H](C)c2nccc(C)n2)cc[nH+]1 ZINC000884533574 591969682 /nfs/dbraw/zinc/96/96/82/591969682.db2.gz LXSSECCNHROLOA-SNVBAGLBSA-N 1 2 243.314 2.311 20 0 BEADLO CCc1nc(N2CC(C)(C)OC[C@@H]2CC)cc[nH+]1 ZINC000884544979 591974040 /nfs/dbraw/zinc/97/40/40/591974040.db2.gz VVWFLTCFLSBZGG-NSHDSACASA-N 1 2 249.358 2.433 20 0 BEADLO CCc1nc(N2C[C@@H](CC)OC[C@H]2CC)cc[nH+]1 ZINC000884545160 591974531 /nfs/dbraw/zinc/97/45/31/591974531.db2.gz ZTKMWMKQKQGLEQ-VXGBXAGGSA-N 1 2 249.358 2.433 20 0 BEADLO CCc1nc(N[C@@H]2COC(C)(C)C2)cc[nH+]1 ZINC000884552033 591976168 /nfs/dbraw/zinc/97/61/68/591976168.db2.gz PFHKNUWLGNQKFS-VIFPVBQESA-N 1 2 221.304 2.018 20 0 BEADLO CCc1nc(N[C@H](CO)CCC(C)C)cc[nH+]1 ZINC000884564272 591982372 /nfs/dbraw/zinc/98/23/72/591982372.db2.gz BMHFBJABTFZLGE-NSHDSACASA-N 1 2 237.347 2.248 20 0 BEADLO CCc1nc(N2CCC(SC)CC2)cc[nH+]1 ZINC000884569132 591983245 /nfs/dbraw/zinc/98/32/45/591983245.db2.gz DHBNHUCJWRJDOC-UHFFFAOYSA-N 1 2 237.372 2.371 20 0 BEADLO CCc1nc(N2C[C@@H](OC)CC[C@H]2C)cc[nH+]1 ZINC000884571023 591984557 /nfs/dbraw/zinc/98/45/57/591984557.db2.gz FJROHGYONPDMBA-MNOVXSKESA-N 1 2 235.331 2.043 20 0 BEADLO CCc1nc(N[C@@H]2CCCn3nccc32)cc[nH+]1 ZINC000884576052 591984926 /nfs/dbraw/zinc/98/49/26/591984926.db2.gz YTAOMPHMYRDKAT-SNVBAGLBSA-N 1 2 243.314 2.183 20 0 BEADLO CCc1nc(N[C@@H](CC)C[C@@H](C)O)cc[nH+]1 ZINC000884575929 591985319 /nfs/dbraw/zinc/98/53/19/591985319.db2.gz WDRALJXMHAESJL-ZJUUUORDSA-N 1 2 223.320 2.000 20 0 BEADLO CCc1nc(N[C@H](C)c2nccnc2C)cc[nH+]1 ZINC000884579673 591986498 /nfs/dbraw/zinc/98/64/98/591986498.db2.gz GHNGWUSKFVGDLA-SNVBAGLBSA-N 1 2 243.314 2.311 20 0 BEADLO Cc1nc(NCc2cc(C3CC3)no2)cc[nH+]1 ZINC000884638216 591999235 /nfs/dbraw/zinc/99/92/35/591999235.db2.gz PJXDNKMNDOLQPH-UHFFFAOYSA-N 1 2 230.271 2.263 20 0 BEADLO c1ccc2[nH+]c(N3C[C@@H]4CSC[C@@H]4C3)[nH]c2c1 ZINC000884646635 592001587 /nfs/dbraw/zinc/00/15/87/592001587.db2.gz ZPDYSASRPSXCJG-AOOOYVTPSA-N 1 2 245.351 2.362 20 0 BEADLO Fc1c[nH+]ccc1NC[C@@H]1CC2(CCC2)CO1 ZINC000884661535 592007038 /nfs/dbraw/zinc/00/70/38/592007038.db2.gz UIKQSVCPLPLOQB-JTQLQIEISA-N 1 2 236.290 2.014 20 0 BEADLO COc1ccc[nH+]c1N1CC[C@H]([C@H]2CCCO2)C1 ZINC000884742667 592016577 /nfs/dbraw/zinc/01/65/77/592016577.db2.gz UMSQYHNGJXZAAO-NWDGAFQWSA-N 1 2 248.326 2.096 20 0 BEADLO CCc1nc(N2CC[C@H]([C@@H]3CCCO3)C2)cc[nH+]1 ZINC000884751613 592017481 /nfs/dbraw/zinc/01/74/81/592017481.db2.gz MZMHMFUXXZDGBK-RYUDHWBXSA-N 1 2 247.342 2.044 20 0 BEADLO C[C@@H](CC(=O)NC[C@]12C[C@H]1CCC2)n1cc[nH+]c1 ZINC000885991722 592123265 /nfs/dbraw/zinc/12/32/65/592123265.db2.gz QYBDUFDAQDEZSS-SCRDCRAPSA-N 1 2 247.342 2.141 20 0 BEADLO COc1cccnc1C[NH2+]Cc1cc(C)co1 ZINC000886138595 592161611 /nfs/dbraw/zinc/16/16/11/592161611.db2.gz OKAPKTDBNVWDKW-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO OC[C@H]1CC(F)(F)C[N@@H+]1CC[C@@H]1C[C@H]1C1CC1 ZINC000886157645 592165673 /nfs/dbraw/zinc/16/56/73/592165673.db2.gz HMUQFGGIFQKGIL-UTUOFQBUSA-N 1 2 245.313 2.125 20 0 BEADLO OC[C@H]1CC(F)(F)C[N@H+]1CC[C@@H]1C[C@H]1C1CC1 ZINC000886157645 592165675 /nfs/dbraw/zinc/16/56/75/592165675.db2.gz HMUQFGGIFQKGIL-UTUOFQBUSA-N 1 2 245.313 2.125 20 0 BEADLO c1cnc2c(c1)C[N@@H+](C[C@H]1CC[C@@H](C3CC3)O1)C2 ZINC000886186214 592172859 /nfs/dbraw/zinc/17/28/59/592172859.db2.gz SCYRIOGXHXLMQY-HIFRSBDPSA-N 1 2 244.338 2.355 20 0 BEADLO c1cnc2c(c1)C[N@H+](C[C@H]1CC[C@@H](C3CC3)O1)C2 ZINC000886186214 592172862 /nfs/dbraw/zinc/17/28/62/592172862.db2.gz SCYRIOGXHXLMQY-HIFRSBDPSA-N 1 2 244.338 2.355 20 0 BEADLO C[C@H](O)C[N@H+](CC[C@@H]1C[C@H]1C1CC1)CC(F)F ZINC000886236778 592182219 /nfs/dbraw/zinc/18/22/19/592182219.db2.gz OQCBWLFHGGMPAC-WCQGTBRESA-N 1 2 247.329 2.371 20 0 BEADLO C[C@H](O)C[N@@H+](CC[C@@H]1C[C@H]1C1CC1)CC(F)F ZINC000886236778 592182222 /nfs/dbraw/zinc/18/22/22/592182222.db2.gz OQCBWLFHGGMPAC-WCQGTBRESA-N 1 2 247.329 2.371 20 0 BEADLO C[C@H]([NH2+]Cc1cccc2c1OCO2)c1ncco1 ZINC000886274099 592193709 /nfs/dbraw/zinc/19/37/09/592193709.db2.gz MKXYHADCSQTNKI-VIFPVBQESA-N 1 2 246.266 2.254 20 0 BEADLO COc1cccc(NCc2c[nH+]cn2C)c1OC ZINC000886275705 592195433 /nfs/dbraw/zinc/19/54/33/592195433.db2.gz JJMCRWUCUSHZDR-UHFFFAOYSA-N 1 2 247.298 2.049 20 0 BEADLO Cc1cn[nH]c1C[NH+]1CCC2(CCCC2=O)CC1 ZINC000886283891 592199860 /nfs/dbraw/zinc/19/98/60/592199860.db2.gz JVINBCPBNAVAAA-UHFFFAOYSA-N 1 2 247.342 2.053 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1cccnc1)c1ncco1 ZINC000886530012 592248034 /nfs/dbraw/zinc/24/80/34/592248034.db2.gz BJIWYNQLUIFOPL-UWVGGRQHSA-N 1 2 217.272 2.481 20 0 BEADLO CCc1noc(C)c1C[NH2+][C@@H](C)c1ncco1 ZINC000886533221 592248821 /nfs/dbraw/zinc/24/88/21/592248821.db2.gz XAXOKASLVFLHQH-QMMMGPOBSA-N 1 2 235.287 2.384 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccccn1)c1ncco1 ZINC000886536229 592250509 /nfs/dbraw/zinc/25/05/09/592250509.db2.gz DHJYFWDNCOCPLL-VHSXEESVSA-N 1 2 217.272 2.481 20 0 BEADLO COC(=O)[C@@H]1CC[C@@H](Nc2c[nH+]cc(C)c2)C1 ZINC000886577902 592266708 /nfs/dbraw/zinc/26/67/08/592266708.db2.gz BIYUMNINFNDECX-GHMZBOCLSA-N 1 2 234.299 2.144 20 0 BEADLO CCn1c[nH+]c2c1CCN(C(=O)[C@H](C)C(C)C)C2 ZINC000886621214 592276899 /nfs/dbraw/zinc/27/68/99/592276899.db2.gz FRPPYCKKCNJRIO-LLVKDONJSA-N 1 2 249.358 2.080 20 0 BEADLO CC/C=C(\C)C(=O)N1CCc2c([nH+]cn2CC)C1 ZINC000886622853 592279843 /nfs/dbraw/zinc/27/98/43/592279843.db2.gz IJSFKONAFIBPQF-IZZDOVSWSA-N 1 2 247.342 2.144 20 0 BEADLO Cn1c[nH+]cc1CN(CC(F)F)C1CCC1 ZINC000887100813 592441465 /nfs/dbraw/zinc/44/14/65/592441465.db2.gz RZVVKOSIWQTMOK-UHFFFAOYSA-N 1 2 229.274 2.040 20 0 BEADLO FC(F)COCC[N@@H+](CC(F)F)C1CCC1 ZINC000887102235 592442877 /nfs/dbraw/zinc/44/28/77/592442877.db2.gz IEOCVGDFYSEIFM-UHFFFAOYSA-N 1 2 243.244 2.388 20 0 BEADLO FC(F)COCC[N@H+](CC(F)F)C1CCC1 ZINC000887102235 592442872 /nfs/dbraw/zinc/44/28/72/592442872.db2.gz IEOCVGDFYSEIFM-UHFFFAOYSA-N 1 2 243.244 2.388 20 0 BEADLO OC1(CC[N@H+](CC(F)F)C2CCC2)CCC1 ZINC000887102564 592442996 /nfs/dbraw/zinc/44/29/96/592442996.db2.gz URBJMBZCNJIAIK-UHFFFAOYSA-N 1 2 233.302 2.411 20 0 BEADLO OC1(CC[N@@H+](CC(F)F)C2CCC2)CCC1 ZINC000887102564 592443000 /nfs/dbraw/zinc/44/30/00/592443000.db2.gz URBJMBZCNJIAIK-UHFFFAOYSA-N 1 2 233.302 2.411 20 0 BEADLO C[C@H](c1nc(C2CC2)no1)[N@H+](C)CCCF ZINC000887137855 592452661 /nfs/dbraw/zinc/45/26/61/592452661.db2.gz VWVLSZJMLJWYKX-MRVPVSSYSA-N 1 2 227.283 2.299 20 0 BEADLO C[C@H](c1nc(C2CC2)no1)[N@@H+](C)CCCF ZINC000887137855 592452665 /nfs/dbraw/zinc/45/26/65/592452665.db2.gz VWVLSZJMLJWYKX-MRVPVSSYSA-N 1 2 227.283 2.299 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC1CCC=CCC1 ZINC000887934069 592560561 /nfs/dbraw/zinc/56/05/61/592560561.db2.gz QHRSEXXRJNXGTM-UHFFFAOYSA-N 1 2 245.326 2.432 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2C[C@H](C)CO2)c(C)[nH+]1 ZINC000889464239 592612858 /nfs/dbraw/zinc/61/28/58/592612858.db2.gz DOLNZBBBLFIGQO-QPUJVOFHSA-N 1 2 234.299 2.062 20 0 BEADLO C[C@H](CC(=O)N[C@@H]1C[C@@H]2CCC[C@@H]12)n1cc[nH+]c1 ZINC000889613350 592629780 /nfs/dbraw/zinc/62/97/80/592629780.db2.gz YSXCZWGAVKISDX-YVECIDJPSA-N 1 2 247.342 2.139 20 0 BEADLO Cn1c[nH+]c(CNC(=O)[C@@H]2CCCC3(CC3)C2)c1 ZINC000890103654 592680241 /nfs/dbraw/zinc/68/02/41/592680241.db2.gz OFNCQWNRQDISBB-LLVKDONJSA-N 1 2 247.342 2.007 20 0 BEADLO CC[C@H]1CCCC[C@H]1C(=O)NCc1cn(C)c[nH+]1 ZINC000890106486 592681031 /nfs/dbraw/zinc/68/10/31/592681031.db2.gz ALDPPCQIXNNVSS-WCQYABFASA-N 1 2 249.358 2.253 20 0 BEADLO CC(F)(F)C[NH2+][C@@H]1CCc2cccnc21 ZINC000829299906 592707885 /nfs/dbraw/zinc/70/78/85/592707885.db2.gz LWIURTZUCSDUOZ-SECBINFHSA-N 1 2 212.243 2.314 20 0 BEADLO CC(C)CC[C@@H](C)[NH+]1CC(O)(C(F)(F)F)C1 ZINC001256366973 987180995 /nfs/dbraw/zinc/18/09/95/987180995.db2.gz UQKKWJLKGSCARW-SECBINFHSA-N 1 2 239.281 2.420 20 0 BEADLO CCc1cc(NC[C@H](C)OC)nc(CC)[nH+]1 ZINC000893396184 634400426 /nfs/dbraw/zinc/40/04/26/634400426.db2.gz CZHCVMISUCBTPZ-VIFPVBQESA-N 1 2 223.320 2.048 20 0 BEADLO CCc1ncc(C[N@H+]2Cc3c[nH]nc3[C@@H](C)C2)o1 ZINC000931467707 634466148 /nfs/dbraw/zinc/46/61/48/634466148.db2.gz QPTKBVKKTXNNAR-VIFPVBQESA-N 1 2 246.314 2.079 20 0 BEADLO CCc1ncc(C[N@@H+]2Cc3c[nH]nc3[C@@H](C)C2)o1 ZINC000931467707 634466153 /nfs/dbraw/zinc/46/61/53/634466153.db2.gz QPTKBVKKTXNNAR-VIFPVBQESA-N 1 2 246.314 2.079 20 0 BEADLO CCc1c[nH]c2nc[nH+]c(S[C@H]3CCOC3)c12 ZINC000893471547 634518546 /nfs/dbraw/zinc/51/85/46/634518546.db2.gz GZDDBKXSCCKYGJ-VIFPVBQESA-N 1 2 249.339 2.401 20 0 BEADLO Nc1ccc(CNC(=O)C2CCCCCC2)c[nH+]1 ZINC000308375206 631311510 /nfs/dbraw/zinc/31/15/10/631311510.db2.gz KGWMNBDTVAMJJC-UHFFFAOYSA-N 1 2 247.342 2.250 20 0 BEADLO C[C@@H]1COCC[N@@H+]1Cc1nccc2c1CCCC2 ZINC000891696690 631453568 /nfs/dbraw/zinc/45/35/68/631453568.db2.gz WCPKPANCZMUFAW-GFCCVEGCSA-N 1 2 246.354 2.181 20 0 BEADLO C[C@@H]1COCC[N@H+]1Cc1nccc2c1CCCC2 ZINC000891696690 631453576 /nfs/dbraw/zinc/45/35/76/631453576.db2.gz WCPKPANCZMUFAW-GFCCVEGCSA-N 1 2 246.354 2.181 20 0 BEADLO CNc1cc(NC2Cc3ccccc3C2)nc[nH+]1 ZINC000234528092 631568738 /nfs/dbraw/zinc/56/87/38/631568738.db2.gz ZVTDCYZCQDSBMK-UHFFFAOYSA-N 1 2 240.310 2.098 20 0 BEADLO CNc1cc(NC2Cc3ccccc3C2)[nH+]cn1 ZINC000234528092 631568744 /nfs/dbraw/zinc/56/87/44/631568744.db2.gz ZVTDCYZCQDSBMK-UHFFFAOYSA-N 1 2 240.310 2.098 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C[C@@H]1CC=CCC1 ZINC000933990057 631578373 /nfs/dbraw/zinc/57/83/73/631578373.db2.gz AASNGTSNDYBYPL-LLVKDONJSA-N 1 2 233.315 2.081 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C[C@H]1CC=CCC1 ZINC000933990058 631578987 /nfs/dbraw/zinc/57/89/87/631578987.db2.gz AASNGTSNDYBYPL-NSHDSACASA-N 1 2 233.315 2.081 20 0 BEADLO OC[C@@H]1CC[N@@H+]1Cc1cccc(Cl)c1F ZINC000934014763 631586552 /nfs/dbraw/zinc/58/65/52/631586552.db2.gz OSMAADJSPKMXFI-VIFPVBQESA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@@H]1CC[N@H+]1Cc1cccc(Cl)c1F ZINC000934014763 631586556 /nfs/dbraw/zinc/58/65/56/631586556.db2.gz OSMAADJSPKMXFI-VIFPVBQESA-N 1 2 229.682 2.046 20 0 BEADLO C[C@@H](c1c(F)cccc1F)[N@@H+]1CC[C@H]1CO ZINC000934024771 631596983 /nfs/dbraw/zinc/59/69/83/631596983.db2.gz ABLNJBSVTNJYBT-IUCAKERBSA-N 1 2 227.254 2.092 20 0 BEADLO C[C@@H](c1c(F)cccc1F)[N@H+]1CC[C@H]1CO ZINC000934024771 631596988 /nfs/dbraw/zinc/59/69/88/631596988.db2.gz ABLNJBSVTNJYBT-IUCAKERBSA-N 1 2 227.254 2.092 20 0 BEADLO OC[C@H]1CC[N@@H+]1Cc1ccc(Cl)c(F)c1 ZINC000934015366 631608697 /nfs/dbraw/zinc/60/86/97/631608697.db2.gz WQZSGGRRRDFEDN-SECBINFHSA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@H]1CC[N@H+]1Cc1ccc(Cl)c(F)c1 ZINC000934015366 631608700 /nfs/dbraw/zinc/60/87/00/631608700.db2.gz WQZSGGRRRDFEDN-SECBINFHSA-N 1 2 229.682 2.046 20 0 BEADLO CC1CC(NC(=O)c2cc3c[nH+]ccc3[nH]2)C1 ZINC000934023384 631624088 /nfs/dbraw/zinc/62/40/88/631624088.db2.gz HEOBUWXYIBAFKK-UHFFFAOYSA-N 1 2 229.283 2.091 20 0 BEADLO C[C@]1(C(=O)OCCCn2cc[nH+]c2)C=CCC1 ZINC000924408066 631742774 /nfs/dbraw/zinc/74/27/74/631742774.db2.gz NJTGUOGFKLIJDB-ZDUSSCGKSA-N 1 2 234.299 2.173 20 0 BEADLO C[C@@H]([NH2+][C@H]1CC[C@H]1C)C(=O)OC(C)(C)C ZINC000309087009 631875213 /nfs/dbraw/zinc/87/52/13/631875213.db2.gz YZDVNJGAMRPDCC-BBBLOLIVSA-N 1 2 213.321 2.105 20 0 BEADLO C[C@H](c1cccc(F)c1)[N@@H+]1CC[C@H](O)[C@H](F)C1 ZINC000934579096 631950955 /nfs/dbraw/zinc/95/09/55/631950955.db2.gz GRXQJDFPNWQPOX-WQAKAFBOSA-N 1 2 241.281 2.291 20 0 BEADLO C[C@H](c1cccc(F)c1)[N@H+]1CC[C@H](O)[C@H](F)C1 ZINC000934579096 631950961 /nfs/dbraw/zinc/95/09/61/631950961.db2.gz GRXQJDFPNWQPOX-WQAKAFBOSA-N 1 2 241.281 2.291 20 0 BEADLO C/C=C(/CC)C(=O)OCc1cc[nH+]c(N)c1 ZINC000309344867 632006854 /nfs/dbraw/zinc/00/68/54/632006854.db2.gz LXOABFSQPZRTKU-KMKOMSMNSA-N 1 2 220.272 2.063 20 0 BEADLO Cn1cccc1C[NH2+]Cc1ncc(Cl)s1 ZINC000308874427 632045700 /nfs/dbraw/zinc/04/57/00/632045700.db2.gz MPQOTWONAZIATC-UHFFFAOYSA-N 1 2 241.747 2.425 20 0 BEADLO FCC[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000309516815 632435683 /nfs/dbraw/zinc/43/56/83/632435683.db2.gz RVUIMHHACQLZNZ-UHFFFAOYSA-N 1 2 220.247 2.401 20 0 BEADLO C[C@@H](O)C[NH2+][C@@H](C)C(F)(F)c1ccccc1 ZINC000924528270 632696158 /nfs/dbraw/zinc/69/61/58/632696158.db2.gz MSCHEGIIQTYKSY-ZJUUUORDSA-N 1 2 229.270 2.137 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2CO[C@H](C)[C@H]2C)c1 ZINC000926663752 632791311 /nfs/dbraw/zinc/79/13/11/632791311.db2.gz XIEIDXZFRIARMO-CKYFFXLPSA-N 1 2 236.315 2.063 20 0 BEADLO CCC/C=C/C(=O)OCc1cc[nH+]c(N)c1 ZINC000309277288 632878049 /nfs/dbraw/zinc/87/80/49/632878049.db2.gz MKIPJFFRIFVZIZ-SNAWJCMRSA-N 1 2 220.272 2.063 20 0 BEADLO CC[C@@H]1C[C@H]1NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000935791464 633011654 /nfs/dbraw/zinc/01/16/54/633011654.db2.gz QDYSUHALEOMCBX-LDYMZIIASA-N 1 2 229.283 2.091 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCCC[C@@H]1F)c1cc(CO)on1 ZINC000926786269 633064696 /nfs/dbraw/zinc/06/46/96/633064696.db2.gz QDYKPAIYQHLWIR-DVVUODLYSA-N 1 2 242.294 2.098 20 0 BEADLO C[N@H+](Cc1cccnc1)Cc1ccc(Cl)nn1 ZINC000167228748 633127035 /nfs/dbraw/zinc/12/70/35/633127035.db2.gz UNLMRXHFOLFQDN-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[N@@H+](Cc1cccnc1)Cc1ccc(Cl)nn1 ZINC000167228748 633127039 /nfs/dbraw/zinc/12/70/39/633127039.db2.gz UNLMRXHFOLFQDN-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO CC[N@H+](C)Cc1occc1Br ZINC000306783305 635975381 /nfs/dbraw/zinc/97/53/81/635975381.db2.gz GJEKDWHHKOVGJV-UHFFFAOYSA-N 1 2 218.094 2.494 20 0 BEADLO CC[N@@H+](C)Cc1occc1Br ZINC000306783305 635975386 /nfs/dbraw/zinc/97/53/86/635975386.db2.gz GJEKDWHHKOVGJV-UHFFFAOYSA-N 1 2 218.094 2.494 20 0 BEADLO C[C@@H]1[C@H](O)CCC[N@@H+]1C/C(Cl)=C/Cl ZINC000307327749 635986297 /nfs/dbraw/zinc/98/62/97/635986297.db2.gz JQCVFKDFEPSIIH-HMDQVIMHSA-N 1 2 224.131 2.151 20 0 BEADLO C[C@@H]1[C@H](O)CCC[N@H+]1C/C(Cl)=C/Cl ZINC000307327749 635986303 /nfs/dbraw/zinc/98/63/03/635986303.db2.gz JQCVFKDFEPSIIH-HMDQVIMHSA-N 1 2 224.131 2.151 20 0 BEADLO CCc1cc(NCC[C@H](O)CC)nc(CC)[nH+]1 ZINC000892936650 633738660 /nfs/dbraw/zinc/73/86/60/633738660.db2.gz JSVSUNNKSQRCIS-LLVKDONJSA-N 1 2 237.347 2.174 20 0 BEADLO Cc1c(Cl)c(C[N@@H+]2CC[C@H](CF)C2)nn1C ZINC000895567787 636157977 /nfs/dbraw/zinc/15/79/77/636157977.db2.gz KUQYGILGYGUSOS-SECBINFHSA-N 1 2 245.729 2.173 20 0 BEADLO Cc1c(Cl)c(C[N@H+]2CC[C@H](CF)C2)nn1C ZINC000895567787 636157993 /nfs/dbraw/zinc/15/79/93/636157993.db2.gz KUQYGILGYGUSOS-SECBINFHSA-N 1 2 245.729 2.173 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC[C@@H](c2nccs2)C1 ZINC000895581424 636163512 /nfs/dbraw/zinc/16/35/12/636163512.db2.gz AELGELVEYMOPKA-SNVBAGLBSA-N 1 2 248.355 2.164 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000895581424 636163515 /nfs/dbraw/zinc/16/35/15/636163515.db2.gz AELGELVEYMOPKA-SNVBAGLBSA-N 1 2 248.355 2.164 20 0 BEADLO Cc1ncc(C[N@H+]2CCC[C@@H]2c2ccnn2C)o1 ZINC000932264183 635629023 /nfs/dbraw/zinc/62/90/23/635629023.db2.gz WEYYRZMGJGIDTE-CYBMUJFWSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1ncc(C[N@@H+]2CCC[C@@H]2c2ccnn2C)o1 ZINC000932264183 635629030 /nfs/dbraw/zinc/62/90/30/635629030.db2.gz WEYYRZMGJGIDTE-CYBMUJFWSA-N 1 2 246.314 2.054 20 0 BEADLO C[C@@H]1CN(c2cc(N(C)C)[nH+]cn2)[C@@H](C)[C@H]1C ZINC000894235692 635762741 /nfs/dbraw/zinc/76/27/41/635762741.db2.gz OXIOWVXDTXYFRK-VWYCJHECSA-N 1 2 234.347 2.023 20 0 BEADLO C[C@@H]1CN(c2cc(N(C)C)nc[nH+]2)[C@@H](C)[C@H]1C ZINC000894235692 635762745 /nfs/dbraw/zinc/76/27/45/635762745.db2.gz OXIOWVXDTXYFRK-VWYCJHECSA-N 1 2 234.347 2.023 20 0 BEADLO Cc1cn(C(C)(C)C(=O)NCCCC2CC2)c[nH+]1 ZINC000896454474 636194176 /nfs/dbraw/zinc/19/41/76/636194176.db2.gz RWNTZHIOHOLPCL-UHFFFAOYSA-N 1 2 249.358 2.233 20 0 BEADLO Cc1nc(NCc2cc(C3CC3)nn2C)cc[nH+]1 ZINC000896511016 636196282 /nfs/dbraw/zinc/19/62/82/636196282.db2.gz BRKRAAWSBYTODZ-UHFFFAOYSA-N 1 2 243.314 2.008 20 0 BEADLO C[C@H]1CCCC[C@@]1(C)NC(=O)Cc1c[nH]c[nH+]1 ZINC000909566634 636255427 /nfs/dbraw/zinc/25/54/27/636255427.db2.gz IZHIHPRAZHOSLQ-GXFFZTMASA-N 1 2 235.331 2.037 20 0 BEADLO Cc1c(C[N@H+]2CCO[C@H](C)[C@@H]2C)ccnc1F ZINC000862245742 636617176 /nfs/dbraw/zinc/61/71/76/636617176.db2.gz WIVQGAFMHPDBEL-WDEREUQCSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1c(C[N@@H+]2CCO[C@H](C)[C@@H]2C)ccnc1F ZINC000862245742 636617179 /nfs/dbraw/zinc/61/71/79/636617179.db2.gz WIVQGAFMHPDBEL-WDEREUQCSA-N 1 2 238.306 2.138 20 0 BEADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)C(F)F ZINC000190173016 636618486 /nfs/dbraw/zinc/61/84/86/636618486.db2.gz HOPJHZBVTGMGTH-UHFFFAOYSA-N 1 2 237.209 2.076 20 0 BEADLO CCc1onc(C)c1C[N@@H+]1C[C@H](C)OC[C@H]1C ZINC000929183361 636919525 /nfs/dbraw/zinc/91/95/25/636919525.db2.gz UOVAJKVFCBTFMH-ZJUUUORDSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1onc(C)c1C[N@H+]1C[C@H](C)OC[C@H]1C ZINC000929183361 636919535 /nfs/dbraw/zinc/91/95/35/636919535.db2.gz UOVAJKVFCBTFMH-ZJUUUORDSA-N 1 2 238.331 2.155 20 0 BEADLO CC(C)=C(C)CC(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000898909570 637063647 /nfs/dbraw/zinc/06/36/47/637063647.db2.gz ALLFSQHECMDHBF-UHFFFAOYSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]C1([C@@H]2CCCCO2)CC1 ZINC000927165138 637075666 /nfs/dbraw/zinc/07/56/66/637075666.db2.gz ZSWNCIWJKGXURZ-MFKMUULPSA-N 1 2 249.358 2.470 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]C1([C@H]2CCCCO2)CC1 ZINC000927165140 637076237 /nfs/dbraw/zinc/07/62/37/637076237.db2.gz ZSWNCIWJKGXURZ-ZWNOBZJWSA-N 1 2 249.358 2.470 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@]2(C)CCC[C@@H]2C)[nH+]c1C ZINC000901000040 637224621 /nfs/dbraw/zinc/22/46/21/637224621.db2.gz IRYKDCOSZCIDOY-LKFCYVNXSA-N 1 2 249.358 2.469 20 0 BEADLO CC1(C)CCCC[C@@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000901025985 637227955 /nfs/dbraw/zinc/22/79/55/637227955.db2.gz MAKRRZWTGUGISR-NSHDSACASA-N 1 2 235.331 2.037 20 0 BEADLO CN(C)c1cc(-c2cccc(CCO)c2)cc[nH+]1 ZINC000904850279 637507122 /nfs/dbraw/zinc/50/71/22/637507122.db2.gz UXQWMFCPQPRGHS-UHFFFAOYSA-N 1 2 242.322 2.349 20 0 BEADLO C/C(=C/c1[nH]c(C)c(C)[nH+]1)c1ncccn1 ZINC000905076839 637605703 /nfs/dbraw/zinc/60/57/03/637605703.db2.gz LPCXGSOEHHMNHG-FPLPWBNLSA-N 1 2 214.272 2.377 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2c(c1)OCC2 ZINC000905306072 637764512 /nfs/dbraw/zinc/76/45/12/637764512.db2.gz SGEOGEPFDHHIGR-UHFFFAOYSA-N 1 2 200.241 2.022 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NC[C@]12C[C@H]1CCCC2 ZINC000927439082 637887713 /nfs/dbraw/zinc/88/77/13/637887713.db2.gz YWCFWLFSWJLNAV-RISCZKNCSA-N 1 2 247.342 2.039 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NC[C@]12C[C@H]1CCCC2 ZINC000927439082 637887715 /nfs/dbraw/zinc/88/77/15/637887715.db2.gz YWCFWLFSWJLNAV-RISCZKNCSA-N 1 2 247.342 2.039 20 0 BEADLO CC[C@H](C)[C@@H]([NH2+][C@H]1C[C@H](SC)C1)C(=O)OC ZINC000905776593 637906013 /nfs/dbraw/zinc/90/60/13/637906013.db2.gz GPNWUMVIMAXSLP-XWLWVQCSSA-N 1 2 245.388 2.058 20 0 BEADLO CC[C@@H](C)[C@@H]([NH2+][C@H]1C[C@H](SC)C1)C(=O)OC ZINC000905776590 637906473 /nfs/dbraw/zinc/90/64/73/637906473.db2.gz GPNWUMVIMAXSLP-GWOFURMSSA-N 1 2 245.388 2.058 20 0 BEADLO CC[C@H](C)[C@@H]([NH2+][C@@H]1CCC(F)(F)C1)C(=O)OC ZINC000905768010 637922575 /nfs/dbraw/zinc/92/25/75/637922575.db2.gz POOZETGGQZGBDR-IVZWLZJFSA-N 1 2 249.301 2.352 20 0 BEADLO CC[C@H](C)[C@H]([NH2+]C[C@]1(C)CC1(F)F)C(=O)OC ZINC000905772395 637927433 /nfs/dbraw/zinc/92/74/33/637927433.db2.gz DSNBQVNZTIWSJF-QXEWZRGKSA-N 1 2 249.301 2.209 20 0 BEADLO CCN(C)C(=O)c1c(C)cc(C)[nH+]c1C ZINC000906035800 638027733 /nfs/dbraw/zinc/02/77/33/638027733.db2.gz CWXZKPCNDUIACF-UHFFFAOYSA-N 1 2 206.289 2.099 20 0 BEADLO CCCCNc1cccc(CN2CCOCC2)[nH+]1 ZINC000906529306 638195296 /nfs/dbraw/zinc/19/52/96/638195296.db2.gz LCLPHYJASKKABH-UHFFFAOYSA-N 1 2 249.358 2.126 20 0 BEADLO CC(=O)C[C@@H](C)NC(=O)c1c(C)cc(C)[nH+]c1C ZINC000907102039 638300374 /nfs/dbraw/zinc/30/03/74/638300374.db2.gz QPZBZEWIIMORDL-SNVBAGLBSA-N 1 2 248.326 2.104 20 0 BEADLO C[C@H]1CCCCN(C(=O)CNc2cccc[nH+]2)C1 ZINC000907465634 638382433 /nfs/dbraw/zinc/38/24/33/638382433.db2.gz CETMNEVUDSEKDB-LBPRGKRZSA-N 1 2 247.342 2.142 20 0 BEADLO C[C@@H]1CC[C@@H](CNC(=O)CNc2cccc[nH+]2)C1 ZINC000907914090 638511252 /nfs/dbraw/zinc/51/12/52/638511252.db2.gz SRSIKUQILRRYLF-VXGBXAGGSA-N 1 2 247.342 2.046 20 0 BEADLO C[C@@H]1CCC[C@H](CNC(=O)Cc2c[nH]c[nH+]2)[C@H]1C ZINC000907924206 638514790 /nfs/dbraw/zinc/51/47/90/638514790.db2.gz IFQZJLKBUGDAFS-GRYCIOLGSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@H]1CCC[C@@H]1CNC(=O)CNc1cccc[nH+]1 ZINC000907973648 638530894 /nfs/dbraw/zinc/53/08/94/638530894.db2.gz MVNKHDMNRBTUMX-NWDGAFQWSA-N 1 2 247.342 2.046 20 0 BEADLO Cc1cc(C)c(C(=O)NCC(C)(F)F)c(C)[nH+]1 ZINC000908423245 638703297 /nfs/dbraw/zinc/70/32/97/638703297.db2.gz CXVYFSFCCIYDSW-UHFFFAOYSA-N 1 2 242.269 2.392 20 0 BEADLO Cc1cc(C)c(C(=O)N2C[C@H](C)[C@@H]2C)c(C)[nH+]1 ZINC000908437075 638712924 /nfs/dbraw/zinc/71/29/24/638712924.db2.gz YSJVGGMYFKJLJA-CABZTGNLSA-N 1 2 232.327 2.487 20 0 BEADLO Cc1cc(C)c(C(=O)N2CC[C@@H](F)C2)c(C)[nH+]1 ZINC000908535618 639004974 /nfs/dbraw/zinc/00/49/74/639004974.db2.gz ATTGMZNBHJDLLA-LLVKDONJSA-N 1 2 236.290 2.191 20 0 BEADLO CC(C)=CCC[C@H](C)NC(=O)Cc1c[nH]c[nH+]1 ZINC000908564265 639017892 /nfs/dbraw/zinc/01/78/92/639017892.db2.gz IWSMIGAKNRRLLV-NSHDSACASA-N 1 2 235.331 2.203 20 0 BEADLO CC(C)[C@@H]1CN(C(=O)Cc2c[nH+]c[nH]2)[C@@H]1C(C)C ZINC000909052757 639131940 /nfs/dbraw/zinc/13/19/40/639131940.db2.gz SMKCWSGDAHODBE-GXTWGEPZSA-N 1 2 249.358 2.091 20 0 BEADLO C/C=C(/CC)C(=O)OCCCc1[nH+]ccn1C ZINC000802790129 639231398 /nfs/dbraw/zinc/23/13/98/639231398.db2.gz UNIDLVYKIQGBEN-WCIBSUBMSA-N 1 2 236.315 2.252 20 0 BEADLO CCC[C@@H](NC(=O)Cc1c[nH]c[nH+]1)C1CCC1 ZINC000909930692 639280902 /nfs/dbraw/zinc/28/09/02/639280902.db2.gz UBGSOUQMSDUHJY-GFCCVEGCSA-N 1 2 235.331 2.037 20 0 BEADLO Cc1cc(C)c(C(=O)N2CC=CC2)c(C)[nH+]1 ZINC000909992946 639303256 /nfs/dbraw/zinc/30/32/56/639303256.db2.gz AGQYZTUWAHOUEI-UHFFFAOYSA-N 1 2 216.284 2.019 20 0 BEADLO CC(C)(C)[C@@H]1CCC[C@@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000910470519 639462082 /nfs/dbraw/zinc/46/20/82/639462082.db2.gz SEFWNOMBQOPQPD-NEPJUHHUSA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)(C)[C@H]1CCC[C@@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000910470521 639462120 /nfs/dbraw/zinc/46/21/20/639462120.db2.gz SEFWNOMBQOPQPD-RYUDHWBXSA-N 1 2 249.358 2.283 20 0 BEADLO Cc1nc(CN(C)Cc2cc(C)cc(C)[nH+]2)no1 ZINC000930241389 639649045 /nfs/dbraw/zinc/64/90/45/639649045.db2.gz KBINAWCPILSGLO-UHFFFAOYSA-N 1 2 246.314 2.022 20 0 BEADLO COc1nnc(C[N@@H+]2CC(C)(C)C[C@@H]2C)s1 ZINC000930721486 639877412 /nfs/dbraw/zinc/87/74/12/639877412.db2.gz GSYWFSJCFULWJK-QMMMGPOBSA-N 1 2 241.360 2.167 20 0 BEADLO COc1nnc(C[N@H+]2CC(C)(C)C[C@@H]2C)s1 ZINC000930721486 639877415 /nfs/dbraw/zinc/87/74/15/639877415.db2.gz GSYWFSJCFULWJK-QMMMGPOBSA-N 1 2 241.360 2.167 20 0 BEADLO CC[C@H](CO)[NH+]1Cc2cc(F)c(F)cc2C1 ZINC000930888397 639973817 /nfs/dbraw/zinc/97/38/17/639973817.db2.gz ZAARIDGCWRSREP-SNVBAGLBSA-N 1 2 227.254 2.051 20 0 BEADLO C[N@@H+](Cc1nncs1)C[C@H]1CC1(C)C ZINC000931080563 640061259 /nfs/dbraw/zinc/06/12/59/640061259.db2.gz CMFYEBKHGBKGTJ-MRVPVSSYSA-N 1 2 211.334 2.016 20 0 BEADLO C[N@H+](Cc1nncs1)C[C@H]1CC1(C)C ZINC000931080563 640061262 /nfs/dbraw/zinc/06/12/62/640061262.db2.gz CMFYEBKHGBKGTJ-MRVPVSSYSA-N 1 2 211.334 2.016 20 0 BEADLO CCCN(C)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000931108666 640066742 /nfs/dbraw/zinc/06/67/42/640066742.db2.gz MZWPUOQCSAXJJK-UHFFFAOYSA-N 1 2 217.272 2.045 20 0 BEADLO c1nc([C@@H]2CCC[N@H+]2C[C@@H]2CC[C@H]3C[C@H]3C2)n[nH]1 ZINC000931140912 640076421 /nfs/dbraw/zinc/07/64/21/640076421.db2.gz AIEGRCAJXYDZHF-XQHKEYJVSA-N 1 2 246.358 2.378 20 0 BEADLO c1nc([C@@H]2CCC[N@@H+]2C[C@@H]2CC[C@H]3C[C@H]3C2)n[nH]1 ZINC000931140912 640076427 /nfs/dbraw/zinc/07/64/27/640076427.db2.gz AIEGRCAJXYDZHF-XQHKEYJVSA-N 1 2 246.358 2.378 20 0 BEADLO C/C(=C(/F)C(=O)N[C@H]1CCn2c[nH+]cc21)C1CC1 ZINC000912585708 640121825 /nfs/dbraw/zinc/12/18/25/640121825.db2.gz ZJUDKMCFQODMSY-UVIKPUKZSA-N 1 2 249.289 2.098 20 0 BEADLO COC[C@@H](C[N@@H+]1CC[C@@H]1C(F)F)C(C)C ZINC000931426573 640195392 /nfs/dbraw/zinc/19/53/92/640195392.db2.gz NCCICTWLPYMHJW-NXEZZACHSA-N 1 2 221.291 2.244 20 0 BEADLO COC[C@@H](C[N@H+]1CC[C@@H]1C(F)F)C(C)C ZINC000931426573 640195400 /nfs/dbraw/zinc/19/54/00/640195400.db2.gz NCCICTWLPYMHJW-NXEZZACHSA-N 1 2 221.291 2.244 20 0 BEADLO Cc1conc1C[NH+]1CCC(c2ncco2)CC1 ZINC000931443526 640210659 /nfs/dbraw/zinc/21/06/59/640210659.db2.gz WADJOFWUECCDMR-UHFFFAOYSA-N 1 2 247.298 2.351 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N1CC=CC12CCCC2 ZINC000913204739 640331880 /nfs/dbraw/zinc/33/18/80/640331880.db2.gz LASWLHNGDWTVAT-UHFFFAOYSA-N 1 2 245.326 2.054 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N1CC=CC12CCCC2 ZINC000913204739 640331884 /nfs/dbraw/zinc/33/18/84/640331884.db2.gz LASWLHNGDWTVAT-UHFFFAOYSA-N 1 2 245.326 2.054 20 0 BEADLO C[C@H]([NH2+]Cc1c[nH]cn1)c1cccs1 ZINC000054763754 640405908 /nfs/dbraw/zinc/40/59/08/640405908.db2.gz DEEIZVUJIFQZIT-QMMMGPOBSA-N 1 2 207.302 2.322 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2ccnn2C)on1 ZINC000932265734 640464844 /nfs/dbraw/zinc/46/48/44/640464844.db2.gz RVNRMRRHFBPKPW-CYBMUJFWSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2ccnn2C)on1 ZINC000932265734 640464854 /nfs/dbraw/zinc/46/48/54/640464854.db2.gz RVNRMRRHFBPKPW-CYBMUJFWSA-N 1 2 246.314 2.054 20 0 BEADLO CN(CCCn1cc[nH+]c1)C1(C(F)(F)F)CC1 ZINC000932297127 640473870 /nfs/dbraw/zinc/47/38/70/640473870.db2.gz GMEFYKDHJTVBBE-UHFFFAOYSA-N 1 2 247.264 2.300 20 0 BEADLO CC[C@@H]([NH2+]Cc1c[nH]cn1)c1ccncc1 ZINC000164690313 640499857 /nfs/dbraw/zinc/49/98/57/640499857.db2.gz ZTWVYNHJIIIHBM-GFCCVEGCSA-N 1 2 216.288 2.046 20 0 BEADLO c1cc(C[NH2+][C@@H](c2ccccn2)C2CC2)no1 ZINC000932378057 640506286 /nfs/dbraw/zinc/50/62/86/640506286.db2.gz KTDYGLYFKLREBP-CYBMUJFWSA-N 1 2 229.283 2.311 20 0 BEADLO CC1(C)C(C)(C)C1(C)C(=O)NCCc1[nH]cc[nH+]1 ZINC000932475694 640543882 /nfs/dbraw/zinc/54/38/82/640543882.db2.gz RMSJOQZDQLJMJP-UHFFFAOYSA-N 1 2 249.358 2.141 20 0 BEADLO Cc1cc(C[NH2+][C@H]2CCc3cccnc32)on1 ZINC000226818047 640795012 /nfs/dbraw/zinc/79/50/12/640795012.db2.gz QXMKFZKTZPJKAD-LBPRGKRZSA-N 1 2 229.283 2.155 20 0 BEADLO Cn1c[nH+]cc1CN(Cc1ccoc1)C1CC1 ZINC000934004519 640804072 /nfs/dbraw/zinc/80/40/72/640804072.db2.gz OCDQBRBSSZNSIT-UHFFFAOYSA-N 1 2 231.299 2.178 20 0 BEADLO Cn1cncc1C[N@H+](Cc1ccoc1)C1CC1 ZINC000934004519 640804076 /nfs/dbraw/zinc/80/40/76/640804076.db2.gz OCDQBRBSSZNSIT-UHFFFAOYSA-N 1 2 231.299 2.178 20 0 BEADLO Cn1cncc1C[N@@H+](Cc1ccoc1)C1CC1 ZINC000934004519 640804080 /nfs/dbraw/zinc/80/40/80/640804080.db2.gz OCDQBRBSSZNSIT-UHFFFAOYSA-N 1 2 231.299 2.178 20 0 BEADLO CC[N@@H+]1CCCC[C@H]1C(=O)Oc1ccccc1 ZINC000170919071 640939703 /nfs/dbraw/zinc/93/97/03/640939703.db2.gz HSWRBXYIWROYIQ-ZDUSSCGKSA-N 1 2 233.311 2.466 20 0 BEADLO CC[N@H+]1CCCC[C@H]1C(=O)Oc1ccccc1 ZINC000170919071 640939706 /nfs/dbraw/zinc/93/97/06/640939706.db2.gz HSWRBXYIWROYIQ-ZDUSSCGKSA-N 1 2 233.311 2.466 20 0 BEADLO Cc1cccc2c1CC[N@@H+](Cc1nccn1C)C2 ZINC000170921461 640940513 /nfs/dbraw/zinc/94/05/13/640940513.db2.gz YBEGAKCYPVWKBG-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO Cc1cccc2c1CC[N@H+](Cc1nccn1C)C2 ZINC000170921461 640940520 /nfs/dbraw/zinc/94/05/20/640940520.db2.gz YBEGAKCYPVWKBG-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO CCCNc1cc(N2CC[C@@H](C)C2)nc[nH+]1 ZINC000087820887 641054830 /nfs/dbraw/zinc/05/48/30/641054830.db2.gz WIVCAYQVXJRCNP-SNVBAGLBSA-N 1 2 220.320 2.145 20 0 BEADLO CCCNc1cc(N2CC[C@@H](C)C2)[nH+]cn1 ZINC000087820887 641054832 /nfs/dbraw/zinc/05/48/32/641054832.db2.gz WIVCAYQVXJRCNP-SNVBAGLBSA-N 1 2 220.320 2.145 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@H+](C)Cc1ncccc1Cl ZINC000934107616 641072057 /nfs/dbraw/zinc/07/20/57/641072057.db2.gz XKNOFLRIUWCJOM-VXGBXAGGSA-N 1 2 240.734 2.344 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@@H+](C)Cc1ncccc1Cl ZINC000934107616 641072063 /nfs/dbraw/zinc/07/20/63/641072063.db2.gz XKNOFLRIUWCJOM-VXGBXAGGSA-N 1 2 240.734 2.344 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2cncs2)nn1C ZINC000934194754 641097477 /nfs/dbraw/zinc/09/74/77/641097477.db2.gz AQZNZJKKJUHXII-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO CCCCC1([NH2+][C@H](C)C(=O)OCC)CC1 ZINC000934209062 641103659 /nfs/dbraw/zinc/10/36/59/641103659.db2.gz JEEIFJHGZPCLBU-SNVBAGLBSA-N 1 2 213.321 2.250 20 0 BEADLO C(c1noc(C2CC2)n1)[N@@H+]1C[C@@H]2C[C@H]1CCC2 ZINC000934379408 641135633 /nfs/dbraw/zinc/13/56/33/641135633.db2.gz OKTVMWJNURNCFX-GXSJLCMTSA-N 1 2 233.315 2.321 20 0 BEADLO C(c1noc(C2CC2)n1)[N@H+]1C[C@@H]2C[C@H]1CCC2 ZINC000934379408 641135635 /nfs/dbraw/zinc/13/56/35/641135635.db2.gz OKTVMWJNURNCFX-GXSJLCMTSA-N 1 2 233.315 2.321 20 0 BEADLO O=c1c2ccccc2sn1C[NH+]1CCCC1 ZINC000058583845 641158912 /nfs/dbraw/zinc/15/89/12/641158912.db2.gz YEOTXOZYOYLCKX-UHFFFAOYSA-N 1 2 234.324 2.116 20 0 BEADLO C[C@@H]1CCC[N@@H+]1Cn1ccc(C(F)(F)F)n1 ZINC000173529020 641183596 /nfs/dbraw/zinc/18/35/96/641183596.db2.gz OGNGRLSEWLNRIA-MRVPVSSYSA-N 1 2 233.237 2.344 20 0 BEADLO C[C@@H]1CCC[N@H+]1Cn1ccc(C(F)(F)F)n1 ZINC000173529020 641183600 /nfs/dbraw/zinc/18/36/00/641183600.db2.gz OGNGRLSEWLNRIA-MRVPVSSYSA-N 1 2 233.237 2.344 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+]1CC[C@@H](O)[C@@H](F)C1 ZINC000934574993 641204835 /nfs/dbraw/zinc/20/48/35/641204835.db2.gz VSJMPTPBINNNFY-QWHCGFSZSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1ccc(F)cc1C[N@H+]1CC[C@@H](O)[C@@H](F)C1 ZINC000934574993 641204843 /nfs/dbraw/zinc/20/48/43/641204843.db2.gz VSJMPTPBINNNFY-QWHCGFSZSA-N 1 2 241.281 2.039 20 0 BEADLO CCCOC(=O)[C@@H](C)[NH2+]C(C)(C)CSC ZINC000934673345 641242105 /nfs/dbraw/zinc/24/21/05/641242105.db2.gz BWWNSYCLPLMJCI-SECBINFHSA-N 1 2 233.377 2.059 20 0 BEADLO c1nnc(C[NH2+][C@H](c2ccncc2)C2CC2)s1 ZINC000934701951 641251263 /nfs/dbraw/zinc/25/12/63/641251263.db2.gz UIHVSAPHYFQPFF-LBPRGKRZSA-N 1 2 246.339 2.174 20 0 BEADLO C[C@@H](c1nc(CCC(F)(F)F)no1)[NH+](C)C ZINC000350599483 641372460 /nfs/dbraw/zinc/37/24/60/641372460.db2.gz QGUWHZVHEMQZSI-LURJTMIESA-N 1 2 237.225 2.187 20 0 BEADLO C[C@H](c1noc([C@H](C)[NH+](C)C)n1)C1CC1 ZINC000350600056 641372993 /nfs/dbraw/zinc/37/29/93/641372993.db2.gz SJXUSLQJGFBBRU-YUMQZZPRSA-N 1 2 209.293 2.206 20 0 BEADLO CCC[C@@H](C)NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000929718059 641417401 /nfs/dbraw/zinc/41/74/01/641417401.db2.gz NCYCIMQBTBEQQW-SECBINFHSA-N 1 2 231.299 2.481 20 0 BEADLO CCSCCCc1noc([C@H](C)[NH+](C)C)n1 ZINC000350983903 641580064 /nfs/dbraw/zinc/58/00/64/641580064.db2.gz HKDSVQJTWYOBHH-VIFPVBQESA-N 1 2 243.376 2.378 20 0 BEADLO CC1(C)C[C@@]1(C)CNC(=O)CNc1cccc[nH+]1 ZINC000914379135 641654174 /nfs/dbraw/zinc/65/41/74/641654174.db2.gz PXOAMXLMPOQKEI-AWEZNQCLSA-N 1 2 247.342 2.046 20 0 BEADLO CCC[C@H](OC)c1noc([C@H](C)[NH+](C)C)n1 ZINC000351136618 641681086 /nfs/dbraw/zinc/68/10/86/641681086.db2.gz TVSSZYVCHDQVNR-IUCAKERBSA-N 1 2 227.308 2.180 20 0 BEADLO CCN(C(=O)Cn1cc[nH+]c1)c1ccc(C)cc1 ZINC000915216176 641809567 /nfs/dbraw/zinc/80/95/67/641809567.db2.gz TULOLJSMSDQIDS-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO CCn1cnn(C[N@H+](C)[C@H](C)C(C)C)c1=S ZINC000915208888 641809644 /nfs/dbraw/zinc/80/96/44/641809644.db2.gz IKKUCMYFTBCPKD-SNVBAGLBSA-N 1 2 242.392 2.368 20 0 BEADLO CCn1cnn(C[N@@H+](C)[C@H](C)C(C)C)c1=S ZINC000915208888 641809648 /nfs/dbraw/zinc/80/96/48/641809648.db2.gz IKKUCMYFTBCPKD-SNVBAGLBSA-N 1 2 242.392 2.368 20 0 BEADLO Cc1cc(N)nc(S[C@@H](C)c2ncccn2)[nH+]1 ZINC000916177022 641915536 /nfs/dbraw/zinc/91/55/36/641915536.db2.gz QARUVXPPFYWXAC-QMMMGPOBSA-N 1 2 247.327 2.011 20 0 BEADLO CS[C@H]1CC[C@H](Nc2cc[nH+]c(C)n2)C1 ZINC000078477650 641926344 /nfs/dbraw/zinc/92/63/44/641926344.db2.gz DWYAZYBNPNICAD-UWVGGRQHSA-N 1 2 223.345 2.481 20 0 BEADLO CC(C)(C)c1nc(Cn2cc[nH+]c2)co1 ZINC000917359774 642048062 /nfs/dbraw/zinc/04/80/62/642048062.db2.gz UNWAACRUHQTNGV-UHFFFAOYSA-N 1 2 205.261 2.217 20 0 BEADLO CCn1cnn(C[N@H+](CC)CC(C)C)c1=S ZINC000917454583 642065631 /nfs/dbraw/zinc/06/56/31/642065631.db2.gz UFZOEXVENOWNFF-UHFFFAOYSA-N 1 2 242.392 2.369 20 0 BEADLO CCn1cnn(C[N@@H+](CC)CC(C)C)c1=S ZINC000917454583 642065639 /nfs/dbraw/zinc/06/56/39/642065639.db2.gz UFZOEXVENOWNFF-UHFFFAOYSA-N 1 2 242.392 2.369 20 0 BEADLO C/C(=C\C(=O)NCCCCn1cc[nH+]c1)C1CC1 ZINC000918706774 642253339 /nfs/dbraw/zinc/25/33/39/642253339.db2.gz ZGYPVXYCHUWZBR-ZRDIBKRKSA-N 1 2 247.342 2.136 20 0 BEADLO Cc1ccccc1SCC[NH+]1CCOCC1 ZINC000918715905 642255456 /nfs/dbraw/zinc/25/54/56/642255456.db2.gz LJASFNWXGKIEOW-UHFFFAOYSA-N 1 2 237.368 2.419 20 0 BEADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+]Cc1c[nH]nc1C ZINC000925462466 642313264 /nfs/dbraw/zinc/31/32/64/642313264.db2.gz KWOJKUPWBHUQAQ-NSHDSACASA-N 1 2 246.314 2.182 20 0 BEADLO c1ncc(C[N@H+]2CCOC[C@H]2CC2CC2)s1 ZINC000933216080 642393910 /nfs/dbraw/zinc/39/39/10/642393910.db2.gz VXEDOGHGXKPZKO-LLVKDONJSA-N 1 2 238.356 2.144 20 0 BEADLO c1ncc(C[N@@H+]2CCOC[C@H]2CC2CC2)s1 ZINC000933216080 642393916 /nfs/dbraw/zinc/39/39/16/642393916.db2.gz VXEDOGHGXKPZKO-LLVKDONJSA-N 1 2 238.356 2.144 20 0 BEADLO C[N@H+](CC1CC1)Cn1ncn(C2CC2)c1=S ZINC000919942520 642410307 /nfs/dbraw/zinc/41/03/07/642410307.db2.gz VTZIPMZXUOPZFF-UHFFFAOYSA-N 1 2 238.360 2.048 20 0 BEADLO C[N@@H+](CC1CC1)Cn1ncn(C2CC2)c1=S ZINC000919942520 642410316 /nfs/dbraw/zinc/41/03/16/642410316.db2.gz VTZIPMZXUOPZFF-UHFFFAOYSA-N 1 2 238.360 2.048 20 0 BEADLO CCOc1cccc(C[NH2+]Cc2nonc2C)c1 ZINC000070261683 642429482 /nfs/dbraw/zinc/42/94/82/642429482.db2.gz AHKUPSAJZDNZIF-UHFFFAOYSA-N 1 2 247.298 2.067 20 0 BEADLO CCC/C(C)=C/C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000920290718 642470846 /nfs/dbraw/zinc/47/08/46/642470846.db2.gz OTANFBAUTDBBEL-JATZPVMKSA-N 1 2 235.331 2.134 20 0 BEADLO C[C@@H]1[C@@H](C)CC[N@@H+]1Cn1ncsc1=S ZINC000174949616 642639895 /nfs/dbraw/zinc/63/98/95/642639895.db2.gz VXEFICNLXFNHIZ-JGVFFNPUSA-N 1 2 229.374 2.362 20 0 BEADLO C[C@@H]1[C@@H](C)CC[N@H+]1Cn1ncsc1=S ZINC000174949616 642639899 /nfs/dbraw/zinc/63/98/99/642639899.db2.gz VXEFICNLXFNHIZ-JGVFFNPUSA-N 1 2 229.374 2.362 20 0 BEADLO Cc1cc(C)cc([C@@H](O)Cn2cc[nH+]c2)c1 ZINC000097986987 642651729 /nfs/dbraw/zinc/65/17/29/642651729.db2.gz DPXVUVCFCOIUAP-ZDUSSCGKSA-N 1 2 216.284 2.234 20 0 BEADLO C[N@H+](Cc1cc2ccccc2o1)[C@@H]1CCOC1=O ZINC000175191789 642656135 /nfs/dbraw/zinc/65/61/35/642656135.db2.gz AAJJSEYQXHOGKY-GFCCVEGCSA-N 1 2 245.278 2.180 20 0 BEADLO C[N@@H+](Cc1cc2ccccc2o1)[C@@H]1CCOC1=O ZINC000175191789 642656141 /nfs/dbraw/zinc/65/61/41/642656141.db2.gz AAJJSEYQXHOGKY-GFCCVEGCSA-N 1 2 245.278 2.180 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@H](O)c1ccccc1 ZINC000179978844 642760801 /nfs/dbraw/zinc/76/08/01/642760801.db2.gz ONLZVCAGJORPPQ-HZMBPMFUSA-N 1 2 245.326 2.102 20 0 BEADLO Cc1nonc1C[NH2+][C@@H](C)c1ccsc1 ZINC000069795216 642906792 /nfs/dbraw/zinc/90/67/92/642906792.db2.gz CSAKZWIHJODNCT-ZETCQYMHSA-N 1 2 223.301 2.290 20 0 BEADLO C=C(C)COC(=O)[C@H](c1ccccc1)[NH+](C)C ZINC000181982517 642932225 /nfs/dbraw/zinc/93/22/25/642932225.db2.gz PUILSCMDFHPAJS-ZDUSSCGKSA-N 1 2 233.311 2.409 20 0 BEADLO CCCCC[C@H](C)NC(=O)CCc1c[nH]c[nH+]1 ZINC000276525156 643020760 /nfs/dbraw/zinc/02/07/60/643020760.db2.gz CNHPESAELWURLK-NSHDSACASA-N 1 2 237.347 2.427 20 0 BEADLO CCCCC[C@H](C)NC(=O)CCc1c[nH+]c[nH]1 ZINC000276525156 643020772 /nfs/dbraw/zinc/02/07/72/643020772.db2.gz CNHPESAELWURLK-NSHDSACASA-N 1 2 237.347 2.427 20 0 BEADLO Cc1ccccc1OCC[N@@H+](C)C[C@@H](C)C#N ZINC000070869709 643076696 /nfs/dbraw/zinc/07/66/96/643076696.db2.gz BVGYOIVUDQXUQH-LBPRGKRZSA-N 1 2 232.327 2.465 20 0 BEADLO Cc1ccccc1OCC[N@H+](C)C[C@@H](C)C#N ZINC000070869709 643076700 /nfs/dbraw/zinc/07/67/00/643076700.db2.gz BVGYOIVUDQXUQH-LBPRGKRZSA-N 1 2 232.327 2.465 20 0 BEADLO C#CC[NH+](CC#C)Cc1cc(C)ccc1OC ZINC000076185392 643148546 /nfs/dbraw/zinc/14/85/46/643148546.db2.gz LUMYLLSJGNHHPW-UHFFFAOYSA-N 1 2 227.307 2.072 20 0 BEADLO O=Cc1c[nH]nc1C=Cc1c[nH+]c2ccccn12 ZINC000254976756 643195307 /nfs/dbraw/zinc/19/53/07/643195307.db2.gz QYKFDDSCNBMLMU-PLNGDYQASA-N 1 2 238.250 2.040 20 0 BEADLO C=CCCO[NH+]=C(N)c1ccc(F)cc1 ZINC000077238722 643265232 /nfs/dbraw/zinc/26/52/32/643265232.db2.gz CUQVZYPEJRTRAN-UHFFFAOYSA-N 1 2 208.236 2.039 20 0 BEADLO CCOc1ccccc1C[NH2+]Cc1cnc[nH]1 ZINC000112342261 643332428 /nfs/dbraw/zinc/33/24/28/643332428.db2.gz JQLVHPCZANDBPT-UHFFFAOYSA-N 1 2 231.299 2.098 20 0 BEADLO CC(C)Oc1cccc(C[NH2+]Cc2c[nH]cn2)c1 ZINC000112341498 643333049 /nfs/dbraw/zinc/33/30/49/643333049.db2.gz ZLPKCQYSHPTWKF-UHFFFAOYSA-N 1 2 245.326 2.487 20 0 BEADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cnc[nH]2)o1 ZINC000112341595 643333067 /nfs/dbraw/zinc/33/30/67/643333067.db2.gz IPFZWJANYPHAGT-CABZTGNLSA-N 1 2 231.299 2.416 20 0 BEADLO c1cc(C[N@@H+]2CCOCC23CCC3)co1 ZINC000093510574 643335072 /nfs/dbraw/zinc/33/50/72/643335072.db2.gz SGPWYRAHVJZVFR-UHFFFAOYSA-N 1 2 207.273 2.035 20 0 BEADLO c1cc(C[N@H+]2CCOCC23CCC3)co1 ZINC000093510574 643335079 /nfs/dbraw/zinc/33/50/79/643335079.db2.gz SGPWYRAHVJZVFR-UHFFFAOYSA-N 1 2 207.273 2.035 20 0 BEADLO Cc1cc(NC(=O)c2ccc[nH]c2=S)cc[nH+]1 ZINC000073300689 643429401 /nfs/dbraw/zinc/42/94/01/643429401.db2.gz SNJZZIZFDBXGHV-UHFFFAOYSA-N 1 2 245.307 2.326 20 0 BEADLO CCCCCCC(=O)N1CC(n2cc[nH+]c2)C1 ZINC000733986038 643485982 /nfs/dbraw/zinc/48/59/82/643485982.db2.gz UHLHSIXXZHJGDC-UHFFFAOYSA-N 1 2 235.331 2.237 20 0 BEADLO CC(=O)C1CC[NH+](Cc2ccn(C(C)C)n2)CC1 ZINC000085161812 643688121 /nfs/dbraw/zinc/68/81/21/643688121.db2.gz IOAJGMKQDWEMJO-UHFFFAOYSA-N 1 2 249.358 2.265 20 0 BEADLO CCc1onc(C)c1C[N@@H+]1CCO[C@H](CC)C1 ZINC000929257463 643830632 /nfs/dbraw/zinc/83/06/32/643830632.db2.gz MWFYLSWWQZFADO-LLVKDONJSA-N 1 2 238.331 2.156 20 0 BEADLO CCc1onc(C)c1C[N@H+]1CCO[C@H](CC)C1 ZINC000929257463 643830636 /nfs/dbraw/zinc/83/06/36/643830636.db2.gz MWFYLSWWQZFADO-LLVKDONJSA-N 1 2 238.331 2.156 20 0 BEADLO C[C@@H]1Cc2cc(C[NH2+]C(CF)CF)ccc2O1 ZINC000922153950 643875363 /nfs/dbraw/zinc/87/53/63/643875363.db2.gz GFISGEGSCPTMLQ-SECBINFHSA-N 1 2 241.281 2.407 20 0 BEADLO Nc1[nH+]cccc1COC(=O)[C@H]1CC=CCC1 ZINC000922220375 643908553 /nfs/dbraw/zinc/90/85/53/643908553.db2.gz UINGSTHCSJMXIH-JTQLQIEISA-N 1 2 232.283 2.063 20 0 BEADLO CC/C=C(/C)C(=O)OCc1ccc[nH+]c1N ZINC000922229746 643911093 /nfs/dbraw/zinc/91/10/93/643911093.db2.gz MBRVPFXNYQOGHP-UITAMQMPSA-N 1 2 220.272 2.063 20 0 BEADLO CCC[C@H](C)C(=O)OCc1ccc(N)[nH+]c1 ZINC000922352806 643980156 /nfs/dbraw/zinc/98/01/56/643980156.db2.gz SVSPGXIWEFZPJP-VIFPVBQESA-N 1 2 222.288 2.143 20 0 BEADLO Nc1ccc(COC(=O)C=C2CCCC2)c[nH+]1 ZINC000922374097 643982101 /nfs/dbraw/zinc/98/21/01/643982101.db2.gz MQIZTGNLYISENM-UHFFFAOYSA-N 1 2 232.283 2.207 20 0 BEADLO C/C(=C\C(=O)OCc1ccc(N)[nH+]c1)C1CC1 ZINC000922369227 643982448 /nfs/dbraw/zinc/98/24/48/643982448.db2.gz FLUSUKWDKOVMRQ-RMKNXTFCSA-N 1 2 232.283 2.063 20 0 BEADLO C[C@H]1CC/C(=C/C(=O)OCc2ccc[nH+]c2N)C1 ZINC000922516387 644005641 /nfs/dbraw/zinc/00/56/41/644005641.db2.gz GEFCEIZEIPBPHQ-DFYQSJSGSA-N 1 2 246.310 2.453 20 0 BEADLO c1ncc(C[NH2+][C@@H](c2ncccn2)C2CC2)s1 ZINC000922579909 644032956 /nfs/dbraw/zinc/03/29/56/644032956.db2.gz MEEQDJSNUFQMBD-LLVKDONJSA-N 1 2 246.339 2.174 20 0 BEADLO C[C@@H]1CCC[C@@H]1C(=O)OCc1ccc[nH+]c1N ZINC000922605003 644040896 /nfs/dbraw/zinc/04/08/96/644040896.db2.gz DTFFARUVJMAHQU-KOLCDFICSA-N 1 2 234.299 2.143 20 0 BEADLO C[C@H]1CCC[C@H]1C(=O)OCc1ccc[nH+]c1N ZINC000922604999 644040964 /nfs/dbraw/zinc/04/09/64/644040964.db2.gz DTFFARUVJMAHQU-GXSJLCMTSA-N 1 2 234.299 2.143 20 0 BEADLO C[C@H]1CCC[C@H]1C(=O)OCc1ccc(N)[nH+]c1 ZINC000922606067 644041179 /nfs/dbraw/zinc/04/11/79/644041179.db2.gz VDTSCBGGGRUPIV-GXSJLCMTSA-N 1 2 234.299 2.143 20 0 BEADLO CC(C)C[C@@H](C)C(=O)OCc1ccc[nH+]c1N ZINC000922614868 644041910 /nfs/dbraw/zinc/04/19/10/644041910.db2.gz OSEJTEBUVWJHHY-SNVBAGLBSA-N 1 2 236.315 2.389 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1C(=O)OCc1ccc[nH+]c1N ZINC000922625394 644046370 /nfs/dbraw/zinc/04/63/70/644046370.db2.gz ZQWYTNBNKDBGDB-SMDDNHRTSA-N 1 2 248.326 2.389 20 0 BEADLO CC(C)C(C)(C)C(=O)OCc1ccc[nH+]c1N ZINC000922635887 644050009 /nfs/dbraw/zinc/05/00/09/644050009.db2.gz YSHXMJAVJNZJLA-UHFFFAOYSA-N 1 2 236.315 2.389 20 0 BEADLO CC(C)n1ncnc1C[NH2+]C(C)(C)/C=C\Cl ZINC000922646101 644051786 /nfs/dbraw/zinc/05/17/86/644051786.db2.gz YJNCQNGCSCBCFB-WAYWQWQTSA-N 1 2 242.754 2.480 20 0 BEADLO Nc1ccc(COC(=O)[C@@H]2CCC[C@H]3C[C@H]32)c[nH+]1 ZINC000922856178 644119583 /nfs/dbraw/zinc/11/95/83/644119583.db2.gz XFSYZYCIUMTTER-QJPTWQEYSA-N 1 2 246.310 2.143 20 0 BEADLO Nc1ccc(COC(=O)[C@@H]2CCCC23CC3)c[nH+]1 ZINC000922897583 644186607 /nfs/dbraw/zinc/18/66/07/644186607.db2.gz NSIJKLVVGGDFID-NSHDSACASA-N 1 2 246.310 2.287 20 0 BEADLO CCCCO[NH+]=C(N)c1ccc(F)cc1 ZINC000085260182 644437193 /nfs/dbraw/zinc/43/71/93/644437193.db2.gz XBPBFOVDELBCTR-UHFFFAOYSA-N 1 2 210.252 2.263 20 0 BEADLO C[C@@H](C(=O)O[C@@H]1CC[N@H+](CCF)C1)C1CCC1 ZINC000838875545 644546764 /nfs/dbraw/zinc/54/67/64/644546764.db2.gz YJZDMBFLLIZOCH-ZYHUDNBSSA-N 1 2 243.322 2.010 20 0 BEADLO C[C@@H](C(=O)O[C@@H]1CC[N@@H+](CCF)C1)C1CCC1 ZINC000838875545 644546766 /nfs/dbraw/zinc/54/67/66/644546766.db2.gz YJZDMBFLLIZOCH-ZYHUDNBSSA-N 1 2 243.322 2.010 20 0 BEADLO CCCCOC(=O)C[N@@H+]1CCS[C@H](C)[C@H]1C ZINC000246340118 644581647 /nfs/dbraw/zinc/58/16/47/644581647.db2.gz IZYBAPIRTRKPGS-GHMZBOCLSA-N 1 2 245.388 2.156 20 0 BEADLO CCCCOC(=O)C[N@H+]1CCS[C@H](C)[C@H]1C ZINC000246340118 644581653 /nfs/dbraw/zinc/58/16/53/644581653.db2.gz IZYBAPIRTRKPGS-GHMZBOCLSA-N 1 2 245.388 2.156 20 0 BEADLO CCCCOC(=O)[C@H](C)[N@@H+]1CCSC[C@H]1C ZINC000246649973 644601453 /nfs/dbraw/zinc/60/14/53/644601453.db2.gz IOGSDZOTLTVOCH-MNOVXSKESA-N 1 2 245.388 2.156 20 0 BEADLO CCCCOC(=O)[C@H](C)[N@H+]1CCSC[C@H]1C ZINC000246649973 644601457 /nfs/dbraw/zinc/60/14/57/644601457.db2.gz IOGSDZOTLTVOCH-MNOVXSKESA-N 1 2 245.388 2.156 20 0 BEADLO CC[C@@H]1C[N@H+](C/C=C/Cl)C[C@@H](C)O1 ZINC000247376536 644636753 /nfs/dbraw/zinc/63/67/53/644636753.db2.gz FTYIRQAPPWSEQP-NUNSBDKSSA-N 1 2 203.713 2.238 20 0 BEADLO CC[C@@H]1C[N@@H+](C/C=C/Cl)C[C@@H](C)O1 ZINC000247376536 644636757 /nfs/dbraw/zinc/63/67/57/644636757.db2.gz FTYIRQAPPWSEQP-NUNSBDKSSA-N 1 2 203.713 2.238 20 0 BEADLO CC1(C)CC[C@H]1NC(=O)c1cccc2[nH+]ccn21 ZINC000805323448 644666041 /nfs/dbraw/zinc/66/60/41/644666041.db2.gz OYOUWGYBLDOELU-LLVKDONJSA-N 1 2 243.310 2.253 20 0 BEADLO CC(C)c1cnc(C[N@H+](C)CC2(CO)CC2)o1 ZINC000782601288 644741653 /nfs/dbraw/zinc/74/16/53/644741653.db2.gz WHHZLABCVJMCPS-UHFFFAOYSA-N 1 2 238.331 2.002 20 0 BEADLO CC(C)c1cnc(C[N@@H+](C)CC2(CO)CC2)o1 ZINC000782601288 644741658 /nfs/dbraw/zinc/74/16/58/644741658.db2.gz WHHZLABCVJMCPS-UHFFFAOYSA-N 1 2 238.331 2.002 20 0 BEADLO C[C@H]1CC[C@H]1[NH2+]c1ccc(N(C)CCO)cc1 ZINC000783280322 644751890 /nfs/dbraw/zinc/75/18/90/644751890.db2.gz JLPKFTASLXWXPF-SMDDNHRTSA-N 1 2 234.343 2.326 20 0 BEADLO C[C@H]1CC[C@@H]1[NH2+]c1ccc(N(C)CCO)cc1 ZINC000783280320 644752904 /nfs/dbraw/zinc/75/29/04/644752904.db2.gz JLPKFTASLXWXPF-FZMZJTMJSA-N 1 2 234.343 2.326 20 0 BEADLO C[C@@H]1CC/C(=C\C(=O)OCCc2c[nH+]cn2C)C1 ZINC000793237898 644801681 /nfs/dbraw/zinc/80/16/81/644801681.db2.gz LEOZEJNOYDHNKH-OYGDSYQHSA-N 1 2 248.326 2.252 20 0 BEADLO C[C@@H]1CC/C(=C/C(=O)OCCc2c[nH+]cn2C)C1 ZINC000793237894 644802108 /nfs/dbraw/zinc/80/21/08/644802108.db2.gz LEOZEJNOYDHNKH-HQQGHWSLSA-N 1 2 248.326 2.252 20 0 BEADLO OCC1([NH2+]CC(F)(F)C(F)F)CCCCC1 ZINC000303526267 644829834 /nfs/dbraw/zinc/82/98/34/644829834.db2.gz YINMKHSQKHIUAS-UHFFFAOYSA-N 1 2 243.244 2.172 20 0 BEADLO O[C@H](CC1CCCC1)C[N@@H+]1Cc2ccncc2C1 ZINC000809564683 644891360 /nfs/dbraw/zinc/89/13/60/644891360.db2.gz CRXUVDKMCUPIOM-OAHLLOKOSA-N 1 2 246.354 2.338 20 0 BEADLO O[C@H](CC1CCCC1)C[N@H+]1Cc2ccncc2C1 ZINC000809564683 644891364 /nfs/dbraw/zinc/89/13/64/644891364.db2.gz CRXUVDKMCUPIOM-OAHLLOKOSA-N 1 2 246.354 2.338 20 0 BEADLO CO[C@H]1C[C@H]([NH2+]CC(F)(F)C(F)F)C1(C)C ZINC000304541586 644915569 /nfs/dbraw/zinc/91/55/69/644915569.db2.gz NMWSWUYKLPVDSY-BQBZGAKWSA-N 1 2 243.244 2.290 20 0 BEADLO Cc1cc(CNC(=O)[C@H](F)C(C)C)cc(C)[nH+]1 ZINC000817459056 644983469 /nfs/dbraw/zinc/98/34/69/644983469.db2.gz QPZVAKFBOVMGLP-GFCCVEGCSA-N 1 2 238.306 2.309 20 0 BEADLO CCCC[C@](C)(F)C(=O)NCc1[nH]c[nH+]c1C ZINC000829493923 645109484 /nfs/dbraw/zinc/10/94/84/645109484.db2.gz UNEGKVYBLIBHOG-LBPRGKRZSA-N 1 2 241.310 2.253 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NCCC[C@H]1C=CCC1 ZINC000834326122 645138160 /nfs/dbraw/zinc/13/81/60/645138160.db2.gz BTMPAQCWXUEUKT-LBPRGKRZSA-N 1 2 247.342 2.123 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](C)c2ncco2)c1 ZINC000926659382 645342552 /nfs/dbraw/zinc/34/25/52/645342552.db2.gz HNFAJXUEBYMIFB-VIFPVBQESA-N 1 2 233.271 2.389 20 0 BEADLO CC/C=C/COC(=O)Cc1cn2c([nH+]1)CCCC2 ZINC000845449633 645362557 /nfs/dbraw/zinc/36/25/57/645362557.db2.gz RIUMCNTUGJMUTD-ZZXKWVIFSA-N 1 2 248.326 2.271 20 0 BEADLO CC[C@H](C)OC(=O)Cc1cn2c([nH+]1)CCCC2 ZINC000845451004 645363966 /nfs/dbraw/zinc/36/39/66/645363966.db2.gz UHHGEPXYQSTZCL-JTQLQIEISA-N 1 2 236.315 2.104 20 0 BEADLO C[C@@H](CC(=O)OCC(C)(C)C)n1cc[nH+]c1 ZINC000845463869 645364902 /nfs/dbraw/zinc/36/49/02/645364902.db2.gz SCIZIYZBRHLAKU-JTQLQIEISA-N 1 2 224.304 2.424 20 0 BEADLO Cc1noc([C@@H](C)[N@H+](C)C[C@H]2CCC=CO2)n1 ZINC000848926574 645443511 /nfs/dbraw/zinc/44/35/11/645443511.db2.gz ZTNVGIKOAOFOIW-MWLCHTKSSA-N 1 2 237.303 2.064 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+](C)C[C@H]2CCC=CO2)n1 ZINC000848926574 645443519 /nfs/dbraw/zinc/44/35/19/645443519.db2.gz ZTNVGIKOAOFOIW-MWLCHTKSSA-N 1 2 237.303 2.064 20 0 BEADLO CC(C)[C@@H]([NH2+][C@@H](C)c1ncco1)c1cnn(C)c1 ZINC000927072958 645538450 /nfs/dbraw/zinc/53/84/50/645538450.db2.gz ZUFNKYPGAIXRLI-CMPLNLGQSA-N 1 2 248.330 2.456 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C1([C@@H]2CCCCO2)CC1 ZINC000927165133 645580111 /nfs/dbraw/zinc/58/01/11/645580111.db2.gz ZSWNCIWJKGXURZ-GWCFXTLKSA-N 1 2 249.358 2.470 20 0 BEADLO Nc1ccc(CNC(=O)C=C2CCCCC2)c[nH+]1 ZINC000927777608 645654490 /nfs/dbraw/zinc/65/44/90/645654490.db2.gz CFAOJZWSZOOEQU-UHFFFAOYSA-N 1 2 245.326 2.171 20 0 BEADLO CC(C)CC(C)(C)C(=O)NCc1ccc(N)[nH+]c1 ZINC000927778578 645656638 /nfs/dbraw/zinc/65/66/38/645656638.db2.gz XGEZHGQTCHBIIK-UHFFFAOYSA-N 1 2 249.358 2.352 20 0 BEADLO C[C@H](c1ccc(F)nc1)[N@@H+]1CCc2nc[nH]c2C1 ZINC000929069128 645933801 /nfs/dbraw/zinc/93/38/01/645933801.db2.gz HDGFLZCDECVKKH-SECBINFHSA-N 1 2 246.289 2.063 20 0 BEADLO C[C@H](c1ccc(F)nc1)[N@H+]1CCc2nc[nH]c2C1 ZINC000929069128 645933805 /nfs/dbraw/zinc/93/38/05/645933805.db2.gz HDGFLZCDECVKKH-SECBINFHSA-N 1 2 246.289 2.063 20 0 BEADLO C[C@@H]1C[C@@H]1c1noc([C@@H]2C[C@H]2c2c[nH]c[nH+]2)n1 ZINC000923924315 645963041 /nfs/dbraw/zinc/96/30/41/645963041.db2.gz ZSIUPWXEBMBADY-BZNPZCIMSA-N 1 2 230.271 2.187 20 0 BEADLO C[C@H](c1nc([C@H]2CCCS2)no1)[NH+](C)C ZINC000923921850 645963369 /nfs/dbraw/zinc/96/33/69/645963369.db2.gz YTJVGYMQSOHOMB-HTQZYQBOSA-N 1 2 227.333 2.260 20 0 BEADLO C[C@@H](c1noc([C@@H](C)[NH+](C)C)n1)C1CC1 ZINC000923957281 645965186 /nfs/dbraw/zinc/96/51/86/645965186.db2.gz SJXUSLQJGFBBRU-HTQZYQBOSA-N 1 2 209.293 2.206 20 0 BEADLO O=C(C[C@@H]1CC=CCC1)NCCCn1cc[nH+]c1 ZINC000929155687 645978355 /nfs/dbraw/zinc/97/83/55/645978355.db2.gz DVFQDRJGSHZMAD-CYBMUJFWSA-N 1 2 247.342 2.136 20 0 BEADLO Cc1cn(C)nc1C[N@H+](C)Cc1cccc(F)c1 ZINC000929210673 646006188 /nfs/dbraw/zinc/00/61/88/646006188.db2.gz RPNKVVTYUCSVOI-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1cn(C)nc1C[N@@H+](C)Cc1cccc(F)c1 ZINC000929210673 646006196 /nfs/dbraw/zinc/00/61/96/646006196.db2.gz RPNKVVTYUCSVOI-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)C[C@H]1CC=CCC1 ZINC000924252581 646014286 /nfs/dbraw/zinc/01/42/86/646014286.db2.gz YFMIHXOPEMEUHJ-LBPRGKRZSA-N 1 2 248.326 2.252 20 0 BEADLO COC/C(C)=C\C[N@@H+]1CCC[C@@H](c2ccn[nH]2)C1 ZINC000929297101 646072004 /nfs/dbraw/zinc/07/20/04/646072004.db2.gz UCSWIHLPEXZBBB-MVXISAMASA-N 1 2 249.358 2.182 20 0 BEADLO COC/C(C)=C\C[N@H+]1CCC[C@@H](c2ccn[nH]2)C1 ZINC000929297101 646072006 /nfs/dbraw/zinc/07/20/06/646072006.db2.gz UCSWIHLPEXZBBB-MVXISAMASA-N 1 2 249.358 2.182 20 0 BEADLO COCC[N@H+](C)Cc1c(F)ccc(C)c1F ZINC000929318959 646075806 /nfs/dbraw/zinc/07/58/06/646075806.db2.gz GRLZYPIBBHNEMM-UHFFFAOYSA-N 1 2 229.270 2.351 20 0 BEADLO COCC[N@@H+](C)Cc1c(F)ccc(C)c1F ZINC000929318959 646075809 /nfs/dbraw/zinc/07/58/09/646075809.db2.gz GRLZYPIBBHNEMM-UHFFFAOYSA-N 1 2 229.270 2.351 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCCc2c1cnn2C)c1ncco1 ZINC000924650907 646086256 /nfs/dbraw/zinc/08/62/56/646086256.db2.gz MLOQQBZVSZCLFO-GXSJLCMTSA-N 1 2 246.314 2.136 20 0 BEADLO COc1nnc(C[N@@H+]2CCC[C@H](C)CC2)s1 ZINC000929362930 646095385 /nfs/dbraw/zinc/09/53/85/646095385.db2.gz BTXMRMVAXUZYJP-VIFPVBQESA-N 1 2 241.360 2.169 20 0 BEADLO COc1nnc(C[N@H+]2CCC[C@H](C)CC2)s1 ZINC000929362930 646095389 /nfs/dbraw/zinc/09/53/89/646095389.db2.gz BTXMRMVAXUZYJP-VIFPVBQESA-N 1 2 241.360 2.169 20 0 BEADLO CC(C)n1ccc(C[NH2+][C@H](C)c2ccnnc2)n1 ZINC000925109279 646186571 /nfs/dbraw/zinc/18/65/71/646186571.db2.gz ZGGYGJCFVWUMIV-LLVKDONJSA-N 1 2 245.330 2.105 20 0 BEADLO C[N@H+](Cc1c(F)cncc1F)C1CCC1 ZINC000929720320 646273129 /nfs/dbraw/zinc/27/31/29/646273129.db2.gz NHEXROGTBVMCBX-UHFFFAOYSA-N 1 2 212.243 2.344 20 0 BEADLO C[N@@H+](Cc1c(F)cncc1F)C1CCC1 ZINC000929720320 646273137 /nfs/dbraw/zinc/27/31/37/646273137.db2.gz NHEXROGTBVMCBX-UHFFFAOYSA-N 1 2 212.243 2.344 20 0 BEADLO COC/C(C)=C/C[N@H+](C)Cc1nccs1 ZINC000929767411 646297882 /nfs/dbraw/zinc/29/78/82/646297882.db2.gz DZYMSJSCVLYXBU-ONNFQVAWSA-N 1 2 226.345 2.168 20 0 BEADLO COC/C(C)=C/C[N@@H+](C)Cc1nccs1 ZINC000929767411 646297886 /nfs/dbraw/zinc/29/78/86/646297886.db2.gz DZYMSJSCVLYXBU-ONNFQVAWSA-N 1 2 226.345 2.168 20 0 BEADLO CC(C)(C)NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000929776200 646303807 /nfs/dbraw/zinc/30/38/07/646303807.db2.gz GIDWZMBFOYMOAW-UHFFFAOYSA-N 1 2 217.272 2.091 20 0 BEADLO CO[C@@H]1CC[N@H+](Cc2coc(C(C)(C)C)n2)C1 ZINC000929791964 646322257 /nfs/dbraw/zinc/32/22/57/646322257.db2.gz IPIKCBLPYTXCHC-LLVKDONJSA-N 1 2 238.331 2.193 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2coc(C(C)(C)C)n2)C1 ZINC000929791964 646322262 /nfs/dbraw/zinc/32/22/62/646322262.db2.gz IPIKCBLPYTXCHC-LLVKDONJSA-N 1 2 238.331 2.193 20 0 BEADLO FC(F)(F)[C@@H]1CCC[C@@H](Cn2cc[nH+]c2)O1 ZINC000929865362 646365148 /nfs/dbraw/zinc/36/51/48/646365148.db2.gz CWGUBLIJXVBSNR-IUCAKERBSA-N 1 2 234.221 2.383 20 0 BEADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@@H](C)c1cn[nH]c1 ZINC000925633236 646377704 /nfs/dbraw/zinc/37/77/04/646377704.db2.gz COJTVKCGNCIJLP-GZMMTYOYSA-N 1 2 246.314 2.434 20 0 BEADLO Cc1nonc1[C@@H](C)[NH2+][C@@H](C)c1ccc[nH]1 ZINC000925644972 646388069 /nfs/dbraw/zinc/38/80/69/646388069.db2.gz NSPDSWSFIPQGMJ-JGVFFNPUSA-N 1 2 220.276 2.118 20 0 BEADLO COc1nnc(C[NH2+][C@@H](C)c2ccccc2)s1 ZINC000930182491 646482897 /nfs/dbraw/zinc/48/28/97/646482897.db2.gz NEHJZYSVTGFKRU-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO COc1cc([C@H](C)[NH2+]Cc2occc2C)on1 ZINC000926471918 646652012 /nfs/dbraw/zinc/65/20/12/646652012.db2.gz STKQEGZSKUNOSL-VIFPVBQESA-N 1 2 236.271 2.435 20 0 BEADLO CCCCOC(=O)[C@H](C)[NH2+][C@H]1CSC[C@@H]1C ZINC000310023001 711702301 /nfs/dbraw/zinc/70/23/01/711702301.db2.gz OEJHQNLGLMENJX-DCAQKATOSA-N 1 2 245.388 2.059 20 0 BEADLO Cn1c[nH+]cc1COc1ccc(Cl)nc1 ZINC000087543234 711837287 /nfs/dbraw/zinc/83/72/87/711837287.db2.gz RFDXRZFGPQRFLD-UHFFFAOYSA-N 1 2 223.663 2.048 20 0 BEADLO Cc1nc(NCC[C@H]2CCSC2)cc[nH+]1 ZINC000704864071 712119004 /nfs/dbraw/zinc/11/90/04/712119004.db2.gz DIHKXPZENGJXHT-JTQLQIEISA-N 1 2 223.345 2.340 20 0 BEADLO CSC1CC([NH2+][C@H](C)C(=O)OC(C)(C)C)C1 ZINC000706887768 712158801 /nfs/dbraw/zinc/15/88/01/712158801.db2.gz MEYWHGPFOYUNEM-XNWIYYODSA-N 1 2 245.388 2.200 20 0 BEADLO C[N@H+](C/C(Cl)=C\Cl)[C@@H]1CCCOC1 ZINC000379382747 712379699 /nfs/dbraw/zinc/37/96/99/712379699.db2.gz FONSDPIIKSZXHH-WHXYTISESA-N 1 2 224.131 2.416 20 0 BEADLO C[N@@H+](C/C(Cl)=C\Cl)[C@@H]1CCCOC1 ZINC000379382747 712379700 /nfs/dbraw/zinc/37/97/00/712379700.db2.gz FONSDPIIKSZXHH-WHXYTISESA-N 1 2 224.131 2.416 20 0 BEADLO CC[N@H+](C/C(Cl)=C/Cl)[C@H]1CCOC1 ZINC000379387811 712380453 /nfs/dbraw/zinc/38/04/53/712380453.db2.gz IGBFIXVXVWXNJL-RDOCRHDPSA-N 1 2 224.131 2.416 20 0 BEADLO CC[N@@H+](C/C(Cl)=C/Cl)[C@H]1CCOC1 ZINC000379387811 712380454 /nfs/dbraw/zinc/38/04/54/712380454.db2.gz IGBFIXVXVWXNJL-RDOCRHDPSA-N 1 2 224.131 2.416 20 0 BEADLO Cc1cc(CNc2cc[nH+]c(C)n2)c(C)o1 ZINC000390471412 712418757 /nfs/dbraw/zinc/41/87/57/712418757.db2.gz JGVDXVVNAZBQNS-UHFFFAOYSA-N 1 2 217.272 2.029 20 0 BEADLO CCOC1CC2(C[C@@H]2Nc2cc[nH+]cc2F)C1 ZINC000721202008 712898467 /nfs/dbraw/zinc/89/84/67/712898467.db2.gz NXFXVPCGUKRFKC-YHECAPGISA-N 1 2 236.290 2.012 20 0 BEADLO CC[C@](C)([NH2+]CCc1cccs1)C(=O)OC ZINC000381395453 710632012 /nfs/dbraw/zinc/63/20/12/710632012.db2.gz PLRFKKMITHCBRO-LBPRGKRZSA-N 1 2 241.356 2.222 20 0 BEADLO CCC[C@@H]([NH2+][C@H]1CC12CCC2)C(=O)OCC ZINC000721220456 712899186 /nfs/dbraw/zinc/89/91/86/712899186.db2.gz JJJFWYMSZOXLHP-MNOVXSKESA-N 1 2 225.332 2.250 20 0 BEADLO CC(C)=CC[NH+]1CC(N(C)C(=O)C2=CCCC2)C1 ZINC001042608758 710794512 /nfs/dbraw/zinc/79/45/12/710794512.db2.gz OTBZOUWDIXYFCN-UHFFFAOYSA-N 1 2 248.370 2.206 20 0 BEADLO Cc1ccc(CSCC[NH+]2CCOCC2)o1 ZINC000901675156 710872666 /nfs/dbraw/zinc/87/26/66/710872666.db2.gz XNIBEYBKCVIDGO-UHFFFAOYSA-N 1 2 241.356 2.153 20 0 BEADLO CCc1ncc(COc2cc[nH+]cc2)o1 ZINC000902732919 710886930 /nfs/dbraw/zinc/88/69/30/710886930.db2.gz FFOXNGILKGWCBD-UHFFFAOYSA-N 1 2 204.229 2.211 20 0 BEADLO CCN(CCC1CC1)c1cc(NC)[nH+]cn1 ZINC000385664578 711015631 /nfs/dbraw/zinc/01/56/31/711015631.db2.gz CVWILVMCYNACTD-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO CCN(CCC1CC1)c1cc(NC)nc[nH+]1 ZINC000385664578 711015634 /nfs/dbraw/zinc/01/56/34/711015634.db2.gz CVWILVMCYNACTD-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO Cc1cc(C[NH2+]Cc2nc(C)c(C)s2)[nH]n1 ZINC000390431751 711116478 /nfs/dbraw/zinc/11/64/78/711116478.db2.gz AIZQTXQZTOLPEY-UHFFFAOYSA-N 1 2 236.344 2.081 20 0 BEADLO CC[C@@H]([NH2+]CC(F)(F)C(F)F)[C@@H]1CCCO1 ZINC000390768692 711133718 /nfs/dbraw/zinc/13/37/18/711133718.db2.gz TXSSNRJZWIWNQJ-SFYZADRCSA-N 1 2 243.244 2.434 20 0 BEADLO CO[C@H]1C[C@@H]([N@H+](C)C/C(Cl)=C\Cl)C1 ZINC000393708127 711170285 /nfs/dbraw/zinc/17/02/85/711170285.db2.gz BJLJKEYFYSVOOB-AXDPDMTESA-N 1 2 224.131 2.415 20 0 BEADLO CO[C@H]1C[C@@H]([N@@H+](C)C/C(Cl)=C\Cl)C1 ZINC000393708127 711170289 /nfs/dbraw/zinc/17/02/89/711170289.db2.gz BJLJKEYFYSVOOB-AXDPDMTESA-N 1 2 224.131 2.415 20 0 BEADLO C[C@@H]1[C@H](O)CCC[N@@H+]1C/C(Cl)=C\Cl ZINC000395042061 711201255 /nfs/dbraw/zinc/20/12/55/711201255.db2.gz JQCVFKDFEPSIIH-DAAJKXQRSA-N 1 2 224.131 2.151 20 0 BEADLO C[C@@H]1[C@H](O)CCC[N@H+]1C/C(Cl)=C\Cl ZINC000395042061 711201258 /nfs/dbraw/zinc/20/12/58/711201258.db2.gz JQCVFKDFEPSIIH-DAAJKXQRSA-N 1 2 224.131 2.151 20 0 BEADLO O[C@H](C[NH2+][C@@H]1CCCC1(F)F)c1ccccc1 ZINC000398140563 711403334 /nfs/dbraw/zinc/40/33/34/711403334.db2.gz WFUMPAXVEMOSAA-VXGBXAGGSA-N 1 2 241.281 2.497 20 0 BEADLO CC[C@H]([NH2+]Cc1cnn[nH]1)c1ccccc1OC ZINC000398334686 711407679 /nfs/dbraw/zinc/40/76/79/711407679.db2.gz JVYXXFZHBYMILD-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO Fc1ccc2c(c1)CC[C@@H]2[NH2+]Cc1c[nH]cn1 ZINC000134287470 711498562 /nfs/dbraw/zinc/49/85/62/711498562.db2.gz LSTJNIJXRZMOGR-ZDUSSCGKSA-N 1 2 231.274 2.326 20 0 BEADLO CNc1cc(N(Cc2ccoc2)C2CC2)nc[nH+]1 ZINC000723719406 711535467 /nfs/dbraw/zinc/53/54/67/711535467.db2.gz OHKZWKITWXGLSN-UHFFFAOYSA-N 1 2 244.298 2.280 20 0 BEADLO CNc1cc(N(Cc2ccoc2)C2CC2)[nH+]cn1 ZINC000723719406 711535471 /nfs/dbraw/zinc/53/54/71/711535471.db2.gz OHKZWKITWXGLSN-UHFFFAOYSA-N 1 2 244.298 2.280 20 0 BEADLO CNc1cc(N2CCC(C3CC3)CC2)nc[nH+]1 ZINC000724813230 711616541 /nfs/dbraw/zinc/61/65/41/711616541.db2.gz GXKFLBCUOVGLPF-UHFFFAOYSA-N 1 2 232.331 2.145 20 0 BEADLO CNc1cc(N2CCC(C3CC3)CC2)[nH+]cn1 ZINC000724813230 711616545 /nfs/dbraw/zinc/61/65/45/711616545.db2.gz GXKFLBCUOVGLPF-UHFFFAOYSA-N 1 2 232.331 2.145 20 0 BEADLO Cc1cn[nH]c1C[NH+]1CCC(c2ncco2)CC1 ZINC000931443064 711715064 /nfs/dbraw/zinc/71/50/64/711715064.db2.gz NCZATMRMPJOKSS-UHFFFAOYSA-N 1 2 246.314 2.086 20 0 BEADLO C[C@H](CC(C)(C)C)NC(=O)CNc1cccc[nH+]1 ZINC000909554897 711783342 /nfs/dbraw/zinc/78/33/42/711783342.db2.gz BJEVIMZJMHEHSP-LLVKDONJSA-N 1 2 249.358 2.434 20 0 BEADLO CC1=C(C(=O)OCc2ccc(N)[nH+]c2)CCC1 ZINC000922548631 711973120 /nfs/dbraw/zinc/97/31/20/711973120.db2.gz SVAIDQFXTUGUNZ-UHFFFAOYSA-N 1 2 232.283 2.207 20 0 BEADLO C[C@@H]1CC=C(C(=O)OCc2ccc[nH+]c2N)CC1 ZINC000922794937 711976618 /nfs/dbraw/zinc/97/66/18/711976618.db2.gz QIQNSCXUHYFJRD-SNVBAGLBSA-N 1 2 246.310 2.453 20 0 BEADLO COc1cncc(C[NH2+]Cc2nc(C)cs2)c1 ZINC000700016306 711982407 /nfs/dbraw/zinc/98/24/07/711982407.db2.gz FSAJMCQEPLSIDD-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO CCCNc1cc(NCC[C@@H](C)F)nc[nH+]1 ZINC000702570294 712055648 /nfs/dbraw/zinc/05/56/48/712055648.db2.gz HJUTZPYQLFPAHU-SECBINFHSA-N 1 2 226.299 2.459 20 0 BEADLO CCCNc1cc(NCC[C@@H](C)F)[nH+]cn1 ZINC000702570294 712055649 /nfs/dbraw/zinc/05/56/49/712055649.db2.gz HJUTZPYQLFPAHU-SECBINFHSA-N 1 2 226.299 2.459 20 0 BEADLO FC(F)[C@H]1CC[N@H+](Cc2ccc(Cl)nn2)C1 ZINC000707168270 712166233 /nfs/dbraw/zinc/16/62/33/712166233.db2.gz PLKLEMKMMXZCPS-ZETCQYMHSA-N 1 2 247.676 2.217 20 0 BEADLO FC(F)[C@H]1CC[N@@H+](Cc2ccc(Cl)nn2)C1 ZINC000707168270 712166234 /nfs/dbraw/zinc/16/62/34/712166234.db2.gz PLKLEMKMMXZCPS-ZETCQYMHSA-N 1 2 247.676 2.217 20 0 BEADLO C[C@]1(C(F)(F)F)CC[N@H+](Cc2ncc[nH]2)C1 ZINC000708621473 712195745 /nfs/dbraw/zinc/19/57/45/712195745.db2.gz ZVVBOEGTMZCDKB-VIFPVBQESA-N 1 2 233.237 2.184 20 0 BEADLO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2ncc[nH]2)C1 ZINC000708621473 712195746 /nfs/dbraw/zinc/19/57/46/712195746.db2.gz ZVVBOEGTMZCDKB-VIFPVBQESA-N 1 2 233.237 2.184 20 0 BEADLO Nc1[nH+]cccc1CSc1nccn1C1CC1 ZINC000709741669 712217684 /nfs/dbraw/zinc/21/76/84/712217684.db2.gz LVZQNAIAIHAVLK-UHFFFAOYSA-N 1 2 246.339 2.488 20 0 BEADLO C[C@@H](O)C[N@H+](C/C(Cl)=C\Cl)C1CC1 ZINC000709487211 712222746 /nfs/dbraw/zinc/22/27/46/712222746.db2.gz YZWMJRFZTNNGMF-VKDKVYATSA-N 1 2 224.131 2.151 20 0 BEADLO C[C@@H](O)C[N@@H+](C/C(Cl)=C\Cl)C1CC1 ZINC000709487211 712222747 /nfs/dbraw/zinc/22/27/47/712222747.db2.gz YZWMJRFZTNNGMF-VKDKVYATSA-N 1 2 224.131 2.151 20 0 BEADLO Cc1noc(C)c1[C@@H](C)[NH2+][C@H](C)c1cn(C)cn1 ZINC000710022243 712241505 /nfs/dbraw/zinc/24/15/05/712241505.db2.gz BPCLZXRASSZCQM-RKDXNWHRSA-N 1 2 248.330 2.437 20 0 BEADLO Oc1cccc(C[NH2+]Cc2nccn2C2CC2)c1 ZINC000711752665 712325117 /nfs/dbraw/zinc/32/51/17/712325117.db2.gz RYTBNLUCUYZEIS-UHFFFAOYSA-N 1 2 243.310 2.213 20 0 BEADLO Cc1nc(N[C@@H](C2CCC2)[C@H]2CCOC2)cc[nH+]1 ZINC000711869897 712336981 /nfs/dbraw/zinc/33/69/81/712336981.db2.gz MDHWWOHFPVOOMH-JSGCOSHPSA-N 1 2 247.342 2.402 20 0 BEADLO C[C@H]([NH2+][C@H]1CCn2ccnc21)c1ccco1 ZINC000379017401 712368841 /nfs/dbraw/zinc/36/88/41/712368841.db2.gz RCCINODALNBXPS-UWVGGRQHSA-N 1 2 217.272 2.272 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](CCF)CCO2 ZINC000796429554 712424838 /nfs/dbraw/zinc/42/48/38/712424838.db2.gz IOQFEYXKBMIUKD-UHFFFAOYSA-N 1 2 209.264 2.159 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](CCF)CCO2 ZINC000796429554 712424840 /nfs/dbraw/zinc/42/48/40/712424840.db2.gz IOQFEYXKBMIUKD-UHFFFAOYSA-N 1 2 209.264 2.159 20 0 BEADLO CC[NH2+]Cc1noc(C[C@@H]2CCCC2(F)F)n1 ZINC000713927193 712473205 /nfs/dbraw/zinc/47/32/05/712473205.db2.gz DUVLCBXLWJYDBX-QMMMGPOBSA-N 1 2 245.273 2.157 20 0 BEADLO CCCn1cc([C@@H](C)[NH2+]Cc2ccoc2)nn1 ZINC000715894716 712540810 /nfs/dbraw/zinc/54/08/10/712540810.db2.gz JPVFKDFRKIWRJR-SNVBAGLBSA-N 1 2 234.303 2.132 20 0 BEADLO C[C@@H]([NH2+]Cc1cscn1)c1ccns1 ZINC000715943611 712544492 /nfs/dbraw/zinc/54/44/92/712544492.db2.gz NCEGMWIBZMDWJY-SSDOTTSWSA-N 1 2 225.342 2.450 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1nccn1C)c1ccns1 ZINC000716036246 712547663 /nfs/dbraw/zinc/54/76/63/712547663.db2.gz ZYJHLMIXFGYSRZ-RKDXNWHRSA-N 1 2 236.344 2.288 20 0 BEADLO Cc1ncc(C[NH2+][C@@H](C)c2ccns2)o1 ZINC000716013196 712552576 /nfs/dbraw/zinc/55/25/76/712552576.db2.gz FLLUINWVTJPJAY-ZETCQYMHSA-N 1 2 223.301 2.290 20 0 BEADLO c1cn(C[C@@H]2CCC3(CCC3)CO2)c[nH+]1 ZINC000716287726 712553920 /nfs/dbraw/zinc/55/39/20/712553920.db2.gz VQHIPDZNLWHAFN-NSHDSACASA-N 1 2 206.289 2.232 20 0 BEADLO Cc1[nH]ncc1C[NH2+]C[C@H]1CCC2(CCC2)CO1 ZINC000716592868 712564578 /nfs/dbraw/zinc/56/45/78/712564578.db2.gz GROAZLKXZTVRSM-CYBMUJFWSA-N 1 2 249.358 2.157 20 0 BEADLO CC[C@@H](C[C@@H](C)O)Nc1[nH+]cccc1OC ZINC000716879626 712580086 /nfs/dbraw/zinc/58/00/86/712580086.db2.gz KXYWRDBISBWXBC-ZJUUUORDSA-N 1 2 224.304 2.052 20 0 BEADLO CC1CC(CNC(=O)c2cc3c[nH+]ccc3[nH]2)C1 ZINC000826863674 712592663 /nfs/dbraw/zinc/59/26/63/712592663.db2.gz BQEYZZZUGQTFEQ-UHFFFAOYSA-N 1 2 243.310 2.339 20 0 BEADLO CCC[C@H]([NH2+]C[C@H]1CCC=CO1)C(=O)OCC ZINC000379919826 712626938 /nfs/dbraw/zinc/62/69/38/712626938.db2.gz QCOKUEZLKWHZFK-NEPJUHHUSA-N 1 2 241.331 2.001 20 0 BEADLO CCCCOC(=O)C[NH2+][C@@H]1CCC1(C)C ZINC000379990140 712644978 /nfs/dbraw/zinc/64/49/78/712644978.db2.gz XCWXQUDCVUSFGR-SNVBAGLBSA-N 1 2 213.321 2.108 20 0 BEADLO CCc1ccc(C(=O)NCc2[nH]c[nH+]c2C)s1 ZINC000380170446 712705461 /nfs/dbraw/zinc/70/54/61/712705461.db2.gz JOZVOVWKRKJGKK-UHFFFAOYSA-N 1 2 249.339 2.272 20 0 BEADLO C=C/C=C\CC[N@@H+]1CCC[C@H]1c1nnc[nH]1 ZINC000931142780 712713574 /nfs/dbraw/zinc/71/35/74/712713574.db2.gz FPIGBPLMDGXUIL-BYCRGOAPSA-N 1 2 218.304 2.074 20 0 BEADLO C=C/C=C\CC[N@H+]1CCC[C@H]1c1nnc[nH]1 ZINC000931142780 712713575 /nfs/dbraw/zinc/71/35/75/712713575.db2.gz FPIGBPLMDGXUIL-BYCRGOAPSA-N 1 2 218.304 2.074 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CC12CCC2 ZINC000721185558 712895306 /nfs/dbraw/zinc/89/53/06/712895306.db2.gz BRUONBAPJAQJEJ-JTQLQIEISA-N 1 2 204.273 2.445 20 0 BEADLO CCOC(C)(C)C[NH+]1CC(F)(C2CC2)C1 ZINC001209066250 957305713 /nfs/dbraw/zinc/30/57/13/957305713.db2.gz ARYNCVRROAJVQV-UHFFFAOYSA-N 1 2 215.312 2.235 20 0 BEADLO CNc1ccc(Nc2nccs2)c[nH+]1 ZINC000307129922 957659433 /nfs/dbraw/zinc/65/94/33/957659433.db2.gz FWUUGJHELKFNHH-UHFFFAOYSA-N 1 2 206.274 2.323 20 0 BEADLO CCc1ccc(NC(=O)C[C@@H]([NH3+])C(F)F)cc1 ZINC000724762893 959303757 /nfs/dbraw/zinc/30/37/57/959303757.db2.gz TUYVFZOWQUCTCC-SNVBAGLBSA-N 1 2 242.269 2.170 20 0 BEADLO CCC1(CC)CCN(C(=O)C[C@H]([NH3+])C(F)F)C1 ZINC000724754815 959365641 /nfs/dbraw/zinc/36/56/41/959365641.db2.gz HDPTZERCJUVVJF-VIFPVBQESA-N 1 2 248.317 2.008 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC(=O)[C@H](C)C2)c1C ZINC001140858426 960634473 /nfs/dbraw/zinc/63/44/73/960634473.db2.gz JCMFAELAYQQCNS-SNVBAGLBSA-N 1 2 220.316 2.042 20 0 BEADLO FC(F)(F)c1ccncc1C[NH+]1CC=CC1 ZINC001140916160 960690199 /nfs/dbraw/zinc/69/01/99/960690199.db2.gz ZEXFKXNKWDNDCS-UHFFFAOYSA-N 1 2 228.217 2.472 20 0 BEADLO F[C@H]1CC[N@H+](Cc2ncco2)CCC1(F)F ZINC001141005578 960806042 /nfs/dbraw/zinc/80/60/42/960806042.db2.gz MNZKHJYBWSIQNB-QMMMGPOBSA-N 1 2 234.221 2.244 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2ncco2)CCC1(F)F ZINC001141005578 960806045 /nfs/dbraw/zinc/80/60/45/960806045.db2.gz MNZKHJYBWSIQNB-QMMMGPOBSA-N 1 2 234.221 2.244 20 0 BEADLO C[C@@H]1CC[N@@H+]1Cc1c[nH]nc1C(F)(F)F ZINC001141012273 960818275 /nfs/dbraw/zinc/81/82/75/960818275.db2.gz XUMGRGJZYXCXPY-ZCFIWIBFSA-N 1 2 219.210 2.023 20 0 BEADLO C[C@@H]1CC[N@H+]1Cc1c[nH]nc1C(F)(F)F ZINC001141012273 960818280 /nfs/dbraw/zinc/81/82/80/960818280.db2.gz XUMGRGJZYXCXPY-ZCFIWIBFSA-N 1 2 219.210 2.023 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1CC(C)(C)O1 ZINC001157662970 963695296 /nfs/dbraw/zinc/69/52/96/963695296.db2.gz OOZFNIYLPWTUMC-SECBINFHSA-N 1 2 222.288 2.070 20 0 BEADLO Cc1c(F)cc[nH+]c1NC1COC(C)(C)OC1 ZINC001158063532 963801209 /nfs/dbraw/zinc/80/12/09/963801209.db2.gz POWDTBDCSPJVRQ-UHFFFAOYSA-N 1 2 240.278 2.093 20 0 BEADLO CC(=O)CC(C)(C)Nc1nc(C)[nH+]cc1C ZINC001160294255 964277580 /nfs/dbraw/zinc/27/75/80/964277580.db2.gz ALBLUJIYWYCVKD-UHFFFAOYSA-N 1 2 221.304 2.263 20 0 BEADLO Fc1c[nH]c2nc[nH+]c(NCC(F)(F)F)c12 ZINC001161626125 964651844 /nfs/dbraw/zinc/65/18/44/964651844.db2.gz RJLJBAQLJSWORL-UHFFFAOYSA-N 1 2 234.156 2.071 20 0 BEADLO COC(=O)[C@@H](C)c1ccc(NCC(C)C)[nH+]c1 ZINC001161647146 964661042 /nfs/dbraw/zinc/66/10/42/964661042.db2.gz LOEVNHXGSMYMNK-JTQLQIEISA-N 1 2 236.315 2.426 20 0 BEADLO COc1cc[nH+]cc1NCCCSC ZINC001163874512 965613291 /nfs/dbraw/zinc/61/32/91/965613291.db2.gz DTPRQTNFCDTFIU-UHFFFAOYSA-N 1 2 212.318 2.255 20 0 BEADLO Nc1[nH+]c(N2C[C@@H]3C[C@@H]3[C@H](F)C2)ccc1Cl ZINC001165366108 966066537 /nfs/dbraw/zinc/06/65/37/966066537.db2.gz AJUIEGHZJNIJMA-ACLDMZEESA-N 1 2 241.697 2.111 20 0 BEADLO Cc1cc2cc(N[C@H](C)CCO)[nH+]cc2[nH]1 ZINC001165867189 966181079 /nfs/dbraw/zinc/18/10/79/966181079.db2.gz NZEGKVHUDUBFGK-MRVPVSSYSA-N 1 2 219.288 2.054 20 0 BEADLO c1cc(C[N@@H+]2C[C@H]3CC[C@@H]2CO3)cs1 ZINC001204045890 966868078 /nfs/dbraw/zinc/86/80/78/966868078.db2.gz SCNATQMCGGJSQZ-GHMZBOCLSA-N 1 2 209.314 2.111 20 0 BEADLO c1cc(C[N@H+]2C[C@H]3CC[C@@H]2CO3)cs1 ZINC001204045890 966868087 /nfs/dbraw/zinc/86/80/87/966868087.db2.gz SCNATQMCGGJSQZ-GHMZBOCLSA-N 1 2 209.314 2.111 20 0 BEADLO C[C@@H]1C[C@@H](C[NH+]2CC(C)(F)C2)C[C@H](C)O1 ZINC001209381234 1165805708 /nfs/dbraw/zinc/80/57/08/1165805708.db2.gz DHIRNABGOYXMPP-JGPRNRPPSA-N 1 2 215.312 2.234 20 0 BEADLO Cc1c(C[N@@H+]2CC[C@@](C)(F)[C@@H](F)C2)cnn1C ZINC001204570039 967058172 /nfs/dbraw/zinc/05/81/72/967058172.db2.gz ZDIXXOGKNMFQMN-NWDGAFQWSA-N 1 2 243.301 2.001 20 0 BEADLO Cc1c(C[N@H+]2CC[C@@](C)(F)[C@@H](F)C2)cnn1C ZINC001204570039 967058186 /nfs/dbraw/zinc/05/81/86/967058186.db2.gz ZDIXXOGKNMFQMN-NWDGAFQWSA-N 1 2 243.301 2.001 20 0 BEADLO CC1(C)CCC[C@H](OCC[NH+]2CCOCC2)C1 ZINC001210224927 1165853401 /nfs/dbraw/zinc/85/34/01/1165853401.db2.gz KORBUCZNRBYSEA-ZDUSSCGKSA-N 1 2 241.375 2.304 20 0 BEADLO Cc1coc(Nc2c[nH+]c(C)c(N)c2)n1 ZINC001210284550 1165863114 /nfs/dbraw/zinc/86/31/14/1165863114.db2.gz IIOIDWJGOJYZAK-UHFFFAOYSA-N 1 2 204.233 2.012 20 0 BEADLO C[C@H]1CCCCN(C(=O)CCc2[nH+]ccn2C)C1 ZINC001347163200 1165916391 /nfs/dbraw/zinc/91/63/91/1165916391.db2.gz UJRUXHBXAKSNDV-LBPRGKRZSA-N 1 2 249.358 2.001 20 0 BEADLO O=C1CC(Nc2[nH+]cccc2C2CCOCC2)C1 ZINC001167338602 1165915641 /nfs/dbraw/zinc/91/56/41/1165915641.db2.gz FNMBINWXCLFOSP-UHFFFAOYSA-N 1 2 246.310 2.119 20 0 BEADLO Cc1ncc(C[NH2+][C@@H]2CCc3cccnc32)o1 ZINC000397936889 1165961668 /nfs/dbraw/zinc/96/16/68/1165961668.db2.gz GXGPKCNLDYVWAY-GFCCVEGCSA-N 1 2 229.283 2.155 20 0 BEADLO COc1cc[nH+]c(Nc2cnc(OC)c(F)c2)c1 ZINC001203401057 1166012244 /nfs/dbraw/zinc/01/22/44/1166012244.db2.gz NNXQOTHBCSORGN-UHFFFAOYSA-N 1 2 249.245 2.377 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1scnc1C ZINC001206991506 968527086 /nfs/dbraw/zinc/52/70/86/968527086.db2.gz JMMZSIKXPIYYSM-NSHDSACASA-N 1 2 238.356 2.395 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@H+]1Cc1scnc1C ZINC001206991506 968527091 /nfs/dbraw/zinc/52/70/91/968527091.db2.gz JMMZSIKXPIYYSM-NSHDSACASA-N 1 2 238.356 2.395 20 0 BEADLO Fc1cccnc1C[NH+]1CC2(CCC2)C1 ZINC001207029829 968561798 /nfs/dbraw/zinc/56/17/98/968561798.db2.gz UKESOXZEXRQEQN-UHFFFAOYSA-N 1 2 206.264 2.207 20 0 BEADLO CC(=O)[C@H]1CCCC[N@@H+]1Cc1c(C)noc1C ZINC000111691862 1166054604 /nfs/dbraw/zinc/05/46/04/1166054604.db2.gz CTOGPIITMMOHBT-CYBMUJFWSA-N 1 2 236.315 2.235 20 0 BEADLO CC(=O)[C@H]1CCCC[N@H+]1Cc1c(C)noc1C ZINC000111691862 1166054612 /nfs/dbraw/zinc/05/46/12/1166054612.db2.gz CTOGPIITMMOHBT-CYBMUJFWSA-N 1 2 236.315 2.235 20 0 BEADLO Cc1cc(-c2cccc(O)c2)c[nH+]c1N ZINC000082730035 1166076158 /nfs/dbraw/zinc/07/61/58/1166076158.db2.gz SSIZFZQEYSTNKB-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO O=C1CCC[N@@H+](CC2CCSCC2)C[C@H]1F ZINC001207697153 968863659 /nfs/dbraw/zinc/86/36/59/968863659.db2.gz YBTVNHWFJRZMJO-LLVKDONJSA-N 1 2 245.363 2.133 20 0 BEADLO O=C1CCC[N@H+](CC2CCSCC2)C[C@H]1F ZINC001207697153 968863666 /nfs/dbraw/zinc/86/36/66/968863666.db2.gz YBTVNHWFJRZMJO-LLVKDONJSA-N 1 2 245.363 2.133 20 0 BEADLO CCC[C@H](O)CNc1c[nH+]c(C)cc1C ZINC001252774470 968941000 /nfs/dbraw/zinc/94/10/00/968941000.db2.gz NDGIFYDKQDWTFZ-NSHDSACASA-N 1 2 208.305 2.271 20 0 BEADLO C[C@H](Nc1cc(N)cc(Cl)[nH+]1)[C@@H]1CCCO1 ZINC000228877189 1166226605 /nfs/dbraw/zinc/22/66/05/1166226605.db2.gz HCALIVFEBQXBBN-CBAPKCEASA-N 1 2 241.722 2.297 20 0 BEADLO C[C@@H]1C[C@@H]1c1nnc([C@@H]([NH3+])c2ccccc2)o1 ZINC000224321186 1166230454 /nfs/dbraw/zinc/23/04/54/1166230454.db2.gz TVSRZZWGFWMHLR-MIMYLULJSA-N 1 2 229.283 2.241 20 0 BEADLO CC(C)CCC[N@@H+]1C[C@@H](CO)CC(F)(F)C1 ZINC001208735045 969220247 /nfs/dbraw/zinc/22/02/47/969220247.db2.gz RIPWXQBJJZKBOS-NSHDSACASA-N 1 2 235.318 2.372 20 0 BEADLO CC(C)CCC[N@H+]1C[C@@H](CO)CC(F)(F)C1 ZINC001208735045 969220255 /nfs/dbraw/zinc/22/02/55/969220255.db2.gz RIPWXQBJJZKBOS-NSHDSACASA-N 1 2 235.318 2.372 20 0 BEADLO CC[N@H+](C[C@@H](C)C(F)(F)F)[C@@H](C)C(=O)OC ZINC001208898769 969286059 /nfs/dbraw/zinc/28/60/59/969286059.db2.gz ZDEYYWOUSGBLJD-SFYZADRCSA-N 1 2 241.253 2.068 20 0 BEADLO CC[N@@H+](C[C@@H](C)C(F)(F)F)[C@@H](C)C(=O)OC ZINC001208898769 969286069 /nfs/dbraw/zinc/28/60/69/969286069.db2.gz ZDEYYWOUSGBLJD-SFYZADRCSA-N 1 2 241.253 2.068 20 0 BEADLO CCC(=O)C(C)(C)C[N@H+](C)Cc1ccon1 ZINC001208919696 969306522 /nfs/dbraw/zinc/30/65/22/969306522.db2.gz DGGKKEDHSVJZCQ-UHFFFAOYSA-N 1 2 224.304 2.112 20 0 BEADLO CCC(=O)C(C)(C)C[N@@H+](C)Cc1ccon1 ZINC001208919696 969306526 /nfs/dbraw/zinc/30/65/26/969306526.db2.gz DGGKKEDHSVJZCQ-UHFFFAOYSA-N 1 2 224.304 2.112 20 0 BEADLO Oc1ccc(C[N@@H+]2CC[C@H](F)C2)cc1F ZINC000689849721 1166365498 /nfs/dbraw/zinc/36/54/98/1166365498.db2.gz PKLDHEXJQOOAPO-VIFPVBQESA-N 1 2 213.227 2.075 20 0 BEADLO Oc1ccc(C[N@H+]2CC[C@H](F)C2)cc1F ZINC000689849721 1166365502 /nfs/dbraw/zinc/36/55/02/1166365502.db2.gz PKLDHEXJQOOAPO-VIFPVBQESA-N 1 2 213.227 2.075 20 0 BEADLO CC[N@H+](C)Cc1ncccc1Br ZINC000306536795 1166366598 /nfs/dbraw/zinc/36/65/98/1166366598.db2.gz QVTVCMWTQJKWDL-UHFFFAOYSA-N 1 2 229.121 2.296 20 0 BEADLO CC[N@@H+](C)Cc1ncccc1Br ZINC000306536795 1166366605 /nfs/dbraw/zinc/36/66/05/1166366605.db2.gz QVTVCMWTQJKWDL-UHFFFAOYSA-N 1 2 229.121 2.296 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC[C@H]2CCC[C@H]2C1 ZINC001209551843 969536553 /nfs/dbraw/zinc/53/65/53/969536553.db2.gz CETSMPNPCFCORN-NEPJUHHUSA-N 1 2 219.332 2.340 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC[C@H]2CCC[C@H]2C1 ZINC001209551843 969536559 /nfs/dbraw/zinc/53/65/59/969536559.db2.gz CETSMPNPCFCORN-NEPJUHHUSA-N 1 2 219.332 2.340 20 0 BEADLO FC(F)[C@@H]1CCC[N@H+](Cc2ccon2)C1 ZINC001209564799 969547405 /nfs/dbraw/zinc/54/74/05/969547405.db2.gz FDBDOANVTFARNN-MRVPVSSYSA-N 1 2 216.231 2.152 20 0 BEADLO FC(F)[C@@H]1CCC[N@@H+](Cc2ccon2)C1 ZINC001209564799 969547411 /nfs/dbraw/zinc/54/74/11/969547411.db2.gz FDBDOANVTFARNN-MRVPVSSYSA-N 1 2 216.231 2.152 20 0 BEADLO CCOC(=O)[C@@H]1CCC[C@@H]([NH2+][C@H]2CC2(F)F)C1 ZINC001255337328 970119478 /nfs/dbraw/zinc/11/94/78/970119478.db2.gz PNYQGVSSBLJMOC-BBBLOLIVSA-N 1 2 247.285 2.106 20 0 BEADLO Cc1cccnc1C[NH2+][C@H]1C[C@@H](C)n2ccnc21 ZINC000379004647 1166628680 /nfs/dbraw/zinc/62/86/80/1166628680.db2.gz DLSAVSCBIUGLNQ-NEPJUHHUSA-N 1 2 242.326 2.382 20 0 BEADLO Nc1ccc(-c2ccc(C3OCCO3)cc2)c[nH+]1 ZINC000016948033 1166645095 /nfs/dbraw/zinc/64/50/95/1166645095.db2.gz PJKHELRJVYJOCF-UHFFFAOYSA-N 1 2 242.278 2.376 20 0 BEADLO CC(C)(CNc1nccs1)n1cc[nH+]c1 ZINC000692585478 1166656855 /nfs/dbraw/zinc/65/68/55/1166656855.db2.gz STZFJQVMKUXZOV-UHFFFAOYSA-N 1 2 222.317 2.187 20 0 BEADLO Nc1cc(N2CC[C@@H]3CCCC[C@@H]3C2)[nH+]cn1 ZINC000129831923 1166826779 /nfs/dbraw/zinc/82/67/79/1166826779.db2.gz CMVNGQPULPVDHR-WDEREUQCSA-N 1 2 232.331 2.075 20 0 BEADLO CCOC(=O)C1([NH2+][C@@H]2CC[C@H](CC)C2)CC1 ZINC001173267374 975130875 /nfs/dbraw/zinc/13/08/75/975130875.db2.gz RHRJAGSBCJSORT-WDEREUQCSA-N 1 2 225.332 2.250 20 0 BEADLO Cc1ncc(C[N@@H+](C)CCC(F)(F)F)o1 ZINC001332569173 975218189 /nfs/dbraw/zinc/21/81/89/975218189.db2.gz RDUMUUMMVNUKJK-UHFFFAOYSA-N 1 2 222.210 2.367 20 0 BEADLO CCCCOC(=O)[C@H](C)[NH2+][C@H](C)CSCC ZINC001173286603 975247890 /nfs/dbraw/zinc/24/78/90/975247890.db2.gz BWNJYPFJDNLXCY-MNOVXSKESA-N 1 2 247.404 2.449 20 0 BEADLO CC[C@@H](C)Nc1[nH+]ccc(OC)c1C(=O)OC ZINC001168001386 1167138654 /nfs/dbraw/zinc/13/86/54/1167138654.db2.gz XPRQPMPCINMEMZ-MRVPVSSYSA-N 1 2 238.287 2.087 20 0 BEADLO CC[C@H](C)Nc1[nH+]ccc(OC)c1C(=O)OC ZINC001168001388 1167139699 /nfs/dbraw/zinc/13/96/99/1167139699.db2.gz XPRQPMPCINMEMZ-QMMMGPOBSA-N 1 2 238.287 2.087 20 0 BEADLO Nc1ccc(F)c(C[NH+]2CCSCC2)c1F ZINC000309241704 1167273800 /nfs/dbraw/zinc/27/38/00/1167273800.db2.gz MOQIKVKFBMUQBO-UHFFFAOYSA-N 1 2 244.310 2.096 20 0 BEADLO CCCC[C@H]1CCC[C@H]1[NH2+]Cc1ncn[nH]1 ZINC000309451780 1167306858 /nfs/dbraw/zinc/30/68/58/1167306858.db2.gz LIRJNBITABMUJK-WDEREUQCSA-N 1 2 222.336 2.253 20 0 BEADLO CCCC[C@@H]1CCC[C@H]1[NH2+]Cc1ncn[nH]1 ZINC000309451775 1167306602 /nfs/dbraw/zinc/30/66/02/1167306602.db2.gz LIRJNBITABMUJK-GHMZBOCLSA-N 1 2 222.336 2.253 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2oncc2c1 ZINC001243473970 970764262 /nfs/dbraw/zinc/76/42/62/970764262.db2.gz GOZNGZQSBJVSIX-UHFFFAOYSA-N 1 2 211.224 2.472 20 0 BEADLO C[N@H+](Cc1ccnc(C(F)F)c1)C1(C)COC1 ZINC001231892449 977785471 /nfs/dbraw/zinc/78/54/71/977785471.db2.gz CKVUVELGOAFDCY-UHFFFAOYSA-N 1 2 242.269 2.240 20 0 BEADLO C[N@@H+](Cc1ccnc(C(F)F)c1)C1(C)COC1 ZINC001231892449 977785484 /nfs/dbraw/zinc/78/54/84/977785484.db2.gz CKVUVELGOAFDCY-UHFFFAOYSA-N 1 2 242.269 2.240 20 0 BEADLO Cc1cccnc1C[NH2+]Cc1ccn(C(C)C)n1 ZINC000085161557 1167613224 /nfs/dbraw/zinc/61/32/24/1167613224.db2.gz RTLBOFBRMXEZDI-UHFFFAOYSA-N 1 2 244.342 2.457 20 0 BEADLO Cc1nnc(C[N@@H+]2CC[C@](C)(CF)C2)s1 ZINC001232243563 977972092 /nfs/dbraw/zinc/97/20/92/977972092.db2.gz UNNMBXQVMXJFRZ-SNVBAGLBSA-N 1 2 229.324 2.028 20 0 BEADLO Cc1nnc(C[N@H+]2CC[C@](C)(CF)C2)s1 ZINC001232243563 977972104 /nfs/dbraw/zinc/97/21/04/977972104.db2.gz UNNMBXQVMXJFRZ-SNVBAGLBSA-N 1 2 229.324 2.028 20 0 BEADLO CCOc1cc(NC=CC(C)(C)O)cc(C)[nH+]1 ZINC001203214812 1167653659 /nfs/dbraw/zinc/65/36/59/1167653659.db2.gz OKKYLYQOZAGODM-VOTSOKGWSA-N 1 2 236.315 2.485 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)CCC(F)F ZINC001337641104 978437448 /nfs/dbraw/zinc/43/74/48/978437448.db2.gz VMUFKYXQZXUTME-UHFFFAOYSA-N 1 2 228.242 2.104 20 0 BEADLO C[C@@H](O)C[N@H+](Cc1csc(Cl)n1)C1CC1 ZINC000691315327 1167783315 /nfs/dbraw/zinc/78/33/15/1167783315.db2.gz VIJCGRBPQUNPMF-SSDOTTSWSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H](O)C[N@@H+](Cc1csc(Cl)n1)C1CC1 ZINC000691315327 1167783321 /nfs/dbraw/zinc/78/33/21/1167783321.db2.gz VIJCGRBPQUNPMF-SSDOTTSWSA-N 1 2 246.763 2.142 20 0 BEADLO Cc1cc(F)cc(N2CCSCC2)[nH+]1 ZINC001337734194 978476876 /nfs/dbraw/zinc/47/68/76/978476876.db2.gz PREFQEGFYKRNQK-UHFFFAOYSA-N 1 2 212.293 2.082 20 0 BEADLO CC(=O)[C@@H]1CCC[N@@H+]1Cc1cc(C)ns1 ZINC001233313729 978537760 /nfs/dbraw/zinc/53/77/60/978537760.db2.gz KHEQRLMDYPYZKW-NSHDSACASA-N 1 2 224.329 2.005 20 0 BEADLO CC(=O)[C@@H]1CCC[N@H+]1Cc1cc(C)ns1 ZINC001233313729 978537770 /nfs/dbraw/zinc/53/77/70/978537770.db2.gz KHEQRLMDYPYZKW-NSHDSACASA-N 1 2 224.329 2.005 20 0 BEADLO Cc1cnsc1C[N@H+]1C[C@@H](C)OC[C@@H]1C ZINC001233322712 978562777 /nfs/dbraw/zinc/56/27/77/978562777.db2.gz QHFDLYTZEUXHIO-VHSXEESVSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1cnsc1C[N@@H+]1C[C@@H](C)OC[C@@H]1C ZINC001233322712 978562781 /nfs/dbraw/zinc/56/27/81/978562781.db2.gz QHFDLYTZEUXHIO-VHSXEESVSA-N 1 2 226.345 2.061 20 0 BEADLO CCN1CC[N@H+](CC2OC=CC2=S)C[C@H]1C ZINC001237183488 979834152 /nfs/dbraw/zinc/83/41/52/979834152.db2.gz AVWKABIPHDZNHG-SNVBAGLBSA-N 1 2 240.372 2.094 20 0 BEADLO CCN1CC[N@@H+](CC2OC=CC2=S)C[C@H]1C ZINC001237183488 979834158 /nfs/dbraw/zinc/83/41/58/979834158.db2.gz AVWKABIPHDZNHG-SNVBAGLBSA-N 1 2 240.372 2.094 20 0 BEADLO CC[N@@H+]1CCN(CC2OC=CC2=S)C[C@H]1C ZINC001237183488 979834159 /nfs/dbraw/zinc/83/41/59/979834159.db2.gz AVWKABIPHDZNHG-SNVBAGLBSA-N 1 2 240.372 2.094 20 0 BEADLO CC[N@H+]1CCN(CC2OC=CC2=S)C[C@H]1C ZINC001237183488 979834160 /nfs/dbraw/zinc/83/41/60/979834160.db2.gz AVWKABIPHDZNHG-SNVBAGLBSA-N 1 2 240.372 2.094 20 0 BEADLO Cc1sccc1C[NH+]1CC2(CCO2)C1 ZINC001237966001 980117823 /nfs/dbraw/zinc/11/78/23/980117823.db2.gz FLAJMOBTDRDFEI-UHFFFAOYSA-N 1 2 209.314 2.031 20 0 BEADLO Cc1ncncc1C[N@@H+]1CCC[C@](C)(F)C1 ZINC001238163272 980193109 /nfs/dbraw/zinc/19/31/09/980193109.db2.gz FLGVGCWEMQAYMB-LBPRGKRZSA-N 1 2 223.295 2.109 20 0 BEADLO Cc1ncncc1C[N@H+]1CCC[C@](C)(F)C1 ZINC001238163272 980193112 /nfs/dbraw/zinc/19/31/12/980193112.db2.gz FLGVGCWEMQAYMB-LBPRGKRZSA-N 1 2 223.295 2.109 20 0 BEADLO CC[C@H](C)CCC(=O)NCCc1[nH]cc(C)[nH+]1 ZINC001185571602 980246831 /nfs/dbraw/zinc/24/68/31/980246831.db2.gz BUXXOAREYFYDRK-JTQLQIEISA-N 1 2 237.347 2.203 20 0 BEADLO Cn1c[nH+]cc1CCCOC(=O)CCC1CC1 ZINC001344916285 980500692 /nfs/dbraw/zinc/50/06/92/980500692.db2.gz FULLAXWPNDIPCT-UHFFFAOYSA-N 1 2 236.315 2.086 20 0 BEADLO Cc1cccc(CC[NH+]2CCOCC2)c1F ZINC001250278071 980650323 /nfs/dbraw/zinc/65/03/23/980650323.db2.gz SKZCGQOPQXLEJP-UHFFFAOYSA-N 1 2 223.291 2.009 20 0 BEADLO Nc1cc(C(F)(F)F)c(CC(F)F)c[nH+]1 ZINC001250391535 980912463 /nfs/dbraw/zinc/91/24/63/980912463.db2.gz WPJFBZFCYYGAQO-UHFFFAOYSA-N 1 2 226.148 2.490 20 0 BEADLO C[C@H]1C[C@H](Nc2cc(N)cc(Cl)[nH+]2)CCO1 ZINC000229563538 1168625738 /nfs/dbraw/zinc/62/57/38/1168625738.db2.gz NBUKDLLJNXUQGV-IONNQARKSA-N 1 2 241.722 2.297 20 0 BEADLO Nc1cc(-c2cn[nH]c2)[nH+]cc1C(F)(F)F ZINC001240239126 981204365 /nfs/dbraw/zinc/20/43/65/981204365.db2.gz LCNLUMNCNDLLMO-UHFFFAOYSA-N 1 2 228.177 2.073 20 0 BEADLO Cc1sccc1NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001348777480 981440567 /nfs/dbraw/zinc/44/05/67/981440567.db2.gz UBJIIWQJHUMGKZ-MRVPVSSYSA-N 1 2 235.312 2.453 20 0 BEADLO CCCCCOC(=O)N1CCn2c[nH+]cc2C1 ZINC001193761878 981445284 /nfs/dbraw/zinc/44/52/84/981445284.db2.gz FSXNQKFLABCZSV-UHFFFAOYSA-N 1 2 237.303 2.026 20 0 BEADLO CCOC(=O)c1c[nH+]c(N)n1C1=CCCCC1 ZINC001175751736 1168697292 /nfs/dbraw/zinc/69/72/92/1168697292.db2.gz GCZSHVRNUWAICY-UHFFFAOYSA-N 1 2 235.287 2.057 20 0 BEADLO CCOC(=O)c1ccsc1Nc1[nH]cc[nH+]1 ZINC001176079842 1168702514 /nfs/dbraw/zinc/70/25/14/1168702514.db2.gz OHKZFMGYJLBDDK-UHFFFAOYSA-N 1 2 237.284 2.392 20 0 BEADLO COC(=O)c1c(C)csc1Nc1[nH]cc[nH+]1 ZINC001176079924 1168702077 /nfs/dbraw/zinc/70/20/77/1168702077.db2.gz MFCFRVKCAYDWSI-UHFFFAOYSA-N 1 2 237.284 2.310 20 0 BEADLO CC(C)(C)C[N@@H+]1CCCC(=O)[C@H](F)C1 ZINC001201433160 983227159 /nfs/dbraw/zinc/22/71/59/983227159.db2.gz UAVOFHAMYCDDRK-SECBINFHSA-N 1 2 201.285 2.036 20 0 BEADLO CC(C)(C)C[N@H+]1CCCC(=O)[C@H](F)C1 ZINC001201433160 983227163 /nfs/dbraw/zinc/22/71/63/983227163.db2.gz UAVOFHAMYCDDRK-SECBINFHSA-N 1 2 201.285 2.036 20 0 BEADLO CCCC[C@@H](O)CNc1cc([C@H](C)O)cc[nH+]1 ZINC001252083326 983443789 /nfs/dbraw/zinc/44/37/89/983443789.db2.gz NVISUYFMZDOETB-CMPLNLGQSA-N 1 2 238.331 2.098 20 0 BEADLO CC(C)COCC[C@H](C)[N@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001172475029 974770635 /nfs/dbraw/zinc/77/06/35/974770635.db2.gz ZALMIMLVNJQRRB-SDDRHHMPSA-N 1 2 235.318 2.429 20 0 BEADLO CC(C)COCC[C@H](C)[N@@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001172475029 974770639 /nfs/dbraw/zinc/77/06/39/974770639.db2.gz ZALMIMLVNJQRRB-SDDRHHMPSA-N 1 2 235.318 2.429 20 0 BEADLO CC(C)OCC[C@H](C)[N@@H+]1CCCC(=O)[C@@H](F)C1 ZINC001172445247 974806785 /nfs/dbraw/zinc/80/67/85/974806785.db2.gz XVJDCRSTCWIZSF-RYUDHWBXSA-N 1 2 245.338 2.193 20 0 BEADLO CC(C)OCC[C@H](C)[N@H+]1CCCC(=O)[C@@H](F)C1 ZINC001172445247 974806789 /nfs/dbraw/zinc/80/67/89/974806789.db2.gz XVJDCRSTCWIZSF-RYUDHWBXSA-N 1 2 245.338 2.193 20 0 BEADLO CCc1cc(N2CCC(OC)CC2)nc(CC)[nH+]1 ZINC001120870404 1169322850 /nfs/dbraw/zinc/32/28/50/1169322850.db2.gz WLWJNWNLNJHQKL-UHFFFAOYSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2ncccc2O)C[C@@H]1F ZINC001138390557 1169356551 /nfs/dbraw/zinc/35/65/51/1169356551.db2.gz ANDAWUWBNSOOTO-RYUDHWBXSA-N 1 2 242.269 2.059 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2ncccc2O)C[C@@H]1F ZINC001138390557 1169356560 /nfs/dbraw/zinc/35/65/60/1169356560.db2.gz ANDAWUWBNSOOTO-RYUDHWBXSA-N 1 2 242.269 2.059 20 0 BEADLO Cc1ccnc(CNc2c[nH+]cc(C)c2C)n1 ZINC001162193298 1169448966 /nfs/dbraw/zinc/44/89/66/1169448966.db2.gz HTRKMXFBFNIUSP-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO COC(=O)c1ccc(F)c(-c2ccc[nH+]c2N)c1 ZINC001243472130 970771708 /nfs/dbraw/zinc/77/17/08/970771708.db2.gz DPRDADLYIQIKEI-UHFFFAOYSA-N 1 2 246.241 2.257 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](CO)C(C)(C)C)c1 ZINC001157757277 970784923 /nfs/dbraw/zinc/78/49/23/970784923.db2.gz HJVSUBABEYJGIY-NSHDSACASA-N 1 2 238.331 2.047 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2ncccc2F)n(C)n1 ZINC000793551698 970812490 /nfs/dbraw/zinc/81/24/90/970812490.db2.gz VOUWNQGZUODMSE-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO C[C@@H]1C[C@@H]1c1nnc(C[NH+]2CCCCC2)o1 ZINC001256610904 970866271 /nfs/dbraw/zinc/86/62/71/970866271.db2.gz SPFUFWMPVRQFPD-ZJUUUORDSA-N 1 2 221.304 2.179 20 0 BEADLO CNc1cc(N[C@@H]2CC[C@H]3C[C@H]3C2)[nH+]cn1 ZINC000403078953 970875281 /nfs/dbraw/zinc/87/52/81/970875281.db2.gz ANXWCPCZXLZOJI-LPEHRKFASA-N 1 2 218.304 2.119 20 0 BEADLO Cc1cn2c(cccc2-c2cccc(=O)[nH]2)[nH+]1 ZINC001243737641 970900918 /nfs/dbraw/zinc/90/09/18/970900918.db2.gz OSEGHKZLUMMRRM-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO C[C@@H]1C[C@H]1c1nnc(CN(C)c2cccc[nH+]2)o1 ZINC001256659974 970905539 /nfs/dbraw/zinc/90/55/39/970905539.db2.gz UQIDCRTXBCUJDT-NXEZZACHSA-N 1 2 244.298 2.224 20 0 BEADLO COc1ccc(Nc2[nH+]cc(O)cc2C)cc1N ZINC001216254476 971003720 /nfs/dbraw/zinc/00/37/20/971003720.db2.gz NPOUCGISKMDHDS-UHFFFAOYSA-N 1 2 245.282 2.430 20 0 BEADLO COc1ccc2nc(C3=C[NH2+]CCC3)cnc2c1 ZINC001243947043 971033005 /nfs/dbraw/zinc/03/30/05/971033005.db2.gz CXIOJBXEESSNPO-UHFFFAOYSA-N 1 2 241.294 2.363 20 0 BEADLO CC(C)c1cncnc1C1=C[NH2+]CCC1 ZINC001243946897 971036351 /nfs/dbraw/zinc/03/63/51/971036351.db2.gz AJAPNXHBTXOUQO-UHFFFAOYSA-N 1 2 203.289 2.324 20 0 BEADLO Cc1ccc2c(ncnc2C2=C[NH2+]CCC2)n1 ZINC001243949483 971038112 /nfs/dbraw/zinc/03/81/12/971038112.db2.gz NGALLIWWRZUHLE-UHFFFAOYSA-N 1 2 226.283 2.058 20 0 BEADLO COc1cc(NC2=CCCOC2)cc(C)[nH+]1 ZINC001216505752 971104050 /nfs/dbraw/zinc/10/40/50/971104050.db2.gz NKHJTPHHESXFCW-UHFFFAOYSA-N 1 2 220.272 2.115 20 0 BEADLO Cc1csc(C[NH+]2CCC(=O)CC2)c1 ZINC000307110126 971123927 /nfs/dbraw/zinc/12/39/27/971123927.db2.gz BPOXHCYDNPDSLS-UHFFFAOYSA-N 1 2 209.314 2.221 20 0 BEADLO Clc1ccnc(CNc2cccc[nH+]2)n1 ZINC001170542530 971143046 /nfs/dbraw/zinc/14/30/46/971143046.db2.gz NJWXHIHZJSBBMS-UHFFFAOYSA-N 1 2 220.663 2.137 20 0 BEADLO FC1(F)C[NH2+]CCN(CCCC2CCCC2)C1 ZINC001210814919 1169529414 /nfs/dbraw/zinc/52/94/14/1169529414.db2.gz LBCQYCKOBORXDR-UHFFFAOYSA-N 1 2 246.345 2.497 20 0 BEADLO CCC[C@H](CC)[N@@H+]1CCC(=O)[C@@H](F)C1 ZINC001257264682 971162955 /nfs/dbraw/zinc/16/29/55/971162955.db2.gz QSQVAPYBCCZIMA-UWVGGRQHSA-N 1 2 201.285 2.178 20 0 BEADLO CCC[C@H](CC)[N@H+]1CCC(=O)[C@@H](F)C1 ZINC001257264682 971162959 /nfs/dbraw/zinc/16/29/59/971162959.db2.gz QSQVAPYBCCZIMA-UWVGGRQHSA-N 1 2 201.285 2.178 20 0 BEADLO C[C@@H](C(=O)NCCC1=CCCCC1)n1cc[nH+]c1 ZINC000053898741 971167231 /nfs/dbraw/zinc/16/72/31/971167231.db2.gz MIUFGSSCIUIHHU-LBPRGKRZSA-N 1 2 247.342 2.451 20 0 BEADLO C[C@H]1C[C@@H]1c1nnc([C@H]([NH3+])COC(C)(C)C)o1 ZINC001217700357 971341238 /nfs/dbraw/zinc/34/12/38/971341238.db2.gz DDWDGLITLPOWNP-XHNCKOQMSA-N 1 2 239.319 2.008 20 0 BEADLO CCc1nnc([C@H]2CC[C@H](C(F)(F)F)C[NH2+]2)o1 ZINC001217706047 971346354 /nfs/dbraw/zinc/34/63/54/971346354.db2.gz LOZNCTOUDIJVOZ-NKWVEPMBSA-N 1 2 249.236 2.235 20 0 BEADLO CCCCC[C@H](C)[NH2+]C1(C(=O)OC)CC1 ZINC001257500495 971417205 /nfs/dbraw/zinc/41/72/05/971417205.db2.gz QVPSDHRKNDODJH-JTQLQIEISA-N 1 2 213.321 2.250 20 0 BEADLO c1cn(CCc2nnc(C3CCCC3)o2)c[nH+]1 ZINC001257518318 971439916 /nfs/dbraw/zinc/43/99/16/971439916.db2.gz PPSYCYNDIQVOFZ-UHFFFAOYSA-N 1 2 232.287 2.166 20 0 BEADLO C[NH+](C)C1(c2nnc(C3CCCC3)o2)CC1 ZINC001257545630 971448160 /nfs/dbraw/zinc/44/81/60/971448160.db2.gz BYRCQAQMQOCLEE-UHFFFAOYSA-N 1 2 221.304 2.278 20 0 BEADLO C[NH+]1CC(Oc2cccc3cccc(O)c32)C1 ZINC001225828163 1169595958 /nfs/dbraw/zinc/59/59/58/1169595958.db2.gz WFNNDWHHVMPSPO-UHFFFAOYSA-N 1 2 229.279 2.238 20 0 BEADLO Fc1ccc(O[C@H]2CC[NH2+]CC2(F)F)cc1 ZINC001218005983 971568705 /nfs/dbraw/zinc/56/87/05/971568705.db2.gz PIUYBOUUJXCSCP-JTQLQIEISA-N 1 2 231.217 2.202 20 0 BEADLO Cc1ccc(O[C@H]2CC[NH2+]CC2(F)F)nc1C ZINC001218008106 971569017 /nfs/dbraw/zinc/56/90/17/971569017.db2.gz WXTKNEFYUFODRI-JTQLQIEISA-N 1 2 242.269 2.074 20 0 BEADLO Cc1ccc(O[C@@H]2CC[NH2+]CC2(F)F)cc1 ZINC001218005912 971570018 /nfs/dbraw/zinc/57/00/18/971570018.db2.gz OFTWVYSUPWMDLW-LLVKDONJSA-N 1 2 227.254 2.371 20 0 BEADLO CC(C)c1cccc(O[C@@H]2C[NH2+]CC2(F)F)n1 ZINC001218232546 971641609 /nfs/dbraw/zinc/64/16/09/971641609.db2.gz CYRJPBHGPWXDIZ-SNVBAGLBSA-N 1 2 242.269 2.191 20 0 BEADLO CC(C)[NH+]1CC(Oc2cc3[nH]ccc3cc2O)C1 ZINC001228030716 1169631153 /nfs/dbraw/zinc/63/11/53/1169631153.db2.gz VQUVXUYROWJGKX-UHFFFAOYSA-N 1 2 246.310 2.345 20 0 BEADLO COC(=O)[C@H]1CC[C@@H](Oc2cc[nH+]cc2)CC1 ZINC001225295530 974371434 /nfs/dbraw/zinc/37/14/34/974371434.db2.gz LFXQZDVDPNUYEO-PHIMTYICSA-N 1 2 235.283 2.192 20 0 BEADLO Cc1cnccc1NC(=O)CCCn1cc[nH+]c1 ZINC000107284856 971733310 /nfs/dbraw/zinc/73/33/10/971733310.db2.gz WAPUVOBXJJKVOB-UHFFFAOYSA-N 1 2 244.298 2.005 20 0 BEADLO CC1(C)[C@@H]2C[C@H]([N@@H+]3CC[C@H](O)C(F)(F)C3)C[C@@H]21 ZINC001170761890 971743619 /nfs/dbraw/zinc/74/36/19/971743619.db2.gz PCRVGEVEJWHKQP-VLEAKVRGSA-N 1 2 245.313 2.123 20 0 BEADLO CC1(C)[C@@H]2C[C@H]([N@H+]3CC[C@H](O)C(F)(F)C3)C[C@@H]21 ZINC001170761890 971743624 /nfs/dbraw/zinc/74/36/24/971743624.db2.gz PCRVGEVEJWHKQP-VLEAKVRGSA-N 1 2 245.313 2.123 20 0 BEADLO COc1cc(C)cc(-c2c[nH+]c(N)c(C)c2)n1 ZINC001245535679 971849011 /nfs/dbraw/zinc/84/90/11/971849011.db2.gz NBAGMMGNLJYRKF-UHFFFAOYSA-N 1 2 229.283 2.351 20 0 BEADLO CC[C@H](C)OCC[C@@H](C)[NH2+]CC(=O)OC(C)C ZINC001172322577 974534542 /nfs/dbraw/zinc/53/45/42/974534542.db2.gz VVNZQAAGRQBJHQ-NEPJUHHUSA-N 1 2 245.363 2.121 20 0 BEADLO Nc1ccc(NCOc2ccccc2)c[nH+]1 ZINC001170805693 971858251 /nfs/dbraw/zinc/85/82/51/971858251.db2.gz GLNMHFPNTCZWRH-UHFFFAOYSA-N 1 2 215.256 2.112 20 0 BEADLO CCc1nn(C[N@H+]2C[C@H](C)C[C@@H]2C)c(=S)o1 ZINC001331008388 974556070 /nfs/dbraw/zinc/55/60/70/974556070.db2.gz PJPMIUJXKQFCFS-BDAKNGLRSA-N 1 2 241.360 2.456 20 0 BEADLO O=C(C=C1CC[NH2+]CC1)Nc1ccccc1S ZINC001218831027 971952613 /nfs/dbraw/zinc/95/26/13/971952613.db2.gz OAXKHKGRGFMRBT-UHFFFAOYSA-N 1 2 248.351 2.224 20 0 BEADLO COc1cnc(F)cc1/C(C)=C/C=C/[NH3+] ZINC001239036325 1169705472 /nfs/dbraw/zinc/70/54/72/1169705472.db2.gz NWYVAHPMMXKQER-MSLMYCKWSA-N 1 2 208.236 2.105 20 0 BEADLO CC[C@@H](C)OCC[C@H](C)[N@@H+]1CCCC(=O)C1 ZINC001172343911 974612103 /nfs/dbraw/zinc/61/21/03/974612103.db2.gz WOUBMWCXJQNXLF-NWDGAFQWSA-N 1 2 227.348 2.245 20 0 BEADLO CC[C@@H](C)OCC[C@H](C)[N@H+]1CCCC(=O)C1 ZINC001172343911 974612113 /nfs/dbraw/zinc/61/21/13/974612113.db2.gz WOUBMWCXJQNXLF-NWDGAFQWSA-N 1 2 227.348 2.245 20 0 BEADLO C[C@H]1C[C@H](O)CC[N@@H+]1Cc1cnc(Cl)s1 ZINC000705349275 957166981 /nfs/dbraw/zinc/16/69/81/957166981.db2.gz VVPMYMSDMRJGCY-JGVFFNPUSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@H]1C[C@H](O)CC[N@H+]1Cc1cnc(Cl)s1 ZINC000705349275 957166986 /nfs/dbraw/zinc/16/69/86/957166986.db2.gz VVPMYMSDMRJGCY-JGVFFNPUSA-N 1 2 246.763 2.142 20 0 BEADLO Cc1cccc(C[N@@H+]2C[C@@H]3C[C@H]2CO3)c1F ZINC001137677575 957169352 /nfs/dbraw/zinc/16/93/52/957169352.db2.gz YPRMNMXJLXXOLU-RYUDHWBXSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1cccc(C[N@H+]2C[C@@H]3C[C@H]2CO3)c1F ZINC001137677575 957169362 /nfs/dbraw/zinc/16/93/62/957169362.db2.gz YPRMNMXJLXXOLU-RYUDHWBXSA-N 1 2 221.275 2.107 20 0 BEADLO COc1cc([NH2+]CC2(C)CC2)ccc1N ZINC000234970379 957316090 /nfs/dbraw/zinc/31/60/90/957316090.db2.gz UMUDVJSRPJQBJY-UHFFFAOYSA-N 1 2 206.289 2.489 20 0 BEADLO CSc1cc[nH+]c(N2C[C@H]3[C@H](CF)[C@H]3C2)c1 ZINC001167225607 957556708 /nfs/dbraw/zinc/55/67/08/957556708.db2.gz SRPZJZQDMTWCKS-RTCCRHLQSA-N 1 2 238.331 2.455 20 0 BEADLO Clc1ccnc(C[NH+]2CCSCC2)c1 ZINC000086129502 957561967 /nfs/dbraw/zinc/56/19/67/957561967.db2.gz OTNSEVWOTFWJPA-UHFFFAOYSA-N 1 2 228.748 2.284 20 0 BEADLO C[N@H+](Cc1cccnc1)Cc1cccc(F)n1 ZINC001140129966 957600546 /nfs/dbraw/zinc/60/05/46/957600546.db2.gz DZPWNHDXYGUYHG-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[N@@H+](Cc1cccnc1)Cc1cccc(F)n1 ZINC001140129966 957600554 /nfs/dbraw/zinc/60/05/54/957600554.db2.gz DZPWNHDXYGUYHG-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO Cc1[nH+]cc(Nc2nccnc2C2CC2)cc1N ZINC001210285803 957715413 /nfs/dbraw/zinc/71/54/13/957715413.db2.gz RWGZCCIQVWZIOB-UHFFFAOYSA-N 1 2 241.298 2.383 20 0 BEADLO Cc1[nH+]cc(Nc2ccc(F)cn2)cc1N ZINC001210284174 957715958 /nfs/dbraw/zinc/71/59/58/957715958.db2.gz FTUVHPNLDRHGLF-UHFFFAOYSA-N 1 2 218.235 2.250 20 0 BEADLO COc1cc(F)ncc1Nc1c[nH+]c(C)c(N)c1 ZINC001210288696 957716581 /nfs/dbraw/zinc/71/65/81/957716581.db2.gz SKCRQEXFBLVDOW-UHFFFAOYSA-N 1 2 248.261 2.259 20 0 BEADLO CC[N@H+](Cc1cnc[nH]1)Cc1cccc(OC)c1 ZINC001136871731 972287996 /nfs/dbraw/zinc/28/79/96/972287996.db2.gz FPNLONLAXUPFJS-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO CC[N@@H+](Cc1cnc[nH]1)Cc1cccc(OC)c1 ZINC001136871731 972287998 /nfs/dbraw/zinc/28/79/98/972287998.db2.gz FPNLONLAXUPFJS-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO Cc1cc(C[NH2+]Cc2cccc3c2OCC3)on1 ZINC000693150839 957742877 /nfs/dbraw/zinc/74/28/77/957742877.db2.gz GXSZDBHTXFLTOP-UHFFFAOYSA-N 1 2 244.294 2.208 20 0 BEADLO CC(C)Oc1cc(NCc2cccnn2)cc[nH+]1 ZINC001167324428 957757511 /nfs/dbraw/zinc/75/75/11/957757511.db2.gz KVUIFNQGPDJLDM-UHFFFAOYSA-N 1 2 244.298 2.271 20 0 BEADLO Cc1c(F)cccc1C[N@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001204510876 957781129 /nfs/dbraw/zinc/78/11/29/957781129.db2.gz PHIVPHCOLIFFHF-TXEJJXNPSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1c(F)cccc1C[N@@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001204510876 957781134 /nfs/dbraw/zinc/78/11/34/957781134.db2.gz PHIVPHCOLIFFHF-TXEJJXNPSA-N 1 2 221.275 2.107 20 0 BEADLO COc1cc(Nc2cnc(C)cn2)cc(C)[nH+]1 ZINC001210776106 957874813 /nfs/dbraw/zinc/87/48/13/957874813.db2.gz MCRHTVNVJJDABK-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO C[C@@H](C(=O)N1CCC[C@@H](C2CC2)C1)n1cc[nH+]c1 ZINC001347513572 957959210 /nfs/dbraw/zinc/95/92/10/957959210.db2.gz IHGSVQBPFKBMQY-WCQYABFASA-N 1 2 247.342 2.093 20 0 BEADLO CC(C(=O)NC[C@@H](C)Cn1cc[nH+]c1)=C1CCC1 ZINC001347816335 958157919 /nfs/dbraw/zinc/15/79/19/958157919.db2.gz QQKLSRUVDVFBDE-LLVKDONJSA-N 1 2 247.342 2.136 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H]3C[C@H]2CO3)cc(C)c1F ZINC001143381458 958187208 /nfs/dbraw/zinc/18/72/08/958187208.db2.gz BDSRPYRMKMKHGZ-STQMWFEESA-N 1 2 235.302 2.416 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H]3C[C@H]2CO3)cc(C)c1F ZINC001143381458 958187216 /nfs/dbraw/zinc/18/72/16/958187216.db2.gz BDSRPYRMKMKHGZ-STQMWFEESA-N 1 2 235.302 2.416 20 0 BEADLO Cc1c(Nc2c[nH+]cc(C)c2C)cnn1C ZINC001213523218 958201359 /nfs/dbraw/zinc/20/13/59/958201359.db2.gz NKOZJEUGIKIAJB-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO COc1ccc(C[N@@H+]2C[C@@H](F)C[C@H]2C)cn1 ZINC001137031988 972335486 /nfs/dbraw/zinc/33/54/86/972335486.db2.gz VZUQFZLEAVGALH-KOLCDFICSA-N 1 2 224.279 2.023 20 0 BEADLO COc1ccc(C[N@H+]2C[C@@H](F)C[C@H]2C)cn1 ZINC001137031988 972335489 /nfs/dbraw/zinc/33/54/89/972335489.db2.gz VZUQFZLEAVGALH-KOLCDFICSA-N 1 2 224.279 2.023 20 0 BEADLO COc1ccc(C[N@@H+]2C[C@H](F)C[C@H]2C)cn1 ZINC001137031989 972337298 /nfs/dbraw/zinc/33/72/98/972337298.db2.gz VZUQFZLEAVGALH-MWLCHTKSSA-N 1 2 224.279 2.023 20 0 BEADLO COc1ccc(C[N@H+]2C[C@H](F)C[C@H]2C)cn1 ZINC001137031989 972337300 /nfs/dbraw/zinc/33/73/00/972337300.db2.gz VZUQFZLEAVGALH-MWLCHTKSSA-N 1 2 224.279 2.023 20 0 BEADLO Cc1cc(N[C@H]2C[C@@H](CO)C2)nc(C(C)C)[nH+]1 ZINC000707497140 958549292 /nfs/dbraw/zinc/54/92/92/958549292.db2.gz VYPUWEZFHHLXCR-PHIMTYICSA-N 1 2 235.331 2.091 20 0 BEADLO CC[N@H+](Cc1cc(F)cc(F)c1C)C1COC1 ZINC001143768097 972357764 /nfs/dbraw/zinc/35/77/64/972357764.db2.gz YSIGYLOKRVZENX-UHFFFAOYSA-N 1 2 241.281 2.494 20 0 BEADLO CC[N@@H+](Cc1cc(F)cc(F)c1C)C1COC1 ZINC001143768097 972357771 /nfs/dbraw/zinc/35/77/71/972357771.db2.gz YSIGYLOKRVZENX-UHFFFAOYSA-N 1 2 241.281 2.494 20 0 BEADLO CC(C)[NH+]1CC(OCC(=O)c2cccs2)C1 ZINC001222080679 972360107 /nfs/dbraw/zinc/36/01/07/972360107.db2.gz DFQZIOOAWZQEGO-UHFFFAOYSA-N 1 2 239.340 2.040 20 0 BEADLO Cc1nn(C)cc1Nc1cc(C)cc(C)[nH+]1 ZINC000707906534 958807590 /nfs/dbraw/zinc/80/75/90/958807590.db2.gz BLUUVSZSWUTSQH-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO CC1CCC(OCCn2cc[nH+]c2)CC1 ZINC001222134728 972382796 /nfs/dbraw/zinc/38/27/96/972382796.db2.gz LTMTVWAHOLIMAX-UHFFFAOYSA-N 1 2 208.305 2.478 20 0 BEADLO C[C@H](COc1ccccc1)OCCn1cc[nH+]c1 ZINC001222135573 972384421 /nfs/dbraw/zinc/38/44/21/972384421.db2.gz ZXOSKGJXKJEKJO-CYBMUJFWSA-N 1 2 246.310 2.367 20 0 BEADLO C[C@H](Cc1ccco1)OCCn1cc[nH+]c1 ZINC001222139921 972385594 /nfs/dbraw/zinc/38/55/94/972385594.db2.gz XWXDRVQRCVIEGC-LLVKDONJSA-N 1 2 220.272 2.124 20 0 BEADLO C[C@@H](Cc1ccco1)OCCn1cc[nH+]c1 ZINC001222139922 972387055 /nfs/dbraw/zinc/38/70/55/972387055.db2.gz XWXDRVQRCVIEGC-NSHDSACASA-N 1 2 220.272 2.124 20 0 BEADLO C[C@H](OCCn1cc[nH+]c1)c1nccs1 ZINC001222138252 972387170 /nfs/dbraw/zinc/38/71/70/972387170.db2.gz CLEHNIRIVCOSIA-VIFPVBQESA-N 1 2 223.301 2.117 20 0 BEADLO c1cn(CCO[C@@H](c2cccnc2)C2CC2)c[nH+]1 ZINC001222138514 972389436 /nfs/dbraw/zinc/38/94/36/972389436.db2.gz FXNXGJOQJLNZGX-CQSZACIVSA-N 1 2 243.310 2.446 20 0 BEADLO c1cn(CCO[C@H](c2cccnc2)C2CC2)c[nH+]1 ZINC001222138513 972388124 /nfs/dbraw/zinc/38/81/24/972388124.db2.gz FXNXGJOQJLNZGX-AWEZNQCLSA-N 1 2 243.310 2.446 20 0 BEADLO C[C@@H](OCCn1cc[nH+]c1)c1ccncc1F ZINC001222139949 972388729 /nfs/dbraw/zinc/38/87/29/972388729.db2.gz ZCPQFEZYLNDPCF-SNVBAGLBSA-N 1 2 235.262 2.195 20 0 BEADLO CC(F)(F)CNc1cc(N)cc(Cl)[nH+]1 ZINC000307081463 959042106 /nfs/dbraw/zinc/04/21/06/959042106.db2.gz TXKMTNLWWUMXCL-UHFFFAOYSA-N 1 2 221.638 2.384 20 0 BEADLO Cc1cc(Cl)nnc1NCc1cc[nH+]c(N)c1 ZINC001167612457 959062911 /nfs/dbraw/zinc/06/29/11/959062911.db2.gz FOFGTIMOBDKDPA-UHFFFAOYSA-N 1 2 249.705 2.028 20 0 BEADLO CSc1ccc(COC2C[NH+](C)C2)cc1 ZINC001222228714 972408530 /nfs/dbraw/zinc/40/85/30/972408530.db2.gz RGMVGQUQAIARNV-UHFFFAOYSA-N 1 2 223.341 2.239 20 0 BEADLO CC(C)[C@H]1CCCCN1C(=O)C[C@@H]([NH3+])C(F)F ZINC000724710705 959230430 /nfs/dbraw/zinc/23/04/30/959230430.db2.gz HDQNPYQJYNYFLF-NXEZZACHSA-N 1 2 248.317 2.006 20 0 BEADLO CCN(C(=O)C[C@@H]([NH3+])C(F)F)c1ccccc1 ZINC000724762842 959304580 /nfs/dbraw/zinc/30/45/80/959304580.db2.gz SQCDOVQEOMJZBI-SNVBAGLBSA-N 1 2 242.269 2.022 20 0 BEADLO C[C@@H](NC(=O)C[C@@H]([NH3+])C(F)F)C1CCCCC1 ZINC000724754631 959363350 /nfs/dbraw/zinc/36/33/50/959363350.db2.gz DYAQQRHMLKPYSD-PSASIEDQSA-N 1 2 248.317 2.054 20 0 BEADLO CC(C)(C)[C@H]1CCCN(c2cc(N)nc[nH+]2)C1 ZINC000708466461 959476523 /nfs/dbraw/zinc/47/65/23/959476523.db2.gz IEUUHRFRVBGLRS-JTQLQIEISA-N 1 2 234.347 2.321 20 0 BEADLO CC[C@@](C)([NH2+]CC1=NOCC1)c1nccs1 ZINC001167681395 959702025 /nfs/dbraw/zinc/70/20/25/959702025.db2.gz ZEUNBDLEHLTWFY-LLVKDONJSA-N 1 2 239.344 2.134 20 0 BEADLO Cc1cc(C[NH2+][C@@H]2CCc3ccc(O)cc32)no1 ZINC000690792848 959839393 /nfs/dbraw/zinc/83/93/93/959839393.db2.gz UAWFWCRSFJSYQP-CQSZACIVSA-N 1 2 244.294 2.466 20 0 BEADLO Nc1cc(N2CC[C@H](C3CCCCC3)C2)[nH+]cn1 ZINC000708824002 959856681 /nfs/dbraw/zinc/85/66/81/959856681.db2.gz YNKIFUKDOAFMRB-LBPRGKRZSA-N 1 2 246.358 2.465 20 0 BEADLO Cc1ccc(O[C@@H]2C[NH2+]CC2(F)F)c(F)c1F ZINC001218230739 959905546 /nfs/dbraw/zinc/90/55/46/959905546.db2.gz COIPQZZNQGKQGG-MRVPVSSYSA-N 1 2 249.207 2.259 20 0 BEADLO CC[N@H+](CCOC)Cc1ccc(O)c(F)c1F ZINC001140890084 960044019 /nfs/dbraw/zinc/04/40/19/960044019.db2.gz UOHKAXCHDPBWSD-UHFFFAOYSA-N 1 2 245.269 2.139 20 0 BEADLO CC[N@@H+](CCOC)Cc1ccc(O)c(F)c1F ZINC001140890084 960044030 /nfs/dbraw/zinc/04/40/30/960044030.db2.gz UOHKAXCHDPBWSD-UHFFFAOYSA-N 1 2 245.269 2.139 20 0 BEADLO C[C@H](C(=O)N[C@@H](C)c1ccsc1)n1cc[nH+]c1 ZINC001327188025 972483971 /nfs/dbraw/zinc/48/39/71/972483971.db2.gz OWGRQMBNYYXXHM-VHSXEESVSA-N 1 2 249.339 2.383 20 0 BEADLO CCCCOC1C[NH+](Cc2cc[nH]c2)C1 ZINC001140707399 960519214 /nfs/dbraw/zinc/51/92/14/960519214.db2.gz HZHBLQVLZCZHTK-UHFFFAOYSA-N 1 2 208.305 2.016 20 0 BEADLO c1oc2ccccc2c1C[NH+]1CC2(CCO2)C1 ZINC001140786966 960570175 /nfs/dbraw/zinc/57/01/75/960570175.db2.gz RJQLHDDCFSYMCK-UHFFFAOYSA-N 1 2 229.279 2.408 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1c[nH]c2ccncc12 ZINC001140804907 960606745 /nfs/dbraw/zinc/60/67/45/960606745.db2.gz JXGRCRKFDXGIKG-LBPRGKRZSA-N 1 2 245.326 2.174 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1c[nH]c2ccncc12 ZINC001140804907 960606757 /nfs/dbraw/zinc/60/67/57/960606757.db2.gz JXGRCRKFDXGIKG-LBPRGKRZSA-N 1 2 245.326 2.174 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC(=O)[C@H](C)C2)c1C ZINC001140858426 960634460 /nfs/dbraw/zinc/63/44/60/960634460.db2.gz JCMFAELAYQQCNS-SNVBAGLBSA-N 1 2 220.316 2.042 20 0 BEADLO COC(C)(C)C[C@H](C)OCc1c[nH+]cn1C ZINC001222600626 960724429 /nfs/dbraw/zinc/72/44/29/960724429.db2.gz SQKNVVJMBWTACG-JTQLQIEISA-N 1 2 226.320 2.140 20 0 BEADLO c1coc(C[N@@H+]2CCC[C@@H]2c2cccnc2)n1 ZINC001141005667 960802919 /nfs/dbraw/zinc/80/29/19/960802919.db2.gz PQEHCZMRTMUGQB-GFCCVEGCSA-N 1 2 229.283 2.407 20 0 BEADLO c1coc(C[N@H+]2CCC[C@@H]2c2cccnc2)n1 ZINC001141005667 960802920 /nfs/dbraw/zinc/80/29/20/960802920.db2.gz PQEHCZMRTMUGQB-GFCCVEGCSA-N 1 2 229.283 2.407 20 0 BEADLO c1coc(C[N@@H+]2CCc3ccccc3C2)n1 ZINC001141005272 960804304 /nfs/dbraw/zinc/80/43/04/960804304.db2.gz ABOLLFKGVCJZMG-UHFFFAOYSA-N 1 2 214.268 2.233 20 0 BEADLO c1coc(C[N@H+]2CCc3ccccc3C2)n1 ZINC001141005272 960804307 /nfs/dbraw/zinc/80/43/07/960804307.db2.gz ABOLLFKGVCJZMG-UHFFFAOYSA-N 1 2 214.268 2.233 20 0 BEADLO C[N@H+](CCOc1ccccc1)Cc1ncco1 ZINC001141008655 960809382 /nfs/dbraw/zinc/80/93/82/960809382.db2.gz HMVOKCSLMRHDAG-UHFFFAOYSA-N 1 2 232.283 2.185 20 0 BEADLO C[N@@H+](CCOc1ccccc1)Cc1ncco1 ZINC001141008655 960809383 /nfs/dbraw/zinc/80/93/83/960809383.db2.gz HMVOKCSLMRHDAG-UHFFFAOYSA-N 1 2 232.283 2.185 20 0 BEADLO Oc1cccc2ccc(C[N@@H+]3CC[C@@H](F)C3)nc12 ZINC001141019413 960822906 /nfs/dbraw/zinc/82/29/06/960822906.db2.gz DNBCQUVBKYPOEO-LLVKDONJSA-N 1 2 246.285 2.484 20 0 BEADLO Oc1cccc2ccc(C[N@H+]3CC[C@@H](F)C3)nc12 ZINC001141019413 960822909 /nfs/dbraw/zinc/82/29/09/960822909.db2.gz DNBCQUVBKYPOEO-LLVKDONJSA-N 1 2 246.285 2.484 20 0 BEADLO Cc1ncoc1C[N@@H+]1CCC(=O)[C@H]2CCCC[C@@H]21 ZINC001141050604 960839155 /nfs/dbraw/zinc/83/91/55/960839155.db2.gz DXAICJQCSUHMFT-RYUDHWBXSA-N 1 2 248.326 2.317 20 0 BEADLO Cc1ncoc1C[N@H+]1CCC(=O)[C@H]2CCCC[C@@H]21 ZINC001141050604 960839165 /nfs/dbraw/zinc/83/91/65/960839165.db2.gz DXAICJQCSUHMFT-RYUDHWBXSA-N 1 2 248.326 2.317 20 0 BEADLO Cc1ncoc1C[NH+]1CC2(C1)C[C@@H](F)CS2 ZINC001141053671 960847695 /nfs/dbraw/zinc/84/76/95/960847695.db2.gz MEHOWSOZPPKHIX-SECBINFHSA-N 1 2 242.319 2.012 20 0 BEADLO CCCCc1[nH]cc(CN2CCC[C@H]2C(C)=O)[nH+]1 ZINC001141075068 960860024 /nfs/dbraw/zinc/86/00/24/960860024.db2.gz XOVCUHJBLMOBLX-ZDUSSCGKSA-N 1 2 249.358 2.306 20 0 BEADLO CCCCc1[nH]c(CN2CCC[C@H]2C(C)=O)c[nH+]1 ZINC001141075068 960860027 /nfs/dbraw/zinc/86/00/27/960860027.db2.gz XOVCUHJBLMOBLX-ZDUSSCGKSA-N 1 2 249.358 2.306 20 0 BEADLO CCCCc1[nH]c(CN(C)CCF)c[nH+]1 ZINC001141074443 960861197 /nfs/dbraw/zinc/86/11/97/960861197.db2.gz HQYZOJQMHFSNAJ-UHFFFAOYSA-N 1 2 213.300 2.154 20 0 BEADLO CCCCc1[nH]cc(CN(C)CCF)[nH+]1 ZINC001141074443 960861199 /nfs/dbraw/zinc/86/11/99/960861199.db2.gz HQYZOJQMHFSNAJ-UHFFFAOYSA-N 1 2 213.300 2.154 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2cocn2)CCC1(F)F ZINC001141126087 960871588 /nfs/dbraw/zinc/87/15/88/960871588.db2.gz JRDGLDMSLZQYKQ-SECBINFHSA-N 1 2 234.221 2.244 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2cocn2)CCC1(F)F ZINC001141126087 960871590 /nfs/dbraw/zinc/87/15/90/960871590.db2.gz JRDGLDMSLZQYKQ-SECBINFHSA-N 1 2 234.221 2.244 20 0 BEADLO c1csc([C@H]2CCC[N@H+]2Cc2cn[nH]c2)n1 ZINC001203096992 960882697 /nfs/dbraw/zinc/88/26/97/960882697.db2.gz UAMOGZCGZSILDK-SNVBAGLBSA-N 1 2 234.328 2.203 20 0 BEADLO c1csc([C@H]2CCC[N@@H+]2Cc2cn[nH]c2)n1 ZINC001203096992 960882702 /nfs/dbraw/zinc/88/27/02/960882702.db2.gz UAMOGZCGZSILDK-SNVBAGLBSA-N 1 2 234.328 2.203 20 0 BEADLO c1csc([C@@H]2CCC[N@H+]2Cc2cn[nH]c2)n1 ZINC001203096991 960883286 /nfs/dbraw/zinc/88/32/86/960883286.db2.gz UAMOGZCGZSILDK-JTQLQIEISA-N 1 2 234.328 2.203 20 0 BEADLO c1csc([C@@H]2CCC[N@@H+]2Cc2cn[nH]c2)n1 ZINC001203096991 960883287 /nfs/dbraw/zinc/88/32/87/960883287.db2.gz UAMOGZCGZSILDK-JTQLQIEISA-N 1 2 234.328 2.203 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)Nc1ccc2[nH]ccc2c1 ZINC001141393529 961057805 /nfs/dbraw/zinc/05/78/05/961057805.db2.gz LTTUEFQIZMVTIP-UHFFFAOYSA-N 1 2 240.266 2.072 20 0 BEADLO Cc1cc(NC2(CO)CCCC2)c[nH+]c1C ZINC001167804860 961060885 /nfs/dbraw/zinc/06/08/85/961060885.db2.gz MMVDCIXPNNVWDQ-UHFFFAOYSA-N 1 2 220.316 2.415 20 0 BEADLO Nc1cc(Cl)[nH+]c(N2C3CCC2CC3)c1 ZINC000399268913 961102604 /nfs/dbraw/zinc/10/26/04/961102604.db2.gz AHGIKZOSCFHUHF-UHFFFAOYSA-N 1 2 223.707 2.448 20 0 BEADLO COCOCCc1[nH]c2ccc(C)c(C)c2[nH+]1 ZINC001250591447 1169788053 /nfs/dbraw/zinc/78/80/53/1169788053.db2.gz MYYKLFHOBPLZME-UHFFFAOYSA-N 1 2 234.299 2.343 20 0 BEADLO CC(C)/C=C/C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC001142659770 961564336 /nfs/dbraw/zinc/56/43/36/961564336.db2.gz USHAHWYHJBZNDX-BTDICHCPSA-N 1 2 247.342 2.328 20 0 BEADLO O=C(Nc1ccc(Cn2cc[nH+]c2)cc1)C1CC1 ZINC001142677730 961603668 /nfs/dbraw/zinc/60/36/68/961603668.db2.gz MZBBRQOYDYXMJT-UHFFFAOYSA-N 1 2 241.294 2.280 20 0 BEADLO Cc1nc(NCc2nccn2C)cc(C(C)C)[nH+]1 ZINC000709838569 961689441 /nfs/dbraw/zinc/68/94/41/961689441.db2.gz ASAIVMHMCZGJLX-UHFFFAOYSA-N 1 2 245.330 2.254 20 0 BEADLO O[C@@H]1C[N@H+](Cc2csc(Cl)c2)CC[C@@H]1F ZINC001142760649 961706810 /nfs/dbraw/zinc/70/68/10/961706810.db2.gz ZQHZZSXMJWZMNJ-DTWKUNHWSA-N 1 2 249.738 2.306 20 0 BEADLO O[C@@H]1C[N@@H+](Cc2csc(Cl)c2)CC[C@@H]1F ZINC001142760649 961706834 /nfs/dbraw/zinc/70/68/34/961706834.db2.gz ZQHZZSXMJWZMNJ-DTWKUNHWSA-N 1 2 249.738 2.306 20 0 BEADLO FC1(C2CC2)CN(Cc2cccn3cc[nH+]c23)C1 ZINC001142943690 961843945 /nfs/dbraw/zinc/84/39/45/961843945.db2.gz BPPSHLIZXWYDNJ-UHFFFAOYSA-N 1 2 245.301 2.268 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc3cccnc3[nH]2)C[C@H](C)O1 ZINC001143212454 961957465 /nfs/dbraw/zinc/95/74/65/961957465.db2.gz QSFWVZAFYMSADE-PHIMTYICSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc3cccnc3[nH]2)C[C@H](C)O1 ZINC001143212454 961957475 /nfs/dbraw/zinc/95/74/75/961957475.db2.gz QSFWVZAFYMSADE-PHIMTYICSA-N 1 2 245.326 2.172 20 0 BEADLO Cc1nn(C)cc1[C@H](C)Oc1cc[nH+]cc1 ZINC001225290263 962041587 /nfs/dbraw/zinc/04/15/87/962041587.db2.gz WXWSDOUJTWUGHP-JTQLQIEISA-N 1 2 217.272 2.264 20 0 BEADLO Cc1cc[nH+]c(C)c1N[C@H]1CCSC1=O ZINC001167951840 962678832 /nfs/dbraw/zinc/67/88/32/962678832.db2.gz GWSGOOLZDRYRTM-VIFPVBQESA-N 1 2 222.313 2.142 20 0 BEADLO Cn1c[nH+]c2ccc(N[C@H]3CCSC3=O)cc21 ZINC001167955499 962793904 /nfs/dbraw/zinc/79/39/04/962793904.db2.gz MPHSVNYMTIORTA-JTQLQIEISA-N 1 2 247.323 2.017 20 0 BEADLO COc1c[nH+]c(NCC(C)(F)F)c(C)c1 ZINC001154855559 962871362 /nfs/dbraw/zinc/87/13/62/962871362.db2.gz WTYAQDNIGOLJME-UHFFFAOYSA-N 1 2 216.231 2.466 20 0 BEADLO COc1cc(C)c[nH+]c1NCC(C)(F)F ZINC001154858749 962877162 /nfs/dbraw/zinc/87/71/62/962877162.db2.gz RHIDFTUVNFCQDR-UHFFFAOYSA-N 1 2 216.231 2.466 20 0 BEADLO c1nc(CNc2cc3ccccc3c[nH+]2)no1 ZINC001154893694 962881628 /nfs/dbraw/zinc/88/16/28/962881628.db2.gz NCWZNASQRDFDLJ-UHFFFAOYSA-N 1 2 226.239 2.230 20 0 BEADLO COc1cc(C)c[nH+]c1NCc1cnoc1C ZINC001154884389 962884501 /nfs/dbraw/zinc/88/45/01/962884501.db2.gz KDTDIRSXUQVYKX-UHFFFAOYSA-N 1 2 233.271 2.307 20 0 BEADLO CN(C)c1cc(NC(C)(C)C2CC2)[nH+]cn1 ZINC001155065024 962957773 /nfs/dbraw/zinc/95/77/73/962957773.db2.gz OHFWUQBLDLTCPQ-UHFFFAOYSA-N 1 2 220.320 2.143 20 0 BEADLO CN(C)c1cc(NC(C)(C)C2CC2)nc[nH+]1 ZINC001155065024 962957798 /nfs/dbraw/zinc/95/77/98/962957798.db2.gz OHFWUQBLDLTCPQ-UHFFFAOYSA-N 1 2 220.320 2.143 20 0 BEADLO COc1cc(C)c[nH+]c1N1C[C@@H](C)OC[C@H]1C ZINC001155428786 963074670 /nfs/dbraw/zinc/07/46/70/963074670.db2.gz FGXZQBZHPVQBKM-GHMZBOCLSA-N 1 2 236.315 2.012 20 0 BEADLO CCCc1cc(N2C[C@@H](C)OC[C@H]2C)nc(C)[nH+]1 ZINC001155429140 963078674 /nfs/dbraw/zinc/07/86/74/963078674.db2.gz RMQXWONVEMBUHL-GHMZBOCLSA-N 1 2 249.358 2.351 20 0 BEADLO COc1cc(F)cc(-c2c[nH+]cn2C)c1 ZINC000713178945 963102143 /nfs/dbraw/zinc/10/21/43/963102143.db2.gz COSUZDCABJHVQS-UHFFFAOYSA-N 1 2 206.220 2.235 20 0 BEADLO Cc1cc(F)cc(C[N@@H+]2CC[C@@H](O)[C@H](F)C2)c1 ZINC001143580287 963148207 /nfs/dbraw/zinc/14/82/07/963148207.db2.gz CQRVVCOMALUAIF-CHWSQXEVSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cc(F)cc(C[N@H+]2CC[C@@H](O)[C@H](F)C2)c1 ZINC001143580287 963148217 /nfs/dbraw/zinc/14/82/17/963148217.db2.gz CQRVVCOMALUAIF-CHWSQXEVSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1ncoc1C[NH2+][C@@H]1COCc2ccccc21 ZINC000895026763 963180196 /nfs/dbraw/zinc/18/01/96/963180196.db2.gz ZRVHXORJVTZAEH-CYBMUJFWSA-N 1 2 244.294 2.344 20 0 BEADLO CCCc1cc(N2CCOCC23CC3)nc(C)[nH+]1 ZINC001155840586 963183771 /nfs/dbraw/zinc/18/37/71/963183771.db2.gz UEFQMKRUEHLOOR-UHFFFAOYSA-N 1 2 247.342 2.107 20 0 BEADLO CC[C@@H](C)Nc1ccn2cc(N)[nH+]c2c1 ZINC001167997982 963200909 /nfs/dbraw/zinc/20/09/09/963200909.db2.gz CPSXAGCRKKNFKT-MRVPVSSYSA-N 1 2 204.277 2.127 20 0 BEADLO CC[C@H](C)Nc1ccc(-n2c[nH+]c(C)c2C)nn1 ZINC001168000252 963219997 /nfs/dbraw/zinc/21/99/97/963219997.db2.gz SGIPKCARJIJVEA-VIFPVBQESA-N 1 2 245.330 2.490 20 0 BEADLO Nc1[nH+]c(NC[C@@H]2CCCCO2)ccc1Cl ZINC001156380933 963331490 /nfs/dbraw/zinc/33/14/90/963331490.db2.gz LPNSZISNOFGRAL-QMMMGPOBSA-N 1 2 241.722 2.298 20 0 BEADLO COC(C)(C)CNc1[nH+]ccc(F)c1C ZINC001156439314 963349774 /nfs/dbraw/zinc/34/97/74/963349774.db2.gz QLLGOVCXDUCIKO-UHFFFAOYSA-N 1 2 212.268 2.366 20 0 BEADLO CCSc1cc[nH+]c(N[C@@H](C)CCO)c1 ZINC001156455336 963360720 /nfs/dbraw/zinc/36/07/20/963360720.db2.gz MAZYWBPPPGKLJE-VIFPVBQESA-N 1 2 226.345 2.376 20 0 BEADLO CCc1[nH]c(CNC(=O)c2ccoc2CC)c[nH+]1 ZINC001156537908 963378544 /nfs/dbraw/zinc/37/85/44/963378544.db2.gz CMCRBEQLRKCSJQ-UHFFFAOYSA-N 1 2 247.298 2.058 20 0 BEADLO CCc1[nH]cc(CNC(=O)c2ccoc2CC)[nH+]1 ZINC001156537908 963378552 /nfs/dbraw/zinc/37/85/52/963378552.db2.gz CMCRBEQLRKCSJQ-UHFFFAOYSA-N 1 2 247.298 2.058 20 0 BEADLO CCc1[nH]c(CNC(=O)CCCC(C)C)c[nH+]1 ZINC001156538120 963381252 /nfs/dbraw/zinc/38/12/52/963381252.db2.gz LJFOGWZTAAFWGF-UHFFFAOYSA-N 1 2 237.347 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)CCCC(C)C)[nH+]1 ZINC001156538120 963381262 /nfs/dbraw/zinc/38/12/62/963381262.db2.gz LJFOGWZTAAFWGF-UHFFFAOYSA-N 1 2 237.347 2.415 20 0 BEADLO CCC/C(C)=C\C(=O)NCc1c[nH+]c(CC)[nH]1 ZINC001156538053 963382697 /nfs/dbraw/zinc/38/26/97/963382697.db2.gz IQLCKKBUVSOYJC-YFHOEESVSA-N 1 2 235.331 2.335 20 0 BEADLO CCCC(C)=CC(=O)NCc1c[nH]c(CC)[nH+]1 ZINC001156538053 963382707 /nfs/dbraw/zinc/38/27/07/963382707.db2.gz IQLCKKBUVSOYJC-YFHOEESVSA-N 1 2 235.331 2.335 20 0 BEADLO CCn1cncc1C[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000669550994 963480860 /nfs/dbraw/zinc/48/08/60/963480860.db2.gz JYYGGWXTQRKPLC-PWSUYJOCSA-N 1 2 225.311 2.083 20 0 BEADLO CCn1cncc1C[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000669550994 963480864 /nfs/dbraw/zinc/48/08/64/963480864.db2.gz JYYGGWXTQRKPLC-PWSUYJOCSA-N 1 2 225.311 2.083 20 0 BEADLO CC(C)NC(=S)Nc1ccn2cc[nH+]c2c1 ZINC001200778509 963482386 /nfs/dbraw/zinc/48/23/86/963482386.db2.gz UCMLBWPCSBYPDZ-UHFFFAOYSA-N 1 2 234.328 2.029 20 0 BEADLO Cc1c(F)cc[nH+]c1N1CC2CC(C2)C1 ZINC001156892698 963483588 /nfs/dbraw/zinc/48/35/88/963483588.db2.gz QVQGRKGCKKOUFH-UHFFFAOYSA-N 1 2 206.264 2.375 20 0 BEADLO COc1ccc(C)[nH+]c1N(C)Cc1cncs1 ZINC001157085330 963528281 /nfs/dbraw/zinc/52/82/81/963528281.db2.gz XDUKEZBNESMFRL-UHFFFAOYSA-N 1 2 249.339 2.492 20 0 BEADLO COc1cc(C)c[nH+]c1N1CCC[C@H]2C[C@H]21 ZINC001157143405 963545281 /nfs/dbraw/zinc/54/52/81/963545281.db2.gz HTOZRAQMXFENTL-WDEREUQCSA-N 1 2 218.300 2.387 20 0 BEADLO COc1ccc(C)[nH+]c1N(C)Cc1ccno1 ZINC001157348778 963579068 /nfs/dbraw/zinc/57/90/68/963579068.db2.gz OPSMTCJXTHCJSZ-UHFFFAOYSA-N 1 2 233.271 2.023 20 0 BEADLO COc1cc(C)c[nH+]c1N(C)Cc1ccno1 ZINC001157354579 963583086 /nfs/dbraw/zinc/58/30/86/963583086.db2.gz ZGJYPQITIQHKNT-UHFFFAOYSA-N 1 2 233.271 2.023 20 0 BEADLO CCC1(CNc2[nH+]cc(OC)cc2C)COC1 ZINC001157542872 963657145 /nfs/dbraw/zinc/65/71/45/963657145.db2.gz YZUZDWLBMSBBCY-UHFFFAOYSA-N 1 2 236.315 2.237 20 0 BEADLO CSCc1cc[nH+]c(NCC2CC(=O)C2)c1 ZINC001157611356 963680228 /nfs/dbraw/zinc/68/02/28/963680228.db2.gz RNMCWVXETVYRFI-UHFFFAOYSA-N 1 2 236.340 2.336 20 0 BEADLO Cc1nc2[nH]ccc2c(NC[C@H]2CC(C)(C)O2)[nH+]1 ZINC001157663684 963694003 /nfs/dbraw/zinc/69/40/03/963694003.db2.gz WXHKRMRVZNRWLD-SECBINFHSA-N 1 2 246.314 2.246 20 0 BEADLO CCOc1ccc[nH+]c1NC[C@@H]1CC(C)(C)O1 ZINC001157663755 963694073 /nfs/dbraw/zinc/69/40/73/963694073.db2.gz LGBBMXNUWYORJB-JTQLQIEISA-N 1 2 236.315 2.460 20 0 BEADLO COc1c[nH+]c(N[C@@H](CO)C(C)(C)C)c(C)c1 ZINC001157757593 963719523 /nfs/dbraw/zinc/71/95/23/963719523.db2.gz OIPDWYUQANDZLG-NSHDSACASA-N 1 2 238.331 2.218 20 0 BEADLO Cc1[nH]c2ccc(OC[C@H]3CCCO3)cc2[nH+]1 ZINC001228325486 963756664 /nfs/dbraw/zinc/75/66/64/963756664.db2.gz AAQHAPPZJDJNPV-LLVKDONJSA-N 1 2 232.283 2.429 20 0 BEADLO Cc1cc(N[C@H]2COC(=O)C2)[nH+]c2ccccc12 ZINC001158243977 963837931 /nfs/dbraw/zinc/83/79/31/963837931.db2.gz GJWMFNMXGADGGF-SNVBAGLBSA-N 1 2 242.278 2.271 20 0 BEADLO CCc1cc(NCC[C@@H](O)C2CC2)nc(CC)[nH+]1 ZINC000897384996 963877825 /nfs/dbraw/zinc/87/78/25/963877825.db2.gz PRFOALCMSQZMOV-GFCCVEGCSA-N 1 2 249.358 2.174 20 0 BEADLO C[C@@H](Nc1cc(N)cc(Cl)[nH+]1)c1cnccn1 ZINC001158594487 963893935 /nfs/dbraw/zinc/89/39/35/963893935.db2.gz QTNRELOEKKAMQO-SSDOTTSWSA-N 1 2 249.705 2.280 20 0 BEADLO CC(=O)[C@@H]1CCCN1c1[nH+]ccc2c1ccn2C ZINC001158836393 963940689 /nfs/dbraw/zinc/94/06/89/963940689.db2.gz OOWADSBBNUOHLU-LBPRGKRZSA-N 1 2 243.310 2.131 20 0 BEADLO OC[C@H]1C[C@@H](Nc2[nH+]cccc2-n2cccc2)C1 ZINC001168239134 964030876 /nfs/dbraw/zinc/03/08/76/964030876.db2.gz AVJROOQVWANCRX-TXEJJXNPSA-N 1 2 243.310 2.055 20 0 BEADLO Cc1cc2cc(N[C@H]3C[C@@H](CO)C3)[nH+]cc2[nH]1 ZINC001168239166 964031611 /nfs/dbraw/zinc/03/16/11/964031611.db2.gz DDJSHXYAPZATEB-JGZJWPJOSA-N 1 2 231.299 2.054 20 0 BEADLO CN(C)c1ccc(NC[C@H]2C[C@H](F)C2)[nH+]c1 ZINC001168238679 964032104 /nfs/dbraw/zinc/03/21/04/964032104.db2.gz OQAUBPUDAOBZSE-MGCOHNPYSA-N 1 2 223.295 2.308 20 0 BEADLO CCc1nc(OC)ccc1Nc1ccc(N)[nH+]c1 ZINC001159281795 964050217 /nfs/dbraw/zinc/05/02/17/964050217.db2.gz BBRCFJVRPXCKCL-UHFFFAOYSA-N 1 2 244.298 2.373 20 0 BEADLO Cc1c(F)cc[nH+]c1N[C@@H]1CCOC[C@@H]1C ZINC001159711873 964161723 /nfs/dbraw/zinc/16/17/23/964161723.db2.gz URGFZQMNQNHODH-GZMMTYOYSA-N 1 2 224.279 2.366 20 0 BEADLO Cc1cccc(-c2noc(C[NH+]3CCC3)n2)c1F ZINC001212093406 964253226 /nfs/dbraw/zinc/25/32/26/964253226.db2.gz UPVCYQWWEWSQLU-UHFFFAOYSA-N 1 2 247.273 2.390 20 0 BEADLO Fc1cccc(-c2noc(C[NH+]3CCC3)n2)c1 ZINC001212093063 964255562 /nfs/dbraw/zinc/25/55/62/964255562.db2.gz DDCZDBZHLJKCJV-UHFFFAOYSA-N 1 2 233.246 2.081 20 0 BEADLO CCOC(=O)[C@H](C)CNc1[nH+]ccc(F)c1C ZINC001160890907 964434441 /nfs/dbraw/zinc/43/44/41/964434441.db2.gz ZCAGSCZLEKIXDY-MRVPVSSYSA-N 1 2 240.278 2.140 20 0 BEADLO CCC1(Nc2ccc(-n3cccc3)c[nH+]2)COC1 ZINC001168322084 964442465 /nfs/dbraw/zinc/44/24/65/964442465.db2.gz QJSXGFBGIZSARO-UHFFFAOYSA-N 1 2 243.310 2.463 20 0 BEADLO OCc1ccc(Nc2cccc3[nH+]c[nH]c32)cn1 ZINC001213028989 964506275 /nfs/dbraw/zinc/50/62/75/964506275.db2.gz BZMIXKVGZDGGCO-UHFFFAOYSA-N 1 2 240.266 2.194 20 0 BEADLO Cc1ncc(Nc2cccc3[nH+]c[nH]c32)c(=O)[nH]1 ZINC001213029209 964511667 /nfs/dbraw/zinc/51/16/67/964511667.db2.gz IKPKLDYTWOETRE-UHFFFAOYSA-N 1 2 241.254 2.111 20 0 BEADLO c1cc2cc(NC3CSC3)[nH+]cc2[nH]1 ZINC001168360501 964568239 /nfs/dbraw/zinc/56/82/39/964568239.db2.gz MPYKXOQPIVWOLL-UHFFFAOYSA-N 1 2 205.286 2.090 20 0 BEADLO CC[C@@H](Nc1cc(N(C)C)nc[nH+]1)C(F)(F)F ZINC001161373170 964583124 /nfs/dbraw/zinc/58/31/24/964583124.db2.gz FXJMIFUWBUJHLI-SSDOTTSWSA-N 1 2 248.252 2.295 20 0 BEADLO CC[C@@H](Nc1cc(N(C)C)[nH+]cn1)C(F)(F)F ZINC001161373170 964583129 /nfs/dbraw/zinc/58/31/29/964583129.db2.gz FXJMIFUWBUJHLI-SSDOTTSWSA-N 1 2 248.252 2.295 20 0 BEADLO CN(C)c1ccc(NCC(F)(F)F)[nH+]c1 ZINC001161630675 964652357 /nfs/dbraw/zinc/65/23/57/964652357.db2.gz LYWYATJHAVEWTK-UHFFFAOYSA-N 1 2 219.210 2.122 20 0 BEADLO CCN(C)c1cc(NCC(C)(C)C)[nH+]cn1 ZINC001161635043 964654772 /nfs/dbraw/zinc/65/47/72/964654772.db2.gz UXTZPPDFQILHRN-UHFFFAOYSA-N 1 2 222.336 2.391 20 0 BEADLO CCN(C)c1cc(NCC(C)(C)C)nc[nH+]1 ZINC001161635043 964654774 /nfs/dbraw/zinc/65/47/74/964654774.db2.gz UXTZPPDFQILHRN-UHFFFAOYSA-N 1 2 222.336 2.391 20 0 BEADLO Cc1cc(NCCCn2cc[nH+]c2)cc(F)n1 ZINC001161682262 964683329 /nfs/dbraw/zinc/68/33/29/964683329.db2.gz OFNFABFQROVPGN-UHFFFAOYSA-N 1 2 234.278 2.228 20 0 BEADLO Cc1cncc(NCCCn2cc[nH+]c2)c1 ZINC001161684794 964683789 /nfs/dbraw/zinc/68/37/89/964683789.db2.gz QAJZARNZVKKGLZ-UHFFFAOYSA-N 1 2 216.288 2.089 20 0 BEADLO COc1cc(C)c[nH+]c1N[C@H]1CCO[C@H](C)C1 ZINC001161690750 964687421 /nfs/dbraw/zinc/68/74/21/964687421.db2.gz BDXFGAPBFLCMMR-MNOVXSKESA-N 1 2 236.315 2.378 20 0 BEADLO COc1cc(C)c[nH+]c1N[C@@H]1CCO[C@@H](C)C1 ZINC001161690752 964687901 /nfs/dbraw/zinc/68/79/01/964687901.db2.gz BDXFGAPBFLCMMR-WDEREUQCSA-N 1 2 236.315 2.378 20 0 BEADLO COC[C@@H](Nc1ccc(Cl)c(N)[nH+]1)C1CC1 ZINC001161726663 964715778 /nfs/dbraw/zinc/71/57/78/964715778.db2.gz PJMUKSGBWLVVIL-SECBINFHSA-N 1 2 241.722 2.154 20 0 BEADLO FC(F)CNc1ccc(Cn2cc[nH+]c2)cn1 ZINC001161811538 964764133 /nfs/dbraw/zinc/76/41/33/964764133.db2.gz PHMHEZBXULXVDS-UHFFFAOYSA-N 1 2 238.241 2.003 20 0 BEADLO Nc1[nH+]ccc(F)c1NCCC(F)(F)F ZINC001161824752 964774358 /nfs/dbraw/zinc/77/43/58/964774358.db2.gz XPUJVPQOJDHPEQ-UHFFFAOYSA-N 1 2 223.173 2.167 20 0 BEADLO Nc1cn2ccc(NCCC(F)(F)F)cc2[nH+]1 ZINC001161824447 964774782 /nfs/dbraw/zinc/77/47/82/964774782.db2.gz RPOMATOCAWJOOX-UHFFFAOYSA-N 1 2 244.220 2.281 20 0 BEADLO Cc1cc(NC2CCOCC2)[nH+]c2cc[nH]c21 ZINC001161867155 964800842 /nfs/dbraw/zinc/80/08/42/964800842.db2.gz OQHPWCWGXJXFJM-UHFFFAOYSA-N 1 2 231.299 2.462 20 0 BEADLO Cc1cc(NCC2COC2)cc(OC(F)F)[nH+]1 ZINC001161955205 964834914 /nfs/dbraw/zinc/83/49/14/964834914.db2.gz NGYTYJJTEONNDR-UHFFFAOYSA-N 1 2 244.241 2.050 20 0 BEADLO COc1c[nH+]c(NCc2nccnc2C)c(C)c1 ZINC001162000794 964841786 /nfs/dbraw/zinc/84/17/86/964841786.db2.gz QEHHIPJBIXJYMY-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO COc1c[nH+]c(NC2CC(F)C2)c2[nH]ccc21 ZINC001162209616 964870571 /nfs/dbraw/zinc/87/05/71/964870571.db2.gz KRYCPWPWFOMVEP-UHFFFAOYSA-N 1 2 235.262 2.484 20 0 BEADLO Nc1[nH+]ccc(F)c1NCCC1CCOCC1 ZINC001162222313 964881145 /nfs/dbraw/zinc/88/11/45/964881145.db2.gz MDQUMKZREWZINO-UHFFFAOYSA-N 1 2 239.294 2.032 20 0 BEADLO O[C@@H](CNc1ccn2cc[nH+]c2c1)c1ccco1 ZINC001162258914 964895009 /nfs/dbraw/zinc/89/50/09/964895009.db2.gz VEAATJARAHHETD-NSHDSACASA-N 1 2 243.266 2.073 20 0 BEADLO CC(C)Oc1cc(NCC2CC(=O)C2)cc[nH+]1 ZINC001168392107 965123842 /nfs/dbraw/zinc/12/38/42/965123842.db2.gz JNCCCJHLJXVFBF-UHFFFAOYSA-N 1 2 234.299 2.260 20 0 BEADLO O=C1CC(CNc2ccc(N3CCCC3)[nH+]c2)C1 ZINC001168394368 965133237 /nfs/dbraw/zinc/13/32/37/965133237.db2.gz DDVIFUJINXGSTK-UHFFFAOYSA-N 1 2 245.326 2.073 20 0 BEADLO Cc1cc(NCC2CC(=O)C2)c[nH+]c1C ZINC001168394644 965139643 /nfs/dbraw/zinc/13/96/43/965139643.db2.gz MPQZQLXELKDTAT-UHFFFAOYSA-N 1 2 204.273 2.089 20 0 BEADLO COC(=O)CCN(C)c1[nH+]ccc2ccccc21 ZINC000168759072 965230277 /nfs/dbraw/zinc/23/02/77/965230277.db2.gz URDRJEMKZSPEDU-UHFFFAOYSA-N 1 2 244.294 2.234 20 0 BEADLO CCOc1ccnc(C[N@@H+]2CCC[C@@H]2CF)c1 ZINC001232585388 965385424 /nfs/dbraw/zinc/38/54/24/965385424.db2.gz ABQUUFYCFZUTCI-GFCCVEGCSA-N 1 2 238.306 2.414 20 0 BEADLO CCOc1ccnc(C[N@H+]2CCC[C@@H]2CF)c1 ZINC001232585388 965385435 /nfs/dbraw/zinc/38/54/35/965385435.db2.gz ABQUUFYCFZUTCI-GFCCVEGCSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cc2[nH+]c(N3CCC3)ccc2c(OC)c1 ZINC001163538995 965436681 /nfs/dbraw/zinc/43/66/81/965436681.db2.gz RNDPLLNUVBGXHD-UHFFFAOYSA-N 1 2 244.294 2.462 20 0 BEADLO CC(C)N(c1cc(N(C)C)[nH+]cn1)C(C)C ZINC001163572987 965456708 /nfs/dbraw/zinc/45/67/08/965456708.db2.gz XBXBRHHIFGJUGT-UHFFFAOYSA-N 1 2 222.336 2.166 20 0 BEADLO CC(C)N(c1cc(N(C)C)nc[nH+]1)C(C)C ZINC001163572987 965456718 /nfs/dbraw/zinc/45/67/18/965456718.db2.gz XBXBRHHIFGJUGT-UHFFFAOYSA-N 1 2 222.336 2.166 20 0 BEADLO CCN(C)c1cc(N2CCC[C@H](C)C2)nc[nH+]1 ZINC001163583306 965464926 /nfs/dbraw/zinc/46/49/26/965464926.db2.gz PJSCSVNTQRXSNC-NSHDSACASA-N 1 2 234.347 2.169 20 0 BEADLO CCN(C)c1cc(N2CCC[C@H](C)C2)[nH+]cn1 ZINC001163583306 965464933 /nfs/dbraw/zinc/46/49/33/965464933.db2.gz PJSCSVNTQRXSNC-NSHDSACASA-N 1 2 234.347 2.169 20 0 BEADLO COC(=O)/C=C/c1cc(C)c[nH+]c1N(C)C(C)C ZINC001163622003 965483907 /nfs/dbraw/zinc/48/39/07/965483907.db2.gz RWVZDXATYXIROH-VOTSOKGWSA-N 1 2 248.326 2.421 20 0 BEADLO Cc1cnsc1C[N@@H+]1CCc2cnccc2C1 ZINC001233317789 965485940 /nfs/dbraw/zinc/48/59/40/965485940.db2.gz CWRBBHIZIFSPEO-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cnsc1C[N@H+]1CCc2cnccc2C1 ZINC001233317789 965485945 /nfs/dbraw/zinc/48/59/45/965485945.db2.gz CWRBBHIZIFSPEO-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Nc1[nH+]ccc(F)c1NCCc1cccc(O)c1 ZINC001163698929 965516588 /nfs/dbraw/zinc/51/65/88/965516588.db2.gz ZCAVICXKMLYECL-UHFFFAOYSA-N 1 2 247.273 2.163 20 0 BEADLO CC1(C)C[C@H](CNc2ccc3c([nH+]2)CCOC3)O1 ZINC001168450854 965745465 /nfs/dbraw/zinc/74/54/65/965745465.db2.gz GZGPVDHFPPSIKO-LLVKDONJSA-N 1 2 248.326 2.134 20 0 BEADLO C[C@@H]1CC[C@@H](O)CN1c1cccc(C2CC2)[nH+]1 ZINC001164123917 965746659 /nfs/dbraw/zinc/74/66/59/965746659.db2.gz QCCOYIZBQWSZAY-ZYHUDNBSSA-N 1 2 232.327 2.309 20 0 BEADLO CC1(C)C[C@@H](CNc2ccn3cc[nH+]c3c2)O1 ZINC001168452248 965751404 /nfs/dbraw/zinc/75/14/04/965751404.db2.gz FCNJSDDPHZEZGK-NSHDSACASA-N 1 2 231.299 2.314 20 0 BEADLO C[C@]1(CO)CCN(c2cc3ccccc3c[nH+]2)C1 ZINC001164138676 965755465 /nfs/dbraw/zinc/75/54/65/965755465.db2.gz CGYZXDDZQMAYRV-HNNXBMFYSA-N 1 2 242.322 2.444 20 0 BEADLO C[C@]1(CO)CCN(c2cccc(C3CC3)[nH+]2)C1 ZINC001164148693 965759515 /nfs/dbraw/zinc/75/95/15/965759515.db2.gz QXYQMNQDBRQEMA-AWEZNQCLSA-N 1 2 232.327 2.168 20 0 BEADLO Cc1nc(N2C[C@@H](C)C[C@H]2CO)cc(C(C)C)[nH+]1 ZINC001164149096 965760659 /nfs/dbraw/zinc/76/06/59/965760659.db2.gz ZJEZLWSIXJIWNI-JQWIXIFHSA-N 1 2 249.358 2.116 20 0 BEADLO Cc1cc(N2C[C@@H](C)C[C@H]2CO)nc(C(C)C)[nH+]1 ZINC001164152545 965764646 /nfs/dbraw/zinc/76/46/46/965764646.db2.gz OYUWAAHCIUZWDO-JQWIXIFHSA-N 1 2 249.358 2.116 20 0 BEADLO Cc1c(F)cc[nH+]c1N1CCC[C@@H](O)[C@H](C)C1 ZINC001164217035 965799155 /nfs/dbraw/zinc/79/91/55/965799155.db2.gz AFNVKTUDYRRQIM-BXKDBHETSA-N 1 2 238.306 2.126 20 0 BEADLO CCN(CC)C(=O)[C@H](C)Nc1c[nH+]cc(C)c1C ZINC001164625143 965934403 /nfs/dbraw/zinc/93/44/03/965934403.db2.gz STFAMVFGTPTENV-LBPRGKRZSA-N 1 2 249.358 2.367 20 0 BEADLO CNc1ccc(Nc2cnsc2)c[nH+]1 ZINC001203451775 965982336 /nfs/dbraw/zinc/98/23/36/965982336.db2.gz CAVSBCMHBDZRMV-UHFFFAOYSA-N 1 2 206.274 2.323 20 0 BEADLO Cc1cc(N2CC[C@@](C)(O)C2)nc(C(C)(C)C)[nH+]1 ZINC001165232388 965996890 /nfs/dbraw/zinc/99/68/90/965996890.db2.gz ZFPIIJBSPDBSIU-CQSZACIVSA-N 1 2 249.358 2.044 20 0 BEADLO COc1cc(C)c[nH+]c1N1CC2(C1)CCCOC2 ZINC001165306796 966042735 /nfs/dbraw/zinc/04/27/35/966042735.db2.gz XFAZKUNOHUZGFS-UHFFFAOYSA-N 1 2 248.326 2.015 20 0 BEADLO C[C@H]1COC[C@H]1[NH2+]CC(F)(F)c1ccccc1 ZINC000699759944 966066561 /nfs/dbraw/zinc/06/65/61/966066561.db2.gz OHTGXLLKEXRBRW-CMPLNLGQSA-N 1 2 241.281 2.403 20 0 BEADLO C[C@@H](CCO)Nc1[nH+]cccc1-n1cccc1 ZINC001165866863 966179883 /nfs/dbraw/zinc/17/98/83/966179883.db2.gz LPIGBJWFWPPQTH-NSHDSACASA-N 1 2 231.299 2.055 20 0 BEADLO COCC(C)(C)Nc1cc2cc[nH]c2c[nH+]1 ZINC001165966126 966212703 /nfs/dbraw/zinc/21/27/03/966212703.db2.gz IVXITJAKNUQWTR-UHFFFAOYSA-N 1 2 219.288 2.400 20 0 BEADLO Cc1cc(N[C@H](C)CCO)[nH+]c2cc[nH]c21 ZINC001165965629 966214267 /nfs/dbraw/zinc/21/42/67/966214267.db2.gz DGJHOZLNHISYHX-SECBINFHSA-N 1 2 219.288 2.054 20 0 BEADLO CCc1nc(N2CCCCC23COC3)cc(C)[nH+]1 ZINC001166695836 966366477 /nfs/dbraw/zinc/36/64/77/966366477.db2.gz HQHUKADBZBZYPP-UHFFFAOYSA-N 1 2 247.342 2.107 20 0 BEADLO CNc1ccc(Nc2cc([C@@H](C)O)ccn2)c[nH+]1 ZINC001203455054 966373199 /nfs/dbraw/zinc/37/31/99/966373199.db2.gz PPLFMKXNXSHKLQ-SECBINFHSA-N 1 2 244.298 2.315 20 0 BEADLO CNc1ccc(Nc2cc([C@H](C)O)ccn2)c[nH+]1 ZINC001203455057 966373756 /nfs/dbraw/zinc/37/37/56/966373756.db2.gz PPLFMKXNXSHKLQ-VIFPVBQESA-N 1 2 244.298 2.315 20 0 BEADLO CCn1c[nH+]cc1COC(=O)C(C1CC1)C1CC1 ZINC001518048836 966406054 /nfs/dbraw/zinc/40/60/54/966406054.db2.gz QENDBAQVXVHZJY-UHFFFAOYSA-N 1 2 248.326 2.382 20 0 BEADLO CCc1cn(Cc2cn(C)nc2C(F)F)c[nH+]1 ZINC001166822331 966427030 /nfs/dbraw/zinc/42/70/30/966427030.db2.gz KFHNZPWBAZGJNR-UHFFFAOYSA-N 1 2 240.257 2.165 20 0 BEADLO CN(CC1COC1)c1ccc(C(C)(C)C)c[nH+]1 ZINC001166950696 966478597 /nfs/dbraw/zinc/47/85/97/966478597.db2.gz AVSLZKRDHOKYGE-UHFFFAOYSA-N 1 2 234.343 2.462 20 0 BEADLO CC[N@H+](Cc1nccnc1Cl)C1CC1 ZINC001236614005 966481165 /nfs/dbraw/zinc/48/11/65/966481165.db2.gz NHEMEPCOZSOKLL-UHFFFAOYSA-N 1 2 211.696 2.114 20 0 BEADLO CC[N@@H+](Cc1nccnc1Cl)C1CC1 ZINC001236614005 966481169 /nfs/dbraw/zinc/48/11/69/966481169.db2.gz NHEMEPCOZSOKLL-UHFFFAOYSA-N 1 2 211.696 2.114 20 0 BEADLO COc1ccc(C)[nH+]c1N1C[C@H](C)O[C@@H](C)C1 ZINC001166966062 966490801 /nfs/dbraw/zinc/49/08/01/966490801.db2.gz BCNOULNJTLPSPZ-QWRGUYRKSA-N 1 2 236.315 2.012 20 0 BEADLO CC(C)c1ccc(N(C)C2(C)COC2)[nH+]c1 ZINC001166984688 966504758 /nfs/dbraw/zinc/50/47/58/966504758.db2.gz FRPMSDVVJQGRSV-UHFFFAOYSA-N 1 2 220.316 2.430 20 0 BEADLO CSc1cc[nH+]c(N(C)C2(C)COC2)c1 ZINC001166985679 966508774 /nfs/dbraw/zinc/50/87/74/966508774.db2.gz GHDWKXQPCDZRLE-UHFFFAOYSA-N 1 2 224.329 2.029 20 0 BEADLO CCc1nc(N2CCOC[C@@H]2C(C)C)cc(C)[nH+]1 ZINC001166999298 966511319 /nfs/dbraw/zinc/51/13/19/966511319.db2.gz KGKQBPCNOPJKTA-GFCCVEGCSA-N 1 2 249.358 2.209 20 0 BEADLO CCc1cc(N2CCOC[C@H]2C(C)C)nc(C)[nH+]1 ZINC001166998093 966511927 /nfs/dbraw/zinc/51/19/27/966511927.db2.gz GALCRDXIYWUHMY-ZDUSSCGKSA-N 1 2 249.358 2.209 20 0 BEADLO Cc1cncc(C[N@@H+]2CCc3sccc3C2)n1 ZINC001203164019 966537014 /nfs/dbraw/zinc/53/70/14/966537014.db2.gz PKFMYAPJGWSZSJ-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cncc(C[N@H+]2CCc3sccc3C2)n1 ZINC001203164019 966537021 /nfs/dbraw/zinc/53/70/21/966537021.db2.gz PKFMYAPJGWSZSJ-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ccccc1[C@H]1CCC[N@@H+]1Cc1cnn[nH]1 ZINC001203200928 966547990 /nfs/dbraw/zinc/54/79/90/966547990.db2.gz XUXDNHBZZKKZDT-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1cnn[nH]1 ZINC001203200928 966547999 /nfs/dbraw/zinc/54/79/99/966547999.db2.gz XUXDNHBZZKKZDT-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccccc1[C@H]1CCC[N@@H+]1Cc1c[nH]nn1 ZINC001203200928 966548012 /nfs/dbraw/zinc/54/80/12/966548012.db2.gz XUXDNHBZZKKZDT-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1c[nH]nn1 ZINC001203200928 966548021 /nfs/dbraw/zinc/54/80/21/966548021.db2.gz XUXDNHBZZKKZDT-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccccc1[C@H]1CCC[N@@H+]1Cc1cn[nH]n1 ZINC001203200928 966548033 /nfs/dbraw/zinc/54/80/33/966548033.db2.gz XUXDNHBZZKKZDT-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1cn[nH]n1 ZINC001203200928 966548042 /nfs/dbraw/zinc/54/80/42/966548042.db2.gz XUXDNHBZZKKZDT-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cnn[nH]2)cc1 ZINC001203206426 966550266 /nfs/dbraw/zinc/55/02/66/966550266.db2.gz ZYPODYCKDZUXQR-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2cnn[nH]2)cc1 ZINC001203206426 966550274 /nfs/dbraw/zinc/55/02/74/966550274.db2.gz ZYPODYCKDZUXQR-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2c[nH]nn2)cc1 ZINC001203206426 966550282 /nfs/dbraw/zinc/55/02/82/966550282.db2.gz ZYPODYCKDZUXQR-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2c[nH]nn2)cc1 ZINC001203206426 966550288 /nfs/dbraw/zinc/55/02/88/966550288.db2.gz ZYPODYCKDZUXQR-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO CSc1cc(NC=CC(C)(C)O)cc[nH+]1 ZINC001203216539 966558471 /nfs/dbraw/zinc/55/84/71/966558471.db2.gz KUUMMWZRPPUOIP-FNORWQNLSA-N 1 2 224.329 2.500 20 0 BEADLO Cc1cc(Nc2ccc(C)[nH+]c2C)nn1C ZINC001203363570 966615503 /nfs/dbraw/zinc/61/55/03/966615503.db2.gz VSJWRMGKGIRKBG-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO COc1cc(Nc2ccc(C)[nH+]c2C)ncn1 ZINC001203367163 966618808 /nfs/dbraw/zinc/61/88/08/966618808.db2.gz JCKKZPPKPXEVIS-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO CNc1ccc(Nc2ccc(OC)nc2)c[nH+]1 ZINC001203447700 966644185 /nfs/dbraw/zinc/64/41/85/966644185.db2.gz NVCUNWBGKMCLOZ-UHFFFAOYSA-N 1 2 230.271 2.271 20 0 BEADLO CNc1ccc(Nc2nc(C)co2)c[nH+]1 ZINC001203446451 966650264 /nfs/dbraw/zinc/65/02/64/966650264.db2.gz AEZKXAKQHVPQCY-UHFFFAOYSA-N 1 2 204.233 2.163 20 0 BEADLO CNc1ccc(Nc2cscn2)c[nH+]1 ZINC001203450281 966651997 /nfs/dbraw/zinc/65/19/97/966651997.db2.gz ZQBBHJFKMNAJIV-UHFFFAOYSA-N 1 2 206.274 2.323 20 0 BEADLO CNc1ccc(-n2cnc3ccc(N)cc32)c[nH+]1 ZINC001203456387 966658743 /nfs/dbraw/zinc/65/87/43/966658743.db2.gz DYQPKTNPVICXMX-UHFFFAOYSA-N 1 2 239.282 2.044 20 0 BEADLO CNc1ccc(Nc2c(F)cccc2CO)c[nH+]1 ZINC001203461869 966660200 /nfs/dbraw/zinc/66/02/00/966660200.db2.gz BSFGTXOUZJYJRC-UHFFFAOYSA-N 1 2 247.273 2.498 20 0 BEADLO CCOc1ccccc1C[N@@H+](CC)C1COC1 ZINC001203543643 966678371 /nfs/dbraw/zinc/67/83/71/966678371.db2.gz FVYURDVXSOMDIY-UHFFFAOYSA-N 1 2 235.327 2.306 20 0 BEADLO CCOc1ccccc1C[N@H+](CC)C1COC1 ZINC001203543643 966678368 /nfs/dbraw/zinc/67/83/68/966678368.db2.gz FVYURDVXSOMDIY-UHFFFAOYSA-N 1 2 235.327 2.306 20 0 BEADLO COc1ncc(Nc2cc(C)c[nH+]c2C)cn1 ZINC001203656596 966705731 /nfs/dbraw/zinc/70/57/31/966705731.db2.gz WOXQZUBYHCKIKN-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2nccn3ccnc23)c1 ZINC001203655998 966718320 /nfs/dbraw/zinc/71/83/20/966718320.db2.gz GSJYPWFBNHXRJI-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2ncccn2)c1 ZINC001203653337 966718954 /nfs/dbraw/zinc/71/89/54/966718954.db2.gz LFHXSQYJITTWSL-UHFFFAOYSA-N 1 2 200.245 2.232 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2cncc(N)c2)c1 ZINC001203656665 966723697 /nfs/dbraw/zinc/72/36/97/966723697.db2.gz ZRCLFSOMYZIIMY-UHFFFAOYSA-N 1 2 214.272 2.419 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2cc3n(n2)CCO3)c1 ZINC001203660137 966727516 /nfs/dbraw/zinc/72/75/16/966727516.db2.gz FDNYHCLRAQNRKT-UHFFFAOYSA-N 1 2 230.271 2.031 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCC(=O)[C@H](C)C2)cc1 ZINC001203961755 966832426 /nfs/dbraw/zinc/83/24/26/966832426.db2.gz JWFFGFHAYCDTHV-GFCCVEGCSA-N 1 2 247.338 2.496 20 0 BEADLO CCOc1ccc(C[N@H+]2CCC(=O)[C@H](C)C2)cc1 ZINC001203961755 966832428 /nfs/dbraw/zinc/83/24/28/966832428.db2.gz JWFFGFHAYCDTHV-GFCCVEGCSA-N 1 2 247.338 2.496 20 0 BEADLO Clc1ccc2c(n1)CC[N@@H+](Cc1ncc[nH]1)C2 ZINC001203978983 966838454 /nfs/dbraw/zinc/83/84/54/966838454.db2.gz AZKNRCZGPJGMTJ-UHFFFAOYSA-N 1 2 248.717 2.016 20 0 BEADLO Clc1ccc2c(n1)CC[N@H+](Cc1ncc[nH]1)C2 ZINC001203978983 966838459 /nfs/dbraw/zinc/83/84/59/966838459.db2.gz AZKNRCZGPJGMTJ-UHFFFAOYSA-N 1 2 248.717 2.016 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2ccc[nH]2)C[C@@H]1F ZINC001204006852 966845791 /nfs/dbraw/zinc/84/57/91/966845791.db2.gz MKIFAJBBVOOPSJ-QWRGUYRKSA-N 1 2 214.259 2.287 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2ccc[nH]2)C[C@@H]1F ZINC001204006852 966845793 /nfs/dbraw/zinc/84/57/93/966845793.db2.gz MKIFAJBBVOOPSJ-QWRGUYRKSA-N 1 2 214.259 2.287 20 0 BEADLO CCCCOC(=O)N1CC[NH2+]C2=CCCC[C@@H]21 ZINC001239340214 966863627 /nfs/dbraw/zinc/86/36/27/966863627.db2.gz MNJLNYLPFIYWNH-LBPRGKRZSA-N 1 2 238.331 2.265 20 0 BEADLO CC1(C)C[N@H+](Cc2ccc3c(c2)OCO3)CCO1 ZINC001204049688 966868734 /nfs/dbraw/zinc/86/87/34/966868734.db2.gz IKGMHVWNYKNKMZ-UHFFFAOYSA-N 1 2 249.310 2.026 20 0 BEADLO CC1(C)C[N@@H+](Cc2ccc3c(c2)OCO3)CCO1 ZINC001204049688 966868736 /nfs/dbraw/zinc/86/87/36/966868736.db2.gz IKGMHVWNYKNKMZ-UHFFFAOYSA-N 1 2 249.310 2.026 20 0 BEADLO CC(C)(C)[C@H](CO)Nc1cc2cc[nH]c2c[nH+]1 ZINC001168554910 966878287 /nfs/dbraw/zinc/87/82/87/966878287.db2.gz GPKNUCBKYGMPMS-NSHDSACASA-N 1 2 233.315 2.382 20 0 BEADLO O=C1CC[N@H+](Cc2cccnc2)[C@@H]2CCCC[C@@H]12 ZINC001204068683 966879011 /nfs/dbraw/zinc/87/90/11/966879011.db2.gz DXMDBRJWIXUZLV-ZIAGYGMSSA-N 1 2 244.338 2.415 20 0 BEADLO O=C1CC[N@@H+](Cc2cccnc2)[C@@H]2CCCC[C@@H]12 ZINC001204068683 966879020 /nfs/dbraw/zinc/87/90/20/966879020.db2.gz DXMDBRJWIXUZLV-ZIAGYGMSSA-N 1 2 244.338 2.415 20 0 BEADLO CCOC(=O)C1=C(Nc2cn(C)c[nH+]2)CCCC1 ZINC001168561574 966879421 /nfs/dbraw/zinc/87/94/21/966879421.db2.gz OWJNMMCJFCCFCH-UHFFFAOYSA-N 1 2 249.314 2.223 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2ccncc2)C[C@H]1F ZINC001204080018 966886768 /nfs/dbraw/zinc/88/67/68/966886768.db2.gz DLLVUMOPDBULQT-NEPJUHHUSA-N 1 2 226.270 2.354 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2ccncc2)C[C@H]1F ZINC001204080018 966886769 /nfs/dbraw/zinc/88/67/69/966886769.db2.gz DLLVUMOPDBULQT-NEPJUHHUSA-N 1 2 226.270 2.354 20 0 BEADLO c1c[nH+]c(-c2ccc(C3=CCOC3)cc2)[nH]1 ZINC001239489706 966913270 /nfs/dbraw/zinc/91/32/70/966913270.db2.gz JGKXTWGYTBHHPX-UHFFFAOYSA-N 1 2 212.252 2.490 20 0 BEADLO C[N@H+](Cc1ccc(F)c(F)c1)C1(C)COC1 ZINC001204227731 966932396 /nfs/dbraw/zinc/93/23/96/966932396.db2.gz JRINZMQJNQNIOJ-UHFFFAOYSA-N 1 2 227.254 2.186 20 0 BEADLO C[N@@H+](Cc1ccc(F)c(F)c1)C1(C)COC1 ZINC001204227731 966932406 /nfs/dbraw/zinc/93/24/06/966932406.db2.gz JRINZMQJNQNIOJ-UHFFFAOYSA-N 1 2 227.254 2.186 20 0 BEADLO OC1CC2(C1)C[NH+](Cc1ccc(Cl)s1)C2 ZINC001204437543 966996160 /nfs/dbraw/zinc/99/61/60/966996160.db2.gz CDFDNNSFSYZPOS-UHFFFAOYSA-N 1 2 243.759 2.358 20 0 BEADLO CC(C)Oc1ccc(C[N@@H+]2CCC23COC3)cc1 ZINC001204454483 967001090 /nfs/dbraw/zinc/00/10/90/967001090.db2.gz AQISPKRSETWOBI-UHFFFAOYSA-N 1 2 247.338 2.449 20 0 BEADLO CC(C)Oc1ccc(C[N@H+]2CCC23COC3)cc1 ZINC001204454483 967001096 /nfs/dbraw/zinc/00/10/96/967001096.db2.gz AQISPKRSETWOBI-UHFFFAOYSA-N 1 2 247.338 2.449 20 0 BEADLO CCOC1C[NH+](Cc2ccc3ccccc3n2)C1 ZINC001204499241 967003624 /nfs/dbraw/zinc/00/36/24/967003624.db2.gz FGGMUWBFRSHSBR-UHFFFAOYSA-N 1 2 242.322 2.456 20 0 BEADLO C[N@H+](Cc1cc(F)c(F)c(F)c1)C1(C)COC1 ZINC001204529421 967026886 /nfs/dbraw/zinc/02/68/86/967026886.db2.gz CRCQWQJXOINYNJ-UHFFFAOYSA-N 1 2 245.244 2.325 20 0 BEADLO C[N@@H+](Cc1cc(F)c(F)c(F)c1)C1(C)COC1 ZINC001204529421 967026897 /nfs/dbraw/zinc/02/68/97/967026897.db2.gz CRCQWQJXOINYNJ-UHFFFAOYSA-N 1 2 245.244 2.325 20 0 BEADLO Cc1cc(C[N@H+]2CCOC[C@H]2C)oc1C ZINC001204537015 967033105 /nfs/dbraw/zinc/03/31/05/967033105.db2.gz QTTCNWXIJXQTIW-SNVBAGLBSA-N 1 2 209.289 2.117 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC[C@H]2C)oc1C ZINC001204537015 967033115 /nfs/dbraw/zinc/03/31/15/967033115.db2.gz QTTCNWXIJXQTIW-SNVBAGLBSA-N 1 2 209.289 2.117 20 0 BEADLO COc1cc(Nc2[nH+]cc(O)cc2C)ccc1N ZINC001249715672 967036711 /nfs/dbraw/zinc/03/67/11/967036711.db2.gz ZVJMXKUTHNHZEV-UHFFFAOYSA-N 1 2 245.282 2.430 20 0 BEADLO Nc1[nH+]cccc1Nc1cc[nH]c(=O)c1Cl ZINC001212398437 967037922 /nfs/dbraw/zinc/03/79/22/967037922.db2.gz UUFWESXBFGSVEI-UHFFFAOYSA-N 1 2 236.662 2.161 20 0 BEADLO Nc1ncc(Nc2cccc3[nH+]ccn32)cc1F ZINC001249753576 967039318 /nfs/dbraw/zinc/03/93/18/967039318.db2.gz GUJARALKTRNMCS-UHFFFAOYSA-N 1 2 243.245 2.194 20 0 BEADLO Cc1cccc(Nc2cnc(N)c(F)c2)[nH+]1 ZINC001249754381 967045191 /nfs/dbraw/zinc/04/51/91/967045191.db2.gz MTOYIHDZVIZREG-UHFFFAOYSA-N 1 2 218.235 2.250 20 0 BEADLO Cc1ccc(C(=O)Cc2ccc(N)[nH+]c2)cc1 ZINC001249908428 967145256 /nfs/dbraw/zinc/14/52/56/967145256.db2.gz OEQIPPZIJOOBDS-UHFFFAOYSA-N 1 2 226.279 2.398 20 0 BEADLO COC(=O)CCc1ccc(Cn2cc[nH+]c2)cc1 ZINC001249957882 967201547 /nfs/dbraw/zinc/20/15/47/967201547.db2.gz WLYISIIAEZDDQH-UHFFFAOYSA-N 1 2 244.294 2.037 20 0 BEADLO CCOC(=O)CCCc1ccc(NC)[nH+]c1 ZINC001249974555 967218812 /nfs/dbraw/zinc/21/88/12/967218812.db2.gz OTMAWQAPCNTZHX-UHFFFAOYSA-N 1 2 222.288 2.009 20 0 BEADLO O=c1[nH]cccc1Nc1ccn2cc[nH+]c2c1 ZINC001204951726 967251802 /nfs/dbraw/zinc/25/18/02/967251802.db2.gz YBYNIGGHNIJMGD-UHFFFAOYSA-N 1 2 226.239 2.179 20 0 BEADLO Nc1cccnc1Nc1ccn2cc[nH+]c2c1 ZINC001204950689 967252983 /nfs/dbraw/zinc/25/29/83/967252983.db2.gz FQPQVFYDRAMBNK-UHFFFAOYSA-N 1 2 225.255 2.055 20 0 BEADLO Cn1c[nH+]cc1COCc1ccccc1 ZINC001250000034 967255856 /nfs/dbraw/zinc/25/58/56/967255856.db2.gz SAOQLTIFJWHPJC-UHFFFAOYSA-N 1 2 202.257 2.137 20 0 BEADLO COc1ccc(C[NH+]2CCOCC2)cc1C1CC1 ZINC001250034833 967286692 /nfs/dbraw/zinc/28/66/92/967286692.db2.gz GADMSIHHHCMEKC-UHFFFAOYSA-N 1 2 247.338 2.405 20 0 BEADLO C[C@H]([NH2+]c1c[nH]c2cc(=O)[nH]c-2c1)C(C)(C)C ZINC001168685185 967327846 /nfs/dbraw/zinc/32/78/46/967327846.db2.gz WEXLAKKIKWZJQV-QMMMGPOBSA-N 1 2 233.315 2.423 20 0 BEADLO Nc1ccc(CC(=O)c2ccc(F)cc2)c[nH+]1 ZINC001250134844 967417275 /nfs/dbraw/zinc/41/72/75/967417275.db2.gz NVSQEMTWVOJDQS-UHFFFAOYSA-N 1 2 230.242 2.228 20 0 BEADLO CNc1ccc(CC(=O)Oc2ccccc2)c[nH+]1 ZINC001250258393 967567251 /nfs/dbraw/zinc/56/72/51/967567251.db2.gz BUIJAMUAYHPKFG-UHFFFAOYSA-N 1 2 242.278 2.271 20 0 BEADLO Cc1c[nH+]cc(CCCCCC(N)=O)c1C ZINC001250271976 967594427 /nfs/dbraw/zinc/59/44/27/967594427.db2.gz BTBGJRZTVOJOQA-UHFFFAOYSA-N 1 2 220.316 2.287 20 0 BEADLO CC(C)CCC(=O)OCc1ccc[nH+]c1N ZINC000922231063 967608350 /nfs/dbraw/zinc/60/83/50/967608350.db2.gz DKXPSSBDZQKGLV-UHFFFAOYSA-N 1 2 222.288 2.143 20 0 BEADLO Cn1cnc2ccc(CCn3cc[nH+]c3)cc21 ZINC001250315869 967678538 /nfs/dbraw/zinc/67/85/38/967678538.db2.gz VBWCTWHFMHTFMS-UHFFFAOYSA-N 1 2 226.283 2.013 20 0 BEADLO c1cc2c(nccc2CCn2cc[nH+]c2)[nH]1 ZINC001250315878 967681055 /nfs/dbraw/zinc/68/10/55/967681055.db2.gz VWOHNMZMIROYEO-UHFFFAOYSA-N 1 2 212.256 2.002 20 0 BEADLO CCOc1cc(CCn2cc[nH+]c2)c(F)cn1 ZINC001250316172 967681540 /nfs/dbraw/zinc/68/15/40/967681540.db2.gz CPAXIOXIWYNMBZ-UHFFFAOYSA-N 1 2 235.262 2.059 20 0 BEADLO Cc1cc2cc(CCn3cc[nH+]c3)cnc2[nH]1 ZINC001250316271 967681575 /nfs/dbraw/zinc/68/15/75/967681575.db2.gz GBTYYWPQJJHIDL-UHFFFAOYSA-N 1 2 226.283 2.311 20 0 BEADLO Cc1cc(C)c(Nc2cnn(C3COC3)c2)c[nH+]1 ZINC001205543822 967682578 /nfs/dbraw/zinc/68/25/78/967682578.db2.gz SPFLKFWGKUATQY-UHFFFAOYSA-N 1 2 244.298 2.210 20 0 BEADLO Cc1n[nH]c2ccc(CCn3cc[nH+]c3)cc12 ZINC001250316615 967690437 /nfs/dbraw/zinc/69/04/37/967690437.db2.gz OZIFKNDXVTZZMS-UHFFFAOYSA-N 1 2 226.283 2.311 20 0 BEADLO Cc1cc(CCn2cc[nH+]c2)ccc1O ZINC001250319560 967693618 /nfs/dbraw/zinc/69/36/18/967693618.db2.gz VGPCZFYDMWRBNP-UHFFFAOYSA-N 1 2 202.257 2.140 20 0 BEADLO c1cn(CCc2ccc3c(c2)OCC3)c[nH+]1 ZINC001250319038 967694779 /nfs/dbraw/zinc/69/47/79/967694779.db2.gz PNCNCLOVTRQQNF-UHFFFAOYSA-N 1 2 214.268 2.061 20 0 BEADLO Nc1cc(Cl)ccc1CCn1cc[nH+]c1 ZINC001250319485 967695264 /nfs/dbraw/zinc/69/52/64/967695264.db2.gz RXBGAHOQINYGBM-UHFFFAOYSA-N 1 2 221.691 2.361 20 0 BEADLO Oc1cc(F)c(CCn2cc[nH+]c2)cc1F ZINC001250320123 967698006 /nfs/dbraw/zinc/69/80/06/967698006.db2.gz IDWXLVLNRQOWJK-UHFFFAOYSA-N 1 2 224.210 2.110 20 0 BEADLO CC(C)(O)c1cc(F)cc(CCn2cc[nH+]c2)c1 ZINC001250320850 967698581 /nfs/dbraw/zinc/69/85/81/967698581.db2.gz QXWGGIRFFCBEIA-UHFFFAOYSA-N 1 2 248.301 2.492 20 0 BEADLO O=C1CC[NH+](Cc2ccc3[nH]ccc3c2)CC1 ZINC001205571041 967701759 /nfs/dbraw/zinc/70/17/59/967701759.db2.gz SUDLPKGJVCIXFH-UHFFFAOYSA-N 1 2 228.295 2.333 20 0 BEADLO Clc1cccc2c1C[C@H]([NH+]1CC3(CCO3)C1)C2 ZINC001168739799 967704552 /nfs/dbraw/zinc/70/45/52/967704552.db2.gz QFQYGHLDWDSWOX-LLVKDONJSA-N 1 2 249.741 2.282 20 0 BEADLO Clc1cccc2c1C[C@@H]([NH+]1CC3(CCO3)C1)C2 ZINC001168739800 967705614 /nfs/dbraw/zinc/70/56/14/967705614.db2.gz QFQYGHLDWDSWOX-NSHDSACASA-N 1 2 249.741 2.282 20 0 BEADLO O=c1cc2[nH]cc([NH2+]C(C3CC3)C3CC3)cc-2[nH]1 ZINC001168743454 967720659 /nfs/dbraw/zinc/72/06/59/967720659.db2.gz ATVLNZXHPGVPPT-UHFFFAOYSA-N 1 2 243.310 2.177 20 0 BEADLO Nc1[nH+]cccc1CNc1cccc2c1CCO2 ZINC001205629516 967738513 /nfs/dbraw/zinc/73/85/13/967738513.db2.gz WNCLSFFHKVDNTO-UHFFFAOYSA-N 1 2 241.294 2.211 20 0 BEADLO CN(C)c1ccc(NC2CC(F)C2)[nH+]c1 ZINC001162215236 967745822 /nfs/dbraw/zinc/74/58/22/967745822.db2.gz YZPBKFDZDPYACU-UHFFFAOYSA-N 1 2 209.268 2.060 20 0 BEADLO Cc1noc(Cc2ccc(-c3[nH]cc[nH+]3)cc2)n1 ZINC001250357585 967765113 /nfs/dbraw/zinc/76/51/13/967765113.db2.gz GBPGFYQCEDBOHZ-UHFFFAOYSA-N 1 2 240.266 2.359 20 0 BEADLO CC[N@H+](Cc1cnoc1)Cc1ccccn1 ZINC001205703977 967794751 /nfs/dbraw/zinc/79/47/51/967794751.db2.gz PDQNMSPZAAASKP-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO CC[N@@H+](Cc1cnoc1)Cc1ccccn1 ZINC001205703977 967794772 /nfs/dbraw/zinc/79/47/72/967794772.db2.gz PDQNMSPZAAASKP-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO OCCCCC[N@@H+]1CCC[C@H](F)C(F)(F)C1 ZINC001205796489 967824343 /nfs/dbraw/zinc/82/43/43/967824343.db2.gz RTGYQLKIIWEVLH-JTQLQIEISA-N 1 2 239.281 2.218 20 0 BEADLO OCCCCC[N@H+]1CCC[C@H](F)C(F)(F)C1 ZINC001205796489 967824345 /nfs/dbraw/zinc/82/43/45/967824345.db2.gz RTGYQLKIIWEVLH-JTQLQIEISA-N 1 2 239.281 2.218 20 0 BEADLO Cc1cc(Cc2cc(C)c[nH+]c2C)n(C)n1 ZINC001250417944 967825775 /nfs/dbraw/zinc/82/57/75/967825775.db2.gz NCFBLQGEWSUSGT-UHFFFAOYSA-N 1 2 215.300 2.331 20 0 BEADLO Cc1cccnc1C[N@H+](C)Cc1cnc(C)nc1 ZINC001205807694 967832750 /nfs/dbraw/zinc/83/27/50/967832750.db2.gz UPGVTTFVDVUYSL-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cccnc1C[N@@H+](C)Cc1cnc(C)nc1 ZINC001205807694 967832751 /nfs/dbraw/zinc/83/27/51/967832751.db2.gz UPGVTTFVDVUYSL-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1c[nH+]c(C)c(Cc2ccnn2C)c1 ZINC001250437505 967856654 /nfs/dbraw/zinc/85/66/54/967856654.db2.gz OTMJWOWJJIUDAG-UHFFFAOYSA-N 1 2 201.273 2.023 20 0 BEADLO Cc1cc(C[N@H+](C2CC2)C2COC2)cc(C)n1 ZINC001205960671 967906266 /nfs/dbraw/zinc/90/62/66/967906266.db2.gz XVIRHYPCEYNZIX-UHFFFAOYSA-N 1 2 232.327 2.062 20 0 BEADLO Cc1cc(C[N@@H+](C2CC2)C2COC2)cc(C)n1 ZINC001205960671 967906279 /nfs/dbraw/zinc/90/62/79/967906279.db2.gz XVIRHYPCEYNZIX-UHFFFAOYSA-N 1 2 232.327 2.062 20 0 BEADLO CCc1nc(C)c(C[NH2+]Cc2ccncc2F)o1 ZINC001206006452 967960963 /nfs/dbraw/zinc/96/09/63/967960963.db2.gz YBGNCMKMIMSTEC-UHFFFAOYSA-N 1 2 249.289 2.369 20 0 BEADLO Cc1c[nH+]c(Nc2ccn(C)c(=O)c2)c(C)c1 ZINC001206085695 968052908 /nfs/dbraw/zinc/05/29/08/968052908.db2.gz WFFNRFDHKYHBIG-UHFFFAOYSA-N 1 2 229.283 2.141 20 0 BEADLO CCN(C)c1[nH+]cc(C)cc1/C=C/C(=O)OC ZINC001163585402 968079828 /nfs/dbraw/zinc/07/98/28/968079828.db2.gz ZWUKSBHGPHNIIF-VOTSOKGWSA-N 1 2 234.299 2.032 20 0 BEADLO CNc1ccc(Nc2ncccc2OC)c[nH+]1 ZINC001203448982 968098980 /nfs/dbraw/zinc/09/89/80/968098980.db2.gz TXDKCGLZYFGXMF-UHFFFAOYSA-N 1 2 230.271 2.271 20 0 BEADLO CNc1ccc(Nc2ccsc2C(N)=O)c[nH+]1 ZINC001203448983 968101322 /nfs/dbraw/zinc/10/13/22/968101322.db2.gz TZTPGWWOWBJRGE-UHFFFAOYSA-N 1 2 248.311 2.027 20 0 BEADLO COCCCc1[nH+]c2ccc(OC)cc2n1C ZINC001250603598 968147009 /nfs/dbraw/zinc/14/70/09/968147009.db2.gz WGOBMXMJUNTLKE-UHFFFAOYSA-N 1 2 234.299 2.161 20 0 BEADLO Cc1cc(-c2ccc3c(c2)CC(=O)N3)c[nH+]c1N ZINC001206215766 968148120 /nfs/dbraw/zinc/14/81/20/968148120.db2.gz PAGCRLSYKQTZHS-UHFFFAOYSA-N 1 2 239.278 2.134 20 0 BEADLO CC1(Nc2[nH+]cnc3[nH]cc(F)c32)CCC1 ZINC001164025292 968158991 /nfs/dbraw/zinc/15/89/91/968158991.db2.gz OFWWRJSLVKARHF-UHFFFAOYSA-N 1 2 220.251 2.452 20 0 BEADLO Cc1nonc1CNc1c[nH+]cc(C)c1C ZINC001164059024 968164863 /nfs/dbraw/zinc/16/48/63/968164863.db2.gz HXIQNBYGLOSXCP-UHFFFAOYSA-N 1 2 218.260 2.002 20 0 BEADLO Cc1[nH+]c2ccc(N)cc2n1-c1ccccc1N ZINC001206340143 968243228 /nfs/dbraw/zinc/24/32/28/968243228.db2.gz TWZJYTZEKOBFEL-UHFFFAOYSA-N 1 2 238.294 2.498 20 0 BEADLO C[C@@H](C(=O)N[C@H]1CCCC[C@H]1C)n1cc[nH+]c1 ZINC001251283774 968277664 /nfs/dbraw/zinc/27/76/64/968277664.db2.gz OCWWWLHETWDSRS-WOPDTQHZSA-N 1 2 235.331 2.139 20 0 BEADLO CCCN(CC(C)C)C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001251283996 968279155 /nfs/dbraw/zinc/27/91/55/968279155.db2.gz ZBHMYGLNGWNRIN-GFCCVEGCSA-N 1 2 237.347 2.339 20 0 BEADLO C[C@@H](C(=O)N(C)[C@@H]1CCC[C@@H](C)C1)n1cc[nH+]c1 ZINC001251283605 968280272 /nfs/dbraw/zinc/28/02/72/968280272.db2.gz IZMADZUWQYGCKH-FRRDWIJNSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@H](CN(C)c1cc(N)nc[nH+]1)c1ccccc1 ZINC001251645929 968299341 /nfs/dbraw/zinc/29/93/41/968299341.db2.gz RVIMWZQESLDMCC-LLVKDONJSA-N 1 2 242.326 2.299 20 0 BEADLO COc1cnccc1C[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC001206437979 968302627 /nfs/dbraw/zinc/30/26/27/968302627.db2.gz IJWQFIUCVXCVPT-ZYHUDNBSSA-N 1 2 238.306 2.270 20 0 BEADLO COc1cnccc1C[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC001206437979 968302641 /nfs/dbraw/zinc/30/26/41/968302641.db2.gz IJWQFIUCVXCVPT-ZYHUDNBSSA-N 1 2 238.306 2.270 20 0 BEADLO C[C@H](O)C[N@@H+]1CCc2c3cc(F)ccc3[nH]c2C1 ZINC001251963400 968402699 /nfs/dbraw/zinc/40/26/99/968402699.db2.gz UUMAPKZWDIWVQN-VIFPVBQESA-N 1 2 248.301 2.046 20 0 BEADLO C[C@H](O)C[N@H+]1CCc2c3cc(F)ccc3[nH]c2C1 ZINC001251963400 968402704 /nfs/dbraw/zinc/40/27/04/968402704.db2.gz UUMAPKZWDIWVQN-VIFPVBQESA-N 1 2 248.301 2.046 20 0 BEADLO COc1cccnc1C[N@@H+]1C[C@@H](F)C[C@H]1C ZINC001206610418 968418796 /nfs/dbraw/zinc/41/87/96/968418796.db2.gz GUJIUPGAPSLYLD-ZJUUUORDSA-N 1 2 224.279 2.023 20 0 BEADLO COc1cccnc1C[N@H+]1C[C@@H](F)C[C@H]1C ZINC001206610418 968418800 /nfs/dbraw/zinc/41/88/00/968418800.db2.gz GUJIUPGAPSLYLD-ZJUUUORDSA-N 1 2 224.279 2.023 20 0 BEADLO CCCCOC1C[NH+](C[C@@H](O)c2ccccc2)C1 ZINC001251989287 968428308 /nfs/dbraw/zinc/42/83/08/968428308.db2.gz UHOMOAVVBFIAQH-OAHLLOKOSA-N 1 2 249.354 2.221 20 0 BEADLO CCOC[C@@H](O)CNc1ccc2ccc[nH+]c2c1 ZINC001252031906 968449695 /nfs/dbraw/zinc/44/96/95/968449695.db2.gz HCIADXFTGFYGLM-ZDUSSCGKSA-N 1 2 246.310 2.044 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@H]3CCO[C@H]3C2)cs1 ZINC001206797769 968482171 /nfs/dbraw/zinc/48/21/71/968482171.db2.gz ICKCGIKMFDWSOH-PWSUYJOCSA-N 1 2 238.356 2.062 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@H]3CCO[C@H]3C2)cs1 ZINC001206797769 968482176 /nfs/dbraw/zinc/48/21/76/968482176.db2.gz ICKCGIKMFDWSOH-PWSUYJOCSA-N 1 2 238.356 2.062 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@H](C(F)F)C2)no1 ZINC001206819069 968488260 /nfs/dbraw/zinc/48/82/60/968488260.db2.gz VLKNKILVMPPSBA-SECBINFHSA-N 1 2 230.258 2.460 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@H](C(F)F)C2)no1 ZINC001206819069 968488267 /nfs/dbraw/zinc/48/82/67/968488267.db2.gz VLKNKILVMPPSBA-SECBINFHSA-N 1 2 230.258 2.460 20 0 BEADLO Cc1ncsc1C[N@@H+]1CCCC(=O)CC1 ZINC001206862643 968502025 /nfs/dbraw/zinc/50/20/25/968502025.db2.gz AVSIQEVFMBNQDB-UHFFFAOYSA-N 1 2 224.329 2.007 20 0 BEADLO Cc1ncsc1C[N@H+]1CCCC(=O)CC1 ZINC001206862643 968502029 /nfs/dbraw/zinc/50/20/29/968502029.db2.gz AVSIQEVFMBNQDB-UHFFFAOYSA-N 1 2 224.329 2.007 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCCCC23COC3)c1 ZINC001206854629 968504348 /nfs/dbraw/zinc/50/43/48/968504348.db2.gz KRGVOGPTNJMOJM-UHFFFAOYSA-N 1 2 232.327 2.145 20 0 BEADLO Cc1ccnc(C[N@H+]2CCCCC23COC3)c1 ZINC001206854629 968504352 /nfs/dbraw/zinc/50/43/52/968504352.db2.gz KRGVOGPTNJMOJM-UHFFFAOYSA-N 1 2 232.327 2.145 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000822715598 968534209 /nfs/dbraw/zinc/53/42/09/968534209.db2.gz HBRUDPHTHPNLGM-NEPJUHHUSA-N 1 2 249.358 2.469 20 0 BEADLO C[C@H]1C[C@@H](CF)[N@H+](Cc2cncc(F)c2)C1 ZINC001207017365 968553523 /nfs/dbraw/zinc/55/35/23/968553523.db2.gz VSPPGNPQXRYBAY-CABZTGNLSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@H]1C[C@@H](CF)[N@@H+](Cc2cncc(F)c2)C1 ZINC001207017365 968553529 /nfs/dbraw/zinc/55/35/29/968553529.db2.gz VSPPGNPQXRYBAY-CABZTGNLSA-N 1 2 226.270 2.401 20 0 BEADLO C[N@@H+](Cc1ncccc1F)C[C@@H]1CCCCO1 ZINC001207033570 968566494 /nfs/dbraw/zinc/56/64/94/968566494.db2.gz YWQAKBZPEMETGN-NSHDSACASA-N 1 2 238.306 2.222 20 0 BEADLO C[N@H+](Cc1ncccc1F)C[C@@H]1CCCCO1 ZINC001207033570 968566500 /nfs/dbraw/zinc/56/65/00/968566500.db2.gz YWQAKBZPEMETGN-NSHDSACASA-N 1 2 238.306 2.222 20 0 BEADLO CCCC[C@@H](O)C[N@H+](C)Cc1cscn1 ZINC001252094523 968571717 /nfs/dbraw/zinc/57/17/17/968571717.db2.gz PHSSZZCTVPDISS-LLVKDONJSA-N 1 2 228.361 2.126 20 0 BEADLO CCCC[C@@H](O)C[N@@H+](C)Cc1cscn1 ZINC001252094523 968571722 /nfs/dbraw/zinc/57/17/22/968571722.db2.gz PHSSZZCTVPDISS-LLVKDONJSA-N 1 2 228.361 2.126 20 0 BEADLO c1[nH+]c(CN2CCC3(CC3)C2)n2ccccc12 ZINC001207051203 968579008 /nfs/dbraw/zinc/57/90/08/968579008.db2.gz YGAMTEGGZNYTDJ-UHFFFAOYSA-N 1 2 227.311 2.320 20 0 BEADLO FC[C@H]1[C@@H]2C[N@H+](Cc3ncc(F)cc3F)C[C@H]12 ZINC001207099188 968628149 /nfs/dbraw/zinc/62/81/49/968628149.db2.gz MKSPUWDNDGNWPK-OWUUHHOZSA-N 1 2 242.244 2.007 20 0 BEADLO FC[C@H]1[C@@H]2C[N@@H+](Cc3ncc(F)cc3F)C[C@H]12 ZINC001207099188 968628154 /nfs/dbraw/zinc/62/81/54/968628154.db2.gz MKSPUWDNDGNWPK-OWUUHHOZSA-N 1 2 242.244 2.007 20 0 BEADLO CCn1ccnc1C[N@@H+]1CCC[C@H](C(F)F)C1 ZINC001207145735 968657360 /nfs/dbraw/zinc/65/73/60/968657360.db2.gz RYMLSQFBWCQIHZ-JTQLQIEISA-N 1 2 243.301 2.380 20 0 BEADLO CCn1ccnc1C[N@H+]1CCC[C@H](C(F)F)C1 ZINC001207145735 968657366 /nfs/dbraw/zinc/65/73/66/968657366.db2.gz RYMLSQFBWCQIHZ-JTQLQIEISA-N 1 2 243.301 2.380 20 0 BEADLO Cc1ncccc1C[N@H+](C)Cc1cncs1 ZINC001207153791 968662102 /nfs/dbraw/zinc/66/21/02/968662102.db2.gz LFUHFCBBFQKPHQ-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ncccc1C[N@@H+](C)Cc1cncs1 ZINC001207153791 968662108 /nfs/dbraw/zinc/66/21/08/968662108.db2.gz LFUHFCBBFQKPHQ-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1nonc1[C@H](C)[NH2+]Cc1cccc(F)c1 ZINC000826616544 968672538 /nfs/dbraw/zinc/67/25/38/968672538.db2.gz DNSXMMUAELQJOP-QMMMGPOBSA-N 1 2 235.262 2.368 20 0 BEADLO CCCCNc1[nH+]cccc1CC(=O)OCC ZINC001154827520 968681402 /nfs/dbraw/zinc/68/14/02/968681402.db2.gz JSQAXCDJMXAFDK-UHFFFAOYSA-N 1 2 236.315 2.399 20 0 BEADLO CC(=O)[C@H]1CCCC[N@H+]1Cc1ccnn1C(C)C ZINC001207174950 968681526 /nfs/dbraw/zinc/68/15/26/968681526.db2.gz QIDRCHBDHJWNOW-CQSZACIVSA-N 1 2 249.358 2.408 20 0 BEADLO CC(=O)[C@H]1CCCC[N@@H+]1Cc1ccnn1C(C)C ZINC001207174950 968681533 /nfs/dbraw/zinc/68/15/33/968681533.db2.gz QIDRCHBDHJWNOW-CQSZACIVSA-N 1 2 249.358 2.408 20 0 BEADLO CCCOC1C[NH+](CCOCc2ccccc2)C1 ZINC001207235286 968689146 /nfs/dbraw/zinc/68/91/46/968689146.db2.gz GRNHUWKYIHBNBK-UHFFFAOYSA-N 1 2 249.354 2.314 20 0 BEADLO Cc1cc(-c2ccn3cc[nH+]c3c2)n(C)n1 ZINC001240858022 968772688 /nfs/dbraw/zinc/77/26/88/968772688.db2.gz RGSONNWECQNMHH-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO COC1(C)C[NH+](CCc2ccccc2F)C1 ZINC001207497364 968791793 /nfs/dbraw/zinc/79/17/93/968791793.db2.gz MFISXXFYUJTNLW-UHFFFAOYSA-N 1 2 223.291 2.089 20 0 BEADLO O=C1CC[NH+](CCCc2ccccc2F)CC1 ZINC001207490124 968801847 /nfs/dbraw/zinc/80/18/47/968801847.db2.gz MBCHUXYHQVCBDZ-UHFFFAOYSA-N 1 2 235.302 2.423 20 0 BEADLO CC(C)OC1C[NH+](CCc2ccccc2F)C1 ZINC001207502674 968806352 /nfs/dbraw/zinc/80/63/52/968806352.db2.gz CJBRPLGWNPFXPP-UHFFFAOYSA-N 1 2 237.318 2.477 20 0 BEADLO C[C@H](CCC1CC1)NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001324037539 968887145 /nfs/dbraw/zinc/88/71/45/968887145.db2.gz JSLUIAVQURSDOF-MNOVXSKESA-N 1 2 235.331 2.139 20 0 BEADLO Cc1cn2cc(-c3ccc[nH]c3=O)ccc2[nH+]1 ZINC001241119192 968932100 /nfs/dbraw/zinc/93/21/00/968932100.db2.gz MIZMAPNOFVFDCB-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO CCC[C@H](O)C[N@@H+]1CCCCC(F)(F)C1 ZINC001252771516 968938908 /nfs/dbraw/zinc/93/89/08/968938908.db2.gz KYBQKLFMOOQZQA-JTQLQIEISA-N 1 2 221.291 2.269 20 0 BEADLO CCC[C@H](O)C[N@H+]1CCCCC(F)(F)C1 ZINC001252771516 968938917 /nfs/dbraw/zinc/93/89/17/968938917.db2.gz KYBQKLFMOOQZQA-JTQLQIEISA-N 1 2 221.291 2.269 20 0 BEADLO CCC[C@H](O)CNc1ccc(C)[nH+]c1C ZINC001252770759 968939302 /nfs/dbraw/zinc/93/93/02/968939302.db2.gz KYHGOAPRKQMCKH-NSHDSACASA-N 1 2 208.305 2.271 20 0 BEADLO CCC[C@@H](O)CNc1ccc[nH+]c1N1CCCC1 ZINC001252774865 968944680 /nfs/dbraw/zinc/94/46/80/968944680.db2.gz YZUNVZLZTLQRBD-GFCCVEGCSA-N 1 2 249.358 2.255 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2c(c1)OCCN2 ZINC001241448273 969004213 /nfs/dbraw/zinc/00/42/13/969004213.db2.gz ABCRTDXYWISTAW-UHFFFAOYSA-N 1 2 227.267 2.135 20 0 BEADLO CCCCC[C@@H](O)CNc1[nH+]c[nH]c1C ZINC001253531904 969203465 /nfs/dbraw/zinc/20/34/65/969203465.db2.gz TUZOLSBFQZIAMY-SNVBAGLBSA-N 1 2 211.309 2.071 20 0 BEADLO CC(=O)N1CCC[C@H](C[NH2+]c2ccc(O)cc2)C1 ZINC001168782447 969209970 /nfs/dbraw/zinc/20/99/70/969209970.db2.gz VVBCGQPFDAFLAW-GFCCVEGCSA-N 1 2 248.326 2.063 20 0 BEADLO CC/C=C\CC[N@@H+]1CCC[C@@H](F)C(=O)C1 ZINC001208726170 969212141 /nfs/dbraw/zinc/21/21/41/969212141.db2.gz XQHJZXPAWCXFRX-DLRQAJBASA-N 1 2 213.296 2.346 20 0 BEADLO CC/C=C\CC[N@H+]1CCC[C@@H](F)C(=O)C1 ZINC001208726170 969212146 /nfs/dbraw/zinc/21/21/46/969212146.db2.gz XQHJZXPAWCXFRX-DLRQAJBASA-N 1 2 213.296 2.346 20 0 BEADLO CC/C=C\CC[N@@H+]1C[C@H](CO)CC(F)(F)C1 ZINC001208726324 969214210 /nfs/dbraw/zinc/21/42/10/969214210.db2.gz UAENRHHLAICDGW-DLRQAJBASA-N 1 2 233.302 2.292 20 0 BEADLO CC/C=C\CC[N@H+]1C[C@H](CO)CC(F)(F)C1 ZINC001208726324 969214218 /nfs/dbraw/zinc/21/42/18/969214218.db2.gz UAENRHHLAICDGW-DLRQAJBASA-N 1 2 233.302 2.292 20 0 BEADLO COC(=O)C[NH2+][C@@H](Cc1ccccc1)CC(C)C ZINC001169050952 969368471 /nfs/dbraw/zinc/36/84/71/969368471.db2.gz SVYBBESJDYQBOK-CQSZACIVSA-N 1 2 249.354 2.406 20 0 BEADLO CCCn1c[nH+]cc1CNc1cccc(CO)c1 ZINC000090204353 969393630 /nfs/dbraw/zinc/39/36/30/969393630.db2.gz FPEGXNJXHIKNPD-UHFFFAOYSA-N 1 2 245.326 2.398 20 0 BEADLO CCCc1nnc(C2CN(c3cccc[nH+]3)C2)o1 ZINC001253963182 969432120 /nfs/dbraw/zinc/43/21/20/969432120.db2.gz PWZXJRZGGHPOOG-UHFFFAOYSA-N 1 2 244.298 2.021 20 0 BEADLO CCCc1nnc(Cc2c[nH+]c3ccccn23)o1 ZINC001253983043 969439128 /nfs/dbraw/zinc/43/91/28/969439128.db2.gz NZMLTIDPTRHCHV-UHFFFAOYSA-N 1 2 242.282 2.261 20 0 BEADLO COCC1([N@H+](C)Cc2ncoc2C(C)C)CC1 ZINC001254076987 969470607 /nfs/dbraw/zinc/47/06/07/969470607.db2.gz NEWKSPJVKJREKA-UHFFFAOYSA-N 1 2 238.331 2.409 20 0 BEADLO COCC1([N@@H+](C)Cc2ncoc2C(C)C)CC1 ZINC001254076987 969470616 /nfs/dbraw/zinc/47/06/16/969470616.db2.gz NEWKSPJVKJREKA-UHFFFAOYSA-N 1 2 238.331 2.409 20 0 BEADLO CC(C)[N@@H+]1CC[C@H]1c1nnc(C2CC2)o1 ZINC001254092324 969490888 /nfs/dbraw/zinc/49/08/88/969490888.db2.gz STHJESVJXKVTPF-VIFPVBQESA-N 1 2 207.277 2.102 20 0 BEADLO CC(C)[N@H+]1CC[C@H]1c1nnc(C2CC2)o1 ZINC001254092324 969490895 /nfs/dbraw/zinc/49/08/95/969490895.db2.gz STHJESVJXKVTPF-VIFPVBQESA-N 1 2 207.277 2.102 20 0 BEADLO Cc1noc([C@@H]2CCC[N@@H+]2Cc2cc[nH]c2)n1 ZINC000289779957 969490806 /nfs/dbraw/zinc/49/08/06/969490806.db2.gz LBWYDLJWHYQZDJ-NSHDSACASA-N 1 2 232.287 2.043 20 0 BEADLO Cc1noc([C@@H]2CCC[N@H+]2Cc2cc[nH]c2)n1 ZINC000289779957 969490819 /nfs/dbraw/zinc/49/08/19/969490819.db2.gz LBWYDLJWHYQZDJ-NSHDSACASA-N 1 2 232.287 2.043 20 0 BEADLO Cc1c(F)cc[nH+]c1NCC1(CO)CCC1 ZINC001156271376 969492768 /nfs/dbraw/zinc/49/27/68/969492768.db2.gz SIOXCEVBGYRQJR-UHFFFAOYSA-N 1 2 224.279 2.104 20 0 BEADLO CC(=O)[C@@H]1CC[N@H+](Cc2cnc(Cl)s2)C1 ZINC001209471620 969522513 /nfs/dbraw/zinc/52/25/13/969522513.db2.gz CUDWXJBVGOVEGH-MRVPVSSYSA-N 1 2 244.747 2.207 20 0 BEADLO CC(=O)[C@@H]1CC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC001209471620 969522517 /nfs/dbraw/zinc/52/25/17/969522517.db2.gz CUDWXJBVGOVEGH-MRVPVSSYSA-N 1 2 244.747 2.207 20 0 BEADLO CCOC(=O)C1([NH2+]C2CCC(F)(F)CC2)CC1 ZINC001254208414 969539070 /nfs/dbraw/zinc/53/90/70/969539070.db2.gz MRLBKMLETUFROZ-UHFFFAOYSA-N 1 2 247.285 2.250 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC(=O)C(C)(C)C2)[nH]1 ZINC001209574862 969559261 /nfs/dbraw/zinc/55/92/61/969559261.db2.gz XZEDUNCTCVXEEA-UHFFFAOYSA-N 1 2 220.316 2.124 20 0 BEADLO Cc1ccc(C[N@H+]2CCC(=O)C(C)(C)C2)[nH]1 ZINC001209574862 969559265 /nfs/dbraw/zinc/55/92/65/969559265.db2.gz XZEDUNCTCVXEEA-UHFFFAOYSA-N 1 2 220.316 2.124 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cncs2)[nH]1 ZINC001209576249 969563056 /nfs/dbraw/zinc/56/30/56/969563056.db2.gz ULGOOMHXCCEEEA-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cncs2)[nH]1 ZINC001209576249 969563059 /nfs/dbraw/zinc/56/30/59/969563059.db2.gz ULGOOMHXCCEEEA-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1cnc(Cl)cc1C ZINC001209638152 969569511 /nfs/dbraw/zinc/56/95/11/969569511.db2.gz RSSCYIROPCQOGY-LLVKDONJSA-N 1 2 240.734 2.264 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1cnc(Cl)cc1C ZINC001209638152 969569519 /nfs/dbraw/zinc/56/95/19/969569519.db2.gz RSSCYIROPCQOGY-LLVKDONJSA-N 1 2 240.734 2.264 20 0 BEADLO C[N@@H+]1CCC12CN(CC1CCC(F)(F)CC1)C2 ZINC001276669472 969605937 /nfs/dbraw/zinc/60/59/37/969605937.db2.gz YPQVBPSNDWRSPU-UHFFFAOYSA-N 1 2 244.329 2.202 20 0 BEADLO C[N@H+]1CCC12CN(CC1CCC(F)(F)CC1)C2 ZINC001276669472 969605946 /nfs/dbraw/zinc/60/59/46/969605946.db2.gz YPQVBPSNDWRSPU-UHFFFAOYSA-N 1 2 244.329 2.202 20 0 BEADLO COCc1cc[nH+]c(NCCn2cccc2)c1 ZINC001156300415 969610199 /nfs/dbraw/zinc/61/01/99/969610199.db2.gz XYKOCBANZPTBIB-UHFFFAOYSA-N 1 2 231.299 2.142 20 0 BEADLO CCOC(=O)C1([NH2+]C2CCC3(CC3)CC2)CC1 ZINC001254434181 969610826 /nfs/dbraw/zinc/61/08/26/969610826.db2.gz YPMTZQOHRUOMCM-UHFFFAOYSA-N 1 2 237.343 2.395 20 0 BEADLO CCOC(=O)C[NH2+]C1CCc2ccccc2CC1 ZINC001254451995 969643564 /nfs/dbraw/zinc/64/35/64/969643564.db2.gz BQQXHDIZWKAVGL-UHFFFAOYSA-N 1 2 247.338 2.087 20 0 BEADLO Cc1cc(NC[C@@H](O)C(F)(F)F)c[nH+]c1C ZINC001169456440 969643560 /nfs/dbraw/zinc/64/35/60/969643560.db2.gz QRSBJMCVOHTQDS-SECBINFHSA-N 1 2 234.221 2.034 20 0 BEADLO COc1cnc(Nc2ccc3[nH]c[nH+]c3c2)cn1 ZINC001209842459 969651806 /nfs/dbraw/zinc/65/18/06/969651806.db2.gz KLNXDWFFSXIWDG-UHFFFAOYSA-N 1 2 241.254 2.105 20 0 BEADLO COc1ccc(Nc2ccc3[nH]c[nH+]c3c2)nn1 ZINC001209841649 969651966 /nfs/dbraw/zinc/65/19/66/969651966.db2.gz ZPONWPHFZVMVEO-UHFFFAOYSA-N 1 2 241.254 2.105 20 0 BEADLO Nc1cccnc1Nc1ccc2[nH]c[nH+]c2c1 ZINC001209842858 969652792 /nfs/dbraw/zinc/65/27/92/969652792.db2.gz QXMMOUHUGGQPGP-UHFFFAOYSA-N 1 2 225.255 2.284 20 0 BEADLO OCc1cccc(Nc2ccc3[nH]c[nH+]c3c2)n1 ZINC001209848297 969660599 /nfs/dbraw/zinc/66/05/99/969660599.db2.gz LGKUUPJCJXPLRH-UHFFFAOYSA-N 1 2 240.266 2.194 20 0 BEADLO CN(c1ccc(F)c(CO)c1)c1[nH+]cccc1N ZINC001209872531 969670086 /nfs/dbraw/zinc/67/00/86/969670086.db2.gz DSQGZPQDGSUALC-UHFFFAOYSA-N 1 2 247.273 2.063 20 0 BEADLO Cn1c[nH+]c2cc(Nc3ccnnc3)ccc21 ZINC001209959989 969721998 /nfs/dbraw/zinc/72/19/98/969721998.db2.gz CTYVYPROLQLDHT-UHFFFAOYSA-N 1 2 225.255 2.107 20 0 BEADLO Cc1cc(Nc2cn[nH]c(=O)c2)ccc1[NH+](C)C ZINC001210042457 969774447 /nfs/dbraw/zinc/77/44/47/969774447.db2.gz FIDNAEKNNLLRHW-UHFFFAOYSA-N 1 2 244.298 2.300 20 0 BEADLO O=c1[nH]cncc1Nc1ccc2c[nH+]ccc2c1 ZINC001210046887 969776319 /nfs/dbraw/zinc/77/63/19/969776319.db2.gz XKIPFJNCOZZWIO-UHFFFAOYSA-N 1 2 238.250 2.474 20 0 BEADLO CCCC[C@@H](CC)OCC[NH+]1CCOCC1 ZINC001210209264 969832196 /nfs/dbraw/zinc/83/21/96/969832196.db2.gz YYCUGDBDSSDIHJ-CYBMUJFWSA-N 1 2 229.364 2.304 20 0 BEADLO C[C@@H]1CC[C@H](OCC[NH+]2CCOCC2)C[C@@H]1C ZINC001210209218 969832983 /nfs/dbraw/zinc/83/29/83/969832983.db2.gz YGUBQLAIHJLIDU-RDBSUJKOSA-N 1 2 241.375 2.160 20 0 BEADLO O=C1C[C@H]2C[C@H]([N@H+]3Cc4ncsc4C3)C[C@H]2C1 ZINC001254960429 969840453 /nfs/dbraw/zinc/84/04/53/969840453.db2.gz IWTHMUNNTDSWFY-MYJAWHEDSA-N 1 2 248.351 2.216 20 0 BEADLO O=C1C[C@H]2C[C@H]([N@@H+]3Cc4ncsc4C3)C[C@H]2C1 ZINC001254960429 969840458 /nfs/dbraw/zinc/84/04/58/969840458.db2.gz IWTHMUNNTDSWFY-MYJAWHEDSA-N 1 2 248.351 2.216 20 0 BEADLO O=C1CCC[N@H+](C2Cc3ccccc3C2)C[C@H]1F ZINC001255019329 969849307 /nfs/dbraw/zinc/84/93/07/969849307.db2.gz HALZLJXHNJTYFK-CQSZACIVSA-N 1 2 247.313 2.157 20 0 BEADLO O=C1CCC[N@@H+](C2Cc3ccccc3C2)C[C@H]1F ZINC001255019329 969849312 /nfs/dbraw/zinc/84/93/12/969849312.db2.gz HALZLJXHNJTYFK-CQSZACIVSA-N 1 2 247.313 2.157 20 0 BEADLO Cc1[nH+]cc(Nc2ccc(Cl)nn2)cc1N ZINC001210285717 969851122 /nfs/dbraw/zinc/85/11/22/969851122.db2.gz PXDRRZIHDMVVOO-UHFFFAOYSA-N 1 2 235.678 2.159 20 0 BEADLO Cc1cnc(Cl)c(Nc2c[nH+]c(C)c(N)c2)n1 ZINC001210286950 969854222 /nfs/dbraw/zinc/85/42/22/969854222.db2.gz GYZSDXVXCKHXSH-UHFFFAOYSA-N 1 2 249.705 2.468 20 0 BEADLO Cc1[nH+]cc(Nc2cnn(C(C)C)c2)cc1N ZINC001210287398 969854421 /nfs/dbraw/zinc/85/44/21/969854421.db2.gz SZHLYMPGWMSZGF-UHFFFAOYSA-N 1 2 231.303 2.493 20 0 BEADLO Cc1[nH+]cc(Nc2ccn3nccc3c2)cc1N ZINC001210287585 969854644 /nfs/dbraw/zinc/85/46/44/969854644.db2.gz XIWNCODJWFUGTH-UHFFFAOYSA-N 1 2 239.282 2.364 20 0 BEADLO Cc1cn2c(cccc2Nc2ccn(C)n2)[nH+]1 ZINC001210348410 969874472 /nfs/dbraw/zinc/87/44/72/969874472.db2.gz RYEZURSVNYZHHT-UHFFFAOYSA-N 1 2 227.271 2.120 20 0 BEADLO C[C@H](O)c1cccc(Nc2[nH+]cccc2N)c1 ZINC001210503276 969913131 /nfs/dbraw/zinc/91/31/31/969913131.db2.gz KCOZHLPFFIHDTH-VIFPVBQESA-N 1 2 229.283 2.461 20 0 BEADLO CC(C)n1cc(-c2ccn3cc(N)[nH+]c3c2)cn1 ZINC001242435725 969933313 /nfs/dbraw/zinc/93/33/13/969933313.db2.gz NJWVGSUSNAINTM-UHFFFAOYSA-N 1 2 241.298 2.361 20 0 BEADLO CC(=O)c1cc(Nc2[nH+]cc(C)cc2C)ccn1 ZINC001210589089 969967630 /nfs/dbraw/zinc/96/76/30/969967630.db2.gz LJPINPDWAUBJNV-UHFFFAOYSA-N 1 2 241.294 2.462 20 0 BEADLO COc1cc(Nc2cc[nH]c(=O)c2)cc(C)[nH+]1 ZINC001210777571 970027620 /nfs/dbraw/zinc/02/76/20/970027620.db2.gz YWQSRWURGAMTLX-UHFFFAOYSA-N 1 2 231.255 2.243 20 0 BEADLO Cc1nc2c(s1)C[N@@H+]([C@@H]1CCSC1)C2 ZINC001255296641 970060272 /nfs/dbraw/zinc/06/02/72/970060272.db2.gz UYPFTNJXLVIBQE-MRVPVSSYSA-N 1 2 226.370 2.273 20 0 BEADLO Cc1nc2c(s1)C[N@H+]([C@@H]1CCSC1)C2 ZINC001255296641 970060284 /nfs/dbraw/zinc/06/02/84/970060284.db2.gz UYPFTNJXLVIBQE-MRVPVSSYSA-N 1 2 226.370 2.273 20 0 BEADLO Cc1ccc(Nc2ccc(CC(N)=O)cc2)[nH+]c1 ZINC001211011921 970116518 /nfs/dbraw/zinc/11/65/18/970116518.db2.gz JRTBICXVGHWWMP-UHFFFAOYSA-N 1 2 241.294 2.161 20 0 BEADLO Cc1c(CO)cccc1N(C)c1[nH+]cccc1N ZINC001211161215 970161638 /nfs/dbraw/zinc/16/16/38/970161638.db2.gz OTHQFOPXBABBBF-UHFFFAOYSA-N 1 2 243.310 2.232 20 0 BEADLO COc1ccc2ccccc2c1C[NH+]1CC(O)C1 ZINC000291463052 970179888 /nfs/dbraw/zinc/17/98/88/970179888.db2.gz NUWWCYUJZAYVIE-UHFFFAOYSA-N 1 2 243.306 2.025 20 0 BEADLO COc1cccc(Nc2ccc(N(C)C)[nH+]c2)n1 ZINC001211295457 970221651 /nfs/dbraw/zinc/22/16/51/970221651.db2.gz FWQXPJYOTKTVMO-UHFFFAOYSA-N 1 2 244.298 2.295 20 0 BEADLO Cn1c[nH+]cc1-c1cnc2[nH]cc(F)c2c1 ZINC001243066712 970253566 /nfs/dbraw/zinc/25/35/66/970253566.db2.gz ANCXFYQGVWFQII-UHFFFAOYSA-N 1 2 216.219 2.103 20 0 BEADLO COc1cncc(Nc2c[nH+]c(C)cc2C)n1 ZINC001213505412 970329799 /nfs/dbraw/zinc/32/97/99/970329799.db2.gz DJNNXHMARPTJLV-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO Cc1cc(C)c(N(C)c2ncccc2N)c[nH+]1 ZINC001213503412 970331612 /nfs/dbraw/zinc/33/16/12/970331612.db2.gz DRFXUTQHVXDLSH-UHFFFAOYSA-N 1 2 228.299 2.444 20 0 BEADLO Cc1cc(C)c(Nc2nccn3ccnc23)c[nH+]1 ZINC001213507946 970332106 /nfs/dbraw/zinc/33/21/06/970332106.db2.gz IABMTBWUDPPPMO-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cc1c[nH+]cc(Nc2cnc(N(C)C)nc2)c1C ZINC001213527500 970349307 /nfs/dbraw/zinc/34/93/07/970349307.db2.gz PERKRGHWSCADAN-UHFFFAOYSA-N 1 2 243.314 2.298 20 0 BEADLO COCCn1cnc(Nc2c[nH+]cc(C)c2C)c1 ZINC001213528335 970355544 /nfs/dbraw/zinc/35/55/44/970355544.db2.gz AXXHXFHUDNDFMH-UHFFFAOYSA-N 1 2 246.314 2.285 20 0 BEADLO C[C@H](CC(F)(F)F)[N@H+]1CCC(=O)[C@@H](F)CC1 ZINC001255646583 970427890 /nfs/dbraw/zinc/42/78/90/970427890.db2.gz PFFPHXYCMZAOIZ-SFYZADRCSA-N 1 2 241.228 2.330 20 0 BEADLO C[C@H](CC(F)(F)F)[N@@H+]1CCC(=O)[C@@H](F)CC1 ZINC001255646583 970427894 /nfs/dbraw/zinc/42/78/94/970427894.db2.gz PFFPHXYCMZAOIZ-SFYZADRCSA-N 1 2 241.228 2.330 20 0 BEADLO CCOc1ccc[nH+]c1N[C@@H]1CCOC[C@H]1C ZINC000302444324 970439187 /nfs/dbraw/zinc/43/91/87/970439187.db2.gz UKHWSGAGEYDECT-GHMZBOCLSA-N 1 2 236.315 2.317 20 0 BEADLO CCOc1ccc[nH+]c1N[C@H]1CCOC[C@@H]1C ZINC000302444326 970439325 /nfs/dbraw/zinc/43/93/25/970439325.db2.gz UKHWSGAGEYDECT-QWRGUYRKSA-N 1 2 236.315 2.317 20 0 BEADLO Nc1ccc(F)c(-c2ccc[nH+]c2N)c1 ZINC001243284449 970447763 /nfs/dbraw/zinc/44/77/63/970447763.db2.gz OKHFJHUNPRAZPM-UHFFFAOYSA-N 1 2 203.220 2.052 20 0 BEADLO CCCOC(=O)C[NH2+][C@@H](C)Cc1ccc(C)cc1 ZINC001255782801 970482645 /nfs/dbraw/zinc/48/26/45/970482645.db2.gz JTHDUGRKAGGNOA-ZDUSSCGKSA-N 1 2 249.354 2.469 20 0 BEADLO Cc1cc(NCC2CC(=O)C2)nc(C2CC2)[nH+]1 ZINC001157611088 970486699 /nfs/dbraw/zinc/48/66/99/970486699.db2.gz FNCKTYQEUVAFLY-UHFFFAOYSA-N 1 2 231.299 2.053 20 0 BEADLO C=Cc1ccc(NCC2CC(=O)C2)[nH+]c1 ZINC001157609288 970488703 /nfs/dbraw/zinc/48/87/03/970488703.db2.gz PXFQYWVCPVVOBF-UHFFFAOYSA-N 1 2 202.257 2.116 20 0 BEADLO Cc1ccc(Nc2[nH+]cccc2N)c(CO)c1 ZINC001214449306 970501058 /nfs/dbraw/zinc/50/10/58/970501058.db2.gz SBYRJRQZURVXPR-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO CC/C=C/C[NH2+][C@@H]1CCCc2[nH]ncc21 ZINC000401599155 970706904 /nfs/dbraw/zinc/70/69/04/970706904.db2.gz YYDNTAYCXFZATD-PGLGOXFNSA-N 1 2 205.305 2.343 20 0 BEADLO Cc1cn2cc(-c3ccc(CO)nc3)ccc2[nH+]1 ZINC001243468185 970758900 /nfs/dbraw/zinc/75/89/00/970758900.db2.gz HIGGYKRUAUTVKJ-UHFFFAOYSA-N 1 2 239.278 2.197 20 0 BEADLO Cc1c(O)cccc1C[N@H+]1CCC(=O)C[C@H]1C ZINC001144108014 972572072 /nfs/dbraw/zinc/57/20/72/972572072.db2.gz RTPPFHVSAGVYTJ-SNVBAGLBSA-N 1 2 233.311 2.254 20 0 BEADLO Cc1c(O)cccc1C[N@@H+]1CCC(=O)C[C@H]1C ZINC001144108014 972572088 /nfs/dbraw/zinc/57/20/88/972572088.db2.gz RTPPFHVSAGVYTJ-SNVBAGLBSA-N 1 2 233.311 2.254 20 0 BEADLO Cn1c[nH+]cc1CO[C@@H]1COCc2ccccc21 ZINC001222594960 972591410 /nfs/dbraw/zinc/59/14/10/972591410.db2.gz JZPFRKCQOJNLIP-CQSZACIVSA-N 1 2 244.294 2.208 20 0 BEADLO Cn1c[nH+]cc1CO[C@@H]1CCc2cccnc21 ZINC001222595361 972596634 /nfs/dbraw/zinc/59/66/34/972596634.db2.gz XWJOXGOGXOUZFA-GFCCVEGCSA-N 1 2 229.283 2.019 20 0 BEADLO Cc1c(O)cccc1C[NH+]1CC(OC(C)C)C1 ZINC001144120873 972597410 /nfs/dbraw/zinc/59/74/10/972597410.db2.gz BJDNORREUGYAJT-UHFFFAOYSA-N 1 2 235.327 2.310 20 0 BEADLO Cn1c[nH+]cc1CO[C@@H]1CCCC[C@H]1F ZINC001222600177 972598948 /nfs/dbraw/zinc/59/89/48/972598948.db2.gz MTVZCPHQBSIWAB-GHMZBOCLSA-N 1 2 212.268 2.217 20 0 BEADLO CCc1cc(C[NH+]2CC(C)(O)C2)cc(CC)c1O ZINC001144137514 972607626 /nfs/dbraw/zinc/60/76/26/972607626.db2.gz JFUNGRGBNTZICP-UHFFFAOYSA-N 1 2 249.354 2.084 20 0 BEADLO COc1ccc(O)cc1-c1c[nH+]c(N)c(C)c1 ZINC001222635283 972612287 /nfs/dbraw/zinc/61/22/87/972612287.db2.gz WMILYFKSKZYFMQ-UHFFFAOYSA-N 1 2 230.267 2.353 20 0 BEADLO Cc1cccc(C2([NH2+]Cc3nnc[nH]3)CCC2)c1 ZINC001327535839 972618550 /nfs/dbraw/zinc/61/85/50/972618550.db2.gz SUSNTLSWEIESDY-UHFFFAOYSA-N 1 2 242.326 2.282 20 0 BEADLO COc1cc(C[N@H+](C)CCC(F)(F)F)on1 ZINC001327545431 972622839 /nfs/dbraw/zinc/62/28/39/972622839.db2.gz FHJOANAECVWDPR-UHFFFAOYSA-N 1 2 238.209 2.067 20 0 BEADLO COc1cc(C[N@@H+](C)CCC(F)(F)F)on1 ZINC001327545431 972622844 /nfs/dbraw/zinc/62/28/44/972622844.db2.gz FHJOANAECVWDPR-UHFFFAOYSA-N 1 2 238.209 2.067 20 0 BEADLO C[N@H+](Cc1ccno1)Cc1ccc2cc[nH]c2n1 ZINC001144187774 972678710 /nfs/dbraw/zinc/67/87/10/972678710.db2.gz NUPUVAYECFPGNJ-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO C[N@@H+](Cc1ccno1)Cc1ccc2cc[nH]c2n1 ZINC001144187774 972678717 /nfs/dbraw/zinc/67/87/17/972678717.db2.gz NUPUVAYECFPGNJ-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO C[C@]1(F)CCC[N@H+](Cc2ccc(O)cn2)C1 ZINC001144253080 972712949 /nfs/dbraw/zinc/71/29/49/972712949.db2.gz GTVMHZKXEGIKER-LBPRGKRZSA-N 1 2 224.279 2.111 20 0 BEADLO C[C@]1(F)CCC[N@@H+](Cc2ccc(O)cn2)C1 ZINC001144253080 972712961 /nfs/dbraw/zinc/71/29/61/972712961.db2.gz GTVMHZKXEGIKER-LBPRGKRZSA-N 1 2 224.279 2.111 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nnc[nH]2)[C@H]2CCCC[C@H]12 ZINC001327866410 972768670 /nfs/dbraw/zinc/76/86/70/972768670.db2.gz XBKXNKGYSSAKBK-UTUOFQBUSA-N 1 2 234.347 2.205 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nnc[nH]2)[C@H]2CCCC[C@H]12 ZINC001327866410 972768684 /nfs/dbraw/zinc/76/86/84/972768684.db2.gz XBKXNKGYSSAKBK-UTUOFQBUSA-N 1 2 234.347 2.205 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nc[nH]n2)[C@H]2CCCC[C@H]12 ZINC001327866410 972768698 /nfs/dbraw/zinc/76/86/98/972768698.db2.gz XBKXNKGYSSAKBK-UTUOFQBUSA-N 1 2 234.347 2.205 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nc[nH]n2)[C@H]2CCCC[C@H]12 ZINC001327866410 972768716 /nfs/dbraw/zinc/76/87/16/972768716.db2.gz XBKXNKGYSSAKBK-UTUOFQBUSA-N 1 2 234.347 2.205 20 0 BEADLO Cc1cc(C[N@@H+]2CCSC[C@H]2C2CC2)n[nH]1 ZINC001327951010 972824914 /nfs/dbraw/zinc/82/49/14/972824914.db2.gz AZLWBNIGCWTVDA-LBPRGKRZSA-N 1 2 237.372 2.046 20 0 BEADLO Cc1cc(C[N@H+]2CCSC[C@H]2C2CC2)n[nH]1 ZINC001327951010 972824918 /nfs/dbraw/zinc/82/49/18/972824918.db2.gz AZLWBNIGCWTVDA-LBPRGKRZSA-N 1 2 237.372 2.046 20 0 BEADLO c1cc(C[N@@H+]2CCn3cncc3C2)n(C2CC2)c1 ZINC001327951728 972826697 /nfs/dbraw/zinc/82/66/97/972826697.db2.gz JYEVWCPSICIMIN-UHFFFAOYSA-N 1 2 242.326 2.035 20 0 BEADLO c1cc(C[N@H+]2CCn3cncc3C2)n(C2CC2)c1 ZINC001327951728 972826701 /nfs/dbraw/zinc/82/67/01/972826701.db2.gz JYEVWCPSICIMIN-UHFFFAOYSA-N 1 2 242.326 2.035 20 0 BEADLO COc1cc(Cl)cc(C[N@H+](C)CC(C)=O)c1 ZINC001144479021 972836245 /nfs/dbraw/zinc/83/62/45/972836245.db2.gz QCSSRGIUUTURFD-UHFFFAOYSA-N 1 2 241.718 2.369 20 0 BEADLO COc1cc(Cl)cc(C[N@@H+](C)CC(C)=O)c1 ZINC001144479021 972836248 /nfs/dbraw/zinc/83/62/48/972836248.db2.gz QCSSRGIUUTURFD-UHFFFAOYSA-N 1 2 241.718 2.369 20 0 BEADLO C[NH+]1CC(OCc2cc3ccccc3cn2)C1 ZINC001223255774 972898458 /nfs/dbraw/zinc/89/84/58/972898458.db2.gz IUALQVQXZAQYRR-UHFFFAOYSA-N 1 2 228.295 2.065 20 0 BEADLO C[C@@H]1CC[N@@H+]1Cc1cc(F)c(O)cc1F ZINC001144648797 972906047 /nfs/dbraw/zinc/90/60/47/972906047.db2.gz XKZBRXSSDYFSJV-SSDOTTSWSA-N 1 2 213.227 2.265 20 0 BEADLO C[C@@H]1CC[N@H+]1Cc1cc(F)c(O)cc1F ZINC001144648797 972906063 /nfs/dbraw/zinc/90/60/63/972906063.db2.gz XKZBRXSSDYFSJV-SSDOTTSWSA-N 1 2 213.227 2.265 20 0 BEADLO Cc1cc(CO[C@@H]2CCOC2)cc(C)[nH+]1 ZINC001223418840 973052087 /nfs/dbraw/zinc/05/20/87/973052087.db2.gz BJFRGSALOAQYHT-GFCCVEGCSA-N 1 2 207.273 2.004 20 0 BEADLO COC[C@H](C)OCc1cc(C)[nH+]c(C)c1 ZINC001223418787 973052216 /nfs/dbraw/zinc/05/22/16/973052216.db2.gz AQSFVNHQRBJFGK-NSHDSACASA-N 1 2 209.289 2.250 20 0 BEADLO Cc1cc(CO[C@@H]2C=C(C)OC(=O)C2)cc(C)[nH+]1 ZINC001223422685 973063220 /nfs/dbraw/zinc/06/32/20/973063220.db2.gz YWGIHZWVKYJWKP-CYBMUJFWSA-N 1 2 247.294 2.434 20 0 BEADLO Cc1cc(CNC(=O)NC2(C)CC2)cc(C)[nH+]1 ZINC001328836949 973366481 /nfs/dbraw/zinc/36/64/81/973366481.db2.gz ZKRUPGQCBVSPQI-UHFFFAOYSA-N 1 2 233.315 2.050 20 0 BEADLO C[C@@H](C(=O)N1[C@@H]2CC[C@H]1CC(C)C2)n1cc[nH+]c1 ZINC001328844241 973373861 /nfs/dbraw/zinc/37/38/61/973373861.db2.gz PVROKKMNSLLKAF-FOIKRFTLSA-N 1 2 247.342 2.234 20 0 BEADLO CC(C)[NH+]1CC(O[C@H](C)c2nccs2)C1 ZINC001224004569 973397627 /nfs/dbraw/zinc/39/76/27/973397627.db2.gz VKUJWQOBNSOOTA-SECBINFHSA-N 1 2 226.345 2.313 20 0 BEADLO CO[C@H]1CCCC[C@@H]1[NH2+]CC(F)(F)C(F)F ZINC000234772459 973757951 /nfs/dbraw/zinc/75/79/51/973757951.db2.gz KTFZMYUUDZMWGE-YUMQZZPRSA-N 1 2 243.244 2.434 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@@H+]1Cc1cc(C)n[nH]1 ZINC001329658603 973872750 /nfs/dbraw/zinc/87/27/50/973872750.db2.gz FSHAZHFBIDZFGM-GFCCVEGCSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@H+]1Cc1cc(C)n[nH]1 ZINC001329658603 973872753 /nfs/dbraw/zinc/87/27/53/973872753.db2.gz FSHAZHFBIDZFGM-GFCCVEGCSA-N 1 2 237.347 2.108 20 0 BEADLO CN(C)c1cc(NCc2ccccc2)[nH+]cn1 ZINC000585415021 973908384 /nfs/dbraw/zinc/90/83/84/973908384.db2.gz IPKNZEDRHROYKP-UHFFFAOYSA-N 1 2 228.299 2.155 20 0 BEADLO CN(C)c1cc(NCc2ccccc2)nc[nH+]1 ZINC000585415021 973908399 /nfs/dbraw/zinc/90/83/99/973908399.db2.gz IPKNZEDRHROYKP-UHFFFAOYSA-N 1 2 228.299 2.155 20 0 BEADLO Fc1cccc2c1CC[C@@H]([NH+]1CC3(CCO3)C1)C2 ZINC001171435981 974051425 /nfs/dbraw/zinc/05/14/25/974051425.db2.gz AGZYXMPBYQMSPX-GFCCVEGCSA-N 1 2 247.313 2.158 20 0 BEADLO CC[NH+]1CC(OCC[Si](C)(C)C)C1 ZINC001224911876 974073721 /nfs/dbraw/zinc/07/37/21/974073721.db2.gz PZLCMEGXTICKFV-UHFFFAOYSA-N 1 2 201.386 2.045 20 0 BEADLO Cc1cccc2c1CC[C@H]([N@@H+]1CCC(=O)C1)C2 ZINC001171571195 974104366 /nfs/dbraw/zinc/10/43/66/974104366.db2.gz UYHCFVGAJHISDF-ZDUSSCGKSA-N 1 2 229.323 2.127 20 0 BEADLO Cc1cccc2c1CC[C@H]([N@H+]1CCC(=O)C1)C2 ZINC001171571195 974104375 /nfs/dbraw/zinc/10/43/75/974104375.db2.gz UYHCFVGAJHISDF-ZDUSSCGKSA-N 1 2 229.323 2.127 20 0 BEADLO CSCCOC1C[NH+](Cc2ccccc2)C1 ZINC001225040215 974165798 /nfs/dbraw/zinc/16/57/98/974165798.db2.gz LQWDJAOOGVSDCQ-UHFFFAOYSA-N 1 2 237.368 2.250 20 0 BEADLO C[C@@H]1CC(=O)CC[N@@H+]1[C@@H]1Cc2cccc(F)c2C1 ZINC001171792661 974183655 /nfs/dbraw/zinc/18/36/55/974183655.db2.gz IDRYJYIHZSJRDE-ZYHUDNBSSA-N 1 2 247.313 2.346 20 0 BEADLO C[C@@H]1CC(=O)CC[N@H+]1[C@@H]1Cc2cccc(F)c2C1 ZINC001171792661 974183671 /nfs/dbraw/zinc/18/36/71/974183671.db2.gz IDRYJYIHZSJRDE-ZYHUDNBSSA-N 1 2 247.313 2.346 20 0 BEADLO CC[C@H](C)[C@@H](C)[N@@H+]1CC[C@@H](O)C(F)(F)C1 ZINC001171847476 974211205 /nfs/dbraw/zinc/21/12/05/974211205.db2.gz MFRUOJLVQLRPLN-IVZWLZJFSA-N 1 2 221.291 2.123 20 0 BEADLO CC[C@H](C)[C@@H](C)[N@H+]1CC[C@@H](O)C(F)(F)C1 ZINC001171847476 974211216 /nfs/dbraw/zinc/21/12/16/974211216.db2.gz MFRUOJLVQLRPLN-IVZWLZJFSA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)[NH+]1CC(Oc2ccc(Cl)cn2)C1 ZINC001225273105 974336153 /nfs/dbraw/zinc/33/61/53/974336153.db2.gz HCPGRWLVTNPPBW-UHFFFAOYSA-N 1 2 226.707 2.206 20 0 BEADLO C[NH+](C)Cc1ncccc1OC1CCC(=O)CC1 ZINC001225278132 974345622 /nfs/dbraw/zinc/34/56/22/974345622.db2.gz BKWWXFYREAGVGG-UHFFFAOYSA-N 1 2 248.326 2.034 20 0 BEADLO CC(C)CCOC(=O)[C@H](C)Oc1cc[nH+]cc1 ZINC001225295605 974370239 /nfs/dbraw/zinc/37/02/39/974370239.db2.gz LZWXWAKYQVKTGX-NSHDSACASA-N 1 2 237.299 2.438 20 0 BEADLO c1ccc2c(c1)C[C@@H]([N@@H+]1CCC13COC3)CS2 ZINC001172201237 974484101 /nfs/dbraw/zinc/48/41/01/974484101.db2.gz GDYNUKKYYXCKSR-GFCCVEGCSA-N 1 2 247.363 2.178 20 0 BEADLO c1ccc2c(c1)C[C@@H]([N@H+]1CCC13COC3)CS2 ZINC001172201237 974484104 /nfs/dbraw/zinc/48/41/04/974484104.db2.gz GDYNUKKYYXCKSR-GFCCVEGCSA-N 1 2 247.363 2.178 20 0 BEADLO CC[NH+]1CC(Oc2cnc3sccc3c2)C1 ZINC001225444771 974494696 /nfs/dbraw/zinc/49/46/96/974494696.db2.gz BEJKIXLXMKYZQV-UHFFFAOYSA-N 1 2 234.324 2.379 20 0 BEADLO Cc1cc2c(cccc2OC2C[NH+](C)C2)[nH]1 ZINC001225464416 974510400 /nfs/dbraw/zinc/51/04/00/974510400.db2.gz JWOOBSVVBMLAIP-UHFFFAOYSA-N 1 2 216.284 2.169 20 0 BEADLO CC(C)CC1(NC(=O)[C@@H](C)n2cc[nH+]c2)CC1 ZINC001330968149 974545475 /nfs/dbraw/zinc/54/54/75/974545475.db2.gz CDOGZDYAARGCIO-LLVKDONJSA-N 1 2 235.331 2.139 20 0 BEADLO CC1(C)C[C@H]([NH+]2CC(Oc3ccccc3)C2)CO1 ZINC001172287572 974550429 /nfs/dbraw/zinc/55/04/29/974550429.db2.gz XPLKAQSHXUREIQ-LBPRGKRZSA-N 1 2 247.338 2.317 20 0 BEADLO CCc1nn(C[N@@H+]2CC[C@H](C)C2)c(=S)o1 ZINC001331006749 974555670 /nfs/dbraw/zinc/55/56/70/974555670.db2.gz CKFCORMQVLUKOA-QMMMGPOBSA-N 1 2 227.333 2.067 20 0 BEADLO CCc1nn(C[N@H+]2CC[C@H](C)C2)c(=S)o1 ZINC001331006749 974555678 /nfs/dbraw/zinc/55/56/78/974555678.db2.gz CKFCORMQVLUKOA-QMMMGPOBSA-N 1 2 227.333 2.067 20 0 BEADLO CCc1nn(C[N@@H+]2C[C@H](C)C[C@@H]2C)c(=S)o1 ZINC001331008388 974556066 /nfs/dbraw/zinc/55/60/66/974556066.db2.gz PJPMIUJXKQFCFS-BDAKNGLRSA-N 1 2 241.360 2.456 20 0 BEADLO CCc1nn(C[N@@H+]2C[C@H](C)C[C@H]2C)c(=S)o1 ZINC001331008391 974555980 /nfs/dbraw/zinc/55/59/80/974555980.db2.gz PJPMIUJXKQFCFS-RKDXNWHRSA-N 1 2 241.360 2.456 20 0 BEADLO CCc1nn(C[N@H+]2C[C@H](C)C[C@H]2C)c(=S)o1 ZINC001331008391 974555983 /nfs/dbraw/zinc/55/59/83/974555983.db2.gz PJPMIUJXKQFCFS-RKDXNWHRSA-N 1 2 241.360 2.456 20 0 BEADLO CCc1ccc(N(CC)CCOC)[nH+]c1 ZINC001331091133 974596495 /nfs/dbraw/zinc/59/64/95/974596495.db2.gz HYFPGANDWYVQAN-UHFFFAOYSA-N 1 2 208.305 2.117 20 0 BEADLO CC[C@@H](C)OCC[C@@H](C)[N@@H+]1Cc2cncnc2C1 ZINC001172341746 974608335 /nfs/dbraw/zinc/60/83/35/974608335.db2.gz VATXHVJGZSJAID-VXGBXAGGSA-N 1 2 249.358 2.386 20 0 BEADLO CC[C@@H](C)OCC[C@@H](C)[N@H+]1Cc2cncnc2C1 ZINC001172341746 974608338 /nfs/dbraw/zinc/60/83/38/974608338.db2.gz VATXHVJGZSJAID-VXGBXAGGSA-N 1 2 249.358 2.386 20 0 BEADLO CC[C@@H](C)OCC[C@H](C)[N@@H+]1Cc2cncnc2C1 ZINC001172341742 974609234 /nfs/dbraw/zinc/60/92/34/974609234.db2.gz VATXHVJGZSJAID-NWDGAFQWSA-N 1 2 249.358 2.386 20 0 BEADLO CC[C@@H](C)OCC[C@H](C)[N@H+]1Cc2cncnc2C1 ZINC001172341742 974609237 /nfs/dbraw/zinc/60/92/37/974609237.db2.gz VATXHVJGZSJAID-NWDGAFQWSA-N 1 2 249.358 2.386 20 0 BEADLO COC(=O)C1([NH2+][C@@H]2CC[C@@H](C)[C@H](C)C2)CC1 ZINC001172361481 974632777 /nfs/dbraw/zinc/63/27/77/974632777.db2.gz XJZBPKHRPSJKST-GMTAPVOTSA-N 1 2 225.332 2.106 20 0 BEADLO COC(=O)C1([NH2+][C@@H]2CC[C@@H](C)[C@@H](C)C2)CC1 ZINC001172361483 974632918 /nfs/dbraw/zinc/63/29/18/974632918.db2.gz XJZBPKHRPSJKST-OUAUKWLOSA-N 1 2 225.332 2.106 20 0 BEADLO OCc1cc[nH+]c(N[C@H]2C[C@@H]3[C@H](C2)C3(F)F)c1 ZINC001331258862 974664566 /nfs/dbraw/zinc/66/45/66/974664566.db2.gz VPDREWVVPALGKZ-ILWJIGKKSA-N 1 2 240.253 2.030 20 0 BEADLO CC(C)OCC[C@@H](C)[NH2+][C@@H]1CC1(F)F ZINC001172431892 974716352 /nfs/dbraw/zinc/71/63/52/974716352.db2.gz SBXHCLCGKMLZKT-RKDXNWHRSA-N 1 2 207.264 2.187 20 0 BEADLO CC[C@H](CC(C)C)[NH2+]C1(C(=O)OC)CC1 ZINC001172384302 974727620 /nfs/dbraw/zinc/72/76/20/974727620.db2.gz GTCVZOGPUCJVIU-SNVBAGLBSA-N 1 2 213.321 2.106 20 0 BEADLO CC(C)COCC[C@@H](C)[N@@H+]1Cc2cncnc2C1 ZINC001172470225 974766820 /nfs/dbraw/zinc/76/68/20/974766820.db2.gz XUXPHSBVWVDGKU-GFCCVEGCSA-N 1 2 249.358 2.243 20 0 BEADLO CC(C)COCC[C@@H](C)[N@H+]1Cc2cncnc2C1 ZINC001172470225 974766822 /nfs/dbraw/zinc/76/68/22/974766822.db2.gz XUXPHSBVWVDGKU-GFCCVEGCSA-N 1 2 249.358 2.243 20 0 BEADLO CC(C)COCC[C@@H](C)[N@@H+]1CCCC(=O)C1 ZINC001172476443 974772976 /nfs/dbraw/zinc/77/29/76/974772976.db2.gz QBADBJHXZYLGBL-GFCCVEGCSA-N 1 2 227.348 2.103 20 0 BEADLO CC(C)COCC[C@@H](C)[N@H+]1CCCC(=O)C1 ZINC001172476443 974772979 /nfs/dbraw/zinc/77/29/79/974772979.db2.gz QBADBJHXZYLGBL-GFCCVEGCSA-N 1 2 227.348 2.103 20 0 BEADLO CC(C)(C)[NH+]1CC(Oc2cc(O)ccc2F)C1 ZINC001226121900 974799515 /nfs/dbraw/zinc/79/95/15/974799515.db2.gz COWYDRBYSHENHD-UHFFFAOYSA-N 1 2 239.290 2.393 20 0 BEADLO C[NH+]1CC(Oc2ccccc2-n2cccc2)C1 ZINC001226246259 974836842 /nfs/dbraw/zinc/83/68/42/974836842.db2.gz OFWXNMIBTBNJHG-UHFFFAOYSA-N 1 2 228.295 2.170 20 0 BEADLO COC(=O)C[NH2+][C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172537267 974876145 /nfs/dbraw/zinc/87/61/45/974876145.db2.gz JTVMJZNXRXUXFZ-ZIAGYGMSSA-N 1 2 247.338 2.475 20 0 BEADLO CO[C@H]1CCC[C@H]([N@H+](C)CC(F)F)C1 ZINC001172947787 975003823 /nfs/dbraw/zinc/00/38/23/975003823.db2.gz AUMIBKWEKRPGTF-IUCAKERBSA-N 1 2 207.264 2.141 20 0 BEADLO CO[C@H]1CCC[C@H]([N@@H+](C)CC(F)F)C1 ZINC001172947787 975003829 /nfs/dbraw/zinc/00/38/29/975003829.db2.gz AUMIBKWEKRPGTF-IUCAKERBSA-N 1 2 207.264 2.141 20 0 BEADLO Nc1cccn1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001212695231 975006567 /nfs/dbraw/zinc/00/65/67/975006567.db2.gz UUSOCBJRFNFYCP-UHFFFAOYSA-N 1 2 238.294 2.304 20 0 BEADLO C[C@H](C(=O)NCC1(CC2CC2)CC1)n1cc[nH+]c1 ZINC001332291238 975046042 /nfs/dbraw/zinc/04/60/42/975046042.db2.gz PEPNTGPMDXIDNT-LLVKDONJSA-N 1 2 247.342 2.141 20 0 BEADLO Cn1cccc1C[N@@H+]1CC[C@@](C)(F)[C@@H](F)C1 ZINC001203254257 975057705 /nfs/dbraw/zinc/05/77/05/975057705.db2.gz OKNSRZWYZIYXFQ-NWDGAFQWSA-N 1 2 228.286 2.297 20 0 BEADLO Cn1cccc1C[N@H+]1CC[C@@](C)(F)[C@@H](F)C1 ZINC001203254257 975057711 /nfs/dbraw/zinc/05/77/11/975057711.db2.gz OKNSRZWYZIYXFQ-NWDGAFQWSA-N 1 2 228.286 2.297 20 0 BEADLO CCSC[C@H](C)[NH2+]C1(c2nc(C)no2)CC1 ZINC001173296627 975181253 /nfs/dbraw/zinc/18/12/53/975181253.db2.gz VHMCBUKMFZJKST-QMMMGPOBSA-N 1 2 241.360 2.098 20 0 BEADLO Cc1ncc(C[N@H+](C)CCC(F)(F)F)o1 ZINC001332569173 975218180 /nfs/dbraw/zinc/21/81/80/975218180.db2.gz RDUMUUMMVNUKJK-UHFFFAOYSA-N 1 2 222.210 2.367 20 0 BEADLO CCOC(=O)C(C)(C)[NH2+][C@H](C)CSCC ZINC001173287626 975250795 /nfs/dbraw/zinc/25/07/95/975250795.db2.gz JEPJBSMGOJCTFJ-SECBINFHSA-N 1 2 233.377 2.059 20 0 BEADLO CCSC[C@H](C)[NH2+]C1(C(=O)OC)CCCC1 ZINC001173289357 975255897 /nfs/dbraw/zinc/25/58/97/975255897.db2.gz UTWBVWDTIVOIHW-JTQLQIEISA-N 1 2 245.388 2.203 20 0 BEADLO C[C@@H](c1ncccn1)[N@@H+]1CC[C@@H](C(F)(F)F)C1 ZINC001332697998 975258358 /nfs/dbraw/zinc/25/83/58/975258358.db2.gz HMZMCQKLEOTVQO-DTWKUNHWSA-N 1 2 245.248 2.422 20 0 BEADLO C[C@@H](c1ncccn1)[N@H+]1CC[C@@H](C(F)(F)F)C1 ZINC001332697998 975258363 /nfs/dbraw/zinc/25/83/63/975258363.db2.gz HMZMCQKLEOTVQO-DTWKUNHWSA-N 1 2 245.248 2.422 20 0 BEADLO C[C@@H](C(=O)N[C@@H]1C[C@H]1CC(C)(C)C)n1cc[nH+]c1 ZINC001332702261 975261062 /nfs/dbraw/zinc/26/10/62/975261062.db2.gz APFWJVKPMKKCSW-SDDRHHMPSA-N 1 2 249.358 2.385 20 0 BEADLO CCOC(=O)C1([NH2+][C@@H](C)CSCC)CCC1 ZINC001173292371 975266977 /nfs/dbraw/zinc/26/69/77/975266977.db2.gz WTPCGKJPGTUMFU-JTQLQIEISA-N 1 2 245.388 2.203 20 0 BEADLO Cc1cc[nH+]c(C)c1O[C@H]1C=C(C)OC(=O)C1 ZINC001227266256 975342104 /nfs/dbraw/zinc/34/21/04/975342104.db2.gz ZVGROKPEKBZVIA-NSHDSACASA-N 1 2 233.267 2.297 20 0 BEADLO CCC[C@@H](C[NH2+][C@](C)(CCC)C(=O)OC)OC ZINC001332975753 975350265 /nfs/dbraw/zinc/35/02/65/975350265.db2.gz KPIOKYWZLXBGDS-WCQYABFASA-N 1 2 245.363 2.123 20 0 BEADLO CCc1ccc(OC2C[NH+](CC)C2)c(OC)c1 ZINC001227405329 975380116 /nfs/dbraw/zinc/38/01/16/975380116.db2.gz WRULCOUTOPVAQR-UHFFFAOYSA-N 1 2 235.327 2.341 20 0 BEADLO C[NH+](C)Cc1nnc([C@@H]2C[C@@H]3C=C[C@H]2CC3)o1 ZINC001333122787 975449460 /nfs/dbraw/zinc/44/94/60/975449460.db2.gz VUCPAGWAEFBCMQ-OUAUKWLOSA-N 1 2 233.315 2.201 20 0 BEADLO CC1(C)CCC[C@H]1[C@@H]1CC[N@H+](Cc2nnc[nH]2)C1 ZINC001333607412 975889520 /nfs/dbraw/zinc/88/95/20/975889520.db2.gz VJJVVEDEBMLCCP-NEPJUHHUSA-N 1 2 248.374 2.453 20 0 BEADLO CC1(C)CCC[C@H]1[C@@H]1CC[N@@H+](Cc2nnc[nH]2)C1 ZINC001333607412 975889524 /nfs/dbraw/zinc/88/95/24/975889524.db2.gz VJJVVEDEBMLCCP-NEPJUHHUSA-N 1 2 248.374 2.453 20 0 BEADLO CC[NH+]1CC(Oc2noc3cc(C)ccc32)C1 ZINC001228086367 975898706 /nfs/dbraw/zinc/89/87/06/975898706.db2.gz ZSADMMJUKCGKSW-UHFFFAOYSA-N 1 2 232.283 2.219 20 0 BEADLO Cc1cc(OC2C[NH+](C(C)C)C2)nc(C(C)C)n1 ZINC001228251750 976019351 /nfs/dbraw/zinc/01/93/51/976019351.db2.gz DTBFENPDRZEBID-UHFFFAOYSA-N 1 2 249.358 2.380 20 0 BEADLO CCc1nn(C[NH+]2C[C@@H](C)[C@H](C)C2)c(=S)o1 ZINC001333789758 976078830 /nfs/dbraw/zinc/07/88/30/976078830.db2.gz FZJYTZKSPYCPLV-RKDXNWHRSA-N 1 2 241.360 2.313 20 0 BEADLO CCc1nn(C[NH+]2C[C@H](C)[C@@H](C)C2)c(=S)o1 ZINC001333789757 976080534 /nfs/dbraw/zinc/08/05/34/976080534.db2.gz FZJYTZKSPYCPLV-IUCAKERBSA-N 1 2 241.360 2.313 20 0 BEADLO C[C@@H](C(=O)NCC1CCC=CCC1)n1cc[nH+]c1 ZINC001334009975 976218902 /nfs/dbraw/zinc/21/89/02/976218902.db2.gz VNSUHHMMGBYAMY-LBPRGKRZSA-N 1 2 247.342 2.307 20 0 BEADLO CSc1ccc(OC2C[NH+](C)C2)c(C)c1 ZINC001228469264 976234821 /nfs/dbraw/zinc/23/48/21/976234821.db2.gz ZHFHMQZIDTZKOX-UHFFFAOYSA-N 1 2 223.341 2.410 20 0 BEADLO COc1cncc(Nc2ccc(N(C)C)[nH+]c2)c1 ZINC001174086196 976349538 /nfs/dbraw/zinc/34/95/38/976349538.db2.gz JQQFWAPIZWGCBL-UHFFFAOYSA-N 1 2 244.298 2.295 20 0 BEADLO CNC(=O)c1cccc(Nc2ccc(C)c[nH+]2)c1 ZINC001174138431 976371796 /nfs/dbraw/zinc/37/17/96/976371796.db2.gz SANJDHKKJLKMMA-UHFFFAOYSA-N 1 2 241.294 2.493 20 0 BEADLO COc1cc(Nc2c(C)n[nH]c2C)cc(C)[nH+]1 ZINC001174214874 976400706 /nfs/dbraw/zinc/40/07/06/976400706.db2.gz BAYFYHLFFJJFHC-UHFFFAOYSA-N 1 2 232.287 2.482 20 0 BEADLO COc1cc[nH+]c(Nc2cncc(F)c2)c1 ZINC001174289600 976455011 /nfs/dbraw/zinc/45/50/11/976455011.db2.gz MGLPQHRZRWYBEB-UHFFFAOYSA-N 1 2 219.219 2.368 20 0 BEADLO COc1cc(N[C@@H](C)Cc2cc(C)no2)cc[nH+]1 ZINC001174306227 976516615 /nfs/dbraw/zinc/51/66/15/976516615.db2.gz XKCBWHUKQKFSJK-VIFPVBQESA-N 1 2 247.298 2.430 20 0 BEADLO Cn1cc(Nc2cccc(-n3cc[nH+]c3)c2)cn1 ZINC001174330041 976533763 /nfs/dbraw/zinc/53/37/63/976533763.db2.gz MGUYJOZQFTXJBP-UHFFFAOYSA-N 1 2 239.282 2.349 20 0 BEADLO CS[C@H]1CC[C@@H]([N@H+](C)Cc2nncs2)C1 ZINC001334602821 976564965 /nfs/dbraw/zinc/56/49/65/976564965.db2.gz JYNBQXOYEZXATO-BDAKNGLRSA-N 1 2 243.401 2.254 20 0 BEADLO CS[C@H]1CC[C@@H]([N@@H+](C)Cc2nncs2)C1 ZINC001334602821 976564976 /nfs/dbraw/zinc/56/49/76/976564976.db2.gz JYNBQXOYEZXATO-BDAKNGLRSA-N 1 2 243.401 2.254 20 0 BEADLO O=C(NCC=CC1CC1)c1cc2c[nH+]ccc2[nH]1 ZINC001334725722 976604995 /nfs/dbraw/zinc/60/49/95/976604995.db2.gz KTBMXOZHHXDVGS-UPHRSURJSA-N 1 2 241.294 2.259 20 0 BEADLO O=C(NCC=CC1CC1)c1cc2c[nH+]ccc2[nH]1 ZINC001334725720 976605397 /nfs/dbraw/zinc/60/53/97/976605397.db2.gz KTBMXOZHHXDVGS-OWOJBTEDSA-N 1 2 241.294 2.259 20 0 BEADLO Cc1cn2cccc(Nc3cncnc3)c2[nH+]1 ZINC001174384902 976626961 /nfs/dbraw/zinc/62/69/61/976626961.db2.gz KAEULWDFBRZACM-UHFFFAOYSA-N 1 2 225.255 2.176 20 0 BEADLO Cc1cn2c(cccc2Nc2cncnc2)[nH+]1 ZINC001174386046 976630117 /nfs/dbraw/zinc/63/01/17/976630117.db2.gz YJPFNENCRIXCMS-UHFFFAOYSA-N 1 2 225.255 2.176 20 0 BEADLO CCOc1cc[nH+]cc1Nc1c[nH]nc1C ZINC001174470816 976776814 /nfs/dbraw/zinc/77/68/14/976776814.db2.gz WGNXQWJOMOMIND-UHFFFAOYSA-N 1 2 218.260 2.255 20 0 BEADLO COc1cc(Nc2c[nH]nc2C)cc(C)[nH+]1 ZINC001174471907 976781150 /nfs/dbraw/zinc/78/11/50/976781150.db2.gz NPCDRXIWCZHHCH-UHFFFAOYSA-N 1 2 218.260 2.174 20 0 BEADLO Cc1c[nH+]ccc1NC(=S)c1cccc(N)c1 ZINC001174540250 976832257 /nfs/dbraw/zinc/83/22/57/976832257.db2.gz ZZEXETVWWLDNTG-UHFFFAOYSA-N 1 2 243.335 2.182 20 0 BEADLO CCn1cc(Nc2cc(C)[nH+]c(OC)c2)cn1 ZINC001174567716 976885327 /nfs/dbraw/zinc/88/53/27/976885327.db2.gz FZKXNNNZNXADKE-UHFFFAOYSA-N 1 2 232.287 2.359 20 0 BEADLO CC[NH+]1CC(Oc2cc(Cl)ccc2O)C1 ZINC001229544015 976894388 /nfs/dbraw/zinc/89/43/88/976894388.db2.gz IZOYDWMODFPFRO-UHFFFAOYSA-N 1 2 227.691 2.129 20 0 BEADLO Cc1cc(Nc2c(=O)cc[nH]c2Cl)cc[nH+]1 ZINC001174653168 976940636 /nfs/dbraw/zinc/94/06/36/976940636.db2.gz MTSZZJWDSBXWMR-UHFFFAOYSA-N 1 2 235.674 2.310 20 0 BEADLO c1cn(-c2ccc(O[C@H]3CCCOC3)cc2)c[nH+]1 ZINC001229949816 977031900 /nfs/dbraw/zinc/03/19/00/977031900.db2.gz GQWCRXBWVSOBHW-AWEZNQCLSA-N 1 2 244.294 2.430 20 0 BEADLO Cc1cc(Nc2c[nH+]c(C)cc2C)n(C)n1 ZINC001174820679 977073662 /nfs/dbraw/zinc/07/36/62/977073662.db2.gz MRLHFKZZYLZCLD-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO CCc1onc(C)c1CNc1cc[nH+]c(C)n1 ZINC001335561770 977146461 /nfs/dbraw/zinc/14/64/61/977146461.db2.gz WDNZMXOZCALJJX-UHFFFAOYSA-N 1 2 232.287 2.256 20 0 BEADLO Cc1ccc(N(C)c2[nH+]cccc2N)cc1N ZINC001174929000 977147254 /nfs/dbraw/zinc/14/72/54/977147254.db2.gz AVJBGRYLWGLVKZ-UHFFFAOYSA-N 1 2 228.299 2.322 20 0 BEADLO CC[NH+]1CC(Oc2cc(F)c(F)cc2C)C1 ZINC001230447300 977212530 /nfs/dbraw/zinc/21/25/30/977212530.db2.gz QRZILQXCCQWOJO-UHFFFAOYSA-N 1 2 227.254 2.356 20 0 BEADLO CC1CCC(C)(C(=O)NCCc2[nH]cc[nH+]2)CC1 ZINC001335773227 977274579 /nfs/dbraw/zinc/27/45/79/977274579.db2.gz MEEQEVDNIJYIAL-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO Fc1cnccc1Nc1cccn2cc[nH+]c12 ZINC001175197323 977291516 /nfs/dbraw/zinc/29/15/16/977291516.db2.gz OXPJQDVGHSATED-UHFFFAOYSA-N 1 2 228.230 2.034 20 0 BEADLO CCOc1cc(Nc2ccncc2F)cc(C)[nH+]1 ZINC001175199920 977305755 /nfs/dbraw/zinc/30/57/55/977305755.db2.gz XWEADFISQAKIMC-UHFFFAOYSA-N 1 2 247.273 2.488 20 0 BEADLO CCCCCC(=O)N(C)C[C@@H]1CC[N@@H+]1CCF ZINC001230775498 977330971 /nfs/dbraw/zinc/33/09/71/977330971.db2.gz IKVHNLORUZJNTN-LBPRGKRZSA-N 1 2 244.354 2.069 20 0 BEADLO CCCCCC(=O)N(C)C[C@@H]1CC[N@H+]1CCF ZINC001230775498 977330986 /nfs/dbraw/zinc/33/09/86/977330986.db2.gz IKVHNLORUZJNTN-LBPRGKRZSA-N 1 2 244.354 2.069 20 0 BEADLO CN(C)c1ccc(N(C)c2ccccc2N)c[nH+]1 ZINC001175343818 977365074 /nfs/dbraw/zinc/36/50/74/977365074.db2.gz PSVDTMRCAKYYMX-UHFFFAOYSA-N 1 2 242.326 2.498 20 0 BEADLO Cn1nccc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175346196 977365723 /nfs/dbraw/zinc/36/57/23/977365723.db2.gz NYFNNJZTNZBCEX-UHFFFAOYSA-N 1 2 243.314 2.159 20 0 BEADLO CN(C)c1ccc(Nc2ccc(CO)cc2)c[nH+]1 ZINC001175343043 977365869 /nfs/dbraw/zinc/36/58/69/977365869.db2.gz DQCNAUXDNAXOSS-UHFFFAOYSA-N 1 2 243.310 2.384 20 0 BEADLO CN(C)c1ccc(Nc2ccnn2CCF)c[nH+]1 ZINC001175341666 977366547 /nfs/dbraw/zinc/36/65/47/977366547.db2.gz MTBVCFPRHXNNRQ-UHFFFAOYSA-N 1 2 249.293 2.057 20 0 BEADLO CN(C)c1ccc(Nc2ccccn2)c[nH+]1 ZINC001175337704 977383568 /nfs/dbraw/zinc/38/35/68/977383568.db2.gz JJDLGPZIVWOBSJ-UHFFFAOYSA-N 1 2 214.272 2.286 20 0 BEADLO CC[C@@H](COc1cc2c(cc1O)C=[NH+]CC2)OC ZINC001230921812 977383670 /nfs/dbraw/zinc/38/36/70/977383670.db2.gz TZZRUJAZHXOGJW-LBPRGKRZSA-N 1 2 249.310 2.171 20 0 BEADLO CCO[C@H](C)COc1cc2c(cc1O)C=[NH+]CC2 ZINC001230921765 977385040 /nfs/dbraw/zinc/38/50/40/977385040.db2.gz RURBEWBLYLHNSW-SNVBAGLBSA-N 1 2 249.310 2.171 20 0 BEADLO C[S@@](=O)c1ccc(Nc2[nH+]cccc2N)cc1 ZINC001175471777 977436761 /nfs/dbraw/zinc/43/67/61/977436761.db2.gz VLTZHEJOEXBEBR-QGZVFWFLSA-N 1 2 247.323 2.145 20 0 BEADLO Cc1ccc(O)c(Nc2cccc(CO)c2)[nH+]1 ZINC001175510038 977482797 /nfs/dbraw/zinc/48/27/97/977482797.db2.gz UFKMDYJDHUZCHX-UHFFFAOYSA-N 1 2 230.267 2.332 20 0 BEADLO C[NH+]1CC(Oc2cnc3cccc(F)c3c2)C1 ZINC001231132397 977496920 /nfs/dbraw/zinc/49/69/20/977496920.db2.gz JEYXCGHHSHUWCB-UHFFFAOYSA-N 1 2 232.258 2.067 20 0 BEADLO COC(=O)C[C@H](C)Nc1cccc(C2CC2)[nH+]1 ZINC000260406266 977500486 /nfs/dbraw/zinc/50/04/86/977500486.db2.gz OXAXOAHMRIQOBK-VIFPVBQESA-N 1 2 234.299 2.323 20 0 BEADLO C[NH+]1CC(Oc2ccc3ncc(F)cc3c2)C1 ZINC001231172390 977523609 /nfs/dbraw/zinc/52/36/09/977523609.db2.gz VSQPSGPAMSBQQC-UHFFFAOYSA-N 1 2 232.258 2.067 20 0 BEADLO COc1cc[nH+]cc1Nc1cnc(SC)nc1 ZINC001175645121 977616186 /nfs/dbraw/zinc/61/61/86/977616186.db2.gz NCOSXSOUQHIBSA-UHFFFAOYSA-N 1 2 248.311 2.346 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCC[C@@H](F)C2)cn1 ZINC001231652735 977667330 /nfs/dbraw/zinc/66/73/30/977667330.db2.gz IUCUJZGSGIOJDK-GFCCVEGCSA-N 1 2 238.306 2.414 20 0 BEADLO CCOc1ccc(C[N@H+]2CCC[C@@H](F)C2)cn1 ZINC001231652735 977667341 /nfs/dbraw/zinc/66/73/41/977667341.db2.gz IUCUJZGSGIOJDK-GFCCVEGCSA-N 1 2 238.306 2.414 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1ccc(Cl)c(O)c1 ZINC001231735453 977717893 /nfs/dbraw/zinc/71/78/93/977717893.db2.gz QWCCEIPSCHDFBY-JTQLQIEISA-N 1 2 241.718 2.266 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1ccc(Cl)c(O)c1 ZINC001231735453 977717911 /nfs/dbraw/zinc/71/79/11/977717911.db2.gz QWCCEIPSCHDFBY-JTQLQIEISA-N 1 2 241.718 2.266 20 0 BEADLO CCOc1ncccc1C[N@@H+]1C[C@@H](F)C[C@H]1C ZINC001231762456 977735670 /nfs/dbraw/zinc/73/56/70/977735670.db2.gz IGDPEIJROOOUJJ-PWSUYJOCSA-N 1 2 238.306 2.413 20 0 BEADLO CCOc1ncccc1C[N@H+]1C[C@@H](F)C[C@H]1C ZINC001231762456 977735679 /nfs/dbraw/zinc/73/56/79/977735679.db2.gz IGDPEIJROOOUJJ-PWSUYJOCSA-N 1 2 238.306 2.413 20 0 BEADLO CSc1ccccc1C[N@@H+]1CCO[C@@H]2C[C@@H]21 ZINC001231786645 977749288 /nfs/dbraw/zinc/74/92/88/977749288.db2.gz IBFADHPHMUOGHO-NWDGAFQWSA-N 1 2 235.352 2.382 20 0 BEADLO CSc1ccccc1C[N@H+]1CCO[C@@H]2C[C@@H]21 ZINC001231786645 977749294 /nfs/dbraw/zinc/74/92/94/977749294.db2.gz IBFADHPHMUOGHO-NWDGAFQWSA-N 1 2 235.352 2.382 20 0 BEADLO COc1cc[nH+]cc1Nc1ccc(F)cn1 ZINC001175847371 977766303 /nfs/dbraw/zinc/76/63/03/977766303.db2.gz LBTGCXJNOZKPPT-UHFFFAOYSA-N 1 2 219.219 2.368 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)C12CCC(CC1)CC2 ZINC001336584228 977795220 /nfs/dbraw/zinc/79/52/20/977795220.db2.gz DAUPIPGNQCKOMP-UHFFFAOYSA-N 1 2 247.342 2.007 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H](F)C[C@H]2C)cnc1F ZINC001231923939 977796116 /nfs/dbraw/zinc/79/61/16/977796116.db2.gz YPANHGQFWDLDPM-MWLCHTKSSA-N 1 2 226.270 2.461 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H](F)C[C@H]2C)cnc1F ZINC001231923939 977796123 /nfs/dbraw/zinc/79/61/23/977796123.db2.gz YPANHGQFWDLDPM-MWLCHTKSSA-N 1 2 226.270 2.461 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H](F)C[C@H]2C)cnc1F ZINC001231925777 977796953 /nfs/dbraw/zinc/79/69/53/977796953.db2.gz YPANHGQFWDLDPM-KOLCDFICSA-N 1 2 226.270 2.461 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H](F)C[C@H]2C)cnc1F ZINC001231925777 977796964 /nfs/dbraw/zinc/79/69/64/977796964.db2.gz YPANHGQFWDLDPM-KOLCDFICSA-N 1 2 226.270 2.461 20 0 BEADLO CCCCC1(NC(=O)[C@H](C)n2cc[nH+]c2)CC1 ZINC001336604509 977807235 /nfs/dbraw/zinc/80/72/35/977807235.db2.gz DLEFRBXVWHMWTM-NSHDSACASA-N 1 2 235.331 2.283 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(=O)[C@H](C)C2)cc(C)n1 ZINC001231994395 977827437 /nfs/dbraw/zinc/82/74/37/977827437.db2.gz AHDUMEPNGFODTE-SNVBAGLBSA-N 1 2 232.327 2.109 20 0 BEADLO Cc1cc(C[N@H+]2CCC(=O)[C@H](C)C2)cc(C)n1 ZINC001231994395 977827440 /nfs/dbraw/zinc/82/74/40/977827440.db2.gz AHDUMEPNGFODTE-SNVBAGLBSA-N 1 2 232.327 2.109 20 0 BEADLO CCc1ccc(N2CCC(C3(O)CC3)CC2)[nH+]c1 ZINC001336678754 977850822 /nfs/dbraw/zinc/85/08/22/977850822.db2.gz JCVCBVFPQXAYJS-UHFFFAOYSA-N 1 2 246.354 2.385 20 0 BEADLO CCC[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC001336703315 977870125 /nfs/dbraw/zinc/87/01/25/977870125.db2.gz JPNCHVSOUWMXNB-QJPTWQEYSA-N 1 2 247.342 2.304 20 0 BEADLO CCC[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC001336703315 977870126 /nfs/dbraw/zinc/87/01/26/977870126.db2.gz JPNCHVSOUWMXNB-QJPTWQEYSA-N 1 2 247.342 2.304 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2cc3ncccc3[nH]2)C1 ZINC001232062222 977875242 /nfs/dbraw/zinc/87/52/42/977875242.db2.gz YFBXLBZTRGTPKJ-SECBINFHSA-N 1 2 219.263 2.107 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2cc3ncccc3[nH]2)C1 ZINC001232062222 977875247 /nfs/dbraw/zinc/87/52/47/977875247.db2.gz YFBXLBZTRGTPKJ-SECBINFHSA-N 1 2 219.263 2.107 20 0 BEADLO CN(C)c1cc(N2CC(C)(C)C2(C)C)nc[nH+]1 ZINC001336708648 977875898 /nfs/dbraw/zinc/87/58/98/977875898.db2.gz AYELRZBBRLDMPQ-UHFFFAOYSA-N 1 2 234.347 2.167 20 0 BEADLO CN(C)c1cc(N2CC(C)(C)C2(C)C)[nH+]cn1 ZINC001336708648 977875902 /nfs/dbraw/zinc/87/59/02/977875902.db2.gz AYELRZBBRLDMPQ-UHFFFAOYSA-N 1 2 234.347 2.167 20 0 BEADLO Cc1cc(F)cc(N2C[C@@H]3CSC[C@@H]3C2)[nH+]1 ZINC001336725996 977886890 /nfs/dbraw/zinc/88/68/90/977886890.db2.gz LSSYKDSICUKHAY-AOOOYVTPSA-N 1 2 238.331 2.328 20 0 BEADLO Cc1scnc1C[N@H+]1[C@@H]2CC[C@H]1CC(=O)C2 ZINC001232211116 977936703 /nfs/dbraw/zinc/93/67/03/977936703.db2.gz WICXGWSWOGMCAO-AOOOYVTPSA-N 1 2 236.340 2.147 20 0 BEADLO Cc1scnc1C[N@@H+]1[C@@H]2CC[C@H]1CC(=O)C2 ZINC001232211116 977936720 /nfs/dbraw/zinc/93/67/20/977936720.db2.gz WICXGWSWOGMCAO-AOOOYVTPSA-N 1 2 236.340 2.147 20 0 BEADLO COc1cc[nH+]cc1Nc1c(Cl)cnn1C ZINC001176117864 977943937 /nfs/dbraw/zinc/94/39/37/977943937.db2.gz ASXXWHFCBFJUAD-UHFFFAOYSA-N 1 2 238.678 2.221 20 0 BEADLO COc1ccnc(Nc2c[nH+]ccc2OC)c1 ZINC001176116852 977944719 /nfs/dbraw/zinc/94/47/19/977944719.db2.gz NEBKMPSNTJQUEN-UHFFFAOYSA-N 1 2 231.255 2.237 20 0 BEADLO COc1cc[nH+]cc1Nc1ccnc(SC)n1 ZINC001176118104 977946585 /nfs/dbraw/zinc/94/65/85/977946585.db2.gz ASKZBOCVOXAGNX-UHFFFAOYSA-N 1 2 248.311 2.346 20 0 BEADLO COc1ccc(N)c(Nc2c[nH+]ccc2OC)c1 ZINC001176120769 977948927 /nfs/dbraw/zinc/94/89/27/977948927.db2.gz KOSJJPKBLNAEMS-UHFFFAOYSA-N 1 2 245.282 2.425 20 0 BEADLO COc1cc[nH+]cc1Nc1cnc(OC)c(F)c1 ZINC001176118930 977949246 /nfs/dbraw/zinc/94/92/46/977949246.db2.gz QWMGSMYQWGVEJS-UHFFFAOYSA-N 1 2 249.245 2.377 20 0 BEADLO COC(=O)c1ccc(Nc2c[nH+]ccc2OC)o1 ZINC001176118962 977950159 /nfs/dbraw/zinc/95/01/59/977950159.db2.gz REOHBALYHKBFSN-UHFFFAOYSA-N 1 2 248.238 2.213 20 0 BEADLO COc1cc[nH+]cc1Nc1ccccn1 ZINC001176119701 977951719 /nfs/dbraw/zinc/95/17/19/977951719.db2.gz VYFYDZOURVJBQE-UHFFFAOYSA-N 1 2 201.229 2.229 20 0 BEADLO CCc1nccnc1Nc1c[nH+]ccc1OC ZINC001176118935 977953642 /nfs/dbraw/zinc/95/36/42/977953642.db2.gz QXOPXGUCKHTRNK-UHFFFAOYSA-N 1 2 230.271 2.186 20 0 BEADLO c1nscc1C[N@@H+]1CCC[C@H]1c1cnccn1 ZINC001232226283 977954592 /nfs/dbraw/zinc/95/45/92/977954592.db2.gz DBSCAVDYMLSGAQ-LBPRGKRZSA-N 1 2 246.339 2.270 20 0 BEADLO c1nscc1C[N@H+]1CCC[C@H]1c1cnccn1 ZINC001232226283 977954600 /nfs/dbraw/zinc/95/46/00/977954600.db2.gz DBSCAVDYMLSGAQ-LBPRGKRZSA-N 1 2 246.339 2.270 20 0 BEADLO CCOc1cc[nH+]cc1Nc1ccc(=O)[nH]c1 ZINC001176126561 977962475 /nfs/dbraw/zinc/96/24/75/977962475.db2.gz OFPIZLJKIMPZCK-UHFFFAOYSA-N 1 2 231.255 2.325 20 0 BEADLO COc1cc[nH+]cc1Nc1c(N)cccc1O ZINC001176125059 977962694 /nfs/dbraw/zinc/96/26/94/977962694.db2.gz YHFPSKHSJSDAEV-UHFFFAOYSA-N 1 2 231.255 2.122 20 0 BEADLO O=c1ccc(Nc2ccn3cc[nH+]c3c2)c[nH]1 ZINC001176128725 977969740 /nfs/dbraw/zinc/96/97/40/977969740.db2.gz HCMFXJDVSFDKLK-UHFFFAOYSA-N 1 2 226.239 2.179 20 0 BEADLO c1nnc(C[N@@H+]2CCC[C@H](C3CCC3)CC2)[nH]1 ZINC001336808121 977973329 /nfs/dbraw/zinc/97/33/29/977973329.db2.gz NUWWAXLICGRTJX-LBPRGKRZSA-N 1 2 234.347 2.207 20 0 BEADLO c1nnc(C[N@H+]2CCC[C@H](C3CCC3)CC2)[nH]1 ZINC001336808121 977973338 /nfs/dbraw/zinc/97/33/38/977973338.db2.gz NUWWAXLICGRTJX-LBPRGKRZSA-N 1 2 234.347 2.207 20 0 BEADLO COCc1ccc(C[N@@H+]2CCC(=O)C[C@@H]2C)cc1 ZINC001232298292 977991269 /nfs/dbraw/zinc/99/12/69/977991269.db2.gz HBMXHIIIIHRTMK-LBPRGKRZSA-N 1 2 247.338 2.386 20 0 BEADLO COCc1ccc(C[N@H+]2CCC(=O)C[C@@H]2C)cc1 ZINC001232298292 977991283 /nfs/dbraw/zinc/99/12/83/977991283.db2.gz HBMXHIIIIHRTMK-LBPRGKRZSA-N 1 2 247.338 2.386 20 0 BEADLO Cc1cc(NCC[C@H](O)C2CC2)nc(C2CC2)[nH+]1 ZINC001336871588 978014535 /nfs/dbraw/zinc/01/45/35/978014535.db2.gz DQGRBUYVJOTUQQ-LBPRGKRZSA-N 1 2 247.342 2.235 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@@H]2CCCOC2)ns1 ZINC001249589985 978048150 /nfs/dbraw/zinc/04/81/50/978048150.db2.gz GJFZGGVIDQCSHK-LLVKDONJSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1cc(C[N@H+](C)[C@@H]2CCCOC2)ns1 ZINC001249589985 978048154 /nfs/dbraw/zinc/04/81/54/978048154.db2.gz GJFZGGVIDQCSHK-LLVKDONJSA-N 1 2 226.345 2.062 20 0 BEADLO CC1(C)C[NH+](Cc2cn3cc(F)ccc3n2)C1 ZINC001232409952 978049332 /nfs/dbraw/zinc/04/93/32/978049332.db2.gz YLEZLGDRVWYZDS-UHFFFAOYSA-N 1 2 233.290 2.315 20 0 BEADLO C[C@]1(F)CCC[N@H+](Cc2[nH]nc3c2CCC3)C1 ZINC001232424660 978057528 /nfs/dbraw/zinc/05/75/28/978057528.db2.gz KPPMSAAESVRYAS-ZDUSSCGKSA-N 1 2 237.322 2.222 20 0 BEADLO C[C@]1(F)CCC[N@@H+](Cc2[nH]nc3c2CCC3)C1 ZINC001232424660 978057539 /nfs/dbraw/zinc/05/75/39/978057539.db2.gz KPPMSAAESVRYAS-ZDUSSCGKSA-N 1 2 237.322 2.222 20 0 BEADLO Cc1[nH]c(CN2CCC[C@H](F)C(F)(F)C2)c[nH+]1 ZINC001232460467 978092608 /nfs/dbraw/zinc/09/26/08/978092608.db2.gz RMBGJWJLBOBHLU-JTQLQIEISA-N 1 2 247.264 2.287 20 0 BEADLO Cc1[nH]cc(CN2CCC[C@H](F)C(F)(F)C2)[nH+]1 ZINC001232460467 978092617 /nfs/dbraw/zinc/09/26/17/978092617.db2.gz RMBGJWJLBOBHLU-JTQLQIEISA-N 1 2 247.264 2.287 20 0 BEADLO Cc1cccc(F)c1C[N@H+]1CCOC[C@H]1C ZINC001232482633 978134863 /nfs/dbraw/zinc/13/48/63/978134863.db2.gz SPLONCJILDHDGR-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cccc(F)c1C[N@@H+]1CCOC[C@H]1C ZINC001232482633 978134878 /nfs/dbraw/zinc/13/48/78/978134878.db2.gz SPLONCJILDHDGR-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cccc(F)c1C[N@@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001232487843 978138702 /nfs/dbraw/zinc/13/87/02/978138702.db2.gz VYKDNDFRZSFAGR-VXGBXAGGSA-N 1 2 235.302 2.497 20 0 BEADLO Cc1cccc(F)c1C[N@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001232487843 978138709 /nfs/dbraw/zinc/13/87/09/978138709.db2.gz VYKDNDFRZSFAGR-VXGBXAGGSA-N 1 2 235.302 2.497 20 0 BEADLO Cc1cccc(F)c1C[N@@H+]1CCO[C@@H](C)C1 ZINC001232491201 978142316 /nfs/dbraw/zinc/14/23/16/978142316.db2.gz VUYUEISTMUZGMZ-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cccc(F)c1C[N@H+]1CCO[C@@H](C)C1 ZINC001232491201 978142317 /nfs/dbraw/zinc/14/23/17/978142317.db2.gz VUYUEISTMUZGMZ-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cn1cc[nH+]c1Nc1c(F)cc(F)c(O)c1F ZINC001176662723 978154954 /nfs/dbraw/zinc/15/49/54/978154954.db2.gz VAPSHZCHLRZMQB-UHFFFAOYSA-N 1 2 243.188 2.287 20 0 BEADLO Cc1nonc1Nc1ccc[nH+]c1N1CCCC1 ZINC001176743427 978170761 /nfs/dbraw/zinc/17/07/61/978170761.db2.gz KGDHRBBLFKTCBX-UHFFFAOYSA-N 1 2 245.286 2.117 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)Nc1ccc2c(c1)N=NC2 ZINC001176833521 978198946 /nfs/dbraw/zinc/19/89/46/978198946.db2.gz OAXCHEFRCALDMO-UHFFFAOYSA-N 1 2 241.254 2.188 20 0 BEADLO CCCC1CCN(C(=O)CCn2cc[nH+]c2)CC1 ZINC001176877999 978227546 /nfs/dbraw/zinc/22/75/46/978227546.db2.gz SQQYKZZBAQVMPI-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO CCc1ccc(N2CC[C@@H](CF)C2)[nH+]c1 ZINC001337254707 978248901 /nfs/dbraw/zinc/24/89/01/978248901.db2.gz ZBJOHEHGGVKNBW-NSHDSACASA-N 1 2 208.280 2.440 20 0 BEADLO Cc1cccnc1[C@H](C)[NH2+]Cc1cnns1 ZINC001176896536 978252029 /nfs/dbraw/zinc/25/20/29/978252029.db2.gz HUKTWWZBBOBUMZ-VIFPVBQESA-N 1 2 234.328 2.092 20 0 BEADLO CCc1[nH]c(CNC(=O)/C=C/C2CCCC2)c[nH+]1 ZINC001597256997 978306780 /nfs/dbraw/zinc/30/67/80/978306780.db2.gz FCWWXJZUHJDFML-BQYQJAHWSA-N 1 2 247.342 2.335 20 0 BEADLO CCc1[nH]cc(CNC(=O)C=CC2CCCC2)[nH+]1 ZINC001597256997 978306787 /nfs/dbraw/zinc/30/67/87/978306787.db2.gz FCWWXJZUHJDFML-BQYQJAHWSA-N 1 2 247.342 2.335 20 0 BEADLO CC[N@H+](C)Cc1ccc(F)c(O)c1F ZINC001232933996 978340023 /nfs/dbraw/zinc/34/00/23/978340023.db2.gz UOGXUNYTARSPIN-UHFFFAOYSA-N 1 2 201.216 2.122 20 0 BEADLO CC[N@@H+](C)Cc1ccc(F)c(O)c1F ZINC001232933996 978340040 /nfs/dbraw/zinc/34/00/40/978340040.db2.gz UOGXUNYTARSPIN-UHFFFAOYSA-N 1 2 201.216 2.122 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)C=Cc1ccco1 ZINC001597676470 978353649 /nfs/dbraw/zinc/35/36/49/978353649.db2.gz GHDKYICVXTVACT-AATRIKPKSA-N 1 2 242.278 2.365 20 0 BEADLO Cc1cc(C)c(C[N@@H+]2CCC(=O)C(C)(C)C2)cn1 ZINC001233009569 978404579 /nfs/dbraw/zinc/40/45/79/978404579.db2.gz DOBUFJHBRFRUEG-UHFFFAOYSA-N 1 2 246.354 2.499 20 0 BEADLO Cc1cc(C)c(C[N@H+]2CCC(=O)C(C)(C)C2)cn1 ZINC001233009569 978404583 /nfs/dbraw/zinc/40/45/83/978404583.db2.gz DOBUFJHBRFRUEG-UHFFFAOYSA-N 1 2 246.354 2.499 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nc3ccccn3n2)C2(CC2)C1 ZINC001233075152 978457075 /nfs/dbraw/zinc/45/70/75/978457075.db2.gz WKZNPFATPTZNFB-NSHDSACASA-N 1 2 242.326 2.104 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nc3ccccn3n2)C2(CC2)C1 ZINC001233075152 978457086 /nfs/dbraw/zinc/45/70/86/978457086.db2.gz WKZNPFATPTZNFB-NSHDSACASA-N 1 2 242.326 2.104 20 0 BEADLO CC[C@@H]1CCC[N@H+](Cc2nc3ccccn3n2)C1 ZINC001233073324 978459514 /nfs/dbraw/zinc/45/95/14/978459514.db2.gz SAXFRQRPEMDXEO-GFCCVEGCSA-N 1 2 244.342 2.351 20 0 BEADLO CC[C@@H]1CCC[N@@H+](Cc2nc3ccccn3n2)C1 ZINC001233073324 978459523 /nfs/dbraw/zinc/45/95/23/978459523.db2.gz SAXFRQRPEMDXEO-GFCCVEGCSA-N 1 2 244.342 2.351 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nc3ccccn3n2)[C@H](C)C1 ZINC001233069788 978460656 /nfs/dbraw/zinc/46/06/56/978460656.db2.gz GCPPWGFQUUMFBA-VXGBXAGGSA-N 1 2 244.342 2.350 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nc3ccccn3n2)[C@H](C)C1 ZINC001233069788 978460662 /nfs/dbraw/zinc/46/06/62/978460662.db2.gz GCPPWGFQUUMFBA-VXGBXAGGSA-N 1 2 244.342 2.350 20 0 BEADLO Fc1ccc2c(c1)n[nH]c2C[N@H+]1CC[C@H](F)C1 ZINC001233120061 978467923 /nfs/dbraw/zinc/46/79/23/978467923.db2.gz UJMXMNOIUVRCNW-VIFPVBQESA-N 1 2 237.253 2.246 20 0 BEADLO Fc1ccc2c(c1)n[nH]c2C[N@@H+]1CC[C@H](F)C1 ZINC001233120061 978467928 /nfs/dbraw/zinc/46/79/28/978467928.db2.gz UJMXMNOIUVRCNW-VIFPVBQESA-N 1 2 237.253 2.246 20 0 BEADLO C[C@H](C(=O)N1[C@H](C)CCC[C@H]1C)n1cc[nH+]c1 ZINC001177922399 978474258 /nfs/dbraw/zinc/47/42/58/978474258.db2.gz ULAXRTAKVIFVGI-IJLUTSLNSA-N 1 2 235.331 2.234 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H](C)OC[C@H]2C)cnc1C ZINC001233161224 978482113 /nfs/dbraw/zinc/48/21/13/978482113.db2.gz XOMUFFCLKWKDNY-VXGBXAGGSA-N 1 2 234.343 2.308 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H](C)OC[C@H]2C)cnc1C ZINC001233161224 978482117 /nfs/dbraw/zinc/48/21/17/978482117.db2.gz XOMUFFCLKWKDNY-VXGBXAGGSA-N 1 2 234.343 2.308 20 0 BEADLO Cc1cc(C[N@@H+]2CCOCC23CCC3)cnc1C ZINC001233161902 978482181 /nfs/dbraw/zinc/48/21/81/978482181.db2.gz LPZWOJJVUZXNPM-UHFFFAOYSA-N 1 2 246.354 2.453 20 0 BEADLO Cc1cc(C[N@H+]2CCOCC23CCC3)cnc1C ZINC001233161902 978482182 /nfs/dbraw/zinc/48/21/82/978482182.db2.gz LPZWOJJVUZXNPM-UHFFFAOYSA-N 1 2 246.354 2.453 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H]3CC[C@@H]2CO3)cnc1C ZINC001233165133 978485011 /nfs/dbraw/zinc/48/50/11/978485011.db2.gz TWWHWWRFMMWWHN-ZIAGYGMSSA-N 1 2 232.327 2.062 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H]3CC[C@@H]2CO3)cnc1C ZINC001233165133 978485016 /nfs/dbraw/zinc/48/50/16/978485016.db2.gz TWWHWWRFMMWWHN-ZIAGYGMSSA-N 1 2 232.327 2.062 20 0 BEADLO Cc1c[nH]c(=O)c(C[N@H+](C)Cc2nccs2)c1 ZINC001233196300 978494368 /nfs/dbraw/zinc/49/43/68/978494368.db2.gz UTQDAQWBEOTWGX-UHFFFAOYSA-N 1 2 249.339 2.184 20 0 BEADLO Cc1c[nH]c(=O)c(C[N@@H+](C)Cc2nccs2)c1 ZINC001233196300 978494375 /nfs/dbraw/zinc/49/43/75/978494375.db2.gz UTQDAQWBEOTWGX-UHFFFAOYSA-N 1 2 249.339 2.184 20 0 BEADLO Cc1ccc(C[N@@H+]2CCOCC23CC3)cc1O ZINC001233235591 978508510 /nfs/dbraw/zinc/50/85/10/978508510.db2.gz ZGYOQZALCFCUFY-UHFFFAOYSA-N 1 2 233.311 2.065 20 0 BEADLO Cc1ccc(C[N@H+]2CCOCC23CC3)cc1O ZINC001233235591 978508514 /nfs/dbraw/zinc/50/85/14/978508514.db2.gz ZGYOQZALCFCUFY-UHFFFAOYSA-N 1 2 233.311 2.065 20 0 BEADLO C[C@H](C(=O)N1CC[C@@H](C)C[C@@H](C)C1)n1cc[nH+]c1 ZINC001178127882 978516372 /nfs/dbraw/zinc/51/63/72/978516372.db2.gz ZDQISWRLDFUHLU-JHJVBQTASA-N 1 2 249.358 2.339 20 0 BEADLO C[C@H]1C[N@H+](Cc2cccc3c2CCO3)CCC1=O ZINC001233274264 978527046 /nfs/dbraw/zinc/52/70/46/978527046.db2.gz JZPBGOSVXHWWLZ-NSHDSACASA-N 1 2 245.322 2.032 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cccc3c2CCO3)CCC1=O ZINC001233274264 978527050 /nfs/dbraw/zinc/52/70/50/978527050.db2.gz JZPBGOSVXHWWLZ-NSHDSACASA-N 1 2 245.322 2.032 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@](C)(O)CC2)[nH+]1 ZINC001337858974 978528511 /nfs/dbraw/zinc/52/85/11/978528511.db2.gz LQWVIPNSFROJJA-ZDUSSCGKSA-N 1 2 238.306 2.270 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@@](C)(O)CC2)[nH+]1 ZINC001337858972 978529986 /nfs/dbraw/zinc/52/99/86/978529986.db2.gz LQWVIPNSFROJJA-CYBMUJFWSA-N 1 2 238.306 2.270 20 0 BEADLO Cc1cc(C[N@@H+]2CCCC(=O)[C@H](C)C2)sn1 ZINC001233309925 978532417 /nfs/dbraw/zinc/53/24/17/978532417.db2.gz IRDNHVRMEYWOOV-SECBINFHSA-N 1 2 238.356 2.253 20 0 BEADLO Cc1cc(C[N@H+]2CCCC(=O)[C@H](C)C2)sn1 ZINC001233309925 978532422 /nfs/dbraw/zinc/53/24/22/978532422.db2.gz IRDNHVRMEYWOOV-SECBINFHSA-N 1 2 238.356 2.253 20 0 BEADLO CC[C@]1(C)CCCN(c2cc(N)nc[nH+]2)C1 ZINC001337874897 978545496 /nfs/dbraw/zinc/54/54/96/978545496.db2.gz CRKMOOLWATWJGO-GFCCVEGCSA-N 1 2 220.320 2.075 20 0 BEADLO CC[C@@H](C)c1ccc[nH+]c1N1CCOCC1 ZINC001249864308 978546192 /nfs/dbraw/zinc/54/61/92/978546192.db2.gz ANWSOKBORCGQDQ-LLVKDONJSA-N 1 2 220.316 2.432 20 0 BEADLO CCOC(=O)[C@@H](C)CNc1cc(F)cc(C)[nH+]1 ZINC001337882750 978546894 /nfs/dbraw/zinc/54/68/94/978546894.db2.gz DCUQXQIOVDKCDP-QMMMGPOBSA-N 1 2 240.278 2.140 20 0 BEADLO Cc1cnsc1C[N@@H+]1CCc2ccncc2C1 ZINC001233321557 978558067 /nfs/dbraw/zinc/55/80/67/978558067.db2.gz UFHFOZGHIYYLMV-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cnsc1C[N@H+]1CCc2ccncc2C1 ZINC001233321557 978558074 /nfs/dbraw/zinc/55/80/74/978558074.db2.gz UFHFOZGHIYYLMV-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cnsc1C[N@@H+]1CCO[C@@H](C(C)C)C1 ZINC001233321739 978562661 /nfs/dbraw/zinc/56/26/61/978562661.db2.gz AZDKYUAXTSKETD-LLVKDONJSA-N 1 2 240.372 2.308 20 0 BEADLO Cc1cnsc1C[N@H+]1CCO[C@@H](C(C)C)C1 ZINC001233321739 978562667 /nfs/dbraw/zinc/56/26/67/978562667.db2.gz AZDKYUAXTSKETD-LLVKDONJSA-N 1 2 240.372 2.308 20 0 BEADLO CN(Cc1cccc2[nH+]ccn21)CC(F)(F)F ZINC001233360778 978571941 /nfs/dbraw/zinc/57/19/41/978571941.db2.gz DRHVIKZBTPCZAF-UHFFFAOYSA-N 1 2 243.232 2.328 20 0 BEADLO CCc1cc(C)nc(NCc2[nH]c(C)c(C)[nH+]2)n1 ZINC001337970356 978579853 /nfs/dbraw/zinc/57/98/53/978579853.db2.gz JCZKGSJDMMVSJS-UHFFFAOYSA-N 1 2 245.330 2.299 20 0 BEADLO Nc1cccc(CN2CCCCC(F)(F)C2)[nH+]1 ZINC001233368704 978581661 /nfs/dbraw/zinc/58/16/61/978581661.db2.gz BMZZIAZBYFIITE-UHFFFAOYSA-N 1 2 241.285 2.285 20 0 BEADLO C[C@@H]1CC[N@@H+]1Cc1c[nH]c(Br)c1 ZINC001233434712 978602044 /nfs/dbraw/zinc/60/20/44/978602044.db2.gz YUDVJPHSDUOADC-SSDOTTSWSA-N 1 2 229.121 2.371 20 0 BEADLO C[C@@H]1CC[N@H+]1Cc1c[nH]c(Br)c1 ZINC001233434712 978602045 /nfs/dbraw/zinc/60/20/45/978602045.db2.gz YUDVJPHSDUOADC-SSDOTTSWSA-N 1 2 229.121 2.371 20 0 BEADLO F[C@@H]1C[C@@H]2C[C@H]1C[N@@H+]2Cc1cncc(Cl)n1 ZINC001233448926 978605630 /nfs/dbraw/zinc/60/56/30/978605630.db2.gz JKSSCGWDTVDCPU-UJNFCWOMSA-N 1 2 241.697 2.062 20 0 BEADLO F[C@@H]1C[C@@H]2C[C@H]1C[N@H+]2Cc1cncc(Cl)n1 ZINC001233448926 978605643 /nfs/dbraw/zinc/60/56/43/978605643.db2.gz JKSSCGWDTVDCPU-UJNFCWOMSA-N 1 2 241.697 2.062 20 0 BEADLO C[N@H+](Cc1ccncc1)Cc1cncc(Cl)n1 ZINC001233447219 978607347 /nfs/dbraw/zinc/60/73/47/978607347.db2.gz XNJLXWAJZCOIKM-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[N@@H+](Cc1ccncc1)Cc1cncc(Cl)n1 ZINC001233447219 978607351 /nfs/dbraw/zinc/60/73/51/978607351.db2.gz XNJLXWAJZCOIKM-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO Cc1n[nH]c(C[N@H+](C)CCC(F)(F)F)c1C ZINC001338234981 978640464 /nfs/dbraw/zinc/64/04/64/978640464.db2.gz QBQXNSVEERBRLJ-UHFFFAOYSA-N 1 2 235.253 2.411 20 0 BEADLO Cc1n[nH]c(C[N@@H+](C)CCC(F)(F)F)c1C ZINC001338234981 978640471 /nfs/dbraw/zinc/64/04/71/978640471.db2.gz QBQXNSVEERBRLJ-UHFFFAOYSA-N 1 2 235.253 2.411 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H]1C[C@@H]1C(C)C ZINC001338244298 978641796 /nfs/dbraw/zinc/64/17/96/978641796.db2.gz UXBOUFIBRWKKHH-VXGBXAGGSA-N 1 2 232.327 2.351 20 0 BEADLO Cc1cc(O[C@H]2CCC[N@@H+](C)C2)cc2[nH]ncc21 ZINC001233739699 978684227 /nfs/dbraw/zinc/68/42/27/978684227.db2.gz RHLFABQKUUZAKS-NSHDSACASA-N 1 2 245.326 2.344 20 0 BEADLO Cc1cc(O[C@H]2CCC[N@H+](C)C2)cc2[nH]ncc21 ZINC001233739699 978684230 /nfs/dbraw/zinc/68/42/30/978684230.db2.gz RHLFABQKUUZAKS-NSHDSACASA-N 1 2 245.326 2.344 20 0 BEADLO C[C@@H](C(=O)N(C)CC1CCCC1)n1cc[nH+]c1 ZINC000069307854 978712189 /nfs/dbraw/zinc/71/21/89/978712189.db2.gz NEUQIAMEEHQJPG-NSHDSACASA-N 1 2 235.331 2.093 20 0 BEADLO CC(C)(C)[NH+]1CC(Oc2cccc(O)c2F)C1 ZINC001233867543 978717999 /nfs/dbraw/zinc/71/79/99/978717999.db2.gz FZIRBPOAWPIRNG-UHFFFAOYSA-N 1 2 239.290 2.393 20 0 BEADLO CCc1cccc(C)c1OC1C[NH+](C)C1 ZINC001233927201 978731046 /nfs/dbraw/zinc/73/10/46/978731046.db2.gz ASIFNCUGFYMDAH-UHFFFAOYSA-N 1 2 205.301 2.250 20 0 BEADLO CCC(C)=CC(=O)Nc1c(C)c[nH+]cc1C ZINC001338994346 978769216 /nfs/dbraw/zinc/76/92/16/978769216.db2.gz ZVOHBKAMXXCECR-RMKNXTFCSA-N 1 2 218.300 2.415 20 0 BEADLO Cc1ccoc1CC(=O)Nc1c(C)c[nH+]cc1C ZINC001339104201 978794355 /nfs/dbraw/zinc/79/43/55/978794355.db2.gz ZECGUJWVWPWSOD-UHFFFAOYSA-N 1 2 244.294 2.203 20 0 BEADLO Cc1c(CN(C)c2cc(F)cc(C)[nH+]2)cnn1C ZINC001339692626 978895310 /nfs/dbraw/zinc/89/53/10/978895310.db2.gz SRVOPPSWCNXBLY-UHFFFAOYSA-N 1 2 248.305 2.207 20 0 BEADLO C[NH+]1CC(Oc2ccc(F)c3cc(O)ccc23)C1 ZINC001234693753 978899961 /nfs/dbraw/zinc/89/99/61/978899961.db2.gz XADURKUHPHPZBV-UHFFFAOYSA-N 1 2 247.269 2.377 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1cc2cccc(F)c2[nH]1 ZINC001235240528 979002059 /nfs/dbraw/zinc/00/20/59/979002059.db2.gz SSHDRHHUHYGBPN-UHFFFAOYSA-N 1 2 234.274 2.328 20 0 BEADLO CC(=O)C[N@H+](C)Cc1cc2cccc(F)c2[nH]1 ZINC001235240528 979002066 /nfs/dbraw/zinc/00/20/66/979002066.db2.gz SSHDRHHUHYGBPN-UHFFFAOYSA-N 1 2 234.274 2.328 20 0 BEADLO CC(C)[C@@H](C)C(=O)Nc1cc[nH+]c2c1CCC2 ZINC001181471887 979116884 /nfs/dbraw/zinc/11/68/84/979116884.db2.gz RVEQKHJRQBGBGY-SNVBAGLBSA-N 1 2 232.327 2.223 20 0 BEADLO C[C@@H]1C[C@@H]1C[N@@H+]1CCNC[C@@H]1c1ccccc1F ZINC001235743203 979140991 /nfs/dbraw/zinc/14/09/91/979140991.db2.gz LPUQADKNMCQVOL-LALPHHSUSA-N 1 2 248.345 2.428 20 0 BEADLO C[C@@H]1C[C@@H]1C[N@H+]1CCNC[C@@H]1c1ccccc1F ZINC001235743203 979141003 /nfs/dbraw/zinc/14/10/03/979141003.db2.gz LPUQADKNMCQVOL-LALPHHSUSA-N 1 2 248.345 2.428 20 0 BEADLO Cc1nc(F)ccc1C[N@H+]1C[C@@H](C)[C@@H](F)C1 ZINC001235804813 979155169 /nfs/dbraw/zinc/15/51/69/979155169.db2.gz GREHJBKCQUFNCN-KCJUWKMLSA-N 1 2 226.270 2.319 20 0 BEADLO Cc1nc(F)ccc1C[N@@H+]1C[C@@H](C)[C@@H](F)C1 ZINC001235804813 979155170 /nfs/dbraw/zinc/15/51/70/979155170.db2.gz GREHJBKCQUFNCN-KCJUWKMLSA-N 1 2 226.270 2.319 20 0 BEADLO CCOc1cc(-c2ccc[nH+]c2N)c(F)cn1 ZINC001235874224 979173030 /nfs/dbraw/zinc/17/30/30/979173030.db2.gz ZZSWYIWRENMNBA-UHFFFAOYSA-N 1 2 233.246 2.264 20 0 BEADLO Cn1cc(Cl)c(C[N@@H+]2CC[C@@H]2C2CC2)n1 ZINC001181913738 979372690 /nfs/dbraw/zinc/37/26/90/979372690.db2.gz RGXJOQIWMBHDQP-LLVKDONJSA-N 1 2 225.723 2.058 20 0 BEADLO Cn1cc(Cl)c(C[N@H+]2CC[C@@H]2C2CC2)n1 ZINC001181913738 979372703 /nfs/dbraw/zinc/37/27/03/979372703.db2.gz RGXJOQIWMBHDQP-LLVKDONJSA-N 1 2 225.723 2.058 20 0 BEADLO Cc1cc(C)c(NC(=O)NC2C[NH+](C)C2)c(C)c1 ZINC001181931975 979374421 /nfs/dbraw/zinc/37/44/21/979374421.db2.gz FKUKTGVJUFBWAL-UHFFFAOYSA-N 1 2 247.342 2.047 20 0 BEADLO CC[C@H](Cc1nnc(C[NH+](C)C)o1)C(C)C ZINC001341627795 979496636 /nfs/dbraw/zinc/49/66/36/979496636.db2.gz OFSHYQNTOVGPOD-SNVBAGLBSA-N 1 2 225.336 2.356 20 0 BEADLO C[NH+](C)Cc1nnc(CCc2ccc(F)cc2)o1 ZINC001341624944 979497759 /nfs/dbraw/zinc/49/77/59/979497759.db2.gz BTKPRLFSRKOGLB-UHFFFAOYSA-N 1 2 249.289 2.056 20 0 BEADLO COC(=O)Cc1cccc(-c2ccc(N)[nH+]c2)c1 ZINC001236312609 979517567 /nfs/dbraw/zinc/51/75/67/979517567.db2.gz SQGOYYGCGHYZQT-UHFFFAOYSA-N 1 2 242.278 2.046 20 0 BEADLO Nc1ccc(-c2cccc3c2CCC(=O)N3)c[nH+]1 ZINC001236313459 979519688 /nfs/dbraw/zinc/51/96/88/979519688.db2.gz PGTPUSNMOHCNBN-UHFFFAOYSA-N 1 2 239.278 2.216 20 0 BEADLO Cc1cc(C(N)=O)cc(C)c1-c1ccc(N)[nH+]c1 ZINC001236318355 979533805 /nfs/dbraw/zinc/53/38/05/979533805.db2.gz WHEZUYRIMFNONC-UHFFFAOYSA-N 1 2 241.294 2.047 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1cccc2occc21 ZINC001236734221 979710313 /nfs/dbraw/zinc/71/03/13/979710313.db2.gz CPZPTGVBFYFANJ-UHFFFAOYSA-N 1 2 247.294 2.428 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1cccc2occc21 ZINC001236734221 979710321 /nfs/dbraw/zinc/71/03/21/979710321.db2.gz CPZPTGVBFYFANJ-UHFFFAOYSA-N 1 2 247.294 2.428 20 0 BEADLO COc1cc(C[NH+]2CCC2)c(F)cc1F ZINC001236816094 979746264 /nfs/dbraw/zinc/74/62/64/979746264.db2.gz WMBIZPJEANPQGE-UHFFFAOYSA-N 1 2 213.227 2.179 20 0 BEADLO C[N@@H+](Cc1ccon1)CC1OC=CC1=S ZINC001237190941 979839988 /nfs/dbraw/zinc/83/99/88/979839988.db2.gz KVDPBXWUWYSMJD-UHFFFAOYSA-N 1 2 224.285 2.188 20 0 BEADLO C[N@H+](Cc1ccon1)CC1OC=CC1=S ZINC001237190941 979839994 /nfs/dbraw/zinc/83/99/94/979839994.db2.gz KVDPBXWUWYSMJD-UHFFFAOYSA-N 1 2 224.285 2.188 20 0 BEADLO Oc1cc(F)cc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)c1 ZINC001237278435 979858730 /nfs/dbraw/zinc/85/87/30/979858730.db2.gz XXSORCRNLFPFRK-TVYUQYBPSA-N 1 2 239.265 2.321 20 0 BEADLO Oc1cc(F)cc(C[N@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)c1 ZINC001237278435 979858732 /nfs/dbraw/zinc/85/87/32/979858732.db2.gz XXSORCRNLFPFRK-TVYUQYBPSA-N 1 2 239.265 2.321 20 0 BEADLO FC(F)(F)c1cnccc1C[NH+]1CC=CC1 ZINC001237286154 979863886 /nfs/dbraw/zinc/86/38/86/979863886.db2.gz XCZGFPJRIOQOAA-UHFFFAOYSA-N 1 2 228.217 2.472 20 0 BEADLO FC(F)(F)c1cnccc1C[NH+]1CCC1 ZINC001237286714 979864508 /nfs/dbraw/zinc/86/45/08/979864508.db2.gz BZDGATVRAWRKJX-UHFFFAOYSA-N 1 2 216.206 2.306 20 0 BEADLO CCc1cccc(C)c1C[N@@H+]1CC[C@H]1C(=O)OC ZINC001237323640 979865970 /nfs/dbraw/zinc/86/59/70/979865970.db2.gz KNCDZGZLEHKHMR-AWEZNQCLSA-N 1 2 247.338 2.305 20 0 BEADLO CCc1cccc(C)c1C[N@H+]1CC[C@H]1C(=O)OC ZINC001237323640 979865974 /nfs/dbraw/zinc/86/59/74/979865974.db2.gz KNCDZGZLEHKHMR-AWEZNQCLSA-N 1 2 247.338 2.305 20 0 BEADLO CCCCC1(C(=O)OCc2c[nH+]cn2C)CC1 ZINC001342805285 979900802 /nfs/dbraw/zinc/90/08/02/979900802.db2.gz SHGLHYCHAPAMRC-UHFFFAOYSA-N 1 2 236.315 2.434 20 0 BEADLO CC(C)c1cccc(C[N@@H+]2CC(=O)NC[C@H]2C)c1 ZINC001237463479 979907127 /nfs/dbraw/zinc/90/71/27/979907127.db2.gz RQDIMTHGTOSKIG-GFCCVEGCSA-N 1 2 246.354 2.130 20 0 BEADLO CC(C)c1cccc(C[N@H+]2CC(=O)NC[C@H]2C)c1 ZINC001237463479 979907135 /nfs/dbraw/zinc/90/71/35/979907135.db2.gz RQDIMTHGTOSKIG-GFCCVEGCSA-N 1 2 246.354 2.130 20 0 BEADLO CC(C)[C@H]1CCN(c2nccn3c[nH+]cc23)C1 ZINC001342913707 979938137 /nfs/dbraw/zinc/93/81/37/979938137.db2.gz IMELZGJJJAPPOQ-NSHDSACASA-N 1 2 230.315 2.212 20 0 BEADLO CCn1c[nH+]cc1CN1CC[C@](C)(F)[C@@H](F)C1 ZINC001237587712 979945639 /nfs/dbraw/zinc/94/56/39/979945639.db2.gz HWISBLPRUYOJDX-RYUDHWBXSA-N 1 2 243.301 2.175 20 0 BEADLO CCn1c[nH+]cc1CN1CCc2occc2C1 ZINC001237592227 979948773 /nfs/dbraw/zinc/94/87/73/979948773.db2.gz DPHZEGUPBXKNBF-UHFFFAOYSA-N 1 2 231.299 2.054 20 0 BEADLO Cc1cccnc1[C@H](C)[NH2+][C@H]1CCn2ccnc21 ZINC001184292458 980014497 /nfs/dbraw/zinc/01/44/97/980014497.db2.gz ZSDYRGYXWXWYCC-RYUDHWBXSA-N 1 2 242.326 2.382 20 0 BEADLO COc1ccc(C[N@H+](C)C2CC2)c(Cl)n1 ZINC001237791344 980047583 /nfs/dbraw/zinc/04/75/83/980047583.db2.gz HGFPRDYOFIRCRK-UHFFFAOYSA-N 1 2 226.707 2.338 20 0 BEADLO COc1ccc(C[N@@H+](C)C2CC2)c(Cl)n1 ZINC001237791344 980047595 /nfs/dbraw/zinc/04/75/95/980047595.db2.gz HGFPRDYOFIRCRK-UHFFFAOYSA-N 1 2 226.707 2.338 20 0 BEADLO Cc1cnc(C[NH+]2CC3(C2)CCCC3)nc1 ZINC001237802826 980047686 /nfs/dbraw/zinc/04/76/86/980047686.db2.gz GOYXKAAUUVJQLR-UHFFFAOYSA-N 1 2 217.316 2.161 20 0 BEADLO COc1ccoc1C[N@@H+]1C[C@@H](C)[C@@H](F)C1 ZINC001237862952 980101223 /nfs/dbraw/zinc/10/12/23/980101223.db2.gz GXCBDWHFCYWITP-BDAKNGLRSA-N 1 2 213.252 2.078 20 0 BEADLO COc1ccoc1C[N@H+]1C[C@@H](C)[C@@H](F)C1 ZINC001237862952 980101224 /nfs/dbraw/zinc/10/12/24/980101224.db2.gz GXCBDWHFCYWITP-BDAKNGLRSA-N 1 2 213.252 2.078 20 0 BEADLO CC[N@H+](C)Cc1scnc1Br ZINC001238034982 980127893 /nfs/dbraw/zinc/12/78/93/980127893.db2.gz DYFXXYLKSVPMMX-UHFFFAOYSA-N 1 2 235.150 2.357 20 0 BEADLO CC[N@@H+](C)Cc1scnc1Br ZINC001238034982 980127896 /nfs/dbraw/zinc/12/78/96/980127896.db2.gz DYFXXYLKSVPMMX-UHFFFAOYSA-N 1 2 235.150 2.357 20 0 BEADLO CC(C)[C@H](C)N(C(=O)C[C@@H]([NH3+])C(F)F)C1CC1 ZINC001343528099 980142945 /nfs/dbraw/zinc/14/29/45/980142945.db2.gz WHOOMOHFZALHDQ-WCBMZHEXSA-N 1 2 248.317 2.004 20 0 BEADLO Cc1ncncc1C[N@@H+]1CCn2cccc2[C@@H]1C ZINC001238174871 980204633 /nfs/dbraw/zinc/20/46/33/980204633.db2.gz DLDVZMUDXIOIFE-LBPRGKRZSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1ncncc1C[N@H+]1CCn2cccc2[C@@H]1C ZINC001238174871 980204640 /nfs/dbraw/zinc/20/46/40/980204640.db2.gz DLDVZMUDXIOIFE-LBPRGKRZSA-N 1 2 242.326 2.163 20 0 BEADLO COc1cnc(C[N@@H+]2CC[C@H]2C)c(Cl)c1 ZINC001238485298 980278236 /nfs/dbraw/zinc/27/82/36/980278236.db2.gz SGPCDQUHVKRHCM-MRVPVSSYSA-N 1 2 226.707 2.338 20 0 BEADLO COc1cnc(C[N@H+]2CC[C@H]2C)c(Cl)c1 ZINC001238485298 980278244 /nfs/dbraw/zinc/27/82/44/980278244.db2.gz SGPCDQUHVKRHCM-MRVPVSSYSA-N 1 2 226.707 2.338 20 0 BEADLO CC(C)C[C@H](CO)Nc1cc(N)cc(Cl)[nH+]1 ZINC000154506300 980307960 /nfs/dbraw/zinc/30/79/60/980307960.db2.gz BNCFMPWQHLHSJT-SECBINFHSA-N 1 2 243.738 2.136 20 0 BEADLO CCOc1ccc(C)c(C[NH+]2CC(OC)C2)c1 ZINC001238703389 980308561 /nfs/dbraw/zinc/30/85/61/980308561.db2.gz DFRGDKVSMFCMTC-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO CC(C)[C@H](F)C(=O)OCC(C)(C)n1cc[nH+]c1 ZINC001344105986 980348309 /nfs/dbraw/zinc/34/83/09/980348309.db2.gz CGPWTPQKTPBQQJ-JTQLQIEISA-N 1 2 242.294 2.156 20 0 BEADLO CC(C)(COC(=O)c1ccoc1)n1cc[nH+]c1 ZINC001344106729 980350237 /nfs/dbraw/zinc/35/02/37/980350237.db2.gz ITVUWEIOQPKKFN-UHFFFAOYSA-N 1 2 234.255 2.068 20 0 BEADLO COc1nn(C)cc1Nc1cc(C)c[nH+]c1C ZINC001203654067 980475909 /nfs/dbraw/zinc/47/59/09/980475909.db2.gz CAXCSAQZZUBEJH-UHFFFAOYSA-N 1 2 232.287 2.184 20 0 BEADLO COCn1cc(Nc2cc(C)c[nH+]c2C)cn1 ZINC001203657677 980494581 /nfs/dbraw/zinc/49/45/81/980494581.db2.gz UAPSLPADEPGNOM-UHFFFAOYSA-N 1 2 232.287 2.242 20 0 BEADLO c1coc(C[N@@H+]2CCc3ncccc3C2)c1 ZINC001203278152 980501224 /nfs/dbraw/zinc/50/12/24/980501224.db2.gz CPYJPCGWKIQAIB-UHFFFAOYSA-N 1 2 214.268 2.233 20 0 BEADLO c1coc(C[N@H+]2CCc3ncccc3C2)c1 ZINC001203278152 980501228 /nfs/dbraw/zinc/50/12/28/980501228.db2.gz CPYJPCGWKIQAIB-UHFFFAOYSA-N 1 2 214.268 2.233 20 0 BEADLO CCn1c[nH+]cc1COC(=O)c1ccsc1 ZINC001344960882 980507976 /nfs/dbraw/zinc/50/79/76/980507976.db2.gz WBMAXBCXNVGRJA-UHFFFAOYSA-N 1 2 236.296 2.322 20 0 BEADLO CCn1c[nH+]cc1COC(=O)Cc1ccc(C)o1 ZINC001344972931 980510218 /nfs/dbraw/zinc/51/02/18/980510218.db2.gz WLFDTBKRJOZRNV-UHFFFAOYSA-N 1 2 248.282 2.090 20 0 BEADLO Cn1c[nH+]cc1CCCOC(=O)[C@]12C[C@H]1CCC2 ZINC001345060007 980537895 /nfs/dbraw/zinc/53/78/95/980537895.db2.gz MULGBYZZGPMECC-BXUZGUMPSA-N 1 2 248.326 2.086 20 0 BEADLO Cc1ccc(CC[NH+]2CCOCC2)c(F)c1 ZINC001250275054 980630300 /nfs/dbraw/zinc/63/03/00/980630300.db2.gz DYDWQTTWJLOORK-UHFFFAOYSA-N 1 2 223.291 2.009 20 0 BEADLO C[C@H]1CCC[C@@H](NC(=O)CCc2[nH+]ccn2C)C1 ZINC001345589032 980638331 /nfs/dbraw/zinc/63/83/31/980638331.db2.gz RQHKFBXPUFTOFY-NWDGAFQWSA-N 1 2 249.358 2.048 20 0 BEADLO CCn1c[nH+]cc1COC(=O)/C=C(\C)C1CC1 ZINC001345590952 980640422 /nfs/dbraw/zinc/64/04/22/980640422.db2.gz QPNKIFYMFBLSFD-UXBLZVDNSA-N 1 2 234.299 2.303 20 0 BEADLO COc1cc(F)ccc1CCn1cc[nH+]c1 ZINC001250315236 980753330 /nfs/dbraw/zinc/75/33/30/980753330.db2.gz HFZAXJDOWPQROB-UHFFFAOYSA-N 1 2 220.247 2.274 20 0 BEADLO CCCCCC[C@H](O)C[NH2+][C@@H](C)c1ncon1 ZINC001346312833 980808309 /nfs/dbraw/zinc/80/83/09/980808309.db2.gz MNOXWLLAVRHWLT-QWRGUYRKSA-N 1 2 241.335 2.052 20 0 BEADLO CC(C)CCCCNC(=O)[C@@H](C)n1cc[nH+]c1 ZINC000077030832 980815858 /nfs/dbraw/zinc/81/58/58/980815858.db2.gz NVHKDUCTUIVJPY-GFCCVEGCSA-N 1 2 237.347 2.387 20 0 BEADLO CCc1cn(CCCOCC(F)(F)F)c[nH+]1 ZINC001190104219 980847341 /nfs/dbraw/zinc/84/73/41/980847341.db2.gz QYXVPWQBPUHCIN-UHFFFAOYSA-N 1 2 236.237 2.415 20 0 BEADLO C[NH+](C)Cc1nnc([C@H]2CCC(C)(C)C2)o1 ZINC001346625304 980870508 /nfs/dbraw/zinc/87/05/08/980870508.db2.gz DNFRTXQQCBPAMT-VIFPVBQESA-N 1 2 223.320 2.425 20 0 BEADLO CC[C@@H]1CCC[C@@H]1NC(=O)CCc1[nH+]ccn1C ZINC001347015588 980947983 /nfs/dbraw/zinc/94/79/83/980947983.db2.gz ODPYJFATAJPFJJ-NEPJUHHUSA-N 1 2 249.358 2.048 20 0 BEADLO Nc1ccc(-c2ccc3[nH+]ccn3c2)c(F)n1 ZINC001239822465 980968363 /nfs/dbraw/zinc/96/83/63/980968363.db2.gz ISQQJDXEIZORAI-UHFFFAOYSA-N 1 2 228.230 2.118 20 0 BEADLO c1nnc(C[NH2+][C@H](c2ccccc2)C2CCC2)[nH]1 ZINC001347104322 980973526 /nfs/dbraw/zinc/97/35/26/980973526.db2.gz LJUPKTLXHALVOV-CQSZACIVSA-N 1 2 242.326 2.436 20 0 BEADLO COc1ncc(-c2cc(C)c3[nH+]ccn3c2)cn1 ZINC001239848119 980987079 /nfs/dbraw/zinc/98/70/79/980987079.db2.gz SRQRATYXGUBNBK-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO NC(=O)c1ccc(-c2ccn3cc[nH+]c3c2)cc1 ZINC001239870640 981010308 /nfs/dbraw/zinc/01/03/08/981010308.db2.gz RKEJSXBYIOLXNS-UHFFFAOYSA-N 1 2 237.262 2.100 20 0 BEADLO Cc1cc(-c2cccc(C(N)=O)c2)cc(C)[nH+]1 ZINC001239882327 981018155 /nfs/dbraw/zinc/01/81/55/981018155.db2.gz AOZZWXSUICDHJI-UHFFFAOYSA-N 1 2 226.279 2.464 20 0 BEADLO CN(C)C(=O)c1cccc(-c2ccc[nH+]c2N)c1 ZINC001239922924 981033899 /nfs/dbraw/zinc/03/38/99/981033899.db2.gz SWVZHQABXBQZMD-UHFFFAOYSA-N 1 2 241.294 2.033 20 0 BEADLO COc1cncc(-c2cccc3[nH+]ccn32)c1 ZINC001239930836 981042644 /nfs/dbraw/zinc/04/26/44/981042644.db2.gz UXHAZIQTLHFFTL-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO COCc1ccccc1-c1ccc[nH+]c1N ZINC001239952116 981057477 /nfs/dbraw/zinc/05/74/77/981057477.db2.gz RUQLGYZTKSPCPF-UHFFFAOYSA-N 1 2 214.268 2.477 20 0 BEADLO Cc1nc([C@H](C)[NH2+][C@@H](C)CSCCF)no1 ZINC001347393684 981067202 /nfs/dbraw/zinc/06/72/02/981067202.db2.gz BZZYQGOKVJQKGF-YUMQZZPRSA-N 1 2 247.339 2.120 20 0 BEADLO C[C@H](C(=O)N[C@@H]1CC2CCC1CC2)n1cc[nH+]c1 ZINC001347729993 981155135 /nfs/dbraw/zinc/15/51/35/981155135.db2.gz YZTHHPDTOXVCCE-IKWCTNDRSA-N 1 2 247.342 2.139 20 0 BEADLO Nc1cc(-c2ccc3n[nH]cc3c2)cc[nH+]1 ZINC001240211808 981159622 /nfs/dbraw/zinc/15/96/22/981159622.db2.gz RZOQYYJNEDRUNL-UHFFFAOYSA-N 1 2 210.240 2.207 20 0 BEADLO Cc1cnnc(-c2ccc3[nH+]ccn3c2)c1 ZINC001240214386 981160870 /nfs/dbraw/zinc/16/08/70/981160870.db2.gz PBWFSPPNDXSSHQ-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO COc1cccnc1-c1ccc2[nH+]ccn2c1 ZINC001240213540 981161977 /nfs/dbraw/zinc/16/19/77/981161977.db2.gz DKKMKAHJZAEZJP-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO Cc1cnc(C)c(-c2ccc3[nH+]ccn3c2)n1 ZINC001240213970 981162201 /nfs/dbraw/zinc/16/22/01/981162201.db2.gz IIPCAHUUWMVUIA-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO CCc1nccnc1-c1ccc2[nH+]ccn2c1 ZINC001240215243 981163868 /nfs/dbraw/zinc/16/38/68/981163868.db2.gz WAGDODALJVALPQ-UHFFFAOYSA-N 1 2 224.267 2.354 20 0 BEADLO COc1cccc(-c2ccc3[nH+]ccn3c2)n1 ZINC001240214826 981164680 /nfs/dbraw/zinc/16/46/80/981164680.db2.gz RSIUKIZOVOQAQG-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO CCOc1ccc(-c2ccc3[nH+]ccn3c2)nn1 ZINC001240214845 981165081 /nfs/dbraw/zinc/16/50/81/981165081.db2.gz SQZPIJGZFYGFOV-UHFFFAOYSA-N 1 2 240.266 2.190 20 0 BEADLO Cc1cn2cc(-c3ccc4[nH+]ccn4c3)cnc2n1 ZINC001240218081 981166571 /nfs/dbraw/zinc/16/65/71/981166571.db2.gz ZOVCQCYVHCSPPD-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO O=C1NCc2ccc(-c3ccc4[nH+]ccn4c3)cc21 ZINC001240217820 981166824 /nfs/dbraw/zinc/16/68/24/981166824.db2.gz PARCOLVCFRCHLM-UHFFFAOYSA-N 1 2 249.273 2.245 20 0 BEADLO c1cn2nc(-c3ccc4[nH+]ccn4c3)ccc2n1 ZINC001240219378 981169211 /nfs/dbraw/zinc/16/92/11/981169211.db2.gz JIYNBGWCVXDMLA-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO CCn1cccc(-c2ccc3[nH+]ccn3c2)c1=O ZINC001240218762 981170766 /nfs/dbraw/zinc/17/07/66/981170766.db2.gz XRIKGSSOPHPNHB-UHFFFAOYSA-N 1 2 239.278 2.183 20 0 BEADLO c1cn2cc(-c3ccc4[nH+]ccn4c3)ncc2n1 ZINC001240219624 981172092 /nfs/dbraw/zinc/17/20/92/981172092.db2.gz QLAISFXCDPPRHL-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO Fc1ccc(-c2cn[nH]c2)cc1-n1cc[nH+]c1 ZINC001240243568 981220612 /nfs/dbraw/zinc/22/06/12/981220612.db2.gz KUOKOSMQXHTGSR-UHFFFAOYSA-N 1 2 228.230 2.402 20 0 BEADLO CCc1ccc(N2C[C@H]3CCC[C@@H](C2)C3O)[nH+]c1 ZINC001347999869 981239401 /nfs/dbraw/zinc/23/94/01/981239401.db2.gz CMORRBMHSKHVAA-NNQSOWQGSA-N 1 2 246.354 2.241 20 0 BEADLO Cn1cc(-c2ccc(-n3cc[nH+]c3)cc2)cn1 ZINC001240295461 981245455 /nfs/dbraw/zinc/24/54/55/981245455.db2.gz UYOIKLHPOLOEEX-UHFFFAOYSA-N 1 2 224.267 2.273 20 0 BEADLO Cn1cc[nH+]c1CCCOC(=O)[C@]1(C)C=CCC1 ZINC001348127643 981290949 /nfs/dbraw/zinc/29/09/49/981290949.db2.gz HYLGAFLEOZTKTP-CQSZACIVSA-N 1 2 248.326 2.252 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1ccc(=O)n(C)c1 ZINC001240331569 981300881 /nfs/dbraw/zinc/30/08/81/981300881.db2.gz HKOGOQXGTIOZIC-UHFFFAOYSA-N 1 2 239.278 2.008 20 0 BEADLO Cc1cn2c(cccc2-c2ccc(=O)n(C)c2)[nH+]1 ZINC001240332496 981301696 /nfs/dbraw/zinc/30/16/96/981301696.db2.gz HAQVSJAFRYLIGE-UHFFFAOYSA-N 1 2 239.278 2.008 20 0 BEADLO CCc1ccc(N2C[C@@H]3COC[C@]3(C)C2)[nH+]c1 ZINC001348247589 981316655 /nfs/dbraw/zinc/31/66/55/981316655.db2.gz RTYXHJWWIHANQR-OCCSQVGLSA-N 1 2 232.327 2.117 20 0 BEADLO CCc1ccc(N2CC[C@@H](C(C)(C)O)C2)[nH+]c1 ZINC001348291693 981327567 /nfs/dbraw/zinc/32/75/67/981327567.db2.gz PYMJCHYGHOIRDR-GFCCVEGCSA-N 1 2 234.343 2.241 20 0 BEADLO Cc1c(-c2c[nH+]c(N(C)C)cc2C)cnn1C ZINC001240381544 981340277 /nfs/dbraw/zinc/34/02/77/981340277.db2.gz XXKADCDEMLSNGD-UHFFFAOYSA-N 1 2 230.315 2.165 20 0 BEADLO Cc1cc(-c2cnc3[nH]ccc3c2)c[nH+]c1N ZINC001240392565 981353089 /nfs/dbraw/zinc/35/30/89/981353089.db2.gz HOXKHLQGWHRSBG-UHFFFAOYSA-N 1 2 224.267 2.467 20 0 BEADLO C[C@@H](C(=O)N1CC[C@H](C2CCC2)C1)n1cc[nH+]c1 ZINC001348465855 981368843 /nfs/dbraw/zinc/36/88/43/981368843.db2.gz QZVHEEQQQQRAQZ-AAEUAGOBSA-N 1 2 247.342 2.093 20 0 BEADLO Cc1cnc(C)nc1NCC(C)(C)n1cc[nH+]c1 ZINC001348545532 981389230 /nfs/dbraw/zinc/38/92/30/981389230.db2.gz AZHQUHIHRUQIHJ-UHFFFAOYSA-N 1 2 245.330 2.137 20 0 BEADLO Cc1c(-c2cnc3ccnn3c2)ccc2[nH+]ccn21 ZINC001240442852 981389956 /nfs/dbraw/zinc/38/99/56/981389956.db2.gz DLOFKOBWGNUOGP-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO c1cc2nc(-c3ccn4cc[nH+]c4c3)ncc2[nH]1 ZINC001240495991 981415300 /nfs/dbraw/zinc/41/53/00/981415300.db2.gz FMOHICKTFZOROC-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO CCOc1ncccc1/C(C)=C/C=C/[NH3+] ZINC001240495019 981415733 /nfs/dbraw/zinc/41/57/33/981415733.db2.gz IVXLJRLDOWVRMA-GZFKCFCKSA-N 1 2 204.273 2.356 20 0 BEADLO c1cn2ccc(-c3ncc4cccnc4n3)cc2[nH+]1 ZINC001240496311 981417227 /nfs/dbraw/zinc/41/72/27/981417227.db2.gz AIRODPCYDDQIMS-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO CCOc1ccc(-c2ccn3cc[nH+]c3c2)nn1 ZINC001240496806 981417859 /nfs/dbraw/zinc/41/78/59/981417859.db2.gz OZBQRDHMFWYXBZ-UHFFFAOYSA-N 1 2 240.266 2.190 20 0 BEADLO CCc1ccc(-c2ccn3cc[nH+]c3c2)nn1 ZINC001240497199 981418324 /nfs/dbraw/zinc/41/83/24/981418324.db2.gz MOLROAZCLVDUQH-UHFFFAOYSA-N 1 2 224.267 2.354 20 0 BEADLO Cc1cnnc(-c2ccn3cc[nH+]c3c2)c1 ZINC001240497041 981418808 /nfs/dbraw/zinc/41/88/08/981418808.db2.gz WRRZHNOAUZUUPZ-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO Nc1cncc(F)c1-c1ccn2cc[nH+]c2c1 ZINC001240504018 981430613 /nfs/dbraw/zinc/43/06/13/981430613.db2.gz UNBFAVWAXTWFHT-UHFFFAOYSA-N 1 2 228.230 2.118 20 0 BEADLO CCOc1cc(-c2ccn3cc[nH+]c3c2)ncn1 ZINC001240504447 981432090 /nfs/dbraw/zinc/43/20/90/981432090.db2.gz PBNUVZMKBBOSHS-UHFFFAOYSA-N 1 2 240.266 2.190 20 0 BEADLO CCn1cc(-c2ccn3cc[nH+]c3c2)ccc1=O ZINC001240510170 981434266 /nfs/dbraw/zinc/43/42/66/981434266.db2.gz DTSKZZIAUNNHKA-UHFFFAOYSA-N 1 2 239.278 2.183 20 0 BEADLO Cc1ncnc(C)c1-c1ccn2cc[nH+]c2c1 ZINC001240508827 981434857 /nfs/dbraw/zinc/43/48/57/981434857.db2.gz LHANVTADAJRTJA-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO Cn1cnc2cc(-c3ccn4cc[nH+]c4c3)cnc21 ZINC001240509400 981434974 /nfs/dbraw/zinc/43/49/74/981434974.db2.gz YRKNLSGEIKCCMA-UHFFFAOYSA-N 1 2 249.277 2.283 20 0 BEADLO Fc1ncc(-c2ccn3cc[nH+]c3c2)c(F)n1 ZINC001240511268 981435778 /nfs/dbraw/zinc/43/57/78/981435778.db2.gz CIJSHTHASMFQDJ-UHFFFAOYSA-N 1 2 232.193 2.070 20 0 BEADLO Cc1nc2cc(-c3ccn4cc[nH+]c4c3)ccn2n1 ZINC001240510932 981436642 /nfs/dbraw/zinc/43/66/42/981436642.db2.gz VRALYMIVGPAHCO-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO Cc1cn2c(cccc2-c2c[nH]nc2C)[nH+]1 ZINC001240518078 981447867 /nfs/dbraw/zinc/44/78/67/981447867.db2.gz JDYFXMNFEUYUKE-UHFFFAOYSA-N 1 2 212.256 2.341 20 0 BEADLO CC(C)COC(=O)NCc1c[nH+]cn1C(C)C ZINC001193862646 981486284 /nfs/dbraw/zinc/48/62/84/981486284.db2.gz AMAFHQMBGYKAHV-UHFFFAOYSA-N 1 2 239.319 2.346 20 0 BEADLO CCCC[C@@H](CC)COC(=O)NC1C[NH+](C)C1 ZINC001193974656 981523788 /nfs/dbraw/zinc/52/37/88/981523788.db2.gz DUURPMARDBZKER-LLVKDONJSA-N 1 2 242.363 2.243 20 0 BEADLO CCCOC(=O)Nc1cccc2[nH+]ccn21 ZINC001194084404 981551647 /nfs/dbraw/zinc/55/16/47/981551647.db2.gz KDXGBFVJGTZPMR-UHFFFAOYSA-N 1 2 219.244 2.293 20 0 BEADLO C[C@H](CCC1CC1)NC(=O)CCc1[nH+]ccn1C ZINC001349445418 981558611 /nfs/dbraw/zinc/55/86/11/981558611.db2.gz ZBRQWWQXURGFHU-LLVKDONJSA-N 1 2 249.358 2.048 20 0 BEADLO Cc1cc(-c2cnc(C3CC3)nc2)c[nH+]c1N ZINC001240688156 981592475 /nfs/dbraw/zinc/59/24/75/981592475.db2.gz VHTTWFNTPDVELW-UHFFFAOYSA-N 1 2 226.283 2.307 20 0 BEADLO CCCC(C)(C)c1nnc(C[NH+](C)C)o1 ZINC001349987037 981830111 /nfs/dbraw/zinc/83/01/11/981830111.db2.gz UQRHMNKQBXDPHM-UHFFFAOYSA-N 1 2 211.309 2.209 20 0 BEADLO CCC1(C)CCN(C(=O)Cc2[nH]c[nH+]c2C)CC1 ZINC001584032471 981851810 /nfs/dbraw/zinc/85/18/10/981851810.db2.gz HUJRXTXKYFXPBZ-UHFFFAOYSA-N 1 2 249.358 2.299 20 0 BEADLO CCC(CC)COC(=O)N(CC)C1C[NH+](C)C1 ZINC001194706770 981865980 /nfs/dbraw/zinc/86/59/80/981865980.db2.gz ZODHDMNNJXGHLG-UHFFFAOYSA-N 1 2 242.363 2.195 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)[C@@H]1CCC[C@H]2C[C@H]21 ZINC001350091323 981868939 /nfs/dbraw/zinc/86/89/39/981868939.db2.gz XIYVFKHCAXILES-YNEHKIRRSA-N 1 2 248.326 2.253 20 0 BEADLO CCCCC(=O)OCc1c[nH+]cn1CC ZINC001350334272 981928909 /nfs/dbraw/zinc/92/89/09/981928909.db2.gz NEJYXBVTEYHWDN-UHFFFAOYSA-N 1 2 210.277 2.136 20 0 BEADLO Cc1ccc(-c2ccc3c(c2)OCO3)[nH+]c1N ZINC001240897601 981949149 /nfs/dbraw/zinc/94/91/49/981949149.db2.gz BYRXSPQSNBMENI-UHFFFAOYSA-N 1 2 228.251 2.368 20 0 BEADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)OCCF ZINC001194929721 981969766 /nfs/dbraw/zinc/96/97/66/981969766.db2.gz UWETZECEBXVQKW-UHFFFAOYSA-N 1 2 249.245 2.390 20 0 BEADLO CC[C@H](C)C[C@H](C)NC(=O)Cc1[nH]c[nH+]c1C ZINC001586816087 982023248 /nfs/dbraw/zinc/02/32/48/982023248.db2.gz JEXFPELXZJRCRL-UWVGGRQHSA-N 1 2 237.347 2.202 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1cc(C)cc(C)c1O ZINC001586941497 982035002 /nfs/dbraw/zinc/03/50/02/982035002.db2.gz PYXYPBAPNUVEPI-LBPRGKRZSA-N 1 2 248.326 2.042 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1cc(C)cc(C)c1O ZINC001586941497 982035012 /nfs/dbraw/zinc/03/50/12/982035012.db2.gz PYXYPBAPNUVEPI-LBPRGKRZSA-N 1 2 248.326 2.042 20 0 BEADLO CCC[C@@H]1CCCN1C(=O)CCc1[nH+]ccn1C ZINC001350814302 982093463 /nfs/dbraw/zinc/09/34/63/982093463.db2.gz JOHMJVOUENQCEH-GFCCVEGCSA-N 1 2 249.358 2.144 20 0 BEADLO CC(C)[C@@H](O)Cn1c[nH+]c(C(C)(C)C)c1 ZINC001350876425 982111378 /nfs/dbraw/zinc/11/13/78/982111378.db2.gz MCYZMQSMZUOHBB-JTQLQIEISA-N 1 2 210.321 2.198 20 0 BEADLO CC(C)[C@H](O)Cn1c[nH+]c(C(C)(C)C)c1 ZINC001350876426 982111828 /nfs/dbraw/zinc/11/18/28/982111828.db2.gz MCYZMQSMZUOHBB-SNVBAGLBSA-N 1 2 210.321 2.198 20 0 BEADLO CCNC(=S)Nc1cccn2c(C)c(C)[nH+]c12 ZINC001195314223 982195883 /nfs/dbraw/zinc/19/58/83/982195883.db2.gz NDWKGPJEZSVODH-UHFFFAOYSA-N 1 2 248.355 2.257 20 0 BEADLO Cc1ccccc1N(C)C(=O)[C@H](C)n1cc[nH+]c1 ZINC001351279671 982262683 /nfs/dbraw/zinc/26/26/83/982262683.db2.gz QSNBZGJHCLGART-LBPRGKRZSA-N 1 2 243.310 2.416 20 0 BEADLO Cc1cc(-c2cc[nH+]c(N)c2)cnc1F ZINC001241162106 982300479 /nfs/dbraw/zinc/30/04/79/982300479.db2.gz BVXQEAABBOXNLZ-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO COC(=O)c1cc(-c2cc[nH+]c(N)c2)ccc1C ZINC001241162076 982300589 /nfs/dbraw/zinc/30/05/89/982300589.db2.gz BMYSLTWOLSEMET-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO COC(=O)c1cccc(C)c1-c1cc[nH+]c(N)c1 ZINC001241162950 982301877 /nfs/dbraw/zinc/30/18/77/982301877.db2.gz PFVLSHDPEXRDGD-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO Cc1nc2ncc(-c3cc[nH+]c(N)c3)cc2o1 ZINC001241162209 982302683 /nfs/dbraw/zinc/30/26/83/982302683.db2.gz GRNLEUVFZJZSBP-UHFFFAOYSA-N 1 2 226.239 2.175 20 0 BEADLO COc1ccc(-c2cc[nH+]c(N)c2)c(C)n1 ZINC001241162734 982302708 /nfs/dbraw/zinc/30/27/08/982302708.db2.gz KOBOPOQSHVVRCH-UHFFFAOYSA-N 1 2 215.256 2.043 20 0 BEADLO COC(=O)c1c(C)cccc1-c1cc[nH+]c(N)c1 ZINC001241162010 982304860 /nfs/dbraw/zinc/30/48/60/982304860.db2.gz AHUHTQRGPQODLG-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO COC(=O)c1cc(C)ccc1-c1cc[nH+]c(N)c1 ZINC001241169605 982312680 /nfs/dbraw/zinc/31/26/80/982312680.db2.gz HTUUCPKNPKWMJH-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO Nc1cc(-c2cccc3c2CCC(=O)N3)cc[nH+]1 ZINC001241170544 982320172 /nfs/dbraw/zinc/32/01/72/982320172.db2.gz NEKCXQWWYKOQEL-UHFFFAOYSA-N 1 2 239.278 2.216 20 0 BEADLO CCOc1ncc(-c2cc[nH+]c(N)c2)cc1OC ZINC001241175880 982327887 /nfs/dbraw/zinc/32/78/87/982327887.db2.gz PJRWTLRYMQVMQG-UHFFFAOYSA-N 1 2 245.282 2.133 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1ccc(N)cn1 ZINC001241228873 982379334 /nfs/dbraw/zinc/37/93/34/982379334.db2.gz VEPAUWBVXDLMIH-UHFFFAOYSA-N 1 2 228.299 2.100 20 0 BEADLO Cc1ccnnc1-c1c[nH+]c(N(C)C)cc1C ZINC001241229164 982379801 /nfs/dbraw/zinc/37/98/01/982379801.db2.gz YXTOJMZRWGLDFJ-UHFFFAOYSA-N 1 2 228.299 2.221 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1ccc(F)nn1 ZINC001241233912 982386197 /nfs/dbraw/zinc/38/61/97/982386197.db2.gz WBUHJYRCBVAXCT-UHFFFAOYSA-N 1 2 232.262 2.052 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H](C)[C@@H]2CCCO2)[nH+]1 ZINC000080778722 982497576 /nfs/dbraw/zinc/49/75/76/982497576.db2.gz HSRWKXUCQSVULA-KWQFWETISA-N 1 2 246.314 2.246 20 0 BEADLO Cc1cc(NC(=O)Cn2cc[nH+]c2)ccc1Cl ZINC001300095099 982562564 /nfs/dbraw/zinc/56/25/64/982562564.db2.gz JCUBGZCGSCTAQD-UHFFFAOYSA-N 1 2 249.701 2.484 20 0 BEADLO Cn1ncc2cc(-c3ccc[nH+]c3N)ccc21 ZINC001241438560 982590515 /nfs/dbraw/zinc/59/05/15/982590515.db2.gz OPARGDJXKXVFFX-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cccc2cnn(C)c21 ZINC001241457717 982612376 /nfs/dbraw/zinc/61/23/76/982612376.db2.gz WQSBBFMJHLVFOL-DXNUHORPSA-N 1 2 213.284 2.449 20 0 BEADLO Cn1ncc2cccc(-c3cc[nH+]c(N)c3)c21 ZINC001241456959 982613273 /nfs/dbraw/zinc/61/32/73/982613273.db2.gz OUDSDJSUKUSPCS-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO Cc1ccc(-c2ccc3c(c2)NCCO3)[nH+]c1N ZINC001241468472 982623261 /nfs/dbraw/zinc/62/32/61/982623261.db2.gz MNABDIGAAWIKQA-UHFFFAOYSA-N 1 2 241.294 2.444 20 0 BEADLO Cc1ccc(-c2ccc([S@@](C)=O)cc2)[nH+]c1N ZINC001241481217 982634025 /nfs/dbraw/zinc/63/40/25/982634025.db2.gz UNHPGONIDDSSRK-QGZVFWFLSA-N 1 2 246.335 2.377 20 0 BEADLO Cc1ccc(-c2cccc(CO)c2)[nH+]c1N ZINC001241509582 982667642 /nfs/dbraw/zinc/66/76/42/982667642.db2.gz XIWNVDJQQOFXIA-UHFFFAOYSA-N 1 2 214.268 2.132 20 0 BEADLO Cc1ccc2n[nH]cc2c1-c1c[nH+]cn1C ZINC001241520297 982685907 /nfs/dbraw/zinc/68/59/07/982685907.db2.gz KVKNTMFQQWANHW-UHFFFAOYSA-N 1 2 212.256 2.272 20 0 BEADLO CC[C@@H](O)CNc1cccc(Cn2cc[nH+]c2)c1 ZINC001251787629 982691871 /nfs/dbraw/zinc/69/18/71/982691871.db2.gz BABHPBNQDCAJGW-CQSZACIVSA-N 1 2 245.326 2.114 20 0 BEADLO Cc1cc(N(C)C)nc(-c2ccc(N)cc2)[nH+]1 ZINC001241539225 982712642 /nfs/dbraw/zinc/71/26/42/982712642.db2.gz RVYMKWQOFUYRHJ-UHFFFAOYSA-N 1 2 228.299 2.100 20 0 BEADLO OCc1ccc(-c2nc3[nH]ccc3c[nH+]2)cc1 ZINC001241553509 982769857 /nfs/dbraw/zinc/76/98/57/982769857.db2.gz BMKSHDAJYDGKMA-UHFFFAOYSA-N 1 2 225.251 2.069 20 0 BEADLO Cc1ccc(-c2ccc(CO)cc2)[nH+]c1N ZINC001241556140 982776327 /nfs/dbraw/zinc/77/63/27/982776327.db2.gz LZVBQJJAAFDTMP-UHFFFAOYSA-N 1 2 214.268 2.132 20 0 BEADLO C[C@@H]1CCC(F)(F)C[N@@H+]1CCC1(O)CCC1 ZINC001198642483 982816103 /nfs/dbraw/zinc/81/61/03/982816103.db2.gz ZRIONOQOLUWYSZ-SNVBAGLBSA-N 1 2 233.302 2.411 20 0 BEADLO C[C@@H]1CCC(F)(F)C[N@H+]1CCC1(O)CCC1 ZINC001198642483 982816104 /nfs/dbraw/zinc/81/61/04/982816104.db2.gz ZRIONOQOLUWYSZ-SNVBAGLBSA-N 1 2 233.302 2.411 20 0 BEADLO CSc1ncc(/C(C)=C/C=C/[NH3+])cn1 ZINC001241627461 982865060 /nfs/dbraw/zinc/86/50/60/982865060.db2.gz LHJOIUMGNFRZNM-MSLMYCKWSA-N 1 2 207.302 2.074 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N[C@@H]2C=CCCC2)c[nH+]1 ZINC001353625904 982935885 /nfs/dbraw/zinc/93/58/85/982935885.db2.gz BZROLXPTPPDOSE-GFCCVEGCSA-N 1 2 247.342 2.152 20 0 BEADLO Cc1ccc(-c2ccc3[nH]nc(N)c3c2)[nH+]c1N ZINC001241711757 982969133 /nfs/dbraw/zinc/96/91/33/982969133.db2.gz KLNSQGCGEXLMSX-UHFFFAOYSA-N 1 2 239.282 2.098 20 0 BEADLO O=C(NCc1c[nH+]cn1C1CCC1)C1=CC=CC1 ZINC001199700132 983004057 /nfs/dbraw/zinc/00/40/57/983004057.db2.gz GBUBXOFSUNXURY-UHFFFAOYSA-N 1 2 243.310 2.111 20 0 BEADLO CNc1cc(-c2ccc3[nH]nc(N)c3c2)cc[nH+]1 ZINC001241729121 983015406 /nfs/dbraw/zinc/01/54/06/983015406.db2.gz HYCVWZRNUDFBMC-UHFFFAOYSA-N 1 2 239.282 2.249 20 0 BEADLO CC(C)(C)NC(=S)Nc1cc[nH+]c2c1CCC2 ZINC001200897559 983109677 /nfs/dbraw/zinc/10/96/77/983109677.db2.gz UTFHMQBTLYJUHF-UHFFFAOYSA-N 1 2 249.383 2.077 20 0 BEADLO CCc1ccc(N(C)Cc2cnn(C)c2)[nH+]c1 ZINC001354061968 983130983 /nfs/dbraw/zinc/13/09/83/983130983.db2.gz RWMUQCAHRLNBNB-UHFFFAOYSA-N 1 2 230.315 2.014 20 0 BEADLO COc1ccc(-c2ccc(C)c(N)[nH+]2)cc1CO ZINC001241927572 983144348 /nfs/dbraw/zinc/14/43/48/983144348.db2.gz GFINLNOXNPBMBH-UHFFFAOYSA-N 1 2 244.294 2.140 20 0 BEADLO COc1ccc(/C(C)=C/C=C/[NH3+])cc1CO ZINC001241929549 983147095 /nfs/dbraw/zinc/14/70/95/983147095.db2.gz MMNXVBLONUGYJV-DROBUMMNSA-N 1 2 219.284 2.063 20 0 BEADLO CCN(C)c1ccc(Nc2ccc(N)[nH+]c2)cn1 ZINC001201280032 983158520 /nfs/dbraw/zinc/15/85/20/983158520.db2.gz XVMVJFISTPAXHY-UHFFFAOYSA-N 1 2 243.314 2.259 20 0 BEADLO Nc1ccc(-n2ccc3c2cccc3N)c[nH+]1 ZINC001201285711 983161438 /nfs/dbraw/zinc/16/14/38/983161438.db2.gz NDYBDULADDXFKW-UHFFFAOYSA-N 1 2 224.267 2.190 20 0 BEADLO Nc1ccc(Nc2cccc(F)c2O)c[nH+]1 ZINC001201285842 983161464 /nfs/dbraw/zinc/16/14/64/983161464.db2.gz QSAUVHDTSLQJES-UHFFFAOYSA-N 1 2 219.219 2.252 20 0 BEADLO c1[nH+]cn2cccc(-c3ccc4[nH]nnc4c3)c12 ZINC001241942911 983164187 /nfs/dbraw/zinc/16/41/87/983164187.db2.gz SRCLJZAHKVSIHL-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO Nc1ccc(Nc2ccc3oc(=O)[nH]c3c2)c[nH+]1 ZINC001201292021 983168055 /nfs/dbraw/zinc/16/80/55/983168055.db2.gz UJXQMXNBGYEISY-UHFFFAOYSA-N 1 2 242.238 2.254 20 0 BEADLO Nc1ccc(-n2ccc3cccc(N)c32)c[nH+]1 ZINC001201292347 983169987 /nfs/dbraw/zinc/16/99/87/983169987.db2.gz WAJGIKAKYDOFGO-UHFFFAOYSA-N 1 2 224.267 2.190 20 0 BEADLO Cc1c(F)ccc(N)c1Nc1ccc(N)[nH+]c1 ZINC001201292376 983170393 /nfs/dbraw/zinc/17/03/93/983170393.db2.gz WSBYTAIHRPHEOD-UHFFFAOYSA-N 1 2 232.262 2.437 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cccc(N2CCOCC2)c1 ZINC001241958326 983172243 /nfs/dbraw/zinc/17/22/43/983172243.db2.gz AHZJBCPBZYNHOV-MVXHYVOWSA-N 1 2 244.338 2.399 20 0 BEADLO Cc1cc(Nc2ccc(N)[nH+]c2)n(C(C)C)n1 ZINC001201272599 983172386 /nfs/dbraw/zinc/17/23/86/983172386.db2.gz RGHGZSXHRMOOLO-UHFFFAOYSA-N 1 2 231.303 2.493 20 0 BEADLO CCOCCN(C)c1cc(F)cc(C)[nH+]1 ZINC001354150717 983173616 /nfs/dbraw/zinc/17/36/16/983173616.db2.gz FDGRPNZSHZEXMF-UHFFFAOYSA-N 1 2 212.268 2.002 20 0 BEADLO CC(=O)c1cccnc1Nc1ccc(N)[nH+]c1 ZINC001201272775 983173889 /nfs/dbraw/zinc/17/38/89/983173889.db2.gz UYKFDSXHRBOVAP-UHFFFAOYSA-N 1 2 228.255 2.005 20 0 BEADLO CC(=O)N1CC=C(c2cc(C)[nH+]c(C)c2)CC1 ZINC001241967929 983176854 /nfs/dbraw/zinc/17/68/54/983176854.db2.gz DMDCILHNAGMUAU-UHFFFAOYSA-N 1 2 230.311 2.334 20 0 BEADLO CCOc1ccc(Nc2ccc(N)[nH+]c2)cn1 ZINC001201276633 983177557 /nfs/dbraw/zinc/17/75/57/983177557.db2.gz YXWXQDUYRWAQDC-UHFFFAOYSA-N 1 2 230.271 2.201 20 0 BEADLO C[C@H]1C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc21 ZINC001242015398 983212428 /nfs/dbraw/zinc/21/24/28/983212428.db2.gz GHRWESFUXSZGIX-SSDOTTSWSA-N 1 2 213.240 2.132 20 0 BEADLO Cc1ccc(N[C@H]2C[C@H](C)n3ncnc32)c(C)[nH+]1 ZINC001354234744 983213466 /nfs/dbraw/zinc/21/34/66/983213466.db2.gz JCMUDJLMFRVCED-CABZTGNLSA-N 1 2 243.314 2.408 20 0 BEADLO CC1(c2ccc(-c3[nH]cc[nH+]3)cc2)COC1 ZINC001242018035 983217208 /nfs/dbraw/zinc/21/72/08/983217208.db2.gz BWWAXEFFAYVOPN-UHFFFAOYSA-N 1 2 214.268 2.365 20 0 BEADLO Cc1cc(N(C)C)ccc1-c1[nH]cc[nH+]1 ZINC001242018704 983220388 /nfs/dbraw/zinc/22/03/88/983220388.db2.gz PCZJGDQZTIUWSQ-UHFFFAOYSA-N 1 2 201.273 2.451 20 0 BEADLO c1c[nH+]c(-c2ccc3c(c2)OCCCO3)[nH]1 ZINC001242018600 983220881 /nfs/dbraw/zinc/22/08/81/983220881.db2.gz RZUOTXHKDSRLSZ-UHFFFAOYSA-N 1 2 216.240 2.238 20 0 BEADLO COC(=O)/C=C\c1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001242019646 983226461 /nfs/dbraw/zinc/22/64/61/983226461.db2.gz IEOVCXGXACHJQE-DAXSKMNVSA-N 1 2 228.251 2.263 20 0 BEADLO CC(C)C[N@@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001201478302 983281728 /nfs/dbraw/zinc/28/17/28/983281728.db2.gz GCVCXAVJQDXZCG-UHFFFAOYSA-N 1 2 249.358 2.206 20 0 BEADLO CC(C)C[N@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001201478302 983281732 /nfs/dbraw/zinc/28/17/32/983281732.db2.gz GCVCXAVJQDXZCG-UHFFFAOYSA-N 1 2 249.358 2.206 20 0 BEADLO COc1cc2[nH+]ccn2cc1-c1ccc(=O)[nH]c1 ZINC001242064978 983288057 /nfs/dbraw/zinc/28/80/57/983288057.db2.gz CPEJDCRRGQUBDQ-UHFFFAOYSA-N 1 2 241.250 2.111 20 0 BEADLO O=c1ccc(-c2ccc3[nH+]ccn3c2)c[nH]1 ZINC001242065666 983290447 /nfs/dbraw/zinc/29/04/47/983290447.db2.gz WNDCARHUSRWTHH-UHFFFAOYSA-N 1 2 211.224 2.102 20 0 BEADLO CNc1ccc(-c2ccn3cc[nH+]c3c2)cn1 ZINC001242069001 983298945 /nfs/dbraw/zinc/29/89/45/983298945.db2.gz AHBFKUQRYXWJCB-UHFFFAOYSA-N 1 2 224.267 2.438 20 0 BEADLO COc1ccnc(-c2c[nH+]c(N)cc2C)c1F ZINC001242078062 983325659 /nfs/dbraw/zinc/32/56/59/983325659.db2.gz QRIHPXLQXOSHBY-UHFFFAOYSA-N 1 2 233.246 2.182 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1nnc(C)c(C)c1C ZINC001242077639 983325898 /nfs/dbraw/zinc/32/58/98/983325898.db2.gz HJTXSJKHCOKRPF-UHFFFAOYSA-N 1 2 228.299 2.354 20 0 BEADLO F[C@@H]1C[NH+](CCc2ccccc2)C[C@H]1F ZINC001201596154 983328017 /nfs/dbraw/zinc/32/80/17/983328017.db2.gz WIHOJUSRMXIEJB-VXGBXAGGSA-N 1 2 211.255 2.221 20 0 BEADLO CCN1CC[C@@H]([NH+]2CCCCC2)C(F)(F)C1 ZINC001201590029 983355806 /nfs/dbraw/zinc/35/58/06/983355806.db2.gz IDMWYLWWSWBEDG-LLVKDONJSA-N 1 2 232.318 2.202 20 0 BEADLO C[N@H+]1CCC[C@@H]2C[NH+](CCc3ccccc3)C[C@H]21 ZINC001201606094 983372847 /nfs/dbraw/zinc/37/28/47/983372847.db2.gz IJZYYHDXBSEGEN-HZPDHXFCSA-N 1 2 244.382 2.255 20 0 BEADLO C[NH+]1CCC[C@@H]2C[N@H+](CCc3ccccc3)C[C@H]21 ZINC001201606094 983372855 /nfs/dbraw/zinc/37/28/55/983372855.db2.gz IJZYYHDXBSEGEN-HZPDHXFCSA-N 1 2 244.382 2.255 20 0 BEADLO Cc1cn2cccc(Nc3cncc(O)c3)c2[nH+]1 ZINC001201628499 983385002 /nfs/dbraw/zinc/38/50/02/983385002.db2.gz LXMKAGTYZSFOSP-UHFFFAOYSA-N 1 2 240.266 2.487 20 0 BEADLO Nc1cc(-c2ccc(F)cc2O)cc[nH+]1 ZINC001242220508 983422026 /nfs/dbraw/zinc/42/20/26/983422026.db2.gz BDFSOTDDZBTXOP-UHFFFAOYSA-N 1 2 204.204 2.176 20 0 BEADLO CCCCC[N@@H+]1CCC[C@@H](F)C(=O)C1 ZINC001201725889 983434126 /nfs/dbraw/zinc/43/41/26/983434126.db2.gz VNPFPUNVPWTPHD-SNVBAGLBSA-N 1 2 201.285 2.180 20 0 BEADLO CCCCC[N@H+]1CCC[C@@H](F)C(=O)C1 ZINC001201725889 983434136 /nfs/dbraw/zinc/43/41/36/983434136.db2.gz VNPFPUNVPWTPHD-SNVBAGLBSA-N 1 2 201.285 2.180 20 0 BEADLO CCCCC[N@@H+]1C[C@@H](CO)CC(F)(F)C1 ZINC001201725995 983432392 /nfs/dbraw/zinc/43/23/92/983432392.db2.gz XABFIDSXENTETL-JTQLQIEISA-N 1 2 221.291 2.126 20 0 BEADLO CCCCC[N@H+]1C[C@@H](CO)CC(F)(F)C1 ZINC001201725995 983432394 /nfs/dbraw/zinc/43/23/94/983432394.db2.gz XABFIDSXENTETL-JTQLQIEISA-N 1 2 221.291 2.126 20 0 BEADLO CCc1cc(N[C@H]2C[C@@H](COC)C2)nc(CC)[nH+]1 ZINC001355335740 983473283 /nfs/dbraw/zinc/47/32/83/983473283.db2.gz SLPWIQLPUSZUAR-KLPPZKSPSA-N 1 2 249.358 2.438 20 0 BEADLO F[C@H]1CCC[N@H+](CC2CC2)CC1(F)F ZINC001201875890 983502552 /nfs/dbraw/zinc/50/25/52/983502552.db2.gz NCLFQZKDMAUBMQ-VIFPVBQESA-N 1 2 207.239 2.466 20 0 BEADLO F[C@H]1CCC[N@@H+](CC2CC2)CC1(F)F ZINC001201875890 983502554 /nfs/dbraw/zinc/50/25/54/983502554.db2.gz NCLFQZKDMAUBMQ-VIFPVBQESA-N 1 2 207.239 2.466 20 0 BEADLO c1ccc(C[N@@H+]2C[C@H]3C[C@@H](C2)N3CC2CC2)cc1 ZINC001201952366 983524277 /nfs/dbraw/zinc/52/42/77/983524277.db2.gz NTSZUSFSOQEAHX-IYBDPMFKSA-N 1 2 242.366 2.355 20 0 BEADLO Nc1[nH+]cccc1-c1cccc(F)c1O ZINC001242351062 983621168 /nfs/dbraw/zinc/62/11/68/983621168.db2.gz OCYSQUCQNIQXMB-UHFFFAOYSA-N 1 2 204.204 2.176 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc(C)c(CO)c1 ZINC001242383757 983673240 /nfs/dbraw/zinc/67/32/40/983673240.db2.gz DWSQMBLPCUWHLG-DROBUMMNSA-N 1 2 203.285 2.363 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(OC(F)F)nc1 ZINC001242419272 983727256 /nfs/dbraw/zinc/72/72/56/983727256.db2.gz HVGVEBHROURSBC-UHFFFAOYSA-N 1 2 225.198 2.084 20 0 BEADLO COc1cc(-c2c[nH+]c(N)c(C)c2)c(OC)cn1 ZINC001242427255 983729950 /nfs/dbraw/zinc/72/99/50/983729950.db2.gz DTZWTWZBTRMUMZ-UHFFFAOYSA-N 1 2 245.282 2.051 20 0 BEADLO C[C@@H](O)c1cccc(-c2ccc[nH+]c2N)c1 ZINC001242551393 983872573 /nfs/dbraw/zinc/87/25/73/983872573.db2.gz XRYIYASLMWECAS-SECBINFHSA-N 1 2 214.268 2.384 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CCCC(=O)[C@H](C)C2)cn1 ZINC001137073227 983906644 /nfs/dbraw/zinc/90/66/44/983906644.db2.gz VGILEPRWSOPZQL-GFCCVEGCSA-N 1 2 249.358 2.265 20 0 BEADLO CC(C)n1cc(C[N@H+]2CCCC(=O)[C@H](C)C2)cn1 ZINC001137073227 983906652 /nfs/dbraw/zinc/90/66/52/983906652.db2.gz VGILEPRWSOPZQL-GFCCVEGCSA-N 1 2 249.358 2.265 20 0 BEADLO CC(C)n1cc(C[N@H+]2CCC(=O)[C@@H](C)CC2)cn1 ZINC001137072865 983907336 /nfs/dbraw/zinc/90/73/36/983907336.db2.gz KZDPWESGSJZQRF-LBPRGKRZSA-N 1 2 249.358 2.265 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CCC(=O)[C@@H](C)CC2)cn1 ZINC001137072865 983907348 /nfs/dbraw/zinc/90/73/48/983907348.db2.gz KZDPWESGSJZQRF-LBPRGKRZSA-N 1 2 249.358 2.265 20 0 BEADLO CCc1cn(CC(=O)COc2ccccc2)c[nH+]1 ZINC001559466128 983923412 /nfs/dbraw/zinc/92/34/12/983923412.db2.gz LRPDODYOUKQIGK-UHFFFAOYSA-N 1 2 244.294 2.094 20 0 BEADLO OC[C@H]1CCC[N@@H+]1Cc1cc(F)cc(F)c1F ZINC001137868671 983934509 /nfs/dbraw/zinc/93/45/09/983934509.db2.gz NMOVMINOYQRRTP-SNVBAGLBSA-N 1 2 245.244 2.061 20 0 BEADLO OC[C@H]1CCC[N@H+]1Cc1cc(F)cc(F)c1F ZINC001137868671 983934518 /nfs/dbraw/zinc/93/45/18/983934518.db2.gz NMOVMINOYQRRTP-SNVBAGLBSA-N 1 2 245.244 2.061 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CCC[C@H]1C(C)(C)C ZINC001137101234 983942786 /nfs/dbraw/zinc/94/27/86/983942786.db2.gz FHFIKXUAUIZEGW-LBPRGKRZSA-N 1 2 249.358 2.298 20 0 BEADLO Cc1oncc1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001242601252 983948860 /nfs/dbraw/zinc/94/88/60/983948860.db2.gz QSTZZMBZOVPSRN-UHFFFAOYSA-N 1 2 240.266 2.290 20 0 BEADLO Cc1oncc1-c1c[nH+]c2c(c1)CCCN2 ZINC001242603880 983958471 /nfs/dbraw/zinc/95/84/71/983958471.db2.gz DBAGWZKZWCRJEO-UHFFFAOYSA-N 1 2 215.256 2.046 20 0 BEADLO Nc1[nH+]cccc1-c1cncc(N2CCCC2)c1 ZINC001242620608 984006350 /nfs/dbraw/zinc/00/63/50/984006350.db2.gz ICWFJCPMROZDDB-UHFFFAOYSA-N 1 2 240.310 2.326 20 0 BEADLO O=c1cccc(Nc2cccn3cc[nH+]c23)[nH]1 ZINC001212787192 984016893 /nfs/dbraw/zinc/01/68/93/984016893.db2.gz OQVBYLMCOXWZEV-UHFFFAOYSA-N 1 2 226.239 2.179 20 0 BEADLO Cc1nc2c(s1)C[N@H+](Cc1ccc[nH]1)CC2 ZINC001204010398 984167429 /nfs/dbraw/zinc/16/74/29/984167429.db2.gz POSNZKZKLSFVPB-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1nc2c(s1)C[N@@H+](Cc1ccc[nH]1)CC2 ZINC001204010398 984167435 /nfs/dbraw/zinc/16/74/35/984167435.db2.gz POSNZKZKLSFVPB-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO c1ccc(C[NH+]2CC(OC[C@@H]3CCCO3)C2)cc1 ZINC001205984466 984217306 /nfs/dbraw/zinc/21/73/06/984217306.db2.gz HQLKKZKRKRBVQB-AWEZNQCLSA-N 1 2 247.338 2.066 20 0 BEADLO COc1ncc(-c2cc[nH+]c(N)c2)cc1Cl ZINC001242932404 984305422 /nfs/dbraw/zinc/30/54/22/984305422.db2.gz YOFMUAJGBTZQKQ-UHFFFAOYSA-N 1 2 235.674 2.388 20 0 BEADLO CC(=O)Nc1ccc(C)c(-c2c[nH+]cn2C)c1 ZINC001243066508 984477250 /nfs/dbraw/zinc/47/72/50/984477250.db2.gz HSLSEKMFOAUOPQ-UHFFFAOYSA-N 1 2 229.283 2.354 20 0 BEADLO CCOc1ncc(-c2c[nH+]cn2C)cc1C ZINC001243067182 984480422 /nfs/dbraw/zinc/48/04/22/984480422.db2.gz GPKAXVADHVXOGF-UHFFFAOYSA-N 1 2 217.272 2.189 20 0 BEADLO CC(=O)Nc1ccc(-c2c[nH+]cn2C)cc1F ZINC001243066442 984480563 /nfs/dbraw/zinc/48/05/63/984480563.db2.gz FMVBKMMGYHPEEV-UHFFFAOYSA-N 1 2 233.246 2.185 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(-c2nnco2)cc1 ZINC001243068572 984487976 /nfs/dbraw/zinc/48/79/76/984487976.db2.gz FCKBLIRJGKYLAL-UHFFFAOYSA-N 1 2 226.239 2.137 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(N2CCCC2=O)cc1 ZINC001243069149 984490957 /nfs/dbraw/zinc/49/09/57/984490957.db2.gz QBWHVUIVYXHDHU-UHFFFAOYSA-N 1 2 241.294 2.214 20 0 BEADLO Cn1c[nH+]cc1-c1ccnc(OCC2CC2)c1 ZINC001243069839 984492504 /nfs/dbraw/zinc/49/25/04/984492504.db2.gz MJDGHWFQDWJLQS-UHFFFAOYSA-N 1 2 229.283 2.271 20 0 BEADLO COC(=O)c1ccc(F)cc1-c1ccc[nH+]c1N ZINC001243119364 984586288 /nfs/dbraw/zinc/58/62/88/984586288.db2.gz JPOZHOHVIPICJE-UHFFFAOYSA-N 1 2 246.241 2.257 20 0 BEADLO CC(C)[C@@H]1CCCCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC001446897791 984705398 /nfs/dbraw/zinc/70/53/98/984705398.db2.gz UYEZPPRAIBWYCZ-LBPRGKRZSA-N 1 2 249.358 2.379 20 0 BEADLO CC(=O)Oc1ccc(-c2c[nH+]cn2C)cc1 ZINC001243365715 984845936 /nfs/dbraw/zinc/84/59/36/984845936.db2.gz XIWAUXFUEKGTAA-UHFFFAOYSA-N 1 2 216.240 2.012 20 0 BEADLO CC(C)c1coc(NC(=O)CCn2cc[nH+]c2)n1 ZINC001449904157 984849437 /nfs/dbraw/zinc/84/94/37/984849437.db2.gz PXZOFCLTONWIDP-UHFFFAOYSA-N 1 2 248.286 2.023 20 0 BEADLO Cc1cn2c(cccc2-c2cc[nH]c(=O)c2)[nH+]1 ZINC001243425698 984899396 /nfs/dbraw/zinc/89/93/96/984899396.db2.gz RRIKKEWKVGLLFZ-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO Nc1cn2ccc(-c3ccc(F)c(N)c3)cc2[nH+]1 ZINC001243454509 984960847 /nfs/dbraw/zinc/96/08/47/984960847.db2.gz VIOWPBVEMCIWRX-UHFFFAOYSA-N 1 2 242.257 2.305 20 0 BEADLO Cc1cc(-c2ccc[nH+]c2N)cc(F)n1 ZINC001243472657 985017291 /nfs/dbraw/zinc/01/72/91/985017291.db2.gz LVTZUCSZWOLLOD-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2[nH]c(=S)[nH]c2c1 ZINC001243472978 985018796 /nfs/dbraw/zinc/01/87/96/985018796.db2.gz DGOWSXCMQSYXEJ-UHFFFAOYSA-N 1 2 242.307 2.496 20 0 BEADLO COC(=O)Cc1ccccc1-c1ccc[nH+]c1N ZINC001243474107 985023599 /nfs/dbraw/zinc/02/35/99/985023599.db2.gz JXHYTWGQHUWKTR-UHFFFAOYSA-N 1 2 242.278 2.046 20 0 BEADLO Cc1nc2ncc(-c3ccc[nH+]c3N)cc2o1 ZINC001243473466 985025099 /nfs/dbraw/zinc/02/50/99/985025099.db2.gz BCRVBVJYANWGFG-UHFFFAOYSA-N 1 2 226.239 2.175 20 0 BEADLO Nc1[nH+]cccc1-c1cccc2c1COC2=O ZINC001243474313 985025672 /nfs/dbraw/zinc/02/56/72/985025672.db2.gz KJFZTDWSKCYJAE-UHFFFAOYSA-N 1 2 226.235 2.001 20 0 BEADLO Nc1[nH+]cccc1-c1cc(F)nc(F)c1 ZINC001243476418 985027935 /nfs/dbraw/zinc/02/79/35/985027935.db2.gz RRWFOYGPNMJJER-UHFFFAOYSA-N 1 2 207.183 2.004 20 0 BEADLO Cc1c(F)nccc1-c1ccc[nH+]c1N ZINC001243475393 985028121 /nfs/dbraw/zinc/02/81/21/985028121.db2.gz GROZPOKBHWHTSL-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2c(c1)COC2=O ZINC001243475334 985031073 /nfs/dbraw/zinc/03/10/73/985031073.db2.gz VNCXZGLGYNHKHZ-UHFFFAOYSA-N 1 2 226.235 2.001 20 0 BEADLO COc1cc(-c2ccc[nH+]c2N)cnc1C ZINC001243474732 985032262 /nfs/dbraw/zinc/03/22/62/985032262.db2.gz QCEGNXDMADCGCH-UHFFFAOYSA-N 1 2 215.256 2.043 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2c(c1)NCC2 ZINC001243476311 985032862 /nfs/dbraw/zinc/03/28/62/985032862.db2.gz AXMGYBAMBUTFEF-UHFFFAOYSA-N 1 2 211.268 2.299 20 0 BEADLO CSc1cnccc1-c1ccc[nH+]c1N ZINC001243477337 985034279 /nfs/dbraw/zinc/03/42/79/985034279.db2.gz KSSGEUDTTCLNIA-UHFFFAOYSA-N 1 2 217.297 2.448 20 0 BEADLO CC1(C)CNc2cc(-c3ccc[nH+]c3N)cnc21 ZINC001243477360 985038689 /nfs/dbraw/zinc/03/86/89/985038689.db2.gz LLWYOXADZMXIFB-UHFFFAOYSA-N 1 2 240.310 2.429 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@H]2CCC[C@H](C)C2)c[nH+]1 ZINC001456143522 985115897 /nfs/dbraw/zinc/11/58/97/985115897.db2.gz RXYRLEYPICOYRS-QWRGUYRKSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@H]2CCC[C@H](C)C2)[nH+]1 ZINC001456143522 985115907 /nfs/dbraw/zinc/11/59/07/985115907.db2.gz RXYRLEYPICOYRS-QWRGUYRKSA-N 1 2 249.358 2.415 20 0 BEADLO CC=CC=CC(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001456345234 985134469 /nfs/dbraw/zinc/13/44/69/985134469.db2.gz KDWAJXOCWPJMBG-YTXTXJHMSA-N 1 2 233.315 2.282 20 0 BEADLO CC=CC=CC(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001456345234 985134475 /nfs/dbraw/zinc/13/44/75/985134475.db2.gz KDWAJXOCWPJMBG-YTXTXJHMSA-N 1 2 233.315 2.282 20 0 BEADLO c1cn(Cc2ccc(-c3cccnn3)cc2)c[nH+]1 ZINC001243656020 985156547 /nfs/dbraw/zinc/15/65/47/985156547.db2.gz AHTDDFSQZWEPJQ-UHFFFAOYSA-N 1 2 236.278 2.388 20 0 BEADLO O=C(NCC=CCl)c1cc2c[nH+]ccc2[nH]1 ZINC001456879093 985172460 /nfs/dbraw/zinc/17/24/60/985172460.db2.gz DLQUMFNNAYDERJ-HNQUOIGGSA-N 1 2 235.674 2.045 20 0 BEADLO Cc1cc(CO)cc(-c2c[nH+]c(N)c(C)c2)c1 ZINC001243701129 985237100 /nfs/dbraw/zinc/23/71/00/985237100.db2.gz LOUASJKQBYDYNO-UHFFFAOYSA-N 1 2 228.295 2.440 20 0 BEADLO Cc1cc(F)ncc1-c1ccn2cc(N)[nH+]c2c1 ZINC001243756632 985286217 /nfs/dbraw/zinc/28/62/17/985286217.db2.gz MLMQHEJCHKFBQE-UHFFFAOYSA-N 1 2 242.257 2.426 20 0 BEADLO CCc1cn(CC(=O)c2ccsc2)c[nH+]1 ZINC001459257639 985422349 /nfs/dbraw/zinc/42/23/49/985422349.db2.gz ASQVSCPXHMCKFV-UHFFFAOYSA-N 1 2 220.297 2.390 20 0 BEADLO CSc1nc(C)cc(C2=C[NH2+]CCC2)n1 ZINC001243947059 985621866 /nfs/dbraw/zinc/62/18/66/985621866.db2.gz CXALFZXTZLDLAD-UHFFFAOYSA-N 1 2 221.329 2.231 20 0 BEADLO c1ccc2nc(C3=C[NH2+]CCC3)cnc2c1 ZINC001243947303 985623740 /nfs/dbraw/zinc/62/37/40/985623740.db2.gz IWCCYFRAZXIISV-UHFFFAOYSA-N 1 2 211.268 2.354 20 0 BEADLO Cc1noc(-c2cccnc2C2=C[NH2+]CCC2)n1 ZINC001243948360 985632220 /nfs/dbraw/zinc/63/22/20/985632220.db2.gz CIDDOBCIBJCQNI-UHFFFAOYSA-N 1 2 242.282 2.164 20 0 BEADLO c1nc2c(c(C3=C[NH2+]CCC3)n1)SCCC2 ZINC001243949433 985636238 /nfs/dbraw/zinc/63/62/38/985636238.db2.gz LCNFMKNJFJJZCC-UHFFFAOYSA-N 1 2 233.340 2.239 20 0 BEADLO c1csc(-c2nccc(C3=C[NH2+]CCC3)n2)n1 ZINC001243949526 985638207 /nfs/dbraw/zinc/63/82/07/985638207.db2.gz LJPGRLKHXWERFP-UHFFFAOYSA-N 1 2 244.323 2.324 20 0 BEADLO Cc1cc(-c2cc(F)nc(F)c2)c[nH+]c1N ZINC001243971487 985696160 /nfs/dbraw/zinc/69/61/60/985696160.db2.gz SUMHJORESMNYLO-UHFFFAOYSA-N 1 2 221.210 2.312 20 0 BEADLO CCCCc1ccc(C[NH+]2CC(O)C2)s1 ZINC001138753539 985813048 /nfs/dbraw/zinc/81/30/48/985813048.db2.gz WFTBRLZVIGZHBO-UHFFFAOYSA-N 1 2 225.357 2.267 20 0 BEADLO Cc1ccc(O)c(Nc2ccc(CCO)cc2)[nH+]1 ZINC001212926550 985930833 /nfs/dbraw/zinc/93/08/33/985930833.db2.gz IXYNOEIFWPTDHE-UHFFFAOYSA-N 1 2 244.294 2.374 20 0 BEADLO COC(=O)c1c(F)cccc1/C(C)=C/C=C/[NH3+] ZINC001244345009 985983727 /nfs/dbraw/zinc/98/37/27/985983727.db2.gz FTJQZIQYLVCQFC-KBXRYBNXSA-N 1 2 235.258 2.488 20 0 BEADLO Cc1ccc(-c2cc[nH+]c(N)c2)c(CO)c1 ZINC001244490083 986194986 /nfs/dbraw/zinc/19/49/86/986194986.db2.gz ZVIYCGBJFQRZPT-UHFFFAOYSA-N 1 2 214.268 2.132 20 0 BEADLO Cc1cc(CO)ccc1-c1ccc[nH+]c1N ZINC001244580863 986263141 /nfs/dbraw/zinc/26/31/41/986263141.db2.gz CUUGREZCHQTTLM-UHFFFAOYSA-N 1 2 214.268 2.132 20 0 BEADLO Cc1cc(CO)ccc1-c1ccc(N)[nH+]c1 ZINC001244581598 986266484 /nfs/dbraw/zinc/26/64/84/986266484.db2.gz NNBDTADCXFIKLB-UHFFFAOYSA-N 1 2 214.268 2.132 20 0 BEADLO Cc1cc(C)c(N)c(-c2c[nH+]cn2C)c1 ZINC001244602095 986277484 /nfs/dbraw/zinc/27/74/84/986277484.db2.gz KUCYUTJXXBXZCU-UHFFFAOYSA-N 1 2 201.273 2.286 20 0 BEADLO CCCNC(=S)Nc1ccc2[nH+]c(C)cn2c1 ZINC001244846600 986394811 /nfs/dbraw/zinc/39/48/11/986394811.db2.gz OECMPZKYOLPJPQ-UHFFFAOYSA-N 1 2 248.355 2.339 20 0 BEADLO CCC[C@@H]([NH2+]CCc1ccc(C)cc1)C(=O)OC ZINC001462619236 986452499 /nfs/dbraw/zinc/45/24/99/986452499.db2.gz OZFSABRNHWDLJT-CQSZACIVSA-N 1 2 249.354 2.469 20 0 BEADLO CNc1cc(-c2ccc3c(c2)C(=O)NC3)cc[nH+]1 ZINC001244973382 986554786 /nfs/dbraw/zinc/55/47/86/986554786.db2.gz OBAOPTGBDPACRF-UHFFFAOYSA-N 1 2 239.278 2.034 20 0 BEADLO Cc1c[nH+]c(CCNc2nccnc2F)c(C)c1 ZINC000689462502 986626623 /nfs/dbraw/zinc/62/66/23/986626623.db2.gz UOAFNAMGLVGURG-UHFFFAOYSA-N 1 2 246.289 2.282 20 0 BEADLO CNc1cc(N2CCC[C@@H](CCF)C2)nc[nH+]1 ZINC000689487152 986664542 /nfs/dbraw/zinc/66/45/42/986664542.db2.gz AJVCZSIXADKNKT-JTQLQIEISA-N 1 2 238.310 2.094 20 0 BEADLO CNc1cc(N2CCC[C@@H](CCF)C2)[nH+]cn1 ZINC000689487152 986664553 /nfs/dbraw/zinc/66/45/53/986664553.db2.gz AJVCZSIXADKNKT-JTQLQIEISA-N 1 2 238.310 2.094 20 0 BEADLO c1cn2c(cccc2C2=CCCOC2)[nH+]1 ZINC001245157533 986684481 /nfs/dbraw/zinc/68/44/81/986684481.db2.gz HRAPNJIRYLBZEY-UHFFFAOYSA-N 1 2 200.241 2.138 20 0 BEADLO Cc1c(CN2CC[C@@H](F)C2)[nH+]c2ccccn12 ZINC001137267672 986703661 /nfs/dbraw/zinc/70/36/61/986703661.db2.gz GJLHGDRIALGLMY-LLVKDONJSA-N 1 2 233.290 2.187 20 0 BEADLO COCn1cc(-c2cccc3[nH+]c(C)cn32)cn1 ZINC001245218545 986735134 /nfs/dbraw/zinc/73/51/34/986735134.db2.gz BXFQVJBVISLFSB-UHFFFAOYSA-N 1 2 242.282 2.110 20 0 BEADLO FC(F)(F)CCNc1cc2cc[nH]c2c[nH+]1 ZINC000381623071 986740002 /nfs/dbraw/zinc/74/00/02/986740002.db2.gz FSOFFQMUNCXARB-UHFFFAOYSA-N 1 2 229.205 2.349 20 0 BEADLO CCOc1cc(-c2ccc(C)c(N)[nH+]2)ccn1 ZINC001245265290 986770840 /nfs/dbraw/zinc/77/08/40/986770840.db2.gz ZZXPSPUCHIFFCJ-UHFFFAOYSA-N 1 2 229.283 2.433 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2[nH]c(C)cc2C)n(C)n1 ZINC001137328086 986781623 /nfs/dbraw/zinc/78/16/23/986781623.db2.gz RMKNKHFXSDHJIO-UHFFFAOYSA-N 1 2 246.358 2.305 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2[nH]c(C)cc2C)n(C)n1 ZINC001137328086 986781635 /nfs/dbraw/zinc/78/16/35/986781635.db2.gz RMKNKHFXSDHJIO-UHFFFAOYSA-N 1 2 246.358 2.305 20 0 BEADLO Fc1ccc2[nH]cc(C[N@H+]3C[C@H]4C[C@@H](C3)O4)c2c1 ZINC001137341324 986804452 /nfs/dbraw/zinc/80/44/52/986804452.db2.gz IESDEVSAUBXDFT-TXEJJXNPSA-N 1 2 246.285 2.280 20 0 BEADLO Fc1ccc2[nH]cc(C[N@@H+]3C[C@H]4C[C@@H](C3)O4)c2c1 ZINC001137341324 986804460 /nfs/dbraw/zinc/80/44/60/986804460.db2.gz IESDEVSAUBXDFT-TXEJJXNPSA-N 1 2 246.285 2.280 20 0 BEADLO Cc1cc(-c2c[nH+]c(N)c(C)c2)nc(C)n1 ZINC001245535876 986912788 /nfs/dbraw/zinc/91/27/88/986912788.db2.gz HAPSENUPOKQXPU-UHFFFAOYSA-N 1 2 214.272 2.046 20 0 BEADLO COc1cnc(-c2c[nH+]c(N)c(C)c2)c(C)c1 ZINC001245536068 986913352 /nfs/dbraw/zinc/91/33/52/986913352.db2.gz QEGAEFSOOPCTCU-UHFFFAOYSA-N 1 2 229.283 2.351 20 0 BEADLO Cc1cnc(-c2c[nH+]c(N)c(C)c2)c(C)n1 ZINC001245535974 986916078 /nfs/dbraw/zinc/91/60/78/986916078.db2.gz JFUVQWOBGLLMPX-UHFFFAOYSA-N 1 2 214.272 2.046 20 0 BEADLO Cc1cc(-c2ncnc3c2CCCC3)c[nH+]c1N ZINC001245536199 986916212 /nfs/dbraw/zinc/91/62/12/986916212.db2.gz MYXWRNSYBSXWDT-UHFFFAOYSA-N 1 2 240.310 2.308 20 0 BEADLO COc1cnc(C)c(-c2c[nH+]c(N)c(C)c2)c1 ZINC001245538513 986921177 /nfs/dbraw/zinc/92/11/77/986921177.db2.gz MUUZGCXTXVIZFG-UHFFFAOYSA-N 1 2 229.283 2.351 20 0 BEADLO Cc1cc(-c2nc3cc[nH]c3nc2C)c[nH+]c1N ZINC001245539787 986924034 /nfs/dbraw/zinc/92/40/34/986924034.db2.gz ZAAVPOWOEVLKMG-UHFFFAOYSA-N 1 2 239.282 2.219 20 0 BEADLO COc1cncc(OC)c1-c1c[nH+]c(N)c(C)c1 ZINC001245539533 986927274 /nfs/dbraw/zinc/92/72/74/986927274.db2.gz VSAMANKVPRZIKL-UHFFFAOYSA-N 1 2 245.282 2.051 20 0 BEADLO COc1ccc(-c2c[nH+]c(N)c(C)c2)c(F)n1 ZINC001245541176 986930207 /nfs/dbraw/zinc/93/02/07/986930207.db2.gz MTRLEHDEDXLSJQ-UHFFFAOYSA-N 1 2 233.246 2.182 20 0 BEADLO Cc1cc(-c2cc(F)c3nccn3c2)c[nH+]c1N ZINC001245541120 986930359 /nfs/dbraw/zinc/93/03/59/986930359.db2.gz LPXFNLLRAALTHG-UHFFFAOYSA-N 1 2 242.257 2.426 20 0 BEADLO CCOc1ccncc1C[N@@H+]1C[C@H](F)C[C@H]1C ZINC001139627284 986936639 /nfs/dbraw/zinc/93/66/39/986936639.db2.gz LJOLIVFOZRACNK-ZYHUDNBSSA-N 1 2 238.306 2.413 20 0 BEADLO CCOc1ccncc1C[N@H+]1C[C@H](F)C[C@H]1C ZINC001139627284 986936650 /nfs/dbraw/zinc/93/66/50/986936650.db2.gz LJOLIVFOZRACNK-ZYHUDNBSSA-N 1 2 238.306 2.413 20 0 BEADLO COc1cc(C[N@H+](C)CCF)cc(F)c1OC ZINC001137512450 986940244 /nfs/dbraw/zinc/94/02/44/986940244.db2.gz HZXJIUZJKKACAN-UHFFFAOYSA-N 1 2 245.269 2.244 20 0 BEADLO COc1cc(C[N@@H+](C)CCF)cc(F)c1OC ZINC001137512450 986940255 /nfs/dbraw/zinc/94/02/55/986940255.db2.gz HZXJIUZJKKACAN-UHFFFAOYSA-N 1 2 245.269 2.244 20 0 BEADLO Cc1c(N)cc[nH+]c1-c1c(O)cccc1F ZINC001245655690 987034532 /nfs/dbraw/zinc/03/45/32/987034532.db2.gz WJWZZHRCFCUEPI-UHFFFAOYSA-N 1 2 218.231 2.484 20 0 BEADLO Cc1c(-c2ccc3nncn3c2)ccc2[nH+]ccn21 ZINC001245660980 987049053 /nfs/dbraw/zinc/04/90/53/987049053.db2.gz HASDCQIVVAJRQB-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO C[C@@H](Cc1ccccc1F)[NH+]1CCC(=O)CC1 ZINC001255842161 987074637 /nfs/dbraw/zinc/07/46/37/987074637.db2.gz PEKGGIJSIBUSQF-NSHDSACASA-N 1 2 235.302 2.422 20 0 BEADLO COc1nc(OC)c(/C(C)=C/C=C/[NH3+])cc1C ZINC001245796608 987088878 /nfs/dbraw/zinc/08/88/78/987088878.db2.gz ZUOWVGUZCWWXKI-PDTNFJSOSA-N 1 2 234.299 2.283 20 0 BEADLO CCc1[nH]c(CNC(=O)c2cc(C)c(C)o2)c[nH+]1 ZINC001472019329 987156129 /nfs/dbraw/zinc/15/61/29/987156129.db2.gz ZCHATSBRMJKRHQ-UHFFFAOYSA-N 1 2 247.298 2.112 20 0 BEADLO CCc1[nH]cc(CNC(=O)c2cc(C)c(C)o2)[nH+]1 ZINC001472019329 987156139 /nfs/dbraw/zinc/15/61/39/987156139.db2.gz ZCHATSBRMJKRHQ-UHFFFAOYSA-N 1 2 247.298 2.112 20 0 BEADLO CCC[C@@H](CC)C(=O)NCc1c[nH+]c(CC)[nH]1 ZINC001472020752 987158893 /nfs/dbraw/zinc/15/88/93/987158893.db2.gz LXIGZBGTNRDIRC-SNVBAGLBSA-N 1 2 237.347 2.415 20 0 BEADLO CCC[C@@H](CC)C(=O)NCc1c[nH]c(CC)[nH+]1 ZINC001472020752 987158911 /nfs/dbraw/zinc/15/89/11/987158911.db2.gz LXIGZBGTNRDIRC-SNVBAGLBSA-N 1 2 237.347 2.415 20 0 BEADLO CCC[C@H](CC)C(=O)NCc1c[nH+]c(CC)[nH]1 ZINC001472020750 987160353 /nfs/dbraw/zinc/16/03/53/987160353.db2.gz LXIGZBGTNRDIRC-JTQLQIEISA-N 1 2 237.347 2.415 20 0 BEADLO CCC[C@H](CC)C(=O)NCc1c[nH]c(CC)[nH+]1 ZINC001472020750 987160363 /nfs/dbraw/zinc/16/03/63/987160363.db2.gz LXIGZBGTNRDIRC-JTQLQIEISA-N 1 2 237.347 2.415 20 0 BEADLO CCCCCc1cc(=O)n(Cc2[nH+]ccn2C)[nH]1 ZINC001245943485 987221484 /nfs/dbraw/zinc/22/14/84/987221484.db2.gz KCVPSBDBFHJZNR-UHFFFAOYSA-N 1 2 248.330 2.103 20 0 BEADLO Cc1c[nH]c(CNc2ccc([NH+](C)C)cc2)n1 ZINC000693483049 987310250 /nfs/dbraw/zinc/31/02/50/987310250.db2.gz JKSXGHWSNGAUMR-UHFFFAOYSA-N 1 2 230.315 2.396 20 0 BEADLO Cc1c(F)ncnc1NCCCCn1cc[nH+]c1 ZINC000696333186 987339782 /nfs/dbraw/zinc/33/97/82/987339782.db2.gz GWGMIVYYXLALBA-UHFFFAOYSA-N 1 2 249.293 2.013 20 0 BEADLO CCC(F)(F)C[NH2+]C[C@H](O)c1cccc(F)c1 ZINC000697553645 987354947 /nfs/dbraw/zinc/35/49/47/987354947.db2.gz HLJGNKPFJBRPFH-NSHDSACASA-N 1 2 247.260 2.494 20 0 BEADLO C[C@H](Cc1ccco1)Nc1cc[nH+]cc1F ZINC000699601619 987377220 /nfs/dbraw/zinc/37/72/20/987377220.db2.gz PJFUPQOEEZQAJE-SECBINFHSA-N 1 2 220.247 2.279 20 0 BEADLO C[C@@H]([NH2+]Cc1cnon1)c1ccc2c(c1)CCC2 ZINC001473333734 987399944 /nfs/dbraw/zinc/39/99/44/987399944.db2.gz GVRXWWZBHXVWJU-SNVBAGLBSA-N 1 2 243.310 2.409 20 0 BEADLO C[C@@H](C(=O)N[C@H]1C[C@H](C)C[C@H](C)C1)n1cc[nH+]c1 ZINC001116115610 987449797 /nfs/dbraw/zinc/44/97/97/987449797.db2.gz OHCGCSFWRJJZRG-QNWHQSFQSA-N 1 2 249.358 2.385 20 0 BEADLO C[C@H](C(=O)N1CCC[C@H]2CCC[C@@H]21)n1cc[nH+]c1 ZINC001116127968 987451132 /nfs/dbraw/zinc/45/11/32/987451132.db2.gz VPYDDAHMABZTOJ-UPJWGTAASA-N 1 2 247.342 2.235 20 0 BEADLO CCCC1CC[NH+](Cc2nnnn2C2CC2)CC1 ZINC001116191891 987466833 /nfs/dbraw/zinc/46/68/33/987466833.db2.gz XANRNPMUNXZAPE-UHFFFAOYSA-N 1 2 249.362 2.020 20 0 BEADLO CC[C@@H](C)[C@H](C)[N@@H+]1CCOCC(F)(F)C1 ZINC001473526873 987467615 /nfs/dbraw/zinc/46/76/15/987467615.db2.gz LGGXNBUUWCHIBP-ZJUUUORDSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@@H](C)[C@H](C)[N@H+]1CCOCC(F)(F)C1 ZINC001473526873 987467624 /nfs/dbraw/zinc/46/76/24/987467624.db2.gz LGGXNBUUWCHIBP-ZJUUUORDSA-N 1 2 221.291 2.389 20 0 BEADLO C[C@H](C(=O)N1C[C@@H]2CCCC[C@@H]2C1)n1cc[nH+]c1 ZINC001116210855 987481416 /nfs/dbraw/zinc/48/14/16/987481416.db2.gz QWRBOMLOFGMBEI-UPJWGTAASA-N 1 2 247.342 2.093 20 0 BEADLO C[C@H](C(=O)N1C[C@@H]2CCCC[C@H]2C1)n1cc[nH+]c1 ZINC001116210851 987481638 /nfs/dbraw/zinc/48/16/38/987481638.db2.gz QWRBOMLOFGMBEI-AGIUHOORSA-N 1 2 247.342 2.093 20 0 BEADLO O=C(c1cc2c[nH+]ccc2[nH]1)N1CCC=C(F)C1 ZINC001546197626 987496804 /nfs/dbraw/zinc/49/68/04/987496804.db2.gz MYHPDMLTDCCSPT-UHFFFAOYSA-N 1 2 245.257 2.262 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2ncccc2C)nn1C ZINC001473880428 987601155 /nfs/dbraw/zinc/60/11/55/987601155.db2.gz ZDBHQWLEPIUWRJ-GFCCVEGCSA-N 1 2 244.342 2.283 20 0 BEADLO Cc1nc([C@H](C)[NH2+]CCc2ccccc2F)no1 ZINC001116775003 987702531 /nfs/dbraw/zinc/70/25/31/987702531.db2.gz IRMMLOJXHPPDKL-VIFPVBQESA-N 1 2 249.289 2.410 20 0 BEADLO C[C@H](O)c1ncc(C[NH+]2CC3(CCC3)C2)s1 ZINC001474569040 987762157 /nfs/dbraw/zinc/76/21/57/987762157.db2.gz URPNEHLUTYLWTR-VIFPVBQESA-N 1 2 238.356 2.182 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ncccc2F)CCS1 ZINC001474678064 987798076 /nfs/dbraw/zinc/79/80/76/987798076.db2.gz FLICUBKBGPTIGH-SECBINFHSA-N 1 2 226.320 2.158 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ncccc2F)CCS1 ZINC001474678064 987798082 /nfs/dbraw/zinc/79/80/82/987798082.db2.gz FLICUBKBGPTIGH-SECBINFHSA-N 1 2 226.320 2.158 20 0 BEADLO CC1=C(c2nnc(C[NH+](C)C)o2)CCC1 ZINC001117229392 987804708 /nfs/dbraw/zinc/80/47/08/987804708.db2.gz VRTPISFCBIHXGX-UHFFFAOYSA-N 1 2 207.277 2.089 20 0 BEADLO CCC(=Cc1nnc(C[NH+](C)C)o1)CC ZINC001117228971 987805117 /nfs/dbraw/zinc/80/51/17/987805117.db2.gz KKWMIIFMYOZDFU-UHFFFAOYSA-N 1 2 209.293 2.335 20 0 BEADLO C[C@H]1CC(N[C@@H]2C[NH2+]CC2(F)F)C[C@H](C)C1 ZINC001246456444 987814053 /nfs/dbraw/zinc/81/40/53/987814053.db2.gz AOESSGJAFBPISP-FXPVBKGRSA-N 1 2 232.318 2.008 20 0 BEADLO CC1(C)CCC(N[C@H]2C[NH2+]CC2(F)F)CC1 ZINC001246459565 987816978 /nfs/dbraw/zinc/81/69/78/987816978.db2.gz KVPDAZBDMKLRSP-JTQLQIEISA-N 1 2 232.318 2.152 20 0 BEADLO CC1(C)CCC([NH2+][C@H]2CNCC2(F)F)CC1 ZINC001246459565 987816979 /nfs/dbraw/zinc/81/69/79/987816979.db2.gz KVPDAZBDMKLRSP-JTQLQIEISA-N 1 2 232.318 2.152 20 0 BEADLO CCCC(CCC)N[C@@H]1C[NH2+]CC1(F)F ZINC001246460786 987818389 /nfs/dbraw/zinc/81/83/89/987818389.db2.gz NHBUKQNBEZJQOR-SNVBAGLBSA-N 1 2 220.307 2.152 20 0 BEADLO CCCC(CCC)N[C@H]1C[NH2+]CC1(F)F ZINC001246460785 987819125 /nfs/dbraw/zinc/81/91/25/987819125.db2.gz NHBUKQNBEZJQOR-JTQLQIEISA-N 1 2 220.307 2.152 20 0 BEADLO Cc1cc(N[C@@H](C)[C@H](C)O)ccc1[NH+](C)C ZINC001118155620 988065556 /nfs/dbraw/zinc/06/55/56/988065556.db2.gz LZZBNVIONGXRRX-QWRGUYRKSA-N 1 2 222.332 2.242 20 0 BEADLO Cc1ccc(N[C@@H](C)c2ccc(=O)[nH]n2)c(C)[nH+]1 ZINC001322072550 988098439 /nfs/dbraw/zinc/09/84/39/988098439.db2.gz FYBKKVIIYXNVSX-JTQLQIEISA-N 1 2 244.298 2.367 20 0 BEADLO CC(C)(CF)[NH2+]Cc1cc2n(n1)CCCC2 ZINC001118387573 988301498 /nfs/dbraw/zinc/30/14/98/988301498.db2.gz SCGZVOLZHYDQDG-UHFFFAOYSA-N 1 2 225.311 2.057 20 0 BEADLO Cc1cccnc1/C=C/c1nnc(C[NH+](C)C)o1 ZINC001322677191 988362639 /nfs/dbraw/zinc/36/26/39/988362639.db2.gz HQJIBRSXHYYVNH-VOTSOKGWSA-N 1 2 244.298 2.005 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2cc(C)no2)[nH]n1 ZINC001323304043 988492351 /nfs/dbraw/zinc/49/23/51/988492351.db2.gz SPIOWICAHKJHHQ-GFCCVEGCSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2cc(C)no2)[nH]n1 ZINC001323304043 988492359 /nfs/dbraw/zinc/49/23/59/988492359.db2.gz SPIOWICAHKJHHQ-GFCCVEGCSA-N 1 2 246.314 2.352 20 0 BEADLO C[C@@H]1CC[C@H]([N@@H+]2CC[C@H](N)C(F)(F)C2)C[C@H]1C ZINC001246839885 988551534 /nfs/dbraw/zinc/55/15/34/988551534.db2.gz ZWSAGFYHCGDJNC-WYUUTHIRSA-N 1 2 246.345 2.479 20 0 BEADLO C[C@@H]1CC[C@H]([N@H+]2CC[C@H](N)C(F)(F)C2)C[C@H]1C ZINC001246839885 988551549 /nfs/dbraw/zinc/55/15/49/988551549.db2.gz ZWSAGFYHCGDJNC-WYUUTHIRSA-N 1 2 246.345 2.479 20 0 BEADLO CCOC(=O)[C@@H]([NH2+]CCc1ccccc1)C1CC1 ZINC001323616991 988570560 /nfs/dbraw/zinc/57/05/60/988570560.db2.gz RTNLEWRNOMIHKN-AWEZNQCLSA-N 1 2 247.338 2.160 20 0 BEADLO CCCC[C@@H](COC)[NH2+][C@@H](C)c1noc(C)n1 ZINC001323767946 988608296 /nfs/dbraw/zinc/60/82/96/988608296.db2.gz LDYOALLUNGQTFG-ONGXEEELSA-N 1 2 241.335 2.234 20 0 BEADLO CN(C)c1ncccc1C[N@H+](C)Cc1ccoc1 ZINC001323930042 988653044 /nfs/dbraw/zinc/65/30/44/988653044.db2.gz LPSZAZNHCNXFMZ-UHFFFAOYSA-N 1 2 245.326 2.373 20 0 BEADLO CN(C)c1ncccc1C[N@@H+](C)Cc1ccoc1 ZINC001323930042 988653052 /nfs/dbraw/zinc/65/30/52/988653052.db2.gz LPSZAZNHCNXFMZ-UHFFFAOYSA-N 1 2 245.326 2.373 20 0 BEADLO CC(C)(C)c1cn(C[C@@H]2COC(C)(C)O2)c[nH+]1 ZINC001118927482 988711829 /nfs/dbraw/zinc/71/18/29/988711829.db2.gz QJHRGKQEPAQOCE-SNVBAGLBSA-N 1 2 238.331 2.332 20 0 BEADLO Cc1cc2[nH]c(CCCCO)[nH+]c2cc1F ZINC001247012480 988840362 /nfs/dbraw/zinc/84/03/62/988840362.db2.gz OFXACHYSWZVRRC-UHFFFAOYSA-N 1 2 222.263 2.325 20 0 BEADLO Cc1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001247427080 988882551 /nfs/dbraw/zinc/88/25/51/988882551.db2.gz HUJAYKHDBVZEJI-UHFFFAOYSA-N 1 2 226.239 2.231 20 0 BEADLO CC[C@@H]1CCC[C@H]1CNC(=O)[C@H](C)n1cc[nH+]c1 ZINC001324790661 988978345 /nfs/dbraw/zinc/97/83/45/988978345.db2.gz NWBJCYOIPSMKJZ-XQQFMLRXSA-N 1 2 249.358 2.387 20 0 BEADLO CCCC1CCN(C(=O)Cc2c[nH+]cn2C)CC1 ZINC001324857925 989006674 /nfs/dbraw/zinc/00/66/74/989006674.db2.gz DAVHLBNQEHBYAI-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO CO[C@H](C)[C@H]([NH3+])c1nc(-c2ccc(C)cc2)no1 ZINC001247962545 989050179 /nfs/dbraw/zinc/05/01/79/989050179.db2.gz ADRUOCDVNJEUEQ-KOLCDFICSA-N 1 2 247.298 2.080 20 0 BEADLO COc1cccnc1C[NH2+]Cc1ncccc1C ZINC001325133386 989097807 /nfs/dbraw/zinc/09/78/07/989097807.db2.gz ROAZVYVCSQFMDV-UHFFFAOYSA-N 1 2 243.310 2.083 20 0 BEADLO CSc1ccc(CN2CCn3c[nH+]cc3C2)o1 ZINC001119512005 989117782 /nfs/dbraw/zinc/11/77/82/989117782.db2.gz KIUXWOOSOGQXMU-UHFFFAOYSA-N 1 2 249.339 2.214 20 0 BEADLO C[C@H](C(=O)N1C[C@@H](C)CC(C)(C)C1)n1cc[nH+]c1 ZINC001325298196 989152566 /nfs/dbraw/zinc/15/25/66/989152566.db2.gz BOGJLXMVCTXQRQ-NWDGAFQWSA-N 1 2 249.358 2.339 20 0 BEADLO CC[C@H](NC(=O)[C@@H](C)n1cc[nH+]c1)[C@@H]1CC1(C)C ZINC001325341436 989166640 /nfs/dbraw/zinc/16/66/40/989166640.db2.gz GXXXJZAHJIVDGK-WOPDTQHZSA-N 1 2 249.358 2.385 20 0 BEADLO Fc1ccc(C[N@@H+]2CCC23COC3)c2[nH]ccc21 ZINC001248817017 989169237 /nfs/dbraw/zinc/16/92/37/989169237.db2.gz FMOQCUUMFHRLOG-UHFFFAOYSA-N 1 2 246.285 2.282 20 0 BEADLO Fc1ccc(C[N@H+]2CCC23COC3)c2[nH]ccc21 ZINC001248817017 989169245 /nfs/dbraw/zinc/16/92/45/989169245.db2.gz FMOQCUUMFHRLOG-UHFFFAOYSA-N 1 2 246.285 2.282 20 0 BEADLO Cc1ccc2[nH]c(C[N@H+]3CC[C@@H]3C)nc2c1 ZINC001248839426 989192527 /nfs/dbraw/zinc/19/25/27/989192527.db2.gz JENODYMHFFRKBH-JTQLQIEISA-N 1 2 215.300 2.466 20 0 BEADLO Cc1ccc2[nH]c(C[N@@H+]3CC[C@@H]3C)nc2c1 ZINC001248839426 989192536 /nfs/dbraw/zinc/19/25/36/989192536.db2.gz JENODYMHFFRKBH-JTQLQIEISA-N 1 2 215.300 2.466 20 0 BEADLO Cc1ccc2nc(C[N@H+]3CC[C@@H]3C)[nH]c2c1 ZINC001248839426 989192545 /nfs/dbraw/zinc/19/25/45/989192545.db2.gz JENODYMHFFRKBH-JTQLQIEISA-N 1 2 215.300 2.466 20 0 BEADLO Cc1ccc2nc(C[N@@H+]3CC[C@@H]3C)[nH]c2c1 ZINC001248839426 989192550 /nfs/dbraw/zinc/19/25/50/989192550.db2.gz JENODYMHFFRKBH-JTQLQIEISA-N 1 2 215.300 2.466 20 0 BEADLO CO[C@@H]1CC[N@H+](Cc2nc3ccc(C)cc3[nH]2)C1 ZINC001248839975 989193775 /nfs/dbraw/zinc/19/37/75/989193775.db2.gz DVJIFYBCPJUHTB-LLVKDONJSA-N 1 2 245.326 2.092 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2nc3ccc(C)cc3[nH]2)C1 ZINC001248839975 989193784 /nfs/dbraw/zinc/19/37/84/989193784.db2.gz DVJIFYBCPJUHTB-LLVKDONJSA-N 1 2 245.326 2.092 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1ccc(Cl)c(C)n1 ZINC001248874638 989212709 /nfs/dbraw/zinc/21/27/09/989212709.db2.gz OFIIAUBLKXXFOJ-LLVKDONJSA-N 1 2 240.734 2.264 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1ccc(Cl)c(C)n1 ZINC001248874638 989212721 /nfs/dbraw/zinc/21/27/21/989212721.db2.gz OFIIAUBLKXXFOJ-LLVKDONJSA-N 1 2 240.734 2.264 20 0 BEADLO C[NH+](C)Cc1nnc(C2=CCCCC2)o1 ZINC001325807425 989265751 /nfs/dbraw/zinc/26/57/51/989265751.db2.gz SJGIXMGIQJEVNN-UHFFFAOYSA-N 1 2 207.277 2.089 20 0 BEADLO CC[C@H](C)c1nn(C)cc1C[N@H+](C)CCF ZINC001249410725 989273778 /nfs/dbraw/zinc/27/37/78/989273778.db2.gz CRWIGNJMYIYYCI-JTQLQIEISA-N 1 2 227.327 2.335 20 0 BEADLO CC[C@H](C)c1nn(C)cc1C[N@@H+](C)CCF ZINC001249410725 989273791 /nfs/dbraw/zinc/27/37/91/989273791.db2.gz CRWIGNJMYIYYCI-JTQLQIEISA-N 1 2 227.327 2.335 20 0 BEADLO CCn1c[nH+]cc1COC(=O)c1ccoc1C ZINC001518049253 989274047 /nfs/dbraw/zinc/27/40/47/989274047.db2.gz UMUIDUYZJJDISE-UHFFFAOYSA-N 1 2 234.255 2.161 20 0 BEADLO Cc1ccc(C[NH+](C)C)c(Br)n1 ZINC001249416376 989274299 /nfs/dbraw/zinc/27/42/99/989274299.db2.gz KDXLTNWVXHOCRB-UHFFFAOYSA-N 1 2 229.121 2.214 20 0 BEADLO C[N@H+](Cc1cc(C(C)(C)C)c[nH]1)C1COC1 ZINC001249479295 989287591 /nfs/dbraw/zinc/28/75/91/989287591.db2.gz XALYGYMGVUIGIZ-UHFFFAOYSA-N 1 2 222.332 2.143 20 0 BEADLO C[N@@H+](Cc1cc(C(C)(C)C)c[nH]1)C1COC1 ZINC001249479295 989287599 /nfs/dbraw/zinc/28/75/99/989287599.db2.gz XALYGYMGVUIGIZ-UHFFFAOYSA-N 1 2 222.332 2.143 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H](C)C(C)(F)F ZINC001518365152 989297208 /nfs/dbraw/zinc/29/72/08/989297208.db2.gz KBNQNTAIWCQBOZ-SECBINFHSA-N 1 2 242.269 2.350 20 0 BEADLO C1=CC[NH+](Cc2nc(C3CC3)cs2)C1 ZINC001249526792 989302308 /nfs/dbraw/zinc/30/23/08/989302308.db2.gz ZQPKAYJDUQNVIL-UHFFFAOYSA-N 1 2 206.314 2.392 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@]3(CCO3)C2)ns1 ZINC001249588658 989316141 /nfs/dbraw/zinc/31/61/41/989316141.db2.gz LCYZUSFUJPSTMR-GFCCVEGCSA-N 1 2 238.356 2.206 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@]3(CCO3)C2)ns1 ZINC001249588658 989316154 /nfs/dbraw/zinc/31/61/54/989316154.db2.gz LCYZUSFUJPSTMR-GFCCVEGCSA-N 1 2 238.356 2.206 20 0 BEADLO CCO[C@@H]1CC[N@H+](Cc2cc(C)sn2)C1 ZINC001249593173 989322955 /nfs/dbraw/zinc/32/29/55/989322955.db2.gz SYXUUOCUBLAIQR-LLVKDONJSA-N 1 2 226.345 2.062 20 0 BEADLO CCO[C@@H]1CC[N@@H+](Cc2cc(C)sn2)C1 ZINC001249593173 989322958 /nfs/dbraw/zinc/32/29/58/989322958.db2.gz SYXUUOCUBLAIQR-LLVKDONJSA-N 1 2 226.345 2.062 20 0 BEADLO CC[C@H](C)[C@@H](C)c1nnc(C[NH+](C)C)o1 ZINC001326084874 989368743 /nfs/dbraw/zinc/36/87/43/989368743.db2.gz UOAWBAYKNXASIR-DTWKUNHWSA-N 1 2 211.309 2.281 20 0 BEADLO c1nnc(C[NH2+][C@H](c2cccnc2)C2CC2)s1 ZINC001119808244 989411119 /nfs/dbraw/zinc/41/11/19/989411119.db2.gz OKKUKTUVGOZMNE-LBPRGKRZSA-N 1 2 246.339 2.174 20 0 BEADLO CCn1c[nH+]cc1COC(=O)CCc1ccco1 ZINC001520442334 989563935 /nfs/dbraw/zinc/56/39/35/989563935.db2.gz OQYUOPSHFHGDER-UHFFFAOYSA-N 1 2 248.282 2.172 20 0 BEADLO CCc1cc(N2CCC[C@@H](OC)C2)nc(CC)[nH+]1 ZINC001120020444 989567441 /nfs/dbraw/zinc/56/74/41/989567441.db2.gz SCCFTUSVHDVFMI-GFCCVEGCSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@@H](C(=O)N[C@@]1(C)CC=CCC1)n1cc[nH+]c1 ZINC001326764902 989691722 /nfs/dbraw/zinc/69/17/22/989691722.db2.gz XAJFASBADWDSHA-AAEUAGOBSA-N 1 2 233.315 2.059 20 0 BEADLO O[C@H](C[NH2+]CC(F)F)Cc1cccc(Cl)c1 ZINC001120581537 989751235 /nfs/dbraw/zinc/75/12/35/989751235.db2.gz LMYAEKRQBZRQFS-JTQLQIEISA-N 1 2 249.688 2.098 20 0 BEADLO C/C(=C/c1nnc(C[NH+](C)C)o1)c1ccco1 ZINC001326987708 989801017 /nfs/dbraw/zinc/80/10/17/989801017.db2.gz NJKWICUQXQIGFA-CLFYSBASSA-N 1 2 233.271 2.285 20 0 BEADLO CCc1ccc(N2CCC[C@H]([C@H](C)O)C2)[nH+]c1 ZINC001120828192 989908750 /nfs/dbraw/zinc/90/87/50/989908750.db2.gz PEVPBGOEHLECGL-AAEUAGOBSA-N 1 2 234.343 2.241 20 0 BEADLO CCc1ccc(N2CC[C@@H](C)[C@H](CO)C2)[nH+]c1 ZINC001120867319 989933623 /nfs/dbraw/zinc/93/36/23/989933623.db2.gz GHRBPVUMKQRPOH-YPMHNXCESA-N 1 2 234.343 2.099 20 0 BEADLO CNc1cc(N2CC(F)(F)CC[C@H]2C)nc[nH+]1 ZINC001120888913 989949274 /nfs/dbraw/zinc/94/92/74/989949274.db2.gz PYSBYVSYTYBMCD-MRVPVSSYSA-N 1 2 242.273 2.142 20 0 BEADLO CNc1cc(N2CC(F)(F)CC[C@H]2C)[nH+]cn1 ZINC001120888913 989949280 /nfs/dbraw/zinc/94/92/80/989949280.db2.gz PYSBYVSYTYBMCD-MRVPVSSYSA-N 1 2 242.273 2.142 20 0 BEADLO Nc1cc(N2CCC[C@]3(CC=CCC3)C2)[nH+]cn1 ZINC001120899095 989955447 /nfs/dbraw/zinc/95/54/47/989955447.db2.gz LWTDDTDFDTUQCF-CQSZACIVSA-N 1 2 244.342 2.386 20 0 BEADLO Fc1ccc(N2CCC(c3c[nH]c[nH+]3)CC2)nc1 ZINC001120906656 989957920 /nfs/dbraw/zinc/95/79/20/989957920.db2.gz TVJSOFLKCTWUIB-UHFFFAOYSA-N 1 2 246.289 2.328 20 0 BEADLO CC[C@H](Nc1cc(N)nc[nH+]1)c1c(C)noc1C ZINC001120913093 989961857 /nfs/dbraw/zinc/96/18/57/989961857.db2.gz HNEKOOKAIULZKS-VIFPVBQESA-N 1 2 247.302 2.227 20 0 BEADLO CCc1ccc(N2CCC(F)(F)C2)[nH+]c1 ZINC001120913755 989962547 /nfs/dbraw/zinc/96/25/47/989962547.db2.gz AYZVBOFKSPRUSV-UHFFFAOYSA-N 1 2 212.243 2.489 20 0 BEADLO CCc1ccc(N2C[C@@H](C)C(O)[C@H](C)C2)[nH+]c1 ZINC001120945509 989979223 /nfs/dbraw/zinc/97/92/23/989979223.db2.gz DDSHEUGFFVNLGB-GHMZBOCLSA-N 1 2 234.343 2.097 20 0 BEADLO CCc1ccc(N2C[C@H](C)C(O)[C@@H](C)C2)[nH+]c1 ZINC001120945510 989979502 /nfs/dbraw/zinc/97/95/02/989979502.db2.gz DDSHEUGFFVNLGB-QWRGUYRKSA-N 1 2 234.343 2.097 20 0 BEADLO CCc1ccc(N2C[C@H](C)[C@@](C)(CO)C2)[nH+]c1 ZINC001120948771 989983537 /nfs/dbraw/zinc/98/35/37/989983537.db2.gz DGJVDDSIFABKJA-SMDDNHRTSA-N 1 2 234.343 2.099 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)CC1CCC1 ZINC001121138397 990022290 /nfs/dbraw/zinc/02/22/90/990022290.db2.gz ABAJWJYGXUDPJR-UHFFFAOYSA-N 1 2 218.300 2.249 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H]1C[C@@H]1C1CC1 ZINC001121139735 990023424 /nfs/dbraw/zinc/02/34/24/990023424.db2.gz MTYLFHCPWMSXBG-NEPJUHHUSA-N 1 2 230.311 2.105 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H]1CCC1(C)C ZINC001121231367 990053136 /nfs/dbraw/zinc/05/31/36/990053136.db2.gz KFIHPFVEUCACRR-LLVKDONJSA-N 1 2 232.327 2.495 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H]1[C@@H]2CCCC[C@@H]21 ZINC001121232008 990055322 /nfs/dbraw/zinc/05/53/22/990055322.db2.gz TXJBBHSNBQEQAH-ITGUQSILSA-N 1 2 244.338 2.495 20 0 BEADLO CC(C)[N@@H+]1CCC[C@@H]1C(=O)OCC(C)(F)F ZINC001526353896 990133181 /nfs/dbraw/zinc/13/31/81/990133181.db2.gz XWQBZWLECHDGHO-SECBINFHSA-N 1 2 235.274 2.058 20 0 BEADLO CC(C)[N@H+]1CCC[C@@H]1C(=O)OCC(C)(F)F ZINC001526353896 990133188 /nfs/dbraw/zinc/13/31/88/990133188.db2.gz XWQBZWLECHDGHO-SECBINFHSA-N 1 2 235.274 2.058 20 0 BEADLO CC(C)(COC(=O)C=C1CCC1)n1cc[nH+]c1 ZINC001123049670 990496299 /nfs/dbraw/zinc/49/62/99/990496299.db2.gz FXSSWBKVOVLABV-UHFFFAOYSA-N 1 2 234.299 2.272 20 0 BEADLO Cn1c[nH+]cc1CCCOC(=O)C=C1CCCC1 ZINC001123065883 990502348 /nfs/dbraw/zinc/50/23/48/990502348.db2.gz JWNBNIAPDJEALY-UHFFFAOYSA-N 1 2 248.326 2.396 20 0 BEADLO CC[C@H](C)C(=O)OCC(C)(C)n1cc[nH+]c1 ZINC001123160220 990519440 /nfs/dbraw/zinc/51/94/40/990519440.db2.gz FJKDRTSSQFNYSR-JTQLQIEISA-N 1 2 224.304 2.208 20 0 BEADLO C[C@H](CC(=O)Nc1cccc(O)c1)n1cc[nH+]c1 ZINC001538627507 990536650 /nfs/dbraw/zinc/53/66/50/990536650.db2.gz OFBDRIKMVYHDNB-SNVBAGLBSA-N 1 2 245.282 2.179 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)Nc1ccccc1Cl ZINC001538807444 990546398 /nfs/dbraw/zinc/54/63/98/990546398.db2.gz NHQKFRHMKPDKBJ-UHFFFAOYSA-N 1 2 235.674 2.244 20 0 BEADLO CCn1c[nH+]cc1COC(=O)c1cc(C)[nH]c1C ZINC001123468953 990590262 /nfs/dbraw/zinc/59/02/62/990590262.db2.gz JZKDOWPLZXXLHY-UHFFFAOYSA-N 1 2 247.298 2.205 20 0 BEADLO Cn1cc[nH+]c1CCC(=O)Nc1ccc(F)cc1 ZINC001540328492 990604721 /nfs/dbraw/zinc/60/47/21/990604721.db2.gz YDJJWYINWDOBJT-UHFFFAOYSA-N 1 2 247.273 2.131 20 0 BEADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)[C@@H]1C[C@H]1F ZINC001542442206 990664994 /nfs/dbraw/zinc/66/49/94/990664994.db2.gz MNDXYFKDZPKTCS-GHMZBOCLSA-N 1 2 245.257 2.373 20 0 BEADLO C/C=C(\C)C(=O)N1CCC(c2c[nH+]cn2C)CC1 ZINC001124093079 990750514 /nfs/dbraw/zinc/75/05/14/990750514.db2.gz ZZWUAPHCBLTYBD-NYYWCZLTSA-N 1 2 247.342 2.092 20 0 BEADLO CC[C@@H]1CCN(C(=O)C[C@H](C)n2cc[nH+]c2)[C@H]1C ZINC001556272953 990757643 /nfs/dbraw/zinc/75/76/43/990757643.db2.gz JMMDUMQWHOCDHF-RWMBFGLXSA-N 1 2 249.358 2.481 20 0 BEADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)[C@@H]1C[C@@H]1F ZINC001125150850 990817006 /nfs/dbraw/zinc/81/70/06/990817006.db2.gz IDMUDTSBWVPCKJ-NEPJUHHUSA-N 1 2 245.257 2.169 20 0 BEADLO CO[C@@H]1CC[N@H+](Cc2cc(F)cc(F)c2F)C1 ZINC001137868864 990863183 /nfs/dbraw/zinc/86/31/83/990863183.db2.gz UTFBAYLFJIKYSS-SNVBAGLBSA-N 1 2 245.244 2.325 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2cc(F)cc(F)c2F)C1 ZINC001137868864 990863186 /nfs/dbraw/zinc/86/31/86/990863186.db2.gz UTFBAYLFJIKYSS-SNVBAGLBSA-N 1 2 245.244 2.325 20 0 BEADLO CCOc1cccc(C[N@H+]2C[C@H]3C[C@@H](C2)O3)c1 ZINC001138101007 990882301 /nfs/dbraw/zinc/88/23/01/990882301.db2.gz FSWOJDLYUSFEPG-OKILXGFUSA-N 1 2 233.311 2.058 20 0 BEADLO CCOc1cccc(C[N@@H+]2C[C@H]3C[C@@H](C2)O3)c1 ZINC001138101007 990882302 /nfs/dbraw/zinc/88/23/02/990882302.db2.gz FSWOJDLYUSFEPG-OKILXGFUSA-N 1 2 233.311 2.058 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1cc(O)cc(O)c1 ZINC001138324470 990914663 /nfs/dbraw/zinc/91/46/63/990914663.db2.gz OQAGCOZMTPFQFP-SCZZXKLOSA-N 1 2 225.263 2.030 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1cc(O)cc(O)c1 ZINC001138324470 990914671 /nfs/dbraw/zinc/91/46/71/990914671.db2.gz OQAGCOZMTPFQFP-SCZZXKLOSA-N 1 2 225.263 2.030 20 0 BEADLO C[N@H+](Cc1cccnc1)Cc1cc(O)cc(O)c1 ZINC001138323463 990915136 /nfs/dbraw/zinc/91/51/36/990915136.db2.gz WKPBVDBBQKRBDX-UHFFFAOYSA-N 1 2 244.294 2.125 20 0 BEADLO C[N@@H+](Cc1cccnc1)Cc1cc(O)cc(O)c1 ZINC001138323463 990915140 /nfs/dbraw/zinc/91/51/40/990915140.db2.gz WKPBVDBBQKRBDX-UHFFFAOYSA-N 1 2 244.294 2.125 20 0 BEADLO Cc1c(C[N@@H+](C)C2COC2)[nH]c2ccc(F)cc12 ZINC001138411582 990940454 /nfs/dbraw/zinc/94/04/54/990940454.db2.gz BREBZVVTUPDTKV-UHFFFAOYSA-N 1 2 248.301 2.446 20 0 BEADLO Cc1c(C[N@H+](C)C2COC2)[nH]c2ccc(F)cc12 ZINC001138411582 990940458 /nfs/dbraw/zinc/94/04/58/990940458.db2.gz BREBZVVTUPDTKV-UHFFFAOYSA-N 1 2 248.301 2.446 20 0 BEADLO COc1c(F)cc(C[N@H+](C)CCF)cc1F ZINC001138425656 990943105 /nfs/dbraw/zinc/94/31/05/990943105.db2.gz HVNCXJVCJUSOHU-UHFFFAOYSA-N 1 2 233.233 2.375 20 0 BEADLO COc1c(F)cc(C[N@@H+](C)CCF)cc1F ZINC001138425656 990943112 /nfs/dbraw/zinc/94/31/12/990943112.db2.gz HVNCXJVCJUSOHU-UHFFFAOYSA-N 1 2 233.233 2.375 20 0 BEADLO Cc1ccc2[nH]c(C[NH+]3CC(C)(O)C3)cc2c1 ZINC001138417908 990945854 /nfs/dbraw/zinc/94/58/54/990945854.db2.gz DIYVCSJGGQMDGM-UHFFFAOYSA-N 1 2 230.311 2.043 20 0 BEADLO CCOc1ccc(C[NH+]2CC(OC)C2)c(C)c1 ZINC001138431032 990947635 /nfs/dbraw/zinc/94/76/35/990947635.db2.gz QZTOUGNQHGQJSR-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO CCc1[nH]c(CNC(=O)c2cc(C)oc2C)c[nH+]1 ZINC001558497592 990953340 /nfs/dbraw/zinc/95/33/40/990953340.db2.gz VNAFEIIIAMCETL-UHFFFAOYSA-N 1 2 247.298 2.112 20 0 BEADLO CCc1[nH]cc(CNC(=O)c2cc(C)oc2C)[nH+]1 ZINC001558497592 990953344 /nfs/dbraw/zinc/95/33/44/990953344.db2.gz VNAFEIIIAMCETL-UHFFFAOYSA-N 1 2 247.298 2.112 20 0 BEADLO COc1cc[nH+]cc1NCc1ccns1 ZINC001308340461 990971040 /nfs/dbraw/zinc/97/10/40/990971040.db2.gz QQMXBEVPZFYMCW-UHFFFAOYSA-N 1 2 221.285 2.159 20 0 BEADLO CC(C)(C)c1n[nH]cc1C[N@@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001138581514 990974378 /nfs/dbraw/zinc/97/43/78/990974378.db2.gz NJDITYNCJJBQOI-VXGBXAGGSA-N 1 2 249.358 2.070 20 0 BEADLO CC(C)(C)c1n[nH]cc1C[N@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001138581514 990974391 /nfs/dbraw/zinc/97/43/91/990974391.db2.gz NJDITYNCJJBQOI-VXGBXAGGSA-N 1 2 249.358 2.070 20 0 BEADLO C[C@H]1C[C@H]([NH2+]Cc2ccc(F)nc2)c2nccn21 ZINC001308404574 990981391 /nfs/dbraw/zinc/98/13/91/990981391.db2.gz YYWVTQCVLCMTER-ONGXEEELSA-N 1 2 246.289 2.213 20 0 BEADLO CSc1ncc(C[NH+]2CC(C)(C)C2)cn1 ZINC001138700774 991013528 /nfs/dbraw/zinc/01/35/28/991013528.db2.gz NSKAALLDMFHOLI-UHFFFAOYSA-N 1 2 223.345 2.040 20 0 BEADLO c1nscc1C[NH2+]Cc1cc(C2CC2)no1 ZINC001308518211 991019721 /nfs/dbraw/zinc/01/97/21/991019721.db2.gz AWGYQTAUSGFQOQ-UHFFFAOYSA-N 1 2 235.312 2.298 20 0 BEADLO C[N@H+](CCF)Cc1ccnc(Br)c1 ZINC001138736358 991020598 /nfs/dbraw/zinc/02/05/98/991020598.db2.gz NNGKEBIPDDPEDB-UHFFFAOYSA-N 1 2 247.111 2.245 20 0 BEADLO C[N@@H+](CCF)Cc1ccnc(Br)c1 ZINC001138736358 991020610 /nfs/dbraw/zinc/02/06/10/991020610.db2.gz NNGKEBIPDDPEDB-UHFFFAOYSA-N 1 2 247.111 2.245 20 0 BEADLO CCOC(=O)CCC[C@H](C)[N@H+](C)CC(F)F ZINC001258134011 991026641 /nfs/dbraw/zinc/02/66/41/991026641.db2.gz VIGISNFQMXTNJW-VIFPVBQESA-N 1 2 237.290 2.305 20 0 BEADLO CCOC(=O)CCC[C@H](C)[N@@H+](C)CC(F)F ZINC001258134011 991026645 /nfs/dbraw/zinc/02/66/45/991026645.db2.gz VIGISNFQMXTNJW-VIFPVBQESA-N 1 2 237.290 2.305 20 0 BEADLO Cc1cccc2nc(NCCn3cc[nH+]c3)oc21 ZINC001559051435 991029977 /nfs/dbraw/zinc/02/99/77/991029977.db2.gz ZTCYXMIFIXUAGZ-UHFFFAOYSA-N 1 2 242.282 2.445 20 0 BEADLO Nc1[nH+]cccc1CNc1nc2ccccc2o1 ZINC001559192755 991049529 /nfs/dbraw/zinc/04/95/29/991049529.db2.gz IERZPXGFZILIFL-UHFFFAOYSA-N 1 2 240.266 2.417 20 0 BEADLO CC(=O)C1CC[NH+](Cc2cccnc2F)CC1 ZINC001138787455 991052314 /nfs/dbraw/zinc/05/23/14/991052314.db2.gz IKHBDNGZBOLPBI-UHFFFAOYSA-N 1 2 236.290 2.022 20 0 BEADLO CCNc1ccc(Nc2cc(F)ncn2)c[nH+]1 ZINC001559304868 991070630 /nfs/dbraw/zinc/07/06/30/991070630.db2.gz LXFKFKINNYAYNV-UHFFFAOYSA-N 1 2 233.250 2.186 20 0 BEADLO C[N@H+](Cc1ccno1)Cc1ccnc(Cl)c1 ZINC001138821303 991075625 /nfs/dbraw/zinc/07/56/25/991075625.db2.gz LIASRJOTBPEPGG-UHFFFAOYSA-N 1 2 237.690 2.355 20 0 BEADLO C[N@@H+](Cc1ccno1)Cc1ccnc(Cl)c1 ZINC001138821303 991075637 /nfs/dbraw/zinc/07/56/37/991075637.db2.gz LIASRJOTBPEPGG-UHFFFAOYSA-N 1 2 237.690 2.355 20 0 BEADLO CCc1cn(Cc2cc(C)c(C(=O)OC)o2)c[nH+]1 ZINC001559465883 991112522 /nfs/dbraw/zinc/11/25/22/991112522.db2.gz DZMWMZOWSFIMKR-UHFFFAOYSA-N 1 2 248.282 2.182 20 0 BEADLO CCc1cn(CC(=O)N2[C@H](C)CCC[C@H]2C)c[nH+]1 ZINC001559466442 991113479 /nfs/dbraw/zinc/11/34/79/991113479.db2.gz UXIRLXKYFMAELY-VXGBXAGGSA-N 1 2 249.358 2.235 20 0 BEADLO CCCOc1ccccc1C[N@H+](C)C1COC1 ZINC001139002118 991124822 /nfs/dbraw/zinc/12/48/22/991124822.db2.gz TXAJMWQPTUKBKJ-UHFFFAOYSA-N 1 2 235.327 2.306 20 0 BEADLO CCCOc1ccccc1C[N@@H+](C)C1COC1 ZINC001139002118 991124828 /nfs/dbraw/zinc/12/48/28/991124828.db2.gz TXAJMWQPTUKBKJ-UHFFFAOYSA-N 1 2 235.327 2.306 20 0 BEADLO CCCn1cc(C[N@H+]2CCC(=O)[C@H](C)CC2)cn1 ZINC001139036988 991128546 /nfs/dbraw/zinc/12/85/46/991128546.db2.gz FEJXJKBBMVQYKN-GFCCVEGCSA-N 1 2 249.358 2.094 20 0 BEADLO CCCn1cc(C[N@@H+]2CCC(=O)[C@H](C)CC2)cn1 ZINC001139036988 991128548 /nfs/dbraw/zinc/12/85/48/991128548.db2.gz FEJXJKBBMVQYKN-GFCCVEGCSA-N 1 2 249.358 2.094 20 0 BEADLO CCCn1cc(C[N@@H+]2CCCC[C@@H]2C(C)=O)cn1 ZINC001139041842 991133804 /nfs/dbraw/zinc/13/38/04/991133804.db2.gz XOCRKKSNBCOHFN-CQSZACIVSA-N 1 2 249.358 2.237 20 0 BEADLO CCCn1cc(C[N@H+]2CCCC[C@@H]2C(C)=O)cn1 ZINC001139041842 991133807 /nfs/dbraw/zinc/13/38/07/991133807.db2.gz XOCRKKSNBCOHFN-CQSZACIVSA-N 1 2 249.358 2.237 20 0 BEADLO CSCC[C@H](C)[N@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001258216139 991143572 /nfs/dbraw/zinc/14/35/72/991143572.db2.gz UVQMSHRXWYHZNN-XHNCKOQMSA-N 1 2 209.305 2.120 20 0 BEADLO CSCC[C@H](C)[N@@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001258216139 991143586 /nfs/dbraw/zinc/14/35/86/991143586.db2.gz UVQMSHRXWYHZNN-XHNCKOQMSA-N 1 2 209.305 2.120 20 0 BEADLO CC[C@H]([NH2+]Cc1cnn[nH]1)c1ccc(C)c(F)c1 ZINC001559711469 991222855 /nfs/dbraw/zinc/22/28/55/991222855.db2.gz JZGUXNSUJXKRHI-ZDUSSCGKSA-N 1 2 248.305 2.493 20 0 BEADLO CC[N@H+](C)Cc1nnc(CCC(C)C)o1 ZINC001258294778 991230288 /nfs/dbraw/zinc/23/02/88/991230288.db2.gz HNEQIZNXXYNAID-UHFFFAOYSA-N 1 2 211.309 2.110 20 0 BEADLO CC[N@@H+](C)Cc1nnc(CCC(C)C)o1 ZINC001258294778 991230301 /nfs/dbraw/zinc/23/03/01/991230301.db2.gz HNEQIZNXXYNAID-UHFFFAOYSA-N 1 2 211.309 2.110 20 0 BEADLO CC[N@H+](Cc1cnc(Cl)c(C)c1)C1COC1 ZINC001139545008 991268712 /nfs/dbraw/zinc/26/87/12/991268712.db2.gz MNTHAUILTYKXOB-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO CC[N@@H+](Cc1cnc(Cl)c(C)c1)C1COC1 ZINC001139545008 991268732 /nfs/dbraw/zinc/26/87/32/991268732.db2.gz MNTHAUILTYKXOB-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO COc1ncc(C[N@@H+]2CCCC[C@@H](F)C2)s1 ZINC001139814381 991383148 /nfs/dbraw/zinc/38/31/48/991383148.db2.gz BWANTHIUXCDHJW-SECBINFHSA-N 1 2 244.335 2.476 20 0 BEADLO COc1ncc(C[N@H+]2CCCC[C@@H](F)C2)s1 ZINC001139814381 991383153 /nfs/dbraw/zinc/38/31/53/991383153.db2.gz BWANTHIUXCDHJW-SECBINFHSA-N 1 2 244.335 2.476 20 0 BEADLO Cc1[nH]c([C@@H]2CCCN2Cc2ccon2)[nH+]c1C ZINC001560136986 991392607 /nfs/dbraw/zinc/39/26/07/991392607.db2.gz OFMYYOFABYOBMI-LBPRGKRZSA-N 1 2 246.314 2.352 20 0 BEADLO CC[C@H](CO)[NH2+]CC(F)(F)c1ccc(F)cc1 ZINC001560148812 991396035 /nfs/dbraw/zinc/39/60/35/991396035.db2.gz KMDWSAOIDHWRID-LLVKDONJSA-N 1 2 247.260 2.278 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[N@@H+]1CCC[C@H](F)C1 ZINC001560205371 991418846 /nfs/dbraw/zinc/41/88/46/991418846.db2.gz UCXYFDGICBNNBF-RYUDHWBXSA-N 1 2 245.338 2.398 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[N@H+]1CCC[C@H](F)C1 ZINC001560205371 991418853 /nfs/dbraw/zinc/41/88/53/991418853.db2.gz UCXYFDGICBNNBF-RYUDHWBXSA-N 1 2 245.338 2.398 20 0 BEADLO Cc1ccc(C[N@@H+]2CCCCC23COC3)cn1 ZINC001139932545 991422362 /nfs/dbraw/zinc/42/23/62/991422362.db2.gz AQVKGDYVMPLLDR-UHFFFAOYSA-N 1 2 232.327 2.145 20 0 BEADLO Cc1ccc(C[N@H+]2CCCCC23COC3)cn1 ZINC001139932545 991422367 /nfs/dbraw/zinc/42/23/67/991422367.db2.gz AQVKGDYVMPLLDR-UHFFFAOYSA-N 1 2 232.327 2.145 20 0 BEADLO O=c1oc2ccc(CNc3cccc[nH+]3)cc2o1 ZINC001560278631 991450747 /nfs/dbraw/zinc/45/07/47/991450747.db2.gz OOHGAFJSWJPGDN-UHFFFAOYSA-N 1 2 242.234 2.393 20 0 BEADLO Fc1ccc2c(c1)CC[N@@H+](Cc1ccnnc1)C2 ZINC001139984823 991460218 /nfs/dbraw/zinc/46/02/18/991460218.db2.gz BHJWGSBCSKCPKW-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1ccc2c(c1)CC[N@H+](Cc1ccnnc1)C2 ZINC001139984823 991460224 /nfs/dbraw/zinc/46/02/24/991460224.db2.gz BHJWGSBCSKCPKW-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO C[N@H+](Cc1ccnnc1)Cc1ccc(Cl)nc1 ZINC001139984051 991461475 /nfs/dbraw/zinc/46/14/75/991461475.db2.gz TXBUCEACDVMLOU-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[N@@H+](Cc1ccnnc1)Cc1ccc(Cl)nc1 ZINC001139984051 991461476 /nfs/dbraw/zinc/46/14/76/991461476.db2.gz TXBUCEACDVMLOU-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[NH+](C)Cc1cc(Br)cnc1F ZINC001140003488 991478878 /nfs/dbraw/zinc/47/88/78/991478878.db2.gz SYQHIKVEJHEVSO-UHFFFAOYSA-N 1 2 233.084 2.045 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ncnn2C)cs1 ZINC001560462594 991480090 /nfs/dbraw/zinc/48/00/90/991480090.db2.gz PWHFFEOUVOQAJX-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO CCc1nc(C[NH2+]Cc2ccc(F)nc2C)co1 ZINC001560475267 991483264 /nfs/dbraw/zinc/48/32/64/991483264.db2.gz VIEIVEKNAHDMDG-UHFFFAOYSA-N 1 2 249.289 2.369 20 0 BEADLO Cn1c2ccc(F)cc2[nH+]c1NCc1ncc[nH]1 ZINC001560621401 991526126 /nfs/dbraw/zinc/52/61/26/991526126.db2.gz KOJAFGBSWYUWIP-UHFFFAOYSA-N 1 2 245.261 2.048 20 0 BEADLO C[C@H](Cc1cccnc1)[NH2+][C@H]1CC1(F)F ZINC001258608866 991528761 /nfs/dbraw/zinc/52/87/61/991528761.db2.gz GMFWSEFAHHMDHL-SCZZXKLOSA-N 1 2 212.243 2.010 20 0 BEADLO Cn1c[nH+]c(Cc2nnc(CC3CCCC3)o2)c1 ZINC001258628636 991561528 /nfs/dbraw/zinc/56/15/28/991561528.db2.gz XPJXJXMTQGEMAC-UHFFFAOYSA-N 1 2 246.314 2.127 20 0 BEADLO CCOC1C[NH+](Cc2c[nH]c3cccc(O)c23)C1 ZINC001140230635 991567487 /nfs/dbraw/zinc/56/74/87/991567487.db2.gz ZDXAGFZONSDSOA-UHFFFAOYSA-N 1 2 246.310 2.094 20 0 BEADLO CCC[C@@H](Cc1ccccc1)[NH2+][C@H]1CCOC1=O ZINC001258650347 991586219 /nfs/dbraw/zinc/58/62/19/991586219.db2.gz ZWQMSBVTGKBCGQ-KBPBESRZSA-N 1 2 247.338 2.303 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1n[nH]c2ccc(C)cc21 ZINC001140331556 991609430 /nfs/dbraw/zinc/60/94/30/991609430.db2.gz KSNQAWDXLCJVIE-NSHDSACASA-N 1 2 245.326 2.092 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1n[nH]c2ccc(C)cc21 ZINC001140331556 991609436 /nfs/dbraw/zinc/60/94/36/991609436.db2.gz KSNQAWDXLCJVIE-NSHDSACASA-N 1 2 245.326 2.092 20 0 BEADLO CC[N@H+](Cc1[nH]nc2ccc(C)cc21)C1COC1 ZINC001140330260 991612004 /nfs/dbraw/zinc/61/20/04/991612004.db2.gz SCPSUVOZXOGCCL-UHFFFAOYSA-N 1 2 245.326 2.092 20 0 BEADLO CC[N@@H+](Cc1[nH]nc2ccc(C)cc21)C1COC1 ZINC001140330260 991612007 /nfs/dbraw/zinc/61/20/07/991612007.db2.gz SCPSUVOZXOGCCL-UHFFFAOYSA-N 1 2 245.326 2.092 20 0 BEADLO CC(C)C[C@@H]1CCCN1C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001318080652 991620682 /nfs/dbraw/zinc/62/06/82/991620682.db2.gz RUSFCLHNLVONKM-OLZOCXBDSA-N 1 2 249.358 2.481 20 0 BEADLO COc1ccccc1OC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001318095796 991621697 /nfs/dbraw/zinc/62/16/97/991621697.db2.gz AVSOFSAVBJGFFW-SNVBAGLBSA-N 1 2 246.266 2.058 20 0 BEADLO c1cc(C[N@@H+]2CCO[C@H]3C[C@H]32)cc2c1CCC2 ZINC001203035256 991637615 /nfs/dbraw/zinc/63/76/15/991637615.db2.gz XHHICEHGJGMLDR-CABCVRRESA-N 1 2 229.323 2.148 20 0 BEADLO c1cc(C[N@H+]2CCO[C@H]3C[C@H]32)cc2c1CCC2 ZINC001203035256 991637618 /nfs/dbraw/zinc/63/76/18/991637618.db2.gz XHHICEHGJGMLDR-CABCVRRESA-N 1 2 229.323 2.148 20 0 BEADLO Cc1ccc2c(c1)CC[C@H]2Nc1cc(N)nc[nH+]1 ZINC001318278181 991642818 /nfs/dbraw/zinc/64/28/18/991642818.db2.gz ZTYORJAHVMISPU-GFCCVEGCSA-N 1 2 240.310 2.467 20 0 BEADLO CO[C@H]1CC[N@H+](Cc2c(F)cc(F)cc2F)C1 ZINC001140529824 991662491 /nfs/dbraw/zinc/66/24/91/991662491.db2.gz IZRCFVIDAZKPMG-VIFPVBQESA-N 1 2 245.244 2.325 20 0 BEADLO CO[C@H]1CC[N@@H+](Cc2c(F)cc(F)cc2F)C1 ZINC001140529824 991662493 /nfs/dbraw/zinc/66/24/93/991662493.db2.gz IZRCFVIDAZKPMG-VIFPVBQESA-N 1 2 245.244 2.325 20 0 BEADLO Cc1cc(C[N@H+]2CCC(=O)C[C@@H]2C)ccc1O ZINC001140574991 991676715 /nfs/dbraw/zinc/67/67/15/991676715.db2.gz YIPHSLWXOFIQMN-NSHDSACASA-N 1 2 233.311 2.254 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(=O)C[C@@H]2C)ccc1O ZINC001140574991 991676719 /nfs/dbraw/zinc/67/67/19/991676719.db2.gz YIPHSLWXOFIQMN-NSHDSACASA-N 1 2 233.311 2.254 20 0 BEADLO CC(C)CN(C(=O)[C@@H](C)n1cc[nH+]c1)C1CC1 ZINC001318558950 991681192 /nfs/dbraw/zinc/68/11/92/991681192.db2.gz GYHKHXSZMIBQHH-LLVKDONJSA-N 1 2 235.331 2.091 20 0 BEADLO COC(=O)C[NH2+][C@H](C)Cc1cccc(Cl)c1 ZINC001258738770 991690356 /nfs/dbraw/zinc/69/03/56/991690356.db2.gz YWSHZZBKGSQLEQ-SECBINFHSA-N 1 2 241.718 2.034 20 0 BEADLO CCCC[C@H](CCC)[N@@H+]1CCOC(=O)C1 ZINC001258766700 991726872 /nfs/dbraw/zinc/72/68/72/991726872.db2.gz MWRUIUXETHMAJN-NSHDSACASA-N 1 2 213.321 2.204 20 0 BEADLO CCCC[C@H](CCC)[N@H+]1CCOC(=O)C1 ZINC001258766700 991726887 /nfs/dbraw/zinc/72/68/87/991726887.db2.gz MWRUIUXETHMAJN-NSHDSACASA-N 1 2 213.321 2.204 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N(C1CC1)C1CCCC1 ZINC001565639706 991797512 /nfs/dbraw/zinc/79/75/12/991797512.db2.gz PTINXGSSWJQAKZ-UHFFFAOYSA-N 1 2 247.342 2.276 20 0 BEADLO CCOC(=O)C1([NH2+][C@@H]2CCC[C@@H](C)C2)CC1 ZINC001258806966 991806480 /nfs/dbraw/zinc/80/64/80/991806480.db2.gz KHSWESQVEQOEDM-GHMZBOCLSA-N 1 2 225.332 2.250 20 0 BEADLO C[C@@H]1CCC[C@@H]([N@@H+]2CC[C@H](O)C(F)(F)C2)C1 ZINC001258826335 991848748 /nfs/dbraw/zinc/84/87/48/991848748.db2.gz JBFJSJDGUQLRTR-MXWKQRLJSA-N 1 2 233.302 2.267 20 0 BEADLO C[C@@H]1CCC[C@@H]([N@H+]2CC[C@H](O)C(F)(F)C2)C1 ZINC001258826335 991848752 /nfs/dbraw/zinc/84/87/52/991848752.db2.gz JBFJSJDGUQLRTR-MXWKQRLJSA-N 1 2 233.302 2.267 20 0 BEADLO CC[C@@H](C)CN(CC)C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001319367677 991849971 /nfs/dbraw/zinc/84/99/71/991849971.db2.gz LAORMUCMUIWSSW-VXGBXAGGSA-N 1 2 237.347 2.339 20 0 BEADLO CC[C@@H](Cc1ccccc1)[NH2+]C1(C(=O)OC)CC1 ZINC001258838174 991873093 /nfs/dbraw/zinc/87/30/93/991873093.db2.gz PHRIMJYASCXTSA-ZDUSSCGKSA-N 1 2 247.338 2.303 20 0 BEADLO CC[C@@H](Cc1ccccc1)[N@@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001258850794 991884452 /nfs/dbraw/zinc/88/44/52/991884452.db2.gz BJADYZLIXKBOAJ-IHRRRGAJSA-N 1 2 245.322 2.007 20 0 BEADLO CC[C@@H](Cc1ccccc1)[N@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001258850794 991884458 /nfs/dbraw/zinc/88/44/58/991884458.db2.gz BJADYZLIXKBOAJ-IHRRRGAJSA-N 1 2 245.322 2.007 20 0 BEADLO C[C@@H](C(=O)NCC1(C2CC2)CCC1)n1cc[nH+]c1 ZINC001319530947 991887548 /nfs/dbraw/zinc/88/75/48/991887548.db2.gz NNSYWXRNCUAGBH-NSHDSACASA-N 1 2 247.342 2.141 20 0 BEADLO CC(C)c1ocnc1C[N@H+](C)CCn1cccn1 ZINC001319866955 992012424 /nfs/dbraw/zinc/01/24/24/992012424.db2.gz ZEXXEDFDMAJFEU-UHFFFAOYSA-N 1 2 248.330 2.127 20 0 BEADLO CC(C)c1ocnc1C[N@@H+](C)CCn1cccn1 ZINC001319866955 992012434 /nfs/dbraw/zinc/01/24/34/992012434.db2.gz ZEXXEDFDMAJFEU-UHFFFAOYSA-N 1 2 248.330 2.127 20 0 BEADLO C[C@@H](C(=O)N[C@@H]1CC12CCCCC2)n1cc[nH+]c1 ZINC001319864700 992014415 /nfs/dbraw/zinc/01/44/15/992014415.db2.gz AANJQGIXNOBUDA-NWDGAFQWSA-N 1 2 247.342 2.283 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@H](C)c2cccnc2)[nH]n1 ZINC001320138822 992110827 /nfs/dbraw/zinc/11/08/27/992110827.db2.gz YNFGEGNEQULSIP-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO Cc1cc(C[N@H+](C)[C@H](C)c2cccnc2)[nH]n1 ZINC001320138822 992110835 /nfs/dbraw/zinc/11/08/35/992110835.db2.gz YNFGEGNEQULSIP-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO C[C@@H](C(=O)N[C@@H]1CCC(C)(C)C1)n1cc[nH+]c1 ZINC001320486362 992218326 /nfs/dbraw/zinc/21/83/26/992218326.db2.gz BPOMWJHJZCQYIU-WDEREUQCSA-N 1 2 235.331 2.139 20 0 BEADLO C[C@H](C(=O)NC1CCC2(CC2)CC1)n1cc[nH+]c1 ZINC001320917715 992402832 /nfs/dbraw/zinc/40/28/32/992402832.db2.gz KNFCHDCLBMGZTE-LLVKDONJSA-N 1 2 247.342 2.283 20 0 BEADLO CCC[C@@H]([NH2+]Cc1ncn[nH]1)C(C)(C)C ZINC001261639968 992437119 /nfs/dbraw/zinc/43/71/19/992437119.db2.gz RSKLVXJJVLOPHO-SECBINFHSA-N 1 2 210.325 2.109 20 0 BEADLO C=COc1ccc(NC(=O)[C@H]2CC[N@H+]2CC)cc1 ZINC001570210361 992448459 /nfs/dbraw/zinc/44/84/59/992448459.db2.gz UYSVSBKGCLVFJO-CYBMUJFWSA-N 1 2 246.310 2.242 20 0 BEADLO C=COc1ccc(NC(=O)[C@H]2CC[N@@H+]2CC)cc1 ZINC001570210361 992448464 /nfs/dbraw/zinc/44/84/64/992448464.db2.gz UYSVSBKGCLVFJO-CYBMUJFWSA-N 1 2 246.310 2.242 20 0 BEADLO C[C@H](C(=O)N(C)[C@@H]1CCC(C)(C)C1)n1cc[nH+]c1 ZINC001321216972 992490055 /nfs/dbraw/zinc/49/00/55/992490055.db2.gz IVVXIPACMXMALZ-VXGBXAGGSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@@H]1CC=CC[C@H]1COC(=O)[C@H]1CCCC[NH2+]1 ZINC001573633774 992660760 /nfs/dbraw/zinc/66/07/60/992660760.db2.gz BBKBOMLGSVSCEX-FRRDWIJNSA-N 1 2 237.343 2.274 20 0 BEADLO CC(C)(C)c1cn(C[C@@](C)(O)C(F)F)c[nH+]1 ZINC001262168136 992738497 /nfs/dbraw/zinc/73/84/97/992738497.db2.gz MJMKSFUBOHFGEO-LLVKDONJSA-N 1 2 232.274 2.197 20 0 BEADLO Cc1cccc2c1CC[C@@H]2Nc1cc(N)nc[nH+]1 ZINC001262682522 993024216 /nfs/dbraw/zinc/02/42/16/993024216.db2.gz AEMUQWDOTFXWLM-LBPRGKRZSA-N 1 2 240.310 2.467 20 0 BEADLO CCSCC[C@@H](C)N(C)c1cc(N)nc[nH+]1 ZINC001262685472 993026699 /nfs/dbraw/zinc/02/66/99/993026699.db2.gz CIISHXVXHQWEHA-SECBINFHSA-N 1 2 240.376 2.027 20 0 BEADLO CCSCC[C@H](C)N(C)c1cc(N)nc[nH+]1 ZINC001262685473 993028365 /nfs/dbraw/zinc/02/83/65/993028365.db2.gz CIISHXVXHQWEHA-VIFPVBQESA-N 1 2 240.376 2.027 20 0 BEADLO CCc1ccc(N2CCC3(CCO3)CC2)[nH+]c1 ZINC001262695196 993035972 /nfs/dbraw/zinc/03/59/72/993035972.db2.gz UAIDDBMEBUARIB-UHFFFAOYSA-N 1 2 232.327 2.403 20 0 BEADLO CCc1ccc(N2C[C@H](CO)C[C@H](C)C2)[nH+]c1 ZINC001262699972 993040187 /nfs/dbraw/zinc/04/01/87/993040187.db2.gz RDCQIEXRYKLSOT-WCQYABFASA-N 1 2 234.343 2.099 20 0 BEADLO C[C@H](CC[N@H+](C)Cc1cnn[nH]1)c1ccccc1 ZINC001575529309 993061709 /nfs/dbraw/zinc/06/17/09/993061709.db2.gz ISMKCTRKGTUYRS-GFCCVEGCSA-N 1 2 244.342 2.430 20 0 BEADLO C[C@H](CC[N@@H+](C)Cc1cnn[nH]1)c1ccccc1 ZINC001575529309 993061722 /nfs/dbraw/zinc/06/17/22/993061722.db2.gz ISMKCTRKGTUYRS-GFCCVEGCSA-N 1 2 244.342 2.430 20 0 BEADLO C[C@H](CC[N@H+](C)Cc1c[nH]nn1)c1ccccc1 ZINC001575529309 993061731 /nfs/dbraw/zinc/06/17/31/993061731.db2.gz ISMKCTRKGTUYRS-GFCCVEGCSA-N 1 2 244.342 2.430 20 0 BEADLO C[C@H](CC[N@@H+](C)Cc1c[nH]nn1)c1ccccc1 ZINC001575529309 993061740 /nfs/dbraw/zinc/06/17/40/993061740.db2.gz ISMKCTRKGTUYRS-GFCCVEGCSA-N 1 2 244.342 2.430 20 0 BEADLO C[C@H](CC[N@H+](C)Cc1cn[nH]n1)c1ccccc1 ZINC001575529309 993061747 /nfs/dbraw/zinc/06/17/47/993061747.db2.gz ISMKCTRKGTUYRS-GFCCVEGCSA-N 1 2 244.342 2.430 20 0 BEADLO C[C@H](CC[N@@H+](C)Cc1cn[nH]n1)c1ccccc1 ZINC001575529309 993061755 /nfs/dbraw/zinc/06/17/55/993061755.db2.gz ISMKCTRKGTUYRS-GFCCVEGCSA-N 1 2 244.342 2.430 20 0 BEADLO C[C@@H](CC[N@H+](C)Cc1cnn[nH]1)c1ccccc1 ZINC001575529316 993063565 /nfs/dbraw/zinc/06/35/65/993063565.db2.gz ISMKCTRKGTUYRS-LBPRGKRZSA-N 1 2 244.342 2.430 20 0 BEADLO C[C@@H](CC[N@@H+](C)Cc1cnn[nH]1)c1ccccc1 ZINC001575529316 993063575 /nfs/dbraw/zinc/06/35/75/993063575.db2.gz ISMKCTRKGTUYRS-LBPRGKRZSA-N 1 2 244.342 2.430 20 0 BEADLO C[C@@H](CC[N@H+](C)Cc1c[nH]nn1)c1ccccc1 ZINC001575529316 993063584 /nfs/dbraw/zinc/06/35/84/993063584.db2.gz ISMKCTRKGTUYRS-LBPRGKRZSA-N 1 2 244.342 2.430 20 0 BEADLO C[C@@H](CC[N@@H+](C)Cc1c[nH]nn1)c1ccccc1 ZINC001575529316 993063595 /nfs/dbraw/zinc/06/35/95/993063595.db2.gz ISMKCTRKGTUYRS-LBPRGKRZSA-N 1 2 244.342 2.430 20 0 BEADLO C[C@@H](CC[N@H+](C)Cc1cn[nH]n1)c1ccccc1 ZINC001575529316 993063604 /nfs/dbraw/zinc/06/36/04/993063604.db2.gz ISMKCTRKGTUYRS-LBPRGKRZSA-N 1 2 244.342 2.430 20 0 BEADLO C[C@@H](CC[N@@H+](C)Cc1cn[nH]n1)c1ccccc1 ZINC001575529316 993063612 /nfs/dbraw/zinc/06/36/12/993063612.db2.gz ISMKCTRKGTUYRS-LBPRGKRZSA-N 1 2 244.342 2.430 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)CCC1CC1 ZINC001262805298 993068171 /nfs/dbraw/zinc/06/81/71/993068171.db2.gz MBFHRWWKOIVJGQ-UHFFFAOYSA-N 1 2 218.300 2.249 20 0 BEADLO CCC[C@H](C)C(=O)OCCCc1c[nH+]cn1C ZINC001263509806 993352255 /nfs/dbraw/zinc/35/22/55/993352255.db2.gz HXBUWDAFTYIJRJ-NSHDSACASA-N 1 2 238.331 2.332 20 0 BEADLO Nc1cc(Cl)[nH+]c(N[C@H]2CCC[C@@H](O)C2)c1 ZINC000382300067 993447780 /nfs/dbraw/zinc/44/77/80/993447780.db2.gz NEMDVSJDYFNZGP-DTWKUNHWSA-N 1 2 241.722 2.033 20 0 BEADLO CC[C@H](C)c1[nH]c2cc3c(cc2[nH+]1)OCC(=O)N3 ZINC000587956711 993464544 /nfs/dbraw/zinc/46/45/44/993464544.db2.gz VCMISBJXTDSZBJ-ZETCQYMHSA-N 1 2 245.282 2.407 20 0 BEADLO CCOC1C[NH+](Cc2ccc(C#N)cc2C)C1 ZINC000383080470 993480378 /nfs/dbraw/zinc/48/03/78/993480378.db2.gz CDYLSQIQYQICNV-UHFFFAOYSA-N 1 2 230.311 2.087 20 0 BEADLO CO[C@@H](C)CNc1cc(CSC)cc[nH+]1 ZINC000389983714 993772698 /nfs/dbraw/zinc/77/26/98/993772698.db2.gz KRMQIQIDKHFHPD-VIFPVBQESA-N 1 2 226.345 2.391 20 0 BEADLO Cc1ccc(C(=O)Nc2c(C)c[nH+]cc2C)o1 ZINC001288769779 994479258 /nfs/dbraw/zinc/47/92/58/994479258.db2.gz ZWOKPOKYUPPYRM-UHFFFAOYSA-N 1 2 230.267 2.274 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CCC[C@@H]1CC(C)C ZINC001292677902 994623503 /nfs/dbraw/zinc/62/35/03/994623503.db2.gz WUQJUARFPIVYJK-GFCCVEGCSA-N 1 2 249.358 2.298 20 0 BEADLO CC[C@H]1CCC[C@H](NC(=O)Cc2[nH]c[nH+]c2C)C1 ZINC001293702020 994660210 /nfs/dbraw/zinc/66/02/10/994660210.db2.gz GRKYTGVGVSRADO-RYUDHWBXSA-N 1 2 249.358 2.346 20 0 BEADLO CC(C)c1oncc1NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001336052135 994945057 /nfs/dbraw/zinc/94/50/57/994945057.db2.gz GMJGXULVERSKFH-VIFPVBQESA-N 1 2 248.286 2.194 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)Nc1cscc1Cl ZINC001303267354 995145732 /nfs/dbraw/zinc/14/57/32/995145732.db2.gz UQELOCXNWAZESL-UHFFFAOYSA-N 1 2 241.703 2.306 20 0 BEADLO CCc1ccc(N2CC[C@@H](n3cccn3)C2)[nH+]c1 ZINC001337179085 995150965 /nfs/dbraw/zinc/15/09/65/995150965.db2.gz KTVORQDJCMYTSD-CYBMUJFWSA-N 1 2 242.326 2.292 20 0 BEADLO CCc1cn(CC(=O)c2cc(C)ccn2)c[nH+]1 ZINC001307397511 995342437 /nfs/dbraw/zinc/34/24/37/995342437.db2.gz QZIZBQUGPGPVRY-UHFFFAOYSA-N 1 2 229.283 2.032 20 0 BEADLO c1ccc(NCc2ccc3c(c2)OCCO3)[nH+]c1 ZINC000019777068 1170131186 /nfs/dbraw/zinc/13/11/86/1170131186.db2.gz KCDFSZVMBSZERQ-UHFFFAOYSA-N 1 2 242.278 2.465 20 0 BEADLO Cc1ncoc1CNc1cc2cc[nH]c2c[nH+]1 ZINC001620989006 1170180375 /nfs/dbraw/zinc/18/03/75/1170180375.db2.gz YILQZYCNLBQBFE-UHFFFAOYSA-N 1 2 228.255 2.471 20 0 BEADLO CCc1cn(Cc2nnc(-c3ccco3)o2)c[nH+]1 ZINC001614965822 1170501382 /nfs/dbraw/zinc/50/13/82/1170501382.db2.gz DQCYSKQXXGVVGO-UHFFFAOYSA-N 1 2 244.254 2.137 20 0 BEADLO Cc1occc1C(=O)Nc1c(C)c[nH+]cc1C ZINC001616245849 1170544635 /nfs/dbraw/zinc/54/46/35/1170544635.db2.gz BMRMYAMSFPWGOR-UHFFFAOYSA-N 1 2 230.267 2.274 20 0 BEADLO Cc1cc(C[N@@H+]2Cc3c[nH]nc3[C@H](C)C2)sn1 ZINC001620483374 1170673845 /nfs/dbraw/zinc/67/38/45/1170673845.db2.gz NPMKNWFGVUIJIJ-MRVPVSSYSA-N 1 2 248.355 2.294 20 0 BEADLO Cc1cc(C[N@H+]2Cc3c[nH]nc3[C@H](C)C2)sn1 ZINC001620483374 1170673849 /nfs/dbraw/zinc/67/38/49/1170673849.db2.gz NPMKNWFGVUIJIJ-MRVPVSSYSA-N 1 2 248.355 2.294 20 0 BEADLO CCn1ccc(C[NH2+][C@H](C)c2ccccn2)n1 ZINC001620695584 1170706090 /nfs/dbraw/zinc/70/60/90/1170706090.db2.gz ZVKXMAOAFUAHLD-LLVKDONJSA-N 1 2 230.315 2.149 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1cc(F)ccc1N ZINC000036322336 1170912376 /nfs/dbraw/zinc/91/23/76/1170912376.db2.gz ZKLMPOFBGGJKEK-LBPRGKRZSA-N 1 2 238.306 2.019 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1cc(F)ccc1N ZINC000036322336 1170912378 /nfs/dbraw/zinc/91/23/78/1170912378.db2.gz ZKLMPOFBGGJKEK-LBPRGKRZSA-N 1 2 238.306 2.019 20 0 BEADLO CC(C)[C@@H]1CCCCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC001624054194 1171003521 /nfs/dbraw/zinc/00/35/21/1171003521.db2.gz FOGQGBHLGUZTEO-ZDUSSCGKSA-N 1 2 249.358 2.379 20 0 BEADLO CCO/C=C\C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC001627313058 1171163880 /nfs/dbraw/zinc/16/38/80/1171163880.db2.gz FVLVFXMFBYJZFB-SREVYHEPSA-N 1 2 245.282 2.131 20 0 BEADLO C[C@@H](NC(=O)[C@@H](C)n1cc[nH+]c1)c1cccs1 ZINC000044817666 1171414437 /nfs/dbraw/zinc/41/44/37/1171414437.db2.gz XCUJASHLSHFQDP-NXEZZACHSA-N 1 2 249.339 2.383 20 0 BEADLO O=C(NCc1ccoc1)c1cc2c[nH+]ccc2[nH]1 ZINC001631346779 1171450503 /nfs/dbraw/zinc/45/05/03/1171450503.db2.gz VFQWVLGSVFMTID-UHFFFAOYSA-N 1 2 241.250 2.086 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)[C@H](C)C(C)(C)C ZINC001631676519 1171472735 /nfs/dbraw/zinc/47/27/35/1171472735.db2.gz MEKOZCQDXTUFES-SNVBAGLBSA-N 1 2 237.347 2.154 20 0 BEADLO C=C/C=C/CC(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC001632283274 1171502269 /nfs/dbraw/zinc/50/22/69/1171502269.db2.gz QJDPYQKFOVYBTF-PCAWENJQSA-N 1 2 245.326 2.248 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@H]1CC12CCCCC2 ZINC001632955353 1171545245 /nfs/dbraw/zinc/54/52/45/1171545245.db2.gz JBMZMWLQZVRQPP-LBPRGKRZSA-N 1 2 247.342 2.100 20 0 BEADLO C[C@H](NC(=O)Cc1c[nH]c[nH+]1)C1CCCCCC1 ZINC001633719678 1171601014 /nfs/dbraw/zinc/60/10/14/1171601014.db2.gz JCPLLBKHSGCGNU-NSHDSACASA-N 1 2 249.358 2.427 20 0 BEADLO C[C@H](C(=O)Nc1ccccc1)n1cc[nH+]c1 ZINC000049247772 1171682126 /nfs/dbraw/zinc/68/21/26/1171682126.db2.gz PPPLNHWNQSBRCL-SNVBAGLBSA-N 1 2 215.256 2.083 20 0 BEADLO C[C@@H](C(=O)N1CCc2ccccc21)n1cc[nH+]c1 ZINC000049247824 1171683313 /nfs/dbraw/zinc/68/33/13/1171683313.db2.gz RSZZOLOYZJALGL-NSHDSACASA-N 1 2 241.294 2.033 20 0 BEADLO C[C@@H]1CC(=O)CC[N@@H+]1Cc1cccs1 ZINC000049712687 1171721863 /nfs/dbraw/zinc/72/18/63/1171721863.db2.gz PRQUGWQVJRQWMX-SECBINFHSA-N 1 2 209.314 2.302 20 0 BEADLO C[C@@H]1CC(=O)CC[N@H+]1Cc1cccs1 ZINC000049712687 1171721869 /nfs/dbraw/zinc/72/18/69/1171721869.db2.gz PRQUGWQVJRQWMX-SECBINFHSA-N 1 2 209.314 2.302 20 0 BEADLO C[C@H]1C[N@H+](Cc2cccs2)CCC1=O ZINC000049693703 1171722431 /nfs/dbraw/zinc/72/24/31/1171722431.db2.gz DEEQFTYYKSAPJI-VIFPVBQESA-N 1 2 209.314 2.159 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cccs2)CCC1=O ZINC000049693703 1171722438 /nfs/dbraw/zinc/72/24/38/1171722438.db2.gz DEEQFTYYKSAPJI-VIFPVBQESA-N 1 2 209.314 2.159 20 0 BEADLO CC(Cl)=CC(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001636016566 1171785445 /nfs/dbraw/zinc/78/54/45/1171785445.db2.gz AQRYXWNCEWVCSC-XBXARRHUSA-N 1 2 241.722 2.292 20 0 BEADLO C/C(Cl)=C\C(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001636016566 1171785451 /nfs/dbraw/zinc/78/54/51/1171785451.db2.gz AQRYXWNCEWVCSC-XBXARRHUSA-N 1 2 241.722 2.292 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)CC(C)(F)F)[nH+]1 ZINC001636017174 1171785930 /nfs/dbraw/zinc/78/59/30/1171785930.db2.gz ZVYAYFRKNNWGTL-UHFFFAOYSA-N 1 2 245.273 2.195 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)CC(C)(F)F)c[nH+]1 ZINC001636017174 1171785934 /nfs/dbraw/zinc/78/59/34/1171785934.db2.gz ZVYAYFRKNNWGTL-UHFFFAOYSA-N 1 2 245.273 2.195 20 0 BEADLO CCCc1nnc([C@H]([NH3+])c2ccccc2)o1 ZINC000050283996 1171788431 /nfs/dbraw/zinc/78/84/31/1171788431.db2.gz MPKKCWDHUMSIOC-LLVKDONJSA-N 1 2 217.272 2.070 20 0 BEADLO CCCC[C@H](C)[NH2+]CC(=O)OC(C)(C)C ZINC000050888538 1171849419 /nfs/dbraw/zinc/84/94/19/1171849419.db2.gz HZMPYCQYGVDZBK-JTQLQIEISA-N 1 2 215.337 2.496 20 0 BEADLO CC(C)[C@@H]1CCCCCN1C(=O)Cn1cc[nH+]c1 ZINC001637378265 1171923639 /nfs/dbraw/zinc/92/36/39/1171923639.db2.gz LNVSQODRSRXUFV-ZDUSSCGKSA-N 1 2 249.358 2.310 20 0 BEADLO C[C@H](C(=O)N(C)[C@H]1CCCC[C@H]1C)n1cc[nH+]c1 ZINC000052433167 1171964501 /nfs/dbraw/zinc/96/45/01/1171964501.db2.gz OCPCYRWPOKFAIP-UPJWGTAASA-N 1 2 249.358 2.481 20 0 BEADLO CCC(C)(CC)NC(=O)c1c[nH+]c(C)[nH]1 ZINC000270042028 168310149 /nfs/dbraw/zinc/31/01/49/168310149.db2.gz CZKDWBZCALTQBL-UHFFFAOYSA-N 1 2 209.293 2.027 20 0 BEADLO C[C@@H](NC(=O)C[C@H](C)n1cc[nH+]c1)C1CCC1 ZINC000649865340 398145776 /nfs/dbraw/zinc/14/57/76/398145776.db2.gz UHOARQODSNWBKC-WDEREUQCSA-N 1 2 235.331 2.139 20 0 BEADLO CCC[C@@H](OC)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000297845797 398146872 /nfs/dbraw/zinc/14/68/72/398146872.db2.gz RQWVGBFYPVNMGK-LLVKDONJSA-N 1 2 247.298 2.088 20 0 BEADLO Cc1ccnc(C[N@H+](C)Cc2cccs2)n1 ZINC000336701896 187321783 /nfs/dbraw/zinc/32/17/83/187321783.db2.gz MEBXGFXEIWPYQC-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ccnc(C[N@@H+](C)Cc2cccs2)n1 ZINC000336701896 187321784 /nfs/dbraw/zinc/32/17/84/187321784.db2.gz MEBXGFXEIWPYQC-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO C[C@@H]1CC[C@@H](C)N1C(=O)CCCn1cc[nH+]c1 ZINC000161790029 538918901 /nfs/dbraw/zinc/91/89/01/538918901.db2.gz AKXNNVYQAUGPEA-VXGBXAGGSA-N 1 2 235.331 2.063 20 0 BEADLO Cc1cc2[nH+]cn(C[C@@H](C)CO)c2cc1C ZINC000162077191 538920685 /nfs/dbraw/zinc/92/06/85/538920685.db2.gz VFLFYVQNXRCNDL-SECBINFHSA-N 1 2 218.300 2.282 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3sccc3C2)nn1C ZINC000336686972 178003393 /nfs/dbraw/zinc/00/33/93/178003393.db2.gz GIQCKFTYMLEFAZ-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1cc(C[N@H+]2CCc3sccc3C2)nn1C ZINC000336686972 178003396 /nfs/dbraw/zinc/00/33/96/178003396.db2.gz GIQCKFTYMLEFAZ-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1cc(C[N@@H+]2CC[S@@](=O)[C@H](C)C2)cs1 ZINC000336224007 178004071 /nfs/dbraw/zinc/00/40/71/178004071.db2.gz AXVKVEWSEVJNMX-MEBBXXQBSA-N 1 2 243.397 2.009 20 0 BEADLO Cc1cc(C[N@H+]2CC[S@@](=O)[C@H](C)C2)cs1 ZINC000336224007 178004072 /nfs/dbraw/zinc/00/40/72/178004072.db2.gz AXVKVEWSEVJNMX-MEBBXXQBSA-N 1 2 243.397 2.009 20 0 BEADLO CC(=O)Nc1ccc(C[NH2+][C@@H](C)C(F)F)cc1 ZINC000389965411 398153298 /nfs/dbraw/zinc/15/32/98/398153298.db2.gz MCUPZUFUBKOHOP-QMMMGPOBSA-N 1 2 242.269 2.388 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccccc2F)on1 ZINC000044300994 178027446 /nfs/dbraw/zinc/02/74/46/178027446.db2.gz MYHROMZRNYRGFU-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO Cc1ccc(NCc2cocn2)c(C)[nH+]1 ZINC000276976770 398172499 /nfs/dbraw/zinc/17/24/99/398172499.db2.gz GHWJSDGVLHWJCJ-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO F[C@@]1(c2ccccc2)C[C@H]1NCc1[nH]cc[nH+]1 ZINC000424204294 398174930 /nfs/dbraw/zinc/17/49/30/398174930.db2.gz VIGWXFKGHTUWLB-DGCLKSJQSA-N 1 2 231.274 2.137 20 0 BEADLO F[C@@]1(c2ccccc2)C[C@H]1[NH2+]Cc1ncc[nH]1 ZINC000424204294 398174933 /nfs/dbraw/zinc/17/49/33/398174933.db2.gz VIGWXFKGHTUWLB-DGCLKSJQSA-N 1 2 231.274 2.137 20 0 BEADLO Cc1ccc(C[N@@H+](C)[C@H](C)c2cnccn2)nc1 ZINC000649903048 398177406 /nfs/dbraw/zinc/17/74/06/398177406.db2.gz NQVPSDTVOVCXFT-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1ccc(C[N@H+](C)[C@H](C)c2cnccn2)nc1 ZINC000649903048 398177410 /nfs/dbraw/zinc/17/74/10/398177410.db2.gz NQVPSDTVOVCXFT-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cccc(NC(=O)NCc2[nH]cc[nH+]2)c1 ZINC000080606718 398182151 /nfs/dbraw/zinc/18/21/51/398182151.db2.gz KZFVUUOQZZNOPN-UHFFFAOYSA-N 1 2 230.271 2.040 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+]1CCO[C@@H]2C[C@@H]21 ZINC000368635177 178085243 /nfs/dbraw/zinc/08/52/43/178085243.db2.gz RHMLCZRKJYDNQB-QWHCGFSZSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1cc(F)ccc1C[N@H+]1CCO[C@@H]2C[C@@H]21 ZINC000368635177 178085245 /nfs/dbraw/zinc/08/52/45/178085245.db2.gz RHMLCZRKJYDNQB-QWHCGFSZSA-N 1 2 221.275 2.107 20 0 BEADLO F[C@H]1CC[N@H+](Cc2noc3c2CCCC3)C1 ZINC000649938222 398191460 /nfs/dbraw/zinc/19/14/60/398191460.db2.gz DSGUNABKJCJJFL-VIFPVBQESA-N 1 2 224.279 2.097 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2noc3c2CCCC3)C1 ZINC000649938222 398191465 /nfs/dbraw/zinc/19/14/65/398191465.db2.gz DSGUNABKJCJJFL-VIFPVBQESA-N 1 2 224.279 2.097 20 0 BEADLO Cc1cc([NH+](C)C)ccc1NCc1cncn1C ZINC000090165386 178095165 /nfs/dbraw/zinc/09/51/65/178095165.db2.gz VRDBIYXWOLPBCG-UHFFFAOYSA-N 1 2 244.342 2.407 20 0 BEADLO Cc1cc(N(C)CC(F)F)nc(C2CC2)[nH+]1 ZINC000341478980 178097678 /nfs/dbraw/zinc/09/76/78/178097678.db2.gz HOYRCAFHCRJWEW-UHFFFAOYSA-N 1 2 227.258 2.364 20 0 BEADLO Cc1cc(N(C)CCCCCO)nc(C2CC2)[nH+]1 ZINC000278946436 178098319 /nfs/dbraw/zinc/09/83/19/178098319.db2.gz WUIVIQKXGKLYKG-UHFFFAOYSA-N 1 2 249.358 2.261 20 0 BEADLO Cc1cc(N(C)[C@@H]2CCOC2)nc(C(C)C)[nH+]1 ZINC000112966644 178101097 /nfs/dbraw/zinc/10/10/97/178101097.db2.gz PCLBFMATLJMWOX-LLVKDONJSA-N 1 2 235.331 2.134 20 0 BEADLO Cc1cc(N2CCC[C@@H](C)CC2)nc[nH+]1 ZINC000301223418 178115171 /nfs/dbraw/zinc/11/51/71/178115171.db2.gz CCHJWAHVSMIIIR-SNVBAGLBSA-N 1 2 205.305 2.411 20 0 BEADLO Cc1cc(N(CC(C)C)C2CC2)nc[nH+]1 ZINC000301232303 178101895 /nfs/dbraw/zinc/10/18/95/178101895.db2.gz BEXKLQLTRPXBSL-UHFFFAOYSA-N 1 2 205.305 2.410 20 0 BEADLO CC(=O)Nc1ccccc1C[NH2+]CC(C)(F)F ZINC000576245014 365536692 /nfs/dbraw/zinc/53/66/92/365536692.db2.gz JRDFJIGGVCCKET-UHFFFAOYSA-N 1 2 242.269 2.390 20 0 BEADLO Cc1cc(N)nc(SCCc2cccnc2)[nH+]1 ZINC000096570050 178108800 /nfs/dbraw/zinc/10/88/00/178108800.db2.gz CMTHHYKISHOIQV-UHFFFAOYSA-N 1 2 246.339 2.097 20 0 BEADLO Cc1cc(N)nc(SCC[C@H]2CCCO2)[nH+]1 ZINC000148600392 178109800 /nfs/dbraw/zinc/10/98/00/178109800.db2.gz NCOUTHIKKQZBKL-SECBINFHSA-N 1 2 239.344 2.028 20 0 BEADLO Cc1cc(N2CCC[C@H](O)CC2)nc(C(C)C)[nH+]1 ZINC000338837662 178115707 /nfs/dbraw/zinc/11/57/07/178115707.db2.gz RPCMEIIKTBXGCV-LBPRGKRZSA-N 1 2 249.358 2.260 20 0 BEADLO Cc1cc(N2CCC[C@H](C)CC2)nc[nH+]1 ZINC000301223417 178116353 /nfs/dbraw/zinc/11/63/53/178116353.db2.gz CCHJWAHVSMIIIR-JTQLQIEISA-N 1 2 205.305 2.411 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2cccc(F)c2N)[C@@H]1C ZINC000380586047 398201170 /nfs/dbraw/zinc/20/11/70/398201170.db2.gz QSBKJKVSVHDJFC-NXEZZACHSA-N 1 2 238.306 2.017 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2cccc(F)c2N)[C@@H]1C ZINC000380586047 398201172 /nfs/dbraw/zinc/20/11/72/398201172.db2.gz QSBKJKVSVHDJFC-NXEZZACHSA-N 1 2 238.306 2.017 20 0 BEADLO Cc1cc(N2CC[C@@H]([C@H](C)O)C2)nc(C(C)C)[nH+]1 ZINC000228159591 178118120 /nfs/dbraw/zinc/11/81/20/178118120.db2.gz CXSJULJAMUMUHC-NWDGAFQWSA-N 1 2 249.358 2.116 20 0 BEADLO Cc1cc(NC(=O)CC2CCOCC2)cc[nH+]1 ZINC000117258483 178126297 /nfs/dbraw/zinc/12/62/97/178126297.db2.gz MUFAXZNVAMCZIN-UHFFFAOYSA-N 1 2 234.299 2.145 20 0 BEADLO Cc1cc(NC(=O)CC[C@H]2CCOC2)cc[nH+]1 ZINC000175861641 178128854 /nfs/dbraw/zinc/12/88/54/178128854.db2.gz XTKLKBSQFZJMSU-NSHDSACASA-N 1 2 234.299 2.145 20 0 BEADLO CC(C)(C)c1nc(N[C@H]2CCOC2(C)C)cc[nH+]1 ZINC000649403199 398205042 /nfs/dbraw/zinc/20/50/42/398205042.db2.gz ZKESJUUSYLJZQB-JTQLQIEISA-N 1 2 249.358 2.175 20 0 BEADLO Cc1cc(NC(=O)CSC(F)F)cc[nH+]1 ZINC000295021610 178132315 /nfs/dbraw/zinc/13/23/15/178132315.db2.gz ZKTPBXGZANPONV-UHFFFAOYSA-N 1 2 232.255 2.284 20 0 BEADLO Cc1cc(NC(=O)Cc2ccco2)cc[nH+]1 ZINC000074696959 178134126 /nfs/dbraw/zinc/13/41/26/178134126.db2.gz QEJMEBSNABCCKE-UHFFFAOYSA-N 1 2 216.240 2.164 20 0 BEADLO Cc1cc(NC(=O)NC[C@@]2(C)CCCO2)cc[nH+]1 ZINC000119837454 178140785 /nfs/dbraw/zinc/14/07/85/178140785.db2.gz LXGDKMXGVQFKOK-CYBMUJFWSA-N 1 2 249.314 2.081 20 0 BEADLO Cc1cc(NC(=O)NC[C@]2(C)CCCO2)cc[nH+]1 ZINC000119837295 178141313 /nfs/dbraw/zinc/14/13/13/178141313.db2.gz LXGDKMXGVQFKOK-ZDUSSCGKSA-N 1 2 249.314 2.081 20 0 BEADLO C[C@@H](CC(=O)N(C)CC1CCCC1)n1cc[nH+]c1 ZINC000576349475 365573469 /nfs/dbraw/zinc/57/34/69/365573469.db2.gz HNKJWXJLKRQZJK-LBPRGKRZSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CCO[C@@H](C)C2)cc[nH+]1 ZINC000271837139 178147859 /nfs/dbraw/zinc/14/78/59/178147859.db2.gz AKHBDNTZRVQGOS-QWRGUYRKSA-N 1 2 234.299 2.144 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CCCO[C@@H]2C)cc[nH+]1 ZINC000191633068 178147942 /nfs/dbraw/zinc/14/79/42/178147942.db2.gz FVJQVWUCAKIBCA-PWSUYJOCSA-N 1 2 234.299 2.144 20 0 BEADLO CC(C)C[C@@H](C)CC(=O)NCc1c[nH+]c[nH]1 ZINC000331089347 398217501 /nfs/dbraw/zinc/21/75/01/398217501.db2.gz UAYJJNGCJHAYPQ-SNVBAGLBSA-N 1 2 223.320 2.098 20 0 BEADLO CC(C)C[C@@H](C)CC(=O)NCc1c[nH]c[nH+]1 ZINC000331089347 398217505 /nfs/dbraw/zinc/21/75/05/398217505.db2.gz UAYJJNGCJHAYPQ-SNVBAGLBSA-N 1 2 223.320 2.098 20 0 BEADLO Cc1cc(NC(=O)c2cc(C(C)C)[nH]n2)cc[nH+]1 ZINC000078892473 178149117 /nfs/dbraw/zinc/14/91/17/178149117.db2.gz ADWZTAPRPLWMGF-UHFFFAOYSA-N 1 2 244.298 2.489 20 0 BEADLO Cc1cc(NC(=O)c2cn(C(C)C)cn2)cc[nH+]1 ZINC000281333318 178151983 /nfs/dbraw/zinc/15/19/83/178151983.db2.gz SBRJXRJEXHYJBO-UHFFFAOYSA-N 1 2 244.298 2.420 20 0 BEADLO Cc1cc(NC2(CO)CCC2)nc(C(C)C)[nH+]1 ZINC000122149593 178152470 /nfs/dbraw/zinc/15/24/70/178152470.db2.gz WMVVFQRRECPBAA-UHFFFAOYSA-N 1 2 235.331 2.235 20 0 BEADLO Cc1cc(NC[C@@H]2CCOC2)nc(C2CC2)[nH+]1 ZINC000116260279 178166359 /nfs/dbraw/zinc/16/63/59/178166359.db2.gz BOMCLHKLEYIREY-JTQLQIEISA-N 1 2 233.315 2.111 20 0 BEADLO CC1(CC(=O)NCCCNc2cccc[nH+]2)CC1 ZINC000429784791 398225317 /nfs/dbraw/zinc/22/53/17/398225317.db2.gz AAIGRKJVAOHPKI-UHFFFAOYSA-N 1 2 247.342 2.190 20 0 BEADLO Cc1cc(NC[C@@H]2Cc3ccccc3O2)nc[nH+]1 ZINC000040727328 178167625 /nfs/dbraw/zinc/16/76/25/178167625.db2.gz YDENWKJXOWHSNV-LBPRGKRZSA-N 1 2 241.294 2.201 20 0 BEADLO Cc1cc(NC[C@@H]2CC[C@H](O)C2)nc(C2CC2)[nH+]1 ZINC000191638616 178167872 /nfs/dbraw/zinc/16/78/72/178167872.db2.gz BAYXIRGSERGIFY-PWSUYJOCSA-N 1 2 247.342 2.235 20 0 BEADLO Cc1cc(NC[C@H](O)C(C)(C)C)nc(C2CC2)[nH+]1 ZINC000265392203 178168436 /nfs/dbraw/zinc/16/84/36/178168436.db2.gz UWSZLJYKMKWJNN-NSHDSACASA-N 1 2 249.358 2.481 20 0 BEADLO Cc1cc(NC[C@H](C)CCCO)nc(C2CC2)[nH+]1 ZINC000295056222 178168571 /nfs/dbraw/zinc/16/85/71/178168571.db2.gz YEPUHCNZAOELPT-SNVBAGLBSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1ccc(C(=O)Nc2cc[nH+]c(C)c2)cn1 ZINC000066779027 136221896 /nfs/dbraw/zinc/22/18/96/136221896.db2.gz WPTIEAYTVYNBNQ-UHFFFAOYSA-N 1 2 227.267 2.346 20 0 BEADLO Cc1cc(NCc2ccncc2C)nc[nH+]1 ZINC000129874939 178175159 /nfs/dbraw/zinc/17/51/59/178175159.db2.gz HUWLCHAKPRRBEQ-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO Cc1cc(NCc2ccsc2)nc[nH+]1 ZINC000063153144 178175585 /nfs/dbraw/zinc/17/55/85/178175585.db2.gz LASPSWDROJZTOJ-UHFFFAOYSA-N 1 2 205.286 2.459 20 0 BEADLO Cc1cc(N[C@@H](C)[C@@H]2CCOC2)nc(C2CC2)[nH+]1 ZINC000266287722 178178089 /nfs/dbraw/zinc/17/80/89/178178089.db2.gz VVWPSNRPBUDVBO-CMPLNLGQSA-N 1 2 247.342 2.499 20 0 BEADLO Cc1[nH]ccc1C(=O)Nc1ccc[nH+]c1N(C)C ZINC000175754643 365590779 /nfs/dbraw/zinc/59/07/79/365590779.db2.gz IVZFWZVADWYZCD-UHFFFAOYSA-N 1 2 244.298 2.036 20 0 BEADLO Cc1cc(N[C@@H]2CS[C@@H](C)C2)nc[nH+]1 ZINC000307563381 178182848 /nfs/dbraw/zinc/18/28/48/178182848.db2.gz CCHDWUNPZVZLCJ-IUCAKERBSA-N 1 2 209.318 2.091 20 0 BEADLO Cc1cc(N[C@@H]2C[C@H](O)C2(C)C)nc(C2CC2)[nH+]1 ZINC000189211410 178184308 /nfs/dbraw/zinc/18/43/08/178184308.db2.gz AIWYHCYXWAXWHQ-MNOVXSKESA-N 1 2 247.342 2.234 20 0 BEADLO Cc1cc(N[C@@H]2[C@H]3CCO[C@H]3C2(C)C)nc[nH+]1 ZINC000301340696 178184895 /nfs/dbraw/zinc/18/48/95/178184895.db2.gz HYFQIEHTACFCKU-YUSALJHKSA-N 1 2 233.315 2.010 20 0 BEADLO Cc1cc(N[C@H](C)[C@H](C)CO)nc(C(C)C)[nH+]1 ZINC000134959502 178186347 /nfs/dbraw/zinc/18/63/47/178186347.db2.gz WACDQXXAEXDXDX-MWLCHTKSSA-N 1 2 237.347 2.337 20 0 BEADLO Cc1cc(N[C@H](C)CO)c2cccc(F)c2[nH+]1 ZINC000268856894 178186420 /nfs/dbraw/zinc/18/64/20/178186420.db2.gz ZKOGESCAHUMALM-SECBINFHSA-N 1 2 234.274 2.475 20 0 BEADLO Cc1cc(N[C@H](CCO)c2cccs2)nc[nH+]1 ZINC000301382524 178186826 /nfs/dbraw/zinc/18/68/26/178186826.db2.gz ZFGXFXNJVIVXBR-SNVBAGLBSA-N 1 2 249.339 2.382 20 0 BEADLO Cc1cc(N[C@H]2COc3ccc(F)cc32)nc[nH+]1 ZINC000341669665 178189827 /nfs/dbraw/zinc/18/98/27/178189827.db2.gz VJRVJGLPJPMWFF-NSHDSACASA-N 1 2 245.257 2.470 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(O[C@H]2CCOC2)cc1 ZINC000649428139 398229436 /nfs/dbraw/zinc/22/94/36/398229436.db2.gz IXOGQEGXZPRPCM-ZDUSSCGKSA-N 1 2 244.294 2.255 20 0 BEADLO Cc1cc(N[C@H]2C[C@@H](C)n3ccnc32)nc[nH+]1 ZINC000333742326 178191592 /nfs/dbraw/zinc/19/15/92/178191592.db2.gz WCXQNHMJBCIWFK-ZJUUUORDSA-N 1 2 229.287 2.099 20 0 BEADLO Cc1cc(N[C@H]2C[C@@H](O)C2(C)C)nc(C2CC2)[nH+]1 ZINC000189211478 178192286 /nfs/dbraw/zinc/19/22/86/178192286.db2.gz AIWYHCYXWAXWHQ-WDEREUQCSA-N 1 2 247.342 2.234 20 0 BEADLO CN(CC1(C)COC1)c1cc[nH+]c2ccncc21 ZINC000624528471 343987727 /nfs/dbraw/zinc/98/77/27/343987727.db2.gz XHYNPJNHBNSJSK-UHFFFAOYSA-N 1 2 243.310 2.103 20 0 BEADLO COc1ccc(-c2c[nH+]cn2C)cc1OC ZINC000649424924 398226662 /nfs/dbraw/zinc/22/66/62/398226662.db2.gz TZGLWPSYZRARHC-UHFFFAOYSA-N 1 2 218.256 2.104 20 0 BEADLO COC1C[NH+](Cc2cccc(C3CC3)c2)C1 ZINC000421388798 192327357 /nfs/dbraw/zinc/32/73/57/192327357.db2.gz WBOWUPYHCRPWKV-UHFFFAOYSA-N 1 2 217.312 2.395 20 0 BEADLO CC[C@@H](C)[C@@H](CNc1cc(CO)cc[nH+]1)OC ZINC000381155517 398227991 /nfs/dbraw/zinc/22/79/91/398227991.db2.gz MKUBOGBZFVDYJD-ZYHUDNBSSA-N 1 2 238.331 2.047 20 0 BEADLO FC(F)C[N@@H+]1CCSC[C@H]1C1CC1 ZINC000650057758 398228661 /nfs/dbraw/zinc/22/86/61/398228661.db2.gz YVFHJVKWZQZGKM-QMMMGPOBSA-N 1 2 207.289 2.079 20 0 BEADLO FC(F)C[N@H+]1CCSC[C@H]1C1CC1 ZINC000650057758 398228663 /nfs/dbraw/zinc/22/86/63/398228663.db2.gz YVFHJVKWZQZGKM-QMMMGPOBSA-N 1 2 207.289 2.079 20 0 BEADLO FC(F)C[N@@H+]1CCSC[C@@H]1C1CC1 ZINC000650057757 398228863 /nfs/dbraw/zinc/22/88/63/398228863.db2.gz YVFHJVKWZQZGKM-MRVPVSSYSA-N 1 2 207.289 2.079 20 0 BEADLO FC(F)C[N@H+]1CCSC[C@@H]1C1CC1 ZINC000650057757 398228865 /nfs/dbraw/zinc/22/88/65/398228865.db2.gz YVFHJVKWZQZGKM-MRVPVSSYSA-N 1 2 207.289 2.079 20 0 BEADLO Clc1ccc(C[N@@H+]2CC[C@@]23CCOC3)o1 ZINC000421394749 192329893 /nfs/dbraw/zinc/32/98/93/192329893.db2.gz HCFWYXPYUSUEBS-NSHDSACASA-N 1 2 227.691 2.298 20 0 BEADLO Clc1ccc(C[N@H+]2CC[C@@]23CCOC3)o1 ZINC000421394749 192329895 /nfs/dbraw/zinc/32/98/95/192329895.db2.gz HCFWYXPYUSUEBS-NSHDSACASA-N 1 2 227.691 2.298 20 0 BEADLO CC(C)[C@@H](C)N(C(=O)CCc1c[nH+]c[nH]1)C1CC1 ZINC000276640971 538933036 /nfs/dbraw/zinc/93/30/36/538933036.db2.gz UWYZQTPCICJZPR-LLVKDONJSA-N 1 2 249.358 2.378 20 0 BEADLO CC(C)[C@@H](C)N(C(=O)CCc1c[nH]c[nH+]1)C1CC1 ZINC000276640971 538933037 /nfs/dbraw/zinc/93/30/37/538933037.db2.gz UWYZQTPCICJZPR-LLVKDONJSA-N 1 2 249.358 2.378 20 0 BEADLO CCC(CC)CNC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000330974864 168354859 /nfs/dbraw/zinc/35/48/59/168354859.db2.gz SSUNPUSNLOBIBD-UHFFFAOYSA-N 1 2 237.347 2.240 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2ncc[nH]2)c(C)o1 ZINC000044730055 178228600 /nfs/dbraw/zinc/22/86/00/178228600.db2.gz IDBXQJNGVMBYBA-SECBINFHSA-N 1 2 219.288 2.470 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2nccs2)nn1C ZINC000282240124 178228971 /nfs/dbraw/zinc/22/89/71/178228971.db2.gz PWTJAHHMVWMHRH-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2c(C)noc2C)no1 ZINC000279593678 178229494 /nfs/dbraw/zinc/22/94/94/178229494.db2.gz OMWHVIKIAZINIM-SECBINFHSA-N 1 2 235.287 2.439 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2ncnn2C)ccc1F ZINC000269011599 178229750 /nfs/dbraw/zinc/22/97/50/178229750.db2.gz XPQDUEHAGPCXSZ-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2ccco2)no1 ZINC000280891672 178229781 /nfs/dbraw/zinc/22/97/81/178229781.db2.gz DEJJGVLLSIAPDR-SECBINFHSA-N 1 2 206.245 2.427 20 0 BEADLO COCCOc1cccc(-c2c[nH+]cn2C)c1 ZINC000649429174 398230969 /nfs/dbraw/zinc/23/09/69/398230969.db2.gz PYAPPDIWVAGUDZ-UHFFFAOYSA-N 1 2 232.283 2.112 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2cn[nH]c2)no1 ZINC000309553355 178230754 /nfs/dbraw/zinc/23/07/54/178230754.db2.gz IXWPBUKVBUFOKI-DTWKUNHWSA-N 1 2 220.276 2.118 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2nncn2C)oc1C ZINC000282078843 178231506 /nfs/dbraw/zinc/23/15/06/178231506.db2.gz HMTIWLXIWRXQEU-ZJUUUORDSA-N 1 2 248.330 2.437 20 0 BEADLO Cc1cc(N(C)Cc2cccs2)nc[nH+]1 ZINC000334316449 136225240 /nfs/dbraw/zinc/22/52/40/136225240.db2.gz SNNPEJFFVBNQFA-UHFFFAOYSA-N 1 2 219.313 2.483 20 0 BEADLO Cc1cccc(CCNc2ncc(C)c(C)n2)[nH+]1 ZINC000280126760 538936683 /nfs/dbraw/zinc/93/66/83/538936683.db2.gz AWNMGGPARHUSSB-UHFFFAOYSA-N 1 2 242.326 2.451 20 0 BEADLO CN(Cc1cccs1)C(=O)CCc1c[nH+]c[nH]1 ZINC000280383696 538936923 /nfs/dbraw/zinc/93/69/23/538936923.db2.gz WGOXAWZMKCLSFK-UHFFFAOYSA-N 1 2 249.339 2.062 20 0 BEADLO CN(Cc1cccs1)C(=O)CCc1c[nH]c[nH+]1 ZINC000280383696 538936925 /nfs/dbraw/zinc/93/69/25/538936925.db2.gz WGOXAWZMKCLSFK-UHFFFAOYSA-N 1 2 249.339 2.062 20 0 BEADLO CC(C)Cn1cc(N[C@H](C)c2[nH]cc[nH+]2)cn1 ZINC000278859224 538935099 /nfs/dbraw/zinc/93/50/99/538935099.db2.gz FJETXUCCSYPLLY-SNVBAGLBSA-N 1 2 233.319 2.435 20 0 BEADLO CCc1noc(CC)c1C[NH2+][C@@H](C)c1ncc[nH]1 ZINC000278950435 538935252 /nfs/dbraw/zinc/93/52/52/538935252.db2.gz MXFIQKRXCYNQQJ-VIFPVBQESA-N 1 2 248.330 2.373 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2ncc[nH]2)c(C)o1 ZINC000044730056 178251813 /nfs/dbraw/zinc/25/18/13/178251813.db2.gz IDBXQJNGVMBYBA-VIFPVBQESA-N 1 2 219.288 2.470 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H](C)CC2CCC2)c[nH+]1 ZINC000634367750 361812252 /nfs/dbraw/zinc/81/22/52/361812252.db2.gz PPEMBDCNKHDMNL-QMMMGPOBSA-N 1 2 221.304 2.027 20 0 BEADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccno2)on1 ZINC000336585347 178266068 /nfs/dbraw/zinc/26/60/68/178266068.db2.gz JHZJUOGJDCCNER-LLVKDONJSA-N 1 2 233.271 2.308 20 0 BEADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ccno2)on1 ZINC000336585347 178266072 /nfs/dbraw/zinc/26/60/72/178266072.db2.gz JHZJUOGJDCCNER-LLVKDONJSA-N 1 2 233.271 2.308 20 0 BEADLO C[C@H]1CCN(C(=O)CCc2c[nH+]c[nH]2)CC1(C)C ZINC000281655259 538939163 /nfs/dbraw/zinc/93/91/63/538939163.db2.gz RTNDRMBELCAESH-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO C[C@H]1CCN(C(=O)CCc2c[nH]c[nH+]2)CC1(C)C ZINC000281655259 538939164 /nfs/dbraw/zinc/93/91/64/538939164.db2.gz RTNDRMBELCAESH-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO c1c[nH+]c(-c2ccc(N3CCCC3)nc2)[nH]1 ZINC000649438067 398240052 /nfs/dbraw/zinc/24/00/52/398240052.db2.gz SBMFENBJFOMEFC-UHFFFAOYSA-N 1 2 214.272 2.072 20 0 BEADLO C[C@@H](Nc1cc[nH+]c(C(C)(C)C)n1)C1CC1 ZINC000381253756 398244153 /nfs/dbraw/zinc/24/41/53/398244153.db2.gz QEHWTCHRCBLGHM-SECBINFHSA-N 1 2 219.332 2.406 20 0 BEADLO CCC(CC)C[NH2+][C@H](CC(F)F)C(=O)OC ZINC000309994811 168364206 /nfs/dbraw/zinc/36/42/06/168364206.db2.gz BVMSOMOJWZUXLB-SECBINFHSA-N 1 2 237.290 2.209 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H](OC)C(C)C ZINC000381242335 398240610 /nfs/dbraw/zinc/24/06/10/398240610.db2.gz VUZDOVPPUPBECL-LLVKDONJSA-N 1 2 224.304 2.173 20 0 BEADLO COCC[C@H](CO)Nc1ccc2ccccc2[nH+]1 ZINC000281810076 398241008 /nfs/dbraw/zinc/24/10/08/398241008.db2.gz IZTSXRSIMHUCTQ-GFCCVEGCSA-N 1 2 246.310 2.044 20 0 BEADLO Cc1cc2[nH+]cn(CCCO)c2cc1C ZINC000035117106 178305720 /nfs/dbraw/zinc/30/57/20/178305720.db2.gz IQWCHIBIWUBMFE-UHFFFAOYSA-N 1 2 204.273 2.036 20 0 BEADLO Cc1cc2ccccc2[nH+]c1N[C@H](C)CO ZINC000063105710 178299353 /nfs/dbraw/zinc/29/93/53/178299353.db2.gz BWZTUBVULQUKDD-SNVBAGLBSA-N 1 2 216.284 2.336 20 0 BEADLO C[C@@H](Nc1cnn(CC(F)F)c1)c1[nH]cc[nH+]1 ZINC000286218483 538943083 /nfs/dbraw/zinc/94/30/83/538943083.db2.gz SGHMIMKUEOMZFK-SSDOTTSWSA-N 1 2 241.245 2.044 20 0 BEADLO Cc1cc2[nH+]cn(Cc3ccnn3C)c2cc1C ZINC000181871791 178305516 /nfs/dbraw/zinc/30/55/16/178305516.db2.gz WJLGQGPBSCRGKT-UHFFFAOYSA-N 1 2 240.310 2.435 20 0 BEADLO CC[C@](C)(CNc1cc[nH+]c(C)n1)OC ZINC000322996850 259308711 /nfs/dbraw/zinc/30/87/11/259308711.db2.gz JMHVEVOZCOQHCE-LLVKDONJSA-N 1 2 209.293 2.012 20 0 BEADLO Cc1cc2c(cc1NCc1[nH]cc[nH+]1)OCO2 ZINC000183092416 178291511 /nfs/dbraw/zinc/29/15/11/178291511.db2.gz KNIRHGGKBGGVLU-UHFFFAOYSA-N 1 2 231.255 2.059 20 0 BEADLO Cc1nc(N2C[C@H](C)OC3(CCCC3)C2)cc[nH+]1 ZINC000645406900 398246374 /nfs/dbraw/zinc/24/63/74/398246374.db2.gz XBPPATHSSDMSKG-NSHDSACASA-N 1 2 247.342 2.323 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1C[C@@H]1C1CC1 ZINC000176025416 365650740 /nfs/dbraw/zinc/65/07/40/365650740.db2.gz IAROYNOLAUFMEL-GHMZBOCLSA-N 1 2 216.284 2.375 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H]1C[C@H]1C1CC1 ZINC000176025454 365651004 /nfs/dbraw/zinc/65/10/04/365651004.db2.gz IAROYNOLAUFMEL-QWRGUYRKSA-N 1 2 216.284 2.375 20 0 BEADLO Cc1cc(C(=O)NCc2c[nH+]cn2C)sc1C ZINC000291377228 538947629 /nfs/dbraw/zinc/94/76/29/538947629.db2.gz ZPACIVUFNCSNHO-UHFFFAOYSA-N 1 2 249.339 2.028 20 0 BEADLO Cc1ccc(-c2nnc(Cn3cc[nH+]c3)o2)cc1 ZINC000025932982 178340674 /nfs/dbraw/zinc/34/06/74/178340674.db2.gz SRCQDULDXOXIGA-UHFFFAOYSA-N 1 2 240.266 2.290 20 0 BEADLO CCC1(CO)CCN(c2nc(C)[nH+]cc2C)CC1 ZINC000576717346 365668593 /nfs/dbraw/zinc/66/85/93/365668593.db2.gz HZOOWRFIAFDYDN-UHFFFAOYSA-N 1 2 249.358 2.082 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)C1CCCCCC1 ZINC000291205542 538947775 /nfs/dbraw/zinc/94/77/75/538947775.db2.gz FHDCUYIPMARSQI-UHFFFAOYSA-N 1 2 235.331 2.007 20 0 BEADLO CCC(C)(C)CC(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000344358949 136231647 /nfs/dbraw/zinc/23/16/47/136231647.db2.gz VQKWVDPSDJLBDM-SNVBAGLBSA-N 1 2 249.358 2.210 20 0 BEADLO CCC(C)(C)CC(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000344358949 136231648 /nfs/dbraw/zinc/23/16/48/136231648.db2.gz VQKWVDPSDJLBDM-SNVBAGLBSA-N 1 2 249.358 2.210 20 0 BEADLO Cc1ccc(Cn2nnnc2C(C)(C)C)c(C)[nH+]1 ZINC000185341310 398264798 /nfs/dbraw/zinc/26/47/98/398264798.db2.gz PSYHCWGRMFIHIR-UHFFFAOYSA-N 1 2 245.330 2.031 20 0 BEADLO CCN(CCOC)c1cc[nH+]c(C(C)C)n1 ZINC000343805720 136231311 /nfs/dbraw/zinc/23/13/11/136231311.db2.gz JCMVILYTERUHEA-UHFFFAOYSA-N 1 2 223.320 2.073 20 0 BEADLO Cc1[nH]c([C@@H]2CCCN2C(=O)[C@H]2C[C@@H]2C)[nH+]c1C ZINC001638207147 1172001829 /nfs/dbraw/zinc/00/18/29/1172001829.db2.gz GAWDUSTZOCPLJQ-UWJYBYFXSA-N 1 2 247.342 2.346 20 0 BEADLO CC(F)(F)C[NH2+]Cc1cccc(O)c1 ZINC000378760354 346827292 /nfs/dbraw/zinc/82/72/92/346827292.db2.gz VQSOWRAYDHMJNA-UHFFFAOYSA-N 1 2 201.216 2.137 20 0 BEADLO CCCn1cc(C[NH2+]CC(C)(F)F)cn1 ZINC000378804491 346838383 /nfs/dbraw/zinc/83/83/83/346838383.db2.gz XAGYCPLGLPDNKX-UHFFFAOYSA-N 1 2 217.263 2.038 20 0 BEADLO C[N@@H+](Cc1cc2n(n1)CCC2)Cc1ccco1 ZINC000649475673 398273114 /nfs/dbraw/zinc/27/31/14/398273114.db2.gz JQSYVYSWSFFCRB-UHFFFAOYSA-N 1 2 231.299 2.054 20 0 BEADLO C[N@H+](Cc1cc2n(n1)CCC2)Cc1ccco1 ZINC000649475673 398273116 /nfs/dbraw/zinc/27/31/16/398273116.db2.gz JQSYVYSWSFFCRB-UHFFFAOYSA-N 1 2 231.299 2.054 20 0 BEADLO CCc1nc(C[NH+](C(C)C)C(C)C)no1 ZINC000180452414 538958578 /nfs/dbraw/zinc/95/85/78/538958578.db2.gz AOWVFQJHSQKPHM-UHFFFAOYSA-N 1 2 211.309 2.251 20 0 BEADLO CC(F)(F)C[NH2+]Cc1cnn2ccccc12 ZINC000378870289 346851074 /nfs/dbraw/zinc/85/10/74/346851074.db2.gz LZIQOQKHDFBIBT-UHFFFAOYSA-N 1 2 225.242 2.079 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)[C@]12C[C@H]1CCC2 ZINC000421470728 192342789 /nfs/dbraw/zinc/34/27/89/192342789.db2.gz CJUOOJTZMISKSH-QMTHXVAHSA-N 1 2 241.294 2.463 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@@](C)(F)C2)cn1 ZINC000334925136 398274320 /nfs/dbraw/zinc/27/43/20/398274320.db2.gz APDGFYKMXPDFPG-GFCCVEGCSA-N 1 2 224.279 2.024 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@@](C)(F)C2)cn1 ZINC000334925136 398274323 /nfs/dbraw/zinc/27/43/23/398274323.db2.gz APDGFYKMXPDFPG-GFCCVEGCSA-N 1 2 224.279 2.024 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@](C)(F)C2)cn1 ZINC000334925137 398274592 /nfs/dbraw/zinc/27/45/92/398274592.db2.gz APDGFYKMXPDFPG-LBPRGKRZSA-N 1 2 224.279 2.024 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@](C)(F)C2)cn1 ZINC000334925137 398274596 /nfs/dbraw/zinc/27/45/96/398274596.db2.gz APDGFYKMXPDFPG-LBPRGKRZSA-N 1 2 224.279 2.024 20 0 BEADLO Cc1cc(NCc2c[nH+]c3ccccn23)no1 ZINC000181464731 538960942 /nfs/dbraw/zinc/96/09/42/538960942.db2.gz XKMMNZNSBMAZBA-UHFFFAOYSA-N 1 2 228.255 2.243 20 0 BEADLO C[C@@H]1CN(c2nc[nH+]c(N)c2Cl)[C@@H](C)[C@H]1C ZINC000399742146 342742321 /nfs/dbraw/zinc/74/23/21/342742321.db2.gz JJXLKACYPYJJIL-CSMHCCOUSA-N 1 2 240.738 2.193 20 0 BEADLO C[C@@H]1CN(c2[nH+]cnc(N)c2Cl)[C@@H](C)[C@H]1C ZINC000399742146 342742322 /nfs/dbraw/zinc/74/23/22/342742322.db2.gz JJXLKACYPYJJIL-CSMHCCOUSA-N 1 2 240.738 2.193 20 0 BEADLO Cc1cc(CNC(=O)N2C[C@H](C)[C@@H]2C)cc(C)[nH+]1 ZINC000335610656 136236634 /nfs/dbraw/zinc/23/66/34/136236634.db2.gz IQVKFUZRKWIGFY-CABZTGNLSA-N 1 2 247.342 2.248 20 0 BEADLO C[C@H]1CCCC[C@H]1C[N@H+](C)Cc1nnc[nH]1 ZINC000183085045 538965890 /nfs/dbraw/zinc/96/58/90/538965890.db2.gz MNIWHCLMBODDTF-QWRGUYRKSA-N 1 2 222.336 2.063 20 0 BEADLO C[C@H]1CCCC[C@H]1C[N@@H+](C)Cc1nnc[nH]1 ZINC000183085045 538965892 /nfs/dbraw/zinc/96/58/92/538965892.db2.gz MNIWHCLMBODDTF-QWRGUYRKSA-N 1 2 222.336 2.063 20 0 BEADLO CCn1ccnc1C[NH2+]Cc1ccc(Cl)o1 ZINC000309634007 342771370 /nfs/dbraw/zinc/77/13/70/342771370.db2.gz IVFKHXORKCZUGW-UHFFFAOYSA-N 1 2 239.706 2.439 20 0 BEADLO O[C@@H](Cn1cc[nH+]c1)c1cccc(Cl)c1 ZINC000146861106 342772716 /nfs/dbraw/zinc/77/27/16/342772716.db2.gz LRZUTWGAXVSLHO-NSHDSACASA-N 1 2 222.675 2.270 20 0 BEADLO CC[C@]1(C(C)C)C[C@H]1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493449182 529390326 /nfs/dbraw/zinc/39/03/26/529390326.db2.gz GDTWJHPKURYMDI-HGIUVPSYSA-N 1 2 247.342 2.364 20 0 BEADLO C/C=C\CNc1cc(N2CCCCC2)nc[nH+]1 ZINC000624655223 342809582 /nfs/dbraw/zinc/80/95/82/342809582.db2.gz NJKQXBBXVBYADJ-IHWYPQMZSA-N 1 2 232.331 2.455 20 0 BEADLO C/C=C\CNc1cc(N2CCCCC2)[nH+]cn1 ZINC000624655223 342809583 /nfs/dbraw/zinc/80/95/83/342809583.db2.gz NJKQXBBXVBYADJ-IHWYPQMZSA-N 1 2 232.331 2.455 20 0 BEADLO CCC(F)(F)C[NH2+]Cc1cnc(N(C)C)s1 ZINC000623679664 398290392 /nfs/dbraw/zinc/29/03/92/398290392.db2.gz DSKDMQRXFDJTKG-UHFFFAOYSA-N 1 2 249.330 2.344 20 0 BEADLO c1ccc(N[C@H]2CO[C@@H](C3CC3)C2)[nH+]c1 ZINC000624672325 342816498 /nfs/dbraw/zinc/81/64/98/342816498.db2.gz ISGMSUYCRQYALN-GHMZBOCLSA-N 1 2 204.273 2.061 20 0 BEADLO CCc1cc(N[C@@H]2CO[C@@H](C3CC3)C2)nc[nH+]1 ZINC000624673343 342817080 /nfs/dbraw/zinc/81/70/80/342817080.db2.gz HWURIUHKHXTNGZ-NWDGAFQWSA-N 1 2 233.315 2.018 20 0 BEADLO CCC(CC)[NH2+]c1ccc(-n2cnnn2)cc1 ZINC000020094358 168393549 /nfs/dbraw/zinc/39/35/49/168393549.db2.gz HOXJPSIANGFFEX-UHFFFAOYSA-N 1 2 231.303 2.263 20 0 BEADLO CC(C)Nc1ccc(-c2[nH+]ccn2C)cn1 ZINC000630052821 361922064 /nfs/dbraw/zinc/92/20/64/361922064.db2.gz MKVOWBMNJJXVMQ-UHFFFAOYSA-N 1 2 216.288 2.302 20 0 BEADLO CO[C@H]1C[C@H](Nc2nc(C)[nH+]c3c2CCCC3)C1 ZINC000624724999 342822727 /nfs/dbraw/zinc/82/27/27/342822727.db2.gz IRUWSOVUIIWBQM-XYPYZODXSA-N 1 2 247.342 2.253 20 0 BEADLO C[C@@H]1C[C@H]1CNc1cc2cc[nH]c2c[nH+]1 ZINC000380246707 538987713 /nfs/dbraw/zinc/98/77/13/538987713.db2.gz OJBPAJOYVFYDJO-SCZZXKLOSA-N 1 2 201.273 2.053 20 0 BEADLO COc1ccc(N[C@@H]2CSC[C@@H]2C)[nH+]c1 ZINC000380322651 538989428 /nfs/dbraw/zinc/98/94/28/538989428.db2.gz KXGWLDXNQXACQD-WCBMZHEXSA-N 1 2 224.329 2.254 20 0 BEADLO CCN(Cc1[nH+]ccn1C)c1cccc(O)c1 ZINC000191561342 538992530 /nfs/dbraw/zinc/99/25/30/538992530.db2.gz LRIDVFCURSTMGJ-UHFFFAOYSA-N 1 2 231.299 2.152 20 0 BEADLO C[C@@H]1CCCC[C@H]1NC(=O)CCc1c[nH+]c[nH]1 ZINC000188846022 538979814 /nfs/dbraw/zinc/97/98/14/538979814.db2.gz HLGFNCSTBOFFKC-ZYHUDNBSSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H]1CCCC[C@H]1NC(=O)CCc1c[nH]c[nH+]1 ZINC000188846022 538979815 /nfs/dbraw/zinc/97/98/15/538979815.db2.gz HLGFNCSTBOFFKC-ZYHUDNBSSA-N 1 2 235.331 2.037 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NCCCC1CCCC1 ZINC000189017232 538980586 /nfs/dbraw/zinc/98/05/86/538980586.db2.gz UAJYAYCXLPXVEW-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NCCCC1CCCC1 ZINC000189017232 538980588 /nfs/dbraw/zinc/98/05/88/538980588.db2.gz UAJYAYCXLPXVEW-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO CC(C)C[C@H]1CCN(C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000189179397 538980999 /nfs/dbraw/zinc/98/09/99/538980999.db2.gz TXKSVKYAEYCUMX-GFCCVEGCSA-N 1 2 249.358 2.237 20 0 BEADLO CC(C)C[C@H]1CCN(C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000189179397 538981000 /nfs/dbraw/zinc/98/10/00/538981000.db2.gz TXKSVKYAEYCUMX-GFCCVEGCSA-N 1 2 249.358 2.237 20 0 BEADLO FC(F)C[NH+]1CCC([C@@H]2CCCO2)CC1 ZINC000189148622 538981095 /nfs/dbraw/zinc/98/10/95/538981095.db2.gz STQMHCVWKZPPEP-JTQLQIEISA-N 1 2 219.275 2.143 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+][C@H]1CSC1(C)C ZINC000380115083 538985514 /nfs/dbraw/zinc/98/55/14/538985514.db2.gz PGXDDESFHLEHLL-XCBNKYQSSA-N 1 2 225.361 2.263 20 0 BEADLO C[C@@H]([NH2+]C1CSC1)c1nc(C(C)(C)C)no1 ZINC000381483034 539001804 /nfs/dbraw/zinc/00/18/04/539001804.db2.gz UCFBCUIOIJMKKV-SSDOTTSWSA-N 1 2 241.360 2.133 20 0 BEADLO Cc1cc(NC(=O)CCc2c[nH+]c[nH]2)ccc1F ZINC000193146726 539002326 /nfs/dbraw/zinc/00/23/26/539002326.db2.gz GLFPOCZFMFLQFR-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO Cc1cc(NC(=O)CCc2c[nH]c[nH+]2)ccc1F ZINC000193146726 539002327 /nfs/dbraw/zinc/00/23/27/539002327.db2.gz GLFPOCZFMFLQFR-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO Cc1cnn(C)c1C[NH2+][C@H]1CCCC1(F)F ZINC000381542002 539003742 /nfs/dbraw/zinc/00/37/42/539003742.db2.gz IHIUMASZKAQZFH-JTQLQIEISA-N 1 2 229.274 2.006 20 0 BEADLO CC[C@@H]1CCCN(C(=O)CCc2c[nH+]c[nH]2)CC1 ZINC000193290861 539004262 /nfs/dbraw/zinc/00/42/62/539004262.db2.gz QDRMSNKSQVDNRK-GFCCVEGCSA-N 1 2 249.358 2.381 20 0 BEADLO CC[C@@H]1CCCN(C(=O)CCc2c[nH]c[nH+]2)CC1 ZINC000193290861 539004264 /nfs/dbraw/zinc/00/42/64/539004264.db2.gz QDRMSNKSQVDNRK-GFCCVEGCSA-N 1 2 249.358 2.381 20 0 BEADLO COc1ccc(NC[C@@H]2CC=CCC2)[nH+]c1 ZINC000381614505 539004854 /nfs/dbraw/zinc/00/48/54/539004854.db2.gz UMUJKQAAWVIKFV-LLVKDONJSA-N 1 2 218.300 2.280 20 0 BEADLO CCn1ccnc1C[NH2+][C@H](C)c1ccoc1 ZINC000381746473 539006600 /nfs/dbraw/zinc/00/66/00/539006600.db2.gz QCKLNOUUDRHSSS-SNVBAGLBSA-N 1 2 219.288 2.347 20 0 BEADLO c1csc(C[NH2+][C@H]2CCCc3cn[nH]c32)n1 ZINC000381153488 538995165 /nfs/dbraw/zinc/99/51/65/538995165.db2.gz PNMSXFNZOPISCS-VIFPVBQESA-N 1 2 234.328 2.033 20 0 BEADLO c1csc(C[NH2+][C@H]2CCCc3c[nH]nc32)n1 ZINC000381153488 538995167 /nfs/dbraw/zinc/99/51/67/538995167.db2.gz PNMSXFNZOPISCS-VIFPVBQESA-N 1 2 234.328 2.033 20 0 BEADLO CC[C@]1(C)CCN(c2nc[nH+]c(N)c2Cl)C1 ZINC000390299504 539020853 /nfs/dbraw/zinc/02/08/53/539020853.db2.gz BZIJFGAOSCALON-LLVKDONJSA-N 1 2 240.738 2.339 20 0 BEADLO CC[C@]1(C)CCN(c2[nH+]cnc(N)c2Cl)C1 ZINC000390299504 539020855 /nfs/dbraw/zinc/02/08/55/539020855.db2.gz BZIJFGAOSCALON-LLVKDONJSA-N 1 2 240.738 2.339 20 0 BEADLO CCCCNC(=O)[C@@H](C)[N@H+](C)Cc1ccco1 ZINC000042334359 361980327 /nfs/dbraw/zinc/98/03/27/361980327.db2.gz PYBROSSPAUNKQQ-LLVKDONJSA-N 1 2 238.331 2.016 20 0 BEADLO CCCCNC(=O)[C@@H](C)[N@@H+](C)Cc1ccco1 ZINC000042334359 361980331 /nfs/dbraw/zinc/98/03/31/361980331.db2.gz PYBROSSPAUNKQQ-LLVKDONJSA-N 1 2 238.331 2.016 20 0 BEADLO CCc1cc(N[C@H](C)c2nnc(C)s2)nc[nH+]1 ZINC000391969273 539027828 /nfs/dbraw/zinc/02/78/28/539027828.db2.gz WFQCBBFLTVUMBV-SSDOTTSWSA-N 1 2 249.343 2.372 20 0 BEADLO CCc1cc(N[C@H]2CSC[C@@H]2C)nc[nH+]1 ZINC000389979734 539019408 /nfs/dbraw/zinc/01/94/08/539019408.db2.gz HUQLYHNBZKNIOB-WPRPVWTQSA-N 1 2 223.345 2.202 20 0 BEADLO COc1cncc(C[N@H+](C)Cc2cccs2)n1 ZINC000625060125 342847293 /nfs/dbraw/zinc/84/72/93/342847293.db2.gz IQMKSOMFRXQFDL-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1cncc(C[N@@H+](C)Cc2cccs2)n1 ZINC000625060125 342847294 /nfs/dbraw/zinc/84/72/94/342847294.db2.gz IQMKSOMFRXQFDL-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO CC[N@H+](Cc1noc(C2CCC2)n1)C1CC1 ZINC000625076460 342848626 /nfs/dbraw/zinc/84/86/26/342848626.db2.gz GZIKHGGXNAEIOS-UHFFFAOYSA-N 1 2 221.304 2.321 20 0 BEADLO CC[N@@H+](Cc1noc(C2CCC2)n1)C1CC1 ZINC000625076460 342848627 /nfs/dbraw/zinc/84/86/27/342848627.db2.gz GZIKHGGXNAEIOS-UHFFFAOYSA-N 1 2 221.304 2.321 20 0 BEADLO CCc1cc(N[C@H](CC)C(C)(C)O)nc[nH+]1 ZINC000382115707 398305771 /nfs/dbraw/zinc/30/57/71/398305771.db2.gz LZWBFLRZDJRCPV-SNVBAGLBSA-N 1 2 223.320 2.000 20 0 BEADLO Cc1cccc(C(=O)N[C@@H](C)c2[nH+]ccn2C)c1 ZINC000082285376 398311931 /nfs/dbraw/zinc/31/19/31/398311931.db2.gz UVVGWKDFCLLFDG-NSHDSACASA-N 1 2 243.310 2.220 20 0 BEADLO Cc1cc(NCc2cnccc2C)nc[nH+]1 ZINC000167309608 136245087 /nfs/dbraw/zinc/24/50/87/136245087.db2.gz FWZAGBVFBOKECG-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO CCCCc1cc(N[C@H]2CCCOC2)nc[nH+]1 ZINC000631109302 342911078 /nfs/dbraw/zinc/91/10/78/342911078.db2.gz PLLJZTZBNRLUMO-LBPRGKRZSA-N 1 2 235.331 2.410 20 0 BEADLO Cc1nc([C@H](C)[N@@H+](C)CCCOC(C)C)no1 ZINC000351518146 136246506 /nfs/dbraw/zinc/24/65/06/136246506.db2.gz LEWGGXRFLPCSPD-JTQLQIEISA-N 1 2 241.335 2.186 20 0 BEADLO Cc1nc([C@H](C)[N@H+](C)CCCOC(C)C)no1 ZINC000351518146 136246507 /nfs/dbraw/zinc/24/65/07/136246507.db2.gz LEWGGXRFLPCSPD-JTQLQIEISA-N 1 2 241.335 2.186 20 0 BEADLO CO[C@H]1CC[N@H+](Cc2cc(C(C)(C)C)on2)C1 ZINC000351512111 136246769 /nfs/dbraw/zinc/24/67/69/136246769.db2.gz FKNNAAHRXHXKOP-NSHDSACASA-N 1 2 238.331 2.193 20 0 BEADLO CO[C@H]1CC[N@@H+](Cc2cc(C(C)(C)C)on2)C1 ZINC000351512111 136246770 /nfs/dbraw/zinc/24/67/70/136246770.db2.gz FKNNAAHRXHXKOP-NSHDSACASA-N 1 2 238.331 2.193 20 0 BEADLO CCCCc1cc(N[C@H](CC)[C@H](C)O)nc[nH+]1 ZINC000631291948 342903364 /nfs/dbraw/zinc/90/33/64/342903364.db2.gz DEYNJVFBXAQWLC-CMPLNLGQSA-N 1 2 237.347 2.391 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccccc2F)[C@H](C)CO1 ZINC000045784324 342922274 /nfs/dbraw/zinc/92/22/74/342922274.db2.gz AADZLNBJILBKLJ-GHMZBOCLSA-N 1 2 223.291 2.435 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccccc2F)[C@H](C)CO1 ZINC000045784324 342922275 /nfs/dbraw/zinc/92/22/75/342922275.db2.gz AADZLNBJILBKLJ-GHMZBOCLSA-N 1 2 223.291 2.435 20 0 BEADLO CCOCC[N@H+](C)Cc1cc(C(C)(C)C)on1 ZINC000351573323 136247220 /nfs/dbraw/zinc/24/72/20/136247220.db2.gz IRHAGYPBRMXCDZ-UHFFFAOYSA-N 1 2 240.347 2.440 20 0 BEADLO CCOCC[N@@H+](C)Cc1cc(C(C)(C)C)on1 ZINC000351573323 136247221 /nfs/dbraw/zinc/24/72/21/136247221.db2.gz IRHAGYPBRMXCDZ-UHFFFAOYSA-N 1 2 240.347 2.440 20 0 BEADLO CC[C@H]([NH2+][C@@H](C)C(=O)OC)c1cccs1 ZINC000037073679 342916690 /nfs/dbraw/zinc/91/66/90/342916690.db2.gz ZOSUOAUYYZFIKL-IUCAKERBSA-N 1 2 227.329 2.350 20 0 BEADLO CCC[C@H](C)CCC[N@H+](C)Cc1nnc[nH]1 ZINC000625224386 342920786 /nfs/dbraw/zinc/92/07/86/342920786.db2.gz WYJGLWMXZQEMNG-NSHDSACASA-N 1 2 224.352 2.453 20 0 BEADLO CCC[C@H](C)CCC[N@@H+](C)Cc1nnc[nH]1 ZINC000625224386 342920787 /nfs/dbraw/zinc/92/07/87/342920787.db2.gz WYJGLWMXZQEMNG-NSHDSACASA-N 1 2 224.352 2.453 20 0 BEADLO COC(=O)[C@@H]([NH2+]C(C)C)c1ccccc1C ZINC000037445975 342931376 /nfs/dbraw/zinc/93/13/76/342931376.db2.gz ZDDJQLMVOGRMHE-LBPRGKRZSA-N 1 2 221.300 2.207 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)[C@H]1CC1(F)F)C(=O)OC(C)(C)C ZINC000602594942 349643928 /nfs/dbraw/zinc/64/39/28/349643928.db2.gz STFMTYROAOFJJK-DJLDLDEBSA-N 1 2 249.301 2.350 20 0 BEADLO Cc1cscc1-c1noc(Cn2cc[nH+]c2)n1 ZINC000564664674 398329513 /nfs/dbraw/zinc/32/95/13/398329513.db2.gz ALDNAJKEQQJPBT-UHFFFAOYSA-N 1 2 246.295 2.351 20 0 BEADLO CSc1cc(C[NH2+]Cc2ccon2)ccn1 ZINC000634974824 398339549 /nfs/dbraw/zinc/33/95/49/398339549.db2.gz LEOYXMVPKNIJKK-UHFFFAOYSA-N 1 2 235.312 2.081 20 0 BEADLO CC[C@@H]1CN(Cc2[nH]c(C)c(C)[nH+]2)C[C@@H](C)O1 ZINC000628155042 398336095 /nfs/dbraw/zinc/33/60/95/398336095.db2.gz OQZMNEZFJKDXCL-BXKDBHETSA-N 1 2 237.347 2.026 20 0 BEADLO C[C@@H](CC(=O)NC1(C2CCC2)CC1)n1cc[nH+]c1 ZINC000650658969 398336356 /nfs/dbraw/zinc/33/63/56/398336356.db2.gz WYSBQGHGQCXORO-NSHDSACASA-N 1 2 247.342 2.283 20 0 BEADLO C[C@H]1CC[C@@H](CC(=O)N2CCc3[nH]c[nH+]c3C2)C1 ZINC000627368887 346889253 /nfs/dbraw/zinc/88/92/53/346889253.db2.gz FOIDQTKIFWJZFY-WDEREUQCSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@H]1CC[C@@H](CC(=O)N2CCc3[nH+]c[nH]c3C2)C1 ZINC000627368887 346889256 /nfs/dbraw/zinc/88/92/56/346889256.db2.gz FOIDQTKIFWJZFY-WDEREUQCSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@@H]1C[C@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000029951529 398337058 /nfs/dbraw/zinc/33/70/58/398337058.db2.gz JWPQYGYGFMLHLX-ZWNOBZJWSA-N 1 2 241.294 2.467 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCCc2occc21)c1nncn1C ZINC000123951266 398338658 /nfs/dbraw/zinc/33/86/58/398338658.db2.gz GJXUTFYPLLRHTM-GXSJLCMTSA-N 1 2 246.314 2.136 20 0 BEADLO CC[C@H](O)Cn1c(C)[nH+]c2ccccc21 ZINC000037694365 342941367 /nfs/dbraw/zinc/94/13/67/342941367.db2.gz MRLOTDOJWCUBKH-JTQLQIEISA-N 1 2 204.273 2.116 20 0 BEADLO Cc1noc(C)c1C[NH2+][C@H]1C[C@H](C)n2ccnc21 ZINC000379025161 346888506 /nfs/dbraw/zinc/88/85/06/346888506.db2.gz URMKPGBTCIISNI-UFBFGSQYSA-N 1 2 246.314 2.284 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1C[C@H]1C ZINC000643903112 398344375 /nfs/dbraw/zinc/34/43/75/398344375.db2.gz QMEQNVAGJDKSQO-PSASIEDQSA-N 1 2 204.273 2.293 20 0 BEADLO CC(C)(C)OC1CC[NH+](Cc2ncc[nH]2)CC1 ZINC000162384480 349683157 /nfs/dbraw/zinc/68/31/57/349683157.db2.gz DBUICWHUELPAOK-UHFFFAOYSA-N 1 2 237.347 2.189 20 0 BEADLO Cc1ccc(CN(C)c2cc(C)[nH+]cn2)o1 ZINC000301220978 187205702 /nfs/dbraw/zinc/20/57/02/187205702.db2.gz ADVGMAXURPUNBG-UHFFFAOYSA-N 1 2 217.272 2.323 20 0 BEADLO CC(C)(C)c1nc(NCC2(O)CCC2)cc[nH+]1 ZINC000301497607 187205855 /nfs/dbraw/zinc/20/58/55/187205855.db2.gz BUXODSDJWRXVQY-UHFFFAOYSA-N 1 2 235.331 2.101 20 0 BEADLO Cc1ccnc(NCCc2ccc(C)[nH+]c2)n1 ZINC000301266198 187206219 /nfs/dbraw/zinc/20/62/19/187206219.db2.gz HUGTVDAUTMSKLO-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO COC1CC([N@H+](C)Cc2ncc(Cl)s2)C1 ZINC000352195012 536718665 /nfs/dbraw/zinc/71/86/65/536718665.db2.gz NIYCXLCGPRWSHB-UHFFFAOYSA-N 1 2 246.763 2.406 20 0 BEADLO COC1CC([N@@H+](C)Cc2ncc(Cl)s2)C1 ZINC000352195012 536718674 /nfs/dbraw/zinc/71/86/74/536718674.db2.gz NIYCXLCGPRWSHB-UHFFFAOYSA-N 1 2 246.763 2.406 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)COC(C)C ZINC000304551275 187208524 /nfs/dbraw/zinc/20/85/24/187208524.db2.gz OVPXYTINUIYSRH-UHFFFAOYSA-N 1 2 222.288 2.062 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N1[C@H](C)CC[C@@H]1C ZINC000492492542 529552704 /nfs/dbraw/zinc/55/27/04/529552704.db2.gz MBGZYHVWMADOMU-GRPTYIHUSA-N 1 2 247.342 2.316 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N1CC[C@H](C)[C@H]1C ZINC000492410336 529552845 /nfs/dbraw/zinc/55/28/45/529552845.db2.gz RIZHQPLFFCHSNK-CYLBZQBVSA-N 1 2 247.342 2.173 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N1[C@H](C)CC[C@H]1C ZINC000492492543 529552889 /nfs/dbraw/zinc/55/28/89/529552889.db2.gz MBGZYHVWMADOMU-IDDPWSFUSA-N 1 2 247.342 2.316 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N(C)[C@H](C)C1CC1 ZINC000492450515 529557079 /nfs/dbraw/zinc/55/70/79/529557079.db2.gz RCWBGHITCXBCMM-SKVAFPRGSA-N 1 2 247.342 2.173 20 0 BEADLO Clc1ccc(C[NH+]2CCSCC2)cn1 ZINC000020257239 342979091 /nfs/dbraw/zinc/97/90/91/342979091.db2.gz BXEGBPXUGKWWLZ-UHFFFAOYSA-N 1 2 228.748 2.284 20 0 BEADLO CCn1ccnc1C[N@H+](C)[C@@H](C)c1ccncc1 ZINC000162445387 349708936 /nfs/dbraw/zinc/70/89/36/349708936.db2.gz FEYCBDICAFYNOI-LBPRGKRZSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1ccnc1C[N@@H+](C)[C@@H](C)c1ccncc1 ZINC000162445387 349708939 /nfs/dbraw/zinc/70/89/39/349708939.db2.gz FEYCBDICAFYNOI-LBPRGKRZSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1cc[nH+]c1CN(C)[C@@H](C)c1ccncc1 ZINC000162445387 349708944 /nfs/dbraw/zinc/70/89/44/349708944.db2.gz FEYCBDICAFYNOI-LBPRGKRZSA-N 1 2 244.342 2.491 20 0 BEADLO Cc1ccc(F)c(C[N@@H+]2C[C@@H](F)C[C@H]2CO)c1 ZINC000335900556 136259303 /nfs/dbraw/zinc/25/93/03/136259303.db2.gz QYPIFIPBXUXIAM-RYUDHWBXSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1ccc(F)c(C[N@H+]2C[C@@H](F)C[C@H]2CO)c1 ZINC000335900556 136259304 /nfs/dbraw/zinc/25/93/04/136259304.db2.gz QYPIFIPBXUXIAM-RYUDHWBXSA-N 1 2 241.281 2.039 20 0 BEADLO CS[C@@H]1CC[C@H]1Nc1c[nH+]cc(N(C)C)c1 ZINC000602726017 349714899 /nfs/dbraw/zinc/71/48/99/349714899.db2.gz UIQGZKGFNFVXCA-VXGBXAGGSA-N 1 2 237.372 2.454 20 0 BEADLO CCC(F)(F)C[N@H+](C[C@@H](C)C(=O)OC)C1CC1 ZINC000602772111 349726114 /nfs/dbraw/zinc/72/61/14/349726114.db2.gz PGOSXGXGYLSNFQ-SECBINFHSA-N 1 2 249.301 2.305 20 0 BEADLO CCC(F)(F)C[N@@H+](C[C@@H](C)C(=O)OC)C1CC1 ZINC000602772111 349726116 /nfs/dbraw/zinc/72/61/16/349726116.db2.gz PGOSXGXGYLSNFQ-SECBINFHSA-N 1 2 249.301 2.305 20 0 BEADLO COC(=O)c1coc([C@H](C)[NH+]2[C@H](C)C[C@H]2C)n1 ZINC000602821412 349761603 /nfs/dbraw/zinc/76/16/03/349761603.db2.gz LVOZTAIBFNWLKG-HLTSFMKQSA-N 1 2 238.287 2.005 20 0 BEADLO CCOC(=O)C[N@H+](CC)Cc1ccc(F)cc1 ZINC000049948285 343019165 /nfs/dbraw/zinc/01/91/65/343019165.db2.gz ZZLZRJHYDOTZRI-UHFFFAOYSA-N 1 2 239.290 2.211 20 0 BEADLO CCOC(=O)C[N@@H+](CC)Cc1ccc(F)cc1 ZINC000049948285 343019168 /nfs/dbraw/zinc/01/91/68/343019168.db2.gz ZZLZRJHYDOTZRI-UHFFFAOYSA-N 1 2 239.290 2.211 20 0 BEADLO CC(C)(C)OC(=O)[C@@H](C1CC1)[N@@H+]1CC[C@H](F)C1 ZINC000602841589 349779026 /nfs/dbraw/zinc/77/90/26/349779026.db2.gz OLCPFERDQDZZJI-WDEREUQCSA-N 1 2 243.322 2.151 20 0 BEADLO CC(C)(C)OC(=O)[C@@H](C1CC1)[N@H+]1CC[C@H](F)C1 ZINC000602841589 349779027 /nfs/dbraw/zinc/77/90/27/349779027.db2.gz OLCPFERDQDZZJI-WDEREUQCSA-N 1 2 243.322 2.151 20 0 BEADLO Cn1cc[nH+]c1-n1nc(C2CC2)cc1C1CC1 ZINC000634629846 343038031 /nfs/dbraw/zinc/03/80/31/343038031.db2.gz FJEFQNJCPPGEQW-UHFFFAOYSA-N 1 2 228.299 2.361 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnc[nH]2)C[C@H](C)C1(F)F ZINC000625656001 344025885 /nfs/dbraw/zinc/02/58/85/344025885.db2.gz YKXNODSSSLEMOC-DTORHVGOSA-N 1 2 229.274 2.133 20 0 BEADLO CC(C)[N@H+](CC(N)=O)Cc1cscc1Cl ZINC000678123506 488198002 /nfs/dbraw/zinc/19/80/02/488198002.db2.gz ZOGPMQPCDYWUAO-UHFFFAOYSA-N 1 2 246.763 2.097 20 0 BEADLO CC(C)[N@@H+](CC(N)=O)Cc1cscc1Cl ZINC000678123506 488198005 /nfs/dbraw/zinc/19/80/05/488198005.db2.gz ZOGPMQPCDYWUAO-UHFFFAOYSA-N 1 2 246.763 2.097 20 0 BEADLO Cc1ccccc1-c1noc(Cn2cc[nH+]c2)n1 ZINC000049067121 343084325 /nfs/dbraw/zinc/08/43/25/343084325.db2.gz PNORRYOCLSSPSI-UHFFFAOYSA-N 1 2 240.266 2.290 20 0 BEADLO Cn1ccc(CNc2[nH]c3cc(F)ccc3[nH+]2)n1 ZINC000236100203 343074660 /nfs/dbraw/zinc/07/46/60/343074660.db2.gz UDXYBNLZBDITLZ-UHFFFAOYSA-N 1 2 245.261 2.048 20 0 BEADLO Cn1cc[nH+]c1Cn1cc(C2CCCCC2)nn1 ZINC000640952443 362096437 /nfs/dbraw/zinc/09/64/37/362096437.db2.gz AMZFTOYKHGWFPE-UHFFFAOYSA-N 1 2 245.330 2.108 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000421576702 192354585 /nfs/dbraw/zinc/35/45/85/192354585.db2.gz MXZNTQQPXOFBFL-CHWSQXEVSA-N 1 2 232.327 2.361 20 0 BEADLO CC(C)[C@H](O)C1(CNc2cccc[nH+]2)CC1 ZINC000271807750 187237160 /nfs/dbraw/zinc/23/71/60/187237160.db2.gz LQKPGXCJTAIETC-LBPRGKRZSA-N 1 2 220.316 2.291 20 0 BEADLO Cc1cc(CNC(=O)Cc2ccoc2)cc(C)[nH+]1 ZINC000421576440 192355105 /nfs/dbraw/zinc/35/51/05/192355105.db2.gz MJRSEKYHJAYHSR-UHFFFAOYSA-N 1 2 244.294 2.150 20 0 BEADLO C[C@@H](NC(=O)C1CCCCC1)c1[nH]cc[nH+]1 ZINC000125384221 343173129 /nfs/dbraw/zinc/17/31/29/343173129.db2.gz XAYILVXVEKPSLC-SECBINFHSA-N 1 2 221.304 2.167 20 0 BEADLO CC[C@@H]1CCCC[N@@H+]1Cc1noc(C)n1 ZINC000051124114 346932036 /nfs/dbraw/zinc/93/20/36/346932036.db2.gz REFRATSPNTUGGH-SNVBAGLBSA-N 1 2 209.293 2.143 20 0 BEADLO CC[C@@H]1CCCC[N@H+]1Cc1noc(C)n1 ZINC000051124114 346932039 /nfs/dbraw/zinc/93/20/39/346932039.db2.gz REFRATSPNTUGGH-SNVBAGLBSA-N 1 2 209.293 2.143 20 0 BEADLO CCOc1ccccc1NCc1[nH+]ccn1C ZINC000036804584 343324744 /nfs/dbraw/zinc/32/47/44/343324744.db2.gz NYFWTTJJGGAOCI-UHFFFAOYSA-N 1 2 231.299 2.431 20 0 BEADLO COC(=O)[C@H](C)[NH2+]C1CC(c2ccc(C)cc2)C1 ZINC000037074111 343332640 /nfs/dbraw/zinc/33/26/40/343332640.db2.gz OKVPNVATNUMFOV-XGNXJENSSA-N 1 2 247.338 2.392 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@H](C)CCc1ccccc1 ZINC000037074005 343332736 /nfs/dbraw/zinc/33/27/36/343332736.db2.gz CVDPSKOARRFWKX-NEPJUHHUSA-N 1 2 235.327 2.159 20 0 BEADLO COC(=O)[C@H](C)[NH2+]C1CC(c2ccccc2C)C1 ZINC000037074122 343332778 /nfs/dbraw/zinc/33/27/78/343332778.db2.gz CAGCYUCYRCDGFK-HIFPTAJRSA-N 1 2 247.338 2.392 20 0 BEADLO C[C@@H]1C[C@@H](C)[N@H+](Cc2nc(C(F)F)no2)C1 ZINC000335613036 136295574 /nfs/dbraw/zinc/29/55/74/136295574.db2.gz RMEPQXQXRSTXOP-RNFRBKRXSA-N 1 2 231.246 2.238 20 0 BEADLO C[C@@H]1C[C@@H](C)[N@@H+](Cc2nc(C(F)F)no2)C1 ZINC000335613036 136295575 /nfs/dbraw/zinc/29/55/75/136295575.db2.gz RMEPQXQXRSTXOP-RNFRBKRXSA-N 1 2 231.246 2.238 20 0 BEADLO CC[C@]([NH2+]CC1CC1)(C(=O)OC)c1ccccc1 ZINC000037967729 343362250 /nfs/dbraw/zinc/36/22/50/343362250.db2.gz AKMIITVTDSWMTO-OAHLLOKOSA-N 1 2 247.338 2.465 20 0 BEADLO COC(=O)C(C)(C)[NH2+]Cc1ccc(C)c(C)c1 ZINC000037304483 343343202 /nfs/dbraw/zinc/34/32/02/343343202.db2.gz DCZSCQZBBNFJKH-UHFFFAOYSA-N 1 2 235.327 2.345 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NCCC(C)(C)C ZINC000348832279 136303365 /nfs/dbraw/zinc/30/33/65/136303365.db2.gz FDYCSFWVAIEKAB-UHFFFAOYSA-N 1 2 235.331 2.370 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@@H](C)C[C@@H]2C(N)=O)on1 ZINC000335673910 136317299 /nfs/dbraw/zinc/31/72/99/136317299.db2.gz BIQMWNACRYZBOR-LDYMZIIASA-N 1 2 237.303 2.119 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@@H](C)C[C@@H]2C(N)=O)on1 ZINC000335673910 136317300 /nfs/dbraw/zinc/31/73/00/136317300.db2.gz BIQMWNACRYZBOR-LDYMZIIASA-N 1 2 237.303 2.119 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCOC2(CCCCC2)C1 ZINC000335675512 136318216 /nfs/dbraw/zinc/31/82/16/136318216.db2.gz QZZJVBKAXZHFQX-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCOC2(CCCCC2)C1 ZINC000335675512 136318217 /nfs/dbraw/zinc/31/82/17/136318217.db2.gz QZZJVBKAXZHFQX-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CCOC2(CCCCC2)C1 ZINC000335675512 136318218 /nfs/dbraw/zinc/31/82/18/136318218.db2.gz QZZJVBKAXZHFQX-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CCOC2(CCCCC2)C1 ZINC000335675512 136318219 /nfs/dbraw/zinc/31/82/19/136318219.db2.gz QZZJVBKAXZHFQX-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO c1nc(C[N@@H+]2CCC[C@@H]2c2ccncc2)co1 ZINC000348904744 136305672 /nfs/dbraw/zinc/30/56/72/136305672.db2.gz NLMVKDRPTAUYQL-CYBMUJFWSA-N 1 2 229.283 2.407 20 0 BEADLO c1nc(C[N@H+]2CCC[C@@H]2c2ccncc2)co1 ZINC000348904744 136305673 /nfs/dbraw/zinc/30/56/73/136305673.db2.gz NLMVKDRPTAUYQL-CYBMUJFWSA-N 1 2 229.283 2.407 20 0 BEADLO CCc1noc([C@H](c2ccccc2)[NH+](C)C)n1 ZINC000348885530 136308164 /nfs/dbraw/zinc/30/81/64/136308164.db2.gz IIIGTZUXTAEFNP-LBPRGKRZSA-N 1 2 231.299 2.283 20 0 BEADLO CC[C@H](C)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000421554101 192360687 /nfs/dbraw/zinc/36/06/87/192360687.db2.gz FPNHJVQTBRXKJJ-VIFPVBQESA-N 1 2 220.316 2.361 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C1CC(C)(C)C1 ZINC000335667623 136311588 /nfs/dbraw/zinc/31/15/88/136311588.db2.gz FLGBUAROVOJCRJ-UHFFFAOYSA-N 1 2 232.327 2.441 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1cccc(C)n1 ZINC000335670955 136312838 /nfs/dbraw/zinc/31/28/38/136312838.db2.gz KBXMEOYZDNLNCP-UHFFFAOYSA-N 1 2 241.294 2.022 20 0 BEADLO c1cncc(C[N@@H+]2CCO[C@H](C3CCC3)C2)c1 ZINC000335662043 136315578 /nfs/dbraw/zinc/31/55/78/136315578.db2.gz CVKWDWMSQMIRQY-AWEZNQCLSA-N 1 2 232.327 2.083 20 0 BEADLO c1cncc(C[N@H+]2CCO[C@H](C3CCC3)C2)c1 ZINC000335662043 136315579 /nfs/dbraw/zinc/31/55/79/136315579.db2.gz CVKWDWMSQMIRQY-AWEZNQCLSA-N 1 2 232.327 2.083 20 0 BEADLO C[C@@H](CCC(C)(C)C)C(=O)NCc1c[nH+]c[nH]1 ZINC000349126128 136322188 /nfs/dbraw/zinc/32/21/88/136322188.db2.gz FXPYFHIEYLAZQV-JTQLQIEISA-N 1 2 237.347 2.488 20 0 BEADLO C[C@@H](CCC(C)(C)C)C(=O)NCc1c[nH]c[nH+]1 ZINC000349126128 136322189 /nfs/dbraw/zinc/32/21/89/136322189.db2.gz FXPYFHIEYLAZQV-JTQLQIEISA-N 1 2 237.347 2.488 20 0 BEADLO NC(=O)[C@H]1CC[N@H+](Cc2ncc(Cl)s2)C1 ZINC000335693273 136325694 /nfs/dbraw/zinc/32/56/94/136325694.db2.gz QXFVVGLWUYBSHD-LURJTMIESA-N 1 2 245.735 2.154 20 0 BEADLO NC(=O)[C@H]1CC[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000335693273 136325695 /nfs/dbraw/zinc/32/56/95/136325695.db2.gz QXFVVGLWUYBSHD-LURJTMIESA-N 1 2 245.735 2.154 20 0 BEADLO CSc1ccc(C[NH2+]Cc2ccn[nH]2)cc1 ZINC000041014687 343412380 /nfs/dbraw/zinc/41/23/80/343412380.db2.gz ZCMZWDJWUBZWPG-UHFFFAOYSA-N 1 2 233.340 2.421 20 0 BEADLO CCOc1ccccc1C[NH2+]Cc1cc[nH]n1 ZINC000041013809 343412550 /nfs/dbraw/zinc/41/25/50/343412550.db2.gz FWECAXCZHJLIGX-UHFFFAOYSA-N 1 2 231.299 2.098 20 0 BEADLO CC(C)[C@H](C)N(C(=O)C=Cc1c[nH]c[nH+]1)C1CC1 ZINC000276596774 187338800 /nfs/dbraw/zinc/33/88/00/187338800.db2.gz NUZQYCQTCBOVJT-ZPMKCOPCSA-N 1 2 247.342 2.458 20 0 BEADLO Cc1ccc2c(c1)CC[N@@H+](Cc1ncccn1)C2 ZINC000335720791 136345662 /nfs/dbraw/zinc/34/56/62/136345662.db2.gz SHFBPRKHPBGJJK-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1ccc2c(c1)CC[N@H+](Cc1ncccn1)C2 ZINC000335720791 136345663 /nfs/dbraw/zinc/34/56/63/136345663.db2.gz SHFBPRKHPBGJJK-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC[C@@H]2c2ncc[nH]2)cn1 ZINC000335720474 136345701 /nfs/dbraw/zinc/34/57/01/136345701.db2.gz ZFPCBFFCBMHEID-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc(C[N@H+]2CCC[C@@H]2c2ncc[nH]2)cn1 ZINC000335720474 136345702 /nfs/dbraw/zinc/34/57/02/136345702.db2.gz ZFPCBFFCBMHEID-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO CC[C@@H]([NH2+]C[C@H]1CCCCC1(F)F)C(=O)OC ZINC000394501456 259360464 /nfs/dbraw/zinc/36/04/64/259360464.db2.gz NSKFYILKECUXAS-NXEZZACHSA-N 1 2 249.301 2.353 20 0 BEADLO COC(=O)[C@@H](C)[NH2+]Cc1cccc2ccccc21 ZINC000042223256 343431273 /nfs/dbraw/zinc/43/12/73/343431273.db2.gz QNAQTANVECIVRZ-LLVKDONJSA-N 1 2 243.306 2.491 20 0 BEADLO Cc1nc(C[NH+]2[C@@H](C)COC[C@@H]2C)c(C)s1 ZINC000335704369 136335214 /nfs/dbraw/zinc/33/52/14/136335214.db2.gz BRRQSUOSJZLCMP-IUCAKERBSA-N 1 2 240.372 2.369 20 0 BEADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1nccn1C ZINC000335714845 136338741 /nfs/dbraw/zinc/33/87/41/136338741.db2.gz PSEADFFKOKGPNF-BDAKNGLRSA-N 1 2 247.264 2.193 20 0 BEADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1nccn1C ZINC000335714845 136338742 /nfs/dbraw/zinc/33/87/42/136338742.db2.gz PSEADFFKOKGPNF-BDAKNGLRSA-N 1 2 247.264 2.193 20 0 BEADLO Cc1cnc(C[N@H+]2CCS[C@@H](C)[C@@H]2C)nc1 ZINC000335718372 136340417 /nfs/dbraw/zinc/34/04/17/136340417.db2.gz KECGXWRVDZEOQQ-QWRGUYRKSA-N 1 2 237.372 2.111 20 0 BEADLO Cc1cnc(C[N@@H+]2CCS[C@@H](C)[C@@H]2C)nc1 ZINC000335718372 136340418 /nfs/dbraw/zinc/34/04/18/136340418.db2.gz KECGXWRVDZEOQQ-QWRGUYRKSA-N 1 2 237.372 2.111 20 0 BEADLO c1ccc([C@H]2CC[N@H+]2Cc2ncccn2)cc1 ZINC000335719197 136340441 /nfs/dbraw/zinc/34/04/41/136340441.db2.gz HNEJVMNGIKXBIV-CYBMUJFWSA-N 1 2 225.295 2.424 20 0 BEADLO c1ccc([C@H]2CC[N@@H+]2Cc2ncccn2)cc1 ZINC000335719197 136340442 /nfs/dbraw/zinc/34/04/42/136340442.db2.gz HNEJVMNGIKXBIV-CYBMUJFWSA-N 1 2 225.295 2.424 20 0 BEADLO C[C@@H]([NH+]=c1[nH]c2c(cccc2F)n1C)C1CC1 ZINC000350254056 136357119 /nfs/dbraw/zinc/35/71/19/136357119.db2.gz QNXKVYDSBLLSKA-MRVPVSSYSA-N 1 2 233.290 2.345 20 0 BEADLO CC[C@@](C)([NH2+]C[C@H]1CCOC1)C(F)(F)F ZINC000379931649 365744173 /nfs/dbraw/zinc/74/41/73/365744173.db2.gz OXHTXBSVMOTFAK-RKDXNWHRSA-N 1 2 225.254 2.344 20 0 BEADLO Oc1cccc2c1CCC[C@@H]2[NH2+]Cc1c[nH]cn1 ZINC000191659560 136362905 /nfs/dbraw/zinc/36/29/05/136362905.db2.gz GPUKWIOIMXUYBG-ZDUSSCGKSA-N 1 2 243.310 2.283 20 0 BEADLO C[C@@H]1C[C@H]1CC(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000353991762 136363498 /nfs/dbraw/zinc/36/34/98/136363498.db2.gz DMKPGSZXTJJHAM-WOPDTQHZSA-N 1 2 247.342 2.162 20 0 BEADLO Cc1ccc(NC(=O)NCCn2cc[nH+]c2)cc1 ZINC000048388489 136372740 /nfs/dbraw/zinc/37/27/40/136372740.db2.gz HYWOFQKOGFWRCU-UHFFFAOYSA-N 1 2 244.298 2.013 20 0 BEADLO COC(=O)[C@H](C)[NH2+]CC[C@H](C)c1ccccc1 ZINC000043533709 343477253 /nfs/dbraw/zinc/47/72/53/343477253.db2.gz QBKJMUSSIKUHBP-RYUDHWBXSA-N 1 2 235.327 2.331 20 0 BEADLO CC[C@H](Nc1nc[nH+]c(N)c1Cl)C1CC1 ZINC000323770722 488221190 /nfs/dbraw/zinc/22/11/90/488221190.db2.gz XSILPZORYQDPHO-ZETCQYMHSA-N 1 2 226.711 2.313 20 0 BEADLO CC[C@H](Nc1[nH+]cnc(N)c1Cl)C1CC1 ZINC000323770722 488221193 /nfs/dbraw/zinc/22/11/93/488221193.db2.gz XSILPZORYQDPHO-ZETCQYMHSA-N 1 2 226.711 2.313 20 0 BEADLO C[C@H](CC(=O)N1C[C@@H]2CCCC[C@@H]21)n1cc[nH+]c1 ZINC000616721917 343549160 /nfs/dbraw/zinc/54/91/60/343549160.db2.gz PMVGBSRFOWTWKL-AGIUHOORSA-N 1 2 247.342 2.235 20 0 BEADLO Cc1cccc(Cc2noc(C[NH+](C)C)n2)c1 ZINC000278171312 187341289 /nfs/dbraw/zinc/34/12/89/187341289.db2.gz SXKHNVNTJMHUJW-UHFFFAOYSA-N 1 2 231.299 2.030 20 0 BEADLO CCCN(C(=O)[C@H]1CCc2[nH+]c[nH]c2C1)C(C)C ZINC000616695812 343541348 /nfs/dbraw/zinc/54/13/48/343541348.db2.gz LELFCLRMNLKYQR-NSHDSACASA-N 1 2 249.358 2.162 20 0 BEADLO CCCN(C(=O)[C@H]1CCc2[nH]c[nH+]c2C1)C(C)C ZINC000616695812 343541350 /nfs/dbraw/zinc/54/13/50/343541350.db2.gz LELFCLRMNLKYQR-NSHDSACASA-N 1 2 249.358 2.162 20 0 BEADLO Cc1nc(C[NH2+][C@H](C)c2cnn(C)c2)cs1 ZINC000044500253 343504331 /nfs/dbraw/zinc/50/43/31/343504331.db2.gz MCIWFKZFLSDDJF-MRVPVSSYSA-N 1 2 236.344 2.036 20 0 BEADLO CCCCC(=O)NCc1cn2ccc(C)cc2[nH+]1 ZINC000048968451 343590721 /nfs/dbraw/zinc/59/07/21/343590721.db2.gz MHRBUJPANWIBQT-UHFFFAOYSA-N 1 2 245.326 2.449 20 0 BEADLO C[C@@H]1CCC[N@H+](Cc2ncc(Cl)n2C)C1 ZINC000052867254 343640965 /nfs/dbraw/zinc/64/09/65/343640965.db2.gz UHQMOHHGLFBTLN-SECBINFHSA-N 1 2 227.739 2.305 20 0 BEADLO C[C@@H]1CCC[N@@H+](Cc2ncc(Cl)n2C)C1 ZINC000052867254 343640967 /nfs/dbraw/zinc/64/09/67/343640967.db2.gz UHQMOHHGLFBTLN-SECBINFHSA-N 1 2 227.739 2.305 20 0 BEADLO Fc1c(Cl)cccc1C[NH2+]Cc1ncc[nH]1 ZINC000127151195 343647980 /nfs/dbraw/zinc/64/79/80/343647980.db2.gz SCBUTNWFWPKXIN-UHFFFAOYSA-N 1 2 239.681 2.492 20 0 BEADLO Cc1ccc(CNc2c[nH]c[nH+]2)cc1F ZINC000380003058 365794779 /nfs/dbraw/zinc/79/47/79/365794779.db2.gz OAOVFVMMWZESBF-UHFFFAOYSA-N 1 2 205.236 2.469 20 0 BEADLO CCc1nnc(C[N@H+](C)Cc2cccs2)o1 ZINC000054105342 343655707 /nfs/dbraw/zinc/65/57/07/343655707.db2.gz IHOQCMVPGVXHAH-UHFFFAOYSA-N 1 2 237.328 2.326 20 0 BEADLO CCc1nnc(C[N@@H+](C)Cc2cccs2)o1 ZINC000054105342 343655710 /nfs/dbraw/zinc/65/57/10/343655710.db2.gz IHOQCMVPGVXHAH-UHFFFAOYSA-N 1 2 237.328 2.326 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2OCC[C@H]2C)c(C)[nH+]1 ZINC000159222673 349831649 /nfs/dbraw/zinc/83/16/49/349831649.db2.gz GQYMHWBKNSYANM-PELKAZGASA-N 1 2 234.299 2.062 20 0 BEADLO CC(C)c1nc(N[C@H](C)CCCO)cc[nH+]1 ZINC000153924079 343706301 /nfs/dbraw/zinc/70/63/01/343706301.db2.gz NSPXVLDRDCRQDB-SNVBAGLBSA-N 1 2 223.320 2.173 20 0 BEADLO c1ccc2[nH]c(C[NH+]3CCSCC3)nc2c1 ZINC000126220292 343681949 /nfs/dbraw/zinc/68/19/49/343681949.db2.gz RFEGUWGAIKHQGU-UHFFFAOYSA-N 1 2 233.340 2.112 20 0 BEADLO C[N@H+](C/C=C\c1ccncc1)Cc1ccon1 ZINC000494981255 529820737 /nfs/dbraw/zinc/82/07/37/529820737.db2.gz SIVDVAMMZDLJMD-IHWYPQMZSA-N 1 2 229.283 2.215 20 0 BEADLO C[N@@H+](C/C=C\c1ccncc1)Cc1ccon1 ZINC000494981255 529820738 /nfs/dbraw/zinc/82/07/38/529820738.db2.gz SIVDVAMMZDLJMD-IHWYPQMZSA-N 1 2 229.283 2.215 20 0 BEADLO Cc1c[nH+]c(C)nc1NCC[C@@H]1CCO[C@@H](C)C1 ZINC000576172688 343721015 /nfs/dbraw/zinc/72/10/15/343721015.db2.gz UVYZSDLJACJCAQ-WCQYABFASA-N 1 2 249.358 2.132 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2occc2C)nn1 ZINC000292095571 187349554 /nfs/dbraw/zinc/34/95/54/187349554.db2.gz FTZYJDHOAFAIQH-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2occc2C)nn1 ZINC000292095571 187349556 /nfs/dbraw/zinc/34/95/56/187349556.db2.gz FTZYJDHOAFAIQH-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COC(=O)[C@H](C1CC1)[N@H+](C)Cc1ccsc1 ZINC000084093470 343749188 /nfs/dbraw/zinc/74/91/88/343749188.db2.gz CKBBBOOGSCZXNN-NSHDSACASA-N 1 2 239.340 2.132 20 0 BEADLO COC(=O)[C@H](C1CC1)[N@@H+](C)Cc1ccsc1 ZINC000084093470 343749189 /nfs/dbraw/zinc/74/91/89/343749189.db2.gz CKBBBOOGSCZXNN-NSHDSACASA-N 1 2 239.340 2.132 20 0 BEADLO CN(CC1CCCCC1)C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493715074 529864235 /nfs/dbraw/zinc/86/42/35/529864235.db2.gz AGCXNQRPELWYQL-BQYQJAHWSA-N 1 2 247.342 2.462 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@@H+]1C[C@@H](C)[C@H]1C ZINC000293284201 187350557 /nfs/dbraw/zinc/35/05/57/187350557.db2.gz CRZZNQMPHDUCEK-KKZNHRDASA-N 1 2 239.340 2.302 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@H+]1C[C@@H](C)[C@H]1C ZINC000293284201 187350558 /nfs/dbraw/zinc/35/05/58/187350558.db2.gz CRZZNQMPHDUCEK-KKZNHRDASA-N 1 2 239.340 2.302 20 0 BEADLO CC[C@H]([NH2+]Cc1cnc[nH]1)c1c(C)noc1C ZINC000179325891 346981201 /nfs/dbraw/zinc/98/12/01/346981201.db2.gz XNLWSVBEWANHES-NSHDSACASA-N 1 2 234.303 2.255 20 0 BEADLO c1c[nH]c(C[N@@H+]2CCC=C(c3cccnc3)C2)n1 ZINC000295695623 187350921 /nfs/dbraw/zinc/35/09/21/187350921.db2.gz DSIISNAZUSMMNI-UHFFFAOYSA-N 1 2 240.310 2.094 20 0 BEADLO c1c[nH]c(C[N@H+]2CCC=C(c3cccnc3)C2)n1 ZINC000295695623 187350923 /nfs/dbraw/zinc/35/09/23/187350923.db2.gz DSIISNAZUSMMNI-UHFFFAOYSA-N 1 2 240.310 2.094 20 0 BEADLO Cc1nnc(C[NH2+]C2(c3cccc(F)c3)CC2)o1 ZINC000179695975 346993205 /nfs/dbraw/zinc/99/32/05/346993205.db2.gz HPNLVCPKFIVPML-UHFFFAOYSA-N 1 2 247.273 2.296 20 0 BEADLO CC1(C)C[C@@H](O)CCN(c2cccc[nH+]2)C1 ZINC000295847421 343867799 /nfs/dbraw/zinc/86/77/99/343867799.db2.gz AYVBYGYWFHPLPS-NSHDSACASA-N 1 2 220.316 2.069 20 0 BEADLO Cn1cc[nH+]c1-c1cccc(NC(=O)C2CC2)c1 ZINC000299062617 187353592 /nfs/dbraw/zinc/35/35/92/187353592.db2.gz OZBNQZRBTXYIMD-UHFFFAOYSA-N 1 2 241.294 2.436 20 0 BEADLO Cc1cccc(CCNc2cccc[nH+]2)n1 ZINC000336744440 537834403 /nfs/dbraw/zinc/83/44/03/537834403.db2.gz UYLLRUPWKKZDFB-UHFFFAOYSA-N 1 2 213.284 2.440 20 0 BEADLO Cc1cc(C[NH2+]Cc2c[nH]nc2C(C)(C)C)no1 ZINC000067718609 343901417 /nfs/dbraw/zinc/90/14/17/343901417.db2.gz PRULUXNXKDMQQO-UHFFFAOYSA-N 1 2 248.330 2.293 20 0 BEADLO Cn1ncc(Cl)c1CNc1cccc[nH+]1 ZINC000128762695 343914027 /nfs/dbraw/zinc/91/40/27/343914027.db2.gz RUDVEPGPTFXCEQ-UHFFFAOYSA-N 1 2 222.679 2.081 20 0 BEADLO CN(C[C@@H]1CC=CCC1)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492903722 529944428 /nfs/dbraw/zinc/94/44/28/529944428.db2.gz URLRLINWPBMRNK-QDZRJHCZSA-N 1 2 245.326 2.238 20 0 BEADLO CN(C[C@@H]1CC=CCC1)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492903718 529944441 /nfs/dbraw/zinc/94/44/41/529944441.db2.gz URLRLINWPBMRNK-ABZNLYFFSA-N 1 2 245.326 2.238 20 0 BEADLO Cc1c[nH]c(C[N@@H+](C)Cc2cccc(F)c2)n1 ZINC000628119369 343970462 /nfs/dbraw/zinc/97/04/62/343970462.db2.gz ORDNWAITORPVDX-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1c[nH]c(C[N@H+](C)Cc2cccc(F)c2)n1 ZINC000628119369 343970465 /nfs/dbraw/zinc/97/04/65/343970465.db2.gz ORDNWAITORPVDX-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1c[nH]c(CN(C)Cc2cccc(F)c2)[nH+]1 ZINC000628119369 343970467 /nfs/dbraw/zinc/97/04/67/343970467.db2.gz ORDNWAITORPVDX-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2cccc(O)c2)o1 ZINC000628117558 343966227 /nfs/dbraw/zinc/96/62/27/343966227.db2.gz NMQSMEGPJBLINI-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2cccc(O)c2)o1 ZINC000628117558 343966229 /nfs/dbraw/zinc/96/62/29/343966229.db2.gz NMQSMEGPJBLINI-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO Cc1c[nH]c(CN(C)Cc2ccc(C)o2)[nH+]1 ZINC000628120010 343968594 /nfs/dbraw/zinc/96/85/94/343968594.db2.gz UDAVESPSWREDQJ-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO Cc1[nH+]c2ccc(C(=O)N3CC[C@H]3C)cc2n1C ZINC000641244249 362320801 /nfs/dbraw/zinc/32/08/01/362320801.db2.gz XRGIASKYKNMPHJ-SECBINFHSA-N 1 2 243.310 2.116 20 0 BEADLO Cc1cc(NC(=O)COC2CCCC2)cc[nH+]1 ZINC000078892644 344103896 /nfs/dbraw/zinc/10/38/96/344103896.db2.gz AGLHHACACXRCOZ-UHFFFAOYSA-N 1 2 234.299 2.288 20 0 BEADLO CCC(C)(C)N(C)C(=O)CCCn1cc[nH+]c1 ZINC000605464146 344104765 /nfs/dbraw/zinc/10/47/65/344104765.db2.gz SYMHJSQUQDEOCN-UHFFFAOYSA-N 1 2 237.347 2.310 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1C[C@@H](C)C[C@H]1C ZINC000335912315 344085000 /nfs/dbraw/zinc/08/50/00/344085000.db2.gz RUMKWBDRGKSUDW-GXSJLCMTSA-N 1 2 233.315 2.074 20 0 BEADLO CC(C)(C)n1cc(C[NH+](C2CC2)C2CC2)nn1 ZINC000625840911 344092261 /nfs/dbraw/zinc/09/22/61/344092261.db2.gz AAINVECLEUMEDX-UHFFFAOYSA-N 1 2 234.347 2.160 20 0 BEADLO COCc1nc(C[NH+](C2CC2)C2CC2)cs1 ZINC000625839359 344092644 /nfs/dbraw/zinc/09/26/44/344092644.db2.gz XWBFKEFCBCNBSZ-UHFFFAOYSA-N 1 2 238.356 2.416 20 0 BEADLO C[C@H](CNc1cc(CO)cc[nH+]1)C1CC1 ZINC000641307944 362356275 /nfs/dbraw/zinc/35/62/75/362356275.db2.gz MTPSZXCMXFMSFQ-SECBINFHSA-N 1 2 206.289 2.032 20 0 BEADLO Cc1ccc(C[NH2+]Cc2nc(C#N)cs2)o1 ZINC000395288077 344143841 /nfs/dbraw/zinc/14/38/41/344143841.db2.gz DPHHPJKAOOIIRB-UHFFFAOYSA-N 1 2 233.296 2.206 20 0 BEADLO COCC[C@H](C)Nc1cc[nH+]c2ccncc12 ZINC000085660318 344207619 /nfs/dbraw/zinc/20/76/19/344207619.db2.gz PVNFZKYRPRFMSR-JTQLQIEISA-N 1 2 231.299 2.467 20 0 BEADLO CCCc1cc(C(=O)Nc2cc[nH+]cc2C)n[nH]1 ZINC000107287139 344235879 /nfs/dbraw/zinc/23/58/79/344235879.db2.gz YBSBTCLDJGPVRH-UHFFFAOYSA-N 1 2 244.298 2.318 20 0 BEADLO CC(C)CCOCCNc1cc[nH+]cc1F ZINC000641316695 362363168 /nfs/dbraw/zinc/36/31/68/362363168.db2.gz TZCMSRXCHCIARC-UHFFFAOYSA-N 1 2 226.295 2.117 20 0 BEADLO Cn1c[nH+]cc1CS[C@@H]1COC(C)(C)C1 ZINC000600571982 344286807 /nfs/dbraw/zinc/28/68/07/344286807.db2.gz NXJMTCKIVUQCAX-JTQLQIEISA-N 1 2 226.345 2.221 20 0 BEADLO CCc1ncc(C[N@@H+]2CCO[C@H](C)[C@@H]2C)s1 ZINC000093417684 344315620 /nfs/dbraw/zinc/31/56/20/344315620.db2.gz SDAPQPGCDQMRDZ-VHSXEESVSA-N 1 2 240.372 2.315 20 0 BEADLO CCc1ncc(C[N@H+]2CCO[C@H](C)[C@@H]2C)s1 ZINC000093417684 344315621 /nfs/dbraw/zinc/31/56/21/344315621.db2.gz SDAPQPGCDQMRDZ-VHSXEESVSA-N 1 2 240.372 2.315 20 0 BEADLO Cc1ccc(C(=O)N[C@H](C)c2[nH+]ccn2C)s1 ZINC000620592284 344325723 /nfs/dbraw/zinc/32/57/23/344325723.db2.gz ODYCSUWJWYXACF-SECBINFHSA-N 1 2 249.339 2.281 20 0 BEADLO CCn1ccnc1C[NH2+][C@@H](C)c1c(C)noc1C ZINC000084224983 344330028 /nfs/dbraw/zinc/33/00/28/344330028.db2.gz AFFBVJUQRYPPKI-VIFPVBQESA-N 1 2 248.330 2.359 20 0 BEADLO CCO[C@H](CSCCn1cc[nH+]c1)C1CC1 ZINC000600636577 344347759 /nfs/dbraw/zinc/34/77/59/344347759.db2.gz HYEVDQBLDDNCJM-GFCCVEGCSA-N 1 2 240.372 2.431 20 0 BEADLO CC(C)C[C@@H](C)C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620603468 344353774 /nfs/dbraw/zinc/35/37/74/344353774.db2.gz IOPWQEMYJLGZES-MNOVXSKESA-N 1 2 237.347 2.280 20 0 BEADLO CC(C)CCCC(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620607992 344358276 /nfs/dbraw/zinc/35/82/76/344358276.db2.gz LQHSPHAIPCELEI-LLVKDONJSA-N 1 2 237.347 2.424 20 0 BEADLO C[C@H](NC(=O)[C@]1(C)C[C@H]2C[C@H]2C1)c1[nH+]ccn1C ZINC000620610076 344358679 /nfs/dbraw/zinc/35/86/79/344358679.db2.gz VHDCWPGNWCKJTH-DYNIEEOBSA-N 1 2 247.342 2.034 20 0 BEADLO COc1cc[nH+]cc1NC(=O)CSC(C)C ZINC000522707994 259375585 /nfs/dbraw/zinc/37/55/85/259375585.db2.gz YMDPUEXPSYYXSA-UHFFFAOYSA-N 1 2 240.328 2.170 20 0 BEADLO CCOCCC(=O)Nc1ccn2cc(C)[nH+]c2c1 ZINC000620650012 344435944 /nfs/dbraw/zinc/43/59/44/344435944.db2.gz JRRNHFYWUPNSPL-UHFFFAOYSA-N 1 2 247.298 2.008 20 0 BEADLO Cn1cc[nH+]c1CNc1ccc([N+](=O)[O-])s1 ZINC000381563071 344521308 /nfs/dbraw/zinc/52/13/08/344521308.db2.gz RYRGMYPEGNHIOF-UHFFFAOYSA-N 1 2 238.272 2.002 20 0 BEADLO CC[N@H+](Cc1cccs1)[C@@H](C)C(=O)OC ZINC000043628845 344528794 /nfs/dbraw/zinc/52/87/94/344528794.db2.gz IXMFCVSLPKPJPN-VIFPVBQESA-N 1 2 227.329 2.132 20 0 BEADLO CC[N@@H+](Cc1cccs1)[C@@H](C)C(=O)OC ZINC000043628845 344528795 /nfs/dbraw/zinc/52/87/95/344528795.db2.gz IXMFCVSLPKPJPN-VIFPVBQESA-N 1 2 227.329 2.132 20 0 BEADLO C[C@H](CNc1cc(CO)cc[nH+]1)c1ccncc1 ZINC000641418763 362405846 /nfs/dbraw/zinc/40/58/46/362405846.db2.gz PKSJEBVCHJOYAG-LLVKDONJSA-N 1 2 243.310 2.185 20 0 BEADLO CCC(=O)CCCSc1nc(N)cc(C)[nH+]1 ZINC000183852267 347054111 /nfs/dbraw/zinc/05/41/11/347054111.db2.gz QLJBOJKFRIHHCK-UHFFFAOYSA-N 1 2 239.344 2.219 20 0 BEADLO CCCC[C@@H]([NH2+]CCSC(C)C)C(=O)OC ZINC000309400291 347055028 /nfs/dbraw/zinc/05/50/28/347055028.db2.gz UFCMMRAVPPSIJL-LLVKDONJSA-N 1 2 247.404 2.449 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1CCC[C@H]2OCC[C@@H]21 ZINC000641441592 362419238 /nfs/dbraw/zinc/41/92/38/362419238.db2.gz NHUUJIYNQJQLKM-IRUJWGPZSA-N 1 2 236.290 2.012 20 0 BEADLO C[C@@H](CC(=O)N1CCC[C@H](C)CC1)n1cc[nH+]c1 ZINC000577734537 344593962 /nfs/dbraw/zinc/59/39/62/344593962.db2.gz ABFOYMQZEUUWOF-STQMWFEESA-N 1 2 249.358 2.483 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@@H]([C@@H]2CCOC2)C1 ZINC000641457699 362428843 /nfs/dbraw/zinc/42/88/43/362428843.db2.gz ZGOOJUKHNZBOGD-GHMZBOCLSA-N 1 2 236.290 2.084 20 0 BEADLO CCC[C@@H]1CN(c2cc[nH+]cc2F)CCO1 ZINC000641463736 362434531 /nfs/dbraw/zinc/43/45/31/362434531.db2.gz KXFDBIGJGKQDLZ-SNVBAGLBSA-N 1 2 224.279 2.226 20 0 BEADLO CCCc1nnc(SCc2cn(C)c[nH+]2)o1 ZINC000641465578 362438684 /nfs/dbraw/zinc/43/86/84/362438684.db2.gz GMMDYZPFYZQDLM-UHFFFAOYSA-N 1 2 238.316 2.048 20 0 BEADLO CC(C)C1(CNc2cc(CO)cc[nH+]2)CC1 ZINC000641424421 362408616 /nfs/dbraw/zinc/40/86/16/362408616.db2.gz ACEPQFAFKPCJIR-UHFFFAOYSA-N 1 2 220.316 2.422 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1CCC[C@@H]2OCC[C@H]21 ZINC000641441593 362418408 /nfs/dbraw/zinc/41/84/08/362418408.db2.gz NHUUJIYNQJQLKM-NDMJEZRESA-N 1 2 236.290 2.012 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1CCC[C@H]2OCC[C@H]21 ZINC000641441595 362418545 /nfs/dbraw/zinc/41/85/45/362418545.db2.gz NHUUJIYNQJQLKM-UFGOTCBOSA-N 1 2 236.290 2.012 20 0 BEADLO C[C@H](Nc1cc[nH+]cc1F)[C@H]1CCCCO1 ZINC000641481864 362449968 /nfs/dbraw/zinc/44/99/68/362449968.db2.gz ALHKTWIZYPAJNV-JOYOIKCWSA-N 1 2 224.279 2.012 20 0 BEADLO C[C@H](Nc1cc[nH+]cc1F)[C@@H]1CCCCO1 ZINC000641481863 362450221 /nfs/dbraw/zinc/45/02/21/362450221.db2.gz ALHKTWIZYPAJNV-CABZTGNLSA-N 1 2 224.279 2.012 20 0 BEADLO CC1(C)C[C@H](Nc2cc[nH+]cc2F)C(C)(C)O1 ZINC000641483483 362451594 /nfs/dbraw/zinc/45/15/94/362451594.db2.gz QHVZXEOQFYZNBG-NSHDSACASA-N 1 2 238.306 2.401 20 0 BEADLO C[C@H](CNc1cc[nH+]cc1F)c1nccs1 ZINC000641489173 362457718 /nfs/dbraw/zinc/45/77/18/362457718.db2.gz MPBUEPGULJPFHP-MRVPVSSYSA-N 1 2 237.303 2.315 20 0 BEADLO Fc1c[nH+]ccc1N[C@H]1CCO[C@@H](C2CC2)C1 ZINC000641491429 362459871 /nfs/dbraw/zinc/45/98/71/362459871.db2.gz PFRKFHALLAOEGJ-GXFFZTMASA-N 1 2 236.290 2.012 20 0 BEADLO CC1(C)CC(CNc2cc(CO)cc[nH+]2)C1 ZINC000641521520 362478800 /nfs/dbraw/zinc/47/88/00/362478800.db2.gz NQPAUABBCQEZNJ-UHFFFAOYSA-N 1 2 220.316 2.422 20 0 BEADLO CCOC1CC(CCNc2cc[nH+]cc2F)C1 ZINC000641541075 362488749 /nfs/dbraw/zinc/48/87/49/362488749.db2.gz AWVNBNSEKQDEAN-UHFFFAOYSA-N 1 2 238.306 2.260 20 0 BEADLO Fc1ccc(C[NH2+]CC(F)F)cc1F ZINC000049577802 344654361 /nfs/dbraw/zinc/65/43/61/344654361.db2.gz JYNOINFLLZCWEK-UHFFFAOYSA-N 1 2 207.170 2.320 20 0 BEADLO Cc1ccc(C[NH+]2CCC(=O)CC2)s1 ZINC000050225574 344659722 /nfs/dbraw/zinc/65/97/22/344659722.db2.gz MSSWIDRZMLRRTK-UHFFFAOYSA-N 1 2 209.314 2.221 20 0 BEADLO C[C@H](c1ccncc1)[N@@H+]1CCO[C@@H](CCF)C1 ZINC000626002014 344662170 /nfs/dbraw/zinc/66/21/70/344662170.db2.gz DMSOVQXQSGNTCK-YPMHNXCESA-N 1 2 238.306 2.203 20 0 BEADLO C[C@H](c1ccncc1)[N@H+]1CCO[C@@H](CCF)C1 ZINC000626002014 344662173 /nfs/dbraw/zinc/66/21/73/344662173.db2.gz DMSOVQXQSGNTCK-YPMHNXCESA-N 1 2 238.306 2.203 20 0 BEADLO CCc1ccc(C[NH2+]Cc2cc(C)on2)cn1 ZINC000560495326 344743771 /nfs/dbraw/zinc/74/37/71/344743771.db2.gz KKTNYJWZYGBREZ-UHFFFAOYSA-N 1 2 231.299 2.230 20 0 BEADLO Cc1nc(NC[C@@H](CCO)CC(C)C)cc[nH+]1 ZINC000075062255 344764261 /nfs/dbraw/zinc/76/42/61/344764261.db2.gz QEQYBSMULNWELU-LBPRGKRZSA-N 1 2 237.347 2.242 20 0 BEADLO CC[C@H]1C[C@@H](C)CN1c1cc[nH+]c(C)n1 ZINC000075065973 344764827 /nfs/dbraw/zinc/76/48/27/344764827.db2.gz MGDHHWOABKCCEQ-KOLCDFICSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1nc(N[C@@H](CO)C2CCCCC2)cc[nH+]1 ZINC000075066300 344764946 /nfs/dbraw/zinc/76/49/46/344764946.db2.gz LOGWBYZNMFYRDV-LBPRGKRZSA-N 1 2 235.331 2.138 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)/C=C\C1CCCC1 ZINC000493186114 530026941 /nfs/dbraw/zinc/02/69/41/530026941.db2.gz JZEMYDYTXXDVKJ-FPLPWBNLSA-N 1 2 247.342 2.125 20 0 BEADLO CCOc1nnc(C[N@@H+]2CCC(C)(C)C2)s1 ZINC000076015390 344790614 /nfs/dbraw/zinc/79/06/14/344790614.db2.gz TXXBDOMDFPDKON-UHFFFAOYSA-N 1 2 241.360 2.169 20 0 BEADLO CCOc1nnc(C[N@H+]2CCC(C)(C)C2)s1 ZINC000076015390 344790616 /nfs/dbraw/zinc/79/06/16/344790616.db2.gz TXXBDOMDFPDKON-UHFFFAOYSA-N 1 2 241.360 2.169 20 0 BEADLO C[C@H]1C[N@H+](Cc2noc(C(C)(C)C)n2)C[C@H]1C ZINC000076110486 344795195 /nfs/dbraw/zinc/79/51/95/344795195.db2.gz UMUIJWCZQOIKJB-AOOOYVTPSA-N 1 2 237.347 2.455 20 0 BEADLO C[C@H]1C[N@@H+](Cc2noc(C(C)(C)C)n2)C[C@H]1C ZINC000076110486 344795196 /nfs/dbraw/zinc/79/51/96/344795196.db2.gz UMUIJWCZQOIKJB-AOOOYVTPSA-N 1 2 237.347 2.455 20 0 BEADLO Cc1ncc(C[N@@H+]2CCc3ccc(O)cc3C2)o1 ZINC000628145436 344820773 /nfs/dbraw/zinc/82/07/73/344820773.db2.gz MVNUHMCISLNJEP-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO Cc1ncc(C[N@H+]2CCc3ccc(O)cc3C2)o1 ZINC000628145436 344820775 /nfs/dbraw/zinc/82/07/75/344820775.db2.gz MVNUHMCISLNJEP-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO OCc1cc[nH+]c(NC[C@@H]2CCC(F)(F)C2)c1 ZINC000641547558 362495186 /nfs/dbraw/zinc/49/51/86/362495186.db2.gz BNYPXJSDYHUTBF-SNVBAGLBSA-N 1 2 242.269 2.421 20 0 BEADLO CN(C)c1ncccc1CNc1cccc[nH+]1 ZINC000076721403 344809023 /nfs/dbraw/zinc/80/90/23/344809023.db2.gz DAYYDDALWBMOOT-UHFFFAOYSA-N 1 2 228.299 2.155 20 0 BEADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccon2)on1 ZINC000077265837 344814494 /nfs/dbraw/zinc/81/44/94/344814494.db2.gz FVYCOGMBICLKDJ-NSHDSACASA-N 1 2 233.271 2.308 20 0 BEADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccon2)on1 ZINC000077265837 344814496 /nfs/dbraw/zinc/81/44/96/344814496.db2.gz FVYCOGMBICLKDJ-NSHDSACASA-N 1 2 233.271 2.308 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2CCCO[C@@H]2C)c(C)[nH+]1 ZINC000189232932 178744118 /nfs/dbraw/zinc/74/41/18/178744118.db2.gz LNTIDJRRWXDZEN-VXGBXAGGSA-N 1 2 248.326 2.452 20 0 BEADLO CC(C)N(C)C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000335338212 534972708 /nfs/dbraw/zinc/97/27/08/534972708.db2.gz GYKPDLXTWBOBDY-SNVBAGLBSA-N 1 2 236.319 2.007 20 0 BEADLO CCCC[C@H](COC)Nc1cc[nH+]c(C)n1 ZINC000078293050 344841652 /nfs/dbraw/zinc/84/16/52/344841652.db2.gz USYOUDUBGNECSW-LLVKDONJSA-N 1 2 223.320 2.402 20 0 BEADLO Cc1[nH]c(CN(C)Cc2cscn2)[nH+]c1C ZINC000628156034 344846448 /nfs/dbraw/zinc/84/64/48/344846448.db2.gz YIWCXKFPZMIKRX-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@@H](C)S[C@@H](C)C2)[nH]c1C ZINC000628156261 344847887 /nfs/dbraw/zinc/84/78/87/344847887.db2.gz JENFKCBHKGDOFM-DTORHVGOSA-N 1 2 239.388 2.352 20 0 BEADLO Cc1nc(C[N@H+]2C[C@@H](C)S[C@@H](C)C2)[nH]c1C ZINC000628156261 344847888 /nfs/dbraw/zinc/84/78/88/344847888.db2.gz JENFKCBHKGDOFM-DTORHVGOSA-N 1 2 239.388 2.352 20 0 BEADLO Cc1[nH]c(CN2C[C@@H](C)S[C@@H](C)C2)[nH+]c1C ZINC000628156261 344847890 /nfs/dbraw/zinc/84/78/90/344847890.db2.gz JENFKCBHKGDOFM-DTORHVGOSA-N 1 2 239.388 2.352 20 0 BEADLO Cc1nc(NC[C@](C)(O)c2cccs2)cc[nH+]1 ZINC000078297545 344842313 /nfs/dbraw/zinc/84/23/13/344842313.db2.gz IMFKJIPWEMTVQL-LBPRGKRZSA-N 1 2 249.339 2.166 20 0 BEADLO CO[C@H]1CCCC[C@H]1Nc1cccc[nH+]1 ZINC000078427361 344867386 /nfs/dbraw/zinc/86/73/86/344867386.db2.gz DGKMEVVBNAVDRC-MNOVXSKESA-N 1 2 206.289 2.451 20 0 BEADLO Cc1ncc(C[N@H+]2CCOC[C@@H]2CC(C)C)o1 ZINC000628172594 344892943 /nfs/dbraw/zinc/89/29/43/344892943.db2.gz NFJWFFYJTQLRAH-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1ncc(C[N@@H+]2CCOC[C@@H]2CC(C)C)o1 ZINC000628172594 344892945 /nfs/dbraw/zinc/89/29/45/344892945.db2.gz NFJWFFYJTQLRAH-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1ccc(N[C@@H](C)c2cnn(C)c2)c[nH+]1 ZINC000154242549 178771016 /nfs/dbraw/zinc/77/10/16/178771016.db2.gz MJSKEECKYJTARB-JTQLQIEISA-N 1 2 216.288 2.297 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CC(C)(C)OCC2(C)C)n1 ZINC000628178426 344908999 /nfs/dbraw/zinc/90/89/99/344908999.db2.gz PTIYXDQVHAFTLL-UHFFFAOYSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CC(C)(C)OCC2(C)C)n1 ZINC000628178426 344909003 /nfs/dbraw/zinc/90/90/03/344909003.db2.gz PTIYXDQVHAFTLL-UHFFFAOYSA-N 1 2 237.347 2.108 20 0 BEADLO C=Cc1ccc(C(=O)Nc2cc[nH+]cc2O)cc1 ZINC000358727150 187294828 /nfs/dbraw/zinc/29/48/28/187294828.db2.gz WHPUPWYNJKANMG-UHFFFAOYSA-N 1 2 240.262 2.104 20 0 BEADLO C[NH+](C)Cc1nc(C2Cc3ccccc3C2)no1 ZINC000583420300 344930874 /nfs/dbraw/zinc/93/08/74/344930874.db2.gz MZPZOKIIZIHXHX-UHFFFAOYSA-N 1 2 243.310 2.014 20 0 BEADLO Cc1[nH]c(CN2CCOC(C)(C)[C@@H]2C)[nH+]c1C ZINC000628179089 344913860 /nfs/dbraw/zinc/91/38/60/344913860.db2.gz NOERSIUCMQANRE-NSHDSACASA-N 1 2 237.347 2.026 20 0 BEADLO Cc1[nH]c(CN2CCOC(C)(C)[C@H]2C)[nH+]c1C ZINC000628179088 344914134 /nfs/dbraw/zinc/91/41/34/344914134.db2.gz NOERSIUCMQANRE-LLVKDONJSA-N 1 2 237.347 2.026 20 0 BEADLO Cc1nc(C[NH2+]C2(CF)CCC2)cs1 ZINC000574571761 344914975 /nfs/dbraw/zinc/91/49/75/344914975.db2.gz NAGKMEPCMMGYBR-UHFFFAOYSA-N 1 2 214.309 2.433 20 0 BEADLO Cc1ccc([C@@H](C)C[N@H+](C)Cc2nnc[nH]2)cc1 ZINC000628179446 344915174 /nfs/dbraw/zinc/91/51/74/344915174.db2.gz ADTVJWXFFDVAFL-LBPRGKRZSA-N 1 2 244.342 2.349 20 0 BEADLO Cc1ccc([C@@H](C)C[N@@H+](C)Cc2nnc[nH]2)cc1 ZINC000628179446 344915178 /nfs/dbraw/zinc/91/51/78/344915178.db2.gz ADTVJWXFFDVAFL-LBPRGKRZSA-N 1 2 244.342 2.349 20 0 BEADLO CCc1cc(C[NH2+]Cc2oc(C)nc2C)on1 ZINC000628198859 344964238 /nfs/dbraw/zinc/96/42/38/344964238.db2.gz OKNMBRAYUTUFMI-UHFFFAOYSA-N 1 2 235.287 2.132 20 0 BEADLO Cc1c[nH]c(CN2CCc3ccccc32)[nH+]1 ZINC000628199044 344965332 /nfs/dbraw/zinc/96/53/32/344965332.db2.gz ZCNXUZCHQJRDKD-UHFFFAOYSA-N 1 2 213.284 2.281 20 0 BEADLO C[C@H]1CCC[C@H]1CNc1cc(CO)cc[nH+]1 ZINC000641553273 362497462 /nfs/dbraw/zinc/49/74/62/362497462.db2.gz VCCZYLLGBWKTGX-JQWIXIFHSA-N 1 2 220.316 2.422 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@H](C(F)F)C1 ZINC000641552580 362497806 /nfs/dbraw/zinc/49/78/06/362497806.db2.gz JLCOTAGVWBHYEY-ZETCQYMHSA-N 1 2 216.206 2.312 20 0 BEADLO CCc1nnc(SCCCn2cc[nH+]c2)o1 ZINC000641562148 362502493 /nfs/dbraw/zinc/50/24/93/362502493.db2.gz HCEXSDRBSIEALH-UHFFFAOYSA-N 1 2 238.316 2.011 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@@]2(C1)CCCOC2 ZINC000641563071 362503258 /nfs/dbraw/zinc/50/32/58/362503258.db2.gz OZGCBKZGNLKIOX-CYBMUJFWSA-N 1 2 236.290 2.228 20 0 BEADLO COc1ccc([C@H](O)CNc2cccc[nH+]2)cc1 ZINC000079884463 345048412 /nfs/dbraw/zinc/04/84/12/345048412.db2.gz WCIJYDCMCBXTQY-CYBMUJFWSA-N 1 2 244.294 2.236 20 0 BEADLO CC(=O)Nc1cc(NCc2[nH]cc[nH+]2)ccc1F ZINC000049715510 192083694 /nfs/dbraw/zinc/08/36/94/192083694.db2.gz QPYRRCHXKVZOTC-UHFFFAOYSA-N 1 2 248.261 2.119 20 0 BEADLO CO[C@@H]1CCN(c2cc[nH+]cc2F)CC1(C)C ZINC000641619717 362550696 /nfs/dbraw/zinc/55/06/96/362550696.db2.gz WXAMBDDHTPLXNE-GFCCVEGCSA-N 1 2 238.306 2.472 20 0 BEADLO Fc1c[nH+]ccc1NCc1noc2c1CCCC2 ZINC000641598047 362538206 /nfs/dbraw/zinc/53/82/06/362538206.db2.gz HDCWFWQRBKNONW-UHFFFAOYSA-N 1 2 247.273 2.122 20 0 BEADLO C[C@@H](Nc1cc(C2CC2)ncn1)c1[nH]cc[nH+]1 ZINC000641607228 362544166 /nfs/dbraw/zinc/54/41/66/362544166.db2.gz VGVSVFFPTREIKH-MRVPVSSYSA-N 1 2 229.287 2.250 20 0 BEADLO CC(C)(C)O[C@H]1C[C@@H](Nc2cc[nH+]cc2F)C1 ZINC000641646741 362571038 /nfs/dbraw/zinc/57/10/38/362571038.db2.gz VVGFCHZUUSPXKD-AOOOYVTPSA-N 1 2 238.306 2.401 20 0 BEADLO C[C@@H](CNc1cc[nH+]cc1F)CC(F)F ZINC000641646498 362572459 /nfs/dbraw/zinc/57/24/59/362572459.db2.gz TWZBMJGZSJHFHN-SSDOTTSWSA-N 1 2 218.222 2.346 20 0 BEADLO OCc1cc[nH+]c(N2CCC[C@@H](CCF)C2)c1 ZINC000641660300 362579883 /nfs/dbraw/zinc/57/98/83/362579883.db2.gz WUBOSEQBVNGOGL-NSHDSACASA-N 1 2 238.306 2.150 20 0 BEADLO CC[C@H](COCC1CC1)Nc1cc[nH+]cc1F ZINC000641656309 362580002 /nfs/dbraw/zinc/58/00/02/362580002.db2.gz FNCIFQMQGOSWJB-LLVKDONJSA-N 1 2 238.306 2.260 20 0 BEADLO CCC(C)(C)OCCNc1cc[nH+]cc1F ZINC000641627532 362561686 /nfs/dbraw/zinc/56/16/86/362561686.db2.gz POXCSCMBKVAQNX-UHFFFAOYSA-N 1 2 226.295 2.260 20 0 BEADLO OCC[C@@H]1CCCN(c2cc[nH+]cc2F)CC1 ZINC000641637981 362566280 /nfs/dbraw/zinc/56/62/80/362566280.db2.gz UBXKIVCNENRJGF-LLVKDONJSA-N 1 2 238.306 2.210 20 0 BEADLO CO[C@H](CNc1cc[nH+]cc1F)CC(C)C ZINC000641638802 362567373 /nfs/dbraw/zinc/56/73/73/362567373.db2.gz SZWOBVFFOWSIHE-JTQLQIEISA-N 1 2 226.295 2.116 20 0 BEADLO F[C@]1(c2ccccc2)C[C@H]1[NH2+]Cc1ccon1 ZINC000634983967 345167117 /nfs/dbraw/zinc/16/71/17/345167117.db2.gz DBIZXFLQCMZFGY-OLZOCXBDSA-N 1 2 232.258 2.402 20 0 BEADLO CC(C)Oc1ncccc1C[NH2+]Cc1ccon1 ZINC000634953010 345129096 /nfs/dbraw/zinc/12/90/96/345129096.db2.gz OMWFNUHITZPRAP-UHFFFAOYSA-N 1 2 247.298 2.147 20 0 BEADLO CC[C@H](CSC)Nc1cc(CO)cc[nH+]1 ZINC000603328804 349924210 /nfs/dbraw/zinc/92/42/10/349924210.db2.gz HFCTWUQXLSTNNT-SNVBAGLBSA-N 1 2 226.345 2.127 20 0 BEADLO Cc1cscc1C[NH2+]Cc1ccon1 ZINC000634979266 345159201 /nfs/dbraw/zinc/15/92/01/345159201.db2.gz ZPJMBPMHLAVINK-UHFFFAOYSA-N 1 2 208.286 2.334 20 0 BEADLO CCN(CC)C(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC000635064108 345234761 /nfs/dbraw/zinc/23/47/61/345234761.db2.gz QHMHSQDKZIAXMA-LBPRGKRZSA-N 1 2 237.347 2.339 20 0 BEADLO CC(C)C[C@@H](C(=O)N[C@H](C)C1CC1)n1cc[nH+]c1 ZINC000635126286 345252263 /nfs/dbraw/zinc/25/22/63/345252263.db2.gz ZBYFGHAFJFDVSN-YPMHNXCESA-N 1 2 249.358 2.385 20 0 BEADLO COc1ccc(NC(=O)[C@H](C)n2cc[nH+]c2)cc1 ZINC000053898698 1172059628 /nfs/dbraw/zinc/05/96/28/1172059628.db2.gz FJLMICKPMVIXNJ-JTQLQIEISA-N 1 2 245.282 2.091 20 0 BEADLO CC1(C)C[C@@H]1C(=O)NCCCNc1cccc[nH+]1 ZINC000129753011 345261904 /nfs/dbraw/zinc/26/19/04/345261904.db2.gz BJAKSZVOVSBZJA-LLVKDONJSA-N 1 2 247.342 2.046 20 0 BEADLO CC(C)CC[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635187986 345267074 /nfs/dbraw/zinc/26/70/74/345267074.db2.gz GDNXSWQVUWLZHY-IJLUTSLNSA-N 1 2 249.358 2.454 20 0 BEADLO CC(C)CC[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635187986 345267077 /nfs/dbraw/zinc/26/70/77/345267077.db2.gz GDNXSWQVUWLZHY-IJLUTSLNSA-N 1 2 249.358 2.454 20 0 BEADLO CC(C)C[C@H](C(=O)NC(C)(C)C)n1cc[nH+]c1 ZINC000635201038 345270464 /nfs/dbraw/zinc/27/04/64/345270464.db2.gz KAFAIOHHODYTPV-LLVKDONJSA-N 1 2 237.347 2.385 20 0 BEADLO C[C@H](N(C)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C(C)(C)C ZINC000635224638 345277525 /nfs/dbraw/zinc/27/75/25/345277525.db2.gz RCWBSGIUHWTCLS-HBNTYKKESA-N 1 2 249.358 2.406 20 0 BEADLO C[C@H](N(C)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C(C)(C)C ZINC000635224638 345277529 /nfs/dbraw/zinc/27/75/29/345277529.db2.gz RCWBSGIUHWTCLS-HBNTYKKESA-N 1 2 249.358 2.406 20 0 BEADLO CCc1c[nH]c(CC(=O)NCCCC(C)C)[nH+]1 ZINC000635241494 345282278 /nfs/dbraw/zinc/28/22/78/345282278.db2.gz VBHMFWOPUOFPQE-UHFFFAOYSA-N 1 2 237.347 2.067 20 0 BEADLO Cc1cn2ccc(C(=O)NCC3CCC3)cc2[nH+]1 ZINC000635266356 345292024 /nfs/dbraw/zinc/29/20/24/345292024.db2.gz DJVVPDKLUFDONV-UHFFFAOYSA-N 1 2 243.310 2.173 20 0 BEADLO CC(C)C[C@H](C(=O)NC[C@@H]1C[C@H]1C)n1cc[nH+]c1 ZINC000635300964 345299303 /nfs/dbraw/zinc/29/93/03/345299303.db2.gz QPHCUMHDNUSUOY-FRRDWIJNSA-N 1 2 249.358 2.243 20 0 BEADLO CC(C)C[C@H](C(=O)N[C@H]1CC1(C)C)n1cc[nH+]c1 ZINC000635406983 345351370 /nfs/dbraw/zinc/35/13/70/345351370.db2.gz PRRDWCKZVCITMN-NEPJUHHUSA-N 1 2 249.358 2.385 20 0 BEADLO Cc1cc(N[C@H]2CC23CC3)nc(C(C)C)[nH+]1 ZINC000425271757 192087521 /nfs/dbraw/zinc/08/75/21/192087521.db2.gz JJLKLNYMFAYCSE-JTQLQIEISA-N 1 2 217.316 2.295 20 0 BEADLO CNc1nc(N[C@H]2CC23CC3)[nH+]c2ccccc21 ZINC000425275260 192087830 /nfs/dbraw/zinc/08/78/30/192087830.db2.gz TVUGEFHJTMBNND-NSHDSACASA-N 1 2 240.310 2.058 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@H](C)[C@@H](C)CC)[nH+]1 ZINC000635419791 345359884 /nfs/dbraw/zinc/35/98/84/345359884.db2.gz GXEFZSAHEVLCLD-VHSXEESVSA-N 1 2 237.347 2.065 20 0 BEADLO CCC[C@@H](CC)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635443767 345373441 /nfs/dbraw/zinc/37/34/41/345373441.db2.gz KTKFPYNLYYBZCY-GMTAPVOTSA-N 1 2 235.331 2.208 20 0 BEADLO CCC[C@@H](CC)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635443767 345373444 /nfs/dbraw/zinc/37/34/44/345373444.db2.gz KTKFPYNLYYBZCY-GMTAPVOTSA-N 1 2 235.331 2.208 20 0 BEADLO COC[C@@H](C)Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000080762780 345449914 /nfs/dbraw/zinc/44/99/14/345449914.db2.gz ODYRNNHLRARSEX-SECBINFHSA-N 1 2 223.320 2.221 20 0 BEADLO CCC[C@@H]1C[C@@H]1C(=O)NC[C@@H](C)Cn1cc[nH+]c1 ZINC000081801798 345492647 /nfs/dbraw/zinc/49/26/47/345492647.db2.gz UWUBHNOLHWKVFF-UPJWGTAASA-N 1 2 249.358 2.072 20 0 BEADLO CC(C)C[C@H](C(=O)NC1CCC1)n1cc[nH+]c1 ZINC000635535919 345494592 /nfs/dbraw/zinc/49/45/92/345494592.db2.gz QGUYWVXJOYLKIB-GFCCVEGCSA-N 1 2 235.331 2.139 20 0 BEADLO CC(C)C[C@@H](C(=O)NC1CCC1)n1cc[nH+]c1 ZINC000635535925 345494834 /nfs/dbraw/zinc/49/48/34/345494834.db2.gz QGUYWVXJOYLKIB-LBPRGKRZSA-N 1 2 235.331 2.139 20 0 BEADLO CC(C)(F)CCNc1cc[nH+]cc1F ZINC000641659421 362584042 /nfs/dbraw/zinc/58/40/42/362584042.db2.gz OXLWOOZSCFWYBW-UHFFFAOYSA-N 1 2 200.232 2.193 20 0 BEADLO CC[C@@H](Nc1cc(CO)cc[nH+]1)C1CC1 ZINC000641660624 362587267 /nfs/dbraw/zinc/58/72/67/362587267.db2.gz HDBVIUCFOWEROQ-LLVKDONJSA-N 1 2 206.289 2.174 20 0 BEADLO CC(C)(Nc1ncc(Cl)cn1)c1[nH]cc[nH+]1 ZINC000641664745 362589406 /nfs/dbraw/zinc/58/94/06/362589406.db2.gz LQSYNIDCRAZLBA-UHFFFAOYSA-N 1 2 237.694 2.200 20 0 BEADLO C[C@H](c1cccnc1)[N@H+](C)Cc1cnccn1 ZINC000080965986 345456319 /nfs/dbraw/zinc/45/63/19/345456319.db2.gz VVCFXSIVPOHTAB-LLVKDONJSA-N 1 2 228.299 2.065 20 0 BEADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1cnccn1 ZINC000080965986 345456321 /nfs/dbraw/zinc/45/63/21/345456321.db2.gz VVCFXSIVPOHTAB-LLVKDONJSA-N 1 2 228.299 2.065 20 0 BEADLO CC(C)(C)c1nc(NC2(CO)CCCC2)cc[nH+]1 ZINC000081012855 345461696 /nfs/dbraw/zinc/46/16/96/345461696.db2.gz KNMXMLKLNYJGQY-UHFFFAOYSA-N 1 2 249.358 2.491 20 0 BEADLO Cc1cc(NC(=O)CC2(O)CCCCC2)cc[nH+]1 ZINC000081386615 345472692 /nfs/dbraw/zinc/47/26/92/345472692.db2.gz CYDWVPNSEZXXNH-UHFFFAOYSA-N 1 2 248.326 2.414 20 0 BEADLO CC(C)C[C@H](CO)Nc1cc[nH+]c2ccncc12 ZINC000085685614 345529015 /nfs/dbraw/zinc/52/90/15/345529015.db2.gz ZQZKDFVQHQVPIT-LLVKDONJSA-N 1 2 245.326 2.449 20 0 BEADLO C[C@H](CCCO)Nc1cc[nH+]c2ccncc12 ZINC000088758383 345545396 /nfs/dbraw/zinc/54/53/96/345545396.db2.gz PSPSTNYYHIYTCP-SNVBAGLBSA-N 1 2 231.299 2.203 20 0 BEADLO C[C@@H](CCCO)Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000088758196 345545452 /nfs/dbraw/zinc/54/54/52/345545452.db2.gz GYYNDEFVSBKALW-JTQLQIEISA-N 1 2 237.347 2.347 20 0 BEADLO CCOC(=O)C[N@H+](C)C[C@H]1CCCCC1(F)F ZINC000394677840 323090560 /nfs/dbraw/zinc/09/05/60/323090560.db2.gz WVPHUJVOECYLKL-SNVBAGLBSA-N 1 2 249.301 2.307 20 0 BEADLO CCOC(=O)C[N@@H+](C)C[C@H]1CCCCC1(F)F ZINC000394677840 323090561 /nfs/dbraw/zinc/09/05/61/323090561.db2.gz WVPHUJVOECYLKL-SNVBAGLBSA-N 1 2 249.301 2.307 20 0 BEADLO CC(C)CC(C)(C)C(=O)NCc1[nH+]ccn1C ZINC000084598985 345519431 /nfs/dbraw/zinc/51/94/31/345519431.db2.gz AIKRTRSSODKOFO-UHFFFAOYSA-N 1 2 237.347 2.109 20 0 BEADLO C[N@H+](CCO)[C@@H](CCc1ccccc1)C(F)F ZINC000626135814 345602502 /nfs/dbraw/zinc/60/25/02/345602502.db2.gz IVZWVUQKOFVHOC-LBPRGKRZSA-N 1 2 243.297 2.177 20 0 BEADLO C[N@@H+](CCO)[C@@H](CCc1ccccc1)C(F)F ZINC000626135814 345602503 /nfs/dbraw/zinc/60/25/03/345602503.db2.gz IVZWVUQKOFVHOC-LBPRGKRZSA-N 1 2 243.297 2.177 20 0 BEADLO C[N@H+](CCO)[C@H](CCc1ccccc1)C(F)F ZINC000626135813 345602668 /nfs/dbraw/zinc/60/26/68/345602668.db2.gz IVZWVUQKOFVHOC-GFCCVEGCSA-N 1 2 243.297 2.177 20 0 BEADLO C[N@@H+](CCO)[C@H](CCc1ccccc1)C(F)F ZINC000626135813 345602671 /nfs/dbraw/zinc/60/26/71/345602671.db2.gz IVZWVUQKOFVHOC-GFCCVEGCSA-N 1 2 243.297 2.177 20 0 BEADLO Fc1ccc(C[N@@H+]2CCc3n[nH]cc3C2)cc1F ZINC000091077820 345582180 /nfs/dbraw/zinc/58/21/80/345582180.db2.gz ZPHAFURWEFRSAQ-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO Fc1ccc(C[N@H+]2CCc3n[nH]cc3C2)cc1F ZINC000091077820 345582181 /nfs/dbraw/zinc/58/21/81/345582181.db2.gz ZPHAFURWEFRSAQ-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO CCOCC[N@H+](C)C/C(Cl)=C/Cl ZINC000093313999 345661309 /nfs/dbraw/zinc/66/13/09/345661309.db2.gz VXRXWJUJOPKQSV-VURMDHGXSA-N 1 2 212.120 2.274 20 0 BEADLO CCOCC[N@@H+](C)C/C(Cl)=C/Cl ZINC000093313999 345661312 /nfs/dbraw/zinc/66/13/12/345661312.db2.gz VXRXWJUJOPKQSV-VURMDHGXSA-N 1 2 212.120 2.274 20 0 BEADLO CCOCC[N@H+](C)Cc1ncc(C(C)(C)C)o1 ZINC000093315632 345661464 /nfs/dbraw/zinc/66/14/64/345661464.db2.gz BCNMJQCDJXDTQC-UHFFFAOYSA-N 1 2 240.347 2.440 20 0 BEADLO CCOCC[N@@H+](C)Cc1ncc(C(C)(C)C)o1 ZINC000093315632 345661466 /nfs/dbraw/zinc/66/14/66/345661466.db2.gz BCNMJQCDJXDTQC-UHFFFAOYSA-N 1 2 240.347 2.440 20 0 BEADLO Fc1ccc(F)c2c1CCN(Cc1c[nH+]c[nH]1)C2 ZINC000093815740 345665758 /nfs/dbraw/zinc/66/57/58/345665758.db2.gz ZCJCMXCWAKFLCU-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO Fc1ccc(F)c2c1CCN(Cc1c[nH]c[nH+]1)C2 ZINC000093815740 345665759 /nfs/dbraw/zinc/66/57/59/345665759.db2.gz ZCJCMXCWAKFLCU-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO CCOCCN(C)c1cc(C)[nH+]c(C2CC2)n1 ZINC000092963033 345649073 /nfs/dbraw/zinc/64/90/73/345649073.db2.gz WQEUDIYYSLAMAN-UHFFFAOYSA-N 1 2 235.331 2.135 20 0 BEADLO OCc1cc[nH+]c(N2CCCC3(CC3)CC2)c1 ZINC000641679438 362601298 /nfs/dbraw/zinc/60/12/98/362601298.db2.gz UXSUKKWYCYVXHC-UHFFFAOYSA-N 1 2 232.327 2.344 20 0 BEADLO CC(=O)c1ccc(C[N@H+]2[C@H](C)COC[C@@H]2C)cc1 ZINC000115033308 345676624 /nfs/dbraw/zinc/67/66/24/345676624.db2.gz FVMODMJEVQWWBO-TXEJJXNPSA-N 1 2 247.338 2.498 20 0 BEADLO CC(=O)c1ccc(C[N@@H+]2[C@H](C)COC[C@@H]2C)cc1 ZINC000115033308 345676626 /nfs/dbraw/zinc/67/66/26/345676626.db2.gz FVMODMJEVQWWBO-TXEJJXNPSA-N 1 2 247.338 2.498 20 0 BEADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CC[C@H](O)C1 ZINC000095435349 345686254 /nfs/dbraw/zinc/68/62/54/345686254.db2.gz LIPPDCODHRWWAT-ZJUUUORDSA-N 1 2 238.331 2.100 20 0 BEADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC[C@H](O)C1 ZINC000095435349 345686255 /nfs/dbraw/zinc/68/62/55/345686255.db2.gz LIPPDCODHRWWAT-ZJUUUORDSA-N 1 2 238.331 2.100 20 0 BEADLO Cc1cc([C@H]2CCCN2c2cc[nH+]c(C)n2)no1 ZINC000203940913 345732034 /nfs/dbraw/zinc/73/20/34/345732034.db2.gz HZZXUWHGUGMKMJ-GFCCVEGCSA-N 1 2 244.298 2.423 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@@H](C)C2CCCC2)[nH+]1 ZINC000635567126 345813397 /nfs/dbraw/zinc/81/33/97/345813397.db2.gz QJACRQBMBONVCK-JTQLQIEISA-N 1 2 249.358 2.210 20 0 BEADLO Cc1cc(N[C@@H]2COCc3ccccc32)nc[nH+]1 ZINC000418982600 192090885 /nfs/dbraw/zinc/09/08/85/192090885.db2.gz CFQQSLIGJXRHDQ-CYBMUJFWSA-N 1 2 241.294 2.468 20 0 BEADLO Cn1c2c(cccc2F)[nH]c1=[NH+]C[C@H]1CC12CC2 ZINC000418981351 192090893 /nfs/dbraw/zinc/09/08/93/192090893.db2.gz QFUREMRGKPESNF-SECBINFHSA-N 1 2 245.301 2.346 20 0 BEADLO CCc1ccc(C(=O)N[C@H](C)c2[nH]cc[nH+]2)cc1 ZINC000140772319 345822363 /nfs/dbraw/zinc/82/23/63/345822363.db2.gz OXFSGELHFJWTNB-SNVBAGLBSA-N 1 2 243.310 2.463 20 0 BEADLO C[C@H]1CCCCCN1C(=O)CCCn1cc[nH+]c1 ZINC000074650408 345796699 /nfs/dbraw/zinc/79/66/99/345796699.db2.gz MILNWVIUEZDPHK-ZDUSSCGKSA-N 1 2 249.358 2.454 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H](C)Cc1ccco1 ZINC000668420249 537911656 /nfs/dbraw/zinc/91/16/56/537911656.db2.gz YSCUFABTUPOCGC-JTQLQIEISA-N 1 2 244.294 2.222 20 0 BEADLO Cc1cc(C(=O)N[C@H](C)c2[nH]cc[nH+]2)c(C)o1 ZINC000140744304 345822487 /nfs/dbraw/zinc/82/24/87/345822487.db2.gz JGXFSOIOMQYEKZ-MRVPVSSYSA-N 1 2 233.271 2.111 20 0 BEADLO CCc1ccccc1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000141043012 345831951 /nfs/dbraw/zinc/83/19/51/345831951.db2.gz BYVMUFQWURTSFB-SNVBAGLBSA-N 1 2 243.310 2.463 20 0 BEADLO CC(C)(CF)[NH2+]Cc1ccn(C(F)F)n1 ZINC000336746825 187309905 /nfs/dbraw/zinc/30/99/05/187309905.db2.gz BZRPLSPZTVLQDE-UHFFFAOYSA-N 1 2 221.226 2.116 20 0 BEADLO CCc1cnc(CN[C@H]2CCn3cc[nH+]c32)s1 ZINC000294281874 345889565 /nfs/dbraw/zinc/88/95/65/345889565.db2.gz YNOZYRXNYWLZQO-JTQLQIEISA-N 1 2 248.355 2.137 20 0 BEADLO CCc1cnc(C[NH2+][C@H]2CCn3ccnc32)s1 ZINC000294281874 345889569 /nfs/dbraw/zinc/88/95/69/345889569.db2.gz YNOZYRXNYWLZQO-JTQLQIEISA-N 1 2 248.355 2.137 20 0 BEADLO C[C@@H]1C[C@@H](Nc2cc[nH+]c3ccncc23)[C@@H](C)O1 ZINC000631466428 345874386 /nfs/dbraw/zinc/87/43/86/345874386.db2.gz VXISTKQIGCSPLO-GPCCPHFNSA-N 1 2 243.310 2.030 20 0 BEADLO Cc1nnc(C[N@H+]2Cc3ccccc3C[C@H]2C)o1 ZINC000172907207 345880202 /nfs/dbraw/zinc/88/02/02/345880202.db2.gz MCPLXIZLSPNUSN-SNVBAGLBSA-N 1 2 243.310 2.325 20 0 BEADLO Cc1nnc(C[N@@H+]2Cc3ccccc3C[C@H]2C)o1 ZINC000172907207 345880207 /nfs/dbraw/zinc/88/02/07/345880207.db2.gz MCPLXIZLSPNUSN-SNVBAGLBSA-N 1 2 243.310 2.325 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000309851808 187310640 /nfs/dbraw/zinc/31/06/40/187310640.db2.gz JCTWSJVMLCAKOJ-SNVBAGLBSA-N 1 2 229.274 2.386 20 0 BEADLO C[C@@H]1C[C@H](Nc2cc(NC3CC3)[nH+]cn2)[C@@H](C)O1 ZINC000631466786 345921573 /nfs/dbraw/zinc/92/15/73/345921573.db2.gz XAUXHQWXGBGPDG-KKZNHRDASA-N 1 2 248.330 2.029 20 0 BEADLO C[C@@H]1C[C@H](Nc2cc(NC3CC3)nc[nH+]2)[C@@H](C)O1 ZINC000631466786 345921576 /nfs/dbraw/zinc/92/15/76/345921576.db2.gz XAUXHQWXGBGPDG-KKZNHRDASA-N 1 2 248.330 2.029 20 0 BEADLO CC(=O)CCCC(=O)Nc1ccc(C)[nH+]c1C ZINC000187898314 187312545 /nfs/dbraw/zinc/31/25/45/187312545.db2.gz FGXRXQPRDJTFEK-UHFFFAOYSA-N 1 2 234.299 2.396 20 0 BEADLO CC1(C)CCC[C@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635655167 345933756 /nfs/dbraw/zinc/93/37/56/345933756.db2.gz NPGSYWGRPWOSTC-CKYFFXLPSA-N 1 2 247.342 2.208 20 0 BEADLO CC1(C)CCC[C@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635655167 345933759 /nfs/dbraw/zinc/93/37/59/345933759.db2.gz NPGSYWGRPWOSTC-CKYFFXLPSA-N 1 2 247.342 2.208 20 0 BEADLO C[C@@H](N(C)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C1(C)CC1 ZINC000635662006 345944497 /nfs/dbraw/zinc/94/44/97/345944497.db2.gz RPZVZNBLUFTXHB-GMTAPVOTSA-N 1 2 247.342 2.160 20 0 BEADLO C[C@@H](N(C)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C1(C)CC1 ZINC000635662006 345944498 /nfs/dbraw/zinc/94/44/98/345944498.db2.gz RPZVZNBLUFTXHB-GMTAPVOTSA-N 1 2 247.342 2.160 20 0 BEADLO CCc1c[nH]c(CC(=O)NCC2(C(C)C)CC2)[nH+]1 ZINC000635662152 345945149 /nfs/dbraw/zinc/94/51/49/345945149.db2.gz OGFUHFFKANGMHE-UHFFFAOYSA-N 1 2 249.358 2.067 20 0 BEADLO CCc1c[nH]c(CC(=O)NCC2(CC)CCC2)[nH+]1 ZINC000635662185 345945181 /nfs/dbraw/zinc/94/51/81/345945181.db2.gz TYBFIOBFXRTWLN-UHFFFAOYSA-N 1 2 249.358 2.211 20 0 BEADLO CC(C)C[C@H](C(=O)NC1CC=CC1)n1cc[nH+]c1 ZINC000635682336 345975748 /nfs/dbraw/zinc/97/57/48/345975748.db2.gz MICNWOGMTQELTJ-CYBMUJFWSA-N 1 2 247.342 2.305 20 0 BEADLO CCOC(=O)[C@H](Cc1ccccc1)[NH2+][C@@H]1C[C@H]1C ZINC000585729242 345982906 /nfs/dbraw/zinc/98/29/06/345982906.db2.gz XRAPYIGNAKEBLN-BNOWGMLFSA-N 1 2 247.338 2.159 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@]2(C)CCC[C@H]2C)c[nH+]1 ZINC001639097829 1172071321 /nfs/dbraw/zinc/07/13/21/1172071321.db2.gz QNMMKAWHBPZTKY-QMTHXVAHSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@]2(C)CCC[C@H]2C)[nH+]1 ZINC001639097829 1172071326 /nfs/dbraw/zinc/07/13/26/1172071326.db2.gz QNMMKAWHBPZTKY-QMTHXVAHSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1c[nH]c(CC(=O)N2[C@H](C)CC[C@H]2CC)[nH+]1 ZINC000635764518 346057162 /nfs/dbraw/zinc/05/71/62/346057162.db2.gz NGEMMKLRTANHQQ-ZYHUDNBSSA-N 1 2 249.358 2.304 20 0 BEADLO Cc1nc(N2C[C@H](C)[C@H](C)[C@H]2C)cc[nH+]1 ZINC000419022696 192094827 /nfs/dbraw/zinc/09/48/27/192094827.db2.gz VKAKRNXGDPFXHX-LPEHRKFASA-N 1 2 205.305 2.266 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CC[C@H](C)[C@H]2CC)[nH+]1 ZINC000635816175 346072018 /nfs/dbraw/zinc/07/20/18/346072018.db2.gz LHUFTGRMKMGUAK-CMPLNLGQSA-N 1 2 249.358 2.162 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@H](C)CCC2CC2)[nH+]1 ZINC000635809517 346073739 /nfs/dbraw/zinc/07/37/39/346073739.db2.gz JXNPDXMZVQDKJC-SNVBAGLBSA-N 1 2 249.358 2.210 20 0 BEADLO CCc1[nH]c(CNC(=O)CC2=CCCCC2)c[nH+]1 ZINC001639094274 1172072692 /nfs/dbraw/zinc/07/26/92/1172072692.db2.gz ZJVPXZXEFFLCSW-UHFFFAOYSA-N 1 2 247.342 2.479 20 0 BEADLO CCc1[nH]cc(CNC(=O)CC2=CCCCC2)[nH+]1 ZINC001639094274 1172072701 /nfs/dbraw/zinc/07/27/01/1172072701.db2.gz ZJVPXZXEFFLCSW-UHFFFAOYSA-N 1 2 247.342 2.479 20 0 BEADLO COc1ccc(C[NH2+]C(CF)CF)cc1F ZINC000449373048 201889207 /nfs/dbraw/zinc/88/92/07/201889207.db2.gz NDWWVGHMUNSFQZ-UHFFFAOYSA-N 1 2 233.233 2.232 20 0 BEADLO Cc1cn2ccc(C(=O)N3CC(C)(C)C3)cc2[nH+]1 ZINC000635872475 346093547 /nfs/dbraw/zinc/09/35/47/346093547.db2.gz NLOPXLZPZOJUOI-UHFFFAOYSA-N 1 2 243.310 2.125 20 0 BEADLO CC(C)C[C@H](C(=O)N1CC(C)(C)C1)n1cc[nH+]c1 ZINC000635873081 346094197 /nfs/dbraw/zinc/09/41/97/346094197.db2.gz UIJHVUFZUUZMTR-GFCCVEGCSA-N 1 2 249.358 2.339 20 0 BEADLO CC(C)C[C@H](C(=O)N1CC=CCC1)n1cc[nH+]c1 ZINC000635777509 346063041 /nfs/dbraw/zinc/06/30/41/346063041.db2.gz ADFOGVMGLVQPGT-CYBMUJFWSA-N 1 2 247.342 2.259 20 0 BEADLO Cc1cc(NC[C@@H]2CC23CC3)nc(C2CC2)[nH+]1 ZINC000418996186 192096733 /nfs/dbraw/zinc/09/67/33/192096733.db2.gz SENPTPGGJYRFED-NSHDSACASA-N 1 2 229.327 2.296 20 0 BEADLO CC(C)(C)C(C)(C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635959721 346133194 /nfs/dbraw/zinc/13/31/94/346133194.db2.gz SJXPYAGJPANSPT-NXEZZACHSA-N 1 2 249.358 2.454 20 0 BEADLO CC(C)(C)C(C)(C)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635959721 346133198 /nfs/dbraw/zinc/13/31/98/346133198.db2.gz SJXPYAGJPANSPT-NXEZZACHSA-N 1 2 249.358 2.454 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C1CCC=CCC1 ZINC000635983185 346136720 /nfs/dbraw/zinc/13/67/20/346136720.db2.gz KAZSTRRYXLBMBZ-UHFFFAOYSA-N 1 2 247.342 2.266 20 0 BEADLO COC[C@@H]([NH2+]Cc1cnc(C)o1)c1ccco1 ZINC000628226410 346173081 /nfs/dbraw/zinc/17/30/81/346173081.db2.gz MUXZLLWIKMXDJG-LLVKDONJSA-N 1 2 236.271 2.053 20 0 BEADLO C[C@H]1CCC(C)(C)N1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636011570 346153432 /nfs/dbraw/zinc/15/34/32/346153432.db2.gz HLWBHYIVSBOUSX-HBNTYKKESA-N 1 2 247.342 2.303 20 0 BEADLO C[C@H]1CCC(C)(C)N1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636011570 346153434 /nfs/dbraw/zinc/15/34/34/346153434.db2.gz HLWBHYIVSBOUSX-HBNTYKKESA-N 1 2 247.342 2.303 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636018968 346157918 /nfs/dbraw/zinc/15/79/18/346157918.db2.gz QIDMJTBPQWXKEU-BGOOENEXSA-N 1 2 247.342 2.064 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636018968 346157919 /nfs/dbraw/zinc/15/79/19/346157919.db2.gz QIDMJTBPQWXKEU-BGOOENEXSA-N 1 2 247.342 2.064 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636018972 346158127 /nfs/dbraw/zinc/15/81/27/346158127.db2.gz QIDMJTBPQWXKEU-KLTVKPSUSA-N 1 2 247.342 2.064 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636018972 346158132 /nfs/dbraw/zinc/15/81/32/346158132.db2.gz QIDMJTBPQWXKEU-KLTVKPSUSA-N 1 2 247.342 2.064 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@@]2(C)CC=CCC2)[nH+]1 ZINC000636021941 346159990 /nfs/dbraw/zinc/15/99/90/346159990.db2.gz UINOXKPDHJDTTF-AWEZNQCLSA-N 1 2 247.342 2.130 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CC(C)(C)C[C@H]2C)[nH+]1 ZINC000636025375 346162281 /nfs/dbraw/zinc/16/22/81/346162281.db2.gz BPELCGWXTUXDMY-SNVBAGLBSA-N 1 2 249.358 2.162 20 0 BEADLO C[C@@H]1CCN(CC(F)F)C[C@H]1n1cc[nH+]c1 ZINC000245705732 537953374 /nfs/dbraw/zinc/95/33/74/537953374.db2.gz SAPZTIYBBCIJIH-NXEZZACHSA-N 1 2 229.274 2.031 20 0 BEADLO CC[C@@]1(C)CN(Cc2[nH]c(C)c(C)[nH+]2)CCO1 ZINC000628245341 346210644 /nfs/dbraw/zinc/21/06/44/346210644.db2.gz SKZUOUDHLPGKFL-ZDUSSCGKSA-N 1 2 237.347 2.027 20 0 BEADLO COc1cc[nH+]cc1NCc1oc(C)nc1C ZINC000628230241 346179436 /nfs/dbraw/zinc/17/94/36/346179436.db2.gz YQFCJHSRJMVCEF-UHFFFAOYSA-N 1 2 233.271 2.307 20 0 BEADLO Cc1[nH]c(CN2CC[C@@H](C)[C@@H](F)C2)[nH+]c1C ZINC000628234830 346188540 /nfs/dbraw/zinc/18/85/40/346188540.db2.gz OLHFTTZEXFQPAJ-KCJUWKMLSA-N 1 2 225.311 2.206 20 0 BEADLO Cc1c[nH]c(CN2CCN(C)c3ccccc32)[nH+]1 ZINC000628236250 346190505 /nfs/dbraw/zinc/19/05/05/346190505.db2.gz VEZMGRGEOFUSRW-UHFFFAOYSA-N 1 2 242.326 2.175 20 0 BEADLO Cc1cc(C[NH2+]Cc2cnc(C3CC3)o2)on1 ZINC000628233790 346192584 /nfs/dbraw/zinc/19/25/84/346192584.db2.gz VEGMZJVXFONUEW-UHFFFAOYSA-N 1 2 233.271 2.138 20 0 BEADLO Cc1[nH]c(CN(C)Cc2ccncc2)[nH+]c1C ZINC000628237676 346193074 /nfs/dbraw/zinc/19/30/74/346193074.db2.gz VHIDYISOAKHWRM-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Nc1[nH+]cccc1CSC[C@@H]1CCCO1 ZINC000236372355 346231634 /nfs/dbraw/zinc/23/16/34/346231634.db2.gz YCUFNXPJBGXPJG-JTQLQIEISA-N 1 2 224.329 2.076 20 0 BEADLO CN(C[C@H](O)C1CC1)c1cc2ccccc2c[nH+]1 ZINC000631153557 346233144 /nfs/dbraw/zinc/23/31/44/346233144.db2.gz AHKMBZVWYRAPSD-AWEZNQCLSA-N 1 2 242.322 2.442 20 0 BEADLO CC[C@@H]([NH2+][C@@H]1CCCC(F)(F)C1)C(=O)OC ZINC000309505296 347089300 /nfs/dbraw/zinc/08/93/00/347089300.db2.gz BTVHDPNBJUHDKU-RKDXNWHRSA-N 1 2 235.274 2.106 20 0 BEADLO Cc1c[nH]c(CN(C)Cc2ccc(C)cn2)[nH+]1 ZINC000628249910 346219031 /nfs/dbraw/zinc/21/90/31/346219031.db2.gz WFTDZABTWNJJIM-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cn1ncc2c1nc[nH+]c2N[C@@]12C[C@@H]1CCCC2 ZINC000631475290 346219515 /nfs/dbraw/zinc/21/95/15/346219515.db2.gz JRQHZNZRMKXGKO-ZANVPECISA-N 1 2 243.314 2.108 20 0 BEADLO Cc1csc(C[NH2+]Cc2cncs2)n1 ZINC000054788271 187317810 /nfs/dbraw/zinc/31/78/10/187317810.db2.gz XNCMRGIBRAWWSD-UHFFFAOYSA-N 1 2 225.342 2.198 20 0 BEADLO C/C=C/C[C@H]([NH2+]CCSCC)C(=O)OCC ZINC000336781082 187317190 /nfs/dbraw/zinc/31/71/90/187317190.db2.gz TWLYNVSMFXTQNQ-ZPMKCOPCSA-N 1 2 245.388 2.227 20 0 BEADLO Cc1[nH]c(CN2C[C@H](C)O[C@@H](C3CC3)C2)[nH+]c1C ZINC000628255465 346249041 /nfs/dbraw/zinc/24/90/41/346249041.db2.gz NPQYSUWMNXGOGA-TVQRCGJNSA-N 1 2 249.358 2.026 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CC[C@H](C(F)(F)F)[C@H]2C)n1 ZINC000628255606 346249554 /nfs/dbraw/zinc/24/95/54/346249554.db2.gz SEWHQYGTIWKAQU-BDAKNGLRSA-N 1 2 247.264 2.491 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CC[C@H](C(F)(F)F)[C@H]2C)n1 ZINC000628255606 346249557 /nfs/dbraw/zinc/24/95/57/346249557.db2.gz SEWHQYGTIWKAQU-BDAKNGLRSA-N 1 2 247.264 2.491 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC[C@H]2c2cccnc2)n1 ZINC000628277527 346286392 /nfs/dbraw/zinc/28/63/92/346286392.db2.gz WMOIHXNGGOEJOP-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC[C@H]2c2cccnc2)n1 ZINC000628277527 346286399 /nfs/dbraw/zinc/28/63/99/346286399.db2.gz WMOIHXNGGOEJOP-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1c[nH]c(CN2CCCC[C@H]2c2cc[nH]n2)[nH+]1 ZINC000628271659 346282378 /nfs/dbraw/zinc/28/23/78/346282378.db2.gz LRKOZIUZFWEBLP-LBPRGKRZSA-N 1 2 245.330 2.168 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1c(C)cccc1C ZINC000336583625 179031863 /nfs/dbraw/zinc/03/18/63/179031863.db2.gz VZHIVTVSTNBIDN-UHFFFAOYSA-N 1 2 243.310 2.265 20 0 BEADLO Cc1cccc(C)c1C[N@H+](C)Cc1nnc[nH]1 ZINC000267628602 179033401 /nfs/dbraw/zinc/03/34/01/179033401.db2.gz RVLDQTFRHBMDCF-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1cccc(C)c1C[N@@H+](C)Cc1nnc[nH]1 ZINC000267628602 179033403 /nfs/dbraw/zinc/03/34/03/179033403.db2.gz RVLDQTFRHBMDCF-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO CCc1ccc(CNc2cc(CO)cc[nH+]2)o1 ZINC000641762609 362693849 /nfs/dbraw/zinc/69/38/49/362693849.db2.gz ORQWXESMWHNNHS-UHFFFAOYSA-N 1 2 232.283 2.341 20 0 BEADLO CC(C)[C@@H](NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C1CC1 ZINC000636227211 346361270 /nfs/dbraw/zinc/36/12/70/346361270.db2.gz QVUZGACEVFSRRJ-NQBHXWOUSA-N 1 2 247.342 2.064 20 0 BEADLO CC(C)[C@@H](NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C1CC1 ZINC000636227211 346361271 /nfs/dbraw/zinc/36/12/71/346361271.db2.gz QVUZGACEVFSRRJ-NQBHXWOUSA-N 1 2 247.342 2.064 20 0 BEADLO c1cnn(-c2ccc(CNc3c[nH]c[nH+]3)cc2)c1 ZINC000577082687 365809494 /nfs/dbraw/zinc/80/94/94/365809494.db2.gz QPJUMERUHTUZHE-UHFFFAOYSA-N 1 2 239.282 2.208 20 0 BEADLO CCC(C)(C)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636160289 346340502 /nfs/dbraw/zinc/34/05/02/346340502.db2.gz LKHIFJGEQJQSLX-GMTAPVOTSA-N 1 2 249.358 2.454 20 0 BEADLO CCC(C)(C)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636160289 346340507 /nfs/dbraw/zinc/34/05/07/346340507.db2.gz LKHIFJGEQJQSLX-GMTAPVOTSA-N 1 2 249.358 2.454 20 0 BEADLO CCC[C@@H]([NH2+]CC[C@@H](C)F)C(=O)OCC ZINC000419166025 192101956 /nfs/dbraw/zinc/10/19/56/192101956.db2.gz BBPCJWMIKACWME-NXEZZACHSA-N 1 2 219.300 2.056 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](C[C@H](O)C(F)(F)F)C2 ZINC000336346672 187367788 /nfs/dbraw/zinc/36/77/88/187367788.db2.gz IWAMTKLKADJNOD-NSHDSACASA-N 1 2 245.244 2.234 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](C[C@H](O)C(F)(F)F)C2 ZINC000336346672 187367789 /nfs/dbraw/zinc/36/77/89/187367789.db2.gz IWAMTKLKADJNOD-NSHDSACASA-N 1 2 245.244 2.234 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2cnns2)c1 ZINC000295507544 179069872 /nfs/dbraw/zinc/06/98/72/179069872.db2.gz LDMRMIBERSNIIB-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2cnns2)c1 ZINC000295507544 179069875 /nfs/dbraw/zinc/06/98/75/179069875.db2.gz LDMRMIBERSNIIB-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cccc(C[N@H+]2CCOC[C@@H]2C)c1F ZINC000294759060 179078551 /nfs/dbraw/zinc/07/85/51/179078551.db2.gz IQVQMRCYVKIVCN-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cccc(C[N@@H+]2CCOC[C@@H]2C)c1F ZINC000294759060 179078554 /nfs/dbraw/zinc/07/85/54/179078554.db2.gz IQVQMRCYVKIVCN-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ncc([C@@H](C)[NH2+][C@H](C)C(F)F)c(C)n1 ZINC000641792436 362727574 /nfs/dbraw/zinc/72/75/74/362727574.db2.gz VEQZAMMAIWIPNW-HTRCEHHLSA-N 1 2 229.274 2.398 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCCc2nn(C)cc21)C(F)F ZINC000641791286 362730017 /nfs/dbraw/zinc/73/00/17/362730017.db2.gz GGOFRBDPZAWIJA-VXNVDRBHSA-N 1 2 229.274 2.041 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCCc2nn(C)cc21)C(F)F ZINC000641791283 362730251 /nfs/dbraw/zinc/73/02/51/362730251.db2.gz GGOFRBDPZAWIJA-APPZFPTMSA-N 1 2 229.274 2.041 20 0 BEADLO CCn1nccc1C[NH2+][C@@H](C)c1cscn1 ZINC000580097036 346523142 /nfs/dbraw/zinc/52/31/42/346523142.db2.gz YBSBEJXSNHGIHJ-VIFPVBQESA-N 1 2 236.344 2.210 20 0 BEADLO Cc1cnccc1C[N@@H+]1[C@@H](C)[C@H](C)CC[C@H]1C[NH3+] ZINC000641806385 362764987 /nfs/dbraw/zinc/76/49/87/362764987.db2.gz RIPAHFCEZSMLRI-ZLDLUXBVSA-N 1 2 247.386 2.338 20 0 BEADLO Cc1cnccc1C[N@H+]1[C@@H](C)[C@H](C)CC[C@H]1C[NH3+] ZINC000641806385 362764990 /nfs/dbraw/zinc/76/49/90/362764990.db2.gz RIPAHFCEZSMLRI-ZLDLUXBVSA-N 1 2 247.386 2.338 20 0 BEADLO Cc1cccc(N(C)Cc2c[nH+]cn2C)c1 ZINC000177040531 179118429 /nfs/dbraw/zinc/11/84/29/179118429.db2.gz CEFAZBUCNDFLAZ-UHFFFAOYSA-N 1 2 215.300 2.365 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N(C)C[C@H]1CC1(C)C ZINC000621043565 346586005 /nfs/dbraw/zinc/58/60/05/346586005.db2.gz FANJCYDRCVCDPI-GHMZBOCLSA-N 1 2 249.358 2.093 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N(C)C[C@H]1CC1(C)C ZINC000621043565 346586008 /nfs/dbraw/zinc/58/60/08/346586008.db2.gz FANJCYDRCVCDPI-GHMZBOCLSA-N 1 2 249.358 2.093 20 0 BEADLO CC(C)(C)OCC[NH2+]Cc1n[nH]c2ccccc21 ZINC000589647059 346722218 /nfs/dbraw/zinc/72/22/18/346722218.db2.gz CTJGXHKQARQSCB-UHFFFAOYSA-N 1 2 247.342 2.468 20 0 BEADLO c1cc(C[NH2+]Cc2n[nH]c3ccccc32)co1 ZINC000589644809 346724776 /nfs/dbraw/zinc/72/47/76/346724776.db2.gz VLJOBQWFYFPKDF-UHFFFAOYSA-N 1 2 227.267 2.446 20 0 BEADLO C[N@H+](Cc1cocn1)Cc1cccc(O)c1 ZINC000584328636 346771796 /nfs/dbraw/zinc/77/17/96/346771796.db2.gz VCFOLDPAGCUZSD-UHFFFAOYSA-N 1 2 218.256 2.012 20 0 BEADLO C[N@@H+](Cc1cocn1)Cc1cccc(O)c1 ZINC000584328636 346771798 /nfs/dbraw/zinc/77/17/98/346771798.db2.gz VCFOLDPAGCUZSD-UHFFFAOYSA-N 1 2 218.256 2.012 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccccc1C)C(=O)OC ZINC000168306852 346733070 /nfs/dbraw/zinc/73/30/70/346733070.db2.gz VVUZPVIUIHHGAR-GFCCVEGCSA-N 1 2 221.300 2.036 20 0 BEADLO Cc1cccc(NCc2[nH+]ccn2C)c1 ZINC000036804433 179151570 /nfs/dbraw/zinc/15/15/70/179151570.db2.gz ORJJYXUAKKHQSL-UHFFFAOYSA-N 1 2 201.273 2.341 20 0 BEADLO C[C@@H]1CC[C@H](C)N(C(=O)CCCn2cc[nH+]c2)C1 ZINC000075277353 346742836 /nfs/dbraw/zinc/74/28/36/346742836.db2.gz UTCSEFVMULSAEJ-OLZOCXBDSA-N 1 2 249.358 2.310 20 0 BEADLO CCc1nc(C)c(C[NH2+]Cc2cnc(C)o2)o1 ZINC000628292930 347119309 /nfs/dbraw/zinc/11/93/09/347119309.db2.gz CALAIEMOQFUMFB-UHFFFAOYSA-N 1 2 235.287 2.132 20 0 BEADLO CCOC(=O)C1(C)CC([NH2+]CC(F)(F)CC)C1 ZINC000601283797 347149459 /nfs/dbraw/zinc/14/94/59/347149459.db2.gz CYZTUPILYRGRCL-UHFFFAOYSA-N 1 2 249.301 2.353 20 0 BEADLO CCc1nnc(C[N@H+](C)Cc2ccc(C)cc2)[nH]1 ZINC000185165303 347192687 /nfs/dbraw/zinc/19/26/87/347192687.db2.gz NVQZPIDJBAACKP-UHFFFAOYSA-N 1 2 244.342 2.308 20 0 BEADLO CCc1nnc(C[N@@H+](C)Cc2ccc(C)cc2)[nH]1 ZINC000185165303 347192689 /nfs/dbraw/zinc/19/26/89/347192689.db2.gz NVQZPIDJBAACKP-UHFFFAOYSA-N 1 2 244.342 2.308 20 0 BEADLO CCc1noc(C)c1C[NH2+]Cc1cnc(C)o1 ZINC000628295457 347216040 /nfs/dbraw/zinc/21/60/40/347216040.db2.gz UAKCEXCKKVTBNQ-UHFFFAOYSA-N 1 2 235.287 2.132 20 0 BEADLO CCC(CC)[NH2+]Cc1[nH]ncc1Br ZINC000388221536 347249014 /nfs/dbraw/zinc/24/90/14/347249014.db2.gz ILVDAEAMRUSWCV-UHFFFAOYSA-N 1 2 246.152 2.450 20 0 BEADLO Cc1cccc2c1ncnc2-n1cc[nH+]c1 ZINC000301710211 179207942 /nfs/dbraw/zinc/20/79/42/179207942.db2.gz USJFZQSAPUMPHA-UHFFFAOYSA-N 1 2 210.240 2.124 20 0 BEADLO C[C@@H]([NH2+]CC(C)(F)F)c1cccc(CO)c1 ZINC000382321595 347277173 /nfs/dbraw/zinc/27/71/73/347277173.db2.gz TZOUKUQAWUNDOQ-SECBINFHSA-N 1 2 229.270 2.485 20 0 BEADLO CCn1ccnc1C[NH+]1CC2(C1)CCCC2 ZINC000582107937 347280144 /nfs/dbraw/zinc/28/01/44/347280144.db2.gz NZJUBYOWESECKH-UHFFFAOYSA-N 1 2 219.332 2.279 20 0 BEADLO Cc1cccc2c1C[N@@H+](Cc1cnc[nH]1)CC2 ZINC000280176912 179216792 /nfs/dbraw/zinc/21/67/92/179216792.db2.gz GPNQZPQTIQDESO-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1cccc2c1C[N@H+](Cc1ncc[nH]1)CC2 ZINC000277262385 179216929 /nfs/dbraw/zinc/21/69/29/179216929.db2.gz RBCSHUSIKVYIGX-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1cccc2c1C[N@@H+](Cc1ncc[nH]1)CC2 ZINC000277262385 179216930 /nfs/dbraw/zinc/21/69/30/179216930.db2.gz RBCSHUSIKVYIGX-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)[C@H]1C[C@@H]1C1CCCC1 ZINC000616921244 347450279 /nfs/dbraw/zinc/45/02/79/347450279.db2.gz KOLRHURPQTVOOH-OLZOCXBDSA-N 1 2 247.342 2.194 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)[C@H]1C[C@@H]1C1CCCC1 ZINC000616921244 347450282 /nfs/dbraw/zinc/45/02/82/347450282.db2.gz KOLRHURPQTVOOH-OLZOCXBDSA-N 1 2 247.342 2.194 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)[C@@H]1C[C@H]1C1CCCC1 ZINC000616921245 347450332 /nfs/dbraw/zinc/45/03/32/347450332.db2.gz KOLRHURPQTVOOH-QWHCGFSZSA-N 1 2 247.342 2.194 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)[C@@H]1C[C@H]1C1CCCC1 ZINC000616921245 347450334 /nfs/dbraw/zinc/45/03/34/347450334.db2.gz KOLRHURPQTVOOH-QWHCGFSZSA-N 1 2 247.342 2.194 20 0 BEADLO Cc1cccc(C(=O)N(C)Cc2c[nH+]c[nH]2)c1C ZINC000616922053 347452652 /nfs/dbraw/zinc/45/26/52/347452652.db2.gz NMTOABYJMIJSDP-UHFFFAOYSA-N 1 2 243.310 2.299 20 0 BEADLO Cc1cccc(C(=O)N(C)Cc2c[nH]c[nH+]2)c1C ZINC000616922053 347452653 /nfs/dbraw/zinc/45/26/53/347452653.db2.gz NMTOABYJMIJSDP-UHFFFAOYSA-N 1 2 243.310 2.299 20 0 BEADLO CC[C@@H](CC(F)F)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616922202 347452677 /nfs/dbraw/zinc/45/26/77/347452677.db2.gz SZLIYSPOOHUERV-QMMMGPOBSA-N 1 2 245.273 2.050 20 0 BEADLO CC[C@@H](CC(F)F)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616922202 347452678 /nfs/dbraw/zinc/45/26/78/347452678.db2.gz SZLIYSPOOHUERV-QMMMGPOBSA-N 1 2 245.273 2.050 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)CCC(C)(C)C ZINC000616925797 347457108 /nfs/dbraw/zinc/45/71/08/347457108.db2.gz QIODINIEUHLGAU-UHFFFAOYSA-N 1 2 223.320 2.194 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)CCC(C)(C)C ZINC000616925797 347457111 /nfs/dbraw/zinc/45/71/11/347457111.db2.gz QIODINIEUHLGAU-UHFFFAOYSA-N 1 2 223.320 2.194 20 0 BEADLO Cc1ccccc1-n1cc(C[NH2+][C@@H](C)CF)nn1 ZINC000288421272 179241282 /nfs/dbraw/zinc/24/12/82/179241282.db2.gz JURYDXRLWAMPDD-NSHDSACASA-N 1 2 248.305 2.023 20 0 BEADLO CCCC[C@@H](C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616928618 347494669 /nfs/dbraw/zinc/49/46/69/347494669.db2.gz GXHYNNQYDBCJLD-SNVBAGLBSA-N 1 2 223.320 2.194 20 0 BEADLO CCCC[C@@H](C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616928618 347494671 /nfs/dbraw/zinc/49/46/71/347494671.db2.gz GXHYNNQYDBCJLD-SNVBAGLBSA-N 1 2 223.320 2.194 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)c1ccoc1C1CC1 ZINC000616928509 347495217 /nfs/dbraw/zinc/49/52/17/347495217.db2.gz CCYYNHKAOFJXFP-UHFFFAOYSA-N 1 2 245.282 2.152 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)c1ccoc1C1CC1 ZINC000616928509 347495219 /nfs/dbraw/zinc/49/52/19/347495219.db2.gz CCYYNHKAOFJXFP-UHFFFAOYSA-N 1 2 245.282 2.152 20 0 BEADLO CCC(CC)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000590730356 347497471 /nfs/dbraw/zinc/49/74/71/347497471.db2.gz URZMXNYZHDTZNN-CYBMUJFWSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1scc(C(=O)N(C)Cc2c[nH+]c[nH]2)c1C ZINC000616926625 347458003 /nfs/dbraw/zinc/45/80/03/347458003.db2.gz JQALQOQDEIRFAN-UHFFFAOYSA-N 1 2 249.339 2.360 20 0 BEADLO Cc1scc(C(=O)N(C)Cc2c[nH]c[nH+]2)c1C ZINC000616926625 347458004 /nfs/dbraw/zinc/45/80/04/347458004.db2.gz JQALQOQDEIRFAN-UHFFFAOYSA-N 1 2 249.339 2.360 20 0 BEADLO C[C@@H]1CC[C@@H](CC(=O)N(C)Cc2c[nH+]c[nH]2)C1 ZINC000616926743 347459439 /nfs/dbraw/zinc/45/94/39/347459439.db2.gz OCTMTYYPZCTAHS-GHMZBOCLSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@@H]1CC[C@@H](CC(=O)N(C)Cc2c[nH]c[nH+]2)C1 ZINC000616926743 347459441 /nfs/dbraw/zinc/45/94/41/347459441.db2.gz OCTMTYYPZCTAHS-GHMZBOCLSA-N 1 2 235.331 2.194 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)[C@H]1CCC(C)(C)C1 ZINC000616927134 347459518 /nfs/dbraw/zinc/45/95/18/347459518.db2.gz AYLGTGFUHYWBSL-JTQLQIEISA-N 1 2 235.331 2.194 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)[C@H]1CCC(C)(C)C1 ZINC000616927134 347459519 /nfs/dbraw/zinc/45/95/19/347459519.db2.gz AYLGTGFUHYWBSL-JTQLQIEISA-N 1 2 235.331 2.194 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)C[C@@H]1C=CCCC1 ZINC000616927124 347459558 /nfs/dbraw/zinc/45/95/58/347459558.db2.gz AJDDENKYQLWUSX-LLVKDONJSA-N 1 2 233.315 2.115 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)C[C@@H]1C=CCCC1 ZINC000616927124 347459559 /nfs/dbraw/zinc/45/95/59/347459559.db2.gz AJDDENKYQLWUSX-LLVKDONJSA-N 1 2 233.315 2.115 20 0 BEADLO C[C@@H]1CCC[C@H]1CC(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616927402 347459586 /nfs/dbraw/zinc/45/95/86/347459586.db2.gz IFFCTFKUGGATRA-MNOVXSKESA-N 1 2 235.331 2.194 20 0 BEADLO C[C@@H]1CCC[C@H]1CC(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616927402 347459589 /nfs/dbraw/zinc/45/95/89/347459589.db2.gz IFFCTFKUGGATRA-MNOVXSKESA-N 1 2 235.331 2.194 20 0 BEADLO Cc1ccccc1C(=O)Nc1cc[nH+]cc1O ZINC000109889925 179252267 /nfs/dbraw/zinc/25/22/67/179252267.db2.gz JHIBVNCBWYJIIL-UHFFFAOYSA-N 1 2 228.251 2.348 20 0 BEADLO Cc1ccccc1CCC[NH2+][C@]1(C)CCOC1=O ZINC000289404076 179264111 /nfs/dbraw/zinc/26/41/11/179264111.db2.gz AHTCVYPXIIMFSY-OAHLLOKOSA-N 1 2 247.338 2.223 20 0 BEADLO Cc1csc(CCNc2cc(C)[nH+]cn2)n1 ZINC000063134383 347591343 /nfs/dbraw/zinc/59/13/43/347591343.db2.gz OOLGGMSXPXJYFL-UHFFFAOYSA-N 1 2 234.328 2.205 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000616975021 347546757 /nfs/dbraw/zinc/54/67/57/347546757.db2.gz XMRVGNNDECIUHB-NEPJUHHUSA-N 1 2 237.347 2.481 20 0 BEADLO CC(C)[C@H]1CCCN1C(=O)CCCn1cc[nH+]c1 ZINC000591158135 347626681 /nfs/dbraw/zinc/62/66/81/347626681.db2.gz BTPYFBBHLKWGQW-CYBMUJFWSA-N 1 2 249.358 2.310 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)C[C@@H]1CCOC1 ZINC000333401646 537991449 /nfs/dbraw/zinc/99/14/49/537991449.db2.gz NZBJKOFTQQUXCK-NSHDSACASA-N 1 2 234.299 2.064 20 0 BEADLO CCCC[C@H]([NH2+][C@@H](C)[C@H]1CC1(F)F)C(=O)OC ZINC000591377445 347651006 /nfs/dbraw/zinc/65/10/06/347651006.db2.gz ZXADOXVWHZPTQV-AEJSXWLSSA-N 1 2 249.301 2.352 20 0 BEADLO CC[C@@H](COC)[NH2+][C@@H](CC)C(=O)OC(C)(C)C ZINC000592399943 347777065 /nfs/dbraw/zinc/77/70/65/347777065.db2.gz JNWIWJROWBMBOW-QWRGUYRKSA-N 1 2 245.363 2.121 20 0 BEADLO COC(=O)[C@](C)([NH2+]CC1=CCCC1)C1CC1 ZINC000592089747 347731379 /nfs/dbraw/zinc/73/13/79/347731379.db2.gz KIKNYMCQEZVADN-CYBMUJFWSA-N 1 2 223.316 2.028 20 0 BEADLO CC[C@H](C)C[C@@H]([NH2+][C@H]1CCSC1)C(=O)OC ZINC000592517605 347793932 /nfs/dbraw/zinc/79/39/32/347793932.db2.gz WOVSNKWDSMWAOY-GARJFASQSA-N 1 2 245.388 2.059 20 0 BEADLO Cc1ccccc1C[C@@H](CO)Nc1cccc[nH+]1 ZINC000302720020 179289666 /nfs/dbraw/zinc/28/96/66/179289666.db2.gz OSDUYQHQSMBFHO-AWEZNQCLSA-N 1 2 242.322 2.406 20 0 BEADLO Cc1ccccc1Cc1noc(C[NH+](C)C)n1 ZINC000277774913 179293077 /nfs/dbraw/zinc/29/30/77/179293077.db2.gz DXDLCJXLXFXNCJ-UHFFFAOYSA-N 1 2 231.299 2.030 20 0 BEADLO Cc1cc(C(=O)Nc2cc[nH+]cc2C)c(C)[nH]1 ZINC000593270933 347876391 /nfs/dbraw/zinc/87/63/91/347876391.db2.gz MMSIMIUSNRSZAM-UHFFFAOYSA-N 1 2 229.283 2.009 20 0 BEADLO CC(C)CCN(C(=O)/C=C\c1[nH]cc[nH+]1)C1CC1 ZINC000493608037 347922869 /nfs/dbraw/zinc/92/28/69/347922869.db2.gz BRQHHZBRXSOMAF-WAYWQWQTSA-N 1 2 247.342 2.460 20 0 BEADLO CCCC[C@@H]([NH2+]CCC(C)(C)F)C(=O)OC ZINC000594725066 348108062 /nfs/dbraw/zinc/10/80/62/348108062.db2.gz JCPQMHBQWCCWBO-SNVBAGLBSA-N 1 2 233.327 2.446 20 0 BEADLO CCC[C@@H]([NH2+]CCc1ccoc1)C(=O)OCC ZINC000594724702 348108143 /nfs/dbraw/zinc/10/81/43/348108143.db2.gz GGRGBGTXGFNMFE-GFCCVEGCSA-N 1 2 239.315 2.144 20 0 BEADLO Cc1nc(C[N@@H+]2CCOC(C)(C)[C@H]2C)c(C)o1 ZINC000660007111 490132453 /nfs/dbraw/zinc/13/24/53/490132453.db2.gz ZIAVOCPFAOUZQQ-SNVBAGLBSA-N 1 2 238.331 2.291 20 0 BEADLO Cc1nc(C[N@H+]2CCOC(C)(C)[C@H]2C)c(C)o1 ZINC000660007111 490132460 /nfs/dbraw/zinc/13/24/60/490132460.db2.gz ZIAVOCPFAOUZQQ-SNVBAGLBSA-N 1 2 238.331 2.291 20 0 BEADLO Cc1cccn2cc(CSC[C@@H](C)O)[nH+]c12 ZINC000298261793 179357393 /nfs/dbraw/zinc/35/73/93/179357393.db2.gz OMLPDXQXIUPCIY-SNVBAGLBSA-N 1 2 236.340 2.257 20 0 BEADLO COC(=O)Cc1ccc(C)c(-c2[nH+]ccn2C)c1 ZINC000594629378 348084846 /nfs/dbraw/zinc/08/48/46/348084846.db2.gz HELVKPJPJOCXHE-UHFFFAOYSA-N 1 2 244.294 2.111 20 0 BEADLO Cc1cccn2c(CNCC(F)(F)F)c[nH+]c12 ZINC000340558369 179354852 /nfs/dbraw/zinc/35/48/52/179354852.db2.gz NQCQQCLDTOXIFN-UHFFFAOYSA-N 1 2 243.232 2.295 20 0 BEADLO Cc1ccc[nH+]c1CCCNc1nncs1 ZINC000295070066 179368002 /nfs/dbraw/zinc/36/80/02/179368002.db2.gz WGUDWXPSYDODOL-UHFFFAOYSA-N 1 2 234.328 2.286 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+]1CCc2ccc(C)cc2C1 ZINC000595657489 348297998 /nfs/dbraw/zinc/29/79/98/348297998.db2.gz KRKWRISFVKSHDT-GFCCVEGCSA-N 1 2 247.338 2.305 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+]1CCc2ccc(C)cc2C1 ZINC000595657489 348298001 /nfs/dbraw/zinc/29/80/01/348298001.db2.gz KRKWRISFVKSHDT-GFCCVEGCSA-N 1 2 247.338 2.305 20 0 BEADLO CC[C@@H](C[N@@H+]1CCC[C@@H]1C(F)F)OC ZINC000419280789 192121809 /nfs/dbraw/zinc/12/18/09/192121809.db2.gz PHJACUMQMLMDEC-DTWKUNHWSA-N 1 2 207.264 2.141 20 0 BEADLO CC[C@@H](C[N@H+]1CCC[C@@H]1C(F)F)OC ZINC000419280789 192121810 /nfs/dbraw/zinc/12/18/10/192121810.db2.gz PHJACUMQMLMDEC-DTWKUNHWSA-N 1 2 207.264 2.141 20 0 BEADLO CCCCC[NH2+][C@](C)(CCF)C(=O)OC ZINC000595768852 348335743 /nfs/dbraw/zinc/33/57/43/348335743.db2.gz HQLWPFPMZSIDNO-LLVKDONJSA-N 1 2 219.300 2.058 20 0 BEADLO CSCC[N@@H+]1CCO[C@H](C(F)(F)F)[C@@H]1C ZINC000595784995 348345771 /nfs/dbraw/zinc/34/57/71/348345771.db2.gz LXDPQLQJMXXJKV-YUMQZZPRSA-N 1 2 243.294 2.001 20 0 BEADLO CSCC[N@H+]1CCO[C@H](C(F)(F)F)[C@@H]1C ZINC000595784995 348345776 /nfs/dbraw/zinc/34/57/76/348345776.db2.gz LXDPQLQJMXXJKV-YUMQZZPRSA-N 1 2 243.294 2.001 20 0 BEADLO CCCC[C@@H]([NH2+][C@@H]1C[C@H]1C(C)C)C(=O)OC ZINC000419330423 192123185 /nfs/dbraw/zinc/12/31/85/192123185.db2.gz PROYEXBXEWXCEI-QJPTWQEYSA-N 1 2 227.348 2.352 20 0 BEADLO CC[C@@H]([NH2+]C1(CC(C)C)CC1)C(=O)OC ZINC000595831023 348365566 /nfs/dbraw/zinc/36/55/66/348365566.db2.gz KHUYDVFPTDDVAO-SNVBAGLBSA-N 1 2 213.321 2.106 20 0 BEADLO COC(=O)[C@H]([NH2+]C[C@H]1CC12CC2)c1ccccc1 ZINC000419333214 192124464 /nfs/dbraw/zinc/12/44/64/192124464.db2.gz FEEFRUUPIXMAGV-CHWSQXEVSA-N 1 2 245.322 2.290 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N2CCC[C@@H](C)C2)c1 ZINC000596051407 348433215 /nfs/dbraw/zinc/43/32/15/348433215.db2.gz QZWPZSRKAIHDBS-LLVKDONJSA-N 1 2 248.326 2.033 20 0 BEADLO CCC(CC)Nc1cc(CC(=O)OC)cc[nH+]1 ZINC000596055825 348434550 /nfs/dbraw/zinc/43/45/50/348434550.db2.gz ONLIOWZVUBSLAT-UHFFFAOYSA-N 1 2 236.315 2.398 20 0 BEADLO CCC[C@@H](C)Nc1cc(CC(=O)OC)cc[nH+]1 ZINC000596070713 348437357 /nfs/dbraw/zinc/43/73/57/348437357.db2.gz SEXMCCAZFDNKFE-SNVBAGLBSA-N 1 2 236.315 2.398 20 0 BEADLO C[C@H]1C[NH+](CC(=O)OC(C)(C)C)C[C@H](C)S1 ZINC000075891349 349988045 /nfs/dbraw/zinc/98/80/45/349988045.db2.gz GTMNTJSVDSIQTM-UWVGGRQHSA-N 1 2 245.388 2.154 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@@H]2CC=CCC2)c1 ZINC000596134310 348447332 /nfs/dbraw/zinc/44/73/32/348447332.db2.gz LKLCSLFXKQIXSL-GFCCVEGCSA-N 1 2 246.310 2.318 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N2CC[C@@H](C)[C@H]2C)c1 ZINC000596148531 348452364 /nfs/dbraw/zinc/45/23/64/348452364.db2.gz CMIUZJYAVOPFTO-GHMZBOCLSA-N 1 2 248.326 2.032 20 0 BEADLO COC(=O)Cc1cc[nH+]c(NCC2(C)CC2)c1 ZINC000596149142 348452382 /nfs/dbraw/zinc/45/23/82/348452382.db2.gz JLLIDROHOIXOPZ-UHFFFAOYSA-N 1 2 234.299 2.009 20 0 BEADLO CC[C@H](CSCCn1cc[nH+]c1)OC ZINC000419622053 192142175 /nfs/dbraw/zinc/14/21/75/192142175.db2.gz GEBYFAVBTJYCMN-SNVBAGLBSA-N 1 2 214.334 2.041 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@@H](C)C2CCC2)c1 ZINC000596174268 348461579 /nfs/dbraw/zinc/46/15/79/348461579.db2.gz JOCMJIVPQFGYHZ-JTQLQIEISA-N 1 2 248.326 2.398 20 0 BEADLO COc1cc[nH+]cc1CSCC1(C)COC1 ZINC000596365198 348510987 /nfs/dbraw/zinc/51/09/87/348510987.db2.gz WFNAOSNBUYZHTD-UHFFFAOYSA-N 1 2 239.340 2.360 20 0 BEADLO Cc1nc(C[N@@H+]([C@H](C)C2CC2)C2CC2)no1 ZINC000051881575 323191951 /nfs/dbraw/zinc/19/19/51/323191951.db2.gz YPOGCEOSORSZMV-MRVPVSSYSA-N 1 2 221.304 2.141 20 0 BEADLO Cc1nc(C[N@H+]([C@H](C)C2CC2)C2CC2)no1 ZINC000051881575 323191952 /nfs/dbraw/zinc/19/19/52/323191952.db2.gz YPOGCEOSORSZMV-MRVPVSSYSA-N 1 2 221.304 2.141 20 0 BEADLO CCOC(=O)[C@@H](CC)[N@H+](CC)Cc1ccoc1 ZINC000075684157 348571948 /nfs/dbraw/zinc/57/19/48/348571948.db2.gz XVTKMWBLRQJCNT-GFCCVEGCSA-N 1 2 239.315 2.443 20 0 BEADLO CCOC(=O)[C@@H](CC)[N@@H+](CC)Cc1ccoc1 ZINC000075684157 348571951 /nfs/dbraw/zinc/57/19/51/348571951.db2.gz XVTKMWBLRQJCNT-GFCCVEGCSA-N 1 2 239.315 2.443 20 0 BEADLO c1cc2c(s1)CC[N@@H+](Cc1cnccn1)C2 ZINC000206620999 348657286 /nfs/dbraw/zinc/65/72/86/348657286.db2.gz XVVYDCQOINJSKH-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1cc2c(s1)CC[N@H+](Cc1cnccn1)C2 ZINC000206620999 348657289 /nfs/dbraw/zinc/65/72/89/348657289.db2.gz XVVYDCQOINJSKH-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO CC[C@@H]([NH2+]Cc1cncn1C)c1nccs1 ZINC000082784173 348724973 /nfs/dbraw/zinc/72/49/73/348724973.db2.gz PZVQNTJAQIPCAW-SNVBAGLBSA-N 1 2 236.344 2.118 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1nccn1C)c1ccco1 ZINC000070007633 490194145 /nfs/dbraw/zinc/19/41/45/490194145.db2.gz PFVQAXKUTLZHLO-UWVGGRQHSA-N 1 2 219.288 2.425 20 0 BEADLO Cc1cc(C)nc(N[C@@H]2C[C@H](C)n3cc[nH+]c32)n1 ZINC000577459920 365957802 /nfs/dbraw/zinc/95/78/02/365957802.db2.gz POSQUXPROQCAGU-WDEREUQCSA-N 1 2 243.314 2.408 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccco1)c1nccn1C ZINC000070007637 490194982 /nfs/dbraw/zinc/19/49/82/490194982.db2.gz PFVQAXKUTLZHLO-VHSXEESVSA-N 1 2 219.288 2.425 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1cnn(C(C)C)c1 ZINC000191352154 179711505 /nfs/dbraw/zinc/71/15/05/179711505.db2.gz CTQDHBNJQXFJPZ-UHFFFAOYSA-N 1 2 244.298 2.420 20 0 BEADLO CCc1cnc(C[NH2+]Cc2cnc(C)o2)s1 ZINC000397902907 362936800 /nfs/dbraw/zinc/93/68/00/362936800.db2.gz XKAXMVJLLQEOFJ-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO CC(C)[C@@H]1C[C@@H](Nc2c[nH]c[nH+]2)CCO1 ZINC000308886361 349024556 /nfs/dbraw/zinc/02/45/56/349024556.db2.gz VXXHGOWDGZKVHR-UWVGGRQHSA-N 1 2 209.293 2.025 20 0 BEADLO C[C@H]([NH2+]Cc1ncccn1)c1ccccc1F ZINC000054459557 349033347 /nfs/dbraw/zinc/03/33/47/349033347.db2.gz OGWOUKCLSKIGMR-JTQLQIEISA-N 1 2 231.274 2.467 20 0 BEADLO Fc1cccnc1NCCCCn1cc[nH+]c1 ZINC000054700882 349077349 /nfs/dbraw/zinc/07/73/49/349077349.db2.gz QPABSPLGVXLFGK-UHFFFAOYSA-N 1 2 234.278 2.310 20 0 BEADLO Cc1cc(NCC[C@H]2CCCO2)nc(C2CC2)[nH+]1 ZINC000599430019 349187731 /nfs/dbraw/zinc/18/77/31/349187731.db2.gz SHNOGRZIAPYFOB-GFCCVEGCSA-N 1 2 247.342 2.065 20 0 BEADLO COC(=O)CCCC[N@@H+]1CCCC[C@H]1C(F)F ZINC000599399215 349171734 /nfs/dbraw/zinc/17/17/34/349171734.db2.gz LBMXNKQIXJSSQX-JTQLQIEISA-N 1 2 249.301 2.449 20 0 BEADLO COC(=O)CCCC[N@H+]1CCCC[C@H]1C(F)F ZINC000599399215 349171736 /nfs/dbraw/zinc/17/17/36/349171736.db2.gz LBMXNKQIXJSSQX-JTQLQIEISA-N 1 2 249.301 2.449 20 0 BEADLO CCOC(=O)CCC[N@@H+]1Cc2ccc(O)cc2C1 ZINC000599536016 349212053 /nfs/dbraw/zinc/21/20/53/349212053.db2.gz BNHYLVDUGRPHDT-UHFFFAOYSA-N 1 2 249.310 2.051 20 0 BEADLO CCOC(=O)CCC[N@H+]1Cc2ccc(O)cc2C1 ZINC000599536016 349212058 /nfs/dbraw/zinc/21/20/58/349212058.db2.gz BNHYLVDUGRPHDT-UHFFFAOYSA-N 1 2 249.310 2.051 20 0 BEADLO CC(C)OC(=O)CC[N@@H+]1Cc2ccc(O)cc2C1 ZINC000599536698 349212809 /nfs/dbraw/zinc/21/28/09/349212809.db2.gz OZIBAEGQSAWSSJ-UHFFFAOYSA-N 1 2 249.310 2.050 20 0 BEADLO CC(C)OC(=O)CC[N@H+]1Cc2ccc(O)cc2C1 ZINC000599536698 349212812 /nfs/dbraw/zinc/21/28/12/349212812.db2.gz OZIBAEGQSAWSSJ-UHFFFAOYSA-N 1 2 249.310 2.050 20 0 BEADLO CCC[N@@H+]1CCc2occc2[C@H]1C(=O)OCC ZINC000599549698 349215293 /nfs/dbraw/zinc/21/52/93/349215293.db2.gz YVGZCHMUZYNHQW-LBPRGKRZSA-N 1 2 237.299 2.152 20 0 BEADLO CCC[N@H+]1CCc2occc2[C@H]1C(=O)OCC ZINC000599549698 349215297 /nfs/dbraw/zinc/21/52/97/349215297.db2.gz YVGZCHMUZYNHQW-LBPRGKRZSA-N 1 2 237.299 2.152 20 0 BEADLO CCc1nc(CN(C)c2cc(C)[nH+]cn2)cs1 ZINC000599556846 349217482 /nfs/dbraw/zinc/21/74/82/349217482.db2.gz KRGCITBVLVLSTP-UHFFFAOYSA-N 1 2 248.355 2.440 20 0 BEADLO CC(C)OCC[NH2+]C(C)(C)C(=O)OC(C)(C)C ZINC000599647815 349233760 /nfs/dbraw/zinc/23/37/60/349233760.db2.gz BNWZJUCUEZPCSZ-UHFFFAOYSA-N 1 2 245.363 2.121 20 0 BEADLO Cc1nc(C[NH2+]Cc2cccc(O)c2)cs1 ZINC000040443806 179969177 /nfs/dbraw/zinc/96/91/77/179969177.db2.gz JENAZPASFTXGDG-UHFFFAOYSA-N 1 2 234.324 2.447 20 0 BEADLO CCc1nc(C)c(CNc2cc(C)[nH+]cn2)o1 ZINC000311857732 350044019 /nfs/dbraw/zinc/04/40/19/350044019.db2.gz QZSQGDGEVRMMRC-UHFFFAOYSA-N 1 2 232.287 2.256 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1cc(C)[nH]c1C ZINC000603911655 350050424 /nfs/dbraw/zinc/05/04/24/350050424.db2.gz RYZQGTAEHZMKQF-UHFFFAOYSA-N 1 2 243.310 2.263 20 0 BEADLO O=C(CC1=CCCCC1)N1CC(n2cc[nH+]c2)C1 ZINC000603917458 350052988 /nfs/dbraw/zinc/05/29/88/350052988.db2.gz ZMXYFUNGXOVAMC-UHFFFAOYSA-N 1 2 245.326 2.157 20 0 BEADLO Cc1nc([C@@H](C)NCc2[nH+]ccn2C)cs1 ZINC000070852883 180037399 /nfs/dbraw/zinc/03/73/99/180037399.db2.gz NKMBBOFBQYCSJQ-MRVPVSSYSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1nnc([C@H]2CCC[N@H+](C/C=C/Cl)C2)[nH]1 ZINC000268507593 180053818 /nfs/dbraw/zinc/05/38/18/180053818.db2.gz UBDFRGZXBXJQPK-GFAPAMAISA-N 1 2 240.738 2.045 20 0 BEADLO Cc1nnc([C@H]2CCC[N@@H+](C/C=C/Cl)C2)[nH]1 ZINC000268507593 180053826 /nfs/dbraw/zinc/05/38/26/180053826.db2.gz UBDFRGZXBXJQPK-GFAPAMAISA-N 1 2 240.738 2.045 20 0 BEADLO Cc1n[nH]c([C@H]2CCC[N@H+](C/C=C/Cl)C2)n1 ZINC000268507593 180053827 /nfs/dbraw/zinc/05/38/27/180053827.db2.gz UBDFRGZXBXJQPK-GFAPAMAISA-N 1 2 240.738 2.045 20 0 BEADLO Cc1n[nH]c([C@H]2CCC[N@@H+](C/C=C/Cl)C2)n1 ZINC000268507593 180053831 /nfs/dbraw/zinc/05/38/31/180053831.db2.gz UBDFRGZXBXJQPK-GFAPAMAISA-N 1 2 240.738 2.045 20 0 BEADLO Cc1nc([C@H]2CCC[N@H+](C/C=C/Cl)C2)n[nH]1 ZINC000268507593 180053832 /nfs/dbraw/zinc/05/38/32/180053832.db2.gz UBDFRGZXBXJQPK-GFAPAMAISA-N 1 2 240.738 2.045 20 0 BEADLO Cc1nc([C@H]2CCC[N@@H+](C/C=C/Cl)C2)n[nH]1 ZINC000268507593 180053835 /nfs/dbraw/zinc/05/38/35/180053835.db2.gz UBDFRGZXBXJQPK-GFAPAMAISA-N 1 2 240.738 2.045 20 0 BEADLO Cc1nc(NCC[C@H](C)F)c2c([nH+]1)CCCC2 ZINC000338759367 180067147 /nfs/dbraw/zinc/06/71/47/180067147.db2.gz XUBIWEQCVZSXAK-VIFPVBQESA-N 1 2 237.322 2.246 20 0 BEADLO Cc1nc(NCCCCF)c2c([nH+]1)CCCC2 ZINC000359966009 180067255 /nfs/dbraw/zinc/06/72/55/180067255.db2.gz IUFZXXWSOFLQHW-UHFFFAOYSA-N 1 2 237.322 2.247 20 0 BEADLO CCc1cc(N[C@@]2(C)CCO[C@@H]2C)nc[nH+]1 ZINC000230098175 538055345 /nfs/dbraw/zinc/05/53/45/538055345.db2.gz XLKDRFMUVNBJBI-SKDRFNHKSA-N 1 2 221.304 2.018 20 0 BEADLO Cc1[nH]c(CNCC(F)(F)C(F)F)[nH+]c1C ZINC000623532051 362950615 /nfs/dbraw/zinc/95/06/15/362950615.db2.gz ZTZPYCLSROTGCM-UHFFFAOYSA-N 1 2 239.216 2.017 20 0 BEADLO Cc1nc(NC2CC2)c2c([nH+]1)CCCC2 ZINC000107301036 180068481 /nfs/dbraw/zinc/06/84/81/180068481.db2.gz RIPJMAMBQGVOHC-UHFFFAOYSA-N 1 2 203.289 2.238 20 0 BEADLO Cc1nc(N[C@H](CO)C(C)C)c2c([nH+]1)CCCC2 ZINC000272958310 180069600 /nfs/dbraw/zinc/06/96/00/180069600.db2.gz ZSQQMVASNBKPFN-CYBMUJFWSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1[nH+]c2ccccc2n1CC1(O)CCC1 ZINC000336327920 180102708 /nfs/dbraw/zinc/10/27/08/180102708.db2.gz MSSYGJQONOJNHC-UHFFFAOYSA-N 1 2 216.284 2.260 20 0 BEADLO Cc1[nH]c(C(=O)NCc2ccc(F)c(C)c2)c[nH+]1 ZINC000336245872 180131556 /nfs/dbraw/zinc/13/15/56/180131556.db2.gz DPKMOSAQVRJTPI-UHFFFAOYSA-N 1 2 247.273 2.096 20 0 BEADLO COC1CCC(Nc2cc(C)[nH+]cn2)CC1 ZINC000220584012 350177272 /nfs/dbraw/zinc/17/72/72/350177272.db2.gz ZQXSGCKTVNUDQL-UHFFFAOYSA-N 1 2 221.304 2.155 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2cnc(C)nc2)s1 ZINC000339218003 180140351 /nfs/dbraw/zinc/14/03/51/180140351.db2.gz DSJGTIFZNYUWMU-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2cnc(C)nc2)s1 ZINC000339218003 180140357 /nfs/dbraw/zinc/14/03/57/180140357.db2.gz DSJGTIFZNYUWMU-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N([C@@H](C)C(C)C)C1CC1 ZINC000346292836 180120603 /nfs/dbraw/zinc/12/06/03/180120603.db2.gz XVAWWDQBFFLPNJ-NSHDSACASA-N 1 2 249.358 2.296 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1ccc(Cl)cc1 ZINC000334508689 180120623 /nfs/dbraw/zinc/12/06/23/180120623.db2.gz OTTQCTAJLMUNQZ-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO Cc1ncc(C[N@H+]2CCO[C@H](C)[C@@H]2C)s1 ZINC000156320813 180144279 /nfs/dbraw/zinc/14/42/79/180144279.db2.gz WVCTWPLEMJIOPS-DTWKUNHWSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ncc(C[N@@H+]2CCO[C@H](C)[C@@H]2C)s1 ZINC000156320813 180144281 /nfs/dbraw/zinc/14/42/81/180144281.db2.gz WVCTWPLEMJIOPS-DTWKUNHWSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+](C)CCC(F)(F)F)o1 ZINC000104678603 191066687 /nfs/dbraw/zinc/06/66/87/191066687.db2.gz NQFAESJLKPXEOX-ZCFIWIBFSA-N 1 2 237.225 2.323 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+](C)CCC(F)(F)F)o1 ZINC000104678603 191066689 /nfs/dbraw/zinc/06/66/89/191066689.db2.gz NQFAESJLKPXEOX-ZCFIWIBFSA-N 1 2 237.225 2.323 20 0 BEADLO Cc1cc(N2CC[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000604758651 350183764 /nfs/dbraw/zinc/18/37/64/350183764.db2.gz PHPUQKCFEAMSTH-VIFPVBQESA-N 1 2 203.289 2.261 20 0 BEADLO Cc1nc(NCc2cccc(N(C)C)c2)cc[nH+]1 ZINC000266338851 180200003 /nfs/dbraw/zinc/20/00/03/180200003.db2.gz HYBGQSSBMBCNAM-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO Cc1nc(NCCc2ccc(O)cc2)cc[nH+]1 ZINC000054936105 180200070 /nfs/dbraw/zinc/20/00/70/180200070.db2.gz GSUBIAGTCLTPQD-UHFFFAOYSA-N 1 2 229.283 2.145 20 0 BEADLO Cc1nc(NC[C@@H](CO)C2CCCCC2)cc[nH+]1 ZINC000292751701 180201102 /nfs/dbraw/zinc/20/11/02/180201102.db2.gz JPRVCLWEKJCPTA-ZDUSSCGKSA-N 1 2 249.358 2.386 20 0 BEADLO Cc1nc(NC[C@@]2(C)CCCC[C@@H]2O)cc[nH+]1 ZINC000175060138 180201570 /nfs/dbraw/zinc/20/15/70/180201570.db2.gz ZUZAMDRLRRTMGK-WCQYABFASA-N 1 2 235.331 2.138 20 0 BEADLO Cc1nc(NCCc2ccccc2)cc[nH+]1 ZINC000045921699 180201798 /nfs/dbraw/zinc/20/17/98/180201798.db2.gz PAGUOIQYEIBOFS-UHFFFAOYSA-N 1 2 213.284 2.440 20 0 BEADLO Cc1nc(N[C@@H](C)[C@H]2CCCCO2)cc[nH+]1 ZINC000271915266 180201940 /nfs/dbraw/zinc/20/19/40/180201940.db2.gz BUHSMESIXWDICA-GXSJLCMTSA-N 1 2 221.304 2.155 20 0 BEADLO Cc1cnccc1CNc1cc[nH+]c(C)n1 ZINC000129869582 180202208 /nfs/dbraw/zinc/20/22/08/180202208.db2.gz KILDUXKPJQRDPW-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO Cc1ccoc1CNc1cc[nH+]c(C)n1 ZINC000291654757 180202473 /nfs/dbraw/zinc/20/24/73/180202473.db2.gz CFPTZLYPWKDQQG-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO Cc1nc(N[C@@H](C)c2nnc(C(C)C)[nH]2)cc[nH+]1 ZINC000270701183 180203933 /nfs/dbraw/zinc/20/39/33/180203933.db2.gz INEYBANNTZGAEN-QMMMGPOBSA-N 1 2 246.318 2.200 20 0 BEADLO Cc1nc(N[C@H](C)[C@H](O)c2ccccc2)cc[nH+]1 ZINC000288183466 180204859 /nfs/dbraw/zinc/20/48/59/180204859.db2.gz JGLINDJHXXDOOF-YGRLFVJLSA-N 1 2 243.310 2.319 20 0 BEADLO Cc1nc(NCC2(c3ccccc3)CC2)cc[nH+]1 ZINC000360230121 180179242 /nfs/dbraw/zinc/17/92/42/180179242.db2.gz IVVLQPBVLIJJNH-UHFFFAOYSA-N 1 2 239.322 2.351 20 0 BEADLO Cc1nc(NCCc2c(F)cccc2F)cc[nH+]1 ZINC000360963825 180181100 /nfs/dbraw/zinc/18/11/00/180181100.db2.gz GYBUKQSLQLRJCQ-UHFFFAOYSA-N 1 2 249.264 2.140 20 0 BEADLO Cc1[nH+]cccc1Cc1nc(CC2CC2)no1 ZINC000285581978 180222666 /nfs/dbraw/zinc/22/26/66/180222666.db2.gz SPPTVTIXQABWNC-UHFFFAOYSA-N 1 2 229.283 2.316 20 0 BEADLO Cc1[nH+]cccc1NCc1ccn(C)c1 ZINC000085726741 180226742 /nfs/dbraw/zinc/22/67/42/180226742.db2.gz ALIGDHAOOIOOBA-UHFFFAOYSA-N 1 2 201.273 2.341 20 0 BEADLO Cc1[nH+]cccc1N[C@H](C)Cn1cccn1 ZINC000123169767 180227254 /nfs/dbraw/zinc/22/72/54/180227254.db2.gz DTRXTSTUFZCMRU-SNVBAGLBSA-N 1 2 216.288 2.087 20 0 BEADLO Cc1nc(N[C@H](C)Cn2cc[nH+]c2)sc1C ZINC000083532819 350240389 /nfs/dbraw/zinc/24/03/89/350240389.db2.gz RLLGMCUIQNXSHY-MRVPVSSYSA-N 1 2 236.344 2.457 20 0 BEADLO CC(C)Cn1nccc1C[N@H+]1CC[C@H](F)C1 ZINC000648040100 490407149 /nfs/dbraw/zinc/40/71/49/490407149.db2.gz BURIBASZRIXSBM-NSHDSACASA-N 1 2 225.311 2.083 20 0 BEADLO CCc1nc(C[N@@H+]2CC[C@@H](C)C[C@H]2C)no1 ZINC000335084208 350267874 /nfs/dbraw/zinc/26/78/74/350267874.db2.gz BJJOWUFAKDQLDA-NXEZZACHSA-N 1 2 223.320 2.252 20 0 BEADLO CCc1nc(C[N@H+]2CC[C@@H](C)C[C@H]2C)no1 ZINC000335084208 350267877 /nfs/dbraw/zinc/26/78/77/350267877.db2.gz BJJOWUFAKDQLDA-NXEZZACHSA-N 1 2 223.320 2.252 20 0 BEADLO O=C(N[C@]12C[C@H]1CCC2)c1ccc2[nH+]ccn2c1 ZINC000617206288 350352064 /nfs/dbraw/zinc/35/20/64/350352064.db2.gz GGWWLNYIZJJPND-BXUZGUMPSA-N 1 2 241.294 2.007 20 0 BEADLO Cc1ncsc1C[N@H+]1CCO[C@H](C)[C@@H]1C ZINC000093418618 180317032 /nfs/dbraw/zinc/31/70/32/180317032.db2.gz UMMOSZIQGZJNLO-VHSXEESVSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ncsc1C[N@@H+]1CCO[C@H](C)[C@@H]1C ZINC000093418618 180317035 /nfs/dbraw/zinc/31/70/35/180317035.db2.gz UMMOSZIQGZJNLO-VHSXEESVSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2ccon2)cn1 ZINC000427857144 191096229 /nfs/dbraw/zinc/09/62/29/191096229.db2.gz PQLRGAVDYATPDM-VHSXEESVSA-N 1 2 232.287 2.185 20 0 BEADLO CCCCc1nc(C[N@H+](C)[C@@H](C)CO)cs1 ZINC000132116450 191101341 /nfs/dbraw/zinc/10/13/41/191101341.db2.gz JTWLIZINCVUYTA-JTQLQIEISA-N 1 2 242.388 2.298 20 0 BEADLO CCCCc1nc(C[N@@H+](C)[C@@H](C)CO)cs1 ZINC000132116450 191101344 /nfs/dbraw/zinc/10/13/44/191101344.db2.gz JTWLIZINCVUYTA-JTQLQIEISA-N 1 2 242.388 2.298 20 0 BEADLO Cc1[nH]c(CN2CC(CC(F)(F)F)C2)[nH+]c1C ZINC000628306921 350435299 /nfs/dbraw/zinc/43/52/99/350435299.db2.gz DLADOVKOKQYQOO-UHFFFAOYSA-N 1 2 247.264 2.411 20 0 BEADLO Cc1nn(C)c(C)c1N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000293898261 180345454 /nfs/dbraw/zinc/34/54/54/180345454.db2.gz GYXNDEDIXIACTH-KWQFWETISA-N 1 2 245.330 2.351 20 0 BEADLO Cc1nn(C)c(Cl)c1C[N@@H+]1CCC[C@H]1CF ZINC000293018956 180349550 /nfs/dbraw/zinc/34/95/50/180349550.db2.gz KIIUFEPTYIDJNO-VIFPVBQESA-N 1 2 245.729 2.316 20 0 BEADLO Cc1nn(C)c(Cl)c1C[N@H+]1CCC[C@H]1CF ZINC000293018956 180349553 /nfs/dbraw/zinc/34/95/53/180349553.db2.gz KIIUFEPTYIDJNO-VIFPVBQESA-N 1 2 245.729 2.316 20 0 BEADLO C[C@H]([NH2+][C@H]1CCC1(C)C)C(=O)OC(C)(C)C ZINC000309304427 323341093 /nfs/dbraw/zinc/34/10/93/323341093.db2.gz MUCLJXACQWOCJU-UWVGGRQHSA-N 1 2 227.348 2.495 20 0 BEADLO CC[N@H+](Cc1ccncc1)Cc1ncc(C)cn1 ZINC000336722658 350483419 /nfs/dbraw/zinc/48/34/19/350483419.db2.gz YNNPHVQTHGJCPS-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO CC[N@@H+](Cc1ccncc1)Cc1ncc(C)cn1 ZINC000336722658 350483422 /nfs/dbraw/zinc/48/34/22/350483422.db2.gz YNNPHVQTHGJCPS-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO c1[nH+]c(Sc2cnccn2)n2ccccc12 ZINC000642225621 362959232 /nfs/dbraw/zinc/95/92/32/362959232.db2.gz ZGKOKQPUBOIYQA-UHFFFAOYSA-N 1 2 228.280 2.276 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@H](CF)C2)s1 ZINC000577481320 365963432 /nfs/dbraw/zinc/96/34/32/365963432.db2.gz IGPYTCFEZNLQFY-SNVBAGLBSA-N 1 2 243.347 2.481 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@H](CF)C2)s1 ZINC000577481320 365963437 /nfs/dbraw/zinc/96/34/37/365963437.db2.gz IGPYTCFEZNLQFY-SNVBAGLBSA-N 1 2 243.347 2.481 20 0 BEADLO Cc1ccccc1NC(=O)NCc1c[nH+]cn1C ZINC000335327616 538095804 /nfs/dbraw/zinc/09/58/04/538095804.db2.gz WWMWGHLUQVLKQK-UHFFFAOYSA-N 1 2 244.298 2.050 20 0 BEADLO FC[C@@H](NCc1[nH]cc[nH+]1)c1ccc(F)cc1 ZINC000631283741 350596313 /nfs/dbraw/zinc/59/63/13/350596313.db2.gz MHZBGVSUJIDWDX-LLVKDONJSA-N 1 2 237.253 2.349 20 0 BEADLO CCCC[C@@H](C)C(=O)N[C@@H]1CCn2cc[nH+]c2C1 ZINC000337589693 350598425 /nfs/dbraw/zinc/59/84/25/350598425.db2.gz HKFNQCYKHCSRFF-VXGBXAGGSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1nc(NC(C)(C)C(F)F)cc[nH+]1 ZINC000307048903 490651934 /nfs/dbraw/zinc/65/19/34/490651934.db2.gz CDDMTBJSDFJPMC-UHFFFAOYSA-N 1 2 201.220 2.241 20 0 BEADLO C/C=C/CNC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000637488544 350649740 /nfs/dbraw/zinc/64/97/40/350649740.db2.gz QAXCFFFLCBTDLY-KXMPLOMGSA-N 1 2 248.330 2.222 20 0 BEADLO CCCCC[N@@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000606903393 350627270 /nfs/dbraw/zinc/62/72/70/350627270.db2.gz XXIYXBVSVAFXOJ-VIFPVBQESA-N 1 2 225.254 2.440 20 0 BEADLO CCCCC[N@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000606903393 350627273 /nfs/dbraw/zinc/62/72/73/350627273.db2.gz XXIYXBVSVAFXOJ-VIFPVBQESA-N 1 2 225.254 2.440 20 0 BEADLO Cc1ncc(C[NH2+]Cc2csc(C)n2)o1 ZINC000397977111 362975839 /nfs/dbraw/zinc/97/58/39/362975839.db2.gz GCGBBEAFPKSYIE-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO Cc1c[nH]c(CN2Cc3cccc(F)c3C2)[nH+]1 ZINC000628308703 350784136 /nfs/dbraw/zinc/78/41/36/350784136.db2.gz DRKVKGSEQTXLQD-UHFFFAOYSA-N 1 2 231.274 2.373 20 0 BEADLO CCCC[N@H+](Cc1noc(C)n1)C1CC1 ZINC000051854644 350864080 /nfs/dbraw/zinc/86/40/80/350864080.db2.gz ODHICKIFVVYIOX-UHFFFAOYSA-N 1 2 209.293 2.143 20 0 BEADLO CCCC[N@@H+](Cc1noc(C)n1)C1CC1 ZINC000051854644 350864083 /nfs/dbraw/zinc/86/40/83/350864083.db2.gz ODHICKIFVVYIOX-UHFFFAOYSA-N 1 2 209.293 2.143 20 0 BEADLO COc1ccc[nH+]c1N1CCCSCC1 ZINC000623866201 350934296 /nfs/dbraw/zinc/93/42/96/350934296.db2.gz OBPRWIBVCCDFEU-UHFFFAOYSA-N 1 2 224.329 2.034 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cnc(C)s2)on1 ZINC000052101334 350937448 /nfs/dbraw/zinc/93/74/48/350937448.db2.gz ADKAXDQZAYCUEP-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cnc(C)s2)on1 ZINC000052101334 350937451 /nfs/dbraw/zinc/93/74/51/350937451.db2.gz ADKAXDQZAYCUEP-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO CC[C@@H]1C[NH+](Cc2cnc(C)o2)C[C@@H](CC)O1 ZINC000628315221 350875398 /nfs/dbraw/zinc/87/53/98/350875398.db2.gz CXQVZTLJBGRGRW-VXGBXAGGSA-N 1 2 238.331 2.372 20 0 BEADLO CC=CC[NH2+]Cc1n[nH]c2ccccc21 ZINC000623739040 350883541 /nfs/dbraw/zinc/88/35/41/350883541.db2.gz GHIRQEYHZIIUSF-NSCUHMNNSA-N 1 2 201.273 2.229 20 0 BEADLO CC[C@H]1CN(Cc2[nH]cc(C)[nH+]2)C[C@H](CC)O1 ZINC000628315655 350897237 /nfs/dbraw/zinc/89/72/37/350897237.db2.gz RKBAJSIIYNJNSG-RYUDHWBXSA-N 1 2 237.347 2.108 20 0 BEADLO Fc1cc(C[NH2+]Cc2cocn2)cc(F)c1F ZINC000397735789 350968956 /nfs/dbraw/zinc/96/89/56/350968956.db2.gz SPGMCINWGUKNIL-UHFFFAOYSA-N 1 2 242.200 2.382 20 0 BEADLO CCC1CC[NH+](Cc2noc(C)n2)CC1 ZINC000052280157 350942483 /nfs/dbraw/zinc/94/24/83/350942483.db2.gz RZRIUYGKAABPND-UHFFFAOYSA-N 1 2 209.293 2.000 20 0 BEADLO O=C(NCc1ccn2cc[nH+]c2c1)C1=CCCC1 ZINC000177670020 366017353 /nfs/dbraw/zinc/01/73/53/366017353.db2.gz NXSFTQFDHFSRIT-UHFFFAOYSA-N 1 2 241.294 2.061 20 0 BEADLO Cc1ncc(C[NH2+]Cc2ccn(C(C)C)n2)o1 ZINC000398057703 362994308 /nfs/dbraw/zinc/99/43/08/362994308.db2.gz JBVRBHDLSWGEBV-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO CC1(C)CCC(C[NH2+]Cc2c[nH]nn2)CC1 ZINC000398428686 351155373 /nfs/dbraw/zinc/15/53/73/351155373.db2.gz YYGJQPJZKRGJHL-UHFFFAOYSA-N 1 2 222.336 2.111 20 0 BEADLO CC1(C)CCC(C[NH2+]Cc2cn[nH]n2)CC1 ZINC000398428686 351155375 /nfs/dbraw/zinc/15/53/75/351155375.db2.gz YYGJQPJZKRGJHL-UHFFFAOYSA-N 1 2 222.336 2.111 20 0 BEADLO Cc1[nH]c(CN2CC[C@@H](OC(C)C)C2)[nH+]c1C ZINC000628321089 351166785 /nfs/dbraw/zinc/16/67/85/351166785.db2.gz KFLSNOKUQWGMDQ-GFCCVEGCSA-N 1 2 237.347 2.026 20 0 BEADLO Cc1cc(Cl)cc(C[NH2+]Cc2cnn[nH]2)c1 ZINC000398384848 351127824 /nfs/dbraw/zinc/12/78/24/351127824.db2.gz IIKKSYUUKBPTBT-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO Cc1cc(Cl)cc(C[NH2+]Cc2c[nH]nn2)c1 ZINC000398384848 351127826 /nfs/dbraw/zinc/12/78/26/351127826.db2.gz IIKKSYUUKBPTBT-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO CC[C@H]1CN(Cc2[nH]c(C)c(C)[nH+]2)[C@@H](C)CO1 ZINC000628324469 351236874 /nfs/dbraw/zinc/23/68/74/351236874.db2.gz VFQANFPPFNRAAH-CABZTGNLSA-N 1 2 237.347 2.026 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H](CC)OC ZINC000265206925 351265438 /nfs/dbraw/zinc/26/54/38/351265438.db2.gz KYYDXSUIGHRSRL-LLVKDONJSA-N 1 2 222.288 2.008 20 0 BEADLO CC[C@@H](OC)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000263889916 351196508 /nfs/dbraw/zinc/19/65/08/351196508.db2.gz ZPGALTOSYLYWOB-LLVKDONJSA-N 1 2 247.298 2.006 20 0 BEADLO CC(C)CN(C(=O)CCn1cc[nH+]c1)C(C)C ZINC000263904826 351198469 /nfs/dbraw/zinc/19/84/69/351198469.db2.gz RGOAZAFSMDCULG-UHFFFAOYSA-N 1 2 237.347 2.166 20 0 BEADLO Cc1c[nH]c(C[NH+]2CC(C)(c3ccccc3)C2)n1 ZINC000628361831 351334538 /nfs/dbraw/zinc/33/45/38/351334538.db2.gz UVVAHHAOCJZAPA-UHFFFAOYSA-N 1 2 241.338 2.492 20 0 BEADLO CC1(C)C[C@H]1C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000269744765 351366949 /nfs/dbraw/zinc/36/69/49/351366949.db2.gz MXLVKWAZMYBVJZ-QWRGUYRKSA-N 1 2 247.342 2.162 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)CO[C@@H](C)CC ZINC000269860114 351369031 /nfs/dbraw/zinc/36/90/31/351369031.db2.gz KMFSBPOUTBBISC-JTQLQIEISA-N 1 2 236.315 2.398 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C(C)(C)F ZINC000271115265 351401942 /nfs/dbraw/zinc/40/19/42/351401942.db2.gz CXCMOKWCLBDLFA-UHFFFAOYSA-N 1 2 210.252 2.331 20 0 BEADLO Clc1ccc2[nH+]cc(CN=c3cco[nH]3)n2c1 ZINC000361631973 180588170 /nfs/dbraw/zinc/58/81/70/180588170.db2.gz OGVZPVURXWIFKH-UHFFFAOYSA-N 1 2 248.673 2.010 20 0 BEADLO Cc1csc(C[NH2+]Cc2ccns2)n1 ZINC000404468468 351466657 /nfs/dbraw/zinc/46/66/57/351466657.db2.gz VVJFHOISTUZNAO-UHFFFAOYSA-N 1 2 225.342 2.198 20 0 BEADLO Clc1cnn([C@@H]2CCN(c3cccc[nH+]3)C2)c1 ZINC000290935608 180600623 /nfs/dbraw/zinc/60/06/23/180600623.db2.gz ZLKIGLQTMNRUIU-LLVKDONJSA-N 1 2 248.717 2.383 20 0 BEADLO CC[C@@H]1CCCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000276495839 351626741 /nfs/dbraw/zinc/62/67/41/351626741.db2.gz HCCZJVJMCHTXJS-NNNHXZLVSA-N 1 2 233.315 2.214 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N(C)[C@@H](C)C1(C)CC1 ZINC000577647081 366030969 /nfs/dbraw/zinc/03/09/69/366030969.db2.gz GCRYGJWPKCQDTQ-QWRGUYRKSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N(C)[C@@H](C)C1(C)CC1 ZINC000577647081 366030978 /nfs/dbraw/zinc/03/09/78/366030978.db2.gz GCRYGJWPKCQDTQ-QWRGUYRKSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H](CC(=O)N1CCC[C@@H](C)CC1)n1cc[nH+]c1 ZINC000577734535 366048028 /nfs/dbraw/zinc/04/80/28/366048028.db2.gz ABFOYMQZEUUWOF-OLZOCXBDSA-N 1 2 249.358 2.483 20 0 BEADLO CC(C)=C(C)CC(=O)Nc1ccc(N)[nH+]c1 ZINC000637828235 351674946 /nfs/dbraw/zinc/67/49/46/351674946.db2.gz COQGKVJRWUBABT-UHFFFAOYSA-N 1 2 219.288 2.179 20 0 BEADLO Cc1nc(N2CCC[C@H]2C)c(C)c(C)[nH+]1 ZINC000177832945 366067617 /nfs/dbraw/zinc/06/76/17/366067617.db2.gz TZXPYBCVAFOTFK-MRVPVSSYSA-N 1 2 205.305 2.391 20 0 BEADLO c1cc(C[NH2+][C@@H]2CC23CCCCC3)[nH]n1 ZINC000386953291 363089032 /nfs/dbraw/zinc/08/90/32/363089032.db2.gz XEPSYSWCCXBCNO-LLVKDONJSA-N 1 2 205.305 2.222 20 0 BEADLO Cc1cc(NC(=O)[C@@H](C)c2ccco2)cc[nH+]1 ZINC000607649511 351821197 /nfs/dbraw/zinc/82/11/97/351821197.db2.gz GSQRCHHFWYXGFM-JTQLQIEISA-N 1 2 230.267 2.147 20 0 BEADLO C[C@H]1CCC[C@H](C(=O)N2CC(n3cc[nH+]c3)C2)C1 ZINC000607651304 351827015 /nfs/dbraw/zinc/82/70/15/351827015.db2.gz PEKHUNVKGNHMLG-RYUDHWBXSA-N 1 2 247.342 2.093 20 0 BEADLO CC[C@H](NC(=O)CCc1c[nH+]c[nH]1)[C@H]1CC1(C)C ZINC000577840446 366078865 /nfs/dbraw/zinc/07/88/65/366078865.db2.gz XMFMCXLBUBWTTD-NEPJUHHUSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@H](NC(=O)CCc1c[nH]c[nH+]1)[C@H]1CC1(C)C ZINC000577840446 366078871 /nfs/dbraw/zinc/07/88/71/366078871.db2.gz XMFMCXLBUBWTTD-NEPJUHHUSA-N 1 2 249.358 2.283 20 0 BEADLO c1cc([C@@H]2CCC[N@@H+](Cc3ccns3)C2)[nH]n1 ZINC000637952531 351827703 /nfs/dbraw/zinc/82/77/03/351827703.db2.gz RWLQCVYOBSMMGO-SNVBAGLBSA-N 1 2 248.355 2.246 20 0 BEADLO c1cc([C@@H]2CCC[N@H+](Cc3ccns3)C2)[nH]n1 ZINC000637952531 351827706 /nfs/dbraw/zinc/82/77/06/351827706.db2.gz RWLQCVYOBSMMGO-SNVBAGLBSA-N 1 2 248.355 2.246 20 0 BEADLO CC[C@@H]1CCC[C@H]1NC(=O)CCc1c[nH+]c[nH]1 ZINC000279903296 351828376 /nfs/dbraw/zinc/82/83/76/351828376.db2.gz MTHDCBIQMLRDBI-ZYHUDNBSSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@@H]1CCC[C@H]1NC(=O)CCc1c[nH]c[nH+]1 ZINC000279903296 351828380 /nfs/dbraw/zinc/82/83/80/351828380.db2.gz MTHDCBIQMLRDBI-ZYHUDNBSSA-N 1 2 235.331 2.037 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H](C)OC[C@H]2C)sn1 ZINC000637930643 351806677 /nfs/dbraw/zinc/80/66/77/351806677.db2.gz QTTARANVTMIOAA-ZJUUUORDSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H](C)OC[C@H]2C)sn1 ZINC000637930643 351806681 /nfs/dbraw/zinc/80/66/81/351806681.db2.gz QTTARANVTMIOAA-ZJUUUORDSA-N 1 2 226.345 2.061 20 0 BEADLO CC[C@@H]1CCCC[C@H]1C(=O)NCc1[nH+]ccn1C ZINC000280584480 351851575 /nfs/dbraw/zinc/85/15/75/351851575.db2.gz SIKDTASIXGDUQO-VXGBXAGGSA-N 1 2 249.358 2.253 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@](C)(CC)OC ZINC000280733066 351858474 /nfs/dbraw/zinc/85/84/74/351858474.db2.gz LNDBAJJBJWRBNU-CYBMUJFWSA-N 1 2 236.315 2.398 20 0 BEADLO Cc1ccc2[nH+]c(CS[C@H](C)CO)cn2c1 ZINC000079087478 323627843 /nfs/dbraw/zinc/62/78/43/323627843.db2.gz VHXWKFGPWXGRSE-SNVBAGLBSA-N 1 2 236.340 2.257 20 0 BEADLO CC[C@H](C)[C@H](C[N@H+](C)CC(F)F)OC ZINC000637974490 351849795 /nfs/dbraw/zinc/84/97/95/351849795.db2.gz UZGXYTRIWBWYFS-IUCAKERBSA-N 1 2 209.280 2.244 20 0 BEADLO CC[C@H](C)[C@H](C[N@@H+](C)CC(F)F)OC ZINC000637974490 351849797 /nfs/dbraw/zinc/84/97/97/351849797.db2.gz UZGXYTRIWBWYFS-IUCAKERBSA-N 1 2 209.280 2.244 20 0 BEADLO CC1(C)CCC[C@H]1NC(=O)CCc1[nH]cc[nH+]1 ZINC000280999844 351870445 /nfs/dbraw/zinc/87/04/45/351870445.db2.gz MNTLCAJTYNSEQM-SNVBAGLBSA-N 1 2 235.331 2.037 20 0 BEADLO CC(C)C[C@@H]1COCC[N@@H+]1Cc1ccns1 ZINC000638070319 351940690 /nfs/dbraw/zinc/94/06/90/351940690.db2.gz YJUGMRADTWRKLS-LLVKDONJSA-N 1 2 240.372 2.390 20 0 BEADLO CC(C)C[C@@H]1COCC[N@H+]1Cc1ccns1 ZINC000638070319 351940691 /nfs/dbraw/zinc/94/06/91/351940691.db2.gz YJUGMRADTWRKLS-LLVKDONJSA-N 1 2 240.372 2.390 20 0 BEADLO CC[C@](C)(C[N@H+](CCOC)CC(F)F)OC ZINC000638013776 351891017 /nfs/dbraw/zinc/89/10/17/351891017.db2.gz DYQJFXZEMQUENA-LLVKDONJSA-N 1 2 239.306 2.015 20 0 BEADLO CC[C@](C)(C[N@@H+](CCOC)CC(F)F)OC ZINC000638013776 351891022 /nfs/dbraw/zinc/89/10/22/351891022.db2.gz DYQJFXZEMQUENA-LLVKDONJSA-N 1 2 239.306 2.015 20 0 BEADLO C[C@@H]1[N@H+](Cc2ccns2)CCOC1(C)C ZINC000638097711 351976717 /nfs/dbraw/zinc/97/67/17/351976717.db2.gz ZHHQRHSVJJABPM-VIFPVBQESA-N 1 2 226.345 2.142 20 0 BEADLO C[C@@H]1[N@@H+](Cc2ccns2)CCOC1(C)C ZINC000638097711 351976719 /nfs/dbraw/zinc/97/67/19/351976719.db2.gz ZHHQRHSVJJABPM-VIFPVBQESA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@H]1CCC[C@H]1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000284335065 351995574 /nfs/dbraw/zinc/99/55/74/351995574.db2.gz IYNDCNVKCCJPRC-PWBFPFQSSA-N 1 2 233.315 2.118 20 0 BEADLO CC[C@@H]1CCC[C@H](NC(=O)CCc2[nH]cc[nH+]2)C1 ZINC000287770073 352133994 /nfs/dbraw/zinc/13/39/94/352133994.db2.gz UWKSUDNDKPIRQC-NEPJUHHUSA-N 1 2 249.358 2.427 20 0 BEADLO CC1(C)CC[C@@H]1NC(=O)c1ccc2[nH+]ccn2c1 ZINC000286962026 352108693 /nfs/dbraw/zinc/10/86/93/352108693.db2.gz FXHDLNOAQBCTHX-NSHDSACASA-N 1 2 243.310 2.253 20 0 BEADLO CCCC[C@@H](C)N(C)C(=O)CCn1cc[nH+]c1 ZINC000291071120 352259626 /nfs/dbraw/zinc/25/96/26/352259626.db2.gz XEBLRSDLPAXTOG-GFCCVEGCSA-N 1 2 237.347 2.310 20 0 BEADLO CC(C)[C@H]1CCCC[C@H]1NC(=O)Cn1cc[nH+]c1 ZINC000073380023 352335051 /nfs/dbraw/zinc/33/50/51/352335051.db2.gz VCPGKKYPURJTNP-CHWSQXEVSA-N 1 2 249.358 2.214 20 0 BEADLO CC(C)COCCSCCn1cc[nH+]c1 ZINC000283505589 187691665 /nfs/dbraw/zinc/69/16/65/187691665.db2.gz MAOOZCOGJMEXEC-UHFFFAOYSA-N 1 2 228.361 2.289 20 0 BEADLO CCC[C@@H](C[NH2+]C(C)(C)c1noc(C)n1)OC ZINC000638524441 352357141 /nfs/dbraw/zinc/35/71/41/352357141.db2.gz QODNGTDSFIJZTE-JTQLQIEISA-N 1 2 241.335 2.018 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)NCc1[nH]c[nH+]c1C ZINC000295411115 352411259 /nfs/dbraw/zinc/41/12/59/352411259.db2.gz VFWZDAUIMNDDNH-GHMZBOCLSA-N 1 2 235.331 2.161 20 0 BEADLO C[C@@H](O)CC[NH2+][C@@H](c1ccccc1)C(F)F ZINC000411761130 191208812 /nfs/dbraw/zinc/20/88/12/191208812.db2.gz UCWFIRCSFMHOTP-KOLCDFICSA-N 1 2 229.270 2.353 20 0 BEADLO COc1cccc(C)c1C[NH2+]Cc1cocn1 ZINC000638636620 352479283 /nfs/dbraw/zinc/47/92/83/352479283.db2.gz FDFWMWGTNKAZKB-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO CC[C@@H]1CCCC[C@H]1NC(=O)CCn1cc[nH+]c1 ZINC000299694448 352544726 /nfs/dbraw/zinc/54/47/26/352544726.db2.gz XKJSRMMXDAEXHH-CHWSQXEVSA-N 1 2 249.358 2.358 20 0 BEADLO CCc1[nH+]c(C(C)C)ccc1Cn1ccnn1 ZINC000298355445 352501120 /nfs/dbraw/zinc/50/11/20/352501120.db2.gz SYILCMLGNIOLHQ-UHFFFAOYSA-N 1 2 230.315 2.407 20 0 BEADLO CCc1nc(C[N@H+](CC)CCOC)cs1 ZINC000299114637 352520447 /nfs/dbraw/zinc/52/04/47/352520447.db2.gz CWAWZXGWHHJJDN-UHFFFAOYSA-N 1 2 228.361 2.174 20 0 BEADLO CCc1nc(C[N@@H+](CC)CCOC)cs1 ZINC000299114637 352520451 /nfs/dbraw/zinc/52/04/51/352520451.db2.gz CWAWZXGWHHJJDN-UHFFFAOYSA-N 1 2 228.361 2.174 20 0 BEADLO FC[C@H]1C[N@H+](C/C=C/c2ccccc2)CCO1 ZINC000411852465 191219933 /nfs/dbraw/zinc/21/99/33/191219933.db2.gz KHOGMYPXRUFWIB-GBXSZLQWSA-N 1 2 235.302 2.370 20 0 BEADLO FC[C@H]1C[N@@H+](C/C=C/c2ccccc2)CCO1 ZINC000411852465 191219934 /nfs/dbraw/zinc/21/99/34/191219934.db2.gz KHOGMYPXRUFWIB-GBXSZLQWSA-N 1 2 235.302 2.370 20 0 BEADLO CO[C@H](C)C[N@@H+]1Cc2ccc(C(C)=O)cc2C1 ZINC000411957269 191233609 /nfs/dbraw/zinc/23/36/09/191233609.db2.gz YZWVNMRXFKOGQT-SNVBAGLBSA-N 1 2 233.311 2.240 20 0 BEADLO CO[C@H](C)C[N@H+]1Cc2ccc(C(C)=O)cc2C1 ZINC000411957269 191233612 /nfs/dbraw/zinc/23/36/12/191233612.db2.gz YZWVNMRXFKOGQT-SNVBAGLBSA-N 1 2 233.311 2.240 20 0 BEADLO CCN(Cc1[nH]cc[nH+]1)Cc1occc1C ZINC000412025454 191240123 /nfs/dbraw/zinc/24/01/23/191240123.db2.gz IMGTUHAWPQISBP-UHFFFAOYSA-N 1 2 219.288 2.333 20 0 BEADLO Cc1[nH+]cccc1N[C@@H](C)C[C@@H]1CCCC(=O)N1 ZINC000638787436 352742710 /nfs/dbraw/zinc/74/27/10/352742710.db2.gz ZNGPVWNMNKJZSR-JQWIXIFHSA-N 1 2 247.342 2.249 20 0 BEADLO Cc1[nH+]cccc1N[C@H](C)C[C@@H]1CCCC(=O)N1 ZINC000638787437 352742762 /nfs/dbraw/zinc/74/27/62/352742762.db2.gz ZNGPVWNMNKJZSR-PWSUYJOCSA-N 1 2 247.342 2.249 20 0 BEADLO Cc1c[nH+]cc(NC2CC(n3cccn3)C2)c1 ZINC000638787504 352743518 /nfs/dbraw/zinc/74/35/18/352743518.db2.gz HLADVXCZJCXQRT-UHFFFAOYSA-N 1 2 228.299 2.402 20 0 BEADLO COC(=O)[C@H](CC(C)C)[NH2+][C@H]1CS[C@@H](C)C1 ZINC000086934981 352747681 /nfs/dbraw/zinc/74/76/81/352747681.db2.gz MFXWTKWVJLXWFF-AXFHLTTASA-N 1 2 245.388 2.058 20 0 BEADLO c1cn([C@H]2CCCN(c3ccccn3)C2)c[nH+]1 ZINC000608083269 352755805 /nfs/dbraw/zinc/75/58/05/352755805.db2.gz UHDILOPZLXVAGW-LBPRGKRZSA-N 1 2 228.299 2.120 20 0 BEADLO Cc1ccccc1NC(=O)NCc1[nH+]ccn1C ZINC000334173019 352757288 /nfs/dbraw/zinc/75/72/88/352757288.db2.gz AZFOOPWTTJGATQ-UHFFFAOYSA-N 1 2 244.298 2.050 20 0 BEADLO Cc1nc(C[N@H+]2CCO[C@H](C)[C@H]2C)c(C)s1 ZINC000334184922 352772985 /nfs/dbraw/zinc/77/29/85/352772985.db2.gz DIJXEAXRFOYOMF-RKDXNWHRSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nc(C[N@@H+]2CCO[C@H](C)[C@H]2C)c(C)s1 ZINC000334184922 352772990 /nfs/dbraw/zinc/77/29/90/352772990.db2.gz DIJXEAXRFOYOMF-RKDXNWHRSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1cc(F)cc2c1C[N@H+](CC(N)=O)CC2 ZINC000334240578 352827917 /nfs/dbraw/zinc/82/79/17/352827917.db2.gz MFGFTCKDAHKFMF-UHFFFAOYSA-N 1 2 222.263 2.027 20 0 BEADLO Cc1cc(F)cc2c1C[N@@H+](CC(N)=O)CC2 ZINC000334240578 352827920 /nfs/dbraw/zinc/82/79/20/352827920.db2.gz MFGFTCKDAHKFMF-UHFFFAOYSA-N 1 2 222.263 2.027 20 0 BEADLO c1cnn([C@H]2CCC[N@@H+](Cc3cscn3)C2)c1 ZINC000334188443 352778212 /nfs/dbraw/zinc/77/82/12/352778212.db2.gz HHXFLDKEQHYYEM-LBPRGKRZSA-N 1 2 248.355 2.177 20 0 BEADLO c1cnn([C@H]2CCC[N@H+](Cc3cscn3)C2)c1 ZINC000334188443 352778214 /nfs/dbraw/zinc/77/82/14/352778214.db2.gz HHXFLDKEQHYYEM-LBPRGKRZSA-N 1 2 248.355 2.177 20 0 BEADLO O=C(c1ccsc1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000334245349 352835391 /nfs/dbraw/zinc/83/53/91/352835391.db2.gz FEYUVQNAEIZXCX-JTQLQIEISA-N 1 2 247.323 2.449 20 0 BEADLO CC1=C[C@@H](C)C[N@H+](Cc2nnc(C3CC3)[nH]2)C1 ZINC000334246741 352838061 /nfs/dbraw/zinc/83/80/61/352838061.db2.gz ITSONMWLBRJYHE-SECBINFHSA-N 1 2 232.331 2.080 20 0 BEADLO CC1=C[C@@H](C)C[N@@H+](Cc2nnc(C3CC3)[nH]2)C1 ZINC000334246741 352838065 /nfs/dbraw/zinc/83/80/65/352838065.db2.gz ITSONMWLBRJYHE-SECBINFHSA-N 1 2 232.331 2.080 20 0 BEADLO Cc1ccc(CNC(=O)c2c[nH+]c(C)[nH]2)s1 ZINC000334248272 352840007 /nfs/dbraw/zinc/84/00/07/352840007.db2.gz XBQXPHZHOMWZGI-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO CC[C@@H]([NH2+]C[C@H](SC)C(C)(C)C)C(=O)OC ZINC000336747644 352917396 /nfs/dbraw/zinc/91/73/96/352917396.db2.gz XKQJGFHQKBLNAZ-ZJUUUORDSA-N 1 2 247.404 2.305 20 0 BEADLO Cn1cc[nH+]c1CN[C@H]1CCCc2scnc21 ZINC000623885841 352926475 /nfs/dbraw/zinc/92/64/75/352926475.db2.gz KENCICSZVBTCMB-VIFPVBQESA-N 1 2 248.355 2.044 20 0 BEADLO Cn1ccnc1C[NH2+][C@H]1CCCc2scnc21 ZINC000623885841 352926478 /nfs/dbraw/zinc/92/64/78/352926478.db2.gz KENCICSZVBTCMB-VIFPVBQESA-N 1 2 248.355 2.044 20 0 BEADLO Cc1nc(N2CC[C@@H](c3ccco3)C2)cc[nH+]1 ZINC000608085803 352931932 /nfs/dbraw/zinc/93/19/32/352931932.db2.gz JHLSOSJTAHNUKH-LLVKDONJSA-N 1 2 229.283 2.372 20 0 BEADLO C[C@]1(O)CCN(c2[nH+]ccc3ccc(F)cc32)C1 ZINC000334252657 352889625 /nfs/dbraw/zinc/88/96/25/352889625.db2.gz LKJUOUSPEZLMGS-AWEZNQCLSA-N 1 2 246.285 2.335 20 0 BEADLO CC[C@@H](C)[C@H](C[N@@H+]1CCC(F)(F)C1)OC ZINC000638842361 353018544 /nfs/dbraw/zinc/01/85/44/353018544.db2.gz PXPNIUUTXXAENI-ZJUUUORDSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@@H](C)[C@H](C[N@H+]1CCC(F)(F)C1)OC ZINC000638842361 353018546 /nfs/dbraw/zinc/01/85/46/353018546.db2.gz PXPNIUUTXXAENI-ZJUUUORDSA-N 1 2 221.291 2.389 20 0 BEADLO CCC(=O)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000334371914 353030604 /nfs/dbraw/zinc/03/06/04/353030604.db2.gz XTYMYNNZDNJMQX-UHFFFAOYSA-N 1 2 229.283 2.436 20 0 BEADLO COc1ccnc(C[N@@H+]2CC[C@@](C)(F)C2)c1 ZINC000334361798 353012191 /nfs/dbraw/zinc/01/21/91/353012191.db2.gz JNFZFVHFNJKTOY-GFCCVEGCSA-N 1 2 224.279 2.024 20 0 BEADLO COc1ccnc(C[N@H+]2CC[C@@](C)(F)C2)c1 ZINC000334361798 353012193 /nfs/dbraw/zinc/01/21/93/353012193.db2.gz JNFZFVHFNJKTOY-GFCCVEGCSA-N 1 2 224.279 2.024 20 0 BEADLO COc1cc[nH+]c(CN2CC[C@@](C)(F)C2)c1 ZINC000334361798 353012195 /nfs/dbraw/zinc/01/21/95/353012195.db2.gz JNFZFVHFNJKTOY-GFCCVEGCSA-N 1 2 224.279 2.024 20 0 BEADLO CCN(C(=O)C[C@@H](C)n1cc[nH+]c1)C(C)C ZINC000577854559 366085263 /nfs/dbraw/zinc/08/52/63/366085263.db2.gz QRMXKTAMMDLIBI-LLVKDONJSA-N 1 2 223.320 2.091 20 0 BEADLO CCOc1ncccc1C[NH2+][C@@H](C)c1ncc[nH]1 ZINC000428242557 538107623 /nfs/dbraw/zinc/10/76/23/538107623.db2.gz VPRQAXIUFGCGDK-JTQLQIEISA-N 1 2 246.314 2.054 20 0 BEADLO CC[C@@H](O)CCCNc1[nH+]cccc1OC ZINC000398566923 353070730 /nfs/dbraw/zinc/07/07/30/353070730.db2.gz NEESRBZKGDSZSP-SNVBAGLBSA-N 1 2 224.304 2.053 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1nc(C)c(C)o1 ZINC000334429731 353104330 /nfs/dbraw/zinc/10/43/30/353104330.db2.gz ZFGSLPLYZPYOCR-JOYOIKCWSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1nc(C)c(C)o1 ZINC000334429731 353104334 /nfs/dbraw/zinc/10/43/34/353104334.db2.gz ZFGSLPLYZPYOCR-JOYOIKCWSA-N 1 2 238.331 2.291 20 0 BEADLO Cc1ccc(CN(C)Cc2[nH+]ccn2C)c(F)c1 ZINC000638918852 353082899 /nfs/dbraw/zinc/08/28/99/353082899.db2.gz FQZFBMWVNAQHJM-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1cc(N[C@@H]2CSC[C@H]2C)nc(C2CC2)[nH+]1 ZINC000334408202 353089707 /nfs/dbraw/zinc/08/97/07/353089707.db2.gz HVOKWKSQEZVOPS-LDYMZIIASA-N 1 2 249.383 2.248 20 0 BEADLO Cc1cc(N)nc(S[C@@H](C)c2cccnc2)[nH+]1 ZINC000338593078 188018053 /nfs/dbraw/zinc/01/80/53/188018053.db2.gz RBXFKXBJXLODBG-VIFPVBQESA-N 1 2 246.339 2.446 20 0 BEADLO Fc1ccccc1SCC[NH+]1CCOCC1 ZINC000247503615 188019393 /nfs/dbraw/zinc/01/93/93/188019393.db2.gz GGKPGLSTBRFHJI-UHFFFAOYSA-N 1 2 241.331 2.250 20 0 BEADLO Cc1nc(N(C)[C@H](C)c2ccccn2)cc[nH+]1 ZINC000266166000 188021978 /nfs/dbraw/zinc/02/19/78/188021978.db2.gz YCQFPCFAQXJPNO-SNVBAGLBSA-N 1 2 228.299 2.377 20 0 BEADLO Cc1nc(N(C)CCCOC(C)C)cc[nH+]1 ZINC000266195191 188022725 /nfs/dbraw/zinc/02/27/25/188022725.db2.gz CJYNYPGJVQTBAV-UHFFFAOYSA-N 1 2 223.320 2.036 20 0 BEADLO Cc1nc(F)ccc1C[N@H+]1C[C@@H](C)OC[C@@H]1C ZINC000278442584 188030272 /nfs/dbraw/zinc/03/02/72/188030272.db2.gz LUCHLRPBXWAGTR-VHSXEESVSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1nc(F)ccc1C[N@@H+]1C[C@@H](C)OC[C@@H]1C ZINC000278442584 188030274 /nfs/dbraw/zinc/03/02/74/188030274.db2.gz LUCHLRPBXWAGTR-VHSXEESVSA-N 1 2 238.306 2.138 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@H+](C)CC1CC1 ZINC000280187412 188031457 /nfs/dbraw/zinc/03/14/57/188031457.db2.gz ZQLXIEQKJLCAHC-NSHDSACASA-N 1 2 239.340 2.304 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@@H+](C)CC1CC1 ZINC000280187412 188031459 /nfs/dbraw/zinc/03/14/59/188031459.db2.gz ZQLXIEQKJLCAHC-NSHDSACASA-N 1 2 239.340 2.304 20 0 BEADLO CC(C)N(CC1CCC1)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000282882454 188033028 /nfs/dbraw/zinc/03/30/28/188033028.db2.gz VMMDKEYIXWORJB-VOTSOKGWSA-N 1 2 247.342 2.460 20 0 BEADLO CC(=O)c1ccc(C[N@H+]2C[C@H](C)OC[C@H]2C)cc1 ZINC000296568271 188040207 /nfs/dbraw/zinc/04/02/07/188040207.db2.gz QFEJSVVNNGSUNB-NEPJUHHUSA-N 1 2 247.338 2.498 20 0 BEADLO CC(=O)c1ccc(C[N@@H+]2C[C@H](C)OC[C@H]2C)cc1 ZINC000296568271 188040209 /nfs/dbraw/zinc/04/02/09/188040209.db2.gz QFEJSVVNNGSUNB-NEPJUHHUSA-N 1 2 247.338 2.498 20 0 BEADLO C=Cn1cc(C[NH2+][C@H](COC)c2ccco2)cn1 ZINC000194351453 188005359 /nfs/dbraw/zinc/00/53/59/188005359.db2.gz DKANCQNHJALDHL-GFCCVEGCSA-N 1 2 247.298 2.054 20 0 BEADLO CC[C@@H](OC)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000330671083 353177012 /nfs/dbraw/zinc/17/70/12/353177012.db2.gz MMTRKHAAETZJFR-LLVKDONJSA-N 1 2 236.315 2.370 20 0 BEADLO Cc1oncc1N[C@@H](c1[nH+]ccn1C)C1CC1 ZINC000638973271 353177762 /nfs/dbraw/zinc/17/77/62/353177762.db2.gz HTHBSDVBCXXJAN-LLVKDONJSA-N 1 2 232.287 2.280 20 0 BEADLO FC(F)(F)CC[N@@H+]1CCC[C@H]1c1cc[nH]n1 ZINC000286126785 180880666 /nfs/dbraw/zinc/88/06/66/180880666.db2.gz MKIPGNCPHXUIIE-VIFPVBQESA-N 1 2 233.237 2.499 20 0 BEADLO FC(F)(F)CC[N@H+]1CCC[C@H]1c1cc[nH]n1 ZINC000286126785 180880667 /nfs/dbraw/zinc/88/06/67/180880667.db2.gz MKIPGNCPHXUIIE-VIFPVBQESA-N 1 2 233.237 2.499 20 0 BEADLO COc1ccc(N[C@H]2CSC[C@H]2C)[nH+]c1 ZINC000380322650 538111416 /nfs/dbraw/zinc/11/14/16/538111416.db2.gz KXGWLDXNQXACQD-SCZZXKLOSA-N 1 2 224.329 2.254 20 0 BEADLO FC(F)n1cc[nH+]c1Cn1ccc(Cl)n1 ZINC000121255591 180912707 /nfs/dbraw/zinc/91/27/07/180912707.db2.gz IWOVUHHFBWSNLX-UHFFFAOYSA-N 1 2 232.621 2.176 20 0 BEADLO CCC1(CNC(=O)CCCn2cc[nH+]c2)CCC1 ZINC000084253561 538113714 /nfs/dbraw/zinc/11/37/14/538113714.db2.gz WXRPLSBHFWJJOP-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO C[C@@H]1CC(C(=O)Nc2cc[nH+]cc2O)C[C@@H](C)C1 ZINC000356556751 188238567 /nfs/dbraw/zinc/23/85/67/188238567.db2.gz YNJGKMKBLKQWOK-UWVGGRQHSA-N 1 2 248.326 2.220 20 0 BEADLO CC(C)[C@H]1CCCN(C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000356804754 188238580 /nfs/dbraw/zinc/23/85/80/188238580.db2.gz OQVUKWYLDPIPBK-LBPRGKRZSA-N 1 2 249.358 2.237 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)C1CCC1 ZINC000362394718 188244741 /nfs/dbraw/zinc/24/47/41/188244741.db2.gz FNHMVHDYTUZCMG-UHFFFAOYSA-N 1 2 204.273 2.437 20 0 BEADLO CC(C)C[C@@H](C)C[N@@H+]1CC(F)(F)C[C@@H]1CO ZINC000369052309 188246278 /nfs/dbraw/zinc/24/62/78/188246278.db2.gz ASSKLNDFJMBUDO-GHMZBOCLSA-N 1 2 235.318 2.371 20 0 BEADLO CC(C)C[C@@H](C)C[N@H+]1CC(F)(F)C[C@@H]1CO ZINC000369052309 188246280 /nfs/dbraw/zinc/24/62/80/188246280.db2.gz ASSKLNDFJMBUDO-GHMZBOCLSA-N 1 2 235.318 2.371 20 0 BEADLO C/C=C/C=C/C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000378521259 188251899 /nfs/dbraw/zinc/25/18/99/188251899.db2.gz UTKSTDKCNLEJSZ-PPNHYWAMSA-N 1 2 231.299 2.206 20 0 BEADLO C[C@@H]1CC(=O)CC[N@@H+]1CCc1cccc(F)c1 ZINC000049711356 188298470 /nfs/dbraw/zinc/29/84/70/188298470.db2.gz CPWDMVOILWQOKK-LLVKDONJSA-N 1 2 235.302 2.422 20 0 BEADLO C[C@@H]1CC(=O)CC[N@H+]1CCc1cccc(F)c1 ZINC000049711356 188298472 /nfs/dbraw/zinc/29/84/72/188298472.db2.gz CPWDMVOILWQOKK-LLVKDONJSA-N 1 2 235.302 2.422 20 0 BEADLO COc1ncc(CNc2ccc[nH+]c2C)s1 ZINC000393792977 353319221 /nfs/dbraw/zinc/31/92/21/353319221.db2.gz FFJFCWROASMKBZ-UHFFFAOYSA-N 1 2 235.312 2.467 20 0 BEADLO CC(C)c1cnc(C[NH2+]CCF)s1 ZINC000336645051 188339955 /nfs/dbraw/zinc/33/99/55/188339955.db2.gz UFJRXUHQOZBWKV-UHFFFAOYSA-N 1 2 202.298 2.326 20 0 BEADLO Cc1nc(N[C@H](c2nccn2C)C2CC2)cc[nH+]1 ZINC000343287607 353358724 /nfs/dbraw/zinc/35/87/24/353358724.db2.gz PDLLCJYFYAFLLP-LBPRGKRZSA-N 1 2 243.314 2.082 20 0 BEADLO CCC[C@@H](C[N@H+](CC)CC(F)F)OC ZINC000639058822 353365227 /nfs/dbraw/zinc/36/52/27/353365227.db2.gz IPBWBLUVQDSPIO-VIFPVBQESA-N 1 2 209.280 2.389 20 0 BEADLO CCC[C@@H](C[N@@H+](CC)CC(F)F)OC ZINC000639058822 353365229 /nfs/dbraw/zinc/36/52/29/353365229.db2.gz IPBWBLUVQDSPIO-VIFPVBQESA-N 1 2 209.280 2.389 20 0 BEADLO CC(C)(C)c1nc(N[C@H]2CCCC[C@@H]2O)cc[nH+]1 ZINC000080803708 353393673 /nfs/dbraw/zinc/39/36/73/353393673.db2.gz HOSBULQEVKFXAO-QWRGUYRKSA-N 1 2 249.358 2.490 20 0 BEADLO Cc1nnc(NCCc2ccc(C)[nH+]c2)s1 ZINC000013235380 188342349 /nfs/dbraw/zinc/34/23/49/188342349.db2.gz DYPDFNKNGVRVRI-UHFFFAOYSA-N 1 2 234.328 2.205 20 0 BEADLO C/C=C(\C)C(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000267532883 188373344 /nfs/dbraw/zinc/37/33/44/188373344.db2.gz TWKNDYXEYLSZKH-JNZVDCKRSA-N 1 2 233.315 2.430 20 0 BEADLO C/C=C(\C=C\C(=O)N[C@H](C)Cn1cc[nH+]c1)CC ZINC000268767931 188373714 /nfs/dbraw/zinc/37/37/14/188373714.db2.gz OKCLEINQTCERDL-BCLPDBEVSA-N 1 2 247.342 2.300 20 0 BEADLO CC(C)=CC(=O)N1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000268372493 188373885 /nfs/dbraw/zinc/37/38/85/188373885.db2.gz KMCMZNJCWGMLHA-STQMWFEESA-N 1 2 247.342 2.259 20 0 BEADLO CC(C)[C@H](NC(=O)C1CC=CC1)c1[nH]cc[nH+]1 ZINC000276666008 188379929 /nfs/dbraw/zinc/37/99/29/188379929.db2.gz UJCPUCJHAJWDDU-NSHDSACASA-N 1 2 233.315 2.189 20 0 BEADLO CC[C@H]1CCCC[C@@H]1C(=O)NCCn1cc[nH+]c1 ZINC000280446245 188383170 /nfs/dbraw/zinc/38/31/70/188383170.db2.gz YLIVYWTXGQQHTQ-STQMWFEESA-N 1 2 249.358 2.216 20 0 BEADLO c1cc(C[N@@H+]2CCc3ncsc3C2)sn1 ZINC000639086012 353433892 /nfs/dbraw/zinc/43/38/92/353433892.db2.gz NBCMHGAOFYBCHV-UHFFFAOYSA-N 1 2 237.353 2.158 20 0 BEADLO c1cc(C[N@H+]2CCc3ncsc3C2)sn1 ZINC000639086012 353433894 /nfs/dbraw/zinc/43/38/94/353433894.db2.gz NBCMHGAOFYBCHV-UHFFFAOYSA-N 1 2 237.353 2.158 20 0 BEADLO COc1ccncc1C[N@H+](C)Cc1ccco1 ZINC000286705649 188387152 /nfs/dbraw/zinc/38/71/52/188387152.db2.gz CLFWVGAJNVJHBZ-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1ccncc1C[N@@H+](C)Cc1ccco1 ZINC000286705649 188387154 /nfs/dbraw/zinc/38/71/54/188387154.db2.gz CLFWVGAJNVJHBZ-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO CC(C)[C@H](O)CSc1[nH+]cc2ccccn21 ZINC000298210675 188395284 /nfs/dbraw/zinc/39/52/84/188395284.db2.gz GOWKEQMVWOGTGP-LLVKDONJSA-N 1 2 236.340 2.443 20 0 BEADLO Cc1nc(N2CCCO[C@H](C(C)C)C2)cc[nH+]1 ZINC000293912914 188392075 /nfs/dbraw/zinc/39/20/75/188392075.db2.gz DFEXWZGETDVHEA-LBPRGKRZSA-N 1 2 235.331 2.036 20 0 BEADLO CC(C)[N@H+](Cc1cnc(Cl)s1)C1COC1 ZINC000295336810 188392933 /nfs/dbraw/zinc/39/29/33/188392933.db2.gz HTZFJDIGDRKPMA-UHFFFAOYSA-N 1 2 246.763 2.406 20 0 BEADLO CC(C)[N@@H+](Cc1cnc(Cl)s1)C1COC1 ZINC000295336810 188392935 /nfs/dbraw/zinc/39/29/35/188392935.db2.gz HTZFJDIGDRKPMA-UHFFFAOYSA-N 1 2 246.763 2.406 20 0 BEADLO C[C@H]1CC[C@H](CNc2[nH+]cnc3c2cnn3C)C1 ZINC000230434251 353497563 /nfs/dbraw/zinc/49/75/63/353497563.db2.gz DNQFIEDJTFEURJ-UWVGGRQHSA-N 1 2 245.330 2.211 20 0 BEADLO CC(C)c1nnc(C[NH2+]CC2(F)CC2)s1 ZINC000308873995 353586911 /nfs/dbraw/zinc/58/69/11/353586911.db2.gz RVGYTXIJNVILBN-UHFFFAOYSA-N 1 2 229.324 2.253 20 0 BEADLO c1cc2c(s1)C[N@H+](Cc1cnccn1)CC2 ZINC000334515549 353610476 /nfs/dbraw/zinc/61/04/76/353610476.db2.gz LPPMHACHUSLACO-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1cc2c(s1)C[N@@H+](Cc1cnccn1)CC2 ZINC000334515549 353610479 /nfs/dbraw/zinc/61/04/79/353610479.db2.gz LPPMHACHUSLACO-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO F[C@H]1CC[N@H+](Cc2ccc3c(n2)CCC3)C1 ZINC000334519016 353658932 /nfs/dbraw/zinc/65/89/32/353658932.db2.gz NELLYYDNOXTIGF-NSHDSACASA-N 1 2 220.291 2.114 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2ccc3c(n2)CCC3)C1 ZINC000334519016 353658934 /nfs/dbraw/zinc/65/89/34/353658934.db2.gz NELLYYDNOXTIGF-NSHDSACASA-N 1 2 220.291 2.114 20 0 BEADLO Cc1c[nH+]c(C)nc1N1C[C@H](C)OC2(CCC2)C1 ZINC000577887534 366097897 /nfs/dbraw/zinc/09/78/97/366097897.db2.gz UZRQFYOJGKJZPY-NSHDSACASA-N 1 2 247.342 2.241 20 0 BEADLO C[C@H]([NH2+]Cc1c[nH]nn1)[C@@H]1CC2CCC1CC2 ZINC000398472251 363251026 /nfs/dbraw/zinc/25/10/26/363251026.db2.gz XOOMLSMTHYOKMK-YUVKLTJASA-N 1 2 234.347 2.109 20 0 BEADLO C[C@H]([NH2+]Cc1cn[nH]n1)[C@@H]1CC2CCC1CC2 ZINC000398472251 363251030 /nfs/dbraw/zinc/25/10/30/363251030.db2.gz XOOMLSMTHYOKMK-YUVKLTJASA-N 1 2 234.347 2.109 20 0 BEADLO Cc1cc(NC[C@@H]2CC[C@@H](O)C2)nc(C(C)C)[nH+]1 ZINC000232763963 353760754 /nfs/dbraw/zinc/76/07/54/353760754.db2.gz RDEQILBKHIMRNN-VXGBXAGGSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1cc(NC[C@@H]2CC[C@H](O)C2)nc(C(C)C)[nH+]1 ZINC000232764017 353761060 /nfs/dbraw/zinc/76/10/60/353761060.db2.gz RDEQILBKHIMRNN-NEPJUHHUSA-N 1 2 249.358 2.481 20 0 BEADLO COc1ccc(C[NH2+][C@H](C)c2nc(C)no2)cc1 ZINC000074071549 353742558 /nfs/dbraw/zinc/74/25/58/353742558.db2.gz WNMOQRVEJLNALX-SECBINFHSA-N 1 2 247.298 2.237 20 0 BEADLO Cc1noc([C@H](C)[NH2+]Cc2cccs2)n1 ZINC000074071792 353745613 /nfs/dbraw/zinc/74/56/13/353745613.db2.gz OKXOVTHYVSVVQO-ZETCQYMHSA-N 1 2 223.301 2.290 20 0 BEADLO Fc1cccnc1NCc1ccn2cc[nH+]c2c1 ZINC000357432660 181016164 /nfs/dbraw/zinc/01/61/64/181016164.db2.gz FDLKXMOLSYKFCD-UHFFFAOYSA-N 1 2 242.257 2.481 20 0 BEADLO CCOC(=O)C[N@@H+]1CCC[C@@H]1c1cccs1 ZINC000053096019 353814663 /nfs/dbraw/zinc/81/46/63/353814663.db2.gz OTLGJZISONTYKU-SNVBAGLBSA-N 1 2 239.340 2.448 20 0 BEADLO CCOC(=O)C[N@H+]1CCC[C@@H]1c1cccs1 ZINC000053096019 353814664 /nfs/dbraw/zinc/81/46/64/353814664.db2.gz OTLGJZISONTYKU-SNVBAGLBSA-N 1 2 239.340 2.448 20 0 BEADLO Fc1cncc(C[N@@H+]2CCC[C@@H]2c2cc[nH]n2)c1 ZINC000286041712 181019780 /nfs/dbraw/zinc/01/97/80/181019780.db2.gz IIQLZASCGICXES-CYBMUJFWSA-N 1 2 246.289 2.281 20 0 BEADLO Fc1cncc(C[N@H+]2CCC[C@@H]2c2cc[nH]n2)c1 ZINC000286041712 181019781 /nfs/dbraw/zinc/01/97/81/181019781.db2.gz IIQLZASCGICXES-CYBMUJFWSA-N 1 2 246.289 2.281 20 0 BEADLO O=C(NCCC1CC1)Nc1ccc2[nH+]ccn2c1 ZINC000608313995 353868150 /nfs/dbraw/zinc/86/81/50/353868150.db2.gz YHHNTRDYZGASOQ-UHFFFAOYSA-N 1 2 244.298 2.256 20 0 BEADLO CC[C@@H](C)[C@@H](C[NH2+]C1(C(F)F)CC1)OC ZINC000639139601 353856523 /nfs/dbraw/zinc/85/65/23/353856523.db2.gz MTYIWRKNRLAESC-RKDXNWHRSA-N 1 2 221.291 2.435 20 0 BEADLO C[C@@H]1OCC[C@]1(C)Nc1cc[nH+]c(C2CC2)n1 ZINC000343493148 353910657 /nfs/dbraw/zinc/91/06/57/353910657.db2.gz BDLQVAMKIGGMJQ-ZANVPECISA-N 1 2 233.315 2.333 20 0 BEADLO C[C@@H]1OCC[C@@]1(C)Nc1cc[nH+]c(C2CC2)n1 ZINC000343493147 353910854 /nfs/dbraw/zinc/91/08/54/353910854.db2.gz BDLQVAMKIGGMJQ-TVQRCGJNSA-N 1 2 233.315 2.333 20 0 BEADLO CO[C@H]1C[C@@H](Nc2cccc[nH+]2)C12CCC2 ZINC000334533976 353913326 /nfs/dbraw/zinc/91/33/26/353913326.db2.gz GKAPYFFBVWVFTL-MNOVXSKESA-N 1 2 218.300 2.451 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2CCSC[C@H](C)C2)no1 ZINC000334534800 353914663 /nfs/dbraw/zinc/91/46/63/353914663.db2.gz GISRIPNZNNIXRQ-BDAKNGLRSA-N 1 2 241.360 2.124 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2CCSC[C@H](C)C2)no1 ZINC000334534800 353914664 /nfs/dbraw/zinc/91/46/64/353914664.db2.gz GISRIPNZNNIXRQ-BDAKNGLRSA-N 1 2 241.360 2.124 20 0 BEADLO COc1ccncc1C[N@@H+]1CC[C@](C)(F)C1 ZINC000334536863 353924075 /nfs/dbraw/zinc/92/40/75/353924075.db2.gz BVSCTMJSLRUSNX-LBPRGKRZSA-N 1 2 224.279 2.024 20 0 BEADLO COc1ccncc1C[N@H+]1CC[C@](C)(F)C1 ZINC000334536863 353924077 /nfs/dbraw/zinc/92/40/77/353924077.db2.gz BVSCTMJSLRUSNX-LBPRGKRZSA-N 1 2 224.279 2.024 20 0 BEADLO CC1(CC(=O)N2CCC(n3cc[nH+]c3)CC2)CC1 ZINC000334539153 353927114 /nfs/dbraw/zinc/92/71/14/353927114.db2.gz QLNJDEVMGDLARQ-UHFFFAOYSA-N 1 2 247.342 2.237 20 0 BEADLO CC[C@H](C)[C@@H](CN1CC[N@@H+](CC)C[C@H]1C)OC ZINC000639161156 353942754 /nfs/dbraw/zinc/94/27/54/353942754.db2.gz WTMREEXTYHPEHN-BFHYXJOUSA-N 1 2 242.407 2.074 20 0 BEADLO c1cc(N2CCC[C@]23CCOC3)nc(C2CC2)[nH+]1 ZINC000343706871 353967633 /nfs/dbraw/zinc/96/76/33/353967633.db2.gz KRTGVJLUXBJQGU-CQSZACIVSA-N 1 2 245.326 2.113 20 0 BEADLO CC1=C[C@@H](C)C[N@H+](Cc2noc(C3CC3)n2)C1 ZINC000334551849 353992665 /nfs/dbraw/zinc/99/26/65/353992665.db2.gz YTVDNMLWABHZDA-SECBINFHSA-N 1 2 233.315 2.345 20 0 BEADLO CC1=C[C@@H](C)C[N@@H+](Cc2noc(C3CC3)n2)C1 ZINC000334551849 353992667 /nfs/dbraw/zinc/99/26/67/353992667.db2.gz YTVDNMLWABHZDA-SECBINFHSA-N 1 2 233.315 2.345 20 0 BEADLO CC(C)n1nccc1C[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000334554405 353998636 /nfs/dbraw/zinc/99/86/36/353998636.db2.gz PEPNPHZFYVWVHX-RYUDHWBXSA-N 1 2 237.347 2.073 20 0 BEADLO C[C@@](CO)(CNc1cccc[nH+]1)c1ccccc1 ZINC000343800133 354003847 /nfs/dbraw/zinc/00/38/47/354003847.db2.gz YCQOZNNMDISQCF-HNNXBMFYSA-N 1 2 242.322 2.444 20 0 BEADLO C[C@@H]1CC[C@H]1Nc1cc(N2CCCC2)nc[nH+]1 ZINC000343809355 354011066 /nfs/dbraw/zinc/01/10/66/354011066.db2.gz OJFCHBKIHOBZNS-GHMZBOCLSA-N 1 2 232.331 2.287 20 0 BEADLO C[C@@H]1CC[C@H]1Nc1cc(N2CCCC2)[nH+]cn1 ZINC000343809355 354011068 /nfs/dbraw/zinc/01/10/68/354011068.db2.gz OJFCHBKIHOBZNS-GHMZBOCLSA-N 1 2 232.331 2.287 20 0 BEADLO CCOC(=O)CCC[N@H+](CC(F)F)C(C)C ZINC000178565151 366140080 /nfs/dbraw/zinc/14/00/80/366140080.db2.gz ZOCPKRLLEJOQBG-UHFFFAOYSA-N 1 2 237.290 2.305 20 0 BEADLO CCOC(=O)CCC[N@@H+](CC(F)F)C(C)C ZINC000178565151 366140083 /nfs/dbraw/zinc/14/00/83/366140083.db2.gz ZOCPKRLLEJOQBG-UHFFFAOYSA-N 1 2 237.290 2.305 20 0 BEADLO Cc1cc(N[C@@H]2C[C@H]2C(F)F)nc(C2CC2)[nH+]1 ZINC000343822985 354015113 /nfs/dbraw/zinc/01/51/13/354015113.db2.gz AFAXHYOGDRELIW-RKDXNWHRSA-N 1 2 239.269 2.150 20 0 BEADLO COc1cncc(C[N@H+](C)Cc2ccoc2)c1 ZINC000343970298 354077520 /nfs/dbraw/zinc/07/75/20/354077520.db2.gz IIKWYMFRBKNMIZ-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1cncc(C[N@@H+](C)Cc2ccoc2)c1 ZINC000343970298 354077525 /nfs/dbraw/zinc/07/75/25/354077525.db2.gz IIKWYMFRBKNMIZ-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO Cc1cccc2c1CC[C@H]2[NH2+]CC(F)(F)CO ZINC000344099520 354119689 /nfs/dbraw/zinc/11/96/89/354119689.db2.gz FTHFFUCTIWINJN-GFCCVEGCSA-N 1 2 241.281 2.200 20 0 BEADLO CCC1CN(c2cc[nH+]c(C(C)C)n2)C1 ZINC000334577342 354119719 /nfs/dbraw/zinc/11/97/19/354119719.db2.gz MQHORPDJLVBPPS-UHFFFAOYSA-N 1 2 205.305 2.446 20 0 BEADLO COc1cc[nH+]cc1CSc1ncco1 ZINC000344160479 354167504 /nfs/dbraw/zinc/16/75/04/354167504.db2.gz FCSNGEGOCJUDGK-UHFFFAOYSA-N 1 2 222.269 2.371 20 0 BEADLO CC(C)(C)CC[N@@H+]1CCOCC(F)(F)C1 ZINC000344133837 354149665 /nfs/dbraw/zinc/14/96/65/354149665.db2.gz YKLZKRRCDIBQLT-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO CC(C)(C)CC[N@H+]1CCOCC(F)(F)C1 ZINC000344133837 354149669 /nfs/dbraw/zinc/14/96/69/354149669.db2.gz YKLZKRRCDIBQLT-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO CS[C@H]1CC[C@H](Nc2cc(C)[nH+]cn2)C1 ZINC000230917331 363328623 /nfs/dbraw/zinc/32/86/23/363328623.db2.gz PFRGQYBKCWOZOL-UWVGGRQHSA-N 1 2 223.345 2.481 20 0 BEADLO CCCN(CCC)C(=O)C(C)(C)c1c[nH+]c[nH]1 ZINC000344236376 354186205 /nfs/dbraw/zinc/18/62/05/354186205.db2.gz ZXKWSIUYDLINCO-UHFFFAOYSA-N 1 2 237.347 2.336 20 0 BEADLO Cc1cc(CNc2ccc(C)[nH+]c2)n(C)n1 ZINC000334597224 354231323 /nfs/dbraw/zinc/23/13/23/354231323.db2.gz IMSOIDUQUKRPKZ-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC(C)(C)[C@H]1C1CC1 ZINC000334608425 354315820 /nfs/dbraw/zinc/31/58/20/354315820.db2.gz UILMDEBDIIBFMS-GFCCVEGCSA-N 1 2 219.332 2.339 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC(C)(C)[C@H]1C1CC1 ZINC000334608425 354315821 /nfs/dbraw/zinc/31/58/21/354315821.db2.gz UILMDEBDIIBFMS-GFCCVEGCSA-N 1 2 219.332 2.339 20 0 BEADLO C[C@@H](O)[C@H](C)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000578007344 366176108 /nfs/dbraw/zinc/17/61/08/366176108.db2.gz LZAQZLSDDZGBON-WDEREUQCSA-N 1 2 231.299 2.054 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CCCc3occc3C2)[nH]1 ZINC000334641611 354397095 /nfs/dbraw/zinc/39/70/95/354397095.db2.gz CZXRCWLMVMXAQX-SECBINFHSA-N 1 2 246.314 2.216 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CCCc3occc3C2)[nH]1 ZINC000334641611 354397097 /nfs/dbraw/zinc/39/70/97/354397097.db2.gz CZXRCWLMVMXAQX-SECBINFHSA-N 1 2 246.314 2.216 20 0 BEADLO CC(C)(C)n1cc(C[NH+]2CC3(C2)CCCC3)nn1 ZINC000334646945 354436992 /nfs/dbraw/zinc/43/69/92/354436992.db2.gz SENTXBRWFKAIKY-UHFFFAOYSA-N 1 2 248.374 2.409 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCCc2nn(C)cc21)C(C)(F)F ZINC000334668908 354409490 /nfs/dbraw/zinc/40/94/90/354409490.db2.gz CZIGWBQILBWHHZ-WCBMZHEXSA-N 1 2 243.301 2.431 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CCC(F)(F)[C@H](C)C2)o1 ZINC000334669782 354410799 /nfs/dbraw/zinc/41/07/99/354410799.db2.gz WWAWCLKMGAQFPK-HTQZYQBOSA-N 1 2 245.273 2.416 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CCC(F)(F)[C@H](C)C2)o1 ZINC000334669782 354410802 /nfs/dbraw/zinc/41/08/02/354410802.db2.gz WWAWCLKMGAQFPK-HTQZYQBOSA-N 1 2 245.273 2.416 20 0 BEADLO C[C@H]1CCC[N@H+](Cc2nnc(C(C)(C)C)[nH]2)C1 ZINC000334677129 354421147 /nfs/dbraw/zinc/42/11/47/354421147.db2.gz QBBLUPUSTAWTJS-JTQLQIEISA-N 1 2 236.363 2.334 20 0 BEADLO C[C@H]1CCC[N@@H+](Cc2nnc(C(C)(C)C)[nH]2)C1 ZINC000334677129 354421150 /nfs/dbraw/zinc/42/11/50/354421150.db2.gz QBBLUPUSTAWTJS-JTQLQIEISA-N 1 2 236.363 2.334 20 0 BEADLO CC1=CCC[N@@H+]([C@@H](C)c2csnn2)C1 ZINC000334682736 354428585 /nfs/dbraw/zinc/42/85/85/354428585.db2.gz FIAPLNOBVUQCJN-VIFPVBQESA-N 1 2 209.318 2.251 20 0 BEADLO CC1=CCC[N@H+]([C@@H](C)c2csnn2)C1 ZINC000334682736 354428587 /nfs/dbraw/zinc/42/85/87/354428587.db2.gz FIAPLNOBVUQCJN-VIFPVBQESA-N 1 2 209.318 2.251 20 0 BEADLO Cc1nc(N2C[C@H](C3CC3)[C@H]2C2CC2)cc[nH+]1 ZINC000334683240 354429143 /nfs/dbraw/zinc/42/91/43/354429143.db2.gz IZFWYHBZZGEAOS-TZMCWYRMSA-N 1 2 229.327 2.410 20 0 BEADLO CC1(C(=O)Nc2c[nH+]c3n2CCCC3)CCC1 ZINC000334655701 354449450 /nfs/dbraw/zinc/44/94/50/354449450.db2.gz ZPVAEDBPJKROAH-UHFFFAOYSA-N 1 2 233.315 2.348 20 0 BEADLO FC(F)(F)[C@H]([NH2+]CCC[C@H]1CCO1)C1CC1 ZINC000639189368 354452191 /nfs/dbraw/zinc/45/21/91/354452191.db2.gz XVBRGMZYNSKNFW-VHSXEESVSA-N 1 2 237.265 2.486 20 0 BEADLO CC[C@@]1(C)COCC[N@@H+]1Cc1nc(C)cs1 ZINC000334659104 354455203 /nfs/dbraw/zinc/45/52/03/354455203.db2.gz WMKAFRITHYGCCS-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO CC[C@@]1(C)COCC[N@H+]1Cc1nc(C)cs1 ZINC000334659104 354455204 /nfs/dbraw/zinc/45/52/04/354455204.db2.gz WMKAFRITHYGCCS-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO c1nn[nH]c1C[N@@H+]1CCCC2(CCCCC2)C1 ZINC000334662588 354462462 /nfs/dbraw/zinc/46/24/62/354462462.db2.gz JLUAWQRLZLZZOW-UHFFFAOYSA-N 1 2 234.347 2.351 20 0 BEADLO c1nn[nH]c1C[N@H+]1CCCC2(CCCCC2)C1 ZINC000334662588 354462467 /nfs/dbraw/zinc/46/24/67/354462467.db2.gz JLUAWQRLZLZZOW-UHFFFAOYSA-N 1 2 234.347 2.351 20 0 BEADLO c1n[nH]nc1C[N@@H+]1CCCC2(CCCCC2)C1 ZINC000334662588 354462471 /nfs/dbraw/zinc/46/24/71/354462471.db2.gz JLUAWQRLZLZZOW-UHFFFAOYSA-N 1 2 234.347 2.351 20 0 BEADLO c1n[nH]nc1C[N@H+]1CCCC2(CCCCC2)C1 ZINC000334662588 354462474 /nfs/dbraw/zinc/46/24/74/354462474.db2.gz JLUAWQRLZLZZOW-UHFFFAOYSA-N 1 2 234.347 2.351 20 0 BEADLO CC(C)CC(=O)Nc1c[nH+]c2n1CCCC2 ZINC000334694802 354485547 /nfs/dbraw/zinc/48/55/47/354485547.db2.gz DPULOTGWBOKYRE-UHFFFAOYSA-N 1 2 221.304 2.204 20 0 BEADLO CC[C@]1(C)C[N@H+](Cc2ccncc2F)CCO1 ZINC000334734397 354534503 /nfs/dbraw/zinc/53/45/03/354534503.db2.gz COVRBRVHSXNMKE-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO CC[C@]1(C)C[N@@H+](Cc2ccncc2F)CCO1 ZINC000334734397 354534506 /nfs/dbraw/zinc/53/45/06/354534506.db2.gz COVRBRVHSXNMKE-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO CC(C)[C@@H]1C[N@H+](Cc2ccncc2F)CCO1 ZINC000334743063 354546102 /nfs/dbraw/zinc/54/61/02/354546102.db2.gz RFBHQPQGNQURTC-ZDUSSCGKSA-N 1 2 238.306 2.078 20 0 BEADLO CC(C)[C@@H]1C[N@@H+](Cc2ccncc2F)CCO1 ZINC000334743063 354546106 /nfs/dbraw/zinc/54/61/06/354546106.db2.gz RFBHQPQGNQURTC-ZDUSSCGKSA-N 1 2 238.306 2.078 20 0 BEADLO C[C@H]1C[C@H](NC(=O)c2ccsc2)c2[nH+]ccn21 ZINC000334740241 354543584 /nfs/dbraw/zinc/54/35/84/354543584.db2.gz HWPFPBOZWQMZMI-WPRPVWTQSA-N 1 2 247.323 2.380 20 0 BEADLO F[C@H]1CC[N@H+](Cc2ccncc2Cl)C1 ZINC000334700445 354492925 /nfs/dbraw/zinc/49/29/25/354492925.db2.gz IJIRLGACCYDMAY-VIFPVBQESA-N 1 2 214.671 2.279 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2ccncc2Cl)C1 ZINC000334700445 354492926 /nfs/dbraw/zinc/49/29/26/354492926.db2.gz IJIRLGACCYDMAY-VIFPVBQESA-N 1 2 214.671 2.279 20 0 BEADLO c1ccc(N2CCO[C@H](C3CCC3)C2)[nH+]c1 ZINC000334712830 354510679 /nfs/dbraw/zinc/51/06/79/354510679.db2.gz QVRMFDRSOUDOET-LBPRGKRZSA-N 1 2 218.300 2.087 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C1=CC[C@H](C)CC1 ZINC000334716372 354515610 /nfs/dbraw/zinc/51/56/10/354515610.db2.gz YKCWKDVAVLSCDZ-JTQLQIEISA-N 1 2 230.311 2.497 20 0 BEADLO CC[C@@]1(C)COCC[N@@H+]1Cc1ccc(F)cn1 ZINC000334720523 354520433 /nfs/dbraw/zinc/52/04/33/354520433.db2.gz BCRNVDFMCYXRFU-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO CC[C@@]1(C)COCC[N@H+]1Cc1ccc(F)cn1 ZINC000334720523 354520434 /nfs/dbraw/zinc/52/04/34/354520434.db2.gz BCRNVDFMCYXRFU-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO CC(C)c1nc(N[C@@H]2CS[C@@H](C)C2)cc[nH+]1 ZINC000334802715 354558401 /nfs/dbraw/zinc/55/84/01/354558401.db2.gz ADHAQDPTQKKAKU-UWVGGRQHSA-N 1 2 237.372 2.328 20 0 BEADLO C[C@@H]1CCCN(C(=O)[C@H]2CCCc3[nH+]c[nH]c32)C1 ZINC000334761992 354582161 /nfs/dbraw/zinc/58/21/61/354582161.db2.gz DAHLBGUJISTYFA-MNOVXSKESA-N 1 2 247.342 2.088 20 0 BEADLO C[C@@]1(C(=O)Nc2cccc3[nH+]ccn32)C[C@H]1F ZINC000335094783 354632834 /nfs/dbraw/zinc/63/28/34/354632834.db2.gz KNBQAPABADCGSG-PRHODGIISA-N 1 2 233.246 2.021 20 0 BEADLO C[C@@H]1CCC[N@H+](Cc2nc(C(F)F)no2)C1 ZINC000335098512 354638837 /nfs/dbraw/zinc/63/88/37/354638837.db2.gz GCGVBWWVVQXBSB-SSDOTTSWSA-N 1 2 231.246 2.239 20 0 BEADLO C[C@@H]1CCC[N@@H+](Cc2nc(C(F)F)no2)C1 ZINC000335098512 354638839 /nfs/dbraw/zinc/63/88/39/354638839.db2.gz GCGVBWWVVQXBSB-SSDOTTSWSA-N 1 2 231.246 2.239 20 0 BEADLO C[C@H]1CCC[C@@H](CC(=O)NCCn2cc[nH+]c2)C1 ZINC000345368104 354638920 /nfs/dbraw/zinc/63/89/20/354638920.db2.gz ATECQULQLKYVNA-QWHCGFSZSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@H]1CCC[N@H+](Cc2nc(C(F)F)no2)C1 ZINC000335098513 354639145 /nfs/dbraw/zinc/63/91/45/354639145.db2.gz GCGVBWWVVQXBSB-ZETCQYMHSA-N 1 2 231.246 2.239 20 0 BEADLO C[C@H]1CCC[N@@H+](Cc2nc(C(F)F)no2)C1 ZINC000335098513 354639149 /nfs/dbraw/zinc/63/91/49/354639149.db2.gz GCGVBWWVVQXBSB-ZETCQYMHSA-N 1 2 231.246 2.239 20 0 BEADLO CC1(CSc2[nH+]cc3ccccn32)COC1 ZINC000345451307 354657958 /nfs/dbraw/zinc/65/79/58/354657958.db2.gz YSEYWPVCWAELQZ-UHFFFAOYSA-N 1 2 234.324 2.463 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1CCCC[C@@H]1C ZINC000335105581 354690371 /nfs/dbraw/zinc/69/03/71/354690371.db2.gz VPTNXERHVHXQDQ-GXSJLCMTSA-N 1 2 235.331 2.161 20 0 BEADLO CC(F)(F)C[NH2+]Cc1cccc(F)c1N ZINC000639208162 354705013 /nfs/dbraw/zinc/70/50/13/354705013.db2.gz PBFPJZVVDAIBHP-UHFFFAOYSA-N 1 2 218.222 2.153 20 0 BEADLO C[C@@H]1[C@@H](C)CC[N@@H+]1Cc1nc(C(F)F)no1 ZINC000335100385 354709300 /nfs/dbraw/zinc/70/93/00/354709300.db2.gz SLVWBUFCTZFBSW-NKWVEPMBSA-N 1 2 231.246 2.238 20 0 BEADLO C[C@@H]1[C@@H](C)CC[N@H+]1Cc1nc(C(F)F)no1 ZINC000335100385 354709303 /nfs/dbraw/zinc/70/93/03/354709303.db2.gz SLVWBUFCTZFBSW-NKWVEPMBSA-N 1 2 231.246 2.238 20 0 BEADLO Cc1ccc(F)cc1NC(=O)CCc1[nH]cc[nH+]1 ZINC000345629551 354718464 /nfs/dbraw/zinc/71/84/64/354718464.db2.gz NPPGFKNTSSJJRV-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO CC(C)(C(=O)NCc1cccs1)c1c[nH]c[nH+]1 ZINC000345632285 354719455 /nfs/dbraw/zinc/71/94/55/354719455.db2.gz AGFUHQYRXREYIE-UHFFFAOYSA-N 1 2 249.339 2.065 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)c1ncnc2sccc21 ZINC000345639968 354721880 /nfs/dbraw/zinc/72/18/80/354721880.db2.gz CUAVMJGVWCCZOP-UHFFFAOYSA-N 1 2 245.311 2.051 20 0 BEADLO CC1(C)CCC[N@@H+]1Cc1nc(C(F)F)no1 ZINC000335118672 354723772 /nfs/dbraw/zinc/72/37/72/354723772.db2.gz JRGDCKYSIOOFLM-UHFFFAOYSA-N 1 2 231.246 2.382 20 0 BEADLO CC1(C)CCC[N@H+]1Cc1nc(C(F)F)no1 ZINC000335118672 354723775 /nfs/dbraw/zinc/72/37/75/354723775.db2.gz JRGDCKYSIOOFLM-UHFFFAOYSA-N 1 2 231.246 2.382 20 0 BEADLO CO[C@@H](C[NH2+]CC(C)(F)F)Cc1ccccc1 ZINC000639206651 354681388 /nfs/dbraw/zinc/68/13/88/354681388.db2.gz BOGNQMKCRKVMPG-GFCCVEGCSA-N 1 2 243.297 2.489 20 0 BEADLO CC(C)OCCC[N@@H+]1CCC(F)(F)C1 ZINC000345823596 354790806 /nfs/dbraw/zinc/79/08/06/354790806.db2.gz BUJXEAUYDRKLGQ-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO CC(C)OCCC[N@H+]1CCC(F)(F)C1 ZINC000345823596 354790810 /nfs/dbraw/zinc/79/08/10/354790810.db2.gz BUJXEAUYDRKLGQ-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@]3(CCCO3)[C@H]2C2CC2)on1 ZINC000639212433 354775840 /nfs/dbraw/zinc/77/58/40/354775840.db2.gz DOOUHAMJIODJOT-ZIAGYGMSSA-N 1 2 248.326 2.126 20 0 BEADLO Cc1cc(C[N@H+]2C[C@]3(CCCO3)[C@H]2C2CC2)on1 ZINC000639212433 354775842 /nfs/dbraw/zinc/77/58/42/354775842.db2.gz DOOUHAMJIODJOT-ZIAGYGMSSA-N 1 2 248.326 2.126 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@]3(CCCO3)[C@@H]2C2CC2)on1 ZINC000639212423 354775845 /nfs/dbraw/zinc/77/58/45/354775845.db2.gz DOOUHAMJIODJOT-KBPBESRZSA-N 1 2 248.326 2.126 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@]3(CCCO3)[C@@H]2C2CC2)on1 ZINC000639212423 354775847 /nfs/dbraw/zinc/77/58/47/354775847.db2.gz DOOUHAMJIODJOT-KBPBESRZSA-N 1 2 248.326 2.126 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)CC2CCC2)c2[nH+]ccn21 ZINC000335141165 354845437 /nfs/dbraw/zinc/84/54/37/354845437.db2.gz OZLUBJGRRRDKJF-KOLCDFICSA-N 1 2 233.315 2.195 20 0 BEADLO FC(F)(F)C1=CC[N@H+](Cc2cnccn2)CC1 ZINC000335145382 354854655 /nfs/dbraw/zinc/85/46/55/354854655.db2.gz BPDCDOIXLFIQJH-UHFFFAOYSA-N 1 2 243.232 2.171 20 0 BEADLO FC(F)(F)C1=CC[N@@H+](Cc2cnccn2)CC1 ZINC000335145382 354854659 /nfs/dbraw/zinc/85/46/59/354854659.db2.gz BPDCDOIXLFIQJH-UHFFFAOYSA-N 1 2 243.232 2.171 20 0 BEADLO C[N@@H+](Cc1csnn1)C[C@H]1CC=CCC1 ZINC000346334067 354899171 /nfs/dbraw/zinc/89/91/71/354899171.db2.gz NGDOPLFBHJDEDV-JTQLQIEISA-N 1 2 223.345 2.326 20 0 BEADLO C[N@H+](Cc1csnn1)C[C@H]1CC=CCC1 ZINC000346334067 354899174 /nfs/dbraw/zinc/89/91/74/354899174.db2.gz NGDOPLFBHJDEDV-JTQLQIEISA-N 1 2 223.345 2.326 20 0 BEADLO Cc1cc(N2CCC[C@H]2C2CCOCC2)nc[nH+]1 ZINC000346255303 354881832 /nfs/dbraw/zinc/88/18/32/354881832.db2.gz CJTGSJYCYLXCQL-ZDUSSCGKSA-N 1 2 247.342 2.180 20 0 BEADLO CC(C)c1nc(N[C@H](C)[C@@H]2CCCCO2)cc[nH+]1 ZINC000346464862 354953724 /nfs/dbraw/zinc/95/37/24/354953724.db2.gz UKTHPNNEQFIJHG-NEPJUHHUSA-N 1 2 249.358 2.391 20 0 BEADLO C[C@H](c1cnn(C)c1)[N@H+](C)Cc1ccc(F)cn1 ZINC000346505564 354962394 /nfs/dbraw/zinc/96/23/94/354962394.db2.gz SHLLIUWGKGBTCT-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO C[C@H](c1cnn(C)c1)[N@@H+](C)Cc1ccc(F)cn1 ZINC000346505564 354962397 /nfs/dbraw/zinc/96/23/97/354962397.db2.gz SHLLIUWGKGBTCT-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO COc1cccnc1C[NH2+]Cc1ccc(C)cn1 ZINC000449750062 202021476 /nfs/dbraw/zinc/02/14/76/202021476.db2.gz SBPFRPIUSWRYMZ-UHFFFAOYSA-N 1 2 243.310 2.083 20 0 BEADLO Cn1c(CCn2cc[nH+]c2)nc2ccccc21 ZINC000346619569 354994697 /nfs/dbraw/zinc/99/46/97/354994697.db2.gz LKCWQMPQJQNTBV-UHFFFAOYSA-N 1 2 226.283 2.013 20 0 BEADLO FC1(F)CC[N@H+](CCC2CCOCC2)C1 ZINC000335188903 355020354 /nfs/dbraw/zinc/02/03/54/355020354.db2.gz GJSUUDLENJPVFJ-UHFFFAOYSA-N 1 2 219.275 2.144 20 0 BEADLO FC1(F)CC[N@@H+](CCC2CCOCC2)C1 ZINC000335188903 355020360 /nfs/dbraw/zinc/02/03/60/355020360.db2.gz GJSUUDLENJPVFJ-UHFFFAOYSA-N 1 2 219.275 2.144 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)C1=CCCCCC1 ZINC000335183501 355082001 /nfs/dbraw/zinc/08/20/01/355082001.db2.gz XQAOOXLJORXMEK-UHFFFAOYSA-N 1 2 247.342 2.269 20 0 BEADLO Cc1[nH]c(C(=O)NC2CC(C(C)(C)C)C2)c[nH+]1 ZINC000335973509 134030438 /nfs/dbraw/zinc/03/04/38/134030438.db2.gz ZHBCGPOMURBFFJ-UHFFFAOYSA-N 1 2 235.331 2.273 20 0 BEADLO Cc1cc(NC(=O)[C@H](C)C2CCC2)cc[nH+]1 ZINC000335222547 355063535 /nfs/dbraw/zinc/06/35/35/355063535.db2.gz IIMFQIJGXBBZNW-SNVBAGLBSA-N 1 2 218.300 2.187 20 0 BEADLO CCN(CC)C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000335186040 355084555 /nfs/dbraw/zinc/08/45/55/355084555.db2.gz YPIRKXXDLTUINO-SNVBAGLBSA-N 1 2 236.319 2.008 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1ccc(C)nc1 ZINC000346720116 355104322 /nfs/dbraw/zinc/10/43/22/355104322.db2.gz LMMNGBHOJXKYSQ-UHFFFAOYSA-N 1 2 243.266 2.046 20 0 BEADLO C[C@@H]1[C@@H](CO)CCCN1c1[nH]c2ccccc2[nH+]1 ZINC000335233692 355094506 /nfs/dbraw/zinc/09/45/06/355094506.db2.gz RWLNQVPUMFCEMO-GHMZBOCLSA-N 1 2 245.326 2.160 20 0 BEADLO C[C@H](C1CC1)N(C)C(=O)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000335234830 355095393 /nfs/dbraw/zinc/09/53/93/355095393.db2.gz LSCHUVRZKAMZSI-MWLCHTKSSA-N 1 2 247.342 2.087 20 0 BEADLO COc1cccc(OC)c1C[N@@H+]1CC[C@@H](F)C1 ZINC000639229634 355132721 /nfs/dbraw/zinc/13/27/21/355132721.db2.gz WMKKSASNKQOVCY-SNVBAGLBSA-N 1 2 239.290 2.248 20 0 BEADLO COc1cccc(OC)c1C[N@H+]1CC[C@@H](F)C1 ZINC000639229634 355132722 /nfs/dbraw/zinc/13/27/22/355132722.db2.gz WMKKSASNKQOVCY-SNVBAGLBSA-N 1 2 239.290 2.248 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc(F)cn2)[C@H](C)[C@H](C)O1 ZINC000346971235 355207613 /nfs/dbraw/zinc/20/76/13/355207613.db2.gz GNEDWXOCGMNKMK-MXWKQRLJSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc(F)cn2)[C@H](C)[C@H](C)O1 ZINC000346971235 355207614 /nfs/dbraw/zinc/20/76/14/355207614.db2.gz GNEDWXOCGMNKMK-MXWKQRLJSA-N 1 2 238.306 2.218 20 0 BEADLO CN(CC1CCC1)c1cc(NC2CC2)[nH+]cn1 ZINC000413146136 191359582 /nfs/dbraw/zinc/35/95/82/191359582.db2.gz OSAZIFHVDVVINA-UHFFFAOYSA-N 1 2 232.331 2.287 20 0 BEADLO CN(CC1CCC1)c1cc(NC2CC2)nc[nH+]1 ZINC000413146136 191359584 /nfs/dbraw/zinc/35/95/84/191359584.db2.gz OSAZIFHVDVVINA-UHFFFAOYSA-N 1 2 232.331 2.287 20 0 BEADLO Cc1[nH+]c2ccccn2c1CSCCCO ZINC000413020271 191341809 /nfs/dbraw/zinc/34/18/09/191341809.db2.gz WZFZADIPTMNULK-UHFFFAOYSA-N 1 2 236.340 2.258 20 0 BEADLO COC(=O)C(C)(C)[NH2+]C[C@@H]1C[C@@H]1c1ccccc1 ZINC000347630181 355240709 /nfs/dbraw/zinc/24/07/09/355240709.db2.gz IANOEQDQKVGQGJ-QWHCGFSZSA-N 1 2 247.338 2.331 20 0 BEADLO C[C@H]1CCCCN1c1cc(NC2CC2)[nH+]cn1 ZINC000413022750 191343504 /nfs/dbraw/zinc/34/35/04/191343504.db2.gz FWOIYADXNJJUAK-JTQLQIEISA-N 1 2 232.331 2.430 20 0 BEADLO C[C@H]1CCCCN1c1cc(NC2CC2)nc[nH+]1 ZINC000413022750 191343506 /nfs/dbraw/zinc/34/35/06/191343506.db2.gz FWOIYADXNJJUAK-JTQLQIEISA-N 1 2 232.331 2.430 20 0 BEADLO C[C@@H]1CN(c2cc(NC3CC3)[nH+]cn2)C[C@H]1C ZINC000413170814 191361133 /nfs/dbraw/zinc/36/11/33/191361133.db2.gz OCVDUUCWEJFLPV-NXEZZACHSA-N 1 2 232.331 2.143 20 0 BEADLO C[C@@H]1CN(c2cc(NC3CC3)nc[nH+]2)C[C@H]1C ZINC000413170814 191361136 /nfs/dbraw/zinc/36/11/36/191361136.db2.gz OCVDUUCWEJFLPV-NXEZZACHSA-N 1 2 232.331 2.143 20 0 BEADLO CN(C)c1ccc(NCc2cncs2)[nH+]c1 ZINC000124577103 324619615 /nfs/dbraw/zinc/61/96/15/324619615.db2.gz CNCUHORKZMKNEK-UHFFFAOYSA-N 1 2 234.328 2.216 20 0 BEADLO C[C@H]1C[C@H]1CNc1cc(NC2CC2)nc[nH+]1 ZINC000413055405 191351809 /nfs/dbraw/zinc/35/18/09/191351809.db2.gz QUZYLLHYJOYJJV-IUCAKERBSA-N 1 2 218.304 2.119 20 0 BEADLO C[C@H]1C[C@H]1CNc1cc(NC2CC2)[nH+]cn1 ZINC000413055405 191351812 /nfs/dbraw/zinc/35/18/12/191351812.db2.gz QUZYLLHYJOYJJV-IUCAKERBSA-N 1 2 218.304 2.119 20 0 BEADLO CO[C@@H]1COC[C@@H]1Nc1ccc2ccccc2[nH+]1 ZINC000413459635 191382441 /nfs/dbraw/zinc/38/24/41/191382441.db2.gz NHNDXCDWSBUYRK-QWHCGFSZSA-N 1 2 244.294 2.061 20 0 BEADLO CO[C@H]1C[C@H](Nc2cc(C)[nH+]cn2)C12CCC2 ZINC000413446157 191384849 /nfs/dbraw/zinc/38/48/49/191384849.db2.gz PHORKNYGMOMJPU-QWRGUYRKSA-N 1 2 233.315 2.155 20 0 BEADLO Cc1cc(NC[C@H]2CCC[C@@H]2C2CC2)nc[nH+]1 ZINC000413483497 191387607 /nfs/dbraw/zinc/38/76/07/191387607.db2.gz RLXBMDOXBFHRKN-CHWSQXEVSA-N 1 2 231.343 2.445 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2nncn2C)cc1C ZINC000347680799 355266128 /nfs/dbraw/zinc/26/61/28/355266128.db2.gz XTUZQLGRUBQXSX-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2nncn2C)cc1C ZINC000347680799 355266130 /nfs/dbraw/zinc/26/61/30/355266130.db2.gz XTUZQLGRUBQXSX-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO CO[C@](C)([C@H](C)Nc1cc(C)[nH+]cn1)C1CC1 ZINC000413524979 191393343 /nfs/dbraw/zinc/39/33/43/191393343.db2.gz XKLTWNPHMJDCIA-GXFFZTMASA-N 1 2 235.331 2.401 20 0 BEADLO Cc1ccc(CCNc2cncc(C)n2)[nH+]c1 ZINC000413351639 191373970 /nfs/dbraw/zinc/37/39/70/191373970.db2.gz LVNNOQJHETZTHS-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO Cc1cc(NC[C@@H]2CC[C@H](C)O2)nc(C2CC2)[nH+]1 ZINC000413377054 191376939 /nfs/dbraw/zinc/37/69/39/191376939.db2.gz NVNACOMCUJBZCN-JQWIXIFHSA-N 1 2 247.342 2.064 20 0 BEADLO CC(C)c1nc(NC[C@H]2CC[C@H](C)O2)cc[nH+]1 ZINC000413379422 191377107 /nfs/dbraw/zinc/37/71/07/191377107.db2.gz RMHMJENGRPGKEM-WDEREUQCSA-N 1 2 235.331 2.001 20 0 BEADLO C[C@H]1CC[C@H](CNc2cc[nH+]c3ccncc23)O1 ZINC000413370857 191377593 /nfs/dbraw/zinc/37/75/93/191377593.db2.gz DGNHBBLETUFKBB-WDEREUQCSA-N 1 2 243.310 2.031 20 0 BEADLO CCO[C@H]1C[C@@H](Nc2cc[nH+]c3ccncc23)C1 ZINC000413390540 191379219 /nfs/dbraw/zinc/37/92/19/191379219.db2.gz YIESQEYLKYLAPU-PHIMTYICSA-N 1 2 243.310 2.031 20 0 BEADLO COC1CCC(Nc2cc[nH+]c(C)n2)CC1 ZINC000413425038 191379381 /nfs/dbraw/zinc/37/93/81/191379381.db2.gz YGLWAFVFCXAIPI-UHFFFAOYSA-N 1 2 221.304 2.155 20 0 BEADLO CO[C@H]1C[C@H](Nc2cc[nH+]c(C)n2)C12CCC2 ZINC000413435304 191380287 /nfs/dbraw/zinc/38/02/87/191380287.db2.gz FNFXCIINDVGTCO-QWRGUYRKSA-N 1 2 233.315 2.155 20 0 BEADLO c1cc(N[C@H]2CCC[C@@H]3C[C@@H]32)nc(C2CC2)[nH+]1 ZINC000413459430 191381357 /nfs/dbraw/zinc/38/13/57/191381357.db2.gz NDVAQBTUQWQXOG-WOPDTQHZSA-N 1 2 229.327 2.376 20 0 BEADLO CCSc1cccc(C[NH+]2CC(C)(O)C2)c1 ZINC000639253791 355293017 /nfs/dbraw/zinc/29/30/17/355293017.db2.gz RAHZTAHGEOLEHL-UHFFFAOYSA-N 1 2 237.368 2.365 20 0 BEADLO CC(C)c1nc(N2CCC[C@@H](CO)[C@@H]2C)cc[nH+]1 ZINC000413599834 191399405 /nfs/dbraw/zinc/39/94/05/191399405.db2.gz XKAXXVPRAOSCGP-RYUDHWBXSA-N 1 2 249.358 2.197 20 0 BEADLO CCn1ncnc1C[NH+]1CC(C2CCCCC2)C1 ZINC000639250924 355281908 /nfs/dbraw/zinc/28/19/08/355281908.db2.gz ZGXSTNHJEPNTFB-UHFFFAOYSA-N 1 2 248.374 2.310 20 0 BEADLO CCOC1C[NH+](Cc2ccc(C(F)F)nc2)C1 ZINC000639250239 355282770 /nfs/dbraw/zinc/28/27/70/355282770.db2.gz MGKDEYXAPDDLCR-UHFFFAOYSA-N 1 2 242.269 2.240 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC[C@H](C(F)(F)F)[C@H]1C ZINC000335740262 355389799 /nfs/dbraw/zinc/38/97/99/355389799.db2.gz ZUMFRCZMTLLBNK-SCZZXKLOSA-N 1 2 247.264 2.491 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC[C@H](C(F)(F)F)[C@H]1C ZINC000335740262 355389804 /nfs/dbraw/zinc/38/98/04/355389804.db2.gz ZUMFRCZMTLLBNK-SCZZXKLOSA-N 1 2 247.264 2.491 20 0 BEADLO Cc1noc(-c2cccc(Cn3cc[nH+]c3)c2)n1 ZINC000349769303 355447502 /nfs/dbraw/zinc/44/75/02/355447502.db2.gz FLYQWWIKEORYFZ-UHFFFAOYSA-N 1 2 240.266 2.290 20 0 BEADLO CC(=O)c1cc(NCc2[nH+]ccn2C)ccc1F ZINC000349732434 355425252 /nfs/dbraw/zinc/42/52/52/355425252.db2.gz PDLLNVNNCYUCER-UHFFFAOYSA-N 1 2 247.273 2.374 20 0 BEADLO Cc1nnc(C[N@@H+](C)[C@@H]2CC2(C)C)s1 ZINC000335786558 355436313 /nfs/dbraw/zinc/43/63/13/355436313.db2.gz YZSAFLMPTXCCHB-MRVPVSSYSA-N 1 2 211.334 2.077 20 0 BEADLO Cc1nnc(C[N@H+](C)[C@@H]2CC2(C)C)s1 ZINC000335786558 355436316 /nfs/dbraw/zinc/43/63/16/355436316.db2.gz YZSAFLMPTXCCHB-MRVPVSSYSA-N 1 2 211.334 2.077 20 0 BEADLO CCn1cc([C@H](C)[NH2+][C@H](C)c2ccon2)cn1 ZINC000349833794 355488854 /nfs/dbraw/zinc/48/88/54/355488854.db2.gz LSHSUJZLSMTJNB-VHSXEESVSA-N 1 2 234.303 2.303 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@H]3CCCC[C@@H]32)n[nH]1 ZINC000335817435 355508124 /nfs/dbraw/zinc/50/81/24/355508124.db2.gz ITUTZXMERMZUDH-NEPJUHHUSA-N 1 2 234.347 2.268 20 0 BEADLO C[NH2+]Cc1noc([C@H]2C[C@@H]2c2sccc2C)n1 ZINC000349873123 355514147 /nfs/dbraw/zinc/51/41/47/355514147.db2.gz DDYALNFOEJLPOJ-IUCAKERBSA-N 1 2 249.339 2.430 20 0 BEADLO C[NH2+]Cc1noc(C[C@@H](C)c2cccc(F)c2)n1 ZINC000349878337 355515847 /nfs/dbraw/zinc/51/58/47/355515847.db2.gz ITSSRIUCYFQCHV-SECBINFHSA-N 1 2 249.289 2.274 20 0 BEADLO C[NH2+]Cc1noc(C/C=C/c2ccc(C)cc2)n1 ZINC000349882743 355517809 /nfs/dbraw/zinc/51/78/09/355517809.db2.gz NGZFNMAGWCRFBV-ONEGZZNKSA-N 1 2 243.310 2.353 20 0 BEADLO C[NH2+]Cc1noc([C@@H](C)c2cccc(F)c2)n1 ZINC000349914672 355525691 /nfs/dbraw/zinc/52/56/91/355525691.db2.gz UKMRYBKWQSYSIU-QMMMGPOBSA-N 1 2 235.262 2.080 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccns2)[C@H](C)CO1 ZINC000639296796 355582380 /nfs/dbraw/zinc/58/23/80/355582380.db2.gz PVXFSPFSUFFNPF-NXEZZACHSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccns2)[C@H](C)CO1 ZINC000639296796 355582382 /nfs/dbraw/zinc/58/23/82/355582382.db2.gz PVXFSPFSUFFNPF-NXEZZACHSA-N 1 2 226.345 2.142 20 0 BEADLO Cc1ccnc(C[N@@H+](C)[C@@H]2CC2(C)C)n1 ZINC000335848622 355593028 /nfs/dbraw/zinc/59/30/28/355593028.db2.gz YLIXABQBUQHIDZ-SNVBAGLBSA-N 1 2 205.305 2.015 20 0 BEADLO Cc1ccnc(C[N@H+](C)[C@@H]2CC2(C)C)n1 ZINC000335848622 355593030 /nfs/dbraw/zinc/59/30/30/355593030.db2.gz YLIXABQBUQHIDZ-SNVBAGLBSA-N 1 2 205.305 2.015 20 0 BEADLO CCc1cc[nH+]cc1N[C@@H](COC)C1CC1 ZINC000639297205 355602629 /nfs/dbraw/zinc/60/26/29/355602629.db2.gz ZZYVLINGNPZWAQ-ZDUSSCGKSA-N 1 2 220.316 2.481 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cn(C)nn2)cc1C ZINC000449762778 202026024 /nfs/dbraw/zinc/02/60/24/202026024.db2.gz LIBFNJIEWGMVFB-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cn(C)nn2)cc1C ZINC000449762778 202026026 /nfs/dbraw/zinc/02/60/26/202026026.db2.gz LIBFNJIEWGMVFB-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO CCc1nocc1C[N@H+]1C[C@H](C)OC[C@@H]1CC ZINC000350240533 355654473 /nfs/dbraw/zinc/65/44/73/355654473.db2.gz LYLQYJIJTUJHII-JQWIXIFHSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1nocc1C[N@@H+]1C[C@H](C)OC[C@@H]1CC ZINC000350240533 355654475 /nfs/dbraw/zinc/65/44/75/355654475.db2.gz LYLQYJIJTUJHII-JQWIXIFHSA-N 1 2 238.331 2.236 20 0 BEADLO F[C@@H]1CCC[N@H+](Cc2cc(C3CC3)no2)C1 ZINC000639311837 355671639 /nfs/dbraw/zinc/67/16/39/355671639.db2.gz FDMAKFPINYSROO-SNVBAGLBSA-N 1 2 224.279 2.486 20 0 BEADLO F[C@@H]1CCC[N@@H+](Cc2cc(C3CC3)no2)C1 ZINC000639311837 355671644 /nfs/dbraw/zinc/67/16/44/355671644.db2.gz FDMAKFPINYSROO-SNVBAGLBSA-N 1 2 224.279 2.486 20 0 BEADLO Cc1noc(C[N@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)n1 ZINC000336006189 134048776 /nfs/dbraw/zinc/04/87/76/134048776.db2.gz NKYDBNVROIDYBL-XPUUQOCRSA-N 1 2 249.236 2.151 20 0 BEADLO Cc1noc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)n1 ZINC000336006189 134048777 /nfs/dbraw/zinc/04/87/77/134048777.db2.gz NKYDBNVROIDYBL-XPUUQOCRSA-N 1 2 249.236 2.151 20 0 BEADLO CC1(C)C[N@H+](Cc2c[nH]cn2)CC2(CCCC2)O1 ZINC000191226850 355709890 /nfs/dbraw/zinc/70/98/90/355709890.db2.gz KFAMKDFWQPRJDI-UHFFFAOYSA-N 1 2 249.358 2.333 20 0 BEADLO CC1(C)C[N@@H+](Cc2c[nH]cn2)CC2(CCCC2)O1 ZINC000191226850 355709893 /nfs/dbraw/zinc/70/98/93/355709893.db2.gz KFAMKDFWQPRJDI-UHFFFAOYSA-N 1 2 249.358 2.333 20 0 BEADLO CC1(C)C[N@H+](Cc2cnc[nH]2)CC2(CCCC2)O1 ZINC000191226850 355709895 /nfs/dbraw/zinc/70/98/95/355709895.db2.gz KFAMKDFWQPRJDI-UHFFFAOYSA-N 1 2 249.358 2.333 20 0 BEADLO CC1(C)C[N@@H+](Cc2cnc[nH]2)CC2(CCCC2)O1 ZINC000191226850 355709898 /nfs/dbraw/zinc/70/98/98/355709898.db2.gz KFAMKDFWQPRJDI-UHFFFAOYSA-N 1 2 249.358 2.333 20 0 BEADLO Cc1ncsc1C[N@@H+]1CCO[C@@H](C2CC2)C1 ZINC000336009265 134050121 /nfs/dbraw/zinc/05/01/21/134050121.db2.gz ZVXYNEGTWALEHF-LLVKDONJSA-N 1 2 238.356 2.062 20 0 BEADLO Cc1ncsc1C[N@H+]1CCO[C@@H](C2CC2)C1 ZINC000336009265 134050122 /nfs/dbraw/zinc/05/01/22/134050122.db2.gz ZVXYNEGTWALEHF-LLVKDONJSA-N 1 2 238.356 2.062 20 0 BEADLO Cc1cc(C)c(NC(=O)[C@@H]2CO[C@@H](C)C2)c(C)[nH+]1 ZINC000335884509 355675037 /nfs/dbraw/zinc/67/50/37/355675037.db2.gz ROTUBZNTNCVIJK-JQWIXIFHSA-N 1 2 248.326 2.370 20 0 BEADLO COCc1cc[nH+]c(NCc2ccns2)c1 ZINC000639313133 355684620 /nfs/dbraw/zinc/68/46/20/355684620.db2.gz NWPNSKLEBKCERP-UHFFFAOYSA-N 1 2 235.312 2.297 20 0 BEADLO COc1ccc(NCc2cncs2)[nH+]c1 ZINC000225895177 491084501 /nfs/dbraw/zinc/08/45/01/491084501.db2.gz FRSZWYPCSAFZCL-UHFFFAOYSA-N 1 2 221.285 2.159 20 0 BEADLO CCc1cnc(C[N@@H+]2CCSC[C@H]2C)o1 ZINC000608497487 355824342 /nfs/dbraw/zinc/82/43/42/355824342.db2.gz KNFUHUROQUGLMF-SECBINFHSA-N 1 2 226.345 2.174 20 0 BEADLO CCc1cnc(C[N@H+]2CCSC[C@H]2C)o1 ZINC000608497487 355824346 /nfs/dbraw/zinc/82/43/46/355824346.db2.gz KNFUHUROQUGLMF-SECBINFHSA-N 1 2 226.345 2.174 20 0 BEADLO CCn1nccc1C[NH2+]Cc1cc(C2CC2)no1 ZINC000639339179 355781096 /nfs/dbraw/zinc/78/10/96/355781096.db2.gz ZNDWDKIFDJDNSA-UHFFFAOYSA-N 1 2 246.314 2.058 20 0 BEADLO c1[nH]nnc1C[NH2+]C1CCC(=C2CCC2)CC1 ZINC000639342227 355785045 /nfs/dbraw/zinc/78/50/45/355785045.db2.gz SUYNFLJLABLCPN-UHFFFAOYSA-N 1 2 232.331 2.317 20 0 BEADLO c1n[nH]nc1C[NH2+]C1CCC(=C2CCC2)CC1 ZINC000639342227 355785047 /nfs/dbraw/zinc/78/50/47/355785047.db2.gz SUYNFLJLABLCPN-UHFFFAOYSA-N 1 2 232.331 2.317 20 0 BEADLO CC1(C)CC[C@H](C(=O)N2CCn3c[nH+]cc3C2)C1 ZINC000336024915 134056891 /nfs/dbraw/zinc/05/68/91/134056891.db2.gz GZYOQRIQSLSZHS-NSHDSACASA-N 1 2 247.342 2.052 20 0 BEADLO Cc1ncc([C@@H](C)[NH+]2CC3(C2)CCCO3)c(C)n1 ZINC000639347440 355794251 /nfs/dbraw/zinc/79/42/51/355794251.db2.gz NDBNFJSDYBGOFW-LLVKDONJSA-N 1 2 247.342 2.019 20 0 BEADLO CN(C)c1c[nH+]cc(N[C@H]2CO[C@@H](C3CC3)C2)c1 ZINC000639362938 355819928 /nfs/dbraw/zinc/81/99/28/355819928.db2.gz MXOBPJBWSZZBGH-TZMCWYRMSA-N 1 2 247.342 2.127 20 0 BEADLO Cc1cnc(C[N@@H+]2CC(C)(C)OCC2(C)C)o1 ZINC000608497106 355823246 /nfs/dbraw/zinc/82/32/46/355823246.db2.gz PEODWNQJXUPEPA-UHFFFAOYSA-N 1 2 238.331 2.372 20 0 BEADLO Cc1cnc(C[N@H+]2CC(C)(C)OCC2(C)C)o1 ZINC000608497106 355823249 /nfs/dbraw/zinc/82/32/49/355823249.db2.gz PEODWNQJXUPEPA-UHFFFAOYSA-N 1 2 238.331 2.372 20 0 BEADLO C[C@@H](Nc1c[nH+]cc(N(C)C)c1)C1CCOCC1 ZINC000639364356 355834313 /nfs/dbraw/zinc/83/43/13/355834313.db2.gz HXHVZXMETDYDCE-LLVKDONJSA-N 1 2 249.358 2.375 20 0 BEADLO C[C@H](Nc1c[nH+]cc(N(C)C)c1)[C@H]1CCCO1 ZINC000639364944 355837306 /nfs/dbraw/zinc/83/73/06/355837306.db2.gz KOPUDKQWBOLLHX-GXFFZTMASA-N 1 2 235.331 2.127 20 0 BEADLO C[C@@H]1C[C@@H]1CNc1c[nH+]cc(N(C)C)c1 ZINC000639365633 355838124 /nfs/dbraw/zinc/83/81/24/355838124.db2.gz QBSNJYHSLONUMY-NXEZZACHSA-N 1 2 205.305 2.216 20 0 BEADLO COC(=O)[C@H](c1ccccc1C)[N@H+]1CC=CCC1 ZINC000613477297 363456195 /nfs/dbraw/zinc/45/61/95/363456195.db2.gz XTFSQDGFWSXXHW-AWEZNQCLSA-N 1 2 245.322 2.471 20 0 BEADLO COC(=O)[C@H](c1ccccc1C)[N@@H+]1CC=CCC1 ZINC000613477297 363456200 /nfs/dbraw/zinc/45/62/00/363456200.db2.gz XTFSQDGFWSXXHW-AWEZNQCLSA-N 1 2 245.322 2.471 20 0 BEADLO C[C@H]1C[C@@H](Nc2c[nH+]cc(N(C)C)c2)CCO1 ZINC000639364057 355832413 /nfs/dbraw/zinc/83/24/13/355832413.db2.gz GMOMQIUXXZAXTD-QWRGUYRKSA-N 1 2 235.331 2.127 20 0 BEADLO CN(C)c1c[nH+]cc(N[C@@H]2COC(C)(C)C2)c1 ZINC000639364227 355832422 /nfs/dbraw/zinc/83/24/22/355832422.db2.gz GTRDRIHQKIQKOR-NSHDSACASA-N 1 2 235.331 2.127 20 0 BEADLO CC[C@@](C)(CNc1c[nH+]cc(N(C)C)c1)OC ZINC000639363934 355832740 /nfs/dbraw/zinc/83/27/40/355832740.db2.gz FHFXVBVYNBXBQR-ZDUSSCGKSA-N 1 2 237.347 2.375 20 0 BEADLO CC(=O)Nc1nc(C[NH+]2[C@@H](C)C[C@@H]2C)cs1 ZINC000336055761 134066233 /nfs/dbraw/zinc/06/62/33/134066233.db2.gz WZHJRSNDMDVGCI-YUMQZZPRSA-N 1 2 239.344 2.084 20 0 BEADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]C2(C)COC2)o1 ZINC000639382449 355929154 /nfs/dbraw/zinc/92/91/54/355929154.db2.gz QELBIGGYTAKORK-KOLCDFICSA-N 1 2 221.300 2.282 20 0 BEADLO CCc1cc(C[NH2+][C@H](C)c2cncnc2C)on1 ZINC000583641342 355947300 /nfs/dbraw/zinc/94/73/00/355947300.db2.gz NAWKTGOCZMCTTF-SECBINFHSA-N 1 2 246.314 2.186 20 0 BEADLO OCc1cccc(NCc2ccccc2F)[nH+]1 ZINC000351269212 355969332 /nfs/dbraw/zinc/96/93/32/355969332.db2.gz LONCKIIXFJULPY-UHFFFAOYSA-N 1 2 232.258 2.325 20 0 BEADLO CCn1c[nH+]cc1CN[C@H](C1CC1)C(F)(F)F ZINC000418064870 191960494 /nfs/dbraw/zinc/96/04/94/191960494.db2.gz KKROPEZIWFFSHR-SNVBAGLBSA-N 1 2 247.264 2.334 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2ccnc(C)n2)n1 ZINC000351643740 356041915 /nfs/dbraw/zinc/04/19/15/356041915.db2.gz HIYNJLSLXYUREV-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2ccnc(C)n2)n1 ZINC000351643740 356041918 /nfs/dbraw/zinc/04/19/18/356041918.db2.gz HIYNJLSLXYUREV-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO CC(C)(C)n1cc(C[NH2+]C2(CF)CCC2)nn1 ZINC000584350575 356064441 /nfs/dbraw/zinc/06/44/41/356064441.db2.gz QOXHGBDRGHMXPG-UHFFFAOYSA-N 1 2 240.326 2.015 20 0 BEADLO CC1(C)C[NH+](Cc2nc3c(s2)CCC3)C1 ZINC000639392864 356060235 /nfs/dbraw/zinc/06/02/35/356060235.db2.gz BJGYWRBCKBTMLC-UHFFFAOYSA-N 1 2 222.357 2.474 20 0 BEADLO CC(C)Cn1cc(C[NH2+][C@@H](C)c2ccon2)cn1 ZINC000351592333 356023632 /nfs/dbraw/zinc/02/36/32/356023632.db2.gz JVYAUMAYCHGIFB-NSHDSACASA-N 1 2 248.330 2.378 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N(C)[C@H]1CC[C@H](C)C1 ZINC000335906366 356105890 /nfs/dbraw/zinc/10/58/90/356105890.db2.gz AKTODRGPGMFOMU-JQWIXIFHSA-N 1 2 247.342 2.464 20 0 BEADLO CCC(C)(C)[C@H](C)NC(=O)CCc1[nH]cc[nH+]1 ZINC000617568516 356123537 /nfs/dbraw/zinc/12/35/37/356123537.db2.gz DVQLVIFLERAZAV-JTQLQIEISA-N 1 2 237.347 2.283 20 0 BEADLO COC(=O)[C@H](CC(C)C)[N@@H+]1CC[C@](C)(F)C1 ZINC000351738623 356076680 /nfs/dbraw/zinc/07/66/80/356076680.db2.gz XRDIRJPVPZHTHX-JQWIXIFHSA-N 1 2 231.311 2.008 20 0 BEADLO COC(=O)[C@H](CC(C)C)[N@H+]1CC[C@](C)(F)C1 ZINC000351738623 356076681 /nfs/dbraw/zinc/07/66/81/356076681.db2.gz XRDIRJPVPZHTHX-JQWIXIFHSA-N 1 2 231.311 2.008 20 0 BEADLO CCC[C@@](C)(CC)C(=O)N[C@H]1Cc2c[nH+]cn2C1 ZINC000623259709 356090574 /nfs/dbraw/zinc/09/05/74/356090574.db2.gz IVFMIKQLARLZOC-SMDDNHRTSA-N 1 2 249.358 2.140 20 0 BEADLO CCC[C@](C)(CC)C(=O)N[C@@H]1Cc2c[nH+]cn2C1 ZINC000623259708 356090993 /nfs/dbraw/zinc/09/09/93/356090993.db2.gz IVFMIKQLARLZOC-RISCZKNCSA-N 1 2 249.358 2.140 20 0 BEADLO CCC[C@@](C)(CC)C(=O)N[C@@H]1Cc2c[nH+]cn2C1 ZINC000623259706 356091221 /nfs/dbraw/zinc/09/12/21/356091221.db2.gz IVFMIKQLARLZOC-BXUZGUMPSA-N 1 2 249.358 2.140 20 0 BEADLO COc1ccccc1/C=C\C[N@@H+]1CCOC[C@@H]1C ZINC000351893346 356161154 /nfs/dbraw/zinc/16/11/54/356161154.db2.gz UYVQSIORIKEGQC-VGVVRCBHSA-N 1 2 247.338 2.429 20 0 BEADLO COc1ccccc1/C=C\C[N@H+]1CCOC[C@@H]1C ZINC000351893346 356161157 /nfs/dbraw/zinc/16/11/57/356161157.db2.gz UYVQSIORIKEGQC-VGVVRCBHSA-N 1 2 247.338 2.429 20 0 BEADLO Cc1cc(N2CC[C@H](C)C(F)(F)C2)nc[nH+]1 ZINC000336098593 134080819 /nfs/dbraw/zinc/08/08/19/134080819.db2.gz PVYMOMHLACHXEJ-QMMMGPOBSA-N 1 2 227.258 2.267 20 0 BEADLO CCC(CC)(CC)C(=O)N[C@H]1Cc2c[nH+]cn2C1 ZINC000623263939 356227690 /nfs/dbraw/zinc/22/76/90/356227690.db2.gz BDCQLIVNIASIJT-NSHDSACASA-N 1 2 249.358 2.140 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+]C12C[C@@H](C)C[C@H](C)C2 ZINC000639427705 356208977 /nfs/dbraw/zinc/20/89/77/356208977.db2.gz OCLAFZRHUAXJCD-QWRGUYRKSA-N 1 2 238.375 2.369 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@@H]1[C@H]1CCC[C@@H](C)C1 ZINC000639428942 356209043 /nfs/dbraw/zinc/20/90/43/356209043.db2.gz ZJDMZAPBADQWHG-WOPDTQHZSA-N 1 2 238.375 2.369 20 0 BEADLO CC[C@H](C)CCNC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000617643031 356255385 /nfs/dbraw/zinc/25/53/85/356255385.db2.gz NGZAABZPFWHYNG-NWDGAFQWSA-N 1 2 237.347 2.387 20 0 BEADLO COC[C@@H](Nc1ccc[nH+]c1C)C1CC1 ZINC000087481645 491089083 /nfs/dbraw/zinc/08/90/83/491089083.db2.gz WEYGLWNJUHPMIM-GFCCVEGCSA-N 1 2 206.289 2.227 20 0 BEADLO CCC(F)(F)C[N@H+](C)C[C@H]1CCCO1 ZINC000639455088 356240608 /nfs/dbraw/zinc/24/06/08/356240608.db2.gz XGYCGKNLQOWLPZ-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CCC(F)(F)C[N@@H+](C)C[C@H]1CCCO1 ZINC000639455088 356240609 /nfs/dbraw/zinc/24/06/09/356240609.db2.gz XGYCGKNLQOWLPZ-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CCC(F)(F)C[N@H+](CCCOC)CCOC ZINC000639458023 356243968 /nfs/dbraw/zinc/24/39/68/356243968.db2.gz RDDILYOAPZTQAB-UHFFFAOYSA-N 1 2 239.306 2.017 20 0 BEADLO CCC(F)(F)C[N@@H+](CCCOC)CCOC ZINC000639458023 356243973 /nfs/dbraw/zinc/24/39/73/356243973.db2.gz RDDILYOAPZTQAB-UHFFFAOYSA-N 1 2 239.306 2.017 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1ccccc1F ZINC000336125119 134092576 /nfs/dbraw/zinc/09/25/76/134092576.db2.gz HOAPNPFZXIBGQW-UHFFFAOYSA-N 1 2 244.269 2.457 20 0 BEADLO CSC[C@@H](C)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000609622969 356403322 /nfs/dbraw/zinc/40/33/22/356403322.db2.gz AFMIPQMDMAURIC-SECBINFHSA-N 1 2 249.339 2.272 20 0 BEADLO C1=C[C@H]2CC[C@@H](C1)[N@H+]2Cc1nc(CC2CC2)no1 ZINC000639545075 356405905 /nfs/dbraw/zinc/40/59/05/356405905.db2.gz OUPPQMSBRGEMJH-NWDGAFQWSA-N 1 2 245.326 2.315 20 0 BEADLO C1=C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1nc(CC2CC2)no1 ZINC000639545075 356405909 /nfs/dbraw/zinc/40/59/09/356405909.db2.gz OUPPQMSBRGEMJH-NWDGAFQWSA-N 1 2 245.326 2.315 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)CCCn1cc[nH+]c1 ZINC000623280545 356452977 /nfs/dbraw/zinc/45/29/77/356452977.db2.gz AYIRLPZYJQMWFQ-RYUDHWBXSA-N 1 2 237.347 2.214 20 0 BEADLO Cn1c[nH+]cc1COc1cc(F)cc(F)c1 ZINC000336158732 134107271 /nfs/dbraw/zinc/10/72/71/134107271.db2.gz LNXXUECOWNZHAW-UHFFFAOYSA-N 1 2 224.210 2.277 20 0 BEADLO O=c1cc(C[N@H+]2CCC[C@H]2C(F)F)cc[nH]1 ZINC000639556132 356459540 /nfs/dbraw/zinc/45/95/40/356459540.db2.gz UXCWMFCQVQIOLC-VIFPVBQESA-N 1 2 228.242 2.017 20 0 BEADLO O=c1cc(C[N@@H+]2CCC[C@H]2C(F)F)cc[nH]1 ZINC000639556132 356459543 /nfs/dbraw/zinc/45/95/43/356459543.db2.gz UXCWMFCQVQIOLC-VIFPVBQESA-N 1 2 228.242 2.017 20 0 BEADLO Cc1nc(C[NH2+]Cc2ccc(C)cn2)cs1 ZINC000087782258 491091988 /nfs/dbraw/zinc/09/19/88/491091988.db2.gz NZDRUEMWOSVDJQ-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO CC[C@@H](O)CNc1cc[nH+]c2c(OC)cccc12 ZINC000420623812 192250533 /nfs/dbraw/zinc/25/05/33/192250533.db2.gz IOCOEIWVQLIFSW-SNVBAGLBSA-N 1 2 246.310 2.426 20 0 BEADLO Cc1cc(NC[C@@H]2Cc3ccccc32)c(C#N)c[nH+]1 ZINC000399358553 356466946 /nfs/dbraw/zinc/46/69/46/356466946.db2.gz AMLUVPOSRWBQSX-ZDUSSCGKSA-N 1 2 249.317 2.435 20 0 BEADLO CC[C@@H]1CN(c2cc[nH+]c(C)n2)C[C@H](CC)O1 ZINC000420640609 192253681 /nfs/dbraw/zinc/25/36/81/192253681.db2.gz YYBONEDDQLJEKB-TXEJJXNPSA-N 1 2 235.331 2.179 20 0 BEADLO CC(C)c1nc(NCCCC2(O)CCC2)cc[nH+]1 ZINC000420639199 192253756 /nfs/dbraw/zinc/25/37/56/192253756.db2.gz PLQFTZNQMMCVRL-UHFFFAOYSA-N 1 2 249.358 2.129 20 0 BEADLO Cc1cc(N2C[C@H](O)CC[C@H]2C)nc(C2CC2)[nH+]1 ZINC000420642178 192254193 /nfs/dbraw/zinc/25/41/93/192254193.db2.gz SOQNZRXUZCFABO-ZYHUDNBSSA-N 1 2 247.342 2.012 20 0 BEADLO C[C@@]1(F)CC[N@H+](CC(=O)Nc2ccccc2)C1 ZINC000336165969 134112919 /nfs/dbraw/zinc/11/29/19/134112919.db2.gz OKOIFJMFJQQSGZ-CYBMUJFWSA-N 1 2 236.290 2.059 20 0 BEADLO C[C@@]1(F)CC[N@@H+](CC(=O)Nc2ccccc2)C1 ZINC000336165969 134112920 /nfs/dbraw/zinc/11/29/20/134112920.db2.gz OKOIFJMFJQQSGZ-CYBMUJFWSA-N 1 2 236.290 2.059 20 0 BEADLO Cc1cc(CNC(=O)N(C)CC(C)C)cc(C)[nH+]1 ZINC000420700935 192257516 /nfs/dbraw/zinc/25/75/16/192257516.db2.gz QAJFKIBHVXJNCW-UHFFFAOYSA-N 1 2 249.358 2.496 20 0 BEADLO CCCN(C)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000420697126 192257605 /nfs/dbraw/zinc/25/76/05/192257605.db2.gz ILNMSVZUPHBLGJ-UHFFFAOYSA-N 1 2 235.331 2.250 20 0 BEADLO CCC(F)(F)C[NH2+][C@@H](CO)c1ccsc1 ZINC000639588905 356511875 /nfs/dbraw/zinc/51/18/75/356511875.db2.gz HNSCZOKUIQTWMC-VIFPVBQESA-N 1 2 235.299 2.416 20 0 BEADLO CCC[C@@H](CC)NC(=O)CCCn1cc[nH+]c1 ZINC000623291005 356504941 /nfs/dbraw/zinc/50/49/41/356504941.db2.gz SFKRNPUIJZTVCN-GFCCVEGCSA-N 1 2 237.347 2.358 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@H]1CC[C@H](C)C1 ZINC000336183920 134120586 /nfs/dbraw/zinc/12/05/86/134120586.db2.gz GDLUTQHQBCLYQS-ONGXEEELSA-N 1 2 233.315 2.122 20 0 BEADLO C/C(=C\c1ccccc1)C[NH+]1CCS(=O)CC1 ZINC000179462852 366260334 /nfs/dbraw/zinc/26/03/34/366260334.db2.gz IRFPIFKLMOUGFC-ACCUITESSA-N 1 2 249.379 2.154 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1CC(=O)c1ccccc1F ZINC000639618797 356536241 /nfs/dbraw/zinc/53/62/41/356536241.db2.gz RJMOYHINDHASNC-NXEZZACHSA-N 1 2 221.275 2.491 20 0 BEADLO Fc1cc(F)cc(C[N@@H+]2CC[C@@]23CCOC3)c1 ZINC000421013186 192301592 /nfs/dbraw/zinc/30/15/92/192301592.db2.gz FXWRHPYOAKCFRS-ZDUSSCGKSA-N 1 2 239.265 2.330 20 0 BEADLO Fc1cc(F)cc(C[N@H+]2CC[C@@]23CCOC3)c1 ZINC000421013186 192301594 /nfs/dbraw/zinc/30/15/94/192301594.db2.gz FXWRHPYOAKCFRS-ZDUSSCGKSA-N 1 2 239.265 2.330 20 0 BEADLO COc1ccc2c(c1)C1(CC1)C[N@@H+](CC(C)=O)C2 ZINC000639647696 356554428 /nfs/dbraw/zinc/55/44/28/356554428.db2.gz FCBQNCPYXHZAMZ-UHFFFAOYSA-N 1 2 245.322 2.131 20 0 BEADLO COc1ccc2c(c1)C1(CC1)C[N@H+](CC(C)=O)C2 ZINC000639647696 356554430 /nfs/dbraw/zinc/55/44/30/356554430.db2.gz FCBQNCPYXHZAMZ-UHFFFAOYSA-N 1 2 245.322 2.131 20 0 BEADLO CC(=O)C[N@@H+]1Cc2ccccc2OC(C)(C)C1 ZINC000639644822 356558843 /nfs/dbraw/zinc/55/88/43/356558843.db2.gz BXQAJOCXQYDDFD-UHFFFAOYSA-N 1 2 233.311 2.249 20 0 BEADLO CC(=O)C[N@H+]1Cc2ccccc2OC(C)(C)C1 ZINC000639644822 356558846 /nfs/dbraw/zinc/55/88/46/356558846.db2.gz BXQAJOCXQYDDFD-UHFFFAOYSA-N 1 2 233.311 2.249 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)NCCCNc1cccc[nH+]1 ZINC000449857506 202045879 /nfs/dbraw/zinc/04/58/79/202045879.db2.gz RITOUHIAKHZHEN-VXGBXAGGSA-N 1 2 247.342 2.046 20 0 BEADLO Cc1c(Cl)c(C[NH2+]Cc2ccoc2)nn1C ZINC000421329178 192317982 /nfs/dbraw/zinc/31/79/82/192317982.db2.gz UYYMVBPJEUOOGE-UHFFFAOYSA-N 1 2 239.706 2.265 20 0 BEADLO Cc1c(Cl)c(C[NH2+]Cc2ccco2)nn1C ZINC000421334918 192318697 /nfs/dbraw/zinc/31/86/97/192318697.db2.gz REBVDLXXWNAJMA-UHFFFAOYSA-N 1 2 239.706 2.265 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NCc2c[nH+]c[nH]2)C[C@@H]1C ZINC000449908395 202050727 /nfs/dbraw/zinc/05/07/27/202050727.db2.gz UKZDRIIRTDGVJX-OUAUKWLOSA-N 1 2 235.331 2.098 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NCc2c[nH]c[nH+]2)C[C@@H]1C ZINC000449908395 202050729 /nfs/dbraw/zinc/05/07/29/202050729.db2.gz UKZDRIIRTDGVJX-OUAUKWLOSA-N 1 2 235.331 2.098 20 0 BEADLO CC[N@H+](C[C@H](C)OC)CC(F)(F)CC ZINC000639652326 356564178 /nfs/dbraw/zinc/56/41/78/356564178.db2.gz PGCKDQZSECUFIL-VIFPVBQESA-N 1 2 209.280 2.389 20 0 BEADLO CC[N@@H+](C[C@H](C)OC)CC(F)(F)CC ZINC000639652326 356564179 /nfs/dbraw/zinc/56/41/79/356564179.db2.gz PGCKDQZSECUFIL-VIFPVBQESA-N 1 2 209.280 2.389 20 0 BEADLO CCC[C@@H](C)CC(=O)N[C@H]1CCn2c[nH+]cc2C1 ZINC000623304027 356594698 /nfs/dbraw/zinc/59/46/98/356594698.db2.gz PMWCMDTZLMMZSJ-NEPJUHHUSA-N 1 2 249.358 2.140 20 0 BEADLO CC1(C)CN(c2[nH]c3ccccc3[nH+]2)CCO1 ZINC000301856738 356583543 /nfs/dbraw/zinc/58/35/43/356583543.db2.gz DGBTUGKZTTXVAU-UHFFFAOYSA-N 1 2 231.299 2.178 20 0 BEADLO CCC(F)(F)C[N@@H+]1CC[C@H](O)CC12CCC2 ZINC000639687923 356596675 /nfs/dbraw/zinc/59/66/75/356596675.db2.gz UGOMBBKWYAUJMA-JTQLQIEISA-N 1 2 233.302 2.411 20 0 BEADLO CCC(F)(F)C[N@H+]1CC[C@H](O)CC12CCC2 ZINC000639687923 356596678 /nfs/dbraw/zinc/59/66/78/356596678.db2.gz UGOMBBKWYAUJMA-JTQLQIEISA-N 1 2 233.302 2.411 20 0 BEADLO CC[C@H](NC(=O)[C@@H]1CCC[C@H]2C[C@H]21)c1[nH]cc[nH+]1 ZINC000613579945 363522819 /nfs/dbraw/zinc/52/28/19/363522819.db2.gz ZNKBXHXROGGABL-QCNOEVLYSA-N 1 2 247.342 2.413 20 0 BEADLO CN(Cc1c[nH+]cn1C)c1ccsc1 ZINC000639735929 356625020 /nfs/dbraw/zinc/62/50/20/356625020.db2.gz ZCEHBCFNDVWAAH-UHFFFAOYSA-N 1 2 207.302 2.118 20 0 BEADLO CN1CC[N@H+](Cc2cccnc2)C[C@H]1C(C)(C)C ZINC000639750021 356643960 /nfs/dbraw/zinc/64/39/60/356643960.db2.gz UXLUAXISBQOJEC-AWEZNQCLSA-N 1 2 247.386 2.244 20 0 BEADLO CN1CC[N@@H+](Cc2cccnc2)C[C@H]1C(C)(C)C ZINC000639750021 356643966 /nfs/dbraw/zinc/64/39/66/356643966.db2.gz UXLUAXISBQOJEC-AWEZNQCLSA-N 1 2 247.386 2.244 20 0 BEADLO CN1CC[N@H+](Cc2cccnc2)C[C@@H]1C(C)(C)C ZINC000639750022 356644205 /nfs/dbraw/zinc/64/42/05/356644205.db2.gz UXLUAXISBQOJEC-CQSZACIVSA-N 1 2 247.386 2.244 20 0 BEADLO CN1CC[N@@H+](Cc2cccnc2)C[C@@H]1C(C)(C)C ZINC000639750022 356644207 /nfs/dbraw/zinc/64/42/07/356644207.db2.gz UXLUAXISBQOJEC-CQSZACIVSA-N 1 2 247.386 2.244 20 0 BEADLO C[C@H]([NH2+]C1CC(C(F)F)C1)C(=O)OC(C)(C)C ZINC000613620656 363542940 /nfs/dbraw/zinc/54/29/40/363542940.db2.gz GILKGSGLSPXGPS-UEJVZZJDSA-N 1 2 249.301 2.350 20 0 BEADLO Cc1cncc(-c2nc(C[N@@H+](C)C3CC3)no2)c1 ZINC000450264307 202114649 /nfs/dbraw/zinc/11/46/49/202114649.db2.gz TUZWSWDLMFXXSO-UHFFFAOYSA-N 1 2 244.298 2.034 20 0 BEADLO Cc1cncc(-c2nc(C[N@H+](C)C3CC3)no2)c1 ZINC000450264307 202114653 /nfs/dbraw/zinc/11/46/53/202114653.db2.gz TUZWSWDLMFXXSO-UHFFFAOYSA-N 1 2 244.298 2.034 20 0 BEADLO COCCN(C)c1[nH+]ccc2c(OC)cccc21 ZINC000450272825 202116064 /nfs/dbraw/zinc/11/60/64/202116064.db2.gz YWBYAIZQYMMWEV-UHFFFAOYSA-N 1 2 246.310 2.326 20 0 BEADLO C[C@@H]1CCC[N@H+](Cc2csnn2)[C@@H]1C ZINC000179799263 366309741 /nfs/dbraw/zinc/30/97/41/366309741.db2.gz HIDDLOUPRMNOSJ-RKDXNWHRSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]1CCC[N@@H+](Cc2csnn2)[C@@H]1C ZINC000179799263 366309745 /nfs/dbraw/zinc/30/97/45/366309745.db2.gz HIDDLOUPRMNOSJ-RKDXNWHRSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]([NH2+][C@H](C)C(C)(F)F)c1cn[nH]c1 ZINC000389464917 356679535 /nfs/dbraw/zinc/67/95/35/356679535.db2.gz JPAYFRSDKUJWAT-RNFRBKRXSA-N 1 2 203.236 2.104 20 0 BEADLO CCCn1cc(C[NH2+][C@H](C)C(C)(F)F)cn1 ZINC000389486045 356692495 /nfs/dbraw/zinc/69/24/95/356692495.db2.gz MHYBPBMDTREEQJ-SECBINFHSA-N 1 2 231.290 2.426 20 0 BEADLO C[C@H]([NH2+]Cc1cccn1C)C(C)(F)F ZINC000389463903 356681166 /nfs/dbraw/zinc/68/11/66/356681166.db2.gz ISHSRGBFPSCGQK-QMMMGPOBSA-N 1 2 202.248 2.158 20 0 BEADLO C[C@@H]([NH2+][C@H](C)C(C)(F)F)c1cnn(C)c1 ZINC000389474248 356681914 /nfs/dbraw/zinc/68/19/14/356681914.db2.gz WPCSBFKLLLVUPC-HTQZYQBOSA-N 1 2 217.263 2.114 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)C(C)(F)F)c1ccnn1C ZINC000389475682 356684512 /nfs/dbraw/zinc/68/45/12/356684512.db2.gz ZCDLKSFFEAGBRZ-SFYZADRCSA-N 1 2 217.263 2.114 20 0 BEADLO Cc1ccc(Cc2nc(-c3cocn3)no2)c[nH+]1 ZINC000350877619 366360045 /nfs/dbraw/zinc/36/00/45/366360045.db2.gz LORIHJCVHKBMTJ-UHFFFAOYSA-N 1 2 242.238 2.019 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@H]2c2cn[nH]c2)oc1C ZINC000639779904 356728335 /nfs/dbraw/zinc/72/83/35/356728335.db2.gz BECVBVISGRPZFR-LBPRGKRZSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@H]2c2cn[nH]c2)oc1C ZINC000639779904 356728337 /nfs/dbraw/zinc/72/83/37/356728337.db2.gz BECVBVISGRPZFR-LBPRGKRZSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@@H]2c2cn[nH]c2)oc1C ZINC000639779902 356728464 /nfs/dbraw/zinc/72/84/64/356728464.db2.gz BECVBVISGRPZFR-GFCCVEGCSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@@H]2c2cn[nH]c2)oc1C ZINC000639779902 356728467 /nfs/dbraw/zinc/72/84/67/356728467.db2.gz BECVBVISGRPZFR-GFCCVEGCSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1cncc(C[N@H+](C)Cc2ccns2)c1 ZINC000639806874 356778222 /nfs/dbraw/zinc/77/82/22/356778222.db2.gz IGPDLQONPGDYSE-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cncc(C[N@@H+](C)Cc2ccns2)c1 ZINC000639806874 356778226 /nfs/dbraw/zinc/77/82/26/356778226.db2.gz IGPDLQONPGDYSE-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CCc1nc(C[N@H+](CC)CCC2CC2)no1 ZINC000355047558 356748789 /nfs/dbraw/zinc/74/87/89/356748789.db2.gz XOYWLWUGCNHULT-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO CCc1nc(C[N@@H+](CC)CCC2CC2)no1 ZINC000355047558 356748791 /nfs/dbraw/zinc/74/87/91/356748791.db2.gz XOYWLWUGCNHULT-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO CCC[C@@]1(C)CCC[N@H+](Cc2c[nH]nn2)C1 ZINC000450454296 202170813 /nfs/dbraw/zinc/17/08/13/202170813.db2.gz LGEBLGAARMGYPN-LBPRGKRZSA-N 1 2 222.336 2.207 20 0 BEADLO CCC[C@@]1(C)CCC[N@@H+](Cc2c[nH]nn2)C1 ZINC000450454296 202170817 /nfs/dbraw/zinc/17/08/17/202170817.db2.gz LGEBLGAARMGYPN-LBPRGKRZSA-N 1 2 222.336 2.207 20 0 BEADLO CCC[C@@]1(C)CCC[N@H+](Cc2cnn[nH]2)C1 ZINC000450454296 202170821 /nfs/dbraw/zinc/17/08/21/202170821.db2.gz LGEBLGAARMGYPN-LBPRGKRZSA-N 1 2 222.336 2.207 20 0 BEADLO CCC[C@@]1(C)CCC[N@@H+](Cc2cnn[nH]2)C1 ZINC000450454296 202170822 /nfs/dbraw/zinc/17/08/22/202170822.db2.gz LGEBLGAARMGYPN-LBPRGKRZSA-N 1 2 222.336 2.207 20 0 BEADLO CCC[C@@]1(C)CCC[N@H+](Cc2cn[nH]n2)C1 ZINC000450454296 202170826 /nfs/dbraw/zinc/17/08/26/202170826.db2.gz LGEBLGAARMGYPN-LBPRGKRZSA-N 1 2 222.336 2.207 20 0 BEADLO CCC[C@@]1(C)CCC[N@@H+](Cc2cn[nH]n2)C1 ZINC000450454296 202170830 /nfs/dbraw/zinc/17/08/30/202170830.db2.gz LGEBLGAARMGYPN-LBPRGKRZSA-N 1 2 222.336 2.207 20 0 BEADLO Cn1c[nH+]cc1Cc1nc(CCC(C)(C)C)no1 ZINC000350440031 538652937 /nfs/dbraw/zinc/65/29/37/538652937.db2.gz QQWYSRYVNSHBGR-UHFFFAOYSA-N 1 2 248.330 2.373 20 0 BEADLO Cc1cc(F)ccc1C[N@H+]1CCN(C)C[C@@H]1C ZINC000548156814 538654194 /nfs/dbraw/zinc/65/41/94/538654194.db2.gz PQJAKQWYWDCMGA-LBPRGKRZSA-N 1 2 236.334 2.270 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+]1CCN(C)C[C@@H]1C ZINC000548156814 538654203 /nfs/dbraw/zinc/65/42/03/538654203.db2.gz PQJAKQWYWDCMGA-LBPRGKRZSA-N 1 2 236.334 2.270 20 0 BEADLO CCCCNC(=O)c1cc(C)cn2cc[nH+]c12 ZINC000623363236 356813226 /nfs/dbraw/zinc/81/32/26/356813226.db2.gz IOPIYGCHWREDNJ-UHFFFAOYSA-N 1 2 231.299 2.173 20 0 BEADLO CCc1cccc(C[N@@H+]2CCO[C@H](OC)C2)c1 ZINC000639835140 356824287 /nfs/dbraw/zinc/82/42/87/356824287.db2.gz BCVOELQKASKJSQ-AWEZNQCLSA-N 1 2 235.327 2.054 20 0 BEADLO CCc1cccc(C[N@H+]2CCO[C@H](OC)C2)c1 ZINC000639835140 356824290 /nfs/dbraw/zinc/82/42/90/356824290.db2.gz BCVOELQKASKJSQ-AWEZNQCLSA-N 1 2 235.327 2.054 20 0 BEADLO CO[C@H]1C[N@H+](Cc2cc(C)cc(C)c2)CCO1 ZINC000639837035 356826017 /nfs/dbraw/zinc/82/60/17/356826017.db2.gz XHUGUAFELCPKNR-CQSZACIVSA-N 1 2 235.327 2.108 20 0 BEADLO CO[C@H]1C[N@@H+](Cc2cc(C)cc(C)c2)CCO1 ZINC000639837035 356826020 /nfs/dbraw/zinc/82/60/20/356826020.db2.gz XHUGUAFELCPKNR-CQSZACIVSA-N 1 2 235.327 2.108 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@H](OC)C2)cc1 ZINC000639838275 356828317 /nfs/dbraw/zinc/82/83/17/356828317.db2.gz NEORWCBISMFUDR-AWEZNQCLSA-N 1 2 235.327 2.054 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@H](OC)C2)cc1 ZINC000639838275 356828320 /nfs/dbraw/zinc/82/83/20/356828320.db2.gz NEORWCBISMFUDR-AWEZNQCLSA-N 1 2 235.327 2.054 20 0 BEADLO CC1(C)CCC[C@@H](NC(=O)CCc2c[nH+]c[nH]2)C1 ZINC000281821735 538710008 /nfs/dbraw/zinc/71/00/08/538710008.db2.gz LGVMHKRQFIMVIA-LLVKDONJSA-N 1 2 249.358 2.427 20 0 BEADLO CC1(C)CCC[C@@H](NC(=O)CCc2c[nH]c[nH+]2)C1 ZINC000281821735 538710018 /nfs/dbraw/zinc/71/00/18/538710018.db2.gz LGVMHKRQFIMVIA-LLVKDONJSA-N 1 2 249.358 2.427 20 0 BEADLO CNc1nc(NCCCOC)[nH+]c2ccccc21 ZINC000041146863 356859627 /nfs/dbraw/zinc/85/96/27/356859627.db2.gz NJFZVACROQZNBE-UHFFFAOYSA-N 1 2 246.314 2.120 20 0 BEADLO CC[C@@H](Nc1cc[nH+]c(C2CC2)n1)C(F)F ZINC000450565949 202198801 /nfs/dbraw/zinc/19/88/01/202198801.db2.gz ONDHXOJVYBEZOU-MRVPVSSYSA-N 1 2 227.258 2.232 20 0 BEADLO CC(C)CNC(=O)C[N@@H+]1Cc2ccccc2[C@H]1C ZINC000361089398 356917470 /nfs/dbraw/zinc/91/74/70/356917470.db2.gz VOGBUMFDNYOHJW-GFCCVEGCSA-N 1 2 246.354 2.335 20 0 BEADLO CC(C)CNC(=O)C[N@H+]1Cc2ccccc2[C@H]1C ZINC000361089398 356917476 /nfs/dbraw/zinc/91/74/76/356917476.db2.gz VOGBUMFDNYOHJW-GFCCVEGCSA-N 1 2 246.354 2.335 20 0 BEADLO CCc1nc(C[N@@H+](CC)[C@@H]2CCOC2)cs1 ZINC000361251719 356922867 /nfs/dbraw/zinc/92/28/67/356922867.db2.gz OJVVTELOPAVSNP-LLVKDONJSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nc(C[N@H+](CC)[C@@H]2CCOC2)cs1 ZINC000361251719 356922872 /nfs/dbraw/zinc/92/28/72/356922872.db2.gz OJVVTELOPAVSNP-LLVKDONJSA-N 1 2 240.372 2.316 20 0 BEADLO CC[C@@H](Nc1cc(C)[nH+]cn1)C(F)F ZINC000450568734 202201187 /nfs/dbraw/zinc/20/11/87/202201187.db2.gz SVDHWRRZAPINMY-SSDOTTSWSA-N 1 2 201.220 2.241 20 0 BEADLO CC[N@H+](Cc1ncc(C2CC2)o1)[C@@H]1CCOC1 ZINC000361587912 356934706 /nfs/dbraw/zinc/93/47/06/356934706.db2.gz LCUOHHXEGDPSKK-LLVKDONJSA-N 1 2 236.315 2.163 20 0 BEADLO CC[N@@H+](Cc1ncc(C2CC2)o1)[C@@H]1CCOC1 ZINC000361587912 356934710 /nfs/dbraw/zinc/93/47/10/356934710.db2.gz LCUOHHXEGDPSKK-LLVKDONJSA-N 1 2 236.315 2.163 20 0 BEADLO CCN(c1cc[nH+]c(C(C)C)n1)[C@@H]1CCOC1 ZINC000359969713 356898634 /nfs/dbraw/zinc/89/86/34/356898634.db2.gz WKZJTQQIRKLXPO-LLVKDONJSA-N 1 2 235.331 2.215 20 0 BEADLO Cc1cc(NC2CC(C)(F)C2)nc(C2CC2)[nH+]1 ZINC000450585754 202205581 /nfs/dbraw/zinc/20/55/81/202205581.db2.gz ZLSXITGZQSXBFD-UHFFFAOYSA-N 1 2 235.306 2.387 20 0 BEADLO CC1(C)CN(c2cc3ccccc3c[nH+]2)C[C@@H]1O ZINC000631255511 357010966 /nfs/dbraw/zinc/01/09/66/357010966.db2.gz REJLTUQQOSABRJ-ZDUSSCGKSA-N 1 2 242.322 2.442 20 0 BEADLO CC[C@H](CC(=O)NCc1c[nH+]cn1C)C(C)C ZINC000355255999 538790940 /nfs/dbraw/zinc/79/09/40/538790940.db2.gz NKCGRUVAYXEKFX-LLVKDONJSA-N 1 2 237.347 2.109 20 0 BEADLO CC[C@@H]([NH2+]Cc1ncc[nH]1)c1c(C)noc1C ZINC000121180792 357080228 /nfs/dbraw/zinc/08/02/28/357080228.db2.gz KZTXVXXSYOQACG-SNVBAGLBSA-N 1 2 234.303 2.255 20 0 BEADLO CC(=O)C[N@@H+]1CC(C)(C)[C@@H]1c1ccncc1 ZINC000639879441 357113381 /nfs/dbraw/zinc/11/33/81/357113381.db2.gz WTIBBELRNMBZIL-LBPRGKRZSA-N 1 2 218.300 2.054 20 0 BEADLO CC(=O)C[N@H+]1CC(C)(C)[C@@H]1c1ccncc1 ZINC000639879441 357113383 /nfs/dbraw/zinc/11/33/83/357113383.db2.gz WTIBBELRNMBZIL-LBPRGKRZSA-N 1 2 218.300 2.054 20 0 BEADLO CCO[C@@H]1C[C@@H](Nc2c[nH]c[nH+]2)C12CCC2 ZINC000390493579 357096490 /nfs/dbraw/zinc/09/64/90/357096490.db2.gz RDPVZMJCMKVTNM-NXEZZACHSA-N 1 2 221.304 2.169 20 0 BEADLO CC(=O)C[NH2+][C@@H](C(F)F)C1CCCCC1 ZINC000639884042 357157373 /nfs/dbraw/zinc/15/73/73/357157373.db2.gz IEBSHSUERIFKSR-SNVBAGLBSA-N 1 2 219.275 2.379 20 0 BEADLO C[C@@H](CCN(C)CC(F)F)[N@H+](C)CC(F)F ZINC000156788603 538796485 /nfs/dbraw/zinc/79/64/85/538796485.db2.gz FTIKQHSJOZGVSP-QMMMGPOBSA-N 1 2 244.276 2.159 20 0 BEADLO C[C@@H](CCN(C)CC(F)F)[N@@H+](C)CC(F)F ZINC000156788603 538796493 /nfs/dbraw/zinc/79/64/93/538796493.db2.gz FTIKQHSJOZGVSP-QMMMGPOBSA-N 1 2 244.276 2.159 20 0 BEADLO Cc1cc([C@H](C)[NH2+]CC(C)(C)F)no1 ZINC000631659963 357190707 /nfs/dbraw/zinc/19/07/07/357190707.db2.gz CYMWHONNXYEAGN-QMMMGPOBSA-N 1 2 200.257 2.382 20 0 BEADLO CC(C)[C@H]1CCCN(C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000356769260 538815454 /nfs/dbraw/zinc/81/54/54/538815454.db2.gz HSFCPOAVYALNEO-LBPRGKRZSA-N 1 2 249.358 2.237 20 0 BEADLO CC(C)[C@H]1CCCN(C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000356769260 538815461 /nfs/dbraw/zinc/81/54/61/538815461.db2.gz HSFCPOAVYALNEO-LBPRGKRZSA-N 1 2 249.358 2.237 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@@H](C3CC3)C2)no1 ZINC000377522213 357234434 /nfs/dbraw/zinc/23/44/34/357234434.db2.gz CXEDOGQJIRIAHN-LLVKDONJSA-N 1 2 235.331 2.254 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@@H](C3CC3)C2)no1 ZINC000377522213 357234444 /nfs/dbraw/zinc/23/44/44/357234444.db2.gz CXEDOGQJIRIAHN-LLVKDONJSA-N 1 2 235.331 2.254 20 0 BEADLO CCOc1ccc(C[NH+]2CC3(C2)CCCO3)cc1 ZINC000628426726 357254640 /nfs/dbraw/zinc/25/46/40/357254640.db2.gz IYPFDEUYQDOBBM-UHFFFAOYSA-N 1 2 247.338 2.450 20 0 BEADLO Cc1sccc1C[NH+]1CC2(C1)CCCO2 ZINC000628427614 357255592 /nfs/dbraw/zinc/25/55/92/357255592.db2.gz MYVFKSBFKVTWKR-UHFFFAOYSA-N 1 2 223.341 2.421 20 0 BEADLO CCSCC[N@@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000610215192 357277438 /nfs/dbraw/zinc/27/74/38/357277438.db2.gz OGVIPDVKNHBTMN-QMMMGPOBSA-N 1 2 243.294 2.003 20 0 BEADLO CCSCC[N@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000610215192 357277441 /nfs/dbraw/zinc/27/74/41/357277441.db2.gz OGVIPDVKNHBTMN-QMMMGPOBSA-N 1 2 243.294 2.003 20 0 BEADLO C[NH2+]Cc1noc([C@H]2CCCc3sccc32)n1 ZINC000168463949 134198054 /nfs/dbraw/zinc/19/80/54/134198054.db2.gz MMBYBOPGTHONDG-VIFPVBQESA-N 1 2 249.339 2.319 20 0 BEADLO CC(C)[C@@H](CO)CNc1ccc2ccccc2[nH+]1 ZINC000394066021 357325519 /nfs/dbraw/zinc/32/55/19/357325519.db2.gz FXZGPSRHSCDYQF-CYBMUJFWSA-N 1 2 244.338 2.333 20 0 BEADLO COC(=O)[C@H]([NH2+]C[C@@H]1CCCC1(F)F)C(C)C ZINC000394661572 357368074 /nfs/dbraw/zinc/36/80/74/357368074.db2.gz OQIYEVGTHOLRQI-VHSXEESVSA-N 1 2 249.301 2.209 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1C[C@@H]1C(F)F ZINC000583152657 357496394 /nfs/dbraw/zinc/49/63/94/357496394.db2.gz ACBZZSYCVUKNDU-YUMQZZPRSA-N 1 2 213.231 2.159 20 0 BEADLO Cc1cncc(C[N@@H+]2CCOCC23CCC3)c1 ZINC000189968188 357678568 /nfs/dbraw/zinc/67/85/68/357678568.db2.gz IFWLYJIUXIBUIX-UHFFFAOYSA-N 1 2 232.327 2.145 20 0 BEADLO Cc1cncc(C[N@H+]2CCOCC23CCC3)c1 ZINC000189968188 357678574 /nfs/dbraw/zinc/67/85/74/357678574.db2.gz IFWLYJIUXIBUIX-UHFFFAOYSA-N 1 2 232.327 2.145 20 0 BEADLO c1[nH+]c(SCc2ncccn2)n2ccccc12 ZINC000190977916 357735397 /nfs/dbraw/zinc/73/53/97/357735397.db2.gz UVGPZUOADBAHRG-UHFFFAOYSA-N 1 2 242.307 2.417 20 0 BEADLO CCS[C@H]1CCC[C@H]1[NH2+]Cc1noc(C)n1 ZINC000233850650 357756093 /nfs/dbraw/zinc/75/60/93/357756093.db2.gz CRZIVBQCEUVDCM-ZJUUUORDSA-N 1 2 241.360 2.142 20 0 BEADLO CC[C@@H](C)CNc1nc[nH+]c(N)c1Cl ZINC000233839490 357756617 /nfs/dbraw/zinc/75/66/17/357756617.db2.gz NPNHBALGXHMCPL-ZCFIWIBFSA-N 1 2 214.700 2.170 20 0 BEADLO CC[C@@H](C)CNc1[nH+]cnc(N)c1Cl ZINC000233839490 357756621 /nfs/dbraw/zinc/75/66/21/357756621.db2.gz NPNHBALGXHMCPL-ZCFIWIBFSA-N 1 2 214.700 2.170 20 0 BEADLO CC[C@H](C(=O)OC(C)(C)C)[NH+]1CCSCC1 ZINC000191944007 357806395 /nfs/dbraw/zinc/80/63/95/357806395.db2.gz OJOPFMOQKWWIFG-SNVBAGLBSA-N 1 2 245.388 2.156 20 0 BEADLO C[C@@H](c1ccco1)[N@H+](C)Cc1ncccn1 ZINC000191968954 357807580 /nfs/dbraw/zinc/80/75/80/357807580.db2.gz UNVXFDQYJFKKIH-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1ncccn1 ZINC000191968954 357807585 /nfs/dbraw/zinc/80/75/85/357807585.db2.gz UNVXFDQYJFKKIH-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@@H]1CCC[C@@]1(C)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000584391554 357883757 /nfs/dbraw/zinc/88/37/57/357883757.db2.gz YEVWTKYTBLDQCK-BXUZGUMPSA-N 1 2 247.342 2.093 20 0 BEADLO CSCC[N@@H+]1C[C@@H](C)O[C@H](C(F)(F)F)C1 ZINC000610409994 357916342 /nfs/dbraw/zinc/91/63/42/357916342.db2.gz AXTZLCXFZJRYRD-SFYZADRCSA-N 1 2 243.294 2.001 20 0 BEADLO CSCC[N@H+]1C[C@@H](C)O[C@H](C(F)(F)F)C1 ZINC000610409994 357916345 /nfs/dbraw/zinc/91/63/45/357916345.db2.gz AXTZLCXFZJRYRD-SFYZADRCSA-N 1 2 243.294 2.001 20 0 BEADLO CC[C@@H]1CCC[C@@H]1CNC(=O)CCc1c[nH+]c[nH]1 ZINC000584451715 357971292 /nfs/dbraw/zinc/97/12/92/357971292.db2.gz GGDGGIWJCCFXHC-VXGBXAGGSA-N 1 2 249.358 2.285 20 0 BEADLO CC[C@@H]1CCC[C@@H]1CNC(=O)CCc1c[nH]c[nH+]1 ZINC000584451715 357971296 /nfs/dbraw/zinc/97/12/96/357971296.db2.gz GGDGGIWJCCFXHC-VXGBXAGGSA-N 1 2 249.358 2.285 20 0 BEADLO CCc1cc(C[NH2+]Cc2ncc(C)s2)on1 ZINC000583852520 357975502 /nfs/dbraw/zinc/97/55/02/357975502.db2.gz WBDYTRMFGMQPNU-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1cc2ccccc2[nH]1 ZINC000610619712 358025406 /nfs/dbraw/zinc/02/54/06/358025406.db2.gz JUZBHLFXJQFKCN-UHFFFAOYSA-N 1 2 246.310 2.163 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1cc2ccccc2[nH]1 ZINC000610619712 358025407 /nfs/dbraw/zinc/02/54/07/358025407.db2.gz JUZBHLFXJQFKCN-UHFFFAOYSA-N 1 2 246.310 2.163 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)CCCCCF ZINC000639971587 358030011 /nfs/dbraw/zinc/03/00/11/358030011.db2.gz SHFBDHRQWXQYTE-UHFFFAOYSA-N 1 2 213.300 2.290 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)CCCCCF ZINC000639971587 358030014 /nfs/dbraw/zinc/03/00/14/358030014.db2.gz SHFBDHRQWXQYTE-UHFFFAOYSA-N 1 2 213.300 2.290 20 0 BEADLO CCC[NH2+]C1(C(=O)OCC)Cc2ccccc2C1 ZINC000037513634 358085759 /nfs/dbraw/zinc/08/57/59/358085759.db2.gz JNVUFASKYIDXDC-UHFFFAOYSA-N 1 2 247.338 2.087 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCC[C@](O)(CC)C1 ZINC000640036830 358136888 /nfs/dbraw/zinc/13/68/88/358136888.db2.gz XWXTXYWTQHBDPP-SNVBAGLBSA-N 1 2 221.291 2.269 20 0 BEADLO CCC(F)(F)C[N@H+]1CCC[C@](O)(CC)C1 ZINC000640036830 358136891 /nfs/dbraw/zinc/13/68/91/358136891.db2.gz XWXTXYWTQHBDPP-SNVBAGLBSA-N 1 2 221.291 2.269 20 0 BEADLO CC(C)(C)OCCNc1cc[nH+]c2ccncc12 ZINC000584818955 358188871 /nfs/dbraw/zinc/18/88/71/358188871.db2.gz RFZRMSAXZOKLFJ-UHFFFAOYSA-N 1 2 245.326 2.279 20 0 BEADLO C[C@@H](CC(=O)N1CCCC[C@H](C)C1)n1cc[nH+]c1 ZINC000584783331 358176885 /nfs/dbraw/zinc/17/68/85/358176885.db2.gz BCTZVAFTYXXPSJ-STQMWFEESA-N 1 2 249.358 2.483 20 0 BEADLO CC(C)c1nc(N[C@@H]2CCOC2(C)C)cc[nH+]1 ZINC000450635358 202220621 /nfs/dbraw/zinc/22/06/21/202220621.db2.gz BEDDZRKXYMQBNI-SNVBAGLBSA-N 1 2 235.331 2.001 20 0 BEADLO COc1ccnc(C[NH2+][C@H](C)c2ccccc2)n1 ZINC000450651360 202224918 /nfs/dbraw/zinc/22/49/18/202224918.db2.gz PFTYJAAXPSVGJG-LLVKDONJSA-N 1 2 243.310 2.336 20 0 BEADLO Cc1[nH]c(CN2Cc3ccccc3CO2)[nH+]c1C ZINC000640125971 358205722 /nfs/dbraw/zinc/20/57/22/358205722.db2.gz FRCSIYHZCPBTMK-UHFFFAOYSA-N 1 2 243.310 2.474 20 0 BEADLO CCn1cc[nH+]c1CNc1cncc(SC)n1 ZINC000450682365 202232220 /nfs/dbraw/zinc/23/22/20/202232220.db2.gz NZJZFNGLEVYBAD-UHFFFAOYSA-N 1 2 249.343 2.027 20 0 BEADLO CC/C=C/CNc1cc(C)[nH+]c(C2CC2)n1 ZINC000450688164 202235331 /nfs/dbraw/zinc/23/53/31/202235331.db2.gz BYQZVCUCCPEUMJ-SNAWJCMRSA-N 1 2 217.316 2.462 20 0 BEADLO Cc1nc(N2C[C@@H]3[C@@H]4C=C[C@@H](C4)[C@]3(C)C2)cc[nH+]1 ZINC000450684693 202235420 /nfs/dbraw/zinc/23/54/20/202235420.db2.gz AHLQDAMSFXAXQQ-COMQUAJESA-N 1 2 241.338 2.433 20 0 BEADLO CN(CC1CCCC1)C(=O)CCCn1cc[nH+]c1 ZINC000104341070 358222209 /nfs/dbraw/zinc/22/22/09/358222209.db2.gz DATGNWRIQHSQLD-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO COC[C@@H]([NH2+]Cc1cccc(C)n1)c1ccco1 ZINC000450730985 202249140 /nfs/dbraw/zinc/24/91/40/202249140.db2.gz YGSACXSJBGEJJU-CYBMUJFWSA-N 1 2 246.310 2.460 20 0 BEADLO CC[C@](C)(CNc1cc[nH+]c(C2CC2)n1)OC ZINC000450713837 202241822 /nfs/dbraw/zinc/24/18/22/202241822.db2.gz KNGVANVIYGWALF-CYBMUJFWSA-N 1 2 235.331 2.003 20 0 BEADLO Cc1cc(N)nc(SCCC(C)(F)F)[nH+]1 ZINC000450713934 202242177 /nfs/dbraw/zinc/24/21/77/202242177.db2.gz GRVMDGQJTKDSLY-UHFFFAOYSA-N 1 2 233.287 2.335 20 0 BEADLO CC[C@@](C)(CNc1cc[nH+]c(C(C)C)n1)OC ZINC000450712363 202242544 /nfs/dbraw/zinc/24/25/44/202242544.db2.gz ISQMCDVLEWEAKJ-ZDUSSCGKSA-N 1 2 237.347 2.249 20 0 BEADLO CC[C@@H]1C[C@H]1CNc1[nH+]c(C)nc2[nH]ccc21 ZINC000450723935 202246063 /nfs/dbraw/zinc/24/60/63/202246063.db2.gz KXDHPGKPJJQSQS-ZJUUUORDSA-N 1 2 230.315 2.146 20 0 BEADLO CCO[C@H]1CCN(c2cc[nH+]c(C)n2)C[C@H]1C ZINC000450744160 202252778 /nfs/dbraw/zinc/25/27/78/202252778.db2.gz LALAUXLPWHPPGW-PWSUYJOCSA-N 1 2 235.331 2.036 20 0 BEADLO CCO[C@H]1CCN(c2cc[nH+]c(C)n2)C[C@@H]1C ZINC000450744159 202253841 /nfs/dbraw/zinc/25/38/41/202253841.db2.gz LALAUXLPWHPPGW-JQWIXIFHSA-N 1 2 235.331 2.036 20 0 BEADLO CO[C@@H]1CCN(c2cc[nH+]c(C(C)C)n2)C[C@H]1C ZINC000450764334 202258441 /nfs/dbraw/zinc/25/84/41/202258441.db2.gz BYFXHUSAJNYPDC-VXGBXAGGSA-N 1 2 249.358 2.461 20 0 BEADLO CCc1cn(Cc2csc(COC)n2)c[nH+]1 ZINC001641418937 1172247042 /nfs/dbraw/zinc/24/70/42/1172247042.db2.gz URODVRVATQKDQW-UHFFFAOYSA-N 1 2 237.328 2.097 20 0 BEADLO Fc1ccc(NCCCCn2cc[nH+]c2)nc1 ZINC000045108234 358401608 /nfs/dbraw/zinc/40/16/08/358401608.db2.gz KYGRACQWLPFAIU-UHFFFAOYSA-N 1 2 234.278 2.310 20 0 BEADLO Cc1cc(C)nc(NCCCCn2cc[nH+]c2)n1 ZINC000045108268 358401621 /nfs/dbraw/zinc/40/16/21/358401621.db2.gz RPOHNSAALTVHSP-UHFFFAOYSA-N 1 2 245.330 2.182 20 0 BEADLO CC(=O)C[NH2+][C@H](CF)c1ccc(F)cc1 ZINC000640155073 358437940 /nfs/dbraw/zinc/43/79/40/358437940.db2.gz PTLOBSYGDSIMJN-LLVKDONJSA-N 1 2 213.227 2.015 20 0 BEADLO Cc1cnc([C@H](NCc2[nH]cc[nH+]2)C2CC2)s1 ZINC000174545160 134282625 /nfs/dbraw/zinc/28/26/25/134282625.db2.gz UZROEJWOENGJHM-LLVKDONJSA-N 1 2 248.355 2.416 20 0 BEADLO Cc1cnc([C@H]([NH2+]Cc2ncc[nH]2)C2CC2)s1 ZINC000174545160 134282626 /nfs/dbraw/zinc/28/26/26/134282626.db2.gz UZROEJWOENGJHM-LLVKDONJSA-N 1 2 248.355 2.416 20 0 BEADLO CCc1cn([C@@H]2CCC(C)(C)C2=O)c[nH+]1 ZINC001641418885 1172247681 /nfs/dbraw/zinc/24/76/81/1172247681.db2.gz SKIOBEQBCCBCCG-SNVBAGLBSA-N 1 2 206.289 2.376 20 0 BEADLO CCOC[C@H]1CCN(c2cc[nH+]c(C(C)C)n2)C1 ZINC000175050552 134284206 /nfs/dbraw/zinc/28/42/06/134284206.db2.gz APMDBNANDKYUGM-LBPRGKRZSA-N 1 2 249.358 2.463 20 0 BEADLO CC(C)c1nc(C[N@H+](CCO)C2CC2)cs1 ZINC000048065539 358613629 /nfs/dbraw/zinc/61/36/29/358613629.db2.gz PQTQGUCIEOIAHG-UHFFFAOYSA-N 1 2 240.372 2.223 20 0 BEADLO CC(C)c1nc(C[N@@H+](CCO)C2CC2)cs1 ZINC000048065539 358613632 /nfs/dbraw/zinc/61/36/32/358613632.db2.gz PQTQGUCIEOIAHG-UHFFFAOYSA-N 1 2 240.372 2.223 20 0 BEADLO CCc1cnc(C[NH2+][C@@H](C)c2cnccn2)s1 ZINC000130512820 358630357 /nfs/dbraw/zinc/63/03/57/358630357.db2.gz GKYYKKOJYSFCPT-VIFPVBQESA-N 1 2 248.355 2.346 20 0 BEADLO Cc1[nH]c2ccc(NC(=O)COC(C)C)cc2[nH+]1 ZINC000049105524 358672669 /nfs/dbraw/zinc/67/26/69/358672669.db2.gz CKBRNCJACAGJTM-UHFFFAOYSA-N 1 2 247.298 2.235 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1ccc(C)c(C)c1 ZINC000050066226 358711457 /nfs/dbraw/zinc/71/14/57/358711457.db2.gz IBCYJUHPRCMCSK-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1ccc(C)c(C)c1 ZINC000050066226 358711462 /nfs/dbraw/zinc/71/14/62/358711462.db2.gz IBCYJUHPRCMCSK-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1cc(C)ccc1C ZINC000050066495 358711497 /nfs/dbraw/zinc/71/14/97/358711497.db2.gz LIPPNFKENWDHPL-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1cc(C)ccc1C ZINC000050066495 358711500 /nfs/dbraw/zinc/71/15/00/358711500.db2.gz LIPPNFKENWDHPL-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO Cc1ccc(C(=O)NC(C)(C)c2[nH]cc[nH+]2)cc1 ZINC000578242628 366468050 /nfs/dbraw/zinc/46/80/50/366468050.db2.gz GCIZXKYYWNFOIY-UHFFFAOYSA-N 1 2 243.310 2.383 20 0 BEADLO c1cnn([C@@H]2CCC[N@@H+](Cc3nccs3)C2)c1 ZINC000135027843 358816168 /nfs/dbraw/zinc/81/61/68/358816168.db2.gz YBEFPVOVJWRION-LLVKDONJSA-N 1 2 248.355 2.177 20 0 BEADLO c1cnn([C@@H]2CCC[N@H+](Cc3nccs3)C2)c1 ZINC000135027843 358816172 /nfs/dbraw/zinc/81/61/72/358816172.db2.gz YBEFPVOVJWRION-LLVKDONJSA-N 1 2 248.355 2.177 20 0 BEADLO c1cnn([C@H]2CCC[N@@H+](Cc3nccs3)C2)c1 ZINC000135027858 358817026 /nfs/dbraw/zinc/81/70/26/358817026.db2.gz YBEFPVOVJWRION-NSHDSACASA-N 1 2 248.355 2.177 20 0 BEADLO c1cnn([C@H]2CCC[N@H+](Cc3nccs3)C2)c1 ZINC000135027858 358817028 /nfs/dbraw/zinc/81/70/28/358817028.db2.gz YBEFPVOVJWRION-NSHDSACASA-N 1 2 248.355 2.177 20 0 BEADLO CCc1nc(C[N@H+]2CCCC[C@H]2CC)no1 ZINC000054316295 358858386 /nfs/dbraw/zinc/85/83/86/358858386.db2.gz HFBVSOHWVLROBW-SNVBAGLBSA-N 1 2 223.320 2.397 20 0 BEADLO CCc1nc(C[N@@H+]2CCCC[C@H]2CC)no1 ZINC000054316295 358858389 /nfs/dbraw/zinc/85/83/89/358858389.db2.gz HFBVSOHWVLROBW-SNVBAGLBSA-N 1 2 223.320 2.397 20 0 BEADLO Cc1cnc(C[N@H+]2CCSC[C@H]2C)s1 ZINC000180504617 366489306 /nfs/dbraw/zinc/48/93/06/366489306.db2.gz RJHCVGREFZPPJC-MRVPVSSYSA-N 1 2 228.386 2.389 20 0 BEADLO Cc1cnc(C[N@@H+]2CCSC[C@H]2C)s1 ZINC000180504617 366489311 /nfs/dbraw/zinc/48/93/11/366489311.db2.gz RJHCVGREFZPPJC-MRVPVSSYSA-N 1 2 228.386 2.389 20 0 BEADLO C[C@H]1CCCC[N@@H+]1Cc1noc(C2CC2)n1 ZINC000053602533 358835770 /nfs/dbraw/zinc/83/57/70/358835770.db2.gz GSMYJFFLFJEDHB-VIFPVBQESA-N 1 2 221.304 2.321 20 0 BEADLO C[C@H]1CCCC[N@H+]1Cc1noc(C2CC2)n1 ZINC000053602533 358835774 /nfs/dbraw/zinc/83/57/74/358835774.db2.gz GSMYJFFLFJEDHB-VIFPVBQESA-N 1 2 221.304 2.321 20 0 BEADLO CC[C@H](NC(=O)c1ccccc1)c1[nH]cc[nH+]1 ZINC000140444370 358922494 /nfs/dbraw/zinc/92/24/94/358922494.db2.gz YPQGBWIPAWYGOW-NSHDSACASA-N 1 2 229.283 2.291 20 0 BEADLO CCOC(=O)[C@@H](CC)[NH+]1CC2(C1)CC(F)(F)C2 ZINC000611180815 358929067 /nfs/dbraw/zinc/92/90/67/358929067.db2.gz VHQMQTNFNOJJNK-SECBINFHSA-N 1 2 247.285 2.059 20 0 BEADLO C[C@H](Cc1nc(CC2CC2)no1)n1cc[nH+]c1 ZINC000351402556 366522005 /nfs/dbraw/zinc/52/20/05/366522005.db2.gz JOUWDKOYTSOEIA-SECBINFHSA-N 1 2 232.287 2.022 20 0 BEADLO CC[C@@H]([NH2+]Cc1cc[nH]n1)c1nc(C)cs1 ZINC000105502802 359024325 /nfs/dbraw/zinc/02/43/25/359024325.db2.gz ZBDFEJAZGVWPSE-SNVBAGLBSA-N 1 2 236.344 2.416 20 0 BEADLO CC[N@@H+](Cc1noc(C2CC2)n1)CC1CC1 ZINC000070012904 359038764 /nfs/dbraw/zinc/03/87/64/359038764.db2.gz WPDOGHWZCPKJED-UHFFFAOYSA-N 1 2 221.304 2.179 20 0 BEADLO CC[N@H+](Cc1noc(C2CC2)n1)CC1CC1 ZINC000070012904 359038769 /nfs/dbraw/zinc/03/87/69/359038769.db2.gz WPDOGHWZCPKJED-UHFFFAOYSA-N 1 2 221.304 2.179 20 0 BEADLO Cc1ccc(C(=O)N(C)Cc2[nH]cc[nH+]2)cc1F ZINC000070979323 359068576 /nfs/dbraw/zinc/06/85/76/359068576.db2.gz PBNCHWWYXCDDNS-UHFFFAOYSA-N 1 2 247.273 2.129 20 0 BEADLO Cc1cc[nH+]cc1NCc1ccc(C(N)=O)cc1 ZINC000071413839 359079304 /nfs/dbraw/zinc/07/93/04/359079304.db2.gz RHXIFBHWPVTGTN-UHFFFAOYSA-N 1 2 241.294 2.101 20 0 BEADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)C1CC1 ZINC000074829732 359130340 /nfs/dbraw/zinc/13/03/40/359130340.db2.gz CJHLXPDISKFYFA-UHFFFAOYSA-N 1 2 227.267 2.425 20 0 BEADLO Cc1[nH+]c2cc(NC(=O)C(C)C)ccc2n1C ZINC000074985638 359137036 /nfs/dbraw/zinc/13/70/36/359137036.db2.gz QBOIWRSHMZFMGO-UHFFFAOYSA-N 1 2 231.299 2.476 20 0 BEADLO CO[C@H]1CCN(c2cc[nH+]c(C3CC3)n2)C[C@H]1C ZINC000450780788 202263750 /nfs/dbraw/zinc/26/37/50/202263750.db2.gz YPORXNZATSOASP-PWSUYJOCSA-N 1 2 247.342 2.215 20 0 BEADLO Cn1ccc(C[NH+]2CC(Cc3cccs3)C2)n1 ZINC000628479027 359313794 /nfs/dbraw/zinc/31/37/94/359313794.db2.gz XLACVMCXXYKKMZ-UHFFFAOYSA-N 1 2 247.367 2.156 20 0 BEADLO CC1(C)CC[C@@H]1Nc1nc[nH+]c(N)c1Cl ZINC000286256731 359354701 /nfs/dbraw/zinc/35/47/01/359354701.db2.gz CQFOKPPHQKHAPG-LURJTMIESA-N 1 2 226.711 2.313 20 0 BEADLO CC1(C)CC[C@@H]1Nc1[nH+]cnc(N)c1Cl ZINC000286256731 359354704 /nfs/dbraw/zinc/35/47/04/359354704.db2.gz CQFOKPPHQKHAPG-LURJTMIESA-N 1 2 226.711 2.313 20 0 BEADLO COC(=O)C[NH2+][C@H](CC1CC1)c1ccccc1 ZINC000611395921 359358876 /nfs/dbraw/zinc/35/88/76/359358876.db2.gz ZBALAZAMMAYOGR-CYBMUJFWSA-N 1 2 233.311 2.290 20 0 BEADLO Clc1ncc(C[N@@H+]2CC[C@@H]3C[C@@H]32)s1 ZINC000306263997 359485522 /nfs/dbraw/zinc/48/55/22/359485522.db2.gz NXTXCLSCOLKQGD-SVRRBLITSA-N 1 2 214.721 2.391 20 0 BEADLO Clc1ncc(C[N@H+]2CC[C@@H]3C[C@@H]32)s1 ZINC000306263997 359485527 /nfs/dbraw/zinc/48/55/27/359485527.db2.gz NXTXCLSCOLKQGD-SVRRBLITSA-N 1 2 214.721 2.391 20 0 BEADLO C[C@@H](CC(=O)N1CC[C@@H](C)C[C@H]1C)n1cc[nH+]c1 ZINC000580437204 359555631 /nfs/dbraw/zinc/55/56/31/359555631.db2.gz MEMJJMHRXWZGLL-FRRDWIJNSA-N 1 2 249.358 2.481 20 0 BEADLO OC[C@H]([C@H](Nc1cccc[nH+]1)C1CC1)C1CC1 ZINC000450778869 202264814 /nfs/dbraw/zinc/26/48/14/202264814.db2.gz NZFYQTBJVUZNSH-GXTWGEPZSA-N 1 2 232.327 2.291 20 0 BEADLO Cc1c[nH+]cc(N[C@@H](C)[C@@H]2CCCO2)c1 ZINC000309036265 491143046 /nfs/dbraw/zinc/14/30/46/491143046.db2.gz GFYYGDACCRSVQS-JQWIXIFHSA-N 1 2 206.289 2.369 20 0 BEADLO CO[C@@H]1CCC[C@H]1Nc1cc[nH+]c2ccncc12 ZINC000450784981 202266797 /nfs/dbraw/zinc/26/67/97/202266797.db2.gz LWOIMFVRZONVRL-ZIAGYGMSSA-N 1 2 243.310 2.031 20 0 BEADLO CSc1ccc(NCc2cn[nH]c2)[nH+]c1 ZINC000309067041 491143932 /nfs/dbraw/zinc/14/39/32/491143932.db2.gz AQFGWWPXOXGCDU-UHFFFAOYSA-N 1 2 220.301 2.139 20 0 BEADLO Cc1cc(N(C)[C@@H](CO)CC(C)(C)C)nc[nH+]1 ZINC000450838436 202284229 /nfs/dbraw/zinc/28/42/29/202284229.db2.gz YDJCIEMLQHYFBP-LLVKDONJSA-N 1 2 237.347 2.018 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)/C=C/c1cccnc1 ZINC000107289629 359737430 /nfs/dbraw/zinc/73/74/30/359737430.db2.gz LJVGTGFIWWOMQZ-SNAWJCMRSA-N 1 2 239.278 2.437 20 0 BEADLO CO[C@@H]1CC[C@@H](C(=O)Nc2ccc(C)[nH+]c2C)C1 ZINC000612227033 359740662 /nfs/dbraw/zinc/74/06/62/359740662.db2.gz PJSQKUKOSSPQSR-VXGBXAGGSA-N 1 2 248.326 2.452 20 0 BEADLO CCn1cnc(C(=O)Nc2ccc(C)[nH+]c2C)c1 ZINC000612227185 359740983 /nfs/dbraw/zinc/74/09/83/359740983.db2.gz QHGDTMFIOVRWSP-UHFFFAOYSA-N 1 2 244.298 2.167 20 0 BEADLO CO[C@H](COCc1[nH]cc[nH+]1)Cc1ccccc1 ZINC000450891876 202301927 /nfs/dbraw/zinc/30/19/27/202301927.db2.gz BUGOLKCVZJCQGL-ZDUSSCGKSA-N 1 2 246.310 2.184 20 0 BEADLO CC[C@@H](O)[C@H](CC)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000450866563 202293156 /nfs/dbraw/zinc/29/31/56/202293156.db2.gz XFCQEKLZHDTIPD-NWDGAFQWSA-N 1 2 249.358 2.046 20 0 BEADLO CC[C@H](O)[C@H](CC)Nc1cc[nH+]c2ccncc12 ZINC000450866671 202293197 /nfs/dbraw/zinc/29/31/97/202293197.db2.gz XODJKPGPQBVKDZ-FZMZJTMJSA-N 1 2 245.326 2.013 20 0 BEADLO CC[C@H](O)[C@H](CC)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000450866589 202294078 /nfs/dbraw/zinc/29/40/78/202294078.db2.gz XIZRLYRSVUULFE-QWRGUYRKSA-N 1 2 248.330 2.228 20 0 BEADLO CCc1cc(N2CCCC[C@@H]2COC)nc(C)[nH+]1 ZINC000450940770 202314497 /nfs/dbraw/zinc/31/44/97/202314497.db2.gz ROZBJGKIVPWNII-CYBMUJFWSA-N 1 2 249.358 2.353 20 0 BEADLO Cc1[nH+]cccc1N[C@@H](C)[C@@H]1CCCO1 ZINC000309091972 491144691 /nfs/dbraw/zinc/14/46/91/491144691.db2.gz FBIJIUMROZIPPX-JQWIXIFHSA-N 1 2 206.289 2.369 20 0 BEADLO Cn1c[nH+]cc1CSCc1cccnc1 ZINC000451051928 202337425 /nfs/dbraw/zinc/33/74/25/202337425.db2.gz WEPWFVALASGSNT-UHFFFAOYSA-N 1 2 219.313 2.249 20 0 BEADLO c1nc(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)co1 ZINC000578443548 366569546 /nfs/dbraw/zinc/56/95/46/366569546.db2.gz DKXFUGJRIQRSTK-AWEZNQCLSA-N 1 2 244.294 2.328 20 0 BEADLO c1nc(C[N@H+]2CC[C@H](Oc3ccccc3)C2)co1 ZINC000578443548 366569550 /nfs/dbraw/zinc/56/95/50/366569550.db2.gz DKXFUGJRIQRSTK-AWEZNQCLSA-N 1 2 244.294 2.328 20 0 BEADLO CC(C)n1ccc(C[N@H+](C(C)C)C2COC2)n1 ZINC000451120358 202357529 /nfs/dbraw/zinc/35/75/29/202357529.db2.gz LGFICXQPMVMMKF-UHFFFAOYSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)n1ccc(C[N@@H+](C(C)C)C2COC2)n1 ZINC000451120358 202357532 /nfs/dbraw/zinc/35/75/32/202357532.db2.gz LGFICXQPMVMMKF-UHFFFAOYSA-N 1 2 237.347 2.073 20 0 BEADLO COc1ccc[nH+]c1N1CCCCCC1 ZINC000231142819 359879712 /nfs/dbraw/zinc/87/97/12/359879712.db2.gz WNLAMSNBGNEAJY-UHFFFAOYSA-N 1 2 206.289 2.471 20 0 BEADLO CC[C@H](F)C[N@H+](C)[C@H](CC(C)C)C(=O)OC ZINC000451273456 202382070 /nfs/dbraw/zinc/38/20/70/202382070.db2.gz WNGXRCRQBYZTBU-WDEREUQCSA-N 1 2 233.327 2.254 20 0 BEADLO CC[C@H](F)C[N@@H+](C)[C@H](CC(C)C)C(=O)OC ZINC000451273456 202382071 /nfs/dbraw/zinc/38/20/71/202382071.db2.gz WNGXRCRQBYZTBU-WDEREUQCSA-N 1 2 233.327 2.254 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2CC23CCCC3)cc[nH+]1 ZINC000578713951 366629058 /nfs/dbraw/zinc/62/90/58/366629058.db2.gz HFSDUYUKWASJNJ-LBPRGKRZSA-N 1 2 245.326 2.266 20 0 BEADLO Cc1ccc(C(C)(C)[NH2+]CC(F)F)cn1 ZINC000309194634 491146210 /nfs/dbraw/zinc/14/62/10/491146210.db2.gz QHFLCRYBRDYRBP-UHFFFAOYSA-N 1 2 214.259 2.480 20 0 BEADLO c1csc([C@@H]([NH2+][C@H]2CC23CC3)c2nnc[nH]2)c1 ZINC000578878854 366664948 /nfs/dbraw/zinc/66/49/48/366664948.db2.gz JCJWWEIMRMDQAH-VHSXEESVSA-N 1 2 246.339 2.098 20 0 BEADLO CCn1ncnc1C[NH2+][C@@H](C)c1ccccc1F ZINC000088590618 359969082 /nfs/dbraw/zinc/96/90/82/359969082.db2.gz KVNRDUDRKARJDB-JTQLQIEISA-N 1 2 248.305 2.288 20 0 BEADLO CCn1ncnc1C[NH2+][C@H](C)c1ccccc1F ZINC000088590620 359969372 /nfs/dbraw/zinc/96/93/72/359969372.db2.gz KVNRDUDRKARJDB-SNVBAGLBSA-N 1 2 248.305 2.288 20 0 BEADLO Cc1cc(C)c(C(=O)NCc2c[nH+]c[nH]2)c(C)c1 ZINC000088759265 359977511 /nfs/dbraw/zinc/97/75/11/359977511.db2.gz GPNWRRBSBMVXFU-UHFFFAOYSA-N 1 2 243.310 2.265 20 0 BEADLO Cc1cc(C)c(C(=O)NCc2c[nH]c[nH+]2)c(C)c1 ZINC000088759265 359977512 /nfs/dbraw/zinc/97/75/12/359977512.db2.gz GPNWRRBSBMVXFU-UHFFFAOYSA-N 1 2 243.310 2.265 20 0 BEADLO O=C(CC[N@H+]1C[C@H]2CC[C@@H](C1)O2)c1ccccc1 ZINC000090907427 360093925 /nfs/dbraw/zinc/09/39/25/360093925.db2.gz KMQVALDXRFDHNL-OKILXGFUSA-N 1 2 245.322 2.123 20 0 BEADLO O=C(CC[N@@H+]1C[C@H]2CC[C@@H](C1)O2)c1ccccc1 ZINC000090907427 360093927 /nfs/dbraw/zinc/09/39/27/360093927.db2.gz KMQVALDXRFDHNL-OKILXGFUSA-N 1 2 245.322 2.123 20 0 BEADLO CCn1c[nH+]cc1CNc1ccc(CCO)cc1 ZINC000090172686 360061584 /nfs/dbraw/zinc/06/15/84/360061584.db2.gz MKEQIZMLPPRPAV-UHFFFAOYSA-N 1 2 245.326 2.050 20 0 BEADLO CCn1cc(NCc2c[nH+]cn2C(C)C)cn1 ZINC000090207793 360064978 /nfs/dbraw/zinc/06/49/78/360064978.db2.gz DHQDDAWONZZSEF-UHFFFAOYSA-N 1 2 233.319 2.293 20 0 BEADLO CCc1ccc(C[N@H+]2CCOC[C@H]2CC)o1 ZINC000091980958 360139564 /nfs/dbraw/zinc/13/95/64/360139564.db2.gz HUBUHBZJOFMMMK-LLVKDONJSA-N 1 2 223.316 2.453 20 0 BEADLO CCc1ccc(C[N@@H+]2CCOC[C@H]2CC)o1 ZINC000091980958 360139568 /nfs/dbraw/zinc/13/95/68/360139568.db2.gz HUBUHBZJOFMMMK-LLVKDONJSA-N 1 2 223.316 2.453 20 0 BEADLO CC(=O)c1ccc(OCc2c[nH+]cn2C)cc1 ZINC000091278507 360110256 /nfs/dbraw/zinc/11/02/56/360110256.db2.gz JXZOGIYMYDACFJ-UHFFFAOYSA-N 1 2 230.267 2.202 20 0 BEADLO CC[C@H](C)CNc1ccc(N2CCOCC2)c[nH+]1 ZINC000093064028 360213970 /nfs/dbraw/zinc/21/39/70/360213970.db2.gz NMDALMSSMUIJMB-LBPRGKRZSA-N 1 2 249.358 2.376 20 0 BEADLO COCc1ccc(C[N@@H+]2CCO[C@H](C)[C@@H]2C)o1 ZINC000093417713 360241469 /nfs/dbraw/zinc/24/14/69/360241469.db2.gz CZHDEFIIGZSDLM-WDEREUQCSA-N 1 2 239.315 2.035 20 0 BEADLO COCc1ccc(C[N@H+]2CCO[C@H](C)[C@@H]2C)o1 ZINC000093417713 360241475 /nfs/dbraw/zinc/24/14/75/360241475.db2.gz CZHDEFIIGZSDLM-WDEREUQCSA-N 1 2 239.315 2.035 20 0 BEADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2c[nH]cn2)n1 ZINC000093453372 360244977 /nfs/dbraw/zinc/24/49/77/360244977.db2.gz JFIACQVHXLBQDP-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2c[nH]cn2)n1 ZINC000093453372 360244983 /nfs/dbraw/zinc/24/49/83/360244983.db2.gz JFIACQVHXLBQDP-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cnc[nH]2)n1 ZINC000093453372 360244985 /nfs/dbraw/zinc/24/49/85/360244985.db2.gz JFIACQVHXLBQDP-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2cnc[nH]2)n1 ZINC000093453372 360244990 /nfs/dbraw/zinc/24/49/90/360244990.db2.gz JFIACQVHXLBQDP-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ncccc1C[N@H+](C)Cc1nccs1 ZINC000093582748 360257703 /nfs/dbraw/zinc/25/77/03/360257703.db2.gz ZEARRIQPMPKEDN-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ncccc1C[N@@H+](C)Cc1nccs1 ZINC000093582748 360257707 /nfs/dbraw/zinc/25/77/07/360257707.db2.gz ZEARRIQPMPKEDN-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cc[nH+]cc1NCc1cc(C(N)=O)cs1 ZINC000093688092 360272783 /nfs/dbraw/zinc/27/27/83/360272783.db2.gz HHTDJCWHZPOHNJ-UHFFFAOYSA-N 1 2 247.323 2.163 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@H]2CCCCO2)oc1C ZINC000098134114 360389990 /nfs/dbraw/zinc/38/99/90/360389990.db2.gz HBGQZRPFZCOMNH-GFCCVEGCSA-N 1 2 238.331 2.292 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@H]2CCCCO2)oc1C ZINC000098134114 360389994 /nfs/dbraw/zinc/38/99/94/360389994.db2.gz HBGQZRPFZCOMNH-GFCCVEGCSA-N 1 2 238.331 2.292 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCCC1(F)F)c1ccnn1C ZINC000309554454 491151322 /nfs/dbraw/zinc/15/13/22/491151322.db2.gz JGMXOHRLBTUAEK-PSASIEDQSA-N 1 2 229.274 2.259 20 0 BEADLO C[C@H]([NH2+][C@H]1CCCC1(F)F)c1ccnn1C ZINC000309554457 491151380 /nfs/dbraw/zinc/15/13/80/491151380.db2.gz JGMXOHRLBTUAEK-WPRPVWTQSA-N 1 2 229.274 2.259 20 0 BEADLO CC(C)c1nc(NC[C@@H](O)C(C)C)cc[nH+]1 ZINC000156669183 200697637 /nfs/dbraw/zinc/69/76/37/200697637.db2.gz QWSVHJXSNNQPEU-SNVBAGLBSA-N 1 2 223.320 2.029 20 0 BEADLO COc1cc(NCc2ccc(C)[nH+]c2C)[nH]n1 ZINC000629205299 360946227 /nfs/dbraw/zinc/94/62/27/360946227.db2.gz BNEONSHYVRIDEH-UHFFFAOYSA-N 1 2 232.287 2.042 20 0 BEADLO Cc1[nH+]c(C(C)C)ccc1CS(C)(=O)=O ZINC000629181414 360929405 /nfs/dbraw/zinc/92/94/05/360929405.db2.gz MUPSFFZBHDLQNQ-UHFFFAOYSA-N 1 2 227.329 2.058 20 0 BEADLO C[NH2+]c1ccc(NCc2ccn(C)n2)cc1 ZINC000629388568 361041371 /nfs/dbraw/zinc/04/13/71/361041371.db2.gz FLLFDIIMTYTTDC-UHFFFAOYSA-N 1 2 216.288 2.074 20 0 BEADLO C[C@@H](C(=O)N1CCn2c[nH+]cc2C1)C1CCCC1 ZINC000640412156 361202982 /nfs/dbraw/zinc/20/29/82/361202982.db2.gz LDKSFOGNJIIQDN-LLVKDONJSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1ccc(C[NH2+]Cc2c(Cl)cnn2C)o1 ZINC000394649492 361224734 /nfs/dbraw/zinc/22/47/34/361224734.db2.gz SQHRVNSOVQVVBB-UHFFFAOYSA-N 1 2 239.706 2.265 20 0 BEADLO CCC(C)(CC)C(=O)N1CCn2c[nH+]cc2C1 ZINC000640454082 361231059 /nfs/dbraw/zinc/23/10/59/361231059.db2.gz DRXAGZNSJPACJJ-UHFFFAOYSA-N 1 2 235.331 2.052 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+]2CCOC3(CCC3)C2)cn1 ZINC000428285412 201003295 /nfs/dbraw/zinc/00/32/95/201003295.db2.gz IOZQSXDIXSOAOM-GFCCVEGCSA-N 1 2 247.342 2.101 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+]2CCOC3(CCC3)C2)cn1 ZINC000428285412 201003298 /nfs/dbraw/zinc/00/32/98/201003298.db2.gz IOZQSXDIXSOAOM-GFCCVEGCSA-N 1 2 247.342 2.101 20 0 BEADLO Cc1cnc([C@H](C)[N@H+](C)Cc2cccnc2)cn1 ZINC000428288787 201005365 /nfs/dbraw/zinc/00/53/65/201005365.db2.gz SQRNJBPLMZXWLE-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+](C)Cc2cccnc2)cn1 ZINC000428288787 201005368 /nfs/dbraw/zinc/00/53/68/201005368.db2.gz SQRNJBPLMZXWLE-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO CCc1cccc(C[NH+]2CC(O)(C(F)F)C2)c1 ZINC000579239496 366743557 /nfs/dbraw/zinc/74/35/57/366743557.db2.gz ZMUNPFLOIJYNHB-UHFFFAOYSA-N 1 2 241.281 2.061 20 0 BEADLO Cc1cnc([C@H](C)[N@H+]2CCO[C@@H](C(C)C)C2)cn1 ZINC000428348971 201010057 /nfs/dbraw/zinc/01/00/57/201010057.db2.gz QJTHKVAAHYCDCR-GXTWGEPZSA-N 1 2 249.358 2.203 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+]2CCO[C@@H](C(C)C)C2)cn1 ZINC000428348971 201010060 /nfs/dbraw/zinc/01/00/60/201010060.db2.gz QJTHKVAAHYCDCR-GXTWGEPZSA-N 1 2 249.358 2.203 20 0 BEADLO CC[C@@]1(C)C[N@@H+]([C@H](C)c2cnc(C)cn2)CCO1 ZINC000428486424 201024335 /nfs/dbraw/zinc/02/43/35/201024335.db2.gz VXPSDHNQPCYCEZ-OCCSQVGLSA-N 1 2 249.358 2.347 20 0 BEADLO CC[C@@]1(C)C[N@H+]([C@H](C)c2cnc(C)cn2)CCO1 ZINC000428486424 201024338 /nfs/dbraw/zinc/02/43/38/201024338.db2.gz VXPSDHNQPCYCEZ-OCCSQVGLSA-N 1 2 249.358 2.347 20 0 BEADLO Cc1cc(N(C)[C@H]2CC[C@H](C)C2)nc[nH+]1 ZINC000428669685 201033794 /nfs/dbraw/zinc/03/37/94/201033794.db2.gz QLUKEBHHPMZAAF-ONGXEEELSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1cc(N(C)[C@@H]2CC[C@H](C)C2)nc[nH+]1 ZINC000428669682 201033956 /nfs/dbraw/zinc/03/39/56/201033956.db2.gz QLUKEBHHPMZAAF-GXSJLCMTSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1nc(C[NH2+][C@H](C)c2c[nH]nc2C)cs1 ZINC000309796598 491156737 /nfs/dbraw/zinc/15/67/37/491156737.db2.gz QHYIZHNVCPIWPV-SSDOTTSWSA-N 1 2 236.344 2.334 20 0 BEADLO Cc1nc(C[NH+](C2CCC2)C2CCC2)no1 ZINC000429129436 201069973 /nfs/dbraw/zinc/06/99/73/201069973.db2.gz RVBHKXSKDREOTM-UHFFFAOYSA-N 1 2 221.304 2.285 20 0 BEADLO Cc1cnn(Cc2[nH+]ccn2-c2ccccc2)c1 ZINC000429243340 201083710 /nfs/dbraw/zinc/08/37/10/201083710.db2.gz DZOYETUPHAVMJB-UHFFFAOYSA-N 1 2 238.294 2.426 20 0 BEADLO Cc1nsc(C)c1C[N@H+]1C[C@H](C)OC[C@@H]1C ZINC000579430716 366782943 /nfs/dbraw/zinc/78/29/43/366782943.db2.gz YLCCDDJLEIXQTQ-IUCAKERBSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nsc(C)c1C[N@@H+]1C[C@H](C)OC[C@@H]1C ZINC000579430716 366782946 /nfs/dbraw/zinc/78/29/46/366782946.db2.gz YLCCDDJLEIXQTQ-IUCAKERBSA-N 1 2 240.372 2.369 20 0 BEADLO CCOC1(C)CC[NH+](Cc2cn[nH]c2C)CC1 ZINC000430091416 201142458 /nfs/dbraw/zinc/14/24/58/201142458.db2.gz SLEYPSCUVWOGQG-UHFFFAOYSA-N 1 2 237.347 2.109 20 0 BEADLO CC[C@H]1CC[N@@H+]1Cc1nnc(C(C)(C)C)[nH]1 ZINC000433181658 201164827 /nfs/dbraw/zinc/16/48/27/201164827.db2.gz LUXWFULMDQCSSP-VIFPVBQESA-N 1 2 222.336 2.087 20 0 BEADLO CC[C@H]1CC[N@H+]1Cc1nnc(C(C)(C)C)[nH]1 ZINC000433181658 201164829 /nfs/dbraw/zinc/16/48/29/201164829.db2.gz LUXWFULMDQCSSP-VIFPVBQESA-N 1 2 222.336 2.087 20 0 BEADLO CC[C@@H](F)C[NH2+][C@@](C)(c1noc(C)n1)C1CC1 ZINC000433308387 201180501 /nfs/dbraw/zinc/18/05/01/201180501.db2.gz YAYNTILYFKIGNM-ZYHUDNBSSA-N 1 2 241.310 2.341 20 0 BEADLO CCn1cc(C[NH2+][C@H]2CCCC2(F)F)cn1 ZINC000309958556 491158876 /nfs/dbraw/zinc/15/88/76/491158876.db2.gz JXKQZSLUNNQWQL-JTQLQIEISA-N 1 2 229.274 2.180 20 0 BEADLO CC[C@@H](O)CCCNc1[nH+]c(C)nc2[nH]ccc21 ZINC000433782557 201193667 /nfs/dbraw/zinc/19/36/67/201193667.db2.gz KXTRSMKFGLVTAS-SNVBAGLBSA-N 1 2 248.330 2.181 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@H](CO)CC(C)C)[nH+]1 ZINC000433795610 201194089 /nfs/dbraw/zinc/19/40/89/201194089.db2.gz YZYNFVSLADHYCV-JTQLQIEISA-N 1 2 248.330 2.085 20 0 BEADLO CCc1cc(N[C@]2(CC)CCOC2)nc[nH+]1 ZINC000309951894 491158781 /nfs/dbraw/zinc/15/87/81/491158781.db2.gz GLPJQAABTOMBPM-GFCCVEGCSA-N 1 2 221.304 2.020 20 0 BEADLO CC[C@H](Nc1cc[nH+]c(C)n1)[C@H]1CCCO1 ZINC000153191626 201226571 /nfs/dbraw/zinc/22/65/71/201226571.db2.gz UYCSCNBHRFJPIQ-WDEREUQCSA-N 1 2 221.304 2.155 20 0 BEADLO OCCCCNc1ccc(-c2ccsc2)c[nH+]1 ZINC000629690351 361625100 /nfs/dbraw/zinc/62/51/00/361625100.db2.gz INXLQEHJIFCYPT-UHFFFAOYSA-N 1 2 248.351 2.416 20 0 BEADLO Nc1ccc(-c2ccc(N3CCCC3)nc2)c[nH+]1 ZINC000629709908 361643099 /nfs/dbraw/zinc/64/30/99/361643099.db2.gz MBXNIZPJWUMZNT-UHFFFAOYSA-N 1 2 240.310 2.156 20 0 BEADLO CCC[C@H]([NH2+]C[C@H](C)SC)C(=O)OCC ZINC000155097595 201301189 /nfs/dbraw/zinc/30/11/89/201301189.db2.gz FPCJUPJSNLIDHJ-UWVGGRQHSA-N 1 2 233.377 2.059 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NC[C@H]1CCCC12CC2 ZINC000629832321 361731077 /nfs/dbraw/zinc/73/10/77/361731077.db2.gz ZRLHMZZKGWATPS-LLVKDONJSA-N 1 2 247.342 2.039 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NC[C@H]1CCCC12CC2 ZINC000629832321 361731082 /nfs/dbraw/zinc/73/10/82/361731082.db2.gz ZRLHMZZKGWATPS-LLVKDONJSA-N 1 2 247.342 2.039 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)CC(F)(F)F ZINC000622081670 370697955 /nfs/dbraw/zinc/69/79/55/370697955.db2.gz AKNMOJHKZAJKQJ-ZETCQYMHSA-N 1 2 249.236 2.033 20 0 BEADLO Cc1cc(C[NH2+][C@@H](CO)c2ccccc2C)no1 ZINC000541985467 364056647 /nfs/dbraw/zinc/05/66/47/364056647.db2.gz YRSUTPHHLIOHTQ-AWEZNQCLSA-N 1 2 246.310 2.115 20 0 BEADLO O=C(c1ccc(-c2c[nH]c[nH+]2)cc1)N1CCCC1 ZINC000630395290 364120140 /nfs/dbraw/zinc/12/01/40/364120140.db2.gz ZTKJHVZMTMWUMW-UHFFFAOYSA-N 1 2 241.294 2.313 20 0 BEADLO C[C@H](CC(=O)Nc1cc(F)ccn1)n1cc[nH+]c1 ZINC000622151223 370736530 /nfs/dbraw/zinc/73/65/30/370736530.db2.gz BJLRCOILSSBHEB-SECBINFHSA-N 1 2 248.261 2.007 20 0 BEADLO C[C@@H](CC(=O)Nc1cc(F)ccn1)n1cc[nH+]c1 ZINC000622151224 370736621 /nfs/dbraw/zinc/73/66/21/370736621.db2.gz BJLRCOILSSBHEB-VIFPVBQESA-N 1 2 248.261 2.007 20 0 BEADLO CC[C@H](Nc1nc(C)cc(OC)n1)c1[nH]cc[nH+]1 ZINC000139843939 541345174 /nfs/dbraw/zinc/34/51/74/541345174.db2.gz SJQFBUBJMYRYDY-VIFPVBQESA-N 1 2 247.302 2.080 20 0 BEADLO COC[C@@H](Nc1c[nH+]cc(C)c1)C1CC1 ZINC000134343824 541357413 /nfs/dbraw/zinc/35/74/13/541357413.db2.gz SMRPTLADRZTFQC-GFCCVEGCSA-N 1 2 206.289 2.227 20 0 BEADLO CC[C@@H]([NH2+][C@@H](C)c1cn[nH]c1)C(F)F ZINC000453227770 202713686 /nfs/dbraw/zinc/71/36/86/202713686.db2.gz BGDIRMPTCSRWNE-POYBYMJQSA-N 1 2 203.236 2.104 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CCC1(C)C)c1[nH]cc[nH+]1 ZINC000615157752 364547902 /nfs/dbraw/zinc/54/79/02/364547902.db2.gz GMDOFHCEFTZGEG-RKDXNWHRSA-N 1 2 221.304 2.023 20 0 BEADLO C[C@@H](NC(=O)[C@]1(C)CCC[C@@H]1C)c1[nH]cc[nH+]1 ZINC000615157671 364548167 /nfs/dbraw/zinc/54/81/67/364548167.db2.gz FGMOKXJFARTYOB-OPQQBVKSSA-N 1 2 235.331 2.413 20 0 BEADLO C[C@@H](NC(=O)[C@]1(C)C[C@H]2C[C@H]2C1)c1[nH]cc[nH+]1 ZINC000615158018 364548262 /nfs/dbraw/zinc/54/82/62/364548262.db2.gz IDYKKUWASDWQNH-ORXSELOVSA-N 1 2 233.315 2.023 20 0 BEADLO Cc1ccc(NC(=O)CCC2(O)CCC2)c(C)[nH+]1 ZINC000631742632 364550964 /nfs/dbraw/zinc/55/09/64/364550964.db2.gz BAIXRSSSSDDUGH-UHFFFAOYSA-N 1 2 248.326 2.332 20 0 BEADLO CCc1cc(N[C@@H]2C[C@@H](OC)C2(C)C)nc[nH+]1 ZINC000227820238 541371880 /nfs/dbraw/zinc/37/18/80/541371880.db2.gz HAWIXIBNIMRWIC-GHMZBOCLSA-N 1 2 235.331 2.264 20 0 BEADLO Cc1cc(N2CCC[C@@H]2[C@H]2CCCOC2)nc[nH+]1 ZINC000567767347 364754475 /nfs/dbraw/zinc/75/44/75/364754475.db2.gz JSTOWVDLISMTFN-QWHCGFSZSA-N 1 2 247.342 2.180 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCC=C(F)C1 ZINC000573338810 364804786 /nfs/dbraw/zinc/80/47/86/364804786.db2.gz ZLUTYXMKFIMFJW-UHFFFAOYSA-N 1 2 207.252 2.157 20 0 BEADLO CCOC1(C)C[NH+](Cc2cccc(F)c2N)C1 ZINC000399080597 364782154 /nfs/dbraw/zinc/78/21/54/364782154.db2.gz LGFGBMRMDANUKK-UHFFFAOYSA-N 1 2 238.306 2.019 20 0 BEADLO CC(C)(NC(=O)CCC1CCC1)c1[nH]cc[nH+]1 ZINC000573499160 364847654 /nfs/dbraw/zinc/84/76/54/364847654.db2.gz HAIFIUGTJDJBSG-UHFFFAOYSA-N 1 2 235.331 2.341 20 0 BEADLO CC[C@@H](NCc1[nH]c(C)c(C)[nH+]1)C(F)F ZINC000573386488 364821462 /nfs/dbraw/zinc/82/14/62/364821462.db2.gz CPJUKIWRVKFEJV-MRVPVSSYSA-N 1 2 217.263 2.160 20 0 BEADLO Cc1cc(CNC(=O)c2ccsn2)cc(C)[nH+]1 ZINC000573792347 364916066 /nfs/dbraw/zinc/91/60/66/364916066.db2.gz BENJQPKNCJRIHB-UHFFFAOYSA-N 1 2 247.323 2.085 20 0 BEADLO CC(C)n1ccc(C[NH2+][C@H](C)c2cnccn2)n1 ZINC000573866451 364935507 /nfs/dbraw/zinc/93/55/07/364935507.db2.gz SBDZIDCXSUGVSM-LLVKDONJSA-N 1 2 245.330 2.105 20 0 BEADLO CCn1ccc(NCc2c[nH+]cn2C(C)C)n1 ZINC000305987823 541403012 /nfs/dbraw/zinc/40/30/12/541403012.db2.gz NJELKVOQSMKYKA-UHFFFAOYSA-N 1 2 233.319 2.293 20 0 BEADLO Cc1nc(N2CCC[C@H]([C@@H]3CCOC3)C2)cc[nH+]1 ZINC000439073513 201433524 /nfs/dbraw/zinc/43/35/24/201433524.db2.gz CPUKMSPBMIBMRC-QWHCGFSZSA-N 1 2 247.342 2.038 20 0 BEADLO CC(C)[C@H]1CCN1C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000574092435 364985951 /nfs/dbraw/zinc/98/59/51/364985951.db2.gz TZBQTKCOGWMZSG-NWDGAFQWSA-N 1 2 235.331 2.091 20 0 BEADLO Cc1nc(N2CC[C@@H](c3cccnc3)C2)cc[nH+]1 ZINC000574152884 364997019 /nfs/dbraw/zinc/99/70/19/364997019.db2.gz CIJQNCPCTYVHNV-CYBMUJFWSA-N 1 2 240.310 2.174 20 0 BEADLO CO[C@]1(C)CCCN(c2nc(C)[nH+]cc2C)C1 ZINC000574413691 365057366 /nfs/dbraw/zinc/05/73/66/365057366.db2.gz HMSRLVHRYAPUSE-CYBMUJFWSA-N 1 2 235.331 2.099 20 0 BEADLO C[C@@H](C[S@@](C)=O)Nc1[nH+]ccc2ccccc21 ZINC000169068443 365067938 /nfs/dbraw/zinc/06/79/38/365067938.db2.gz BWSFCUKPECDVLV-BTDLBPIBSA-N 1 2 248.351 2.414 20 0 BEADLO COc1cc(C)c(CNc2c[nH]c[nH+]2)cc1OC ZINC000574327730 365038942 /nfs/dbraw/zinc/03/89/42/365038942.db2.gz MDCFYIVCVLVAOR-UHFFFAOYSA-N 1 2 247.298 2.347 20 0 BEADLO Cc1cc(C)cc(N(C)C(=O)Cn2cc[nH+]c2)c1 ZINC000574495682 365073351 /nfs/dbraw/zinc/07/33/51/365073351.db2.gz FYYPCDUMNQJFJH-UHFFFAOYSA-N 1 2 243.310 2.163 20 0 BEADLO Cc1ccoc1C[N@@H+](C)Cc1snnc1C ZINC000575063304 365184111 /nfs/dbraw/zinc/18/41/11/365184111.db2.gz QGVLYZIQVIXZTF-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1ccoc1C[N@H+](C)Cc1snnc1C ZINC000575063304 365184118 /nfs/dbraw/zinc/18/41/18/365184118.db2.gz QGVLYZIQVIXZTF-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO O=C1CC[N@H+](Cc2ccccn2)C2(CCC2)C1 ZINC000574769285 365141497 /nfs/dbraw/zinc/14/14/97/365141497.db2.gz VWFYCGIXSSFWKR-UHFFFAOYSA-N 1 2 230.311 2.169 20 0 BEADLO O=C1CC[N@@H+](Cc2ccccn2)C2(CCC2)C1 ZINC000574769285 365141503 /nfs/dbraw/zinc/14/15/03/365141503.db2.gz VWFYCGIXSSFWKR-UHFFFAOYSA-N 1 2 230.311 2.169 20 0 BEADLO CCC1CN(C(=O)c2ccn3c(C)c[nH+]c3c2)C1 ZINC000575070934 365187131 /nfs/dbraw/zinc/18/71/31/365187131.db2.gz JAWBJOVOPLWSEM-UHFFFAOYSA-N 1 2 243.310 2.125 20 0 BEADLO CC[C@@H](c1ccccc1)[NH+]1CCS(=O)CC1 ZINC000171700477 365227532 /nfs/dbraw/zinc/22/75/32/365227532.db2.gz XBJWRYYWYGBHKX-ZDUSSCGKSA-N 1 2 237.368 2.202 20 0 BEADLO CC(C)(C(=O)NCc1c[nH+]c[nH]1)c1cccs1 ZINC000443541718 193023813 /nfs/dbraw/zinc/02/38/13/193023813.db2.gz ULENFZJRMLRAKV-UHFFFAOYSA-N 1 2 249.339 2.065 20 0 BEADLO CC(C)(C(=O)NCc1c[nH]c[nH+]1)c1cccs1 ZINC000443541718 193023816 /nfs/dbraw/zinc/02/38/16/193023816.db2.gz ULENFZJRMLRAKV-UHFFFAOYSA-N 1 2 249.339 2.065 20 0 BEADLO C[C@@H](NC(=O)C1=CCCCC1)c1[nH]cc[nH+]1 ZINC000575429012 365318546 /nfs/dbraw/zinc/31/85/46/365318546.db2.gz GWDPJXLPQDXVGS-SECBINFHSA-N 1 2 219.288 2.087 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCCOC1CCCC1 ZINC000576034948 365457509 /nfs/dbraw/zinc/45/75/09/365457509.db2.gz XFLFNGOPSQAURA-UHFFFAOYSA-N 1 2 249.358 2.277 20 0 BEADLO CCC(CC)CC(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000576121546 365494356 /nfs/dbraw/zinc/49/43/56/365494356.db2.gz GCCBBEQZVKCSDL-SECBINFHSA-N 1 2 223.320 2.413 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000576164286 365505946 /nfs/dbraw/zinc/50/59/46/365505946.db2.gz SIVDXJUWDRQRRI-SRVKXCTJSA-N 1 2 237.347 2.385 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)C2CC(C)C2)[nH+]1 ZINC000579723103 366991627 /nfs/dbraw/zinc/99/16/27/366991627.db2.gz XGIRYGQIFAYYRX-UHFFFAOYSA-N 1 2 235.331 2.116 20 0 BEADLO CCCn1cc(C[N@H+](C)Cc2cccnc2)cn1 ZINC000183658968 367035089 /nfs/dbraw/zinc/03/50/89/367035089.db2.gz ASWNMJRCNYWHTR-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CCCn1cc(C[N@@H+](C)Cc2cccnc2)cn1 ZINC000183658968 367035093 /nfs/dbraw/zinc/03/50/93/367035093.db2.gz ASWNMJRCNYWHTR-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO C[C@H]([NH2+]Cc1nnc2n1CCCC2)c1ccoc1 ZINC000184915910 367109921 /nfs/dbraw/zinc/10/99/21/367109921.db2.gz IGIVSDPADKOXPW-JTQLQIEISA-N 1 2 246.314 2.058 20 0 BEADLO COc1cc[nH+]cc1NC(=O)Nc1cc(C)on1 ZINC000194914459 367324507 /nfs/dbraw/zinc/32/45/07/367324507.db2.gz KKIJAXBYGVOQAN-UHFFFAOYSA-N 1 2 248.242 2.031 20 0 BEADLO CCn1nc(C)c(C[NH2+]CC(C)(F)F)c1C ZINC000382199264 367497510 /nfs/dbraw/zinc/49/75/10/367497510.db2.gz DQAOKGYWPMGKOZ-UHFFFAOYSA-N 1 2 231.290 2.265 20 0 BEADLO Fc1ccccc1C1([NH2+]Cc2cnccn2)CC1 ZINC000581534185 367552977 /nfs/dbraw/zinc/55/29/77/367552977.db2.gz VOJOCZRDVCKWET-UHFFFAOYSA-N 1 2 243.285 2.395 20 0 BEADLO C=COc1ccc(NC(=O)Cn2cc[nH+]c2)cc1 ZINC001642383852 1172353626 /nfs/dbraw/zinc/35/36/26/1172353626.db2.gz LUFCDJNRBAPGPX-UHFFFAOYSA-N 1 2 243.266 2.044 20 0 BEADLO Cc1ccc(N[C@@H]2C[C@@H](C)O[C@H]2C)c[nH+]1 ZINC000384650976 367711843 /nfs/dbraw/zinc/71/18/43/367711843.db2.gz UNQPYYKGBGQIOZ-JFGNBEQYSA-N 1 2 206.289 2.368 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1NC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000581834614 367839111 /nfs/dbraw/zinc/83/91/11/367839111.db2.gz UTEHFKZPPVJFOX-MPKXVKKWSA-N 1 2 249.358 2.139 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1NC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000581834614 367839118 /nfs/dbraw/zinc/83/91/18/367839118.db2.gz UTEHFKZPPVJFOX-MPKXVKKWSA-N 1 2 249.358 2.139 20 0 BEADLO COc1cccc(CNc2nc(C)[nH+]cc2C)c1 ZINC000581914610 367900531 /nfs/dbraw/zinc/90/05/31/367900531.db2.gz OKEWKMFMGBNNRE-UHFFFAOYSA-N 1 2 243.310 2.136 20 0 BEADLO CC[C@H](Nc1ccc2ccccc2[nH+]1)[C@H](C)O ZINC000386714656 368011696 /nfs/dbraw/zinc/01/16/96/368011696.db2.gz QJZHWHLMEHZFQH-JQWIXIFHSA-N 1 2 230.311 2.228 20 0 BEADLO Cc1c[nH+]c(C)nc1NC[C@@H]1CCCSC1 ZINC000581954082 368019676 /nfs/dbraw/zinc/01/96/76/368019676.db2.gz IZAQGGDACFMMNG-NSHDSACASA-N 1 2 237.372 2.070 20 0 BEADLO CN(C)c1ccc(NCc2cncc(F)c2)c[nH+]1 ZINC000387216028 368110960 /nfs/dbraw/zinc/11/09/60/368110960.db2.gz RGQNCAVKRYKRAU-UHFFFAOYSA-N 1 2 246.289 2.294 20 0 BEADLO CC(C)(C)c1nc(C[NH+]2C3CCC2CC3)no1 ZINC000642525189 368173408 /nfs/dbraw/zinc/17/34/08/368173408.db2.gz GCHVBJDDCWEZPG-UHFFFAOYSA-N 1 2 235.331 2.494 20 0 BEADLO Cc1cc(C)c(CNC(=O)N[C@H](C)C2CC2)c[nH+]1 ZINC000454187152 202797520 /nfs/dbraw/zinc/79/75/20/202797520.db2.gz CNDPSUHARHCHTI-LLVKDONJSA-N 1 2 247.342 2.296 20 0 BEADLO CCCCCC(=O)NCc1ccc(N(C)C)[nH+]c1 ZINC000046387608 368443010 /nfs/dbraw/zinc/44/30/10/368443010.db2.gz QPMDGDOJQADEIM-UHFFFAOYSA-N 1 2 249.358 2.344 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@@H](C)CC(C)C)no1 ZINC000045943806 368433497 /nfs/dbraw/zinc/43/34/97/368433497.db2.gz DGTNZKLBWWIDAY-VIFPVBQESA-N 1 2 211.309 2.244 20 0 BEADLO Cc1nc(C[N@H+](C)[C@@H](C)CC(C)C)no1 ZINC000045943806 368433501 /nfs/dbraw/zinc/43/35/01/368433501.db2.gz DGTNZKLBWWIDAY-VIFPVBQESA-N 1 2 211.309 2.244 20 0 BEADLO c1ccc(NCCc2ccc3c(c2)OCO3)[nH+]c1 ZINC000061173858 368560149 /nfs/dbraw/zinc/56/01/49/368560149.db2.gz HQNSBEUJUQHZIW-UHFFFAOYSA-N 1 2 242.278 2.465 20 0 BEADLO CCOc1nnc(C[N@H+](C)[C@@H](C)C2CC2)s1 ZINC000063615673 368591455 /nfs/dbraw/zinc/59/14/55/368591455.db2.gz XBVGGGIFUQWRGH-QMMMGPOBSA-N 1 2 241.360 2.167 20 0 BEADLO CCOc1nnc(C[N@@H+](C)[C@@H](C)C2CC2)s1 ZINC000063615673 368591461 /nfs/dbraw/zinc/59/14/61/368591461.db2.gz XBVGGGIFUQWRGH-QMMMGPOBSA-N 1 2 241.360 2.167 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)c1[nH]ccc1C ZINC000456353503 202938735 /nfs/dbraw/zinc/93/87/35/202938735.db2.gz MPWYJXHFYIBTLP-JTQLQIEISA-N 1 2 246.314 2.031 20 0 BEADLO CCC[C@@H]1[C@H](C)CCCN1C(=O)Cn1cc[nH+]c1 ZINC000081473001 368601731 /nfs/dbraw/zinc/60/17/31/368601731.db2.gz UNEUSRYLMRZRFR-CHWSQXEVSA-N 1 2 249.358 2.310 20 0 BEADLO Cc1cc(C[N@H+](C)CCC(F)(F)F)on1 ZINC000064635083 368609875 /nfs/dbraw/zinc/60/98/75/368609875.db2.gz XZSIFBKHNMRPTO-UHFFFAOYSA-N 1 2 222.210 2.367 20 0 BEADLO Cc1cc(C[N@@H+](C)CCC(F)(F)F)on1 ZINC000064635083 368609881 /nfs/dbraw/zinc/60/98/81/368609881.db2.gz XZSIFBKHNMRPTO-UHFFFAOYSA-N 1 2 222.210 2.367 20 0 BEADLO CCO[C@H](C)C(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC000065514305 368623550 /nfs/dbraw/zinc/62/35/50/368623550.db2.gz QWHTUYAOXOMWBD-MRVPVSSYSA-N 1 2 247.298 2.235 20 0 BEADLO CCO[C@H](C)C(=O)Nc1ccc2[nH+]c(C)[nH]c2c1 ZINC000065514305 368623553 /nfs/dbraw/zinc/62/35/53/368623553.db2.gz QWHTUYAOXOMWBD-MRVPVSSYSA-N 1 2 247.298 2.235 20 0 BEADLO CCCc1nc(C[N@H+](C(C)C)C2CC2)no1 ZINC000065588507 368625280 /nfs/dbraw/zinc/62/52/80/368625280.db2.gz PVBFZZYVSPMOQZ-UHFFFAOYSA-N 1 2 223.320 2.395 20 0 BEADLO CCCc1nc(C[N@@H+](C(C)C)C2CC2)no1 ZINC000065588507 368625287 /nfs/dbraw/zinc/62/52/87/368625287.db2.gz PVBFZZYVSPMOQZ-UHFFFAOYSA-N 1 2 223.320 2.395 20 0 BEADLO CC[C@@H](C)C(=O)NCc1c[nH+]c(C)cc1C ZINC000456860965 202986419 /nfs/dbraw/zinc/98/64/19/202986419.db2.gz OJRKFKBOPNDPAP-SECBINFHSA-N 1 2 220.316 2.361 20 0 BEADLO C[C@H](CC(C)(C)C)NC(=O)CCn1cc[nH+]c1 ZINC000457237932 203025806 /nfs/dbraw/zinc/02/58/06/203025806.db2.gz VNGLWNCAEQDNDU-LLVKDONJSA-N 1 2 237.347 2.214 20 0 BEADLO C[C@H]1CCCC[C@@]1(C)NC(=O)CCn1cc[nH+]c1 ZINC000457249426 203027748 /nfs/dbraw/zinc/02/77/48/203027748.db2.gz IWDKWWVNAZIUMT-GXTWGEPZSA-N 1 2 249.358 2.358 20 0 BEADLO CCOC(=O)C[N@H+](C)[C@H](C)Cc1ccsc1 ZINC000081599116 370904379 /nfs/dbraw/zinc/90/43/79/370904379.db2.gz QEVMMYKGLRLKIH-SNVBAGLBSA-N 1 2 241.356 2.174 20 0 BEADLO CCOC(=O)C[N@@H+](C)[C@H](C)Cc1ccsc1 ZINC000081599116 370904385 /nfs/dbraw/zinc/90/43/85/370904385.db2.gz QEVMMYKGLRLKIH-SNVBAGLBSA-N 1 2 241.356 2.174 20 0 BEADLO Cc1ccc(NC(=O)c2ncccc2F)c(C)[nH+]1 ZINC000622425783 370914045 /nfs/dbraw/zinc/91/40/45/370914045.db2.gz MSWBPRJNNHMCLE-UHFFFAOYSA-N 1 2 245.257 2.485 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)[C@H]2C[C@H]3C[C@H]3C2)c2[nH+]ccn21 ZINC000615963986 368800958 /nfs/dbraw/zinc/80/09/58/368800958.db2.gz UVVSBCINGJJOQO-GCHJQGSQSA-N 1 2 245.326 2.051 20 0 BEADLO NC(=O)Nc1ccc(CNc2cccc[nH+]2)cc1 ZINC000073448604 368806366 /nfs/dbraw/zinc/80/63/66/368806366.db2.gz FEMABCNBVCIYPZ-UHFFFAOYSA-N 1 2 242.282 2.184 20 0 BEADLO CC(C)[C@@H]1CCCN(C(=O)Cn2cc[nH+]c2)CC1 ZINC000073726735 368813624 /nfs/dbraw/zinc/81/36/24/368813624.db2.gz XHBNBTQSGYZUIG-CYBMUJFWSA-N 1 2 249.358 2.168 20 0 BEADLO O=C(Cn1cc[nH+]c1)N1CCC[C@H]1C1CCCC1 ZINC000073016637 368790042 /nfs/dbraw/zinc/79/00/42/368790042.db2.gz FRDJEWKAXFGHAV-ZDUSSCGKSA-N 1 2 247.342 2.064 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)C2CC3(CC3)C2)c2[nH+]ccn21 ZINC000615962808 368797917 /nfs/dbraw/zinc/79/79/17/368797917.db2.gz IGJLFSCRROJKOT-KOLCDFICSA-N 1 2 245.326 2.195 20 0 BEADLO CC(C)n1ccc(C[NH2+]Cc2ccccn2)n1 ZINC000084225497 368852467 /nfs/dbraw/zinc/85/24/67/368852467.db2.gz RDNJZBLOHWWHNP-UHFFFAOYSA-N 1 2 230.315 2.149 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1[C@@H](C)CCC1(C)C ZINC000616164548 368999221 /nfs/dbraw/zinc/99/92/21/368999221.db2.gz FDHMVANATMPWSC-VIFPVBQESA-N 1 2 235.331 2.050 20 0 BEADLO CC(C)CCCCC(=O)NCc1c[nH+]c[nH]1 ZINC000457580911 203076403 /nfs/dbraw/zinc/07/64/03/203076403.db2.gz PPSBOJDKWOEPSD-UHFFFAOYSA-N 1 2 223.320 2.242 20 0 BEADLO CC(C)CCCCC(=O)NCc1c[nH]c[nH+]1 ZINC000457580911 203076406 /nfs/dbraw/zinc/07/64/06/203076406.db2.gz PPSBOJDKWOEPSD-UHFFFAOYSA-N 1 2 223.320 2.242 20 0 BEADLO C[C@H](C(=O)N(C)CCCn1cc[nH+]c1)C1CCC1 ZINC000457656865 203086551 /nfs/dbraw/zinc/08/65/51/203086551.db2.gz QZKLXSMIAIUXJX-LBPRGKRZSA-N 1 2 249.358 2.168 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NCCCC1CCC1 ZINC000618614837 369184573 /nfs/dbraw/zinc/18/45/73/369184573.db2.gz QGMDMAFKVHRLGI-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NCCCC1CCC1 ZINC000618614837 369184579 /nfs/dbraw/zinc/18/45/79/369184579.db2.gz QGMDMAFKVHRLGI-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO CCCC(=O)Nc1c[nH+]c2c(C)cccn12 ZINC000619011091 369257336 /nfs/dbraw/zinc/25/73/36/369257336.db2.gz PMSRIEDIFRBISH-UHFFFAOYSA-N 1 2 217.272 2.381 20 0 BEADLO Cc1cccn2c(NC(=O)C(C)C)c[nH+]c12 ZINC000619011552 369257420 /nfs/dbraw/zinc/25/74/20/369257420.db2.gz VRSQWHKDZHIODC-UHFFFAOYSA-N 1 2 217.272 2.237 20 0 BEADLO CC[C@@H](OC)C(=O)Nc1c[nH+]c2c(C)cccn12 ZINC000619013784 369257485 /nfs/dbraw/zinc/25/74/85/369257485.db2.gz YTHCRDGFUNITIF-SNVBAGLBSA-N 1 2 247.298 2.006 20 0 BEADLO Cc1cccn2c(NC(=O)C3(C)CC3)c[nH+]c12 ZINC000619014728 369258779 /nfs/dbraw/zinc/25/87/79/369258779.db2.gz SCQVSRWOBBWWSN-UHFFFAOYSA-N 1 2 229.283 2.381 20 0 BEADLO CCC(F)(F)C[NH2+][C@H]1C[C@@H](C)N(C2CC2)C1 ZINC000623680129 369381517 /nfs/dbraw/zinc/38/15/17/369381517.db2.gz YSEZFOLMYHDXES-ZJUUUORDSA-N 1 2 232.318 2.247 20 0 BEADLO COC1C[NH+](Cc2ccc([C@H]3C[C@H]3C)o2)C1 ZINC000459588115 203307161 /nfs/dbraw/zinc/30/71/61/203307161.db2.gz VVHCXINWBXXGRI-SKDRFNHKSA-N 1 2 221.300 2.234 20 0 BEADLO COC1C[NH+](C/C=C\c2ccc(F)c(F)c2)C1 ZINC000459587490 203307896 /nfs/dbraw/zinc/30/78/96/203307896.db2.gz VJXVOEPKKHKQHB-IHWYPQMZSA-N 1 2 239.265 2.309 20 0 BEADLO CCC1(CC)C[NH+](Cc2ncc(C)n2C)C1 ZINC000459601183 203312382 /nfs/dbraw/zinc/31/23/82/203312382.db2.gz WNUKQFSDSVCCCV-UHFFFAOYSA-N 1 2 221.348 2.351 20 0 BEADLO CCC1(CC)CN(Cc2[nH+]cc(C)n2C)C1 ZINC000459601183 203312385 /nfs/dbraw/zinc/31/23/85/203312385.db2.gz WNUKQFSDSVCCCV-UHFFFAOYSA-N 1 2 221.348 2.351 20 0 BEADLO COC1C[NH+](Cc2cc(C)cc(Cl)c2)C1 ZINC000459573828 203303812 /nfs/dbraw/zinc/30/38/12/203303812.db2.gz CILXYKFPACSKLI-UHFFFAOYSA-N 1 2 225.719 2.479 20 0 BEADLO CCC(F)(F)C[NH2+]Cc1cnc(C2CC2)nc1 ZINC000623679226 369379076 /nfs/dbraw/zinc/37/90/76/369379076.db2.gz NEWLVEOBVQGJAG-UHFFFAOYSA-N 1 2 241.285 2.489 20 0 BEADLO CCc1ncc(C[NH2+]CC(F)(F)CC)cn1 ZINC000623679144 369379143 /nfs/dbraw/zinc/37/91/43/369379143.db2.gz JXFZOHHFTKEKSM-UHFFFAOYSA-N 1 2 229.274 2.174 20 0 BEADLO Cn1nccc1C[NH+]1CC(C)(CC(F)(F)F)C1 ZINC000459645489 203328911 /nfs/dbraw/zinc/32/89/11/203328911.db2.gz ZGOJXPOQKOSFSD-UHFFFAOYSA-N 1 2 247.264 2.194 20 0 BEADLO CC[C@H](CO)Nc1cc2ccccc2c[nH+]1 ZINC000631031970 370970221 /nfs/dbraw/zinc/97/02/21/370970221.db2.gz OUSYWZVEKRTBEL-GFCCVEGCSA-N 1 2 216.284 2.418 20 0 BEADLO CCc1ccc(C[NH2+][C@@H](C)c2ccn(C)n2)o1 ZINC000459740574 203350216 /nfs/dbraw/zinc/35/02/16/203350216.db2.gz FAEPCSHQEIJNAE-JTQLQIEISA-N 1 2 233.315 2.426 20 0 BEADLO CC(C)(C)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000082277446 370978293 /nfs/dbraw/zinc/97/82/93/370978293.db2.gz XVLOEPCOIRLBAH-NSHDSACASA-N 1 2 235.331 2.093 20 0 BEADLO Cc1cc(N)nc(S[C@H](C)c2ccncc2)[nH+]1 ZINC000619950607 369641657 /nfs/dbraw/zinc/64/16/57/369641657.db2.gz ZZYVAMSFCZERCF-SECBINFHSA-N 1 2 246.339 2.446 20 0 BEADLO CCC(C)(C)N(C)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000567993090 326293203 /nfs/dbraw/zinc/29/32/03/326293203.db2.gz FKNCMZIHRHOTRE-NSHDSACASA-N 1 2 237.347 2.481 20 0 BEADLO CC(C)CC1(NC(=O)CCc2c[nH+]c[nH]2)CC1 ZINC000620284424 369799907 /nfs/dbraw/zinc/79/99/07/369799907.db2.gz BDXBFCXCCKUICG-UHFFFAOYSA-N 1 2 235.331 2.037 20 0 BEADLO CC(C)CC1(NC(=O)CCc2c[nH]c[nH+]2)CC1 ZINC000620284424 369799909 /nfs/dbraw/zinc/79/99/09/369799909.db2.gz BDXBFCXCCKUICG-UHFFFAOYSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H](NC(=O)C1=CCCCCC1)c1[nH+]ccn1C ZINC000620603287 369951478 /nfs/dbraw/zinc/95/14/78/369951478.db2.gz GOPWFCVMSBSEJI-LLVKDONJSA-N 1 2 247.342 2.488 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620604925 369952632 /nfs/dbraw/zinc/95/26/32/369952632.db2.gz XEUOHTZMVMMOBT-HBNTYKKESA-N 1 2 237.347 2.280 20 0 BEADLO Cc1cc(C)c(C(=O)N[C@@H](C)c2[nH+]ccn2C)o1 ZINC000620604458 369952791 /nfs/dbraw/zinc/95/27/91/369952791.db2.gz TZMTYHSMBKTAMR-JTQLQIEISA-N 1 2 247.298 2.121 20 0 BEADLO C[C@H](NC(=O)C1C(C)(C)C1(C)C)c1[nH+]ccn1C ZINC000620604378 369952968 /nfs/dbraw/zinc/95/29/68/369952968.db2.gz SVHDSMDREXYZAK-VIFPVBQESA-N 1 2 249.358 2.280 20 0 BEADLO CCc1occc1C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620606574 369954854 /nfs/dbraw/zinc/95/48/54/369954854.db2.gz WTGKKVGZFODIGO-SECBINFHSA-N 1 2 247.298 2.067 20 0 BEADLO C[C@H](NC(=O)[C@@H]1CC[C@H]2C[C@H]2C1)c1[nH+]ccn1C ZINC000620610231 369956571 /nfs/dbraw/zinc/95/65/71/369956571.db2.gz GLRKRNYMMMSITN-YFKTTZPYSA-N 1 2 247.342 2.034 20 0 BEADLO C[C@H](NC(=O)[C@@H]1CCC[C@H]2C[C@H]21)c1[nH+]ccn1C ZINC000620611669 369958439 /nfs/dbraw/zinc/95/84/39/369958439.db2.gz NCTHWSBVFPEFFE-NNYUYHANSA-N 1 2 247.342 2.034 20 0 BEADLO CCCOCC(=O)Nc1ccn2cc(C)[nH+]c2c1 ZINC000620649126 369972749 /nfs/dbraw/zinc/97/27/49/369972749.db2.gz USTUBRIWLJYQLN-UHFFFAOYSA-N 1 2 247.298 2.008 20 0 BEADLO CCCCCC(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620596364 369947833 /nfs/dbraw/zinc/94/78/33/369947833.db2.gz OAEIXHYRPYOGRF-SNVBAGLBSA-N 1 2 223.320 2.178 20 0 BEADLO CCC(CC)C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620596386 369947898 /nfs/dbraw/zinc/94/78/98/369947898.db2.gz OGPQIPVBXIMDFX-VIFPVBQESA-N 1 2 223.320 2.034 20 0 BEADLO CC(C)CC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000074859404 370048220 /nfs/dbraw/zinc/04/82/20/370048220.db2.gz NYKIWUXLPVMGLY-UHFFFAOYSA-N 1 2 217.272 2.319 20 0 BEADLO Cc1nsc(C)c1C[N@@H+]1CCOCC1(C)C ZINC000568169125 326318849 /nfs/dbraw/zinc/31/88/49/326318849.db2.gz CAKADARDHRJYGW-UHFFFAOYSA-N 1 2 240.372 2.371 20 0 BEADLO Cc1nsc(C)c1C[N@H+]1CCOCC1(C)C ZINC000568169125 326318852 /nfs/dbraw/zinc/31/88/52/326318852.db2.gz CAKADARDHRJYGW-UHFFFAOYSA-N 1 2 240.372 2.371 20 0 BEADLO CCc1cnc(C[N@@H+]2CCS[C@H](C)C2)o1 ZINC000075715419 370169385 /nfs/dbraw/zinc/16/93/85/370169385.db2.gz VJMFQPNBMYODJX-SECBINFHSA-N 1 2 226.345 2.174 20 0 BEADLO CCc1cnc(C[N@H+]2CCS[C@H](C)C2)o1 ZINC000075715419 370169389 /nfs/dbraw/zinc/16/93/89/370169389.db2.gz VJMFQPNBMYODJX-SECBINFHSA-N 1 2 226.345 2.174 20 0 BEADLO C[C@H]1C[NH+](Cc2ccncc2Cl)C[C@H](C)O1 ZINC000075589657 370146827 /nfs/dbraw/zinc/14/68/27/370146827.db2.gz LLKPVPQTCNVNCD-UWVGGRQHSA-N 1 2 240.734 2.344 20 0 BEADLO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1nccnc1C ZINC000621335236 370269882 /nfs/dbraw/zinc/26/98/82/370269882.db2.gz GQYKTTCYMOAUGX-SECBINFHSA-N 1 2 246.314 2.241 20 0 BEADLO CCO[C@H](CC)C(=O)Nc1cc[nH+]c(C)c1 ZINC000112298650 370276274 /nfs/dbraw/zinc/27/62/74/370276274.db2.gz FPFXXZYAYZMONF-LLVKDONJSA-N 1 2 222.288 2.144 20 0 BEADLO Cc1nccnc1C[N@H+]1CCOC[C@H]1CC(C)C ZINC000621715636 370463565 /nfs/dbraw/zinc/46/35/65/370463565.db2.gz BDLOBTKSUIPAOD-CYBMUJFWSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1nccnc1C[N@@H+]1CCOC[C@H]1CC(C)C ZINC000621715636 370463567 /nfs/dbraw/zinc/46/35/67/370463567.db2.gz BDLOBTKSUIPAOD-CYBMUJFWSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1nccnc1C[N@@H+](C)[C@H](C)c1cccnc1 ZINC000621722027 370474171 /nfs/dbraw/zinc/47/41/71/370474171.db2.gz JDJNHMGAKPMUKD-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1nccnc1C[N@H+](C)[C@H](C)c1cccnc1 ZINC000621722027 370474174 /nfs/dbraw/zinc/47/41/74/370474174.db2.gz JDJNHMGAKPMUKD-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO CCOc1cncc(C[N@@H+]2CCC[C@@H](F)C2)c1 ZINC000621732182 370486234 /nfs/dbraw/zinc/48/62/34/370486234.db2.gz RBXUFQKUCGBJAN-GFCCVEGCSA-N 1 2 238.306 2.414 20 0 BEADLO CCOc1cncc(C[N@H+]2CCC[C@@H](F)C2)c1 ZINC000621732182 370486236 /nfs/dbraw/zinc/48/62/36/370486236.db2.gz RBXUFQKUCGBJAN-GFCCVEGCSA-N 1 2 238.306 2.414 20 0 BEADLO CCOc1cncc(C[N@@H+]2CCC[C@H](F)C2)c1 ZINC000621732183 370486372 /nfs/dbraw/zinc/48/63/72/370486372.db2.gz RBXUFQKUCGBJAN-LBPRGKRZSA-N 1 2 238.306 2.414 20 0 BEADLO CCOc1cncc(C[N@H+]2CCC[C@H](F)C2)c1 ZINC000621732183 370486373 /nfs/dbraw/zinc/48/63/73/370486373.db2.gz RBXUFQKUCGBJAN-LBPRGKRZSA-N 1 2 238.306 2.414 20 0 BEADLO CC1(c2ccccc2)C[NH+](Cc2cc[nH]n2)C1 ZINC000621734913 370491916 /nfs/dbraw/zinc/49/19/16/370491916.db2.gz ZKTVWDOZYOHFKY-UHFFFAOYSA-N 1 2 227.311 2.183 20 0 BEADLO Cc1nc(NC[C@](C)(O)CCC(C)C)cc[nH+]1 ZINC000078300901 370549473 /nfs/dbraw/zinc/54/94/73/370549473.db2.gz YCVSRRWRNHJAOK-CYBMUJFWSA-N 1 2 237.347 2.384 20 0 BEADLO CCc1cc(NCC(C)(C)C[C@@H](C)O)nc[nH+]1 ZINC000078339800 370552605 /nfs/dbraw/zinc/55/26/05/370552605.db2.gz BMZWBDQXGLRUIN-SNVBAGLBSA-N 1 2 237.347 2.248 20 0 BEADLO CN(CC(C)(C)C)C(=O)C(C)(C)c1c[nH+]c[nH]1 ZINC000621831705 370553589 /nfs/dbraw/zinc/55/35/89/370553589.db2.gz RTFIFJDIOIXOCB-UHFFFAOYSA-N 1 2 237.347 2.192 20 0 BEADLO CC(C)(C(=O)N1CCC(C)(C)CC1)c1c[nH+]c[nH]1 ZINC000621835373 370556324 /nfs/dbraw/zinc/55/63/24/370556324.db2.gz YNLKCXLXBNKMRI-UHFFFAOYSA-N 1 2 249.358 2.336 20 0 BEADLO CCOC(=O)C[C@@H](C)Nc1cc(C2CC2)[nH+]cn1 ZINC000260553203 370998860 /nfs/dbraw/zinc/99/88/60/370998860.db2.gz VXEAEYKOPVRHMR-SECBINFHSA-N 1 2 249.314 2.108 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1ccc2c(c1)CCC2 ZINC000070502002 371038356 /nfs/dbraw/zinc/03/83/56/371038356.db2.gz AVIDZTMGIWTENL-UHFFFAOYSA-N 1 2 247.338 2.170 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1ccc2c(c1)CCC2 ZINC000070502002 371038362 /nfs/dbraw/zinc/03/83/62/371038362.db2.gz AVIDZTMGIWTENL-UHFFFAOYSA-N 1 2 247.338 2.170 20 0 BEADLO CCCC[NH2+][C@H](Cc1ccccc1)C(=O)OC ZINC000125214787 371303079 /nfs/dbraw/zinc/30/30/79/371303079.db2.gz KSSYFLBKFSTZDB-CYBMUJFWSA-N 1 2 235.327 2.160 20 0 BEADLO CCCCc1cc(NCc2cc(C)no2)nc[nH+]1 ZINC000631076347 371368180 /nfs/dbraw/zinc/36/81/80/371368180.db2.gz XVLARGGTTUXJBL-UHFFFAOYSA-N 1 2 246.314 2.150 20 0 BEADLO COCCOCCNc1cc2ccccc2c[nH+]1 ZINC000631073422 371340151 /nfs/dbraw/zinc/34/01/51/371340151.db2.gz MXSXPCQNAVTIHE-UHFFFAOYSA-N 1 2 246.310 2.310 20 0 BEADLO CCC(F)(F)C[NH2+][C@H]1CN(C2CC2)C[C@H]1C ZINC000624147623 371341694 /nfs/dbraw/zinc/34/16/94/371341694.db2.gz GMSLGFYXPVDDDF-KOLCDFICSA-N 1 2 232.318 2.104 20 0 BEADLO CCC(F)(F)C[NH2+][C@@H](C)c1cn(C)nc1C ZINC000624147857 371342874 /nfs/dbraw/zinc/34/28/74/371342874.db2.gz NDNFZSYCZPECDN-QMMMGPOBSA-N 1 2 231.290 2.424 20 0 BEADLO CCC(F)(F)C[NH2+][C@H](C)c1ccnn1C ZINC000624148910 371346286 /nfs/dbraw/zinc/34/62/86/371346286.db2.gz QXWHWPSOYBZNTR-MRVPVSSYSA-N 1 2 217.263 2.116 20 0 BEADLO CC[C@@H]([NH2+][C@@H](CC)COC)C(=O)OC(C)(C)C ZINC000572908598 326418455 /nfs/dbraw/zinc/41/84/55/326418455.db2.gz JNWIWJROWBMBOW-WDEREUQCSA-N 1 2 245.363 2.121 20 0 BEADLO CC(C)c1nc(N[C@@H](C)[C@@H](C)CO)cc[nH+]1 ZINC000156660170 371484161 /nfs/dbraw/zinc/48/41/61/371484161.db2.gz YMCNBYWAAKSZFB-UWVGGRQHSA-N 1 2 223.320 2.029 20 0 BEADLO COc1ccc[nH+]c1N1CC[C@@H](C)O[C@@H](C)C1 ZINC000624401099 371500325 /nfs/dbraw/zinc/50/03/25/371500325.db2.gz JBABJSCNIDFHOR-MNOVXSKESA-N 1 2 236.315 2.094 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1CCC[C@H](C)O1 ZINC000624399633 371500684 /nfs/dbraw/zinc/50/06/84/371500684.db2.gz RASKYRUOUVPZOG-QWRGUYRKSA-N 1 2 236.315 2.460 20 0 BEADLO CCCC1(C(=O)N2CCc3[nH]c[nH+]c3C2)CCC1 ZINC000627369445 371589051 /nfs/dbraw/zinc/58/90/51/371589051.db2.gz TUBCFAOTTDSVHN-UHFFFAOYSA-N 1 2 247.342 2.265 20 0 BEADLO CCCC1(C(=O)N2CCc3[nH+]c[nH]c3C2)CCC1 ZINC000627369445 371589055 /nfs/dbraw/zinc/58/90/55/371589055.db2.gz TUBCFAOTTDSVHN-UHFFFAOYSA-N 1 2 247.342 2.265 20 0 BEADLO C[C@H]1CCCC[C@@H]1C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627373263 371592995 /nfs/dbraw/zinc/59/29/95/371592995.db2.gz MELSYANKAOYIFV-QWRGUYRKSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@H]1CCCC[C@@H]1C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627373263 371593000 /nfs/dbraw/zinc/59/30/00/371593000.db2.gz MELSYANKAOYIFV-QWRGUYRKSA-N 1 2 247.342 2.121 20 0 BEADLO Nc1nc(NCCC2CC2)[nH+]c2ccccc12 ZINC000301892800 181786942 /nfs/dbraw/zinc/78/69/42/181786942.db2.gz MLMYCMBUZYERCJ-UHFFFAOYSA-N 1 2 228.299 2.424 20 0 BEADLO C[C@](CO)([NH2+]Cc1cscn1)c1ccccc1 ZINC000227212379 371803577 /nfs/dbraw/zinc/80/35/77/371803577.db2.gz ZNWJPWNCWRMLBZ-CYBMUJFWSA-N 1 2 248.351 2.140 20 0 BEADLO C[C@@](CO)([NH2+]Cc1nccs1)c1ccccc1 ZINC000227213031 371804037 /nfs/dbraw/zinc/80/40/37/371804037.db2.gz QLKWHAIDWYMZHG-ZDUSSCGKSA-N 1 2 248.351 2.140 20 0 BEADLO CCCCc1cc(N[C@@H](C)CCCO)nc[nH+]1 ZINC000631160988 372211645 /nfs/dbraw/zinc/21/16/45/372211645.db2.gz YRLOFTFOMJUQFF-NSHDSACASA-N 1 2 237.347 2.392 20 0 BEADLO CCCCC[C@H]1CCCN1c1nc(C)[nH+]c(N)n1 ZINC000631170111 372215272 /nfs/dbraw/zinc/21/52/72/372215272.db2.gz LUIQZUPQUZDAKE-NSHDSACASA-N 1 2 249.362 2.142 20 0 BEADLO CCCCC[C@H]1CCCN1c1nc(N)nc(C)[nH+]1 ZINC000631170111 372215278 /nfs/dbraw/zinc/21/52/78/372215278.db2.gz LUIQZUPQUZDAKE-NSHDSACASA-N 1 2 249.362 2.142 20 0 BEADLO C[C@@H]1CN(c2cc3ccccc3c[nH+]2)CC[C@@H]1O ZINC000631218565 372241784 /nfs/dbraw/zinc/24/17/84/372241784.db2.gz OBXZJHUCJBQIHO-RISCZKNCSA-N 1 2 242.322 2.442 20 0 BEADLO CCCCc1cc(N[C@H]2CCOC2)nc[nH+]1 ZINC000631177850 372219264 /nfs/dbraw/zinc/21/92/64/372219264.db2.gz ATCGFCQQOVPQNQ-NSHDSACASA-N 1 2 221.304 2.020 20 0 BEADLO C[C@@H]1CN(c2cc3ccccc3c[nH+]2)CC[C@H]1O ZINC000631218563 372242062 /nfs/dbraw/zinc/24/20/62/372242062.db2.gz OBXZJHUCJBQIHO-BXUZGUMPSA-N 1 2 242.322 2.442 20 0 BEADLO C[C@H]1CN(c2cc3ccccc3c[nH+]2)CC[C@@H]1O ZINC000631218564 372242610 /nfs/dbraw/zinc/24/26/10/372242610.db2.gz OBXZJHUCJBQIHO-FZMZJTMJSA-N 1 2 242.322 2.442 20 0 BEADLO CN(C)c1c[nH+]cc(NC[C@@H]2CCSC2)c1 ZINC000631202723 372233586 /nfs/dbraw/zinc/23/35/86/372233586.db2.gz BVNXYZUTQHWXHM-JTQLQIEISA-N 1 2 237.372 2.313 20 0 BEADLO CC(C)OC[C@H](C)Nc1c[nH+]cc(N(C)C)c1 ZINC000631203993 372233797 /nfs/dbraw/zinc/23/37/97/372233797.db2.gz WFNZUFAGZCVWCU-NSHDSACASA-N 1 2 237.347 2.373 20 0 BEADLO Cc1ncc([C@H](C)[NH2+]Cc2ncc[nH]2)s1 ZINC000631223412 372246838 /nfs/dbraw/zinc/24/68/38/372246838.db2.gz ALOCXYYHWIJKMK-ZETCQYMHSA-N 1 2 222.317 2.025 20 0 BEADLO C[C@H](CCO)N(C)c1cc2ccccc2c[nH+]1 ZINC000631342195 372303092 /nfs/dbraw/zinc/30/30/92/372303092.db2.gz ULEYGJYQEOJBLI-LLVKDONJSA-N 1 2 230.311 2.442 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cn(C3CCC3)nn2)o1 ZINC000631243180 372257397 /nfs/dbraw/zinc/25/73/97/372257397.db2.gz VGVJQGYMJUQHLK-UHFFFAOYSA-N 1 2 246.314 2.194 20 0 BEADLO c1cc2c(nc(C3CC3)[nH+]c2N[C@@H]2CC23CC3)[nH]1 ZINC000631309748 372288719 /nfs/dbraw/zinc/28/87/19/372288719.db2.gz VNGBGDWQZKFUFK-SNVBAGLBSA-N 1 2 240.310 2.222 20 0 BEADLO CCc1cc(N2CC[C@H]2C(F)(F)F)nc(C)[nH+]1 ZINC000631343782 372304723 /nfs/dbraw/zinc/30/47/23/372304723.db2.gz PIAMVJAANNNOEK-VIFPVBQESA-N 1 2 245.248 2.488 20 0 BEADLO OC[C@H]1C[C@@H](Nc2cc(C(F)(F)F)cc[nH+]2)C1 ZINC000631426964 372356454 /nfs/dbraw/zinc/35/64/54/372356454.db2.gz HATPIIQAUFZAHO-OTSSQURYSA-N 1 2 246.232 2.283 20 0 BEADLO CCC[C@@H](CCO)Nc1[nH+]cccc1OC ZINC000631427225 372357947 /nfs/dbraw/zinc/35/79/47/372357947.db2.gz QHCTYYHQKPWPMX-JTQLQIEISA-N 1 2 224.304 2.053 20 0 BEADLO Cc1cc(N[C@@H]2C[C@@H](C)O[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000631463187 372377215 /nfs/dbraw/zinc/37/72/15/372377215.db2.gz ATQMZZOHCNGQHW-CKYFFXLPSA-N 1 2 247.342 2.062 20 0 BEADLO Cc1cc(C)c(C(=O)NCc2[nH]c[nH+]c2C)s1 ZINC000631594170 372447016 /nfs/dbraw/zinc/44/70/16/372447016.db2.gz JFTZGVWIAAJUJF-UHFFFAOYSA-N 1 2 249.339 2.326 20 0 BEADLO c1cc2c(nc[nH+]c2N2OC3CCC2CC3)[nH]1 ZINC000631599635 372451058 /nfs/dbraw/zinc/45/10/58/372451058.db2.gz ICEKIQOUMJCRCE-UHFFFAOYSA-N 1 2 230.271 2.021 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N1CCC[C@H]2CCC[C@H]21 ZINC000279262256 181941836 /nfs/dbraw/zinc/94/18/36/181941836.db2.gz VEJRLFZARVQSKH-VXGBXAGGSA-N 1 2 247.342 2.133 20 0 BEADLO C=C/C=C\CC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001643075098 1172430933 /nfs/dbraw/zinc/43/09/33/1172430933.db2.gz AFIOZLJXZTUOJC-WAYWQWQTSA-N 1 2 230.311 2.447 20 0 BEADLO CC(C)c1[nH+]c2c(n1C)CCN(CC(F)F)C2 ZINC000171994303 372851221 /nfs/dbraw/zinc/85/12/21/372851221.db2.gz IWWGBVYWXOZYMN-UHFFFAOYSA-N 1 2 243.301 2.167 20 0 BEADLO CCCC(=O)NCc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000633522405 373583503 /nfs/dbraw/zinc/58/35/03/373583503.db2.gz UNKJAZZRSHHRGE-UHFFFAOYSA-N 1 2 243.310 2.493 20 0 BEADLO CC[C@H](Nc1nc(C)[nH+]c(N)n1)c1ccccc1 ZINC000380787713 373543649 /nfs/dbraw/zinc/54/36/49/373543649.db2.gz ZFHHRIKMONOOQC-NSHDSACASA-N 1 2 243.314 2.156 20 0 BEADLO CC[C@H](Nc1nc(N)nc(C)[nH+]1)c1ccccc1 ZINC000380787713 373543654 /nfs/dbraw/zinc/54/36/54/373543654.db2.gz ZFHHRIKMONOOQC-NSHDSACASA-N 1 2 243.314 2.156 20 0 BEADLO C[C@H](CC1CCC1)NC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000634369758 374218004 /nfs/dbraw/zinc/21/80/04/374218004.db2.gz HUHVNVRNSVZIBW-SNVBAGLBSA-N 1 2 249.358 2.382 20 0 BEADLO C[C@H](CC1CCC1)NC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000634370694 374219665 /nfs/dbraw/zinc/21/96/65/374219665.db2.gz BURJIFAIDLSYGA-GHMZBOCLSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](CC1CCC1)NC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000634370694 374219674 /nfs/dbraw/zinc/21/96/74/374219674.db2.gz BURJIFAIDLSYGA-GHMZBOCLSA-N 1 2 249.358 2.283 20 0 BEADLO CC1CCC(C[N@H+](CCO)CC(F)F)CC1 ZINC000193028906 205972156 /nfs/dbraw/zinc/97/21/56/205972156.db2.gz JBUUUAAOANTIQD-UHFFFAOYSA-N 1 2 235.318 2.372 20 0 BEADLO CC1CCC(C[N@@H+](CCO)CC(F)F)CC1 ZINC000193028906 205972162 /nfs/dbraw/zinc/97/21/62/205972162.db2.gz JBUUUAAOANTIQD-UHFFFAOYSA-N 1 2 235.318 2.372 20 0 BEADLO O=C(NCc1ccn2cc[nH+]c2c1)C1CCCC1 ZINC000178391237 182263945 /nfs/dbraw/zinc/26/39/45/182263945.db2.gz XMXGJTMWDVRUJV-UHFFFAOYSA-N 1 2 243.310 2.141 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)c1sccc1C1CC1 ZINC000357551772 182273739 /nfs/dbraw/zinc/27/37/39/182273739.db2.gz PSQASEQHLZITGX-UHFFFAOYSA-N 1 2 247.323 2.279 20 0 BEADLO CCc1ncc(CNc2cccc(CO)[nH+]2)s1 ZINC000432728697 206064092 /nfs/dbraw/zinc/06/40/92/206064092.db2.gz CVPCTSPZNYAFOF-UHFFFAOYSA-N 1 2 249.339 2.205 20 0 BEADLO CNc1[nH+]cnc2c1cnn2CCCC(C)C ZINC000435796508 206065940 /nfs/dbraw/zinc/06/59/40/206065940.db2.gz BBQAGFNOVDPBNE-UHFFFAOYSA-N 1 2 233.319 2.304 20 0 BEADLO COC1C[NH+](Cc2ccc(Cl)cc2C)C1 ZINC000459578731 206135339 /nfs/dbraw/zinc/13/53/39/206135339.db2.gz IVRYPQYPAYJFLC-UHFFFAOYSA-N 1 2 225.719 2.479 20 0 BEADLO COC1C[NH+](Cc2cccn2CCC(C)C)C1 ZINC000459581000 206136188 /nfs/dbraw/zinc/13/61/88/206136188.db2.gz LTBLGJFWODMNIM-UHFFFAOYSA-N 1 2 236.359 2.365 20 0 BEADLO OC1(c2ccc(F)cc2)C[NH+](CCCCF)C1 ZINC000367514746 183022845 /nfs/dbraw/zinc/02/28/45/183022845.db2.gz OUADSLOBAMWDIM-UHFFFAOYSA-N 1 2 241.281 2.079 20 0 BEADLO OCC1CN(c2cc[nH+]c3c(Cl)cccc23)C1 ZINC000287064456 183041148 /nfs/dbraw/zinc/04/11/48/183041148.db2.gz XNIQHEDMPGMAOV-UHFFFAOYSA-N 1 2 248.713 2.317 20 0 BEADLO CCCC[C@H](CC)C(=O)NCc1[nH+]ccn1C ZINC000264329693 168995094 /nfs/dbraw/zinc/99/50/94/168995094.db2.gz SKASSWXDBMGDNF-NSHDSACASA-N 1 2 237.347 2.253 20 0 BEADLO OC[C@@H](Nc1cccc[nH+]1)C1CCCC1 ZINC000290867666 183111818 /nfs/dbraw/zinc/11/18/18/183111818.db2.gz RFXXPGWPGLCQJH-LLVKDONJSA-N 1 2 206.289 2.045 20 0 BEADLO OCC[C@H]1CCC[C@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000275016983 183098306 /nfs/dbraw/zinc/09/83/06/183098306.db2.gz LCBJHMZSHRZOHI-ZYHUDNBSSA-N 1 2 247.342 2.317 20 0 BEADLO CCCC[C@H]([NH2+][C@H]1C[C@H]1CC)C(=O)OC ZINC000300390201 169013379 /nfs/dbraw/zinc/01/33/79/169013379.db2.gz SUSKKCCMRBHPJF-VWYCJHECSA-N 1 2 213.321 2.106 20 0 BEADLO CCCC[C@H]([NH2+][C@H](C)COC(C)C)C(=O)OC ZINC000337514746 169013511 /nfs/dbraw/zinc/01/35/11/169013511.db2.gz UKZNIUZMZNXTHD-NEPJUHHUSA-N 1 2 245.363 2.121 20 0 BEADLO OC[C@@H](CNc1ccc2ccccc2[nH+]1)C1CC1 ZINC000357777759 183105178 /nfs/dbraw/zinc/10/51/78/183105178.db2.gz AULOCLMAUSNSFI-CYBMUJFWSA-N 1 2 242.322 2.087 20 0 BEADLO CCCCc1nc(C[N@@H+]2CC[C@@H](C)C2)no1 ZINC000336698311 169026576 /nfs/dbraw/zinc/02/65/76/169026576.db2.gz IMAUKBHXTIQIIT-SNVBAGLBSA-N 1 2 223.320 2.254 20 0 BEADLO CCCCc1nc(C[N@H+]2CC[C@@H](C)C2)no1 ZINC000336698311 169026578 /nfs/dbraw/zinc/02/65/78/169026578.db2.gz IMAUKBHXTIQIIT-SNVBAGLBSA-N 1 2 223.320 2.254 20 0 BEADLO OC[C@H]1CCCC[C@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000266217588 183148184 /nfs/dbraw/zinc/14/81/84/183148184.db2.gz PNOVFBZBAKVAKE-VXGBXAGGSA-N 1 2 247.342 2.317 20 0 BEADLO OC[C@H]1CCCC[N@@H+]1Cc1csc(Cl)n1 ZINC000295419077 183148938 /nfs/dbraw/zinc/14/89/38/183148938.db2.gz DSZLBLDJEMYJDN-SECBINFHSA-N 1 2 246.763 2.143 20 0 BEADLO OC[C@H]1CCCC[N@H+]1Cc1csc(Cl)n1 ZINC000295419077 183148939 /nfs/dbraw/zinc/14/89/39/183148939.db2.gz DSZLBLDJEMYJDN-SECBINFHSA-N 1 2 246.763 2.143 20 0 BEADLO O[C@@H](CNc1cccc[nH+]1)C1CCCCC1 ZINC000006119001 183182519 /nfs/dbraw/zinc/18/25/19/183182519.db2.gz AWBDNFNPUYFLNI-LBPRGKRZSA-N 1 2 220.316 2.435 20 0 BEADLO CCCN(C)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000280901801 169056622 /nfs/dbraw/zinc/05/66/22/169056622.db2.gz DYKBAKURDHRFHH-UHFFFAOYSA-N 1 2 232.287 2.208 20 0 BEADLO O[C@@H]1CCCC[C@H]1Nc1cc[nH+]c2ccncc12 ZINC000267244565 183192223 /nfs/dbraw/zinc/19/22/23/183192223.db2.gz SMKKDJIEXFNQSP-ZIAGYGMSSA-N 1 2 243.310 2.345 20 0 BEADLO CCC[N@H+](CC(=O)OC)Cc1ccc(CC)o1 ZINC000269339027 169100362 /nfs/dbraw/zinc/10/03/62/169100362.db2.gz FGXNEUKXALEPPL-UHFFFAOYSA-N 1 2 239.315 2.227 20 0 BEADLO CCC[N@@H+](CC(=O)OC)Cc1ccc(CC)o1 ZINC000269339027 169100363 /nfs/dbraw/zinc/10/03/63/169100363.db2.gz FGXNEUKXALEPPL-UHFFFAOYSA-N 1 2 239.315 2.227 20 0 BEADLO CCC[N@H+](C)Cc1c(Br)cnn1C ZINC000278427254 169081595 /nfs/dbraw/zinc/08/15/95/169081595.db2.gz JJLSUCPJNONXMQ-UHFFFAOYSA-N 1 2 246.152 2.024 20 0 BEADLO CCC[N@@H+](C)Cc1c(Br)cnn1C ZINC000278427254 169081597 /nfs/dbraw/zinc/08/15/97/169081597.db2.gz JJLSUCPJNONXMQ-UHFFFAOYSA-N 1 2 246.152 2.024 20 0 BEADLO CCC[N@H+](CC(=O)OC)Cc1cccs1 ZINC000050065755 169101723 /nfs/dbraw/zinc/10/17/23/169101723.db2.gz KSFFTKWIIVQDTD-UHFFFAOYSA-N 1 2 227.329 2.133 20 0 BEADLO CCC[N@@H+](CC(=O)OC)Cc1cccs1 ZINC000050065755 169101726 /nfs/dbraw/zinc/10/17/26/169101726.db2.gz KSFFTKWIIVQDTD-UHFFFAOYSA-N 1 2 227.329 2.133 20 0 BEADLO CCCN(C)c1cc(N(C)CCC)[nH+]cn1 ZINC000122873658 169089065 /nfs/dbraw/zinc/08/90/65/169089065.db2.gz HHZYTZMZPLSLNM-UHFFFAOYSA-N 1 2 222.336 2.169 20 0 BEADLO Oc1cc(F)cc(C[N@@H+]2CCC[C@@H]2CF)c1 ZINC000294044096 183258623 /nfs/dbraw/zinc/25/86/23/183258623.db2.gz PBQOIMKPQQJULT-LLVKDONJSA-N 1 2 227.254 2.465 20 0 BEADLO Oc1cc(F)cc(C[N@H+]2CCC[C@@H]2CF)c1 ZINC000294044096 183258624 /nfs/dbraw/zinc/25/86/24/183258624.db2.gz PBQOIMKPQQJULT-LLVKDONJSA-N 1 2 227.254 2.465 20 0 BEADLO CCC[N@H+](Cc1cnn[nH]1)Cc1ccc(F)cc1 ZINC000298126595 169175044 /nfs/dbraw/zinc/17/50/44/169175044.db2.gz NFVOMEDYEUGJEP-UHFFFAOYSA-N 1 2 248.305 2.356 20 0 BEADLO CCC[N@@H+](Cc1cnn[nH]1)Cc1ccc(F)cc1 ZINC000298126595 169175047 /nfs/dbraw/zinc/17/50/47/169175047.db2.gz NFVOMEDYEUGJEP-UHFFFAOYSA-N 1 2 248.305 2.356 20 0 BEADLO CCC[N@H+](Cc1c[nH]nn1)Cc1ccc(F)cc1 ZINC000298126595 169175049 /nfs/dbraw/zinc/17/50/49/169175049.db2.gz NFVOMEDYEUGJEP-UHFFFAOYSA-N 1 2 248.305 2.356 20 0 BEADLO CCC[N@@H+](Cc1c[nH]nn1)Cc1ccc(F)cc1 ZINC000298126595 169175053 /nfs/dbraw/zinc/17/50/53/169175053.db2.gz NFVOMEDYEUGJEP-UHFFFAOYSA-N 1 2 248.305 2.356 20 0 BEADLO c1c[nH+]c(CN2CCc3ccsc3C2)[nH]1 ZINC000132729121 183325200 /nfs/dbraw/zinc/32/52/00/183325200.db2.gz BUZBRZNSIDUVCR-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO c1c[nH]c(C[N@@H+]2CCc3ccsc3C2)n1 ZINC000132729121 183325202 /nfs/dbraw/zinc/32/52/02/183325202.db2.gz BUZBRZNSIDUVCR-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO c1c[nH]c(C[N@H+]2CCc3ccsc3C2)n1 ZINC000132729121 183325203 /nfs/dbraw/zinc/32/52/03/183325203.db2.gz BUZBRZNSIDUVCR-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO c1c[nH+]c(COCCCC2CCOCC2)[nH]1 ZINC000279012739 183326997 /nfs/dbraw/zinc/32/69/97/183326997.db2.gz AQABJCUHILCJDT-UHFFFAOYSA-N 1 2 224.304 2.133 20 0 BEADLO CCCN1CC[NH+](Cc2ccccc2)CC1 ZINC000034552632 169202889 /nfs/dbraw/zinc/20/28/89/169202889.db2.gz MMOMLVPXKBCSMG-UHFFFAOYSA-N 1 2 218.344 2.214 20 0 BEADLO c1cc(C[NH2+]C[C@@H]2CCC3(CCCCC3)O2)[nH]n1 ZINC000359812678 183349504 /nfs/dbraw/zinc/34/95/04/183349504.db2.gz WSSGWLHRQATFPJ-ZDUSSCGKSA-N 1 2 249.358 2.381 20 0 BEADLO c1cc(N[C@@H]2C[C@H]3OCCC[C@@H]23)nc(C2CC2)[nH+]1 ZINC000302557494 183359089 /nfs/dbraw/zinc/35/90/89/183359089.db2.gz LVAMLRGELLJBQT-QJPTWQEYSA-N 1 2 245.326 2.333 20 0 BEADLO c1nc(C[NH+]2CCCCC2)n(-c2ccccc2)n1 ZINC000281903379 183387751 /nfs/dbraw/zinc/38/77/51/183387751.db2.gz FWSMPEDFEJYJDL-UHFFFAOYSA-N 1 2 242.326 2.253 20 0 BEADLO c1snnc1C[NH2+]C1(c2ccccc2)CC1 ZINC000133115185 183389470 /nfs/dbraw/zinc/38/94/70/183389470.db2.gz WQZKBJZTFBNJIY-UHFFFAOYSA-N 1 2 231.324 2.317 20 0 BEADLO c1ccc(C2([NH2+]Cc3ncccn3)CC2)cc1 ZINC000361862235 183389509 /nfs/dbraw/zinc/38/95/09/183389509.db2.gz LWZYMTRXLWYWET-UHFFFAOYSA-N 1 2 225.295 2.256 20 0 BEADLO CCCOc1ccc(C[NH2+]Cc2cocn2)cn1 ZINC000192310210 169318530 /nfs/dbraw/zinc/31/85/30/169318530.db2.gz IAIGALQDFAEKDD-UHFFFAOYSA-N 1 2 247.298 2.148 20 0 BEADLO c1cn(CCSCC[C@H]2CCCO2)c[nH+]1 ZINC000190163638 183469663 /nfs/dbraw/zinc/46/96/63/183469663.db2.gz SIKJKPHEEUZUAN-LLVKDONJSA-N 1 2 226.345 2.185 20 0 BEADLO C[C@@H]1CCC[C@@H](C[N@H+](C)Cc2nnc[nH]2)C1 ZINC000179359572 134316790 /nfs/dbraw/zinc/31/67/90/134316790.db2.gz JOPSJYNUIQJZES-GHMZBOCLSA-N 1 2 222.336 2.063 20 0 BEADLO C[C@@H]1CCC[C@@H](C[N@@H+](C)Cc2nnc[nH]2)C1 ZINC000179359572 134316791 /nfs/dbraw/zinc/31/67/91/134316791.db2.gz JOPSJYNUIQJZES-GHMZBOCLSA-N 1 2 222.336 2.063 20 0 BEADLO CC[C@@H]1CC[C@H]1[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000336682863 171058598 /nfs/dbraw/zinc/05/85/98/171058598.db2.gz DFUSKTLBWFSTHX-HBNTYKKESA-N 1 2 227.348 2.495 20 0 BEADLO CCCc1occc1C(=O)NCc1[nH]c[nH+]c1C ZINC000282624393 169609666 /nfs/dbraw/zinc/60/96/66/169609666.db2.gz FVJNKBPSJPRMFY-UHFFFAOYSA-N 1 2 247.298 2.194 20 0 BEADLO C[C@H](O)CC[N@H+](C)C/C(Cl)=C/Cl ZINC000131728558 383845813 /nfs/dbraw/zinc/84/58/13/383845813.db2.gz CENLFNQQJBZCGO-BJMRUTCWSA-N 1 2 212.120 2.008 20 0 BEADLO C[C@H](O)CC[N@@H+](C)C/C(Cl)=C/Cl ZINC000131728558 383845817 /nfs/dbraw/zinc/84/58/17/383845817.db2.gz CENLFNQQJBZCGO-BJMRUTCWSA-N 1 2 212.120 2.008 20 0 BEADLO Cc1cc(-n2cc[nH+]c2)nc(C(C)C)n1 ZINC000070163655 383875985 /nfs/dbraw/zinc/87/59/85/383875985.db2.gz FBCHXHKQKQMUNS-UHFFFAOYSA-N 1 2 202.261 2.094 20 0 BEADLO CC(C)(C)c1csc(C[N@@H+]2CC[C@H](O)C2)n1 ZINC000087370507 383832536 /nfs/dbraw/zinc/83/25/36/383832536.db2.gz LSLGMRQZNLOVAU-VIFPVBQESA-N 1 2 240.372 2.007 20 0 BEADLO CC(C)(C)c1csc(C[N@H+]2CC[C@H](O)C2)n1 ZINC000087370507 383832544 /nfs/dbraw/zinc/83/25/44/383832544.db2.gz LSLGMRQZNLOVAU-VIFPVBQESA-N 1 2 240.372 2.007 20 0 BEADLO COC(=O)c1cc(Cn2cc[nH+]c2)c(C)s1 ZINC000089102287 383933993 /nfs/dbraw/zinc/93/39/93/383933993.db2.gz HLRZRRLEHYKLKT-UHFFFAOYSA-N 1 2 236.296 2.088 20 0 BEADLO C=Cn1cc(C[NH2+][C@@H](CC)C(F)F)cn1 ZINC000449362043 383979774 /nfs/dbraw/zinc/97/97/74/383979774.db2.gz LVAGHKUHDYYBHU-VIFPVBQESA-N 1 2 215.247 2.117 20 0 BEADLO CCCC[C@H]([NH2+][C@H](CC)CSC)C(=O)OC ZINC000091555068 383981896 /nfs/dbraw/zinc/98/18/96/383981896.db2.gz CXULWCUFNSVOEQ-MNOVXSKESA-N 1 2 247.404 2.449 20 0 BEADLO Cc1csc(C[N@@H+]2CCO[C@H]3CCC[C@@H]32)n1 ZINC000268000108 383951348 /nfs/dbraw/zinc/95/13/48/383951348.db2.gz CQILQUYEOOJKSH-QWRGUYRKSA-N 1 2 238.356 2.205 20 0 BEADLO Cc1csc(C[N@H+]2CCO[C@H]3CCC[C@@H]32)n1 ZINC000268000108 383951351 /nfs/dbraw/zinc/95/13/51/383951351.db2.gz CQILQUYEOOJKSH-QWRGUYRKSA-N 1 2 238.356 2.205 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]Cc1cc(C)cc(N)c1 ZINC000643542053 383951395 /nfs/dbraw/zinc/95/13/95/383951395.db2.gz VSQUGOYAYYWSFB-JTQLQIEISA-N 1 2 244.342 2.460 20 0 BEADLO CC[C@H]1CCCC[C@H]1C[NH2+]Cc1c[nH]nn1 ZINC000401762711 383958075 /nfs/dbraw/zinc/95/80/75/383958075.db2.gz SPXBMEJJQIBSAI-QWRGUYRKSA-N 1 2 222.336 2.111 20 0 BEADLO CC[C@H]1CCCC[C@H]1C[NH2+]Cc1cn[nH]n1 ZINC000401762711 383958080 /nfs/dbraw/zinc/95/80/80/383958080.db2.gz SPXBMEJJQIBSAI-QWRGUYRKSA-N 1 2 222.336 2.111 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC3(CCCC3)C2)on1 ZINC000336470483 383964584 /nfs/dbraw/zinc/96/45/84/383964584.db2.gz JHUMOVLJVGNLJY-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO Cc1cc(C[N@H+]2CCOC3(CCCC3)C2)on1 ZINC000336470483 383964588 /nfs/dbraw/zinc/96/45/88/383964588.db2.gz JHUMOVLJVGNLJY-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO CCSCC[NH2+][C@H](C(=O)OC(C)C)C(C)C ZINC000449503285 383965940 /nfs/dbraw/zinc/96/59/40/383965940.db2.gz HPXCIAUVHNUJSO-NSHDSACASA-N 1 2 247.404 2.305 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)/C=C\c1cccnc1 ZINC000255064105 384026935 /nfs/dbraw/zinc/02/69/35/384026935.db2.gz LJVGTGFIWWOMQZ-PLNGDYQASA-N 1 2 239.278 2.437 20 0 BEADLO CN(Cc1[nH+]ccn1C)c1ccc(Cl)cn1 ZINC000090345555 384010947 /nfs/dbraw/zinc/01/09/47/384010947.db2.gz FPOJMUNSZBQJFX-UHFFFAOYSA-N 1 2 236.706 2.105 20 0 BEADLO Cc1ccsc1[C@@H](C)[NH2+]Cc1ncn(C)n1 ZINC000090970074 384086829 /nfs/dbraw/zinc/08/68/29/384086829.db2.gz DQTPQGZBDWJSQD-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO FC(F)CC1C[NH+](Cc2nccs2)C1 ZINC000644906894 384056655 /nfs/dbraw/zinc/05/66/55/384056655.db2.gz JJYNADWZJJZAHF-UHFFFAOYSA-N 1 2 218.272 2.230 20 0 BEADLO Cc1ccc2[nH+]cc(CNC(CF)CF)n2c1 ZINC000449377511 384076626 /nfs/dbraw/zinc/07/66/26/384076626.db2.gz ASXPEEGDENRNCJ-UHFFFAOYSA-N 1 2 239.269 2.040 20 0 BEADLO C[C@H]1C[C@H](Nc2cccc(-n3cc[nH+]c3)c2)CO1 ZINC000401829281 384078089 /nfs/dbraw/zinc/07/80/89/384078089.db2.gz MNXVUXVFKZUKMI-AAEUAGOBSA-N 1 2 243.310 2.462 20 0 BEADLO COC(=O)C[N@H+](Cc1ccsc1)C(C)C ZINC000050063752 384105927 /nfs/dbraw/zinc/10/59/27/384105927.db2.gz CTZCZFMMMRNPIM-UHFFFAOYSA-N 1 2 227.329 2.132 20 0 BEADLO COC(=O)C[N@@H+](Cc1ccsc1)C(C)C ZINC000050063752 384105934 /nfs/dbraw/zinc/10/59/34/384105934.db2.gz CTZCZFMMMRNPIM-UHFFFAOYSA-N 1 2 227.329 2.132 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1nccs1)c1cnn(C)c1 ZINC000070717606 384134679 /nfs/dbraw/zinc/13/46/79/384134679.db2.gz TXUNOSWWKROIHV-RKDXNWHRSA-N 1 2 236.344 2.288 20 0 BEADLO CN(C)c1ccc([NH2+]CC2(C)COC2)cc1 ZINC000070616948 384123972 /nfs/dbraw/zinc/12/39/72/384123972.db2.gz BMGDJBZJFABHAM-UHFFFAOYSA-N 1 2 220.316 2.201 20 0 BEADLO C[NH+](C)c1ccc(NCC2(C)COC2)cc1 ZINC000070616948 384123976 /nfs/dbraw/zinc/12/39/76/384123976.db2.gz BMGDJBZJFABHAM-UHFFFAOYSA-N 1 2 220.316 2.201 20 0 BEADLO CC[C@](C)(O)CNc1cc(C)[nH+]c(C2CC2)n1 ZINC000116260693 384124302 /nfs/dbraw/zinc/12/43/02/384124302.db2.gz ZCFDGHXVQSOJNZ-ZDUSSCGKSA-N 1 2 235.331 2.235 20 0 BEADLO Cn1cnc(C[NH2+][C@H](c2ccccc2)C2CC2)n1 ZINC000091410008 384126422 /nfs/dbraw/zinc/12/64/22/384126422.db2.gz KVZLOSYYJOXWHW-CQSZACIVSA-N 1 2 242.326 2.056 20 0 BEADLO CC[C@@H](NC(=O)CCC(F)(F)F)c1[nH]cc[nH+]1 ZINC000140518297 384130550 /nfs/dbraw/zinc/13/05/50/384130550.db2.gz QAMVSEGQUBKYFU-SSDOTTSWSA-N 1 2 249.236 2.320 20 0 BEADLO C[C@@H]1COCC[N@@H+]1Cc1cnc(C2CC2)s1 ZINC000091815099 384147990 /nfs/dbraw/zinc/14/79/90/384147990.db2.gz IHUIJBDGTIGCKN-SECBINFHSA-N 1 2 238.356 2.241 20 0 BEADLO C[C@@H]1COCC[N@H+]1Cc1cnc(C2CC2)s1 ZINC000091815099 384147992 /nfs/dbraw/zinc/14/79/92/384147992.db2.gz IHUIJBDGTIGCKN-SECBINFHSA-N 1 2 238.356 2.241 20 0 BEADLO Cn1cc[nH+]c1CN1CCc2cc(F)ccc2C1 ZINC000091892105 384155562 /nfs/dbraw/zinc/15/55/62/384155562.db2.gz RZSCKPWMOHAQAJ-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO CC[C@@H](NC(=O)C[C@H]1C=CCC1)c1[nH]cc[nH+]1 ZINC000140607077 384156162 /nfs/dbraw/zinc/15/61/62/384156162.db2.gz FPRSVQIYHZSSRG-WDEREUQCSA-N 1 2 233.315 2.333 20 0 BEADLO Cc1n[nH]c(C)c1CNc1c[nH+]ccc1C ZINC000070958348 384143330 /nfs/dbraw/zinc/14/33/30/384143330.db2.gz XBVRERHGJQNEQJ-UHFFFAOYSA-N 1 2 216.288 2.342 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1nc(C2CC2)no1)c1cn[nH]c1 ZINC000358802855 384168908 /nfs/dbraw/zinc/16/89/08/384168908.db2.gz FANUPWZXQMFHHW-HTQZYQBOSA-N 1 2 247.302 2.082 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1ccc(C(C)C)nc1 ZINC001645131480 1172635473 /nfs/dbraw/zinc/63/54/73/1172635473.db2.gz GKJSWQSJNNARPH-CYBMUJFWSA-N 1 2 247.342 2.238 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1ccc(C(C)C)nc1 ZINC001645131480 1172635477 /nfs/dbraw/zinc/63/54/77/1172635477.db2.gz GKJSWQSJNNARPH-CYBMUJFWSA-N 1 2 247.342 2.238 20 0 BEADLO CC(C)[C@@H]1N(C(=O)CCc2c[nH+]c[nH]2)CC1(C)C ZINC000294072642 384215438 /nfs/dbraw/zinc/21/54/38/384215438.db2.gz WWQYWIMXGICMMV-ZDUSSCGKSA-N 1 2 249.358 2.235 20 0 BEADLO CC(C)[C@@H]1N(C(=O)CCc2c[nH]c[nH+]2)CC1(C)C ZINC000294072642 384215441 /nfs/dbraw/zinc/21/54/41/384215441.db2.gz WWQYWIMXGICMMV-ZDUSSCGKSA-N 1 2 249.358 2.235 20 0 BEADLO C[N@H+](Cc1cc(F)c(F)cc1F)[C@@H]1CCOC1 ZINC000132180746 384219265 /nfs/dbraw/zinc/21/92/65/384219265.db2.gz ZARCYYVNCWSFIA-SECBINFHSA-N 1 2 245.244 2.325 20 0 BEADLO C[N@@H+](Cc1cc(F)c(F)cc1F)[C@@H]1CCOC1 ZINC000132180746 384219270 /nfs/dbraw/zinc/21/92/70/384219270.db2.gz ZARCYYVNCWSFIA-SECBINFHSA-N 1 2 245.244 2.325 20 0 BEADLO CSC1(CNc2ccc(CO)c[nH+]2)CCC1 ZINC000291555787 384222592 /nfs/dbraw/zinc/22/25/92/384222592.db2.gz MRSGBQILVPMDBB-UHFFFAOYSA-N 1 2 238.356 2.272 20 0 BEADLO Cn1cncc1C[N@@H+]1CCc2cc(F)ccc2C1 ZINC000119021502 384228260 /nfs/dbraw/zinc/22/82/60/384228260.db2.gz JFPCPVQNIMCZDI-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1cncc1C[N@H+]1CCc2cc(F)ccc2C1 ZINC000119021502 384228268 /nfs/dbraw/zinc/22/82/68/384228268.db2.gz JFPCPVQNIMCZDI-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1c[nH+]cc1CN1CCc2cc(F)ccc2C1 ZINC000119021502 384228286 /nfs/dbraw/zinc/22/82/86/384228286.db2.gz JFPCPVQNIMCZDI-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cc1csc(C[NH2+]Cc2nccs2)n1 ZINC000082394100 384229096 /nfs/dbraw/zinc/22/90/96/384229096.db2.gz GLJFIRNNPZESIK-UHFFFAOYSA-N 1 2 225.342 2.198 20 0 BEADLO Cc1cc[nH+]cc1NC[C@H]1CCCOC1 ZINC000082581255 384243496 /nfs/dbraw/zinc/24/34/96/384243496.db2.gz DVFDKFNBSAVFQS-LLVKDONJSA-N 1 2 206.289 2.229 20 0 BEADLO CCCC(=O)N1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000119373088 384265278 /nfs/dbraw/zinc/26/52/78/384265278.db2.gz XMAYHHZTIYVXNT-LBPRGKRZSA-N 1 2 249.358 2.001 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@H]1CCC[C@@H]1c1ccccc1 ZINC000133766364 384311993 /nfs/dbraw/zinc/31/19/93/384311993.db2.gz TXFCNABDHJUTLC-BNOWGMLFSA-N 1 2 247.338 2.474 20 0 BEADLO FC(F)n1cc[nH+]c1Cn1cc(Cl)cn1 ZINC000133797928 384314409 /nfs/dbraw/zinc/31/44/09/384314409.db2.gz MLHFSIIJOQFKCV-UHFFFAOYSA-N 1 2 232.621 2.176 20 0 BEADLO CC[N@H+](Cc1ccnn1C1CCCC1)C1COC1 ZINC000449422808 384318125 /nfs/dbraw/zinc/31/81/25/384318125.db2.gz FSDYNNPXMFEAHC-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO CC[N@@H+](Cc1ccnn1C1CCCC1)C1COC1 ZINC000449422808 384318128 /nfs/dbraw/zinc/31/81/28/384318128.db2.gz FSDYNNPXMFEAHC-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO C[C@@H]1C[C@@H](Nc2ccc3ccccc3[nH+]2)CO1 ZINC000335436832 384279407 /nfs/dbraw/zinc/27/94/07/384279407.db2.gz CVNXSPYNAOMRPO-ZYHUDNBSSA-N 1 2 228.295 2.246 20 0 BEADLO CC(C)(C(=O)NCCn1cc[nH+]c1)C1CCCC1 ZINC000158899503 384285606 /nfs/dbraw/zinc/28/56/06/384285606.db2.gz KBENLCBZLCHLKU-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO CCOc1ccc(C[NH2+]CC(F)F)cc1 ZINC000147269636 384288695 /nfs/dbraw/zinc/28/86/95/384288695.db2.gz YXVNXQJCQNXBEG-UHFFFAOYSA-N 1 2 215.243 2.440 20 0 BEADLO COc1cc([C@@H](C)[NH2+][C@@H](C)c2ccon2)ccn1 ZINC000569589980 384289028 /nfs/dbraw/zinc/28/90/28/384289028.db2.gz DDADDJZVADTHAM-ZJUUUORDSA-N 1 2 247.298 2.490 20 0 BEADLO C[C@@H]1CCCC[N@H+](CCOC[C@@H]2CCCO2)C1 ZINC000558786882 384290697 /nfs/dbraw/zinc/29/06/97/384290697.db2.gz ZEHJDQUCMXJRHV-KGLIPLIRSA-N 1 2 241.375 2.304 20 0 BEADLO C[C@@H]1CCCC[N@@H+](CCOC[C@@H]2CCCO2)C1 ZINC000558786882 384290701 /nfs/dbraw/zinc/29/07/01/384290701.db2.gz ZEHJDQUCMXJRHV-KGLIPLIRSA-N 1 2 241.375 2.304 20 0 BEADLO C[C@H]1CCCC[N@H+](CCOC[C@H]2CCCO2)C1 ZINC000558786883 384290902 /nfs/dbraw/zinc/29/09/02/384290902.db2.gz ZEHJDQUCMXJRHV-UONOGXRCSA-N 1 2 241.375 2.304 20 0 BEADLO C[C@H]1CCCC[N@@H+](CCOC[C@H]2CCCO2)C1 ZINC000558786883 384290904 /nfs/dbraw/zinc/29/09/04/384290904.db2.gz ZEHJDQUCMXJRHV-UONOGXRCSA-N 1 2 241.375 2.304 20 0 BEADLO CCC1(C(=O)N(C)Cc2[nH+]ccn2C)CCCC1 ZINC000158954735 384291216 /nfs/dbraw/zinc/29/12/16/384291216.db2.gz QQNUFEDGSMMDRQ-UHFFFAOYSA-N 1 2 249.358 2.349 20 0 BEADLO CO[C@H]1CCCN(C(=O)Nc2cc[nH+]c(C)c2)C1 ZINC000119637644 384292730 /nfs/dbraw/zinc/29/27/30/384292730.db2.gz YJLZLTOSZIFDTF-LBPRGKRZSA-N 1 2 249.314 2.033 20 0 BEADLO CC[C@H]([NH2+]Cc1ncn(C)n1)c1ccccc1 ZINC000134201772 384341310 /nfs/dbraw/zinc/34/13/10/384341310.db2.gz MCAWOAZLUJROBH-LBPRGKRZSA-N 1 2 230.315 2.056 20 0 BEADLO FC(F)n1ccc(C[N@@H+]2CC[C@@H]2C2CC2)n1 ZINC000449424102 384327014 /nfs/dbraw/zinc/32/70/14/384327014.db2.gz CKOXYGOZVHHWSH-SNVBAGLBSA-N 1 2 227.258 2.263 20 0 BEADLO FC(F)n1ccc(C[N@H+]2CC[C@@H]2C2CC2)n1 ZINC000449424102 384327019 /nfs/dbraw/zinc/32/70/19/384327019.db2.gz CKOXYGOZVHHWSH-SNVBAGLBSA-N 1 2 227.258 2.263 20 0 BEADLO O=C(c1ccoc1)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000120143133 384331569 /nfs/dbraw/zinc/33/15/69/384331569.db2.gz MSZMJUCKKUBNRU-LLVKDONJSA-N 1 2 245.282 2.370 20 0 BEADLO C[C@H](C[C@H]1CCCO1)Nc1cccc[nH+]1 ZINC000308834063 384334407 /nfs/dbraw/zinc/33/44/07/384334407.db2.gz HKIOVOGTHDPPII-GHMZBOCLSA-N 1 2 206.289 2.451 20 0 BEADLO CC[C@H]([NH2+]CCc1ccccc1C)C(=O)OC ZINC000134978079 384404841 /nfs/dbraw/zinc/40/48/41/384404841.db2.gz FYIKNTJJKJDPFY-ZDUSSCGKSA-N 1 2 235.327 2.079 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCc2ccccc21)c1ncn(C)n1 ZINC000275649275 384406424 /nfs/dbraw/zinc/40/64/24/384406424.db2.gz DKWDQWCCFQCLMN-GXFFZTMASA-N 1 2 242.326 2.153 20 0 BEADLO Cn1c[nH+]c(CCNc2ccc(Cl)cn2)c1 ZINC000313478894 384419203 /nfs/dbraw/zinc/41/92/03/384419203.db2.gz CUKFRYDVXZXVBQ-UHFFFAOYSA-N 1 2 236.706 2.123 20 0 BEADLO C(c1noc(C2CC2)n1)[N@@H+]1CCC[C@@H]1C1CC1 ZINC000363386354 384386615 /nfs/dbraw/zinc/38/66/15/384386615.db2.gz NQQHTZUCDYCSDM-LLVKDONJSA-N 1 2 233.315 2.321 20 0 BEADLO C(c1noc(C2CC2)n1)[N@H+]1CCC[C@@H]1C1CC1 ZINC000363386354 384386621 /nfs/dbraw/zinc/38/66/21/384386621.db2.gz NQQHTZUCDYCSDM-LLVKDONJSA-N 1 2 233.315 2.321 20 0 BEADLO C[N@H+](CCCF)Cc1nccn1C(F)F ZINC000120967750 384390945 /nfs/dbraw/zinc/39/09/45/384390945.db2.gz NQDPNFUKBCBRNL-UHFFFAOYSA-N 1 2 221.226 2.070 20 0 BEADLO C[N@@H+](CCCF)Cc1nccn1C(F)F ZINC000120967750 384390949 /nfs/dbraw/zinc/39/09/49/384390949.db2.gz NQDPNFUKBCBRNL-UHFFFAOYSA-N 1 2 221.226 2.070 20 0 BEADLO OC1CCN(c2cc(C(F)(F)F)cc[nH+]2)CC1 ZINC000078612551 384451533 /nfs/dbraw/zinc/45/15/33/384451533.db2.gz QTNVPSLYTVSKBH-UHFFFAOYSA-N 1 2 246.232 2.062 20 0 BEADLO Cc1cc(C)n(CCCNc2cc[nH+]c(C)n2)n1 ZINC000135239180 384428847 /nfs/dbraw/zinc/42/88/47/384428847.db2.gz IAPLPLFYPAZHTL-UHFFFAOYSA-N 1 2 245.330 2.101 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)Cc1ccc[nH]1 ZINC000175427514 384433056 /nfs/dbraw/zinc/43/30/56/384433056.db2.gz LOWLMCRVEVTYIM-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)Cc1ccc[nH]1 ZINC000175427514 384433061 /nfs/dbraw/zinc/43/30/61/384433061.db2.gz LOWLMCRVEVTYIM-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N(C)C1CCC1 ZINC000121697807 384433686 /nfs/dbraw/zinc/43/36/86/384433686.db2.gz WDBZTWBPXFTVPB-UHFFFAOYSA-N 1 2 219.288 2.406 20 0 BEADLO C[C@@H]([NH2+]Cc1ccn[nH]1)c1ccccc1 ZINC000036899943 384462810 /nfs/dbraw/zinc/46/28/10/384462810.db2.gz LIVPKLVKSZBITR-SNVBAGLBSA-N 1 2 201.273 2.261 20 0 BEADLO C[C@H](CCO)Nc1ccc2ccccc2[nH+]1 ZINC000096867095 384482465 /nfs/dbraw/zinc/48/24/65/384482465.db2.gz RRGZUSITLAXEEX-SNVBAGLBSA-N 1 2 216.284 2.418 20 0 BEADLO Cn1c2ccccc2[nH+]c1N[C@H]1CCCOC1 ZINC000079047244 384483327 /nfs/dbraw/zinc/48/33/27/384483327.db2.gz WOBDBPRDYFNZLH-JTQLQIEISA-N 1 2 231.299 2.164 20 0 BEADLO COC(=O)[C@H]([NH2+]CC1CCC1)c1ccccc1 ZINC000079619060 384507051 /nfs/dbraw/zinc/50/70/51/384507051.db2.gz NRHJUHSZEJJRKN-CYBMUJFWSA-N 1 2 233.311 2.290 20 0 BEADLO CC[C@H](SC)C(=O)Nc1cc[nH+]c(C)c1 ZINC000122514769 384489223 /nfs/dbraw/zinc/48/92/23/384489223.db2.gz HTOXWMUNLUFJSA-JTQLQIEISA-N 1 2 224.329 2.470 20 0 BEADLO OCc1cc[nH+]c(N[C@@H]2CC[C@@H]3C[C@@H]3C2)c1 ZINC000403098729 384515395 /nfs/dbraw/zinc/51/53/95/384515395.db2.gz CBBGPCRFVMZYCZ-IJLUTSLNSA-N 1 2 218.300 2.174 20 0 BEADLO c1cc(C[NH2+]Cc2ccc3occc3c2)[nH]n1 ZINC000556836773 384517957 /nfs/dbraw/zinc/51/79/57/384517957.db2.gz GMLUGSSESOPJGX-UHFFFAOYSA-N 1 2 227.267 2.446 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1C[C@H](C)CC[C@@H]1C ZINC000566444565 384519293 /nfs/dbraw/zinc/51/92/93/384519293.db2.gz HXNRVTNMNSBVHW-UTUOFQBUSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1C[C@H](C)CC[C@@H]1C ZINC000566444565 384519297 /nfs/dbraw/zinc/51/92/97/384519297.db2.gz HXNRVTNMNSBVHW-UTUOFQBUSA-N 1 2 249.358 2.235 20 0 BEADLO CCCc1nc(C[N@@H+]2CCCC2(C)C)no1 ZINC000170872891 384528599 /nfs/dbraw/zinc/52/85/99/384528599.db2.gz AWPYLKSVVWTHSS-UHFFFAOYSA-N 1 2 223.320 2.397 20 0 BEADLO CCCc1nc(C[N@H+]2CCCC2(C)C)no1 ZINC000170872891 384528606 /nfs/dbraw/zinc/52/86/06/384528606.db2.gz AWPYLKSVVWTHSS-UHFFFAOYSA-N 1 2 223.320 2.397 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2ncccc2C)s1 ZINC000353580800 384530309 /nfs/dbraw/zinc/53/03/09/384530309.db2.gz JVTBEMNDZWKBIR-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO [NH3+][C@H](c1nc(CC2CC2)no1)c1ccccc1 ZINC000149001093 384548117 /nfs/dbraw/zinc/54/81/17/384548117.db2.gz YDUCUWYLXPCOIG-LBPRGKRZSA-N 1 2 229.283 2.070 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CCCC[C@@H](C)C1 ZINC000566452547 384550811 /nfs/dbraw/zinc/55/08/11/384550811.db2.gz ZGRKUFMCTDCYDV-VXGBXAGGSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CCCC[C@@H](C)C1 ZINC000566452547 384550819 /nfs/dbraw/zinc/55/08/19/384550819.db2.gz ZGRKUFMCTDCYDV-VXGBXAGGSA-N 1 2 249.358 2.237 20 0 BEADLO Cc1c[nH+]c(CNc2cnccc2C)n1C ZINC000309713173 384552834 /nfs/dbraw/zinc/55/28/34/384552834.db2.gz RPHFBWTVFLRUEQ-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO Cc1[nH+]cccc1N[C@H]1CCO[C@@H](C)C1 ZINC000085726722 384554299 /nfs/dbraw/zinc/55/42/99/384554299.db2.gz OPHSIJJUJVNUKL-ONGXEEELSA-N 1 2 206.289 2.369 20 0 BEADLO C[NH+](C)c1ccc(NCc2ncc[nH]2)cc1 ZINC000049714874 384559601 /nfs/dbraw/zinc/55/96/01/384559601.db2.gz VPLIFWRYAMHYTE-UHFFFAOYSA-N 1 2 216.288 2.088 20 0 BEADLO c1c[nH+]c(COCCOc2ccccc2)[nH]1 ZINC000123836348 384588499 /nfs/dbraw/zinc/58/84/99/384588499.db2.gz TWODRHKQGNQGPE-UHFFFAOYSA-N 1 2 218.256 2.005 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@H](CF)C2)cc1F ZINC000334865470 384603208 /nfs/dbraw/zinc/60/32/08/384603208.db2.gz UHNQZZMFJFPWPA-GFCCVEGCSA-N 1 2 241.281 2.304 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@H](CF)C2)cc1F ZINC000334865470 384603209 /nfs/dbraw/zinc/60/32/09/384603209.db2.gz UHNQZZMFJFPWPA-GFCCVEGCSA-N 1 2 241.281 2.304 20 0 BEADLO CCSCCCNc1cc[nH+]c(C)n1 ZINC000300858145 384612583 /nfs/dbraw/zinc/61/25/83/384612583.db2.gz CCUUOKKZRZQQCT-UHFFFAOYSA-N 1 2 211.334 2.340 20 0 BEADLO CC(C)(C)C[N@@H+]1CCOCC(F)(F)C1 ZINC000367680778 384617131 /nfs/dbraw/zinc/61/71/31/384617131.db2.gz BIUHWNOHDDIGBW-UHFFFAOYSA-N 1 2 207.264 2.000 20 0 BEADLO CC(C)(C)C[N@H+]1CCOCC(F)(F)C1 ZINC000367680778 384617137 /nfs/dbraw/zinc/61/71/37/384617137.db2.gz BIUHWNOHDDIGBW-UHFFFAOYSA-N 1 2 207.264 2.000 20 0 BEADLO COC(=O)[C@H](C)[N@@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000081573385 384622420 /nfs/dbraw/zinc/62/24/20/384622420.db2.gz NYMYSHKKOFDPQR-MDZLAQPJSA-N 1 2 233.311 2.241 20 0 BEADLO COC(=O)[C@H](C)[N@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000081573385 384622430 /nfs/dbraw/zinc/62/24/30/384622430.db2.gz NYMYSHKKOFDPQR-MDZLAQPJSA-N 1 2 233.311 2.241 20 0 BEADLO Cc1nc(N2CCSC(C)(C)C2)cc[nH+]1 ZINC000081032624 384601012 /nfs/dbraw/zinc/60/10/12/384601012.db2.gz CAPCUBJOAYZGAV-UHFFFAOYSA-N 1 2 223.345 2.117 20 0 BEADLO CCC[C@H]1C[N@@H+]([C@@H](C)c2cnccn2)CCO1 ZINC000184694923 384637202 /nfs/dbraw/zinc/63/72/02/384637202.db2.gz KSVKCJSJRXCDBG-RYUDHWBXSA-N 1 2 235.331 2.039 20 0 BEADLO CCC[C@H]1C[N@H+]([C@@H](C)c2cnccn2)CCO1 ZINC000184694923 384637205 /nfs/dbraw/zinc/63/72/05/384637205.db2.gz KSVKCJSJRXCDBG-RYUDHWBXSA-N 1 2 235.331 2.039 20 0 BEADLO CCCC(=O)N1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000124467477 384641177 /nfs/dbraw/zinc/64/11/77/384641177.db2.gz FOFBGLAUZXTVQK-NEPJUHHUSA-N 1 2 235.331 2.093 20 0 BEADLO C/C=C/C[C@@H](CO)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000184806076 384649555 /nfs/dbraw/zinc/64/95/55/384649555.db2.gz OZPHBRKBNZDTBJ-PCAWENJQSA-N 1 2 247.342 2.401 20 0 BEADLO Cn1cccc1C(=O)C[NH+]1Cc2ccccc2C1 ZINC000050911606 384651061 /nfs/dbraw/zinc/65/10/61/384651061.db2.gz CHUOCNMDFBSIJF-UHFFFAOYSA-N 1 2 240.306 2.224 20 0 BEADLO COCc1ccc(C[NH2+]Cc2ccco2)o1 ZINC000125027748 384689459 /nfs/dbraw/zinc/68/94/59/384689459.db2.gz DIMOTCNYEMJCHY-UHFFFAOYSA-N 1 2 221.256 2.309 20 0 BEADLO c1cn2c([nH+]1)[C@H](Nc1ccc3c(c1)CCO3)CC2 ZINC000294259172 384702664 /nfs/dbraw/zinc/70/26/64/384702664.db2.gz XCPXVTBYPRXNAC-GFCCVEGCSA-N 1 2 241.294 2.375 20 0 BEADLO CC(C)(O)CNc1ccc2ccccc2[nH+]1 ZINC000082686939 384703372 /nfs/dbraw/zinc/70/33/72/384703372.db2.gz MXXHPUMJYSWDNP-UHFFFAOYSA-N 1 2 216.284 2.418 20 0 BEADLO COC(=O)C[N@H+](Cc1ccco1)C1CCCC1 ZINC000052077188 384715068 /nfs/dbraw/zinc/71/50/68/384715068.db2.gz BNTHBJNEDOWKTE-UHFFFAOYSA-N 1 2 237.299 2.197 20 0 BEADLO COC(=O)C[N@@H+](Cc1ccco1)C1CCCC1 ZINC000052077188 384715074 /nfs/dbraw/zinc/71/50/74/384715074.db2.gz BNTHBJNEDOWKTE-UHFFFAOYSA-N 1 2 237.299 2.197 20 0 BEADLO CCCCCC(=O)N1CCn2cc(C)[nH+]c2C1 ZINC000363704275 384717852 /nfs/dbraw/zinc/71/78/52/384717852.db2.gz WSWCYUWUPJEOBI-UHFFFAOYSA-N 1 2 235.331 2.114 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CC2CCC1CC2)c1[nH]cc[nH+]1 ZINC000394053583 384736576 /nfs/dbraw/zinc/73/65/76/384736576.db2.gz ABTPOANFCWVMIH-YYJSSNLHSA-N 1 2 247.342 2.413 20 0 BEADLO CCC1(C(=O)NCCn2cc[nH+]c2)CCCCC1 ZINC000185576361 384739592 /nfs/dbraw/zinc/73/95/92/384739592.db2.gz LJYCFZZDAFKBES-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO Cc1nnc(C[NH2+]C(C)(C)c2cccs2)o1 ZINC000309701903 384750142 /nfs/dbraw/zinc/75/01/42/384750142.db2.gz MZJJAVDBPWEJGI-UHFFFAOYSA-N 1 2 237.328 2.464 20 0 BEADLO Cc1nc(C[N@H+](C)CCc2cccs2)no1 ZINC000174150463 384760530 /nfs/dbraw/zinc/76/05/30/384760530.db2.gz BLFFWFFXTHEPHC-UHFFFAOYSA-N 1 2 237.328 2.114 20 0 BEADLO Cc1nc(C[N@@H+](C)CCc2cccs2)no1 ZINC000174150463 384760539 /nfs/dbraw/zinc/76/05/39/384760539.db2.gz BLFFWFFXTHEPHC-UHFFFAOYSA-N 1 2 237.328 2.114 20 0 BEADLO C[C@@H](C(=O)N(C)c1ccc[nH+]c1N(C)C)C1CC1 ZINC000176782622 384768804 /nfs/dbraw/zinc/76/88/04/384768804.db2.gz KVOXMYMGIFGAKZ-SNVBAGLBSA-N 1 2 247.342 2.157 20 0 BEADLO Cc1nn(C)cc1CNc1ccc(C)[nH+]c1 ZINC000126074061 384770241 /nfs/dbraw/zinc/77/02/41/384770241.db2.gz GPGGAVLGHWBERN-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO C[C@H]1SCC[N@H+](CC(=O)OC(C)(C)C)[C@@H]1C ZINC000118415315 384837887 /nfs/dbraw/zinc/83/78/87/384837887.db2.gz HJMMQHWQACGTTG-NXEZZACHSA-N 1 2 245.388 2.154 20 0 BEADLO C[C@H]1SCC[N@@H+](CC(=O)OC(C)(C)C)[C@@H]1C ZINC000118415315 384837893 /nfs/dbraw/zinc/83/78/93/384837893.db2.gz HJMMQHWQACGTTG-NXEZZACHSA-N 1 2 245.388 2.154 20 0 BEADLO CC(C)c1nc(NC[C@H]2CCSC2)cc[nH+]1 ZINC000336755699 384836045 /nfs/dbraw/zinc/83/60/45/384836045.db2.gz XWTTYSXLKAAPIC-SNVBAGLBSA-N 1 2 237.372 2.187 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1cscn1 ZINC000126736866 384797378 /nfs/dbraw/zinc/79/73/78/384797378.db2.gz XXNWIWAWJAWUAX-UHFFFAOYSA-N 1 2 208.286 2.334 20 0 BEADLO CCC[C@H](CC)NC(=O)[C@H]1CCn2c[nH+]cc2C1 ZINC000151804449 384798087 /nfs/dbraw/zinc/79/80/87/384798087.db2.gz VYKKRKZHJDXQJC-RYUDHWBXSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1csc([C@H]([NH2+]Cc2ncc[nH]2)C2CC2)n1 ZINC000174541941 384805765 /nfs/dbraw/zinc/80/57/65/384805765.db2.gz UPMPJFDUAHYSKZ-LLVKDONJSA-N 1 2 248.355 2.416 20 0 BEADLO Cc1csc([C@H](NCc2[nH]cc[nH+]2)C2CC2)n1 ZINC000174541941 384805770 /nfs/dbraw/zinc/80/57/70/384805770.db2.gz UPMPJFDUAHYSKZ-LLVKDONJSA-N 1 2 248.355 2.416 20 0 BEADLO CC(C)c1nc(NC[C@H]2CC[C@@H](O)C2)cc[nH+]1 ZINC000302673479 384807059 /nfs/dbraw/zinc/80/70/59/384807059.db2.gz LORWPWPXMPEHGY-WDEREUQCSA-N 1 2 235.331 2.173 20 0 BEADLO CC(C)[C@@H](NC(=O)OCCCF)c1[nH]cc[nH+]1 ZINC000497214746 384876291 /nfs/dbraw/zinc/87/62/91/384876291.db2.gz NTMFOTNVWXKKAH-SECBINFHSA-N 1 2 243.282 2.193 20 0 BEADLO C[C@]1(CNc2cccc[nH+]2)CCCC[C@@H]1O ZINC000301485597 384877298 /nfs/dbraw/zinc/87/72/98/384877298.db2.gz HIJLVUGUKJOVRF-WCQYABFASA-N 1 2 220.316 2.435 20 0 BEADLO C[C@@]1(CNc2cccc[nH+]2)CCCC[C@@H]1O ZINC000301485595 384877793 /nfs/dbraw/zinc/87/77/93/384877793.db2.gz HIJLVUGUKJOVRF-AAEUAGOBSA-N 1 2 220.316 2.435 20 0 BEADLO FC(F)n1ccc(C[NH2+]Cc2ccoc2)n1 ZINC000336672071 384843694 /nfs/dbraw/zinc/84/36/94/384843694.db2.gz IYJJLKBBIUMFFH-UHFFFAOYSA-N 1 2 227.214 2.161 20 0 BEADLO C[C@H]([NH2+][C@H](CCO)c1ccco1)c1ccccn1 ZINC000186515341 384846653 /nfs/dbraw/zinc/84/66/53/384846653.db2.gz PAVMHBGMRKXTHT-WCQYABFASA-N 1 2 246.310 2.449 20 0 BEADLO C[C@H]([NH2+][C@@H](CCO)c1ccco1)c1ccccn1 ZINC000186515309 384846878 /nfs/dbraw/zinc/84/68/78/384846878.db2.gz PAVMHBGMRKXTHT-AAEUAGOBSA-N 1 2 246.310 2.449 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1ccc(F)c(C)c1 ZINC000336063650 384869593 /nfs/dbraw/zinc/86/95/93/384869593.db2.gz DNODQGKGHMSIAA-UHFFFAOYSA-N 1 2 247.273 2.096 20 0 BEADLO CO[C@@H](CNc1cc(C)[nH+]c(C(C)C)n1)C1CC1 ZINC000338796616 384958018 /nfs/dbraw/zinc/95/80/18/384958018.db2.gz WBJAISNSVYYLNP-LBPRGKRZSA-N 1 2 249.358 2.167 20 0 BEADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1cccn1C ZINC000175326140 384892285 /nfs/dbraw/zinc/89/22/85/384892285.db2.gz WHUKXHAKNJGWLA-GFCCVEGCSA-N 1 2 229.327 2.403 20 0 BEADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1cccn1C ZINC000175326140 384892291 /nfs/dbraw/zinc/89/22/91/384892291.db2.gz WHUKXHAKNJGWLA-GFCCVEGCSA-N 1 2 229.327 2.403 20 0 BEADLO Cn1c(Cl)cnc1C[N@@H+]1CCCC2(CC2)C1 ZINC000186994087 384902725 /nfs/dbraw/zinc/90/27/25/384902725.db2.gz KYKXOIAMVOANCR-UHFFFAOYSA-N 1 2 239.750 2.450 20 0 BEADLO Cn1c(Cl)cnc1C[N@H+]1CCCC2(CC2)C1 ZINC000186994087 384902733 /nfs/dbraw/zinc/90/27/33/384902733.db2.gz KYKXOIAMVOANCR-UHFFFAOYSA-N 1 2 239.750 2.450 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635765675 384905976 /nfs/dbraw/zinc/90/59/76/384905976.db2.gz SOQMPKJYCLLFQP-DDHJBXDOSA-N 1 2 247.342 2.303 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635765675 384905984 /nfs/dbraw/zinc/90/59/84/384905984.db2.gz SOQMPKJYCLLFQP-DDHJBXDOSA-N 1 2 247.342 2.303 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1cscn1)c1cn[nH]c1 ZINC000222510249 384917269 /nfs/dbraw/zinc/91/72/69/384917269.db2.gz RQYJSBKPMSZDPJ-HTQZYQBOSA-N 1 2 222.317 2.278 20 0 BEADLO C[C@@]12CC[N@H+](Cc3cnns3)C[C@@H]1C2(F)F ZINC000336275314 384921708 /nfs/dbraw/zinc/92/17/08/384921708.db2.gz NKGSPZVTZCNCAH-DTWKUNHWSA-N 1 2 245.298 2.015 20 0 BEADLO C[C@@]12CC[N@@H+](Cc3cnns3)C[C@@H]1C2(F)F ZINC000336275314 384921713 /nfs/dbraw/zinc/92/17/13/384921713.db2.gz NKGSPZVTZCNCAH-DTWKUNHWSA-N 1 2 245.298 2.015 20 0 BEADLO CCc1nc(C[N@H+](C)[C@H](C)C2(C)CC2)no1 ZINC000177232105 384924731 /nfs/dbraw/zinc/92/47/31/384924731.db2.gz JFFRZINGJIFZDD-SECBINFHSA-N 1 2 223.320 2.252 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@H](C)C2(C)CC2)no1 ZINC000177232105 384924735 /nfs/dbraw/zinc/92/47/35/384924735.db2.gz JFFRZINGJIFZDD-SECBINFHSA-N 1 2 223.320 2.252 20 0 BEADLO COc1c(C)c[nH+]c(CSCCCO)c1C ZINC000085163361 384926117 /nfs/dbraw/zinc/92/61/17/384926117.db2.gz ZUUYLPVMNPWOCI-UHFFFAOYSA-N 1 2 241.356 2.323 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)CC1=CCCCC1 ZINC000106730992 384928336 /nfs/dbraw/zinc/92/83/36/384928336.db2.gz DPCNZGSHCFYQLN-UHFFFAOYSA-N 1 2 247.342 2.269 20 0 BEADLO CNc1ccc(Nc2nc(C)ns2)c[nH+]1 ZINC000301923354 384944941 /nfs/dbraw/zinc/94/49/41/384944941.db2.gz HDRLOHCTLICLSX-UHFFFAOYSA-N 1 2 221.289 2.027 20 0 BEADLO C[C@@H](F)CCNc1cc[nH+]c2ccncc12 ZINC000338759492 384946610 /nfs/dbraw/zinc/94/66/10/384946610.db2.gz YOAVIFBOSRYZOR-SECBINFHSA-N 1 2 219.263 2.212 20 0 BEADLO c1ccc(NCC2CC2)c(C[NH+]2CCOCC2)c1 ZINC000127784732 384946844 /nfs/dbraw/zinc/94/68/44/384946844.db2.gz DEQCVTWFAYCECE-UHFFFAOYSA-N 1 2 246.354 2.341 20 0 BEADLO Cc1cc(C[NH2+][C@H]2C[C@H](C)n3ccnc32)sn1 ZINC000404342578 384975292 /nfs/dbraw/zinc/97/52/92/384975292.db2.gz FQSALBCXLYVJRR-ONGXEEELSA-N 1 2 248.355 2.444 20 0 BEADLO c1ccc(N[C@@H]2C[C@@H]3OCCC[C@@H]23)[nH+]c1 ZINC000302441872 384991894 /nfs/dbraw/zinc/99/18/94/384991894.db2.gz NFZQQCQQPNMXBT-AXFHLTTASA-N 1 2 204.273 2.061 20 0 BEADLO Cc1cnc([C@H](C)[NH+]2CCSCC2)o1 ZINC000335665278 385017189 /nfs/dbraw/zinc/01/71/89/385017189.db2.gz UVYCPYKGRYMMJN-VIFPVBQESA-N 1 2 212.318 2.093 20 0 BEADLO Cc1noc(C)c1C(=O)Nc1cc[nH+]cc1C ZINC000107292103 384961717 /nfs/dbraw/zinc/96/17/17/384961717.db2.gz JEDVUZOGDIBHHN-UHFFFAOYSA-N 1 2 231.255 2.247 20 0 BEADLO Cc1noc(C)c1CC(=O)Nc1cc[nH+]cc1C ZINC000107285667 384962798 /nfs/dbraw/zinc/96/27/98/384962798.db2.gz XKWKIFBHBNFFSE-UHFFFAOYSA-N 1 2 245.282 2.176 20 0 BEADLO Cc1n[nH]cc1CNc1ccc[nH+]c1C ZINC000085726814 384964220 /nfs/dbraw/zinc/96/42/20/384964220.db2.gz UYAHSYRNYRMWGP-UHFFFAOYSA-N 1 2 202.261 2.034 20 0 BEADLO Cc1nc(C[N@H+]2C[C@@H](C)OC[C@@H]2C)c(C)s1 ZINC000336324080 385060619 /nfs/dbraw/zinc/06/06/19/385060619.db2.gz TYWPMXPJSXIWLO-DTWKUNHWSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)c(C)s1 ZINC000336324080 385060622 /nfs/dbraw/zinc/06/06/22/385060622.db2.gz TYWPMXPJSXIWLO-DTWKUNHWSA-N 1 2 240.372 2.369 20 0 BEADLO C[N@H+](CCc1ccccn1)Cc1cscn1 ZINC000176142239 385024501 /nfs/dbraw/zinc/02/45/01/385024501.db2.gz QEDOSUNWDIUERI-UHFFFAOYSA-N 1 2 233.340 2.213 20 0 BEADLO C[N@@H+](CCc1ccccn1)Cc1cscn1 ZINC000176142239 385024509 /nfs/dbraw/zinc/02/45/09/385024509.db2.gz QEDOSUNWDIUERI-UHFFFAOYSA-N 1 2 233.340 2.213 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N(C)CC(F)(F)F ZINC000188189280 385024688 /nfs/dbraw/zinc/02/46/88/385024688.db2.gz CSMLZBAZYFUTAC-UHFFFAOYSA-N 1 2 247.220 2.416 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C1(O)CCCCC1 ZINC000086584498 385029044 /nfs/dbraw/zinc/02/90/44/385029044.db2.gz GCNXSVLYDMHQMG-UHFFFAOYSA-N 1 2 234.299 2.024 20 0 BEADLO Cc1[nH]c(C(=O)NC2(C)CCC(C)CC2)c[nH+]1 ZINC000270080167 385032780 /nfs/dbraw/zinc/03/27/80/385032780.db2.gz LCQXOXIMSMCIII-UHFFFAOYSA-N 1 2 235.331 2.417 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1ccccc1CC ZINC000188914830 385042242 /nfs/dbraw/zinc/04/22/42/385042242.db2.gz ZQQBDOSFJBQRRU-UHFFFAOYSA-N 1 2 235.327 2.244 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1ccccc1CC ZINC000188914830 385042250 /nfs/dbraw/zinc/04/22/50/385042250.db2.gz ZQQBDOSFJBQRRU-UHFFFAOYSA-N 1 2 235.327 2.244 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)[C@@H]2C[C@@H]2C(C)C)[nH+]1 ZINC000516657462 385123840 /nfs/dbraw/zinc/12/38/40/385123840.db2.gz ZOYVMRCKPDZZBE-GHMZBOCLSA-N 1 2 249.358 2.362 20 0 BEADLO Cc1ccc([S@](=O)Cc2[nH+]ccn2C)cc1 ZINC000129231564 385124471 /nfs/dbraw/zinc/12/44/71/385124471.db2.gz TUMCNMZOCJISES-INIZCTEOSA-N 1 2 234.324 2.036 20 0 BEADLO CC[C@@H](C)C[N@H+](CC)Cc1noc(C)n1 ZINC000177854736 385129970 /nfs/dbraw/zinc/12/99/70/385129970.db2.gz IKBUTCYNLSHCCE-SECBINFHSA-N 1 2 211.309 2.246 20 0 BEADLO CC[C@@H](C)C[N@@H+](CC)Cc1noc(C)n1 ZINC000177854736 385129978 /nfs/dbraw/zinc/12/99/78/385129978.db2.gz IKBUTCYNLSHCCE-SECBINFHSA-N 1 2 211.309 2.246 20 0 BEADLO Nc1ccc(NC(=O)C2CCCCC2)c[nH+]1 ZINC000061680481 385132500 /nfs/dbraw/zinc/13/25/00/385132500.db2.gz IRYZIUPDSYTUPT-UHFFFAOYSA-N 1 2 219.288 2.183 20 0 BEADLO Cc1cccc([S@@](=O)Cc2[nH+]ccn2C)c1 ZINC000129287765 385133084 /nfs/dbraw/zinc/13/30/84/385133084.db2.gz XIMATOJRPOUXLP-MRXNPFEDSA-N 1 2 234.324 2.036 20 0 BEADLO c1cnc2ccc(C[N@@H+]3CCO[C@H]4C[C@H]43)cc2c1 ZINC000644716261 385133572 /nfs/dbraw/zinc/13/35/72/385133572.db2.gz NLNYZLILLCHQOB-CABCVRRESA-N 1 2 240.306 2.208 20 0 BEADLO c1cnc2ccc(C[N@H+]3CCO[C@H]4C[C@H]43)cc2c1 ZINC000644716261 385133577 /nfs/dbraw/zinc/13/35/77/385133577.db2.gz NLNYZLILLCHQOB-CABCVRRESA-N 1 2 240.306 2.208 20 0 BEADLO CC(C)(C)c1nc(C[N@@H+]2CC[C@H](O)C2)cs1 ZINC000061708692 385134667 /nfs/dbraw/zinc/13/46/67/385134667.db2.gz OZKOFTDNBINAEL-JTQLQIEISA-N 1 2 240.372 2.007 20 0 BEADLO CC(C)(C)c1nc(C[N@H+]2CC[C@H](O)C2)cs1 ZINC000061708692 385134676 /nfs/dbraw/zinc/13/46/76/385134676.db2.gz OZKOFTDNBINAEL-JTQLQIEISA-N 1 2 240.372 2.007 20 0 BEADLO CCC[C@](C)([NH2+]CCSCC)C(=O)OC ZINC000119648281 385134845 /nfs/dbraw/zinc/13/48/45/385134845.db2.gz WINGFAKOJFZWSF-NSHDSACASA-N 1 2 233.377 2.061 20 0 BEADLO COc1cc(C)[nH+]c(CN[C@H](C)C(F)(F)F)c1 ZINC000342294537 385136156 /nfs/dbraw/zinc/13/61/56/385136156.db2.gz QETSOGKWQDRPQV-MRVPVSSYSA-N 1 2 248.248 2.439 20 0 BEADLO Cn1cc[nH+]c1C[S@](=O)C1CCCCC1 ZINC000129314738 385136820 /nfs/dbraw/zinc/13/68/20/385136820.db2.gz DYASQSKGBVVIKH-OAHLLOKOSA-N 1 2 226.345 2.002 20 0 BEADLO CC[C@](C)(NCc1[nH]cc[nH+]1)c1nccs1 ZINC000152643874 385197317 /nfs/dbraw/zinc/19/73/17/385197317.db2.gz FUFIKCFRKQYZRU-NSHDSACASA-N 1 2 236.344 2.281 20 0 BEADLO CC[C@](C)([NH2+]Cc1ncc[nH]1)c1nccs1 ZINC000152643874 385197321 /nfs/dbraw/zinc/19/73/21/385197321.db2.gz FUFIKCFRKQYZRU-NSHDSACASA-N 1 2 236.344 2.281 20 0 BEADLO COC(=O)[C@H]1CCCC[N@@H+]1Cc1ccc(C)o1 ZINC000152051106 385152051 /nfs/dbraw/zinc/15/20/51/385152051.db2.gz JJMQCXUQZSFWKB-GFCCVEGCSA-N 1 2 237.299 2.116 20 0 BEADLO COC(=O)[C@H]1CCCC[N@H+]1Cc1ccc(C)o1 ZINC000152051106 385152057 /nfs/dbraw/zinc/15/20/57/385152057.db2.gz JJMQCXUQZSFWKB-GFCCVEGCSA-N 1 2 237.299 2.116 20 0 BEADLO Cc1nc(N(C)[C@@H](C)C2(C)CC2)cc[nH+]1 ZINC000176856178 385152771 /nfs/dbraw/zinc/15/27/71/385152771.db2.gz OZTRDFIYWULYSR-VIFPVBQESA-N 1 2 205.305 2.410 20 0 BEADLO Cc1n[nH]cc1NC(=O)Nc1ccc(C)[nH+]c1C ZINC000152347374 385176804 /nfs/dbraw/zinc/17/68/04/385176804.db2.gz IIHDJKMUXCBZKC-UHFFFAOYSA-N 1 2 245.286 2.374 20 0 BEADLO Cn1cc(C[N@@H+]2CCc3c(F)cccc3C2)cn1 ZINC000152770492 385213061 /nfs/dbraw/zinc/21/30/61/385213061.db2.gz FLOZWBJDYHGDEK-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1cc(C[N@H+]2CCc3c(F)cccc3C2)cn1 ZINC000152770492 385213065 /nfs/dbraw/zinc/21/30/65/385213065.db2.gz FLOZWBJDYHGDEK-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO CC1=CCC[C@H](C)[C@@H]1C[N@H+]1CC(=O)N(C2CC2)C1 ZINC000448262917 385230098 /nfs/dbraw/zinc/23/00/98/385230098.db2.gz GNARJJWVKJRZHI-GXTWGEPZSA-N 1 2 248.370 2.243 20 0 BEADLO CC1=CCC[C@H](C)[C@@H]1C[N@@H+]1CC(=O)N(C2CC2)C1 ZINC000448262917 385230104 /nfs/dbraw/zinc/23/01/04/385230104.db2.gz GNARJJWVKJRZHI-GXTWGEPZSA-N 1 2 248.370 2.243 20 0 BEADLO Cc1cc(C)n(CCCNc2cccc[nH+]2)n1 ZINC000130237728 385232330 /nfs/dbraw/zinc/23/23/30/385232330.db2.gz QECUDIBXNMRYCY-UHFFFAOYSA-N 1 2 230.315 2.397 20 0 BEADLO Cc1ccc(N[C@H](C)c2cnn(C)c2)c[nH+]1 ZINC000154242637 385311148 /nfs/dbraw/zinc/31/11/48/385311148.db2.gz MJSKEECKYJTARB-SNVBAGLBSA-N 1 2 216.288 2.297 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2cccnc2)CCO1 ZINC000131248667 385321495 /nfs/dbraw/zinc/32/14/95/385321495.db2.gz KGIZXYZMONCLKN-ZDUSSCGKSA-N 1 2 220.316 2.083 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2cccnc2)CCO1 ZINC000131248667 385321498 /nfs/dbraw/zinc/32/14/98/385321498.db2.gz KGIZXYZMONCLKN-ZDUSSCGKSA-N 1 2 220.316 2.083 20 0 BEADLO C[C@H](CNC(=O)c1cccs1)Cn1cc[nH+]c1 ZINC000153460776 385258266 /nfs/dbraw/zinc/25/82/66/385258266.db2.gz OMHFMYQVMPYLQE-SNVBAGLBSA-N 1 2 249.339 2.011 20 0 BEADLO CCOC[C@@H](O)CNc1ccc2ccccc2[nH+]1 ZINC000310994237 385266059 /nfs/dbraw/zinc/26/60/59/385266059.db2.gz WGRDAYBONRKSHI-LBPRGKRZSA-N 1 2 246.310 2.044 20 0 BEADLO COC(=O)[C@H]1[C@@H]2CCC[C@@H]2C[N@@H+]1C/C=C/Cl ZINC000191215142 385293696 /nfs/dbraw/zinc/29/36/96/385293696.db2.gz REYZKIKEAIZFSI-ACBLUPFASA-N 1 2 243.734 2.012 20 0 BEADLO COC(=O)[C@H]1[C@@H]2CCC[C@@H]2C[N@H+]1C/C=C/Cl ZINC000191215142 385293699 /nfs/dbraw/zinc/29/36/99/385293699.db2.gz REYZKIKEAIZFSI-ACBLUPFASA-N 1 2 243.734 2.012 20 0 BEADLO CC(C)C[C@@H]1CCN(c2cc(CO)cc[nH+]2)C1 ZINC000307848209 385301570 /nfs/dbraw/zinc/30/15/70/385301570.db2.gz SZPFSTIXRZYOHF-LBPRGKRZSA-N 1 2 234.343 2.446 20 0 BEADLO C[N@H+](CCOCc1ccccc1)Cc1cocn1 ZINC000191949989 385336141 /nfs/dbraw/zinc/33/61/41/385336141.db2.gz FUOPDSNDZKXRCL-UHFFFAOYSA-N 1 2 246.310 2.323 20 0 BEADLO C[N@@H+](CCOCc1ccccc1)Cc1cocn1 ZINC000191949989 385336145 /nfs/dbraw/zinc/33/61/45/385336145.db2.gz FUOPDSNDZKXRCL-UHFFFAOYSA-N 1 2 246.310 2.323 20 0 BEADLO CC(C)[C@@H]1C[N@H+](Cc2cocn2)CCS1 ZINC000191949268 385336734 /nfs/dbraw/zinc/33/67/34/385336734.db2.gz MUVCQJLDBCHMKX-NSHDSACASA-N 1 2 226.345 2.248 20 0 BEADLO CC(C)[C@@H]1C[N@@H+](Cc2cocn2)CCS1 ZINC000191949268 385336737 /nfs/dbraw/zinc/33/67/37/385336737.db2.gz MUVCQJLDBCHMKX-NSHDSACASA-N 1 2 226.345 2.248 20 0 BEADLO C[C@@H](CF)[NH2+]Cc1ncc(Cl)s1 ZINC000308004584 385391172 /nfs/dbraw/zinc/39/11/72/385391172.db2.gz CRHAXQDRZXXJIS-YFKPBYRVSA-N 1 2 208.689 2.244 20 0 BEADLO c1cn(CCCCC2CCOCC2)c[nH+]1 ZINC000281051653 385389504 /nfs/dbraw/zinc/38/95/04/385389504.db2.gz SMKHYAPWDUFVPX-UHFFFAOYSA-N 1 2 208.305 2.480 20 0 BEADLO COc1ccc(CNc2c[nH+]ccc2C)cn1 ZINC000158109881 385352169 /nfs/dbraw/zinc/35/21/69/385352169.db2.gz GRCMIJLPEHFEOF-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO CC(C)CCC(=O)NCc1ccn2cc[nH+]c2c1 ZINC000178364199 385361776 /nfs/dbraw/zinc/36/17/76/385361776.db2.gz QGWNOAOGVHPFPH-UHFFFAOYSA-N 1 2 245.326 2.387 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)C1CCOCC1)C(F)(F)F ZINC000309022740 385364733 /nfs/dbraw/zinc/36/47/33/385364733.db2.gz YFOUXBAYOMWWOL-JGVFFNPUSA-N 1 2 225.254 2.342 20 0 BEADLO CC[C@H]([NH2+][C@@H]1CCOC[C@@H]1C)C(F)(F)F ZINC000309064202 385391261 /nfs/dbraw/zinc/39/12/61/385391261.db2.gz YIZDSNFDOGUDQA-YIZRAAEISA-N 1 2 225.254 2.342 20 0 BEADLO Cc1cc[nH+]c(N[C@@H](C)[C@H](C)CO)c1Cl ZINC000309019109 385372679 /nfs/dbraw/zinc/37/26/79/385372679.db2.gz VXUPLFAVLNYDIR-BDAKNGLRSA-N 1 2 228.723 2.472 20 0 BEADLO Cc1cc[nH+]c(N[C@@H](C)[C@@H](C)CO)c1Cl ZINC000309019113 385373549 /nfs/dbraw/zinc/37/35/49/385373549.db2.gz VXUPLFAVLNYDIR-IUCAKERBSA-N 1 2 228.723 2.472 20 0 BEADLO CC[C@H]([NH2+][C@H]1CC12CCCCC2)C(=O)OC ZINC000192862247 385375163 /nfs/dbraw/zinc/37/51/63/385375163.db2.gz VSHHZPFGRQJBSX-QWRGUYRKSA-N 1 2 225.332 2.250 20 0 BEADLO CC[C@H]([NH2+][C@H]1CCOC[C@@H]1C)C(F)(F)F ZINC000309064199 385390559 /nfs/dbraw/zinc/39/05/59/385390559.db2.gz YIZDSNFDOGUDQA-CIUDSAMLSA-N 1 2 225.254 2.342 20 0 BEADLO Cc1c[nH]nc1CNc1c[nH+]ccc1C ZINC000289411601 385377260 /nfs/dbraw/zinc/37/72/60/385377260.db2.gz BNOPLDWPRNTUIS-UHFFFAOYSA-N 1 2 202.261 2.034 20 0 BEADLO COc1cc(C)[nH+]c(CSC[C@@H](C)CO)c1 ZINC000168878411 385390881 /nfs/dbraw/zinc/39/08/81/385390881.db2.gz VOAWBWPWYYQEMT-VIFPVBQESA-N 1 2 241.356 2.260 20 0 BEADLO Cc1ccc(N[C@H](C)[C@H]2CCCO2)c[nH+]1 ZINC000309042654 385387520 /nfs/dbraw/zinc/38/75/20/385387520.db2.gz KXJIZOVGMYNFKP-ZYHUDNBSSA-N 1 2 206.289 2.369 20 0 BEADLO C[NH+](C)Cc1nc(CCCc2ccccc2)no1 ZINC000191821306 385327702 /nfs/dbraw/zinc/32/77/02/385327702.db2.gz FVMPOSRIFAYHMV-UHFFFAOYSA-N 1 2 245.326 2.307 20 0 BEADLO Cc1nnsc1C[NH2+]Cc1ccc(Cl)o1 ZINC000309083642 385401817 /nfs/dbraw/zinc/40/18/17/385401817.db2.gz UEHOGNRZKOPQGS-UHFFFAOYSA-N 1 2 243.719 2.383 20 0 BEADLO CC[C@@H](C)OCC(=O)Nc1ccc(C)[nH+]c1C ZINC000178914170 385426409 /nfs/dbraw/zinc/42/64/09/385426409.db2.gz OBDNTYGTEZEDDH-SNVBAGLBSA-N 1 2 236.315 2.452 20 0 BEADLO Cc1ccc(NC(=O)C=Cc2c[nH]c[nH+]2)c(C)n1 ZINC000492813820 385439204 /nfs/dbraw/zinc/43/92/04/385439204.db2.gz QLWVOZIBHROHIU-GQCTYLIASA-N 1 2 242.282 2.073 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1cccc(F)c1N ZINC000156345956 385447265 /nfs/dbraw/zinc/44/72/65/385447265.db2.gz MRNRVNRZTAWVJT-LLVKDONJSA-N 1 2 238.306 2.019 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1cccc(F)c1N ZINC000156345956 385447270 /nfs/dbraw/zinc/44/72/70/385447270.db2.gz MRNRVNRZTAWVJT-LLVKDONJSA-N 1 2 238.306 2.019 20 0 BEADLO Cc1csc(C[N@H+]2CCO[C@H](C)[C@@H]2C)n1 ZINC000156442423 385452841 /nfs/dbraw/zinc/45/28/41/385452841.db2.gz IBIQFNRODUTJSF-VHSXEESVSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1csc(C[N@@H+]2CCO[C@H](C)[C@@H]2C)n1 ZINC000156442423 385452844 /nfs/dbraw/zinc/45/28/44/385452844.db2.gz IBIQFNRODUTJSF-VHSXEESVSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2ccon2)o1 ZINC000309134579 385427324 /nfs/dbraw/zinc/42/73/24/385427324.db2.gz RUSUZQVJDKQEIM-SECBINFHSA-N 1 2 206.245 2.427 20 0 BEADLO COC(=O)C[N@H+](C)Cc1c(C)oc2ccccc21 ZINC000179394995 385465160 /nfs/dbraw/zinc/46/51/60/385465160.db2.gz GRDGBARFNUFFLN-UHFFFAOYSA-N 1 2 247.294 2.346 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1c(C)oc2ccccc21 ZINC000179394995 385465161 /nfs/dbraw/zinc/46/51/61/385465161.db2.gz GRDGBARFNUFFLN-UHFFFAOYSA-N 1 2 247.294 2.346 20 0 BEADLO CCC[C@@H]([NH2+]CCSC(C)C)C(=O)OCC ZINC000309213511 385483401 /nfs/dbraw/zinc/48/34/01/385483401.db2.gz OPQPJZABJDOBIU-LLVKDONJSA-N 1 2 247.404 2.449 20 0 BEADLO CCCCCC(=O)Nc1cc[nH+]cc1O ZINC000109889041 385490877 /nfs/dbraw/zinc/49/08/77/385490877.db2.gz OWXLHGMPEQREJZ-UHFFFAOYSA-N 1 2 208.261 2.306 20 0 BEADLO Cc1ccc(CC(=O)Nc2cc[nH+]cc2O)cc1 ZINC000109890904 385491095 /nfs/dbraw/zinc/49/10/95/385491095.db2.gz ZKIUCVMEEQDXII-UHFFFAOYSA-N 1 2 242.278 2.277 20 0 BEADLO O=S1CC[NH+]([C@H]2CCCc3ccccc32)CC1 ZINC000111223546 385496374 /nfs/dbraw/zinc/49/63/74/385496374.db2.gz YSSKELOOGBNJKP-AWEZNQCLSA-N 1 2 249.379 2.128 20 0 BEADLO CC[C@H]1C[N@H+](Cc2nc(C)c(C)o2)C[C@H](C)O1 ZINC000111274170 385498429 /nfs/dbraw/zinc/49/84/29/385498429.db2.gz IDMCTOJZUMSNSW-CABZTGNLSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2nc(C)c(C)o2)C[C@H](C)O1 ZINC000111274170 385498434 /nfs/dbraw/zinc/49/84/34/385498434.db2.gz IDMCTOJZUMSNSW-CABZTGNLSA-N 1 2 238.331 2.291 20 0 BEADLO Cn1ncnc1C[N@@H+]1CCC[C@@H]1c1cccs1 ZINC000157405141 385499315 /nfs/dbraw/zinc/49/93/15/385499315.db2.gz YCXUPQXEFJBCNW-SNVBAGLBSA-N 1 2 248.355 2.214 20 0 BEADLO Cn1ncnc1C[N@H+]1CCC[C@@H]1c1cccs1 ZINC000157405141 385499318 /nfs/dbraw/zinc/49/93/18/385499318.db2.gz YCXUPQXEFJBCNW-SNVBAGLBSA-N 1 2 248.355 2.214 20 0 BEADLO CC(C)[C@@H]1CCN(c2cc(CO)cc[nH+]2)C1 ZINC000166523844 385507029 /nfs/dbraw/zinc/50/70/29/385507029.db2.gz RJIBUFGBTKMVJB-GFCCVEGCSA-N 1 2 220.316 2.056 20 0 BEADLO C[N@H+](CCOc1ccc(F)cc1)Cc1cnc[nH]1 ZINC000179770323 385489921 /nfs/dbraw/zinc/48/99/21/385489921.db2.gz NOZULCPMQRPQAP-UHFFFAOYSA-N 1 2 249.289 2.060 20 0 BEADLO C[N@@H+](CCOc1ccc(F)cc1)Cc1cnc[nH]1 ZINC000179770323 385489926 /nfs/dbraw/zinc/48/99/26/385489926.db2.gz NOZULCPMQRPQAP-UHFFFAOYSA-N 1 2 249.289 2.060 20 0 BEADLO Cn1cc(C[N@@H+]2CCc3cccc(F)c3C2)cn1 ZINC000157885388 385533270 /nfs/dbraw/zinc/53/32/70/385533270.db2.gz CHNGWJUQQHJBGR-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1cc(C[N@H+]2CCc3cccc(F)c3C2)cn1 ZINC000157885388 385533273 /nfs/dbraw/zinc/53/32/73/385533273.db2.gz CHNGWJUQQHJBGR-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO COC[C@@H](C)N(C)c1cc(C)[nH+]c(C2CC2)n1 ZINC000172014543 385541511 /nfs/dbraw/zinc/54/15/11/385541511.db2.gz IUSMAGYAJCDLEA-SNVBAGLBSA-N 1 2 235.331 2.134 20 0 BEADLO CC(C)n1ccc(C[N@@H+]2CCS[C@H](C)C2)n1 ZINC000172013944 385541727 /nfs/dbraw/zinc/54/17/27/385541727.db2.gz HHBADIVWJXRFHZ-LLVKDONJSA-N 1 2 239.388 2.401 20 0 BEADLO CC(C)n1ccc(C[N@H+]2CCS[C@H](C)C2)n1 ZINC000172013944 385541729 /nfs/dbraw/zinc/54/17/29/385541729.db2.gz HHBADIVWJXRFHZ-LLVKDONJSA-N 1 2 239.388 2.401 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CCO[C@H](C)[C@H]1C ZINC000180726393 385541912 /nfs/dbraw/zinc/54/19/12/385541912.db2.gz RKKNYZYSMRTQNJ-GHMZBOCLSA-N 1 2 249.314 2.031 20 0 BEADLO Cc1nc(N2CC(C3CC3)C2)c(C)c(C)[nH+]1 ZINC000643170320 385546199 /nfs/dbraw/zinc/54/61/99/385546199.db2.gz KLOOHRFKEIMCHF-UHFFFAOYSA-N 1 2 217.316 2.248 20 0 BEADLO O=C(OCC1CC1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000364815076 385520670 /nfs/dbraw/zinc/52/06/70/385520670.db2.gz VDIGIBTUHYIXQZ-JTQLQIEISA-N 1 2 235.287 2.093 20 0 BEADLO C[C@@H]1CN(C(=O)/C=C/c2[nH]cc[nH+]2)CC(C)(C)C1 ZINC000493111065 385521548 /nfs/dbraw/zinc/52/15/48/385521548.db2.gz BHYRMCIAFVRJKB-ZWNMCFTASA-N 1 2 247.342 2.318 20 0 BEADLO Brc1cncc(C[NH+]2CCC2)c1 ZINC000258037678 385523801 /nfs/dbraw/zinc/52/38/01/385523801.db2.gz GSFGAMHIUMRRQG-UHFFFAOYSA-N 1 2 227.105 2.050 20 0 BEADLO CN(Cc1cscn1)c1cc[nH+]c(C2CC2)n1 ZINC000171863925 385524628 /nfs/dbraw/zinc/52/46/28/385524628.db2.gz GKHANTOQGSRXOP-UHFFFAOYSA-N 1 2 246.339 2.447 20 0 BEADLO Cc1cnc(C[N@H+](C)CCOCC2CC2)s1 ZINC000180539973 385528632 /nfs/dbraw/zinc/52/86/32/385528632.db2.gz QUFZDVYRTSTGLO-UHFFFAOYSA-N 1 2 240.372 2.310 20 0 BEADLO Cc1cnc(C[N@@H+](C)CCOCC2CC2)s1 ZINC000180539973 385528636 /nfs/dbraw/zinc/52/86/36/385528636.db2.gz QUFZDVYRTSTGLO-UHFFFAOYSA-N 1 2 240.372 2.310 20 0 BEADLO COc1ncccc1C(=O)Nc1cc[nH+]cc1C ZINC000107292947 385561879 /nfs/dbraw/zinc/56/18/79/385561879.db2.gz YHHSQRIWFZPWIJ-UHFFFAOYSA-N 1 2 243.266 2.046 20 0 BEADLO COC[C@H]([NH2+]Cc1ncc(C)o1)c1ccccc1 ZINC000181679755 385593594 /nfs/dbraw/zinc/59/35/94/385593594.db2.gz DRZJJEOBCKSVLM-ZDUSSCGKSA-N 1 2 246.310 2.460 20 0 BEADLO CC[C@](C)(OC)C(=O)Nc1cc[nH+]cc1C ZINC000280794596 385605220 /nfs/dbraw/zinc/60/52/20/385605220.db2.gz UZEUIGWNETVDLP-LBPRGKRZSA-N 1 2 222.288 2.144 20 0 BEADLO CC(C)c1ccc([C@@H](C)[N@@H+]2CCNC(=O)C2)cc1 ZINC000181510592 385581319 /nfs/dbraw/zinc/58/13/19/385581319.db2.gz SJHWLDBNQLKNFL-GFCCVEGCSA-N 1 2 246.354 2.303 20 0 BEADLO CC(C)c1ccc([C@@H](C)[N@H+]2CCNC(=O)C2)cc1 ZINC000181510592 385581320 /nfs/dbraw/zinc/58/13/20/385581320.db2.gz SJHWLDBNQLKNFL-GFCCVEGCSA-N 1 2 246.354 2.303 20 0 BEADLO CC[C@]1(C)CCN(C(=O)Nc2cc[nH+]cc2C)C1 ZINC000334614174 385588386 /nfs/dbraw/zinc/58/83/86/385588386.db2.gz WYPFUTSXPXEOKR-CQSZACIVSA-N 1 2 247.342 2.466 20 0 BEADLO CO[C@@H](C)COc1cccc(-n2cc[nH+]c2)c1 ZINC000181660291 385592480 /nfs/dbraw/zinc/59/24/80/385592480.db2.gz VEZJUUDMLWTJNF-NSHDSACASA-N 1 2 232.283 2.286 20 0 BEADLO COC(=O)Cc1cc[nH+]c(NCC2CC(C)C2)c1 ZINC000598642312 385625146 /nfs/dbraw/zinc/62/51/46/385625146.db2.gz FVMZZDNTEGQIOH-UHFFFAOYSA-N 1 2 248.326 2.255 20 0 BEADLO CC(C)c1occc1C(=O)NCc1[nH+]ccn1C ZINC000280833864 385609685 /nfs/dbraw/zinc/60/96/85/385609685.db2.gz ZHBQPXXCGGCXFH-UHFFFAOYSA-N 1 2 247.298 2.067 20 0 BEADLO CC[C@H](Cc1nc(C[NH2+]C)no1)C(C)C ZINC000309528258 385664450 /nfs/dbraw/zinc/66/44/50/385664450.db2.gz VJAOAVZXXAUJKD-SECBINFHSA-N 1 2 211.309 2.014 20 0 BEADLO CC[C@H](C)CNc1cc2cc[nH]c2c[nH+]1 ZINC000643191699 385640058 /nfs/dbraw/zinc/64/00/58/385640058.db2.gz NDQVNNSOFSHFFS-VIFPVBQESA-N 1 2 203.289 2.443 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)[C@H]1CCCC(C)(C)C1 ZINC000270072194 385665313 /nfs/dbraw/zinc/66/53/13/385665313.db2.gz SBWGKLBJWKJCGV-NSHDSACASA-N 1 2 249.358 2.253 20 0 BEADLO Cn1nccc1[C@H]1CCCC[N@@H+]1Cc1ccno1 ZINC000281236864 385647566 /nfs/dbraw/zinc/64/75/66/385647566.db2.gz CTFSYMQANFVGCX-CYBMUJFWSA-N 1 2 246.314 2.135 20 0 BEADLO Cn1nccc1[C@H]1CCCC[N@H+]1Cc1ccno1 ZINC000281236864 385647574 /nfs/dbraw/zinc/64/75/74/385647574.db2.gz CTFSYMQANFVGCX-CYBMUJFWSA-N 1 2 246.314 2.135 20 0 BEADLO CCc1cc(N[C@@H]2CCO[C@@H](CC)C2)nc[nH+]1 ZINC000643195933 385653637 /nfs/dbraw/zinc/65/36/37/385653637.db2.gz FPYPTWZRWFFWFP-NEPJUHHUSA-N 1 2 235.331 2.409 20 0 BEADLO CCc1cc(N[C@H]2CCO[C@@H](CC)C2)nc[nH+]1 ZINC000643195935 385654103 /nfs/dbraw/zinc/65/41/03/385654103.db2.gz FPYPTWZRWFFWFP-RYUDHWBXSA-N 1 2 235.331 2.409 20 0 BEADLO FC(F)(F)[C@@H]([NH2+]C[C@@H]1CCCOC1)C1CC1 ZINC000309531407 385665929 /nfs/dbraw/zinc/66/59/29/385665929.db2.gz DCIRCQLVFKEQDU-WPRPVWTQSA-N 1 2 237.265 2.344 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2nccc(N)n2)cc1 ZINC000182335971 385658933 /nfs/dbraw/zinc/65/89/33/385658933.db2.gz IVIFTUZOJSFFNV-NSHDSACASA-N 1 2 242.326 2.218 20 0 BEADLO FC(F)(F)[C@H]([NH2+]C[C@@H]1CCCOC1)C1CC1 ZINC000309531406 385666155 /nfs/dbraw/zinc/66/61/55/385666155.db2.gz DCIRCQLVFKEQDU-WCBMZHEXSA-N 1 2 237.265 2.344 20 0 BEADLO CC[C@H](O)CCCNc1[nH+]ccc(C)c1Cl ZINC000336734665 385672355 /nfs/dbraw/zinc/67/23/55/385672355.db2.gz LAFJLYFGXQPUTB-JTQLQIEISA-N 1 2 242.750 2.428 20 0 BEADLO Cc1cc(NC(=O)CCCC2CC2)cc[nH+]1 ZINC000643133051 385674599 /nfs/dbraw/zinc/67/45/99/385674599.db2.gz XSHWIMVQHMOMQY-UHFFFAOYSA-N 1 2 218.300 2.331 20 0 BEADLO CC(C)(C)CNc1cc(NCC2CC2)[nH+]cn1 ZINC000340019387 385679923 /nfs/dbraw/zinc/67/99/23/385679923.db2.gz OHRYRZRBVXDGRF-UHFFFAOYSA-N 1 2 234.347 2.178 20 0 BEADLO CC(C)(C)CNc1cc(NCC2CC2)nc[nH+]1 ZINC000340019387 385679929 /nfs/dbraw/zinc/67/99/29/385679929.db2.gz OHRYRZRBVXDGRF-UHFFFAOYSA-N 1 2 234.347 2.178 20 0 BEADLO C[C@@]1(CNc2ccc(CO)c[nH+]2)CCCS1 ZINC000647913118 385683787 /nfs/dbraw/zinc/68/37/87/385683787.db2.gz QBMBMOAUAOWKEB-LBPRGKRZSA-N 1 2 238.356 2.272 20 0 BEADLO CC[C@H](NC(=O)C1(CCF)CC1)c1[nH]cc[nH+]1 ZINC000355752402 385684580 /nfs/dbraw/zinc/68/45/80/385684580.db2.gz NVBSYXQQABXLKU-VIFPVBQESA-N 1 2 239.294 2.117 20 0 BEADLO c1cn(CCCN2CCc3ccccc32)c[nH+]1 ZINC000182622169 385689571 /nfs/dbraw/zinc/68/95/71/385689571.db2.gz BXWIYMKXIJBOPZ-UHFFFAOYSA-N 1 2 227.311 2.336 20 0 BEADLO Cc1cccc([C@H](C)[NH2+]CC(F)(F)CO)c1 ZINC000184699479 385695752 /nfs/dbraw/zinc/69/57/52/385695752.db2.gz DVJSJULUMVTZTI-JTQLQIEISA-N 1 2 229.270 2.273 20 0 BEADLO CCOC[C@@H]1CCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000270551433 385718049 /nfs/dbraw/zinc/71/80/49/385718049.db2.gz GHTOLFRHEKPQHF-LLVKDONJSA-N 1 2 245.326 2.426 20 0 BEADLO FCCCC[NH+]=c1[nH]c2ccccc2[nH]1 ZINC000336684346 385671464 /nfs/dbraw/zinc/67/14/64/385671464.db2.gz KKNXLJMZTTVOBQ-UHFFFAOYSA-N 1 2 207.252 2.146 20 0 BEADLO CCSCCSCCn1cc[nH+]c1 ZINC000185596181 385734862 /nfs/dbraw/zinc/73/48/62/385734862.db2.gz AYHRHZJXJGFOQX-UHFFFAOYSA-N 1 2 216.375 2.369 20 0 BEADLO Cn1cc[nH+]c1CN1CCc2cc(F)ccc21 ZINC000282429008 385760741 /nfs/dbraw/zinc/76/07/41/385760741.db2.gz JZIKRFLDFNQAFT-UHFFFAOYSA-N 1 2 231.274 2.122 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1cncs1 ZINC000270988338 385767377 /nfs/dbraw/zinc/76/73/77/385767377.db2.gz GSEJNWGLYDQRDE-ZJUUUORDSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1cncs1 ZINC000270988338 385767383 /nfs/dbraw/zinc/76/73/83/385767383.db2.gz GSEJNWGLYDQRDE-ZJUUUORDSA-N 1 2 226.345 2.142 20 0 BEADLO Fc1cccc(C[NH+]2CC3(C2)CCOC3)c1F ZINC000293974768 385777304 /nfs/dbraw/zinc/77/73/04/385777304.db2.gz KIPHAIPXFBCRMY-UHFFFAOYSA-N 1 2 239.265 2.187 20 0 BEADLO CC1(C)C(CNC(=O)C=Cc2c[nH]c[nH+]2)C1(C)C ZINC000282779448 385784133 /nfs/dbraw/zinc/78/41/33/385784133.db2.gz MODHQQJQGLKELM-AATRIKPKSA-N 1 2 247.342 2.221 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1c1[nH+]cnc2c1cnn2C ZINC000337784971 385784028 /nfs/dbraw/zinc/78/40/28/385784028.db2.gz AQQLPRAAYDKPNR-ZJUUUORDSA-N 1 2 245.330 2.131 20 0 BEADLO CC(C)n1cc(C[N@H+](C)Cc2cccnc2)cn1 ZINC000183659674 385784093 /nfs/dbraw/zinc/78/40/93/385784093.db2.gz APIKRQMIEFLBHE-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO CC(C)n1cc(C[N@@H+](C)Cc2cccnc2)cn1 ZINC000183659674 385784102 /nfs/dbraw/zinc/78/41/02/385784102.db2.gz APIKRQMIEFLBHE-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO Cc1ccn2cc(CNC(=O)C(C)(C)F)[nH+]c2c1 ZINC000271092183 385785148 /nfs/dbraw/zinc/78/51/48/385785148.db2.gz WZPNVRDCYUNXGC-UHFFFAOYSA-N 1 2 249.289 2.007 20 0 BEADLO FC(F)[C@H]1CCC[N@@H+]1CCO[C@H]1CCCCO1 ZINC000353197028 385721650 /nfs/dbraw/zinc/72/16/50/385721650.db2.gz VHGRLRAGSPJINW-MNOVXSKESA-N 1 2 249.301 2.259 20 0 BEADLO FC(F)[C@H]1CCC[N@H+]1CCO[C@H]1CCCCO1 ZINC000353197028 385721654 /nfs/dbraw/zinc/72/16/54/385721654.db2.gz VHGRLRAGSPJINW-MNOVXSKESA-N 1 2 249.301 2.259 20 0 BEADLO COC[C@H]1CCN(c2[nH+]c3ccccc3n2C)C1 ZINC000270617542 385725238 /nfs/dbraw/zinc/72/52/38/385725238.db2.gz ZVDQKQJMFPVSLH-NSHDSACASA-N 1 2 245.326 2.046 20 0 BEADLO COCc1ccc(C[N@H+](C)Cc2ccon2)cc1 ZINC000271205317 385803645 /nfs/dbraw/zinc/80/36/45/385803645.db2.gz RMVPEZMNGFEKGY-UHFFFAOYSA-N 1 2 246.310 2.453 20 0 BEADLO COCc1ccc(C[N@@H+](C)Cc2ccon2)cc1 ZINC000271205317 385803649 /nfs/dbraw/zinc/80/36/49/385803649.db2.gz RMVPEZMNGFEKGY-UHFFFAOYSA-N 1 2 246.310 2.453 20 0 BEADLO C[C@@H]1[C@@H](C)[S@](=O)CC[N@@H+]1Cc1ccsc1 ZINC000271221397 385806043 /nfs/dbraw/zinc/80/60/43/385806043.db2.gz ZGYRQLZBAVTJEP-IQMDTDKHSA-N 1 2 243.397 2.089 20 0 BEADLO C[C@@H]1[C@@H](C)[S@](=O)CC[N@H+]1Cc1ccsc1 ZINC000271221397 385806048 /nfs/dbraw/zinc/80/60/48/385806048.db2.gz ZGYRQLZBAVTJEP-IQMDTDKHSA-N 1 2 243.397 2.089 20 0 BEADLO FC(F)C1CC[NH+](Cc2cnns2)CC1 ZINC000335570553 385805999 /nfs/dbraw/zinc/80/59/99/385805999.db2.gz FTAMFXLUKPGNSW-UHFFFAOYSA-N 1 2 233.287 2.015 20 0 BEADLO CC(C)[C@@H](NC(=O)CCC1CC1)c1[nH]cc[nH+]1 ZINC000283142028 385810954 /nfs/dbraw/zinc/81/09/54/385810954.db2.gz XWQGEQYFJMIIAL-GFCCVEGCSA-N 1 2 235.331 2.413 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1ccc(F)c(C)c1 ZINC000128566333 385821423 /nfs/dbraw/zinc/82/14/23/385821423.db2.gz QKYLCFLYDKOENY-UHFFFAOYSA-N 1 2 239.290 2.129 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1ccc(F)c(C)c1 ZINC000128566333 385821427 /nfs/dbraw/zinc/82/14/27/385821427.db2.gz QKYLCFLYDKOENY-UHFFFAOYSA-N 1 2 239.290 2.129 20 0 BEADLO C[C@@H]([NH2+]Cc1c[nH]nn1)[C@H](C)c1ccccc1 ZINC000283618761 385824618 /nfs/dbraw/zinc/82/46/18/385824618.db2.gz AMBTXVAMYGTJIE-WDEREUQCSA-N 1 2 230.315 2.087 20 0 BEADLO C[C@@H]([NH2+]Cc1cn[nH]n1)[C@H](C)c1ccccc1 ZINC000283618761 385824619 /nfs/dbraw/zinc/82/46/19/385824619.db2.gz AMBTXVAMYGTJIE-WDEREUQCSA-N 1 2 230.315 2.087 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CC23CCCCC3)c[nH+]1 ZINC000271408543 385825236 /nfs/dbraw/zinc/82/52/36/385825236.db2.gz SMTFXRYVUFKUPU-LLVKDONJSA-N 1 2 233.315 2.171 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H]2CC23CCCCC3)c[nH+]1 ZINC000271408545 385825410 /nfs/dbraw/zinc/82/54/10/385825410.db2.gz SMTFXRYVUFKUPU-NSHDSACASA-N 1 2 233.315 2.171 20 0 BEADLO CC[C@H]1CCC[C@@H]1C(=O)N(C)Cc1[nH+]ccn1C ZINC000294252208 385828002 /nfs/dbraw/zinc/82/80/02/385828002.db2.gz CVDWKRUNOZNETR-RYUDHWBXSA-N 1 2 249.358 2.205 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1ncc(C)s1 ZINC000271501845 385834222 /nfs/dbraw/zinc/83/42/22/385834222.db2.gz KRWHDGWKZNKSBA-KOLCDFICSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1ncc(C)s1 ZINC000271501845 385834224 /nfs/dbraw/zinc/83/42/24/385834224.db2.gz KRWHDGWKZNKSBA-KOLCDFICSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1c[nH+]c(CNc2ccccc2F)n1C ZINC000336738333 385836442 /nfs/dbraw/zinc/83/64/42/385836442.db2.gz OBOCCPXPOUVHSG-UHFFFAOYSA-N 1 2 219.263 2.480 20 0 BEADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccn(C)n2)o1 ZINC000112341607 385839673 /nfs/dbraw/zinc/83/96/73/385839673.db2.gz QODNMBKDBMPAIU-ZWNOBZJWSA-N 1 2 245.326 2.426 20 0 BEADLO COC[C@@H]([NH2+][C@H](C)c1cn[nH]c1)c1ccc(C)o1 ZINC000283953059 385840275 /nfs/dbraw/zinc/84/02/75/385840275.db2.gz FXDKDOPSOIVKEQ-ZYHUDNBSSA-N 1 2 249.314 2.349 20 0 BEADLO c1cn(CCCNc2ccnc(C3CC3)n2)c[nH+]1 ZINC000271639947 385842838 /nfs/dbraw/zinc/84/28/38/385842838.db2.gz PICAZEVHQDPZJU-UHFFFAOYSA-N 1 2 243.314 2.053 20 0 BEADLO c1cc2cc(C[N@@H+]3CCO[C@H]4C[C@H]43)ccc2cn1 ZINC000644837599 385850012 /nfs/dbraw/zinc/85/00/12/385850012.db2.gz LARFWKAJEUSGSV-CABCVRRESA-N 1 2 240.306 2.208 20 0 BEADLO c1cc2cc(C[N@H+]3CCO[C@H]4C[C@H]43)ccc2cn1 ZINC000644837599 385850016 /nfs/dbraw/zinc/85/00/16/385850016.db2.gz LARFWKAJEUSGSV-CABCVRRESA-N 1 2 240.306 2.208 20 0 BEADLO COC(=O)[C@H]([NH2+]CCc1ccccc1)C(C)C ZINC000068740518 385851503 /nfs/dbraw/zinc/85/15/03/385851503.db2.gz NPRVWYSELJMXHX-CYBMUJFWSA-N 1 2 235.327 2.016 20 0 BEADLO CCCOc1cccc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)c1 ZINC000644838551 385853966 /nfs/dbraw/zinc/85/39/66/385853966.db2.gz QZJCISNLKQZIQC-LSDHHAIUSA-N 1 2 247.338 2.449 20 0 BEADLO CCCOc1cccc(C[N@H+]2CCO[C@@H]3C[C@@H]32)c1 ZINC000644838551 385853971 /nfs/dbraw/zinc/85/39/71/385853971.db2.gz QZJCISNLKQZIQC-LSDHHAIUSA-N 1 2 247.338 2.449 20 0 BEADLO C[N@H+](Cc1csnn1)C1Cc2ccccc2C1 ZINC000271128324 385789664 /nfs/dbraw/zinc/78/96/64/385789664.db2.gz IJYCPVKNGYEKDK-UHFFFAOYSA-N 1 2 245.351 2.137 20 0 BEADLO C[N@@H+](Cc1csnn1)C1Cc2ccccc2C1 ZINC000271128324 385789673 /nfs/dbraw/zinc/78/96/73/385789673.db2.gz IJYCPVKNGYEKDK-UHFFFAOYSA-N 1 2 245.351 2.137 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N1CCC[C@@H]1C1CCC1 ZINC000282901408 385794147 /nfs/dbraw/zinc/79/41/47/385794147.db2.gz AWBGAEFAQWAOJB-GFCCVEGCSA-N 1 2 247.342 2.133 20 0 BEADLO C[C@@H]1CCCC[C@H]1Nc1nc[nH+]c2c1OCCN2 ZINC000647845909 385886490 /nfs/dbraw/zinc/88/64/90/385886490.db2.gz FKXIKBJBFCHEGQ-NXEZZACHSA-N 1 2 248.330 2.272 20 0 BEADLO C[C@@H]1CCCC[C@H]1Nc1[nH+]cnc2c1OCCN2 ZINC000647845909 385886495 /nfs/dbraw/zinc/88/64/95/385886495.db2.gz FKXIKBJBFCHEGQ-NXEZZACHSA-N 1 2 248.330 2.272 20 0 BEADLO Cc1ccc(F)cc1C[N@H+]1CCOC[C@H]1C ZINC000272286126 385891091 /nfs/dbraw/zinc/89/10/91/385891091.db2.gz NMAGCVYUDHUPAU-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+]1CCOC[C@H]1C ZINC000272286126 385891098 /nfs/dbraw/zinc/89/10/98/385891098.db2.gz NMAGCVYUDHUPAU-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO CC1(C)CCCN(c2nc[nH+]c(N)c2Cl)C1 ZINC000232916708 385902018 /nfs/dbraw/zinc/90/20/18/385902018.db2.gz UVTQENWADACQDW-UHFFFAOYSA-N 1 2 240.738 2.339 20 0 BEADLO CC1(C)CCCN(c2[nH+]cnc(N)c2Cl)C1 ZINC000232916708 385902021 /nfs/dbraw/zinc/90/20/21/385902021.db2.gz UVTQENWADACQDW-UHFFFAOYSA-N 1 2 240.738 2.339 20 0 BEADLO Cc1noc([C@H](c2ccccc2)[NH+](C)C)n1 ZINC000285234827 385908411 /nfs/dbraw/zinc/90/84/11/385908411.db2.gz GDHJFXFPSQSQSJ-NSHDSACASA-N 1 2 217.272 2.029 20 0 BEADLO C[C@H]1CCCC[C@@H]1C(=O)Nc1ccc(N)[nH+]c1 ZINC000335036462 385926455 /nfs/dbraw/zinc/92/64/55/385926455.db2.gz DTHKVBYYIMVQPZ-ONGXEEELSA-N 1 2 233.315 2.259 20 0 BEADLO Cc1c[nH]nc1C[N@@H+](C)[C@@H](C)c1ccccn1 ZINC000284304928 385862548 /nfs/dbraw/zinc/86/25/48/385862548.db2.gz VJONOUOCQAXRCB-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO Cc1c[nH]nc1C[N@H+](C)[C@@H](C)c1ccccn1 ZINC000284304928 385862552 /nfs/dbraw/zinc/86/25/52/385862552.db2.gz VJONOUOCQAXRCB-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO Cc1cn[nH]c1C[N@@H+](C)[C@@H](C)c1ccccn1 ZINC000284304928 385862555 /nfs/dbraw/zinc/86/25/55/385862555.db2.gz VJONOUOCQAXRCB-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO Cc1cn[nH]c1C[N@H+](C)[C@@H](C)c1ccccn1 ZINC000284304928 385862559 /nfs/dbraw/zinc/86/25/59/385862559.db2.gz VJONOUOCQAXRCB-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO CC[C@H](NC(=O)[C@@H]1[C@H](C)[C@@H]1C1CC1)c1[nH]cc[nH+]1 ZINC000529055011 385867072 /nfs/dbraw/zinc/86/70/72/385867072.db2.gz YUUHHXHEPTWLJP-SASUGWTJSA-N 1 2 247.342 2.269 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000284525017 385872529 /nfs/dbraw/zinc/87/25/29/385872529.db2.gz WKPQUNGEZAIZJE-FLPUTOKSSA-N 1 2 233.315 2.212 20 0 BEADLO Cc1cc(C[N@@H+](C)CC(=O)NC(C)C)cs1 ZINC000294603310 385874239 /nfs/dbraw/zinc/87/42/39/385874239.db2.gz URQAOKWDIZNVAI-UHFFFAOYSA-N 1 2 240.372 2.013 20 0 BEADLO Cc1cc(C[N@H+](C)CC(=O)NC(C)C)cs1 ZINC000294603310 385874242 /nfs/dbraw/zinc/87/42/42/385874242.db2.gz URQAOKWDIZNVAI-UHFFFAOYSA-N 1 2 240.372 2.013 20 0 BEADLO Cc1nocc1C[N@@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000294608078 385874389 /nfs/dbraw/zinc/87/43/89/385874389.db2.gz IHRHIUIYSSHHKW-ZDUSSCGKSA-N 1 2 246.314 2.433 20 0 BEADLO Cc1nocc1C[N@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000294608078 385874392 /nfs/dbraw/zinc/87/43/92/385874392.db2.gz IHRHIUIYSSHHKW-ZDUSSCGKSA-N 1 2 246.314 2.433 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2ccccn2)nc1 ZINC000295163101 385981326 /nfs/dbraw/zinc/98/13/26/385981326.db2.gz NKKZVNRYXGTXKD-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2ccccn2)nc1 ZINC000295163101 385981335 /nfs/dbraw/zinc/98/13/35/385981335.db2.gz NKKZVNRYXGTXKD-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H]2CCCOCC2)[nH+]1 ZINC000345077563 385986938 /nfs/dbraw/zinc/98/69/38/385986938.db2.gz UVZLJPGOWQRFGI-SNVBAGLBSA-N 1 2 246.314 2.247 20 0 BEADLO C[N@H+](Cc1ncnn1C(C)(C)C)[C@H]1CC1(C)C ZINC000338363843 385988461 /nfs/dbraw/zinc/98/84/61/385988461.db2.gz JKVRTVUMXXTPHQ-JTQLQIEISA-N 1 2 236.363 2.263 20 0 BEADLO C[N@@H+](Cc1ncnn1C(C)(C)C)[C@H]1CC1(C)C ZINC000338363843 385988467 /nfs/dbraw/zinc/98/84/67/385988467.db2.gz JKVRTVUMXXTPHQ-JTQLQIEISA-N 1 2 236.363 2.263 20 0 BEADLO CC(=O)c1cccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000294988371 385935346 /nfs/dbraw/zinc/93/53/46/385935346.db2.gz MTYVWHQTPIGHFG-TXEJJXNPSA-N 1 2 247.338 2.498 20 0 BEADLO CC(=O)c1cccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000294988371 385935352 /nfs/dbraw/zinc/93/53/52/385935352.db2.gz MTYVWHQTPIGHFG-TXEJJXNPSA-N 1 2 247.338 2.498 20 0 BEADLO COC(=O)c1ccc(C[N@H+](C)Cc2ccco2)[nH]1 ZINC000272786079 385935693 /nfs/dbraw/zinc/93/56/93/385935693.db2.gz WXKLSPMHSVLHPA-UHFFFAOYSA-N 1 2 248.282 2.026 20 0 BEADLO COC(=O)c1ccc(C[N@@H+](C)Cc2ccco2)[nH]1 ZINC000272786079 385935694 /nfs/dbraw/zinc/93/56/94/385935694.db2.gz WXKLSPMHSVLHPA-UHFFFAOYSA-N 1 2 248.282 2.026 20 0 BEADLO CSC(C)(C)CNc1cc(C)[nH+]cn1 ZINC000128007741 385941643 /nfs/dbraw/zinc/94/16/43/385941643.db2.gz UVPUSLSIDRQKNZ-UHFFFAOYSA-N 1 2 211.334 2.339 20 0 BEADLO COC(=O)[C@H]1CCCC[N@@H+]1Cc1cccs1 ZINC000096465933 385953528 /nfs/dbraw/zinc/95/35/28/385953528.db2.gz WIJADSLAGHJFNP-LLVKDONJSA-N 1 2 239.340 2.276 20 0 BEADLO COC(=O)[C@H]1CCCC[N@H+]1Cc1cccs1 ZINC000096465933 385953531 /nfs/dbraw/zinc/95/35/31/385953531.db2.gz WIJADSLAGHJFNP-LLVKDONJSA-N 1 2 239.340 2.276 20 0 BEADLO C[N@H+](Cc1ncnn1C(C)(C)C)C1CCC1 ZINC000338309561 385963697 /nfs/dbraw/zinc/96/36/97/385963697.db2.gz WFIMDXAUXBHBDP-UHFFFAOYSA-N 1 2 222.336 2.017 20 0 BEADLO C[N@@H+](Cc1ncnn1C(C)(C)C)C1CCC1 ZINC000338309561 385963703 /nfs/dbraw/zinc/96/37/03/385963703.db2.gz WFIMDXAUXBHBDP-UHFFFAOYSA-N 1 2 222.336 2.017 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2CCSC2)c(C)[nH+]1 ZINC000335872784 385994232 /nfs/dbraw/zinc/99/42/32/385994232.db2.gz UMACITVAHSWBSE-JTQLQIEISA-N 1 2 236.340 2.390 20 0 BEADLO C[C@H]([NH2+]Cc1ccno1)c1c(F)cncc1F ZINC000285817381 385969070 /nfs/dbraw/zinc/96/90/70/385969070.db2.gz VIFXDVGVNWDPCU-ZETCQYMHSA-N 1 2 239.225 2.199 20 0 BEADLO Cc1noc([C@H]2CCC[N@@H+]2C/C=C/Cl)n1 ZINC000285844002 385973239 /nfs/dbraw/zinc/97/32/39/385973239.db2.gz XMPSTDBVXOCCOG-HYYFJVDXSA-N 1 2 227.695 2.267 20 0 BEADLO Cc1noc([C@H]2CCC[N@H+]2C/C=C/Cl)n1 ZINC000285844002 385973244 /nfs/dbraw/zinc/97/32/44/385973244.db2.gz XMPSTDBVXOCCOG-HYYFJVDXSA-N 1 2 227.695 2.267 20 0 BEADLO Cc1nocc1CN1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000295227180 385997260 /nfs/dbraw/zinc/99/72/60/385997260.db2.gz CKNQJNUDLCGNRO-LBPRGKRZSA-N 1 2 246.314 2.433 20 0 BEADLO O=C([C@@H]1C[C@@H]1C1CC1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000345066219 386001568 /nfs/dbraw/zinc/00/15/68/386001568.db2.gz VRPCSDCFIUMRBD-UTUOFQBUSA-N 1 2 245.326 2.119 20 0 BEADLO C[N@H+](Cc1csc(Cl)n1)[C@@H]1CCC[C@H]1O ZINC000295303286 386008182 /nfs/dbraw/zinc/00/81/82/386008182.db2.gz MNSPCPRRWQIKLL-RKDXNWHRSA-N 1 2 246.763 2.142 20 0 BEADLO C[N@@H+](Cc1csc(Cl)n1)[C@@H]1CCC[C@H]1O ZINC000295303286 386008189 /nfs/dbraw/zinc/00/81/89/386008189.db2.gz MNSPCPRRWQIKLL-RKDXNWHRSA-N 1 2 246.763 2.142 20 0 BEADLO CC/C(C)=C/C(=O)NCc1c[nH+]ccc1OC ZINC000295298011 386009570 /nfs/dbraw/zinc/00/95/70/386009570.db2.gz AVVNTUFLATYALO-JXMROGBWSA-N 1 2 234.299 2.063 20 0 BEADLO c1ccc(N2CCC[C@@H]2[C@H]2CCCO2)[nH+]c1 ZINC000286290347 386020880 /nfs/dbraw/zinc/02/08/80/386020880.db2.gz DAOIPICLHIIWKX-VXGBXAGGSA-N 1 2 218.300 2.229 20 0 BEADLO O[C@@H]1CCCN(c2[nH+]ccc3ccc(F)cc32)C1 ZINC000334421607 386025309 /nfs/dbraw/zinc/02/53/09/386025309.db2.gz DABGSDRANCOKEN-GFCCVEGCSA-N 1 2 246.285 2.335 20 0 BEADLO OC[C@]1(F)CC[N@H+](Cc2ccccc2Cl)C1 ZINC000334420572 386026543 /nfs/dbraw/zinc/02/65/43/386026543.db2.gz AEKHAFVTMCTBRN-LBPRGKRZSA-N 1 2 243.709 2.246 20 0 BEADLO OC[C@]1(F)CC[N@@H+](Cc2ccccc2Cl)C1 ZINC000334420572 386026547 /nfs/dbraw/zinc/02/65/47/386026547.db2.gz AEKHAFVTMCTBRN-LBPRGKRZSA-N 1 2 243.709 2.246 20 0 BEADLO Cc1ccc(Cc2nc([C@H]3CCCO3)no2)c[nH+]1 ZINC000273765936 386033052 /nfs/dbraw/zinc/03/30/52/386033052.db2.gz BEFOQXXSBAQMLX-LLVKDONJSA-N 1 2 245.282 2.215 20 0 BEADLO Cc1cc(CNC(=O)c2cncs2)cc(C)[nH+]1 ZINC000335074795 386042863 /nfs/dbraw/zinc/04/28/63/386042863.db2.gz RNHSUYSFGWNJST-UHFFFAOYSA-N 1 2 247.323 2.085 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2ccn(C)n2)nc1C ZINC000414160725 386045224 /nfs/dbraw/zinc/04/52/24/386045224.db2.gz DMAYPIPHKPFDGR-GFCCVEGCSA-N 1 2 244.342 2.283 20 0 BEADLO CCC[C@H]([NH2+]Cc1ccc(C)s1)C(=O)OC ZINC000336749382 385996139 /nfs/dbraw/zinc/99/61/39/385996139.db2.gz YVKSHEZITFBZGP-NSHDSACASA-N 1 2 241.356 2.488 20 0 BEADLO CCOC[C@@H](Nc1cc[nH+]c(C)n1)C(C)C ZINC000233767308 385996170 /nfs/dbraw/zinc/99/61/70/385996170.db2.gz GYNRWBQDXPPQMO-LLVKDONJSA-N 1 2 223.320 2.258 20 0 BEADLO Cc1ccoc1C[NH2+][C@H](CCO)c1ccco1 ZINC000274469590 386109572 /nfs/dbraw/zinc/10/95/72/386109572.db2.gz YWSNJUOIQRIATB-LLVKDONJSA-N 1 2 235.283 2.394 20 0 BEADLO Cc1ccc(C[N@@H+](C)[C@@H](C)c2nncn2C)cc1 ZINC000287267292 386109784 /nfs/dbraw/zinc/10/97/84/386109784.db2.gz LDJUTVHMWHBOJJ-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1ccc(C[N@H+](C)[C@@H](C)c2nncn2C)cc1 ZINC000287267292 386109788 /nfs/dbraw/zinc/10/97/88/386109788.db2.gz LDJUTVHMWHBOJJ-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO c1ccc(NC[C@H]2CSCCS2)[nH+]c1 ZINC000129905807 386116787 /nfs/dbraw/zinc/11/67/87/386116787.db2.gz DPSDHWPZLCUTCA-VIFPVBQESA-N 1 2 226.370 2.342 20 0 BEADLO COC1(CCNc2cc[nH+]c(C(C)C)n2)CCC1 ZINC000338730482 386116891 /nfs/dbraw/zinc/11/68/91/386116891.db2.gz BWHRNBGNHXBIAS-UHFFFAOYSA-N 1 2 249.358 2.393 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC(C)(C)C1CC1 ZINC000335938476 386058174 /nfs/dbraw/zinc/05/81/74/386058174.db2.gz UPAUFZPQLJKBMQ-UHFFFAOYSA-N 1 2 233.315 2.122 20 0 BEADLO C[NH2+]Cc1noc([C@@H](C)Cc2ccccc2)n1 ZINC000414648535 386064678 /nfs/dbraw/zinc/06/46/78/386064678.db2.gz VKJNGAWRBYPGFO-JTQLQIEISA-N 1 2 231.299 2.135 20 0 BEADLO CCC1(C(=O)NCc2[nH]cc[nH+]2)CCCCC1 ZINC000274059753 386064941 /nfs/dbraw/zinc/06/49/41/386064941.db2.gz LAQNZTUXNKQHRH-UHFFFAOYSA-N 1 2 235.331 2.386 20 0 BEADLO C[NH2+]Cc1noc([C@H](C)Cc2ccccc2)n1 ZINC000414648536 386065457 /nfs/dbraw/zinc/06/54/57/386065457.db2.gz VKJNGAWRBYPGFO-SNVBAGLBSA-N 1 2 231.299 2.135 20 0 BEADLO Cc1cc(NCC2CCC(F)CC2)nc[nH+]1 ZINC000645389478 386072798 /nfs/dbraw/zinc/07/27/98/386072798.db2.gz AROZWHBCLQLGME-UHFFFAOYSA-N 1 2 223.295 2.147 20 0 BEADLO C[C@H](C(N)=O)[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000287006955 386088735 /nfs/dbraw/zinc/08/87/35/386088735.db2.gz QKMDGLLGKXIHLP-PSASIEDQSA-N 1 2 238.356 2.005 20 0 BEADLO C[C@H](C(N)=O)[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000287006955 386088740 /nfs/dbraw/zinc/08/87/40/386088740.db2.gz QKMDGLLGKXIHLP-PSASIEDQSA-N 1 2 238.356 2.005 20 0 BEADLO CCc1ncc(CNc2ccc[nH+]c2C)cn1 ZINC000414285767 386096073 /nfs/dbraw/zinc/09/60/73/386096073.db2.gz BTLLSWFWCALKMO-UHFFFAOYSA-N 1 2 228.299 2.355 20 0 BEADLO CN(C)c1ccc(NCCC(C)(C)C)[nH+]c1 ZINC000336772803 386099719 /nfs/dbraw/zinc/09/97/19/386099719.db2.gz VUMMREQBQFTQSK-UHFFFAOYSA-N 1 2 221.348 2.418 20 0 BEADLO Cn1ncc(Cl)c1C[NH+]1CC(C2CCC2)C1 ZINC000335151307 386146447 /nfs/dbraw/zinc/14/64/47/386146447.db2.gz QRMVBSUBUOCOOK-UHFFFAOYSA-N 1 2 239.750 2.305 20 0 BEADLO Cc1cc(N2CCOC[C@H]2CC2CCC2)nc[nH+]1 ZINC000338829565 386147248 /nfs/dbraw/zinc/14/72/48/386147248.db2.gz LTIJUURBHQJAAP-CYBMUJFWSA-N 1 2 247.342 2.180 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCC[C@@](C)(F)C1 ZINC000296196629 386147311 /nfs/dbraw/zinc/14/73/11/386147311.db2.gz YWPNITVISOZDCQ-LLVKDONJSA-N 1 2 211.284 2.042 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCC[C@@](C)(F)C1 ZINC000296196629 386147315 /nfs/dbraw/zinc/14/73/15/386147315.db2.gz YWPNITVISOZDCQ-LLVKDONJSA-N 1 2 211.284 2.042 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CCC[C@@](C)(F)C1 ZINC000296196629 386147319 /nfs/dbraw/zinc/14/73/19/386147319.db2.gz YWPNITVISOZDCQ-LLVKDONJSA-N 1 2 211.284 2.042 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CCC[C@@](C)(F)C1 ZINC000296196629 386147323 /nfs/dbraw/zinc/14/73/23/386147323.db2.gz YWPNITVISOZDCQ-LLVKDONJSA-N 1 2 211.284 2.042 20 0 BEADLO Cc1cc(N2CCOC[C@@H]2CC2CCC2)nc[nH+]1 ZINC000338829566 386147741 /nfs/dbraw/zinc/14/77/41/386147741.db2.gz LTIJUURBHQJAAP-ZDUSSCGKSA-N 1 2 247.342 2.180 20 0 BEADLO Cn1c2ccccc2[nH+]c1N[C@H]1CCC[C@@H]1F ZINC000338824401 386148069 /nfs/dbraw/zinc/14/80/69/386148069.db2.gz NSDQNEMIBGLITL-UWVGGRQHSA-N 1 2 233.290 2.298 20 0 BEADLO CO[C@H](C[N@@H+]1CC[C@@H](C)C(F)(F)C1)C1CC1 ZINC000425482279 386152617 /nfs/dbraw/zinc/15/26/17/386152617.db2.gz QKBOZROPHJIUBD-MWLCHTKSSA-N 1 2 233.302 2.389 20 0 BEADLO CO[C@H](C[N@H+]1CC[C@@H](C)C(F)(F)C1)C1CC1 ZINC000425482279 386152621 /nfs/dbraw/zinc/15/26/21/386152621.db2.gz QKBOZROPHJIUBD-MWLCHTKSSA-N 1 2 233.302 2.389 20 0 BEADLO CCC1(CNC(=O)CCc2[nH]cc[nH+]2)CCCC1 ZINC000287894063 386154720 /nfs/dbraw/zinc/15/47/20/386154720.db2.gz BZHMUJHSSHSWGW-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO CC(C)[C@@H](NC(=O)CC1(C)CC1)c1[nH]cc[nH+]1 ZINC000338880212 386166533 /nfs/dbraw/zinc/16/65/33/386166533.db2.gz LOIBHANUEUZOAF-LLVKDONJSA-N 1 2 235.331 2.413 20 0 BEADLO CC1(C)OCC[C@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000296362912 386167625 /nfs/dbraw/zinc/16/76/25/386167625.db2.gz SBLIUUYXEDLDDV-SNVBAGLBSA-N 1 2 233.315 2.333 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@H](CC)C2)nc1 ZINC000338906883 386177625 /nfs/dbraw/zinc/17/76/25/386177625.db2.gz WQDSPILGRYLGEM-CQSZACIVSA-N 1 2 234.343 2.255 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@H](CC)C2)nc1 ZINC000338906883 386177628 /nfs/dbraw/zinc/17/76/28/386177628.db2.gz WQDSPILGRYLGEM-CQSZACIVSA-N 1 2 234.343 2.255 20 0 BEADLO CC/C=C/C[NH2+][C@H](c1ncc[nH]1)c1cccnc1 ZINC000296508109 386179684 /nfs/dbraw/zinc/17/96/84/386179684.db2.gz PIWLHQODTZBDEU-OOPCZODUSA-N 1 2 242.326 2.450 20 0 BEADLO CCC=CC[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000296528915 386182103 /nfs/dbraw/zinc/18/21/03/386182103.db2.gz QHOXJJDUXOWBPZ-MXPWBENCSA-N 1 2 242.326 2.450 20 0 BEADLO CC(C)n1ccc(C[NH2+][C@@H](C)c2cn[nH]c2)n1 ZINC000275159183 386188512 /nfs/dbraw/zinc/18/85/12/386188512.db2.gz IMKQRRIRLZGQCQ-JTQLQIEISA-N 1 2 233.319 2.038 20 0 BEADLO CC[C@H]1CCCC[C@@H]1NC(=O)CCc1[nH]cc[nH+]1 ZINC000287472705 386125953 /nfs/dbraw/zinc/12/59/53/386125953.db2.gz YGCGJBPLMRSYMO-RYUDHWBXSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@@H]1CC(C(=O)NCc2c[nH+]c[nH]2)C[C@@H](C)C1 ZINC000334466449 386126008 /nfs/dbraw/zinc/12/60/08/386126008.db2.gz DHOOVHJSVBBASY-UWVGGRQHSA-N 1 2 235.331 2.098 20 0 BEADLO C[C@@H]1CC(C(=O)NCc2c[nH]c[nH+]2)C[C@@H](C)C1 ZINC000334466449 386126013 /nfs/dbraw/zinc/12/60/13/386126013.db2.gz DHOOVHJSVBBASY-UWVGGRQHSA-N 1 2 235.331 2.098 20 0 BEADLO CC[C@H]1CCCC[C@H]1NC(=O)CCc1[nH]cc[nH+]1 ZINC000287472701 386127142 /nfs/dbraw/zinc/12/71/42/386127142.db2.gz YGCGJBPLMRSYMO-NWDGAFQWSA-N 1 2 249.358 2.427 20 0 BEADLO CCc1ccc(CN2CCn3cc[nH+]c3C2)o1 ZINC000334467047 386128878 /nfs/dbraw/zinc/12/88/78/386128878.db2.gz DUCOQYNAVKIKDQ-UHFFFAOYSA-N 1 2 231.299 2.054 20 0 BEADLO CO[C@H](C)CNc1cc(C)[nH+]c(C2CC2)n1 ZINC000189926837 386129408 /nfs/dbraw/zinc/12/94/08/386129408.db2.gz WEPCPVYWCLTUMK-SECBINFHSA-N 1 2 221.304 2.109 20 0 BEADLO Fc1ccc2cc[nH+]c(N3CCOCC3)c2c1 ZINC000334467092 386139502 /nfs/dbraw/zinc/13/95/02/386139502.db2.gz DVXCJEFYUKSQSU-UHFFFAOYSA-N 1 2 232.258 2.211 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1cncc(F)c1 ZINC000275168055 386189447 /nfs/dbraw/zinc/18/94/47/386189447.db2.gz WJGBRHUBQYDBST-GWCFXTLKSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1cncc(F)c1 ZINC000275168055 386189451 /nfs/dbraw/zinc/18/94/51/386189451.db2.gz WJGBRHUBQYDBST-GWCFXTLKSA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1ncc[nH]1 ZINC000288470334 386204700 /nfs/dbraw/zinc/20/47/00/386204700.db2.gz FRYXJBYILFTCNU-ZANVPECISA-N 1 2 229.283 2.022 20 0 BEADLO CC(=O)c1ccc(C[N@H+]2CCO[C@H](C)[C@H]2C)cc1 ZINC000296840623 386206171 /nfs/dbraw/zinc/20/61/71/386206171.db2.gz STEGSHWCUBNVBN-DGCLKSJQSA-N 1 2 247.338 2.498 20 0 BEADLO CC(=O)c1ccc(C[N@@H+]2CCO[C@H](C)[C@H]2C)cc1 ZINC000296840623 386206175 /nfs/dbraw/zinc/20/61/75/386206175.db2.gz STEGSHWCUBNVBN-DGCLKSJQSA-N 1 2 247.338 2.498 20 0 BEADLO Cn1cccc1C[N@H+](C)Cc1cncc(F)c1 ZINC000347056411 386206722 /nfs/dbraw/zinc/20/67/22/386206722.db2.gz NQDSGVSOYQJWOZ-UHFFFAOYSA-N 1 2 233.290 2.191 20 0 BEADLO Cn1cccc1C[N@@H+](C)Cc1cncc(F)c1 ZINC000347056411 386206724 /nfs/dbraw/zinc/20/67/24/386206724.db2.gz NQDSGVSOYQJWOZ-UHFFFAOYSA-N 1 2 233.290 2.191 20 0 BEADLO CC[C@H](CC(=O)NCc1[nH+]ccn1C)C(C)C ZINC000264200490 386214407 /nfs/dbraw/zinc/21/44/07/386214407.db2.gz POOOLWHRMHMWHN-LLVKDONJSA-N 1 2 237.347 2.109 20 0 BEADLO Cn1c[nH+]cc1CN1CCCNc2ccccc21 ZINC000131324670 386216280 /nfs/dbraw/zinc/21/62/80/386216280.db2.gz MAXYPRBBUJAOTL-UHFFFAOYSA-N 1 2 242.326 2.242 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2cnccc2C)cn1 ZINC000355580476 386220183 /nfs/dbraw/zinc/22/01/83/386220183.db2.gz HCJHYYMMORWUBN-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2cnccc2C)cn1 ZINC000355580476 386220189 /nfs/dbraw/zinc/22/01/89/386220189.db2.gz HCJHYYMMORWUBN-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NCC(C)(C)C1CCC1 ZINC000297073257 386223148 /nfs/dbraw/zinc/22/31/48/386223148.db2.gz QCIBFKIIISGBQB-UHFFFAOYSA-N 1 2 249.358 2.203 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)NCC(C)(C)C1CCC1 ZINC000297073257 386223157 /nfs/dbraw/zinc/22/31/57/386223157.db2.gz QCIBFKIIISGBQB-UHFFFAOYSA-N 1 2 249.358 2.203 20 0 BEADLO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1ccn(C)n1 ZINC000288623827 386223396 /nfs/dbraw/zinc/22/33/96/386223396.db2.gz RXMRPZSFNXIEAN-QMTHXVAHSA-N 1 2 243.310 2.032 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@@H](C)OC(C)(C)C2)cn1 ZINC000414382360 386226977 /nfs/dbraw/zinc/22/69/77/386226977.db2.gz OTHQDVJPJWBFTF-LLVKDONJSA-N 1 2 249.358 2.038 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@@H](C)OC(C)(C)C2)cn1 ZINC000414382360 386226981 /nfs/dbraw/zinc/22/69/81/386226981.db2.gz OTHQDVJPJWBFTF-LLVKDONJSA-N 1 2 249.358 2.038 20 0 BEADLO CO[C@@H]1CN(c2[nH]c3ccccc3[nH+]2)CC[C@H]1C ZINC000275821669 386242682 /nfs/dbraw/zinc/24/26/82/386242682.db2.gz FQHSEYQLLYGBHF-ZWNOBZJWSA-N 1 2 245.326 2.424 20 0 BEADLO CO[C@@H]1CN(c2[nH]c3ccccc3[nH+]2)CC[C@@H]1C ZINC000275821665 386243741 /nfs/dbraw/zinc/24/37/41/386243741.db2.gz FQHSEYQLLYGBHF-GXFFZTMASA-N 1 2 245.326 2.424 20 0 BEADLO c1nc(C[NH+]2CC3(C2)CCCCC3)co1 ZINC000297315216 386244148 /nfs/dbraw/zinc/24/41/48/386244148.db2.gz CDQFLCFAEQKAEL-UHFFFAOYSA-N 1 2 206.289 2.441 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+]1CCc2nc[nH]c2C1 ZINC000647932522 386250209 /nfs/dbraw/zinc/25/02/09/386250209.db2.gz FOTDUPKTWUKFTR-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1ccc(F)cc1C[N@H+]1CCc2nc[nH]c2C1 ZINC000647932522 386250213 /nfs/dbraw/zinc/25/02/13/386250213.db2.gz FOTDUPKTWUKFTR-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1ccc(C[N@H+]2CCOC[C@@H]2CC(C)C)nn1 ZINC000414390058 386252710 /nfs/dbraw/zinc/25/27/10/386252710.db2.gz VFLSUBXHMLJPGW-AWEZNQCLSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1ccc(C[N@@H+]2CCOC[C@@H]2CC(C)C)nn1 ZINC000414390058 386252715 /nfs/dbraw/zinc/25/27/15/386252715.db2.gz VFLSUBXHMLJPGW-AWEZNQCLSA-N 1 2 249.358 2.032 20 0 BEADLO CCCc1nc(C[N@@H+](CC)CCC)no1 ZINC000336646296 386254778 /nfs/dbraw/zinc/25/47/78/386254778.db2.gz KCYWLYOGFBAQHE-UHFFFAOYSA-N 1 2 211.309 2.254 20 0 BEADLO CCCc1nc(C[N@H+](CC)CCC)no1 ZINC000336646296 386254780 /nfs/dbraw/zinc/25/47/80/386254780.db2.gz KCYWLYOGFBAQHE-UHFFFAOYSA-N 1 2 211.309 2.254 20 0 BEADLO c1ccc(C[NH2+]Cc2noc3c2CCCC3)nc1 ZINC000288361653 386191671 /nfs/dbraw/zinc/19/16/71/386191671.db2.gz DBGSMALZIAVZRZ-UHFFFAOYSA-N 1 2 243.310 2.238 20 0 BEADLO CC[C@]1(C)C[N@@H+](Cc2ccc(F)cn2)CCO1 ZINC000276174103 386280269 /nfs/dbraw/zinc/28/02/69/386280269.db2.gz FVACSXKTUJADQT-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO Cc1[nH]c(C(=O)NCCC2CCCCC2)c[nH+]1 ZINC000264913588 386283977 /nfs/dbraw/zinc/28/39/77/386283977.db2.gz ZWSDTFXGGXUZLQ-UHFFFAOYSA-N 1 2 235.331 2.418 20 0 BEADLO CC(C)Cn1cc(N[C@@H](C)c2[nH+]ccn2C)cn1 ZINC000347209604 386284069 /nfs/dbraw/zinc/28/40/69/386284069.db2.gz WJVRQEWAWCLNKA-NSHDSACASA-N 1 2 247.346 2.446 20 0 BEADLO O=C(CCC1CC1)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000265282109 386324413 /nfs/dbraw/zinc/32/44/13/386324413.db2.gz YDPCWNDLVYBVBE-GFCCVEGCSA-N 1 2 247.342 2.306 20 0 BEADLO Cn1c(C[N@@H+]2CCC23CCC3)nnc1C1CCC1 ZINC000334480097 386289319 /nfs/dbraw/zinc/28/93/19/386289319.db2.gz TUHFJUAWGFYKER-UHFFFAOYSA-N 1 2 246.358 2.211 20 0 BEADLO Cn1c(C[N@H+]2CCC23CCC3)nnc1C1CCC1 ZINC000334480097 386289325 /nfs/dbraw/zinc/28/93/25/386289325.db2.gz TUHFJUAWGFYKER-UHFFFAOYSA-N 1 2 246.358 2.211 20 0 BEADLO CC(C)(F)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000297949030 386290752 /nfs/dbraw/zinc/29/07/52/386290752.db2.gz ZXDUQGZSLFWABQ-UHFFFAOYSA-N 1 2 221.235 2.021 20 0 BEADLO CCCCNC(=O)c1ccc2[nH+]c(C)n(C)c2c1 ZINC000353360504 386294317 /nfs/dbraw/zinc/29/43/17/386294317.db2.gz ZMMGNLVESQBXOO-UHFFFAOYSA-N 1 2 245.326 2.412 20 0 BEADLO C[C@@H]1CC(C)(C)CN1C(=O)C(C)(C)c1c[nH+]c[nH]1 ZINC000335263726 386294343 /nfs/dbraw/zinc/29/43/43/386294343.db2.gz GYVXZRWHMNJELR-SNVBAGLBSA-N 1 2 249.358 2.334 20 0 BEADLO Cc1ccc(C[NH2+]Cc2ncccc2N(C)C)o1 ZINC000289410904 386299119 /nfs/dbraw/zinc/29/91/19/386299119.db2.gz AEVPURLMHSUEGN-UHFFFAOYSA-N 1 2 245.326 2.339 20 0 BEADLO COCc1cc(C[N@@H+]2CCC(C)=C(C)C2)no1 ZINC000298120751 386300246 /nfs/dbraw/zinc/30/02/46/386300246.db2.gz PHSCVCHUTRWLPT-UHFFFAOYSA-N 1 2 236.315 2.363 20 0 BEADLO COCc1cc(C[N@H+]2CCC(C)=C(C)C2)no1 ZINC000298120751 386300250 /nfs/dbraw/zinc/30/02/50/386300250.db2.gz PHSCVCHUTRWLPT-UHFFFAOYSA-N 1 2 236.315 2.363 20 0 BEADLO Cc1cn[nH]c1C[NH2+][C@@H]1c2ccccc2O[C@@H]1C ZINC000289441133 386304719 /nfs/dbraw/zinc/30/47/19/386304719.db2.gz ARWZAJXTMFLLHL-YGRLFVJLSA-N 1 2 243.310 2.330 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@@H]1c2ccccc2O[C@@H]1C ZINC000289441133 386304722 /nfs/dbraw/zinc/30/47/22/386304722.db2.gz ARWZAJXTMFLLHL-YGRLFVJLSA-N 1 2 243.310 2.330 20 0 BEADLO C[C@@H](Nc1cccc[nH+]1)C(=O)N1CCCC[C@H]1C ZINC000265105760 386307167 /nfs/dbraw/zinc/30/71/67/386307167.db2.gz GIWSXGNRZJJXFR-VXGBXAGGSA-N 1 2 247.342 2.283 20 0 BEADLO CO[C@H](C)[C@H](C)Nc1nc(C)[nH+]c2c1CCCC2 ZINC000276354647 386308139 /nfs/dbraw/zinc/30/81/39/386308139.db2.gz UXZUVVGRHKENKH-VHSXEESVSA-N 1 2 249.358 2.499 20 0 BEADLO Cc1ccc(Cc2noc(C3(F)CC3)n2)c[nH+]1 ZINC000351335554 386311078 /nfs/dbraw/zinc/31/10/78/386311078.db2.gz AQAYKKDUARXONL-UHFFFAOYSA-N 1 2 233.246 2.322 20 0 BEADLO CO[C@@H](C)[C@H](C)Nc1cc[nH+]c2ccncc12 ZINC000276383765 386313056 /nfs/dbraw/zinc/31/30/56/386313056.db2.gz ZIMPCGQLTXZSNW-UWVGGRQHSA-N 1 2 231.299 2.465 20 0 BEADLO CCC1(CNC(=O)CCc2c[nH+]c[nH]2)CCC1 ZINC000276401827 386316847 /nfs/dbraw/zinc/31/68/47/386316847.db2.gz HMOIVMYDDDZRGH-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO CCC1(CNC(=O)CCc2c[nH]c[nH+]2)CCC1 ZINC000276401827 386316851 /nfs/dbraw/zinc/31/68/51/386316851.db2.gz HMOIVMYDDDZRGH-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1CCCC1(C)C ZINC000274707697 386320643 /nfs/dbraw/zinc/32/06/43/386320643.db2.gz SDGCMCZSVREOCM-JTQLQIEISA-N 1 2 235.331 2.161 20 0 BEADLO C[C@@H](Cn1cccn1)Nc1cc[nH+]c(C2CC2)n1 ZINC000264672645 386261647 /nfs/dbraw/zinc/26/16/47/386261647.db2.gz WYYNPBVIAQQVDV-JTQLQIEISA-N 1 2 243.314 2.051 20 0 BEADLO Cc1cnn(C)c1C[N@@H+]1CCn2cccc2[C@H]1C ZINC000289115905 386262733 /nfs/dbraw/zinc/26/27/33/386262733.db2.gz NIGDQCUFOCFKCT-GFCCVEGCSA-N 1 2 244.342 2.107 20 0 BEADLO Cc1cnn(C)c1C[N@H+]1CCn2cccc2[C@H]1C ZINC000289115905 386262735 /nfs/dbraw/zinc/26/27/35/386262735.db2.gz NIGDQCUFOCFKCT-GFCCVEGCSA-N 1 2 244.342 2.107 20 0 BEADLO Cn1c[nH+]cc1CCC(=O)N[C@@H]1CCC(C)(C)C1 ZINC000339175856 386278578 /nfs/dbraw/zinc/27/85/78/386278578.db2.gz IPPABVMDLKTZPE-LLVKDONJSA-N 1 2 249.358 2.048 20 0 BEADLO CC[C@]1(C)C[N@H+](Cc2ccc(F)cn2)CCO1 ZINC000276174103 386280266 /nfs/dbraw/zinc/28/02/66/386280266.db2.gz FVACSXKTUJADQT-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO CCC[C@H](C(=O)OCC)[N@@H+]1CC[C@@](C)(F)C1 ZINC000347345743 386340147 /nfs/dbraw/zinc/34/01/47/386340147.db2.gz FEIGSWMNQXEMPC-ZYHUDNBSSA-N 1 2 231.311 2.152 20 0 BEADLO CCC[C@H](C(=O)OCC)[N@H+]1CC[C@@](C)(F)C1 ZINC000347345743 386340150 /nfs/dbraw/zinc/34/01/50/386340150.db2.gz FEIGSWMNQXEMPC-ZYHUDNBSSA-N 1 2 231.311 2.152 20 0 BEADLO Cc1nc(C[NH2+][C@H](CCO)c2ccccc2)co1 ZINC000647970166 386355379 /nfs/dbraw/zinc/35/53/79/386355379.db2.gz FWKDBYIIYUGLRC-CQSZACIVSA-N 1 2 246.310 2.196 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)NCCC1=CCCC1 ZINC000276630660 386357900 /nfs/dbraw/zinc/35/79/00/386357900.db2.gz SMZBAARELAFNBT-AATRIKPKSA-N 1 2 231.299 2.040 20 0 BEADLO Cc1cn2cc(NC(=O)N[C@@H]3C[C@H]3C)ccc2[nH+]1 ZINC000265692359 386360093 /nfs/dbraw/zinc/36/00/93/386360093.db2.gz FYWXGLHSRDMFCI-LDYMZIIASA-N 1 2 244.298 2.173 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2ccc(F)cn2)C1 ZINC000334493527 386360081 /nfs/dbraw/zinc/36/00/81/386360081.db2.gz DNNUZORRRRNKRV-LLVKDONJSA-N 1 2 212.243 2.155 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2ccc(F)cn2)C1 ZINC000334493527 386360083 /nfs/dbraw/zinc/36/00/83/386360083.db2.gz DNNUZORRRRNKRV-LLVKDONJSA-N 1 2 212.243 2.155 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1c(Cl)cnn1C ZINC000335271804 386360745 /nfs/dbraw/zinc/36/07/45/386360745.db2.gz CKBPIANEMWKOIT-HTQZYQBOSA-N 1 2 213.712 2.056 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1cn(C(C)(C)C)nn1 ZINC000335272459 386363537 /nfs/dbraw/zinc/36/35/37/386363537.db2.gz ULYHCOURPXEJFN-UWVGGRQHSA-N 1 2 222.336 2.016 20 0 BEADLO COC[C@@H]1CCN(c2cc(C)[nH+]c(C3CC3)n2)C1 ZINC000265798923 386369428 /nfs/dbraw/zinc/36/94/28/386369428.db2.gz JHPZABUCQSEFPO-LLVKDONJSA-N 1 2 247.342 2.135 20 0 BEADLO COC(=O)c1coc(C[N@@H+]2CC[C@@](C)(F)C2)c1 ZINC000347372769 386370516 /nfs/dbraw/zinc/37/05/16/386370516.db2.gz KGDAIARAQCFWJE-GFCCVEGCSA-N 1 2 241.262 2.000 20 0 BEADLO COC(=O)c1coc(C[N@H+]2CC[C@@](C)(F)C2)c1 ZINC000347372769 386370521 /nfs/dbraw/zinc/37/05/21/386370521.db2.gz KGDAIARAQCFWJE-GFCCVEGCSA-N 1 2 241.262 2.000 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)CC1(C)CCCC1 ZINC000289905344 386371227 /nfs/dbraw/zinc/37/12/27/386371227.db2.gz KVBXDRRQJCKWSC-LBPRGKRZSA-N 1 2 249.358 2.358 20 0 BEADLO Cc1cnn([C@H]2CC[N@H+](Cc3cscn3)C2)c1 ZINC000289929417 386373677 /nfs/dbraw/zinc/37/36/77/386373677.db2.gz OXZIAVQDPPFNPR-LBPRGKRZSA-N 1 2 248.355 2.095 20 0 BEADLO Cc1cnn([C@H]2CC[N@@H+](Cc3cscn3)C2)c1 ZINC000289929417 386373683 /nfs/dbraw/zinc/37/36/83/386373683.db2.gz OXZIAVQDPPFNPR-LBPRGKRZSA-N 1 2 248.355 2.095 20 0 BEADLO C[C@H]1C[C@H](O)C[N@@H+]1Cc1cc(F)c(F)cc1F ZINC000334495646 386376302 /nfs/dbraw/zinc/37/63/02/386376302.db2.gz SVGAPPBMFVHAGR-CBAPKCEASA-N 1 2 245.244 2.059 20 0 BEADLO C[C@H]1C[C@H](O)C[N@H+]1Cc1cc(F)c(F)cc1F ZINC000334495646 386376306 /nfs/dbraw/zinc/37/63/06/386376306.db2.gz SVGAPPBMFVHAGR-CBAPKCEASA-N 1 2 245.244 2.059 20 0 BEADLO C[C@@H](CNC(=O)CC(C)(C)C)Cn1cc[nH+]c1 ZINC000265863808 386378120 /nfs/dbraw/zinc/37/81/20/386378120.db2.gz XFGYMAWQHOISEW-NSHDSACASA-N 1 2 237.347 2.072 20 0 BEADLO CCC(CC)NC(=O)[C@@H](C)[N@@H+]1CC[C@](C)(F)C1 ZINC000347392797 386378545 /nfs/dbraw/zinc/37/85/45/386378545.db2.gz UUHHNLKCTGZUGK-MFKMUULPSA-N 1 2 244.354 2.114 20 0 BEADLO CCC(CC)NC(=O)[C@@H](C)[N@H+]1CC[C@](C)(F)C1 ZINC000347392797 386378548 /nfs/dbraw/zinc/37/85/48/386378548.db2.gz UUHHNLKCTGZUGK-MFKMUULPSA-N 1 2 244.354 2.114 20 0 BEADLO CCC(CC)NC(=O)[C@H](C)[N@@H+]1CC[C@@](C)(F)C1 ZINC000347392796 386378802 /nfs/dbraw/zinc/37/88/02/386378802.db2.gz UUHHNLKCTGZUGK-GXFFZTMASA-N 1 2 244.354 2.114 20 0 BEADLO CCC(CC)NC(=O)[C@H](C)[N@H+]1CC[C@@](C)(F)C1 ZINC000347392796 386378811 /nfs/dbraw/zinc/37/88/11/386378811.db2.gz UUHHNLKCTGZUGK-GXFFZTMASA-N 1 2 244.354 2.114 20 0 BEADLO CCOc1nnc(C[NH+]2C[C@H](C)[C@@H](C)C2)s1 ZINC000336697170 386379030 /nfs/dbraw/zinc/37/90/30/386379030.db2.gz IAXYMYNNFJABHB-IUCAKERBSA-N 1 2 241.360 2.025 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC1[C@H](C)CCC[C@H]1C ZINC000298736474 386379362 /nfs/dbraw/zinc/37/93/62/386379362.db2.gz XSRAQCGRYZMQSV-NXEZZACHSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)NC1[C@H](C)CCC[C@H]1C ZINC000298736474 386379373 /nfs/dbraw/zinc/37/93/73/386379373.db2.gz XSRAQCGRYZMQSV-NXEZZACHSA-N 1 2 249.358 2.202 20 0 BEADLO C[C@@H](C(=O)OC(C)(C)C)[N@@H+]1CC[C@](C)(F)C1 ZINC000347395709 386382821 /nfs/dbraw/zinc/38/28/21/386382821.db2.gz SXPNREUBPYDCQF-CABZTGNLSA-N 1 2 231.311 2.151 20 0 BEADLO C[C@@H](C(=O)OC(C)(C)C)[N@H+]1CC[C@](C)(F)C1 ZINC000347395709 386382825 /nfs/dbraw/zinc/38/28/25/386382825.db2.gz SXPNREUBPYDCQF-CABZTGNLSA-N 1 2 231.311 2.151 20 0 BEADLO FC(F)(F)COCCCOc1cc[nH+]cc1 ZINC000276454589 386325643 /nfs/dbraw/zinc/32/56/43/386325643.db2.gz MRHRBSCKZUZNKV-UHFFFAOYSA-N 1 2 235.205 2.429 20 0 BEADLO CCCCCCNC(=O)CCc1c[nH+]cn1C ZINC000276460202 386327497 /nfs/dbraw/zinc/32/74/97/386327497.db2.gz BUUQSVNMZGVHJO-UHFFFAOYSA-N 1 2 237.347 2.049 20 0 BEADLO COC(=O)[C@@H]([NH2+]Cc1cc(C)cc(C)c1)C1CC1 ZINC000276474924 386331345 /nfs/dbraw/zinc/33/13/45/386331345.db2.gz QZIPEYKYISWCRT-AWEZNQCLSA-N 1 2 247.338 2.345 20 0 BEADLO Cc1cc(C)c(C[NH2+][C@]2(C)CCOC2=O)c(C)c1 ZINC000289625109 386335849 /nfs/dbraw/zinc/33/58/49/386335849.db2.gz RPYITZSHUBIMGS-OAHLLOKOSA-N 1 2 247.338 2.407 20 0 BEADLO CC[C@](C)([NH2+]CCc1ccccc1)C(=O)OC ZINC000265410130 386337084 /nfs/dbraw/zinc/33/70/84/386337084.db2.gz DPKVIACLJARJMA-AWEZNQCLSA-N 1 2 235.327 2.160 20 0 BEADLO CC(C)(C)c1n[nH]cc1C[NH2+]CC(F)F ZINC000336754159 386442215 /nfs/dbraw/zinc/44/22/15/386442215.db2.gz HZAXJHSZZWMAPY-UHFFFAOYSA-N 1 2 217.263 2.062 20 0 BEADLO Cc1noc(C[N@@H+](Cc2ccco2)C(C)C)n1 ZINC000299396744 386448946 /nfs/dbraw/zinc/44/89/46/386448946.db2.gz UFQNOBWHPVGWBV-UHFFFAOYSA-N 1 2 235.287 2.382 20 0 BEADLO Cc1noc(C[N@H+](Cc2ccco2)C(C)C)n1 ZINC000299396744 386448953 /nfs/dbraw/zinc/44/89/53/386448953.db2.gz UFQNOBWHPVGWBV-UHFFFAOYSA-N 1 2 235.287 2.382 20 0 BEADLO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1cnns1 ZINC000290118033 386396565 /nfs/dbraw/zinc/39/65/65/386396565.db2.gz TXSHOHRNUSSZSY-LBPRGKRZSA-N 1 2 248.355 2.214 20 0 BEADLO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1cnns1 ZINC000290118033 386396568 /nfs/dbraw/zinc/39/65/68/386396568.db2.gz TXSHOHRNUSSZSY-LBPRGKRZSA-N 1 2 248.355 2.214 20 0 BEADLO c1nnsc1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC000336701088 386401897 /nfs/dbraw/zinc/40/18/97/386401897.db2.gz JUKZAKZNGUCMDR-GFCCVEGCSA-N 1 2 246.339 2.270 20 0 BEADLO c1nnsc1C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC000336701088 386401899 /nfs/dbraw/zinc/40/18/99/386401899.db2.gz JUKZAKZNGUCMDR-GFCCVEGCSA-N 1 2 246.339 2.270 20 0 BEADLO c1nnsc1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC000336701091 386401970 /nfs/dbraw/zinc/40/19/70/386401970.db2.gz JUKZAKZNGUCMDR-LBPRGKRZSA-N 1 2 246.339 2.270 20 0 BEADLO c1nnsc1C[N@H+]1CCC[C@H]1c1cccnc1 ZINC000336701091 386401973 /nfs/dbraw/zinc/40/19/73/386401973.db2.gz JUKZAKZNGUCMDR-LBPRGKRZSA-N 1 2 246.339 2.270 20 0 BEADLO Cc1noc(CCC[N@H+](CC(F)F)C2CC2)n1 ZINC000336700741 386402070 /nfs/dbraw/zinc/40/20/70/386402070.db2.gz LJKUHXVACPZEFO-UHFFFAOYSA-N 1 2 245.273 2.040 20 0 BEADLO Cc1noc(CCC[N@@H+](CC(F)F)C2CC2)n1 ZINC000336700741 386402072 /nfs/dbraw/zinc/40/20/72/386402072.db2.gz LJKUHXVACPZEFO-UHFFFAOYSA-N 1 2 245.273 2.040 20 0 BEADLO CC(C)CC(=O)Nc1cccc2[nH+]ccn21 ZINC000266133288 386402401 /nfs/dbraw/zinc/40/24/01/386402401.db2.gz CRADZHLMLKTNEW-UHFFFAOYSA-N 1 2 217.272 2.319 20 0 BEADLO CS[C@@H](C)C(=O)Nc1cccc2[nH+]ccn21 ZINC000266133488 386403642 /nfs/dbraw/zinc/40/36/42/386403642.db2.gz CZPKUPHBZKKMNI-QMMMGPOBSA-N 1 2 235.312 2.024 20 0 BEADLO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1csnn1 ZINC000290200850 386406168 /nfs/dbraw/zinc/40/61/68/386406168.db2.gz PPCBFLVAZZKXSM-PRHODGIISA-N 1 2 247.323 2.150 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@H]1CCC[C@H](C)C1 ZINC000452570989 386408929 /nfs/dbraw/zinc/40/89/29/386408929.db2.gz NCWPKRSAMONQKO-RYUDHWBXSA-N 1 2 249.358 2.346 20 0 BEADLO C[C@@H](Nc1cc[nH+]c(C2CC2)n1)c1cnn(C)c1 ZINC000266193623 386410132 /nfs/dbraw/zinc/41/01/32/386410132.db2.gz BYBBZPLGKFHPKS-SECBINFHSA-N 1 2 243.314 2.261 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@@H]1CCC[C@H](C)C1 ZINC000452570987 386410357 /nfs/dbraw/zinc/41/03/57/386410357.db2.gz NCWPKRSAMONQKO-NWDGAFQWSA-N 1 2 249.358 2.346 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cnc(C)cn2)o1 ZINC000336707352 386410424 /nfs/dbraw/zinc/41/04/24/386410424.db2.gz OQEIIMCEIGZSJD-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cnc(C)cn2)o1 ZINC000336707352 386410430 /nfs/dbraw/zinc/41/04/30/386410430.db2.gz OQEIIMCEIGZSJD-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO O=C(/C=C/C1CC1)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000266253557 386416067 /nfs/dbraw/zinc/41/60/67/386416067.db2.gz BNIIUCUFMJWACG-ONEGZZNKSA-N 1 2 245.326 2.082 20 0 BEADLO COc1cc(CNc2cccc[nH+]2)ccn1 ZINC000060726262 386416793 /nfs/dbraw/zinc/41/67/93/386416793.db2.gz UTSQJRHUQMICNJ-UHFFFAOYSA-N 1 2 215.256 2.097 20 0 BEADLO Cc1cc(NC(=O)N2C[C@H](C)[C@H](C)[C@H]2C)cc[nH+]1 ZINC000416947585 386420339 /nfs/dbraw/zinc/42/03/39/386420339.db2.gz JFHBCBODMWTBAE-ZMLRMANQSA-N 1 2 247.342 2.320 20 0 BEADLO Cc1cc(N[C@@H]2CCS[C@H]2C)nc(C2CC2)[nH+]1 ZINC000645401877 386427421 /nfs/dbraw/zinc/42/74/21/386427421.db2.gz NPDOOGXEOWCPRS-GXSJLCMTSA-N 1 2 249.383 2.390 20 0 BEADLO Cc1cnn(C)c1C[N@@H+](C)[C@@H](C)c1cccnc1 ZINC000290389135 386430320 /nfs/dbraw/zinc/43/03/20/386430320.db2.gz OMCJSJQAWKCZKY-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cnn(C)c1C[N@H+](C)[C@@H](C)c1cccnc1 ZINC000290389135 386430325 /nfs/dbraw/zinc/43/03/25/386430325.db2.gz OMCJSJQAWKCZKY-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO CCCCN(CCOC)c1cc[nH+]c(C)n1 ZINC000266457857 386435645 /nfs/dbraw/zinc/43/56/45/386435645.db2.gz YGCGYYKZRXNTEK-UHFFFAOYSA-N 1 2 223.320 2.038 20 0 BEADLO C[C@H]1SCC[C@@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000645402414 386435798 /nfs/dbraw/zinc/43/57/98/386435798.db2.gz RYYLEXIQFPSSEX-SCZZXKLOSA-N 1 2 235.356 2.082 20 0 BEADLO Cn1c2cc(F)ccc2[nH+]c1N1CC=CCC1 ZINC000644864113 386467084 /nfs/dbraw/zinc/46/70/84/386467084.db2.gz ASASOIKTAJIKPZ-UHFFFAOYSA-N 1 2 231.274 2.479 20 0 BEADLO O=C(CC1CC1)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000299570553 386468820 /nfs/dbraw/zinc/46/88/20/386468820.db2.gz BMOPASSMWKSPMB-NSHDSACASA-N 1 2 233.315 2.263 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C1(CCF)CC1 ZINC000290841168 386481716 /nfs/dbraw/zinc/48/17/16/386481716.db2.gz QFWKGHHVEMVHGF-UHFFFAOYSA-N 1 2 222.263 2.468 20 0 BEADLO C[N@H+](Cc1ccon1)Cc1cccc(O)c1 ZINC000266956218 386482993 /nfs/dbraw/zinc/48/29/93/386482993.db2.gz VLVXOOCIVXWDBI-UHFFFAOYSA-N 1 2 218.256 2.012 20 0 BEADLO C[N@@H+](Cc1ccon1)Cc1cccc(O)c1 ZINC000266956218 386482996 /nfs/dbraw/zinc/48/29/96/386482996.db2.gz VLVXOOCIVXWDBI-UHFFFAOYSA-N 1 2 218.256 2.012 20 0 BEADLO CCC[C@H](C(=O)N1CCn2c[nH+]cc2C1)C(C)C ZINC000290869725 386484074 /nfs/dbraw/zinc/48/40/74/386484074.db2.gz CLHIEUIOVXBTFI-ZDUSSCGKSA-N 1 2 249.358 2.298 20 0 BEADLO CCCCN(CCO)c1cc(C)[nH+]c(C2CC2)n1 ZINC000267019580 386484670 /nfs/dbraw/zinc/48/46/70/386484670.db2.gz IOHSVTCNNRPFML-UHFFFAOYSA-N 1 2 249.358 2.261 20 0 BEADLO Cc1c[nH+]c(C)nc1NCC1(C(C)C)CC1 ZINC000519561901 386488645 /nfs/dbraw/zinc/48/86/45/386488645.db2.gz ZTIAGHGCZLUAML-UHFFFAOYSA-N 1 2 219.332 2.363 20 0 BEADLO C[NH+](C)Cc1nc(C(C)(C)c2ccccc2)no1 ZINC000278125250 386491312 /nfs/dbraw/zinc/49/13/12/386491312.db2.gz JTEXIQHDCXMYLJ-UHFFFAOYSA-N 1 2 245.326 2.457 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000278124757 386492191 /nfs/dbraw/zinc/49/21/91/386492191.db2.gz BJOMSKCCVASEHM-SECBINFHSA-N 1 2 247.264 2.492 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000278124757 386492200 /nfs/dbraw/zinc/49/22/00/386492200.db2.gz BJOMSKCCVASEHM-SECBINFHSA-N 1 2 247.264 2.492 20 0 BEADLO CC[C@@H]([NH2+]CC[C@@H]1CCOC1)C(F)(F)F ZINC000336755679 386492584 /nfs/dbraw/zinc/49/25/84/386492584.db2.gz IBWAIGSHPQHBDA-RKDXNWHRSA-N 1 2 225.254 2.344 20 0 BEADLO O=C(C[N@@H+]1CCC12CCC2)Nc1ccccc1F ZINC000335435677 386493713 /nfs/dbraw/zinc/49/37/13/386493713.db2.gz NMNNICFYGDLFES-UHFFFAOYSA-N 1 2 248.301 2.393 20 0 BEADLO O=C(C[N@H+]1CCC12CCC2)Nc1ccccc1F ZINC000335435677 386493716 /nfs/dbraw/zinc/49/37/16/386493716.db2.gz NMNNICFYGDLFES-UHFFFAOYSA-N 1 2 248.301 2.393 20 0 BEADLO CC(C)(C)c1nnc(C[N@@H+]2CCC23CCC3)[nH]1 ZINC000335439465 386496902 /nfs/dbraw/zinc/49/69/02/386496902.db2.gz BELYSUYUOXJRBG-UHFFFAOYSA-N 1 2 234.347 2.231 20 0 BEADLO CC(C)(C)c1nnc(C[N@H+]2CCC23CCC3)[nH]1 ZINC000335439465 386496909 /nfs/dbraw/zinc/49/69/09/386496909.db2.gz BELYSUYUOXJRBG-UHFFFAOYSA-N 1 2 234.347 2.231 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2nccc(N)n2)o1 ZINC000647971130 386497063 /nfs/dbraw/zinc/49/70/63/386497063.db2.gz VDSACQVEYINQSO-NXEZZACHSA-N 1 2 246.314 2.202 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)CC1CCCCCC1 ZINC000267343849 386529604 /nfs/dbraw/zinc/52/96/04/386529604.db2.gz DIHVAKYYPWQMHS-UHFFFAOYSA-N 1 2 249.358 2.397 20 0 BEADLO C[C@H]1COC(C)(C)C[N@@H+]1Cc1cncs1 ZINC000335445387 386510408 /nfs/dbraw/zinc/51/04/08/386510408.db2.gz UPUQLDIWEKJSJO-VIFPVBQESA-N 1 2 226.345 2.142 20 0 BEADLO C[C@H]1COC(C)(C)C[N@H+]1Cc1cncs1 ZINC000335445387 386510415 /nfs/dbraw/zinc/51/04/15/386510415.db2.gz UPUQLDIWEKJSJO-VIFPVBQESA-N 1 2 226.345 2.142 20 0 BEADLO COC(=O)[C@@H]([NH2+]CCCc1ccccc1)C1CC1 ZINC000227766924 386511824 /nfs/dbraw/zinc/51/18/24/386511824.db2.gz URDSOTKUBRBLCF-AWEZNQCLSA-N 1 2 247.338 2.160 20 0 BEADLO CCc1nc(N2CC(C)(C)OC[C@H]2C)cc(C)[nH+]1 ZINC000343230903 386512303 /nfs/dbraw/zinc/51/23/03/386512303.db2.gz NAXBIYJZFXRZBA-LLVKDONJSA-N 1 2 249.358 2.351 20 0 BEADLO Nc1[nH+]cnc(NC(C2CC2)C2CC2)c1Cl ZINC000227845470 386516811 /nfs/dbraw/zinc/51/68/11/386516811.db2.gz GQIREBAKDMAZAP-UHFFFAOYSA-N 1 2 238.722 2.313 20 0 BEADLO Nc1nc[nH+]c(NC(C2CC2)C2CC2)c1Cl ZINC000227845470 386516817 /nfs/dbraw/zinc/51/68/17/386516817.db2.gz GQIREBAKDMAZAP-UHFFFAOYSA-N 1 2 238.722 2.313 20 0 BEADLO CCOc1ccc(OC(=O)[C@@H]2CCC[N@@H+]2C)cc1 ZINC000299474750 386455140 /nfs/dbraw/zinc/45/51/40/386455140.db2.gz FCJBPDOJUJDITQ-ZDUSSCGKSA-N 1 2 249.310 2.085 20 0 BEADLO CCOc1ccc(OC(=O)[C@@H]2CCC[N@H+]2C)cc1 ZINC000299474750 386455147 /nfs/dbraw/zinc/45/51/47/386455147.db2.gz FCJBPDOJUJDITQ-ZDUSSCGKSA-N 1 2 249.310 2.085 20 0 BEADLO c1cn2cc(-c3nc(CC4CC4)no3)ccc2[nH+]1 ZINC000266623107 386459167 /nfs/dbraw/zinc/45/91/67/386459167.db2.gz TVJIAOVBLDXFNW-UHFFFAOYSA-N 1 2 240.266 2.337 20 0 BEADLO Fc1cc(F)c(C[NH2+]Cc2cc[nH]n2)c(F)c1 ZINC000339521769 386464709 /nfs/dbraw/zinc/46/47/09/386464709.db2.gz BUBCQTHNDQMDHH-UHFFFAOYSA-N 1 2 241.216 2.117 20 0 BEADLO CCc1ncc(C[N@@H+]2CC[C@H](F)C2)s1 ZINC000335410141 386574299 /nfs/dbraw/zinc/57/42/99/386574299.db2.gz PSEJWUVQASYXJO-QMMMGPOBSA-N 1 2 214.309 2.249 20 0 BEADLO CCc1ncc(C[N@H+]2CC[C@H](F)C2)s1 ZINC000335410141 386574303 /nfs/dbraw/zinc/57/43/03/386574303.db2.gz PSEJWUVQASYXJO-QMMMGPOBSA-N 1 2 214.309 2.249 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cc(O)cc(F)c2)CCO1 ZINC000184147943 386574900 /nfs/dbraw/zinc/57/49/00/386574900.db2.gz IZECISLLFCHBJY-ZDUSSCGKSA-N 1 2 239.290 2.142 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cc(O)cc(F)c2)CCO1 ZINC000184147943 386574907 /nfs/dbraw/zinc/57/49/07/386574907.db2.gz IZECISLLFCHBJY-ZDUSSCGKSA-N 1 2 239.290 2.142 20 0 BEADLO c1coc(CNc2cc(N3CCCC3)nc[nH+]2)c1 ZINC000243852522 386576483 /nfs/dbraw/zinc/57/64/83/386576483.db2.gz RFXSZWPDOZWJKD-UHFFFAOYSA-N 1 2 244.298 2.282 20 0 BEADLO c1coc(CNc2cc(N3CCCC3)[nH+]cn2)c1 ZINC000243852522 386576490 /nfs/dbraw/zinc/57/64/90/386576490.db2.gz RFXSZWPDOZWJKD-UHFFFAOYSA-N 1 2 244.298 2.282 20 0 BEADLO COC[C@H](C)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000103363794 386576788 /nfs/dbraw/zinc/57/67/88/386576788.db2.gz VXMLHHWBZSRBQJ-VIFPVBQESA-N 1 2 236.315 2.228 20 0 BEADLO CC[C@](C)(CO)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000267738394 386577660 /nfs/dbraw/zinc/57/76/60/386577660.db2.gz VBSUQWRYKHYXES-CYBMUJFWSA-N 1 2 235.331 2.235 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2cc(C(N)=O)co2)o1 ZINC000187733005 386587779 /nfs/dbraw/zinc/58/77/79/386587779.db2.gz YWJSUVWYJXYACX-VIFPVBQESA-N 1 2 248.282 2.131 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCCc2occc21)c1ncnn1C ZINC000278810388 386589705 /nfs/dbraw/zinc/58/97/05/386589705.db2.gz RXDPYHBULHCCSW-MWLCHTKSSA-N 1 2 246.314 2.136 20 0 BEADLO C[C@H]1C[N@H+](Cc2nccs2)CC2(CCC2)O1 ZINC000335462372 386546252 /nfs/dbraw/zinc/54/62/52/386546252.db2.gz FNIWPHGGGSICPR-JTQLQIEISA-N 1 2 238.356 2.287 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nccs2)CC2(CCC2)O1 ZINC000335462372 386546256 /nfs/dbraw/zinc/54/62/56/386546256.db2.gz FNIWPHGGGSICPR-JTQLQIEISA-N 1 2 238.356 2.287 20 0 BEADLO Cc1c[nH]nc1C[N@H+](Cc1ccccn1)C1CC1 ZINC000291594673 386558638 /nfs/dbraw/zinc/55/86/38/386558638.db2.gz QCRCICWXQXUQDI-UHFFFAOYSA-N 1 2 242.326 2.278 20 0 BEADLO Cc1c[nH]nc1C[N@@H+](Cc1ccccn1)C1CC1 ZINC000291594673 386558642 /nfs/dbraw/zinc/55/86/42/386558642.db2.gz QCRCICWXQXUQDI-UHFFFAOYSA-N 1 2 242.326 2.278 20 0 BEADLO CCCC[C@H]([NH2+]CC(C)(C)OCC)C(=O)OC ZINC000187778585 386597563 /nfs/dbraw/zinc/59/75/63/386597563.db2.gz XZDAGAUQMXCHGH-NSHDSACASA-N 1 2 245.363 2.123 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cncs2)C[C@@H](C)O1 ZINC000245566869 386597867 /nfs/dbraw/zinc/59/78/67/386597867.db2.gz TZPNNMZWCOWOJA-ZJUUUORDSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cncs2)C[C@@H](C)O1 ZINC000245566869 386597873 /nfs/dbraw/zinc/59/78/73/386597873.db2.gz TZPNNMZWCOWOJA-ZJUUUORDSA-N 1 2 226.345 2.142 20 0 BEADLO Cc1cccc2ncc(C[N@@H+]3CC[C@@H](F)C3)n21 ZINC000335409578 386571773 /nfs/dbraw/zinc/57/17/73/386571773.db2.gz MBVCKIHFLRIQPX-LLVKDONJSA-N 1 2 233.290 2.187 20 0 BEADLO Cc1cccc2ncc(C[N@H+]3CC[C@@H](F)C3)n21 ZINC000335409578 386571777 /nfs/dbraw/zinc/57/17/77/386571777.db2.gz MBVCKIHFLRIQPX-LLVKDONJSA-N 1 2 233.290 2.187 20 0 BEADLO FC(F)(F)C[C@@H]1CC[N@H+](Cc2ncc[nH]2)C1 ZINC000278720387 386572003 /nfs/dbraw/zinc/57/20/03/386572003.db2.gz KPLAFKBPURFNGS-QMMMGPOBSA-N 1 2 233.237 2.184 20 0 BEADLO FC(F)(F)C[C@@H]1CC[N@@H+](Cc2ncc[nH]2)C1 ZINC000278720387 386572007 /nfs/dbraw/zinc/57/20/07/386572007.db2.gz KPLAFKBPURFNGS-QMMMGPOBSA-N 1 2 233.237 2.184 20 0 BEADLO Cc1cccn2c(C[N@@H+]3CC[C@@H](F)C3)cnc12 ZINC000335410098 386573344 /nfs/dbraw/zinc/57/33/44/386573344.db2.gz OEOVROCPODIXSP-LLVKDONJSA-N 1 2 233.290 2.187 20 0 BEADLO Cc1cccn2c(C[N@H+]3CC[C@@H](F)C3)cnc12 ZINC000335410098 386573350 /nfs/dbraw/zinc/57/33/50/386573350.db2.gz OEOVROCPODIXSP-LLVKDONJSA-N 1 2 233.290 2.187 20 0 BEADLO Cc1cccn2c(CN3CC[C@@H](F)C3)c[nH+]c12 ZINC000335410098 386573355 /nfs/dbraw/zinc/57/33/55/386573355.db2.gz OEOVROCPODIXSP-LLVKDONJSA-N 1 2 233.290 2.187 20 0 BEADLO Cn1c[nH+]cc1CC(=O)N1CCCCC(C)(C)C1 ZINC000525873479 386622681 /nfs/dbraw/zinc/62/26/81/386622681.db2.gz UIMQCEQNFFWFBV-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO Cc1cccc(C[S@@](=O)Cc2c[nH+]cn2C)c1 ZINC000268144473 386625387 /nfs/dbraw/zinc/62/53/87/386625387.db2.gz ITIKZLUDNCAPRD-QGZVFWFLSA-N 1 2 248.351 2.177 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1CCC[C@@H](F)C1 ZINC000335499116 386625623 /nfs/dbraw/zinc/62/56/23/386625623.db2.gz AYBGTDYRNKSGKJ-GHMZBOCLSA-N 1 2 236.290 2.279 20 0 BEADLO CCc1cc(N)nc(SCc2ccccn2)[nH+]1 ZINC000279085119 386630231 /nfs/dbraw/zinc/63/02/31/386630231.db2.gz MLWWPHXTZVYVKY-UHFFFAOYSA-N 1 2 246.339 2.309 20 0 BEADLO CC(C)CO[C@H]1CCN(c2cccc[nH+]2)C1 ZINC000268256414 386632610 /nfs/dbraw/zinc/63/26/10/386632610.db2.gz IOVBIHDRKBCLHR-LBPRGKRZSA-N 1 2 220.316 2.333 20 0 BEADLO CC1=CCC[N@@H+](Cc2nn(C)cc2Cl)C1 ZINC000335503986 386635262 /nfs/dbraw/zinc/63/52/62/386635262.db2.gz SQLHNNNUHQMVMA-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO CC1=CCC[N@H+](Cc2nn(C)cc2Cl)C1 ZINC000335503986 386635266 /nfs/dbraw/zinc/63/52/66/386635266.db2.gz SQLHNNNUHQMVMA-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO CCO[C@H](C)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000097293818 386636089 /nfs/dbraw/zinc/63/60/89/386636089.db2.gz SGIOYOMBBFYBBK-LLVKDONJSA-N 1 2 236.315 2.370 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@@H](CF)C2)o1 ZINC000414470456 386639200 /nfs/dbraw/zinc/63/92/00/386639200.db2.gz LXEZRQAOIHYIRD-LBPRGKRZSA-N 1 2 227.279 2.012 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@@H](CF)C2)o1 ZINC000414470456 386639207 /nfs/dbraw/zinc/63/92/07/386639207.db2.gz LXEZRQAOIHYIRD-LBPRGKRZSA-N 1 2 227.279 2.012 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)NCCCC1CCCC1 ZINC000279161417 386639427 /nfs/dbraw/zinc/63/94/27/386639427.db2.gz IHSFNDHMCXWFMV-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO C[N@H+](CCF)Cc1cnn(-c2ccccc2)c1 ZINC000268322965 386642352 /nfs/dbraw/zinc/64/23/52/386642352.db2.gz UPQAJDVCQKZUPM-UHFFFAOYSA-N 1 2 233.290 2.274 20 0 BEADLO C[N@@H+](CCF)Cc1cnn(-c2ccccc2)c1 ZINC000268322965 386642357 /nfs/dbraw/zinc/64/23/57/386642357.db2.gz UPQAJDVCQKZUPM-UHFFFAOYSA-N 1 2 233.290 2.274 20 0 BEADLO Cc1noc([C@H](C)[NH2+]Cc2ccnn2C(C)C)n1 ZINC000337199926 386648134 /nfs/dbraw/zinc/64/81/34/386648134.db2.gz DXIZWEPOJAQBES-VIFPVBQESA-N 1 2 249.318 2.006 20 0 BEADLO CC(C)=CC(=O)N1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000268372472 386648187 /nfs/dbraw/zinc/64/81/87/386648187.db2.gz KMCMZNJCWGMLHA-CHWSQXEVSA-N 1 2 247.342 2.259 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)NCCC1=CCCCC1 ZINC000279204150 386648488 /nfs/dbraw/zinc/64/84/88/386648488.db2.gz NDDXGCXHARJQSP-UHFFFAOYSA-N 1 2 247.342 2.349 20 0 BEADLO C/C=C(\C)C(=O)N1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000268376191 386648900 /nfs/dbraw/zinc/64/89/00/386648900.db2.gz LRCMNKKPDCZBQR-BELPRIPISA-N 1 2 247.342 2.259 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccc(F)c2)n(C)n1 ZINC000417750545 386650834 /nfs/dbraw/zinc/65/08/34/386650834.db2.gz XUMLFKBGWBYATB-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccc(F)c2)n(C)n1 ZINC000417750545 386650839 /nfs/dbraw/zinc/65/08/39/386650839.db2.gz XUMLFKBGWBYATB-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CCC[C@@H]2CCC[C@H]21 ZINC000278969027 386611333 /nfs/dbraw/zinc/61/13/33/386611333.db2.gz XKEPNUCUFAPWSY-WCQYABFASA-N 1 2 247.342 2.052 20 0 BEADLO Cc1noc([C@H](C)NCc2c[nH+]cn2C(C)C)n1 ZINC000425330468 386661814 /nfs/dbraw/zinc/66/18/14/386661814.db2.gz ASOUVJWAMUWKQQ-VIFPVBQESA-N 1 2 249.318 2.006 20 0 BEADLO CCC1(CNC(=O)c2c[nH+]c(C)[nH]2)CCCC1 ZINC000268540714 386663071 /nfs/dbraw/zinc/66/30/71/386663071.db2.gz GRMBGNGFLIDILR-UHFFFAOYSA-N 1 2 235.331 2.418 20 0 BEADLO CC[N@H+](CCC1CCOCC1)CC(F)F ZINC000645000601 386665470 /nfs/dbraw/zinc/66/54/70/386665470.db2.gz JKFLGMIPVAVCGH-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO CC[N@@H+](CCC1CCOCC1)CC(F)F ZINC000645000601 386665474 /nfs/dbraw/zinc/66/54/74/386665474.db2.gz JKFLGMIPVAVCGH-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO CCOc1cccc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)c1 ZINC000366512240 386669234 /nfs/dbraw/zinc/66/92/34/386669234.db2.gz ACONOQJMKINREA-UONOGXRCSA-N 1 2 233.311 2.058 20 0 BEADLO CCOc1cccc(C[N@H+]2CCO[C@@H]3C[C@@H]32)c1 ZINC000366512240 386669236 /nfs/dbraw/zinc/66/92/36/386669236.db2.gz ACONOQJMKINREA-UONOGXRCSA-N 1 2 233.311 2.058 20 0 BEADLO C[C@@H]1COCC[N@@H+]1Cc1ccc(C(F)F)nc1 ZINC000639121876 386676672 /nfs/dbraw/zinc/67/66/72/386676672.db2.gz CGWHIVSXGSVHRB-SECBINFHSA-N 1 2 242.269 2.240 20 0 BEADLO C[C@@H]1COCC[N@H+]1Cc1ccc(C(F)F)nc1 ZINC000639121876 386676676 /nfs/dbraw/zinc/67/66/76/386676676.db2.gz CGWHIVSXGSVHRB-SECBINFHSA-N 1 2 242.269 2.240 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccoc2C)n(C)n1 ZINC000417760887 386679721 /nfs/dbraw/zinc/67/97/21/386679721.db2.gz RQYZADNLBOJJMH-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccoc2C)n(C)n1 ZINC000417760887 386679727 /nfs/dbraw/zinc/67/97/27/386679727.db2.gz RQYZADNLBOJJMH-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO CC[C@@H](Nc1cc[nH+]c(C2CC2)n1)C(C)(C)O ZINC000292688586 386710297 /nfs/dbraw/zinc/71/02/97/386710297.db2.gz FERQGDWDMOFUMS-SNVBAGLBSA-N 1 2 235.331 2.315 20 0 BEADLO COC(=O)[C@H](CC1CC1)[NH2+]Cc1cccs1 ZINC000414480560 386684253 /nfs/dbraw/zinc/68/42/53/386684253.db2.gz BGCQNFWTSVOTPE-NSHDSACASA-N 1 2 239.340 2.179 20 0 BEADLO COC(=O)C[N@H+](C)Cc1cccc(C(F)F)c1 ZINC000279478691 386686508 /nfs/dbraw/zinc/68/65/08/386686508.db2.gz NTEAQQOCQOSILK-UHFFFAOYSA-N 1 2 243.253 2.229 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1cccc(C(F)F)c1 ZINC000279478691 386686516 /nfs/dbraw/zinc/68/65/16/386686516.db2.gz NTEAQQOCQOSILK-UHFFFAOYSA-N 1 2 243.253 2.229 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N(C)[C@@H](C)C1CCC1 ZINC000357020671 386692746 /nfs/dbraw/zinc/69/27/46/386692746.db2.gz OLQWGJUALBKKIF-NSHDSACASA-N 1 2 247.342 2.464 20 0 BEADLO CC1=C(C)C[C@H](C(=O)NCc2c[nH+]c[nH]2)CC1 ZINC000335545631 386730664 /nfs/dbraw/zinc/73/06/64/386730664.db2.gz NSECAQDFMYDUNA-LLVKDONJSA-N 1 2 233.315 2.162 20 0 BEADLO CC1=C(C)C[C@H](C(=O)NCc2c[nH]c[nH+]2)CC1 ZINC000335545631 386730671 /nfs/dbraw/zinc/73/06/71/386730671.db2.gz NSECAQDFMYDUNA-LLVKDONJSA-N 1 2 233.315 2.162 20 0 BEADLO CC[C@H]([NH2+][C@@H]1C[C@@H]1Cc1ccccc1)C(=O)OC ZINC000279739343 386731599 /nfs/dbraw/zinc/73/15/99/386731599.db2.gz KKUJVVKFINNWOC-MELADBBJSA-N 1 2 247.338 2.159 20 0 BEADLO CCC(=O)N1CC[N@H+](Cc2cccc(C)c2)C1 ZINC000335484682 386715521 /nfs/dbraw/zinc/71/55/21/386715521.db2.gz SOAFUQZPTGQWQV-UHFFFAOYSA-N 1 2 232.327 2.007 20 0 BEADLO CCC(=O)N1CC[N@@H+](Cc2cccc(C)c2)C1 ZINC000335484682 386715523 /nfs/dbraw/zinc/71/55/23/386715523.db2.gz SOAFUQZPTGQWQV-UHFFFAOYSA-N 1 2 232.327 2.007 20 0 BEADLO Cn1c[nH+]cc1Cc1noc(CCC2CCC2)n1 ZINC000329609663 386717286 /nfs/dbraw/zinc/71/72/86/386717286.db2.gz NLVPOFQLHORGKW-UHFFFAOYSA-N 1 2 246.314 2.127 20 0 BEADLO Cc1cnccc1SCc1c[nH+]cn1C ZINC000292735140 386717387 /nfs/dbraw/zinc/71/73/87/386717387.db2.gz JAFUISCFODOBQS-UHFFFAOYSA-N 1 2 219.313 2.416 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccc(C)n2)n(C)n1 ZINC000417784318 386720045 /nfs/dbraw/zinc/72/00/45/386720045.db2.gz CXNXIMVWVGSELH-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccc(C)n2)n(C)n1 ZINC000417784318 386720050 /nfs/dbraw/zinc/72/00/50/386720050.db2.gz CXNXIMVWVGSELH-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO C[C@H]1SCC[N@H+](Cc2cocn2)[C@H]1C ZINC000191944179 386721158 /nfs/dbraw/zinc/72/11/58/386721158.db2.gz UHOPXDJURMDRCM-DTWKUNHWSA-N 1 2 212.318 2.000 20 0 BEADLO C[C@H]1SCC[N@@H+](Cc2cocn2)[C@H]1C ZINC000191944179 386721165 /nfs/dbraw/zinc/72/11/65/386721165.db2.gz UHOPXDJURMDRCM-DTWKUNHWSA-N 1 2 212.318 2.000 20 0 BEADLO C[C@@H]1[C@H](C)SCC[N@@H+]1Cc1cocn1 ZINC000191944157 386721714 /nfs/dbraw/zinc/72/17/14/386721714.db2.gz UHOPXDJURMDRCM-BDAKNGLRSA-N 1 2 212.318 2.000 20 0 BEADLO C[C@@H]1[C@H](C)SCC[N@H+]1Cc1cocn1 ZINC000191944157 386721718 /nfs/dbraw/zinc/72/17/18/386721718.db2.gz UHOPXDJURMDRCM-BDAKNGLRSA-N 1 2 212.318 2.000 20 0 BEADLO CC(C)(C)[C@H]1C[N@H+](Cc2nccs2)CCO1 ZINC000279706958 386724917 /nfs/dbraw/zinc/72/49/17/386724917.db2.gz HPSYXHJOQYVXNF-SNVBAGLBSA-N 1 2 240.372 2.390 20 0 BEADLO CC(C)(C)[C@H]1C[N@@H+](Cc2nccs2)CCO1 ZINC000279706958 386724928 /nfs/dbraw/zinc/72/49/28/386724928.db2.gz HPSYXHJOQYVXNF-SNVBAGLBSA-N 1 2 240.372 2.390 20 0 BEADLO c1cc2c(o1)CCC[C@H]2[NH2+]Cc1cocn1 ZINC000192285152 386751422 /nfs/dbraw/zinc/75/14/22/386751422.db2.gz OVPRGDMABBDGQA-LLVKDONJSA-N 1 2 218.256 2.435 20 0 BEADLO Cc1ccc(Cc2nc([C@@H]3C[C@@H]3C)no2)c[nH+]1 ZINC000334153004 386753113 /nfs/dbraw/zinc/75/31/13/386753113.db2.gz NEIQMCUEZAWGAF-GZMMTYOYSA-N 1 2 229.283 2.487 20 0 BEADLO CC[C@H]1CCC[C@@H]1NC(=O)CCc1c[nH+]c[nH]1 ZINC000279903290 386753768 /nfs/dbraw/zinc/75/37/68/386753768.db2.gz MTHDCBIQMLRDBI-JQWIXIFHSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@H]1CCC[C@@H]1NC(=O)CCc1c[nH]c[nH+]1 ZINC000279903290 386753777 /nfs/dbraw/zinc/75/37/77/386753777.db2.gz MTHDCBIQMLRDBI-JQWIXIFHSA-N 1 2 235.331 2.037 20 0 BEADLO Fc1ccc2oc(-n3cc[nH+]c3)nc2c1 ZINC000114446404 386754008 /nfs/dbraw/zinc/75/40/08/386754008.db2.gz YJIDKGLVAMCHHI-UHFFFAOYSA-N 1 2 203.176 2.153 20 0 BEADLO COC(=O)c1coc(C[N@@H+]2CCC[C@@H]2CF)c1 ZINC000292969633 386757426 /nfs/dbraw/zinc/75/74/26/386757426.db2.gz GLBCCGJBUAUHDR-SNVBAGLBSA-N 1 2 241.262 2.000 20 0 BEADLO COC(=O)c1coc(C[N@H+]2CCC[C@@H]2CF)c1 ZINC000292969633 386757434 /nfs/dbraw/zinc/75/74/34/386757434.db2.gz GLBCCGJBUAUHDR-SNVBAGLBSA-N 1 2 241.262 2.000 20 0 BEADLO COC(=O)[C@@H](c1ccsc1)[NH+]1CCCC1 ZINC000279964691 386760960 /nfs/dbraw/zinc/76/09/60/386760960.db2.gz IOPUSAXIMBFHND-SNVBAGLBSA-N 1 2 225.313 2.058 20 0 BEADLO Cn1ccc(C[N@@H+]2CC[C@@H]2c2ccccc2)n1 ZINC000334145232 386744284 /nfs/dbraw/zinc/74/42/84/386744284.db2.gz KRULFGAKMYNQEH-CQSZACIVSA-N 1 2 227.311 2.367 20 0 BEADLO Cn1ccc(C[N@H+]2CC[C@@H]2c2ccccc2)n1 ZINC000334145232 386744286 /nfs/dbraw/zinc/74/42/86/386744286.db2.gz KRULFGAKMYNQEH-CQSZACIVSA-N 1 2 227.311 2.367 20 0 BEADLO CO[C@@]1(C)CCCN(c2cc[nH+]c(C)n2)CC1 ZINC000280231689 386791415 /nfs/dbraw/zinc/79/14/15/386791415.db2.gz LTCQCDJJYIFNTL-ZDUSSCGKSA-N 1 2 235.331 2.180 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)Cc1ccc(F)cc1 ZINC000114461113 386773102 /nfs/dbraw/zinc/77/31/02/386773102.db2.gz FQXTXHDVIVZAGQ-UHFFFAOYSA-N 1 2 219.263 2.181 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)Cc1ccc(F)cc1 ZINC000114461113 386773106 /nfs/dbraw/zinc/77/31/06/386773106.db2.gz FQXTXHDVIVZAGQ-UHFFFAOYSA-N 1 2 219.263 2.181 20 0 BEADLO CCCC[C@H](CC)NCC(F)(F)C[NH3+] ZINC000414933350 386782945 /nfs/dbraw/zinc/78/29/45/386782945.db2.gz TTYLHLBHYMMAMT-VIFPVBQESA-N 1 2 208.296 2.139 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1cc(F)ccc1F ZINC000293453895 386820478 /nfs/dbraw/zinc/82/04/78/386820478.db2.gz CUEQJSWNSVBJPJ-NSHDSACASA-N 1 2 227.254 2.186 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1cc(F)ccc1F ZINC000293453895 386820483 /nfs/dbraw/zinc/82/04/83/386820483.db2.gz CUEQJSWNSVBJPJ-NSHDSACASA-N 1 2 227.254 2.186 20 0 BEADLO CCC[C@H]([NH2+][C@@H]1CSC[C@H]1C)C(=O)OCC ZINC000336672954 386821685 /nfs/dbraw/zinc/82/16/85/386821685.db2.gz AXCZHLFQYPAXRL-OUAUKWLOSA-N 1 2 245.388 2.059 20 0 BEADLO Cc1nc(NCCNc2cccc[nH+]2)sc1C ZINC000357665221 386822659 /nfs/dbraw/zinc/82/26/59/386822659.db2.gz WBGWCMBOVXBIBK-UHFFFAOYSA-N 1 2 248.355 2.101 20 0 BEADLO c1cn(Cc2nc(CC3CCCC3)no2)c[nH+]1 ZINC000293337630 386802261 /nfs/dbraw/zinc/80/22/61/386802261.db2.gz MCAVTVGTJJYABZ-UHFFFAOYSA-N 1 2 232.287 2.047 20 0 BEADLO CO[C@@H]1CCC[C@H]1CNc1cc[nH+]c(C2CC2)n1 ZINC000340945275 386804203 /nfs/dbraw/zinc/80/42/03/386804203.db2.gz CPVKPWMUXIRCPM-NWDGAFQWSA-N 1 2 247.342 2.003 20 0 BEADLO CO[C@@H]1CCC[C@@H]1CNc1cc[nH+]c(C2CC2)n1 ZINC000340945468 386804377 /nfs/dbraw/zinc/80/43/77/386804377.db2.gz CPVKPWMUXIRCPM-VXGBXAGGSA-N 1 2 247.342 2.003 20 0 BEADLO CO[C@H]1CCC[C@H]1CNc1cc[nH+]c(C2CC2)n1 ZINC000340945276 386804575 /nfs/dbraw/zinc/80/45/75/386804575.db2.gz CPVKPWMUXIRCPM-RYUDHWBXSA-N 1 2 247.342 2.003 20 0 BEADLO Cc1nnc(N[C@@H](c2[nH]cc[nH+]2)C(C)C)nc1C ZINC000357557727 386806710 /nfs/dbraw/zinc/80/67/10/386806710.db2.gz JEVRXCUHLHAVJU-SNVBAGLBSA-N 1 2 246.318 2.021 20 0 BEADLO CC[C@H]1CCCC[C@@H]1NC(=O)CCc1c[nH+]c[nH]1 ZINC000280461363 386814378 /nfs/dbraw/zinc/81/43/78/386814378.db2.gz ZUSVYDWXUJWGJT-AAEUAGOBSA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@H]1CCCC[C@@H]1NC(=O)CCc1c[nH]c[nH+]1 ZINC000280461363 386814382 /nfs/dbraw/zinc/81/43/82/386814382.db2.gz ZUSVYDWXUJWGJT-AAEUAGOBSA-N 1 2 249.358 2.427 20 0 BEADLO CN(Cc1[nH+]ccn1C)c1nc2ccccc2o1 ZINC000301073989 386814667 /nfs/dbraw/zinc/81/46/67/386814667.db2.gz KMNGUSACTWMQJD-UHFFFAOYSA-N 1 2 242.282 2.198 20 0 BEADLO CN(C[C@H]1CCCCO1)c1cccc[nH+]1 ZINC000301083434 386815563 /nfs/dbraw/zinc/81/55/63/386815563.db2.gz LBLLNIIKISJLIX-LLVKDONJSA-N 1 2 206.289 2.087 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@H]3C[C@H]32)ccc1F ZINC000366555167 386832336 /nfs/dbraw/zinc/83/23/36/386832336.db2.gz CTYFIGBDZJNPHU-OLZOCXBDSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@H]3C[C@H]32)ccc1F ZINC000366555167 386832341 /nfs/dbraw/zinc/83/23/41/386832341.db2.gz CTYFIGBDZJNPHU-OLZOCXBDSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1c[nH+]c(CNCc2ccc(C)c(F)c2)n1C ZINC000341081220 386833328 /nfs/dbraw/zinc/83/33/28/386833328.db2.gz SNHBKAXNTONECZ-UHFFFAOYSA-N 1 2 247.317 2.466 20 0 BEADLO CC(C)CC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000280709879 386836977 /nfs/dbraw/zinc/83/69/77/386836977.db2.gz GLPYTZKLGDTJHV-UHFFFAOYSA-N 1 2 217.272 2.319 20 0 BEADLO Cc1nocc1CNc1ccc(C)[nH+]c1 ZINC000293395774 386837566 /nfs/dbraw/zinc/83/75/66/386837566.db2.gz XNAJPRJOWXWWBE-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO Cc1ccc(N[C@H](C)C(C)(C)n2cncn2)c[nH+]1 ZINC000280703345 386838089 /nfs/dbraw/zinc/83/80/89/386838089.db2.gz ATPHNHYMBIKUTA-LLVKDONJSA-N 1 2 245.330 2.217 20 0 BEADLO Cc1sccc1C[N@@H+](C)Cc1nccn1C ZINC000293560869 386839096 /nfs/dbraw/zinc/83/90/96/386839096.db2.gz IBLLNIBIKRZRSW-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1sccc1C[N@H+](C)Cc1nccn1C ZINC000293560869 386839100 /nfs/dbraw/zinc/83/91/00/386839100.db2.gz IBLLNIBIKRZRSW-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1sccc1CN(C)Cc1[nH+]ccn1C ZINC000293560869 386839104 /nfs/dbraw/zinc/83/91/04/386839104.db2.gz IBLLNIBIKRZRSW-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO CCc1cccc(C[N@H+](C)[C@H](C)C(=O)OC)c1 ZINC000280730367 386839942 /nfs/dbraw/zinc/83/99/42/386839942.db2.gz LFFJIHDXFAYCPV-LLVKDONJSA-N 1 2 235.327 2.242 20 0 BEADLO CCc1cccc(C[N@@H+](C)[C@H](C)C(=O)OC)c1 ZINC000280730367 386839947 /nfs/dbraw/zinc/83/99/47/386839947.db2.gz LFFJIHDXFAYCPV-LLVKDONJSA-N 1 2 235.327 2.242 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1c(F)cc(C)cc1F ZINC000425340924 386842181 /nfs/dbraw/zinc/84/21/81/386842181.db2.gz BXKRYKRXNGFEAK-JTQLQIEISA-N 1 2 241.281 2.494 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1c(F)cc(C)cc1F ZINC000425340924 386842183 /nfs/dbraw/zinc/84/21/83/386842183.db2.gz BXKRYKRXNGFEAK-JTQLQIEISA-N 1 2 241.281 2.494 20 0 BEADLO c1ccc(N2C[C@@H]3CC=CC[C@@H]3C2)[nH+]c1 ZINC000301409636 386842523 /nfs/dbraw/zinc/84/25/23/386842523.db2.gz JHFRMEQKULZWKH-TXEJJXNPSA-N 1 2 200.285 2.484 20 0 BEADLO C[C@]1(CO)CCC[C@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000301454738 386846006 /nfs/dbraw/zinc/84/60/06/386846006.db2.gz MNVZUAXIZNHQLV-BXUZGUMPSA-N 1 2 247.342 2.317 20 0 BEADLO Cc1cc(F)c(C[N@@H+](C)C2CC(O)C2)c(F)c1 ZINC000425334042 386847490 /nfs/dbraw/zinc/84/74/90/386847490.db2.gz GBTPHXRBELHMEZ-UHFFFAOYSA-N 1 2 241.281 2.228 20 0 BEADLO Cc1cc(F)c(C[N@H+](C)C2CC(O)C2)c(F)c1 ZINC000425334042 386847495 /nfs/dbraw/zinc/84/74/95/386847495.db2.gz GBTPHXRBELHMEZ-UHFFFAOYSA-N 1 2 241.281 2.228 20 0 BEADLO COC[C@@H](Nc1cc(C)[nH+]cn1)c1ccco1 ZINC000301515697 386850020 /nfs/dbraw/zinc/85/00/20/386850020.db2.gz BVTBWSYAWYKJCG-SNVBAGLBSA-N 1 2 233.271 2.178 20 0 BEADLO COC[C@H](Nc1cc(C)[nH+]cn1)c1ccco1 ZINC000301515696 386851487 /nfs/dbraw/zinc/85/14/87/386851487.db2.gz BVTBWSYAWYKJCG-JTQLQIEISA-N 1 2 233.271 2.178 20 0 BEADLO Cc1ccsc1C[N@H+](C)Cc1c[nH]cn1 ZINC000349521645 386852031 /nfs/dbraw/zinc/85/20/31/386852031.db2.gz KQKVBXFYSASZGB-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1ccsc1C[N@@H+](C)Cc1c[nH]cn1 ZINC000349521645 386852038 /nfs/dbraw/zinc/85/20/38/386852038.db2.gz KQKVBXFYSASZGB-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1ccsc1C[N@H+](C)Cc1cnc[nH]1 ZINC000349521645 386852041 /nfs/dbraw/zinc/85/20/41/386852041.db2.gz KQKVBXFYSASZGB-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1ccsc1C[N@@H+](C)Cc1cnc[nH]1 ZINC000349521645 386852044 /nfs/dbraw/zinc/85/20/44/386852044.db2.gz KQKVBXFYSASZGB-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO CCO[C@@H]1CCC[C@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000450932852 386852724 /nfs/dbraw/zinc/85/27/24/386852724.db2.gz CTJIXSCSROHEMR-VXGBXAGGSA-N 1 2 247.342 2.145 20 0 BEADLO CN(c1nc(N)c2ccccc2[nH+]1)C1CCC1 ZINC000301928814 386891656 /nfs/dbraw/zinc/89/16/56/386891656.db2.gz ZTLSVNRGFYLCNW-UHFFFAOYSA-N 1 2 228.299 2.201 20 0 BEADLO CC(C)c1nccnc1NCCCn1cc[nH+]c1 ZINC000349530196 386855152 /nfs/dbraw/zinc/85/51/52/386855152.db2.gz QOMJDHMPYDUUSC-UHFFFAOYSA-N 1 2 245.330 2.299 20 0 BEADLO O=[S@](CCC1CC1)Cc1cn2ccccc2[nH+]1 ZINC000358119243 386894149 /nfs/dbraw/zinc/89/41/49/386894149.db2.gz JPMCEDLIODMYEC-QGZVFWFLSA-N 1 2 248.351 2.383 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc2c(n1)CCC2 ZINC000334791905 386857890 /nfs/dbraw/zinc/85/78/90/386857890.db2.gz DXOPUUQDRXPNIQ-NEPJUHHUSA-N 1 2 246.354 2.180 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccc2c(n1)CCC2 ZINC000334791905 386857893 /nfs/dbraw/zinc/85/78/93/386857893.db2.gz DXOPUUQDRXPNIQ-NEPJUHHUSA-N 1 2 246.354 2.180 20 0 BEADLO Cn1c[nH+]cc1CN1Cc2cccc(F)c2C1 ZINC000334793063 386860172 /nfs/dbraw/zinc/86/01/72/386860172.db2.gz SSGOEYWFQDLWQV-UHFFFAOYSA-N 1 2 231.274 2.075 20 0 BEADLO Fc1cccc2c1C[N@H+](CC1=CCCOC1)C2 ZINC000334793290 386860917 /nfs/dbraw/zinc/86/09/17/386860917.db2.gz YKYSINGMLNVRHB-UHFFFAOYSA-N 1 2 233.286 2.488 20 0 BEADLO Fc1cccc2c1C[N@@H+](CC1=CCCOC1)C2 ZINC000334793290 386860921 /nfs/dbraw/zinc/86/09/21/386860921.db2.gz YKYSINGMLNVRHB-UHFFFAOYSA-N 1 2 233.286 2.488 20 0 BEADLO Cc1ccc(F)c(C[N@@H+]2CCO[C@@H](CF)C2)c1 ZINC000334828588 386865141 /nfs/dbraw/zinc/86/51/41/386865141.db2.gz IRLDLJQBQFMFTE-LBPRGKRZSA-N 1 2 241.281 2.304 20 0 BEADLO Cc1ccc(F)c(C[N@H+]2CCO[C@@H](CF)C2)c1 ZINC000334828588 386865148 /nfs/dbraw/zinc/86/51/48/386865148.db2.gz IRLDLJQBQFMFTE-LBPRGKRZSA-N 1 2 241.281 2.304 20 0 BEADLO CCN(CC)c1ncc(C[N@H+](C)CCF)s1 ZINC000293760367 386873745 /nfs/dbraw/zinc/87/37/45/386873745.db2.gz XQZZAZBURPQUEV-UHFFFAOYSA-N 1 2 245.367 2.391 20 0 BEADLO CCN(CC)c1ncc(C[N@@H+](C)CCF)s1 ZINC000293760367 386873751 /nfs/dbraw/zinc/87/37/51/386873751.db2.gz XQZZAZBURPQUEV-UHFFFAOYSA-N 1 2 245.367 2.391 20 0 BEADLO O=[S@@](CCC1CC1)Cc1cn2ccccc2[nH+]1 ZINC000358119242 386894611 /nfs/dbraw/zinc/89/46/11/386894611.db2.gz JPMCEDLIODMYEC-KRWDZBQOSA-N 1 2 248.351 2.383 20 0 BEADLO CC(C)(C)c1nc(N[C@H]2CC[C@H](O)CC2)cc[nH+]1 ZINC000301791508 386879172 /nfs/dbraw/zinc/87/91/72/386879172.db2.gz ZNXILNYAKASECC-XYPYZODXSA-N 1 2 249.358 2.490 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)Nc1ccc(C)c(F)c1 ZINC000335755644 386882572 /nfs/dbraw/zinc/88/25/72/386882572.db2.gz HUZRVRRZABPLPF-UHFFFAOYSA-N 1 2 247.273 2.347 20 0 BEADLO Fc1ccc(NCc2cn3ccccc3[nH+]2)nc1 ZINC000341348291 386887641 /nfs/dbraw/zinc/88/76/41/386887641.db2.gz AQQUHCZMEVNHSJ-UHFFFAOYSA-N 1 2 242.257 2.481 20 0 BEADLO CCn1c[nH+]cc1CN(C)[C@H](C)c1ccncc1 ZINC000418010646 386889812 /nfs/dbraw/zinc/88/98/12/386889812.db2.gz TXUXKBFKVQRGHH-GFCCVEGCSA-N 1 2 244.342 2.491 20 0 BEADLO c1cn(CCSCC2CCOCC2)c[nH+]1 ZINC000341498876 386915091 /nfs/dbraw/zinc/91/50/91/386915091.db2.gz OJJVBYJHWNPZQC-UHFFFAOYSA-N 1 2 226.345 2.043 20 0 BEADLO Cc1ccc(NC(=O)C[C@](C)(O)C2CC2)c(C)[nH+]1 ZINC000331774865 386900259 /nfs/dbraw/zinc/90/02/59/386900259.db2.gz BWLSKVFYIVXDRK-AWEZNQCLSA-N 1 2 248.326 2.188 20 0 BEADLO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2cnn(C)c2C)o1 ZINC000330832077 386901846 /nfs/dbraw/zinc/90/18/46/386901846.db2.gz HIIDERZVYYTKKK-UWVGGRQHSA-N 1 2 248.330 2.437 20 0 BEADLO Cc1cc(N2C[C@@H]3C[C@H]2CS3)nc(C2CC2)[nH+]1 ZINC000334818960 386947211 /nfs/dbraw/zinc/94/72/11/386947211.db2.gz PMUXEQXOUYQUFT-QWRGUYRKSA-N 1 2 247.367 2.357 20 0 BEADLO CO[C@H]1CC[C@H](Nc2cc[nH+]c(C3CC3)n2)C1 ZINC000302750101 386934510 /nfs/dbraw/zinc/93/45/10/386934510.db2.gz GRQGDPWUDBVZKK-QWRGUYRKSA-N 1 2 233.315 2.333 20 0 BEADLO C[N@H+](CCOCC1CCC1)Cc1nccs1 ZINC000341672567 386941598 /nfs/dbraw/zinc/94/15/98/386941598.db2.gz GYUSKYLHEUYZPK-UHFFFAOYSA-N 1 2 240.372 2.392 20 0 BEADLO C[N@@H+](CCOCC1CCC1)Cc1nccs1 ZINC000341672567 386941602 /nfs/dbraw/zinc/94/16/02/386941602.db2.gz GYUSKYLHEUYZPK-UHFFFAOYSA-N 1 2 240.372 2.392 20 0 BEADLO C[N@H+](CCOCC1CCC1)Cc1cscn1 ZINC000341682169 386941805 /nfs/dbraw/zinc/94/18/05/386941805.db2.gz YFFWBRZNPTVCQV-UHFFFAOYSA-N 1 2 240.372 2.392 20 0 BEADLO C[N@@H+](CCOCC1CCC1)Cc1cscn1 ZINC000341682169 386941808 /nfs/dbraw/zinc/94/18/08/386941808.db2.gz YFFWBRZNPTVCQV-UHFFFAOYSA-N 1 2 240.372 2.392 20 0 BEADLO Cc1cc(N[C@@H]2C[C@H]2c2ccco2)nc[nH+]1 ZINC000334817900 386944891 /nfs/dbraw/zinc/94/48/91/386944891.db2.gz APOZJNZDHPAXIW-NXEZZACHSA-N 1 2 215.256 2.346 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccccc1F)c1ncnn1C ZINC000352900511 386954370 /nfs/dbraw/zinc/95/43/70/386954370.db2.gz JLYZANGILBGZOB-VHSXEESVSA-N 1 2 248.305 2.366 20 0 BEADLO CC[C@H]([NH2+]C[C@@H]1CCCOC1)C(F)(F)F ZINC000336763245 386954632 /nfs/dbraw/zinc/95/46/32/386954632.db2.gz OTDWMZQJDWUADZ-IUCAKERBSA-N 1 2 225.254 2.344 20 0 BEADLO CC(C)(C)CCCC(=O)NCc1c[nH+]c[nH]1 ZINC000331069831 386954988 /nfs/dbraw/zinc/95/49/88/386954988.db2.gz CBBYMLYFQIMEGO-UHFFFAOYSA-N 1 2 223.320 2.242 20 0 BEADLO CC(C)(C)CCCC(=O)NCc1c[nH]c[nH+]1 ZINC000331069831 386954997 /nfs/dbraw/zinc/95/49/97/386954997.db2.gz CBBYMLYFQIMEGO-UHFFFAOYSA-N 1 2 223.320 2.242 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@]12CC[C@@H](C)[C@@H](C)C2 ZINC000639426717 386962276 /nfs/dbraw/zinc/96/22/76/386962276.db2.gz HRVRSMOYNMRFOT-UHIISALHSA-N 1 2 238.375 2.369 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+](C)Cc2cnccc2C)o1 ZINC000331102689 386964727 /nfs/dbraw/zinc/96/47/27/386964727.db2.gz CYGCTAZKOXUTNZ-SNVBAGLBSA-N 1 2 246.314 2.274 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+](C)Cc2cnccc2C)o1 ZINC000331102689 386964733 /nfs/dbraw/zinc/96/47/33/386964733.db2.gz CYGCTAZKOXUTNZ-SNVBAGLBSA-N 1 2 246.314 2.274 20 0 BEADLO CCCc1nc(C[N@H+](C)[C@@H](C)C(C)C)no1 ZINC000341833529 386970564 /nfs/dbraw/zinc/97/05/64/386970564.db2.gz HISPHKIJNIJMNT-JTQLQIEISA-N 1 2 225.336 2.498 20 0 BEADLO CCCc1nc(C[N@@H+](C)[C@@H](C)C(C)C)no1 ZINC000341833529 386970568 /nfs/dbraw/zinc/97/05/68/386970568.db2.gz HISPHKIJNIJMNT-JTQLQIEISA-N 1 2 225.336 2.498 20 0 BEADLO CCCc1nc(C[N@H+](C)[C@H](C)C(C)C)no1 ZINC000341833533 386971485 /nfs/dbraw/zinc/97/14/85/386971485.db2.gz HISPHKIJNIJMNT-SNVBAGLBSA-N 1 2 225.336 2.498 20 0 BEADLO CCCc1nc(C[N@@H+](C)[C@H](C)C(C)C)no1 ZINC000341833533 386971491 /nfs/dbraw/zinc/97/14/91/386971491.db2.gz HISPHKIJNIJMNT-SNVBAGLBSA-N 1 2 225.336 2.498 20 0 BEADLO CC[C@H]1CCC[C@@H]1c1nc(C[NH2+]C)no1 ZINC000332365743 386973571 /nfs/dbraw/zinc/97/35/71/386973571.db2.gz KOKUJKBYFWIHAB-IUCAKERBSA-N 1 2 209.293 2.083 20 0 BEADLO CCOc1nnc(C[N@H+](C)[C@H](C)C(C)C)s1 ZINC000341848525 386978394 /nfs/dbraw/zinc/97/83/94/386978394.db2.gz ZGXWJDDJRQQLRV-SECBINFHSA-N 1 2 243.376 2.413 20 0 BEADLO CCOc1nnc(C[N@@H+](C)[C@H](C)C(C)C)s1 ZINC000341848525 386978399 /nfs/dbraw/zinc/97/83/99/386978399.db2.gz ZGXWJDDJRQQLRV-SECBINFHSA-N 1 2 243.376 2.413 20 0 BEADLO CS[C@H]1CC[C@@H]1[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000425362117 386982364 /nfs/dbraw/zinc/98/23/64/386982364.db2.gz UDKXHUNQBHEXND-GUBZILKMSA-N 1 2 245.388 2.200 20 0 BEADLO Cc1cc(N2CC(C)=C[C@H](C)C2)nc[nH+]1 ZINC000334914746 386987115 /nfs/dbraw/zinc/98/71/15/386987115.db2.gz HTYGSMPKKOUQDZ-VIFPVBQESA-N 1 2 203.289 2.187 20 0 BEADLO Cc1[nH+]cccc1Cc1nc(C2(C)CC2)no1 ZINC000334914802 386990100 /nfs/dbraw/zinc/99/01/00/386990100.db2.gz XRIXKSWBKUNFBM-UHFFFAOYSA-N 1 2 229.283 2.415 20 0 BEADLO CC[C@H](NC(=O)[C@H](C)C(F)(F)F)c1[nH]cc[nH+]1 ZINC000331262854 387000004 /nfs/dbraw/zinc/00/00/04/387000004.db2.gz DXFRAGHNRQYXNA-BQBZGAKWSA-N 1 2 249.236 2.175 20 0 BEADLO C[N@H+](Cc1cccnc1)Cc1cncc(F)c1 ZINC000353055157 387033620 /nfs/dbraw/zinc/03/36/20/387033620.db2.gz DATIYEPFZCPXQG-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[N@@H+](Cc1cccnc1)Cc1cncc(F)c1 ZINC000353055157 387033622 /nfs/dbraw/zinc/03/36/22/387033622.db2.gz DATIYEPFZCPXQG-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[C@@]1(O)C[C@H](Nc2cc(C(F)(F)F)cc[nH+]2)C1 ZINC000334955788 387033800 /nfs/dbraw/zinc/03/38/00/387033800.db2.gz OPTJROPYUFDQJW-WAAGHKOSSA-N 1 2 246.232 2.426 20 0 BEADLO c1cc2[nH+]ccc(NC[C@H]3CC34CC4)c2cn1 ZINC000334968507 387053035 /nfs/dbraw/zinc/05/30/35/387053035.db2.gz QXRQBJVOLOGJQC-SNVBAGLBSA-N 1 2 225.295 2.264 20 0 BEADLO Nc1[nH+]cnc(NCC2CC(F)(F)C2)c1Cl ZINC000291992969 387059938 /nfs/dbraw/zinc/05/99/38/387059938.db2.gz YDDSKAMOJBMICP-UHFFFAOYSA-N 1 2 248.664 2.169 20 0 BEADLO Nc1nc[nH+]c(NCC2CC(F)(F)C2)c1Cl ZINC000291992969 387059942 /nfs/dbraw/zinc/05/99/42/387059942.db2.gz YDDSKAMOJBMICP-UHFFFAOYSA-N 1 2 248.664 2.169 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2cccc3c2OCCO3)C1 ZINC000336222895 387064286 /nfs/dbraw/zinc/06/42/86/387064286.db2.gz TXNZQQWGFUEKMW-LLVKDONJSA-N 1 2 237.274 2.002 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2cccc3c2OCCO3)C1 ZINC000336222895 387064289 /nfs/dbraw/zinc/06/42/89/387064289.db2.gz TXNZQQWGFUEKMW-LLVKDONJSA-N 1 2 237.274 2.002 20 0 BEADLO COC[C@H](C)[N@@H+]1CCn2c(cc3ccccc32)C1 ZINC000336029887 387009904 /nfs/dbraw/zinc/00/99/04/387009904.db2.gz CBSXLQXAJXVMFN-LBPRGKRZSA-N 1 2 244.338 2.492 20 0 BEADLO COC[C@H](C)[N@H+]1CCn2c(cc3ccccc32)C1 ZINC000336029887 387009906 /nfs/dbraw/zinc/00/99/06/387009906.db2.gz CBSXLQXAJXVMFN-LBPRGKRZSA-N 1 2 244.338 2.492 20 0 BEADLO CC[C@@H](NC(=O)C[C@@H](C)SC)c1[nH]cc[nH+]1 ZINC000331291784 387010861 /nfs/dbraw/zinc/01/08/61/387010861.db2.gz WTYFZJRAKQPPHW-RKDXNWHRSA-N 1 2 241.360 2.119 20 0 BEADLO CCCCCOC1C[NH+](Cc2cccnc2)C1 ZINC000358779831 387011458 /nfs/dbraw/zinc/01/14/58/387011458.db2.gz LCOYBMMRHXQULW-UHFFFAOYSA-N 1 2 234.343 2.473 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCC[C@H](CCC(N)=O)C1 ZINC000639470125 387015350 /nfs/dbraw/zinc/01/53/50/387015350.db2.gz KBXJELDRPCPZAG-SNVBAGLBSA-N 1 2 248.317 2.009 20 0 BEADLO CCC(F)(F)C[N@H+]1CCC[C@H](CCC(N)=O)C1 ZINC000639470125 387015353 /nfs/dbraw/zinc/01/53/53/387015353.db2.gz KBXJELDRPCPZAG-SNVBAGLBSA-N 1 2 248.317 2.009 20 0 BEADLO Cc1nc(C(F)F)n(Cc2c[nH+]ccc2C)n1 ZINC000334941134 387019232 /nfs/dbraw/zinc/01/92/32/387019232.db2.gz UGCDFOTZDOPYRE-UHFFFAOYSA-N 1 2 238.241 2.276 20 0 BEADLO COC(=O)[C@@H]([NH2+][C@@H]1CCCC(F)(F)C1)C1CC1 ZINC000358844630 387022407 /nfs/dbraw/zinc/02/24/07/387022407.db2.gz DLYRMPWFOJPRSF-ZJUUUORDSA-N 1 2 247.285 2.106 20 0 BEADLO c1cc(C[NH2+]Cc2nc3c(s2)CCCC3)on1 ZINC000648023177 387022671 /nfs/dbraw/zinc/02/26/71/387022671.db2.gz GIJOYZAPEMHJIC-UHFFFAOYSA-N 1 2 249.339 2.300 20 0 BEADLO Cc1cc(CNC(=O)N2CCC[C@@H]2C)cc(C)[nH+]1 ZINC000334985549 387074022 /nfs/dbraw/zinc/07/40/22/387074022.db2.gz FJMRPLBUCPFPRK-LBPRGKRZSA-N 1 2 247.342 2.392 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+]1Cc2ccccc2C2(CC2)C1 ZINC000186167696 387074820 /nfs/dbraw/zinc/07/48/20/387074820.db2.gz QIKZDVUNHRRVAJ-LLVKDONJSA-N 1 2 245.322 2.095 20 0 BEADLO COC(=O)[C@@H](C)[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000186167696 387074823 /nfs/dbraw/zinc/07/48/23/387074823.db2.gz QIKZDVUNHRRVAJ-LLVKDONJSA-N 1 2 245.322 2.095 20 0 BEADLO C[C@H]([NH2+]Cc1nnc2ccccn21)c1ccco1 ZINC000020185473 387077540 /nfs/dbraw/zinc/07/75/40/387077540.db2.gz KTJXJNRJIGGWPV-JTQLQIEISA-N 1 2 242.282 2.173 20 0 BEADLO Cc1cc(NCCc2cccc(F)c2F)nc[nH+]1 ZINC000352325216 387077914 /nfs/dbraw/zinc/07/79/14/387077914.db2.gz OUOBCEYNQPOECY-UHFFFAOYSA-N 1 2 249.264 2.140 20 0 BEADLO C[NH2+]Cc1noc(C(F)=C2CCCC2)n1 ZINC000333912896 387077968 /nfs/dbraw/zinc/07/79/68/387077968.db2.gz FQKULTLWECGPNS-UHFFFAOYSA-N 1 2 211.240 2.044 20 0 BEADLO CCc1nocc1CN(C)Cc1c[nH+]cn1CC ZINC000418067884 387082848 /nfs/dbraw/zinc/08/28/48/387082848.db2.gz PSLMAQOXNYTNQM-UHFFFAOYSA-N 1 2 248.330 2.085 20 0 BEADLO Cc1c(Cl)c(C[N@@H+]2C[C@@H]3CCC[C@@H]32)nn1C ZINC000334996435 387087947 /nfs/dbraw/zinc/08/79/47/387087947.db2.gz ZEZORBLNBQPGRS-ONGXEEELSA-N 1 2 239.750 2.366 20 0 BEADLO Cc1c(Cl)c(C[N@H+]2C[C@@H]3CCC[C@@H]32)nn1C ZINC000334996435 387087953 /nfs/dbraw/zinc/08/79/53/387087953.db2.gz ZEZORBLNBQPGRS-ONGXEEELSA-N 1 2 239.750 2.366 20 0 BEADLO CCc1nc(C[NH+]2[C@@H](C)CCC[C@@H]2C)no1 ZINC000066665443 387089285 /nfs/dbraw/zinc/08/92/85/387089285.db2.gz DADBCUDNYMLVKZ-UWVGGRQHSA-N 1 2 223.320 2.395 20 0 BEADLO C[C@H](C(=O)Nc1ccccc1)[N@@H+]1CC[C@H](F)C1 ZINC000336259614 387090793 /nfs/dbraw/zinc/09/07/93/387090793.db2.gz OSJPRSWSKOCETO-MNOVXSKESA-N 1 2 236.290 2.057 20 0 BEADLO C[C@H](C(=O)Nc1ccccc1)[N@H+]1CC[C@H](F)C1 ZINC000336259614 387090798 /nfs/dbraw/zinc/09/07/98/387090798.db2.gz OSJPRSWSKOCETO-MNOVXSKESA-N 1 2 236.290 2.057 20 0 BEADLO CS[C@@H]1CC[N@@H+]([C@@H](C)c2csnn2)C1 ZINC000336262128 387095073 /nfs/dbraw/zinc/09/50/73/387095073.db2.gz XKTXVAVRDPBKLB-JGVFFNPUSA-N 1 2 229.374 2.036 20 0 BEADLO Cc1cc(N2CC3(C[C@H]2C)CCOCC3)nc[nH+]1 ZINC000645381708 387095089 /nfs/dbraw/zinc/09/50/89/387095089.db2.gz GUZHTGPBFVJVBH-GFCCVEGCSA-N 1 2 247.342 2.180 20 0 BEADLO CS[C@@H]1CC[N@H+]([C@@H](C)c2csnn2)C1 ZINC000336262128 387095075 /nfs/dbraw/zinc/09/50/75/387095075.db2.gz XKTXVAVRDPBKLB-JGVFFNPUSA-N 1 2 229.374 2.036 20 0 BEADLO CS[C@@H]1CC[N@@H+]([C@H](C)c2csnn2)C1 ZINC000336262127 387095863 /nfs/dbraw/zinc/09/58/63/387095863.db2.gz XKTXVAVRDPBKLB-HTQZYQBOSA-N 1 2 229.374 2.036 20 0 BEADLO CS[C@@H]1CC[N@H+]([C@H](C)c2csnn2)C1 ZINC000336262127 387095865 /nfs/dbraw/zinc/09/58/65/387095865.db2.gz XKTXVAVRDPBKLB-HTQZYQBOSA-N 1 2 229.374 2.036 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@H](F)C2)c(C)s1 ZINC000336262572 387098056 /nfs/dbraw/zinc/09/80/56/387098056.db2.gz CBIBWMFKFXSWGL-VIFPVBQESA-N 1 2 214.309 2.304 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@H](F)C2)c(C)s1 ZINC000336262572 387098058 /nfs/dbraw/zinc/09/80/58/387098058.db2.gz CBIBWMFKFXSWGL-VIFPVBQESA-N 1 2 214.309 2.304 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CCC[C@](C)(F)C2)o1 ZINC000336268647 387102111 /nfs/dbraw/zinc/10/21/11/387102111.db2.gz ATPJPDMUZRBRDJ-KWQFWETISA-N 1 2 227.283 2.263 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CCC[C@](C)(F)C2)o1 ZINC000336268647 387102115 /nfs/dbraw/zinc/10/21/15/387102115.db2.gz ATPJPDMUZRBRDJ-KWQFWETISA-N 1 2 227.283 2.263 20 0 BEADLO C[NH2+]Cc1noc(C(C)=C2CCCC2)n1 ZINC000333949511 387104364 /nfs/dbraw/zinc/10/43/64/387104364.db2.gz XIUUVOPWHFYAIU-UHFFFAOYSA-N 1 2 207.277 2.137 20 0 BEADLO Cc1ccc(NC(=O)c2ccncc2F)c(C)[nH+]1 ZINC000119261887 387112006 /nfs/dbraw/zinc/11/20/06/387112006.db2.gz PTFDPQFINUTCDN-UHFFFAOYSA-N 1 2 245.257 2.485 20 0 BEADLO C[C@H](c1ccco1)[N@H+](C)CC(=O)NC(C)(C)C ZINC000069069567 387112247 /nfs/dbraw/zinc/11/22/47/387112247.db2.gz FIQRBEPHSPRIEP-SNVBAGLBSA-N 1 2 238.331 2.187 20 0 BEADLO C[C@H](c1ccco1)[N@@H+](C)CC(=O)NC(C)(C)C ZINC000069069567 387112254 /nfs/dbraw/zinc/11/22/54/387112254.db2.gz FIQRBEPHSPRIEP-SNVBAGLBSA-N 1 2 238.331 2.187 20 0 BEADLO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc[nH]n1 ZINC000336284538 387118672 /nfs/dbraw/zinc/11/86/72/387118672.db2.gz ZIXSULGYJOJFSA-IONNQARKSA-N 1 2 233.237 2.182 20 0 BEADLO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cc[nH]n1 ZINC000336284538 387118675 /nfs/dbraw/zinc/11/86/75/387118675.db2.gz ZIXSULGYJOJFSA-IONNQARKSA-N 1 2 233.237 2.182 20 0 BEADLO CCSCC[N@H+](CC(F)F)C1CC1 ZINC000119385391 387124776 /nfs/dbraw/zinc/12/47/76/387124776.db2.gz LGXJXQRNGKKHGV-UHFFFAOYSA-N 1 2 209.305 2.469 20 0 BEADLO CCSCC[N@@H+](CC(F)F)C1CC1 ZINC000119385391 387124780 /nfs/dbraw/zinc/12/47/80/387124780.db2.gz LGXJXQRNGKKHGV-UHFFFAOYSA-N 1 2 209.305 2.469 20 0 BEADLO C[C@H]([NH2+][C@H]1CCc2cn[nH]c2C1)c1cscn1 ZINC000336316316 387141488 /nfs/dbraw/zinc/14/14/88/387141488.db2.gz SOELHCXWCCPQKN-WPRPVWTQSA-N 1 2 248.355 2.074 20 0 BEADLO Cc1coc(SCc2[nH+]ccn2C)n1 ZINC000336317179 387143930 /nfs/dbraw/zinc/14/39/30/387143930.db2.gz HEKZSWTUTMQTDZ-UHFFFAOYSA-N 1 2 209.274 2.009 20 0 BEADLO COC1(CCNc2cc[nH+]c(C)n2)CCC1 ZINC000292784774 387145904 /nfs/dbraw/zinc/14/59/04/387145904.db2.gz MCQSDCMDWMGKJA-UHFFFAOYSA-N 1 2 221.304 2.156 20 0 BEADLO Cc1noc(CCC[N@@H+]2CCC[C@@H]2C(F)F)n1 ZINC000353170368 387147462 /nfs/dbraw/zinc/14/74/62/387147462.db2.gz GUKPVLFXOAGOAY-SECBINFHSA-N 1 2 245.273 2.040 20 0 BEADLO Cc1noc(CCC[N@H+]2CCC[C@@H]2C(F)F)n1 ZINC000353170368 387147467 /nfs/dbraw/zinc/14/74/67/387147467.db2.gz GUKPVLFXOAGOAY-SECBINFHSA-N 1 2 245.273 2.040 20 0 BEADLO FCCCC[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000352401186 387148452 /nfs/dbraw/zinc/14/84/52/387148452.db2.gz HCYQVHPIKITZHL-GFCCVEGCSA-N 1 2 248.305 2.233 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2ncc(C3CC3)o2)C1 ZINC000336324861 387152014 /nfs/dbraw/zinc/15/20/14/387152014.db2.gz LCWSWFHSTGFYOU-LBPRGKRZSA-N 1 2 224.279 2.486 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2ncc(C3CC3)o2)C1 ZINC000336324861 387152018 /nfs/dbraw/zinc/15/20/18/387152018.db2.gz LCWSWFHSTGFYOU-LBPRGKRZSA-N 1 2 224.279 2.486 20 0 BEADLO Cc1cc(N2CC[C@@H](CCO)C2)nc(C(C)C)[nH+]1 ZINC000229350839 387163986 /nfs/dbraw/zinc/16/39/86/387163986.db2.gz INCIZQCMJARJGG-LBPRGKRZSA-N 1 2 249.358 2.117 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cnccn2)c(C)n1 ZINC000187133748 387171019 /nfs/dbraw/zinc/17/10/19/387171019.db2.gz PSXSLKFYDUGMHE-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cnccn2)c(C)n1 ZINC000187133748 387171021 /nfs/dbraw/zinc/17/10/21/387171021.db2.gz PSXSLKFYDUGMHE-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cnc(C[N@@H+]2CCO[C@H](C(C)(C)C)C2)o1 ZINC000336349126 387178624 /nfs/dbraw/zinc/17/86/24/387178624.db2.gz IZWVCEAUZNYRCE-NSHDSACASA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cnc(C[N@H+]2CCO[C@H](C(C)(C)C)C2)o1 ZINC000336349126 387178628 /nfs/dbraw/zinc/17/86/28/387178628.db2.gz IZWVCEAUZNYRCE-NSHDSACASA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cnc(C[N@@H+]2CCO[C@@H](C(C)(C)C)C2)o1 ZINC000336349125 387179379 /nfs/dbraw/zinc/17/93/79/387179379.db2.gz IZWVCEAUZNYRCE-LLVKDONJSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cnc(C[N@H+]2CCO[C@@H](C(C)(C)C)C2)o1 ZINC000336349125 387179384 /nfs/dbraw/zinc/17/93/84/387179384.db2.gz IZWVCEAUZNYRCE-LLVKDONJSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1ccc(C[N@@H+](C)[C@H]2CCN(C3CC3)C2)o1 ZINC000353325935 387181418 /nfs/dbraw/zinc/18/14/18/387181418.db2.gz AUDDNZDLSPHDQF-ZDUSSCGKSA-N 1 2 234.343 2.257 20 0 BEADLO Cc1ccc(C[N@H+](C)[C@H]2CCN(C3CC3)C2)o1 ZINC000353325935 387181423 /nfs/dbraw/zinc/18/14/23/387181423.db2.gz AUDDNZDLSPHDQF-ZDUSSCGKSA-N 1 2 234.343 2.257 20 0 BEADLO CC[C@@H](NC(=O)CCc1[nH]cc[nH+]1)C(C)(C)C ZINC000353338663 387183409 /nfs/dbraw/zinc/18/34/09/387183409.db2.gz OZCWRLDJAMYTTA-SNVBAGLBSA-N 1 2 237.347 2.283 20 0 BEADLO Cc1cnc([C@H](C)[NH2+][C@@H](CO)c2ccccc2)o1 ZINC000359614119 387135264 /nfs/dbraw/zinc/13/52/64/387135264.db2.gz YAPUFSWYYGJWIG-AAEUAGOBSA-N 1 2 246.310 2.367 20 0 BEADLO CC[C@@H]1CC[C@@H](C)C[C@@H]1NCC(F)(F)C[NH3+] ZINC000423343913 387192243 /nfs/dbraw/zinc/19/22/43/387192243.db2.gz MHAOZFQTEUGWFI-MXWKQRLJSA-N 1 2 234.334 2.385 20 0 BEADLO CC[C@H](O)CNc1cc(C)[nH+]c(C(C)C)n1 ZINC000229994294 387210959 /nfs/dbraw/zinc/21/09/59/387210959.db2.gz BOPPFNOQUHXZRX-JTQLQIEISA-N 1 2 223.320 2.091 20 0 BEADLO CC(C)C(=O)NCc1cccc(-n2cc[nH+]c2)c1 ZINC000360014927 387213538 /nfs/dbraw/zinc/21/35/38/387213538.db2.gz FYNYYJMFZANMOQ-UHFFFAOYSA-N 1 2 243.310 2.145 20 0 BEADLO Cc1noc([C@@H]2CCC[N@@H+]2Cc2cnoc2C)n1 ZINC000353553981 387228793 /nfs/dbraw/zinc/22/87/93/387228793.db2.gz GUGDWPYTCTZOAR-NSHDSACASA-N 1 2 248.286 2.012 20 0 BEADLO Cc1noc([C@@H]2CCC[N@H+]2Cc2cnoc2C)n1 ZINC000353553981 387228798 /nfs/dbraw/zinc/22/87/98/387228798.db2.gz GUGDWPYTCTZOAR-NSHDSACASA-N 1 2 248.286 2.012 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC000336400762 387229585 /nfs/dbraw/zinc/22/95/85/387229585.db2.gz DLOXYURIZYCIRR-ZDUSSCGKSA-N 1 2 231.343 2.483 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC000336400762 387229590 /nfs/dbraw/zinc/22/95/90/387229590.db2.gz DLOXYURIZYCIRR-ZDUSSCGKSA-N 1 2 231.343 2.483 20 0 BEADLO C[C@@H]1CCCC[C@]1(C)NC(=O)Cc1c[nH+]cn1C ZINC000572095629 387235203 /nfs/dbraw/zinc/23/52/03/387235203.db2.gz KSKPVUMLTIUOFR-RISCZKNCSA-N 1 2 249.358 2.048 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C1=CCCC1 ZINC000336408160 387235522 /nfs/dbraw/zinc/23/55/22/387235522.db2.gz UZZRLVUOQZKEJW-UHFFFAOYSA-N 1 2 216.284 2.115 20 0 BEADLO Cc1nn(C(C)C)cc1C[N@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC000336421841 387253564 /nfs/dbraw/zinc/25/35/64/387253564.db2.gz KGNUFFXRSWEBBP-OKILXGFUSA-N 1 2 249.358 2.136 20 0 BEADLO Cc1nn(C(C)C)cc1C[N@@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC000336421841 387253567 /nfs/dbraw/zinc/25/35/67/387253567.db2.gz KGNUFFXRSWEBBP-OKILXGFUSA-N 1 2 249.358 2.136 20 0 BEADLO CO[C@@H](C)C[N@H+](CC(F)F)CC1CCC1 ZINC000360209331 387242638 /nfs/dbraw/zinc/24/26/38/387242638.db2.gz POVCDRQNYWXLAA-VIFPVBQESA-N 1 2 221.291 2.389 20 0 BEADLO CO[C@@H](C)C[N@@H+](CC(F)F)CC1CCC1 ZINC000360209331 387242645 /nfs/dbraw/zinc/24/26/45/387242645.db2.gz POVCDRQNYWXLAA-VIFPVBQESA-N 1 2 221.291 2.389 20 0 BEADLO Cc1noc([C@H](C)[NH2+]Cc2ccc(C)nc2C)n1 ZINC000360235138 387247252 /nfs/dbraw/zinc/24/72/52/387247252.db2.gz RYPFAMOJOXQWRG-JTQLQIEISA-N 1 2 246.314 2.241 20 0 BEADLO CC(C)[C@@H]1CCCC[C@@H]1NCC(F)(F)C[NH3+] ZINC000423347407 387197593 /nfs/dbraw/zinc/19/75/93/387197593.db2.gz QJJOGCOJFDDFOT-QWRGUYRKSA-N 1 2 234.334 2.385 20 0 BEADLO CC(C)[C@@H]1CCCC[C@H]1NCC(F)(F)C[NH3+] ZINC000423347408 387198208 /nfs/dbraw/zinc/19/82/08/387198208.db2.gz QJJOGCOJFDDFOT-WDEREUQCSA-N 1 2 234.334 2.385 20 0 BEADLO C[C@H](CC(=O)NCCCC1CC1)n1cc[nH+]c1 ZINC000572165665 387255981 /nfs/dbraw/zinc/25/59/81/387255981.db2.gz XTLKCHRQGZHYJU-LLVKDONJSA-N 1 2 235.331 2.141 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C[C@H](C)SC ZINC000161821470 387271894 /nfs/dbraw/zinc/27/18/94/387271894.db2.gz OIJWPISVQVAWLT-QMMMGPOBSA-N 1 2 240.328 2.170 20 0 BEADLO CC[C@@H](C)C(=O)N1CC[C@H](Oc2cc[nH+]cc2)C1 ZINC000120896611 387279314 /nfs/dbraw/zinc/27/93/14/387279314.db2.gz KGWAIDHJWZTTPJ-YPMHNXCESA-N 1 2 248.326 2.107 20 0 BEADLO CCOCCC1(CNc2nc(C)[nH+]cc2C)CC1 ZINC000572257244 387287898 /nfs/dbraw/zinc/28/78/98/387287898.db2.gz JNEMZZZICSPDMN-UHFFFAOYSA-N 1 2 249.358 2.134 20 0 BEADLO C[C@H]1c2ccccc2CN1Cc1[nH]cc[nH+]1 ZINC000353862638 387288313 /nfs/dbraw/zinc/28/83/13/387288313.db2.gz DRYJWEXDCPCSPY-JTQLQIEISA-N 1 2 213.284 2.487 20 0 BEADLO C[C@@H]([NH2+]Cc1[nH]ncc1Br)C1CC1 ZINC000379403971 387307369 /nfs/dbraw/zinc/30/73/69/387307369.db2.gz QLXXMNWBOZUKHH-ZCFIWIBFSA-N 1 2 244.136 2.060 20 0 BEADLO C[C@@]1(O)CCC[N@H+](Cc2ncc(Cl)s2)C1 ZINC000336533397 387354860 /nfs/dbraw/zinc/35/48/60/387354860.db2.gz XXVUKPYELNVTJS-SNVBAGLBSA-N 1 2 246.763 2.143 20 0 BEADLO C[C@@]1(O)CCC[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000336533397 387354864 /nfs/dbraw/zinc/35/48/64/387354864.db2.gz XXVUKPYELNVTJS-SNVBAGLBSA-N 1 2 246.763 2.143 20 0 BEADLO Cc1cnc(C[N@@H+]2CCSC(C)(C)C2)nc1 ZINC000336553760 387375047 /nfs/dbraw/zinc/37/50/47/387375047.db2.gz NOQLYSPPQFZBMG-UHFFFAOYSA-N 1 2 237.372 2.112 20 0 BEADLO Cc1cnc(C[N@H+]2CCSC(C)(C)C2)nc1 ZINC000336553760 387375052 /nfs/dbraw/zinc/37/50/52/387375052.db2.gz NOQLYSPPQFZBMG-UHFFFAOYSA-N 1 2 237.372 2.112 20 0 BEADLO Cn1ccnc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000336553384 387375150 /nfs/dbraw/zinc/37/51/50/387375150.db2.gz YHDJEJXEAPGEGO-ZDUSSCGKSA-N 1 2 227.311 2.367 20 0 BEADLO Cn1ccnc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000336553384 387375155 /nfs/dbraw/zinc/37/51/55/387375155.db2.gz YHDJEJXEAPGEGO-ZDUSSCGKSA-N 1 2 227.311 2.367 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H]1C[C@H](c2ccccc2)[C@@H]1C ZINC000373491671 387375948 /nfs/dbraw/zinc/37/59/48/387375948.db2.gz XBLAYPWFCOLABJ-UZGDPCLZSA-N 1 2 247.338 2.330 20 0 BEADLO Cc1cnc(C[NH+]2CCC(C(F)F)CC2)nc1 ZINC000336555687 387380131 /nfs/dbraw/zinc/38/01/31/387380131.db2.gz VOLZJDZPVJMXEA-UHFFFAOYSA-N 1 2 241.285 2.262 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@H](OCC2CC2)C1 ZINC000373536426 387381118 /nfs/dbraw/zinc/38/11/18/387381118.db2.gz WGIVJRBQFVLEFT-AWEZNQCLSA-N 1 2 249.358 2.109 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@H](OCC2CC2)C1 ZINC000373536426 387381122 /nfs/dbraw/zinc/38/11/22/387381122.db2.gz WGIVJRBQFVLEFT-AWEZNQCLSA-N 1 2 249.358 2.109 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2CO[C@H](C)C2)c(C)[nH+]1 ZINC000336502368 387327075 /nfs/dbraw/zinc/32/70/75/387327075.db2.gz BETSMAVZQSCZPF-KOLCDFICSA-N 1 2 234.299 2.062 20 0 BEADLO Cc1ccc(NCc2cn(C(C)C)nn2)c(C)[nH+]1 ZINC000286751755 387340624 /nfs/dbraw/zinc/34/06/24/387340624.db2.gz GVUNSIGOFKJGIS-UHFFFAOYSA-N 1 2 245.330 2.483 20 0 BEADLO COc1ccc(C[NH2+][C@H](C)c2cscn2)cn1 ZINC000162346291 387344318 /nfs/dbraw/zinc/34/43/18/387344318.db2.gz USEBZEKCWDHUCT-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO CC[C@@H](NC(=O)Cc1ccc(C)o1)c1[nH]cc[nH+]1 ZINC000525952506 387344547 /nfs/dbraw/zinc/34/45/47/387344547.db2.gz DVXYZEMFGGZZOZ-LLVKDONJSA-N 1 2 247.298 2.121 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)[C@H]1CCC(C)(C)C1 ZINC000336559019 387383735 /nfs/dbraw/zinc/38/37/35/387383735.db2.gz DJFFDCVBWUOSQZ-JTQLQIEISA-N 1 2 235.331 2.194 20 0 BEADLO CCC[C@@H]1C[C@@H]1c1nc(Cc2c[nH+]cn2C)no1 ZINC000361260657 387427302 /nfs/dbraw/zinc/42/73/02/387427302.db2.gz HTEJIKGBASUNOL-KOLCDFICSA-N 1 2 246.314 2.298 20 0 BEADLO C[N@H+](CCCO[C@@H]1CCCCO1)CC(F)F ZINC000361273705 387429026 /nfs/dbraw/zinc/42/90/26/387429026.db2.gz OYQXTJJAIYIASB-LLVKDONJSA-N 1 2 237.290 2.117 20 0 BEADLO C[N@@H+](CCCO[C@@H]1CCCCO1)CC(F)F ZINC000361273705 387429033 /nfs/dbraw/zinc/42/90/33/387429033.db2.gz OYQXTJJAIYIASB-LLVKDONJSA-N 1 2 237.290 2.117 20 0 BEADLO CC[C@]1(C)CCN(c2cc[nH+]c(C)n2)C1 ZINC000336603987 387447557 /nfs/dbraw/zinc/44/75/57/387447557.db2.gz BSLISDQBZIBALV-GFCCVEGCSA-N 1 2 205.305 2.411 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1CCO[C@H](C2CC2)C1 ZINC000572900070 387462116 /nfs/dbraw/zinc/46/21/16/387462116.db2.gz UNTIUPDXJFIRQC-STQMWFEESA-N 1 2 247.342 2.463 20 0 BEADLO CCCCCC(=O)N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000374381449 387448479 /nfs/dbraw/zinc/44/84/79/387448479.db2.gz URFQHYFRSCLYOB-GFCCVEGCSA-N 1 2 249.358 2.316 20 0 BEADLO CC(C)(C)C(C)(C)NC(=O)CCc1c[nH+]c[nH]1 ZINC000350768099 387457614 /nfs/dbraw/zinc/45/76/14/387457614.db2.gz OGZDKAAMXQNOJE-UHFFFAOYSA-N 1 2 237.347 2.283 20 0 BEADLO CC(C)(C)C(C)(C)NC(=O)CCc1c[nH]c[nH+]1 ZINC000350768099 387457619 /nfs/dbraw/zinc/45/76/19/387457619.db2.gz OGZDKAAMXQNOJE-UHFFFAOYSA-N 1 2 237.347 2.283 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1Cc2ccccc21 ZINC000336562656 387389051 /nfs/dbraw/zinc/38/90/51/387389051.db2.gz HJHNDHRXIXGLJQ-CYBMUJFWSA-N 1 2 238.290 2.090 20 0 BEADLO COc1c(O)cccc1C[N@H+](C)Cc1ccc[nH]1 ZINC000352628044 387390174 /nfs/dbraw/zinc/39/01/74/387390174.db2.gz HWQHBVYIKZUSFH-UHFFFAOYSA-N 1 2 246.310 2.361 20 0 BEADLO COc1c(O)cccc1C[N@@H+](C)Cc1ccc[nH]1 ZINC000352628044 387390179 /nfs/dbraw/zinc/39/01/79/387390179.db2.gz HWQHBVYIKZUSFH-UHFFFAOYSA-N 1 2 246.310 2.361 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)C/C=C\c1ccccc1 ZINC000361194518 387414910 /nfs/dbraw/zinc/41/49/10/387414910.db2.gz TWBGSDMWOHBARQ-UMAGTOLTSA-N 1 2 233.311 2.193 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)C/C=C\c1ccccc1 ZINC000361194518 387414915 /nfs/dbraw/zinc/41/49/15/387414915.db2.gz TWBGSDMWOHBARQ-UMAGTOLTSA-N 1 2 233.311 2.193 20 0 BEADLO COC(=O)[C@@H](C1CC1)[N@@H+]1Cc2ccc(C)cc2C1 ZINC000361592316 387505184 /nfs/dbraw/zinc/50/51/84/387505184.db2.gz BUJXSZIYMBAARU-CQSZACIVSA-N 1 2 245.322 2.262 20 0 BEADLO COC(=O)[C@@H](C1CC1)[N@H+]1Cc2ccc(C)cc2C1 ZINC000361592316 387505193 /nfs/dbraw/zinc/50/51/93/387505193.db2.gz BUJXSZIYMBAARU-CQSZACIVSA-N 1 2 245.322 2.262 20 0 BEADLO C[C@@H]1C[C@H]1CC(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000355499158 387543247 /nfs/dbraw/zinc/54/32/47/387543247.db2.gz AYOSRZJPNGSJOI-OUAUKWLOSA-N 1 2 233.315 2.119 20 0 BEADLO Cn1nccc1C[N@H+](C)Cc1ccc(Cl)o1 ZINC000355275232 387509186 /nfs/dbraw/zinc/50/91/86/387509186.db2.gz DDEDEDQYWASSKT-UHFFFAOYSA-N 1 2 239.706 2.299 20 0 BEADLO Cn1nccc1C[N@@H+](C)Cc1ccc(Cl)o1 ZINC000355275232 387509192 /nfs/dbraw/zinc/50/91/92/387509192.db2.gz DDEDEDQYWASSKT-UHFFFAOYSA-N 1 2 239.706 2.299 20 0 BEADLO COc1ccc[nH+]c1NC1CCSCC1 ZINC000162730866 387509441 /nfs/dbraw/zinc/50/94/41/387509441.db2.gz ZHMWUUUCGIJCOE-UHFFFAOYSA-N 1 2 224.329 2.398 20 0 BEADLO CCCCOC1CC[NH+](Cc2ncccn2)CC1 ZINC000361838300 387543528 /nfs/dbraw/zinc/54/35/28/387543528.db2.gz SDPURTSDGKCYAV-UHFFFAOYSA-N 1 2 249.358 2.258 20 0 BEADLO C[C@H](CC(C)(C)C)C(=O)NCc1[nH+]ccn1C ZINC000355294443 387514496 /nfs/dbraw/zinc/51/44/96/387514496.db2.gz QEVHQCDAKFIVHC-SNVBAGLBSA-N 1 2 237.347 2.109 20 0 BEADLO CCO[C@@H](C)c1nccn1CCCn1cc[nH+]c1 ZINC000122097821 387466201 /nfs/dbraw/zinc/46/62/01/387466201.db2.gz SSDVWMAMFPLZEC-LBPRGKRZSA-N 1 2 248.330 2.267 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N3C[C@H](C)[C@H]3C)ccn12 ZINC000516193666 387473086 /nfs/dbraw/zinc/47/30/86/387473086.db2.gz WFOGKAQFMUUCMT-GXSJLCMTSA-N 1 2 243.310 2.123 20 0 BEADLO Cc1cn2c([nH+]1)CN(Cc1ccc(F)cc1)CC2 ZINC000374641944 387475861 /nfs/dbraw/zinc/47/58/61/387475861.db2.gz BNMLRGKGJUVKFT-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO CO[C@@H]1CCCN(c2cccc[nH+]2)CC1 ZINC000374647918 387476153 /nfs/dbraw/zinc/47/61/53/387476153.db2.gz PGHKQAZNKDIQCL-LLVKDONJSA-N 1 2 206.289 2.087 20 0 BEADLO CC[C@@H](C)[C@H](C)C(=O)N1CCn2cc(C)[nH+]c2C1 ZINC000374673424 387480962 /nfs/dbraw/zinc/48/09/62/387480962.db2.gz AMPRRKSDWOIAFY-PWSUYJOCSA-N 1 2 249.358 2.216 20 0 BEADLO O=C(C[C@@H]1C=CCC1)NCCCCn1cc[nH+]c1 ZINC000516268116 387489805 /nfs/dbraw/zinc/48/98/05/387489805.db2.gz AFEYQJDKVHVSSY-CYBMUJFWSA-N 1 2 247.342 2.136 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)Cc1ccoc1 ZINC000123637842 387587768 /nfs/dbraw/zinc/58/77/68/387587768.db2.gz VMMDERYQQCRXMI-UHFFFAOYSA-N 1 2 216.240 2.164 20 0 BEADLO CC(C)n1ccnc1C[N@@H+]1CCOCC[C@H]1C ZINC000362239022 387588148 /nfs/dbraw/zinc/58/81/48/387588148.db2.gz RQLHCQFZVKHNJV-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccnc1C[N@H+]1CCOCC[C@H]1C ZINC000362239022 387588153 /nfs/dbraw/zinc/58/81/53/387588153.db2.gz RQLHCQFZVKHNJV-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO COC1(C)C[NH+](Cc2ccc(F)cc2)C1 ZINC000362324947 387596581 /nfs/dbraw/zinc/59/65/81/387596581.db2.gz QZNVDLSZUJMBGP-UHFFFAOYSA-N 1 2 209.264 2.046 20 0 BEADLO Cc1cc(N[C@@H]2C[C@@H]2C2CC2)nc(C2CC2)[nH+]1 ZINC000362375618 387604448 /nfs/dbraw/zinc/60/44/48/387604448.db2.gz KGPFVSCHQRMFOD-VXGBXAGGSA-N 1 2 229.327 2.295 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1C[C@H]1C(C)C ZINC000356221097 387629132 /nfs/dbraw/zinc/62/91/32/387629132.db2.gz OLWIXIGNWRAQMO-NWDGAFQWSA-N 1 2 232.327 2.297 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)CCCC(F)(F)F ZINC000356029082 387608566 /nfs/dbraw/zinc/60/85/66/387608566.db2.gz NVNSVWTWTWWXEW-UHFFFAOYSA-N 1 2 249.236 2.101 20 0 BEADLO CC(C)(C)[C@@H]1CCN(C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000356041242 387609816 /nfs/dbraw/zinc/60/98/16/387609816.db2.gz QZPCMANSKPHOST-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO COC(=O)c1ccccc1COc1cc[nH+]cc1 ZINC000356088469 387616062 /nfs/dbraw/zinc/61/60/62/387616062.db2.gz FGDHYTTUFLSQAW-UHFFFAOYSA-N 1 2 243.262 2.447 20 0 BEADLO Cc1ccc(NC(=O)COc2cc[nH+]cc2)cc1 ZINC000356088467 387616822 /nfs/dbraw/zinc/61/68/22/387616822.db2.gz FFFZPBJQTBKHGZ-UHFFFAOYSA-N 1 2 242.278 2.408 20 0 BEADLO c1c[nH+]c(-c2ccc3c(c2)CCOC3)[nH]1 ZINC000527533871 387624485 /nfs/dbraw/zinc/62/44/85/387624485.db2.gz QIOASJQYELEHCY-UHFFFAOYSA-N 1 2 200.241 2.149 20 0 BEADLO C[C@H](Nc1cc[nH+]c(C2CC2)n1)[C@H]1CCCOC1 ZINC000355568910 387553181 /nfs/dbraw/zinc/55/31/81/387553181.db2.gz SKELKIDFCAOJKO-JQWIXIFHSA-N 1 2 247.342 2.003 20 0 BEADLO Cc1ccncc1C[N@H+](C)Cc1cncs1 ZINC000355581425 387553759 /nfs/dbraw/zinc/55/37/59/387553759.db2.gz IOOYAOYYUGTULC-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ccncc1C[N@@H+](C)Cc1cncs1 ZINC000355581425 387553764 /nfs/dbraw/zinc/55/37/64/387553764.db2.gz IOOYAOYYUGTULC-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO FCCCC[N@@H+]1CCOC[C@H]1c1ccco1 ZINC000375687733 387566376 /nfs/dbraw/zinc/56/63/76/387566376.db2.gz GZAYVQSZFUMTLF-NSHDSACASA-N 1 2 227.279 2.403 20 0 BEADLO FCCCC[N@H+]1CCOC[C@H]1c1ccco1 ZINC000375687733 387566378 /nfs/dbraw/zinc/56/63/78/387566378.db2.gz GZAYVQSZFUMTLF-NSHDSACASA-N 1 2 227.279 2.403 20 0 BEADLO C[C@H](CC(=O)NCc1[nH]cc[nH+]1)c1ccccc1 ZINC000114124738 387567376 /nfs/dbraw/zinc/56/73/76/387567376.db2.gz MTQCAXRYBMNGDX-LLVKDONJSA-N 1 2 243.310 2.220 20 0 BEADLO CC(C)c1nc(N[C@H]2CCO[C@H]2C2CC2)cc[nH+]1 ZINC000363163204 387694614 /nfs/dbraw/zinc/69/46/14/387694614.db2.gz UJXCVMWNNPICLM-AAEUAGOBSA-N 1 2 247.342 2.001 20 0 BEADLO C(c1nnc(C2CC2)n1C1CC1)[NH+]1CCCCC1 ZINC000125882785 387666899 /nfs/dbraw/zinc/66/68/99/387666899.db2.gz ONKISJLYNGPXJB-UHFFFAOYSA-N 1 2 246.358 2.476 20 0 BEADLO Cn1c2cc(F)ccc2[nH]c1=[NH+]CC1CCC1 ZINC000431035188 387672213 /nfs/dbraw/zinc/67/22/13/387672213.db2.gz QYXMAIXDBOBYHW-UHFFFAOYSA-N 1 2 233.290 2.346 20 0 BEADLO CC[C@H](F)CN1CC[N@H+](C[C@@H](F)CC)C[C@@H]1C ZINC000440768661 387688280 /nfs/dbraw/zinc/68/82/80/387688280.db2.gz ZXLIGMBOLTUARW-AVGNSLFASA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@H](F)CN1CC[N@@H+](C[C@@H](F)CC)C[C@@H]1C ZINC000440768661 387688287 /nfs/dbraw/zinc/68/82/87/387688287.db2.gz ZXLIGMBOLTUARW-AVGNSLFASA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@H](F)CN1CC[N@H+](C[C@@H](F)CC)[C@@H](C)C1 ZINC000440768661 387688292 /nfs/dbraw/zinc/68/82/92/387688292.db2.gz ZXLIGMBOLTUARW-AVGNSLFASA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@H](F)CN1CC[N@@H+](C[C@@H](F)CC)[C@@H](C)C1 ZINC000440768661 387688295 /nfs/dbraw/zinc/68/82/95/387688295.db2.gz ZXLIGMBOLTUARW-AVGNSLFASA-N 1 2 248.361 2.489 20 0 BEADLO FC1(F)COCC[N@H+](C[C@@H]2CC=CCC2)C1 ZINC000367682857 387744744 /nfs/dbraw/zinc/74/47/44/387744744.db2.gz HHJAFAHPANVWTE-LLVKDONJSA-N 1 2 231.286 2.310 20 0 BEADLO FC1(F)COCC[N@@H+](C[C@@H]2CC=CCC2)C1 ZINC000367682857 387744751 /nfs/dbraw/zinc/74/47/51/387744751.db2.gz HHJAFAHPANVWTE-LLVKDONJSA-N 1 2 231.286 2.310 20 0 BEADLO Cc1cn[nH]c1C[NH2+][C@@H](C)c1ncccc1F ZINC000527827736 387747828 /nfs/dbraw/zinc/74/78/28/387747828.db2.gz IMPUOUCHCAXIOW-VIFPVBQESA-N 1 2 234.278 2.103 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@@H](C)c1ncccc1F ZINC000527827736 387747836 /nfs/dbraw/zinc/74/78/36/387747836.db2.gz IMPUOUCHCAXIOW-VIFPVBQESA-N 1 2 234.278 2.103 20 0 BEADLO COc1ccc[nH+]c1N(C)Cc1ccco1 ZINC000527827573 387748258 /nfs/dbraw/zinc/74/82/58/387748258.db2.gz GCNLZLZTZRGRDL-UHFFFAOYSA-N 1 2 218.256 2.320 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC[C@H]1CC[C@@H](C)C1 ZINC000521459026 387749299 /nfs/dbraw/zinc/74/92/99/387749299.db2.gz PZAYMWGBYMXXDH-UTUOFQBUSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC[C@H]1CC[C@@H](C)C1 ZINC000521459026 387749308 /nfs/dbraw/zinc/74/93/08/387749308.db2.gz PZAYMWGBYMXXDH-UTUOFQBUSA-N 1 2 249.358 2.141 20 0 BEADLO Cc1cnc(C[N@H+]2CCC(F)(F)C[C@@H]2C)nc1 ZINC000528772868 387706865 /nfs/dbraw/zinc/70/68/65/387706865.db2.gz NKQWRCMVCWFUGB-JTQLQIEISA-N 1 2 241.285 2.405 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC(F)(F)C[C@@H]2C)nc1 ZINC000528772868 387706870 /nfs/dbraw/zinc/70/68/70/387706870.db2.gz NKQWRCMVCWFUGB-JTQLQIEISA-N 1 2 241.285 2.405 20 0 BEADLO CCCOc1cncc(NCc2[nH]cc[nH+]2)c1 ZINC000527782445 387709233 /nfs/dbraw/zinc/70/92/33/387709233.db2.gz XXMHKJWPADDPBQ-UHFFFAOYSA-N 1 2 232.287 2.206 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2nccs2)C1 ZINC000306784362 387711161 /nfs/dbraw/zinc/71/11/61/387711161.db2.gz HQIYHDZEGPRZIV-VIFPVBQESA-N 1 2 200.282 2.077 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2nccs2)C1 ZINC000306784362 387711165 /nfs/dbraw/zinc/71/11/65/387711165.db2.gz HQIYHDZEGPRZIV-VIFPVBQESA-N 1 2 200.282 2.077 20 0 BEADLO COc1ccc[nH+]c1N(C)CCc1ccncc1 ZINC000527865252 387736963 /nfs/dbraw/zinc/73/69/63/387736963.db2.gz NCDVOHBBJGDIGH-UHFFFAOYSA-N 1 2 243.310 2.164 20 0 BEADLO O=[S@]1CC[C@@H](Nc2[nH+]ccc3ccccc32)C1 ZINC000527908684 387764233 /nfs/dbraw/zinc/76/42/33/387764233.db2.gz FYMSBVXMZFVUOH-DIFFPNOSSA-N 1 2 246.335 2.168 20 0 BEADLO COC[C@H]1CCN1c1cc(C)[nH+]c(C(C)C)n1 ZINC000432170621 387769298 /nfs/dbraw/zinc/76/92/98/387769298.db2.gz TXUUPFNBUAOCFY-LLVKDONJSA-N 1 2 235.331 2.134 20 0 BEADLO Cc1cc(NC(=O)NC[C@H]2CC[C@@H](C)C2)cc[nH+]1 ZINC000432269451 387779280 /nfs/dbraw/zinc/77/92/80/387779280.db2.gz JLRJMOIRBMUZNA-PWSUYJOCSA-N 1 2 247.342 2.370 20 0 BEADLO CC[C@H](COC)Nc1cc[nH+]c(C2CC2)n1 ZINC000150916474 387780725 /nfs/dbraw/zinc/78/07/25/387780725.db2.gz NQODFCDOTKZFRV-SNVBAGLBSA-N 1 2 221.304 2.191 20 0 BEADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cocn2)on1 ZINC000432744922 387812837 /nfs/dbraw/zinc/81/28/37/387812837.db2.gz OPTLKDXSTWTYBZ-NSHDSACASA-N 1 2 233.271 2.308 20 0 BEADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cocn2)on1 ZINC000432744922 387812839 /nfs/dbraw/zinc/81/28/39/387812839.db2.gz OPTLKDXSTWTYBZ-NSHDSACASA-N 1 2 233.271 2.308 20 0 BEADLO CNc1nc(-c2ccncc2)[nH+]c(C)c1C ZINC000050864066 387795320 /nfs/dbraw/zinc/79/53/20/387795320.db2.gz HYJRUYPNDWKJPF-UHFFFAOYSA-N 1 2 214.272 2.197 20 0 BEADLO COc1ccc[nH+]c1N1CCc2ncsc2C1 ZINC000527979562 387798387 /nfs/dbraw/zinc/79/83/87/387798387.db2.gz KWRVBCGXVHHLPC-UHFFFAOYSA-N 1 2 247.323 2.109 20 0 BEADLO COc1ccc[nH+]c1N1CCC[C@](C)(OC)C1 ZINC000527991231 387806088 /nfs/dbraw/zinc/80/60/88/387806088.db2.gz AHEICDXOWPUTAP-ZDUSSCGKSA-N 1 2 236.315 2.096 20 0 BEADLO Cc1cnc(SCc2cc[nH+]c(N)c2)nc1 ZINC000052756626 387807876 /nfs/dbraw/zinc/80/78/76/387807876.db2.gz UNAMCZQHLIIOIU-UHFFFAOYSA-N 1 2 232.312 2.055 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1CCC(C)(C)O1 ZINC000527968276 387811635 /nfs/dbraw/zinc/81/16/35/387811635.db2.gz QUCYVBXPURAXGO-SNVBAGLBSA-N 1 2 236.315 2.460 20 0 BEADLO COCCN(C)c1[nH+]ccc2ccccc21 ZINC000527857036 387758310 /nfs/dbraw/zinc/75/83/10/387758310.db2.gz ZAZOSDHAZDGFDQ-UHFFFAOYSA-N 1 2 216.284 2.317 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ncccc1F)c1ccn(C)n1 ZINC000528037142 387819912 /nfs/dbraw/zinc/81/99/12/387819912.db2.gz DGQJWZBZMYIOPD-UWVGGRQHSA-N 1 2 248.305 2.366 20 0 BEADLO COc1ccc[nH+]c1NCCc1cc(C)no1 ZINC000528018916 387825228 /nfs/dbraw/zinc/82/52/28/387825228.db2.gz QUPFLLNEMPKATD-UHFFFAOYSA-N 1 2 233.271 2.041 20 0 BEADLO CC(C)CC1(C(=O)N(C)Cc2[nH]cc[nH+]2)CC1 ZINC000442732635 387833032 /nfs/dbraw/zinc/83/30/32/387833032.db2.gz WRMWLMUCNBYHLE-UHFFFAOYSA-N 1 2 235.331 2.194 20 0 BEADLO COc1ccc[nH+]c1N1CCC[C@]2(CCOC2)C1 ZINC000528030383 387833480 /nfs/dbraw/zinc/83/34/80/387833480.db2.gz MZNCSGQJDSXUCP-AWEZNQCLSA-N 1 2 248.326 2.097 20 0 BEADLO CC[C@H](NC(=O)[C@H]1C[C@H]1C(C)C)c1[nH]cc[nH+]1 ZINC000442814114 387845521 /nfs/dbraw/zinc/84/55/21/387845521.db2.gz UVJCBFRTVFHUSZ-DCAQKATOSA-N 1 2 235.331 2.269 20 0 BEADLO CC[C@H](NC(=O)[C@@H]1C[C@]1(C)CC)c1[nH]cc[nH+]1 ZINC000442814514 387847012 /nfs/dbraw/zinc/84/70/12/387847012.db2.gz VAEYBUFQMCZHEV-KWBADKCTSA-N 1 2 235.331 2.413 20 0 BEADLO CC[C@@H]1CCC[C@H]1CNC(=O)c1c[nH+]c(C)[nH]1 ZINC000452531383 387849693 /nfs/dbraw/zinc/84/96/93/387849693.db2.gz QLOVILFJUKSFHZ-MNOVXSKESA-N 1 2 235.331 2.274 20 0 BEADLO CCO[C@@]1(C)C[C@H]1Nc1cc(NC2CC2)[nH+]cn1 ZINC000528155411 387857230 /nfs/dbraw/zinc/85/72/30/387857230.db2.gz GMDAYYIAYVNQDL-MFKMUULPSA-N 1 2 248.330 2.030 20 0 BEADLO CCO[C@@]1(C)C[C@H]1Nc1cc(NC2CC2)nc[nH+]1 ZINC000528155411 387857235 /nfs/dbraw/zinc/85/72/35/387857235.db2.gz GMDAYYIAYVNQDL-MFKMUULPSA-N 1 2 248.330 2.030 20 0 BEADLO CC(C)n1c[nH+]cc1CN[C@@H](C)c1ccon1 ZINC000424170657 387861606 /nfs/dbraw/zinc/86/16/06/387861606.db2.gz KJXDLIQJNVSRQI-JTQLQIEISA-N 1 2 234.303 2.303 20 0 BEADLO CCC(CC)CC(=O)NCc1[nH+]ccn1CC ZINC000452571799 387862772 /nfs/dbraw/zinc/86/27/72/387862772.db2.gz PWMKETZZEUQOIH-UHFFFAOYSA-N 1 2 237.347 2.346 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@H]1CC[C@H](C)CC1 ZINC000582611801 387865200 /nfs/dbraw/zinc/86/52/00/387865200.db2.gz KNMTUEFRDFTJQJ-HAQNSBGRSA-N 1 2 249.358 2.346 20 0 BEADLO CC(C)c1nc(N[C@H]2[C@@H](C)[C@H](C)O[C@H]2C)cc[nH+]1 ZINC000528204671 387869687 /nfs/dbraw/zinc/86/96/87/387869687.db2.gz IPTYNTPQDIGINW-ZPFDUUQYSA-N 1 2 249.358 2.246 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)[C@@]1(C)CCC[C@@H]1C ZINC000448708879 387893620 /nfs/dbraw/zinc/89/36/20/387893620.db2.gz NDWODINSWLSBIO-SCRDCRAPSA-N 1 2 249.358 2.214 20 0 BEADLO CC(C)[N@H+](C)Cc1nc([C@@H]2CC[C@H](C)O2)no1 ZINC000528248048 387876611 /nfs/dbraw/zinc/87/66/11/387876611.db2.gz GQHNTOXUOLKBAZ-UWVGGRQHSA-N 1 2 239.319 2.150 20 0 BEADLO CC(C)[N@@H+](C)Cc1nc([C@@H]2CC[C@H](C)O2)no1 ZINC000528248048 387876614 /nfs/dbraw/zinc/87/66/14/387876614.db2.gz GQHNTOXUOLKBAZ-UWVGGRQHSA-N 1 2 239.319 2.150 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H]2C[C@H]2C2CCCCC2)c[nH+]1 ZINC000266597352 387883569 /nfs/dbraw/zinc/88/35/69/387883569.db2.gz RNISHEYURSOWMY-RYUDHWBXSA-N 1 2 247.342 2.417 20 0 BEADLO Cc1cc(N[C@@H](C)c2ncccc2F)nc[nH+]1 ZINC000528261590 387888012 /nfs/dbraw/zinc/88/80/12/387888012.db2.gz CWNJXCSRKVTDJU-VIFPVBQESA-N 1 2 232.262 2.492 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)[C@]1(C)CC=CCC1 ZINC000448706933 387888115 /nfs/dbraw/zinc/88/81/15/387888115.db2.gz BFYHHETVXAHUJG-TZMCWYRMSA-N 1 2 247.342 2.134 20 0 BEADLO FC(F)(F)CC[N@@H+]1CCc2ncsc2C1 ZINC000444678084 387906820 /nfs/dbraw/zinc/90/68/20/387906820.db2.gz VSADFTUMHCMIMG-UHFFFAOYSA-N 1 2 236.262 2.454 20 0 BEADLO FC(F)(F)CC[N@H+]1CCc2ncsc2C1 ZINC000444678084 387906822 /nfs/dbraw/zinc/90/68/22/387906822.db2.gz VSADFTUMHCMIMG-UHFFFAOYSA-N 1 2 236.262 2.454 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@H](CC(F)(F)F)C2)no1 ZINC000444689473 387911102 /nfs/dbraw/zinc/91/11/02/387911102.db2.gz GECVNEQMRSSJFC-MRVPVSSYSA-N 1 2 249.236 2.152 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@H](CC(F)(F)F)C2)no1 ZINC000444689473 387911108 /nfs/dbraw/zinc/91/11/08/387911108.db2.gz GECVNEQMRSSJFC-MRVPVSSYSA-N 1 2 249.236 2.152 20 0 BEADLO Cc1csc(C[N@@H+](C)Cc2cccn2C)n1 ZINC000158155217 387935464 /nfs/dbraw/zinc/93/54/64/387935464.db2.gz ZSNKPGSXWMSGBD-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1csc(C[N@H+](C)Cc2cccn2C)n1 ZINC000158155217 387935468 /nfs/dbraw/zinc/93/54/68/387935468.db2.gz ZSNKPGSXWMSGBD-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO c1coc(C[N@@H+]2CCc3ncsc3C2)c1 ZINC000438352323 387926248 /nfs/dbraw/zinc/92/62/48/387926248.db2.gz KHWVDIVYFIGETF-UHFFFAOYSA-N 1 2 220.297 2.294 20 0 BEADLO c1coc(C[N@H+]2CCc3ncsc3C2)c1 ZINC000438352323 387926254 /nfs/dbraw/zinc/92/62/54/387926254.db2.gz KHWVDIVYFIGETF-UHFFFAOYSA-N 1 2 220.297 2.294 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nccs2)[C@@H](C)[C@@H](C)O1 ZINC000438359280 387927569 /nfs/dbraw/zinc/92/75/69/387927569.db2.gz PWNLTDVLWSVYAD-KXUCPTDWSA-N 1 2 226.345 2.141 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nccs2)[C@@H](C)[C@@H](C)O1 ZINC000438359280 387927574 /nfs/dbraw/zinc/92/75/74/387927574.db2.gz PWNLTDVLWSVYAD-KXUCPTDWSA-N 1 2 226.345 2.141 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cncs2)[C@H](C)[C@@H](C)O1 ZINC000438363940 387928396 /nfs/dbraw/zinc/92/83/96/387928396.db2.gz MOLVBLHXTZXZJW-OPRDCNLKSA-N 1 2 226.345 2.141 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cncs2)[C@H](C)[C@@H](C)O1 ZINC000438363940 387928401 /nfs/dbraw/zinc/92/84/01/387928401.db2.gz MOLVBLHXTZXZJW-OPRDCNLKSA-N 1 2 226.345 2.141 20 0 BEADLO CC(C)c1nc(N2CC[C@H](O)C(C)(C)C2)cc[nH+]1 ZINC000445619370 387952477 /nfs/dbraw/zinc/95/24/77/387952477.db2.gz RRKJXYVNWKCVSN-NSHDSACASA-N 1 2 249.358 2.197 20 0 BEADLO CC[C@@H](COC)Nc1[nH+]c2ccccc2n1C ZINC000079745181 387958282 /nfs/dbraw/zinc/95/82/82/387958282.db2.gz BAZIKBRZVBDZQO-JTQLQIEISA-N 1 2 233.315 2.410 20 0 BEADLO CCn1cccc1CNc1cccc(CO)[nH+]1 ZINC000453046391 387971367 /nfs/dbraw/zinc/97/13/67/387971367.db2.gz DNTJABFHSFBFQH-UHFFFAOYSA-N 1 2 231.299 2.007 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ncc(C)s2)C[C@@H](C)O1 ZINC000245541726 387957673 /nfs/dbraw/zinc/95/76/73/387957673.db2.gz QRBCMLPLNSDVGY-MWLCHTKSSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ncc(C)s2)C[C@@H](C)O1 ZINC000245541726 387957676 /nfs/dbraw/zinc/95/76/76/387957676.db2.gz QRBCMLPLNSDVGY-MWLCHTKSSA-N 1 2 240.372 2.451 20 0 BEADLO C[C@H](c1cnccn1)[N@@H+]1CCc2ncsc2C1 ZINC000445846753 387974378 /nfs/dbraw/zinc/97/43/78/387974378.db2.gz NIFAEHZRXLMNHM-SECBINFHSA-N 1 2 246.339 2.052 20 0 BEADLO C[C@H](c1cnccn1)[N@H+]1CCc2ncsc2C1 ZINC000445846753 387974383 /nfs/dbraw/zinc/97/43/83/387974383.db2.gz NIFAEHZRXLMNHM-SECBINFHSA-N 1 2 246.339 2.052 20 0 BEADLO CO[C@@H](C)[C@@H](C)Nc1ccc2c(c1)CC[NH2+]2 ZINC000423214214 387998183 /nfs/dbraw/zinc/99/81/83/387998183.db2.gz KYWBXKYZUDONIT-ZJUUUORDSA-N 1 2 220.316 2.490 20 0 BEADLO CCOC[C@H](C)Nc1ccc2c(c1)CC[NH2+]2 ZINC000423217204 388000031 /nfs/dbraw/zinc/00/00/31/388000031.db2.gz PPBJPCMIDVYBLT-JTQLQIEISA-N 1 2 220.316 2.492 20 0 BEADLO CN(C)c1ccccc1CNc1c[nH]c[nH+]1 ZINC000309656186 388001488 /nfs/dbraw/zinc/00/14/88/388001488.db2.gz PWPXTEGYLJYRAV-UHFFFAOYSA-N 1 2 216.288 2.088 20 0 BEADLO CC(C)CCc1csc([C@H]2COCC[NH2+]2)n1 ZINC000446136406 388002821 /nfs/dbraw/zinc/00/28/21/388002821.db2.gz KETIYYGVLBSCDK-LLVKDONJSA-N 1 2 240.372 2.393 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)Nc1cnn(C)c1C ZINC000453188296 388004387 /nfs/dbraw/zinc/00/43/87/388004387.db2.gz WEWYUJFWLGWBPI-VIFPVBQESA-N 1 2 233.319 2.118 20 0 BEADLO c1cn2c([nH+]1)[C@@H](Nc1cccc3c1CCO3)CC2 ZINC000453201868 388007864 /nfs/dbraw/zinc/00/78/64/388007864.db2.gz BCXDZSXORNBSOT-LBPRGKRZSA-N 1 2 241.294 2.375 20 0 BEADLO Cc1cccc(CN(C)c2cc(C)[nH+]cn2)n1 ZINC000439594941 388009795 /nfs/dbraw/zinc/00/97/95/388009795.db2.gz KZLQEHLYVHETNV-UHFFFAOYSA-N 1 2 228.299 2.125 20 0 BEADLO CC[C@H](N[C@H]1CCn2cc[nH+]c21)C(F)(F)F ZINC000453208187 388010442 /nfs/dbraw/zinc/01/04/42/388010442.db2.gz BIUHAFBRPVUKMY-YUMQZZPRSA-N 1 2 233.237 2.258 20 0 BEADLO CCc1nc(C[N@@H+]2CC[C@@H](C)[C@@H](C)C2)no1 ZINC000245968658 387996665 /nfs/dbraw/zinc/99/66/65/387996665.db2.gz VZXIZAANUVZYTJ-ZJUUUORDSA-N 1 2 223.320 2.110 20 0 BEADLO CCc1nc(C[N@H+]2CC[C@@H](C)[C@@H](C)C2)no1 ZINC000245968658 387996673 /nfs/dbraw/zinc/99/66/73/387996673.db2.gz VZXIZAANUVZYTJ-ZJUUUORDSA-N 1 2 223.320 2.110 20 0 BEADLO CC[C@H](Nc1ccnc(C2CC2)n1)c1[nH]cc[nH+]1 ZINC000439643050 388013249 /nfs/dbraw/zinc/01/32/49/388013249.db2.gz JBUBHALCIXUZIQ-JTQLQIEISA-N 1 2 243.314 2.062 20 0 BEADLO C[N@H+](Cc1nnc(C(C)(C)C)[nH]1)[C@H]1CC1(C)C ZINC000433188114 388032228 /nfs/dbraw/zinc/03/22/28/388032228.db2.gz LGFXOFKXVQSCDT-VIFPVBQESA-N 1 2 236.363 2.333 20 0 BEADLO C[N@@H+](Cc1nnc(C(C)(C)C)[nH]1)[C@H]1CC1(C)C ZINC000433188114 388032232 /nfs/dbraw/zinc/03/22/32/388032232.db2.gz LGFXOFKXVQSCDT-VIFPVBQESA-N 1 2 236.363 2.333 20 0 BEADLO CC[C@H]([NH2+][C@H](C)c1cnn(C)c1)C(F)F ZINC000453251410 388026579 /nfs/dbraw/zinc/02/65/79/388026579.db2.gz TWFRCUVSSGWPRO-APPZFPTMSA-N 1 2 217.263 2.114 20 0 BEADLO CC[C@H](N[C@@H](C)c1[nH+]ccn1C)C(F)F ZINC000453252166 388026972 /nfs/dbraw/zinc/02/69/72/388026972.db2.gz UUUWTQOAIWGRHZ-YUMQZZPRSA-N 1 2 217.263 2.114 20 0 BEADLO Cn1ccnc1C[NH2+][C@H]1CSc2ccccc21 ZINC000083748770 388061169 /nfs/dbraw/zinc/06/11/69/388061169.db2.gz FBNIQCPHIOMQBR-NSHDSACASA-N 1 2 245.351 2.357 20 0 BEADLO c1c[nH]c(C[NH2+][C@@H]2CSc3ccccc32)n1 ZINC000083748662 388061349 /nfs/dbraw/zinc/06/13/49/388061349.db2.gz QRUSGNHDYNYVKA-SNVBAGLBSA-N 1 2 231.324 2.346 20 0 BEADLO CCOC(=O)[C@@H]1CCCC[N@@H+]1C[C@@H](F)CC ZINC000440704072 388071547 /nfs/dbraw/zinc/07/15/47/388071547.db2.gz UQZXRAMLKONVMG-QWRGUYRKSA-N 1 2 231.311 2.152 20 0 BEADLO CCOC(=O)[C@@H]1CCCC[N@H+]1C[C@@H](F)CC ZINC000440704072 388071548 /nfs/dbraw/zinc/07/15/48/388071548.db2.gz UQZXRAMLKONVMG-QWRGUYRKSA-N 1 2 231.311 2.152 20 0 BEADLO CC[C@@]1(C(C)C)C[C@@H]1[NH2+]Cc1ccn[nH]1 ZINC000453605568 388091037 /nfs/dbraw/zinc/09/10/37/388091037.db2.gz CXWQIAOQADIFEU-RYUDHWBXSA-N 1 2 207.321 2.324 20 0 BEADLO Fc1cc(Cl)cnc1NCCn1cc[nH+]c1 ZINC000086710463 388106713 /nfs/dbraw/zinc/10/67/13/388106713.db2.gz JUGYEOQQAPCRMC-UHFFFAOYSA-N 1 2 240.669 2.183 20 0 BEADLO CC[C@H](F)C[N@@H+]1CC[S@@](=O)C(CC)(CC)C1 ZINC000440497534 388045832 /nfs/dbraw/zinc/04/58/32/388045832.db2.gz HUXZXRHBNGUPBA-MEDUHNTESA-N 1 2 249.395 2.358 20 0 BEADLO CC[C@H](F)C[N@H+]1CC[S@@](=O)C(CC)(CC)C1 ZINC000440497534 388045834 /nfs/dbraw/zinc/04/58/34/388045834.db2.gz HUXZXRHBNGUPBA-MEDUHNTESA-N 1 2 249.395 2.358 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCN(C)[C@@H](C(C)C)C1 ZINC000440521718 388050244 /nfs/dbraw/zinc/05/02/44/388050244.db2.gz XZWUEWPBJPZHAG-VXGBXAGGSA-N 1 2 216.344 2.007 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCN(C)[C@@H](C(C)C)C1 ZINC000440521718 388050248 /nfs/dbraw/zinc/05/02/48/388050248.db2.gz XZWUEWPBJPZHAG-VXGBXAGGSA-N 1 2 216.344 2.007 20 0 BEADLO Cc1nocc1C[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000646153310 388157422 /nfs/dbraw/zinc/15/74/22/388157422.db2.gz CXYLAMKBAVHIAN-KCJUWKMLSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1nocc1C[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000646153310 388157423 /nfs/dbraw/zinc/15/74/23/388157423.db2.gz CXYLAMKBAVHIAN-KCJUWKMLSA-N 1 2 212.268 2.163 20 0 BEADLO COC[C@H](Cc1ccccc1)[NH2+]C(CF)CF ZINC000449379885 388187594 /nfs/dbraw/zinc/18/75/94/388187594.db2.gz KMMDLONXFXKFAS-LBPRGKRZSA-N 1 2 243.297 2.141 20 0 BEADLO CC1(C)CN(Cc2[nH]cc[nH+]2)[C@@H]1c1ccncc1 ZINC000646217179 388166601 /nfs/dbraw/zinc/16/66/01/388166601.db2.gz BPVDASJACIWDKV-CYBMUJFWSA-N 1 2 242.326 2.388 20 0 BEADLO CC1(C)C[N@H+](Cc2cn[nH]c2)[C@@H]1c1ccncc1 ZINC000646216905 388167063 /nfs/dbraw/zinc/16/70/63/388167063.db2.gz JAUNUVRTKYKGGU-CYBMUJFWSA-N 1 2 242.326 2.388 20 0 BEADLO CC1(C)C[N@@H+](Cc2cn[nH]c2)[C@@H]1c1ccncc1 ZINC000646216905 388167066 /nfs/dbraw/zinc/16/70/66/388167066.db2.gz JAUNUVRTKYKGGU-CYBMUJFWSA-N 1 2 242.326 2.388 20 0 BEADLO COc1cc(F)cc(C[NH2+]C(CF)CF)c1 ZINC000449379526 388188288 /nfs/dbraw/zinc/18/82/88/388188288.db2.gz IXGNBMBFTHONKH-UHFFFAOYSA-N 1 2 233.233 2.232 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C1=CC[C@@H](C)CC1 ZINC000456096528 388176950 /nfs/dbraw/zinc/17/69/50/388176950.db2.gz IMAYNVOPBGAFGH-LLVKDONJSA-N 1 2 247.342 2.266 20 0 BEADLO Cc1sccc1C[N@@H+]1CCc2cn[nH]c2C1 ZINC000646089845 388140225 /nfs/dbraw/zinc/14/02/25/388140225.db2.gz FZEZPTQQTQKEAU-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1sccc1C[N@H+]1CCc2cn[nH]c2C1 ZINC000646089845 388140227 /nfs/dbraw/zinc/14/02/27/388140227.db2.gz FZEZPTQQTQKEAU-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1sccc1C[N@@H+]1CCc2c[nH]nc2C1 ZINC000646089845 388140228 /nfs/dbraw/zinc/14/02/28/388140228.db2.gz FZEZPTQQTQKEAU-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1sccc1C[N@H+]1CCc2c[nH]nc2C1 ZINC000646089845 388140230 /nfs/dbraw/zinc/14/02/30/388140230.db2.gz FZEZPTQQTQKEAU-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO COc1cc(C)c(C[NH2+]C(CF)CF)c(C)n1 ZINC000449377496 388187325 /nfs/dbraw/zinc/18/73/25/388187325.db2.gz AMTZPPIZKFVJKU-UHFFFAOYSA-N 1 2 244.285 2.104 20 0 BEADLO Cc1nc2ccccn2c1C[NH2+]C(CF)CF ZINC000449382763 388189849 /nfs/dbraw/zinc/18/98/49/388189849.db2.gz YKLPCYNBIMTBDS-UHFFFAOYSA-N 1 2 239.269 2.040 20 0 BEADLO COC(=O)[C@H]1CCN(c2cccc[nH+]2)[C@H]1C(C)C ZINC000488715883 388191453 /nfs/dbraw/zinc/19/14/53/388191453.db2.gz IEZPJYVOPHKEPL-AAEUAGOBSA-N 1 2 248.326 2.106 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@@H](C)C1CC1 ZINC000456340643 388195475 /nfs/dbraw/zinc/19/54/75/388195475.db2.gz CRIFZCAYVYYOMK-UWVGGRQHSA-N 1 2 235.331 2.126 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@@H](C)C(C)C ZINC000456344964 388195890 /nfs/dbraw/zinc/19/58/90/388195890.db2.gz GEURYRPVAMEZEJ-QWRGUYRKSA-N 1 2 237.347 2.372 20 0 BEADLO CC[C@H](C)C(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456356507 388196998 /nfs/dbraw/zinc/19/69/98/388196998.db2.gz BDVRLNHQALLDOO-GUBZILKMSA-N 1 2 221.304 2.051 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)CCC2CC2)c2[nH+]ccn21 ZINC000456361485 388197651 /nfs/dbraw/zinc/19/76/51/388197651.db2.gz DOJBZLPUBGYADK-KOLCDFICSA-N 1 2 233.315 2.195 20 0 BEADLO CCC[C@H](C)C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456371499 388197696 /nfs/dbraw/zinc/19/76/96/388197696.db2.gz IKCDYLXBYCEMIB-GARJFASQSA-N 1 2 235.331 2.441 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)C1(CC)CC1 ZINC000456365694 388197949 /nfs/dbraw/zinc/19/79/49/388197949.db2.gz WBSVNQOESVQHBX-JTQLQIEISA-N 1 2 235.331 2.270 20 0 BEADLO CCC(CC)C(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456362320 388197973 /nfs/dbraw/zinc/19/79/73/388197973.db2.gz DXBJPEAJODJZCT-ONGXEEELSA-N 1 2 235.331 2.441 20 0 BEADLO C[C@H](C(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21)C1CC1 ZINC000456422303 388199943 /nfs/dbraw/zinc/19/99/43/388199943.db2.gz OCFYNAFLLNYOGK-QXEWZRGKSA-N 1 2 233.315 2.051 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)[C@H]2[C@@H]3CCC[C@@H]32)c2[nH+]ccn21 ZINC000456410142 388200059 /nfs/dbraw/zinc/20/00/59/388200059.db2.gz GAYGHIANPWUXMM-GCHJQGSQSA-N 1 2 245.326 2.051 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)[C@@H]2CC2(C)C)c2[nH+]ccn21 ZINC000456421008 388200155 /nfs/dbraw/zinc/20/01/55/388200155.db2.gz NARHJNRFAJWCPB-KXUCPTDWSA-N 1 2 233.315 2.051 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)[C@H]2CC2(C)C)c2[nH+]ccn21 ZINC000456421006 388200266 /nfs/dbraw/zinc/20/02/66/388200266.db2.gz NARHJNRFAJWCPB-IVZWLZJFSA-N 1 2 233.315 2.051 20 0 BEADLO C[C@H](C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21)C1CC1 ZINC000456422301 388200365 /nfs/dbraw/zinc/20/03/65/388200365.db2.gz OCFYNAFLLNYOGK-ATZCPNFKSA-N 1 2 233.315 2.051 20 0 BEADLO CC[N@H+](Cc1cc(F)cc(OC)c1)C1COC1 ZINC000449423615 388202319 /nfs/dbraw/zinc/20/23/19/388202319.db2.gz HYIDOLFWGAJQHB-UHFFFAOYSA-N 1 2 239.290 2.055 20 0 BEADLO CC[N@@H+](Cc1cc(F)cc(OC)c1)C1COC1 ZINC000449423615 388202322 /nfs/dbraw/zinc/20/23/22/388202322.db2.gz HYIDOLFWGAJQHB-UHFFFAOYSA-N 1 2 239.290 2.055 20 0 BEADLO Cc1nnc(C[N@@H+](C)[C@@H]2CC2(C)C)n1C1CC1 ZINC000489395777 388210911 /nfs/dbraw/zinc/21/09/11/388210911.db2.gz DABHCGJXAYVOCV-LLVKDONJSA-N 1 2 234.347 2.152 20 0 BEADLO Cc1nnc(C[N@H+](C)[C@@H]2CC2(C)C)n1C1CC1 ZINC000489395777 388210914 /nfs/dbraw/zinc/21/09/14/388210914.db2.gz DABHCGJXAYVOCV-LLVKDONJSA-N 1 2 234.347 2.152 20 0 BEADLO C[N@H+](CC(=O)OC(C)(C)C)[C@@H]1CC1(C)C ZINC000489416224 388212991 /nfs/dbraw/zinc/21/29/91/388212991.db2.gz SREZFRBEIYBYIQ-SECBINFHSA-N 1 2 213.321 2.058 20 0 BEADLO C[N@@H+](CC(=O)OC(C)(C)C)[C@@H]1CC1(C)C ZINC000489416224 388212994 /nfs/dbraw/zinc/21/29/94/388212994.db2.gz SREZFRBEIYBYIQ-SECBINFHSA-N 1 2 213.321 2.058 20 0 BEADLO CC[C@H](NC(=O)c1c[nH+]c(C)[nH]1)C1CCCC1 ZINC000456655252 388213244 /nfs/dbraw/zinc/21/32/44/388213244.db2.gz HYEZXAOSKPBVJF-NSHDSACASA-N 1 2 235.331 2.417 20 0 BEADLO CC(C)c1nnc(C[N@H+](C)[C@H]2CC2(C)C)o1 ZINC000489480884 388217552 /nfs/dbraw/zinc/21/75/52/388217552.db2.gz MRRXTXOLHMWQHT-VIFPVBQESA-N 1 2 223.320 2.423 20 0 BEADLO CC(C)c1nnc(C[N@@H+](C)[C@H]2CC2(C)C)o1 ZINC000489480884 388217553 /nfs/dbraw/zinc/21/75/53/388217553.db2.gz MRRXTXOLHMWQHT-VIFPVBQESA-N 1 2 223.320 2.423 20 0 BEADLO CC(C)Cc1noc(C[N@H+](C)[C@@H]2CC2(C)C)n1 ZINC000489497329 388218448 /nfs/dbraw/zinc/21/84/48/388218448.db2.gz GXBYVRJWFJPKBT-SNVBAGLBSA-N 1 2 237.347 2.498 20 0 BEADLO CC(C)Cc1noc(C[N@@H+](C)[C@@H]2CC2(C)C)n1 ZINC000489497329 388218450 /nfs/dbraw/zinc/21/84/50/388218450.db2.gz GXBYVRJWFJPKBT-SNVBAGLBSA-N 1 2 237.347 2.498 20 0 BEADLO Cc1c[nH+]c(C)nc1N1C[C@H]2CCC[C@@H]21 ZINC000517960324 256556052 /nfs/dbraw/zinc/55/60/52/256556052.db2.gz HJHHQPRKIPJKRT-MNOVXSKESA-N 1 2 203.289 2.082 20 0 BEADLO C[C@@H](NC(=O)C(C)(C)c1c[nH]c[nH+]1)C1CCCC1 ZINC000456776161 388220621 /nfs/dbraw/zinc/22/06/21/388220621.db2.gz SJGLFLJAGQMHII-SNVBAGLBSA-N 1 2 249.358 2.382 20 0 BEADLO c1snnc1C[N@@H+]1C[C@@H](C2CC2)[C@@H]1C1CC1 ZINC000449531370 388225508 /nfs/dbraw/zinc/22/55/08/388225508.db2.gz BPILDQAWKDHBNU-RYUDHWBXSA-N 1 2 235.356 2.159 20 0 BEADLO c1snnc1C[N@H+]1C[C@@H](C2CC2)[C@@H]1C1CC1 ZINC000449531370 388225511 /nfs/dbraw/zinc/22/55/11/388225511.db2.gz BPILDQAWKDHBNU-RYUDHWBXSA-N 1 2 235.356 2.159 20 0 BEADLO Cc1cc(C)c(CNC(=O)C[C@@H]2C[C@H]2C)c[nH+]1 ZINC000456833968 388226644 /nfs/dbraw/zinc/22/66/44/388226644.db2.gz HEOPBURFOVVHAA-PWSUYJOCSA-N 1 2 232.327 2.361 20 0 BEADLO Cc1cc(C)c(CNC(=O)C2CCC2)c[nH+]1 ZINC000456863124 388228002 /nfs/dbraw/zinc/22/80/02/388228002.db2.gz QLYUBRPBZNICJQ-UHFFFAOYSA-N 1 2 218.300 2.115 20 0 BEADLO CSCCC(=O)NCc1c[nH+]c(C)cc1C ZINC000456866213 388229041 /nfs/dbraw/zinc/22/90/41/388229041.db2.gz URYLPMPCCLTDGG-UHFFFAOYSA-N 1 2 238.356 2.068 20 0 BEADLO CC[C@@]1(O)CCN(c2cc(C)[nH+]c(C3CC3)n2)C1 ZINC000490051063 388232416 /nfs/dbraw/zinc/23/24/16/388232416.db2.gz UEYSYKZKQXNYSY-CQSZACIVSA-N 1 2 247.342 2.014 20 0 BEADLO CO[C@H]1C[C@H]([N@H+](C)Cc2cn[nH]c2C)C12CCC2 ZINC000449637166 388246852 /nfs/dbraw/zinc/24/68/52/388246852.db2.gz YITMKWLEFOAKBB-STQMWFEESA-N 1 2 249.358 2.108 20 0 BEADLO CO[C@H]1C[C@H]([N@@H+](C)Cc2cn[nH]c2C)C12CCC2 ZINC000449637166 388246854 /nfs/dbraw/zinc/24/68/54/388246854.db2.gz YITMKWLEFOAKBB-STQMWFEESA-N 1 2 249.358 2.108 20 0 BEADLO C/C=C/C=C/C(=O)Nc1c[nH+]ccc1OC ZINC000491382807 388290238 /nfs/dbraw/zinc/29/02/38/388290238.db2.gz JMRHAKUYNHPOOA-VNKDHWASSA-N 1 2 218.256 2.161 20 0 BEADLO c1cnc(C[N@@H+]2CCOCC23CCCCC3)nc1 ZINC000451816952 388298435 /nfs/dbraw/zinc/29/84/35/388298435.db2.gz QADYWACOOLPTSC-UHFFFAOYSA-N 1 2 247.342 2.012 20 0 BEADLO c1cnc(C[N@H+]2CCOCC23CCCCC3)nc1 ZINC000451816952 388298436 /nfs/dbraw/zinc/29/84/36/388298436.db2.gz QADYWACOOLPTSC-UHFFFAOYSA-N 1 2 247.342 2.012 20 0 BEADLO C[C@@H](O)C[N@H+](CCCCCF)CC(F)F ZINC000451831200 388298973 /nfs/dbraw/zinc/29/89/73/388298973.db2.gz KDWNPDKJNWOLRL-SECBINFHSA-N 1 2 227.270 2.074 20 0 BEADLO C[C@@H](O)C[N@@H+](CCCCCF)CC(F)F ZINC000451831200 388298975 /nfs/dbraw/zinc/29/89/75/388298975.db2.gz KDWNPDKJNWOLRL-SECBINFHSA-N 1 2 227.270 2.074 20 0 BEADLO C/C=C/C=C/C(=O)Nc1cccc2[nH+]ccn21 ZINC000491906366 388327180 /nfs/dbraw/zinc/32/71/80/388327180.db2.gz QRDXHVCURFRLHG-CRBCFSCISA-N 1 2 227.267 2.405 20 0 BEADLO C[C@H]1CC(C)(C)CN1C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493069275 256613631 /nfs/dbraw/zinc/61/36/31/256613631.db2.gz GRZZIMRDCCWMGY-YEZKRMTDSA-N 1 2 233.315 2.070 20 0 BEADLO CC(C)n1ncnc1C[NH+]1CCC(CF)CC1 ZINC000451388054 388268311 /nfs/dbraw/zinc/26/83/11/388268311.db2.gz ATARYMMDHZQELK-UHFFFAOYSA-N 1 2 240.326 2.041 20 0 BEADLO CC(C)c1nnc(C[NH+]2CCC(CF)CC2)[nH]1 ZINC000451392057 388268543 /nfs/dbraw/zinc/26/85/43/388268543.db2.gz IAKKQXHLVIQDHY-UHFFFAOYSA-N 1 2 240.326 2.110 20 0 BEADLO CC[C@H](C)N(C)C(=O)/C=C\c1[nH+]ccn1CC ZINC000492301014 388340741 /nfs/dbraw/zinc/34/07/41/388340741.db2.gz SNLHMSMBLUFPAD-TVRMLOFPSA-N 1 2 235.331 2.173 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N1CC[C@H](C)[C@@H]1C ZINC000492410337 388343711 /nfs/dbraw/zinc/34/37/11/388343711.db2.gz RIZHQPLFFCHSNK-WTIVYXKASA-N 1 2 247.342 2.173 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ccccc1)c1ncn(C)n1 ZINC000275598864 388345129 /nfs/dbraw/zinc/34/51/29/388345129.db2.gz IZRAHRFYFDTMTQ-QWRGUYRKSA-N 1 2 230.315 2.227 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2ncn(C)n2)c(C)c1 ZINC000275829582 388346158 /nfs/dbraw/zinc/34/61/58/388346158.db2.gz OAPOBPLQGRGFNW-GFCCVEGCSA-N 1 2 244.342 2.283 20 0 BEADLO C[C@@H](N(C)c1nc[nH+]c(N)c1Cl)C1(C)CC1 ZINC000302916365 388346520 /nfs/dbraw/zinc/34/65/20/388346520.db2.gz WFPZKJGYPKVJGX-SSDOTTSWSA-N 1 2 240.738 2.337 20 0 BEADLO C[C@@H](N(C)c1[nH+]cnc(N)c1Cl)C1(C)CC1 ZINC000302916365 388346523 /nfs/dbraw/zinc/34/65/23/388346523.db2.gz WFPZKJGYPKVJGX-SSDOTTSWSA-N 1 2 240.738 2.337 20 0 BEADLO CC(C)=CCCNc1[nH+]cnc2c1cnn2C ZINC000276518428 388349893 /nfs/dbraw/zinc/34/98/93/388349893.db2.gz AECUMTBJFSVVDR-UHFFFAOYSA-N 1 2 231.303 2.132 20 0 BEADLO C[C@@H]1CCCC[C@@H]1CC(=O)NCc1[nH]cc[nH+]1 ZINC000524406766 388359187 /nfs/dbraw/zinc/35/91/87/388359187.db2.gz NXQMXLPBSFYEAS-GHMZBOCLSA-N 1 2 235.331 2.242 20 0 BEADLO C[C@H](CC(=O)NC(C1CC1)C1CC1)n1cc[nH+]c1 ZINC000519161992 256644530 /nfs/dbraw/zinc/64/45/30/256644530.db2.gz WAEVDPUNPCFTQL-SNVBAGLBSA-N 1 2 247.342 2.139 20 0 BEADLO CC[C@@H]1CCCCN1c1nc[nH+]c(N)c1Cl ZINC000227840474 388371506 /nfs/dbraw/zinc/37/15/06/388371506.db2.gz VEYKDZDQQWIYJE-MRVPVSSYSA-N 1 2 240.738 2.481 20 0 BEADLO CC[C@@H]1CCCCN1c1[nH+]cnc(N)c1Cl ZINC000227840474 388371508 /nfs/dbraw/zinc/37/15/08/388371508.db2.gz VEYKDZDQQWIYJE-MRVPVSSYSA-N 1 2 240.738 2.481 20 0 BEADLO Nc1[nH+]cnc(NCC2CCCC2)c1Cl ZINC000227847416 388371599 /nfs/dbraw/zinc/37/15/99/388371599.db2.gz ONJJGPNYPGZSCI-UHFFFAOYSA-N 1 2 226.711 2.314 20 0 BEADLO Nc1nc[nH+]c(NCC2CCCC2)c1Cl ZINC000227847416 388371601 /nfs/dbraw/zinc/37/16/01/388371601.db2.gz ONJJGPNYPGZSCI-UHFFFAOYSA-N 1 2 226.711 2.314 20 0 BEADLO CC(C)CCNc1nc[nH+]c(N)c1Cl ZINC000227840762 388371640 /nfs/dbraw/zinc/37/16/40/388371640.db2.gz SWKZJOJCCISOTL-UHFFFAOYSA-N 1 2 214.700 2.170 20 0 BEADLO CC(C)CCNc1[nH+]cnc(N)c1Cl ZINC000227840762 388371642 /nfs/dbraw/zinc/37/16/42/388371642.db2.gz SWKZJOJCCISOTL-UHFFFAOYSA-N 1 2 214.700 2.170 20 0 BEADLO Cc1ncccc1NC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000519661275 256655709 /nfs/dbraw/zinc/65/57/09/256655709.db2.gz YWVHWZUWOGWPIZ-JTQLQIEISA-N 1 2 244.298 2.176 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@@H]2CCC[C@@H]2C2CC2)c[nH+]1 ZINC000572847304 388380786 /nfs/dbraw/zinc/38/07/86/388380786.db2.gz GTTKIAGBQIRJPI-NWDGAFQWSA-N 1 2 247.342 2.274 20 0 BEADLO C[C@@H]([NH2+]Cc1cncs1)c1cscn1 ZINC000164654154 388382442 /nfs/dbraw/zinc/38/24/42/388382442.db2.gz YOARPFUOCDIMFW-SSDOTTSWSA-N 1 2 225.342 2.450 20 0 BEADLO CC[C@H]([NH3+])C(=O)N[C@H]1CCC(C)(C)C[C@H]1C ZINC000236945663 388386535 /nfs/dbraw/zinc/38/65/35/388386535.db2.gz YRDCCNIYETVAHV-VWYCJHECSA-N 1 2 226.364 2.055 20 0 BEADLO C[C@H]1CCCC[C@H]1NC(=O)C[NH+]1CC(C)(C)C1 ZINC000646574860 388386872 /nfs/dbraw/zinc/38/68/72/388386872.db2.gz GJQLXPLXXVJBDQ-NWDGAFQWSA-N 1 2 238.375 2.023 20 0 BEADLO CC[C@H]([NH3+])C(=O)N[C@@H]1CCC[C@H]1CCC(C)C ZINC000236933904 388386916 /nfs/dbraw/zinc/38/69/16/388386916.db2.gz BJFPJMBDDOXXSU-RWMBFGLXSA-N 1 2 240.391 2.445 20 0 BEADLO CC[C@H]([NH3+])C(=O)N[C@@H]1CC[C@@H](C)c2ccccc21 ZINC000236934483 388386979 /nfs/dbraw/zinc/38/69/79/388386979.db2.gz JUIGJEMQCWCTCF-DDTOSNHZSA-N 1 2 246.354 2.479 20 0 BEADLO CCOc1cccc(C[NH2+]Cc2cocn2)c1 ZINC000236953051 388387337 /nfs/dbraw/zinc/38/73/37/388387337.db2.gz PSCJAOKTQWVSDT-UHFFFAOYSA-N 1 2 232.283 2.363 20 0 BEADLO c1csc([C@H]([NH2+]C2CCC2)c2nnc[nH]2)c1 ZINC000294926252 388406657 /nfs/dbraw/zinc/40/66/57/388406657.db2.gz XGVCICDOWOBNDT-JTQLQIEISA-N 1 2 234.328 2.098 20 0 BEADLO COc1c(C)c[nH+]c(CN(C)C2CC2)c1C ZINC000171234812 388402779 /nfs/dbraw/zinc/40/27/79/388402779.db2.gz OJDORSXRXKKPMH-UHFFFAOYSA-N 1 2 220.316 2.301 20 0 BEADLO COc1cc[nH+]cc1NC(=O)/C=C\C1CCC1 ZINC000492065598 388333351 /nfs/dbraw/zinc/33/33/51/388333351.db2.gz HWNALKADXNIEDF-WAYWQWQTSA-N 1 2 232.283 2.385 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)/C=C\C1CCC1 ZINC000492231756 388338913 /nfs/dbraw/zinc/33/89/13/388338913.db2.gz LTKWPNHRZPFWTR-SREVYHEPSA-N 1 2 247.342 2.088 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N[C@@H]1CCC[C@H]1C ZINC000492274552 388340041 /nfs/dbraw/zinc/34/00/41/388340041.db2.gz JQVBOTGJCRXPPS-PKJDGDQJSA-N 1 2 247.342 2.221 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)NCC1CCCC1 ZINC000492276818 388340266 /nfs/dbraw/zinc/34/02/66/388340266.db2.gz MYICOVCSCBBFFD-FPLPWBNLSA-N 1 2 247.342 2.223 20 0 BEADLO C[C@H](COCC(F)(F)F)Nc1cccc[nH+]1 ZINC000299330407 388440731 /nfs/dbraw/zinc/44/07/31/388440731.db2.gz LASOFJIGYZCHGA-MRVPVSSYSA-N 1 2 234.221 2.461 20 0 BEADLO Cc1ccc(CCCNc2cnn(C)c2)c[nH+]1 ZINC000525985294 388450217 /nfs/dbraw/zinc/45/02/17/388450217.db2.gz DWKPEFXBPQXJDI-UHFFFAOYSA-N 1 2 230.315 2.168 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H]1CS[C@@H](C(C)(C)C)C1 ZINC000309578229 388458051 /nfs/dbraw/zinc/45/80/51/388458051.db2.gz POMAPUZLIXQZPH-KXUCPTDWSA-N 1 2 245.388 2.058 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)[C@@H]1C[C@@H]1C1CC1 ZINC000176707555 388459178 /nfs/dbraw/zinc/45/91/78/388459178.db2.gz VVOCIMXEJRMQBO-GHMZBOCLSA-N 1 2 245.326 2.132 20 0 BEADLO C[C@H]([NH2+][C@H]1CSC[C@H]1C)C(=O)OC(C)(C)C ZINC000336706012 388465643 /nfs/dbraw/zinc/46/56/43/388465643.db2.gz PSOZXBFVFMZCNU-UTLUCORTSA-N 1 2 245.388 2.058 20 0 BEADLO Cc1nc(C[NH2+]C(C)(C)c2cccs2)no1 ZINC000336721848 388468504 /nfs/dbraw/zinc/46/85/04/388468504.db2.gz DOWPYDQLGAVRNX-UHFFFAOYSA-N 1 2 237.328 2.464 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CC=C(C)CC1 ZINC000515870385 256759134 /nfs/dbraw/zinc/75/91/34/256759134.db2.gz XECTYTXQQAZPOF-UHFFFAOYSA-N 1 2 203.289 2.250 20 0 BEADLO CC[N@H+](CCCO)Cc1csc(Cl)n1 ZINC000295046702 388407306 /nfs/dbraw/zinc/40/73/06/388407306.db2.gz OIUQJSXNZKBRAK-UHFFFAOYSA-N 1 2 234.752 2.001 20 0 BEADLO CC[N@@H+](CCCO)Cc1csc(Cl)n1 ZINC000295046702 388407307 /nfs/dbraw/zinc/40/73/07/388407307.db2.gz OIUQJSXNZKBRAK-UHFFFAOYSA-N 1 2 234.752 2.001 20 0 BEADLO c1[nH]cc(NC2CCN(c3ccccc3)CC2)[nH+]1 ZINC000573065242 388416520 /nfs/dbraw/zinc/41/65/20/388416520.db2.gz XDZVJGQGSUDYQO-UHFFFAOYSA-N 1 2 242.326 2.491 20 0 BEADLO CC(C)C[C@H](C)NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000573253922 388435764 /nfs/dbraw/zinc/43/57/64/388435764.db2.gz KHDNIKOLCRCISF-NWDGAFQWSA-N 1 2 237.347 2.385 20 0 BEADLO CCC[C@@H]([NH2+]C[C@@](C)(CC)OC)C(=O)OCC ZINC000322578547 388438825 /nfs/dbraw/zinc/43/88/25/388438825.db2.gz CFPJJWDSXBIDDA-DGCLKSJQSA-N 1 2 245.363 2.123 20 0 BEADLO C[C@@H](CC(=O)N1CCCC[C@@H]1C)n1cc[nH+]c1 ZINC000517154937 388539507 /nfs/dbraw/zinc/53/95/07/388539507.db2.gz TZLJGLHLTAXVAP-RYUDHWBXSA-N 1 2 235.331 2.235 20 0 BEADLO Cc1cc(NC(=O)[C@H]2[C@H](C3CC3)[C@@H]2C)cc[nH+]1 ZINC000528533345 388544208 /nfs/dbraw/zinc/54/42/08/388544208.db2.gz JHFQRZNXLDPORT-TVYUQYBPSA-N 1 2 230.311 2.043 20 0 BEADLO CCCC[C@@H]([NH2+][C@H](C)CSC)C(=O)OC ZINC000135225830 388486253 /nfs/dbraw/zinc/48/62/53/388486253.db2.gz UMBBKPGLWVWKBP-NXEZZACHSA-N 1 2 233.377 2.059 20 0 BEADLO CCC[C@@H]1C[C@H]1NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000517379152 388548814 /nfs/dbraw/zinc/54/88/14/388548814.db2.gz UPAPYGVTTYANPP-IJLUTSLNSA-N 1 2 235.331 2.139 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1CCOC[C@@H]1[C@@H]1CCCO1 ZINC000528510262 388507116 /nfs/dbraw/zinc/50/71/16/388507116.db2.gz XWSRHNNOYDRREY-JUTKWBCOSA-N 1 2 245.750 2.009 20 0 BEADLO C/C(Cl)=C/C[N@H+]1CCOC[C@@H]1[C@@H]1CCCO1 ZINC000528510262 388507119 /nfs/dbraw/zinc/50/71/19/388507119.db2.gz XWSRHNNOYDRREY-JUTKWBCOSA-N 1 2 245.750 2.009 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cnccn1)c1cscn1 ZINC000576887951 388508389 /nfs/dbraw/zinc/50/83/89/388508389.db2.gz XVWQJZCLFRSTKY-DTWKUNHWSA-N 1 2 234.328 2.345 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1cnccn1)c1cscn1 ZINC000576887952 388508774 /nfs/dbraw/zinc/50/87/74/388508774.db2.gz XVWQJZCLFRSTKY-IUCAKERBSA-N 1 2 234.328 2.345 20 0 BEADLO COC(=O)c1occc1C[NH+]1[C@H](C)C[C@H]1C ZINC000548097738 388509410 /nfs/dbraw/zinc/50/94/10/388509410.db2.gz RARQXENACFNQQG-RKDXNWHRSA-N 1 2 223.272 2.049 20 0 BEADLO Cc1ncc(C[NH2+][C@H]2COCc3ccccc32)o1 ZINC000397955517 388513844 /nfs/dbraw/zinc/51/38/44/388513844.db2.gz RGJGPUUMAIJFBS-AWEZNQCLSA-N 1 2 244.294 2.344 20 0 BEADLO Cc1cc(NC(=O)[C@H]2C[C@H]2C(C)C)c(C)c[nH+]1 ZINC000548192487 388521079 /nfs/dbraw/zinc/52/10/79/388521079.db2.gz ZPMKVVOTLNHBID-RYUDHWBXSA-N 1 2 232.327 2.351 20 0 BEADLO CCC[C@H](NC(=O)Cn1cc[nH+]c1)C1CCCC1 ZINC000516852062 388521529 /nfs/dbraw/zinc/52/15/29/388521529.db2.gz YBHSLBHWUGJILC-ZDUSSCGKSA-N 1 2 249.358 2.358 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CC[C@@H](OCC(C)C)C1 ZINC000516878076 388522965 /nfs/dbraw/zinc/52/29/65/388522965.db2.gz WVIZNIPHRKRVSV-CYBMUJFWSA-N 1 2 249.358 2.345 20 0 BEADLO C/C(Cl)=C\C[N@H+]1CCC[C@@H]1c1nncn1C ZINC000528428312 388523010 /nfs/dbraw/zinc/52/30/10/388523010.db2.gz DIEGJLGYNFUBNG-NAZIUFLLSA-N 1 2 240.738 2.095 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1CCC[C@@H]1c1nncn1C ZINC000528428312 388523011 /nfs/dbraw/zinc/52/30/11/388523011.db2.gz DIEGJLGYNFUBNG-NAZIUFLLSA-N 1 2 240.738 2.095 20 0 BEADLO CC(C)c1nc(N[C@H]2C[C@@H]2C(F)F)cc[nH+]1 ZINC000348113309 388525758 /nfs/dbraw/zinc/52/57/58/388525758.db2.gz FWBXTBMFSPPLHZ-YUMQZZPRSA-N 1 2 227.258 2.087 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000528437559 388526666 /nfs/dbraw/zinc/52/66/66/388526666.db2.gz IUKFHWHVGHQBBU-HDXDTZNISA-N 1 2 203.713 2.238 20 0 BEADLO C/C(Cl)=C\C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000528437559 388526667 /nfs/dbraw/zinc/52/66/67/388526667.db2.gz IUKFHWHVGHQBBU-HDXDTZNISA-N 1 2 203.713 2.238 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1CCC(=O)[C@H](C)C1 ZINC000528462359 388528446 /nfs/dbraw/zinc/52/84/46/388528446.db2.gz WQDNZYYQFAQEAW-KLUICZCQSA-N 1 2 201.697 2.040 20 0 BEADLO C/C(Cl)=C\C[N@H+]1CCC(=O)[C@H](C)C1 ZINC000528462359 388528448 /nfs/dbraw/zinc/52/84/48/388528448.db2.gz WQDNZYYQFAQEAW-KLUICZCQSA-N 1 2 201.697 2.040 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1CCC(=O)[C@H](C)C1 ZINC000528462362 388529248 /nfs/dbraw/zinc/52/92/48/388529248.db2.gz WQDNZYYQFAQEAW-MMEMACFNSA-N 1 2 201.697 2.040 20 0 BEADLO C/C(Cl)=C/C[N@H+]1CCC(=O)[C@H](C)C1 ZINC000528462362 388529249 /nfs/dbraw/zinc/52/92/49/388529249.db2.gz WQDNZYYQFAQEAW-MMEMACFNSA-N 1 2 201.697 2.040 20 0 BEADLO COC(=O)c1sccc1C[N@H+](C)C1CC1 ZINC000088494319 388531410 /nfs/dbraw/zinc/53/14/10/388531410.db2.gz LIBUOFCFVLFBSX-UHFFFAOYSA-N 1 2 225.313 2.129 20 0 BEADLO COC(=O)c1sccc1C[N@@H+](C)C1CC1 ZINC000088494319 388531414 /nfs/dbraw/zinc/53/14/14/388531414.db2.gz LIBUOFCFVLFBSX-UHFFFAOYSA-N 1 2 225.313 2.129 20 0 BEADLO C[C@@H](c1nc(C2CC2)no1)[N@H+]1[C@H](C)C[C@@H]1C ZINC000548425960 388536785 /nfs/dbraw/zinc/53/67/85/388536785.db2.gz XFBWHSWZLSZYCU-YIZRAAEISA-N 1 2 221.304 2.491 20 0 BEADLO C[C@@H](c1nc(C2CC2)no1)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548425960 388536789 /nfs/dbraw/zinc/53/67/89/388536789.db2.gz XFBWHSWZLSZYCU-YIZRAAEISA-N 1 2 221.304 2.491 20 0 BEADLO Cc1ccc(NC(=O)Cc2ccoc2)c(C)[nH+]1 ZINC000185677598 256856395 /nfs/dbraw/zinc/85/63/95/256856395.db2.gz XUADWLYJCMORPD-UHFFFAOYSA-N 1 2 230.267 2.473 20 0 BEADLO COC(=O)[C@H]([NH2+][C@@H]1CC12CCCCC2)C1CC1 ZINC000358824792 388555619 /nfs/dbraw/zinc/55/56/19/388555619.db2.gz XBXRFLKTDDYVPS-VXGBXAGGSA-N 1 2 237.343 2.250 20 0 BEADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1ccn(C)n1 ZINC000528767340 388570707 /nfs/dbraw/zinc/57/07/07/388570707.db2.gz HLJCRFNCORMABI-VIFPVBQESA-N 1 2 229.274 2.040 20 0 BEADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1ccn(C)n1 ZINC000528767340 388570708 /nfs/dbraw/zinc/57/07/08/388570708.db2.gz HLJCRFNCORMABI-VIFPVBQESA-N 1 2 229.274 2.040 20 0 BEADLO C[N@H+](Cc1cccc(O)c1Cl)[C@@H]1CCOC1 ZINC000328195096 388585998 /nfs/dbraw/zinc/58/59/98/388585998.db2.gz DUCXSOLOBXHAAQ-SNVBAGLBSA-N 1 2 241.718 2.266 20 0 BEADLO C[N@@H+](Cc1cccc(O)c1Cl)[C@@H]1CCOC1 ZINC000328195096 388586000 /nfs/dbraw/zinc/58/60/00/388586000.db2.gz DUCXSOLOBXHAAQ-SNVBAGLBSA-N 1 2 241.718 2.266 20 0 BEADLO FC(F)C[N@H+](CC[C@@H]1CCCO1)C1CC1 ZINC000189241459 388627821 /nfs/dbraw/zinc/62/78/21/388627821.db2.gz SFLGBEQOWUOODT-JTQLQIEISA-N 1 2 219.275 2.285 20 0 BEADLO FC(F)C[N@@H+](CC[C@@H]1CCCO1)C1CC1 ZINC000189241459 388627824 /nfs/dbraw/zinc/62/78/24/388627824.db2.gz SFLGBEQOWUOODT-JTQLQIEISA-N 1 2 219.275 2.285 20 0 BEADLO Cn1ncc2c1nc[nH+]c2N[C@H]1CC12CCCC2 ZINC000328785080 388646434 /nfs/dbraw/zinc/64/64/34/388646434.db2.gz IPDAKCJPUAKPAR-JTQLQIEISA-N 1 2 243.314 2.108 20 0 BEADLO CN(C(=O)CCCn1cc[nH+]c1)C1CCCCC1 ZINC000620409445 388646735 /nfs/dbraw/zinc/64/67/35/388646735.db2.gz RQFXPADOFIFSPO-UHFFFAOYSA-N 1 2 249.358 2.454 20 0 BEADLO CCCCN(CC)C(=O)CCCn1cc[nH+]c1 ZINC000620410749 388646915 /nfs/dbraw/zinc/64/69/15/388646915.db2.gz JNTDEDYTTFAKLS-UHFFFAOYSA-N 1 2 237.347 2.312 20 0 BEADLO Cc1cccc(NC(=O)C[C@@H](C)n2cc[nH+]c2)n1 ZINC000551918911 388647444 /nfs/dbraw/zinc/64/74/44/388647444.db2.gz VPWKMXNQRVGFFE-LLVKDONJSA-N 1 2 244.298 2.176 20 0 BEADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2ncc[nH]2)o1 ZINC000067670395 388737989 /nfs/dbraw/zinc/73/79/89/388737989.db2.gz WKPNPZFPLSTAOS-MWLCHTKSSA-N 1 2 231.299 2.416 20 0 BEADLO C[C@@H]1C[C@H]1c1ccc(CNCc2[nH]cc[nH+]2)o1 ZINC000067670395 388737993 /nfs/dbraw/zinc/73/79/93/388737993.db2.gz WKPNPZFPLSTAOS-MWLCHTKSSA-N 1 2 231.299 2.416 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)CCC(C)(C)C ZINC000649028367 388740913 /nfs/dbraw/zinc/74/09/13/388740913.db2.gz YGKHPYAQBABCDS-UHFFFAOYSA-N 1 2 237.347 2.155 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CCOC[C@H]2C)cc[nH+]1 ZINC000194802810 388743112 /nfs/dbraw/zinc/74/31/12/388743112.db2.gz REWGEUBOFANNHA-SKDRFNHKSA-N 1 2 234.299 2.001 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CC[C@H](C)C2)c(C)c[nH+]1 ZINC000538442497 388690971 /nfs/dbraw/zinc/69/09/71/388690971.db2.gz WVQVIEINUMLXMV-CABZTGNLSA-N 1 2 232.327 2.495 20 0 BEADLO Cc1c[nH+]cc(N[C@@H]2CCO[C@@H](C)C2)c1 ZINC000225853040 388691875 /nfs/dbraw/zinc/69/18/75/388691875.db2.gz LNBHGBBUENJJBE-WDEREUQCSA-N 1 2 206.289 2.369 20 0 BEADLO FC(F)OCCCNc1cc[nH+]c(C2CC2)n1 ZINC000193621064 388711637 /nfs/dbraw/zinc/71/16/37/388711637.db2.gz LXBASHMXIITLEF-UHFFFAOYSA-N 1 2 243.257 2.395 20 0 BEADLO Cc1ccccc1[C@@H]1NC(=O)[C@@H]2C[C@H](C)CC[N@@H+]12 ZINC000249472940 388722581 /nfs/dbraw/zinc/72/25/81/388722581.db2.gz SOLISKPZZKGICU-DDTOSNHZSA-N 1 2 244.338 2.224 20 0 BEADLO Cc1ccccc1[C@@H]1NC(=O)[C@@H]2C[C@H](C)CC[N@H+]12 ZINC000249472940 388722584 /nfs/dbraw/zinc/72/25/84/388722584.db2.gz SOLISKPZZKGICU-DDTOSNHZSA-N 1 2 244.338 2.224 20 0 BEADLO CCS[C@@H]1CCCC[C@H]1[NH2+][C@H](C)C(=O)OC ZINC000249511688 388725044 /nfs/dbraw/zinc/72/50/44/388725044.db2.gz NVBDKOXOSAOVPM-GMTAPVOTSA-N 1 2 245.388 2.202 20 0 BEADLO CCS[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)C(=O)OC ZINC000249511689 388725551 /nfs/dbraw/zinc/72/55/51/388725551.db2.gz NVBDKOXOSAOVPM-OUAUKWLOSA-N 1 2 245.388 2.202 20 0 BEADLO C[C@H]1C[N@@H+](Cc2csnn2)CC[C@@H]1C ZINC000127652798 388729143 /nfs/dbraw/zinc/72/91/43/388729143.db2.gz QAIBKEVFFVNJFW-IUCAKERBSA-N 1 2 211.334 2.016 20 0 BEADLO C[C@H]1C[N@H+](Cc2csnn2)CC[C@@H]1C ZINC000127652798 388729144 /nfs/dbraw/zinc/72/91/44/388729144.db2.gz QAIBKEVFFVNJFW-IUCAKERBSA-N 1 2 211.334 2.016 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H](C)OC[C@@H]2C)sc1C ZINC000088576334 388732523 /nfs/dbraw/zinc/73/25/23/388732523.db2.gz OHYUFNGGJCFGOY-IUCAKERBSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H](C)OC[C@@H]2C)sc1C ZINC000088576334 388732524 /nfs/dbraw/zinc/73/25/24/388732524.db2.gz OHYUFNGGJCFGOY-IUCAKERBSA-N 1 2 240.372 2.369 20 0 BEADLO CC[C@H](C)NC(=O)C[N@H+](C)[C@H](C)c1ccco1 ZINC000249831182 388733616 /nfs/dbraw/zinc/73/36/16/388733616.db2.gz OFQBARGEOYARSQ-WDEREUQCSA-N 1 2 238.331 2.187 20 0 BEADLO CC[C@H](C)NC(=O)C[N@@H+](C)[C@H](C)c1ccco1 ZINC000249831182 388733618 /nfs/dbraw/zinc/73/36/18/388733618.db2.gz OFQBARGEOYARSQ-WDEREUQCSA-N 1 2 238.331 2.187 20 0 BEADLO C[C@@H](N(C)C(=O)CCc1[nH]cc[nH+]1)C(C)(C)C ZINC000554299218 388806244 /nfs/dbraw/zinc/80/62/44/388806244.db2.gz CVIYJBMXKWSFBN-SNVBAGLBSA-N 1 2 237.347 2.235 20 0 BEADLO FC(F)(F)C[NH2+][C@@H]1CCCC12CCOCC2 ZINC000300989563 388767389 /nfs/dbraw/zinc/76/73/89/388767389.db2.gz VRENYBPFHVONAU-SECBINFHSA-N 1 2 237.265 2.488 20 0 BEADLO c1csc(-c2noc([C@H]3CSC[NH2+]3)n2)c1 ZINC000229002757 388778640 /nfs/dbraw/zinc/77/86/40/388778640.db2.gz LOURKOAZFPKORF-ZCFIWIBFSA-N 1 2 239.325 2.133 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)Nc1cc(C)[nH+]cc1C ZINC000555230277 388843344 /nfs/dbraw/zinc/84/33/44/388843344.db2.gz HEYHLDWUBYZEFT-VXGBXAGGSA-N 1 2 232.327 2.495 20 0 BEADLO COc1ccc(C[NH2+]Cc2ccno2)c(F)c1 ZINC000231894847 388843589 /nfs/dbraw/zinc/84/35/89/388843589.db2.gz BKVQYUSJRUITLW-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO CCc1nocc1C[NH2+]Cc1ncccc1F ZINC000555564018 388854531 /nfs/dbraw/zinc/85/45/31/388854531.db2.gz XIGHSZVXPAFCOW-UHFFFAOYSA-N 1 2 235.262 2.061 20 0 BEADLO C[C@@H]1[C@@H](O)CC[N@@H+]1Cc1cc(F)c(F)cc1F ZINC000648763629 388846746 /nfs/dbraw/zinc/84/67/46/388846746.db2.gz SNGFLKMSWRHSPT-KRTXAFLBSA-N 1 2 245.244 2.059 20 0 BEADLO C[C@@H]1[C@@H](O)CC[N@H+]1Cc1cc(F)c(F)cc1F ZINC000648763629 388846750 /nfs/dbraw/zinc/84/67/50/388846750.db2.gz SNGFLKMSWRHSPT-KRTXAFLBSA-N 1 2 245.244 2.059 20 0 BEADLO CC1=C[C@@H](C)CN(C(=O)C[C@@H](C)n2cc[nH+]c2)C1 ZINC000565094483 388913579 /nfs/dbraw/zinc/91/35/79/388913579.db2.gz MEVFDAZMNVZWSE-DGCLKSJQSA-N 1 2 247.342 2.259 20 0 BEADLO CC1=C[C@H](C)CN(C(=O)C[C@@H](C)n2cc[nH+]c2)C1 ZINC000565094484 388913895 /nfs/dbraw/zinc/91/38/95/388913895.db2.gz MEVFDAZMNVZWSE-WCQYABFASA-N 1 2 247.342 2.259 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCC(=O)CC12CCC2 ZINC000565173387 388921026 /nfs/dbraw/zinc/92/10/26/388921026.db2.gz TYWPFPCRWZREQX-SNVBAGLBSA-N 1 2 213.296 2.322 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCC(=O)CC12CCC2 ZINC000565173387 388921029 /nfs/dbraw/zinc/92/10/29/388921029.db2.gz TYWPFPCRWZREQX-SNVBAGLBSA-N 1 2 213.296 2.322 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)Cc1ccc(O)cc1 ZINC000565229144 388929851 /nfs/dbraw/zinc/92/98/51/388929851.db2.gz PNIQFQAQYLXCKE-UHFFFAOYSA-N 1 2 243.310 2.435 20 0 BEADLO C[C@@H](NC(=O)c1[nH]ccc1C1CC1)c1[nH]cc[nH+]1 ZINC000565666913 388961600 /nfs/dbraw/zinc/96/16/00/388961600.db2.gz OOVSIZLMQYVGLC-MRVPVSSYSA-N 1 2 244.298 2.106 20 0 BEADLO CO[C@H]1CCN(c2cc[nH+]c(C)n2)CC1(C)C ZINC000295640304 132221007 /nfs/dbraw/zinc/22/10/07/132221007.db2.gz CCRNIEMTJHTEDH-NSHDSACASA-N 1 2 235.331 2.036 20 0 BEADLO CCOc1cccc(C[N@@H+]2CCC[C@H](F)C2)n1 ZINC000565366669 388940648 /nfs/dbraw/zinc/94/06/48/388940648.db2.gz UYGUNALFSZMUCB-NSHDSACASA-N 1 2 238.306 2.414 20 0 BEADLO CCOc1cccc(C[N@H+]2CCC[C@H](F)C2)n1 ZINC000565366669 388940651 /nfs/dbraw/zinc/94/06/51/388940651.db2.gz UYGUNALFSZMUCB-NSHDSACASA-N 1 2 238.306 2.414 20 0 BEADLO Cn1ccc(C[NH2+][C@H]2C[C@]2(F)c2ccccc2)n1 ZINC000566062729 388985863 /nfs/dbraw/zinc/98/58/63/388985863.db2.gz KGFLIXAGWGYUBL-KBPBESRZSA-N 1 2 245.301 2.147 20 0 BEADLO Cc1noc(C)c1CCNc1cccc[nH+]1 ZINC000264499173 388991155 /nfs/dbraw/zinc/99/11/55/388991155.db2.gz HZVJLCFSNZTMKS-UHFFFAOYSA-N 1 2 217.272 2.341 20 0 BEADLO Cc1cscc1C(=O)NCc1[nH]c[nH+]c1C ZINC000267312292 388999489 /nfs/dbraw/zinc/99/94/89/388999489.db2.gz IJAJEQPFZWWGAD-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO Cc1cc(N2CC[C@@H](C)[C@H](C)C2)nc[nH+]1 ZINC000301918323 132258453 /nfs/dbraw/zinc/25/84/53/132258453.db2.gz JSHCIWLSZCRLJC-NXEZZACHSA-N 1 2 205.305 2.267 20 0 BEADLO C[C@@H]1CCCCN1c1[nH+]cnc(N)c1Cl ZINC000235276898 132292545 /nfs/dbraw/zinc/29/25/45/132292545.db2.gz ZSLGGIAGIQFFLM-SSDOTTSWSA-N 1 2 226.711 2.091 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](CO)c2ccccc2)s1 ZINC000273127563 389037180 /nfs/dbraw/zinc/03/71/80/389037180.db2.gz QVDVJSIPGWZWET-LBPRGKRZSA-N 1 2 248.351 2.275 20 0 BEADLO CO[C@@H]1CCC[C@H]1Sc1nc(N)cc(C)[nH+]1 ZINC000273074403 389037613 /nfs/dbraw/zinc/03/76/13/389037613.db2.gz FNIHQUJGLASMME-RKDXNWHRSA-N 1 2 239.344 2.027 20 0 BEADLO COc1ccc2c(c1)[nH+]ccc2OCC[C@H](C)O ZINC000418891171 533313897 /nfs/dbraw/zinc/31/38/97/533313897.db2.gz WWDVJZQGEBBMGS-JTQLQIEISA-N 1 2 247.294 2.393 20 0 BEADLO C[C@H]([NH2+][C@H]1CCCc2nn(C)cc21)c1ccon1 ZINC000530518755 322823342 /nfs/dbraw/zinc/82/33/42/322823342.db2.gz WVQIBEFALBGEKJ-CABZTGNLSA-N 1 2 246.314 2.136 20 0 BEADLO C[C@@H]1CCCC[C@H]1CNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493339774 533593012 /nfs/dbraw/zinc/59/30/12/533593012.db2.gz RMQXKEVXHSDSPR-PBWNMSGQSA-N 1 2 247.342 2.365 20 0 BEADLO C[C@@H]1CCCC[C@H]1N(C)C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493818307 533600310 /nfs/dbraw/zinc/60/03/10/533600310.db2.gz SKHZMYIFKULPAT-IDDPWSFUSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@@H]1CCCN(C(=O)/C=C\c2[nH]cc[nH+]2)[C@H]1C ZINC000493283366 533637938 /nfs/dbraw/zinc/63/79/38/533637938.db2.gz HMXMNCGKUCESTG-MXFLAHGMSA-N 1 2 233.315 2.070 20 0 BEADLO CC[C@H]1CN(c2cccc[nH+]2)C[C@@H](C)O1 ZINC000264714564 132179837 /nfs/dbraw/zinc/17/98/37/132179837.db2.gz GVKSIAFRQBDHQS-MNOVXSKESA-N 1 2 206.289 2.085 20 0 BEADLO Cc1cc(N2C[C@H](C)OC[C@H]2C)nc(C2CC2)[nH+]1 ZINC000265297505 132182341 /nfs/dbraw/zinc/18/23/41/132182341.db2.gz CKQWCXJVSXPIGH-MNOVXSKESA-N 1 2 247.342 2.276 20 0 BEADLO CC[C@@H]1CO[C@H](C)CN1c1cc[nH+]c(C2CC2)n1 ZINC000268024425 132190962 /nfs/dbraw/zinc/19/09/62/132190962.db2.gz IWAQJSXIXXIDMA-ZYHUDNBSSA-N 1 2 247.342 2.358 20 0 BEADLO c1cc(N2CCO[C@H]3CCC[C@@H]32)nc(C2CC2)[nH+]1 ZINC000268016847 132191065 /nfs/dbraw/zinc/19/10/65/132191065.db2.gz GTQCFVHXQVNUNH-RYUDHWBXSA-N 1 2 245.326 2.112 20 0 BEADLO Cc1nc(N2CC[C@@H](C(C)(C)C)[C@H](O)C2)cc[nH+]1 ZINC000273353986 132201918 /nfs/dbraw/zinc/20/19/18/132201918.db2.gz VQSZIJMNOAPXDW-VXGBXAGGSA-N 1 2 249.358 2.018 20 0 BEADLO CC[C@]1(C)CN(c2cccc[nH+]2)CCO1 ZINC000276035490 132205864 /nfs/dbraw/zinc/20/58/64/132205864.db2.gz MPYJJJNTQWMWSX-GFCCVEGCSA-N 1 2 206.289 2.087 20 0 BEADLO CO[C@@H]1CN(c2cc[nH+]c(C3CC3)n2)CC[C@@H]1C ZINC000276012581 132205904 /nfs/dbraw/zinc/20/59/04/132205904.db2.gz MKMRQUQPGGXAFV-CMPLNLGQSA-N 1 2 247.342 2.215 20 0 BEADLO FC1=CCCN(c2cc(N3CCCC3)[nH+]cn2)C1 ZINC000278845084 132208516 /nfs/dbraw/zinc/20/85/16/132208516.db2.gz WPUJBGOXMABVJH-UHFFFAOYSA-N 1 2 248.305 2.140 20 0 BEADLO FC1=CCCN(c2cc(N3CCCC3)nc[nH+]2)C1 ZINC000278845084 132208517 /nfs/dbraw/zinc/20/85/17/132208517.db2.gz WPUJBGOXMABVJH-UHFFFAOYSA-N 1 2 248.305 2.140 20 0 BEADLO Cc1cc(N2CCC[C@]3(CCCOC3)C2)nc[nH+]1 ZINC000353479105 132213045 /nfs/dbraw/zinc/21/30/45/132213045.db2.gz QIJRPCJAATYDBX-AWEZNQCLSA-N 1 2 247.342 2.182 20 0 BEADLO C[C@H]1CCCCN1c1cc(N2CCCC2)[nH+]cn1 ZINC000286842084 132215447 /nfs/dbraw/zinc/21/54/47/132215447.db2.gz FVQPCNMGAYVDPS-LBPRGKRZSA-N 1 2 246.358 2.456 20 0 BEADLO C[C@H]1CCCCN1c1cc(N2CCCC2)nc[nH+]1 ZINC000286842084 132215448 /nfs/dbraw/zinc/21/54/48/132215448.db2.gz FVQPCNMGAYVDPS-LBPRGKRZSA-N 1 2 246.358 2.456 20 0 BEADLO C[C@]1(F)CCCN(c2nc[nH+]c(N)c2Cl)C1 ZINC000294833560 132219488 /nfs/dbraw/zinc/21/94/88/132219488.db2.gz ALKRYELFDWYMCZ-JTQLQIEISA-N 1 2 244.701 2.041 20 0 BEADLO C[C@]1(F)CCCN(c2[nH+]cnc(N)c2Cl)C1 ZINC000294833560 132219490 /nfs/dbraw/zinc/21/94/90/132219490.db2.gz ALKRYELFDWYMCZ-JTQLQIEISA-N 1 2 244.701 2.041 20 0 BEADLO CC[C@H]1COCCN1c1cc(C)[nH+]c(C2CC2)n1 ZINC000341507696 132226407 /nfs/dbraw/zinc/22/64/07/132226407.db2.gz VPRZCNLIBHMZAO-LBPRGKRZSA-N 1 2 247.342 2.278 20 0 BEADLO Cc1cc(N2CC[C@]3(C)[C@H](C2)C3(F)F)nc[nH+]1 ZINC000336497391 132248333 /nfs/dbraw/zinc/24/83/33/132248333.db2.gz NOUJYJFRJOZWJV-GXSJLCMTSA-N 1 2 239.269 2.267 20 0 BEADLO Cc1cc(N2CCC[C@H](C)[C@H]2C)nc[nH+]1 ZINC000301437852 132253546 /nfs/dbraw/zinc/25/35/46/132253546.db2.gz SMUUHYRALKGFPN-GXSJLCMTSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1cc(N2CCOC[C@@H]2CC(C)C)nc[nH+]1 ZINC000301544859 132254454 /nfs/dbraw/zinc/25/44/54/132254454.db2.gz DPBOAOIXUJMGGZ-LBPRGKRZSA-N 1 2 235.331 2.036 20 0 BEADLO Cc1nc(N2CCSCC2)c2c([nH+]1)CCCC2 ZINC000301563562 132255138 /nfs/dbraw/zinc/25/51/38/132255138.db2.gz LEKFRJXFWVZCFQ-UHFFFAOYSA-N 1 2 249.383 2.217 20 0 BEADLO Cc1cc(N2CC[C@H](C)[C@H](C)C2)nc[nH+]1 ZINC000301918325 132258724 /nfs/dbraw/zinc/25/87/24/132258724.db2.gz JSHCIWLSZCRLJC-VHSXEESVSA-N 1 2 205.305 2.267 20 0 BEADLO Cc1cc(N2CCc3cccc(F)c3C2)nc[nH+]1 ZINC000301956035 132259099 /nfs/dbraw/zinc/25/90/99/132259099.db2.gz KTNGDWJORNWSBV-UHFFFAOYSA-N 1 2 243.285 2.487 20 0 BEADLO Cc1cc(N2CCC([C@H]3CCCO3)CC2)nc[nH+]1 ZINC000302571663 132264567 /nfs/dbraw/zinc/26/45/67/132264567.db2.gz QRGBGNGPTVCZPO-CYBMUJFWSA-N 1 2 247.342 2.180 20 0 BEADLO Cc1cc(N2CCC([C@@H]3CCCO3)CC2)nc[nH+]1 ZINC000302571665 132264737 /nfs/dbraw/zinc/26/47/37/132264737.db2.gz QRGBGNGPTVCZPO-ZDUSSCGKSA-N 1 2 247.342 2.180 20 0 BEADLO CC[C@]1(C)CN(c2cc[nH+]c(C3CC3)n2)CCO1 ZINC000302626260 132265122 /nfs/dbraw/zinc/26/51/22/132265122.db2.gz FNNCMBHJEQUOGR-CQSZACIVSA-N 1 2 247.342 2.359 20 0 BEADLO Cc1cc(N2CCC[C@H](CO)C2)nc(C(C)C)[nH+]1 ZINC000032717160 132268054 /nfs/dbraw/zinc/26/80/54/132268054.db2.gz HRWMUONASVAXKO-LBPRGKRZSA-N 1 2 249.358 2.117 20 0 BEADLO Cc1cc(N2CCC[C@@H](CO)C2)nc(C(C)C)[nH+]1 ZINC000032717159 132268240 /nfs/dbraw/zinc/26/82/40/132268240.db2.gz HRWMUONASVAXKO-GFCCVEGCSA-N 1 2 249.358 2.117 20 0 BEADLO CCC1(O)CCN(c2nc(C)[nH+]c(C)c2C)CC1 ZINC000354375901 132269954 /nfs/dbraw/zinc/26/99/54/132269954.db2.gz AZFGQGBMHLSMRP-UHFFFAOYSA-N 1 2 249.358 2.143 20 0 BEADLO CO[C@@H]1CCCN(c2cc(C)[nH+]c(C3CC3)n2)C1 ZINC000354879202 132270429 /nfs/dbraw/zinc/27/04/29/132270429.db2.gz ARGJBKWEGFJGJM-GFCCVEGCSA-N 1 2 247.342 2.278 20 0 BEADLO c1ccc(N2CCC([C@@H]3CCOC3)CC2)[nH+]c1 ZINC000374649300 132287565 /nfs/dbraw/zinc/28/75/65/132287565.db2.gz ZEOVXIGHBRARDQ-CYBMUJFWSA-N 1 2 232.327 2.335 20 0 BEADLO C[C@H]1CCCCN1c1nc[nH+]c(N)c1Cl ZINC000235580798 132292444 /nfs/dbraw/zinc/29/24/44/132292444.db2.gz ZSLGGIAGIQFFLM-ZETCQYMHSA-N 1 2 226.711 2.091 20 0 BEADLO C[C@H]1CCCCN1c1[nH+]cnc(N)c1Cl ZINC000235580798 132292446 /nfs/dbraw/zinc/29/24/46/132292446.db2.gz ZSLGGIAGIQFFLM-ZETCQYMHSA-N 1 2 226.711 2.091 20 0 BEADLO C[C@@H]1CCCCN1c1nc[nH+]c(N)c1Cl ZINC000235276898 132292543 /nfs/dbraw/zinc/29/25/43/132292543.db2.gz ZSLGGIAGIQFFLM-SSDOTTSWSA-N 1 2 226.711 2.091 20 0 BEADLO C[C@H]1COc2ccccc2N1Cc1[nH+]ccn1C ZINC000072825992 132397471 /nfs/dbraw/zinc/39/74/71/132397471.db2.gz QZYNEYPBAGPZGP-NSHDSACASA-N 1 2 243.310 2.208 20 0 BEADLO OC1(CSc2[nH+]cc3ccccn32)CCC1 ZINC000334270000 133609774 /nfs/dbraw/zinc/60/97/74/133609774.db2.gz RLRBDIPZTOCDJA-UHFFFAOYSA-N 1 2 234.324 2.341 20 0 BEADLO C[C@H]1CCCC[C@H]1C(=O)N1CCn2cc[nH+]c2C1 ZINC000335089481 133760836 /nfs/dbraw/zinc/76/08/36/133760836.db2.gz GUZLHUHYUMJBHI-NWDGAFQWSA-N 1 2 247.342 2.052 20 0 BEADLO C[NH2+]Cc1noc(C2(c3ccccc3C)CC2)n1 ZINC000349923555 133926200 /nfs/dbraw/zinc/92/62/00/133926200.db2.gz WYLLAVJJMSVEHQ-UHFFFAOYSA-N 1 2 243.310 2.177 20 0 BEADLO CC1C[NH+](Cc2c(F)ccc(O)c2F)C1 ZINC000335914189 133991787 /nfs/dbraw/zinc/99/17/87/133991787.db2.gz YCJBQVRPDXHKIK-UHFFFAOYSA-N 1 2 213.227 2.122 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nc(C(C)(C)C)no2)[C@H]1C ZINC000335931174 134011048 /nfs/dbraw/zinc/01/10/48/134011048.db2.gz NCPXEICCFHFELP-BDAKNGLRSA-N 1 2 223.320 2.207 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nc(C(C)(C)C)no2)[C@H]1C ZINC000335931174 134011049 /nfs/dbraw/zinc/01/10/49/134011049.db2.gz NCPXEICCFHFELP-BDAKNGLRSA-N 1 2 223.320 2.207 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@](C)(F)C2)cs1 ZINC000335940382 134017029 /nfs/dbraw/zinc/01/70/29/134017029.db2.gz BRHDUKGTPLBSGB-JTQLQIEISA-N 1 2 214.309 2.385 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@](C)(F)C2)cs1 ZINC000335940382 134017030 /nfs/dbraw/zinc/01/70/30/134017030.db2.gz BRHDUKGTPLBSGB-JTQLQIEISA-N 1 2 214.309 2.385 20 0 BEADLO Cc1cc(NC(=O)N(C)[C@@H](C)C(C)C)cc[nH+]1 ZINC000335940750 134017337 /nfs/dbraw/zinc/01/73/37/134017337.db2.gz KWGQJYGWLRHFFG-NSHDSACASA-N 1 2 235.331 2.320 20 0 BEADLO O=C(CC1CCC1)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000335957511 134023581 /nfs/dbraw/zinc/02/35/81/134023581.db2.gz CNDOQTBZTMBHIL-LLVKDONJSA-N 1 2 233.315 2.263 20 0 BEADLO c1nc(C[N@@H+]2CCC[C@@H]2c2cccnc2)c[nH]1 ZINC000335959332 134024165 /nfs/dbraw/zinc/02/41/65/134024165.db2.gz ZNJQCMDJTDOECK-CYBMUJFWSA-N 1 2 228.299 2.142 20 0 BEADLO c1nc(C[N@H+]2CCC[C@@H]2c2cccnc2)c[nH]1 ZINC000335959332 134024166 /nfs/dbraw/zinc/02/41/66/134024166.db2.gz ZNJQCMDJTDOECK-CYBMUJFWSA-N 1 2 228.299 2.142 20 0 BEADLO c1ncc(C[N@@H+]2CCC[C@@H]2c2cccnc2)[nH]1 ZINC000335959332 134024167 /nfs/dbraw/zinc/02/41/67/134024167.db2.gz ZNJQCMDJTDOECK-CYBMUJFWSA-N 1 2 228.299 2.142 20 0 BEADLO c1ncc(C[N@H+]2CCC[C@@H]2c2cccnc2)[nH]1 ZINC000335959332 134024168 /nfs/dbraw/zinc/02/41/68/134024168.db2.gz ZNJQCMDJTDOECK-CYBMUJFWSA-N 1 2 228.299 2.142 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC(C)C1 ZINC000335963014 134027229 /nfs/dbraw/zinc/02/72/29/134027229.db2.gz JOVUCLFOMJNNLD-UHFFFAOYSA-N 1 2 219.288 2.182 20 0 BEADLO c1csc(CN2CCC[C@H]2c2[nH]cc[nH+]2)n1 ZINC000335966218 134028612 /nfs/dbraw/zinc/02/86/12/134028612.db2.gz XTNZAYFZIZMJCB-VIFPVBQESA-N 1 2 234.328 2.203 20 0 BEADLO Cc1noc(C)c1CC[N@@H+]1CCC=C(F)C1 ZINC000335969150 134029173 /nfs/dbraw/zinc/02/91/73/134029173.db2.gz ZEFGTDWPHAPKOK-UHFFFAOYSA-N 1 2 224.279 2.393 20 0 BEADLO Cc1noc(C)c1CC[N@H+]1CCC=C(F)C1 ZINC000335969150 134029174 /nfs/dbraw/zinc/02/91/74/134029174.db2.gz ZEFGTDWPHAPKOK-UHFFFAOYSA-N 1 2 224.279 2.393 20 0 BEADLO c1cc2c(o1)CCC[N@@H+](Cc1ncccn1)C2 ZINC000335991991 134040593 /nfs/dbraw/zinc/04/05/93/134040593.db2.gz KSZABLYJWSZWFB-UHFFFAOYSA-N 1 2 229.283 2.018 20 0 BEADLO c1cc2c(o1)CCC[N@H+](Cc1ncccn1)C2 ZINC000335991991 134040594 /nfs/dbraw/zinc/04/05/94/134040594.db2.gz KSZABLYJWSZWFB-UHFFFAOYSA-N 1 2 229.283 2.018 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCCc3occc3C2)n1 ZINC000335992108 134040881 /nfs/dbraw/zinc/04/08/81/134040881.db2.gz PFSVLWKMWUHEPA-UHFFFAOYSA-N 1 2 243.310 2.326 20 0 BEADLO Cc1ccnc(C[N@H+]2CCCc3occc3C2)n1 ZINC000335992108 134040882 /nfs/dbraw/zinc/04/08/82/134040882.db2.gz PFSVLWKMWUHEPA-UHFFFAOYSA-N 1 2 243.310 2.326 20 0 BEADLO Cn1ncc(Cl)c1C[N@@H+]1CCCSCC1 ZINC000335996975 134042671 /nfs/dbraw/zinc/04/26/71/134042671.db2.gz MVNQLRYNWKSWIX-UHFFFAOYSA-N 1 2 245.779 2.012 20 0 BEADLO Cn1ncc(Cl)c1C[N@H+]1CCCSCC1 ZINC000335996975 134042672 /nfs/dbraw/zinc/04/26/72/134042672.db2.gz MVNQLRYNWKSWIX-UHFFFAOYSA-N 1 2 245.779 2.012 20 0 BEADLO C[C@@H]1C[C@@H]1CC(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000336002561 134047852 /nfs/dbraw/zinc/04/78/52/134047852.db2.gz NYEXSBWJYSMMCZ-VXGBXAGGSA-N 1 2 247.342 2.093 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2CC(C)=C[C@@H](C)C2)no1 ZINC000336006838 134049349 /nfs/dbraw/zinc/04/93/49/134049349.db2.gz QLHBYTWWIFGTOZ-SCZZXKLOSA-N 1 2 221.304 2.337 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2CC(C)=C[C@@H](C)C2)no1 ZINC000336006838 134049350 /nfs/dbraw/zinc/04/93/50/134049350.db2.gz QLHBYTWWIFGTOZ-SCZZXKLOSA-N 1 2 221.304 2.337 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2CC(C)=C[C@H](C)C2)no1 ZINC000336006840 134049414 /nfs/dbraw/zinc/04/94/14/134049414.db2.gz QLHBYTWWIFGTOZ-WPRPVWTQSA-N 1 2 221.304 2.337 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2CC(C)=C[C@H](C)C2)no1 ZINC000336006840 134049415 /nfs/dbraw/zinc/04/94/15/134049415.db2.gz QLHBYTWWIFGTOZ-WPRPVWTQSA-N 1 2 221.304 2.337 20 0 BEADLO c1cc(C[N@@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)no1 ZINC000336007681 134049960 /nfs/dbraw/zinc/04/99/60/134049960.db2.gz ULZYUABJSVGFPA-QWHCGFSZSA-N 1 2 248.326 2.208 20 0 BEADLO c1cc(C[N@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)no1 ZINC000336007681 134049961 /nfs/dbraw/zinc/04/99/61/134049961.db2.gz ULZYUABJSVGFPA-QWHCGFSZSA-N 1 2 248.326 2.208 20 0 BEADLO C[C@H]1C[C@H]1CC(=O)Nc1cccc2[nH+]ccn21 ZINC000336016995 134053309 /nfs/dbraw/zinc/05/33/09/134053309.db2.gz WGABCLYIAHMDQB-UWVGGRQHSA-N 1 2 229.283 2.319 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1cnccc1C ZINC000336018932 134053748 /nfs/dbraw/zinc/05/37/48/134053748.db2.gz FQLDKSOEIMBAHZ-UHFFFAOYSA-N 1 2 241.294 2.022 20 0 BEADLO C[C@H]1CCC[C@@H](C(=O)N2CCn3c[nH+]cc3C2)C1 ZINC000336019466 134054066 /nfs/dbraw/zinc/05/40/66/134054066.db2.gz KRJCCZZSXROLGB-NWDGAFQWSA-N 1 2 247.342 2.052 20 0 BEADLO C[C@H]1C[C@@H]1C[NH+]=c1[nH]c2c(cccc2F)n1C ZINC000352075232 134055583 /nfs/dbraw/zinc/05/55/83/134055583.db2.gz CATFDTYGANZYRL-DTWKUNHWSA-N 1 2 233.290 2.202 20 0 BEADLO C[C@@H]1C[C@H]1C[NH+]=c1[nH]c2c(cccc2F)n1C ZINC000352075231 134055652 /nfs/dbraw/zinc/05/56/52/134055652.db2.gz CATFDTYGANZYRL-BDAKNGLRSA-N 1 2 233.290 2.202 20 0 BEADLO Cn1nccc1C[NH+]1CC(c2ccccc2F)C1 ZINC000336032289 134058596 /nfs/dbraw/zinc/05/85/96/134058596.db2.gz MAFYQZWMNSRFID-UHFFFAOYSA-N 1 2 245.301 2.159 20 0 BEADLO O=C(Nc1ccccc1)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000336044646 134063002 /nfs/dbraw/zinc/06/30/02/134063002.db2.gz KRFRYZAQEMZAQP-NSHDSACASA-N 1 2 241.294 2.468 20 0 BEADLO CC(C)(C)c1nnc(C[N@@H+]2CCCC3(CC3)C2)[nH]1 ZINC000336136690 134096347 /nfs/dbraw/zinc/09/63/47/134096347.db2.gz AUUXVNXWCGGAPD-UHFFFAOYSA-N 1 2 248.374 2.478 20 0 BEADLO CC(C)(C)c1nnc(C[N@H+]2CCCC3(CC3)C2)[nH]1 ZINC000336136690 134096348 /nfs/dbraw/zinc/09/63/48/134096348.db2.gz AUUXVNXWCGGAPD-UHFFFAOYSA-N 1 2 248.374 2.478 20 0 BEADLO Cn1c[nH+]cc1CNC1(C(F)F)CCCCC1 ZINC000352205259 134104999 /nfs/dbraw/zinc/10/49/99/134104999.db2.gz ZUMUJDHRVARRGT-UHFFFAOYSA-N 1 2 243.301 2.478 20 0 BEADLO C[C@H]1CCC[C@@H](c2noc(C[NH+](C)C)n2)C1 ZINC000336182559 134120051 /nfs/dbraw/zinc/12/00/51/134120051.db2.gz XXHZBCBCOGKHLI-VHSXEESVSA-N 1 2 223.320 2.425 20 0 BEADLO C[C@@H]1CCC[C@H](c2noc(C[NH+](C)C)n2)C1 ZINC000336182560 134120384 /nfs/dbraw/zinc/12/03/84/134120384.db2.gz XXHZBCBCOGKHLI-ZJUUUORDSA-N 1 2 223.320 2.425 20 0 BEADLO Cc1cc(N2CC[C@H](F)C2)nc(C(C)C)[nH+]1 ZINC000336188980 134122565 /nfs/dbraw/zinc/12/25/65/134122565.db2.gz RDNUVJLGTQZGKN-JTQLQIEISA-N 1 2 223.295 2.457 20 0 BEADLO C[C@H](c1csnn1)[N@@H+]1CCC[C@@H](C)C1 ZINC000336189622 134123091 /nfs/dbraw/zinc/12/30/91/134123091.db2.gz IDEBEWODGPXZLQ-RKDXNWHRSA-N 1 2 211.334 2.331 20 0 BEADLO C[C@H](c1csnn1)[N@H+]1CCC[C@@H](C)C1 ZINC000336189622 134123092 /nfs/dbraw/zinc/12/30/92/134123092.db2.gz IDEBEWODGPXZLQ-RKDXNWHRSA-N 1 2 211.334 2.331 20 0 BEADLO CC(C)[C@H]1CCC[N@H+](Cc2cn[nH]n2)CC1 ZINC000336190487 134123585 /nfs/dbraw/zinc/12/35/85/134123585.db2.gz JMGJEFPCWPFRLS-NSHDSACASA-N 1 2 222.336 2.063 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@]1(C)CCC[C@@H]1C ZINC000336210887 134134266 /nfs/dbraw/zinc/13/42/66/134134266.db2.gz PWGZIYDPXVVIRQ-ZANVPECISA-N 1 2 235.331 2.161 20 0 BEADLO CC(C)(C(=O)Nc1ccc(F)cc1)c1c[nH+]c[nH]1 ZINC000336211212 134134476 /nfs/dbraw/zinc/13/44/76/134134476.db2.gz ZQGYXKDJKYTTCU-UHFFFAOYSA-N 1 2 247.273 2.465 20 0 BEADLO CC(C)(C(=O)Nc1ccc(F)cc1)c1c[nH]c[nH+]1 ZINC000336211212 134134477 /nfs/dbraw/zinc/13/44/77/134134477.db2.gz ZQGYXKDJKYTTCU-UHFFFAOYSA-N 1 2 247.273 2.465 20 0 BEADLO C[C@H]([NH2+]Cc1ccn[nH]1)[C@H]1COc2ccccc21 ZINC000169170776 134249465 /nfs/dbraw/zinc/24/94/65/134249465.db2.gz PWSWMOVKRFJDGN-GXFFZTMASA-N 1 2 243.310 2.064 20 0 BEADLO CC(C)n1ccnc1C[N@H+](C)C[C@H]1CCCO1 ZINC000171145211 134257341 /nfs/dbraw/zinc/25/73/41/134257341.db2.gz YGOSKIHTQHCQOP-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccnc1C[N@@H+](C)C[C@H]1CCCO1 ZINC000171145211 134257342 /nfs/dbraw/zinc/25/73/42/134257342.db2.gz YGOSKIHTQHCQOP-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)COC1CC[NH+](Cc2ncc[nH]2)CC1 ZINC000171919420 134263097 /nfs/dbraw/zinc/26/30/97/134263097.db2.gz NKDPEVANTBRHQH-UHFFFAOYSA-N 1 2 237.347 2.047 20 0 BEADLO Cc1cc(NC(=O)[C@H]2C[C@@H]2C2CC2)cc[nH+]1 ZINC000175861706 134288254 /nfs/dbraw/zinc/28/82/54/134288254.db2.gz PDQKLJIHVDHKKV-NEPJUHHUSA-N 1 2 216.284 2.375 20 0 BEADLO Cc1cc(NC(=O)N2CCCO[C@H](C)C2)cc[nH+]1 ZINC000179822288 134324310 /nfs/dbraw/zinc/32/43/10/134324310.db2.gz RBCNLMWZWNWOSZ-LLVKDONJSA-N 1 2 249.314 2.033 20 0 BEADLO COC(=O)c1occc1CNc1c[nH+]cc(C)c1 ZINC000224916946 134352278 /nfs/dbraw/zinc/35/22/78/134352278.db2.gz ZJESGNYCYBJDDG-UHFFFAOYSA-N 1 2 246.266 2.382 20 0 BEADLO Cc1nnc(NCc2cn3ccccc3[nH+]2)s1 ZINC000226140796 134359521 /nfs/dbraw/zinc/35/95/21/134359521.db2.gz DICICJYREBBJJI-UHFFFAOYSA-N 1 2 245.311 2.106 20 0 BEADLO Cc1oncc1C[N@@H+]1CCC[C@@H](c2ccn[nH]2)C1 ZINC000185194322 134372616 /nfs/dbraw/zinc/37/26/16/134372616.db2.gz CNMKOOWNVAEIAY-LLVKDONJSA-N 1 2 246.314 2.086 20 0 BEADLO Cc1oncc1C[N@H+]1CCC[C@@H](c2ccn[nH]2)C1 ZINC000185194322 134372617 /nfs/dbraw/zinc/37/26/17/134372617.db2.gz CNMKOOWNVAEIAY-LLVKDONJSA-N 1 2 246.314 2.086 20 0 BEADLO Cc1ccc(CS(=O)(=O)CC2CC2)c(C)[nH+]1 ZINC000185243750 134375556 /nfs/dbraw/zinc/37/55/56/134375556.db2.gz NKULWXWNIIOWQF-UHFFFAOYSA-N 1 2 239.340 2.023 20 0 BEADLO CCc1nc(C[N@H+](C)C2CCCCC2)no1 ZINC000054316300 134388655 /nfs/dbraw/zinc/38/86/55/134388655.db2.gz YEFGMTKNXHLUIB-UHFFFAOYSA-N 1 2 223.320 2.397 20 0 BEADLO CCc1nc(C[N@@H+](C)C2CCCCC2)no1 ZINC000054316300 134388657 /nfs/dbraw/zinc/38/86/57/134388657.db2.gz YEFGMTKNXHLUIB-UHFFFAOYSA-N 1 2 223.320 2.397 20 0 BEADLO COC(=O)c1ccc(CNc2c[nH+]cc(C)c2)[nH]1 ZINC000227836813 134389827 /nfs/dbraw/zinc/38/98/27/134389827.db2.gz AWCCPFMJHXSPCL-UHFFFAOYSA-N 1 2 245.282 2.117 20 0 BEADLO Cc1cc(NCCC[C@@H](C)O)nc(C(C)C)[nH+]1 ZINC000227995615 134396464 /nfs/dbraw/zinc/39/64/64/134396464.db2.gz BEVNPOQDTREGHS-LLVKDONJSA-N 1 2 237.347 2.481 20 0 BEADLO COC[C@@H](CCO)Nc1ccc2ccccc2[nH+]1 ZINC000228294975 134412539 /nfs/dbraw/zinc/41/25/39/134412539.db2.gz GCBUNJIIWOPERF-GFCCVEGCSA-N 1 2 246.310 2.044 20 0 BEADLO CO[C@@H](C)C[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000248424923 135007976 /nfs/dbraw/zinc/00/79/76/135007976.db2.gz NSUZWRLHICRHAT-CMPLNLGQSA-N 1 2 241.356 2.156 20 0 BEADLO CO[C@@H](C)C[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000248424923 135007978 /nfs/dbraw/zinc/00/79/78/135007978.db2.gz NSUZWRLHICRHAT-CMPLNLGQSA-N 1 2 241.356 2.156 20 0 BEADLO CCC[C@@H]1C[N@@H+]([C@H](C)c2cnccn2)CCO1 ZINC000248617317 135017187 /nfs/dbraw/zinc/01/71/87/135017187.db2.gz KSVKCJSJRXCDBG-VXGBXAGGSA-N 1 2 235.331 2.039 20 0 BEADLO CCC[C@@H]1C[N@H+]([C@H](C)c2cnccn2)CCO1 ZINC000248617317 135017188 /nfs/dbraw/zinc/01/71/88/135017188.db2.gz KSVKCJSJRXCDBG-VXGBXAGGSA-N 1 2 235.331 2.039 20 0 BEADLO COc1ccccc1/C=C\C[N@@H+]1CCO[C@@H](C)C1 ZINC000255324711 135129157 /nfs/dbraw/zinc/12/91/57/135129157.db2.gz WYQFVWNMHCKAIH-VGVVRCBHSA-N 1 2 247.338 2.429 20 0 BEADLO COc1ccccc1/C=C\C[N@H+]1CCO[C@@H](C)C1 ZINC000255324711 135129158 /nfs/dbraw/zinc/12/91/58/135129158.db2.gz WYQFVWNMHCKAIH-VGVVRCBHSA-N 1 2 247.338 2.429 20 0 BEADLO Cc1nc(C)c(C[N@H+](C)Cc2ccon2)s1 ZINC000266001232 135146889 /nfs/dbraw/zinc/14/68/89/135146889.db2.gz NYOQFZSTCYFMAD-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1nc(C)c(C[N@@H+](C)Cc2ccon2)s1 ZINC000266001232 135146891 /nfs/dbraw/zinc/14/68/91/135146891.db2.gz NYOQFZSTCYFMAD-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1cc(NC[C@H]2CCCCS2)nc[nH+]1 ZINC000087686126 135165575 /nfs/dbraw/zinc/16/55/75/135165575.db2.gz GMKIFKWMIKOXIO-SNVBAGLBSA-N 1 2 223.345 2.483 20 0 BEADLO O=C(NCc1c[nH+]c[nH]1)c1ccc(Cl)s1 ZINC000084081606 135182459 /nfs/dbraw/zinc/18/24/59/135182459.db2.gz SYERDTRCFUXWGJ-UHFFFAOYSA-N 1 2 241.703 2.055 20 0 BEADLO O=C(NCc1c[nH]c[nH+]1)c1ccc(Cl)s1 ZINC000084081606 135182461 /nfs/dbraw/zinc/18/24/61/135182461.db2.gz SYERDTRCFUXWGJ-UHFFFAOYSA-N 1 2 241.703 2.055 20 0 BEADLO Cc1ccc([C@@H]([NH3+])c2nc(CC3CC3)no2)cc1 ZINC000261716641 135247507 /nfs/dbraw/zinc/24/75/07/135247507.db2.gz JIDILDTYVBIIJC-CYBMUJFWSA-N 1 2 243.310 2.379 20 0 BEADLO C[C@@H]1C[C@@H](C)N(c2cc(N3CCCC3)[nH+]cn2)C1 ZINC000342350544 135261107 /nfs/dbraw/zinc/26/11/07/135261107.db2.gz PKUNQXTWXVFHCV-VXGBXAGGSA-N 1 2 246.358 2.312 20 0 BEADLO C[C@@H]1C[C@@H](C)N(c2cc(N3CCCC3)nc[nH+]2)C1 ZINC000342350544 135261109 /nfs/dbraw/zinc/26/11/09/135261109.db2.gz PKUNQXTWXVFHCV-VXGBXAGGSA-N 1 2 246.358 2.312 20 0 BEADLO C[C@@H]1C[C@H](C)N(c2cc(N3CCCC3)[nH+]cn2)C1 ZINC000342350541 135261637 /nfs/dbraw/zinc/26/16/37/135261637.db2.gz PKUNQXTWXVFHCV-NEPJUHHUSA-N 1 2 246.358 2.312 20 0 BEADLO C[C@@H]1C[C@H](C)N(c2cc(N3CCCC3)nc[nH+]2)C1 ZINC000342350541 135261638 /nfs/dbraw/zinc/26/16/38/135261638.db2.gz PKUNQXTWXVFHCV-NEPJUHHUSA-N 1 2 246.358 2.312 20 0 BEADLO Cc1c[nH+]c(CN2CCc3ccccc32)n1C ZINC000342725858 135316057 /nfs/dbraw/zinc/31/60/57/135316057.db2.gz JKAOIVAJAKKSMN-UHFFFAOYSA-N 1 2 227.311 2.291 20 0 BEADLO Cc1c[nH+]c(CN(C)Cc2ccoc2C)n1C ZINC000342783572 135317185 /nfs/dbraw/zinc/31/71/85/135317185.db2.gz QEHCTYOAPNLHOG-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO Cc1c[nH+]c(CN2CCc3sccc3C2)n1C ZINC000342797671 135321253 /nfs/dbraw/zinc/32/12/53/135321253.db2.gz HJWAWUJTVOOUFQ-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)C(C)(C)c2c[nH]c[nH+]2)C1 ZINC000334307297 135350198 /nfs/dbraw/zinc/35/01/98/135350198.db2.gz HQJPANRVURFXRF-GHMZBOCLSA-N 1 2 249.358 2.382 20 0 BEADLO Fc1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)cc1 ZINC000334329816 135354944 /nfs/dbraw/zinc/35/49/44/135354944.db2.gz JQZLZLNVDHAHOM-BETUJISGSA-N 1 2 221.275 2.189 20 0 BEADLO Fc1ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)cc1 ZINC000334329816 135354945 /nfs/dbraw/zinc/35/49/45/135354945.db2.gz JQZLZLNVDHAHOM-BETUJISGSA-N 1 2 221.275 2.189 20 0 BEADLO CC(=O)N(Cc1[nH]cc[nH+]1)c1cccc(F)c1 ZINC000334350876 135369042 /nfs/dbraw/zinc/36/90/42/135369042.db2.gz FRFSQLYXWNUWNB-UHFFFAOYSA-N 1 2 233.246 2.102 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CC[C@@](C)(F)C2)cn1 ZINC000334354129 135370257 /nfs/dbraw/zinc/37/02/57/135370257.db2.gz JGINJPIZHRHQCI-GFCCVEGCSA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1cc(C[N@H+]2CC[C@@](C)(F)C2)cn1 ZINC000334354129 135370259 /nfs/dbraw/zinc/37/02/59/135370259.db2.gz JGINJPIZHRHQCI-GFCCVEGCSA-N 1 2 225.311 2.398 20 0 BEADLO CC1=CCC[N@H+](Cc2ncnn2C(C)(C)C)C1 ZINC000334385423 135381917 /nfs/dbraw/zinc/38/19/17/135381917.db2.gz MYODOILDFBTCFR-UHFFFAOYSA-N 1 2 234.347 2.185 20 0 BEADLO CC1=CCC[N@@H+](Cc2ncnn2C(C)(C)C)C1 ZINC000334385423 135381918 /nfs/dbraw/zinc/38/19/18/135381918.db2.gz MYODOILDFBTCFR-UHFFFAOYSA-N 1 2 234.347 2.185 20 0 BEADLO Cc1cc(N2CC[C@H](C)[C@H]2CO)nc(C(C)C)[nH+]1 ZINC000299963637 135383018 /nfs/dbraw/zinc/38/30/18/135383018.db2.gz KXKQZSBDAKTQRB-CMPLNLGQSA-N 1 2 249.358 2.116 20 0 BEADLO Cc1cc(C[NH2+]Cc2sc(C)nc2C)no1 ZINC000080706825 135383717 /nfs/dbraw/zinc/38/37/17/135383717.db2.gz VQGWPFIRGZIVHL-UHFFFAOYSA-N 1 2 237.328 2.346 20 0 BEADLO CC(C)[C@@H](C)CNc1[nH+]cnc2c1cnn2C ZINC000081070417 135386724 /nfs/dbraw/zinc/38/67/24/135386724.db2.gz IYZXVVIUUVPACH-VIFPVBQESA-N 1 2 233.319 2.067 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1csnc1C ZINC000334425988 135397774 /nfs/dbraw/zinc/39/77/74/135397774.db2.gz YEWBKISOCSFOKQ-UHFFFAOYSA-N 1 2 247.323 2.083 20 0 BEADLO C[C@](CO)(CNc1cccc[nH+]1)c1ccccc1 ZINC000343800136 135696632 /nfs/dbraw/zinc/69/66/32/135696632.db2.gz YCQOZNNMDISQCF-OAHLLOKOSA-N 1 2 242.322 2.444 20 0 BEADLO C[C@H]1OCC[C@@H]1Nc1ccc(N2CCCC2)c[nH+]1 ZINC000346423083 135926911 /nfs/dbraw/zinc/92/69/11/135926911.db2.gz ZCDMIQBQHKZSNO-YPMHNXCESA-N 1 2 247.342 2.271 20 0 BEADLO CCn1c[nH+]cc1CN1CC[C@H](C)C(F)(F)C1 ZINC000335295436 136006017 /nfs/dbraw/zinc/00/60/17/136006017.db2.gz KWHLJRKTGIWUFZ-JTQLQIEISA-N 1 2 243.301 2.380 20 0 BEADLO CCc1csc(N(C)Cc2[nH+]ccn2C)n1 ZINC000347899759 136015787 /nfs/dbraw/zinc/01/57/87/136015787.db2.gz KVRYXBABPJISDV-UHFFFAOYSA-N 1 2 236.344 2.075 20 0 BEADLO Cc1cnn(C)c1C[N@H+](C)Cc1cccc(C)n1 ZINC000347856942 136016275 /nfs/dbraw/zinc/01/62/75/136016275.db2.gz CBPALYHLUKRKFF-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cnn(C)c1C[N@@H+](C)Cc1cccc(C)n1 ZINC000347856942 136016276 /nfs/dbraw/zinc/01/62/76/136016276.db2.gz CBPALYHLUKRKFF-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO COC1CCC(CCNc2cc(C)[nH+]cn2)CC1 ZINC000347878517 136017098 /nfs/dbraw/zinc/01/70/98/136017098.db2.gz MUHJPIYRYMXIGG-UHFFFAOYSA-N 1 2 249.358 2.214 20 0 BEADLO C[C@@H]1CC[C@@H](NC(=O)CCn2cc[nH+]c2)C[C@H]1C ZINC000348083385 136034761 /nfs/dbraw/zinc/03/47/61/136034761.db2.gz WYCSRORCQNWGPL-JHJVBQTASA-N 1 2 249.358 2.214 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCC[C@H]1c1cc[nH]n1 ZINC000348147607 136039200 /nfs/dbraw/zinc/03/92/00/136039200.db2.gz GTLAJBBCRNGMDN-KOLCDFICSA-N 1 2 211.284 2.295 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCC[C@H]1c1cc[nH]n1 ZINC000348147607 136039201 /nfs/dbraw/zinc/03/92/01/136039201.db2.gz GTLAJBBCRNGMDN-KOLCDFICSA-N 1 2 211.284 2.295 20 0 BEADLO Cc1nc(CC[N@@H+](C)Cc2ccon2)cs1 ZINC000348210243 136044958 /nfs/dbraw/zinc/04/49/58/136044958.db2.gz LXYJDTNAPNWFRP-UHFFFAOYSA-N 1 2 237.328 2.114 20 0 BEADLO Cc1nc(CC[N@H+](C)Cc2ccon2)cs1 ZINC000348210243 136044959 /nfs/dbraw/zinc/04/49/59/136044959.db2.gz LXYJDTNAPNWFRP-UHFFFAOYSA-N 1 2 237.328 2.114 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@H](C3CC3)C2)cn1 ZINC000348189938 136048748 /nfs/dbraw/zinc/04/87/48/136048748.db2.gz ZATCHHYKSIIGAS-HNNXBMFYSA-N 1 2 246.354 2.255 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@H](C3CC3)C2)cn1 ZINC000348189938 136048749 /nfs/dbraw/zinc/04/87/49/136048749.db2.gz ZATCHHYKSIIGAS-HNNXBMFYSA-N 1 2 246.354 2.255 20 0 BEADLO C=Cn1cc(C[NH+]2CC3(CCC3(F)F)C2)cn1 ZINC000335328900 136053276 /nfs/dbraw/zinc/05/32/76/136053276.db2.gz HVGXHUDJWQJMAI-UHFFFAOYSA-N 1 2 239.269 2.215 20 0 BEADLO CC1=C[C@H](C)C[N@@H+](Cc2ncnn2C(C)C)C1 ZINC000335332780 136054423 /nfs/dbraw/zinc/05/44/23/136054423.db2.gz KKOBDKMBWYEZJE-NSHDSACASA-N 1 2 234.347 2.257 20 0 BEADLO CC1=C[C@H](C)C[N@H+](Cc2ncnn2C(C)C)C1 ZINC000335332780 136054424 /nfs/dbraw/zinc/05/44/24/136054424.db2.gz KKOBDKMBWYEZJE-NSHDSACASA-N 1 2 234.347 2.257 20 0 BEADLO O[C@H]1CCCN(c2[nH+]ccc3cc(F)ccc32)C1 ZINC000335356664 136069603 /nfs/dbraw/zinc/06/96/03/136069603.db2.gz HOUFHZBANTVDCZ-LBPRGKRZSA-N 1 2 246.285 2.335 20 0 BEADLO CC(C)n1cc(C[N@H+](C)[C@@H]2CC2(C)C)nn1 ZINC000348357960 136072539 /nfs/dbraw/zinc/07/25/39/136072539.db2.gz PTFZLXGJJXDFKT-LLVKDONJSA-N 1 2 222.336 2.089 20 0 BEADLO CC(C)n1cc(C[N@@H+](C)[C@@H]2CC2(C)C)nn1 ZINC000348357960 136072540 /nfs/dbraw/zinc/07/25/40/136072540.db2.gz PTFZLXGJJXDFKT-LLVKDONJSA-N 1 2 222.336 2.089 20 0 BEADLO CN(c1[nH+]ccc2cc(F)ccc21)C1CC(O)C1 ZINC000335356741 136074577 /nfs/dbraw/zinc/07/45/77/136074577.db2.gz JKXKDVIMQGUYSQ-UHFFFAOYSA-N 1 2 246.285 2.333 20 0 BEADLO OCC1(CNc2cccc[nH+]2)CCCC1 ZINC000166139741 136077203 /nfs/dbraw/zinc/07/72/03/136077203.db2.gz BNVUTDAXGPPARG-UHFFFAOYSA-N 1 2 206.289 2.046 20 0 BEADLO Cc1nc(N[C@@H]2CCC[C@H](F)C2)cc[nH+]1 ZINC000335379758 136087086 /nfs/dbraw/zinc/08/70/86/136087086.db2.gz MOCITUCGSILPLB-VHSXEESVSA-N 1 2 209.268 2.478 20 0 BEADLO C[C@@H]1[C@H](O)CCC[N@@H+]1Cc1ncc(Cl)s1 ZINC000335364058 136095113 /nfs/dbraw/zinc/09/51/13/136095113.db2.gz STBPIEMAUHGZFI-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H]1[C@H](O)CCC[N@H+]1Cc1ncc(Cl)s1 ZINC000335364058 136095114 /nfs/dbraw/zinc/09/51/14/136095114.db2.gz STBPIEMAUHGZFI-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H](C(=O)N(C)Cc1[nH]cc[nH+]1)c1cccs1 ZINC000348537945 136095407 /nfs/dbraw/zinc/09/54/07/136095407.db2.gz ZLMNAXDILVGKRV-SECBINFHSA-N 1 2 249.339 2.233 20 0 BEADLO C[C@H](C(=O)N(C)Cc1[nH]cc[nH+]1)c1cccs1 ZINC000348537946 136095581 /nfs/dbraw/zinc/09/55/81/136095581.db2.gz ZLMNAXDILVGKRV-VIFPVBQESA-N 1 2 249.339 2.233 20 0 BEADLO C[C@@H]1CCC[N@@H+]1Cc1nn(C)cc1Cl ZINC000335550547 136098205 /nfs/dbraw/zinc/09/82/05/136098205.db2.gz MCZYBDCRDIVXOH-MRVPVSSYSA-N 1 2 213.712 2.058 20 0 BEADLO C[C@@H]1CCC[N@H+]1Cc1nn(C)cc1Cl ZINC000335550547 136098206 /nfs/dbraw/zinc/09/82/06/136098206.db2.gz MCZYBDCRDIVXOH-MRVPVSSYSA-N 1 2 213.712 2.058 20 0 BEADLO C[C@H]1CCC[N@@H+]1Cc1nn(C)cc1Cl ZINC000335550548 136098058 /nfs/dbraw/zinc/09/80/58/136098058.db2.gz MCZYBDCRDIVXOH-QMMMGPOBSA-N 1 2 213.712 2.058 20 0 BEADLO C[C@H]1CCC[N@H+]1Cc1nn(C)cc1Cl ZINC000335550548 136098059 /nfs/dbraw/zinc/09/80/59/136098059.db2.gz MCZYBDCRDIVXOH-QMMMGPOBSA-N 1 2 213.712 2.058 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2CCC(=O)C2)c(C)[nH+]1 ZINC000335551139 136098135 /nfs/dbraw/zinc/09/81/35/136098135.db2.gz MTQSIYZQPDWAIJ-JTQLQIEISA-N 1 2 232.283 2.006 20 0 BEADLO Cc1cc(C)n(Cc2c[nH+]ccc2C)n1 ZINC000335596165 136105062 /nfs/dbraw/zinc/10/50/62/136105062.db2.gz PFYYWQKIOLQJMV-UHFFFAOYSA-N 1 2 201.273 2.252 20 0 BEADLO CC(C)[C@H]1C[N@H+](Cc2cnns2)CCS1 ZINC000335570625 136109027 /nfs/dbraw/zinc/10/90/27/136109027.db2.gz WWJQJOBDIGZUBY-SNVBAGLBSA-N 1 2 243.401 2.112 20 0 BEADLO CC(C)[C@H]1C[N@@H+](Cc2cnns2)CCS1 ZINC000335570625 136109028 /nfs/dbraw/zinc/10/90/28/136109028.db2.gz WWJQJOBDIGZUBY-SNVBAGLBSA-N 1 2 243.401 2.112 20 0 BEADLO CCc1[nH]c(CNC(=O)CC(CC)CC)c[nH+]1 ZINC001646326359 1172731945 /nfs/dbraw/zinc/73/19/45/1172731945.db2.gz YTQVFSDTULPLEK-UHFFFAOYSA-N 1 2 237.347 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)CC(CC)CC)[nH+]1 ZINC001646326359 1172731951 /nfs/dbraw/zinc/73/19/51/1172731951.db2.gz YTQVFSDTULPLEK-UHFFFAOYSA-N 1 2 237.347 2.415 20 0 BEADLO C[C@H](O)[C@H](C)[NH+]1Cc2cc(F)c(F)cc2C1 ZINC001646448031 1172740460 /nfs/dbraw/zinc/74/04/60/1172740460.db2.gz DPEGSCPIHSLVFM-YUMQZZPRSA-N 1 2 227.254 2.050 20 0 BEADLO C[C@@H](O)[C@H](C)[NH+]1Cc2cc(F)c(F)cc2C1 ZINC001646448029 1172740748 /nfs/dbraw/zinc/74/07/48/1172740748.db2.gz DPEGSCPIHSLVFM-JGVFFNPUSA-N 1 2 227.254 2.050 20 0 BEADLO C[C@@H]1OCC[N@H+](Cc2ccccc2F)[C@H]1C ZINC000156323468 397758122 /nfs/dbraw/zinc/75/81/22/397758122.db2.gz JSAGUKYBDWHQNO-QWRGUYRKSA-N 1 2 223.291 2.435 20 0 BEADLO C[C@@H]1OCC[N@@H+](Cc2ccccc2F)[C@H]1C ZINC000156323468 397758125 /nfs/dbraw/zinc/75/81/25/397758125.db2.gz JSAGUKYBDWHQNO-QWRGUYRKSA-N 1 2 223.291 2.435 20 0 BEADLO Cc1cc(C)c(NC(=O)[C@@H]2CCCOC2)c(C)[nH+]1 ZINC000170790178 397770134 /nfs/dbraw/zinc/77/01/34/397770134.db2.gz QFGMGWIJAFFUSY-GFCCVEGCSA-N 1 2 248.326 2.372 20 0 BEADLO CC(C)(C)C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000082277445 397885605 /nfs/dbraw/zinc/88/56/05/397885605.db2.gz KUDHKPVNMSSQAX-UHFFFAOYSA-N 1 2 235.331 2.093 20 0 BEADLO C[C@H]1CC[N@H+](Cc2cc3n(n2)CCC3)C[C@H]1F ZINC000649578050 397965897 /nfs/dbraw/zinc/96/58/97/397965897.db2.gz DNCPGUXZWNXQKO-GXFFZTMASA-N 1 2 237.322 2.009 20 0 BEADLO C[C@H](CC(=O)N[C@@H]1CC[C@@H]2C[C@@H]2C1)n1cc[nH+]c1 ZINC000650127638 397938250 /nfs/dbraw/zinc/93/82/50/397938250.db2.gz UMSDGOFCDQEUIG-FDYHWXHSSA-N 1 2 247.342 2.139 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2cc3n(n2)CCC3)C[C@H]1F ZINC000649578050 397965901 /nfs/dbraw/zinc/96/59/01/397965901.db2.gz DNCPGUXZWNXQKO-GXFFZTMASA-N 1 2 237.322 2.009 20 0 BEADLO CCC1(C(=O)NCCCNc2cccc[nH+]2)CC1 ZINC000267268629 397945284 /nfs/dbraw/zinc/94/52/84/397945284.db2.gz QPHUTOHKPIMTNM-UHFFFAOYSA-N 1 2 247.342 2.190 20 0 BEADLO CCn1ccc(C[NH2+]Cc2ccc(Cl)o2)n1 ZINC000414482550 397954150 /nfs/dbraw/zinc/95/41/50/397954150.db2.gz MWWGFWWWVLOLDL-UHFFFAOYSA-N 1 2 239.706 2.439 20 0 BEADLO Cc1nc(NC[C@@H]2CCC[C@@H](C)C2)nc(N)[nH+]1 ZINC000302631031 397957405 /nfs/dbraw/zinc/95/74/05/397957405.db2.gz QOAGAYHKKVIKAV-PSASIEDQSA-N 1 2 235.335 2.000 20 0 BEADLO Cc1nc(N)nc(NC[C@@H]2CCC[C@@H](C)C2)[nH+]1 ZINC000302631031 397957406 /nfs/dbraw/zinc/95/74/06/397957406.db2.gz QOAGAYHKKVIKAV-PSASIEDQSA-N 1 2 235.335 2.000 20 0 BEADLO Cc1nc(NC2CCC(C)(C)CC2)nc(N)[nH+]1 ZINC000302637249 397957590 /nfs/dbraw/zinc/95/75/90/397957590.db2.gz RYLBOKCNHIOKDA-UHFFFAOYSA-N 1 2 235.335 2.143 20 0 BEADLO Cc1nc(N)nc(NC2CCC(C)(C)CC2)[nH+]1 ZINC000302637249 397957592 /nfs/dbraw/zinc/95/75/92/397957592.db2.gz RYLBOKCNHIOKDA-UHFFFAOYSA-N 1 2 235.335 2.143 20 0 BEADLO Cc1n[nH]cc1[C@H](C)[NH2+]CC(C)(F)F ZINC000382205900 397921520 /nfs/dbraw/zinc/92/15/20/397921520.db2.gz GABCEKDZQDHDAJ-LURJTMIESA-N 1 2 203.236 2.024 20 0 BEADLO O[C@H]1CCCC[C@@H]1C[N@H+](CC(F)F)C1CC1 ZINC000382218985 397924496 /nfs/dbraw/zinc/92/44/96/397924496.db2.gz MNYOFRTYIUDJAU-KOLCDFICSA-N 1 2 233.302 2.267 20 0 BEADLO O[C@H]1CCCC[C@@H]1C[N@@H+](CC(F)F)C1CC1 ZINC000382218985 397924501 /nfs/dbraw/zinc/92/45/01/397924501.db2.gz MNYOFRTYIUDJAU-KOLCDFICSA-N 1 2 233.302 2.267 20 0 BEADLO O=C(CCC1CC1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000371525414 397994467 /nfs/dbraw/zinc/99/44/67/397994467.db2.gz MOVAMZHBRIKQKH-NSHDSACASA-N 1 2 233.315 2.263 20 0 BEADLO CCc1cc[nH+]cc1NCc1cncnc1OC ZINC000650243007 398004302 /nfs/dbraw/zinc/00/43/02/398004302.db2.gz GPCAYCQCNRPSJQ-UHFFFAOYSA-N 1 2 244.298 2.055 20 0 BEADLO OC[C@@H]1CC(F)(F)C[N@@H+]1CCC1CCCC1 ZINC000372501351 398004655 /nfs/dbraw/zinc/00/46/55/398004655.db2.gz DOADJCOZTDAUSZ-NSHDSACASA-N 1 2 233.302 2.269 20 0 BEADLO OC[C@@H]1CC(F)(F)C[N@H+]1CCC1CCCC1 ZINC000372501351 398004656 /nfs/dbraw/zinc/00/46/56/398004656.db2.gz DOADJCOZTDAUSZ-NSHDSACASA-N 1 2 233.302 2.269 20 0 BEADLO C[C@H]1CC[N@@H+]1Cc1cnc(Cl)s1 ZINC000575596044 398008391 /nfs/dbraw/zinc/00/83/91/398008391.db2.gz PLTUJNKFFGJCGB-LURJTMIESA-N 1 2 202.710 2.391 20 0 BEADLO C[C@H]1CC[N@H+]1Cc1cnc(Cl)s1 ZINC000575596044 398008393 /nfs/dbraw/zinc/00/83/93/398008393.db2.gz PLTUJNKFFGJCGB-LURJTMIESA-N 1 2 202.710 2.391 20 0 BEADLO COC(=O)C(C)(C)[NH2+]C[C@@H](C)Cc1ccccc1 ZINC000274819247 398016722 /nfs/dbraw/zinc/01/67/22/398016722.db2.gz GMFALHGNQRQWDC-LBPRGKRZSA-N 1 2 249.354 2.406 20 0 BEADLO COC(=O)[C@@H]1C[C@H](C)CC[N@@H+]1Cc1ccco1 ZINC000274969438 398017843 /nfs/dbraw/zinc/01/78/43/398017843.db2.gz VZEWQDPQOPOZLD-PWSUYJOCSA-N 1 2 237.299 2.053 20 0 BEADLO COC(=O)[C@@H]1C[C@H](C)CC[N@H+]1Cc1ccco1 ZINC000274969438 398017848 /nfs/dbraw/zinc/01/78/48/398017848.db2.gz VZEWQDPQOPOZLD-PWSUYJOCSA-N 1 2 237.299 2.053 20 0 BEADLO Cc1ccc(C)c(Cc2noc(C[NH+](C)C)n2)c1 ZINC000278261983 398036862 /nfs/dbraw/zinc/03/68/62/398036862.db2.gz ZTIVWRZXIXOTEZ-UHFFFAOYSA-N 1 2 245.326 2.339 20 0 BEADLO C[C@@H]([NH2+]Cc1cc2n(n1)CCC2)c1ccccn1 ZINC000649581702 397969454 /nfs/dbraw/zinc/96/94/54/397969454.db2.gz JSYNRPAIELRPNV-LLVKDONJSA-N 1 2 242.326 2.075 20 0 BEADLO C/C=C\C[S@](=O)Cc1cn2ccccc2[nH+]1 ZINC000255130877 398041903 /nfs/dbraw/zinc/04/19/03/398041903.db2.gz KMABEZGKQFQIGA-YPQKKHBXSA-N 1 2 234.324 2.159 20 0 BEADLO C/C=C\C[S@@](=O)Cc1cn2ccccc2[nH+]1 ZINC000255130875 398042160 /nfs/dbraw/zinc/04/21/60/398042160.db2.gz KMABEZGKQFQIGA-RXYHWBRQSA-N 1 2 234.324 2.159 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccc(F)c2N)no1 ZINC000637930204 398042180 /nfs/dbraw/zinc/04/21/80/398042180.db2.gz VBIVNLIZDULDNC-UHFFFAOYSA-N 1 2 249.289 2.336 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccc(F)c2N)no1 ZINC000637930204 398042184 /nfs/dbraw/zinc/04/21/84/398042184.db2.gz VBIVNLIZDULDNC-UHFFFAOYSA-N 1 2 249.289 2.336 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1Cc1ccon1 ZINC000649717798 398059362 /nfs/dbraw/zinc/05/93/62/398059362.db2.gz MNANRGNGRNRBDB-NEPJUHHUSA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@H+]1Cc1ccon1 ZINC000649717798 398059365 /nfs/dbraw/zinc/05/93/65/398059365.db2.gz MNANRGNGRNRBDB-NEPJUHHUSA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cnc(C)nc2)[C@@H](CC)CO1 ZINC000649718650 398059951 /nfs/dbraw/zinc/05/99/51/398059951.db2.gz DFJFNTWXUFBKRD-KBPBESRZSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cnc(C)nc2)[C@@H](CC)CO1 ZINC000649718650 398059955 /nfs/dbraw/zinc/05/99/55/398059955.db2.gz DFJFNTWXUFBKRD-KBPBESRZSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccno2)[C@@H](CC)CO1 ZINC000649718939 398061332 /nfs/dbraw/zinc/06/13/32/398061332.db2.gz JIQHBRQDVQUKQJ-QWRGUYRKSA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccno2)[C@@H](CC)CO1 ZINC000649718939 398061335 /nfs/dbraw/zinc/06/13/35/398061335.db2.gz JIQHBRQDVQUKQJ-QWRGUYRKSA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@H]1C[N@H+](Cc2c(C)noc2C)[C@H](C)CO1 ZINC000649731513 398071475 /nfs/dbraw/zinc/07/14/75/398071475.db2.gz INGGTLSKVQLRQB-SKDRFNHKSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2c(C)noc2C)[C@H](C)CO1 ZINC000649731513 398071478 /nfs/dbraw/zinc/07/14/78/398071478.db2.gz INGGTLSKVQLRQB-SKDRFNHKSA-N 1 2 238.331 2.291 20 0 BEADLO Cc1nc(C[NH2+][C@H]2CCC[C@H]2F)cs1 ZINC000307714777 398074113 /nfs/dbraw/zinc/07/41/13/398074113.db2.gz DUUYKFCOZIEEMG-ZJUUUORDSA-N 1 2 214.309 2.432 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cncc(F)c2)[C@@H](C)CO1 ZINC000649736173 398077731 /nfs/dbraw/zinc/07/77/31/398077731.db2.gz XJSBDGBSLOQQLL-GXFFZTMASA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cncc(F)c2)[C@@H](C)CO1 ZINC000649736173 398077734 /nfs/dbraw/zinc/07/77/34/398077734.db2.gz XJSBDGBSLOQQLL-GXFFZTMASA-N 1 2 238.306 2.220 20 0 BEADLO FC1(F)CC12CC[NH+](Cc1cnns1)CC2 ZINC000649772936 398095152 /nfs/dbraw/zinc/09/51/52/398095152.db2.gz CVUDCACQENQGMJ-UHFFFAOYSA-N 1 2 245.298 2.159 20 0 BEADLO CCc1cc(NCc2cc(C(C)C)no2)nc[nH+]1 ZINC000603928535 398095850 /nfs/dbraw/zinc/09/58/50/398095850.db2.gz FNMUPPZPQZSDFW-UHFFFAOYSA-N 1 2 246.314 2.184 20 0 BEADLO CCc1ccc(C[NH2+]Cc2cc(C)no2)o1 ZINC000051725009 398058645 /nfs/dbraw/zinc/05/86/45/398058645.db2.gz PDJWHZLZLSZUAV-UHFFFAOYSA-N 1 2 220.272 2.428 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2noc(C3CC3)n2)C[C@H]1C ZINC000245905517 398118828 /nfs/dbraw/zinc/11/88/28/398118828.db2.gz LRWVULBAIMGASU-NXEZZACHSA-N 1 2 235.331 2.425 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2noc(C3CC3)n2)C[C@H]1C ZINC000245905517 398118829 /nfs/dbraw/zinc/11/88/29/398118829.db2.gz LRWVULBAIMGASU-NXEZZACHSA-N 1 2 235.331 2.425 20 0 BEADLO c1c(CN2OC3CCC2CC3)[nH+]c2ccccn12 ZINC000640242215 398121356 /nfs/dbraw/zinc/12/13/56/398121356.db2.gz UIEYMHUIXIIADV-UHFFFAOYSA-N 1 2 243.310 2.393 20 0 BEADLO c1nc(C[NH2+]Cc2cnn3ccccc23)cs1 ZINC000111609778 398111128 /nfs/dbraw/zinc/11/11/28/398111128.db2.gz SVNKEWHMRKIEPG-UHFFFAOYSA-N 1 2 244.323 2.081 20 0 BEADLO Cc1ccc(CNc2cc(C)[nH+]cn2)cn1 ZINC000062054861 398111326 /nfs/dbraw/zinc/11/13/26/398111326.db2.gz JLGRYILWDQXTFI-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nccs2)C2(CCC2)CO1 ZINC000649822527 398124377 /nfs/dbraw/zinc/12/43/77/398124377.db2.gz JIEFSAMORRSNLF-SNVBAGLBSA-N 1 2 238.356 2.287 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nccs2)C2(CCC2)CO1 ZINC000649822527 398124381 /nfs/dbraw/zinc/12/43/81/398124381.db2.gz JIEFSAMORRSNLF-SNVBAGLBSA-N 1 2 238.356 2.287 20 0 BEADLO CC(C)CCCC(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000294455850 398126252 /nfs/dbraw/zinc/12/62/52/398126252.db2.gz LJWPCMIZVBHVOH-LBPRGKRZSA-N 1 2 237.347 2.214 20 0 BEADLO Cc1cnc(C[N@H+]2C[C@H](C)OCC23CCC3)o1 ZINC000649823902 398126324 /nfs/dbraw/zinc/12/63/24/398126324.db2.gz PWPGALQOTPGIIB-NSHDSACASA-N 1 2 236.315 2.126 20 0 BEADLO Cc1cnc(C[N@@H+]2C[C@H](C)OCC23CCC3)o1 ZINC000649823902 398126326 /nfs/dbraw/zinc/12/63/26/398126326.db2.gz PWPGALQOTPGIIB-NSHDSACASA-N 1 2 236.315 2.126 20 0 BEADLO O[C@@H]1[C@@H](Nc2cccc[nH+]2)CCCC1(F)F ZINC000334810726 487561147 /nfs/dbraw/zinc/56/11/47/487561147.db2.gz MGARINPYPZTMJH-WCBMZHEXSA-N 1 2 228.242 2.042 20 0 BEADLO CCc1cc(C)nc(NCCCn2cc[nH+]c2)n1 ZINC000680330997 487564631 /nfs/dbraw/zinc/56/46/31/487564631.db2.gz HTJNLNVLCLUXGJ-UHFFFAOYSA-N 1 2 245.330 2.046 20 0 BEADLO CC(C)OC(=O)[C@H](C)[N@H+](C)Cc1ccccc1 ZINC000126634725 167169357 /nfs/dbraw/zinc/16/93/57/167169357.db2.gz QTAKLZXRCGBTHQ-LBPRGKRZSA-N 1 2 235.327 2.459 20 0 BEADLO CC(C)OC(=O)[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000126634725 167169359 /nfs/dbraw/zinc/16/93/59/167169359.db2.gz QTAKLZXRCGBTHQ-LBPRGKRZSA-N 1 2 235.327 2.459 20 0 BEADLO Cc1cc(C[NH2+]Cc2cnn(C(C)C)c2)no1 ZINC000226242458 322888374 /nfs/dbraw/zinc/88/83/74/322888374.db2.gz PEOGWBOBICFMCM-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO C[C@H]1CSCC[N@@H+]1Cc1nccs1 ZINC000179221413 177305073 /nfs/dbraw/zinc/30/50/73/177305073.db2.gz YZPKBTFRCSSDRD-QMMMGPOBSA-N 1 2 214.359 2.080 20 0 BEADLO C[C@H]1CSCC[N@H+]1Cc1nccs1 ZINC000179221413 177305075 /nfs/dbraw/zinc/30/50/75/177305075.db2.gz YZPKBTFRCSSDRD-QMMMGPOBSA-N 1 2 214.359 2.080 20 0 BEADLO CCCN(Cc1c[nH+]cn1C)CC(F)(F)F ZINC000674369974 487567051 /nfs/dbraw/zinc/56/70/51/487567051.db2.gz OEZLFTIDEWCQIK-UHFFFAOYSA-N 1 2 235.253 2.194 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2c(C)noc2C)nn1C ZINC000680384193 487581526 /nfs/dbraw/zinc/58/15/26/487581526.db2.gz WTHLMHZPXCHCFV-SECBINFHSA-N 1 2 248.330 2.184 20 0 BEADLO Cc1cn[nH]c1C[N@H+](C)Cc1ccsc1 ZINC000685833146 487582356 /nfs/dbraw/zinc/58/23/56/487582356.db2.gz LSWFBASDHGMVHM-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1cn[nH]c1C[N@@H+](C)Cc1ccsc1 ZINC000685833146 487582360 /nfs/dbraw/zinc/58/23/60/487582360.db2.gz LSWFBASDHGMVHM-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1c[nH]nc1C[N@H+](C)Cc1ccsc1 ZINC000685833146 487582364 /nfs/dbraw/zinc/58/23/64/487582364.db2.gz LSWFBASDHGMVHM-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1c[nH]nc1C[N@@H+](C)Cc1ccsc1 ZINC000685833146 487582367 /nfs/dbraw/zinc/58/23/67/487582367.db2.gz LSWFBASDHGMVHM-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO C[C@@H]1CCCN1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000674568740 487597069 /nfs/dbraw/zinc/59/70/69/487597069.db2.gz MAIPPPHZGOBXDI-SNVBAGLBSA-N 1 2 244.298 2.351 20 0 BEADLO CCc1cc(NCC2(O)CCC(C)CC2)nc[nH+]1 ZINC000087066731 487603249 /nfs/dbraw/zinc/60/32/49/487603249.db2.gz HRNFGEFFRDFUHW-UHFFFAOYSA-N 1 2 249.358 2.392 20 0 BEADLO CCn1cc([C@@H](C)[NH2+]Cc2nc(C)oc2C)cn1 ZINC000660742612 409696866 /nfs/dbraw/zinc/69/68/66/409696866.db2.gz XGDUXDGULSKHNS-SECBINFHSA-N 1 2 248.330 2.359 20 0 BEADLO Cc1occc1C[N@@H+]1CCO[C@](C)(C(F)F)C1 ZINC000668826485 487610230 /nfs/dbraw/zinc/61/02/30/487610230.db2.gz CTGDBHCOFQZJEL-LBPRGKRZSA-N 1 2 245.269 2.444 20 0 BEADLO Cc1occc1C[N@H+]1CCO[C@](C)(C(F)F)C1 ZINC000668826485 487610232 /nfs/dbraw/zinc/61/02/32/487610232.db2.gz CTGDBHCOFQZJEL-LBPRGKRZSA-N 1 2 245.269 2.444 20 0 BEADLO CCCN(C(=O)[C@H]1CCc2[nH+]ccn2C1)C(C)C ZINC000655238702 409684535 /nfs/dbraw/zinc/68/45/35/409684535.db2.gz IIHRFNQCLQCCMV-LBPRGKRZSA-N 1 2 249.358 2.093 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1NC(=O)CCCn1cc[nH+]c1 ZINC000655266590 409770081 /nfs/dbraw/zinc/77/00/81/409770081.db2.gz JGXSPNPBQACZKY-JSGCOSHPSA-N 1 2 249.358 2.214 20 0 BEADLO C[C@H]1C[N@H+](Cc2cncs2)C2(CCC2)CO1 ZINC000651974394 409964361 /nfs/dbraw/zinc/96/43/61/409964361.db2.gz CJPSVONVOZSYPV-JTQLQIEISA-N 1 2 238.356 2.287 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cncs2)C2(CCC2)CO1 ZINC000651974394 409964365 /nfs/dbraw/zinc/96/43/65/409964365.db2.gz CJPSVONVOZSYPV-JTQLQIEISA-N 1 2 238.356 2.287 20 0 BEADLO CSc1ccc[nH+]c1NCc1cnn(C)c1 ZINC000651970805 409939985 /nfs/dbraw/zinc/93/99/85/409939985.db2.gz LNEYGDBXGAFQJG-UHFFFAOYSA-N 1 2 234.328 2.149 20 0 BEADLO CSc1ccc[nH+]c1NCc1cc(C)n(C)n1 ZINC000651972131 409945332 /nfs/dbraw/zinc/94/53/32/409945332.db2.gz HYKSTLGZWMYKCU-UHFFFAOYSA-N 1 2 248.355 2.458 20 0 BEADLO CSc1cc(C[NH2+]Cc2cocn2)ccn1 ZINC000309929427 410177130 /nfs/dbraw/zinc/17/71/30/410177130.db2.gz XEKAEMJWLBMQBO-UHFFFAOYSA-N 1 2 235.312 2.081 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccccc2F)CCO1 ZINC000046513146 410178791 /nfs/dbraw/zinc/17/87/91/410178791.db2.gz ZGMVKFCNHOOSLY-GFCCVEGCSA-N 1 2 223.291 2.437 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccccc2F)CCO1 ZINC000046513146 410178795 /nfs/dbraw/zinc/17/87/95/410178795.db2.gz ZGMVKFCNHOOSLY-GFCCVEGCSA-N 1 2 223.291 2.437 20 0 BEADLO Cc1nc(N2C[C@@H](C)[C@H]2C)c(C)c(C)[nH+]1 ZINC000663948431 410397252 /nfs/dbraw/zinc/39/72/52/410397252.db2.gz YVTJXRPWCQWKAU-GMSGAONNSA-N 1 2 205.305 2.246 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H]2COC(C)(C)C2)[nH+]1 ZINC000664144490 410468922 /nfs/dbraw/zinc/46/89/22/410468922.db2.gz LRKKFZQUAIWUAP-VIFPVBQESA-N 1 2 246.314 2.246 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)CCCC1CC1 ZINC000650787656 410435335 /nfs/dbraw/zinc/43/53/35/410435335.db2.gz TUVKDJJRQIGAKF-UHFFFAOYSA-N 1 2 235.331 2.100 20 0 BEADLO CC[C@H](COCC1CC1)Nc1cc[nH+]c(C)n1 ZINC000664174991 410508169 /nfs/dbraw/zinc/50/81/69/410508169.db2.gz WKJVTIVUXWAQPO-GFCCVEGCSA-N 1 2 235.331 2.402 20 0 BEADLO Cc1cc(C)c(CNC(=O)N2CC=CCC2)c[nH+]1 ZINC000653271529 410520044 /nfs/dbraw/zinc/52/00/44/410520044.db2.gz FMPAULSZCZVTCC-UHFFFAOYSA-N 1 2 245.326 2.170 20 0 BEADLO CCC[C@H](C)NC(=O)Cc1cn2c([nH+]1)CCCC2 ZINC000651053739 410774274 /nfs/dbraw/zinc/77/42/74/410774274.db2.gz UMYRTCVZFXTMKL-NSHDSACASA-N 1 2 249.358 2.067 20 0 BEADLO CC(C)CCC(=O)NC[C@H](C)Cn1cc[nH+]c1 ZINC000265820781 166794276 /nfs/dbraw/zinc/79/42/76/166794276.db2.gz OIBKXNZVWXFNSG-LBPRGKRZSA-N 1 2 237.347 2.072 20 0 BEADLO CCCC(C)(C)C(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000651111473 410812244 /nfs/dbraw/zinc/81/22/44/410812244.db2.gz GEWLHQKDIWOSIK-NSHDSACASA-N 1 2 237.347 2.214 20 0 BEADLO C[C@@H](c1ccccc1)[C@@H](O)C[NH+]1CC(C)(F)C1 ZINC000651136247 410832372 /nfs/dbraw/zinc/83/23/72/410832372.db2.gz UAOXWQMHTICURL-AAEUAGOBSA-N 1 2 237.318 2.195 20 0 BEADLO C[C@H](CC(=O)N1CCC[C@@H]1C1CC1)n1cc[nH+]c1 ZINC000651254348 410886896 /nfs/dbraw/zinc/88/68/96/410886896.db2.gz MUYIGLMTAICCHL-DGCLKSJQSA-N 1 2 247.342 2.235 20 0 BEADLO CC[C@@H](C)N(C)C(=O)Cc1cn2c([nH+]1)CCCC2 ZINC000651219469 410868931 /nfs/dbraw/zinc/86/89/31/410868931.db2.gz WSLHSDAWALCSJM-LLVKDONJSA-N 1 2 249.358 2.019 20 0 BEADLO CC[C@@H]1CCCN(c2cc(CO)cc[nH+]2)C1 ZINC000040878478 410894058 /nfs/dbraw/zinc/89/40/58/410894058.db2.gz HRZRRUOXHKNLHF-LLVKDONJSA-N 1 2 220.316 2.200 20 0 BEADLO OCc1cc[nH+]c(N2CCc3sccc3C2)c1 ZINC000040864158 410896954 /nfs/dbraw/zinc/89/69/54/410896954.db2.gz LXDJEBVMXWJDMQ-UHFFFAOYSA-N 1 2 246.335 2.198 20 0 BEADLO CC(C)C[NH2+][C@H](c1nnc[nH]1)c1ccc(F)cc1 ZINC000340167010 167011815 /nfs/dbraw/zinc/01/18/15/167011815.db2.gz RWTCAGAOFSVDNA-LBPRGKRZSA-N 1 2 248.305 2.279 20 0 BEADLO CC(C)C[NH2+][C@@H](c1cccs1)c1nnc[nH]1 ZINC000293615630 167014731 /nfs/dbraw/zinc/01/47/31/167014731.db2.gz GWIXFEGBVONXFM-JTQLQIEISA-N 1 2 236.344 2.201 20 0 BEADLO CC(C)C[NH2+]c1ccc2c(c1)NC(=O)[C@H](C)O2 ZINC000036969355 167016849 /nfs/dbraw/zinc/01/68/49/167016849.db2.gz DPHNVXHXFSSTRE-VIFPVBQESA-N 1 2 234.299 2.474 20 0 BEADLO COc1ccc(N[C@H](C)c2ccncn2)[nH+]c1 ZINC000651300057 410907548 /nfs/dbraw/zinc/90/75/48/410907548.db2.gz MFSSVLLDCPBARG-SECBINFHSA-N 1 2 230.271 2.053 20 0 BEADLO Cc1ccc(N[C@@H](C)Cc2cnccn2)c[nH+]1 ZINC000651300358 410907838 /nfs/dbraw/zinc/90/78/38/410907838.db2.gz SASZWKHGIMLKRL-NSHDSACASA-N 1 2 228.299 2.223 20 0 BEADLO CCc1cc(NCc2c[nH+]c(C)cc2C)ncn1 ZINC000396965996 410908651 /nfs/dbraw/zinc/90/86/51/410908651.db2.gz BQBVRQKRSOKGOU-UHFFFAOYSA-N 1 2 242.326 2.085 20 0 BEADLO CC(C)OC(=O)[C@@H]1CN(c2cccc[nH+]2)C[C@@H]1C ZINC000353637059 167168969 /nfs/dbraw/zinc/16/89/69/167168969.db2.gz JNMXBZOVQKEKRX-NWDGAFQWSA-N 1 2 248.326 2.106 20 0 BEADLO CC(C)OCc1nc([C@H](C)[NH2+]CCCF)no1 ZINC000352621109 167270971 /nfs/dbraw/zinc/27/09/71/167270971.db2.gz LXBRCFWXHZVNGE-VIFPVBQESA-N 1 2 245.298 2.005 20 0 BEADLO C[C@H](C(=O)N1CC(n2cc[nH+]c2)C1)C1CCCC1 ZINC000674094406 487619370 /nfs/dbraw/zinc/61/93/70/487619370.db2.gz SZSHPTYAGFGKFP-NSHDSACASA-N 1 2 247.342 2.093 20 0 BEADLO CC(C)Oc1ccc(C[NH2+]Cc2cocn2)cn1 ZINC000192287348 167293374 /nfs/dbraw/zinc/29/33/74/167293374.db2.gz ZBNKWIVNNJWUJR-UHFFFAOYSA-N 1 2 247.298 2.147 20 0 BEADLO CC(C)Oc1cc[nH+]cc1COC(=O)C1CC1 ZINC000286823028 167313198 /nfs/dbraw/zinc/31/31/98/167313198.db2.gz CKNWZGYVGDRQOU-UHFFFAOYSA-N 1 2 235.283 2.322 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CSC[C@@H]1C ZINC000397949628 410938023 /nfs/dbraw/zinc/93/80/23/410938023.db2.gz WAAXOWTYQFMSHD-DTWKUNHWSA-N 1 2 224.329 2.254 20 0 BEADLO CC[C@H]([NH2+][C@H](C)c1c[nH]nc1C)C(F)F ZINC000651364346 410953666 /nfs/dbraw/zinc/95/36/66/410953666.db2.gz KTHKWVMQFVNELQ-MUWHJKNJSA-N 1 2 217.263 2.412 20 0 BEADLO CC(C)[C@@H](Nc1ncccn1)c1[nH]cc[nH+]1 ZINC000309523271 167436923 /nfs/dbraw/zinc/43/69/23/167436923.db2.gz CDQUOHQIZWTXOW-SECBINFHSA-N 1 2 217.276 2.009 20 0 BEADLO CCc1cc(N[C@H](C)CCCCO)nc[nH+]1 ZINC000398415425 410964285 /nfs/dbraw/zinc/96/42/85/410964285.db2.gz FYAQTQLNZJNIDM-SNVBAGLBSA-N 1 2 223.320 2.002 20 0 BEADLO CCc1nc(N2C[C@H](CC)OC[C@H]2C)cc(C)[nH+]1 ZINC000651405717 410986322 /nfs/dbraw/zinc/98/63/22/410986322.db2.gz WVOJNWZUNZKTJO-NEPJUHHUSA-N 1 2 249.358 2.351 20 0 BEADLO CC[NH+](CC)[C@@H](C(=O)OC)c1ccsc1 ZINC000337134049 169794880 /nfs/dbraw/zinc/79/48/80/169794880.db2.gz MPPKCMHLHSBHRX-SNVBAGLBSA-N 1 2 227.329 2.304 20 0 BEADLO C[C@@](O)(C[NH2+][C@@H]1CCCC1(F)F)C(F)(F)F ZINC000398168694 410946125 /nfs/dbraw/zinc/94/61/25/410946125.db2.gz FANNZRUGMDPPQA-RNFRBKRXSA-N 1 2 247.207 2.077 20 0 BEADLO C[C@@](O)(C[NH2+][C@H]1CCCC1(F)F)C(F)(F)F ZINC000398168688 410946207 /nfs/dbraw/zinc/94/62/07/410946207.db2.gz FANNZRUGMDPPQA-NKWVEPMBSA-N 1 2 247.207 2.077 20 0 BEADLO C[C@](O)(C[NH2+][C@@H]1CCCC1(F)F)C(F)(F)F ZINC000398168699 410946260 /nfs/dbraw/zinc/94/62/60/410946260.db2.gz FANNZRUGMDPPQA-RQJHMYQMSA-N 1 2 247.207 2.077 20 0 BEADLO CCc1cc(N[C@H](C)COCC2CC2)nc[nH+]1 ZINC000651457816 411039642 /nfs/dbraw/zinc/03/96/42/411039642.db2.gz MEMZFNLSMROYFI-SNVBAGLBSA-N 1 2 235.331 2.266 20 0 BEADLO CC(=O)c1cc(C[N@@H+]2CC(C)=C[C@@H](C)C2)on1 ZINC000653656866 411159549 /nfs/dbraw/zinc/15/95/49/411159549.db2.gz WVPZEPLWGNSBDX-SECBINFHSA-N 1 2 234.299 2.275 20 0 BEADLO CC(=O)c1cc(C[N@H+]2CC(C)=C[C@@H](C)C2)on1 ZINC000653656866 411159553 /nfs/dbraw/zinc/15/95/53/411159553.db2.gz WVPZEPLWGNSBDX-SECBINFHSA-N 1 2 234.299 2.275 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2CCO[C@@H](C)C2)c1 ZINC000652068560 411104815 /nfs/dbraw/zinc/10/48/15/411104815.db2.gz HFOHYPFXTUQGDS-CMPLNLGQSA-N 1 2 236.315 2.207 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](C)C2CC2)c1 ZINC000652068097 411105328 /nfs/dbraw/zinc/10/53/28/411105328.db2.gz RIPQENBKGYROGF-VIFPVBQESA-N 1 2 206.289 2.438 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2CCSC2)c1 ZINC000652068878 411106665 /nfs/dbraw/zinc/10/66/65/411106665.db2.gz RGCXOWSVZNYQFH-SNVBAGLBSA-N 1 2 224.329 2.145 20 0 BEADLO CCC(=O)N1CC[N@H+](CCc2ccc(C)cc2)C1 ZINC000425507898 411178463 /nfs/dbraw/zinc/17/84/63/411178463.db2.gz GNFXLUHDPQWAPI-UHFFFAOYSA-N 1 2 246.354 2.049 20 0 BEADLO CCC(=O)N1CC[N@@H+](CCc2ccc(C)cc2)C1 ZINC000425507898 411178466 /nfs/dbraw/zinc/17/84/66/411178466.db2.gz GNFXLUHDPQWAPI-UHFFFAOYSA-N 1 2 246.354 2.049 20 0 BEADLO COc1c(C)[nH+]cnc1NCCCOC(C)C ZINC000656105157 411178834 /nfs/dbraw/zinc/17/88/34/411178834.db2.gz NYUFSENULHBOOF-UHFFFAOYSA-N 1 2 239.319 2.021 20 0 BEADLO COc1c(C)[nH+]cnc1N(C)Cc1ccccc1 ZINC000656103799 411178918 /nfs/dbraw/zinc/17/89/18/411178918.db2.gz JJGQQEVBHJZLEN-UHFFFAOYSA-N 1 2 243.310 2.430 20 0 BEADLO COc1c(C)[nH+]cnc1N1CCCCCC1 ZINC000656103339 411178966 /nfs/dbraw/zinc/17/89/66/411178966.db2.gz CHPACHHJASEBRA-UHFFFAOYSA-N 1 2 221.304 2.174 20 0 BEADLO COc1c(C)[nH+]cnc1NCCc1ccco1 ZINC000656105802 411179358 /nfs/dbraw/zinc/17/93/58/411179358.db2.gz FAQWZMHATCJJGV-UHFFFAOYSA-N 1 2 233.271 2.041 20 0 BEADLO CCC1CCN(c2nc[nH+]c(C)c2OC)CC1 ZINC000656110885 411180722 /nfs/dbraw/zinc/18/07/22/411180722.db2.gz VPUCFPDSWFJAKI-UHFFFAOYSA-N 1 2 235.331 2.420 20 0 BEADLO COc1c(C)[nH+]cnc1N1CCC[C@@H](C)CC1 ZINC000656112545 411181625 /nfs/dbraw/zinc/18/16/25/411181625.db2.gz BDUDNHWRZBNKAU-SNVBAGLBSA-N 1 2 235.331 2.420 20 0 BEADLO COc1c(C)[nH+]cnc1NCCCC1CC1 ZINC000656127499 411183289 /nfs/dbraw/zinc/18/32/89/411183289.db2.gz LYMUOXYMKPERPT-UHFFFAOYSA-N 1 2 221.304 2.396 20 0 BEADLO CC[C@H](C)CN(C)c1nc[nH+]c(C)c1OC ZINC000656125127 411183523 /nfs/dbraw/zinc/18/35/23/411183523.db2.gz WTYJJSJAOKLOEV-VIFPVBQESA-N 1 2 223.320 2.276 20 0 BEADLO COc1c(C)[nH+]cnc1NCc1cncc(C)c1 ZINC000656150174 411186959 /nfs/dbraw/zinc/18/69/59/411186959.db2.gz KAMOJKSEUGNXGL-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO COc1c(C)[nH+]cnc1N1CCCC2(CC2)C1 ZINC000656163857 411189570 /nfs/dbraw/zinc/18/95/70/411189570.db2.gz CKTICUIQPPQWRD-UHFFFAOYSA-N 1 2 233.315 2.174 20 0 BEADLO CO[C@H]1CC[C@@H](Nc2nc(C)[nH+]cc2C)C1 ZINC000656176046 411193330 /nfs/dbraw/zinc/19/33/30/411193330.db2.gz UIMXELKVCZBALL-MNOVXSKESA-N 1 2 221.304 2.073 20 0 BEADLO Cc1cc(C)c(CNC(=O)NC2CC=CC2)c[nH+]1 ZINC000652447501 411244507 /nfs/dbraw/zinc/24/45/07/411244507.db2.gz LJEYZAAPTNTOJY-UHFFFAOYSA-N 1 2 245.326 2.216 20 0 BEADLO COc1c(C)[nH+]cnc1N1CCC(C)=C(C)C1 ZINC000656182507 411195348 /nfs/dbraw/zinc/19/53/48/411195348.db2.gz AJSQCYMZVLCHFF-UHFFFAOYSA-N 1 2 233.315 2.340 20 0 BEADLO C[C@@H](O)CC[NH+]1Cc2cc(F)c(F)cc2C1 ZINC000653830966 411196094 /nfs/dbraw/zinc/19/60/94/411196094.db2.gz PINHMXJHBAGPFY-MRVPVSSYSA-N 1 2 227.254 2.051 20 0 BEADLO COC[C@@H](C)[NH+]1Cc2cc(F)c(F)cc2C1 ZINC000653833711 411196424 /nfs/dbraw/zinc/19/64/24/411196424.db2.gz RSGGENKATNOPHL-MRVPVSSYSA-N 1 2 227.254 2.315 20 0 BEADLO Cc1noc([C@H](C)[N@H+](C)CC2=CCCC2)n1 ZINC000653847309 411198779 /nfs/dbraw/zinc/19/87/79/411198779.db2.gz ZXWWJWJTLRIQEQ-VIFPVBQESA-N 1 2 221.304 2.481 20 0 BEADLO Cc1noc([C@H](C)[N@@H+](C)CC2=CCCC2)n1 ZINC000653847309 411198782 /nfs/dbraw/zinc/19/87/82/411198782.db2.gz ZXWWJWJTLRIQEQ-VIFPVBQESA-N 1 2 221.304 2.481 20 0 BEADLO CC/C=C/CNc1nc[nH+]c(C)c1OC ZINC000656194529 411199209 /nfs/dbraw/zinc/19/92/09/411199209.db2.gz HLJCBYQDZHXSAF-AATRIKPKSA-N 1 2 207.277 2.172 20 0 BEADLO CC[C@@H]([NH2+][C@@H]1CCCn2nccc21)C(F)F ZINC000658024258 411201639 /nfs/dbraw/zinc/20/16/39/411201639.db2.gz ITBYZANBHFZUIC-RKDXNWHRSA-N 1 2 229.274 2.351 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1C[C@H](C)n2ccnc21 ZINC000656196848 411202220 /nfs/dbraw/zinc/20/22/20/411202220.db2.gz OTXUFBQMIQIWQD-GXSJLCMTSA-N 1 2 243.314 2.408 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1C[C@@H](C)n2ccnc21 ZINC000656196849 411202233 /nfs/dbraw/zinc/20/22/33/411202233.db2.gz OTXUFBQMIQIWQD-KOLCDFICSA-N 1 2 243.314 2.408 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](C)C(C)(C)OC)c1 ZINC000652330847 411202611 /nfs/dbraw/zinc/20/26/11/411202611.db2.gz QQYDLOVQUNDZHN-JTQLQIEISA-N 1 2 238.331 2.453 20 0 BEADLO CC[C@H]1C[C@H](Nc2nc(C)[nH+]cc2C)CCO1 ZINC000656204958 411208026 /nfs/dbraw/zinc/20/80/26/411208026.db2.gz RTNGGYIIRMLQJX-NEPJUHHUSA-N 1 2 235.331 2.463 20 0 BEADLO Cc1nc(N2CC3(CC3(F)F)C2)c(C)c(C)[nH+]1 ZINC000656204879 411208696 /nfs/dbraw/zinc/20/86/96/411208696.db2.gz YJBABSYWTCQUBU-UHFFFAOYSA-N 1 2 239.269 2.247 20 0 BEADLO C[C@H]([NH2+][C@@H]1C[C@@H](C)n2ncnc21)c1ccccn1 ZINC000658101339 411246034 /nfs/dbraw/zinc/24/60/34/411246034.db2.gz LFQUVSBFYYEXGL-JFGNBEQYSA-N 1 2 243.314 2.030 20 0 BEADLO C[C@H]([NH2+][C@@H]1C[C@H](C)n2ncnc21)c1ccoc1 ZINC000658101934 411246171 /nfs/dbraw/zinc/24/61/71/411246171.db2.gz NOTLIARIOCWGLU-ATZCPNFKSA-N 1 2 232.287 2.228 20 0 BEADLO CC(C)n1nccc1C[NH+]1CC2(CC2(F)F)C1 ZINC000656265680 411221237 /nfs/dbraw/zinc/22/12/37/411221237.db2.gz WAJKWODEEIASPH-UHFFFAOYSA-N 1 2 241.285 2.305 20 0 BEADLO CC(C)n1cc(C[NH+]2CC3(CC3(F)F)C2)cn1 ZINC000656266143 411221990 /nfs/dbraw/zinc/22/19/90/411221990.db2.gz QSPFDBFSJVIWIM-UHFFFAOYSA-N 1 2 241.285 2.305 20 0 BEADLO C[C@@H]1CC(C)(C)CN1C(=O)CCCn1cc[nH+]c1 ZINC000665662901 411224302 /nfs/dbraw/zinc/22/43/02/411224302.db2.gz OKLBMDJLUPJCCB-GFCCVEGCSA-N 1 2 249.358 2.310 20 0 BEADLO CC(C)(NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]21)c1[nH]cc[nH+]1 ZINC000652413509 411232797 /nfs/dbraw/zinc/23/27/97/411232797.db2.gz OGWQHOKCEBKGTR-VWYCJHECSA-N 1 2 247.342 2.197 20 0 BEADLO COc1cc(-c2[nH+]ccn2C)ccc1CCCO ZINC000656369671 411235833 /nfs/dbraw/zinc/23/58/33/411235833.db2.gz SOPLTCAJLDMUQI-UHFFFAOYSA-N 1 2 246.310 2.021 20 0 BEADLO Cn1cc[nH+]c1-c1ccc2c(c1)NC(=O)C2(C)C ZINC000656371640 411238033 /nfs/dbraw/zinc/23/80/33/411238033.db2.gz LUAYXVLMFZLUGZ-UHFFFAOYSA-N 1 2 241.294 2.317 20 0 BEADLO Cn1cc[nH+]c1-c1cccc2c1OCCC2 ZINC000656371875 411238587 /nfs/dbraw/zinc/23/85/87/411238587.db2.gz ZVKHNYSKYLFHHL-UHFFFAOYSA-N 1 2 214.268 2.412 20 0 BEADLO CC(C)C[C@H]1CCC[N@H+](CCc2cnn[nH]2)C1 ZINC000660001406 411166024 /nfs/dbraw/zinc/16/60/24/411166024.db2.gz QBLQWZJWNBIRMY-GFCCVEGCSA-N 1 2 236.363 2.105 20 0 BEADLO CC(C)C[C@H]1CCC[N@@H+](CCc2cnn[nH]2)C1 ZINC000660001406 411166025 /nfs/dbraw/zinc/16/60/25/411166025.db2.gz QBLQWZJWNBIRMY-GFCCVEGCSA-N 1 2 236.363 2.105 20 0 BEADLO CC(C)(C)[C@H]1CCC[N@H+](CCc2cnn[nH]2)C1 ZINC000660452977 411166197 /nfs/dbraw/zinc/16/61/97/411166197.db2.gz GLKVZYHWYJKHKT-NSHDSACASA-N 1 2 236.363 2.105 20 0 BEADLO CC(C)(C)[C@H]1CCC[N@@H+](CCc2cnn[nH]2)C1 ZINC000660452977 411166200 /nfs/dbraw/zinc/16/62/00/411166200.db2.gz GLKVZYHWYJKHKT-NSHDSACASA-N 1 2 236.363 2.105 20 0 BEADLO CC(C)C[C@@H]1CCC[N@H+](CCc2cnn[nH]2)C1 ZINC000660001407 411166371 /nfs/dbraw/zinc/16/63/71/411166371.db2.gz QBLQWZJWNBIRMY-LBPRGKRZSA-N 1 2 236.363 2.105 20 0 BEADLO CC(C)C[C@@H]1CCC[N@@H+](CCc2cnn[nH]2)C1 ZINC000660001407 411166377 /nfs/dbraw/zinc/16/63/77/411166377.db2.gz QBLQWZJWNBIRMY-LBPRGKRZSA-N 1 2 236.363 2.105 20 0 BEADLO c1cc(C[NH2+]Cc2cc3n(n2)CCCC3)co1 ZINC000655716598 411271184 /nfs/dbraw/zinc/27/11/84/411271184.db2.gz YVKMNPPZJXVADI-UHFFFAOYSA-N 1 2 231.299 2.102 20 0 BEADLO CCC1(NC(=O)Nc2ccc3[nH+]ccn3c2)CC1 ZINC000652565296 411273647 /nfs/dbraw/zinc/27/36/47/411273647.db2.gz KMBJKGGTYOKZSD-UHFFFAOYSA-N 1 2 244.298 2.398 20 0 BEADLO C[C@@H]1CCN(c2cc(CO)cc[nH+]2)[C@H](C)C1 ZINC000051734326 411281747 /nfs/dbraw/zinc/28/17/47/411281747.db2.gz XBLZWZWFZSBSBN-GHMZBOCLSA-N 1 2 220.316 2.199 20 0 BEADLO CCn1cc(C[NH2+][C@H](C)c2cc(C)c(C)o2)nn1 ZINC000658177682 411282504 /nfs/dbraw/zinc/28/25/04/411282504.db2.gz UMPIOLBFZRLXSY-SNVBAGLBSA-N 1 2 248.330 2.359 20 0 BEADLO Cc1nocc1C[NH+]1CC(CC(F)(F)F)C1 ZINC000656688409 411328664 /nfs/dbraw/zinc/32/86/64/411328664.db2.gz ODPWXVMQMYPFPH-UHFFFAOYSA-N 1 2 234.221 2.367 20 0 BEADLO CCn1cc[nH+]c1CN1CC(CC(F)(F)F)C1 ZINC000656686377 411328732 /nfs/dbraw/zinc/32/87/32/411328732.db2.gz HTONVOQVHVBOCX-UHFFFAOYSA-N 1 2 247.264 2.287 20 0 BEADLO Fc1ccc(C[NH2+][C@H]2CCCn3ccnc32)nc1 ZINC000655723713 411297444 /nfs/dbraw/zinc/29/74/44/411297444.db2.gz OGSQVCAJAUXMIJ-LBPRGKRZSA-N 1 2 246.289 2.042 20 0 BEADLO CCN(C#N)CC[N@H+](C)Cc1ccccc1F ZINC000602755272 411298761 /nfs/dbraw/zinc/29/87/61/411298761.db2.gz DJLGPQMCQKZNJL-UHFFFAOYSA-N 1 2 235.306 2.060 20 0 BEADLO CCN(C#N)CC[N@@H+](C)Cc1ccccc1F ZINC000602755272 411298765 /nfs/dbraw/zinc/29/87/65/411298765.db2.gz DJLGPQMCQKZNJL-UHFFFAOYSA-N 1 2 235.306 2.060 20 0 BEADLO Cc1nccnc1[C@H](C)[NH2+]Cc1ccc(F)cn1 ZINC000446930308 411308984 /nfs/dbraw/zinc/30/89/84/411308984.db2.gz NMEIWNKMINWATP-JTQLQIEISA-N 1 2 246.289 2.170 20 0 BEADLO COC1(C)C[NH+](Cc2cc3ccccc3[nH]2)C1 ZINC000656621262 411311441 /nfs/dbraw/zinc/31/14/41/411311441.db2.gz XBPNUHMZCLMCAG-UHFFFAOYSA-N 1 2 230.311 2.389 20 0 BEADLO C[C@@H](CC(=O)NCc1c[nH+]c[nH]1)c1ccccc1 ZINC000359680473 411313740 /nfs/dbraw/zinc/31/37/40/411313740.db2.gz KFAZIQDHDLKAQM-NSHDSACASA-N 1 2 243.310 2.220 20 0 BEADLO C[C@@H](CC(=O)NCc1c[nH]c[nH+]1)c1ccccc1 ZINC000359680473 411313744 /nfs/dbraw/zinc/31/37/44/411313744.db2.gz KFAZIQDHDLKAQM-NSHDSACASA-N 1 2 243.310 2.220 20 0 BEADLO C[C@@H](CC(=O)NC1(C)CC=CC1)n1cc[nH+]c1 ZINC000654013024 411315978 /nfs/dbraw/zinc/31/59/78/411315978.db2.gz PGWRDFSQGIJRMN-NSHDSACASA-N 1 2 233.315 2.059 20 0 BEADLO COc1cc(C)c(C)cc1[NH2+]C[C@@H](C)CO ZINC000656660331 411318523 /nfs/dbraw/zinc/31/85/23/411318523.db2.gz WLTTZWBDSOZPTQ-SECBINFHSA-N 1 2 223.316 2.352 20 0 BEADLO Cn1c[nH+]c(CN2CC=C(C(F)(F)F)CC2)c1 ZINC000660128756 411249262 /nfs/dbraw/zinc/24/92/62/411249262.db2.gz MLXSFEPOCMKLEO-UHFFFAOYSA-N 1 2 245.248 2.115 20 0 BEADLO Cn1cnc(C[N@H+]2CC=C(C(F)(F)F)CC2)c1 ZINC000660128756 411249265 /nfs/dbraw/zinc/24/92/65/411249265.db2.gz MLXSFEPOCMKLEO-UHFFFAOYSA-N 1 2 245.248 2.115 20 0 BEADLO Cn1cnc(C[N@@H+]2CC=C(C(F)(F)F)CC2)c1 ZINC000660128756 411249267 /nfs/dbraw/zinc/24/92/67/411249267.db2.gz MLXSFEPOCMKLEO-UHFFFAOYSA-N 1 2 245.248 2.115 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)[C@H]1CC12CCCCC2 ZINC000336499617 411252287 /nfs/dbraw/zinc/25/22/87/411252287.db2.gz CGJPTOGNLDLUHY-LLVKDONJSA-N 1 2 247.342 2.007 20 0 BEADLO Cc1ncncc1[C@H](C)[NH2+]Cc1cscn1 ZINC000655704125 411254439 /nfs/dbraw/zinc/25/44/39/411254439.db2.gz QDWSPEBMZBUJEX-QMMMGPOBSA-N 1 2 234.328 2.092 20 0 BEADLO Cc1[nH]c2ccc(-n3cc(C4CC4)nn3)cc2[nH+]1 ZINC000656438936 411256840 /nfs/dbraw/zinc/25/68/40/411256840.db2.gz HHXVXZMBEQCMKD-UHFFFAOYSA-N 1 2 239.282 2.329 20 0 BEADLO Cc1[nH]c2cc(-n3cc(C4CC4)nn3)ccc2[nH+]1 ZINC000656438936 411256841 /nfs/dbraw/zinc/25/68/41/411256841.db2.gz HHXVXZMBEQCMKD-UHFFFAOYSA-N 1 2 239.282 2.329 20 0 BEADLO CCc1cc(N[C@@H]2CCC[C@H]2OC)nc[nH+]1 ZINC000050374462 411257033 /nfs/dbraw/zinc/25/70/33/411257033.db2.gz ZKJSAICDJSENSX-GHMZBOCLSA-N 1 2 221.304 2.018 20 0 BEADLO COc1cccc(NCc2c[nH+]cn2C(C)C)n1 ZINC000656775978 411355891 /nfs/dbraw/zinc/35/58/91/411355891.db2.gz FJSQQTRGPOOHSE-UHFFFAOYSA-N 1 2 246.314 2.480 20 0 BEADLO CCC(CC)CNc1cc(CO)cc[nH+]1 ZINC000130512032 411355923 /nfs/dbraw/zinc/35/59/23/411355923.db2.gz BHYYIHPVAXJFEN-UHFFFAOYSA-N 1 2 208.305 2.422 20 0 BEADLO Cn1nccc1CNc1c[nH+]cc2c1CCCC2 ZINC000656776180 411356190 /nfs/dbraw/zinc/35/61/90/411356190.db2.gz KLFOYBUAWJUURB-UHFFFAOYSA-N 1 2 242.326 2.306 20 0 BEADLO COc1cccc(NCc2[nH+]ccn2C(C)C)n1 ZINC000656776001 411356373 /nfs/dbraw/zinc/35/63/73/411356373.db2.gz GLOWRFNKUYYBQE-UHFFFAOYSA-N 1 2 246.314 2.480 20 0 BEADLO Cn1ncc(C2CC2)c1CNc1cccc[nH+]1 ZINC000656767605 411363150 /nfs/dbraw/zinc/36/31/50/411363150.db2.gz NLAMUQPOTMMPLP-UHFFFAOYSA-N 1 2 228.299 2.305 20 0 BEADLO CC1(CNc2cc[nH+]cc2F)CCOCC1 ZINC000277091633 168047763 /nfs/dbraw/zinc/04/77/63/168047763.db2.gz UGNAOQGLMBTRGI-UHFFFAOYSA-N 1 2 224.279 2.449 20 0 BEADLO CC(C)(C)c1nc(NCC2(C)COC2)cc[nH+]1 ZINC000301519140 168047770 /nfs/dbraw/zinc/04/77/70/168047770.db2.gz HETDSJPLGGOKGU-UHFFFAOYSA-N 1 2 235.331 2.223 20 0 BEADLO CCn1cc([C@H](C)[NH2+][C@@H](C)c2nccn2C)cn1 ZINC000658338477 411345930 /nfs/dbraw/zinc/34/59/30/411345930.db2.gz YXLYZNVCOHIKFQ-QWRGUYRKSA-N 1 2 247.346 2.048 20 0 BEADLO CC1(CC(=O)NCc2[nH]cc[nH+]2)CCCCC1 ZINC000128619355 168016499 /nfs/dbraw/zinc/01/64/99/168016499.db2.gz SKMDXEWTRHTZSZ-UHFFFAOYSA-N 1 2 235.331 2.386 20 0 BEADLO CC1(CC(=O)N2CCn3c[nH+]cc3C2)CCCC1 ZINC000290966204 168016679 /nfs/dbraw/zinc/01/66/79/168016679.db2.gz SIYHJMFLNGHUPH-UHFFFAOYSA-N 1 2 247.342 2.196 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ccc(F)cn1)c1nccn1C ZINC000658338431 411346052 /nfs/dbraw/zinc/34/60/52/411346052.db2.gz XWKZAPOWOCJSDQ-UWVGGRQHSA-N 1 2 248.305 2.366 20 0 BEADLO COc1ccc(NCc2[nH+]ccn2C(C)C)cn1 ZINC000656766832 411348802 /nfs/dbraw/zinc/34/88/02/411348802.db2.gz FBKQEHKFONAPQY-UHFFFAOYSA-N 1 2 246.314 2.480 20 0 BEADLO CC1=CCC[N@@H+](Cc2nccn2C(F)F)C1 ZINC000280810587 168099944 /nfs/dbraw/zinc/09/99/44/168099944.db2.gz LWYZFORZVQWQSZ-UHFFFAOYSA-N 1 2 227.258 2.430 20 0 BEADLO CC1=CCC[N@H+](Cc2nccn2C(F)F)C1 ZINC000280810587 168099943 /nfs/dbraw/zinc/09/99/43/168099943.db2.gz LWYZFORZVQWQSZ-UHFFFAOYSA-N 1 2 227.258 2.430 20 0 BEADLO CC1=CCC[N@H+](Cc2cn(C(C)(C)C)nn2)C1 ZINC000281859087 168100292 /nfs/dbraw/zinc/10/02/92/168100292.db2.gz SXTVTHXMALJRBM-UHFFFAOYSA-N 1 2 234.347 2.185 20 0 BEADLO CC1=CCC[N@@H+](Cc2cn(C(C)(C)C)nn2)C1 ZINC000281859087 168100296 /nfs/dbraw/zinc/10/02/96/168100296.db2.gz SXTVTHXMALJRBM-UHFFFAOYSA-N 1 2 234.347 2.185 20 0 BEADLO CC1=CC[N@H+](Cc2nnc(-c3ccco3)o2)CC1 ZINC000270393007 168115041 /nfs/dbraw/zinc/11/50/41/168115041.db2.gz YJNAIRZZXCMSBA-UHFFFAOYSA-N 1 2 245.282 2.482 20 0 BEADLO CC1=CC[N@@H+](Cc2nnc(-c3ccco3)o2)CC1 ZINC000270393007 168115043 /nfs/dbraw/zinc/11/50/43/168115043.db2.gz YJNAIRZZXCMSBA-UHFFFAOYSA-N 1 2 245.282 2.482 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2CC=C(C)CC2)no1 ZINC000289335849 168117826 /nfs/dbraw/zinc/11/78/26/168117826.db2.gz INCLBXDHULHRSD-SECBINFHSA-N 1 2 207.277 2.091 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2CC=C(C)CC2)no1 ZINC000289335849 168117829 /nfs/dbraw/zinc/11/78/29/168117829.db2.gz INCLBXDHULHRSD-SECBINFHSA-N 1 2 207.277 2.091 20 0 BEADLO CC1=C[C@H](C)C[C@@H](C[N@H+]2CC(=O)N(C3CC3)C2)C1 ZINC000356415017 168128389 /nfs/dbraw/zinc/12/83/89/168128389.db2.gz CPRZZWHIWFPOCU-WCQYABFASA-N 1 2 248.370 2.243 20 0 BEADLO CC1=C[C@H](C)C[C@@H](C[N@@H+]2CC(=O)N(C3CC3)C2)C1 ZINC000356415017 168128391 /nfs/dbraw/zinc/12/83/91/168128391.db2.gz CPRZZWHIWFPOCU-WCQYABFASA-N 1 2 248.370 2.243 20 0 BEADLO CC1=C[C@H](C)C[C@H](C[N@H+](C)Cc2nnc[nH]2)C1 ZINC000290312038 168128946 /nfs/dbraw/zinc/12/89/46/168128946.db2.gz AQRQFTQLOINFNP-JQWIXIFHSA-N 1 2 234.347 2.229 20 0 BEADLO CC1=C[C@H](C)C[C@H](C[N@@H+](C)Cc2nnc[nH]2)C1 ZINC000290312038 168128948 /nfs/dbraw/zinc/12/89/48/168128948.db2.gz AQRQFTQLOINFNP-JQWIXIFHSA-N 1 2 234.347 2.229 20 0 BEADLO CC1CCC(CC(=O)NCCn2cc[nH+]c2)CC1 ZINC000359725267 168152256 /nfs/dbraw/zinc/15/22/56/168152256.db2.gz WDXLMLCWWZKEOW-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO CC1CCC(CC(=O)NCc2[nH]cc[nH+]2)CC1 ZINC000360214512 168152306 /nfs/dbraw/zinc/15/23/06/168152306.db2.gz WJMSQWXILDSKNM-UHFFFAOYSA-N 1 2 235.331 2.242 20 0 BEADLO CC1CCC(NC(=O)COc2cc[nH+]cc2)CC1 ZINC000276448055 168161522 /nfs/dbraw/zinc/16/15/22/168161522.db2.gz LJZUBKLJECJIGP-UHFFFAOYSA-N 1 2 248.326 2.155 20 0 BEADLO CC1C[NH+](Cc2cccc(O)c2Cl)C1 ZINC000334321831 168192009 /nfs/dbraw/zinc/19/20/09/168192009.db2.gz XHXKUYCOKAUPCB-UHFFFAOYSA-N 1 2 211.692 2.497 20 0 BEADLO CCC(=CC(=O)N[C@H]1CCc2[nH+]c[nH]c2C1)CC ZINC000371307275 168196157 /nfs/dbraw/zinc/19/61/57/168196157.db2.gz CKKXSIJYPQCAOL-NSHDSACASA-N 1 2 247.342 2.130 20 0 BEADLO CCC(=CC(=O)N[C@H]1CCc2[nH]c[nH+]c2C1)CC ZINC000371307275 168196158 /nfs/dbraw/zinc/19/61/58/168196158.db2.gz CKKXSIJYPQCAOL-NSHDSACASA-N 1 2 247.342 2.130 20 0 BEADLO CCC(=O)N(C)[C@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000294230206 168211491 /nfs/dbraw/zinc/21/14/91/168211491.db2.gz QJAHJWHIUZDPBU-ZDUSSCGKSA-N 1 2 243.310 2.368 20 0 BEADLO CC[C@H]1C[N@H+](Cc2nc(C)oc2C)C[C@@H](C)O1 ZINC000659920955 411382745 /nfs/dbraw/zinc/38/27/45/411382745.db2.gz YCFFLJROJGXADB-SKDRFNHKSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2nc(C)oc2C)C[C@@H](C)O1 ZINC000659920955 411382748 /nfs/dbraw/zinc/38/27/48/411382748.db2.gz YCFFLJROJGXADB-SKDRFNHKSA-N 1 2 238.331 2.291 20 0 BEADLO CNc1ccc(-c2ccc(OC)nc2)c[nH+]1 ZINC000656857988 411385795 /nfs/dbraw/zinc/38/57/95/411385795.db2.gz XJTQSBRSCLFMHS-UHFFFAOYSA-N 1 2 215.256 2.194 20 0 BEADLO CCC(C)(C)C(=O)NCc1cn2ccccc2[nH+]1 ZINC000263752127 168266091 /nfs/dbraw/zinc/26/60/91/168266091.db2.gz JADBBYUWHAUMPU-UHFFFAOYSA-N 1 2 245.326 2.387 20 0 BEADLO CCC(C)(C)C(=O)NCc1ccn2cc[nH+]c2c1 ZINC000178361903 168266859 /nfs/dbraw/zinc/26/68/59/168266859.db2.gz CIUDDEILUFZHJS-UHFFFAOYSA-N 1 2 245.326 2.387 20 0 BEADLO CCC(C)(C)C(=O)Nc1c[nH+]ccc1OC ZINC000102608337 168269493 /nfs/dbraw/zinc/26/94/93/168269493.db2.gz LCJGHRJDUQTBDF-UHFFFAOYSA-N 1 2 222.288 2.465 20 0 BEADLO CCC(C)(C)CC[N@H+](CCO)CC(F)F ZINC000361341026 168276308 /nfs/dbraw/zinc/27/63/08/168276308.db2.gz LMNSYGZVVGALJX-UHFFFAOYSA-N 1 2 223.307 2.372 20 0 BEADLO CCC(C)(C)CC[N@@H+](CCO)CC(F)F ZINC000361341026 168276310 /nfs/dbraw/zinc/27/63/10/168276310.db2.gz LMNSYGZVVGALJX-UHFFFAOYSA-N 1 2 223.307 2.372 20 0 BEADLO CCC(C)(C)[N@H+](C)Cc1nsc(N(C)C)n1 ZINC000336684819 168289009 /nfs/dbraw/zinc/28/90/09/168289009.db2.gz VCWKHWURFJIGPN-UHFFFAOYSA-N 1 2 242.392 2.225 20 0 BEADLO CCC(C)(C)[N@@H+](C)Cc1nsc(N(C)C)n1 ZINC000336684819 168289012 /nfs/dbraw/zinc/28/90/12/168289012.db2.gz VCWKHWURFJIGPN-UHFFFAOYSA-N 1 2 242.392 2.225 20 0 BEADLO CCC(C)(CC)NC(=O)[C@@H]1CCc2[nH+]ccn2C1 ZINC000364398434 168309003 /nfs/dbraw/zinc/30/90/03/168309003.db2.gz SLQSWCJTRYWACZ-LLVKDONJSA-N 1 2 249.358 2.140 20 0 BEADLO CCCC(C)(C)NC(=O)[C@@H]1CCc2c[nH+]cn2C1 ZINC000653030506 411398961 /nfs/dbraw/zinc/39/89/61/411398961.db2.gz BTVSLKJQXMDFEG-LLVKDONJSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1nnc(C[NH2+][C@@H](C)c2ccsc2)[nH]1 ZINC000129845469 411403179 /nfs/dbraw/zinc/40/31/79/411403179.db2.gz IIZDKCHWUFXZJV-ZETCQYMHSA-N 1 2 222.317 2.025 20 0 BEADLO CCCC(C)(C)C(=O)Nc1ccc(N)[nH+]c1 ZINC000653048728 411404988 /nfs/dbraw/zinc/40/49/88/411404988.db2.gz VUXMSDFMGYYSNT-UHFFFAOYSA-N 1 2 221.304 2.259 20 0 BEADLO CC[N@H+](CC[C@H]1CCOC1=O)c1ccccc1 ZINC000267952158 169873415 /nfs/dbraw/zinc/87/34/15/169873415.db2.gz KFJINPACEJXREZ-LBPRGKRZSA-N 1 2 233.311 2.466 20 0 BEADLO CC[N@@H+](CC[C@H]1CCOC1=O)c1ccccc1 ZINC000267952158 169873416 /nfs/dbraw/zinc/87/34/16/169873416.db2.gz KFJINPACEJXREZ-LBPRGKRZSA-N 1 2 233.311 2.466 20 0 BEADLO CN(CC1CC1)c1cc[nH+]c2ccncc21 ZINC000267249774 411419440 /nfs/dbraw/zinc/41/94/40/411419440.db2.gz UHKIJYSLCRVDAU-UHFFFAOYSA-N 1 2 213.284 2.476 20 0 BEADLO CCc1[nH+]c(C)ccc1OC[C@H](C)OC ZINC000276422265 411441661 /nfs/dbraw/zinc/44/16/61/411441661.db2.gz AUSIDYQIHAPJOR-JTQLQIEISA-N 1 2 209.289 2.366 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC1(C)CCC(C)CC1 ZINC000279466816 411449436 /nfs/dbraw/zinc/44/94/36/411449436.db2.gz PKZHEOTWJHUOGE-UHFFFAOYSA-N 1 2 249.358 2.346 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)NC1(C)CCC(C)CC1 ZINC000279466816 411449438 /nfs/dbraw/zinc/44/94/38/411449438.db2.gz PKZHEOTWJHUOGE-UHFFFAOYSA-N 1 2 249.358 2.346 20 0 BEADLO Cc1c[nH]c(C[NH2+]Cc2ccc(Cl)o2)n1 ZINC000657290418 411452124 /nfs/dbraw/zinc/45/21/24/411452124.db2.gz PIIASNXZVZAJOY-UHFFFAOYSA-N 1 2 225.679 2.254 20 0 BEADLO Cc1c[nH]c(C[NH2+]Cc2ccc(F)c(F)c2)n1 ZINC000657329658 411467367 /nfs/dbraw/zinc/46/73/67/411467367.db2.gz UEZNHMOXFRLRSE-UHFFFAOYSA-N 1 2 237.253 2.286 20 0 BEADLO Cc1cc(CNCc2[nH+]ccn2C(C)C)on1 ZINC000657348148 411475166 /nfs/dbraw/zinc/47/51/66/411475166.db2.gz LZZCYJVFKCRMOS-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO Cc1cc(C[NH2+]Cc2nccn2C(C)C)on1 ZINC000657348148 411475170 /nfs/dbraw/zinc/47/51/70/411475170.db2.gz LZZCYJVFKCRMOS-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO CCc1cc(NCC(C)(F)F)nc[nH+]1 ZINC000307502404 411475598 /nfs/dbraw/zinc/47/55/98/411475598.db2.gz JCZPHESJBZTYFB-UHFFFAOYSA-N 1 2 201.220 2.106 20 0 BEADLO CCc1ccc(C[N@H+](C2CC2)C2COC2)o1 ZINC000295993777 411479636 /nfs/dbraw/zinc/47/96/36/411479636.db2.gz KITBDCLLQIAGPV-UHFFFAOYSA-N 1 2 221.300 2.205 20 0 BEADLO CCc1ccc(C[N@@H+](C2CC2)C2COC2)o1 ZINC000295993777 411479640 /nfs/dbraw/zinc/47/96/40/411479640.db2.gz KITBDCLLQIAGPV-UHFFFAOYSA-N 1 2 221.300 2.205 20 0 BEADLO CC[C@@H]1C[C@H](Nc2c[nH+]cc(C)c2)CO1 ZINC000657412551 411499066 /nfs/dbraw/zinc/49/90/66/411499066.db2.gz GRYMUYWYYUFAGZ-NWDGAFQWSA-N 1 2 206.289 2.369 20 0 BEADLO COc1ccc[nH+]c1NCc1nccn1C(C)C ZINC000657420986 411503279 /nfs/dbraw/zinc/50/32/79/411503279.db2.gz KBRSPPYWOYSDRZ-UHFFFAOYSA-N 1 2 246.314 2.480 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@@H](C)c2cncc(F)c2)n1 ZINC000657432383 411506117 /nfs/dbraw/zinc/50/61/17/411506117.db2.gz MZJSLWOAOJMPON-VIFPVBQESA-N 1 2 234.278 2.103 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NC1(C2CCC2)CC1 ZINC000655165950 411508851 /nfs/dbraw/zinc/50/88/51/411508851.db2.gz YCTMBWCSKZWORJ-JTQLQIEISA-N 1 2 247.342 2.037 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NC1(C2CCC2)CC1 ZINC000655165950 411508854 /nfs/dbraw/zinc/50/88/54/411508854.db2.gz YCTMBWCSKZWORJ-JTQLQIEISA-N 1 2 247.342 2.037 20 0 BEADLO CC(C)([NH2+]Cc1ccnn1CC1CC1)C(F)F ZINC000657453261 411514581 /nfs/dbraw/zinc/51/45/81/411514581.db2.gz UDTKWLVJJFSVCP-UHFFFAOYSA-N 1 2 243.301 2.426 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@@H+]1Cc1cc(C2CC2)no1 ZINC000660009932 411527783 /nfs/dbraw/zinc/52/77/83/411527783.db2.gz DBZCYOVXEYHFGX-ZJUUUORDSA-N 1 2 236.315 2.161 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1cc(C2CC2)no1 ZINC000660009932 411527785 /nfs/dbraw/zinc/52/77/85/411527785.db2.gz DBZCYOVXEYHFGX-ZJUUUORDSA-N 1 2 236.315 2.161 20 0 BEADLO CCc1ncc(C[NH2+]Cc2nccn2C(C)C)o1 ZINC000657484099 411528632 /nfs/dbraw/zinc/52/86/32/411528632.db2.gz ADAPZJHPXHRRQU-UHFFFAOYSA-N 1 2 248.330 2.304 20 0 BEADLO CCc1ncc(CNCc2[nH+]ccn2C(C)C)o1 ZINC000657484099 411528634 /nfs/dbraw/zinc/52/86/34/411528634.db2.gz ADAPZJHPXHRRQU-UHFFFAOYSA-N 1 2 248.330 2.304 20 0 BEADLO Cc1[nH]c(CN[C@H]2C[C@@H](C)n3ccnc32)[nH+]c1C ZINC000657483605 411529079 /nfs/dbraw/zinc/52/90/79/411529079.db2.gz MIZNYYPUSWIXBF-KCJUWKMLSA-N 1 2 245.330 2.019 20 0 BEADLO CC[N@@H+]1CCOC[C@@H]1CC(=O)c1cccs1 ZINC000119539949 170002044 /nfs/dbraw/zinc/00/20/44/170002044.db2.gz HDUVQONSVUWRAA-JTQLQIEISA-N 1 2 239.340 2.042 20 0 BEADLO CC[N@H+]1CCOC[C@@H]1CC(=O)c1cccs1 ZINC000119539949 170002045 /nfs/dbraw/zinc/00/20/45/170002045.db2.gz HDUVQONSVUWRAA-JTQLQIEISA-N 1 2 239.340 2.042 20 0 BEADLO Cc1nc(C[NH2+][C@@H](C)c2c(C)noc2C)co1 ZINC000660196181 411552822 /nfs/dbraw/zinc/55/28/22/411552822.db2.gz KLUZOYXGOBYYGU-ZETCQYMHSA-N 1 2 235.287 2.439 20 0 BEADLO CCc1ccc(C[NH2+][C@@H]2C[C@@H](C)n3ncnc32)o1 ZINC000657567840 411552855 /nfs/dbraw/zinc/55/28/55/411552855.db2.gz FOIHNCMCMIXVQK-BXKDBHETSA-N 1 2 246.314 2.229 20 0 BEADLO C[C@H]1C[C@@H]([NH2+]Cc2ccccc2F)c2ncnn21 ZINC000657566959 411553385 /nfs/dbraw/zinc/55/33/85/411553385.db2.gz GFKIBMXLMOIVRZ-JOYOIKCWSA-N 1 2 246.289 2.213 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)nc(C)n1 ZINC000660220439 411555254 /nfs/dbraw/zinc/55/52/54/411555254.db2.gz IKLMVONHSAFLAV-ZANVPECISA-N 1 2 237.322 2.273 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)nc(C)n1 ZINC000660220439 411555256 /nfs/dbraw/zinc/55/52/56/411555256.db2.gz IKLMVONHSAFLAV-ZANVPECISA-N 1 2 237.322 2.273 20 0 BEADLO CCc1nocc1C[N@@H+]1CCOC[C@@]1(C)CC ZINC000660148648 411546008 /nfs/dbraw/zinc/54/60/08/411546008.db2.gz LYVHCTZLRQQAGE-CYBMUJFWSA-N 1 2 238.331 2.238 20 0 BEADLO CCc1nocc1C[N@H+]1CCOC[C@@]1(C)CC ZINC000660148648 411546009 /nfs/dbraw/zinc/54/60/09/411546009.db2.gz LYVHCTZLRQQAGE-CYBMUJFWSA-N 1 2 238.331 2.238 20 0 BEADLO CCOC(=O)CCCC[N@@H+]1CCC[C@@H]1C(F)F ZINC000353179024 170199993 /nfs/dbraw/zinc/19/99/93/170199993.db2.gz YHHYLQXDZNGKIC-SNVBAGLBSA-N 1 2 249.301 2.449 20 0 BEADLO CCOC(=O)CCCC[N@H+]1CCC[C@@H]1C(F)F ZINC000353179024 170199995 /nfs/dbraw/zinc/19/99/95/170199995.db2.gz YHHYLQXDZNGKIC-SNVBAGLBSA-N 1 2 249.301 2.449 20 0 BEADLO CCOC(=O)CCC[N@@H+]1CCC[C@H]1C(F)F ZINC000353173927 170200234 /nfs/dbraw/zinc/20/02/34/170200234.db2.gz PVWVFZUXEGXGGW-VIFPVBQESA-N 1 2 235.274 2.059 20 0 BEADLO CCOC(=O)CCC[N@H+]1CCC[C@H]1C(F)F ZINC000353173927 170200235 /nfs/dbraw/zinc/20/02/35/170200235.db2.gz PVWVFZUXEGXGGW-VIFPVBQESA-N 1 2 235.274 2.059 20 0 BEADLO CCOC(=O)C[N@H+](C)CCc1ccccc1C ZINC000259166386 170214375 /nfs/dbraw/zinc/21/43/75/170214375.db2.gz UDFWYCNRHJYJNR-UHFFFAOYSA-N 1 2 235.327 2.032 20 0 BEADLO CCOC(=O)C[N@@H+](C)CCc1ccccc1C ZINC000259166386 170214377 /nfs/dbraw/zinc/21/43/77/170214377.db2.gz UDFWYCNRHJYJNR-UHFFFAOYSA-N 1 2 235.327 2.032 20 0 BEADLO CCOC(=O)C[N@H+](C)CC1(c2ccccc2)CC1 ZINC000189302672 170214563 /nfs/dbraw/zinc/21/45/63/170214563.db2.gz MIWPXZBYOUBHPE-UHFFFAOYSA-N 1 2 247.338 2.213 20 0 BEADLO CCOC(=O)C[N@@H+](C)CC1(c2ccccc2)CC1 ZINC000189302672 170214564 /nfs/dbraw/zinc/21/45/64/170214564.db2.gz MIWPXZBYOUBHPE-UHFFFAOYSA-N 1 2 247.338 2.213 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1cccc2cc[nH]c21 ZINC000271037209 170214793 /nfs/dbraw/zinc/21/47/93/170214793.db2.gz GJCHUOLKJVMLHC-UHFFFAOYSA-N 1 2 246.310 2.163 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1cccc2cc[nH]c21 ZINC000271037209 170214795 /nfs/dbraw/zinc/21/47/95/170214795.db2.gz GJCHUOLKJVMLHC-UHFFFAOYSA-N 1 2 246.310 2.163 20 0 BEADLO CCOC(=O)C[N@H+](C)[C@H](C)c1ccccc1 ZINC000050275275 170216133 /nfs/dbraw/zinc/21/61/33/170216133.db2.gz SSYJACMKLYDXNN-LLVKDONJSA-N 1 2 221.300 2.243 20 0 BEADLO CCOC(=O)C[N@@H+](C)[C@H](C)c1ccccc1 ZINC000050275275 170216134 /nfs/dbraw/zinc/21/61/34/170216134.db2.gz SSYJACMKLYDXNN-LLVKDONJSA-N 1 2 221.300 2.243 20 0 BEADLO CCOC(=O)C[N@@H+]1CCc2ccccc2[C@H]1C ZINC000171630045 170220994 /nfs/dbraw/zinc/22/09/94/170220994.db2.gz AICFXNGPDBMICT-LLVKDONJSA-N 1 2 233.311 2.169 20 0 BEADLO CCOC(=O)C[N@H+]1CCc2ccccc2[C@H]1C ZINC000171630045 170220997 /nfs/dbraw/zinc/22/09/97/170220997.db2.gz AICFXNGPDBMICT-LLVKDONJSA-N 1 2 233.311 2.169 20 0 BEADLO CCOC(=O)C[NH2+][C@@H]1CC[C@@H](c2ccccc2)C1 ZINC000370525705 170226649 /nfs/dbraw/zinc/22/66/49/170226649.db2.gz GMVKPNPPEOQCCP-ZIAGYGMSSA-N 1 2 247.338 2.475 20 0 BEADLO Cc1nc(C[NH2+][C@H](CO)c2ccccc2C)co1 ZINC000660239453 411557513 /nfs/dbraw/zinc/55/75/13/411557513.db2.gz RGYPYRSTKVUQAK-CQSZACIVSA-N 1 2 246.310 2.115 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+](C)Cc1cccc(C)c1 ZINC000043638667 170265755 /nfs/dbraw/zinc/26/57/55/170265755.db2.gz JBGVBUYBCKODRG-LBPRGKRZSA-N 1 2 235.327 2.378 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+](C)Cc1cccc(C)c1 ZINC000043638667 170265757 /nfs/dbraw/zinc/26/57/57/170265757.db2.gz JBGVBUYBCKODRG-LBPRGKRZSA-N 1 2 235.327 2.378 20 0 BEADLO CCOC(=O)[C@H]([NH2+]CC1CC1)c1ccccc1 ZINC000037968174 170277096 /nfs/dbraw/zinc/27/70/96/170277096.db2.gz DZOIERXEGXYYHR-CYBMUJFWSA-N 1 2 233.311 2.290 20 0 BEADLO CCOC1CC(Nc2ccc(C)[nH+]c2)C1 ZINC000163723378 170330368 /nfs/dbraw/zinc/33/03/68/170330368.db2.gz USIIUCCQNFADQA-UHFFFAOYSA-N 1 2 206.289 2.369 20 0 BEADLO CCOC1C[NH+](Cc2ccc(C)s2)C1 ZINC000297456816 170337189 /nfs/dbraw/zinc/33/71/89/170337189.db2.gz PQSPRIXKFPKORC-UHFFFAOYSA-N 1 2 211.330 2.277 20 0 BEADLO CCOCCC(=O)Nc1c(C)cc[nH+]c1C ZINC000362394694 170362801 /nfs/dbraw/zinc/36/28/01/170362801.db2.gz FKUSMCASIOGHNU-UHFFFAOYSA-N 1 2 222.288 2.064 20 0 BEADLO CCC1(CC)CC[NH+](CCc2cnn[nH]2)CC1 ZINC000660323630 411568692 /nfs/dbraw/zinc/56/86/92/411568692.db2.gz IXGXICNNCRIWTD-UHFFFAOYSA-N 1 2 236.363 2.249 20 0 BEADLO CCOCCC[N@@H+]1CCC[C@H]1C(F)F ZINC000353177179 170372962 /nfs/dbraw/zinc/37/29/62/170372962.db2.gz VNZOPFVHSIXQAM-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CCOCCC[N@H+]1CCC[C@H]1C(F)F ZINC000353177179 170372963 /nfs/dbraw/zinc/37/29/63/170372963.db2.gz VNZOPFVHSIXQAM-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO COCC1=CC[N@H+](Cc2nc(C)oc2C)CC1 ZINC000660318563 411568959 /nfs/dbraw/zinc/56/89/59/411568959.db2.gz KURAOTOOMPYIAL-UHFFFAOYSA-N 1 2 236.315 2.070 20 0 BEADLO COCC1=CC[N@@H+](Cc2nc(C)oc2C)CC1 ZINC000660318563 411568961 /nfs/dbraw/zinc/56/89/61/411568961.db2.gz KURAOTOOMPYIAL-UHFFFAOYSA-N 1 2 236.315 2.070 20 0 BEADLO CCOCC[N@H+](C)Cc1c(F)cccc1F ZINC000181482829 170390095 /nfs/dbraw/zinc/39/00/95/170390095.db2.gz RRLVLFSTHDBBMZ-UHFFFAOYSA-N 1 2 229.270 2.433 20 0 BEADLO CCOCC[N@@H+](C)Cc1c(F)cccc1F ZINC000181482829 170390096 /nfs/dbraw/zinc/39/00/96/170390096.db2.gz RRLVLFSTHDBBMZ-UHFFFAOYSA-N 1 2 229.270 2.433 20 0 BEADLO CCOCC[N@H+](CC)Cc1cc(F)ncc1F ZINC000294750919 170395831 /nfs/dbraw/zinc/39/58/31/170395831.db2.gz ICSAZSGTXDZBEP-UHFFFAOYSA-N 1 2 244.285 2.218 20 0 BEADLO CCOCC[N@@H+](CC)Cc1cc(F)ncc1F ZINC000294750919 170395833 /nfs/dbraw/zinc/39/58/33/170395833.db2.gz ICSAZSGTXDZBEP-UHFFFAOYSA-N 1 2 244.285 2.218 20 0 BEADLO CCOCC[N@H+](CC)Cc1nccn1C(F)F ZINC000107678728 170396443 /nfs/dbraw/zinc/39/64/43/170396443.db2.gz ZKUYEZLMVDIBDF-UHFFFAOYSA-N 1 2 247.289 2.137 20 0 BEADLO CCOCC[N@@H+](CC)Cc1nccn1C(F)F ZINC000107678728 170396445 /nfs/dbraw/zinc/39/64/45/170396445.db2.gz ZKUYEZLMVDIBDF-UHFFFAOYSA-N 1 2 247.289 2.137 20 0 BEADLO CC[C@]1(C)C[N@H+](Cc2nc(C)oc2C)CCO1 ZINC000660380074 411576104 /nfs/dbraw/zinc/57/61/04/411576104.db2.gz JMBHYMOVRXDAJK-CYBMUJFWSA-N 1 2 238.331 2.292 20 0 BEADLO CC[C@]1(C)C[N@@H+](Cc2nc(C)oc2C)CCO1 ZINC000660380074 411576106 /nfs/dbraw/zinc/57/61/06/411576106.db2.gz JMBHYMOVRXDAJK-CYBMUJFWSA-N 1 2 238.331 2.292 20 0 BEADLO O[C@H]1C[N@H+](CCCC2CCC2)CC(F)(F)C1 ZINC000660392487 411578172 /nfs/dbraw/zinc/57/81/72/411578172.db2.gz PRYOPRSPYCOMOP-LLVKDONJSA-N 1 2 233.302 2.269 20 0 BEADLO O[C@H]1C[N@@H+](CCCC2CCC2)CC(F)(F)C1 ZINC000660392487 411578173 /nfs/dbraw/zinc/57/81/73/411578173.db2.gz PRYOPRSPYCOMOP-LLVKDONJSA-N 1 2 233.302 2.269 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@@H]1CCc2ccc(O)cc21 ZINC000657694627 411581141 /nfs/dbraw/zinc/58/11/41/411581141.db2.gz ULFIUBZAMBRPHO-CQSZACIVSA-N 1 2 243.310 2.201 20 0 BEADLO Cc1ccc(F)c(CN(C)Cc2cn(C)c[nH+]2)c1 ZINC000660421293 411582646 /nfs/dbraw/zinc/58/26/46/411582646.db2.gz PDFGKTNCIJJWCB-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1nc(C[N@@H+]2CCO[C@@H](C(C)(C)C)C2)co1 ZINC000660441984 411584841 /nfs/dbraw/zinc/58/48/41/411584841.db2.gz LCYHCAAOHDPYIK-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1nc(C[N@H+]2CCO[C@@H](C(C)(C)C)C2)co1 ZINC000660441984 411584842 /nfs/dbraw/zinc/58/48/42/411584842.db2.gz LCYHCAAOHDPYIK-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1nc(C[N@@H+]2CCO[C@H](C(C)(C)C)C2)co1 ZINC000660441985 411584892 /nfs/dbraw/zinc/58/48/92/411584892.db2.gz LCYHCAAOHDPYIK-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1nc(C[N@H+]2CCO[C@H](C(C)(C)C)C2)co1 ZINC000660441985 411584893 /nfs/dbraw/zinc/58/48/93/411584893.db2.gz LCYHCAAOHDPYIK-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO O=C1CC[N@H+](Cc2cncs2)C2(CCC2)C1 ZINC000660820326 411645804 /nfs/dbraw/zinc/64/58/04/411645804.db2.gz OAEFEDSTFHDQDB-UHFFFAOYSA-N 1 2 236.340 2.231 20 0 BEADLO O=C1CC[N@@H+](Cc2cncs2)C2(CCC2)C1 ZINC000660820326 411645807 /nfs/dbraw/zinc/64/58/07/411645807.db2.gz OAEFEDSTFHDQDB-UHFFFAOYSA-N 1 2 236.340 2.231 20 0 BEADLO Fc1ccc(C(F)(F)C[NH2+][C@@H]2CCOC2)cc1 ZINC000657766462 411593030 /nfs/dbraw/zinc/59/30/30/411593030.db2.gz BSDMWIXWBDDQFM-LLVKDONJSA-N 1 2 245.244 2.296 20 0 BEADLO C[C@H](O)[C@H]([NH2+]Cc1cscn1)c1ccccc1 ZINC000657815029 411604016 /nfs/dbraw/zinc/60/40/16/411604016.db2.gz HBKKCOFQYGOJKS-GWCFXTLKSA-N 1 2 248.351 2.355 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)co1 ZINC000660607332 411606114 /nfs/dbraw/zinc/60/61/14/411606114.db2.gz TUSSBXJMIVLMLE-WDEREUQCSA-N 1 2 242.269 2.460 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)co1 ZINC000660607332 411606116 /nfs/dbraw/zinc/60/61/16/411606116.db2.gz TUSSBXJMIVLMLE-WDEREUQCSA-N 1 2 242.269 2.460 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2cnc3ccccc3n2)C1 ZINC000660692833 411617970 /nfs/dbraw/zinc/61/79/70/411617970.db2.gz SOIBYDGKFIKXLH-SNVBAGLBSA-N 1 2 231.274 2.174 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2cnc3ccccc3n2)C1 ZINC000660692833 411617971 /nfs/dbraw/zinc/61/79/71/411617971.db2.gz SOIBYDGKFIKXLH-SNVBAGLBSA-N 1 2 231.274 2.174 20 0 BEADLO C[N@@H+](Cc1cnc[nH]1)C[C@@H]1CCC2(CCCC2)O1 ZINC000661089997 411703359 /nfs/dbraw/zinc/70/33/59/411703359.db2.gz KQBHYGSXFISOQK-ZDUSSCGKSA-N 1 2 249.358 2.333 20 0 BEADLO C[N@H+](Cc1cnc[nH]1)C[C@@H]1CCC2(CCCC2)O1 ZINC000661089997 411703363 /nfs/dbraw/zinc/70/33/63/411703363.db2.gz KQBHYGSXFISOQK-ZDUSSCGKSA-N 1 2 249.358 2.333 20 0 BEADLO C[N@@H+](Cc1c[nH]cn1)C[C@@H]1CCC2(CCCC2)O1 ZINC000661089997 411703366 /nfs/dbraw/zinc/70/33/66/411703366.db2.gz KQBHYGSXFISOQK-ZDUSSCGKSA-N 1 2 249.358 2.333 20 0 BEADLO C[N@H+](Cc1c[nH]cn1)C[C@@H]1CCC2(CCCC2)O1 ZINC000661089997 411703370 /nfs/dbraw/zinc/70/33/70/411703370.db2.gz KQBHYGSXFISOQK-ZDUSSCGKSA-N 1 2 249.358 2.333 20 0 BEADLO C[N@H+](CCC(C)(C)C1CC1)Cc1n[nH]c(=O)o1 ZINC000660844583 411656535 /nfs/dbraw/zinc/65/65/35/411656535.db2.gz PXGCDNWPRIFQHP-UHFFFAOYSA-N 1 2 239.319 2.033 20 0 BEADLO C[N@@H+](CCC(C)(C)C1CC1)Cc1n[nH]c(=O)o1 ZINC000660844583 411656539 /nfs/dbraw/zinc/65/65/39/411656539.db2.gz PXGCDNWPRIFQHP-UHFFFAOYSA-N 1 2 239.319 2.033 20 0 BEADLO CC1CCC(C[N@H+](C)Cc2n[nH]c(=O)o2)CC1 ZINC000660845233 411657428 /nfs/dbraw/zinc/65/74/28/411657428.db2.gz MDMFPTHIKZWCFF-UHFFFAOYSA-N 1 2 239.319 2.033 20 0 BEADLO CC1CCC(C[N@@H+](C)Cc2n[nH]c(=O)o2)CC1 ZINC000660845233 411657433 /nfs/dbraw/zinc/65/74/33/411657433.db2.gz MDMFPTHIKZWCFF-UHFFFAOYSA-N 1 2 239.319 2.033 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@@H+]1Cc1coc(C)n1 ZINC000660912806 411668363 /nfs/dbraw/zinc/66/83/63/411668363.db2.gz NCSAQACBHRFBSY-LBPRGKRZSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@H+]1Cc1coc(C)n1 ZINC000660912806 411668367 /nfs/dbraw/zinc/66/83/67/411668367.db2.gz NCSAQACBHRFBSY-LBPRGKRZSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@H]1C[N@H+](Cc2nc(C)oc2C)[C@H](C)CO1 ZINC000660912332 411669671 /nfs/dbraw/zinc/66/96/71/411669671.db2.gz JCPWJOLYWYLEIH-SKDRFNHKSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2nc(C)oc2C)[C@H](C)CO1 ZINC000660912332 411669672 /nfs/dbraw/zinc/66/96/72/411669672.db2.gz JCPWJOLYWYLEIH-SKDRFNHKSA-N 1 2 238.331 2.291 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2C[C@@H]3CCCC[C@@H]32)no1 ZINC000660930954 411681800 /nfs/dbraw/zinc/68/18/00/411681800.db2.gz LTOJSSUZWFDOEO-MIMYLULJSA-N 1 2 221.304 2.313 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2C[C@@H]3CCCC[C@@H]32)no1 ZINC000660930954 411681802 /nfs/dbraw/zinc/68/18/02/411681802.db2.gz LTOJSSUZWFDOEO-MIMYLULJSA-N 1 2 221.304 2.313 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)Cc1cc(F)ccc1F ZINC000661086816 411700682 /nfs/dbraw/zinc/70/06/82/411700682.db2.gz IREDFMJUQDZSGR-UHFFFAOYSA-N 1 2 237.253 2.320 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)Cc1cc(F)ccc1F ZINC000661086816 411700684 /nfs/dbraw/zinc/70/06/84/411700684.db2.gz IREDFMJUQDZSGR-UHFFFAOYSA-N 1 2 237.253 2.320 20 0 BEADLO Cc1ccc(NCCc2cc[nH+]cc2C)nn1 ZINC000663744711 411738244 /nfs/dbraw/zinc/73/82/44/411738244.db2.gz IVWUGTCHIPHNOA-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO CCOc1nnc(C[N@H+](C)CCC2CC2)s1 ZINC000336702088 170606043 /nfs/dbraw/zinc/60/60/43/170606043.db2.gz MZZZXYFQWFGENG-UHFFFAOYSA-N 1 2 241.360 2.169 20 0 BEADLO CCOc1nnc(C[N@@H+](C)CCC2CC2)s1 ZINC000336702088 170606044 /nfs/dbraw/zinc/60/60/44/170606044.db2.gz MZZZXYFQWFGENG-UHFFFAOYSA-N 1 2 241.360 2.169 20 0 BEADLO Nc1[nH+]cccc1CNc1nc(C2CC2)ns1 ZINC000663963732 411792703 /nfs/dbraw/zinc/79/27/03/411792703.db2.gz YGOIZTLSNQPUQO-UHFFFAOYSA-N 1 2 247.327 2.005 20 0 BEADLO Nc1cccc2c1cc[nH+]c2N1CC[C@@H](F)C1 ZINC000663962661 411793083 /nfs/dbraw/zinc/79/30/83/411793083.db2.gz OZADNUKMYHUSFJ-SECBINFHSA-N 1 2 231.274 2.365 20 0 BEADLO C[C@@H]1COC2(CCC2)C[N@@H+]1Cc1nccs1 ZINC000661470626 411782380 /nfs/dbraw/zinc/78/23/80/411782380.db2.gz UPQNXRINVIRJFR-SNVBAGLBSA-N 1 2 238.356 2.287 20 0 BEADLO C[C@@H]1COC2(CCC2)C[N@H+]1Cc1nccs1 ZINC000661470626 411782382 /nfs/dbraw/zinc/78/23/82/411782382.db2.gz UPQNXRINVIRJFR-SNVBAGLBSA-N 1 2 238.356 2.287 20 0 BEADLO Cc1nc(N2CC[C@@H]2C(F)F)c(C)c(C)[nH+]1 ZINC000663946132 411786087 /nfs/dbraw/zinc/78/60/87/411786087.db2.gz QPEQWZSJLYODGO-SECBINFHSA-N 1 2 227.258 2.246 20 0 BEADLO CCn1cc[nH+]c1CNc1cc(C(C)=O)ccn1 ZINC000663956789 411790316 /nfs/dbraw/zinc/79/03/16/411790316.db2.gz IAQRKBFSLUMAMV-UHFFFAOYSA-N 1 2 244.298 2.113 20 0 BEADLO C[C@@H](c1cnccn1)[N@@H+]1CCO[C@](C)(C2CC2)C1 ZINC000661169948 411727307 /nfs/dbraw/zinc/72/73/07/411727307.db2.gz VMDRTYUFVYLMQQ-FZMZJTMJSA-N 1 2 247.342 2.039 20 0 BEADLO C[C@@H](c1cnccn1)[N@H+]1CCO[C@](C)(C2CC2)C1 ZINC000661169948 411727309 /nfs/dbraw/zinc/72/73/09/411727309.db2.gz VMDRTYUFVYLMQQ-FZMZJTMJSA-N 1 2 247.342 2.039 20 0 BEADLO Cc1ccncc1C[NH+]1C[C@@H](C)C(=O)[C@H](C)C1 ZINC000661545862 411800136 /nfs/dbraw/zinc/80/01/36/411800136.db2.gz HSGYOCVAZVBEGX-VXGBXAGGSA-N 1 2 232.327 2.047 20 0 BEADLO CO[C@H](COc1cc[nH+]cc1)C1CCC1 ZINC000664017243 411815600 /nfs/dbraw/zinc/81/56/00/411815600.db2.gz WTIZGLQLWSCJDR-GFCCVEGCSA-N 1 2 207.273 2.276 20 0 BEADLO CCCc1nc(C)c(COCc2[nH]cc[nH+]2)o1 ZINC000664031711 411820160 /nfs/dbraw/zinc/82/01/60/411820160.db2.gz ASGCWIFPGIYIDK-UHFFFAOYSA-N 1 2 235.287 2.375 20 0 BEADLO Cc1ccc(COc2ccnnc2)c(C)[nH+]1 ZINC000664068534 411837618 /nfs/dbraw/zinc/83/76/18/411837618.db2.gz LLQWWIRBKVNXDN-UHFFFAOYSA-N 1 2 215.256 2.067 20 0 BEADLO c1nc(N2C[C@@H]3CCCC[C@@H]32)cc(NC2CC2)[nH+]1 ZINC000664079584 411842719 /nfs/dbraw/zinc/84/27/19/411842719.db2.gz BIXFKLIUIDSFTE-JQWIXIFHSA-N 1 2 244.342 2.430 20 0 BEADLO c1nc(NC2CC2)cc(N2C[C@@H]3CCCC[C@@H]32)[nH+]1 ZINC000664079584 411842720 /nfs/dbraw/zinc/84/27/20/411842720.db2.gz BIXFKLIUIDSFTE-JQWIXIFHSA-N 1 2 244.342 2.430 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@@H](CCF)C2)no1 ZINC000661693594 411843000 /nfs/dbraw/zinc/84/30/00/411843000.db2.gz PVVVYHYICXDWGN-JTQLQIEISA-N 1 2 241.310 2.204 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@@H](CCF)C2)no1 ZINC000661693594 411843002 /nfs/dbraw/zinc/84/30/02/411843002.db2.gz PVVVYHYICXDWGN-JTQLQIEISA-N 1 2 241.310 2.204 20 0 BEADLO Cc1ccc(Cn2cc(C3CC3)nn2)c(C)[nH+]1 ZINC000664121420 411860818 /nfs/dbraw/zinc/86/08/18/411860818.db2.gz DDQQQNXSKWMNCI-UHFFFAOYSA-N 1 2 228.299 2.216 20 0 BEADLO CC[C@@H](C)[C@@H](C)C(=O)NCc1[nH]c[nH+]c1C ZINC000272687523 170769990 /nfs/dbraw/zinc/76/99/90/170769990.db2.gz PMOHCSVQNIDWIF-RKDXNWHRSA-N 1 2 223.320 2.017 20 0 BEADLO C[C@@H](Nc1cc[nH+]c(C(C)(C)C)n1)C1(CO)CC1 ZINC000664271852 411907044 /nfs/dbraw/zinc/90/70/44/411907044.db2.gz MGZFSUBZVUNNMH-SNVBAGLBSA-N 1 2 249.358 2.347 20 0 BEADLO COCC1(C2CCC2)CN(c2cc(C)[nH+]cn2)C1 ZINC000664285051 411911892 /nfs/dbraw/zinc/91/18/92/411911892.db2.gz VQPUZPKVDNPQOS-UHFFFAOYSA-N 1 2 247.342 2.038 20 0 BEADLO COc1c(N)[nH+]cnc1NCCCC1CCC1 ZINC000664396579 411942783 /nfs/dbraw/zinc/94/27/83/411942783.db2.gz PYTQVLYBHVJUIU-UHFFFAOYSA-N 1 2 236.319 2.060 20 0 BEADLO COc1c(N)nc[nH+]c1NCCCC1CCC1 ZINC000664396579 411942786 /nfs/dbraw/zinc/94/27/86/411942786.db2.gz PYTQVLYBHVJUIU-UHFFFAOYSA-N 1 2 236.319 2.060 20 0 BEADLO COc1c(C)[nH+]cnc1NCCc1ccoc1 ZINC000664381273 411935636 /nfs/dbraw/zinc/93/56/36/411935636.db2.gz SXNACFYOBYBWOP-UHFFFAOYSA-N 1 2 233.271 2.041 20 0 BEADLO C[C@@H](O)[C@H]1CCC[N@@H+]1Cc1ncc(Cl)s1 ZINC000661764403 411873731 /nfs/dbraw/zinc/87/37/31/411873731.db2.gz DBSKGGSWDGRACO-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H](O)[C@H]1CCC[N@H+]1Cc1ncc(Cl)s1 ZINC000661764403 411873732 /nfs/dbraw/zinc/87/37/32/411873732.db2.gz DBSKGGSWDGRACO-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO COCC1(Nc2cc[nH+]c(C)n2)CCCC1 ZINC000664161024 411875004 /nfs/dbraw/zinc/87/50/04/411875004.db2.gz MINBHFKTVNAKJO-UHFFFAOYSA-N 1 2 221.304 2.156 20 0 BEADLO CC[C@H](COCC1CC1)Nc1cc(C)[nH+]cn1 ZINC000664176137 411881591 /nfs/dbraw/zinc/88/15/91/411881591.db2.gz XFGXSGVKGPTCRT-GFCCVEGCSA-N 1 2 235.331 2.402 20 0 BEADLO Cc1nc(C[NH+]2CCC(c3ccon3)CC2)co1 ZINC000662048828 411966647 /nfs/dbraw/zinc/96/66/47/411966647.db2.gz LCRKOPGVSSMFJY-UHFFFAOYSA-N 1 2 247.298 2.351 20 0 BEADLO OC1(CNc2cccc[nH+]2)CCC(F)(F)CC1 ZINC000664580783 411990884 /nfs/dbraw/zinc/99/08/84/411990884.db2.gz ZPIAFZJEMGFOHG-UHFFFAOYSA-N 1 2 242.269 2.434 20 0 BEADLO CO[C@@]1(C)C[C@H]1Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000664606239 411997030 /nfs/dbraw/zinc/99/70/30/411997030.db2.gz UCEQABUQAFBQOO-MFKMUULPSA-N 1 2 233.315 2.252 20 0 BEADLO Cc1nc(NC[C@H]2CCOC2(C)C)cc[nH+]1 ZINC000664606755 411998365 /nfs/dbraw/zinc/99/83/65/411998365.db2.gz ZSCRKZKUKFGKIK-SNVBAGLBSA-N 1 2 221.304 2.012 20 0 BEADLO C[C@@H](Nc1nc(C2CC2)ns1)c1[nH+]ccn1C ZINC000664608933 411999018 /nfs/dbraw/zinc/99/90/18/411999018.db2.gz QOOSNURSGZHDSV-SSDOTTSWSA-N 1 2 249.343 2.322 20 0 BEADLO FC(F)(F)C[C@H]1CN(c2cccc[nH+]2)CCO1 ZINC000664638856 412001595 /nfs/dbraw/zinc/00/15/95/412001595.db2.gz KSHXWOGHPXFXMC-VIFPVBQESA-N 1 2 246.232 2.239 20 0 BEADLO CC[C@@H]([NH2+][C@@H](C)c1ccccc1)C(=O)OC ZINC000034431769 170908760 /nfs/dbraw/zinc/90/87/60/170908760.db2.gz KWPWOWNUGHMEDM-CMPLNLGQSA-N 1 2 221.300 2.289 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@H](C3CCC3)C2)no1 ZINC000662039155 411954628 /nfs/dbraw/zinc/95/46/28/411954628.db2.gz OYEXWEQCOMRXLN-LBPRGKRZSA-N 1 2 235.331 2.390 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@H](C3CCC3)C2)no1 ZINC000662039155 411954631 /nfs/dbraw/zinc/95/46/31/411954631.db2.gz OYEXWEQCOMRXLN-LBPRGKRZSA-N 1 2 235.331 2.390 20 0 BEADLO COc1ccc(F)cc1C[NH+]1CC2(CC2)C1 ZINC000335375945 487621578 /nfs/dbraw/zinc/62/15/78/487621578.db2.gz NFVDRPIBVCLVKK-UHFFFAOYSA-N 1 2 221.275 2.430 20 0 BEADLO CC[C@@H]1CCC[C@H](NC(=O)CCn2cc[nH+]c2)C1 ZINC000265826981 170994460 /nfs/dbraw/zinc/99/44/60/170994460.db2.gz VKNDRQYSPRRVDK-OLZOCXBDSA-N 1 2 249.358 2.358 20 0 BEADLO COCCCCC[N@H+](C)Cc1nnc(C)s1 ZINC000662261118 412054929 /nfs/dbraw/zinc/05/49/29/412054929.db2.gz UTLDQNLFKUMLQX-UHFFFAOYSA-N 1 2 243.376 2.095 20 0 BEADLO COCCCCC[N@@H+](C)Cc1nnc(C)s1 ZINC000662261118 412054932 /nfs/dbraw/zinc/05/49/32/412054932.db2.gz UTLDQNLFKUMLQX-UHFFFAOYSA-N 1 2 243.376 2.095 20 0 BEADLO CC[C@@H]1CCN(C(=O)c2ccc3[nH+]ccn3c2)C1 ZINC000176593285 171007876 /nfs/dbraw/zinc/00/78/76/171007876.db2.gz JGCSDBLLAUFBOT-LLVKDONJSA-N 1 2 243.310 2.206 20 0 BEADLO CC[C@@H]1CC[N@@H+]1Cc1cc(F)ncc1F ZINC000295582779 171025760 /nfs/dbraw/zinc/02/57/60/171025760.db2.gz BOLYOSWPSKDELL-SECBINFHSA-N 1 2 212.243 2.344 20 0 BEADLO CC[C@@H]1CC[N@H+]1Cc1cc(F)ncc1F ZINC000295582779 171025762 /nfs/dbraw/zinc/02/57/62/171025762.db2.gz BOLYOSWPSKDELL-SECBINFHSA-N 1 2 212.243 2.344 20 0 BEADLO CC[C@@H]1CC[N@@H+]1Cc1ncc(Cl)n1C ZINC000292433621 171025796 /nfs/dbraw/zinc/02/57/96/171025796.db2.gz NVJCRCNQWGLKIS-MRVPVSSYSA-N 1 2 213.712 2.058 20 0 BEADLO CC[C@@H]1CC[N@H+]1Cc1ncc(Cl)n1C ZINC000292433621 171025798 /nfs/dbraw/zinc/02/57/98/171025798.db2.gz NVJCRCNQWGLKIS-MRVPVSSYSA-N 1 2 213.712 2.058 20 0 BEADLO CC[C@@H]1CC[C@@H]1[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000336682861 171043792 /nfs/dbraw/zinc/04/37/92/171043792.db2.gz DFUSKTLBWFSTHX-AXFHLTTASA-N 1 2 227.348 2.495 20 0 BEADLO CC[C@@H]1CC[C@H](C(=O)Nc2cc[nH+]c(C)c2)O1 ZINC000268137834 171048855 /nfs/dbraw/zinc/04/88/55/171048855.db2.gz NDVBCQRVGWGPFB-VXGBXAGGSA-N 1 2 234.299 2.286 20 0 BEADLO CC[C@@H]1CN(c2cc[nH+]c(C3CC3)n2)CCCO1 ZINC000341406810 171098195 /nfs/dbraw/zinc/09/81/95/171098195.db2.gz LGBHETJTLUDVAF-GFCCVEGCSA-N 1 2 247.342 2.359 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1nc2ccccc2o1 ZINC000115577804 171108572 /nfs/dbraw/zinc/10/85/72/171108572.db2.gz LLSIEUIJGWTJDD-LLVKDONJSA-N 1 2 246.310 2.439 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1nc2ccccc2o1 ZINC000115577804 171108574 /nfs/dbraw/zinc/10/85/74/171108574.db2.gz LLSIEUIJGWTJDD-LLVKDONJSA-N 1 2 246.310 2.439 20 0 BEADLO CC[C@@H]1COCCN1Cc1[nH+]ccn1C(C)C ZINC000336705699 171108839 /nfs/dbraw/zinc/10/88/39/171108839.db2.gz NVEZYDPYPFSRED-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1nc(C)cs1 ZINC000268047324 171110392 /nfs/dbraw/zinc/11/03/92/171110392.db2.gz SHMDQPKEFOESNS-WDEREUQCSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1nc(C)cs1 ZINC000268047324 171110395 /nfs/dbraw/zinc/11/03/95/171110395.db2.gz SHMDQPKEFOESNS-WDEREUQCSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1[C@H](C)CCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000283016519 171157420 /nfs/dbraw/zinc/15/74/20/171157420.db2.gz HNIKPECGYBQFLY-DJVCXFJCSA-N 1 2 233.315 2.070 20 0 BEADLO CC[C@@]([NH2+]CC1CC1)(C(=O)OC)c1ccccc1 ZINC000037967730 171194813 /nfs/dbraw/zinc/19/48/13/171194813.db2.gz AKMIITVTDSWMTO-HNNXBMFYSA-N 1 2 247.338 2.465 20 0 BEADLO CC[C@@]1(C)CCN(C(=O)Nc2cc[nH+]c(C)c2)C1 ZINC000334150906 171201010 /nfs/dbraw/zinc/20/10/10/171201010.db2.gz OJHTWKLKAFGMRG-AWEZNQCLSA-N 1 2 247.342 2.466 20 0 BEADLO CC[C@H](C(=O)OC)[N@H+](C)Cc1ccc(C)s1 ZINC000173302652 171241071 /nfs/dbraw/zinc/24/10/71/171241071.db2.gz NXXGRWAINWMYEF-LLVKDONJSA-N 1 2 241.356 2.440 20 0 BEADLO CC[C@H](C(=O)OC)[N@@H+](C)Cc1ccc(C)s1 ZINC000173302652 171241073 /nfs/dbraw/zinc/24/10/73/171241073.db2.gz NXXGRWAINWMYEF-LLVKDONJSA-N 1 2 241.356 2.440 20 0 BEADLO CC[C@H](C)C(=O)N(C)Cc1cn2c([nH+]1)CCCC2 ZINC000375949088 171246724 /nfs/dbraw/zinc/24/67/24/171246724.db2.gz SCBQDYGKKRTLNG-NSHDSACASA-N 1 2 249.358 2.224 20 0 BEADLO CC[C@H](C)C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000336463680 171247550 /nfs/dbraw/zinc/24/75/50/171247550.db2.gz QAMMWGSOOMSHFW-JTQLQIEISA-N 1 2 235.331 2.162 20 0 BEADLO CC[C@H](C)C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000336463680 171247552 /nfs/dbraw/zinc/24/75/52/171247552.db2.gz QAMMWGSOOMSHFW-JTQLQIEISA-N 1 2 235.331 2.162 20 0 BEADLO CC[C@H](C)C(=O)N1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000120897043 171249598 /nfs/dbraw/zinc/24/95/98/171249598.db2.gz KGWAIDHJWZTTPJ-WCQYABFASA-N 1 2 248.326 2.107 20 0 BEADLO CC[C@H](C)C(=O)Nc1c[nH+]ccc1OC ZINC000299463157 171256941 /nfs/dbraw/zinc/25/69/41/171256941.db2.gz DBUMJMSGGUBTPN-QMMMGPOBSA-N 1 2 208.261 2.075 20 0 BEADLO CC[C@H](C)CCC(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000285292669 171267239 /nfs/dbraw/zinc/26/72/39/171267239.db2.gz VMWZEYUBXDYUOK-RYUDHWBXSA-N 1 2 237.347 2.214 20 0 BEADLO CC[C@H](C)CCC(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000354233899 171268302 /nfs/dbraw/zinc/26/83/02/171268302.db2.gz ALXFDDGVWHJGOI-QWRGUYRKSA-N 1 2 249.358 2.210 20 0 BEADLO CC[C@H](C)CCC(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000354233899 171268304 /nfs/dbraw/zinc/26/83/04/171268304.db2.gz ALXFDDGVWHJGOI-QWRGUYRKSA-N 1 2 249.358 2.210 20 0 BEADLO CC[C@H](C)C[N@@H+]1CCOCC(F)(F)C1 ZINC000367988420 171281695 /nfs/dbraw/zinc/28/16/95/171281695.db2.gz KNNJKYCLOURFIU-VIFPVBQESA-N 1 2 207.264 2.000 20 0 BEADLO CC[C@H](C)C[N@H+]1CCOCC(F)(F)C1 ZINC000367988420 171281697 /nfs/dbraw/zinc/28/16/97/171281697.db2.gz KNNJKYCLOURFIU-VIFPVBQESA-N 1 2 207.264 2.000 20 0 BEADLO CC[C@H](C)C[NH2+]c1ccc(-n2cnnn2)cc1 ZINC000020094475 171287765 /nfs/dbraw/zinc/28/77/65/171287765.db2.gz IDMQALGYOTWYMA-JTQLQIEISA-N 1 2 231.303 2.120 20 0 BEADLO CC[C@H](C)[N@H+](CC(=O)OC)Cc1ccc(C)o1 ZINC000281289196 171311697 /nfs/dbraw/zinc/31/16/97/171311697.db2.gz OYWANYXEDRWIDG-JTQLQIEISA-N 1 2 239.315 2.362 20 0 BEADLO CC[C@H](C)[N@@H+](CC(=O)OC)Cc1ccc(C)o1 ZINC000281289196 171311698 /nfs/dbraw/zinc/31/16/98/171311698.db2.gz OYWANYXEDRWIDG-JTQLQIEISA-N 1 2 239.315 2.362 20 0 BEADLO CC[C@H](C)Sc1[nH+]cnc2c1cnn2C ZINC000248182991 171357885 /nfs/dbraw/zinc/35/78/85/171357885.db2.gz ZXCMQSRLHLNWAH-ZETCQYMHSA-N 1 2 222.317 2.254 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)NCCNc1cccc[nH+]1 ZINC000272579118 171359031 /nfs/dbraw/zinc/35/90/31/171359031.db2.gz OAWWRXDGGSSJCZ-NWDGAFQWSA-N 1 2 249.358 2.292 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)NCc1[nH]c[nH+]c1C ZINC000272687520 171359869 /nfs/dbraw/zinc/35/98/69/171359869.db2.gz PMOHCSVQNIDWIF-DTWKUNHWSA-N 1 2 223.320 2.017 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000356556780 171383753 /nfs/dbraw/zinc/38/37/53/171383753.db2.gz YVUBSDZUMAZHNX-UWVGGRQHSA-N 1 2 223.320 2.050 20 0 BEADLO COCc1cc(-c2[nH+]ccn2C)cs1 ZINC000665181216 412121181 /nfs/dbraw/zinc/12/11/81/412121181.db2.gz MAZGTEMGBUXRTO-UHFFFAOYSA-N 1 2 208.286 2.295 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2c(c1)CCCO2 ZINC000665184575 412122445 /nfs/dbraw/zinc/12/24/45/412122445.db2.gz RIQQEOLSISJMAN-UHFFFAOYSA-N 1 2 214.268 2.412 20 0 BEADLO CCCn1nc(C)c(-c2[nH]cc[nH+]2)c1C ZINC000665193687 412127190 /nfs/dbraw/zinc/12/71/90/412127190.db2.gz FUQMMXKUMMAEHE-UHFFFAOYSA-N 1 2 204.277 2.300 20 0 BEADLO CC(C)c1nc(C[N@@H+]2CC3CC2(C)C3)no1 ZINC000662382573 412133190 /nfs/dbraw/zinc/13/31/90/412133190.db2.gz ZPBACFHVEPPXSS-UHFFFAOYSA-N 1 2 221.304 2.177 20 0 BEADLO CC(C)c1nc(C[N@H+]2CC3CC2(C)C3)no1 ZINC000662382573 412133193 /nfs/dbraw/zinc/13/31/93/412133193.db2.gz ZPBACFHVEPPXSS-UHFFFAOYSA-N 1 2 221.304 2.177 20 0 BEADLO CC1(c2csc(Cn3cc[nH+]c3)n2)CC1 ZINC000663220457 412394208 /nfs/dbraw/zinc/39/42/08/412394208.db2.gz ROOMTBLKLFUEEV-UHFFFAOYSA-N 1 2 219.313 2.439 20 0 BEADLO CCCc1nccnc1NCc1c[nH+]cn1CC ZINC000663259001 412402506 /nfs/dbraw/zinc/40/25/06/412402506.db2.gz USBAQJSWTMWTRJ-UHFFFAOYSA-N 1 2 245.330 2.258 20 0 BEADLO CCc1ccc(CN2CCn3c[nH+]cc3C2)o1 ZINC000291655892 171801870 /nfs/dbraw/zinc/80/18/70/171801870.db2.gz UXUWHPXCZRDIKM-UHFFFAOYSA-N 1 2 231.299 2.054 20 0 BEADLO CCc1ccc(CNC(=O)c2c[nH+]c(C)[nH]2)s1 ZINC000264840378 171803593 /nfs/dbraw/zinc/80/35/93/171803593.db2.gz KXBJPNPUIGRRRG-UHFFFAOYSA-N 1 2 249.339 2.272 20 0 BEADLO CCc1ccc(C[NH2+][C@@H](C(=O)OC)C2CC2)cc1 ZINC000227769589 171808855 /nfs/dbraw/zinc/80/88/55/171808855.db2.gz PQSAVANCVQGJST-CQSZACIVSA-N 1 2 247.338 2.290 20 0 BEADLO CCc1ccccc1C[NH2+]C(C)(C)C(=O)OC ZINC000052202272 171882097 /nfs/dbraw/zinc/88/20/97/171882097.db2.gz MFMOWOHCYSOKMF-UHFFFAOYSA-N 1 2 235.327 2.290 20 0 BEADLO CCc1nc(C)c(CNc2cc[nH+]c(C)n2)o1 ZINC000292152822 171957148 /nfs/dbraw/zinc/95/71/48/171957148.db2.gz CJCYTFXIKMYSON-UHFFFAOYSA-N 1 2 232.287 2.256 20 0 BEADLO CCc1nc([C@H]2CCCC[N@H+]2CC)no1 ZINC000377430709 172007302 /nfs/dbraw/zinc/00/73/02/172007302.db2.gz UZFUKQNQPCIRTR-SECBINFHSA-N 1 2 209.293 2.179 20 0 BEADLO CCc1nc([C@H]2CCCC[N@@H+]2CC)no1 ZINC000377430709 172007304 /nfs/dbraw/zinc/00/73/04/172007304.db2.gz UZFUKQNQPCIRTR-SECBINFHSA-N 1 2 209.293 2.179 20 0 BEADLO CCc1ncc(C[N@@H+]2CCO[C@@H](C)[C@H]2C)s1 ZINC000271198555 172017091 /nfs/dbraw/zinc/01/70/91/172017091.db2.gz SDAPQPGCDQMRDZ-ZJUUUORDSA-N 1 2 240.372 2.315 20 0 BEADLO CCc1ncc(C[N@H+]2CCO[C@@H](C)[C@H]2C)s1 ZINC000271198555 172017092 /nfs/dbraw/zinc/01/70/92/172017092.db2.gz SDAPQPGCDQMRDZ-ZJUUUORDSA-N 1 2 240.372 2.315 20 0 BEADLO CCc1nn(C)cc1N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000294242690 172043645 /nfs/dbraw/zinc/04/36/45/172043645.db2.gz WFENUMNLCZGKLG-ONGXEEELSA-N 1 2 245.330 2.297 20 0 BEADLO CCc1nn(C)cc1N[C@@H](C)c1[nH+]ccn1CC ZINC000296830173 172044200 /nfs/dbraw/zinc/04/42/00/172044200.db2.gz MMTSKVFAAUREHT-JTQLQIEISA-N 1 2 247.346 2.372 20 0 BEADLO CCc1nnc(C[N@@H+]2CCC(C)=C(C)C2)o1 ZINC000280501795 172047854 /nfs/dbraw/zinc/04/78/54/172047854.db2.gz CEMLRINUBWAHQZ-UHFFFAOYSA-N 1 2 221.304 2.174 20 0 BEADLO CCc1nnc(C[N@H+]2CCC(C)=C(C)C2)o1 ZINC000280501795 172047855 /nfs/dbraw/zinc/04/78/55/172047855.db2.gz CEMLRINUBWAHQZ-UHFFFAOYSA-N 1 2 221.304 2.174 20 0 BEADLO CCc1nnc([C@H](C)[N@H+]2CC=C(C)CC2)o1 ZINC000336438634 172065135 /nfs/dbraw/zinc/06/51/35/172065135.db2.gz UTYMUYCLZFJBAZ-JTQLQIEISA-N 1 2 221.304 2.345 20 0 BEADLO CCc1nnc([C@H](C)[N@@H+]2CC=C(C)CC2)o1 ZINC000336438634 172065138 /nfs/dbraw/zinc/06/51/38/172065138.db2.gz UTYMUYCLZFJBAZ-JTQLQIEISA-N 1 2 221.304 2.345 20 0 BEADLO CCc1noc(C)c1C[NH2+][C@@H](C)c1nccn1C ZINC000340442071 172079233 /nfs/dbraw/zinc/07/92/33/172079233.db2.gz MPLSQOKVOONHTP-VIFPVBQESA-N 1 2 248.330 2.130 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1ccnn1CC ZINC000293678759 172095756 /nfs/dbraw/zinc/09/57/56/172095756.db2.gz PMRSIIIFCYFROU-UHFFFAOYSA-N 1 2 248.330 2.085 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1ccnn1CC ZINC000293678759 172095758 /nfs/dbraw/zinc/09/57/58/172095758.db2.gz PMRSIIIFCYFROU-UHFFFAOYSA-N 1 2 248.330 2.085 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1ccco1 ZINC000295023208 172096148 /nfs/dbraw/zinc/09/61/48/172096148.db2.gz WVSVMLHLXCVRBS-UHFFFAOYSA-N 1 2 220.272 2.462 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1ccco1 ZINC000295023208 172096149 /nfs/dbraw/zinc/09/61/49/172096149.db2.gz WVSVMLHLXCVRBS-UHFFFAOYSA-N 1 2 220.272 2.462 20 0 BEADLO CCCCC[C@@H]([NH2+][C@@H](CC)COC)C(=O)OC ZINC001652223458 1173048389 /nfs/dbraw/zinc/04/83/89/1173048389.db2.gz JPCDABDRAFKNCE-NWDGAFQWSA-N 1 2 245.363 2.123 20 0 BEADLO CCn1cc(CC[N@@H+]2CCC[C@H]2C(F)F)cn1 ZINC000353167209 172160719 /nfs/dbraw/zinc/16/07/19/172160719.db2.gz ABHNRJZVNCMWQC-NSHDSACASA-N 1 2 243.301 2.175 20 0 BEADLO CCn1cc(CC[N@H+]2CCC[C@H]2C(F)F)cn1 ZINC000353167209 172160722 /nfs/dbraw/zinc/16/07/22/172160722.db2.gz ABHNRJZVNCMWQC-NSHDSACASA-N 1 2 243.301 2.175 20 0 BEADLO CCn1cc(C[N@@H+]2CCn3cccc3[C@@H]2C)cn1 ZINC000179564611 172164322 /nfs/dbraw/zinc/16/43/22/172164322.db2.gz RSABNMXWUVCBHG-LBPRGKRZSA-N 1 2 244.342 2.281 20 0 BEADLO CCn1cc(C[N@H+]2CCn3cccc3[C@@H]2C)cn1 ZINC000179564611 172164326 /nfs/dbraw/zinc/16/43/26/172164326.db2.gz RSABNMXWUVCBHG-LBPRGKRZSA-N 1 2 244.342 2.281 20 0 BEADLO CCn1ccnc1C[NH+]1CCC(C(F)F)CC1 ZINC000336701548 172221302 /nfs/dbraw/zinc/22/13/02/172221302.db2.gz LRCHFPSJTWHFDJ-UHFFFAOYSA-N 1 2 243.301 2.380 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C[C@H]1CCC[C@@H]1C ZINC000295590351 172222124 /nfs/dbraw/zinc/22/21/24/172222124.db2.gz HUGHSCIQNCUSIG-NWDGAFQWSA-N 1 2 249.358 2.346 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@H](C)C(C)(C)C ZINC000295813754 172222561 /nfs/dbraw/zinc/22/25/61/172222561.db2.gz SVPSCCKMRFMKCM-JTQLQIEISA-N 1 2 237.347 2.201 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)c1c(C)coc1C ZINC000295732110 172223158 /nfs/dbraw/zinc/22/31/58/172223158.db2.gz RNSSGQSNSJUXOL-UHFFFAOYSA-N 1 2 247.298 2.043 20 0 BEADLO CCn1cc[nH+]c1CN[C@@H](C)c1nccs1 ZINC000070732284 172224665 /nfs/dbraw/zinc/22/46/65/172224665.db2.gz XPARVYRYSRSPMR-VIFPVBQESA-N 1 2 236.344 2.210 20 0 BEADLO CCn1c[nH+]cc1CNc1cn(C)nc1C(C)C ZINC000302455438 172232884 /nfs/dbraw/zinc/23/28/84/172232884.db2.gz WDEBFKCMQVBZCY-UHFFFAOYSA-N 1 2 247.346 2.372 20 0 BEADLO CCn1cnnc1C[NH2+][C@H](C)c1ccsc1 ZINC000166622578 172237066 /nfs/dbraw/zinc/23/70/66/172237066.db2.gz PYYWVYWZPMNOTB-SECBINFHSA-N 1 2 236.344 2.210 20 0 BEADLO CCn1cnnc1C[NH2+][C@@H](C)c1cc(C)c(C)o1 ZINC000281951059 172237096 /nfs/dbraw/zinc/23/70/96/172237096.db2.gz ANSAPTWVMGEXEQ-JTQLQIEISA-N 1 2 248.330 2.359 20 0 BEADLO CCn1ncnc1C[N@H+](C)[C@@H](C)c1ccccc1 ZINC000193297830 172279259 /nfs/dbraw/zinc/27/92/59/172279259.db2.gz ASDDTWRIWCEQHQ-LBPRGKRZSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1ncnc1C[N@@H+](C)[C@@H](C)c1ccccc1 ZINC000193297830 172279260 /nfs/dbraw/zinc/27/92/60/172279260.db2.gz ASDDTWRIWCEQHQ-LBPRGKRZSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1ncnc1C[NH2+][C@@H]1CCCc2occc21 ZINC000359050495 172281763 /nfs/dbraw/zinc/28/17/63/172281763.db2.gz AMOSHLXCYAZJRF-LLVKDONJSA-N 1 2 246.314 2.058 20 0 BEADLO CN(C)C(=O)[C@@H]1CCC[C@@H](Nc2cccc[nH+]2)C1 ZINC000265138685 172385588 /nfs/dbraw/zinc/38/55/88/172385588.db2.gz PQIOEEWMFQENKK-VXGBXAGGSA-N 1 2 247.342 2.141 20 0 BEADLO CN(C)c1ccccc1C[NH2+]Cc1cscn1 ZINC000263850951 172571014 /nfs/dbraw/zinc/57/10/14/172571014.db2.gz NTEMOGOSVFDRLE-UHFFFAOYSA-N 1 2 247.367 2.499 20 0 BEADLO CN(C[C@@H](O)Cc1ccccc1)c1cccc[nH+]1 ZINC000292884819 172806858 /nfs/dbraw/zinc/80/68/58/172806858.db2.gz ZGDVUUJMZYCJFM-AWEZNQCLSA-N 1 2 242.322 2.121 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)[C@@H]1CC2CCC1CC2 ZINC000311130648 172926772 /nfs/dbraw/zinc/92/67/72/172926772.db2.gz CENFMCLGBXSUSE-HTAVTVPLSA-N 1 2 247.342 2.194 20 0 BEADLO C[N@@H+]1CCC[C@@H]1C(=O)Nc1ccccc1Cl ZINC000082326394 173025087 /nfs/dbraw/zinc/02/50/87/173025087.db2.gz VNOYZXHHFKYSSM-LLVKDONJSA-N 1 2 238.718 2.373 20 0 BEADLO C[N@H+]1CCC[C@@H]1C(=O)Nc1ccccc1Cl ZINC000082326394 173025088 /nfs/dbraw/zinc/02/50/88/173025088.db2.gz VNOYZXHHFKYSSM-LLVKDONJSA-N 1 2 238.718 2.373 20 0 BEADLO COc1cccc(NCc2ccc[nH+]c2N)c1F ZINC001652273261 1173054721 /nfs/dbraw/zinc/05/47/21/1173054721.db2.gz MQAYMIDACJTALX-UHFFFAOYSA-N 1 2 247.273 2.424 20 0 BEADLO CN1CC[N@H+](Cc2ccon2)Cc2ccccc21 ZINC000265592816 173090520 /nfs/dbraw/zinc/09/05/20/173090520.db2.gz LGNBYFLZCRPOLT-UHFFFAOYSA-N 1 2 243.310 2.127 20 0 BEADLO CN1CC[N@@H+](Cc2ccon2)Cc2ccccc21 ZINC000265592816 173090521 /nfs/dbraw/zinc/09/05/21/173090521.db2.gz LGNBYFLZCRPOLT-UHFFFAOYSA-N 1 2 243.310 2.127 20 0 BEADLO CNc1ccc(Nc2cc(C(C)C)ncn2)c[nH+]1 ZINC000339666655 173209676 /nfs/dbraw/zinc/20/96/76/173209676.db2.gz HUVWSQGYRBEEEQ-UHFFFAOYSA-N 1 2 243.314 2.202 20 0 BEADLO C[NH2+]Cc1noc(C[C@H](C)CC(C)C)n1 ZINC000336712001 173399959 /nfs/dbraw/zinc/39/99/59/173399959.db2.gz SMJMJQMXVQMSGJ-SECBINFHSA-N 1 2 211.309 2.014 20 0 BEADLO COC(=O)C[N@H+]1CC=C(c2ccc(F)cc2)CC1 ZINC000193007735 173586419 /nfs/dbraw/zinc/58/64/19/173586419.db2.gz JOCKFDRPDVAVBZ-UHFFFAOYSA-N 1 2 249.285 2.088 20 0 BEADLO COC(=O)C[N@@H+]1CC=C(c2ccc(F)cc2)CC1 ZINC000193007735 173586420 /nfs/dbraw/zinc/58/64/20/173586420.db2.gz JOCKFDRPDVAVBZ-UHFFFAOYSA-N 1 2 249.285 2.088 20 0 BEADLO COC(=O)[C@H](CC(F)F)[NH2+]CCC(C)(C)C ZINC000309986118 173794469 /nfs/dbraw/zinc/79/44/69/173794469.db2.gz YIENYSYDQAMWQE-QMMMGPOBSA-N 1 2 237.290 2.209 20 0 BEADLO COC1CCC([NH2+][C@H](C)C(F)(F)F)CC1 ZINC000336770391 174023501 /nfs/dbraw/zinc/02/35/01/174023501.db2.gz VTCNJPPHDCPWJR-AFPNSQJFSA-N 1 2 225.254 2.484 20 0 BEADLO COC1CCC([NH2+][C@@H](C)C(F)(F)F)CC1 ZINC000336770394 174023508 /nfs/dbraw/zinc/02/35/08/174023508.db2.gz VTCNJPPHDCPWJR-UEJVZZJDSA-N 1 2 225.254 2.484 20 0 BEADLO COC1C[NH+](Cc2ccc(SC)cc2)C1 ZINC000358447702 174035038 /nfs/dbraw/zinc/03/50/38/174035038.db2.gz AOUFCJJHILENSK-UHFFFAOYSA-N 1 2 223.341 2.239 20 0 BEADLO COCC1(CNc2cc[nH+]c(C)n2)CCC1 ZINC000282050514 174106626 /nfs/dbraw/zinc/10/66/26/174106626.db2.gz XTYGCUQEDLNCTJ-UHFFFAOYSA-N 1 2 221.304 2.014 20 0 BEADLO COCC1=CCN(c2[nH]c3ccccc3[nH+]2)CC1 ZINC000274626345 174116809 /nfs/dbraw/zinc/11/68/09/174116809.db2.gz MHJQBJZSJRRZPJ-UHFFFAOYSA-N 1 2 243.310 2.346 20 0 BEADLO COCCC1(CNc2cc(C)[nH+]cn2)CC1 ZINC000225365121 174157556 /nfs/dbraw/zinc/15/75/56/174157556.db2.gz XMIZASCOOXLAAW-UHFFFAOYSA-N 1 2 221.304 2.014 20 0 BEADLO COCCCC(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000299689562 174168477 /nfs/dbraw/zinc/16/84/77/174168477.db2.gz VUEOAWVYFQXRJB-UHFFFAOYSA-N 1 2 247.298 2.008 20 0 BEADLO COCCCN(C)c1cc[nH+]c(C(C)(C)C)n1 ZINC000301503454 174219988 /nfs/dbraw/zinc/21/99/88/174219988.db2.gz FWFNNAJRRQTNSU-UHFFFAOYSA-N 1 2 237.347 2.247 20 0 BEADLO COCCCNc1cc(C)[nH+]c(C(C)C)n1 ZINC000035121252 174251627 /nfs/dbraw/zinc/25/16/27/174251627.db2.gz JCANIDNACPAGAR-UHFFFAOYSA-N 1 2 223.320 2.357 20 0 BEADLO COCCCOc1cccc(-n2cc[nH+]c2)c1 ZINC000183258809 174257312 /nfs/dbraw/zinc/25/73/12/174257312.db2.gz JOSMWGGYCUSGCS-UHFFFAOYSA-N 1 2 232.283 2.288 20 0 BEADLO COCC[N@H+](C)Cc1ncc(CSC)s1 ZINC000294909197 174280012 /nfs/dbraw/zinc/28/00/12/174280012.db2.gz NEFNNVQOIFZLBL-UHFFFAOYSA-N 1 2 246.401 2.084 20 0 BEADLO COCC[N@@H+](C)Cc1ncc(CSC)s1 ZINC000294909197 174280014 /nfs/dbraw/zinc/28/00/14/174280014.db2.gz NEFNNVQOIFZLBL-UHFFFAOYSA-N 1 2 246.401 2.084 20 0 BEADLO COCC[N@H+](C)Cc1ncc(C(C)(C)C)o1 ZINC000298764582 174281310 /nfs/dbraw/zinc/28/13/10/174281310.db2.gz BPXSLCJESBZODV-UHFFFAOYSA-N 1 2 226.320 2.050 20 0 BEADLO COCC[N@@H+](C)Cc1ncc(C(C)(C)C)o1 ZINC000298764582 174281311 /nfs/dbraw/zinc/28/13/11/174281311.db2.gz BPXSLCJESBZODV-UHFFFAOYSA-N 1 2 226.320 2.050 20 0 BEADLO COCC[N@H+](Cc1cocn1)Cc1ccccc1 ZINC000191920614 174299151 /nfs/dbraw/zinc/29/91/51/174299151.db2.gz MEWHEVAJIWLZAY-UHFFFAOYSA-N 1 2 246.310 2.323 20 0 BEADLO COCC[N@@H+](Cc1cocn1)Cc1ccccc1 ZINC000191920614 174299152 /nfs/dbraw/zinc/29/91/52/174299152.db2.gz MEWHEVAJIWLZAY-UHFFFAOYSA-N 1 2 246.310 2.323 20 0 BEADLO COCC[N@@H+]1CC[C@@](F)(c2ccccc2F)C1 ZINC000374813357 174312733 /nfs/dbraw/zinc/31/27/33/174312733.db2.gz CRXVLFMZAVPFRU-ZDUSSCGKSA-N 1 2 241.281 2.343 20 0 BEADLO COCC[N@H+]1CC[C@@](F)(c2ccccc2F)C1 ZINC000374813357 174312736 /nfs/dbraw/zinc/31/27/36/174312736.db2.gz CRXVLFMZAVPFRU-ZDUSSCGKSA-N 1 2 241.281 2.343 20 0 BEADLO COCC[N@@H+]1CC[C@](F)(c2ccccc2F)C1 ZINC000374813356 174315671 /nfs/dbraw/zinc/31/56/71/174315671.db2.gz CRXVLFMZAVPFRU-CYBMUJFWSA-N 1 2 241.281 2.343 20 0 BEADLO COCC[N@H+]1CC[C@](F)(c2ccccc2F)C1 ZINC000374813356 174315673 /nfs/dbraw/zinc/31/56/73/174315673.db2.gz CRXVLFMZAVPFRU-CYBMUJFWSA-N 1 2 241.281 2.343 20 0 BEADLO COCCNc1cc[nH+]c2c(OC)cccc12 ZINC000302408087 174341558 /nfs/dbraw/zinc/34/15/58/174341558.db2.gz GGENSESUXFRECS-UHFFFAOYSA-N 1 2 232.283 2.302 20 0 BEADLO COCCOc1ccc(NCc2[nH]cc[nH+]2)cc1 ZINC000049715304 174369140 /nfs/dbraw/zinc/36/91/40/174369140.db2.gz YCTVCGLLBHBEHH-UHFFFAOYSA-N 1 2 247.298 2.047 20 0 BEADLO CO[C@@]1(C)CCCN(c2cc(C)[nH+]cn2)CC1 ZINC000360094405 174794518 /nfs/dbraw/zinc/79/45/18/174794518.db2.gz SFECCHIUBAYVPW-ZDUSSCGKSA-N 1 2 235.331 2.180 20 0 BEADLO COc1ccc(-c2ccc(N)[nH+]c2)cc1OC ZINC000041252315 175033758 /nfs/dbraw/zinc/03/37/58/175033758.db2.gz FWUAKYMELHOQEQ-UHFFFAOYSA-N 1 2 230.267 2.348 20 0 BEADLO COc1ccc(C)cc1NCc1c[nH+]c[nH]1 ZINC000054763201 175078355 /nfs/dbraw/zinc/07/83/55/175078355.db2.gz NUXAYJABYVEBPZ-UHFFFAOYSA-N 1 2 217.272 2.339 20 0 BEADLO COc1ccc(C)cc1NCc1c[nH]c[nH+]1 ZINC000054763201 175078356 /nfs/dbraw/zinc/07/83/56/175078356.db2.gz NUXAYJABYVEBPZ-UHFFFAOYSA-N 1 2 217.272 2.339 20 0 BEADLO COc1ccc(CCOCc2[nH]cc[nH+]2)cc1 ZINC000123809880 175092486 /nfs/dbraw/zinc/09/24/86/175092486.db2.gz REQMBVKBLIXOMT-UHFFFAOYSA-N 1 2 232.283 2.178 20 0 BEADLO COc1ccc(F)c(C[N@H+](C)CCF)c1 ZINC000293581903 175124507 /nfs/dbraw/zinc/12/45/07/175124507.db2.gz HTUWBEWKWLRXPZ-UHFFFAOYSA-N 1 2 215.243 2.236 20 0 BEADLO COc1ccc(F)c(C[N@@H+](C)CCF)c1 ZINC000293581903 175124509 /nfs/dbraw/zinc/12/45/09/175124509.db2.gz HTUWBEWKWLRXPZ-UHFFFAOYSA-N 1 2 215.243 2.236 20 0 BEADLO COc1ccc(F)cc1C[N@H+](C)CCF ZINC000293745069 175129120 /nfs/dbraw/zinc/12/91/20/175129120.db2.gz WFVKGLBMCRBYIN-UHFFFAOYSA-N 1 2 215.243 2.236 20 0 BEADLO COc1ccc(F)cc1C[N@@H+](C)CCF ZINC000293745069 175129121 /nfs/dbraw/zinc/12/91/21/175129121.db2.gz WFVKGLBMCRBYIN-UHFFFAOYSA-N 1 2 215.243 2.236 20 0 BEADLO COc1ccc(F)cc1C[NH2+]Cc1[nH]ncc1C ZINC000289590249 175130253 /nfs/dbraw/zinc/13/02/53/175130253.db2.gz UBEILRPMWLSLFC-UHFFFAOYSA-N 1 2 249.289 2.156 20 0 BEADLO COc1ccc(F)cc1C[NH2+]Cc1n[nH]cc1C ZINC000289590249 175130255 /nfs/dbraw/zinc/13/02/55/175130255.db2.gz UBEILRPMWLSLFC-UHFFFAOYSA-N 1 2 249.289 2.156 20 0 BEADLO COc1ccc(F)cc1C[NH2+]Cc1cocn1 ZINC000277097947 175130374 /nfs/dbraw/zinc/13/03/74/175130374.db2.gz VZCHUHFJRZCECX-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO COc1ccc(F)cc1NCc1[nH+]ccn1C ZINC000082711466 175131910 /nfs/dbraw/zinc/13/19/10/175131910.db2.gz STDQLVVOIXAHOH-UHFFFAOYSA-N 1 2 235.262 2.180 20 0 BEADLO COc1ccc(OC)c(NCc2c[nH+]cn2C)c1 ZINC000090153453 175167203 /nfs/dbraw/zinc/16/72/03/175167203.db2.gz JJGAZYJDNGHJRI-UHFFFAOYSA-N 1 2 247.298 2.049 20 0 BEADLO COc1ccc2c(c1)C[N@@H+](Cc1ccno1)CC2 ZINC000264646485 175210821 /nfs/dbraw/zinc/21/08/21/175210821.db2.gz XBPKNZQUCHGZLS-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1ccc2c(c1)C[N@H+](Cc1ccno1)CC2 ZINC000264646485 175210823 /nfs/dbraw/zinc/21/08/23/175210823.db2.gz XBPKNZQUCHGZLS-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2cnc[nH]2)c1 ZINC000280429085 175254896 /nfs/dbraw/zinc/25/48/96/175254896.db2.gz JHLUOBIZDITKIE-UHFFFAOYSA-N 1 2 231.299 2.050 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2cnc[nH]2)c1 ZINC000280429085 175254897 /nfs/dbraw/zinc/25/48/97/175254897.db2.gz JHLUOBIZDITKIE-UHFFFAOYSA-N 1 2 231.299 2.050 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2c[nH]cn2)c1 ZINC000280429085 175254898 /nfs/dbraw/zinc/25/48/98/175254898.db2.gz JHLUOBIZDITKIE-UHFFFAOYSA-N 1 2 231.299 2.050 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2c[nH]cn2)c1 ZINC000280429085 175254899 /nfs/dbraw/zinc/25/48/99/175254899.db2.gz JHLUOBIZDITKIE-UHFFFAOYSA-N 1 2 231.299 2.050 20 0 BEADLO COc1cccc(CNc2ccc(C)[nH+]c2)n1 ZINC000083356690 175268822 /nfs/dbraw/zinc/26/88/22/175268822.db2.gz KKYVBHNUEJODSX-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO COc1cccc([C@@H](C)[NH2+]Cc2nc(C)no2)c1 ZINC000038034382 175287636 /nfs/dbraw/zinc/28/76/36/175287636.db2.gz BDDVCDFWNBVNIN-SECBINFHSA-N 1 2 247.298 2.237 20 0 BEADLO COc1cccc([C@@H](O)CNc2cccc[nH+]2)c1 ZINC000301299520 175289926 /nfs/dbraw/zinc/28/99/26/175289926.db2.gz ZFYDTRZXTKMSPH-ZDUSSCGKSA-N 1 2 244.294 2.236 20 0 BEADLO COc1cccc2c(N[C@H](C)CCO)cc[nH+]c12 ZINC000275499594 175300073 /nfs/dbraw/zinc/30/00/73/175300073.db2.gz MBIUYICVEYRNAZ-SNVBAGLBSA-N 1 2 246.310 2.426 20 0 BEADLO COc1cccc2c(N[C@@H](C)CO)cc[nH+]c12 ZINC000275679777 175300390 /nfs/dbraw/zinc/30/03/90/175300390.db2.gz ZVSXEZSOLGLUEE-VIFPVBQESA-N 1 2 232.283 2.036 20 0 BEADLO COc1cccc2c1CC[N@H+](Cc1ccon1)C2 ZINC000182696326 175300681 /nfs/dbraw/zinc/30/06/81/175300681.db2.gz OIPKGAPZGKHJHD-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1cccc2c1CC[N@@H+](Cc1ccon1)C2 ZINC000182696326 175300683 /nfs/dbraw/zinc/30/06/83/175300683.db2.gz OIPKGAPZGKHJHD-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1ccccc1C[N@H+](C1CC1)C1COC1 ZINC000289959345 175325943 /nfs/dbraw/zinc/32/59/43/175325943.db2.gz IJJDTFLNXZTCPN-UHFFFAOYSA-N 1 2 233.311 2.058 20 0 BEADLO COc1ccccc1C[N@@H+](C1CC1)C1COC1 ZINC000289959345 175325944 /nfs/dbraw/zinc/32/59/44/175325944.db2.gz IJJDTFLNXZTCPN-UHFFFAOYSA-N 1 2 233.311 2.058 20 0 BEADLO COc1ccccc1CN(C)Cc1[nH+]ccn1C ZINC000070979230 175326467 /nfs/dbraw/zinc/32/64/67/175326467.db2.gz WMIPUJMUINAILB-UHFFFAOYSA-N 1 2 245.326 2.061 20 0 BEADLO COc1cc[nH+]c(CN(CC(C)(C)C)OC)c1 ZINC000285527378 175357919 /nfs/dbraw/zinc/35/79/19/175357919.db2.gz OTDMEOKGRNPIAK-UHFFFAOYSA-N 1 2 238.331 2.500 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)CCC(C)C ZINC000293461221 175369503 /nfs/dbraw/zinc/36/95/03/175369503.db2.gz VREIOPCKLKCDAG-UHFFFAOYSA-N 1 2 236.315 2.143 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)/C=C(\C)C1CC1 ZINC000294695277 175369541 /nfs/dbraw/zinc/36/95/41/175369541.db2.gz UUKOQBDWJDCLFL-JXMROGBWSA-N 1 2 246.310 2.063 20 0 BEADLO COc1ccncc1C[NH2+][C@@H](C)c1cc(C)on1 ZINC000287088453 175371917 /nfs/dbraw/zinc/37/19/17/175371917.db2.gz VTBSEJOUKLLJTQ-JTQLQIEISA-N 1 2 247.298 2.237 20 0 BEADLO COc1cc[nH+]cc1COC(=O)[C@H](C)C1CC1 ZINC000286605903 175373770 /nfs/dbraw/zinc/37/37/70/175373770.db2.gz AJPXKWJJNLSABG-SECBINFHSA-N 1 2 235.283 2.180 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H]1CC=CCC1 ZINC000299467924 175374685 /nfs/dbraw/zinc/37/46/85/175374685.db2.gz FTLHUPANPROPPB-SNVBAGLBSA-N 1 2 232.283 2.385 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@H]1C[C@@H]1C(C)C ZINC000185210444 175374729 /nfs/dbraw/zinc/37/47/29/175374729.db2.gz SJTTYPDNEXKVRZ-ZJUUUORDSA-N 1 2 234.299 2.321 20 0 BEADLO COc1cc[nH+]cc1NC(=O)CC(C)C ZINC000299526397 175375019 /nfs/dbraw/zinc/37/50/19/175375019.db2.gz YCAKQONOYUCDAR-UHFFFAOYSA-N 1 2 208.261 2.075 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C[C@@H]1C[C@@H]1C ZINC000355257997 175375672 /nfs/dbraw/zinc/37/56/72/175375672.db2.gz UTOZDXAYQSNJED-IUCAKERBSA-N 1 2 220.272 2.075 20 0 BEADLO COc1cncc(C[N@H+](C)Cc2ccco2)c1 ZINC000289364529 175384430 /nfs/dbraw/zinc/38/44/30/175384430.db2.gz ZNNMTPXYMMPKSJ-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1cncc(C[N@@H+](C)Cc2ccco2)c1 ZINC000289364529 175384432 /nfs/dbraw/zinc/38/44/32/175384432.db2.gz ZNNMTPXYMMPKSJ-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1ncc(C)cc1NCc1[nH+]cc(C)n1C ZINC000341296775 175397908 /nfs/dbraw/zinc/39/79/08/175397908.db2.gz HHXQMJUHEFKTGG-UHFFFAOYSA-N 1 2 246.314 2.053 20 0 BEADLO C[C@@H](C(N)=O)[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000287006967 175630853 /nfs/dbraw/zinc/63/08/53/175630853.db2.gz QKMDGLLGKXIHLP-WPRPVWTQSA-N 1 2 238.356 2.005 20 0 BEADLO C[C@@H](C(N)=O)[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000287006967 175630856 /nfs/dbraw/zinc/63/08/56/175630856.db2.gz QKMDGLLGKXIHLP-WPRPVWTQSA-N 1 2 238.356 2.005 20 0 BEADLO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1cn(C)nn1 ZINC000336784183 176015806 /nfs/dbraw/zinc/01/58/06/176015806.db2.gz YVMHISMNJBFDAR-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1cn(C)nn1 ZINC000336784183 176015807 /nfs/dbraw/zinc/01/58/07/176015807.db2.gz YVMHISMNJBFDAR-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1cncn1C ZINC000179258720 176025767 /nfs/dbraw/zinc/02/57/67/176025767.db2.gz RWFZSHKQNIFJPG-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1cncn1C ZINC000179258720 176025768 /nfs/dbraw/zinc/02/57/68/176025768.db2.gz RWFZSHKQNIFJPG-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1cocn1 ZINC000191973670 176026469 /nfs/dbraw/zinc/02/64/69/176026469.db2.gz LDPWIQKRBOFRHC-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1cocn1 ZINC000191973670 176026471 /nfs/dbraw/zinc/02/64/71/176026471.db2.gz LDPWIQKRBOFRHC-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1cnns1 ZINC000336668563 176029679 /nfs/dbraw/zinc/02/96/79/176029679.db2.gz MNZWFPIMICJXME-VIFPVBQESA-N 1 2 234.328 2.126 20 0 BEADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1cnns1 ZINC000336668563 176029681 /nfs/dbraw/zinc/02/96/81/176029681.db2.gz MNZWFPIMICJXME-VIFPVBQESA-N 1 2 234.328 2.126 20 0 BEADLO C[C@@H](c1ccco1)[N@H+](C)Cc1ccnn1C ZINC000131112421 176031714 /nfs/dbraw/zinc/03/17/14/176031714.db2.gz QVEXBBNBMSYDQS-JTQLQIEISA-N 1 2 219.288 2.206 20 0 BEADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1ccnn1C ZINC000131112421 176031715 /nfs/dbraw/zinc/03/17/15/176031715.db2.gz QVEXBBNBMSYDQS-JTQLQIEISA-N 1 2 219.288 2.206 20 0 BEADLO C[C@@H](c1ccco1)[N@H+](CC(=O)NC1CC1)C1CC1 ZINC000086233296 176032081 /nfs/dbraw/zinc/03/20/81/176032081.db2.gz MGYDBZZGKQKTCO-JTQLQIEISA-N 1 2 248.326 2.084 20 0 BEADLO C[C@@H](c1ccco1)[N@@H+](CC(=O)NC1CC1)C1CC1 ZINC000086233296 176032083 /nfs/dbraw/zinc/03/20/83/176032083.db2.gz MGYDBZZGKQKTCO-JTQLQIEISA-N 1 2 248.326 2.084 20 0 BEADLO C[C@@H](c1ccco1)[N@H+](Cc1cnnn1C)C1CC1 ZINC000092483350 176033261 /nfs/dbraw/zinc/03/32/61/176033261.db2.gz BUGDXAVXHDLBDS-JTQLQIEISA-N 1 2 246.314 2.134 20 0 BEADLO C[C@@H](c1ccco1)[N@@H+](Cc1cnnn1C)C1CC1 ZINC000092483350 176033262 /nfs/dbraw/zinc/03/32/62/176033262.db2.gz BUGDXAVXHDLBDS-JTQLQIEISA-N 1 2 246.314 2.134 20 0 BEADLO C[C@@H](c1cnccn1)[N@@H+]1CCC[C@](C)(F)C1 ZINC000295451548 176037545 /nfs/dbraw/zinc/03/75/45/176037545.db2.gz PLPVWQFANBHAIO-JQWIXIFHSA-N 1 2 223.295 2.362 20 0 BEADLO C[C@@H](c1cnccn1)[N@H+]1CCC[C@](C)(F)C1 ZINC000295451548 176037547 /nfs/dbraw/zinc/03/75/47/176037547.db2.gz PLPVWQFANBHAIO-JQWIXIFHSA-N 1 2 223.295 2.362 20 0 BEADLO C[C@@H](c1cnccn1)[N@@H+]1CCOC2(CCCC2)C1 ZINC000373361055 176037673 /nfs/dbraw/zinc/03/76/73/176037673.db2.gz JWONZOAJHKNNJP-LBPRGKRZSA-N 1 2 247.342 2.183 20 0 BEADLO C[C@@H](c1cnccn1)[N@H+]1CCOC2(CCCC2)C1 ZINC000373361055 176037676 /nfs/dbraw/zinc/03/76/76/176037676.db2.gz JWONZOAJHKNNJP-LBPRGKRZSA-N 1 2 247.342 2.183 20 0 BEADLO C[C@@H]1CC/C(=C\C(=O)Nc2ccc(N)[nH+]c2)C1 ZINC000269152244 176056851 /nfs/dbraw/zinc/05/68/51/176056851.db2.gz QDMJGRXAMURPKF-YIXGCBLDSA-N 1 2 231.299 2.349 20 0 BEADLO C[C@@H]1CCCCN1C(=O)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000336221846 176068363 /nfs/dbraw/zinc/06/83/63/176068363.db2.gz YOLJBYCJCXEWNB-GHMZBOCLSA-N 1 2 247.342 2.231 20 0 BEADLO C[C@@H]1CCCC[C@@H]1NC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000336624392 176079407 /nfs/dbraw/zinc/07/94/07/176079407.db2.gz IIRDOTLNVGNBEE-MNOVXSKESA-N 1 2 249.358 2.382 20 0 BEADLO C[C@@H]1CCCC[C@H]1CNC(=O)CCn1cc[nH+]c1 ZINC000299657327 176084949 /nfs/dbraw/zinc/08/49/49/176084949.db2.gz MLFALFBDXYWDIH-OLZOCXBDSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@@H]1CCCN(c2nc[nH+]c(N)c2Cl)CC1 ZINC000235334250 176104398 /nfs/dbraw/zinc/10/43/98/176104398.db2.gz BFECVXVTHBFLAA-MRVPVSSYSA-N 1 2 240.738 2.339 20 0 BEADLO C[C@@H]1CCCN(c2[nH+]cnc(N)c2Cl)CC1 ZINC000235334250 176104399 /nfs/dbraw/zinc/10/43/99/176104399.db2.gz BFECVXVTHBFLAA-MRVPVSSYSA-N 1 2 240.738 2.339 20 0 BEADLO C[C@@H]1CCCN1c1cc(NCC2CC2)[nH+]cn1 ZINC000112074915 176111267 /nfs/dbraw/zinc/11/12/67/176111267.db2.gz DBXNOLQXJVZIAT-SNVBAGLBSA-N 1 2 232.331 2.287 20 0 BEADLO C[C@@H]1CCCN1c1cc(NCC2CC2)nc[nH+]1 ZINC000112074915 176111271 /nfs/dbraw/zinc/11/12/71/176111271.db2.gz DBXNOLQXJVZIAT-SNVBAGLBSA-N 1 2 232.331 2.287 20 0 BEADLO C[C@@H]1CCCN1c1cc(NC2CC2)[nH+]cn1 ZINC000309426904 176111494 /nfs/dbraw/zinc/11/14/94/176111494.db2.gz KJVYFSQCKQTTPE-SECBINFHSA-N 1 2 218.304 2.040 20 0 BEADLO C[C@@H]1CCCN1c1cc(NC2CC2)nc[nH+]1 ZINC000309426904 176111497 /nfs/dbraw/zinc/11/14/97/176111497.db2.gz KJVYFSQCKQTTPE-SECBINFHSA-N 1 2 218.304 2.040 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)CCc2c[nH+]c[nH]2)CC1 ZINC000281936438 176121816 /nfs/dbraw/zinc/12/18/16/176121816.db2.gz RVWMRHCRUQYFNE-VXGBXAGGSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)CCc2c[nH]c[nH+]2)CC1 ZINC000281936438 176121817 /nfs/dbraw/zinc/12/18/17/176121817.db2.gz RVWMRHCRUQYFNE-VXGBXAGGSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@@H]1CCC[C@H](N(C)C(=O)CCn2cc[nH+]c2)C1 ZINC000299633005 176140123 /nfs/dbraw/zinc/14/01/23/176140123.db2.gz SRGCTSBROQERQY-OLZOCXBDSA-N 1 2 249.358 2.310 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)CCn2cc[nH+]c2)CC1 ZINC000275965083 176141603 /nfs/dbraw/zinc/14/16/03/176141603.db2.gz IYIIZUMZWUJZQJ-OLZOCXBDSA-N 1 2 249.358 2.358 20 0 BEADLO C[C@@H]1CCC[C@H]1CC(=O)N(C)Cc1[nH+]ccn1C ZINC000274382231 176147744 /nfs/dbraw/zinc/14/77/44/176147744.db2.gz AJMRYJMLTJVPFU-NEPJUHHUSA-N 1 2 249.358 2.205 20 0 BEADLO C[C@@H]1CCC[C@]1(C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000336245405 176152112 /nfs/dbraw/zinc/15/21/12/176152112.db2.gz AVSNPGAWEXZLMH-MFKMUULPSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@@H]1CCC[C@]1(C)C(=O)N(C)Cc1[nH+]ccn1C ZINC000336236289 176152449 /nfs/dbraw/zinc/15/24/49/176152449.db2.gz ACCIHBZVCBHKCH-RISCZKNCSA-N 1 2 249.358 2.205 20 0 BEADLO C[C@@H]1CCN(C(=O)C(C)(C)C)C[C@@H]1n1cc[nH+]c1 ZINC000123965157 176153629 /nfs/dbraw/zinc/15/36/29/176153629.db2.gz JREFQANGOCUPAV-NEPJUHHUSA-N 1 2 249.358 2.339 20 0 BEADLO C[C@@H]1CCN(C(=O)C2CCC2)C[C@H]1n1cc[nH+]c1 ZINC000123054171 176154614 /nfs/dbraw/zinc/15/46/14/176154614.db2.gz XPXIVKFKUHBXJE-DGCLKSJQSA-N 1 2 247.342 2.093 20 0 BEADLO C[C@@H]1C[C@H](C)CCN(C(=O)CCn2cc[nH+]c2)C1 ZINC000269792369 176155070 /nfs/dbraw/zinc/15/50/70/176155070.db2.gz HHWURTJPIPRCNH-CHWSQXEVSA-N 1 2 249.358 2.168 20 0 BEADLO C[C@@H]1CCN(c2cc[nH+]c3ccncc32)C1 ZINC000267964700 176181624 /nfs/dbraw/zinc/18/16/24/176181624.db2.gz LRICGKQXSHWRIX-SNVBAGLBSA-N 1 2 213.284 2.476 20 0 BEADLO C[C@@H]1CCN(c2cc(N3CC[C@@H](C)C3)[nH+]cn2)C1 ZINC000270002909 176182026 /nfs/dbraw/zinc/18/20/26/176182026.db2.gz YQGQGWNPPSMGMK-VXGBXAGGSA-N 1 2 246.358 2.169 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NCCn2cc[nH+]c2)C[C@H]1C ZINC000294559523 176195395 /nfs/dbraw/zinc/19/53/95/176195395.db2.gz ROLAOOQVISMKFG-JHJVBQTASA-N 1 2 249.358 2.072 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)C[C@@H]1CC[C@@H](C)C1 ZINC000268432638 176200863 /nfs/dbraw/zinc/20/08/63/176200863.db2.gz NRUNEAZKLIMWAA-JHJVBQTASA-N 1 2 249.358 2.214 20 0 BEADLO C[C@@H]1CC[C@@H](C[N@H+](C)Cc2nccs2)O1 ZINC000188558981 176202440 /nfs/dbraw/zinc/20/24/40/176202440.db2.gz BBYASFUGOMMMME-ZJUUUORDSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@@H]1CC[C@@H](C[N@@H+](C)Cc2nccs2)O1 ZINC000188558981 176202443 /nfs/dbraw/zinc/20/24/43/176202443.db2.gz BBYASFUGOMMMME-ZJUUUORDSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@@H]1CC[C@@H](C[N@@H+]2CCC[C@@H]2C(F)F)O1 ZINC000353167301 176203572 /nfs/dbraw/zinc/20/35/72/176203572.db2.gz AXQVIPFQLMUBLQ-KXUCPTDWSA-N 1 2 219.275 2.283 20 0 BEADLO C[C@@H]1CC[C@@H](C[N@H+]2CCC[C@@H]2C(F)F)O1 ZINC000353167301 176203575 /nfs/dbraw/zinc/20/35/75/176203575.db2.gz AXQVIPFQLMUBLQ-KXUCPTDWSA-N 1 2 219.275 2.283 20 0 BEADLO C[C@@H]1CC[C@H](C[N@H+](C)Cc2cscn2)O1 ZINC000188541616 176223723 /nfs/dbraw/zinc/22/37/23/176223723.db2.gz IJNHERDFHXTFQN-MWLCHTKSSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@@H]1CC[C@H](C[N@@H+](C)Cc2cscn2)O1 ZINC000188541616 176223724 /nfs/dbraw/zinc/22/37/24/176223724.db2.gz IJNHERDFHXTFQN-MWLCHTKSSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@@H]1CC[C@H]([NH2+]c2ccc(OCC(N)=O)cc2)C1 ZINC000080451867 176234760 /nfs/dbraw/zinc/23/47/60/176234760.db2.gz CDYUGUUCFSKEME-PWSUYJOCSA-N 1 2 248.326 2.151 20 0 BEADLO C[C@@H]1CN(C(=O)c2ccc3[nH+]ccn3c2)C[C@H]1C ZINC000267612629 176261452 /nfs/dbraw/zinc/26/14/52/176261452.db2.gz HANNCXUSUPHYKM-GHMZBOCLSA-N 1 2 243.310 2.062 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccnc(Cl)c2)[C@H](C)CO1 ZINC000050166127 176309539 /nfs/dbraw/zinc/30/95/39/176309539.db2.gz RGDSORGSEBUQAI-NXEZZACHSA-N 1 2 240.734 2.344 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccnc(Cl)c2)[C@H](C)CO1 ZINC000050166127 176309541 /nfs/dbraw/zinc/30/95/41/176309541.db2.gz RGDSORGSEBUQAI-NXEZZACHSA-N 1 2 240.734 2.344 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnn(C)n2)[C@@H]1c1ccccc1 ZINC000289790237 176310139 /nfs/dbraw/zinc/31/01/39/176310139.db2.gz LOURMEDZNSWIAC-RISCZKNCSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnn(C)n2)[C@@H]1c1ccccc1 ZINC000289790237 176310141 /nfs/dbraw/zinc/31/01/41/176310141.db2.gz LOURMEDZNSWIAC-RISCZKNCSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@@H]1CN(Cc2[nH]cc[nH+]2)Cc2ccccc2O1 ZINC000292308794 176312573 /nfs/dbraw/zinc/31/25/73/176312573.db2.gz DPOITJHAYAZSGD-LLVKDONJSA-N 1 2 243.310 2.193 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ncnn2C)[C@@H]1c1ccccc1 ZINC000177354902 176313569 /nfs/dbraw/zinc/31/35/69/176313569.db2.gz BUZVLPAHPMFRHG-RISCZKNCSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ncnn2C)[C@@H]1c1ccccc1 ZINC000177354902 176313571 /nfs/dbraw/zinc/31/35/71/176313571.db2.gz BUZVLPAHPMFRHG-RISCZKNCSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@@H]1CN(c2cc(NCC3CC3)[nH+]cn2)C[C@H]1C ZINC000301835870 176319383 /nfs/dbraw/zinc/31/93/83/176319383.db2.gz UTDSRJZVRUCAQS-GHMZBOCLSA-N 1 2 246.358 2.391 20 0 BEADLO C[C@@H]1CN(c2cc(NCC3CC3)nc[nH+]2)C[C@H]1C ZINC000301835870 176319384 /nfs/dbraw/zinc/31/93/84/176319384.db2.gz UTDSRJZVRUCAQS-GHMZBOCLSA-N 1 2 246.358 2.391 20 0 BEADLO C[C@@H]1COCC[C@H]1[NH2+][C@@H](C1CC1)C(F)(F)F ZINC000309822857 176344970 /nfs/dbraw/zinc/34/49/70/176344970.db2.gz WRUOAWDFUVYGAO-QNSHHTMESA-N 1 2 237.265 2.342 20 0 BEADLO CC[N@H+](Cc1nc(C2CCC2)no1)C1CC1 ZINC000680692565 487633679 /nfs/dbraw/zinc/63/36/79/487633679.db2.gz UNNODRSKOFUOFA-UHFFFAOYSA-N 1 2 221.304 2.321 20 0 BEADLO CC[N@@H+](Cc1nc(C2CCC2)no1)C1CC1 ZINC000680692565 487633684 /nfs/dbraw/zinc/63/36/84/487633684.db2.gz UNNODRSKOFUOFA-UHFFFAOYSA-N 1 2 221.304 2.321 20 0 BEADLO C[C@@H]1C[C@@H]([NH2+]Cc2ncc[nH]2)c2ccccc2O1 ZINC000295039706 176378040 /nfs/dbraw/zinc/37/80/40/176378040.db2.gz MMJBPDGUQXNIAG-ZYHUDNBSSA-N 1 2 243.310 2.412 20 0 BEADLO C[C@@H]1C[C@@H]1CC(=O)N(C)c1ccc[nH+]c1N(C)C ZINC000361882576 176388236 /nfs/dbraw/zinc/38/82/36/176388236.db2.gz IVZBEHJVSKRDHQ-GHMZBOCLSA-N 1 2 247.342 2.157 20 0 BEADLO C[C@@H]1C[C@@H]1CC(=O)N[C@@H](c1[nH+]ccn1C)C1CC1 ZINC000356498449 176389744 /nfs/dbraw/zinc/38/97/44/176389744.db2.gz RMDSGBPGWQSCHS-IRUJWGPZSA-N 1 2 247.342 2.034 20 0 BEADLO C[C@@H]1C[C@@H]1C[NH2+][C@H](c1cccs1)c1nnc[nH]1 ZINC000293679548 176397560 /nfs/dbraw/zinc/39/75/60/176397560.db2.gz KHADLTZUZPNVPS-FXPVBKGRSA-N 1 2 248.355 2.201 20 0 BEADLO C[C@@H]1C[C@@H]1CNc1cc(N2CCCC2)nc[nH+]1 ZINC000277593152 176398032 /nfs/dbraw/zinc/39/80/32/176398032.db2.gz UKQAIHUNYNZLJF-GHMZBOCLSA-N 1 2 232.331 2.145 20 0 BEADLO C[C@@H]1C[C@@H]1CNc1cc(N2CCCC2)[nH+]cn1 ZINC000277593152 176398034 /nfs/dbraw/zinc/39/80/34/176398034.db2.gz UKQAIHUNYNZLJF-GHMZBOCLSA-N 1 2 232.331 2.145 20 0 BEADLO C[C@H](NC(=O)CCc1[nH]cc[nH+]1)C1CCCCC1 ZINC000354094845 176790885 /nfs/dbraw/zinc/79/08/85/176790885.db2.gz WXMXQGAAOOSOCF-NSHDSACASA-N 1 2 249.358 2.427 20 0 BEADLO C[C@H]([NH2+]CC(F)(F)CO)c1cccs1 ZINC000184703066 176834376 /nfs/dbraw/zinc/83/43/76/176834376.db2.gz GYGBKPIHDQTELJ-ZETCQYMHSA-N 1 2 221.272 2.026 20 0 BEADLO C[C@H](O)C[C@H]1CCCN1c1[nH]c2ccccc2[nH+]1 ZINC000270591010 177002630 /nfs/dbraw/zinc/00/26/30/177002630.db2.gz SKYJPDIXDXGPDL-WDEREUQCSA-N 1 2 245.326 2.303 20 0 BEADLO C[C@H](c1ccccc1)[N@H+](C)Cc1cnn(C)n1 ZINC000289553115 177039165 /nfs/dbraw/zinc/03/91/65/177039165.db2.gz DNWJXZUASWQCCJ-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1ccccc1)[N@@H+](C)Cc1cnn(C)n1 ZINC000289553115 177039167 /nfs/dbraw/zinc/03/91/67/177039167.db2.gz DNWJXZUASWQCCJ-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1ccccn1)[N@H+](C)Cc1ccn(C)n1 ZINC000336704168 177042649 /nfs/dbraw/zinc/04/26/49/177042649.db2.gz CPUGVSICESIALU-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1ccn(C)n1 ZINC000336704168 177042651 /nfs/dbraw/zinc/04/26/51/177042651.db2.gz CPUGVSICESIALU-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1cccnc1)[N@H+](C)Cc1cocn1 ZINC000191975855 177045277 /nfs/dbraw/zinc/04/52/77/177045277.db2.gz HCESNMKETZUNHM-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1cocn1 ZINC000191975855 177045278 /nfs/dbraw/zinc/04/52/78/177045278.db2.gz HCESNMKETZUNHM-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H](c1cccnc1)[N@H+](C)Cc1cncn1C ZINC000162455294 177045316 /nfs/dbraw/zinc/04/53/16/177045316.db2.gz JBCGAWZMOHYXGB-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1cncn1C ZINC000162455294 177045317 /nfs/dbraw/zinc/04/53/17/177045317.db2.gz JBCGAWZMOHYXGB-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1cccnc1)N(C)Cc1c[nH+]cn1C ZINC000162455294 177045318 /nfs/dbraw/zinc/04/53/18/177045318.db2.gz JBCGAWZMOHYXGB-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1ccco1)[N@H+](C)Cc1cc(=O)c(O)co1 ZINC000124128379 177048091 /nfs/dbraw/zinc/04/80/91/177048091.db2.gz PXLYIYAIMZZRIU-SECBINFHSA-N 1 2 249.266 2.131 20 0 BEADLO C[C@H](c1ccco1)[N@@H+](C)Cc1cc(=O)c(O)co1 ZINC000124128379 177048092 /nfs/dbraw/zinc/04/80/92/177048092.db2.gz PXLYIYAIMZZRIU-SECBINFHSA-N 1 2 249.266 2.131 20 0 BEADLO C[C@H](c1cccs1)[N@H+](C)Cc1nccc(N)n1 ZINC000268707370 177048988 /nfs/dbraw/zinc/04/89/88/177048988.db2.gz WJDDXWNFBIZLSA-SECBINFHSA-N 1 2 248.355 2.313 20 0 BEADLO C[C@H](c1cccs1)[N@@H+](C)Cc1nccc(N)n1 ZINC000268707370 177048990 /nfs/dbraw/zinc/04/89/90/177048990.db2.gz WJDDXWNFBIZLSA-SECBINFHSA-N 1 2 248.355 2.313 20 0 BEADLO C[C@H](c1noc(CCn2cc[nH+]c2)n1)C1CC1 ZINC000273930264 177056341 /nfs/dbraw/zinc/05/63/41/177056341.db2.gz IOGCDNHTWWJHHZ-VIFPVBQESA-N 1 2 232.287 2.022 20 0 BEADLO C[C@H]1CCCCCN1c1[nH+]cnc2c1cnn2C ZINC000337881371 177070389 /nfs/dbraw/zinc/07/03/89/177070389.db2.gz UYMJEOKJULIVNT-JTQLQIEISA-N 1 2 245.330 2.132 20 0 BEADLO C[C@H]1CCCC[C@@H]1NC(=O)CCc1[nH]cc[nH+]1 ZINC000279265929 177081780 /nfs/dbraw/zinc/08/17/80/177081780.db2.gz VOJCUYAOJDJVDO-QWRGUYRKSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H]1CCCC[C@@H]1NC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000336624393 177082142 /nfs/dbraw/zinc/08/21/42/177082142.db2.gz IIRDOTLNVGNBEE-QWRGUYRKSA-N 1 2 249.358 2.382 20 0 BEADLO C[C@H]1CCCC[C@H]1CNC(=O)CCc1c[nH+]c[nH]1 ZINC000192903281 177085640 /nfs/dbraw/zinc/08/56/40/177085640.db2.gz VYLZGZGKAOUJOP-RYUDHWBXSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H]1CCCC[C@H]1CNC(=O)CCc1c[nH]c[nH+]1 ZINC000192903281 177085641 /nfs/dbraw/zinc/08/56/41/177085641.db2.gz VYLZGZGKAOUJOP-RYUDHWBXSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H]1CCCC[C@H]1N(C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000276445517 177086085 /nfs/dbraw/zinc/08/60/85/177086085.db2.gz AGGYOLFAXFJBAJ-GPTOWFIXSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@H]1CCC[C@@H](CC(=O)NCc2c[nH+]c[nH]2)C1 ZINC000330896960 177118820 /nfs/dbraw/zinc/11/88/20/177118820.db2.gz LSPFODLDWBFPLD-WDEREUQCSA-N 1 2 235.331 2.242 20 0 BEADLO C[C@H]1CCC[C@@H](CC(=O)NCc2c[nH]c[nH+]2)C1 ZINC000330896960 177118823 /nfs/dbraw/zinc/11/88/23/177118823.db2.gz LSPFODLDWBFPLD-WDEREUQCSA-N 1 2 235.331 2.242 20 0 BEADLO C[C@H]1CCC[C@@]1(C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000336245403 177127978 /nfs/dbraw/zinc/12/79/78/177127978.db2.gz AVSNPGAWEXZLMH-GXFFZTMASA-N 1 2 235.331 2.194 20 0 BEADLO C[C@H]1CCC[C@H](NC(=O)CCn2cc[nH+]c2)CC1 ZINC000275965089 177135169 /nfs/dbraw/zinc/13/51/69/177135169.db2.gz IYIIZUMZWUJZQJ-STQMWFEESA-N 1 2 249.358 2.358 20 0 BEADLO C[C@H]1CCN(C(=O)CC2CC2)C[C@@H]1n1cc[nH+]c1 ZINC000123836676 177146234 /nfs/dbraw/zinc/14/62/34/177146234.db2.gz XBOURLSGNSOABT-AAEUAGOBSA-N 1 2 247.342 2.093 20 0 BEADLO C[C@H]1CC[N@H+](Cc2ccsc2)CC[S@]1=O ZINC000277384324 177167630 /nfs/dbraw/zinc/16/76/30/177167630.db2.gz GAVUSARKWJKKTC-ZUZCIYMTSA-N 1 2 243.397 2.091 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2ccsc2)CC[S@]1=O ZINC000277384324 177167631 /nfs/dbraw/zinc/16/76/31/177167631.db2.gz GAVUSARKWJKKTC-ZUZCIYMTSA-N 1 2 243.397 2.091 20 0 BEADLO C[C@H]1CCN(c2cccc[nH+]2)CCS1 ZINC000276832540 177171979 /nfs/dbraw/zinc/17/19/79/177171979.db2.gz BHWQGRNPOFOXLS-JTQLQIEISA-N 1 2 208.330 2.413 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccc(F)cc2)CCC1=O ZINC000049693607 177263715 /nfs/dbraw/zinc/26/37/15/177263715.db2.gz YIQUUFWWEAQOPA-JTQLQIEISA-N 1 2 221.275 2.237 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccc(F)cc2)CCC1=O ZINC000049693607 177263716 /nfs/dbraw/zinc/26/37/16/177263716.db2.gz YIQUUFWWEAQOPA-JTQLQIEISA-N 1 2 221.275 2.237 20 0 BEADLO C[C@H]1C[N@H+](Cc2ncnn2C)[C@@H]1c1ccccc1 ZINC000177354912 177271782 /nfs/dbraw/zinc/27/17/82/177271782.db2.gz BUZVLPAHPMFRHG-FZMZJTMJSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ncnn2C)[C@@H]1c1ccccc1 ZINC000177354912 177271783 /nfs/dbraw/zinc/27/17/83/177271783.db2.gz BUZVLPAHPMFRHG-FZMZJTMJSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@H]1COC(C)(C)C[N@@H+]1Cc1ccc(F)cn1 ZINC000336544516 177287097 /nfs/dbraw/zinc/28/70/97/177287097.db2.gz NGYISFTYCMKWMJ-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H]1COC(C)(C)C[N@H+]1Cc1ccc(F)cn1 ZINC000336544516 177287098 /nfs/dbraw/zinc/28/70/98/177287098.db2.gz NGYISFTYCMKWMJ-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)NCc2[nH+]ccn2C)C[C@@H]1C ZINC000294487649 177308753 /nfs/dbraw/zinc/30/87/53/177308753.db2.gz GEINAWQNWVKDHB-WOPDTQHZSA-N 1 2 249.358 2.109 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)CCc2[nH]cc[nH+]2)C[C@@H]1C ZINC000356005499 177329035 /nfs/dbraw/zinc/32/90/35/177329035.db2.gz FVWCNHJEYUUMOZ-WOPDTQHZSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H]1C[C@@H]1CNc1ccc(N(C)C)c[nH+]1 ZINC000309104922 177345940 /nfs/dbraw/zinc/34/59/40/177345940.db2.gz HONVWVCKTDYUFH-VHSXEESVSA-N 1 2 205.305 2.216 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NCCn2cc[nH+]c2)C[C@@H]1C ZINC000294559520 177354083 /nfs/dbraw/zinc/35/40/83/177354083.db2.gz ROLAOOQVISMKFG-FRRDWIJNSA-N 1 2 249.358 2.072 20 0 BEADLO C[C@H]1C[C@H]([NH2+]Cc2cncs2)c2nccn21 ZINC000345365610 177371419 /nfs/dbraw/zinc/37/14/19/177371419.db2.gz YRVAAGPDAUSEAJ-WPRPVWTQSA-N 1 2 234.328 2.135 20 0 BEADLO C[C@H]1C[C@H]1CNc1ccc(N(C)C)c[nH+]1 ZINC000309104921 177381736 /nfs/dbraw/zinc/38/17/36/177381736.db2.gz HONVWVCKTDYUFH-UWVGGRQHSA-N 1 2 205.305 2.216 20 0 BEADLO C[C@H]1C[C@H]1CNc1cc(N2CCCC2)nc[nH+]1 ZINC000277593156 177381823 /nfs/dbraw/zinc/38/18/23/177381823.db2.gz UKQAIHUNYNZLJF-QWRGUYRKSA-N 1 2 232.331 2.145 20 0 BEADLO C[C@H]1C[C@H]1CNc1cc(N2CCCC2)[nH+]cn1 ZINC000277593156 177381825 /nfs/dbraw/zinc/38/18/25/177381825.db2.gz UKQAIHUNYNZLJF-QWRGUYRKSA-N 1 2 232.331 2.145 20 0 BEADLO C[C@@H]1Cc2ncn(Cc3c[nH+]cn3C)c2C[C@@H]1C ZINC000295082463 177388226 /nfs/dbraw/zinc/38/82/26/177388226.db2.gz DMTKQODXQGAPLA-MNOVXSKESA-N 1 2 244.342 2.036 20 0 BEADLO C[C@H]1OCC[N@H+](CC2=CCCCC2)[C@@H]1C(N)=O ZINC000336266951 177398049 /nfs/dbraw/zinc/39/80/49/177398049.db2.gz PZISUACBYATOJT-PWSUYJOCSA-N 1 2 238.331 2.111 20 0 BEADLO C[C@H]1OCC[N@@H+](CC2=CCCCC2)[C@@H]1C(N)=O ZINC000336266951 177398050 /nfs/dbraw/zinc/39/80/50/177398050.db2.gz PZISUACBYATOJT-PWSUYJOCSA-N 1 2 238.331 2.111 20 0 BEADLO C[C@H]1CCCN(c2cc(CO)cc[nH+]2)CC1 ZINC000082489751 487642036 /nfs/dbraw/zinc/64/20/36/487642036.db2.gz CAJZSHVGJMOLIT-NSHDSACASA-N 1 2 220.316 2.200 20 0 BEADLO C[C@@H]1C[C@H]1C[NH2+]c1ccc(-n2ccnn2)cc1 ZINC000488348786 225383060 /nfs/dbraw/zinc/38/30/60/225383060.db2.gz OHFMDUOSMCNTBE-MNOVXSKESA-N 1 2 228.299 2.335 20 0 BEADLO C[C@H]1C[C@H]1C[NH2+]c1ccc(-n2ccnn2)cc1 ZINC000488349282 225384052 /nfs/dbraw/zinc/38/40/52/225384052.db2.gz OHFMDUOSMCNTBE-QWRGUYRKSA-N 1 2 228.299 2.335 20 0 BEADLO C[C@@H]1C[C@H](C)[C@@H](C)N(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492815371 226059858 /nfs/dbraw/zinc/05/98/58/226059858.db2.gz WVAIFADUWQGCTO-HCSCIRHASA-N 1 2 247.342 2.316 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N(CC1CC1)C1CCC1 ZINC000492859224 226068993 /nfs/dbraw/zinc/06/89/93/226068993.db2.gz GHWWRAHGRJFNTF-VOTSOKGWSA-N 1 2 245.326 2.214 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)NC1(C2CCC2)CCC1 ZINC000493019644 226105993 /nfs/dbraw/zinc/10/59/93/226105993.db2.gz KMXAVCDNOVDGRG-AATRIKPKSA-N 1 2 245.326 2.262 20 0 BEADLO C[C@@H]1CCCC[C@@H]1CNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493339776 226190543 /nfs/dbraw/zinc/19/05/43/226190543.db2.gz RMQXKEVXHSDSPR-UXFRKABBSA-N 1 2 247.342 2.365 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)Nc1cc(F)cc(F)c1 ZINC000493260295 226168419 /nfs/dbraw/zinc/16/84/19/226168419.db2.gz OJPJQSPWCGVKQV-OWOJBTEDSA-N 1 2 249.220 2.340 20 0 BEADLO O=C(/C=C\c1[nH]cc[nH+]1)N(C1CCC1)C1CCC1 ZINC000493273493 226172785 /nfs/dbraw/zinc/17/27/85/226172785.db2.gz QHCCBRSLSQQBNN-FPLPWBNLSA-N 1 2 245.326 2.357 20 0 BEADLO C[C@H]1CCCCCN1C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493609633 226245757 /nfs/dbraw/zinc/24/57/57/226245757.db2.gz IBZBBZHQZAEQDZ-MLRMMBSGSA-N 1 2 233.315 2.214 20 0 BEADLO C[C@@H]1CCCCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493785532 226254057 /nfs/dbraw/zinc/25/40/57/226254057.db2.gz HXOOQBOJNYUXAE-XUIVZRPNSA-N 1 2 233.315 2.214 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N(C1CC1)C1CCCC1 ZINC000493787870 226254104 /nfs/dbraw/zinc/25/41/04/226254104.db2.gz VTDLLZNFCUFQMP-VMPITWQZSA-N 1 2 245.326 2.357 20 0 BEADLO CN(C(=O)C=Cc1c[nH]c[nH+]1)[C@@H]1CCC(C)(C)C1 ZINC000493812185 226255157 /nfs/dbraw/zinc/25/51/57/226255157.db2.gz BORONPAHVIKSIM-ZYOFXKKJSA-N 1 2 247.342 2.460 20 0 BEADLO Cc1cc(C)c(CNC(=O)/C=C/C2CC2)c[nH+]1 ZINC000493820807 226255757 /nfs/dbraw/zinc/25/57/57/226255757.db2.gz LARJXLLSDWVBKF-AATRIKPKSA-N 1 2 230.311 2.281 20 0 BEADLO O=C(OCC1CC1)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000496489474 226306514 /nfs/dbraw/zinc/30/65/14/226306514.db2.gz IXSKXPGPDYWZQO-UHFFFAOYSA-N 1 2 249.314 2.136 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)OC2CCC2)c2[nH+]ccn21 ZINC000496828903 226315121 /nfs/dbraw/zinc/31/51/21/226315121.db2.gz PVYHDOOANXHNLV-WCBMZHEXSA-N 1 2 235.287 2.168 20 0 BEADLO Cn1cc[nH+]c1[C@H](NC(=O)OCC1CC1)C1CC1 ZINC000496234164 226299774 /nfs/dbraw/zinc/29/97/74/226299774.db2.gz OZOVFOZPUQXDGG-LLVKDONJSA-N 1 2 249.314 2.007 20 0 BEADLO Cc1cncc(NCCc2ccc(C)[nH+]c2)n1 ZINC000680829969 487654359 /nfs/dbraw/zinc/65/43/59/487654359.db2.gz UYAIXEFSXFRBTA-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO COc1cccc(C[NH2+][C@@H](C)C(F)F)c1 ZINC000228504800 487667155 /nfs/dbraw/zinc/66/71/55/487667155.db2.gz LMQGYDUSDMTGPS-QMMMGPOBSA-N 1 2 215.243 2.438 20 0 BEADLO C[C@H]1CC[C@@H](C[N@@H+]2CCC[C@@H]2C(F)F)O1 ZINC000513208686 229395215 /nfs/dbraw/zinc/39/52/15/229395215.db2.gz AXQVIPFQLMUBLQ-LPEHRKFASA-N 1 2 219.275 2.283 20 0 BEADLO C[C@H]1CC[C@@H](C[N@H+]2CCC[C@@H]2C(F)F)O1 ZINC000513208686 229395218 /nfs/dbraw/zinc/39/52/18/229395218.db2.gz AXQVIPFQLMUBLQ-LPEHRKFASA-N 1 2 219.275 2.283 20 0 BEADLO CO[C@H](CNc1ccc(C)[nH+]c1)C1CC1 ZINC000653469324 487673307 /nfs/dbraw/zinc/67/33/07/487673307.db2.gz WKLDDFGYYXBOPK-GFCCVEGCSA-N 1 2 206.289 2.227 20 0 BEADLO C[C@@H]1C[N@H+](CCCCF)C[C@H](C(F)(F)F)O1 ZINC000671683135 487688530 /nfs/dbraw/zinc/68/85/30/487688530.db2.gz DKSXMNVPVJKGRF-RKDXNWHRSA-N 1 2 243.244 2.388 20 0 BEADLO C[C@@H]1C[N@@H+](CCCCF)C[C@H](C(F)(F)F)O1 ZINC000671683135 487688533 /nfs/dbraw/zinc/68/85/33/487688533.db2.gz DKSXMNVPVJKGRF-RKDXNWHRSA-N 1 2 243.244 2.388 20 0 BEADLO Cn1ccnc1C[N@@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000176886046 487688176 /nfs/dbraw/zinc/68/81/76/487688176.db2.gz TXNMLQNDHXVHSL-SECBINFHSA-N 1 2 247.264 2.194 20 0 BEADLO Cn1ccnc1C[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000176886046 487688184 /nfs/dbraw/zinc/68/81/84/487688184.db2.gz TXNMLQNDHXVHSL-SECBINFHSA-N 1 2 247.264 2.194 20 0 BEADLO Cn1cc[nH+]c1CN1CCC[C@@H](C(F)(F)F)C1 ZINC000176886046 487688190 /nfs/dbraw/zinc/68/81/90/487688190.db2.gz TXNMLQNDHXVHSL-SECBINFHSA-N 1 2 247.264 2.194 20 0 BEADLO FC[C@@H]1CCC[N@@H+]1Cc1ccncc1F ZINC000336217823 487693348 /nfs/dbraw/zinc/69/33/48/487693348.db2.gz SSTMAOFAPQIYPS-JTQLQIEISA-N 1 2 212.243 2.155 20 0 BEADLO FC[C@@H]1CCC[N@H+]1Cc1ccncc1F ZINC000336217823 487693353 /nfs/dbraw/zinc/69/33/53/487693353.db2.gz SSTMAOFAPQIYPS-JTQLQIEISA-N 1 2 212.243 2.155 20 0 BEADLO Cc1ncc(C[NH2+][C@@H](C)c2ncccc2F)cn1 ZINC000527826679 262887574 /nfs/dbraw/zinc/88/75/74/262887574.db2.gz RJFPRXAJIXYZBG-VIFPVBQESA-N 1 2 246.289 2.170 20 0 BEADLO CC(=O)N1CC[N@@H+](C/C=C(\C)Cl)C(C)(C)C1 ZINC000528440895 262947646 /nfs/dbraw/zinc/94/76/46/262947646.db2.gz UZCDMBPSIOFZNK-BJMVGYQFSA-N 1 2 244.766 2.072 20 0 BEADLO CC(=O)N1CC[N@H+](C/C=C(\C)Cl)C(C)(C)C1 ZINC000528440895 262947648 /nfs/dbraw/zinc/94/76/48/262947648.db2.gz UZCDMBPSIOFZNK-BJMVGYQFSA-N 1 2 244.766 2.072 20 0 BEADLO C[C@H](c1cnccn1)[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000681031026 487701761 /nfs/dbraw/zinc/70/17/61/487701761.db2.gz WGZCSDDNEPMFPD-MXWKQRLJSA-N 1 2 223.295 2.218 20 0 BEADLO C[C@H](c1cnccn1)[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000681031026 487701762 /nfs/dbraw/zinc/70/17/62/487701762.db2.gz WGZCSDDNEPMFPD-MXWKQRLJSA-N 1 2 223.295 2.218 20 0 BEADLO CCC[N@@H+]1C[C@H](C(F)(F)F)OC[C@@H]1C ZINC000671714123 487703945 /nfs/dbraw/zinc/70/39/45/487703945.db2.gz NEZYHUCOQSAECT-JGVFFNPUSA-N 1 2 211.227 2.048 20 0 BEADLO CCC[N@H+]1C[C@H](C(F)(F)F)OC[C@@H]1C ZINC000671714123 487703948 /nfs/dbraw/zinc/70/39/48/487703948.db2.gz NEZYHUCOQSAECT-JGVFFNPUSA-N 1 2 211.227 2.048 20 0 BEADLO C[C@H]1CO[C@@H](C(F)(F)F)C[N@@H+]1CCCCF ZINC000671715562 487704018 /nfs/dbraw/zinc/70/40/18/487704018.db2.gz JDSYATFDGDSAOA-DTWKUNHWSA-N 1 2 243.244 2.388 20 0 BEADLO C[C@H]1CO[C@@H](C(F)(F)F)C[N@H+]1CCCCF ZINC000671715562 487704022 /nfs/dbraw/zinc/70/40/22/487704022.db2.gz JDSYATFDGDSAOA-DTWKUNHWSA-N 1 2 243.244 2.388 20 0 BEADLO Cc1cc([C@H](C)N[C@H](C)c2[nH+]ccn2C)no1 ZINC000669706428 487706428 /nfs/dbraw/zinc/70/64/28/487706428.db2.gz DOBFMRWUEPTSTL-VHSXEESVSA-N 1 2 234.303 2.128 20 0 BEADLO Cc1sccc1C[N@H+](C)Cc1cnc[nH]1 ZINC000668421892 487725658 /nfs/dbraw/zinc/72/56/58/487725658.db2.gz JZVLTWPEPBAJRA-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1sccc1C[N@@H+](C)Cc1cnc[nH]1 ZINC000668421892 487725660 /nfs/dbraw/zinc/72/56/60/487725660.db2.gz JZVLTWPEPBAJRA-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1sccc1C[N@H+](C)Cc1c[nH]cn1 ZINC000668421892 487725663 /nfs/dbraw/zinc/72/56/63/487725663.db2.gz JZVLTWPEPBAJRA-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1sccc1C[N@@H+](C)Cc1c[nH]cn1 ZINC000668421892 487725666 /nfs/dbraw/zinc/72/56/66/487725666.db2.gz JZVLTWPEPBAJRA-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO OCC1(CCNc2cccc[nH+]2)CCC1 ZINC000651466037 487747595 /nfs/dbraw/zinc/74/75/95/487747595.db2.gz LYFKBNJGWIAUAM-UHFFFAOYSA-N 1 2 206.289 2.046 20 0 BEADLO CC(C)CCCC(=O)NCCCn1cc[nH+]c1 ZINC000294152592 487773817 /nfs/dbraw/zinc/77/38/17/487773817.db2.gz AKFNMJCCQGCALS-UHFFFAOYSA-N 1 2 237.347 2.216 20 0 BEADLO Cc1cnc(C[N@H+]2CC[C@H](C)[C@H](F)C2)o1 ZINC000679225723 487788690 /nfs/dbraw/zinc/78/86/90/487788690.db2.gz RCAWAHRDOSGHHS-WCBMZHEXSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1cnc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)o1 ZINC000679225723 487788696 /nfs/dbraw/zinc/78/86/96/487788696.db2.gz RCAWAHRDOSGHHS-WCBMZHEXSA-N 1 2 212.268 2.163 20 0 BEADLO CCC[C@H](C)N(C)C(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000666351494 487791082 /nfs/dbraw/zinc/79/10/82/487791082.db2.gz GKIAVOZFCQLEQD-QJPTWQEYSA-N 1 2 249.358 2.171 20 0 BEADLO CCc1ncc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)cn1 ZINC000666353542 487793294 /nfs/dbraw/zinc/79/32/94/487793294.db2.gz BAADCMFQOIQWLO-JQWIXIFHSA-N 1 2 237.322 2.219 20 0 BEADLO CCc1ncc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)cn1 ZINC000666353542 487793299 /nfs/dbraw/zinc/79/32/99/487793299.db2.gz BAADCMFQOIQWLO-JQWIXIFHSA-N 1 2 237.322 2.219 20 0 BEADLO COCC1([N@H+](C)Cc2ncc(Cl)s2)CC1 ZINC000681407236 487794807 /nfs/dbraw/zinc/79/48/07/487794807.db2.gz RKEVTHOOILAYRL-UHFFFAOYSA-N 1 2 246.763 2.407 20 0 BEADLO COCC1([N@@H+](C)Cc2ncc(Cl)s2)CC1 ZINC000681407236 487794810 /nfs/dbraw/zinc/79/48/10/487794810.db2.gz RKEVTHOOILAYRL-UHFFFAOYSA-N 1 2 246.763 2.407 20 0 BEADLO CCOc1cccc(-c2[nH+]ccn2C)c1 ZINC000041211103 487795423 /nfs/dbraw/zinc/79/54/23/487795423.db2.gz RKYYKFYDAAISNH-UHFFFAOYSA-N 1 2 202.257 2.486 20 0 BEADLO Cc1cc(C[NH+]2CC(CC(F)(F)F)C2)nn1C ZINC000666391207 487795774 /nfs/dbraw/zinc/79/57/74/487795774.db2.gz GQIAHUYIDXEQMM-UHFFFAOYSA-N 1 2 247.264 2.113 20 0 BEADLO Cc1cnc(C[N@H+](C)CCOC(C)(C)C)o1 ZINC000676043215 487804206 /nfs/dbraw/zinc/80/42/06/487804206.db2.gz WUJUGOCWWYMDDA-UHFFFAOYSA-N 1 2 226.320 2.230 20 0 BEADLO Cc1cnc(C[N@@H+](C)CCOC(C)(C)C)o1 ZINC000676043215 487804208 /nfs/dbraw/zinc/80/42/08/487804208.db2.gz WUJUGOCWWYMDDA-UHFFFAOYSA-N 1 2 226.320 2.230 20 0 BEADLO CC/C=C\CC[N@@H+]1CCOC[C@H]1c1ccnn1C ZINC000649884722 487813544 /nfs/dbraw/zinc/81/35/44/487813544.db2.gz ZBHBJGAGXKMGJO-WSNITJDQSA-N 1 2 249.358 2.150 20 0 BEADLO CC/C=C\CC[N@H+]1CCOC[C@H]1c1ccnn1C ZINC000649884722 487813548 /nfs/dbraw/zinc/81/35/48/487813548.db2.gz ZBHBJGAGXKMGJO-WSNITJDQSA-N 1 2 249.358 2.150 20 0 BEADLO CC/C=C/CC[N@@H+]1CCOC[C@H]1c1ccnn1C ZINC000649884721 487813645 /nfs/dbraw/zinc/81/36/45/487813645.db2.gz ZBHBJGAGXKMGJO-NNTXTVRGSA-N 1 2 249.358 2.150 20 0 BEADLO CC/C=C/CC[N@H+]1CCOC[C@H]1c1ccnn1C ZINC000649884721 487813649 /nfs/dbraw/zinc/81/36/49/487813649.db2.gz ZBHBJGAGXKMGJO-NNTXTVRGSA-N 1 2 249.358 2.150 20 0 BEADLO c1n[nH]cc1CNc1ccc(N2CCCC2)c[nH+]1 ZINC000676198412 487819754 /nfs/dbraw/zinc/81/97/54/487819754.db2.gz BDZVXNKJFGUVGJ-UHFFFAOYSA-N 1 2 243.314 2.017 20 0 BEADLO Cc1cc(NC(=O)NCC2=CCCC2)c(C)c[nH+]1 ZINC000666495722 487821530 /nfs/dbraw/zinc/82/15/30/487821530.db2.gz AZMINUAHAZNSTA-UHFFFAOYSA-N 1 2 245.326 2.352 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NCC1=CCCC1 ZINC000666494075 487821902 /nfs/dbraw/zinc/82/19/02/487821902.db2.gz QHKPIOQRSSJHMM-UHFFFAOYSA-N 1 2 231.299 2.044 20 0 BEADLO c1cn(C2CCCC2)nc1C[NH2+]Cc1cn[nH]c1 ZINC000676240359 487828167 /nfs/dbraw/zinc/82/81/67/487828167.db2.gz OEZPPPQMZYPNDT-UHFFFAOYSA-N 1 2 245.330 2.011 20 0 BEADLO CC[C@H]1C[N@@H+]([C@H](C)c2cnc(C)nc2C)CCO1 ZINC000681658041 487833083 /nfs/dbraw/zinc/83/30/83/487833083.db2.gz VNPOBPCIDDUPHP-YPMHNXCESA-N 1 2 249.358 2.265 20 0 BEADLO CC[C@H]1C[N@H+]([C@H](C)c2cnc(C)nc2C)CCO1 ZINC000681658041 487833085 /nfs/dbraw/zinc/83/30/85/487833085.db2.gz VNPOBPCIDDUPHP-YPMHNXCESA-N 1 2 249.358 2.265 20 0 BEADLO Cc1ncc([C@H](C)[N@@H+]2CCOC(C)(C)C2)c(C)n1 ZINC000681672989 487837230 /nfs/dbraw/zinc/83/72/30/487837230.db2.gz SHMLLZZSOVCMKZ-NSHDSACASA-N 1 2 249.358 2.265 20 0 BEADLO Cc1ncc([C@H](C)[N@H+]2CCOC(C)(C)C2)c(C)n1 ZINC000681672989 487837233 /nfs/dbraw/zinc/83/72/33/487837233.db2.gz SHMLLZZSOVCMKZ-NSHDSACASA-N 1 2 249.358 2.265 20 0 BEADLO C[C@@H]1CC[C@@H](C)[N@H+](Cc2cnsn2)C1 ZINC000846808122 588290135 /nfs/dbraw/zinc/29/01/35/588290135.db2.gz PZRGMVCSDNSQFD-RKDXNWHRSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]1CC[C@@H](C)[N@@H+](Cc2cnsn2)C1 ZINC000846808122 588290136 /nfs/dbraw/zinc/29/01/36/588290136.db2.gz PZRGMVCSDNSQFD-RKDXNWHRSA-N 1 2 211.334 2.159 20 0 BEADLO FC(F)c1noc(C[NH+]2C3CCC2CC3)n1 ZINC000564879498 322948638 /nfs/dbraw/zinc/94/86/38/322948638.db2.gz HENUALVRAKGARJ-UHFFFAOYSA-N 1 2 229.230 2.134 20 0 BEADLO ClC(Cl)=CC[N@@H+]1CCc2cn[nH]c2C1 ZINC000851862756 588636069 /nfs/dbraw/zinc/63/60/69/588636069.db2.gz GANMKSCQHLJOOR-UHFFFAOYSA-N 1 2 232.114 2.087 20 0 BEADLO ClC(Cl)=CC[N@H+]1CCc2cn[nH]c2C1 ZINC000851862756 588636070 /nfs/dbraw/zinc/63/60/70/588636070.db2.gz GANMKSCQHLJOOR-UHFFFAOYSA-N 1 2 232.114 2.087 20 0 BEADLO CC(C)C(C)(C)NC(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000668113847 487843444 /nfs/dbraw/zinc/84/34/44/487843444.db2.gz BIRGHKHGVABGFK-SNVBAGLBSA-N 1 2 249.358 2.065 20 0 BEADLO CC(C)C(C)(C)NC(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000668113847 487843448 /nfs/dbraw/zinc/84/34/48/487843448.db2.gz BIRGHKHGVABGFK-SNVBAGLBSA-N 1 2 249.358 2.065 20 0 BEADLO CC1=CC[C@](C)(C(=O)NCc2c[nH+]c[nH]2)CC1 ZINC000668995325 487843931 /nfs/dbraw/zinc/84/39/31/487843931.db2.gz KUDKSOYDGUTPCF-ZDUSSCGKSA-N 1 2 233.315 2.162 20 0 BEADLO CC1=CC[C@](C)(C(=O)NCc2c[nH]c[nH+]2)CC1 ZINC000668995325 487843934 /nfs/dbraw/zinc/84/39/34/487843934.db2.gz KUDKSOYDGUTPCF-ZDUSSCGKSA-N 1 2 233.315 2.162 20 0 BEADLO O=C(NCc1c[nH+]c[nH]1)C1CC2(C1)CCCCC2 ZINC000668995826 487845086 /nfs/dbraw/zinc/84/50/86/487845086.db2.gz QPPVQQYIXZMQAQ-UHFFFAOYSA-N 1 2 247.342 2.386 20 0 BEADLO O=C(NCc1c[nH]c[nH+]1)C1CC2(C1)CCCCC2 ZINC000668995826 487845090 /nfs/dbraw/zinc/84/50/90/487845090.db2.gz QPPVQQYIXZMQAQ-UHFFFAOYSA-N 1 2 247.342 2.386 20 0 BEADLO CC[N@H+](CCOC)Cc1scnc1Cl ZINC000877993182 590467339 /nfs/dbraw/zinc/46/73/39/590467339.db2.gz DPUGBCGXWYPCAY-UHFFFAOYSA-N 1 2 234.752 2.265 20 0 BEADLO CC[N@@H+](CCOC)Cc1scnc1Cl ZINC000877993182 590467343 /nfs/dbraw/zinc/46/73/43/590467343.db2.gz DPUGBCGXWYPCAY-UHFFFAOYSA-N 1 2 234.752 2.265 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccccc2)o1 ZINC000306487263 322951368 /nfs/dbraw/zinc/95/13/68/322951368.db2.gz ITGGNOILRGMMAR-SECBINFHSA-N 1 2 217.272 2.229 20 0 BEADLO O=C(CCCn1cc[nH+]c1)N1CC[C@H]2CCC[C@H]21 ZINC000681747362 487852286 /nfs/dbraw/zinc/85/22/86/487852286.db2.gz JRGSBOROWPKWHA-CHWSQXEVSA-N 1 2 247.342 2.064 20 0 BEADLO CC(C)(C)C[C@H]1CCCN1C(=O)Cn1cc[nH+]c1 ZINC000564637797 322954663 /nfs/dbraw/zinc/95/46/63/322954663.db2.gz LKRBVCNWSGNULQ-GFCCVEGCSA-N 1 2 249.358 2.310 20 0 BEADLO CC[C@H](C)C(=O)NC(C)(C)c1[nH]cc(C)[nH+]1 ZINC000569347998 322955740 /nfs/dbraw/zinc/95/57/40/322955740.db2.gz ZVNQKMKLSWRFFJ-QMMMGPOBSA-N 1 2 223.320 2.116 20 0 BEADLO CCn1cc[nH+]c1CNc1cncc(C)c1 ZINC000227603801 322971952 /nfs/dbraw/zinc/97/19/52/322971952.db2.gz YNVIRXOMCFELHB-UHFFFAOYSA-N 1 2 216.288 2.219 20 0 BEADLO CC[C@H](NC(=O)[C@@H](C)c1ccco1)c1[nH]cc[nH+]1 ZINC000682040955 487888189 /nfs/dbraw/zinc/88/81/89/487888189.db2.gz BTNLRHMNBCCGBI-UWVGGRQHSA-N 1 2 247.298 2.374 20 0 BEADLO C[C@H](C[N@H+](CCO)CC(F)F)C(C)(C)C ZINC000670270754 487889293 /nfs/dbraw/zinc/88/92/93/487889293.db2.gz URBQCNDHGULTCJ-SECBINFHSA-N 1 2 223.307 2.228 20 0 BEADLO C[C@H](C[N@@H+](CCO)CC(F)F)C(C)(C)C ZINC000670270754 487889298 /nfs/dbraw/zinc/88/92/98/487889298.db2.gz URBQCNDHGULTCJ-SECBINFHSA-N 1 2 223.307 2.228 20 0 BEADLO O=C(NCCc1[nH]cc[nH+]1)[C@@H]1CCCC2(CC2)C1 ZINC000668536839 487901196 /nfs/dbraw/zinc/90/11/96/487901196.db2.gz ZANBNWZIKNFESE-LLVKDONJSA-N 1 2 247.342 2.039 20 0 BEADLO c1cc(N2CCC[C@H]3C[C@H]32)nc(C2CC2)[nH+]1 ZINC000672323843 487919472 /nfs/dbraw/zinc/91/94/72/487919472.db2.gz TUOOWAVVMAVHFD-WDEREUQCSA-N 1 2 215.300 2.343 20 0 BEADLO Cc1ccn2cc(CNC(=O)CCCF)[nH+]c2c1 ZINC000667001510 487920924 /nfs/dbraw/zinc/92/09/24/487920924.db2.gz LCVMUFBKPXHRMN-UHFFFAOYSA-N 1 2 249.289 2.009 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2CCOC2(C)C)c1 ZINC000652331540 487920939 /nfs/dbraw/zinc/92/09/39/487920939.db2.gz KFFMWWKNVBVHRI-LLVKDONJSA-N 1 2 236.315 2.207 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](C)c2cnccn2)c1 ZINC000652331147 487921047 /nfs/dbraw/zinc/92/10/47/487921047.db2.gz ZHXLHAZUHMCOFL-JTQLQIEISA-N 1 2 244.298 2.191 20 0 BEADLO CCC[C@@H](O)CC(=O)Nc1ccc(C)[nH+]c1C ZINC000676759431 487922706 /nfs/dbraw/zinc/92/27/06/487922706.db2.gz WEZWIKHBOZBGGE-LLVKDONJSA-N 1 2 236.315 2.188 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CC[C@@H](C(F)F)C2)s1 ZINC000669932268 487935465 /nfs/dbraw/zinc/93/54/65/487935465.db2.gz DDDMRRLXPOZBQJ-POYBYMJQSA-N 1 2 247.314 2.495 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CC[C@@H](C(F)F)C2)s1 ZINC000669932268 487935470 /nfs/dbraw/zinc/93/54/70/487935470.db2.gz DDDMRRLXPOZBQJ-POYBYMJQSA-N 1 2 247.314 2.495 20 0 BEADLO CO[C@H](C)C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000049276083 487945421 /nfs/dbraw/zinc/94/54/21/487945421.db2.gz IQHNXVLKGWMLKW-SECBINFHSA-N 1 2 245.282 2.050 20 0 BEADLO CC1(F)C[NH+](C[C@@H](O)CCc2ccccc2)C1 ZINC000684607898 487945625 /nfs/dbraw/zinc/94/56/25/487945625.db2.gz OQCAKXPOKLVIQZ-ZDUSSCGKSA-N 1 2 237.318 2.024 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000667142215 487946106 /nfs/dbraw/zinc/94/61/06/487946106.db2.gz ORZSFVXGBCAYER-HBNTYKKESA-N 1 2 249.358 2.065 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000667142215 487946111 /nfs/dbraw/zinc/94/61/11/487946111.db2.gz ORZSFVXGBCAYER-HBNTYKKESA-N 1 2 249.358 2.065 20 0 BEADLO CC[C@@](C)(CNc1[nH+]cccc1OC)OC ZINC000323178964 322965124 /nfs/dbraw/zinc/96/51/24/322965124.db2.gz ZENGKRMHLQPUJT-LBPRGKRZSA-N 1 2 224.304 2.317 20 0 BEADLO C[C@@H](NC(=O)C1=CCCCCC1)c1[nH]cc[nH+]1 ZINC000569470525 322967278 /nfs/dbraw/zinc/96/72/78/322967278.db2.gz BAAYZFUXHCACIU-SNVBAGLBSA-N 1 2 233.315 2.477 20 0 BEADLO COC(C)(C)CN(C)c1[nH]c2ccccc2[nH+]1 ZINC000536502637 322975718 /nfs/dbraw/zinc/97/57/18/322975718.db2.gz URPHGCSZBFBZOC-UHFFFAOYSA-N 1 2 233.315 2.424 20 0 BEADLO CC[C@@H]1CCN(C(=O)C[C@H](C)n2cc[nH+]c2)C1 ZINC000564662390 322976643 /nfs/dbraw/zinc/97/66/43/322976643.db2.gz YTBMSQZYDKWLKF-NWDGAFQWSA-N 1 2 235.331 2.093 20 0 BEADLO CCCN(C(=O)[C@H]1CCCc2[nH+]c[nH]c21)C(C)C ZINC000564666937 322979258 /nfs/dbraw/zinc/97/92/58/322979258.db2.gz LIUJEBMQRPTZDI-NSHDSACASA-N 1 2 249.358 2.477 20 0 BEADLO CC1CC(C(=O)N[C@@H](c2[nH+]ccn2C)C2CC2)C1 ZINC000561121015 322995653 /nfs/dbraw/zinc/99/56/53/322995653.db2.gz GBSVTNUOXKGTCU-QEWOUOOISA-N 1 2 247.342 2.034 20 0 BEADLO Cc1ccccc1NC(=O)CCc1c[nH+]c[nH]1 ZINC000074727053 323002734 /nfs/dbraw/zinc/00/27/34/323002734.db2.gz MSGXPRYUPAWIOZ-UHFFFAOYSA-N 1 2 229.283 2.289 20 0 BEADLO Cc1ccccc1NC(=O)CCc1c[nH]c[nH+]1 ZINC000074727053 323002735 /nfs/dbraw/zinc/00/27/35/323002735.db2.gz MSGXPRYUPAWIOZ-UHFFFAOYSA-N 1 2 229.283 2.289 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1[nH]c(C)cc1C ZINC000151606813 323020274 /nfs/dbraw/zinc/02/02/74/323020274.db2.gz JTTBDCZFABWDOZ-UHFFFAOYSA-N 1 2 245.282 2.287 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C[C@@H]1CC[C@H]2C[C@H]21 ZINC000562513460 323022153 /nfs/dbraw/zinc/02/21/53/323022153.db2.gz KGTTULQFAXMBFE-GARJFASQSA-N 1 2 246.310 2.465 20 0 BEADLO CC(C)(C(=O)Nc1ccsc1)c1c[nH+]c[nH]1 ZINC000562581486 323024945 /nfs/dbraw/zinc/02/49/45/323024945.db2.gz GMSVMVUYUVDXCF-UHFFFAOYSA-N 1 2 235.312 2.388 20 0 BEADLO CC(C)(C(=O)Nc1ccsc1)c1c[nH]c[nH+]1 ZINC000562581486 323024946 /nfs/dbraw/zinc/02/49/46/323024946.db2.gz GMSVMVUYUVDXCF-UHFFFAOYSA-N 1 2 235.312 2.388 20 0 BEADLO CC(C)[N@H+](Cc1cnns1)Cc1ccccn1 ZINC000562687062 323027660 /nfs/dbraw/zinc/02/76/60/323027660.db2.gz RZIWXDFLUUZRTH-UHFFFAOYSA-N 1 2 248.355 2.344 20 0 BEADLO CC(C)[N@@H+](Cc1cnns1)Cc1ccccn1 ZINC000562687062 323027661 /nfs/dbraw/zinc/02/76/61/323027661.db2.gz RZIWXDFLUUZRTH-UHFFFAOYSA-N 1 2 248.355 2.344 20 0 BEADLO C[C@@H](NC(=O)C[C@H]1C=CCCC1)c1[nH]cc[nH+]1 ZINC000566983904 323030614 /nfs/dbraw/zinc/03/06/14/323030614.db2.gz UBSAGWDLXQPQTI-MNOVXSKESA-N 1 2 233.315 2.333 20 0 BEADLO CC(C)[C@H](NC(=O)[C@@]12C[C@@H]1CCC2)c1[nH]cc[nH+]1 ZINC000562949696 323034672 /nfs/dbraw/zinc/03/46/72/323034672.db2.gz SNXJLKNSXUPEAR-MJVIPROJSA-N 1 2 247.342 2.413 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N[C@@H](C1CC1)C1CCC1 ZINC000562962935 323036849 /nfs/dbraw/zinc/03/68/49/323036849.db2.gz FGZUQZSDILXVSR-CQSZACIVSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC[C@H]1CC=CCC1 ZINC000572973376 323037765 /nfs/dbraw/zinc/03/77/65/323037765.db2.gz VVMZNYUQQUKTEE-NEPJUHHUSA-N 1 2 247.342 2.061 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC[C@H]1CC=CCC1 ZINC000572973376 323037766 /nfs/dbraw/zinc/03/77/66/323037766.db2.gz VVMZNYUQQUKTEE-NEPJUHHUSA-N 1 2 247.342 2.061 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)NC[C@@H]3C[C@H]3C)ccn12 ZINC000569739849 323039586 /nfs/dbraw/zinc/03/95/86/323039586.db2.gz KOQMIZCNWFVBMN-SKDRFNHKSA-N 1 2 243.310 2.029 20 0 BEADLO OC1(CNc2ccc(-n3cc[nH+]c3)cc2)CCC1 ZINC000569921339 323044616 /nfs/dbraw/zinc/04/46/16/323044616.db2.gz WHEWZRHSEPHEAW-UHFFFAOYSA-N 1 2 243.310 2.199 20 0 BEADLO c1cc(C[N@@H+]2CCC=C(c3ccccn3)C2)no1 ZINC000570388104 323057908 /nfs/dbraw/zinc/05/79/08/323057908.db2.gz IDLLIBHASVJCPN-UHFFFAOYSA-N 1 2 241.294 2.359 20 0 BEADLO c1cc(C[N@H+]2CCC=C(c3ccccn3)C2)no1 ZINC000570388104 323057909 /nfs/dbraw/zinc/05/79/09/323057909.db2.gz IDLLIBHASVJCPN-UHFFFAOYSA-N 1 2 241.294 2.359 20 0 BEADLO Cn1cc(CNc2c[nH]c[nH+]2)c(C(C)(C)C)n1 ZINC000570509131 323061655 /nfs/dbraw/zinc/06/16/55/323061655.db2.gz ZTOHARHLNFVBPH-UHFFFAOYSA-N 1 2 233.319 2.053 20 0 BEADLO C[C@@H](CC(=O)NC[C@H]1CC[C@@H](C)C1)n1cc[nH+]c1 ZINC000572648478 323062579 /nfs/dbraw/zinc/06/25/79/323062579.db2.gz FUUFZTORPGGHCC-AGIUHOORSA-N 1 2 249.358 2.387 20 0 BEADLO C[C@H](CC(=O)NC[C@H]1CC[C@@H](C)C1)n1cc[nH+]c1 ZINC000572648481 323062589 /nfs/dbraw/zinc/06/25/89/323062589.db2.gz FUUFZTORPGGHCC-UPJWGTAASA-N 1 2 249.358 2.387 20 0 BEADLO Cc1cc(N[C@H](CO)CC2CCCC2)nc[nH+]1 ZINC000570542870 323062818 /nfs/dbraw/zinc/06/28/18/323062818.db2.gz FHOUHPTVJXFIOO-LBPRGKRZSA-N 1 2 235.331 2.138 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)[C@H](C)C2CC2)[nH+]1 ZINC000570638672 323065727 /nfs/dbraw/zinc/06/57/27/323065727.db2.gz CCNLDWRFVQUSQA-SECBINFHSA-N 1 2 235.331 2.116 20 0 BEADLO C[C@@H](NC(=O)C[C@H]1CC[C@@H](C)C1)c1[nH]cc[nH+]1 ZINC000570647994 323066064 /nfs/dbraw/zinc/06/60/64/323066064.db2.gz JUKXAQMYAXRLHX-MXWKQRLJSA-N 1 2 235.331 2.413 20 0 BEADLO CNC(=O)CCSCc1ccc(C)[nH+]c1C ZINC000570848072 323072482 /nfs/dbraw/zinc/07/24/82/323072482.db2.gz FULPPXWTBIJKOM-UHFFFAOYSA-N 1 2 238.356 2.068 20 0 BEADLO C[N@H+](Cc1noc(-c2ccccc2)n1)C1CC1 ZINC000047916033 323076507 /nfs/dbraw/zinc/07/65/07/323076507.db2.gz XIMXVPAAQPZRPE-UHFFFAOYSA-N 1 2 229.283 2.331 20 0 BEADLO C[N@@H+](Cc1noc(-c2ccccc2)n1)C1CC1 ZINC000047916033 323076508 /nfs/dbraw/zinc/07/65/08/323076508.db2.gz XIMXVPAAQPZRPE-UHFFFAOYSA-N 1 2 229.283 2.331 20 0 BEADLO C[C@@H]1C[C@H](O)CN(c2[nH+]ccc3ccccc32)C1 ZINC000401530748 323080218 /nfs/dbraw/zinc/08/02/18/323080218.db2.gz HZBJNBMXQHYEFQ-YPMHNXCESA-N 1 2 242.322 2.442 20 0 BEADLO Cc1nc(N[C@H]2CO[C@H](C)C2)c2c([nH+]1)CCCC2 ZINC000563053028 323082969 /nfs/dbraw/zinc/08/29/69/323082969.db2.gz UGKAYNGMYSXSCK-MWLCHTKSSA-N 1 2 247.342 2.253 20 0 BEADLO CCCc1csc(C[NH2+]Cc2ccno2)n1 ZINC000563151448 323095632 /nfs/dbraw/zinc/09/56/32/323095632.db2.gz SKKCPGRPNTVQPU-UHFFFAOYSA-N 1 2 237.328 2.373 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)[C@H]1CCCC[C@@H]1C1CC1 ZINC000563180000 323100339 /nfs/dbraw/zinc/10/03/39/323100339.db2.gz IARMCWMQBXNPGZ-NEPJUHHUSA-N 1 2 247.342 2.242 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)[C@@H]1CCCC[C@H]1C1CC1 ZINC000563180001 323100346 /nfs/dbraw/zinc/10/03/46/323100346.db2.gz IARMCWMQBXNPGZ-NWDGAFQWSA-N 1 2 247.342 2.242 20 0 BEADLO C[C@@H](CC(=O)NCc1cccs1)n1cc[nH+]c1 ZINC000563210315 323102062 /nfs/dbraw/zinc/10/20/62/323102062.db2.gz QBSZONFYPCMUFH-JTQLQIEISA-N 1 2 249.339 2.212 20 0 BEADLO C[C@@H](CC(=O)N1CC2(C1)CCCC2)n1cc[nH+]c1 ZINC000563255001 323106861 /nfs/dbraw/zinc/10/68/61/323106861.db2.gz XUZSQFZZSRPZST-LBPRGKRZSA-N 1 2 247.342 2.237 20 0 BEADLO C[C@@H]1C[C@H](C)CN1c1nc(N)c2ccccc2[nH+]1 ZINC000534272775 323115333 /nfs/dbraw/zinc/11/53/33/323115333.db2.gz YIRZTOFQZYJYTI-VHSXEESVSA-N 1 2 242.326 2.277 20 0 BEADLO CO[C@H]1C[C@@H](Nc2nc(C)[nH+]cc2C)C12CCC2 ZINC000563423763 323124201 /nfs/dbraw/zinc/12/42/01/323124201.db2.gz JGCAPUVPXRHIQZ-NEPJUHHUSA-N 1 2 247.342 2.463 20 0 BEADLO CO[C@@H]1C[C@@H](Nc2nc(C)[nH+]cc2C)C12CCC2 ZINC000563423771 323124370 /nfs/dbraw/zinc/12/43/70/323124370.db2.gz JGCAPUVPXRHIQZ-VXGBXAGGSA-N 1 2 247.342 2.463 20 0 BEADLO CC[C@@H]([NH2+]CCCc1cccs1)C(=O)OC ZINC000310012564 323126268 /nfs/dbraw/zinc/12/62/68/323126268.db2.gz JFFJNAJKPBCTOK-LLVKDONJSA-N 1 2 241.356 2.222 20 0 BEADLO CC[C@@](C)(NCc1c[nH+]cn1C)C(F)(F)F ZINC000310040957 323127072 /nfs/dbraw/zinc/12/70/72/323127072.db2.gz YANOEISCPJCTKK-SECBINFHSA-N 1 2 235.253 2.241 20 0 BEADLO CCCN(CCC)C(=O)[C@@H]1CCc2c[nH+]cn2C1 ZINC000571469624 323145713 /nfs/dbraw/zinc/14/57/13/323145713.db2.gz CMTYTDRYIXVJIW-GFCCVEGCSA-N 1 2 249.358 2.094 20 0 BEADLO CC(C)C1CCC(NCC(F)(F)C[NH3+])CC1 ZINC000414925030 323152094 /nfs/dbraw/zinc/15/20/94/323152094.db2.gz HMWRTAXEWRGAQP-UHFFFAOYSA-N 1 2 234.334 2.385 20 0 BEADLO C[N@H+](CC(=O)Nc1ccccc1)Cc1ccoc1 ZINC000048839511 323155959 /nfs/dbraw/zinc/15/59/59/323155959.db2.gz LCXCFDFGUZNMJQ-UHFFFAOYSA-N 1 2 244.294 2.350 20 0 BEADLO C[N@@H+](CC(=O)Nc1ccccc1)Cc1ccoc1 ZINC000048839511 323155960 /nfs/dbraw/zinc/15/59/60/323155960.db2.gz LCXCFDFGUZNMJQ-UHFFFAOYSA-N 1 2 244.294 2.350 20 0 BEADLO Cc1ccc(C(=O)Nc2cc(C)[nH+]cc2C)o1 ZINC000535036294 323164271 /nfs/dbraw/zinc/16/42/71/323164271.db2.gz RGZRVXLIFMWJIG-UHFFFAOYSA-N 1 2 230.267 2.274 20 0 BEADLO Cc1cc(NC(=O)NCC2CCC2)c(C)c[nH+]1 ZINC000535059197 323164911 /nfs/dbraw/zinc/16/49/11/323164911.db2.gz CZSNSXVOMVZEJJ-UHFFFAOYSA-N 1 2 233.315 2.042 20 0 BEADLO c1cc(C[N@@H+]2CCC[C@H]2c2ccccn2)n[nH]1 ZINC000535067657 323165075 /nfs/dbraw/zinc/16/50/75/323165075.db2.gz WLFLHVSZIVHVNJ-ZDUSSCGKSA-N 1 2 228.299 2.142 20 0 BEADLO c1cc(C[N@H+]2CCC[C@H]2c2ccccn2)n[nH]1 ZINC000535067657 323165076 /nfs/dbraw/zinc/16/50/76/323165076.db2.gz WLFLHVSZIVHVNJ-ZDUSSCGKSA-N 1 2 228.299 2.142 20 0 BEADLO CSCCC[N@H+](CC(F)F)C1CC1 ZINC000075718070 323170692 /nfs/dbraw/zinc/17/06/92/323170692.db2.gz XLYVWWJNXRWWFZ-UHFFFAOYSA-N 1 2 209.305 2.469 20 0 BEADLO CSCCC[N@@H+](CC(F)F)C1CC1 ZINC000075718070 323170693 /nfs/dbraw/zinc/17/06/93/323170693.db2.gz XLYVWWJNXRWWFZ-UHFFFAOYSA-N 1 2 209.305 2.469 20 0 BEADLO CC[C@@]1(C)C[C@H]1C(=O)NCCCCn1cc[nH+]c1 ZINC000532069484 323171306 /nfs/dbraw/zinc/17/13/06/323171306.db2.gz HJQXOIXYHDGMLF-JSGCOSHPSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@@H](CC(=O)NCC1=CCCCC1)n1cc[nH+]c1 ZINC000563716028 323175204 /nfs/dbraw/zinc/17/52/04/323175204.db2.gz MPIHPANDAXLWRB-LBPRGKRZSA-N 1 2 247.342 2.451 20 0 BEADLO Cc1cncc([C@H](C)[NH2+]Cc2ncccn2)c1 ZINC000563821385 323179293 /nfs/dbraw/zinc/17/92/93/323179293.db2.gz HUXCJCBZLRGESH-NSHDSACASA-N 1 2 228.299 2.031 20 0 BEADLO Fc1ccc(F)c(CNc2c[nH]c[nH+]2)c1 ZINC000308898935 323181238 /nfs/dbraw/zinc/18/12/38/323181238.db2.gz BFBBNDWBOXYBQM-UHFFFAOYSA-N 1 2 209.199 2.300 20 0 BEADLO COC[C@@H](C)CNc1ccc(SC)c[nH+]1 ZINC000308918807 323181504 /nfs/dbraw/zinc/18/15/04/323181504.db2.gz GQPCNQHQPLQFQZ-VIFPVBQESA-N 1 2 226.345 2.498 20 0 BEADLO C[C@@H](CC(=O)N[C@@H]1CC=CCC1)n1cc[nH+]c1 ZINC000563888566 323183529 /nfs/dbraw/zinc/18/35/29/323183529.db2.gz BPBZQHSYNXYHQA-NWDGAFQWSA-N 1 2 233.315 2.059 20 0 BEADLO C[C@@H](CC(=O)N[C@H]1CC=CCC1)n1cc[nH+]c1 ZINC000563888567 323183566 /nfs/dbraw/zinc/18/35/66/323183566.db2.gz BPBZQHSYNXYHQA-RYUDHWBXSA-N 1 2 233.315 2.059 20 0 BEADLO CCCc1ncc(C[NH2+]Cc2ccc(F)cn2)o1 ZINC000529596722 323184706 /nfs/dbraw/zinc/18/47/06/323184706.db2.gz RFYNMFXQMCIBLX-UHFFFAOYSA-N 1 2 249.289 2.451 20 0 BEADLO COc1ccccc1C[NH2+][C@H](C)c1csnn1 ZINC000398489073 323185922 /nfs/dbraw/zinc/18/59/22/323185922.db2.gz VIZCPYRKXLWTSI-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO Cc1ccoc1C(=O)Nc1cc(C)[nH+]cc1C ZINC000535748083 323190168 /nfs/dbraw/zinc/19/01/68/323190168.db2.gz QQRDXWWIBANGHK-UHFFFAOYSA-N 1 2 230.267 2.274 20 0 BEADLO Cc1cc(NC(=O)N2CC[C@@H](C)[C@@H]2C)c(C)c[nH+]1 ZINC000535773059 323190871 /nfs/dbraw/zinc/19/08/71/323190871.db2.gz DAVZSKPJAWECOY-SKDRFNHKSA-N 1 2 247.342 2.383 20 0 BEADLO CCCCNC(=O)Nc1cc(C)[nH+]cc1C ZINC000535774419 323190971 /nfs/dbraw/zinc/19/09/71/323190971.db2.gz QPILOADIGFUFLA-UHFFFAOYSA-N 1 2 221.304 2.042 20 0 BEADLO Cc1ccc(C)c([C@H](C)[NH2+]Cc2ncn(C)n2)c1 ZINC000134197709 323195049 /nfs/dbraw/zinc/19/50/49/323195049.db2.gz XVIKNVSNBDSMGR-LBPRGKRZSA-N 1 2 244.342 2.283 20 0 BEADLO Cc1cccc(C[NH2+][C@@H](C)c2cnccn2)n1 ZINC000070479594 323195998 /nfs/dbraw/zinc/19/59/98/323195998.db2.gz YIVZCNYRWXYWSQ-NSHDSACASA-N 1 2 228.299 2.031 20 0 BEADLO Cc1cc(NC(=O)NC[C@H]2CC2(C)C)c(C)c[nH+]1 ZINC000536619186 323198734 /nfs/dbraw/zinc/19/87/34/323198734.db2.gz JSBKWKYASOPSMS-LLVKDONJSA-N 1 2 247.342 2.288 20 0 BEADLO Cc1nccnc1[C@H](C)[NH2+]Cc1ncccc1F ZINC000530370837 323383367 /nfs/dbraw/zinc/38/33/67/323383367.db2.gz HNUQBVJXRLUDKO-JTQLQIEISA-N 1 2 246.289 2.170 20 0 BEADLO CCn1cc([C@H](C)[NH2+]Cc2ncccc2F)cn1 ZINC000530418706 323386018 /nfs/dbraw/zinc/38/60/18/323386018.db2.gz ANXAJQQNJWRKSR-JTQLQIEISA-N 1 2 248.305 2.288 20 0 BEADLO COc1ccc[nH+]c1N1CCC[C@H](F)C1 ZINC000527996192 323733579 /nfs/dbraw/zinc/73/35/79/323733579.db2.gz CSKIOHUVPNRINT-VIFPVBQESA-N 1 2 210.252 2.029 20 0 BEADLO CC(C)c1nc(N[C@@H]2[C@H](C)O[C@@H](C)[C@H]2C)cc[nH+]1 ZINC000528204666 323780196 /nfs/dbraw/zinc/78/01/96/323780196.db2.gz IPTYNTPQDIGINW-BLFANLJRSA-N 1 2 249.358 2.246 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N[C@H]1C=CCCC1 ZINC000119181946 323913703 /nfs/dbraw/zinc/91/37/03/323913703.db2.gz IFPYIQXCOQJXPW-BCPZQOPPSA-N 1 2 245.326 2.141 20 0 BEADLO c1snnc1C[NH2+][C@H](c1cccnc1)C1CC1 ZINC000537317869 324064908 /nfs/dbraw/zinc/06/49/08/324064908.db2.gz LCIPLSVEVHMXPB-LBPRGKRZSA-N 1 2 246.339 2.174 20 0 BEADLO COCc1ccc(CNc2[nH+]cccc2OC)o1 ZINC000537360884 324066381 /nfs/dbraw/zinc/06/63/81/324066381.db2.gz JGNCUWUACGTHIT-UHFFFAOYSA-N 1 2 248.282 2.442 20 0 BEADLO CC(C)c1nocc1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000529410992 324289212 /nfs/dbraw/zinc/28/92/12/324289212.db2.gz BYZZSNCOPSBUQL-MRVPVSSYSA-N 1 2 248.286 2.012 20 0 BEADLO C[C@H]1[C@@H](C2CC2)[C@H]1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000529461383 324305862 /nfs/dbraw/zinc/30/58/62/324305862.db2.gz ZHGGDJKMILCJJT-LSJOCFKGSA-N 1 2 247.342 2.053 20 0 BEADLO O[C@H]1CC[N@H+](Cc2c(F)ccc(F)c2Cl)C1 ZINC000529522541 324323164 /nfs/dbraw/zinc/32/31/64/324323164.db2.gz GSMWYNQPJRXSDR-ZETCQYMHSA-N 1 2 247.672 2.185 20 0 BEADLO O[C@H]1CC[N@@H+](Cc2c(F)ccc(F)c2Cl)C1 ZINC000529522541 324323166 /nfs/dbraw/zinc/32/31/66/324323166.db2.gz GSMWYNQPJRXSDR-ZETCQYMHSA-N 1 2 247.672 2.185 20 0 BEADLO CC1(C)CCC[C@H]1CCNC(=O)Cc1[nH]cc[nH+]1 ZINC000529565196 324344573 /nfs/dbraw/zinc/34/45/73/324344573.db2.gz TWFWBDBJMOLXHP-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H]1C[C@H]([NH2+]Cc2ccc(F)cn2)c2nccn21 ZINC000529594660 324357092 /nfs/dbraw/zinc/35/70/92/324357092.db2.gz FGGISTXTAFRXJM-CABZTGNLSA-N 1 2 246.289 2.213 20 0 BEADLO CCn1ccnc1C[NH+]1CC(Cc2ccco2)C1 ZINC000529648355 324371347 /nfs/dbraw/zinc/37/13/47/324371347.db2.gz AFQVKYIOIZOPFL-UHFFFAOYSA-N 1 2 245.326 2.171 20 0 BEADLO Cc1ccc(NCc2cc(C(N)=O)cs2)c[nH+]1 ZINC000128078795 324805409 /nfs/dbraw/zinc/80/54/09/324805409.db2.gz NKZDFIXJGGIFGQ-UHFFFAOYSA-N 1 2 247.323 2.163 20 0 BEADLO Cn1c[nH+]cc1CCNC(=O)C1CCCCCC1 ZINC000542481262 325030329 /nfs/dbraw/zinc/03/03/29/325030329.db2.gz RGUFCEQWXVNFEG-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO Cc1ccc(NC(=O)CC2(O)CCCC2)c(C)[nH+]1 ZINC000130641676 325076319 /nfs/dbraw/zinc/07/63/19/325076319.db2.gz DYPMLVFMHDAWLY-UHFFFAOYSA-N 1 2 248.326 2.332 20 0 BEADLO FC1CN(c2nc(C3CC3)[nH+]c3c2CCC3)C1 ZINC000544065200 325129932 /nfs/dbraw/zinc/12/99/32/325129932.db2.gz JGAXFEZPMQRWGC-UHFFFAOYSA-N 1 2 233.290 2.001 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2ccc(F)cc2)o1 ZINC000544515407 325145936 /nfs/dbraw/zinc/14/59/36/325145936.db2.gz IWLKBWOQYDFIMB-QMMMGPOBSA-N 1 2 235.262 2.368 20 0 BEADLO Cn1c[nH+]cc1Cc1noc(C=C2CCCC2)n1 ZINC000545125646 325179129 /nfs/dbraw/zinc/17/91/29/325179129.db2.gz AOEKPLGHIVGIJP-UHFFFAOYSA-N 1 2 244.298 2.351 20 0 BEADLO Cc1cc(N2CCc3ccsc3C2)nc[nH+]1 ZINC000132420703 325216249 /nfs/dbraw/zinc/21/62/49/325216249.db2.gz OSYQQPMZMRODLW-UHFFFAOYSA-N 1 2 231.324 2.409 20 0 BEADLO CC(C)c1nc(Cc2cn3ccccc3[nH+]2)no1 ZINC000545599067 325229487 /nfs/dbraw/zinc/22/94/87/325229487.db2.gz WCDDWMAGJWWJLH-UHFFFAOYSA-N 1 2 242.282 2.432 20 0 BEADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1ncccc1O ZINC000564294241 325238047 /nfs/dbraw/zinc/23/80/47/325238047.db2.gz YZQMWKFJITUOQF-NSHDSACASA-N 1 2 243.310 2.166 20 0 BEADLO CC(C)c1nc(N(C)CC2(O)CCCC2)cc[nH+]1 ZINC000133113312 325269295 /nfs/dbraw/zinc/26/92/95/325269295.db2.gz FXBYSUPIIJJSPV-UHFFFAOYSA-N 1 2 249.358 2.341 20 0 BEADLO CC(C)OC(=O)CC[N@H+](CC(F)F)C1CC1 ZINC000075718030 325308241 /nfs/dbraw/zinc/30/82/41/325308241.db2.gz BNJZJQGTVUOFEE-UHFFFAOYSA-N 1 2 235.274 2.058 20 0 BEADLO CC(C)OC(=O)CC[N@@H+](CC(F)F)C1CC1 ZINC000075718030 325308243 /nfs/dbraw/zinc/30/82/43/325308243.db2.gz BNJZJQGTVUOFEE-UHFFFAOYSA-N 1 2 235.274 2.058 20 0 BEADLO CC(C)c1nc(N2CCC[C@@H]2C[C@@H](C)O)cc[nH+]1 ZINC000133352842 325289433 /nfs/dbraw/zinc/28/94/33/325289433.db2.gz VHECGHRPKJQVCI-VXGBXAGGSA-N 1 2 249.358 2.340 20 0 BEADLO CC1(C)C[N@H+](Cc2nc3ccccc3o2)CCO1 ZINC000075701158 325307345 /nfs/dbraw/zinc/30/73/45/325307345.db2.gz FTLHDXVKKGNVTL-UHFFFAOYSA-N 1 2 246.310 2.439 20 0 BEADLO CC1(C)C[N@@H+](Cc2nc3ccccc3o2)CCO1 ZINC000075701158 325307349 /nfs/dbraw/zinc/30/73/49/325307349.db2.gz FTLHDXVKKGNVTL-UHFFFAOYSA-N 1 2 246.310 2.439 20 0 BEADLO Cc1cnc(C[NH2+]Cc2ccc(C)cn2)s1 ZINC000134368175 325355620 /nfs/dbraw/zinc/35/56/20/325355620.db2.gz SPEZIOMYNBREEG-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO Cc1nnc(C[NH2+][C@H](C)c2ccoc2)s1 ZINC000134722672 325373313 /nfs/dbraw/zinc/37/33/13/325373313.db2.gz XAFGTOCOWMJDMP-SSDOTTSWSA-N 1 2 223.301 2.290 20 0 BEADLO CC[C@]1(C)C[N@H+](Cc2cc(C)nc(C)n2)CCO1 ZINC000660380206 487967489 /nfs/dbraw/zinc/96/74/89/487967489.db2.gz JUXWUFHGNXHVPE-CQSZACIVSA-N 1 2 249.358 2.094 20 0 BEADLO CC[C@]1(C)C[N@@H+](Cc2cc(C)nc(C)n2)CCO1 ZINC000660380206 487967493 /nfs/dbraw/zinc/96/74/93/487967493.db2.gz JUXWUFHGNXHVPE-CQSZACIVSA-N 1 2 249.358 2.094 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)N(C)C(C)C ZINC000548008171 325420786 /nfs/dbraw/zinc/42/07/86/325420786.db2.gz UZSFFNSLHNQFNE-JTQLQIEISA-N 1 2 238.335 2.014 20 0 BEADLO Cc1nocc1C[NH2+]Cc1noc2c1CCCC2 ZINC000550218365 325526284 /nfs/dbraw/zinc/52/62/84/325526284.db2.gz KFLXQACGDNGBCG-UHFFFAOYSA-N 1 2 247.298 2.140 20 0 BEADLO CC[C@H]1CC[C@H](C(=O)NCCn2cc[nH+]c2)CC1 ZINC000249400842 325647614 /nfs/dbraw/zinc/64/76/14/325647614.db2.gz VEEAQIHCHQKJLH-JOCQHMNTSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1[nH]c(CNCc2ccn(C(C)C)n2)[nH+]c1C ZINC000565242898 325885290 /nfs/dbraw/zinc/88/52/90/325885290.db2.gz UEUXABSSYQYLFK-UHFFFAOYSA-N 1 2 247.346 2.094 20 0 BEADLO CC[C@H](C)N(C)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000566307567 326032393 /nfs/dbraw/zinc/03/23/93/326032393.db2.gz KYOBALMWWKROGP-WDEREUQCSA-N 1 2 223.320 2.091 20 0 BEADLO CCC(C)(C)N(C)C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000566443714 326048407 /nfs/dbraw/zinc/04/84/07/326048407.db2.gz AHDRAQYFDLNVDO-SNVBAGLBSA-N 1 2 237.347 2.235 20 0 BEADLO CCC(C)(C)N(C)C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000566443714 326048409 /nfs/dbraw/zinc/04/84/09/326048409.db2.gz AHDRAQYFDLNVDO-SNVBAGLBSA-N 1 2 237.347 2.235 20 0 BEADLO CCN(C(=O)Cc1[nH]c[nH+]c1C)[C@@H](C)C(C)C ZINC000566453478 326049976 /nfs/dbraw/zinc/04/99/76/326049976.db2.gz YEYKMVRCUGCPSD-NSHDSACASA-N 1 2 237.347 2.154 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CCCC[C@H](C)C1 ZINC000566452543 326050005 /nfs/dbraw/zinc/05/00/05/326050005.db2.gz ZGRKUFMCTDCYDV-NWDGAFQWSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CCCC[C@H](C)C1 ZINC000566452543 326050009 /nfs/dbraw/zinc/05/00/09/326050009.db2.gz ZGRKUFMCTDCYDV-NWDGAFQWSA-N 1 2 249.358 2.237 20 0 BEADLO CC1=C[C@@H](C)CN(C(=O)[C@H](C)Cc2c[nH+]c[nH]2)C1 ZINC000566457463 326050648 /nfs/dbraw/zinc/05/06/48/326050648.db2.gz JGNAJGKHFDHAMI-ZYHUDNBSSA-N 1 2 247.342 2.013 20 0 BEADLO CC1=C[C@@H](C)CN(C(=O)[C@H](C)Cc2c[nH]c[nH+]2)C1 ZINC000566457463 326050651 /nfs/dbraw/zinc/05/06/51/326050651.db2.gz JGNAJGKHFDHAMI-ZYHUDNBSSA-N 1 2 247.342 2.013 20 0 BEADLO CC1=C[C@H](C)CN(C(=O)[C@H](C)Cc2c[nH+]c[nH]2)C1 ZINC000566457458 326050769 /nfs/dbraw/zinc/05/07/69/326050769.db2.gz JGNAJGKHFDHAMI-CMPLNLGQSA-N 1 2 247.342 2.013 20 0 BEADLO CC1=C[C@H](C)CN(C(=O)[C@H](C)Cc2c[nH]c[nH+]2)C1 ZINC000566457458 326050771 /nfs/dbraw/zinc/05/07/71/326050771.db2.gz JGNAJGKHFDHAMI-CMPLNLGQSA-N 1 2 247.342 2.013 20 0 BEADLO CC1=C[C@H](C)CN(C(=O)[C@@H](C)Cc2c[nH+]c[nH]2)C1 ZINC000566457460 326050835 /nfs/dbraw/zinc/05/08/35/326050835.db2.gz JGNAJGKHFDHAMI-JQWIXIFHSA-N 1 2 247.342 2.013 20 0 BEADLO CC1=C[C@H](C)CN(C(=O)[C@@H](C)Cc2c[nH]c[nH+]2)C1 ZINC000566457460 326050837 /nfs/dbraw/zinc/05/08/37/326050837.db2.gz JGNAJGKHFDHAMI-JQWIXIFHSA-N 1 2 247.342 2.013 20 0 BEADLO Cc1c[nH+]c(C)nc1N1C[C@@H](C)S[C@@H](C)C1 ZINC000566630282 326070011 /nfs/dbraw/zinc/07/00/11/326070011.db2.gz RRVMQYNYNQYCMJ-AOOOYVTPSA-N 1 2 237.372 2.424 20 0 BEADLO CC(C)C(C)(C)NC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000566688221 326074830 /nfs/dbraw/zinc/07/48/30/326074830.db2.gz XQDRMVVEUPEKBY-SNVBAGLBSA-N 1 2 237.347 2.139 20 0 BEADLO CC(C)C(C)(C)NC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000566688221 326074832 /nfs/dbraw/zinc/07/48/32/326074832.db2.gz XQDRMVVEUPEKBY-SNVBAGLBSA-N 1 2 237.347 2.139 20 0 BEADLO CC1=C(C)C[C@@H](C(=O)NCCn2cc[nH+]c2)CC1 ZINC000566856493 326088660 /nfs/dbraw/zinc/08/86/60/326088660.db2.gz CUGBNNNGIJSGNE-ZDUSSCGKSA-N 1 2 247.342 2.136 20 0 BEADLO CC(C)[C@@H]1CCCN1C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000567059675 326109031 /nfs/dbraw/zinc/10/90/31/326109031.db2.gz DKQGJBYKBVECKR-YPMHNXCESA-N 1 2 249.358 2.235 20 0 BEADLO CC(C)[C@@H]1CCCN1C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000567059675 326109033 /nfs/dbraw/zinc/10/90/33/326109033.db2.gz DKQGJBYKBVECKR-YPMHNXCESA-N 1 2 249.358 2.235 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1ccc(C)nc1 ZINC000153772499 326112574 /nfs/dbraw/zinc/11/25/74/326112574.db2.gz YPQOIFGZYBVSJT-ZDUSSCGKSA-N 1 2 220.316 2.001 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1ccc(C)nc1 ZINC000153772499 326112576 /nfs/dbraw/zinc/11/25/76/326112576.db2.gz YPQOIFGZYBVSJT-ZDUSSCGKSA-N 1 2 220.316 2.001 20 0 BEADLO Cc1ccc(C[N@@H+]2CCOC3(CCC3)C2)nc1 ZINC000154156232 326133494 /nfs/dbraw/zinc/13/34/94/326133494.db2.gz NIRNMMZKRQPJQZ-UHFFFAOYSA-N 1 2 232.327 2.145 20 0 BEADLO Cc1ccc(C[N@H+]2CCOC3(CCC3)C2)nc1 ZINC000154156232 326133496 /nfs/dbraw/zinc/13/34/96/326133496.db2.gz NIRNMMZKRQPJQZ-UHFFFAOYSA-N 1 2 232.327 2.145 20 0 BEADLO CCCOc1ccc(C[NH+]2CCOCC2)cc1 ZINC000154505818 326147351 /nfs/dbraw/zinc/14/73/51/326147351.db2.gz NOECMUXXSJKBKX-UHFFFAOYSA-N 1 2 235.327 2.308 20 0 BEADLO CCC(O)(CC)C(C)(C)C[NH2+]Cc1ccn[nH]1 ZINC000567292211 326156836 /nfs/dbraw/zinc/15/68/36/326156836.db2.gz IQWIKMWICCDLEU-UHFFFAOYSA-N 1 2 239.363 2.077 20 0 BEADLO CC[C@@]1(C)C[C@H]1C(=O)N(C)CCCn1cc[nH+]c1 ZINC000154961084 326175217 /nfs/dbraw/zinc/17/52/17/326175217.db2.gz FONIDXSMKOLSNA-JSGCOSHPSA-N 1 2 249.358 2.168 20 0 BEADLO Cc1nc(N[C@@H]2CCC[C@H]3OCC[C@H]32)cc[nH+]1 ZINC000268395119 326177256 /nfs/dbraw/zinc/17/72/56/326177256.db2.gz NSSODHIHQWXLHR-QJPTWQEYSA-N 1 2 233.315 2.155 20 0 BEADLO Cc1nc(N[C@@H]2CCC[C@@H]3OCC[C@H]32)cc[nH+]1 ZINC000268395123 326177295 /nfs/dbraw/zinc/17/72/95/326177295.db2.gz NSSODHIHQWXLHR-TUAOUCFPSA-N 1 2 233.315 2.155 20 0 BEADLO CC1(C)CC[C@@H]1NC(=O)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000567772360 326256974 /nfs/dbraw/zinc/25/69/74/326256974.db2.gz AHGHFVGQTGHJES-KOLCDFICSA-N 1 2 247.342 2.134 20 0 BEADLO CC1(C)CC[C@@H]1NC(=O)[C@@H]1CCCc2[nH]c[nH+]c21 ZINC000567772360 326256976 /nfs/dbraw/zinc/25/69/76/326256976.db2.gz AHGHFVGQTGHJES-KOLCDFICSA-N 1 2 247.342 2.134 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)CC2CCC2)[nH+]1 ZINC000567905710 326281116 /nfs/dbraw/zinc/28/11/16/326281116.db2.gz NGWBUCPJBMYRAY-UHFFFAOYSA-N 1 2 235.331 2.260 20 0 BEADLO Cc1ncc(C[N@@H+]2CCC[C@@H](F)C2)s1 ZINC000568053781 326301230 /nfs/dbraw/zinc/30/12/30/326301230.db2.gz GXMWDNSYNTYAHZ-SECBINFHSA-N 1 2 214.309 2.385 20 0 BEADLO Cc1ncc(C[N@H+]2CCC[C@@H](F)C2)s1 ZINC000568053781 326301232 /nfs/dbraw/zinc/30/12/32/326301232.db2.gz GXMWDNSYNTYAHZ-SECBINFHSA-N 1 2 214.309 2.385 20 0 BEADLO CC1(C)C[NH+](CC(=O)NCC2(C)CCCC2)C1 ZINC000568191801 326323189 /nfs/dbraw/zinc/32/31/89/326323189.db2.gz SXZGYHWABYMONB-UHFFFAOYSA-N 1 2 238.375 2.025 20 0 BEADLO CC[C@H]1CCC[C@H]1NC(=O)C[NH+]1CC(C)(C)C1 ZINC000568197179 326324882 /nfs/dbraw/zinc/32/48/82/326324882.db2.gz YOARZUGXQQYAOY-NWDGAFQWSA-N 1 2 238.375 2.023 20 0 BEADLO CCC1(CC)CN(C(=O)[C@H](C)Cc2c[nH+]c[nH]2)C1 ZINC000568213764 326326948 /nfs/dbraw/zinc/32/69/48/326326948.db2.gz HHVYJNIMEKKZAJ-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO CCC1(CC)CN(C(=O)[C@H](C)Cc2c[nH]c[nH+]2)C1 ZINC000568213764 326326950 /nfs/dbraw/zinc/32/69/50/326326950.db2.gz HHVYJNIMEKKZAJ-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)NCCC(C)C ZINC000158620283 326333360 /nfs/dbraw/zinc/33/33/60/326333360.db2.gz VOJOKLSNVKQQAJ-AATRIKPKSA-N 1 2 235.331 2.079 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000568249925 326335191 /nfs/dbraw/zinc/33/51/91/326335191.db2.gz ZZAGBLFEXUFIOU-AXFHLTTASA-N 1 2 246.310 2.465 20 0 BEADLO CCc1ccc([C@@H](C)[NH2+]Cc2ncccn2)o1 ZINC000568276219 326340006 /nfs/dbraw/zinc/34/00/06/326340006.db2.gz ICGMVLBVFFIFPE-SNVBAGLBSA-N 1 2 231.299 2.483 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)CCC1CCOCC1 ZINC000568881438 326380967 /nfs/dbraw/zinc/38/09/67/326380967.db2.gz QXHYPXGIHYDKNM-UHFFFAOYSA-N 1 2 249.358 2.346 20 0 BEADLO Cc1cc(CNC(=O)N[C@@H]2CC23CC3)cc(C)[nH+]1 ZINC000569232857 326396506 /nfs/dbraw/zinc/39/65/06/326396506.db2.gz SLXBGEDSTBAEFD-GFCCVEGCSA-N 1 2 245.326 2.050 20 0 BEADLO C[C@H]([NH2+]Cc1cncs1)c1cscn1 ZINC000164654032 326415484 /nfs/dbraw/zinc/41/54/84/326415484.db2.gz YOARPFUOCDIMFW-ZETCQYMHSA-N 1 2 225.342 2.450 20 0 BEADLO CC(F)(F)C[NH2+]Cc1cnc(C2CC2)nc1 ZINC000572962363 326421279 /nfs/dbraw/zinc/42/12/79/326421279.db2.gz UVXQMALAEYBUSW-UHFFFAOYSA-N 1 2 227.258 2.099 20 0 BEADLO CC[C@H](C)[C@H]1CCCCN1C(=O)Cn1cc[nH+]c1 ZINC000573148814 326432139 /nfs/dbraw/zinc/43/21/39/326432139.db2.gz BEYMZNAKAFVLEY-QWHCGFSZSA-N 1 2 249.358 2.310 20 0 BEADLO CC(C)CCC[N@@H+]1C[C@H](O)CC(F)(F)C1 ZINC000682559341 487979952 /nfs/dbraw/zinc/97/99/52/487979952.db2.gz TZVMVGRTEKWYDX-SNVBAGLBSA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)CCC[N@H+]1C[C@H](O)CC(F)(F)C1 ZINC000682559341 487979956 /nfs/dbraw/zinc/97/99/56/487979956.db2.gz TZVMVGRTEKWYDX-SNVBAGLBSA-N 1 2 221.291 2.125 20 0 BEADLO CC/C=C\CC[N@@H+]1C[C@H](O)CC(F)(F)C1 ZINC000682546801 487985087 /nfs/dbraw/zinc/98/50/87/487985087.db2.gz OFSYFNGKIXIPTJ-UMBAGQNISA-N 1 2 219.275 2.045 20 0 BEADLO CC/C=C\CC[N@H+]1C[C@H](O)CC(F)(F)C1 ZINC000682546801 487985092 /nfs/dbraw/zinc/98/50/92/487985092.db2.gz OFSYFNGKIXIPTJ-UMBAGQNISA-N 1 2 219.275 2.045 20 0 BEADLO CCN1CC[N@H+]([C@@H](C)c2ccccn2)C[C@@H]1C ZINC000677191407 487994053 /nfs/dbraw/zinc/99/40/53/487994053.db2.gz BTUAPMJJHCQLBU-STQMWFEESA-N 1 2 233.359 2.169 20 0 BEADLO Cc1c([C@H](C)Nc2cc(C)[nH+]cn2)cnn1C ZINC000602541991 487995164 /nfs/dbraw/zinc/99/51/64/487995164.db2.gz ODEMLMRIDNYSTM-VIFPVBQESA-N 1 2 231.303 2.000 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)C1CCC(C2CC2)CC1 ZINC000668603608 487996212 /nfs/dbraw/zinc/99/62/12/487996212.db2.gz HLIVTZRXNHAYKD-UHFFFAOYSA-N 1 2 247.342 2.242 20 0 BEADLO CC(C)c1cccc(C(=O)NCc2[nH]cc[nH+]2)c1 ZINC000668604622 487998380 /nfs/dbraw/zinc/99/83/80/487998380.db2.gz RUJRUMHLCKQOGV-UHFFFAOYSA-N 1 2 243.310 2.463 20 0 BEADLO CO[C@@H](C)CNc1cc[nH+]c(C(C)(C)C)n1 ZINC000309665763 487999799 /nfs/dbraw/zinc/99/97/99/487999799.db2.gz TYSYJEDYVUJTGB-VIFPVBQESA-N 1 2 223.320 2.221 20 0 BEADLO Cc1cc(N[C@H](CO)CC2CC2)nc(C2CC2)[nH+]1 ZINC000677237587 488002291 /nfs/dbraw/zinc/00/22/91/488002291.db2.gz XUBGVVWLAPPKQI-LBPRGKRZSA-N 1 2 247.342 2.235 20 0 BEADLO CCCC[N@H+](C)Cc1nnc(CC)s1 ZINC000680045998 488006717 /nfs/dbraw/zinc/00/67/17/488006717.db2.gz FRIXAEYFSVZXGM-UHFFFAOYSA-N 1 2 213.350 2.332 20 0 BEADLO CCCC[N@@H+](C)Cc1nnc(CC)s1 ZINC000680045998 488006721 /nfs/dbraw/zinc/00/67/21/488006721.db2.gz FRIXAEYFSVZXGM-UHFFFAOYSA-N 1 2 213.350 2.332 20 0 BEADLO CC1(NC(=O)Nc2ccc3[nH+]ccn3c2)CCC1 ZINC000677264617 488007137 /nfs/dbraw/zinc/00/71/37/488007137.db2.gz LXCBWCRTTDOHDA-UHFFFAOYSA-N 1 2 244.298 2.398 20 0 BEADLO Cc1ncc(C[N@@H+]2CCc3sccc3C2)n1C ZINC000667492990 488025866 /nfs/dbraw/zinc/02/58/66/488025866.db2.gz DGHUSXRQUANAJX-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1ncc(C[N@H+]2CCc3sccc3C2)n1C ZINC000667492990 488025871 /nfs/dbraw/zinc/02/58/71/488025871.db2.gz DGHUSXRQUANAJX-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1cc(NC(=O)[C@@H](C)Cc2ccco2)cc[nH+]1 ZINC000668635670 488035076 /nfs/dbraw/zinc/03/50/76/488035076.db2.gz NIHUXDCUESKQKY-JTQLQIEISA-N 1 2 244.294 2.222 20 0 BEADLO CC[C@@H](C)CC(=O)N1CC(Oc2cc[nH+]cc2)C1 ZINC000682890718 488061257 /nfs/dbraw/zinc/06/12/57/488061257.db2.gz LUIRKOQVBUNZRM-LLVKDONJSA-N 1 2 248.326 2.107 20 0 BEADLO CC[C@@H](C)CC(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000682891571 488061662 /nfs/dbraw/zinc/06/16/62/488061662.db2.gz ITLRIPZPRHOWDK-CHWSQXEVSA-N 1 2 249.358 2.483 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1CSC1(C)C ZINC000656185472 488062812 /nfs/dbraw/zinc/06/28/12/488062812.db2.gz CYESATOGTOKQJO-MRVPVSSYSA-N 1 2 239.344 2.100 20 0 BEADLO CCn1ccc(CN(C)c2cc[nH+]c(C)n2)c1 ZINC000682919986 488064023 /nfs/dbraw/zinc/06/40/23/488064023.db2.gz RICVGEIQJFNGSL-UHFFFAOYSA-N 1 2 230.315 2.243 20 0 BEADLO CC(C)CCN(C)C(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000666183676 488072085 /nfs/dbraw/zinc/07/20/85/488072085.db2.gz UPJIURRMWFBTRL-NSHDSACASA-N 1 2 249.358 2.019 20 0 BEADLO CC(C)CCN(C)C(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000666183676 488072088 /nfs/dbraw/zinc/07/20/88/488072088.db2.gz UPJIURRMWFBTRL-NSHDSACASA-N 1 2 249.358 2.019 20 0 BEADLO CCCn1nccc1C[N@@H+]1CCOCC12CCC2 ZINC000667651674 488074597 /nfs/dbraw/zinc/07/45/97/488074597.db2.gz DLCJVBVLUJPAAN-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CCCn1nccc1C[N@H+]1CCOCC12CCC2 ZINC000667651674 488074599 /nfs/dbraw/zinc/07/45/99/488074599.db2.gz DLCJVBVLUJPAAN-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CCn1ccc(CN(C)Cc2[nH+]ccn2CC)c1 ZINC000682999362 488083391 /nfs/dbraw/zinc/08/33/91/488083391.db2.gz IXVKIKMZPQOFJL-UHFFFAOYSA-N 1 2 246.358 2.356 20 0 BEADLO CCn1ccc(C[N@H+](C)Cc2nccn2CC)c1 ZINC000682999362 488083382 /nfs/dbraw/zinc/08/33/82/488083382.db2.gz IXVKIKMZPQOFJL-UHFFFAOYSA-N 1 2 246.358 2.356 20 0 BEADLO CCn1ccc(C[N@@H+](C)Cc2nccn2CC)c1 ZINC000682999362 488083387 /nfs/dbraw/zinc/08/33/87/488083387.db2.gz IXVKIKMZPQOFJL-UHFFFAOYSA-N 1 2 246.358 2.356 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cc(C)ccn2)CCO1 ZINC000683003307 488085455 /nfs/dbraw/zinc/08/54/55/488085455.db2.gz OWDJLRAOZXKBNS-ZDUSSCGKSA-N 1 2 220.316 2.001 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cc(C)ccn2)CCO1 ZINC000683003307 488085459 /nfs/dbraw/zinc/08/54/59/488085459.db2.gz OWDJLRAOZXKBNS-ZDUSSCGKSA-N 1 2 220.316 2.001 20 0 BEADLO Cc1ccnc(C[NH+](C)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC000683010619 488090668 /nfs/dbraw/zinc/09/06/68/488090668.db2.gz CIFDNNGOQCENOW-ZFWWWQNUSA-N 1 2 247.386 2.305 20 0 BEADLO Cc1ccnc(C[NH+](C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC000683010619 488090672 /nfs/dbraw/zinc/09/06/72/488090672.db2.gz CIFDNNGOQCENOW-ZFWWWQNUSA-N 1 2 247.386 2.305 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2cc(C)ccn2)s1 ZINC000683023436 488097435 /nfs/dbraw/zinc/09/74/35/488097435.db2.gz SKJSFYGXAWFUJN-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO Cn1ccnc1C[NH+]1CC(Cc2ccccc2)C1 ZINC000677716385 488099208 /nfs/dbraw/zinc/09/92/08/488099208.db2.gz CAERAOJJWDDJHZ-UHFFFAOYSA-N 1 2 241.338 2.095 20 0 BEADLO CCn1ccc(C[N@H+](C)[C@@H](C)c2nc(C)no2)c1 ZINC000683029821 488100793 /nfs/dbraw/zinc/10/07/93/488100793.db2.gz RTMPHWUQVDBNFA-JTQLQIEISA-N 1 2 248.330 2.392 20 0 BEADLO CCn1ccc(C[N@@H+](C)[C@@H](C)c2nc(C)no2)c1 ZINC000683029821 488100797 /nfs/dbraw/zinc/10/07/97/488100797.db2.gz RTMPHWUQVDBNFA-JTQLQIEISA-N 1 2 248.330 2.392 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2ccc(C)c(F)c2)o1 ZINC000683045999 488104221 /nfs/dbraw/zinc/10/42/21/488104221.db2.gz CYYPWIQMSYMINP-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2ccc(C)c(F)c2)o1 ZINC000683045999 488104225 /nfs/dbraw/zinc/10/42/25/488104225.db2.gz CYYPWIQMSYMINP-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO CCC[C@H]1CCC[C@@H]1C(=O)NCc1c[nH+]cn1C ZINC000296147421 487536618 /nfs/dbraw/zinc/53/66/18/487536618.db2.gz SECBVVHMEDIOOG-AAEUAGOBSA-N 1 2 249.358 2.253 20 0 BEADLO FC(F)[C@@H]1CC[N@H+](Cc2nc(C3CC3)no2)C1 ZINC000677734599 488112596 /nfs/dbraw/zinc/11/25/96/488112596.db2.gz XUNHLSQSNLBABE-MRVPVSSYSA-N 1 2 243.257 2.034 20 0 BEADLO FC(F)[C@@H]1CC[N@@H+](Cc2nc(C3CC3)no2)C1 ZINC000677734599 488112601 /nfs/dbraw/zinc/11/26/01/488112601.db2.gz XUNHLSQSNLBABE-MRVPVSSYSA-N 1 2 243.257 2.034 20 0 BEADLO Cc1noc([C@H](C)[N@H+](C)Cc2ccc(O)cc2)n1 ZINC000674284744 487545480 /nfs/dbraw/zinc/54/54/80/487545480.db2.gz ZDNOUHVKYUJZHY-VIFPVBQESA-N 1 2 247.298 2.277 20 0 BEADLO Cc1noc([C@H](C)[N@@H+](C)Cc2ccc(O)cc2)n1 ZINC000674284744 487545484 /nfs/dbraw/zinc/54/54/84/487545484.db2.gz ZDNOUHVKYUJZHY-VIFPVBQESA-N 1 2 247.298 2.277 20 0 BEADLO Cc1noc([C@@H](C)[N@H+](C)Cc2ccc(O)cc2)n1 ZINC000674284743 487545908 /nfs/dbraw/zinc/54/59/08/487545908.db2.gz ZDNOUHVKYUJZHY-SECBINFHSA-N 1 2 247.298 2.277 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+](C)Cc2ccc(O)cc2)n1 ZINC000674284743 487545915 /nfs/dbraw/zinc/54/59/15/487545915.db2.gz ZDNOUHVKYUJZHY-SECBINFHSA-N 1 2 247.298 2.277 20 0 BEADLO CCC[C@@H](C)C[N@H+](C)Cc1noc(C)n1 ZINC000668796470 487551091 /nfs/dbraw/zinc/55/10/91/487551091.db2.gz VIMGHGZSFZBCJW-SECBINFHSA-N 1 2 211.309 2.246 20 0 BEADLO CCC[C@@H](C)C[N@@H+](C)Cc1noc(C)n1 ZINC000668796470 487551093 /nfs/dbraw/zinc/55/10/93/487551093.db2.gz VIMGHGZSFZBCJW-SECBINFHSA-N 1 2 211.309 2.246 20 0 BEADLO CC(C)c1cnc(C[N@H+](C)C2(CO)CC2)s1 ZINC000668799124 487556886 /nfs/dbraw/zinc/55/68/86/487556886.db2.gz VOLRMKLCYACUIL-UHFFFAOYSA-N 1 2 240.372 2.223 20 0 BEADLO CC(C)c1cnc(C[N@@H+](C)C2(CO)CC2)s1 ZINC000668799124 487556891 /nfs/dbraw/zinc/55/68/91/487556891.db2.gz VOLRMKLCYACUIL-UHFFFAOYSA-N 1 2 240.372 2.223 20 0 BEADLO C[C@@H]([NH2+]Cc1csnn1)c1ccsc1 ZINC000061361398 487472157 /nfs/dbraw/zinc/47/21/57/487472157.db2.gz ZKARZMFZNAJVDJ-SSDOTTSWSA-N 1 2 225.342 2.450 20 0 BEADLO C[C@H](C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1)C1CC1 ZINC000673906247 487474786 /nfs/dbraw/zinc/47/47/86/487474786.db2.gz MXDYREGQAIYNBZ-WCQYABFASA-N 1 2 247.342 2.093 20 0 BEADLO Cc1cn2c([nH+]1)CN([C@@H](C)c1ccccn1)CC2 ZINC000679867520 487477271 /nfs/dbraw/zinc/47/72/71/487477271.db2.gz GHJJTYILIAWUCR-LBPRGKRZSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1cc(C[N@@H+]2CCOCC2(C)C)sn1 ZINC000682673773 487484369 /nfs/dbraw/zinc/48/43/69/487484369.db2.gz UHRRFNIQKKNLMI-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1cc(C[N@H+]2CCOCC2(C)C)sn1 ZINC000682673773 487484374 /nfs/dbraw/zinc/48/43/74/487484374.db2.gz UHRRFNIQKKNLMI-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO Fc1cccc([C@@H]2CCN2Cc2[nH]cc[nH+]2)c1 ZINC000674013051 487499460 /nfs/dbraw/zinc/49/94/60/487499460.db2.gz JPDOYNLIUUHXTJ-LBPRGKRZSA-N 1 2 231.274 2.496 20 0 BEADLO CC[C@](C)(O)CNc1cc[nH+]c(C(C)(C)C)n1 ZINC000674063632 487506258 /nfs/dbraw/zinc/50/62/58/487506258.db2.gz BIROWFJBNVTKQH-ZDUSSCGKSA-N 1 2 237.347 2.347 20 0 BEADLO CC(C)(C)c1nccc(NCCn2cc[nH+]c2)n1 ZINC000674062421 487506263 /nfs/dbraw/zinc/50/62/63/487506263.db2.gz QTRHBVCMFBVGDP-UHFFFAOYSA-N 1 2 245.330 2.083 20 0 BEADLO CCc1noc(C[NH2+][C@@H](C)c2cnccc2C)n1 ZINC000679942007 487499569 /nfs/dbraw/zinc/49/95/69/487499569.db2.gz JSDIGUZDDGRZIH-JTQLQIEISA-N 1 2 246.314 2.186 20 0 BEADLO CC[C@@](C)(O)CNc1cc[nH+]c(C(C)(C)C)n1 ZINC000674063625 487506407 /nfs/dbraw/zinc/50/64/07/487506407.db2.gz BIROWFJBNVTKQH-CYBMUJFWSA-N 1 2 237.347 2.347 20 0 BEADLO C[C@H](C(=O)N(C)Cc1[nH]cc[nH+]1)C1CCCC1 ZINC000674089419 487516872 /nfs/dbraw/zinc/51/68/72/487516872.db2.gz FIPREPNNBZKMHZ-JTQLQIEISA-N 1 2 235.331 2.194 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](Cc1cn[nH]c1)CCO2 ZINC000685443091 487523734 /nfs/dbraw/zinc/52/37/34/487523734.db2.gz SIBWUDHFDJNFMB-UHFFFAOYSA-N 1 2 243.310 2.113 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](Cc1cn[nH]c1)CCO2 ZINC000685443091 487523740 /nfs/dbraw/zinc/52/37/40/487523740.db2.gz SIBWUDHFDJNFMB-UHFFFAOYSA-N 1 2 243.310 2.113 20 0 BEADLO CCc1nnc(C[N@@H+]2CCS[C@H](C)C2)s1 ZINC000680050127 487527281 /nfs/dbraw/zinc/52/72/81/487527281.db2.gz OGNOXRGMUQKVAO-MRVPVSSYSA-N 1 2 243.401 2.038 20 0 BEADLO CCc1nnc(C[N@H+]2CCS[C@H](C)C2)s1 ZINC000680050127 487527285 /nfs/dbraw/zinc/52/72/85/487527285.db2.gz OGNOXRGMUQKVAO-MRVPVSSYSA-N 1 2 243.401 2.038 20 0 BEADLO CCCOC(=O)C[NH2+][C@@H](C)CCC(C)C ZINC001256361233 970763440 /nfs/dbraw/zinc/76/34/40/970763440.db2.gz PJCRJQKCCJQATM-NSHDSACASA-N 1 2 215.337 2.354 20 0 BEADLO Cc1[nH+]cccc1Cn1cc(-n2cccc2)cn1 ZINC000685579978 487557356 /nfs/dbraw/zinc/55/73/56/487557356.db2.gz OGNGOFYLDBOVMI-UHFFFAOYSA-N 1 2 238.294 2.426 20 0 BEADLO c1cc(COc2ccccc2-n2cc[nH+]c2)on1 ZINC000674345456 487562581 /nfs/dbraw/zinc/56/25/81/487562581.db2.gz CBFNAFJXQYTAQQ-UHFFFAOYSA-N 1 2 241.250 2.439 20 0 BEADLO c1cn(-c2ccc(NCc3cn[nH]c3)cc2)c[nH+]1 ZINC000676314645 487835690 /nfs/dbraw/zinc/83/56/90/487835690.db2.gz IOHBRPLLNXMFTE-UHFFFAOYSA-N 1 2 239.282 2.208 20 0 BEADLO O=C(Nc1ccccc1)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000034385183 487968697 /nfs/dbraw/zinc/96/86/97/487968697.db2.gz WORGAZLRXIPDKZ-SNVBAGLBSA-N 1 2 241.294 2.153 20 0 BEADLO O=C(Nc1ccccc1)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000034385183 487968700 /nfs/dbraw/zinc/96/87/00/487968700.db2.gz WORGAZLRXIPDKZ-SNVBAGLBSA-N 1 2 241.294 2.153 20 0 BEADLO Cn1c2ccccc2[nH+]c1N[C@H](CO)CC1CC1 ZINC000677811028 488128905 /nfs/dbraw/zinc/12/89/05/488128905.db2.gz VWYFOVNTDJAQMI-NSHDSACASA-N 1 2 245.326 2.146 20 0 BEADLO Cc1cn2cc(NC(=O)CCCF)ccc2[nH+]1 ZINC000667861291 488140713 /nfs/dbraw/zinc/14/07/13/488140713.db2.gz MWVIICAEGOCCES-UHFFFAOYSA-N 1 2 235.262 2.331 20 0 BEADLO CC1(C)CCC[C@H]1CNC(=O)CCc1c[nH+]c[nH]1 ZINC000294305730 488147824 /nfs/dbraw/zinc/14/78/24/488147824.db2.gz XGFLMRNPTYLNSQ-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO CC1(C)CCC[C@H]1CNC(=O)CCc1c[nH]c[nH+]1 ZINC000294305730 488147829 /nfs/dbraw/zinc/14/78/29/488147829.db2.gz XGFLMRNPTYLNSQ-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO CC[N@H+](Cc1ccccn1)[C@@H](C)c1nc(C)no1 ZINC000677892945 488150858 /nfs/dbraw/zinc/15/08/58/488150858.db2.gz ZVRQTKDNWPAAEN-JTQLQIEISA-N 1 2 246.314 2.356 20 0 BEADLO CC[N@@H+](Cc1ccccn1)[C@@H](C)c1nc(C)no1 ZINC000677892945 488150864 /nfs/dbraw/zinc/15/08/64/488150864.db2.gz ZVRQTKDNWPAAEN-JTQLQIEISA-N 1 2 246.314 2.356 20 0 BEADLO CCc1cc(N[C@H]2CSC2(C)C)nc[nH+]1 ZINC000379972011 488163401 /nfs/dbraw/zinc/16/34/01/488163401.db2.gz BRDMPWIRMKKSDF-VIFPVBQESA-N 1 2 223.345 2.345 20 0 BEADLO Cn1ccc(C[N@H+](C)Cc2ccsc2)n1 ZINC000677951233 488164535 /nfs/dbraw/zinc/16/45/35/488164535.db2.gz KCUHJHFPZBZIES-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO Cn1ccc(C[N@@H+](C)Cc2ccsc2)n1 ZINC000677951233 488164540 /nfs/dbraw/zinc/16/45/40/488164540.db2.gz KCUHJHFPZBZIES-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO Cc1nc(C)c(CN(C)Cc2[nH]cc[nH+]2)s1 ZINC000677950438 488164812 /nfs/dbraw/zinc/16/48/12/488164812.db2.gz RPFFXYSASXPRBX-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO CC(C)(C)C(C)(C)C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627372173 488182516 /nfs/dbraw/zinc/18/25/16/488182516.db2.gz FGESKDIBDRGUHV-UHFFFAOYSA-N 1 2 249.358 2.367 20 0 BEADLO CC(C)(C)C(C)(C)C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627372173 488182519 /nfs/dbraw/zinc/18/25/19/488182519.db2.gz FGESKDIBDRGUHV-UHFFFAOYSA-N 1 2 249.358 2.367 20 0 BEADLO Cc1nc(C(=O)Nc2cc[nH+]cc2C)sc1C ZINC000683547941 488192204 /nfs/dbraw/zinc/19/22/04/488192204.db2.gz JUDAYMOUFHQMNH-UHFFFAOYSA-N 1 2 247.323 2.138 20 0 BEADLO Cc1cc(NC(=O)N(C)[C@H](C)C2CC2)c(C)c[nH+]1 ZINC000678099039 488198284 /nfs/dbraw/zinc/19/82/84/488198284.db2.gz VPMSCXFHNLXWLT-LLVKDONJSA-N 1 2 247.342 2.383 20 0 BEADLO Cc1cc(NC(=O)N(C)[C@@H](C)C2CC2)c(C)c[nH+]1 ZINC000678099040 488198395 /nfs/dbraw/zinc/19/83/95/488198395.db2.gz VPMSCXFHNLXWLT-NSHDSACASA-N 1 2 247.342 2.383 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1CCC1(C)C ZINC000668745323 488204604 /nfs/dbraw/zinc/20/46/04/488204604.db2.gz DHWJUCKWYQDJHS-NSHDSACASA-N 1 2 232.327 2.441 20 0 BEADLO CC1(C[N@@H+]2CCO[C@@H](C(F)(F)F)C2)CCC1 ZINC000683700277 488209938 /nfs/dbraw/zinc/20/99/38/488209938.db2.gz VHNFQNOYVDYEKJ-SECBINFHSA-N 1 2 237.265 2.440 20 0 BEADLO CC1(C[N@H+]2CCO[C@@H](C(F)(F)F)C2)CCC1 ZINC000683700277 488209942 /nfs/dbraw/zinc/20/99/42/488209942.db2.gz VHNFQNOYVDYEKJ-SECBINFHSA-N 1 2 237.265 2.440 20 0 BEADLO COc1cc(C[NH2+]Cc2ccon2)ccc1C ZINC000683704051 488210739 /nfs/dbraw/zinc/21/07/39/488210739.db2.gz ONZXVOHWNVSFMS-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)[C@@H]1CCCC2(CC2)C1 ZINC000668194005 488219802 /nfs/dbraw/zinc/21/98/02/488219802.db2.gz WRZXIODSYLYQRH-LLVKDONJSA-N 1 2 247.342 2.007 20 0 BEADLO COc1ncccc1C[N@@H+]1CC[C@H](C)[C@H](F)C1 ZINC000683787070 488221929 /nfs/dbraw/zinc/22/19/29/488221929.db2.gz YRCQTKDOKQZTOZ-CMPLNLGQSA-N 1 2 238.306 2.270 20 0 BEADLO COc1ncccc1C[N@H+]1CC[C@H](C)[C@H](F)C1 ZINC000683787070 488221931 /nfs/dbraw/zinc/22/19/31/488221931.db2.gz YRCQTKDOKQZTOZ-CMPLNLGQSA-N 1 2 238.306 2.270 20 0 BEADLO CCN1CC[N@H+](Cc2ccc(C)o2)C[C@H]1C ZINC000678261732 488228806 /nfs/dbraw/zinc/22/88/06/488228806.db2.gz QCQBQHHWIILAKH-LLVKDONJSA-N 1 2 222.332 2.114 20 0 BEADLO CCN1CC[N@@H+](Cc2ccc(C)o2)C[C@H]1C ZINC000678261732 488228810 /nfs/dbraw/zinc/22/88/10/488228810.db2.gz QCQBQHHWIILAKH-LLVKDONJSA-N 1 2 222.332 2.114 20 0 BEADLO c1cc(C[N@@H+]2CCc3c[nH]nc3C2)cs1 ZINC000678275869 488235308 /nfs/dbraw/zinc/23/53/08/488235308.db2.gz IBYQXXGTOXMLDP-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO c1cc(C[N@H+]2CCc3c[nH]nc3C2)cs1 ZINC000678275869 488235310 /nfs/dbraw/zinc/23/53/10/488235310.db2.gz IBYQXXGTOXMLDP-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO Cn1cnc(C[N@H+](C)Cc2cccc(F)c2)c1 ZINC000683896936 488238883 /nfs/dbraw/zinc/23/88/83/488238883.db2.gz DWZGFSMYWMTJMM-UHFFFAOYSA-N 1 2 233.290 2.191 20 0 BEADLO Cn1cnc(C[N@@H+](C)Cc2cccc(F)c2)c1 ZINC000683896936 488238884 /nfs/dbraw/zinc/23/88/84/488238884.db2.gz DWZGFSMYWMTJMM-UHFFFAOYSA-N 1 2 233.290 2.191 20 0 BEADLO COc1ccccc1C[N@H+](C)Cc1cn(C)cn1 ZINC000683896965 488238968 /nfs/dbraw/zinc/23/89/68/488238968.db2.gz GCFFHWUCGCRXRW-UHFFFAOYSA-N 1 2 245.326 2.061 20 0 BEADLO COc1ccccc1C[N@@H+](C)Cc1cn(C)cn1 ZINC000683896965 488238970 /nfs/dbraw/zinc/23/89/70/488238970.db2.gz GCFFHWUCGCRXRW-UHFFFAOYSA-N 1 2 245.326 2.061 20 0 BEADLO COc1ccccc1CN(C)Cc1cn(C)c[nH+]1 ZINC000683896965 488238972 /nfs/dbraw/zinc/23/89/72/488238972.db2.gz GCFFHWUCGCRXRW-UHFFFAOYSA-N 1 2 245.326 2.061 20 0 BEADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1cn(C)cn1 ZINC000683899706 488241588 /nfs/dbraw/zinc/24/15/88/488241588.db2.gz IOSRTJRQXXEABT-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1cn(C)cn1 ZINC000683899706 488241592 /nfs/dbraw/zinc/24/15/92/488241592.db2.gz IOSRTJRQXXEABT-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO CCC(CC)CC(=O)N[C@H]1CCc2c[nH+]cn2C1 ZINC000672157962 488243298 /nfs/dbraw/zinc/24/32/98/488243298.db2.gz LNRYIOWDFHSOKL-LBPRGKRZSA-N 1 2 249.358 2.140 20 0 BEADLO CCCCNc1cc(N2CCC[C@H]2C)nc(N)[nH+]1 ZINC000672226700 488246524 /nfs/dbraw/zinc/24/65/24/488246524.db2.gz SXEIODVKTMRHTF-SNVBAGLBSA-N 1 2 249.362 2.260 20 0 BEADLO CCCCNc1cc(N2CCC[C@H]2C)[nH+]c(N)n1 ZINC000672226700 488246527 /nfs/dbraw/zinc/24/65/27/488246527.db2.gz SXEIODVKTMRHTF-SNVBAGLBSA-N 1 2 249.362 2.260 20 0 BEADLO CCC1(O)CCC(Nc2cc(C)[nH+]cn2)CC1 ZINC000678481792 488260091 /nfs/dbraw/zinc/26/00/91/488260091.db2.gz SEINHQCOZLPVEY-UHFFFAOYSA-N 1 2 235.331 2.281 20 0 BEADLO CC[C@H]1CC[C@H](C)N1C(=O)CCCn1cc[nH+]c1 ZINC000678485449 488260819 /nfs/dbraw/zinc/26/08/19/488260819.db2.gz DYUQPUWRBVQKFJ-STQMWFEESA-N 1 2 249.358 2.453 20 0 BEADLO FC(F)C[N@@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000678637155 488275443 /nfs/dbraw/zinc/27/54/43/488275443.db2.gz BOISTYOXHJAIOD-WDEREUQCSA-N 1 2 233.302 2.390 20 0 BEADLO FC(F)C[N@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000678637155 488275445 /nfs/dbraw/zinc/27/54/45/488275445.db2.gz BOISTYOXHJAIOD-WDEREUQCSA-N 1 2 233.302 2.390 20 0 BEADLO CCc1cc(NC[C@@H]2CCC[C@H]2OC)nc[nH+]1 ZINC000678720938 488278496 /nfs/dbraw/zinc/27/84/96/488278496.db2.gz SKDYYPUQLZETCR-CMPLNLGQSA-N 1 2 235.331 2.266 20 0 BEADLO CC(C)c1cc(C[NH2+][C@H](C)c2nccn2C)on1 ZINC000678771235 488281748 /nfs/dbraw/zinc/28/17/48/488281748.db2.gz LUAZZSCJLNXHHU-SNVBAGLBSA-N 1 2 248.330 2.382 20 0 BEADLO CC(C)c1cc(CN[C@H](C)c2[nH+]ccn2C)on1 ZINC000678771235 488281749 /nfs/dbraw/zinc/28/17/49/488281749.db2.gz LUAZZSCJLNXHHU-SNVBAGLBSA-N 1 2 248.330 2.382 20 0 BEADLO Fc1cnccc1N1CCC(n2cc[nH+]c2)CC1 ZINC000678787281 488282899 /nfs/dbraw/zinc/28/28/99/488282899.db2.gz HDYRKSYGBHKANL-UHFFFAOYSA-N 1 2 246.289 2.259 20 0 BEADLO c1ccc(-c2nc(C[N@H+]3CC=CCC3)no2)cc1 ZINC000679321398 488336103 /nfs/dbraw/zinc/33/61/03/488336103.db2.gz AVSHXHOOPHIGBR-UHFFFAOYSA-N 1 2 241.294 2.499 20 0 BEADLO c1ccc(-c2nc(C[N@@H+]3CC=CCC3)no2)cc1 ZINC000679321398 488336105 /nfs/dbraw/zinc/33/61/05/488336105.db2.gz AVSHXHOOPHIGBR-UHFFFAOYSA-N 1 2 241.294 2.499 20 0 BEADLO Cc1cc(C(=O)C[N@H+]2CC=CCC2)c(C)n1C ZINC000679322860 488336426 /nfs/dbraw/zinc/33/64/26/488336426.db2.gz PEIVLFAAMXMKIZ-UHFFFAOYSA-N 1 2 232.327 2.087 20 0 BEADLO Cc1cc(C(=O)C[N@@H+]2CC=CCC2)c(C)n1C ZINC000679322860 488336427 /nfs/dbraw/zinc/33/64/27/488336427.db2.gz PEIVLFAAMXMKIZ-UHFFFAOYSA-N 1 2 232.327 2.087 20 0 BEADLO CC[C@H](Nc1ccc(OC)c[nH+]1)c1cnn(C)c1 ZINC000679068591 488305243 /nfs/dbraw/zinc/30/52/43/488305243.db2.gz JFAVYRDGOZXOSM-LBPRGKRZSA-N 1 2 246.314 2.387 20 0 BEADLO COc1ccc(N[C@H](C)c2cn(C)nc2C)[nH+]c1 ZINC000679069185 488305302 /nfs/dbraw/zinc/30/53/02/488305302.db2.gz ZNGVIGMWQKWCLH-SECBINFHSA-N 1 2 246.314 2.305 20 0 BEADLO CC[C@H](Nc1ccc(OC)cn1)c1[nH+]ccn1C ZINC000679068939 488305568 /nfs/dbraw/zinc/30/55/68/488305568.db2.gz UFRQWBNWXZPYRX-NSHDSACASA-N 1 2 246.314 2.387 20 0 BEADLO COc1ccc[nH+]c1N[C@@H](C)C[C@@H]1CCOC1 ZINC000679092322 488308667 /nfs/dbraw/zinc/30/86/67/488308667.db2.gz ZKIWHZWYSPHBLS-QWRGUYRKSA-N 1 2 236.315 2.317 20 0 BEADLO CCc1cc(N(C)C[C@H]2CCCC[C@@H]2O)nc[nH+]1 ZINC000679197819 488316298 /nfs/dbraw/zinc/31/62/98/488316298.db2.gz UPNFWIGRFSGCNV-YPMHNXCESA-N 1 2 249.358 2.026 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)nc1 ZINC000679219431 488317377 /nfs/dbraw/zinc/31/73/77/488317377.db2.gz FUTMRZXIZQBTEB-GXFFZTMASA-N 1 2 238.306 2.270 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@H](C)[C@H](F)C2)nc1 ZINC000679219431 488317380 /nfs/dbraw/zinc/31/73/80/488317380.db2.gz FUTMRZXIZQBTEB-GXFFZTMASA-N 1 2 238.306 2.270 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)nc1 ZINC000679219435 488317551 /nfs/dbraw/zinc/31/75/51/488317551.db2.gz FUTMRZXIZQBTEB-ZWNOBZJWSA-N 1 2 238.306 2.270 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)nc1 ZINC000679219435 488317553 /nfs/dbraw/zinc/31/75/53/488317553.db2.gz FUTMRZXIZQBTEB-ZWNOBZJWSA-N 1 2 238.306 2.270 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nccs2)C[C@@H]1F ZINC000679218162 488318252 /nfs/dbraw/zinc/31/82/52/488318252.db2.gz CEZJPICTZSJVNM-BDAKNGLRSA-N 1 2 214.309 2.323 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nccs2)C[C@@H]1F ZINC000679218162 488318253 /nfs/dbraw/zinc/31/82/53/488318253.db2.gz CEZJPICTZSJVNM-BDAKNGLRSA-N 1 2 214.309 2.323 20 0 BEADLO CCc1noc(C[N@H+]2CC(C)=C[C@@H](C)C2)n1 ZINC000684669351 488337471 /nfs/dbraw/zinc/33/74/71/488337471.db2.gz CFVGUVYCPNPKQZ-SECBINFHSA-N 1 2 221.304 2.030 20 0 BEADLO CCc1noc(C[N@@H+]2CC(C)=C[C@@H](C)C2)n1 ZINC000684669351 488337472 /nfs/dbraw/zinc/33/74/72/488337472.db2.gz CFVGUVYCPNPKQZ-SECBINFHSA-N 1 2 221.304 2.030 20 0 BEADLO COCc1nc(C[N@H+]2CC=CCC2)cs1 ZINC000679324192 488337601 /nfs/dbraw/zinc/33/76/01/488337601.db2.gz OAMTWDKEQOEIGC-UHFFFAOYSA-N 1 2 224.329 2.051 20 0 BEADLO COCc1nc(C[N@@H+]2CC=CCC2)cs1 ZINC000679324192 488337604 /nfs/dbraw/zinc/33/76/04/488337604.db2.gz OAMTWDKEQOEIGC-UHFFFAOYSA-N 1 2 224.329 2.051 20 0 BEADLO CC1=C[C@H](C)CN(C(=O)CCCn2cc[nH+]c2)C1 ZINC000684709266 488339225 /nfs/dbraw/zinc/33/92/25/488339225.db2.gz MJZQYOUTMBJENL-LBPRGKRZSA-N 1 2 247.342 2.088 20 0 BEADLO CCCn1cc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)cn1 ZINC000679361672 488346313 /nfs/dbraw/zinc/34/63/13/488346313.db2.gz UNTJBHALMMJYOQ-WCQYABFASA-N 1 2 239.338 2.473 20 0 BEADLO CCCn1cc(C[N@H+]2CC[C@H](C)[C@H](F)C2)cn1 ZINC000679361672 488346315 /nfs/dbraw/zinc/34/63/15/488346315.db2.gz UNTJBHALMMJYOQ-WCQYABFASA-N 1 2 239.338 2.473 20 0 BEADLO CCCCNc1cc(N2CCCCC2)nc(N)[nH+]1 ZINC000684838707 488348311 /nfs/dbraw/zinc/34/83/11/488348311.db2.gz TZCQVDZHGWAUSZ-UHFFFAOYSA-N 1 2 249.362 2.261 20 0 BEADLO CCCCNc1cc(N2CCCCC2)[nH+]c(N)n1 ZINC000684838707 488348314 /nfs/dbraw/zinc/34/83/14/488348314.db2.gz TZCQVDZHGWAUSZ-UHFFFAOYSA-N 1 2 249.362 2.261 20 0 BEADLO Cc1nc(N2CC=CCC2)c2c([nH+]1)CCCC2 ZINC000679839251 488368036 /nfs/dbraw/zinc/36/80/36/488368036.db2.gz LCAUBTRRAYMTNG-UHFFFAOYSA-N 1 2 229.327 2.430 20 0 BEADLO c1ccc(NCCc2cnc(C3CC3)nc2)[nH+]c1 ZINC000533711491 490109137 /nfs/dbraw/zinc/10/91/37/490109137.db2.gz TUTXWIMGFHWJER-UHFFFAOYSA-N 1 2 240.310 2.404 20 0 BEADLO C[C@H]1CCCC[C@@]1(C)NC(=O)CCc1c[nH+]c[nH]1 ZINC000457293242 490117288 /nfs/dbraw/zinc/11/72/88/490117288.db2.gz PVNMDLRMNYAHJL-SMDDNHRTSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@H]1CCCC[C@@]1(C)NC(=O)CCc1c[nH]c[nH+]1 ZINC000457293242 490117292 /nfs/dbraw/zinc/11/72/92/490117292.db2.gz PVNMDLRMNYAHJL-SMDDNHRTSA-N 1 2 249.358 2.427 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H](C)OCC23CCC3)on1 ZINC000649822092 490205422 /nfs/dbraw/zinc/20/54/22/490205422.db2.gz YGDBWWOGUUYJMC-NSHDSACASA-N 1 2 236.315 2.126 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H](C)OCC23CCC3)on1 ZINC000649822092 490205428 /nfs/dbraw/zinc/20/54/28/490205428.db2.gz YGDBWWOGUUYJMC-NSHDSACASA-N 1 2 236.315 2.126 20 0 BEADLO CSCC(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000357699323 490293477 /nfs/dbraw/zinc/29/34/77/490293477.db2.gz XKZGZGIWKZYJOB-UHFFFAOYSA-N 1 2 247.323 2.174 20 0 BEADLO O=C(NCc1ccc(-c2c[nH]c[nH+]2)cc1)C1CC1 ZINC000633522523 490306146 /nfs/dbraw/zinc/30/61/46/490306146.db2.gz WTMSXELDXQPSMJ-UHFFFAOYSA-N 1 2 241.294 2.103 20 0 BEADLO CC(C)Cn1nccc1C[N@@H+]1CC[C@H](F)C1 ZINC000648040100 490407142 /nfs/dbraw/zinc/40/71/42/490407142.db2.gz BURIBASZRIXSBM-NSHDSACASA-N 1 2 225.311 2.083 20 0 BEADLO Cc1ccc(CSc2nc(N)cc(C)[nH+]2)cn1 ZINC000405576720 490464976 /nfs/dbraw/zinc/46/49/76/490464976.db2.gz FQEVVRQRRPIPJB-UHFFFAOYSA-N 1 2 246.339 2.193 20 0 BEADLO Fc1ccc2c(c1)C[N@@H+](Cc1cncnc1)CC2 ZINC000125889516 490469470 /nfs/dbraw/zinc/46/94/70/490469470.db2.gz MBGROVMXYKDQDU-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1ccc2c(c1)C[N@H+](Cc1cncnc1)CC2 ZINC000125889516 490469479 /nfs/dbraw/zinc/46/94/79/490469479.db2.gz MBGROVMXYKDQDU-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Cc1cccc(NC(=O)CCc2c[nH+]c[nH]2)c1 ZINC000074727056 490500937 /nfs/dbraw/zinc/50/09/37/490500937.db2.gz RHQZXFUQTPFVKS-UHFFFAOYSA-N 1 2 229.283 2.289 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NC1CCCCCC1 ZINC000074727012 490500854 /nfs/dbraw/zinc/50/08/54/490500854.db2.gz AESRDANIWAAMKS-UHFFFAOYSA-N 1 2 235.331 2.181 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NC1CCCCCC1 ZINC000074727012 490500859 /nfs/dbraw/zinc/50/08/59/490500859.db2.gz AESRDANIWAAMKS-UHFFFAOYSA-N 1 2 235.331 2.181 20 0 BEADLO Cc1cccc(NC(=O)CCc2c[nH]c[nH+]2)c1 ZINC000074727056 490500942 /nfs/dbraw/zinc/50/09/42/490500942.db2.gz RHQZXFUQTPFVKS-UHFFFAOYSA-N 1 2 229.283 2.289 20 0 BEADLO CCN(C(=O)CCc1c[nH+]c[nH]1)c1ccccc1 ZINC000074727090 490501564 /nfs/dbraw/zinc/50/15/64/490501564.db2.gz MHCPHXOKOBVYOZ-UHFFFAOYSA-N 1 2 243.310 2.395 20 0 BEADLO CCN(C(=O)CCc1c[nH]c[nH+]1)c1ccccc1 ZINC000074727090 490501572 /nfs/dbraw/zinc/50/15/72/490501572.db2.gz MHCPHXOKOBVYOZ-UHFFFAOYSA-N 1 2 243.310 2.395 20 0 BEADLO CN(C)c1nc(C[NH2+]Cc2ccco2)cs1 ZINC000080244855 490626777 /nfs/dbraw/zinc/62/67/77/490626777.db2.gz KUCFBPAHIMMOKC-UHFFFAOYSA-N 1 2 237.328 2.092 20 0 BEADLO Cc1cccc(NC(=O)N(C)Cc2[nH]cc[nH+]2)c1 ZINC000080526847 490641885 /nfs/dbraw/zinc/64/18/85/490641885.db2.gz DXEWUZWJGGTLBC-UHFFFAOYSA-N 1 2 244.298 2.382 20 0 BEADLO Cc1cnc(C[NH2+]Cc2ccc(F)cc2)o1 ZINC000227084424 491054744 /nfs/dbraw/zinc/05/47/44/491054744.db2.gz WOUOAWUTCFMSSS-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO C[C@H](NC(=O)/C=C/c1[nH]cc[nH+]1)C1CCCC1 ZINC000493184602 491070706 /nfs/dbraw/zinc/07/07/06/491070706.db2.gz GQUHTMIBQWOWDT-FGEFZZPRSA-N 1 2 233.315 2.118 20 0 BEADLO CS[C@@H](C)C(=O)Nc1c[nH+]c2c(C)cccn12 ZINC000598263445 491083814 /nfs/dbraw/zinc/08/38/14/491083814.db2.gz TURVPJBSFLRVDF-VIFPVBQESA-N 1 2 249.339 2.333 20 0 BEADLO FC1(F)C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cnc[nH]1 ZINC000625681559 491125596 /nfs/dbraw/zinc/12/55/96/491125596.db2.gz OJFNJBDKQQFWBN-AOOOYVTPSA-N 1 2 227.258 2.172 20 0 BEADLO FC1(F)C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cnc[nH]1 ZINC000625681559 491125597 /nfs/dbraw/zinc/12/55/97/491125597.db2.gz OJFNJBDKQQFWBN-AOOOYVTPSA-N 1 2 227.258 2.172 20 0 BEADLO Cc1nc2[nH]ccc2c(NC2CC(C)C2)[nH+]1 ZINC000081009535 491133825 /nfs/dbraw/zinc/13/38/25/491133825.db2.gz ATUVLZCYYLUFNZ-UHFFFAOYSA-N 1 2 216.288 2.477 20 0 BEADLO C[C@@H](CCCCO)[NH2+][C@@H](C1CC1)C(F)(F)F ZINC000309734651 491155322 /nfs/dbraw/zinc/15/53/22/491155322.db2.gz GCDCWUMHCCPFED-WPRPVWTQSA-N 1 2 239.281 2.468 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N(C(=O)/C=C\c2[nH]cc[nH+]2)C1 ZINC000493862504 533729488 /nfs/dbraw/zinc/72/94/88/533729488.db2.gz YKKDRZUYJUVWGB-UXFRKABBSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@@H]1CCC[C@@H](CNC(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492768697 533747348 /nfs/dbraw/zinc/74/73/48/533747348.db2.gz PEYNALOHNGWIEJ-GKKDLHFNSA-N 1 2 247.342 2.365 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)/C=C\C(C)(C)C)S1 ZINC000493240377 534004824 /nfs/dbraw/zinc/00/48/24/534004824.db2.gz OYOKMWQLQNVXHQ-SLGIHZDVSA-N 1 2 226.345 2.196 20 0 BEADLO C[C@H]1COC(C)(C)CN1c1cc[nH+]c(C2CC2)n1 ZINC000487043850 534021885 /nfs/dbraw/zinc/02/18/85/534021885.db2.gz IHBDCRIAJYQYMH-JTQLQIEISA-N 1 2 247.342 2.358 20 0 BEADLO CCc1cc(N(C)C(C)C)nc(CC)[nH+]1 ZINC000891714103 582712411 /nfs/dbraw/zinc/71/24/11/582712411.db2.gz RVVDBRSUHCGXEV-UHFFFAOYSA-N 1 2 207.321 2.446 20 0 BEADLO CC[C@]1(C)C[C@@H]1C(=O)NCc1c[nH+]ccc1OC ZINC000348266909 535932477 /nfs/dbraw/zinc/93/24/77/535932477.db2.gz CJOUBCUUCVWKND-BXUZGUMPSA-N 1 2 248.326 2.143 20 0 BEADLO C[C@@H]1CC[C@H](C)N(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492774522 534219814 /nfs/dbraw/zinc/21/98/14/534219814.db2.gz WVJGQZXQIQYKLD-MXFLAHGMSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@@H]1CN(C(=O)C=Cc2c[nH]c[nH+]2)C(C)(C)C1 ZINC000492761235 534276820 /nfs/dbraw/zinc/27/68/20/534276820.db2.gz FZVFEEMWYBHROB-LWTINBJPSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@@H](N(C)C(=O)/C=C/c1[nH]cc[nH+]1)C(C)(C)C ZINC000493509100 534280842 /nfs/dbraw/zinc/28/08/42/534280842.db2.gz AYSUOZUYMPPOJD-VQCYPWCPSA-N 1 2 235.331 2.316 20 0 BEADLO CCc1ccc(C[N@@H+]2CCOCC23CCC3)nc1 ZINC000336164238 536178028 /nfs/dbraw/zinc/17/80/28/536178028.db2.gz CDYFUEJMUYNMTC-UHFFFAOYSA-N 1 2 246.354 2.399 20 0 BEADLO CCc1ccc(C[N@H+]2CCOCC23CCC3)nc1 ZINC000336164238 536178032 /nfs/dbraw/zinc/17/80/32/536178032.db2.gz CDYFUEJMUYNMTC-UHFFFAOYSA-N 1 2 246.354 2.399 20 0 BEADLO Cc1ccsc1CNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492772598 534471803 /nfs/dbraw/zinc/47/18/03/534471803.db2.gz UDXQZOUUQCAAJX-NSCUHMNNSA-N 1 2 247.323 2.109 20 0 BEADLO CCc1cc(N2CC[C@H](C)C2)nc(CC)[nH+]1 ZINC000892254364 582814152 /nfs/dbraw/zinc/81/41/52/582814152.db2.gz LKBPJEIZZVLYOP-JTQLQIEISA-N 1 2 219.332 2.448 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@@H]1CCC(C)(C)C1 ZINC000781804546 582866246 /nfs/dbraw/zinc/86/62/46/582866246.db2.gz AABVJQVMCGRILF-SNVBAGLBSA-N 1 2 236.315 2.290 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)N1CC[C@@H](CC2CC2)C1 ZINC000493182585 534787276 /nfs/dbraw/zinc/78/72/76/534787276.db2.gz BPLASWVZELFJIL-PCAWENJQSA-N 1 2 245.326 2.072 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CCCCCCC1 ZINC000493306838 534800553 /nfs/dbraw/zinc/80/05/53/534800553.db2.gz SKFXXWTZOLYKHQ-SREVYHEPSA-N 1 2 233.315 2.216 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N[C@@H]1CC12CCCCC2 ZINC000492813640 534802261 /nfs/dbraw/zinc/80/22/61/534802261.db2.gz QDSRNUJFQHVIBX-QMAVJUDZSA-N 1 2 245.326 2.262 20 0 BEADLO CC(C)c1nc(N2CCOC3(CCC3)C2)cc[nH+]1 ZINC000125521767 534909733 /nfs/dbraw/zinc/90/97/33/534909733.db2.gz XVNVWAUSMITSDF-UHFFFAOYSA-N 1 2 247.342 2.359 20 0 BEADLO CC(C)c1nc(N2CC[C@H](F)C2)cc[nH+]1 ZINC000336189328 534909811 /nfs/dbraw/zinc/90/98/11/534909811.db2.gz PVJWUSHBAZLBCM-VIFPVBQESA-N 1 2 209.268 2.148 20 0 BEADLO CC(C)(C)[C@@H]1CCCN1C(=O)/C=C\c1[nH]cc[nH+]1 ZINC000493340979 526654463 /nfs/dbraw/zinc/65/44/63/526654463.db2.gz WACFISMTSNXVMI-ZADCQDASSA-N 1 2 247.342 2.460 20 0 BEADLO C/C=C/C=C/C(=O)Nc1c[nH+]c2n1CCCC2 ZINC000493431989 527587419 /nfs/dbraw/zinc/58/74/19/527587419.db2.gz LNXBVORKNPKZEL-CRBCFSCISA-N 1 2 231.299 2.290 20 0 BEADLO CC(C)(C)CCCNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492892962 527661373 /nfs/dbraw/zinc/66/13/73/527661373.db2.gz FTJNYDYLJLFJNA-AATRIKPKSA-N 1 2 235.331 2.365 20 0 BEADLO CCC1CCN(C(=O)/C=C/c2[nH]cc[nH+]2)CC1 ZINC000493263870 527862871 /nfs/dbraw/zinc/86/28/71/527862871.db2.gz VPXKJDMOWPZIFB-ONEGZZNKSA-N 1 2 233.315 2.072 20 0 BEADLO CCN(CC(C)(C)C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493300069 527941352 /nfs/dbraw/zinc/94/13/52/527941352.db2.gz HSTQXBNOGZPSTL-VOTSOKGWSA-N 1 2 235.331 2.318 20 0 BEADLO CCN(CC1CC1)C(=O)/C=C/c1[nH+]ccn1CC ZINC000492450632 528319724 /nfs/dbraw/zinc/31/97/24/528319724.db2.gz RVTZRZFLUQSPLL-BQYQJAHWSA-N 1 2 247.342 2.175 20 0 BEADLO CC(C)C[C@@H]1CCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493196957 528376936 /nfs/dbraw/zinc/37/69/36/528376936.db2.gz YCAYOPDEFXFKEQ-GFUIURDCSA-N 1 2 247.342 2.460 20 0 BEADLO CC(C)[C@@H](C)N(C(=O)C=Cc1c[nH]c[nH+]1)C1CC1 ZINC000492767660 528397003 /nfs/dbraw/zinc/39/70/03/528397003.db2.gz NUZQYCQTCBOVJT-MEQVVJDKSA-N 1 2 247.342 2.458 20 0 BEADLO CC(C)[C@@H]1CCCCN1C(=O)/C=C\c1[nH]cc[nH+]1 ZINC000493716538 528646734 /nfs/dbraw/zinc/64/67/34/528646734.db2.gz CMIWLMGSTPEGLH-DGMVEKRQSA-N 1 2 247.342 2.460 20 0 BEADLO CCC1(CC)CCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492760853 529043864 /nfs/dbraw/zinc/04/38/64/529043864.db2.gz DZONACKCCKLDQZ-WAYWQWQTSA-N 1 2 247.342 2.462 20 0 BEADLO CC1(C)CN(C(=O)C=Cc2c[nH]c[nH+]2)[C@@H]1C1CC1 ZINC000493773118 529061117 /nfs/dbraw/zinc/06/11/17/529061117.db2.gz WAMCCPIOCQMXRJ-CFHLNLSMSA-N 1 2 245.326 2.070 20 0 BEADLO CCC1(CNC(=O)C=Cc2c[nH]c[nH+]2)CCC1 ZINC000492815403 529118175 /nfs/dbraw/zinc/11/81/75/529118175.db2.gz WYPMGMCFEYKINP-PLNGDYQASA-N 1 2 233.315 2.119 20 0 BEADLO CC[C@H]1CCCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492771020 529196594 /nfs/dbraw/zinc/19/65/94/529196594.db2.gz HCCZJVJMCHTXJS-DGMVEKRQSA-N 1 2 233.315 2.214 20 0 BEADLO CC[C@@H]1CCC[C@@H]1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492763243 529308893 /nfs/dbraw/zinc/30/88/93/529308893.db2.gz IYNDCNVKCCJPRC-BTTAUDESSA-N 1 2 233.315 2.118 20 0 BEADLO CCOCC(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000078820419 535420930 /nfs/dbraw/zinc/42/09/30/535420930.db2.gz FQZGZNKYZCNZKV-UHFFFAOYSA-N 1 2 245.282 2.052 20 0 BEADLO CCC[C@@H]1C[C@@H]1C(=O)NCc1c[nH+]ccc1OC ZINC000348414418 535452457 /nfs/dbraw/zinc/45/24/57/535452457.db2.gz ROKMTZCOFBHCOR-PWSUYJOCSA-N 1 2 248.326 2.143 20 0 BEADLO CCOC(=O)[C@@H](c1ccccc1)[N@H+](C)CC ZINC000171923618 535500771 /nfs/dbraw/zinc/50/07/71/535500771.db2.gz KQJMTWACTVDMJN-GFCCVEGCSA-N 1 2 221.300 2.243 20 0 BEADLO CCOC(=O)[C@@H](c1ccccc1)[N@@H+](C)CC ZINC000171923618 535500776 /nfs/dbraw/zinc/50/07/76/535500776.db2.gz KQJMTWACTVDMJN-GFCCVEGCSA-N 1 2 221.300 2.243 20 0 BEADLO Cc1cncc([C@H](C)[NH2+]Cc2cocn2)c1 ZINC000393792991 582924751 /nfs/dbraw/zinc/92/47/51/582924751.db2.gz GKOFTSIVYMHLOI-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO CC[C@@H]([NH2+]Cc1cnc[nH]1)c1c(C)noc1C ZINC000179325905 535805107 /nfs/dbraw/zinc/80/51/07/535805107.db2.gz XNLWSVBEWANHES-LLVKDONJSA-N 1 2 234.303 2.255 20 0 BEADLO CC[C@@H](O)C[N@@H+]1CCn2c(cc3ccccc32)C1 ZINC000335930130 535813534 /nfs/dbraw/zinc/81/35/34/535813534.db2.gz ILEVTBONWDESDQ-CQSZACIVSA-N 1 2 244.338 2.228 20 0 BEADLO CC[C@@H](O)C[N@H+]1CCn2c(cc3ccccc32)C1 ZINC000335930130 535813535 /nfs/dbraw/zinc/81/35/35/535813535.db2.gz ILEVTBONWDESDQ-CQSZACIVSA-N 1 2 244.338 2.228 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1cnn(C(C)C)c1 ZINC000179814852 535835344 /nfs/dbraw/zinc/83/53/44/535835344.db2.gz JJFLVHUJYBZRPM-CYBMUJFWSA-N 1 2 237.347 2.075 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1cnn(C(C)C)c1 ZINC000179814852 535835347 /nfs/dbraw/zinc/83/53/47/535835347.db2.gz JJFLVHUJYBZRPM-CYBMUJFWSA-N 1 2 237.347 2.075 20 0 BEADLO CC[C@@H]1COCCN1c1cc(C)[nH+]c(C2CC2)n1 ZINC000341507695 535835622 /nfs/dbraw/zinc/83/56/22/535835622.db2.gz VPRZCNLIBHMZAO-GFCCVEGCSA-N 1 2 247.342 2.278 20 0 BEADLO CC[C@H](NCc1[nH+]ccn1C)c1nccs1 ZINC000070717151 535921920 /nfs/dbraw/zinc/92/19/20/535921920.db2.gz MMQKZOYEFHVDPM-VIFPVBQESA-N 1 2 236.344 2.118 20 0 BEADLO CC[C@H]([NH2+]Cc1nccn1C)c1nccs1 ZINC000070717151 535921925 /nfs/dbraw/zinc/92/19/25/535921925.db2.gz MMQKZOYEFHVDPM-VIFPVBQESA-N 1 2 236.344 2.118 20 0 BEADLO CCc1[nH]ccc1C(=O)Nc1c[nH+]ccc1OC ZINC000351966606 535996456 /nfs/dbraw/zinc/99/64/56/535996456.db2.gz ZYPYKPHVYXAIOF-UHFFFAOYSA-N 1 2 245.282 2.233 20 0 BEADLO CC[C@@]1(O)CC[N@H+](Cc2ncc(Cl)s2)C1 ZINC000336107346 536087465 /nfs/dbraw/zinc/08/74/65/536087465.db2.gz DEAJDSVDAAMJHL-SNVBAGLBSA-N 1 2 246.763 2.143 20 0 BEADLO CC[C@@]1(O)CC[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000336107346 536087468 /nfs/dbraw/zinc/08/74/68/536087468.db2.gz DEAJDSVDAAMJHL-SNVBAGLBSA-N 1 2 246.763 2.143 20 0 BEADLO CCc1ccc(C[N@@H+]2CCOC(C)(C)C2)nc1 ZINC000335930021 536177388 /nfs/dbraw/zinc/17/73/88/536177388.db2.gz CIAFXJCVIZHLSO-UHFFFAOYSA-N 1 2 234.343 2.255 20 0 BEADLO CCc1ccc(C[N@H+]2CCOC(C)(C)C2)nc1 ZINC000335930021 536177391 /nfs/dbraw/zinc/17/73/91/536177391.db2.gz CIAFXJCVIZHLSO-UHFFFAOYSA-N 1 2 234.343 2.255 20 0 BEADLO CCCC[C@@H](COC)Nc1cc(NC)[nH+]cn1 ZINC000892602875 582926095 /nfs/dbraw/zinc/92/60/95/582926095.db2.gz GQNQEPUYZQMOLO-JTQLQIEISA-N 1 2 238.335 2.135 20 0 BEADLO CCCC[C@@H](COC)Nc1cc(NC)nc[nH+]1 ZINC000892602875 582926097 /nfs/dbraw/zinc/92/60/97/582926097.db2.gz GQNQEPUYZQMOLO-JTQLQIEISA-N 1 2 238.335 2.135 20 0 BEADLO COC(=O)C(C)(C)[N@H+](C)Cc1ccccc1F ZINC000258769226 536427684 /nfs/dbraw/zinc/42/76/84/536427684.db2.gz KKHKOOKCQUKISP-UHFFFAOYSA-N 1 2 239.290 2.209 20 0 BEADLO COC(=O)C(C)(C)[N@@H+](C)Cc1ccccc1F ZINC000258769226 536427686 /nfs/dbraw/zinc/42/76/86/536427686.db2.gz KKHKOOKCQUKISP-UHFFFAOYSA-N 1 2 239.290 2.209 20 0 BEADLO COC(=O)C(C)(C)[N@H+](C)Cc1ccsc1C ZINC000351254757 536427778 /nfs/dbraw/zinc/42/77/78/536427778.db2.gz ASTKUYDBHVCAAW-UHFFFAOYSA-N 1 2 241.356 2.440 20 0 BEADLO COC(=O)C(C)(C)[N@@H+](C)Cc1ccsc1C ZINC000351254757 536427783 /nfs/dbraw/zinc/42/77/83/536427783.db2.gz ASTKUYDBHVCAAW-UHFFFAOYSA-N 1 2 241.356 2.440 20 0 BEADLO COCc1ccc(C[NH2+][C@@H](C)c2ccon2)o1 ZINC000351600128 536777957 /nfs/dbraw/zinc/77/79/57/536777957.db2.gz YXONKFCXQXKHTM-VIFPVBQESA-N 1 2 236.271 2.265 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N1CCC[C@@H]2CCC[C@H]21 ZINC000189439373 538109761 /nfs/dbraw/zinc/10/97/61/538109761.db2.gz HSAQIBPBUMGZAY-WCQYABFASA-N 1 2 247.342 2.133 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N1CCC[C@@H]2CCC[C@H]21 ZINC000189439373 538109762 /nfs/dbraw/zinc/10/97/62/538109762.db2.gz HSAQIBPBUMGZAY-WCQYABFASA-N 1 2 247.342 2.133 20 0 BEADLO CC(C)=C(C)CC(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000635537629 566318691 /nfs/dbraw/zinc/31/86/91/566318691.db2.gz HPXMRUAXJUHKKZ-UHFFFAOYSA-N 1 2 221.304 2.115 20 0 BEADLO CC(C)[N@H+](CCCc1cnn(C)c1)CC(F)F ZINC000135396144 566337786 /nfs/dbraw/zinc/33/77/86/566337786.db2.gz CJZSIBPNEKXUGI-UHFFFAOYSA-N 1 2 245.317 2.328 20 0 BEADLO CC(C)[N@@H+](CCCc1cnn(C)c1)CC(F)F ZINC000135396144 566337791 /nfs/dbraw/zinc/33/77/91/566337791.db2.gz CJZSIBPNEKXUGI-UHFFFAOYSA-N 1 2 245.317 2.328 20 0 BEADLO c1[nH+]c2c(cc1NC1CSC1)CCCC2 ZINC000389980085 566380658 /nfs/dbraw/zinc/38/06/58/566380658.db2.gz ICXMRRNPQRGHAD-UHFFFAOYSA-N 1 2 220.341 2.488 20 0 BEADLO C[C@@H]1CCCCCN1C(=O)CCc1c[nH+]c[nH]1 ZINC000334379468 566394558 /nfs/dbraw/zinc/39/45/58/566394558.db2.gz YOVKQDBNERAEEH-LLVKDONJSA-N 1 2 235.331 2.133 20 0 BEADLO C[C@@H]1CCCCCN1C(=O)CCc1c[nH]c[nH+]1 ZINC000334379468 566394564 /nfs/dbraw/zinc/39/45/64/566394564.db2.gz YOVKQDBNERAEEH-LLVKDONJSA-N 1 2 235.331 2.133 20 0 BEADLO CC[C@@H](NC(=O)CCc1c[nH+]c[nH]1)C(C)(C)C ZINC000353336062 566474805 /nfs/dbraw/zinc/47/48/05/566474805.db2.gz LFKWMUDKACLFLL-LLVKDONJSA-N 1 2 237.347 2.283 20 0 BEADLO CC[C@@H](NC(=O)CCc1c[nH]c[nH+]1)C(C)(C)C ZINC000353336062 566474812 /nfs/dbraw/zinc/47/48/12/566474812.db2.gz LFKWMUDKACLFLL-LLVKDONJSA-N 1 2 237.347 2.283 20 0 BEADLO CCc1cc(NCCOC(C)C)nc(CC)[nH+]1 ZINC000893159174 583059260 /nfs/dbraw/zinc/05/92/60/583059260.db2.gz IBLQEEXGYVQNAF-UHFFFAOYSA-N 1 2 237.347 2.438 20 0 BEADLO CCn1cc(C[N@@H+]2CCC=C(F)C2)c(C)n1 ZINC000893437976 583143513 /nfs/dbraw/zinc/14/35/13/583143513.db2.gz VRMMEFPQUNAQHS-UHFFFAOYSA-N 1 2 223.295 2.271 20 0 BEADLO CCn1cc(C[N@H+]2CCC=C(F)C2)c(C)n1 ZINC000893437976 583143516 /nfs/dbraw/zinc/14/35/16/583143516.db2.gz VRMMEFPQUNAQHS-UHFFFAOYSA-N 1 2 223.295 2.271 20 0 BEADLO Cc1ccc(CC[NH2+]CC(F)(F)CO)cc1C ZINC000893640753 583183799 /nfs/dbraw/zinc/18/37/99/583183799.db2.gz FOKCZMHTHCWOSC-UHFFFAOYSA-N 1 2 243.297 2.063 20 0 BEADLO C[C@H](O)c1cccc(N[C@H]2CSC[C@@H]2C)[nH+]1 ZINC000893829449 583226914 /nfs/dbraw/zinc/22/69/14/583226914.db2.gz YNDKXTZEJKPCCP-QXEWZRGKSA-N 1 2 238.356 2.298 20 0 BEADLO Cc1ncoc1C[N@H+](C)Cc1ccoc1 ZINC000893974601 583265008 /nfs/dbraw/zinc/26/50/08/583265008.db2.gz SOEQLQFJMZFYSX-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO Cc1ncoc1C[N@@H+](C)Cc1ccoc1 ZINC000893974601 583265010 /nfs/dbraw/zinc/26/50/10/583265010.db2.gz SOEQLQFJMZFYSX-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO CC(C)OCC(N)=[NH+]OC[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000853657645 588753100 /nfs/dbraw/zinc/75/31/00/588753100.db2.gz FBRPFYCZSHXZDU-GRYCIOLGSA-N 1 2 240.347 2.346 20 0 BEADLO Cc1cc(C)c(CNc2cnc(F)cn2)c[nH+]1 ZINC000853673268 588754483 /nfs/dbraw/zinc/75/44/83/588754483.db2.gz CNYYYCFIRHKANN-UHFFFAOYSA-N 1 2 232.262 2.240 20 0 BEADLO CCC(CC)CO[NH+]=C(N)[C@@H]1CCCO1 ZINC000853698080 588757772 /nfs/dbraw/zinc/75/77/72/588757772.db2.gz MNWMOBFRGAQZLS-JTQLQIEISA-N 1 2 214.309 2.100 20 0 BEADLO Cc1cc(N[C@@H]2C[C@@H](O)c3ccccc32)nc[nH+]1 ZINC000853836653 588765529 /nfs/dbraw/zinc/76/55/29/588765529.db2.gz DAULWUDOSISENE-CHWSQXEVSA-N 1 2 241.294 2.375 20 0 BEADLO CC(C)c1nc(N2C[C@H]3COC[C@]3(C)C2)cc[nH+]1 ZINC000853858486 588766445 /nfs/dbraw/zinc/76/64/45/588766445.db2.gz MYFJOGWHVCZDSN-FZMZJTMJSA-N 1 2 247.342 2.073 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)N1CCCCC1 ZINC000853863789 588766609 /nfs/dbraw/zinc/76/66/09/588766609.db2.gz YYMHMWSZGABPDR-UHFFFAOYSA-N 1 2 244.298 2.352 20 0 BEADLO CC(C)c1nc(N2C[C@@H](C)[C@@](C)(CO)C2)cc[nH+]1 ZINC000853965215 588770414 /nfs/dbraw/zinc/77/04/14/588770414.db2.gz VMHVZRTVSCWFEG-BXUZGUMPSA-N 1 2 249.358 2.055 20 0 BEADLO Cc1cc[nH+]cc1Cc1noc(C2=COCC2)n1 ZINC000854098622 588774645 /nfs/dbraw/zinc/77/46/45/588774645.db2.gz RHGBLJHVCGRNPC-UHFFFAOYSA-N 1 2 243.266 2.125 20 0 BEADLO CC[NH2+]Cc1noc([C@@H](OC)C2CCCC2)n1 ZINC000854132428 588775830 /nfs/dbraw/zinc/77/58/30/588775830.db2.gz YORJUKURSSCARK-NSHDSACASA-N 1 2 239.319 2.057 20 0 BEADLO CCOc1cccc(-c2c[nH+]cn2C)c1 ZINC000854187740 588778556 /nfs/dbraw/zinc/77/85/56/588778556.db2.gz KNPXPDNYKHZGRP-UHFFFAOYSA-N 1 2 202.257 2.486 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)[C@H]1CCCC2(CC2)C1 ZINC000854498665 588789671 /nfs/dbraw/zinc/78/96/71/588789671.db2.gz IXXVSVXHRAFHOB-NSHDSACASA-N 1 2 247.342 2.007 20 0 BEADLO CC(C)[C@@H]1[C@@H](C(C)C)CN1C(=O)Cc1[nH]cc[nH+]1 ZINC000854827282 588812450 /nfs/dbraw/zinc/81/24/50/588812450.db2.gz IAKFPKPFVXETOA-BXUZGUMPSA-N 1 2 249.358 2.091 20 0 BEADLO C[C@H](NC(=O)Cc1[nH]cc[nH+]1)[C@@H]1CCC[C@@H](C)C1 ZINC000854895535 588815671 /nfs/dbraw/zinc/81/56/71/588815671.db2.gz WQNUPGZMPUDOAV-GRYCIOLGSA-N 1 2 249.358 2.283 20 0 BEADLO CCC[C@@H](NC(=O)Cc1[nH]cc[nH+]1)C1CCCC1 ZINC000854918605 588816721 /nfs/dbraw/zinc/81/67/21/588816721.db2.gz CDHNEORJZMEKNM-GFCCVEGCSA-N 1 2 249.358 2.427 20 0 BEADLO CC(C)(C)[C@@H]1CCC[C@@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000854942523 588817614 /nfs/dbraw/zinc/81/76/14/588817614.db2.gz VKOZELSLEWIVKG-MNOVXSKESA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)[C@@H]2CCC2(C)C)S1 ZINC000854989189 588819884 /nfs/dbraw/zinc/81/98/84/588819884.db2.gz ABEQTQMWRGVRFV-YUMQZZPRSA-N 1 2 226.345 2.030 20 0 BEADLO Cc1ccc(C[N@H+](C)CN2CCCC2=O)s1 ZINC000113244618 588828154 /nfs/dbraw/zinc/82/81/54/588828154.db2.gz TYSONCNYGIQTSE-UHFFFAOYSA-N 1 2 238.356 2.068 20 0 BEADLO Cc1ccc(C[N@@H+](C)CN2CCCC2=O)s1 ZINC000113244618 588828155 /nfs/dbraw/zinc/82/81/55/588828155.db2.gz TYSONCNYGIQTSE-UHFFFAOYSA-N 1 2 238.356 2.068 20 0 BEADLO Cc1nc(N2CC[C@H]3C[C@H]32)c2c([nH+]1)CCCC2 ZINC000804689267 582526660 /nfs/dbraw/zinc/52/66/60/582526660.db2.gz MIBHKGXBJXTXOP-GXFFZTMASA-N 1 2 229.327 2.262 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)O[C@@H]1CC[N@H+](CCF)C1 ZINC000813094542 582578012 /nfs/dbraw/zinc/57/80/12/582578012.db2.gz TVNSWYXSWLCNOS-IJLUTSLNSA-N 1 2 243.322 2.010 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)O[C@@H]1CC[N@@H+](CCF)C1 ZINC000813094542 582578016 /nfs/dbraw/zinc/57/80/16/582578016.db2.gz TVNSWYXSWLCNOS-IJLUTSLNSA-N 1 2 243.322 2.010 20 0 BEADLO C[C@H](CC(=O)OC[C@@]1(C)C[C@@H]1F)n1cc[nH+]c1 ZINC000845611851 582616049 /nfs/dbraw/zinc/61/60/49/582616049.db2.gz QOCKYPURTHQPPO-JFGNBEQYSA-N 1 2 240.278 2.126 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C[C@@H]1C[C@H]1C1CC1 ZINC000888978018 582669038 /nfs/dbraw/zinc/66/90/38/582669038.db2.gz CBHIWBNFMSIJBO-STQMWFEESA-N 1 2 244.338 2.441 20 0 BEADLO COc1ccc2ccc(NCCCO)[nH+]c2c1 ZINC000891410418 582680001 /nfs/dbraw/zinc/68/00/01/582680001.db2.gz PJZPPAZOLPXCHQ-UHFFFAOYSA-N 1 2 232.283 2.038 20 0 BEADLO CCN(CCO)c1ccc2ccc(OC)cc2[nH+]1 ZINC000891428032 582682601 /nfs/dbraw/zinc/68/26/01/582682601.db2.gz ZJDMLMSNGNWHRJ-UHFFFAOYSA-N 1 2 246.310 2.062 20 0 BEADLO COC[C@H](C)Nc1cc(C)[nH+]c(C2CCC2)n1 ZINC000891438552 582685430 /nfs/dbraw/zinc/68/54/30/582685430.db2.gz OWNNMMUHAKKSSQ-JTQLQIEISA-N 1 2 235.331 2.499 20 0 BEADLO Cc1cc(N2CCC(O)CC2)nc(C2CCC2)[nH+]1 ZINC000891494835 582693294 /nfs/dbraw/zinc/69/32/94/582693294.db2.gz KMOLCKGEPVMLCN-UHFFFAOYSA-N 1 2 247.342 2.014 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCO[C@@H](CC)C2)o1 ZINC000891561369 582697601 /nfs/dbraw/zinc/69/76/01/582697601.db2.gz ALOVXUMSBZPWQD-NSHDSACASA-N 1 2 239.315 2.289 20 0 BEADLO CCOc1ccc(C[N@H+]2CCO[C@@H](CC)C2)o1 ZINC000891561369 582697602 /nfs/dbraw/zinc/69/76/02/582697602.db2.gz ALOVXUMSBZPWQD-NSHDSACASA-N 1 2 239.315 2.289 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccnn2C2CCC2)[C@@H](C)CO1 ZINC000891669237 582708240 /nfs/dbraw/zinc/70/82/40/582708240.db2.gz AQRNTASXVNPYCQ-NWDGAFQWSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccnn2C2CCC2)[C@@H](C)CO1 ZINC000891669237 582708241 /nfs/dbraw/zinc/70/82/41/582708241.db2.gz AQRNTASXVNPYCQ-NWDGAFQWSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@H](CO)Nc1cc(C2CC2)[nH+]c(C2CC2)n1 ZINC000891683948 582709896 /nfs/dbraw/zinc/70/98/96/582709896.db2.gz CTIWEGDBGZGNHN-MRVPVSSYSA-N 1 2 233.315 2.024 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1ccnn1C1CCC1 ZINC000891715297 582711982 /nfs/dbraw/zinc/71/19/82/582711982.db2.gz CILOWSBFRKNTFC-LBPRGKRZSA-N 1 2 249.358 2.219 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1ccnn1C1CCC1 ZINC000891715297 582711983 /nfs/dbraw/zinc/71/19/83/582711983.db2.gz CILOWSBFRKNTFC-LBPRGKRZSA-N 1 2 249.358 2.219 20 0 BEADLO Cc1cnc(Cl)c(C[N@@H+]2CCCOCC2)c1 ZINC000891719569 582713708 /nfs/dbraw/zinc/71/37/08/582713708.db2.gz GUXXLFOJKQBSPQ-UHFFFAOYSA-N 1 2 240.734 2.266 20 0 BEADLO Cc1cnc(Cl)c(C[N@H+]2CCCOCC2)c1 ZINC000891719569 582713712 /nfs/dbraw/zinc/71/37/12/582713712.db2.gz GUXXLFOJKQBSPQ-UHFFFAOYSA-N 1 2 240.734 2.266 20 0 BEADLO CCc1cc(N2C[C@H](C)OC[C@@H]2C)nc(CC)[nH+]1 ZINC000891734858 582715611 /nfs/dbraw/zinc/71/56/11/582715611.db2.gz YLVJOUPBQMQVTH-QWRGUYRKSA-N 1 2 249.358 2.215 20 0 BEADLO C[C@H](O)c1cccc(NCc2nccs2)[nH+]1 ZINC000891862435 582731332 /nfs/dbraw/zinc/73/13/32/582731332.db2.gz SWWDKNPYFYZYDD-QMMMGPOBSA-N 1 2 235.312 2.204 20 0 BEADLO O=C(/C=C/C1CC1)Nc1ccc2[nH+]ccn2c1 ZINC000742667415 582735290 /nfs/dbraw/zinc/73/52/90/582735290.db2.gz UCLQOZOWYZHMKN-ZZXKWVIFSA-N 1 2 227.267 2.239 20 0 BEADLO Cc1cnc(Cl)c(C[N@@H+](C)[C@@H]2CCOC2)c1 ZINC000891934270 582739664 /nfs/dbraw/zinc/73/96/64/582739664.db2.gz DVGQWEVYIBINFP-LLVKDONJSA-N 1 2 240.734 2.264 20 0 BEADLO Cc1cnc(Cl)c(C[N@H+](C)[C@@H]2CCOC2)c1 ZINC000891934270 582739665 /nfs/dbraw/zinc/73/96/65/582739665.db2.gz DVGQWEVYIBINFP-LLVKDONJSA-N 1 2 240.734 2.264 20 0 BEADLO Cc1occc1CN(C)c1cc(N(C)C)[nH+]cn1 ZINC000891972697 582750197 /nfs/dbraw/zinc/75/01/97/582750197.db2.gz GFOULTYJDCKQFB-UHFFFAOYSA-N 1 2 246.314 2.080 20 0 BEADLO Cc1occc1CN(C)c1cc(N(C)C)nc[nH+]1 ZINC000891972697 582750200 /nfs/dbraw/zinc/75/02/00/582750200.db2.gz GFOULTYJDCKQFB-UHFFFAOYSA-N 1 2 246.314 2.080 20 0 BEADLO CC(C)[C@@H](C)N(C)c1cc(N(C)C)[nH+]cn1 ZINC000892007317 582760740 /nfs/dbraw/zinc/76/07/40/582760740.db2.gz GSUFECPIOVKCMA-SNVBAGLBSA-N 1 2 222.336 2.023 20 0 BEADLO CC(C)[C@@H](C)N(C)c1cc(N(C)C)nc[nH+]1 ZINC000892007317 582760741 /nfs/dbraw/zinc/76/07/41/582760741.db2.gz GSUFECPIOVKCMA-SNVBAGLBSA-N 1 2 222.336 2.023 20 0 BEADLO CC(C)[C@H](C)N(C)c1nccn2c[nH+]cc12 ZINC000892010537 582761051 /nfs/dbraw/zinc/76/10/51/582761051.db2.gz WDXOCOYENNTFLL-JTQLQIEISA-N 1 2 218.304 2.210 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2C[C@@H]2[C@H]2C[C@H]2C)c(C)c[nH+]1 ZINC000866860622 582766135 /nfs/dbraw/zinc/76/61/35/582766135.db2.gz ZGKAKYARTWEEEF-GHORINQJSA-N 1 2 244.338 2.351 20 0 BEADLO CNc1cc(N(C)[C@H](C)c2ccccn2)nc[nH+]1 ZINC000892086792 582787733 /nfs/dbraw/zinc/78/77/33/582787733.db2.gz VTSLAPMNKWUUAJ-SNVBAGLBSA-N 1 2 243.314 2.111 20 0 BEADLO CNc1cc(N(C)[C@H](C)c2ccccn2)[nH+]cn1 ZINC000892086792 582787735 /nfs/dbraw/zinc/78/77/35/582787735.db2.gz VTSLAPMNKWUUAJ-SNVBAGLBSA-N 1 2 243.314 2.111 20 0 BEADLO CNc1cc(N(C)[C@@H](C)c2ccccn2)nc[nH+]1 ZINC000892086790 582788072 /nfs/dbraw/zinc/78/80/72/582788072.db2.gz VTSLAPMNKWUUAJ-JTQLQIEISA-N 1 2 243.314 2.111 20 0 BEADLO CNc1cc(N(C)[C@@H](C)c2ccccn2)[nH+]cn1 ZINC000892086790 582788076 /nfs/dbraw/zinc/78/80/76/582788076.db2.gz VTSLAPMNKWUUAJ-JTQLQIEISA-N 1 2 243.314 2.111 20 0 BEADLO CN(Cc1cccn1C)Cc1[nH+]ccn1C1CC1 ZINC000892093082 582788872 /nfs/dbraw/zinc/78/88/72/582788872.db2.gz JLKZTLYXZWGSDB-UHFFFAOYSA-N 1 2 244.342 2.189 20 0 BEADLO COCCCCCNc1cccc([C@H](C)O)[nH+]1 ZINC000892133352 582798278 /nfs/dbraw/zinc/79/82/78/582798278.db2.gz OHWPSXOBWFHYMP-NSHDSACASA-N 1 2 238.331 2.364 20 0 BEADLO Cc1ccc([N@H+](C)CCCN2CCCC2=O)cc1 ZINC000725806130 582862690 /nfs/dbraw/zinc/86/26/90/582862690.db2.gz ATOXGAKZQFRSQY-UHFFFAOYSA-N 1 2 246.354 2.444 20 0 BEADLO Cc1ccc([N@@H+](C)CCCN2CCCC2=O)cc1 ZINC000725806130 582862693 /nfs/dbraw/zinc/86/26/93/582862693.db2.gz ATOXGAKZQFRSQY-UHFFFAOYSA-N 1 2 246.354 2.444 20 0 BEADLO Cc1ccc([N@H+](C)CCCN2CCOC2=O)cc1 ZINC000725806830 582862937 /nfs/dbraw/zinc/86/29/37/582862937.db2.gz OGOMTIJTQVJKAJ-UHFFFAOYSA-N 1 2 248.326 2.274 20 0 BEADLO Cc1ccc([N@@H+](C)CCCN2CCOC2=O)cc1 ZINC000725806830 582862938 /nfs/dbraw/zinc/86/29/38/582862938.db2.gz OGOMTIJTQVJKAJ-UHFFFAOYSA-N 1 2 248.326 2.274 20 0 BEADLO O=C(NCC1=CCCC1)c1cccc2[nH+]ccn21 ZINC000856096053 588860207 /nfs/dbraw/zinc/86/02/07/588860207.db2.gz NBFFXPKCWXOHQR-UHFFFAOYSA-N 1 2 241.294 2.174 20 0 BEADLO CC(C)[NH2+]Cc1ncc(Br)cc1O ZINC000892502862 582899921 /nfs/dbraw/zinc/89/99/21/582899921.db2.gz YFPLCVMSDSZGCQ-UHFFFAOYSA-N 1 2 245.120 2.048 20 0 BEADLO COc1ccc(C[NH2+]Cc2nc(C)cs2)nc1 ZINC000892533784 582907505 /nfs/dbraw/zinc/90/75/05/582907505.db2.gz PVLVILNYWVEVBI-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO CCc1cc(N2CC[C@@H](COC)C2)nc(CC)[nH+]1 ZINC000892634232 582934408 /nfs/dbraw/zinc/93/44/08/582934408.db2.gz ZLRQGWJYKKTCBJ-LLVKDONJSA-N 1 2 249.358 2.074 20 0 BEADLO COCCOc1ccc(CNc2cccc[nH+]2)o1 ZINC000892637021 582934978 /nfs/dbraw/zinc/93/49/78/582934978.db2.gz LRCHHWZGXLEPMC-UHFFFAOYSA-N 1 2 248.282 2.312 20 0 BEADLO COc1ccc(C[NH2+]Cc2nccs2)o1 ZINC000892640143 582935735 /nfs/dbraw/zinc/93/57/35/582935735.db2.gz HUWOIVVUGDGFDU-UHFFFAOYSA-N 1 2 224.285 2.035 20 0 BEADLO C[C@H]1CN(c2nccn3c[nH+]cc23)C[C@H](C)S1 ZINC000892697525 582958263 /nfs/dbraw/zinc/95/82/63/582958263.db2.gz SAKYSRDJYRCTFF-UWVGGRQHSA-N 1 2 248.355 2.060 20 0 BEADLO C[C@@H]1CN(c2nccn3c[nH+]cc23)C[C@@H](C)S1 ZINC000892697524 582958706 /nfs/dbraw/zinc/95/87/06/582958706.db2.gz SAKYSRDJYRCTFF-NXEZZACHSA-N 1 2 248.355 2.060 20 0 BEADLO CNc1[nH+]c(C)ccc1C(=O)OCCC1CC1 ZINC000744739450 582961515 /nfs/dbraw/zinc/96/15/15/582961515.db2.gz ABECPUFYTAEZDN-UHFFFAOYSA-N 1 2 234.299 2.389 20 0 BEADLO C[C@@H](NC(=O)/C=C\C(C)(C)C)c1[nH+]ccn1C ZINC000856278040 588866467 /nfs/dbraw/zinc/86/64/67/588866467.db2.gz WFZRBGRTZUEXGN-JYESYGNLSA-N 1 2 235.331 2.200 20 0 BEADLO CCC/C(C)=C/C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000856277636 588866588 /nfs/dbraw/zinc/86/65/88/588866588.db2.gz NHWMUFTWZCBYAX-PBQZMEPESA-N 1 2 235.331 2.344 20 0 BEADLO C[C@H](NC(=O)C1CC(C)(C)C1)c1[nH+]ccn1C ZINC000856282155 588867193 /nfs/dbraw/zinc/86/71/93/588867193.db2.gz VHNWBBKVKURXPT-VIFPVBQESA-N 1 2 235.331 2.034 20 0 BEADLO C[C@@H](O)c1cccc(NCC2(C)CC2)[nH+]1 ZINC000892796254 582984176 /nfs/dbraw/zinc/98/41/76/582984176.db2.gz PNAXMZUSGGBUGS-SECBINFHSA-N 1 2 206.289 2.347 20 0 BEADLO C[C@@H](O)c1cccc(NC[C@@H]2CCCS2)[nH+]1 ZINC000892885585 583003452 /nfs/dbraw/zinc/00/34/52/583003452.db2.gz ZUFXPHSWGRQQTC-ZJUUUORDSA-N 1 2 238.356 2.442 20 0 BEADLO C[C@@H](O)c1cccc(NC2CC=CC2)[nH+]1 ZINC000892915728 583008618 /nfs/dbraw/zinc/00/86/18/583008618.db2.gz DIZVYURKVUVLFI-SECBINFHSA-N 1 2 204.273 2.265 20 0 BEADLO Cc1nn(C(C)C)c(C)c1C[NH2+]Cc1cocn1 ZINC000892978118 583024281 /nfs/dbraw/zinc/02/42/81/583024281.db2.gz YXXPJGGVTITJRU-UHFFFAOYSA-N 1 2 248.330 2.359 20 0 BEADLO CCc1cc(NC(C)(C)[C@@H](C)O)nc(CC)[nH+]1 ZINC000893038744 583034591 /nfs/dbraw/zinc/03/45/91/583034591.db2.gz WPUACGLYLOZXAN-SECBINFHSA-N 1 2 237.347 2.173 20 0 BEADLO Fc1ccc(C[NH2+]Cc2nccn2C2CC2)nc1 ZINC000893149481 583057356 /nfs/dbraw/zinc/05/73/56/583057356.db2.gz FZTQACBRGBHTNV-UHFFFAOYSA-N 1 2 246.289 2.042 20 0 BEADLO CCN(CCC1CC1)c1nccn2c[nH+]cc12 ZINC000893182027 583066058 /nfs/dbraw/zinc/06/60/58/583066058.db2.gz PATFLFSSWRWVBJ-UHFFFAOYSA-N 1 2 230.315 2.356 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2ncc[nH]2)ccn1 ZINC000856732475 588875498 /nfs/dbraw/zinc/87/54/98/588875498.db2.gz RWHBTWIWNBQHOF-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2ncc[nH]2)ccn1 ZINC000856732475 588875499 /nfs/dbraw/zinc/87/54/99/588875499.db2.gz RWHBTWIWNBQHOF-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO C[C@@H]1CCCCN(c2cc(N(C)C)[nH+]cn2)C1 ZINC000893245270 583077656 /nfs/dbraw/zinc/07/76/56/583077656.db2.gz KZSKZGHZAVPCCP-LLVKDONJSA-N 1 2 234.347 2.169 20 0 BEADLO C[C@@H]1CCCCN(c2cc(N(C)C)nc[nH+]2)C1 ZINC000893245270 583077658 /nfs/dbraw/zinc/07/76/58/583077658.db2.gz KZSKZGHZAVPCCP-LLVKDONJSA-N 1 2 234.347 2.169 20 0 BEADLO C[C@H]1CCCCN(c2cc(N(C)C)[nH+]cn2)C1 ZINC000893245271 583077680 /nfs/dbraw/zinc/07/76/80/583077680.db2.gz KZSKZGHZAVPCCP-NSHDSACASA-N 1 2 234.347 2.169 20 0 BEADLO C[C@H]1CCCCN(c2cc(N(C)C)nc[nH+]2)C1 ZINC000893245271 583077681 /nfs/dbraw/zinc/07/76/81/583077681.db2.gz KZSKZGHZAVPCCP-NSHDSACASA-N 1 2 234.347 2.169 20 0 BEADLO Cc1ccnc(CNc2cc[nH+]c(C(C)C)n2)n1 ZINC000856765748 588876430 /nfs/dbraw/zinc/87/64/30/588876430.db2.gz MNBQYGUVRMLAPH-UHFFFAOYSA-N 1 2 243.314 2.311 20 0 BEADLO C[C@H]1CC[C@@H](Nc2cc(N(C)C)nc[nH+]2)C1 ZINC000893369336 583128272 /nfs/dbraw/zinc/12/82/72/583128272.db2.gz RKMFBIKYKGLJMR-VHSXEESVSA-N 1 2 220.320 2.143 20 0 BEADLO C[C@H]1CC[C@@H](Nc2cc(N(C)C)[nH+]cn2)C1 ZINC000893369336 583128273 /nfs/dbraw/zinc/12/82/73/583128273.db2.gz RKMFBIKYKGLJMR-VHSXEESVSA-N 1 2 220.320 2.143 20 0 BEADLO CCc1cc(N[C@@H](C)[C@H](C)OC)nc(CC)[nH+]1 ZINC000893409966 583139126 /nfs/dbraw/zinc/13/91/26/583139126.db2.gz XZWOKVLXFYUDKF-UWVGGRQHSA-N 1 2 237.347 2.437 20 0 BEADLO Cc1cc(N2C[C@H](O)C[C@H]2C)nc(C2CCC2)[nH+]1 ZINC000893428099 583142143 /nfs/dbraw/zinc/14/21/43/583142143.db2.gz REZFRTOHBOOJSJ-ZYHUDNBSSA-N 1 2 247.342 2.012 20 0 BEADLO Cc1cc(N2C[C@@H](O)C[C@@H]2C)nc(C2CCC2)[nH+]1 ZINC000893428094 583142189 /nfs/dbraw/zinc/14/21/89/583142189.db2.gz REZFRTOHBOOJSJ-JQWIXIFHSA-N 1 2 247.342 2.012 20 0 BEADLO Cc1c[nH+]c2n1CC[C@@H]2OC(=O)CC(C)C ZINC000893516185 583155811 /nfs/dbraw/zinc/15/58/11/583155811.db2.gz JHDMNQKRYZIOJF-JTQLQIEISA-N 1 2 222.288 2.226 20 0 BEADLO Cc1ccc(C(=O)O[C@H]2CCn3c(C)c[nH+]c32)o1 ZINC000893520427 583156198 /nfs/dbraw/zinc/15/61/98/583156198.db2.gz XEJCYDNLEFHWJY-JTQLQIEISA-N 1 2 246.266 2.395 20 0 BEADLO FC1C[NH+](C[C@H]2CCc3ccccc32)C1 ZINC000893521297 583156626 /nfs/dbraw/zinc/15/66/26/583156626.db2.gz CAXLSJXKCFZMCF-LLVKDONJSA-N 1 2 205.276 2.370 20 0 BEADLO FC1C[NH+](C[C@@H]2CCc3ccccc32)C1 ZINC000893521299 583156754 /nfs/dbraw/zinc/15/67/54/583156754.db2.gz CAXLSJXKCFZMCF-NSHDSACASA-N 1 2 205.276 2.370 20 0 BEADLO c1cc(C[N@@H+]2CCO[C@H](C3CCC3)C2)co1 ZINC000840955673 583183544 /nfs/dbraw/zinc/18/35/44/583183544.db2.gz XUUKJRPVLTWIEQ-ZDUSSCGKSA-N 1 2 221.300 2.281 20 0 BEADLO c1cc(C[N@H+]2CCO[C@H](C3CCC3)C2)co1 ZINC000840955673 583183546 /nfs/dbraw/zinc/18/35/46/583183546.db2.gz XUUKJRPVLTWIEQ-ZDUSSCGKSA-N 1 2 221.300 2.281 20 0 BEADLO Cn1cc(C[N@@H+]2CCC[C@](C)(F)C2)c(Cl)n1 ZINC000857049523 588884005 /nfs/dbraw/zinc/88/40/05/588884005.db2.gz XCONFRUFUXXEBC-NSHDSACASA-N 1 2 245.729 2.398 20 0 BEADLO Cn1cc(C[N@H+]2CCC[C@](C)(F)C2)c(Cl)n1 ZINC000857049523 588884007 /nfs/dbraw/zinc/88/40/07/588884007.db2.gz XCONFRUFUXXEBC-NSHDSACASA-N 1 2 245.729 2.398 20 0 BEADLO Cc1nccnc1C[N@@H+]1CCC[C@@](C)(F)C1 ZINC000857047416 588884120 /nfs/dbraw/zinc/88/41/20/588884120.db2.gz BTMQWNHWMBIQSZ-GFCCVEGCSA-N 1 2 223.295 2.109 20 0 BEADLO Cc1nccnc1C[N@H+]1CCC[C@@](C)(F)C1 ZINC000857047416 588884122 /nfs/dbraw/zinc/88/41/22/588884122.db2.gz BTMQWNHWMBIQSZ-GFCCVEGCSA-N 1 2 223.295 2.109 20 0 BEADLO Cn1cc(C[NH+]2CC(CC(F)F)C2)c(Cl)n1 ZINC000857048981 588884332 /nfs/dbraw/zinc/88/43/32/588884332.db2.gz DPZVWQFZSOGYCM-UHFFFAOYSA-N 1 2 249.692 2.161 20 0 BEADLO Cn1c(C[NH+]2CC(CC3CC3)C2)cnc1Cl ZINC000857066054 588884966 /nfs/dbraw/zinc/88/49/66/588884966.db2.gz DOLFHHGBYOTCAW-UHFFFAOYSA-N 1 2 239.750 2.305 20 0 BEADLO CCc1cc(N(C)C[C@@H](C)OC)nc(CC)[nH+]1 ZINC000893847863 583233022 /nfs/dbraw/zinc/23/30/22/583233022.db2.gz KSJVHSUIIRVRNU-SNVBAGLBSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)c1c[nH]c(CN2C[C@@H](C)O[C@@H](C)C2)[nH+]1 ZINC000893864867 583235086 /nfs/dbraw/zinc/23/50/86/583235086.db2.gz GCOJGZOBLHJLCW-PHIMTYICSA-N 1 2 237.347 2.142 20 0 BEADLO c1[nH+]cn2ccnc(N3CCC[C@H](C4CC4)C3)c12 ZINC000893885442 583240769 /nfs/dbraw/zinc/24/07/69/583240769.db2.gz NPWKNMBMMXMEIA-LBPRGKRZSA-N 1 2 242.326 2.356 20 0 BEADLO CCc1cc(N[C@@H]2CCCOC2)nc(CC)[nH+]1 ZINC000893887313 583241973 /nfs/dbraw/zinc/24/19/73/583241973.db2.gz CPIZITRCOYDPBQ-LLVKDONJSA-N 1 2 235.331 2.192 20 0 BEADLO CC(C)c1c[nH]c(C[NH+]2CCSCC2)n1 ZINC000893922011 583248048 /nfs/dbraw/zinc/24/80/48/583248048.db2.gz XIRCNRHXVBYPDT-UHFFFAOYSA-N 1 2 225.361 2.082 20 0 BEADLO CC(C)c1c[nH]c(CN2CCSCC2)[nH+]1 ZINC000893922011 583248050 /nfs/dbraw/zinc/24/80/50/583248050.db2.gz XIRCNRHXVBYPDT-UHFFFAOYSA-N 1 2 225.361 2.082 20 0 BEADLO Cc1coc(C[N@H+]2C[C@H](C)OC[C@H]2C)c1 ZINC000893953837 583261713 /nfs/dbraw/zinc/26/17/13/583261713.db2.gz ZSMZHLPFCIOZPC-MNOVXSKESA-N 1 2 209.289 2.197 20 0 BEADLO Cc1coc(C[N@@H+]2C[C@H](C)OC[C@H]2C)c1 ZINC000893953837 583261715 /nfs/dbraw/zinc/26/17/15/583261715.db2.gz ZSMZHLPFCIOZPC-MNOVXSKESA-N 1 2 209.289 2.197 20 0 BEADLO C[C@@H](F)CCNc1cccc([C@@H](C)O)[nH+]1 ZINC000893981886 583265986 /nfs/dbraw/zinc/26/59/86/583265986.db2.gz MNLIJFRVQCZHDI-RKDXNWHRSA-N 1 2 212.268 2.295 20 0 BEADLO CSc1ccc(C[N@H+](C)Cc2cnccn2)o1 ZINC000893977725 583266292 /nfs/dbraw/zinc/26/62/92/583266292.db2.gz LOWNFZUHGKPHPJ-UHFFFAOYSA-N 1 2 249.339 2.424 20 0 BEADLO CSc1ccc(C[N@@H+](C)Cc2cnccn2)o1 ZINC000893977725 583266294 /nfs/dbraw/zinc/26/62/94/583266294.db2.gz LOWNFZUHGKPHPJ-UHFFFAOYSA-N 1 2 249.339 2.424 20 0 BEADLO Cc1ccnc(CNc2cccc([C@H](C)O)[nH+]2)c1 ZINC000893985766 583268722 /nfs/dbraw/zinc/26/87/22/583268722.db2.gz NFNJCDXAPCUECA-NSHDSACASA-N 1 2 243.310 2.450 20 0 BEADLO C[C@H]1COC(C)(C)CN1Cc1[nH+]ccn1C1CC1 ZINC000894010581 583271447 /nfs/dbraw/zinc/27/14/47/583271447.db2.gz WADFMBRJCSOXOY-NSHDSACASA-N 1 2 249.358 2.217 20 0 BEADLO CCc1cc(NC(CF)CF)nc(CC)[nH+]1 ZINC000894016553 583275829 /nfs/dbraw/zinc/27/58/29/583275829.db2.gz AIFWDUSEOMCKFX-UHFFFAOYSA-N 1 2 229.274 2.321 20 0 BEADLO CC[C@@](C)(CNc1cccc([C@@H](C)O)[nH+]1)OC ZINC000894053118 583289721 /nfs/dbraw/zinc/28/97/21/583289721.db2.gz INIVBOCWYWWJHP-MFKMUULPSA-N 1 2 238.331 2.362 20 0 BEADLO c1[nH+]cn2ccnc(N3C[C@@H]4CCCC[C@@H]4C3)c12 ZINC000894068145 583294447 /nfs/dbraw/zinc/29/44/47/583294447.db2.gz NWDHEQLWBPJASI-TXEJJXNPSA-N 1 2 242.326 2.356 20 0 BEADLO CO[C@@H]1CCC[C@H]1Nc1cccc([C@H](C)O)[nH+]1 ZINC000894073601 583296375 /nfs/dbraw/zinc/29/63/75/583296375.db2.gz XIVSNQDVWZEXBD-MVWJERBFSA-N 1 2 236.315 2.114 20 0 BEADLO Cc1ccncc1CNc1cccc([C@H](C)O)[nH+]1 ZINC000894074296 583297466 /nfs/dbraw/zinc/29/74/66/583297466.db2.gz MLVFAASBPRPZRK-NSHDSACASA-N 1 2 243.310 2.450 20 0 BEADLO CCc1cc(NCC2(CC)COC2)nc(CC)[nH+]1 ZINC000894099422 583304058 /nfs/dbraw/zinc/30/40/58/583304058.db2.gz KUFIMDCRNGVPQU-UHFFFAOYSA-N 1 2 249.358 2.440 20 0 BEADLO CCc1cc(CNc2cc(C)[nH+]c(CC)n2)n[nH]1 ZINC000804451260 583314786 /nfs/dbraw/zinc/31/47/86/583314786.db2.gz CEIWTCHXDXIVJV-UHFFFAOYSA-N 1 2 245.330 2.245 20 0 BEADLO C[C@@H](O)c1cccc(NC[C@H]2CC[C@@H](C)O2)[nH+]1 ZINC000894152029 583318814 /nfs/dbraw/zinc/31/88/14/583318814.db2.gz HXUQVCDBKISYBP-GMTAPVOTSA-N 1 2 236.315 2.114 20 0 BEADLO Cc1ncoc1C[NH2+]Cc1ccccc1F ZINC000894150761 583319516 /nfs/dbraw/zinc/31/95/16/583319516.db2.gz QJAPQHAQXHPVPK-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO C[C@@H](Nc1cccc([C@H](C)O)[nH+]1)c1ccn(C)n1 ZINC000894168032 583324503 /nfs/dbraw/zinc/32/45/03/583324503.db2.gz PSCJNLWKAKHVAS-ZJUUUORDSA-N 1 2 246.314 2.042 20 0 BEADLO COCC[C@@H](C)CNc1cccc([C@@H](C)O)[nH+]1 ZINC000894184759 583332562 /nfs/dbraw/zinc/33/25/62/583332562.db2.gz GADMCVBDHHZDBZ-GHMZBOCLSA-N 1 2 238.331 2.219 20 0 BEADLO C[C@@H]1CC(C)(C)CN1c1nccn2c[nH+]cc12 ZINC000894205244 583341659 /nfs/dbraw/zinc/34/16/59/583341659.db2.gz JZOYNXCUDBPUMQ-SNVBAGLBSA-N 1 2 230.315 2.354 20 0 BEADLO Cc1cc(CNc2nc[nH+]c(C)c2C)cc(=O)[nH]1 ZINC000894239494 583386996 /nfs/dbraw/zinc/38/69/96/583386996.db2.gz NXTQJQWOWUGPMK-UHFFFAOYSA-N 1 2 244.298 2.115 20 0 BEADLO Cc1cnc(C[NH2+]Cc2ocnc2C)s1 ZINC000894270264 583402475 /nfs/dbraw/zinc/40/24/75/583402475.db2.gz WIURFQYGCPVSGC-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO Cc1ncoc1CNc1ccc[nH+]c1C ZINC000894359948 583436899 /nfs/dbraw/zinc/43/68/99/583436899.db2.gz VCOVSVOOZOJBMB-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO CCOCC[N@H+](C)Cc1nc(C(C)C)c[nH]1 ZINC000894425175 583456032 /nfs/dbraw/zinc/45/60/32/583456032.db2.gz SFVRBEFRCIACGE-UHFFFAOYSA-N 1 2 225.336 2.001 20 0 BEADLO CCOCC[N@@H+](C)Cc1nc(C(C)C)c[nH]1 ZINC000894425175 583456034 /nfs/dbraw/zinc/45/60/34/583456034.db2.gz SFVRBEFRCIACGE-UHFFFAOYSA-N 1 2 225.336 2.001 20 0 BEADLO Cc1nc2c(s1)[C@H]([NH2+]Cc1c[nH]cn1)CCC2 ZINC000894430997 583457685 /nfs/dbraw/zinc/45/76/85/583457685.db2.gz INQRTYLQGFUDFR-SNVBAGLBSA-N 1 2 248.355 2.342 20 0 BEADLO CO[C@@H](C)C[N@H+](C)Cc1nc(C(C)(C)C)co1 ZINC000894434552 583459198 /nfs/dbraw/zinc/45/91/98/583459198.db2.gz GAGFXZZADAOTJD-JTQLQIEISA-N 1 2 240.347 2.439 20 0 BEADLO CO[C@@H](C)C[N@@H+](C)Cc1nc(C(C)(C)C)co1 ZINC000894434552 583459200 /nfs/dbraw/zinc/45/92/00/583459200.db2.gz GAGFXZZADAOTJD-JTQLQIEISA-N 1 2 240.347 2.439 20 0 BEADLO CO[C@@H]1Cc2ccc(NCc3c[nH+]c[nH]3)cc2C1 ZINC000894445268 583461278 /nfs/dbraw/zinc/46/12/78/583461278.db2.gz PPRVAABQWSVEEK-CQSZACIVSA-N 1 2 243.310 2.135 20 0 BEADLO CO[C@@H]1Cc2ccc(NCc3c[nH]c[nH+]3)cc2C1 ZINC000894445268 583461279 /nfs/dbraw/zinc/46/12/79/583461279.db2.gz PPRVAABQWSVEEK-CQSZACIVSA-N 1 2 243.310 2.135 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2ocnc2C)cn1 ZINC000894453341 583463731 /nfs/dbraw/zinc/46/37/31/583463731.db2.gz PMCKKSNXIUCURM-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2ocnc2C)cn1 ZINC000894453341 583463735 /nfs/dbraw/zinc/46/37/35/583463735.db2.gz PMCKKSNXIUCURM-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO Cc1ncoc1CN1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000894462551 583467172 /nfs/dbraw/zinc/46/71/72/583467172.db2.gz XNYXIVLBGYUCQM-SNVBAGLBSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1ncoc1C[N@@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000894462551 583467173 /nfs/dbraw/zinc/46/71/73/583467173.db2.gz XNYXIVLBGYUCQM-SNVBAGLBSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1ncoc1C[N@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000894462551 583467174 /nfs/dbraw/zinc/46/71/74/583467174.db2.gz XNYXIVLBGYUCQM-SNVBAGLBSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1n[nH]c(C[N@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)c1C ZINC000894532707 583478284 /nfs/dbraw/zinc/47/82/84/583478284.db2.gz DVQZDDLCJOAQBG-KPXOXKRLSA-N 1 2 237.347 2.024 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)c1C ZINC000894532707 583478285 /nfs/dbraw/zinc/47/82/85/583478285.db2.gz DVQZDDLCJOAQBG-KPXOXKRLSA-N 1 2 237.347 2.024 20 0 BEADLO Fc1cccc2c1OCC[C@H]2[NH2+]Cc1cnc[nH]1 ZINC000894535876 583479771 /nfs/dbraw/zinc/47/97/71/583479771.db2.gz XOAWWBQYMPRYIV-GFCCVEGCSA-N 1 2 247.273 2.162 20 0 BEADLO Cc1noc([C@@H](C)[NH2+][C@@H]2CCc3cccnc32)n1 ZINC000894542150 583481145 /nfs/dbraw/zinc/48/11/45/583481145.db2.gz GNGWHRZGSXOUPI-LDYMZIIASA-N 1 2 244.298 2.111 20 0 BEADLO C[C@@H](O)c1cccc(N[C@H]2COC3(CCC3)C2)[nH+]1 ZINC000894541094 583481162 /nfs/dbraw/zinc/48/11/62/583481162.db2.gz HDYOAKQWBNNHGY-GHMZBOCLSA-N 1 2 248.326 2.258 20 0 BEADLO CC(C)c1c[nH]c(CN2CCCc3n[nH]cc32)[nH+]1 ZINC000894590111 583488132 /nfs/dbraw/zinc/48/81/32/583488132.db2.gz WHCAQSOMYJXRQV-UHFFFAOYSA-N 1 2 245.330 2.209 20 0 BEADLO CN(Cc1nc(Cl)cs1)Cc1[nH]cc[nH+]1 ZINC000894586674 583489561 /nfs/dbraw/zinc/48/95/61/583489561.db2.gz QXMBOYGXRVRZKV-UHFFFAOYSA-N 1 2 242.735 2.152 20 0 BEADLO CN(C[C@@H]1CC1(C)C)c1nccn2c[nH+]cc12 ZINC000894651209 583499949 /nfs/dbraw/zinc/49/99/49/583499949.db2.gz OXAFDUBNARGUMP-JTQLQIEISA-N 1 2 230.315 2.212 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2n[nH]c(C)c2C)CCCO1 ZINC000894652408 583501448 /nfs/dbraw/zinc/50/14/48/583501448.db2.gz IAKYCTHFFSWEOD-GFCCVEGCSA-N 1 2 237.347 2.027 20 0 BEADLO CC(C)[N@H+](Cc1ccnn1C1CCC1)C1COC1 ZINC000894659685 583503859 /nfs/dbraw/zinc/50/38/59/583503859.db2.gz ZORHGHAWHYXSNL-UHFFFAOYSA-N 1 2 249.358 2.217 20 0 BEADLO CC(C)[N@@H+](Cc1ccnn1C1CCC1)C1COC1 ZINC000894659685 583503862 /nfs/dbraw/zinc/50/38/62/583503862.db2.gz ZORHGHAWHYXSNL-UHFFFAOYSA-N 1 2 249.358 2.217 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2c(Cl)n[nH]c2C2CC2)C1 ZINC000894673438 583504506 /nfs/dbraw/zinc/50/45/06/583504506.db2.gz ZWJBLCWLLQPQEI-MRVPVSSYSA-N 1 2 243.713 2.484 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2c(Cl)n[nH]c2C2CC2)C1 ZINC000894673438 583504508 /nfs/dbraw/zinc/50/45/08/583504508.db2.gz ZWJBLCWLLQPQEI-MRVPVSSYSA-N 1 2 243.713 2.484 20 0 BEADLO Cc1cc(C[N@@H+](C(C)C)C2COC2)cnc1F ZINC000894659103 583504517 /nfs/dbraw/zinc/50/45/17/583504517.db2.gz NSZCAIJRQGOCCD-UHFFFAOYSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1cc(C[N@H+](C(C)C)C2COC2)cnc1F ZINC000894659103 583504519 /nfs/dbraw/zinc/50/45/19/583504519.db2.gz NSZCAIJRQGOCCD-UHFFFAOYSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CC[C@]3(C2)CCCOC3)c1C ZINC000894697865 583510772 /nfs/dbraw/zinc/51/07/72/583510772.db2.gz PKJXZSZFSVDFBH-AWEZNQCLSA-N 1 2 249.358 2.029 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CC[C@]3(C2)CCCOC3)c1C ZINC000894697865 583510774 /nfs/dbraw/zinc/51/07/74/583510774.db2.gz PKJXZSZFSVDFBH-AWEZNQCLSA-N 1 2 249.358 2.029 20 0 BEADLO CCc1cc(N(C)CC2(C)COC2)nc(CC)[nH+]1 ZINC000894726108 583515334 /nfs/dbraw/zinc/51/53/34/583515334.db2.gz PLBIDEBORHBMSL-UHFFFAOYSA-N 1 2 249.358 2.074 20 0 BEADLO Cc1cc[nH+]c(N)c1CN[C@@H]1CCCC1(F)F ZINC000894784997 583521109 /nfs/dbraw/zinc/52/11/09/583521109.db2.gz PJNLSQVQJUKELZ-SNVBAGLBSA-N 1 2 241.285 2.250 20 0 BEADLO CCc1cc(N[C@H]2C[C@H](OC)C2)nc(CC)[nH+]1 ZINC000894819826 583524752 /nfs/dbraw/zinc/52/47/52/583524752.db2.gz KQDSFALPCFBFFK-XYPYZODXSA-N 1 2 235.331 2.191 20 0 BEADLO CCc1cc(NC[C@H]2C[C@@H](OC)C2)nc(CC)[nH+]1 ZINC000894827593 583526560 /nfs/dbraw/zinc/52/65/60/583526560.db2.gz FLMJUCQLGZZMOF-KLPPZKSPSA-N 1 2 249.358 2.438 20 0 BEADLO FC(F)C1C[NH+](Cc2cnn(C3CCC3)c2)C1 ZINC000894828968 583527397 /nfs/dbraw/zinc/52/73/97/583527397.db2.gz VTZSDMAPIIKVRX-UHFFFAOYSA-N 1 2 241.285 2.305 20 0 BEADLO CCc1nc(N2CC(c3ccccn3)C2)cc[nH+]1 ZINC000894845739 583531485 /nfs/dbraw/zinc/53/14/85/583531485.db2.gz NGSRXLMUEQJZOQ-UHFFFAOYSA-N 1 2 240.310 2.038 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1cc(F)ncc1F ZINC000894860153 583533689 /nfs/dbraw/zinc/53/36/89/583533689.db2.gz BUIDOABYGVLAFQ-JGVFFNPUSA-N 1 2 212.243 2.200 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1cc(F)ncc1F ZINC000894860153 583533691 /nfs/dbraw/zinc/53/36/91/583533691.db2.gz BUIDOABYGVLAFQ-JGVFFNPUSA-N 1 2 212.243 2.200 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+]2C[C@@H](C)[C@@H]2C)n1 ZINC000894862227 583535030 /nfs/dbraw/zinc/53/50/30/583535030.db2.gz UXLSHZLISMRKBK-ZJUUUORDSA-N 1 2 207.321 2.373 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+]2C[C@@H](C)[C@@H]2C)n1 ZINC000894862227 583535031 /nfs/dbraw/zinc/53/50/31/583535031.db2.gz UXLSHZLISMRKBK-ZJUUUORDSA-N 1 2 207.321 2.373 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1c(C(F)(F)F)cnn1C ZINC000894861466 583536122 /nfs/dbraw/zinc/53/61/22/583536122.db2.gz HTEMXIBJXXMUSE-JGVFFNPUSA-N 1 2 247.264 2.279 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1c(C(F)(F)F)cnn1C ZINC000894861466 583536124 /nfs/dbraw/zinc/53/61/24/583536124.db2.gz HTEMXIBJXXMUSE-JGVFFNPUSA-N 1 2 247.264 2.279 20 0 BEADLO CCOc1ccc(C[NH2+]Cc2ccn(CC)n2)o1 ZINC000894896655 583550182 /nfs/dbraw/zinc/55/01/82/583550182.db2.gz YEOMAOZNAIWVAP-UHFFFAOYSA-N 1 2 249.314 2.185 20 0 BEADLO Cc1cc(N[C@H]2CCC[C@@H]2O)nc(C2CCC2)[nH+]1 ZINC000894986818 583565394 /nfs/dbraw/zinc/56/53/94/583565394.db2.gz RNTZXBMHYOUKEE-RYUDHWBXSA-N 1 2 247.342 2.378 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2CCO[C@H](C3CCC3)C2)c1C ZINC000894987424 583565419 /nfs/dbraw/zinc/56/54/19/583565419.db2.gz PYHAHNAMYIWOEP-AWEZNQCLSA-N 1 2 249.358 2.027 20 0 BEADLO Cc1n[nH]c(C[N@H+]2CCO[C@H](C3CCC3)C2)c1C ZINC000894987424 583565420 /nfs/dbraw/zinc/56/54/20/583565420.db2.gz PYHAHNAMYIWOEP-AWEZNQCLSA-N 1 2 249.358 2.027 20 0 BEADLO COCC(=O)Nc1ccc2[nH+]c(C)cc(C)c2c1 ZINC000895064251 583577608 /nfs/dbraw/zinc/57/76/08/583577608.db2.gz UVENFTITXUKQQD-UHFFFAOYSA-N 1 2 244.294 2.437 20 0 BEADLO CC[C@@H]1CC[N@@H+]1Cn1nc2ccccn2c1=S ZINC000793820397 583590944 /nfs/dbraw/zinc/59/09/44/583590944.db2.gz KWEHRFPRUYEHFS-SNVBAGLBSA-N 1 2 248.355 2.307 20 0 BEADLO CC[C@@H]1CC[N@H+]1Cn1nc2ccccn2c1=S ZINC000793820397 583590947 /nfs/dbraw/zinc/59/09/47/583590947.db2.gz KWEHRFPRUYEHFS-SNVBAGLBSA-N 1 2 248.355 2.307 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2CCO[C@@H](C)C2)c1C ZINC000882153326 583595448 /nfs/dbraw/zinc/59/54/48/583595448.db2.gz FKVBCGOLIIDUBY-JOYOIKCWSA-N 1 2 235.331 2.320 20 0 BEADLO Cc1[nH+]cnc(NCC(C)(C)CCCO)c1C ZINC000882155614 583596043 /nfs/dbraw/zinc/59/60/43/583596043.db2.gz IOEBEKUZNMKZII-UHFFFAOYSA-N 1 2 237.347 2.304 20 0 BEADLO CC[C@H]1CN(Cc2[nH+]ccn2C2CC2)[C@H](C)CO1 ZINC000895148707 583605656 /nfs/dbraw/zinc/60/56/56/583605656.db2.gz XCAWQZIUFIBAQW-YPMHNXCESA-N 1 2 249.358 2.217 20 0 BEADLO C[C@H](CC(=O)NC1CCC=CCC1)n1cc[nH+]c1 ZINC000895213846 583628182 /nfs/dbraw/zinc/62/81/82/583628182.db2.gz UUYLWGASSQGFEH-GFCCVEGCSA-N 1 2 247.342 2.449 20 0 BEADLO Cc1ccc(CC2C[NH+](Cc3cnc[nH]3)C2)cc1 ZINC000895277488 583635837 /nfs/dbraw/zinc/63/58/37/583635837.db2.gz GTKDJCJMLKGWCT-UHFFFAOYSA-N 1 2 241.338 2.393 20 0 BEADLO CC1=NO[C@@H](C[NH2+]Cc2nc3ccccc3o2)C1 ZINC000895305629 583642993 /nfs/dbraw/zinc/64/29/93/583642993.db2.gz VOPLTPSIDIHXNQ-SNVBAGLBSA-N 1 2 245.282 2.082 20 0 BEADLO CC1=NO[C@H](C[NH2+]Cc2ncc(Cl)s2)C1 ZINC000895303117 583644787 /nfs/dbraw/zinc/64/47/87/583644787.db2.gz DBTQSMKGXTZMGO-ZETCQYMHSA-N 1 2 245.735 2.051 20 0 BEADLO CC(=O)OC[C@@H](C)Nc1c[nH+]cc2c1CCCC2 ZINC000895308433 583646592 /nfs/dbraw/zinc/64/65/92/583646592.db2.gz IJLMTLMKZUBCKZ-SNVBAGLBSA-N 1 2 248.326 2.324 20 0 BEADLO Cc1cccc(CC[N@@H+]2Cc3ccncc3C2)n1 ZINC000857881062 588920066 /nfs/dbraw/zinc/92/00/66/588920066.db2.gz AQDHCFLUJCICME-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1cccc(CC[N@H+]2Cc3ccncc3C2)n1 ZINC000857881062 588920067 /nfs/dbraw/zinc/92/00/67/588920067.db2.gz AQDHCFLUJCICME-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO CCC[C@H](C[N@@H+]1CC[C@@H]1C(F)F)OC ZINC000895431964 583671057 /nfs/dbraw/zinc/67/10/57/583671057.db2.gz RZEGVSRCAIUWET-RKDXNWHRSA-N 1 2 207.264 2.141 20 0 BEADLO CCC[C@H](C[N@H+]1CC[C@@H]1C(F)F)OC ZINC000895431964 583671060 /nfs/dbraw/zinc/67/10/60/583671060.db2.gz RZEGVSRCAIUWET-RKDXNWHRSA-N 1 2 207.264 2.141 20 0 BEADLO CSc1ccc(C[NH2+]Cc2ncc[nH]2)o1 ZINC000895422442 583673633 /nfs/dbraw/zinc/67/36/33/583673633.db2.gz DTSJYWSRKSARBQ-UHFFFAOYSA-N 1 2 223.301 2.014 20 0 BEADLO CSc1ccc(CNCc2[nH]cc[nH+]2)o1 ZINC000895422442 583673634 /nfs/dbraw/zinc/67/36/34/583673634.db2.gz DTSJYWSRKSARBQ-UHFFFAOYSA-N 1 2 223.301 2.014 20 0 BEADLO Oc1ccc(F)c(C[N@@H+]2CC[C@H](CF)C2)c1F ZINC000895572813 583692336 /nfs/dbraw/zinc/69/23/36/583692336.db2.gz LTFMITFNKPXAJH-MRVPVSSYSA-N 1 2 245.244 2.462 20 0 BEADLO Oc1ccc(F)c(C[N@H+]2CC[C@H](CF)C2)c1F ZINC000895572813 583692337 /nfs/dbraw/zinc/69/23/37/583692337.db2.gz LTFMITFNKPXAJH-MRVPVSSYSA-N 1 2 245.244 2.462 20 0 BEADLO Cn1ccc([C@H]2CCCN(c3cccc[nH+]3)C2)n1 ZINC000895632056 583698574 /nfs/dbraw/zinc/69/85/74/583698574.db2.gz LZJXDVVXTLWWFI-LBPRGKRZSA-N 1 2 242.326 2.199 20 0 BEADLO CC(C)([NH2+]Cc1ccn[nH]1)[C@@H](O)c1ccccc1 ZINC000895659329 583701893 /nfs/dbraw/zinc/70/18/93/583701893.db2.gz VKMNAFNJTCGIMR-ZDUSSCGKSA-N 1 2 245.326 2.012 20 0 BEADLO CC(C)(F)C[NH2+]Cc1nnc(C2CC2)s1 ZINC000895691266 583707465 /nfs/dbraw/zinc/70/74/65/583707465.db2.gz OASFLOAOMQZJGO-UHFFFAOYSA-N 1 2 229.324 2.253 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)C1(C2CC2)CC1 ZINC000885732397 588924500 /nfs/dbraw/zinc/92/45/00/588924500.db2.gz RNWYHGCZWNFBFO-UHFFFAOYSA-N 1 2 234.299 2.007 20 0 BEADLO Cc1ccccc1C1CC([NH2+][C@H]2CCOC2=O)C1 ZINC000895803332 583731488 /nfs/dbraw/zinc/73/14/88/583731488.db2.gz AGFDKOUEOZCYJY-YIZWMMSDSA-N 1 2 245.322 2.146 20 0 BEADLO O=C1OCC[C@@H]1[NH2+]CCC1CCCCCC1 ZINC000895807235 583732105 /nfs/dbraw/zinc/73/21/05/583732105.db2.gz LRWXATWYHSEFDZ-LBPRGKRZSA-N 1 2 225.332 2.252 20 0 BEADLO CCC[C@@H](C[NH2+][C@H]1CCOC1=O)c1ccccc1 ZINC000895804608 583732249 /nfs/dbraw/zinc/73/22/49/583732249.db2.gz LORVPSCUZULBQN-KBPBESRZSA-N 1 2 247.338 2.475 20 0 BEADLO CN(Cc1ccns1)Cc1[nH+]ccn1C1CC1 ZINC000895812077 583733257 /nfs/dbraw/zinc/73/32/57/583733257.db2.gz ZLOJQIOYNBTUML-UHFFFAOYSA-N 1 2 248.355 2.307 20 0 BEADLO CCCCc1cc(N[C@@H]2COC[C@H]2C)nc[nH+]1 ZINC000895910775 583745729 /nfs/dbraw/zinc/74/57/29/583745729.db2.gz WBTOPSIOOULPHH-ZYHUDNBSSA-N 1 2 235.331 2.266 20 0 BEADLO Cc1cc(N[C@@H]2COC[C@H]2C)nc(C2CCC2)[nH+]1 ZINC000895911263 583745926 /nfs/dbraw/zinc/74/59/26/583745926.db2.gz XIWRKLVCWLHUJX-BXKDBHETSA-N 1 2 247.342 2.499 20 0 BEADLO CCn1ncc(NCc2[nH+]ccn2C2CC2)c1C ZINC000895947502 583749192 /nfs/dbraw/zinc/74/91/92/583749192.db2.gz HWTWXXQWKYJGAS-UHFFFAOYSA-N 1 2 245.330 2.355 20 0 BEADLO O=C(N[C@H]1CCn2c[nH+]cc21)[C@@H]1CCCC12CC2 ZINC000857976058 588926353 /nfs/dbraw/zinc/92/63/53/588926353.db2.gz WPJBFWXUQOIRTL-QWRGUYRKSA-N 1 2 245.326 2.024 20 0 BEADLO CO[C@@H]1C[N@H+](Cc2cccc(C3CC3)c2)CCO1 ZINC000895961714 583750924 /nfs/dbraw/zinc/75/09/24/583750924.db2.gz CQHROLBITCUTKS-HNNXBMFYSA-N 1 2 247.338 2.369 20 0 BEADLO CO[C@@H]1C[N@@H+](Cc2cccc(C3CC3)c2)CCO1 ZINC000895961714 583750926 /nfs/dbraw/zinc/75/09/26/583750926.db2.gz CQHROLBITCUTKS-HNNXBMFYSA-N 1 2 247.338 2.369 20 0 BEADLO CC(C)OC1CN(Cc2c[nH+]cn2C(C)C)C1 ZINC000895954594 583751930 /nfs/dbraw/zinc/75/19/30/583751930.db2.gz BNHARYBQYIKEAZ-UHFFFAOYSA-N 1 2 237.347 2.073 20 0 BEADLO COCc1ccc(C[NH+]2CC(OC(C)C)C2)cc1 ZINC000895955586 583752429 /nfs/dbraw/zinc/75/24/29/583752429.db2.gz SHULLKIZAFGPJJ-UHFFFAOYSA-N 1 2 249.354 2.442 20 0 BEADLO Cc1ncsc1C[NH+]1CC(OC(C)C)C1 ZINC000895955039 583752575 /nfs/dbraw/zinc/75/25/75/583752575.db2.gz MIYUWXUQUAWHGY-UHFFFAOYSA-N 1 2 226.345 2.061 20 0 BEADLO C/C(=C/C(=O)N[C@H]1CCn2c[nH+]cc21)C(C)(C)C ZINC000857977757 588926598 /nfs/dbraw/zinc/92/65/98/588926598.db2.gz ZIIYDYAKAIKKJO-BRNRAETOSA-N 1 2 247.342 2.437 20 0 BEADLO CC(C)CCCC(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857977840 588926693 /nfs/dbraw/zinc/92/66/93/588926693.db2.gz HVUSNPCLVKKBAH-NSHDSACASA-N 1 2 235.331 2.270 20 0 BEADLO CCCC[C@@H](C)C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857977420 588926904 /nfs/dbraw/zinc/92/69/04/588926904.db2.gz DTJWAJUCJQIGTR-GHMZBOCLSA-N 1 2 235.331 2.270 20 0 BEADLO OCc1cc[nH+]c(NC[C@@H]2C[C@H]2C(F)(F)F)c1 ZINC000896086562 583769507 /nfs/dbraw/zinc/76/95/07/583769507.db2.gz AYXTYELBTIPODG-DTWKUNHWSA-N 1 2 246.232 2.184 20 0 BEADLO CCCC1(C(=O)N[C@@H]2CCn3c[nH+]cc32)CC1 ZINC000857982618 588927909 /nfs/dbraw/zinc/92/79/09/588927909.db2.gz KHTIAYSVIFNCNJ-SNVBAGLBSA-N 1 2 233.315 2.024 20 0 BEADLO CCCC1(C(=O)N[C@H]2CCn3c[nH+]cc32)CC1 ZINC000857982617 588927917 /nfs/dbraw/zinc/92/79/17/588927917.db2.gz KHTIAYSVIFNCNJ-JTQLQIEISA-N 1 2 233.315 2.024 20 0 BEADLO CCC(CC)CC(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857982516 588928009 /nfs/dbraw/zinc/92/80/09/588928009.db2.gz JTDDYVOERCKUCM-NSHDSACASA-N 1 2 235.331 2.270 20 0 BEADLO Cc1nc(NC[C@@H]2C[C@H]2C(F)(F)F)cc[nH+]1 ZINC000896093161 583771070 /nfs/dbraw/zinc/77/10/70/583771070.db2.gz WXLUIVNEMRKUDI-JGVFFNPUSA-N 1 2 231.221 2.395 20 0 BEADLO CCC[C@H](O)CCNc1cc[nH+]c(CC)n1 ZINC000896183280 583779128 /nfs/dbraw/zinc/77/91/28/583779128.db2.gz NGPGDCSTKQRFGL-JTQLQIEISA-N 1 2 223.320 2.002 20 0 BEADLO C[C@@H]1CC[C@@H](CC(=O)N[C@H]2CCn3c[nH+]cc32)C1 ZINC000857984378 588928616 /nfs/dbraw/zinc/92/86/16/588928616.db2.gz ZGCXOTPUEQHKRQ-UTUOFQBUSA-N 1 2 247.342 2.270 20 0 BEADLO C[C@@H]1CC/C(=C/C(=O)N[C@@H]2CCn3c[nH+]cc32)C1 ZINC000857984033 588928750 /nfs/dbraw/zinc/92/87/50/588928750.db2.gz XBYIKKBRWFPMOV-QESQTXLRSA-N 1 2 245.326 2.191 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857983240 588928898 /nfs/dbraw/zinc/92/88/98/588928898.db2.gz YFXALINFHYNFTI-WDMOLILDSA-N 1 2 247.342 2.126 20 0 BEADLO CC1(C(=O)N[C@@H]2CCn3c[nH+]cc32)CCCC1 ZINC000857985042 588928914 /nfs/dbraw/zinc/92/89/14/588928914.db2.gz GVKAVFXGSWKYEB-SNVBAGLBSA-N 1 2 233.315 2.024 20 0 BEADLO CCCCCCC(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857989102 588929132 /nfs/dbraw/zinc/92/91/32/588929132.db2.gz KQZBWQIORYGWAB-LLVKDONJSA-N 1 2 235.331 2.415 20 0 BEADLO Cc1nc(N[C@H]2CCS[C@H](C)C2)cc[nH+]1 ZINC000896246641 583784821 /nfs/dbraw/zinc/78/48/21/583784821.db2.gz QJYPUUIBFHRICY-SCZZXKLOSA-N 1 2 223.345 2.481 20 0 BEADLO C[C@H]1C[C@H](Nc2cc(CO)cc[nH+]2)CCS1 ZINC000896245072 583784961 /nfs/dbraw/zinc/78/49/61/583784961.db2.gz DBOLKGOJAJJYKY-GXSJLCMTSA-N 1 2 238.356 2.270 20 0 BEADLO O=C(CC1CCCCC1)N[C@H]1CCn2c[nH+]cc21 ZINC000857991165 588929857 /nfs/dbraw/zinc/92/98/57/588929857.db2.gz VIFIDHPPJZMDGN-LBPRGKRZSA-N 1 2 247.342 2.415 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)C(F)F)n(C)n1 ZINC000883400933 583794456 /nfs/dbraw/zinc/79/44/56/583794456.db2.gz YJGYYNKLZSMCQY-SFYZADRCSA-N 1 2 217.263 2.033 20 0 BEADLO O=C(CC1CCCC1)N[C@@H]1CCn2c[nH+]cc21 ZINC000857991409 588930024 /nfs/dbraw/zinc/93/00/24/588930024.db2.gz XQDNACSSTXWEET-LLVKDONJSA-N 1 2 233.315 2.024 20 0 BEADLO CCC[C@H](OC)c1noc(C2([NH+](C)C)CC2)n1 ZINC000896351414 583795667 /nfs/dbraw/zinc/79/56/67/583795667.db2.gz MJBPERHQJOZTCX-VIFPVBQESA-N 1 2 239.319 2.108 20 0 BEADLO O=C(N[C@@H]1CCn2c[nH+]cc21)C1CCCCC1 ZINC000857991398 588930216 /nfs/dbraw/zinc/93/02/16/588930216.db2.gz XOGPTNDHYJQITL-LLVKDONJSA-N 1 2 233.315 2.024 20 0 BEADLO CCO[C@H]1CCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000896409800 583800724 /nfs/dbraw/zinc/80/07/24/583800724.db2.gz QRBRWKGODZRXBB-JTQLQIEISA-N 1 2 231.299 2.178 20 0 BEADLO CC(C)[C@@H](Nc1cc[nH+]cc1F)c1cnn(C)c1 ZINC000896422586 583801574 /nfs/dbraw/zinc/80/15/74/583801574.db2.gz LTPSRHDQAVSCLM-CYBMUJFWSA-N 1 2 248.305 2.185 20 0 BEADLO Cc1nc(N[C@H](c2cnn(C)c2)C(C)C)cc[nH+]1 ZINC000896429223 583802145 /nfs/dbraw/zinc/80/21/45/583802145.db2.gz ZZWJDAUHHYWREE-ZDUSSCGKSA-N 1 2 245.330 2.328 20 0 BEADLO COc1c(C)[nH+]cnc1NC[C@]12C[C@H]1CCC2 ZINC000896544783 583810335 /nfs/dbraw/zinc/81/03/35/583810335.db2.gz CEKHHYVDRJWGSJ-MFKMUULPSA-N 1 2 233.315 2.396 20 0 BEADLO CC(C)c1nc(NCc2cncc(O)c2)cc[nH+]1 ZINC000896632591 583818519 /nfs/dbraw/zinc/81/85/19/583818519.db2.gz RELSOMIECHGPQU-UHFFFAOYSA-N 1 2 244.298 2.313 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N2C[C@@H](C)[C@H](C)C2)c[nH+]1 ZINC000896755821 583830710 /nfs/dbraw/zinc/83/07/10/583830710.db2.gz CISHFSOBIALDRG-GHMZBOCLSA-N 1 2 249.358 2.041 20 0 BEADLO CCc1cc(NCC[C@@H]2CCCC[C@@H]2O)nc[nH+]1 ZINC000896812943 583836063 /nfs/dbraw/zinc/83/60/63/583836063.db2.gz PZXSFYFUDJIGGF-AAEUAGOBSA-N 1 2 249.358 2.392 20 0 BEADLO CCC[C@@H](CC)C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000896905735 583851309 /nfs/dbraw/zinc/85/13/09/583851309.db2.gz LQEVXGCYMPOPGU-LLVKDONJSA-N 1 2 237.347 2.469 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H]2CCC2(C)C)[nH+]c1C ZINC000896908094 583851971 /nfs/dbraw/zinc/85/19/71/583851971.db2.gz UZUJETSIUHLIJG-JTQLQIEISA-N 1 2 235.331 2.079 20 0 BEADLO Cc1[nH]c(CNC(=O)C[C@H]2CC[C@@H](C)C2)[nH+]c1C ZINC000896917185 583855278 /nfs/dbraw/zinc/85/52/78/583855278.db2.gz QXTBMVXERSSLLB-SKDRFNHKSA-N 1 2 249.358 2.469 20 0 BEADLO CC[C@H](C)Cc1noc(C2([NH+](C)C)CC2)n1 ZINC000896948748 583863628 /nfs/dbraw/zinc/86/36/28/583863628.db2.gz LGWRWLSBCGAEDP-VIFPVBQESA-N 1 2 223.320 2.209 20 0 BEADLO CCCCc1cc(N[C@@H]2CCC[C@@H]2CO)nc[nH+]1 ZINC000896966561 583864837 /nfs/dbraw/zinc/86/48/37/583864837.db2.gz YZJCAPDUIDNIEH-DGCLKSJQSA-N 1 2 249.358 2.392 20 0 BEADLO CCc1cc(NC2CC3(C2)CO[C@@H](C)C3)nc[nH+]1 ZINC000897045458 583872776 /nfs/dbraw/zinc/87/27/76/583872776.db2.gz NKQYBIHHFPGXJH-JKDOVBDQSA-N 1 2 247.342 2.409 20 0 BEADLO CCc1nc(NC2CC3(C2)CO[C@H](C)C3)cc[nH+]1 ZINC000897045941 583872799 /nfs/dbraw/zinc/87/27/99/583872799.db2.gz WOFPQENQOXKXPB-CDWSIMAYSA-N 1 2 247.342 2.409 20 0 BEADLO CO[C@@H]1CC[C@H]1N(C)c1cc[nH+]c(C(C)C)n1 ZINC000897149065 583884416 /nfs/dbraw/zinc/88/44/16/583884416.db2.gz NQDLCLKNCZNGHR-GHMZBOCLSA-N 1 2 235.331 2.214 20 0 BEADLO CCc1cc(N(C)[C@@H]2CC[C@H]2OC)nc(CC)[nH+]1 ZINC000897139967 583884515 /nfs/dbraw/zinc/88/45/15/583884515.db2.gz LSGRGJMHBQNUMI-VXGBXAGGSA-N 1 2 249.358 2.215 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1C[C@H]2CCC[C@@H]21 ZINC000897177233 583889798 /nfs/dbraw/zinc/88/97/98/583889798.db2.gz LVUSDWRDDRPCKG-OUAUKWLOSA-N 1 2 233.315 2.394 20 0 BEADLO Cc1cc(N[C@H](C)Cc2cccnc2)nc[nH+]1 ZINC000897196078 583893902 /nfs/dbraw/zinc/89/39/02/583893902.db2.gz MLMISBFWZUMFHL-LLVKDONJSA-N 1 2 228.299 2.223 20 0 BEADLO Cc1nc(N[C@H]2CCOC23CCCC3)cc[nH+]1 ZINC000897322494 583922343 /nfs/dbraw/zinc/92/23/43/583922343.db2.gz HOBAYXPYQIWJEA-NSHDSACASA-N 1 2 233.315 2.299 20 0 BEADLO C[C@@H]1CC=CC[C@H]1Nc1cc(N(C)C)nc[nH+]1 ZINC000897392765 583948685 /nfs/dbraw/zinc/94/86/85/583948685.db2.gz NFDNIBSCCITZNQ-GHMZBOCLSA-N 1 2 232.331 2.309 20 0 BEADLO C[C@@H]1CC=CC[C@H]1Nc1cc(N(C)C)[nH+]cn1 ZINC000897392765 583948686 /nfs/dbraw/zinc/94/86/86/583948686.db2.gz NFDNIBSCCITZNQ-GHMZBOCLSA-N 1 2 232.331 2.309 20 0 BEADLO CCn1cnn(C[N@@H+]2C[C@@H](C)C[C@H]2C)c1=S ZINC000740858757 583971792 /nfs/dbraw/zinc/97/17/92/583971792.db2.gz GMKNQEQIHLKALG-VHSXEESVSA-N 1 2 240.376 2.122 20 0 BEADLO CCn1cnn(C[N@H+]2C[C@@H](C)C[C@H]2C)c1=S ZINC000740858757 583971794 /nfs/dbraw/zinc/97/17/94/583971794.db2.gz GMKNQEQIHLKALG-VHSXEESVSA-N 1 2 240.376 2.122 20 0 BEADLO Cc1c[nH]c(CNc2cccc3c2OCC3)[nH+]1 ZINC000858231778 588939825 /nfs/dbraw/zinc/93/98/25/588939825.db2.gz QIXHLDDMKDJPKV-UHFFFAOYSA-N 1 2 229.283 2.265 20 0 BEADLO COC(=O)C[C@@H]1CC[C@H](Nc2cccc[nH+]2)C1 ZINC000897544077 584015210 /nfs/dbraw/zinc/01/52/10/584015210.db2.gz GAWXDGCBIIPWFD-MNOVXSKESA-N 1 2 234.299 2.225 20 0 BEADLO Cc1c[nH]c(CNc2cnn(C3CCC3)c2)[nH+]1 ZINC000897878496 584057196 /nfs/dbraw/zinc/05/71/96/584057196.db2.gz GVXXZYZXPWYBLF-UHFFFAOYSA-N 1 2 231.303 2.252 20 0 BEADLO CCn1c[nH+]cc1CNc1cnn(C2CCC2)c1 ZINC000897877270 584057405 /nfs/dbraw/zinc/05/74/05/584057405.db2.gz IOHQAXGJXYCVMO-UHFFFAOYSA-N 1 2 245.330 2.437 20 0 BEADLO CC(C)Cn1cc[nH+]c1CNc1nccnc1F ZINC000858422070 588953523 /nfs/dbraw/zinc/95/35/23/588953523.db2.gz FHAIGNFKHIOYKV-UHFFFAOYSA-N 1 2 249.293 2.080 20 0 BEADLO Cc1nnc(C[NH+]2CC(Cc3ccoc3)C2)s1 ZINC000898159656 584087865 /nfs/dbraw/zinc/08/78/65/584087865.db2.gz AZBDYFURIMUHLX-UHFFFAOYSA-N 1 2 249.339 2.114 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@H](c1ccncc1)C1CC1 ZINC000898326264 584107606 /nfs/dbraw/zinc/10/76/06/584107606.db2.gz UYWCTJGTNOCEPX-AWEZNQCLSA-N 1 2 242.326 2.354 20 0 BEADLO O=C(N[C@@H]1CCn2c[nH+]cc21)C1CCC=CCC1 ZINC000898810032 584159966 /nfs/dbraw/zinc/15/99/66/584159966.db2.gz HLHRQVWUZIWXMP-GFCCVEGCSA-N 1 2 245.326 2.191 20 0 BEADLO CC(C)=C(C)CC(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000898812228 584160124 /nfs/dbraw/zinc/16/01/24/584160124.db2.gz ZMBFXFVCSATFPY-LLVKDONJSA-N 1 2 233.315 2.191 20 0 BEADLO CC(C)(CNC(=O)c1ccsc1)n1cc[nH+]c1 ZINC000898898733 584165029 /nfs/dbraw/zinc/16/50/29/584165029.db2.gz AJVQPBSVOYWBQD-UHFFFAOYSA-N 1 2 249.339 2.110 20 0 BEADLO CCC(C)(C)C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000898902888 584165200 /nfs/dbraw/zinc/16/52/00/584165200.db2.gz UUDHBTPWTTVYNN-UHFFFAOYSA-N 1 2 237.347 2.171 20 0 BEADLO C/C(=C/C(=O)NCC(C)(C)n1cc[nH+]c1)C1CC1 ZINC000898901555 584165353 /nfs/dbraw/zinc/16/53/53/584165353.db2.gz JYNKAJMVZRDFLL-FLIBITNWSA-N 1 2 247.342 2.091 20 0 BEADLO CC(C)(CNC(=O)C1CCCCC1)n1cc[nH+]c1 ZINC000898893926 584165356 /nfs/dbraw/zinc/16/53/56/584165356.db2.gz QXCNWSUMTBEFRP-UHFFFAOYSA-N 1 2 249.358 2.315 20 0 BEADLO Cc1cn(C(C)(C)C(=O)NC2CC(C)(C)C2)c[nH+]1 ZINC000898988379 584168574 /nfs/dbraw/zinc/16/85/74/584168574.db2.gz WGHWXHKPDFUGIK-UHFFFAOYSA-N 1 2 249.358 2.231 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ccns1)c1ccn(C)n1 ZINC000858577927 588968213 /nfs/dbraw/zinc/96/82/13/588968213.db2.gz VWWVVVNDWIUCJD-RKDXNWHRSA-N 1 2 236.344 2.288 20 0 BEADLO Cc1cn2ccc(C(=O)N(C)CCCF)cc2[nH+]1 ZINC000899811768 584238962 /nfs/dbraw/zinc/23/89/62/584238962.db2.gz QAXOSLXDPIECJD-UHFFFAOYSA-N 1 2 249.289 2.074 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N2CCCC[C@H]2C)c[nH+]1 ZINC000899938276 584258863 /nfs/dbraw/zinc/25/88/63/584258863.db2.gz ZMQITKWZTZJJGS-GFCCVEGCSA-N 1 2 249.358 2.328 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N2CCCC[C@@H]2C)c[nH+]1 ZINC000899938277 584259155 /nfs/dbraw/zinc/25/91/55/584259155.db2.gz ZMQITKWZTZJJGS-LBPRGKRZSA-N 1 2 249.358 2.328 20 0 BEADLO CCN(C(=O)Cc1c[nH+]c[nH]1)c1ccc(C)cc1 ZINC000900152509 584282283 /nfs/dbraw/zinc/28/22/83/584282283.db2.gz FAKFJXGBKBASHK-UHFFFAOYSA-N 1 2 243.310 2.314 20 0 BEADLO CCN(C(=O)Cc1c[nH]c[nH+]1)c1ccc(C)cc1 ZINC000900152509 584282284 /nfs/dbraw/zinc/28/22/84/584282284.db2.gz FAKFJXGBKBASHK-UHFFFAOYSA-N 1 2 243.310 2.314 20 0 BEADLO CC[C@@H]1CCCN(C(=O)CNc2cccc[nH+]2)C1 ZINC000900181108 584283165 /nfs/dbraw/zinc/28/31/65/584283165.db2.gz YWNIOJHTDDUMHJ-GFCCVEGCSA-N 1 2 247.342 2.142 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)CNc1cccc[nH+]1 ZINC000900193400 584284938 /nfs/dbraw/zinc/28/49/38/584284938.db2.gz JGTLCNHRXPJNOC-LLVKDONJSA-N 1 2 235.331 2.141 20 0 BEADLO C[C@@H]1CN(C(=O)Cc2c[nH+]c[nH]2)c2ccccc21 ZINC000900218991 584286957 /nfs/dbraw/zinc/28/69/57/584286957.db2.gz PLUNAGYXNLXTAI-SNVBAGLBSA-N 1 2 241.294 2.103 20 0 BEADLO C[C@@H]1CN(C(=O)Cc2c[nH]c[nH+]2)c2ccccc21 ZINC000900218991 584286959 /nfs/dbraw/zinc/28/69/59/584286959.db2.gz PLUNAGYXNLXTAI-SNVBAGLBSA-N 1 2 241.294 2.103 20 0 BEADLO Cc1ccc(N(C)C(=O)Cc2c[nH+]c[nH]2)cc1C ZINC000900290527 584291635 /nfs/dbraw/zinc/29/16/35/584291635.db2.gz OMQSBMNTFFOZQQ-UHFFFAOYSA-N 1 2 243.310 2.232 20 0 BEADLO Cc1ccc(N(C)C(=O)Cc2c[nH]c[nH+]2)cc1C ZINC000900290527 584291637 /nfs/dbraw/zinc/29/16/37/584291637.db2.gz OMQSBMNTFFOZQQ-UHFFFAOYSA-N 1 2 243.310 2.232 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)N1CCC[C@H]1C1CCCC1 ZINC000900312250 584293872 /nfs/dbraw/zinc/29/38/72/584293872.db2.gz ASTCMZSXNPSKOJ-ZDUSSCGKSA-N 1 2 247.342 2.133 20 0 BEADLO CC[C@@H](C)[C@@H](C)NC(=O)CNc1cccc[nH+]1 ZINC000900365666 584296976 /nfs/dbraw/zinc/29/69/76/584296976.db2.gz PVILJBRHRSBEBQ-GHMZBOCLSA-N 1 2 235.331 2.044 20 0 BEADLO CC(C)[C@H]1CCCN1C(=O)CNc1cccc[nH+]1 ZINC000900378357 584299476 /nfs/dbraw/zinc/29/94/76/584299476.db2.gz IIWHSQIEMUNMFD-GFCCVEGCSA-N 1 2 247.342 2.141 20 0 BEADLO CN(CCC1CCCCC1)C(=O)Cc1c[nH+]c[nH]1 ZINC000900495356 584317220 /nfs/dbraw/zinc/31/72/20/584317220.db2.gz OTAITGYKELXSLR-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO CC(C)[C@H]1CCCC[C@@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000900566997 584326379 /nfs/dbraw/zinc/32/63/79/584326379.db2.gz TXVKEJCSBMYRFP-OLZOCXBDSA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)[C@H]1CCCC[C@@H]1NC(=O)Cc1c[nH+]c[nH]1 ZINC000900566997 584326381 /nfs/dbraw/zinc/32/63/81/584326381.db2.gz TXVKEJCSBMYRFP-OLZOCXBDSA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)[C@@H]1CCCC[C@@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000900566999 584326424 /nfs/dbraw/zinc/32/64/24/584326424.db2.gz TXVKEJCSBMYRFP-STQMWFEESA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)[C@@H]1CCCC[C@@H]1NC(=O)Cc1c[nH+]c[nH]1 ZINC000900566999 584326425 /nfs/dbraw/zinc/32/64/25/584326425.db2.gz TXVKEJCSBMYRFP-STQMWFEESA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)[C@H]1CCC[C@H](NC(=O)Cc2c[nH]c[nH+]2)C1 ZINC000900572874 584326866 /nfs/dbraw/zinc/32/68/66/584326866.db2.gz JGQSWGVWPGEUQU-RYUDHWBXSA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)[C@H]1CCC[C@H](NC(=O)Cc2c[nH+]c[nH]2)C1 ZINC000900572874 584326867 /nfs/dbraw/zinc/32/68/67/584326867.db2.gz JGQSWGVWPGEUQU-RYUDHWBXSA-N 1 2 249.358 2.283 20 0 BEADLO CCOC(=O)C1=CC[C@H](Nc2cccc[nH+]2)C1 ZINC000858734985 588975439 /nfs/dbraw/zinc/97/54/39/588975439.db2.gz RIGZHQFHCITGGD-NSHDSACASA-N 1 2 232.283 2.145 20 0 BEADLO Cc1cc(C)[nH+]c(Cn2cc(C3CC3)nn2)c1 ZINC000900624332 584332744 /nfs/dbraw/zinc/33/27/44/584332744.db2.gz GYLJLPBGXDEBOR-UHFFFAOYSA-N 1 2 228.299 2.216 20 0 BEADLO CCCCN(C(=O)Cc1c[nH+]c[nH]1)[C@@H](C)CC ZINC000900631505 584334062 /nfs/dbraw/zinc/33/40/62/584334062.db2.gz MBPUDFIECIBZSN-NSHDSACASA-N 1 2 237.347 2.379 20 0 BEADLO CCC(C)(CC)NC(=O)CNc1cccc[nH+]1 ZINC000900697038 584339896 /nfs/dbraw/zinc/33/98/96/584339896.db2.gz GMIZHPJEVNQOCG-UHFFFAOYSA-N 1 2 235.331 2.188 20 0 BEADLO C[C@H]1CCCC[C@H]1CCNC(=O)Cc1c[nH]c[nH+]1 ZINC000900718086 584344528 /nfs/dbraw/zinc/34/45/28/584344528.db2.gz JSPLGRJNYUDVJZ-RYUDHWBXSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H]1CCCC[C@H]1CCNC(=O)Cc1c[nH+]c[nH]1 ZINC000900718086 584344530 /nfs/dbraw/zinc/34/45/30/584344530.db2.gz JSPLGRJNYUDVJZ-RYUDHWBXSA-N 1 2 249.358 2.285 20 0 BEADLO CCCC[C@@H](CCC)NC(=O)Cc1c[nH]c[nH+]1 ZINC000900953025 584366551 /nfs/dbraw/zinc/36/65/51/584366551.db2.gz AIKYSGMNEAIFQE-LLVKDONJSA-N 1 2 237.347 2.427 20 0 BEADLO CCCC[C@@H](CCC)NC(=O)Cc1c[nH+]c[nH]1 ZINC000900953025 584366553 /nfs/dbraw/zinc/36/65/53/584366553.db2.gz AIKYSGMNEAIFQE-LLVKDONJSA-N 1 2 237.347 2.427 20 0 BEADLO C=C/C(C)=C/CC(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000901001353 584373266 /nfs/dbraw/zinc/37/32/66/584373266.db2.gz VNSKYRFWVDADPB-RMKNXTFCSA-N 1 2 233.315 2.165 20 0 BEADLO Cc1[nH]c(CNC(=O)/C=C/C2CCCC2)[nH+]c1C ZINC000901001014 584373341 /nfs/dbraw/zinc/37/33/41/584373341.db2.gz QLTMUYOQVATGOG-BQYQJAHWSA-N 1 2 247.342 2.389 20 0 BEADLO Cc1[nH]c(CNC(=O)C=CC2CCCC2)[nH+]c1C ZINC000901001014 584373344 /nfs/dbraw/zinc/37/33/44/584373344.db2.gz QLTMUYOQVATGOG-BQYQJAHWSA-N 1 2 247.342 2.389 20 0 BEADLO CCC1(CNC(=O)CNc2cccc[nH+]2)CCC1 ZINC000900992085 584374417 /nfs/dbraw/zinc/37/44/17/584374417.db2.gz TTXUMQZXFPTIJD-UHFFFAOYSA-N 1 2 247.342 2.190 20 0 BEADLO CCC[C@H](C)[C@@H]1CCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC000901116295 584385823 /nfs/dbraw/zinc/38/58/23/584385823.db2.gz CNWCWENLMMTZSY-AAEUAGOBSA-N 1 2 249.358 2.379 20 0 BEADLO CNc1[nH+]c(C)ccc1C(=O)N1CCC=C(F)C1 ZINC000901305294 584419887 /nfs/dbraw/zinc/41/98/87/584419887.db2.gz RPZOWJOPFIZNSN-UHFFFAOYSA-N 1 2 249.289 2.131 20 0 BEADLO CC(C)c1c[nH]c(C=Cc2n[nH]cc2C=O)[nH+]1 ZINC000901464884 584451545 /nfs/dbraw/zinc/45/15/45/584451545.db2.gz PJTWGNPFQSGMAI-ARJAWSKDSA-N 1 2 230.271 2.239 20 0 BEADLO C/C(=C/c1[nH]c(C)c(C)[nH+]1)c1cnccn1 ZINC000901492398 584452970 /nfs/dbraw/zinc/45/29/70/584452970.db2.gz YZBROXLYFXVFBP-VURMDHGXSA-N 1 2 214.272 2.377 20 0 BEADLO CCCOC(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000858943187 588986717 /nfs/dbraw/zinc/98/67/17/588986717.db2.gz GISXCIRMPBOEID-NSHDSACASA-N 1 2 237.303 2.067 20 0 BEADLO CNc1ccc(C)cc1C[NH2+]Cc1cn[nH]c1C ZINC000902065007 584522308 /nfs/dbraw/zinc/52/23/08/584522308.db2.gz XNRFKIKZZBEBAU-UHFFFAOYSA-N 1 2 244.342 2.358 20 0 BEADLO CCOc1ccc(CNc2cc[nH+]cc2F)o1 ZINC000902067570 584523255 /nfs/dbraw/zinc/52/32/55/584523255.db2.gz XLPRPKUCBDCFMG-UHFFFAOYSA-N 1 2 236.246 2.246 20 0 BEADLO CCCc1nccnc1NCc1[nH]c(C)c(C)[nH+]1 ZINC000902134150 584525741 /nfs/dbraw/zinc/52/57/41/584525741.db2.gz BGHYCEOYRMXMPC-UHFFFAOYSA-N 1 2 245.330 2.381 20 0 BEADLO Cc1nc(NCc2ccnn2CC(C)C)cc[nH+]1 ZINC000902124177 584529059 /nfs/dbraw/zinc/52/90/59/584529059.db2.gz CGQMBZVVQVKZIV-UHFFFAOYSA-N 1 2 245.330 2.250 20 0 BEADLO Cc1nc(NCc2cnn(C3CCC3)c2)cc[nH+]1 ZINC000902127122 584529101 /nfs/dbraw/zinc/52/91/01/584529101.db2.gz MQBBXZBEQQNRFD-UHFFFAOYSA-N 1 2 243.314 2.319 20 0 BEADLO Cn1c[nH+]cc1CNc1cnc(C(C)(C)C)nc1 ZINC000902187832 584533527 /nfs/dbraw/zinc/53/35/27/584533527.db2.gz DLORZONIGUFPIZ-UHFFFAOYSA-N 1 2 245.330 2.120 20 0 BEADLO Cc1cc(NCc2c[nH+]cn2C(C)C)ncn1 ZINC000902196115 584536487 /nfs/dbraw/zinc/53/64/87/584536487.db2.gz QXHZKYRPDSMAFS-UHFFFAOYSA-N 1 2 231.303 2.175 20 0 BEADLO Cc1cc(NCc2ccnn2C(C)C)nc[nH+]1 ZINC000902196131 584536619 /nfs/dbraw/zinc/53/66/19/584536619.db2.gz RREDXOHFOSFQIC-UHFFFAOYSA-N 1 2 231.303 2.175 20 0 BEADLO CN(C)c1ccc(Cn2cc(Cl)cn2)c[nH+]1 ZINC000902223469 584540785 /nfs/dbraw/zinc/54/07/85/584540785.db2.gz VGJOOGFVIPCACY-UHFFFAOYSA-N 1 2 236.706 2.046 20 0 BEADLO CCn1cnc(C[NH2+][C@H](C)c2c(C)noc2C)c1 ZINC000902243210 584545481 /nfs/dbraw/zinc/54/54/81/584545481.db2.gz KQQBZUYEEVGSJT-SECBINFHSA-N 1 2 248.330 2.359 20 0 BEADLO Cc1[nH]c(CNc2cnc(F)c(F)c2)[nH+]c1C ZINC000902287278 584548188 /nfs/dbraw/zinc/54/81/88/584548188.db2.gz XVSYFCJJQZIWOZ-UHFFFAOYSA-N 1 2 238.241 2.312 20 0 BEADLO CCCn1cc(NCc2cn(CC)c[nH+]2)cn1 ZINC000902339092 584556785 /nfs/dbraw/zinc/55/67/85/584556785.db2.gz QRQLOYFRTDHNST-UHFFFAOYSA-N 1 2 233.319 2.122 20 0 BEADLO CCc1[nH+]c(C)ccc1OCc1cnn(CC)n1 ZINC000902352839 584569492 /nfs/dbraw/zinc/56/94/92/584569492.db2.gz BOLBRSKMCFYMQP-UHFFFAOYSA-N 1 2 246.314 2.143 20 0 BEADLO CCCOC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000859057189 588995112 /nfs/dbraw/zinc/99/51/12/588995112.db2.gz BUQZTWXBPCUAFW-SNVBAGLBSA-N 1 2 237.303 2.483 20 0 BEADLO CCn1c[nH+]c(CNc2cnn(CC(C)C)c2)c1 ZINC000902421510 584592321 /nfs/dbraw/zinc/59/23/21/584592321.db2.gz OHFHPNYXVRZZOO-UHFFFAOYSA-N 1 2 247.346 2.368 20 0 BEADLO CNc1ccccc1C[NH2+]Cc1nnc(C)s1 ZINC000902466931 584614906 /nfs/dbraw/zinc/61/49/06/584614906.db2.gz OWZIRIIERAKVIK-UHFFFAOYSA-N 1 2 248.355 2.178 20 0 BEADLO Nc1nc(C[NH2+][C@@H]2CCCc3occc32)cs1 ZINC000902499288 584619695 /nfs/dbraw/zinc/61/96/95/584619695.db2.gz MQGSRAQXGNXQRC-SNVBAGLBSA-N 1 2 249.339 2.486 20 0 BEADLO C[C@H]([NH2+]Cc1csc(N)n1)c1ccoc1 ZINC000902487051 584625856 /nfs/dbraw/zinc/62/58/56/584625856.db2.gz AWIOFKVOJYZPSQ-ZETCQYMHSA-N 1 2 223.301 2.169 20 0 BEADLO c1cc(CCSCCn2cc[nH+]c2)sn1 ZINC000902569072 584636210 /nfs/dbraw/zinc/63/62/10/584636210.db2.gz NBWVFZDKJNLZFX-UHFFFAOYSA-N 1 2 239.369 2.316 20 0 BEADLO CCc1nc(C)c(C[NH2+]Cc2cn(CC)cn2)o1 ZINC000902575049 584637203 /nfs/dbraw/zinc/63/72/03/584637203.db2.gz URCIGOUVXGCYTP-UHFFFAOYSA-N 1 2 248.330 2.052 20 0 BEADLO CSCCO[NH+]=C(N)Cc1ccccc1F ZINC000902623708 584640220 /nfs/dbraw/zinc/64/02/20/584640220.db2.gz VKFNJZVUBXOINF-UHFFFAOYSA-N 1 2 242.319 2.230 20 0 BEADLO NC(COC1CCC1)=[NH+]OC1CC2(CCC2)C1 ZINC000902613046 584643672 /nfs/dbraw/zinc/64/36/72/584643672.db2.gz LIDIWCZCFYVDHQ-UHFFFAOYSA-N 1 2 238.331 2.387 20 0 BEADLO CCCO[NH+]=C(N)Cc1ccccc1F ZINC000902622535 584645416 /nfs/dbraw/zinc/64/54/16/584645416.db2.gz GEUSSHBTIHHKNW-UHFFFAOYSA-N 1 2 210.252 2.277 20 0 BEADLO CCn1cnc(C[NH2+]Cc2ccc(C)o2)c1 ZINC000902633642 584647529 /nfs/dbraw/zinc/64/75/29/584647529.db2.gz WYIVNGPKMBUILQ-UHFFFAOYSA-N 1 2 219.288 2.094 20 0 BEADLO CC(C)NC(=O)COc1ccc2c[nH+]ccc2c1 ZINC000902635795 584648705 /nfs/dbraw/zinc/64/87/05/584648705.db2.gz FEBKAFWUJBWHHL-UHFFFAOYSA-N 1 2 244.294 2.138 20 0 BEADLO CC[C@H]1c2ccccc2C[N@H+]1CN1CCC1=O ZINC000902669820 584654292 /nfs/dbraw/zinc/65/42/92/584654292.db2.gz KWDQAQJEOCNRIN-ZDUSSCGKSA-N 1 2 230.311 2.143 20 0 BEADLO CC[C@H]1c2ccccc2C[N@@H+]1CN1CCC1=O ZINC000902669820 584654293 /nfs/dbraw/zinc/65/42/93/584654293.db2.gz KWDQAQJEOCNRIN-ZDUSSCGKSA-N 1 2 230.311 2.143 20 0 BEADLO COC/C(C)=C/CO[NH+]=C(N)c1ccccc1C ZINC000902685159 584655725 /nfs/dbraw/zinc/65/57/25/584655725.db2.gz FGRRYWMXWFQNDR-DHZHZOJOSA-N 1 2 248.326 2.434 20 0 BEADLO CCn1cnc(C[NH2+][C@@H](C)c2cncs2)c1 ZINC000902689657 584656602 /nfs/dbraw/zinc/65/66/02/584656602.db2.gz MTHYLWQYHTUYBK-VIFPVBQESA-N 1 2 236.344 2.210 20 0 BEADLO C[C@H]1OCC[C@H]1COc1ccc2c(c1)[nH+]cn2C ZINC000902781125 584670261 /nfs/dbraw/zinc/67/02/61/584670261.db2.gz GBOWRXWYZUCSDM-MNOVXSKESA-N 1 2 246.310 2.377 20 0 BEADLO Cc1cccc(F)c1C[NH2+][C@@H](C)c1cn(C)nn1 ZINC000902821679 584675697 /nfs/dbraw/zinc/67/56/97/584675697.db2.gz KHGOFQZANIZFLT-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1ccnc(F)c1 ZINC000859078227 588998303 /nfs/dbraw/zinc/99/83/03/588998303.db2.gz ZKUXZMYISQIKDX-JQWIXIFHSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1ccnc(F)c1 ZINC000859078227 588998304 /nfs/dbraw/zinc/99/83/04/588998304.db2.gz ZKUXZMYISQIKDX-JQWIXIFHSA-N 1 2 238.306 2.220 20 0 BEADLO CCc1ncc(C[N@@H+]2CCC[C@H](F)C2)o1 ZINC000902991267 584709574 /nfs/dbraw/zinc/70/95/74/584709574.db2.gz MOHJGOKNODSMHA-VIFPVBQESA-N 1 2 212.268 2.171 20 0 BEADLO CCc1ncc(C[N@H+]2CCC[C@H](F)C2)o1 ZINC000902991267 584709575 /nfs/dbraw/zinc/70/95/75/584709575.db2.gz MOHJGOKNODSMHA-VIFPVBQESA-N 1 2 212.268 2.171 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+]2CCC[C@H](F)C2)cn1 ZINC000902992643 584710889 /nfs/dbraw/zinc/71/08/89/584710889.db2.gz MIGMTEQRYHGOEX-MNOVXSKESA-N 1 2 223.295 2.280 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+]2CCC[C@H](F)C2)cn1 ZINC000902992643 584710890 /nfs/dbraw/zinc/71/08/90/584710890.db2.gz MIGMTEQRYHGOEX-MNOVXSKESA-N 1 2 223.295 2.280 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@H](F)C2)nc(C)n1 ZINC000902993727 584711311 /nfs/dbraw/zinc/71/13/11/584711311.db2.gz WOYHBXQLQBUVIO-NSHDSACASA-N 1 2 223.295 2.027 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@H](F)C2)nc(C)n1 ZINC000902993727 584711312 /nfs/dbraw/zinc/71/13/12/584711312.db2.gz WOYHBXQLQBUVIO-NSHDSACASA-N 1 2 223.295 2.027 20 0 BEADLO Fc1cccc(C[N@H+]2CCC[C@@H](F)C2)n1 ZINC000902993525 584711885 /nfs/dbraw/zinc/71/18/85/584711885.db2.gz SWAWRXPDRCKOEC-SECBINFHSA-N 1 2 212.243 2.155 20 0 BEADLO Fc1cccc(C[N@@H+]2CCC[C@@H](F)C2)n1 ZINC000902993525 584711886 /nfs/dbraw/zinc/71/18/86/584711886.db2.gz SWAWRXPDRCKOEC-SECBINFHSA-N 1 2 212.243 2.155 20 0 BEADLO CCC(C)(C)NC(=O)[C@@H](C)[N@@H+]1CCC[C@H](F)C1 ZINC000903001706 584716207 /nfs/dbraw/zinc/71/62/07/584716207.db2.gz PUJLJNVUKTZNTL-MNOVXSKESA-N 1 2 244.354 2.114 20 0 BEADLO CCC(C)(C)NC(=O)[C@@H](C)[N@H+]1CCC[C@H](F)C1 ZINC000903001706 584716208 /nfs/dbraw/zinc/71/62/08/584716208.db2.gz PUJLJNVUKTZNTL-MNOVXSKESA-N 1 2 244.354 2.114 20 0 BEADLO CCCN(CCC)C(=O)C[N@@H+]1CCC[C@H](F)C1 ZINC000903002789 584716323 /nfs/dbraw/zinc/71/63/23/584716323.db2.gz HNHPMXAHKXOYBU-LBPRGKRZSA-N 1 2 244.354 2.069 20 0 BEADLO CCCN(CCC)C(=O)C[N@H+]1CCC[C@H](F)C1 ZINC000903002789 584716325 /nfs/dbraw/zinc/71/63/25/584716325.db2.gz HNHPMXAHKXOYBU-LBPRGKRZSA-N 1 2 244.354 2.069 20 0 BEADLO O[C@H](C[N@@H+]1CCC[C@@H](F)C1)c1cccc(F)c1 ZINC000903002051 584716349 /nfs/dbraw/zinc/71/63/49/584716349.db2.gz VCQHRNGCKJHKPH-CHWSQXEVSA-N 1 2 241.281 2.293 20 0 BEADLO O[C@H](C[N@H+]1CCC[C@@H](F)C1)c1cccc(F)c1 ZINC000903002051 584716351 /nfs/dbraw/zinc/71/63/51/584716351.db2.gz VCQHRNGCKJHKPH-CHWSQXEVSA-N 1 2 241.281 2.293 20 0 BEADLO CC(C)[C@@H]([NH2+][C@H](C)c1ccco1)c1nncn1C ZINC000903061237 584722971 /nfs/dbraw/zinc/72/29/71/584722971.db2.gz LQCFGAVSMVAPRO-ZYHUDNBSSA-N 1 2 248.330 2.456 20 0 BEADLO C[C@H](N[C@H](c1ncccn1)C1CC1)c1[nH]cc[nH+]1 ZINC000903323092 584746822 /nfs/dbraw/zinc/74/68/22/584746822.db2.gz AKYBZPKUHVRTBP-ONGXEEELSA-N 1 2 243.314 2.002 20 0 BEADLO C[C@H](N[C@@H](c1ncccn1)C1CC1)c1[nH]cc[nH+]1 ZINC000903323089 584747006 /nfs/dbraw/zinc/74/70/06/584747006.db2.gz AKYBZPKUHVRTBP-GXSJLCMTSA-N 1 2 243.314 2.002 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCn2ccnc21)c1cncs1 ZINC000903312588 584747989 /nfs/dbraw/zinc/74/79/89/584747989.db2.gz WYSVCVARKCQCLE-DTWKUNHWSA-N 1 2 234.328 2.135 20 0 BEADLO Cn1c[nH+]c(CN[C@H]2CCCc3scnc32)c1 ZINC000903352910 584755833 /nfs/dbraw/zinc/75/58/33/584755833.db2.gz WQUKTJQDVLLTFY-JTQLQIEISA-N 1 2 248.355 2.044 20 0 BEADLO Cn1cnc(C[NH2+][C@H]2CCCc3scnc32)c1 ZINC000903352910 584755835 /nfs/dbraw/zinc/75/58/35/584755835.db2.gz WQUKTJQDVLLTFY-JTQLQIEISA-N 1 2 248.355 2.044 20 0 BEADLO CCCn1cc([C@@H](C)[NH2+]C/C=C/Cl)nn1 ZINC000903444096 584768934 /nfs/dbraw/zinc/76/89/34/584768934.db2.gz MRHHDTFGSSSDED-XNPJLODASA-N 1 2 228.727 2.091 20 0 BEADLO CC(C)n1cc([C@H](C)[NH2+]C/C=C/Cl)nn1 ZINC000903446566 584770078 /nfs/dbraw/zinc/77/00/78/584770078.db2.gz YLVVESSIVVHFGK-MOVJSRMASA-N 1 2 228.727 2.262 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1noc(C2(C)CCC2)n1 ZINC000904270048 584858585 /nfs/dbraw/zinc/85/85/85/584858585.db2.gz VLHZPVFZHPLUAE-UHFFFAOYSA-N 1 2 244.298 2.464 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1noc(C(C)C)n1 ZINC000904273048 584858598 /nfs/dbraw/zinc/85/85/98/584858598.db2.gz PQRBWCLSKXPLPF-UHFFFAOYSA-N 1 2 218.260 2.146 20 0 BEADLO Cc1ccc(F)c(C[NH+]2CC(O)(C(C)C)C2)c1 ZINC000829290607 584906791 /nfs/dbraw/zinc/90/67/91/584906791.db2.gz CRUPZMHBTXXJHF-UHFFFAOYSA-N 1 2 237.318 2.337 20 0 BEADLO FC(F)(F)Cn1cc[nH+]c1CN1CC[C@@H]2C[C@@H]21 ZINC000761091728 584909663 /nfs/dbraw/zinc/90/96/63/584909663.db2.gz JKDGSZCHFDZWHL-BDAKNGLRSA-N 1 2 245.248 2.040 20 0 BEADLO FC(F)(F)Cn1ccnc1C[N@@H+]1CC[C@@H]2C[C@@H]21 ZINC000761091728 584909664 /nfs/dbraw/zinc/90/96/64/584909664.db2.gz JKDGSZCHFDZWHL-BDAKNGLRSA-N 1 2 245.248 2.040 20 0 BEADLO FC(F)(F)Cn1ccnc1C[N@H+]1CC[C@@H]2C[C@@H]21 ZINC000761091728 584909665 /nfs/dbraw/zinc/90/96/65/584909665.db2.gz JKDGSZCHFDZWHL-BDAKNGLRSA-N 1 2 245.248 2.040 20 0 BEADLO Cc1ccc(NC(=O)C[N@@H+]2CC[C@@H]3C[C@@H]32)c(F)c1 ZINC000761091580 584909696 /nfs/dbraw/zinc/90/96/96/584909696.db2.gz VUJGQBDKGDZWLM-MFKMUULPSA-N 1 2 248.301 2.167 20 0 BEADLO Cc1ccc(NC(=O)C[N@H+]2CC[C@@H]3C[C@@H]32)c(F)c1 ZINC000761091580 584909697 /nfs/dbraw/zinc/90/96/97/584909697.db2.gz VUJGQBDKGDZWLM-MFKMUULPSA-N 1 2 248.301 2.167 20 0 BEADLO CC[C@@H](C)N1CC[NH+](CCC(=O)C(C)C)CC1 ZINC000832188366 584911124 /nfs/dbraw/zinc/91/11/24/584911124.db2.gz ZFANLJJDHMJOCD-CYBMUJFWSA-N 1 2 240.391 2.018 20 0 BEADLO CCC/C(C)=C/C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000732094930 584933780 /nfs/dbraw/zinc/93/37/80/584933780.db2.gz VAGLPZLQPYFAQZ-CSKARUKUSA-N 1 2 221.304 2.115 20 0 BEADLO O[C@@H](COc1ccc(-n2cc[nH+]c2)cc1)C1CC1 ZINC000840753386 584941523 /nfs/dbraw/zinc/94/15/23/584941523.db2.gz PVDDAJZTFGGQKI-AWEZNQCLSA-N 1 2 244.294 2.022 20 0 BEADLO CC(C)=CC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000733878492 584954008 /nfs/dbraw/zinc/95/40/08/584954008.db2.gz IIQDFIYTFQEYOJ-UHFFFAOYSA-N 1 2 215.256 2.239 20 0 BEADLO CC(C)OCCC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000733969177 584955976 /nfs/dbraw/zinc/95/59/76/584955976.db2.gz CGQIWNBRHDHDBC-UHFFFAOYSA-N 1 2 247.298 2.088 20 0 BEADLO Cc1nonc1C[N@H+](C)CCc1ccccc1F ZINC000734149368 584957879 /nfs/dbraw/zinc/95/78/79/584957879.db2.gz JHMIKPKEUINYEP-UHFFFAOYSA-N 1 2 249.289 2.192 20 0 BEADLO Cc1nonc1C[N@@H+](C)CCc1ccccc1F ZINC000734149368 584957880 /nfs/dbraw/zinc/95/78/80/584957880.db2.gz JHMIKPKEUINYEP-UHFFFAOYSA-N 1 2 249.289 2.192 20 0 BEADLO CCc1nc(NCCC2(COC)CC2)cc[nH+]1 ZINC000884541739 584959036 /nfs/dbraw/zinc/95/90/36/584959036.db2.gz MIYUXEVSXLNFGN-UHFFFAOYSA-N 1 2 235.331 2.268 20 0 BEADLO c1ccc(N2CC[C@H]([C@@H]3CCCO3)C2)[nH+]c1 ZINC000884731308 584962981 /nfs/dbraw/zinc/96/29/81/584962981.db2.gz WLNGAVBOFNSYMA-RYUDHWBXSA-N 1 2 218.300 2.087 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OCC1CCOCC1 ZINC000735488454 584977859 /nfs/dbraw/zinc/97/78/59/584977859.db2.gz NGYGEAJEZOYCKY-UHFFFAOYSA-N 1 2 248.326 2.268 20 0 BEADLO c1[nH]cc(CCc2nc(-c3ccccc3)no2)[nH+]1 ZINC000351027474 585011446 /nfs/dbraw/zinc/01/14/46/585011446.db2.gz MLSLDSADQJJVIM-UHFFFAOYSA-N 1 2 240.266 2.245 20 0 BEADLO c1[nH]c(CCc2nc(-c3ccccc3)no2)c[nH+]1 ZINC000351027474 585011447 /nfs/dbraw/zinc/01/14/47/585011447.db2.gz MLSLDSADQJJVIM-UHFFFAOYSA-N 1 2 240.266 2.245 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1C(=O)OCc1c[nH+]cn1C ZINC000774140791 585027222 /nfs/dbraw/zinc/02/72/22/585027222.db2.gz UZUXWKWHXKXPQZ-WCQYABFASA-N 1 2 236.315 2.146 20 0 BEADLO CCc1cc(Nc2c[nH]nc2C)nc(C)[nH+]1 ZINC000180431162 585033112 /nfs/dbraw/zinc/03/31/12/585033112.db2.gz ONMYMGCGJHKTOM-UHFFFAOYSA-N 1 2 217.276 2.123 20 0 BEADLO CCOC(=O)CC(C)(C)CNc1cccc[nH+]1 ZINC000838908903 585077639 /nfs/dbraw/zinc/07/76/39/585077639.db2.gz NXDPAZMHNBPBEG-UHFFFAOYSA-N 1 2 236.315 2.473 20 0 BEADLO CCn1ncc(C[NH2+][C@H](C)c2ccc(F)cc2)n1 ZINC000838891029 585078744 /nfs/dbraw/zinc/07/87/44/585078744.db2.gz RXONGMPJFWLKGJ-SNVBAGLBSA-N 1 2 248.305 2.288 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)OCc1ccc[nH+]c1N(C)C ZINC000838957199 585080859 /nfs/dbraw/zinc/08/08/59/585080859.db2.gz YPSIBABMCADHHP-ZYHUDNBSSA-N 1 2 248.326 2.237 20 0 BEADLO CCn1ncc(C[NH2+]C2(c3ccccc3)CC2)n1 ZINC000838931354 585081435 /nfs/dbraw/zinc/08/14/35/585081435.db2.gz CFCMJMRCBRMDIG-UHFFFAOYSA-N 1 2 242.326 2.077 20 0 BEADLO CCn1ncc(C[NH2+]Cc2c(C)cccc2F)n1 ZINC000838968664 585082915 /nfs/dbraw/zinc/08/29/15/585082915.db2.gz QVQAOBBNSISRTH-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO C[S@@](=O)CC[N@@H+]1Cc2ccc(Cl)cc2C1 ZINC000839194457 585097664 /nfs/dbraw/zinc/09/76/64/585097664.db2.gz QKWVGTSNHHQHCK-OAHLLOKOSA-N 1 2 243.759 2.034 20 0 BEADLO C[S@@](=O)CC[N@H+]1Cc2ccc(Cl)cc2C1 ZINC000839194457 585097665 /nfs/dbraw/zinc/09/76/65/585097665.db2.gz QKWVGTSNHHQHCK-OAHLLOKOSA-N 1 2 243.759 2.034 20 0 BEADLO C[C@@H]([NH2+]C/C(Cl)=C/Cl)c1ccn(C)n1 ZINC000839195750 585098574 /nfs/dbraw/zinc/09/85/74/585098574.db2.gz GSSJAFADFYRIBG-BESBCXERSA-N 1 2 234.130 2.390 20 0 BEADLO Clc1ncc(C[N@@H+]2C[C@@H]3C[C@H]2CS3)s1 ZINC000839201454 585099645 /nfs/dbraw/zinc/09/96/45/585099645.db2.gz LCKQAUNQTLHUNZ-BQBZGAKWSA-N 1 2 246.788 2.486 20 0 BEADLO Clc1ncc(C[N@H+]2C[C@@H]3C[C@H]2CS3)s1 ZINC000839201454 585099646 /nfs/dbraw/zinc/09/96/46/585099646.db2.gz LCKQAUNQTLHUNZ-BQBZGAKWSA-N 1 2 246.788 2.486 20 0 BEADLO CC(C)c1nc(N[C@@H](CCO)C2CC2)cc[nH+]1 ZINC000741243345 585111708 /nfs/dbraw/zinc/11/17/08/585111708.db2.gz YLQVIIZYEJWYTM-NSHDSACASA-N 1 2 235.331 2.173 20 0 BEADLO C[N@H+](Cn1nc2ccccn2c1=S)C1CCC1 ZINC000742172983 585122581 /nfs/dbraw/zinc/12/25/81/585122581.db2.gz LIMPYKPOQPRKHN-UHFFFAOYSA-N 1 2 248.355 2.307 20 0 BEADLO C[N@@H+](Cn1nc2ccccn2c1=S)C1CCC1 ZINC000742172983 585122582 /nfs/dbraw/zinc/12/25/82/585122582.db2.gz LIMPYKPOQPRKHN-UHFFFAOYSA-N 1 2 248.355 2.307 20 0 BEADLO Cc1noc(C)c1CN(C)c1cc[nH+]c(C)n1 ZINC000742254820 585124345 /nfs/dbraw/zinc/12/43/45/585124345.db2.gz SDTGREIZDOEKSK-UHFFFAOYSA-N 1 2 232.287 2.026 20 0 BEADLO CSCCCO[NH+]=C(N)c1cccc(F)c1 ZINC000742356840 585124808 /nfs/dbraw/zinc/12/48/08/585124808.db2.gz XOFWFOGLWCVENT-UHFFFAOYSA-N 1 2 242.319 2.425 20 0 BEADLO C/C(=C/C(=O)NCCCn1cc[nH+]c1)C(C)(C)C ZINC000742466223 585126888 /nfs/dbraw/zinc/12/68/88/585126888.db2.gz SUUWCYXREMCRGB-BENRWUELSA-N 1 2 249.358 2.382 20 0 BEADLO C/C(=C\C(=O)N[C@@H](C)Cn1cc[nH+]c1)C(C)(C)C ZINC000742544720 585127950 /nfs/dbraw/zinc/12/79/50/585127950.db2.gz ROYFIMNBHYGKTE-OBIHZWKSSA-N 1 2 249.358 2.380 20 0 BEADLO Cc1ccc([C@H](C)C(=O)Nc2cc[nH+]cc2C)o1 ZINC000742647309 585129380 /nfs/dbraw/zinc/12/93/80/585129380.db2.gz KNXPBOPLENPJFL-NSHDSACASA-N 1 2 244.294 2.456 20 0 BEADLO Cn1c(Cl)cnc1C[N@@H+]1CCC1(C)C ZINC000746463984 585168427 /nfs/dbraw/zinc/16/84/27/585168427.db2.gz ZQDKLYDSVDQJQO-UHFFFAOYSA-N 1 2 213.712 2.058 20 0 BEADLO Cn1c(Cl)cnc1C[N@H+]1CCC1(C)C ZINC000746463984 585168428 /nfs/dbraw/zinc/16/84/28/585168428.db2.gz ZQDKLYDSVDQJQO-UHFFFAOYSA-N 1 2 213.712 2.058 20 0 BEADLO FCC[NH+]1CCN(C/C=C/c2ccccc2)CC1 ZINC000746500482 585169069 /nfs/dbraw/zinc/16/90/69/585169069.db2.gz BINQWSGHIKCJII-QPJJXVBHSA-N 1 2 248.345 2.287 20 0 BEADLO C[C@H]1C[N@H+](CCF)C[C@H](c2ccccc2)O1 ZINC000746503910 585169154 /nfs/dbraw/zinc/16/91/54/585169154.db2.gz PMMSYVULLVRROE-WCQYABFASA-N 1 2 223.291 2.418 20 0 BEADLO C[C@H]1C[N@@H+](CCF)C[C@H](c2ccccc2)O1 ZINC000746503910 585169155 /nfs/dbraw/zinc/16/91/55/585169155.db2.gz PMMSYVULLVRROE-WCQYABFASA-N 1 2 223.291 2.418 20 0 BEADLO CCC/C(C)=C/C(=O)NC[C@H](C)Cn1cc[nH+]c1 ZINC000747400741 585178607 /nfs/dbraw/zinc/17/86/07/585178607.db2.gz MFZIIDNRGPSZLG-RPHSKFLZSA-N 1 2 249.358 2.382 20 0 BEADLO CCC/C(C)=C/C(=O)NC[C@@H](C)Cn1cc[nH+]c1 ZINC000747400742 585178657 /nfs/dbraw/zinc/17/86/57/585178657.db2.gz MFZIIDNRGPSZLG-YQCJOKCJSA-N 1 2 249.358 2.382 20 0 BEADLO C[C@@H](CNC(=O)C=C1CCCC1)Cn1cc[nH+]c1 ZINC000747401302 585178692 /nfs/dbraw/zinc/17/86/92/585178692.db2.gz VOUDJFZRFZWIOJ-LBPRGKRZSA-N 1 2 247.342 2.136 20 0 BEADLO C[C@@H]1c2ccccc2C[N@H+]1CN1CCOC1=S ZINC000747461608 585179072 /nfs/dbraw/zinc/17/90/72/585179072.db2.gz GIRFNQFOPJDUQP-SNVBAGLBSA-N 1 2 248.351 2.138 20 0 BEADLO C[C@@H]1c2ccccc2C[N@@H+]1CN1CCOC1=S ZINC000747461608 585179073 /nfs/dbraw/zinc/17/90/73/585179073.db2.gz GIRFNQFOPJDUQP-SNVBAGLBSA-N 1 2 248.351 2.138 20 0 BEADLO Cn1c[nH+]cc1COC(=O)/C=C/C(C)(C)C ZINC000747779040 585184244 /nfs/dbraw/zinc/18/42/44/585184244.db2.gz AULYGBJWQUSWNW-AATRIKPKSA-N 1 2 222.288 2.066 20 0 BEADLO Cc1ccc(C(=O)OCc2c[nH+]cn2C)cc1C ZINC000747780840 585184363 /nfs/dbraw/zinc/18/43/63/585184363.db2.gz JZGWKVQEHLTJNN-UHFFFAOYSA-N 1 2 244.294 2.394 20 0 BEADLO COc1cc[nH+]cc1NC(=S)NC(C)(C)C ZINC000748156791 585188306 /nfs/dbraw/zinc/18/83/06/585188306.db2.gz IWLQBYCRXLMCIT-UHFFFAOYSA-N 1 2 239.344 2.175 20 0 BEADLO CC(C)c1cnc(C[N@@H+]2CCCOC[C@H]2C)o1 ZINC000749512778 585203210 /nfs/dbraw/zinc/20/32/10/585203210.db2.gz CGCXVCLTHWDVJB-LLVKDONJSA-N 1 2 238.331 2.409 20 0 BEADLO CC(C)c1cnc(C[N@H+]2CCCOC[C@H]2C)o1 ZINC000749512778 585203211 /nfs/dbraw/zinc/20/32/11/585203211.db2.gz CGCXVCLTHWDVJB-LLVKDONJSA-N 1 2 238.331 2.409 20 0 BEADLO CO[C@@H](C)CC(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC000749565420 585204021 /nfs/dbraw/zinc/20/40/21/585204021.db2.gz PCSOKXJMRGRSMU-QMMMGPOBSA-N 1 2 247.298 2.235 20 0 BEADLO C[N@@H+](Cc1cnccn1)C[C@H]1CC1(Cl)Cl ZINC000750185481 585211989 /nfs/dbraw/zinc/21/19/89/585211989.db2.gz PVWKYOPZTMWPJP-MRVPVSSYSA-N 1 2 246.141 2.102 20 0 BEADLO C[N@H+](Cc1cnccn1)C[C@H]1CC1(Cl)Cl ZINC000750185481 585211990 /nfs/dbraw/zinc/21/19/90/585211990.db2.gz PVWKYOPZTMWPJP-MRVPVSSYSA-N 1 2 246.141 2.102 20 0 BEADLO Cl/C=C(/Cl)C[N@@H+]1CCc2cn[nH]c2C1 ZINC000750722575 585218819 /nfs/dbraw/zinc/21/88/19/585218819.db2.gz RTKSBFPLVNXYOT-FPYGCLRLSA-N 1 2 232.114 2.087 20 0 BEADLO Cl/C=C(/Cl)C[N@H+]1CCc2cn[nH]c2C1 ZINC000750722575 585218820 /nfs/dbraw/zinc/21/88/20/585218820.db2.gz RTKSBFPLVNXYOT-FPYGCLRLSA-N 1 2 232.114 2.087 20 0 BEADLO C/C=C(\C)C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000751424676 585230307 /nfs/dbraw/zinc/23/03/07/585230307.db2.gz FUZWUSVROBRSHM-XCVCLJGOSA-N 1 2 233.315 2.082 20 0 BEADLO C/C=C(\C)C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000751424676 585230308 /nfs/dbraw/zinc/23/03/08/585230308.db2.gz FUZWUSVROBRSHM-XCVCLJGOSA-N 1 2 233.315 2.082 20 0 BEADLO C[C@H]1CCC[N@@H+]1Cn1nc2ccccn2c1=S ZINC000751926778 585239134 /nfs/dbraw/zinc/23/91/34/585239134.db2.gz WRQWLVYUEKEWTB-JTQLQIEISA-N 1 2 248.355 2.307 20 0 BEADLO C[C@H]1CCC[N@H+]1Cn1nc2ccccn2c1=S ZINC000751926778 585239135 /nfs/dbraw/zinc/23/91/35/585239135.db2.gz WRQWLVYUEKEWTB-JTQLQIEISA-N 1 2 248.355 2.307 20 0 BEADLO CCCCCCC(=O)Nc1cc[nH+]cc1N(C)C ZINC000753475907 585259603 /nfs/dbraw/zinc/25/96/03/585259603.db2.gz VOWYUKPUFGEWRB-UHFFFAOYSA-N 1 2 249.358 2.478 20 0 BEADLO C[N@H+](CCC(=O)C(C)(C)C)Cc1ccon1 ZINC000753721422 585267082 /nfs/dbraw/zinc/26/70/82/585267082.db2.gz BDIHEHNJUJLOIW-UHFFFAOYSA-N 1 2 224.304 2.112 20 0 BEADLO C[N@@H+](CCC(=O)C(C)(C)C)Cc1ccon1 ZINC000753721422 585267083 /nfs/dbraw/zinc/26/70/83/585267083.db2.gz BDIHEHNJUJLOIW-UHFFFAOYSA-N 1 2 224.304 2.112 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OC/C=C\c1ccccc1 ZINC000754296419 585282422 /nfs/dbraw/zinc/28/24/22/585282422.db2.gz QTHVOJNQNFPGIA-WDDYJBPVSA-N 1 2 234.299 2.233 20 0 BEADLO C[C@H]1CCN(c2[nH+]cnc3[nH]c(Cl)cc32)C1 ZINC000754677370 585289083 /nfs/dbraw/zinc/28/90/83/585289083.db2.gz YGWQUXNDBQEXJY-ZETCQYMHSA-N 1 2 236.706 2.409 20 0 BEADLO Cn1c[nH+]cc1COC(=O)CCC1CCC1 ZINC000754684828 585289391 /nfs/dbraw/zinc/28/93/91/585289391.db2.gz LHDCPRPENVMHMQ-UHFFFAOYSA-N 1 2 222.288 2.044 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)/C=C\C2CC2)c1 ZINC000757714168 585344705 /nfs/dbraw/zinc/34/47/05/585344705.db2.gz MZGLOROZAQBCIL-WAYWQWQTSA-N 1 2 247.294 2.408 20 0 BEADLO Cc1ccc(Cl)c(N(C)Cc2[nH]cc[nH+]2)n1 ZINC000757920833 585346978 /nfs/dbraw/zinc/34/69/78/585346978.db2.gz ODOBMVZEIUBBSM-UHFFFAOYSA-N 1 2 236.706 2.403 20 0 BEADLO FCC[N@@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000759330830 585368004 /nfs/dbraw/zinc/36/80/04/585368004.db2.gz SQXXJWYJEQWZIT-LBPRGKRZSA-N 1 2 227.279 2.230 20 0 BEADLO FCC[N@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000759330830 585368005 /nfs/dbraw/zinc/36/80/05/585368005.db2.gz SQXXJWYJEQWZIT-LBPRGKRZSA-N 1 2 227.279 2.230 20 0 BEADLO C[C@@H]1CO[C@@H](c2ccccc2)C[N@@H+]1CCF ZINC000759340170 585368867 /nfs/dbraw/zinc/36/88/67/585368867.db2.gz SHJBXFFHAFAUQG-DGCLKSJQSA-N 1 2 223.291 2.418 20 0 BEADLO C[C@@H]1CO[C@@H](c2ccccc2)C[N@H+]1CCF ZINC000759340170 585368868 /nfs/dbraw/zinc/36/88/68/585368868.db2.gz SHJBXFFHAFAUQG-DGCLKSJQSA-N 1 2 223.291 2.418 20 0 BEADLO CN(CCF)Cc1[nH+]ccn1Cc1ccccc1 ZINC000759346787 585370043 /nfs/dbraw/zinc/37/00/43/585370043.db2.gz JNHUBDLINRTHEE-UHFFFAOYSA-N 1 2 247.317 2.333 20 0 BEADLO C[C@H]1C[N@H+](CCF)[C@H](c2ccccc2)CO1 ZINC000759347593 585370679 /nfs/dbraw/zinc/37/06/79/585370679.db2.gz REKRESIGWJJLKV-AAEUAGOBSA-N 1 2 223.291 2.418 20 0 BEADLO C[C@H]1C[N@@H+](CCF)[C@H](c2ccccc2)CO1 ZINC000759347593 585370680 /nfs/dbraw/zinc/37/06/80/585370680.db2.gz REKRESIGWJJLKV-AAEUAGOBSA-N 1 2 223.291 2.418 20 0 BEADLO CCC[C@@H]([NH2+][C@H](C)c1ccc[nH]1)C(=O)OCC ZINC000760249071 585387401 /nfs/dbraw/zinc/38/74/01/585387401.db2.gz KYJSXITTXOGXGX-ZYHUDNBSSA-N 1 2 238.331 2.397 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CC[C@@H](C(F)(F)F)C2)o1 ZINC000761053941 585404580 /nfs/dbraw/zinc/40/45/80/585404580.db2.gz IFJVCAOXTJXZRD-POYBYMJQSA-N 1 2 249.236 2.323 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CC[C@@H](C(F)(F)F)C2)o1 ZINC000761053941 585404581 /nfs/dbraw/zinc/40/45/81/585404581.db2.gz IFJVCAOXTJXZRD-POYBYMJQSA-N 1 2 249.236 2.323 20 0 BEADLO O[C@H](C[N@@H+]1CCC[C@H]1C(F)F)c1ccccc1 ZINC000761121956 585410800 /nfs/dbraw/zinc/41/08/00/585410800.db2.gz ZOJLGYHOMPRMAT-NWDGAFQWSA-N 1 2 241.281 2.450 20 0 BEADLO O[C@H](C[N@H+]1CCC[C@H]1C(F)F)c1ccccc1 ZINC000761121956 585410801 /nfs/dbraw/zinc/41/08/01/585410801.db2.gz ZOJLGYHOMPRMAT-NWDGAFQWSA-N 1 2 241.281 2.450 20 0 BEADLO CCC/C(C)=C/C(=O)NCCNc1cccc[nH+]1 ZINC000762796732 585437259 /nfs/dbraw/zinc/43/72/59/585437259.db2.gz OTNSSAWFRJIUAT-VAWYXSNFSA-N 1 2 247.342 2.356 20 0 BEADLO CC(C)OCC(N)=[NH+]OC/C(Cl)=C\Cl ZINC000763178626 585444301 /nfs/dbraw/zinc/44/43/01/585444301.db2.gz DFFAXYDSHJSREL-XVNBXDOJSA-N 1 2 241.118 2.229 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@H](C)Cc1ccccc1C ZINC000763285757 585445869 /nfs/dbraw/zinc/44/58/69/585445869.db2.gz TVNQTBDGMMQCDT-OLZOCXBDSA-N 1 2 249.354 2.467 20 0 BEADLO CCOC(=O)C[N@H+]1Cc2ccccc2[C@H](C)C1 ZINC000763622330 585451236 /nfs/dbraw/zinc/45/12/36/585451236.db2.gz CGZQOENPDSBWDN-LLVKDONJSA-N 1 2 233.311 2.169 20 0 BEADLO CCOC(=O)C[N@@H+]1Cc2ccccc2[C@H](C)C1 ZINC000763622330 585451237 /nfs/dbraw/zinc/45/12/37/585451237.db2.gz CGZQOENPDSBWDN-LLVKDONJSA-N 1 2 233.311 2.169 20 0 BEADLO CCOC(=O)C1([N@H+](C)CCF)CCCCC1 ZINC000763660345 585451505 /nfs/dbraw/zinc/45/15/05/585451505.db2.gz WEVDMISZSROBHZ-UHFFFAOYSA-N 1 2 231.311 2.154 20 0 BEADLO CCOC(=O)C1([N@@H+](C)CCF)CCCCC1 ZINC000763660345 585451506 /nfs/dbraw/zinc/45/15/06/585451506.db2.gz WEVDMISZSROBHZ-UHFFFAOYSA-N 1 2 231.311 2.154 20 0 BEADLO FC(F)C1CC[NH+](Cn2cc(Cl)cn2)CC1 ZINC000765145219 585482056 /nfs/dbraw/zinc/48/20/56/585482056.db2.gz AGMHDRPOJAROBC-UHFFFAOYSA-N 1 2 249.692 2.471 20 0 BEADLO CCOC(=O)C[N@H+](C/C=C/Cl)C1CCC1 ZINC000767873264 585527217 /nfs/dbraw/zinc/52/72/17/585527217.db2.gz AFPYXHGDKKOAGT-QPJJXVBHSA-N 1 2 231.723 2.157 20 0 BEADLO CCOC(=O)C[N@@H+](C/C=C/Cl)C1CCC1 ZINC000767873264 585527218 /nfs/dbraw/zinc/52/72/18/585527218.db2.gz AFPYXHGDKKOAGT-QPJJXVBHSA-N 1 2 231.723 2.157 20 0 BEADLO CC/C=C(/C)C(=O)OCc1c[nH+]ccc1OC ZINC000805358940 585530942 /nfs/dbraw/zinc/53/09/42/585530942.db2.gz VEFOJKLDRYCEJO-YHYXMXQVSA-N 1 2 235.283 2.490 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@@H](C)C2)c(C)o1 ZINC000768228425 585534077 /nfs/dbraw/zinc/53/40/77/585534077.db2.gz IXNKYHKAXVSJRA-JTQLQIEISA-N 1 2 209.289 2.117 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@@H](C)C2)c(C)o1 ZINC000768228425 585534078 /nfs/dbraw/zinc/53/40/78/585534078.db2.gz IXNKYHKAXVSJRA-JTQLQIEISA-N 1 2 209.289 2.117 20 0 BEADLO CCCCCCNc1nc(N(C)C)nc(C)[nH+]1 ZINC000768523063 585539519 /nfs/dbraw/zinc/53/95/19/585539519.db2.gz XDLXWRFHPPHJNN-UHFFFAOYSA-N 1 2 237.351 2.238 20 0 BEADLO CCCCCCNc1nc(C)[nH+]c(N(C)C)n1 ZINC000768523063 585539520 /nfs/dbraw/zinc/53/95/20/585539520.db2.gz XDLXWRFHPPHJNN-UHFFFAOYSA-N 1 2 237.351 2.238 20 0 BEADLO COc1cc[nH+]cc1COC(=O)c1ccoc1C ZINC000805370071 585541137 /nfs/dbraw/zinc/54/11/37/585541137.db2.gz HOXVJRCHRVINNT-UHFFFAOYSA-N 1 2 247.250 2.349 20 0 BEADLO c1cc([C@H]2CCC[N@@H+](Cc3ccoc3)C2)[nH]n1 ZINC000768893489 585545704 /nfs/dbraw/zinc/54/57/04/585545704.db2.gz WSVGFMQYKKOPIU-LBPRGKRZSA-N 1 2 231.299 2.382 20 0 BEADLO c1cc([C@H]2CCC[N@H+](Cc3ccoc3)C2)[nH]n1 ZINC000768893489 585545705 /nfs/dbraw/zinc/54/57/05/585545705.db2.gz WSVGFMQYKKOPIU-LBPRGKRZSA-N 1 2 231.299 2.382 20 0 BEADLO CCCCCO[NH+]=C(N)COC(C)(C)C ZINC000768932870 585546200 /nfs/dbraw/zinc/54/62/00/585546200.db2.gz QSPXZAUUIQZLGG-UHFFFAOYSA-N 1 2 216.325 2.490 20 0 BEADLO CC/C=C/CCO[NH+]=C(N)COC(C)C ZINC000768926501 585546235 /nfs/dbraw/zinc/54/62/35/585546235.db2.gz KIJMXSNHIWSVAG-AATRIKPKSA-N 1 2 214.309 2.266 20 0 BEADLO O=C(OCCn1cc[nH+]c1)[C@H](F)c1ccccc1 ZINC000769171053 585550491 /nfs/dbraw/zinc/55/04/91/585550491.db2.gz ZOLWTDHOQMPVBO-GFCCVEGCSA-N 1 2 248.257 2.137 20 0 BEADLO CCC/C=C/C(=O)N(C)CCCn1cc[nH+]c1 ZINC000769306420 585553278 /nfs/dbraw/zinc/55/32/78/585553278.db2.gz GWJOCEBEAPUNAZ-FNORWQNLSA-N 1 2 235.331 2.088 20 0 BEADLO CCN1CC[N@@H+](Cc2cc(C)oc2C)C[C@H]1C ZINC000769380492 585555099 /nfs/dbraw/zinc/55/50/99/585555099.db2.gz JJJULODAHLAYGQ-LLVKDONJSA-N 1 2 236.359 2.422 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H](F)c1ccccc1 ZINC000769374826 585555183 /nfs/dbraw/zinc/55/51/83/585555183.db2.gz JRTOSDTVFIVMOR-CYBMUJFWSA-N 1 2 244.269 2.461 20 0 BEADLO Fc1cccc2c1CC[N@H+](Cc1cn[nH]c1)C2 ZINC000769388218 585555216 /nfs/dbraw/zinc/55/52/16/585555216.db2.gz RDUVBCCNAHHENG-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO Fc1cccc2c1CC[N@@H+](Cc1cn[nH]c1)C2 ZINC000769388218 585555217 /nfs/dbraw/zinc/55/52/17/585555217.db2.gz RDUVBCCNAHHENG-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO C[C@@H]1CSCC[N@@H+]1Cc1coc(C2CC2)n1 ZINC000769429288 585556492 /nfs/dbraw/zinc/55/64/92/585556492.db2.gz WUAFVWVFFIRGQK-SECBINFHSA-N 1 2 238.356 2.489 20 0 BEADLO C[C@@H]1CSCC[N@H+]1Cc1coc(C2CC2)n1 ZINC000769429288 585556493 /nfs/dbraw/zinc/55/64/93/585556493.db2.gz WUAFVWVFFIRGQK-SECBINFHSA-N 1 2 238.356 2.489 20 0 BEADLO CC1(C)CC[N@@H+]1Cc1cn2cccc(F)c2n1 ZINC000769447234 585556955 /nfs/dbraw/zinc/55/69/55/585556955.db2.gz WZRSEDDXLVGPKB-UHFFFAOYSA-N 1 2 233.290 2.458 20 0 BEADLO CC1(C)CC[N@H+]1Cc1cn2cccc(F)c2n1 ZINC000769447234 585556956 /nfs/dbraw/zinc/55/69/56/585556956.db2.gz WZRSEDDXLVGPKB-UHFFFAOYSA-N 1 2 233.290 2.458 20 0 BEADLO C[C@@H]1COCC[N@H+](Cc2coc(C3CC3)n2)C1 ZINC000769458017 585557455 /nfs/dbraw/zinc/55/74/55/585557455.db2.gz YERQBJOOLBNNMT-JTQLQIEISA-N 1 2 236.315 2.020 20 0 BEADLO C[C@@H]1COCC[N@@H+](Cc2coc(C3CC3)n2)C1 ZINC000769458017 585557456 /nfs/dbraw/zinc/55/74/56/585557456.db2.gz YERQBJOOLBNNMT-JTQLQIEISA-N 1 2 236.315 2.020 20 0 BEADLO C[C@H]1COCC[N@H+](Cc2coc(C3CC3)n2)C1 ZINC000769458019 585557648 /nfs/dbraw/zinc/55/76/48/585557648.db2.gz YERQBJOOLBNNMT-SNVBAGLBSA-N 1 2 236.315 2.020 20 0 BEADLO C[C@H]1COCC[N@@H+](Cc2coc(C3CC3)n2)C1 ZINC000769458019 585557649 /nfs/dbraw/zinc/55/76/49/585557649.db2.gz YERQBJOOLBNNMT-SNVBAGLBSA-N 1 2 236.315 2.020 20 0 BEADLO C[C@@H]1COCCC[N@@H+]1Cc1coc(C2CC2)n1 ZINC000769457163 585557727 /nfs/dbraw/zinc/55/77/27/585557727.db2.gz NZFJOASEFGGBKI-SNVBAGLBSA-N 1 2 236.315 2.163 20 0 BEADLO C[C@@H]1COCCC[N@H+]1Cc1coc(C2CC2)n1 ZINC000769457163 585557728 /nfs/dbraw/zinc/55/77/28/585557728.db2.gz NZFJOASEFGGBKI-SNVBAGLBSA-N 1 2 236.315 2.163 20 0 BEADLO CC(C)[C@H]1C[N@H+](Cc2ccnc(F)c2)CCO1 ZINC000859239424 589023277 /nfs/dbraw/zinc/02/32/77/589023277.db2.gz OKBYDEKFWKOEGU-GFCCVEGCSA-N 1 2 238.306 2.078 20 0 BEADLO CC(C)[C@H]1C[N@@H+](Cc2ccnc(F)c2)CCO1 ZINC000859239424 589023279 /nfs/dbraw/zinc/02/32/79/589023279.db2.gz OKBYDEKFWKOEGU-GFCCVEGCSA-N 1 2 238.306 2.078 20 0 BEADLO CCC(CC)NC(=O)c1cccc2[nH+]ccn21 ZINC000770052633 585570221 /nfs/dbraw/zinc/57/02/21/585570221.db2.gz JTABODXKMZAXAR-UHFFFAOYSA-N 1 2 231.299 2.253 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)c1nccs1 ZINC000770531472 585575671 /nfs/dbraw/zinc/57/56/71/585575671.db2.gz MQTIKQPWJCBRFY-UHFFFAOYSA-N 1 2 244.279 2.043 20 0 BEADLO C/C=C(/C)C(=O)Nc1cccc2[nH+]ccn21 ZINC000770565733 585576642 /nfs/dbraw/zinc/57/66/42/585576642.db2.gz BNBWYDYOAABQPD-OQFOIZHKSA-N 1 2 215.256 2.239 20 0 BEADLO C[C@H]1C[C@H]1C(=O)OCc1cccc2[nH+]ccn21 ZINC000770733472 585580612 /nfs/dbraw/zinc/58/06/12/585580612.db2.gz MLKPAYMRYUKYFU-GXSJLCMTSA-N 1 2 230.267 2.034 20 0 BEADLO O=C(/C=C/C1CC1)OCc1cccc2[nH+]ccn21 ZINC000770931193 585584658 /nfs/dbraw/zinc/58/46/58/585584658.db2.gz SMXMDJDSIZKPOA-VOTSOKGWSA-N 1 2 242.278 2.344 20 0 BEADLO Cc1ccc(COC(=O)C(C)C)c(C)[nH+]1 ZINC000771882124 585603240 /nfs/dbraw/zinc/60/32/40/585603240.db2.gz QVTZNUZNGBIFEY-UHFFFAOYSA-N 1 2 207.273 2.398 20 0 BEADLO C[C@H](C(=O)OCCn1cc[nH+]c1)C1CCCC1 ZINC000771993332 585606356 /nfs/dbraw/zinc/60/63/56/585606356.db2.gz IBLPWGRUHBEWIQ-NSHDSACASA-N 1 2 236.315 2.253 20 0 BEADLO O=C(OCCn1cc[nH+]c1)C(F)=C1CCCC1 ZINC000772003855 585606596 /nfs/dbraw/zinc/60/65/96/585606596.db2.gz NFLNZKRKXFWOCE-UHFFFAOYSA-N 1 2 238.262 2.224 20 0 BEADLO C[C@@H]1CC/C(=C\C(=O)OCCn2cc[nH+]c2)C1 ZINC000771999728 585606621 /nfs/dbraw/zinc/60/66/21/585606621.db2.gz GWPYMGWSUUPZQQ-LWMMSDEHSA-N 1 2 234.299 2.173 20 0 BEADLO CCc1cc(C)c(C(=O)OCCn2cc[nH+]c2)o1 ZINC000772001714 585606703 /nfs/dbraw/zinc/60/67/03/585606703.db2.gz KADPFRZYEGBCSR-UHFFFAOYSA-N 1 2 248.282 2.204 20 0 BEADLO COC1(C(=O)OCc2ccc(C)[nH+]c2C)CCC1 ZINC000772260193 585611278 /nfs/dbraw/zinc/61/12/78/585611278.db2.gz VSQQCUWRCCDHHU-UHFFFAOYSA-N 1 2 249.310 2.311 20 0 BEADLO C[C@@H](CC(C)(C)C)C(=O)OCCn1cc[nH+]c1 ZINC000772612131 585619200 /nfs/dbraw/zinc/61/92/00/585619200.db2.gz OKMKHRMYUKFRHY-NSHDSACASA-N 1 2 238.331 2.499 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000772900402 585627050 /nfs/dbraw/zinc/62/70/50/585627050.db2.gz YHAJUIFZFDZOLO-CSKARUKUSA-N 1 2 235.331 2.361 20 0 BEADLO C/C(=C/C(C)(C)C)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000772994009 585629317 /nfs/dbraw/zinc/62/93/17/585629317.db2.gz KUSCRYADUJLXPP-XFFZJAGNSA-N 1 2 247.342 2.259 20 0 BEADLO COc1cc[nH+]cc1COC(=O)C1=CCCC1 ZINC000805496579 585646394 /nfs/dbraw/zinc/64/63/94/585646394.db2.gz VYZKNCHOTKRCLB-UHFFFAOYSA-N 1 2 233.267 2.244 20 0 BEADLO C[N@@H+]1CCCC[C@H]1C(=O)OCc1ccsc1 ZINC000774106808 585650576 /nfs/dbraw/zinc/65/05/76/585650576.db2.gz SBVHGOZJFYXHEE-NSHDSACASA-N 1 2 239.340 2.276 20 0 BEADLO C[N@H+]1CCCC[C@H]1C(=O)OCc1ccsc1 ZINC000774106808 585650577 /nfs/dbraw/zinc/65/05/77/585650577.db2.gz SBVHGOZJFYXHEE-NSHDSACASA-N 1 2 239.340 2.276 20 0 BEADLO COc1cc[nH+]cc1COC(=O)/C=C/SC ZINC000805502246 585651446 /nfs/dbraw/zinc/65/14/46/585651446.db2.gz AKHGFHOZTOVKLS-GQCTYLIASA-N 1 2 239.296 2.010 20 0 BEADLO COc1cc[nH+]cc1COC(=O)[C@H]1[C@@H]2CCC[C@@H]21 ZINC000805524065 585666116 /nfs/dbraw/zinc/66/61/16/585666116.db2.gz HXRHUGIUCPTIJH-PJXYFTJBSA-N 1 2 247.294 2.180 20 0 BEADLO COc1cc[nH+]cc1COC(=O)[C@H](F)C(C)C ZINC000805533884 585672591 /nfs/dbraw/zinc/67/25/91/585672591.db2.gz AJZVREDPCSEABI-LLVKDONJSA-N 1 2 241.262 2.128 20 0 BEADLO CCCN(C(=O)c1cccc2[nH+]ccn21)C1CC1 ZINC000775909665 585687394 /nfs/dbraw/zinc/68/73/94/585687394.db2.gz VBJLVOPDNULPEI-UHFFFAOYSA-N 1 2 243.310 2.349 20 0 BEADLO CCC[C@H](C)NC(=O)c1cccc2[nH+]ccn21 ZINC000776736447 585703694 /nfs/dbraw/zinc/70/36/94/585703694.db2.gz PWBFSEJWAXSDOW-JTQLQIEISA-N 1 2 231.299 2.253 20 0 BEADLO CC[C@@H](C)[C@H](C)NC(=O)c1cccc2[nH+]ccn21 ZINC000776851465 585706114 /nfs/dbraw/zinc/70/61/14/585706114.db2.gz CEXFHKDNBFBBQN-MNOVXSKESA-N 1 2 245.326 2.499 20 0 BEADLO CC1(NC(=O)c2cccc3[nH+]ccn32)CCCC1 ZINC000776889699 585706471 /nfs/dbraw/zinc/70/64/71/585706471.db2.gz FOHLERMKHRNZJE-UHFFFAOYSA-N 1 2 243.310 2.397 20 0 BEADLO CCc1noc(C)c1[C@@H](C)[NH2+]Cc1cocn1 ZINC000777034808 585707255 /nfs/dbraw/zinc/70/72/55/585707255.db2.gz AIWAZMGHZIGIBI-MRVPVSSYSA-N 1 2 235.287 2.384 20 0 BEADLO C[C@@H]1CC[C@@H](C)N1C(=O)c1cccc2[nH+]ccn21 ZINC000777013603 585707283 /nfs/dbraw/zinc/70/72/83/585707283.db2.gz ZOEOYPSHJRQKPW-GHMZBOCLSA-N 1 2 243.310 2.347 20 0 BEADLO CCCCOC(=O)[C@H](C)[N@@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000778230838 585728247 /nfs/dbraw/zinc/72/82/47/585728247.db2.gz CKZMGMPOVPXPBY-SRVKXCTJSA-N 1 2 245.338 2.398 20 0 BEADLO CCCCOC(=O)[C@H](C)[N@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000778230838 585728248 /nfs/dbraw/zinc/72/82/48/585728248.db2.gz CKZMGMPOVPXPBY-SRVKXCTJSA-N 1 2 245.338 2.398 20 0 BEADLO O=C1C[C@@H](c2ccccc2)N1C[N@H+]1CC=CCC1 ZINC000778577706 585737692 /nfs/dbraw/zinc/73/76/92/585737692.db2.gz WPNOYOVSYFHHJJ-AWEZNQCLSA-N 1 2 242.322 2.179 20 0 BEADLO O=C1C[C@@H](c2ccccc2)N1C[N@@H+]1CC=CCC1 ZINC000778577706 585737693 /nfs/dbraw/zinc/73/76/93/585737693.db2.gz WPNOYOVSYFHHJJ-AWEZNQCLSA-N 1 2 242.322 2.179 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@]23CCOC3=O)c(C)o1 ZINC000779198255 585747147 /nfs/dbraw/zinc/74/71/47/585747147.db2.gz BXYNSMQETJKMBN-AWEZNQCLSA-N 1 2 249.310 2.178 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@]23CCOC3=O)c(C)o1 ZINC000779198255 585747148 /nfs/dbraw/zinc/74/71/48/585747148.db2.gz BXYNSMQETJKMBN-AWEZNQCLSA-N 1 2 249.310 2.178 20 0 BEADLO C[C@H](CCO)Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000779420620 585754721 /nfs/dbraw/zinc/75/47/21/585754721.db2.gz YONVADUSVMQOIM-GFCCVEGCSA-N 1 2 249.358 2.255 20 0 BEADLO CC/C(C)=C(/C)C(=O)N(C)Cc1[nH+]ccn1C ZINC000779754582 585761180 /nfs/dbraw/zinc/76/11/80/585761180.db2.gz PPLBJMIVCVFLGB-KHPPLWFESA-N 1 2 235.331 2.125 20 0 BEADLO CC/C(C)=C(\C)C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000780893101 585785942 /nfs/dbraw/zinc/78/59/42/585785942.db2.gz TWLGCJSONMHUPJ-KPMWUXBGSA-N 1 2 235.331 2.134 20 0 BEADLO CC/C(C)=C(/C)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000780944019 585786953 /nfs/dbraw/zinc/78/69/53/585786953.db2.gz QSUFTQYXLRBIQG-KHPPLWFESA-N 1 2 233.315 2.013 20 0 BEADLO CC/C(C)=C(/C)C(=O)NC[C@H](C)Cn1cc[nH+]c1 ZINC000780951377 585787068 /nfs/dbraw/zinc/78/70/68/585787068.db2.gz WUDOYGYNVGERPV-IBPBOOLHSA-N 1 2 249.358 2.382 20 0 BEADLO CC/C(C)=C(/C)C(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000780986521 585787979 /nfs/dbraw/zinc/78/79/79/585787979.db2.gz NIZRIIMNMLMHIA-JUDLJHIGSA-N 1 2 247.342 2.130 20 0 BEADLO CCC(C)=C(C)C(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000780986521 585787980 /nfs/dbraw/zinc/78/79/80/585787980.db2.gz NIZRIIMNMLMHIA-JUDLJHIGSA-N 1 2 247.342 2.130 20 0 BEADLO CC(C)(C)CC(=O)OCCCn1cc[nH+]c1 ZINC000782023771 585806819 /nfs/dbraw/zinc/80/68/19/585806819.db2.gz RWNKMDSVBTZNMJ-UHFFFAOYSA-N 1 2 224.304 2.253 20 0 BEADLO CC[C@@H](C)C(=O)OCc1cc[nH+]c(N(C)C)c1 ZINC000782146676 585808437 /nfs/dbraw/zinc/80/84/37/585808437.db2.gz ISWQJTXGZUDLDW-SNVBAGLBSA-N 1 2 236.315 2.237 20 0 BEADLO Cc1cn2c(n1)C[N@@H+](C/C(Cl)=C/Cl)CC2 ZINC000782521173 585819727 /nfs/dbraw/zinc/81/97/27/585819727.db2.gz ZVZPUSGCYKADMI-WTKPLQERSA-N 1 2 246.141 2.326 20 0 BEADLO Cc1cn2c(n1)C[N@H+](C/C(Cl)=C/Cl)CC2 ZINC000782521173 585819728 /nfs/dbraw/zinc/81/97/28/585819728.db2.gz ZVZPUSGCYKADMI-WTKPLQERSA-N 1 2 246.141 2.326 20 0 BEADLO Cc1nccnc1[C@H](C)[NH2+]Cc1cccc(F)n1 ZINC000783261308 585832518 /nfs/dbraw/zinc/83/25/18/585832518.db2.gz DTCYSMLDWUEUQK-JTQLQIEISA-N 1 2 246.289 2.170 20 0 BEADLO CN1c2cc([NH2+]CCC3CC3)ccc2OCC1=O ZINC000783567879 585837240 /nfs/dbraw/zinc/83/72/40/585837240.db2.gz YUTYBKHGLRSTRW-UHFFFAOYSA-N 1 2 246.310 2.254 20 0 BEADLO O=C(CCCc1ccsc1)NCc1c[nH+]c[nH]1 ZINC000783581580 585837474 /nfs/dbraw/zinc/83/74/74/585837474.db2.gz AKBKUSWKHHTPSJ-UHFFFAOYSA-N 1 2 249.339 2.110 20 0 BEADLO O=C(CCCc1ccsc1)NCc1c[nH]c[nH+]1 ZINC000783581580 585837475 /nfs/dbraw/zinc/83/74/75/585837475.db2.gz AKBKUSWKHHTPSJ-UHFFFAOYSA-N 1 2 249.339 2.110 20 0 BEADLO CC(C)(C)/C=C\C(=O)OCCCn1cc[nH+]c1 ZINC000783633197 585838879 /nfs/dbraw/zinc/83/88/79/585838879.db2.gz IIOYPUFPKUMTMA-WAYWQWQTSA-N 1 2 236.315 2.419 20 0 BEADLO O=C(c1cccc2[nH+]ccn21)N1CCC=C(F)C1 ZINC000783658653 585839713 /nfs/dbraw/zinc/83/97/13/585839713.db2.gz KXDMAARQRTWRGW-UHFFFAOYSA-N 1 2 245.257 2.034 20 0 BEADLO C[C@H](C(=O)OCCCn1cc[nH+]c1)C(C)(C)C ZINC000783682776 585839946 /nfs/dbraw/zinc/83/99/46/585839946.db2.gz OOGJOHSKMKUZLF-LLVKDONJSA-N 1 2 238.331 2.499 20 0 BEADLO CCC1(C(=O)OCCCn2cc[nH+]c2)CCC1 ZINC000784053382 585848078 /nfs/dbraw/zinc/84/80/78/585848078.db2.gz DWYXXBDDPMBAPC-UHFFFAOYSA-N 1 2 236.315 2.397 20 0 BEADLO Cc1cc(NC(=O)[C@H](F)C(C)C)c(C)c[nH+]1 ZINC000784145177 585851580 /nfs/dbraw/zinc/85/15/80/585851580.db2.gz NKVZGTMEFKWNCF-LLVKDONJSA-N 1 2 224.279 2.053 20 0 BEADLO C[N@H+](CC(F)(F)C(F)F)[C@H]1CC[C@H](O)CC1 ZINC000784397127 585858654 /nfs/dbraw/zinc/85/86/54/585858654.db2.gz ZYJTYECHGHDJEA-ZKCHVHJHSA-N 1 2 243.244 2.122 20 0 BEADLO C[N@@H+](CC(F)(F)C(F)F)[C@H]1CC[C@H](O)CC1 ZINC000784397127 585858655 /nfs/dbraw/zinc/85/86/55/585858655.db2.gz ZYJTYECHGHDJEA-ZKCHVHJHSA-N 1 2 243.244 2.122 20 0 BEADLO CCC/C=C/C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000785421866 585873233 /nfs/dbraw/zinc/87/32/33/585873233.db2.gz VQZPZDVVMQBOBV-VQCYPWCPSA-N 1 2 221.304 2.333 20 0 BEADLO CCCC=CC(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000785421866 585873234 /nfs/dbraw/zinc/87/32/34/585873234.db2.gz VQZPZDVVMQBOBV-VQCYPWCPSA-N 1 2 221.304 2.333 20 0 BEADLO NC(=[NH+]OCc1ccc(F)cn1)c1ccccc1 ZINC000786732312 585896766 /nfs/dbraw/zinc/89/67/66/585896766.db2.gz NNFQQMXIIRDSPE-UHFFFAOYSA-N 1 2 245.257 2.267 20 0 BEADLO CCCCCC[N@@H+]1C[C@H](O)CC(F)(F)C1 ZINC000787368504 585907947 /nfs/dbraw/zinc/90/79/47/585907947.db2.gz NQGMWGWOCURTCO-SNVBAGLBSA-N 1 2 221.291 2.269 20 0 BEADLO CCCCCC[N@H+]1C[C@H](O)CC(F)(F)C1 ZINC000787368504 585907948 /nfs/dbraw/zinc/90/79/48/585907948.db2.gz NQGMWGWOCURTCO-SNVBAGLBSA-N 1 2 221.291 2.269 20 0 BEADLO CC1(C)C[NH+](C[C@@H](O)c2c(F)cccc2F)C1 ZINC000788433542 585923166 /nfs/dbraw/zinc/92/31/66/585923166.db2.gz BSVYOSQCAGRRDO-LLVKDONJSA-N 1 2 241.281 2.340 20 0 BEADLO C[C@H]1CN(c2ccccc2F)CC[N@@H+]1CCF ZINC000789497240 585943453 /nfs/dbraw/zinc/94/34/53/585943453.db2.gz JKKUHGNRXIOZFF-NSHDSACASA-N 1 2 240.297 2.306 20 0 BEADLO C[C@H]1CN(c2ccccc2F)CC[N@H+]1CCF ZINC000789497240 585943454 /nfs/dbraw/zinc/94/34/54/585943454.db2.gz JKKUHGNRXIOZFF-NSHDSACASA-N 1 2 240.297 2.306 20 0 BEADLO CC(C)(C)OCC(N)=[NH+]OCCCCCF ZINC000789589177 585944985 /nfs/dbraw/zinc/94/49/85/585944985.db2.gz BWCMZZHEYPMMCW-UHFFFAOYSA-N 1 2 234.315 2.440 20 0 BEADLO C[C@@H]1CCC[C@H](CO[NH+]=C(N)[C@H]2CCCO2)C1 ZINC000789608542 585946301 /nfs/dbraw/zinc/94/63/01/585946301.db2.gz KMIHTKOCLACRKJ-GRYCIOLGSA-N 1 2 240.347 2.490 20 0 BEADLO CC(C)(C)CCCO[NH+]=C(N)[C@@H]1CCCO1 ZINC000789609922 585946528 /nfs/dbraw/zinc/94/65/28/585946528.db2.gz KFPFKVYXJXUHTR-JTQLQIEISA-N 1 2 228.336 2.490 20 0 BEADLO Cc1ccc(C)c(CO[NH+]=C(N)[C@@H]2CCCO2)c1 ZINC000789612065 585946608 /nfs/dbraw/zinc/94/66/08/585946608.db2.gz SBHIIWAMBCWQNR-ZDUSSCGKSA-N 1 2 248.326 2.481 20 0 BEADLO CC(C)(C)CCO[NH+]=C(N)[C@@H]1CCCO1 ZINC000789612056 585946616 /nfs/dbraw/zinc/94/66/16/585946616.db2.gz RZQQTEITXVGNEM-VIFPVBQESA-N 1 2 214.309 2.100 20 0 BEADLO NC(=[NH+]OCCC1CCCC1)[C@@H]1CCCO1 ZINC000789626015 585947302 /nfs/dbraw/zinc/94/73/02/585947302.db2.gz CALYHRJRNTVQRQ-NSHDSACASA-N 1 2 226.320 2.244 20 0 BEADLO Nc1cc(COC(=O)C=C2CCCC2)cc[nH+]1 ZINC000791763155 585987631 /nfs/dbraw/zinc/98/76/31/585987631.db2.gz VWMABAZKHYVVTO-UHFFFAOYSA-N 1 2 232.283 2.207 20 0 BEADLO C[C@H](C(=O)OCc1cc[nH+]c(N)c1)C(C)(C)C ZINC000791910219 585991167 /nfs/dbraw/zinc/99/11/67/585991167.db2.gz AGQUWUNAXVXQPV-SECBINFHSA-N 1 2 236.315 2.389 20 0 BEADLO CC[C@@H](C)[C@H](C)C(=O)OCCc1c[nH+]cn1C ZINC000793253877 586015163 /nfs/dbraw/zinc/01/51/63/586015163.db2.gz UHJCBGSKKHWPGH-MNOVXSKESA-N 1 2 238.331 2.188 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)OCCc1c[nH+]cn1C ZINC000793253881 586015210 /nfs/dbraw/zinc/01/52/10/586015210.db2.gz UHJCBGSKKHWPGH-WDEREUQCSA-N 1 2 238.331 2.188 20 0 BEADLO O=C(CCC(F)F)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000793771410 586026342 /nfs/dbraw/zinc/02/63/42/586026342.db2.gz VGDYFDKFWRLPNZ-MRVPVSSYSA-N 1 2 243.257 2.119 20 0 BEADLO CC[C@H]1CC[N@@H+]1Cn1ccc(C(F)(F)F)n1 ZINC000793821751 586027571 /nfs/dbraw/zinc/02/75/71/586027571.db2.gz SBAWRAHFCHMDDR-QMMMGPOBSA-N 1 2 233.237 2.344 20 0 BEADLO CC[C@H]1CC[N@H+]1Cn1ccc(C(F)(F)F)n1 ZINC000793821751 586027572 /nfs/dbraw/zinc/02/75/72/586027572.db2.gz SBAWRAHFCHMDDR-QMMMGPOBSA-N 1 2 233.237 2.344 20 0 BEADLO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1cnc[nH]1 ZINC000796443540 586103311 /nfs/dbraw/zinc/10/33/11/586103311.db2.gz RPMZOBXLSWJINS-CYBMUJFWSA-N 1 2 230.315 2.085 20 0 BEADLO Cn1cccc1[C@H]1CCC[N@H+]1Cc1cnc[nH]1 ZINC000796443540 586103312 /nfs/dbraw/zinc/10/33/12/586103312.db2.gz RPMZOBXLSWJINS-CYBMUJFWSA-N 1 2 230.315 2.085 20 0 BEADLO Cc1csc([C@@H]([NH2+]Cc2cnc[nH]2)C2CC2)n1 ZINC000796451181 586103900 /nfs/dbraw/zinc/10/39/00/586103900.db2.gz RJYSAZRMBXHECP-NSHDSACASA-N 1 2 248.355 2.416 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCCc2[nH]ncc21)c1ccc[nH]1 ZINC000796845219 586114738 /nfs/dbraw/zinc/11/47/38/586114738.db2.gz HDHVGCNRDVHKPS-JOYOIKCWSA-N 1 2 230.315 2.466 20 0 BEADLO COc1ccc(N[C@H]2CCCc3n[nH]cc32)[nH+]c1 ZINC000796890232 586116434 /nfs/dbraw/zinc/11/64/34/586116434.db2.gz NVDHLPDRAOHMMY-NSHDSACASA-N 1 2 244.298 2.303 20 0 BEADLO Cn1c[nH+]cc1COC(=O)CC1CC(C)(C)C1 ZINC000796941518 586117711 /nfs/dbraw/zinc/11/77/11/586117711.db2.gz CKHYNYVMMKMUCH-UHFFFAOYSA-N 1 2 236.315 2.290 20 0 BEADLO C[C@@H]1C[C@H]1COC(=O)[C@@H](c1ccccc1)[NH+](C)C ZINC000798820556 586150641 /nfs/dbraw/zinc/15/06/41/586150641.db2.gz JECRTCVGPCIDBG-KWCYVHTRSA-N 1 2 247.338 2.489 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OC[C@@H](C)CC(C)C ZINC000799175875 586164901 /nfs/dbraw/zinc/16/49/01/586164901.db2.gz UNXSWKBUDLTVSH-UWVGGRQHSA-N 1 2 216.325 2.202 20 0 BEADLO CC(C)C1C[NH+](Cc2ncc(Cl)n2C)C1 ZINC000799735209 586195641 /nfs/dbraw/zinc/19/56/41/586195641.db2.gz MHZMOEAXYFHGMA-UHFFFAOYSA-N 1 2 227.739 2.161 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@@H](C)c2ccnn2C)no1 ZINC000800502992 586223334 /nfs/dbraw/zinc/22/33/34/586223334.db2.gz KCBLZNXRRSRQGP-UWVGGRQHSA-N 1 2 234.303 2.128 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@@H](C)c2nccnc2C)no1 ZINC000800502795 586223349 /nfs/dbraw/zinc/22/33/49/586223349.db2.gz GZSLVPASPLMGSS-ONGXEEELSA-N 1 2 246.314 2.493 20 0 BEADLO O=C(CC[N@H+]1Cc2ccc(O)cc2C1)C1CC1 ZINC000859477339 589039906 /nfs/dbraw/zinc/03/99/06/589039906.db2.gz QJPGDUVDPUCYKF-UHFFFAOYSA-N 1 2 231.295 2.077 20 0 BEADLO O=C(CC[N@@H+]1Cc2ccc(O)cc2C1)C1CC1 ZINC000859477339 589039907 /nfs/dbraw/zinc/03/99/07/589039907.db2.gz QJPGDUVDPUCYKF-UHFFFAOYSA-N 1 2 231.295 2.077 20 0 BEADLO Cc1oncc1C[N@@H+]1Cc2ccc(O)cc2C1 ZINC000859477012 589040197 /nfs/dbraw/zinc/04/01/97/589040197.db2.gz DIPJFTXAZJZWLN-UHFFFAOYSA-N 1 2 230.267 2.204 20 0 BEADLO Cc1oncc1C[N@H+]1Cc2ccc(O)cc2C1 ZINC000859477012 589040199 /nfs/dbraw/zinc/04/01/99/589040199.db2.gz DIPJFTXAZJZWLN-UHFFFAOYSA-N 1 2 230.267 2.204 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)CCSC(C)(C)C ZINC000801953619 586284048 /nfs/dbraw/zinc/28/40/48/586284048.db2.gz SENQYYNRQPWYEE-VIFPVBQESA-N 1 2 233.377 2.011 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)CCSC(C)(C)C ZINC000801953619 586284051 /nfs/dbraw/zinc/28/40/51/586284051.db2.gz SENQYYNRQPWYEE-VIFPVBQESA-N 1 2 233.377 2.011 20 0 BEADLO CCCC[C@H](C)C(=O)O[C@H]1CC[N@H+](CCF)C1 ZINC000802232880 586297489 /nfs/dbraw/zinc/29/74/89/586297489.db2.gz LMWDUXVGGYEPEI-RYUDHWBXSA-N 1 2 245.338 2.400 20 0 BEADLO CCCC[C@H](C)C(=O)O[C@H]1CC[N@@H+](CCF)C1 ZINC000802232880 586297491 /nfs/dbraw/zinc/29/74/91/586297491.db2.gz LMWDUXVGGYEPEI-RYUDHWBXSA-N 1 2 245.338 2.400 20 0 BEADLO CCC[C@@H](C)C(=O)O[C@@H]1CC[N@H+](CCF)C1 ZINC000802240422 586299368 /nfs/dbraw/zinc/29/93/68/586299368.db2.gz YGZAQMLOOYYHLY-GHMZBOCLSA-N 1 2 231.311 2.010 20 0 BEADLO CCC[C@@H](C)C(=O)O[C@@H]1CC[N@@H+](CCF)C1 ZINC000802240422 586299369 /nfs/dbraw/zinc/29/93/69/586299369.db2.gz YGZAQMLOOYYHLY-GHMZBOCLSA-N 1 2 231.311 2.010 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)O[C@H]1CC[N@H+](CCF)C1 ZINC000802238975 586299419 /nfs/dbraw/zinc/29/94/19/586299419.db2.gz LUCXYMPITNUTAP-SRVKXCTJSA-N 1 2 245.338 2.256 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)O[C@H]1CC[N@@H+](CCF)C1 ZINC000802238975 586299420 /nfs/dbraw/zinc/29/94/20/586299420.db2.gz LUCXYMPITNUTAP-SRVKXCTJSA-N 1 2 245.338 2.256 20 0 BEADLO Cc1cc(C[N@@H+]2CCOCC23CC3)c(C)o1 ZINC000802658511 586308664 /nfs/dbraw/zinc/30/86/64/586308664.db2.gz HFWNNDSDGNVYIR-UHFFFAOYSA-N 1 2 221.300 2.261 20 0 BEADLO Cc1cc(C[N@H+]2CCOCC23CC3)c(C)o1 ZINC000802658511 586308667 /nfs/dbraw/zinc/30/86/67/586308667.db2.gz HFWNNDSDGNVYIR-UHFFFAOYSA-N 1 2 221.300 2.261 20 0 BEADLO O=C(OCCCCF)c1ccc2[nH+]ccn2c1 ZINC000803346229 586345938 /nfs/dbraw/zinc/34/59/38/586345938.db2.gz PPQYNQWLNFGPDC-UHFFFAOYSA-N 1 2 236.246 2.241 20 0 BEADLO CCC(=CC(=O)N[C@@H]1CCc2c[nH+]cn2C1)CC ZINC000804335063 586391381 /nfs/dbraw/zinc/39/13/81/586391381.db2.gz QHZJYBZKHRMDRR-GFCCVEGCSA-N 1 2 247.342 2.061 20 0 BEADLO CC1(C)CC(=O)N(C[N@@H+]2CCC[C@@](C)(F)C2)C1 ZINC000840099984 586445626 /nfs/dbraw/zinc/44/56/26/586445626.db2.gz RCTKYUNTWWUHEF-CYBMUJFWSA-N 1 2 242.338 2.026 20 0 BEADLO CC1(C)CC(=O)N(C[N@H+]2CCC[C@@](C)(F)C2)C1 ZINC000840099984 586445627 /nfs/dbraw/zinc/44/56/27/586445627.db2.gz RCTKYUNTWWUHEF-CYBMUJFWSA-N 1 2 242.338 2.026 20 0 BEADLO C[C@@H]1CC(C)(C)C[N@@H+]1Cn1ncn(C)c1=S ZINC000840183472 586513244 /nfs/dbraw/zinc/51/32/44/586513244.db2.gz MBJPHJQIRPPLDT-SECBINFHSA-N 1 2 240.376 2.029 20 0 BEADLO C[C@@H]1CC(C)(C)C[N@H+]1Cn1ncn(C)c1=S ZINC000840183472 586513246 /nfs/dbraw/zinc/51/32/46/586513246.db2.gz MBJPHJQIRPPLDT-SECBINFHSA-N 1 2 240.376 2.029 20 0 BEADLO Cc1noc([C@H]2CCC[N@@H+]2Cc2ccoc2)n1 ZINC000809721764 586514997 /nfs/dbraw/zinc/51/49/97/586514997.db2.gz ZYLMMERUWYGKAQ-LLVKDONJSA-N 1 2 233.271 2.308 20 0 BEADLO Cc1noc([C@H]2CCC[N@H+]2Cc2ccoc2)n1 ZINC000809721764 586514999 /nfs/dbraw/zinc/51/49/99/586514999.db2.gz ZYLMMERUWYGKAQ-LLVKDONJSA-N 1 2 233.271 2.308 20 0 BEADLO Cc1nonc1C[NH2+]Cc1cc2ccccc2o1 ZINC000809744642 586516368 /nfs/dbraw/zinc/51/63/68/586516368.db2.gz VZHKRCSZWRJCNA-UHFFFAOYSA-N 1 2 243.266 2.414 20 0 BEADLO Cc1nonc1C[NH2+]Cc1cc(C)ccc1F ZINC000809744661 586516488 /nfs/dbraw/zinc/51/64/88/586516488.db2.gz WYKJUVVDUJMDAZ-UHFFFAOYSA-N 1 2 235.262 2.115 20 0 BEADLO CCc1ccc(C[N@H+](C)Cc2cnn(C)n2)cc1 ZINC000809933481 586524269 /nfs/dbraw/zinc/52/42/69/586524269.db2.gz IGXUPTKDRNQIBS-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO CCc1ccc(C[N@@H+](C)Cc2cnn(C)n2)cc1 ZINC000809933481 586524271 /nfs/dbraw/zinc/52/42/71/586524271.db2.gz IGXUPTKDRNQIBS-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO Cc1ccc(C)c(C[N@@H+](C)Cc2cnn(C)n2)c1 ZINC000809988596 586529626 /nfs/dbraw/zinc/52/96/26/586529626.db2.gz LUVOKDQZVRQZCD-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1ccc(C)c(C[N@H+](C)Cc2cnn(C)n2)c1 ZINC000809988596 586529628 /nfs/dbraw/zinc/52/96/28/586529628.db2.gz LUVOKDQZVRQZCD-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO CC[C@@H](O)c1nccn1Cc1ccc[nH+]c1C ZINC000810005236 586530985 /nfs/dbraw/zinc/53/09/85/586530985.db2.gz KBAOCLPLVQRPKS-GFCCVEGCSA-N 1 2 231.299 2.078 20 0 BEADLO CCCOC(=O)[C@H](C)[N@@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000810045377 586532631 /nfs/dbraw/zinc/53/26/31/586532631.db2.gz MKUZGJJDEGHLAQ-UWVGGRQHSA-N 1 2 249.301 2.305 20 0 BEADLO CCCOC(=O)[C@H](C)[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000810045377 586532632 /nfs/dbraw/zinc/53/26/32/586532632.db2.gz MKUZGJJDEGHLAQ-UWVGGRQHSA-N 1 2 249.301 2.305 20 0 BEADLO COc1cc(F)c(F)cc1NCc1[nH]cc[nH+]1 ZINC000810164597 586536391 /nfs/dbraw/zinc/53/63/91/586536391.db2.gz KSDNLPNZUJSQPY-UHFFFAOYSA-N 1 2 239.225 2.309 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)C1(F)CCCCC1 ZINC000810366511 586538531 /nfs/dbraw/zinc/53/85/31/586538531.db2.gz YVZCJPAETMJEDG-UHFFFAOYSA-N 1 2 239.294 2.041 20 0 BEADLO C[C@@H]1C[N@H+](Cn2cc(Cl)cn2)CCC1(F)F ZINC000811779156 586566581 /nfs/dbraw/zinc/56/65/81/586566581.db2.gz GNPFGBGACYUNER-MRVPVSSYSA-N 1 2 249.692 2.471 20 0 BEADLO C[C@@H]1C[N@@H+](Cn2cc(Cl)cn2)CCC1(F)F ZINC000811779156 586566582 /nfs/dbraw/zinc/56/65/82/586566582.db2.gz GNPFGBGACYUNER-MRVPVSSYSA-N 1 2 249.692 2.471 20 0 BEADLO Cc1ccc(CSCc2cnn(C)n2)c(C)[nH+]1 ZINC000811806910 586566785 /nfs/dbraw/zinc/56/67/85/586566785.db2.gz JKFGRAVDQZDXCT-UHFFFAOYSA-N 1 2 248.355 2.260 20 0 BEADLO C[C@@H]1C[N@H+](Cn2cc[nH]c2=S)CCC1(F)F ZINC000811780147 586566846 /nfs/dbraw/zinc/56/68/46/586566846.db2.gz VQHXJTMWPLFZRU-MRVPVSSYSA-N 1 2 247.314 2.106 20 0 BEADLO C[C@@H]1C[N@@H+](Cn2cc[nH]c2=S)CCC1(F)F ZINC000811780147 586566847 /nfs/dbraw/zinc/56/68/47/586566847.db2.gz VQHXJTMWPLFZRU-MRVPVSSYSA-N 1 2 247.314 2.106 20 0 BEADLO OCc1ccc(NCc2ccc(O)c(F)c2)[nH+]c1 ZINC000813338433 586600654 /nfs/dbraw/zinc/60/06/54/586600654.db2.gz HMXFCYJAGFOVSF-UHFFFAOYSA-N 1 2 248.257 2.031 20 0 BEADLO CC[C@H](C)CONc1cc(-n2cc[nH+]c2)ncn1 ZINC000813621656 586604574 /nfs/dbraw/zinc/60/45/74/586604574.db2.gz CZUSSNRAOBJKOZ-JTQLQIEISA-N 1 2 247.302 2.052 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)OC[C@H]3C[C@H]3C)ccn12 ZINC000859734464 589057794 /nfs/dbraw/zinc/05/77/94/589057794.db2.gz CCKPGNIXJKKZLW-BXKDBHETSA-N 1 2 244.294 2.456 20 0 BEADLO CCn1ccnc1[C@@H]1CCCC[N@@H+]1CCF ZINC000815107775 586667224 /nfs/dbraw/zinc/66/72/24/586667224.db2.gz UDMRSGBCFBARNU-NSHDSACASA-N 1 2 225.311 2.400 20 0 BEADLO CCn1ccnc1[C@@H]1CCCC[N@H+]1CCF ZINC000815107775 586667225 /nfs/dbraw/zinc/66/72/25/586667225.db2.gz UDMRSGBCFBARNU-NSHDSACASA-N 1 2 225.311 2.400 20 0 BEADLO CCn1cc[nH+]c1[C@@H]1CCCCN1CCF ZINC000815107775 586667227 /nfs/dbraw/zinc/66/72/27/586667227.db2.gz UDMRSGBCFBARNU-NSHDSACASA-N 1 2 225.311 2.400 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnn(-c3ccccc3)n2)[C@@H]1C ZINC000815162685 586671187 /nfs/dbraw/zinc/67/11/87/586671187.db2.gz GPHSNFVTLYTKBT-VXGBXAGGSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnn(-c3ccccc3)n2)[C@@H]1C ZINC000815162685 586671188 /nfs/dbraw/zinc/67/11/88/586671188.db2.gz GPHSNFVTLYTKBT-VXGBXAGGSA-N 1 2 242.326 2.108 20 0 BEADLO Cn1ncc(C[N@H+](C)Cc2ccoc2)c1Cl ZINC000816495049 586736898 /nfs/dbraw/zinc/73/68/98/586736898.db2.gz IJIHEEHJTCWTSM-UHFFFAOYSA-N 1 2 239.706 2.299 20 0 BEADLO Cn1ncc(C[N@@H+](C)Cc2ccoc2)c1Cl ZINC000816495049 586736899 /nfs/dbraw/zinc/73/68/99/586736899.db2.gz IJIHEEHJTCWTSM-UHFFFAOYSA-N 1 2 239.706 2.299 20 0 BEADLO Cc1ccc(NC(=O)Cc2[nH]cc[nH+]2)cc1C ZINC000816809717 586765230 /nfs/dbraw/zinc/76/52/30/586765230.db2.gz IUXMRSYDDMRQRZ-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)N1CCC[C@@H]1C1CCCC1 ZINC000816895302 586769339 /nfs/dbraw/zinc/76/93/39/586769339.db2.gz HVODVHQEUMDTNP-GFCCVEGCSA-N 1 2 247.342 2.133 20 0 BEADLO CCCOC(=O)[C@H](C)[N@@H+]1CCC(F)(F)C[C@@H]1C ZINC000859836792 589064587 /nfs/dbraw/zinc/06/45/87/589064587.db2.gz ZLBFGDWMXSWCNZ-UWVGGRQHSA-N 1 2 249.301 2.448 20 0 BEADLO CCCOC(=O)[C@H](C)[N@H+]1CCC(F)(F)C[C@@H]1C ZINC000859836792 589064588 /nfs/dbraw/zinc/06/45/88/589064588.db2.gz ZLBFGDWMXSWCNZ-UWVGGRQHSA-N 1 2 249.301 2.448 20 0 BEADLO CC[C@H](C)CONC(=O)c1cccc2[nH+]ccn21 ZINC000816980537 586777885 /nfs/dbraw/zinc/77/78/85/586777885.db2.gz NJOZVAIUMDSFAE-JTQLQIEISA-N 1 2 247.298 2.042 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)C=C1CCCC1 ZINC000817086392 586781318 /nfs/dbraw/zinc/78/13/18/586781318.db2.gz PSTQRYWJPLKAPN-UHFFFAOYSA-N 1 2 246.310 2.207 20 0 BEADLO CC(C)COC(=O)C[N@@H+]1CCC(F)(F)C[C@H]1C ZINC000859838537 589065243 /nfs/dbraw/zinc/06/52/43/589065243.db2.gz MJKQDSLIVGWMRZ-SNVBAGLBSA-N 1 2 249.301 2.305 20 0 BEADLO CC(C)COC(=O)C[N@H+]1CCC(F)(F)C[C@H]1C ZINC000859838537 589065245 /nfs/dbraw/zinc/06/52/45/589065245.db2.gz MJKQDSLIVGWMRZ-SNVBAGLBSA-N 1 2 249.301 2.305 20 0 BEADLO CC(C)COC(=O)C[N@@H+]1CCC(F)(F)C[C@@H]1C ZINC000859838536 589065419 /nfs/dbraw/zinc/06/54/19/589065419.db2.gz MJKQDSLIVGWMRZ-JTQLQIEISA-N 1 2 249.301 2.305 20 0 BEADLO CC(C)COC(=O)C[N@H+]1CCC(F)(F)C[C@@H]1C ZINC000859838536 589065421 /nfs/dbraw/zinc/06/54/21/589065421.db2.gz MJKQDSLIVGWMRZ-JTQLQIEISA-N 1 2 249.301 2.305 20 0 BEADLO COC1CC(C(=O)OCc2ccc(C)[nH+]c2C)C1 ZINC000859846933 589066305 /nfs/dbraw/zinc/06/63/05/589066305.db2.gz MXBRBYXDCCYXHV-UHFFFAOYSA-N 1 2 249.310 2.167 20 0 BEADLO CCC1(CC)CCN(C[N@@H+]2CC[C@@H](F)C2)C1=O ZINC000817362363 586799170 /nfs/dbraw/zinc/79/91/70/586799170.db2.gz PFZXYJMDHAZFNP-LLVKDONJSA-N 1 2 242.338 2.026 20 0 BEADLO CCC1(CC)CCN(C[N@H+]2CC[C@@H](F)C2)C1=O ZINC000817362363 586799171 /nfs/dbraw/zinc/79/91/71/586799171.db2.gz PFZXYJMDHAZFNP-LLVKDONJSA-N 1 2 242.338 2.026 20 0 BEADLO CC(C)n1cc(C(C)(C)[NH2+]Cc2ccoc2)nn1 ZINC000817419583 586803663 /nfs/dbraw/zinc/80/36/63/586803663.db2.gz JGMUMQJBBVSDNE-UHFFFAOYSA-N 1 2 248.330 2.477 20 0 BEADLO Cc1cc(CNC(=S)NC2CCC2)cc(C)[nH+]1 ZINC000817562567 586811305 /nfs/dbraw/zinc/81/13/05/586811305.db2.gz MNJQOHFLPSGSDS-UHFFFAOYSA-N 1 2 249.383 2.215 20 0 BEADLO Cn1cc(N[C@@H]2CCc3ccc[nH+]c3CC2)cn1 ZINC000817581168 586812645 /nfs/dbraw/zinc/81/26/45/586812645.db2.gz PSTVPMDZXWMJEO-GFCCVEGCSA-N 1 2 242.326 2.175 20 0 BEADLO Cc1noc([C@H](C)[NH2+][C@@H](C)c2ccns2)n1 ZINC000860053205 589077072 /nfs/dbraw/zinc/07/70/72/589077072.db2.gz SPRSTHRKNMTWER-BQBZGAKWSA-N 1 2 238.316 2.246 20 0 BEADLO Cc1ccc(NC(=O)/C=C\[C@H]2CCCO2)c(C)[nH+]1 ZINC000819376190 586958394 /nfs/dbraw/zinc/95/83/94/586958394.db2.gz UWAABEPQNXDXRF-XYLWRLHESA-N 1 2 246.310 2.372 20 0 BEADLO Cc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)c(C)[nH+]1 ZINC000819376189 586958500 /nfs/dbraw/zinc/95/85/00/586958500.db2.gz UWAABEPQNXDXRF-WMADIVHISA-N 1 2 246.310 2.372 20 0 BEADLO NC(=O)CC[NH2+]c1ccc(OC2CCCC2)cc1 ZINC000819403446 586961259 /nfs/dbraw/zinc/96/12/59/586961259.db2.gz KHBRQNNTSCJHJM-UHFFFAOYSA-N 1 2 248.326 2.295 20 0 BEADLO Cc1cc([NH+](C)C)ccc1NC[C@@H](O)C1CC1 ZINC000819410063 586961784 /nfs/dbraw/zinc/96/17/84/586961784.db2.gz VYOAAQPIHZNELF-CQSZACIVSA-N 1 2 234.343 2.244 20 0 BEADLO Cc1cc(NC[C@@H](O)C2CC2)ccc1[NH+](C)C ZINC000819409156 586962049 /nfs/dbraw/zinc/96/20/49/586962049.db2.gz XSOMKMUTVCIVBB-CQSZACIVSA-N 1 2 234.343 2.244 20 0 BEADLO CCC/C(C)=C/C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819764119 586991125 /nfs/dbraw/zinc/99/11/25/586991125.db2.gz BNKMXOVSMULVMI-BNICOGTQSA-N 1 2 226.345 2.340 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)C2C(C)(C)C2(C)C)S1 ZINC000819770659 586991481 /nfs/dbraw/zinc/99/14/81/586991481.db2.gz AWUUDIJFHACFBT-ZETCQYMHSA-N 1 2 240.372 2.276 20 0 BEADLO CC(C)C[C@@H](C)C(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819778062 586993264 /nfs/dbraw/zinc/99/32/64/586993264.db2.gz XYWJIUALNNZCOO-BDAKNGLRSA-N 1 2 228.361 2.276 20 0 BEADLO CC(C)CCCC(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819779624 586993630 /nfs/dbraw/zinc/99/36/30/586993630.db2.gz AACVRUVTFXFGMI-VIFPVBQESA-N 1 2 228.361 2.420 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819781172 586993791 /nfs/dbraw/zinc/99/37/91/586993791.db2.gz MELZNAXVJFAHEZ-IVZWLZJFSA-N 1 2 240.372 2.420 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)C[C@@H]2CC[C@@H]3C[C@@H]32)S1 ZINC000819781424 586994282 /nfs/dbraw/zinc/99/42/82/586994282.db2.gz ODGWUQNMXUJNNW-IMSYWVGJSA-N 1 2 238.356 2.030 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819782441 586994717 /nfs/dbraw/zinc/99/47/17/586994717.db2.gz VIDAMKHIVIZKCW-DJLDLDEBSA-N 1 2 226.345 2.030 20 0 BEADLO CCC[C@H](CC)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000820003245 587012053 /nfs/dbraw/zinc/01/20/53/587012053.db2.gz KMJWOLXVNAYFFY-NSHDSACASA-N 1 2 235.331 2.093 20 0 BEADLO C[C@@H](NC(=O)C[C@H]1CC=CCC1)c1[nH]cc[nH+]1 ZINC000820191363 587033816 /nfs/dbraw/zinc/03/38/16/587033816.db2.gz CHTOGMOTNKNOSF-MNOVXSKESA-N 1 2 233.315 2.333 20 0 BEADLO CCN(Cc1ccccc1)C(=O)Cc1[nH]cc[nH+]1 ZINC000820389590 587045579 /nfs/dbraw/zinc/04/55/79/587045579.db2.gz QESBRQQGGLKDQJ-UHFFFAOYSA-N 1 2 243.310 2.001 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)[C@@]1(C)C=CCC1 ZINC000820415482 587047096 /nfs/dbraw/zinc/04/70/96/587047096.db2.gz UIROOWUZMDOMCM-AWEZNQCLSA-N 1 2 246.310 2.063 20 0 BEADLO C=C=CCNc1cc(C)[nH+]c(-c2ccncc2)n1 ZINC000820586921 587056999 /nfs/dbraw/zinc/05/69/99/587056999.db2.gz XPGGBBXNPJOWFP-UHFFFAOYSA-N 1 2 238.294 2.022 20 0 BEADLO CC[C@H](NC(=O)Cc1[nH]cc[nH+]1)c1ccccc1 ZINC000821023701 587089452 /nfs/dbraw/zinc/08/94/52/587089452.db2.gz TUTDVWLUPYKZJW-LBPRGKRZSA-N 1 2 243.310 2.220 20 0 BEADLO CCC[C@@H](CC)C(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000821105671 587095920 /nfs/dbraw/zinc/09/59/20/587095920.db2.gz DBFCNZWGWDMSSY-MNOVXSKESA-N 1 2 249.358 2.210 20 0 BEADLO CCC[C@@H](CC)C(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000821105671 587095921 /nfs/dbraw/zinc/09/59/21/587095921.db2.gz DBFCNZWGWDMSSY-MNOVXSKESA-N 1 2 249.358 2.210 20 0 BEADLO CC(C)COCC[N@@H+]1Cc2ccncc2C1 ZINC000821263242 587104228 /nfs/dbraw/zinc/10/42/28/587104228.db2.gz XJXRKDDOJHYFSK-UHFFFAOYSA-N 1 2 220.316 2.070 20 0 BEADLO CC(C)COCC[N@H+]1Cc2ccncc2C1 ZINC000821263242 587104229 /nfs/dbraw/zinc/10/42/29/587104229.db2.gz XJXRKDDOJHYFSK-UHFFFAOYSA-N 1 2 220.316 2.070 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)[C@]1(C)C=CCC1 ZINC000821309344 587106336 /nfs/dbraw/zinc/10/63/36/587106336.db2.gz RUDQTTJBUAIGPS-BXUZGUMPSA-N 1 2 247.342 2.437 20 0 BEADLO Nc1cc(COC(=O)C(F)=C2CCC2)cc[nH+]1 ZINC000821370717 587113211 /nfs/dbraw/zinc/11/32/11/587113211.db2.gz KGZIEUYLQJZYKJ-UHFFFAOYSA-N 1 2 236.246 2.115 20 0 BEADLO CCC(=O)OCc1ccc[nH+]c1N1CCCC1 ZINC000821609092 587132272 /nfs/dbraw/zinc/13/22/72/587132272.db2.gz JBWHLZYSWUWPNN-UHFFFAOYSA-N 1 2 234.299 2.135 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)C2(C)CC=CC2)c2[nH+]ccn21 ZINC000821787314 587137867 /nfs/dbraw/zinc/13/78/67/587137867.db2.gz SIKIPQXBJCHVES-GHMZBOCLSA-N 1 2 245.326 2.361 20 0 BEADLO C[C@@H]1C[C@@H]1C(=O)OCc1[nH]c[nH+]c1C(C)(C)C ZINC000822323461 587162172 /nfs/dbraw/zinc/16/21/72/587162172.db2.gz JAXBFWXXJSJSIA-BDAKNGLRSA-N 1 2 236.315 2.406 20 0 BEADLO CC/C(C)=C/C(=O)NCc1ccc[nH+]c1N(C)C ZINC000822509986 587172833 /nfs/dbraw/zinc/17/28/33/587172833.db2.gz RQZDCDSHYGAVFW-PKNBQFBNSA-N 1 2 247.342 2.120 20 0 BEADLO C[C@@H]1CC(C)(C)CN1C(=O)/C=C\c1cn(C)c[nH+]1 ZINC000822738233 587183712 /nfs/dbraw/zinc/18/37/12/587183712.db2.gz HLSSKNIIRGRHGS-ISALQUGTSA-N 1 2 247.342 2.080 20 0 BEADLO CCC[C@H](CC)C(=O)N[C@@H]1CCc2c[nH+]cn2C1 ZINC000822861260 587189719 /nfs/dbraw/zinc/18/97/19/587189719.db2.gz IUUIEFGJPLUKCP-NWDGAFQWSA-N 1 2 249.358 2.140 20 0 BEADLO CCC[C@H](CC)C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000823237433 587210436 /nfs/dbraw/zinc/21/04/36/587210436.db2.gz VNOBPHOLWIYUNN-QWRGUYRKSA-N 1 2 235.331 2.270 20 0 BEADLO C[C@@H]1CCN(C(=O)/C=C/c2cn(C)c[nH+]2)[C@H](C)C1 ZINC000823259273 587211964 /nfs/dbraw/zinc/21/19/64/587211964.db2.gz BNBLDLVANVPNNF-GKUNOOHESA-N 1 2 247.342 2.080 20 0 BEADLO Cc1ccc([C@H](C)NC(=O)Cc2[nH]cc[nH+]2)s1 ZINC000823278232 587213200 /nfs/dbraw/zinc/21/32/00/587213200.db2.gz LNWAAZCGTHWKAP-VIFPVBQESA-N 1 2 249.339 2.200 20 0 BEADLO CCn1nc(C)c(C[N@H+](C)Cc2ccccc2)n1 ZINC000823371656 587218051 /nfs/dbraw/zinc/21/80/51/587218051.db2.gz HXALSRIDIIHLIV-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1nc(C)c(C[N@@H+](C)Cc2ccccc2)n1 ZINC000823371656 587218052 /nfs/dbraw/zinc/21/80/52/587218052.db2.gz HXALSRIDIIHLIV-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CO[C@@H]1CC[N@H+](Cc2ccnc(Cl)c2F)C1 ZINC000823459858 587223886 /nfs/dbraw/zinc/22/38/86/587223886.db2.gz ZNHSUVIEZNMWRQ-SECBINFHSA-N 1 2 244.697 2.095 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2ccnc(Cl)c2F)C1 ZINC000823459858 587223888 /nfs/dbraw/zinc/22/38/88/587223888.db2.gz ZNHSUVIEZNMWRQ-SECBINFHSA-N 1 2 244.697 2.095 20 0 BEADLO CC(C)=C(C)CC(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000823807053 587241056 /nfs/dbraw/zinc/24/10/56/587241056.db2.gz PLFVPAMQOIMDHS-SECBINFHSA-N 1 2 226.345 2.340 20 0 BEADLO CCn1nc(C)c(C[NH2+]Cc2cc(C)oc2C)n1 ZINC000823867028 587244643 /nfs/dbraw/zinc/24/46/43/587244643.db2.gz XHXMVEIGWCVHKC-UHFFFAOYSA-N 1 2 248.330 2.106 20 0 BEADLO CCC[C@H](CC)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000824355739 587267465 /nfs/dbraw/zinc/26/74/65/587267465.db2.gz VRXKHVQAONNRFW-JTQLQIEISA-N 1 2 223.320 2.194 20 0 BEADLO CCC[C@H](CC)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000824355739 587267466 /nfs/dbraw/zinc/26/74/66/587267466.db2.gz VRXKHVQAONNRFW-JTQLQIEISA-N 1 2 223.320 2.194 20 0 BEADLO Fc1cccc(F)c1CN[C@H]1CCn2cc[nH+]c21 ZINC000824522141 587273429 /nfs/dbraw/zinc/27/34/29/587273429.db2.gz QXNXPTRGLZKUEF-LBPRGKRZSA-N 1 2 249.264 2.396 20 0 BEADLO Cc1cc(C[NH2+]Cc2nnc(C(C)C)[nH]2)c(C)o1 ZINC000824602764 587279094 /nfs/dbraw/zinc/27/90/94/587279094.db2.gz FCZFBFGLRZHPGT-UHFFFAOYSA-N 1 2 248.330 2.428 20 0 BEADLO Cc1[nH]ncc1C[NH2+]C[C@@]1(C)CC1(Cl)Cl ZINC000824765140 587286382 /nfs/dbraw/zinc/28/63/82/587286382.db2.gz IFASRXSRRMOFBJ-SECBINFHSA-N 1 2 248.157 2.392 20 0 BEADLO CCC(C)(C)[C@H](C)NC(=O)/C=C/c1cn(C)c[nH+]1 ZINC000824840526 587289680 /nfs/dbraw/zinc/28/96/80/587289680.db2.gz AUNBIOFSWMOKCB-AEZGRPFRSA-N 1 2 249.358 2.374 20 0 BEADLO CC[C@@](C)(NC(=O)/C=C/c1cn(C)c[nH+]1)C1CC1 ZINC000825398353 587318363 /nfs/dbraw/zinc/31/83/63/587318363.db2.gz QFAMBDKEOFBBSX-HSBSLETESA-N 1 2 247.342 2.128 20 0 BEADLO O=C(C[C@H]1CC=CCC1)N[C@H]1CCn2c[nH+]cc21 ZINC000825514317 587322868 /nfs/dbraw/zinc/32/28/68/587322868.db2.gz ZWDFRZFQPRCLCP-RYUDHWBXSA-N 1 2 245.326 2.191 20 0 BEADLO CC(C)(CNC(=O)[C@]1(C)C=CCC1)n1cc[nH+]c1 ZINC000825532570 587323917 /nfs/dbraw/zinc/32/39/17/587323917.db2.gz XXBIUCSSHPNWMQ-CQSZACIVSA-N 1 2 247.342 2.091 20 0 BEADLO CCN(C(=O)Cc1[nH]cc[nH+]1)[C@H]1CCCC[C@H]1C ZINC000825607795 587327262 /nfs/dbraw/zinc/32/72/62/587327262.db2.gz PMFNVBSDLHNHSP-NEPJUHHUSA-N 1 2 249.358 2.379 20 0 BEADLO Cc1cc[nH+]c(NCC(C)(C)C)c1-c1nn[nH]n1 ZINC000826313027 587352074 /nfs/dbraw/zinc/35/20/74/587352074.db2.gz UXWGCLVMKSWVDG-UHFFFAOYSA-N 1 2 246.318 2.028 20 0 BEADLO O=C(NOCC1CCC1)c1cc2c[nH+]ccc2[nH]1 ZINC000826628056 587357241 /nfs/dbraw/zinc/35/72/41/587357241.db2.gz UDKVHUDUFDXPDG-UHFFFAOYSA-N 1 2 245.282 2.024 20 0 BEADLO CCCC[C@@](C)(F)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000826834373 587363614 /nfs/dbraw/zinc/36/36/14/587363614.db2.gz QQPNYWCFLNGIJL-GFCCVEGCSA-N 1 2 241.310 2.287 20 0 BEADLO CC/C(C)=C/C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000826937811 587366251 /nfs/dbraw/zinc/36/62/51/587366251.db2.gz NJEDQZWOCUFTIB-DHZHZOJOSA-N 1 2 247.342 2.472 20 0 BEADLO CC/C(C)=C/C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000826937811 587366252 /nfs/dbraw/zinc/36/62/52/587366252.db2.gz NJEDQZWOCUFTIB-DHZHZOJOSA-N 1 2 247.342 2.472 20 0 BEADLO Cc1c[nH]c(CNC(=O)C2(C)C(C)(C)C2(C)C)[nH+]1 ZINC000827582261 587389850 /nfs/dbraw/zinc/38/98/50/587389850.db2.gz CYVSVUOKDXTYKW-UHFFFAOYSA-N 1 2 249.358 2.407 20 0 BEADLO Oc1ccc2c(c1)C[N@@H+](Cc1ccoc1)CCO2 ZINC000827655768 587394588 /nfs/dbraw/zinc/39/45/88/587394588.db2.gz CLYXORYRYQWSTF-UHFFFAOYSA-N 1 2 245.278 2.380 20 0 BEADLO Oc1ccc2c(c1)C[N@H+](Cc1ccoc1)CCO2 ZINC000827655768 587394589 /nfs/dbraw/zinc/39/45/89/587394589.db2.gz CLYXORYRYQWSTF-UHFFFAOYSA-N 1 2 245.278 2.380 20 0 BEADLO C[C@H]1CCCC[C@H]1CCNC(=O)Cc1[nH]cc[nH+]1 ZINC000827787845 587402482 /nfs/dbraw/zinc/40/24/82/587402482.db2.gz PXPJUELKPWAOBX-RYUDHWBXSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H]1CCC[C@H](CCNC(=O)Cc2[nH]cc[nH+]2)C1 ZINC000827955182 587413114 /nfs/dbraw/zinc/41/31/14/587413114.db2.gz AQIYLESMAIMBKN-NWDGAFQWSA-N 1 2 249.358 2.285 20 0 BEADLO CC[C@@H](C)[C@@H]([NH2+]CC1=CCCC1)C(=O)OC ZINC000828236143 587427020 /nfs/dbraw/zinc/42/70/20/587427020.db2.gz ZDDZWKSSGAIQTB-ZYHUDNBSSA-N 1 2 225.332 2.274 20 0 BEADLO CC[C@@H](C)[C@@H]1CCCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC000828276423 587430486 /nfs/dbraw/zinc/43/04/86/587430486.db2.gz KLVRWFZPNQUCHD-NEPJUHHUSA-N 1 2 249.358 2.379 20 0 BEADLO CC/C(C)=C/C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000828316159 587434200 /nfs/dbraw/zinc/43/42/00/587434200.db2.gz DRJCSMKANNAQQE-PBQZMEPESA-N 1 2 233.315 2.430 20 0 BEADLO CC/C(C)=C/C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000828316160 587434462 /nfs/dbraw/zinc/43/44/62/587434462.db2.gz DRJCSMKANNAQQE-USKTWTLRSA-N 1 2 233.315 2.430 20 0 BEADLO Cn1c[nH+]c(/C=C/C(=O)NCCCCC2CC2)c1 ZINC000828470820 587444490 /nfs/dbraw/zinc/44/44/90/587444490.db2.gz JXXONTCQPSCZTM-BQYQJAHWSA-N 1 2 247.342 2.130 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)N[C@@H]1CC[C@H]2CCC[C@H]2C1 ZINC000828794661 587462391 /nfs/dbraw/zinc/46/23/91/587462391.db2.gz ISHJJPCFHOSCMY-GRYCIOLGSA-N 1 2 247.342 2.037 20 0 BEADLO CC(C(=O)N1CCn2cc(C)[nH+]c2C1)=C1CCC1 ZINC000828978360 587477353 /nfs/dbraw/zinc/47/73/53/587477353.db2.gz BBNSPQUGUDLBCI-UHFFFAOYSA-N 1 2 245.326 2.034 20 0 BEADLO CCC[C@H]1[C@H](C)CCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC000829016235 587479907 /nfs/dbraw/zinc/47/99/07/587479907.db2.gz PXVJBIINUPGFGT-NEPJUHHUSA-N 1 2 249.358 2.379 20 0 BEADLO C/C=C(/C)C(=O)N1CCc2[nH]c[nH+]c2C12CCC2 ZINC000829079130 587482443 /nfs/dbraw/zinc/48/24/43/587482443.db2.gz MDRZLMWFAAFPRC-KMKOMSMNSA-N 1 2 245.326 2.140 20 0 BEADLO CC/C(C)=C\C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000829542044 587502906 /nfs/dbraw/zinc/50/29/06/587502906.db2.gz FJKDGXAJDDHDNC-HSTULFTRSA-N 1 2 221.304 2.333 20 0 BEADLO CCC(C)=CC(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000829542044 587502907 /nfs/dbraw/zinc/50/29/07/587502907.db2.gz FJKDGXAJDDHDNC-HSTULFTRSA-N 1 2 221.304 2.333 20 0 BEADLO CC(C)CC1CCN(C(=O)Cc2[nH]cc[nH+]2)CC1 ZINC000830168961 587540353 /nfs/dbraw/zinc/54/03/53/587540353.db2.gz TYVIHJAQFAFQKL-UHFFFAOYSA-N 1 2 249.358 2.237 20 0 BEADLO O[C@H](C[N@@H+]1CC[C@H](F)C1)c1ccc(F)cc1F ZINC000830467360 587552201 /nfs/dbraw/zinc/55/22/01/587552201.db2.gz KIAQOQBXKPKIQV-JOYOIKCWSA-N 1 2 245.244 2.042 20 0 BEADLO O[C@H](C[N@H+]1CC[C@H](F)C1)c1ccc(F)cc1F ZINC000830467360 587552202 /nfs/dbraw/zinc/55/22/02/587552202.db2.gz KIAQOQBXKPKIQV-JOYOIKCWSA-N 1 2 245.244 2.042 20 0 BEADLO O[C@@H](C[N@@H+]1CC[C@@H](F)C1)c1ccc(F)cc1F ZINC000830467361 587552232 /nfs/dbraw/zinc/55/22/32/587552232.db2.gz KIAQOQBXKPKIQV-SKDRFNHKSA-N 1 2 245.244 2.042 20 0 BEADLO O[C@@H](C[N@H+]1CC[C@@H](F)C1)c1ccc(F)cc1F ZINC000830467361 587552233 /nfs/dbraw/zinc/55/22/33/587552233.db2.gz KIAQOQBXKPKIQV-SKDRFNHKSA-N 1 2 245.244 2.042 20 0 BEADLO O[C@@H](C[N@@H+]1CC[C@@H](F)C1)c1cccc(Cl)c1 ZINC000830467837 587552412 /nfs/dbraw/zinc/55/24/12/587552412.db2.gz SHTUMZGBYXOFPC-NEPJUHHUSA-N 1 2 243.709 2.417 20 0 BEADLO O[C@@H](C[N@H+]1CC[C@@H](F)C1)c1cccc(Cl)c1 ZINC000830467837 587552414 /nfs/dbraw/zinc/55/24/14/587552414.db2.gz SHTUMZGBYXOFPC-NEPJUHHUSA-N 1 2 243.709 2.417 20 0 BEADLO Cc1ccc(COC(=O)C2(F)CC2)c(C)[nH+]1 ZINC000830758407 587567927 /nfs/dbraw/zinc/56/79/27/587567927.db2.gz CQGMZAVVWYGCNB-UHFFFAOYSA-N 1 2 223.247 2.244 20 0 BEADLO C[C@@H]1C[N@H+](CCF)C2(CCCC2)CN1CCF ZINC000830924199 587577712 /nfs/dbraw/zinc/57/77/12/587577712.db2.gz URAMZSRRDFSCAV-GFCCVEGCSA-N 1 2 246.345 2.244 20 0 BEADLO C[C@@H]1C[N@@H+](CCF)C2(CCCC2)CN1CCF ZINC000830924199 587577713 /nfs/dbraw/zinc/57/77/13/587577713.db2.gz URAMZSRRDFSCAV-GFCCVEGCSA-N 1 2 246.345 2.244 20 0 BEADLO CC(C)(CNC(=O)Cc1[nH]cc[nH+]1)C1CCCC1 ZINC000831051482 587583642 /nfs/dbraw/zinc/58/36/42/587583642.db2.gz VQORCVZFGFVAHF-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO CC1(C)CCC(CNC(=O)Cc2[nH]cc[nH+]2)CC1 ZINC000831330230 587599012 /nfs/dbraw/zinc/59/90/12/587599012.db2.gz SELCRCDXXCGTEY-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO CO[C@@H]1CC[N@H+](CC(F)(F)C(F)F)C[C@@H]1C ZINC000831528338 587616599 /nfs/dbraw/zinc/61/65/99/587616599.db2.gz NTLYEALVAGHAIA-JGVFFNPUSA-N 1 2 243.244 2.244 20 0 BEADLO CO[C@@H]1CC[N@@H+](CC(F)(F)C(F)F)C[C@@H]1C ZINC000831528338 587616601 /nfs/dbraw/zinc/61/66/01/587616601.db2.gz NTLYEALVAGHAIA-JGVFFNPUSA-N 1 2 243.244 2.244 20 0 BEADLO c1coc([C@H]2[N@H+](CC3OCCO3)CC23CCC3)c1 ZINC000832236146 587651506 /nfs/dbraw/zinc/65/15/06/587651506.db2.gz GDNWVULFTBWROE-CYBMUJFWSA-N 1 2 249.310 2.180 20 0 BEADLO c1coc([C@H]2[N@@H+](CC3OCCO3)CC23CCC3)c1 ZINC000832236146 587651508 /nfs/dbraw/zinc/65/15/08/587651508.db2.gz GDNWVULFTBWROE-CYBMUJFWSA-N 1 2 249.310 2.180 20 0 BEADLO C[C@H]1CCC[C@@H](NC(=O)Cc2[nH]cc[nH+]2)CC1 ZINC000832760827 587685770 /nfs/dbraw/zinc/68/57/70/587685770.db2.gz VIGYIPVTGGIRGT-WDEREUQCSA-N 1 2 235.331 2.037 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833278223 587703776 /nfs/dbraw/zinc/70/37/76/587703776.db2.gz PNQPSBMEQCZAAL-MJVIPROJSA-N 1 2 247.342 2.126 20 0 BEADLO CC(C)(CC(=O)N[C@H]1CCn2cc[nH+]c21)C1CC1 ZINC000833270865 587704090 /nfs/dbraw/zinc/70/40/90/587704090.db2.gz BQNIPVKPWXSOPG-NSHDSACASA-N 1 2 247.342 2.270 20 0 BEADLO O=C(CCCC1CC1)N[C@H]1CCn2cc[nH+]c21 ZINC000833270920 587704290 /nfs/dbraw/zinc/70/42/90/587704290.db2.gz CPFRMPXTGJXHGM-NSHDSACASA-N 1 2 233.315 2.024 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833272800 587704300 /nfs/dbraw/zinc/70/43/00/587704300.db2.gz SOZZPPCXAQUFQR-UTUOFQBUSA-N 1 2 247.342 2.126 20 0 BEADLO C[C@@H](C(=O)N[C@H]1CCn2cc[nH+]c21)C1CCCC1 ZINC000833284129 587704486 /nfs/dbraw/zinc/70/44/86/587704486.db2.gz GXIHNKDUTSFELI-PWSUYJOCSA-N 1 2 247.342 2.270 20 0 BEADLO O=C(N[C@@H]1CCn2cc[nH+]c21)C(F)=C1CCCC1 ZINC000833286465 587704805 /nfs/dbraw/zinc/70/48/05/587704805.db2.gz XOTQHPPLBQVLML-SNVBAGLBSA-N 1 2 249.289 2.242 20 0 BEADLO CCC[C@@H](C)CC(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833293368 587705120 /nfs/dbraw/zinc/70/51/20/587705120.db2.gz XIJZAFQQPBMWEC-MNOVXSKESA-N 1 2 235.331 2.270 20 0 BEADLO Cc1ccsc1C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833304884 587705450 /nfs/dbraw/zinc/70/54/50/587705450.db2.gz IOKGOTWGFMMAHQ-VIFPVBQESA-N 1 2 247.323 2.128 20 0 BEADLO C[C@@H](CC1CCCCC1)NC(=O)Cc1[nH]cc[nH+]1 ZINC000834638185 587762293 /nfs/dbraw/zinc/76/22/93/587762293.db2.gz SEJXPAAXCKMJFJ-NSHDSACASA-N 1 2 249.358 2.427 20 0 BEADLO C[C@H](CC1CCCCC1)NC(=O)Cc1[nH]cc[nH+]1 ZINC000834657129 587763228 /nfs/dbraw/zinc/76/32/28/587763228.db2.gz SEJXPAAXCKMJFJ-LLVKDONJSA-N 1 2 249.358 2.427 20 0 BEADLO CC(C)[C@@H](C)[NH2+]c1ccc(O[C@@H]2CC(=O)N2)cc1 ZINC000834892706 587769746 /nfs/dbraw/zinc/76/97/46/587769746.db2.gz CVSFRLJGAZLBML-QMTHXVAHSA-N 1 2 248.326 2.368 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)OCc1c[nH+]cn1C ZINC000835193772 587788309 /nfs/dbraw/zinc/78/83/09/587788309.db2.gz NWARAAUACHEFHF-PWSUYJOCSA-N 1 2 236.315 2.290 20 0 BEADLO CC[C@H]1CCC[C@@H]1C(=O)OCc1c[nH+]cn1C ZINC000835193770 587788372 /nfs/dbraw/zinc/78/83/72/587788372.db2.gz NWARAAUACHEFHF-JQWIXIFHSA-N 1 2 236.315 2.290 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)OCc1cc[nH+]c(N(C)C)c1 ZINC000835287983 587794680 /nfs/dbraw/zinc/79/46/80/587794680.db2.gz VUBWPXUKONVDQH-VXGBXAGGSA-N 1 2 248.326 2.237 20 0 BEADLO CC/C(C)=C/C(=O)OCCCc1[nH+]ccn1C ZINC000835329507 587796482 /nfs/dbraw/zinc/79/64/82/587796482.db2.gz CXHZKUGEIVRUBC-ZHACJKMWSA-N 1 2 236.315 2.252 20 0 BEADLO Cc1cc(C)c(NC(=O)NN2CCCC2)c(C)[nH+]1 ZINC000836630720 587835604 /nfs/dbraw/zinc/83/56/04/587835604.db2.gz AGRMOHRGBHYGHN-UHFFFAOYSA-N 1 2 248.330 2.139 20 0 BEADLO CC/C(C)=C(\C)C(=O)NCc1[nH+]ccn1CC ZINC000836806573 587838310 /nfs/dbraw/zinc/83/83/10/587838310.db2.gz FAOGJRHMIVXCBF-ZHACJKMWSA-N 1 2 235.331 2.266 20 0 BEADLO C/C(=C\C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21)C1CC1 ZINC000836952611 587843392 /nfs/dbraw/zinc/84/33/92/587843392.db2.gz BUYPOFUFZMCPPD-URGSKGIXSA-N 1 2 245.326 2.361 20 0 BEADLO C/C(=C/C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21)C1CC1 ZINC000836952606 587843469 /nfs/dbraw/zinc/84/34/69/587843469.db2.gz BUYPOFUFZMCPPD-PJFTZXESSA-N 1 2 245.326 2.361 20 0 BEADLO CC(C)=C(C)C(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000836953719 587843523 /nfs/dbraw/zinc/84/35/23/587843523.db2.gz HEOIMDJXANFQDE-ONGXEEELSA-N 1 2 233.315 2.361 20 0 BEADLO C/C=C(/CC)C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000836962484 587843971 /nfs/dbraw/zinc/84/39/71/587843971.db2.gz ZTRZUCAFWATEID-HEMQCFABSA-N 1 2 233.315 2.361 20 0 BEADLO CCO/C=C/C(=O)OCc1ccc(C)[nH+]c1C ZINC000840591999 587913555 /nfs/dbraw/zinc/91/35/55/587913555.db2.gz VQIDVGOTKFKYBV-BQYQJAHWSA-N 1 2 235.283 2.292 20 0 BEADLO NC(=[NH+]OC[C@@H]1CCC(F)(F)C1)[C@@H]1CCCO1 ZINC000842046276 587992409 /nfs/dbraw/zinc/99/24/09/587992409.db2.gz BBCQNNCBMNNPGY-BDAKNGLRSA-N 1 2 248.273 2.099 20 0 BEADLO NC(=[NH+]OCCC[C@H]1CCOC1)c1ccccc1 ZINC000842649168 588048649 /nfs/dbraw/zinc/04/86/49/588048649.db2.gz ZRSHNUYOGSONLN-LBPRGKRZSA-N 1 2 248.326 2.350 20 0 BEADLO NC(Cc1cccnc1)=[NH+]OCC1=CCCC1 ZINC000842649454 588048868 /nfs/dbraw/zinc/04/88/68/588048868.db2.gz MOMXPEBRKWGWRI-UHFFFAOYSA-N 1 2 231.299 2.233 20 0 BEADLO COc1ncncc1CNc1ccc(C)[nH+]c1C ZINC000842692081 588053043 /nfs/dbraw/zinc/05/30/43/588053043.db2.gz IAUQKAVBOFXQMG-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO CC[NH2+]Cc1noc(/C=C2/CC[C@@H](C)C2)n1 ZINC000843144623 588086239 /nfs/dbraw/zinc/08/62/39/588086239.db2.gz DYYQESGHONYASU-SBMLRHLQSA-N 1 2 221.304 2.383 20 0 BEADLO CC[NH2+]Cc1noc([C@@H](C)OCCC(C)C)n1 ZINC000843145462 588086776 /nfs/dbraw/zinc/08/67/76/588086776.db2.gz MOCGYJQNWUUXGP-SNVBAGLBSA-N 1 2 241.335 2.303 20 0 BEADLO CC[NH2+]Cc1noc(COc2cccc(C)c2)n1 ZINC000843145733 588087084 /nfs/dbraw/zinc/08/70/84/588087084.db2.gz NGVWNLBWUHDCKN-UHFFFAOYSA-N 1 2 247.298 2.067 20 0 BEADLO Cc1ccc(NC(=O)C2(F)CC2)c(C)[nH+]1 ZINC000843564242 588124115 /nfs/dbraw/zinc/12/41/15/588124115.db2.gz XKIOUXWVWXQXGF-UHFFFAOYSA-N 1 2 208.236 2.139 20 0 BEADLO O=C(NC1=[NH+]CCS1)[C@H]1C[C@@H]1C1CCCC1 ZINC000844317335 588184067 /nfs/dbraw/zinc/18/40/67/588184067.db2.gz QPZYBXLBUNGFTF-ZJUUUORDSA-N 1 2 238.356 2.032 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccc(F)cn2)[C@@H](C)CO1 ZINC000844391612 588188931 /nfs/dbraw/zinc/18/89/31/588188931.db2.gz SCGSQCKPAUESCF-GWCFXTLKSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccc(F)cn2)[C@@H](C)CO1 ZINC000844391612 588188932 /nfs/dbraw/zinc/18/89/32/588188932.db2.gz SCGSQCKPAUESCF-GWCFXTLKSA-N 1 2 238.306 2.220 20 0 BEADLO Cc1oncc1C[N@H+]1C[C@@H](C)OCC12CCC2 ZINC000844421765 588191717 /nfs/dbraw/zinc/19/17/17/588191717.db2.gz JYOZLNIYJTZQLI-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1oncc1C[N@@H+]1C[C@@H](C)OCC12CCC2 ZINC000844421765 588191719 /nfs/dbraw/zinc/19/17/19/588191719.db2.gz JYOZLNIYJTZQLI-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1cnc(C[N@@H+]2C[C@H]3[C@@H](C2)C3(F)F)s1 ZINC000844457022 588196332 /nfs/dbraw/zinc/19/63/32/588196332.db2.gz ILVHARIWVJZXIA-OCAPTIKFSA-N 1 2 230.283 2.148 20 0 BEADLO Cc1cnc(C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)s1 ZINC000844457022 588196333 /nfs/dbraw/zinc/19/63/33/588196333.db2.gz ILVHARIWVJZXIA-OCAPTIKFSA-N 1 2 230.283 2.148 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+]2C[C@H]3[C@@H](C2)C3(F)F)o1 ZINC000844457830 588196624 /nfs/dbraw/zinc/19/66/24/588196624.db2.gz LOCCEEYHBPUDIY-XHNCKOQMSA-N 1 2 228.242 2.241 20 0 BEADLO Cc1cnc([C@H](C)[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)o1 ZINC000844457830 588196625 /nfs/dbraw/zinc/19/66/25/588196625.db2.gz LOCCEEYHBPUDIY-XHNCKOQMSA-N 1 2 228.242 2.241 20 0 BEADLO CC[C@@H](C(=O)OC(C)(C)C)[N@H+](C)CCC(C)=O ZINC000844476622 588198744 /nfs/dbraw/zinc/19/87/44/588198744.db2.gz HGMROAUULBGUDW-NSHDSACASA-N 1 2 243.347 2.018 20 0 BEADLO CC[C@@H](C(=O)OC(C)(C)C)[N@@H+](C)CCC(C)=O ZINC000844476622 588198745 /nfs/dbraw/zinc/19/87/45/588198745.db2.gz HGMROAUULBGUDW-NSHDSACASA-N 1 2 243.347 2.018 20 0 BEADLO CCc1cc[nH+]cc1NCc1nn(CC)nc1C ZINC000844708619 588214600 /nfs/dbraw/zinc/21/46/00/588214600.db2.gz LYNIPFGSQYSHAR-UHFFFAOYSA-N 1 2 245.330 2.176 20 0 BEADLO CCn1nc(C)c(CNc2cc(C)c[nH+]c2C)n1 ZINC000844707395 588214817 /nfs/dbraw/zinc/21/48/17/588214817.db2.gz JARSPJCUIZTGGB-UHFFFAOYSA-N 1 2 245.330 2.230 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2C[C@@H]2C2CCCC2)n1 ZINC000844906064 588218814 /nfs/dbraw/zinc/21/88/14/588218814.db2.gz JJUNAGRWSZNIAG-GHMZBOCLSA-N 1 2 235.331 2.473 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2C[C@H]2C2CCCC2)n1 ZINC000844906067 588219016 /nfs/dbraw/zinc/21/90/16/588219016.db2.gz JJUNAGRWSZNIAG-WDEREUQCSA-N 1 2 235.331 2.473 20 0 BEADLO C[C@@H](NC(=O)c1cccc2[nH+]ccn21)C(C)(C)C ZINC000844968655 588219948 /nfs/dbraw/zinc/21/99/48/588219948.db2.gz XCHSFZHIHUDRQX-SNVBAGLBSA-N 1 2 245.326 2.499 20 0 BEADLO CC[C@H](C)COC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000845281467 588225375 /nfs/dbraw/zinc/22/53/75/588225375.db2.gz HXIKEPQHGLXVGZ-QWRGUYRKSA-N 1 2 224.304 2.424 20 0 BEADLO CCCCOC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000845279462 588225442 /nfs/dbraw/zinc/22/54/42/588225442.db2.gz WQZGYBUGEKLJNI-SNVBAGLBSA-N 1 2 210.277 2.178 20 0 BEADLO CCCCOC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000845279461 588225481 /nfs/dbraw/zinc/22/54/81/588225481.db2.gz WQZGYBUGEKLJNI-JTQLQIEISA-N 1 2 210.277 2.178 20 0 BEADLO C[C@H](CC(=O)OCCC1CC1)n1cc[nH+]c1 ZINC000845281433 588225527 /nfs/dbraw/zinc/22/55/27/588225527.db2.gz HIQSYVLOCGJABU-SNVBAGLBSA-N 1 2 222.288 2.178 20 0 BEADLO O=C(OCCn1cc[nH+]c1)[C@H]1C[C@H]1C1CCCC1 ZINC000845337786 588227087 /nfs/dbraw/zinc/22/70/87/588227087.db2.gz AFBLNWSOUNSFKR-STQMWFEESA-N 1 2 248.326 2.253 20 0 BEADLO C[C@@H](CC(=O)OC[C@@H]1CC1(F)F)n1cc[nH+]c1 ZINC000845581167 588233927 /nfs/dbraw/zinc/23/39/27/588233927.db2.gz FOLHCXKSQUSUEV-IUCAKERBSA-N 1 2 244.241 2.033 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccc(F)nc2)[C@H](C)CO1 ZINC000846043590 588254779 /nfs/dbraw/zinc/25/47/79/588254779.db2.gz LQZSBUKPTCYTTQ-ZYHUDNBSSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccc(F)nc2)[C@H](C)CO1 ZINC000846043590 588254780 /nfs/dbraw/zinc/25/47/80/588254780.db2.gz LQZSBUKPTCYTTQ-ZYHUDNBSSA-N 1 2 238.306 2.220 20 0 BEADLO CCONC(=O)C[NH2+]CC1(C)CCCCCC1 ZINC000846083884 588255879 /nfs/dbraw/zinc/25/58/79/588255879.db2.gz AWMVNJDCWZWYSH-UHFFFAOYSA-N 1 2 242.363 2.004 20 0 BEADLO CCONC(=O)C[NH2+]CCCC1CCCCC1 ZINC000846091132 588256446 /nfs/dbraw/zinc/25/64/46/588256446.db2.gz IIZUJDAJGHQTGM-UHFFFAOYSA-N 1 2 242.363 2.004 20 0 BEADLO C[C@H](COCC1CC1)[NH2+][C@H]1CCCc2[nH]ncc21 ZINC000846204123 588260231 /nfs/dbraw/zinc/26/02/31/588260231.db2.gz DQEAKWBAIGAXEO-MFKMUULPSA-N 1 2 249.358 2.192 20 0 BEADLO C[C@H]1C[C@H](C)C[NH+](Cc2cnsn2)C1 ZINC000846768432 588286890 /nfs/dbraw/zinc/28/68/90/588286890.db2.gz JTNSVFTXUKUOLB-IUCAKERBSA-N 1 2 211.334 2.016 20 0 BEADLO CC(C)[C@H]1C[N@H+](Cc2cnsn2)CCS1 ZINC000846808465 588289911 /nfs/dbraw/zinc/28/99/11/588289911.db2.gz IOFSMUIYAOJWIH-SNVBAGLBSA-N 1 2 243.401 2.112 20 0 BEADLO CC(C)[C@H]1C[N@@H+](Cc2cnsn2)CCS1 ZINC000846808465 588289912 /nfs/dbraw/zinc/28/99/12/588289912.db2.gz IOFSMUIYAOJWIH-SNVBAGLBSA-N 1 2 243.401 2.112 20 0 BEADLO CC(C)C[C@@H]1CC[N@H+](Cc2cnsn2)C1 ZINC000846807995 588290067 /nfs/dbraw/zinc/29/00/67/588290067.db2.gz OIQYLYYMUVDYEN-JTQLQIEISA-N 1 2 225.361 2.406 20 0 BEADLO CC(C)C[C@@H]1CC[N@@H+](Cc2cnsn2)C1 ZINC000846807995 588290068 /nfs/dbraw/zinc/29/00/68/588290068.db2.gz OIQYLYYMUVDYEN-JTQLQIEISA-N 1 2 225.361 2.406 20 0 BEADLO CO[C@@H]1CC[N@H+](Cc2cnc(Cl)c(F)c2)C1 ZINC000846812351 588290753 /nfs/dbraw/zinc/29/07/53/588290753.db2.gz UHUMLEWGTKHYOJ-SECBINFHSA-N 1 2 244.697 2.095 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2cnc(Cl)c(F)c2)C1 ZINC000846812351 588290754 /nfs/dbraw/zinc/29/07/54/588290754.db2.gz UHUMLEWGTKHYOJ-SECBINFHSA-N 1 2 244.697 2.095 20 0 BEADLO c1nsnc1C[N@@H+](CC1CC1)C1CCC1 ZINC000846881964 588295184 /nfs/dbraw/zinc/29/51/84/588295184.db2.gz GGGJDZGYIJHTAD-UHFFFAOYSA-N 1 2 223.345 2.303 20 0 BEADLO c1nsnc1C[N@H+](CC1CC1)C1CCC1 ZINC000846881964 588295185 /nfs/dbraw/zinc/29/51/85/588295185.db2.gz GGGJDZGYIJHTAD-UHFFFAOYSA-N 1 2 223.345 2.303 20 0 BEADLO c1nsnc1C[NH+]1CCC(C2CC2)CC1 ZINC000846918079 588296754 /nfs/dbraw/zinc/29/67/54/588296754.db2.gz HELVZQWOVZSIBM-UHFFFAOYSA-N 1 2 223.345 2.160 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1cnc(Cl)c(F)c1 ZINC000846926611 588297344 /nfs/dbraw/zinc/29/73/44/588297344.db2.gz XPYJKKUTEUSPNI-SECBINFHSA-N 1 2 244.697 2.095 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1cnc(Cl)c(F)c1 ZINC000846926611 588297345 /nfs/dbraw/zinc/29/73/45/588297345.db2.gz XPYJKKUTEUSPNI-SECBINFHSA-N 1 2 244.697 2.095 20 0 BEADLO CON1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000846973573 588299216 /nfs/dbraw/zinc/29/92/16/588299216.db2.gz AERQXBIEGYONMC-UHFFFAOYSA-N 1 2 240.734 2.019 20 0 BEADLO CON1CC[NH+](Cc2cccc(Cl)c2)CC1 ZINC000846978275 588299925 /nfs/dbraw/zinc/29/99/25/588299925.db2.gz XQVPPHCTFMFQTB-UHFFFAOYSA-N 1 2 240.734 2.019 20 0 BEADLO O[C@H](C[NH+]1Cc2cc(F)c(F)cc2C1)C1CC1 ZINC000847049677 588305098 /nfs/dbraw/zinc/30/50/98/588305098.db2.gz WNISOHTXEHTLLA-CYBMUJFWSA-N 1 2 239.265 2.051 20 0 BEADLO CCCCOC(=O)C(C)(C)[NH2+]CCOC(C)C ZINC000847056492 588305316 /nfs/dbraw/zinc/30/53/16/588305316.db2.gz ASJSRLQCSNNLOD-UHFFFAOYSA-N 1 2 245.363 2.123 20 0 BEADLO C[Si](C)(C)CCCC(=O)NC1=[NH+]CCS1 ZINC000847299192 588310451 /nfs/dbraw/zinc/31/04/51/588310451.db2.gz WMKSKDNNNZYVEQ-UHFFFAOYSA-N 1 2 244.436 2.324 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)OCC(F)F)ccn12 ZINC000848781314 588413693 /nfs/dbraw/zinc/41/36/93/588413693.db2.gz JHSIWKNRKGUQDM-UHFFFAOYSA-N 1 2 240.209 2.065 20 0 BEADLO Cc1c[nH]c(C[NH2+]Cc2ccc(Cl)nc2)n1 ZINC000850036858 588514789 /nfs/dbraw/zinc/51/47/89/588514789.db2.gz SNIWOFOAZIOTAD-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO COc1cc[nH+]cc1COC(=O)C1CC2(CC2)C1 ZINC000850215628 588529653 /nfs/dbraw/zinc/52/96/53/588529653.db2.gz NIALHIBBCVRRPB-UHFFFAOYSA-N 1 2 247.294 2.324 20 0 BEADLO CCONC(=O)C[NH2+][C@@H]1CCC[C@H](CC)CC1 ZINC000850337868 588537666 /nfs/dbraw/zinc/53/76/66/588537666.db2.gz BNCWNCTVOOGBLG-NWDGAFQWSA-N 1 2 242.363 2.003 20 0 BEADLO Cc1cc(C[NH2+][C@@H]2C[C@@H](C)n3ncnc32)c(C)o1 ZINC000850352419 588538175 /nfs/dbraw/zinc/53/81/75/588538175.db2.gz VMPRYBSKDVDDEN-PRHODGIISA-N 1 2 246.314 2.284 20 0 BEADLO CCc1nc(C[NH2+][C@H]2CCCn3nccc32)co1 ZINC000850472500 588549267 /nfs/dbraw/zinc/54/92/67/588549267.db2.gz IVLAMVLNKQSFGN-NSHDSACASA-N 1 2 246.314 2.058 20 0 BEADLO CCCCC[C@H](C)[NH2+]Cc1nnc(COC)[nH]1 ZINC000850513313 588555851 /nfs/dbraw/zinc/55/58/51/588555851.db2.gz FUDBCYNFAGQZJD-JTQLQIEISA-N 1 2 240.351 2.010 20 0 BEADLO c1cc([NH+]2CCCC2)ccc1N[C@H]1CCOC1 ZINC000109430590 588562228 /nfs/dbraw/zinc/56/22/28/588562228.db2.gz MXKXPVXONGYVQZ-ZDUSSCGKSA-N 1 2 232.327 2.488 20 0 BEADLO Cn1c[nH+]cc1COC(=O)C1CCC2(CC2)CC1 ZINC000850868634 588571885 /nfs/dbraw/zinc/57/18/85/588571885.db2.gz GFDLLOLIJFQODB-UHFFFAOYSA-N 1 2 248.326 2.434 20 0 BEADLO CC1(C)CC[C@H]1C(=O)O[C@@H]1CC[N@H+](CCF)C1 ZINC000850997353 588582874 /nfs/dbraw/zinc/58/28/74/588582874.db2.gz DUTVXKRHWGAPKP-MNOVXSKESA-N 1 2 243.322 2.010 20 0 BEADLO CC1(C)CC[C@H]1C(=O)O[C@@H]1CC[N@@H+](CCF)C1 ZINC000850997353 588582875 /nfs/dbraw/zinc/58/28/75/588582875.db2.gz DUTVXKRHWGAPKP-MNOVXSKESA-N 1 2 243.322 2.010 20 0 BEADLO c1csc([C@H]2CCC[N@H+]2Cc2cnon2)c1 ZINC000851714354 588615883 /nfs/dbraw/zinc/61/58/83/588615883.db2.gz QBKVTNUSDJIVMM-SNVBAGLBSA-N 1 2 235.312 2.468 20 0 BEADLO c1csc([C@H]2CCC[N@@H+]2Cc2cnon2)c1 ZINC000851714354 588615884 /nfs/dbraw/zinc/61/58/84/588615884.db2.gz QBKVTNUSDJIVMM-SNVBAGLBSA-N 1 2 235.312 2.468 20 0 BEADLO C[C@H](c1ccccc1)[N@H+](C)Cc1cnon1 ZINC000851717805 588616386 /nfs/dbraw/zinc/61/63/86/588616386.db2.gz XWUNJFHFBMWJBO-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H](c1ccccc1)[N@@H+](C)Cc1cnon1 ZINC000851717805 588616387 /nfs/dbraw/zinc/61/63/87/588616387.db2.gz XWUNJFHFBMWJBO-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO ClC(Cl)=CC[NH+]1CCSCC1 ZINC000851727784 588618579 /nfs/dbraw/zinc/61/85/79/588618579.db2.gz XGOGIEYIFPBPCN-UHFFFAOYSA-N 1 2 212.145 2.354 20 0 BEADLO C[C@H]1C[N@H+](Cc2cccc(F)n2)CC(C)(C)O1 ZINC000851735806 588620449 /nfs/dbraw/zinc/62/04/49/588620449.db2.gz BWMKQGRNWKBTQN-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cccc(F)n2)CC(C)(C)O1 ZINC000851735806 588620450 /nfs/dbraw/zinc/62/04/50/588620450.db2.gz BWMKQGRNWKBTQN-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO Oc1ccc([C@H]2CCC[N@@H+]2Cc2cnon2)cc1 ZINC000851825002 588633631 /nfs/dbraw/zinc/63/36/31/588633631.db2.gz RDNFGNDWOZFHKH-CYBMUJFWSA-N 1 2 245.282 2.112 20 0 BEADLO Oc1ccc([C@H]2CCC[N@H+]2Cc2cnon2)cc1 ZINC000851825002 588633632 /nfs/dbraw/zinc/63/36/32/588633632.db2.gz RDNFGNDWOZFHKH-CYBMUJFWSA-N 1 2 245.282 2.112 20 0 BEADLO Fc1ccc(C2([NH2+]Cc3cnon3)CCC2)cc1 ZINC000851837514 588633975 /nfs/dbraw/zinc/63/39/75/588633975.db2.gz YOKATFZVDJFSCP-UHFFFAOYSA-N 1 2 247.273 2.378 20 0 BEADLO C[C@H](NC(=O)OC1CCCC1)c1[nH+]ccn1C ZINC000851855140 588635444 /nfs/dbraw/zinc/63/54/44/588635444.db2.gz BDIIEJHWYHELDF-VIFPVBQESA-N 1 2 237.303 2.150 20 0 BEADLO O=C1CC[C@@H](C[N@H+](CC(F)F)CC2CCC2)O1 ZINC000851880487 588639013 /nfs/dbraw/zinc/63/90/13/588639013.db2.gz ARWIJPNBUXNNFI-JTQLQIEISA-N 1 2 247.285 2.059 20 0 BEADLO O=C1CC[C@@H](C[N@@H+](CC(F)F)CC2CCC2)O1 ZINC000851880487 588639014 /nfs/dbraw/zinc/63/90/14/588639014.db2.gz ARWIJPNBUXNNFI-JTQLQIEISA-N 1 2 247.285 2.059 20 0 BEADLO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2cnon2)C1 ZINC000851934196 588645475 /nfs/dbraw/zinc/64/54/75/588645475.db2.gz GCTBLZZCMBRUFZ-MFKMUULPSA-N 1 2 244.298 2.048 20 0 BEADLO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cnon2)C1 ZINC000851934196 588645476 /nfs/dbraw/zinc/64/54/76/588645476.db2.gz GCTBLZZCMBRUFZ-MFKMUULPSA-N 1 2 244.298 2.048 20 0 BEADLO CC[C@H]1Cc2ccccc2C[N@@H+]1Cc1cnon1 ZINC000851939579 588646514 /nfs/dbraw/zinc/64/65/14/588646514.db2.gz FSLHMHGFTAZXIZ-AWEZNQCLSA-N 1 2 243.310 2.407 20 0 BEADLO CC[C@H]1Cc2ccccc2C[N@H+]1Cc1cnon1 ZINC000851939579 588646515 /nfs/dbraw/zinc/64/65/15/588646515.db2.gz FSLHMHGFTAZXIZ-AWEZNQCLSA-N 1 2 243.310 2.407 20 0 BEADLO Cc1cc(C)c2c(c1)C[N@@H+](Cc1cnon1)CC2 ZINC000851954277 588647355 /nfs/dbraw/zinc/64/73/55/588647355.db2.gz RIUWRNXGRFOGRR-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1cc(C)c2c(c1)C[N@H+](Cc1cnon1)CC2 ZINC000851954277 588647356 /nfs/dbraw/zinc/64/73/56/588647356.db2.gz RIUWRNXGRFOGRR-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Fc1cccc(C[NH+]2CCC(F)(F)CC2)n1 ZINC000852001262 588654055 /nfs/dbraw/zinc/65/40/55/588654055.db2.gz HBKGRGSADNOVDU-UHFFFAOYSA-N 1 2 230.233 2.452 20 0 BEADLO CC(C)C[C@@H](O)CNc1cc[nH+]c(C(C)C)n1 ZINC000110382407 588659049 /nfs/dbraw/zinc/65/90/49/588659049.db2.gz RRFPIOIZVXBVIC-LLVKDONJSA-N 1 2 237.347 2.419 20 0 BEADLO C[C@@H]([NH2+]CC=C(Cl)Cl)c1ccn(C)n1 ZINC000852161324 588668422 /nfs/dbraw/zinc/66/84/22/588668422.db2.gz GTDQUOGKFZXOJZ-SSDOTTSWSA-N 1 2 234.130 2.390 20 0 BEADLO Fc1cccc(C2([NH2+]Cc3cnon3)CCC2)c1 ZINC000852206885 588671868 /nfs/dbraw/zinc/67/18/68/588671868.db2.gz URBPSTRXNCIUHB-UHFFFAOYSA-N 1 2 247.273 2.378 20 0 BEADLO Fc1ccccc1C1([NH2+]Cc2cnon2)CCC1 ZINC000852206562 588671970 /nfs/dbraw/zinc/67/19/70/588671970.db2.gz MMFADNUZAZDHLH-UHFFFAOYSA-N 1 2 247.273 2.378 20 0 BEADLO CCCOC(=O)[C@H](C)[NH2+]C1(CC(C)C)CC1 ZINC000852682587 588695494 /nfs/dbraw/zinc/69/54/94/588695494.db2.gz GBXQEIPSMPPHNM-NSHDSACASA-N 1 2 227.348 2.496 20 0 BEADLO c1nonc1C[N@@H+]1CC2CC1(c1ccccc1)C2 ZINC000852762793 588700914 /nfs/dbraw/zinc/70/09/14/588700914.db2.gz WSHJYMWLZIZXNG-UHFFFAOYSA-N 1 2 241.294 2.191 20 0 BEADLO c1nonc1C[N@H+]1CC2CC1(c1ccccc1)C2 ZINC000852762793 588700915 /nfs/dbraw/zinc/70/09/15/588700915.db2.gz WSHJYMWLZIZXNG-UHFFFAOYSA-N 1 2 241.294 2.191 20 0 BEADLO C[C@H](CC(=O)OCc1c[nH+]cn1C)c1ccco1 ZINC000860575477 589106850 /nfs/dbraw/zinc/10/68/50/589106850.db2.gz DTZRZAWDYRDLRA-SNVBAGLBSA-N 1 2 248.282 2.250 20 0 BEADLO Cc1c(C[N@H+]2C[C@@H](C)OC[C@@H]2C)ccnc1F ZINC000862223539 589195861 /nfs/dbraw/zinc/19/58/61/589195861.db2.gz QPSJPFAOIMGEAC-VHSXEESVSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1c(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)ccnc1F ZINC000862223539 589195863 /nfs/dbraw/zinc/19/58/63/589195863.db2.gz QPSJPFAOIMGEAC-VHSXEESVSA-N 1 2 238.306 2.138 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1ccc2cc[nH]c2c1 ZINC000862238781 589195949 /nfs/dbraw/zinc/19/59/49/589195949.db2.gz JZSGYHIFTGNERP-UHFFFAOYSA-N 1 2 246.310 2.163 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1ccc2cc[nH]c2c1 ZINC000862238781 589195950 /nfs/dbraw/zinc/19/59/50/589195950.db2.gz JZSGYHIFTGNERP-UHFFFAOYSA-N 1 2 246.310 2.163 20 0 BEADLO Cc1nc(C)c(C[NH2+]Cc2cccc(F)n2)o1 ZINC000862291093 589200122 /nfs/dbraw/zinc/20/01/22/589200122.db2.gz JYOOLNBNZDZUAK-UHFFFAOYSA-N 1 2 235.262 2.115 20 0 BEADLO Cc1ncc(CN2CCC[C@@H]2c2[nH]cc[nH+]2)o1 ZINC000862326973 589201160 /nfs/dbraw/zinc/20/11/60/589201160.db2.gz WFYFFAKUXWPIPD-LLVKDONJSA-N 1 2 232.287 2.043 20 0 BEADLO CCc1nc(C[NH2+]Cc2ccnc(F)c2C)co1 ZINC000862388180 589207332 /nfs/dbraw/zinc/20/73/32/589207332.db2.gz XQBJMPUKFMVKPO-UHFFFAOYSA-N 1 2 249.289 2.369 20 0 BEADLO CC1(C)CCC(C)(C)N(C(=O)Cc2[nH]cc[nH+]2)C1 ZINC000862586536 589226372 /nfs/dbraw/zinc/22/63/72/589226372.db2.gz APORAXXOKLQXRP-UHFFFAOYSA-N 1 2 249.358 2.379 20 0 BEADLO CC1(C)CCC(C)(NC(=O)Cn2cc[nH+]c2)CC1 ZINC000862967824 589249462 /nfs/dbraw/zinc/24/94/62/589249462.db2.gz XMWFGZZSPFPQHO-UHFFFAOYSA-N 1 2 249.358 2.358 20 0 BEADLO S=c1ncccn1C[NH+](C1CC1)C1CC1 ZINC000863303783 589277515 /nfs/dbraw/zinc/27/75/15/589277515.db2.gz AGOWECUIAIMHSY-UHFFFAOYSA-N 1 2 221.329 2.197 20 0 BEADLO Cc1nc(CC(N)=[NH+]OC[C@H]2C[C@H]2C)cs1 ZINC000863455544 589288654 /nfs/dbraw/zinc/28/86/54/589288654.db2.gz MFFLPDKZOPBDNY-VXNVDRBHSA-N 1 2 239.344 2.148 20 0 BEADLO COC1(C(N)=[NH+]OCCCCF)CCCC1 ZINC000863478651 589291908 /nfs/dbraw/zinc/29/19/08/589291908.db2.gz UJEFWDYJYUSQLD-UHFFFAOYSA-N 1 2 232.299 2.194 20 0 BEADLO CCSCCO[NH+]=C(N)C1(OC)CCCC1 ZINC000863478049 589292095 /nfs/dbraw/zinc/29/20/95/589292095.db2.gz IDUSMQXKHASPKP-UHFFFAOYSA-N 1 2 246.376 2.197 20 0 BEADLO Cc1[nH+]cc(-c2scc3c2OCCO3)n1C ZINC000863975427 589331090 /nfs/dbraw/zinc/33/10/90/589331090.db2.gz POGKLHITQINDJN-UHFFFAOYSA-N 1 2 236.296 2.228 20 0 BEADLO C[C@@H](O)c1cccc(N[C@@H]2COC(C)(C)C2)[nH+]1 ZINC000864090194 589343266 /nfs/dbraw/zinc/34/32/66/589343266.db2.gz BQYOLRMKNPSPAD-ZJUUUORDSA-N 1 2 236.315 2.114 20 0 BEADLO CS[C@H]1C[C@H](Nc2cccc([C@@H](C)O)[nH+]2)C1 ZINC000864090933 589343520 /nfs/dbraw/zinc/34/35/20/589343520.db2.gz LSKGZXJBKWQBDV-OPRDCNLKSA-N 1 2 238.356 2.441 20 0 BEADLO C[N@H+](Cc1ccsc1)Cc1cncnc1 ZINC000120448497 589415535 /nfs/dbraw/zinc/41/55/35/589415535.db2.gz JPPLTOJAGWMBNE-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO C[N@@H+](Cc1ccsc1)Cc1cncnc1 ZINC000120448497 589415536 /nfs/dbraw/zinc/41/55/36/589415536.db2.gz JPPLTOJAGWMBNE-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO CC(C)(C)NC(=O)Cn1c[nH+]c(C(C)(C)C)c1 ZINC000865375399 589428386 /nfs/dbraw/zinc/42/83/86/589428386.db2.gz UZYWPISIGKKJLD-UHFFFAOYSA-N 1 2 237.347 2.095 20 0 BEADLO CC[C@H](C)NC(=O)Cn1c[nH+]c(C(C)(C)C)c1 ZINC000865374789 589428430 /nfs/dbraw/zinc/42/84/30/589428430.db2.gz KUEFIIIGZBSNSQ-JTQLQIEISA-N 1 2 237.347 2.095 20 0 BEADLO CC(=O)c1cc(Cn2c[nH+]c(C(C)(C)C)c2)on1 ZINC000865376476 589429021 /nfs/dbraw/zinc/42/90/21/589429021.db2.gz OREOESBXXPNWBA-UHFFFAOYSA-N 1 2 247.298 2.420 20 0 BEADLO Cc1cc(C(F)(F)F)c[nH+]c1NC[C@@H](C)O ZINC000865401572 589433055 /nfs/dbraw/zinc/43/30/55/589433055.db2.gz CPHIWORLGFBFIR-SSDOTTSWSA-N 1 2 234.221 2.202 20 0 BEADLO Fc1cncc(NCc2cn(C3CC3)c[nH+]2)c1 ZINC000865553770 589445703 /nfs/dbraw/zinc/44/57/03/589445703.db2.gz JSWFQDPMRGFACF-UHFFFAOYSA-N 1 2 232.262 2.364 20 0 BEADLO CCCCc1cc(N[C@H](CCO)C2CC2)nc[nH+]1 ZINC000865552632 589445996 /nfs/dbraw/zinc/44/59/96/589445996.db2.gz NBPSUYLDGYOXHN-CYBMUJFWSA-N 1 2 249.358 2.392 20 0 BEADLO COc1cncc(NCc2[nH]c(C)c(C)[nH+]2)c1 ZINC000865657003 589454692 /nfs/dbraw/zinc/45/46/92/589454692.db2.gz VXTQSNPCFKHSBM-UHFFFAOYSA-N 1 2 232.287 2.042 20 0 BEADLO CC1(C)CN(c2[nH+]cnc3[nH]c(Cl)cc32)C1 ZINC000865735182 589459412 /nfs/dbraw/zinc/45/94/12/589459412.db2.gz GBYLCUMEHISDTI-UHFFFAOYSA-N 1 2 236.706 2.409 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2C[C@H]2C(C)(C)C)cc[nH+]1 ZINC000865741782 589460135 /nfs/dbraw/zinc/46/01/35/589460135.db2.gz RPFYAPQHPPBFSI-VXGBXAGGSA-N 1 2 232.327 2.433 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2C[C@@H]2[C@H]2C[C@H]2C)cc[nH+]1 ZINC000865741577 589460193 /nfs/dbraw/zinc/46/01/93/589460193.db2.gz PYRILMGHWMLNBC-GHORINQJSA-N 1 2 230.311 2.043 20 0 BEADLO Clc1cc2c(nc[nH+]c2N2CC[C@@H]3C[C@@H]32)[nH]1 ZINC000865756561 589461351 /nfs/dbraw/zinc/46/13/51/589461351.db2.gz SPKKDRQZAKNWQT-SVRRBLITSA-N 1 2 234.690 2.162 20 0 BEADLO CC(C)Cc1cc(NCCC2(O)CCC2)nc[nH+]1 ZINC000865771525 589461439 /nfs/dbraw/zinc/46/14/39/589461439.db2.gz JSMPKPMCMOSAPH-UHFFFAOYSA-N 1 2 249.358 2.392 20 0 BEADLO C[C@H](O)c1ccc(N2CCC[C@H]3C[C@H]32)[nH+]c1 ZINC000865794072 589462070 /nfs/dbraw/zinc/46/20/70/589462070.db2.gz JUQJFIVJFJQJDT-JBLDHEPKSA-N 1 2 218.300 2.124 20 0 BEADLO CCCNc1cc(N2CCC[C@H]3C[C@H]32)nc[nH+]1 ZINC000865793327 589462216 /nfs/dbraw/zinc/46/22/16/589462216.db2.gz FFXGNHNTUAPTJU-WDEREUQCSA-N 1 2 232.331 2.287 20 0 BEADLO CCCNc1cc(N2CCC[C@H]3C[C@H]32)[nH+]cn1 ZINC000865793327 589462217 /nfs/dbraw/zinc/46/22/17/589462217.db2.gz FFXGNHNTUAPTJU-WDEREUQCSA-N 1 2 232.331 2.287 20 0 BEADLO CC/C=C(\F)C(=O)NCCCCn1cc[nH+]c1 ZINC000865804774 589462230 /nfs/dbraw/zinc/46/22/30/589462230.db2.gz HLWKYANCDKCURG-WZUFQYTHSA-N 1 2 239.294 2.043 20 0 BEADLO C[C@H]1CC[C@H]1Nc1[nH+]cnc2[nH]c(Cl)cc21 ZINC000865803728 589462247 /nfs/dbraw/zinc/46/22/47/589462247.db2.gz HYOILXZRTGEXOL-POYBYMJQSA-N 1 2 236.706 2.244 20 0 BEADLO CCCCc1cc(NCc2c[nH+]cn2C)ncn1 ZINC000865813978 589462996 /nfs/dbraw/zinc/46/29/96/589462996.db2.gz DFESYCPPWMJJIN-UHFFFAOYSA-N 1 2 245.330 2.165 20 0 BEADLO C[C@@H]1[C@@H](C)CN1c1[nH+]cnc2[nH]c(Cl)cc21 ZINC000865839214 589464535 /nfs/dbraw/zinc/46/45/35/589464535.db2.gz JRSFOMYUASFLOF-NKWVEPMBSA-N 1 2 236.706 2.408 20 0 BEADLO CCc1nc(CNc2ccc([C@@H](C)O)c[nH+]2)co1 ZINC000865859177 589465490 /nfs/dbraw/zinc/46/54/90/589465490.db2.gz MNMGQTWUVIHJTM-SECBINFHSA-N 1 2 247.298 2.297 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1C[C@@H]1[C@H]1C[C@H]1C ZINC000865859524 589465649 /nfs/dbraw/zinc/46/56/49/589465649.db2.gz BLUBSLGCSXLUAO-GWNIPJSYSA-N 1 2 244.338 2.297 20 0 BEADLO Cc1cc(C(F)(F)F)c[nH+]c1N[C@H]1C[C@@H](O)C1 ZINC000865862148 589465861 /nfs/dbraw/zinc/46/58/61/589465861.db2.gz GXUMAASWMSNKII-DTORHVGOSA-N 1 2 246.232 2.344 20 0 BEADLO CN(C)c1ccc(NCc2cn(C)c[nH+]2)cc1F ZINC000865864200 589465878 /nfs/dbraw/zinc/46/58/78/589465878.db2.gz NQDWPUYVJOYOAY-UHFFFAOYSA-N 1 2 248.305 2.237 20 0 BEADLO C[C@@H](O)c1ccc(N[C@@H](C)c2ccn(C)n2)[nH+]c1 ZINC000865872718 589466369 /nfs/dbraw/zinc/46/63/69/589466369.db2.gz STROQGWAZCSVSH-VHSXEESVSA-N 1 2 246.314 2.042 20 0 BEADLO CC(C)c1nc2[nH]ccc2c(N[C@@H]2CC[C@H]2O)[nH+]1 ZINC000865890929 589467433 /nfs/dbraw/zinc/46/74/33/589467433.db2.gz ZWKRKKAFUXDCAY-NXEZZACHSA-N 1 2 246.314 2.017 20 0 BEADLO Cc1n[nH]cc1CN(C)c1cc[nH+]c(C(C)C)n1 ZINC000865901111 589467703 /nfs/dbraw/zinc/46/77/03/589467703.db2.gz LYYGNRMNACQYNZ-UHFFFAOYSA-N 1 2 245.330 2.268 20 0 BEADLO CCCCCOC(=O)[C@H](C)[NH+]1CCSCC1 ZINC000120807046 589469248 /nfs/dbraw/zinc/46/92/48/589469248.db2.gz ACSMJKNFQMXFCH-NSHDSACASA-N 1 2 245.388 2.157 20 0 BEADLO CCc1nc(N2C[C@@H](OC)CC[C@H]2C)cc(C)[nH+]1 ZINC000866072662 589474949 /nfs/dbraw/zinc/47/49/49/589474949.db2.gz LXRLPEXWMUVXIB-NEPJUHHUSA-N 1 2 249.358 2.351 20 0 BEADLO Cc1cc(NC[C@@H]2C[C@H]2C2CCOCC2)nc[nH+]1 ZINC000866179712 589478984 /nfs/dbraw/zinc/47/89/84/589478984.db2.gz CQWFNBGYVUKONH-STQMWFEESA-N 1 2 247.342 2.260 20 0 BEADLO c1ccc(N2CC[C@@H]3CSC[C@@H]3C2)[nH+]c1 ZINC000866205618 589480291 /nfs/dbraw/zinc/48/02/91/589480291.db2.gz GOOQJTXWZRLOCO-MNOVXSKESA-N 1 2 220.341 2.271 20 0 BEADLO C[C@@H](Nc1ccc([C@H](C)O)c[nH+]1)c1ccnn1C ZINC000866253409 589483213 /nfs/dbraw/zinc/48/32/13/589483213.db2.gz YIJQLHBECNTHQL-ZJUUUORDSA-N 1 2 246.314 2.042 20 0 BEADLO CC(C)(C)OC1CN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000866279624 589484018 /nfs/dbraw/zinc/48/40/18/589484018.db2.gz ZGAUVDKLGFMFSG-UHFFFAOYSA-N 1 2 247.342 2.358 20 0 BEADLO CC[C@H](C[C@H](C)O)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000866300948 589484830 /nfs/dbraw/zinc/48/48/30/589484830.db2.gz ZZERZMJRLFRGET-WCBMZHEXSA-N 1 2 248.330 2.228 20 0 BEADLO Cc1cccc(C[C@@H](C)[NH2+]CC(F)(F)CO)c1 ZINC000866340246 589487069 /nfs/dbraw/zinc/48/70/69/589487069.db2.gz IBZGOJSFVRBPTC-LLVKDONJSA-N 1 2 243.297 2.143 20 0 BEADLO FC(F)(F)[C@@H]1C[C@H]1[NH2+][C@@H]1CCCc2[nH]ncc21 ZINC000866498862 589497609 /nfs/dbraw/zinc/49/76/09/589497609.db2.gz BRNFAGXPZOHMRX-NQMVMOMDSA-N 1 2 245.248 2.328 20 0 BEADLO CCCCN(c1cc[nH+]cc1)S(=O)(=O)CC ZINC000867627967 589527815 /nfs/dbraw/zinc/52/78/15/589527815.db2.gz MIFACCRITURMNF-UHFFFAOYSA-N 1 2 242.344 2.038 20 0 BEADLO CCCOC(=O)NC[C@@H]1c2ccccc2C[N@H+]1C ZINC000867793051 589534441 /nfs/dbraw/zinc/53/44/41/589534441.db2.gz DESMEDWXSZGKNE-CYBMUJFWSA-N 1 2 248.326 2.309 20 0 BEADLO CCCOC(=O)NC[C@@H]1c2ccccc2C[N@@H+]1C ZINC000867793051 589534442 /nfs/dbraw/zinc/53/44/42/589534442.db2.gz DESMEDWXSZGKNE-CYBMUJFWSA-N 1 2 248.326 2.309 20 0 BEADLO Cc1cc(C)c(C(=O)NCc2c[nH+]cn2C)s1 ZINC000868413419 589557903 /nfs/dbraw/zinc/55/79/03/589557903.db2.gz SVAHOIYGHIXPSZ-UHFFFAOYSA-N 1 2 249.339 2.028 20 0 BEADLO O=C(N[C@@H]1CCn2cc[nH+]c21)[C@]12C[C@H]1CCCC2 ZINC000868621532 589568636 /nfs/dbraw/zinc/56/86/36/589568636.db2.gz WQZFQRPYFKMSJJ-JTNHKYCSSA-N 1 2 245.326 2.024 20 0 BEADLO O=C(N[C@@H]1CCn2cc[nH+]c21)[C@@]12C[C@@H]1CCCC2 ZINC000868621535 589568793 /nfs/dbraw/zinc/56/87/93/589568793.db2.gz WQZFQRPYFKMSJJ-WDMOLILDSA-N 1 2 245.326 2.024 20 0 BEADLO Cn1c[nH+]cc1CNc1ccc(Cl)nc1 ZINC000122796256 589631678 /nfs/dbraw/zinc/63/16/78/589631678.db2.gz WADKFYRBLRDRHI-UHFFFAOYSA-N 1 2 222.679 2.081 20 0 BEADLO C[C@H](CC(=O)OC[C@@H]1C[C@H]1C1CC1)n1cc[nH+]c1 ZINC000870671531 589682506 /nfs/dbraw/zinc/68/25/06/589682506.db2.gz PYZHKLYCTPMFKH-WXHSDQCUSA-N 1 2 248.326 2.424 20 0 BEADLO FC(F)Cn1cc[nH+]c1CSc1ncc[nH]1 ZINC000871654857 589782612 /nfs/dbraw/zinc/78/26/12/589782612.db2.gz LSYQKGOFAGZVQX-UHFFFAOYSA-N 1 2 244.270 2.164 20 0 BEADLO CC(C)CCO[NH+]=C(N)COC1CCC1 ZINC000871774847 589813224 /nfs/dbraw/zinc/81/32/24/589813224.db2.gz HNRXRECNKIFKHD-UHFFFAOYSA-N 1 2 214.309 2.100 20 0 BEADLO Fc1cccc2c1CC[N@H+](Cc1cncnc1)C2 ZINC000123786775 589814106 /nfs/dbraw/zinc/81/41/06/589814106.db2.gz PFXJAHQKIBSXES-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1cccc2c1CC[N@@H+](Cc1cncnc1)C2 ZINC000123786775 589814107 /nfs/dbraw/zinc/81/41/07/589814107.db2.gz PFXJAHQKIBSXES-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO CC/C=C/CCO[NH+]=C(N)COC1CCC1 ZINC000871778938 589814684 /nfs/dbraw/zinc/81/46/84/589814684.db2.gz YJDJFAOUKNICMT-ONEGZZNKSA-N 1 2 226.320 2.410 20 0 BEADLO CCC(CC)CO[NH+]=C(N)COC1CCC1 ZINC000871778846 589814972 /nfs/dbraw/zinc/81/49/72/589814972.db2.gz VZPPGHBKOTYDAN-UHFFFAOYSA-N 1 2 228.336 2.490 20 0 BEADLO CC(C)C[C@H](C)O[NH+]=C(N)COC1CCC1 ZINC000871778701 589815186 /nfs/dbraw/zinc/81/51/86/589815186.db2.gz STIHGPQQRGMMLZ-JTQLQIEISA-N 1 2 228.336 2.489 20 0 BEADLO CC/C=C\CCO[NH+]=C(N)COC1CCC1 ZINC000871778937 589815284 /nfs/dbraw/zinc/81/52/84/589815284.db2.gz YJDJFAOUKNICMT-ARJAWSKDSA-N 1 2 226.320 2.410 20 0 BEADLO CC(C)[C@H]([NH2+][C@@H]1CCOC1=O)c1ccccc1 ZINC000123848584 589828610 /nfs/dbraw/zinc/82/86/10/589828610.db2.gz YENXMOKEMQETEE-OLZOCXBDSA-N 1 2 233.311 2.289 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[NH2+][C@@H]1CC12CCC2 ZINC000871937994 589834691 /nfs/dbraw/zinc/83/46/91/589834691.db2.gz KFRTWZREQONIAN-NWDGAFQWSA-N 1 2 239.359 2.496 20 0 BEADLO Cc1nonc1C[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000871937095 589834998 /nfs/dbraw/zinc/83/49/98/589834998.db2.gz AQDZFMYORPHXRA-LBPRGKRZSA-N 1 2 247.273 2.294 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@@H]1C[C@H]2CCC[C@@H]2O1 ZINC000872110062 589874403 /nfs/dbraw/zinc/87/44/03/589874403.db2.gz VLQKHDUGYGVYHT-TWJQMWNJSA-N 1 2 249.358 2.326 20 0 BEADLO Cc1nonc1C[NH2+][C@@H](C)c1ccc(C)nc1C ZINC000872137127 589878830 /nfs/dbraw/zinc/87/88/30/589878830.db2.gz QTZXFJNFQBLPBW-VIFPVBQESA-N 1 2 246.314 2.241 20 0 BEADLO Cc1nonc1C[NH2+][C@H]1CCCc2occc21 ZINC000872135927 589879455 /nfs/dbraw/zinc/87/94/55/589879455.db2.gz JKPPHENDEUXPKY-JTQLQIEISA-N 1 2 233.271 2.138 20 0 BEADLO CCC[C@H]([NH2+]Cc1nonc1C)c1ccccn1 ZINC000872137626 589879943 /nfs/dbraw/zinc/87/99/43/589879943.db2.gz UUFBJHZJAMDSEW-NSHDSACASA-N 1 2 246.314 2.404 20 0 BEADLO CC1(C)C[N@H+](CN2CCCC2=O)[C@@H]1c1ccco1 ZINC000872633286 589957644 /nfs/dbraw/zinc/95/76/44/589957644.db2.gz CTHXBLNQNRKAKL-CYBMUJFWSA-N 1 2 248.326 2.242 20 0 BEADLO CC1(C)C[N@@H+](CN2CCCC2=O)[C@@H]1c1ccco1 ZINC000872633286 589957646 /nfs/dbraw/zinc/95/76/46/589957646.db2.gz CTHXBLNQNRKAKL-CYBMUJFWSA-N 1 2 248.326 2.242 20 0 BEADLO Cc1nc(NC[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc[nH+]1 ZINC000872699772 589962818 /nfs/dbraw/zinc/96/28/18/589962818.db2.gz UAKZJNHUJQWKQJ-SRVKXCTJSA-N 1 2 233.315 2.155 20 0 BEADLO CCn1ncc(NCc2[nH]c(C)c(C)[nH+]2)c1C ZINC000873195831 589990905 /nfs/dbraw/zinc/99/09/05/589990905.db2.gz DKDGGSUMFJJAEU-UHFFFAOYSA-N 1 2 233.319 2.163 20 0 BEADLO CCC1(CC)CCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC000874630684 590120378 /nfs/dbraw/zinc/12/03/78/590120378.db2.gz YCVKEANKWUYANW-UHFFFAOYSA-N 1 2 235.331 2.133 20 0 BEADLO COC1CC[NH+](Cc2nc(Cl)cs2)CC1 ZINC000876554334 590215195 /nfs/dbraw/zinc/21/51/95/590215195.db2.gz KKNJFNAMWHKHFV-UHFFFAOYSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@@]1(O)CCC[N@H+](Cc2nc(Cl)cs2)C1 ZINC000876759079 590238778 /nfs/dbraw/zinc/23/87/78/590238778.db2.gz KIQFBUCURMMOBK-SNVBAGLBSA-N 1 2 246.763 2.143 20 0 BEADLO C[C@@]1(O)CCC[N@@H+](Cc2nc(Cl)cs2)C1 ZINC000876759079 590238779 /nfs/dbraw/zinc/23/87/79/590238779.db2.gz KIQFBUCURMMOBK-SNVBAGLBSA-N 1 2 246.763 2.143 20 0 BEADLO C[N@H+](Cc1nc(Cl)cs1)CC1(CO)CC1 ZINC000877461788 590331590 /nfs/dbraw/zinc/33/15/90/590331590.db2.gz KFIIYGABFYGKGW-UHFFFAOYSA-N 1 2 246.763 2.001 20 0 BEADLO C[N@@H+](Cc1nc(Cl)cs1)CC1(CO)CC1 ZINC000877461788 590331593 /nfs/dbraw/zinc/33/15/93/590331593.db2.gz KFIIYGABFYGKGW-UHFFFAOYSA-N 1 2 246.763 2.001 20 0 BEADLO CC(C)C1C[NH+](Cc2ccc(Cl)nn2)C1 ZINC000877486082 590338719 /nfs/dbraw/zinc/33/87/19/590338719.db2.gz DMUNMHNCYFTZLB-UHFFFAOYSA-N 1 2 225.723 2.218 20 0 BEADLO CC1C[NH+](Cc2cccnc2Br)C1 ZINC000877487070 590339074 /nfs/dbraw/zinc/33/90/74/590339074.db2.gz BTUYTENRKSNAJS-UHFFFAOYSA-N 1 2 241.132 2.296 20 0 BEADLO FC1(F)CC[NH+](Cc2ccns2)CC1 ZINC000877492895 590339952 /nfs/dbraw/zinc/33/99/52/590339952.db2.gz WXAAANGWYDKFRB-UHFFFAOYSA-N 1 2 218.272 2.374 20 0 BEADLO COc1ncc(C[NH+]2CCC(F)(F)CC2)s1 ZINC000877492513 590340047 /nfs/dbraw/zinc/34/00/47/590340047.db2.gz YAOCMYILIGPWFI-UHFFFAOYSA-N 1 2 248.298 2.383 20 0 BEADLO CO[C@H](C[NH2+]C(CF)CF)Cc1ccccc1 ZINC000877556055 590356688 /nfs/dbraw/zinc/35/66/88/590356688.db2.gz KGJUTZRYERHBFC-ZDUSSCGKSA-N 1 2 243.297 2.141 20 0 BEADLO CCc1nc(C[NH2+]Cc2ccc(CO)cc2)co1 ZINC000877570849 590362246 /nfs/dbraw/zinc/36/22/46/590362246.db2.gz OHAFPZHAYDKLMO-UHFFFAOYSA-N 1 2 246.310 2.019 20 0 BEADLO CC(C)(C)Oc1cccc(C[NH+]2CC(C)(O)C2)c1 ZINC000877580368 590364257 /nfs/dbraw/zinc/36/42/57/590364257.db2.gz AWLBYZZZWWESJP-UHFFFAOYSA-N 1 2 249.354 2.431 20 0 BEADLO C[C@@H]1CC[C@@H](O)C[N@@H+]1Cc1nc(Cl)cs1 ZINC000877595669 590369912 /nfs/dbraw/zinc/36/99/12/590369912.db2.gz GYXXBADZIAKHSV-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H]1CC[C@@H](O)C[N@H+]1Cc1nc(Cl)cs1 ZINC000877595669 590369916 /nfs/dbraw/zinc/36/99/16/590369916.db2.gz GYXXBADZIAKHSV-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO CC1(C[N@@H+]2CC[C@H](O)C(F)(F)C2)CCCC1 ZINC000877624348 590375530 /nfs/dbraw/zinc/37/55/30/590375530.db2.gz NYBLGCMJARWBGG-JTQLQIEISA-N 1 2 233.302 2.269 20 0 BEADLO CC1(C[N@H+]2CC[C@H](O)C(F)(F)C2)CCCC1 ZINC000877624348 590375533 /nfs/dbraw/zinc/37/55/33/590375533.db2.gz NYBLGCMJARWBGG-JTQLQIEISA-N 1 2 233.302 2.269 20 0 BEADLO C[C@H]1CC[C@@H]1Nc1c[nH+]cc(N(C)C)c1 ZINC000877667155 590389261 /nfs/dbraw/zinc/38/92/61/590389261.db2.gz DSUOFFOJQBALMH-CABZTGNLSA-N 1 2 205.305 2.358 20 0 BEADLO Cc1cc(C[NH2+]Cc2ncc[nH]2)cc(Cl)n1 ZINC000877672347 590389550 /nfs/dbraw/zinc/38/95/50/590389550.db2.gz CHZYRPXNRLUWSS-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO Cc1cc(C[NH2+][C@@H]2CCCC[C@@H]2F)no1 ZINC000877683174 590391383 /nfs/dbraw/zinc/39/13/83/590391383.db2.gz ZGOZBHNUSUVMOR-WDEREUQCSA-N 1 2 212.268 2.353 20 0 BEADLO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2cc[nH]n2)C1 ZINC000877811906 590426816 /nfs/dbraw/zinc/42/68/16/590426816.db2.gz BZUQMWLMHBZFBY-SECBINFHSA-N 1 2 233.237 2.184 20 0 BEADLO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2cc[nH]n2)C1 ZINC000877811906 590426814 /nfs/dbraw/zinc/42/68/14/590426814.db2.gz BZUQMWLMHBZFBY-SECBINFHSA-N 1 2 233.237 2.184 20 0 BEADLO C[C@]1(C(F)(F)F)CC[N@H+](Cc2cc[nH]n2)C1 ZINC000877811907 590427349 /nfs/dbraw/zinc/42/73/49/590427349.db2.gz BZUQMWLMHBZFBY-VIFPVBQESA-N 1 2 233.237 2.184 20 0 BEADLO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2cc[nH]n2)C1 ZINC000877811907 590427351 /nfs/dbraw/zinc/42/73/51/590427351.db2.gz BZUQMWLMHBZFBY-VIFPVBQESA-N 1 2 233.237 2.184 20 0 BEADLO Cc1cccc(CCn2cc(C3CC3)nn2)[nH+]1 ZINC000877886282 590439117 /nfs/dbraw/zinc/43/91/17/590439117.db2.gz IQIVIHHULOMETL-UHFFFAOYSA-N 1 2 228.299 2.102 20 0 BEADLO CCC[N@H+](CC[C@@H](O)C(C)C)CC(F)F ZINC000878031740 590475936 /nfs/dbraw/zinc/47/59/36/590475936.db2.gz CKFQXWCWINKGJE-SNVBAGLBSA-N 1 2 223.307 2.371 20 0 BEADLO CCC[N@@H+](CC[C@@H](O)C(C)C)CC(F)F ZINC000878031740 590475938 /nfs/dbraw/zinc/47/59/38/590475938.db2.gz CKFQXWCWINKGJE-SNVBAGLBSA-N 1 2 223.307 2.371 20 0 BEADLO C[N@H+](CCCOC(F)(F)F)CC(F)F ZINC000878051970 590482779 /nfs/dbraw/zinc/48/27/79/590482779.db2.gz OBOFMPPYXPKEBW-UHFFFAOYSA-N 1 2 221.169 2.110 20 0 BEADLO C[N@@H+](CCCOC(F)(F)F)CC(F)F ZINC000878051970 590482781 /nfs/dbraw/zinc/48/27/81/590482781.db2.gz OBOFMPPYXPKEBW-UHFFFAOYSA-N 1 2 221.169 2.110 20 0 BEADLO CC1(C)CC[N@H+](Cc2nccn2CC(F)F)C1 ZINC000878147980 590504454 /nfs/dbraw/zinc/50/44/54/590504454.db2.gz CMCMATWAMANVCM-UHFFFAOYSA-N 1 2 243.301 2.380 20 0 BEADLO CC1(C)CC[N@@H+](Cc2nccn2CC(F)F)C1 ZINC000878147980 590504455 /nfs/dbraw/zinc/50/44/55/590504455.db2.gz CMCMATWAMANVCM-UHFFFAOYSA-N 1 2 243.301 2.380 20 0 BEADLO CC[C@@H]1CCC[C@]1(C)C(=O)NCCn1cc[nH+]c1 ZINC000878223187 590526007 /nfs/dbraw/zinc/52/60/07/590526007.db2.gz LXZPRZNGRSZDRI-OCCSQVGLSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@H]1COCCC[N@@H+]1Cc1scnc1Cl ZINC000878287115 590534540 /nfs/dbraw/zinc/53/45/40/590534540.db2.gz WVJMJRGTWFGKOE-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@H]1COCCC[N@H+]1Cc1scnc1Cl ZINC000878287115 590534542 /nfs/dbraw/zinc/53/45/42/590534542.db2.gz WVJMJRGTWFGKOE-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO C[N@@H+](Cc1ncc[nH]1)C[C@@H]1CCCC(C)(C)O1 ZINC000878315527 590541828 /nfs/dbraw/zinc/54/18/28/590541828.db2.gz QKPONFBMACZTOC-NSHDSACASA-N 1 2 237.347 2.189 20 0 BEADLO C[N@H+](Cc1ncc[nH]1)C[C@@H]1CCCC(C)(C)O1 ZINC000878315527 590541829 /nfs/dbraw/zinc/54/18/29/590541829.db2.gz QKPONFBMACZTOC-NSHDSACASA-N 1 2 237.347 2.189 20 0 BEADLO Cc1nc(C[N@H+](C)CCCC2CC2)no1 ZINC000878381979 590557076 /nfs/dbraw/zinc/55/70/76/590557076.db2.gz XNBBEMJAQLVSLG-UHFFFAOYSA-N 1 2 209.293 2.000 20 0 BEADLO Cc1nc(C[N@@H+](C)CCCC2CC2)no1 ZINC000878381979 590557078 /nfs/dbraw/zinc/55/70/78/590557078.db2.gz XNBBEMJAQLVSLG-UHFFFAOYSA-N 1 2 209.293 2.000 20 0 BEADLO Cc1conc1C[N@H+]1CC[C@H](C)[C@H](F)C1 ZINC000878383827 590557623 /nfs/dbraw/zinc/55/76/23/590557623.db2.gz WKBAYTLEUKGBIO-WCBMZHEXSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1conc1C[N@@H+]1CC[C@H](C)[C@H](F)C1 ZINC000878383827 590557624 /nfs/dbraw/zinc/55/76/24/590557624.db2.gz WKBAYTLEUKGBIO-WCBMZHEXSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1conc1C[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000878383825 590557759 /nfs/dbraw/zinc/55/77/59/590557759.db2.gz WKBAYTLEUKGBIO-PSASIEDQSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1conc1C[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000878383825 590557760 /nfs/dbraw/zinc/55/77/60/590557760.db2.gz WKBAYTLEUKGBIO-PSASIEDQSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1conc1C[N@@H+]1CCC[C@H](OC(F)F)C1 ZINC000878394430 590558577 /nfs/dbraw/zinc/55/85/77/590558577.db2.gz WBAIOURKNHIALG-VIFPVBQESA-N 1 2 246.257 2.187 20 0 BEADLO Cc1conc1C[N@H+]1CCC[C@H](OC(F)F)C1 ZINC000878394430 590558580 /nfs/dbraw/zinc/55/85/80/590558580.db2.gz WBAIOURKNHIALG-VIFPVBQESA-N 1 2 246.257 2.187 20 0 BEADLO Cc1conc1C[N@@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000878530903 590587557 /nfs/dbraw/zinc/58/75/57/590587557.db2.gz ANGGBQBJAYYAGJ-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1conc1C[N@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000878530903 590587559 /nfs/dbraw/zinc/58/75/59/590587559.db2.gz ANGGBQBJAYYAGJ-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1nccn1CC(F)F ZINC000878533701 590588189 /nfs/dbraw/zinc/58/81/89/590588189.db2.gz RGRVEBFVOVPKPF-IUCAKERBSA-N 1 2 229.274 2.131 20 0 BEADLO C=C/C=C\CC[N@@H+]1CCC[C@H](C2N=NC(=O)O2)C1 ZINC000878549355 590590374 /nfs/dbraw/zinc/59/03/74/590590374.db2.gz FHKQVBZNMROLGM-BYCRGOAPSA-N 1 2 249.314 2.087 20 0 BEADLO C=C/C=C\CC[N@H+]1CCC[C@H](C2N=NC(=O)O2)C1 ZINC000878549355 590590375 /nfs/dbraw/zinc/59/03/75/590590375.db2.gz FHKQVBZNMROLGM-BYCRGOAPSA-N 1 2 249.314 2.087 20 0 BEADLO FC(F)(F)OCCC[N@@H+]1Cc2ccncc2C1 ZINC000878609017 590595686 /nfs/dbraw/zinc/59/56/86/590595686.db2.gz LFIBBCLWKAEJPW-UHFFFAOYSA-N 1 2 246.232 2.324 20 0 BEADLO FC(F)(F)OCCC[N@H+]1Cc2ccncc2C1 ZINC000878609017 590595687 /nfs/dbraw/zinc/59/56/87/590595687.db2.gz LFIBBCLWKAEJPW-UHFFFAOYSA-N 1 2 246.232 2.324 20 0 BEADLO CO[C@@H](C)C[N@H+](C)Cc1nc2c(o1)CCCC2 ZINC000878613289 590596099 /nfs/dbraw/zinc/59/60/99/590596099.db2.gz JZWIWLHYODLCQZ-JTQLQIEISA-N 1 2 238.331 2.020 20 0 BEADLO CO[C@@H](C)C[N@@H+](C)Cc1nc2c(o1)CCCC2 ZINC000878613289 590596102 /nfs/dbraw/zinc/59/61/02/590596102.db2.gz JZWIWLHYODLCQZ-JTQLQIEISA-N 1 2 238.331 2.020 20 0 BEADLO C=C/C=C\CC[N@H+](CC(F)F)C[C@H](C)O ZINC000878685124 590609092 /nfs/dbraw/zinc/60/90/92/590609092.db2.gz QVOCSAJEZPMCCA-LWTINBJPSA-N 1 2 219.275 2.067 20 0 BEADLO C=C/C=C\CC[N@@H+](CC(F)F)C[C@H](C)O ZINC000878685124 590609094 /nfs/dbraw/zinc/60/90/94/590609094.db2.gz QVOCSAJEZPMCCA-LWTINBJPSA-N 1 2 219.275 2.067 20 0 BEADLO C[C@H](C[N@H+](C)Cc1n[nH]c(=O)o1)CC(C)(C)C ZINC000878726116 590616795 /nfs/dbraw/zinc/61/67/95/590616795.db2.gz JLPAYJHIRQRJLB-VIFPVBQESA-N 1 2 241.335 2.279 20 0 BEADLO C[C@H](C[N@@H+](C)Cc1n[nH]c(=O)o1)CC(C)(C)C ZINC000878726116 590616797 /nfs/dbraw/zinc/61/67/97/590616797.db2.gz JLPAYJHIRQRJLB-VIFPVBQESA-N 1 2 241.335 2.279 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C[C@@H]1C[C@H]1C1CC1 ZINC000878770159 590620531 /nfs/dbraw/zinc/62/05/31/590620531.db2.gz UGGBUSBXWVOUEX-RYUDHWBXSA-N 1 2 230.311 2.187 20 0 BEADLO ClC1=CCC[N@H+](Cc2cncs2)C1 ZINC000878790606 590620877 /nfs/dbraw/zinc/62/08/77/590620877.db2.gz PYFVBYQEIBKGDT-UHFFFAOYSA-N 1 2 214.721 2.472 20 0 BEADLO ClC1=CCC[N@@H+](Cc2cncs2)C1 ZINC000878790606 590620878 /nfs/dbraw/zinc/62/08/78/590620878.db2.gz PYFVBYQEIBKGDT-UHFFFAOYSA-N 1 2 214.721 2.472 20 0 BEADLO Cc1nn(C)cc1C[N@@H+]1CCC=C(Cl)C1 ZINC000878790694 590622781 /nfs/dbraw/zinc/62/27/81/590622781.db2.gz SBEWIHUCCYOMPS-UHFFFAOYSA-N 1 2 225.723 2.057 20 0 BEADLO Cc1nn(C)cc1C[N@H+]1CCC=C(Cl)C1 ZINC000878790694 590622782 /nfs/dbraw/zinc/62/27/82/590622782.db2.gz SBEWIHUCCYOMPS-UHFFFAOYSA-N 1 2 225.723 2.057 20 0 BEADLO Fc1cccc(C[N@@H+]2CCC[C@@H]2c2cn[nH]c2)n1 ZINC000878876922 590638635 /nfs/dbraw/zinc/63/86/35/590638635.db2.gz XQIFGFOCZWVXSC-GFCCVEGCSA-N 1 2 246.289 2.281 20 0 BEADLO Fc1cccc(C[N@H+]2CCC[C@@H]2c2cn[nH]c2)n1 ZINC000878876922 590638640 /nfs/dbraw/zinc/63/86/40/590638640.db2.gz XQIFGFOCZWVXSC-GFCCVEGCSA-N 1 2 246.289 2.281 20 0 BEADLO C[N@@H+](Cc1cnc[nH]1)C[C@@H]1CCC(C)(C)CO1 ZINC000878884889 590639697 /nfs/dbraw/zinc/63/96/97/590639697.db2.gz OGURRWJKQFMVRK-LBPRGKRZSA-N 1 2 237.347 2.047 20 0 BEADLO C[N@H+](Cc1cnc[nH]1)C[C@@H]1CCC(C)(C)CO1 ZINC000878884889 590639700 /nfs/dbraw/zinc/63/97/00/590639700.db2.gz OGURRWJKQFMVRK-LBPRGKRZSA-N 1 2 237.347 2.047 20 0 BEADLO C[N@@H+](Cc1c[nH]cn1)C[C@@H]1CCC(C)(C)CO1 ZINC000878884889 590639701 /nfs/dbraw/zinc/63/97/01/590639701.db2.gz OGURRWJKQFMVRK-LBPRGKRZSA-N 1 2 237.347 2.047 20 0 BEADLO C[N@H+](Cc1c[nH]cn1)C[C@@H]1CCC(C)(C)CO1 ZINC000878884889 590639702 /nfs/dbraw/zinc/63/97/02/590639702.db2.gz OGURRWJKQFMVRK-LBPRGKRZSA-N 1 2 237.347 2.047 20 0 BEADLO O[C@@H]1CC[N@H+](CC2CC3(CCC3)C2)CC1(F)F ZINC000878915217 590650037 /nfs/dbraw/zinc/65/00/37/590650037.db2.gz QQOHJVACGPUGRZ-LLVKDONJSA-N 1 2 245.313 2.269 20 0 BEADLO O[C@@H]1CC[N@@H+](CC2CC3(CCC3)C2)CC1(F)F ZINC000878915217 590650041 /nfs/dbraw/zinc/65/00/41/590650041.db2.gz QQOHJVACGPUGRZ-LLVKDONJSA-N 1 2 245.313 2.269 20 0 BEADLO O[C@H]1CC[N@H+](CC2CC3(CCC3)C2)CC1(F)F ZINC000878915218 590650163 /nfs/dbraw/zinc/65/01/63/590650163.db2.gz QQOHJVACGPUGRZ-NSHDSACASA-N 1 2 245.313 2.269 20 0 BEADLO O[C@H]1CC[N@@H+](CC2CC3(CCC3)C2)CC1(F)F ZINC000878915218 590650167 /nfs/dbraw/zinc/65/01/67/590650167.db2.gz QQOHJVACGPUGRZ-NSHDSACASA-N 1 2 245.313 2.269 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2c[nH]nc2C)s1 ZINC000879188858 590709963 /nfs/dbraw/zinc/70/99/63/590709963.db2.gz RCNGGZAUFIYOOK-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2c[nH]nc2C)s1 ZINC000879188858 590709966 /nfs/dbraw/zinc/70/99/66/590709966.db2.gz RCNGGZAUFIYOOK-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)C[C@H]1CC2(CCC2)CO1 ZINC000879188283 590709914 /nfs/dbraw/zinc/70/99/14/590709914.db2.gz JOHZQINWMCGRNH-CYBMUJFWSA-N 1 2 249.358 2.109 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)C[C@H]1CC2(CCC2)CO1 ZINC000879188283 590709918 /nfs/dbraw/zinc/70/99/18/590709918.db2.gz JOHZQINWMCGRNH-CYBMUJFWSA-N 1 2 249.358 2.109 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)C[C@H]1CCC2(CCC2)O1 ZINC000879188637 590709931 /nfs/dbraw/zinc/70/99/31/590709931.db2.gz OPROQWCGQKUPOD-CYBMUJFWSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)C[C@H]1CCC2(CCC2)O1 ZINC000879188637 590709935 /nfs/dbraw/zinc/70/99/35/590709935.db2.gz OPROQWCGQKUPOD-CYBMUJFWSA-N 1 2 249.358 2.252 20 0 BEADLO CO[C@@H](CC(C)C)C[N@H+](C)Cc1cn[nH]c1C ZINC000879188656 590710507 /nfs/dbraw/zinc/71/05/07/590710507.db2.gz PHNQBPYJZPZSQL-ZDUSSCGKSA-N 1 2 239.363 2.211 20 0 BEADLO CO[C@@H](CC(C)C)C[N@@H+](C)Cc1cn[nH]c1C ZINC000879188656 590710510 /nfs/dbraw/zinc/71/05/10/590710510.db2.gz PHNQBPYJZPZSQL-ZDUSSCGKSA-N 1 2 239.363 2.211 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccon2)c(C)o1 ZINC000127722568 590765477 /nfs/dbraw/zinc/76/54/77/590765477.db2.gz WBPPSQXRWSCVLY-UHFFFAOYSA-N 1 2 206.245 2.174 20 0 BEADLO CCON(CC)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000879449718 590772591 /nfs/dbraw/zinc/77/25/91/590772591.db2.gz VJEDYPMZVXSPAJ-UHFFFAOYSA-N 1 2 248.286 2.140 20 0 BEADLO CCOC(=O)C[N@@H+]1CCC[C@@H]1c1cncc(C)c1 ZINC000879749194 590861298 /nfs/dbraw/zinc/86/12/98/590861298.db2.gz UIADATXTCLVZSP-CYBMUJFWSA-N 1 2 248.326 2.090 20 0 BEADLO CCOC(=O)C[N@H+]1CCC[C@@H]1c1cncc(C)c1 ZINC000879749194 590861300 /nfs/dbraw/zinc/86/13/00/590861300.db2.gz UIADATXTCLVZSP-CYBMUJFWSA-N 1 2 248.326 2.090 20 0 BEADLO Cc1cncc([C@@H]2CCC[N@@H+]2Cc2cc[nH]n2)c1 ZINC000879751111 590862784 /nfs/dbraw/zinc/86/27/84/590862784.db2.gz FJXAEMQDZBPXJB-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cncc([C@@H]2CCC[N@H+]2Cc2cc[nH]n2)c1 ZINC000879751111 590862788 /nfs/dbraw/zinc/86/27/88/590862788.db2.gz FJXAEMQDZBPXJB-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO CCON(CC)Cc1cn2cc(C)ccc2[nH+]1 ZINC000879795674 590874371 /nfs/dbraw/zinc/87/43/71/590874371.db2.gz ZDJYERSIQCVISI-UHFFFAOYSA-N 1 2 233.315 2.416 20 0 BEADLO FC(F)(F)[C@@H]1CC[N@H+](C/C=C/Cl)CCO1 ZINC000880044905 590913155 /nfs/dbraw/zinc/91/31/55/590913155.db2.gz UUYZTEJJPUFJMQ-LKVYWMSASA-N 1 2 243.656 2.392 20 0 BEADLO FC(F)(F)[C@@H]1CC[N@@H+](C/C=C/Cl)CCO1 ZINC000880044905 590913159 /nfs/dbraw/zinc/91/31/59/590913159.db2.gz UUYZTEJJPUFJMQ-LKVYWMSASA-N 1 2 243.656 2.392 20 0 BEADLO CCc1nnc(C[N@@H+]2CCC[C@H](CF)C2)s1 ZINC000880236889 590968475 /nfs/dbraw/zinc/96/84/75/590968475.db2.gz LHYXTKVINGIQFO-SECBINFHSA-N 1 2 243.351 2.282 20 0 BEADLO CCc1nnc(C[N@H+]2CCC[C@H](CF)C2)s1 ZINC000880236889 590968477 /nfs/dbraw/zinc/96/84/77/590968477.db2.gz LHYXTKVINGIQFO-SECBINFHSA-N 1 2 243.351 2.282 20 0 BEADLO CC(C)n1ncnc1C[N@@H+]1CCC[C@H](CF)C1 ZINC000880237176 590968600 /nfs/dbraw/zinc/96/86/00/590968600.db2.gz RZIGBXJDRDPIJI-LLVKDONJSA-N 1 2 240.326 2.041 20 0 BEADLO CC(C)n1ncnc1C[N@H+]1CCC[C@H](CF)C1 ZINC000880237176 590968602 /nfs/dbraw/zinc/96/86/02/590968602.db2.gz RZIGBXJDRDPIJI-LLVKDONJSA-N 1 2 240.326 2.041 20 0 BEADLO Cn1nc(C[NH+]2CCC(F)CC2)cc1Cl ZINC000880238599 590971675 /nfs/dbraw/zinc/97/16/75/590971675.db2.gz IIIWDUNAOYBPRI-UHFFFAOYSA-N 1 2 231.702 2.007 20 0 BEADLO CC(C)n1ccnc1C[NH+]1CCC(F)CC1 ZINC000880241245 590975285 /nfs/dbraw/zinc/97/52/85/590975285.db2.gz TUOQXPKKOCOTHZ-UHFFFAOYSA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1ccc(C[NH+]2CCC(F)CC2)n1 ZINC000880242081 590975468 /nfs/dbraw/zinc/97/54/68/590975468.db2.gz OKPBWIDDWMGERA-UHFFFAOYSA-N 1 2 225.311 2.398 20 0 BEADLO CCCNc1cc(N[C@@H](C)CSC)nc[nH+]1 ZINC000128319996 590978682 /nfs/dbraw/zinc/97/86/82/590978682.db2.gz MOMXWKQKCOEZPT-VIFPVBQESA-N 1 2 240.376 2.462 20 0 BEADLO CCCNc1cc(N[C@@H](C)CSC)[nH+]cn1 ZINC000128319996 590978685 /nfs/dbraw/zinc/97/86/85/590978685.db2.gz MOMXWKQKCOEZPT-VIFPVBQESA-N 1 2 240.376 2.462 20 0 BEADLO Fc1cc2c(cc1F)C[N@H+](Cc1cn[nH]c1)CC2 ZINC000880443273 591044991 /nfs/dbraw/zinc/04/49/91/591044991.db2.gz DKAVGKXUUJAOPS-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO Fc1cc2c(cc1F)C[N@@H+](Cc1cn[nH]c1)CC2 ZINC000880443273 591044995 /nfs/dbraw/zinc/04/49/95/591044995.db2.gz DKAVGKXUUJAOPS-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO OC[C@H]1C=CC[N@@H+]1Cc1ccc(Cl)cc1F ZINC000880489629 591066750 /nfs/dbraw/zinc/06/67/50/591066750.db2.gz WENGLVXGTWDPIT-LLVKDONJSA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@H]1C=CC[N@H+]1Cc1ccc(Cl)cc1F ZINC000880489629 591066755 /nfs/dbraw/zinc/06/67/55/591066755.db2.gz WENGLVXGTWDPIT-LLVKDONJSA-N 1 2 241.693 2.212 20 0 BEADLO C/C=C\C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000211315510 591156616 /nfs/dbraw/zinc/15/66/16/591156616.db2.gz QDVDIHZUCAFZRJ-DJWKRKHSSA-N 1 2 227.267 2.387 20 0 BEADLO CC1(O)CC[NH+](C/C(Cl)=C\Cl)CC1 ZINC000211400173 591164446 /nfs/dbraw/zinc/16/44/46/591164446.db2.gz JKYKDGUCDLKZQW-SOFGYWHQSA-N 1 2 224.131 2.152 20 0 BEADLO Cc1[nH]c(C(=O)NCC(C)(C)CC(F)F)c[nH+]1 ZINC000881535231 591233217 /nfs/dbraw/zinc/23/32/17/591233217.db2.gz PAICCUXSBWTFHC-UHFFFAOYSA-N 1 2 245.273 2.129 20 0 BEADLO C[C@H](CC(=O)NC[C@@]1(C)CC1(C)C)n1cc[nH+]c1 ZINC000881544648 591237229 /nfs/dbraw/zinc/23/72/29/591237229.db2.gz CUPVZHPJWDHKBS-BXUZGUMPSA-N 1 2 249.358 2.387 20 0 BEADLO C=C/C=C/CCNC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000881570943 591244877 /nfs/dbraw/zinc/24/48/77/591244877.db2.gz WVABXIVXHZXKJO-ZYOFXKKJSA-N 1 2 233.315 2.083 20 0 BEADLO Cc1[nH+]cnc(NCc2ccco2)c1C ZINC000881732368 591267686 /nfs/dbraw/zinc/26/76/86/591267686.db2.gz GAUIKSQAPXPQPS-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO Cc1[nH+]cnc(NCc2ccccn2)c1C ZINC000881735538 591267965 /nfs/dbraw/zinc/26/79/65/591267965.db2.gz LWYCVNYRIWVPRJ-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO Cc1[nH+]cnc(N2CCC[C@@H](C)C2)c1C ZINC000881733997 591268345 /nfs/dbraw/zinc/26/83/45/591268345.db2.gz CAOOJAWYUXBGHZ-SECBINFHSA-N 1 2 205.305 2.330 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H](O)c2ccccc2)c1C ZINC000881744115 591268444 /nfs/dbraw/zinc/26/84/44/591268444.db2.gz MYNXSOHKQFUMJV-CYBMUJFWSA-N 1 2 243.310 2.239 20 0 BEADLO Cc1[nH+]cnc(N2CCC(C)CC2)c1C ZINC000881740039 591268807 /nfs/dbraw/zinc/26/88/07/591268807.db2.gz GCUQLBRKNMKMNN-UHFFFAOYSA-N 1 2 205.305 2.330 20 0 BEADLO OCc1cc[nH+]c(NC[C@H]2CC2(Cl)Cl)c1 ZINC000881768799 591269368 /nfs/dbraw/zinc/26/93/68/591269368.db2.gz CEDNIOZZVQHTEH-MRVPVSSYSA-N 1 2 247.125 2.180 20 0 BEADLO Cc1[nH+]cnc(NCCOCC(F)(F)F)c1C ZINC000881788617 591270906 /nfs/dbraw/zinc/27/09/06/591270906.db2.gz CZFOQFBXRHENMC-UHFFFAOYSA-N 1 2 249.236 2.084 20 0 BEADLO Cc1[nH+]cnc(NCCc2cccnc2)c1C ZINC000881788415 591271224 /nfs/dbraw/zinc/27/12/24/591271224.db2.gz UTJBFBXVPNKZEM-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H](C)Cn2cccn2)c1C ZINC000881812631 591272328 /nfs/dbraw/zinc/27/23/28/591272328.db2.gz UYZUNLBPIJKGQT-SNVBAGLBSA-N 1 2 245.330 2.038 20 0 BEADLO Cc1cccc(CNc2nc[nH+]c(C)c2C)n1 ZINC000881828252 591273670 /nfs/dbraw/zinc/27/36/70/591273670.db2.gz YCADLSFVGBIDKZ-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2CCCCO2)c1C ZINC000881846771 591274540 /nfs/dbraw/zinc/27/45/40/591274540.db2.gz WOGDODYQEXPWAY-NSHDSACASA-N 1 2 221.304 2.074 20 0 BEADLO CC[C@@H](C)[C@@](C)(O)CNc1nc[nH+]c(C)c1C ZINC000881978071 591285090 /nfs/dbraw/zinc/28/50/90/591285090.db2.gz XNLNNJLOACZUEJ-RNCFNFMXSA-N 1 2 237.347 2.302 20 0 BEADLO CCOC[C@@H]1CCCN(c2nc[nH+]c(C)c2C)C1 ZINC000881982724 591285745 /nfs/dbraw/zinc/28/57/45/591285745.db2.gz HRXUUPAXTVGJNN-CYBMUJFWSA-N 1 2 249.358 2.346 20 0 BEADLO Cc1[nH+]cnc(NC[C@H](O)CC(C)(C)C)c1C ZINC000881993233 591286109 /nfs/dbraw/zinc/28/61/09/591286109.db2.gz PCBPMAMLNWAQET-LLVKDONJSA-N 1 2 237.347 2.302 20 0 BEADLO CSCC[C@@H](C)Nc1cc(CO)cc[nH+]1 ZINC000881996562 591286442 /nfs/dbraw/zinc/28/64/42/591286442.db2.gz WLPVZSXUFQDYHJ-SECBINFHSA-N 1 2 226.345 2.127 20 0 BEADLO Cc1ccc([C@@H](O)CNc2nc[nH+]c(C)c2C)o1 ZINC000882011297 591287698 /nfs/dbraw/zinc/28/76/98/591287698.db2.gz ZTEKHCNOYQHINL-NSHDSACASA-N 1 2 247.298 2.140 20 0 BEADLO Cc1[nH+]cnc(NC[C@](C)(O)c2ccco2)c1C ZINC000882019128 591288024 /nfs/dbraw/zinc/28/80/24/591288024.db2.gz KAWUNZWRQBFUSU-ZDUSSCGKSA-N 1 2 247.298 2.006 20 0 BEADLO Cc1[nH+]cnc(NCCOC2CCC2)c1C ZINC000882030342 591289498 /nfs/dbraw/zinc/28/94/98/591289498.db2.gz SIAZCIANPSBGME-UHFFFAOYSA-N 1 2 221.304 2.074 20 0 BEADLO CO[C@@H](CNc1nc[nH+]c(C)c1C)C(C)C ZINC000882040763 591291837 /nfs/dbraw/zinc/29/18/37/591291837.db2.gz WQJAGHPXTSBITP-NSHDSACASA-N 1 2 223.320 2.176 20 0 BEADLO Cc1[nH+]cnc(NC[C@]2(C)CCCC[C@H]2O)c1C ZINC000882052323 591292345 /nfs/dbraw/zinc/29/23/45/591292345.db2.gz CDDYAVVXTDUALH-OCCSQVGLSA-N 1 2 249.358 2.447 20 0 BEADLO CC[C@@H]1CCN(c2nc[nH+]c(C)c2C)C1 ZINC000882078576 591294652 /nfs/dbraw/zinc/29/46/52/591294652.db2.gz XRYZYBCYANBMKM-LLVKDONJSA-N 1 2 205.305 2.330 20 0 BEADLO C[C@H]1CSC(SCc2cn(C)c[nH+]2)=N1 ZINC000882149610 591306307 /nfs/dbraw/zinc/30/63/07/591306307.db2.gz GQBMRKMBDUFEFZ-ZETCQYMHSA-N 1 2 227.358 2.145 20 0 BEADLO CCOC(C)(C)CNc1nc[nH+]c(C)c1C ZINC000882233112 591318586 /nfs/dbraw/zinc/31/85/86/591318586.db2.gz WPFGLQCHKVHTDQ-UHFFFAOYSA-N 1 2 223.320 2.320 20 0 BEADLO Cc1[nH+]cnc(NC[C@@]2(O)CCCC2(C)C)c1C ZINC000882400010 591342954 /nfs/dbraw/zinc/34/29/54/591342954.db2.gz BJRLTNYQHHSRRM-AWEZNQCLSA-N 1 2 249.358 2.447 20 0 BEADLO Cc1ncnc(N[C@@H]2C[C@H](C)n3cc[nH+]c32)c1C ZINC000882426682 591346498 /nfs/dbraw/zinc/34/64/98/591346498.db2.gz PFUMMVSKLSUQOV-GZMMTYOYSA-N 1 2 243.314 2.408 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2CCS[C@@H]2C)c1C ZINC000882519383 591381571 /nfs/dbraw/zinc/38/15/71/591381571.db2.gz VVQHCWMKAIVIKZ-NXEZZACHSA-N 1 2 223.345 2.399 20 0 BEADLO Cc1[nH+]cnc(NCCc2ccoc2)c1C ZINC000882619579 591400273 /nfs/dbraw/zinc/40/02/73/591400273.db2.gz PNFXRGBLMLUZKZ-UHFFFAOYSA-N 1 2 217.272 2.341 20 0 BEADLO Cc1ncnc(NCC(C)(C)n2cc[nH+]c2)c1C ZINC000882626269 591402803 /nfs/dbraw/zinc/40/28/03/591402803.db2.gz WXLKIIFRPVNJGV-UHFFFAOYSA-N 1 2 245.330 2.137 20 0 BEADLO CCO[C@@]1(C)C[C@H]1Nc1nc[nH+]c(C)c1C ZINC000882653042 591406790 /nfs/dbraw/zinc/40/67/90/591406790.db2.gz UBWBLHUNOBHEJQ-PWSUYJOCSA-N 1 2 221.304 2.073 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2CO[C@@H](C3CC3)C2)c1C ZINC000882662912 591407986 /nfs/dbraw/zinc/40/79/86/591407986.db2.gz HERWBTOBRMRZSI-VXGBXAGGSA-N 1 2 233.315 2.073 20 0 BEADLO COC(C)(C)CCNc1nc[nH+]c(C)c1C ZINC000882690917 591412605 /nfs/dbraw/zinc/41/26/05/591412605.db2.gz BGSKDDZCBXLXPM-UHFFFAOYSA-N 1 2 223.320 2.320 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@@H]2CSC[C@H]2C1 ZINC000882697400 591413921 /nfs/dbraw/zinc/41/39/21/591413921.db2.gz FLOPJDIBSMWDOA-NXEZZACHSA-N 1 2 238.331 2.410 20 0 BEADLO Cc1[nH+]cnc(NCC[C@@H](O)C2CCCC2)c1C ZINC000882708200 591415776 /nfs/dbraw/zinc/41/57/76/591415776.db2.gz VSYWQFXRCLBJPJ-CYBMUJFWSA-N 1 2 249.358 2.447 20 0 BEADLO Cc1[nH+]cnc(N2CCC[C@H](C(C)(C)O)C2)c1C ZINC000882714867 591418609 /nfs/dbraw/zinc/41/86/09/591418609.db2.gz ZXBZNYYOYWMADM-LBPRGKRZSA-N 1 2 249.358 2.081 20 0 BEADLO Cc1[nH+]cnc(NC[C@H]2CC(C)(C)CO2)c1C ZINC000882715187 591420021 /nfs/dbraw/zinc/42/00/21/591420021.db2.gz OYINUZVDFSHQLJ-LLVKDONJSA-N 1 2 235.331 2.320 20 0 BEADLO CO[C@H]1C[C@H](CNc2cc[nH+]c(C3CC3)n2)C1 ZINC000882798334 591442908 /nfs/dbraw/zinc/44/29/08/591442908.db2.gz FXHQVPAVDPRZND-HOMQSWHASA-N 1 2 233.315 2.191 20 0 BEADLO FC[C@H]1CCCN(c2cc[nH+]cc2F)C1 ZINC000882803675 591444639 /nfs/dbraw/zinc/44/46/39/591444639.db2.gz AKLZSLLNXOFWHS-SECBINFHSA-N 1 2 212.243 2.407 20 0 BEADLO Cc1nc(N2CCC(F)CC2)c(C)c(C)[nH+]1 ZINC000882806444 591446356 /nfs/dbraw/zinc/44/63/56/591446356.db2.gz AKDOJGWKRYGQIN-UHFFFAOYSA-N 1 2 223.295 2.340 20 0 BEADLO CCC(=O)N[C@@H](Cn1cc[nH+]c1)c1ccccc1 ZINC000882837358 591450449 /nfs/dbraw/zinc/45/04/49/591450449.db2.gz FNXQLJNJXCZEQA-ZDUSSCGKSA-N 1 2 243.310 2.151 20 0 BEADLO FC[C@H]1CCN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000882841741 591452385 /nfs/dbraw/zinc/45/23/85/591452385.db2.gz DKZMWJNWRARPCI-SECBINFHSA-N 1 2 221.279 2.150 20 0 BEADLO Cc1cc(N2CC[C@@H](CF)C2)nc(C2CC2)[nH+]1 ZINC000882841617 591452596 /nfs/dbraw/zinc/45/25/96/591452596.db2.gz ANQYGRITWABRRX-JTQLQIEISA-N 1 2 235.306 2.458 20 0 BEADLO CO[C@@]1(C(F)(F)F)CCN(c2cccc[nH+]2)C1 ZINC000882847212 591454687 /nfs/dbraw/zinc/45/46/87/591454687.db2.gz DOIWAFGBUUKNPK-JTQLQIEISA-N 1 2 246.232 2.239 20 0 BEADLO Cc1cc(CNCc2[nH]cc(C(C)C)[nH+]2)no1 ZINC000882920321 591474367 /nfs/dbraw/zinc/47/43/67/591474367.db2.gz GLMDZWPEPQTNGC-UHFFFAOYSA-N 1 2 234.303 2.119 20 0 BEADLO OCc1cc[nH+]c(NC[C@@H]2CCC3(CCC3)O2)c1 ZINC000882972702 591489105 /nfs/dbraw/zinc/48/91/05/591489105.db2.gz VFWDUJVXVWGTPG-LBPRGKRZSA-N 1 2 248.326 2.088 20 0 BEADLO Cc1nc(NC2CCC3(COC3)CC2)cc[nH+]1 ZINC000882995395 591498624 /nfs/dbraw/zinc/49/86/24/591498624.db2.gz WEYZPGGUECEOFR-UHFFFAOYSA-N 1 2 233.315 2.156 20 0 BEADLO Cc1[nH+]cnc(NC2CCC3(COC3)CC2)c1C ZINC000882994726 591499119 /nfs/dbraw/zinc/49/91/19/591499119.db2.gz QHRCWEWPNRJCHI-UHFFFAOYSA-N 1 2 247.342 2.465 20 0 BEADLO CCc1cc(C[NH2+]Cc2nc(C(C)C)c[nH]2)on1 ZINC000883016768 591515294 /nfs/dbraw/zinc/51/52/94/591515294.db2.gz LMVCOODNEKAXCZ-UHFFFAOYSA-N 1 2 248.330 2.373 20 0 BEADLO C=C/C=C/CCO[NH+]=C(N)COC1CCC1 ZINC000883040402 591525245 /nfs/dbraw/zinc/52/52/45/591525245.db2.gz AOSIMVCQPDAKDR-ONEGZZNKSA-N 1 2 224.304 2.186 20 0 BEADLO CC(C)c1c[nH]c(C[NH2+]Cc2ccc(F)cn2)n1 ZINC000883047476 591527648 /nfs/dbraw/zinc/52/76/48/591527648.db2.gz RETZHMCCFLTOOO-UHFFFAOYSA-N 1 2 248.305 2.357 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OC1CCC1 ZINC000883058895 591531789 /nfs/dbraw/zinc/53/17/89/591531789.db2.gz FFWQVMQOHZUAOQ-UHFFFAOYSA-N 1 2 204.273 2.394 20 0 BEADLO CC(C)c1c[nH]c(CNCc2ncccc2F)[nH+]1 ZINC000883073830 591535809 /nfs/dbraw/zinc/53/58/09/591535809.db2.gz CHKGCCPMBASHJV-UHFFFAOYSA-N 1 2 248.305 2.357 20 0 BEADLO Cc1cc(N[C@@H]2CCO[C@H]2C)c[nH+]c1C ZINC000883341249 591620180 /nfs/dbraw/zinc/62/01/80/591620180.db2.gz LGHDVWIHLSHIMD-CMPLNLGQSA-N 1 2 206.289 2.288 20 0 BEADLO Cc1cc(CNc2c[nH+]c(C)c(C)c2)n(C)n1 ZINC000883341581 591620289 /nfs/dbraw/zinc/62/02/89/591620289.db2.gz UNACURVZEYUMSU-UHFFFAOYSA-N 1 2 230.315 2.352 20 0 BEADLO COc1ncncc1CNc1c[nH+]c(C)c(C)c1 ZINC000883341170 591620322 /nfs/dbraw/zinc/62/03/22/591620322.db2.gz JSKPMEQVRNGLIF-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO Cc1cc(NCc2cocn2)c[nH+]c1C ZINC000883341547 591620628 /nfs/dbraw/zinc/62/06/28/591620628.db2.gz SVXKZKLJXYVINR-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO COC[C@H](Cc1ccccc1)[NH2+][C@@H](C)C(F)F ZINC000883399243 591646593 /nfs/dbraw/zinc/64/65/93/591646593.db2.gz IERMEPZYMZKMTC-JQWIXIFHSA-N 1 2 243.297 2.487 20 0 BEADLO Cc1nc(F)ccc1C[NH2+][C@@H](C)C(F)F ZINC000883407078 591650914 /nfs/dbraw/zinc/65/09/14/591650914.db2.gz KHSQXUKRVXXIBK-ZETCQYMHSA-N 1 2 218.222 2.272 20 0 BEADLO C[C@H]([NH2+]Cc1ccc2oc(=O)oc2c1)C(F)F ZINC000883407720 591651262 /nfs/dbraw/zinc/65/12/62/591651262.db2.gz DBVRVMKEARIZHC-LURJTMIESA-N 1 2 243.209 2.129 20 0 BEADLO C[C@H]1CCN(C(=O)N2CCC[C@@H]2c2[nH]cc[nH+]2)C1 ZINC000800105978 591824019 /nfs/dbraw/zinc/82/40/19/591824019.db2.gz ZDZZGHJIPOEFJA-WDEREUQCSA-N 1 2 248.330 2.008 20 0 BEADLO C[C@@H]1CCN(C(=O)N2CCC[C@@H]2c2[nH]cc[nH+]2)C1 ZINC000800105965 591824040 /nfs/dbraw/zinc/82/40/40/591824040.db2.gz ZDZZGHJIPOEFJA-GHMZBOCLSA-N 1 2 248.330 2.008 20 0 BEADLO COc1ccc([NH2+][C@H](C)C2CC2)cc1CO ZINC000134496507 591931729 /nfs/dbraw/zinc/93/17/29/591931729.db2.gz UIVKUQSSQOTWNR-SECBINFHSA-N 1 2 221.300 2.398 20 0 BEADLO CCc1nc(N[C@H]2[C@@H]3CCC[C@@H]32)cc[nH+]1 ZINC000884488968 591955335 /nfs/dbraw/zinc/95/53/35/591955335.db2.gz LKIIQJGQURKFAP-GDGBQDQQSA-N 1 2 203.289 2.249 20 0 BEADLO CCc1nc(N2CCC[C@@](C)(OC)CC2)cc[nH+]1 ZINC000884494427 591955697 /nfs/dbraw/zinc/95/56/97/591955697.db2.gz SOFVHPXIWGIOHO-CQSZACIVSA-N 1 2 249.358 2.434 20 0 BEADLO CCc1nc(N2CCC[C@](C)(OC)C2)cc[nH+]1 ZINC000884492238 591956286 /nfs/dbraw/zinc/95/62/86/591956286.db2.gz PUHZOTJFHJYPRN-ZDUSSCGKSA-N 1 2 235.331 2.044 20 0 BEADLO CCc1nc(N2CCCCC[C@@H]2CCO)cc[nH+]1 ZINC000884500145 591958197 /nfs/dbraw/zinc/95/81/97/591958197.db2.gz YAOKCEVMBCODNZ-GFCCVEGCSA-N 1 2 249.358 2.170 20 0 BEADLO CCc1nc(N2CCC[C@H]3C[C@H]32)cc[nH+]1 ZINC000884504249 591958757 /nfs/dbraw/zinc/95/87/57/591958757.db2.gz DRZJXMDANYWNGY-VHSXEESVSA-N 1 2 203.289 2.028 20 0 BEADLO CCc1nc(NC[C@@]2(O)CCC[C@@H]2C)cc[nH+]1 ZINC000884516179 591962795 /nfs/dbraw/zinc/96/27/95/591962795.db2.gz DPRSKHMAOMKWNC-GWCFXTLKSA-N 1 2 235.331 2.002 20 0 BEADLO Cc1cnc(NCCc2[nH+]cccc2C)o1 ZINC000884520673 591963745 /nfs/dbraw/zinc/96/37/45/591963745.db2.gz BSADECZMUXUNIL-UHFFFAOYSA-N 1 2 217.272 2.341 20 0 BEADLO CCc1nc(NCc2ccnc(C)c2)cc[nH+]1 ZINC000884518568 591964356 /nfs/dbraw/zinc/96/43/56/591964356.db2.gz SYJVPIFFDMKZPH-UHFFFAOYSA-N 1 2 228.299 2.355 20 0 BEADLO CCc1nc(N[C@H](C)c2cnccn2)cc[nH+]1 ZINC000884520579 591964741 /nfs/dbraw/zinc/96/47/41/591964741.db2.gz ZHYAUNMPSYGHNS-SECBINFHSA-N 1 2 229.287 2.002 20 0 BEADLO CCc1nc(NCCC[C@H]2CCOC2)cc[nH+]1 ZINC000884523808 591965365 /nfs/dbraw/zinc/96/53/65/591965365.db2.gz GPXQGLXQLNNVAF-NSHDSACASA-N 1 2 235.331 2.268 20 0 BEADLO CCc1nc(N2CC[C@H](O)CC(C)(C)C2)cc[nH+]1 ZINC000884523241 591965566 /nfs/dbraw/zinc/96/55/66/591965566.db2.gz SFHCSXAENMHJMN-NSHDSACASA-N 1 2 249.358 2.026 20 0 BEADLO CCc1nc(N[C@@H]2C[C@H]3C[C@H]3C2)cc[nH+]1 ZINC000884536825 591970473 /nfs/dbraw/zinc/97/04/73/591970473.db2.gz KCGQOAHINJZDPR-ILWJIGKKSA-N 1 2 203.289 2.249 20 0 BEADLO CCc1nc(N(CC)CCSC)cc[nH+]1 ZINC000884543323 591973213 /nfs/dbraw/zinc/97/32/13/591973213.db2.gz BAAWMNROZUKWGB-UHFFFAOYSA-N 1 2 225.361 2.228 20 0 BEADLO CCC[C@H](C)[C@H](CO)Nc1cc[nH+]c(CC)n1 ZINC000884544771 591973512 /nfs/dbraw/zinc/97/35/12/591973512.db2.gz PCBZIWUKONSHQL-QWRGUYRKSA-N 1 2 237.347 2.248 20 0 BEADLO CCc1nc(NC2(COC)CCCC2)cc[nH+]1 ZINC000884552041 591976080 /nfs/dbraw/zinc/97/60/80/591976080.db2.gz PMFVMKQDNAIUDY-UHFFFAOYSA-N 1 2 235.331 2.410 20 0 BEADLO CCc1nc(N[C@@H](C)Cc2ccccn2)cc[nH+]1 ZINC000884548394 591976129 /nfs/dbraw/zinc/97/61/29/591976129.db2.gz JVHFRSBHJZIMNE-NSHDSACASA-N 1 2 242.326 2.477 20 0 BEADLO CCc1nc(N[C@H]2CO[C@@H](C3CC3)C2)cc[nH+]1 ZINC000884566134 591982139 /nfs/dbraw/zinc/98/21/39/591982139.db2.gz CIHZOCVXBRCRDM-GHMZBOCLSA-N 1 2 233.315 2.018 20 0 BEADLO CCc1nc(N2CCC(C)(F)CC2)cc[nH+]1 ZINC000884571861 591984275 /nfs/dbraw/zinc/98/42/75/591984275.db2.gz ZXUOTZJVOATXRR-UHFFFAOYSA-N 1 2 223.295 2.367 20 0 BEADLO CCc1nc(NCC[C@@H](O)C2CCCC2)cc[nH+]1 ZINC000884575151 591985304 /nfs/dbraw/zinc/98/53/04/591985304.db2.gz CTIWEEDWQMTHBH-GFCCVEGCSA-N 1 2 249.358 2.392 20 0 BEADLO CCc1nc(N[C@@H](C)C(F)F)cc[nH+]1 ZINC000884583375 591987740 /nfs/dbraw/zinc/98/77/40/591987740.db2.gz BIHTYDWVDHUVLP-LURJTMIESA-N 1 2 201.220 2.105 20 0 BEADLO c1ccc(NC[C@@H]2CC3(CCC3)CO2)[nH+]c1 ZINC000884663835 592007536 /nfs/dbraw/zinc/00/75/36/592007536.db2.gz WMSNFSRQMUHIGN-NSHDSACASA-N 1 2 218.300 2.453 20 0 BEADLO Cc1nc(NC[C@H]2CC3(CCC3)CO2)cc[nH+]1 ZINC000884663554 592007845 /nfs/dbraw/zinc/00/78/45/592007845.db2.gz POZLAWKNPMYMRN-LLVKDONJSA-N 1 2 233.315 2.156 20 0 BEADLO CCc1nc(NCC[C@H]2CCCO2)cc[nH+]1 ZINC000884677174 592010111 /nfs/dbraw/zinc/01/01/11/592010111.db2.gz KIQVIJLLEFTRBM-SNVBAGLBSA-N 1 2 221.304 2.020 20 0 BEADLO c1cnc([C@@H]2CCCN(c3cccc[nH+]3)C2)nc1 ZINC000884708821 592013256 /nfs/dbraw/zinc/01/32/56/592013256.db2.gz MECLMZSTIIUXKL-GFCCVEGCSA-N 1 2 240.310 2.256 20 0 BEADLO COc1ccc[nH+]c1N1CC[C@H]([C@@H]2CCCO2)C1 ZINC000884742669 592016220 /nfs/dbraw/zinc/01/62/20/592016220.db2.gz UMSQYHNGJXZAAO-RYUDHWBXSA-N 1 2 248.326 2.096 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@H]([C@H]2CCCO2)C1 ZINC000884743422 592016514 /nfs/dbraw/zinc/01/65/14/592016514.db2.gz YJMAHUZLBIJASC-GXFFZTMASA-N 1 2 236.290 2.226 20 0 BEADLO Cc1nc2[nH]ccc2c(N(C)CCCF)[nH+]1 ZINC000884856997 592024796 /nfs/dbraw/zinc/02/47/96/592024796.db2.gz NRHCIIPFLLIKFV-UHFFFAOYSA-N 1 2 222.267 2.062 20 0 BEADLO C[C@H]1OCC[N@H+](CCSC(F)(F)F)[C@H]1C ZINC000886041164 592139001 /nfs/dbraw/zinc/13/90/01/592139001.db2.gz KWEBMDRVEGAUDZ-JGVFFNPUSA-N 1 2 243.294 2.349 20 0 BEADLO C[C@H]1OCC[N@@H+](CCSC(F)(F)F)[C@H]1C ZINC000886041164 592139004 /nfs/dbraw/zinc/13/90/04/592139004.db2.gz KWEBMDRVEGAUDZ-JGVFFNPUSA-N 1 2 243.294 2.349 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)C[C@@H]1CCC2(CCC2)CO1 ZINC000886008528 592130306 /nfs/dbraw/zinc/13/03/06/592130306.db2.gz OPOBXJUWCTVSAX-ZDUSSCGKSA-N 1 2 249.358 2.191 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)C[C@@H]1CCC2(CCC2)CO1 ZINC000886008528 592130308 /nfs/dbraw/zinc/13/03/08/592130308.db2.gz OPOBXJUWCTVSAX-ZDUSSCGKSA-N 1 2 249.358 2.191 20 0 BEADLO Cc1n[nH]c(CNc2ccc(N(C)C)[nH+]c2)c1C ZINC000886020568 592134145 /nfs/dbraw/zinc/13/41/45/592134145.db2.gz CUQUBCUINPODNH-UHFFFAOYSA-N 1 2 245.330 2.100 20 0 BEADLO Cc1[nH]nc(CNc2ccc(N(C)C)[nH+]c2)c1C ZINC000886020568 592134147 /nfs/dbraw/zinc/13/41/47/592134147.db2.gz CUQUBCUINPODNH-UHFFFAOYSA-N 1 2 245.330 2.100 20 0 BEADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1[nH]nc(C)c1C ZINC000886134428 592160915 /nfs/dbraw/zinc/16/09/15/592160915.db2.gz RSBCPSISGUTGTD-LLVKDONJSA-N 1 2 247.346 2.094 20 0 BEADLO Cc1coc(CNc2cc(CO)cc[nH+]2)c1 ZINC000886149570 592163871 /nfs/dbraw/zinc/16/38/71/592163871.db2.gz RPDURXRVSMZOGL-UHFFFAOYSA-N 1 2 218.256 2.087 20 0 BEADLO c1cnc2c(c1)C[N@@H+](C[C@H]1CC[C@H](C3CC3)O1)C2 ZINC000886186215 592172686 /nfs/dbraw/zinc/17/26/86/592172686.db2.gz SCYRIOGXHXLMQY-UKRRQHHQSA-N 1 2 244.338 2.355 20 0 BEADLO c1cnc2c(c1)C[N@H+](C[C@H]1CC[C@H](C3CC3)O1)C2 ZINC000886186215 592172687 /nfs/dbraw/zinc/17/26/87/592172687.db2.gz SCYRIOGXHXLMQY-UKRRQHHQSA-N 1 2 244.338 2.355 20 0 BEADLO Cc1ccncc1C[NH2+][C@H](C)c1ncco1 ZINC000886272402 592193194 /nfs/dbraw/zinc/19/31/94/592193194.db2.gz ORNQKHMKTOFTHX-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2ncco2)cn1 ZINC000886274614 592194940 /nfs/dbraw/zinc/19/49/40/592194940.db2.gz XMRCEFSJNJHKGL-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO C[C@H]([NH2+]Cc1cccc(O)c1)c1ncco1 ZINC000886275792 592195689 /nfs/dbraw/zinc/19/56/89/592195689.db2.gz MGPJHNSRYIHBGH-VIFPVBQESA-N 1 2 218.256 2.231 20 0 BEADLO COc1ccc(C[NH2+][C@H](C)c2ncco2)cc1O ZINC000886275525 592195725 /nfs/dbraw/zinc/19/57/25/592195725.db2.gz CCDKXSGWFNMBJN-SECBINFHSA-N 1 2 248.282 2.240 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CC2(CCCC2)OC[C@H]1C ZINC000886283587 592200546 /nfs/dbraw/zinc/20/05/46/592200546.db2.gz AROMRDOXEQVAES-GFCCVEGCSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CC2(CCCC2)OC[C@H]1C ZINC000886283587 592200547 /nfs/dbraw/zinc/20/05/47/592200547.db2.gz AROMRDOXEQVAES-GFCCVEGCSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CC2(CCCC2)OC[C@H]1C ZINC000886283587 592200548 /nfs/dbraw/zinc/20/05/48/592200548.db2.gz AROMRDOXEQVAES-GFCCVEGCSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CC2(CCCC2)OC[C@H]1C ZINC000886283587 592200549 /nfs/dbraw/zinc/20/05/49/592200549.db2.gz AROMRDOXEQVAES-GFCCVEGCSA-N 1 2 249.358 2.252 20 0 BEADLO c1ccc(-c2nc(C[N@@H+]3C[C@@H]4C[C@@H]4C3)no2)cc1 ZINC000886328802 592210320 /nfs/dbraw/zinc/21/03/20/592210320.db2.gz QYMRTTWOKOTBAK-TXEJJXNPSA-N 1 2 241.294 2.188 20 0 BEADLO c1ccc(-c2nc(C[N@H+]3C[C@@H]4C[C@@H]4C3)no2)cc1 ZINC000886328802 592210322 /nfs/dbraw/zinc/21/03/22/592210322.db2.gz QYMRTTWOKOTBAK-TXEJJXNPSA-N 1 2 241.294 2.188 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cccnc1)c1ncco1 ZINC000886530013 592247537 /nfs/dbraw/zinc/24/75/37/592247537.db2.gz BJIWYNQLUIFOPL-VHSXEESVSA-N 1 2 217.272 2.481 20 0 BEADLO Cc1cccc(C[NH2+][C@H](C)c2ncco2)n1 ZINC000886532535 592249123 /nfs/dbraw/zinc/24/91/23/592249123.db2.gz KUZSDCGCNHUHAP-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO C[C@H]([NH2+]CCC(F)(F)F)c1ncco1 ZINC000886532043 592249463 /nfs/dbraw/zinc/24/94/63/592249463.db2.gz CEEKIZRSJDKUDS-LURJTMIESA-N 1 2 208.183 2.278 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ncco1)c1ccccn1 ZINC000886536230 592250728 /nfs/dbraw/zinc/25/07/28/592250728.db2.gz DHJYFWDNCOCPLL-ZJUUUORDSA-N 1 2 217.272 2.481 20 0 BEADLO COC(=O)[C@@H]1CC[C@H](Nc2ccc[nH+]c2C)C1 ZINC000886578440 592266949 /nfs/dbraw/zinc/26/69/49/592266949.db2.gz XDHVJTNBDIBBIV-MNOVXSKESA-N 1 2 234.299 2.144 20 0 BEADLO COC(=O)[C@@H]1CC[C@H](Nc2ccc(C)[nH+]c2C)C1 ZINC000886578406 592267265 /nfs/dbraw/zinc/26/72/65/592267265.db2.gz VBBBYJVUJQVDBS-NEPJUHHUSA-N 1 2 248.326 2.452 20 0 BEADLO COC(=O)[C@@H]1CC[C@@H](Nc2ccc[nH+]c2C)C1 ZINC000886578439 592267576 /nfs/dbraw/zinc/26/75/76/592267576.db2.gz XDHVJTNBDIBBIV-GHMZBOCLSA-N 1 2 234.299 2.144 20 0 BEADLO CC/C(C)=C/C(=O)N1CCc2c([nH+]cn2CC)C1 ZINC000886611421 592274196 /nfs/dbraw/zinc/27/41/96/592274196.db2.gz BHZSJGKIYSBPIV-DHZHZOJOSA-N 1 2 247.342 2.144 20 0 BEADLO CCC[C@@H](C)C(=O)N1CCc2c([nH+]cn2CC)C1 ZINC000886621491 592277134 /nfs/dbraw/zinc/27/71/34/592277134.db2.gz QXUYEITUVPNDAS-LLVKDONJSA-N 1 2 249.358 2.224 20 0 BEADLO CCn1c[nH+]c2c1CCN(C(=O)CC(C)(C)C)C2 ZINC000886625836 592281568 /nfs/dbraw/zinc/28/15/68/592281568.db2.gz BPXALVZOSYVGFO-UHFFFAOYSA-N 1 2 249.358 2.224 20 0 BEADLO C[C@@H](NCc1cc(C2CC2)no1)c1[nH]cc[nH+]1 ZINC000886684839 592302932 /nfs/dbraw/zinc/30/29/32/592302932.db2.gz UFRWDDNYLYGPJY-MRVPVSSYSA-N 1 2 232.287 2.126 20 0 BEADLO C[C@@H]([NH2+]Cc1cc(C2CC2)no1)c1ncc[nH]1 ZINC000886684839 592302936 /nfs/dbraw/zinc/30/29/36/592302936.db2.gz UFRWDDNYLYGPJY-MRVPVSSYSA-N 1 2 232.287 2.126 20 0 BEADLO CC[NH2+][C@@H](Cc1cc2ccccc2o1)C(=O)OC ZINC000886938122 592398726 /nfs/dbraw/zinc/39/87/26/592398726.db2.gz FMHAMJNLHRKHES-LBPRGKRZSA-N 1 2 247.294 2.126 20 0 BEADLO CC(C)(O)CC[N@H+](CC(F)F)C1CCC1 ZINC000887100520 592441682 /nfs/dbraw/zinc/44/16/82/592441682.db2.gz FDYVPXAYVLDDBP-UHFFFAOYSA-N 1 2 221.291 2.267 20 0 BEADLO CC(C)(O)CC[N@@H+](CC(F)F)C1CCC1 ZINC000887100520 592441685 /nfs/dbraw/zinc/44/16/85/592441685.db2.gz FDYVPXAYVLDDBP-UHFFFAOYSA-N 1 2 221.291 2.267 20 0 BEADLO COC(=O)CCC[N@H+](CC(F)F)C1CCC1 ZINC000887099214 592441981 /nfs/dbraw/zinc/44/19/81/592441981.db2.gz VRHQLGILCCTMIQ-UHFFFAOYSA-N 1 2 235.274 2.059 20 0 BEADLO COC(=O)CCC[N@@H+](CC(F)F)C1CCC1 ZINC000887099214 592441983 /nfs/dbraw/zinc/44/19/83/592441983.db2.gz VRHQLGILCCTMIQ-UHFFFAOYSA-N 1 2 235.274 2.059 20 0 BEADLO FC(F)C[N@H+](CCc1cn[nH]c1)C1CCC1 ZINC000887102199 592442703 /nfs/dbraw/zinc/44/27/03/592442703.db2.gz HAUFGWSBCVHRLN-UHFFFAOYSA-N 1 2 229.274 2.072 20 0 BEADLO FC(F)C[N@@H+](CCc1cn[nH]c1)C1CCC1 ZINC000887102199 592442705 /nfs/dbraw/zinc/44/27/05/592442705.db2.gz HAUFGWSBCVHRLN-UHFFFAOYSA-N 1 2 229.274 2.072 20 0 BEADLO CCCCc1nc(C[N@H+](C)CCCF)no1 ZINC000887137556 592451855 /nfs/dbraw/zinc/45/18/55/592451855.db2.gz LWJGMBXBZROCDD-UHFFFAOYSA-N 1 2 229.299 2.204 20 0 BEADLO CCCCc1nc(C[N@@H+](C)CCCF)no1 ZINC000887137556 592451857 /nfs/dbraw/zinc/45/18/57/592451857.db2.gz LWJGMBXBZROCDD-UHFFFAOYSA-N 1 2 229.299 2.204 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NCC(C)(C)C1CC1 ZINC000887371681 592495092 /nfs/dbraw/zinc/49/50/92/592495092.db2.gz BKKFGOZRIXDWAT-JTQLQIEISA-N 1 2 249.358 2.141 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NCC(C)(C)C1CC1 ZINC000887371681 592495095 /nfs/dbraw/zinc/49/50/95/592495095.db2.gz BKKFGOZRIXDWAT-JTQLQIEISA-N 1 2 249.358 2.141 20 0 BEADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1ccn(C)n1 ZINC000336727920 592520347 /nfs/dbraw/zinc/52/03/47/592520347.db2.gz MNIVWUKEQSIRHB-CQSZACIVSA-N 1 2 244.342 2.398 20 0 BEADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ccn(C)n1 ZINC000336727920 592520351 /nfs/dbraw/zinc/52/03/51/592520351.db2.gz MNIVWUKEQSIRHB-CQSZACIVSA-N 1 2 244.342 2.398 20 0 BEADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1ccn(C)n1 ZINC000336727919 592520608 /nfs/dbraw/zinc/52/06/08/592520608.db2.gz MNIVWUKEQSIRHB-AWEZNQCLSA-N 1 2 244.342 2.398 20 0 BEADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ccn(C)n1 ZINC000336727919 592520611 /nfs/dbraw/zinc/52/06/11/592520611.db2.gz MNIVWUKEQSIRHB-AWEZNQCLSA-N 1 2 244.342 2.398 20 0 BEADLO C[C@@H]1CN(C(=O)Nc2ccc3[nH+]ccn3c2)[C@H]1C ZINC000887801675 592553328 /nfs/dbraw/zinc/55/33/28/592553328.db2.gz QJRHDSZUIHBQCL-ZJUUUORDSA-N 1 2 244.298 2.206 20 0 BEADLO Cc1cc(NC(=O)NC2CCC=CCC2)cc[nH+]1 ZINC000887934244 592561099 /nfs/dbraw/zinc/56/10/99/592561099.db2.gz RWKUBAJDMPFKLD-UHFFFAOYSA-N 1 2 245.326 2.432 20 0 BEADLO C[C@H]1CN(C(=O)Nc2ccn3cc[nH+]c3c2)[C@H]1C ZINC000888071603 592574352 /nfs/dbraw/zinc/57/43/52/592574352.db2.gz SDJVFCZPYPSXIW-UWVGGRQHSA-N 1 2 244.298 2.206 20 0 BEADLO C[C@@H]1[C@@H](C)CN1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000888071604 592574888 /nfs/dbraw/zinc/57/48/88/592574888.db2.gz SDJVFCZPYPSXIW-VHSXEESVSA-N 1 2 244.298 2.206 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2C[C@@H](C)CO2)c(C)[nH+]1 ZINC000889464238 592613310 /nfs/dbraw/zinc/61/33/10/592613310.db2.gz DOLNZBBBLFIGQO-PRHODGIISA-N 1 2 234.299 2.062 20 0 BEADLO CCCCC1(NC(=O)Cc2[nH]c[nH+]c2C)CC1 ZINC000889528331 592618183 /nfs/dbraw/zinc/61/81/83/592618183.db2.gz GOGRTICBQPTLID-UHFFFAOYSA-N 1 2 235.331 2.100 20 0 BEADLO CCCCC1(NC(=O)Cc2[nH+]c[nH]c2C)CC1 ZINC000889528331 592618186 /nfs/dbraw/zinc/61/81/86/592618186.db2.gz GOGRTICBQPTLID-UHFFFAOYSA-N 1 2 235.331 2.100 20 0 BEADLO CCCCC1(NC(=O)c2c[nH+]c(C)[nH]2)CC1 ZINC000889530857 592618453 /nfs/dbraw/zinc/61/84/53/592618453.db2.gz DDQYCPWOGXFXCJ-UHFFFAOYSA-N 1 2 221.304 2.171 20 0 BEADLO C[C@H](CC(=O)N[C@@H]1C[C@H]2CCC[C@H]21)n1cc[nH+]c1 ZINC000889613347 592629804 /nfs/dbraw/zinc/62/98/04/592629804.db2.gz YSXCZWGAVKISDX-FDYHWXHSSA-N 1 2 247.342 2.139 20 0 BEADLO Cc1cc(C)c(C(=O)NCc2cn(C)c[nH+]2)s1 ZINC000890103930 592680327 /nfs/dbraw/zinc/68/03/27/592680327.db2.gz RODHYQHXIPOIAB-UHFFFAOYSA-N 1 2 249.339 2.028 20 0 BEADLO CC[C@H](CC(C)C)C(=O)NCc1cn(C)c[nH+]1 ZINC000890104694 592681886 /nfs/dbraw/zinc/68/18/86/592681886.db2.gz PBWZTTOUQWYHMO-LLVKDONJSA-N 1 2 237.347 2.109 20 0 BEADLO CC(C)c1ccoc1C(=O)NCc1cn(C)c[nH+]1 ZINC000890106852 592682107 /nfs/dbraw/zinc/68/21/07/592682107.db2.gz GUTBVBJACDUBEQ-UHFFFAOYSA-N 1 2 247.298 2.067 20 0 BEADLO CCC[C@@H](C(=O)NCc1cn(C)c[nH+]1)C(C)C ZINC000890109298 592683339 /nfs/dbraw/zinc/68/33/39/592683339.db2.gz JTAKMGVECOFTQC-GFCCVEGCSA-N 1 2 237.347 2.109 20 0 BEADLO C[C@H]1CCCC[C@@H]1CC(=O)NCc1cn(C)c[nH+]1 ZINC000890114586 592685612 /nfs/dbraw/zinc/68/56/12/592685612.db2.gz QMELHMGMDCXVNV-NWDGAFQWSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1ncc(CC(=O)Nc2c(C)cc[nH+]c2C)o1 ZINC000890492307 592703107 /nfs/dbraw/zinc/70/31/07/592703107.db2.gz JYSWOIJZCXJEGK-UHFFFAOYSA-N 1 2 245.282 2.176 20 0 BEADLO CSCC[C@H](C)[N@@H+]1CCC[C@@H](F)C(=O)C1 ZINC001258216672 991145652 /nfs/dbraw/zinc/14/56/52/991145652.db2.gz ZQKSFIHUHDSDPL-VHSXEESVSA-N 1 2 233.352 2.131 20 0 BEADLO CSCC[C@H](C)[N@H+]1CCC[C@@H](F)C(=O)C1 ZINC001258216672 991145668 /nfs/dbraw/zinc/14/56/68/991145668.db2.gz ZQKSFIHUHDSDPL-VHSXEESVSA-N 1 2 233.352 2.131 20 0 BEADLO CCc1cc(NC[C@@H](C)OC)nc(CC)[nH+]1 ZINC000893396183 634400573 /nfs/dbraw/zinc/40/05/73/634400573.db2.gz CZHCVMISUCBTPZ-SECBINFHSA-N 1 2 223.320 2.048 20 0 BEADLO CCc1cc(NCCC2CC(O)C2)nc(CC)[nH+]1 ZINC000893497909 634534634 /nfs/dbraw/zinc/53/46/34/634534634.db2.gz HKZFALMBHLLXQA-UHFFFAOYSA-N 1 2 249.358 2.174 20 0 BEADLO CCc1cc(N[C@H]2CCOC[C@H]2C)nc(CC)[nH+]1 ZINC000893503195 634539401 /nfs/dbraw/zinc/53/94/01/634539401.db2.gz YTNMPLWGRVIHKJ-PWSUYJOCSA-N 1 2 249.358 2.438 20 0 BEADLO CCc1ccc(C[NH2+]Cc2nonc2C)s1 ZINC000225284430 635403651 /nfs/dbraw/zinc/40/36/51/635403651.db2.gz LECISSKDSAOBPJ-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO Nc1ccc(CNC(=O)CC2CCCCC2)c[nH+]1 ZINC000308384418 631242316 /nfs/dbraw/zinc/24/23/16/631242316.db2.gz FXTSJTQVNRESCA-UHFFFAOYSA-N 1 2 247.342 2.250 20 0 BEADLO CN(C)c1cc(N2CCCCCCC2)nc[nH+]1 ZINC000891442820 631302798 /nfs/dbraw/zinc/30/27/98/631302798.db2.gz VNGNYFYAMUFFAI-UHFFFAOYSA-N 1 2 234.347 2.313 20 0 BEADLO CN(C)c1cc(N2CCCCCCC2)[nH+]cn1 ZINC000891442820 631302800 /nfs/dbraw/zinc/30/28/00/631302800.db2.gz VNGNYFYAMUFFAI-UHFFFAOYSA-N 1 2 234.347 2.313 20 0 BEADLO CCCC[C@H](C)C(=O)NCc1ccc(N)[nH+]c1 ZINC000308393466 631310458 /nfs/dbraw/zinc/31/04/58/631310458.db2.gz RQELIFJNOICFFB-JTQLQIEISA-N 1 2 235.331 2.106 20 0 BEADLO C[C@@H]1C[C@@H](C)N(C(=O)c2cc3c[nH+]ccc3[nH]2)C1 ZINC000933368932 631328342 /nfs/dbraw/zinc/32/83/42/631328342.db2.gz NFUZXQZTCBVIEC-NXEZZACHSA-N 1 2 243.310 2.433 20 0 BEADLO Cc1cnc(Cl)c(C[N@H+](CCO)C2CC2)c1 ZINC000891619129 631413087 /nfs/dbraw/zinc/41/30/87/631413087.db2.gz LVLKTUIIXGGESQ-UHFFFAOYSA-N 1 2 240.734 2.000 20 0 BEADLO Cc1cnc(Cl)c(C[N@@H+](CCO)C2CC2)c1 ZINC000891619129 631413092 /nfs/dbraw/zinc/41/30/92/631413092.db2.gz LVLKTUIIXGGESQ-UHFFFAOYSA-N 1 2 240.734 2.000 20 0 BEADLO C[C@@H]1CN(C(=O)c2cc3c[nH+]ccc3[nH]2)C[C@H]1C ZINC000933818665 631514616 /nfs/dbraw/zinc/51/46/16/631514616.db2.gz XHVRKXNSPALPJD-NXEZZACHSA-N 1 2 243.310 2.291 20 0 BEADLO OC[C@@H]1CC[N@@H+]1Cc1ccc(Cl)cc1F ZINC000934013264 631589741 /nfs/dbraw/zinc/58/97/41/631589741.db2.gz GSPIRWQYRAFJLL-JTQLQIEISA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@@H]1CC[N@H+]1Cc1ccc(Cl)cc1F ZINC000934013264 631589744 /nfs/dbraw/zinc/58/97/44/631589744.db2.gz GSPIRWQYRAFJLL-JTQLQIEISA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@H]1CC[N@@H+]1Cc1c(F)cccc1Cl ZINC000934014092 631595198 /nfs/dbraw/zinc/59/51/98/631595198.db2.gz KSYUGGVAPCXUFL-MRVPVSSYSA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@H]1CC[N@H+]1Cc1c(F)cccc1Cl ZINC000934014092 631595204 /nfs/dbraw/zinc/59/52/04/631595204.db2.gz KSYUGGVAPCXUFL-MRVPVSSYSA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@H]1CC[N@@H+]1Cc1cccc(F)c1Cl ZINC000934020275 631620564 /nfs/dbraw/zinc/62/05/64/631620564.db2.gz ZQVKMSVNLFEMDA-SECBINFHSA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@H]1CC[N@H+]1Cc1cccc(F)c1Cl ZINC000934020275 631620569 /nfs/dbraw/zinc/62/05/69/631620569.db2.gz ZQVKMSVNLFEMDA-SECBINFHSA-N 1 2 229.682 2.046 20 0 BEADLO C[C@@H](c1ccc(F)cc1F)[N@@H+]1CC[C@@H]1CO ZINC000934028760 631629027 /nfs/dbraw/zinc/62/90/27/631629027.db2.gz ZMFGMWCPTCWCQT-WCBMZHEXSA-N 1 2 227.254 2.092 20 0 BEADLO C[C@@H](c1ccc(F)cc1F)[N@H+]1CC[C@@H]1CO ZINC000934028760 631629029 /nfs/dbraw/zinc/62/90/29/631629029.db2.gz ZMFGMWCPTCWCQT-WCBMZHEXSA-N 1 2 227.254 2.092 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@H+](C)[C@H](C)c1nnc(C)s1 ZINC000934113684 631688970 /nfs/dbraw/zinc/68/89/70/631688970.db2.gz DMTCAZOMOUNCHV-SZEHBUNVSA-N 1 2 241.360 2.017 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@@H+](C)[C@H](C)c1nnc(C)s1 ZINC000934113684 631688973 /nfs/dbraw/zinc/68/89/73/631688973.db2.gz DMTCAZOMOUNCHV-SZEHBUNVSA-N 1 2 241.360 2.017 20 0 BEADLO CC1(CNC(=O)c2cc3c[nH+]ccc3[nH]2)CCC1 ZINC000934254147 631749692 /nfs/dbraw/zinc/74/96/92/631749692.db2.gz WJHDUPRPLYXABZ-UHFFFAOYSA-N 1 2 243.310 2.483 20 0 BEADLO O[C@@H]1CC[N@H+](CCCCC(F)(F)F)C[C@H]1F ZINC000934564527 631927432 /nfs/dbraw/zinc/92/74/32/631927432.db2.gz DBYRRNPOZYWECJ-RKDXNWHRSA-N 1 2 243.244 2.124 20 0 BEADLO O[C@@H]1CC[N@@H+](CCCCC(F)(F)F)C[C@H]1F ZINC000934564527 631927436 /nfs/dbraw/zinc/92/74/36/631927436.db2.gz DBYRRNPOZYWECJ-RKDXNWHRSA-N 1 2 243.244 2.124 20 0 BEADLO c1cc(C[N@@H+]2CCc3ncsc3C2)co1 ZINC000226250314 631946987 /nfs/dbraw/zinc/94/69/87/631946987.db2.gz XMIIXCHCOWZXHW-UHFFFAOYSA-N 1 2 220.297 2.294 20 0 BEADLO c1cc(C[N@H+]2CCc3ncsc3C2)co1 ZINC000226250314 631946992 /nfs/dbraw/zinc/94/69/92/631946992.db2.gz XMIIXCHCOWZXHW-UHFFFAOYSA-N 1 2 220.297 2.294 20 0 BEADLO C[C@H](c1ccccc1F)[N@@H+]1CC[C@@H](O)[C@@H](F)C1 ZINC000934584892 631955201 /nfs/dbraw/zinc/95/52/01/631955201.db2.gz ZUTGULGWGFLYFA-JIMOISOXSA-N 1 2 241.281 2.291 20 0 BEADLO C[C@H](c1ccccc1F)[N@H+]1CC[C@@H](O)[C@@H](F)C1 ZINC000934584892 631955209 /nfs/dbraw/zinc/95/52/09/631955209.db2.gz ZUTGULGWGFLYFA-JIMOISOXSA-N 1 2 241.281 2.291 20 0 BEADLO C[C@H]1OCC[C@]1(C)[NH2+]CC(F)(F)C(F)F ZINC000308867283 632007153 /nfs/dbraw/zinc/00/71/53/632007153.db2.gz LKXPZCWUMDNMAT-SVRRBLITSA-N 1 2 229.217 2.044 20 0 BEADLO CCCNc1cc(NCC(C)(C)OC)nc[nH+]1 ZINC000161541505 632078151 /nfs/dbraw/zinc/07/81/51/632078151.db2.gz ODNUCWULTKANCD-UHFFFAOYSA-N 1 2 238.335 2.135 20 0 BEADLO CCCNc1cc(NCC(C)(C)OC)[nH+]cn1 ZINC000161541505 632078157 /nfs/dbraw/zinc/07/81/57/632078157.db2.gz ODNUCWULTKANCD-UHFFFAOYSA-N 1 2 238.335 2.135 20 0 BEADLO CNc1cc(NCc2occc2C)nc[nH+]1 ZINC000309480339 632417043 /nfs/dbraw/zinc/41/70/43/632417043.db2.gz WPUATSUZBITECO-UHFFFAOYSA-N 1 2 218.260 2.032 20 0 BEADLO CNc1cc(NCc2occc2C)[nH+]cn1 ZINC000309480339 632417045 /nfs/dbraw/zinc/41/70/45/632417045.db2.gz WPUATSUZBITECO-UHFFFAOYSA-N 1 2 218.260 2.032 20 0 BEADLO CCC[C@@H](C)Cc1nc(C[NH2+]CC)no1 ZINC000309848062 632675136 /nfs/dbraw/zinc/67/51/36/632675136.db2.gz VSWWLYYZBOLCKB-SECBINFHSA-N 1 2 211.309 2.158 20 0 BEADLO Cl/C=C/CN1CC[NH+](C/C=C\Cl)CC1 ZINC000255870297 632829833 /nfs/dbraw/zinc/82/98/33/632829833.db2.gz FHCCSKDPFKOADL-HSFFGMMNSA-N 1 2 235.158 2.109 20 0 BEADLO Cl/C=C/C[NH+]1CCN(C/C=C\Cl)CC1 ZINC000255870297 632829834 /nfs/dbraw/zinc/82/98/34/632829834.db2.gz FHCCSKDPFKOADL-HSFFGMMNSA-N 1 2 235.158 2.109 20 0 BEADLO CCCSC[C@@H](C)[NH2+]Cc1ccn[nH]1 ZINC000892515344 632868384 /nfs/dbraw/zinc/86/83/84/632868384.db2.gz NOORBAXCCQLGIT-SECBINFHSA-N 1 2 213.350 2.031 20 0 BEADLO Cc1nn(C(C)C)c(C)c1C[NH2+]Cc1cc[nH]n1 ZINC000892515043 632870120 /nfs/dbraw/zinc/87/01/20/632870120.db2.gz BFXSHJBMWCHCKM-UHFFFAOYSA-N 1 2 247.346 2.094 20 0 BEADLO C[C@@H](O)[C@@H]([NH2+][C@@H](C)c1ncco1)c1ccccc1 ZINC000926730590 632899654 /nfs/dbraw/zinc/89/96/54/632899654.db2.gz ACRQDFFJUMXEJU-DMDPSCGWSA-N 1 2 246.310 2.447 20 0 BEADLO CC[C@@H](CSC)[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000162113115 633021430 /nfs/dbraw/zinc/02/14/30/633021430.db2.gz ZLUSYXKACHVPAI-UWVGGRQHSA-N 1 2 247.404 2.448 20 0 BEADLO CCc1cc(NC[C@H](C)CCO)nc(CC)[nH+]1 ZINC000892729977 633205273 /nfs/dbraw/zinc/20/52/73/633205273.db2.gz DNEBUQVIFILXLE-SNVBAGLBSA-N 1 2 237.347 2.032 20 0 BEADLO Cc1cc(NC[C@@H](C)CCO)nc(C2CCC2)[nH+]1 ZINC000892730353 633205539 /nfs/dbraw/zinc/20/55/39/633205539.db2.gz GXYPCBVSUYUKNS-JTQLQIEISA-N 1 2 249.358 2.483 20 0 BEADLO CC(C)[C@H]1C[N@H+](C/C=C/Cl)CCO1 ZINC000307713420 635993751 /nfs/dbraw/zinc/99/37/51/635993751.db2.gz BSGQPIYZBWOUQI-HMDXOVGESA-N 1 2 203.713 2.096 20 0 BEADLO CC(C)[C@H]1C[N@@H+](C/C=C/Cl)CCO1 ZINC000307713420 635993754 /nfs/dbraw/zinc/99/37/54/635993754.db2.gz BSGQPIYZBWOUQI-HMDXOVGESA-N 1 2 203.713 2.096 20 0 BEADLO Cc1nc(N2CCC[C@@H](CO)CC2)c(C)c(C)[nH+]1 ZINC000338827704 636055159 /nfs/dbraw/zinc/05/51/59/636055159.db2.gz JDNUHWBRRLOXEU-CYBMUJFWSA-N 1 2 249.358 2.001 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2CC=CCC2)n1 ZINC000309637755 633978285 /nfs/dbraw/zinc/97/82/85/633978285.db2.gz NHVQFOOGYOLRRA-SECBINFHSA-N 1 2 207.277 2.003 20 0 BEADLO Cc1cnc(Cl)c(C[N@@H+](C)C2(CO)CC2)c1 ZINC000895475723 636148012 /nfs/dbraw/zinc/14/80/12/636148012.db2.gz MIRVFIZYYNHFAX-UHFFFAOYSA-N 1 2 240.734 2.000 20 0 BEADLO Cc1cnc(Cl)c(C[N@H+](C)C2(CO)CC2)c1 ZINC000895475723 636148016 /nfs/dbraw/zinc/14/80/16/636148016.db2.gz MIRVFIZYYNHFAX-UHFFFAOYSA-N 1 2 240.734 2.000 20 0 BEADLO CCC[C@](C)([NH2+]C[C@@H]1CCC=CO1)C(=O)OC ZINC000194174922 634308421 /nfs/dbraw/zinc/30/84/21/634308421.db2.gz RIGUDMHEKFIDQR-AAEUAGOBSA-N 1 2 241.331 2.001 20 0 BEADLO CCCCCCn1ncc2c1nc[nH+]c2NC ZINC000194431178 634316368 /nfs/dbraw/zinc/31/63/68/634316368.db2.gz TYJPRQYYRNRSFR-UHFFFAOYSA-N 1 2 233.319 2.448 20 0 BEADLO COC(=O)C(C)(C)[NH2+]CCc1ccc(C)c(C)c1 ZINC000258790644 635202377 /nfs/dbraw/zinc/20/23/77/635202377.db2.gz MJVOYFDVDILTDL-UHFFFAOYSA-N 1 2 249.354 2.387 20 0 BEADLO CCOCc1ccc(C[NH2+]Cc2c[nH]cn2)cc1 ZINC000894171057 635738025 /nfs/dbraw/zinc/73/80/25/635738025.db2.gz DHDIOPXVKXJGDJ-UHFFFAOYSA-N 1 2 245.326 2.236 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H]2CCC[C@@H]3C[C@@H]32)[nH+]c1C ZINC000896908138 636251105 /nfs/dbraw/zinc/25/11/05/636251105.db2.gz WNZLULCRJHJZEL-UTUOFQBUSA-N 1 2 247.342 2.079 20 0 BEADLO Cc1[nH]c(CNC(=O)CCCC(C)C)[nH+]c1C ZINC000896910808 636253327 /nfs/dbraw/zinc/25/33/27/636253327.db2.gz YOMBUWQNKQFYQK-UHFFFAOYSA-N 1 2 237.347 2.469 20 0 BEADLO Cl/C=C\CNc1cc(NC2CC2)[nH+]cn1 ZINC000897503696 636728135 /nfs/dbraw/zinc/72/81/35/636728135.db2.gz QWTQNRTXKQZJIU-RJRFIUFISA-N 1 2 224.695 2.215 20 0 BEADLO Cl/C=C\CNc1cc(NC2CC2)nc[nH+]1 ZINC000897503696 636728139 /nfs/dbraw/zinc/72/81/39/636728139.db2.gz QWTQNRTXKQZJIU-RJRFIUFISA-N 1 2 224.695 2.215 20 0 BEADLO Cl/C=C/CNc1cc(NC2CC2)[nH+]cn1 ZINC000897503695 636728571 /nfs/dbraw/zinc/72/85/71/636728571.db2.gz QWTQNRTXKQZJIU-DAFODLJHSA-N 1 2 224.695 2.215 20 0 BEADLO Cl/C=C/CNc1cc(NC2CC2)nc[nH+]1 ZINC000897503695 636728581 /nfs/dbraw/zinc/72/85/81/636728581.db2.gz QWTQNRTXKQZJIU-DAFODLJHSA-N 1 2 224.695 2.215 20 0 BEADLO Cc1nonc1[C@@H](C)[NH2+][C@@H](C)c1cnccc1C ZINC000925295504 636782601 /nfs/dbraw/zinc/78/26/01/636782601.db2.gz XSVJWPHQGPJYSQ-VHSXEESVSA-N 1 2 246.314 2.493 20 0 BEADLO CCc1onc(C)c1C[N@@H+]1C[C@H](C)OC[C@@H]1C ZINC000929183359 636919569 /nfs/dbraw/zinc/91/95/69/636919569.db2.gz UOVAJKVFCBTFMH-UWVGGRQHSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1onc(C)c1C[N@H+]1C[C@H](C)OC[C@@H]1C ZINC000929183359 636919575 /nfs/dbraw/zinc/91/95/75/636919575.db2.gz UOVAJKVFCBTFMH-UWVGGRQHSA-N 1 2 238.331 2.155 20 0 BEADLO C[C@H]1C[C@@H]1c1noc([C@@H]2C[C@H]2c2c[nH]c[nH+]2)n1 ZINC000923924319 637012089 /nfs/dbraw/zinc/01/20/89/637012089.db2.gz ZSIUPWXEBMBADY-RBXMUDONSA-N 1 2 230.271 2.187 20 0 BEADLO CNc1cc(N2CC[C@@H]3CCCC[C@@H]32)nc[nH+]1 ZINC000163555539 637033551 /nfs/dbraw/zinc/03/35/51/637033551.db2.gz XEBZOYUSCMIOFO-QWRGUYRKSA-N 1 2 232.331 2.287 20 0 BEADLO CNc1cc(N2CC[C@@H]3CCCC[C@@H]32)[nH+]cn1 ZINC000163555539 637033560 /nfs/dbraw/zinc/03/35/60/637033560.db2.gz XEBZOYUSCMIOFO-QWRGUYRKSA-N 1 2 232.331 2.287 20 0 BEADLO CC[C@@H]1C[C@H](C)CN1C(=O)CNc1cccc[nH+]1 ZINC000900908475 637205057 /nfs/dbraw/zinc/20/50/57/637205057.db2.gz HYPRIXFTHRKYKL-NWDGAFQWSA-N 1 2 247.342 2.141 20 0 BEADLO CC1(CNC(=O)Cc2c[nH]c[nH+]2)CCCCC1 ZINC000901022944 637226130 /nfs/dbraw/zinc/22/61/30/637226130.db2.gz GHSKPTHDRKTPNW-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO CC(C)C[C@@H]1CCCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC000901029261 637229226 /nfs/dbraw/zinc/22/92/26/637229226.db2.gz MKOBYWKLXNZHIG-ZDUSSCGKSA-N 1 2 249.358 2.379 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1noc([C@H]2CC23CC3)n1 ZINC000904268584 637395139 /nfs/dbraw/zinc/39/51/39/637395139.db2.gz VXHPRQMDIXTJMQ-SECBINFHSA-N 1 2 242.282 2.290 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1noc([C@@H]2C[C@H]2C)n1 ZINC000904268231 637395702 /nfs/dbraw/zinc/39/57/02/637395702.db2.gz FMLSWESRIDRHSS-HTRCEHHLSA-N 1 2 230.271 2.146 20 0 BEADLO CC[NH2+]Cc1noc(C[C@@H]2CC=CCC2)n1 ZINC000904493345 637420670 /nfs/dbraw/zinc/42/06/70/637420670.db2.gz BOKFZUHCTWHPDW-SNVBAGLBSA-N 1 2 221.304 2.078 20 0 BEADLO Fc1ncccc1-c1c[nH+]c2n1CCCC2 ZINC000904743483 637467378 /nfs/dbraw/zinc/46/73/78/637467378.db2.gz VCWRKVJXDYDNHM-UHFFFAOYSA-N 1 2 217.247 2.421 20 0 BEADLO Cc1c2c(ccc1-c1c[nH+]cn1C)OCC2 ZINC000904862489 637513334 /nfs/dbraw/zinc/51/33/34/637513334.db2.gz OZMFGRVIDRJPNU-UHFFFAOYSA-N 1 2 214.268 2.330 20 0 BEADLO CCOCOc1cnccc1-c1c[nH+]c(C)n1C ZINC000904878052 637519965 /nfs/dbraw/zinc/51/99/65/637519965.db2.gz NHZPNCDEGUQODW-UHFFFAOYSA-N 1 2 247.298 2.163 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(N=S(C)(C)=O)cc1 ZINC000905304509 637761781 /nfs/dbraw/zinc/76/17/81/637761781.db2.gz LGHHRCKSCOJPQA-UHFFFAOYSA-N 1 2 249.339 2.446 20 0 BEADLO Cc1n[nH]c(C)c1-c1c[nH+]c2c(c1)CCCN2 ZINC000906162820 638101276 /nfs/dbraw/zinc/10/12/76/638101276.db2.gz IPNWBPVVVVHVFP-UHFFFAOYSA-N 1 2 228.299 2.089 20 0 BEADLO C[C@@H]1C[N@@H+]([C@@H]2C[C@@H]2c2cccc(F)c2)CCO1 ZINC000906584795 638219314 /nfs/dbraw/zinc/21/93/14/638219314.db2.gz QJECXBIHOVIFMF-LERXQTSPSA-N 1 2 235.302 2.402 20 0 BEADLO C[C@@H]1C[N@H+]([C@@H]2C[C@@H]2c2cccc(F)c2)CCO1 ZINC000906584795 638219324 /nfs/dbraw/zinc/21/93/24/638219324.db2.gz QJECXBIHOVIFMF-LERXQTSPSA-N 1 2 235.302 2.402 20 0 BEADLO CCC[C@@H]1CCCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC000907358630 638360067 /nfs/dbraw/zinc/36/00/67/638360067.db2.gz NYLMWRFQWHMCQY-GFCCVEGCSA-N 1 2 235.331 2.133 20 0 BEADLO Cc1cc(C)c(C(=O)N2CC(C)C2)c(C)[nH+]1 ZINC000907765627 638465134 /nfs/dbraw/zinc/46/51/34/638465134.db2.gz SWLSOFFASMNWBV-UHFFFAOYSA-N 1 2 218.300 2.099 20 0 BEADLO C[C@H](CC1CCCCC1)NC(=O)Cc1c[nH]c[nH+]1 ZINC000907804689 638469563 /nfs/dbraw/zinc/46/95/63/638469563.db2.gz AVNIKYQCLBZLOV-LLVKDONJSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@H]1CC[C@@H](CNC(=O)CNc2cccc[nH+]2)C1 ZINC000907914087 638510786 /nfs/dbraw/zinc/51/07/86/638510786.db2.gz SRSIKUQILRRYLF-NWDGAFQWSA-N 1 2 247.342 2.046 20 0 BEADLO C[C@H]1CCC[C@H]1CNC(=O)CNc1cccc[nH+]1 ZINC000907973649 638530029 /nfs/dbraw/zinc/53/00/29/638530029.db2.gz MVNKHDMNRBTUMX-RYUDHWBXSA-N 1 2 247.342 2.046 20 0 BEADLO Cc1cc(C)c(C(=O)NCCCCF)c(C)[nH+]1 ZINC000908316929 638638095 /nfs/dbraw/zinc/63/80/95/638638095.db2.gz ILTQCFIUBVPJBL-UHFFFAOYSA-N 1 2 238.306 2.486 20 0 BEADLO Cc1cc(C)c(C(=O)NCC[C@H](C)F)c(C)[nH+]1 ZINC000908428288 638707267 /nfs/dbraw/zinc/70/72/67/638707267.db2.gz PULQYGUUPMZIIP-VIFPVBQESA-N 1 2 238.306 2.485 20 0 BEADLO Cc1cc(C)c(C(=O)N2C[C@@H](C)[C@@H]2C)c(C)[nH+]1 ZINC000908437077 638714271 /nfs/dbraw/zinc/71/42/71/638714271.db2.gz YSJVGGMYFKJLJA-SKDRFNHKSA-N 1 2 232.327 2.487 20 0 BEADLO Cc1cc(C)c(C(=O)NC(CF)CF)c(C)[nH+]1 ZINC000908527274 638998133 /nfs/dbraw/zinc/99/81/33/638998133.db2.gz SKDIROLJUURGDZ-UHFFFAOYSA-N 1 2 242.269 2.044 20 0 BEADLO Cc1cc(NCc2cccn2C)nc(C(C)C)[nH+]1 ZINC000348350328 639059093 /nfs/dbraw/zinc/05/90/93/639059093.db2.gz NNLNYKDHSOZYRF-UHFFFAOYSA-N 1 2 244.342 2.281 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1ccccc1CF ZINC000930288405 639681311 /nfs/dbraw/zinc/68/13/11/639681311.db2.gz VUTKFOFFASUHTN-SNVBAGLBSA-N 1 2 239.290 2.149 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1ccccc1CF ZINC000930288405 639681318 /nfs/dbraw/zinc/68/13/18/639681318.db2.gz VUTKFOFFASUHTN-SNVBAGLBSA-N 1 2 239.290 2.149 20 0 BEADLO CC[N@@H+](Cc1c(F)cncc1F)C[C@@H](C)OC ZINC000930541122 639808490 /nfs/dbraw/zinc/80/84/90/639808490.db2.gz UPQSFOSEKNNYKK-SECBINFHSA-N 1 2 244.285 2.217 20 0 BEADLO CC[N@H+](Cc1c(F)cncc1F)C[C@@H](C)OC ZINC000930541122 639808493 /nfs/dbraw/zinc/80/84/93/639808493.db2.gz UPQSFOSEKNNYKK-SECBINFHSA-N 1 2 244.285 2.217 20 0 BEADLO O=C(CNc1cccc[nH+]1)N1CCC12CCCC2 ZINC000911865501 639852166 /nfs/dbraw/zinc/85/21/66/639852166.db2.gz MJHBOTTVRKFSEY-UHFFFAOYSA-N 1 2 245.326 2.039 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@H](CC)OC[C@H]2C)o1 ZINC000930851756 639947739 /nfs/dbraw/zinc/94/77/39/639947739.db2.gz JQWJKZLBCXXEGP-MNOVXSKESA-N 1 2 238.331 2.236 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@H](CC)OC[C@H]2C)o1 ZINC000930851756 639947746 /nfs/dbraw/zinc/94/77/46/639947746.db2.gz JQWJKZLBCXXEGP-MNOVXSKESA-N 1 2 238.331 2.236 20 0 BEADLO CC/C=C/CC[NH2+][C@@]1(C)CC(C)(C)OC1=O ZINC000930873695 639964394 /nfs/dbraw/zinc/96/43/94/639964394.db2.gz AUHQHYLTDRDQJY-YBJDMEARSA-N 1 2 225.332 2.417 20 0 BEADLO Cc1nnc(CN(C)Cc2cc(C)cc(C)[nH+]2)o1 ZINC000930971560 640006136 /nfs/dbraw/zinc/00/61/36/640006136.db2.gz TVFQIMSERHUHQS-UHFFFAOYSA-N 1 2 246.314 2.022 20 0 BEADLO O=C(N[C@H]1CCn2c[nH+]cc21)C1(C2CC2)CCC1 ZINC000912584275 640122250 /nfs/dbraw/zinc/12/22/50/640122250.db2.gz GJKWSQIUUQIGIC-NSHDSACASA-N 1 2 245.326 2.024 20 0 BEADLO CC/C(C)=C(/C)C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000912616146 640140625 /nfs/dbraw/zinc/14/06/25/640140625.db2.gz ZCTJXGNLLDPFDC-QXMHVHEDSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@@H](CNC(=O)Cc1c[nH]c[nH+]1)C1CCCCC1 ZINC000912710639 640180078 /nfs/dbraw/zinc/18/00/78/640180078.db2.gz RKBQOOMLZSJOOT-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO Cc1ccc(C[N@@H+]2Cc3c[nH]nc3[C@H](C)C2)nc1 ZINC000931461610 640220539 /nfs/dbraw/zinc/22/05/39/640220539.db2.gz WCRNDNBUKOBRSY-LLVKDONJSA-N 1 2 242.326 2.232 20 0 BEADLO Cc1ccc(C[N@H+]2Cc3c[nH]nc3[C@H](C)C2)nc1 ZINC000931461610 640220545 /nfs/dbraw/zinc/22/05/45/640220545.db2.gz WCRNDNBUKOBRSY-LLVKDONJSA-N 1 2 242.326 2.232 20 0 BEADLO CCc1nocc1C[N@H+]1Cc2c[nH]nc2[C@@H](C)C1 ZINC000931462015 640222196 /nfs/dbraw/zinc/22/21/96/640222196.db2.gz ITXNIOGETXDSHJ-VIFPVBQESA-N 1 2 246.314 2.079 20 0 BEADLO CCc1nocc1C[N@@H+]1Cc2c[nH]nc2[C@@H](C)C1 ZINC000931462015 640222199 /nfs/dbraw/zinc/22/21/99/640222199.db2.gz ITXNIOGETXDSHJ-VIFPVBQESA-N 1 2 246.314 2.079 20 0 BEADLO CCOC(=O)C[N@@H+]1CCSC[C@@H]1C(C)(C)C ZINC000931590274 640281683 /nfs/dbraw/zinc/28/16/83/640281683.db2.gz NYHUQNRGZUXLCB-SNVBAGLBSA-N 1 2 245.388 2.013 20 0 BEADLO CCOC(=O)C[N@H+]1CCSC[C@@H]1C(C)(C)C ZINC000931590274 640281692 /nfs/dbraw/zinc/28/16/92/640281692.db2.gz NYHUQNRGZUXLCB-SNVBAGLBSA-N 1 2 245.388 2.013 20 0 BEADLO c1nc(C[NH2+]C2(c3ccccc3)CC2)c[nH]1 ZINC000163950918 640432772 /nfs/dbraw/zinc/43/27/72/640432772.db2.gz CQXFUUMAVDEPSA-UHFFFAOYSA-N 1 2 213.284 2.189 20 0 BEADLO C[C@H]1CC[N@H+](Cc2nc3ccccc3[nH]2)CCO1 ZINC000932335446 640476500 /nfs/dbraw/zinc/47/65/00/640476500.db2.gz GRVNZNWVMVAYHB-NSHDSACASA-N 1 2 245.326 2.174 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2nc3ccccc3[nH]2)CCO1 ZINC000932335446 640476504 /nfs/dbraw/zinc/47/65/04/640476504.db2.gz GRVNZNWVMVAYHB-NSHDSACASA-N 1 2 245.326 2.174 20 0 BEADLO CC(C)n1ccnc1C[N@@H+]1CCO[C@@H](C)CC1 ZINC000932339937 640483064 /nfs/dbraw/zinc/48/30/64/640483064.db2.gz FQWFXRAHWPELKH-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccnc1C[N@H+]1CCO[C@@H](C)CC1 ZINC000932339937 640483075 /nfs/dbraw/zinc/48/30/75/640483075.db2.gz FQWFXRAHWPELKH-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO Cl/C=C/C[NH2+][C@@H](c1ncccn1)C1CC1 ZINC000932360483 640498466 /nfs/dbraw/zinc/49/84/66/640498466.db2.gz LXYYEQVYRRQZCJ-XOTMTNNUSA-N 1 2 223.707 2.270 20 0 BEADLO c1nnsc1C[NH2+][C@@H](c1ccccn1)C1CC1 ZINC000932387609 640515173 /nfs/dbraw/zinc/51/51/73/640515173.db2.gz YVIUQWCAPKYYFW-GFCCVEGCSA-N 1 2 246.339 2.174 20 0 BEADLO CC(C)C[N@H+](Cc1cc[nH]n1)Cc1ccccn1 ZINC000932449635 640529035 /nfs/dbraw/zinc/52/90/35/640529035.db2.gz QXWJQMYQVZQORE-UHFFFAOYSA-N 1 2 244.342 2.463 20 0 BEADLO CC(C)C[N@@H+](Cc1cc[nH]n1)Cc1ccccn1 ZINC000932449635 640529044 /nfs/dbraw/zinc/52/90/44/640529044.db2.gz QXWJQMYQVZQORE-UHFFFAOYSA-N 1 2 244.342 2.463 20 0 BEADLO CC[N@H+](CCC(F)(F)F)C(C)(C)C(=O)OC ZINC000933193636 640675807 /nfs/dbraw/zinc/67/58/07/640675807.db2.gz QVGDXXBEVPTKQY-UHFFFAOYSA-N 1 2 241.253 2.212 20 0 BEADLO CC[N@@H+](CCC(F)(F)F)C(C)(C)C(=O)OC ZINC000933193636 640675809 /nfs/dbraw/zinc/67/58/09/640675809.db2.gz QVGDXXBEVPTKQY-UHFFFAOYSA-N 1 2 241.253 2.212 20 0 BEADLO C[N@H+](Cc1ccoc1)Cc1ccc(Cl)nn1 ZINC000167398465 640716429 /nfs/dbraw/zinc/71/64/29/640716429.db2.gz ISFIFDQECWWYSL-UHFFFAOYSA-N 1 2 237.690 2.355 20 0 BEADLO C[N@@H+](Cc1ccoc1)Cc1ccc(Cl)nn1 ZINC000167398465 640716434 /nfs/dbraw/zinc/71/64/34/640716434.db2.gz ISFIFDQECWWYSL-UHFFFAOYSA-N 1 2 237.690 2.355 20 0 BEADLO Cl/C=C/C[N@@H+]1CCOC[C@@H]1C[C@H]1CCCO1 ZINC000933669400 640740904 /nfs/dbraw/zinc/74/09/04/640740904.db2.gz CAYOCKIUSCIAJG-VOBIIGJTSA-N 1 2 245.750 2.009 20 0 BEADLO Cl/C=C/C[N@H+]1CCOC[C@@H]1C[C@H]1CCCO1 ZINC000933669400 640740908 /nfs/dbraw/zinc/74/09/08/640740908.db2.gz CAYOCKIUSCIAJG-VOBIIGJTSA-N 1 2 245.750 2.009 20 0 BEADLO CC[N@@H+]1CCCC[C@@H]1C(=O)Oc1ccccc1 ZINC000170919069 640940491 /nfs/dbraw/zinc/94/04/91/640940491.db2.gz HSWRBXYIWROYIQ-CYBMUJFWSA-N 1 2 233.311 2.466 20 0 BEADLO CC[N@H+]1CCCC[C@@H]1C(=O)Oc1ccccc1 ZINC000170919069 640940496 /nfs/dbraw/zinc/94/04/96/640940496.db2.gz HSWRBXYIWROYIQ-CYBMUJFWSA-N 1 2 233.311 2.466 20 0 BEADLO CCCNc1cc(NCC2CC2)nc[nH+]1 ZINC000087807591 641050372 /nfs/dbraw/zinc/05/03/72/641050372.db2.gz FKKXDZMHULNCTI-UHFFFAOYSA-N 1 2 206.293 2.120 20 0 BEADLO CCCNc1cc(NCC2CC2)[nH+]cn1 ZINC000087807591 641050376 /nfs/dbraw/zinc/05/03/76/641050376.db2.gz FKKXDZMHULNCTI-UHFFFAOYSA-N 1 2 206.293 2.120 20 0 BEADLO CCCNc1cc(NCCCSC)nc[nH+]1 ZINC000087830669 641063949 /nfs/dbraw/zinc/06/39/49/641063949.db2.gz MAWZKRMQOQRYOV-UHFFFAOYSA-N 1 2 240.376 2.464 20 0 BEADLO CCCNc1cc(NCCCSC)[nH+]cn1 ZINC000087830669 641063955 /nfs/dbraw/zinc/06/39/55/641063955.db2.gz MAWZKRMQOQRYOV-UHFFFAOYSA-N 1 2 240.376 2.464 20 0 BEADLO CNc1cc(N[C@@H]2CCC[C@@H]2C)[nH+]cn1 ZINC000087829557 641064199 /nfs/dbraw/zinc/06/41/99/641064199.db2.gz MCXGOLVIJLLZMX-DTWKUNHWSA-N 1 2 206.293 2.119 20 0 BEADLO CO[C@H]1CC[C@@H]1[N@H+](C)Cc1ncccc1Cl ZINC000934107614 641070120 /nfs/dbraw/zinc/07/01/20/641070120.db2.gz XKNOFLRIUWCJOM-RYUDHWBXSA-N 1 2 240.734 2.344 20 0 BEADLO CO[C@H]1CC[C@@H]1[N@@H+](C)Cc1ncccc1Cl ZINC000934107614 641070126 /nfs/dbraw/zinc/07/01/26/641070126.db2.gz XKNOFLRIUWCJOM-RYUDHWBXSA-N 1 2 240.734 2.344 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@H+](C)Cc1csc(C)n1 ZINC000934120133 641083198 /nfs/dbraw/zinc/08/31/98/641083198.db2.gz ZZXCHRIJNHWYSD-WDEREUQCSA-N 1 2 226.345 2.061 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@@H+](C)Cc1csc(C)n1 ZINC000934120133 641083200 /nfs/dbraw/zinc/08/32/00/641083200.db2.gz ZZXCHRIJNHWYSD-WDEREUQCSA-N 1 2 226.345 2.061 20 0 BEADLO CO[C@H]1CC[C@H]1[N@H+](C)Cc1csc(C)n1 ZINC000934120131 641084031 /nfs/dbraw/zinc/08/40/31/641084031.db2.gz ZZXCHRIJNHWYSD-MNOVXSKESA-N 1 2 226.345 2.061 20 0 BEADLO CO[C@H]1CC[C@H]1[N@@H+](C)Cc1csc(C)n1 ZINC000934120131 641084033 /nfs/dbraw/zinc/08/40/33/641084033.db2.gz ZZXCHRIJNHWYSD-MNOVXSKESA-N 1 2 226.345 2.061 20 0 BEADLO CCc1nc(C[N@H+](C)[C@H]2CC[C@@H]2OC)cs1 ZINC000934128182 641085366 /nfs/dbraw/zinc/08/53/66/641085366.db2.gz QKXWKMIIGLEBRB-QWRGUYRKSA-N 1 2 240.372 2.315 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@H]2CC[C@@H]2OC)cs1 ZINC000934128182 641085367 /nfs/dbraw/zinc/08/53/67/641085367.db2.gz QKXWKMIIGLEBRB-QWRGUYRKSA-N 1 2 240.372 2.315 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2cncs2)nn1C ZINC000934194755 641096743 /nfs/dbraw/zinc/09/67/43/641096743.db2.gz AQZNZJKKJUHXII-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO CCCCC1([NH2+]Cc2noc(CC)n2)CC1 ZINC000934209849 641103431 /nfs/dbraw/zinc/10/34/31/641103431.db2.gz UEPHRUMFLRPFKA-UHFFFAOYSA-N 1 2 223.320 2.444 20 0 BEADLO COc1c(C)c[nH+]c(CNC(=O)C2CCC2)c1C ZINC000050449295 641151671 /nfs/dbraw/zinc/15/16/71/641151671.db2.gz SJFSTICVTADTGW-UHFFFAOYSA-N 1 2 248.326 2.123 20 0 BEADLO Cc1nn(C[N@H+]2CCC[C@@H]2C)c(=S)s1 ZINC000173526319 641182979 /nfs/dbraw/zinc/18/29/79/641182979.db2.gz OKFVGKBICSCLFT-ZETCQYMHSA-N 1 2 229.374 2.424 20 0 BEADLO Cc1nn(C[N@@H+]2CCC[C@@H]2C)c(=S)s1 ZINC000173526319 641182982 /nfs/dbraw/zinc/18/29/82/641182982.db2.gz OKFVGKBICSCLFT-ZETCQYMHSA-N 1 2 229.374 2.424 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1ccc(O)c(F)c1 ZINC000232449682 641272968 /nfs/dbraw/zinc/27/29/68/641272968.db2.gz NQXOKBIOUXWPBE-LLVKDONJSA-N 1 2 239.290 2.142 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1ccc(O)c(F)c1 ZINC000232449682 641272972 /nfs/dbraw/zinc/27/29/72/641272972.db2.gz NQXOKBIOUXWPBE-LLVKDONJSA-N 1 2 239.290 2.142 20 0 BEADLO C[N@H+](CC(F)F)C[C@H]1C[C@@H]2[C@H](C1)C2(F)F ZINC000929515034 641341224 /nfs/dbraw/zinc/34/12/24/641341224.db2.gz AXLYUOLRZTYYIO-RNLVFQAGSA-N 1 2 225.229 2.475 20 0 BEADLO C[N@@H+](CC(F)F)C[C@H]1C[C@@H]2[C@H](C1)C2(F)F ZINC000929515034 641341232 /nfs/dbraw/zinc/34/12/32/641341232.db2.gz AXLYUOLRZTYYIO-RNLVFQAGSA-N 1 2 225.229 2.475 20 0 BEADLO COC1(c2noc([C@H](C)[NH+](C)C)n2)CCCC1 ZINC000350761740 641411762 /nfs/dbraw/zinc/41/17/62/641411762.db2.gz QQISQGKNQAKBLK-VIFPVBQESA-N 1 2 239.319 2.108 20 0 BEADLO C[C@H]1CC[C@H](NC(=O)c2cc3c[nH+]ccc3[nH]2)C1 ZINC000935540796 641425280 /nfs/dbraw/zinc/42/52/80/641425280.db2.gz MUOAIDCJHVIDDA-ONGXEEELSA-N 1 2 243.310 2.481 20 0 BEADLO CC1(CCNC(=O)c2cc3c[nH+]ccc3[nH]2)CC1 ZINC000935731715 641471444 /nfs/dbraw/zinc/47/14/44/641471444.db2.gz AOCFDYCUAVQREA-UHFFFAOYSA-N 1 2 243.310 2.483 20 0 BEADLO CNc1cc(N[C@H](C)c2nc(C)cs2)nc[nH+]1 ZINC000156174758 641598847 /nfs/dbraw/zinc/59/88/47/641598847.db2.gz TUAJHUOGEYFJQA-MRVPVSSYSA-N 1 2 249.343 2.456 20 0 BEADLO CNc1cc(N[C@H](C)c2nc(C)cs2)[nH+]cn1 ZINC000156174758 641598853 /nfs/dbraw/zinc/59/88/53/641598853.db2.gz TUAJHUOGEYFJQA-MRVPVSSYSA-N 1 2 249.343 2.456 20 0 BEADLO Cc1ccc(NC(=O)[C@@H](C)C2CC2)c(N(C)C)[nH+]1 ZINC000152731832 641639685 /nfs/dbraw/zinc/63/96/85/641639685.db2.gz FWCVSXXIYMLKKT-JTQLQIEISA-N 1 2 247.342 2.441 20 0 BEADLO CCCC[C@@H]([NH2+]C[C@@H]1CCC=CO1)C(=O)OC ZINC000187732866 641721122 /nfs/dbraw/zinc/72/11/22/641721122.db2.gz NVGXKDIFPFZRBH-NWDGAFQWSA-N 1 2 241.331 2.001 20 0 BEADLO CCCC[C@H]([NH2+]C[C@H]1CCC=CO1)C(=O)OC ZINC000187732884 641722495 /nfs/dbraw/zinc/72/24/95/641722495.db2.gz NVGXKDIFPFZRBH-NEPJUHHUSA-N 1 2 241.331 2.001 20 0 BEADLO COC[C@@H](C)C[NH2+]c1ccc(N(C)C)cc1 ZINC000153353548 641762765 /nfs/dbraw/zinc/76/27/65/641762765.db2.gz JWMOAVKFTVFACB-NSHDSACASA-N 1 2 222.332 2.447 20 0 BEADLO COC[C@@H](C)CNc1ccc([NH+](C)C)cc1 ZINC000153353548 641762770 /nfs/dbraw/zinc/76/27/70/641762770.db2.gz JWMOAVKFTVFACB-NSHDSACASA-N 1 2 222.332 2.447 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1C(=O)NC1C[NH+](CC)C1 ZINC001031173188 641772181 /nfs/dbraw/zinc/77/21/81/641772181.db2.gz SCCWRMZREVLAOA-YPMHNXCESA-N 1 2 238.375 2.023 20 0 BEADLO Fc1ccc(CNc2cc[nH+]cc2F)cn1 ZINC000192149295 641966776 /nfs/dbraw/zinc/96/67/76/641966776.db2.gz RSULYRSCWQEHAF-UHFFFAOYSA-N 1 2 221.210 2.367 20 0 BEADLO CC[NH+]1CC(NC(=O)C2(C)CCC(C)CC2)C1 ZINC001031459717 642177674 /nfs/dbraw/zinc/17/76/74/642177674.db2.gz BGKPAHFPIWJQKB-UHFFFAOYSA-N 1 2 238.375 2.023 20 0 BEADLO Cc1ccnc(SCCn2cc[nH+]c2)c1 ZINC000918802465 642267329 /nfs/dbraw/zinc/26/73/29/642267329.db2.gz ZUHRRGKBIUIOEM-UHFFFAOYSA-N 1 2 219.313 2.379 20 0 BEADLO CC(=O)OCCn1c[nH+]c(Cc2ccccc2)c1 ZINC000919151593 642303163 /nfs/dbraw/zinc/30/31/63/642303163.db2.gz SNHGSFNVHHAFKE-UHFFFAOYSA-N 1 2 244.294 2.037 20 0 BEADLO CC(C)C[C@@H]1C[N@H+](C)CCN1CCOC(C)C ZINC000933243459 642411247 /nfs/dbraw/zinc/41/12/47/642411247.db2.gz LAGOLVLFCGTTPY-CQSZACIVSA-N 1 2 242.407 2.074 20 0 BEADLO CC(C)C[C@@H]1C[N@@H+](C)CCN1CCOC(C)C ZINC000933243459 642411254 /nfs/dbraw/zinc/41/12/54/642411254.db2.gz LAGOLVLFCGTTPY-CQSZACIVSA-N 1 2 242.407 2.074 20 0 BEADLO C[C@H]1CCCC[C@H]1N(C)C(=O)CCc1c[nH]c[nH+]1 ZINC000188566404 642415203 /nfs/dbraw/zinc/41/52/03/642415203.db2.gz DMUAXHUOXBAGJV-WCQYABFASA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H]1CCCC[C@H]1N(C)C(=O)CCc1c[nH+]c[nH]1 ZINC000188566404 642415214 /nfs/dbraw/zinc/41/52/14/642415214.db2.gz DMUAXHUOXBAGJV-WCQYABFASA-N 1 2 249.358 2.379 20 0 BEADLO CCC[NH+](CCC)Cc1nnc(OC)s1 ZINC000920257915 642462405 /nfs/dbraw/zinc/46/24/05/642462405.db2.gz ABIOFJFFPHNMPJ-UHFFFAOYSA-N 1 2 229.349 2.169 20 0 BEADLO CCCCCCNC(=O)CCCn1cc[nH+]c1 ZINC000920925020 642559858 /nfs/dbraw/zinc/55/98/58/642559858.db2.gz FOUGNNGHKNYNFB-UHFFFAOYSA-N 1 2 237.347 2.360 20 0 BEADLO Clc1cnn(C[NH+]2C3CCC2CC3)c1 ZINC000921185507 642582467 /nfs/dbraw/zinc/58/24/67/642582467.db2.gz OBPQNBLEMYYLOL-UHFFFAOYSA-N 1 2 211.696 2.121 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@@H](O)c1ccccc1 ZINC000179978869 642759620 /nfs/dbraw/zinc/75/96/20/642759620.db2.gz ONLZVCAGJORPPQ-IINYFYTJSA-N 1 2 245.326 2.102 20 0 BEADLO CNc1cc(N[C@@H](C)Cc2ccco2)[nH+]cn1 ZINC000130818110 642764061 /nfs/dbraw/zinc/76/40/61/642764061.db2.gz INSAKJDWFHFWDA-VIFPVBQESA-N 1 2 232.287 2.154 20 0 BEADLO C#CCCOC(=O)[C@@H](c1ccccc1)[N@@H+](C)CC ZINC000181147034 642842996 /nfs/dbraw/zinc/84/29/96/642842996.db2.gz QSURVBGWVVHTOW-CQSZACIVSA-N 1 2 245.322 2.246 20 0 BEADLO C#CCCOC(=O)[C@@H](c1ccccc1)[N@H+](C)CC ZINC000181147034 642842998 /nfs/dbraw/zinc/84/29/98/642842998.db2.gz QSURVBGWVVHTOW-CQSZACIVSA-N 1 2 245.322 2.246 20 0 BEADLO C#C[C@H](C)OC(=O)[C@H](c1ccccc1)[N@@H+](C)CC ZINC000181165664 642846096 /nfs/dbraw/zinc/84/60/96/642846096.db2.gz MXSLMBDURDGBNC-JSGCOSHPSA-N 1 2 245.322 2.244 20 0 BEADLO C#C[C@H](C)OC(=O)[C@H](c1ccccc1)[N@H+](C)CC ZINC000181165664 642846099 /nfs/dbraw/zinc/84/60/99/642846099.db2.gz MXSLMBDURDGBNC-JSGCOSHPSA-N 1 2 245.322 2.244 20 0 BEADLO C=C(C)C[N@@H+](C)Cc1c(C)nn(C)c1Cl ZINC000181289362 642859972 /nfs/dbraw/zinc/85/99/72/642859972.db2.gz SIULLJNNRMIKIV-UHFFFAOYSA-N 1 2 227.739 2.390 20 0 BEADLO C=C(C)C[N@H+](C)Cc1c(C)nn(C)c1Cl ZINC000181289362 642859979 /nfs/dbraw/zinc/85/99/79/642859979.db2.gz SIULLJNNRMIKIV-UHFFFAOYSA-N 1 2 227.739 2.390 20 0 BEADLO CC(C)COC(=O)C[N@@H+]1CCS[C@H](C)[C@@H]1C ZINC000181461248 642873906 /nfs/dbraw/zinc/87/39/06/642873906.db2.gz YEQPWAJMOSKYJX-WDEREUQCSA-N 1 2 245.388 2.011 20 0 BEADLO CC(C)COC(=O)C[N@H+]1CCS[C@H](C)[C@@H]1C ZINC000181461248 642873910 /nfs/dbraw/zinc/87/39/10/642873910.db2.gz YEQPWAJMOSKYJX-WDEREUQCSA-N 1 2 245.388 2.011 20 0 BEADLO CCCCOC(=O)C[NH+]1C[C@H](C)S[C@@H](C)C1 ZINC000069908808 642933019 /nfs/dbraw/zinc/93/30/19/642933019.db2.gz SSICTKUBDQZWFX-QWRGUYRKSA-N 1 2 245.388 2.156 20 0 BEADLO CC(C)COC(=O)[C@@H](c1ccccc1)[NH+](C)C ZINC000181983137 642937959 /nfs/dbraw/zinc/93/79/59/642937959.db2.gz BCOWKXNEYPWJOV-CYBMUJFWSA-N 1 2 235.327 2.489 20 0 BEADLO C[C@H]1CC[N@H+](Cc2ncccc2Cl)CCO1 ZINC000932337008 643129532 /nfs/dbraw/zinc/12/95/32/643129532.db2.gz URLATAJNIBJHFS-JTQLQIEISA-N 1 2 240.734 2.346 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2ncccc2Cl)CCO1 ZINC000932337008 643129541 /nfs/dbraw/zinc/12/95/41/643129541.db2.gz URLATAJNIBJHFS-JTQLQIEISA-N 1 2 240.734 2.346 20 0 BEADLO CC[N@H+](CCC#N)C[C@@H](O)c1cccc(F)c1 ZINC000081514142 643230217 /nfs/dbraw/zinc/23/02/17/643230217.db2.gz QOPYBUCENOFAAO-CYBMUJFWSA-N 1 2 236.290 2.095 20 0 BEADLO CC[N@@H+](CCC#N)C[C@@H](O)c1cccc(F)c1 ZINC000081514142 643230222 /nfs/dbraw/zinc/23/02/22/643230222.db2.gz QOPYBUCENOFAAO-CYBMUJFWSA-N 1 2 236.290 2.095 20 0 BEADLO OCCCCCC[N@H+](CC(F)F)C1CC1 ZINC000175770928 643232221 /nfs/dbraw/zinc/23/22/21/643232221.db2.gz UPBMTMYZEHICQI-UHFFFAOYSA-N 1 2 221.291 2.269 20 0 BEADLO OCCCCCC[N@@H+](CC(F)F)C1CC1 ZINC000175770928 643232228 /nfs/dbraw/zinc/23/22/28/643232228.db2.gz UPBMTMYZEHICQI-UHFFFAOYSA-N 1 2 221.291 2.269 20 0 BEADLO COC(=O)[C@H]([NH2+]CCc1cccs1)C(C)C ZINC000082602228 643353335 /nfs/dbraw/zinc/35/33/35/643353335.db2.gz JAGRCHPHJWOJGX-LLVKDONJSA-N 1 2 241.356 2.078 20 0 BEADLO C/C=C/C=C\C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000733872300 643476609 /nfs/dbraw/zinc/47/66/09/643476609.db2.gz LVPSUDDIJAQUEX-IAROGAJJSA-N 1 2 227.267 2.405 20 0 BEADLO O=C(C=C1CCCCC1)N1CC(n2cc[nH+]c2)C1 ZINC000733984540 643485774 /nfs/dbraw/zinc/48/57/74/643485774.db2.gz YNKKYROVFXIZMZ-UHFFFAOYSA-N 1 2 245.326 2.157 20 0 BEADLO Cc1nn(C)c(C[NH2+]Cc2ccco2)c1Cl ZINC000084270378 643655726 /nfs/dbraw/zinc/65/57/26/643655726.db2.gz NJXIKKXKOVCNAA-UHFFFAOYSA-N 1 2 239.706 2.265 20 0 BEADLO C[C@H]1Cc2cc(C[NH2+]C(CF)CF)ccc2O1 ZINC000922153951 643874384 /nfs/dbraw/zinc/87/43/84/643874384.db2.gz GFISGEGSCPTMLQ-VIFPVBQESA-N 1 2 241.281 2.407 20 0 BEADLO Cc1cc(C(=O)OCc2c[nH+]cn2C)ccc1F ZINC000085987612 643881481 /nfs/dbraw/zinc/88/14/81/643881481.db2.gz IKYBMBCZHVGNHK-UHFFFAOYSA-N 1 2 248.257 2.225 20 0 BEADLO CCCCCC(=O)OCc1ccc[nH+]c1N ZINC000922173915 643891205 /nfs/dbraw/zinc/89/12/05/643891205.db2.gz NRRCNMFHYKXSHZ-UHFFFAOYSA-N 1 2 222.288 2.287 20 0 BEADLO C[C@@H](CC(=O)OCc1ccc(N)[nH+]c1)C1CC1 ZINC000922386924 643985162 /nfs/dbraw/zinc/98/51/62/643985162.db2.gz RFTGPXTTWCRAEI-VIFPVBQESA-N 1 2 234.299 2.143 20 0 BEADLO C[C@@H](C(=O)OCc1ccc(N)[nH+]c1)C(C)(C)C ZINC000922461771 643998535 /nfs/dbraw/zinc/99/85/35/643998535.db2.gz MQUPHHBSJNWUNH-VIFPVBQESA-N 1 2 236.315 2.389 20 0 BEADLO Nc1[nH+]cccc1COC(=O)[C@H]1CC12CCCC2 ZINC000922508428 644006025 /nfs/dbraw/zinc/00/60/25/644006025.db2.gz SWDZSRONYPRXMO-LLVKDONJSA-N 1 2 246.310 2.287 20 0 BEADLO c1cnc([C@H]([NH2+]Cc2ccncc2)C2CC2)nc1 ZINC000922583942 644033890 /nfs/dbraw/zinc/03/38/90/644033890.db2.gz XUHYBOUPKPRXFX-CYBMUJFWSA-N 1 2 240.310 2.113 20 0 BEADLO c1cc(C[NH2+][C@@H](c2ccccn2)C2CC2)n[nH]1 ZINC000922587298 644036289 /nfs/dbraw/zinc/03/62/89/644036289.db2.gz YMUVXYMSKIUKKV-CYBMUJFWSA-N 1 2 228.299 2.046 20 0 BEADLO CC/C(C)=C(\C)C(=O)OCc1ccc(N)[nH+]c1 ZINC000922594319 644037167 /nfs/dbraw/zinc/03/71/67/644037167.db2.gz XBQRUICRJCSBDX-MDZDMXLPSA-N 1 2 234.299 2.453 20 0 BEADLO C[C@H]1CCC[C@@H]1C(=O)OCc1ccc[nH+]c1N ZINC000922605007 644041460 /nfs/dbraw/zinc/04/14/60/644041460.db2.gz DTFFARUVJMAHQU-ONGXEEELSA-N 1 2 234.299 2.143 20 0 BEADLO Nc1[nH+]cccc1COC(=O)C[C@@H]1C=CCCC1 ZINC000922623786 644042487 /nfs/dbraw/zinc/04/24/87/644042487.db2.gz YHQQHNGYFUJYDG-LLVKDONJSA-N 1 2 246.310 2.453 20 0 BEADLO CC(C)(C(=O)OCc1ccc(N)[nH+]c1)C1CC1 ZINC000922733626 644083197 /nfs/dbraw/zinc/08/31/97/644083197.db2.gz UCBUDZYPCJZKAS-UHFFFAOYSA-N 1 2 234.299 2.143 20 0 BEADLO CC/C(C)=C\C(=O)OCc1ccc[nH+]c1N ZINC000922777727 644092144 /nfs/dbraw/zinc/09/21/44/644092144.db2.gz ZQWFRHJXOIXHLI-CLFYSBASSA-N 1 2 220.272 2.063 20 0 BEADLO Nc1ccc(COC(=O)C[C@@H]2CC[C@@H]3C[C@@H]32)c[nH+]1 ZINC000922779414 644094483 /nfs/dbraw/zinc/09/44/83/644094483.db2.gz WIKRETLJHBEMPE-WOPDTQHZSA-N 1 2 246.310 2.143 20 0 BEADLO Nc1ccc(COC(=O)C2CC3(CCC3)C2)c[nH+]1 ZINC000922834836 644113566 /nfs/dbraw/zinc/11/35/66/644113566.db2.gz QMXWPBHCIQVPRZ-UHFFFAOYSA-N 1 2 246.310 2.287 20 0 BEADLO CC1(C)CC[C@@H]1C(=O)OCc1ccc(N)[nH+]c1 ZINC000922866185 644120986 /nfs/dbraw/zinc/12/09/86/644120986.db2.gz LYLOIZIURVURBY-SNVBAGLBSA-N 1 2 234.299 2.143 20 0 BEADLO Cn1c[nH+]cc1CC(=O)NC1CCCCCCC1 ZINC000186777944 644144754 /nfs/dbraw/zinc/14/47/54/644144754.db2.gz AECGPXQSOWTDBT-UHFFFAOYSA-N 1 2 249.358 2.192 20 0 BEADLO CC[C@H](C)[C@H](C(=O)OC)[N@H+](C)Cc1ccoc1 ZINC000929328124 644146014 /nfs/dbraw/zinc/14/60/14/644146014.db2.gz OIEHJHAUAFRCAX-CMPLNLGQSA-N 1 2 239.315 2.299 20 0 BEADLO CC[C@H](C)[C@H](C(=O)OC)[N@@H+](C)Cc1ccoc1 ZINC000929328124 644146022 /nfs/dbraw/zinc/14/60/22/644146022.db2.gz OIEHJHAUAFRCAX-CMPLNLGQSA-N 1 2 239.315 2.299 20 0 BEADLO Nc1[nH+]cccc1COC(=O)[C@H]1CCCC12CC2 ZINC000922899645 644185878 /nfs/dbraw/zinc/18/58/78/644185878.db2.gz ZNZCFIWCLPOHIV-LLVKDONJSA-N 1 2 246.310 2.287 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)C1(C2CC2)CCC1 ZINC000923337382 644359121 /nfs/dbraw/zinc/35/91/21/644359121.db2.gz LKPQGCLYFKXRIT-UHFFFAOYSA-N 1 2 248.326 2.397 20 0 BEADLO C[C@H]1CC[N@H+](Cn2ncsc2=S)[C@H]1C ZINC000247094825 644622577 /nfs/dbraw/zinc/62/25/77/644622577.db2.gz VXEFICNLXFNHIZ-YUMQZZPRSA-N 1 2 229.374 2.362 20 0 BEADLO C[C@H]1CC[N@@H+](Cn2ncsc2=S)[C@H]1C ZINC000247094825 644622582 /nfs/dbraw/zinc/62/25/82/644622582.db2.gz VXEFICNLXFNHIZ-YUMQZZPRSA-N 1 2 229.374 2.362 20 0 BEADLO CC/C(C)=C(\C)C(=O)N[C@@H]1CCn2cc[nH+]c2C1 ZINC000779214998 644711015 /nfs/dbraw/zinc/71/10/15/644711015.db2.gz IVIQBVWMZXMDKA-HCRIHEDKSA-N 1 2 247.342 2.061 20 0 BEADLO CCC(C)=C(C)C(=O)Nc1cc[nH+]c(C)c1 ZINC000780016557 644723783 /nfs/dbraw/zinc/72/37/83/644723783.db2.gz NECYOYHGCWAJNM-PKNBQFBNSA-N 1 2 218.300 2.497 20 0 BEADLO CC(C)[C@H](C)C(=O)OCCCn1cc[nH+]c1 ZINC000783666684 644758380 /nfs/dbraw/zinc/75/83/80/644758380.db2.gz BEMMCGLWLWKTFO-NSHDSACASA-N 1 2 224.304 2.109 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)CCC1CCC1 ZINC000793241599 644801340 /nfs/dbraw/zinc/80/13/40/644801340.db2.gz KHWVOCKCENQMMA-UHFFFAOYSA-N 1 2 236.315 2.086 20 0 BEADLO c1cc(C[N@@H+]2C[C@@]3(CCCO3)[C@@H]2C2CC2)co1 ZINC000816666347 644964367 /nfs/dbraw/zinc/96/43/67/644964367.db2.gz KZTVULJCERUSEI-KBPBESRZSA-N 1 2 233.311 2.423 20 0 BEADLO c1cc(C[N@H+]2C[C@@]3(CCCO3)[C@@H]2C2CC2)co1 ZINC000816666347 644964373 /nfs/dbraw/zinc/96/43/73/644964373.db2.gz KZTVULJCERUSEI-KBPBESRZSA-N 1 2 233.311 2.423 20 0 BEADLO C/C=C(\C)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000817459025 644983082 /nfs/dbraw/zinc/98/30/82/644983082.db2.gz PBRMURWAVGBVDM-WEVVVXLNSA-N 1 2 218.300 2.281 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NCCC[C@@H]1C=CCC1 ZINC000834326121 645138392 /nfs/dbraw/zinc/13/83/92/645138392.db2.gz BTMPAQCWXUEUKT-GFCCVEGCSA-N 1 2 247.342 2.123 20 0 BEADLO CCCc1ncc(C[NH2+][C@@H](C)c2ccnnc2)o1 ZINC000926536700 645262526 /nfs/dbraw/zinc/26/25/26/645262526.db2.gz HDKQAKFGCULKOS-JTQLQIEISA-N 1 2 246.314 2.268 20 0 BEADLO CC(C)COC(=O)C[NH2+]C1(C2CCC2)CC1 ZINC000844419108 645329771 /nfs/dbraw/zinc/32/97/71/645329771.db2.gz VZHYQPPYYWTGOY-UHFFFAOYSA-N 1 2 225.332 2.108 20 0 BEADLO C[C@H]([NH2+][C@@H](C)C(F)F)c1cc[nH]c(=O)c1 ZINC000926864048 645462930 /nfs/dbraw/zinc/46/29/30/645462930.db2.gz FUSBKMXILXHFMA-BQBZGAKWSA-N 1 2 216.231 2.091 20 0 BEADLO CC(C)[C@@H]([NH2+][C@H](C)c1ncco1)c1cnn(C)c1 ZINC000927072961 645534286 /nfs/dbraw/zinc/53/42/86/645534286.db2.gz ZUFNKYPGAIXRLI-ZYHUDNBSSA-N 1 2 248.330 2.456 20 0 BEADLO Cc1cc(F)cc(NC(=O)Cc2[nH]cc[nH+]2)c1 ZINC000857474717 645572290 /nfs/dbraw/zinc/57/22/90/645572290.db2.gz NNWLFWQWIFPTJF-UHFFFAOYSA-N 1 2 233.246 2.038 20 0 BEADLO CCC(CC)[C@@H](C)C(=O)NCc1ccc(N)[nH+]c1 ZINC000927777847 645656366 /nfs/dbraw/zinc/65/63/66/645656366.db2.gz PGDULCCROKLADZ-SNVBAGLBSA-N 1 2 249.358 2.352 20 0 BEADLO Nc1ccc(CNC(=O)C[C@@H]2CC=CCC2)c[nH+]1 ZINC000927778743 645656494 /nfs/dbraw/zinc/65/64/94/645656494.db2.gz ZNVMUUYIRMHGNJ-LLVKDONJSA-N 1 2 245.326 2.026 20 0 BEADLO C/C(=C\C(=O)NCc1ccc(N)[nH+]c1)C(C)(C)C ZINC000927780801 645658711 /nfs/dbraw/zinc/65/87/11/645658711.db2.gz NSTFXPBGMWNJHV-JXMROGBWSA-N 1 2 247.342 2.272 20 0 BEADLO F[C@@H]1CC[N@H+](CCSC(F)(F)F)C1 ZINC000886222855 645883759 /nfs/dbraw/zinc/88/37/59/645883759.db2.gz CACYIUMKMWHBEH-ZCFIWIBFSA-N 1 2 217.231 2.283 20 0 BEADLO F[C@@H]1CC[N@@H+](CCSC(F)(F)F)C1 ZINC000886222855 645883761 /nfs/dbraw/zinc/88/37/61/645883761.db2.gz CACYIUMKMWHBEH-ZCFIWIBFSA-N 1 2 217.231 2.283 20 0 BEADLO Cc1cc(N2CCC[C@H]2CO)nc(C2CCC2)[nH+]1 ZINC000929084809 645933328 /nfs/dbraw/zinc/93/33/28/645933328.db2.gz NDCHMSRRWNUESA-LBPRGKRZSA-N 1 2 247.342 2.014 20 0 BEADLO C[C@H](c1ccc(F)nc1)[N@@H+]1CCOC(C)(C)C1 ZINC000929118842 645954024 /nfs/dbraw/zinc/95/40/24/645954024.db2.gz UGICHJGHRPQSGS-SNVBAGLBSA-N 1 2 238.306 2.393 20 0 BEADLO C[C@H](c1ccc(F)nc1)[N@H+]1CCOC(C)(C)C1 ZINC000929118842 645954029 /nfs/dbraw/zinc/95/40/29/645954029.db2.gz UGICHJGHRPQSGS-SNVBAGLBSA-N 1 2 238.306 2.393 20 0 BEADLO C[C@@H]1C[C@H]1c1noc([C@@H]2C[C@H]2c2c[nH]c[nH+]2)n1 ZINC000923924316 645963408 /nfs/dbraw/zinc/96/34/08/645963408.db2.gz ZSIUPWXEBMBADY-FNCVBFRFSA-N 1 2 230.271 2.187 20 0 BEADLO COc1cccc(C[NH2+][C@H](C)c2nonc2C)c1 ZINC000924563086 646069132 /nfs/dbraw/zinc/06/91/32/646069132.db2.gz FDOKCBURLFGAFB-SECBINFHSA-N 1 2 247.298 2.237 20 0 BEADLO CCC1CC[NH+](Cc2nncs2)CC1 ZINC000929297397 646071052 /nfs/dbraw/zinc/07/10/52/646071052.db2.gz HWIOVQZLJSTUTB-UHFFFAOYSA-N 1 2 211.334 2.160 20 0 BEADLO Cc1csc(C[NH2+][C@@H](C)c2ccnnc2)n1 ZINC000924617144 646078804 /nfs/dbraw/zinc/07/88/04/646078804.db2.gz XNFIYJVBKUOUMZ-VIFPVBQESA-N 1 2 234.328 2.092 20 0 BEADLO C[C@@H](c1ncccn1)[N@H+](C)C[C@@H]1CCCCO1 ZINC000929331341 646084201 /nfs/dbraw/zinc/08/42/01/646084201.db2.gz WQDUXVLFMKRKCP-RYUDHWBXSA-N 1 2 235.331 2.039 20 0 BEADLO C[C@@H](c1ncccn1)[N@@H+](C)C[C@@H]1CCCCO1 ZINC000929331341 646084205 /nfs/dbraw/zinc/08/42/05/646084205.db2.gz WQDUXVLFMKRKCP-RYUDHWBXSA-N 1 2 235.331 2.039 20 0 BEADLO C[C@@H](c1ncccn1)[N@H+](C)C[C@H]1CCCCO1 ZINC000929331340 646085046 /nfs/dbraw/zinc/08/50/46/646085046.db2.gz WQDUXVLFMKRKCP-NWDGAFQWSA-N 1 2 235.331 2.039 20 0 BEADLO C[C@@H](c1ncccn1)[N@@H+](C)C[C@H]1CCCCO1 ZINC000929331340 646085052 /nfs/dbraw/zinc/08/50/52/646085052.db2.gz WQDUXVLFMKRKCP-NWDGAFQWSA-N 1 2 235.331 2.039 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@@H](C)OC(C)(C)C2)o1 ZINC000929347447 646091547 /nfs/dbraw/zinc/09/15/47/646091547.db2.gz GLIVWLZDBCUNJI-SNVBAGLBSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@@H](C)OC(C)(C)C2)o1 ZINC000929347447 646091554 /nfs/dbraw/zinc/09/15/54/646091554.db2.gz GLIVWLZDBCUNJI-SNVBAGLBSA-N 1 2 238.331 2.236 20 0 BEADLO COc1cc([C@H](C)[NH2+]Cc2cccc(C)n2)on1 ZINC000924723937 646095481 /nfs/dbraw/zinc/09/54/81/646095481.db2.gz PMJYKYDFGBDTQU-JTQLQIEISA-N 1 2 247.298 2.237 20 0 BEADLO CCn1nc(C)c([C@@H](C)[NH2+]Cc2ccoc2C)n1 ZINC000924826932 646114754 /nfs/dbraw/zinc/11/47/54/646114754.db2.gz RFEZHQDSVHMIPA-SECBINFHSA-N 1 2 248.330 2.359 20 0 BEADLO COc1cc([C@@H](C)[NH2+]Cc2cccc(O)c2)on1 ZINC000924901496 646128892 /nfs/dbraw/zinc/12/88/92/646128892.db2.gz XMFJNWDUGQMZJM-SECBINFHSA-N 1 2 248.282 2.240 20 0 BEADLO C[C@H](NCc1cn2c([nH+]1)CCCC2)c1ncco1 ZINC000924915101 646132142 /nfs/dbraw/zinc/13/21/42/646132142.db2.gz NKBMVCVVWVOWOT-JTQLQIEISA-N 1 2 246.314 2.058 20 0 BEADLO C[C@H]([NH2+][C@H](CCO)c1ccccc1)c1ncco1 ZINC000925132972 646192074 /nfs/dbraw/zinc/19/20/74/646192074.db2.gz NECRRRJLXDQEBY-WCQYABFASA-N 1 2 246.310 2.449 20 0 BEADLO COc1nnc(C[N@H+]2[C@H](C)CCC[C@@H]2C)s1 ZINC000929604931 646195690 /nfs/dbraw/zinc/19/56/90/646195690.db2.gz NYFXOMYBUNOQOY-DTORHVGOSA-N 1 2 241.360 2.310 20 0 BEADLO COc1nnc(C[N@@H+]2[C@H](C)CCC[C@@H]2C)s1 ZINC000929604931 646195695 /nfs/dbraw/zinc/19/56/95/646195695.db2.gz NYFXOMYBUNOQOY-DTORHVGOSA-N 1 2 241.360 2.310 20 0 BEADLO CCc1cnc(C[NH2+][C@@H](C)c2ccnnc2)s1 ZINC000925162135 646196520 /nfs/dbraw/zinc/19/65/20/646196520.db2.gz FMYRBYKNCDAXKT-VIFPVBQESA-N 1 2 248.355 2.346 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)C[C@@H]1CCCC2(CCC2)O1 ZINC000929624120 646206227 /nfs/dbraw/zinc/20/62/27/646206227.db2.gz HGCVZLFSTDMMRZ-ZDUSSCGKSA-N 1 2 249.358 2.333 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)C[C@@H]1CCCC2(CCC2)O1 ZINC000929624120 646206235 /nfs/dbraw/zinc/20/62/35/646206235.db2.gz HGCVZLFSTDMMRZ-ZDUSSCGKSA-N 1 2 249.358 2.333 20 0 BEADLO CCc1onc(C)c1C[N@H+]1CCOC[C@@H]1CC ZINC000929659370 646230192 /nfs/dbraw/zinc/23/01/92/646230192.db2.gz HMYGYJSTRNNAGA-NSHDSACASA-N 1 2 238.331 2.156 20 0 BEADLO CCc1onc(C)c1C[N@@H+]1CCOC[C@@H]1CC ZINC000929659370 646230198 /nfs/dbraw/zinc/23/01/98/646230198.db2.gz HMYGYJSTRNNAGA-NSHDSACASA-N 1 2 238.331 2.156 20 0 BEADLO COc1nnc(C[N@@H+]2CCC[C@H](C)[C@@H]2C)s1 ZINC000929703373 646259019 /nfs/dbraw/zinc/25/90/19/646259019.db2.gz MEIXGXWYONVYCK-IUCAKERBSA-N 1 2 241.360 2.167 20 0 BEADLO COc1nnc(C[N@H+]2CCC[C@H](C)[C@@H]2C)s1 ZINC000929703373 646259027 /nfs/dbraw/zinc/25/90/27/646259027.db2.gz MEIXGXWYONVYCK-IUCAKERBSA-N 1 2 241.360 2.167 20 0 BEADLO COc1nnc(C[N@@H+]2C[C@H](C)CC[C@H]2C)s1 ZINC000929756628 646287945 /nfs/dbraw/zinc/28/79/45/646287945.db2.gz IHKHEHDYBICYDS-RKDXNWHRSA-N 1 2 241.360 2.167 20 0 BEADLO COc1nnc(C[N@H+]2C[C@H](C)CC[C@H]2C)s1 ZINC000929756628 646287951 /nfs/dbraw/zinc/28/79/51/646287951.db2.gz IHKHEHDYBICYDS-RKDXNWHRSA-N 1 2 241.360 2.167 20 0 BEADLO COC/C(C)=C\C[N@H+](C)Cc1nccs1 ZINC000929767413 646296629 /nfs/dbraw/zinc/29/66/29/646296629.db2.gz DZYMSJSCVLYXBU-WMZJFQQLSA-N 1 2 226.345 2.168 20 0 BEADLO COC/C(C)=C\C[N@@H+](C)Cc1nccs1 ZINC000929767413 646296632 /nfs/dbraw/zinc/29/66/32/646296632.db2.gz DZYMSJSCVLYXBU-WMZJFQQLSA-N 1 2 226.345 2.168 20 0 BEADLO CCc1onc(C)c1C[N@@H+]1CCO[C@H](C)[C@@H]1C ZINC000929848137 646358876 /nfs/dbraw/zinc/35/88/76/646358876.db2.gz QTLGGVJQLMSOSL-WDEREUQCSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1onc(C)c1C[N@H+]1CCO[C@H](C)[C@@H]1C ZINC000929848137 646358878 /nfs/dbraw/zinc/35/88/78/646358878.db2.gz QTLGGVJQLMSOSL-WDEREUQCSA-N 1 2 238.331 2.155 20 0 BEADLO CCC(C)(C)[N@H+](C)Cc1nnc(OC)s1 ZINC000929979128 646383925 /nfs/dbraw/zinc/38/39/25/646383925.db2.gz KJCYXYMRBRJKOX-UHFFFAOYSA-N 1 2 229.349 2.167 20 0 BEADLO CCC(C)(C)[N@@H+](C)Cc1nnc(OC)s1 ZINC000929979128 646383929 /nfs/dbraw/zinc/38/39/29/646383929.db2.gz KJCYXYMRBRJKOX-UHFFFAOYSA-N 1 2 229.349 2.167 20 0 BEADLO FCc1ccccc1C[N@@H+]1CCc2c[nH]nc2C1 ZINC000930067818 646417318 /nfs/dbraw/zinc/41/73/18/646417318.db2.gz ASYLYJCEQIFIAJ-UHFFFAOYSA-N 1 2 245.301 2.438 20 0 BEADLO FCc1ccccc1C[N@H+]1CCc2c[nH]nc2C1 ZINC000930067818 646417320 /nfs/dbraw/zinc/41/73/20/646417320.db2.gz ASYLYJCEQIFIAJ-UHFFFAOYSA-N 1 2 245.301 2.438 20 0 BEADLO C[C@@H](c1ccc(F)nc1)[N@@H+]1CCc2c[nH]nc2C1 ZINC000930068971 646420412 /nfs/dbraw/zinc/42/04/12/646420412.db2.gz MQQUUMVPGYPZKF-VIFPVBQESA-N 1 2 246.289 2.063 20 0 BEADLO C[C@@H](c1ccc(F)nc1)[N@H+]1CCc2c[nH]nc2C1 ZINC000930068971 646420416 /nfs/dbraw/zinc/42/04/16/646420416.db2.gz MQQUUMVPGYPZKF-VIFPVBQESA-N 1 2 246.289 2.063 20 0 BEADLO Cc1ncc(C[NH+]2CC3(C2)CC(F)(F)C3)o1 ZINC000930124640 646447987 /nfs/dbraw/zinc/44/79/87/646447987.db2.gz ADWKJWVALZUZIS-UHFFFAOYSA-N 1 2 228.242 2.214 20 0 BEADLO CCOCC[N@H+](C)Cc1coc(C(C)(C)C)n1 ZINC000930176873 646480420 /nfs/dbraw/zinc/48/04/20/646480420.db2.gz XKXJNJVDRCHYSX-UHFFFAOYSA-N 1 2 240.347 2.440 20 0 BEADLO CCOCC[N@@H+](C)Cc1coc(C(C)(C)C)n1 ZINC000930176873 646480422 /nfs/dbraw/zinc/48/04/22/646480422.db2.gz XKXJNJVDRCHYSX-UHFFFAOYSA-N 1 2 240.347 2.440 20 0 BEADLO COc1ccc([C@H](C)[NH2+]Cc2nncs2)cc1 ZINC000930189598 646484418 /nfs/dbraw/zinc/48/44/18/646484418.db2.gz JZLDCSLIOYZOHC-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO C[C@H]([NH2+]CC(C)(F)F)c1cc[nH]c(=O)c1 ZINC000926485289 646658094 /nfs/dbraw/zinc/65/80/94/646658094.db2.gz DEJPDAZMJCAXDM-ZETCQYMHSA-N 1 2 216.231 2.093 20 0 BEADLO Cc1cc(F)ccc1NC(=O)C[C@H]([NH3+])C(F)F ZINC000724737377 711609855 /nfs/dbraw/zinc/60/98/55/711609855.db2.gz BHXQATJVJCPYEO-QMMMGPOBSA-N 1 2 246.232 2.055 20 0 BEADLO [NH3+][C@H](CC(=O)Nc1ccc(Cl)cc1)C(F)F ZINC000724738602 711610110 /nfs/dbraw/zinc/61/01/10/711610110.db2.gz IDZOUPATOIAHLD-MRVPVSSYSA-N 1 2 248.660 2.261 20 0 BEADLO Fc1ccc(C[NH+]2CCC(F)(F)CC2)cn1 ZINC000725377915 712374010 /nfs/dbraw/zinc/37/40/10/712374010.db2.gz GWNBTFIHEYDQDP-UHFFFAOYSA-N 1 2 230.233 2.452 20 0 BEADLO C[N@H+](C/C(Cl)=C\Cl)C1(CO)CCC1 ZINC000379390970 712381391 /nfs/dbraw/zinc/38/13/91/712381391.db2.gz VTJLQCBQKVDMBH-VMPITWQZSA-N 1 2 224.131 2.152 20 0 BEADLO C[N@@H+](C/C(Cl)=C\Cl)C1(CO)CCC1 ZINC000379390970 712381393 /nfs/dbraw/zinc/38/13/93/712381393.db2.gz VTJLQCBQKVDMBH-VMPITWQZSA-N 1 2 224.131 2.152 20 0 BEADLO Cc1nc(NC[C@@H]2C[C@@H]2[C@@H]2C[C@@H]2C)cc[nH+]1 ZINC000716591639 712564533 /nfs/dbraw/zinc/56/45/33/712564533.db2.gz LNUYBWXFEDNNGG-IXLVHKGHSA-N 1 2 217.316 2.489 20 0 BEADLO Cc1coc(C[NH2+]Cc2cc(C)no2)c1 ZINC000718134373 712747363 /nfs/dbraw/zinc/74/73/63/712747363.db2.gz MJLWCGCMOZJALQ-UHFFFAOYSA-N 1 2 206.245 2.174 20 0 BEADLO COCC(C)(C)CCNc1cc[nH+]c(C)n1 ZINC000718763183 712781488 /nfs/dbraw/zinc/78/14/88/712781488.db2.gz AKKHSTQWZAWOEB-UHFFFAOYSA-N 1 2 223.320 2.260 20 0 BEADLO Cc1cc(C[NH2+]Cc2cocn2)cc(Cl)n1 ZINC000381358738 710627704 /nfs/dbraw/zinc/62/77/04/710627704.db2.gz FADUAHIKNWXWFP-UHFFFAOYSA-N 1 2 237.690 2.321 20 0 BEADLO Cc1cncc([C@H](C)[NH2+]Cc2ccon2)c1 ZINC000381526075 710651882 /nfs/dbraw/zinc/65/18/82/710651882.db2.gz WSFKGOALOQPFLK-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO CCCC[C@H]([NH2+][C@@H]1CC12CCC2)C(=O)OC ZINC000721223271 712899453 /nfs/dbraw/zinc/89/94/53/712899453.db2.gz UNYOMQUTYQPOHT-WDEREUQCSA-N 1 2 225.332 2.250 20 0 BEADLO [NH3+][C@H](CC(=O)NCCC1CCCCC1)C(F)F ZINC000724757472 710746296 /nfs/dbraw/zinc/74/62/96/710746296.db2.gz DEVGIXHTGWOFIG-SNVBAGLBSA-N 1 2 248.317 2.056 20 0 BEADLO Cn1c[nH+]cc1CNc1ccc([N+](=O)[O-])s1 ZINC000381862305 710757221 /nfs/dbraw/zinc/75/72/21/710757221.db2.gz WLIDTLZSJZBVST-UHFFFAOYSA-N 1 2 238.272 2.002 20 0 BEADLO COC(=O)C(C)(C)[NH2+]CCC(C)(C)SC ZINC000385205256 711007592 /nfs/dbraw/zinc/00/75/92/711007592.db2.gz HYMZJFMHRVRISG-UHFFFAOYSA-N 1 2 233.377 2.059 20 0 BEADLO CNc1cc(N(C)[C@H](C)C2(C)CC2)nc[nH+]1 ZINC000385559570 711014762 /nfs/dbraw/zinc/01/47/62/711014762.db2.gz PEVBOOWGQAYLDQ-SECBINFHSA-N 1 2 220.320 2.143 20 0 BEADLO CNc1cc(N(C)[C@H](C)C2(C)CC2)[nH+]cn1 ZINC000385559570 711014765 /nfs/dbraw/zinc/01/47/65/711014765.db2.gz PEVBOOWGQAYLDQ-SECBINFHSA-N 1 2 220.320 2.143 20 0 BEADLO Cc1ccnc(C[NH2+][C@@H](C)c2nccnc2C)c1 ZINC000385830002 711018158 /nfs/dbraw/zinc/01/81/58/711018158.db2.gz QHIXFQHWQFQBHV-LBPRGKRZSA-N 1 2 242.326 2.339 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+][C@H](C)CSC(C)(C)C ZINC000390425752 711116489 /nfs/dbraw/zinc/11/64/89/711116489.db2.gz MHAVXLGRTGFNJO-NXEZZACHSA-N 1 2 247.404 2.448 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2nccs2)n(C)n1 ZINC000381279409 710615958 /nfs/dbraw/zinc/61/59/58/710615958.db2.gz XTGZKSVFRWDCSZ-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO Cc1cc(CNc2cc[nH+]c(C)n2)cs1 ZINC000381342295 710625292 /nfs/dbraw/zinc/62/52/92/710625292.db2.gz BYMBQMRVEXIETI-UHFFFAOYSA-N 1 2 219.313 2.189 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1CCC=CO1 ZINC000381410177 710633879 /nfs/dbraw/zinc/63/38/79/710633879.db2.gz UGWRJGAFNCCJCP-SNVBAGLBSA-N 1 2 220.272 2.195 20 0 BEADLO CC(C)(NC(=O)Cc1c[nH]c[nH+]1)c1ccccc1 ZINC000900402103 710843368 /nfs/dbraw/zinc/84/33/68/710843368.db2.gz OJZBBUOGIPMEKJ-UHFFFAOYSA-N 1 2 243.310 2.004 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2cc(C)ccc2F)[nH]1 ZINC000392442108 711147082 /nfs/dbraw/zinc/14/70/82/711147082.db2.gz BFJTZIRYJODRGG-SECBINFHSA-N 1 2 248.305 2.411 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2ccccc2F)[nH]1 ZINC000392471101 711149274 /nfs/dbraw/zinc/14/92/74/711149274.db2.gz UDOLSNUBLXYYNI-QMMMGPOBSA-N 1 2 234.278 2.103 20 0 BEADLO Cc1cc(C)c(CNc2ccc(Cl)nn2)c[nH+]1 ZINC000396960872 711374493 /nfs/dbraw/zinc/37/44/93/711374493.db2.gz BPDCZYNNOUZMQC-UHFFFAOYSA-N 1 2 248.717 2.176 20 0 BEADLO FC(F)(F)[C@@H]1CCC[C@H]([NH2+]Cc2c[nH]nn2)C1 ZINC000398352366 711407526 /nfs/dbraw/zinc/40/75/26/711407526.db2.gz GDJDYFURTRJVMM-SFYZADRCSA-N 1 2 248.252 2.015 20 0 BEADLO FC(F)(F)[C@@H]1CCC[C@H]([NH2+]Cc2cn[nH]n2)C1 ZINC000398352366 711407528 /nfs/dbraw/zinc/40/75/28/711407528.db2.gz GDJDYFURTRJVMM-SFYZADRCSA-N 1 2 248.252 2.015 20 0 BEADLO OCc1cccc(Nc2[nH+]cnc3[nH]ccc32)c1 ZINC000726965505 711438950 /nfs/dbraw/zinc/43/89/50/711438950.db2.gz HSUMHHPJDMSYIO-UHFFFAOYSA-N 1 2 240.266 2.194 20 0 BEADLO Cc1cc(C[NH+]2CCOCC2)c2c(n1)CCCC2 ZINC000891390215 711509380 /nfs/dbraw/zinc/50/93/80/711509380.db2.gz LZGDBOGPWHIGFI-UHFFFAOYSA-N 1 2 246.354 2.101 20 0 BEADLO CC(C)OCCC[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000383511359 711512393 /nfs/dbraw/zinc/51/23/93/711512393.db2.gz FLTNSDRKKBCKPX-NSHDSACASA-N 1 2 245.363 2.121 20 0 BEADLO CCCCC[C@@H](C)NC(=O)C[C@H]([NH3+])C(F)F ZINC000724693120 711609272 /nfs/dbraw/zinc/60/92/72/711609272.db2.gz OLPFAJAQEWKIGP-BDAKNGLRSA-N 1 2 236.306 2.054 20 0 BEADLO Cc1nc(N[C@H](CCO)C2CCCC2)cc[nH+]1 ZINC000725035459 711645421 /nfs/dbraw/zinc/64/54/21/711645421.db2.gz BFSPQNAMYFGKKH-GFCCVEGCSA-N 1 2 235.331 2.138 20 0 BEADLO Cc1ccc(Cl)c(NCc2c[nH+]cn2C)n1 ZINC000309707657 711662683 /nfs/dbraw/zinc/66/26/83/711662683.db2.gz PGZUDUBRVULKAZ-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO CC(C)O[C@@]1(CNc2cccc[nH+]2)CCOC1 ZINC000722361645 711748953 /nfs/dbraw/zinc/74/89/53/711748953.db2.gz OMRQPNFKQZISMU-CYBMUJFWSA-N 1 2 236.315 2.078 20 0 BEADLO Cc1ncoc1C[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000894420214 711771468 /nfs/dbraw/zinc/77/14/68/711771468.db2.gz LXQACCNQJJNIIV-SCZZXKLOSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1ncoc1C[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000894420214 711771469 /nfs/dbraw/zinc/77/14/69/711771469.db2.gz LXQACCNQJJNIIV-SCZZXKLOSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1cc(C)c(C(=O)NCC(C)(C)F)c(C)[nH+]1 ZINC000913423640 711822339 /nfs/dbraw/zinc/82/23/39/711822339.db2.gz LKWAKINFTOEYCN-UHFFFAOYSA-N 1 2 238.306 2.485 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)C/C=C/Cl ZINC000046060568 711828645 /nfs/dbraw/zinc/82/86/45/711828645.db2.gz DPSVSLYRBDZMCA-SNAWJCMRSA-N 1 2 214.696 2.476 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)C/C=C/Cl ZINC000046060568 711828646 /nfs/dbraw/zinc/82/86/46/711828646.db2.gz DPSVSLYRBDZMCA-SNAWJCMRSA-N 1 2 214.696 2.476 20 0 BEADLO CCn1cc([C@H](C)[NH2+][C@@H](C)c2ncc[nH]2)cn1 ZINC000138994482 711839928 /nfs/dbraw/zinc/83/99/28/711839928.db2.gz XFDCNVKJXGBENL-UWVGGRQHSA-N 1 2 233.319 2.038 20 0 BEADLO CC(C)C1(O)C[NH+](Cc2cccc(F)c2)C1 ZINC000084376747 711924903 /nfs/dbraw/zinc/92/49/03/711924903.db2.gz JYMFGAKLIWVXSQ-UHFFFAOYSA-N 1 2 223.291 2.028 20 0 BEADLO C[C@@H](C(=O)OCc1ccc[nH+]c1N)C1CCC1 ZINC000922792461 711975918 /nfs/dbraw/zinc/97/59/18/711975918.db2.gz AKPAVJRMQVFQCK-SECBINFHSA-N 1 2 234.299 2.143 20 0 BEADLO COc1cncc(C[NH2+]Cc2csc(C)n2)c1 ZINC000700016970 711982119 /nfs/dbraw/zinc/98/21/19/711982119.db2.gz IYCHVVKETOUILW-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO COc1cncc(C[NH2+]Cc2ncc(C)s2)c1 ZINC000700024507 711983669 /nfs/dbraw/zinc/98/36/69/711983669.db2.gz PTVMCAXZIKUSFM-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO C[C@H]1O[C@@H](C)[C@@H](C)[C@@H]1[NH2+]CC(F)(F)C(F)F ZINC000701034486 712012933 /nfs/dbraw/zinc/01/29/33/712012933.db2.gz JIVGNZURDULPEI-CWKFCGSDSA-N 1 2 243.244 2.288 20 0 BEADLO C[N@H+](Cc1csc(Cl)n1)CC1(C)COC1 ZINC000702978739 712062921 /nfs/dbraw/zinc/06/29/21/712062921.db2.gz CKOUHWAWFRTZCQ-UHFFFAOYSA-N 1 2 246.763 2.265 20 0 BEADLO C[N@@H+](Cc1csc(Cl)n1)CC1(C)COC1 ZINC000702978739 712062923 /nfs/dbraw/zinc/06/29/23/712062923.db2.gz CKOUHWAWFRTZCQ-UHFFFAOYSA-N 1 2 246.763 2.265 20 0 BEADLO Cn1ncc2c1nc[nH+]c2NC[C@]1(C)CC1(C)C ZINC000705287827 712127754 /nfs/dbraw/zinc/12/77/54/712127754.db2.gz FXNQUHXIAPDPGA-ZDUSSCGKSA-N 1 2 245.330 2.211 20 0 BEADLO CCn1cc([C@@H](C)[NH2+]Cc2nocc2C)cn1 ZINC000708257240 712184885 /nfs/dbraw/zinc/18/48/85/712184885.db2.gz QCAAMYBNTKJFGK-SNVBAGLBSA-N 1 2 234.303 2.050 20 0 BEADLO Cc1conc1C[NH2+][C@@H](C)c1cncc(F)c1 ZINC000708274681 712185858 /nfs/dbraw/zinc/18/58/58/712185858.db2.gz LHXDWWDRZNDVJV-VIFPVBQESA-N 1 2 235.262 2.368 20 0 BEADLO Cc1[nH]c(CN2CC[C@@H](C(F)(F)F)C2)[nH+]c1C ZINC000709063623 712206756 /nfs/dbraw/zinc/20/67/56/712206756.db2.gz DYNQPZIWAJDXMI-SECBINFHSA-N 1 2 247.264 2.411 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cn(C)cn1)c1ccccn1 ZINC000710004719 712239693 /nfs/dbraw/zinc/23/96/93/712239693.db2.gz BMLGPVMOFDXWDV-MNOVXSKESA-N 1 2 230.315 2.227 20 0 BEADLO Cc1nc(NC[C@@H]2CCC(C)(C)CO2)cc[nH+]1 ZINC000710639405 712264804 /nfs/dbraw/zinc/26/48/04/712264804.db2.gz RABRSVXCSXROBN-NSHDSACASA-N 1 2 235.331 2.402 20 0 BEADLO CC(=O)C1CCN(c2cc[nH+]cc2F)CC1 ZINC000711078382 712278803 /nfs/dbraw/zinc/27/88/03/712278803.db2.gz JDYFUVQWINGGAA-UHFFFAOYSA-N 1 2 222.263 2.026 20 0 BEADLO Cc1nc(NC[C@@H]2CCC3(CCC3)O2)cc[nH+]1 ZINC000711439937 712300994 /nfs/dbraw/zinc/30/09/94/712300994.db2.gz ZVAZRRBRTYNSIM-NSHDSACASA-N 1 2 233.315 2.299 20 0 BEADLO O=C(C[N@H+]1CC[C@@H](CF)C1)c1ccccc1F ZINC000711454147 712303908 /nfs/dbraw/zinc/30/39/08/712303908.db2.gz WIFVUCLRAGERSA-JTQLQIEISA-N 1 2 239.265 2.300 20 0 BEADLO O=C(C[N@@H+]1CC[C@@H](CF)C1)c1ccccc1F ZINC000711454147 712303909 /nfs/dbraw/zinc/30/39/09/712303909.db2.gz WIFVUCLRAGERSA-JTQLQIEISA-N 1 2 239.265 2.300 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCn2ccnc21)c1ccco1 ZINC000379017402 712369037 /nfs/dbraw/zinc/36/90/37/712369037.db2.gz RCCINODALNBXPS-VHSXEESVSA-N 1 2 217.272 2.272 20 0 BEADLO C=C(Cl)C[N@H+]1CCC[C@@H]1C(=O)N(CC)CC ZINC000065297428 712380768 /nfs/dbraw/zinc/38/07/68/712380768.db2.gz JMUGILYWESCBCD-LLVKDONJSA-N 1 2 244.766 2.072 20 0 BEADLO C=C(Cl)C[N@@H+]1CCC[C@@H]1C(=O)N(CC)CC ZINC000065297428 712380769 /nfs/dbraw/zinc/38/07/69/712380769.db2.gz JMUGILYWESCBCD-LLVKDONJSA-N 1 2 244.766 2.072 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)[C@@H]1CC12CCC2 ZINC000760125260 712409835 /nfs/dbraw/zinc/40/98/35/712409835.db2.gz NPXSMAWMGGPKHF-JTQLQIEISA-N 1 2 241.294 2.463 20 0 BEADLO CC1(CNC(=O)c2cccc3[nH+]ccn32)CCC1 ZINC000776996601 712416009 /nfs/dbraw/zinc/41/60/09/712416009.db2.gz UKEBFGODVFPKCT-UHFFFAOYSA-N 1 2 243.310 2.254 20 0 BEADLO C=C/C=C/CC[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000713661806 712469018 /nfs/dbraw/zinc/46/90/18/712469018.db2.gz RTNYDLMQTQGBGO-WSKFYRRCSA-N 1 2 225.332 2.439 20 0 BEADLO C[C@@H]1CC[C@H](O)C[N@@H+]1Cc1scnc1Cl ZINC000713740478 712470460 /nfs/dbraw/zinc/47/04/60/712470460.db2.gz LEZOINYMHLZFOJ-SFYZADRCSA-N 1 2 246.763 2.142 20 0 BEADLO CC[NH2+]Cc1noc(C[C@H]2CCCC2(F)F)n1 ZINC000713927191 712473311 /nfs/dbraw/zinc/47/33/11/712473311.db2.gz DUVLCBXLWJYDBX-MRVPVSSYSA-N 1 2 245.273 2.157 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2CCCC[C@H]2C)n1 ZINC000714453084 712490081 /nfs/dbraw/zinc/49/00/81/712490081.db2.gz YJTQPUBRYYKZRX-NXEZZACHSA-N 1 2 223.320 2.473 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cn(C)nn1)c1ccccc1F ZINC000715876950 712538734 /nfs/dbraw/zinc/53/87/34/712538734.db2.gz JBDHLPCDLXFNRR-ZJUUUORDSA-N 1 2 248.305 2.366 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1cnccn1)c1ccns1 ZINC000716036236 712547766 /nfs/dbraw/zinc/54/77/66/712547766.db2.gz ZXYHEBNGTKPAMK-RKDXNWHRSA-N 1 2 234.328 2.345 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCn2ccnc21)c1ccns1 ZINC000715999981 712551751 /nfs/dbraw/zinc/55/17/51/712551751.db2.gz RURRSFINIQKOLT-BDAKNGLRSA-N 1 2 234.328 2.135 20 0 BEADLO Cc1[nH]nc(CNc2cc(C)cc[nH+]2)c1C ZINC000716444940 712561016 /nfs/dbraw/zinc/56/10/16/712561016.db2.gz CWCFYFYNLYEMGZ-UHFFFAOYSA-N 1 2 216.288 2.342 20 0 BEADLO CC[C@H](C[C@@H](C)O)Nc1[nH+]cccc1OC ZINC000716879623 712580116 /nfs/dbraw/zinc/58/01/16/712580116.db2.gz KXYWRDBISBWXBC-NXEZZACHSA-N 1 2 224.304 2.052 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1CC(C)(C)CO1 ZINC000717590366 712661415 /nfs/dbraw/zinc/66/14/15/712661415.db2.gz VFDWXOUVSRFSCJ-JTQLQIEISA-N 1 2 236.315 2.317 20 0 BEADLO Cc1cc(NC(=O)[C@@H](O)c2ccccc2)cc[nH+]1 ZINC000081386636 712729912 /nfs/dbraw/zinc/72/99/12/712729912.db2.gz HBJXVNZXDPFFGF-ZDUSSCGKSA-N 1 2 242.278 2.062 20 0 BEADLO Nc1ccc(CNC(=O)C2CCC=CCC2)c[nH+]1 ZINC000718087841 712742405 /nfs/dbraw/zinc/74/24/05/712742405.db2.gz HYEBIQYPIFGOCI-UHFFFAOYSA-N 1 2 245.326 2.026 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H]1CCC=CCCC1 ZINC000719042257 712794067 /nfs/dbraw/zinc/79/40/67/712794067.db2.gz UESUKSULSLNJTD-LBPRGKRZSA-N 1 2 247.342 2.471 20 0 BEADLO Cc1nc(NCc2nc3c(s2)CCC3)cc[nH+]1 ZINC000719620174 712817576 /nfs/dbraw/zinc/81/75/76/712817576.db2.gz VFKJVSNKGVITJI-UHFFFAOYSA-N 1 2 246.339 2.342 20 0 BEADLO CC(C)(O)[C@@H]1CCCN(c2cc[nH+]cc2F)C1 ZINC000719650865 712820652 /nfs/dbraw/zinc/82/06/52/712820652.db2.gz DTWJLMGCFLVUJI-SNVBAGLBSA-N 1 2 238.306 2.208 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cccnc2Cl)CCO1 ZINC000720492068 712846750 /nfs/dbraw/zinc/84/67/50/712846750.db2.gz BOCYBXUVXFANMS-SNVBAGLBSA-N 1 2 240.734 2.346 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cccnc2Cl)CCO1 ZINC000720492068 712846753 /nfs/dbraw/zinc/84/67/53/712846753.db2.gz BOCYBXUVXFANMS-SNVBAGLBSA-N 1 2 240.734 2.346 20 0 BEADLO CN(C)c1cc(N(C)C[C@@H]2CC2(C)C)[nH+]cn1 ZINC001167093366 957282175 /nfs/dbraw/zinc/28/21/75/957282175.db2.gz ZINYFSPQRJFPTC-JTQLQIEISA-N 1 2 234.347 2.025 20 0 BEADLO COC1C[NH+](Cc2cc(C)c(F)c(C)c2)C1 ZINC001143377329 957387120 /nfs/dbraw/zinc/38/71/20/957387120.db2.gz UEDWQPDVEJVGFZ-UHFFFAOYSA-N 1 2 223.291 2.273 20 0 BEADLO CC(=O)CNc1ccc([NH+](C)C)c(C)c1 ZINC001167629331 959125159 /nfs/dbraw/zinc/12/51/59/959125159.db2.gz KPABBFDONMMUEJ-UHFFFAOYSA-N 1 2 206.289 2.062 20 0 BEADLO Nc1cc(Cl)[nH+]c(N2CCC[C@H]3C[C@H]32)c1 ZINC000308973639 959553770 /nfs/dbraw/zinc/55/37/70/959553770.db2.gz FYLXVMBLXUKTKG-IONNQARKSA-N 1 2 223.707 2.306 20 0 BEADLO Cc1nc([C@H](C)[NH2+][C@H]2C=CCCC2)no1 ZINC000393743019 959893007 /nfs/dbraw/zinc/89/30/07/959893007.db2.gz LXHNDHCUAGBJKO-WPRPVWTQSA-N 1 2 207.277 2.137 20 0 BEADLO C[C@]1(F)CCC[N@H+](Cc2csnn2)CC1 ZINC001140992790 960160851 /nfs/dbraw/zinc/16/08/51/960160851.db2.gz XTRZFULPLJUHOF-JTQLQIEISA-N 1 2 229.324 2.252 20 0 BEADLO C[C@]1(F)CCC[N@@H+](Cc2csnn2)CC1 ZINC001140992790 960160867 /nfs/dbraw/zinc/16/08/67/960160867.db2.gz XTRZFULPLJUHOF-JTQLQIEISA-N 1 2 229.324 2.252 20 0 BEADLO Oc1c(F)cc(C[N@@H+]2C[C@@H]3C[C@@H]3C2)cc1F ZINC001140988415 960777908 /nfs/dbraw/zinc/77/79/08/960777908.db2.gz AFZIUTMOASPROR-DTORHVGOSA-N 1 2 225.238 2.122 20 0 BEADLO Oc1c(F)cc(C[N@H+]2C[C@@H]3C[C@@H]3C2)cc1F ZINC001140988415 960777928 /nfs/dbraw/zinc/77/79/28/960777928.db2.gz AFZIUTMOASPROR-DTORHVGOSA-N 1 2 225.238 2.122 20 0 BEADLO CCCc1cc(NC=[NH2+])nc(CCC)n1 ZINC001167864303 961328508 /nfs/dbraw/zinc/32/85/08/961328508.db2.gz FMGLWNVYMALKBY-UHFFFAOYSA-N 1 2 206.293 2.401 20 0 BEADLO Cc1nc(N2C[C@@H](C)OC[C@H]2C)c(C)c(C)[nH+]1 ZINC001155431223 963075462 /nfs/dbraw/zinc/07/54/62/963075462.db2.gz DCERPHHSFXCXNS-RKDXNWHRSA-N 1 2 235.331 2.015 20 0 BEADLO CC[C@@H](C)Nc1cc[nH+]c(OCCOC)c1 ZINC001168003955 963243803 /nfs/dbraw/zinc/24/38/03/963243803.db2.gz SECXHIYZAYQIOL-SNVBAGLBSA-N 1 2 224.304 2.317 20 0 BEADLO FC1(CNc2cccc[nH+]2)CCOCC1 ZINC001168122717 963788887 /nfs/dbraw/zinc/78/88/87/963788887.db2.gz LYAXQWZNIUUJKW-UHFFFAOYSA-N 1 2 210.252 2.012 20 0 BEADLO Nc1[nH+]c(N[C@H]2CCC[C@@H](O)C2)ccc1Cl ZINC001158371794 963857470 /nfs/dbraw/zinc/85/74/70/963857470.db2.gz AMJFROQJSVMCFN-JGVFFNPUSA-N 1 2 241.722 2.033 20 0 BEADLO COC(=O)[C@@H]1C[C@@H](F)C[N@@H+]1C1CCC(C)CC1 ZINC001168210713 963988158 /nfs/dbraw/zinc/98/81/58/963988158.db2.gz XAHPRUJURBMGHU-RSJDFQLWSA-N 1 2 243.322 2.151 20 0 BEADLO COC(=O)[C@@H]1C[C@@H](F)C[N@H+]1C1CCC(C)CC1 ZINC001168210713 963988166 /nfs/dbraw/zinc/98/81/66/963988166.db2.gz XAHPRUJURBMGHU-RSJDFQLWSA-N 1 2 243.322 2.151 20 0 BEADLO CC(C)c1ccc(N2CC[C@@](C)(O)C2)[nH+]c1 ZINC001165230342 965998261 /nfs/dbraw/zinc/99/82/61/965998261.db2.gz YARQMCMKKOTDEC-CYBMUJFWSA-N 1 2 220.316 2.166 20 0 BEADLO CCN(c1cc(C(C)C)[nH+]c(C)n1)C1COC1 ZINC001166941865 966461532 /nfs/dbraw/zinc/46/15/32/966461532.db2.gz KDLAKXUKKDRGSI-UHFFFAOYSA-N 1 2 235.331 2.134 20 0 BEADLO CCc1cn(C[C@@H]2CC[C@@H](C3CC3)O2)c[nH+]1 ZINC001166822324 966424593 /nfs/dbraw/zinc/42/45/93/966424593.db2.gz KDLIQGKWEQEJBO-STQMWFEESA-N 1 2 220.316 2.403 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)Cc1cncs1 ZINC000091812517 1165793070 /nfs/dbraw/zinc/79/30/70/1165793070.db2.gz QTZKUEJVDCCMFZ-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)Cc1cncs1 ZINC000091812517 1165793076 /nfs/dbraw/zinc/79/30/76/1165793076.db2.gz QTZKUEJVDCCMFZ-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2ccn(C)n2)c1 ZINC001203652909 966722152 /nfs/dbraw/zinc/72/21/52/966722152.db2.gz GBMCWUBBWJKLOK-UHFFFAOYSA-N 1 2 202.261 2.176 20 0 BEADLO CCCCCC[C@@H](C)[NH2+]CC(=O)OCC ZINC000037394143 1165797770 /nfs/dbraw/zinc/79/77/70/1165797770.db2.gz FSWDOCSDAMVSDR-LLVKDONJSA-N 1 2 215.337 2.498 20 0 BEADLO C[C@H]1CC(C[NH+]2CC(C)(F)C2)C[C@H](C)O1 ZINC001209381242 1165806737 /nfs/dbraw/zinc/80/67/37/1165806737.db2.gz DHIRNABGOYXMPP-UWVGGRQHSA-N 1 2 215.312 2.234 20 0 BEADLO CCc1ccc(C[N@@H+]2CCCC(=O)CC2)o1 ZINC001204390465 966988479 /nfs/dbraw/zinc/98/84/79/966988479.db2.gz FSBHNABDSVLRSO-UHFFFAOYSA-N 1 2 221.300 2.397 20 0 BEADLO CCc1ccc(C[N@H+]2CCCC(=O)CC2)o1 ZINC001204390465 966988492 /nfs/dbraw/zinc/98/84/92/966988492.db2.gz FSBHNABDSVLRSO-UHFFFAOYSA-N 1 2 221.300 2.397 20 0 BEADLO Cc1cc(CC(=O)OC(C)C)cc(C)[nH+]1 ZINC001250085664 967349620 /nfs/dbraw/zinc/34/96/20/967349620.db2.gz TYYSPHZEGIBEHA-UHFFFAOYSA-N 1 2 207.273 2.193 20 0 BEADLO Cc1[nH+]cc(Nc2ncccc2F)cc1N ZINC001210285225 1165861307 /nfs/dbraw/zinc/86/13/07/1165861307.db2.gz MIXUITWUTIHHEN-UHFFFAOYSA-N 1 2 218.235 2.250 20 0 BEADLO COc1cccnc1Nc1c[nH+]c(C)c(N)c1 ZINC001210287142 1165865018 /nfs/dbraw/zinc/86/50/18/1165865018.db2.gz MFOASQPPSRYIJD-UHFFFAOYSA-N 1 2 230.271 2.119 20 0 BEADLO O=C1CC(Nc2cc(C3CC3)[nH+]c(C3CC3)n2)C1 ZINC001167338644 1165914525 /nfs/dbraw/zinc/91/45/25/1165914525.db2.gz HAHOQINCYRHNAA-UHFFFAOYSA-N 1 2 243.310 2.375 20 0 BEADLO COc1cc2[nH]c(C[NH+](C)C)nc2cc1Cl ZINC001250565745 968081754 /nfs/dbraw/zinc/08/17/54/968081754.db2.gz QNPAYCVPEMZKOO-UHFFFAOYSA-N 1 2 239.706 2.287 20 0 BEADLO COc1ccc2[nH]c(CCSC)[nH+]c2c1 ZINC000083187437 1165930548 /nfs/dbraw/zinc/93/05/48/1165930548.db2.gz ABTQDIWUMCIUTG-UHFFFAOYSA-N 1 2 222.313 2.477 20 0 BEADLO C[C@@H](C(=O)N(C)c1ccccc1)n1cc[nH+]c1 ZINC000053898550 1165989428 /nfs/dbraw/zinc/98/94/28/1165989428.db2.gz NZHUBDNHHOKLOY-NSHDSACASA-N 1 2 229.283 2.107 20 0 BEADLO COc1cc(-c2c[nH+]cn2C)cc(OC)c1OC ZINC000147947406 1166008533 /nfs/dbraw/zinc/00/85/33/1166008533.db2.gz XUCIMCZCRLESMB-UHFFFAOYSA-N 1 2 248.282 2.113 20 0 BEADLO C[C@H]1C[NH+](Cc2c(N)cccc2F)C[C@H](C)O1 ZINC000109426981 1166013473 /nfs/dbraw/zinc/01/34/73/1166013473.db2.gz DYXIBOKHKGGMCO-UWVGGRQHSA-N 1 2 238.306 2.017 20 0 BEADLO COc1cncc(C[N@@H+]2C[C@H](F)C[C@H]2C)c1 ZINC001206989297 968529694 /nfs/dbraw/zinc/52/96/94/968529694.db2.gz MYVCXKTVLAVPQK-MWLCHTKSSA-N 1 2 224.279 2.023 20 0 BEADLO COc1cncc(C[N@H+]2C[C@H](F)C[C@H]2C)c1 ZINC001206989297 968529699 /nfs/dbraw/zinc/52/96/99/968529699.db2.gz MYVCXKTVLAVPQK-MWLCHTKSSA-N 1 2 224.279 2.023 20 0 BEADLO Cc1ncccc1C[N@@H+](C)Cc1ccno1 ZINC001207154054 968660162 /nfs/dbraw/zinc/66/01/62/968660162.db2.gz LIMKLXIXGKJFTC-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO CC(=O)OC1C[NH+](CC2CCC(F)(F)CC2)C1 ZINC001207346800 968726491 /nfs/dbraw/zinc/72/64/91/968726491.db2.gz BBBLPLUAQSZZHU-UHFFFAOYSA-N 1 2 247.285 2.059 20 0 BEADLO C[N@H+](CC(F)F)C[C@@H]1CCOC(C)(C)C1 ZINC001207372514 968746488 /nfs/dbraw/zinc/74/64/88/968746488.db2.gz TTYZBJFUAKMERZ-SECBINFHSA-N 1 2 221.291 2.389 20 0 BEADLO C[N@@H+](CC(F)F)C[C@@H]1CCOC(C)(C)C1 ZINC001207372514 968746494 /nfs/dbraw/zinc/74/64/94/968746494.db2.gz TTYZBJFUAKMERZ-SECBINFHSA-N 1 2 221.291 2.389 20 0 BEADLO Nc1cc(-c2cccc3c2OCC3)cc[nH+]1 ZINC000227663756 1166249176 /nfs/dbraw/zinc/24/91/76/1166249176.db2.gz XKOFUMIUJYXHBK-UHFFFAOYSA-N 1 2 212.252 2.266 20 0 BEADLO CCCCC[C@H](O)CNc1[nH+]cccc1O ZINC001253521532 969198911 /nfs/dbraw/zinc/19/89/11/969198911.db2.gz UPBGUDGJDFTNGZ-JTQLQIEISA-N 1 2 224.304 2.140 20 0 BEADLO CC/C=C\CC[N@@H+]1CC(F)(F)C[C@@]1(C)CO ZINC001208725546 969215013 /nfs/dbraw/zinc/21/50/13/969215013.db2.gz LIBIMVOUCBLFIX-WYGGZMRJSA-N 1 2 233.302 2.435 20 0 BEADLO CC/C=C\CC[N@H+]1CC(F)(F)C[C@@]1(C)CO ZINC001208725546 969215020 /nfs/dbraw/zinc/21/50/20/969215020.db2.gz LIBIMVOUCBLFIX-WYGGZMRJSA-N 1 2 233.302 2.435 20 0 BEADLO Clc1ccc(CC[NH+]2CC3(CCO3)C2)cc1 ZINC001208741095 969228520 /nfs/dbraw/zinc/22/85/20/969228520.db2.gz PHYGLRONTRTKIO-UHFFFAOYSA-N 1 2 237.730 2.357 20 0 BEADLO CN(CC1CCCCC1)C(=O)C[C@H]([NH3+])C(F)F ZINC000724760622 1166361796 /nfs/dbraw/zinc/36/17/96/1166361796.db2.gz ZHGLZPLQYPJHMR-JTQLQIEISA-N 1 2 248.317 2.008 20 0 BEADLO C[C@@H](COC1C[NH+](C)C1)c1ccccc1 ZINC001205999948 969410767 /nfs/dbraw/zinc/41/07/67/969410767.db2.gz JGJWGCWCEIWSGH-NSHDSACASA-N 1 2 205.301 2.121 20 0 BEADLO OC1(C(F)(F)F)C[NH+](C2CCC3(CC3)CC2)C1 ZINC001254441376 969627309 /nfs/dbraw/zinc/62/73/09/969627309.db2.gz MRICHJMSTXWXHI-UHFFFAOYSA-N 1 2 249.276 2.318 20 0 BEADLO Cc1cc(O)ccc1Nc1ccc(N)[nH+]c1 ZINC000019952315 1166652416 /nfs/dbraw/zinc/65/24/16/1166652416.db2.gz YQASYRYEMFTZOZ-UHFFFAOYSA-N 1 2 215.256 2.421 20 0 BEADLO C[C@@H](CC(F)(F)F)[N@H+](C1CC1)C1COC1 ZINC001255656020 970432025 /nfs/dbraw/zinc/43/20/25/970432025.db2.gz OVXUXDOKTJHBHX-ZETCQYMHSA-N 1 2 223.238 2.191 20 0 BEADLO C[C@@H](CC(F)(F)F)[N@@H+](C1CC1)C1COC1 ZINC001255656020 970432031 /nfs/dbraw/zinc/43/20/31/970432031.db2.gz OVXUXDOKTJHBHX-ZETCQYMHSA-N 1 2 223.238 2.191 20 0 BEADLO CC(C)(O)C=CNc1cccn2cc[nH+]c12 ZINC001203211039 1166831101 /nfs/dbraw/zinc/83/11/01/1166831101.db2.gz NLTUUGPFJDACMA-AATRIKPKSA-N 1 2 217.272 2.031 20 0 BEADLO CCSC[C@H](C)[N@@H+]1CCC[C@@H](F)C(=O)C1 ZINC001173299380 975193351 /nfs/dbraw/zinc/19/33/51/975193351.db2.gz GHCLYYIESRIWTD-VHSXEESVSA-N 1 2 233.352 2.131 20 0 BEADLO CCSC[C@H](C)[N@H+]1CCC[C@@H](F)C(=O)C1 ZINC001173299380 975193355 /nfs/dbraw/zinc/19/33/55/975193355.db2.gz GHCLYYIESRIWTD-VHSXEESVSA-N 1 2 233.352 2.131 20 0 BEADLO CCOC(=O)[C@H](CC)Oc1c(C)cc[nH+]c1C ZINC001227264352 975337943 /nfs/dbraw/zinc/33/79/43/975337943.db2.gz LRKMLHNFTUJXDE-NSHDSACASA-N 1 2 237.299 2.419 20 0 BEADLO CC[C@@H](C)Nc1ccc(CC(=O)OC)c[nH+]1 ZINC001168001198 1167139266 /nfs/dbraw/zinc/13/92/66/1167139266.db2.gz WUXZKMQMPICQCF-SECBINFHSA-N 1 2 222.288 2.008 20 0 BEADLO CC[C@H]([NH2+]CC=C(C)C)c1noc(C)n1 ZINC000308943473 1167225139 /nfs/dbraw/zinc/22/51/39/1167225139.db2.gz MWMNTHBAGIDBFN-JTQLQIEISA-N 1 2 209.293 2.385 20 0 BEADLO Cc1cnc(F)c(OC2C[NH+](C(C)(C)C)C2)c1 ZINC001228587152 976356300 /nfs/dbraw/zinc/35/63/00/976356300.db2.gz ORYPZWZSUBOCPU-UHFFFAOYSA-N 1 2 238.306 2.391 20 0 BEADLO C[C@H](C(=O)NC(C)(C)/C=C/Cl)n1cc[nH+]c1 ZINC001335323986 976962882 /nfs/dbraw/zinc/96/28/82/976962882.db2.gz LUNFLYPCLBRSHH-XNPJLODASA-N 1 2 241.722 2.091 20 0 BEADLO c1ccn(-c2ccc[nH+]c2NC2CSC2)c1 ZINC001168359796 1167539524 /nfs/dbraw/zinc/53/95/24/1167539524.db2.gz MVHVIVSCXVHCHU-UHFFFAOYSA-N 1 2 231.324 2.400 20 0 BEADLO Cc1cc(F)cc(N2CCOC(C)(C)C2)[nH+]1 ZINC001336473595 977707521 /nfs/dbraw/zinc/70/75/21/977707521.db2.gz ZRHXGRFXCWDLAA-UHFFFAOYSA-N 1 2 224.279 2.144 20 0 BEADLO CCc1cc(NC[C@](C)(O)CC)nc(CC)[nH+]1 ZINC001336698304 977862275 /nfs/dbraw/zinc/86/22/75/977862275.db2.gz RADGKPIPUGSRQF-CYBMUJFWSA-N 1 2 237.347 2.174 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC[C@H](C(F)F)C2)s1 ZINC001232245247 977977043 /nfs/dbraw/zinc/97/70/43/977977043.db2.gz OVPILSVRKDSWTE-QMMMGPOBSA-N 1 2 247.314 2.324 20 0 BEADLO Cc1nnc(C[N@H+]2CCC[C@H](C(F)F)C2)s1 ZINC001232245247 977977049 /nfs/dbraw/zinc/97/70/49/977977049.db2.gz OVPILSVRKDSWTE-QMMMGPOBSA-N 1 2 247.314 2.324 20 0 BEADLO C[C@@H]1CCC[N@@H+]1Cn1ncn(C2CC2)c1=S ZINC000173522898 1167696025 /nfs/dbraw/zinc/69/60/25/1167696025.db2.gz FPHIIVPNMGPWLR-SECBINFHSA-N 1 2 238.360 2.191 20 0 BEADLO C[C@@H]1CCC[N@H+]1Cn1ncn(C2CC2)c1=S ZINC000173522898 1167696028 /nfs/dbraw/zinc/69/60/28/1167696028.db2.gz FPHIIVPNMGPWLR-SECBINFHSA-N 1 2 238.360 2.191 20 0 BEADLO Nc1cc(-c2cccc3c2OCCO3)cc[nH+]1 ZINC000313323621 1167735291 /nfs/dbraw/zinc/73/52/91/1167735291.db2.gz DEFUATIAMHUZKS-UHFFFAOYSA-N 1 2 228.251 2.102 20 0 BEADLO CC(C)CC[C@@H](C)[N@@H+]1CCNCC(F)(F)C1 ZINC001256363885 970764539 /nfs/dbraw/zinc/76/45/39/970764539.db2.gz NPUMYTGVIYYWPE-LLVKDONJSA-N 1 2 234.334 2.352 20 0 BEADLO CC(C)CC[C@@H](C)[N@H+]1CCNCC(F)(F)C1 ZINC001256363885 970764548 /nfs/dbraw/zinc/76/45/48/970764548.db2.gz NPUMYTGVIYYWPE-LLVKDONJSA-N 1 2 234.334 2.352 20 0 BEADLO CC(C)CC[C@@H](C)N1CC[NH2+]CC(F)(F)C1 ZINC001256363885 970764558 /nfs/dbraw/zinc/76/45/58/970764558.db2.gz NPUMYTGVIYYWPE-LLVKDONJSA-N 1 2 234.334 2.352 20 0 BEADLO CCCn1c[nH+]cc1CNc1cccnc1 ZINC000085185997 1167799238 /nfs/dbraw/zinc/79/92/38/1167799238.db2.gz BNVPRAWAYLDHPD-UHFFFAOYSA-N 1 2 216.288 2.300 20 0 BEADLO Cc1cnsc1C[N@@H+]1CCOCC1(C)C ZINC001233320685 978557426 /nfs/dbraw/zinc/55/74/26/978557426.db2.gz JOGPSRUOKJOCHU-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1cnsc1C[N@H+]1CCOCC1(C)C ZINC001233320685 978557440 /nfs/dbraw/zinc/55/74/40/978557440.db2.gz JOGPSRUOKJOCHU-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1cnsc1C[N@@H+]1CCC[C@@H](F)C1 ZINC001233320754 978557559 /nfs/dbraw/zinc/55/75/59/978557559.db2.gz MECDVNVITTYEHL-SECBINFHSA-N 1 2 214.309 2.385 20 0 BEADLO Cc1cnsc1C[N@H+]1CCC[C@@H](F)C1 ZINC001233320754 978557563 /nfs/dbraw/zinc/55/75/63/978557563.db2.gz MECDVNVITTYEHL-SECBINFHSA-N 1 2 214.309 2.385 20 0 BEADLO Cc1cnsc1C[N@@H+]1CCOC[C@@H]1C1CC1 ZINC001233321845 978564449 /nfs/dbraw/zinc/56/44/49/978564449.db2.gz GKAVIYKMUAETOX-LLVKDONJSA-N 1 2 238.356 2.062 20 0 BEADLO Cc1cnsc1C[N@H+]1CCOC[C@@H]1C1CC1 ZINC001233321845 978564453 /nfs/dbraw/zinc/56/44/53/978564453.db2.gz GKAVIYKMUAETOX-LLVKDONJSA-N 1 2 238.356 2.062 20 0 BEADLO Cc1cc(C)c(C(=O)NCCC(F)F)c(C)[nH+]1 ZINC001338459445 978686373 /nfs/dbraw/zinc/68/63/73/978686373.db2.gz DTDJNZPUDUZOIF-UHFFFAOYSA-N 1 2 242.269 2.392 20 0 BEADLO CN(C)c1ccnc(Cl)c1C[N@H+](C)C1CC1 ZINC001234097483 978774869 /nfs/dbraw/zinc/77/48/69/978774869.db2.gz WGWNRXPOWSNCIN-UHFFFAOYSA-N 1 2 239.750 2.395 20 0 BEADLO CN(C)c1ccnc(Cl)c1C[N@@H+](C)C1CC1 ZINC001234097483 978774873 /nfs/dbraw/zinc/77/48/73/978774873.db2.gz WGWNRXPOWSNCIN-UHFFFAOYSA-N 1 2 239.750 2.395 20 0 BEADLO Oc1ccc(C[NH2+]Cc2ncc[nH]2)cc1Cl ZINC000070819522 978909931 /nfs/dbraw/zinc/90/99/31/978909931.db2.gz FKPZIKSZTJDRQT-UHFFFAOYSA-N 1 2 237.690 2.059 20 0 BEADLO FC(F)c1ccc(C[NH2+]Cc2nnc[nH]2)cc1 ZINC000150109297 1168326161 /nfs/dbraw/zinc/32/61/61/1168326161.db2.gz LEZQNUKRERKTMV-UHFFFAOYSA-N 1 2 238.241 2.032 20 0 BEADLO CCc1n[nH]cc1C[N@H+](C)Cc1cncs1 ZINC001237653861 980019005 /nfs/dbraw/zinc/01/90/05/980019005.db2.gz RDOXGVQXIMNKHJ-UHFFFAOYSA-N 1 2 236.344 2.061 20 0 BEADLO CCc1n[nH]cc1C[N@@H+](C)Cc1cncs1 ZINC001237653861 980019012 /nfs/dbraw/zinc/01/90/12/980019012.db2.gz RDOXGVQXIMNKHJ-UHFFFAOYSA-N 1 2 236.344 2.061 20 0 BEADLO CCc1[nH]ncc1C[N@@H+]1CCCCC12CC2 ZINC001237658983 980020689 /nfs/dbraw/zinc/02/06/89/980020689.db2.gz LVPLAZNIOHUEOY-UHFFFAOYSA-N 1 2 219.332 2.491 20 0 BEADLO CCc1[nH]ncc1C[N@H+]1CCCCC12CC2 ZINC001237658983 980020696 /nfs/dbraw/zinc/02/06/96/980020696.db2.gz LVPLAZNIOHUEOY-UHFFFAOYSA-N 1 2 219.332 2.491 20 0 BEADLO Cc1nc(C[N@H+]2C[C@@H](C)[C@@H](F)C2)ccc1F ZINC001237813900 980068257 /nfs/dbraw/zinc/06/82/57/980068257.db2.gz NWFQURYMCWRRKI-PELKAZGASA-N 1 2 226.270 2.319 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@@H](C)[C@@H](F)C2)ccc1F ZINC001237813900 980068264 /nfs/dbraw/zinc/06/82/64/980068264.db2.gz NWFQURYMCWRRKI-PELKAZGASA-N 1 2 226.270 2.319 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2cnc(F)cc2Cl)C1 ZINC001238019109 980124318 /nfs/dbraw/zinc/12/43/18/980124318.db2.gz ZOGJQOFZCMTSJJ-SECBINFHSA-N 1 2 244.697 2.095 20 0 BEADLO COc1cc(C[NH+]2CC(C)(C)C2)cnc1F ZINC001238447213 980268053 /nfs/dbraw/zinc/26/80/53/980268053.db2.gz DUAWCOBJRSGTKO-UHFFFAOYSA-N 1 2 224.279 2.071 20 0 BEADLO COc1cnc(C[NH+]2CC(C)C2)c(Cl)c1 ZINC001238483187 980276243 /nfs/dbraw/zinc/27/62/43/980276243.db2.gz HSJXKFMFRFLRBR-UHFFFAOYSA-N 1 2 226.707 2.195 20 0 BEADLO CCCCOC(=O)N(CC)CCn1cc[nH+]c1 ZINC001193693122 981413133 /nfs/dbraw/zinc/41/31/33/981413133.db2.gz IUNKIADVUTXIFR-UHFFFAOYSA-N 1 2 239.319 2.142 20 0 BEADLO CCCOC(=O)NCc1c[nH+]cn1C1CCC1 ZINC001194148140 981577032 /nfs/dbraw/zinc/57/70/32/981577032.db2.gz RTEJHWRMWCKGCL-UHFFFAOYSA-N 1 2 237.303 2.244 20 0 BEADLO CCCCC(=O)Nc1c(C)c[nH+]cc1C ZINC001349792686 981745826 /nfs/dbraw/zinc/74/58/26/981745826.db2.gz WRUXMXCXDRIFCD-UHFFFAOYSA-N 1 2 206.289 2.249 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cc(CO)ccc1F ZINC001241152108 982288444 /nfs/dbraw/zinc/28/84/44/982288444.db2.gz JRIUPGQVVGHWSP-YGQDEOHPSA-N 1 2 207.248 2.194 20 0 BEADLO CC[C@@H](C)C[C@H](C)NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC000080691992 982485786 /nfs/dbraw/zinc/48/57/86/982485786.db2.gz NEZJMMYIHAFUEI-GRYCIOLGSA-N 1 2 237.347 2.385 20 0 BEADLO C[C@@H]1CCC(F)(F)CN1CCCn1cc[nH+]c1 ZINC001198640499 982812847 /nfs/dbraw/zinc/81/28/47/982812847.db2.gz DJDHVEXWNDOVFI-LLVKDONJSA-N 1 2 243.301 2.393 20 0 BEADLO CC(C)=CCC[C@H](C)C[N@@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001201496923 983263329 /nfs/dbraw/zinc/26/33/29/983263329.db2.gz SDLLXYKNXJWJES-AVGNSLFASA-N 1 2 237.343 2.369 20 0 BEADLO CC(C)=CCC[C@H](C)C[N@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001201496923 983263337 /nfs/dbraw/zinc/26/33/37/983263337.db2.gz SDLLXYKNXJWJES-AVGNSLFASA-N 1 2 237.343 2.369 20 0 BEADLO CCC[C@H](C)C[N@@H+]1C[C@H](F)C[C@H]1C(=O)OC ZINC001201538490 983294104 /nfs/dbraw/zinc/29/41/04/983294104.db2.gz HECTYQGCCAZPMW-AXFHLTTASA-N 1 2 231.311 2.008 20 0 BEADLO CCC[C@H](C)C[N@H+]1C[C@H](F)C[C@H]1C(=O)OC ZINC001201538490 983294111 /nfs/dbraw/zinc/29/41/11/983294111.db2.gz HECTYQGCCAZPMW-AXFHLTTASA-N 1 2 231.311 2.008 20 0 BEADLO CCCC[C@@H](O)CNc1ccc(N(C)C)[nH+]c1 ZINC001252078808 983329219 /nfs/dbraw/zinc/32/92/19/983329219.db2.gz ZZTCNXMYAKOCJU-GFCCVEGCSA-N 1 2 237.347 2.111 20 0 BEADLO Cc1csc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)c1 ZINC001137160346 984004519 /nfs/dbraw/zinc/00/45/19/984004519.db2.gz VUKCLCPBZIHTAL-WDEREUQCSA-N 1 2 209.314 2.030 20 0 BEADLO Cc1csc(C[N@H+]2CCO[C@@H]3C[C@@H]32)c1 ZINC001137160346 984004531 /nfs/dbraw/zinc/00/45/31/984004531.db2.gz VUKCLCPBZIHTAL-WDEREUQCSA-N 1 2 209.314 2.030 20 0 BEADLO C[NH+]1CC(Oc2ccc(Cl)c(F)c2)C1 ZINC001225782114 974683132 /nfs/dbraw/zinc/68/31/32/974683132.db2.gz OGUIKCRIUICDFG-UHFFFAOYSA-N 1 2 215.655 2.172 20 0 BEADLO CC(C)OCC[C@H](C)[NH2+][C@@H]1CC1(F)F ZINC001172431889 974715978 /nfs/dbraw/zinc/71/59/78/974715978.db2.gz SBXHCLCGKMLZKT-DTWKUNHWSA-N 1 2 207.264 2.187 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2[nH]nc(C)c2C)[C@H](C)CO1 ZINC001331548635 974759486 /nfs/dbraw/zinc/75/94/86/974759486.db2.gz MJUBDVGPNQHSSS-SKDRFNHKSA-N 1 2 237.347 2.026 20 0 BEADLO CC(C)COCC[C@@H](C)[NH+]1C[C@@H](F)[C@H](F)C1 ZINC001172475027 974771218 /nfs/dbraw/zinc/77/12/18/974771218.db2.gz ZALMIMLVNJQRRB-IJLUTSLNSA-N 1 2 235.318 2.429 20 0 BEADLO CC(C)COCC[C@H](C)[NH2+][C@H]1CC1(F)F ZINC001172453705 974816155 /nfs/dbraw/zinc/81/61/55/974816155.db2.gz GJEUXTNWAVAKDG-UWVGGRQHSA-N 1 2 221.291 2.435 20 0 BEADLO CC(C)OCC[C@@H](C)[N@H+](C)CC(F)F ZINC001172458216 974818697 /nfs/dbraw/zinc/81/86/97/974818697.db2.gz BTZVNPHDPCTPNS-SECBINFHSA-N 1 2 209.280 2.387 20 0 BEADLO CC(C)OCC[C@@H](C)[N@@H+](C)CC(F)F ZINC001172458216 974818701 /nfs/dbraw/zinc/81/87/01/974818701.db2.gz BTZVNPHDPCTPNS-SECBINFHSA-N 1 2 209.280 2.387 20 0 BEADLO Oc1cccc(C[NH+]2CCC2)c1Br ZINC001140547057 1169372502 /nfs/dbraw/zinc/37/25/02/1169372502.db2.gz GKQMODBXAYQHLJ-UHFFFAOYSA-N 1 2 242.116 2.360 20 0 BEADLO COC(=O)c1cccc(-c2ccc[nH+]c2N)c1F ZINC001243474853 970766725 /nfs/dbraw/zinc/76/67/25/970766725.db2.gz SPSZSMBMDHEWPU-UHFFFAOYSA-N 1 2 246.241 2.257 20 0 BEADLO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1csnn1 ZINC000127179845 973293987 /nfs/dbraw/zinc/29/39/87/973293987.db2.gz SQDHKMSQHVPNCK-DTWKUNHWSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1csnn1 ZINC000127179845 973293997 /nfs/dbraw/zinc/29/39/97/973293997.db2.gz SQDHKMSQHVPNCK-DTWKUNHWSA-N 1 2 211.334 2.159 20 0 BEADLO CCN(CC1CCC1)C(=O)[C@H](C)n1cc[nH+]c1 ZINC001256371086 970785697 /nfs/dbraw/zinc/78/56/97/970785697.db2.gz XEBNJWGWNYIVSD-NSHDSACASA-N 1 2 235.331 2.093 20 0 BEADLO C[C@H](Cc1ccccn1)[N@@H+]1C[C@@H](F)C[C@H]1CF ZINC001256410763 970820444 /nfs/dbraw/zinc/82/04/44/970820444.db2.gz OAVAKJVGQZUTLJ-MDZLAQPJSA-N 1 2 240.297 2.395 20 0 BEADLO C[C@H](Cc1ccccn1)[N@H+]1C[C@@H](F)C[C@H]1CF ZINC001256410763 970820445 /nfs/dbraw/zinc/82/04/45/970820445.db2.gz OAVAKJVGQZUTLJ-MDZLAQPJSA-N 1 2 240.297 2.395 20 0 BEADLO C[C@H]1C[C@H]1c1nnc(C[NH+]2CCCCC2)o1 ZINC001256610903 970867114 /nfs/dbraw/zinc/86/71/14/970867114.db2.gz SPFUFWMPVRQFPD-VHSXEESVSA-N 1 2 221.304 2.179 20 0 BEADLO C[C@@H](Cc1ccncc1)[NH2+][C@@H]1CC1(F)F ZINC001256715849 970933724 /nfs/dbraw/zinc/93/37/24/970933724.db2.gz IKNJLJPDGWGXIV-WCBMZHEXSA-N 1 2 212.243 2.010 20 0 BEADLO Cc1cn2c(cccc2NC2=CCCOC2)[nH+]1 ZINC001216504547 971101838 /nfs/dbraw/zinc/10/18/38/971101838.db2.gz DRTIXIQYAGAVMY-UHFFFAOYSA-N 1 2 229.283 2.359 20 0 BEADLO Cc1[nH+]c2ccc(N)cc2n1C1=CCCOC1 ZINC001216510761 971111874 /nfs/dbraw/zinc/11/18/74/971111874.db2.gz WPOIHDHTCCLNQQ-UHFFFAOYSA-N 1 2 229.283 2.188 20 0 BEADLO CC1(C)CN(c2cc(N)cc(Cl)[nH+]2)C1 ZINC000307185067 971132125 /nfs/dbraw/zinc/13/21/25/971132125.db2.gz GZQBRFKTJNQZQB-UHFFFAOYSA-N 1 2 211.696 2.163 20 0 BEADLO COc1cc[nH+]c(Nc2cnc(F)c(OC)c2)c1 ZINC001216418516 1169543338 /nfs/dbraw/zinc/54/33/38/1169543338.db2.gz NOINNOHEPGESOG-UHFFFAOYSA-N 1 2 249.245 2.377 20 0 BEADLO CC(=O)[C@H]1CCCC[N@@H+]1Cc1ccc(C)nc1 ZINC000405675207 971290487 /nfs/dbraw/zinc/29/04/87/971290487.db2.gz JNGKRLCUCJSWMY-CQSZACIVSA-N 1 2 232.327 2.334 20 0 BEADLO CC(=O)[C@H]1CCCC[N@H+]1Cc1ccc(C)nc1 ZINC000405675207 971290491 /nfs/dbraw/zinc/29/04/91/971290491.db2.gz JNGKRLCUCJSWMY-CQSZACIVSA-N 1 2 232.327 2.334 20 0 BEADLO CCCc1nnc([C@@H]2[NH2+]CCc3ccccc32)o1 ZINC001217720621 971357564 /nfs/dbraw/zinc/35/75/64/971357564.db2.gz PBKCCGFKBWWGJD-CYBMUJFWSA-N 1 2 243.310 2.257 20 0 BEADLO CC[C@H](C)[N@@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001257446789 971362962 /nfs/dbraw/zinc/36/29/62/971362962.db2.gz RIPQAWYQSRSBTI-NSHDSACASA-N 1 2 249.358 2.349 20 0 BEADLO CC[C@H](C)[N@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001257446789 971362965 /nfs/dbraw/zinc/36/29/65/971362965.db2.gz RIPQAWYQSRSBTI-NSHDSACASA-N 1 2 249.358 2.349 20 0 BEADLO CC[C@@H](C)[N@@H+]1CCN(C(=O)OC(C)(C)C)C1 ZINC001257447981 971367721 /nfs/dbraw/zinc/36/77/21/971367721.db2.gz ODNIBFOOMXEHBK-SNVBAGLBSA-N 1 2 228.336 2.295 20 0 BEADLO CC[C@@H](C)[N@H+]1CCN(C(=O)OC(C)(C)C)C1 ZINC001257447981 971367727 /nfs/dbraw/zinc/36/77/27/971367727.db2.gz ODNIBFOOMXEHBK-SNVBAGLBSA-N 1 2 228.336 2.295 20 0 BEADLO c1nc2c(s1)C[N@@H+]([C@@H]1CCCSC1)C2 ZINC001257682657 971483205 /nfs/dbraw/zinc/48/32/05/971483205.db2.gz IPDIXJDUUUZBDF-MRVPVSSYSA-N 1 2 226.370 2.354 20 0 BEADLO c1nc2c(s1)C[N@H+]([C@@H]1CCCSC1)C2 ZINC001257682657 971483207 /nfs/dbraw/zinc/48/32/07/971483207.db2.gz IPDIXJDUUUZBDF-MRVPVSSYSA-N 1 2 226.370 2.354 20 0 BEADLO COC(=O)C1CCC([N@@H+]2CCC(F)(F)C2)CC1 ZINC001257860636 971507770 /nfs/dbraw/zinc/50/77/70/971507770.db2.gz ZQOIAIPNLKZVHD-UHFFFAOYSA-N 1 2 247.285 2.059 20 0 BEADLO COC(=O)C1CCC([N@H+]2CCC(F)(F)C2)CC1 ZINC001257860636 971507778 /nfs/dbraw/zinc/50/77/78/971507778.db2.gz ZQOIAIPNLKZVHD-UHFFFAOYSA-N 1 2 247.285 2.059 20 0 BEADLO C[C@H](C[NH+](C)C)Oc1cccc(S)c1 ZINC001226015396 1169599401 /nfs/dbraw/zinc/59/94/01/1169599401.db2.gz JOICBUPKXJQINE-SECBINFHSA-N 1 2 211.330 2.304 20 0 BEADLO C[NH2+][C@H]1C[C@H](Oc2ccc(S)cc2C)C1 ZINC001217952718 971543095 /nfs/dbraw/zinc/54/30/95/971543095.db2.gz GHCUKVXYEJGMAC-MGCOHNPYSA-N 1 2 223.341 2.413 20 0 BEADLO FC(F)C[NH2+][C@H]1COc2ccc(Cl)cc2C1 ZINC001257946950 971547178 /nfs/dbraw/zinc/54/71/78/971547178.db2.gz LROUKTDMVNRWHV-SECBINFHSA-N 1 2 247.672 2.498 20 0 BEADLO Cc1c(O)cccc1-c1cc[nH+]c(N)c1 ZINC001244958652 971562342 /nfs/dbraw/zinc/56/23/42/971562342.db2.gz HPEPLKPSGHABPP-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO Fc1ccc(O[C@H]2CC[NH2+]CC2(F)F)c(F)c1 ZINC001218004090 971567296 /nfs/dbraw/zinc/56/72/96/971567296.db2.gz AMVFOXZUQQCAQN-JTQLQIEISA-N 1 2 249.207 2.341 20 0 BEADLO COc1ccccc1OC1C[NH+](C(C)C)C1 ZINC001225211705 974240154 /nfs/dbraw/zinc/24/01/54/974240154.db2.gz CLLDSCDNJHNATF-UHFFFAOYSA-N 1 2 221.300 2.167 20 0 BEADLO Cc1cc(S)ccc1O[C@H]1C[NH2+][C@H](C)C1 ZINC001218039390 971585299 /nfs/dbraw/zinc/58/52/99/971585299.db2.gz JVGRELWBECEARM-NXEZZACHSA-N 1 2 223.341 2.413 20 0 BEADLO Oc1ccc(Cl)c(O[C@@H]2C[NH2+]CC2(F)F)c1 ZINC001218232845 971644208 /nfs/dbraw/zinc/64/42/08/971644208.db2.gz HCNDNNCQITULSO-SECBINFHSA-N 1 2 249.644 2.032 20 0 BEADLO Cc1cc2[nH+]ccn2cc1C1=CCCOC1 ZINC001245158829 971703240 /nfs/dbraw/zinc/70/32/40/971703240.db2.gz ULTOBPPYMFEBHG-UHFFFAOYSA-N 1 2 214.268 2.446 20 0 BEADLO CCC=CNc1[nH+]c(C)cc(C)c1C(N)=O ZINC001170763314 971748636 /nfs/dbraw/zinc/74/86/36/971748636.db2.gz DVITWNFLLKQSMC-AATRIKPKSA-N 1 2 219.288 2.133 20 0 BEADLO CCC=CNc1nc(N(C)C)cc(C)[nH+]1 ZINC001170766080 971756879 /nfs/dbraw/zinc/75/68/79/971756879.db2.gz CGYSRBNQWIEVHY-VOTSOKGWSA-N 1 2 206.293 2.187 20 0 BEADLO Cc1cc(S)ccc1O[C@@H]1C[NH2+][C@@H]1C ZINC001218384468 971763935 /nfs/dbraw/zinc/76/39/35/971763935.db2.gz DOQDQBLVYMFPMY-LDYMZIIASA-N 1 2 209.314 2.023 20 0 BEADLO Nc1ccc(Nc2c[nH]c3ncc(F)cc23)c[nH+]1 ZINC001159281804 971805477 /nfs/dbraw/zinc/80/54/77/971805477.db2.gz BNGDEZYZWMUASE-UHFFFAOYSA-N 1 2 243.245 2.423 20 0 BEADLO Cc1[nH]c2ccc(OC[C@H]3C[C@H](O)C3)cc2[nH+]1 ZINC001218427420 971806057 /nfs/dbraw/zinc/80/60/57/971806057.db2.gz ZYXNCRRRTLVYIL-MGCOHNPYSA-N 1 2 232.283 2.021 20 0 BEADLO CC[C@H](C)OCC[C@@H](C)[NH2+]C(C)(C)C(=O)OC ZINC001172322478 974532440 /nfs/dbraw/zinc/53/24/40/974532440.db2.gz VAGFXLAKJODQDS-MNOVXSKESA-N 1 2 245.363 2.121 20 0 BEADLO Cc1cc(-c2cccn3ccnc23)c[nH+]c1N ZINC001245535821 971850227 /nfs/dbraw/zinc/85/02/27/971850227.db2.gz BPIUBZPJJBEQMB-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO C[C@H]1COCC[C@@H]1Nc1cc2cc[nH]c2c[nH+]1 ZINC001170814870 971889230 /nfs/dbraw/zinc/88/92/30/971889230.db2.gz WPCZBPHPZRYHSK-ONGXEEELSA-N 1 2 231.299 2.400 20 0 BEADLO Cc1cncc(Br)c1C[NH+]1CCC1 ZINC001235639837 1169698477 /nfs/dbraw/zinc/69/84/77/1169698477.db2.gz YUUPTCXMDDXNOJ-UHFFFAOYSA-N 1 2 241.132 2.358 20 0 BEADLO Cn1nc(C(F)(F)F)cc1-c1cc[nH+]c(N)c1 ZINC000705310492 957105383 /nfs/dbraw/zinc/10/53/83/957105383.db2.gz YXGHKWRSJFRDAU-UHFFFAOYSA-N 1 2 242.204 2.083 20 0 BEADLO C[C@H](C[N@@H+]1CCC(=O)C(C)(C)C1)C(F)(F)F ZINC001208906207 957238179 /nfs/dbraw/zinc/23/81/79/957238179.db2.gz UJIUSMDDLJDCHP-MRVPVSSYSA-N 1 2 237.265 2.486 20 0 BEADLO C[C@H](C[N@H+]1CCC(=O)C(C)(C)C1)C(F)(F)F ZINC001208906207 957238188 /nfs/dbraw/zinc/23/81/88/957238188.db2.gz UJIUSMDDLJDCHP-MRVPVSSYSA-N 1 2 237.265 2.486 20 0 BEADLO CN(C)c1cc(N(C)C[C@@H]2CC2(C)C)nc[nH+]1 ZINC001167093366 957282164 /nfs/dbraw/zinc/28/21/64/957282164.db2.gz ZINYFSPQRJFPTC-JTQLQIEISA-N 1 2 234.347 2.025 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2ccccn2)C[C@@H]1F ZINC001204056159 972257699 /nfs/dbraw/zinc/25/76/99/972257699.db2.gz UYRSDBWYAHEJBH-RYUDHWBXSA-N 1 2 226.270 2.354 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2ccccn2)C[C@@H]1F ZINC001204056159 972257705 /nfs/dbraw/zinc/25/77/05/972257705.db2.gz UYRSDBWYAHEJBH-RYUDHWBXSA-N 1 2 226.270 2.354 20 0 BEADLO Cc1cc(C[NH+]2CCOCC2)cc(C)c1F ZINC001143376859 957313099 /nfs/dbraw/zinc/31/30/99/957313099.db2.gz JPCQEHOTTHWAGV-UHFFFAOYSA-N 1 2 223.291 2.275 20 0 BEADLO COc1cc(C)c[nH+]c1N1CC[C@@H]2OCC[C@H]2C1 ZINC001167211806 957544639 /nfs/dbraw/zinc/54/46/39/957544639.db2.gz BFZKXORSHQLRJT-RYUDHWBXSA-N 1 2 248.326 2.014 20 0 BEADLO C[C@@]1(F)CCCC[N@H+](Cc2cnc[nH]2)C1 ZINC001136865970 972280073 /nfs/dbraw/zinc/28/00/73/972280073.db2.gz FALVVBIHZYIYRC-LLVKDONJSA-N 1 2 211.284 2.124 20 0 BEADLO C[C@@]1(F)CCCC[N@@H+](Cc2cnc[nH]2)C1 ZINC001136865970 972280078 /nfs/dbraw/zinc/28/00/78/972280078.db2.gz FALVVBIHZYIYRC-LLVKDONJSA-N 1 2 211.284 2.124 20 0 BEADLO C[C@@]1(F)CCCC[N@H+](Cc2c[nH]cn2)C1 ZINC001136865970 972280085 /nfs/dbraw/zinc/28/00/85/972280085.db2.gz FALVVBIHZYIYRC-LLVKDONJSA-N 1 2 211.284 2.124 20 0 BEADLO C[C@@]1(F)CCCC[N@@H+](Cc2c[nH]cn2)C1 ZINC001136865970 972280089 /nfs/dbraw/zinc/28/00/89/972280089.db2.gz FALVVBIHZYIYRC-LLVKDONJSA-N 1 2 211.284 2.124 20 0 BEADLO Cn1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)n1 ZINC001210350763 957728767 /nfs/dbraw/zinc/72/87/67/957728767.db2.gz BMXDIEWFCPDGQS-UHFFFAOYSA-N 1 2 239.282 2.349 20 0 BEADLO Nc1ccc[nH+]c1Nc1ccc(CO)c(F)c1 ZINC001210481236 957762964 /nfs/dbraw/zinc/76/29/64/957762964.db2.gz HHCFVHBJZLBSSC-UHFFFAOYSA-N 1 2 233.246 2.039 20 0 BEADLO Cc1ccc(CO)cc1Nc1[nH+]cccc1N ZINC001210678506 957853167 /nfs/dbraw/zinc/85/31/67/957853167.db2.gz UWLBMYNBLSLXEH-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO Cc1ncc(C[N@@H+]2CCc3cnccc3C2)s1 ZINC001207058866 957877086 /nfs/dbraw/zinc/87/70/86/957877086.db2.gz NPIFOPRDHASHTH-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ncc(C[N@H+]2CCc3cnccc3C2)s1 ZINC001207058866 957877091 /nfs/dbraw/zinc/87/70/91/957877091.db2.gz NPIFOPRDHASHTH-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO CC=C(C)Nc1ccc(N2CCOCC2)[nH+]c1 ZINC001210792527 957888216 /nfs/dbraw/zinc/88/82/16/957888216.db2.gz OJTFZPBECVDCJZ-QDEBKDIKSA-N 1 2 233.315 2.254 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@@](C)(O)[C@@H](F)C2)oc1C ZINC001204535939 958002528 /nfs/dbraw/zinc/00/25/28/958002528.db2.gz AXPGEBSFSPTABK-QWHCGFSZSA-N 1 2 241.306 2.191 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@@](C)(O)[C@@H](F)C2)oc1C ZINC001204535939 958002543 /nfs/dbraw/zinc/00/25/43/958002543.db2.gz AXPGEBSFSPTABK-QWHCGFSZSA-N 1 2 241.306 2.191 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3ncn(C)c3C2)oc1C ZINC001204541078 958033558 /nfs/dbraw/zinc/03/35/58/958033558.db2.gz FOWAIMZRWJSVPC-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO Cc1cc(C[N@H+]2CCc3ncn(C)c3C2)oc1C ZINC001204541078 958033574 /nfs/dbraw/zinc/03/35/74/958033574.db2.gz FOWAIMZRWJSVPC-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO Cc1sccc1CN1CC[NH2+]CC(F)(F)C1 ZINC001211345552 958169089 /nfs/dbraw/zinc/16/90/89/958169089.db2.gz ASELNAITASMBAE-UHFFFAOYSA-N 1 2 246.326 2.097 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H]3C[C@@H](C2)O3)cc(C)c1F ZINC001143382122 958188891 /nfs/dbraw/zinc/18/88/91/958188891.db2.gz UXOUOFIUXRLBDD-BETUJISGSA-N 1 2 235.302 2.416 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H]3C[C@@H](C2)O3)cc(C)c1F ZINC001143382122 958188897 /nfs/dbraw/zinc/18/88/97/958188897.db2.gz UXOUOFIUXRLBDD-BETUJISGSA-N 1 2 235.302 2.416 20 0 BEADLO COc1cncc(Nc2c[nH+]cc(C)c2C)n1 ZINC001213525349 958202260 /nfs/dbraw/zinc/20/22/60/958202260.db2.gz SDFHVYNPBKHOMK-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO C[C@H]1CC(=O)CC[N@@H+]1Cc1ccc2c(c1)COC2 ZINC001137022226 972329169 /nfs/dbraw/zinc/32/91/69/972329169.db2.gz XAINLZFYGZPWRO-NSHDSACASA-N 1 2 245.322 2.270 20 0 BEADLO C[C@H]1CC(=O)CC[N@H+]1Cc1ccc2c(c1)COC2 ZINC001137022226 972329176 /nfs/dbraw/zinc/32/91/76/972329176.db2.gz XAINLZFYGZPWRO-NSHDSACASA-N 1 2 245.322 2.270 20 0 BEADLO C[C@@H]1C[C@H](N[C@H]2C[NH2+]CC2(F)F)CC(C)(C)C1 ZINC001246462171 972334047 /nfs/dbraw/zinc/33/40/47/972334047.db2.gz QXAQMHDSLXEQIX-VWYCJHECSA-N 1 2 246.345 2.398 20 0 BEADLO C[C@@H]1CC(=O)CC[N@@H+]1Cc1ccc2[nH]cnc2c1 ZINC001137041119 972338848 /nfs/dbraw/zinc/33/88/48/972338848.db2.gz LRMKXFBPXBBCAD-SNVBAGLBSA-N 1 2 243.310 2.116 20 0 BEADLO C[C@@H]1CC(=O)CC[N@H+]1Cc1ccc2[nH]cnc2c1 ZINC001137041119 972338853 /nfs/dbraw/zinc/33/88/53/972338853.db2.gz LRMKXFBPXBBCAD-SNVBAGLBSA-N 1 2 243.310 2.116 20 0 BEADLO Cc1nc(NC[C@@H]2C[C@H]2C2CCCC2)nc(N)[nH+]1 ZINC001348541958 958405520 /nfs/dbraw/zinc/40/55/20/958405520.db2.gz CUAVYCWCTJWHTM-QWRGUYRKSA-N 1 2 247.346 2.000 20 0 BEADLO Cc1nc(N)nc(NC[C@@H]2C[C@H]2C2CCCC2)[nH+]1 ZINC001348541958 958405529 /nfs/dbraw/zinc/40/55/29/958405529.db2.gz CUAVYCWCTJWHTM-QWRGUYRKSA-N 1 2 247.346 2.000 20 0 BEADLO Cc1nc(NC[C@@H]2C[C@@H]2C2CCCC2)nc(N)[nH+]1 ZINC001348541959 958406593 /nfs/dbraw/zinc/40/65/93/958406593.db2.gz CUAVYCWCTJWHTM-WDEREUQCSA-N 1 2 247.346 2.000 20 0 BEADLO Cc1nc(N)nc(NC[C@@H]2C[C@@H]2C2CCCC2)[nH+]1 ZINC001348541959 958406600 /nfs/dbraw/zinc/40/66/00/958406600.db2.gz CUAVYCWCTJWHTM-WDEREUQCSA-N 1 2 247.346 2.000 20 0 BEADLO C[C@@H]1CCC[C@@H](OCCn2cc[nH+]c2)C1 ZINC001222135066 972373541 /nfs/dbraw/zinc/37/35/41/972373541.db2.gz VDOLRWLUOWKOAQ-VXGBXAGGSA-N 1 2 208.305 2.478 20 0 BEADLO Cc1c(O)cccc1N(C)c1[nH+]cccc1N ZINC001216317246 958831380 /nfs/dbraw/zinc/83/13/80/958831380.db2.gz PRFUSSMUDOSLLD-UHFFFAOYSA-N 1 2 229.283 2.446 20 0 BEADLO CC(C)[C@@H](OCCn1cc[nH+]c1)C(F)(F)F ZINC001222134672 972380729 /nfs/dbraw/zinc/38/07/29/972380729.db2.gz JVDPMONQBQZLEE-SECBINFHSA-N 1 2 236.237 2.487 20 0 BEADLO CCCC(=O)[C@H](CCC)OCCn1cc[nH+]c1 ZINC001222134989 972382212 /nfs/dbraw/zinc/38/22/12/972382212.db2.gz UUYTWQSIOFTQKI-ZDUSSCGKSA-N 1 2 238.331 2.438 20 0 BEADLO c1cn(CCO[C@H]2CCOc3ccccc32)c[nH+]1 ZINC001222134797 972383466 /nfs/dbraw/zinc/38/34/66/972383466.db2.gz OMWDPHKENGXNEA-AWEZNQCLSA-N 1 2 244.294 2.424 20 0 BEADLO CCCCOC[C@@H](C)OCCn1cc[nH+]c1 ZINC001222134186 972384346 /nfs/dbraw/zinc/38/43/46/972384346.db2.gz BKYXVCWETGEXSS-GFCCVEGCSA-N 1 2 226.320 2.105 20 0 BEADLO c1csc(C[N@@H+]2CCc3ncncc3C2)c1 ZINC000585379363 958900311 /nfs/dbraw/zinc/90/03/11/958900311.db2.gz JZFBMBYVCCXKLE-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1csc(C[N@H+]2CCc3ncncc3C2)c1 ZINC000585379363 958900326 /nfs/dbraw/zinc/90/03/26/958900326.db2.gz JZFBMBYVCCXKLE-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO C[C@H](OCCn1cc[nH+]c1)c1cccnc1F ZINC001222138637 972385868 /nfs/dbraw/zinc/38/58/68/972385868.db2.gz JDJGZRQISBGLON-JTQLQIEISA-N 1 2 235.262 2.195 20 0 BEADLO CC1(C)[C@@H]2C[C@@H](OCCn3cc[nH+]c3)C[C@@H]21 ZINC001222139437 972387963 /nfs/dbraw/zinc/38/79/63/972387963.db2.gz RUOVFTAYVLEYIG-CNDDSTCGSA-N 1 2 220.316 2.334 20 0 BEADLO Cc1ncc(Cl)nc1NCc1cc[nH+]c(N)c1 ZINC001167613408 959063785 /nfs/dbraw/zinc/06/37/85/959063785.db2.gz KFMBFRCTUBXMEM-UHFFFAOYSA-N 1 2 249.705 2.028 20 0 BEADLO Cc1ccc(N)cc1NCc1cc[nH+]c(N)c1 ZINC001167617089 959082523 /nfs/dbraw/zinc/08/25/23/959082523.db2.gz GPIPOOICXCZQHL-UHFFFAOYSA-N 1 2 228.299 2.167 20 0 BEADLO CCCc1cc(NCc2cc[nH+]c(N)c2)ncn1 ZINC001167616598 959083733 /nfs/dbraw/zinc/08/37/33/959083733.db2.gz CHOWYPRMDGNJTO-UHFFFAOYSA-N 1 2 243.314 2.018 20 0 BEADLO CC(C)c1nccnc1NCc1cc[nH+]c(N)c1 ZINC001167617435 959092910 /nfs/dbraw/zinc/09/29/10/959092910.db2.gz QHWDSXFYEOQLBS-UHFFFAOYSA-N 1 2 243.314 2.189 20 0 BEADLO CC1(F)C[NH+](C[C@H]2CCOC(C)(C)C2)C1 ZINC001207354785 959222120 /nfs/dbraw/zinc/22/21/20/959222120.db2.gz XVMDEHBQGZZRGI-JTQLQIEISA-N 1 2 215.312 2.235 20 0 BEADLO CC(C)[C@@H]1CCCCN1C(=O)C[C@@H]([NH3+])C(F)F ZINC000724710708 959230274 /nfs/dbraw/zinc/23/02/74/959230274.db2.gz HDQNPYQJYNYFLF-ZJUUUORDSA-N 1 2 248.317 2.006 20 0 BEADLO O=C1CC[NH+](Cc2cccc3ccncc32)CC1 ZINC001140640147 959293768 /nfs/dbraw/zinc/29/37/68/959293768.db2.gz HCNCUZAKMWSIJO-UHFFFAOYSA-N 1 2 240.306 2.400 20 0 BEADLO C[C@H](NC(=O)C[C@@H]([NH3+])C(F)F)C1CCCCC1 ZINC000724754633 959366694 /nfs/dbraw/zinc/36/66/94/959366694.db2.gz DYAQQRHMLKPYSD-WCBMZHEXSA-N 1 2 248.317 2.054 20 0 BEADLO COc1ccc(F)c(C[NH+](C)C)c1F ZINC001143970448 972438753 /nfs/dbraw/zinc/43/87/53/972438753.db2.gz KDOOQQZUFZGHFU-UHFFFAOYSA-N 1 2 201.216 2.035 20 0 BEADLO C1=C[C@H]([NH2+]Cc2n[nH]c3ccccc32)CC1 ZINC000694015393 959675582 /nfs/dbraw/zinc/67/55/82/959675582.db2.gz DCRYPNOMBGZIRC-JTQLQIEISA-N 1 2 213.284 2.371 20 0 BEADLO CC=CC=CC(=O)Nc1cc[nH+]c2c1CCC2 ZINC001143993702 972465140 /nfs/dbraw/zinc/46/51/40/972465140.db2.gz RWLFLIXRMFJMFL-CRBCFSCISA-N 1 2 228.295 2.063 20 0 BEADLO Cc1c[nH]c(C[N@@H+](C)Cc2ccncn2)c1C ZINC001140864561 960007352 /nfs/dbraw/zinc/00/73/52/960007352.db2.gz WIXPIQVFALCIBJ-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1c[nH]c(C[N@H+](C)Cc2ccncn2)c1C ZINC001140864561 960007375 /nfs/dbraw/zinc/00/73/75/960007375.db2.gz WIXPIQVFALCIBJ-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Oc1c(F)cc(C[NH+]2CC=CC2)cc1F ZINC001140988407 960158887 /nfs/dbraw/zinc/15/88/87/960158887.db2.gz ZUPPXWPQYYFWDX-UHFFFAOYSA-N 1 2 211.211 2.042 20 0 BEADLO Cc1cn2c(cccc2NC=CC(C)(C)O)[nH+]1 ZINC001203209026 960174121 /nfs/dbraw/zinc/17/41/21/960174121.db2.gz CVMSAQMZCWMSIM-BQYQJAHWSA-N 1 2 231.299 2.339 20 0 BEADLO C=C/C(C)=C\CC(=O)NC1C[NH+](CC=C(C)C)C1 ZINC001267654499 960174253 /nfs/dbraw/zinc/17/42/53/960174253.db2.gz ABOBAVGGHXUYGM-MLPAPPSSSA-N 1 2 248.370 2.275 20 0 BEADLO Cc1c[nH+]cc(NC(C)(C)CCO)c1C ZINC001167739085 960357867 /nfs/dbraw/zinc/35/78/67/960357867.db2.gz DPBYEMRWVAKOFO-UHFFFAOYSA-N 1 2 208.305 2.271 20 0 BEADLO C[N@H+](Cc1ccc(Cl)nc1)Cc1ccncn1 ZINC000396652008 960385027 /nfs/dbraw/zinc/38/50/27/960385027.db2.gz DUIKZJGSXBDCLV-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[N@@H+](Cc1ccc(Cl)nc1)Cc1ccncn1 ZINC000396652008 960385034 /nfs/dbraw/zinc/38/50/34/960385034.db2.gz DUIKZJGSXBDCLV-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO COc1cc[nH+]cc1NC1(C2CCOCC2)CC1 ZINC001167744115 960444958 /nfs/dbraw/zinc/44/49/58/960444958.db2.gz YRQTVCIHKWXKNH-UHFFFAOYSA-N 1 2 248.326 2.461 20 0 BEADLO Fc1cnc(Cl)cc1C[N@@H+]1C[C@@H]2C[C@@H]2C1 ZINC001140605394 960452583 /nfs/dbraw/zinc/45/25/83/960452583.db2.gz AGQNCPZOJOXZMM-OCAPTIKFSA-N 1 2 226.682 2.326 20 0 BEADLO Fc1cnc(Cl)cc1C[N@H+]1C[C@@H]2C[C@@H]2C1 ZINC001140605394 960452592 /nfs/dbraw/zinc/45/25/92/960452592.db2.gz AGQNCPZOJOXZMM-OCAPTIKFSA-N 1 2 226.682 2.326 20 0 BEADLO Cc1cc(C[NH+]2CCC(=O)CC2)cc(C)c1O ZINC001140658163 960478954 /nfs/dbraw/zinc/47/89/54/960478954.db2.gz LWWQURGBJDKWHS-UHFFFAOYSA-N 1 2 233.311 2.174 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2c[nH]c3ccncc23)C[C@H](C)O1 ZINC001140799384 960582652 /nfs/dbraw/zinc/58/26/52/960582652.db2.gz BNWNOGQAUYKBFQ-PHIMTYICSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1C[N@H+](Cc2c[nH]c3ccncc23)C[C@H](C)O1 ZINC001140799384 960582664 /nfs/dbraw/zinc/58/26/64/960582664.db2.gz BNWNOGQAUYKBFQ-PHIMTYICSA-N 1 2 245.326 2.172 20 0 BEADLO F[C@H]1CCC[N@H+](Cc2c[nH]c3ccncc23)C1 ZINC001140802604 960595805 /nfs/dbraw/zinc/59/58/05/960595805.db2.gz AKOLKJFEBAWJPW-NSHDSACASA-N 1 2 233.290 2.497 20 0 BEADLO F[C@H]1CCC[N@@H+](Cc2c[nH]c3ccncc23)C1 ZINC001140802604 960595814 /nfs/dbraw/zinc/59/58/14/960595814.db2.gz AKOLKJFEBAWJPW-NSHDSACASA-N 1 2 233.290 2.497 20 0 BEADLO F[C@H]1CC[N@H+](Cc2c[nH]c3ccncc23)C1 ZINC001140802552 960598158 /nfs/dbraw/zinc/59/81/58/960598158.db2.gz YSHSTIMSLXTANS-JTQLQIEISA-N 1 2 219.263 2.107 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2c[nH]c3ccncc23)C1 ZINC001140802552 960598165 /nfs/dbraw/zinc/59/81/65/960598165.db2.gz YSHSTIMSLXTANS-JTQLQIEISA-N 1 2 219.263 2.107 20 0 BEADLO Oc1ccc(C[N@@H+]2C[C@@H]3C[C@@H]3C2)c(F)c1F ZINC001140888387 960668106 /nfs/dbraw/zinc/66/81/06/960668106.db2.gz REZNGTNNFDCZFT-DTORHVGOSA-N 1 2 225.238 2.122 20 0 BEADLO Oc1ccc(C[N@H+]2C[C@@H]3C[C@@H]3C2)c(F)c1F ZINC001140888387 960668117 /nfs/dbraw/zinc/66/81/17/960668117.db2.gz REZNGTNNFDCZFT-DTORHVGOSA-N 1 2 225.238 2.122 20 0 BEADLO COc1ccccc1C[N@H+](C)Cc1cc(C)n[nH]1 ZINC001203075367 960668181 /nfs/dbraw/zinc/66/81/81/960668181.db2.gz GMLNUFHYVAULQG-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1ccccc1C[N@@H+](C)Cc1cc(C)n[nH]1 ZINC001203075367 960668193 /nfs/dbraw/zinc/66/81/93/960668193.db2.gz GMLNUFHYVAULQG-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO c1ncc(C[N@@H+]2CCOC3(CCCCC3)C2)o1 ZINC001140934023 960716145 /nfs/dbraw/zinc/71/61/45/960716145.db2.gz QDEBMDWUBXSSOG-UHFFFAOYSA-N 1 2 236.315 2.210 20 0 BEADLO c1ncc(C[N@H+]2CCOC3(CCCCC3)C2)o1 ZINC001140934023 960716153 /nfs/dbraw/zinc/71/61/53/960716153.db2.gz QDEBMDWUBXSSOG-UHFFFAOYSA-N 1 2 236.315 2.210 20 0 BEADLO COc1ccsc1C[N@@H+]1CCCC(=O)CC1 ZINC001141320887 960752982 /nfs/dbraw/zinc/75/29/82/960752982.db2.gz LRPOBYHXNSZBMA-UHFFFAOYSA-N 1 2 239.340 2.312 20 0 BEADLO COc1ccsc1C[N@H+]1CCCC(=O)CC1 ZINC001141320887 960752991 /nfs/dbraw/zinc/75/29/91/960752991.db2.gz LRPOBYHXNSZBMA-UHFFFAOYSA-N 1 2 239.340 2.312 20 0 BEADLO Cc1ncoc1C[NH+]1CC2(C1)C[C@H](F)CS2 ZINC001141053672 960849056 /nfs/dbraw/zinc/84/90/56/960849056.db2.gz MEHOWSOZPPKHIX-VIFPVBQESA-N 1 2 242.319 2.012 20 0 BEADLO CCCCc1[nH]c(CN2CC(F)(F)C2)c[nH+]1 ZINC001141067087 960851936 /nfs/dbraw/zinc/85/19/36/960851936.db2.gz RQGKQZZCPJYYOL-UHFFFAOYSA-N 1 2 229.274 2.203 20 0 BEADLO CCCCc1[nH]cc(CN2CC(F)(F)C2)[nH+]1 ZINC001141067087 960851952 /nfs/dbraw/zinc/85/19/52/960851952.db2.gz RQGKQZZCPJYYOL-UHFFFAOYSA-N 1 2 229.274 2.203 20 0 BEADLO CCCCc1[nH]c(CN2CCCC(=O)CC2)c[nH+]1 ZINC001141068363 960858476 /nfs/dbraw/zinc/85/84/76/960858476.db2.gz GOECUDPJAIYPGQ-UHFFFAOYSA-N 1 2 249.358 2.307 20 0 BEADLO CCCCc1[nH]cc(CN2CCCC(=O)CC2)[nH+]1 ZINC001141068363 960858480 /nfs/dbraw/zinc/85/84/80/960858480.db2.gz GOECUDPJAIYPGQ-UHFFFAOYSA-N 1 2 249.358 2.307 20 0 BEADLO CCc1ccccc1C[N@@H+]1CCO[C@H](C(C)=O)C1 ZINC001141228276 960987057 /nfs/dbraw/zinc/98/70/57/960987057.db2.gz FEIXCNRJHLVDBW-HNNXBMFYSA-N 1 2 247.338 2.039 20 0 BEADLO CCc1ccccc1C[N@H+]1CCO[C@H](C(C)=O)C1 ZINC001141228276 960987109 /nfs/dbraw/zinc/98/71/09/960987109.db2.gz FEIXCNRJHLVDBW-HNNXBMFYSA-N 1 2 247.338 2.039 20 0 BEADLO C[C@H]1CC(=O)CC[N@@H+]1Cc1cccc(N(C)C)c1 ZINC001141257402 961021416 /nfs/dbraw/zinc/02/14/16/961021416.db2.gz FIMYJTSNLSUPBF-LBPRGKRZSA-N 1 2 246.354 2.306 20 0 BEADLO C[C@H]1CC(=O)CC[N@H+]1Cc1cccc(N(C)C)c1 ZINC001141257402 961021449 /nfs/dbraw/zinc/02/14/49/961021449.db2.gz FIMYJTSNLSUPBF-LBPRGKRZSA-N 1 2 246.354 2.306 20 0 BEADLO CC(C)(C)C(=O)Nc1cccc(NC=[NH2+])n1 ZINC001167865014 961334667 /nfs/dbraw/zinc/33/46/67/961334667.db2.gz QPDKOPAMWAAIPE-UHFFFAOYSA-N 1 2 220.276 2.085 20 0 BEADLO CCCOCCNc1ccn2cc[nH+]c2c1 ZINC001167872014 961384433 /nfs/dbraw/zinc/38/44/33/961384433.db2.gz DWJRLMHGAHSCIO-UHFFFAOYSA-N 1 2 219.288 2.173 20 0 BEADLO CC1(C)C[N@H+](Cc2cc3cccnc3[nH]2)CCO1 ZINC001143211572 961956366 /nfs/dbraw/zinc/95/63/66/961956366.db2.gz FVFGKVYUSSYJLU-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO CC1(C)C[N@@H+](Cc2cc3cccnc3[nH]2)CCO1 ZINC001143211572 961956388 /nfs/dbraw/zinc/95/63/88/961956388.db2.gz FVFGKVYUSSYJLU-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO Cc1csc(C[NH+]2CC3(CSC3)C2)n1 ZINC001204380524 962464477 /nfs/dbraw/zinc/46/44/77/962464477.db2.gz FQBSWZKPQRWXBM-UHFFFAOYSA-N 1 2 226.370 2.000 20 0 BEADLO O=C(c1c[nH]c2cc[nH+]cc12)N1C2CCC1CC2 ZINC001152976777 962510041 /nfs/dbraw/zinc/51/00/41/962510041.db2.gz BOPYONUQQVIOND-UHFFFAOYSA-N 1 2 241.294 2.330 20 0 BEADLO Cc1ncoc1C[NH2+]Cc1nc(C)c(C)s1 ZINC000894297873 962796895 /nfs/dbraw/zinc/79/68/95/962796895.db2.gz GDROMOZCEQAWMI-UHFFFAOYSA-N 1 2 237.328 2.346 20 0 BEADLO COc1ccc2ccc(NCC3COC3)[nH+]c2c1 ZINC001154634311 962819844 /nfs/dbraw/zinc/81/98/44/962819844.db2.gz MROYVWVNKVJWLB-UHFFFAOYSA-N 1 2 244.294 2.302 20 0 BEADLO Cc1cc(NCC2COC2)nc(C(C)(C)C)[nH+]1 ZINC001154638167 962825534 /nfs/dbraw/zinc/82/55/34/962825534.db2.gz PCUNBKAHOGFWCZ-UHFFFAOYSA-N 1 2 235.331 2.141 20 0 BEADLO C[C@H](C(=O)N1CCCCC[C@@H]1C)n1cc[nH+]c1 ZINC001154674974 962833988 /nfs/dbraw/zinc/83/39/88/962833988.db2.gz KYRBIERCVXLMRI-NWDGAFQWSA-N 1 2 235.331 2.235 20 0 BEADLO CC[C@H]1CCN(C(=O)C(C)(C)c2c[nH+]c[nH]2)[C@@H]1C ZINC001154802039 962852400 /nfs/dbraw/zinc/85/24/00/962852400.db2.gz OCTGTJWUSVUGNG-MNOVXSKESA-N 1 2 249.358 2.334 20 0 BEADLO CSc1nc(NC2CC(F)C2)cc(C)[nH+]1 ZINC001154831791 962859732 /nfs/dbraw/zinc/85/97/32/962859732.db2.gz LIRBUDDNVURGAD-UHFFFAOYSA-N 1 2 227.308 2.419 20 0 BEADLO Nc1[nH+]c(NC2CC(F)C2)ccc1Cl ZINC001154844190 962868833 /nfs/dbraw/zinc/86/88/33/962868833.db2.gz UNZXAHHZQDLEAE-UHFFFAOYSA-N 1 2 215.659 2.230 20 0 BEADLO Cc1oncc1CNc1[nH+]c(C)nc2[nH]ccc21 ZINC001154884580 962884855 /nfs/dbraw/zinc/88/48/55/962884855.db2.gz TXKFTYVJIVXBDV-UHFFFAOYSA-N 1 2 243.270 2.175 20 0 BEADLO Cc1cc(NCc2ncon2)nc(C(C)(C)C)[nH+]1 ZINC001154896580 962887096 /nfs/dbraw/zinc/88/70/96/962887096.db2.gz XJRSCZWFEPTRJV-UHFFFAOYSA-N 1 2 247.302 2.078 20 0 BEADLO CCOc1ccc(NC(=[NH2+])C(C)(C)C)nn1 ZINC001155175339 963001081 /nfs/dbraw/zinc/00/10/81/963001081.db2.gz BQIXPPXMIJLPQG-UHFFFAOYSA-N 1 2 222.292 2.311 20 0 BEADLO COC(=O)c1cc2[nH+]c[nH]c2c(NCC(C)C)c1 ZINC001161648373 963020500 /nfs/dbraw/zinc/02/05/00/963020500.db2.gz GBEYGLHSNUQBFA-UHFFFAOYSA-N 1 2 247.298 2.417 20 0 BEADLO Cc1csc(CN2CCC(F)(F)[C@H]([NH3+])C2)c1 ZINC001206657386 963122271 /nfs/dbraw/zinc/12/22/71/963122271.db2.gz QCTMJMFJIDBWMY-SNVBAGLBSA-N 1 2 246.326 2.225 20 0 BEADLO CSCCCNc1nc(C)[nH+]c2c1CCC2 ZINC001155980223 963221398 /nfs/dbraw/zinc/22/13/98/963221398.db2.gz UZMFLBXAVZPYNY-UHFFFAOYSA-N 1 2 237.372 2.439 20 0 BEADLO Cc1nonc1CNc1cc(C)[nH+]c(C(C)C)n1 ZINC001156087497 963253356 /nfs/dbraw/zinc/25/33/56/963253356.db2.gz BAQFPLZIDNGGOB-UHFFFAOYSA-N 1 2 247.302 2.212 20 0 BEADLO Cc1nonc1CNc1cc(C(C)C)[nH+]c(C)n1 ZINC001156084052 963256083 /nfs/dbraw/zinc/25/60/83/963256083.db2.gz BOASSFYHNPQPET-UHFFFAOYSA-N 1 2 247.302 2.212 20 0 BEADLO CCSc1cc[nH+]c(N[C@H](C)CCO)c1 ZINC001156455335 963359543 /nfs/dbraw/zinc/35/95/43/963359543.db2.gz MAZYWBPPPGKLJE-SECBINFHSA-N 1 2 226.345 2.376 20 0 BEADLO CCC/C(C)=C/C(=O)NCc1c[nH+]c(CC)[nH]1 ZINC001156538052 963380223 /nfs/dbraw/zinc/38/02/23/963380223.db2.gz IQLCKKBUVSOYJC-JXMROGBWSA-N 1 2 235.331 2.335 20 0 BEADLO CCCC(C)=CC(=O)NCc1c[nH]c(CC)[nH+]1 ZINC001156538052 963380231 /nfs/dbraw/zinc/38/02/31/963380231.db2.gz IQLCKKBUVSOYJC-JXMROGBWSA-N 1 2 235.331 2.335 20 0 BEADLO CSc1cc[nH+]c(NCc2cccnn2)c1 ZINC001156604072 963405217 /nfs/dbraw/zinc/40/52/17/963405217.db2.gz XQRTWEKRDVDVIG-UHFFFAOYSA-N 1 2 232.312 2.206 20 0 BEADLO CCOc1cccc(NCc2cc[nH+]c(N)c2)n1 ZINC001156757361 963453126 /nfs/dbraw/zinc/45/31/26/963453126.db2.gz STBYJNCNNOZGCG-UHFFFAOYSA-N 1 2 244.298 2.070 20 0 BEADLO CSc1cccc(NCc2cc[nH+]c(N)c2)n1 ZINC001156761186 963454763 /nfs/dbraw/zinc/45/47/63/963454763.db2.gz PUCIGQUNTGTJNP-UHFFFAOYSA-N 1 2 246.339 2.393 20 0 BEADLO CCCN(C)c1cc(C)[nH+]c(SC)n1 ZINC001156872392 963476437 /nfs/dbraw/zinc/47/64/37/963476437.db2.gz YMESAWVSOMAKJV-UHFFFAOYSA-N 1 2 211.334 2.353 20 0 BEADLO COCc1cc[nH+]c(N2CC3CC(C3)C2)c1 ZINC001156888185 963482119 /nfs/dbraw/zinc/48/21/19/963482119.db2.gz YLBGZLCNQYATTK-UHFFFAOYSA-N 1 2 218.300 2.074 20 0 BEADLO CCC(C)(C)C(=O)NCc1[nH]c2c([nH+]1)CCCC2 ZINC001156892047 963484034 /nfs/dbraw/zinc/48/40/34/963484034.db2.gz XHMNDLWEQXRVTL-UHFFFAOYSA-N 1 2 249.358 2.341 20 0 BEADLO CCCOCCNc1[nH+]cc(C)cc1OC ZINC001157090323 963530613 /nfs/dbraw/zinc/53/06/13/963530613.db2.gz YHCRKKKWRGLIFT-UHFFFAOYSA-N 1 2 224.304 2.237 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)C=C2CCC2)[nH+]1 ZINC001157120340 963535285 /nfs/dbraw/zinc/53/52/85/963535285.db2.gz VFDNPMIAOHLDHB-UHFFFAOYSA-N 1 2 233.315 2.260 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)C=C2CCC2)c[nH+]1 ZINC001157120340 963535292 /nfs/dbraw/zinc/53/52/92/963535292.db2.gz VFDNPMIAOHLDHB-UHFFFAOYSA-N 1 2 233.315 2.260 20 0 BEADLO CC(=O)Nc1c(C)cc[nH+]c1N1CCC[C@@H]2C[C@@H]21 ZINC001157143197 963542801 /nfs/dbraw/zinc/54/28/01/963542801.db2.gz GOYNJYRTDLSWCS-NEPJUHHUSA-N 1 2 245.326 2.337 20 0 BEADLO Nc1[nH+]c(N2CCC[C@H]3C[C@H]32)ccc1Cl ZINC001157151183 963547795 /nfs/dbraw/zinc/54/77/95/963547795.db2.gz IJAARPWMNHRBRD-IONNQARKSA-N 1 2 223.707 2.306 20 0 BEADLO CCOC(=O)Cc1ccc(N[C@@H](C)CC)[nH+]c1 ZINC001157239299 963563855 /nfs/dbraw/zinc/56/38/55/963563855.db2.gz ZRUCBWWNUBIDPE-JTQLQIEISA-N 1 2 236.315 2.398 20 0 BEADLO C[C@@H]1C[C@@H]([NH2+]CC(F)(F)C(F)(F)F)CCO1 ZINC001168072665 963602837 /nfs/dbraw/zinc/60/28/37/963602837.db2.gz VXDKRICAZSCEND-RQJHMYQMSA-N 1 2 247.207 2.341 20 0 BEADLO CCSc1cc[nH+]c(N[C@H]2C[C@@H](CO)C2)c1 ZINC001157463527 963620147 /nfs/dbraw/zinc/62/01/47/963620147.db2.gz YTGRIYISSJJTPB-AOOOYVTPSA-N 1 2 238.356 2.376 20 0 BEADLO CCN(CCn1cc[nH+]c1)c1nc(C)ccc1F ZINC001157459564 963620827 /nfs/dbraw/zinc/62/08/27/963620827.db2.gz ALEBZGNSHRLVIR-UHFFFAOYSA-N 1 2 248.305 2.252 20 0 BEADLO CCN(CCn1cc[nH+]c1)c1nccc(F)c1C ZINC001157462426 963621206 /nfs/dbraw/zinc/62/12/06/963621206.db2.gz HWIICJURMHFWJH-UHFFFAOYSA-N 1 2 248.305 2.252 20 0 BEADLO CC1(C)C[C@@H](CNc2ccc(Cl)c(N)[nH+]2)O1 ZINC001157662708 963695591 /nfs/dbraw/zinc/69/55/91/963695591.db2.gz ATYLKFAVHDOYIR-ZETCQYMHSA-N 1 2 241.722 2.297 20 0 BEADLO C1=C(Nc2ccc[nH+]c2N2CCCCC2)COC1 ZINC001203380021 963750694 /nfs/dbraw/zinc/75/06/94/963750694.db2.gz NFRGDKKCCIUGPN-UHFFFAOYSA-N 1 2 245.326 2.398 20 0 BEADLO CCCNc1[nH+]cccc1[Si](C)(C)C ZINC001168130878 963813219 /nfs/dbraw/zinc/81/32/19/963813219.db2.gz VULUJWCZWWUTEL-UHFFFAOYSA-N 1 2 208.381 2.449 20 0 BEADLO Cc1c(F)cc[nH+]c1N[C@H]1CCC[C@@H](O)C1 ZINC001158371160 963857210 /nfs/dbraw/zinc/85/72/10/963857210.db2.gz UKWXNFMDERDZQK-VHSXEESVSA-N 1 2 224.279 2.245 20 0 BEADLO C=Cc1ccc(NC[C@@H]2COC(C)(C)O2)[nH+]c1 ZINC001158926493 963959087 /nfs/dbraw/zinc/95/90/87/963959087.db2.gz QZWTWDDHCCXZAN-LLVKDONJSA-N 1 2 234.299 2.288 20 0 BEADLO Cc1c(F)cc[nH+]c1N1C[C@@H]2CCCC(=O)[C@@H]2C1 ZINC001159002820 963972019 /nfs/dbraw/zinc/97/20/19/963972019.db2.gz YCQVFYPBYIYLMO-WDEREUQCSA-N 1 2 248.301 2.335 20 0 BEADLO Cc1c(F)cc[nH+]c1N1C[C@@H]2CCCC(=O)[C@H]2C1 ZINC001159002819 963973314 /nfs/dbraw/zinc/97/33/14/963973314.db2.gz YCQVFYPBYIYLMO-QWRGUYRKSA-N 1 2 248.301 2.335 20 0 BEADLO Cc1c(F)cc[nH+]c1N1C[C@H]2CCCC(=O)[C@@H]2C1 ZINC001159002817 963974068 /nfs/dbraw/zinc/97/40/68/963974068.db2.gz YCQVFYPBYIYLMO-GHMZBOCLSA-N 1 2 248.301 2.335 20 0 BEADLO Cc1nc(N[C@H]2CCOC[C@@H]2C)c2c([nH+]1)CCC2 ZINC001159712792 964161111 /nfs/dbraw/zinc/16/11/11/964161111.db2.gz ANPZBPBKYPRULA-CABZTGNLSA-N 1 2 247.342 2.111 20 0 BEADLO COC(=O)C[C@@H](C)Nc1cc(SC)cc[nH+]1 ZINC001160534194 964330325 /nfs/dbraw/zinc/33/03/25/964330325.db2.gz UJSBIULFNREXJZ-MRVPVSSYSA-N 1 2 240.328 2.167 20 0 BEADLO Cc1cc(NCC[C@@H](C)CO)nc(C(C)C)[nH+]1 ZINC001160608049 964354841 /nfs/dbraw/zinc/35/48/41/964354841.db2.gz MDWBDKDBNPNMRW-SNVBAGLBSA-N 1 2 237.347 2.339 20 0 BEADLO CSCc1cc[nH+]c(NCC[C@@H](C)CO)c1 ZINC001160608564 964355739 /nfs/dbraw/zinc/35/57/39/964355739.db2.gz XNYCTHDXROTZRX-SNVBAGLBSA-N 1 2 240.372 2.375 20 0 BEADLO c1[nH]c2c(cccc2Nc2cncnc2)[nH+]1 ZINC001213026210 964408845 /nfs/dbraw/zinc/40/88/45/964408845.db2.gz NQBNUEHDHZUWLO-UHFFFAOYSA-N 1 2 211.228 2.097 20 0 BEADLO CN(C)c1cc(NC2(C(F)(F)F)CC2)[nH+]cn1 ZINC001160821757 964416187 /nfs/dbraw/zinc/41/61/87/964416187.db2.gz QFYKHDCEVBECHE-UHFFFAOYSA-N 1 2 246.236 2.049 20 0 BEADLO CN(C)c1cc(NC2(C(F)(F)F)CC2)nc[nH+]1 ZINC001160821757 964416194 /nfs/dbraw/zinc/41/61/94/964416194.db2.gz QFYKHDCEVBECHE-UHFFFAOYSA-N 1 2 246.236 2.049 20 0 BEADLO CCCN(CCC)C(=O)[C@]1(C)CC(F)(F)C[NH2+]1 ZINC001160855790 964417944 /nfs/dbraw/zinc/41/79/44/964417944.db2.gz DUHWRDUJPNMKAO-NSHDSACASA-N 1 2 248.317 2.022 20 0 BEADLO CC[C@H](COC)Nc1[nH+]ccc(F)c1C ZINC001160937527 964449765 /nfs/dbraw/zinc/44/97/65/964449765.db2.gz UKKOUTGPDHYRRX-SECBINFHSA-N 1 2 212.268 2.366 20 0 BEADLO Cc1cc[nH+]c(N[C@H]2CCC(C)(C)C2)c1C(N)=O ZINC001161032450 964489357 /nfs/dbraw/zinc/48/93/57/964489357.db2.gz PZROWDCVIBQVCU-JTQLQIEISA-N 1 2 247.342 2.480 20 0 BEADLO C[C@H]1C[C@H](Nc2ccc(Cl)c(N)[nH+]2)CCO1 ZINC001161695975 964694700 /nfs/dbraw/zinc/69/47/00/964694700.db2.gz JQVCVUJDDZETPP-JGVFFNPUSA-N 1 2 241.722 2.297 20 0 BEADLO O=C(Nc1ccsc1)[C@@H]1CC2CC[NH+]1CC2 ZINC001142626146 964711537 /nfs/dbraw/zinc/71/15/37/964711537.db2.gz FSGZOJUZDOTNEQ-NSHDSACASA-N 1 2 236.340 2.171 20 0 BEADLO Cc1cc2cc(N[C@@H](CO)C(C)C)[nH+]cc2[nH]1 ZINC001161735332 964724410 /nfs/dbraw/zinc/72/44/10/964724410.db2.gz LFMJQILBRWUMFO-LBPRGKRZSA-N 1 2 233.315 2.300 20 0 BEADLO CC(C)Oc1cc(N[C@@H](CO)C(C)C)cc[nH+]1 ZINC001161741002 964727297 /nfs/dbraw/zinc/72/72/97/964727297.db2.gz ZGMMPHXENMDDFS-LBPRGKRZSA-N 1 2 238.331 2.298 20 0 BEADLO Cc1cc(C[N@@H+](C)C2COC2)cc(F)c1F ZINC001143607869 964737138 /nfs/dbraw/zinc/73/71/38/964737138.db2.gz YSMDXNGYYQFCHM-UHFFFAOYSA-N 1 2 227.254 2.104 20 0 BEADLO Cc1cc(C[N@H+](C)C2COC2)cc(F)c1F ZINC001143607869 964737147 /nfs/dbraw/zinc/73/71/47/964737147.db2.gz YSMDXNGYYQFCHM-UHFFFAOYSA-N 1 2 227.254 2.104 20 0 BEADLO Fc1c[nH]c2nc[nH+]c(NCCC(F)(F)F)c12 ZINC001161820415 964769675 /nfs/dbraw/zinc/76/96/75/964769675.db2.gz TXLPATPZSYMDHC-UHFFFAOYSA-N 1 2 248.183 2.413 20 0 BEADLO COc1cc[nH+]cc1NCCC(F)(F)F ZINC001161824581 964775111 /nfs/dbraw/zinc/77/51/11/964775111.db2.gz UVNXQDGLCPYFRK-UHFFFAOYSA-N 1 2 220.194 2.455 20 0 BEADLO Cc1c[nH+]cc(NC2CCOCC2)c1C ZINC001161866007 964800383 /nfs/dbraw/zinc/80/03/83/964800383.db2.gz YRHHDUJPWRPAAQ-UHFFFAOYSA-N 1 2 206.289 2.289 20 0 BEADLO CCCc1cc(NCC2COC2)nc(CCC)[nH+]1 ZINC001161947520 964828941 /nfs/dbraw/zinc/82/89/41/964828941.db2.gz OMMLMVZSVDLDAI-UHFFFAOYSA-N 1 2 249.358 2.440 20 0 BEADLO FC1CC(Nc2cc3cc[nH]c3c[nH+]2)C1 ZINC001162207498 964861723 /nfs/dbraw/zinc/86/17/23/964861723.db2.gz GJMYCCWHUTZVKQ-UHFFFAOYSA-N 1 2 205.236 2.475 20 0 BEADLO CN(C)c1ccc(N[C@H]2CC[C@](C)(O)CC2)[nH+]c1 ZINC001162360727 964942885 /nfs/dbraw/zinc/94/28/85/964942885.db2.gz MZCDBAVDZMFROQ-YEORSEQZSA-N 1 2 249.358 2.253 20 0 BEADLO CNc1ccc(NCc2cccn2C)c[nH+]1 ZINC001162709462 965133681 /nfs/dbraw/zinc/13/36/81/965133681.db2.gz KURQAKMNCWPDDQ-UHFFFAOYSA-N 1 2 216.288 2.074 20 0 BEADLO CCC1(C[NH2+][C@H](C)C(=O)OC(C)(C)C)CC1 ZINC000226774057 965243319 /nfs/dbraw/zinc/24/33/19/965243319.db2.gz VYMUUVQXNJMQLR-SNVBAGLBSA-N 1 2 227.348 2.496 20 0 BEADLO Cc1cnc(NCc2ccc3[nH+]ccn3c2)cn1 ZINC001163135595 965261987 /nfs/dbraw/zinc/26/19/87/965261987.db2.gz GKLPYZYOKUQARP-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO Cc1ccnnc1NCc1ccc2[nH+]ccn2c1 ZINC001163136596 965263326 /nfs/dbraw/zinc/26/33/26/965263326.db2.gz KTRLVWJOGSMNRE-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO CC1(C)C[N@H+](Cc2cc3ccoc3cn2)CCO1 ZINC001232549933 965377846 /nfs/dbraw/zinc/37/78/46/965377846.db2.gz OGZMRPBVSFDUOP-UHFFFAOYSA-N 1 2 246.310 2.439 20 0 BEADLO CC1(C)C[N@@H+](Cc2cc3ccoc3cn2)CCO1 ZINC001232549933 965377857 /nfs/dbraw/zinc/37/78/57/965377857.db2.gz OGZMRPBVSFDUOP-UHFFFAOYSA-N 1 2 246.310 2.439 20 0 BEADLO OC[C@H]1CCCCN1c1cccc(C2CC2)[nH+]1 ZINC001163558661 965449694 /nfs/dbraw/zinc/44/96/94/965449694.db2.gz GQAYASJWJYOFIR-GFCCVEGCSA-N 1 2 232.327 2.310 20 0 BEADLO CN(C)c1[nH+]cnc2[nH]c3cc(F)ccc3c21 ZINC001163572376 965455653 /nfs/dbraw/zinc/45/56/53/965455653.db2.gz NZMYTZXUBJMSJF-UHFFFAOYSA-N 1 2 230.246 2.316 20 0 BEADLO CC(=O)Nc1c(C)cc[nH+]c1N1CC(C)(C)C1 ZINC001163726847 965538743 /nfs/dbraw/zinc/53/87/43/965538743.db2.gz AMEWQUHLGBDRPL-UHFFFAOYSA-N 1 2 233.315 2.195 20 0 BEADLO COCC1CN(c2cc(C)[nH+]c(C(C)(C)C)n2)C1 ZINC001163734685 965551678 /nfs/dbraw/zinc/55/16/78/965551678.db2.gz OZSWUFPESIMNAQ-UHFFFAOYSA-N 1 2 249.358 2.165 20 0 BEADLO C1=CCN(c2[nH+]ccc3c4c([nH]c32)CCC4)C1 ZINC001163922154 965634359 /nfs/dbraw/zinc/63/43/59/965634359.db2.gz WQTFNQDASUIPKI-UHFFFAOYSA-N 1 2 225.295 2.428 20 0 BEADLO Cc1cc2cc(NCc3nonc3C)[nH+]cc2[nH]1 ZINC001164054567 965715962 /nfs/dbraw/zinc/71/59/62/965715962.db2.gz NVFRXAWHNOFAGT-UHFFFAOYSA-N 1 2 243.270 2.175 20 0 BEADLO CSc1cc[nH+]c(N2CC[C@@H](CO)[C@H]2C)c1 ZINC001164056142 965720767 /nfs/dbraw/zinc/72/07/67/965720767.db2.gz IQMHKXOIBSRKBJ-ZJUUUORDSA-N 1 2 238.356 2.011 20 0 BEADLO COc1cc[nH+]cc1NC[C@H]1CC(C)(C)O1 ZINC001168453590 965754900 /nfs/dbraw/zinc/75/49/00/965754900.db2.gz YVWQMNHDRJFCTE-SECBINFHSA-N 1 2 222.288 2.070 20 0 BEADLO CCc1[nH]c(CNc2cc(C(C)C)ncn2)c[nH+]1 ZINC001164243365 965809634 /nfs/dbraw/zinc/80/96/34/965809634.db2.gz LDAKREMEGGEPME-UHFFFAOYSA-N 1 2 245.330 2.498 20 0 BEADLO CCc1[nH]cc(CNc2cc(C(C)C)ncn2)[nH+]1 ZINC001164243365 965809637 /nfs/dbraw/zinc/80/96/37/965809637.db2.gz LDAKREMEGGEPME-UHFFFAOYSA-N 1 2 245.330 2.498 20 0 BEADLO COC1C[NH+]([C@H](C)Cc2cccc(F)c2)C1 ZINC001168474011 965855590 /nfs/dbraw/zinc/85/55/90/965855590.db2.gz JXKNSUXELHKXCY-SNVBAGLBSA-N 1 2 223.291 2.087 20 0 BEADLO CC[C@@H]([NH2+]Cc1nnc[nH]1)c1ccc(C)c(F)c1 ZINC001307641986 965953993 /nfs/dbraw/zinc/95/39/93/965953993.db2.gz CRKYTOWUJKBYQX-GFCCVEGCSA-N 1 2 248.305 2.493 20 0 BEADLO COc1ccc(C)[nH+]c1N1CC[C@]2(CCOC2)C1 ZINC001165251229 966005430 /nfs/dbraw/zinc/00/54/30/966005430.db2.gz MRTGXQCSNZTTDX-AWEZNQCLSA-N 1 2 248.326 2.015 20 0 BEADLO CCc1cccc(C[N@@H+]2CCCCC23COC3)n1 ZINC001235259165 966033667 /nfs/dbraw/zinc/03/36/67/966033667.db2.gz UXJHZOLJVOTTDI-UHFFFAOYSA-N 1 2 246.354 2.399 20 0 BEADLO CCc1cccc(C[N@H+]2CCCCC23COC3)n1 ZINC001235259165 966033690 /nfs/dbraw/zinc/03/36/90/966033690.db2.gz UXJHZOLJVOTTDI-UHFFFAOYSA-N 1 2 246.354 2.399 20 0 BEADLO C[C@H](Cc1cccc(F)c1)[NH+]1CC2(CCO2)C1 ZINC001168494816 966038513 /nfs/dbraw/zinc/03/85/13/966038513.db2.gz DEIJPODSZZSXFH-LLVKDONJSA-N 1 2 235.302 2.231 20 0 BEADLO Fc1c[nH+]ccc1NCCCc1ccncc1 ZINC001165525478 966114801 /nfs/dbraw/zinc/11/48/01/966114801.db2.gz YDGVLEFKVUDLCK-UHFFFAOYSA-N 1 2 231.274 2.082 20 0 BEADLO COc1cccc2[nH+]c(N[C@H](C)CCO)ccc21 ZINC001165866248 966179969 /nfs/dbraw/zinc/17/99/69/966179969.db2.gz GGDJLCBOYQNSLX-SNVBAGLBSA-N 1 2 246.310 2.426 20 0 BEADLO C[C@H](CCO)Nc1ccc(-n2cccc2)c[nH+]1 ZINC001165893293 966195264 /nfs/dbraw/zinc/19/52/64/966195264.db2.gz HYTYDSIITFNXKH-LLVKDONJSA-N 1 2 231.299 2.055 20 0 BEADLO C[C@@H](O)CCn1c[nH+]c(Cc2ccccc2)c1 ZINC000919150198 966292918 /nfs/dbraw/zinc/29/29/18/966292918.db2.gz ISNXDOMVFACRGH-GFCCVEGCSA-N 1 2 230.311 2.245 20 0 BEADLO CC(C)[C@@H](O)Cn1c[nH+]c(Cc2ccccc2)c1 ZINC000919150188 966295081 /nfs/dbraw/zinc/29/50/81/966295081.db2.gz INCSGUACXYTCPR-HNNXBMFYSA-N 1 2 244.338 2.491 20 0 BEADLO CCc1nc(N2CCn3cccc3C2)cc(C)[nH+]1 ZINC001166601903 966318899 /nfs/dbraw/zinc/31/88/99/966318899.db2.gz BYAPZPROFSUGFG-UHFFFAOYSA-N 1 2 242.326 2.169 20 0 BEADLO Nc1[nH+]c(N2CCn3cccc3C2)ccc1Cl ZINC001166605195 966322470 /nfs/dbraw/zinc/32/24/70/966322470.db2.gz YZVUIEIPLXMZHM-UHFFFAOYSA-N 1 2 248.717 2.139 20 0 BEADLO C[C@@H]1CCCN(c2cc(N(C)C)[nH+]cn2)[C@@H]1C ZINC001166612623 966332752 /nfs/dbraw/zinc/33/27/52/966332752.db2.gz XOSSSKZYTDKEFS-GHMZBOCLSA-N 1 2 234.347 2.167 20 0 BEADLO C[C@@H]1CCCN(c2cc(N(C)C)nc[nH+]2)[C@@H]1C ZINC001166612623 966332764 /nfs/dbraw/zinc/33/27/64/966332764.db2.gz XOSSSKZYTDKEFS-GHMZBOCLSA-N 1 2 234.347 2.167 20 0 BEADLO Nc1ccc(-c2ccc3oc(=O)ccc3c2)c[nH+]1 ZINC001236313171 966361760 /nfs/dbraw/zinc/36/17/60/966361760.db2.gz KHAQWCAUKPTIKI-UHFFFAOYSA-N 1 2 238.246 2.437 20 0 BEADLO Cc1cc[nH+]c(Nc2cc[nH]c(=O)c2)c1 ZINC001212262437 966371200 /nfs/dbraw/zinc/37/12/00/966371200.db2.gz CTWDBSAYLFXHFQ-UHFFFAOYSA-N 1 2 201.229 2.234 20 0 BEADLO CCc1cn(CC(F)(F)C(F)F)c[nH+]1 ZINC001166821644 966423155 /nfs/dbraw/zinc/42/31/55/966423155.db2.gz BNIBXZXRBBCXCO-UHFFFAOYSA-N 1 2 210.174 2.346 20 0 BEADLO Cc1c(F)cc[nH+]c1N1CCC[C@@H](CCO)C1 ZINC001166849667 966429084 /nfs/dbraw/zinc/42/90/84/966429084.db2.gz WVACBYNPQRKCFM-NSHDSACASA-N 1 2 238.306 2.128 20 0 BEADLO Cc1c(F)cc[nH+]c1N1CCC[C@H](CCO)C1 ZINC001166849666 966432279 /nfs/dbraw/zinc/43/22/79/966432279.db2.gz WVACBYNPQRKCFM-LLVKDONJSA-N 1 2 238.306 2.128 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCC(=O)[C@@H](C)CC2)o1 ZINC001236590317 966474414 /nfs/dbraw/zinc/47/44/14/966474414.db2.gz ZUZWIFAEKDSHNZ-VIFPVBQESA-N 1 2 236.315 2.092 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCC(=O)[C@@H](C)CC2)o1 ZINC001236590317 966474422 /nfs/dbraw/zinc/47/44/22/966474422.db2.gz ZUZWIFAEKDSHNZ-VIFPVBQESA-N 1 2 236.315 2.092 20 0 BEADLO C[C@@H]1C[C@H](O)CCN1c1cccc(C2CC2)[nH+]1 ZINC001166961457 966483332 /nfs/dbraw/zinc/48/33/32/966483332.db2.gz KBQVSZGNQKZNGA-ZYHUDNBSSA-N 1 2 232.327 2.309 20 0 BEADLO Nc1cc(Nc2[nH+]cccc2CCO)ccc1F ZINC001212337117 966501298 /nfs/dbraw/zinc/50/12/98/966501298.db2.gz XNYZLEFCIMOEDX-UHFFFAOYSA-N 1 2 247.273 2.081 20 0 BEADLO Cc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cnn[nH]1 ZINC001203200927 966542949 /nfs/dbraw/zinc/54/29/49/966542949.db2.gz XUXDNHBZZKKZDT-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1cnn[nH]1 ZINC001203200927 966542957 /nfs/dbraw/zinc/54/29/57/966542957.db2.gz XUXDNHBZZKKZDT-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccccc1[C@@H]1CCC[N@@H+]1Cc1c[nH]nn1 ZINC001203200927 966542960 /nfs/dbraw/zinc/54/29/60/966542960.db2.gz XUXDNHBZZKKZDT-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1c[nH]nn1 ZINC001203200927 966542967 /nfs/dbraw/zinc/54/29/67/966542967.db2.gz XUXDNHBZZKKZDT-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cn[nH]n1 ZINC001203200927 966542972 /nfs/dbraw/zinc/54/29/72/966542972.db2.gz XUXDNHBZZKKZDT-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1cn[nH]n1 ZINC001203200927 966542984 /nfs/dbraw/zinc/54/29/84/966542984.db2.gz XUXDNHBZZKKZDT-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cncc(C)n2)cn1 ZINC001203177025 966545045 /nfs/dbraw/zinc/54/50/45/966545045.db2.gz MFDNOOIEGHXFOW-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cncc(C)n2)cn1 ZINC001203177025 966545054 /nfs/dbraw/zinc/54/50/54/966545054.db2.gz MFDNOOIEGHXFOW-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO CC(C)(O)C=CNc1ccn2cc[nH+]c2c1 ZINC001203216536 966562442 /nfs/dbraw/zinc/56/24/42/966562442.db2.gz KSDCICWWCRJHNI-SNAWJCMRSA-N 1 2 217.272 2.031 20 0 BEADLO COc1cc(Nc2cnoc2)cc(C)[nH+]1 ZINC001203234472 966573790 /nfs/dbraw/zinc/57/37/90/966573790.db2.gz QZCIVMPZKNVDTI-UHFFFAOYSA-N 1 2 205.217 2.130 20 0 BEADLO Cn1cccc1C[N@@H+]1CCC[C@H]1c1ncccn1 ZINC001203270577 966590500 /nfs/dbraw/zinc/59/05/00/966590500.db2.gz JVHSABJTLLEEJM-ZDUSSCGKSA-N 1 2 242.326 2.152 20 0 BEADLO Cn1cccc1C[N@H+]1CCC[C@H]1c1ncccn1 ZINC001203270577 966590512 /nfs/dbraw/zinc/59/05/12/966590512.db2.gz JVHSABJTLLEEJM-ZDUSSCGKSA-N 1 2 242.326 2.152 20 0 BEADLO c1coc(C[N@@H+]2CCc3cccnc3C2)c1 ZINC001203283331 966600543 /nfs/dbraw/zinc/60/05/43/966600543.db2.gz FMORHZAIYZHBOJ-UHFFFAOYSA-N 1 2 214.268 2.233 20 0 BEADLO c1coc(C[N@H+]2CCc3cccnc3C2)c1 ZINC001203283331 966600560 /nfs/dbraw/zinc/60/05/60/966600560.db2.gz FMORHZAIYZHBOJ-UHFFFAOYSA-N 1 2 214.268 2.233 20 0 BEADLO COc1cc(Nc2ccc(C)[nH+]c2C)c(N)cn1 ZINC001203368703 966616988 /nfs/dbraw/zinc/61/69/88/966616988.db2.gz FHACHOBNEXWEHV-UHFFFAOYSA-N 1 2 244.298 2.428 20 0 BEADLO Cc1ccc(Nc2cnc3cccnn32)c(C)[nH+]1 ZINC001203369984 966620968 /nfs/dbraw/zinc/62/09/68/966620968.db2.gz FMQSLKZJGUAFNE-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO COc1ccccc1C[N@@H+]1CCCC(=O)CC1 ZINC001203428854 966640944 /nfs/dbraw/zinc/64/09/44/966640944.db2.gz UVRFMAGIPQDWGX-UHFFFAOYSA-N 1 2 233.311 2.250 20 0 BEADLO COc1ccccc1C[N@H+]1CCCC(=O)CC1 ZINC001203428854 966640957 /nfs/dbraw/zinc/64/09/57/966640957.db2.gz UVRFMAGIPQDWGX-UHFFFAOYSA-N 1 2 233.311 2.250 20 0 BEADLO CCn1ncc(Nc2ccc(NC)[nH+]c2)c1C ZINC001203448832 966649562 /nfs/dbraw/zinc/64/95/62/966649562.db2.gz MFVUNHMXKBNQSW-UHFFFAOYSA-N 1 2 231.303 2.392 20 0 BEADLO CNc1ccc(Nc2cc(F)ccn2)c[nH+]1 ZINC001203446499 966651008 /nfs/dbraw/zinc/65/10/08/966651008.db2.gz BGBZCRJDKLEJHJ-UHFFFAOYSA-N 1 2 218.235 2.401 20 0 BEADLO CCn1cnc(Nc2ccc(NC)[nH+]c2)c1 ZINC001203455385 966652950 /nfs/dbraw/zinc/65/29/50/966652950.db2.gz SECPPOAPVJBXCI-UHFFFAOYSA-N 1 2 217.276 2.083 20 0 BEADLO CCOc1ccccc1C[N@@H+]1CCOCC12CC2 ZINC001203545881 966682382 /nfs/dbraw/zinc/68/23/82/966682382.db2.gz VOZSRHZLYNQQGT-UHFFFAOYSA-N 1 2 247.338 2.450 20 0 BEADLO CCOc1ccccc1C[N@H+]1CCOCC12CC2 ZINC001203545881 966682395 /nfs/dbraw/zinc/68/23/95/966682395.db2.gz VOZSRHZLYNQQGT-UHFFFAOYSA-N 1 2 247.338 2.450 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2nc(Cl)cnc2N)c1 ZINC001203657600 966719965 /nfs/dbraw/zinc/71/99/65/966719965.db2.gz RBXOOYOYBBYGGQ-UHFFFAOYSA-N 1 2 249.705 2.468 20 0 BEADLO CC(=O)OC1C[NH+](Cc2c(C)cc(C)cc2C)C1 ZINC001203742885 966763586 /nfs/dbraw/zinc/76/35/86/966763586.db2.gz AHNSSCWIDLXPID-UHFFFAOYSA-N 1 2 247.338 2.359 20 0 BEADLO COc1cc(C)c(C[N@@H+]2CCC23COC3)cc1C ZINC001203761634 966775251 /nfs/dbraw/zinc/77/52/51/966775251.db2.gz XXUKSQSYKNFAJB-UHFFFAOYSA-N 1 2 247.338 2.287 20 0 BEADLO COc1cc(C)c(C[N@H+]2CCC23COC3)cc1C ZINC001203761634 966775259 /nfs/dbraw/zinc/77/52/59/966775259.db2.gz XXUKSQSYKNFAJB-UHFFFAOYSA-N 1 2 247.338 2.287 20 0 BEADLO C[N@@H+]1CCC12CN(CC1(c3ccccc3)CC1)C2 ZINC001276423891 966791129 /nfs/dbraw/zinc/79/11/29/966791129.db2.gz CDUCRMDKRZRXTJ-UHFFFAOYSA-N 1 2 242.366 2.108 20 0 BEADLO C[N@H+]1CCC12CN(CC1(c3ccccc3)CC1)C2 ZINC001276423891 966791142 /nfs/dbraw/zinc/79/11/42/966791142.db2.gz CDUCRMDKRZRXTJ-UHFFFAOYSA-N 1 2 242.366 2.108 20 0 BEADLO CC[N@H+](Cc1ccc(F)cc1)[C@@H](C)C(=O)OC ZINC001203918399 966821744 /nfs/dbraw/zinc/82/17/44/966821744.db2.gz WAQITJLRSSVMMO-JTQLQIEISA-N 1 2 239.290 2.209 20 0 BEADLO CC[N@@H+](Cc1ccc(F)cc1)[C@@H](C)C(=O)OC ZINC001203918399 966821747 /nfs/dbraw/zinc/82/17/47/966821747.db2.gz WAQITJLRSSVMMO-JTQLQIEISA-N 1 2 239.290 2.209 20 0 BEADLO Cc1ccsc1C[NH+]1CC(N2CCCC2)C1 ZINC001204022298 966857742 /nfs/dbraw/zinc/85/77/42/966857742.db2.gz WCIQYNHVYXDZSP-UHFFFAOYSA-N 1 2 236.384 2.337 20 0 BEADLO Cc1ccsc1CN1CC[N@@H+](C)[C@H](C)C1 ZINC001204023423 966858964 /nfs/dbraw/zinc/85/89/64/966858964.db2.gz HSWUWNOGBNEXQL-LLVKDONJSA-N 1 2 224.373 2.192 20 0 BEADLO C[C@@]1(O)CC[N@H+](Cc2ccsc2)C[C@@H]1F ZINC001204034662 966860471 /nfs/dbraw/zinc/86/04/71/966860471.db2.gz JVCFYNGWMWLFBA-WDEREUQCSA-N 1 2 229.320 2.043 20 0 BEADLO C[C@@]1(O)CC[N@@H+](Cc2ccsc2)C[C@@H]1F ZINC001204034662 966860473 /nfs/dbraw/zinc/86/04/73/966860473.db2.gz JVCFYNGWMWLFBA-WDEREUQCSA-N 1 2 229.320 2.043 20 0 BEADLO Cc1cccc(C[N@@H+]2CCc3ncccc3C2)n1 ZINC001204068426 966875691 /nfs/dbraw/zinc/87/56/91/966875691.db2.gz HLIPMBOCSKMKFB-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1cccc(C[N@H+]2CCc3ncccc3C2)n1 ZINC001204068426 966875694 /nfs/dbraw/zinc/87/56/94/966875694.db2.gz HLIPMBOCSKMKFB-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1cnc2c(c1)C[N@@H+](Cc1ccccn1)CC2 ZINC001204064845 966876171 /nfs/dbraw/zinc/87/61/71/966876171.db2.gz FYKRLVNAKHOQAF-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1cnc2c(c1)C[N@H+](Cc1ccccn1)CC2 ZINC001204064845 966876175 /nfs/dbraw/zinc/87/61/75/966876175.db2.gz FYKRLVNAKHOQAF-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2cccnc2)C[C@H]1F ZINC001204072696 966879429 /nfs/dbraw/zinc/87/94/29/966879429.db2.gz SGSCKOCXOVHTDX-VXGBXAGGSA-N 1 2 226.270 2.354 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2cccnc2)C[C@H]1F ZINC001204072696 966879427 /nfs/dbraw/zinc/87/94/27/966879427.db2.gz SGSCKOCXOVHTDX-VXGBXAGGSA-N 1 2 226.270 2.354 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2cccnc2)C[C@H]1F ZINC001204072693 966880753 /nfs/dbraw/zinc/88/07/53/966880753.db2.gz SGSCKOCXOVHTDX-NEPJUHHUSA-N 1 2 226.270 2.354 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2cccnc2)C[C@H]1F ZINC001204072693 966880759 /nfs/dbraw/zinc/88/07/59/966880759.db2.gz SGSCKOCXOVHTDX-NEPJUHHUSA-N 1 2 226.270 2.354 20 0 BEADLO Oc1ccc(C[N@@H+]2CCn3cccc3C2)cc1 ZINC001204094122 966890015 /nfs/dbraw/zinc/89/00/15/966890015.db2.gz YRSUVXPJBQFAQK-UHFFFAOYSA-N 1 2 228.295 2.210 20 0 BEADLO Oc1ccc(C[N@H+]2CCn3cccc3C2)cc1 ZINC001204094122 966890018 /nfs/dbraw/zinc/89/00/18/966890018.db2.gz YRSUVXPJBQFAQK-UHFFFAOYSA-N 1 2 228.295 2.210 20 0 BEADLO CCn1ccc(C[N@@H+]2CCc3ccccc3C2)n1 ZINC001204144316 966903888 /nfs/dbraw/zinc/90/38/88/966903888.db2.gz FWGHWNPIKGPGPF-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO CCn1ccc(C[N@H+]2CCc3ccccc3C2)n1 ZINC001204144316 966903893 /nfs/dbraw/zinc/90/38/93/966903893.db2.gz FWGHWNPIKGPGPF-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO CCN1C[C@@H](C)[N@H+](Cc2ccc(C)cc2)CC1=O ZINC001204175623 966918602 /nfs/dbraw/zinc/91/86/02/966918602.db2.gz XIASHIQARXJLLP-CYBMUJFWSA-N 1 2 246.354 2.048 20 0 BEADLO CCN1C[C@@H](C)[N@@H+](Cc2ccc(C)cc2)CC1=O ZINC001204175623 966918609 /nfs/dbraw/zinc/91/86/09/966918609.db2.gz XIASHIQARXJLLP-CYBMUJFWSA-N 1 2 246.354 2.048 20 0 BEADLO CC(C)(C)c1nnc(Nc2ccc[nH+]c2N)o1 ZINC001212389688 966998993 /nfs/dbraw/zinc/99/89/93/966998993.db2.gz XLIFSYYDYMMPCZ-UHFFFAOYSA-N 1 2 233.275 2.088 20 0 BEADLO CCOC1C[NH+](Cc2cccc(F)c2C)C1 ZINC001204508844 967010420 /nfs/dbraw/zinc/01/04/20/967010420.db2.gz TYAULTBQOUTMNM-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO COC(=O)[C@H]1CCC[N@@H+]1Cc1cc(C)c(C)o1 ZINC001204536762 967035022 /nfs/dbraw/zinc/03/50/22/967035022.db2.gz LSAKZIJFKJQNGK-GFCCVEGCSA-N 1 2 237.299 2.034 20 0 BEADLO COC(=O)[C@H]1CCC[N@H+]1Cc1cc(C)c(C)o1 ZINC001204536762 967035027 /nfs/dbraw/zinc/03/50/27/967035027.db2.gz LSAKZIJFKJQNGK-GFCCVEGCSA-N 1 2 237.299 2.034 20 0 BEADLO Cc1nc[nH]c1C[N@H+](Cc1ccco1)C1CC1 ZINC001204593353 967093447 /nfs/dbraw/zinc/09/34/47/967093447.db2.gz WVRNMJJDIAXRMJ-UHFFFAOYSA-N 1 2 231.299 2.476 20 0 BEADLO Cc1nc[nH]c1C[N@@H+](Cc1ccco1)C1CC1 ZINC001204593353 967093458 /nfs/dbraw/zinc/09/34/58/967093458.db2.gz WVRNMJJDIAXRMJ-UHFFFAOYSA-N 1 2 231.299 2.476 20 0 BEADLO COc1ccc(C[N@@H+]2C[C@@H](F)C[C@H]2C)nc1C ZINC001249892198 967131199 /nfs/dbraw/zinc/13/11/99/967131199.db2.gz NJPYBXKLOWIQSV-KOLCDFICSA-N 1 2 238.306 2.331 20 0 BEADLO COc1ccc(C[N@H+]2C[C@@H](F)C[C@H]2C)nc1C ZINC001249892198 967131206 /nfs/dbraw/zinc/13/12/06/967131206.db2.gz NJPYBXKLOWIQSV-KOLCDFICSA-N 1 2 238.306 2.331 20 0 BEADLO COc1cc(C[N@@H+]2CC[C@@H]2C)cnc1Cl ZINC001249917352 967156515 /nfs/dbraw/zinc/15/65/15/967156515.db2.gz MXJYVFCIDMJCAW-QMMMGPOBSA-N 1 2 226.707 2.338 20 0 BEADLO COc1cc(C[N@H+]2CC[C@@H]2C)cnc1Cl ZINC001249917352 967156519 /nfs/dbraw/zinc/15/65/19/967156519.db2.gz MXJYVFCIDMJCAW-QMMMGPOBSA-N 1 2 226.707 2.338 20 0 BEADLO CO[C@H](C)C1C[NH+](Cc2nc3ccccc3[nH]2)C1 ZINC001204800709 967174101 /nfs/dbraw/zinc/17/41/01/967174101.db2.gz ZXDYHRYOXIWBSQ-SNVBAGLBSA-N 1 2 245.326 2.030 20 0 BEADLO CO[C@@H](C)C1C[NH+](Cc2nc3ccccc3[nH]2)C1 ZINC001204800706 967177913 /nfs/dbraw/zinc/17/79/13/967177913.db2.gz ZXDYHRYOXIWBSQ-JTQLQIEISA-N 1 2 245.326 2.030 20 0 BEADLO CCOC(=O)CCCc1ccn2cc[nH+]c2c1 ZINC001249974570 967218405 /nfs/dbraw/zinc/21/84/05/967218405.db2.gz PJZRPINAXLTRSX-UHFFFAOYSA-N 1 2 232.283 2.220 20 0 BEADLO CCOC(=O)CCCc1cc[nH+]c(NC)c1 ZINC001249975677 967218793 /nfs/dbraw/zinc/21/87/93/967218793.db2.gz SGRPFFCJQJCUMG-UHFFFAOYSA-N 1 2 222.288 2.009 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)Cc1cc2cccnc2o1 ZINC001204916871 967233959 /nfs/dbraw/zinc/23/39/59/967233959.db2.gz UVDQWACHFITIRD-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)Cc1cc2cccnc2o1 ZINC001204916871 967233973 /nfs/dbraw/zinc/23/39/73/967233973.db2.gz UVDQWACHFITIRD-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO c1cn2ccc(Nc3ccon3)cc2[nH+]1 ZINC001204943326 967245262 /nfs/dbraw/zinc/24/52/62/967245262.db2.gz HANKDXDSCMSFKM-UHFFFAOYSA-N 1 2 200.201 2.066 20 0 BEADLO Cc1ccc(C)c(Nc2ccc3nncn3c2)[nH+]1 ZINC001250000283 967257076 /nfs/dbraw/zinc/25/70/76/967257076.db2.gz LKNNAVHOOHMFSS-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cc1c(C)c(-c2c[nH+]cn2C)ccc1CO ZINC001204963455 967259539 /nfs/dbraw/zinc/25/95/39/967259539.db2.gz ZLBZMRFVLZNZBE-UHFFFAOYSA-N 1 2 216.284 2.196 20 0 BEADLO CC(=O)[C@H]1C[N@H+](Cc2cccc(C)c2C)CCO1 ZINC001205103852 967350501 /nfs/dbraw/zinc/35/05/01/967350501.db2.gz WKIAAOBWHLBNQD-OAHLLOKOSA-N 1 2 247.338 2.093 20 0 BEADLO CC(=O)[C@H]1C[N@@H+](Cc2cccc(C)c2C)CCO1 ZINC001205103852 967350513 /nfs/dbraw/zinc/35/05/13/967350513.db2.gz WKIAAOBWHLBNQD-OAHLLOKOSA-N 1 2 247.338 2.093 20 0 BEADLO Nc1cc(C(F)(F)F)c(C[C@H]2CCCO2)c[nH+]1 ZINC001250103756 967380050 /nfs/dbraw/zinc/38/00/50/967380050.db2.gz OUJYWMPXRWAXFA-MRVPVSSYSA-N 1 2 246.232 2.404 20 0 BEADLO CCOc1nccc(-c2ccc3[nH+]ccn3c2)n1 ZINC001240214667 967424256 /nfs/dbraw/zinc/42/42/56/967424256.db2.gz PHSFPSJTHCCCGU-UHFFFAOYSA-N 1 2 240.266 2.190 20 0 BEADLO COC(=O)CCCc1ccc(C)[nH+]c1C ZINC001250144892 967433188 /nfs/dbraw/zinc/43/31/88/967433188.db2.gz CHTFQGWVNGZACL-UHFFFAOYSA-N 1 2 207.273 2.194 20 0 BEADLO c1cn2ccc(Cc3cccnc3)cc2[nH+]1 ZINC001250170069 967469083 /nfs/dbraw/zinc/46/90/83/967469083.db2.gz LJXAMFIPHGIYES-UHFFFAOYSA-N 1 2 209.252 2.320 20 0 BEADLO Cc1c(-c2cnn(C)c2)ccc2[nH+]ccn21 ZINC001240297761 967500038 /nfs/dbraw/zinc/50/00/38/967500038.db2.gz PRBOKMSNULDWEQ-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(F)c2n[nH]cc21 ZINC001205337527 967547506 /nfs/dbraw/zinc/54/75/06/967547506.db2.gz PGUGVDDGQXCABI-UHFFFAOYSA-N 1 2 216.219 2.103 20 0 BEADLO COC[C@H](Nc1ccc(Cl)c(N)[nH+]1)C1CC1 ZINC001161726665 967619150 /nfs/dbraw/zinc/61/91/50/967619150.db2.gz PJMUKSGBWLVVIL-VIFPVBQESA-N 1 2 241.722 2.154 20 0 BEADLO CCOc1cc(C[NH+](C)C)c(Cl)cn1 ZINC001250303541 967634829 /nfs/dbraw/zinc/63/48/29/967634829.db2.gz LXMZCGCGINKDGY-UHFFFAOYSA-N 1 2 214.696 2.195 20 0 BEADLO Cc1ccc(Nc2cnn(C3COC3)c2)c(C)[nH+]1 ZINC001205537703 967672133 /nfs/dbraw/zinc/67/21/33/967672133.db2.gz SOZNXULRAJMGHV-UHFFFAOYSA-N 1 2 244.298 2.210 20 0 BEADLO c1cnn(-c2ccc(CCn3cc[nH+]c3)cc2)c1 ZINC001250316207 967679366 /nfs/dbraw/zinc/67/93/66/967679366.db2.gz DGUBTYJUAUKNBU-UHFFFAOYSA-N 1 2 238.294 2.312 20 0 BEADLO Oc1cc(F)c(CCn2cc[nH+]c2)c(F)c1 ZINC001250316569 967685642 /nfs/dbraw/zinc/68/56/42/967685642.db2.gz NBVLAMONYBVXJZ-UHFFFAOYSA-N 1 2 224.210 2.110 20 0 BEADLO CC(=O)c1ccccc1CCn1cc[nH+]c1 ZINC001250316586 967688188 /nfs/dbraw/zinc/68/81/88/967688188.db2.gz NQZZUSQUEZUZPW-UHFFFAOYSA-N 1 2 214.268 2.328 20 0 BEADLO Cn1cc2cccc(CCn3cc[nH+]c3)c2n1 ZINC001250316686 967690369 /nfs/dbraw/zinc/69/03/69/967690369.db2.gz SQOKULIEQMMLSZ-UHFFFAOYSA-N 1 2 226.283 2.013 20 0 BEADLO c1cn(CCc2cccnc2C2CC2)c[nH+]1 ZINC001250319540 967694830 /nfs/dbraw/zinc/69/48/30/967694830.db2.gz URGCVRZYNPZRGG-UHFFFAOYSA-N 1 2 213.284 2.398 20 0 BEADLO C[C@@H](O)c1ccc(CCn2cc[nH+]c2)cc1 ZINC001250318931 967694874 /nfs/dbraw/zinc/69/48/74/967694874.db2.gz MSVDLCYQCIHOEP-LLVKDONJSA-N 1 2 216.284 2.179 20 0 BEADLO Oc1cc(CCn2cc[nH+]c2)ccc1Cl ZINC001250319523 967695174 /nfs/dbraw/zinc/69/51/74/967695174.db2.gz TUJQBSSFIXQHIR-UHFFFAOYSA-N 1 2 222.675 2.485 20 0 BEADLO Cc1cc(Cl)ncc1CCn1cc[nH+]c1 ZINC001250319952 967696084 /nfs/dbraw/zinc/69/60/84/967696084.db2.gz GWSBABLBZYZDFC-UHFFFAOYSA-N 1 2 221.691 2.483 20 0 BEADLO CCc1cncc(CCn2cc[nH+]c2)c1 ZINC001250319978 967697400 /nfs/dbraw/zinc/69/74/00/967697400.db2.gz WJESLSRVNUKVFV-UHFFFAOYSA-N 1 2 201.273 2.083 20 0 BEADLO c1cn(CCc2cccc3[nH]cnc32)c[nH+]1 ZINC001250320072 967698135 /nfs/dbraw/zinc/69/81/35/967698135.db2.gz XNDDHVLPNNYBKG-UHFFFAOYSA-N 1 2 212.256 2.002 20 0 BEADLO CCc1coc(CNc2ccc(N(C)C)c[nH+]2)n1 ZINC001162140104 967701986 /nfs/dbraw/zinc/70/19/86/967701986.db2.gz JTCZLCIGVYTBJX-UHFFFAOYSA-N 1 2 246.314 2.310 20 0 BEADLO c1cnc(Cc2ccc(N3CCCC3)[nH+]c2)nc1 ZINC001250344213 967738211 /nfs/dbraw/zinc/73/82/11/967738211.db2.gz XRKHASRONMWMGA-UHFFFAOYSA-N 1 2 240.310 2.063 20 0 BEADLO Cn1ccc2cc(Nc3[nH+]cccc3N)cnc21 ZINC001205671659 967762056 /nfs/dbraw/zinc/76/20/56/967762056.db2.gz GXPSYCYYPBAETE-UHFFFAOYSA-N 1 2 239.282 2.294 20 0 BEADLO Cc1cccnc1C[N@H+](C)Cc1cncs1 ZINC001205813625 967832264 /nfs/dbraw/zinc/83/22/64/967832264.db2.gz CMJIHLDUQCUSTH-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cccnc1C[N@@H+](C)Cc1cncs1 ZINC001205813625 967832268 /nfs/dbraw/zinc/83/22/68/967832268.db2.gz CMJIHLDUQCUSTH-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CC(C)Cc1[nH]c2cc3c(cc2[nH+]1)OCC(=O)N3 ZINC001250425386 967838378 /nfs/dbraw/zinc/83/83/78/967838378.db2.gz FBVRSSROGMFOIC-UHFFFAOYSA-N 1 2 245.282 2.092 20 0 BEADLO CCCc1[nH]c2ccc(OCOC)cc2[nH+]1 ZINC001250426125 967839149 /nfs/dbraw/zinc/83/91/49/967839149.db2.gz DHWVBXFPQFPMDC-UHFFFAOYSA-N 1 2 220.272 2.498 20 0 BEADLO CCCc1[nH]c2cc3c(cc2[nH+]1)OCC3 ZINC001250426086 967840995 /nfs/dbraw/zinc/84/09/95/967840995.db2.gz AYWFCXCRTIOJFO-UHFFFAOYSA-N 1 2 202.257 2.450 20 0 BEADLO c1cn(Cc2ccc(-c3ncccn3)cc2)c[nH+]1 ZINC001250445175 967872361 /nfs/dbraw/zinc/87/23/61/967872361.db2.gz JJCPOJXQLHOOLR-UHFFFAOYSA-N 1 2 236.278 2.388 20 0 BEADLO Cc1cc(C)c(Nc2cnn3cccnc23)c[nH+]1 ZINC001205952486 967899944 /nfs/dbraw/zinc/89/99/44/967899944.db2.gz YFOIEMLKSQYYHR-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO c1cc2nccc(-c3ccc4[nH+]ccn4c3)n2n1 ZINC001250480457 967926205 /nfs/dbraw/zinc/92/62/05/967926205.db2.gz SWYIWGRWQPTIBZ-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO CCc1ccc(C)[nH+]c1Nc1ccn(C)c(=O)c1 ZINC001206071483 968039827 /nfs/dbraw/zinc/03/98/27/968039827.db2.gz SYDBXNARROJNJY-UHFFFAOYSA-N 1 2 243.310 2.395 20 0 BEADLO c1c2c(cc3[nH+]c([C@@H]4CCCOC4)[nH]c13)OCC2 ZINC001250551230 968056713 /nfs/dbraw/zinc/05/67/13/968056713.db2.gz LWPKLKSHIOUSDU-SNVBAGLBSA-N 1 2 244.294 2.392 20 0 BEADLO Cc1cc(F)cc2[nH+]c(CCn3cccn3)[nH]c21 ZINC001250563326 968076119 /nfs/dbraw/zinc/07/61/19/968076119.db2.gz XZCPEQDEGKCWSM-UHFFFAOYSA-N 1 2 244.273 2.450 20 0 BEADLO C[C@@H](C(=O)N[C@H]1CC[C@@H](C)[C@@H](C)C1)n1cc[nH+]c1 ZINC001320394352 1169916314 /nfs/dbraw/zinc/91/63/14/1169916314.db2.gz IUWBIGNDJGBQAD-VOAKCMCISA-N 1 2 249.358 2.385 20 0 BEADLO Cn1cnc(C[N@@H+]2CCCC[C@](C)(F)C2)c1 ZINC001206207027 968133746 /nfs/dbraw/zinc/13/37/46/968133746.db2.gz NAVMUUBUPCGPTH-LBPRGKRZSA-N 1 2 225.311 2.134 20 0 BEADLO Cn1cnc(C[N@H+]2CCCC[C@](C)(F)C2)c1 ZINC001206207027 968133752 /nfs/dbraw/zinc/13/37/52/968133752.db2.gz NAVMUUBUPCGPTH-LBPRGKRZSA-N 1 2 225.311 2.134 20 0 BEADLO Cc1cccc2c1C[N@H+](C[C@H](O)C(F)(F)F)C2 ZINC001250965675 968226314 /nfs/dbraw/zinc/22/63/14/968226314.db2.gz VXAYWSUOWJGKHN-NSHDSACASA-N 1 2 245.244 2.234 20 0 BEADLO Cc1cccc2c1C[N@@H+](C[C@H](O)C(F)(F)F)C2 ZINC001250965675 968226323 /nfs/dbraw/zinc/22/63/23/968226323.db2.gz VXAYWSUOWJGKHN-NSHDSACASA-N 1 2 245.244 2.234 20 0 BEADLO Cc1cccc2c1C[N@H+](C[C@@H](O)C(F)(F)F)C2 ZINC001250965674 968229044 /nfs/dbraw/zinc/22/90/44/968229044.db2.gz VXAYWSUOWJGKHN-LLVKDONJSA-N 1 2 245.244 2.234 20 0 BEADLO Cc1cccc2c1C[N@@H+](C[C@@H](O)C(F)(F)F)C2 ZINC001250965674 968229055 /nfs/dbraw/zinc/22/90/55/968229055.db2.gz VXAYWSUOWJGKHN-LLVKDONJSA-N 1 2 245.244 2.234 20 0 BEADLO Cc1cccc2c1C[N@H+](Cc1ccnn1C)C2 ZINC001206322787 968229823 /nfs/dbraw/zinc/22/98/23/968229823.db2.gz OGSSVVNCQYFOQX-UHFFFAOYSA-N 1 2 227.311 2.244 20 0 BEADLO Cc1cccc2c1C[N@@H+](Cc1ccnn1C)C2 ZINC001206322787 968229830 /nfs/dbraw/zinc/22/98/30/968229830.db2.gz OGSSVVNCQYFOQX-UHFFFAOYSA-N 1 2 227.311 2.244 20 0 BEADLO FC(F)n1cccc1C[N@@H+]1CC[C@@]12CCOC2 ZINC001206328635 968235994 /nfs/dbraw/zinc/23/59/94/968235994.db2.gz MIDJOKNZWGUNQY-LBPRGKRZSA-N 1 2 242.269 2.248 20 0 BEADLO FC(F)n1cccc1C[N@H+]1CC[C@@]12CCOC2 ZINC001206328635 968236001 /nfs/dbraw/zinc/23/60/01/968236001.db2.gz MIDJOKNZWGUNQY-LBPRGKRZSA-N 1 2 242.269 2.248 20 0 BEADLO Cc1c(F)cc[nH+]c1N1CC[C@@]2(CCOC2)C1 ZINC001165253549 968276190 /nfs/dbraw/zinc/27/61/90/968276190.db2.gz IKKRPKDBKFDXBW-CYBMUJFWSA-N 1 2 236.290 2.146 20 0 BEADLO C[C@@H](C(=O)NC[C@@H]1CCCC[C@H]1C)n1cc[nH+]c1 ZINC001251289284 968278581 /nfs/dbraw/zinc/27/85/81/968278581.db2.gz ZWIWWHIBELRKPC-AGIUHOORSA-N 1 2 249.358 2.387 20 0 BEADLO C[C@@H](CN(C)c1cc(N)nc[nH+]1)c1ccccc1 ZINC001251645930 968299631 /nfs/dbraw/zinc/29/96/31/968299631.db2.gz RVIMWZQESLDMCC-NSHDSACASA-N 1 2 242.326 2.299 20 0 BEADLO COc1cc(Nc2ccc[nH]c2=O)cc(C)[nH+]1 ZINC001206440071 968305974 /nfs/dbraw/zinc/30/59/74/968305974.db2.gz VIOIWMVAASWJLG-UHFFFAOYSA-N 1 2 231.255 2.243 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H]2C[C@H]2CC(C)C)[nH+]c1C ZINC000821429199 968488465 /nfs/dbraw/zinc/48/84/65/968488465.db2.gz FYWYPXNZICZHSG-VXGBXAGGSA-N 1 2 249.358 2.325 20 0 BEADLO Cc1ccnc(C[N@H+](C)Cc2cnc(C)nc2)c1 ZINC001206853986 968499638 /nfs/dbraw/zinc/49/96/38/968499638.db2.gz LQJVFBKQTGLXNB-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccnc(C[N@@H+](C)Cc2cnc(C)nc2)c1 ZINC001206853986 968499640 /nfs/dbraw/zinc/49/96/40/968499640.db2.gz LQJVFBKQTGLXNB-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO c1cnc(C[NH+]2CC3(C2)CCCCC3)nc1 ZINC001207015536 968550642 /nfs/dbraw/zinc/55/06/42/968550642.db2.gz AOWVAHMMTGWPCY-UHFFFAOYSA-N 1 2 217.316 2.243 20 0 BEADLO Cc1ccnc(N)c1C[N@H+](C)Cc1ccco1 ZINC000823701150 968557293 /nfs/dbraw/zinc/55/72/93/968557293.db2.gz ZAPLGFUELGOPTN-UHFFFAOYSA-N 1 2 231.299 2.197 20 0 BEADLO Cc1ccnc(N)c1C[N@@H+](C)Cc1ccco1 ZINC000823701150 968557299 /nfs/dbraw/zinc/55/72/99/968557299.db2.gz ZAPLGFUELGOPTN-UHFFFAOYSA-N 1 2 231.299 2.197 20 0 BEADLO C[N@H+](Cc1ccncc1)Cc1ccc(F)cn1 ZINC001207038030 968567490 /nfs/dbraw/zinc/56/74/90/968567490.db2.gz FQYYSFKJLAZHHC-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[N@@H+](Cc1ccncc1)Cc1ccc(F)cn1 ZINC001207038030 968567494 /nfs/dbraw/zinc/56/74/94/968567494.db2.gz FQYYSFKJLAZHHC-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO COC(=O)c1c[nH]c2nc[nH+]c(C=C(C)C)c12 ZINC001240634009 968586413 /nfs/dbraw/zinc/58/64/13/968586413.db2.gz UJJNYBLHBCMXAR-UHFFFAOYSA-N 1 2 231.255 2.119 20 0 BEADLO Cc1ncc(C[N@@H+]2CCCC(=O)[C@H](C)C2)s1 ZINC001207059167 968591888 /nfs/dbraw/zinc/59/18/88/968591888.db2.gz UVLOGLPZXDSWKC-SECBINFHSA-N 1 2 238.356 2.253 20 0 BEADLO Cc1ncc(C[N@H+]2CCCC(=O)[C@H](C)C2)s1 ZINC001207059167 968591892 /nfs/dbraw/zinc/59/18/92/968591892.db2.gz UVLOGLPZXDSWKC-SECBINFHSA-N 1 2 238.356 2.253 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2cccnc2C)cn1 ZINC001207080494 968615252 /nfs/dbraw/zinc/61/52/52/968615252.db2.gz OSGDTDCUUOHALD-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2cccnc2C)cn1 ZINC001207080494 968615260 /nfs/dbraw/zinc/61/52/60/968615260.db2.gz OSGDTDCUUOHALD-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO CSCC[N@H+](C)Cc1ncc(F)cc1F ZINC001207102533 968628169 /nfs/dbraw/zinc/62/81/69/968628169.db2.gz NOGVEYMFSYQFMW-UHFFFAOYSA-N 1 2 232.299 2.155 20 0 BEADLO CSCC[N@@H+](C)Cc1ncc(F)cc1F ZINC001207102533 968628174 /nfs/dbraw/zinc/62/81/74/968628174.db2.gz NOGVEYMFSYQFMW-UHFFFAOYSA-N 1 2 232.299 2.155 20 0 BEADLO Fc1cnc(C[N@@H+]2CCC[C@H]3C[C@H]32)c(F)c1 ZINC001207100963 968629168 /nfs/dbraw/zinc/62/91/68/968629168.db2.gz FUXVZYBVDFDTPE-QPUJVOFHSA-N 1 2 224.254 2.344 20 0 BEADLO Fc1cnc(C[N@H+]2CCC[C@H]3C[C@H]32)c(F)c1 ZINC001207100963 968629181 /nfs/dbraw/zinc/62/91/81/968629181.db2.gz FUXVZYBVDFDTPE-QPUJVOFHSA-N 1 2 224.254 2.344 20 0 BEADLO CCc1[nH+]ccc(C)c1NCC(C)(C)O ZINC001252350472 968629998 /nfs/dbraw/zinc/62/99/98/968629998.db2.gz HCJYRMQYAYJIFD-UHFFFAOYSA-N 1 2 208.305 2.135 20 0 BEADLO Cc1ncccc1C[N@H+](C)Cc1ccno1 ZINC001207154054 968660158 /nfs/dbraw/zinc/66/01/58/968660158.db2.gz LIMKLXIXGKJFTC-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ccnc(C)n2)cn1 ZINC001207170509 968673109 /nfs/dbraw/zinc/67/31/09/968673109.db2.gz STVSORQVDAGXLE-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ccnc(C)n2)cn1 ZINC001207170509 968673114 /nfs/dbraw/zinc/67/31/14/968673114.db2.gz STVSORQVDAGXLE-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO C=Cc1ccc(C[NH+]2CCOCC2)cc1OC ZINC001240833802 968733917 /nfs/dbraw/zinc/73/39/17/968733917.db2.gz NBVHKYKSSIUXMN-UHFFFAOYSA-N 1 2 233.311 2.170 20 0 BEADLO CCc1noc(C[N@@H+]2CC(C)(C)C2(C)C)n1 ZINC001252638801 968888213 /nfs/dbraw/zinc/88/82/13/968888213.db2.gz ZARFRPWZBNMPKD-UHFFFAOYSA-N 1 2 223.320 2.252 20 0 BEADLO CCc1noc(C[N@H+]2CC(C)(C)C2(C)C)n1 ZINC001252638801 968888217 /nfs/dbraw/zinc/88/82/17/968888217.db2.gz ZARFRPWZBNMPKD-UHFFFAOYSA-N 1 2 223.320 2.252 20 0 BEADLO CC(=O)C[N@H+](C)CCc1c(F)cccc1F ZINC001208112366 969007314 /nfs/dbraw/zinc/00/73/14/969007314.db2.gz LMECCMXPSTWKHZ-UHFFFAOYSA-N 1 2 227.254 2.028 20 0 BEADLO CC(=O)C[N@@H+](C)CCc1c(F)cccc1F ZINC001208112366 969007322 /nfs/dbraw/zinc/00/73/22/969007322.db2.gz LMECCMXPSTWKHZ-UHFFFAOYSA-N 1 2 227.254 2.028 20 0 BEADLO c1cn2cc(-c3cncs3)ccc2[nH+]1 ZINC001241497472 969011988 /nfs/dbraw/zinc/01/19/88/969011988.db2.gz JXOPUPDGICNXRR-UHFFFAOYSA-N 1 2 201.254 2.458 20 0 BEADLO CS[C@H](C)CC[N@@H+]1CCC(F)(F)C1 ZINC001208136958 969040833 /nfs/dbraw/zinc/04/08/33/969040833.db2.gz DUJLLUKKJGQJMJ-MRVPVSSYSA-N 1 2 209.305 2.469 20 0 BEADLO CS[C@H](C)CC[N@H+]1CCC(F)(F)C1 ZINC001208136958 969040841 /nfs/dbraw/zinc/04/08/41/969040841.db2.gz DUJLLUKKJGQJMJ-MRVPVSSYSA-N 1 2 209.305 2.469 20 0 BEADLO CS[C@@H](C)CC[N@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001208139464 969056113 /nfs/dbraw/zinc/05/61/13/969056113.db2.gz RVRZDUJHGHZZHG-XHNCKOQMSA-N 1 2 209.305 2.120 20 0 BEADLO CS[C@@H](C)CC[N@@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001208139464 969056125 /nfs/dbraw/zinc/05/61/25/969056125.db2.gz RVRZDUJHGHZZHG-XHNCKOQMSA-N 1 2 209.305 2.120 20 0 BEADLO Cc1cc(-c2ccc(CC(N)=O)cc2)cc(C)[nH+]1 ZINC001241992840 969157629 /nfs/dbraw/zinc/15/76/29/969157629.db2.gz SVVHKRNCGGJZKO-UHFFFAOYSA-N 1 2 240.306 2.393 20 0 BEADLO COC(=O)c1cc(-c2[nH]cc[nH+]2)c(C)cc1F ZINC001242013952 969165043 /nfs/dbraw/zinc/16/50/43/969165043.db2.gz AEIGLTDGTGFEMB-UHFFFAOYSA-N 1 2 234.230 2.311 20 0 BEADLO c1c[nH]c(-c2ccc(Cn3cc[nH+]c3)cc2)n1 ZINC001242018457 969170657 /nfs/dbraw/zinc/17/06/57/969170657.db2.gz OHONGVCGCUQHCX-UHFFFAOYSA-N 1 2 224.267 2.322 20 0 BEADLO c1ncc(CNc2ccc3c([nH+]2)CCCC3)[nH]1 ZINC000712332217 969185049 /nfs/dbraw/zinc/18/50/49/969185049.db2.gz BPQGZZRYEOSYAZ-UHFFFAOYSA-N 1 2 228.299 2.296 20 0 BEADLO Cc1cn2cc(-c3ccnnc3)ccc2[nH+]1 ZINC001242055789 969186765 /nfs/dbraw/zinc/18/67/65/969186765.db2.gz LWTMAOGXYQABBC-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1ncnc2[nH]cc(F)c21 ZINC001242070584 969196811 /nfs/dbraw/zinc/19/68/11/969196811.db2.gz DINSGVKRPGECSC-UHFFFAOYSA-N 1 2 243.245 2.001 20 0 BEADLO CCc1nc(-c2c[nH+]c(N)cc2C)ncc1F ZINC001242072305 969198056 /nfs/dbraw/zinc/19/80/56/969198056.db2.gz ILBSTCAZPAQTCZ-UHFFFAOYSA-N 1 2 232.262 2.131 20 0 BEADLO Cc1cc(NC2=CC[N@H+](C)CC2)sn1 ZINC001208741534 969230916 /nfs/dbraw/zinc/23/09/16/969230916.db2.gz KQJWBRVVNOZUBL-UHFFFAOYSA-N 1 2 209.318 2.083 20 0 BEADLO Cc1cc(NC2=CC[N@@H+](C)CC2)sn1 ZINC001208741534 969230925 /nfs/dbraw/zinc/23/09/25/969230925.db2.gz KQJWBRVVNOZUBL-UHFFFAOYSA-N 1 2 209.318 2.083 20 0 BEADLO NC(=O)CCNc1[nH+]cccc1-c1ccccc1 ZINC001168952705 969293525 /nfs/dbraw/zinc/29/35/25/969293525.db2.gz NZUVIAQZOHYGSD-UHFFFAOYSA-N 1 2 241.294 2.036 20 0 BEADLO C[C@@H](c1nc(C(C)(C)C)no1)n1cc[nH+]c1 ZINC000349795461 969315661 /nfs/dbraw/zinc/31/56/61/969315661.db2.gz SLEMYEFNWLHHLK-QMMMGPOBSA-N 1 2 220.276 2.173 20 0 BEADLO Cc1cccc(-c2nnc(Cc3c[nH]c[nH+]3)o2)c1 ZINC001253637819 969318953 /nfs/dbraw/zinc/31/89/53/969318953.db2.gz OAMTYYWXYYJLOW-UHFFFAOYSA-N 1 2 240.266 2.359 20 0 BEADLO c1c(CCNc2cccnc2)[nH+]c2ccccn12 ZINC001169005634 969329769 /nfs/dbraw/zinc/32/97/69/969329769.db2.gz WBEWPPPZFFGISD-UHFFFAOYSA-N 1 2 238.294 2.384 20 0 BEADLO Cc1cc(C)c(NC[C@H](O)C(C)C)c[nH+]1 ZINC001253752373 969367906 /nfs/dbraw/zinc/36/79/06/969367906.db2.gz FQEOIBUBZGBWMD-LBPRGKRZSA-N 1 2 208.305 2.127 20 0 BEADLO CC(C)[C@H](O)CNc1ccc(-n2cc[nH+]c2)cc1 ZINC001253752876 969370225 /nfs/dbraw/zinc/37/02/25/969370225.db2.gz XOKCFGUZSZCTES-CQSZACIVSA-N 1 2 245.326 2.301 20 0 BEADLO Fc1ccc2c[nH+]c(NCC3OCCO3)cc2c1 ZINC001169062354 969376065 /nfs/dbraw/zinc/37/60/65/969376065.db2.gz GNTFANYLMUUAIE-UHFFFAOYSA-N 1 2 248.257 2.159 20 0 BEADLO CC(C)OC1C[NH+](CCOc2ccccc2)C1 ZINC001209301263 969430324 /nfs/dbraw/zinc/43/03/24/969430324.db2.gz PIWBMQOSLKXFIV-UHFFFAOYSA-N 1 2 235.327 2.175 20 0 BEADLO C[C@@H]1CC(C[N@H+](C)CC(F)F)C[C@@H](C)O1 ZINC001209393742 969462555 /nfs/dbraw/zinc/46/25/55/969462555.db2.gz SIVIOWXCYSLYSX-RKDXNWHRSA-N 1 2 221.291 2.387 20 0 BEADLO C[C@@H]1CC(C[N@@H+](C)CC(F)F)C[C@@H](C)O1 ZINC001209393742 969462567 /nfs/dbraw/zinc/46/25/67/969462567.db2.gz SIVIOWXCYSLYSX-RKDXNWHRSA-N 1 2 221.291 2.387 20 0 BEADLO Cc1cccc2c(C[N@@H+]3CCO[C@H]4C[C@H]43)c[nH]c21 ZINC001209494174 969525464 /nfs/dbraw/zinc/52/54/64/969525464.db2.gz NSDOPEYHFPMMJE-KGLIPLIRSA-N 1 2 242.322 2.449 20 0 BEADLO Cc1cccc2c(C[N@H+]3CCO[C@H]4C[C@H]43)c[nH]c21 ZINC001209494174 969525466 /nfs/dbraw/zinc/52/54/66/969525466.db2.gz NSDOPEYHFPMMJE-KGLIPLIRSA-N 1 2 242.322 2.449 20 0 BEADLO Cc1ccc2[nH]cc(C[N@@H+]3CCO[C@@H]4C[C@@H]43)c2c1 ZINC001209500734 969528186 /nfs/dbraw/zinc/52/81/86/969528186.db2.gz ZMBPCDRWTFVEKT-LSDHHAIUSA-N 1 2 242.322 2.449 20 0 BEADLO Cc1ccc2[nH]cc(C[N@H+]3CCO[C@@H]4C[C@@H]43)c2c1 ZINC001209500734 969528195 /nfs/dbraw/zinc/52/81/95/969528195.db2.gz ZMBPCDRWTFVEKT-LSDHHAIUSA-N 1 2 242.322 2.449 20 0 BEADLO c1coc(Nc2ccc3[nH]c[nH+]c3c2)n1 ZINC001209843063 969651400 /nfs/dbraw/zinc/65/14/00/969651400.db2.gz UVOVBQKWZVRYGF-UHFFFAOYSA-N 1 2 200.201 2.295 20 0 BEADLO Cc1ccnnc1Nc1ccc2[nH]c[nH+]c2c1 ZINC001209848670 969665250 /nfs/dbraw/zinc/66/52/50/969665250.db2.gz PXQNZHINXFDZGA-UHFFFAOYSA-N 1 2 225.255 2.405 20 0 BEADLO C[C@@H](C(=O)N1CC[C@@H](C(C)(C)C)C1)n1cc[nH+]c1 ZINC001254630860 969751363 /nfs/dbraw/zinc/75/13/63/969751363.db2.gz QHJVEXJHSCHYND-NWDGAFQWSA-N 1 2 249.358 2.339 20 0 BEADLO Cn1cnc(Nc2ccc3c[nH+]ccc3c2)n1 ZINC001210045236 969775994 /nfs/dbraw/zinc/77/59/94/969775994.db2.gz YZNDUSOGFFHHJQ-UHFFFAOYSA-N 1 2 225.255 2.107 20 0 BEADLO CCCC[C@H](CC)OCC[NH+]1CCOCC1 ZINC001210209265 969833001 /nfs/dbraw/zinc/83/30/01/969833001.db2.gz YYCUGDBDSSDIHJ-ZDUSSCGKSA-N 1 2 229.364 2.304 20 0 BEADLO O=C1C[C@H]2CC([N@@H+]3CCCC(F)(F)C3)C[C@@H]2C1 ZINC001254946429 969833023 /nfs/dbraw/zinc/83/30/23/969833023.db2.gz NVAJFSGMLMFKLW-NXEZZACHSA-N 1 2 243.297 2.475 20 0 BEADLO O=C1C[C@H]2CC([N@H+]3CCCC(F)(F)C3)C[C@@H]2C1 ZINC001254946429 969833027 /nfs/dbraw/zinc/83/30/27/969833027.db2.gz NVAJFSGMLMFKLW-NXEZZACHSA-N 1 2 243.297 2.475 20 0 BEADLO C[C@@H]1CC[C@@H](C)[C@@H](OCC[NH+]2CCOCC2)C1 ZINC001210209033 969833520 /nfs/dbraw/zinc/83/35/20/969833520.db2.gz YAVJOHIJCGYRDB-MCIONIFRSA-N 1 2 241.375 2.160 20 0 BEADLO O=C1C[C@H]2CC([NH+]3CC(F)(C4CC4)C3)C[C@@H]2C1 ZINC001254946775 969836146 /nfs/dbraw/zinc/83/61/46/969836146.db2.gz UDRWQZWXJIAMQO-NXEZZACHSA-N 1 2 237.318 2.178 20 0 BEADLO C[C@@H]1CCC[C@@H](OCC[NH+]2CCOCC2)[C@H]1C ZINC001210224904 969836867 /nfs/dbraw/zinc/83/68/67/969836867.db2.gz KEDMJCDCUBQWAU-HZSPNIEDSA-N 1 2 241.375 2.160 20 0 BEADLO Cc1cccnc1Nc1c[nH+]c(C)c(N)c1 ZINC001210285706 969845596 /nfs/dbraw/zinc/84/55/96/969845596.db2.gz PNQXTEUEHBJPPG-UHFFFAOYSA-N 1 2 214.272 2.419 20 0 BEADLO CC1(F)C[NH+](C2Cc3ccccc3C2)C1 ZINC001255018971 969849046 /nfs/dbraw/zinc/84/90/46/969849046.db2.gz DPDBJENGZWJYOZ-UHFFFAOYSA-N 1 2 205.276 2.198 20 0 BEADLO Cc1[nH+]cc(Nc2cccc(F)n2)cc1N ZINC001210284104 969852163 /nfs/dbraw/zinc/85/21/63/969852163.db2.gz FBOLWJQJJWASNQ-UHFFFAOYSA-N 1 2 218.235 2.250 20 0 BEADLO CCc1nccnc1Nc1c[nH+]c(C)c(N)c1 ZINC001210287632 969853109 /nfs/dbraw/zinc/85/31/09/969853109.db2.gz YEQWQUDWINBSPB-UHFFFAOYSA-N 1 2 229.287 2.068 20 0 BEADLO Cc1[nH+]cc(Nc2c(Cl)cnn2C)cc1N ZINC001210287127 969853507 /nfs/dbraw/zinc/85/35/07/969853507.db2.gz LXKKZPPRMXNZDZ-UHFFFAOYSA-N 1 2 237.694 2.103 20 0 BEADLO COc1ncc(Nc2c[nH+]c(C)c(N)c2)cc1C ZINC001210286695 969854578 /nfs/dbraw/zinc/85/45/78/969854578.db2.gz DMFZUSATBUKZTF-UHFFFAOYSA-N 1 2 244.298 2.428 20 0 BEADLO CC(=O)c1ncccc1Nc1c[nH+]c(C)c(N)c1 ZINC001210288469 969856110 /nfs/dbraw/zinc/85/61/10/969856110.db2.gz JWCYZHFAZDEWJZ-UHFFFAOYSA-N 1 2 242.282 2.313 20 0 BEADLO Cc1[nH+]cc(Nc2ccc(CO)c(F)c2)cc1N ZINC001210292881 969860528 /nfs/dbraw/zinc/86/05/28/969860528.db2.gz BBNQVWWDSKKBEJ-UHFFFAOYSA-N 1 2 247.273 2.347 20 0 BEADLO Cc1oncc1Nc1cccc2[nH+]ccn21 ZINC001210575506 969951381 /nfs/dbraw/zinc/95/13/81/969951381.db2.gz ADSWMZGVYXFTJQ-UHFFFAOYSA-N 1 2 214.228 2.374 20 0 BEADLO CC(=O)c1cc(Nc2cc(C)cc[nH+]2)ccn1 ZINC001210588382 969966116 /nfs/dbraw/zinc/96/61/16/969966116.db2.gz MCNJTRJCKNFNLG-UHFFFAOYSA-N 1 2 227.267 2.153 20 0 BEADLO Cc1cccc(Nc2c[nH]c(=O)c(F)c2)[nH+]1 ZINC001210596527 969969582 /nfs/dbraw/zinc/96/95/82/969969582.db2.gz JRXXSILQNJYJSH-UHFFFAOYSA-N 1 2 219.219 2.373 20 0 BEADLO O=c1[nH]cc(Nc2cccc3[nH+]ccn32)cc1F ZINC001210597898 969971174 /nfs/dbraw/zinc/97/11/74/969971174.db2.gz YRZHSMJXLHZFHW-UHFFFAOYSA-N 1 2 244.229 2.318 20 0 BEADLO CCCc1nccnc1NCc1cc[nH+]c(N)c1 ZINC001156764008 969997293 /nfs/dbraw/zinc/99/72/93/969997293.db2.gz NSQRYLBUAYOSFW-UHFFFAOYSA-N 1 2 243.314 2.018 20 0 BEADLO C[C@H](c1nnc(C2CCC2)o1)n1cc[nH+]c1 ZINC001255181750 969997971 /nfs/dbraw/zinc/99/79/71/969997971.db2.gz CHXVZTGVTNOMIJ-MRVPVSSYSA-N 1 2 218.260 2.143 20 0 BEADLO CCOC(=O)[C@H]([NH2+][C@H]1CCSC1)[C@@H](C)CC ZINC001255276071 970025088 /nfs/dbraw/zinc/02/50/88/970025088.db2.gz DYFFIENHETUAEX-GARJFASQSA-N 1 2 245.388 2.059 20 0 BEADLO CCOC(=O)[C@H]([NH2+][C@@H]1CCSC1)[C@@H](C)CC ZINC001255276072 970025899 /nfs/dbraw/zinc/02/58/99/970025899.db2.gz DYFFIENHETUAEX-HBNTYKKESA-N 1 2 245.388 2.059 20 0 BEADLO COc1cc(Nc2cc(C)n(C)n2)cc(C)[nH+]1 ZINC001210776521 970028581 /nfs/dbraw/zinc/02/85/81/970028581.db2.gz QDYIKAKFPCRZKM-UHFFFAOYSA-N 1 2 232.287 2.184 20 0 BEADLO COc1cc(Nc2cccc(N)c2O)cc(C)[nH+]1 ZINC001210783099 970031238 /nfs/dbraw/zinc/03/12/38/970031238.db2.gz BINJAVDJSGMZGK-UHFFFAOYSA-N 1 2 245.282 2.430 20 0 BEADLO [NH2+]=CNc1cc2nc(Cl)cnc2cc1F ZINC001157079838 970079809 /nfs/dbraw/zinc/07/98/09/970079809.db2.gz DQRJNNYMIFXETB-UHFFFAOYSA-N 1 2 224.626 2.441 20 0 BEADLO [NH2+]=CNc1cc(C(=O)Nc2ccccc2)ccn1 ZINC001157078467 970080580 /nfs/dbraw/zinc/08/05/80/970080580.db2.gz NCWDUQPFPFSEBQ-UHFFFAOYSA-N 1 2 240.266 2.353 20 0 BEADLO CCN(CC)c1cc(N2CCC[C@@H]3C[C@@H]32)nc[nH+]1 ZINC001157142682 970111459 /nfs/dbraw/zinc/11/14/59/970111459.db2.gz DRIPTBZMHITMAL-NEPJUHHUSA-N 1 2 246.358 2.312 20 0 BEADLO CCN(CC)c1cc(N2CCC[C@@H]3C[C@@H]32)[nH+]cn1 ZINC001157142682 970111466 /nfs/dbraw/zinc/11/14/66/970111466.db2.gz DRIPTBZMHITMAL-NEPJUHHUSA-N 1 2 246.358 2.312 20 0 BEADLO CCOC(=O)[C@H]1CCC[C@H]([N@H+](C)CC(F)F)C1 ZINC001255379939 970127626 /nfs/dbraw/zinc/12/76/26/970127626.db2.gz YQIPBHQZZNWDEA-UWVGGRQHSA-N 1 2 249.301 2.305 20 0 BEADLO CCOC(=O)[C@H]1CCC[C@H]([N@@H+](C)CC(F)F)C1 ZINC001255379939 970127631 /nfs/dbraw/zinc/12/76/31/970127631.db2.gz YQIPBHQZZNWDEA-UWVGGRQHSA-N 1 2 249.301 2.305 20 0 BEADLO Cc1cc(CN2CC[NH2+]CC(F)(F)C2)cs1 ZINC001211352834 970243677 /nfs/dbraw/zinc/24/36/77/970243677.db2.gz CXYKKUJBZDDFOJ-UHFFFAOYSA-N 1 2 246.326 2.097 20 0 BEADLO Cc1nc2cc(Nc3c[nH+]cn3C)ccc2[nH]1 ZINC001213071128 970273197 /nfs/dbraw/zinc/27/31/97/970273197.db2.gz AQOFQXOWVLCWIX-UHFFFAOYSA-N 1 2 227.271 2.348 20 0 BEADLO COc1ncc(-c2c[nH+]cn2C)cc1C(F)F ZINC001243071893 970286558 /nfs/dbraw/zinc/28/65/58/970286558.db2.gz IDTCZWVBFBORSL-UHFFFAOYSA-N 1 2 239.225 2.428 20 0 BEADLO Cc1[nH+]cc(C2CC2)cc1Nc1cncc(N)n1 ZINC001213491409 970327672 /nfs/dbraw/zinc/32/76/72/970327672.db2.gz JEPKLTLOGZMTDA-UHFFFAOYSA-N 1 2 241.298 2.383 20 0 BEADLO Cc1cc(C)c(Nc2ccnn2C2COC2)c[nH+]1 ZINC001213507929 970334705 /nfs/dbraw/zinc/33/47/05/970334705.db2.gz HLENYZJSMSTMMQ-UHFFFAOYSA-N 1 2 244.298 2.210 20 0 BEADLO Cc1cc(C)c(Nc2cc3n(n2)CCCO3)c[nH+]1 ZINC001213511106 970336637 /nfs/dbraw/zinc/33/66/37/970336637.db2.gz WNOIDOWXGUHFPE-UHFFFAOYSA-N 1 2 244.298 2.421 20 0 BEADLO Cc1c[nH+]cc(Nc2cnns2)c1C ZINC001213524688 970345560 /nfs/dbraw/zinc/34/55/60/970345560.db2.gz DIEFFZUMNINJFL-UHFFFAOYSA-N 1 2 206.274 2.294 20 0 BEADLO COc1nccnc1Nc1c[nH+]cc(C)c1C ZINC001213525060 970345793 /nfs/dbraw/zinc/34/57/93/970345793.db2.gz MPGMCWCBLDAING-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO Cc1c[nH+]cc(Nc2cnn3cccnc23)c1C ZINC001213524660 970348644 /nfs/dbraw/zinc/34/86/44/970348644.db2.gz BQEAYUXYQYUIJV-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO COCCn1cc(Nc2c[nH+]cc(C)c2C)cn1 ZINC001213524950 970349836 /nfs/dbraw/zinc/34/98/36/970349836.db2.gz KHLLJTLGHXVQCA-UHFFFAOYSA-N 1 2 246.314 2.285 20 0 BEADLO CC[C@@H]([NH2+][C@H](C)Cc1ccc(C)cc1)C(=O)OC ZINC001255773884 970478426 /nfs/dbraw/zinc/47/84/26/970478426.db2.gz RJHHNEONJFACSG-TZMCWYRMSA-N 1 2 249.354 2.467 20 0 BEADLO C[C@@H](Cc1ccccc1Cl)[NH+]1CC(C)(O)C1 ZINC001170266445 970645340 /nfs/dbraw/zinc/64/53/40/970645340.db2.gz OSBWGXYEADTGBO-JTQLQIEISA-N 1 2 239.746 2.338 20 0 BEADLO C[C@@H]1C[C@@H](Nc2ccc([NH+](C)C)cc2)CO1 ZINC000401951729 970748664 /nfs/dbraw/zinc/74/86/64/970748664.db2.gz VEEZVGAKAKXFDG-ZYHUDNBSSA-N 1 2 220.316 2.342 20 0 BEADLO C[C@H]1C[C@H](Nc2ccc([NH+](C)C)cc2)CO1 ZINC000401951726 970749579 /nfs/dbraw/zinc/74/95/79/970749579.db2.gz VEEZVGAKAKXFDG-JQWIXIFHSA-N 1 2 220.316 2.342 20 0 BEADLO CCCOC(=O)C[NH2+][C@H](C)CCC(C)C ZINC001256361225 970760214 /nfs/dbraw/zinc/76/02/14/970760214.db2.gz PJCRJQKCCJQATM-LLVKDONJSA-N 1 2 215.337 2.354 20 0 BEADLO Cc1c(O)cccc1C[N@H+](C)Cc1cnccn1 ZINC001144119094 972588287 /nfs/dbraw/zinc/58/82/87/972588287.db2.gz SJLFWVCZEQDAHV-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO Cc1c(O)cccc1C[N@@H+](C)Cc1cnccn1 ZINC001144119094 972588299 /nfs/dbraw/zinc/58/82/99/972588299.db2.gz SJLFWVCZEQDAHV-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO Cc1c(O)cccc1C[N@H+](C1CC1)C1COC1 ZINC001144118117 972589703 /nfs/dbraw/zinc/58/97/03/972589703.db2.gz PRRMIDSFMGRXCV-UHFFFAOYSA-N 1 2 233.311 2.064 20 0 BEADLO Cc1c(O)cccc1C[N@@H+](C1CC1)C1COC1 ZINC001144118117 972589714 /nfs/dbraw/zinc/58/97/14/972589714.db2.gz PRRMIDSFMGRXCV-UHFFFAOYSA-N 1 2 233.311 2.064 20 0 BEADLO Cn1c[nH+]cc1CO[C@H]1COCc2ccccc21 ZINC001222594959 972593481 /nfs/dbraw/zinc/59/34/81/972593481.db2.gz JZPFRKCQOJNLIP-AWEZNQCLSA-N 1 2 244.294 2.208 20 0 BEADLO Cn1c[nH+]cc1CO[C@@H]1C[C@H]2CC[C@@H]1C2 ZINC001222595212 972594471 /nfs/dbraw/zinc/59/44/71/972594471.db2.gz SYLARTPXIOJRCI-HOSYDEDBSA-N 1 2 206.289 2.125 20 0 BEADLO Cn1c[nH+]cc1CO[C@H]1CCCC[C@@H]1F ZINC001222600179 972596278 /nfs/dbraw/zinc/59/62/78/972596278.db2.gz MTVZCPHQBSIWAB-QWRGUYRKSA-N 1 2 212.268 2.217 20 0 BEADLO C[C@@H](COCc1c[nH+]cn1C)Oc1ccccc1 ZINC001222601123 972599352 /nfs/dbraw/zinc/59/93/52/972599352.db2.gz YEVWWPWDEKSDIX-LBPRGKRZSA-N 1 2 246.310 2.404 20 0 BEADLO Cn1c[nH+]cc1CO[C@@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001222600438 972600438 /nfs/dbraw/zinc/60/04/38/972600438.db2.gz OXFRLWNLRUUKSS-CNDDSTCGSA-N 1 2 220.316 2.371 20 0 BEADLO Cc1cc(C[N@H+](C)CCC(F)(F)F)nc(C)n1 ZINC001327511284 972604556 /nfs/dbraw/zinc/60/45/56/972604556.db2.gz GUNHVALHQYYJQM-UHFFFAOYSA-N 1 2 247.264 2.478 20 0 BEADLO Cc1cc(C[N@@H+](C)CCC(F)(F)F)nc(C)n1 ZINC001327511284 972604561 /nfs/dbraw/zinc/60/45/61/972604561.db2.gz GUNHVALHQYYJQM-UHFFFAOYSA-N 1 2 247.264 2.478 20 0 BEADLO CCc1cc(C[NH+]2CC(OC)C2)cc(CC)c1O ZINC001144137190 972605411 /nfs/dbraw/zinc/60/54/11/972605411.db2.gz IHGZVLYGJIINGY-UHFFFAOYSA-N 1 2 249.354 2.348 20 0 BEADLO CCCOC1C[NH+](Cc2ccc3cc[nH]c3n2)C1 ZINC001144179429 972651169 /nfs/dbraw/zinc/65/11/69/972651169.db2.gz FESAIPCVMJKLGT-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO C[C@@H]1CC(=O)CC[N@@H+]1Cc1ccc2cc[nH]c2n1 ZINC001144169099 972668681 /nfs/dbraw/zinc/66/86/81/972668681.db2.gz WOAOESCDVDKKRU-SNVBAGLBSA-N 1 2 243.310 2.116 20 0 BEADLO C[C@@H]1CC(=O)CC[N@H+]1Cc1ccc2cc[nH]c2n1 ZINC001144169099 972668688 /nfs/dbraw/zinc/66/86/88/972668688.db2.gz WOAOESCDVDKKRU-SNVBAGLBSA-N 1 2 243.310 2.116 20 0 BEADLO Cc1ccoc1CN(C)C(=O)[C@H](C)n1cc[nH+]c1 ZINC001327886981 972788628 /nfs/dbraw/zinc/78/86/28/972788628.db2.gz MBSHLRZPSMATLA-NSHDSACASA-N 1 2 247.298 2.004 20 0 BEADLO CCN(Cc1[nH+]cn2ccccc12)C1CC1 ZINC001144610879 972886691 /nfs/dbraw/zinc/88/66/91/972886691.db2.gz FHXAXXSGDLNHMV-UHFFFAOYSA-N 1 2 215.300 2.319 20 0 BEADLO CCCN(CCOC)Cc1[nH+]cn2ccccc12 ZINC001144611947 972888699 /nfs/dbraw/zinc/88/86/99/972888699.db2.gz XWWDYXVOTIUZOY-UHFFFAOYSA-N 1 2 247.342 2.193 20 0 BEADLO OCC1(Nc2cccc[nH+]2)Cc2ccccc2C1 ZINC001171204177 972918107 /nfs/dbraw/zinc/91/81/07/972918107.db2.gz XNCAWAMEBRKSOW-UHFFFAOYSA-N 1 2 240.306 2.023 20 0 BEADLO Cc1cccc([C@@H]2CC[N@H+](Cc3nnc[nH]3)C2)c1 ZINC001328392963 973013405 /nfs/dbraw/zinc/01/34/05/973013405.db2.gz CHOVYWVYIXNNLY-CYBMUJFWSA-N 1 2 242.326 2.103 20 0 BEADLO Cc1cccc([C@@H]2CC[N@@H+](Cc3nnc[nH]3)C2)c1 ZINC001328392963 973013422 /nfs/dbraw/zinc/01/34/22/973013422.db2.gz CHOVYWVYIXNNLY-CYBMUJFWSA-N 1 2 242.326 2.103 20 0 BEADLO CCCC[C@@H]([NH2+]Cc1ncn[nH]1)C1CCC1 ZINC001328392980 973014552 /nfs/dbraw/zinc/01/45/52/973014552.db2.gz CPVSUSPQDVPXMR-LLVKDONJSA-N 1 2 222.336 2.253 20 0 BEADLO Cc1ccccc1[C@@H]([NH2+]Cc1nnc[nH]1)C1CC1 ZINC001328395171 973020081 /nfs/dbraw/zinc/02/00/81/973020081.db2.gz VWXBQOSOBODPDY-AWEZNQCLSA-N 1 2 242.326 2.354 20 0 BEADLO CC(C)(C)C[C@@H]1CC[N@H+](Cc2nnc[nH]2)C1 ZINC001328412367 973031573 /nfs/dbraw/zinc/03/15/73/973031573.db2.gz KVIURXWNAWCPCP-JTQLQIEISA-N 1 2 222.336 2.063 20 0 BEADLO CC(C)(C)C[C@@H]1CC[N@@H+](Cc2nnc[nH]2)C1 ZINC001328412367 973031583 /nfs/dbraw/zinc/03/15/83/973031583.db2.gz KVIURXWNAWCPCP-JTQLQIEISA-N 1 2 222.336 2.063 20 0 BEADLO CC(C)c1ocnc1CN1CCn2c[nH+]cc2C1 ZINC001328410914 973032674 /nfs/dbraw/zinc/03/26/74/973032674.db2.gz WPVAHNMDZMVOPF-UHFFFAOYSA-N 1 2 246.314 2.010 20 0 BEADLO Cc1cc(COC[C@@H]2CCO2)cc(C)[nH+]1 ZINC001223420622 973055889 /nfs/dbraw/zinc/05/58/89/973055889.db2.gz LEDDCAIVZWJAIN-LBPRGKRZSA-N 1 2 207.273 2.004 20 0 BEADLO Cc1c[nH]c(CCNC(=O)CC2=CCCCC2)[nH+]1 ZINC001146748271 973248521 /nfs/dbraw/zinc/24/85/21/973248521.db2.gz PTONZNQCCWVDLK-UHFFFAOYSA-N 1 2 247.342 2.267 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C)n[nH]2)[C@H](CC)CO1 ZINC001328709252 973286757 /nfs/dbraw/zinc/28/67/57/973286757.db2.gz XRSXPSIAXTUCKJ-CHWSQXEVSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C)n[nH]2)[C@H](CC)CO1 ZINC001328709252 973286777 /nfs/dbraw/zinc/28/67/77/973286777.db2.gz XRSXPSIAXTUCKJ-CHWSQXEVSA-N 1 2 237.347 2.108 20 0 BEADLO CCN(CC)C(=O)Cn1c[nH+]c(C(C)(C)C)c1 ZINC001329344785 973693028 /nfs/dbraw/zinc/69/30/28/973693028.db2.gz JWYIKSNHWWHYQF-UHFFFAOYSA-N 1 2 237.347 2.049 20 0 BEADLO C[C@H](CC1CCC1)NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001332201308 1169967449 /nfs/dbraw/zinc/96/74/49/1169967449.db2.gz JNMLPWGQFPNPRX-GHMZBOCLSA-N 1 2 235.331 2.139 20 0 BEADLO c1cnc(C[NH2+][C@@H]2CCCc3ncccc32)nc1 ZINC001329677865 973880084 /nfs/dbraw/zinc/88/00/84/973880084.db2.gz CYYBPCPHRACVTK-CYBMUJFWSA-N 1 2 240.310 2.039 20 0 BEADLO C[C@@H]1C[C@H](c2ccccc2)[N@H+](Cc2nnc[nH]2)C1 ZINC001329895279 974012722 /nfs/dbraw/zinc/01/27/22/974012722.db2.gz ORFNCQZWFDFLSI-DGCLKSJQSA-N 1 2 242.326 2.388 20 0 BEADLO C[C@@H]1C[C@H](c2ccccc2)[N@@H+](Cc2nnc[nH]2)C1 ZINC001329895279 974012739 /nfs/dbraw/zinc/01/27/39/974012739.db2.gz ORFNCQZWFDFLSI-DGCLKSJQSA-N 1 2 242.326 2.388 20 0 BEADLO Fc1cccc2c1CC[C@H]([NH+]1CC3(CCO3)C1)C2 ZINC001171435982 974053145 /nfs/dbraw/zinc/05/31/45/974053145.db2.gz AGZYXMPBYQMSPX-LBPRGKRZSA-N 1 2 247.313 2.158 20 0 BEADLO C[C@H](c1nc(C2CCC2)no1)n1cc[nH+]c1 ZINC001330050944 974084248 /nfs/dbraw/zinc/08/42/48/974084248.db2.gz PTEJFJDZELZSTM-MRVPVSSYSA-N 1 2 218.260 2.143 20 0 BEADLO C[C@@H](COCc1ccccc1)COC1C[NH+](C)C1 ZINC001225009406 974138895 /nfs/dbraw/zinc/13/88/95/974138895.db2.gz YZNAMOKTZVQFLN-ZDUSSCGKSA-N 1 2 249.354 2.170 20 0 BEADLO CC(C)[NH+]1CC(Oc2ccccc2F)C1 ZINC001225201063 974224158 /nfs/dbraw/zinc/22/41/58/974224158.db2.gz BQNKDRUKMFQCKJ-UHFFFAOYSA-N 1 2 209.264 2.297 20 0 BEADLO CCOc1ccccc1OC1C[NH+](CC)C1 ZINC001225214241 974243592 /nfs/dbraw/zinc/24/35/92/974243592.db2.gz FFTLJJPOSMCAJP-UHFFFAOYSA-N 1 2 221.300 2.168 20 0 BEADLO C[C@@H](C(=O)N1CCC(C2CC2)CC1)n1cc[nH+]c1 ZINC001330437643 974262931 /nfs/dbraw/zinc/26/29/31/974262931.db2.gz XRQGBWHUEPVLIV-NSHDSACASA-N 1 2 247.342 2.093 20 0 BEADLO C[NH+]1CC(Oc2cccc(C(F)(F)F)c2)C1 ZINC001225238956 974291619 /nfs/dbraw/zinc/29/16/19/974291619.db2.gz UDHPBDZXDDAIBV-UHFFFAOYSA-N 1 2 231.217 2.398 20 0 BEADLO c1cc(C[N@@H+]2CCOCC23CC3)n(C2CC2)c1 ZINC001330536910 974294683 /nfs/dbraw/zinc/29/46/83/974294683.db2.gz SBCHMVJIEPBHFE-UHFFFAOYSA-N 1 2 232.327 2.188 20 0 BEADLO c1cc(C[N@H+]2CCOCC23CC3)n(C2CC2)c1 ZINC001330536910 974294695 /nfs/dbraw/zinc/29/46/95/974294695.db2.gz SBCHMVJIEPBHFE-UHFFFAOYSA-N 1 2 232.327 2.188 20 0 BEADLO CC[NH+]1CC(Oc2ccc(Cl)cc2)C1 ZINC001225253326 974309991 /nfs/dbraw/zinc/30/99/91/974309991.db2.gz NIKWFOSWNRLBFO-UHFFFAOYSA-N 1 2 211.692 2.423 20 0 BEADLO Cc1ccccc1C1([NH2+]Cc2nnc[nH]2)CCC1 ZINC001330565350 974316663 /nfs/dbraw/zinc/31/66/63/974316663.db2.gz KUYYMKHYWXTQMT-UHFFFAOYSA-N 1 2 242.326 2.282 20 0 BEADLO COC(=O)[C@H]1CC[C@H](Oc2cc[nH+]cc2)CC1 ZINC001225290931 974358960 /nfs/dbraw/zinc/35/89/60/974358960.db2.gz LFXQZDVDPNUYEO-XYPYZODXSA-N 1 2 235.283 2.192 20 0 BEADLO C[C@@H](Oc1cc[nH+]cc1)c1cncnc1 ZINC001225290842 974360258 /nfs/dbraw/zinc/36/02/58/974360258.db2.gz KBOJAAOUNUFWHS-SECBINFHSA-N 1 2 201.229 2.012 20 0 BEADLO c1ccc2c(c1)OC[C@H](COc1cc[nH+]cc1)O2 ZINC001225291241 974367067 /nfs/dbraw/zinc/36/70/67/974367067.db2.gz QNYGCGCZSSSHID-LBPRGKRZSA-N 1 2 243.262 2.300 20 0 BEADLO c1scc2c1OC[C@H](COc1cc[nH+]cc1)O2 ZINC001225296595 974373018 /nfs/dbraw/zinc/37/30/18/974373018.db2.gz ZSBAMAKXDSZSJH-JTQLQIEISA-N 1 2 249.291 2.362 20 0 BEADLO COC(=O)[C@@H]1C[C@H](Oc2cc[nH+]cc2)C1(C)C ZINC001225296567 974374439 /nfs/dbraw/zinc/37/44/39/974374439.db2.gz YPXMHLKHCWMNLM-QWRGUYRKSA-N 1 2 235.283 2.048 20 0 BEADLO Cc1cc(N[C@H]2C[C@H](O)C2)[nH+]c2ccccc12 ZINC001330690188 974420595 /nfs/dbraw/zinc/42/05/95/974420595.db2.gz UKKQNTOMKYFJDG-XYPYZODXSA-N 1 2 228.295 2.478 20 0 BEADLO C[C@H](NC(=O)[C@H](C)n1cc[nH+]c1)C1CCCC1 ZINC001330820495 974492268 /nfs/dbraw/zinc/49/22/68/974492268.db2.gz ZOWQKPRQMJHPBK-QWRGUYRKSA-N 1 2 235.331 2.139 20 0 BEADLO CCc1ccc(NC(=O)[C@@H](C)n2cc[nH+]c2)nc1 ZINC001330829403 974492613 /nfs/dbraw/zinc/49/26/13/974492613.db2.gz AFABZYODOOINKX-SNVBAGLBSA-N 1 2 244.298 2.040 20 0 BEADLO CC[C@H]1C[N@H+](Cc2[nH]nc(C)c2C)[C@H](C)CO1 ZINC001331548635 974759478 /nfs/dbraw/zinc/75/94/78/974759478.db2.gz MJUBDVGPNQHSSS-SKDRFNHKSA-N 1 2 237.347 2.026 20 0 BEADLO CSc1ccc(OC2C[NH+](C)C2)cc1C ZINC001226014460 974763143 /nfs/dbraw/zinc/76/31/43/974763143.db2.gz ULDNJZKNHKEHJD-UHFFFAOYSA-N 1 2 223.341 2.410 20 0 BEADLO CC(C)COCC[C@H](C)[N@@H+]1Cc2cncnc2C1 ZINC001172470226 974767123 /nfs/dbraw/zinc/76/71/23/974767123.db2.gz XUXPHSBVWVDGKU-LBPRGKRZSA-N 1 2 249.358 2.243 20 0 BEADLO CC(C)COCC[C@H](C)[N@H+]1Cc2cncnc2C1 ZINC001172470226 974767128 /nfs/dbraw/zinc/76/71/28/974767128.db2.gz XUXPHSBVWVDGKU-LBPRGKRZSA-N 1 2 249.358 2.243 20 0 BEADLO CCOC(=O)C(C)(C)[NH2+][C@@H](C)CCOC(C)C ZINC001172438523 974794885 /nfs/dbraw/zinc/79/48/85/974794885.db2.gz SBVKVHKKCXTMLK-NSHDSACASA-N 1 2 245.363 2.121 20 0 BEADLO CC[NH+]1CC(Oc2ccc3c(O)cccc3n2)C1 ZINC001226284678 974843646 /nfs/dbraw/zinc/84/36/46/974843646.db2.gz IRQMUPKOQSJTJY-UHFFFAOYSA-N 1 2 244.294 2.023 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H]1CCc2ccc(C)cc2C1 ZINC001172833930 974952720 /nfs/dbraw/zinc/95/27/20/974952720.db2.gz CNABKEMQVBGJNR-SMDDNHRTSA-N 1 2 247.338 2.003 20 0 BEADLO CCc1ccc(C[C@H](C)[N@@H+]2CCC(=O)C2)cc1 ZINC001173243474 975079628 /nfs/dbraw/zinc/07/96/28/975079628.db2.gz OAFNWYPUGWUJKQ-LBPRGKRZSA-N 1 2 231.339 2.455 20 0 BEADLO CCc1ccc(C[C@H](C)[N@H+]2CCC(=O)C2)cc1 ZINC001173243474 975079635 /nfs/dbraw/zinc/07/96/35/975079635.db2.gz OAFNWYPUGWUJKQ-LBPRGKRZSA-N 1 2 231.339 2.455 20 0 BEADLO CCC[C@H]([NH2+][C@H](C)CSCC)C(=O)OC ZINC001173294513 975172533 /nfs/dbraw/zinc/17/25/33/975172533.db2.gz CRHSMTAWYMTNDA-ZJUUUORDSA-N 1 2 233.377 2.059 20 0 BEADLO CCSC[C@@H](C)[NH2+]C1(c2nc(C)no2)CC1 ZINC001173296626 975183651 /nfs/dbraw/zinc/18/36/51/975183651.db2.gz VHMCBUKMFZJKST-MRVPVSSYSA-N 1 2 241.360 2.098 20 0 BEADLO CCSC[C@@H](C)[NH2+]C(CC)(CC)C(=O)OC ZINC001173302585 975206691 /nfs/dbraw/zinc/20/66/91/975206691.db2.gz STOWIIYYQPDPIX-SNVBAGLBSA-N 1 2 247.404 2.449 20 0 BEADLO CC(C)(C)[NH+]1CC(Oc2nccs2)C1 ZINC001227036318 975227095 /nfs/dbraw/zinc/22/70/95/975227095.db2.gz PERPFPGAIYAECH-UHFFFAOYSA-N 1 2 212.318 2.005 20 0 BEADLO CCSC[C@H](C)[NH2+]Cc1noc(C(C)C)n1 ZINC001173286288 975248758 /nfs/dbraw/zinc/24/87/58/975248758.db2.gz AJHXJABDARDPSG-VIFPVBQESA-N 1 2 243.376 2.424 20 0 BEADLO CC[NH+]1CC(Oc2nccc3oc(C)cc32)C1 ZINC001227086835 975255999 /nfs/dbraw/zinc/25/59/99/975255999.db2.gz LSZOOYLCNCDUHN-UHFFFAOYSA-N 1 2 232.283 2.219 20 0 BEADLO CC[NH+]1CC(Oc2cnc(Cl)c(Cl)c2)C1 ZINC001227223653 975309706 /nfs/dbraw/zinc/30/97/06/975309706.db2.gz CYFVYJNAUQJKEC-UHFFFAOYSA-N 1 2 247.125 2.471 20 0 BEADLO COC(=O)C[C@@H](C)Oc1c(C)cc[nH+]c1C ZINC001227261033 975334152 /nfs/dbraw/zinc/33/41/52/975334152.db2.gz WXNVTSIRMWBYBJ-SECBINFHSA-N 1 2 223.272 2.029 20 0 BEADLO CCOC(=O)[C@H](C)Oc1c(C)cc[nH+]c1C ZINC001227259151 975335403 /nfs/dbraw/zinc/33/54/03/975335403.db2.gz DVJPFSXJILXAGV-JTQLQIEISA-N 1 2 223.272 2.029 20 0 BEADLO C[C@@]1(O)CC[N@H+](Cc2ccccc2F)C[C@@H]1F ZINC001203346212 975381878 /nfs/dbraw/zinc/38/18/78/975381878.db2.gz IZPQBRBOUCFDID-QWHCGFSZSA-N 1 2 241.281 2.121 20 0 BEADLO C[C@@]1(O)CC[N@@H+](Cc2ccccc2F)C[C@@H]1F ZINC001203346212 975381888 /nfs/dbraw/zinc/38/18/88/975381888.db2.gz IZPQBRBOUCFDID-QWHCGFSZSA-N 1 2 241.281 2.121 20 0 BEADLO CC(C)c1ocnc1C[N@@H+]1CCO[C@H](C)CC1 ZINC001333304228 975629924 /nfs/dbraw/zinc/62/99/24/975629924.db2.gz MBLRPKXXPRSWED-LLVKDONJSA-N 1 2 238.331 2.409 20 0 BEADLO CC(C)c1ocnc1C[N@H+]1CCO[C@H](C)CC1 ZINC001333304228 975629936 /nfs/dbraw/zinc/62/99/36/975629936.db2.gz MBLRPKXXPRSWED-LLVKDONJSA-N 1 2 238.331 2.409 20 0 BEADLO OCCc1ccc[nH+]c1Nc1ccc(F)cc1 ZINC001173798972 975648209 /nfs/dbraw/zinc/64/82/09/975648209.db2.gz BHCJNDCLZLYBIA-UHFFFAOYSA-N 1 2 232.258 2.499 20 0 BEADLO C[NH+]1CC(Oc2cc(F)cc(Cl)c2)C1 ZINC001227855177 975742632 /nfs/dbraw/zinc/74/26/32/975742632.db2.gz LOKPAYXWBGXQEA-UHFFFAOYSA-N 1 2 215.655 2.172 20 0 BEADLO Cn1c[nH+]cc1CCCOC(=O)C1(C)CCC1 ZINC001343738833 1169992993 /nfs/dbraw/zinc/99/29/93/1169992993.db2.gz LNNGEQGWOULIKK-UHFFFAOYSA-N 1 2 236.315 2.086 20 0 BEADLO Cc1[nH+]c2ccc(N)cc2n1-c1cccnc1 ZINC001173856046 975783435 /nfs/dbraw/zinc/78/34/35/975783435.db2.gz QBUOTBIKOXRSKV-UHFFFAOYSA-N 1 2 224.267 2.311 20 0 BEADLO CCC1CCC([N@H+](C)Cc2nnc[nH]2)CC1 ZINC001333582533 975866108 /nfs/dbraw/zinc/86/61/08/975866108.db2.gz NAUIBWBURATEJF-UHFFFAOYSA-N 1 2 222.336 2.205 20 0 BEADLO CCC1CCC([N@@H+](C)Cc2nnc[nH]2)CC1 ZINC001333582533 975866110 /nfs/dbraw/zinc/86/61/10/975866110.db2.gz NAUIBWBURATEJF-UHFFFAOYSA-N 1 2 222.336 2.205 20 0 BEADLO Cc1ccc(N[C@@H](C)c2cnnn2C)c(C)[nH+]1 ZINC001333595872 975879105 /nfs/dbraw/zinc/87/91/05/975879105.db2.gz GZAIJBRWDXZTQW-JTQLQIEISA-N 1 2 231.303 2.000 20 0 BEADLO ClC(Cl)=CC[N@@H+]1CC[C@]12CCOC2 ZINC001333604442 975884852 /nfs/dbraw/zinc/88/48/52/975884852.db2.gz HDUAHRNKCKKZEF-SECBINFHSA-N 1 2 222.115 2.170 20 0 BEADLO ClC(Cl)=CC[N@H+]1CC[C@]12CCOC2 ZINC001333604442 975884863 /nfs/dbraw/zinc/88/48/63/975884863.db2.gz HDUAHRNKCKKZEF-SECBINFHSA-N 1 2 222.115 2.170 20 0 BEADLO COc1cc2c(cc1OC[C@@H](C)OC)C=[NH+]CC2 ZINC001228091033 975899606 /nfs/dbraw/zinc/89/96/06/975899606.db2.gz QULKDCPZZNNRGV-SNVBAGLBSA-N 1 2 249.310 2.084 20 0 BEADLO Cc1cc(NC/C=C/CO)nc(C2CCC2)[nH+]1 ZINC001333823331 976106774 /nfs/dbraw/zinc/10/67/74/976106774.db2.gz RCWOXRSOPSOVNX-NSCUHMNNSA-N 1 2 233.315 2.013 20 0 BEADLO CO[C@H](C)COc1ccc2[nH]c(C)[nH+]c2c1 ZINC001228326356 976119183 /nfs/dbraw/zinc/11/91/83/976119183.db2.gz HKUGUYBUZWAYEZ-MRVPVSSYSA-N 1 2 220.272 2.285 20 0 BEADLO Cc1[nH]c2ccc(O[C@@H]3CCCOC3)cc2[nH+]1 ZINC001228326082 976121912 /nfs/dbraw/zinc/12/19/12/976121912.db2.gz DVALETMVOQRSTJ-LLVKDONJSA-N 1 2 232.283 2.429 20 0 BEADLO COc1ncc(Nc2cc[nH+]c(SC)c2)cn1 ZINC001174034686 976235598 /nfs/dbraw/zinc/23/55/98/976235598.db2.gz IJRRQQPOKIMATC-UHFFFAOYSA-N 1 2 248.311 2.346 20 0 BEADLO CCOc1cc[nH+]cc1Nc1cnc(OC)nc1 ZINC001174033667 976237249 /nfs/dbraw/zinc/23/72/49/976237249.db2.gz RYUOXUOXNARWJY-UHFFFAOYSA-N 1 2 246.270 2.023 20 0 BEADLO Cc1cccc(Nc2ccc(C(N)=O)cc2)[nH+]1 ZINC001174047490 976272348 /nfs/dbraw/zinc/27/23/48/976272348.db2.gz RJUGSCSSFZGPHO-UHFFFAOYSA-N 1 2 227.267 2.233 20 0 BEADLO Cc1ccc[nH+]c1Nc1ccc(C(N)=O)cc1 ZINC001174047350 976273149 /nfs/dbraw/zinc/27/31/49/976273149.db2.gz KFKHRTJGCHOJBB-UHFFFAOYSA-N 1 2 227.267 2.233 20 0 BEADLO CC[NH+]1CC(Oc2ccnc(C(F)F)c2)C1 ZINC001228528006 976279007 /nfs/dbraw/zinc/27/90/07/976279007.db2.gz ATBIWNFHKIYIPU-UHFFFAOYSA-N 1 2 228.242 2.102 20 0 BEADLO CC(C)Oc1ccc(OC2C[NH+](C)C2)cc1 ZINC001228584530 976353367 /nfs/dbraw/zinc/35/33/67/976353367.db2.gz ZTRYXJYEESGZIJ-UHFFFAOYSA-N 1 2 221.300 2.167 20 0 BEADLO COc1cncc(Nc2ccn3cc[nH+]c3c2)c1 ZINC001174090079 976358636 /nfs/dbraw/zinc/35/86/36/976358636.db2.gz JOCQFMFWIJBDTH-UHFFFAOYSA-N 1 2 240.266 2.482 20 0 BEADLO Cc1n[nH]c(C)c1-n1c(C)[nH+]c2ccc(N)cc21 ZINC001174214307 976397080 /nfs/dbraw/zinc/39/70/80/976397080.db2.gz NOQGEERRKVIZRJ-UHFFFAOYSA-N 1 2 241.298 2.256 20 0 BEADLO Cc1nn(C)c(C)c1Nc1ccn2cc[nH+]c2c1 ZINC001174227532 976423905 /nfs/dbraw/zinc/42/39/05/976423905.db2.gz QDYVWYAHPPAUKP-UHFFFAOYSA-N 1 2 241.298 2.428 20 0 BEADLO CC[NH+]1CC(Oc2cc(OC)ccc2C)C1 ZINC001228726010 976460655 /nfs/dbraw/zinc/46/06/55/976460655.db2.gz DBGBTWSVWMRAMS-UHFFFAOYSA-N 1 2 221.300 2.087 20 0 BEADLO Cn1c[nH+]c2cc(Nc3cn[nH]c3)ccc21 ZINC001174295968 976476500 /nfs/dbraw/zinc/47/65/00/976476500.db2.gz CWSVQLUWOUROKM-UHFFFAOYSA-N 1 2 213.244 2.040 20 0 BEADLO COc1cc(Nc2c[nH+]ccc2OC)ccn1 ZINC001174303604 976496944 /nfs/dbraw/zinc/49/69/44/976496944.db2.gz UREKQBGSGHORMS-UHFFFAOYSA-N 1 2 231.255 2.237 20 0 BEADLO Nc1cccc2[nH+]cn(-c3ccc4n[nH]cc4c3)c21 ZINC001174275152 976498867 /nfs/dbraw/zinc/49/88/67/976498867.db2.gz QCEKCNCXHLOQGL-UHFFFAOYSA-N 1 2 249.277 2.484 20 0 BEADLO Cc1cn2c(cccc2Nc2cnn(C)c2)[nH+]1 ZINC001174328446 976524734 /nfs/dbraw/zinc/52/47/34/976524734.db2.gz SYHZQIDMOVKHLJ-UHFFFAOYSA-N 1 2 227.271 2.120 20 0 BEADLO O=C(N[C@@H]1C=CCCC1)c1cc2c[nH+]ccc2[nH]1 ZINC001334693917 976587382 /nfs/dbraw/zinc/58/73/82/976587382.db2.gz ZRGCNKXZSLFBPK-LLVKDONJSA-N 1 2 241.294 2.401 20 0 BEADLO Cc1cc[nH+]c(Nc2ccc3ncnn3c2)c1 ZINC001174371091 976610736 /nfs/dbraw/zinc/61/07/36/976610736.db2.gz GLWHXXSMGPMJMD-UHFFFAOYSA-N 1 2 225.255 2.176 20 0 BEADLO c1cn(-c2cccc(Nc3cncnc3)c2)c[nH+]1 ZINC001174383884 976621010 /nfs/dbraw/zinc/62/10/10/976621010.db2.gz DMLHXLPIXVMDHM-UHFFFAOYSA-N 1 2 237.266 2.406 20 0 BEADLO CC[NH+]1CC(Oc2ncnc3ccc(C)cc32)C1 ZINC001229056031 976686178 /nfs/dbraw/zinc/68/61/78/976686178.db2.gz KWJCRZXKWKPLMX-UHFFFAOYSA-N 1 2 243.310 2.021 20 0 BEADLO CC(C)OC(=O)C[N@@H+]1CCC[C@H]1c1ccc[nH]1 ZINC001334867740 976760279 /nfs/dbraw/zinc/76/02/79/976760279.db2.gz JWNXZUIKZILGKJ-LBPRGKRZSA-N 1 2 236.315 2.103 20 0 BEADLO CC(C)OC(=O)C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC001334867740 976760297 /nfs/dbraw/zinc/76/02/97/976760297.db2.gz JWNXZUIKZILGKJ-LBPRGKRZSA-N 1 2 236.315 2.103 20 0 BEADLO CC(C)OC(=O)C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC001334867739 976760581 /nfs/dbraw/zinc/76/05/81/976760581.db2.gz JWNXZUIKZILGKJ-GFCCVEGCSA-N 1 2 236.315 2.103 20 0 BEADLO CC(C)OC(=O)C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC001334867739 976760593 /nfs/dbraw/zinc/76/05/93/976760593.db2.gz JWNXZUIKZILGKJ-GFCCVEGCSA-N 1 2 236.315 2.103 20 0 BEADLO Cc1cc(O)ccc1NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001334936484 976800663 /nfs/dbraw/zinc/80/06/63/976800663.db2.gz MCRAIOYYGPBYTO-JTQLQIEISA-N 1 2 245.282 2.097 20 0 BEADLO Cc1c[nH+]ccc1Nc1c(=O)cc[nH]c1Cl ZINC001174537332 976821100 /nfs/dbraw/zinc/82/11/00/976821100.db2.gz GRBUESIEDALEQB-UHFFFAOYSA-N 1 2 235.674 2.310 20 0 BEADLO Nc1cnn(-c2ccc([NH+]3CCCC3)cc2)c1 ZINC001174525172 976842888 /nfs/dbraw/zinc/84/28/88/976842888.db2.gz RUKBMUXRMWQBSG-UHFFFAOYSA-N 1 2 228.299 2.055 20 0 BEADLO Cc1cc(NC(=O)[C@@H](C)n2cc[nH+]c2)cnc1C ZINC001335150534 976866877 /nfs/dbraw/zinc/86/68/77/976866877.db2.gz MQFANEFLAGGLIM-LLVKDONJSA-N 1 2 244.298 2.095 20 0 BEADLO CC(=O)[C@H](C)Oc1ccc(-n2cc[nH+]c2)cc1 ZINC001229954493 977038984 /nfs/dbraw/zinc/03/89/84/977038984.db2.gz PSMKVYUZBYYDRL-NSHDSACASA-N 1 2 230.267 2.229 20 0 BEADLO Cc1cc(Nc2cccn3cc(C)[nH+]c23)n(C)n1 ZINC001174821020 977074656 /nfs/dbraw/zinc/07/46/56/977074656.db2.gz PEBNSAISSBKJNX-UHFFFAOYSA-N 1 2 241.298 2.428 20 0 BEADLO Cc1ccc([N@H+]2C(=N)C=C(Cl)C=C2N)cc1N ZINC001174933466 977173953 /nfs/dbraw/zinc/17/39/53/977173953.db2.gz QQQGNTJQKIATHB-UHFFFAOYSA-N 1 2 248.717 2.083 20 0 BEADLO Cc1ccc([N@@H+]2C(=N)C=C(Cl)C=C2N)cc1N ZINC001174933466 977173955 /nfs/dbraw/zinc/17/39/55/977173955.db2.gz QQQGNTJQKIATHB-UHFFFAOYSA-N 1 2 248.717 2.083 20 0 BEADLO CCOc1cc[nH+]cc1Nc1ccncc1F ZINC001175197186 977291439 /nfs/dbraw/zinc/29/14/39/977291439.db2.gz MIGQUNMKLUHVQJ-UHFFFAOYSA-N 1 2 233.246 2.180 20 0 BEADLO Cc1cc(C)c(Nc2ccncc2F)c[nH+]1 ZINC001175196583 977292044 /nfs/dbraw/zinc/29/20/44/977292044.db2.gz BCMBKBBGMQIAMN-UHFFFAOYSA-N 1 2 217.247 2.398 20 0 BEADLO CN(C)c1ccc(Nc2ncc(F)cc2O)c[nH+]1 ZINC001175342430 977366940 /nfs/dbraw/zinc/36/69/40/977366940.db2.gz UUDQBJUQCYQULX-UHFFFAOYSA-N 1 2 248.261 2.131 20 0 BEADLO CO[C@H](C)CCOc1cc2c(cc1O)C=[NH+]CC2 ZINC001230918911 977378601 /nfs/dbraw/zinc/37/86/01/977378601.db2.gz BDJLBRBAHSIVRP-SNVBAGLBSA-N 1 2 249.310 2.171 20 0 BEADLO Cc1noc(C)c1Nc1ccc(N(C)C)[nH+]c1 ZINC001175341006 977385956 /nfs/dbraw/zinc/38/59/56/977385956.db2.gz MTZXYJWNCLOERJ-UHFFFAOYSA-N 1 2 232.287 2.496 20 0 BEADLO CN(C)c1ccc(Nc2cncs2)c[nH+]1 ZINC001175339049 977389216 /nfs/dbraw/zinc/38/92/16/977389216.db2.gz UYEVXGYSRDDMMA-UHFFFAOYSA-N 1 2 220.301 2.348 20 0 BEADLO O=C1CC(Oc2ccc(-c3[nH]cc[nH+]3)cc2)C1 ZINC001231082794 977474215 /nfs/dbraw/zinc/47/42/15/977474215.db2.gz ZOEUXFPNDGUZGE-UHFFFAOYSA-N 1 2 228.251 2.187 20 0 BEADLO CC(C)c1cc(N=C2CCC[N@H+](C)C2)on1 ZINC001175574271 977571831 /nfs/dbraw/zinc/57/18/31/977571831.db2.gz SBNXMVHLYCFZPR-UHFFFAOYSA-N 1 2 221.304 2.429 20 0 BEADLO CC(C)c1cc(N=C2CCC[N@@H+](C)C2)on1 ZINC001175574271 977571838 /nfs/dbraw/zinc/57/18/38/977571838.db2.gz SBNXMVHLYCFZPR-UHFFFAOYSA-N 1 2 221.304 2.429 20 0 BEADLO Cc1c(C)c(OC2C[NH+](C)C2)c(C)c(C)c1O ZINC001231344974 977572012 /nfs/dbraw/zinc/57/20/12/977572012.db2.gz YQOWPIDAPCRAIN-UHFFFAOYSA-N 1 2 235.327 2.319 20 0 BEADLO C[C@H]1CC(=O)CC[N@@H+]1Cc1c[nH]c2cccnc12 ZINC001231485693 977606952 /nfs/dbraw/zinc/60/69/52/977606952.db2.gz JCDGKFBJNPZDEW-JTQLQIEISA-N 1 2 243.310 2.116 20 0 BEADLO C[C@H]1CC(=O)CC[N@H+]1Cc1c[nH]c2cccnc12 ZINC001231485693 977606964 /nfs/dbraw/zinc/60/69/64/977606964.db2.gz JCDGKFBJNPZDEW-JTQLQIEISA-N 1 2 243.310 2.116 20 0 BEADLO CCc1ccc(C[N@H+]2C[C@H]3C[C@@H](C2)O3)s1 ZINC001231502418 977618262 /nfs/dbraw/zinc/61/82/62/977618262.db2.gz DXFSNGIBQMNGHF-AOOOYVTPSA-N 1 2 223.341 2.284 20 0 BEADLO CCc1ccc(C[N@@H+]2C[C@H]3C[C@@H](C2)O3)s1 ZINC001231502418 977618268 /nfs/dbraw/zinc/61/82/68/977618268.db2.gz DXFSNGIBQMNGHF-AOOOYVTPSA-N 1 2 223.341 2.284 20 0 BEADLO CCOc1ccc(C[N@@H+]2CC[C@@H](F)C2)cn1 ZINC001231649745 977665723 /nfs/dbraw/zinc/66/57/23/977665723.db2.gz SDKCHXOJPPHROX-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO CCOc1ccc(C[N@H+]2CC[C@@H](F)C2)cn1 ZINC001231649745 977665726 /nfs/dbraw/zinc/66/57/26/977665726.db2.gz SDKCHXOJPPHROX-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO CC(C)OC1C[NH+](Cc2cc3cc[nH]c3cn2)C1 ZINC001231673645 977686231 /nfs/dbraw/zinc/68/62/31/977686231.db2.gz SFLWDDPYUJBADX-UHFFFAOYSA-N 1 2 245.326 2.172 20 0 BEADLO COCc1ccc(C[N@H+](C)Cc2ccno2)o1 ZINC001231694552 977691714 /nfs/dbraw/zinc/69/17/14/977691714.db2.gz KMWILRBBRONEDV-UHFFFAOYSA-N 1 2 236.271 2.046 20 0 BEADLO COCc1ccc(C[N@@H+](C)Cc2ccno2)o1 ZINC001231694552 977691731 /nfs/dbraw/zinc/69/17/31/977691731.db2.gz KMWILRBBRONEDV-UHFFFAOYSA-N 1 2 236.271 2.046 20 0 BEADLO Nc1cc(C(F)(F)F)c(Nc2cnoc2)c[nH+]1 ZINC001175710159 977698425 /nfs/dbraw/zinc/69/84/25/977698425.db2.gz WGUAYYJIBRRRPD-UHFFFAOYSA-N 1 2 244.176 2.414 20 0 BEADLO CCC[C@]1(C)CCCN(c2cc(N)nc[nH+]2)C1 ZINC001336545692 977771278 /nfs/dbraw/zinc/77/12/78/977771278.db2.gz YBFWSLYYTZELRV-CYBMUJFWSA-N 1 2 234.347 2.465 20 0 BEADLO C[C@H]1CC(=O)CC[N@@H+]1Cc1ccc2c[nH]nc2c1 ZINC001231904997 977790601 /nfs/dbraw/zinc/79/06/01/977790601.db2.gz BSLMMZPVGDXMER-JTQLQIEISA-N 1 2 243.310 2.116 20 0 BEADLO C[C@H]1CC(=O)CC[N@H+]1Cc1ccc2c[nH]nc2c1 ZINC001231904997 977790610 /nfs/dbraw/zinc/79/06/10/977790610.db2.gz BSLMMZPVGDXMER-JTQLQIEISA-N 1 2 243.310 2.116 20 0 BEADLO COc1cnc(C[N@H+](C)Cc2ccsc2)cn1 ZINC001231936742 977807572 /nfs/dbraw/zinc/80/75/72/977807572.db2.gz SQNJDVLVIKYHBB-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1cnc(C[N@@H+](C)Cc2ccsc2)cn1 ZINC001231936742 977807580 /nfs/dbraw/zinc/80/75/80/977807580.db2.gz SQNJDVLVIKYHBB-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO CO[C@@H]1CCN(c2cc(F)cc(C)[nH+]2)C[C@@H]1C ZINC001336649728 977831552 /nfs/dbraw/zinc/83/15/52/977831552.db2.gz WYMYMGAZDIJZNT-JOYOIKCWSA-N 1 2 238.306 2.390 20 0 BEADLO Oc1cncc(C[N@@H+]2CCCC[C@@H](F)C2)c1 ZINC001232038530 977862876 /nfs/dbraw/zinc/86/28/76/977862876.db2.gz GGGQCJWNAQFJIG-LLVKDONJSA-N 1 2 224.279 2.111 20 0 BEADLO Oc1cncc(C[N@H+]2CCCC[C@@H](F)C2)c1 ZINC001232038530 977862878 /nfs/dbraw/zinc/86/28/78/977862878.db2.gz GGGQCJWNAQFJIG-LLVKDONJSA-N 1 2 224.279 2.111 20 0 BEADLO C[C@]1(F)CCC[N@H+](Cc2cncc(O)c2)C1 ZINC001232039852 977867934 /nfs/dbraw/zinc/86/79/34/977867934.db2.gz YEZFNWIFGCHJJX-LBPRGKRZSA-N 1 2 224.279 2.111 20 0 BEADLO C[C@]1(F)CCC[N@@H+](Cc2cncc(O)c2)C1 ZINC001232039852 977867936 /nfs/dbraw/zinc/86/79/36/977867936.db2.gz YEZFNWIFGCHJJX-LBPRGKRZSA-N 1 2 224.279 2.111 20 0 BEADLO C[C@H]1C[NH+](Cc2cc3ncccc3[nH]2)C[C@H](C)O1 ZINC001232063866 977879446 /nfs/dbraw/zinc/87/94/46/977879446.db2.gz PKTWKQCDHTVGIR-QWRGUYRKSA-N 1 2 245.326 2.172 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cncnc2)c(C)n1 ZINC001232082970 977885131 /nfs/dbraw/zinc/88/51/31/977885131.db2.gz PGRLVYRBZDMHOG-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cncnc2)c(C)n1 ZINC001232082970 977885135 /nfs/dbraw/zinc/88/51/35/977885135.db2.gz PGRLVYRBZDMHOG-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO CC1(C)COCC[N@@H+]1Cc1cc2ccncc2[nH]1 ZINC001232094146 977894408 /nfs/dbraw/zinc/89/44/08/977894408.db2.gz KDUMGMRTXRHSBK-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO CC1(C)COCC[N@H+]1Cc1cc2ccncc2[nH]1 ZINC001232094146 977894413 /nfs/dbraw/zinc/89/44/13/977894413.db2.gz KDUMGMRTXRHSBK-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1ccns1 ZINC001232188814 977911505 /nfs/dbraw/zinc/91/15/05/977911505.db2.gz NBGURKAUPZNFQD-HTQZYQBOSA-N 1 2 200.282 2.075 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1ccns1 ZINC001232188814 977911514 /nfs/dbraw/zinc/91/15/14/977911514.db2.gz NBGURKAUPZNFQD-HTQZYQBOSA-N 1 2 200.282 2.075 20 0 BEADLO Fc1ccc(Cl)nc1C[NH+]1CCCC1 ZINC001232155672 977896726 /nfs/dbraw/zinc/89/67/26/977896726.db2.gz DVRYVFSHEINMHP-UHFFFAOYSA-N 1 2 214.671 2.470 20 0 BEADLO Fc1ccc(Cl)nc1C[N@@H+]1C[C@@H]2C[C@@H]2C1 ZINC001232156595 977897117 /nfs/dbraw/zinc/89/71/17/977897117.db2.gz DSHPRTSATSCAKV-OCAPTIKFSA-N 1 2 226.682 2.326 20 0 BEADLO Fc1ccc(Cl)nc1C[N@H+]1C[C@@H]2C[C@@H]2C1 ZINC001232156595 977897121 /nfs/dbraw/zinc/89/71/21/977897121.db2.gz DSHPRTSATSCAKV-OCAPTIKFSA-N 1 2 226.682 2.326 20 0 BEADLO COC1(CNc2ccc(N(C)C)c[nH+]2)CCC1 ZINC001336742858 977902463 /nfs/dbraw/zinc/90/24/63/977902463.db2.gz SBCWJCDYCHIUPE-UHFFFAOYSA-N 1 2 235.331 2.129 20 0 BEADLO CC(=O)C1CC[NH+](Cc2ncsc2C)CC1 ZINC001232204938 977932254 /nfs/dbraw/zinc/93/22/54/977932254.db2.gz BDTJIDVRAFTIHD-UHFFFAOYSA-N 1 2 238.356 2.253 20 0 BEADLO COc1cc[nH+]cc1Nc1ccn2nccc2c1 ZINC001176117858 977944413 /nfs/dbraw/zinc/94/44/13/977944413.db2.gz ANXXHTKRRRXQBK-UHFFFAOYSA-N 1 2 240.266 2.482 20 0 BEADLO COc1cc[nH+]cc1Nc1cnc(Cl)cn1 ZINC001176116884 977944582 /nfs/dbraw/zinc/94/45/82/977944582.db2.gz OTZPDRBHCSGVEK-UHFFFAOYSA-N 1 2 236.662 2.277 20 0 BEADLO COc1cc[nH+]cc1Nc1cnncc1Cl ZINC001176118374 977947693 /nfs/dbraw/zinc/94/76/93/977947693.db2.gz JILCJTYIXFNJFW-UHFFFAOYSA-N 1 2 236.662 2.277 20 0 BEADLO COc1cc[nH+]cc1-n1cc2ccc(N)cc2n1 ZINC001176120538 977949896 /nfs/dbraw/zinc/94/98/96/977949896.db2.gz CTVYEIOGWZSMCX-UHFFFAOYSA-N 1 2 240.266 2.011 20 0 BEADLO COc1cc[nH+]cc1Nc1cccnc1C(C)=O ZINC001176119000 977952032 /nfs/dbraw/zinc/95/20/32/977952032.db2.gz NJPKGTSVFTVDCE-UHFFFAOYSA-N 1 2 243.266 2.431 20 0 BEADLO COc1cc[nH+]cc1Nc1cn2ccccc2n1 ZINC001176119691 977953819 /nfs/dbraw/zinc/95/38/19/977953819.db2.gz ZOJUNKRRUWEEQG-UHFFFAOYSA-N 1 2 240.266 2.482 20 0 BEADLO COc1cc[nH+]cc1Nc1ccnc(OC)c1F ZINC001176120951 977954343 /nfs/dbraw/zinc/95/43/43/977954343.db2.gz CBTIOXPCDMNFJM-UHFFFAOYSA-N 1 2 249.245 2.377 20 0 BEADLO COc1cc[nH+]cc1Nc1cccc(N)c1O ZINC001176124812 977956011 /nfs/dbraw/zinc/95/60/11/977956011.db2.gz RKOMOSAIOFONDQ-UHFFFAOYSA-N 1 2 231.255 2.122 20 0 BEADLO COc1cc[nH+]cc1Nc1cc(F)ccc1CO ZINC001176123701 977958180 /nfs/dbraw/zinc/95/81/80/977958180.db2.gz DGNRRARUFTWVLL-UHFFFAOYSA-N 1 2 248.257 2.465 20 0 BEADLO COc1cc[nH+]cc1N1CCc2c1cccc2N ZINC001176124173 977958405 /nfs/dbraw/zinc/95/84/05/977958405.db2.gz OICJSCTXCAXWRV-UHFFFAOYSA-N 1 2 241.294 2.367 20 0 BEADLO COc1cc[nH+]cc1Nc1cccc(F)c1CO ZINC001176125330 977963998 /nfs/dbraw/zinc/96/39/98/977963998.db2.gz ZCYVBIIVWHYVAY-UHFFFAOYSA-N 1 2 248.257 2.465 20 0 BEADLO Cc1nnc(C[N@@H+]2CC[C@@](C)(CF)C2)s1 ZINC001232243561 977967516 /nfs/dbraw/zinc/96/75/16/977967516.db2.gz UNNMBXQVMXJFRZ-JTQLQIEISA-N 1 2 229.324 2.028 20 0 BEADLO Cc1nnc(C[N@H+]2CC[C@@](C)(CF)C2)s1 ZINC001232243561 977967524 /nfs/dbraw/zinc/96/75/24/977967524.db2.gz UNNMBXQVMXJFRZ-JTQLQIEISA-N 1 2 229.324 2.028 20 0 BEADLO COCc1cccc(C[N@@H+]2CCC[C@@H](F)C2)n1 ZINC001232256386 977981189 /nfs/dbraw/zinc/98/11/89/977981189.db2.gz RWCQMBSHOBKPRF-LLVKDONJSA-N 1 2 238.306 2.162 20 0 BEADLO COCc1cccc(C[N@H+]2CCC[C@@H](F)C2)n1 ZINC001232256386 977981210 /nfs/dbraw/zinc/98/12/10/977981210.db2.gz RWCQMBSHOBKPRF-LLVKDONJSA-N 1 2 238.306 2.162 20 0 BEADLO COCc1cccc(C[N@@H+]2CCC[C@H](F)C2)n1 ZINC001232255658 977981430 /nfs/dbraw/zinc/98/14/30/977981430.db2.gz RWCQMBSHOBKPRF-NSHDSACASA-N 1 2 238.306 2.162 20 0 BEADLO COCc1cccc(C[N@H+]2CCC[C@H](F)C2)n1 ZINC001232255658 977981442 /nfs/dbraw/zinc/98/14/42/977981442.db2.gz RWCQMBSHOBKPRF-NSHDSACASA-N 1 2 238.306 2.162 20 0 BEADLO C[N@H+](Cc1cc(Cl)cs1)C1COC1 ZINC001232281783 977994044 /nfs/dbraw/zinc/99/40/44/977994044.db2.gz RZHWVFJUODNZTO-UHFFFAOYSA-N 1 2 217.721 2.232 20 0 BEADLO C[N@@H+](Cc1cc(Cl)cs1)C1COC1 ZINC001232281783 977994055 /nfs/dbraw/zinc/99/40/55/977994055.db2.gz RZHWVFJUODNZTO-UHFFFAOYSA-N 1 2 217.721 2.232 20 0 BEADLO CCOc1ncc(C[N@@H+]2CC[C@H](F)C2)cc1C ZINC001232302999 977999091 /nfs/dbraw/zinc/99/90/91/977999091.db2.gz PUUQPMUDJROCBI-LBPRGKRZSA-N 1 2 238.306 2.333 20 0 BEADLO CCOc1ncc(C[N@H+]2CC[C@H](F)C2)cc1C ZINC001232302999 977999096 /nfs/dbraw/zinc/99/90/96/977999096.db2.gz PUUQPMUDJROCBI-LBPRGKRZSA-N 1 2 238.306 2.333 20 0 BEADLO Cc1cc(NCC[C@@H](O)C2CC2)nc(C2CC2)[nH+]1 ZINC001336871584 978012682 /nfs/dbraw/zinc/01/26/82/978012682.db2.gz DQGRBUYVJOTUQQ-GFCCVEGCSA-N 1 2 247.342 2.235 20 0 BEADLO COc1cc[nH+]c(Nc2csc(CO)c2)c1 ZINC001176368136 978053980 /nfs/dbraw/zinc/05/39/80/978053980.db2.gz MFBBFZOJHRNTMS-UHFFFAOYSA-N 1 2 236.296 2.388 20 0 BEADLO Cc1[nH]c(CN2Cc3cccc(F)c3C2)c[nH+]1 ZINC001232463924 978107902 /nfs/dbraw/zinc/10/79/02/978107902.db2.gz PBLNIVNETALDCN-UHFFFAOYSA-N 1 2 231.274 2.373 20 0 BEADLO Cc1[nH]cc(CN2Cc3cccc(F)c3C2)[nH+]1 ZINC001232463924 978107904 /nfs/dbraw/zinc/10/79/04/978107904.db2.gz PBLNIVNETALDCN-UHFFFAOYSA-N 1 2 231.274 2.373 20 0 BEADLO CNc1ccccc1C[NH+]1CC2(C1)CCCO2 ZINC001232667748 978223452 /nfs/dbraw/zinc/22/34/52/978223452.db2.gz DZAABDKKMAAJAA-UHFFFAOYSA-N 1 2 232.327 2.093 20 0 BEADLO CNc1ccccc1C[NH+]1CC(OC(C)C)C1 ZINC001232674503 978241093 /nfs/dbraw/zinc/24/10/93/978241093.db2.gz XWPBZZSBKVBNMZ-UHFFFAOYSA-N 1 2 234.343 2.338 20 0 BEADLO Cc1[nH]c(CNc2nc(C)cc(C)n2)[nH+]c1C ZINC001337270231 978258260 /nfs/dbraw/zinc/25/82/60/978258260.db2.gz ZIPLIOCXOUJEJF-UHFFFAOYSA-N 1 2 231.303 2.045 20 0 BEADLO CCc1[nH]c(CNC(=O)C2C(C)(C)C2(C)C)c[nH+]1 ZINC001597250425 978300674 /nfs/dbraw/zinc/30/06/74/978300674.db2.gz HDPPGOUDEWIOPF-UHFFFAOYSA-N 1 2 249.358 2.271 20 0 BEADLO CCc1[nH]cc(CNC(=O)C2C(C)(C)C2(C)C)[nH+]1 ZINC001597250425 978300683 /nfs/dbraw/zinc/30/06/83/978300683.db2.gz HDPPGOUDEWIOPF-UHFFFAOYSA-N 1 2 249.358 2.271 20 0 BEADLO COc1cc(C[N@H+](C)CCF)c(OC)cc1C ZINC001232834147 978305318 /nfs/dbraw/zinc/30/53/18/978305318.db2.gz IIOLPGVVZYFEDP-UHFFFAOYSA-N 1 2 241.306 2.414 20 0 BEADLO COc1cc(C[N@@H+](C)CCF)c(OC)cc1C ZINC001232834147 978305331 /nfs/dbraw/zinc/30/53/31/978305331.db2.gz IIOLPGVVZYFEDP-UHFFFAOYSA-N 1 2 241.306 2.414 20 0 BEADLO CCc1[nH]c(CNC(=O)c2cc(C)cs2)c[nH+]1 ZINC001597258323 978307284 /nfs/dbraw/zinc/30/72/84/978307284.db2.gz ZLAYVNHYWSYTLO-UHFFFAOYSA-N 1 2 249.339 2.272 20 0 BEADLO CCc1[nH]cc(CNC(=O)c2cc(C)cs2)[nH+]1 ZINC001597258323 978307294 /nfs/dbraw/zinc/30/72/94/978307294.db2.gz ZLAYVNHYWSYTLO-UHFFFAOYSA-N 1 2 249.339 2.272 20 0 BEADLO O=C(c1cc2c[nH+]ccc2[nH]1)N1CCCSC1 ZINC001337392044 978319812 /nfs/dbraw/zinc/31/98/12/978319812.db2.gz FOPKCQMHAPLDOD-UHFFFAOYSA-N 1 2 247.323 2.100 20 0 BEADLO Cc1cc(O)cc(C[N@@H+]2CCOCC23CC3)c1 ZINC001232881994 978320735 /nfs/dbraw/zinc/32/07/35/978320735.db2.gz MWBFIHKEAZJTIA-UHFFFAOYSA-N 1 2 233.311 2.065 20 0 BEADLO Cc1cc(O)cc(C[N@H+]2CCOCC23CC3)c1 ZINC001232881994 978320752 /nfs/dbraw/zinc/32/07/52/978320752.db2.gz MWBFIHKEAZJTIA-UHFFFAOYSA-N 1 2 233.311 2.065 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC[C@H]1CCC[C@@H](C)C1 ZINC001597575092 978342767 /nfs/dbraw/zinc/34/27/67/978342767.db2.gz QBARJWPQZUCEAN-PWSUYJOCSA-N 1 2 249.358 2.203 20 0 BEADLO CCNc1ccc(Nc2nccc(C)n2)c[nH+]1 ZINC001337541537 978400659 /nfs/dbraw/zinc/40/06/59/978400659.db2.gz RTCSYZLNEJZXBZ-UHFFFAOYSA-N 1 2 229.287 2.355 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H]1CC1(C)C ZINC001337640010 978437370 /nfs/dbraw/zinc/43/73/70/978437370.db2.gz MEDQPORBTUOSPG-SNVBAGLBSA-N 1 2 218.300 2.105 20 0 BEADLO c1ccn2nc(C[N@@H+]3CCC4(CCC4)C3)nc2c1 ZINC001233072902 978460475 /nfs/dbraw/zinc/46/04/75/978460475.db2.gz JRERBVOZKMITRE-UHFFFAOYSA-N 1 2 242.326 2.105 20 0 BEADLO c1ccn2nc(C[N@H+]3CCC4(CCC4)C3)nc2c1 ZINC001233072902 978460482 /nfs/dbraw/zinc/46/04/82/978460482.db2.gz JRERBVOZKMITRE-UHFFFAOYSA-N 1 2 242.326 2.105 20 0 BEADLO C[C@H]1CCC[N@H+](Cc2nc3ccccn3n2)[C@H]1C ZINC001233070192 978460530 /nfs/dbraw/zinc/46/05/30/978460530.db2.gz LTDBLIPCPDTFAU-RYUDHWBXSA-N 1 2 244.342 2.350 20 0 BEADLO C[C@H]1CCC[N@@H+](Cc2nc3ccccn3n2)[C@H]1C ZINC001233070192 978460539 /nfs/dbraw/zinc/46/05/39/978460539.db2.gz LTDBLIPCPDTFAU-RYUDHWBXSA-N 1 2 244.342 2.350 20 0 BEADLO Cc1csc(NC(=O)[C@@H](C)n2cc[nH+]c2)c1 ZINC001177922369 978473682 /nfs/dbraw/zinc/47/36/82/978473682.db2.gz UCRDSPIYECAQNV-SECBINFHSA-N 1 2 235.312 2.453 20 0 BEADLO Cc1cc(F)cc(N2CCO[C@@H](C)[C@@H]2C)[nH+]1 ZINC001337808630 978505144 /nfs/dbraw/zinc/50/51/44/978505144.db2.gz HFGIHNONMYGNHF-UWVGGRQHSA-N 1 2 224.279 2.143 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(=O)[C@H](C)CC2)sn1 ZINC001233309828 978532406 /nfs/dbraw/zinc/53/24/06/978532406.db2.gz DJDPTZSTYGLHRT-SECBINFHSA-N 1 2 238.356 2.253 20 0 BEADLO Cc1cc(C[N@H+]2CCC(=O)[C@H](C)CC2)sn1 ZINC001233309828 978532408 /nfs/dbraw/zinc/53/24/08/978532408.db2.gz DJDPTZSTYGLHRT-SECBINFHSA-N 1 2 238.356 2.253 20 0 BEADLO C[N@H+](Cc1ccc(F)c(F)c1)Cc1ccncn1 ZINC001204227504 978626012 /nfs/dbraw/zinc/62/60/12/978626012.db2.gz HZEGUZKYDAGGNY-UHFFFAOYSA-N 1 2 249.264 2.387 20 0 BEADLO C[N@@H+](Cc1ccc(F)c(F)c1)Cc1ccncn1 ZINC001204227504 978626023 /nfs/dbraw/zinc/62/60/23/978626023.db2.gz HZEGUZKYDAGGNY-UHFFFAOYSA-N 1 2 249.264 2.387 20 0 BEADLO CC(C)n1nccc1C[NH2+][C@H](C)c1ccn(C)n1 ZINC001178926836 978637438 /nfs/dbraw/zinc/63/74/38/978637438.db2.gz AHPSPUSPIVYTBZ-LLVKDONJSA-N 1 2 247.346 2.048 20 0 BEADLO COc1cc(C[NH+]2CC(C)C2)cnc1Cl ZINC001249916333 978661868 /nfs/dbraw/zinc/66/18/68/978661868.db2.gz CSJFAEAYMRZCDV-UHFFFAOYSA-N 1 2 226.707 2.195 20 0 BEADLO CC[C@@H](C)C(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001179087359 978667947 /nfs/dbraw/zinc/66/79/47/978667947.db2.gz CADBCMDOFQAESD-SECBINFHSA-N 1 2 223.320 2.195 20 0 BEADLO CC[C@@H](C)C(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001179087359 978667951 /nfs/dbraw/zinc/66/79/51/978667951.db2.gz CADBCMDOFQAESD-SECBINFHSA-N 1 2 223.320 2.195 20 0 BEADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1cc[nH]n1)CCO2 ZINC000068985277 978687145 /nfs/dbraw/zinc/68/71/45/978687145.db2.gz IJYGFTCNBDQFJK-GFCCVEGCSA-N 1 2 247.273 2.162 20 0 BEADLO CC[C@H](CO)Nc1cc(C)[nH+]c(C(C)(C)C)n1 ZINC000069697139 978748266 /nfs/dbraw/zinc/74/82/66/978748266.db2.gz HVJXLNADGRCKGC-SNVBAGLBSA-N 1 2 237.347 2.265 20 0 BEADLO CN(C)c1ccnc(Cl)c1C[NH+]1CCC1 ZINC001234094413 978773793 /nfs/dbraw/zinc/77/37/93/978773793.db2.gz CDAPFJBEVFNZJU-UHFFFAOYSA-N 1 2 225.723 2.007 20 0 BEADLO c1nc(N2CCC[C@@H]2C2CC2)cc(NC2CC2)[nH+]1 ZINC001339573662 978874495 /nfs/dbraw/zinc/87/44/95/978874495.db2.gz CFLKEKJBSYOUEY-GFCCVEGCSA-N 1 2 244.342 2.430 20 0 BEADLO c1nc(NC2CC2)cc(N2CCC[C@@H]2C2CC2)[nH+]1 ZINC001339573662 978874498 /nfs/dbraw/zinc/87/44/98/978874498.db2.gz CFLKEKJBSYOUEY-GFCCVEGCSA-N 1 2 244.342 2.430 20 0 BEADLO Cc1cc(F)cc(N2CC[C@]3(CCOC3)C2)[nH+]1 ZINC001339611305 978880496 /nfs/dbraw/zinc/88/04/96/978880496.db2.gz YHDSDKIJFGCXMS-ZDUSSCGKSA-N 1 2 236.290 2.146 20 0 BEADLO Cc1ccc(Nc2ccn(C)n2)c(C)[nH+]1 ZINC001203363023 978892115 /nfs/dbraw/zinc/89/21/15/978892115.db2.gz LAHFMSVCAZADLL-UHFFFAOYSA-N 1 2 202.261 2.176 20 0 BEADLO CCc1ccc(N2CC[C@@H](C(=O)OC)[C@H]2C)[nH+]c1 ZINC001339685135 978893502 /nfs/dbraw/zinc/89/35/02/978893502.db2.gz DFZKAXKCLAJUSA-ZYHUDNBSSA-N 1 2 248.326 2.032 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)C1(CF)CCC1 ZINC001331266315 978897404 /nfs/dbraw/zinc/89/74/04/978897404.db2.gz VGLWJEYVPUQSPI-UHFFFAOYSA-N 1 2 247.273 2.413 20 0 BEADLO COC1C[NH+](Cc2cccc(N3CCCC3)c2)C1 ZINC001235087838 978974104 /nfs/dbraw/zinc/97/41/04/978974104.db2.gz HLRYUHHSJROYRX-UHFFFAOYSA-N 1 2 246.354 2.117 20 0 BEADLO FC(F)(F)CCC[N@@H+]1CCC12CN(C1CC1)C2 ZINC001277922988 978975446 /nfs/dbraw/zinc/97/54/46/978975446.db2.gz PXTHEZVGDSXARW-UHFFFAOYSA-N 1 2 248.292 2.251 20 0 BEADLO FC(F)(F)CCC[N@H+]1CCC12CN(C1CC1)C2 ZINC001277922988 978975451 /nfs/dbraw/zinc/97/54/51/978975451.db2.gz PXTHEZVGDSXARW-UHFFFAOYSA-N 1 2 248.292 2.251 20 0 BEADLO CC(C)(CF)[NH2+]Cc1ncccc1F ZINC001181008067 978982008 /nfs/dbraw/zinc/98/20/08/978982008.db2.gz PBMICMMHUUQIPY-UHFFFAOYSA-N 1 2 200.232 2.058 20 0 BEADLO CCC[C@@H]1CCCN(C(=O)[C@H](C)n2cc[nH+]c2)C1 ZINC001340272581 978999521 /nfs/dbraw/zinc/99/95/21/978999521.db2.gz FUEMCKLLCSIVJA-QWHCGFSZSA-N 1 2 249.358 2.483 20 0 BEADLO CCc1cccc(C[N@H+]2CCC(=O)[C@@H](C)CC2)n1 ZINC001235252716 979007048 /nfs/dbraw/zinc/00/70/48/979007048.db2.gz FZZBTKRDHHTCSQ-LBPRGKRZSA-N 1 2 246.354 2.445 20 0 BEADLO CCc1cccc(C[N@@H+]2CCC(=O)[C@@H](C)CC2)n1 ZINC001235252716 979007054 /nfs/dbraw/zinc/00/70/54/979007054.db2.gz FZZBTKRDHHTCSQ-LBPRGKRZSA-N 1 2 246.354 2.445 20 0 BEADLO CCc1cccc(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)n1 ZINC001235267337 979013260 /nfs/dbraw/zinc/01/32/60/979013260.db2.gz RCAVPGLARYQOMM-NWDGAFQWSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1cccc(C[N@H+]2C[C@@H](C)OC[C@@H]2C)n1 ZINC001235267337 979013266 /nfs/dbraw/zinc/01/32/66/979013266.db2.gz RCAVPGLARYQOMM-NWDGAFQWSA-N 1 2 234.343 2.253 20 0 BEADLO CC1(C)C[C@@H]1C(=O)NCc1c[nH+]cn1C1CCC1 ZINC001181301162 979037102 /nfs/dbraw/zinc/03/71/02/979037102.db2.gz OYRQXIXAEAGHNQ-GFCCVEGCSA-N 1 2 247.342 2.270 20 0 BEADLO Cc1ncn(C)c1C[N@@H+]1CC[C@@](C)(F)[C@H](F)C1 ZINC001235539563 979077047 /nfs/dbraw/zinc/07/70/47/979077047.db2.gz VSZKOPWDNLGCDZ-VXGBXAGGSA-N 1 2 243.301 2.001 20 0 BEADLO Cc1ncn(C)c1C[N@H+]1CC[C@@](C)(F)[C@H](F)C1 ZINC001235539563 979077058 /nfs/dbraw/zinc/07/70/58/979077058.db2.gz VSZKOPWDNLGCDZ-VXGBXAGGSA-N 1 2 243.301 2.001 20 0 BEADLO Cc1nc2c(s1)CN(Cc1c(C)[nH+]cn1C)C2 ZINC001235555024 979100790 /nfs/dbraw/zinc/10/07/90/979100790.db2.gz HZTWGLXULKTAMY-UHFFFAOYSA-N 1 2 248.355 2.009 20 0 BEADLO COc1ncc(C[N@H+](C)CCF)cc1Cl ZINC001235709118 979129841 /nfs/dbraw/zinc/12/98/41/979129841.db2.gz JTUGHXBGLWAILR-UHFFFAOYSA-N 1 2 232.686 2.145 20 0 BEADLO COc1ncc(C[N@@H+](C)CCF)cc1Cl ZINC001235709118 979129843 /nfs/dbraw/zinc/12/98/43/979129843.db2.gz JTUGHXBGLWAILR-UHFFFAOYSA-N 1 2 232.686 2.145 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)CC1(C)CC1 ZINC001340810824 979116124 /nfs/dbraw/zinc/11/61/24/979116124.db2.gz QRJRZOZAUGSPJP-UHFFFAOYSA-N 1 2 218.300 2.249 20 0 BEADLO CC[N@H+](C)Cc1nc2ccc(F)cc2[nH]1 ZINC001235678651 979117477 /nfs/dbraw/zinc/11/74/77/979117477.db2.gz DKWBTCKESOHOEZ-UHFFFAOYSA-N 1 2 207.252 2.154 20 0 BEADLO CC[N@@H+](C)Cc1nc2ccc(F)cc2[nH]1 ZINC001235678651 979117483 /nfs/dbraw/zinc/11/74/83/979117483.db2.gz DKWBTCKESOHOEZ-UHFFFAOYSA-N 1 2 207.252 2.154 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc(F)c(CO)c1F ZINC001235884446 979181399 /nfs/dbraw/zinc/18/13/99/979181399.db2.gz GFJHDPGFBKXJJY-YALUOGEHSA-N 1 2 225.238 2.333 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC[C@@H]1CCCC[C@H]1C ZINC001603422083 979455072 /nfs/dbraw/zinc/45/50/72/979455072.db2.gz MNTJYBGFHSCHIW-PWSUYJOCSA-N 1 2 249.358 2.203 20 0 BEADLO Nc1ccc(-c2ccc3ncoc3c2)c[nH+]1 ZINC001236313606 979519170 /nfs/dbraw/zinc/51/91/70/979519170.db2.gz WJEFMMVQGKZQQE-UHFFFAOYSA-N 1 2 211.224 2.472 20 0 BEADLO Nc1ccc(-c2cccc(N3CCC3=O)c2)c[nH+]1 ZINC001236315160 979526416 /nfs/dbraw/zinc/52/64/16/979526416.db2.gz IFFDPQKTNSKZKY-UHFFFAOYSA-N 1 2 239.278 2.068 20 0 BEADLO COCc1cc(OC)ccc1-c1ccc(N)[nH+]c1 ZINC001236318639 979533271 /nfs/dbraw/zinc/53/32/71/979533271.db2.gz VSGWPMZLBAPKRJ-UHFFFAOYSA-N 1 2 244.294 2.486 20 0 BEADLO Nc1ccc(-c2ccc3c(c2)NCC3)c[nH+]1 ZINC001236319516 979533530 /nfs/dbraw/zinc/53/35/30/979533530.db2.gz YIZXUVLSGIDDGT-UHFFFAOYSA-N 1 2 211.268 2.299 20 0 BEADLO CO[C@H](C)CNc1ccc(N2CCCC2)c[nH+]1 ZINC001182497933 979544836 /nfs/dbraw/zinc/54/48/36/979544836.db2.gz GJSPUZNPOIFPGB-LLVKDONJSA-N 1 2 235.331 2.129 20 0 BEADLO COc1cncc(/C(C)=C/C=C/[NH3+])c1C ZINC001236384433 979573300 /nfs/dbraw/zinc/57/33/00/979573300.db2.gz ZZMKMTCVYXUFTE-REZHQCRGSA-N 1 2 204.273 2.274 20 0 BEADLO Nc1[nH+]cccc1CNc1cccc2c1OCC2 ZINC001182901582 979674367 /nfs/dbraw/zinc/67/43/67/979674367.db2.gz DIDFEIRSXUBNPP-UHFFFAOYSA-N 1 2 241.294 2.211 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1cc(Cl)cc(C)n1 ZINC001236651954 979687123 /nfs/dbraw/zinc/68/71/23/979687123.db2.gz NFANTPGGSDNNAY-GFCCVEGCSA-N 1 2 240.734 2.264 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1cc(Cl)cc(C)n1 ZINC001236651954 979687127 /nfs/dbraw/zinc/68/71/27/979687127.db2.gz NFANTPGGSDNNAY-GFCCVEGCSA-N 1 2 240.734 2.264 20 0 BEADLO Oc1cc(C[NH+]2CC3(CSC3)C2)ccc1F ZINC001236708123 979703931 /nfs/dbraw/zinc/70/39/31/979703931.db2.gz NPHZLZLTTSDYLA-UHFFFAOYSA-N 1 2 239.315 2.080 20 0 BEADLO c1cn2cc(C[C@@H]3CCCO3)ccc2[nH+]1 ZINC001250101285 979730089 /nfs/dbraw/zinc/73/00/89/979730089.db2.gz XJCFPYYNKATLOK-NSHDSACASA-N 1 2 202.257 2.056 20 0 BEADLO CCCCC1([NH2+]CC(=O)OC(C)C)CC1 ZINC001342345225 979775934 /nfs/dbraw/zinc/77/59/34/979775934.db2.gz IADIBRQTUNHSRH-UHFFFAOYSA-N 1 2 213.321 2.250 20 0 BEADLO COC1C[NH+](Cc2ccc(F)c3ccoc32)C1 ZINC001236892146 979781970 /nfs/dbraw/zinc/78/19/70/979781970.db2.gz ZYZASUPSVFAPAJ-UHFFFAOYSA-N 1 2 235.258 2.403 20 0 BEADLO Fc1ccc(C[NH+]2CCOCC2)c2occc21 ZINC001236892661 979782634 /nfs/dbraw/zinc/78/26/34/979782634.db2.gz FOWMFAHBMYFNFB-UHFFFAOYSA-N 1 2 235.258 2.404 20 0 BEADLO S=C1C=COC1C[N@@H+]1Cc2cccnc2C1 ZINC001237180677 979826845 /nfs/dbraw/zinc/82/68/45/979826845.db2.gz DVACVGIPSWQIJZ-UHFFFAOYSA-N 1 2 232.308 2.479 20 0 BEADLO S=C1C=COC1C[N@H+]1Cc2cccnc2C1 ZINC001237180677 979826847 /nfs/dbraw/zinc/82/68/47/979826847.db2.gz DVACVGIPSWQIJZ-UHFFFAOYSA-N 1 2 232.308 2.479 20 0 BEADLO Cc1cc(F)cc(C)c1C[N@@H+]1CCO[C@H]2C[C@H]21 ZINC001237327081 979871156 /nfs/dbraw/zinc/87/11/56/979871156.db2.gz YMXCPZOVLBHZMK-KGLIPLIRSA-N 1 2 235.302 2.416 20 0 BEADLO Cc1cc(F)cc(C)c1C[N@H+]1CCO[C@H]2C[C@H]21 ZINC001237327081 979871160 /nfs/dbraw/zinc/87/11/60/979871160.db2.gz YMXCPZOVLBHZMK-KGLIPLIRSA-N 1 2 235.302 2.416 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@@H]1CC[C@@H]2C[C@@H]2CC1 ZINC001342724329 979879320 /nfs/dbraw/zinc/87/93/20/979879320.db2.gz FQTSUXSCPOPUSM-CNDDSTCGSA-N 1 2 248.326 2.290 20 0 BEADLO OC1C[NH+](Cc2cccc3c(F)cccc23)C1 ZINC001237521802 979925334 /nfs/dbraw/zinc/92/53/34/979925334.db2.gz MFCHSTJHEOVDAU-UHFFFAOYSA-N 1 2 231.270 2.155 20 0 BEADLO COc1c(C)cccc1C[N@@H+]1CCOCC12CC2 ZINC001237508812 979925587 /nfs/dbraw/zinc/92/55/87/979925587.db2.gz SOWXVJMEZKFFEQ-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO COc1c(C)cccc1C[N@H+]1CCOCC12CC2 ZINC001237508812 979925594 /nfs/dbraw/zinc/92/55/94/979925594.db2.gz SOWXVJMEZKFFEQ-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO COc1c(C)cccc1C[N@H+](C)C1(C)COC1 ZINC001237512376 979927820 /nfs/dbraw/zinc/92/78/20/979927820.db2.gz DCGBLTUSRRQMFV-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO COc1c(C)cccc1C[N@@H+](C)C1(C)COC1 ZINC001237512376 979927823 /nfs/dbraw/zinc/92/78/23/979927823.db2.gz DCGBLTUSRRQMFV-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO CCn1c[nH+]cc1CN1CCC(F)(F)[C@@H](F)C1 ZINC001237587344 979944223 /nfs/dbraw/zinc/94/42/23/979944223.db2.gz CGGCQTKIODWJRW-JTQLQIEISA-N 1 2 247.264 2.082 20 0 BEADLO CC(C)c1ocnc1C[NH2+][C@@H](C)c1cn[nH]c1 ZINC001343046115 979991576 /nfs/dbraw/zinc/99/15/76/979991576.db2.gz AILWFQYEGBXQGG-VIFPVBQESA-N 1 2 234.303 2.372 20 0 BEADLO CCc1n[nH]cc1C[N@@H+]1CC[C@](C)(F)[C@H](F)C1 ZINC001237651332 980006256 /nfs/dbraw/zinc/00/62/56/980006256.db2.gz JOFPPAIEUJXSQW-NEPJUHHUSA-N 1 2 243.301 2.244 20 0 BEADLO CCc1n[nH]cc1C[N@H+]1CC[C@](C)(F)[C@H](F)C1 ZINC001237651332 980006263 /nfs/dbraw/zinc/00/62/63/980006263.db2.gz JOFPPAIEUJXSQW-NEPJUHHUSA-N 1 2 243.301 2.244 20 0 BEADLO Fc1cccc2nc(NCCn3cc[nH+]c3)oc21 ZINC001184563406 980105102 /nfs/dbraw/zinc/10/51/02/980105102.db2.gz JBTBBLNEARVXRU-UHFFFAOYSA-N 1 2 246.245 2.276 20 0 BEADLO CO[C@@H]1CC[N@H+](Cc2cnc(F)cc2Cl)C1 ZINC001238019109 980124310 /nfs/dbraw/zinc/12/43/10/980124310.db2.gz ZOGJQOFZCMTSJJ-SECBINFHSA-N 1 2 244.697 2.095 20 0 BEADLO C[N@H+](CCF)Cc1cncc(C2CC2)c1 ZINC001238197281 980222022 /nfs/dbraw/zinc/22/20/22/980222022.db2.gz SOJNRTIHIBJRST-UHFFFAOYSA-N 1 2 208.280 2.360 20 0 BEADLO C[N@@H+](CCF)Cc1cncc(C2CC2)c1 ZINC001238197281 980222033 /nfs/dbraw/zinc/22/20/33/980222033.db2.gz SOJNRTIHIBJRST-UHFFFAOYSA-N 1 2 208.280 2.360 20 0 BEADLO Fc1ccnc(Cl)c1C[NH+]1CCCC1 ZINC001238225914 980227222 /nfs/dbraw/zinc/22/72/22/980227222.db2.gz QGYOOGCORMMQJT-UHFFFAOYSA-N 1 2 214.671 2.470 20 0 BEADLO COc1cc(C[N@H+](C)C2CC2)c(Cl)cn1 ZINC001238360701 980242571 /nfs/dbraw/zinc/24/25/71/980242571.db2.gz NZGOZNZSCYWYIY-UHFFFAOYSA-N 1 2 226.707 2.338 20 0 BEADLO COc1cc(C[N@@H+](C)C2CC2)c(Cl)cn1 ZINC001238360701 980242581 /nfs/dbraw/zinc/24/25/81/980242581.db2.gz NZGOZNZSCYWYIY-UHFFFAOYSA-N 1 2 226.707 2.338 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@@H](C)C2)cnc1C1CC1 ZINC001238619315 980303875 /nfs/dbraw/zinc/30/38/75/980303875.db2.gz GDNYBRWCMKARAI-LBPRGKRZSA-N 1 2 246.354 2.488 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@@H](C)C2)cnc1C1CC1 ZINC001238619315 980303883 /nfs/dbraw/zinc/30/38/83/980303883.db2.gz GDNYBRWCMKARAI-LBPRGKRZSA-N 1 2 246.354 2.488 20 0 BEADLO CC(C)(O)/C=C/c1c[nH+]c2c(c1)CCCN2 ZINC001239160914 980476377 /nfs/dbraw/zinc/47/63/77/980476377.db2.gz LETDUORIPCCYQZ-AATRIKPKSA-N 1 2 218.300 2.224 20 0 BEADLO Cc1cc(C(=O)OCCCc2c[nH+]cn2C)co1 ZINC001344917881 980500609 /nfs/dbraw/zinc/50/06/09/980500609.db2.gz ZNZPWWUKRVZDCR-UHFFFAOYSA-N 1 2 248.282 2.111 20 0 BEADLO CCc1[nH]c(CNc2nc(C3CC3)ns2)c[nH+]1 ZINC001187739857 980546772 /nfs/dbraw/zinc/54/67/72/980546772.db2.gz LWWILYKBFIRLOE-UHFFFAOYSA-N 1 2 249.343 2.313 20 0 BEADLO CCc1[nH]cc(CNc2nc(C3CC3)ns2)[nH+]1 ZINC001187739857 980546779 /nfs/dbraw/zinc/54/67/79/980546779.db2.gz LWWILYKBFIRLOE-UHFFFAOYSA-N 1 2 249.343 2.313 20 0 BEADLO Cc1ccoc1C(=O)OCC(C)(C)n1cc[nH+]c1 ZINC001345333830 980601485 /nfs/dbraw/zinc/60/14/85/980601485.db2.gz ZSCJKTHHXDUJFA-UHFFFAOYSA-N 1 2 248.282 2.377 20 0 BEADLO Cc1cc(C(=O)Nc2cccc3[nH+]ccn32)c[nH]1 ZINC001188187397 980613722 /nfs/dbraw/zinc/61/37/22/980613722.db2.gz HNGZAHSZNMSZCF-UHFFFAOYSA-N 1 2 240.266 2.223 20 0 BEADLO COC(=[NH2+])c1cccc(C2=CCOC2)c1 ZINC001239490745 980650823 /nfs/dbraw/zinc/65/08/23/980650823.db2.gz ZOUJEADODRURBL-UHFFFAOYSA-N 1 2 203.241 2.072 20 0 BEADLO CCC(CC)Cc1nnc(C[NH+](C)C)o1 ZINC001345941744 980713750 /nfs/dbraw/zinc/71/37/50/980713750.db2.gz PEXRFYKLKCVPII-UHFFFAOYSA-N 1 2 211.309 2.110 20 0 BEADLO CC(C)N(C(=O)CCc1[nH+]ccn1C)C1CCC1 ZINC001346075719 980748518 /nfs/dbraw/zinc/74/85/18/980748518.db2.gz DPCDJYFNKXCXMH-UHFFFAOYSA-N 1 2 249.358 2.142 20 0 BEADLO c1cn(CCc2cc3cccnc3[nH]2)c[nH+]1 ZINC001250319983 980763339 /nfs/dbraw/zinc/76/33/39/980763339.db2.gz GYRUOSBAJRUXNB-UHFFFAOYSA-N 1 2 212.256 2.002 20 0 BEADLO COc1cc[nH+]cc1CCC(=O)OC(C)(C)C ZINC001250330007 980787026 /nfs/dbraw/zinc/78/70/26/980787026.db2.gz ZUFONCWFDBGQJN-UHFFFAOYSA-N 1 2 237.299 2.365 20 0 BEADLO O[C@@H](C[NH2+]CC(F)F)c1cccc(Cl)c1 ZINC001346226970 980792900 /nfs/dbraw/zinc/79/29/00/980792900.db2.gz ZHKGSMBCOICZQS-VIFPVBQESA-N 1 2 235.661 2.228 20 0 BEADLO Cn1c[nH+]cc1CCCOC(=O)C1(C)CC=CC1 ZINC001346235512 980794840 /nfs/dbraw/zinc/79/48/40/980794840.db2.gz MFQKUBWMWNYBGY-UHFFFAOYSA-N 1 2 248.326 2.252 20 0 BEADLO Cc1ccc(-c2ccc3c(c2)OCCO3)[nH+]c1N ZINC001239601349 980801618 /nfs/dbraw/zinc/80/16/18/980801618.db2.gz PQMYZFRBORFYHM-UHFFFAOYSA-N 1 2 242.278 2.410 20 0 BEADLO C[C@@H](C(=O)N(C)[C@@H](C)c1ccco1)n1cc[nH+]c1 ZINC000076901997 980805743 /nfs/dbraw/zinc/80/57/43/980805743.db2.gz GIDMUYBYBMOIQQ-QWRGUYRKSA-N 1 2 247.298 2.257 20 0 BEADLO C[C@H]1CC/C(=C\c2nnc(C[NH+](C)C)o2)C1 ZINC001346624924 980871022 /nfs/dbraw/zinc/87/10/22/980871022.db2.gz CZEUWDUPRIECIJ-HZAKCSEPSA-N 1 2 221.304 2.335 20 0 BEADLO COc1ccc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)c(C)c1C ZINC001203724024 980882087 /nfs/dbraw/zinc/88/20/87/980882087.db2.gz XHJHSAJQGFPMNJ-DZGCQCFKSA-N 1 2 247.338 2.285 20 0 BEADLO COc1ccc(C[N@H+]2CCO[C@@H]3C[C@@H]32)c(C)c1C ZINC001203724024 980882090 /nfs/dbraw/zinc/88/20/90/980882090.db2.gz XHJHSAJQGFPMNJ-DZGCQCFKSA-N 1 2 247.338 2.285 20 0 BEADLO CCn1c[nH+]cc1COC(=O)c1cc(C)c(C)o1 ZINC001346748634 980897952 /nfs/dbraw/zinc/89/79/52/980897952.db2.gz XMKQGSHCOKVYBB-UHFFFAOYSA-N 1 2 248.282 2.470 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@]12C[C@H]1CCC2 ZINC001346746908 980897978 /nfs/dbraw/zinc/89/79/78/980897978.db2.gz HWYMHGMKYOVRRD-ZWNOBZJWSA-N 1 2 234.299 2.136 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc(C(=O)N(C)C)cc1 ZINC001239800692 980938607 /nfs/dbraw/zinc/93/86/07/980938607.db2.gz NHMDQUSDPOWSFA-ZVSIBQGLSA-N 1 2 230.311 2.264 20 0 BEADLO Nc1ccc(-c2cc3[nH]ccc3c[nH+]2)c(F)n1 ZINC001239809711 980948285 /nfs/dbraw/zinc/94/82/85/980948285.db2.gz YJJVDGBEMPEPGM-UHFFFAOYSA-N 1 2 228.230 2.346 20 0 BEADLO COc1ncc(-c2cccc3[nH+]c(C)cn32)cn1 ZINC001239845786 980984120 /nfs/dbraw/zinc/98/41/20/980984120.db2.gz YJDCNCAVLMRNDU-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO COc1ncc(-c2cn3cc[nH+]c3cc2C)cn1 ZINC001239846671 980985958 /nfs/dbraw/zinc/98/59/58/980985958.db2.gz RDJRZVDYEZBLHF-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO Cc1cc(Cc2c[nH+]c(C)cc2C)n(C)n1 ZINC001250419886 980998504 /nfs/dbraw/zinc/99/85/04/980998504.db2.gz PAYPTHGGOLDOQI-UHFFFAOYSA-N 1 2 215.300 2.331 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N(C)CC2CCC2)c[nH+]1 ZINC001347226288 981013430 /nfs/dbraw/zinc/01/34/30/981013430.db2.gz CDXYVTVQIRHZBA-UHFFFAOYSA-N 1 2 249.358 2.185 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2cncnc2c1 ZINC001239986862 981086223 /nfs/dbraw/zinc/08/62/23/981086223.db2.gz XGZMETOZYFZTHJ-UHFFFAOYSA-N 1 2 210.240 2.030 20 0 BEADLO Nc1cc(-c2ccc3cncnc3c2)cc[nH+]1 ZINC001239986483 981086775 /nfs/dbraw/zinc/08/67/75/981086775.db2.gz NIBBKGROUIOYSV-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO CC(C)C(NC(=O)[C@@H](C)n1cc[nH+]c1)C(C)C ZINC001347523016 981104731 /nfs/dbraw/zinc/10/47/31/981104731.db2.gz LBTKLGWAPXUNQO-LLVKDONJSA-N 1 2 237.347 2.241 20 0 BEADLO Cc1nccc(C[NH+]2Cc3ccccc3C2)n1 ZINC000335778676 981110905 /nfs/dbraw/zinc/11/09/05/981110905.db2.gz GCTHITOYFGLYHT-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@@H]3[C@H](C2)C3(F)F)no1 ZINC001192391339 981155350 /nfs/dbraw/zinc/15/53/50/981155350.db2.gz RXPNFGFIGOQLMP-ZJUUUORDSA-N 1 2 228.242 2.070 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@@H]3[C@H](C2)C3(F)F)no1 ZINC001192391339 981155355 /nfs/dbraw/zinc/15/53/55/981155355.db2.gz RXPNFGFIGOQLMP-ZJUUUORDSA-N 1 2 228.242 2.070 20 0 BEADLO C[C@H](C(=O)N[C@H]1CC2CCC1CC2)n1cc[nH+]c1 ZINC001347729998 981156177 /nfs/dbraw/zinc/15/61/77/981156177.db2.gz YZTHHPDTOXVCCE-XVSSEFHLSA-N 1 2 247.342 2.139 20 0 BEADLO c1cn2cc(-c3ncnc4c3CCC4)ccc2[nH+]1 ZINC001240214330 981161098 /nfs/dbraw/zinc/16/10/98/981161098.db2.gz NZPKOQVWTVCOBA-UHFFFAOYSA-N 1 2 236.278 2.280 20 0 BEADLO c1cc2ncc(-c3ccc4[nH+]ccn4c3)nc2[nH]1 ZINC001240214372 981161236 /nfs/dbraw/zinc/16/12/36/981161236.db2.gz JRFOYCFAMRNFGN-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO Cc1nccnc1-c1ccc2[nH+]ccn2c1 ZINC001240215435 981163516 /nfs/dbraw/zinc/16/35/16/981163516.db2.gz RHQYPFMVSYQPLG-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO Cc1ncc(C)c(-c2ccc3[nH+]ccn3c2)n1 ZINC001240214848 981164522 /nfs/dbraw/zinc/16/45/22/981164522.db2.gz SRSGHMXYQXZNBU-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO CCOc1cc(-c2ccc3[nH+]ccn3c2)ncn1 ZINC001240216725 981166808 /nfs/dbraw/zinc/16/68/08/981166808.db2.gz MQWZEXANGUQJTC-UHFFFAOYSA-N 1 2 240.266 2.190 20 0 BEADLO c1cn2cc(-c3ccc4ncnn4c3)ccc2[nH+]1 ZINC001240217603 981166845 /nfs/dbraw/zinc/16/68/45/981166845.db2.gz RZCABZNNCYNDCT-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO O=C1NCc2cc(-c3ccc4[nH+]ccn4c3)ccc21 ZINC001240218009 981167418 /nfs/dbraw/zinc/16/74/18/981167418.db2.gz WAOVXPPMODRUPM-UHFFFAOYSA-N 1 2 249.273 2.245 20 0 BEADLO Nc1cncc(F)c1-c1ccc2[nH+]ccn2c1 ZINC001240217923 981168058 /nfs/dbraw/zinc/16/80/58/981168058.db2.gz QUPSIBRZZOESGS-UHFFFAOYSA-N 1 2 228.230 2.118 20 0 BEADLO c1cn2cc(-c3ccn4ncnc4c3)ccc2[nH+]1 ZINC001240219847 981169590 /nfs/dbraw/zinc/16/95/90/981169590.db2.gz XGHSMJCQHJRSDG-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO C[C@H](C(=O)N[C@H](C1CC1)C1CCC1)n1cc[nH+]c1 ZINC001348023567 981251844 /nfs/dbraw/zinc/25/18/44/981251844.db2.gz JUTIOKIHHNPSCT-MFKMUULPSA-N 1 2 247.342 2.139 20 0 BEADLO C[C@H](CC(C)(C)C)NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001348024996 981252271 /nfs/dbraw/zinc/25/22/71/981252271.db2.gz XXDQEKSDWWRUOG-MNOVXSKESA-N 1 2 237.347 2.385 20 0 BEADLO C[C@@H](C(=O)N[C@@H](C1CC1)C1CCC1)n1cc[nH+]c1 ZINC001348023566 981252916 /nfs/dbraw/zinc/25/29/16/981252916.db2.gz JUTIOKIHHNPSCT-GXFFZTMASA-N 1 2 247.342 2.139 20 0 BEADLO Cc1cn2cc(-c3ccc4ncnn4c3)ccc2[nH+]1 ZINC001240357497 981313939 /nfs/dbraw/zinc/31/39/39/981313939.db2.gz DXGOEKQHQLNUTK-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO CCc1ccc(N2C[C@@H]3COC[C@@]3(C)C2)[nH+]c1 ZINC001348247591 981317516 /nfs/dbraw/zinc/31/75/16/981317516.db2.gz RTYXHJWWIHANQR-TZMCWYRMSA-N 1 2 232.327 2.117 20 0 BEADLO Cc1cc(-c2cncnc2)cn2cc[nH+]c12 ZINC001240376196 981328589 /nfs/dbraw/zinc/32/85/89/981328589.db2.gz ZKCUYGSALUYSCL-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO Nc1[nH+]cccc1-c1cnc2[nH]ccc2c1 ZINC001240392489 981352557 /nfs/dbraw/zinc/35/25/57/981352557.db2.gz KCJOFGKWNILNFH-UHFFFAOYSA-N 1 2 210.240 2.159 20 0 BEADLO Cc1cncc(-c2ccn3cc[nH+]c3c2)n1 ZINC001240496115 981414982 /nfs/dbraw/zinc/41/49/82/981414982.db2.gz GSJOSTHTTCCZDD-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO Cn1ccc2c1ncnc2-c1ccn2cc[nH+]c2c1 ZINC001240496096 981415714 /nfs/dbraw/zinc/41/57/14/981415714.db2.gz FXUPKJLDFPCIIQ-UHFFFAOYSA-N 1 2 249.277 2.283 20 0 BEADLO c1cn2ccc(-c3nncc4cnccc43)cc2[nH+]1 ZINC001240497205 981417200 /nfs/dbraw/zinc/41/72/00/981417200.db2.gz NDAMOSMBHSDCJU-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO Cc1ccc(-c2ccn3cc[nH+]c3c2)nc1N ZINC001240497507 981417879 /nfs/dbraw/zinc/41/78/79/981417879.db2.gz QSEOVLRSPVVALG-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO Cc1cnc(C)c(-c2ccn3cc[nH+]c3c2)n1 ZINC001240497297 981418510 /nfs/dbraw/zinc/41/85/10/981418510.db2.gz VFXKJMGAXPPWEY-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO CCc1ccnc(-c2ccn3cc[nH+]c3c2)n1 ZINC001240496342 981418765 /nfs/dbraw/zinc/41/87/65/981418765.db2.gz MIRAIEUZHCOJGT-UHFFFAOYSA-N 1 2 224.267 2.354 20 0 BEADLO COc1c(C)ncnc1-c1ccn2cc[nH+]c2c1 ZINC001240502979 981431286 /nfs/dbraw/zinc/43/12/86/981431286.db2.gz DBHQVGJRZZCQLK-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO Nc1nccc(F)c1-c1ccn2cc[nH+]c2c1 ZINC001240504089 981431621 /nfs/dbraw/zinc/43/16/21/981431621.db2.gz XYVOORNSGANMHX-UHFFFAOYSA-N 1 2 228.230 2.118 20 0 BEADLO O=C1NCc2cccc(-c3ccn4cc[nH+]c4c3)c21 ZINC001240503190 981431697 /nfs/dbraw/zinc/43/16/97/981431697.db2.gz JTIDLHBPPBRJBP-UHFFFAOYSA-N 1 2 249.273 2.245 20 0 BEADLO CN(C)c1cc(-c2ccn3cc[nH+]c3c2)ccn1 ZINC001240508646 981434651 /nfs/dbraw/zinc/43/46/51/981434651.db2.gz HGAJUWXWNRUABL-UHFFFAOYSA-N 1 2 238.294 2.462 20 0 BEADLO CCc1ncc(-c2ccn3cc[nH+]c3c2)cn1 ZINC001240509166 981434726 /nfs/dbraw/zinc/43/47/26/981434726.db2.gz UEEGWAGFCOOHSJ-UHFFFAOYSA-N 1 2 224.267 2.354 20 0 BEADLO CCC(C)(C)CCNC(=O)[C@H](C)n1cc[nH+]c1 ZINC001348751802 981436060 /nfs/dbraw/zinc/43/60/60/981436060.db2.gz BSLLXNNECPCDTO-NSHDSACASA-N 1 2 237.347 2.387 20 0 BEADLO Cc1nnc2cc(-c3ccn4cc[nH+]c4c3)ccn12 ZINC001240510726 981436104 /nfs/dbraw/zinc/43/61/04/981436104.db2.gz PTCQZSLXZNVCHN-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO CN(C)c1cncc(-c2ccn3cc[nH+]c3c2)c1 ZINC001240513296 981439170 /nfs/dbraw/zinc/43/91/70/981439170.db2.gz KRVSSZQBNBGWEV-UHFFFAOYSA-N 1 2 238.294 2.462 20 0 BEADLO Cc1cc(N[C@@H](CO)C(C)C)nc(C2CCC2)[nH+]1 ZINC001348810366 981447646 /nfs/dbraw/zinc/44/76/46/981447646.db2.gz UNTFYQCKKRMQLI-LBPRGKRZSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1cc(NC(=O)CCc2[nH+]ccn2C)cs1 ZINC001348927759 981478869 /nfs/dbraw/zinc/47/88/69/981478869.db2.gz BIMDFJWFSSRWTK-UHFFFAOYSA-N 1 2 249.339 2.361 20 0 BEADLO CNc1ncc2cc(-c3c[nH+]cn3C)ccc2n1 ZINC001240599819 981494906 /nfs/dbraw/zinc/49/49/06/981494906.db2.gz SEECAFFYFOSYQN-UHFFFAOYSA-N 1 2 239.282 2.072 20 0 BEADLO Cc1cnccc1-c1ccn2cc(N)[nH+]c2c1 ZINC001240608931 981501150 /nfs/dbraw/zinc/50/11/50/981501150.db2.gz TYKWQWIKXXRUFP-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO COc1cc(-c2c[nH+]c(N)c(C)c2)cnc1OC ZINC001240622351 981517142 /nfs/dbraw/zinc/51/71/42/981517142.db2.gz FJUCQGFETUFFKY-UHFFFAOYSA-N 1 2 245.282 2.051 20 0 BEADLO CC[C@H](F)C(=O)Nc1cccc2[nH+]ccn21 ZINC001349307617 981530389 /nfs/dbraw/zinc/53/03/89/981530389.db2.gz ORXKITZTCDGUCW-QMMMGPOBSA-N 1 2 221.235 2.021 20 0 BEADLO c1ccc(N2CC[C@H](CN3CCCC[NH2+]3)C2)cc1 ZINC001580895209 981722149 /nfs/dbraw/zinc/72/21/49/981722149.db2.gz GSPVQOPFXKZKCC-AWEZNQCLSA-N 1 2 245.370 2.113 20 0 BEADLO Cc1ccc(OC(=O)NCc2c[nH+]cn2C)cc1 ZINC001194421100 981808281 /nfs/dbraw/zinc/80/82/81/981808281.db2.gz RRHKIWKOSZVPAQ-UHFFFAOYSA-N 1 2 245.282 2.017 20 0 BEADLO COc1cc2[nH+]ccn2cc1-c1cc(C)nn1C ZINC001240859913 981899451 /nfs/dbraw/zinc/89/94/51/981899451.db2.gz PASVVGVNUYGGMB-UHFFFAOYSA-N 1 2 242.282 2.052 20 0 BEADLO CSc1ccc(C[N@@H+]2CC[C@@]23CCOC3)o1 ZINC001350326475 981925121 /nfs/dbraw/zinc/92/51/21/981925121.db2.gz CPVNLXFRSYBNSA-LBPRGKRZSA-N 1 2 239.340 2.366 20 0 BEADLO CSc1ccc(C[N@H+]2CC[C@@]23CCOC3)o1 ZINC001350326475 981925128 /nfs/dbraw/zinc/92/51/28/981925128.db2.gz CPVNLXFRSYBNSA-LBPRGKRZSA-N 1 2 239.340 2.366 20 0 BEADLO C[C@@H]([NH2+]Cc1ncn[nH]1)C1CCC(F)(F)CC1 ZINC001350382817 981958003 /nfs/dbraw/zinc/95/80/03/981958003.db2.gz ZDCXMAGNSSOMGG-MRVPVSSYSA-N 1 2 244.289 2.108 20 0 BEADLO Oc1cccc(-c2nc3[nH]ccc3c[nH+]2)c1 ZINC001240920731 981979929 /nfs/dbraw/zinc/97/99/29/981979929.db2.gz CFIJMHUIRVMGPF-UHFFFAOYSA-N 1 2 211.224 2.282 20 0 BEADLO Cc1c(-c2cnn3cccnc23)ccc2[nH+]ccn21 ZINC001240939210 982013509 /nfs/dbraw/zinc/01/35/09/982013509.db2.gz QSWLLQOPMODGQT-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO CC[C@H](C)C[C@@H](C)NC(=O)Cc1[nH]c[nH+]c1C ZINC001586816088 982024472 /nfs/dbraw/zinc/02/44/72/982024472.db2.gz JEXFPELXZJRCRL-VHSXEESVSA-N 1 2 237.347 2.202 20 0 BEADLO CC(C)(C)c1cn(CCOC2CC2)c[nH+]1 ZINC001350847905 982102696 /nfs/dbraw/zinc/10/26/96/982102696.db2.gz WTBJFRGSDPHIHK-UHFFFAOYSA-N 1 2 208.305 2.360 20 0 BEADLO Oc1ccccc1-c1c[nH+]c2c(c1)CCCN2 ZINC001241022880 982118729 /nfs/dbraw/zinc/11/87/29/982118729.db2.gz HJRPMEOMGGUSQV-UHFFFAOYSA-N 1 2 226.279 2.455 20 0 BEADLO Cc1c(-c2ccc[nH]c2=O)ccc2[nH+]ccn21 ZINC001241127599 982256183 /nfs/dbraw/zinc/25/61/83/982256183.db2.gz JLDHVJXZTFHCFV-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO OCc1ccc(F)c(-c2cc[nH+]c3c2CCN3)c1 ZINC001241154724 982293177 /nfs/dbraw/zinc/29/31/77/982293177.db2.gz FLCKBHWAMHFMIJ-UHFFFAOYSA-N 1 2 244.269 2.348 20 0 BEADLO COc1ncc(-c2cc[nH+]c(N)c2)cc1C ZINC001241164174 982305690 /nfs/dbraw/zinc/30/56/90/982305690.db2.gz XAGMZNQLQZMWNK-UHFFFAOYSA-N 1 2 215.256 2.043 20 0 BEADLO Nc1cnc2c(cccc2-c2cc[nH+]c(N)c2)c1 ZINC001241169862 982310572 /nfs/dbraw/zinc/31/05/72/982310572.db2.gz PKGARKIPRFWABX-UHFFFAOYSA-N 1 2 236.278 2.461 20 0 BEADLO Nc1ccc2cc(-c3cc[nH+]c(N)c3)ccc2n1 ZINC001241169677 982311342 /nfs/dbraw/zinc/31/13/42/982311342.db2.gz KMVQEBXUBABFHD-UHFFFAOYSA-N 1 2 236.278 2.461 20 0 BEADLO COC(=[NH2+])c1cccc(-c2ccnc(N)c2)c1 ZINC001241169595 982312769 /nfs/dbraw/zinc/31/27/69/982312769.db2.gz HESBVABWFBWONJ-UHFFFAOYSA-N 1 2 227.267 2.303 20 0 BEADLO Nc1cc(-c2cccc3cnncc32)cc[nH+]1 ZINC001241170630 982320227 /nfs/dbraw/zinc/32/02/27/982320227.db2.gz SRUOBWFFLNSVMU-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO Nc1cc(-c2ccc3ccc(=O)oc3c2)cc[nH+]1 ZINC001241170902 982322752 /nfs/dbraw/zinc/32/27/52/982322752.db2.gz XBBNZPDDYVEONF-UHFFFAOYSA-N 1 2 238.246 2.437 20 0 BEADLO Cc1nc2[nH]ccc2cc1-c1cc[nH+]c(N)c1 ZINC001241171214 982324018 /nfs/dbraw/zinc/32/40/18/982324018.db2.gz YXACTUSOWCEBCB-UHFFFAOYSA-N 1 2 224.267 2.467 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@H+](C)Cc1ncoc1C(C)C ZINC001351737552 982369844 /nfs/dbraw/zinc/36/98/44/982369844.db2.gz YNASGILCDQZOGG-NWDGAFQWSA-N 1 2 238.331 2.407 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@@H+](C)Cc1ncoc1C(C)C ZINC001351737552 982369851 /nfs/dbraw/zinc/36/98/51/982369851.db2.gz YNASGILCDQZOGG-NWDGAFQWSA-N 1 2 238.331 2.407 20 0 BEADLO Cc1nccc(-c2c[nH+]c(N(C)C)cc2C)n1 ZINC001241228168 982377653 /nfs/dbraw/zinc/37/76/53/982377653.db2.gz ICVVJVXYGCVLSX-UHFFFAOYSA-N 1 2 228.299 2.221 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1nccnc1C ZINC001241228465 982379991 /nfs/dbraw/zinc/37/99/91/982379991.db2.gz NSDLFFKCHJWYQC-UHFFFAOYSA-N 1 2 228.299 2.221 20 0 BEADLO Cc1cnc(-c2c[nH+]c(N(C)C)cc2C)cn1 ZINC001241228864 982380396 /nfs/dbraw/zinc/38/03/96/982380396.db2.gz UTAYNLFSMZFHHQ-UHFFFAOYSA-N 1 2 228.299 2.221 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1cccc(N)n1 ZINC001241228833 982381591 /nfs/dbraw/zinc/38/15/91/982381591.db2.gz SDWITDZMSNTFHF-UHFFFAOYSA-N 1 2 228.299 2.100 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1cncnc1C ZINC001241242961 982385171 /nfs/dbraw/zinc/38/51/71/982385171.db2.gz BWGZMSDCCUPWDS-UHFFFAOYSA-N 1 2 228.299 2.221 20 0 BEADLO CCc1ccc(C[N@@H+]2CCn3nccc3C2)cc1 ZINC001196409019 982451091 /nfs/dbraw/zinc/45/10/91/982451091.db2.gz DBCDTMITVGKSMR-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO CCc1ccc(C[N@H+]2CCn3nccc3C2)cc1 ZINC001196409019 982451102 /nfs/dbraw/zinc/45/11/02/982451102.db2.gz DBCDTMITVGKSMR-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO CCCCCNC(=S)Nc1cc[nH+]cc1C ZINC001200041970 982531097 /nfs/dbraw/zinc/53/10/97/982531097.db2.gz SFGWLXOPFJREPB-UHFFFAOYSA-N 1 2 237.372 2.289 20 0 BEADLO C[C@@H]([NH2+]Cc1ncc[nH]1)c1cc2cnccc2o1 ZINC001197230184 982544823 /nfs/dbraw/zinc/54/48/23/982544823.db2.gz KONORESMODQNHP-SECBINFHSA-N 1 2 242.282 2.402 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc2c(cnn2C)c1 ZINC001241439523 982591578 /nfs/dbraw/zinc/59/15/78/982591578.db2.gz OQVUNDKFURMQQE-DROBUMMNSA-N 1 2 213.284 2.449 20 0 BEADLO C[C@H]1CCC[C@H](C2C[NH+](Cc3cn(C)nn3)C2)C1 ZINC001352878096 982619344 /nfs/dbraw/zinc/61/93/44/982619344.db2.gz PNXKOWDZLZXALV-RYUDHWBXSA-N 1 2 248.374 2.073 20 0 BEADLO C[C@@H]1CCC[C@@H](C2C[NH+](Cc3cn(C)nn3)C2)C1 ZINC001352878097 982622610 /nfs/dbraw/zinc/62/26/10/982622610.db2.gz PNXKOWDZLZXALV-VXGBXAGGSA-N 1 2 248.374 2.073 20 0 BEADLO C[S@@](=O)c1ccc(-c2ccc(N)[nH+]c2)cc1 ZINC001241485044 982639756 /nfs/dbraw/zinc/63/97/56/982639756.db2.gz XFNNDGDTBRKBCT-MRXNPFEDSA-N 1 2 232.308 2.068 20 0 BEADLO Cc1cc(-c2ccc3c(c2)NCCO3)c[nH+]c1N ZINC001241484086 982640190 /nfs/dbraw/zinc/64/01/90/982640190.db2.gz MDLLBYPWIQRTEJ-UHFFFAOYSA-N 1 2 241.294 2.444 20 0 BEADLO C[C@@H]([NH2+]CC1=NOCC1)c1c(F)cccc1F ZINC001197978101 982647579 /nfs/dbraw/zinc/64/75/79/982647579.db2.gz FXGBDTMEHUIUCD-MRVPVSSYSA-N 1 2 240.253 2.392 20 0 BEADLO C=CC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001353215452 982778184 /nfs/dbraw/zinc/77/81/84/982778184.db2.gz XSNQNMGDGSRVKG-UHFFFAOYSA-N 1 2 231.230 2.136 20 0 BEADLO CN(C)c1cc(-c2ccc(CO)cc2)cc[nH+]1 ZINC001241558206 982783351 /nfs/dbraw/zinc/78/33/51/982783351.db2.gz LFSDDEJFDPDCBR-UHFFFAOYSA-N 1 2 228.295 2.307 20 0 BEADLO CO[C@@H](C)C[N@@H+]1CC(F)(F)CC[C@@H]1C ZINC001198640282 982813921 /nfs/dbraw/zinc/81/39/21/982813921.db2.gz AYGRFMISCINFCT-IUCAKERBSA-N 1 2 207.264 2.141 20 0 BEADLO CO[C@@H](C)C[N@H+]1CC(F)(F)CC[C@@H]1C ZINC001198640282 982813930 /nfs/dbraw/zinc/81/39/30/982813930.db2.gz AYGRFMISCINFCT-IUCAKERBSA-N 1 2 207.264 2.141 20 0 BEADLO Cn1cc2cc(-c3nc4[nH]ccc4c[nH+]3)ccc2n1 ZINC001241604993 982844808 /nfs/dbraw/zinc/84/48/08/982844808.db2.gz XNPGQKRYEQOLGB-UHFFFAOYSA-N 1 2 249.277 2.463 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc2nn(C)cc2c1 ZINC001241609019 982846120 /nfs/dbraw/zinc/84/61/20/982846120.db2.gz WBBHKVKVAGZVDJ-DROBUMMNSA-N 1 2 213.284 2.449 20 0 BEADLO Nc1n[nH]c2ccc(-c3ccn4cc[nH+]c4c3)cc12 ZINC001241716661 982979829 /nfs/dbraw/zinc/97/98/29/982979829.db2.gz GMWLTIKNKNCJFK-UHFFFAOYSA-N 1 2 249.277 2.460 20 0 BEADLO CC(=CC=C[NH3+])c1ccc2[nH]nc(N)c2c1 ZINC001241722842 983007978 /nfs/dbraw/zinc/00/79/78/983007978.db2.gz NZFWHUPEGYZGEK-YALUOGEHSA-N 1 2 214.272 2.021 20 0 BEADLO CCCn1nc(C)cc1/C(C)=C/C=C/[NH3+] ZINC001241764384 983039164 /nfs/dbraw/zinc/03/91/64/983039164.db2.gz XBPHVGZEQYLBOD-YLNKAEQOSA-N 1 2 205.305 2.477 20 0 BEADLO OCc1cc(-c2nc3[nH]ccc3c[nH+]2)ccc1F ZINC001241776456 983044808 /nfs/dbraw/zinc/04/48/08/983044808.db2.gz QEEBGJAOCKGYJX-UHFFFAOYSA-N 1 2 243.241 2.208 20 0 BEADLO CN(C)c1cc[nH+]c(-c2ccc3nn[nH]c3c2)c1 ZINC001241938083 983152761 /nfs/dbraw/zinc/15/27/61/983152761.db2.gz KKTZMGQKVFKHPQ-UHFFFAOYSA-N 1 2 239.282 2.086 20 0 BEADLO CN(C)c1cc[nH+]c(-c2ccc3[nH]nnc3c2)c1 ZINC001241938083 983152766 /nfs/dbraw/zinc/15/27/66/983152766.db2.gz KKTZMGQKVFKHPQ-UHFFFAOYSA-N 1 2 239.282 2.086 20 0 BEADLO Nc1ccc(Nc2ccnn2CC2CCC2)c[nH+]1 ZINC001201279963 983155919 /nfs/dbraw/zinc/15/59/19/983155919.db2.gz WPUSOOIFKGNKLN-UHFFFAOYSA-N 1 2 243.314 2.404 20 0 BEADLO Cc1cc2cc(N)ccc2n1-c1ccc(N)[nH+]c1 ZINC001201283685 983158188 /nfs/dbraw/zinc/15/81/88/983158188.db2.gz DIFLACMMMKBCQP-UHFFFAOYSA-N 1 2 238.294 2.498 20 0 BEADLO CC(=O)c1cc(Nc2ccc(N)[nH+]c2)cnc1C ZINC001201279521 983158247 /nfs/dbraw/zinc/15/82/47/983158247.db2.gz QEADETZYAVAXMF-UHFFFAOYSA-N 1 2 242.282 2.313 20 0 BEADLO Nc1ccc(Nc2cccc3c2OCC3)c[nH+]1 ZINC001201285419 983159999 /nfs/dbraw/zinc/15/99/99/983159999.db2.gz HNQJCQRJOFBISS-UHFFFAOYSA-N 1 2 227.267 2.342 20 0 BEADLO Nc1ccc(Nc2c(F)cccc2CO)c[nH+]1 ZINC001201291682 983168776 /nfs/dbraw/zinc/16/87/76/983168776.db2.gz MVEZHMWVSLUNPC-UHFFFAOYSA-N 1 2 233.246 2.039 20 0 BEADLO Nc1ccc(Nc2ccc3nnsc3c2)c[nH+]1 ZINC001201291705 983169005 /nfs/dbraw/zinc/16/90/05/983169005.db2.gz NZIWAPWMEGIANN-UHFFFAOYSA-N 1 2 243.295 2.412 20 0 BEADLO Nc1ccc(Nc2ccc3ncncc3c2)c[nH+]1 ZINC001201291089 983169256 /nfs/dbraw/zinc/16/92/56/983169256.db2.gz ANHJGWABOBAVME-UHFFFAOYSA-N 1 2 237.266 2.351 20 0 BEADLO C[C@H](O)c1ccccc1Nc1ccc(N)[nH+]c1 ZINC001201292020 983169715 /nfs/dbraw/zinc/16/97/15/983169715.db2.gz UIZSOCKJQJXAFE-VIFPVBQESA-N 1 2 229.283 2.461 20 0 BEADLO Cc1noc(Nc2ccc(N)[nH+]c2)c1C ZINC001201272407 983172432 /nfs/dbraw/zinc/17/24/32/983172432.db2.gz NHVJSEKTUSZIHV-UHFFFAOYSA-N 1 2 204.233 2.012 20 0 BEADLO Cc1nc(Nc2ccc(N)[nH+]c2)sc1C ZINC001201272581 983174464 /nfs/dbraw/zinc/17/44/64/983174464.db2.gz QWQJHJPZUBZKQB-UHFFFAOYSA-N 1 2 220.301 2.481 20 0 BEADLO Cc1cc(F)cc(N2CCO[C@H](C(C)C)C2)[nH+]1 ZINC001354153728 983176256 /nfs/dbraw/zinc/17/62/56/983176256.db2.gz WVPNWFQYAGNNTF-LBPRGKRZSA-N 1 2 238.306 2.390 20 0 BEADLO CCOc1cc(Nc2ccc(N)[nH+]c2)ccn1 ZINC001201276341 983177416 /nfs/dbraw/zinc/17/74/16/983177416.db2.gz UGCFYKPVXDCCSK-UHFFFAOYSA-N 1 2 230.271 2.201 20 0 BEADLO Cc1cn(-c2ccc(N)[nH+]c2)c2cccc(N)c12 ZINC001201295879 983182206 /nfs/dbraw/zinc/18/22/06/983182206.db2.gz VSYFAKMFNNJCPH-UHFFFAOYSA-N 1 2 238.294 2.498 20 0 BEADLO Nc1ccc(Nc2cccc3c2C(=O)OC3)c[nH+]1 ZINC001201295792 983182305 /nfs/dbraw/zinc/18/23/05/983182305.db2.gz RPEINYAVPOHHGY-UHFFFAOYSA-N 1 2 241.250 2.078 20 0 BEADLO COCc1cc(-c2[nH]cc[nH+]2)ccc1F ZINC001242018606 983222108 /nfs/dbraw/zinc/22/21/08/983222108.db2.gz LMRRSAZNIWKWDD-UHFFFAOYSA-N 1 2 206.220 2.362 20 0 BEADLO O=C1CC[C@H](c2ccc(-c3[nH]cc[nH+]3)cc2)N1 ZINC001242020477 983228657 /nfs/dbraw/zinc/22/86/57/983228657.db2.gz XZRYDJOLFNTBBT-LLVKDONJSA-N 1 2 227.267 2.028 20 0 BEADLO CC(C)(C)C[N@@H+]1CC(F)(F)CC[C@H]1CO ZINC001201427262 983229157 /nfs/dbraw/zinc/22/91/57/983229157.db2.gz VPFCCTFQQURNCA-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)(C)C[N@H+]1CC(F)(F)CC[C@H]1CO ZINC001201427262 983229161 /nfs/dbraw/zinc/22/91/61/983229161.db2.gz VPFCCTFQQURNCA-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO Cc1cc(-c2ccc(=O)[nH]c2)cc(C)[nH+]1 ZINC001242063466 983281874 /nfs/dbraw/zinc/28/18/74/983281874.db2.gz OSTREUTWQSTXBY-UHFFFAOYSA-N 1 2 200.241 2.466 20 0 BEADLO CC(C)C[N@@H+]1CCN(C(=O)OC(C)(C)C)C1 ZINC001201483198 983290844 /nfs/dbraw/zinc/29/08/44/983290844.db2.gz YIRAFTFGVMGJCB-UHFFFAOYSA-N 1 2 228.336 2.153 20 0 BEADLO CC(C)C[N@H+]1CCN(C(=O)OC(C)(C)C)C1 ZINC001201483198 983290852 /nfs/dbraw/zinc/29/08/52/983290852.db2.gz YIRAFTFGVMGJCB-UHFFFAOYSA-N 1 2 228.336 2.153 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1nccc(NC(C)C)n1 ZINC001242067548 983295548 /nfs/dbraw/zinc/29/55/48/983295548.db2.gz DJGHNQYTNIKTES-UHFFFAOYSA-N 1 2 243.314 2.250 20 0 BEADLO Cc1nc2ccoc2c(-c2c[nH+]c(N)cc2C)n1 ZINC001242068445 983296722 /nfs/dbraw/zinc/29/67/22/983296722.db2.gz OZRMVZRMYCIWEV-UHFFFAOYSA-N 1 2 240.266 2.484 20 0 BEADLO Cc1cc(C)c(-c2c[nH+]c(N)cc2C)nn1 ZINC001242070751 983304586 /nfs/dbraw/zinc/30/45/86/983304586.db2.gz KVIUPWSQCVNINM-UHFFFAOYSA-N 1 2 214.272 2.046 20 0 BEADLO Cc1c[nH]c2nc(-c3c[nH+]c(N)cc3C)ncc12 ZINC001242072563 983310250 /nfs/dbraw/zinc/31/02/50/983310250.db2.gz MFZSKVQMJIUHJN-UHFFFAOYSA-N 1 2 239.282 2.171 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1nccc(OC(C)C)n1 ZINC001242072548 983310472 /nfs/dbraw/zinc/31/04/72/983310472.db2.gz LTBHGGURSKPQDG-UHFFFAOYSA-N 1 2 244.298 2.216 20 0 BEADLO c1cn2cccc(C3=CCOCC3)c2[nH+]1 ZINC001242074511 983315747 /nfs/dbraw/zinc/31/57/47/983315747.db2.gz FQPKJFHLNXPZDT-UHFFFAOYSA-N 1 2 200.241 2.138 20 0 BEADLO c1cn2ccc(C3=CCOCC3)cc2[nH+]1 ZINC001242075266 983316923 /nfs/dbraw/zinc/31/69/23/983316923.db2.gz TWAFZOPPFYSKFI-UHFFFAOYSA-N 1 2 200.241 2.138 20 0 BEADLO CCCOc1ccnc(-c2c[nH+]c(N)cc2C)n1 ZINC001242078132 983324958 /nfs/dbraw/zinc/32/49/58/983324958.db2.gz SAIOTPBTSYCNHF-UHFFFAOYSA-N 1 2 244.298 2.218 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1cncc(OC(C)C)n1 ZINC001242077940 983325040 /nfs/dbraw/zinc/32/50/40/983325040.db2.gz MHVBDKPJEJDNOR-UHFFFAOYSA-N 1 2 244.298 2.216 20 0 BEADLO CSc1cncc(-c2c[nH+]c(N)cc2C)n1 ZINC001242077246 983325821 /nfs/dbraw/zinc/32/58/21/983325821.db2.gz AYGIHXFSPKGERR-UHFFFAOYSA-N 1 2 232.312 2.151 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1nccc(C(F)F)n1 ZINC001242078536 983328403 /nfs/dbraw/zinc/32/84/03/983328403.db2.gz KVDAJDLUAGAXKB-UHFFFAOYSA-N 1 2 236.225 2.367 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nncs2)CC1(C)C ZINC001354611613 983333559 /nfs/dbraw/zinc/33/35/59/983333559.db2.gz UQRPOZAFFYQMCS-SECBINFHSA-N 1 2 225.361 2.406 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nncs2)CC1(C)C ZINC001354611613 983333564 /nfs/dbraw/zinc/33/35/64/983333564.db2.gz UQRPOZAFFYQMCS-SECBINFHSA-N 1 2 225.361 2.406 20 0 BEADLO Cn1c2ccccc2[nH+]c1Nc1cncc(O)c1 ZINC001201629049 983384072 /nfs/dbraw/zinc/38/40/72/983384072.db2.gz OPHZZTXZRZCKSG-UHFFFAOYSA-N 1 2 240.266 2.418 20 0 BEADLO Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1nnc[nH]1 ZINC001354961385 983388871 /nfs/dbraw/zinc/38/88/71/983388871.db2.gz KKLJDHODKXKFOM-VIFPVBQESA-N 1 2 234.278 2.103 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H](C)C1CCC1 ZINC001355035472 983399788 /nfs/dbraw/zinc/39/97/88/983399788.db2.gz MQPFMCAJWWKBLG-NSHDSACASA-N 1 2 232.327 2.495 20 0 BEADLO CCCCC[N@@H+]1CC(F)(F)C[C@@]1(C)CO ZINC001201725625 983433051 /nfs/dbraw/zinc/43/30/51/983433051.db2.gz ROWPNTIVORZFLG-JTQLQIEISA-N 1 2 221.291 2.269 20 0 BEADLO CCCCC[N@H+]1CC(F)(F)C[C@@]1(C)CO ZINC001201725625 983433055 /nfs/dbraw/zinc/43/30/55/983433055.db2.gz ROWPNTIVORZFLG-JTQLQIEISA-N 1 2 221.291 2.269 20 0 BEADLO CCCCC[N@@H+]1C[C@H](CO)CC(F)(F)C1 ZINC001201725998 983432903 /nfs/dbraw/zinc/43/29/03/983432903.db2.gz XABFIDSXENTETL-SNVBAGLBSA-N 1 2 221.291 2.126 20 0 BEADLO CCCCC[N@H+]1C[C@H](CO)CC(F)(F)C1 ZINC001201725998 983432920 /nfs/dbraw/zinc/43/29/20/983432920.db2.gz XABFIDSXENTETL-SNVBAGLBSA-N 1 2 221.291 2.126 20 0 BEADLO Cc1[nH+]cc(NC(=O)Nc2ccccc2)n1C ZINC001201946300 983518170 /nfs/dbraw/zinc/51/81/70/983518170.db2.gz DBNDOUJGDIKGTC-UHFFFAOYSA-N 1 2 230.271 2.373 20 0 BEADLO OCc1ccc(F)cc1-c1cc[nH+]c2c1CCN2 ZINC001242343364 983594990 /nfs/dbraw/zinc/59/49/90/983594990.db2.gz TYZLHHMTTJQXNA-UHFFFAOYSA-N 1 2 244.269 2.348 20 0 BEADLO C[C@@H]1CC[N@H+](CCC(F)(F)F)CCC1=O ZINC001202306793 983616227 /nfs/dbraw/zinc/61/62/27/983616227.db2.gz BXVWHSBMDSDIJQ-MRVPVSSYSA-N 1 2 223.238 2.240 20 0 BEADLO C[C@@H]1CC[N@@H+](CCC(F)(F)F)CCC1=O ZINC001202306793 983616249 /nfs/dbraw/zinc/61/62/49/983616249.db2.gz BXVWHSBMDSDIJQ-MRVPVSSYSA-N 1 2 223.238 2.240 20 0 BEADLO COC(=O)[C@H](C(C)C)[N@H+](C)CCC(F)(F)F ZINC001202352147 983635907 /nfs/dbraw/zinc/63/59/07/983635907.db2.gz AVBAEMPHNFXEQE-QMMMGPOBSA-N 1 2 241.253 2.068 20 0 BEADLO COC(=O)[C@H](C(C)C)[N@@H+](C)CCC(F)(F)F ZINC001202352147 983635911 /nfs/dbraw/zinc/63/59/11/983635911.db2.gz AVBAEMPHNFXEQE-QMMMGPOBSA-N 1 2 241.253 2.068 20 0 BEADLO CCc1ncccc1-c1cc[nH+]c2c1CCN2 ZINC001242525874 983848105 /nfs/dbraw/zinc/84/81/05/983848105.db2.gz ZMZFCQXOQKWOQR-UHFFFAOYSA-N 1 2 225.295 2.317 20 0 BEADLO Cc1cc(-c2ccc(CO)c(F)c2)c[nH+]c1N ZINC001242533083 983854734 /nfs/dbraw/zinc/85/47/34/983854734.db2.gz RSYCGLIQTFERJZ-UHFFFAOYSA-N 1 2 232.258 2.271 20 0 BEADLO C[C@H](O)c1cccc(-c2cc[nH+]c(N)c2)c1 ZINC001242550418 983872580 /nfs/dbraw/zinc/87/25/80/983872580.db2.gz SAKGNQFLBQWZRC-VIFPVBQESA-N 1 2 214.268 2.384 20 0 BEADLO CN(Cc1ccc[nH+]c1N)c1cccc(O)c1 ZINC001474627471 983914224 /nfs/dbraw/zinc/91/42/24/983914224.db2.gz LUPAGOICYHZION-UHFFFAOYSA-N 1 2 229.283 2.006 20 0 BEADLO CC(=O)[C@H]1CCCC[N@H+]1Cc1cnn(C(C)C)c1 ZINC001137080756 983917154 /nfs/dbraw/zinc/91/71/54/983917154.db2.gz SABILOOOKCDNMN-CQSZACIVSA-N 1 2 249.358 2.408 20 0 BEADLO CC(=O)[C@H]1CCCC[N@@H+]1Cc1cnn(C(C)C)c1 ZINC001137080756 983917175 /nfs/dbraw/zinc/91/71/75/983917175.db2.gz SABILOOOKCDNMN-CQSZACIVSA-N 1 2 249.358 2.408 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1cc(C)cs1 ZINC001137161389 984007880 /nfs/dbraw/zinc/00/78/80/984007880.db2.gz APIPQVTZLPJTTM-UHFFFAOYSA-N 1 2 227.329 2.051 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1cc(C)cs1 ZINC001137161389 984007893 /nfs/dbraw/zinc/00/78/93/984007893.db2.gz APIPQVTZLPJTTM-UHFFFAOYSA-N 1 2 227.329 2.051 20 0 BEADLO Cc1cn2c(cccc2Nc2cccc(=O)[nH]2)[nH+]1 ZINC001212786079 984011366 /nfs/dbraw/zinc/01/13/66/984011366.db2.gz CJRZGQRLOHBTEB-UHFFFAOYSA-N 1 2 240.266 2.487 20 0 BEADLO C[C@H](O)c1ccc(-c2ccc(N)[nH+]c2)cc1 ZINC001242647125 984018276 /nfs/dbraw/zinc/01/82/76/984018276.db2.gz WLPSCVWZTYRVRW-VIFPVBQESA-N 1 2 214.268 2.384 20 0 BEADLO Cc1ccc2c(Nc3cnn(C)n3)cccc2[nH+]1 ZINC001212795972 984048168 /nfs/dbraw/zinc/04/81/68/984048168.db2.gz LMVHRYURZPPSES-UHFFFAOYSA-N 1 2 239.282 2.415 20 0 BEADLO Cc1cc(-c2cc(O)ccc2F)c[nH+]c1N ZINC001242764850 984138741 /nfs/dbraw/zinc/13/87/41/984138741.db2.gz SPNWENCUHVXKIG-UHFFFAOYSA-N 1 2 218.231 2.484 20 0 BEADLO CCc1[nH]nc2ncc(-c3ccc[nH+]c3N)cc12 ZINC001242822739 984182836 /nfs/dbraw/zinc/18/28/36/984182836.db2.gz XKQBOCAUNTUPAQ-UHFFFAOYSA-N 1 2 239.282 2.165 20 0 BEADLO CCCn1nccc1-c1ccn2cc(N)[nH+]c2c1 ZINC001242844611 984192975 /nfs/dbraw/zinc/19/29/75/984192975.db2.gz JAFBEMQHADJFLM-UHFFFAOYSA-N 1 2 241.298 2.190 20 0 BEADLO C[N@H+](Cc1cnccc1Cl)[C@H]1CCCOC1 ZINC001137240513 984204724 /nfs/dbraw/zinc/20/47/24/984204724.db2.gz GZRKTGRQOBVVCG-NSHDSACASA-N 1 2 240.734 2.346 20 0 BEADLO C[N@@H+](Cc1cnccc1Cl)[C@H]1CCCOC1 ZINC001137240513 984204736 /nfs/dbraw/zinc/20/47/36/984204736.db2.gz GZRKTGRQOBVVCG-NSHDSACASA-N 1 2 240.734 2.346 20 0 BEADLO c1csc(-c2ccc(Cn3cc[nH+]c3)cn2)n1 ZINC001242895687 984247992 /nfs/dbraw/zinc/24/79/92/984247992.db2.gz LWFWYBRWHKAONU-UHFFFAOYSA-N 1 2 242.307 2.450 20 0 BEADLO Nc1cn2ccc(-c3nccs3)cc2[nH+]1 ZINC001242896046 984250498 /nfs/dbraw/zinc/25/04/98/984250498.db2.gz LIXIZFNEAUEKLV-UHFFFAOYSA-N 1 2 216.269 2.040 20 0 BEADLO c1csc(-c2cccc3[nH+]ccn32)n1 ZINC001242897034 984256624 /nfs/dbraw/zinc/25/66/24/984256624.db2.gz HMHWJEWMVLQCCI-UHFFFAOYSA-N 1 2 201.254 2.458 20 0 BEADLO C[NH+](C)Cc1c(F)cc(-c2ccncn2)cc1F ZINC001242919531 984295624 /nfs/dbraw/zinc/29/56/24/984295624.db2.gz PSEJZJMXDONHJJ-UHFFFAOYSA-N 1 2 249.264 2.483 20 0 BEADLO Fc1ccc(-c2ccncn2)cc1-n1cc[nH+]c1 ZINC001242921055 984297850 /nfs/dbraw/zinc/29/78/50/984297850.db2.gz MJJMIBOYNDBNNB-UHFFFAOYSA-N 1 2 240.241 2.468 20 0 BEADLO c1cc2c(-c3ccn4cc[nH+]c4c3)ncnn2c1 ZINC001240510280 984309977 /nfs/dbraw/zinc/30/99/77/984309977.db2.gz GQSSUNVNJHHHBM-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO CSc1cncc(-c2ccc[nH+]c2N)c1 ZINC001242950847 984313035 /nfs/dbraw/zinc/31/30/35/984313035.db2.gz KGRFIQHBRNOVQX-UHFFFAOYSA-N 1 2 217.297 2.448 20 0 BEADLO Cc1cc(-c2cncc(CO)c2)c2[nH+]ccn2c1 ZINC001242971818 984340331 /nfs/dbraw/zinc/34/03/31/984340331.db2.gz CFUQISVLGLWMST-UHFFFAOYSA-N 1 2 239.278 2.197 20 0 BEADLO Cc1c(-c2cncc(CO)c2)ccc2[nH+]ccn21 ZINC001242973357 984342660 /nfs/dbraw/zinc/34/26/60/984342660.db2.gz TYTYTKARNQLTKO-UHFFFAOYSA-N 1 2 239.278 2.197 20 0 BEADLO COC(=O)c1ccc(-c2c[nH+]cn2C)c(C)c1F ZINC001243066838 984479118 /nfs/dbraw/zinc/47/91/18/984479118.db2.gz BISYVJKUCYFZBG-UHFFFAOYSA-N 1 2 248.257 2.321 20 0 BEADLO CCC(=O)NCc1cccc(-c2c[nH+]cn2C)c1 ZINC001243068557 984487268 /nfs/dbraw/zinc/48/72/68/984487268.db2.gz DMWSKLUNFSNHLA-UHFFFAOYSA-N 1 2 243.310 2.113 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2c(c1)OCCC2 ZINC001243069180 984488526 /nfs/dbraw/zinc/48/85/26/984488526.db2.gz BEVLRJHUVAICSU-UHFFFAOYSA-N 1 2 214.268 2.412 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(-n2ccnc2)cc1 ZINC001243069020 984490584 /nfs/dbraw/zinc/49/05/84/984490584.db2.gz MTMFNCQEQATTMS-UHFFFAOYSA-N 1 2 224.267 2.273 20 0 BEADLO Cn1c[nH+]cc1-c1ccnc2ncccc21 ZINC001243070339 984494653 /nfs/dbraw/zinc/49/46/53/984494653.db2.gz SKZRZJVNRMBAIZ-UHFFFAOYSA-N 1 2 210.240 2.030 20 0 BEADLO Cc1cc(-c2cccc(CO)c2F)c[nH+]c1N ZINC001243141305 984598350 /nfs/dbraw/zinc/59/83/50/984598350.db2.gz PTEPAKSRWLHHCO-UHFFFAOYSA-N 1 2 232.258 2.271 20 0 BEADLO Cc1cc(-c2nc3[nH]ccc3c[nH+]2)ccc1CO ZINC001243187113 984645997 /nfs/dbraw/zinc/64/59/97/984645997.db2.gz CQPSBXVGXMDWGD-UHFFFAOYSA-N 1 2 239.278 2.377 20 0 BEADLO Cc1ccc(-c2ccc(CO)c(C)c2)[nH+]c1N ZINC001243190103 984657551 /nfs/dbraw/zinc/65/75/51/984657551.db2.gz ZHCAKRXBFYPYNI-UHFFFAOYSA-N 1 2 228.295 2.440 20 0 BEADLO Cc1ccc(-c2cc[nH+]c(N)c2)cc1O ZINC001243227027 984729968 /nfs/dbraw/zinc/72/99/68/984729968.db2.gz QSZGJMUKFITPCA-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO Nc1cn2ccc(-c3cc(N)ccc3F)cc2[nH+]1 ZINC001243283955 984811286 /nfs/dbraw/zinc/81/12/86/984811286.db2.gz GBFMXUJXGJXQQO-UHFFFAOYSA-N 1 2 242.257 2.305 20 0 BEADLO CCC[C@@H](CC)[N@@H+]1CC[C@H](O)C(F)(F)C1 ZINC001257262664 984861273 /nfs/dbraw/zinc/86/12/73/984861273.db2.gz DNSGDMYSOPHJNF-ZJUUUORDSA-N 1 2 221.291 2.267 20 0 BEADLO CCC[C@@H](CC)[N@H+]1CC[C@H](O)C(F)(F)C1 ZINC001257262664 984861274 /nfs/dbraw/zinc/86/12/74/984861274.db2.gz DNSGDMYSOPHJNF-ZJUUUORDSA-N 1 2 221.291 2.267 20 0 BEADLO COC(=O)c1ccccc1-c1ccc[nH+]c1N ZINC001243473173 985015479 /nfs/dbraw/zinc/01/54/79/985015479.db2.gz UVEBOUIFZYWMAT-UHFFFAOYSA-N 1 2 228.251 2.117 20 0 BEADLO Nc1ccc2cc(-c3ccc[nH+]c3N)ccc2n1 ZINC001243473992 985021534 /nfs/dbraw/zinc/02/15/34/985021534.db2.gz QUBFBUNYDYHKDJ-UHFFFAOYSA-N 1 2 236.278 2.461 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2cnncc2c1 ZINC001243473607 985022413 /nfs/dbraw/zinc/02/24/13/985022413.db2.gz CWEJZNHKRNVAMM-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO COc1nc2[nH]ccc2cc1-c1ccc[nH+]c1N ZINC001243473723 985023514 /nfs/dbraw/zinc/02/35/14/985023514.db2.gz OPLROYPASUKYLI-UHFFFAOYSA-N 1 2 240.266 2.167 20 0 BEADLO Cn1cnc2cc(-c3ccc[nH+]c3N)ccc21 ZINC001243473987 985024437 /nfs/dbraw/zinc/02/44/37/985024437.db2.gz GUROTOAGCOSQFR-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO CCOc1ncc(-c2ccc[nH+]c2N)cc1OC ZINC001243477428 985035034 /nfs/dbraw/zinc/03/50/34/985035034.db2.gz NVTNBWFABJJRPV-UHFFFAOYSA-N 1 2 245.282 2.133 20 0 BEADLO Cc1nccc(-c2ccc[nH+]c2N)c1F ZINC001243477488 985038337 /nfs/dbraw/zinc/03/83/37/985038337.db2.gz QDCCRWQPMNRZOU-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO FC1(F)COCC[N@@H+](C2CCCCC2)C1 ZINC001257454754 985051690 /nfs/dbraw/zinc/05/16/90/985051690.db2.gz KPACKARUPJKFCJ-UHFFFAOYSA-N 1 2 219.275 2.287 20 0 BEADLO FC1(F)COCC[N@H+](C2CCCCC2)C1 ZINC001257454754 985051707 /nfs/dbraw/zinc/05/17/07/985051707.db2.gz KPACKARUPJKFCJ-UHFFFAOYSA-N 1 2 219.275 2.287 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H]2CCC[C@@H](C)C2)c[nH+]1 ZINC001456143512 985116036 /nfs/dbraw/zinc/11/60/36/985116036.db2.gz RXYRLEYPICOYRS-GHMZBOCLSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H]2CCC[C@@H](C)C2)[nH+]1 ZINC001456143512 985116043 /nfs/dbraw/zinc/11/60/43/985116043.db2.gz RXYRLEYPICOYRS-GHMZBOCLSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]c(CNC(=O)c2ccccc2C)c[nH+]1 ZINC001456143848 985118041 /nfs/dbraw/zinc/11/80/41/985118041.db2.gz UDOLCZARASEXOF-UHFFFAOYSA-N 1 2 243.310 2.211 20 0 BEADLO CCc1[nH]cc(CNC(=O)c2ccccc2C)[nH+]1 ZINC001456143848 985118051 /nfs/dbraw/zinc/11/80/51/985118051.db2.gz UDOLCZARASEXOF-UHFFFAOYSA-N 1 2 243.310 2.211 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)C[C@@H]1CC=CCC1 ZINC001546081988 985139786 /nfs/dbraw/zinc/13/97/86/985139786.db2.gz BKLHOJXPJPAXKS-GFCCVEGCSA-N 1 2 247.342 2.075 20 0 BEADLO COc1cc2[nH+]ccn2cc1-c1cccc(=O)[nH]1 ZINC001243735370 985265618 /nfs/dbraw/zinc/26/56/18/985265618.db2.gz FFUFVFHPFCCQSO-UHFFFAOYSA-N 1 2 241.250 2.111 20 0 BEADLO Cc1cnc(F)cc1-c1ccn2cc(N)[nH+]c2c1 ZINC001243782205 985324617 /nfs/dbraw/zinc/32/46/17/985324617.db2.gz BVDPUERTZIZENS-UHFFFAOYSA-N 1 2 242.257 2.426 20 0 BEADLO CO[C@@H]1CC=C(c2ccn3cc(N)[nH+]c3c2)CC1 ZINC001243809835 985397952 /nfs/dbraw/zinc/39/79/52/985397952.db2.gz UDXGYBPINBUWNF-GFCCVEGCSA-N 1 2 243.310 2.499 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(CO)c(Cl)c1 ZINC001243819663 985423283 /nfs/dbraw/zinc/42/32/83/985423283.db2.gz PWEXMPAWRWCIFC-UHFFFAOYSA-N 1 2 222.675 2.233 20 0 BEADLO CCc1cn(Cc2cn3ccccc3n2)c[nH+]1 ZINC001459263065 985424112 /nfs/dbraw/zinc/42/41/12/985424112.db2.gz RPISTNYTFANOTK-UHFFFAOYSA-N 1 2 226.283 2.142 20 0 BEADLO c1cn(C[C@@H]2CCCC23CCOCC3)c[nH+]1 ZINC001459689298 985582048 /nfs/dbraw/zinc/58/20/48/985582048.db2.gz XHLNAAQBKSVIRX-LBPRGKRZSA-N 1 2 220.316 2.480 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1COC2(CCC2)C1 ZINC000688267358 985594788 /nfs/dbraw/zinc/59/47/88/985594788.db2.gz LRPAMPSLIWVVKK-SNVBAGLBSA-N 1 2 234.299 2.214 20 0 BEADLO c1c2c(nnc1C1=C[NH2+]CCC1)CCCC2 ZINC001243949110 985635506 /nfs/dbraw/zinc/63/55/06/985635506.db2.gz ISOJDMFJFTWRRW-UHFFFAOYSA-N 1 2 215.300 2.080 20 0 BEADLO c1ncc(N2CCCCC2)nc1C1=C[NH2+]CCC1 ZINC001243950112 985642021 /nfs/dbraw/zinc/64/20/21/985642021.db2.gz VGIADILBJLZQBK-UHFFFAOYSA-N 1 2 244.342 2.191 20 0 BEADLO FC(F)(F)c1ncncc1C1=C[NH2+]CCC1 ZINC001243950489 985652309 /nfs/dbraw/zinc/65/23/09/985652309.db2.gz VROGHBUXGHIEJP-UHFFFAOYSA-N 1 2 229.205 2.220 20 0 BEADLO COCC[N@H+](C)Cc1ccc(C)nc1Cl ZINC000688541920 985667702 /nfs/dbraw/zinc/66/77/02/985667702.db2.gz LHNCLIZHCUKTNZ-UHFFFAOYSA-N 1 2 228.723 2.122 20 0 BEADLO COCC[N@@H+](C)Cc1ccc(C)nc1Cl ZINC000688541920 985667708 /nfs/dbraw/zinc/66/77/08/985667708.db2.gz LHNCLIZHCUKTNZ-UHFFFAOYSA-N 1 2 228.723 2.122 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cc(C)c2c(c1)NC(=O)CO2 ZINC001244062784 985788899 /nfs/dbraw/zinc/78/88/99/985788899.db2.gz LUULYNAGBUDTFZ-BMVOEDMYSA-N 1 2 244.294 2.202 20 0 BEADLO Cc1ccccc1C(F)(F)C[NH2+][C@@H](C)[C@H](C)O ZINC001327641979 985834481 /nfs/dbraw/zinc/83/44/81/985834481.db2.gz VVLUNNFPRQIXCB-QWRGUYRKSA-N 1 2 243.297 2.446 20 0 BEADLO Cc1cc([C@@H]2CCCC[N@@H+]2Cc2ccno2)[nH]n1 ZINC001460841383 985913000 /nfs/dbraw/zinc/91/30/00/985913000.db2.gz IMDOHEMHICPIDH-ZDUSSCGKSA-N 1 2 246.314 2.433 20 0 BEADLO Cc1cc([C@@H]2CCCC[N@H+]2Cc2ccno2)[nH]n1 ZINC001460841383 985913012 /nfs/dbraw/zinc/91/30/12/985913012.db2.gz IMDOHEMHICPIDH-ZDUSSCGKSA-N 1 2 246.314 2.433 20 0 BEADLO CCOC(=O)CC[C@H](C)[N@@H+]1Cc2cccnc2C1 ZINC001258489902 985953014 /nfs/dbraw/zinc/95/30/14/985953014.db2.gz UAWHHHWDRBHTIU-NSHDSACASA-N 1 2 248.326 2.129 20 0 BEADLO CCOC(=O)CC[C@H](C)[N@H+]1Cc2cccnc2C1 ZINC001258489902 985953030 /nfs/dbraw/zinc/95/30/30/985953030.db2.gz UAWHHHWDRBHTIU-NSHDSACASA-N 1 2 248.326 2.129 20 0 BEADLO COc1cncc(CNc2cccc[nH+]2)c1C ZINC001461074528 986005276 /nfs/dbraw/zinc/00/52/76/986005276.db2.gz VOIFRCCLMXFNFU-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO CCc1cn(CC(=O)N[C@H]2CCCC[C@H]2C)c[nH+]1 ZINC001459257966 986072122 /nfs/dbraw/zinc/07/21/22/986072122.db2.gz DOBUIDXIASHGIJ-YPMHNXCESA-N 1 2 249.358 2.140 20 0 BEADLO Cc1c[nH]nc1CNc1cc2cc[nH]c2c[nH+]1 ZINC001461609788 986093340 /nfs/dbraw/zinc/09/33/40/986093340.db2.gz UTFCOMVMXNTOFQ-UHFFFAOYSA-N 1 2 227.271 2.207 20 0 BEADLO CCCn1c[nH+]cc1CNc1ccc(OC)cn1 ZINC001461619617 986099026 /nfs/dbraw/zinc/09/90/26/986099026.db2.gz TYVYAZKMOHSBNS-UHFFFAOYSA-N 1 2 246.314 2.309 20 0 BEADLO CC(C)c1occc1C(=O)OCCn1cc[nH+]c1 ZINC000796392732 986100200 /nfs/dbraw/zinc/10/02/00/986100200.db2.gz DRKNBLYLKZIVJF-UHFFFAOYSA-N 1 2 248.282 2.457 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc(C)cc1CO ZINC001244489157 986184591 /nfs/dbraw/zinc/18/45/91/986184591.db2.gz HMGNQBIQPKSJNH-RZVFHRDZSA-N 1 2 203.285 2.363 20 0 BEADLO CNc1cc(-c2cccc(F)c2CO)cc[nH+]1 ZINC001244564577 986253464 /nfs/dbraw/zinc/25/34/64/986253464.db2.gz QZUONURLKZAGIN-UHFFFAOYSA-N 1 2 232.258 2.422 20 0 BEADLO CCNC(=O)c1ccc(/C(C)=C/C=C/[NH3+])c(F)c1 ZINC001244673767 986300840 /nfs/dbraw/zinc/30/08/40/986300840.db2.gz WZBXUVUWDNRQMI-DXNUHORPSA-N 1 2 248.301 2.451 20 0 BEADLO Cc1cc(CO)cc(C)c1-c1ccc[nH+]c1N ZINC001244690654 986310186 /nfs/dbraw/zinc/31/01/86/986310186.db2.gz HYQCTMZMPOTDEO-UHFFFAOYSA-N 1 2 228.295 2.440 20 0 BEADLO CN(C)c1cc(-c2ccc(O)c(CO)c2)cc[nH+]1 ZINC001244776293 986337078 /nfs/dbraw/zinc/33/70/78/986337078.db2.gz GLGDGRAEWZHXCF-UHFFFAOYSA-N 1 2 244.294 2.013 20 0 BEADLO Fc1cccnc1C[N@@H+]1CC[C@@H]2[C@H](C1)C2(F)F ZINC001462333104 986355414 /nfs/dbraw/zinc/35/54/14/986355414.db2.gz NTCUAOAOUZNTPP-BDAKNGLRSA-N 1 2 242.244 2.308 20 0 BEADLO Fc1cccnc1C[N@H+]1CC[C@@H]2[C@H](C1)C2(F)F ZINC001462333104 986355422 /nfs/dbraw/zinc/35/54/22/986355422.db2.gz NTCUAOAOUZNTPP-BDAKNGLRSA-N 1 2 242.244 2.308 20 0 BEADLO Cc1n[nH]c(C)c1C[N@@H+]1CC[C@@](C)(F)[C@H](F)C1 ZINC001139094701 986368221 /nfs/dbraw/zinc/36/82/21/986368221.db2.gz SLLOHSNECYXPMT-VXGBXAGGSA-N 1 2 243.301 2.299 20 0 BEADLO Cc1n[nH]c(C)c1C[N@H+]1CC[C@@](C)(F)[C@H](F)C1 ZINC001139094701 986368233 /nfs/dbraw/zinc/36/82/33/986368233.db2.gz SLLOHSNECYXPMT-VXGBXAGGSA-N 1 2 243.301 2.299 20 0 BEADLO Cc1n[nH]c(C)c1C[N@@H+]1CC[C@](C)(F)[C@H](F)C1 ZINC001139094698 986369156 /nfs/dbraw/zinc/36/91/56/986369156.db2.gz SLLOHSNECYXPMT-NEPJUHHUSA-N 1 2 243.301 2.299 20 0 BEADLO Cc1n[nH]c(C)c1C[N@H+]1CC[C@](C)(F)[C@H](F)C1 ZINC001139094698 986369167 /nfs/dbraw/zinc/36/91/67/986369167.db2.gz SLLOHSNECYXPMT-NEPJUHHUSA-N 1 2 243.301 2.299 20 0 BEADLO Cc1ccc(CNc2cc3cc[nH]c3c[nH+]2)nn1 ZINC001462389551 986372824 /nfs/dbraw/zinc/37/28/24/986372824.db2.gz VFTWLDNJRGLBFK-UHFFFAOYSA-N 1 2 239.282 2.273 20 0 BEADLO CCCNC(=S)Nc1ccc2[nH+]ccn2c1 ZINC001244835091 986379127 /nfs/dbraw/zinc/37/91/27/986379127.db2.gz GTZSUKWQXOBSTP-UHFFFAOYSA-N 1 2 234.328 2.031 20 0 BEADLO C[C@@H]([NH2+]C1CC(C(=O)OC(C)(C)C)C1)C(F)F ZINC001462538417 986420669 /nfs/dbraw/zinc/42/06/69/986420669.db2.gz YRYMHVPLKHQFNU-AFPNSQJFSA-N 1 2 249.301 2.350 20 0 BEADLO Cc1coc(C(=O)Nc2cc(N(C)C)cc[nH+]2)c1 ZINC001546133221 986468778 /nfs/dbraw/zinc/46/87/78/986468778.db2.gz JAZOCNDGLXCDLQ-UHFFFAOYSA-N 1 2 245.282 2.301 20 0 BEADLO c1cnc2cc(C[N@@H+]3CCC34COC4)ccc2c1 ZINC001139169243 986524085 /nfs/dbraw/zinc/52/40/85/986524085.db2.gz LAOSGNXVBKBRAS-UHFFFAOYSA-N 1 2 240.306 2.210 20 0 BEADLO c1cnc2cc(C[N@H+]3CCC34COC4)ccc2c1 ZINC001139169243 986524096 /nfs/dbraw/zinc/52/40/96/986524096.db2.gz LAOSGNXVBKBRAS-UHFFFAOYSA-N 1 2 240.306 2.210 20 0 BEADLO C[C@@H]([NH2+]C[C@]1(C)CC1(F)F)C(=O)OC(C)(C)C ZINC000689354736 986535886 /nfs/dbraw/zinc/53/58/86/986535886.db2.gz HLWKLHGUIVTFTH-KCJUWKMLSA-N 1 2 249.301 2.352 20 0 BEADLO CNc1cc(-c2cnc3[nH]cnc3c2C)cc[nH+]1 ZINC001244972301 986549400 /nfs/dbraw/zinc/54/94/00/986549400.db2.gz LUEKAWFEGYFDRC-UHFFFAOYSA-N 1 2 239.282 2.370 20 0 BEADLO FC1CC[NH+](Cc2ccc(Cl)nn2)CC1 ZINC000689395257 986553337 /nfs/dbraw/zinc/55/33/37/986553337.db2.gz OVYKXBPLDRTNAK-UHFFFAOYSA-N 1 2 229.686 2.064 20 0 BEADLO CCOc1ccc(NC(=O)[C@H]2CC[N@@H+]2CC)cc1 ZINC001463663331 986570108 /nfs/dbraw/zinc/57/01/08/986570108.db2.gz FOSFLEGLOCHNDL-CYBMUJFWSA-N 1 2 248.326 2.118 20 0 BEADLO CCOc1ccc(NC(=O)[C@H]2CC[N@H+]2CC)cc1 ZINC001463663331 986570122 /nfs/dbraw/zinc/57/01/22/986570122.db2.gz FOSFLEGLOCHNDL-CYBMUJFWSA-N 1 2 248.326 2.118 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1ccc(F)cc1C ZINC001463685656 986573926 /nfs/dbraw/zinc/57/39/26/986573926.db2.gz VPNLUDFSHFLOOL-LBPRGKRZSA-N 1 2 236.290 2.167 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1ccc(F)cc1C ZINC001463685656 986573942 /nfs/dbraw/zinc/57/39/42/986573942.db2.gz VPNLUDFSHFLOOL-LBPRGKRZSA-N 1 2 236.290 2.167 20 0 BEADLO Nc1cc(-c2cc(Cl)cc(CO)c2)cc[nH+]1 ZINC001245089489 986658666 /nfs/dbraw/zinc/65/86/66/986658666.db2.gz AQOMEMCDTUJXJB-UHFFFAOYSA-N 1 2 234.686 2.477 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc(-c2ccn(C)n2)nc1 ZINC001245203800 986723796 /nfs/dbraw/zinc/72/37/96/986723796.db2.gz DAPHUSFJTIKGQF-BZKLWIKRSA-N 1 2 240.310 2.358 20 0 BEADLO COCn1cc(-c2ccc3[nH+]ccn3c2C)cn1 ZINC001245220916 986744022 /nfs/dbraw/zinc/74/40/22/986744022.db2.gz BNNPMVAEINSLTG-UHFFFAOYSA-N 1 2 242.282 2.110 20 0 BEADLO CO[C@H]1C[N@H+](Cc2cc3ccccc3[nH]2)C[C@@H]1F ZINC001137313884 986753355 /nfs/dbraw/zinc/75/33/55/986753355.db2.gz YHTCNVPLQLNZSQ-JSGCOSHPSA-N 1 2 248.301 2.337 20 0 BEADLO CO[C@H]1C[N@@H+](Cc2cc3ccccc3[nH]2)C[C@@H]1F ZINC001137313884 986753364 /nfs/dbraw/zinc/75/33/64/986753364.db2.gz YHTCNVPLQLNZSQ-JSGCOSHPSA-N 1 2 248.301 2.337 20 0 BEADLO CC/C=C(/F)C(=O)NCc1ccn2cc[nH+]c2c1 ZINC001465975882 986763086 /nfs/dbraw/zinc/76/30/86/986763086.db2.gz BZXPTMPDSQAJQS-QDEBKDIKSA-N 1 2 247.273 2.214 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc3ccccc3[nH]2)CCN1C ZINC001137319641 986763577 /nfs/dbraw/zinc/76/35/77/986763577.db2.gz GPXYAYZFLXPMMC-GFCCVEGCSA-N 1 2 243.354 2.304 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc3ccccc3[nH]2)CCN1C ZINC001137319641 986763590 /nfs/dbraw/zinc/76/35/90/986763590.db2.gz GPXYAYZFLXPMMC-GFCCVEGCSA-N 1 2 243.354 2.304 20 0 BEADLO Cc1cc(C)c(C[N@H+]2CCC(=O)[C@H](F)CC2)[nH]1 ZINC001137322330 986770184 /nfs/dbraw/zinc/77/01/84/986770184.db2.gz AHYSIYMCKPNPTJ-LLVKDONJSA-N 1 2 238.306 2.135 20 0 BEADLO Cc1cc(C)c(C[N@@H+]2CCC(=O)[C@H](F)CC2)[nH]1 ZINC001137322330 986770195 /nfs/dbraw/zinc/77/01/95/986770195.db2.gz AHYSIYMCKPNPTJ-LLVKDONJSA-N 1 2 238.306 2.135 20 0 BEADLO Cc1cc(C)c(C[N@@H+]2CCC(=O)[C@H](C)C2)[nH]1 ZINC001137323130 986771254 /nfs/dbraw/zinc/77/12/54/986771254.db2.gz YMOHXKXFIZVYKV-SNVBAGLBSA-N 1 2 220.316 2.042 20 0 BEADLO Cc1cc(C)c(C[N@H+]2CCC(=O)[C@H](C)C2)[nH]1 ZINC001137323130 986771264 /nfs/dbraw/zinc/77/12/64/986771264.db2.gz YMOHXKXFIZVYKV-SNVBAGLBSA-N 1 2 220.316 2.042 20 0 BEADLO CC[C@H]1CCN(C(=O)c2cccc3[nH+]ccn32)C1 ZINC001137324690 986776863 /nfs/dbraw/zinc/77/68/63/986776863.db2.gz IFFOHQGOJCBBBP-NSHDSACASA-N 1 2 243.310 2.206 20 0 BEADLO Cc1cc(C)c(C[N@@H+](C)Cc2cncnc2)[nH]1 ZINC001137332465 986799188 /nfs/dbraw/zinc/79/91/88/986799188.db2.gz VKEUQQQWJKFFCF-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1cc(C)c(C[N@H+](C)Cc2cncnc2)[nH]1 ZINC001137332465 986799201 /nfs/dbraw/zinc/79/92/01/986799201.db2.gz VKEUQQQWJKFFCF-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1n[nH]c2ccccc21 ZINC001137345009 986809024 /nfs/dbraw/zinc/80/90/24/986809024.db2.gz NNISRZFRTMFMLP-ZJUUUORDSA-N 1 2 233.290 2.495 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1n[nH]c2ccccc21 ZINC001137345009 986809025 /nfs/dbraw/zinc/80/90/25/986809025.db2.gz NNISRZFRTMFMLP-ZJUUUORDSA-N 1 2 233.290 2.495 20 0 BEADLO c1ccc2c(C[NH+]3CC4(CSC4)C3)n[nH]c2c1 ZINC001137351540 986820617 /nfs/dbraw/zinc/82/06/17/986820617.db2.gz CYPZNBOIGFRVFI-UHFFFAOYSA-N 1 2 245.351 2.112 20 0 BEADLO CCN(Cc1ccc(C(C)(C)C)[nH]1)C1C[NH+](C)C1 ZINC001137379624 986841574 /nfs/dbraw/zinc/84/15/74/986841574.db2.gz YUWJBCLHCWRGNR-UHFFFAOYSA-N 1 2 249.402 2.448 20 0 BEADLO CSc1cc(-c2c[nH+]c(N)c(C)c2)nc(C)n1 ZINC001245535887 986915334 /nfs/dbraw/zinc/91/53/34/986915334.db2.gz HGYXGTGUHDVOKU-UHFFFAOYSA-N 1 2 246.339 2.460 20 0 BEADLO COCc1ccnc(-c2c[nH+]c(N)c(C)c2)c1 ZINC001245536328 986915715 /nfs/dbraw/zinc/91/57/15/986915715.db2.gz OYGTYOGINOTMPJ-UHFFFAOYSA-N 1 2 229.283 2.181 20 0 BEADLO COc1nccc(-c2c[nH+]c(N)c(C)c2)c1C ZINC001245537281 986917293 /nfs/dbraw/zinc/91/72/93/986917293.db2.gz ANILNDKHZZDXAZ-UHFFFAOYSA-N 1 2 229.283 2.351 20 0 BEADLO COc1nc(C)nc(-c2c[nH+]c(N)c(C)c2)c1C ZINC001245537247 986919138 /nfs/dbraw/zinc/91/91/38/986919138.db2.gz HCCJMRVYEBRZKX-UHFFFAOYSA-N 1 2 244.298 2.055 20 0 BEADLO Cc1cc(-c2c(C)ncnc2C)c[nH+]c1N ZINC001245537954 986919541 /nfs/dbraw/zinc/91/95/41/986919541.db2.gz IACQTTHCTIUYCC-UHFFFAOYSA-N 1 2 214.272 2.046 20 0 BEADLO Cc1cc(-c2ccnc(C)c2F)c[nH+]c1N ZINC001245539005 986925814 /nfs/dbraw/zinc/92/58/14/986925814.db2.gz CLEZCVAISNHTGA-UHFFFAOYSA-N 1 2 217.247 2.482 20 0 BEADLO Cc1cc(-c2cnc(N)c(Cl)c2)c[nH+]c1N ZINC001245564840 986961967 /nfs/dbraw/zinc/96/19/67/986961967.db2.gz JRBCNZGDELDINR-UHFFFAOYSA-N 1 2 234.690 2.270 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H]2C[C@]2(C)C(C)C)c[nH+]1 ZINC001472020399 987163680 /nfs/dbraw/zinc/16/36/80/987163680.db2.gz IFVVADNEPQUHEP-SMDDNHRTSA-N 1 2 249.358 2.271 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H]2C[C@]2(C)C(C)C)[nH+]1 ZINC001472020399 987163702 /nfs/dbraw/zinc/16/37/02/987163702.db2.gz IFVVADNEPQUHEP-SMDDNHRTSA-N 1 2 249.358 2.271 20 0 BEADLO C[C@@H]1C[C@@H]1c1nnc([C@H]2CC3CC[NH+]2CC3)o1 ZINC001256611684 987238529 /nfs/dbraw/zinc/23/85/29/987238529.db2.gz YDUNHLCBVYBDHM-DVVUODLYSA-N 1 2 233.315 2.350 20 0 BEADLO C[C@@H]1C[C@H]1c1nnc([C@H]2CC3CC[NH+]2CC3)o1 ZINC001256611685 987245685 /nfs/dbraw/zinc/24/56/85/987245685.db2.gz YDUNHLCBVYBDHM-FBIMIBRVSA-N 1 2 233.315 2.350 20 0 BEADLO C[C@@H]1C[C@@H]1c1nnc([C@H]2CCCc3[nH]c[nH+]c32)o1 ZINC001256661080 987261541 /nfs/dbraw/zinc/26/15/41/987261541.db2.gz YWNZMIWOQHGKPN-VGMNWLOBSA-N 1 2 244.298 2.384 20 0 BEADLO CCc1cn(Cc2conc2CC)c[nH+]1 ZINC001473086967 987330141 /nfs/dbraw/zinc/33/01/41/987330141.db2.gz FVTSVZACJYUFQT-UHFFFAOYSA-N 1 2 205.261 2.044 20 0 BEADLO CC(F)(F)C[NH2+]C[C@H](O)c1ccc(F)cc1 ZINC000697571243 987356081 /nfs/dbraw/zinc/35/60/81/987356081.db2.gz USERNWAXQHFBAP-JTQLQIEISA-N 1 2 233.233 2.104 20 0 BEADLO CC(F)(F)C[NH2+]C[C@@H](O)c1ccc(F)cc1 ZINC000697571244 987356139 /nfs/dbraw/zinc/35/61/39/987356139.db2.gz USERNWAXQHFBAP-SNVBAGLBSA-N 1 2 233.233 2.104 20 0 BEADLO C[C@@H](Cc1ccco1)Nc1cc[nH+]cc1F ZINC000699601620 987375721 /nfs/dbraw/zinc/37/57/21/987375721.db2.gz PJFUPQOEEZQAJE-VIFPVBQESA-N 1 2 220.247 2.279 20 0 BEADLO Cc1cnc([C@H](C)[NH2+]Cc2cccnc2N)s1 ZINC001473360696 987405052 /nfs/dbraw/zinc/40/50/52/987405052.db2.gz CHQSBFUYYLIQCE-VIFPVBQESA-N 1 2 248.355 2.280 20 0 BEADLO CC(C)N(CC1CC1)C(=O)[C@H](C)n1cc[nH+]c1 ZINC001115897699 987407676 /nfs/dbraw/zinc/40/76/76/987407676.db2.gz LUCWHFBTRFDOFF-NSHDSACASA-N 1 2 235.331 2.091 20 0 BEADLO C[C@@H](C(=O)N[C@@H]1CCCC1(C)C)n1cc[nH+]c1 ZINC001116210035 987481509 /nfs/dbraw/zinc/48/15/09/987481509.db2.gz GWOZOVGPDSEPKR-WDEREUQCSA-N 1 2 235.331 2.139 20 0 BEADLO c1cc(C[N@@H+](CC2=NOCC2)C2CC2)co1 ZINC001473830792 987572550 /nfs/dbraw/zinc/57/25/50/987572550.db2.gz MQPWQAMWXBHTJF-UHFFFAOYSA-N 1 2 220.272 2.020 20 0 BEADLO c1cc(C[N@H+](CC2=NOCC2)C2CC2)co1 ZINC001473830792 987572561 /nfs/dbraw/zinc/57/25/61/987572561.db2.gz MQPWQAMWXBHTJF-UHFFFAOYSA-N 1 2 220.272 2.020 20 0 BEADLO CCCCC[C@@H](C)N[C@H]1C[NH2+]CC[C@H]1F ZINC001246218195 987616116 /nfs/dbraw/zinc/61/61/16/987616116.db2.gz PDHZXBZQTMYTFB-UTUOFQBUSA-N 1 2 216.344 2.245 20 0 BEADLO CCCCC[C@@H](C)[NH2+][C@H]1CNCC[C@H]1F ZINC001246218195 987616121 /nfs/dbraw/zinc/61/61/21/987616121.db2.gz PDHZXBZQTMYTFB-UTUOFQBUSA-N 1 2 216.344 2.245 20 0 BEADLO C[C@@H]1C[C@H](N[C@H]2C[NH2+]CC[C@H]2F)CC(C)(C)C1 ZINC001246219224 987616148 /nfs/dbraw/zinc/61/61/48/987616148.db2.gz YMLFYWLJQZYLPW-XQHKEYJVSA-N 1 2 242.382 2.491 20 0 BEADLO C[C@@H]1C[C@H]([NH2+][C@H]2CNCC[C@H]2F)CC(C)(C)C1 ZINC001246219224 987616152 /nfs/dbraw/zinc/61/61/52/987616152.db2.gz YMLFYWLJQZYLPW-XQHKEYJVSA-N 1 2 242.382 2.491 20 0 BEADLO Cc1[nH]ncc1C[NH2+]CCOc1ccc(F)cc1 ZINC001473930005 987619477 /nfs/dbraw/zinc/61/94/77/987619477.db2.gz WZYOIXASAUKHBL-UHFFFAOYSA-N 1 2 249.289 2.026 20 0 BEADLO CCC[C@H]([NH2+]Cc1nccn1C)c1ccccn1 ZINC001473982538 987624094 /nfs/dbraw/zinc/62/40/94/987624094.db2.gz RYQTXCIUVVEBGG-LBPRGKRZSA-N 1 2 244.342 2.446 20 0 BEADLO CCc1cc(C[NH2+]Cc2cnn(C(C)C)c2)on1 ZINC001474021302 987630210 /nfs/dbraw/zinc/63/02/10/987630210.db2.gz ZNDUSHUYMVAXRV-UHFFFAOYSA-N 1 2 248.330 2.304 20 0 BEADLO CC(C)Nc1ccc(N2CCC(CO)CC2)c[nH+]1 ZINC001474053297 987637933 /nfs/dbraw/zinc/63/79/33/987637933.db2.gz RAOCFBXHDCPBHS-UHFFFAOYSA-N 1 2 249.358 2.111 20 0 BEADLO CC(C)c1nnc([C@H](C)[NH2+]Cc2cccnc2)[nH]1 ZINC001474099997 987642086 /nfs/dbraw/zinc/64/20/86/987642086.db2.gz NUQJULQJVXZBMQ-JTQLQIEISA-N 1 2 245.330 2.174 20 0 BEADLO COc1nscc1NCc1[nH]c(C)c(C)[nH+]1 ZINC001474254646 987668361 /nfs/dbraw/zinc/66/83/61/987668361.db2.gz YTWLHFNANFJAQC-UHFFFAOYSA-N 1 2 238.316 2.104 20 0 BEADLO CC(C)[C@@H]1CCCN(C(=O)[C@@H](C)n2cc[nH+]c2)C1 ZINC001116695870 987673299 /nfs/dbraw/zinc/67/32/99/987673299.db2.gz YLYRMSWFWJRHMK-CHWSQXEVSA-N 1 2 249.358 2.339 20 0 BEADLO C[N@H+](Cc1nc(CO)cs1)Cc1ccccc1 ZINC001474308070 987687098 /nfs/dbraw/zinc/68/70/98/987687098.db2.gz AQYJRLMEYVYQRV-UHFFFAOYSA-N 1 2 248.351 2.267 20 0 BEADLO C[N@@H+](Cc1nc(CO)cs1)Cc1ccccc1 ZINC001474308070 987687103 /nfs/dbraw/zinc/68/71/03/987687103.db2.gz AQYJRLMEYVYQRV-UHFFFAOYSA-N 1 2 248.351 2.267 20 0 BEADLO CCc1nnc(-c2ccc(-n3cc[nH+]c3)cc2)o1 ZINC001117171321 987796280 /nfs/dbraw/zinc/79/62/80/987796280.db2.gz ZRRKXDAXGXFNNG-UHFFFAOYSA-N 1 2 240.266 2.485 20 0 BEADLO C[C@H]1C[C@H](N[C@H]2C[NH2+]CC2(F)F)C[C@@H](C)C1 ZINC001246456447 987813293 /nfs/dbraw/zinc/81/32/93/987813293.db2.gz AOESSGJAFBPISP-ZDCRXTMVSA-N 1 2 232.318 2.008 20 0 BEADLO CC[C@H](C[C@@H](C)CC)N[C@@H]1C[NH2+]CC1(F)F ZINC001246460319 987819679 /nfs/dbraw/zinc/81/96/79/987819679.db2.gz LPPBOCPTJBNVJT-HBNTYKKESA-N 1 2 234.334 2.398 20 0 BEADLO CC[C@@H]1C[C@H]1CNC(=O)c1cccc2[nH+]ccn21 ZINC001117776760 987907766 /nfs/dbraw/zinc/90/77/66/987907766.db2.gz PESRUEWQVZWETD-MNOVXSKESA-N 1 2 243.310 2.110 20 0 BEADLO Cc1ccc(N[C@H](C)c2ccc(=O)[nH]n2)c(C)[nH+]1 ZINC001322072553 988100052 /nfs/dbraw/zinc/10/00/52/988100052.db2.gz FYBKKVIIYXNVSX-SNVBAGLBSA-N 1 2 244.298 2.367 20 0 BEADLO Cc1ccc(NC(=O)[C@H](C)n2cc[nH+]c2)c(C)n1 ZINC001322472303 988282883 /nfs/dbraw/zinc/28/28/83/988282883.db2.gz WJRYQMOEEMPSIA-NSHDSACASA-N 1 2 244.298 2.095 20 0 BEADLO C[C@@H]1CC[C@H](c2nnc(C[NH+](C)C)o2)C1 ZINC001118419372 988333075 /nfs/dbraw/zinc/33/30/75/988333075.db2.gz VRSRDGZFFSHUDF-BDAKNGLRSA-N 1 2 209.293 2.035 20 0 BEADLO C[NH+](C)Cc1nnc([C@@H]2C[C@H]2C2CCCC2)o1 ZINC001118432854 988346977 /nfs/dbraw/zinc/34/69/77/988346977.db2.gz MPGHTEXCYLDILW-WDEREUQCSA-N 1 2 235.331 2.425 20 0 BEADLO C[NH+](C)Cc1nnc([C@H]2C[C@@H]2C2CCCC2)o1 ZINC001118432851 988348509 /nfs/dbraw/zinc/34/85/09/988348509.db2.gz MPGHTEXCYLDILW-MNOVXSKESA-N 1 2 235.331 2.425 20 0 BEADLO C[NH+](C)Cc1nnc([C@@H]2CC3CCC2CC3)o1 ZINC001118433070 988348928 /nfs/dbraw/zinc/34/89/28/988348928.db2.gz OVVBZPZAZHJDNM-VQXHTEKXSA-N 1 2 235.331 2.425 20 0 BEADLO CC1(C)C[NH+](Cc2nnc[nH]2)CC(C)(C)C1 ZINC001118557287 988438236 /nfs/dbraw/zinc/43/82/36/988438236.db2.gz FRGWWVHKYWJYCN-UHFFFAOYSA-N 1 2 222.336 2.063 20 0 BEADLO CCCC[C@@H](COC)[NH2+][C@H](C)c1noc(C)n1 ZINC001323767944 988606418 /nfs/dbraw/zinc/60/64/18/988606418.db2.gz LDYOALLUNGQTFG-KOLCDFICSA-N 1 2 241.335 2.234 20 0 BEADLO CCCC1CC[NH+](Cc2nnc(CC)[nH]2)CC1 ZINC001324086068 988693460 /nfs/dbraw/zinc/69/34/60/988693460.db2.gz TUDPQSGVMVEAQJ-UHFFFAOYSA-N 1 2 236.363 2.379 20 0 BEADLO C[NH+](C)Cc1nnc([C@@H]2CC23CCCC3)o1 ZINC001324173334 988735485 /nfs/dbraw/zinc/73/54/85/988735485.db2.gz KXGPDWHTALRFAY-VIFPVBQESA-N 1 2 221.304 2.179 20 0 BEADLO C[NH+](C)Cc1nnc(C2(c3ccccc3)CC2)o1 ZINC001324173295 988735795 /nfs/dbraw/zinc/73/57/95/988735795.db2.gz JUUMXHQDTGTAEQ-UHFFFAOYSA-N 1 2 243.310 2.211 20 0 BEADLO CCOC1CC2(C1)CC[N@H+](Cc1cc(C)[nH]n1)C2 ZINC001324427721 988836313 /nfs/dbraw/zinc/83/63/13/988836313.db2.gz ZFKLCEVPPCLKLB-UHFFFAOYSA-N 1 2 249.358 2.109 20 0 BEADLO CCOC1CC2(C1)CC[N@@H+](Cc1cc(C)[nH]n1)C2 ZINC001324427721 988836317 /nfs/dbraw/zinc/83/63/17/988836317.db2.gz ZFKLCEVPPCLKLB-UHFFFAOYSA-N 1 2 249.358 2.109 20 0 BEADLO COc1cc2[nH+]c(CCCCO)[nH]c2cc1F ZINC001247014305 988839811 /nfs/dbraw/zinc/83/98/11/988839811.db2.gz JLIHXMXUEGJLMM-UHFFFAOYSA-N 1 2 238.262 2.026 20 0 BEADLO COc1cc2[nH]c(CCCCO)[nH+]c2cc1F ZINC001247014305 988839816 /nfs/dbraw/zinc/83/98/16/988839816.db2.gz JLIHXMXUEGJLMM-UHFFFAOYSA-N 1 2 238.262 2.026 20 0 BEADLO OCCCCc1[nH]c2cc3c(cc2[nH+]1)CCC3 ZINC001247011689 988840411 /nfs/dbraw/zinc/84/04/11/988840411.db2.gz UGHZUQOCOBHOMN-UHFFFAOYSA-N 1 2 230.311 2.367 20 0 BEADLO C[C@H](C(=O)NC1CC(C(C)(C)C)C1)n1cc[nH+]c1 ZINC001324455436 988846166 /nfs/dbraw/zinc/84/61/66/988846166.db2.gz WAKOVFTWOYHMHW-VOMCLLRMSA-N 1 2 249.358 2.385 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)[nH]n1 ZINC001119304784 988918460 /nfs/dbraw/zinc/91/84/60/988918460.db2.gz YQBRPBXGNAYDKZ-SECBINFHSA-N 1 2 247.264 2.492 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)[nH]n1 ZINC001119304784 988918479 /nfs/dbraw/zinc/91/84/79/988918479.db2.gz YQBRPBXGNAYDKZ-SECBINFHSA-N 1 2 247.264 2.492 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N[C@H](C)C2(C)CC2)c[nH+]1 ZINC001514813373 988932316 /nfs/dbraw/zinc/93/23/16/988932316.db2.gz CWTFVQAHGIFJNH-LLVKDONJSA-N 1 2 249.358 2.231 20 0 BEADLO CC1(C)CCC[C@H](C[N@@H+]2CCn3cncc3C2)O1 ZINC001119311851 988932248 /nfs/dbraw/zinc/93/22/48/988932248.db2.gz FUEFUZNPCZZHDT-CYBMUJFWSA-N 1 2 249.358 2.046 20 0 BEADLO CC1(C)CCC[C@H](C[N@H+]2CCn3cncc3C2)O1 ZINC001119311851 988932262 /nfs/dbraw/zinc/93/22/62/988932262.db2.gz FUEFUZNPCZZHDT-CYBMUJFWSA-N 1 2 249.358 2.046 20 0 BEADLO CC(=O)c1ccc(N(C)Cc2c[nH+]cn2C)cc1 ZINC001119323648 988944321 /nfs/dbraw/zinc/94/43/21/988944321.db2.gz ZMZNBRHSPDTJKE-UHFFFAOYSA-N 1 2 243.310 2.259 20 0 BEADLO Cc1noc2ccc(C[N@@H+]3CCO[C@H](C)C3)cc12 ZINC001248690179 989124179 /nfs/dbraw/zinc/12/41/79/989124179.db2.gz JBTMYPIVQKHMFT-SNVBAGLBSA-N 1 2 246.310 2.357 20 0 BEADLO Cc1noc2ccc(C[N@H+]3CCO[C@H](C)C3)cc12 ZINC001248690179 989124187 /nfs/dbraw/zinc/12/41/87/989124187.db2.gz JBTMYPIVQKHMFT-SNVBAGLBSA-N 1 2 246.310 2.357 20 0 BEADLO Cc1cc(F)cc(N(C)CC2=CCCOC2)[nH+]1 ZINC001515892888 989128676 /nfs/dbraw/zinc/12/86/76/989128676.db2.gz VDSBYEIEWBXRJY-UHFFFAOYSA-N 1 2 236.290 2.312 20 0 BEADLO Cc1noc2ccc(C[N@H+]3C[C@H]4C[C@@H](C3)O4)cc12 ZINC001248705866 989133490 /nfs/dbraw/zinc/13/34/90/989133490.db2.gz ISMIYIQVYABLAF-TXEJJXNPSA-N 1 2 244.294 2.109 20 0 BEADLO Cc1noc2ccc(C[N@@H+]3C[C@H]4C[C@@H](C3)O4)cc12 ZINC001248705866 989133495 /nfs/dbraw/zinc/13/34/95/989133495.db2.gz ISMIYIQVYABLAF-TXEJJXNPSA-N 1 2 244.294 2.109 20 0 BEADLO C[C@H](C(=O)N1C[C@H](C)CC(C)(C)C1)n1cc[nH+]c1 ZINC001325298199 989148665 /nfs/dbraw/zinc/14/86/65/989148665.db2.gz BOGJLXMVCTXQRQ-VXGBXAGGSA-N 1 2 249.358 2.339 20 0 BEADLO Cc1cc(NCc2cnccn2)nc(C2CC2)[nH+]1 ZINC001516494451 989157545 /nfs/dbraw/zinc/15/75/45/989157545.db2.gz WCUCVXKJRLLLBL-UHFFFAOYSA-N 1 2 241.298 2.065 20 0 BEADLO CC[C@H](C)[C@H]([NH2+]C/C=C/C1CC1)C(=O)OC ZINC001119560398 989164441 /nfs/dbraw/zinc/16/44/41/989164441.db2.gz QSNWMURMAMKWBP-FANORHCKSA-N 1 2 225.332 2.130 20 0 BEADLO Fc1ccc(C[N@H+]2C[C@H]3C[C@@H](C2)O3)c2[nH]ccc21 ZINC001248817573 989173917 /nfs/dbraw/zinc/17/39/17/989173917.db2.gz BFPKWSIRXGNMKO-PHIMTYICSA-N 1 2 246.285 2.280 20 0 BEADLO Fc1ccc(C[N@@H+]2C[C@H]3C[C@@H](C2)O3)c2[nH]ccc21 ZINC001248817573 989173924 /nfs/dbraw/zinc/17/39/24/989173924.db2.gz BFPKWSIRXGNMKO-PHIMTYICSA-N 1 2 246.285 2.280 20 0 BEADLO O=C1CC[NH+](Cc2ccc(F)c3cc[nH]c32)CC1 ZINC001248815006 989174094 /nfs/dbraw/zinc/17/40/94/989174094.db2.gz IFLDZWXXSSYNOS-UHFFFAOYSA-N 1 2 246.285 2.472 20 0 BEADLO Cc1nonc1C[N@@H+]1CCC(F)(F)C(C)(C)C1 ZINC001248857308 989196477 /nfs/dbraw/zinc/19/64/77/989196477.db2.gz XHNRZUGHIIJDOW-UHFFFAOYSA-N 1 2 245.273 2.245 20 0 BEADLO Cc1nonc1C[N@H+]1CCC(F)(F)C(C)(C)C1 ZINC001248857308 989196483 /nfs/dbraw/zinc/19/64/83/989196483.db2.gz XHNRZUGHIIJDOW-UHFFFAOYSA-N 1 2 245.273 2.245 20 0 BEADLO Cc1nonc1C[NH+]1CC2(C1)CCCCC2 ZINC001248859626 989201906 /nfs/dbraw/zinc/20/19/06/989201906.db2.gz JYYMRZILYUGHGL-UHFFFAOYSA-N 1 2 221.304 2.144 20 0 BEADLO C[C@@H](C(=O)NC1[C@H](C)CCC[C@H]1C)n1cc[nH+]c1 ZINC001325556114 989209518 /nfs/dbraw/zinc/20/95/18/989209518.db2.gz UBXKNKBWYHPTGY-UTUOFQBUSA-N 1 2 249.358 2.385 20 0 BEADLO CC[C@@H](C)[N@H+](C)Cc1ncc(C(=O)OC)s1 ZINC001249463764 989289554 /nfs/dbraw/zinc/28/95/54/989289554.db2.gz VURQJOHEQGUUMS-MRVPVSSYSA-N 1 2 242.344 2.160 20 0 BEADLO CC[C@@H](C)[N@@H+](C)Cc1ncc(C(=O)OC)s1 ZINC001249463764 989289563 /nfs/dbraw/zinc/28/95/63/989289563.db2.gz VURQJOHEQGUUMS-MRVPVSSYSA-N 1 2 242.344 2.160 20 0 BEADLO COCC1C[NH+](Cc2nc(C3CC3)cs2)C1 ZINC001249526747 989300738 /nfs/dbraw/zinc/30/07/38/989300738.db2.gz XDDNZGGTNIYIDU-UHFFFAOYSA-N 1 2 238.356 2.099 20 0 BEADLO CCC(CC)C(=O)Nc1c(C)c[nH+]cc1C ZINC001518383800 989302848 /nfs/dbraw/zinc/30/28/48/989302848.db2.gz LBPQNHOVYUANDD-UHFFFAOYSA-N 1 2 220.316 2.495 20 0 BEADLO FC(F)(F)c1c[nH+]ccc1Nc1cccnn1 ZINC001249584905 989319144 /nfs/dbraw/zinc/31/91/44/989319144.db2.gz ZUZXJOFSRRTIBC-UHFFFAOYSA-N 1 2 240.188 2.056 20 0 BEADLO CCc1ncc(C[N@@H+]2CCO[C@H](C(C)C)C2)o1 ZINC001119773913 989400696 /nfs/dbraw/zinc/40/06/96/989400696.db2.gz AFFOHOGGKKBAAG-LBPRGKRZSA-N 1 2 238.331 2.094 20 0 BEADLO CCc1ncc(C[N@H+]2CCO[C@H](C(C)C)C2)o1 ZINC001119773913 989400699 /nfs/dbraw/zinc/40/06/99/989400699.db2.gz AFFOHOGGKKBAAG-LBPRGKRZSA-N 1 2 238.331 2.094 20 0 BEADLO CS/C=C\C(=O)OCC(C)(C)n1cc[nH+]c1 ZINC001519584592 989433441 /nfs/dbraw/zinc/43/34/41/989433441.db2.gz UIZDVIJEQKURDS-DAXSKMNVSA-N 1 2 240.328 2.038 20 0 BEADLO CS/C=C/C(=O)OCC(C)(C)n1cc[nH+]c1 ZINC001519584593 989435131 /nfs/dbraw/zinc/43/51/31/989435131.db2.gz UIZDVIJEQKURDS-QPJJXVBHSA-N 1 2 240.328 2.038 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)NC1(C2CCCCC2)CC1 ZINC001120000063 989553523 /nfs/dbraw/zinc/55/35/23/989553523.db2.gz UBTOOHXILRDJSJ-UHFFFAOYSA-N 1 2 247.342 2.181 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@@]1(C)C=CCC1 ZINC001520443292 989563799 /nfs/dbraw/zinc/56/37/99/989563799.db2.gz ZZUJSJWCFIJSSB-ZDUSSCGKSA-N 1 2 234.299 2.303 20 0 BEADLO CCn1c[nH+]cc1COC(=O)C1(F)CCCC1 ZINC001520440392 989564085 /nfs/dbraw/zinc/56/40/85/989564085.db2.gz GUXBKPBQHPPGSZ-UHFFFAOYSA-N 1 2 240.278 2.229 20 0 BEADLO CCc1cccc(Cc2nnc(C[NH+](C)C)o2)c1 ZINC001326523374 989596651 /nfs/dbraw/zinc/59/66/51/989596651.db2.gz FZGBGSLDEJQVIM-UHFFFAOYSA-N 1 2 245.326 2.284 20 0 BEADLO CC[N@H+](Cc1nnn(C(C)(C)C)n1)C(C)(C)C ZINC001326758973 989685513 /nfs/dbraw/zinc/68/55/13/989685513.db2.gz YWVSPPSTQOSWPU-UHFFFAOYSA-N 1 2 239.367 2.049 20 0 BEADLO CC[N@@H+](Cc1nnn(C(C)(C)C)n1)C(C)(C)C ZINC001326758973 989685519 /nfs/dbraw/zinc/68/55/19/989685519.db2.gz YWVSPPSTQOSWPU-UHFFFAOYSA-N 1 2 239.367 2.049 20 0 BEADLO C[C@@H](C(=O)N[C@]1(C)CC=CCC1)n1cc[nH+]c1 ZINC001326764904 989693420 /nfs/dbraw/zinc/69/34/20/989693420.db2.gz XAJFASBADWDSHA-WCQYABFASA-N 1 2 233.315 2.059 20 0 BEADLO CCN(C(=O)[C@@H](C)n1cc[nH+]c1)[C@@H](C)C(C)C ZINC001326800665 989723054 /nfs/dbraw/zinc/72/30/54/989723054.db2.gz SBHNAKZXMAYLRS-NWDGAFQWSA-N 1 2 237.347 2.337 20 0 BEADLO CCc1ccc(N2CCC[C@@H]([C@H](C)O)C2)[nH+]c1 ZINC001120828194 989907066 /nfs/dbraw/zinc/90/70/66/989907066.db2.gz PEVPBGOEHLECGL-WCQYABFASA-N 1 2 234.343 2.241 20 0 BEADLO CCc1ccc(N2CCC(C)(CO)CC2)[nH+]c1 ZINC001120919476 989964986 /nfs/dbraw/zinc/96/49/86/989964986.db2.gz XRMRHXISUXSWTN-UHFFFAOYSA-N 1 2 234.343 2.243 20 0 BEADLO CN(C[C@]12CCC[C@H]1OCC2)c1cccc[nH+]1 ZINC001120917422 989965862 /nfs/dbraw/zinc/96/58/62/989965862.db2.gz HFEZECWLNUVDLY-TZMCWYRMSA-N 1 2 232.327 2.477 20 0 BEADLO CCc1ccc(N2C[C@H](C)[C@](C)(CO)C2)[nH+]c1 ZINC001120948769 989981906 /nfs/dbraw/zinc/98/19/06/989981906.db2.gz DGJVDDSIFABKJA-FZMZJTMJSA-N 1 2 234.343 2.099 20 0 BEADLO CC(C)(COC(=O)[C@]12C[C@H]1CCC2)n1cc[nH+]c1 ZINC001526088969 990115321 /nfs/dbraw/zinc/11/53/21/990115321.db2.gz SFIJQWGKBJRVBU-BXUZGUMPSA-N 1 2 248.326 2.352 20 0 BEADLO Cc1cocc1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001527613434 990233280 /nfs/dbraw/zinc/23/32/80/990233280.db2.gz OLSXDJIVAPHCLU-UHFFFAOYSA-N 1 2 241.250 2.488 20 0 BEADLO CCN(CC1CCC1)C(=O)CCc1[nH+]ccn1C ZINC001528383482 990284803 /nfs/dbraw/zinc/28/48/03/990284803.db2.gz MCZNJPXBYAHMQL-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO Cn1c[nH+]cc1COC(=O)CCC1(C)CC1 ZINC001122678612 990433662 /nfs/dbraw/zinc/43/36/62/990433662.db2.gz XBTQFQYABRAONW-UHFFFAOYSA-N 1 2 222.288 2.044 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]12 ZINC001122757534 990443398 /nfs/dbraw/zinc/44/33/98/990443398.db2.gz QSSZLKRYYVHIQL-WCFLWFBJSA-N 1 2 248.326 2.290 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)c1ccccc1 ZINC001534713199 990455795 /nfs/dbraw/zinc/45/57/95/990455795.db2.gz TZGMMIMZFIYJAM-UHFFFAOYSA-N 1 2 226.279 2.373 20 0 BEADLO CCCCC(=O)OCC(C)(C)n1cc[nH+]c1 ZINC001123160272 990518576 /nfs/dbraw/zinc/51/85/76/990518576.db2.gz GHNVTDONLXHQHC-UHFFFAOYSA-N 1 2 224.304 2.352 20 0 BEADLO CCn1c[nH+]cc1COC(=O)C[C@@H]1C[C@H]1C1CC1 ZINC001123376303 990568172 /nfs/dbraw/zinc/56/81/72/990568172.db2.gz QFRGNVPYWXILGI-AAEUAGOBSA-N 1 2 248.326 2.382 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(CCC(C)C)C1CC1 ZINC001540669262 990636433 /nfs/dbraw/zinc/63/64/33/990636433.db2.gz PTYZEELJOKOQHE-UHFFFAOYSA-N 1 2 249.358 2.298 20 0 BEADLO O=C(Nc1ccccc1-n1cc[nH+]c1)[C@@H]1C[C@@H]1F ZINC001540721370 990643448 /nfs/dbraw/zinc/64/34/48/990643448.db2.gz ZRADVOFQUAZQLQ-ZJUUUORDSA-N 1 2 245.257 2.169 20 0 BEADLO Cc1cscc1NC(=O)CCc1[nH+]ccn1C ZINC001123672689 990643975 /nfs/dbraw/zinc/64/39/75/990643975.db2.gz ZIQKBRQWZWGTNL-UHFFFAOYSA-N 1 2 249.339 2.361 20 0 BEADLO C[C@H](CNC(=O)c1cccc2[nH+]ccn21)C1CC1 ZINC001542300843 990662103 /nfs/dbraw/zinc/66/21/03/990662103.db2.gz PHGNBDGYRHBAHF-SNVBAGLBSA-N 1 2 243.310 2.110 20 0 BEADLO CC(C)(C)C[C@@H]1CCCN1c1cc(N)nc[nH+]1 ZINC001548508703 990765479 /nfs/dbraw/zinc/76/54/79/990765479.db2.gz LTRFXTITMGMYQX-JTQLQIEISA-N 1 2 234.347 2.464 20 0 BEADLO CC[C@@H]1CCN(C(=O)[C@H](C)n2cc[nH+]c2)[C@@H]1C ZINC001556273592 990815433 /nfs/dbraw/zinc/81/54/33/990815433.db2.gz ULTBDIHHELGIPX-GRYCIOLGSA-N 1 2 235.331 2.091 20 0 BEADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)[C@H]1C[C@H]1F ZINC001125150851 990816052 /nfs/dbraw/zinc/81/60/52/990816052.db2.gz IDMUDTSBWVPCKJ-NWDGAFQWSA-N 1 2 245.257 2.169 20 0 BEADLO COCC[N@H+](C)Cc1cc(F)cc(F)c1F ZINC001137867212 990863078 /nfs/dbraw/zinc/86/30/78/990863078.db2.gz MHSLADDVGAUXQN-UHFFFAOYSA-N 1 2 233.233 2.182 20 0 BEADLO COCC[N@@H+](C)Cc1cc(F)cc(F)c1F ZINC001137867212 990863081 /nfs/dbraw/zinc/86/30/81/990863081.db2.gz MHSLADDVGAUXQN-UHFFFAOYSA-N 1 2 233.233 2.182 20 0 BEADLO C[C@@H](C(=O)NCCCC1CCC1)n1cc[nH+]c1 ZINC001557540427 990896044 /nfs/dbraw/zinc/89/60/44/990896044.db2.gz ULFWBDUCLKXLPX-NSHDSACASA-N 1 2 235.331 2.141 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)c1ccns1 ZINC001557620374 990899529 /nfs/dbraw/zinc/89/95/29/990899529.db2.gz VXZDLYXVZZYDBJ-UHFFFAOYSA-N 1 2 244.279 2.043 20 0 BEADLO Cc1c2ccccc2[nH]c1C[N@H+]1CCC12COC2 ZINC001138402977 990940580 /nfs/dbraw/zinc/94/05/80/990940580.db2.gz WNXBXFXOYWILRT-UHFFFAOYSA-N 1 2 242.322 2.451 20 0 BEADLO Cc1c2ccccc2[nH]c1C[N@@H+]1CCC12COC2 ZINC001138402977 990940574 /nfs/dbraw/zinc/94/05/74/990940574.db2.gz WNXBXFXOYWILRT-UHFFFAOYSA-N 1 2 242.322 2.451 20 0 BEADLO COc1c(C)cc(C[N@H+]2C[C@H]3C[C@@H](C2)O3)cc1C ZINC001138429062 990944483 /nfs/dbraw/zinc/94/44/83/990944483.db2.gz RVMRRCZKVRTKNO-OKILXGFUSA-N 1 2 247.338 2.285 20 0 BEADLO COc1c(C)cc(C[N@@H+]2C[C@H]3C[C@@H](C2)O3)cc1C ZINC001138429062 990944488 /nfs/dbraw/zinc/94/44/88/990944488.db2.gz RVMRRCZKVRTKNO-OKILXGFUSA-N 1 2 247.338 2.285 20 0 BEADLO CC(C)(C)c1n[nH]cc1C[N@@H+]1CCOC2(CC2)C1 ZINC001138581151 990975054 /nfs/dbraw/zinc/97/50/54/990975054.db2.gz YBMQYWHVOCHGSS-UHFFFAOYSA-N 1 2 249.358 2.072 20 0 BEADLO CC(C)(C)c1n[nH]cc1C[N@H+]1CCOC2(CC2)C1 ZINC001138581151 990975067 /nfs/dbraw/zinc/97/50/67/990975067.db2.gz YBMQYWHVOCHGSS-UHFFFAOYSA-N 1 2 249.358 2.072 20 0 BEADLO C[N@H+](Cc1ccno1)Cc1c[nH]nc1C(C)(C)C ZINC001138581032 990975415 /nfs/dbraw/zinc/97/54/15/990975415.db2.gz RTZSQXYATFUYNC-UHFFFAOYSA-N 1 2 248.330 2.327 20 0 BEADLO C[N@@H+](Cc1ccno1)Cc1c[nH]nc1C(C)(C)C ZINC001138581032 990975426 /nfs/dbraw/zinc/97/54/26/990975426.db2.gz RTZSQXYATFUYNC-UHFFFAOYSA-N 1 2 248.330 2.327 20 0 BEADLO CC(C)=CCC[C@H](C)[N@@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001258095118 990998075 /nfs/dbraw/zinc/99/80/75/990998075.db2.gz CYIOOUJLWADVPS-SRVKXCTJSA-N 1 2 223.316 2.121 20 0 BEADLO CC(C)=CCC[C@H](C)[N@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001258095118 990998080 /nfs/dbraw/zinc/99/80/80/990998080.db2.gz CYIOOUJLWADVPS-SRVKXCTJSA-N 1 2 223.316 2.121 20 0 BEADLO CCSc1ncc(C[NH+]2CC(C)(C)C2)cn1 ZINC001138650167 990999208 /nfs/dbraw/zinc/99/92/08/990999208.db2.gz RAJRSLZGBDSCJJ-UHFFFAOYSA-N 1 2 237.372 2.430 20 0 BEADLO CC(C)=CCC[C@@H](C)[N@@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001258095119 991001008 /nfs/dbraw/zinc/00/10/08/991001008.db2.gz CYIOOUJLWADVPS-WOPDTQHZSA-N 1 2 223.316 2.121 20 0 BEADLO CC(C)=CCC[C@@H](C)[N@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001258095119 991001016 /nfs/dbraw/zinc/00/10/16/991001016.db2.gz CYIOOUJLWADVPS-WOPDTQHZSA-N 1 2 223.316 2.121 20 0 BEADLO CNc1ncccc1C[N@@H+]1CCCC[C@H]1C(C)=O ZINC001138695435 991004986 /nfs/dbraw/zinc/00/49/86/991004986.db2.gz AMIQLBHYMMIREP-ZDUSSCGKSA-N 1 2 247.342 2.067 20 0 BEADLO CNc1ncccc1C[N@H+]1CCCC[C@H]1C(C)=O ZINC001138695435 991004992 /nfs/dbraw/zinc/00/49/92/991004992.db2.gz AMIQLBHYMMIREP-ZDUSSCGKSA-N 1 2 247.342 2.067 20 0 BEADLO C[N@H+](Cc1cccnc1F)C1CC(F)(F)C1 ZINC001138783798 991046725 /nfs/dbraw/zinc/04/67/25/991046725.db2.gz XPBZYQDEDPDAIN-UHFFFAOYSA-N 1 2 230.233 2.450 20 0 BEADLO C[N@@H+](Cc1cccnc1F)C1CC(F)(F)C1 ZINC001138783798 991046731 /nfs/dbraw/zinc/04/67/31/991046731.db2.gz XPBZYQDEDPDAIN-UHFFFAOYSA-N 1 2 230.233 2.450 20 0 BEADLO Cc1cc(C[N@@H+]2CCCC[C@H](F)C2)nn1C ZINC001138826643 991081960 /nfs/dbraw/zinc/08/19/60/991081960.db2.gz KZOCFLYGBRAKAO-NSHDSACASA-N 1 2 225.311 2.053 20 0 BEADLO Cc1cc(C[N@H+]2CCCC[C@H](F)C2)nn1C ZINC001138826643 991081966 /nfs/dbraw/zinc/08/19/66/991081966.db2.gz KZOCFLYGBRAKAO-NSHDSACASA-N 1 2 225.311 2.053 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC[C@H](C(F)F)C2)n1 ZINC001138940589 991108461 /nfs/dbraw/zinc/10/84/61/991108461.db2.gz PKHXIVGKPBNVSY-VIFPVBQESA-N 1 2 229.274 2.195 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC[C@H](C(F)F)C2)n1 ZINC001138940589 991108463 /nfs/dbraw/zinc/10/84/63/991108463.db2.gz PKHXIVGKPBNVSY-VIFPVBQESA-N 1 2 229.274 2.195 20 0 BEADLO CC(C)COc1ccc(C[NH+]2CC(C)(O)C2)cc1 ZINC001138969003 991113607 /nfs/dbraw/zinc/11/36/07/991113607.db2.gz LMPHMSADELIYDR-UHFFFAOYSA-N 1 2 249.354 2.288 20 0 BEADLO CCc1cn(Cc2cc(CO)ccc2F)c[nH+]1 ZINC001559466398 991113727 /nfs/dbraw/zinc/11/37/27/991113727.db2.gz RPJPPMANKKZIHD-UHFFFAOYSA-N 1 2 234.274 2.125 20 0 BEADLO CSCC[C@H](C)[N@@H+]1CCCC(=O)[C@@H](F)C1 ZINC001258215895 991136647 /nfs/dbraw/zinc/13/66/47/991136647.db2.gz RZGXJBHEXMJPNJ-UWVGGRQHSA-N 1 2 233.352 2.131 20 0 BEADLO CSCC[C@H](C)[N@H+]1CCCC(=O)[C@@H](F)C1 ZINC001258215895 991136656 /nfs/dbraw/zinc/13/66/56/991136656.db2.gz RZGXJBHEXMJPNJ-UWVGGRQHSA-N 1 2 233.352 2.131 20 0 BEADLO CCn1ccc(C[N@@H+]2CCC(F)(F)[C@H](C)C2)n1 ZINC001308801099 991140063 /nfs/dbraw/zinc/14/00/63/991140063.db2.gz LJLOYXXUXMNZET-SNVBAGLBSA-N 1 2 243.301 2.380 20 0 BEADLO CCn1ccc(C[N@H+]2CCC(F)(F)[C@H](C)C2)n1 ZINC001308801099 991140066 /nfs/dbraw/zinc/14/00/66/991140066.db2.gz LJLOYXXUXMNZET-SNVBAGLBSA-N 1 2 243.301 2.380 20 0 BEADLO CSCC[C@@H](C)[N@@H+]1CCC[C@@H](F)C(=O)C1 ZINC001258216670 991142457 /nfs/dbraw/zinc/14/24/57/991142457.db2.gz ZQKSFIHUHDSDPL-NXEZZACHSA-N 1 2 233.352 2.131 20 0 BEADLO CSCC[C@@H](C)[N@H+]1CCC[C@@H](F)C(=O)C1 ZINC001258216670 991142467 /nfs/dbraw/zinc/14/24/67/991142467.db2.gz ZQKSFIHUHDSDPL-NXEZZACHSA-N 1 2 233.352 2.131 20 0 BEADLO CSCC[C@H](C)[N@@H+]1CCC[C@H](F)C(=O)C1 ZINC001258216671 991147155 /nfs/dbraw/zinc/14/71/55/991147155.db2.gz ZQKSFIHUHDSDPL-UWVGGRQHSA-N 1 2 233.352 2.131 20 0 BEADLO CSCC[C@H](C)[N@H+]1CCC[C@H](F)C(=O)C1 ZINC001258216671 991147168 /nfs/dbraw/zinc/14/71/68/991147168.db2.gz ZQKSFIHUHDSDPL-UWVGGRQHSA-N 1 2 233.352 2.131 20 0 BEADLO COC(=O)C1([NH2+]C2CCCCCCC2)CC1 ZINC001258232218 991169829 /nfs/dbraw/zinc/16/98/29/991169829.db2.gz DBTOYCBXRZBTOY-UHFFFAOYSA-N 1 2 225.332 2.395 20 0 BEADLO Cn1ccc2cc(C[N@@H+]3CCC34COC4)ccc21 ZINC001139189666 991184470 /nfs/dbraw/zinc/18/44/70/991184470.db2.gz HKXLGMNOQJDJFH-UHFFFAOYSA-N 1 2 242.322 2.153 20 0 BEADLO Cn1ccc2cc(C[N@H+]3CCC34COC4)ccc21 ZINC001139189666 991184475 /nfs/dbraw/zinc/18/44/75/991184475.db2.gz HKXLGMNOQJDJFH-UHFFFAOYSA-N 1 2 242.322 2.153 20 0 BEADLO Cc1ccc(CC[NH2+]C2(c3ncon3)CC2)cc1 ZINC001308955351 991232919 /nfs/dbraw/zinc/23/29/19/991232919.db2.gz QEAFHGXLBITMNZ-UHFFFAOYSA-N 1 2 243.310 2.199 20 0 BEADLO CCCOC(=O)C[NH2+][C@H](C)CC(C)(C)SC ZINC001258330541 991255471 /nfs/dbraw/zinc/25/54/71/991255471.db2.gz XUEAYXBABNXVBS-SNVBAGLBSA-N 1 2 247.404 2.449 20 0 BEADLO C1=CC[NH+](Cc2cnc(-c3ccccc3)[nH]2)C1 ZINC001139550857 991268905 /nfs/dbraw/zinc/26/89/05/991268905.db2.gz LXMSHRWLNOMXNX-UHFFFAOYSA-N 1 2 225.295 2.449 20 0 BEADLO Clc1ccnc(C[N@@H+]2CC[C@]23CCOC3)c1 ZINC001139565221 991270423 /nfs/dbraw/zinc/27/04/23/991270423.db2.gz QJTYJQTWOAUIIG-GFCCVEGCSA-N 1 2 238.718 2.100 20 0 BEADLO Clc1ccnc(C[N@H+]2CC[C@]23CCOC3)c1 ZINC001139565221 991270442 /nfs/dbraw/zinc/27/04/42/991270442.db2.gz QJTYJQTWOAUIIG-GFCCVEGCSA-N 1 2 238.718 2.100 20 0 BEADLO CCOc1ccc(C)cc1C[N@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001139603677 991283022 /nfs/dbraw/zinc/28/30/22/991283022.db2.gz FKKSVEZAODEBAN-OKILXGFUSA-N 1 2 247.338 2.367 20 0 BEADLO CCOc1ccc(C)cc1C[N@@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001139603677 991283036 /nfs/dbraw/zinc/28/30/36/991283036.db2.gz FKKSVEZAODEBAN-OKILXGFUSA-N 1 2 247.338 2.367 20 0 BEADLO COc1ccncc1C[N@@H+]1C[C@H](F)C[C@H]1C ZINC001139606213 991286763 /nfs/dbraw/zinc/28/67/63/991286763.db2.gz FOHLASTUXOZYKF-MWLCHTKSSA-N 1 2 224.279 2.023 20 0 BEADLO COc1ccncc1C[N@H+]1C[C@H](F)C[C@H]1C ZINC001139606213 991286779 /nfs/dbraw/zinc/28/67/79/991286779.db2.gz FOHLASTUXOZYKF-MWLCHTKSSA-N 1 2 224.279 2.023 20 0 BEADLO CCOc1ccc(C[NH+]2CC(OC)C2)cc1CC ZINC001139618548 991293700 /nfs/dbraw/zinc/29/37/00/991293700.db2.gz BHVPKNPEQMWDCW-UHFFFAOYSA-N 1 2 249.354 2.478 20 0 BEADLO CC1(O)C[NH+](Cc2ccccc2C(F)F)C1 ZINC001139795732 991372770 /nfs/dbraw/zinc/37/27/70/991372770.db2.gz MYWVJZFZDCEFQB-UHFFFAOYSA-N 1 2 227.254 2.191 20 0 BEADLO COc1ncc(C[NH+]2CC3(CCC3)C2)s1 ZINC001139813444 991376494 /nfs/dbraw/zinc/37/64/94/991376494.db2.gz OBLLYDXFEMQOSQ-UHFFFAOYSA-N 1 2 224.329 2.138 20 0 BEADLO COCc1ccc(C[N@@H+]2CCO[C@H](C)C2)s1 ZINC001139826260 991386636 /nfs/dbraw/zinc/38/66/36/991386636.db2.gz UBCYLCVJFZGTIS-SNVBAGLBSA-N 1 2 241.356 2.115 20 0 BEADLO COCc1ccc(C[N@H+]2CCO[C@H](C)C2)s1 ZINC001139826260 991386641 /nfs/dbraw/zinc/38/66/41/991386641.db2.gz UBCYLCVJFZGTIS-SNVBAGLBSA-N 1 2 241.356 2.115 20 0 BEADLO C[C@H](CC1CC1)[N@@H+]1CCOCC(F)(F)C1 ZINC001258460157 991415905 /nfs/dbraw/zinc/41/59/05/991415905.db2.gz AFMRSWZNZZFFDC-SECBINFHSA-N 1 2 219.275 2.143 20 0 BEADLO C[C@H](CC1CC1)[N@H+]1CCOCC(F)(F)C1 ZINC001258460157 991415907 /nfs/dbraw/zinc/41/59/07/991415907.db2.gz AFMRSWZNZZFFDC-SECBINFHSA-N 1 2 219.275 2.143 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[N@@H+]1CCC[C@@H](F)C1 ZINC001560205372 991418013 /nfs/dbraw/zinc/41/80/13/991418013.db2.gz UCXYFDGICBNNBF-VXGBXAGGSA-N 1 2 245.338 2.398 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[N@H+]1CCC[C@@H](F)C1 ZINC001560205372 991418017 /nfs/dbraw/zinc/41/80/17/991418017.db2.gz UCXYFDGICBNNBF-VXGBXAGGSA-N 1 2 245.338 2.398 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccc(C)nc2)n(C)n1 ZINC001139931021 991424126 /nfs/dbraw/zinc/42/41/26/991424126.db2.gz AGQQXCLPIICPMG-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccc(C)nc2)n(C)n1 ZINC001139931021 991424129 /nfs/dbraw/zinc/42/41/29/991424129.db2.gz AGQQXCLPIICPMG-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Fc1ccc2c(c1)C[N@@H+](Cc1cccnn1)CC2 ZINC001139971608 991444168 /nfs/dbraw/zinc/44/41/68/991444168.db2.gz IQOLILAVCSKXEZ-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1ccc2c(c1)C[N@H+](Cc1cccnn1)CC2 ZINC001139971608 991444171 /nfs/dbraw/zinc/44/41/71/991444171.db2.gz IQOLILAVCSKXEZ-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO CSc1nccc(C[NH+]2CC3(CCC3)C2)n1 ZINC001140034049 991489450 /nfs/dbraw/zinc/48/94/50/991489450.db2.gz DIHQVAZVJFDWKR-UHFFFAOYSA-N 1 2 235.356 2.184 20 0 BEADLO CSc1nccc(C[NH+]2CC(C)(C)C2)n1 ZINC001140033358 991491006 /nfs/dbraw/zinc/49/10/06/991491006.db2.gz XHUFVRXVGBWQJJ-UHFFFAOYSA-N 1 2 223.345 2.040 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc(O)ccc2F)C[C@@H]1F ZINC001140051022 991503298 /nfs/dbraw/zinc/50/32/98/991503298.db2.gz SOQSHQZVNYOFLB-PELKAZGASA-N 1 2 227.254 2.321 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc(O)ccc2F)C[C@@H]1F ZINC001140051022 991503305 /nfs/dbraw/zinc/50/33/05/991503305.db2.gz SOQSHQZVNYOFLB-PELKAZGASA-N 1 2 227.254 2.321 20 0 BEADLO c1cn(Cc2nnc(CC3CCCC3)o2)c[nH+]1 ZINC001258601991 991507386 /nfs/dbraw/zinc/50/73/86/991507386.db2.gz LSSPQHJDRNWNKI-UHFFFAOYSA-N 1 2 232.287 2.047 20 0 BEADLO CC1(C)CC[C@@H]([N@@H+]2CC[C@@H](O)C(F)(F)C2)C1 ZINC001258604417 991511377 /nfs/dbraw/zinc/51/13/77/991511377.db2.gz CQZSZTHWFUVUHL-NXEZZACHSA-N 1 2 233.302 2.267 20 0 BEADLO CC1(C)CC[C@@H]([N@H+]2CC[C@@H](O)C(F)(F)C2)C1 ZINC001258604417 991511388 /nfs/dbraw/zinc/51/13/88/991511388.db2.gz CQZSZTHWFUVUHL-NXEZZACHSA-N 1 2 233.302 2.267 20 0 BEADLO CC(=O)[C@@H]1CCC[N@@H+]1Cc1ccc(O)cc1F ZINC001140130152 991534830 /nfs/dbraw/zinc/53/48/30/991534830.db2.gz LQNNSQSZYMRNLY-ZDUSSCGKSA-N 1 2 237.274 2.085 20 0 BEADLO CC(=O)[C@@H]1CCC[N@H+]1Cc1ccc(O)cc1F ZINC001140130152 991534837 /nfs/dbraw/zinc/53/48/37/991534837.db2.gz LQNNSQSZYMRNLY-ZDUSSCGKSA-N 1 2 237.274 2.085 20 0 BEADLO CCn1cnc(Cl)c1C[N@H+](C)CCCOC ZINC001560694988 991562279 /nfs/dbraw/zinc/56/22/79/991562279.db2.gz SCFUNZWQSJWPKG-UHFFFAOYSA-N 1 2 245.754 2.025 20 0 BEADLO CCn1cnc(Cl)c1C[N@@H+](C)CCCOC ZINC001560694988 991562291 /nfs/dbraw/zinc/56/22/91/991562291.db2.gz SCFUNZWQSJWPKG-UHFFFAOYSA-N 1 2 245.754 2.025 20 0 BEADLO Cc1ccc2[nH]nc(C[N@@H+](C)[C@H]3CCOC3)c2c1 ZINC001140330843 991608880 /nfs/dbraw/zinc/60/88/80/991608880.db2.gz MRKUDKAAUNSQDP-NSHDSACASA-N 1 2 245.326 2.092 20 0 BEADLO Cc1ccc2[nH]nc(C[N@H+](C)[C@H]3CCOC3)c2c1 ZINC001140330843 991608883 /nfs/dbraw/zinc/60/88/83/991608883.db2.gz MRKUDKAAUNSQDP-NSHDSACASA-N 1 2 245.326 2.092 20 0 BEADLO c1cc(C[N@@H+]2CCOC3(CCCCC3)C2)ncn1 ZINC001140349022 991623654 /nfs/dbraw/zinc/62/36/54/991623654.db2.gz GOPCIAZPKOBXTC-UHFFFAOYSA-N 1 2 247.342 2.012 20 0 BEADLO c1cc(C[N@H+]2CCOC3(CCCCC3)C2)ncn1 ZINC001140349022 991623659 /nfs/dbraw/zinc/62/36/59/991623659.db2.gz GOPCIAZPKOBXTC-UHFFFAOYSA-N 1 2 247.342 2.012 20 0 BEADLO C[C@@H]1CC(=O)CC[N@@H+]1Cc1ccc2n[nH]cc2c1 ZINC001140385052 991632486 /nfs/dbraw/zinc/63/24/86/991632486.db2.gz RHHWKFCYRYCCON-SNVBAGLBSA-N 1 2 243.310 2.116 20 0 BEADLO C[C@@H]1CC(=O)CC[N@H+]1Cc1ccc2n[nH]cc2c1 ZINC001140385052 991632490 /nfs/dbraw/zinc/63/24/90/991632490.db2.gz RHHWKFCYRYCCON-SNVBAGLBSA-N 1 2 243.310 2.116 20 0 BEADLO CC(C)CN(C(=O)[C@H](C)n1cc[nH+]c1)C1CC1 ZINC001318558951 991680011 /nfs/dbraw/zinc/68/00/11/991680011.db2.gz GYHKHXSZMIBQHH-NSHDSACASA-N 1 2 235.331 2.091 20 0 BEADLO CC[C@@H]1CCCN(C(=O)[C@@H](C)n2cc[nH+]c2)CC1 ZINC001318898376 991731040 /nfs/dbraw/zinc/73/10/40/991731040.db2.gz VFIXUOJARBUJPQ-CHWSQXEVSA-N 1 2 249.358 2.483 20 0 BEADLO CC[C@H](C)C[C@@H](C)NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001319123238 991794061 /nfs/dbraw/zinc/79/40/61/991794061.db2.gz NEZJMMYIHAFUEI-TUAOUCFPSA-N 1 2 237.347 2.385 20 0 BEADLO CCOC(=O)C1([NH2+][C@H]2CCC[C@H](C)C2)CC1 ZINC001258806974 991808126 /nfs/dbraw/zinc/80/81/26/991808126.db2.gz KHSWESQVEQOEDM-QWRGUYRKSA-N 1 2 225.332 2.250 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CCCC(C)(C)CC1 ZINC001566145011 991826675 /nfs/dbraw/zinc/82/66/75/991826675.db2.gz HFQLXQTWGKEPJF-UHFFFAOYSA-N 1 2 249.358 2.299 20 0 BEADLO CC[C@@H](Cc1ccccc1)[N@@H+]1CCC(=O)C1 ZINC001258851435 991885279 /nfs/dbraw/zinc/88/52/79/991885279.db2.gz PNAJKSJTIWNCQT-ZDUSSCGKSA-N 1 2 217.312 2.283 20 0 BEADLO CC[C@@H](Cc1ccccc1)[N@H+]1CCC(=O)C1 ZINC001258851435 991885285 /nfs/dbraw/zinc/88/52/85/991885285.db2.gz PNAJKSJTIWNCQT-ZDUSSCGKSA-N 1 2 217.312 2.283 20 0 BEADLO Cc1cccc(F)c1NC(=O)Cc1c[nH+]cn1C ZINC001566969740 991891926 /nfs/dbraw/zinc/89/19/26/991891926.db2.gz NOTZSJDYIKIBNN-UHFFFAOYSA-N 1 2 247.273 2.049 20 0 BEADLO CCC[C@@H](CC)NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001320385500 992187991 /nfs/dbraw/zinc/18/79/91/992187991.db2.gz HEDZTCMYHZWWOK-WDEREUQCSA-N 1 2 223.320 2.139 20 0 BEADLO COC(=O)C[N@@H+](Cc1ccoc1C)CC(C)C ZINC001261366973 992279332 /nfs/dbraw/zinc/27/93/32/992279332.db2.gz MYRCUDMFFFJOOX-UHFFFAOYSA-N 1 2 239.315 2.219 20 0 BEADLO COC(=O)C[N@H+](Cc1ccoc1C)CC(C)C ZINC001261366973 992279351 /nfs/dbraw/zinc/27/93/51/992279351.db2.gz MYRCUDMFFFJOOX-UHFFFAOYSA-N 1 2 239.315 2.219 20 0 BEADLO C[C@@H]1CC=CC[C@@H]1COC(=O)[C@@H]1CCCC[NH2+]1 ZINC001573633776 992663578 /nfs/dbraw/zinc/66/35/78/992663578.db2.gz BBKBOMLGSVSCEX-UPJWGTAASA-N 1 2 237.343 2.274 20 0 BEADLO C[NH2+]CC(=O)O[C@@H](C)c1ccccc1SC ZINC001573896162 992753492 /nfs/dbraw/zinc/75/34/92/992753492.db2.gz XKUWCOXFEQNXPZ-VIFPVBQESA-N 1 2 239.340 2.232 20 0 BEADLO Cc1cc(COC(=O)[C@H]2CCCC[NH2+]2)cs1 ZINC001574133899 992810235 /nfs/dbraw/zinc/81/02/35/992810235.db2.gz HAFKTCIPHBNPMO-LLVKDONJSA-N 1 2 239.340 2.242 20 0 BEADLO Cc1cc(CNC(=O)c2ccns2)cc(C)[nH+]1 ZINC001262628791 992980801 /nfs/dbraw/zinc/98/08/01/992980801.db2.gz GXCWVEGWRKUCTE-UHFFFAOYSA-N 1 2 247.323 2.085 20 0 BEADLO C[C@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1c[nH]nn1 ZINC001575691822 993095187 /nfs/dbraw/zinc/09/51/87/993095187.db2.gz XGMVFGMSVIKHCJ-DRZSPHRISA-N 1 2 242.326 2.259 20 0 BEADLO C[C@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1cn[nH]n1 ZINC001575691822 993095190 /nfs/dbraw/zinc/09/51/90/993095190.db2.gz XGMVFGMSVIKHCJ-DRZSPHRISA-N 1 2 242.326 2.259 20 0 BEADLO C[C@H]([NH2+]Cc1ccc2cc[nH]c2c1)c1cnn[nH]1 ZINC001575698901 993098114 /nfs/dbraw/zinc/09/81/14/993098114.db2.gz ZSKCNHWTXFEPNS-VIFPVBQESA-N 1 2 241.298 2.137 20 0 BEADLO CCSCC[NH2+][C@H](CC)c1noc(C)n1 ZINC000379996599 993302543 /nfs/dbraw/zinc/30/25/43/993302543.db2.gz JWDHDPVHFOPBFC-SECBINFHSA-N 1 2 229.349 2.172 20 0 BEADLO C[N@@H+](Cc1cn[nH]n1)C[C@@H]1CC2CCC1CC2 ZINC001576860658 993438319 /nfs/dbraw/zinc/43/83/19/993438319.db2.gz YKYLAJJZEUOWGL-MCIGGMRASA-N 1 2 234.347 2.063 20 0 BEADLO C[N@H+](Cc1cn[nH]n1)C[C@@H]1CC2CCC1CC2 ZINC001576860658 993438324 /nfs/dbraw/zinc/43/83/24/993438324.db2.gz YKYLAJJZEUOWGL-MCIGGMRASA-N 1 2 234.347 2.063 20 0 BEADLO CSCCCNc1cc2cc[nH]c2c[nH+]1 ZINC000393616932 993970837 /nfs/dbraw/zinc/97/08/37/993970837.db2.gz UPFMMESGGKMLBQ-UHFFFAOYSA-N 1 2 221.329 2.150 20 0 BEADLO Cc1ncc(C[NH+]2CCC(C(F)F)CC2)[nH]1 ZINC000724778394 994074851 /nfs/dbraw/zinc/07/48/51/994074851.db2.gz XUDZOOKSJNHSAM-UHFFFAOYSA-N 1 2 229.274 2.195 20 0 BEADLO Nc1ccc(Nc2cncc(Cl)c2)c[nH+]1 ZINC000821940826 994413717 /nfs/dbraw/zinc/41/37/17/994413717.db2.gz BHWCGLOGHRCTPK-UHFFFAOYSA-N 1 2 220.663 2.456 20 0 BEADLO O=C(Nc1ccsn1)c1cccc2[nH+]ccn21 ZINC001288211216 994459267 /nfs/dbraw/zinc/45/92/67/994459267.db2.gz DFQIMHXPZRVCHN-UHFFFAOYSA-N 1 2 244.279 2.043 20 0 BEADLO CC[C@H]1CCC[C@@H](NC(=O)Cc2[nH]c[nH+]c2C)C1 ZINC001293702019 994661774 /nfs/dbraw/zinc/66/17/74/994661774.db2.gz GRKYTGVGVSRADO-NWDGAFQWSA-N 1 2 249.358 2.346 20 0 BEADLO CCC[C@@H]1CCCN(C(=O)Cc2[nH]c[nH+]c2C)C1 ZINC001294686844 994709634 /nfs/dbraw/zinc/70/96/34/994709634.db2.gz LDVIPXOVFRUKHZ-GFCCVEGCSA-N 1 2 249.358 2.299 20 0 BEADLO C=C/C=C\CC(=O)NCc1ccn2cc[nH+]c2c1 ZINC001294905354 994721865 /nfs/dbraw/zinc/72/18/65/994721865.db2.gz NWSRIKNBFKVGBL-ARJAWSKDSA-N 1 2 241.294 2.083 20 0 BEADLO Cc1[nH]c([C@H]2CCCN2C(=O)CCF)[nH+]c1C ZINC001303608918 995165788 /nfs/dbraw/zinc/16/57/88/995165788.db2.gz NHXQDMKLQPTBAF-SNVBAGLBSA-N 1 2 239.294 2.050 20 0 BEADLO CC(C)CCC(=O)NCc1[nH]c2c([nH+]1)CCCC2 ZINC001304054754 995186709 /nfs/dbraw/zinc/18/67/09/995186709.db2.gz XGDVPPCVRPMZKF-UHFFFAOYSA-N 1 2 249.358 2.341 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001304106574 995190196 /nfs/dbraw/zinc/19/01/96/995190196.db2.gz BZLQVQFCAYYPEW-MWLCHTKSSA-N 1 2 235.331 2.195 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001304106574 995190202 /nfs/dbraw/zinc/19/02/02/995190202.db2.gz BZLQVQFCAYYPEW-MWLCHTKSSA-N 1 2 235.331 2.195 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)c2ccco2)[nH+]1 ZINC001304105684 995190550 /nfs/dbraw/zinc/19/05/50/995190550.db2.gz RBWLIXSNQUDWNF-UHFFFAOYSA-N 1 2 233.271 2.056 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)c2ccco2)c[nH+]1 ZINC001304105684 995190554 /nfs/dbraw/zinc/19/05/54/995190554.db2.gz RBWLIXSNQUDWNF-UHFFFAOYSA-N 1 2 233.271 2.056 20 0 BEADLO FC1(F)Oc2cccc(Cn3cc[nH+]c3)c2O1 ZINC001307540486 995397452 /nfs/dbraw/zinc/39/74/52/995397452.db2.gz ZVIMIQMFMVXHFM-UHFFFAOYSA-N 1 2 238.193 2.253 20 0 BEADLO C[C@H](CC1CCC1)NC(=O)CCc1[nH+]ccn1C ZINC001521768321 1170066201 /nfs/dbraw/zinc/06/62/01/1170066201.db2.gz VDDHRNFZMDQWEP-LLVKDONJSA-N 1 2 249.358 2.048 20 0 BEADLO Fc1ccc(/C=C/C[NH2+]Cc2csnn2)cc1 ZINC001621023020 1170183067 /nfs/dbraw/zinc/18/30/67/1170183067.db2.gz TWEOECMZQOCWOL-OWOJBTEDSA-N 1 2 249.314 2.480 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@H]1CC[C@H](C)[C@@H](C)C1 ZINC001611259767 1170432516 /nfs/dbraw/zinc/43/25/16/1170432516.db2.gz CWWXCJUCJXNDMS-JBLDHEPKSA-N 1 2 249.358 2.202 20 0 BEADLO CCc1cn(CC(=O)c2ccccc2F)c[nH+]1 ZINC001614960552 1170501493 /nfs/dbraw/zinc/50/14/93/1170501493.db2.gz NTNCOOXLTZHCCN-UHFFFAOYSA-N 1 2 232.258 2.468 20 0 BEADLO Fc1ccc([C@@H]2CC[N@@H+]2CC2=NOCC2)cc1 ZINC001620284454 1170664226 /nfs/dbraw/zinc/66/42/26/1170664226.db2.gz HVUYPNRIVACMBR-ZDUSSCGKSA-N 1 2 234.274 2.349 20 0 BEADLO Fc1ccc([C@@H]2CC[N@H+]2CC2=NOCC2)cc1 ZINC001620284454 1170664232 /nfs/dbraw/zinc/66/42/32/1170664232.db2.gz HVUYPNRIVACMBR-ZDUSSCGKSA-N 1 2 234.274 2.349 20 0 BEADLO COC1CC(C[N@@H+]2CCCC(F)(F)C2)C1 ZINC001621425164 1170806504 /nfs/dbraw/zinc/80/65/04/1170806504.db2.gz PHWKIYSMLGDYHX-UHFFFAOYSA-N 1 2 219.275 2.143 20 0 BEADLO COC1CC(C[N@H+]2CCCC(F)(F)C2)C1 ZINC001621425164 1170806510 /nfs/dbraw/zinc/80/65/10/1170806510.db2.gz PHWKIYSMLGDYHX-UHFFFAOYSA-N 1 2 219.275 2.143 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)[C@@H]1CCC[C@H](C)C1 ZINC001623929409 1170987059 /nfs/dbraw/zinc/98/70/59/1170987059.db2.gz FXIFJFLBJVQBKW-CMPLNLGQSA-N 1 2 249.358 2.298 20 0 BEADLO CC(C)c1coc(NC(=O)CCc2c[nH]c[nH+]2)n1 ZINC001624525983 1171042552 /nfs/dbraw/zinc/04/25/52/1171042552.db2.gz VRSCOZJZXLLVAJ-UHFFFAOYSA-N 1 2 248.286 2.092 20 0 BEADLO CC(C)c1coc(NC(=O)CCc2c[nH+]c[nH]2)n1 ZINC001624525983 1171042559 /nfs/dbraw/zinc/04/25/59/1171042559.db2.gz VRSCOZJZXLLVAJ-UHFFFAOYSA-N 1 2 248.286 2.092 20 0 BEADLO O=C(Nc1cccc(F)c1)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC001628542463 1171249594 /nfs/dbraw/zinc/24/95/94/1171249594.db2.gz VTTJBEGDAACJJW-GHMZBOCLSA-N 1 2 245.257 2.291 20 0 BEADLO O=C(Nc1cccc(F)c1)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC001628542463 1171249602 /nfs/dbraw/zinc/24/96/02/1171249602.db2.gz VTTJBEGDAACJJW-GHMZBOCLSA-N 1 2 245.257 2.291 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1c(C)cccc1C ZINC001629065022 1171277693 /nfs/dbraw/zinc/27/76/93/1171277693.db2.gz KWAZXRPOFFUNGY-GFCCVEGCSA-N 1 2 232.327 2.336 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1c(C)cccc1C ZINC001629065022 1171277698 /nfs/dbraw/zinc/27/76/98/1171277698.db2.gz KWAZXRPOFFUNGY-GFCCVEGCSA-N 1 2 232.327 2.336 20 0 BEADLO Cc1ccc(NC(=O)[C@H](C)n2cc[nH+]c2)c(O)c1 ZINC000044982651 1171428716 /nfs/dbraw/zinc/42/87/16/1171428716.db2.gz YBOUMFZFVNQRQJ-JTQLQIEISA-N 1 2 245.282 2.097 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)[C@@H](C)C(C)(C)C ZINC001631676518 1171472434 /nfs/dbraw/zinc/47/24/34/1171472434.db2.gz MEKOZCQDXTUFES-JTQLQIEISA-N 1 2 237.347 2.154 20 0 BEADLO C=C/C=C\CC(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC001632283275 1171502508 /nfs/dbraw/zinc/50/25/08/1171502508.db2.gz QJDPYQKFOVYBTF-VSQXVHSFSA-N 1 2 245.326 2.248 20 0 BEADLO Cc1ccc(NC(=O)[C@H](C)n2cc[nH+]c2)cc1 ZINC000048481982 1171618584 /nfs/dbraw/zinc/61/85/84/1171618584.db2.gz WZEGMQPLDCAPST-NSHDSACASA-N 1 2 229.283 2.391 20 0 BEADLO CC[C@H](C)[NH2+]CC(=O)OCc1ccccc1 ZINC000048632366 1171631326 /nfs/dbraw/zinc/63/13/26/1171631326.db2.gz NWSNZLMIRABHAG-NSHDSACASA-N 1 2 221.300 2.118 20 0 BEADLO C[C@@H](C(=O)Nc1cccc(F)c1)n1cc[nH+]c1 ZINC000049215298 1171682296 /nfs/dbraw/zinc/68/22/96/1171682296.db2.gz GBLBUHCEJJXFRI-VIFPVBQESA-N 1 2 233.246 2.222 20 0 BEADLO C[C@H](NC(=O)[C@H](C)n1cc[nH+]c1)c1ccccc1 ZINC000049215273 1171682483 /nfs/dbraw/zinc/68/24/83/1171682483.db2.gz XCGSALJTLKMEAL-RYUDHWBXSA-N 1 2 243.310 2.322 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)[C@H]2C[C@@H]2C2CC2)[nH+]1 ZINC001636016988 1171783336 /nfs/dbraw/zinc/78/33/36/1171783336.db2.gz UIYYCERONDTLEL-NEPJUHHUSA-N 1 2 247.342 2.195 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)[C@H]2C[C@@H]2C2CC2)c[nH+]1 ZINC001636016988 1171783344 /nfs/dbraw/zinc/78/33/44/1171783344.db2.gz UIYYCERONDTLEL-NEPJUHHUSA-N 1 2 247.342 2.195 20 0 BEADLO [NH3+][C@H](c1nnc(C2CCC2)o1)c1ccccc1 ZINC000050284002 1171787581 /nfs/dbraw/zinc/78/75/81/1171787581.db2.gz QZDSDWSSYWNULZ-NSHDSACASA-N 1 2 229.283 2.385 20 0 BEADLO CCn1cc[nH+]c1CNc1cc(C)cc(N)c1 ZINC000385128434 398135738 /nfs/dbraw/zinc/13/57/38/398135738.db2.gz AARHCZFZHMAFKR-UHFFFAOYSA-N 1 2 230.315 2.406 20 0 BEADLO CCC(CC)(CC)NC(=O)CCc1[nH]cc[nH+]1 ZINC000279484632 168316091 /nfs/dbraw/zinc/31/60/91/168316091.db2.gz RCANCUIKKRFMLO-UHFFFAOYSA-N 1 2 237.347 2.427 20 0 BEADLO CCO[C@@H]1CCC[N@@H+]([C@@H](C)c2csnn2)C1 ZINC000649318229 398142615 /nfs/dbraw/zinc/14/26/15/398142615.db2.gz FOLDEVCPQCPIEF-VHSXEESVSA-N 1 2 241.360 2.100 20 0 BEADLO CCO[C@@H]1CCC[N@H+]([C@@H](C)c2csnn2)C1 ZINC000649318229 398142617 /nfs/dbraw/zinc/14/26/17/398142617.db2.gz FOLDEVCPQCPIEF-VHSXEESVSA-N 1 2 241.360 2.100 20 0 BEADLO CCC1(C)C[NH+](Cc2cc(COC)on2)C1 ZINC000297360512 398144534 /nfs/dbraw/zinc/14/45/34/398144534.db2.gz HNYQFKZIWYJECR-UHFFFAOYSA-N 1 2 224.304 2.053 20 0 BEADLO Cc1nc(C[N@@H+](C)C2CCC(C)CC2)no1 ZINC000051452106 349488257 /nfs/dbraw/zinc/48/82/57/349488257.db2.gz TWTBTYGFXAQQPA-UHFFFAOYSA-N 1 2 223.320 2.389 20 0 BEADLO Cc1nc(C[N@H+](C)C2CCC(C)CC2)no1 ZINC000051452106 349488260 /nfs/dbraw/zinc/48/82/60/349488260.db2.gz TWTBTYGFXAQQPA-UHFFFAOYSA-N 1 2 223.320 2.389 20 0 BEADLO Cc1ccnc(C[N@@H+](C)[C@@H](C)c2ccncc2)n1 ZINC000336719300 187321367 /nfs/dbraw/zinc/32/13/67/187321367.db2.gz VSNDPZLPURFKHG-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1ccnc(C[N@H+](C)[C@@H](C)c2ccncc2)n1 ZINC000336719300 187321368 /nfs/dbraw/zinc/32/13/68/187321368.db2.gz VSNDPZLPURFKHG-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO CCCCC(=O)NCc1cn2cccc(C)c2[nH+]1 ZINC000071435392 398149582 /nfs/dbraw/zinc/14/95/82/398149582.db2.gz PZDYCBWFNZQSCQ-UHFFFAOYSA-N 1 2 245.326 2.449 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3ccccc3C2)nn1C ZINC000336709568 178004176 /nfs/dbraw/zinc/00/41/76/178004176.db2.gz MBBXWBDEQULINX-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO Cc1cc(C[N@H+]2CCc3ccccc3C2)nn1C ZINC000336709568 178004178 /nfs/dbraw/zinc/00/41/78/178004178.db2.gz MBBXWBDEQULINX-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO C[C@H]([NH2+][C@@H](C)C(F)F)c1cncs1 ZINC000389957686 398152000 /nfs/dbraw/zinc/15/20/00/398152000.db2.gz XULLECQLPDNSTE-WDSKDSINSA-N 1 2 206.261 2.447 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cncs1)C(F)F ZINC000389957674 398152179 /nfs/dbraw/zinc/15/21/79/398152179.db2.gz XULLECQLPDNSTE-NTSWFWBYSA-N 1 2 206.261 2.447 20 0 BEADLO Cc1cc(CNC(=O)Nc2cc[nH+]cc2C)on1 ZINC000121291735 178013992 /nfs/dbraw/zinc/01/39/92/178013992.db2.gz UCRALQJRMPSLMH-UHFFFAOYSA-N 1 2 246.270 2.008 20 0 BEADLO Cc1[nH]ncc1C[NH2+]C(C)(C)COC(C)C ZINC000396350903 262802563 /nfs/dbraw/zinc/80/25/63/262802563.db2.gz GGERYIXPCFLYAX-UHFFFAOYSA-N 1 2 225.336 2.011 20 0 BEADLO Fc1ccc(C[N@@H+]2CCc3ncccc3C2)nc1 ZINC000366363793 398155933 /nfs/dbraw/zinc/15/59/33/398155933.db2.gz WLFCCRHLZUCCOB-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1ccc(C[N@H+]2CCc3ncccc3C2)nc1 ZINC000366363793 398155938 /nfs/dbraw/zinc/15/59/38/398155938.db2.gz WLFCCRHLZUCCOB-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccccc2N(C)C)no1 ZINC000340197215 178025865 /nfs/dbraw/zinc/02/58/65/178025865.db2.gz UELAVXXOLZEDKK-UHFFFAOYSA-N 1 2 245.326 2.339 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccccc2F)no1 ZINC000044295991 178026930 /nfs/dbraw/zinc/02/69/30/178026930.db2.gz SHTWTEYMWMOSGS-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ccno2)nc1 ZINC000649898025 398169456 /nfs/dbraw/zinc/16/94/56/398169456.db2.gz XMVWPKQCHSNKTL-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ccno2)nc1 ZINC000649898025 398169458 /nfs/dbraw/zinc/16/94/58/398169458.db2.gz XMVWPKQCHSNKTL-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1c[nH+]c(CNCc2ccc(F)c(C)c2)n1C ZINC000341075571 178028905 /nfs/dbraw/zinc/02/89/05/178028905.db2.gz IJANJJCLNVHUND-UHFFFAOYSA-N 1 2 247.317 2.466 20 0 BEADLO CCc1cc(N[C@H]2CCS[C@H]2C)nc[nH+]1 ZINC000379916095 398174774 /nfs/dbraw/zinc/17/47/74/398174774.db2.gz CGVLMKUKEFTYRM-WPRPVWTQSA-N 1 2 223.345 2.345 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2cccc(C)n2)nn1C ZINC000558623911 398178006 /nfs/dbraw/zinc/17/80/06/398178006.db2.gz CFDIFUXYKMIAIM-GFCCVEGCSA-N 1 2 244.342 2.283 20 0 BEADLO C[C@@H]1SCC[C@@H]1Nc1nc[nH+]c(N)c1Cl ZINC000379982543 398179870 /nfs/dbraw/zinc/17/98/70/398179870.db2.gz IGMOJZUIIOLEAC-WDSKDSINSA-N 1 2 244.751 2.018 20 0 BEADLO C[C@@H]1SCC[C@@H]1Nc1[nH+]cnc(N)c1Cl ZINC000379982543 398179873 /nfs/dbraw/zinc/17/98/73/398179873.db2.gz IGMOJZUIIOLEAC-WDSKDSINSA-N 1 2 244.751 2.018 20 0 BEADLO Cc1cc(Cl)ccc1C[NH2+]CC(F)(F)CO ZINC000231776357 178066418 /nfs/dbraw/zinc/06/64/18/178066418.db2.gz FICYANYCTHIWGW-UHFFFAOYSA-N 1 2 249.688 2.366 20 0 BEADLO Cc1cc(Cl)ccc1OC(=O)C[NH+](C)C ZINC000263885116 178068724 /nfs/dbraw/zinc/06/87/24/178068724.db2.gz KXOKQFTVROSRTN-UHFFFAOYSA-N 1 2 227.691 2.115 20 0 BEADLO CC[C@@H]1CC[C@H](C)C[C@H]1NCC(F)(F)C[NH3+] ZINC000423343912 398166206 /nfs/dbraw/zinc/16/62/06/398166206.db2.gz MHAOZFQTEUGWFI-HBNTYKKESA-N 1 2 234.334 2.385 20 0 BEADLO CCc1nc(CN(C)c2cc[nH+]c(C)n2)cs1 ZINC000558647923 398185719 /nfs/dbraw/zinc/18/57/19/398185719.db2.gz XLRLVNWUIYKBBF-UHFFFAOYSA-N 1 2 248.355 2.440 20 0 BEADLO Cc1cc(F)cc2c1CN(Cc1[nH]cc[nH+]1)CC2 ZINC000336509102 178080352 /nfs/dbraw/zinc/08/03/52/178080352.db2.gz AOCXEBPQUNHEJD-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1cc(N2CCCO[C@H](C)C2)nc(C2CC2)[nH+]1 ZINC000172014990 178114856 /nfs/dbraw/zinc/11/48/56/178114856.db2.gz ZVZCWRRHBRMADY-LLVKDONJSA-N 1 2 247.342 2.278 20 0 BEADLO Cc1cc(N(C)CCO)c2cccc(F)c2[nH+]1 ZINC000152865307 178098304 /nfs/dbraw/zinc/09/83/04/178098304.db2.gz XQQCVIMNSLWWNN-UHFFFAOYSA-N 1 2 234.274 2.111 20 0 BEADLO Cc1cc(N(Cc2cccnc2)C2CC2)nc[nH+]1 ZINC000112965169 178101383 /nfs/dbraw/zinc/10/13/83/178101383.db2.gz LTACTQGDUJAARG-UHFFFAOYSA-N 1 2 240.310 2.349 20 0 BEADLO Cc1cc(N(Cc2ccccn2)C2CC2)nc[nH+]1 ZINC000354035996 178101994 /nfs/dbraw/zinc/10/19/94/178101994.db2.gz PKWLXRSWGATSEK-UHFFFAOYSA-N 1 2 240.310 2.349 20 0 BEADLO Cc1cc(N2CCCO[C@H](C(C)C)C2)nc[nH+]1 ZINC000338846005 178115350 /nfs/dbraw/zinc/11/53/50/178115350.db2.gz JBDMWSBVTQEKTJ-LBPRGKRZSA-N 1 2 235.331 2.036 20 0 BEADLO Cc1cc(N)nc(S[C@@H](C)c2cnccn2)[nH+]1 ZINC000185331558 178109504 /nfs/dbraw/zinc/10/95/04/178109504.db2.gz UGGKPPXYMGBUAG-QMMMGPOBSA-N 1 2 247.327 2.011 20 0 BEADLO Cc1cc(N)nc(SCc2ccccn2)[nH+]1 ZINC000071858236 178110296 /nfs/dbraw/zinc/11/02/96/178110296.db2.gz PZAZEOJPAKIZRX-UHFFFAOYSA-N 1 2 232.312 2.055 20 0 BEADLO Cc1cc(N2CCCc3occc3C2)nc[nH+]1 ZINC000335983515 178115648 /nfs/dbraw/zinc/11/56/48/178115648.db2.gz VWMQVDSHSIVPCB-UHFFFAOYSA-N 1 2 229.283 2.331 20 0 BEADLO CC(C)Cc1ccc(C[NH2+]Cc2cnn[nH]2)cc1 ZINC000398345569 398200662 /nfs/dbraw/zinc/20/06/62/398200662.db2.gz PHXDTJISVWLPFI-UHFFFAOYSA-N 1 2 244.342 2.293 20 0 BEADLO CC(C)Cc1ccc(C[NH2+]Cc2c[nH]nn2)cc1 ZINC000398345569 398200664 /nfs/dbraw/zinc/20/06/64/398200664.db2.gz PHXDTJISVWLPFI-UHFFFAOYSA-N 1 2 244.342 2.293 20 0 BEADLO CC(C)Cc1ccc(C[NH2+]Cc2cn[nH]n2)cc1 ZINC000398345569 398200667 /nfs/dbraw/zinc/20/06/67/398200667.db2.gz PHXDTJISVWLPFI-UHFFFAOYSA-N 1 2 244.342 2.293 20 0 BEADLO Cc1cc(N2CCC[C@H]2CCO)nc(C(C)C)[nH+]1 ZINC000336787117 178116490 /nfs/dbraw/zinc/11/64/90/178116490.db2.gz KMSCGIQPWPTZAW-LBPRGKRZSA-N 1 2 249.358 2.260 20 0 BEADLO Cc1cc(N2CCSCC[C@H]2C)nc[nH+]1 ZINC000302761694 178116541 /nfs/dbraw/zinc/11/65/41/178116541.db2.gz YJCKIXXEPURMNN-SNVBAGLBSA-N 1 2 223.345 2.117 20 0 BEADLO Cc1cc(N2CCSCC[C@@H]2C)nc[nH+]1 ZINC000302761693 178116546 /nfs/dbraw/zinc/11/65/46/178116546.db2.gz YJCKIXXEPURMNN-JTQLQIEISA-N 1 2 223.345 2.117 20 0 BEADLO Cc1cc(N2CC[C@@H](C3CCOCC3)C2)nc[nH+]1 ZINC000339053934 178118522 /nfs/dbraw/zinc/11/85/22/178118522.db2.gz GLJWHJHUEKYAGK-CYBMUJFWSA-N 1 2 247.342 2.038 20 0 BEADLO CCc1cnc(COc2cc[nH+]cc2)o1 ZINC000576295989 365557763 /nfs/dbraw/zinc/55/77/63/365557763.db2.gz QEZHFTWZKZKLIA-UHFFFAOYSA-N 1 2 204.229 2.211 20 0 BEADLO Cc1cc(N2CCc3ccccc3CC2)nc[nH+]1 ZINC000301313452 178120877 /nfs/dbraw/zinc/12/08/77/178120877.db2.gz KCJDVXQMLUUPCL-UHFFFAOYSA-N 1 2 239.322 2.390 20 0 BEADLO Cc1cc(NC(=O)COC(C)(C)C)cc[nH+]1 ZINC000158568483 178133305 /nfs/dbraw/zinc/13/33/05/178133305.db2.gz NIDYQBFODKRVGT-UHFFFAOYSA-N 1 2 222.288 2.144 20 0 BEADLO Cc1cc(NC(=O)C[C@H]2CCC(=O)[C@H]2C)cc[nH+]1 ZINC000280629145 178134519 /nfs/dbraw/zinc/13/45/19/178134519.db2.gz XDBKIMDFRULIHV-WDEREUQCSA-N 1 2 246.310 2.334 20 0 BEADLO Cc1cc(NC(=O)C[C@@H]2CCCCO2)cc[nH+]1 ZINC000074640943 178134995 /nfs/dbraw/zinc/13/49/95/178134995.db2.gz ICLBUIPRYQDWKF-LBPRGKRZSA-N 1 2 234.299 2.288 20 0 BEADLO Cc1cc(NC(=O)N2CCC[C@H]2CF)cc[nH+]1 ZINC000297793988 178138023 /nfs/dbraw/zinc/13/80/23/178138023.db2.gz OOWKVFNFAIBQCO-NSHDSACASA-N 1 2 237.278 2.356 20 0 BEADLO Cc1cnc(CNC(=O)Nc2cc[nH+]c(C)c2)o1 ZINC000286915317 178140730 /nfs/dbraw/zinc/14/07/30/178140730.db2.gz ASQFCANIHSNPLA-UHFFFAOYSA-N 1 2 246.270 2.008 20 0 BEADLO Cc1cc(NC(=O)NC[C@@H]2CCCCO2)cc[nH+]1 ZINC000271158795 178141195 /nfs/dbraw/zinc/14/11/95/178141195.db2.gz VLBJGEPXUVIOAG-LBPRGKRZSA-N 1 2 249.314 2.081 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2CCSC2)cc[nH+]1 ZINC000271132119 178142061 /nfs/dbraw/zinc/14/20/61/178142061.db2.gz NFHYGAMIISEBNK-SNVBAGLBSA-N 1 2 237.328 2.017 20 0 BEADLO Cc1cc(NC(=O)Nc2c(C)cc[nH+]c2C)n[nH]1 ZINC000287603548 178142155 /nfs/dbraw/zinc/14/21/55/178142155.db2.gz SFBQKVYGHARXLG-UHFFFAOYSA-N 1 2 245.286 2.374 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CC2(C)C)cc[nH+]1 ZINC000128694825 178147929 /nfs/dbraw/zinc/14/79/29/178147929.db2.gz MQTCTUVBUBOMNJ-SNVBAGLBSA-N 1 2 204.273 2.375 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CCO[C@H](C)C2)cc[nH+]1 ZINC000271837136 178148208 /nfs/dbraw/zinc/14/82/08/178148208.db2.gz AKHBDNTZRVQGOS-MNOVXSKESA-N 1 2 234.299 2.144 20 0 BEADLO CC[C@H](CC(=O)NCc1c[nH+]c[nH]1)C(C)C ZINC000331089790 398217681 /nfs/dbraw/zinc/21/76/81/398217681.db2.gz UNCOQGLZCNLRFV-SNVBAGLBSA-N 1 2 223.320 2.098 20 0 BEADLO CC[C@H](CC(=O)NCc1c[nH]c[nH+]1)C(C)C ZINC000331089790 398217684 /nfs/dbraw/zinc/21/76/84/398217684.db2.gz UNCOQGLZCNLRFV-SNVBAGLBSA-N 1 2 223.320 2.098 20 0 BEADLO Cc1cc(NC[C@@H](O)C(C)C)nc(C(C)C)[nH+]1 ZINC000125348831 178165631 /nfs/dbraw/zinc/16/56/31/178165631.db2.gz LDVQOTMKSMXZTJ-LLVKDONJSA-N 1 2 237.347 2.337 20 0 BEADLO Cc1cc(NC[C@@H](C)CCCO)nc(C2CC2)[nH+]1 ZINC000295056220 178164894 /nfs/dbraw/zinc/16/48/94/178164894.db2.gz YEPUHCNZAOELPT-JTQLQIEISA-N 1 2 249.358 2.483 20 0 BEADLO CC(C)(C)n1cc(C[NH2+][C@H]2CCC[C@@H]2F)nn1 ZINC000339583850 187329318 /nfs/dbraw/zinc/32/93/18/187329318.db2.gz JLRBZMHTNZCWSO-QWRGUYRKSA-N 1 2 240.326 2.013 20 0 BEADLO CCC(CC)CC(=O)NCc1[nH]c[nH+]c1C ZINC000330940764 168344607 /nfs/dbraw/zinc/34/46/07/168344607.db2.gz BUSYEWZMCUEXDG-UHFFFAOYSA-N 1 2 223.320 2.161 20 0 BEADLO Cc1cc(NCC2CCSCC2)nc[nH+]1 ZINC000123521470 178157951 /nfs/dbraw/zinc/15/79/51/178157951.db2.gz ZOMJYNGKZFUBMR-UHFFFAOYSA-N 1 2 223.345 2.340 20 0 BEADLO Cc1cc(NCCCCOC(C)C)nc[nH+]1 ZINC000228563427 178159381 /nfs/dbraw/zinc/15/93/81/178159381.db2.gz ASJZHRUUVWORFJ-UHFFFAOYSA-N 1 2 223.320 2.402 20 0 BEADLO Cc1cc(NC[C@@](C)(O)CCC(C)C)nc[nH+]1 ZINC000301326415 178166422 /nfs/dbraw/zinc/16/64/22/178166422.db2.gz BAGGVVSYQJHHAO-ZDUSSCGKSA-N 1 2 237.347 2.384 20 0 BEADLO Cc1cc(NC[C@@]2(C)CCCC[C@H]2O)nc[nH+]1 ZINC000301474728 178167209 /nfs/dbraw/zinc/16/72/09/178167209.db2.gz AHEPIOMBFGJXLT-DGCLKSJQSA-N 1 2 235.331 2.138 20 0 BEADLO Cc1cc(NC[C@H](O)c2ccc(F)cc2)nc[nH+]1 ZINC000301232100 178168801 /nfs/dbraw/zinc/16/88/01/178168801.db2.gz IBYKVJZCURNKSL-LBPRGKRZSA-N 1 2 247.273 2.070 20 0 BEADLO Cc1cc(NC[C@]2(C)CCCC[C@H]2O)nc[nH+]1 ZINC000301474732 178169706 /nfs/dbraw/zinc/16/97/06/178169706.db2.gz AHEPIOMBFGJXLT-YPMHNXCESA-N 1 2 235.331 2.138 20 0 BEADLO Cc1cc(NCc2ccc(O)cc2)nc[nH+]1 ZINC000123122220 178173472 /nfs/dbraw/zinc/17/34/72/178173472.db2.gz LXVNCEZYJOSGAW-UHFFFAOYSA-N 1 2 215.256 2.103 20 0 BEADLO Cc1cc(NCc2cn3ccccc3n2)nc[nH+]1 ZINC000110114389 178174413 /nfs/dbraw/zinc/17/44/13/178174413.db2.gz XBZWXXQETHFJAJ-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO CCc1nnc(C[NH2+][C@H](C)c2ccccc2F)[nH]1 ZINC000274594139 538930181 /nfs/dbraw/zinc/93/01/81/538930181.db2.gz KUFFDTHGSLXLKP-SECBINFHSA-N 1 2 248.305 2.357 20 0 BEADLO Cc1nc(CNc2cc(C)[nH+]cn2)oc1C ZINC000226386024 178176228 /nfs/dbraw/zinc/17/62/28/178176228.db2.gz TZACDXRAXLQFOA-UHFFFAOYSA-N 1 2 218.260 2.002 20 0 BEADLO Cc1cc(N[C@@H](C)C[C@@H](C)O)nc(C(C)C)[nH+]1 ZINC000126931331 178178914 /nfs/dbraw/zinc/17/89/14/178178914.db2.gz GGKBLEOPLYBESA-GXSJLCMTSA-N 1 2 237.347 2.480 20 0 BEADLO Cc1cc(N[C@@H](CO)CC(C)C)nc(C2CC2)[nH+]1 ZINC000265404436 178179882 /nfs/dbraw/zinc/17/98/82/178179882.db2.gz ZDNZRUUYMKCBOG-GFCCVEGCSA-N 1 2 249.358 2.481 20 0 BEADLO CC1(C)CCC(C)(C)N(C(=O)Cn2cc[nH+]c2)C1 ZINC000628532489 398222973 /nfs/dbraw/zinc/22/29/73/398222973.db2.gz NBKCHJBTLMHHFF-UHFFFAOYSA-N 1 2 249.358 2.310 20 0 BEADLO Cc1cc(N[C@@H](CCO)C(C)C)nc(C2CC2)[nH+]1 ZINC000266244162 178180908 /nfs/dbraw/zinc/18/09/08/178180908.db2.gz LXUDBLYIHRNUNJ-LBPRGKRZSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1cc(N[C@@H]2C[C@@H](O)C2(C)C)nc(C(C)C)[nH+]1 ZINC000129104608 178183870 /nfs/dbraw/zinc/18/38/70/178183870.db2.gz NMZRPRLOTUSPCI-GHMZBOCLSA-N 1 2 249.358 2.480 20 0 BEADLO Cc1cc(N[C@H]2CCC(=O)N[C@H]2C2CC2)nc[nH+]1 ZINC000329185944 178188951 /nfs/dbraw/zinc/18/89/51/178188951.db2.gz GHIJYIHFJYBMDN-GWCFXTLKSA-N 1 2 246.314 2.094 20 0 BEADLO Cc1cc(N[C@H](C)[C@H]2CCCOC2)nc[nH+]1 ZINC000336777809 178185923 /nfs/dbraw/zinc/18/59/23/178185923.db2.gz JPKXEWDCKUCORF-MNOVXSKESA-N 1 2 221.304 2.012 20 0 BEADLO Cc1cc(N[C@H]2CCOC[C@H]2C)nc(C2CC2)[nH+]1 ZINC000277612531 178189860 /nfs/dbraw/zinc/18/98/60/178189860.db2.gz LVTDMWMUIONZMQ-SKDRFNHKSA-N 1 2 247.342 2.499 20 0 BEADLO Cc1cc(N[C@H]2CCO[C@@H](C(C)C)C2)nc[nH+]1 ZINC000357216549 178190155 /nfs/dbraw/zinc/19/01/55/178190155.db2.gz YCBIDVTYQNNZJB-NWDGAFQWSA-N 1 2 235.331 2.401 20 0 BEADLO Cc1cc(N[C@H]2CC[C@@H](CO)C2)nc(C2CC2)[nH+]1 ZINC000296443507 178190191 /nfs/dbraw/zinc/19/01/91/178190191.db2.gz ZRMCRQMLJGAAGY-PWSUYJOCSA-N 1 2 247.342 2.235 20 0 BEADLO Cc1cc(N[C@H]2C[C@H](O)C2(C)C)nc(C2CC2)[nH+]1 ZINC000189211429 178191609 /nfs/dbraw/zinc/19/16/09/178191609.db2.gz AIWYHCYXWAXWHQ-QWRGUYRKSA-N 1 2 247.342 2.234 20 0 BEADLO Nc1[nH+]cnc(N[C@H]2CCC[C@H](F)C2)c1Cl ZINC000521037909 259302390 /nfs/dbraw/zinc/30/23/90/259302390.db2.gz VZCUKASTOZJNMA-BQBZGAKWSA-N 1 2 244.701 2.405 20 0 BEADLO Nc1nc[nH+]c(N[C@H]2CCC[C@H](F)C2)c1Cl ZINC000521037909 259302392 /nfs/dbraw/zinc/30/23/92/259302392.db2.gz VZCUKASTOZJNMA-BQBZGAKWSA-N 1 2 244.701 2.405 20 0 BEADLO CCc1cc(C[NH2+]Cc2ccco2)on1 ZINC000164378542 361747478 /nfs/dbraw/zinc/74/74/78/361747478.db2.gz LCAUUPCOZYTIAB-UHFFFAOYSA-N 1 2 206.245 2.120 20 0 BEADLO Cc1cc(=O)[nH]c([C@@H](C)[N@@H+](C)Cc2ccco2)n1 ZINC000192526104 178202217 /nfs/dbraw/zinc/20/22/17/178202217.db2.gz PGXZPSKUXQDILI-SNVBAGLBSA-N 1 2 247.298 2.277 20 0 BEADLO FC1(F)CCN(Cc2cn3ccccc3[nH+]2)C1 ZINC000334233248 136224516 /nfs/dbraw/zinc/22/45/16/136224516.db2.gz ODIZHXPLRUZYCE-UHFFFAOYSA-N 1 2 237.253 2.175 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2ccco2)nn1C ZINC000282267295 178228878 /nfs/dbraw/zinc/22/88/78/178228878.db2.gz RDYUJCQNISHUBJ-SNVBAGLBSA-N 1 2 219.288 2.172 20 0 BEADLO CCC[C@H]1CCCN(C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000280042338 538936517 /nfs/dbraw/zinc/93/65/17/538936517.db2.gz VNKZGRNVDYBMOR-LBPRGKRZSA-N 1 2 249.358 2.381 20 0 BEADLO CCC[C@H]1CCCN(C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000280042338 538936518 /nfs/dbraw/zinc/93/65/18/538936518.db2.gz VNKZGRNVDYBMOR-LBPRGKRZSA-N 1 2 249.358 2.381 20 0 BEADLO Cc1cccc(CCNc2ncc(Cl)cn2)[nH+]1 ZINC000280411713 538937119 /nfs/dbraw/zinc/93/71/19/538937119.db2.gz JDPRNWHSBYIVDY-UHFFFAOYSA-N 1 2 248.717 2.488 20 0 BEADLO CC1(C)CC[C@H](n2cc(Cn3cc[nH+]c3)nn2)C1 ZINC000629941464 361785991 /nfs/dbraw/zinc/78/59/91/361785991.db2.gz KDTYHKRXKJWMRI-LBPRGKRZSA-N 1 2 245.330 2.274 20 0 BEADLO COCCc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000649431021 398233585 /nfs/dbraw/zinc/23/35/85/398233585.db2.gz BFEFLWUZEQHYLX-UHFFFAOYSA-N 1 2 202.257 2.266 20 0 BEADLO CCC(CC)CNC(=O)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000366182519 168359203 /nfs/dbraw/zinc/35/92/03/168359203.db2.gz JTNVIASNGBSFGN-NSHDSACASA-N 1 2 249.358 2.382 20 0 BEADLO CCC(CC)CNC(=O)[C@H]1CCCc2[nH]c[nH+]c21 ZINC000366182519 168359207 /nfs/dbraw/zinc/35/92/07/168359207.db2.gz JTNVIASNGBSFGN-NSHDSACASA-N 1 2 249.358 2.382 20 0 BEADLO COCCOc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000649431342 398234445 /nfs/dbraw/zinc/23/44/45/398234445.db2.gz QUVNUFJWASTKCH-UHFFFAOYSA-N 1 2 218.256 2.102 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2ncn(C)n2)cs1 ZINC000294208925 178252330 /nfs/dbraw/zinc/25/23/30/178252330.db2.gz MKVDIZGILQIZKN-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2ccc(F)cn2)no1 ZINC000337412519 178252399 /nfs/dbraw/zinc/25/23/99/178252399.db2.gz NZKBZGOIPDTZIT-VIFPVBQESA-N 1 2 235.262 2.368 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@H]2CCCc3cn[nH]c32)no1 ZINC000285316718 178257755 /nfs/dbraw/zinc/25/77/55/178257755.db2.gz SVUKLVXVIZDLGU-ONGXEEELSA-N 1 2 246.314 2.434 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@H]2CCCc3c[nH]nc32)no1 ZINC000285316718 178257759 /nfs/dbraw/zinc/25/77/59/178257759.db2.gz SVUKLVXVIZDLGU-ONGXEEELSA-N 1 2 246.314 2.434 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@H]2C[C@@H](C)N(C3CC3)C2)no1 ZINC000337552960 178259284 /nfs/dbraw/zinc/25/92/84/178259284.db2.gz POSPELQJWMVTAH-USWWRNFRSA-N 1 2 249.358 2.259 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1C(=O)CCc1c[nH+]c[nH]1 ZINC000281355073 538938624 /nfs/dbraw/zinc/93/86/24/538938624.db2.gz XAESVYTZFGWRPP-CMPLNLGQSA-N 1 2 235.331 2.132 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1C(=O)CCc1c[nH]c[nH+]1 ZINC000281355073 538938625 /nfs/dbraw/zinc/93/86/25/538938625.db2.gz XAESVYTZFGWRPP-CMPLNLGQSA-N 1 2 235.331 2.132 20 0 BEADLO CC(C)N(CC1CCC1)C(=O)CCc1c[nH+]c[nH]1 ZINC000281443506 538939175 /nfs/dbraw/zinc/93/91/75/538939175.db2.gz BZWHPBFZPGSHIQ-UHFFFAOYSA-N 1 2 249.358 2.379 20 0 BEADLO CC(C)N(CC1CCC1)C(=O)CCc1c[nH]c[nH+]1 ZINC000281443506 538939177 /nfs/dbraw/zinc/93/91/77/538939177.db2.gz BZWHPBFZPGSHIQ-UHFFFAOYSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H]1SCC[C@H]1Nc1nc[nH+]c(N)c1Cl ZINC000379982536 398243387 /nfs/dbraw/zinc/24/33/87/398243387.db2.gz IGMOJZUIIOLEAC-NTSWFWBYSA-N 1 2 244.751 2.018 20 0 BEADLO C[C@@H]1SCC[C@H]1Nc1[nH+]cnc(N)c1Cl ZINC000379982536 398243389 /nfs/dbraw/zinc/24/33/89/398243389.db2.gz IGMOJZUIIOLEAC-NTSWFWBYSA-N 1 2 244.751 2.018 20 0 BEADLO COCC[C@H]([NH2+][C@H](C)c1ncc[nH]1)c1ccco1 ZINC000285496663 538941251 /nfs/dbraw/zinc/94/12/51/538941251.db2.gz APXPHUGUCGLFSG-MNOVXSKESA-N 1 2 249.314 2.431 20 0 BEADLO C[NH2+]Cc1noc(CCCC(C)(C)C)n1 ZINC000336713689 398240770 /nfs/dbraw/zinc/24/07/70/398240770.db2.gz UMVLCFPHBBVSFA-UHFFFAOYSA-N 1 2 211.309 2.158 20 0 BEADLO Cc1cc2ccccc2[nH+]c1N1CC[C@H](CO)C1 ZINC000063106505 178299224 /nfs/dbraw/zinc/29/92/24/178299224.db2.gz RHTYDIOANHCMDL-LBPRGKRZSA-N 1 2 242.322 2.362 20 0 BEADLO COc1ccc(F)cc1C[NH2+][C@H](C)c1ncc[nH]1 ZINC000287442518 538944869 /nfs/dbraw/zinc/94/48/69/538944869.db2.gz LBAUAJHVAJYGQF-SECBINFHSA-N 1 2 249.289 2.408 20 0 BEADLO C[C@@H](N[C@H](C1CC1)C(F)(F)F)c1[nH]cc[nH+]1 ZINC000287379719 538944909 /nfs/dbraw/zinc/94/49/09/538944909.db2.gz PIWCESDNDKGWJO-HTRCEHHLSA-N 1 2 233.237 2.401 20 0 BEADLO Cc1cc2[nH+]cn(C[C@H]3COCCO3)c2cc1C ZINC000336262605 178306010 /nfs/dbraw/zinc/30/60/10/178306010.db2.gz VWDDTTGSZWFJCI-LBPRGKRZSA-N 1 2 246.310 2.069 20 0 BEADLO c1cc(C[NH2+][C@H]2CCCc3occc32)no1 ZINC000169220202 538946833 /nfs/dbraw/zinc/94/68/33/538946833.db2.gz LIHNUGHKLMAPBF-NSHDSACASA-N 1 2 218.256 2.435 20 0 BEADLO Cc1ccc(-n2cc[nH+]c2)c(C(=O)NC2CC2)c1 ZINC000118757870 178347706 /nfs/dbraw/zinc/34/77/06/178347706.db2.gz RXJVLCGEBSNIIX-UHFFFAOYSA-N 1 2 241.294 2.073 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)C1(C)CCCCCC1 ZINC000291166927 538947406 /nfs/dbraw/zinc/94/74/06/538947406.db2.gz INGNDUHNAIAPQD-UHFFFAOYSA-N 1 2 249.358 2.397 20 0 BEADLO CC[C@H]1CCCC[C@@H]1C(=O)NCc1c[nH+]cn1C ZINC000291432243 538948026 /nfs/dbraw/zinc/94/80/26/538948026.db2.gz LLXMHUYTLQULLA-AAEUAGOBSA-N 1 2 249.358 2.253 20 0 BEADLO C[C@@H](CC1CCC1)NC(=O)CCc1[nH]cc[nH+]1 ZINC000634369743 361827321 /nfs/dbraw/zinc/82/73/21/361827321.db2.gz HQHKQOHJTXMSMN-JTQLQIEISA-N 1 2 235.331 2.037 20 0 BEADLO COc1cncc(C[N@@H+]2CCC[C@H]2CF)c1 ZINC000292928824 398263812 /nfs/dbraw/zinc/26/38/12/398263812.db2.gz CGVVOAHXUQFARD-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO COc1cncc(C[N@H+]2CCC[C@H]2CF)c1 ZINC000292928824 398263815 /nfs/dbraw/zinc/26/38/15/398263815.db2.gz CGVVOAHXUQFARD-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO C[C@H](CC1CCC1)NC(=O)CCc1c[nH+]cn1C ZINC000634369887 361827792 /nfs/dbraw/zinc/82/77/92/361827792.db2.gz LDTBUPBWQOQKRD-LLVKDONJSA-N 1 2 249.358 2.048 20 0 BEADLO CCc1cc(N[C@H](C)c2[nH+]ccn2CC)ncn1 ZINC000649470531 398270122 /nfs/dbraw/zinc/27/01/22/398270122.db2.gz RKHBMAVJLDUBTK-SNVBAGLBSA-N 1 2 245.330 2.429 20 0 BEADLO C[C@H]([NH2+][C@@H]1CS[C@@H](C)C1)C(=O)OC(C)(C)C ZINC000602503730 349581352 /nfs/dbraw/zinc/58/13/52/349581352.db2.gz FWRZAQJZFFYGPB-GUBZILKMSA-N 1 2 245.388 2.200 20 0 BEADLO CCc1cc(NC[C@@H]2C[C@H]2C(C)C)nc[nH+]1 ZINC000649467825 398268123 /nfs/dbraw/zinc/26/81/23/398268123.db2.gz PLDHDUPJGIJUDF-JQWIXIFHSA-N 1 2 219.332 2.165 20 0 BEADLO Cc1ncc([C@@H](C)[NH2+]CC(C)(F)F)c(C)n1 ZINC000378853071 346844669 /nfs/dbraw/zinc/84/46/69/346844669.db2.gz HOHPNJDVEYRRPP-SSDOTTSWSA-N 1 2 229.274 2.399 20 0 BEADLO CO[C@H](C[NH2+][C@H](C)c1cn[nH]c1C)C(C)(C)C ZINC000180691032 538958713 /nfs/dbraw/zinc/95/87/13/538958713.db2.gz VJWZVGHZZFJNNK-BXKDBHETSA-N 1 2 239.363 2.430 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1ccc2[nH]ccc2c1 ZINC000600111604 342670308 /nfs/dbraw/zinc/67/03/08/342670308.db2.gz KVZRXZFXQKKPOS-UHFFFAOYSA-N 1 2 246.310 2.163 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1ccc2[nH]ccc2c1 ZINC000600111604 342670309 /nfs/dbraw/zinc/67/03/09/342670309.db2.gz KVZRXZFXQKKPOS-UHFFFAOYSA-N 1 2 246.310 2.163 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1ccc2[nH]ccc2c1 ZINC000600153821 342692159 /nfs/dbraw/zinc/69/21/59/342692159.db2.gz QFSRZEHEBDCYAX-JTQLQIEISA-N 1 2 246.310 2.161 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1ccc2[nH]ccc2c1 ZINC000600153821 342692160 /nfs/dbraw/zinc/69/21/60/342692160.db2.gz QFSRZEHEBDCYAX-JTQLQIEISA-N 1 2 246.310 2.161 20 0 BEADLO CC(C)OC(=O)[C@H](C)[NH2+]C[C@@]1(C)CCCS1 ZINC000600169032 342694692 /nfs/dbraw/zinc/69/46/92/342694692.db2.gz OCEAHGZNQGVVKB-CMPLNLGQSA-N 1 2 245.388 2.202 20 0 BEADLO CCc1cc(Nc2cnn(CCF)c2)nc(C)[nH+]1 ZINC000624537288 344001454 /nfs/dbraw/zinc/00/14/54/344001454.db2.gz AIVPHJAWAOLTDL-UHFFFAOYSA-N 1 2 249.293 2.257 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccc(C)nc2C)o1 ZINC000581761038 342713639 /nfs/dbraw/zinc/71/36/39/342713639.db2.gz QCWZWCWFJMSYSP-SNVBAGLBSA-N 1 2 246.314 2.241 20 0 BEADLO C[C@H](Nc1cnn(CC2CC2)c1)c1[nH+]ccn1C ZINC000183420173 538966931 /nfs/dbraw/zinc/96/69/31/538966931.db2.gz OOPONKUASWGMSZ-JTQLQIEISA-N 1 2 245.330 2.200 20 0 BEADLO Cc1cc(CNC(=O)[C@H]2C[C@H]3C[C@H]3C2)cc(C)[nH+]1 ZINC000616363352 342721556 /nfs/dbraw/zinc/72/15/56/342721556.db2.gz PVJFELPMGUAYCL-WDNDVIMCSA-N 1 2 244.338 2.361 20 0 BEADLO CCc1[nH+]c(C)ccc1OCCCC(=O)OC ZINC000232200138 342789707 /nfs/dbraw/zinc/78/97/07/342789707.db2.gz YFSPSNOGZAEPBH-UHFFFAOYSA-N 1 2 237.299 2.284 20 0 BEADLO CCc1ncc(C[NH2+]Cc2cc(C3CC3)no2)o1 ZINC000639254241 398285796 /nfs/dbraw/zinc/28/57/96/398285796.db2.gz WIZONNAOERZIJL-UHFFFAOYSA-N 1 2 247.298 2.392 20 0 BEADLO FCC[C@@H]1CN(c2[nH]c3ccccc3[nH+]2)CCO1 ZINC000624650685 342809006 /nfs/dbraw/zinc/80/90/06/342809006.db2.gz IIJBGWZXHLINEQ-SNVBAGLBSA-N 1 2 249.289 2.128 20 0 BEADLO COc1c(C)[nH+]cnc1NC[C@]1(C)C[C@H]2C[C@H]2C1 ZINC000624657353 342811096 /nfs/dbraw/zinc/81/10/96/342811096.db2.gz NUWZATIDRVFVOC-GNXNZQSNSA-N 1 2 247.342 2.064 20 0 BEADLO CCc1cc(N[C@H]2CO[C@H](C3CC3)C2)nc[nH+]1 ZINC000624673342 342817077 /nfs/dbraw/zinc/81/70/77/342817077.db2.gz HWURIUHKHXTNGZ-NEPJUHHUSA-N 1 2 233.315 2.018 20 0 BEADLO CCC(O)(CC)CN(C)c1cc[nH+]c(C2CC2)n1 ZINC000624712177 342821207 /nfs/dbraw/zinc/82/12/07/342821207.db2.gz BVXBNKBOOSFMGS-UHFFFAOYSA-N 1 2 249.358 2.341 20 0 BEADLO CCC(CC)[NH2+]c1ccc(OCC(N)=O)cc1 ZINC000037041337 168394353 /nfs/dbraw/zinc/39/43/53/168394353.db2.gz UKDWADSAEFANHG-UHFFFAOYSA-N 1 2 236.315 2.151 20 0 BEADLO COc1ccc(N[C@H](C)[C@H]2CCCCO2)[nH+]c1 ZINC000379206736 538976578 /nfs/dbraw/zinc/97/65/78/538976578.db2.gz BRENKFIDGSWBSL-ZYHUDNBSSA-N 1 2 236.315 2.460 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)Nc1ccsc1 ZINC000189899200 538985776 /nfs/dbraw/zinc/98/57/76/538985776.db2.gz UATXTUGQWPWGDW-UHFFFAOYSA-N 1 2 221.285 2.043 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)Nc1ccsc1 ZINC000189899200 538985779 /nfs/dbraw/zinc/98/57/79/538985779.db2.gz UATXTUGQWPWGDW-UHFFFAOYSA-N 1 2 221.285 2.043 20 0 BEADLO CC1(C)C(c2noc(Cn3cc[nH+]c3)n2)C1(C)C ZINC000624750597 342826928 /nfs/dbraw/zinc/82/69/28/342826928.db2.gz ZCGNULVCGPNZSG-UHFFFAOYSA-N 1 2 246.314 2.464 20 0 BEADLO Fc1c[nH+]ccc1NCc1cnn2ccccc12 ZINC000192149898 538994133 /nfs/dbraw/zinc/99/41/33/538994133.db2.gz CWAZJIXWXHBABS-UHFFFAOYSA-N 1 2 242.257 2.481 20 0 BEADLO C[C@H](C1CC1)N(C(=O)CCc1c[nH+]c[nH]1)C1CC1 ZINC000188779643 538980171 /nfs/dbraw/zinc/98/01/71/538980171.db2.gz WETFNNRDRHCKDL-SNVBAGLBSA-N 1 2 247.342 2.132 20 0 BEADLO C[C@H](C1CC1)N(C(=O)CCc1c[nH]c[nH+]1)C1CC1 ZINC000188779643 538980172 /nfs/dbraw/zinc/98/01/72/538980172.db2.gz WETFNNRDRHCKDL-SNVBAGLBSA-N 1 2 247.342 2.132 20 0 BEADLO Cc1cc(CNC(=O)[C@]2(C)C[C@@H]2F)cc(C)[nH+]1 ZINC000335623000 136240434 /nfs/dbraw/zinc/24/04/34/136240434.db2.gz GHBKGHPOTMHGNX-WCQYABFASA-N 1 2 236.290 2.063 20 0 BEADLO C[C@@H](C1CC1)n1cc(NCc2[nH]cc[nH+]2)cn1 ZINC000189244102 346864231 /nfs/dbraw/zinc/86/42/31/346864231.db2.gz WUNSVFOZALMHEP-VIFPVBQESA-N 1 2 231.303 2.189 20 0 BEADLO CCC(CC)[C@@H](C)C(=O)NCCc1[nH]cc[nH+]1 ZINC000341757527 168398232 /nfs/dbraw/zinc/39/82/32/168398232.db2.gz XXGPCIHXTZUCMY-SNVBAGLBSA-N 1 2 237.347 2.141 20 0 BEADLO CCn1cc[nH+]c1CN[C@H]1CCCC1(F)F ZINC000381489598 539002418 /nfs/dbraw/zinc/00/24/18/539002418.db2.gz WVBNCNGLIPNAQD-VIFPVBQESA-N 1 2 229.274 2.180 20 0 BEADLO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1cocn1 ZINC000381507710 539002691 /nfs/dbraw/zinc/00/26/91/539002691.db2.gz QEWNEWIVUXLPHI-SSDOTTSWSA-N 1 2 221.260 2.130 20 0 BEADLO CCCn1cc(C[NH2+]C(C)(C)C(F)F)cn1 ZINC000381586647 539004121 /nfs/dbraw/zinc/00/41/21/539004121.db2.gz HWHGNUBRSRTVEE-UHFFFAOYSA-N 1 2 231.290 2.426 20 0 BEADLO C[C@H]1CCN(C(=O)CCc2c[nH+]c[nH]2)C[C@H](C)C1 ZINC000193664403 539007777 /nfs/dbraw/zinc/00/77/77/539007777.db2.gz AWCROZICEUCHHA-NWDGAFQWSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@H]1CCN(C(=O)CCc2c[nH]c[nH+]2)C[C@H](C)C1 ZINC000193664403 539007778 /nfs/dbraw/zinc/00/77/78/539007778.db2.gz AWCROZICEUCHHA-NWDGAFQWSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H]1CCN(C(=O)CCc2c[nH+]c[nH]2)C[C@@H](C)C1 ZINC000193664415 539007786 /nfs/dbraw/zinc/00/77/86/539007786.db2.gz AWCROZICEUCHHA-NEPJUHHUSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H]1CCN(C(=O)CCc2c[nH]c[nH+]2)C[C@@H](C)C1 ZINC000193664415 539007787 /nfs/dbraw/zinc/00/77/87/539007787.db2.gz AWCROZICEUCHHA-NEPJUHHUSA-N 1 2 249.358 2.237 20 0 BEADLO OCCC[C@@H]([NH2+]Cc1ccn[nH]1)c1ccccc1 ZINC000304254925 398295513 /nfs/dbraw/zinc/29/55/13/398295513.db2.gz BPSZZQGKKLPZDH-CQSZACIVSA-N 1 2 245.326 2.013 20 0 BEADLO C[C@H]1CCC[C@@H](CNC(=O)CCc2c[nH+]c[nH]2)C1 ZINC000192865244 538998979 /nfs/dbraw/zinc/99/89/79/538998979.db2.gz YUMDTPXVKQSMRP-NWDGAFQWSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H]1CCC[C@@H](CNC(=O)CCc2c[nH]c[nH+]2)C1 ZINC000192865244 538998981 /nfs/dbraw/zinc/99/89/81/538998981.db2.gz YUMDTPXVKQSMRP-NWDGAFQWSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1CC[C@H]1Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000390455539 539022025 /nfs/dbraw/zinc/02/20/25/539022025.db2.gz CPINFRDLXWOGAN-NXEZZACHSA-N 1 2 219.332 2.406 20 0 BEADLO CCn1nccc1C[NH2+][C@H]1CCCC1(F)F ZINC000390461110 539022259 /nfs/dbraw/zinc/02/22/59/539022259.db2.gz FVPAGUBDBODJHH-JTQLQIEISA-N 1 2 229.274 2.180 20 0 BEADLO C[C@@H](N[C@H]1CCCC1(F)F)c1[nH+]ccn1C ZINC000390645495 539026595 /nfs/dbraw/zinc/02/65/95/539026595.db2.gz NTMABPJNYTZTER-BDAKNGLRSA-N 1 2 229.274 2.259 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccc(C)cn2)s1 ZINC000391869991 539027961 /nfs/dbraw/zinc/02/79/61/539027961.db2.gz YMXNBKBHEHYFAL-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO Cc1nnsc1CNc1ccc(C)[nH+]c1C ZINC000394841402 361989352 /nfs/dbraw/zinc/98/93/52/361989352.db2.gz KNQYXKIPJWRNDE-UHFFFAOYSA-N 1 2 234.328 2.470 20 0 BEADLO CC=CC[NH2+][C@H](c1cccs1)c1nnc[nH]1 ZINC000624199037 342841408 /nfs/dbraw/zinc/84/14/08/342841408.db2.gz DXPXVKCEWZTYCE-VMZHVLLKSA-N 1 2 234.328 2.121 20 0 BEADLO CCn1cc[nH+]c1CNC(C)(C)C(F)F ZINC000389946636 539018978 /nfs/dbraw/zinc/01/89/78/539018978.db2.gz QVZDCYDLYHPHQD-UHFFFAOYSA-N 1 2 217.263 2.036 20 0 BEADLO Cc1cnc([C@H](C)[NH+]2C[C@@H](C)O[C@H](C)C2)o1 ZINC000348896440 136243158 /nfs/dbraw/zinc/24/31/58/136243158.db2.gz VDBIECJXDMKQBJ-MXWKQRLJSA-N 1 2 224.304 2.153 20 0 BEADLO COc1cncc(C[N@H+](C)Cc2ccsc2)n1 ZINC000625058341 342847032 /nfs/dbraw/zinc/84/70/32/342847032.db2.gz UJRWZRBCJLPSNV-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1cncc(C[N@@H+](C)Cc2ccsc2)n1 ZINC000625058341 342847033 /nfs/dbraw/zinc/84/70/33/342847033.db2.gz UJRWZRBCJLPSNV-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO Cc1nccnc1C[NH2+][C@H](C)c1ccccn1 ZINC000621326046 342867904 /nfs/dbraw/zinc/86/79/04/342867904.db2.gz WFWMRAQKAFHUHA-SNVBAGLBSA-N 1 2 228.299 2.031 20 0 BEADLO Cn1ncc2c1nc[nH+]c2SC1CCCC1 ZINC000014207453 342878067 /nfs/dbraw/zinc/87/80/67/342878067.db2.gz FNWPFEXHYGWXER-UHFFFAOYSA-N 1 2 234.328 2.398 20 0 BEADLO C[C@@H]([NH2+]Cc1ccon1)c1ccc2c(c1)OCO2 ZINC000148653477 398313338 /nfs/dbraw/zinc/31/33/38/398313338.db2.gz RNSNBFFDEYBXRP-SECBINFHSA-N 1 2 246.266 2.254 20 0 BEADLO Cc1nccc(C[N@H+]2CCOC[C@H]2CC(C)C)n1 ZINC000351567788 136246915 /nfs/dbraw/zinc/24/69/15/136246915.db2.gz JININVHNKUWXAD-CQSZACIVSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1nccc(C[N@@H+]2CCOC[C@H]2CC(C)C)n1 ZINC000351567788 136246916 /nfs/dbraw/zinc/24/69/16/136246916.db2.gz JININVHNKUWXAD-CQSZACIVSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1nccc(C[N@H+]2CCOC[C@@H]2CC(C)C)n1 ZINC000351567787 136247152 /nfs/dbraw/zinc/24/71/52/136247152.db2.gz JININVHNKUWXAD-AWEZNQCLSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1nccc(C[N@@H+]2CCOC[C@@H]2CC(C)C)n1 ZINC000351567787 136247153 /nfs/dbraw/zinc/24/71/53/136247153.db2.gz JININVHNKUWXAD-AWEZNQCLSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1nocc1C[N@H+]1CCOC[C@H]1CC(C)C ZINC000351569101 136247158 /nfs/dbraw/zinc/24/71/58/136247158.db2.gz RBZZJEKMFSESHB-CYBMUJFWSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1nocc1C[N@@H+]1CCOC[C@H]1CC(C)C ZINC000351569101 136247159 /nfs/dbraw/zinc/24/71/59/136247159.db2.gz RBZZJEKMFSESHB-CYBMUJFWSA-N 1 2 238.331 2.230 20 0 BEADLO CCOC(=O)C[N@H+](CC)Cc1cccc(C)c1 ZINC000047867203 342922739 /nfs/dbraw/zinc/92/27/39/342922739.db2.gz IPZQHIMWZQDPET-UHFFFAOYSA-N 1 2 235.327 2.380 20 0 BEADLO CCOC(=O)C[N@@H+](CC)Cc1cccc(C)c1 ZINC000047867203 342922741 /nfs/dbraw/zinc/92/27/41/342922741.db2.gz IPZQHIMWZQDPET-UHFFFAOYSA-N 1 2 235.327 2.380 20 0 BEADLO CC[C@H](NC(=O)C=Cc1c[nH]c[nH+]1)C(C)(C)C ZINC000493454382 529457905 /nfs/dbraw/zinc/45/79/05/529457905.db2.gz GPUUIFRBVFWBKQ-ZADCQDASSA-N 1 2 235.331 2.364 20 0 BEADLO CC[C@@H]1CCCCCN1C(=O)CCn1cc[nH+]c1 ZINC000351730323 136250579 /nfs/dbraw/zinc/25/05/79/136250579.db2.gz LGNGYUFBGKLGRZ-CYBMUJFWSA-N 1 2 249.358 2.454 20 0 BEADLO CC[C@H]1CCCCCN1C(=O)CCn1cc[nH+]c1 ZINC000351730328 136250649 /nfs/dbraw/zinc/25/06/49/136250649.db2.gz LGNGYUFBGKLGRZ-ZDUSSCGKSA-N 1 2 249.358 2.454 20 0 BEADLO Cc1noc(C)c1C[NH2+][C@@H]1C[C@H](C)n2ccnc21 ZINC000379025156 346888856 /nfs/dbraw/zinc/88/88/56/346888856.db2.gz URMKPGBTCIISNI-QPUJVOFHSA-N 1 2 246.314 2.284 20 0 BEADLO C[C@@H](F)CC[N@@H+]1CCCC[C@@H]1c1nnc[nH]1 ZINC000351752936 136250890 /nfs/dbraw/zinc/25/08/90/136250890.db2.gz UAJMJJMJMLVILJ-NXEZZACHSA-N 1 2 226.299 2.080 20 0 BEADLO C[C@@H](F)CC[N@H+]1CCCC[C@@H]1c1nnc[nH]1 ZINC000351752936 136250891 /nfs/dbraw/zinc/25/08/91/136250891.db2.gz UAJMJJMJMLVILJ-NXEZZACHSA-N 1 2 226.299 2.080 20 0 BEADLO C[C@@H](F)CC[N@@H+]1CCCC[C@@H]1c1nc[nH]n1 ZINC000351752936 136250892 /nfs/dbraw/zinc/25/08/92/136250892.db2.gz UAJMJJMJMLVILJ-NXEZZACHSA-N 1 2 226.299 2.080 20 0 BEADLO C[C@@H](F)CC[N@H+]1CCCC[C@@H]1c1nc[nH]n1 ZINC000351752936 136250893 /nfs/dbraw/zinc/25/08/93/136250893.db2.gz UAJMJJMJMLVILJ-NXEZZACHSA-N 1 2 226.299 2.080 20 0 BEADLO C[C@H](F)CC[N@@H+]1CCCC[C@@H]1c1nnc[nH]1 ZINC000351752938 136251116 /nfs/dbraw/zinc/25/11/16/136251116.db2.gz UAJMJJMJMLVILJ-VHSXEESVSA-N 1 2 226.299 2.080 20 0 BEADLO C[C@H](F)CC[N@H+]1CCCC[C@@H]1c1nnc[nH]1 ZINC000351752938 136251117 /nfs/dbraw/zinc/25/11/17/136251117.db2.gz UAJMJJMJMLVILJ-VHSXEESVSA-N 1 2 226.299 2.080 20 0 BEADLO C[C@H](F)CC[N@@H+]1CCCC[C@@H]1c1nc[nH]n1 ZINC000351752938 136251118 /nfs/dbraw/zinc/25/11/18/136251118.db2.gz UAJMJJMJMLVILJ-VHSXEESVSA-N 1 2 226.299 2.080 20 0 BEADLO C[C@H](F)CC[N@H+]1CCCC[C@@H]1c1nc[nH]n1 ZINC000351752938 136251119 /nfs/dbraw/zinc/25/11/19/136251119.db2.gz UAJMJJMJMLVILJ-VHSXEESVSA-N 1 2 226.299 2.080 20 0 BEADLO CC(C)(C)c1nc(NC[C@@H]2CCC[C@H]2O)cc[nH+]1 ZINC000301579109 187206353 /nfs/dbraw/zinc/20/63/53/187206353.db2.gz NDSBSOKOBNVOSF-WDEREUQCSA-N 1 2 249.358 2.347 20 0 BEADLO CO[C@H]1CCCN(c2cc[nH+]c(C(C)C)n2)C1 ZINC000171924822 536712065 /nfs/dbraw/zinc/71/20/65/536712065.db2.gz OJHHWUNFLMQYAJ-NSHDSACASA-N 1 2 235.331 2.215 20 0 BEADLO Cc1occc1C[NH2+]Cc1nccs1 ZINC000308729388 346906636 /nfs/dbraw/zinc/90/66/36/346906636.db2.gz IMKLVJDGPKQARW-UHFFFAOYSA-N 1 2 208.286 2.334 20 0 BEADLO CC(C)c1nc(N2CCOCC[C@H]2C)cc[nH+]1 ZINC000302006338 187206997 /nfs/dbraw/zinc/20/69/97/187206997.db2.gz VUGYLNUHKKQJEF-LLVKDONJSA-N 1 2 235.331 2.215 20 0 BEADLO CCn1cc[nH+]c1CN(C)[C@H](C)c1ccccn1 ZINC000162422944 349704233 /nfs/dbraw/zinc/70/42/33/349704233.db2.gz KZBWQLSOQSWSKK-GFCCVEGCSA-N 1 2 244.342 2.491 20 0 BEADLO CCc1[nH]ccc1C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000354764537 187211881 /nfs/dbraw/zinc/21/18/81/187211881.db2.gz DQWBILGEOLYMOD-LLVKDONJSA-N 1 2 246.314 2.181 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N[C@@H](C)CC(C)C ZINC000492494979 529555446 /nfs/dbraw/zinc/55/54/46/529555446.db2.gz UOCREUKISSMPIW-SYTKJHMZSA-N 1 2 249.358 2.467 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N[C@H]1CC=CCC1 ZINC000492529916 529556286 /nfs/dbraw/zinc/55/62/86/529556286.db2.gz HGIHJBGWUOECNU-BCPZQOPPSA-N 1 2 245.326 2.141 20 0 BEADLO Clc1cccnc1NCCCn1cc[nH+]c1 ZINC000020362096 342984076 /nfs/dbraw/zinc/98/40/76/342984076.db2.gz FEQKYYXTXVUJPF-UHFFFAOYSA-N 1 2 236.706 2.434 20 0 BEADLO CCN(C#N)CC[N@@H+]1CC[C@H]1c1cccc(F)c1 ZINC000602775803 349728338 /nfs/dbraw/zinc/72/83/38/349728338.db2.gz AWQMDPTZWCCQCP-AWEZNQCLSA-N 1 2 247.317 2.375 20 0 BEADLO CCN(C#N)CC[N@H+]1CC[C@H]1c1cccc(F)c1 ZINC000602775803 349728341 /nfs/dbraw/zinc/72/83/41/349728341.db2.gz AWQMDPTZWCCQCP-AWEZNQCLSA-N 1 2 247.317 2.375 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)/C=C/C1CC1 ZINC000493066664 529587627 /nfs/dbraw/zinc/58/76/27/529587627.db2.gz UFPUJBOBOZIEGT-VQCYPWCPSA-N 1 2 233.315 2.046 20 0 BEADLO Cc1ccc(OCCNc2cc[nH+]c(C)n2)cc1 ZINC000360216688 187217564 /nfs/dbraw/zinc/21/75/64/187217564.db2.gz AUDBLNTZMLZLOA-UHFFFAOYSA-N 1 2 243.310 2.006 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)OCC1CC1 ZINC000496023118 529588491 /nfs/dbraw/zinc/58/84/91/529588491.db2.gz QQQXBVMFVLEKTN-SECBINFHSA-N 1 2 237.303 2.100 20 0 BEADLO CC[C@@H](NC(=O)CC1(C)CC1)c1[nH]cc[nH+]1 ZINC000401275144 529588742 /nfs/dbraw/zinc/58/87/42/529588742.db2.gz PCORQHMGEXGKMA-SECBINFHSA-N 1 2 221.304 2.167 20 0 BEADLO COC(=O)c1coc([C@H](C)[N@H+]2[C@H](C)C[C@@H]2C)n1 ZINC000602821414 349761760 /nfs/dbraw/zinc/76/17/60/349761760.db2.gz LVOZTAIBFNWLKG-YIZRAAEISA-N 1 2 238.287 2.005 20 0 BEADLO COC(=O)c1coc([C@H](C)[N@@H+]2[C@H](C)C[C@@H]2C)n1 ZINC000602821414 349761762 /nfs/dbraw/zinc/76/17/62/349761762.db2.gz LVOZTAIBFNWLKG-YIZRAAEISA-N 1 2 238.287 2.005 20 0 BEADLO CCC(F)(F)C[N@H+](CCC(=O)OC)C(C)C ZINC000602788199 349751570 /nfs/dbraw/zinc/75/15/70/349751570.db2.gz UQKZJUGSWJYTFW-UHFFFAOYSA-N 1 2 237.290 2.305 20 0 BEADLO CCC(F)(F)C[N@@H+](CCC(=O)OC)C(C)C ZINC000602788199 349751573 /nfs/dbraw/zinc/75/15/73/349751573.db2.gz UQKZJUGSWJYTFW-UHFFFAOYSA-N 1 2 237.290 2.305 20 0 BEADLO c1nc(C[N@H+]2[C@H]3C=CC[C@@H]2CC3)cs1 ZINC000368433800 187220853 /nfs/dbraw/zinc/22/08/53/187220853.db2.gz MQISBWXFDMEPBF-WDEREUQCSA-N 1 2 206.314 2.436 20 0 BEADLO c1nc(C[N@@H+]2[C@H]3C=CC[C@@H]2CC3)cs1 ZINC000368433800 187220856 /nfs/dbraw/zinc/22/08/56/187220856.db2.gz MQISBWXFDMEPBF-WDEREUQCSA-N 1 2 206.314 2.436 20 0 BEADLO C[C@@H]1C[NH+](Cc2ncc[nH]2)C[C@@H](C)C1(F)F ZINC000625648563 344025185 /nfs/dbraw/zinc/02/51/85/344025185.db2.gz IIQDKOSSQWVVSH-RKDXNWHRSA-N 1 2 229.274 2.133 20 0 BEADLO c1coc([C@@H]2COCC[N@H+]2C[C@@H]2CCC=CO2)c1 ZINC000370526239 187221960 /nfs/dbraw/zinc/22/19/60/187221960.db2.gz CHRLZUYYWDQRRZ-STQMWFEESA-N 1 2 249.310 2.346 20 0 BEADLO c1coc([C@@H]2COCC[N@@H+]2C[C@@H]2CCC=CO2)c1 ZINC000370526239 187221963 /nfs/dbraw/zinc/22/19/63/187221963.db2.gz CHRLZUYYWDQRRZ-STQMWFEESA-N 1 2 249.310 2.346 20 0 BEADLO CC(C)=CC(=O)N1CCC[C@@H](c2[nH+]ccn2C)C1 ZINC000373045896 187223366 /nfs/dbraw/zinc/22/33/66/187223366.db2.gz UCKBKZHWWCEMLT-GFCCVEGCSA-N 1 2 247.342 2.092 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2nnc(C)o2)cc1 ZINC000302735594 187223568 /nfs/dbraw/zinc/22/35/68/187223568.db2.gz CQSSENUWXVDVRQ-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2nnc(C)o2)cc1 ZINC000302735594 187223570 /nfs/dbraw/zinc/22/35/70/187223570.db2.gz CQSSENUWXVDVRQ-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO C[C@H](CC(F)(F)F)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000402717964 343039576 /nfs/dbraw/zinc/03/95/76/343039576.db2.gz HTYQFVVSWNJHOR-RNFRBKRXSA-N 1 2 249.236 2.175 20 0 BEADLO CC[C@H](C)C[C@@H](C)NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493143374 529675367 /nfs/dbraw/zinc/67/53/67/529675367.db2.gz BCSCGJNMHODIDU-PFDYWKIBSA-N 1 2 235.331 2.364 20 0 BEADLO CC[C@H](C)C[C@H](C)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492811148 529679782 /nfs/dbraw/zinc/67/97/82/529679782.db2.gz KABRTXSSXCHHIF-PZIAFJOJSA-N 1 2 235.331 2.364 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+](C)Cc1sccc1C ZINC000067386498 362019586 /nfs/dbraw/zinc/01/95/86/362019586.db2.gz GJDPHAYVRPUDBL-JTQLQIEISA-N 1 2 241.356 2.440 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+](C)Cc1sccc1C ZINC000067386498 362019593 /nfs/dbraw/zinc/01/95/93/362019593.db2.gz GJDPHAYVRPUDBL-JTQLQIEISA-N 1 2 241.356 2.440 20 0 BEADLO c1cn(Cc2cn(CCC3CCCC3)nn2)c[nH+]1 ZINC000641000036 362113369 /nfs/dbraw/zinc/11/33/69/362113369.db2.gz QMLLJPDRVPWXPB-UHFFFAOYSA-N 1 2 245.330 2.103 20 0 BEADLO CCOC(=O)C[N@H+](CC)Cc1ccsc1 ZINC000050051804 343132828 /nfs/dbraw/zinc/13/28/28/343132828.db2.gz JTSCSARZNJADDY-UHFFFAOYSA-N 1 2 227.329 2.133 20 0 BEADLO CCOC(=O)C[N@@H+](CC)Cc1ccsc1 ZINC000050051804 343132830 /nfs/dbraw/zinc/13/28/30/343132830.db2.gz JTSCSARZNJADDY-UHFFFAOYSA-N 1 2 227.329 2.133 20 0 BEADLO CC[C@H](C)CNC(=O)c1ccc2[nH+]ccn2c1 ZINC000421583356 192357245 /nfs/dbraw/zinc/35/72/45/192357245.db2.gz XQOYMBGUNIUSMH-JTQLQIEISA-N 1 2 231.299 2.110 20 0 BEADLO C[NH2+]Cc1noc([C@H]2C[C@H]2C2CCCCC2)n1 ZINC000576959519 365734267 /nfs/dbraw/zinc/73/42/67/365734267.db2.gz ZUDDYXCYKKAOEH-QWRGUYRKSA-N 1 2 235.331 2.473 20 0 BEADLO CC[C@H](NC(=O)CSC(C)C)c1[nH]cc[nH+]1 ZINC000125332294 343173173 /nfs/dbraw/zinc/17/31/73/343173173.db2.gz JZZVCFYZIRYDCC-VIFPVBQESA-N 1 2 241.360 2.119 20 0 BEADLO Cc1ccc(F)c(C(=O)N[C@H](C)c2[nH]cc[nH+]2)c1 ZINC000139429267 343197428 /nfs/dbraw/zinc/19/74/28/343197428.db2.gz ZCZNERAVACHWPR-SECBINFHSA-N 1 2 247.273 2.348 20 0 BEADLO CCOCC[N@H+](C)Cc1ncccc1Cl ZINC000625283964 343220184 /nfs/dbraw/zinc/22/01/84/343220184.db2.gz RBIVYAPGZDMJSF-UHFFFAOYSA-N 1 2 228.723 2.203 20 0 BEADLO CCOCC[N@@H+](C)Cc1ncccc1Cl ZINC000625283964 343220186 /nfs/dbraw/zinc/22/01/86/343220186.db2.gz RBIVYAPGZDMJSF-UHFFFAOYSA-N 1 2 228.723 2.203 20 0 BEADLO CCC[C@H](CC)Nc1nc[nH+]c(N)c1OC ZINC000134873607 343191587 /nfs/dbraw/zinc/19/15/87/343191587.db2.gz KEKPKFDLUZAQKL-QMMMGPOBSA-N 1 2 224.308 2.058 20 0 BEADLO CCC[C@H](CC)Nc1[nH+]cnc(N)c1OC ZINC000134873607 343191588 /nfs/dbraw/zinc/19/15/88/343191588.db2.gz KEKPKFDLUZAQKL-QMMMGPOBSA-N 1 2 224.308 2.058 20 0 BEADLO COc1c(N)[nH+]cnc1NCC1(C)CCCC1 ZINC000134893857 343191991 /nfs/dbraw/zinc/19/19/91/343191991.db2.gz UCBFFRAUOPNNNL-UHFFFAOYSA-N 1 2 236.319 2.060 20 0 BEADLO COc1c(N)nc[nH+]c1NCC1(C)CCCC1 ZINC000134893857 343191993 /nfs/dbraw/zinc/19/19/93/343191993.db2.gz UCBFFRAUOPNNNL-UHFFFAOYSA-N 1 2 236.319 2.060 20 0 BEADLO CC1(C)CC(C[N@@H+]2CC(F)(F)C[C@H]2CO)C1 ZINC000625356116 343247706 /nfs/dbraw/zinc/24/77/06/343247706.db2.gz NZMHAYAGSRTOIP-JTQLQIEISA-N 1 2 233.302 2.125 20 0 BEADLO CC1(C)CC(C[N@H+]2CC(F)(F)C[C@H]2CO)C1 ZINC000625356116 343247708 /nfs/dbraw/zinc/24/77/08/343247708.db2.gz NZMHAYAGSRTOIP-JTQLQIEISA-N 1 2 233.302 2.125 20 0 BEADLO Cn1cc[nH+]c1CNc1ccc(F)cc1 ZINC000034937770 343281262 /nfs/dbraw/zinc/28/12/62/343281262.db2.gz OROFNGDXMCWMAM-UHFFFAOYSA-N 1 2 205.236 2.171 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1nncn1C)c1ccccc1F ZINC000037017271 343330548 /nfs/dbraw/zinc/33/05/48/343330548.db2.gz LTPWSPLAXJRVGG-ZJUUUORDSA-N 1 2 248.305 2.366 20 0 BEADLO CC1(C(=O)NCCCn2cc[nH+]c2)CCCCC1 ZINC000122012637 343302260 /nfs/dbraw/zinc/30/22/60/343302260.db2.gz BOLUYRLSLHTQCR-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO C[C@@H]1C[C@H](C)C[N@H+]1Cc1nc(C(F)F)no1 ZINC000335613035 136295668 /nfs/dbraw/zinc/29/56/68/136295668.db2.gz RMEPQXQXRSTXOP-NKWVEPMBSA-N 1 2 231.246 2.238 20 0 BEADLO C[C@@H]1C[C@H](C)C[N@@H+]1Cc1nc(C(F)F)no1 ZINC000335613035 136295669 /nfs/dbraw/zinc/29/56/69/136295669.db2.gz RMEPQXQXRSTXOP-NKWVEPMBSA-N 1 2 231.246 2.238 20 0 BEADLO CCS(=O)(=O)Nc1ccc([NH2+]C(C)C)cc1 ZINC000037784771 343355277 /nfs/dbraw/zinc/35/52/77/343355277.db2.gz IFCNAYNLHFAOPE-UHFFFAOYSA-N 1 2 242.344 2.269 20 0 BEADLO C[C@@H]1C[C@@H]1CNc1ccc(Cn2cc[nH+]c2)cn1 ZINC000348838066 136302231 /nfs/dbraw/zinc/30/22/31/136302231.db2.gz LUKKZUFAGWMUCU-DGCLKSJQSA-N 1 2 242.326 2.394 20 0 BEADLO Cc1cc(NC(=O)NCCC(C)(C)C)cc[nH+]1 ZINC000348831353 136303404 /nfs/dbraw/zinc/30/34/04/136303404.db2.gz ADYLJBCEBFQJHM-UHFFFAOYSA-N 1 2 235.331 2.370 20 0 BEADLO COCc1ccccc1C[NH2+]Cc1cn[nH]c1C ZINC000037762798 343354023 /nfs/dbraw/zinc/35/40/23/343354023.db2.gz UYHGPDAFRCFUAH-UHFFFAOYSA-N 1 2 245.326 2.154 20 0 BEADLO CC1C[NH+](Cc2nccn2-c2ccccc2)C1 ZINC000335675304 136318246 /nfs/dbraw/zinc/31/82/46/136318246.db2.gz FJUMXGFGAVSZMM-UHFFFAOYSA-N 1 2 227.311 2.324 20 0 BEADLO CC[C@@H](C)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000421554097 192360369 /nfs/dbraw/zinc/36/03/69/192360369.db2.gz FPNHJVQTBRXKJJ-SECBINFHSA-N 1 2 220.316 2.361 20 0 BEADLO Cc1nc(C[N@@H+]2CCO[C@@H]3CCC[C@H]32)oc1C ZINC000335669414 136312448 /nfs/dbraw/zinc/31/24/48/136312448.db2.gz ZHJBXYHIBJYMRW-VXGBXAGGSA-N 1 2 236.315 2.045 20 0 BEADLO Cc1nc(C[N@H+]2CCO[C@@H]3CCC[C@H]32)oc1C ZINC000335669414 136312449 /nfs/dbraw/zinc/31/24/49/136312449.db2.gz ZHJBXYHIBJYMRW-VXGBXAGGSA-N 1 2 236.315 2.045 20 0 BEADLO CC(C)C[C@@H](C)Cn1cc(Cn2cc[nH+]c2)nn1 ZINC000641078071 362186922 /nfs/dbraw/zinc/18/69/22/362186922.db2.gz WYNTXVSZOQHPKT-GFCCVEGCSA-N 1 2 247.346 2.205 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@@]12C[C@@H]1CCC2 ZINC000421559505 192361750 /nfs/dbraw/zinc/36/17/50/192361750.db2.gz UPAZKOUNVBFQKF-MJVIPROJSA-N 1 2 247.342 2.270 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+]1CCCc2sccc2C1 ZINC000609338411 343419816 /nfs/dbraw/zinc/41/98/16/343419816.db2.gz CFOARJNQWSRWQS-SECBINFHSA-N 1 2 239.340 2.058 20 0 BEADLO COC(=O)[C@@H](C)[N@H+]1CCCc2sccc2C1 ZINC000609338411 343419819 /nfs/dbraw/zinc/41/98/19/343419819.db2.gz CFOARJNQWSRWQS-SECBINFHSA-N 1 2 239.340 2.058 20 0 BEADLO CCc1cc(N[C@@H](C)c2csnn2)nc[nH+]1 ZINC000398318178 488215341 /nfs/dbraw/zinc/21/53/41/488215341.db2.gz GQAHJGDHMXVLRZ-ZETCQYMHSA-N 1 2 235.316 2.064 20 0 BEADLO C[C@@H](CC(=O)N1CCn2cc[nH+]c2C1)C(C)(C)C ZINC000335679250 136319979 /nfs/dbraw/zinc/31/99/79/136319979.db2.gz DFMJWNQXLSTBHM-NSHDSACASA-N 1 2 249.358 2.298 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)CCC1CCCCC1 ZINC000041534834 343421272 /nfs/dbraw/zinc/42/12/72/343421272.db2.gz VYDIAZFTLIOPNY-UHFFFAOYSA-N 1 2 249.358 2.397 20 0 BEADLO C[C@H]1C[C@@H]1CC(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000335722180 136346346 /nfs/dbraw/zinc/34/63/46/136346346.db2.gz PDBFXQZCENTSNY-CMPLNLGQSA-N 1 2 247.342 2.162 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2cn3ccsc3n2)C1 ZINC000335721971 136346371 /nfs/dbraw/zinc/34/63/71/136346371.db2.gz SZCYFLLZINTIEW-LLVKDONJSA-N 1 2 239.319 2.330 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2cn3ccsc3n2)C1 ZINC000335721971 136346372 /nfs/dbraw/zinc/34/63/72/136346372.db2.gz SZCYFLLZINTIEW-LLVKDONJSA-N 1 2 239.319 2.330 20 0 BEADLO CC(C)=CC[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000275901394 187339407 /nfs/dbraw/zinc/33/94/07/187339407.db2.gz VDNKPGIEXAKNLU-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO c1ccc(C[N@@H+](Cc2cncnc2)C2CC2)nc1 ZINC000349252905 136333038 /nfs/dbraw/zinc/33/30/38/136333038.db2.gz VMSYLCNIPRHUKA-UHFFFAOYSA-N 1 2 240.310 2.036 20 0 BEADLO c1ccc(C[N@H+](Cc2cncnc2)C2CC2)nc1 ZINC000349252905 136333039 /nfs/dbraw/zinc/33/30/39/136333039.db2.gz VMSYLCNIPRHUKA-UHFFFAOYSA-N 1 2 240.310 2.036 20 0 BEADLO Cc1cc(N2CC(C)C2)nc(C(C)C)[nH+]1 ZINC000335700857 136334193 /nfs/dbraw/zinc/33/41/93/136334193.db2.gz ZXQRHACMWJJQGI-UHFFFAOYSA-N 1 2 205.305 2.365 20 0 BEADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1nccn1C ZINC000335714847 136338557 /nfs/dbraw/zinc/33/85/57/136338557.db2.gz PSEADFFKOKGPNF-IUCAKERBSA-N 1 2 247.264 2.193 20 0 BEADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1nccn1C ZINC000335714847 136338558 /nfs/dbraw/zinc/33/85/58/136338558.db2.gz PSEADFFKOKGPNF-IUCAKERBSA-N 1 2 247.264 2.193 20 0 BEADLO COC(=O)[C@@H](C)[NH2+]C1CC(c2ccccc2C)C1 ZINC000042304528 343434484 /nfs/dbraw/zinc/43/44/84/343434484.db2.gz CAGCYUCYRCDGFK-PNESKVBLSA-N 1 2 247.338 2.392 20 0 BEADLO C[C@H](Cc1cnn(C)c1)[NH2+]Cc1cccc(F)c1 ZINC000350550380 136361855 /nfs/dbraw/zinc/36/18/55/136361855.db2.gz APTVVDGIFXWCLY-LLVKDONJSA-N 1 2 247.317 2.280 20 0 BEADLO C[N@@H+](Cc1cscn1)C[C@H](O)c1ccccc1 ZINC000042867501 343455974 /nfs/dbraw/zinc/45/59/74/343455974.db2.gz GYOXUKRZNYEAQN-ZDUSSCGKSA-N 1 2 248.351 2.309 20 0 BEADLO C[N@H+](Cc1cscn1)C[C@H](O)c1ccccc1 ZINC000042867501 343455976 /nfs/dbraw/zinc/45/59/76/343455976.db2.gz GYOXUKRZNYEAQN-ZDUSSCGKSA-N 1 2 248.351 2.309 20 0 BEADLO C[C@H]([NH2+]Cc1cccc2c1OCO2)c1ccon1 ZINC000351573378 136369264 /nfs/dbraw/zinc/36/92/64/136369264.db2.gz JNJGUMQDFSTRPQ-VIFPVBQESA-N 1 2 246.266 2.254 20 0 BEADLO Cc1ccn2c(CN(C)CC(F)F)c[nH+]c2c1 ZINC000092508982 136376547 /nfs/dbraw/zinc/37/65/47/136376547.db2.gz LVOJNOKXZMAMPW-UHFFFAOYSA-N 1 2 239.269 2.340 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1CSC1(C)C ZINC000577004514 365754246 /nfs/dbraw/zinc/75/42/46/365754246.db2.gz IKJSGYCJXMCYRM-VIFPVBQESA-N 1 2 223.345 2.399 20 0 BEADLO CCCc1nc(C[N@H+](CCO)C2CC2)cs1 ZINC000048065460 343570733 /nfs/dbraw/zinc/57/07/33/343570733.db2.gz JXIAJIPNJOABPS-UHFFFAOYSA-N 1 2 240.372 2.052 20 0 BEADLO CCCc1nc(C[N@@H+](CCO)C2CC2)cs1 ZINC000048065460 343570735 /nfs/dbraw/zinc/57/07/35/343570735.db2.gz JXIAJIPNJOABPS-UHFFFAOYSA-N 1 2 240.372 2.052 20 0 BEADLO CC(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000082733978 187266730 /nfs/dbraw/zinc/26/67/30/187266730.db2.gz WGKIRKDUANJEDJ-UHFFFAOYSA-N 1 2 201.229 2.035 20 0 BEADLO CCCCC(=O)NCc1cn2cc(C)ccc2[nH+]1 ZINC000048968944 343590992 /nfs/dbraw/zinc/59/09/92/343590992.db2.gz FNXXAFJXWBILEE-UHFFFAOYSA-N 1 2 245.326 2.449 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)Nc1ccc(Cl)cn1 ZINC000049235996 343594319 /nfs/dbraw/zinc/59/43/19/343594319.db2.gz DBSFYTFHSCMFQD-SECBINFHSA-N 1 2 236.706 2.432 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@H](C)CCc1cccc(C)c1 ZINC000049352464 343595849 /nfs/dbraw/zinc/59/58/49/343595849.db2.gz BFNHBUSNALYJFE-CHWSQXEVSA-N 1 2 249.354 2.467 20 0 BEADLO CC1(C[N@@H+]2CCO[C@H](C(F)(F)F)C2)CC1 ZINC000683830328 488229024 /nfs/dbraw/zinc/22/90/24/488229024.db2.gz LYELKVYRXDGVNE-QMMMGPOBSA-N 1 2 223.238 2.050 20 0 BEADLO CC1(C[N@H+]2CCO[C@H](C(F)(F)F)C2)CC1 ZINC000683830328 488229026 /nfs/dbraw/zinc/22/90/26/488229026.db2.gz LYELKVYRXDGVNE-QMMMGPOBSA-N 1 2 223.238 2.050 20 0 BEADLO CC(=O)NCCC[N@@H+]1CCCCc2ccccc21 ZINC000126463271 343709106 /nfs/dbraw/zinc/70/91/06/343709106.db2.gz BUELVJHIECWGAM-UHFFFAOYSA-N 1 2 246.354 2.356 20 0 BEADLO CC(=O)NCCC[N@H+]1CCCCc2ccccc21 ZINC000126463271 343709108 /nfs/dbraw/zinc/70/91/08/343709108.db2.gz BUELVJHIECWGAM-UHFFFAOYSA-N 1 2 246.354 2.356 20 0 BEADLO Cc1nnsc1C[N@@H+](C)[C@H](C)c1cccnc1 ZINC000576063868 343702634 /nfs/dbraw/zinc/70/26/34/343702634.db2.gz VANLLLORQATBIQ-SNVBAGLBSA-N 1 2 248.355 2.435 20 0 BEADLO Cc1nnsc1C[N@H+](C)[C@H](C)c1cccnc1 ZINC000576063868 343702635 /nfs/dbraw/zinc/70/26/35/343702635.db2.gz VANLLLORQATBIQ-SNVBAGLBSA-N 1 2 248.355 2.435 20 0 BEADLO CCc1ncc(C[N@@H+](C)Cc2cn[nH]c2)s1 ZINC000678262345 488229325 /nfs/dbraw/zinc/22/93/25/488229325.db2.gz NDFJNDSLJRRXMA-UHFFFAOYSA-N 1 2 236.344 2.061 20 0 BEADLO CC(C)n1cc([C@@H](C)[NH2+]Cc2nccn2C)cn1 ZINC000557808246 343738088 /nfs/dbraw/zinc/73/80/88/343738088.db2.gz LFDKMKRGULWCCH-LLVKDONJSA-N 1 2 247.346 2.048 20 0 BEADLO CCc1cnccc1CNc1nc(C)[nH+]cc1C ZINC000584183013 343770968 /nfs/dbraw/zinc/77/09/68/343770968.db2.gz SCQMZCVTJBLPEW-UHFFFAOYSA-N 1 2 242.326 2.085 20 0 BEADLO CC(=O)Nc1cc(NCc2c[nH+]c[nH]2)ccc1F ZINC000054765026 187272317 /nfs/dbraw/zinc/27/23/17/187272317.db2.gz MDVPBQLJGNSQQK-UHFFFAOYSA-N 1 2 248.261 2.119 20 0 BEADLO CC(=O)Nc1cc(NCc2c[nH]c[nH+]2)ccc1F ZINC000054765026 187272319 /nfs/dbraw/zinc/27/23/19/187272319.db2.gz MDVPBQLJGNSQQK-UHFFFAOYSA-N 1 2 248.261 2.119 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1CCOC1(C)C ZINC000624410268 343763829 /nfs/dbraw/zinc/76/38/29/343763829.db2.gz MXQMFKJQCVDKPL-JTQLQIEISA-N 1 2 236.315 2.317 20 0 BEADLO FC(F)C(F)(F)CNc1cc[nH+]c(C2CC2)n1 ZINC000624417839 343782546 /nfs/dbraw/zinc/78/25/46/343782546.db2.gz UEZLQADWCLMFRX-UHFFFAOYSA-N 1 2 249.211 2.088 20 0 BEADLO CC[N@@H+](Cc1nccs1)C[C@@H]1CCCO1 ZINC000179204573 346976722 /nfs/dbraw/zinc/97/67/22/346976722.db2.gz IZYMQWGHEARUCW-JTQLQIEISA-N 1 2 226.345 2.144 20 0 BEADLO CC[N@H+](Cc1nccs1)C[C@@H]1CCCO1 ZINC000179204573 346976725 /nfs/dbraw/zinc/97/67/25/346976725.db2.gz IZYMQWGHEARUCW-JTQLQIEISA-N 1 2 226.345 2.144 20 0 BEADLO FC1(F)C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ncc[nH]1 ZINC000625683139 344038126 /nfs/dbraw/zinc/03/81/26/344038126.db2.gz LFCWXRSLAGNBOA-DTORHVGOSA-N 1 2 227.258 2.172 20 0 BEADLO FC1(F)C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ncc[nH]1 ZINC000625683139 344038127 /nfs/dbraw/zinc/03/81/27/344038127.db2.gz LFCWXRSLAGNBOA-DTORHVGOSA-N 1 2 227.258 2.172 20 0 BEADLO C(c1noc(C2CC2)n1)[NH+]1CCC2(CC2)CC1 ZINC000363459205 187274617 /nfs/dbraw/zinc/27/46/17/187274617.db2.gz IIPIVLKHGRZEGH-UHFFFAOYSA-N 1 2 233.315 2.323 20 0 BEADLO C[C@H](c1ccco1)[N@H+](C)Cc1cn(C)cn1 ZINC000683898436 488240112 /nfs/dbraw/zinc/24/01/12/488240112.db2.gz OZBWFYPHWARHNZ-SNVBAGLBSA-N 1 2 219.288 2.206 20 0 BEADLO C[C@H](c1ccco1)[N@@H+](C)Cc1cn(C)cn1 ZINC000683898436 488240113 /nfs/dbraw/zinc/24/01/13/488240113.db2.gz OZBWFYPHWARHNZ-SNVBAGLBSA-N 1 2 219.288 2.206 20 0 BEADLO CC[C@@H]([NH2+]Cc1c[nH]nn1)c1ccccc1 ZINC000295884801 343876142 /nfs/dbraw/zinc/87/61/42/343876142.db2.gz AYYIBKLNFQRSSD-GFCCVEGCSA-N 1 2 216.288 2.046 20 0 BEADLO CC[C@@H]([NH2+]Cc1cn[nH]n1)c1ccccc1 ZINC000295884801 343876144 /nfs/dbraw/zinc/87/61/44/343876144.db2.gz AYYIBKLNFQRSSD-GFCCVEGCSA-N 1 2 216.288 2.046 20 0 BEADLO C[C@H]([NH2+]CC(C)(F)F)c1ccncc1 ZINC000393421649 343869954 /nfs/dbraw/zinc/86/99/54/343869954.db2.gz JHXNXWBOEGMIFW-QMMMGPOBSA-N 1 2 200.232 2.387 20 0 BEADLO CCCC[C@H](C(=O)OC)[N@H+](C)Cc1ccco1 ZINC000067226590 343890585 /nfs/dbraw/zinc/89/05/85/343890585.db2.gz XGNFJSVJHDJMOA-GFCCVEGCSA-N 1 2 239.315 2.443 20 0 BEADLO CCCC[C@H](C(=O)OC)[N@@H+](C)Cc1ccco1 ZINC000067226590 343890588 /nfs/dbraw/zinc/89/05/88/343890588.db2.gz XGNFJSVJHDJMOA-GFCCVEGCSA-N 1 2 239.315 2.443 20 0 BEADLO CC(C)[C@@H](C)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000603246596 349899499 /nfs/dbraw/zinc/89/94/99/349899499.db2.gz NFPILSJQFOSSEY-OLZOCXBDSA-N 1 2 249.358 2.339 20 0 BEADLO CCC(=O)CCC[N@@H+]1Cc2ccc(O)cc2C1 ZINC000625728053 344059474 /nfs/dbraw/zinc/05/94/74/344059474.db2.gz TZEXLQJADQKQDC-UHFFFAOYSA-N 1 2 233.311 2.467 20 0 BEADLO CCC(=O)CCC[N@H+]1Cc2ccc(O)cc2C1 ZINC000625728053 344059476 /nfs/dbraw/zinc/05/94/76/344059476.db2.gz TZEXLQJADQKQDC-UHFFFAOYSA-N 1 2 233.311 2.467 20 0 BEADLO Cc1nnc(C[N@@H+]2CCCC(F)(F)CC2)s1 ZINC000625770248 344066284 /nfs/dbraw/zinc/06/62/84/344066284.db2.gz ITTPJQQDLRQBIT-UHFFFAOYSA-N 1 2 247.314 2.468 20 0 BEADLO Cc1nnc(C[N@H+]2CCCC(F)(F)CC2)s1 ZINC000625770248 344066288 /nfs/dbraw/zinc/06/62/88/344066288.db2.gz ITTPJQQDLRQBIT-UHFFFAOYSA-N 1 2 247.314 2.468 20 0 BEADLO FC1(F)CCC[N@H+](Cc2csnn2)CC1 ZINC000625771512 344067010 /nfs/dbraw/zinc/06/70/10/344067010.db2.gz GTSBDTKRLIMERI-UHFFFAOYSA-N 1 2 233.287 2.159 20 0 BEADLO FC1(F)CCC[N@@H+](Cc2csnn2)CC1 ZINC000625771512 344067011 /nfs/dbraw/zinc/06/70/11/344067011.db2.gz GTSBDTKRLIMERI-UHFFFAOYSA-N 1 2 233.287 2.159 20 0 BEADLO OCc1cc[nH+]c(NCCC2=CCCCC2)c1 ZINC000641252009 362330615 /nfs/dbraw/zinc/33/06/15/362330615.db2.gz DMWITSRVOZDNPW-UHFFFAOYSA-N 1 2 232.327 2.298 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1C[C@H](C)C[C@H]1C ZINC000335912317 344084676 /nfs/dbraw/zinc/08/46/76/344084676.db2.gz RUMKWBDRGKSUDW-MWLCHTKSSA-N 1 2 233.315 2.074 20 0 BEADLO CCc1nnc(C[NH+](C2CC2)C2CC2)s1 ZINC000625843298 344094359 /nfs/dbraw/zinc/09/43/59/344094359.db2.gz SGCDDHXPXXMONT-UHFFFAOYSA-N 1 2 223.345 2.227 20 0 BEADLO CCCn1c(C)nnc1C[NH+](C1CC1)C1CC1 ZINC000625843263 344094363 /nfs/dbraw/zinc/09/43/63/344094363.db2.gz RXAWHSLDMPHEJS-UHFFFAOYSA-N 1 2 234.347 2.123 20 0 BEADLO Cc1nc(N[C@H](CCO)c2ccccc2)cc[nH+]1 ZINC000078302233 344095799 /nfs/dbraw/zinc/09/57/99/344095799.db2.gz YZFJRBPINMBDTE-CYBMUJFWSA-N 1 2 243.310 2.321 20 0 BEADLO Cc1nc(C[N@@H+]2CCO[C@@H]3CCC[C@@H]32)c(C)o1 ZINC000625853689 344125165 /nfs/dbraw/zinc/12/51/65/344125165.db2.gz AGISMPQZVKUYQU-QWHCGFSZSA-N 1 2 236.315 2.045 20 0 BEADLO Cc1nc(C[N@H+]2CCO[C@@H]3CCC[C@@H]32)c(C)o1 ZINC000625853689 344125168 /nfs/dbraw/zinc/12/51/68/344125168.db2.gz AGISMPQZVKUYQU-QWHCGFSZSA-N 1 2 236.315 2.045 20 0 BEADLO Cc1ccc(Cc2nc(C(C)C)no2)c[nH+]1 ZINC000130301034 344129225 /nfs/dbraw/zinc/12/92/25/344129225.db2.gz XPPPCEMCIMQHIU-UHFFFAOYSA-N 1 2 217.272 2.487 20 0 BEADLO OCc1cc[nH+]c(NC[C@H]2Cc3ccccc32)c1 ZINC000641306245 362355211 /nfs/dbraw/zinc/35/52/11/362355211.db2.gz YUISOCLOURHFGL-CYBMUJFWSA-N 1 2 240.306 2.326 20 0 BEADLO CCN(C[C@H]1CCCO1)c1cc[nH+]cc1F ZINC000641305534 362355333 /nfs/dbraw/zinc/35/53/33/362355333.db2.gz CBPJSWWGINATQI-SNVBAGLBSA-N 1 2 224.279 2.226 20 0 BEADLO Cn1cnnc1C[N@@H+]1CCC[C@@H]1c1cccs1 ZINC000195513938 344207413 /nfs/dbraw/zinc/20/74/13/344207413.db2.gz MPYBORCSKBSVRR-SNVBAGLBSA-N 1 2 248.355 2.214 20 0 BEADLO Cn1cnnc1C[N@H+]1CCC[C@@H]1c1cccs1 ZINC000195513938 344207417 /nfs/dbraw/zinc/20/74/17/344207417.db2.gz MPYBORCSKBSVRR-SNVBAGLBSA-N 1 2 248.355 2.214 20 0 BEADLO C[C@@H](CCO)SCc1ccc(N(C)C)[nH+]c1 ZINC000600525553 344257051 /nfs/dbraw/zinc/25/70/51/344257051.db2.gz WWNOBBQBTJSXRP-JTQLQIEISA-N 1 2 240.372 2.152 20 0 BEADLO C[C@@H]1CN(c2cc[nH+]cc2F)CCS1 ZINC000641343902 362372587 /nfs/dbraw/zinc/37/25/87/362372587.db2.gz IIAAYFGTYBRMMV-MRVPVSSYSA-N 1 2 212.293 2.162 20 0 BEADLO C[C@@H]1CCC[C@H]1Nc1cc(CO)cc[nH+]1 ZINC000641348431 362373387 /nfs/dbraw/zinc/37/33/87/362373387.db2.gz XOPHKMDYFURTQC-MWLCHTKSSA-N 1 2 206.289 2.174 20 0 BEADLO C/C=C/C[NH2+][C@H](CC(C)C)C(=O)OCC ZINC000600615437 344337286 /nfs/dbraw/zinc/33/72/86/344337286.db2.gz VXEUKQGXOYBFAA-OKPNEXGHSA-N 1 2 213.321 2.130 20 0 BEADLO Cc1noc(C)c1[C@@H](C)Nc1cc[nH+]cc1F ZINC000641377730 362383380 /nfs/dbraw/zinc/38/33/80/362383380.db2.gz YRYSNROUHVIYKH-SSDOTTSWSA-N 1 2 235.262 2.421 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620603640 344353572 /nfs/dbraw/zinc/35/35/72/344353572.db2.gz JSPUFUBYFPSNRP-COPLHBTASA-N 1 2 249.358 2.280 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620603650 344353662 /nfs/dbraw/zinc/35/36/62/344353662.db2.gz JSPUFUBYFPSNRP-MJVIPROJSA-N 1 2 249.358 2.280 20 0 BEADLO CCSCC[NH2+][C@H](C[C@@H](C)CC)C(=O)OC ZINC000584292364 344426755 /nfs/dbraw/zinc/42/67/55/344426755.db2.gz LCTLILJYLYGKMC-WDEREUQCSA-N 1 2 247.404 2.307 20 0 BEADLO CCN(C(=O)CCc1c[nH+]c[nH]1)[C@H](C)C(C)C ZINC000584301242 344437459 /nfs/dbraw/zinc/43/74/59/344437459.db2.gz OEPIDHXVQADJMG-LLVKDONJSA-N 1 2 237.347 2.235 20 0 BEADLO CCN(C(=O)CCc1c[nH]c[nH+]1)[C@H](C)C(C)C ZINC000584301242 344437460 /nfs/dbraw/zinc/43/74/60/344437460.db2.gz OEPIDHXVQADJMG-LLVKDONJSA-N 1 2 237.347 2.235 20 0 BEADLO OCc1cc[nH+]c(N[C@H]2CC=CCC2)c1 ZINC000641385312 362385898 /nfs/dbraw/zinc/38/58/98/362385898.db2.gz NBUGVYIMLYIRPM-NSHDSACASA-N 1 2 204.273 2.095 20 0 BEADLO CC(C)[C@H](C)CNc1cc(CO)cc[nH+]1 ZINC000641387601 362386960 /nfs/dbraw/zinc/38/69/60/362386960.db2.gz GEXCKFFASMMHNK-SNVBAGLBSA-N 1 2 208.305 2.278 20 0 BEADLO O=C(CCCn1cc[nH+]c1)Nc1ccsc1 ZINC000605524305 344406826 /nfs/dbraw/zinc/40/68/26/344406826.db2.gz HCCQZUPTVSHPBJ-UHFFFAOYSA-N 1 2 235.312 2.364 20 0 BEADLO C[C@@H]([NH2+]Cc1nccs1)c1ccccn1 ZINC000041011694 344411727 /nfs/dbraw/zinc/41/17/27/344411727.db2.gz HMZOEXLVEQAOBE-SECBINFHSA-N 1 2 219.313 2.389 20 0 BEADLO CC[C@@H]([NH2+][C@H](C)C(=O)OC)c1cccs1 ZINC000042303748 344450106 /nfs/dbraw/zinc/45/01/06/344450106.db2.gz ZOSUOAUYYZFIKL-RKDXNWHRSA-N 1 2 227.329 2.350 20 0 BEADLO Cn1cc(CCC[N@H+](CC(F)F)C2CC2)cn1 ZINC000106872611 344477729 /nfs/dbraw/zinc/47/77/29/344477729.db2.gz UDJDGACPCPUHQO-UHFFFAOYSA-N 1 2 243.301 2.082 20 0 BEADLO Cn1cc(CCC[N@@H+](CC(F)F)C2CC2)cn1 ZINC000106872611 344477730 /nfs/dbraw/zinc/47/77/30/344477730.db2.gz UDJDGACPCPUHQO-UHFFFAOYSA-N 1 2 243.301 2.082 20 0 BEADLO CCc1nc([C@H](C)[NH2+]Cc2cn[nH]c2)cs1 ZINC000381473577 344510490 /nfs/dbraw/zinc/51/04/90/344510490.db2.gz POVTZXIFSNWTKW-QMMMGPOBSA-N 1 2 236.344 2.279 20 0 BEADLO CCCC[C@H]([NH2+][C@H]1CCS[C@H]1C)C(=O)OC ZINC000381551192 344520385 /nfs/dbraw/zinc/52/03/85/344520385.db2.gz MUMXOGXWTQZLRJ-DCAQKATOSA-N 1 2 245.388 2.202 20 0 BEADLO CCC1(CNc2cc(CO)cc[nH+]2)CC1 ZINC000641420208 362406220 /nfs/dbraw/zinc/40/62/20/362406220.db2.gz QYRFVVZTDCADTO-UHFFFAOYSA-N 1 2 206.289 2.176 20 0 BEADLO CCN(C[C@H]1CCOC1)c1cc[nH+]cc1F ZINC000641450953 362425830 /nfs/dbraw/zinc/42/58/30/362425830.db2.gz NERWYCXJHGACNU-SNVBAGLBSA-N 1 2 224.279 2.084 20 0 BEADLO CC(C)C[C@H](C)Nc1cc(CO)cc[nH+]1 ZINC000641457054 362430420 /nfs/dbraw/zinc/43/04/20/362430420.db2.gz NKQNGNNZEXUSBH-JTQLQIEISA-N 1 2 208.305 2.420 20 0 BEADLO CN(CCOCC1CC1)c1cc[nH+]cc1F ZINC000641430869 362413005 /nfs/dbraw/zinc/41/30/05/362413005.db2.gz ONTZVOMTWLTSBW-UHFFFAOYSA-N 1 2 224.279 2.084 20 0 BEADLO CC1(C)C[C@@H](Nc2cc[nH+]cc2F)C(C)(C)O1 ZINC000641483482 362451409 /nfs/dbraw/zinc/45/14/09/362451409.db2.gz QHVZXEOQFYZNBG-LLVKDONJSA-N 1 2 238.306 2.401 20 0 BEADLO C[C@H]1CCN(c2cc[nH+]cc2F)C[C@H]1F ZINC000641483929 362452190 /nfs/dbraw/zinc/45/21/90/362452190.db2.gz XSMYOWXPLLKMGH-WCBMZHEXSA-N 1 2 212.243 2.405 20 0 BEADLO C[C@@H]1CCN(c2cc[nH+]cc2F)C[C@@H]1F ZINC000641483928 362452349 /nfs/dbraw/zinc/45/23/49/362452349.db2.gz XSMYOWXPLLKMGH-SCZZXKLOSA-N 1 2 212.243 2.405 20 0 BEADLO Cc1cccnc1SCc1cn(C)c[nH+]1 ZINC000641483799 362452416 /nfs/dbraw/zinc/45/24/16/362452416.db2.gz FXIOMTBKNATZBL-UHFFFAOYSA-N 1 2 219.313 2.416 20 0 BEADLO Fc1c[nH+]ccc1NC[C@@H]1CCCCS1 ZINC000641487717 362454644 /nfs/dbraw/zinc/45/46/44/362454644.db2.gz NKJSZKADWTZUHD-VIFPVBQESA-N 1 2 226.320 2.340 20 0 BEADLO C[C@H]1CN(c2cc(CO)cc[nH+]2)CC(C)(C)C1 ZINC000641487445 362454840 /nfs/dbraw/zinc/45/48/40/362454840.db2.gz JXFZNJOXKSZZMV-LLVKDONJSA-N 1 2 234.343 2.446 20 0 BEADLO CO[C@@H]1CCCN(c2cc[nH+]cc2F)CC1 ZINC000641488498 362454883 /nfs/dbraw/zinc/45/48/83/362454883.db2.gz SWLGQQTWPSBARI-SNVBAGLBSA-N 1 2 224.279 2.226 20 0 BEADLO CC(C)OCCCCNc1cc[nH+]cc1F ZINC000641487430 362455478 /nfs/dbraw/zinc/45/54/78/362455478.db2.gz JRBUJTLBYIPWJP-UHFFFAOYSA-N 1 2 226.295 2.260 20 0 BEADLO COCCC(C)(C)CNc1cc[nH+]cc1F ZINC000641518447 362472259 /nfs/dbraw/zinc/47/22/59/362472259.db2.gz ZUAZBUIDGONAGO-UHFFFAOYSA-N 1 2 226.295 2.117 20 0 BEADLO CCC(C)(C)CNc1cc(CO)cc[nH+]1 ZINC000641534351 362485016 /nfs/dbraw/zinc/48/50/16/362485016.db2.gz PUJJBQKMXRCZSQ-UHFFFAOYSA-N 1 2 208.305 2.422 20 0 BEADLO FCC[C@@H]1C[N@H+](Cc2ccccc2F)CCO1 ZINC000625999489 344660964 /nfs/dbraw/zinc/66/09/64/344660964.db2.gz VEYVFORJMFHIEC-GFCCVEGCSA-N 1 2 241.281 2.386 20 0 BEADLO FCC[C@@H]1C[N@@H+](Cc2ccccc2F)CCO1 ZINC000625999489 344660965 /nfs/dbraw/zinc/66/09/65/344660965.db2.gz VEYVFORJMFHIEC-GFCCVEGCSA-N 1 2 241.281 2.386 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3c(O)cccc3C2)on1 ZINC000626025779 344678219 /nfs/dbraw/zinc/67/82/19/344678219.db2.gz LGRHOAPIOURZFI-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO Cc1cc(C[N@H+]2CCc3c(O)cccc3C2)on1 ZINC000626025779 344678222 /nfs/dbraw/zinc/67/82/22/344678222.db2.gz LGRHOAPIOURZFI-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO C[C@H]([NH2+]CC(C)(F)F)c1cncs1 ZINC000382005980 347063571 /nfs/dbraw/zinc/06/35/71/347063571.db2.gz BCBIVHDKKORHDP-LURJTMIESA-N 1 2 206.261 2.449 20 0 BEADLO CCO[C@H](C)c1nc(Cc2ccc[nH+]c2C)no1 ZINC000351231495 344734612 /nfs/dbraw/zinc/73/46/12/344734612.db2.gz JGOJTRSQCUEPBU-SNVBAGLBSA-N 1 2 247.298 2.461 20 0 BEADLO Cc1ccc(C)c(C[N@@H+](C)Cc2ncnn2C)c1 ZINC000075024879 344762978 /nfs/dbraw/zinc/76/29/78/344762978.db2.gz JMJFSGYRXJTQHG-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1ccc(C)c(C[N@H+](C)Cc2ncnn2C)c1 ZINC000075024879 344762979 /nfs/dbraw/zinc/76/29/79/344762979.db2.gz JMJFSGYRXJTQHG-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO CC(C)[C@@H](C)CC(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000075630057 344781675 /nfs/dbraw/zinc/78/16/75/344781675.db2.gz CHMXYKRRRAYGJA-RYUDHWBXSA-N 1 2 237.347 2.070 20 0 BEADLO C[C@@H]1C[NH+](Cc2noc(C(C)(C)C)n2)C[C@H]1C ZINC000076110488 344795265 /nfs/dbraw/zinc/79/52/65/344795265.db2.gz UMUIJWCZQOIKJB-NXEZZACHSA-N 1 2 237.347 2.455 20 0 BEADLO CC(C)c1nc(C[N@@H+]2C[C@H](C)[C@H](C)C2)no1 ZINC000076111821 344795654 /nfs/dbraw/zinc/79/56/54/344795654.db2.gz SOLGOSUCOWNHJM-AOOOYVTPSA-N 1 2 223.320 2.281 20 0 BEADLO CC(C)c1nc(C[N@H+]2C[C@H](C)[C@H](C)C2)no1 ZINC000076111821 344795655 /nfs/dbraw/zinc/79/56/55/344795655.db2.gz SOLGOSUCOWNHJM-AOOOYVTPSA-N 1 2 223.320 2.281 20 0 BEADLO CC1(C)COCC[N@@H+]1CCC(F)(F)F ZINC000077268984 344814402 /nfs/dbraw/zinc/81/44/02/344814402.db2.gz MYXJDXDNHZBIAL-UHFFFAOYSA-N 1 2 211.227 2.050 20 0 BEADLO CC1(C)COCC[N@H+]1CCC(F)(F)F ZINC000077268984 344814403 /nfs/dbraw/zinc/81/44/03/344814403.db2.gz MYXJDXDNHZBIAL-UHFFFAOYSA-N 1 2 211.227 2.050 20 0 BEADLO CCCC[N@@H+]1CC(=O)N[C@@H]1C1CCCCC1 ZINC000077474984 344820457 /nfs/dbraw/zinc/82/04/57/344820457.db2.gz XUFWGQQHNBTOCY-ZDUSSCGKSA-N 1 2 224.348 2.125 20 0 BEADLO CCCC[N@H+]1CC(=O)N[C@@H]1C1CCCCC1 ZINC000077474984 344820459 /nfs/dbraw/zinc/82/04/59/344820459.db2.gz XUFWGQQHNBTOCY-ZDUSSCGKSA-N 1 2 224.348 2.125 20 0 BEADLO CC(C)[C@H](C)Nc1ccc(N2CCOCC2)[nH+]c1 ZINC000037076073 534972073 /nfs/dbraw/zinc/97/20/73/534972073.db2.gz RDVZLRWSYJCMNI-LBPRGKRZSA-N 1 2 249.358 2.375 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CCCC12CC2)c1[nH+]ccn1C ZINC000628148857 344835395 /nfs/dbraw/zinc/83/53/95/344835395.db2.gz CDIRXGOOGZDPDR-GHMZBOCLSA-N 1 2 247.342 2.178 20 0 BEADLO Cc1nc(N2CCS[C@H](C)[C@@H]2C)cc[nH+]1 ZINC000078292253 344841775 /nfs/dbraw/zinc/84/17/75/344841775.db2.gz FGYCNNNLXZIFIA-DTWKUNHWSA-N 1 2 223.345 2.115 20 0 BEADLO Cc1nc(N2CCS[C@@H](C)[C@@H]2C)cc[nH+]1 ZINC000078292257 344841802 /nfs/dbraw/zinc/84/18/02/344841802.db2.gz FGYCNNNLXZIFIA-IUCAKERBSA-N 1 2 223.345 2.115 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2CCC[C@H](O)C2)c(C)[nH+]1 ZINC000336452687 178744392 /nfs/dbraw/zinc/74/43/92/178744392.db2.gz NLGOEVFADLSMMU-NEPJUHHUSA-N 1 2 248.326 2.188 20 0 BEADLO CC1(C)COCC[N@@H+]1Cc1cnc(C2CC2)o1 ZINC000628152427 344841218 /nfs/dbraw/zinc/84/12/18/344841218.db2.gz AJFDSMDVOMKQNA-UHFFFAOYSA-N 1 2 236.315 2.163 20 0 BEADLO CC1(C)COCC[N@H+]1Cc1cnc(C2CC2)o1 ZINC000628152427 344841220 /nfs/dbraw/zinc/84/12/20/344841220.db2.gz AJFDSMDVOMKQNA-UHFFFAOYSA-N 1 2 236.315 2.163 20 0 BEADLO COCC[N@H+](C)[C@@H](C)c1nc(C(C)(C)C)no1 ZINC000077409113 344823570 /nfs/dbraw/zinc/82/35/70/344823570.db2.gz VDXSAEXWMQJDPK-VIFPVBQESA-N 1 2 241.335 2.006 20 0 BEADLO COCC[N@@H+](C)[C@@H](C)c1nc(C(C)(C)C)no1 ZINC000077409113 344823571 /nfs/dbraw/zinc/82/35/71/344823571.db2.gz VDXSAEXWMQJDPK-VIFPVBQESA-N 1 2 241.335 2.006 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1cnc(C2CC2)o1 ZINC000628146068 344824920 /nfs/dbraw/zinc/82/49/20/344824920.db2.gz DBINUHGWJJGAOF-LLVKDONJSA-N 1 2 236.315 2.163 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1cnc(C2CC2)o1 ZINC000628146068 344824921 /nfs/dbraw/zinc/82/49/21/344824921.db2.gz DBINUHGWJJGAOF-LLVKDONJSA-N 1 2 236.315 2.163 20 0 BEADLO Cc1c[nH]c(CN(C)Cc2occc2C)[nH+]1 ZINC000628292099 347083720 /nfs/dbraw/zinc/08/37/20/347083720.db2.gz LAMKSSXNWSXRIR-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO CCN(CCC(F)(F)F)Cc1[nH]cc(C)[nH+]1 ZINC000628160345 344856909 /nfs/dbraw/zinc/85/69/09/344856909.db2.gz RMFWGZZJRLSYAT-UHFFFAOYSA-N 1 2 235.253 2.492 20 0 BEADLO CCCN(Cc1[nH]cc(C)[nH+]1)CC(F)F ZINC000628159983 344858888 /nfs/dbraw/zinc/85/88/88/344858888.db2.gz CTEPIPVZEYJPHP-UHFFFAOYSA-N 1 2 217.263 2.195 20 0 BEADLO Cc1cc([NH2+]CC(C)(C)O)cc(C)c1O ZINC000563009071 323079591 /nfs/dbraw/zinc/07/95/91/323079591.db2.gz HPLWGSJNGWAYBU-UHFFFAOYSA-N 1 2 209.289 2.192 20 0 BEADLO CC[C@H]1CN(c2cc[nH+]c(C)n2)CCS1 ZINC000078590633 344888048 /nfs/dbraw/zinc/88/80/48/344888048.db2.gz XHFQMGRAFSGGKW-JTQLQIEISA-N 1 2 223.345 2.117 20 0 BEADLO CC[C@@H]1CN(c2cccc[nH+]2)CCS1 ZINC000078590764 344888142 /nfs/dbraw/zinc/88/81/42/344888142.db2.gz XCMBKMODIWRBQM-SNVBAGLBSA-N 1 2 208.330 2.413 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000448890849 201768169 /nfs/dbraw/zinc/76/81/69/201768169.db2.gz NBSBKSPQZPGUAR-GRYCIOLGSA-N 1 2 247.342 2.162 20 0 BEADLO O=C(NCCNc1cccc[nH+]1)C1CCCCC1 ZINC000078761319 344903297 /nfs/dbraw/zinc/90/32/97/344903297.db2.gz QRYBWMBCWVAXKK-UHFFFAOYSA-N 1 2 247.342 2.190 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCc3ccsc3C2)n1 ZINC000628177102 344905661 /nfs/dbraw/zinc/90/56/61/344905661.db2.gz LCYHQTAZFHVEMY-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCc3ccsc3C2)n1 ZINC000628177102 344905664 /nfs/dbraw/zinc/90/56/64/344905664.db2.gz LCYHQTAZFHVEMY-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1[nH]c(CN2CCOC3(CCCC3)C2)[nH+]c1C ZINC000628182105 344925803 /nfs/dbraw/zinc/92/58/03/344925803.db2.gz DOUVBNVDVJRDSM-UHFFFAOYSA-N 1 2 249.358 2.172 20 0 BEADLO C(c1noc(C2CC2)n1)[N@@H+]1CCC2(CCC2)C1 ZINC000123251265 187295304 /nfs/dbraw/zinc/29/53/04/187295304.db2.gz DKYMNCWQWXCRID-UHFFFAOYSA-N 1 2 233.315 2.323 20 0 BEADLO C(c1noc(C2CC2)n1)[N@H+]1CCC2(CCC2)C1 ZINC000123251265 187295306 /nfs/dbraw/zinc/29/53/06/187295306.db2.gz DKYMNCWQWXCRID-UHFFFAOYSA-N 1 2 233.315 2.323 20 0 BEADLO c1nc(C2CC2)oc1C[N@@H+]1CCOC[C@@H]1C1CC1 ZINC000628184044 344930387 /nfs/dbraw/zinc/93/03/87/344930387.db2.gz XTZKXZHIHYUQPA-CYBMUJFWSA-N 1 2 248.326 2.163 20 0 BEADLO c1nc(C2CC2)oc1C[N@H+]1CCOC[C@@H]1C1CC1 ZINC000628184044 344930390 /nfs/dbraw/zinc/93/03/90/344930390.db2.gz XTZKXZHIHYUQPA-CYBMUJFWSA-N 1 2 248.326 2.163 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCS[C@H](C(C)C)C2)n1 ZINC000628188926 344941606 /nfs/dbraw/zinc/94/16/06/344941606.db2.gz MRIICAOEHPMEIA-NSHDSACASA-N 1 2 239.388 2.292 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCS[C@H](C(C)C)C2)n1 ZINC000628188926 344941608 /nfs/dbraw/zinc/94/16/08/344941608.db2.gz MRIICAOEHPMEIA-NSHDSACASA-N 1 2 239.388 2.292 20 0 BEADLO CC(C)[C@@H]1C[C@@H]1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000577071037 365803525 /nfs/dbraw/zinc/80/35/25/365803525.db2.gz IXALYUHEKREEKZ-UWVGGRQHSA-N 1 2 235.331 2.053 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@@H](C(F)F)C1 ZINC000641552571 362498156 /nfs/dbraw/zinc/49/81/56/362498156.db2.gz JLCOTAGVWBHYEY-SSDOTTSWSA-N 1 2 216.206 2.312 20 0 BEADLO Fc1c[nH+]ccc1N1CCC[C@H]1[C@@H]1CCCO1 ZINC000641560656 362500320 /nfs/dbraw/zinc/50/03/20/362500320.db2.gz FNTCRIUWYVRJOV-STQMWFEESA-N 1 2 236.290 2.369 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCOC2(CCC2)C1 ZINC000154091707 345014809 /nfs/dbraw/zinc/01/48/09/345014809.db2.gz HGPNQZMTIRAEAU-UHFFFAOYSA-N 1 2 236.315 2.046 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCOC2(CCC2)C1 ZINC000154091707 345014812 /nfs/dbraw/zinc/01/48/12/345014812.db2.gz HGPNQZMTIRAEAU-UHFFFAOYSA-N 1 2 236.315 2.046 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)/C=C/C1CC1 ZINC000079696927 345021538 /nfs/dbraw/zinc/02/15/38/345021538.db2.gz RNVDJJUTRMAUQG-BQYQJAHWSA-N 1 2 231.299 2.052 20 0 BEADLO CCO[C@@H]1CCCN(c2cc[nH+]cc2F)C1 ZINC000678787343 488282839 /nfs/dbraw/zinc/28/28/39/488282839.db2.gz KASOVPKMENCCMF-SNVBAGLBSA-N 1 2 224.279 2.226 20 0 BEADLO CO[C@H]1CCN(c2cc[nH+]cc2F)C[C@H]1C ZINC000641618399 362551810 /nfs/dbraw/zinc/55/18/10/362551810.db2.gz FZJAQUVMJXOHJE-SKDRFNHKSA-N 1 2 224.279 2.082 20 0 BEADLO CCc1noc(C)c1CNc1cc[nH+]cc1F ZINC000641611447 362546629 /nfs/dbraw/zinc/54/66/29/362546629.db2.gz UQLRRZRIHSJESX-UHFFFAOYSA-N 1 2 235.262 2.114 20 0 BEADLO COCCCCN(C)c1cc[nH+]cc1F ZINC000641639813 362567591 /nfs/dbraw/zinc/56/75/91/362567591.db2.gz YZKIYQQDLNBMQR-UHFFFAOYSA-N 1 2 212.268 2.084 20 0 BEADLO CCCCCCNC(=O)[C@@H]1CCn2cc[nH+]c2C1 ZINC000155946797 345116187 /nfs/dbraw/zinc/11/61/87/345116187.db2.gz NISLFGWTBBGNRI-GFCCVEGCSA-N 1 2 249.358 2.142 20 0 BEADLO C[C@@]12COC[C@]1(C)CN(c1cc[nH+]cc1F)C2 ZINC000641658005 362582275 /nfs/dbraw/zinc/58/22/75/362582275.db2.gz ALMBMUHNYYIMLM-BETUJISGSA-N 1 2 236.290 2.084 20 0 BEADLO C[C@@H]1C(=O)N(C)CN1c1cc(C(C)(C)C)cc[nH+]1 ZINC000641649345 362575853 /nfs/dbraw/zinc/57/58/53/362575853.db2.gz YOPMICCJLGVSSZ-SNVBAGLBSA-N 1 2 247.342 2.004 20 0 BEADLO CO[C@@H]1CCCC[C@H]1Nc1cc[nH+]cc1F ZINC000641650587 362576596 /nfs/dbraw/zinc/57/65/96/362576596.db2.gz SVPUFJJOMOFQOX-VXGBXAGGSA-N 1 2 224.279 2.012 20 0 BEADLO C[C@H](CNc1cc(CO)cc[nH+]1)c1ccccn1 ZINC000641656038 362580011 /nfs/dbraw/zinc/58/00/11/362580011.db2.gz AVJMJHSRJPYPGP-LLVKDONJSA-N 1 2 243.310 2.185 20 0 BEADLO OCc1cc[nH+]c(NCc2cnc(C3CC3)o2)c1 ZINC000641625102 362557727 /nfs/dbraw/zinc/55/77/27/362557727.db2.gz SATCISBUGWZSAD-UHFFFAOYSA-N 1 2 245.282 2.051 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1Nc1cc(CO)cc[nH+]1 ZINC000641627840 362558062 /nfs/dbraw/zinc/55/80/62/362558062.db2.gz BAWYCDKKMLKBSZ-VXGBXAGGSA-N 1 2 220.316 2.420 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1Nc1cc(CO)cc[nH+]1 ZINC000641631051 362562648 /nfs/dbraw/zinc/56/26/48/362562648.db2.gz XHKQGDDAYLEOON-AAEUAGOBSA-N 1 2 220.316 2.420 20 0 BEADLO CC[C@@H]1C[C@H]1CNc1cc(CO)cc[nH+]1 ZINC000641631420 362562969 /nfs/dbraw/zinc/56/29/69/362562969.db2.gz CDCXZJZWSUZGSC-MNOVXSKESA-N 1 2 206.289 2.032 20 0 BEADLO CC[C@H]1C[C@@H](Nc2cc[nH+]cc2F)CCO1 ZINC000641638606 362566309 /nfs/dbraw/zinc/56/63/09/362566309.db2.gz CXTRKCDACWKALR-UWVGGRQHSA-N 1 2 224.279 2.012 20 0 BEADLO OCC[C@H]1CCCN(c2cc[nH+]cc2F)CC1 ZINC000641637982 362566530 /nfs/dbraw/zinc/56/65/30/362566530.db2.gz UBXKIVCNENRJGF-NSHDSACASA-N 1 2 238.306 2.210 20 0 BEADLO COc1cccc(C[NH2+]Cc2ccon2)c1C ZINC000634987148 345173244 /nfs/dbraw/zinc/17/32/44/345173244.db2.gz NMKIHHVIVAUHAP-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO CCc1noc(CC)c1C[NH2+]Cc1ccon1 ZINC000634968286 345143936 /nfs/dbraw/zinc/14/39/36/345143936.db2.gz KVGPFCCRCKEBNQ-UHFFFAOYSA-N 1 2 235.287 2.077 20 0 BEADLO c1cc(C[NH2+]Cc2ccc3c(n2)CCCC3)no1 ZINC000634978459 345156146 /nfs/dbraw/zinc/15/61/46/345156146.db2.gz CVUFUIUCCJLOEE-UHFFFAOYSA-N 1 2 243.310 2.238 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1CC(C)(C)C[C@@H]1C ZINC000579978006 345224726 /nfs/dbraw/zinc/22/47/26/345224726.db2.gz NDGGUEUEINYQEI-QWRGUYRKSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1CC(C)(C)C[C@@H]1C ZINC000579978006 345224727 /nfs/dbraw/zinc/22/47/27/345224727.db2.gz NDGGUEUEINYQEI-QWRGUYRKSA-N 1 2 249.358 2.235 20 0 BEADLO C/C=C/C[S@](=O)Cc1cn2c(cccc2C)[nH+]1 ZINC000155219542 187301098 /nfs/dbraw/zinc/30/10/98/187301098.db2.gz DEMNAVVUZRREGQ-REMYHPOOSA-N 1 2 248.351 2.468 20 0 BEADLO CCc1c[nH]c(CC(=O)N2C[C@@H](C)C[C@H](C)C2)[nH+]1 ZINC000635066247 345238039 /nfs/dbraw/zinc/23/80/39/345238039.db2.gz ZPWKETHZBGDFBS-QWRGUYRKSA-N 1 2 249.358 2.019 20 0 BEADLO CC(C)=C(C)CC(=O)NCCCn1cc[nH+]c1 ZINC000635066749 345238693 /nfs/dbraw/zinc/23/86/93/345238693.db2.gz CKLPFYHNSVAXGH-UHFFFAOYSA-N 1 2 235.331 2.136 20 0 BEADLO C[C@@H]1C[C@@H](C)CN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635066570 345238908 /nfs/dbraw/zinc/23/89/08/345238908.db2.gz ZQOZRMFFNAZIEL-DDHJBXDOSA-N 1 2 247.342 2.018 20 0 BEADLO C[C@@H]1C[C@@H](C)CN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635066570 345238912 /nfs/dbraw/zinc/23/89/12/345238912.db2.gz ZQOZRMFFNAZIEL-DDHJBXDOSA-N 1 2 247.342 2.018 20 0 BEADLO CCc1c[nH]c(CC(=O)NCC2CCCCC2)[nH+]1 ZINC000635069350 345239371 /nfs/dbraw/zinc/23/93/71/345239371.db2.gz QORFKQZEHXKIEB-UHFFFAOYSA-N 1 2 249.358 2.211 20 0 BEADLO Cc1cc(N[C@@H]2CC23CC3)nc(C(C)C)[nH+]1 ZINC000425271759 192087238 /nfs/dbraw/zinc/08/72/38/192087238.db2.gz JJLKLNYMFAYCSE-SNVBAGLBSA-N 1 2 217.316 2.295 20 0 BEADLO CCC(O)(CC)C[N@H+](C)[C@@H](C)c1csnn1 ZINC000626112160 345278793 /nfs/dbraw/zinc/27/87/93/345278793.db2.gz PDSUMKFIXIUECF-VIFPVBQESA-N 1 2 243.376 2.082 20 0 BEADLO CCC(O)(CC)C[N@@H+](C)[C@@H](C)c1csnn1 ZINC000626112160 345278794 /nfs/dbraw/zinc/27/87/94/345278794.db2.gz PDSUMKFIXIUECF-VIFPVBQESA-N 1 2 243.376 2.082 20 0 BEADLO CCCCN(C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C1CC1 ZINC000635234610 345280217 /nfs/dbraw/zinc/28/02/17/345280217.db2.gz YMHXRZHAZDAGNJ-VXGBXAGGSA-N 1 2 247.342 2.304 20 0 BEADLO CCCCN(C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C1CC1 ZINC000635234610 345280220 /nfs/dbraw/zinc/28/02/20/345280220.db2.gz YMHXRZHAZDAGNJ-VXGBXAGGSA-N 1 2 247.342 2.304 20 0 BEADLO CCN(CC(C)C)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635248090 345284374 /nfs/dbraw/zinc/28/43/74/345284374.db2.gz CWZSRMZPOKRITE-GHMZBOCLSA-N 1 2 235.331 2.018 20 0 BEADLO CCN(CC(C)C)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635248090 345284377 /nfs/dbraw/zinc/28/43/77/345284377.db2.gz CWZSRMZPOKRITE-GHMZBOCLSA-N 1 2 235.331 2.018 20 0 BEADLO CC(C)C[C@@H](C(=O)N(C)C1CC1)n1cc[nH+]c1 ZINC000635263521 345290698 /nfs/dbraw/zinc/29/06/98/345290698.db2.gz QANDMHFQUOSHRW-LBPRGKRZSA-N 1 2 235.331 2.091 20 0 BEADLO CC(C)N(CC1CC1)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635268820 345291431 /nfs/dbraw/zinc/29/14/31/345291431.db2.gz DBXGYBFXOVAOBY-VXGBXAGGSA-N 1 2 247.342 2.160 20 0 BEADLO CC(C)N(CC1CC1)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635268820 345291434 /nfs/dbraw/zinc/29/14/34/345291434.db2.gz DBXGYBFXOVAOBY-VXGBXAGGSA-N 1 2 247.342 2.160 20 0 BEADLO CCC[C@H](C)N(C)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635281416 345293733 /nfs/dbraw/zinc/29/37/33/345293733.db2.gz ZAXSZCAVZNTPSS-HBNTYKKESA-N 1 2 235.331 2.160 20 0 BEADLO CCC[C@H](C)N(C)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635281416 345293735 /nfs/dbraw/zinc/29/37/35/345293735.db2.gz ZAXSZCAVZNTPSS-HBNTYKKESA-N 1 2 235.331 2.160 20 0 BEADLO CC[C@@H]([NH2+]Cc1sccc1C)C(=O)OC ZINC000168386764 345312704 /nfs/dbraw/zinc/31/27/04/345312704.db2.gz FOIAZIYNXNIUED-SECBINFHSA-N 1 2 227.329 2.098 20 0 BEADLO CC1(C)CCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)CC1 ZINC000635478466 345388353 /nfs/dbraw/zinc/38/83/53/345388353.db2.gz KRGGXNBICVJQKH-GHMZBOCLSA-N 1 2 247.342 2.162 20 0 BEADLO CC1(C)CCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)CC1 ZINC000635478466 345388357 /nfs/dbraw/zinc/38/83/57/345388357.db2.gz KRGGXNBICVJQKH-GHMZBOCLSA-N 1 2 247.342 2.162 20 0 BEADLO CC(C)C[C@@H](C(=O)Nc1cnoc1)n1cc[nH+]c1 ZINC000635463485 345380789 /nfs/dbraw/zinc/38/07/89/345380789.db2.gz PCCROOZKIKDWLA-NSHDSACASA-N 1 2 248.286 2.097 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635512415 345409276 /nfs/dbraw/zinc/40/92/76/345409276.db2.gz RIORMTVGAUMNGP-DDHJBXDOSA-N 1 2 247.342 2.303 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635512415 345409277 /nfs/dbraw/zinc/40/92/77/345409277.db2.gz RIORMTVGAUMNGP-DDHJBXDOSA-N 1 2 247.342 2.303 20 0 BEADLO C[C@H](CO)[N@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000159129932 345411582 /nfs/dbraw/zinc/41/15/82/345411582.db2.gz HFODGIHNSZQQLH-SECBINFHSA-N 1 2 242.388 2.253 20 0 BEADLO C[C@H](CO)[N@@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000159129932 345411586 /nfs/dbraw/zinc/41/15/86/345411586.db2.gz HFODGIHNSZQQLH-SECBINFHSA-N 1 2 242.388 2.253 20 0 BEADLO Cc1c[nH+]cc(N[C@H](C)CCn2cccn2)c1 ZINC000159332114 345425197 /nfs/dbraw/zinc/42/51/97/345425197.db2.gz QKYACOVWBPXYRI-GFCCVEGCSA-N 1 2 230.315 2.477 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccn(C)c2)s1 ZINC000135000510 345428855 /nfs/dbraw/zinc/42/88/55/345428855.db2.gz GSQROYWUBPZDCM-MRVPVSSYSA-N 1 2 236.344 2.036 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)NC[C@@H](C)Cn1cc[nH+]c1 ZINC000081801802 345492701 /nfs/dbraw/zinc/49/27/01/345492701.db2.gz UWUBHNOLHWKVFF-JHJVBQTASA-N 1 2 249.358 2.072 20 0 BEADLO O=C(CC1CCCC1)NCCCCn1cc[nH+]c1 ZINC000082269350 345500131 /nfs/dbraw/zinc/50/01/31/345500131.db2.gz XIOOUBAPYWTJPF-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO Cn1cc[nH+]c1[C@H](NC(=O)C1CCCC1)C1CC1 ZINC000082278151 345501337 /nfs/dbraw/zinc/50/13/37/345501337.db2.gz HTHXJHBSWPPPSF-GFCCVEGCSA-N 1 2 247.342 2.178 20 0 BEADLO CC(C)(Nc1cc(C2CC2)ncn1)c1[nH]cc[nH+]1 ZINC000641664716 362588575 /nfs/dbraw/zinc/58/85/75/362588575.db2.gz LFWPHRZJJMRZEO-UHFFFAOYSA-N 1 2 243.314 2.424 20 0 BEADLO CCC[C@H](CNc1cc(CO)cc[nH+]1)OCC ZINC000641676108 362596386 /nfs/dbraw/zinc/59/63/86/362596386.db2.gz IYZWXCSWMVCKNJ-GFCCVEGCSA-N 1 2 238.331 2.191 20 0 BEADLO CCC(O)(CC)CNc1[nH+]c(C)nc2[nH]ccc21 ZINC000080970675 345456478 /nfs/dbraw/zinc/45/64/78/345456478.db2.gz OPCPYBZWUDNNFW-UHFFFAOYSA-N 1 2 248.330 2.229 20 0 BEADLO CC1(C)CCN1Cc1[nH+]ccn1CC(F)(F)F ZINC000081063410 345460899 /nfs/dbraw/zinc/46/08/99/345460899.db2.gz OWJRXXHXSYDMKU-UHFFFAOYSA-N 1 2 247.264 2.430 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H](CCO)C(C)C)[nH+]1 ZINC000081019253 345461503 /nfs/dbraw/zinc/46/15/03/345461503.db2.gz XAGIDPMNLGKAIV-NSHDSACASA-N 1 2 248.330 2.085 20 0 BEADLO CC(C)[C@@H](CO)Nc1cc[nH+]c2ccncc12 ZINC000085704199 345528531 /nfs/dbraw/zinc/52/85/31/345528531.db2.gz AXELACLUZSHNBS-CYBMUJFWSA-N 1 2 231.299 2.059 20 0 BEADLO CC(C)(CCO)CNc1cc[nH+]c2ccncc12 ZINC000085688902 345528553 /nfs/dbraw/zinc/52/85/53/345528553.db2.gz FRSBSBPVRXAATL-UHFFFAOYSA-N 1 2 245.326 2.450 20 0 BEADLO CN(C[C@H]1CCCO1)c1cc[nH+]c2ccncc21 ZINC000085661187 345528862 /nfs/dbraw/zinc/52/88/62/345528862.db2.gz GVEAIZXAXAKFBK-LLVKDONJSA-N 1 2 243.310 2.245 20 0 BEADLO CCc1c[nH]c(CC(=O)NCC2(C)CCCC2)[nH+]1 ZINC000635541905 345534325 /nfs/dbraw/zinc/53/43/25/345534325.db2.gz UNEPYJRKZDSNTE-UHFFFAOYSA-N 1 2 249.358 2.211 20 0 BEADLO O=C(C=C1CCC1)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000087275908 345541305 /nfs/dbraw/zinc/54/13/05/345541305.db2.gz JYDZLKOABURHOH-LBPRGKRZSA-N 1 2 245.326 2.226 20 0 BEADLO C[C@H](CCCO)Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000088758197 345545450 /nfs/dbraw/zinc/54/54/50/345545450.db2.gz GYYNDEFVSBKALW-SNVBAGLBSA-N 1 2 237.347 2.347 20 0 BEADLO COc1ccsc1C[N@@H+]1C[C@@H](C)OC[C@H]1C ZINC000092017414 345614344 /nfs/dbraw/zinc/61/43/44/345614344.db2.gz WYRHBEDYBJQTJB-NXEZZACHSA-N 1 2 241.356 2.366 20 0 BEADLO COc1ccsc1C[N@H+]1C[C@@H](C)OC[C@H]1C ZINC000092017414 345614347 /nfs/dbraw/zinc/61/43/47/345614347.db2.gz WYRHBEDYBJQTJB-NXEZZACHSA-N 1 2 241.356 2.366 20 0 BEADLO Cc1cc(C)c(NC(=O)[C@H]2CCO[C@@H]2C)c(C)[nH+]1 ZINC000092303425 345628437 /nfs/dbraw/zinc/62/84/37/345628437.db2.gz SQDBBTRMFFBRPB-NEPJUHHUSA-N 1 2 248.326 2.370 20 0 BEADLO Cc1ocnc1CNc1[nH+]c(C)nc2[nH]ccc21 ZINC000092689674 345636190 /nfs/dbraw/zinc/63/61/90/345636190.db2.gz QUWZJQHCBWGGEW-UHFFFAOYSA-N 1 2 243.270 2.175 20 0 BEADLO COCc1cc(C[NH2+][C@@H](C)c2ccccn2)no1 ZINC000641701262 362614326 /nfs/dbraw/zinc/61/43/26/362614326.db2.gz RBGIHRMIKIATLB-JTQLQIEISA-N 1 2 247.298 2.067 20 0 BEADLO Cc1ccoc1C[N@@H+](C)[C@H](C)C(=O)OC(C)C ZINC000093773249 345664239 /nfs/dbraw/zinc/66/42/39/345664239.db2.gz GUXZXJCDPSUJFJ-LLVKDONJSA-N 1 2 239.315 2.360 20 0 BEADLO Cc1ccoc1C[N@H+](C)[C@H](C)C(=O)OC(C)C ZINC000093773249 345664243 /nfs/dbraw/zinc/66/42/43/345664243.db2.gz GUXZXJCDPSUJFJ-LLVKDONJSA-N 1 2 239.315 2.360 20 0 BEADLO c1ncc(C[N@@H+]2CCOCC23CCCC3)s1 ZINC000093840541 345665330 /nfs/dbraw/zinc/66/53/30/345665330.db2.gz ROUJZZMKNQCBOI-UHFFFAOYSA-N 1 2 238.356 2.288 20 0 BEADLO c1ncc(C[N@H+]2CCOCC23CCCC3)s1 ZINC000093840541 345665332 /nfs/dbraw/zinc/66/53/32/345665332.db2.gz ROUJZZMKNQCBOI-UHFFFAOYSA-N 1 2 238.356 2.288 20 0 BEADLO CCc1nsc(Nc2ccc(NC)[nH+]c2)n1 ZINC000092612341 345641615 /nfs/dbraw/zinc/64/16/15/345641615.db2.gz PSUTZDMSPHPYAV-UHFFFAOYSA-N 1 2 235.316 2.281 20 0 BEADLO OCc1cc[nH+]c(N[C@@H]2CCCC23CC3)c1 ZINC000641680497 362602224 /nfs/dbraw/zinc/60/22/24/362602224.db2.gz RLQVRWAXBBSGIV-LLVKDONJSA-N 1 2 218.300 2.319 20 0 BEADLO CCOc1ccn(Cc2ccc(C)[nH+]c2C)n1 ZINC000641729535 362643195 /nfs/dbraw/zinc/64/31/95/362643195.db2.gz FYSZCTWJZVHHNH-UHFFFAOYSA-N 1 2 231.299 2.342 20 0 BEADLO CCOc1ccn(Cc2c[nH+]ccc2C)n1 ZINC000641729559 362644601 /nfs/dbraw/zinc/64/46/01/362644601.db2.gz GXEMDCNBIMKLLR-UHFFFAOYSA-N 1 2 217.272 2.034 20 0 BEADLO CC(C)c1cc(C[NH2+]Cc2ccncc2N)on1 ZINC000641721449 362637371 /nfs/dbraw/zinc/63/73/71/362637371.db2.gz CYWOEDOLTWJRDD-UHFFFAOYSA-N 1 2 246.314 2.065 20 0 BEADLO CCCN(CCC)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000139889813 345699256 /nfs/dbraw/zinc/69/92/56/345699256.db2.gz CFOJHMYJYVMSHJ-WAYWQWQTSA-N 1 2 221.304 2.072 20 0 BEADLO CC(C)C1CCN(C(=O)CCn2cc[nH+]c2)CC1 ZINC000141425512 345702941 /nfs/dbraw/zinc/70/29/41/345702941.db2.gz NRQROFFLNXQHFT-UHFFFAOYSA-N 1 2 249.358 2.168 20 0 BEADLO CC(=O)Nc1ccc(-c2[nH+]ccn2C)cc1 ZINC000082735566 345715543 /nfs/dbraw/zinc/71/55/43/345715543.db2.gz ZWDLNUPSZBNVCR-UHFFFAOYSA-N 1 2 215.256 2.046 20 0 BEADLO CC(C)c1nc(NC[C@@H]2CC23CC3)cc[nH+]1 ZINC000418984936 192090846 /nfs/dbraw/zinc/09/08/46/192090846.db2.gz DTICJQKDYUVDFG-JTQLQIEISA-N 1 2 217.316 2.234 20 0 BEADLO O=C(C1CCCC1)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000138694544 345782912 /nfs/dbraw/zinc/78/29/12/345782912.db2.gz HVRGXMJTCUNIJT-UHFFFAOYSA-N 1 2 247.342 2.306 20 0 BEADLO O=C(C1CCCC1)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000138694544 345782914 /nfs/dbraw/zinc/78/29/14/345782914.db2.gz HVRGXMJTCUNIJT-UHFFFAOYSA-N 1 2 247.342 2.306 20 0 BEADLO CCCCCCNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000138977874 345790827 /nfs/dbraw/zinc/79/08/27/345790827.db2.gz VDLMLGGXSKULHH-VOTSOKGWSA-N 1 2 221.304 2.119 20 0 BEADLO CC=CC=CC(=O)NNc1cc[nH+]cc1Cl ZINC000135895402 345793556 /nfs/dbraw/zinc/79/35/56/345793556.db2.gz KHSVVZAIYNPXKX-MQQKCMAXSA-N 1 2 237.690 2.310 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1CCC1(C)C ZINC000668419963 537912756 /nfs/dbraw/zinc/91/27/56/537912756.db2.gz QVBPGRBXPJXIQM-JTQLQIEISA-N 1 2 218.300 2.187 20 0 BEADLO CC[C@@H](C)C[C@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635614746 345893993 /nfs/dbraw/zinc/89/39/93/345893993.db2.gz FHJKIRMOGMZQRQ-WRWGMCAJSA-N 1 2 249.358 2.454 20 0 BEADLO CC[C@@H](C)C[C@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635614746 345893997 /nfs/dbraw/zinc/89/39/97/345893997.db2.gz FHJKIRMOGMZQRQ-WRWGMCAJSA-N 1 2 249.358 2.454 20 0 BEADLO CCc1noc(C)c1C[N@@H+]1CCO[C@@H](C)[C@H]1C ZINC000335918937 345874809 /nfs/dbraw/zinc/87/48/09/345874809.db2.gz KEOUOBOXAWGPEU-ZJUUUORDSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1noc(C)c1C[N@H+]1CCO[C@@H](C)[C@H]1C ZINC000335918937 345874812 /nfs/dbraw/zinc/87/48/12/345874812.db2.gz KEOUOBOXAWGPEU-ZJUUUORDSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1c[nH]c(CC(=O)N(C(C)C)C2CCC2)[nH+]1 ZINC000635594577 345881023 /nfs/dbraw/zinc/88/10/23/345881023.db2.gz AZAQDWUCZBYGQF-UHFFFAOYSA-N 1 2 249.358 2.304 20 0 BEADLO Cc1cn2ccc(C(=O)NCC3(C)CC3)cc2[nH+]1 ZINC000635647645 345924793 /nfs/dbraw/zinc/92/47/93/345924793.db2.gz VZWFLGDIWPLLAK-UHFFFAOYSA-N 1 2 243.310 2.173 20 0 BEADLO CC[C@@](C)(C[NH2+][C@H](C)C(=O)OC(C)(C)C)OC ZINC000322639999 345957011 /nfs/dbraw/zinc/95/70/11/345957011.db2.gz UBSNZAJVLCEXEF-MFKMUULPSA-N 1 2 245.363 2.121 20 0 BEADLO Cc1csc(C[NH2+]Cc2oc(C)nc2C)n1 ZINC000311671937 345961309 /nfs/dbraw/zinc/96/13/09/345961309.db2.gz JNHDBVBOXSNNBK-UHFFFAOYSA-N 1 2 237.328 2.346 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@@H]2CCC[C@H]2CC)[nH+]1 ZINC000635676943 345972571 /nfs/dbraw/zinc/97/25/71/345972571.db2.gz OQQZNZUUHZVPDD-ZYHUDNBSSA-N 1 2 249.358 2.210 20 0 BEADLO CCCC1(CNC(=O)Cc2[nH]cc(CC)[nH+]2)CC1 ZINC000635685609 345978213 /nfs/dbraw/zinc/97/82/13/345978213.db2.gz PKEHVZAVDCAXBH-UHFFFAOYSA-N 1 2 249.358 2.211 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@@H](C)CC(C)C)[nH+]1 ZINC000635722262 346030510 /nfs/dbraw/zinc/03/05/10/346030510.db2.gz GFWYRYUTWSARSD-JTQLQIEISA-N 1 2 237.347 2.065 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CC[C@@H](C)[C@@H]2CC)[nH+]1 ZINC000635816177 346072269 /nfs/dbraw/zinc/07/22/69/346072269.db2.gz LHUFTGRMKMGUAK-PWSUYJOCSA-N 1 2 249.358 2.162 20 0 BEADLO CC(C)C[C@@H](C(=O)N1[C@H](C)C[C@@H]1C)n1cc[nH+]c1 ZINC000635876005 346095919 /nfs/dbraw/zinc/09/59/19/346095919.db2.gz SLOYKRHAFSLZGX-XQQFMLRXSA-N 1 2 249.358 2.480 20 0 BEADLO CCc1c[nH]c(CC(=O)NC[C@H]2CCC[C@H]2C)[nH+]1 ZINC000635893201 346104260 /nfs/dbraw/zinc/10/42/60/346104260.db2.gz MNKFBACTUAPSOI-GHMZBOCLSA-N 1 2 249.358 2.067 20 0 BEADLO Cc1cn2ccc(C(=O)N3C[C@H](C)[C@H]3C)cc2[nH+]1 ZINC000635966534 346125999 /nfs/dbraw/zinc/12/59/99/346125999.db2.gz RBUCDNOEHIHTCG-GXSJLCMTSA-N 1 2 243.310 2.123 20 0 BEADLO CCc1c[nH]c(CC(=O)N2C[C@H](C)[C@H](C)[C@@H]2C)[nH+]1 ZINC000636033735 346169810 /nfs/dbraw/zinc/16/98/10/346169810.db2.gz DJSNFWCQGKBDNS-DCAQKATOSA-N 1 2 249.358 2.018 20 0 BEADLO CCCC[C@H](CC)c1nc(C[NH2+]C)no1 ZINC000051848757 346152165 /nfs/dbraw/zinc/15/21/65/346152165.db2.gz AAHXGKACETZWBG-VIFPVBQESA-N 1 2 211.309 2.473 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@H]2C[C@@]2(C)C(C)C)[nH+]1 ZINC000636018275 346157320 /nfs/dbraw/zinc/15/73/20/346157320.db2.gz KRPMKQWCGREWSQ-FZMZJTMJSA-N 1 2 249.358 2.065 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@@H]2C[C@]2(C)C(C)C)[nH+]1 ZINC000636018274 346157408 /nfs/dbraw/zinc/15/74/08/346157408.db2.gz KRPMKQWCGREWSQ-BXUZGUMPSA-N 1 2 249.358 2.065 20 0 BEADLO CCc1c[nH]c(CC(=O)N(C)C2CC(C)(C)C2)[nH+]1 ZINC000636018912 346157890 /nfs/dbraw/zinc/15/78/90/346157890.db2.gz FQPWAZSJTPDYET-UHFFFAOYSA-N 1 2 249.358 2.162 20 0 BEADLO Cc1[nH]c(CN(CCO)c2ccccc2)[nH+]c1C ZINC000628247320 346214953 /nfs/dbraw/zinc/21/49/53/346214953.db2.gz WGNFXXGGBLDSEA-UHFFFAOYSA-N 1 2 245.326 2.025 20 0 BEADLO Cc1cc(C(=O)NC[C@@H]2C[C@H]2C)c2[nH+]ccn2c1 ZINC000624108353 346207420 /nfs/dbraw/zinc/20/74/20/346207420.db2.gz RIJTWLGRYBELPQ-MNOVXSKESA-N 1 2 243.310 2.029 20 0 BEADLO FC1(F)CC[N@H+](Cc2cccc3n[nH]cc32)C1 ZINC000628232155 346184475 /nfs/dbraw/zinc/18/44/75/346184475.db2.gz NZKFNKXNCHVUJR-UHFFFAOYSA-N 1 2 237.253 2.404 20 0 BEADLO FC1(F)CC[N@@H+](Cc2cccc3n[nH]cc32)C1 ZINC000628232155 346184478 /nfs/dbraw/zinc/18/44/78/346184478.db2.gz NZKFNKXNCHVUJR-UHFFFAOYSA-N 1 2 237.253 2.404 20 0 BEADLO CCN(Cc1[nH]c(C)c(C)[nH+]1)CC(F)F ZINC000628238294 346195010 /nfs/dbraw/zinc/19/50/10/346195010.db2.gz SQTCIAFMWXGTAQ-UHFFFAOYSA-N 1 2 217.263 2.114 20 0 BEADLO C[C@H](O)C[N@H+](C)Cc1c(F)ccc(F)c1Cl ZINC000628238234 346195197 /nfs/dbraw/zinc/19/51/97/346195197.db2.gz QTARIDCQMKDEAB-ZETCQYMHSA-N 1 2 249.688 2.431 20 0 BEADLO C[C@H](O)C[N@@H+](C)Cc1c(F)ccc(F)c1Cl ZINC000628238234 346195199 /nfs/dbraw/zinc/19/51/99/346195199.db2.gz QTARIDCQMKDEAB-ZETCQYMHSA-N 1 2 249.688 2.431 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2cnc(C)o2)cn1 ZINC000628238127 346195442 /nfs/dbraw/zinc/19/54/42/346195442.db2.gz MDYSZQZINVNZAC-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2cnc(C)o2)cn1 ZINC000628238127 346195446 /nfs/dbraw/zinc/19/54/46/346195446.db2.gz MDYSZQZINVNZAC-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO Nc1[nH+]cccc1CSC[C@H]1CCCO1 ZINC000236372365 346231578 /nfs/dbraw/zinc/23/15/78/346231578.db2.gz YCUFNXPJBGXPJG-SNVBAGLBSA-N 1 2 224.329 2.076 20 0 BEADLO Cn1ncc2c1nc[nH+]c2N[C@]12C[C@H]1CCCC2 ZINC000631475269 346219529 /nfs/dbraw/zinc/21/95/29/346219529.db2.gz JRQHZNZRMKXGKO-NOZJJQNGSA-N 1 2 243.314 2.108 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)n1 ZINC000628255608 346249127 /nfs/dbraw/zinc/24/91/27/346249127.db2.gz SEWHQYGTIWKAQU-IUCAKERBSA-N 1 2 247.264 2.491 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)n1 ZINC000628255608 346249130 /nfs/dbraw/zinc/24/91/30/346249130.db2.gz SEWHQYGTIWKAQU-IUCAKERBSA-N 1 2 247.264 2.491 20 0 BEADLO Cc1[nH]c(CN2C[C@@H](C)O[C@@H](C3CC3)C2)[nH+]c1C ZINC000628255463 346249285 /nfs/dbraw/zinc/24/92/85/346249285.db2.gz NPQYSUWMNXGOGA-NOZJJQNGSA-N 1 2 249.358 2.026 20 0 BEADLO Cc1c[nH]c(CN(C)Cc2cnccc2C)[nH+]1 ZINC000628256030 346253315 /nfs/dbraw/zinc/25/33/15/346253315.db2.gz GKVFLDQPWWLTOF-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO C/C=C\C[C@H]([NH2+]C1CC(C)C1)C(=O)OCC ZINC000336781257 187317490 /nfs/dbraw/zinc/31/74/90/187317490.db2.gz UEVIXANQVTYDQS-LYJAQFADSA-N 1 2 225.332 2.272 20 0 BEADLO CCN(Cc1[nH]cc(C)[nH+]1)Cc1ccncc1 ZINC000628277180 346286163 /nfs/dbraw/zinc/28/61/63/346286163.db2.gz GPAYXPGCMOSOHF-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CC[N@H+](Cc1nc(C)c[nH]1)Cc1ccncc1 ZINC000628277180 346286166 /nfs/dbraw/zinc/28/61/66/346286166.db2.gz GPAYXPGCMOSOHF-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CC[N@@H+](Cc1nc(C)c[nH]1)Cc1ccncc1 ZINC000628277180 346286168 /nfs/dbraw/zinc/28/61/68/346286168.db2.gz GPAYXPGCMOSOHF-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO COc1cc(C)[nH+]c(CNCC(C)(F)F)c1 ZINC000382034607 347089724 /nfs/dbraw/zinc/08/97/24/347089724.db2.gz VNRPRKBZEBAQAX-UHFFFAOYSA-N 1 2 230.258 2.143 20 0 BEADLO C/C=C\C[C@H]1CCC[N@H+](CCc2cnn[nH]2)C1 ZINC000626164606 346271763 /nfs/dbraw/zinc/27/17/63/346271763.db2.gz LTIWNTKHJUZUSF-DLGQBQFBSA-N 1 2 234.347 2.025 20 0 BEADLO C/C=C\C[C@H]1CCC[N@@H+](CCc2cnn[nH]2)C1 ZINC000626164606 346271764 /nfs/dbraw/zinc/27/17/64/346271764.db2.gz LTIWNTKHJUZUSF-DLGQBQFBSA-N 1 2 234.347 2.025 20 0 BEADLO Cc1c[nH]c(C[N@@H+](C)Cc2ccc(O)cc2)n1 ZINC000628280020 346290687 /nfs/dbraw/zinc/29/06/87/346290687.db2.gz LVGDKZANJOZXPJ-UHFFFAOYSA-N 1 2 231.299 2.056 20 0 BEADLO Cc1c[nH]c(C[N@H+](C)Cc2ccc(O)cc2)n1 ZINC000628280020 346290693 /nfs/dbraw/zinc/29/06/93/346290693.db2.gz LVGDKZANJOZXPJ-UHFFFAOYSA-N 1 2 231.299 2.056 20 0 BEADLO Cc1cccc(C)c1NC(=O)NCc1[nH]cc[nH+]1 ZINC000119509473 179040324 /nfs/dbraw/zinc/04/03/24/179040324.db2.gz SQMRWJSIEBNPAM-UHFFFAOYSA-N 1 2 244.298 2.348 20 0 BEADLO Cc1[nH]c(CNCc2ccc(C)cn2)[nH+]c1C ZINC000641764385 362695635 /nfs/dbraw/zinc/69/56/35/362695635.db2.gz HEOLFFZQHXLQFQ-UHFFFAOYSA-N 1 2 230.315 2.020 20 0 BEADLO Cc1nc(C[NH2+]Cc2ccc(C)cn2)[nH]c1C ZINC000641764385 362695640 /nfs/dbraw/zinc/69/56/40/362695640.db2.gz HEOLFFZQHXLQFQ-UHFFFAOYSA-N 1 2 230.315 2.020 20 0 BEADLO COc1ccc[nH+]c1NCCc1nccs1 ZINC000160232712 346357942 /nfs/dbraw/zinc/35/79/42/346357942.db2.gz NRVDIZZKWUTIRA-UHFFFAOYSA-N 1 2 235.312 2.201 20 0 BEADLO CC[C@@H](O)COc1ccc(-n2cc[nH+]c2)cc1 ZINC000156977610 346375100 /nfs/dbraw/zinc/37/51/00/346375100.db2.gz JXZRQOPFXVRCBH-GFCCVEGCSA-N 1 2 232.283 2.022 20 0 BEADLO CCCC[C@@H]([NH2+]CC[C@H](C)F)C(=O)OC ZINC000419171069 192101805 /nfs/dbraw/zinc/10/18/05/192101805.db2.gz IIEYEIZBKDXVRV-VHSXEESVSA-N 1 2 219.300 2.056 20 0 BEADLO CCCC[C@@H]([NH2+]CC[C@@H](C)F)C(=O)OC ZINC000419171066 192101225 /nfs/dbraw/zinc/10/12/25/192101225.db2.gz IIEYEIZBKDXVRV-NXEZZACHSA-N 1 2 219.300 2.056 20 0 BEADLO CCN(CCSC)c1cc[nH+]cc1F ZINC000603406527 349957236 /nfs/dbraw/zinc/95/72/36/349957236.db2.gz MYDPJLSSUQMUJQ-UHFFFAOYSA-N 1 2 214.309 2.410 20 0 BEADLO C[C@@H]1CC[N@H+](CCOCC(F)(F)F)C[C@H]1F ZINC000679217492 488317307 /nfs/dbraw/zinc/31/73/07/488317307.db2.gz GBIOBCNKBHBZAX-RKDXNWHRSA-N 1 2 243.244 2.245 20 0 BEADLO C[C@@H]1CC[N@@H+](CCOCC(F)(F)F)C[C@H]1F ZINC000679217492 488317308 /nfs/dbraw/zinc/31/73/08/488317308.db2.gz GBIOBCNKBHBZAX-RKDXNWHRSA-N 1 2 243.244 2.245 20 0 BEADLO CCc1nnc(C[NH2+][C@@H](C)c2ccsc2)[nH]1 ZINC000282449333 346404308 /nfs/dbraw/zinc/40/43/08/346404308.db2.gz IQXQUKUKYOFQBN-QMMMGPOBSA-N 1 2 236.344 2.279 20 0 BEADLO COc1cc([C@H](C)[NH2+][C@H](C)C(F)F)ccn1 ZINC000641792466 362727301 /nfs/dbraw/zinc/72/73/01/362727301.db2.gz VUXDNCGOSMFGHM-JGVFFNPUSA-N 1 2 230.258 2.394 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CC[C@@H](C)[C@@H](F)C2)o1 ZINC000679219244 488318641 /nfs/dbraw/zinc/31/86/41/488318641.db2.gz FMQIKBQNHNWOPQ-WEDXCCLWSA-N 1 2 227.283 2.119 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CC[C@@H](C)[C@@H](F)C2)o1 ZINC000679219244 488318643 /nfs/dbraw/zinc/31/86/43/488318643.db2.gz FMQIKBQNHNWOPQ-WEDXCCLWSA-N 1 2 227.283 2.119 20 0 BEADLO C[C@@H]([NH2+]Cc1ccc2nccnc2c1)C(F)F ZINC000641794022 362732943 /nfs/dbraw/zinc/73/29/43/362732943.db2.gz JHYNOAWTFXTANF-MRVPVSSYSA-N 1 2 237.253 2.373 20 0 BEADLO CC(=O)Nc1cccc(C[NH2+][C@@H](C)C(F)F)c1 ZINC000641794342 362734357 /nfs/dbraw/zinc/73/43/57/362734357.db2.gz NDRAQADSUGTZNW-QMMMGPOBSA-N 1 2 242.269 2.388 20 0 BEADLO Cc1ccc2[nH+]cc(CN[C@@H](C)C(F)F)n2c1 ZINC000641794194 362734686 /nfs/dbraw/zinc/73/46/86/362734686.db2.gz RRCXJABSUBUCOX-VIFPVBQESA-N 1 2 239.269 2.386 20 0 BEADLO Cc1ccc2[nH+]cc(CN[C@H](C)C(F)F)n2c1 ZINC000641794193 362734774 /nfs/dbraw/zinc/73/47/74/362734774.db2.gz RRCXJABSUBUCOX-SECBINFHSA-N 1 2 239.269 2.386 20 0 BEADLO CC[C@H](CSC)N(C)c1cc(CO)cc[nH+]1 ZINC000167667818 346463452 /nfs/dbraw/zinc/46/34/52/346463452.db2.gz IXWNESGZEVRWKC-LLVKDONJSA-N 1 2 240.372 2.152 20 0 BEADLO Cc1cccc(C[NH2+]Cc2ccn[nH]2)c1 ZINC000036900180 179093580 /nfs/dbraw/zinc/09/35/80/179093580.db2.gz JWIAKENMSCVHCD-UHFFFAOYSA-N 1 2 201.273 2.008 20 0 BEADLO CC[C@H](NC(=O)[C@H]1C[C@H]1C1CC1)c1[nH]cc[nH+]1 ZINC000332924000 346489157 /nfs/dbraw/zinc/48/91/57/346489157.db2.gz VEODRKGHDAJUCP-DCAQKATOSA-N 1 2 233.315 2.023 20 0 BEADLO Cc1ncc(C(=O)Nc2cc[nH+]cc2C)s1 ZINC000170957113 346490302 /nfs/dbraw/zinc/49/03/02/346490302.db2.gz VPURGBKYUHADML-UHFFFAOYSA-N 1 2 233.296 2.407 20 0 BEADLO Cc1cccc([N@H+](C)C[C@H]2CCNC(=O)CC2)c1 ZINC000297133530 179115419 /nfs/dbraw/zinc/11/54/19/179115419.db2.gz NESCISLNXYITMY-CYBMUJFWSA-N 1 2 246.354 2.348 20 0 BEADLO Cc1cccc([N@@H+](C)C[C@H]2CCNC(=O)CC2)c1 ZINC000297133530 179115420 /nfs/dbraw/zinc/11/54/20/179115420.db2.gz NESCISLNXYITMY-CYBMUJFWSA-N 1 2 246.354 2.348 20 0 BEADLO CC[C@H]1CC[C@H]1[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000390516671 259391649 /nfs/dbraw/zinc/39/16/49/259391649.db2.gz DFUSKTLBWFSTHX-GARJFASQSA-N 1 2 227.348 2.495 20 0 BEADLO CC(C)C[C@H]1CCCN1C(=O)CCc1[nH]cc[nH+]1 ZINC000352735798 187371023 /nfs/dbraw/zinc/37/10/23/187371023.db2.gz ADZPHTYZUOJJQO-GFCCVEGCSA-N 1 2 249.358 2.379 20 0 BEADLO CCc1cc(N[C@@H](CO)c2ccccc2)nc[nH+]1 ZINC000063001756 346783942 /nfs/dbraw/zinc/78/39/42/346783942.db2.gz OSJNAGQQTVMDJT-ZDUSSCGKSA-N 1 2 243.310 2.185 20 0 BEADLO CCN(Cc1cccc2[nH+]ccn21)CC(F)F ZINC000184092103 347148822 /nfs/dbraw/zinc/14/88/22/347148822.db2.gz YOUBODCNUKOJPC-UHFFFAOYSA-N 1 2 239.269 2.421 20 0 BEADLO Cc1cccc([C@@H](C)[NH2+][C@@H]2CCOC2=O)c1C ZINC000115603291 179182501 /nfs/dbraw/zinc/18/25/01/179182501.db2.gz RLELPJIYXOYHKM-DGCLKSJQSA-N 1 2 233.311 2.270 20 0 BEADLO Cc1cccc([C@H](C)C(=O)NCc2c[nH+]c[nH]2)c1 ZINC000359131926 179193771 /nfs/dbraw/zinc/19/37/71/179193771.db2.gz MUDJSEBSPRWLDN-NSHDSACASA-N 1 2 243.310 2.138 20 0 BEADLO Cc1cccc([C@H](C)C(=O)NCc2c[nH]c[nH+]2)c1 ZINC000359131926 179193774 /nfs/dbraw/zinc/19/37/74/179193774.db2.gz MUDJSEBSPRWLDN-NSHDSACASA-N 1 2 243.310 2.138 20 0 BEADLO CO[C@@H]([C@H](C)Nc1cc(C)[nH+]cn1)C1CC1 ZINC000388259928 347274517 /nfs/dbraw/zinc/27/45/17/347274517.db2.gz CPUBNRSNDCLEOZ-CABZTGNLSA-N 1 2 221.304 2.010 20 0 BEADLO Cc1cc(NC(=O)c2ccccn2)cc[nH+]1 ZINC000072709691 347284007 /nfs/dbraw/zinc/28/40/07/347284007.db2.gz KWKCXKGBUQITHK-UHFFFAOYSA-N 1 2 213.240 2.037 20 0 BEADLO C[C@@H]1CC=C(C(=O)N2CCc3[nH]c[nH+]c3C2)CC1 ZINC000627373159 347335102 /nfs/dbraw/zinc/33/51/02/347335102.db2.gz JFVZODXKRDQKKE-SNVBAGLBSA-N 1 2 245.326 2.041 20 0 BEADLO C[C@@H]1CC=C(C(=O)N2CCc3[nH+]c[nH]c3C2)CC1 ZINC000627373159 347335104 /nfs/dbraw/zinc/33/51/04/347335104.db2.gz JFVZODXKRDQKKE-SNVBAGLBSA-N 1 2 245.326 2.041 20 0 BEADLO CN(C[C@H](O)C1CC1)c1[nH+]ccc2ccccc21 ZINC000624025056 347351733 /nfs/dbraw/zinc/35/17/33/347351733.db2.gz KNCNIQAQMXDPKY-AWEZNQCLSA-N 1 2 242.322 2.442 20 0 BEADLO C[C@@H]1CCC[C@@]1(C)C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627373474 347373761 /nfs/dbraw/zinc/37/37/61/347373761.db2.gz SIGWDTXVEHAUNH-QMTHXVAHSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@@H]1CCC[C@@]1(C)C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627373474 347373764 /nfs/dbraw/zinc/37/37/64/347373764.db2.gz SIGWDTXVEHAUNH-QMTHXVAHSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@@H]1CC=C(C(=O)N(C)Cc2c[nH+]c[nH]2)CC1 ZINC000616921784 347451324 /nfs/dbraw/zinc/45/13/24/347451324.db2.gz CCMKTHFVZNGKKM-SNVBAGLBSA-N 1 2 233.315 2.115 20 0 BEADLO C[C@@H]1CC=C(C(=O)N(C)Cc2c[nH]c[nH+]2)CC1 ZINC000616921784 347451326 /nfs/dbraw/zinc/45/13/26/347451326.db2.gz CCMKTHFVZNGKKM-SNVBAGLBSA-N 1 2 233.315 2.115 20 0 BEADLO Cc1cccc2[nH+]c(C[S@@](=O)CC3CC3)cn21 ZINC000360915540 179230553 /nfs/dbraw/zinc/23/05/53/179230553.db2.gz YLWJHNGRZZHOOB-KRWDZBQOSA-N 1 2 248.351 2.301 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)C1CCC2(CC2)CC1 ZINC000616922157 347452261 /nfs/dbraw/zinc/45/22/61/347452261.db2.gz RDANJLYQDAFRHL-UHFFFAOYSA-N 1 2 247.342 2.339 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)C1CCC2(CC2)CC1 ZINC000616922157 347452264 /nfs/dbraw/zinc/45/22/64/347452264.db2.gz RDANJLYQDAFRHL-UHFFFAOYSA-N 1 2 247.342 2.339 20 0 BEADLO CCC[C@H](C)CC(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616924703 347456080 /nfs/dbraw/zinc/45/60/80/347456080.db2.gz SWDDNTGUMVCAKE-JTQLQIEISA-N 1 2 223.320 2.194 20 0 BEADLO CCC[C@H](C)CC(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616924703 347456083 /nfs/dbraw/zinc/45/60/83/347456083.db2.gz SWDDNTGUMVCAKE-JTQLQIEISA-N 1 2 223.320 2.194 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)C1C(C)(C)C1(C)C ZINC000616925241 347456459 /nfs/dbraw/zinc/45/64/59/347456459.db2.gz AHFCSMDTUZUXTC-UHFFFAOYSA-N 1 2 235.331 2.050 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)C1C(C)(C)C1(C)C ZINC000616925241 347456461 /nfs/dbraw/zinc/45/64/61/347456461.db2.gz AHFCSMDTUZUXTC-UHFFFAOYSA-N 1 2 235.331 2.050 20 0 BEADLO C[C@@H]1CCC[C@H](C(=O)N(C)Cc2c[nH+]c[nH]2)C1 ZINC000616925597 347457436 /nfs/dbraw/zinc/45/74/36/347457436.db2.gz LABNVZPSQLGYGG-MNOVXSKESA-N 1 2 235.331 2.194 20 0 BEADLO C[C@@H]1CCC[C@H](C(=O)N(C)Cc2c[nH]c[nH+]2)C1 ZINC000616925597 347457439 /nfs/dbraw/zinc/45/74/39/347457439.db2.gz LABNVZPSQLGYGG-MNOVXSKESA-N 1 2 235.331 2.194 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)N(C)Cc2c[nH+]c[nH]2)C[C@H]1C ZINC000616928731 347494811 /nfs/dbraw/zinc/49/48/11/347494811.db2.gz KCAPNHPHXPHOOH-UTUOFQBUSA-N 1 2 249.358 2.440 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)N(C)Cc2c[nH]c[nH+]2)C[C@H]1C ZINC000616928731 347494813 /nfs/dbraw/zinc/49/48/13/347494813.db2.gz KCAPNHPHXPHOOH-UTUOFQBUSA-N 1 2 249.358 2.440 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)C(C)(C)C(C)(C)C ZINC000616929074 347496118 /nfs/dbraw/zinc/49/61/18/347496118.db2.gz SAEMREVUHMGILJ-UHFFFAOYSA-N 1 2 237.347 2.440 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)C(C)(C)C(C)(C)C ZINC000616929074 347496119 /nfs/dbraw/zinc/49/61/19/347496119.db2.gz SAEMREVUHMGILJ-UHFFFAOYSA-N 1 2 237.347 2.440 20 0 BEADLO C[C@H]1CC[C@@H](CC(=O)N(C)Cc2c[nH+]c[nH]2)C1 ZINC000616926746 347459853 /nfs/dbraw/zinc/45/98/53/347459853.db2.gz OCTMTYYPZCTAHS-WDEREUQCSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@H]1CC[C@@H](CC(=O)N(C)Cc2c[nH]c[nH+]2)C1 ZINC000616926746 347459857 /nfs/dbraw/zinc/45/98/57/347459857.db2.gz OCTMTYYPZCTAHS-WDEREUQCSA-N 1 2 235.331 2.194 20 0 BEADLO C/C=C/C=C\C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000493090150 347522625 /nfs/dbraw/zinc/52/26/25/347522625.db2.gz ULEZPLAEHICHGG-SSRQUVDVSA-N 1 2 231.299 2.137 20 0 BEADLO C[C@H]1CCCC[C@H]1CC(=O)NCc1[nH+]ccn1C ZINC000590736973 347501635 /nfs/dbraw/zinc/50/16/35/347501635.db2.gz UJESCPBTZKSPBM-RYUDHWBXSA-N 1 2 249.358 2.253 20 0 BEADLO CC[C@H](C)N(CC)C(=O)[C@H]1CCc2c[nH+]cn2C1 ZINC000616976849 347557039 /nfs/dbraw/zinc/55/70/39/347557039.db2.gz YCNRBIVFXUGYHI-RYUDHWBXSA-N 1 2 249.358 2.093 20 0 BEADLO CCC[C@H]1CN(c2cccc[nH+]2)CCO1 ZINC000197893301 347597302 /nfs/dbraw/zinc/59/73/02/347597302.db2.gz FXZCMEOQXSRCGF-NSHDSACASA-N 1 2 206.289 2.087 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000616975024 347546521 /nfs/dbraw/zinc/54/65/21/347546521.db2.gz XMRVGNNDECIUHB-VXGBXAGGSA-N 1 2 237.347 2.481 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000616975357 347546529 /nfs/dbraw/zinc/54/65/29/347546529.db2.gz BOCXQGUHVJGTDN-MNOVXSKESA-N 1 2 249.358 2.162 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000616975357 347546532 /nfs/dbraw/zinc/54/65/32/347546532.db2.gz BOCXQGUHVJGTDN-MNOVXSKESA-N 1 2 249.358 2.162 20 0 BEADLO CC[C@H](C)N(CC)C(=O)[C@H]1CCc2[nH+]ccn2C1 ZINC000616976613 347547361 /nfs/dbraw/zinc/54/73/61/347547361.db2.gz TXWCUCARHSQLEK-RYUDHWBXSA-N 1 2 249.358 2.093 20 0 BEADLO CCC1CCN(C(=O)CCCn2cc[nH+]c2)CC1 ZINC000591147814 347621260 /nfs/dbraw/zinc/62/12/60/347621260.db2.gz BKYFTPDUQLUGQS-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO Cc1ccccc1C[N@@H+]1CC(F)(F)C[C@@H]1CO ZINC000366678207 179271218 /nfs/dbraw/zinc/27/12/18/179271218.db2.gz LTLLXTOSDBUHQB-GFCCVEGCSA-N 1 2 241.281 2.197 20 0 BEADLO Cc1ccccc1C[N@H+]1CC(F)(F)C[C@@H]1CO ZINC000366678207 179271220 /nfs/dbraw/zinc/27/12/20/179271220.db2.gz LTLLXTOSDBUHQB-GFCCVEGCSA-N 1 2 241.281 2.197 20 0 BEADLO CC[N@@H+](Cc1ncccc1Cl)[C@H]1CCOC1 ZINC000528508383 323150854 /nfs/dbraw/zinc/15/08/54/323150854.db2.gz IAHBNJRPZUXVJJ-JTQLQIEISA-N 1 2 240.734 2.346 20 0 BEADLO C[C@H]([NH2+][C@@H](C)[C@@H]1CC1(F)F)C(=O)OC(C)(C)C ZINC000591377423 347650927 /nfs/dbraw/zinc/65/09/27/347650927.db2.gz STFMTYROAOFJJK-CIUDSAMLSA-N 1 2 249.301 2.350 20 0 BEADLO CC[C@@](C)([NH2+]CC1=CCCC1)C(=O)OC ZINC000592089181 347730972 /nfs/dbraw/zinc/73/09/72/347730972.db2.gz GDSPHOWOGYZYJA-GFCCVEGCSA-N 1 2 211.305 2.028 20 0 BEADLO CC[N@H+](CCSC)Cc1nnc(C(C)C)o1 ZINC000592201014 347752833 /nfs/dbraw/zinc/75/28/33/347752833.db2.gz AYRSQMIRHTYZDS-UHFFFAOYSA-N 1 2 243.376 2.378 20 0 BEADLO CC[N@@H+](CCSC)Cc1nnc(C(C)C)o1 ZINC000592201014 347752837 /nfs/dbraw/zinc/75/28/37/347752837.db2.gz AYRSQMIRHTYZDS-UHFFFAOYSA-N 1 2 243.376 2.378 20 0 BEADLO FC(F)O[C@H]1CCC[N@H+](Cc2cscn2)C1 ZINC000679678233 488363873 /nfs/dbraw/zinc/36/38/73/488363873.db2.gz KTTPZTKOFIASMS-VIFPVBQESA-N 1 2 248.298 2.347 20 0 BEADLO FC(F)O[C@H]1CCC[N@@H+](Cc2cscn2)C1 ZINC000679678233 488363874 /nfs/dbraw/zinc/36/38/74/488363874.db2.gz KTTPZTKOFIASMS-VIFPVBQESA-N 1 2 248.298 2.347 20 0 BEADLO Cc1ccccc1NC(=O)CCn1cc[nH+]c1 ZINC000021916649 179298916 /nfs/dbraw/zinc/29/89/16/179298916.db2.gz QBIVXNZQXDGAHW-UHFFFAOYSA-N 1 2 229.283 2.220 20 0 BEADLO CC[C@H]([NH2+][C@@H]1C[C@H]1c1ccccc1C)C(=O)OC ZINC000593182139 347868800 /nfs/dbraw/zinc/86/88/00/347868800.db2.gz XVSYEPHNYJADII-MELADBBJSA-N 1 2 247.338 2.392 20 0 BEADLO Cc1ccccc1OCC[N@@H+](C)Cc1ccon1 ZINC000172383732 179311318 /nfs/dbraw/zinc/31/13/18/179311318.db2.gz PLUIXTAAZXVCAG-UHFFFAOYSA-N 1 2 246.310 2.494 20 0 BEADLO Cc1ccccc1OCC[N@H+](C)Cc1ccon1 ZINC000172383732 179311320 /nfs/dbraw/zinc/31/13/20/179311320.db2.gz PLUIXTAAZXVCAG-UHFFFAOYSA-N 1 2 246.310 2.494 20 0 BEADLO Cc1ccccc1OCc1noc(C[NH+](C)C)n1 ZINC000277949026 179312645 /nfs/dbraw/zinc/31/26/45/179312645.db2.gz ONDRVIWNJKPXFO-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO CSCC[N@H+](C)[C@H](C)c1nc(C2CC2)no1 ZINC000151162731 192371559 /nfs/dbraw/zinc/37/15/59/192371559.db2.gz AKIQOYWCGIYGKV-MRVPVSSYSA-N 1 2 241.360 2.303 20 0 BEADLO CSCC[N@@H+](C)[C@H](C)c1nc(C2CC2)no1 ZINC000151162731 192371560 /nfs/dbraw/zinc/37/15/60/192371560.db2.gz AKIQOYWCGIYGKV-MRVPVSSYSA-N 1 2 241.360 2.303 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CC[C@@H](CC2CC2)C1 ZINC000493600206 347925041 /nfs/dbraw/zinc/92/50/41/347925041.db2.gz WUOSLCDBZYOJHY-MVZIDQBPSA-N 1 2 245.326 2.072 20 0 BEADLO CC[N@H+](CCSC)Cc1cc(C(C)=O)no1 ZINC000594015149 347989692 /nfs/dbraw/zinc/98/96/92/347989692.db2.gz GUZTZGZXGYVVBZ-UHFFFAOYSA-N 1 2 242.344 2.062 20 0 BEADLO CC[N@@H+](CCSC)Cc1cc(C(C)=O)no1 ZINC000594015149 347989694 /nfs/dbraw/zinc/98/96/94/347989694.db2.gz GUZTZGZXGYVVBZ-UHFFFAOYSA-N 1 2 242.344 2.062 20 0 BEADLO Cc1ccccc1[C@H](C)[N@H+](C)Cc1nnc[nH]1 ZINC000178490659 179334270 /nfs/dbraw/zinc/33/42/70/179334270.db2.gz LRLJVWYGZBYVHF-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO Cc1ccccc1[C@H](C)[N@@H+](C)Cc1nnc[nH]1 ZINC000178490659 179334272 /nfs/dbraw/zinc/33/42/72/179334272.db2.gz LRLJVWYGZBYVHF-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO CC[C@H]([NH2+]Cc1ccc2occc2c1)C(=O)OC ZINC000594714099 348104970 /nfs/dbraw/zinc/10/49/70/348104970.db2.gz XNNYJGSCKMSESO-LBPRGKRZSA-N 1 2 247.294 2.474 20 0 BEADLO CC[C@@H]([NH2+][C@@H]1CC[C@@H]1c1ccccc1)C(=O)OC ZINC000594716641 348106232 /nfs/dbraw/zinc/10/62/32/348106232.db2.gz CYZQDDPEDZZRKS-MGPQQGTHSA-N 1 2 247.338 2.474 20 0 BEADLO CC[C@@H]([NH2+]CCc1ccc(C)c(C)c1)C(=O)OC ZINC000594725006 348108362 /nfs/dbraw/zinc/10/83/62/348108362.db2.gz HZSGTJGSSIPNNP-CQSZACIVSA-N 1 2 249.354 2.387 20 0 BEADLO CCCC[C@@H]([NH2+]C[C@]1(C)CC1(F)F)C(=O)OC ZINC000594732705 348109214 /nfs/dbraw/zinc/10/92/14/348109214.db2.gz XDQDDWPJOAIECY-KOLCDFICSA-N 1 2 249.301 2.353 20 0 BEADLO Cc1ccc[nH+]c1CCNc1ncc(Cl)cn1 ZINC000295764030 179370793 /nfs/dbraw/zinc/37/07/93/179370793.db2.gz PDVKMPQUAURPRK-UHFFFAOYSA-N 1 2 248.717 2.488 20 0 BEADLO CCOC(=O)C(CC)(CC)[NH2+]C[C@@H](CC)OC ZINC000419297296 192118809 /nfs/dbraw/zinc/11/88/09/192118809.db2.gz YSABQVHGLNATAG-LLVKDONJSA-N 1 2 245.363 2.123 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@@H]1Cc2ccccc2[C@@H]1C ZINC000595706769 348319650 /nfs/dbraw/zinc/31/96/50/348319650.db2.gz KMQNZDDHXCJYAE-COPLHBTASA-N 1 2 247.338 2.256 20 0 BEADLO COC(=O)[C@](C)(CCF)[NH2+]CCCC1CCC1 ZINC000595772329 348337429 /nfs/dbraw/zinc/33/74/29/348337429.db2.gz JKRHCOQHJBWSMF-ZDUSSCGKSA-N 1 2 245.338 2.448 20 0 BEADLO COC(=O)[C@](C)(CCF)[NH2+]CCCCCF ZINC000595772725 348337445 /nfs/dbraw/zinc/33/74/45/348337445.db2.gz AJOJCHXIIMGWAP-NSHDSACASA-N 1 2 237.290 2.007 20 0 BEADLO Cc1cnc(C[NH2+]Cc2cnc(C)o2)s1 ZINC000397856623 362926032 /nfs/dbraw/zinc/92/60/32/362926032.db2.gz BJTHQRYDNFTQLB-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO Cc1cc(CNC(=O)c2cc(F)c[nH]2)cc(C)[nH+]1 ZINC001639417329 1172104284 /nfs/dbraw/zinc/10/42/84/1172104284.db2.gz SNSPFHPKWRWJLC-UHFFFAOYSA-N 1 2 247.273 2.096 20 0 BEADLO CCC=C(F)C(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001639427425 1172104778 /nfs/dbraw/zinc/10/47/78/1172104778.db2.gz IKCBNGFUVAXUCF-BJMVGYQFSA-N 1 2 239.294 2.413 20 0 BEADLO CC/C=C(/F)C(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001639427425 1172104782 /nfs/dbraw/zinc/10/47/82/1172104782.db2.gz IKCBNGFUVAXUCF-BJMVGYQFSA-N 1 2 239.294 2.413 20 0 BEADLO CSCC[N@@H+]1CCO[C@@H](CC(F)(F)F)C1 ZINC000595888682 348389958 /nfs/dbraw/zinc/38/99/58/348389958.db2.gz ZOAZJEFRDUTZJL-QMMMGPOBSA-N 1 2 243.294 2.003 20 0 BEADLO CSCC[N@H+]1CCO[C@@H](CC(F)(F)F)C1 ZINC000595888682 348389959 /nfs/dbraw/zinc/38/99/59/348389959.db2.gz ZOAZJEFRDUTZJL-QMMMGPOBSA-N 1 2 243.294 2.003 20 0 BEADLO Cc1cc(C)nc(N[C@H]2C[C@H](C)n3cc[nH+]c32)n1 ZINC000577459919 365957247 /nfs/dbraw/zinc/95/72/47/365957247.db2.gz POSQUXPROQCAGU-QWRGUYRKSA-N 1 2 243.314 2.408 20 0 BEADLO COC(=O)[C@@H]([NH2+]C[C@H]1CC12CC2)c1ccccc1 ZINC000419333215 192125074 /nfs/dbraw/zinc/12/50/74/192125074.db2.gz FEEFRUUPIXMAGV-OLZOCXBDSA-N 1 2 245.322 2.290 20 0 BEADLO CCCCN(C)c1cc(CC(=O)OC)cc[nH+]1 ZINC000596050032 348432715 /nfs/dbraw/zinc/43/27/15/348432715.db2.gz AJESQZKQYKRCKZ-UHFFFAOYSA-N 1 2 236.315 2.033 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@@H](C)C2CC2)c1 ZINC000596070459 348437226 /nfs/dbraw/zinc/43/72/26/348437226.db2.gz DFSDICKRFNUDNX-VIFPVBQESA-N 1 2 234.299 2.008 20 0 BEADLO COC(=O)Cc1cc[nH+]c(NCC2CCC2)c1 ZINC000596079681 348439535 /nfs/dbraw/zinc/43/95/35/348439535.db2.gz VVPPESPCCFRCCZ-UHFFFAOYSA-N 1 2 234.299 2.009 20 0 BEADLO COC(=O)Cc1cc[nH+]c(NC[C@@H](C)C2CC2)c1 ZINC000596088257 348443489 /nfs/dbraw/zinc/44/34/89/348443489.db2.gz NPWMXQHDHDKSIF-SNVBAGLBSA-N 1 2 248.326 2.255 20 0 BEADLO Cc1noc([C@@H](C)[N@H+]2C[C@@H](C)S[C@@H](C)C2)n1 ZINC000075892757 349992797 /nfs/dbraw/zinc/99/27/97/349992797.db2.gz AWJXIDOXQPHVTA-HRDYMLBCSA-N 1 2 241.360 2.265 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+]2C[C@@H](C)S[C@@H](C)C2)n1 ZINC000075892757 349992800 /nfs/dbraw/zinc/99/28/00/349992800.db2.gz AWJXIDOXQPHVTA-HRDYMLBCSA-N 1 2 241.360 2.265 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@H]2CC[C@H]2C)c1 ZINC000596231400 348463012 /nfs/dbraw/zinc/46/30/12/348463012.db2.gz LPTBRZJNFNZPLS-KOLCDFICSA-N 1 2 234.299 2.008 20 0 BEADLO FC1(F)C[C@H]1OCCSCCn1cc[nH+]c1 ZINC000596402130 348534214 /nfs/dbraw/zinc/53/42/14/348534214.db2.gz CULDLOUVHARCCK-SECBINFHSA-N 1 2 248.298 2.041 20 0 BEADLO CSC[C@H](C)C(=O)Nc1cc(C)[nH+]cc1C ZINC000535748645 323190370 /nfs/dbraw/zinc/19/03/70/323190370.db2.gz PACOJTGKJNBFEZ-VIFPVBQESA-N 1 2 238.356 2.058 20 0 BEADLO CC[C@H]([NH2+]Cc1cncn1C)c1nccs1 ZINC000082784172 348725192 /nfs/dbraw/zinc/72/51/92/348725192.db2.gz PZVQNTJAQIPCAW-JTQLQIEISA-N 1 2 236.344 2.118 20 0 BEADLO CSC1(C[N@H+](C)Cc2nnc(C)s2)CC1 ZINC000597246813 348689512 /nfs/dbraw/zinc/68/95/12/348689512.db2.gz ZRBHAFYCDNVASF-UHFFFAOYSA-N 1 2 243.401 2.174 20 0 BEADLO CSC1(C[N@@H+](C)Cc2nnc(C)s2)CC1 ZINC000597246813 348689513 /nfs/dbraw/zinc/68/95/13/348689513.db2.gz ZRBHAFYCDNVASF-UHFFFAOYSA-N 1 2 243.401 2.174 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CCO[C@H](C)[C@@H]1C ZINC000180726361 179707442 /nfs/dbraw/zinc/70/74/42/179707442.db2.gz RKKNYZYSMRTQNJ-WDEREUQCSA-N 1 2 249.314 2.031 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N(C)Cc1ccon1 ZINC000271120023 179707230 /nfs/dbraw/zinc/70/72/30/179707230.db2.gz JCGUUYCUPMKARL-UHFFFAOYSA-N 1 2 246.270 2.042 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@@H+]1CCC[C@H]1C ZINC000208677187 348938896 /nfs/dbraw/zinc/93/88/96/348938896.db2.gz OPKVCONGKSHHMS-KOLCDFICSA-N 1 2 239.340 2.447 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@H+]1CCC[C@H]1C ZINC000208677187 348938898 /nfs/dbraw/zinc/93/88/98/348938898.db2.gz OPKVCONGKSHHMS-KOLCDFICSA-N 1 2 239.340 2.447 20 0 BEADLO CC(C)[C@@H]1C[C@H](Nc2c[nH]c[nH+]2)CCO1 ZINC000308886363 349024415 /nfs/dbraw/zinc/02/44/15/349024415.db2.gz VXXHGOWDGZKVHR-ZJUUUORDSA-N 1 2 209.293 2.025 20 0 BEADLO C[C@H]([NH2+]Cc1ncccn1)c1cccc(F)c1 ZINC000054459561 349033288 /nfs/dbraw/zinc/03/32/88/349033288.db2.gz SOMICTAADQINJE-JTQLQIEISA-N 1 2 231.274 2.467 20 0 BEADLO C[C@H]([NH2+]Cc1ncccn1)c1ccc(F)cc1 ZINC000054459533 349033485 /nfs/dbraw/zinc/03/34/85/349033485.db2.gz BKXAGCFYPHALIS-JTQLQIEISA-N 1 2 231.274 2.467 20 0 BEADLO CC(C)N(C(=O)CCCn1cc[nH+]c1)C(C)C ZINC000201010734 349058054 /nfs/dbraw/zinc/05/80/54/349058054.db2.gz DKWSZZDAEXAFRY-UHFFFAOYSA-N 1 2 237.347 2.309 20 0 BEADLO COc1ccc[nH+]c1N1CC[C@@H](SC)C1 ZINC000599083202 349096664 /nfs/dbraw/zinc/09/66/64/349096664.db2.gz KMPFVVBNNOPIOC-SECBINFHSA-N 1 2 224.329 2.032 20 0 BEADLO Cc1csc(C[N@H+]2C[C@H](C)OC[C@@H]2C)n1 ZINC000088576331 179774362 /nfs/dbraw/zinc/77/43/62/179774362.db2.gz FPCJABFDCLMOBO-UWVGGRQHSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1csc(C[N@@H+]2C[C@H](C)OC[C@@H]2C)n1 ZINC000088576331 179774364 /nfs/dbraw/zinc/77/43/64/179774364.db2.gz FPCJABFDCLMOBO-UWVGGRQHSA-N 1 2 226.345 2.061 20 0 BEADLO COCCSCCc1cc[nH+]cc1C ZINC000421834714 192391609 /nfs/dbraw/zinc/39/16/09/192391609.db2.gz LDAVAICVSXTCAW-UHFFFAOYSA-N 1 2 211.330 2.312 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@@H+]1CC1CC(C)(C)C1 ZINC000599390405 349169541 /nfs/dbraw/zinc/16/95/41/349169541.db2.gz KSEMTWUBXSBETB-QWRGUYRKSA-N 1 2 243.322 2.008 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@H+]1CC1CC(C)(C)C1 ZINC000599390405 349169542 /nfs/dbraw/zinc/16/95/42/349169542.db2.gz KSEMTWUBXSBETB-QWRGUYRKSA-N 1 2 243.322 2.008 20 0 BEADLO Cc1cc(N2CC[C@@H]2C)nc(-c2ccncc2)[nH+]1 ZINC000601511387 349294434 /nfs/dbraw/zinc/29/44/34/349294434.db2.gz BFLRWURFCWIIDY-NSHDSACASA-N 1 2 240.310 2.446 20 0 BEADLO COCC1(CNc2[nH+]cccc2OC)CCC1 ZINC000383646887 349257389 /nfs/dbraw/zinc/25/73/89/349257389.db2.gz GPBLJNDAOJYWQX-UHFFFAOYSA-N 1 2 236.315 2.319 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CCC[C@@H](C)C2)c[nH+]1 ZINC000264849986 179888838 /nfs/dbraw/zinc/88/88/38/179888838.db2.gz MUEHZHKNGZQJHN-PSASIEDQSA-N 1 2 221.304 2.027 20 0 BEADLO C[C@H]1CN(c2cccc[nH+]2)CC(C)(C)O1 ZINC000065280768 490251124 /nfs/dbraw/zinc/25/11/24/490251124.db2.gz VPKKGDMRFTVXMJ-JTQLQIEISA-N 1 2 206.289 2.085 20 0 BEADLO CC[C@H]([NH2+]Cc1nccn1C)c1ccc(F)cn1 ZINC000161336166 349424645 /nfs/dbraw/zinc/42/46/45/349424645.db2.gz CGWMCSOECIVRLE-NSHDSACASA-N 1 2 248.305 2.195 20 0 BEADLO CCOC(=O)c1nc(C[NH+](CC)CC)cs1 ZINC000603848816 350044869 /nfs/dbraw/zinc/04/48/69/350044869.db2.gz PRWYFSBIMLNIBK-UHFFFAOYSA-N 1 2 242.344 2.162 20 0 BEADLO Cc1nc(C[NH2+][C@H](C)c2cn[nH]c2)c(C)s1 ZINC000309835085 179973981 /nfs/dbraw/zinc/97/39/81/179973981.db2.gz ZYGWMSOOHPGFCA-SSDOTTSWSA-N 1 2 236.344 2.334 20 0 BEADLO Cc1ccc(C(=O)Nc2ccc3[nH+]ccn3c2)o1 ZINC000603881716 350047470 /nfs/dbraw/zinc/04/74/70/350047470.db2.gz GSIRTIAFSXOOSU-UHFFFAOYSA-N 1 2 241.250 2.488 20 0 BEADLO COCCCCC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000603884552 350048588 /nfs/dbraw/zinc/04/85/88/350048588.db2.gz XFXXBWMGJLLZLQ-UHFFFAOYSA-N 1 2 247.298 2.090 20 0 BEADLO Cc1nc(Cl)ccc1NCc1c[nH+]cn1C ZINC000193343695 179990763 /nfs/dbraw/zinc/99/07/63/179990763.db2.gz TYDGOCKSPZRBIK-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO Cc1cncc(CNc2cc[nH+]c(C)n2)c1 ZINC000131622160 191016732 /nfs/dbraw/zinc/01/67/32/191016732.db2.gz LRKNGBBMDBSSEY-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2C[C@H]3CCCC[C@H]32)no1 ZINC000368099056 180036180 /nfs/dbraw/zinc/03/61/80/180036180.db2.gz LTOJSSUZWFDOEO-FBIMIBRVSA-N 1 2 221.304 2.313 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2C[C@H]3CCCC[C@H]32)no1 ZINC000368099056 180036181 /nfs/dbraw/zinc/03/61/81/180036181.db2.gz LTOJSSUZWFDOEO-FBIMIBRVSA-N 1 2 221.304 2.313 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2CCS[C@H](C)CC2)no1 ZINC000336394943 180047479 /nfs/dbraw/zinc/04/74/79/180047479.db2.gz JQSCORQYDYVSAH-BDAKNGLRSA-N 1 2 241.360 2.266 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2CCS[C@H](C)CC2)no1 ZINC000336394943 180047481 /nfs/dbraw/zinc/04/74/81/180047481.db2.gz JQSCORQYDYVSAH-BDAKNGLRSA-N 1 2 241.360 2.266 20 0 BEADLO Cc1nc([C@H](C)[NH2+]Cc2cncn2C)cs1 ZINC000264614407 180051561 /nfs/dbraw/zinc/05/15/61/180051561.db2.gz QHZPPFNSIBWBSS-QMMMGPOBSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1nc(NC[C@H]2CCCO2)c2c([nH+]1)CCCC2 ZINC000267975513 180070972 /nfs/dbraw/zinc/07/09/72/180070972.db2.gz NYQCXMDXZPJWFF-LLVKDONJSA-N 1 2 247.342 2.255 20 0 BEADLO Cc1nc(NCCC[C@@H](C)O)c2c([nH+]1)CCCC2 ZINC000278553389 180071094 /nfs/dbraw/zinc/07/10/94/180071094.db2.gz AHUNDHBEVFUIME-SNVBAGLBSA-N 1 2 249.358 2.237 20 0 BEADLO Cc1nc(N[C@H]2CCCOC2)c2c([nH+]1)CCCC2 ZINC000272924379 180069679 /nfs/dbraw/zinc/06/96/79/180069679.db2.gz UIKXSWVQPYQXQT-NSHDSACASA-N 1 2 247.342 2.255 20 0 BEADLO Cc1nc(NCCF)c2c([nH+]1)CCCC2 ZINC000280774452 180070857 /nfs/dbraw/zinc/07/08/57/180070857.db2.gz OVIIKFDNDMLQIW-UHFFFAOYSA-N 1 2 209.268 2.045 20 0 BEADLO Clc1ccc(C[N@@H+]2CCCOCC2)o1 ZINC000334254677 538061384 /nfs/dbraw/zinc/06/13/84/538061384.db2.gz NCUDKBXSDSCAJA-UHFFFAOYSA-N 1 2 215.680 2.155 20 0 BEADLO Clc1ccc(C[N@H+]2CCCOCC2)o1 ZINC000334254677 538061395 /nfs/dbraw/zinc/06/13/95/538061395.db2.gz NCUDKBXSDSCAJA-UHFFFAOYSA-N 1 2 215.680 2.155 20 0 BEADLO Fc1cc(Cl)ccc1C[NH2+]Cc1ncc[nH]1 ZINC000133045857 191036424 /nfs/dbraw/zinc/03/64/24/191036424.db2.gz DBBWVJRDTIZRBD-UHFFFAOYSA-N 1 2 239.681 2.492 20 0 BEADLO Cc1[nH+]c2ccccc2n1CC(C)(C)O ZINC000037694367 180104415 /nfs/dbraw/zinc/10/44/15/180104415.db2.gz MJCHOHZEZCYFMT-UHFFFAOYSA-N 1 2 204.273 2.116 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2c[nH]nc2C)s1 ZINC000179384119 180137984 /nfs/dbraw/zinc/13/79/84/180137984.db2.gz XHUHFNYUKNNASO-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2c[nH]nc2C)s1 ZINC000179384119 180137985 /nfs/dbraw/zinc/13/79/85/180137985.db2.gz XHUHFNYUKNNASO-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2conc2C)s1 ZINC000295378634 180140199 /nfs/dbraw/zinc/14/01/99/180140199.db2.gz OXIXSBGSDJPXAQ-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2conc2C)s1 ZINC000295378634 180140201 /nfs/dbraw/zinc/14/02/01/180140201.db2.gz OXIXSBGSDJPXAQ-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C1=CCC(C)(C)CC1 ZINC000336287228 180118873 /nfs/dbraw/zinc/11/88/73/180118873.db2.gz QOYAQXPHTYFFMB-UHFFFAOYSA-N 1 2 247.342 2.471 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H]1CCC[C@H](C)C1 ZINC000336080196 180120721 /nfs/dbraw/zinc/12/07/21/180120721.db2.gz XWTPWAACUJBWFW-ONGXEEELSA-N 1 2 235.331 2.161 20 0 BEADLO Cc1ncc(C[N@@H+]2CCOC[C@H]2C2CC2)s1 ZINC000090009697 180144613 /nfs/dbraw/zinc/14/46/13/180144613.db2.gz TUZXPSHZEZXPRZ-LBPRGKRZSA-N 1 2 238.356 2.062 20 0 BEADLO Cc1ncc(C[N@H+]2CCOC[C@H]2C2CC2)s1 ZINC000090009697 180144616 /nfs/dbraw/zinc/14/46/16/180144616.db2.gz TUZXPSHZEZXPRZ-LBPRGKRZSA-N 1 2 238.356 2.062 20 0 BEADLO CCc1cc(N2CCC(F)(F)C2)nc(C)[nH+]1 ZINC000334403713 538069125 /nfs/dbraw/zinc/06/91/25/538069125.db2.gz OXTWOLMEHFUGEA-UHFFFAOYSA-N 1 2 227.258 2.193 20 0 BEADLO Cc1nc(NCC2CCSCC2)cc[nH+]1 ZINC000078257918 180198164 /nfs/dbraw/zinc/19/81/64/180198164.db2.gz WFSZGOPCYSIERG-UHFFFAOYSA-N 1 2 223.345 2.340 20 0 BEADLO Cc1nc(NC[C@]2(C)CCCS2)cc[nH+]1 ZINC000087620133 180200574 /nfs/dbraw/zinc/20/05/74/180200574.db2.gz WSVUBPWUXDQCLG-NSHDSACASA-N 1 2 223.345 2.483 20 0 BEADLO Cc1nc(NCc2ccccc2N(C)C)cc[nH+]1 ZINC000276905671 180201026 /nfs/dbraw/zinc/20/10/26/180201026.db2.gz MHLMQBOQPTYIPL-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO Cc1nc(NC[C@H]2CSCCS2)cc[nH+]1 ZINC000130295265 180201582 /nfs/dbraw/zinc/20/15/82/180201582.db2.gz AAACBEAQXFGOHF-VIFPVBQESA-N 1 2 241.385 2.046 20 0 BEADLO Cc1nc(NCc2noc3c2CCCC3)cc[nH+]1 ZINC000288162931 180203846 /nfs/dbraw/zinc/20/38/46/180203846.db2.gz HSWDOXVRAPTIDB-UHFFFAOYSA-N 1 2 244.298 2.264 20 0 BEADLO Cc1c([C@@H](C)Nc2cc[nH+]c(C)n2)cnn1C ZINC000266443980 180205154 /nfs/dbraw/zinc/20/51/54/180205154.db2.gz WMZYLYKEDOTQNQ-MRVPVSSYSA-N 1 2 231.303 2.000 20 0 BEADLO Cc1nn(C)cc1[C@@H](C)Nc1cc[nH+]c(C)n1 ZINC000266416984 180205206 /nfs/dbraw/zinc/20/52/06/180205206.db2.gz RJBJNSNQCSPLJQ-MRVPVSSYSA-N 1 2 231.303 2.000 20 0 BEADLO Cc1nc(N[C@H](CO)c2cccc(F)c2)cc[nH+]1 ZINC000361034869 180206533 /nfs/dbraw/zinc/20/65/33/180206533.db2.gz XUXGKUQETNZOPX-GFCCVEGCSA-N 1 2 247.273 2.070 20 0 BEADLO Cc1nc(NC[C@H]2C[C@H]2c2ccccc2)cc[nH+]1 ZINC000338769774 180181566 /nfs/dbraw/zinc/18/15/66/180181566.db2.gz LVLVRWSSPJMYRK-KGLIPLIRSA-N 1 2 239.322 2.423 20 0 BEADLO Cc1[nH+]cccc1N[C@H](C)CCn1cccn1 ZINC000159329450 180228296 /nfs/dbraw/zinc/22/82/96/180228296.db2.gz IWYKMXXAZYVWBI-LLVKDONJSA-N 1 2 230.315 2.477 20 0 BEADLO Cc1nc(NCCn2cc[nH+]c2)sc1C ZINC000083532773 350240469 /nfs/dbraw/zinc/24/04/69/350240469.db2.gz BNOJKHCMJOSIJM-UHFFFAOYSA-N 1 2 222.317 2.069 20 0 BEADLO CCOc1nnc(C[N@@H+]2CCCC[C@H]2C)s1 ZINC000049982653 350273309 /nfs/dbraw/zinc/27/33/09/350273309.db2.gz YKGRZINNTHHOIH-SECBINFHSA-N 1 2 241.360 2.311 20 0 BEADLO CCOc1nnc(C[N@H+]2CCCC[C@H]2C)s1 ZINC000049982653 350273310 /nfs/dbraw/zinc/27/33/10/350273310.db2.gz YKGRZINNTHHOIH-SECBINFHSA-N 1 2 241.360 2.311 20 0 BEADLO Fc1cccc2c1OCC[C@H]2[NH2+]Cc1cocn1 ZINC000428566201 191090183 /nfs/dbraw/zinc/09/01/83/191090183.db2.gz NTBUTNZYUKVHRD-GFCCVEGCSA-N 1 2 248.257 2.427 20 0 BEADLO Cc1ncsc1C[N@@H+](C)Cc1ccccn1 ZINC000066563030 180314244 /nfs/dbraw/zinc/31/42/44/180314244.db2.gz ZZNZLCLDDMKVDX-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ncsc1C[N@H+](C)Cc1ccccn1 ZINC000066563030 180314247 /nfs/dbraw/zinc/31/42/47/180314247.db2.gz ZZNZLCLDDMKVDX-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ccc(F)c(CNc2c[nH]c[nH+]2)c1 ZINC000309215082 323329592 /nfs/dbraw/zinc/32/95/92/323329592.db2.gz UEVIQWPNKMIYMW-UHFFFAOYSA-N 1 2 205.236 2.469 20 0 BEADLO CCC[NH2+][C@@H](c1ncn[nH]1)C1CCCCC1 ZINC000083746912 350354390 /nfs/dbraw/zinc/35/43/90/350354390.db2.gz ZENWPEGQRIFWHD-LLVKDONJSA-N 1 2 222.336 2.426 20 0 BEADLO C[C@H]([NH2+]CC(F)F)c1ccc([S@@](C)=O)cc1 ZINC000309413012 350376413 /nfs/dbraw/zinc/37/64/13/350376413.db2.gz IVIGMVFOTYOKPG-ZKANADHPSA-N 1 2 247.310 2.340 20 0 BEADLO CCc1cc(NCc2cccnc2)nc[nH+]1 ZINC000040765070 350394309 /nfs/dbraw/zinc/39/43/09/350394309.db2.gz NJOBPFNYXHJMBD-UHFFFAOYSA-N 1 2 214.272 2.046 20 0 BEADLO Cc1ncsc1C[NH2+][C@H](C)c1ncc[nH]1 ZINC000124703652 180321507 /nfs/dbraw/zinc/32/15/07/180321507.db2.gz SBVCSRTXYOFKQU-MRVPVSSYSA-N 1 2 222.317 2.025 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@@H]2CC)no1 ZINC000336651478 350419215 /nfs/dbraw/zinc/41/92/15/350419215.db2.gz VGSTTZFIJFNPRL-VIFPVBQESA-N 1 2 209.293 2.006 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@@H]2CC)no1 ZINC000336651478 350419218 /nfs/dbraw/zinc/41/92/18/350419218.db2.gz VGSTTZFIJFNPRL-VIFPVBQESA-N 1 2 209.293 2.006 20 0 BEADLO CCc1nc(C[N@H+](C)[C@H]2CCCOC2)cs1 ZINC000336665096 350425894 /nfs/dbraw/zinc/42/58/94/350425894.db2.gz FIGFVKXHFKRIRK-NSHDSACASA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@H]2CCCOC2)cs1 ZINC000336665096 350425897 /nfs/dbraw/zinc/42/58/97/350425897.db2.gz FIGFVKXHFKRIRK-NSHDSACASA-N 1 2 240.372 2.316 20 0 BEADLO CC[N@@H+](Cc1noc(C)n1)CC1CCC1 ZINC000336692654 350448118 /nfs/dbraw/zinc/44/81/18/350448118.db2.gz PTSODPRYUVXMMN-UHFFFAOYSA-N 1 2 209.293 2.000 20 0 BEADLO CC[N@H+](Cc1noc(C)n1)CC1CCC1 ZINC000336692654 350448122 /nfs/dbraw/zinc/44/81/22/350448122.db2.gz PTSODPRYUVXMMN-UHFFFAOYSA-N 1 2 209.293 2.000 20 0 BEADLO CC[N@H+](Cc1noc(C2CC2)n1)C1CCC1 ZINC000336693768 350450188 /nfs/dbraw/zinc/45/01/88/350450188.db2.gz DWBAASOXBPVAER-UHFFFAOYSA-N 1 2 221.304 2.321 20 0 BEADLO CC[N@@H+](Cc1noc(C2CC2)n1)C1CCC1 ZINC000336693768 350450191 /nfs/dbraw/zinc/45/01/91/350450191.db2.gz DWBAASOXBPVAER-UHFFFAOYSA-N 1 2 221.304 2.321 20 0 BEADLO CC[N@H+](Cc1cc(C)no1)Cc1ccncc1 ZINC000336708105 350460390 /nfs/dbraw/zinc/46/03/90/350460390.db2.gz PCHIOVNLONJOGS-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1cc(C)no1)Cc1ccncc1 ZINC000336708105 350460392 /nfs/dbraw/zinc/46/03/92/350460392.db2.gz PCHIOVNLONJOGS-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO Cc1nn(C)cc1C[N@H+](C)Cc1ccccc1F ZINC000014191854 180373587 /nfs/dbraw/zinc/37/35/87/180373587.db2.gz SSMFYOGTSDPFSS-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1nn(C)cc1C[N@@H+](C)Cc1ccccc1F ZINC000014191854 180373591 /nfs/dbraw/zinc/37/35/91/180373591.db2.gz SSMFYOGTSDPFSS-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO COC(=O)[C@@H]([NH2+]CCC(F)(F)F)C(C)(C)C ZINC000309449198 350499964 /nfs/dbraw/zinc/49/99/64/350499964.db2.gz KPYUCKXANCZIEJ-SSDOTTSWSA-N 1 2 241.253 2.116 20 0 BEADLO Cc1nc(C[N@@H+](CCC(C)C)C2CC2)no1 ZINC000051882356 350540793 /nfs/dbraw/zinc/54/07/93/350540793.db2.gz FWPYOQKOORYJJI-UHFFFAOYSA-N 1 2 223.320 2.389 20 0 BEADLO Cc1nc(C[N@H+](CCC(C)C)C2CC2)no1 ZINC000051882356 350540797 /nfs/dbraw/zinc/54/07/97/350540797.db2.gz FWPYOQKOORYJJI-UHFFFAOYSA-N 1 2 223.320 2.389 20 0 BEADLO COc1c(C)[nH+]c(C2CC2)nc1N[C@H]1CC[C@@H]1C ZINC000580784281 350532470 /nfs/dbraw/zinc/53/24/70/350532470.db2.gz RZEHOYJAHKVSJL-KWQFWETISA-N 1 2 247.342 2.303 20 0 BEADLO CC[C@@H]1[C@H](C)CCN1C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000577498156 365970603 /nfs/dbraw/zinc/97/06/03/365970603.db2.gz LZXOHJRVSPLSGL-FRRDWIJNSA-N 1 2 249.358 2.481 20 0 BEADLO CCCC[C@@H](C)C(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000337540982 350593868 /nfs/dbraw/zinc/59/38/68/350593868.db2.gz YZXYETZVGUJTOG-GHMZBOCLSA-N 1 2 249.358 2.210 20 0 BEADLO CCCC[C@@H](C)C(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000337540982 350593871 /nfs/dbraw/zinc/59/38/71/350593871.db2.gz YZXYETZVGUJTOG-GHMZBOCLSA-N 1 2 249.358 2.210 20 0 BEADLO CCCC[C@@H](C)C(=O)N[C@H]1CCn2cc[nH+]c2C1 ZINC000337589686 350598313 /nfs/dbraw/zinc/59/83/13/350598313.db2.gz HKFNQCYKHCSRFF-NEPJUHHUSA-N 1 2 249.358 2.140 20 0 BEADLO CCc1noc([C@@H](C)[N@@H+]2CC[C@H](C(F)F)C2)n1 ZINC000677735475 490654212 /nfs/dbraw/zinc/65/42/12/490654212.db2.gz QVNKNWUSELZNCX-SFYZADRCSA-N 1 2 245.273 2.280 20 0 BEADLO CCc1noc([C@@H](C)[N@H+]2CC[C@H](C(F)F)C2)n1 ZINC000677735475 490654217 /nfs/dbraw/zinc/65/42/17/490654217.db2.gz QVNKNWUSELZNCX-SFYZADRCSA-N 1 2 245.273 2.280 20 0 BEADLO CC(C)(C)CCCNC(=O)CCn1cc[nH+]c1 ZINC000606872999 350619638 /nfs/dbraw/zinc/61/96/38/350619638.db2.gz QDIZNARHHBCODL-UHFFFAOYSA-N 1 2 237.347 2.216 20 0 BEADLO Cc1cnc(C[NH2+][C@@H]2CCc3c2cccc3O)o1 ZINC000231637184 350632218 /nfs/dbraw/zinc/63/22/18/350632218.db2.gz JVPZKQASTBPMJH-GFCCVEGCSA-N 1 2 244.294 2.466 20 0 BEADLO Cc1cc(C)c(CNC(=O)N2CCCC2)c[nH+]1 ZINC000334504912 350673763 /nfs/dbraw/zinc/67/37/63/350673763.db2.gz JFIGBFZXVOXIJS-UHFFFAOYSA-N 1 2 233.315 2.004 20 0 BEADLO CC[N@H+](Cc1ncnn1C(C)(C)C)C1CC1 ZINC000338265025 350675567 /nfs/dbraw/zinc/67/55/67/350675567.db2.gz RZBAEVVFWCESNB-UHFFFAOYSA-N 1 2 222.336 2.017 20 0 BEADLO CC[N@@H+](Cc1ncnn1C(C)(C)C)C1CC1 ZINC000338265025 350675569 /nfs/dbraw/zinc/67/55/69/350675569.db2.gz RZBAEVVFWCESNB-UHFFFAOYSA-N 1 2 222.336 2.017 20 0 BEADLO CC(C)[N@H+](Cc1cncc(Cl)c1)C1COC1 ZINC000621298381 350724138 /nfs/dbraw/zinc/72/41/38/350724138.db2.gz UHCUGABNLJDXPM-UHFFFAOYSA-N 1 2 240.734 2.344 20 0 BEADLO CC(C)[N@@H+](Cc1cncc(Cl)c1)C1COC1 ZINC000621298381 350724143 /nfs/dbraw/zinc/72/41/43/350724143.db2.gz UHCUGABNLJDXPM-UHFFFAOYSA-N 1 2 240.734 2.344 20 0 BEADLO C[C@H]1CC(C)(C)CC[C@H]1[NH2+]Cc1c[nH]nn1 ZINC000334622623 350726115 /nfs/dbraw/zinc/72/61/15/350726115.db2.gz BVNDQCIDFHXBLS-GXSJLCMTSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@H]1CC(C)(C)CC[C@H]1[NH2+]Cc1cn[nH]n1 ZINC000334622623 350726117 /nfs/dbraw/zinc/72/61/17/350726117.db2.gz BVNDQCIDFHXBLS-GXSJLCMTSA-N 1 2 222.336 2.109 20 0 BEADLO COC[C@@H]([NH2+]Cc1cccnc1)c1ccco1 ZINC000177574157 366009597 /nfs/dbraw/zinc/00/95/97/366009597.db2.gz YFSJLFSXNGYENN-GFCCVEGCSA-N 1 2 232.283 2.152 20 0 BEADLO C[C@@H]([NH2+]Cc1cnc(C2CC2)o1)c1ccn(C)n1 ZINC000628309273 350785114 /nfs/dbraw/zinc/78/51/14/350785114.db2.gz LOOXGIIYINWQOQ-SECBINFHSA-N 1 2 246.314 2.136 20 0 BEADLO C[C@@H]1CCCCN1c1cc(-n2cc[nH+]c2)ncn1 ZINC000607141854 350941853 /nfs/dbraw/zinc/94/18/53/350941853.db2.gz WJAPINSXKLMGHR-LLVKDONJSA-N 1 2 243.314 2.041 20 0 BEADLO C[C@H](c1nc(C2CC2)no1)[NH+]1CCSCC1 ZINC000051914902 350870741 /nfs/dbraw/zinc/87/07/41/350870741.db2.gz AGHBUZXIPHVXGI-MRVPVSSYSA-N 1 2 239.344 2.057 20 0 BEADLO CC[C@H]1C[NH+](Cc2cnc(C)o2)C[C@H](CC)O1 ZINC000628315219 350875115 /nfs/dbraw/zinc/87/51/15/350875115.db2.gz CXQVZTLJBGRGRW-RYUDHWBXSA-N 1 2 238.331 2.372 20 0 BEADLO CC(C)[C@@H]1CC[C@H]([NH2+]Cc2c[nH]nn2)C[C@@H]1C ZINC000623577863 363010189 /nfs/dbraw/zinc/01/01/89/363010189.db2.gz JKCIJJODUJDQFY-GVXVVHGQSA-N 1 2 236.363 2.355 20 0 BEADLO CC(C)[C@@H]1CC[C@H]([NH2+]Cc2cn[nH]n2)C[C@@H]1C ZINC000623577863 363010194 /nfs/dbraw/zinc/01/01/94/363010194.db2.gz JKCIJJODUJDQFY-GVXVVHGQSA-N 1 2 236.363 2.355 20 0 BEADLO C[C@H]1C[C@@H]1Nc1[nH+]c(C2CC2)nc2[nH]ccc21 ZINC000631096117 351074752 /nfs/dbraw/zinc/07/47/52/351074752.db2.gz AHEGCOIKVYGSRY-XVKPBYJWSA-N 1 2 228.299 2.078 20 0 BEADLO CC1(C)CCC[C@@H](C[NH2+]Cc2c[nH]nn2)C1 ZINC000623578154 363009732 /nfs/dbraw/zinc/00/97/32/363009732.db2.gz XAYPGTWCKADVED-SNVBAGLBSA-N 1 2 222.336 2.111 20 0 BEADLO CC1(C)CCC[C@@H](C[NH2+]Cc2cn[nH]n2)C1 ZINC000623578154 363009737 /nfs/dbraw/zinc/00/97/37/363009737.db2.gz XAYPGTWCKADVED-SNVBAGLBSA-N 1 2 222.336 2.111 20 0 BEADLO CC[C@@H]1CCC[C@H]([NH2+]Cc2c[nH]nn2)CC1 ZINC000398415820 351142478 /nfs/dbraw/zinc/14/24/78/351142478.db2.gz SJUMMKZETJTDBA-MNOVXSKESA-N 1 2 222.336 2.253 20 0 BEADLO CC[C@@H]1CCC[C@H]([NH2+]Cc2cn[nH]n2)CC1 ZINC000398415820 351142483 /nfs/dbraw/zinc/14/24/83/351142483.db2.gz SJUMMKZETJTDBA-MNOVXSKESA-N 1 2 222.336 2.253 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@@H+]1Cc1nc(C)c[nH]1 ZINC000628324163 351236042 /nfs/dbraw/zinc/23/60/42/351236042.db2.gz GZURBBGPGRZEAA-NSHDSACASA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@H+]1Cc1nc(C)c[nH]1 ZINC000628324163 351236045 /nfs/dbraw/zinc/23/60/45/351236045.db2.gz GZURBBGPGRZEAA-NSHDSACASA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@H]1CN(Cc2[nH]c(C)c(C)[nH+]2)[C@H](C)CO1 ZINC000628324471 351236570 /nfs/dbraw/zinc/23/65/70/351236570.db2.gz VFQANFPPFNRAAH-SKDRFNHKSA-N 1 2 237.347 2.026 20 0 BEADLO CC[N@@H+]1CCO[C@@H](c2ccccc2OC)C1 ZINC000616675400 351243088 /nfs/dbraw/zinc/24/30/88/351243088.db2.gz BBODWACLOCHYGF-CYBMUJFWSA-N 1 2 221.300 2.088 20 0 BEADLO CC[N@H+]1CCO[C@@H](c2ccccc2OC)C1 ZINC000616675400 351243089 /nfs/dbraw/zinc/24/30/89/351243089.db2.gz BBODWACLOCHYGF-CYBMUJFWSA-N 1 2 221.300 2.088 20 0 BEADLO Cc1ncc(C[N@H+]2C[C@@H](C)OCC23CCC3)o1 ZINC000628325192 351251090 /nfs/dbraw/zinc/25/10/90/351251090.db2.gz BFSKHIZRWMPJHE-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1ncc(C[N@@H+]2C[C@@H](C)OCC23CCC3)o1 ZINC000628325192 351251091 /nfs/dbraw/zinc/25/10/91/351251091.db2.gz BFSKHIZRWMPJHE-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1cc(C)on1 ZINC000265000207 351260276 /nfs/dbraw/zinc/26/02/76/351260276.db2.gz DQPPANRIWSYLDA-UHFFFAOYSA-N 1 2 231.255 2.193 20 0 BEADLO FC(F)C[NH+]1CCc2ccccc2CC1 ZINC000222913461 351260477 /nfs/dbraw/zinc/26/04/77/351260477.db2.gz OCEUSRPGHIZCHZ-UHFFFAOYSA-N 1 2 211.255 2.352 20 0 BEADLO CC1(C)C[N@H+](Cc2cscn2)CCS1 ZINC000267653372 351318671 /nfs/dbraw/zinc/31/86/71/351318671.db2.gz YEJMBCJZFGELMN-UHFFFAOYSA-N 1 2 228.386 2.471 20 0 BEADLO CC1(C)C[N@@H+](Cc2cscn2)CCS1 ZINC000267653372 351318674 /nfs/dbraw/zinc/31/86/74/351318674.db2.gz YEJMBCJZFGELMN-UHFFFAOYSA-N 1 2 228.386 2.471 20 0 BEADLO CCc1cc(N[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)nc[nH+]1 ZINC000607356661 351331016 /nfs/dbraw/zinc/33/10/16/351331016.db2.gz XPCNXMRKYOMCTH-UHTWSYAYSA-N 1 2 247.342 2.264 20 0 BEADLO CC[C@@H]1CCCN(C(=O)CCn2cc[nH+]c2)CC1 ZINC000265269444 351267332 /nfs/dbraw/zinc/26/73/32/351267332.db2.gz GFHFHNWGGLUKOL-CYBMUJFWSA-N 1 2 249.358 2.312 20 0 BEADLO Clc1cc(Cn2cc[nH+]c2)cc2c1OCO2 ZINC000072558642 351273268 /nfs/dbraw/zinc/27/32/68/351273268.db2.gz RSGVJIKJSPUIQK-UHFFFAOYSA-N 1 2 236.658 2.314 20 0 BEADLO CCCCc1cc(N[C@H](CC)CCO)nc[nH+]1 ZINC000631126316 351365767 /nfs/dbraw/zinc/36/57/67/351365767.db2.gz IRUDBJRQQCFFOD-LLVKDONJSA-N 1 2 237.347 2.392 20 0 BEADLO c1ccc2cc(N[C@@H]3CCOC3)[nH+]cc2c1 ZINC000631178719 351380751 /nfs/dbraw/zinc/38/07/51/351380751.db2.gz KUCONZKALZMDQF-GFCCVEGCSA-N 1 2 214.268 2.436 20 0 BEADLO CC[N@H+](Cc1ccon1)Cc1ccncc1 ZINC000270968035 351392092 /nfs/dbraw/zinc/39/20/92/351392092.db2.gz BVNICZIZXSXBBS-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO CC[N@@H+](Cc1ccon1)Cc1ccncc1 ZINC000270968035 351392097 /nfs/dbraw/zinc/39/20/97/351392097.db2.gz BVNICZIZXSXBBS-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO CC1(C)C[NH+](Cc2ccon2)CC(C)(C)O1 ZINC000276132987 351611219 /nfs/dbraw/zinc/61/12/19/351611219.db2.gz BACUPAFPQVMRAB-UHFFFAOYSA-N 1 2 224.304 2.064 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000276547958 351631692 /nfs/dbraw/zinc/63/16/92/351631692.db2.gz HBMMRBPZGUJHFI-XIJCSBCJSA-N 1 2 233.315 2.118 20 0 BEADLO CC[C@H](NC(=O)C[C@H](C)n1cc[nH+]c1)C1CC1 ZINC000618861120 351748965 /nfs/dbraw/zinc/74/89/65/351748965.db2.gz UKXJATQQURHJAD-JQWIXIFHSA-N 1 2 235.331 2.139 20 0 BEADLO CC[C@H]1COCC[N@@H+]1[C@H](C)c1cnc(C)nc1C ZINC000637948414 351822166 /nfs/dbraw/zinc/82/21/66/351822166.db2.gz MYMASCVPVXZZSY-YPMHNXCESA-N 1 2 249.358 2.265 20 0 BEADLO CC[C@H]1COCC[N@H+]1[C@H](C)c1cnc(C)nc1C ZINC000637948414 351822167 /nfs/dbraw/zinc/82/21/67/351822167.db2.gz MYMASCVPVXZZSY-YPMHNXCESA-N 1 2 249.358 2.265 20 0 BEADLO C[C@@H]1CCC[C@H](C(=O)N2CC(n3cc[nH+]c3)C2)C1 ZINC000607651302 351827054 /nfs/dbraw/zinc/82/70/54/351827054.db2.gz PEKHUNVKGNHMLG-NEPJUHHUSA-N 1 2 247.342 2.093 20 0 BEADLO Cc1ncc([C@H](C)[N@@H+]2C[C@@H](C)OC[C@H]2C)c(C)n1 ZINC000637930697 351807220 /nfs/dbraw/zinc/80/72/20/351807220.db2.gz SEGHHGQKCWDMQJ-FOGDFJRCSA-N 1 2 249.358 2.264 20 0 BEADLO Cc1ncc([C@H](C)[N@H+]2C[C@@H](C)OC[C@H]2C)c(C)n1 ZINC000637930697 351807222 /nfs/dbraw/zinc/80/72/22/351807222.db2.gz SEGHHGQKCWDMQJ-FOGDFJRCSA-N 1 2 249.358 2.264 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@](C)(CC)OC ZINC000280733069 351858262 /nfs/dbraw/zinc/85/82/62/351858262.db2.gz LNDBAJJBJWRBNU-ZDUSSCGKSA-N 1 2 236.315 2.398 20 0 BEADLO CCC[C@H](C[N@@H+]1CCC[C@@H]1c1ncon1)OC ZINC000637997321 351874486 /nfs/dbraw/zinc/87/44/86/351874486.db2.gz ATGRFLFJIYLSNY-GHMZBOCLSA-N 1 2 239.319 2.022 20 0 BEADLO CCC[C@H](C[N@H+]1CCC[C@@H]1c1ncon1)OC ZINC000637997321 351874489 /nfs/dbraw/zinc/87/44/89/351874489.db2.gz ATGRFLFJIYLSNY-GHMZBOCLSA-N 1 2 239.319 2.022 20 0 BEADLO CCCC[C@H](C)C(=O)NCCNc1cccc[nH+]1 ZINC000282146136 351924565 /nfs/dbraw/zinc/92/45/65/351924565.db2.gz LKSYQCLISJQBTC-LBPRGKRZSA-N 1 2 249.358 2.436 20 0 BEADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1cc[nH]n1 ZINC000283931850 351987140 /nfs/dbraw/zinc/98/71/40/351987140.db2.gz KPKKCTUAPGTBNY-ZDUSSCGKSA-N 1 2 230.315 2.388 20 0 BEADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1cc[nH]n1 ZINC000283931850 351987143 /nfs/dbraw/zinc/98/71/43/351987143.db2.gz KPKKCTUAPGTBNY-ZDUSSCGKSA-N 1 2 230.315 2.388 20 0 BEADLO CC[C@@H]([NH2+]Cc1nccs1)c1ccn(C)n1 ZINC000336738398 351999621 /nfs/dbraw/zinc/99/96/21/351999621.db2.gz OFAVWQASENMEOL-SECBINFHSA-N 1 2 236.344 2.118 20 0 BEADLO CC1(C)CCC[C@@H](NC(=O)CCc2[nH]cc[nH+]2)C1 ZINC000289121043 352172142 /nfs/dbraw/zinc/17/21/42/352172142.db2.gz QJCFSIWVKMNQJD-LLVKDONJSA-N 1 2 249.358 2.427 20 0 BEADLO CCOC(=O)C(C)(C)[N@H+](C)Cc1ccco1 ZINC000093359375 352206974 /nfs/dbraw/zinc/20/69/74/352206974.db2.gz DAUPDYVLCSCHDN-UHFFFAOYSA-N 1 2 225.288 2.053 20 0 BEADLO CCOC(=O)C(C)(C)[N@@H+](C)Cc1ccco1 ZINC000093359375 352206977 /nfs/dbraw/zinc/20/69/77/352206977.db2.gz DAUPDYVLCSCHDN-UHFFFAOYSA-N 1 2 225.288 2.053 20 0 BEADLO CC[N@H+](Cc1cc[nH]n1)[C@@H](C)c1cccnc1 ZINC000290328780 352220290 /nfs/dbraw/zinc/22/02/90/352220290.db2.gz DNRPETYRCLLWIW-NSHDSACASA-N 1 2 230.315 2.388 20 0 BEADLO CC[N@@H+](Cc1cc[nH]n1)[C@@H](C)c1cccnc1 ZINC000290328780 352220295 /nfs/dbraw/zinc/22/02/95/352220295.db2.gz DNRPETYRCLLWIW-NSHDSACASA-N 1 2 230.315 2.388 20 0 BEADLO Cc1nnc(C[NH+]2CCC(C)(F)CC2)s1 ZINC000630073911 363157457 /nfs/dbraw/zinc/15/74/57/363157457.db2.gz YHVUKJCJKPYFAD-UHFFFAOYSA-N 1 2 229.324 2.171 20 0 BEADLO CCCC[C@H](C)C(=O)N1CCn2c[nH+]cc2C1 ZINC000290915575 352249124 /nfs/dbraw/zinc/24/91/24/352249124.db2.gz JQPWHTFVNABGEM-NSHDSACASA-N 1 2 235.331 2.052 20 0 BEADLO CC1(C)CN(C(=O)C=Cc2c[nH]c[nH+]2)[C@H]1C1CC1 ZINC000291988395 352297670 /nfs/dbraw/zinc/29/76/70/352297670.db2.gz WAMCCPIOCQMXRJ-GFUIURDCSA-N 1 2 245.326 2.070 20 0 BEADLO CC[N@H+](Cc1ccncc1)[C@H](C)c1nnc(C)[nH]1 ZINC000411425242 191185782 /nfs/dbraw/zinc/18/57/82/191185782.db2.gz MDUDLYNVRCPXLJ-SNVBAGLBSA-N 1 2 245.330 2.091 20 0 BEADLO CC[N@@H+](Cc1ccncc1)[C@H](C)c1nnc(C)[nH]1 ZINC000411425242 191185785 /nfs/dbraw/zinc/18/57/85/191185785.db2.gz MDUDLYNVRCPXLJ-SNVBAGLBSA-N 1 2 245.330 2.091 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)N(C)Cc1[nH+]ccn1C ZINC000294252215 352373442 /nfs/dbraw/zinc/37/34/42/352373442.db2.gz CVDWKRUNOZNETR-VXGBXAGGSA-N 1 2 249.358 2.205 20 0 BEADLO CO[C@]1(C)CCCN(c2cccc[nH+]2)CC1 ZINC000280281917 187689937 /nfs/dbraw/zinc/68/99/37/187689937.db2.gz PVAQSZPWSXOVFS-CYBMUJFWSA-N 1 2 220.316 2.477 20 0 BEADLO OC1(CC[N@@H+]2CCCC[C@H]2C(F)F)CCC1 ZINC000411694432 191205066 /nfs/dbraw/zinc/20/50/66/191205066.db2.gz RNFITUSRHHJION-JTQLQIEISA-N 1 2 233.302 2.411 20 0 BEADLO OC1(CC[N@H+]2CCCC[C@H]2C(F)F)CCC1 ZINC000411694432 191205068 /nfs/dbraw/zinc/20/50/68/191205068.db2.gz RNFITUSRHHJION-JTQLQIEISA-N 1 2 233.302 2.411 20 0 BEADLO CCN1CC[NH+](Cc2ccc(C(C)=O)cc2)CC1 ZINC000296229787 352440209 /nfs/dbraw/zinc/44/02/09/352440209.db2.gz DWGRMKSAZOOPLE-UHFFFAOYSA-N 1 2 246.354 2.027 20 0 BEADLO CC(C)[C@H](Nc1ncc(F)cn1)c1[nH]cc[nH+]1 ZINC000291205068 187696482 /nfs/dbraw/zinc/69/64/82/187696482.db2.gz UUYXICFBSOHMON-VIFPVBQESA-N 1 2 235.266 2.148 20 0 BEADLO COC(=O)c1cc(C[N@@H+]2CC[C@@H](F)C2)cs1 ZINC000411774533 191211067 /nfs/dbraw/zinc/21/10/67/191211067.db2.gz OZLCEGVUGVSCCE-SECBINFHSA-N 1 2 243.303 2.079 20 0 BEADLO COC(=O)c1cc(C[N@H+]2CC[C@@H](F)C2)cs1 ZINC000411774533 191211069 /nfs/dbraw/zinc/21/10/69/191211069.db2.gz OZLCEGVUGVSCCE-SECBINFHSA-N 1 2 243.303 2.079 20 0 BEADLO Cn1cc[nH+]c1C[S@@](=O)C1CCCCC1 ZINC000129314506 180751366 /nfs/dbraw/zinc/75/13/66/180751366.db2.gz DYASQSKGBVVIKH-HNNXBMFYSA-N 1 2 226.345 2.002 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1NC(=O)CCn1cc[nH+]c1 ZINC000299694450 352544829 /nfs/dbraw/zinc/54/48/29/352544829.db2.gz XKJSRMMXDAEXHH-OLZOCXBDSA-N 1 2 249.358 2.358 20 0 BEADLO C[C@@H]1CCC[C@@H](CCNC(=O)Cn2cc[nH+]c2)C1 ZINC000073732225 352672708 /nfs/dbraw/zinc/67/27/08/352672708.db2.gz GWGASHRHXMIQBK-OLZOCXBDSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1cc(C[NH2+][C@H]2CCCc3cn[nH]c32)sn1 ZINC000638768947 352710542 /nfs/dbraw/zinc/71/05/42/352710542.db2.gz HPTOZSACTIFDSH-NSHDSACASA-N 1 2 248.355 2.342 20 0 BEADLO CO[C@@H](CNc1ccc[nH+]c1C)C1CC1 ZINC000638786783 352742662 /nfs/dbraw/zinc/74/26/62/352742662.db2.gz QVFRYWMYCCGCPD-LBPRGKRZSA-N 1 2 206.289 2.227 20 0 BEADLO Cc1nc(N2CCC[C@H]2C2CC2)cc[nH+]1 ZINC000608082663 352746989 /nfs/dbraw/zinc/74/69/89/352746989.db2.gz JWLZURDSNYPZGX-NSHDSACASA-N 1 2 203.289 2.164 20 0 BEADLO Cc1cc(N2CC[C@H](C3CC3)C2)nc[nH+]1 ZINC000334186759 352776545 /nfs/dbraw/zinc/77/65/45/352776545.db2.gz GVIYWGXDPDRDHG-NSHDSACASA-N 1 2 203.289 2.021 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCOCC12CCC2 ZINC000334174509 352758957 /nfs/dbraw/zinc/75/89/57/352758957.db2.gz CAVWIWZPFGPRDR-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCOCC12CCC2 ZINC000334174509 352758962 /nfs/dbraw/zinc/75/89/62/352758962.db2.gz CAVWIWZPFGPRDR-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO CC1(C)C[C@@H]1CNC(=O)c1ccc2[nH+]ccn2c1 ZINC000334218435 352819640 /nfs/dbraw/zinc/81/96/40/352819640.db2.gz DWESWOVJQKKNSQ-LLVKDONJSA-N 1 2 243.310 2.110 20 0 BEADLO Cc1csc(COc2cc[nH+]cc2)n1 ZINC000335812650 133920219 /nfs/dbraw/zinc/92/02/19/133920219.db2.gz XUSQMFDKYGFKGA-UHFFFAOYSA-N 1 2 206.270 2.426 20 0 BEADLO CC(C)n1nccc1C[N@H+]1[C@H](C)COC[C@@H]1C ZINC000334239877 352859634 /nfs/dbraw/zinc/85/96/34/352859634.db2.gz LMPVBCLIJWTNJJ-TXEJJXNPSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1[C@H](C)COC[C@@H]1C ZINC000334239877 352859636 /nfs/dbraw/zinc/85/96/36/352859636.db2.gz LMPVBCLIJWTNJJ-TXEJJXNPSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)n1nccc1C[NH+]1[C@@H](C)COC[C@@H]1C ZINC000334239876 352859692 /nfs/dbraw/zinc/85/96/92/352859692.db2.gz LMPVBCLIJWTNJJ-RYUDHWBXSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)c1noc(C[N@@H+]2C[C@@H](C)[C@H]2C)n1 ZINC000334229080 352845959 /nfs/dbraw/zinc/84/59/59/352845959.db2.gz HSDKLHJDBJWYHC-RKDXNWHRSA-N 1 2 209.293 2.033 20 0 BEADLO CC(C)c1noc(C[N@H+]2C[C@@H](C)[C@H]2C)n1 ZINC000334229080 352845962 /nfs/dbraw/zinc/84/59/62/352845962.db2.gz HSDKLHJDBJWYHC-RKDXNWHRSA-N 1 2 209.293 2.033 20 0 BEADLO CC(C)(C(=O)Nc1cccc(F)c1)c1c[nH+]c[nH]1 ZINC000334290044 352929307 /nfs/dbraw/zinc/92/93/07/352929307.db2.gz BWKRXUMVQMZXMH-UHFFFAOYSA-N 1 2 247.273 2.465 20 0 BEADLO CC(C)(C(=O)Nc1cccc(F)c1)c1c[nH]c[nH+]1 ZINC000334290044 352929310 /nfs/dbraw/zinc/92/93/10/352929310.db2.gz BWKRXUMVQMZXMH-UHFFFAOYSA-N 1 2 247.273 2.465 20 0 BEADLO C[C@H]1C[N@H+](CCc2cccc(F)c2F)CCO1 ZINC000334293055 352930138 /nfs/dbraw/zinc/93/01/38/352930138.db2.gz PCCVCLIABNLVEI-JTQLQIEISA-N 1 2 241.281 2.228 20 0 BEADLO C[C@H]1C[N@@H+](CCc2cccc(F)c2F)CCO1 ZINC000334293055 352930139 /nfs/dbraw/zinc/93/01/39/352930139.db2.gz PCCVCLIABNLVEI-JTQLQIEISA-N 1 2 241.281 2.228 20 0 BEADLO Cc1ccc(C[N@@H+]2CC[S@](=O)[C@H](C)C2)s1 ZINC000334263435 352897043 /nfs/dbraw/zinc/89/70/43/352897043.db2.gz WGDRGZLJTHZMCH-BMIGLBTASA-N 1 2 243.397 2.009 20 0 BEADLO Cc1ccc(C[N@H+]2CC[S@](=O)[C@H](C)C2)s1 ZINC000334263435 352897044 /nfs/dbraw/zinc/89/70/44/352897044.db2.gz WGDRGZLJTHZMCH-BMIGLBTASA-N 1 2 243.397 2.009 20 0 BEADLO CCn1nccc1C[N@@H+]1CCOCC12CCCC2 ZINC000334311699 352943388 /nfs/dbraw/zinc/94/33/88/352943388.db2.gz GVSRAJVAOXVFDL-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CCn1nccc1C[N@H+]1CCOCC12CCCC2 ZINC000334311699 352943392 /nfs/dbraw/zinc/94/33/92/352943392.db2.gz GVSRAJVAOXVFDL-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CC(C)([NH2+]Cc1cncs1)C(F)F ZINC000379411839 538106461 /nfs/dbraw/zinc/10/64/61/538106461.db2.gz IZHCTHLSKHAMBP-UHFFFAOYSA-N 1 2 206.261 2.276 20 0 BEADLO CO[C@](C)(C[N@@H+]1CCC(F)(F)C1)C1CC1 ZINC000638842305 353018723 /nfs/dbraw/zinc/01/87/23/353018723.db2.gz OKXMZCYYPPPSBS-SNVBAGLBSA-N 1 2 219.275 2.143 20 0 BEADLO CO[C@](C)(C[N@H+]1CCC(F)(F)C1)C1CC1 ZINC000638842305 353018724 /nfs/dbraw/zinc/01/87/24/353018724.db2.gz OKXMZCYYPPPSBS-SNVBAGLBSA-N 1 2 219.275 2.143 20 0 BEADLO CCn1ccnc1C[N@@H+]1CCOCC12CCCC2 ZINC000334372187 353023728 /nfs/dbraw/zinc/02/37/28/353023728.db2.gz QYWMFQIGOHOHOI-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CCn1ccnc1C[N@H+]1CCOCC12CCCC2 ZINC000334372187 353023730 /nfs/dbraw/zinc/02/37/30/353023730.db2.gz QYWMFQIGOHOHOI-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CCn1cc[nH+]c1CN1CCOCC12CCCC2 ZINC000334372187 353023733 /nfs/dbraw/zinc/02/37/33/353023733.db2.gz QYWMFQIGOHOHOI-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO Cn1cccc1C[N@@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000334375990 353032782 /nfs/dbraw/zinc/03/27/82/353032782.db2.gz DVVONAQFNAEEEP-LBPRGKRZSA-N 1 2 230.315 2.085 20 0 BEADLO Cn1cccc1C[N@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000334375990 353032786 /nfs/dbraw/zinc/03/27/86/353032786.db2.gz DVVONAQFNAEEEP-LBPRGKRZSA-N 1 2 230.315 2.085 20 0 BEADLO COc1ccc[nH+]c1NCCC[C@@H]1CCO1 ZINC000638825097 353005984 /nfs/dbraw/zinc/00/59/84/353005984.db2.gz YQHPFISUJFXTTD-SNVBAGLBSA-N 1 2 222.288 2.071 20 0 BEADLO Cc1cc(NC(=O)[C@H]2Cc3ccccc32)cc[nH+]1 ZINC000334425342 353103846 /nfs/dbraw/zinc/10/38/46/353103846.db2.gz UPBRBKRADHNWOG-AWEZNQCLSA-N 1 2 238.290 2.090 20 0 BEADLO C[C@H]1Oc2cc(F)ccc2[C@@H]1[NH2+]Cc1ncc[nH]1 ZINC000334430109 353105261 /nfs/dbraw/zinc/10/52/61/353105261.db2.gz UXBOAPVGSMHJLS-AMIZOPFISA-N 1 2 247.273 2.161 20 0 BEADLO C[N@H+](Cc1ccns1)Cc1cccnc1 ZINC000638919995 353078679 /nfs/dbraw/zinc/07/86/79/353078679.db2.gz XEYPYLXNDCUFSZ-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO C[N@@H+](Cc1ccns1)Cc1cccnc1 ZINC000638919995 353078680 /nfs/dbraw/zinc/07/86/80/353078680.db2.gz XEYPYLXNDCUFSZ-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO COc1ncc(C[N@H+](C)Cc2cccnc2)s1 ZINC000638919524 353084305 /nfs/dbraw/zinc/08/43/05/353084305.db2.gz QVWPPRKTFUUISD-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1ncc(C[N@@H+](C)Cc2cccnc2)s1 ZINC000638919524 353084306 /nfs/dbraw/zinc/08/43/06/353084306.db2.gz QVWPPRKTFUUISD-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO CC(C)CCn1ccc(N[C@@H](C)c2[nH]cc[nH+]2)n1 ZINC000428439654 538108119 /nfs/dbraw/zinc/10/81/19/538108119.db2.gz CJAVKCFXHUOYOX-NSHDSACASA-N 1 2 247.346 2.247 20 0 BEADLO Cc1cc(N[C@H]2CSC[C@H]2C)nc(C2CC2)[nH+]1 ZINC000334408194 353089653 /nfs/dbraw/zinc/08/96/53/353089653.db2.gz HVOKWKSQEZVOPS-KCJUWKMLSA-N 1 2 249.383 2.248 20 0 BEADLO C=Cn1cc(C[N@H+](C)Cc2cnc(C)s2)cn1 ZINC000193779226 188005633 /nfs/dbraw/zinc/00/56/33/188005633.db2.gz UJINAJPPFNJCGJ-UHFFFAOYSA-N 1 2 248.355 2.381 20 0 BEADLO C=Cn1cc(C[N@@H+](C)Cc2cnc(C)s2)cn1 ZINC000193779226 188005635 /nfs/dbraw/zinc/00/56/35/188005635.db2.gz UJINAJPPFNJCGJ-UHFFFAOYSA-N 1 2 248.355 2.381 20 0 BEADLO CC(C)N1CC[N@@H+]([C@@H](C)c2ccccc2)CC1=O ZINC000272483803 188026326 /nfs/dbraw/zinc/02/63/26/188026326.db2.gz BLJIAGJVSIDAMA-ZDUSSCGKSA-N 1 2 246.354 2.300 20 0 BEADLO CC(C)N1CC[N@H+]([C@@H](C)c2ccccc2)CC1=O ZINC000272483803 188026328 /nfs/dbraw/zinc/02/63/28/188026328.db2.gz BLJIAGJVSIDAMA-ZDUSSCGKSA-N 1 2 246.354 2.300 20 0 BEADLO CC(C)C[C@@H](CO)N(C)c1[nH]c2ccccc2[nH+]1 ZINC000274748616 188028065 /nfs/dbraw/zinc/02/80/65/188028065.db2.gz OWYXDNMOVGRGHA-NSHDSACASA-N 1 2 247.342 2.406 20 0 BEADLO CC[C@@H](C)CCC(=O)NCCNc1cccc[nH+]1 ZINC000287042708 188034816 /nfs/dbraw/zinc/03/48/16/188034816.db2.gz JRJBXNWWFYUQJZ-GFCCVEGCSA-N 1 2 249.358 2.436 20 0 BEADLO COc1ccncc1C[N@H+](C)Cc1ccccn1 ZINC000295166227 188038256 /nfs/dbraw/zinc/03/82/56/188038256.db2.gz NUPRXRHWSLZLMH-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1ccncc1C[N@@H+](C)Cc1ccccn1 ZINC000295166227 188038257 /nfs/dbraw/zinc/03/82/57/188038257.db2.gz NUPRXRHWSLZLMH-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO C1=CCC(Nc2cc[nH+]c(C3CC3)n2)C1 ZINC000163424321 188049173 /nfs/dbraw/zinc/04/91/73/188049173.db2.gz QRZHQEBWOPQZHC-UHFFFAOYSA-N 1 2 201.273 2.485 20 0 BEADLO CC(C)[C@H](NC(=O)[C@@H](C)C1CC1)c1[nH]cc[nH+]1 ZINC000331704062 188053572 /nfs/dbraw/zinc/05/35/72/188053572.db2.gz XMRVVLHGPPJUCK-ONGXEEELSA-N 1 2 235.331 2.269 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](C[C@@H](O)C(F)(F)F)C2 ZINC000336346666 188055391 /nfs/dbraw/zinc/05/53/91/188055391.db2.gz IWAMTKLKADJNOD-LLVKDONJSA-N 1 2 245.244 2.234 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](C[C@@H](O)C(F)(F)F)C2 ZINC000336346666 188055393 /nfs/dbraw/zinc/05/53/93/188055393.db2.gz IWAMTKLKADJNOD-LLVKDONJSA-N 1 2 245.244 2.234 20 0 BEADLO CC[C@H]1CCCN(C(=O)C[C@@H](C)n2cc[nH+]c2)C1 ZINC000577854274 366086025 /nfs/dbraw/zinc/08/60/25/366086025.db2.gz HZNIPQUBZMJFRO-OLZOCXBDSA-N 1 2 249.358 2.483 20 0 BEADLO CCCc1csc(C[N@@H+]2CC[C@@H]2COC)n1 ZINC000354059983 188235433 /nfs/dbraw/zinc/23/54/33/188235433.db2.gz YVBSDQWLVGWROE-LLVKDONJSA-N 1 2 240.372 2.316 20 0 BEADLO CCCc1csc(C[N@H+]2CC[C@@H]2COC)n1 ZINC000354059983 188235435 /nfs/dbraw/zinc/23/54/35/188235435.db2.gz YVBSDQWLVGWROE-LLVKDONJSA-N 1 2 240.372 2.316 20 0 BEADLO COc1ccc(N[C@@H]2CCSC2)[nH+]c1 ZINC000225834433 538114142 /nfs/dbraw/zinc/11/41/42/538114142.db2.gz GYNWVSDWDYASHP-MRVPVSSYSA-N 1 2 210.302 2.008 20 0 BEADLO COc1ccc(N[C@@H]2CCO[C@H](C)C2)[nH+]c1 ZINC000225835385 538114151 /nfs/dbraw/zinc/11/41/51/538114151.db2.gz IJFYJMCQQVCPDW-NXEZZACHSA-N 1 2 222.288 2.070 20 0 BEADLO CN(C)c1ccc(Nc2ncc(Cl)cn2)c[nH+]1 ZINC000359017749 188240234 /nfs/dbraw/zinc/24/02/34/188240234.db2.gz KQJNOIKJGHDFJT-UHFFFAOYSA-N 1 2 249.705 2.335 20 0 BEADLO CC(C)[N@H+](Cc1cccnc1)Cc1ncccn1 ZINC000361866981 188245741 /nfs/dbraw/zinc/24/57/41/188245741.db2.gz XGPPPERJDQBTLY-UHFFFAOYSA-N 1 2 242.326 2.282 20 0 BEADLO CC(C)[N@@H+](Cc1cccnc1)Cc1ncccn1 ZINC000361866981 188245743 /nfs/dbraw/zinc/24/57/43/188245743.db2.gz XGPPPERJDQBTLY-UHFFFAOYSA-N 1 2 242.326 2.282 20 0 BEADLO Oc1ccc(C[N@@H+]2CCCc3[nH]ncc3C2)cc1 ZINC000668840807 538114383 /nfs/dbraw/zinc/11/43/83/538114383.db2.gz JICFUWXRZZPBFS-UHFFFAOYSA-N 1 2 243.310 2.064 20 0 BEADLO Oc1ccc(C[N@H+]2CCCc3[nH]ncc3C2)cc1 ZINC000668840807 538114384 /nfs/dbraw/zinc/11/43/84/538114384.db2.gz JICFUWXRZZPBFS-UHFFFAOYSA-N 1 2 243.310 2.064 20 0 BEADLO Cc1n[nH]cc1C[NH2+][C@@H](C)c1nccs1 ZINC000070621414 188287660 /nfs/dbraw/zinc/28/76/60/188287660.db2.gz SAKXYMDMNOESFL-QMMMGPOBSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1csc(C[NH2+]Cc2cscn2)n1 ZINC000040505575 188306741 /nfs/dbraw/zinc/30/67/41/188306741.db2.gz BANOMQXRJDISLB-UHFFFAOYSA-N 1 2 225.342 2.198 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N(CC1CC1)C1CCC1 ZINC000412306383 191275391 /nfs/dbraw/zinc/27/53/91/191275391.db2.gz KPSKYRGFHWCFKT-UHFFFAOYSA-N 1 2 247.342 2.133 20 0 BEADLO CO[C@@H](C[NH+]1CC(F)C1)C1CCCCC1 ZINC000639036780 353314767 /nfs/dbraw/zinc/31/47/67/353314767.db2.gz CTRFBNDTVUGBRA-LBPRGKRZSA-N 1 2 215.312 2.235 20 0 BEADLO FC1C[NH+](C[C@@H]2CCN(c3ccccc3)C2)C1 ZINC000639039129 353314903 /nfs/dbraw/zinc/31/49/03/353314903.db2.gz QCSMSXHTKGOMDX-LBPRGKRZSA-N 1 2 234.318 2.167 20 0 BEADLO COc1cc(C[N@H+](C)Cc2ccncc2)sn1 ZINC000639041052 353319200 /nfs/dbraw/zinc/31/92/00/353319200.db2.gz QKRAAGJUXKOHRI-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2ccncc2)sn1 ZINC000639041052 353319201 /nfs/dbraw/zinc/31/92/01/353319201.db2.gz QKRAAGJUXKOHRI-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO CC[C@@H](C)C[C@@H](CC)[NH2+]Cc1c[nH]nn1 ZINC000398330122 363218438 /nfs/dbraw/zinc/21/84/38/363218438.db2.gz HPOPIFDEJPKEHD-NXEZZACHSA-N 1 2 210.325 2.109 20 0 BEADLO CC[C@@H](C)C[C@@H](CC)[NH2+]Cc1cn[nH]n1 ZINC000398330122 363218442 /nfs/dbraw/zinc/21/84/42/363218442.db2.gz HPOPIFDEJPKEHD-NXEZZACHSA-N 1 2 210.325 2.109 20 0 BEADLO CC(C)C[C@H](C)NC(=O)c1ccc2[nH+]ccn2c1 ZINC000178692856 188343633 /nfs/dbraw/zinc/34/36/33/188343633.db2.gz YREXEELZNLKLFY-NSHDSACASA-N 1 2 245.326 2.499 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+][C@H](CC)CC(F)(F)F ZINC000309978326 188347475 /nfs/dbraw/zinc/34/74/75/188347475.db2.gz UZKXPYMSIKSSNM-HTQZYQBOSA-N 1 2 241.253 2.259 20 0 BEADLO Cn1c[nH+]cc1CCC(=O)NC1CCCCCC1 ZINC000188414884 188348834 /nfs/dbraw/zinc/34/88/34/188348834.db2.gz UWMAMPNVSSTIOR-UHFFFAOYSA-N 1 2 249.358 2.192 20 0 BEADLO Cc1ncsc1CN(C)c1cc[nH+]c(C)n1 ZINC000266363347 188372714 /nfs/dbraw/zinc/37/27/14/188372714.db2.gz KUSMVMQKDRPOKZ-UHFFFAOYSA-N 1 2 234.328 2.186 20 0 BEADLO C/C=C(\C)C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000267578536 188373182 /nfs/dbraw/zinc/37/31/82/188373182.db2.gz KQRFXKVHYMGYTM-QDEBKDIKSA-N 1 2 233.315 2.013 20 0 BEADLO CC(C)Cc1noc(C[N@@H+]2C[C@H](C)[C@@H]2C)n1 ZINC000339575503 188368622 /nfs/dbraw/zinc/36/86/22/188368622.db2.gz SJQWYFLOTQQTSK-UWVGGRQHSA-N 1 2 223.320 2.108 20 0 BEADLO CC(C)Cc1noc(C[N@H+]2C[C@H](C)[C@@H]2C)n1 ZINC000339575503 188368624 /nfs/dbraw/zinc/36/86/24/188368624.db2.gz SJQWYFLOTQQTSK-UWVGGRQHSA-N 1 2 223.320 2.108 20 0 BEADLO CC(C)=CC(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000263938804 188371170 /nfs/dbraw/zinc/37/11/70/188371170.db2.gz IDPAOGCNZOJUET-NSHDSACASA-N 1 2 233.315 2.082 20 0 BEADLO Cc1nc(N(CC(C)C)C2CC2)cc[nH+]1 ZINC000266168110 188371489 /nfs/dbraw/zinc/37/14/89/188371489.db2.gz QALCAAJRWMSQMH-UHFFFAOYSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1nc(N(C)CCOc2ccccc2)cc[nH+]1 ZINC000266146448 188371597 /nfs/dbraw/zinc/37/15/97/188371597.db2.gz RZPBFOQGZSBITI-UHFFFAOYSA-N 1 2 243.310 2.300 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@@H](C)c1cccc(CO)c1 ZINC000272010560 188377723 /nfs/dbraw/zinc/37/77/23/188377723.db2.gz UGQXCOUJIAZJOZ-JTQLQIEISA-N 1 2 245.326 2.061 20 0 BEADLO CC[C@@]1(C)C[N@H+](Cc2cc(C)ns2)CCO1 ZINC000639092179 353454677 /nfs/dbraw/zinc/45/46/77/353454677.db2.gz YCOKKPBWPJCPRE-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO CC[C@@]1(C)C[N@@H+](Cc2cc(C)ns2)CCO1 ZINC000639092179 353454680 /nfs/dbraw/zinc/45/46/80/353454680.db2.gz YCOKKPBWPJCPRE-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO CC1(C)C[C@H]1[NH2+][C@H](c1ncc[nH]1)c1ccccn1 ZINC000278639625 188382075 /nfs/dbraw/zinc/38/20/75/188382075.db2.gz HMAORADYFJEBGJ-NEPJUHHUSA-N 1 2 242.326 2.282 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccns2)[C@H](C)[C@H](C)O1 ZINC000639085881 353433306 /nfs/dbraw/zinc/43/33/06/353433306.db2.gz MBVFMRJHFWOKOK-BBBLOLIVSA-N 1 2 226.345 2.141 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccns2)[C@H](C)[C@H](C)O1 ZINC000639085881 353433307 /nfs/dbraw/zinc/43/33/07/353433307.db2.gz MBVFMRJHFWOKOK-BBBLOLIVSA-N 1 2 226.345 2.141 20 0 BEADLO CC[C@H]([NH2+]CCC[C@H]1CCO1)C(F)(F)F ZINC000639093782 353476359 /nfs/dbraw/zinc/47/63/59/353476359.db2.gz AMGAVNUNLROQGV-IUCAKERBSA-N 1 2 225.254 2.486 20 0 BEADLO Clc1cc(NCCn2cc[nH+]c2)ccn1 ZINC000230815649 353533157 /nfs/dbraw/zinc/53/31/57/353533157.db2.gz NHIIWBSQADZOLB-UHFFFAOYSA-N 1 2 222.679 2.044 20 0 BEADLO Cc1cc(N2CCC[C@@](C)(O)CC2)c(C#N)c[nH+]1 ZINC000399003429 353551090 /nfs/dbraw/zinc/55/10/90/353551090.db2.gz VEGBGLBLOFIJMY-CQSZACIVSA-N 1 2 245.326 2.003 20 0 BEADLO Cc1cc(NC(=O)[C@@H](C)CC(F)F)c(C)c[nH+]1 ZINC000521208010 324179136 /nfs/dbraw/zinc/17/91/36/324179136.db2.gz FNFWDQSNOOAFHW-ZETCQYMHSA-N 1 2 242.269 2.350 20 0 BEADLO CS[C@H](C)C(=O)Nc1c(C)cc[nH+]c1C ZINC000334515810 353612109 /nfs/dbraw/zinc/61/21/09/353612109.db2.gz HQNWANPVBRQHMF-SECBINFHSA-N 1 2 224.329 2.388 20 0 BEADLO CCC[C@@H]([NH2+]Cc1c[nH]nn1)[C@@H]1CC1(C)C ZINC000398423919 363237327 /nfs/dbraw/zinc/23/73/27/363237327.db2.gz WMMNNFCDZHXJDN-WDEREUQCSA-N 1 2 222.336 2.109 20 0 BEADLO CCC[C@@H]([NH2+]Cc1cn[nH]n1)[C@@H]1CC1(C)C ZINC000398423919 363237330 /nfs/dbraw/zinc/23/73/30/363237330.db2.gz WMMNNFCDZHXJDN-WDEREUQCSA-N 1 2 222.336 2.109 20 0 BEADLO CCC[C@@H]([NH2+]Cc1c[nH]nn1)[C@H]1CC1(C)C ZINC000398423916 363237402 /nfs/dbraw/zinc/23/74/02/363237402.db2.gz WMMNNFCDZHXJDN-GHMZBOCLSA-N 1 2 222.336 2.109 20 0 BEADLO CCC[C@@H]([NH2+]Cc1cn[nH]n1)[C@H]1CC1(C)C ZINC000398423916 363237409 /nfs/dbraw/zinc/23/74/09/363237409.db2.gz WMMNNFCDZHXJDN-GHMZBOCLSA-N 1 2 222.336 2.109 20 0 BEADLO CC[C@H](CCO)CNc1cc[nH+]c(C(C)C)n1 ZINC000152407675 353617735 /nfs/dbraw/zinc/61/77/35/353617735.db2.gz AJQASGYOZFAJQF-LLVKDONJSA-N 1 2 237.347 2.421 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2ccc3c(n2)CCC3)C1 ZINC000334519014 353658949 /nfs/dbraw/zinc/65/89/49/353658949.db2.gz NELLYYDNOXTIGF-LLVKDONJSA-N 1 2 220.291 2.114 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2ccc3c(n2)CCC3)C1 ZINC000334519014 353658950 /nfs/dbraw/zinc/65/89/50/353658950.db2.gz NELLYYDNOXTIGF-LLVKDONJSA-N 1 2 220.291 2.114 20 0 BEADLO Fc1cccc2c1CCN(Cc1[nH]cc[nH+]1)C2 ZINC000152886924 181004933 /nfs/dbraw/zinc/00/49/33/181004933.db2.gz QOCZQNNFOKBLFP-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO CC[C@](C)([NH2+]CCCCCO)C(F)(F)F ZINC000308954756 353725965 /nfs/dbraw/zinc/72/59/65/353725965.db2.gz QDZJPMNGVJRWGL-VIFPVBQESA-N 1 2 227.270 2.470 20 0 BEADLO Cc1[nH+]c2cc(NC(=O)[C@H]3C[C@@H]3C)ccc2n1C ZINC000608248455 353770161 /nfs/dbraw/zinc/77/01/61/353770161.db2.gz NYEHWNNMUYKSBM-KWQFWETISA-N 1 2 243.310 2.476 20 0 BEADLO Cc1cnc(C[NH2+][C@H](C)c2cnccn2)s1 ZINC000224186079 324215094 /nfs/dbraw/zinc/21/50/94/324215094.db2.gz YPJOZRFCQRZXEF-SECBINFHSA-N 1 2 234.328 2.092 20 0 BEADLO Fc1cccnc1NCc1cn2ccccc2[nH+]1 ZINC000359088847 181015568 /nfs/dbraw/zinc/01/55/68/181015568.db2.gz BCMBQWWMQVXVBF-UHFFFAOYSA-N 1 2 242.257 2.481 20 0 BEADLO CO[C@H](CNc1ccc(CO)c[nH+]1)CC(C)C ZINC000639132361 353841831 /nfs/dbraw/zinc/84/18/31/353841831.db2.gz MRNYPKLAFDRKGR-LBPRGKRZSA-N 1 2 238.331 2.047 20 0 BEADLO Cc1ccc(C[N@@H+]2CCOCC23CC3)c(F)c1 ZINC000639144284 353851001 /nfs/dbraw/zinc/85/10/01/353851001.db2.gz UUJPGOBVLVWJAJ-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1ccc(C[N@H+]2CCOCC23CC3)c(F)c1 ZINC000639144284 353851003 /nfs/dbraw/zinc/85/10/03/353851003.db2.gz UUJPGOBVLVWJAJ-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1ncc([C@H](C)[N@@H+]2CCOCC23CC3)c(C)n1 ZINC000639144267 353851139 /nfs/dbraw/zinc/85/11/39/353851139.db2.gz UJNPEIAMCDSHSY-NSHDSACASA-N 1 2 247.342 2.019 20 0 BEADLO Cc1ncc([C@H](C)[N@H+]2CCOCC23CC3)c(C)n1 ZINC000639144267 353851140 /nfs/dbraw/zinc/85/11/40/353851140.db2.gz UJNPEIAMCDSHSY-NSHDSACASA-N 1 2 247.342 2.019 20 0 BEADLO CC[C@H]1C[C@H](Nc2cccc[nH+]2)CCO1 ZINC000334534123 353914121 /nfs/dbraw/zinc/91/41/21/353914121.db2.gz LCKSCNQNWBJBTJ-MNOVXSKESA-N 1 2 206.289 2.451 20 0 BEADLO Cc1nn(C(C)C)cc1C[N@H+](C)Cc1cc[nH]n1 ZINC000343507394 353922192 /nfs/dbraw/zinc/92/21/92/353922192.db2.gz HMHSVESOBYNRLY-UHFFFAOYSA-N 1 2 247.346 2.128 20 0 BEADLO Cc1nn(C(C)C)cc1C[N@@H+](C)Cc1cc[nH]n1 ZINC000343507394 353922193 /nfs/dbraw/zinc/92/21/93/353922193.db2.gz HMHSVESOBYNRLY-UHFFFAOYSA-N 1 2 247.346 2.128 20 0 BEADLO CC[C@@]1(C)C[C@@H]1C(=O)NCCNc1cccc[nH+]1 ZINC000343599101 353930321 /nfs/dbraw/zinc/93/03/21/353930321.db2.gz HFICLUXVOFOCHW-RISCZKNCSA-N 1 2 247.342 2.046 20 0 BEADLO Cc1occc1C[NH2+]Cc1nccn1C(F)F ZINC000343637353 353950264 /nfs/dbraw/zinc/95/02/64/353950264.db2.gz JGVTWYLQPPGZMR-UHFFFAOYSA-N 1 2 241.241 2.469 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N(C)C1CC(C)(C)C1 ZINC000334549196 353989037 /nfs/dbraw/zinc/98/90/37/353989037.db2.gz AAWXBOFEVLUCHY-UHFFFAOYSA-N 1 2 247.342 2.464 20 0 BEADLO CC(C)n1nccc1C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000334554408 353998531 /nfs/dbraw/zinc/99/85/31/353998531.db2.gz PEPNPHZFYVWVHX-TXEJJXNPSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000334554408 353998534 /nfs/dbraw/zinc/99/85/34/353998534.db2.gz PEPNPHZFYVWVHX-TXEJJXNPSA-N 1 2 237.347 2.073 20 0 BEADLO Cc1cc(CNc2ccc[nH+]c2C)no1 ZINC000334555208 354000310 /nfs/dbraw/zinc/00/03/10/354000310.db2.gz BYICYVWIYGWNJK-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO Cc1cc(N[C@@H]2C[C@@H]2C(F)F)nc(C2CC2)[nH+]1 ZINC000343822972 354015380 /nfs/dbraw/zinc/01/53/80/354015380.db2.gz AFAXHYOGDRELIW-DTWKUNHWSA-N 1 2 239.269 2.150 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CCc3ccccc3C2)[nH]1 ZINC000334549674 354016814 /nfs/dbraw/zinc/01/68/14/354016814.db2.gz OALKVAXBHKDLEE-SNVBAGLBSA-N 1 2 242.326 2.232 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CCc3ccccc3C2)[nH]1 ZINC000334549674 354016816 /nfs/dbraw/zinc/01/68/16/354016816.db2.gz OALKVAXBHKDLEE-SNVBAGLBSA-N 1 2 242.326 2.232 20 0 BEADLO CCc1nc(C[N@H+](C)C[C@@H]2CC=CCC2)no1 ZINC000344059464 354128226 /nfs/dbraw/zinc/12/82/26/354128226.db2.gz LEWAUZFYTMFLAI-LLVKDONJSA-N 1 2 235.331 2.420 20 0 BEADLO CCc1nc(C[N@@H+](C)C[C@@H]2CC=CCC2)no1 ZINC000344059464 354128228 /nfs/dbraw/zinc/12/82/28/354128228.db2.gz LEWAUZFYTMFLAI-LLVKDONJSA-N 1 2 235.331 2.420 20 0 BEADLO Cc1cccc2c1CC[C@@H]2[NH2+]CC(F)(F)CO ZINC000344100460 354131642 /nfs/dbraw/zinc/13/16/42/354131642.db2.gz FTHFFUCTIWINJN-LBPRGKRZSA-N 1 2 241.281 2.200 20 0 BEADLO Fc1cnccc1C[N@@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000334562550 354118776 /nfs/dbraw/zinc/11/87/76/354118776.db2.gz MXHOJJCMKYQOPB-CYBMUJFWSA-N 1 2 246.289 2.281 20 0 BEADLO Fc1cnccc1C[N@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000334562550 354118778 /nfs/dbraw/zinc/11/87/78/354118778.db2.gz MXHOJJCMKYQOPB-CYBMUJFWSA-N 1 2 246.289 2.281 20 0 BEADLO Cc1nc(C[NH2+]Cc2cnc(C)nc2)sc1C ZINC000344555406 354293810 /nfs/dbraw/zinc/29/38/10/354293810.db2.gz ZEBHAGKDBZNCLV-UHFFFAOYSA-N 1 2 248.355 2.148 20 0 BEADLO Cc1[nH]c(C(=O)NC(C)(C)C(C)(C)C)c[nH+]1 ZINC000334612558 354296897 /nfs/dbraw/zinc/29/68/97/354296897.db2.gz AEYBNZZKOPLZSV-UHFFFAOYSA-N 1 2 223.320 2.273 20 0 BEADLO COc1ccc(C)cc1C[N@@H+]1CCOCC12CC2 ZINC000334613959 354298802 /nfs/dbraw/zinc/29/88/02/354298802.db2.gz IILAQTRNQDBWCW-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO COc1ccc(C)cc1C[N@H+]1CCOCC12CC2 ZINC000334613959 354298805 /nfs/dbraw/zinc/29/88/05/354298805.db2.gz IILAQTRNQDBWCW-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO C[C@H](c1csnn1)[N@@H+]1CCS[C@@H](C)CC1 ZINC000334620365 354357181 /nfs/dbraw/zinc/35/71/81/354357181.db2.gz QKTOFYPJKWJVMH-DTWKUNHWSA-N 1 2 243.401 2.427 20 0 BEADLO C[C@H](c1csnn1)[N@H+]1CCS[C@@H](C)CC1 ZINC000334620365 354357184 /nfs/dbraw/zinc/35/71/84/354357184.db2.gz QKTOFYPJKWJVMH-DTWKUNHWSA-N 1 2 243.401 2.427 20 0 BEADLO C[C@@H]1c2ccccc2C[N@H+]1Cc1cncn1C ZINC000334607533 354314875 /nfs/dbraw/zinc/31/48/75/354314875.db2.gz AWKYXRPZRAUYHD-LLVKDONJSA-N 1 2 227.311 2.497 20 0 BEADLO C[C@@H]1c2ccccc2C[N@@H+]1Cc1cncn1C ZINC000334607533 354314877 /nfs/dbraw/zinc/31/48/77/354314877.db2.gz AWKYXRPZRAUYHD-LLVKDONJSA-N 1 2 227.311 2.497 20 0 BEADLO Fc1cccc(C[NH2+]Cc2ccon2)c1F ZINC000086452648 491061743 /nfs/dbraw/zinc/06/17/43/491061743.db2.gz QTRKLCPCJXYVBR-UHFFFAOYSA-N 1 2 224.210 2.243 20 0 BEADLO C[C@@H](O)[C@@H](C)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000578007341 366176084 /nfs/dbraw/zinc/17/60/84/366176084.db2.gz LZAQZLSDDZGBON-GHMZBOCLSA-N 1 2 231.299 2.054 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2CCC3(CCC3)C2)no1 ZINC000334685277 354431660 /nfs/dbraw/zinc/43/16/60/354431660.db2.gz JKIGVHKYPBVIGN-VIFPVBQESA-N 1 2 221.304 2.315 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2CCC3(CCC3)C2)no1 ZINC000334685277 354431665 /nfs/dbraw/zinc/43/16/65/354431665.db2.gz JKIGVHKYPBVIGN-VIFPVBQESA-N 1 2 221.304 2.315 20 0 BEADLO Cc1cc(N2C[C@@H](C3CC3)[C@@H]2C2CC2)nc[nH+]1 ZINC000334688376 354434302 /nfs/dbraw/zinc/43/43/02/354434302.db2.gz ZUPCCPICEDMIQA-JSGCOSHPSA-N 1 2 229.327 2.410 20 0 BEADLO CC1(CO)C[NH+](Cc2ccc(Cl)cc2F)C1 ZINC000334647221 354437708 /nfs/dbraw/zinc/43/77/08/354437708.db2.gz OZYIWYIGIUAOLW-UHFFFAOYSA-N 1 2 243.709 2.293 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CCC(F)(F)[C@@H](C)C2)o1 ZINC000334669786 354410772 /nfs/dbraw/zinc/41/07/72/354410772.db2.gz WWAWCLKMGAQFPK-JGVFFNPUSA-N 1 2 245.273 2.416 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CCC(F)(F)[C@@H](C)C2)o1 ZINC000334669786 354410774 /nfs/dbraw/zinc/41/07/74/354410774.db2.gz WWAWCLKMGAQFPK-JGVFFNPUSA-N 1 2 245.273 2.416 20 0 BEADLO FC1=CCCN(Cc2c[nH+]c3ccccn23)C1 ZINC000334674943 354417414 /nfs/dbraw/zinc/41/74/14/354417414.db2.gz UKYODUKJLFCOJA-UHFFFAOYSA-N 1 2 231.274 2.393 20 0 BEADLO c1n[nH]nc1C[N@@H+]1CCC[C@H](c2ccccc2)C1 ZINC000334652681 354445680 /nfs/dbraw/zinc/44/56/80/354445680.db2.gz RSFLESITQVIWOG-ZDUSSCGKSA-N 1 2 242.326 2.184 20 0 BEADLO c1n[nH]nc1C[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC000334652681 354445681 /nfs/dbraw/zinc/44/56/81/354445681.db2.gz RSFLESITQVIWOG-ZDUSSCGKSA-N 1 2 242.326 2.184 20 0 BEADLO C[C@@H]1CCC[C@]1(C)C(=O)N1CCn2c[nH+]cc2C1 ZINC000334662063 354461933 /nfs/dbraw/zinc/46/19/33/354461933.db2.gz UFTFHBBXSOKHBJ-RISCZKNCSA-N 1 2 247.342 2.052 20 0 BEADLO CC(C)[C@H]1C[C@H]1C(=O)Nc1c[nH+]c2n1CCCC2 ZINC000334665217 354466994 /nfs/dbraw/zinc/46/69/94/354466994.db2.gz DLCCSYIBPJGMGQ-GHMZBOCLSA-N 1 2 247.342 2.450 20 0 BEADLO CC(C)=CCNC(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000334694749 354485618 /nfs/dbraw/zinc/48/56/18/354485618.db2.gz BHRXJSCRPHNUMT-WDEREUQCSA-N 1 2 248.330 2.154 20 0 BEADLO Cc1cc(C)c(CNC(=O)C2(C)CC2)c[nH+]1 ZINC000334750873 354475998 /nfs/dbraw/zinc/47/59/98/354475998.db2.gz UWNLCTRYCWGOHT-UHFFFAOYSA-N 1 2 218.300 2.115 20 0 BEADLO C[C@@H]1CCCC[C@H]1CCNC(=O)Cn1cc[nH+]c1 ZINC000578061027 366207236 /nfs/dbraw/zinc/20/72/36/366207236.db2.gz DTAXSSPIGKVQMJ-OLZOCXBDSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1cc(NC(=O)N2CC(C(C)(C)C)C2)cc[nH+]1 ZINC000334692786 354483163 /nfs/dbraw/zinc/48/31/63/354483163.db2.gz CYBOPCJHEPPNKL-UHFFFAOYSA-N 1 2 247.342 2.322 20 0 BEADLO Cn1c[nH+]cc1Cc1nc(-c2cccs2)no1 ZINC000349651088 366208565 /nfs/dbraw/zinc/20/85/65/366208565.db2.gz PSOBXGUUTPDEPI-UHFFFAOYSA-N 1 2 246.295 2.122 20 0 BEADLO COC1C[NH+](Cc2ccc3ncccc3c2)C1 ZINC000334727053 354527110 /nfs/dbraw/zinc/52/71/10/354527110.db2.gz VZRQFEDCAFIRQX-UHFFFAOYSA-N 1 2 228.295 2.065 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@]1(C)CC=CCC1 ZINC000334729153 354529436 /nfs/dbraw/zinc/52/94/36/354529436.db2.gz YGAIHVPUOZVJTB-CQSZACIVSA-N 1 2 230.311 2.497 20 0 BEADLO CC1C[NH+](Cc2csc(C3CC3)n2)C1 ZINC000335929028 134009785 /nfs/dbraw/zinc/00/97/85/134009785.db2.gz JAZYPHGTOKENQS-UHFFFAOYSA-N 1 2 208.330 2.472 20 0 BEADLO O=C(Nc1c[nH+]c2n1CCCC2)C1CCCC1 ZINC000334696321 354487678 /nfs/dbraw/zinc/48/76/78/354487678.db2.gz NPNDZGDNMNLLHU-UHFFFAOYSA-N 1 2 233.315 2.348 20 0 BEADLO COC1C[NH+](Cc2coc3ccccc23)C1 ZINC000334740138 354543765 /nfs/dbraw/zinc/54/37/65/354543765.db2.gz KROIVTRBDSJDNT-UHFFFAOYSA-N 1 2 217.268 2.263 20 0 BEADLO Cc1cc(C)c(CNC(=O)NC2CC(C)C2)c[nH+]1 ZINC000334700663 354493800 /nfs/dbraw/zinc/49/38/00/354493800.db2.gz FUVYVYPEVQGSHY-UHFFFAOYSA-N 1 2 247.342 2.296 20 0 BEADLO Cc1nc(N2CCCC23CCC3)cc[nH+]1 ZINC000334711592 354508396 /nfs/dbraw/zinc/50/83/96/354508396.db2.gz YPEUPPKNBDXVIC-UHFFFAOYSA-N 1 2 203.289 2.308 20 0 BEADLO Cc1cc(C(=O)N[C@@H]2C[C@@H](C)n3cc[nH+]c32)co1 ZINC000334716349 354514856 /nfs/dbraw/zinc/51/48/56/354514856.db2.gz XPNPPRJFLRMILF-LDYMZIIASA-N 1 2 245.282 2.220 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)C2CC(C)(C)C2)c2[nH+]ccn21 ZINC000334768321 354589532 /nfs/dbraw/zinc/58/95/32/354589532.db2.gz JJVNGWZUOAIOEI-MWLCHTKSSA-N 1 2 247.342 2.441 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)c2ccccc2)c2[nH+]ccn21 ZINC000334743797 354547378 /nfs/dbraw/zinc/54/73/78/354547378.db2.gz NCORHMMVNKMWFP-PWSUYJOCSA-N 1 2 241.294 2.319 20 0 BEADLO C[C@H]1CCC[C@@H](CC(=O)Nc2cc[nH+]cc2O)C1 ZINC000345382939 354646442 /nfs/dbraw/zinc/64/64/42/354646442.db2.gz UEAHWIZLCJZMEN-WDEREUQCSA-N 1 2 248.326 2.364 20 0 BEADLO C[C@@H]1CCC[C@@H](CC(=O)Nc2cc[nH+]cc2O)C1 ZINC000345382933 354646475 /nfs/dbraw/zinc/64/64/75/354646475.db2.gz UEAHWIZLCJZMEN-GHMZBOCLSA-N 1 2 248.326 2.364 20 0 BEADLO CCn1ncnc1C[N@@H+]1CC(C)(C)[C@H]1C(C)C ZINC000639204465 354655346 /nfs/dbraw/zinc/65/53/46/354655346.db2.gz QBTNNHPLHGJAFF-GFCCVEGCSA-N 1 2 236.363 2.164 20 0 BEADLO CCn1ncnc1C[N@H+]1CC(C)(C)[C@H]1C(C)C ZINC000639204465 354655348 /nfs/dbraw/zinc/65/53/48/354655348.db2.gz QBTNNHPLHGJAFF-GFCCVEGCSA-N 1 2 236.363 2.164 20 0 BEADLO CCC(=O)N1CC[N@H+](Cc2ccccc2C)C1 ZINC000335106776 354691249 /nfs/dbraw/zinc/69/12/49/354691249.db2.gz DSKQLSFPNUBCLK-UHFFFAOYSA-N 1 2 232.327 2.007 20 0 BEADLO CCC(=O)N1CC[N@@H+](Cc2ccccc2C)C1 ZINC000335106776 354691252 /nfs/dbraw/zinc/69/12/52/354691252.db2.gz DSKQLSFPNUBCLK-UHFFFAOYSA-N 1 2 232.327 2.007 20 0 BEADLO CC(C)n1cncc1C[N@@H+]1CCO[C@H]2CCC[C@H]21 ZINC000335112151 354698646 /nfs/dbraw/zinc/69/86/46/354698646.db2.gz UHIJHEQAUFGTMT-KGLIPLIRSA-N 1 2 249.358 2.217 20 0 BEADLO CC(C)n1cncc1C[N@H+]1CCO[C@H]2CCC[C@H]21 ZINC000335112151 354698648 /nfs/dbraw/zinc/69/86/48/354698648.db2.gz UHIJHEQAUFGTMT-KGLIPLIRSA-N 1 2 249.358 2.217 20 0 BEADLO CC(C)n1c[nH+]cc1CN1CCO[C@H]2CCC[C@H]21 ZINC000335112151 354698651 /nfs/dbraw/zinc/69/86/51/354698651.db2.gz UHIJHEQAUFGTMT-KGLIPLIRSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nc(C(F)F)no2)CC[C@@H]1C ZINC000335119089 354724767 /nfs/dbraw/zinc/72/47/67/354724767.db2.gz RNPMOSZYBHZMFF-YUMQZZPRSA-N 1 2 245.273 2.485 20 0 BEADLO C[C@H]1C[N@H+](Cc2nc(C(F)F)no2)CC[C@@H]1C ZINC000335119089 354724771 /nfs/dbraw/zinc/72/47/71/354724771.db2.gz RNPMOSZYBHZMFF-YUMQZZPRSA-N 1 2 245.273 2.485 20 0 BEADLO CO[C@H](C[NH2+]CC(C)(F)F)Cc1ccccc1 ZINC000639206653 354681424 /nfs/dbraw/zinc/68/14/24/354681424.db2.gz BOGNQMKCRKVMPG-LBPRGKRZSA-N 1 2 243.297 2.489 20 0 BEADLO Cc1cc(C)c(CNC(=O)N(C)C2CCC2)c[nH+]1 ZINC000335128098 354774256 /nfs/dbraw/zinc/77/42/56/354774256.db2.gz BJKUDIWDQRRSQY-UHFFFAOYSA-N 1 2 247.342 2.392 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@]3(CCCO3)[C@H]2C2CC2)on1 ZINC000639212428 354775762 /nfs/dbraw/zinc/77/57/62/354775762.db2.gz DOOUHAMJIODJOT-KGLIPLIRSA-N 1 2 248.326 2.126 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@]3(CCCO3)[C@H]2C2CC2)on1 ZINC000639212428 354775764 /nfs/dbraw/zinc/77/57/64/354775764.db2.gz DOOUHAMJIODJOT-KGLIPLIRSA-N 1 2 248.326 2.126 20 0 BEADLO CCCC1(C(=O)N[C@H](C)Cn2cc[nH+]c2)CCC1 ZINC000345651453 354736959 /nfs/dbraw/zinc/73/69/59/354736959.db2.gz CBYMJTWIQYTBDF-GFCCVEGCSA-N 1 2 249.358 2.358 20 0 BEADLO C[C@@H]1CC[C@@H](CC(=O)N(C)Cc2[nH]cc[nH+]2)C1 ZINC000345659550 354739191 /nfs/dbraw/zinc/73/91/91/354739191.db2.gz YPFRLPHXFSYCFH-GHMZBOCLSA-N 1 2 235.331 2.194 20 0 BEADLO CN(CC[N@@H+]1CCC(F)(F)C1)c1ccccc1 ZINC000345906554 354804758 /nfs/dbraw/zinc/80/47/58/354804758.db2.gz GTFCMBJLSJLCGU-UHFFFAOYSA-N 1 2 240.297 2.464 20 0 BEADLO CN(CC[N@H+]1CCC(F)(F)C1)c1ccccc1 ZINC000345906554 354804764 /nfs/dbraw/zinc/80/47/64/354804764.db2.gz GTFCMBJLSJLCGU-UHFFFAOYSA-N 1 2 240.297 2.464 20 0 BEADLO CC(C)[C@@H](C)CNc1nc[nH+]c(N)c1Cl ZINC000232687729 363379762 /nfs/dbraw/zinc/37/97/62/363379762.db2.gz PSPFKAGGAYNNKW-ZETCQYMHSA-N 1 2 228.727 2.416 20 0 BEADLO CC(C)[C@@H](C)CNc1[nH+]cnc(N)c1Cl ZINC000232687729 363379765 /nfs/dbraw/zinc/37/97/65/363379765.db2.gz PSPFKAGGAYNNKW-ZETCQYMHSA-N 1 2 228.727 2.416 20 0 BEADLO Cc1[nH+]cccc1Cn1cnc(C(C)(C)C)n1 ZINC000642337515 363392493 /nfs/dbraw/zinc/39/24/93/363392493.db2.gz VWAHLLBCYSHSDO-UHFFFAOYSA-N 1 2 230.315 2.327 20 0 BEADLO CCCCC(=O)N1CC[C@H](Oc2cc[nH+]cc2)C1 ZINC000346011552 354838335 /nfs/dbraw/zinc/83/83/35/354838335.db2.gz MKEYNEYJBBVNDG-ZDUSSCGKSA-N 1 2 248.326 2.252 20 0 BEADLO CC[C@H](C)CN(C)C(=O)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000346303779 354890907 /nfs/dbraw/zinc/89/09/07/354890907.db2.gz MJYFKESZYCPALQ-QWRGUYRKSA-N 1 2 249.358 2.334 20 0 BEADLO COC[C@H](C)Nc1ccc(N2CCCC2)c[nH+]1 ZINC000346413423 354917122 /nfs/dbraw/zinc/91/71/22/354917122.db2.gz DLVOVJXCFRNBBO-NSHDSACASA-N 1 2 235.331 2.129 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616927975 491069018 /nfs/dbraw/zinc/06/90/18/491069018.db2.gz VBKJHMKXWGGTEI-YPMHNXCESA-N 1 2 235.331 2.050 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616927975 491069020 /nfs/dbraw/zinc/06/90/20/491069020.db2.gz VBKJHMKXWGGTEI-YPMHNXCESA-N 1 2 235.331 2.050 20 0 BEADLO Fc1cc2ncc(-n3cc[nH+]c3)nc2cc1F ZINC000346366255 354918750 /nfs/dbraw/zinc/91/87/50/354918750.db2.gz ITFHTWCFQLGPMS-UHFFFAOYSA-N 1 2 232.193 2.094 20 0 BEADLO CSC[C@@H]1CCCN(c2cc(C)[nH+]cn2)C1 ZINC000335204827 355039846 /nfs/dbraw/zinc/03/98/46/355039846.db2.gz ZPAPXQOISVPCOQ-LLVKDONJSA-N 1 2 237.372 2.364 20 0 BEADLO O[C@H]1C[C@@H](Nc2[nH+]ccc3ccc(F)cc32)C1 ZINC000335190820 355023691 /nfs/dbraw/zinc/02/36/91/355023691.db2.gz DRNGODCWEKDONJ-PHIMTYICSA-N 1 2 232.258 2.309 20 0 BEADLO COC(=O)[C@H]([NH2+]CC1=CCCC1)C(C)(C)C ZINC000592081557 491072345 /nfs/dbraw/zinc/07/23/45/491072345.db2.gz ACPBCTYKDANLMO-NSHDSACASA-N 1 2 225.332 2.274 20 0 BEADLO C[C@H](N[C@H]1CCC[N@H+](C)[C@@H]1C)c1ccccn1 ZINC000346785803 355116963 /nfs/dbraw/zinc/11/69/63/355116963.db2.gz AGSUZNQUJLCDJJ-SCRDCRAPSA-N 1 2 233.359 2.215 20 0 BEADLO C[C@H](N[C@H]1CCC[N@@H+](C)[C@@H]1C)c1ccccn1 ZINC000346785803 355116967 /nfs/dbraw/zinc/11/69/67/355116967.db2.gz AGSUZNQUJLCDJJ-SCRDCRAPSA-N 1 2 233.359 2.215 20 0 BEADLO Cc1cc(NC(=O)N(C)C2CC(C)(C)C2)cc[nH+]1 ZINC000335187407 355086231 /nfs/dbraw/zinc/08/62/31/355086231.db2.gz FEGZTTCEYRSAGO-UHFFFAOYSA-N 1 2 247.342 2.464 20 0 BEADLO OC[C@@H](Cc1ccc(F)cc1)Nc1cccc[nH+]1 ZINC000346702806 355093278 /nfs/dbraw/zinc/09/32/78/355093278.db2.gz UUSJMRJUURRPDC-CYBMUJFWSA-N 1 2 246.285 2.236 20 0 BEADLO Cc1cc(NC(=O)C(C)(C)C(F)F)cc[nH+]1 ZINC000335254302 355213043 /nfs/dbraw/zinc/21/30/43/355213043.db2.gz SPXQXGRHVBNVIH-UHFFFAOYSA-N 1 2 228.242 2.042 20 0 BEADLO c1nc(NC2CC2)cc(NC2CCC2)[nH+]1 ZINC000413143411 191359293 /nfs/dbraw/zinc/35/92/93/191359293.db2.gz WNGFXYVJEUYLDX-UHFFFAOYSA-N 1 2 204.277 2.015 20 0 BEADLO c1nc(NC2CCC2)cc(NC2CC2)[nH+]1 ZINC000413143411 191359296 /nfs/dbraw/zinc/35/92/96/191359296.db2.gz WNGFXYVJEUYLDX-UHFFFAOYSA-N 1 2 204.277 2.015 20 0 BEADLO C[C@@H](F)CC[N@@H+]1CCO[C@@H](c2nccs2)C1 ZINC000352007729 134035515 /nfs/dbraw/zinc/03/55/15/134035515.db2.gz YOLYUPJCBLSIND-NXEZZACHSA-N 1 2 244.335 2.265 20 0 BEADLO C[C@@H](F)CC[N@H+]1CCO[C@@H](c2nccs2)C1 ZINC000352007729 134035516 /nfs/dbraw/zinc/03/55/16/134035516.db2.gz YOLYUPJCBLSIND-NXEZZACHSA-N 1 2 244.335 2.265 20 0 BEADLO C[C@H]1C[C@@H]1CNc1cc(NC2CC2)nc[nH+]1 ZINC000413055404 191351424 /nfs/dbraw/zinc/35/14/24/191351424.db2.gz QUZYLLHYJOYJJV-DTWKUNHWSA-N 1 2 218.304 2.119 20 0 BEADLO C[C@H]1C[C@@H]1CNc1cc(NC2CC2)[nH+]cn1 ZINC000413055404 191351425 /nfs/dbraw/zinc/35/14/25/191351425.db2.gz QUZYLLHYJOYJJV-DTWKUNHWSA-N 1 2 218.304 2.119 20 0 BEADLO Cc1nc(N[C@@H]2CCC[C@@H]3C[C@@H]32)cc[nH+]1 ZINC000413466629 191381954 /nfs/dbraw/zinc/38/19/54/191381954.db2.gz YGZNAHJLACVEEW-OUAUKWLOSA-N 1 2 203.289 2.386 20 0 BEADLO CC[C@@H]1OCC[C@H]1Nc1cc[nH+]c(C(C)C)n1 ZINC000413447773 191384199 /nfs/dbraw/zinc/38/41/99/191384199.db2.gz ITTNIDZYMXVZNS-MNOVXSKESA-N 1 2 235.331 2.001 20 0 BEADLO Cc1cc(N(C)C2CC(C)(C)C2)nc[nH+]1 ZINC000413450034 191385043 /nfs/dbraw/zinc/38/50/43/191385043.db2.gz XXDXELDSHIGJIJ-UHFFFAOYSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1cc(NC[C@@H]2CCC[C@H]2C2CC2)nc[nH+]1 ZINC000413483502 191388240 /nfs/dbraw/zinc/38/82/40/191388240.db2.gz RLXBMDOXBFHRKN-STQMWFEESA-N 1 2 231.343 2.445 20 0 BEADLO C[C@@H]1C[C@H](CNc2cccc[nH+]2)[C@@H](C)O1 ZINC000413539437 191393421 /nfs/dbraw/zinc/39/34/21/191393421.db2.gz UBNIGBSDNOTLNU-GMTAPVOTSA-N 1 2 206.289 2.307 20 0 BEADLO C[C@@H]1C[C@H](CNc2cc[nH+]c(C3CC3)n2)[C@H](C)O1 ZINC000413534546 191394401 /nfs/dbraw/zinc/39/44/01/191394401.db2.gz OXQVJHLOPZDBEF-JFGNBEQYSA-N 1 2 247.342 2.001 20 0 BEADLO c1nc(N2CC[C@H](C3CC3)C2)cc(NC2CC2)[nH+]1 ZINC000413216370 191364376 /nfs/dbraw/zinc/36/43/76/191364376.db2.gz RNUSPYMVQOVWRM-NSHDSACASA-N 1 2 244.342 2.287 20 0 BEADLO c1nc(NC2CC2)cc(N2CC[C@H](C3CC3)C2)[nH+]1 ZINC000413216370 191364379 /nfs/dbraw/zinc/36/43/79/191364379.db2.gz RNUSPYMVQOVWRM-NSHDSACASA-N 1 2 244.342 2.287 20 0 BEADLO CC1=C[C@H](C)CN(c2cc(NC3CC3)[nH+]cn2)C1 ZINC000413278457 191365610 /nfs/dbraw/zinc/36/56/10/191365610.db2.gz YWTGEZAGLIKDNP-JTQLQIEISA-N 1 2 244.342 2.453 20 0 BEADLO CC1=C[C@H](C)CN(c2cc(NC3CC3)nc[nH+]2)C1 ZINC000413278457 191365613 /nfs/dbraw/zinc/36/56/13/191365613.db2.gz YWTGEZAGLIKDNP-JTQLQIEISA-N 1 2 244.342 2.453 20 0 BEADLO Cc1cc(NCCC2CC(F)(F)C2)nc[nH+]1 ZINC000413344877 191373735 /nfs/dbraw/zinc/37/37/35/191373735.db2.gz SECNBDUPSHQIGC-UHFFFAOYSA-N 1 2 227.258 2.054 20 0 BEADLO CC(C)c1nc(NC[C@@H]2CC[C@@H](C)O2)cc[nH+]1 ZINC000413379419 191377480 /nfs/dbraw/zinc/37/74/80/191377480.db2.gz RMHMJENGRPGKEM-MNOVXSKESA-N 1 2 235.331 2.001 20 0 BEADLO CCO[C@H]1C[C@@H](Nc2cc(C)[nH+]c(C(C)C)n2)C1 ZINC000413386090 191377695 /nfs/dbraw/zinc/37/76/95/191377695.db2.gz JFJRLDABGJOLQX-TXEJJXNPSA-N 1 2 249.358 2.310 20 0 BEADLO CC(C)O[C@H]1C[C@@H](Nc2cccc[nH+]2)C1 ZINC000413384660 191378020 /nfs/dbraw/zinc/37/80/20/191378020.db2.gz FQNPCOJDDIUJFG-PHIMTYICSA-N 1 2 206.289 2.450 20 0 BEADLO CC1(O)C[NH+](C/C=C/c2ccc(F)c(F)c2)C1 ZINC000639253454 355291440 /nfs/dbraw/zinc/29/14/40/355291440.db2.gz GCDQWYRLBQSRSD-NSCUHMNNSA-N 1 2 239.265 2.045 20 0 BEADLO CC1(O)C[NH+](C/C=C\c2ccc(F)c(F)c2)C1 ZINC000639253448 355291494 /nfs/dbraw/zinc/29/14/94/355291494.db2.gz GCDQWYRLBQSRSD-IHWYPQMZSA-N 1 2 239.265 2.045 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2ccn(C)n2)sn1 ZINC000639258479 355306490 /nfs/dbraw/zinc/30/64/90/355306490.db2.gz BCFGEJJEYPMUIB-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1[C@H](C)[C@@H]1C1CC1 ZINC000528464804 355333454 /nfs/dbraw/zinc/33/34/54/355333454.db2.gz GGPWGESEZIKUKE-OASPWFOLSA-N 1 2 230.311 2.043 20 0 BEADLO c1cc(C[NH+]2CC3(C2)CCCCC3)no1 ZINC000639250201 355282312 /nfs/dbraw/zinc/28/23/12/355282312.db2.gz KZRNNAVNWBQVSK-UHFFFAOYSA-N 1 2 206.289 2.441 20 0 BEADLO CCC1(CC)C[NH+](Cc2ncnn2C(C)C)C1 ZINC000639250509 355283509 /nfs/dbraw/zinc/28/35/09/355283509.db2.gz RZXSOPTZANFAKJ-UHFFFAOYSA-N 1 2 236.363 2.481 20 0 BEADLO FC(F)C1C[NH+](Cc2cc(C3CC3)no2)C1 ZINC000639252282 355286287 /nfs/dbraw/zinc/28/62/87/355286287.db2.gz CZSBOIDFBQTJTC-UHFFFAOYSA-N 1 2 228.242 2.249 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC[C@@H](C(F)(F)F)[C@H]1C ZINC000335740261 355389719 /nfs/dbraw/zinc/38/97/19/355389719.db2.gz ZUMFRCZMTLLBNK-PSASIEDQSA-N 1 2 247.264 2.491 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC[C@@H](C(F)(F)F)[C@H]1C ZINC000335740261 355389725 /nfs/dbraw/zinc/38/97/25/355389725.db2.gz ZUMFRCZMTLLBNK-PSASIEDQSA-N 1 2 247.264 2.491 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@H](C3CC3)C2)no1 ZINC000335993331 134041389 /nfs/dbraw/zinc/04/13/89/134041389.db2.gz DCOJTIOYHJUKMA-NSHDSACASA-N 1 2 221.304 2.000 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@H](C3CC3)C2)no1 ZINC000335993331 134041390 /nfs/dbraw/zinc/04/13/90/134041390.db2.gz DCOJTIOYHJUKMA-NSHDSACASA-N 1 2 221.304 2.000 20 0 BEADLO Cc1nnc(C[N@@H+](C)[C@H]2CC2(C)C)s1 ZINC000335786559 355436420 /nfs/dbraw/zinc/43/64/20/355436420.db2.gz YZSAFLMPTXCCHB-QMMMGPOBSA-N 1 2 211.334 2.077 20 0 BEADLO Cc1nnc(C[N@H+](C)[C@H]2CC2(C)C)s1 ZINC000335786559 355436424 /nfs/dbraw/zinc/43/64/24/355436424.db2.gz YZSAFLMPTXCCHB-QMMMGPOBSA-N 1 2 211.334 2.077 20 0 BEADLO FC1(C[N@@H+]2CCC3(C2)Oc2ccccc2O3)CC1 ZINC000583533029 355396527 /nfs/dbraw/zinc/39/65/27/355396527.db2.gz BYGJJCOSLHQMOM-UHFFFAOYSA-N 1 2 249.285 2.362 20 0 BEADLO FC1(C[N@H+]2CCC3(C2)Oc2ccccc2O3)CC1 ZINC000583533029 355396529 /nfs/dbraw/zinc/39/65/29/355396529.db2.gz BYGJJCOSLHQMOM-UHFFFAOYSA-N 1 2 249.285 2.362 20 0 BEADLO CC1(C(=O)N2CCn3cc[nH+]c3C2)CCCCC1 ZINC000335774802 355399402 /nfs/dbraw/zinc/39/94/02/355399402.db2.gz RWAXLWFDMWRTER-UHFFFAOYSA-N 1 2 247.342 2.196 20 0 BEADLO C[NH2+]Cc1noc(C(C)(C)Cc2ccccc2)n1 ZINC000349913937 355524989 /nfs/dbraw/zinc/52/49/89/355524989.db2.gz RTESZOZVBOVJLX-UHFFFAOYSA-N 1 2 245.326 2.309 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccns2)[C@@H](C)CO1 ZINC000639296797 355582308 /nfs/dbraw/zinc/58/23/08/355582308.db2.gz PVXFSPFSUFFNPF-UWVGGRQHSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccns2)[C@@H](C)CO1 ZINC000639296797 355582309 /nfs/dbraw/zinc/58/23/09/355582309.db2.gz PVXFSPFSUFFNPF-UWVGGRQHSA-N 1 2 226.345 2.142 20 0 BEADLO CC(C)[C@@H](C)C(=O)N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000335838185 355567292 /nfs/dbraw/zinc/56/72/92/355567292.db2.gz QPKZJSKSVIKDCZ-NEPJUHHUSA-N 1 2 249.358 2.028 20 0 BEADLO CC(C)[C@H](C)C(=O)N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000335838186 355567389 /nfs/dbraw/zinc/56/73/89/355567389.db2.gz QPKZJSKSVIKDCZ-NWDGAFQWSA-N 1 2 249.358 2.028 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+]2CC[C@@](C)(F)C2)cn1 ZINC000335876780 355646822 /nfs/dbraw/zinc/64/68/22/355646822.db2.gz MWAVJUVFAQITLO-CMPLNLGQSA-N 1 2 223.295 2.280 20 0 BEADLO Cc1cnc([C@H](C)[N@H+]2CC[C@@](C)(F)C2)cn1 ZINC000335876780 355646825 /nfs/dbraw/zinc/64/68/25/355646825.db2.gz MWAVJUVFAQITLO-CMPLNLGQSA-N 1 2 223.295 2.280 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+]2CC[C@](C)(F)C2)cn1 ZINC000335876781 355647032 /nfs/dbraw/zinc/64/70/32/355647032.db2.gz MWAVJUVFAQITLO-JQWIXIFHSA-N 1 2 223.295 2.280 20 0 BEADLO Cc1cnc([C@H](C)[N@H+]2CC[C@](C)(F)C2)cn1 ZINC000335876781 355647033 /nfs/dbraw/zinc/64/70/33/355647033.db2.gz MWAVJUVFAQITLO-JQWIXIFHSA-N 1 2 223.295 2.280 20 0 BEADLO CCc1nocc1C[N@H+]1C[C@@H](C)OC[C@@H]1CC ZINC000350240534 355654887 /nfs/dbraw/zinc/65/48/87/355654887.db2.gz LYLQYJIJTUJHII-PWSUYJOCSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1nocc1C[N@@H+]1C[C@@H](C)OC[C@@H]1CC ZINC000350240534 355654889 /nfs/dbraw/zinc/65/48/89/355654889.db2.gz LYLQYJIJTUJHII-PWSUYJOCSA-N 1 2 238.331 2.236 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NCC1CC(C)(C)C1 ZINC000583574055 355656706 /nfs/dbraw/zinc/65/67/06/355656706.db2.gz MVJSRPDEOOPGQK-SNVBAGLBSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NCC1CC(C)(C)C1 ZINC000583574055 355656707 /nfs/dbraw/zinc/65/67/07/355656707.db2.gz MVJSRPDEOOPGQK-SNVBAGLBSA-N 1 2 249.358 2.141 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)Cc1cccnc1 ZINC000583574976 355657935 /nfs/dbraw/zinc/65/79/35/355657935.db2.gz ONMQICGIUCZUMI-UHFFFAOYSA-N 1 2 228.299 2.125 20 0 BEADLO Cc1cnc(C[NH2+][C@@H]2CCCN3CCCC[C@H]23)o1 ZINC000639301519 355639599 /nfs/dbraw/zinc/63/95/99/355639599.db2.gz GERYXDSHMCHMGJ-CHWSQXEVSA-N 1 2 249.358 2.090 20 0 BEADLO C[C@H](Cc1ccsc1)[N@@H+]1Cc2cnn(C)c2C1 ZINC000639321709 355722970 /nfs/dbraw/zinc/72/29/70/355722970.db2.gz YGBNCDJBQUESCT-SNVBAGLBSA-N 1 2 247.367 2.428 20 0 BEADLO C[C@H](Cc1ccsc1)[N@H+]1Cc2cnn(C)c2C1 ZINC000639321709 355722973 /nfs/dbraw/zinc/72/29/73/355722973.db2.gz YGBNCDJBQUESCT-SNVBAGLBSA-N 1 2 247.367 2.428 20 0 BEADLO Cc1cc(C)c(NC(=O)[C@H]2CO[C@H](C)C2)c(C)[nH+]1 ZINC000335884511 355675300 /nfs/dbraw/zinc/67/53/00/355675300.db2.gz ROTUBZNTNCVIJK-ZYHUDNBSSA-N 1 2 248.326 2.370 20 0 BEADLO OC[C@@H]1C[C@@H](F)C[N@@H+]1Cc1cc(Cl)cs1 ZINC000335886525 355677139 /nfs/dbraw/zinc/67/71/39/355677139.db2.gz VWSQPXFELCBYCY-BDAKNGLRSA-N 1 2 249.738 2.306 20 0 BEADLO OC[C@@H]1C[C@@H](F)C[N@H+]1Cc1cc(Cl)cs1 ZINC000335886525 355677140 /nfs/dbraw/zinc/67/71/40/355677140.db2.gz VWSQPXFELCBYCY-BDAKNGLRSA-N 1 2 249.738 2.306 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@H](F)C2)sn1 ZINC000639313327 355686267 /nfs/dbraw/zinc/68/62/67/355686267.db2.gz QIBIXOFUJWFTMV-VIFPVBQESA-N 1 2 214.309 2.385 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@H](F)C2)sn1 ZINC000639313327 355686271 /nfs/dbraw/zinc/68/62/71/355686271.db2.gz QIBIXOFUJWFTMV-VIFPVBQESA-N 1 2 214.309 2.385 20 0 BEADLO CO[C@@H]1CC[C@@H](Nc2cc[nH+]c3ccncc23)C1 ZINC000350700576 355743393 /nfs/dbraw/zinc/74/33/93/355743393.db2.gz KBKTUXZPIUNCHN-GHMZBOCLSA-N 1 2 243.310 2.031 20 0 BEADLO Cc1cnc(C[NH2+][C@H](c2ccccc2)[C@H](C)O)o1 ZINC000639333644 355763510 /nfs/dbraw/zinc/76/35/10/355763510.db2.gz YQONGVGGXXENAV-FZMZJTMJSA-N 1 2 246.310 2.195 20 0 BEADLO Cc1ccc(C[NH+]2CC(O)(C(F)F)C2)cc1C ZINC000425345286 191815976 /nfs/dbraw/zinc/81/59/76/191815976.db2.gz GDGGLBPQCSSRPI-UHFFFAOYSA-N 1 2 241.281 2.115 20 0 BEADLO C[C@@]1(C[NH2+]Cc2c[nH]nn2)C[C@H]1c1ccccc1 ZINC000639340354 355781890 /nfs/dbraw/zinc/78/18/90/355781890.db2.gz DQDZFFVHOLYUPT-KBPBESRZSA-N 1 2 242.326 2.088 20 0 BEADLO C[C@@]1(C[NH2+]Cc2cn[nH]n2)C[C@H]1c1ccccc1 ZINC000639340354 355781892 /nfs/dbraw/zinc/78/18/92/355781892.db2.gz DQDZFFVHOLYUPT-KBPBESRZSA-N 1 2 242.326 2.088 20 0 BEADLO Cc1ncc([C@H](C)[NH+]2CC3(C2)CCCO3)c(C)n1 ZINC000639347441 355794055 /nfs/dbraw/zinc/79/40/55/355794055.db2.gz NDBNFJSDYBGOFW-NSHDSACASA-N 1 2 247.342 2.019 20 0 BEADLO CCC(F)(F)C[NH2+]Cc1ccns1 ZINC000639350604 355799065 /nfs/dbraw/zinc/79/90/65/355799065.db2.gz KCGKPMVJVUHQPG-UHFFFAOYSA-N 1 2 206.261 2.278 20 0 BEADLO c1snnc1C[NH+]1CC(c2ccccc2)C1 ZINC000639361478 355815812 /nfs/dbraw/zinc/81/58/12/355815812.db2.gz DCGTXMKHZPWTPU-UHFFFAOYSA-N 1 2 231.324 2.138 20 0 BEADLO CN(C)c1c[nH+]cc(N[C@H]2CCCOCC2)c1 ZINC000639363156 355818996 /nfs/dbraw/zinc/81/89/96/355818996.db2.gz AGNSQHHWQQSVEB-NSHDSACASA-N 1 2 235.331 2.129 20 0 BEADLO C[C@@H](Nc1c[nH+]cc(N(C)C)c1)[C@H]1CCCO1 ZINC000639364946 355837656 /nfs/dbraw/zinc/83/76/56/355837656.db2.gz KOPUDKQWBOLLHX-ZWNOBZJWSA-N 1 2 235.331 2.127 20 0 BEADLO Cc1cc2c(c(C)c1)[C@@H]([NH2+]Cc1c[nH]nn1)CC2 ZINC000628363257 355847111 /nfs/dbraw/zinc/84/71/11/355847111.db2.gz CVKDBIVDNXQGKM-ZDUSSCGKSA-N 1 2 242.326 2.199 20 0 BEADLO c1[nH]nnc1C[NH2+]C1CC2(C1)CCCCC2 ZINC000628363578 355849427 /nfs/dbraw/zinc/84/94/27/355849427.db2.gz PGCAPNAMZAYWNI-UHFFFAOYSA-N 1 2 220.320 2.007 20 0 BEADLO c1n[nH]nc1C[NH2+]C1CC2(C1)CCCCC2 ZINC000628363578 355849432 /nfs/dbraw/zinc/84/94/32/355849432.db2.gz PGCAPNAMZAYWNI-UHFFFAOYSA-N 1 2 220.320 2.007 20 0 BEADLO CCCC[C@@H](C)[C@@H](C)[NH2+]Cc1c[nH]nn1 ZINC000628363805 355850292 /nfs/dbraw/zinc/85/02/92/355850292.db2.gz YHPWVTXHJFDCLW-NXEZZACHSA-N 1 2 210.325 2.109 20 0 BEADLO CCCC[C@@H](C)[C@@H](C)[NH2+]Cc1cn[nH]n1 ZINC000628363805 355850294 /nfs/dbraw/zinc/85/02/94/355850294.db2.gz YHPWVTXHJFDCLW-NXEZZACHSA-N 1 2 210.325 2.109 20 0 BEADLO c1c[nH]c(C[NH2+]Cc2cnc(C3CC3)s2)n1 ZINC000639371206 355866970 /nfs/dbraw/zinc/86/69/70/355866970.db2.gz LGDVUPXUTHGXHH-UHFFFAOYSA-N 1 2 234.328 2.033 20 0 BEADLO O=C(C1=CCCC1)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000336054143 134065319 /nfs/dbraw/zinc/06/53/19/134065319.db2.gz IUNHHFRZVURSPL-GFCCVEGCSA-N 1 2 245.326 2.226 20 0 BEADLO COCC1(C2CC2)C[NH+](Cc2cscn2)C1 ZINC000639378610 355913098 /nfs/dbraw/zinc/91/30/98/355913098.db2.gz ASXZXLGARGAQGY-UHFFFAOYSA-N 1 2 238.356 2.002 20 0 BEADLO CC1([NH2+]Cc2ccc(F)cc2Cl)COC1 ZINC000639380579 355918625 /nfs/dbraw/zinc/91/86/25/355918625.db2.gz GGEPAJTYMXHWHV-UHFFFAOYSA-N 1 2 229.682 2.358 20 0 BEADLO CC1([NH2+]Cc2ccsc2Cl)COC1 ZINC000639380629 355919046 /nfs/dbraw/zinc/91/90/46/355919046.db2.gz HIZIVQAWSBYCDM-UHFFFAOYSA-N 1 2 217.721 2.280 20 0 BEADLO CCc1cc(NCCCOCC2CC2)nc[nH+]1 ZINC000223444268 355900075 /nfs/dbraw/zinc/90/00/75/355900075.db2.gz BDWDETAIGWDMKT-UHFFFAOYSA-N 1 2 235.331 2.268 20 0 BEADLO Cc1[nH]c(CN2CCC(C)(F)CC2)[nH+]c1C ZINC000639388456 356006912 /nfs/dbraw/zinc/00/69/12/356006912.db2.gz CATVFUAQHOYEEL-UHFFFAOYSA-N 1 2 225.311 2.351 20 0 BEADLO Cc1nc([C@@H](C)[N@H+](C)CC(C)(C)C)no1 ZINC000351489515 356000252 /nfs/dbraw/zinc/00/02/52/356000252.db2.gz HNNLQTILCMUCBZ-MRVPVSSYSA-N 1 2 211.309 2.417 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+](C)CC(C)(C)C)no1 ZINC000351489515 356000257 /nfs/dbraw/zinc/00/02/57/356000257.db2.gz HNNLQTILCMUCBZ-MRVPVSSYSA-N 1 2 211.309 2.417 20 0 BEADLO C/C=C/C[C@H](CO)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000351585074 356021872 /nfs/dbraw/zinc/02/18/72/356021872.db2.gz KPWLHWNJUNDWGU-HMDXOVGESA-N 1 2 246.314 2.005 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N(C)[C@@H]1CC[C@H](C)C1 ZINC000335906365 356105409 /nfs/dbraw/zinc/10/54/09/356105409.db2.gz AKTODRGPGMFOMU-CMPLNLGQSA-N 1 2 247.342 2.464 20 0 BEADLO COC(=O)[C@H](CC(C)C)[N@@H+]1CC[C@@](C)(F)C1 ZINC000351738622 356076652 /nfs/dbraw/zinc/07/66/52/356076652.db2.gz XRDIRJPVPZHTHX-CMPLNLGQSA-N 1 2 231.311 2.008 20 0 BEADLO COC(=O)[C@H](CC(C)C)[N@H+]1CC[C@@](C)(F)C1 ZINC000351738622 356076653 /nfs/dbraw/zinc/07/66/53/356076653.db2.gz XRDIRJPVPZHTHX-CMPLNLGQSA-N 1 2 231.311 2.008 20 0 BEADLO CCc1nc(N2CCC(F)(F)C2)cc(C)[nH+]1 ZINC000335912598 356132235 /nfs/dbraw/zinc/13/22/35/356132235.db2.gz ZYWRXGISNCZZDX-UHFFFAOYSA-N 1 2 227.258 2.193 20 0 BEADLO CCC(C)(C)[C@@H](C)NC(=O)c1c[nH+]c(C)[nH]1 ZINC000617571584 356134915 /nfs/dbraw/zinc/13/49/15/356134915.db2.gz PVXYJBHXQHZCJB-MRVPVSSYSA-N 1 2 223.320 2.273 20 0 BEADLO CC[C@@H](C)CCNC(=O)CCCn1cc[nH+]c1 ZINC000617635084 356223136 /nfs/dbraw/zinc/22/31/36/356223136.db2.gz IRPGFRYHWHRCEJ-GFCCVEGCSA-N 1 2 237.347 2.216 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@@H]1[C@@H]1CCCC[C@@H]1C ZINC000639426702 356208593 /nfs/dbraw/zinc/20/85/93/356208593.db2.gz HOTWEEAVRPMWIC-TUAOUCFPSA-N 1 2 238.375 2.369 20 0 BEADLO CCc1nc(C[N@H+]2CC(C)=C[C@H](C)C2)no1 ZINC000336117101 134088926 /nfs/dbraw/zinc/08/89/26/134088926.db2.gz HONLRHXLUMETJJ-VIFPVBQESA-N 1 2 221.304 2.030 20 0 BEADLO CCc1nc(C[N@@H+]2CC(C)=C[C@H](C)C2)no1 ZINC000336117101 134088927 /nfs/dbraw/zinc/08/89/27/134088927.db2.gz HONLRHXLUMETJJ-VIFPVBQESA-N 1 2 221.304 2.030 20 0 BEADLO O=C(CC1CSC1)Nc1ccn2cc[nH+]c2c1 ZINC000632810488 356286091 /nfs/dbraw/zinc/28/60/91/356286091.db2.gz IZAGVEVTFXAYJU-UHFFFAOYSA-N 1 2 247.323 2.026 20 0 BEADLO CC(=O)C[N@@H+](C)[C@H](C)c1sc(C)nc1C ZINC000639481411 356296059 /nfs/dbraw/zinc/29/60/59/356296059.db2.gz BFSSQNYCLVIVOE-SECBINFHSA-N 1 2 226.345 2.342 20 0 BEADLO CC(=O)C[N@H+](C)[C@H](C)c1sc(C)nc1C ZINC000639481411 356296063 /nfs/dbraw/zinc/29/60/63/356296063.db2.gz BFSSQNYCLVIVOE-SECBINFHSA-N 1 2 226.345 2.342 20 0 BEADLO CC(=O)C[N@@H+](C)[C@@H](C)c1sc(C)nc1C ZINC000639481412 356296234 /nfs/dbraw/zinc/29/62/34/356296234.db2.gz BFSSQNYCLVIVOE-VIFPVBQESA-N 1 2 226.345 2.342 20 0 BEADLO CC(=O)C[N@H+](C)[C@@H](C)c1sc(C)nc1C ZINC000639481412 356296238 /nfs/dbraw/zinc/29/62/38/356296238.db2.gz BFSSQNYCLVIVOE-VIFPVBQESA-N 1 2 226.345 2.342 20 0 BEADLO CCc1nc(N2CCC23CCC3)cc(C)[nH+]1 ZINC000336371879 356352252 /nfs/dbraw/zinc/35/22/52/356352252.db2.gz BYYKVWLVQPSKLG-UHFFFAOYSA-N 1 2 217.316 2.480 20 0 BEADLO FC(F)C[C@H]1COCC[N@@H+]1CCC(F)(F)F ZINC000353267330 134097461 /nfs/dbraw/zinc/09/74/61/134097461.db2.gz LWYWRBRGWQWCJJ-ZETCQYMHSA-N 1 2 247.207 2.295 20 0 BEADLO FC(F)C[C@H]1COCC[N@H+]1CCC(F)(F)F ZINC000353267330 134097462 /nfs/dbraw/zinc/09/74/62/134097462.db2.gz LWYWRBRGWQWCJJ-ZETCQYMHSA-N 1 2 247.207 2.295 20 0 BEADLO CCCSCC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000609619431 356393159 /nfs/dbraw/zinc/39/31/59/356393159.db2.gz QTEQLTKDXAULNP-UHFFFAOYSA-N 1 2 249.339 2.416 20 0 BEADLO CC(C)SCC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000609623241 356404083 /nfs/dbraw/zinc/40/40/83/356404083.db2.gz XOTPNRQJLHVTMM-UHFFFAOYSA-N 1 2 249.339 2.414 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)CCCn1cc[nH+]c1 ZINC000623280544 356452647 /nfs/dbraw/zinc/45/26/47/356452647.db2.gz AYIRLPZYJQMWFQ-NWDGAFQWSA-N 1 2 237.347 2.214 20 0 BEADLO CC[C@@H]1CN(c2cc(C)[nH+]cn2)C[C@@H](CC)O1 ZINC000420627515 192251911 /nfs/dbraw/zinc/25/19/11/192251911.db2.gz NEAXZKLPSKKFRJ-VXGBXAGGSA-N 1 2 235.331 2.179 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1ccc(Cl)c(F)c1 ZINC000639554431 356456631 /nfs/dbraw/zinc/45/66/31/356456631.db2.gz TZQGJLHUJZRITN-UHFFFAOYSA-N 1 2 229.682 2.500 20 0 BEADLO CC(=O)C[N@H+](C)Cc1ccc(Cl)c(F)c1 ZINC000639554431 356456634 /nfs/dbraw/zinc/45/66/34/356456634.db2.gz TZQGJLHUJZRITN-UHFFFAOYSA-N 1 2 229.682 2.500 20 0 BEADLO CC(C)n1ccnc1C[N@H+](C)[C@@H]1CCCOC1 ZINC000352214518 134108413 /nfs/dbraw/zinc/10/84/13/134108413.db2.gz ZTSNKTBYTNHAGS-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccnc1C[N@@H+](C)[C@@H]1CCCOC1 ZINC000352214518 134108414 /nfs/dbraw/zinc/10/84/14/134108414.db2.gz ZTSNKTBYTNHAGS-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO FC1=CCC[N@H+](C[C@H]2COc3ccccc3O2)C1 ZINC000639558789 356465024 /nfs/dbraw/zinc/46/50/24/356465024.db2.gz JPLIESBYLRVYQL-LBPRGKRZSA-N 1 2 249.285 2.386 20 0 BEADLO FC1=CCC[N@@H+](C[C@H]2COc3ccccc3O2)C1 ZINC000639558789 356465025 /nfs/dbraw/zinc/46/50/25/356465025.db2.gz JPLIESBYLRVYQL-LBPRGKRZSA-N 1 2 249.285 2.386 20 0 BEADLO CC[C@H]1C[C@H](Nc2cc(C)[nH+]cn2)CCO1 ZINC000420616762 192249312 /nfs/dbraw/zinc/24/93/12/192249312.db2.gz ICCNBFURPPXNCZ-MNOVXSKESA-N 1 2 221.304 2.155 20 0 BEADLO Cc1cncc(NCc2cc(C)[nH+]c(C)c2)n1 ZINC000420650686 192255211 /nfs/dbraw/zinc/25/52/11/192255211.db2.gz IGVHYRLHDIZTHQ-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO Cc1cnc(NCc2cc(C)[nH+]c(C)c2)nc1 ZINC000420655619 192256648 /nfs/dbraw/zinc/25/66/48/192256648.db2.gz RYLXUJOJZPSJPZ-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO CC1=CC[N@H+](Cc2nc(C3CCC3)no2)CC1 ZINC000639563035 356478120 /nfs/dbraw/zinc/47/81/20/356478120.db2.gz AUFAIYSONNTYOV-UHFFFAOYSA-N 1 2 233.315 2.489 20 0 BEADLO CC1=CC[N@@H+](Cc2nc(C3CCC3)no2)CC1 ZINC000639563035 356478124 /nfs/dbraw/zinc/47/81/24/356478124.db2.gz AUFAIYSONNTYOV-UHFFFAOYSA-N 1 2 233.315 2.489 20 0 BEADLO Cc1cc(CNC(=O)NC[C@@H]2C[C@@H]2C)cc(C)[nH+]1 ZINC000420812051 192262828 /nfs/dbraw/zinc/26/28/28/192262828.db2.gz WTQZRKBMNSWRJK-ZANVPECISA-N 1 2 247.342 2.154 20 0 BEADLO O=C([C@H]1CC=CCC1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000336168399 134113982 /nfs/dbraw/zinc/11/39/82/134113982.db2.gz OQQNQMOEHRPSQD-RYUDHWBXSA-N 1 2 245.326 2.430 20 0 BEADLO CC[C@@H](C)NC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000420775820 192263465 /nfs/dbraw/zinc/26/34/65/192263465.db2.gz URPXKMPCSZOTHS-SECBINFHSA-N 1 2 235.331 2.296 20 0 BEADLO Cc1cc(C)c(C[N@@H+]2CCC(=O)[C@H](C)C2)c(C)n1 ZINC000639591968 356509337 /nfs/dbraw/zinc/50/93/37/356509337.db2.gz HLRAUTOORXRBKB-LLVKDONJSA-N 1 2 246.354 2.418 20 0 BEADLO Cc1cc(C)c(C[N@H+]2CCC(=O)[C@H](C)C2)c(C)n1 ZINC000639591968 356509340 /nfs/dbraw/zinc/50/93/40/356509340.db2.gz HLRAUTOORXRBKB-LLVKDONJSA-N 1 2 246.354 2.418 20 0 BEADLO CC[C@@H]1C[N@H+]([C@H](C)c2cnccn2)C[C@H](CC)O1 ZINC000420953269 192278157 /nfs/dbraw/zinc/27/81/57/192278157.db2.gz IYVBBIQCXFXXRV-UPJWGTAASA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@H](C)c2cnccn2)C[C@H](CC)O1 ZINC000420953269 192278158 /nfs/dbraw/zinc/27/81/58/192278158.db2.gz IYVBBIQCXFXXRV-UPJWGTAASA-N 1 2 249.358 2.427 20 0 BEADLO CC(=O)C[N@@H+]1CC[C@@H](C(F)(F)F)C(C)(C)C1 ZINC000639609026 356531406 /nfs/dbraw/zinc/53/14/06/356531406.db2.gz QAZYCYVEMGAQPS-SECBINFHSA-N 1 2 237.265 2.486 20 0 BEADLO CC(=O)C[N@H+]1CC[C@@H](C(F)(F)F)C(C)(C)C1 ZINC000639609026 356531411 /nfs/dbraw/zinc/53/14/11/356531411.db2.gz QAZYCYVEMGAQPS-SECBINFHSA-N 1 2 237.265 2.486 20 0 BEADLO c1cc(C[N@@H+]2CCC[C@H]2c2cc[nH]n2)sn1 ZINC000639616601 356534225 /nfs/dbraw/zinc/53/42/25/356534225.db2.gz JGYKONWLPFXFAP-NSHDSACASA-N 1 2 234.328 2.203 20 0 BEADLO c1cc(C[N@H+]2CCC[C@H]2c2cc[nH]n2)sn1 ZINC000639616601 356534227 /nfs/dbraw/zinc/53/42/27/356534227.db2.gz JGYKONWLPFXFAP-NSHDSACASA-N 1 2 234.328 2.203 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1CC(=O)c1ccccc1F ZINC000639618798 356536197 /nfs/dbraw/zinc/53/61/97/356536197.db2.gz RJMOYHINDHASNC-UWVGGRQHSA-N 1 2 221.275 2.491 20 0 BEADLO CC[C@@H](Nc1cc(C)[nH+]cn1)c1noc(C)n1 ZINC000301484801 356542031 /nfs/dbraw/zinc/54/20/31/356542031.db2.gz VTUKMTRDKGPREO-SECBINFHSA-N 1 2 233.275 2.040 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CC[C@@H]2C2CC2)[nH+]1 ZINC000336198298 134127657 /nfs/dbraw/zinc/12/76/57/134127657.db2.gz FUJXPZBCHFKROQ-LLVKDONJSA-N 1 2 228.299 2.255 20 0 BEADLO c1ccc2oc(C[N@@H+]3CC[C@]34CCOC4)nc2c1 ZINC000421028032 192309988 /nfs/dbraw/zinc/30/99/88/192309988.db2.gz HDNMYUYMSBIMNU-CQSZACIVSA-N 1 2 244.294 2.193 20 0 BEADLO c1ccc2oc(C[N@H+]3CC[C@]34CCOC4)nc2c1 ZINC000421028032 192309990 /nfs/dbraw/zinc/30/99/90/192309990.db2.gz HDNMYUYMSBIMNU-CQSZACIVSA-N 1 2 244.294 2.193 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@](C)(F)C2)cn1 ZINC000336215277 134136057 /nfs/dbraw/zinc/13/60/57/134136057.db2.gz GDAPTKGOZZCGCE-LBPRGKRZSA-N 1 2 223.295 2.109 20 0 BEADLO CC(C)CCCC(=O)N[C@H]1CCn2c[nH+]cc2C1 ZINC000623300593 356569314 /nfs/dbraw/zinc/56/93/14/356569314.db2.gz VVVFFCIATYWEAG-LBPRGKRZSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1cccc(NC(=O)CCCn2cc[nH+]c2)n1 ZINC000122679382 363490517 /nfs/dbraw/zinc/49/05/17/363490517.db2.gz MMWYRDMPMNZMBX-UHFFFAOYSA-N 1 2 244.298 2.005 20 0 BEADLO CCC(F)(F)C[N@@H+]1CC[C@@H](OC)[C@H](C)C1 ZINC000639661905 356575412 /nfs/dbraw/zinc/57/54/12/356575412.db2.gz BPJZUCXINASALZ-NXEZZACHSA-N 1 2 221.291 2.389 20 0 BEADLO CCC(F)(F)C[N@H+]1CC[C@@H](OC)[C@H](C)C1 ZINC000639661905 356575416 /nfs/dbraw/zinc/57/54/16/356575416.db2.gz BPJZUCXINASALZ-NXEZZACHSA-N 1 2 221.291 2.389 20 0 BEADLO C[C@@H]1CC(F)(F)CCN1c1cc(CO)cc[nH+]1 ZINC000630094062 363534781 /nfs/dbraw/zinc/53/47/81/363534781.db2.gz UWSYXMMOVRCPAT-SECBINFHSA-N 1 2 242.269 2.198 20 0 BEADLO CC[C@@H](NC(=O)Cc1occc1C)c1[nH]cc[nH+]1 ZINC000613578842 363521648 /nfs/dbraw/zinc/52/16/48/363521648.db2.gz DWDLORYHDGZHAH-SNVBAGLBSA-N 1 2 247.298 2.121 20 0 BEADLO O=c1cc(C[N@H+]2CCCC(F)(F)C2)cc[nH]1 ZINC000639719708 356620431 /nfs/dbraw/zinc/62/04/31/356620431.db2.gz NKWZJXGQZRRMPM-UHFFFAOYSA-N 1 2 228.242 2.018 20 0 BEADLO O=c1cc(C[N@@H+]2CCCC(F)(F)C2)cc[nH]1 ZINC000639719708 356620436 /nfs/dbraw/zinc/62/04/36/356620436.db2.gz NKWZJXGQZRRMPM-UHFFFAOYSA-N 1 2 228.242 2.018 20 0 BEADLO CC1CC(CNc2cc(CO)cc[nH+]2)C1 ZINC000630095088 363545795 /nfs/dbraw/zinc/54/57/95/363545795.db2.gz REZBVXRCRMZQDO-UHFFFAOYSA-N 1 2 206.289 2.032 20 0 BEADLO CC(C)c1nnc(C[N@H+](C)C2CC2)s1 ZINC000450264771 202114392 /nfs/dbraw/zinc/11/43/92/202114392.db2.gz VAFRLRVTRJLVLO-UHFFFAOYSA-N 1 2 211.334 2.256 20 0 BEADLO CC(C)c1nnc(C[N@@H+](C)C2CC2)s1 ZINC000450264771 202114395 /nfs/dbraw/zinc/11/43/95/202114395.db2.gz VAFRLRVTRJLVLO-UHFFFAOYSA-N 1 2 211.334 2.256 20 0 BEADLO C[C@@H](c1csnn1)[N@H+](C)C[C@@H]1CCCCO1 ZINC000450286140 202118766 /nfs/dbraw/zinc/11/87/66/202118766.db2.gz NGPPUBYXWVFDOU-UWVGGRQHSA-N 1 2 241.360 2.100 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+](C)C[C@@H]1CCCCO1 ZINC000450286140 202118769 /nfs/dbraw/zinc/11/87/69/202118769.db2.gz NGPPUBYXWVFDOU-UWVGGRQHSA-N 1 2 241.360 2.100 20 0 BEADLO COc1ccc[nH+]c1N1CCC(C)(F)CC1 ZINC000630094376 363536914 /nfs/dbraw/zinc/53/69/14/363536914.db2.gz GVPGTQSNTQLBEO-UHFFFAOYSA-N 1 2 224.279 2.419 20 0 BEADLO C[C@H](Cc1noc(C[NH+](C)C)n1)c1ccccc1 ZINC000350646324 366315741 /nfs/dbraw/zinc/31/57/41/366315741.db2.gz NZYQVDJAWPCOOZ-LLVKDONJSA-N 1 2 245.326 2.477 20 0 BEADLO COC(=O)[C@@H]([NH2+]CC1=CCCCC1)C(C)C ZINC000583674744 356680642 /nfs/dbraw/zinc/68/06/42/356680642.db2.gz GTKGZGLXHPZRAT-LBPRGKRZSA-N 1 2 225.332 2.274 20 0 BEADLO C[C@@H](NCc1cn2ccccc2[nH+]1)C(C)(F)F ZINC000389465446 356679365 /nfs/dbraw/zinc/67/93/65/356679365.db2.gz IEYBSSPGYBPVPX-SECBINFHSA-N 1 2 239.269 2.468 20 0 BEADLO Cc1cc(N2CC(C)(C)C2)c(C#N)c[nH+]1 ZINC000399399207 356667748 /nfs/dbraw/zinc/66/77/48/356667748.db2.gz VTIQDAYCWBXDBI-UHFFFAOYSA-N 1 2 201.273 2.108 20 0 BEADLO C[C@@H]([NH2+]Cc1cccn1C)C(C)(F)F ZINC000389463902 356681519 /nfs/dbraw/zinc/68/15/19/356681519.db2.gz ISHSRGBFPSCGQK-MRVPVSSYSA-N 1 2 202.248 2.158 20 0 BEADLO Fc1cnccc1C[N@@H+]1CCC[C@H]1c1cn[nH]c1 ZINC000639777080 356720865 /nfs/dbraw/zinc/72/08/65/356720865.db2.gz RQKYHMFABKKHSU-ZDUSSCGKSA-N 1 2 246.289 2.281 20 0 BEADLO Fc1cnccc1C[N@H+]1CCC[C@H]1c1cn[nH]c1 ZINC000639777080 356720867 /nfs/dbraw/zinc/72/08/67/356720867.db2.gz RQKYHMFABKKHSU-ZDUSSCGKSA-N 1 2 246.289 2.281 20 0 BEADLO Cc1[nH]c(CN(C)Cc2ccns2)[nH+]c1C ZINC000639790786 356742962 /nfs/dbraw/zinc/74/29/62/356742962.db2.gz LZNNACSTYMYZPX-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1ccnc(C[N@H+](C)Cc2ccns2)c1 ZINC000639806817 356777683 /nfs/dbraw/zinc/77/76/83/356777683.db2.gz GVNLALJPYKZIBW-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ccnc(C[N@@H+](C)Cc2ccns2)c1 ZINC000639806817 356777685 /nfs/dbraw/zinc/77/76/85/356777685.db2.gz GVNLALJPYKZIBW-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cnccc1C[N@H+](C)Cc1ccns1 ZINC000639806784 356777957 /nfs/dbraw/zinc/77/79/57/356777957.db2.gz GQYZJOBNYVWROA-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cnccc1C[N@@H+](C)Cc1ccns1 ZINC000639806784 356777960 /nfs/dbraw/zinc/77/79/60/356777960.db2.gz GQYZJOBNYVWROA-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CCC[C@@H](C)[N@H+](C)Cc1noc(CC)n1 ZINC000054316621 363566685 /nfs/dbraw/zinc/56/66/85/363566685.db2.gz OCTRVWUODODKTR-SECBINFHSA-N 1 2 211.309 2.252 20 0 BEADLO CCC[C@@H](C)[N@@H+](C)Cc1noc(CC)n1 ZINC000054316621 363566687 /nfs/dbraw/zinc/56/66/87/363566687.db2.gz OCTRVWUODODKTR-SECBINFHSA-N 1 2 211.309 2.252 20 0 BEADLO C[C@H](CO)CSc1[nH+]cc2ccccn21 ZINC000154739029 538652726 /nfs/dbraw/zinc/65/27/26/538652726.db2.gz IFDDDVRZWQVMCT-SECBINFHSA-N 1 2 222.313 2.055 20 0 BEADLO CC[N@H+](Cc1cnn(C)c1)[C@H](C)c1ncc(C)o1 ZINC000357004776 356812107 /nfs/dbraw/zinc/81/21/07/356812107.db2.gz KWTNAIXBNKEYQJ-LLVKDONJSA-N 1 2 248.330 2.300 20 0 BEADLO CC[N@@H+](Cc1cnn(C)c1)[C@H](C)c1ncc(C)o1 ZINC000357004776 356812111 /nfs/dbraw/zinc/81/21/11/356812111.db2.gz KWTNAIXBNKEYQJ-LLVKDONJSA-N 1 2 248.330 2.300 20 0 BEADLO CO[C@H]1C[N@@H+]([C@@H](C)c2ccccc2F)CCO1 ZINC000639832348 356816994 /nfs/dbraw/zinc/81/69/94/356816994.db2.gz GHJKCMXJJRSAHT-GXFFZTMASA-N 1 2 239.290 2.191 20 0 BEADLO CO[C@H]1C[N@H+]([C@@H](C)c2ccccc2F)CCO1 ZINC000639832348 356816998 /nfs/dbraw/zinc/81/69/98/356816998.db2.gz GHJKCMXJJRSAHT-GXFFZTMASA-N 1 2 239.290 2.191 20 0 BEADLO CO[C@@H]1C[N@@H+]([C@@H](C)c2cccc(F)c2)CCO1 ZINC000639834320 356819342 /nfs/dbraw/zinc/81/93/42/356819342.db2.gz WFWDTSQUUDEUJJ-GWCFXTLKSA-N 1 2 239.290 2.191 20 0 BEADLO CO[C@@H]1C[N@H+]([C@@H](C)c2cccc(F)c2)CCO1 ZINC000639834320 356819348 /nfs/dbraw/zinc/81/93/48/356819348.db2.gz WFWDTSQUUDEUJJ-GWCFXTLKSA-N 1 2 239.290 2.191 20 0 BEADLO CO[C@@H]1C[N@@H+]([C@H](C)c2cccc(F)c2)CCO1 ZINC000639834322 356819520 /nfs/dbraw/zinc/81/95/20/356819520.db2.gz WFWDTSQUUDEUJJ-MFKMUULPSA-N 1 2 239.290 2.191 20 0 BEADLO CO[C@@H]1C[N@H+]([C@H](C)c2cccc(F)c2)CCO1 ZINC000639834322 356819524 /nfs/dbraw/zinc/81/95/24/356819524.db2.gz WFWDTSQUUDEUJJ-MFKMUULPSA-N 1 2 239.290 2.191 20 0 BEADLO CO[C@H]1C[N@@H+]([C@@H](C)c2cccc(F)c2)CCO1 ZINC000639834321 356819557 /nfs/dbraw/zinc/81/95/57/356819557.db2.gz WFWDTSQUUDEUJJ-GXFFZTMASA-N 1 2 239.290 2.191 20 0 BEADLO CO[C@H]1C[N@H+]([C@@H](C)c2cccc(F)c2)CCO1 ZINC000639834321 356819559 /nfs/dbraw/zinc/81/95/59/356819559.db2.gz WFWDTSQUUDEUJJ-GXFFZTMASA-N 1 2 239.290 2.191 20 0 BEADLO COCC[N@H+](C)Cc1cc(-c2ccco2)on1 ZINC000054355374 363569050 /nfs/dbraw/zinc/56/90/50/363569050.db2.gz HZVDARHSOQVTIG-UHFFFAOYSA-N 1 2 236.271 2.013 20 0 BEADLO COCC[N@@H+](C)Cc1cc(-c2ccco2)on1 ZINC000054355374 363569056 /nfs/dbraw/zinc/56/90/56/363569056.db2.gz HZVDARHSOQVTIG-UHFFFAOYSA-N 1 2 236.271 2.013 20 0 BEADLO C[C@H](c1ccccc1)[C@H](O)Cn1cc[nH+]c1 ZINC000450512915 202188496 /nfs/dbraw/zinc/18/84/96/202188496.db2.gz VLSJAQWJEJWZGN-DGCLKSJQSA-N 1 2 216.284 2.048 20 0 BEADLO CCc1cnccc1[C@@H](C)[NH2+]Cc1nc(C)no1 ZINC000361118942 356917061 /nfs/dbraw/zinc/91/70/61/356917061.db2.gz DUYZCHJTMXELMA-SECBINFHSA-N 1 2 246.314 2.186 20 0 BEADLO CC[N@@H+](Cc1noc(C(C)C)n1)C[C@@H](C)OC ZINC000361576444 356933902 /nfs/dbraw/zinc/93/39/02/356933902.db2.gz HRJSHPNIRUMLKM-SNVBAGLBSA-N 1 2 241.335 2.050 20 0 BEADLO CC[N@H+](Cc1noc(C(C)C)n1)C[C@@H](C)OC ZINC000361576444 356933906 /nfs/dbraw/zinc/93/39/06/356933906.db2.gz HRJSHPNIRUMLKM-SNVBAGLBSA-N 1 2 241.335 2.050 20 0 BEADLO Cc1nc(CNc2cc(C)[nH+]cc2C#N)cs1 ZINC000399581289 356981556 /nfs/dbraw/zinc/98/15/56/356981556.db2.gz LWAGSHHXEYRZKY-UHFFFAOYSA-N 1 2 244.323 2.061 20 0 BEADLO Cc1cc(CNc2cc[nH+]c(C(C)C)n2)ccn1 ZINC000450616068 202210355 /nfs/dbraw/zinc/21/03/55/202210355.db2.gz CYDOGIZREOCVRZ-UHFFFAOYSA-N 1 2 242.326 2.337 20 0 BEADLO C[C@H](CC1CCCC1)C(=O)NCc1c[nH+]cn1C ZINC000355250665 538793231 /nfs/dbraw/zinc/79/32/31/538793231.db2.gz CBZPBJQNWRVLOG-LLVKDONJSA-N 1 2 249.358 2.253 20 0 BEADLO CCCCc1cc(N[C@@H](CO)CC2CC2)nc[nH+]1 ZINC000631181548 357170033 /nfs/dbraw/zinc/17/00/33/357170033.db2.gz QZVSPAMFGITQDA-CYBMUJFWSA-N 1 2 249.358 2.392 20 0 BEADLO Oc1ccc2c(c1)C[N@@H+](CC1(F)CC1)C2 ZINC000628419443 357237959 /nfs/dbraw/zinc/23/79/59/357237959.db2.gz YIJVTUZSGNKPKA-UHFFFAOYSA-N 1 2 207.248 2.210 20 0 BEADLO Oc1ccc2c(c1)C[N@H+](CC1(F)CC1)C2 ZINC000628419443 357237962 /nfs/dbraw/zinc/23/79/62/357237962.db2.gz YIJVTUZSGNKPKA-UHFFFAOYSA-N 1 2 207.248 2.210 20 0 BEADLO Cn1c[nH+]cc1CNc1ncnc2sccc21 ZINC000356957429 538820693 /nfs/dbraw/zinc/82/06/93/538820693.db2.gz ACBWTCNTXREHMZ-UHFFFAOYSA-N 1 2 245.311 2.037 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000628422749 357244623 /nfs/dbraw/zinc/24/46/23/357244623.db2.gz JBIRIIMYDZBEKE-NEPJUHHUSA-N 1 2 237.372 2.188 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000628422749 357244626 /nfs/dbraw/zinc/24/46/26/357244626.db2.gz JBIRIIMYDZBEKE-NEPJUHHUSA-N 1 2 237.372 2.188 20 0 BEADLO Fc1cccc(C[NH+]2CC3(C2)CCCO3)c1 ZINC000628426783 357255242 /nfs/dbraw/zinc/25/52/42/357255242.db2.gz LPXCAUQXLWQTED-UHFFFAOYSA-N 1 2 221.275 2.191 20 0 BEADLO Cc1nn(C(C)C)cc1C[NH+]1CC2(C1)CCCO2 ZINC000628427696 357256099 /nfs/dbraw/zinc/25/60/99/357256099.db2.gz UJXSRUPKGIBXJV-UHFFFAOYSA-N 1 2 249.358 2.137 20 0 BEADLO C[C@@H]1C[C@H](C)[C@@H](C)N(C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000357146616 538826048 /nfs/dbraw/zinc/82/60/48/538826048.db2.gz ZBZQUQNLBWYAID-GRYCIOLGSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H]1C[C@H](C)[C@@H](C)N(C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000357146616 538826063 /nfs/dbraw/zinc/82/60/63/538826063.db2.gz ZBZQUQNLBWYAID-GRYCIOLGSA-N 1 2 249.358 2.235 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000582735414 357376344 /nfs/dbraw/zinc/37/63/44/357376344.db2.gz GZYYUNMQETUXFN-BREBYQMCSA-N 1 2 235.331 2.269 20 0 BEADLO Cc1cc(C[NH2+]Cc2ncccn2)cs1 ZINC000394432712 357355809 /nfs/dbraw/zinc/35/58/09/357355809.db2.gz CDEAWRWGBMQEGI-UHFFFAOYSA-N 1 2 219.313 2.136 20 0 BEADLO CCC[C@H](C)[C@@H]1CCCN1C(=O)Cn1cc[nH+]c1 ZINC000582937996 357440707 /nfs/dbraw/zinc/44/07/07/357440707.db2.gz YOQURHRSOBDMCX-STQMWFEESA-N 1 2 249.358 2.310 20 0 BEADLO COc1ccc[nH+]c1N[C@H](C)CC(C)(C)O ZINC000395063092 357410037 /nfs/dbraw/zinc/41/00/37/357410037.db2.gz ZYEHZBUMMTWMLX-SECBINFHSA-N 1 2 224.304 2.052 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2ccccc2CO)no1 ZINC000582754293 357381708 /nfs/dbraw/zinc/38/17/08/357381708.db2.gz OKFSVRSTZUMHSR-NSHDSACASA-N 1 2 246.310 2.326 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2ccccc2CO)no1 ZINC000582754287 357381715 /nfs/dbraw/zinc/38/17/15/357381715.db2.gz OKFSVRSTZUMHSR-LLVKDONJSA-N 1 2 246.310 2.326 20 0 BEADLO CC[C@H]1CCC[C@H]1C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000583005205 357454859 /nfs/dbraw/zinc/45/48/59/357454859.db2.gz OWCFGPDOKODNTK-WCQYABFASA-N 1 2 247.342 2.093 20 0 BEADLO COc1ccc(C)[nH+]c1NCc1nc(C)c(C)[nH]1 ZINC000583035382 357465722 /nfs/dbraw/zinc/46/57/22/357465722.db2.gz PEZKMBNCRFSFIZ-UHFFFAOYSA-N 1 2 246.314 2.351 20 0 BEADLO CC[C@@H](C)CC(=O)NCc1ccc[nH+]c1N(C)C ZINC000188677984 357571348 /nfs/dbraw/zinc/57/13/48/357571348.db2.gz AIRDJCMPEWKPGH-LLVKDONJSA-N 1 2 249.358 2.200 20 0 BEADLO CC(C)[C@@H]1CCN(C(=O)C[C@@H](C)n2cc[nH+]c2)C1 ZINC000583207405 357520623 /nfs/dbraw/zinc/52/06/23/357520623.db2.gz QIIFCRGNKXWOIS-CHWSQXEVSA-N 1 2 249.358 2.339 20 0 BEADLO CC(C)[C@H]1CCN(C(=O)C[C@@H](C)n2cc[nH+]c2)C1 ZINC000583207408 357520947 /nfs/dbraw/zinc/52/09/47/357520947.db2.gz QIIFCRGNKXWOIS-OLZOCXBDSA-N 1 2 249.358 2.339 20 0 BEADLO CCc1cc(N2CCOC(C)(C)[C@H]2C)nc(C)[nH+]1 ZINC000359723572 538857275 /nfs/dbraw/zinc/85/72/75/538857275.db2.gz CVNYHSVGNROYGZ-SNVBAGLBSA-N 1 2 249.358 2.351 20 0 BEADLO Cc1cnc(C(C)(C)[NH2+]Cc2cncnc2)s1 ZINC000175981346 538877633 /nfs/dbraw/zinc/87/76/33/538877633.db2.gz IRDWOXZPLYFJFF-UHFFFAOYSA-N 1 2 248.355 2.266 20 0 BEADLO c1coc([C@H]2C[N@H+](C[C@@H]3CCC=CO3)CCO2)c1 ZINC000191087845 357748738 /nfs/dbraw/zinc/74/87/38/357748738.db2.gz DNPKBLFWVIZNIV-GXTWGEPZSA-N 1 2 249.310 2.346 20 0 BEADLO c1coc([C@H]2C[N@@H+](C[C@@H]3CCC=CO3)CCO2)c1 ZINC000191087845 357748740 /nfs/dbraw/zinc/74/87/40/357748740.db2.gz DNPKBLFWVIZNIV-GXTWGEPZSA-N 1 2 249.310 2.346 20 0 BEADLO C[C@H](CC(=O)N1CCC[C@@H](C)[C@@H]1C)n1cc[nH+]c1 ZINC000583266501 357765371 /nfs/dbraw/zinc/76/53/71/357765371.db2.gz LXLFIRYEEDLRBE-UPJWGTAASA-N 1 2 249.358 2.481 20 0 BEADLO Cc1cccn2c(CNc3cnccn3)c[nH+]c12 ZINC000192151374 357824885 /nfs/dbraw/zinc/82/48/85/357824885.db2.gz DLCCEWXQAWTESB-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO CSCCC[N@@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000610369855 357811224 /nfs/dbraw/zinc/81/12/24/357811224.db2.gz VITGRIQNNRPLMI-QMMMGPOBSA-N 1 2 243.294 2.003 20 0 BEADLO CSCCC[N@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000610369855 357811226 /nfs/dbraw/zinc/81/12/26/357811226.db2.gz VITGRIQNNRPLMI-QMMMGPOBSA-N 1 2 243.294 2.003 20 0 BEADLO COc1cccc(CNc2cc[nH+]cc2F)n1 ZINC000192150411 357825210 /nfs/dbraw/zinc/82/52/10/357825210.db2.gz NPVLLFOTVNWGRX-UHFFFAOYSA-N 1 2 233.246 2.236 20 0 BEADLO Cc1nsc(C)c1C[N@@H+](C(C)C)C1COC1 ZINC000583271373 357788905 /nfs/dbraw/zinc/78/89/05/357788905.db2.gz CYQJLLHZMANROL-UHFFFAOYSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nsc(C)c1C[N@H+](C(C)C)C1COC1 ZINC000583271373 357788907 /nfs/dbraw/zinc/78/89/07/357788907.db2.gz CYQJLLHZMANROL-UHFFFAOYSA-N 1 2 240.372 2.369 20 0 BEADLO O=C(OCC1CC1)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000192898623 357857903 /nfs/dbraw/zinc/85/79/03/357857903.db2.gz IEGOKHIQYYAKJD-LLVKDONJSA-N 1 2 249.314 2.483 20 0 BEADLO Cc1cc(C[NH+](Cc2cc(C)no2)C2CC2)on1 ZINC000192937052 357861064 /nfs/dbraw/zinc/86/10/64/357861064.db2.gz AQQHHPPSCUDLDX-UHFFFAOYSA-N 1 2 247.298 2.444 20 0 BEADLO COc1cccc2c1cc[nH+]c2N[C@@H]1CCOC1 ZINC000235041780 357840628 /nfs/dbraw/zinc/84/06/28/357840628.db2.gz SCWFOAJGSXUKCU-SNVBAGLBSA-N 1 2 244.294 2.444 20 0 BEADLO C[C@H]1CCCC[C@H]1C[N@H+](CCO)CC(F)F ZINC000193024947 357865149 /nfs/dbraw/zinc/86/51/49/357865149.db2.gz FCFSPRBFKOCQDB-QWRGUYRKSA-N 1 2 235.318 2.372 20 0 BEADLO C[C@H]1CCCC[C@H]1C[N@@H+](CCO)CC(F)F ZINC000193024947 357865152 /nfs/dbraw/zinc/86/51/52/357865152.db2.gz FCFSPRBFKOCQDB-QWRGUYRKSA-N 1 2 235.318 2.372 20 0 BEADLO C[C@H]1CCC[C@]1(C)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000584391555 357883826 /nfs/dbraw/zinc/88/38/26/357883826.db2.gz YEVWTKYTBLDQCK-FZMZJTMJSA-N 1 2 247.342 2.093 20 0 BEADLO CSCC[N@@H+]1C[C@@H](C)O[C@@H](C(F)(F)F)C1 ZINC000610409992 357916568 /nfs/dbraw/zinc/91/65/68/357916568.db2.gz AXTZLCXFZJRYRD-HTQZYQBOSA-N 1 2 243.294 2.001 20 0 BEADLO CSCC[N@H+]1C[C@@H](C)O[C@@H](C(F)(F)F)C1 ZINC000610409992 357916573 /nfs/dbraw/zinc/91/65/73/357916573.db2.gz AXTZLCXFZJRYRD-HTQZYQBOSA-N 1 2 243.294 2.001 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC000020453954 357933945 /nfs/dbraw/zinc/93/39/45/357933945.db2.gz QPOYPHZVTUMAPC-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000020453954 357933947 /nfs/dbraw/zinc/93/39/47/357933947.db2.gz QPOYPHZVTUMAPC-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cn1nc(C2CC2)nc1C[N@H+](C)C1CC(C)(C)C1 ZINC000583750187 357933984 /nfs/dbraw/zinc/93/39/84/357933984.db2.gz AHXPQGHAYYMGDP-UHFFFAOYSA-N 1 2 248.374 2.313 20 0 BEADLO Cn1nc(C2CC2)nc1C[N@@H+](C)C1CC(C)(C)C1 ZINC000583750187 357933989 /nfs/dbraw/zinc/93/39/89/357933989.db2.gz AHXPQGHAYYMGDP-UHFFFAOYSA-N 1 2 248.374 2.313 20 0 BEADLO COC(=O)[C@@H]([NH2+]Cc1ccccc1C)C(C)C ZINC000035085033 357962935 /nfs/dbraw/zinc/96/29/35/357962935.db2.gz ZJAQBBYWEFTHBP-ZDUSSCGKSA-N 1 2 235.327 2.282 20 0 BEADLO C[C@@H](CC(=O)N(C)[C@H]1CC[C@@H](C)C1)n1cc[nH+]c1 ZINC000584473009 357990406 /nfs/dbraw/zinc/99/04/06/357990406.db2.gz MPWSJBODHFIFFL-AGIUHOORSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@H](CC(=O)N(C)[C@H]1CC[C@@H](C)C1)n1cc[nH+]c1 ZINC000584473012 357990460 /nfs/dbraw/zinc/99/04/60/357990460.db2.gz MPWSJBODHFIFFL-UPJWGTAASA-N 1 2 249.358 2.481 20 0 BEADLO Cc1n[nH]cc1C[N@@H+](C)Cc1ccn(C(C)C)n1 ZINC000639969698 358021871 /nfs/dbraw/zinc/02/18/71/358021871.db2.gz BITHDUFCBBOLPA-UHFFFAOYSA-N 1 2 247.346 2.128 20 0 BEADLO Cc1n[nH]cc1C[N@H+](C)Cc1ccn(C(C)C)n1 ZINC000639969698 358021873 /nfs/dbraw/zinc/02/18/73/358021873.db2.gz BITHDUFCBBOLPA-UHFFFAOYSA-N 1 2 247.346 2.128 20 0 BEADLO CC[C@H]1CCN1C(=O)Nc1cc(C)[nH+]cc1C ZINC000584512661 358024860 /nfs/dbraw/zinc/02/48/60/358024860.db2.gz RGKLKKAIMTUEBP-NSHDSACASA-N 1 2 233.315 2.137 20 0 BEADLO CCc1nc(C[NH+]2CCC(CCF)CC2)no1 ZINC000639988923 358028112 /nfs/dbraw/zinc/02/81/12/358028112.db2.gz NUXNTZJVRXTWJG-UHFFFAOYSA-N 1 2 241.310 2.204 20 0 BEADLO Cn1c[nH+]cc1Cc1noc(C2=CCCCC2)n1 ZINC000350223678 358043701 /nfs/dbraw/zinc/04/37/01/358043701.db2.gz WQERFBLROLQCAT-UHFFFAOYSA-N 1 2 244.298 2.351 20 0 BEADLO Cc1cc([NH2+]CCC(C)C)ccc1-n1cnnn1 ZINC000037104029 358064971 /nfs/dbraw/zinc/06/49/71/358064971.db2.gz NJPJNCORIUKPKO-UHFFFAOYSA-N 1 2 245.330 2.429 20 0 BEADLO COc1cccc2c1C[N@H+](Cc1c[nH]nc1C)C2 ZINC000628462226 358097710 /nfs/dbraw/zinc/09/77/10/358097710.db2.gz LIXCVTFSINBEIJ-UHFFFAOYSA-N 1 2 243.310 2.243 20 0 BEADLO COc1cccc2c1C[N@@H+](Cc1c[nH]nc1C)C2 ZINC000628462226 358097713 /nfs/dbraw/zinc/09/77/13/358097713.db2.gz LIXCVTFSINBEIJ-UHFFFAOYSA-N 1 2 243.310 2.243 20 0 BEADLO CCN(Cc1[nH+]ccn1C)[C@@H](C)C(F)(F)F ZINC000640065665 358153637 /nfs/dbraw/zinc/15/36/37/358153637.db2.gz ZDQOVSITESLCIM-QMMMGPOBSA-N 1 2 235.253 2.193 20 0 BEADLO COc1cc[nH+]c(CN2CCCCCO2)c1 ZINC000640123444 358203264 /nfs/dbraw/zinc/20/32/64/358203264.db2.gz OJBNXPYCDIBPTP-UHFFFAOYSA-N 1 2 222.288 2.008 20 0 BEADLO CC/C=C\CNc1cc(N2CCCC2)nc[nH+]1 ZINC000450690379 202233828 /nfs/dbraw/zinc/23/38/28/202233828.db2.gz GQTSWFUEJHUKCI-ARJAWSKDSA-N 1 2 232.331 2.455 20 0 BEADLO CC/C=C\CNc1cc(N2CCCC2)[nH+]cn1 ZINC000450690379 202233831 /nfs/dbraw/zinc/23/38/31/202233831.db2.gz GQTSWFUEJHUKCI-ARJAWSKDSA-N 1 2 232.331 2.455 20 0 BEADLO Cc1cc(N2C[C@H]3[C@@H]4C=C[C@@H](C4)[C@]3(C)C2)nc[nH+]1 ZINC000450698843 202237299 /nfs/dbraw/zinc/23/72/99/202237299.db2.gz XXLLQSXLGCGJRY-OSFYFWSMSA-N 1 2 241.338 2.433 20 0 BEADLO CO[C@@H]1CCN(c2nc(C)[nH+]c(C)c2C)C[C@H]1C ZINC000450756594 202257097 /nfs/dbraw/zinc/25/70/97/202257097.db2.gz KKJUMTHABCNFBY-NOZJJQNGSA-N 1 2 249.358 2.263 20 0 BEADLO CCC1(CC)CC[NH+](Cc2c[nH]nn2)CC1 ZINC000450755594 202257265 /nfs/dbraw/zinc/25/72/65/202257265.db2.gz FIFSYCCQQUADAD-UHFFFAOYSA-N 1 2 222.336 2.207 20 0 BEADLO CCC1(CC)CC[NH+](Cc2cnn[nH]2)CC1 ZINC000450755594 202257268 /nfs/dbraw/zinc/25/72/68/202257268.db2.gz FIFSYCCQQUADAD-UHFFFAOYSA-N 1 2 222.336 2.207 20 0 BEADLO CCC1(CC)CC[NH+](Cc2cn[nH]n2)CC1 ZINC000450755594 202257270 /nfs/dbraw/zinc/25/72/70/202257270.db2.gz FIFSYCCQQUADAD-UHFFFAOYSA-N 1 2 222.336 2.207 20 0 BEADLO Cc1cc(NC[C@@H]2CCO[C@H](C(C)C)C2)nc[nH+]1 ZINC000450741389 202251472 /nfs/dbraw/zinc/25/14/72/202251472.db2.gz WYNLTPBRGVLFRN-OLZOCXBDSA-N 1 2 249.358 2.070 20 0 BEADLO Cc1cc(NC[C@H]2CCO[C@@H](C(C)C)C2)nc[nH+]1 ZINC000450741390 202251820 /nfs/dbraw/zinc/25/18/20/202251820.db2.gz WYNLTPBRGVLFRN-QWHCGFSZSA-N 1 2 249.358 2.070 20 0 BEADLO CO[C@H]1CCN(c2cc[nH+]c(C(C)C)n2)C[C@@H]1C ZINC000450764333 202259523 /nfs/dbraw/zinc/25/95/23/202259523.db2.gz BYFXHUSAJNYPDC-RYUDHWBXSA-N 1 2 249.358 2.461 20 0 BEADLO CC/C(C)=C\c1nc(Cc2c[nH+]cn2C)no1 ZINC000351095445 366410136 /nfs/dbraw/zinc/41/01/36/366410136.db2.gz TZQROROUFYXRBT-UITAMQMPSA-N 1 2 232.287 2.207 20 0 BEADLO Cc1[nH+]cccc1Cc1noc(COC(C)C)n1 ZINC000351240596 366457281 /nfs/dbraw/zinc/45/72/81/366457281.db2.gz XEDBOBMUQRXTKO-UHFFFAOYSA-N 1 2 247.298 2.289 20 0 BEADLO FCC[NH2+][C@@H](CF)c1ccc(F)cc1 ZINC000640154463 358439123 /nfs/dbraw/zinc/43/91/23/358439123.db2.gz GNGULEMENOAZIM-JTQLQIEISA-N 1 2 203.207 2.395 20 0 BEADLO CCCOCc1nc(Cc2ccc[nH+]c2C)no1 ZINC000351221947 366453822 /nfs/dbraw/zinc/45/38/22/366453822.db2.gz ADSZDYYIJRVWSH-UHFFFAOYSA-N 1 2 247.298 2.290 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)Nc1ccccc1 ZINC000047717891 358600523 /nfs/dbraw/zinc/60/05/23/358600523.db2.gz JBVFCZANNXALRE-NSHDSACASA-N 1 2 244.298 2.093 20 0 BEADLO Cc1cc(N(C)Cc2ccc(C)[nH+]c2C)n[nH]1 ZINC000640192348 358600624 /nfs/dbraw/zinc/60/06/24/358600624.db2.gz VKKZOUBQNZYQIB-UHFFFAOYSA-N 1 2 230.315 2.366 20 0 BEADLO CC[C@H](C)C(=O)Nc1ccc[nH+]c1N(C)C ZINC000047976089 358609061 /nfs/dbraw/zinc/60/90/61/358609061.db2.gz RNUZXHORMUHJIN-VIFPVBQESA-N 1 2 221.304 2.132 20 0 BEADLO CCc1cc(NC[C@@H]2CC[C@@H]3C[C@@H]3C2)nc[nH+]1 ZINC000403335286 358629104 /nfs/dbraw/zinc/62/91/04/358629104.db2.gz DZPFCYLRXOPTOD-UTUOFQBUSA-N 1 2 231.343 2.309 20 0 BEADLO CCc1cnc(C[NH2+][C@H](C)c2cnccn2)s1 ZINC000130513039 358630344 /nfs/dbraw/zinc/63/03/44/358630344.db2.gz GKYYKKOJYSFCPT-SECBINFHSA-N 1 2 248.355 2.346 20 0 BEADLO CCC[N@H+](CC(F)F)C[C@@H]1CCCO1 ZINC000133322920 358750843 /nfs/dbraw/zinc/75/08/43/358750843.db2.gz YJAYCXJXJYTGFH-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CCC[N@@H+](CC(F)F)C[C@@H]1CCCO1 ZINC000133322920 358750846 /nfs/dbraw/zinc/75/08/46/358750846.db2.gz YJAYCXJXJYTGFH-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO O=C(Nc1ccsc1)[C@H]1CCn2c[nH+]cc2C1 ZINC000132600128 358729284 /nfs/dbraw/zinc/72/92/84/358729284.db2.gz RGDHKKPFYGSMKG-VIFPVBQESA-N 1 2 247.323 2.146 20 0 BEADLO CCOC(=O)C[NH2+][C@@H](c1cccs1)C1CC1 ZINC000051100078 358743400 /nfs/dbraw/zinc/74/34/00/358743400.db2.gz YXWWLMGWFYICBW-GFCCVEGCSA-N 1 2 239.340 2.352 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC1(C2(C)CC2)CC1 ZINC000578219886 366460143 /nfs/dbraw/zinc/46/01/43/366460143.db2.gz PGEURJBSGSWQLG-UHFFFAOYSA-N 1 2 245.326 2.266 20 0 BEADLO CC(C)c1cnc(C[NH+]2CCC(O)CC2)s1 ZINC000134872560 358808549 /nfs/dbraw/zinc/80/85/49/358808549.db2.gz OLAWXOMYCSVZNP-UHFFFAOYSA-N 1 2 240.372 2.223 20 0 BEADLO CC[N@H+](Cc1nc([C@H]2CC23CC3)no1)C1CC1 ZINC000351291466 366490564 /nfs/dbraw/zinc/49/05/64/366490564.db2.gz SAIYGAUCSBEXGE-SNVBAGLBSA-N 1 2 233.315 2.321 20 0 BEADLO CC[N@@H+](Cc1nc([C@H]2CC23CC3)no1)C1CC1 ZINC000351291466 366490569 /nfs/dbraw/zinc/49/05/69/366490569.db2.gz SAIYGAUCSBEXGE-SNVBAGLBSA-N 1 2 233.315 2.321 20 0 BEADLO CCOc1cc(N[C@H](CC)c2[nH]cc[nH+]2)ncn1 ZINC000139841824 358915097 /nfs/dbraw/zinc/91/50/97/358915097.db2.gz GHVITQJSDXVYFO-SECBINFHSA-N 1 2 247.302 2.162 20 0 BEADLO Cc1nc(NCc2cccc3c2OCO3)cc[nH+]1 ZINC000054936091 358879495 /nfs/dbraw/zinc/87/94/95/358879495.db2.gz GXEDWTGPTOGZKH-UHFFFAOYSA-N 1 2 243.266 2.126 20 0 BEADLO Cc1nc(C[NH2+][C@H]2CCCn3nccc32)c(C)o1 ZINC000640219322 358886849 /nfs/dbraw/zinc/88/68/49/358886849.db2.gz DIIVNHNQCJCIJH-NSHDSACASA-N 1 2 246.314 2.113 20 0 BEADLO COc1cc(CNc2ccc[nH+]c2C)sn1 ZINC000399113632 366508722 /nfs/dbraw/zinc/50/87/22/366508722.db2.gz JLZIAGVTSDKVKB-UHFFFAOYSA-N 1 2 235.312 2.467 20 0 BEADLO CC[C@H](NC(=O)c1ccc(C)o1)c1[nH]cc[nH+]1 ZINC000140533475 358922805 /nfs/dbraw/zinc/92/28/05/358922805.db2.gz BXMOVCJNARDBTM-VIFPVBQESA-N 1 2 233.271 2.192 20 0 BEADLO CC(C)OCCC[N@@H+]1OC2CCC1CC2 ZINC000640229624 358940361 /nfs/dbraw/zinc/94/03/61/358940361.db2.gz QWKCZFQQFVFUOM-UHFFFAOYSA-N 1 2 213.321 2.360 20 0 BEADLO CC(C)OCCC[N@H+]1OC2CCC1CC2 ZINC000640229624 358940363 /nfs/dbraw/zinc/94/03/63/358940363.db2.gz QWKCZFQQFVFUOM-UHFFFAOYSA-N 1 2 213.321 2.360 20 0 BEADLO C[C@H]1C[C@@H](C[N@@H+]2OC3CCC2CC3)CCO1 ZINC000640230939 358944243 /nfs/dbraw/zinc/94/42/43/358944243.db2.gz WYEGJGNVFHYJOT-ZSVAQUKISA-N 1 2 225.332 2.360 20 0 BEADLO C[C@H]1C[C@@H](C[N@H+]2OC3CCC2CC3)CCO1 ZINC000640230939 358944245 /nfs/dbraw/zinc/94/42/45/358944245.db2.gz WYEGJGNVFHYJOT-ZSVAQUKISA-N 1 2 225.332 2.360 20 0 BEADLO C[C@@H]1C[C@H](C[N@@H+]2OC3CCC2CC3)CCO1 ZINC000640230936 358944321 /nfs/dbraw/zinc/94/43/21/358944321.db2.gz WYEGJGNVFHYJOT-OKZRHMCRSA-N 1 2 225.332 2.360 20 0 BEADLO C[C@@H]1C[C@H](C[N@H+]2OC3CCC2CC3)CCO1 ZINC000640230936 358944322 /nfs/dbraw/zinc/94/43/22/358944322.db2.gz WYEGJGNVFHYJOT-OKZRHMCRSA-N 1 2 225.332 2.360 20 0 BEADLO C[C@H](C[C@@H]1CCOC1)Nc1cccc[nH+]1 ZINC000308844345 491138806 /nfs/dbraw/zinc/13/88/06/491138806.db2.gz LMLXGKGLOHSKBH-MNOVXSKESA-N 1 2 206.289 2.309 20 0 BEADLO c1csc(C[NH2+]Cc2cnn3ccccc23)n1 ZINC000071373213 359078308 /nfs/dbraw/zinc/07/83/08/359078308.db2.gz ZYRBXWDLMAJLSQ-UHFFFAOYSA-N 1 2 244.323 2.081 20 0 BEADLO Cc1ccc2[nH+]c(CS[C@@H](C)CO)cn2c1 ZINC000079087475 325442687 /nfs/dbraw/zinc/44/26/87/325442687.db2.gz VHXWKFGPWXGRSE-JTQLQIEISA-N 1 2 236.340 2.257 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccc3ccccc3n2)CCO1 ZINC000073516567 359103038 /nfs/dbraw/zinc/10/30/38/359103038.db2.gz WVNYWDDCUMBKOF-LBPRGKRZSA-N 1 2 242.322 2.456 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccc3ccccc3n2)CCO1 ZINC000073516567 359103044 /nfs/dbraw/zinc/10/30/44/359103044.db2.gz WVNYWDDCUMBKOF-LBPRGKRZSA-N 1 2 242.322 2.456 20 0 BEADLO Cc1cccc(C(=O)Nc2cc[nH+]c(C)c2)n1 ZINC000073906689 359108736 /nfs/dbraw/zinc/10/87/36/359108736.db2.gz FXZCFQGRQMHGQK-UHFFFAOYSA-N 1 2 227.267 2.346 20 0 BEADLO FC1(F)CCC[C@@H]1[NH2+]Cc1ccncc1 ZINC000308873257 491139483 /nfs/dbraw/zinc/13/94/83/491139483.db2.gz LVJITASQNDHBQZ-JTQLQIEISA-N 1 2 212.243 2.359 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCCC2(CC2)CC1 ZINC000628480196 359318000 /nfs/dbraw/zinc/31/80/00/359318000.db2.gz DEJUWDPWJKHHOA-UHFFFAOYSA-N 1 2 219.332 2.484 20 0 BEADLO Fc1ccc2nc(Cn3cc[nH+]c3)oc2c1 ZINC000162662358 359512309 /nfs/dbraw/zinc/51/23/09/359512309.db2.gz ZZPKKOAUWHZGPR-UHFFFAOYSA-N 1 2 217.203 2.212 20 0 BEADLO Cc1ccoc1CNC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000580453363 359559550 /nfs/dbraw/zinc/55/95/50/359559550.db2.gz WTFGFMKOSBUUQZ-NSHDSACASA-N 1 2 247.298 2.052 20 0 BEADLO Cc1cccnc1C[N@@H+]1CCC(=O)CC12CCC2 ZINC000580462356 359568993 /nfs/dbraw/zinc/56/89/93/359568993.db2.gz YAZTVZGGVVLVMR-UHFFFAOYSA-N 1 2 244.338 2.478 20 0 BEADLO Cc1cccnc1C[N@H+]1CCC(=O)CC12CCC2 ZINC000580462356 359568994 /nfs/dbraw/zinc/56/89/94/359568994.db2.gz YAZTVZGGVVLVMR-UHFFFAOYSA-N 1 2 244.338 2.478 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CCS[C@@H]1C ZINC000308963705 491141365 /nfs/dbraw/zinc/14/13/65/491141365.db2.gz TXEMZEYFERNBSS-RKDXNWHRSA-N 1 2 224.329 2.396 20 0 BEADLO C[NH+](C)Cc1cccc(O)c1Br ZINC000306312656 359592889 /nfs/dbraw/zinc/59/28/89/359592889.db2.gz NSIJGGWOXDFVKD-UHFFFAOYSA-N 1 2 230.105 2.216 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)Nc1ncc(Cl)s1 ZINC000308984211 491141863 /nfs/dbraw/zinc/14/18/63/491141863.db2.gz JDRGGJQELRIWIC-ZETCQYMHSA-N 1 2 242.735 2.494 20 0 BEADLO Cc1cc(NC(C)(C)C(F)F)nc[nH+]1 ZINC000306357328 359685007 /nfs/dbraw/zinc/68/50/07/359685007.db2.gz VHFKJHGZONRNPG-UHFFFAOYSA-N 1 2 201.220 2.241 20 0 BEADLO CC(C)CC[C@@H]1CCC[C@@H]1[NH2+]Cc1c[nH]nn1 ZINC000450820173 202274635 /nfs/dbraw/zinc/27/46/35/202274635.db2.gz NLQGZRARUJWODW-AAEUAGOBSA-N 1 2 236.363 2.499 20 0 BEADLO CC(C)CC[C@@H]1CCC[C@@H]1[NH2+]Cc1cn[nH]n1 ZINC000450820173 202274638 /nfs/dbraw/zinc/27/46/38/202274638.db2.gz NLQGZRARUJWODW-AAEUAGOBSA-N 1 2 236.363 2.499 20 0 BEADLO CC[C@H](C)C[N@H+](C)Cc1nsc(N(C)C)n1 ZINC000163214394 202278238 /nfs/dbraw/zinc/27/82/38/202278238.db2.gz CRRFPCBRUGKQNG-VIFPVBQESA-N 1 2 242.392 2.082 20 0 BEADLO CC[C@H](C)C[N@@H+](C)Cc1nsc(N(C)C)n1 ZINC000163214394 202278242 /nfs/dbraw/zinc/27/82/42/202278242.db2.gz CRRFPCBRUGKQNG-VIFPVBQESA-N 1 2 242.392 2.082 20 0 BEADLO C/C(=C/c1ccccc1)C[N@@H+](C)Cc1cnn[nH]1 ZINC000450842499 202286185 /nfs/dbraw/zinc/28/61/85/202286185.db2.gz BTRBQVALMGBWTM-WQLSENKSSA-N 1 2 242.326 2.340 20 0 BEADLO C/C(=C/c1ccccc1)C[N@H+](C)Cc1cnn[nH]1 ZINC000450842499 202286186 /nfs/dbraw/zinc/28/61/86/202286186.db2.gz BTRBQVALMGBWTM-WQLSENKSSA-N 1 2 242.326 2.340 20 0 BEADLO C/C(=C/c1ccccc1)C[N@@H+](C)Cc1c[nH]nn1 ZINC000450842499 202286189 /nfs/dbraw/zinc/28/61/89/202286189.db2.gz BTRBQVALMGBWTM-WQLSENKSSA-N 1 2 242.326 2.340 20 0 BEADLO C/C(=C/c1ccccc1)C[N@H+](C)Cc1c[nH]nn1 ZINC000450842499 202286192 /nfs/dbraw/zinc/28/61/92/202286192.db2.gz BTRBQVALMGBWTM-WQLSENKSSA-N 1 2 242.326 2.340 20 0 BEADLO c1cc(NCCC[C@H]2CCOC2)nc(C2CC2)[nH+]1 ZINC000450885411 202296987 /nfs/dbraw/zinc/29/69/87/202296987.db2.gz BUGIEACPKJWWRS-NSHDSACASA-N 1 2 247.342 2.005 20 0 BEADLO CO[C@@]1(C)CCC[N@@H+]([C@H](C)c2csnn2)C1 ZINC000450885389 202298033 /nfs/dbraw/zinc/29/80/33/202298033.db2.gz BOBWJZNNJVFIFT-KOLCDFICSA-N 1 2 241.360 2.100 20 0 BEADLO CO[C@@]1(C)CCC[N@H+]([C@H](C)c2csnn2)C1 ZINC000450885389 202298036 /nfs/dbraw/zinc/29/80/36/202298036.db2.gz BOBWJZNNJVFIFT-KOLCDFICSA-N 1 2 241.360 2.100 20 0 BEADLO CCn1cc([C@H](C)Nc2cc(C)[nH+]cn2)cn1 ZINC000450879814 202294637 /nfs/dbraw/zinc/29/46/37/202294637.db2.gz VOOLYRAIBXSPPC-JTQLQIEISA-N 1 2 231.303 2.175 20 0 BEADLO CC(C)[C@H]([NH2+]Cc1c[nH]nn1)c1ccc(F)cc1 ZINC000450924193 202309740 /nfs/dbraw/zinc/30/97/40/202309740.db2.gz SZWMWJYTHGZEJV-ZDUSSCGKSA-N 1 2 248.305 2.431 20 0 BEADLO CC(C)[C@H]([NH2+]Cc1cn[nH]n1)c1ccc(F)cc1 ZINC000450924193 202309744 /nfs/dbraw/zinc/30/97/44/202309744.db2.gz SZWMWJYTHGZEJV-ZDUSSCGKSA-N 1 2 248.305 2.431 20 0 BEADLO Cc1nc(N2CC[C@H](CCCO)C2)c(C)c(C)[nH+]1 ZINC000450955054 202318684 /nfs/dbraw/zinc/31/86/84/202318684.db2.gz OZDVFSYNVHZCCM-ZDUSSCGKSA-N 1 2 249.358 2.001 20 0 BEADLO CO[C@H](C)C[N@H+](C)Cc1nnc(C(C)C)s1 ZINC000450992124 202329610 /nfs/dbraw/zinc/32/96/10/202329610.db2.gz OLORZPBVNOBHIR-SECBINFHSA-N 1 2 243.376 2.128 20 0 BEADLO CO[C@H](C)C[N@@H+](C)Cc1nnc(C(C)C)s1 ZINC000450992124 202329614 /nfs/dbraw/zinc/32/96/14/202329614.db2.gz OLORZPBVNOBHIR-SECBINFHSA-N 1 2 243.376 2.128 20 0 BEADLO CCC(=O)CCC[N@@H+]1CCOC[C@H]1CC(F)F ZINC000450991501 202330439 /nfs/dbraw/zinc/33/04/39/202330439.db2.gz KJSGBZJAGIRRCH-SNVBAGLBSA-N 1 2 249.301 2.102 20 0 BEADLO CCC(=O)CCC[N@H+]1CCOC[C@H]1CC(F)F ZINC000450991501 202330441 /nfs/dbraw/zinc/33/04/41/202330441.db2.gz KJSGBZJAGIRRCH-SNVBAGLBSA-N 1 2 249.301 2.102 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@](C)(F)C2)nn1C ZINC000451110032 202353683 /nfs/dbraw/zinc/35/36/83/202353683.db2.gz BLAXVOGQEVGIRT-LBPRGKRZSA-N 1 2 225.311 2.053 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@](C)(F)C2)nn1C ZINC000451110032 202353685 /nfs/dbraw/zinc/35/36/85/202353685.db2.gz BLAXVOGQEVGIRT-LBPRGKRZSA-N 1 2 225.311 2.053 20 0 BEADLO CCOC(=O)[C@H](CC)[N@@H+]1CCC[C@](C)(F)C1 ZINC000451118402 202358414 /nfs/dbraw/zinc/35/84/14/202358414.db2.gz XTBBPAYCMRLJOQ-JQWIXIFHSA-N 1 2 231.311 2.152 20 0 BEADLO CCOC(=O)[C@H](CC)[N@H+]1CCC[C@](C)(F)C1 ZINC000451118402 202358416 /nfs/dbraw/zinc/35/84/16/202358416.db2.gz XTBBPAYCMRLJOQ-JQWIXIFHSA-N 1 2 231.311 2.152 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+]Cc2cn[nH]c2)s1 ZINC000309162129 491146019 /nfs/dbraw/zinc/14/60/19/491146019.db2.gz ZMFOBQQYJXVAJA-MRVPVSSYSA-N 1 2 222.317 2.025 20 0 BEADLO CC[N@H+](Cc1ccc(C(C)=O)cc1)C1COC1 ZINC000451286228 202393410 /nfs/dbraw/zinc/39/34/10/202393410.db2.gz CQFFEALOCBBHBA-UHFFFAOYSA-N 1 2 233.311 2.110 20 0 BEADLO CC[N@@H+](Cc1ccc(C(C)=O)cc1)C1COC1 ZINC000451286228 202393412 /nfs/dbraw/zinc/39/34/12/202393412.db2.gz CQFFEALOCBBHBA-UHFFFAOYSA-N 1 2 233.311 2.110 20 0 BEADLO COC(=O)[C@@H]([NH2+]CCC1CC1)c1ccccc1 ZINC000088490747 359962938 /nfs/dbraw/zinc/96/29/38/359962938.db2.gz AFZSDYIQYVRIOU-ZDUSSCGKSA-N 1 2 233.311 2.290 20 0 BEADLO COCc1ccccc1C[NH2+]Cc1cc(C)on1 ZINC000088557238 359965528 /nfs/dbraw/zinc/96/55/28/359965528.db2.gz LPSRAUDIPGFWPC-UHFFFAOYSA-N 1 2 246.310 2.419 20 0 BEADLO CCn1ncnc1C[NH2+][C@H](C)c1cc(C)oc1C ZINC000088591087 359969287 /nfs/dbraw/zinc/96/92/87/359969287.db2.gz AHFFISCJRPWYCF-SNVBAGLBSA-N 1 2 248.330 2.359 20 0 BEADLO O=C(CCC1CCCCC1)NCc1c[nH+]c[nH]1 ZINC000088759244 359977125 /nfs/dbraw/zinc/97/71/25/359977125.db2.gz ILJNTEJJVSXCDR-UHFFFAOYSA-N 1 2 235.331 2.386 20 0 BEADLO O=C(CCC1CCCCC1)NCc1c[nH]c[nH+]1 ZINC000088759244 359977131 /nfs/dbraw/zinc/97/71/31/359977131.db2.gz ILJNTEJJVSXCDR-UHFFFAOYSA-N 1 2 235.331 2.386 20 0 BEADLO CN(C(=O)Cn1cc[nH+]c1)C1CCC(C)(C)CC1 ZINC000578946327 366676762 /nfs/dbraw/zinc/67/67/62/366676762.db2.gz CSAQFWZKGFBRJM-UHFFFAOYSA-N 1 2 249.358 2.310 20 0 BEADLO CC(C)n1ccc(C[C@@H](C)Nc2c[nH]c[nH+]2)n1 ZINC000578944306 366677212 /nfs/dbraw/zinc/67/72/12/366677212.db2.gz ZFSASVDLPBLJIP-SNVBAGLBSA-N 1 2 233.319 2.230 20 0 BEADLO Cc1occc1CNc1nc[nH+]c(N)c1Cl ZINC000309247957 491146598 /nfs/dbraw/zinc/14/65/98/491146598.db2.gz CWSLXRJCGFCBQZ-UHFFFAOYSA-N 1 2 238.678 2.226 20 0 BEADLO Cc1occc1CNc1[nH+]cnc(N)c1Cl ZINC000309247957 491146599 /nfs/dbraw/zinc/14/65/99/491146599.db2.gz CWSLXRJCGFCBQZ-UHFFFAOYSA-N 1 2 238.678 2.226 20 0 BEADLO CN(C)c1ccc(NCc2nccs2)c[nH+]1 ZINC000082493603 491146829 /nfs/dbraw/zinc/14/68/29/491146829.db2.gz ZHMILVMXIXVTEP-UHFFFAOYSA-N 1 2 234.328 2.216 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CCOC[C@H]1C1CC1 ZINC000090007908 360052964 /nfs/dbraw/zinc/05/29/64/360052964.db2.gz NBDDQDGLTQROPV-ZDUSSCGKSA-N 1 2 249.358 2.075 20 0 BEADLO COc1ccc([C@@H](C)[NH2+]Cc2ncccn2)cc1 ZINC000090340143 360070087 /nfs/dbraw/zinc/07/00/87/360070087.db2.gz AEOJQLZFXABRDD-LLVKDONJSA-N 1 2 243.310 2.336 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1ccc(COC)o1 ZINC000091980185 360139512 /nfs/dbraw/zinc/13/95/12/360139512.db2.gz COKCQOMKRAGQAM-LLVKDONJSA-N 1 2 239.315 2.037 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1ccc(COC)o1 ZINC000091980185 360139517 /nfs/dbraw/zinc/13/95/17/360139517.db2.gz COKCQOMKRAGQAM-LLVKDONJSA-N 1 2 239.315 2.037 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1scnc1C ZINC000091981891 360139534 /nfs/dbraw/zinc/13/95/34/360139534.db2.gz LKHDURASHLLJNA-SNVBAGLBSA-N 1 2 226.345 2.062 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1scnc1C ZINC000091981891 360139539 /nfs/dbraw/zinc/13/95/39/360139539.db2.gz LKHDURASHLLJNA-SNVBAGLBSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1ccc(O)c(CNc2c[nH+]ccc2C)n1 ZINC000091995452 360144701 /nfs/dbraw/zinc/14/47/01/360144701.db2.gz CNLMHTZTMSITKM-UHFFFAOYSA-N 1 2 229.283 2.411 20 0 BEADLO O=C(Nc1ccccc1)[C@H]1CCn2c[nH+]cc2C1 ZINC000096642059 360351413 /nfs/dbraw/zinc/35/14/13/360351413.db2.gz SFBZJIGZDBKNSR-NSHDSACASA-N 1 2 241.294 2.084 20 0 BEADLO O[C@H](CNc1cc2ccccc2c[nH+]1)C1CC1 ZINC000631098696 360375704 /nfs/dbraw/zinc/37/57/04/360375704.db2.gz ROSVYIYMUZQWDF-CYBMUJFWSA-N 1 2 228.295 2.418 20 0 BEADLO CC(C)c1csc(C[NH2+]Cc2cn[nH]c2)n1 ZINC000309407582 491148764 /nfs/dbraw/zinc/14/87/64/491148764.db2.gz IDKBOXQDDAIFGB-UHFFFAOYSA-N 1 2 236.344 2.279 20 0 BEADLO CC(C)(C(=O)N[C@H]1CCCC12CC2)c1c[nH]c[nH+]1 ZINC000633776299 360472862 /nfs/dbraw/zinc/47/28/62/360472862.db2.gz BODBARBGYSAIOH-JTQLQIEISA-N 1 2 247.342 2.136 20 0 BEADLO CCCCc1cc(NCCc2ccc[nH]2)nc[nH+]1 ZINC000631192943 360589608 /nfs/dbraw/zinc/58/96/08/360589608.db2.gz VOCNUXBVDYVTGU-UHFFFAOYSA-N 1 2 244.342 2.224 20 0 BEADLO O=C(CCn1cc[nH+]c1)NCC[C@H]1CC=CCC1 ZINC000628892295 360732590 /nfs/dbraw/zinc/73/25/90/360732590.db2.gz VLGJZBSFKMTNPY-ZDUSSCGKSA-N 1 2 247.342 2.136 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2ncnn2C)c(F)c1 ZINC000631120329 360741253 /nfs/dbraw/zinc/74/12/53/360741253.db2.gz ITVRGQZIFZLEEI-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO Cn1cc([C@H]([NH2+]CC(F)F)C(C)(C)C)cn1 ZINC000309559265 491151496 /nfs/dbraw/zinc/15/14/96/491151496.db2.gz IRNUXGACNOGPHY-JTQLQIEISA-N 1 2 231.290 2.362 20 0 BEADLO CC(C)c1nc2[nH]ccc2c(NCC[C@H](C)O)[nH+]1 ZINC000631120726 360778509 /nfs/dbraw/zinc/77/85/09/360778509.db2.gz WUOSNSRKTQQKHJ-VIFPVBQESA-N 1 2 248.330 2.216 20 0 BEADLO Cn1nccc1C[NH2+]C1(C(F)F)CCCC1 ZINC000309579016 491152123 /nfs/dbraw/zinc/15/21/23/491152123.db2.gz PSCJWSFZYKAJSL-UHFFFAOYSA-N 1 2 229.274 2.088 20 0 BEADLO C[NH2+]c1ccc(NCc2c[nH]nc2C)cc1 ZINC000629389771 361036200 /nfs/dbraw/zinc/03/62/00/361036200.db2.gz VLPDRMDLVLQGGE-UHFFFAOYSA-N 1 2 216.288 2.372 20 0 BEADLO Cc1sccc1NC(=O)C[NH+]1CC(C)(C)C1 ZINC000634217193 361081539 /nfs/dbraw/zinc/08/15/39/361081539.db2.gz ZFBGCVSABLIBTG-UHFFFAOYSA-N 1 2 238.356 2.337 20 0 BEADLO CC(C)c1nc(C[N@H+](C)[C@@H](C)CO)cs1 ZINC000159149171 361224059 /nfs/dbraw/zinc/22/40/59/361224059.db2.gz NJAMZRLYAORSOH-VIFPVBQESA-N 1 2 228.361 2.079 20 0 BEADLO CC(C)c1nc(C[N@@H+](C)[C@@H](C)CO)cs1 ZINC000159149171 361224061 /nfs/dbraw/zinc/22/40/61/361224061.db2.gz NJAMZRLYAORSOH-VIFPVBQESA-N 1 2 228.361 2.079 20 0 BEADLO C[C@@H](CC(=O)NCCC1=CCCC1)n1cc[nH+]c1 ZINC000578991730 366688851 /nfs/dbraw/zinc/68/88/51/366688851.db2.gz KWRVNEPGRPWAIP-LBPRGKRZSA-N 1 2 247.342 2.451 20 0 BEADLO Cc1ncc([C@H](C)[NH2+]Cc2ccn(C)n2)s1 ZINC000309771775 491156208 /nfs/dbraw/zinc/15/62/08/491156208.db2.gz KPYZVWMLWIUDCD-QMMMGPOBSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1nnc(C[NH2+]C2(c3cccc(F)c3)CC2)[nH]1 ZINC000428325597 201010081 /nfs/dbraw/zinc/01/00/81/201010081.db2.gz HODVCCHIIXFFDD-UHFFFAOYSA-N 1 2 246.289 2.031 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+]2CCO[C@H](C(C)C)C2)cn1 ZINC000428348988 201012293 /nfs/dbraw/zinc/01/22/93/201012293.db2.gz QJTHKVAAHYCDCR-OCCSQVGLSA-N 1 2 249.358 2.203 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+]2CCO[C@H](C(C)C)C2)cn1 ZINC000428348988 201012296 /nfs/dbraw/zinc/01/22/96/201012296.db2.gz QJTHKVAAHYCDCR-OCCSQVGLSA-N 1 2 249.358 2.203 20 0 BEADLO Cc1nc(N(C)[C@@H]2CC[C@@H](C)C2)cc[nH+]1 ZINC000428674815 201033975 /nfs/dbraw/zinc/03/39/75/201033975.db2.gz YGRYQCABCZSZGE-MWLCHTKSSA-N 1 2 205.305 2.410 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)CC1(C)CC1 ZINC000428730843 201039426 /nfs/dbraw/zinc/03/94/26/201039426.db2.gz QDTYPMFRSGAKON-UHFFFAOYSA-N 1 2 218.300 2.195 20 0 BEADLO CSCCC[N@H+](C)Cc1nnc(C(C)C)[nH]1 ZINC000428969452 201053975 /nfs/dbraw/zinc/05/39/75/201053975.db2.gz ROIFPJQHWIALIV-UHFFFAOYSA-N 1 2 242.392 2.113 20 0 BEADLO CSCCC[N@@H+](C)Cc1nnc(C(C)C)[nH]1 ZINC000428969452 201053979 /nfs/dbraw/zinc/05/39/79/201053979.db2.gz ROIFPJQHWIALIV-UHFFFAOYSA-N 1 2 242.392 2.113 20 0 BEADLO CCc1nnc(C[NH2+][C@H](C)c2cc(C)oc2C)[nH]1 ZINC000162463544 361352825 /nfs/dbraw/zinc/35/28/25/361352825.db2.gz NYAMPQQCGXYWCZ-SECBINFHSA-N 1 2 248.330 2.428 20 0 BEADLO CCOC(=O)C(CC)(CC)[NH2+]CCOC(C)C ZINC000429270111 201087323 /nfs/dbraw/zinc/08/73/23/201087323.db2.gz FFUPHYXTVNPORT-UHFFFAOYSA-N 1 2 245.363 2.123 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3nn[nH]c3C2)c(C)s1 ZINC000429290502 201097220 /nfs/dbraw/zinc/09/72/20/201097220.db2.gz GTJUFVKBIJSBTR-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO Cc1cc(C[N@H+]2CCc3nn[nH]c3C2)c(C)s1 ZINC000429290502 201097221 /nfs/dbraw/zinc/09/72/21/201097221.db2.gz GTJUFVKBIJSBTR-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO Cc1ccc2[nH+]cc(CNc3nncs3)n2c1 ZINC000181452097 366812245 /nfs/dbraw/zinc/81/22/45/366812245.db2.gz JENQTCLYXUFVLS-UHFFFAOYSA-N 1 2 245.311 2.106 20 0 BEADLO CC(C)[C@H](O)C[N@@H+]1CCCC[C@@H]1C(F)F ZINC000433189896 201164777 /nfs/dbraw/zinc/16/47/77/201164777.db2.gz TXLDWYMAPAYOHY-NXEZZACHSA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)[C@H](O)C[N@H+]1CCCC[C@@H]1C(F)F ZINC000433189896 201164780 /nfs/dbraw/zinc/16/47/80/201164780.db2.gz TXLDWYMAPAYOHY-NXEZZACHSA-N 1 2 221.291 2.123 20 0 BEADLO C[NH2+]c1ccc(NCc2cc(C)n(C)n2)cc1 ZINC000629654825 361558655 /nfs/dbraw/zinc/55/86/55/361558655.db2.gz RWUWFHIZEPDNOJ-UHFFFAOYSA-N 1 2 230.315 2.382 20 0 BEADLO CO[C@H](C)CCNc1[nH+]c(C)nc2[nH]ccc21 ZINC000433792842 201192889 /nfs/dbraw/zinc/19/28/89/201192889.db2.gz KARNOKYUHQTJKC-MRVPVSSYSA-N 1 2 234.303 2.055 20 0 BEADLO CNc1ccc([NH2+]C[C@@H](C)COC)cc1 ZINC000629653194 361553444 /nfs/dbraw/zinc/55/34/44/361553444.db2.gz CPNJNVDKCMTSSR-SNVBAGLBSA-N 1 2 208.305 2.423 20 0 BEADLO C[NH2+]c1ccc(NC[C@@H](C)COC)cc1 ZINC000629653194 361553447 /nfs/dbraw/zinc/55/34/47/361553447.db2.gz CPNJNVDKCMTSSR-SNVBAGLBSA-N 1 2 208.305 2.423 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@H](CCO)C(C)C)[nH+]1 ZINC000433772077 201194095 /nfs/dbraw/zinc/19/40/95/201194095.db2.gz XAGIDPMNLGKAIV-LLVKDONJSA-N 1 2 248.330 2.085 20 0 BEADLO CC[C@H](Nc1cc[nH+]c(C)n1)[C@@H]1CCCO1 ZINC000153191473 201225345 /nfs/dbraw/zinc/22/53/45/201225345.db2.gz UYCSCNBHRFJPIQ-QWRGUYRKSA-N 1 2 221.304 2.155 20 0 BEADLO CCC(C)(C)CC[N@H+](C)Cc1nnc[nH]1 ZINC000434614057 201228180 /nfs/dbraw/zinc/22/81/80/201228180.db2.gz HGPSGJHZEUTANV-UHFFFAOYSA-N 1 2 210.325 2.063 20 0 BEADLO CCC(C)(C)CC[N@@H+](C)Cc1nnc[nH]1 ZINC000434614057 201228183 /nfs/dbraw/zinc/22/81/83/201228183.db2.gz HGPSGJHZEUTANV-UHFFFAOYSA-N 1 2 210.325 2.063 20 0 BEADLO CC(C)Nc1ccc(-c2cnn(C)c2)c[nH+]1 ZINC000629691614 361619689 /nfs/dbraw/zinc/61/96/89/361619689.db2.gz YYLHNFPEEWOKCX-UHFFFAOYSA-N 1 2 216.288 2.302 20 0 BEADLO CC(C)c1nc(N[C@@]2(C)CCOC2)cc[nH+]1 ZINC000153494076 201240792 /nfs/dbraw/zinc/24/07/92/201240792.db2.gz WJDKFAOXGJJOKT-LBPRGKRZSA-N 1 2 221.304 2.191 20 0 BEADLO CCCC[C@@H]([NH2+][C@H]1CCCSC1)C(=O)OC ZINC000154597491 201286255 /nfs/dbraw/zinc/28/62/55/201286255.db2.gz ANSLKICNYMEQBS-WDEREUQCSA-N 1 2 245.388 2.203 20 0 BEADLO COCCCNc1ccc(-c2ccoc2)c[nH+]1 ZINC000629715065 361657421 /nfs/dbraw/zinc/65/74/21/361657421.db2.gz TZDAODZIDVIWFX-UHFFFAOYSA-N 1 2 232.283 2.212 20 0 BEADLO CNc1ccc(-c2ccc3c(c2)CCO3)c[nH+]1 ZINC000629723196 361662431 /nfs/dbraw/zinc/66/24/31/361662431.db2.gz JACXPXCCDSTJKB-UHFFFAOYSA-N 1 2 226.279 2.147 20 0 BEADLO Cc1cncc(-c2ccc(N[C@@H](C)CO)[nH+]c2)c1 ZINC000629735387 361671813 /nfs/dbraw/zinc/67/18/13/361671813.db2.gz UQADVEFRGHGBNN-NSHDSACASA-N 1 2 243.310 2.245 20 0 BEADLO COCC1(CNc2ccc(OC)c[nH+]2)CCC1 ZINC000310540108 491161937 /nfs/dbraw/zinc/16/19/37/491161937.db2.gz SJHDQENOULHQID-UHFFFAOYSA-N 1 2 236.315 2.319 20 0 BEADLO CCCCc1cc(N[C@@H](C)CCO)nc[nH+]1 ZINC000631124404 361707821 /nfs/dbraw/zinc/70/78/21/361707821.db2.gz LEFFVQBIJDGMCT-JTQLQIEISA-N 1 2 223.320 2.002 20 0 BEADLO CCCCc1cc(N[C@H](C)CCO)nc[nH+]1 ZINC000631124407 361708192 /nfs/dbraw/zinc/70/81/92/361708192.db2.gz LEFFVQBIJDGMCT-SNVBAGLBSA-N 1 2 223.320 2.002 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)NC[C@H]1CCCC12CC2 ZINC000629831163 361727776 /nfs/dbraw/zinc/72/77/76/361727776.db2.gz QDNBFCRVRLRRLE-LLVKDONJSA-N 1 2 247.342 2.039 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2cccc(O)c2)o1 ZINC000080917645 363885933 /nfs/dbraw/zinc/88/59/33/363885933.db2.gz QYRYPXZQVOWUBR-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2cccc(O)c2)o1 ZINC000080917645 363885939 /nfs/dbraw/zinc/88/59/39/363885939.db2.gz QYRYPXZQVOWUBR-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO CC[C@](C)(NC(=O)c1c[nH+]c(C)[nH]1)C1CC1 ZINC000618954012 363923096 /nfs/dbraw/zinc/92/30/96/363923096.db2.gz PJUHNOPNGIWGHZ-LBPRGKRZSA-N 1 2 221.304 2.027 20 0 BEADLO CCn1nccc1C(=O)Nc1ccc(C)[nH+]c1C ZINC000154078053 541334429 /nfs/dbraw/zinc/33/44/29/541334429.db2.gz QHOLKTRNTCOAFO-UHFFFAOYSA-N 1 2 244.298 2.167 20 0 BEADLO Cn1ncc2c1nc[nH+]c2N[C@H]1CCCC12CC2 ZINC000630385863 364099691 /nfs/dbraw/zinc/09/96/91/364099691.db2.gz QQQKQOGQGHGRCL-JTQLQIEISA-N 1 2 243.314 2.108 20 0 BEADLO COc1ccnc(C(=O)Nc2cc[nH+]c(C)c2)c1 ZINC000116199403 370744152 /nfs/dbraw/zinc/74/41/52/370744152.db2.gz SFIIRUWTUSVYOL-UHFFFAOYSA-N 1 2 243.266 2.046 20 0 BEADLO Cc1[nH]c2ccc(NC(=O)C3CSC3)cc2[nH+]1 ZINC000630624145 364361876 /nfs/dbraw/zinc/36/18/76/364361876.db2.gz CXIUMJFBVCTPBM-UHFFFAOYSA-N 1 2 247.323 2.173 20 0 BEADLO CSCCCCNc1nc(C)[nH+]cc1C ZINC000579494876 366834174 /nfs/dbraw/zinc/83/41/74/366834174.db2.gz DULCBKRMUAYPNV-UHFFFAOYSA-N 1 2 225.361 2.070 20 0 BEADLO CC[C@](C)(NC(=O)CCc1c[nH+]c[nH]1)C1CC1 ZINC000618962767 364423589 /nfs/dbraw/zinc/42/35/89/364423589.db2.gz XHAXTMSBBOSELZ-ZDUSSCGKSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@](C)(NC(=O)CCc1c[nH]c[nH+]1)C1CC1 ZINC000618962767 364423594 /nfs/dbraw/zinc/42/35/94/364423594.db2.gz XHAXTMSBBOSELZ-ZDUSSCGKSA-N 1 2 235.331 2.037 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)NCC3(C)CC3)ccn12 ZINC000579490932 366831226 /nfs/dbraw/zinc/83/12/26/366831226.db2.gz LPDVZWMKQLSWRE-UHFFFAOYSA-N 1 2 243.310 2.173 20 0 BEADLO CC(C)CCN(C)C(=O)c1ccc2[nH+]ccn2c1 ZINC000170866985 364545487 /nfs/dbraw/zinc/54/54/87/364545487.db2.gz FYHCMAPTTMHSBL-UHFFFAOYSA-N 1 2 245.326 2.452 20 0 BEADLO C[C@@H](NC(=O)[C@@]1(C)CCC[C@H]1C)c1[nH]cc[nH+]1 ZINC000615157665 364547920 /nfs/dbraw/zinc/54/79/20/364547920.db2.gz FGMOKXJFARTYOB-BREBYQMCSA-N 1 2 235.331 2.413 20 0 BEADLO CCc1cc(N[C@@H]2C[C@H](OC)C2(C)C)nc[nH+]1 ZINC000227820243 541372000 /nfs/dbraw/zinc/37/20/00/541372000.db2.gz HAWIXIBNIMRWIC-MNOVXSKESA-N 1 2 235.331 2.264 20 0 BEADLO COC(=O)[C@@H]([NH2+][C@@H]1C[C@H]1CC(C)(C)C)C1CC1 ZINC000593182278 541377833 /nfs/dbraw/zinc/37/78/33/541377833.db2.gz FVAQSWOZXOQLSA-TUAOUCFPSA-N 1 2 239.359 2.352 20 0 BEADLO CCc1nnc(C[NH2+]Cc2csc(C)c2)[nH]1 ZINC000295920816 364781876 /nfs/dbraw/zinc/78/18/76/364781876.db2.gz FAUXVQBEIKIVBT-UHFFFAOYSA-N 1 2 236.344 2.027 20 0 BEADLO CCc1nnc(C[NH2+]Cc2ccc(F)cc2C)[nH]1 ZINC000296166819 364782174 /nfs/dbraw/zinc/78/21/74/364782174.db2.gz WXJQYDKRFQFUFI-UHFFFAOYSA-N 1 2 248.305 2.104 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ccn(C)n1)c1ccoc1 ZINC000573901464 364939736 /nfs/dbraw/zinc/93/97/36/364939736.db2.gz MRGLKNIGJGZRCB-NXEZZACHSA-N 1 2 219.288 2.425 20 0 BEADLO CCC[C@H](NC(=O)CCc1c[nH+]c[nH]1)C1CCC1 ZINC000458343268 541431554 /nfs/dbraw/zinc/43/15/54/541431554.db2.gz VMZPSSBTCDWTSQ-ZDUSSCGKSA-N 1 2 249.358 2.427 20 0 BEADLO CCC[C@H](NC(=O)CCc1c[nH]c[nH+]1)C1CCC1 ZINC000458343268 541431559 /nfs/dbraw/zinc/43/15/59/541431559.db2.gz VMZPSSBTCDWTSQ-ZDUSSCGKSA-N 1 2 249.358 2.427 20 0 BEADLO Cc1noc(C(C)(C)[NH2+]Cc2ccc(C)nc2)n1 ZINC000341252515 541440453 /nfs/dbraw/zinc/44/04/53/541440453.db2.gz ANMNMVPUBINGAB-UHFFFAOYSA-N 1 2 246.314 2.106 20 0 BEADLO Cn1ncc2c1nc[nH+]c2N[C@@H]1CCCC[C@H]1F ZINC000574172174 365004065 /nfs/dbraw/zinc/00/40/65/365004065.db2.gz GFAQXMDLJGUYIS-NXEZZACHSA-N 1 2 249.293 2.056 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N3CC[C@H](C)C3)ccn12 ZINC000574216275 365011880 /nfs/dbraw/zinc/01/18/80/365011880.db2.gz DKRPSDIRHJZNRK-JTQLQIEISA-N 1 2 243.310 2.125 20 0 BEADLO CO[C@H](c1ccccc1)[C@@H](C)[NH2+]Cc1ccn[nH]1 ZINC000574389331 365049797 /nfs/dbraw/zinc/04/97/97/365049797.db2.gz GMXVMGYRNXHQIC-RISCZKNCSA-N 1 2 245.326 2.276 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CC[C@@H](C)[C@@H]1C ZINC000574465668 365069363 /nfs/dbraw/zinc/06/93/63/365069363.db2.gz OMQZCIGZYUOSDK-SCZZXKLOSA-N 1 2 205.305 2.328 20 0 BEADLO F[C@H]1CCC[N@H+](Cc2cccc3nccn32)C1 ZINC000574577555 365095216 /nfs/dbraw/zinc/09/52/16/365095216.db2.gz BRVWSUYFMIXHBX-NSHDSACASA-N 1 2 233.290 2.268 20 0 BEADLO F[C@H]1CCC[N@@H+](Cc2cccc3nccn32)C1 ZINC000574577555 365095220 /nfs/dbraw/zinc/09/52/20/365095220.db2.gz BRVWSUYFMIXHBX-NSHDSACASA-N 1 2 233.290 2.268 20 0 BEADLO F[C@H]1CCCN(Cc2cccc3[nH+]ccn32)C1 ZINC000574577555 365095223 /nfs/dbraw/zinc/09/52/23/365095223.db2.gz BRVWSUYFMIXHBX-NSHDSACASA-N 1 2 233.290 2.268 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000574817726 365151862 /nfs/dbraw/zinc/15/18/62/365151862.db2.gz QLVHHWRVUGAOIP-VHSXEESVSA-N 1 2 237.347 2.443 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2C[C@H]2c2ccc(F)cc2)n1 ZINC000575019982 365170897 /nfs/dbraw/zinc/17/08/97/365170897.db2.gz JOQDXHZKZHFPOI-WDEREUQCSA-N 1 2 247.273 2.199 20 0 BEADLO C[C@@H](CC(=O)NCc1ccsc1)n1cc[nH+]c1 ZINC000574814537 365150576 /nfs/dbraw/zinc/15/05/76/365150576.db2.gz JGNYOTIQRQTZJF-JTQLQIEISA-N 1 2 249.339 2.212 20 0 BEADLO C[C@@H]([NH+]=c1[nH]c2cccc(F)c2n1C)C1CC1 ZINC000443419826 193021509 /nfs/dbraw/zinc/02/15/09/193021509.db2.gz RMDOAUGSNDVPAR-MRVPVSSYSA-N 1 2 233.290 2.345 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)Nc1ccccc1 ZINC000622272732 370812817 /nfs/dbraw/zinc/81/28/17/370812817.db2.gz FUBOQGWTALNTDY-SNVBAGLBSA-N 1 2 229.283 2.227 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)Nc1ccccc1 ZINC000622272732 370812820 /nfs/dbraw/zinc/81/28/20/370812820.db2.gz FUBOQGWTALNTDY-SNVBAGLBSA-N 1 2 229.283 2.227 20 0 BEADLO CCOC(=O)C[N@H+](C)CCc1ccccc1CC ZINC000444601043 193051889 /nfs/dbraw/zinc/05/18/89/193051889.db2.gz XTZNMECEQOLDTJ-UHFFFAOYSA-N 1 2 249.354 2.286 20 0 BEADLO CCOC(=O)C[N@@H+](C)CCc1ccccc1CC ZINC000444601043 193051891 /nfs/dbraw/zinc/05/18/91/193051891.db2.gz XTZNMECEQOLDTJ-UHFFFAOYSA-N 1 2 249.354 2.286 20 0 BEADLO CCc1nc(N2Cc3cccnc3C2)cc(C)[nH+]1 ZINC000575176087 365230273 /nfs/dbraw/zinc/23/02/73/365230273.db2.gz JLGMFPOSOGEPJY-UHFFFAOYSA-N 1 2 240.310 2.263 20 0 BEADLO FC(F)(F)C1C[NH+](CCOCC2CCC2)C1 ZINC000579572923 366880865 /nfs/dbraw/zinc/88/08/65/366880865.db2.gz ISYYFOBTWVXSNR-UHFFFAOYSA-N 1 2 237.265 2.297 20 0 BEADLO CC1(C)[C@@H]2C[N@@H+](Cc3noc(C4CC4)n3)C[C@@H]21 ZINC000172961366 365391690 /nfs/dbraw/zinc/39/16/90/365391690.db2.gz QIMACYJZPTYDIM-AOOOYVTPSA-N 1 2 233.315 2.035 20 0 BEADLO CC1(C)[C@@H]2C[N@H+](Cc3noc(C4CC4)n3)C[C@@H]21 ZINC000172961366 365391693 /nfs/dbraw/zinc/39/16/93/365391693.db2.gz QIMACYJZPTYDIM-AOOOYVTPSA-N 1 2 233.315 2.035 20 0 BEADLO CC(C)(C)c1nc(C[N@H+]2C[C@@H]3[C@H](C2)C3(C)C)no1 ZINC000172969832 365392039 /nfs/dbraw/zinc/39/20/39/365392039.db2.gz OWMMFKXKLVXZLZ-AOOOYVTPSA-N 1 2 249.358 2.455 20 0 BEADLO CC(C)(C)c1nc(C[N@@H+]2C[C@@H]3[C@H](C2)C3(C)C)no1 ZINC000172969832 365392045 /nfs/dbraw/zinc/39/20/45/365392045.db2.gz OWMMFKXKLVXZLZ-AOOOYVTPSA-N 1 2 249.358 2.455 20 0 BEADLO CC(C)c1nc(C[N@H+]2C[C@@H]3[C@H](C2)C3(C)C)no1 ZINC000172975080 365393919 /nfs/dbraw/zinc/39/39/19/365393919.db2.gz TWOQHSXAIFQFOQ-AOOOYVTPSA-N 1 2 235.331 2.281 20 0 BEADLO CC(C)c1nc(C[N@@H+]2C[C@@H]3[C@H](C2)C3(C)C)no1 ZINC000172975080 365393926 /nfs/dbraw/zinc/39/39/26/365393926.db2.gz TWOQHSXAIFQFOQ-AOOOYVTPSA-N 1 2 235.331 2.281 20 0 BEADLO Fc1ccc([C@H]([NH2+]CC2CC2)c2cn[nH]n2)cc1 ZINC000575877534 365401518 /nfs/dbraw/zinc/40/15/18/365401518.db2.gz XRPJVPYOZIHOPB-ZDUSSCGKSA-N 1 2 246.289 2.033 20 0 BEADLO Fc1ccc([C@H]([NH2+]CC2CC2)c2c[nH]nn2)cc1 ZINC000575877534 365401521 /nfs/dbraw/zinc/40/15/21/365401521.db2.gz XRPJVPYOZIHOPB-ZDUSSCGKSA-N 1 2 246.289 2.033 20 0 BEADLO COCC[N@H+](CC(F)F)CC1CCC1 ZINC000173661512 365434798 /nfs/dbraw/zinc/43/47/98/365434798.db2.gz KLDTWJGQSBMTKZ-UHFFFAOYSA-N 1 2 207.264 2.000 20 0 BEADLO COCC[N@@H+](CC(F)F)CC1CCC1 ZINC000173661512 365434802 /nfs/dbraw/zinc/43/48/02/365434802.db2.gz KLDTWJGQSBMTKZ-UHFFFAOYSA-N 1 2 207.264 2.000 20 0 BEADLO CC1=C(C)C[C@@H](C(=O)Nc2cc[nH+]cc2O)CC1 ZINC000576162219 365505965 /nfs/dbraw/zinc/50/59/65/365505965.db2.gz BFYNQTRZDLOZOR-NSHDSACASA-N 1 2 246.310 2.284 20 0 BEADLO Cc1nc(NCc2ccc(CO)c(F)c2)cc[nH+]1 ZINC000174698112 365507828 /nfs/dbraw/zinc/50/78/28/365507828.db2.gz KLZVXEBRCJQLRZ-UHFFFAOYSA-N 1 2 247.273 2.029 20 0 BEADLO Cn1c[nH+]cc1CN1CCc2c1cc(F)cc2F ZINC000177011225 541502609 /nfs/dbraw/zinc/50/26/09/541502609.db2.gz AXQLATJQFNEHQM-UHFFFAOYSA-N 1 2 249.264 2.261 20 0 BEADLO CC(C)n1c[nH+]cc1CNCC(C)(F)F ZINC000579702512 366983944 /nfs/dbraw/zinc/98/39/44/366983944.db2.gz IHYWTRAPGUYLHC-UHFFFAOYSA-N 1 2 217.263 2.209 20 0 BEADLO CCc1cc(N[C@@H](C)[C@H]2CCCCO2)nc[nH+]1 ZINC000383123675 541513805 /nfs/dbraw/zinc/51/38/05/541513805.db2.gz UBQNQBARBKBAGK-CMPLNLGQSA-N 1 2 235.331 2.409 20 0 BEADLO Cn1c[nH+]cc1Cn1ccc(-c2cccs2)n1 ZINC000439557886 201456513 /nfs/dbraw/zinc/45/65/13/201456513.db2.gz PQMNUUQEAWKOJP-UHFFFAOYSA-N 1 2 244.323 2.393 20 0 BEADLO CC[C@@H](Nc1cnn(CC)c1)c1[nH+]ccn1C ZINC000183369084 367018071 /nfs/dbraw/zinc/01/80/71/367018071.db2.gz ZPFIQUMOSYRXOI-LLVKDONJSA-N 1 2 233.319 2.200 20 0 BEADLO Cc1ccccc1[C@@H]1C[N@@H+]([C@H]2CCOC2)CCO1 ZINC000580730336 367153074 /nfs/dbraw/zinc/15/30/74/367153074.db2.gz MRUMERYPIJIKLO-ZFWWWQNUSA-N 1 2 247.338 2.157 20 0 BEADLO Cc1ccccc1[C@@H]1C[N@H+]([C@H]2CCOC2)CCO1 ZINC000580730336 367153078 /nfs/dbraw/zinc/15/30/78/367153078.db2.gz MRUMERYPIJIKLO-ZFWWWQNUSA-N 1 2 247.338 2.157 20 0 BEADLO CCCC(C)(C)CC(=O)N1CC(n2cc[nH+]c2)C1 ZINC000580750714 367155722 /nfs/dbraw/zinc/15/57/22/367155722.db2.gz UVSOKLRKDYDEIG-UHFFFAOYSA-N 1 2 249.358 2.483 20 0 BEADLO CC[C@@H]1CCCN(C(=O)[C@H](C)Cc2c[nH+]c[nH]2)C1 ZINC000580842311 367184823 /nfs/dbraw/zinc/18/48/23/367184823.db2.gz CGZUHBQHIMUGOZ-VXGBXAGGSA-N 1 2 249.358 2.237 20 0 BEADLO CC[C@@H]1CCCN(C(=O)[C@H](C)Cc2c[nH]c[nH+]2)C1 ZINC000580842311 367184836 /nfs/dbraw/zinc/18/48/36/367184836.db2.gz CGZUHBQHIMUGOZ-VXGBXAGGSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CCC(C)(C)C1)c1[nH]cc[nH+]1 ZINC000580784489 367166308 /nfs/dbraw/zinc/16/63/08/367166308.db2.gz WGSDGWPDWGRFRQ-ZJUUUORDSA-N 1 2 235.331 2.413 20 0 BEADLO C[N@H+](Cc1nnc2n1CCC2)CC1=CCCCC1 ZINC000580992775 367227463 /nfs/dbraw/zinc/22/74/63/367227463.db2.gz SPTYLHQEJILCQL-UHFFFAOYSA-N 1 2 246.358 2.157 20 0 BEADLO C[N@@H+](Cc1nnc2n1CCC2)CC1=CCCCC1 ZINC000580992775 367227467 /nfs/dbraw/zinc/22/74/67/367227467.db2.gz SPTYLHQEJILCQL-UHFFFAOYSA-N 1 2 246.358 2.157 20 0 BEADLO CC[C@@H](c1ccc(F)cc1)[N@H+](C)CC(=O)OC ZINC000194544352 367303413 /nfs/dbraw/zinc/30/34/13/367303413.db2.gz ORWGBGOLGSJKKS-LBPRGKRZSA-N 1 2 239.290 2.382 20 0 BEADLO CC[C@@H](c1ccc(F)cc1)[N@@H+](C)CC(=O)OC ZINC000194544352 367303419 /nfs/dbraw/zinc/30/34/19/367303419.db2.gz ORWGBGOLGSJKKS-LBPRGKRZSA-N 1 2 239.290 2.382 20 0 BEADLO CC(C)(NC(=O)C1CC2(CCC2)C1)c1[nH]cc[nH+]1 ZINC000581255539 367310937 /nfs/dbraw/zinc/31/09/37/367310937.db2.gz AYYIXUCLIMWEBI-UHFFFAOYSA-N 1 2 247.342 2.341 20 0 BEADLO COc1ccc(CNc2c[nH]c[nH+]2)cc1F ZINC000381615065 367439064 /nfs/dbraw/zinc/43/90/64/367439064.db2.gz UTFGKHRXQPBSPN-UHFFFAOYSA-N 1 2 221.235 2.170 20 0 BEADLO CCCc1nc(C[NH2+]C2(C3CC3)CC2)no1 ZINC000381751268 367454170 /nfs/dbraw/zinc/45/41/70/367454170.db2.gz RGPNWRQHTKWDCV-UHFFFAOYSA-N 1 2 221.304 2.054 20 0 BEADLO Cc1[nH]c(CNc2ccccc2CO)[nH+]c1C ZINC000581499784 367528260 /nfs/dbraw/zinc/52/82/60/367528260.db2.gz RWSHONIPSKTMIS-UHFFFAOYSA-N 1 2 231.299 2.131 20 0 BEADLO CCc1nocc1C[NH2+]Cc1ncc(C)s1 ZINC000382404995 367516188 /nfs/dbraw/zinc/51/61/88/367516188.db2.gz RSDNRHLBSHNBIK-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO OCC[N@H+](CCC1=CCCCC1)CC(F)F ZINC000385104153 367791183 /nfs/dbraw/zinc/79/11/83/367791183.db2.gz BNCXIRKMJPVYLD-UHFFFAOYSA-N 1 2 233.302 2.436 20 0 BEADLO OCC[N@@H+](CCC1=CCCCC1)CC(F)F ZINC000385104153 367791187 /nfs/dbraw/zinc/79/11/87/367791187.db2.gz BNCXIRKMJPVYLD-UHFFFAOYSA-N 1 2 233.302 2.436 20 0 BEADLO CCCCNC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000225052618 368140258 /nfs/dbraw/zinc/14/02/58/368140258.db2.gz IJKGYJUGXIPTAK-UHFFFAOYSA-N 1 2 232.287 2.256 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1CCOC(C)(C)C1 ZINC000566485627 326056728 /nfs/dbraw/zinc/05/67/28/326056728.db2.gz PEVXYPLPCAUGDP-LLVKDONJSA-N 1 2 235.331 2.463 20 0 BEADLO COc1c(C)c[nH+]c(CN(C)C(=O)C2CC2)c1C ZINC000058958375 368527331 /nfs/dbraw/zinc/52/73/31/368527331.db2.gz SHMQAYPJNZMSRZ-UHFFFAOYSA-N 1 2 248.326 2.075 20 0 BEADLO CN(Cc1ccc2c(c1)OCO2)c1cccc[nH+]1 ZINC000060847438 368554349 /nfs/dbraw/zinc/55/43/49/368554349.db2.gz FBYDIEGMWOORRM-UHFFFAOYSA-N 1 2 242.278 2.447 20 0 BEADLO CCN(C)C(=O)c1ccc(Cn2cc[nH+]c2)cc1 ZINC000060625831 368548878 /nfs/dbraw/zinc/54/88/78/368548878.db2.gz DYTJASRASAYZIA-UHFFFAOYSA-N 1 2 243.310 2.023 20 0 BEADLO CC(C)c1nc(C[NH+]2CCCCC2)no1 ZINC000064931339 368615559 /nfs/dbraw/zinc/61/55/59/368615559.db2.gz VZRROWMDKYOZSO-UHFFFAOYSA-N 1 2 209.293 2.179 20 0 BEADLO CC(C)n1cc(Nc2[nH+]cnc3[nH]ccc32)cn1 ZINC000066817687 368662817 /nfs/dbraw/zinc/66/28/17/368662817.db2.gz IZTOMRSPJNPAIK-UHFFFAOYSA-N 1 2 242.286 2.479 20 0 BEADLO C[N@H+](CCCO)Cc1c(F)cccc1Cl ZINC000067128462 368680229 /nfs/dbraw/zinc/68/02/29/368680229.db2.gz YWGNYIPUESUQLY-UHFFFAOYSA-N 1 2 231.698 2.293 20 0 BEADLO C[N@@H+](CCCO)Cc1c(F)cccc1Cl ZINC000067128462 368680233 /nfs/dbraw/zinc/68/02/33/368680233.db2.gz YWGNYIPUESUQLY-UHFFFAOYSA-N 1 2 231.698 2.293 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H](C)CC(C)(C)C)c[nH+]1 ZINC000457228411 203022739 /nfs/dbraw/zinc/02/27/39/203022739.db2.gz NSMWEKZIUZYKAD-MRVPVSSYSA-N 1 2 223.320 2.273 20 0 BEADLO C[C@@H]1CCCC[C@@]1(C)NC(=O)CCc1[nH]cc[nH+]1 ZINC000457237412 203024928 /nfs/dbraw/zinc/02/49/28/203024928.db2.gz CMKFOWOZUSVZPB-BXUZGUMPSA-N 1 2 249.358 2.427 20 0 BEADLO CCOC(=O)C[N@H+](C)[C@@H](C)Cc1ccsc1 ZINC000081599115 370903981 /nfs/dbraw/zinc/90/39/81/370903981.db2.gz QEVMMYKGLRLKIH-JTQLQIEISA-N 1 2 241.356 2.174 20 0 BEADLO CCOC(=O)C[N@@H+](C)[C@@H](C)Cc1ccsc1 ZINC000081599115 370903986 /nfs/dbraw/zinc/90/39/86/370903986.db2.gz QEVMMYKGLRLKIH-JTQLQIEISA-N 1 2 241.356 2.174 20 0 BEADLO Cc1[nH]c(C(=O)N[C@]2(C)CCCC[C@H]2C)c[nH+]1 ZINC000457258161 203030664 /nfs/dbraw/zinc/03/06/64/203030664.db2.gz MEZVLDYXTJBZEI-NOZJJQNGSA-N 1 2 235.331 2.417 20 0 BEADLO CC[C@@H](C)C(=O)Nc1nc(C[NH+](C)C)cs1 ZINC000457292963 203035197 /nfs/dbraw/zinc/03/51/97/203035197.db2.gz ORQFDBNNWNMWRK-MRVPVSSYSA-N 1 2 241.360 2.189 20 0 BEADLO CC[C@@]1(C(C)C)C[C@@H]1NC(=O)c1c[nH+]c(C)[nH]1 ZINC000457316406 203036789 /nfs/dbraw/zinc/03/67/89/203036789.db2.gz ZWALUFSRJSDJDK-AAEUAGOBSA-N 1 2 235.331 2.273 20 0 BEADLO CC1(C(=O)NCCCCn2cc[nH+]c2)CCCC1 ZINC000069155852 368747537 /nfs/dbraw/zinc/74/75/37/368747537.db2.gz QLHXKNROJPTOPV-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO CCCCC(=O)NCCc1cn2c([nH+]1)CCCC2 ZINC000074250220 368835239 /nfs/dbraw/zinc/83/52/39/368835239.db2.gz QWTXJBQERKWAMB-UHFFFAOYSA-N 1 2 249.358 2.068 20 0 BEADLO C[C@H]1CN(C(=O)Cn2cc[nH+]c2)c2ccccc21 ZINC000072963771 368788361 /nfs/dbraw/zinc/78/83/61/368788361.db2.gz JVHXFQVADYLIDA-NSHDSACASA-N 1 2 241.294 2.033 20 0 BEADLO CCC(C)(C)CC(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000073019122 368790400 /nfs/dbraw/zinc/79/04/00/368790400.db2.gz DDIULUUOAYUFGV-NSHDSACASA-N 1 2 237.347 2.214 20 0 BEADLO CCN(C(=O)Cn1cc[nH+]c1)[C@H]1CCCC[C@@H]1C ZINC000073306489 368799294 /nfs/dbraw/zinc/79/92/94/368799294.db2.gz MTKVJUIBYAWVJT-STQMWFEESA-N 1 2 249.358 2.310 20 0 BEADLO C[C@H]1CCC(C)(C)N1C(=O)CCc1c[nH+]cn1C ZINC000616165314 369000636 /nfs/dbraw/zinc/00/06/36/369000636.db2.gz ORUNAMICXVZELQ-NSHDSACASA-N 1 2 249.358 2.142 20 0 BEADLO CSC1(C(=O)Nc2ccc3[nH+]ccn3c2)CC1 ZINC000616161796 368994971 /nfs/dbraw/zinc/99/49/71/368994971.db2.gz GCLVTLWFAIIBCJ-UHFFFAOYSA-N 1 2 247.323 2.168 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H](C)CC(F)(F)F ZINC000457545058 203074220 /nfs/dbraw/zinc/07/42/20/203074220.db2.gz DWXXIZOKVVSSLK-SSDOTTSWSA-N 1 2 246.232 2.339 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)C1CC(C(C)(C)C)C1 ZINC000457558145 203075157 /nfs/dbraw/zinc/07/51/57/203075157.db2.gz XGVUYZIQDMGKLK-UHFFFAOYSA-N 1 2 249.358 2.440 20 0 BEADLO Cc1cc(NC(=O)[C@@H](C)CC(F)(F)F)cc[nH+]1 ZINC000457568481 203075841 /nfs/dbraw/zinc/07/58/41/203075841.db2.gz PIHUKTUSSUCKLO-ZETCQYMHSA-N 1 2 246.232 2.339 20 0 BEADLO C[C@@H](CC(=O)NCCC(C)(C)F)n1cc[nH+]c1 ZINC000618413137 369140078 /nfs/dbraw/zinc/14/00/78/369140078.db2.gz OGGGGODGNYNDAP-JTQLQIEISA-N 1 2 241.310 2.089 20 0 BEADLO O=C(CCn1cc[nH+]c1)NC1(C2CCC2)CCC1 ZINC000458239405 203148132 /nfs/dbraw/zinc/14/81/32/203148132.db2.gz OKMRPSLHQVBJJZ-UHFFFAOYSA-N 1 2 247.342 2.112 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)NC(C)(C)C ZINC000459055837 203227496 /nfs/dbraw/zinc/22/74/96/203227496.db2.gz JKXLOXWBDPHVOX-VIFPVBQESA-N 1 2 238.335 2.062 20 0 BEADLO CCCOCC(=O)Nc1c[nH+]c2c(C)cccn12 ZINC000619012949 369257265 /nfs/dbraw/zinc/25/72/65/369257265.db2.gz KELUNFUOUFNHAJ-UHFFFAOYSA-N 1 2 247.298 2.008 20 0 BEADLO COCCCC(=O)Nc1c[nH+]c2c(C)cccn12 ZINC000619013234 369257531 /nfs/dbraw/zinc/25/75/31/369257531.db2.gz NPVBYVGNWAZLFU-UHFFFAOYSA-N 1 2 247.298 2.008 20 0 BEADLO COC(=O)C[N@H+](C)Cc1ccc(C2CC2)cc1 ZINC000459289352 203246813 /nfs/dbraw/zinc/24/68/13/203246813.db2.gz AVPOZDUMDCRIDI-UHFFFAOYSA-N 1 2 233.311 2.169 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1ccc(C2CC2)cc1 ZINC000459289352 203246817 /nfs/dbraw/zinc/24/68/17/203246817.db2.gz AVPOZDUMDCRIDI-UHFFFAOYSA-N 1 2 233.311 2.169 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@H]1C[C@@]1(C)C(C)C ZINC000459480264 203291422 /nfs/dbraw/zinc/29/14/22/203291422.db2.gz LGSKGEPABXUMSF-OCCSQVGLSA-N 1 2 247.342 2.368 20 0 BEADLO CCCn1nccc1C[NH2+]CC(F)(F)CC ZINC000623679414 369379908 /nfs/dbraw/zinc/37/99/08/369379908.db2.gz WMLQWDOQZALVHL-UHFFFAOYSA-N 1 2 231.290 2.428 20 0 BEADLO CCCCCOC1C[NH+](Cc2c[nH]nc2C)C1 ZINC000459599370 203313048 /nfs/dbraw/zinc/31/30/48/203313048.db2.gz YFLAQTTWHGYQOD-UHFFFAOYSA-N 1 2 237.347 2.109 20 0 BEADLO CC(C)n1cc(C[NH+]2CC(C3CCCC3)C2)nn1 ZINC000459609128 203313320 /nfs/dbraw/zinc/31/33/20/203313320.db2.gz IQHUULUMLRVYJZ-UHFFFAOYSA-N 1 2 248.374 2.481 20 0 BEADLO CN(C)c1ccccc1C[NH2+]CC(F)F ZINC000459552578 203299213 /nfs/dbraw/zinc/29/92/13/203299213.db2.gz ZVTSSQKBCFAKAI-UHFFFAOYSA-N 1 2 214.259 2.107 20 0 BEADLO COc1ccc(C[NH2+]CC(F)F)c(C)c1OC ZINC000459551415 203299642 /nfs/dbraw/zinc/29/96/42/203299642.db2.gz WAYAWMOVXDSDLU-UHFFFAOYSA-N 1 2 245.269 2.367 20 0 BEADLO CCOC1C[NH+](Cc2cc(F)ccc2C)C1 ZINC000459613840 203317110 /nfs/dbraw/zinc/31/71/10/203317110.db2.gz WFHITOBWRBCCIX-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO CC1(CO)C[NH+](Cc2cc3c(cccc3F)[nH]2)C1 ZINC000459624044 203320552 /nfs/dbraw/zinc/32/05/52/203320552.db2.gz SQFDWFMBHLFEJH-UHFFFAOYSA-N 1 2 248.301 2.121 20 0 BEADLO CCOC1(C)C[NH+](Cc2cccs2)C1 ZINC000459629019 203323177 /nfs/dbraw/zinc/32/31/77/203323177.db2.gz YOTLDXHGASFQKW-UHFFFAOYSA-N 1 2 211.330 2.359 20 0 BEADLO Cc1ccccc1C[NH+]1CC(OC(F)F)C1 ZINC000459643230 203328458 /nfs/dbraw/zinc/32/84/58/203328458.db2.gz XLXPWOLKTXLUAF-UHFFFAOYSA-N 1 2 227.254 2.418 20 0 BEADLO CC1(CC(F)(F)F)C[NH+](Cc2cncnc2)C1 ZINC000459642683 203329169 /nfs/dbraw/zinc/32/91/69/203329169.db2.gz TVHCRAATJOWBNG-UHFFFAOYSA-N 1 2 245.248 2.251 20 0 BEADLO c1cc2c(nc(C3CC3)[nH+]c2N2CCCC2)[nH]1 ZINC000631030133 370959053 /nfs/dbraw/zinc/95/90/53/370959053.db2.gz NQFYDACVWBJDPJ-UHFFFAOYSA-N 1 2 228.299 2.436 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@@H+]1CCCC(C)(C)C ZINC000619515089 369456097 /nfs/dbraw/zinc/45/60/97/369456097.db2.gz NXCIHATUIKAABI-QWRGUYRKSA-N 1 2 245.338 2.398 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@H+]1CCCC(C)(C)C ZINC000619515089 369456103 /nfs/dbraw/zinc/45/61/03/369456103.db2.gz NXCIHATUIKAABI-QWRGUYRKSA-N 1 2 245.338 2.398 20 0 BEADLO CSCCC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000619566773 369481081 /nfs/dbraw/zinc/48/10/81/369481081.db2.gz KXSOPSFTOTWJFR-UHFFFAOYSA-N 1 2 235.312 2.026 20 0 BEADLO COC(=O)CCC[N@@H+]1Cc2cccc(F)c2C1 ZINC000459742386 203351698 /nfs/dbraw/zinc/35/16/98/203351698.db2.gz WBDQJGIZXIABJS-UHFFFAOYSA-N 1 2 237.274 2.095 20 0 BEADLO COC(=O)CCC[N@H+]1Cc2cccc(F)c2C1 ZINC000459742386 203351701 /nfs/dbraw/zinc/35/17/01/203351701.db2.gz WBDQJGIZXIABJS-UHFFFAOYSA-N 1 2 237.274 2.095 20 0 BEADLO C[N@@H+]1CCCC[C@@H]1C(=O)Nc1ccccc1F ZINC000082324152 370987145 /nfs/dbraw/zinc/98/71/45/370987145.db2.gz OTOPAZSHJBFVGR-GFCCVEGCSA-N 1 2 236.290 2.249 20 0 BEADLO C[N@H+]1CCCC[C@@H]1C(=O)Nc1ccccc1F ZINC000082324152 370987150 /nfs/dbraw/zinc/98/71/50/370987150.db2.gz OTOPAZSHJBFVGR-GFCCVEGCSA-N 1 2 236.290 2.249 20 0 BEADLO CC(C)CC(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000082277323 370978351 /nfs/dbraw/zinc/97/83/51/370978351.db2.gz KVNYYZYBZKFUCT-LBPRGKRZSA-N 1 2 235.331 2.093 20 0 BEADLO CC(C)n1ccc(C[NH2+]Cc2cncs2)n1 ZINC000157473212 326277082 /nfs/dbraw/zinc/27/70/82/326277082.db2.gz JVZICUMAKNYTRV-UHFFFAOYSA-N 1 2 236.344 2.210 20 0 BEADLO CCC[C@H](C)C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620599357 369949454 /nfs/dbraw/zinc/94/94/54/369949454.db2.gz FHSFOCCWJSLHJA-VHSXEESVSA-N 1 2 223.320 2.034 20 0 BEADLO C[C@H](NC(=O)[C@@H]1CCC(C)(C)C1)c1[nH+]ccn1C ZINC000620604197 369953505 /nfs/dbraw/zinc/95/35/05/369953505.db2.gz PMZMSEFDBDYBAY-WDEREUQCSA-N 1 2 249.358 2.424 20 0 BEADLO Cc1cc(C(=O)N[C@H](C)c2[nH+]ccn2C)cs1 ZINC000620608265 369957233 /nfs/dbraw/zinc/95/72/33/369957233.db2.gz NGFSEKYQWMMURB-SECBINFHSA-N 1 2 249.339 2.281 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CCC1(C)C)c1[nH+]ccn1C ZINC000620612244 369958201 /nfs/dbraw/zinc/95/82/01/369958201.db2.gz SIHOPELHCRGUQD-NXEZZACHSA-N 1 2 235.331 2.034 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620611092 369958264 /nfs/dbraw/zinc/95/82/64/369958264.db2.gz YGWMLQKRDHFJFI-IJLUTSLNSA-N 1 2 249.358 2.280 20 0 BEADLO CC[C@@H]1CCC[C@H](C)N1C(=O)Cc1[nH]c[nH+]c1C ZINC000620577419 369935485 /nfs/dbraw/zinc/93/54/85/369935485.db2.gz GKROCBGCZHUKHE-CMPLNLGQSA-N 1 2 249.358 2.440 20 0 BEADLO CC(C)CCC(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620593217 369946703 /nfs/dbraw/zinc/94/67/03/369946703.db2.gz XRGOHPTXEZREAZ-JTQLQIEISA-N 1 2 223.320 2.034 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)C1CCC1 ZINC000074859477 370048279 /nfs/dbraw/zinc/04/82/79/370048279.db2.gz YKUJQIFOFYUSDL-UHFFFAOYSA-N 1 2 215.256 2.073 20 0 BEADLO CCCCC(=O)CSc1nc(N)cc(C)[nH+]1 ZINC000631004564 370091393 /nfs/dbraw/zinc/09/13/93/370091393.db2.gz AKSDMNVOZKEZFI-UHFFFAOYSA-N 1 2 239.344 2.049 20 0 BEADLO CSC[C@@H]1CCC[N@H+](CC(F)F)C1 ZINC000308180019 370108591 /nfs/dbraw/zinc/10/85/91/370108591.db2.gz XXCYGDJTUNNGPX-MRVPVSSYSA-N 1 2 209.305 2.327 20 0 BEADLO CSC[C@@H]1CCC[N@@H+](CC(F)F)C1 ZINC000308180019 370108596 /nfs/dbraw/zinc/10/85/96/370108596.db2.gz XXCYGDJTUNNGPX-MRVPVSSYSA-N 1 2 209.305 2.327 20 0 BEADLO CCc1cc(NCCc2nccs2)nc[nH+]1 ZINC000063134514 370135648 /nfs/dbraw/zinc/13/56/48/370135648.db2.gz TUILNLCHSBTJGT-UHFFFAOYSA-N 1 2 234.328 2.150 20 0 BEADLO CCOc1ccc(CNc2c[nH]c[nH+]2)cc1 ZINC000309651883 370240209 /nfs/dbraw/zinc/24/02/09/370240209.db2.gz OJMLYOFHJMUUAR-UHFFFAOYSA-N 1 2 217.272 2.421 20 0 BEADLO CC[C@H]([NH2+]Cc1nccnc1C)c1nccs1 ZINC000621336863 370271290 /nfs/dbraw/zinc/27/12/90/370271290.db2.gz BOGMNXSFTPSKCP-JTQLQIEISA-N 1 2 248.355 2.482 20 0 BEADLO C[C@@H]1CCN(c2[nH]c3ccccc3[nH+]2)C[C@@H]1CO ZINC000621347736 370282377 /nfs/dbraw/zinc/28/23/77/370282377.db2.gz KXOVISMBJMZJAJ-GHMZBOCLSA-N 1 2 245.326 2.018 20 0 BEADLO Cc1nccnc1C[NH2+][C@H](C)c1cscn1 ZINC000621370231 370305973 /nfs/dbraw/zinc/30/59/73/370305973.db2.gz DYAUKRIXYYGBQL-SECBINFHSA-N 1 2 234.328 2.092 20 0 BEADLO CC[C@H]([NH2+][C@@H](C(F)F)C1CCCCC1)C(N)=O ZINC000621403974 370340040 /nfs/dbraw/zinc/34/00/40/370340040.db2.gz FBOPAIOJTYJIFD-VHSXEESVSA-N 1 2 248.317 2.054 20 0 BEADLO Cc1nccnc1C[N@@H+](C)[C@@H](C)c1ccccn1 ZINC000621721251 370471856 /nfs/dbraw/zinc/47/18/56/370471856.db2.gz GQMCFDPITICIKY-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1nccnc1C[N@H+](C)[C@@H](C)c1ccccn1 ZINC000621721251 370471862 /nfs/dbraw/zinc/47/18/62/370471862.db2.gz GQMCFDPITICIKY-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO CC[C@H]1C[NH+](Cc2nccnc2C)C[C@H](CC)O1 ZINC000621731489 370485870 /nfs/dbraw/zinc/48/58/70/370485870.db2.gz PSDXWNFCBBXFQC-STQMWFEESA-N 1 2 249.358 2.174 20 0 BEADLO Cc1nc(NC[C@@](C)(O)CCC(C)C)cc[nH+]1 ZINC000078300904 370549637 /nfs/dbraw/zinc/54/96/37/370549637.db2.gz YCVSRRWRNHJAOK-ZDUSSCGKSA-N 1 2 237.347 2.384 20 0 BEADLO COc1ccc2[nH+]c(NCC[C@H](C)O)ccc2c1 ZINC000114710097 370590316 /nfs/dbraw/zinc/59/03/16/370590316.db2.gz AQFYAMZPWDYNIL-JTQLQIEISA-N 1 2 246.310 2.426 20 0 BEADLO CC(C)(C(=O)N[C@H]1CC12CCCC2)c1c[nH]c[nH+]1 ZINC000621973533 370630239 /nfs/dbraw/zinc/63/02/39/370630239.db2.gz OZZKCOMBOBWYRX-JTQLQIEISA-N 1 2 247.342 2.136 20 0 BEADLO CCC(C)(C)CNC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000621973383 370630293 /nfs/dbraw/zinc/63/02/93/370630293.db2.gz LKBOISKQAOLWOQ-UHFFFAOYSA-N 1 2 237.347 2.240 20 0 BEADLO COc1cccc(C[NH2+]Cc2csc(C)n2)n1 ZINC000070070068 371008493 /nfs/dbraw/zinc/00/84/93/371008493.db2.gz PHWDBHZLBGVKLG-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO C[C@@H](CO)Nc1cc2ccccc2c[nH+]1 ZINC000631050444 371099937 /nfs/dbraw/zinc/09/99/37/371099937.db2.gz FIVRUIVCYXLBBQ-VIFPVBQESA-N 1 2 202.257 2.028 20 0 BEADLO c1cc2c(nc(C3CC3)[nH+]c2N2CCC2)[nH]1 ZINC000631049690 371091729 /nfs/dbraw/zinc/09/17/29/371091729.db2.gz NDACUTUCPDVFSJ-UHFFFAOYSA-N 1 2 214.272 2.045 20 0 BEADLO C[C@@H]1CCN1c1nc2ccccc2n2c[nH+]cc12 ZINC000623889066 371141521 /nfs/dbraw/zinc/14/15/21/371141521.db2.gz BVLHXXNLXGBUSA-SNVBAGLBSA-N 1 2 238.294 2.481 20 0 BEADLO CC[C@@H]1CN(c2[nH+]cccc2OC)CCS1 ZINC000624007401 371244380 /nfs/dbraw/zinc/24/43/80/371244380.db2.gz VGNHREJGVIKAFS-SNVBAGLBSA-N 1 2 238.356 2.422 20 0 BEADLO CCCCc1cc(NC[C@@H]2CCCOC2)nc[nH+]1 ZINC000631067587 371280214 /nfs/dbraw/zinc/28/02/14/371280214.db2.gz CBQWANKVGWHKLA-LBPRGKRZSA-N 1 2 249.358 2.080 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2ccn(C)n2)o1 ZINC000020351320 371268371 /nfs/dbraw/zinc/26/83/71/371268371.db2.gz VAUCGWPTCHZFGB-JTQLQIEISA-N 1 2 219.288 2.172 20 0 BEADLO CC[C@H]1CCCCN1C(=O)CCCn1cc[nH+]c1 ZINC000125286256 371314285 /nfs/dbraw/zinc/31/42/85/371314285.db2.gz MNECOGSDIRKBIZ-ZDUSSCGKSA-N 1 2 249.358 2.454 20 0 BEADLO CCC(F)(F)C[NH2+][C@@H](C)c1cncnc1C ZINC000624148550 371345001 /nfs/dbraw/zinc/34/50/01/371345001.db2.gz IGAKRLGAICDHKA-QMMMGPOBSA-N 1 2 229.274 2.481 20 0 BEADLO CCC(F)(F)C[NH2+][C@@H]1CCCc2nn(C)cc21 ZINC000624148862 371346330 /nfs/dbraw/zinc/34/63/30/371346330.db2.gz PUZNKGMHJSRDSA-SNVBAGLBSA-N 1 2 243.301 2.432 20 0 BEADLO CC(C)c1nc(N[C@@H](C)[C@H](C)CO)cc[nH+]1 ZINC000156660420 371483584 /nfs/dbraw/zinc/48/35/84/371483584.db2.gz YMCNBYWAAKSZFB-ZJUUUORDSA-N 1 2 223.320 2.029 20 0 BEADLO CC(C)c1nc(N[C@H](C)[C@@H](C)CO)cc[nH+]1 ZINC000156660299 371484299 /nfs/dbraw/zinc/48/42/99/371484299.db2.gz YMCNBYWAAKSZFB-VHSXEESVSA-N 1 2 223.320 2.029 20 0 BEADLO COc1ccc2[nH+]c(N[C@H](C)CCO)ccc2c1 ZINC000156603583 371462360 /nfs/dbraw/zinc/46/23/60/371462360.db2.gz XDOMPIJAPUMRTE-SNVBAGLBSA-N 1 2 246.310 2.426 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1CCC[C@@H](C)O1 ZINC000624399631 371500898 /nfs/dbraw/zinc/50/08/98/371500898.db2.gz RASKYRUOUVPZOG-GHMZBOCLSA-N 1 2 236.315 2.460 20 0 BEADLO Cc1cc(NCc2ccns2)nc(C2CC2)[nH+]1 ZINC000624436658 371509986 /nfs/dbraw/zinc/50/99/86/371509986.db2.gz STBGHWZMVHSYHI-UHFFFAOYSA-N 1 2 246.339 2.153 20 0 BEADLO CSCC[C@@H](C)N(C)c1cc(CO)cc[nH+]1 ZINC000157135085 371526379 /nfs/dbraw/zinc/52/63/79/371526379.db2.gz HZJCNWOINFSDPL-SNVBAGLBSA-N 1 2 240.372 2.152 20 0 BEADLO Cc1cc(CNCc2[nH+]ccn2CC(C)C)on1 ZINC000631080833 371498602 /nfs/dbraw/zinc/49/86/02/371498602.db2.gz ZHZHGQPIWYAYRD-UHFFFAOYSA-N 1 2 248.330 2.125 20 0 BEADLO Cc1cc(C[NH2+]Cc2nccn2CC(C)C)on1 ZINC000631080833 371498607 /nfs/dbraw/zinc/49/86/07/371498607.db2.gz ZHZHGQPIWYAYRD-UHFFFAOYSA-N 1 2 248.330 2.125 20 0 BEADLO C[C@H]1CCC[C@]1(C)C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627373472 371592669 /nfs/dbraw/zinc/59/26/69/371592669.db2.gz SIGWDTXVEHAUNH-HZMBPMFUSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@H]1CCC[C@]1(C)C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627373472 371592672 /nfs/dbraw/zinc/59/26/72/371592672.db2.gz SIGWDTXVEHAUNH-HZMBPMFUSA-N 1 2 247.342 2.121 20 0 BEADLO CCNc1nc[nH+]c(NCC)c1Br ZINC000227093272 371783107 /nfs/dbraw/zinc/78/31/07/371783107.db2.gz XKRKLCXFWPGVJD-UHFFFAOYSA-N 1 2 245.124 2.103 20 0 BEADLO C[C@@H]1C[C@@H]([NH2+]Cc2ccns2)c2nccn21 ZINC000404338451 372082342 /nfs/dbraw/zinc/08/23/42/372082342.db2.gz DATXNFJQSWXAKU-PSASIEDQSA-N 1 2 234.328 2.135 20 0 BEADLO Cc1cc[nH+]c(N[C@H]2C[C@@H](CO)C2)c1Cl ZINC000631426585 372356556 /nfs/dbraw/zinc/35/65/56/372356556.db2.gz DFEDYXYDQYTJBG-DTORHVGOSA-N 1 2 226.707 2.226 20 0 BEADLO Cc1ncc([C@@H](C)Nc2cc[nH+]c(C)n2)s1 ZINC000631472298 372382729 /nfs/dbraw/zinc/38/27/29/372382729.db2.gz QCLKABPGXCBQLI-SSDOTTSWSA-N 1 2 234.328 2.145 20 0 BEADLO COc1c(C)[nH+]cnc1N1CCC(C)(F)CC1 ZINC000631514128 372402721 /nfs/dbraw/zinc/40/27/21/372402721.db2.gz BFUYKKNYPANONR-UHFFFAOYSA-N 1 2 239.294 2.122 20 0 BEADLO CCc1noc([C@@H](C)[N@@H+]2CCS[C@H](C)C2)n1 ZINC000171692470 372735046 /nfs/dbraw/zinc/73/50/46/372735046.db2.gz QTFFMAGYHJETLZ-RKDXNWHRSA-N 1 2 241.360 2.130 20 0 BEADLO CCc1noc([C@@H](C)[N@H+]2CCS[C@H](C)C2)n1 ZINC000171692470 372735050 /nfs/dbraw/zinc/73/50/50/372735050.db2.gz QTFFMAGYHJETLZ-RKDXNWHRSA-N 1 2 241.360 2.130 20 0 BEADLO CC(C)c1nc(NCC2(O)CCCC2)cc[nH+]1 ZINC000171860041 372800740 /nfs/dbraw/zinc/80/07/40/372800740.db2.gz VAMLWISEJDZACX-UHFFFAOYSA-N 1 2 235.331 2.317 20 0 BEADLO FC(F)CN1CC[C@H](CNc2cccc[nH+]2)C1 ZINC000171991722 372849198 /nfs/dbraw/zinc/84/91/98/372849198.db2.gz MRHQLAFPVRQVQX-SNVBAGLBSA-N 1 2 241.285 2.081 20 0 BEADLO C[C@H](CC(=O)N[C@]12C[C@H]1CCCC2)n1cc[nH+]c1 ZINC000634087462 373954698 /nfs/dbraw/zinc/95/46/98/373954698.db2.gz ROCATORUPNRALA-YRGRVCCFSA-N 1 2 247.342 2.283 20 0 BEADLO CCc1[nH]c(CNc2ncncc2Cl)c[nH+]1 ZINC001643236849 1172451443 /nfs/dbraw/zinc/45/14/43/1172451443.db2.gz BJDVBDPDWRCEMI-UHFFFAOYSA-N 1 2 237.694 2.028 20 0 BEADLO CCc1[nH]cc(CNc2ncncc2Cl)[nH+]1 ZINC001643236849 1172451447 /nfs/dbraw/zinc/45/14/47/1172451447.db2.gz BJDVBDPDWRCEMI-UHFFFAOYSA-N 1 2 237.694 2.028 20 0 BEADLO Cc1sccc1NC(=O)CCn1cc[nH+]c1 ZINC000634213514 374031114 /nfs/dbraw/zinc/03/11/14/374031114.db2.gz JLWSYZIWLZYXJM-UHFFFAOYSA-N 1 2 235.312 2.282 20 0 BEADLO CC[C@H](C)NC(=O)Cc1cn2cccc(C)c2[nH+]1 ZINC000041287529 374128917 /nfs/dbraw/zinc/12/89/17/374128917.db2.gz FOXHMTFUTFSSFO-NSHDSACASA-N 1 2 245.326 2.100 20 0 BEADLO CC(C)[C@H]1C[N@H+](CC(F)F)CCS1 ZINC000174335287 374182314 /nfs/dbraw/zinc/18/23/14/374182314.db2.gz OIEBQRIRRMFMSZ-MRVPVSSYSA-N 1 2 209.305 2.325 20 0 BEADLO CC(C)[C@H]1C[N@@H+](CC(F)F)CCS1 ZINC000174335287 374182316 /nfs/dbraw/zinc/18/23/16/374182316.db2.gz OIEBQRIRRMFMSZ-MRVPVSSYSA-N 1 2 209.305 2.325 20 0 BEADLO C[C@@H](CC1CCC1)NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000634370696 374220199 /nfs/dbraw/zinc/22/01/99/374220199.db2.gz BURJIFAIDLSYGA-QWRGUYRKSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H](CC1CCC1)NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000634370696 374220207 /nfs/dbraw/zinc/22/02/07/374220207.db2.gz BURJIFAIDLSYGA-QWRGUYRKSA-N 1 2 249.358 2.283 20 0 BEADLO Cn1ccnc1C[NH2+][C@H]1C[C@@]1(F)c1ccccc1 ZINC000424192668 206034478 /nfs/dbraw/zinc/03/44/78/206034478.db2.gz JOIIRBUKCSZSOA-GXTWGEPZSA-N 1 2 245.301 2.147 20 0 BEADLO Cn1cc[nH+]c1CN[C@H]1C[C@@]1(F)c1ccccc1 ZINC000424192668 206034482 /nfs/dbraw/zinc/03/44/82/206034482.db2.gz JOIIRBUKCSZSOA-GXTWGEPZSA-N 1 2 245.301 2.147 20 0 BEADLO CC[N@H+](Cc1nnc(C)[nH]1)Cc1cccc(F)c1 ZINC000428472149 206058477 /nfs/dbraw/zinc/05/84/77/206058477.db2.gz FVRJRTSTIDBSJV-UHFFFAOYSA-N 1 2 248.305 2.274 20 0 BEADLO CC[N@@H+](Cc1nnc(C)[nH]1)Cc1cccc(F)c1 ZINC000428472149 206058481 /nfs/dbraw/zinc/05/84/81/206058481.db2.gz FVRJRTSTIDBSJV-UHFFFAOYSA-N 1 2 248.305 2.274 20 0 BEADLO O=C(N[C@H]1CC=CCC1)c1ccc2[nH+]ccn2c1 ZINC000172484758 182326861 /nfs/dbraw/zinc/32/68/61/182326861.db2.gz VNLXVUNMECSKPZ-LBPRGKRZSA-N 1 2 241.294 2.173 20 0 BEADLO CCc1ccc(C[NH+]2CC(OCCOC)C2)cc1 ZINC000459466253 206128169 /nfs/dbraw/zinc/12/81/69/206128169.db2.gz PEMQKZPXJGCITR-UHFFFAOYSA-N 1 2 249.354 2.096 20 0 BEADLO O=C(Nc1cc[nH+]cc1O)c1cccs1 ZINC000109889294 182387343 /nfs/dbraw/zinc/38/73/43/182387343.db2.gz COLUPRXGTCMNJY-UHFFFAOYSA-N 1 2 220.253 2.101 20 0 BEADLO O=C(Nc1cc[nH+]cc1O)c1ccc(Cl)o1 ZINC000109889491 182387688 /nfs/dbraw/zinc/38/76/88/182387688.db2.gz HSBPNUWDYYXJCO-UHFFFAOYSA-N 1 2 238.630 2.286 20 0 BEADLO OC1CN(c2cc[nH+]c3c(Cl)cccc23)C1 ZINC000288025370 183031346 /nfs/dbraw/zinc/03/13/46/183031346.db2.gz SWSFGGQDGAFVFQ-UHFFFAOYSA-N 1 2 234.686 2.069 20 0 BEADLO OCCCCCCNc1cc[nH+]c(C2CC2)n1 ZINC000180213720 183043784 /nfs/dbraw/zinc/04/37/84/183043784.db2.gz UJAANVXCVOGTIE-UHFFFAOYSA-N 1 2 235.331 2.319 20 0 BEADLO OCCCCCNc1cc[nH+]c2ccncc12 ZINC000279485488 183046866 /nfs/dbraw/zinc/04/68/66/183046866.db2.gz OGXYMADNCSYFNE-UHFFFAOYSA-N 1 2 231.299 2.204 20 0 BEADLO OCC(F)(F)C[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC000184700682 183035850 /nfs/dbraw/zinc/03/58/50/183035850.db2.gz ZFHCTYGMRWPAJO-LLVKDONJSA-N 1 2 245.244 2.030 20 0 BEADLO OCC[C@@H]([NH2+]Cc1ccco1)c1ccco1 ZINC000184517482 183091163 /nfs/dbraw/zinc/09/11/63/183091163.db2.gz RXPQSFSDCFBOAE-LLVKDONJSA-N 1 2 221.256 2.086 20 0 BEADLO CCCC[C@H]([NH2+]CCSCC)C(=O)OC ZINC000308832069 169011459 /nfs/dbraw/zinc/01/14/59/169011459.db2.gz URDWMJHTLSQORX-JTQLQIEISA-N 1 2 233.377 2.061 20 0 BEADLO CCCC[C@H]([NH2+]CCC(C)(F)F)C(=O)OC ZINC000357692439 169011719 /nfs/dbraw/zinc/01/17/19/169011719.db2.gz APWFDBRPFLPFHP-VIFPVBQESA-N 1 2 237.290 2.353 20 0 BEADLO OC[C@@H]([NH2+]Cc1cscn1)c1ccsc1 ZINC000336738917 183109132 /nfs/dbraw/zinc/10/91/32/183109132.db2.gz RWIDBKGTPISNSR-SNVBAGLBSA-N 1 2 240.353 2.028 20 0 BEADLO OC[C@@H](Nc1cccc[nH+]1)c1ccccc1 ZINC000063001331 183110552 /nfs/dbraw/zinc/11/05/52/183110552.db2.gz JIVAIDYQEZQKRX-GFCCVEGCSA-N 1 2 214.268 2.227 20 0 BEADLO OC[C@H]1CCCC[C@@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000266217581 183148208 /nfs/dbraw/zinc/14/82/08/183148208.db2.gz PNOVFBZBAKVAKE-NEPJUHHUSA-N 1 2 247.342 2.317 20 0 BEADLO CCCCn1ncc(NCc2[nH]cc[nH+]2)c1C ZINC000341259263 169039598 /nfs/dbraw/zinc/03/95/98/169039598.db2.gz BGVHCQBCDHTCQP-UHFFFAOYSA-N 1 2 233.319 2.327 20 0 BEADLO OCc1ccc(C[NH+]2Cc3ccccc3C2)o1 ZINC000169068231 183165035 /nfs/dbraw/zinc/16/50/35/183165035.db2.gz RPCLRYDLMDXTAA-UHFFFAOYSA-N 1 2 229.279 2.288 20 0 BEADLO OC[C@]1(F)CC[N@H+](Cc2sccc2Cl)C1 ZINC000334155136 183159748 /nfs/dbraw/zinc/15/97/48/183159748.db2.gz UGSPFVXFYFXDPS-JTQLQIEISA-N 1 2 249.738 2.308 20 0 BEADLO OC[C@]1(F)CC[N@@H+](Cc2sccc2Cl)C1 ZINC000334155136 183159750 /nfs/dbraw/zinc/15/97/50/183159750.db2.gz UGSPFVXFYFXDPS-JTQLQIEISA-N 1 2 249.738 2.308 20 0 BEADLO O[C@@H]1CC[C@H]1Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000335605610 183205157 /nfs/dbraw/zinc/20/51/57/183205157.db2.gz UAFSWZOBPKHISG-HTQZYQBOSA-N 1 2 232.205 2.036 20 0 BEADLO O[C@@H]1CCCC[C@@H]1CNc1cc[nH+]c(C2CC2)n1 ZINC000156858887 183187667 /nfs/dbraw/zinc/18/76/67/183187667.db2.gz SUOZBZORQZQEIM-VXGBXAGGSA-N 1 2 247.342 2.317 20 0 BEADLO CCC[N@H+](C)[C@H](C(=O)OC)c1ccccc1F ZINC000072583659 169086433 /nfs/dbraw/zinc/08/64/33/169086433.db2.gz QAFHBPIFIQJYGN-LBPRGKRZSA-N 1 2 239.290 2.382 20 0 BEADLO CCC[N@@H+](C)[C@H](C(=O)OC)c1ccccc1F ZINC000072583659 169086436 /nfs/dbraw/zinc/08/64/36/169086436.db2.gz QAFHBPIFIQJYGN-LBPRGKRZSA-N 1 2 239.290 2.382 20 0 BEADLO CCCN(C)c1cc[nH+]c2ccncc21 ZINC000268013702 169088552 /nfs/dbraw/zinc/08/85/52/169088552.db2.gz XFHYSHJJSUZXJW-UHFFFAOYSA-N 1 2 201.273 2.476 20 0 BEADLO CCCN(C)c1[nH+]cnc2c1cnn2C(C)(C)C ZINC000301894416 169090002 /nfs/dbraw/zinc/09/00/02/169090002.db2.gz PIKPMVOTZBRONF-UHFFFAOYSA-N 1 2 247.346 2.428 20 0 BEADLO O[C@H]1CCC[N@H+](Cc2csc(Cl)n2)CC1 ZINC000294103420 183235592 /nfs/dbraw/zinc/23/55/92/183235592.db2.gz SHDRIFQFDIUGEA-VIFPVBQESA-N 1 2 246.763 2.143 20 0 BEADLO O[C@H]1CCC[N@@H+](Cc2csc(Cl)n2)CC1 ZINC000294103420 183235593 /nfs/dbraw/zinc/23/55/93/183235593.db2.gz SHDRIFQFDIUGEA-VIFPVBQESA-N 1 2 246.763 2.143 20 0 BEADLO CCC[N@H+](CC(F)F)CC1(C)COC1 ZINC000336673824 169108318 /nfs/dbraw/zinc/10/83/18/169108318.db2.gz QUABKFVVYPRDFA-UHFFFAOYSA-N 1 2 207.264 2.000 20 0 BEADLO CCC[N@@H+](CC(F)F)CC1(C)COC1 ZINC000336673824 169108320 /nfs/dbraw/zinc/10/83/20/169108320.db2.gz QUABKFVVYPRDFA-UHFFFAOYSA-N 1 2 207.264 2.000 20 0 BEADLO CCC[N@H+](CC)Cc1ncn(-c2ccccc2)n1 ZINC000271545660 169131850 /nfs/dbraw/zinc/13/18/50/169131850.db2.gz MEQUKVGVYWFEDU-UHFFFAOYSA-N 1 2 244.342 2.499 20 0 BEADLO CCC[N@@H+](CC)Cc1ncn(-c2ccccc2)n1 ZINC000271545660 169131852 /nfs/dbraw/zinc/13/18/52/169131852.db2.gz MEQUKVGVYWFEDU-UHFFFAOYSA-N 1 2 244.342 2.499 20 0 BEADLO Oc1cccc2c1C[C@H](Nc1cccc[nH+]1)C2 ZINC000336365669 183297501 /nfs/dbraw/zinc/29/75/01/183297501.db2.gz VIHUZALTFSEEOO-LLVKDONJSA-N 1 2 226.279 2.367 20 0 BEADLO c1n[nH]c2c1[C@H]([NH2+]CCOC1CCCC1)CCC2 ZINC000367740111 183319490 /nfs/dbraw/zinc/31/94/90/183319490.db2.gz NJZZQSBTGITEJB-CYBMUJFWSA-N 1 2 249.358 2.336 20 0 BEADLO c1csc([C@@H]2CCCN2Cc2[nH]cc[nH+]2)n1 ZINC000369188840 183324470 /nfs/dbraw/zinc/32/44/70/183324470.db2.gz RWBHFBHNCZRNRO-VIFPVBQESA-N 1 2 234.328 2.203 20 0 BEADLO c1csc([C@H]2CCCN2Cc2[nH]cc[nH+]2)n1 ZINC000369188839 183325187 /nfs/dbraw/zinc/32/51/87/183325187.db2.gz RWBHFBHNCZRNRO-SECBINFHSA-N 1 2 234.328 2.203 20 0 BEADLO c1cc(CNc2ccc(N3CCCC3)[nH+]c2)n[nH]1 ZINC000036982263 183353704 /nfs/dbraw/zinc/35/37/04/183353704.db2.gz VBCGZYLKXSDKEZ-UHFFFAOYSA-N 1 2 243.314 2.017 20 0 BEADLO c1cc(N[C@@H]2CCCOCC2)nc(C2CC2)[nH+]1 ZINC000183003246 183358196 /nfs/dbraw/zinc/35/81/96/183358196.db2.gz YMEYXZXTBOWFCM-LLVKDONJSA-N 1 2 233.315 2.335 20 0 BEADLO c1cc2[nH+]ccc(NC3CCOCC3)c2cn1 ZINC000267956866 183377413 /nfs/dbraw/zinc/37/74/13/183377413.db2.gz KJTORLYBONACCX-UHFFFAOYSA-N 1 2 229.283 2.221 20 0 BEADLO c1nc(C[NH2+]C2(c3ccccc3)CC2)co1 ZINC000276973118 183389089 /nfs/dbraw/zinc/38/90/89/183389089.db2.gz FQUHVIHZDNAORK-UHFFFAOYSA-N 1 2 214.268 2.454 20 0 BEADLO CCCOCC(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000263778435 169307512 /nfs/dbraw/zinc/30/75/12/169307512.db2.gz GOHRLNBYAHXYOI-UHFFFAOYSA-N 1 2 247.298 2.008 20 0 BEADLO CCCOCC(=O)Nc1cc[nH+]cc1CC ZINC000265232374 169308985 /nfs/dbraw/zinc/30/89/85/169308985.db2.gz POQZHTGFKAJRER-UHFFFAOYSA-N 1 2 222.288 2.009 20 0 BEADLO CCC[C@@H](C(=O)N1CCn2c[nH+]cc2C1)C(C)C ZINC000290869720 169344132 /nfs/dbraw/zinc/34/41/32/169344132.db2.gz CLHIEUIOVXBTFI-CYBMUJFWSA-N 1 2 249.358 2.298 20 0 BEADLO CCC[C@@H](C)Cc1nc(Cc2c[nH+]cn2C)no1 ZINC000357960081 169362422 /nfs/dbraw/zinc/36/24/22/169362422.db2.gz XYVABOUCBSZZFO-SNVBAGLBSA-N 1 2 248.330 2.373 20 0 BEADLO CCC[C@@H](CC)[S@@](=O)Cc1[nH+]ccn1C ZINC000279913512 169381280 /nfs/dbraw/zinc/38/12/80/169381280.db2.gz DOHVPSGTBAXRNY-BMIGLBTASA-N 1 2 228.361 2.248 20 0 BEADLO c1cc(C[N@H+](Cc2cccnc2)C2CC2)on1 ZINC000272587245 183490624 /nfs/dbraw/zinc/49/06/24/183490624.db2.gz RJVUEWAEFTWLRK-UHFFFAOYSA-N 1 2 229.283 2.234 20 0 BEADLO c1cc(C[N@@H+](Cc2cccnc2)C2CC2)on1 ZINC000272587245 183490626 /nfs/dbraw/zinc/49/06/26/183490626.db2.gz RJVUEWAEFTWLRK-UHFFFAOYSA-N 1 2 229.283 2.234 20 0 BEADLO CCc1cn(Cc2csc(C)n2)c[nH+]1 ZINC001644227231 1172535030 /nfs/dbraw/zinc/53/50/30/1172535030.db2.gz GOZAEZVOIXAHFX-UHFFFAOYSA-N 1 2 207.302 2.259 20 0 BEADLO c1sc([C@H]2COCC[NH2+]2)nc1C1CCCC1 ZINC000226468543 183554707 /nfs/dbraw/zinc/55/47/07/183554707.db2.gz WDWYOQXJPMIAQF-SNVBAGLBSA-N 1 2 238.356 2.462 20 0 BEADLO Cc1cnc([C@H](C)[NH2+]Cc2c(C)noc2C)o1 ZINC000220920905 383824811 /nfs/dbraw/zinc/82/48/11/383824811.db2.gz CWBIQGUXTFBSKW-VIFPVBQESA-N 1 2 235.287 2.439 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C=C1CCC1 ZINC000087322191 383825177 /nfs/dbraw/zinc/82/51/77/383825177.db2.gz QOQWFRWFLQOPGV-UHFFFAOYSA-N 1 2 202.257 2.439 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)Cc1cccc(F)c1 ZINC000111192800 383839823 /nfs/dbraw/zinc/83/98/23/383839823.db2.gz LRDRIWAATDFNJN-UHFFFAOYSA-N 1 2 219.263 2.181 20 0 BEADLO Cc1nonc1C[NH2+][C@H](C)c1cccs1 ZINC000069794827 383845878 /nfs/dbraw/zinc/84/58/78/383845878.db2.gz RYSBGHLULGWQPK-MRVPVSSYSA-N 1 2 223.301 2.290 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2scnc2C)on1 ZINC000066564436 383869521 /nfs/dbraw/zinc/86/95/21/383869521.db2.gz MACFEDGZTDELMA-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2scnc2C)on1 ZINC000066564436 383869529 /nfs/dbraw/zinc/86/95/29/383869529.db2.gz MACFEDGZTDELMA-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO CCc1cc(Nc2cnn(CC)c2)nc(C)[nH+]1 ZINC000088058468 383877920 /nfs/dbraw/zinc/87/79/20/383877920.db2.gz CTCSHIXSHLAZCY-UHFFFAOYSA-N 1 2 231.303 2.307 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2ccn(C)n2)o1 ZINC000112338869 383917165 /nfs/dbraw/zinc/91/71/65/383917165.db2.gz PSSSDIOLPSZMFX-JTQLQIEISA-N 1 2 219.288 2.172 20 0 BEADLO CC(C)[N@H+](Cc1nc2ccccc2[nH]1)C1COC1 ZINC000449350650 383930945 /nfs/dbraw/zinc/93/09/45/383930945.db2.gz KRTWEWYPUZFLMQ-UHFFFAOYSA-N 1 2 245.326 2.172 20 0 BEADLO CC(C)[N@@H+](Cc1nc2ccccc2[nH]1)C1COC1 ZINC000449350650 383930950 /nfs/dbraw/zinc/93/09/50/383930950.db2.gz KRTWEWYPUZFLMQ-UHFFFAOYSA-N 1 2 245.326 2.172 20 0 BEADLO CSC[C@@H](C)C(=O)Nc1cc[nH+]cc1C ZINC000066839402 383893461 /nfs/dbraw/zinc/89/34/61/383893461.db2.gz CQLCACYKXZVKSP-SECBINFHSA-N 1 2 224.329 2.328 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@H]2c2cnn(C)c2)no1 ZINC000071797304 384003287 /nfs/dbraw/zinc/00/32/87/384003287.db2.gz KNSGTVCKQRWJTR-ZDUSSCGKSA-N 1 2 246.314 2.054 20 0 BEADLO CC[C@H]([NH2+][C@H]1C[C@@H](C)N(C2CC2)C1)C(F)F ZINC000449364816 383992801 /nfs/dbraw/zinc/99/28/01/383992801.db2.gz UJUBUVYZYQVSTE-YWVKMMECSA-N 1 2 232.318 2.245 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@H]2c2cnn(C)c2)no1 ZINC000071797304 384003295 /nfs/dbraw/zinc/00/32/95/384003295.db2.gz KNSGTVCKQRWJTR-ZDUSSCGKSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1n[nH]cc1C[NH2+][C@H](C)c1nccs1 ZINC000070621415 383944212 /nfs/dbraw/zinc/94/42/12/383944212.db2.gz SAKXYMDMNOESFL-MRVPVSSYSA-N 1 2 222.317 2.025 20 0 BEADLO C[C@@H]1C[C@H]([NH2+]Cc2ccccn2)c2nccn21 ZINC000345353411 383952800 /nfs/dbraw/zinc/95/28/00/383952800.db2.gz KJOVJJVHLFPLDJ-PWSUYJOCSA-N 1 2 228.299 2.074 20 0 BEADLO C[NH2+]Cc1noc(C[C@@H]2CCCC[C@@H]2C)n1 ZINC000518490579 383953923 /nfs/dbraw/zinc/95/39/23/383953923.db2.gz JEJKWYKHCBLHLY-UWVGGRQHSA-N 1 2 223.320 2.158 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CCS[C@H](C)C2)s1 ZINC000335852593 384011953 /nfs/dbraw/zinc/01/19/53/384011953.db2.gz UHHQLHSAIFBNHZ-SFYZADRCSA-N 1 2 243.401 2.345 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CCS[C@H](C)C2)s1 ZINC000335852593 384011962 /nfs/dbraw/zinc/01/19/62/384011962.db2.gz UHHQLHSAIFBNHZ-SFYZADRCSA-N 1 2 243.401 2.345 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@H](C)Cc1ccccc1C ZINC000090274471 384040261 /nfs/dbraw/zinc/04/02/61/384040261.db2.gz WYWUYEKOAWUSKG-VXGBXAGGSA-N 1 2 235.327 2.077 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H](C)Cc1ccccc1C ZINC000090274470 384040496 /nfs/dbraw/zinc/04/04/96/384040496.db2.gz WYWUYEKOAWUSKG-RYUDHWBXSA-N 1 2 235.327 2.077 20 0 BEADLO CCc1ccc([C@H](C)[NH2+]Cc2ncn(C)n2)cc1 ZINC000090969926 384085959 /nfs/dbraw/zinc/08/59/59/384085959.db2.gz ATDZYHUGGBNOEO-NSHDSACASA-N 1 2 244.342 2.228 20 0 BEADLO CC[C@@H](C[N@@H+]1CCOC[C@@H]1c1ccco1)OC ZINC000642687307 384066749 /nfs/dbraw/zinc/06/67/49/384066749.db2.gz GIFMUKZTALCGQS-NWDGAFQWSA-N 1 2 239.315 2.078 20 0 BEADLO CC[C@@H](C[N@H+]1CCOC[C@@H]1c1ccco1)OC ZINC000642687307 384066756 /nfs/dbraw/zinc/06/67/56/384066756.db2.gz GIFMUKZTALCGQS-NWDGAFQWSA-N 1 2 239.315 2.078 20 0 BEADLO CC(C)CC(=O)NCCCNc1cccc[nH+]1 ZINC000115161136 384070990 /nfs/dbraw/zinc/07/09/90/384070990.db2.gz SQZLVOCGSGVIFD-UHFFFAOYSA-N 1 2 235.331 2.046 20 0 BEADLO CC[C@@H](C)C(=O)NCCCNc1cccc[nH+]1 ZINC000115161837 384071172 /nfs/dbraw/zinc/07/11/72/384071172.db2.gz LHPKPMMWUSEUPB-LLVKDONJSA-N 1 2 235.331 2.046 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2ccon2)o1 ZINC000309134580 384081736 /nfs/dbraw/zinc/08/17/36/384081736.db2.gz RUSUZQVJDKQEIM-VIFPVBQESA-N 1 2 206.245 2.427 20 0 BEADLO Cn1nccc1C[N@@H+]1CCc2cc(F)ccc2C1 ZINC000091085026 384100516 /nfs/dbraw/zinc/10/05/16/384100516.db2.gz XBOLTZCQDUFYPQ-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1nccc1C[N@H+]1CCc2cc(F)ccc2C1 ZINC000091085026 384100523 /nfs/dbraw/zinc/10/05/23/384100523.db2.gz XBOLTZCQDUFYPQ-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cnn(C)c1)c1nccs1 ZINC000070717604 384133333 /nfs/dbraw/zinc/13/33/33/384133333.db2.gz TXUNOSWWKROIHV-DTWKUNHWSA-N 1 2 236.344 2.288 20 0 BEADLO Cc1csc(C(C)(C)[NH2+]Cc2cc[nH]n2)n1 ZINC000116381726 384131731 /nfs/dbraw/zinc/13/17/31/384131731.db2.gz ZFRDQJLUBLGKOW-UHFFFAOYSA-N 1 2 236.344 2.200 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1c1nc(C)[nH+]c(N(C)C)n1 ZINC000357297047 384149351 /nfs/dbraw/zinc/14/93/51/384149351.db2.gz YXEXSHQOSFVOSN-KOLCDFICSA-N 1 2 249.362 2.013 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1c1nc(N(C)C)nc(C)[nH+]1 ZINC000357297047 384149353 /nfs/dbraw/zinc/14/93/53/384149353.db2.gz YXEXSHQOSFVOSN-KOLCDFICSA-N 1 2 249.362 2.013 20 0 BEADLO Cc1cc[nH+]cc1NCc1cccn1C ZINC000070957256 384142656 /nfs/dbraw/zinc/14/26/56/384142656.db2.gz VYJHRJGXRQHGDR-UHFFFAOYSA-N 1 2 201.273 2.341 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cn[nH]c1)c1nc(C2CC2)no1 ZINC000358802856 384168428 /nfs/dbraw/zinc/16/84/28/384168428.db2.gz FANUPWZXQMFHHW-JGVFFNPUSA-N 1 2 247.302 2.082 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1nc(C2CC2)no1)c1cn[nH]c1 ZINC000358802872 384170362 /nfs/dbraw/zinc/17/03/62/384170362.db2.gz FANUPWZXQMFHHW-YUMQZZPRSA-N 1 2 247.302 2.082 20 0 BEADLO CCc1ccc(C[N@H+](C)Cc2cnccn2)o1 ZINC000092591192 384185106 /nfs/dbraw/zinc/18/51/06/384185106.db2.gz AEUQHQCTWAMOOK-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1ccc(C[N@@H+](C)Cc2cnccn2)o1 ZINC000092591192 384185109 /nfs/dbraw/zinc/18/51/09/384185109.db2.gz AEUQHQCTWAMOOK-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO Cc1n[nH]cc1C[N@@H+]1CCCC[C@@H]1c1ncc[nH]1 ZINC000092730037 384191773 /nfs/dbraw/zinc/19/17/73/384191773.db2.gz VBXPTFGLBBHDOE-GFCCVEGCSA-N 1 2 245.330 2.168 20 0 BEADLO Cc1n[nH]cc1C[N@H+]1CCCC[C@@H]1c1ncc[nH]1 ZINC000092730037 384191775 /nfs/dbraw/zinc/19/17/75/384191775.db2.gz VBXPTFGLBBHDOE-GFCCVEGCSA-N 1 2 245.330 2.168 20 0 BEADLO Cc1cc(C[N@H+]2CCS[C@@H](C)[C@@H]2C)no1 ZINC000118419171 384198962 /nfs/dbraw/zinc/19/89/62/384198962.db2.gz NLSPRJVZVSDVQU-UWVGGRQHSA-N 1 2 226.345 2.309 20 0 BEADLO Cc1cc(C[N@@H+]2CCS[C@@H](C)[C@@H]2C)no1 ZINC000118419171 384198969 /nfs/dbraw/zinc/19/89/69/384198969.db2.gz NLSPRJVZVSDVQU-UWVGGRQHSA-N 1 2 226.345 2.309 20 0 BEADLO Cc1nc(N2CCc3ccsc3C2)cc[nH+]1 ZINC000132481122 384233105 /nfs/dbraw/zinc/23/31/05/384233105.db2.gz QQYJZXDCFGSXCF-UHFFFAOYSA-N 1 2 231.324 2.409 20 0 BEADLO Fc1cccc(C[N@@H+]2CCc3n[nH]cc3C2)c1 ZINC000118853659 384214450 /nfs/dbraw/zinc/21/44/50/384214450.db2.gz VRBKRMLXKQQUJJ-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO Fc1cccc(C[N@H+]2CCc3n[nH]cc3C2)c1 ZINC000118853659 384214456 /nfs/dbraw/zinc/21/44/56/384214456.db2.gz VRBKRMLXKQQUJJ-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO Cc1nc(N2CCC(c3ncco3)CC2)cc[nH+]1 ZINC000585577374 384219532 /nfs/dbraw/zinc/21/95/32/384219532.db2.gz UNMFBYSFNOYFAM-UHFFFAOYSA-N 1 2 244.298 2.157 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)C[C@H]1CCCC(C)(C)C1 ZINC000560555171 384221083 /nfs/dbraw/zinc/22/10/83/384221083.db2.gz QGLCTRVVUMCSKI-NSHDSACASA-N 1 2 236.363 2.453 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)C[C@H]1CCCC(C)(C)C1 ZINC000560555171 384221086 /nfs/dbraw/zinc/22/10/86/384221086.db2.gz QGLCTRVVUMCSKI-NSHDSACASA-N 1 2 236.363 2.453 20 0 BEADLO CCc1cc(N[C@@H]2[C@H](C)O[C@@H](C)[C@H]2C)nc[nH+]1 ZINC000624635069 384221996 /nfs/dbraw/zinc/22/19/96/384221996.db2.gz ZTDPNDDMCRQTDQ-QYTUQVAYSA-N 1 2 235.331 2.263 20 0 BEADLO Cc1cc[nH+]cc1NC[C@@H]1CCCOC1 ZINC000082581254 384242658 /nfs/dbraw/zinc/24/26/58/384242658.db2.gz DVFDKFNBSAVFQS-NSHDSACASA-N 1 2 206.289 2.229 20 0 BEADLO c1ncc(C[N@@H+]2CCOC3(CCCC3)C2)s1 ZINC000093588871 384251387 /nfs/dbraw/zinc/25/13/87/384251387.db2.gz SOYGTCJAODJRGC-UHFFFAOYSA-N 1 2 238.356 2.288 20 0 BEADLO c1ncc(C[N@H+]2CCOC3(CCCC3)C2)s1 ZINC000093588871 384251390 /nfs/dbraw/zinc/25/13/90/384251390.db2.gz SOYGTCJAODJRGC-UHFFFAOYSA-N 1 2 238.356 2.288 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)CCc1cccs1 ZINC000093685621 384262705 /nfs/dbraw/zinc/26/27/05/384262705.db2.gz ZEHOOFYTXOIYKL-UHFFFAOYSA-N 1 2 235.356 2.454 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)CCc1cccs1 ZINC000093685621 384262713 /nfs/dbraw/zinc/26/27/13/384262713.db2.gz ZEHOOFYTXOIYKL-UHFFFAOYSA-N 1 2 235.356 2.454 20 0 BEADLO CCC[C@H](C)CNc1ccc(CO)c[nH+]1 ZINC000291625141 384265555 /nfs/dbraw/zinc/26/55/55/384265555.db2.gz RYIQWWDKHRUVHA-JTQLQIEISA-N 1 2 208.305 2.422 20 0 BEADLO CC(C)(C)C[C@@H]1CCCN1C(=O)Cn1cc[nH+]c1 ZINC000564637803 384267845 /nfs/dbraw/zinc/26/78/45/384267845.db2.gz LKRBVCNWSGNULQ-LBPRGKRZSA-N 1 2 249.358 2.310 20 0 BEADLO Cn1cnnc1[C@@H]1CCC[N@@H+]1Cc1ccsc1 ZINC000093810429 384271611 /nfs/dbraw/zinc/27/16/11/384271611.db2.gz OYISDGQSISPPJI-NSHDSACASA-N 1 2 248.355 2.214 20 0 BEADLO Cn1cnnc1[C@@H]1CCC[N@H+]1Cc1ccsc1 ZINC000093810429 384271619 /nfs/dbraw/zinc/27/16/19/384271619.db2.gz OYISDGQSISPPJI-NSHDSACASA-N 1 2 248.355 2.214 20 0 BEADLO Cc1ccc(C[N@H+]2CCC[C@H]2c2nncn2C)o1 ZINC000093809780 384273417 /nfs/dbraw/zinc/27/34/17/384273417.db2.gz YYLXNYFLCCBJSX-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC[C@H]2c2nncn2C)o1 ZINC000093809780 384273420 /nfs/dbraw/zinc/27/34/20/384273420.db2.gz YYLXNYFLCCBJSX-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1cnc[nH]1 ZINC000093845420 384275787 /nfs/dbraw/zinc/27/57/87/384275787.db2.gz SYIIGPYWRMHAME-AWEZNQCLSA-N 1 2 244.342 2.475 20 0 BEADLO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1cnc[nH]1 ZINC000093845420 384275796 /nfs/dbraw/zinc/27/57/96/384275796.db2.gz SYIIGPYWRMHAME-AWEZNQCLSA-N 1 2 244.342 2.475 20 0 BEADLO C[C@@H](CO)SCc1ccc(-n2cc[nH+]c2)cc1 ZINC000133197478 384276462 /nfs/dbraw/zinc/27/64/62/384276462.db2.gz QGOORYQUIOHLCF-NSHDSACASA-N 1 2 248.351 2.486 20 0 BEADLO CC[C@H]1CCCN1C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000517748590 384280107 /nfs/dbraw/zinc/28/01/07/384280107.db2.gz NNJMTWMVALDFME-NEPJUHHUSA-N 1 2 235.331 2.235 20 0 BEADLO CC[C@@H]1CCCN1C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000517748591 384281401 /nfs/dbraw/zinc/28/14/01/384281401.db2.gz NNJMTWMVALDFME-NWDGAFQWSA-N 1 2 235.331 2.235 20 0 BEADLO Cn1ncc2c1nc[nH+]c2N[C@H]1CCCC1(C)C ZINC000094267159 384296066 /nfs/dbraw/zinc/29/60/66/384296066.db2.gz HJYKFNFDUKNJJR-JTQLQIEISA-N 1 2 245.330 2.354 20 0 BEADLO CCCC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000120200590 384337792 /nfs/dbraw/zinc/33/77/92/384337792.db2.gz QZGTXHUTNLJTOB-SNVBAGLBSA-N 1 2 221.304 2.263 20 0 BEADLO C[C@@H]1[C@H](C)SCC[N@@H+]1Cc1ccon1 ZINC000077317996 384401628 /nfs/dbraw/zinc/40/16/28/384401628.db2.gz SNTWSEGQJTZTGX-BDAKNGLRSA-N 1 2 212.318 2.000 20 0 BEADLO C[C@@H]1[C@H](C)SCC[N@H+]1Cc1ccon1 ZINC000077317996 384401630 /nfs/dbraw/zinc/40/16/30/384401630.db2.gz SNTWSEGQJTZTGX-BDAKNGLRSA-N 1 2 212.318 2.000 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCCc2nn(C)cc21)c1ccon1 ZINC000530518756 384407450 /nfs/dbraw/zinc/40/74/50/384407450.db2.gz WVQIBEFALBGEKJ-JOYOIKCWSA-N 1 2 246.314 2.136 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2nccc(N)n2)s1 ZINC000135036597 384409831 /nfs/dbraw/zinc/40/98/31/384409831.db2.gz ZUOPRZROHOVMRK-UHFFFAOYSA-N 1 2 248.355 2.061 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2nccc(N)n2)s1 ZINC000135036597 384409835 /nfs/dbraw/zinc/40/98/35/384409835.db2.gz ZUOPRZROHOVMRK-UHFFFAOYSA-N 1 2 248.355 2.061 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@@H]1CCCC[C@H]1F ZINC000335630744 384410467 /nfs/dbraw/zinc/41/04/67/384410467.db2.gz GVLJFKCQIVSILX-GHMZBOCLSA-N 1 2 211.284 2.088 20 0 BEADLO Cc1ccc(C)c(C[NH2+][C@@H](C)c2ncn(C)n2)c1 ZINC000275799992 384414167 /nfs/dbraw/zinc/41/41/67/384414167.db2.gz JYTICGXWMVJAKK-LBPRGKRZSA-N 1 2 244.342 2.283 20 0 BEADLO c1ccc(N[C@H]2CC23CCOCC3)[nH+]c1 ZINC000335647828 384425055 /nfs/dbraw/zinc/42/50/55/384425055.db2.gz DQKBPDRXYQLQMT-JTQLQIEISA-N 1 2 204.273 2.063 20 0 BEADLO Cc1ccc(NCc2cccn2C)c[nH+]1 ZINC000096033319 384425264 /nfs/dbraw/zinc/42/52/64/384425264.db2.gz RXMCHFHZNZQMJR-UHFFFAOYSA-N 1 2 201.273 2.341 20 0 BEADLO Cc1cnc(C[NH2+][C@@H]2C[C@@H](C)n3ccnc32)s1 ZINC000334200573 384384784 /nfs/dbraw/zinc/38/47/84/384384784.db2.gz NIEUWSDQKXURJH-PSASIEDQSA-N 1 2 248.355 2.444 20 0 BEADLO O[C@@H]1CCCN(c2cc(C(F)(F)F)cc[nH+]2)C1 ZINC000078612545 384450248 /nfs/dbraw/zinc/45/02/48/384450248.db2.gz BXDDCMLELJDWRW-SECBINFHSA-N 1 2 246.232 2.062 20 0 BEADLO Nc1[nH+]cnc(N2Cc3ccccc3C2)c1Cl ZINC000236389457 384437654 /nfs/dbraw/zinc/43/76/54/384437654.db2.gz KSXASOVWKLQOTK-UHFFFAOYSA-N 1 2 246.701 2.232 20 0 BEADLO CS[C@H](C)CNC(=O)Nc1cc[nH+]cc1C ZINC000122144456 384459696 /nfs/dbraw/zinc/45/96/96/384459696.db2.gz QLYDZWYJONTKKA-SECBINFHSA-N 1 2 239.344 2.263 20 0 BEADLO C[C@H]([NH2+]Cc1csnn1)c1cccs1 ZINC000036902109 384461556 /nfs/dbraw/zinc/46/15/56/384461556.db2.gz XONZABBEQDKFLL-ZETCQYMHSA-N 1 2 225.342 2.450 20 0 BEADLO Cn1c2ccc(F)cc2[nH]c1=[NH+]CC1(F)CC1 ZINC000530527998 384463086 /nfs/dbraw/zinc/46/30/86/384463086.db2.gz GXVUWMQVYKTKDN-UHFFFAOYSA-N 1 2 237.253 2.048 20 0 BEADLO Cc1cc(NCC[C@H](C)O)nc(C(C)C)[nH+]1 ZINC000078771806 384463226 /nfs/dbraw/zinc/46/32/26/384463226.db2.gz UBFFNVOEZRXUKK-JTQLQIEISA-N 1 2 223.320 2.091 20 0 BEADLO C[N@@H+](Cc1ccc(Cl)s1)CC1OCCO1 ZINC000122143501 384459207 /nfs/dbraw/zinc/45/92/07/384459207.db2.gz AIGJFNBTGGVHPO-UHFFFAOYSA-N 1 2 247.747 2.206 20 0 BEADLO C[N@H+](Cc1ccc(Cl)s1)CC1OCCO1 ZINC000122143501 384459210 /nfs/dbraw/zinc/45/92/10/384459210.db2.gz AIGJFNBTGGVHPO-UHFFFAOYSA-N 1 2 247.747 2.206 20 0 BEADLO O=C(CCCC1CCCC1)NCCn1cc[nH+]c1 ZINC000079543341 384500889 /nfs/dbraw/zinc/50/08/89/384500889.db2.gz NDKIQUZDIJZGFU-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO Cc1ccc2c(c1)N(Cc1ccc(N)[nH+]c1)CC2 ZINC000647518478 384505269 /nfs/dbraw/zinc/50/52/69/384505269.db2.gz MHUOGIYIBGQPIE-UHFFFAOYSA-N 1 2 239.322 2.365 20 0 BEADLO CC(=O)NC1CCC(Nc2ccc(C)[nH+]c2)CC1 ZINC000161658088 384514131 /nfs/dbraw/zinc/51/41/31/384514131.db2.gz HAHJBBBTSGUOFX-UHFFFAOYSA-N 1 2 247.342 2.249 20 0 BEADLO CCCCC(=O)N1CC[C@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000122862582 384516583 /nfs/dbraw/zinc/51/65/83/384516583.db2.gz ONEJQHPNRMZTAE-QWHCGFSZSA-N 1 2 249.358 2.483 20 0 BEADLO CCCCC(=O)N1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000122863312 384517647 /nfs/dbraw/zinc/51/76/47/384517647.db2.gz ONEJQHPNRMZTAE-OLZOCXBDSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](C)c2cnn(C)c2)s1 ZINC000122932020 384521972 /nfs/dbraw/zinc/52/19/72/384521972.db2.gz UXQZILSBDUGNAC-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO Cc1[nH+]cccc1N[C@@H]1CCO[C@@H](C)C1 ZINC000085726717 384554505 /nfs/dbraw/zinc/55/45/05/384554505.db2.gz OPHSIJJUJVNUKL-GXSJLCMTSA-N 1 2 206.289 2.369 20 0 BEADLO Fc1ccc(NCc2[nH]cc[nH+]2)cc1F ZINC000049714556 384558236 /nfs/dbraw/zinc/55/82/36/384558236.db2.gz YVYJKGWVDBCMHD-UHFFFAOYSA-N 1 2 209.199 2.300 20 0 BEADLO Cc1cc(F)c(C[N@@H+]2CCCOCC2)c(F)c1 ZINC000335113224 384559181 /nfs/dbraw/zinc/55/91/81/384559181.db2.gz YCAFLCIYVDMPEC-UHFFFAOYSA-N 1 2 241.281 2.496 20 0 BEADLO Cc1cc(F)c(C[N@H+]2CCCOCC2)c(F)c1 ZINC000335113224 384559187 /nfs/dbraw/zinc/55/91/87/384559187.db2.gz YCAFLCIYVDMPEC-UHFFFAOYSA-N 1 2 241.281 2.496 20 0 BEADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)C1CC1 ZINC000047514903 384560111 /nfs/dbraw/zinc/56/01/11/384560111.db2.gz OJVJTMDGBPNAGX-UHFFFAOYSA-N 1 2 227.267 2.221 20 0 BEADLO CCOc1ccc(NCc2[nH]cc[nH+]2)cc1OC ZINC000049715158 384561034 /nfs/dbraw/zinc/56/10/34/384561034.db2.gz OQJZKFDXTUIQMC-UHFFFAOYSA-N 1 2 247.298 2.429 20 0 BEADLO c1coc([C@H]2C[N@H+](Cc3ccncc3)CCO2)c1 ZINC000151341413 384569105 /nfs/dbraw/zinc/56/91/05/384569105.db2.gz GXAYGZJTVNRNOD-CQSZACIVSA-N 1 2 244.294 2.248 20 0 BEADLO c1coc([C@H]2C[N@@H+](Cc3ccncc3)CCO2)c1 ZINC000151341413 384569108 /nfs/dbraw/zinc/56/91/08/384569108.db2.gz GXAYGZJTVNRNOD-CQSZACIVSA-N 1 2 244.294 2.248 20 0 BEADLO C[C@H]1SCC[N@H+](Cc2cscn2)[C@@H]1C ZINC000172451836 384590686 /nfs/dbraw/zinc/59/06/86/384590686.db2.gz NJCJAPUEERXHON-RKDXNWHRSA-N 1 2 228.386 2.469 20 0 BEADLO C[C@H]1SCC[N@@H+](Cc2cscn2)[C@@H]1C ZINC000172451836 384590691 /nfs/dbraw/zinc/59/06/91/384590691.db2.gz NJCJAPUEERXHON-RKDXNWHRSA-N 1 2 228.386 2.469 20 0 BEADLO CC(C)[N@H+](CCO)C/C(Cl)=C/Cl ZINC000086001393 384587156 /nfs/dbraw/zinc/58/71/56/384587156.db2.gz VYTXEYVXGVEMAU-YVMONPNESA-N 1 2 212.120 2.008 20 0 BEADLO CC(C)[N@@H+](CCO)C/C(Cl)=C/Cl ZINC000086001393 384587163 /nfs/dbraw/zinc/58/71/63/384587163.db2.gz VYTXEYVXGVEMAU-YVMONPNESA-N 1 2 212.120 2.008 20 0 BEADLO Cc1nc(C[N@H+]2CCSC[C@@H]2C)oc1C ZINC000172592234 384608253 /nfs/dbraw/zinc/60/82/53/384608253.db2.gz FEQCCQOUFZECHY-QMMMGPOBSA-N 1 2 226.345 2.229 20 0 BEADLO Cc1nc(C[N@@H+]2CCSC[C@@H]2C)oc1C ZINC000172592234 384608262 /nfs/dbraw/zinc/60/82/62/384608262.db2.gz FEQCCQOUFZECHY-QMMMGPOBSA-N 1 2 226.345 2.229 20 0 BEADLO O=C(CC(F)(F)F)Nc1c[nH+]c2n1CCCC2 ZINC000334879092 384609107 /nfs/dbraw/zinc/60/91/07/384609107.db2.gz ABWMZTQZIOIHNI-UHFFFAOYSA-N 1 2 247.220 2.110 20 0 BEADLO CN(C)c1ccc(NC[C@H]2CCC=CO2)c[nH+]1 ZINC000050268327 384611597 /nfs/dbraw/zinc/61/15/97/384611597.db2.gz SEZWNZQQDUMGDF-GFCCVEGCSA-N 1 2 233.315 2.252 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+]2C[C@@H](C)OC(C)(C)C2)cn1 ZINC000428460141 384615317 /nfs/dbraw/zinc/61/53/17/384615317.db2.gz GGWJOAUYVCAXNI-NEPJUHHUSA-N 1 2 249.358 2.345 20 0 BEADLO Cc1cnc([C@H](C)[N@H+]2C[C@@H](C)OC(C)(C)C2)cn1 ZINC000428460141 384615321 /nfs/dbraw/zinc/61/53/21/384615321.db2.gz GGWJOAUYVCAXNI-NEPJUHHUSA-N 1 2 249.358 2.345 20 0 BEADLO c1csc(C[NH2+]Cc2noc(C3CC3)n2)c1 ZINC000336651327 384616566 /nfs/dbraw/zinc/61/65/66/384616566.db2.gz FDFCQCNKTPRLDY-UHFFFAOYSA-N 1 2 235.312 2.298 20 0 BEADLO C[C@@H]1C[C@H]([NH2+][C@@H](C2CC2)C(F)(F)F)CCO1 ZINC000309805482 384633273 /nfs/dbraw/zinc/63/32/73/384633273.db2.gz SAUQQNCHNUGGTE-QNSHHTMESA-N 1 2 237.265 2.484 20 0 BEADLO COc1cc(C)c(NCc2c[nH+]cn2C)cc1F ZINC000184564563 384618753 /nfs/dbraw/zinc/61/87/53/384618753.db2.gz BTEIVUPHETURSD-UHFFFAOYSA-N 1 2 249.289 2.488 20 0 BEADLO COC[C@@H]1C[N@H+](C/C=C/c2ccccc2)CCO1 ZINC000172879073 384633334 /nfs/dbraw/zinc/63/33/34/384633334.db2.gz VXFKXTZAKWDARV-PXTSUWAFSA-N 1 2 247.338 2.047 20 0 BEADLO COC[C@@H]1C[N@@H+](C/C=C/c2ccccc2)CCO1 ZINC000172879073 384633339 /nfs/dbraw/zinc/63/33/39/384633339.db2.gz VXFKXTZAKWDARV-PXTSUWAFSA-N 1 2 247.338 2.047 20 0 BEADLO c1ccc(N2CCC(OCC3CC3)CC2)[nH+]c1 ZINC000363576092 384622524 /nfs/dbraw/zinc/62/25/24/384622524.db2.gz YGQHXNBSNPBNSR-UHFFFAOYSA-N 1 2 232.327 2.477 20 0 BEADLO Cc1cc[nH+]cc1NCc1ccc(CO)o1 ZINC000081556242 384623474 /nfs/dbraw/zinc/62/34/74/384623474.db2.gz HIZXFEWCPIJWMT-UHFFFAOYSA-N 1 2 218.256 2.087 20 0 BEADLO C[C@@]1(O)CCC[N@H+](Cc2cnc(Cl)s2)C1 ZINC000123937329 384598443 /nfs/dbraw/zinc/59/84/43/384598443.db2.gz XZBOYMBICJCZRV-SNVBAGLBSA-N 1 2 246.763 2.143 20 0 BEADLO C[C@@]1(O)CCC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC000123937329 384598448 /nfs/dbraw/zinc/59/84/48/384598448.db2.gz XZBOYMBICJCZRV-SNVBAGLBSA-N 1 2 246.763 2.143 20 0 BEADLO Cc1cnc(C(C)(C)[NH2+]CCF)s1 ZINC000308312118 384636298 /nfs/dbraw/zinc/63/62/98/384636298.db2.gz SHOQGTRPHIKXQC-UHFFFAOYSA-N 1 2 202.298 2.246 20 0 BEADLO c1cn2cc(CNc3cccc[nH+]3)nc2s1 ZINC000309608929 384638641 /nfs/dbraw/zinc/63/86/41/384638641.db2.gz MBFXWBKXMRFQRD-UHFFFAOYSA-N 1 2 230.296 2.403 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]CC(F)(F)CO)cc1 ZINC000184702890 384640805 /nfs/dbraw/zinc/64/08/05/384640805.db2.gz RGIXNPUHWLNABY-SNVBAGLBSA-N 1 2 229.270 2.273 20 0 BEADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1nc(C)no1 ZINC000162545705 384643886 /nfs/dbraw/zinc/64/38/86/384643886.db2.gz ISVPBBBFKHFEMG-GFCCVEGCSA-N 1 2 246.314 2.356 20 0 BEADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1nc(C)no1 ZINC000162545705 384643890 /nfs/dbraw/zinc/64/38/90/384643890.db2.gz ISVPBBBFKHFEMG-GFCCVEGCSA-N 1 2 246.314 2.356 20 0 BEADLO Cc1nc(N2CCCC3(CC3)C2)cc[nH+]1 ZINC000184833035 384654259 /nfs/dbraw/zinc/65/42/59/384654259.db2.gz HVQLPTPLCQWMOR-UHFFFAOYSA-N 1 2 203.289 2.165 20 0 BEADLO O=C(c1ccco1)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000082277787 384659841 /nfs/dbraw/zinc/65/98/41/384659841.db2.gz OPXONYXSULIVMC-SNVBAGLBSA-N 1 2 245.282 2.370 20 0 BEADLO Cc1ccc(N(C)Cc2[nH+]ccn2C)cc1 ZINC000101562022 384681062 /nfs/dbraw/zinc/68/10/62/384681062.db2.gz GWBZOJFYRKFHKV-UHFFFAOYSA-N 1 2 215.300 2.365 20 0 BEADLO Cn1ccnc1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC000162757741 384681656 /nfs/dbraw/zinc/68/16/56/384681656.db2.gz FTBYOYWVWXKBPZ-ZDUSSCGKSA-N 1 2 242.326 2.152 20 0 BEADLO Cn1ccnc1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000162757741 384681663 /nfs/dbraw/zinc/68/16/63/384681663.db2.gz FTBYOYWVWXKBPZ-ZDUSSCGKSA-N 1 2 242.326 2.152 20 0 BEADLO CC[C@H](CNc1cc[nH+]c(C2CC2)n1)OC ZINC000290709827 384684740 /nfs/dbraw/zinc/68/47/40/384684740.db2.gz OFPATVTZPXDDBR-SNVBAGLBSA-N 1 2 221.304 2.191 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1C(=O)NCCCn1cc[nH+]c1 ZINC000185168733 384689148 /nfs/dbraw/zinc/68/91/48/384689148.db2.gz SQZJNYBUXJDMEX-JSGCOSHPSA-N 1 2 249.358 2.072 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cccc3c2OCO3)CCO1 ZINC000125535180 384726805 /nfs/dbraw/zinc/72/68/05/384726805.db2.gz QMCOHWHTZYPGIU-LBPRGKRZSA-N 1 2 249.310 2.026 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cccc3c2OCO3)CCO1 ZINC000125535180 384726811 /nfs/dbraw/zinc/72/68/11/384726811.db2.gz QMCOHWHTZYPGIU-LBPRGKRZSA-N 1 2 249.310 2.026 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1ccc(F)cc1C ZINC000162883416 384703319 /nfs/dbraw/zinc/70/33/19/384703319.db2.gz IXPHCAPXGLINEZ-UHFFFAOYSA-N 1 2 239.290 2.129 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1ccc(F)cc1C ZINC000162883416 384703325 /nfs/dbraw/zinc/70/33/25/384703325.db2.gz IXPHCAPXGLINEZ-UHFFFAOYSA-N 1 2 239.290 2.129 20 0 BEADLO C[C@@H](O)CNc1[nH+]ccc2ccc(F)cc21 ZINC000309919968 384715081 /nfs/dbraw/zinc/71/50/81/384715081.db2.gz RKNBGLIWPYGOBQ-MRVPVSSYSA-N 1 2 220.247 2.167 20 0 BEADLO CCc1cc(C)c(C(=O)N[C@H](C)c2[nH]cc[nH+]2)o1 ZINC000557047957 384776716 /nfs/dbraw/zinc/77/67/16/384776716.db2.gz QTKBBWGWENBDDF-SECBINFHSA-N 1 2 247.298 2.365 20 0 BEADLO Cc1cc(C)cc(C[NH2+]CC(F)(F)CO)c1 ZINC000183882758 384777891 /nfs/dbraw/zinc/77/78/91/384777891.db2.gz RXIFOLSYLHWNRN-UHFFFAOYSA-N 1 2 229.270 2.021 20 0 BEADLO COc1ccc(C[N@H+](C)CC(C)=O)cc1Cl ZINC000259006574 384736818 /nfs/dbraw/zinc/73/68/18/384736818.db2.gz ZRAVLZRBTREJDU-UHFFFAOYSA-N 1 2 241.718 2.369 20 0 BEADLO COc1ccc(C[N@@H+](C)CC(C)=O)cc1Cl ZINC000259006574 384736824 /nfs/dbraw/zinc/73/68/24/384736824.db2.gz ZRAVLZRBTREJDU-UHFFFAOYSA-N 1 2 241.718 2.369 20 0 BEADLO CC(C)C[C@@H](C)C(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000358174724 384746869 /nfs/dbraw/zinc/74/68/69/384746869.db2.gz YWCBOARJHPDARY-MNOVXSKESA-N 1 2 249.358 2.065 20 0 BEADLO CC(C)C[C@@H](C)C(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000358174724 384746875 /nfs/dbraw/zinc/74/68/75/384746875.db2.gz YWCBOARJHPDARY-MNOVXSKESA-N 1 2 249.358 2.065 20 0 BEADLO Fc1ccc(C[N@@H+]2CCc3n[nH]cc3C2)cc1 ZINC000125767884 384749081 /nfs/dbraw/zinc/74/90/81/384749081.db2.gz VYXKGXKHRQABAM-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO Fc1ccc(C[N@H+]2CCc3n[nH]cc3C2)cc1 ZINC000125767884 384749089 /nfs/dbraw/zinc/74/90/89/384749089.db2.gz VYXKGXKHRQABAM-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO C[C@H]1SCC[N@H+](CC(=O)OC(C)(C)C)[C@H]1C ZINC000118415318 384837810 /nfs/dbraw/zinc/83/78/10/384837810.db2.gz HJMMQHWQACGTTG-VHSXEESVSA-N 1 2 245.388 2.154 20 0 BEADLO C[C@H]1SCC[N@@H+](CC(=O)OC(C)(C)C)[C@H]1C ZINC000118415318 384837819 /nfs/dbraw/zinc/83/78/19/384837819.db2.gz HJMMQHWQACGTTG-VHSXEESVSA-N 1 2 245.388 2.154 20 0 BEADLO Cc1ccc(C(=O)CC[N@@H+]2CCO[C@H](C)C2)cc1 ZINC000053934865 384809533 /nfs/dbraw/zinc/80/95/33/384809533.db2.gz QUKKEXVBRCEPOD-CYBMUJFWSA-N 1 2 247.338 2.289 20 0 BEADLO Cc1ccc(C(=O)CC[N@H+]2CCO[C@H](C)C2)cc1 ZINC000053934865 384809542 /nfs/dbraw/zinc/80/95/42/384809542.db2.gz QUKKEXVBRCEPOD-CYBMUJFWSA-N 1 2 247.338 2.289 20 0 BEADLO COC(C)(C)CNc1cc[nH+]c(C2CC2)n1 ZINC000301467634 384875732 /nfs/dbraw/zinc/87/57/32/384875732.db2.gz QRTWLVOLNHTJFM-UHFFFAOYSA-N 1 2 221.304 2.191 20 0 BEADLO COC(C)(C)C[C@@H](C)Nc1cc(C)[nH+]cn1 ZINC000301479495 384875766 /nfs/dbraw/zinc/87/57/66/384875766.db2.gz YCXJOOAMWCSWLX-SNVBAGLBSA-N 1 2 223.320 2.401 20 0 BEADLO CO[C@H]1CCCC[C@@H]1Nc1cc(C)[nH+]cn1 ZINC000301475222 384877254 /nfs/dbraw/zinc/87/72/54/384877254.db2.gz VVUUSXKNXXGTOV-QWRGUYRKSA-N 1 2 221.304 2.155 20 0 BEADLO CCCCOCC[NH2+][C@@H](C)c1csnn1 ZINC000398284357 384886276 /nfs/dbraw/zinc/88/62/76/384886276.db2.gz XUJJURQQRFUZOW-VIFPVBQESA-N 1 2 229.349 2.005 20 0 BEADLO FC(F)CNCc1cn2cc(Cl)ccc2[nH+]1 ZINC000147640995 384846215 /nfs/dbraw/zinc/84/62/15/384846215.db2.gz JBHJXIMNTWZNFN-UHFFFAOYSA-N 1 2 245.660 2.342 20 0 BEADLO C[NH+](C)c1ccc(NCc2csnn2)cc1 ZINC000057651434 384957592 /nfs/dbraw/zinc/95/75/92/384957592.db2.gz ZEMSKXBKBHRRDB-UHFFFAOYSA-N 1 2 234.328 2.216 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635765692 384906398 /nfs/dbraw/zinc/90/63/98/384906398.db2.gz SOQMPKJYCLLFQP-WRWGMCAJSA-N 1 2 247.342 2.303 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635765692 384906405 /nfs/dbraw/zinc/90/64/05/384906405.db2.gz SOQMPKJYCLLFQP-WRWGMCAJSA-N 1 2 247.342 2.303 20 0 BEADLO Cn1ccnc1[C@H]([NH2+]Cc1ccco1)C1CC1 ZINC000127508821 384909473 /nfs/dbraw/zinc/90/94/73/384909473.db2.gz WNLCSYSWFJGKHT-GFCCVEGCSA-N 1 2 231.299 2.254 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2cn[nH]c2)c1F ZINC000648374221 384920746 /nfs/dbraw/zinc/92/07/46/384920746.db2.gz LNJQFWYBKZICMA-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2cn[nH]c2)c1F ZINC000648374221 384920751 /nfs/dbraw/zinc/92/07/51/384920751.db2.gz LNJQFWYBKZICMA-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO CCc1nc(C[N@H+](C)[C@@H](C)C2(C)CC2)no1 ZINC000177232085 384923607 /nfs/dbraw/zinc/92/36/07/384923607.db2.gz JFFRZINGJIFZDD-VIFPVBQESA-N 1 2 223.320 2.252 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@@H](C)C2(C)CC2)no1 ZINC000177232085 384923611 /nfs/dbraw/zinc/92/36/11/384923611.db2.gz JFFRZINGJIFZDD-VIFPVBQESA-N 1 2 223.320 2.252 20 0 BEADLO c1cn(Cc2ccn(C3CCCC3)n2)c[nH+]1 ZINC000085192901 384923957 /nfs/dbraw/zinc/92/39/57/384923957.db2.gz LYUIEZZDRQVMNL-UHFFFAOYSA-N 1 2 216.288 2.243 20 0 BEADLO Cc1cscc1C(=O)NCCCn1cc[nH+]c1 ZINC000175683738 384945391 /nfs/dbraw/zinc/94/53/91/384945391.db2.gz MAFOBTIFCLVSOJ-UHFFFAOYSA-N 1 2 249.339 2.073 20 0 BEADLO COC(=O)C[N@H+](C)Cc1ccc2c(c1)CCCC2 ZINC000258866935 384946180 /nfs/dbraw/zinc/94/61/80/384946180.db2.gz GHOIYZHUGYXYQF-UHFFFAOYSA-N 1 2 247.338 2.170 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1ccc2c(c1)CCCC2 ZINC000258866935 384946182 /nfs/dbraw/zinc/94/61/82/384946182.db2.gz GHOIYZHUGYXYQF-UHFFFAOYSA-N 1 2 247.338 2.170 20 0 BEADLO C[C@H](Cc1ccoc1)[NH2+]Cc1noc(C2CC2)n1 ZINC000449298574 384946414 /nfs/dbraw/zinc/94/64/14/384946414.db2.gz KLVNDUSABKAKJW-SECBINFHSA-N 1 2 247.298 2.261 20 0 BEADLO CCO[C@H]1C[C@H](N(C)c2cc(C)[nH+]cn2)C1(C)C ZINC000156793185 384960403 /nfs/dbraw/zinc/96/04/03/384960403.db2.gz UJCZEFABBOBCDW-RYUDHWBXSA-N 1 2 249.358 2.425 20 0 BEADLO Cc1[nH]c(C(=O)NC2(C(F)F)CCCC2)c[nH+]1 ZINC000644560279 384960476 /nfs/dbraw/zinc/96/04/76/384960476.db2.gz CCTVREPREIITEQ-UHFFFAOYSA-N 1 2 243.257 2.026 20 0 BEADLO CC(C)c1nc(NCC[C@@H](C)F)cc[nH+]1 ZINC000338755302 384948039 /nfs/dbraw/zinc/94/80/39/384948039.db2.gz OOOICLRDPNBQLE-SECBINFHSA-N 1 2 211.284 2.182 20 0 BEADLO Cc1csc(C[NH2+][C@H]2C[C@@H](C)n3ccnc32)n1 ZINC000294136252 384965418 /nfs/dbraw/zinc/96/54/18/384965418.db2.gz OWRJVXGCPQUGFP-ZJUUUORDSA-N 1 2 248.355 2.444 20 0 BEADLO CCC(F)(F)C[NH2+][C@H](CO)c1ccccc1 ZINC000624147715 384965915 /nfs/dbraw/zinc/96/59/15/384965915.db2.gz IZOPITOYXHSPKI-LLVKDONJSA-N 1 2 229.270 2.355 20 0 BEADLO C[C@H](N[C@@H](C)C(F)(F)F)c1[nH+]ccn1C ZINC000336760631 384973427 /nfs/dbraw/zinc/97/34/27/384973427.db2.gz MHFPHCRKIMMLMQ-BQBZGAKWSA-N 1 2 221.226 2.022 20 0 BEADLO Cc1cc(C[NH2+][C@@H]2C[C@@H](C)n3ccnc32)sn1 ZINC000404342575 384974132 /nfs/dbraw/zinc/97/41/32/384974132.db2.gz FQSALBCXLYVJRR-MWLCHTKSSA-N 1 2 248.355 2.444 20 0 BEADLO CC(C)(C)CCC[N@H+](CCO)CC(F)F ZINC000300888921 385022293 /nfs/dbraw/zinc/02/22/93/385022293.db2.gz UCOVNYUWMKFJCZ-UHFFFAOYSA-N 1 2 223.307 2.372 20 0 BEADLO CC(C)(C)CCC[N@@H+](CCO)CC(F)F ZINC000300888921 385022294 /nfs/dbraw/zinc/02/22/94/385022294.db2.gz UCOVNYUWMKFJCZ-UHFFFAOYSA-N 1 2 223.307 2.372 20 0 BEADLO C[N@H+](CCCO)Cc1csc(C(C)(C)C)n1 ZINC000300849692 384998631 /nfs/dbraw/zinc/99/86/31/384998631.db2.gz SLDUFWJGDSOBRK-UHFFFAOYSA-N 1 2 242.388 2.255 20 0 BEADLO C[N@@H+](CCCO)Cc1csc(C(C)(C)C)n1 ZINC000300849692 384998638 /nfs/dbraw/zinc/99/86/38/384998638.db2.gz SLDUFWJGDSOBRK-UHFFFAOYSA-N 1 2 242.388 2.255 20 0 BEADLO Cc1cc(C[NH2+]Cc2cc(C)on2)sn1 ZINC000404457576 385002744 /nfs/dbraw/zinc/00/27/44/385002744.db2.gz LABQXPOQGFCONI-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO Cc1ccc(NC(=O)CCc2c[nH+]cn2C)cc1 ZINC000188392190 385049927 /nfs/dbraw/zinc/04/99/27/385049927.db2.gz JSTULOUKDFEVFX-UHFFFAOYSA-N 1 2 243.310 2.300 20 0 BEADLO C[C@@H]([NH2+]Cc1ccccc1)c1csnn1 ZINC000307527211 385050418 /nfs/dbraw/zinc/05/04/18/385050418.db2.gz KIAURHODIMZZKK-SECBINFHSA-N 1 2 219.313 2.389 20 0 BEADLO C[C@@H](O)C[NH2+]CC(F)(F)c1ccc(Cl)cc1 ZINC000644645955 385053288 /nfs/dbraw/zinc/05/32/88/385053288.db2.gz QOZLEEAFDNLZEQ-MRVPVSSYSA-N 1 2 249.688 2.402 20 0 BEADLO CC(C)c1nc(N2CC[C@H](C)C2)cc[nH+]1 ZINC000334148342 385053981 /nfs/dbraw/zinc/05/39/81/385053981.db2.gz FZURGEFALORLNP-JTQLQIEISA-N 1 2 205.305 2.446 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1cc(C)ncn1 ZINC000644662822 385072719 /nfs/dbraw/zinc/07/27/19/385072719.db2.gz ONJOSROVSYPFFO-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1cc(C)ncn1 ZINC000644662822 385072723 /nfs/dbraw/zinc/07/27/23/385072723.db2.gz ONJOSROVSYPFFO-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO COC(=O)[C@H]1CCCC[N@@H+]1Cc1ccsc1 ZINC000131088846 385075751 /nfs/dbraw/zinc/07/57/51/385075751.db2.gz GPDVYXVSJYWXJW-LLVKDONJSA-N 1 2 239.340 2.276 20 0 BEADLO COC(=O)[C@H]1CCCC[N@H+]1Cc1ccsc1 ZINC000131088846 385075759 /nfs/dbraw/zinc/07/57/59/385075759.db2.gz GPDVYXVSJYWXJW-LLVKDONJSA-N 1 2 239.340 2.276 20 0 BEADLO C[C@@H](O)CC[N@H+](C)Cc1ncc(C(C)(C)C)o1 ZINC000075780586 385031210 /nfs/dbraw/zinc/03/12/10/385031210.db2.gz KYLZVIULMJHUEY-SNVBAGLBSA-N 1 2 240.347 2.175 20 0 BEADLO C[C@@H](O)CC[N@@H+](C)Cc1ncc(C(C)(C)C)o1 ZINC000075780586 385031221 /nfs/dbraw/zinc/03/12/21/385031221.db2.gz KYLZVIULMJHUEY-SNVBAGLBSA-N 1 2 240.347 2.175 20 0 BEADLO c1[nH+]c(S[C@@H]2CCOC2)n2ccccc12 ZINC000188256196 385032482 /nfs/dbraw/zinc/03/24/82/385032482.db2.gz ZMEKMMOJXSYIBI-SNVBAGLBSA-N 1 2 220.297 2.215 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2CCCOC2)c(C)[nH+]1 ZINC000176192770 385037917 /nfs/dbraw/zinc/03/79/17/385037917.db2.gz FIMXEDHJAPCMHB-NSHDSACASA-N 1 2 234.299 2.064 20 0 BEADLO Cc1ccc(NC(=O)CC2CCOCC2)c(C)[nH+]1 ZINC000176191806 385038306 /nfs/dbraw/zinc/03/83/06/385038306.db2.gz IUNDTMRYXIVRPL-UHFFFAOYSA-N 1 2 248.326 2.454 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000648265083 385039221 /nfs/dbraw/zinc/03/92/21/385039221.db2.gz ARZDNXTZKOVCFP-FRRDWIJNSA-N 1 2 247.342 2.093 20 0 BEADLO Nc1[nH+]cnc(NC2CCCCC2)c1Cl ZINC000236390306 385117462 /nfs/dbraw/zinc/11/74/62/385117462.db2.gz COJMTYGHKJIAGD-UHFFFAOYSA-N 1 2 226.711 2.457 20 0 BEADLO Nc1nc[nH+]c(NC2CCCCC2)c1Cl ZINC000236390306 385117466 /nfs/dbraw/zinc/11/74/66/385117466.db2.gz COJMTYGHKJIAGD-UHFFFAOYSA-N 1 2 226.711 2.457 20 0 BEADLO CC[C@H](C)C[N@H+](CC)Cc1noc(C)n1 ZINC000177854745 385128880 /nfs/dbraw/zinc/12/88/80/385128880.db2.gz IKBUTCYNLSHCCE-VIFPVBQESA-N 1 2 211.309 2.246 20 0 BEADLO CC[C@H](C)C[N@@H+](CC)Cc1noc(C)n1 ZINC000177854745 385128884 /nfs/dbraw/zinc/12/88/84/385128884.db2.gz IKBUTCYNLSHCCE-VIFPVBQESA-N 1 2 211.309 2.246 20 0 BEADLO Cc1cccc([S@](=O)Cc2[nH+]ccn2C)c1 ZINC000129287957 385133814 /nfs/dbraw/zinc/13/38/14/385133814.db2.gz XIMATOJRPOUXLP-INIZCTEOSA-N 1 2 234.324 2.036 20 0 BEADLO Cc1cnc([C@H](C)[NH2+]Cc2[nH]ncc2C)s1 ZINC000289669875 385140331 /nfs/dbraw/zinc/14/03/31/385140331.db2.gz ZMTGIQXFJZUVPW-VIFPVBQESA-N 1 2 236.344 2.334 20 0 BEADLO Cc1cnc([C@H](C)[NH2+]Cc2n[nH]cc2C)s1 ZINC000289669875 385140338 /nfs/dbraw/zinc/14/03/38/385140338.db2.gz ZMTGIQXFJZUVPW-VIFPVBQESA-N 1 2 236.344 2.334 20 0 BEADLO CC[C@H]1CN(c2cc(C)[nH+]c(C(C)C)n2)C[C@H]1O ZINC000340574598 385091713 /nfs/dbraw/zinc/09/17/13/385091713.db2.gz PCOSISAITVMFAO-NWDGAFQWSA-N 1 2 249.358 2.116 20 0 BEADLO C[C@@H](N[C@@H](C)c1[nH]cc[nH+]1)C(F)(F)F ZINC000287224297 385097832 /nfs/dbraw/zinc/09/78/32/385097832.db2.gz GGVMYBZYRBZHEJ-NTSWFWBYSA-N 1 2 207.199 2.011 20 0 BEADLO CC(C)c1nc(N(C)C2CCOCC2)cc[nH+]1 ZINC000530827727 385105845 /nfs/dbraw/zinc/10/58/45/385105845.db2.gz GKEJYQNHLKPATC-UHFFFAOYSA-N 1 2 235.331 2.215 20 0 BEADLO C[C@@H](C[N@H+](C)Cc1nnc[nH]1)c1ccccc1 ZINC000177140830 385189178 /nfs/dbraw/zinc/18/91/78/385189178.db2.gz GAUVHSWXQHSKEM-NSHDSACASA-N 1 2 230.315 2.040 20 0 BEADLO C[C@@H](C[N@@H+](C)Cc1nnc[nH]1)c1ccccc1 ZINC000177140830 385189182 /nfs/dbraw/zinc/18/91/82/385189182.db2.gz GAUVHSWXQHSKEM-NSHDSACASA-N 1 2 230.315 2.040 20 0 BEADLO Cc1noc(C[N@@H+](C)[C@H](C)c2cccc(O)c2)n1 ZINC000109781495 385190469 /nfs/dbraw/zinc/19/04/69/385190469.db2.gz QFQMHKXWNSTIRM-SECBINFHSA-N 1 2 247.298 2.277 20 0 BEADLO Cc1noc(C[N@H+](C)[C@H](C)c2cccc(O)c2)n1 ZINC000109781495 385190473 /nfs/dbraw/zinc/19/04/73/385190473.db2.gz QFQMHKXWNSTIRM-SECBINFHSA-N 1 2 247.298 2.277 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)Cc1ccccc1F ZINC000109831834 385194612 /nfs/dbraw/zinc/19/46/12/385194612.db2.gz DXMWOEHWWLPLCK-UHFFFAOYSA-N 1 2 219.263 2.181 20 0 BEADLO CCC[C@H]([NH2+][C@H](C)COC)C(=O)OC(C)(C)C ZINC000157486922 385195618 /nfs/dbraw/zinc/19/56/18/385195618.db2.gz HDMQWZMVZAZTSR-MNOVXSKESA-N 1 2 245.363 2.121 20 0 BEADLO CC[C@@H](C)CC(=O)NCc1ccn2cc[nH+]c2c1 ZINC000189443567 385154897 /nfs/dbraw/zinc/15/48/97/385154897.db2.gz RSMOCEJSEXEGLB-LLVKDONJSA-N 1 2 245.326 2.387 20 0 BEADLO CC[C@](C)([NH2+]Cc1cc[nH]n1)c1nccs1 ZINC000152656323 385200486 /nfs/dbraw/zinc/20/04/86/385200486.db2.gz MUINFWUISOWKPS-NSHDSACASA-N 1 2 236.344 2.281 20 0 BEADLO Cc1cnc(CNc2cc[nH+]c(C3CC3)n2)o1 ZINC000176944014 385160117 /nfs/dbraw/zinc/16/01/17/385160117.db2.gz LVKCVKONNDGVKI-UHFFFAOYSA-N 1 2 230.271 2.263 20 0 BEADLO COC[C@H](Nc1cc[nH+]c(C)n1)c1ccco1 ZINC000176965262 385160167 /nfs/dbraw/zinc/16/01/67/385160167.db2.gz DUTOGZAAWYSIHW-JTQLQIEISA-N 1 2 233.271 2.178 20 0 BEADLO CCN(CC)c1ccc(N[C@H]2CCOC2)c[nH+]1 ZINC000109430170 385162800 /nfs/dbraw/zinc/16/28/00/385162800.db2.gz DGNMFBIIIHYIRM-LBPRGKRZSA-N 1 2 235.331 2.129 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2cncc(C)c2)CCO1 ZINC000189975144 385201178 /nfs/dbraw/zinc/20/11/78/385201178.db2.gz WOYASKXGBRKERK-CQSZACIVSA-N 1 2 234.343 2.391 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2cncc(C)c2)CCO1 ZINC000189975144 385201184 /nfs/dbraw/zinc/20/11/84/385201184.db2.gz WOYASKXGBRKERK-CQSZACIVSA-N 1 2 234.343 2.391 20 0 BEADLO CN(C[C@H]1CC=CCC1)c1cc(CO)cc[nH+]1 ZINC000402719943 385177205 /nfs/dbraw/zinc/17/72/05/385177205.db2.gz XNYLDNDNORBITM-LBPRGKRZSA-N 1 2 232.327 2.366 20 0 BEADLO C=C/C(C)=C\CC(=O)NCc1c[nH+]ccc1OC ZINC000647068888 385216043 /nfs/dbraw/zinc/21/60/43/385216043.db2.gz DHPXVLMMOYTNFT-WZUFQYTHSA-N 1 2 246.310 2.229 20 0 BEADLO CCc1nnc(C[N@H+]2CC[C@@H]2CC)s1 ZINC000644786391 385218959 /nfs/dbraw/zinc/21/89/59/385218959.db2.gz IRVSYSZAXVTYRV-QMMMGPOBSA-N 1 2 211.334 2.085 20 0 BEADLO CCc1nnc(C[N@@H+]2CC[C@@H]2CC)s1 ZINC000644786391 385218966 /nfs/dbraw/zinc/21/89/66/385218966.db2.gz IRVSYSZAXVTYRV-QMMMGPOBSA-N 1 2 211.334 2.085 20 0 BEADLO CC[N@H+](CCOC)Cc1csc(Cl)n1 ZINC000294789935 385219777 /nfs/dbraw/zinc/21/97/77/385219777.db2.gz BFTFCPJEDVNPDO-UHFFFAOYSA-N 1 2 234.752 2.265 20 0 BEADLO CC[N@@H+](CCOC)Cc1csc(Cl)n1 ZINC000294789935 385219780 /nfs/dbraw/zinc/21/97/80/385219780.db2.gz BFTFCPJEDVNPDO-UHFFFAOYSA-N 1 2 234.752 2.265 20 0 BEADLO CC[C@H](SC)C(=O)Nc1cc[nH+]cc1C ZINC000130128368 385222888 /nfs/dbraw/zinc/22/28/88/385222888.db2.gz WPPBPUBNBOEYFG-JTQLQIEISA-N 1 2 224.329 2.470 20 0 BEADLO Cc1nnc(Cn2c[nH+]c3cc(C)c(C)cc32)o1 ZINC000130224141 385231672 /nfs/dbraw/zinc/23/16/72/385231672.db2.gz SALCNUBDEMMOOI-UHFFFAOYSA-N 1 2 242.282 2.393 20 0 BEADLO Cc1nc(C[N@@H+](C)Cc2ccncc2)cs1 ZINC000130296409 385236852 /nfs/dbraw/zinc/23/68/52/385236852.db2.gz BNQJJGXAOPEQPZ-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1nc(C[N@H+](C)Cc2ccncc2)cs1 ZINC000130296409 385236854 /nfs/dbraw/zinc/23/68/54/385236854.db2.gz BNQJJGXAOPEQPZ-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CC[C@@H]([NH2+]Cc1c[nH]nn1)c1cccs1 ZINC000398347167 385255858 /nfs/dbraw/zinc/25/58/58/385255858.db2.gz QCHRRAQBTZYTPF-SECBINFHSA-N 1 2 222.317 2.107 20 0 BEADLO CC[C@@H]([NH2+]Cc1cn[nH]n1)c1cccs1 ZINC000398347167 385255867 /nfs/dbraw/zinc/25/58/67/385255867.db2.gz QCHRRAQBTZYTPF-SECBINFHSA-N 1 2 222.317 2.107 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C[N@H+]1CC(=O)N(C2CC2)C1 ZINC000448283065 385303023 /nfs/dbraw/zinc/30/30/23/385303023.db2.gz WXGQMLWNZYPMDD-VXGBXAGGSA-N 1 2 236.359 2.077 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C[N@@H+]1CC(=O)N(C2CC2)C1 ZINC000448283065 385303026 /nfs/dbraw/zinc/30/30/26/385303026.db2.gz WXGQMLWNZYPMDD-VXGBXAGGSA-N 1 2 236.359 2.077 20 0 BEADLO CSC1(CNc2cc[nH+]c(C)n2)CC1 ZINC000227990266 385304220 /nfs/dbraw/zinc/30/42/20/385304220.db2.gz YWWWNRUEUSSMIP-UHFFFAOYSA-N 1 2 209.318 2.093 20 0 BEADLO C[N@H+](Cc1nc(C2CCCC2)no1)C1CC1 ZINC000178594339 385305231 /nfs/dbraw/zinc/30/52/31/385305231.db2.gz GWTVDIKESXGWGE-UHFFFAOYSA-N 1 2 221.304 2.321 20 0 BEADLO C[N@@H+](Cc1nc(C2CCCC2)no1)C1CC1 ZINC000178594339 385305236 /nfs/dbraw/zinc/30/52/36/385305236.db2.gz GWTVDIKESXGWGE-UHFFFAOYSA-N 1 2 221.304 2.321 20 0 BEADLO COc1nccc(C[N@H+](C)Cc2ccsc2)n1 ZINC000648350888 385306183 /nfs/dbraw/zinc/30/61/83/385306183.db2.gz AEYNRIBKYUTLKB-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1nccc(C[N@@H+](C)Cc2ccsc2)n1 ZINC000648350888 385306185 /nfs/dbraw/zinc/30/61/85/385306185.db2.gz AEYNRIBKYUTLKB-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COC(=O)[C@H](C)[NH2+]C(C)(C)c1cccs1 ZINC000308950233 385311974 /nfs/dbraw/zinc/31/19/74/385311974.db2.gz OWXLABSYQANEPO-QMMMGPOBSA-N 1 2 227.329 2.134 20 0 BEADLO CC(C)c1nnc(C[N@H+](C)[C@@H]2CCSC2)o1 ZINC000119960845 385312404 /nfs/dbraw/zinc/31/24/04/385312404.db2.gz IIRNKXMBNKKZOY-SECBINFHSA-N 1 2 241.360 2.130 20 0 BEADLO CC(C)c1nnc(C[N@@H+](C)[C@@H]2CCSC2)o1 ZINC000119960845 385312411 /nfs/dbraw/zinc/31/24/11/385312411.db2.gz IIRNKXMBNKKZOY-SECBINFHSA-N 1 2 241.360 2.130 20 0 BEADLO CCC[C@H]([NH2+]CC=C(C)C)C(=O)OCC ZINC000190720986 385258513 /nfs/dbraw/zinc/25/85/13/385258513.db2.gz FLUIUXGDQXPVNK-NSHDSACASA-N 1 2 213.321 2.274 20 0 BEADLO CC[C@H](NC(=O)CCC1CC1)c1[nH]cc[nH+]1 ZINC000331475684 385259660 /nfs/dbraw/zinc/25/96/60/385259660.db2.gz NCCJJRPWSGJPIC-JTQLQIEISA-N 1 2 221.304 2.167 20 0 BEADLO CC[C@]1(C)C[N@H+](Cc2cncs2)CCO1 ZINC000191144442 385287433 /nfs/dbraw/zinc/28/74/33/385287433.db2.gz IUZMORFDILZVKA-LLVKDONJSA-N 1 2 226.345 2.144 20 0 BEADLO CC[C@]1(C)C[N@@H+](Cc2cncs2)CCO1 ZINC000191144442 385287438 /nfs/dbraw/zinc/28/74/38/385287438.db2.gz IUZMORFDILZVKA-LLVKDONJSA-N 1 2 226.345 2.144 20 0 BEADLO CC[C@@]1(C)C[N@H+](Cc2cncs2)CCO1 ZINC000191144454 385287854 /nfs/dbraw/zinc/28/78/54/385287854.db2.gz IUZMORFDILZVKA-NSHDSACASA-N 1 2 226.345 2.144 20 0 BEADLO CC[C@@]1(C)C[N@@H+](Cc2cncs2)CCO1 ZINC000191144454 385287860 /nfs/dbraw/zinc/28/78/60/385287860.db2.gz IUZMORFDILZVKA-NSHDSACASA-N 1 2 226.345 2.144 20 0 BEADLO c1ccc(NCCC2CCOCC2)[nH+]c1 ZINC000308943894 385298764 /nfs/dbraw/zinc/29/87/64/385298764.db2.gz FQUKCACVARELJY-UHFFFAOYSA-N 1 2 206.289 2.310 20 0 BEADLO CC[C@@H](C)CC(=O)NCCCNc1cccc[nH+]1 ZINC000191913612 385331175 /nfs/dbraw/zinc/33/11/75/385331175.db2.gz CPMCDTKHDMTIMY-GFCCVEGCSA-N 1 2 249.358 2.436 20 0 BEADLO C[C@H]1C[C@H]1c1ccc(C[NH+]2CCOCC2)o1 ZINC000154508696 385332366 /nfs/dbraw/zinc/33/23/66/385332366.db2.gz SXUPWQQWIVCMKT-CMPLNLGQSA-N 1 2 221.300 2.235 20 0 BEADLO Cc1nnsc1C[NH2+][C@H](C)c1nccs1 ZINC000308991352 385333567 /nfs/dbraw/zinc/33/35/67/385333567.db2.gz NZYSIHOWVIFJHX-SSDOTTSWSA-N 1 2 240.357 2.154 20 0 BEADLO FC(F)(F)[C@H]1CCC[N@H+](Cc2cocn2)C1 ZINC000191921052 385334717 /nfs/dbraw/zinc/33/47/17/385334717.db2.gz IKKHTPRKSABORZ-QMMMGPOBSA-N 1 2 234.221 2.449 20 0 BEADLO FC(F)(F)[C@H]1CCC[N@@H+](Cc2cocn2)C1 ZINC000191921052 385334723 /nfs/dbraw/zinc/33/47/23/385334723.db2.gz IKKHTPRKSABORZ-QMMMGPOBSA-N 1 2 234.221 2.449 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C1[C@@H]2CCC[C@H]12 ZINC000178216478 385345628 /nfs/dbraw/zinc/34/56/28/385345628.db2.gz XTCGYTZUGPGOIX-DHHPTOIESA-N 1 2 216.284 2.375 20 0 BEADLO COc1ccc(CNc2ccc[nH+]c2C)cn1 ZINC000158123811 385349117 /nfs/dbraw/zinc/34/91/17/385349117.db2.gz PGCCIXRUHUSMDX-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)C[C@H]1C=CCC1 ZINC000154800206 385354902 /nfs/dbraw/zinc/35/49/02/385354902.db2.gz MFEGXIWTGATEFH-ZDUSSCGKSA-N 1 2 247.342 2.088 20 0 BEADLO CC[C@@H](C)OCC(=O)Nc1cc[nH+]c(C)c1 ZINC000131733318 385357655 /nfs/dbraw/zinc/35/76/55/385357655.db2.gz BBFMPRPYOBREHB-SNVBAGLBSA-N 1 2 222.288 2.144 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)CC1CCCC1 ZINC000154904551 385365185 /nfs/dbraw/zinc/36/51/85/385365185.db2.gz ZNHNDGYGCLIIFO-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO CC(C)[C@H](NCc1[nH]cc[nH+]1)C(F)(F)F ZINC000309022298 385365220 /nfs/dbraw/zinc/36/52/20/385365220.db2.gz XXEQDRUJGUCUMA-QMMMGPOBSA-N 1 2 221.226 2.086 20 0 BEADLO CC[C@H]([NH2+][C@@H](C)[C@@H]1CCOC1)C(F)(F)F ZINC000309026342 385368673 /nfs/dbraw/zinc/36/86/73/385368673.db2.gz ATPHGFRAVARJAG-YIZRAAEISA-N 1 2 225.254 2.342 20 0 BEADLO C[C@@H](O)C[N@@H+]1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000192756317 385369128 /nfs/dbraw/zinc/36/91/28/385369128.db2.gz VPJUGPWUQPCJSZ-SECBINFHSA-N 1 2 248.301 2.046 20 0 BEADLO C[C@@H](O)C[N@H+]1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000192756317 385369137 /nfs/dbraw/zinc/36/91/37/385369137.db2.gz VPJUGPWUQPCJSZ-SECBINFHSA-N 1 2 248.301 2.046 20 0 BEADLO CC[C@H]([NH2+]CC1(c2ccccc2)CC1)C(=O)OC ZINC000192830213 385373001 /nfs/dbraw/zinc/37/30/01/385373001.db2.gz OBCRIZDUQOEISE-ZDUSSCGKSA-N 1 2 247.338 2.259 20 0 BEADLO CCSCC[NH2+]C(CC)(CC)C(=O)OC ZINC000309037569 385375732 /nfs/dbraw/zinc/37/57/32/385375732.db2.gz JBUUJRRBPNBVIL-UHFFFAOYSA-N 1 2 233.377 2.061 20 0 BEADLO CC[C@H]([NH2+]CC[C@H]1CCOC1)C(F)(F)F ZINC000309035923 385381876 /nfs/dbraw/zinc/38/18/76/385381876.db2.gz IBWAIGSHPQHBDA-IUCAKERBSA-N 1 2 225.254 2.344 20 0 BEADLO Cc1c[nH+]cc(N[C@@H]2CCO[C@H](C)C2)c1 ZINC000225853068 385383784 /nfs/dbraw/zinc/38/37/84/385383784.db2.gz LNBHGBBUENJJBE-GHMZBOCLSA-N 1 2 206.289 2.369 20 0 BEADLO Cc1c[nH+]cc(N[C@H]2CCO[C@H](C)C2)c1 ZINC000225853080 385384020 /nfs/dbraw/zinc/38/40/20/385384020.db2.gz LNBHGBBUENJJBE-MNOVXSKESA-N 1 2 206.289 2.369 20 0 BEADLO CC[C@@H](Cc1ccc(C)cc1)[NH2+][C@H](C)C(=O)OC ZINC000193097913 385384804 /nfs/dbraw/zinc/38/48/04/385384804.db2.gz UZRQTGSJAUPMRA-OCCSQVGLSA-N 1 2 249.354 2.467 20 0 BEADLO COC(=O)[C@@H](C)[NH2+]C/C(C)=C/c1ccccc1 ZINC000193100366 385384942 /nfs/dbraw/zinc/38/49/42/385384942.db2.gz VLELLKMPGBILOX-LMMOQWNQSA-N 1 2 233.311 2.241 20 0 BEADLO c1[nH]nnc1C[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000295025467 385385519 /nfs/dbraw/zinc/38/55/19/385385519.db2.gz RCJHNSLTKTUJKK-ZDUSSCGKSA-N 1 2 228.299 2.046 20 0 BEADLO c1n[nH]nc1C[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000295025467 385385526 /nfs/dbraw/zinc/38/55/26/385385526.db2.gz RCJHNSLTKTUJKK-ZDUSSCGKSA-N 1 2 228.299 2.046 20 0 BEADLO c1[nH]nnc1C[NH2+][C@H](c1ccccc1)C1CC1 ZINC000295025465 385386796 /nfs/dbraw/zinc/38/67/96/385386796.db2.gz RCJHNSLTKTUJKK-CYBMUJFWSA-N 1 2 228.299 2.046 20 0 BEADLO c1n[nH]nc1C[NH2+][C@H](c1ccccc1)C1CC1 ZINC000295025465 385386799 /nfs/dbraw/zinc/38/67/99/385386799.db2.gz RCJHNSLTKTUJKK-CYBMUJFWSA-N 1 2 228.299 2.046 20 0 BEADLO CC[C@H]1CCC[C@H](NC(=O)CCc2c[nH+]c[nH]2)C1 ZINC000193329432 385392892 /nfs/dbraw/zinc/39/28/92/385392892.db2.gz QOOTWIFGZBGBHM-RYUDHWBXSA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@H]1CCC[C@H](NC(=O)CCc2c[nH]c[nH+]2)C1 ZINC000193329432 385392896 /nfs/dbraw/zinc/39/28/96/385392896.db2.gz QOOTWIFGZBGBHM-RYUDHWBXSA-N 1 2 249.358 2.427 20 0 BEADLO CC(C)=CC[N@@H+](C)CC(=O)OC(C)(C)C ZINC000170646052 385438845 /nfs/dbraw/zinc/43/88/45/385438845.db2.gz SEOAZYVHUKARRK-UHFFFAOYSA-N 1 2 213.321 2.226 20 0 BEADLO CC(C)=CC[N@H+](C)CC(=O)OC(C)(C)C ZINC000170646052 385438848 /nfs/dbraw/zinc/43/88/48/385438848.db2.gz SEOAZYVHUKARRK-UHFFFAOYSA-N 1 2 213.321 2.226 20 0 BEADLO Cc1cc[nH+]c(NCC2(O)CCC2)c1Cl ZINC000309167812 385446138 /nfs/dbraw/zinc/44/61/38/385446138.db2.gz JUCCNXSGVPFJLA-UHFFFAOYSA-N 1 2 226.707 2.370 20 0 BEADLO C[C@@H](Nc1cccc[nH+]1)[C@@H]1CCCOC1 ZINC000309125810 385428837 /nfs/dbraw/zinc/42/88/37/385428837.db2.gz PMWXGZMNNKQNJJ-GHMZBOCLSA-N 1 2 206.289 2.309 20 0 BEADLO C[C@@H](NC(=O)C=Cc1c[nH]c[nH+]1)c1ccccc1 ZINC000492767151 385429392 /nfs/dbraw/zinc/42/93/92/385429392.db2.gz NLRDQPWBXISNQK-SKVAFPRGSA-N 1 2 241.294 2.300 20 0 BEADLO C=Cn1cc(CNc2ccc(C)[nH+]c2)cn1 ZINC000194354945 385430912 /nfs/dbraw/zinc/43/09/12/385430912.db2.gz KKEMJVPGAHXEHK-UHFFFAOYSA-N 1 2 214.272 2.299 20 0 BEADLO CCc1nocc1C[NH2+]Cc1csc(C)n1 ZINC000378706543 385473407 /nfs/dbraw/zinc/47/34/07/385473407.db2.gz QBZHJLPLCPVKHT-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO O=C(CCCC1CC1)NCCCCn1cc[nH+]c1 ZINC000643164659 385474917 /nfs/dbraw/zinc/47/49/17/385474917.db2.gz HFABPTVCZGYDQZ-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO CC[C@@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492896425 385459883 /nfs/dbraw/zinc/45/98/83/385459883.db2.gz JCXKRIUKNNIWRQ-ISALQUGTSA-N 1 2 233.315 2.072 20 0 BEADLO COC[C@@H](C)[N@H+](C)Cc1c(F)cccc1F ZINC000179373367 385462998 /nfs/dbraw/zinc/46/29/98/385462998.db2.gz XIJNWIHUPUKVMT-SECBINFHSA-N 1 2 229.270 2.432 20 0 BEADLO COC[C@@H](C)[N@@H+](C)Cc1c(F)cccc1F ZINC000179373367 385463001 /nfs/dbraw/zinc/46/30/01/385463001.db2.gz XIJNWIHUPUKVMT-SECBINFHSA-N 1 2 229.270 2.432 20 0 BEADLO Cc1ccc(C(=O)Nc2cc[nH+]cc2O)cc1F ZINC000109891128 385490920 /nfs/dbraw/zinc/49/09/20/385490920.db2.gz WSTCGTYEWMKHFH-UHFFFAOYSA-N 1 2 246.241 2.487 20 0 BEADLO Cc1cc[nH+]c(NC[C@H](O)C2CC2)c1Cl ZINC000309229646 385491622 /nfs/dbraw/zinc/49/16/22/385491622.db2.gz WNQQJQLQTGUILG-VIFPVBQESA-N 1 2 226.707 2.226 20 0 BEADLO CC(C)N(C(=O)/C=C\c1[nH]cc[nH+]1)C1CCC1 ZINC000493070618 385512202 /nfs/dbraw/zinc/51/22/02/385512202.db2.gz LZLPHEJGNIENJK-SREVYHEPSA-N 1 2 233.315 2.212 20 0 BEADLO CCC[N@H+](CCC(=O)OC(C)C)CC(F)F ZINC000157870546 385529847 /nfs/dbraw/zinc/52/98/47/385529847.db2.gz RRLWEWNUTJYRAF-UHFFFAOYSA-N 1 2 237.290 2.305 20 0 BEADLO CCC[N@@H+](CCC(=O)OC(C)C)CC(F)F ZINC000157870546 385529850 /nfs/dbraw/zinc/52/98/50/385529850.db2.gz RRLWEWNUTJYRAF-UHFFFAOYSA-N 1 2 237.290 2.305 20 0 BEADLO CC[N@H+](CC(F)F)C[C@@H]1CCSC1 ZINC000308215324 385535577 /nfs/dbraw/zinc/53/55/77/385535577.db2.gz JBGXEDUIAJBLPF-QMMMGPOBSA-N 1 2 209.305 2.327 20 0 BEADLO CC[N@@H+](CC(F)F)C[C@@H]1CCSC1 ZINC000308215324 385535581 /nfs/dbraw/zinc/53/55/81/385535581.db2.gz JBGXEDUIAJBLPF-QMMMGPOBSA-N 1 2 209.305 2.327 20 0 BEADLO COC[C@H](C)CNc1cc(C)[nH+]c(C2CC2)n1 ZINC000172014701 385540951 /nfs/dbraw/zinc/54/09/51/385540951.db2.gz VEPKXSRAUYPMAM-SECBINFHSA-N 1 2 235.331 2.357 20 0 BEADLO CCc1c[nH]c(SCCCn2cc[nH+]c2)n1 ZINC000180438479 385523622 /nfs/dbraw/zinc/52/36/22/385523622.db2.gz BVLGXSNDYOAZQL-UHFFFAOYSA-N 1 2 236.344 2.351 20 0 BEADLO C[C@H]1CC(C)(C)CN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493195487 385553713 /nfs/dbraw/zinc/55/37/13/385553713.db2.gz IISCPMCBOXMPQI-LWTINBJPSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@@H]1CC(C)(C)CN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493195488 385554354 /nfs/dbraw/zinc/55/43/54/385554354.db2.gz IISCPMCBOXMPQI-ORAHPGNNSA-N 1 2 233.315 2.070 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)COc1ccccc1 ZINC000107294626 385560857 /nfs/dbraw/zinc/56/08/57/385560857.db2.gz ZTAYCWKWHVPPSB-UHFFFAOYSA-N 1 2 242.278 2.408 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1cccc(C)c1C ZINC000280752716 385600996 /nfs/dbraw/zinc/60/09/96/385600996.db2.gz DVUVPTNAZYNQGN-GFCCVEGCSA-N 1 2 235.327 2.297 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1cccc(C)c1C ZINC000280752716 385600999 /nfs/dbraw/zinc/60/09/99/385600999.db2.gz DVUVPTNAZYNQGN-GFCCVEGCSA-N 1 2 235.327 2.297 20 0 BEADLO COc1cc(C)[nH+]c(CNC2(C(F)F)CC2)c1 ZINC000337306987 385592963 /nfs/dbraw/zinc/59/29/63/385592963.db2.gz SAROENBGWQKJRM-UHFFFAOYSA-N 1 2 242.269 2.286 20 0 BEADLO Cc1cscc1NC(=O)CCn1cc[nH+]c1 ZINC000269631106 385615420 /nfs/dbraw/zinc/61/54/20/385615420.db2.gz VSXWFFGAUFBMOM-UHFFFAOYSA-N 1 2 235.312 2.282 20 0 BEADLO COC[C@@H](C)Nc1c[nH+]c2c(c1)CCCC2 ZINC000309490594 385619299 /nfs/dbraw/zinc/61/92/99/385619299.db2.gz XAWDYWKPEDGSNT-SNVBAGLBSA-N 1 2 220.316 2.407 20 0 BEADLO COC[C@H](C)Nc1c[nH+]c2c(c1)CCCC2 ZINC000309490592 385619837 /nfs/dbraw/zinc/61/98/37/385619837.db2.gz XAWDYWKPEDGSNT-JTQLQIEISA-N 1 2 220.316 2.407 20 0 BEADLO CCCC[NH2+][C@@H](Cc1ccc(C)cc1)C(=O)OC ZINC000281039804 385630153 /nfs/dbraw/zinc/63/01/53/385630153.db2.gz RDFJTSZYUPNIHB-AWEZNQCLSA-N 1 2 249.354 2.469 20 0 BEADLO C[C@@H]1CN(c2[nH+]ccc3cc(F)ccc32)C[C@H]1O ZINC000645203955 385638547 /nfs/dbraw/zinc/63/85/47/385638547.db2.gz HCGFGXDBLHOGLI-NOZJJQNGSA-N 1 2 246.285 2.191 20 0 BEADLO CC(C)c1nc(N[C@@H]2CCO[C@@H](C)C2)cc[nH+]1 ZINC000354709658 385640009 /nfs/dbraw/zinc/64/00/09/385640009.db2.gz FUJBGCXTWUMLTG-WDEREUQCSA-N 1 2 235.331 2.001 20 0 BEADLO c1csc(C[N@@H+]2CCOC[C@H]2C2CCC2)n1 ZINC000335445252 385642341 /nfs/dbraw/zinc/64/23/41/385642341.db2.gz BBXBQPJAZMZUBF-NSHDSACASA-N 1 2 238.356 2.144 20 0 BEADLO c1csc(C[N@H+]2CCOC[C@H]2C2CCC2)n1 ZINC000335445252 385642348 /nfs/dbraw/zinc/64/23/48/385642348.db2.gz BBXBQPJAZMZUBF-NSHDSACASA-N 1 2 238.356 2.144 20 0 BEADLO CCc1cccc(F)c1C[NH2+]Cc1ccn(C)n1 ZINC000354564441 385665270 /nfs/dbraw/zinc/66/52/70/385665270.db2.gz GEIOXVOKTTXEFE-UHFFFAOYSA-N 1 2 247.317 2.411 20 0 BEADLO Cn1nccc1[C@@H]1CCCC[N@@H+]1Cc1ccno1 ZINC000281236867 385646353 /nfs/dbraw/zinc/64/63/53/385646353.db2.gz CTFSYMQANFVGCX-ZDUSSCGKSA-N 1 2 246.314 2.135 20 0 BEADLO Cn1nccc1[C@@H]1CCCC[N@H+]1Cc1ccno1 ZINC000281236867 385646357 /nfs/dbraw/zinc/64/63/57/385646357.db2.gz CTFSYMQANFVGCX-ZDUSSCGKSA-N 1 2 246.314 2.135 20 0 BEADLO CO[C@H](C)C[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000182230382 385646926 /nfs/dbraw/zinc/64/69/26/385646926.db2.gz NSUZWRLHICRHAT-PWSUYJOCSA-N 1 2 241.356 2.156 20 0 BEADLO CO[C@H](C)C[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000182230382 385646929 /nfs/dbraw/zinc/64/69/29/385646929.db2.gz NSUZWRLHICRHAT-PWSUYJOCSA-N 1 2 241.356 2.156 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)[C@@H]1CCCC(C)(C)C1 ZINC000270072192 385665454 /nfs/dbraw/zinc/66/54/54/385665454.db2.gz SBWGKLBJWKJCGV-LLVKDONJSA-N 1 2 249.358 2.253 20 0 BEADLO CCCCCNC(=O)C[N@@H+]1CCC[C@](C)(F)C1 ZINC000451122423 385659746 /nfs/dbraw/zinc/65/97/46/385659746.db2.gz RIIINDQQPDWGBA-ZDUSSCGKSA-N 1 2 244.354 2.117 20 0 BEADLO CCCCCNC(=O)C[N@H+]1CCC[C@](C)(F)C1 ZINC000451122423 385659750 /nfs/dbraw/zinc/65/97/50/385659750.db2.gz RIIINDQQPDWGBA-ZDUSSCGKSA-N 1 2 244.354 2.117 20 0 BEADLO Cc1[nH]c(C(=O)NC2(C)CCCCC2)c[nH+]1 ZINC000270077901 385663812 /nfs/dbraw/zinc/66/38/12/385663812.db2.gz KTZKIGQDZSBEOY-UHFFFAOYSA-N 1 2 221.304 2.171 20 0 BEADLO FC(F)C1(NCc2[nH]cc[nH+]2)CCCCC1 ZINC000309546240 385679903 /nfs/dbraw/zinc/67/99/03/385679903.db2.gz DLXNNHSGZQGEIR-UHFFFAOYSA-N 1 2 229.274 2.467 20 0 BEADLO Cc1[nH]c2nc[nH+]c(S[C@@H]3CCOC3)c2c1C ZINC000645224105 385689651 /nfs/dbraw/zinc/68/96/51/385689651.db2.gz UTSNFYFTFMCTCW-SECBINFHSA-N 1 2 249.339 2.456 20 0 BEADLO C[C@H](Nc1cc[nH+]c(C2CC2)n1)c1cn[nH]c1 ZINC000270272399 385691363 /nfs/dbraw/zinc/69/13/63/385691363.db2.gz WTWDMLWLGZKDJG-QMMMGPOBSA-N 1 2 229.287 2.250 20 0 BEADLO Fc1ccc2c(c1)N(CCCn1cc[nH+]c1)CC2 ZINC000182883555 385716184 /nfs/dbraw/zinc/71/61/84/385716184.db2.gz XFKGNLAWRXTXNI-UHFFFAOYSA-N 1 2 245.301 2.475 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)CCCC1CC1 ZINC000643201599 385670393 /nfs/dbraw/zinc/67/03/93/385670393.db2.gz RYQOLSGKDPVHAU-UHFFFAOYSA-N 1 2 218.300 2.331 20 0 BEADLO CCC[C@H](CCO)CNc1cccc[nH+]1 ZINC000231151233 385786403 /nfs/dbraw/zinc/78/64/03/385786403.db2.gz SUWCTXUGYARCMY-LLVKDONJSA-N 1 2 208.305 2.292 20 0 BEADLO CC[C@@H](C)N(OC)C(=O)c1ccc2[nH+]ccn2c1 ZINC000270880501 385754939 /nfs/dbraw/zinc/75/49/39/385754939.db2.gz OSLITUYHOPYIJZ-SNVBAGLBSA-N 1 2 247.298 2.136 20 0 BEADLO CC(C)CCCNc1ccc(N(C)C)c[nH+]1 ZINC000336655506 385758553 /nfs/dbraw/zinc/75/85/53/385758553.db2.gz HMMAFOUTDZRRHB-UHFFFAOYSA-N 1 2 221.348 2.418 20 0 BEADLO CC[C@H]([NH2+]Cc1cscn1)c1ccn(C)n1 ZINC000336737310 385759349 /nfs/dbraw/zinc/75/93/49/385759349.db2.gz NHECMWULILKLRB-JTQLQIEISA-N 1 2 236.344 2.118 20 0 BEADLO FCCCCSCCn1cc[nH+]c1 ZINC000336655794 385765722 /nfs/dbraw/zinc/76/57/22/385765722.db2.gz PPFMMMZZQZVZEV-UHFFFAOYSA-N 1 2 202.298 2.366 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1ncnn1C(C)(C)C ZINC000282537490 385770759 /nfs/dbraw/zinc/77/07/59/385770759.db2.gz BVLHRNHDCJHQNX-UHFFFAOYSA-N 1 2 248.330 2.224 20 0 BEADLO CC(C)(C)C(C)(C)C(=O)NCc1c[nH+]c[nH]1 ZINC000309653830 385772452 /nfs/dbraw/zinc/77/24/52/385772452.db2.gz UVASQRCJXDPNMJ-UHFFFAOYSA-N 1 2 223.320 2.098 20 0 BEADLO CC(C)(C)C(C)(C)C(=O)NCc1c[nH]c[nH+]1 ZINC000309653830 385772454 /nfs/dbraw/zinc/77/24/54/385772454.db2.gz UVASQRCJXDPNMJ-UHFFFAOYSA-N 1 2 223.320 2.098 20 0 BEADLO Cc1ccc(F)c(C[N@@H+]2CCO[C@@H](C)C2)c1 ZINC000271026100 385773102 /nfs/dbraw/zinc/77/31/02/385773102.db2.gz DODIZRBYHCVSRN-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ccc(F)c(C[N@H+]2CCO[C@@H](C)C2)c1 ZINC000271026100 385773105 /nfs/dbraw/zinc/77/31/05/385773105.db2.gz DODIZRBYHCVSRN-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC[C@H]1C[C@H]1C ZINC000271108238 385787999 /nfs/dbraw/zinc/78/79/99/385787999.db2.gz FOVQSGBZWBQWHJ-PSASIEDQSA-N 1 2 219.288 2.168 20 0 BEADLO CO[C@@H]1CCCN(c2[nH+]c3ccccc3n2C)C1 ZINC000270600289 385722175 /nfs/dbraw/zinc/72/21/75/385722175.db2.gz VTFZYWUTHPGZMD-LLVKDONJSA-N 1 2 245.326 2.189 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2O[C@H](C)C[C@@H]2C)c(C)[nH+]1 ZINC000282023036 385723855 /nfs/dbraw/zinc/72/38/55/385723855.db2.gz WBHLSUHRJMHEEI-IYYTYJHQSA-N 1 2 248.326 2.450 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2O[C@@H](C)C[C@@H]2C)c(C)[nH+]1 ZINC000282023034 385724233 /nfs/dbraw/zinc/72/42/33/385724233.db2.gz WBHLSUHRJMHEEI-GMOODISLSA-N 1 2 248.326 2.450 20 0 BEADLO COC[C@@H]1CCN(c2[nH+]c3ccccc3n2C)C1 ZINC000270617539 385724808 /nfs/dbraw/zinc/72/48/08/385724808.db2.gz ZVDQKQJMFPVSLH-LLVKDONJSA-N 1 2 245.326 2.046 20 0 BEADLO CC(C)c1nnc([C@@H](C)[NH2+]Cc2ccco2)[nH]1 ZINC000270635134 385725675 /nfs/dbraw/zinc/72/56/75/385725675.db2.gz GUQDYOJUXFRJHP-SECBINFHSA-N 1 2 234.303 2.372 20 0 BEADLO CCn1ncnc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000488453314 385800269 /nfs/dbraw/zinc/80/02/69/385800269.db2.gz ZDMPDMOVFNFTHA-ZDUSSCGKSA-N 1 2 242.326 2.245 20 0 BEADLO CCn1ncnc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000488453314 385800276 /nfs/dbraw/zinc/80/02/76/385800276.db2.gz ZDMPDMOVFNFTHA-ZDUSSCGKSA-N 1 2 242.326 2.245 20 0 BEADLO CSc1ccc(C[NH2+]CC(F)(F)CO)cc1 ZINC000183868655 385801519 /nfs/dbraw/zinc/80/15/19/385801519.db2.gz RWRALLROFTVANQ-UHFFFAOYSA-N 1 2 247.310 2.126 20 0 BEADLO CC(C)[C@H]([NH2+]Cc1c[nH]nn1)c1ccccc1 ZINC000283899327 385802292 /nfs/dbraw/zinc/80/22/92/385802292.db2.gz FMPDGERAGOENOZ-ZDUSSCGKSA-N 1 2 230.315 2.292 20 0 BEADLO CC(C)[C@H]([NH2+]Cc1cn[nH]n1)c1ccccc1 ZINC000283899327 385802301 /nfs/dbraw/zinc/80/23/01/385802301.db2.gz FMPDGERAGOENOZ-ZDUSSCGKSA-N 1 2 230.315 2.292 20 0 BEADLO C[C@@H]([NH2+]Cc1cnn[nH]1)c1ccccc1Cl ZINC000283978840 385814090 /nfs/dbraw/zinc/81/40/90/385814090.db2.gz MGZJWBPAMTWNMK-MRVPVSSYSA-N 1 2 236.706 2.309 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@H]1CCO[C@@H](C)C1 ZINC000271417426 385824946 /nfs/dbraw/zinc/82/49/46/385824946.db2.gz OLDJZMKWGJFESK-QWRGUYRKSA-N 1 2 249.314 2.079 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@H]1CCO[C@H](C)C1 ZINC000271417424 385825059 /nfs/dbraw/zinc/82/50/59/385825059.db2.gz OLDJZMKWGJFESK-MNOVXSKESA-N 1 2 249.314 2.079 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@H]1CCO[C@@H](C)C1 ZINC000271417428 385826337 /nfs/dbraw/zinc/82/63/37/385826337.db2.gz OLDJZMKWGJFESK-WDEREUQCSA-N 1 2 249.314 2.079 20 0 BEADLO C[C@@H]([NH2+]Cc1c[nH]nn1)C(C)(C)c1ccccc1 ZINC000284210646 385857808 /nfs/dbraw/zinc/85/78/08/385857808.db2.gz ZEYMCMSUZNLTJM-LLVKDONJSA-N 1 2 244.342 2.261 20 0 BEADLO C[C@@H]([NH2+]Cc1cn[nH]n1)C(C)(C)c1ccccc1 ZINC000284210646 385857810 /nfs/dbraw/zinc/85/78/10/385857810.db2.gz ZEYMCMSUZNLTJM-LLVKDONJSA-N 1 2 244.342 2.261 20 0 BEADLO Cc1cc(C[N@H+](C)CCc2cscn2)no1 ZINC000283855361 385836091 /nfs/dbraw/zinc/83/60/91/385836091.db2.gz CYLJZXGOSDHPSC-UHFFFAOYSA-N 1 2 237.328 2.114 20 0 BEADLO Cc1cc(C[N@@H+](C)CCc2cscn2)no1 ZINC000283855361 385836095 /nfs/dbraw/zinc/83/60/95/385836095.db2.gz CYLJZXGOSDHPSC-UHFFFAOYSA-N 1 2 237.328 2.114 20 0 BEADLO Cc1noc(C(C)(C)[NH2+]Cc2cnccc2C)n1 ZINC000283924422 385840371 /nfs/dbraw/zinc/84/03/71/385840371.db2.gz IYFDWWKSSYBPBZ-UHFFFAOYSA-N 1 2 246.314 2.106 20 0 BEADLO Cc1csc([C@@H](C)[NH2+]Cc2ccn(C)n2)n1 ZINC000112466358 385844932 /nfs/dbraw/zinc/84/49/32/385844932.db2.gz OTPJMLIZBZBMKP-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO COC(=O)C[NH2+][C@@H](c1ccccc1C)C1CC1 ZINC000271790217 385851066 /nfs/dbraw/zinc/85/10/66/385851066.db2.gz IWEOJKUWNLQCAR-CQSZACIVSA-N 1 2 233.311 2.209 20 0 BEADLO CS[C@@H]1CCN(c2cc[nH+]cc2F)C1 ZINC000603387356 385852973 /nfs/dbraw/zinc/85/29/73/385852973.db2.gz CNEGLBCPJVFOQC-MRVPVSSYSA-N 1 2 212.293 2.162 20 0 BEADLO CC(C)c1nnc(C[NH2+]Cc2ccccc2F)[nH]1 ZINC000294811810 385899658 /nfs/dbraw/zinc/89/96/58/385899658.db2.gz NXANVMWTFYANLH-UHFFFAOYSA-N 1 2 248.305 2.357 20 0 BEADLO CC[N@@H+](CCOC)Cc1c(F)ccc(O)c1F ZINC000294848822 385903203 /nfs/dbraw/zinc/90/32/03/385903203.db2.gz IRASPOUYSVAQPQ-UHFFFAOYSA-N 1 2 245.269 2.139 20 0 BEADLO COC[C@@]1(C)CCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000294879259 385907499 /nfs/dbraw/zinc/90/74/99/385907499.db2.gz DYYNSUUNTBBFJV-AWEZNQCLSA-N 1 2 245.326 2.426 20 0 BEADLO CC[C@@H](C)[C@H](C)C(=O)N(C)Cc1[nH+]ccn1C ZINC000272517048 385909574 /nfs/dbraw/zinc/90/95/74/385909574.db2.gz WXBLSUHBVQWHAP-MNOVXSKESA-N 1 2 237.347 2.061 20 0 BEADLO Cc1cc(C[N@@H+]2CCCC[C@@H]2c2cc[nH]n2)on1 ZINC000285327853 385915715 /nfs/dbraw/zinc/91/57/15/385915715.db2.gz JLFZESPCAUHBQS-CYBMUJFWSA-N 1 2 246.314 2.433 20 0 BEADLO Cc1cc(C[N@H+]2CCCC[C@@H]2c2cc[nH]n2)on1 ZINC000285327853 385915718 /nfs/dbraw/zinc/91/57/18/385915718.db2.gz JLFZESPCAUHBQS-CYBMUJFWSA-N 1 2 246.314 2.433 20 0 BEADLO C[N@H+](Cc1c(F)cccc1Cl)C1(CO)CC1 ZINC000285431777 385925727 /nfs/dbraw/zinc/92/57/27/385925727.db2.gz HNBBQQZRHMDDBF-UHFFFAOYSA-N 1 2 243.709 2.436 20 0 BEADLO C[N@@H+](Cc1c(F)cccc1Cl)C1(CO)CC1 ZINC000285431777 385925734 /nfs/dbraw/zinc/92/57/34/385925734.db2.gz HNBBQQZRHMDDBF-UHFFFAOYSA-N 1 2 243.709 2.436 20 0 BEADLO Cc1cc(N2CC(C3CCC3)C2)nc[nH+]1 ZINC000335035210 385926284 /nfs/dbraw/zinc/92/62/84/385926284.db2.gz XWXBOQFWDMMWCB-UHFFFAOYSA-N 1 2 203.289 2.021 20 0 BEADLO CC[C@H](NC(=O)[C@H]1[C@H](C2CC2)[C@@H]1C)c1[nH]cc[nH+]1 ZINC000529054999 385866996 /nfs/dbraw/zinc/86/69/96/385866996.db2.gz YUUHHXHEPTWLJP-PDEGPIFNSA-N 1 2 247.342 2.269 20 0 BEADLO CC[C@H](NC(=O)[C@@H]1[C@@H](C)[C@@H]1C1CC1)c1[nH]cc[nH+]1 ZINC000529054997 385867118 /nfs/dbraw/zinc/86/71/18/385867118.db2.gz YUUHHXHEPTWLJP-OHBODLIOSA-N 1 2 247.342 2.269 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ccncc1F)c1nccn1C ZINC000338017856 385876072 /nfs/dbraw/zinc/87/60/72/385876072.db2.gz WQILSANHBAHSMR-UWVGGRQHSA-N 1 2 248.305 2.366 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccncc1F)c1cnccn1 ZINC000338006946 385877700 /nfs/dbraw/zinc/87/77/00/385877700.db2.gz DSGJMVVHSVJPNA-VHSXEESVSA-N 1 2 246.289 2.423 20 0 BEADLO CC(C)C[C@H](C)CC(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000647735905 385878554 /nfs/dbraw/zinc/87/85/54/385878554.db2.gz QXOJMWNTKAECOR-NSHDSACASA-N 1 2 249.358 2.367 20 0 BEADLO CC(C)C[C@H](C)CC(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000647735905 385878557 /nfs/dbraw/zinc/87/85/57/385878557.db2.gz QXOJMWNTKAECOR-NSHDSACASA-N 1 2 249.358 2.367 20 0 BEADLO C[N@H+](Cc1csc(Cl)n1)C1(CO)CCC1 ZINC000295153067 385977525 /nfs/dbraw/zinc/97/75/25/385977525.db2.gz BYGDCDYBSMKVBT-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO C[N@@H+](Cc1csc(Cl)n1)C1(CO)CCC1 ZINC000295153067 385977530 /nfs/dbraw/zinc/97/75/30/385977530.db2.gz BYGDCDYBSMKVBT-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO CC[C@H]([NH2+][C@H]1CCCOCC1)C(F)(F)F ZINC000336747615 385978575 /nfs/dbraw/zinc/97/85/75/385978575.db2.gz CANWGKVINIOIRK-IUCAKERBSA-N 1 2 225.254 2.486 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](C)c2ccncc2F)nc1 ZINC000338367972 385979520 /nfs/dbraw/zinc/97/95/20/385979520.db2.gz LTJDLHUAVRUDJH-JTQLQIEISA-N 1 2 246.289 2.170 20 0 BEADLO c1cc(C[NH2+]Cc2ccc3c(c2)CCCN3)[nH]n1 ZINC000414972639 385988447 /nfs/dbraw/zinc/98/84/47/385988447.db2.gz BCZUHKMSNHBAKF-UHFFFAOYSA-N 1 2 242.326 2.058 20 0 BEADLO CC[C@H]1CC[N@H+](Cc2nc(C(F)F)no2)C1 ZINC000425411974 385989912 /nfs/dbraw/zinc/98/99/12/385989912.db2.gz BJEHJYJUBJPOTO-ZETCQYMHSA-N 1 2 231.246 2.239 20 0 BEADLO CC[C@H]1CC[N@@H+](Cc2nc(C(F)F)no2)C1 ZINC000425411974 385989917 /nfs/dbraw/zinc/98/99/17/385989917.db2.gz BJEHJYJUBJPOTO-ZETCQYMHSA-N 1 2 231.246 2.239 20 0 BEADLO CC[C@@H](C)C[NH2+][C@@H](CC(F)(F)F)C(=O)OC ZINC000336749308 385991003 /nfs/dbraw/zinc/99/10/03/385991003.db2.gz YSBDUXWMGFYGAX-SFYZADRCSA-N 1 2 241.253 2.116 20 0 BEADLO CCCC[N@H+](C)Cc1ncnn1C(C)(C)C ZINC000338259994 385939861 /nfs/dbraw/zinc/93/98/61/385939861.db2.gz ALBQYQRHOJOJTE-UHFFFAOYSA-N 1 2 224.352 2.265 20 0 BEADLO CCCC[N@@H+](C)Cc1ncnn1C(C)(C)C ZINC000338259994 385939865 /nfs/dbraw/zinc/93/98/65/385939865.db2.gz ALBQYQRHOJOJTE-UHFFFAOYSA-N 1 2 224.352 2.265 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+](C)C[C@@H]2CCCO2)s1 ZINC000338292307 385946047 /nfs/dbraw/zinc/94/60/47/385946047.db2.gz ASDUASJCAMRRDL-SCZZXKLOSA-N 1 2 241.360 2.018 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+](C)C[C@@H]2CCCO2)s1 ZINC000338292307 385946052 /nfs/dbraw/zinc/94/60/52/385946052.db2.gz ASDUASJCAMRRDL-SCZZXKLOSA-N 1 2 241.360 2.018 20 0 BEADLO Cc1ccnc(N[C@@H](c2[nH]cc[nH+]2)C(C)C)n1 ZINC000285594510 385946552 /nfs/dbraw/zinc/94/65/52/385946552.db2.gz LHEBHPVXMXSMHD-SNVBAGLBSA-N 1 2 231.303 2.317 20 0 BEADLO FC1=CCCN(Cc2cccc3[nH+]ccn32)C1 ZINC000272870908 385947040 /nfs/dbraw/zinc/94/70/40/385947040.db2.gz WESOVQLWBSMFBQ-UHFFFAOYSA-N 1 2 231.274 2.393 20 0 BEADLO Cc1noc([C@H]2CCC[N@@H+]2Cc2cccnc2)n1 ZINC000285599830 385947523 /nfs/dbraw/zinc/94/75/23/385947523.db2.gz JQUXFAJHBPQYOV-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1noc([C@H]2CCC[N@H+]2Cc2cccnc2)n1 ZINC000285599830 385947527 /nfs/dbraw/zinc/94/75/27/385947527.db2.gz JQUXFAJHBPQYOV-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO CO[C@H]1CCC[N@@H+]([C@@H](C)c2nnc(C)s2)C1 ZINC000338284546 385948676 /nfs/dbraw/zinc/94/86/76/385948676.db2.gz QXSGUBLOYGBFGF-WPRPVWTQSA-N 1 2 241.360 2.018 20 0 BEADLO CO[C@H]1CCC[N@H+]([C@@H](C)c2nnc(C)s2)C1 ZINC000338284546 385948678 /nfs/dbraw/zinc/94/86/78/385948678.db2.gz QXSGUBLOYGBFGF-WPRPVWTQSA-N 1 2 241.360 2.018 20 0 BEADLO COC(=O)[C@H]([NH2+]Cc1ccc(C)cc1C)C1CC1 ZINC000272934112 385952982 /nfs/dbraw/zinc/95/29/82/385952982.db2.gz NCTAFIYHZYZWOG-CQSZACIVSA-N 1 2 247.338 2.345 20 0 BEADLO Cc1cc(CNC(=O)N2[C@@H](C)C[C@@H]2C)cc(C)[nH+]1 ZINC000335015129 385971431 /nfs/dbraw/zinc/97/14/31/385971431.db2.gz UJJNABJBRVTOAY-RYUDHWBXSA-N 1 2 247.342 2.391 20 0 BEADLO Cc1noc([C@@H]2CCC[N@@H+]2C/C=C/Cl)n1 ZINC000285844006 385972972 /nfs/dbraw/zinc/97/29/72/385972972.db2.gz XMPSTDBVXOCCOG-SGRBOOSSSA-N 1 2 227.695 2.267 20 0 BEADLO Cc1noc([C@@H]2CCC[N@H+]2C/C=C/Cl)n1 ZINC000285844006 385972978 /nfs/dbraw/zinc/97/29/78/385972978.db2.gz XMPSTDBVXOCCOG-SGRBOOSSSA-N 1 2 227.695 2.267 20 0 BEADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cocn1 ZINC000355208520 385974326 /nfs/dbraw/zinc/97/43/26/385974326.db2.gz ZFXNSWIWONUEOP-APPZFPTMSA-N 1 2 234.221 2.447 20 0 BEADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1cocn1 ZINC000355208520 385974331 /nfs/dbraw/zinc/97/43/31/385974331.db2.gz ZFXNSWIWONUEOP-APPZFPTMSA-N 1 2 234.221 2.447 20 0 BEADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cocn1 ZINC000355208523 385974372 /nfs/dbraw/zinc/97/43/72/385974372.db2.gz ZFXNSWIWONUEOP-VXNVDRBHSA-N 1 2 234.221 2.447 20 0 BEADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cocn1 ZINC000355208523 385974377 /nfs/dbraw/zinc/97/43/77/385974377.db2.gz ZFXNSWIWONUEOP-VXNVDRBHSA-N 1 2 234.221 2.447 20 0 BEADLO FCC[NH2+]Cc1csc(C2CC2)n1 ZINC000308394185 386008935 /nfs/dbraw/zinc/00/89/35/386008935.db2.gz CGTQLQHPEHVIIH-UHFFFAOYSA-N 1 2 200.282 2.080 20 0 BEADLO CCS[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)C(=O)OC ZINC000189517001 386017796 /nfs/dbraw/zinc/01/77/96/386017796.db2.gz NVBDKOXOSAOVPM-GARJFASQSA-N 1 2 245.388 2.202 20 0 BEADLO CC[C@@H](F)C[NH2+][C@H](COC)c1ccco1 ZINC000336771039 386024354 /nfs/dbraw/zinc/02/43/54/386024354.db2.gz WFFFHNKHVNPVHK-NXEZZACHSA-N 1 2 215.268 2.305 20 0 BEADLO CC[C@@H](F)C[NH2+][C@@H](COC)c1ccco1 ZINC000336771042 386026654 /nfs/dbraw/zinc/02/66/54/386026654.db2.gz WFFFHNKHVNPVHK-ZJUUUORDSA-N 1 2 215.268 2.305 20 0 BEADLO COC(=O)[C@H](CCn1cc[nH+]c1)c1ccccc1 ZINC000425429323 386031422 /nfs/dbraw/zinc/03/14/22/386031422.db2.gz YUZXCNVLGZXXPH-CYBMUJFWSA-N 1 2 244.294 2.230 20 0 BEADLO CCCCC[N@@H+]1CC(=O)N[C@]12CC[C@@H](C)C2 ZINC000414200797 386038023 /nfs/dbraw/zinc/03/80/23/386038023.db2.gz DLQTUOQOTUPHDP-DGCLKSJQSA-N 1 2 224.348 2.125 20 0 BEADLO CCCCC[N@H+]1CC(=O)N[C@]12CC[C@@H](C)C2 ZINC000414200797 386038031 /nfs/dbraw/zinc/03/80/31/386038031.db2.gz DLQTUOQOTUPHDP-DGCLKSJQSA-N 1 2 224.348 2.125 20 0 BEADLO F[C@H]1CCC[C@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000334436528 386041504 /nfs/dbraw/zinc/04/15/04/386041504.db2.gz GYHMHLRNXPEAFB-VHSXEESVSA-N 1 2 221.279 2.078 20 0 BEADLO COC(=O)C(C)(C)CC[N@H+](CC(F)F)C1CC1 ZINC000338548811 386041729 /nfs/dbraw/zinc/04/17/29/386041729.db2.gz YQXSMGFMCQAZEX-UHFFFAOYSA-N 1 2 249.301 2.305 20 0 BEADLO COC(=O)C(C)(C)CC[N@@H+](CC(F)F)C1CC1 ZINC000338548811 386041734 /nfs/dbraw/zinc/04/17/34/386041734.db2.gz YQXSMGFMCQAZEX-UHFFFAOYSA-N 1 2 249.301 2.305 20 0 BEADLO Cc1cnc([C@H](C)[NH2+][C@H](C)c2cn[nH]c2)o1 ZINC000303741078 386044700 /nfs/dbraw/zinc/04/47/00/386044700.db2.gz HDOCNZKAGWOYBE-BDAKNGLRSA-N 1 2 220.276 2.118 20 0 BEADLO COCc1ccc(Cn2cc[nH+]c2)cc1 ZINC000338555694 386051478 /nfs/dbraw/zinc/05/14/78/386051478.db2.gz CRMNCBWRDWKXIP-UHFFFAOYSA-N 1 2 202.257 2.078 20 0 BEADLO CO[C@@H](C)CN(C)c1cc[nH+]c2ccncc21 ZINC000286584079 386055205 /nfs/dbraw/zinc/05/52/05/386055205.db2.gz RFQQXSRQYWPOSA-JTQLQIEISA-N 1 2 231.299 2.101 20 0 BEADLO Cc1cnc(C[NH2+][C@H]2CCCc3cn[nH]c32)s1 ZINC000295586277 386055578 /nfs/dbraw/zinc/05/55/78/386055578.db2.gz DYXVBIRAQCBXSJ-JTQLQIEISA-N 1 2 248.355 2.342 20 0 BEADLO Cc1cnc(C[NH2+][C@H]2CCCc3c[nH]nc32)s1 ZINC000295586277 386055583 /nfs/dbraw/zinc/05/55/83/386055583.db2.gz DYXVBIRAQCBXSJ-JTQLQIEISA-N 1 2 248.355 2.342 20 0 BEADLO C[C@@H]1C[N@H+](CC(=O)Nc2ccccc2F)[C@H]1C ZINC000334454012 386103947 /nfs/dbraw/zinc/10/39/47/386103947.db2.gz DWKVUPLQGPFYPP-ZJUUUORDSA-N 1 2 236.290 2.104 20 0 BEADLO C[C@@H]1C[N@@H+](CC(=O)Nc2ccccc2F)[C@H]1C ZINC000334454012 386103953 /nfs/dbraw/zinc/10/39/53/386103953.db2.gz DWKVUPLQGPFYPP-ZJUUUORDSA-N 1 2 236.290 2.104 20 0 BEADLO CCC1(C(=O)N[C@H]2C[C@@H](C)n3cc[nH+]c32)CC1 ZINC000335139314 386114727 /nfs/dbraw/zinc/11/47/27/386114727.db2.gz IILJVWMDJOLVOS-ZJUUUORDSA-N 1 2 233.315 2.195 20 0 BEADLO FC1CC2(C1)C[NH+](Cc1nccs1)C2 ZINC000647929984 386119999 /nfs/dbraw/zinc/11/99/99/386119999.db2.gz KUACDZSHGUBRMO-UHFFFAOYSA-N 1 2 212.293 2.077 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1c1nc(C[NH2+]C)no1 ZINC000414648030 386061512 /nfs/dbraw/zinc/06/15/12/386061512.db2.gz UWEPHNTZWIQORY-ZJUUUORDSA-N 1 2 223.320 2.473 20 0 BEADLO CCOCCSCc1c[nH+]ccc1OC ZINC000286635024 386062108 /nfs/dbraw/zinc/06/21/08/386062108.db2.gz VTJOVIUVFLZGHU-UHFFFAOYSA-N 1 2 227.329 2.360 20 0 BEADLO CCC(CC)c1noc(CCn2cc[nH+]c2)n1 ZINC000274070981 386067011 /nfs/dbraw/zinc/06/70/11/386067011.db2.gz WROYEZOBZFZOAW-UHFFFAOYSA-N 1 2 234.303 2.412 20 0 BEADLO CCn1ccc(C[NH2+][C@H](C)c2cc(C)ccn2)n1 ZINC000414216023 386070935 /nfs/dbraw/zinc/07/09/35/386070935.db2.gz ZECPCSBFFXAQEH-GFCCVEGCSA-N 1 2 244.342 2.457 20 0 BEADLO CCC[C@@](C)(CC)C(=O)NCc1c[nH+]c[nH]1 ZINC000356150137 386072493 /nfs/dbraw/zinc/07/24/93/386072493.db2.gz IDYPSNSZODSLNT-GFCCVEGCSA-N 1 2 223.320 2.242 20 0 BEADLO CCC[C@@](C)(CC)C(=O)NCc1c[nH]c[nH+]1 ZINC000356150137 386072498 /nfs/dbraw/zinc/07/24/98/386072498.db2.gz IDYPSNSZODSLNT-GFCCVEGCSA-N 1 2 223.320 2.242 20 0 BEADLO CC[C@H]1CCC[C@H]1C(=O)NCc1[nH+]ccn1CC ZINC000295739220 386080130 /nfs/dbraw/zinc/08/01/30/386080130.db2.gz SMLFOEFJPFBKIR-NWDGAFQWSA-N 1 2 249.358 2.346 20 0 BEADLO CN(CCO)c1cc[nH+]c2c(Cl)cccc12 ZINC000286915640 386084556 /nfs/dbraw/zinc/08/45/56/386084556.db2.gz KMCAZFDFXFMVAK-UHFFFAOYSA-N 1 2 236.702 2.317 20 0 BEADLO Cc1cnc(CNC(=O)Nc2cc[nH+]cc2C)o1 ZINC000287044982 386091214 /nfs/dbraw/zinc/09/12/14/386091214.db2.gz JUMKVPZQLIIIMP-UHFFFAOYSA-N 1 2 246.270 2.008 20 0 BEADLO CO[C@H]1C[C@@H](N(C)C(=O)Nc2cc[nH+]c(C)c2)C1 ZINC000287019486 386092727 /nfs/dbraw/zinc/09/27/27/386092727.db2.gz IDQPVSGHVGXPBT-TXEJJXNPSA-N 1 2 249.314 2.031 20 0 BEADLO CCCCCCC(=O)NCc1[nH+]ccn1CC ZINC000295856667 386095999 /nfs/dbraw/zinc/09/59/99/386095999.db2.gz WRBMNOMSKPJUED-UHFFFAOYSA-N 1 2 237.347 2.490 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)C[C@@H]1CCC[C@H]1C ZINC000274388961 386097661 /nfs/dbraw/zinc/09/76/61/386097661.db2.gz BRMRZTLWWNPHHL-UPJWGTAASA-N 1 2 249.358 2.214 20 0 BEADLO CC(=O)c1cccc(C[N@@H+]2CCO[C@@H](C)C2)c1 ZINC000296184294 386145271 /nfs/dbraw/zinc/14/52/71/386145271.db2.gz BDDLLTMQQDUQQY-NSHDSACASA-N 1 2 233.311 2.110 20 0 BEADLO CC(=O)c1cccc(C[N@H+]2CCO[C@@H](C)C2)c1 ZINC000296184294 386145273 /nfs/dbraw/zinc/14/52/73/386145273.db2.gz BDDLLTMQQDUQQY-NSHDSACASA-N 1 2 233.311 2.110 20 0 BEADLO CCc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cn1 ZINC000335151338 386146705 /nfs/dbraw/zinc/14/67/05/386146705.db2.gz YJCSYCAPWPSVEP-TXEJJXNPSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cn1 ZINC000335151338 386146707 /nfs/dbraw/zinc/14/67/07/386146707.db2.gz YJCSYCAPWPSVEP-TXEJJXNPSA-N 1 2 234.343 2.253 20 0 BEADLO CC(C)(C)C1CC[NH+](Cc2c[nH]nn2)CC1 ZINC000335153404 386148849 /nfs/dbraw/zinc/14/88/49/386148849.db2.gz HZHHXIWRVXEXSM-UHFFFAOYSA-N 1 2 222.336 2.063 20 0 BEADLO CC(C)(C)C1CC[NH+](Cc2cnn[nH]2)CC1 ZINC000335153404 386148856 /nfs/dbraw/zinc/14/88/56/386148856.db2.gz HZHHXIWRVXEXSM-UHFFFAOYSA-N 1 2 222.336 2.063 20 0 BEADLO CC(C)(C)C1CC[NH+](Cc2cn[nH]n2)CC1 ZINC000335153404 386148861 /nfs/dbraw/zinc/14/88/61/386148861.db2.gz HZHHXIWRVXEXSM-UHFFFAOYSA-N 1 2 222.336 2.063 20 0 BEADLO CC(C)C(C)(C)C(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000335158864 386152657 /nfs/dbraw/zinc/15/26/57/386152657.db2.gz NBDPENAGGVACCT-SNVBAGLBSA-N 1 2 249.358 2.065 20 0 BEADLO CC(C)C(C)(C)C(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000335158864 386152659 /nfs/dbraw/zinc/15/26/59/386152659.db2.gz NBDPENAGGVACCT-SNVBAGLBSA-N 1 2 249.358 2.065 20 0 BEADLO COC(=O)[C@@H]1C[C@@H](C)CC[N@@H+]1C/C=C/Cl ZINC000274823269 386154745 /nfs/dbraw/zinc/15/47/45/386154745.db2.gz BPXJJQIIJGDVJV-GMRPRLDHSA-N 1 2 231.723 2.012 20 0 BEADLO COC(=O)[C@@H]1C[C@@H](C)CC[N@H+]1C/C=C/Cl ZINC000274823269 386154749 /nfs/dbraw/zinc/15/47/49/386154749.db2.gz BPXJJQIIJGDVJV-GMRPRLDHSA-N 1 2 231.723 2.012 20 0 BEADLO CC[C@@H](NC(=O)C1CC(F)(F)C1)c1[nH]cc[nH+]1 ZINC000394741113 386159008 /nfs/dbraw/zinc/15/90/08/386159008.db2.gz QXJPNNZELGMYFR-MRVPVSSYSA-N 1 2 243.257 2.022 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1ccc(C)cc1C ZINC000287963595 386159637 /nfs/dbraw/zinc/15/96/37/386159637.db2.gz SQEWSFCLBBYQAN-LBPRGKRZSA-N 1 2 235.327 2.297 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1ccc(C)cc1C ZINC000287963595 386159645 /nfs/dbraw/zinc/15/96/45/386159645.db2.gz SQEWSFCLBBYQAN-LBPRGKRZSA-N 1 2 235.327 2.297 20 0 BEADLO Cc1cn2cc(NC(=O)NCC(C)C)ccc2[nH+]1 ZINC000263911084 386190282 /nfs/dbraw/zinc/19/02/82/386190282.db2.gz KVCZRJZUBGKIDG-UHFFFAOYSA-N 1 2 246.314 2.420 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C1=CCCCCC1 ZINC000274937116 386165071 /nfs/dbraw/zinc/16/50/71/386165071.db2.gz ZTHHYIZPSVLIFV-UHFFFAOYSA-N 1 2 233.315 2.225 20 0 BEADLO CC(C)(C(=O)NCc1ccsc1)c1c[nH]c[nH+]1 ZINC000346146822 386167628 /nfs/dbraw/zinc/16/76/28/386167628.db2.gz FIXXLGSXNYXRHS-UHFFFAOYSA-N 1 2 249.339 2.065 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cn(C(C)C)nn2)o1 ZINC000310234150 386169061 /nfs/dbraw/zinc/16/90/61/386169061.db2.gz QWVLXNVNWRNZID-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO Cc1ccc(C[NH2+][C@H](CCO)c2ccco2)nc1 ZINC000346225775 386176096 /nfs/dbraw/zinc/17/60/96/386176096.db2.gz SQAJUJBBHPCUIE-CYBMUJFWSA-N 1 2 246.310 2.196 20 0 BEADLO Cc1cn2cc(NC(=O)CC3CC3)ccc2[nH+]1 ZINC000263823309 386179384 /nfs/dbraw/zinc/17/93/84/386179384.db2.gz MQJDYVNFNCRLHE-UHFFFAOYSA-N 1 2 229.283 2.381 20 0 BEADLO CC(=O)c1ccc(C[N@H+]2C[C@@H](C)OC[C@@H]2C)cc1 ZINC000296568274 386185312 /nfs/dbraw/zinc/18/53/12/386185312.db2.gz QFEJSVVNNGSUNB-NWDGAFQWSA-N 1 2 247.338 2.498 20 0 BEADLO CC(=O)c1ccc(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)cc1 ZINC000296568274 386185315 /nfs/dbraw/zinc/18/53/15/386185315.db2.gz QFEJSVVNNGSUNB-NWDGAFQWSA-N 1 2 247.338 2.498 20 0 BEADLO CCO[C@H](C)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000263887985 386187089 /nfs/dbraw/zinc/18/70/89/386187089.db2.gz YUOLQTNTALUHNO-SNVBAGLBSA-N 1 2 247.298 2.006 20 0 BEADLO CC(=O)c1cccc(C[N@H+]2C[C@@H](C)OC[C@@H]2C)c1 ZINC000296586797 386187228 /nfs/dbraw/zinc/18/72/28/386187228.db2.gz ROBPQYUQZXWMRL-NWDGAFQWSA-N 1 2 247.338 2.498 20 0 BEADLO CC(=O)c1cccc(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)c1 ZINC000296586797 386187233 /nfs/dbraw/zinc/18/72/33/386187233.db2.gz ROBPQYUQZXWMRL-NWDGAFQWSA-N 1 2 247.338 2.498 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N1CC2(C1)CCCCC2 ZINC000288341654 386187488 /nfs/dbraw/zinc/18/74/88/386187488.db2.gz CYXCGJMDNWBTLB-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO Cc1nc(C[N@@H+](C)CC2(C)CCC2)no1 ZINC000340277792 386191353 /nfs/dbraw/zinc/19/13/53/386191353.db2.gz LNVACHMKZRSYGG-UHFFFAOYSA-N 1 2 209.293 2.000 20 0 BEADLO Cc1nc(C[N@H+](C)CC2(C)CCC2)no1 ZINC000340277792 386191360 /nfs/dbraw/zinc/19/13/60/386191360.db2.gz LNVACHMKZRSYGG-UHFFFAOYSA-N 1 2 209.293 2.000 20 0 BEADLO CO[C@H](C[N@H+](C)Cc1ncc[nH]1)c1ccccc1 ZINC000647929831 386126475 /nfs/dbraw/zinc/12/64/75/386126475.db2.gz FVVJNJGLNPMBTP-CYBMUJFWSA-N 1 2 245.326 2.229 20 0 BEADLO CO[C@H](C[N@@H+](C)Cc1ncc[nH]1)c1ccccc1 ZINC000647929831 386126479 /nfs/dbraw/zinc/12/64/79/386126479.db2.gz FVVJNJGLNPMBTP-CYBMUJFWSA-N 1 2 245.326 2.229 20 0 BEADLO C[C@@H](F)CCNc1cc(N2CCCC2)nc[nH+]1 ZINC000338756059 386127868 /nfs/dbraw/zinc/12/78/68/386127868.db2.gz PSXKPRNLDWONNU-SNVBAGLBSA-N 1 2 238.310 2.237 20 0 BEADLO C[C@@H](F)CCNc1cc(N2CCCC2)[nH+]cn1 ZINC000338756059 386127872 /nfs/dbraw/zinc/12/78/72/386127872.db2.gz PSXKPRNLDWONNU-SNVBAGLBSA-N 1 2 238.310 2.237 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CCC(C)(C)C2)c[nH+]1 ZINC000334463216 386129985 /nfs/dbraw/zinc/12/99/85/386129985.db2.gz RFZDZRQIHCTLQV-SECBINFHSA-N 1 2 221.304 2.027 20 0 BEADLO CC[C@@H]1CCC[C@H]1NC(=O)CCc1[nH]cc[nH+]1 ZINC000287528948 386132396 /nfs/dbraw/zinc/13/23/96/386132396.db2.gz BPOFHVMECAMHKD-GHMZBOCLSA-N 1 2 235.331 2.037 20 0 BEADLO Cc1ccc(F)c(C[N@H+](C2CC2)C2COC2)c1 ZINC000296069350 386133054 /nfs/dbraw/zinc/13/30/54/386133054.db2.gz PSQPSINDPZSOTJ-UHFFFAOYSA-N 1 2 235.302 2.497 20 0 BEADLO Cc1ccc(F)c(C[N@@H+](C2CC2)C2COC2)c1 ZINC000296069350 386133056 /nfs/dbraw/zinc/13/30/56/386133056.db2.gz PSQPSINDPZSOTJ-UHFFFAOYSA-N 1 2 235.302 2.497 20 0 BEADLO COC(=O)CC[N@@H+]1Cc2cccc(Cl)c2C1 ZINC000287612946 386136449 /nfs/dbraw/zinc/13/64/49/386136449.db2.gz ZJJRMLHPVHZDCI-UHFFFAOYSA-N 1 2 239.702 2.219 20 0 BEADLO COC(=O)CC[N@H+]1Cc2cccc(Cl)c2C1 ZINC000287612946 386136454 /nfs/dbraw/zinc/13/64/54/386136454.db2.gz ZJJRMLHPVHZDCI-UHFFFAOYSA-N 1 2 239.702 2.219 20 0 BEADLO CO[C@H](Cc1ccccc1)Cn1cc[nH+]c1 ZINC000296825248 386204784 /nfs/dbraw/zinc/20/47/84/386204784.db2.gz RHTSAMVIALDPAU-CYBMUJFWSA-N 1 2 216.284 2.141 20 0 BEADLO C[N@H+](CCc1cscn1)Cc1cscn1 ZINC000340287414 386211749 /nfs/dbraw/zinc/21/17/49/386211749.db2.gz NZLTWGFETAYMCJ-UHFFFAOYSA-N 1 2 239.369 2.274 20 0 BEADLO C[N@@H+](CCc1cscn1)Cc1cscn1 ZINC000340287414 386211752 /nfs/dbraw/zinc/21/17/52/386211752.db2.gz NZLTWGFETAYMCJ-UHFFFAOYSA-N 1 2 239.369 2.274 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)C1CCCCCC1 ZINC000264277106 386222713 /nfs/dbraw/zinc/22/27/13/386222713.db2.gz HNYYZPUMNLPKCR-UHFFFAOYSA-N 1 2 235.331 2.007 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)CCC1CCCC1 ZINC000264319056 386227059 /nfs/dbraw/zinc/22/70/59/386227059.db2.gz PRTUZUZEVTVYKL-UHFFFAOYSA-N 1 2 235.331 2.007 20 0 BEADLO CC(C)(CNC(=O)C=Cc1c[nH]c[nH+]1)C1CCC1 ZINC000297164074 386231244 /nfs/dbraw/zinc/23/12/44/386231244.db2.gz WESAXJWYPVXICT-VOTSOKGWSA-N 1 2 247.342 2.365 20 0 BEADLO CC(C)C(C)(C)C(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000275739066 386236734 /nfs/dbraw/zinc/23/67/34/386236734.db2.gz BNNSKBLQUHZSNK-NSHDSACASA-N 1 2 237.347 2.070 20 0 BEADLO C[C@@H](C(=O)Nc1ccn2cc[nH+]c2c1)C1CC1 ZINC000288854654 386236805 /nfs/dbraw/zinc/23/68/05/386236805.db2.gz KQMBHOXSVXCLBA-SECBINFHSA-N 1 2 229.283 2.319 20 0 BEADLO CCCCC(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000125319027 386247038 /nfs/dbraw/zinc/24/70/38/386247038.db2.gz JFEZEPVQHADQOH-VIFPVBQESA-N 1 2 209.293 2.167 20 0 BEADLO Fc1ccccc1CN1CCc2[nH+]c[nH]c2C1 ZINC000647932689 386248494 /nfs/dbraw/zinc/24/84/94/386248494.db2.gz MBYIVGROHXTWRO-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO Cc1nnc(C[N@@H+]2CCCc3occc3C2)s1 ZINC000288990964 386248853 /nfs/dbraw/zinc/24/88/53/386248853.db2.gz ZXLTTZYKINUZDE-UHFFFAOYSA-N 1 2 249.339 2.388 20 0 BEADLO Cc1nnc(C[N@H+]2CCCc3occc3C2)s1 ZINC000288990964 386248863 /nfs/dbraw/zinc/24/88/63/386248863.db2.gz ZXLTTZYKINUZDE-UHFFFAOYSA-N 1 2 249.339 2.388 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)COC1CCCC1 ZINC000264556937 386249639 /nfs/dbraw/zinc/24/96/39/386249639.db2.gz TUSOZGMKCPGBGB-UHFFFAOYSA-N 1 2 234.299 2.288 20 0 BEADLO Cc1c[nH+]c(CNc2ccc(F)cc2)n1C ZINC000336742981 386250800 /nfs/dbraw/zinc/25/08/00/386250800.db2.gz SONVMYUWNBKZMK-UHFFFAOYSA-N 1 2 219.263 2.480 20 0 BEADLO Cc1cn2cc(NC(=O)c3ccoc3)ccc2[nH+]1 ZINC000339125733 386251415 /nfs/dbraw/zinc/25/14/15/386251415.db2.gz QUPXZEIXZOGUOW-UHFFFAOYSA-N 1 2 241.250 2.488 20 0 BEADLO Cc1[nH]c(C(=O)NC(C)(C)c2ccccc2)c[nH+]1 ZINC000264611893 386251583 /nfs/dbraw/zinc/25/15/83/386251583.db2.gz IIJLTEURMMFQQW-UHFFFAOYSA-N 1 2 243.310 2.383 20 0 BEADLO c1nc(C[NH+]2CC(COc3ccccc3)C2)co1 ZINC000297415781 386253161 /nfs/dbraw/zinc/25/31/61/386253161.db2.gz MYCSLUTZJKWPCZ-UHFFFAOYSA-N 1 2 244.294 2.185 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)Cc1ccc(F)cc1F ZINC000264621582 386255266 /nfs/dbraw/zinc/25/52/66/386255266.db2.gz OBZJIFYQWWNFQC-UHFFFAOYSA-N 1 2 237.253 2.320 20 0 BEADLO CC[C@@H](NC(=O)CCc1[nH]cc[nH+]1)[C@H]1CC1(C)C ZINC000416279134 386256942 /nfs/dbraw/zinc/25/69/42/386256942.db2.gz SSZMTQUYBTUFSF-GHMZBOCLSA-N 1 2 249.358 2.283 20 0 BEADLO C[N@H+](Cc1cncc(F)c1)Cc1ccccn1 ZINC000428099012 386195632 /nfs/dbraw/zinc/19/56/32/386195632.db2.gz YIQYVWHFZILBSP-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[N@@H+](Cc1cncc(F)c1)Cc1ccccn1 ZINC000428099012 386195634 /nfs/dbraw/zinc/19/56/34/386195634.db2.gz YIQYVWHFZILBSP-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO COCc1cc(CNc2ccc[nH+]c2C)no1 ZINC000297833506 386282606 /nfs/dbraw/zinc/28/26/06/386282606.db2.gz ZWVPGTCMIOCAKG-UHFFFAOYSA-N 1 2 233.271 2.137 20 0 BEADLO CC(C)Cn1cc(N[C@H](C)c2[nH+]ccn2C)cn1 ZINC000347209599 386283656 /nfs/dbraw/zinc/28/36/56/386283656.db2.gz WJVRQEWAWCLNKA-LLVKDONJSA-N 1 2 247.346 2.446 20 0 BEADLO Cn1ncc2c1CCC[C@H]2Nc1cccc[nH+]1 ZINC000264914427 386284251 /nfs/dbraw/zinc/28/42/51/386284251.db2.gz KGOKEWIAXPJVCL-LLVKDONJSA-N 1 2 228.299 2.305 20 0 BEADLO CSC1(CNc2ccc(N(C)C)[nH+]c2)CC1 ZINC000289366069 386289287 /nfs/dbraw/zinc/28/92/87/386289287.db2.gz ZECZNEKWTOMYRK-UHFFFAOYSA-N 1 2 237.372 2.455 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H]2CC[C@H](C)CC2)c[nH+]1 ZINC000264957127 386289168 /nfs/dbraw/zinc/28/91/68/386289168.db2.gz VSBNWASKGAVODZ-CZMCAQCFSA-N 1 2 221.304 2.027 20 0 BEADLO CCC(=O)N1CC[N@H+](Cc2cccc(CC)c2)C1 ZINC000425509112 386295858 /nfs/dbraw/zinc/29/58/58/386295858.db2.gz IBPNBDAUSYUJQQ-UHFFFAOYSA-N 1 2 246.354 2.261 20 0 BEADLO CCC(=O)N1CC[N@@H+](Cc2cccc(CC)c2)C1 ZINC000425509112 386295864 /nfs/dbraw/zinc/29/58/64/386295864.db2.gz IBPNBDAUSYUJQQ-UHFFFAOYSA-N 1 2 246.354 2.261 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2cnc(CC)nc2)CCO1 ZINC000414399725 386297550 /nfs/dbraw/zinc/29/75/50/386297550.db2.gz VVWDCKSADAIGMQ-CYBMUJFWSA-N 1 2 249.358 2.040 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2cnc(CC)nc2)CCO1 ZINC000414399725 386297555 /nfs/dbraw/zinc/29/75/55/386297555.db2.gz VVWDCKSADAIGMQ-CYBMUJFWSA-N 1 2 249.358 2.040 20 0 BEADLO Cc1cccc(C[NH2+][C@]2(C)CCOC2=O)c1C ZINC000289410944 386298547 /nfs/dbraw/zinc/29/85/47/386298547.db2.gz AFMXCOAHICJFOQ-CQSZACIVSA-N 1 2 233.311 2.099 20 0 BEADLO Cc1cn[nH]c1C[NH2+][C@@H]1c2ccccc2O[C@H]1C ZINC000289441128 386304927 /nfs/dbraw/zinc/30/49/27/386304927.db2.gz ARWZAJXTMFLLHL-HZMBPMFUSA-N 1 2 243.310 2.330 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@@H]1c2ccccc2O[C@H]1C ZINC000289441128 386304932 /nfs/dbraw/zinc/30/49/32/386304932.db2.gz ARWZAJXTMFLLHL-HZMBPMFUSA-N 1 2 243.310 2.330 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CC[C@H](C)C[C@@H]2C)c[nH+]1 ZINC000265086695 386305002 /nfs/dbraw/zinc/30/50/02/386305002.db2.gz RYMUVXGOFNHNAK-ATZCPNFKSA-N 1 2 235.331 2.273 20 0 BEADLO Cc1occc1SCC[N@@H+]1CCO[C@H](C)C1 ZINC000298177915 386306503 /nfs/dbraw/zinc/30/65/03/386306503.db2.gz GJNADJFZHOLFDU-SNVBAGLBSA-N 1 2 241.356 2.401 20 0 BEADLO Cc1occc1SCC[N@H+]1CCO[C@H](C)C1 ZINC000298177915 386306508 /nfs/dbraw/zinc/30/65/08/386306508.db2.gz GJNADJFZHOLFDU-SNVBAGLBSA-N 1 2 241.356 2.401 20 0 BEADLO CN(C)c1cccc(OCc2c[nH+]cn2C)c1 ZINC000289447821 386306542 /nfs/dbraw/zinc/30/65/42/386306542.db2.gz UNKHJWZJZSBVRM-UHFFFAOYSA-N 1 2 231.299 2.065 20 0 BEADLO CO[C@H](C)[C@H](C)Nc1[nH+]c2ccccc2n1C ZINC000276357571 386309046 /nfs/dbraw/zinc/30/90/46/386309046.db2.gz VIHYQZPVAYEFDP-VHSXEESVSA-N 1 2 233.315 2.409 20 0 BEADLO CCCc1noc(C[N@H+](C)CCCSC)n1 ZINC000336668979 386309347 /nfs/dbraw/zinc/30/93/47/386309347.db2.gz UBVKQQKIGANPJM-UHFFFAOYSA-N 1 2 243.376 2.207 20 0 BEADLO CCCc1noc(C[N@@H+](C)CCCSC)n1 ZINC000336668979 386309353 /nfs/dbraw/zinc/30/93/53/386309353.db2.gz UBVKQQKIGANPJM-UHFFFAOYSA-N 1 2 243.376 2.207 20 0 BEADLO CCC(=O)N1CC[N@H+](CCCc2ccccc2)C1 ZINC000425517097 386310091 /nfs/dbraw/zinc/31/00/91/386310091.db2.gz KIJBQPUHZDMZKA-UHFFFAOYSA-N 1 2 246.354 2.131 20 0 BEADLO CCC(=O)N1CC[N@@H+](CCCc2ccccc2)C1 ZINC000425517097 386310096 /nfs/dbraw/zinc/31/00/96/386310096.db2.gz KIJBQPUHZDMZKA-UHFFFAOYSA-N 1 2 246.354 2.131 20 0 BEADLO Cc1nonc1C[N@H+]1CCC[C@H]1c1cccn1C ZINC000265162092 386312190 /nfs/dbraw/zinc/31/21/90/386312190.db2.gz WFGNXMSKIIGQMY-ZDUSSCGKSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1nonc1C[N@@H+]1CCC[C@H]1c1cccn1C ZINC000265162092 386312196 /nfs/dbraw/zinc/31/21/96/386312196.db2.gz WFGNXMSKIIGQMY-ZDUSSCGKSA-N 1 2 246.314 2.054 20 0 BEADLO O=C(CCC1CC1)NCc1cn2ccccc2[nH+]1 ZINC000265177632 386313236 /nfs/dbraw/zinc/31/32/36/386313236.db2.gz FEUFHCYAZQSGNI-UHFFFAOYSA-N 1 2 243.310 2.141 20 0 BEADLO COC1(CCNc2cccc[nH+]2)CCC1 ZINC000292675363 386316496 /nfs/dbraw/zinc/31/64/96/386316496.db2.gz DHUUVIVTTKCYEF-UHFFFAOYSA-N 1 2 206.289 2.453 20 0 BEADLO C[C@H](C[NH2+][C@@]1(C)CCOC1=O)c1ccccc1 ZINC000289502258 386317154 /nfs/dbraw/zinc/31/71/54/386317154.db2.gz JYKBRGXDLCEPKV-RISCZKNCSA-N 1 2 233.311 2.085 20 0 BEADLO C[N@H+](Cc1cnns1)Cc1ccccc1 ZINC000289495260 386317167 /nfs/dbraw/zinc/31/71/67/386317167.db2.gz CXULLDHOJAEHHY-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO C[N@@H+](Cc1cnns1)Cc1ccccc1 ZINC000289495260 386317168 /nfs/dbraw/zinc/31/71/68/386317168.db2.gz CXULLDHOJAEHHY-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO C[C@H](Cn1cccn1)Nc1cc[nH+]c(C2CC2)n1 ZINC000264672648 386261616 /nfs/dbraw/zinc/26/16/16/386261616.db2.gz WYYNPBVIAQQVDV-SNVBAGLBSA-N 1 2 243.314 2.051 20 0 BEADLO CO[C@@H](C)CNc1nc(C)[nH+]c2c1CCCC2 ZINC000276038088 386266966 /nfs/dbraw/zinc/26/69/66/386266966.db2.gz MXWQAGGQYAIKQO-VIFPVBQESA-N 1 2 235.331 2.111 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H]2CCc3ccccc32)c[nH+]1 ZINC000264869949 386278618 /nfs/dbraw/zinc/27/86/18/386278618.db2.gz QZTDTSYMZDGDIH-LBPRGKRZSA-N 1 2 241.294 2.135 20 0 BEADLO CCC1(NC(=O)Nc2cc[nH+]c(C)c2)CC1 ZINC000297777456 386279683 /nfs/dbraw/zinc/27/96/83/386279683.db2.gz NKDBBPWARWVWFS-UHFFFAOYSA-N 1 2 219.288 2.454 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H]2CCCc3occc32)c[nH+]1 ZINC000264874029 386279737 /nfs/dbraw/zinc/27/97/37/386279737.db2.gz RSGGPLVHUZQCNE-JTQLQIEISA-N 1 2 245.282 2.119 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1nc2ccccc2o1 ZINC000339289580 386343269 /nfs/dbraw/zinc/34/32/69/386343269.db2.gz FMBRSIQOZRMULP-JTQLQIEISA-N 1 2 232.283 2.049 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1nc2ccccc2o1 ZINC000339289580 386343272 /nfs/dbraw/zinc/34/32/72/386343272.db2.gz FMBRSIQOZRMULP-JTQLQIEISA-N 1 2 232.283 2.049 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1nc(C2CC2)cs1 ZINC000339290485 386343573 /nfs/dbraw/zinc/34/35/73/386343573.db2.gz OTUVQISXXAEQNV-JTQLQIEISA-N 1 2 238.356 2.241 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1nc(C2CC2)cs1 ZINC000339290485 386343581 /nfs/dbraw/zinc/34/35/81/386343581.db2.gz OTUVQISXXAEQNV-JTQLQIEISA-N 1 2 238.356 2.241 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1c(F)cccc1F ZINC000339283846 386351827 /nfs/dbraw/zinc/35/18/27/386351827.db2.gz QGGIAIUMDDKLAK-VIFPVBQESA-N 1 2 227.254 2.186 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1c(F)cccc1F ZINC000339283846 386351831 /nfs/dbraw/zinc/35/18/31/386351831.db2.gz QGGIAIUMDDKLAK-VIFPVBQESA-N 1 2 227.254 2.186 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1csc(C(C)C)n1 ZINC000339286926 386355970 /nfs/dbraw/zinc/35/59/70/386355970.db2.gz WBZAAINPQQKLML-NSHDSACASA-N 1 2 240.372 2.487 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1csc(C(C)C)n1 ZINC000339286926 386355973 /nfs/dbraw/zinc/35/59/73/386355973.db2.gz WBZAAINPQQKLML-NSHDSACASA-N 1 2 240.372 2.487 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CCC[C@H]2CCC[C@H]21 ZINC000276639136 386357871 /nfs/dbraw/zinc/35/78/71/386357871.db2.gz UPHKWSRSTCMZCO-BKVNPXPRSA-N 1 2 245.326 2.214 20 0 BEADLO Cc1ccoc1C[N@@H+]1CCOC[C@@H]1CC(F)F ZINC000289821779 386359016 /nfs/dbraw/zinc/35/90/16/386359016.db2.gz UAXUWHCITGRMKI-JTQLQIEISA-N 1 2 245.269 2.444 20 0 BEADLO Cc1ccoc1C[N@H+]1CCOC[C@@H]1CC(F)F ZINC000289821779 386359021 /nfs/dbraw/zinc/35/90/21/386359021.db2.gz UAXUWHCITGRMKI-JTQLQIEISA-N 1 2 245.269 2.444 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1c(Cl)cnn1C ZINC000335271806 386360590 /nfs/dbraw/zinc/36/05/90/386360590.db2.gz CKBPIANEMWKOIT-OCAPTIKFSA-N 1 2 213.712 2.056 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1c(Cl)cnn1C ZINC000335271806 386360592 /nfs/dbraw/zinc/36/05/92/386360592.db2.gz CKBPIANEMWKOIT-OCAPTIKFSA-N 1 2 213.712 2.056 20 0 BEADLO CCOc1nnc(C[N@H+](CC)C2CCC2)s1 ZINC000336690644 386360644 /nfs/dbraw/zinc/36/06/44/386360644.db2.gz BFEFKMFIZUUPID-UHFFFAOYSA-N 1 2 241.360 2.311 20 0 BEADLO CCOc1nnc(C[N@@H+](CC)C2CCC2)s1 ZINC000336690644 386360648 /nfs/dbraw/zinc/36/06/48/386360648.db2.gz BFEFKMFIZUUPID-UHFFFAOYSA-N 1 2 241.360 2.311 20 0 BEADLO C[C@H](CNC(=O)CC1CCCC1)Cn1cc[nH+]c1 ZINC000265747761 386364719 /nfs/dbraw/zinc/36/47/19/386364719.db2.gz IGUMLUZIGNTUCM-GFCCVEGCSA-N 1 2 249.358 2.216 20 0 BEADLO CC[C@H]1CCCCN1C(=O)CCc1c[nH+]cn1C ZINC000276695300 386364945 /nfs/dbraw/zinc/36/49/45/386364945.db2.gz QNJWPDWLTYMIMN-LBPRGKRZSA-N 1 2 249.358 2.144 20 0 BEADLO COC(=O)c1ccc(C[N@@H+]2CC[C@@](C)(F)C2)o1 ZINC000347366707 386368154 /nfs/dbraw/zinc/36/81/54/386368154.db2.gz HUMBYERJLURKDJ-GFCCVEGCSA-N 1 2 241.262 2.000 20 0 BEADLO COC(=O)c1ccc(C[N@H+]2CC[C@@](C)(F)C2)o1 ZINC000347366707 386368161 /nfs/dbraw/zinc/36/81/61/386368161.db2.gz HUMBYERJLURKDJ-GFCCVEGCSA-N 1 2 241.262 2.000 20 0 BEADLO Cc1occc1C[N@@H+](C)[C@H](C)C(=O)OC(C)C ZINC000414419537 386369571 /nfs/dbraw/zinc/36/95/71/386369571.db2.gz ZUNZZXVBUITEHE-SNVBAGLBSA-N 1 2 239.315 2.360 20 0 BEADLO Cc1occc1C[N@H+](C)[C@H](C)C(=O)OC(C)C ZINC000414419537 386369575 /nfs/dbraw/zinc/36/95/75/386369575.db2.gz ZUNZZXVBUITEHE-SNVBAGLBSA-N 1 2 239.315 2.360 20 0 BEADLO COC[C@H]1CCN(c2cc(C)[nH+]c(C3CC3)n2)C1 ZINC000265798925 386369716 /nfs/dbraw/zinc/36/97/16/386369716.db2.gz JHPZABUCQSEFPO-NSHDSACASA-N 1 2 247.342 2.135 20 0 BEADLO CCCCN(CC)C(=O)CCc1c[nH+]cn1C ZINC000276730751 386369729 /nfs/dbraw/zinc/36/97/29/386369729.db2.gz SZXFOBVVRVQFCV-UHFFFAOYSA-N 1 2 237.347 2.001 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1ccc(C)c(F)c1 ZINC000276727780 386369954 /nfs/dbraw/zinc/36/99/54/386369954.db2.gz CYAXNAFKDJZLES-SNVBAGLBSA-N 1 2 239.290 2.127 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(C)c(F)c1 ZINC000276727780 386369962 /nfs/dbraw/zinc/36/99/62/386369962.db2.gz CYAXNAFKDJZLES-SNVBAGLBSA-N 1 2 239.290 2.127 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC1[C@@H](C)CCC[C@@H]1C ZINC000298736476 386378437 /nfs/dbraw/zinc/37/84/37/386378437.db2.gz XSRAQCGRYZMQSV-UWVGGRQHSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)NC1[C@@H](C)CCC[C@@H]1C ZINC000298736476 386378443 /nfs/dbraw/zinc/37/84/43/386378443.db2.gz XSRAQCGRYZMQSV-UWVGGRQHSA-N 1 2 249.358 2.202 20 0 BEADLO COC(=O)c1occc1C[N@@H+]1CC[C@@](C)(F)C1 ZINC000347392700 386378859 /nfs/dbraw/zinc/37/88/59/386378859.db2.gz UHJBQJJSYYYFPV-GFCCVEGCSA-N 1 2 241.262 2.000 20 0 BEADLO COC(=O)c1occc1C[N@H+]1CC[C@@](C)(F)C1 ZINC000347392700 386378865 /nfs/dbraw/zinc/37/88/65/386378865.db2.gz UHJBQJJSYYYFPV-GFCCVEGCSA-N 1 2 241.262 2.000 20 0 BEADLO CCCc1nc(C[N@@H+]2CCC[C@H]2CC)no1 ZINC000336697066 386379287 /nfs/dbraw/zinc/37/92/87/386379287.db2.gz HRNNRYPFXSMESS-SNVBAGLBSA-N 1 2 223.320 2.397 20 0 BEADLO CCCc1nc(C[N@H+]2CCC[C@H]2CC)no1 ZINC000336697066 386379293 /nfs/dbraw/zinc/37/92/93/386379293.db2.gz HRNNRYPFXSMESS-SNVBAGLBSA-N 1 2 223.320 2.397 20 0 BEADLO CCCC[C@@H](C(=O)OC)[N@@H+]1CC[C@](C)(F)C1 ZINC000347395445 386382867 /nfs/dbraw/zinc/38/28/67/386382867.db2.gz XJAUIVZTLWZQAQ-JQWIXIFHSA-N 1 2 231.311 2.152 20 0 BEADLO CCCC[C@@H](C(=O)OC)[N@H+]1CC[C@](C)(F)C1 ZINC000347395445 386382869 /nfs/dbraw/zinc/38/28/69/386382869.db2.gz XJAUIVZTLWZQAQ-JQWIXIFHSA-N 1 2 231.311 2.152 20 0 BEADLO Fc1ccccc1-n1ccc(Cn2cc[nH+]c2)n1 ZINC000188231685 386326762 /nfs/dbraw/zinc/32/67/62/386326762.db2.gz LMLRBNOFNPPICR-UHFFFAOYSA-N 1 2 242.257 2.256 20 0 BEADLO CCC[C@@H](O)CNc1cc(C)[nH+]c(C2CC2)n1 ZINC000265320350 386327936 /nfs/dbraw/zinc/32/79/36/386327936.db2.gz DUUSRADDZAPFMQ-LLVKDONJSA-N 1 2 235.331 2.235 20 0 BEADLO Cc1cc(C[N@H+](C)CCc2c(C)noc2C)no1 ZINC000164802570 386328303 /nfs/dbraw/zinc/32/83/03/386328303.db2.gz DJVXDBAWNKAMLQ-UHFFFAOYSA-N 1 2 249.314 2.262 20 0 BEADLO Cc1cc(C[N@@H+](C)CCc2c(C)noc2C)no1 ZINC000164802570 386328310 /nfs/dbraw/zinc/32/83/10/386328310.db2.gz DJVXDBAWNKAMLQ-UHFFFAOYSA-N 1 2 249.314 2.262 20 0 BEADLO CCOCC[N@@H+]1CCc2ccc(F)c(F)c2C1 ZINC000336677292 386328455 /nfs/dbraw/zinc/32/84/55/386328455.db2.gz AYOPITBLDPKMTI-UHFFFAOYSA-N 1 2 241.281 2.359 20 0 BEADLO CCOCC[N@H+]1CCc2ccc(F)c(F)c2C1 ZINC000336677292 386328461 /nfs/dbraw/zinc/32/84/61/386328461.db2.gz AYOPITBLDPKMTI-UHFFFAOYSA-N 1 2 241.281 2.359 20 0 BEADLO Fc1ccc(F)c(CN2CCc3[nH+]c[nH]c3C2)c1 ZINC000647933228 386334707 /nfs/dbraw/zinc/33/47/07/386334707.db2.gz GTSNZQBLZFOVFB-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO C[C@@H]1SCC[C@@H]1Nc1cc[nH+]c2ccncc12 ZINC000645402926 386440534 /nfs/dbraw/zinc/44/05/34/386440534.db2.gz VFRGOICKBPOHFN-ONGXEEELSA-N 1 2 245.351 2.358 20 0 BEADLO CCOc1nnc(C[N@@H+]2C[C@@H](C)C[C@@H]2C)s1 ZINC000336705386 386395860 /nfs/dbraw/zinc/39/58/60/386395860.db2.gz QEAQPWXNFDLPII-IUCAKERBSA-N 1 2 241.360 2.167 20 0 BEADLO CCOc1nnc(C[N@H+]2C[C@@H](C)C[C@@H]2C)s1 ZINC000336705386 386395863 /nfs/dbraw/zinc/39/58/63/386395863.db2.gz QEAQPWXNFDLPII-IUCAKERBSA-N 1 2 241.360 2.167 20 0 BEADLO O=C(CCn1cc[nH+]c1)N1CCC[C@H]2CCC[C@H]21 ZINC000266121149 386400370 /nfs/dbraw/zinc/40/03/70/386400370.db2.gz UJZZJSZOPVECJQ-CHWSQXEVSA-N 1 2 247.342 2.064 20 0 BEADLO Cc1nnc(C[N@@H+]2CCc3cccc(C)c3C2)o1 ZINC000277056966 386403259 /nfs/dbraw/zinc/40/32/59/386403259.db2.gz CVWBDLHYJULROS-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1nnc(C[N@H+]2CCc3cccc(C)c3C2)o1 ZINC000277056966 386403266 /nfs/dbraw/zinc/40/32/66/386403266.db2.gz CVWBDLHYJULROS-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO O=C(CCC1CC1)Nc1cccc2[nH+]ccn21 ZINC000266146321 386403533 /nfs/dbraw/zinc/40/35/33/386403533.db2.gz UYAPLQDWALQLJW-UHFFFAOYSA-N 1 2 229.283 2.463 20 0 BEADLO C[C@H]([NH2+]Cc1cncc(F)c1)c1ccon1 ZINC000336776931 386408642 /nfs/dbraw/zinc/40/86/42/386408642.db2.gz GYHDQZKURHEPMH-QMMMGPOBSA-N 1 2 221.235 2.060 20 0 BEADLO CCOc1nnc(C[NH+]2[C@H](C)CC[C@H]2C)s1 ZINC000336707694 386415481 /nfs/dbraw/zinc/41/54/81/386415481.db2.gz TZKGFCZTOSTCKD-RKDXNWHRSA-N 1 2 241.360 2.310 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CCc2cccc(F)c2C1 ZINC000290313383 386419686 /nfs/dbraw/zinc/41/96/86/386419686.db2.gz ASDWTWFBKKEPLE-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CCc2cccc(F)c2C1 ZINC000290313383 386419689 /nfs/dbraw/zinc/41/96/89/386419689.db2.gz ASDWTWFBKKEPLE-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO CCOc1nnc(C[N@@H+]2CCC[C@H]2CC)s1 ZINC000336710622 386425558 /nfs/dbraw/zinc/42/55/58/386425558.db2.gz ZVPOCGZFYNRUCB-SECBINFHSA-N 1 2 241.360 2.311 20 0 BEADLO CCOc1nnc(C[N@H+]2CCC[C@H]2CC)s1 ZINC000336710622 386425564 /nfs/dbraw/zinc/42/55/64/386425564.db2.gz ZVPOCGZFYNRUCB-SECBINFHSA-N 1 2 241.360 2.311 20 0 BEADLO CC[C@H](CC(=O)N(C)Cc1[nH]cc[nH+]1)C(C)C ZINC000347515945 386426622 /nfs/dbraw/zinc/42/66/22/386426622.db2.gz KXDJXKGMRKACDJ-LLVKDONJSA-N 1 2 237.347 2.440 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000290424512 386432261 /nfs/dbraw/zinc/43/22/61/386432261.db2.gz MNIMZGDPQJLBML-ZDUSSCGKSA-N 1 2 230.315 2.383 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000290424512 386432265 /nfs/dbraw/zinc/43/22/65/386432265.db2.gz MNIMZGDPQJLBML-ZDUSSCGKSA-N 1 2 230.315 2.383 20 0 BEADLO Cl/C=C(\Cl)C[NH+]1CCSCC1 ZINC000266862335 386432884 /nfs/dbraw/zinc/43/28/84/386432884.db2.gz HCUNXPZAYBSKJR-ALCCZGGFSA-N 1 2 212.145 2.354 20 0 BEADLO CCc1ccc(C[N@H+](C)Cc2nncn2C)cc1 ZINC000299560444 386467478 /nfs/dbraw/zinc/46/74/78/386467478.db2.gz FCLBJZMUEQYDQE-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO CCc1ccc(C[N@@H+](C)Cc2nncn2C)cc1 ZINC000299560444 386467482 /nfs/dbraw/zinc/46/74/82/386467482.db2.gz FCLBJZMUEQYDQE-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO CC1(O)C[NH+](Cc2ccccc2OCC2CC2)C1 ZINC000639253944 386468998 /nfs/dbraw/zinc/46/89/98/386468998.db2.gz JQBOZEOXLNTAEO-UHFFFAOYSA-N 1 2 247.338 2.042 20 0 BEADLO CS[C@@H](C)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000299617222 386472849 /nfs/dbraw/zinc/47/28/49/386472849.db2.gz IFMGXAVFJWTUJI-VIFPVBQESA-N 1 2 249.339 2.333 20 0 BEADLO CCC[C@@](C)(CC)C(=O)N1CCn2c[nH+]cc2C1 ZINC000290883013 386483391 /nfs/dbraw/zinc/48/33/91/386483391.db2.gz DZPMFNSDBAEIAX-CQSZACIVSA-N 1 2 249.358 2.442 20 0 BEADLO CCC1(CC)C[NH+](Cc2cncnc2OC)C1 ZINC000648042816 386486968 /nfs/dbraw/zinc/48/69/68/386486968.db2.gz VLUGYCCSOKLFCZ-UHFFFAOYSA-N 1 2 235.331 2.107 20 0 BEADLO CO[C@@](C)(C(=O)Nc1cc[nH+]c(C)c1)C1CC1 ZINC000290890830 386487118 /nfs/dbraw/zinc/48/71/18/386487118.db2.gz CWXZIEGWBDNZNB-CYBMUJFWSA-N 1 2 234.299 2.144 20 0 BEADLO C[C@H](C(=O)N1CCC(c2[nH]cc[nH+]2)CC1)C1CC1 ZINC000267047088 386487893 /nfs/dbraw/zinc/48/78/93/386487893.db2.gz HZBFOGNWCDRKJX-JTQLQIEISA-N 1 2 247.342 2.162 20 0 BEADLO C[C@@H](C(=O)N1CCC(c2[nH]cc[nH+]2)CC1)C1CC1 ZINC000267047090 386488390 /nfs/dbraw/zinc/48/83/90/386488390.db2.gz HZBFOGNWCDRKJX-SNVBAGLBSA-N 1 2 247.342 2.162 20 0 BEADLO CCC[C@H](C)CC(=O)N1CCn2c[nH+]cc2C1 ZINC000290942128 386489394 /nfs/dbraw/zinc/48/93/94/386489394.db2.gz OPMVKTYJDAYHMA-NSHDSACASA-N 1 2 235.331 2.052 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C[C@@H](C)C(C)C ZINC000267057841 386490932 /nfs/dbraw/zinc/49/09/32/386490932.db2.gz GENLHCWFGIWCRL-SECBINFHSA-N 1 2 223.320 2.017 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H](C)c1cccs1 ZINC000267083629 386491846 /nfs/dbraw/zinc/49/18/46/386491846.db2.gz COYSSVJNHATTSI-MRVPVSSYSA-N 1 2 249.339 2.200 20 0 BEADLO Cn1nc(C2CC2)nc1C[N@@H+]1CCCC(C)(C)C1 ZINC000335435341 386493219 /nfs/dbraw/zinc/49/32/19/386493219.db2.gz NSHFOFQTQMYXMI-UHFFFAOYSA-N 1 2 248.374 2.315 20 0 BEADLO Cn1nc(C2CC2)nc1C[N@H+]1CCCC(C)(C)C1 ZINC000335435341 386493225 /nfs/dbraw/zinc/49/32/25/386493225.db2.gz NSHFOFQTQMYXMI-UHFFFAOYSA-N 1 2 248.374 2.315 20 0 BEADLO c1cn(Cc2nc(CC3CCCCC3)no2)c[nH+]1 ZINC000278143761 386494566 /nfs/dbraw/zinc/49/45/66/386494566.db2.gz QWTJNWFSQFQZRA-UHFFFAOYSA-N 1 2 246.314 2.437 20 0 BEADLO CSC1(C(=O)Nc2cc[nH+]c(C)c2)CCC1 ZINC000335439352 386496361 /nfs/dbraw/zinc/49/63/61/386496361.db2.gz KVVHAAPSZYDZBM-UHFFFAOYSA-N 1 2 236.340 2.036 20 0 BEADLO C[C@@H](C(=O)Nc1cccc2[nH+]ccn21)C1CC1 ZINC000267107052 386497724 /nfs/dbraw/zinc/49/77/24/386497724.db2.gz XPKHDQPUFXVPAX-SECBINFHSA-N 1 2 229.283 2.319 20 0 BEADLO C[N@@H+](Cc1ncc(C2CC2)o1)C[C@H]1CCCO1 ZINC000340660566 386505898 /nfs/dbraw/zinc/50/58/98/386505898.db2.gz RWUAYBVNIAVZEX-LLVKDONJSA-N 1 2 236.315 2.163 20 0 BEADLO C[N@H+](Cc1ncc(C2CC2)o1)C[C@H]1CCCO1 ZINC000340660566 386505904 /nfs/dbraw/zinc/50/59/04/386505904.db2.gz RWUAYBVNIAVZEX-LLVKDONJSA-N 1 2 236.315 2.163 20 0 BEADLO COC(C)(C)CC(=O)Nc1cccc2[nH+]ccn21 ZINC000278328410 386509621 /nfs/dbraw/zinc/50/96/21/386509621.db2.gz KOSJNRFNNGPUIO-UHFFFAOYSA-N 1 2 247.298 2.088 20 0 BEADLO CCCCC(=O)NC(C)(C)c1[nH]cc(C)[nH+]1 ZINC000519638264 386513461 /nfs/dbraw/zinc/51/34/61/386513461.db2.gz CVGLIIDJTSISKQ-UHFFFAOYSA-N 1 2 223.320 2.260 20 0 BEADLO CCc1ccccc1C[NH2+][C@H](C(=O)OC)C1CC1 ZINC000227770481 386513893 /nfs/dbraw/zinc/51/38/93/386513893.db2.gz ZGDYNIUNYBGVKF-AWEZNQCLSA-N 1 2 247.338 2.290 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cncs2)CC2(CCC2)O1 ZINC000335448892 386516746 /nfs/dbraw/zinc/51/67/46/386516746.db2.gz GYYUYNMVHVRHKN-SNVBAGLBSA-N 1 2 238.356 2.287 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cncs2)CC2(CCC2)O1 ZINC000335448892 386516748 /nfs/dbraw/zinc/51/67/48/386516748.db2.gz GYYUYNMVHVRHKN-SNVBAGLBSA-N 1 2 238.356 2.287 20 0 BEADLO Cn1c[nH+]cc1CSC(=S)N1CCCC1 ZINC000267251953 386518089 /nfs/dbraw/zinc/51/80/89/386518089.db2.gz ZULVLCSBDAJYDN-UHFFFAOYSA-N 1 2 241.385 2.034 20 0 BEADLO CC1(C)CC[N@H+](Cc2ccco2)CC[S@]1=O ZINC000335451828 386524452 /nfs/dbraw/zinc/52/44/52/386524452.db2.gz VYEZJFOULDVGFK-MRXNPFEDSA-N 1 2 241.356 2.013 20 0 BEADLO CC1(C)CC[N@@H+](Cc2ccco2)CC[S@]1=O ZINC000335451828 386524455 /nfs/dbraw/zinc/52/44/55/386524455.db2.gz VYEZJFOULDVGFK-MRXNPFEDSA-N 1 2 241.356 2.013 20 0 BEADLO COC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccsc1 ZINC000157125631 386457587 /nfs/dbraw/zinc/45/75/87/386457587.db2.gz GPDVYXVSJYWXJW-NSHDSACASA-N 1 2 239.340 2.276 20 0 BEADLO COC(=O)[C@@H]1CCCC[N@H+]1Cc1ccsc1 ZINC000157125631 386457593 /nfs/dbraw/zinc/45/75/93/386457593.db2.gz GPDVYXVSJYWXJW-NSHDSACASA-N 1 2 239.340 2.276 20 0 BEADLO O=C(CCn1cc[nH+]c1)NCCC1CCCCC1 ZINC000299554169 386464718 /nfs/dbraw/zinc/46/47/18/386464718.db2.gz DNYUYAHSECGMBA-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO FC1C[NH+](C[C@@H]2C[C@@H]2c2ccccc2)C1 ZINC000336618730 386576165 /nfs/dbraw/zinc/57/61/65/386576165.db2.gz XYKUUIIFOUSZRQ-WCQYABFASA-N 1 2 205.276 2.444 20 0 BEADLO C[C@H](CC[NH2+]CC(F)(F)CN)c1ccccc1 ZINC000414921623 386579780 /nfs/dbraw/zinc/57/97/80/386579780.db2.gz AWXZIIRUZODAKN-LLVKDONJSA-N 1 2 242.313 2.364 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)C1CCCCC1 ZINC000278794503 386586620 /nfs/dbraw/zinc/58/66/20/386586620.db2.gz YUIXPUCLAWIRHJ-UHFFFAOYSA-N 1 2 235.331 2.052 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC1CCCCCCC1 ZINC000278805898 386587958 /nfs/dbraw/zinc/58/79/58/386587958.db2.gz ZUJAJXZHDKFRIU-UHFFFAOYSA-N 1 2 249.358 2.490 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)NC1CCCCCCC1 ZINC000278805898 386587967 /nfs/dbraw/zinc/58/79/67/386587967.db2.gz ZUJAJXZHDKFRIU-UHFFFAOYSA-N 1 2 249.358 2.490 20 0 BEADLO CC(C(=O)NCc1[nH]c[nH+]c1C)=C1CCCC1 ZINC000267869730 386593670 /nfs/dbraw/zinc/59/36/70/386593670.db2.gz KBYAGPBWQAPTNI-UHFFFAOYSA-N 1 2 233.315 2.225 20 0 BEADLO Cc1nc(F)ccc1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000278827181 386593941 /nfs/dbraw/zinc/59/39/41/386593941.db2.gz YNNXLMKZIKJBHB-AOOOYVTPSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1nc(F)ccc1C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000278827181 386593946 /nfs/dbraw/zinc/59/39/46/386593946.db2.gz YNNXLMKZIKJBHB-AOOOYVTPSA-N 1 2 238.306 2.138 20 0 BEADLO CO[C@@](C)(C(=O)Nc1ccc(C)[nH+]c1C)C1CC1 ZINC000291349201 386536228 /nfs/dbraw/zinc/53/62/28/386536228.db2.gz NUJRFGPRSCABCQ-CQSZACIVSA-N 1 2 248.326 2.452 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H](C)OC3(CCC3)C2)no1 ZINC000335460656 386539802 /nfs/dbraw/zinc/53/98/02/386539802.db2.gz AWPKNUUUPCPHME-LLVKDONJSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H](C)OC3(CCC3)C2)no1 ZINC000335460656 386539809 /nfs/dbraw/zinc/53/98/09/386539809.db2.gz AWPKNUUUPCPHME-LLVKDONJSA-N 1 2 236.315 2.126 20 0 BEADLO CCC1(C(=O)Nc2cccc3[nH+]ccn32)CC1 ZINC000267525714 386551055 /nfs/dbraw/zinc/55/10/55/386551055.db2.gz OBRLQBNEMKOCPC-UHFFFAOYSA-N 1 2 229.283 2.463 20 0 BEADLO C/C=C(\C)C(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000267532884 386551915 /nfs/dbraw/zinc/55/19/15/386551915.db2.gz TWKNDYXEYLSZKH-LFJXOHPOSA-N 1 2 233.315 2.430 20 0 BEADLO COC[C@@H](C)N(C)c1cc[nH+]c2ccncc21 ZINC000267916380 386597390 /nfs/dbraw/zinc/59/73/90/386597390.db2.gz BOIUMABODCLRBI-SNVBAGLBSA-N 1 2 231.299 2.101 20 0 BEADLO CCc1nc(C)c(C[N@@H+]2CC[C@@H](F)C2)o1 ZINC000335467624 386556845 /nfs/dbraw/zinc/55/68/45/386556845.db2.gz YZBCBNZMLWTPAT-SECBINFHSA-N 1 2 212.268 2.089 20 0 BEADLO CCc1nc(C)c(C[N@H+]2CC[C@@H](F)C2)o1 ZINC000335467624 386556851 /nfs/dbraw/zinc/55/68/51/386556851.db2.gz YZBCBNZMLWTPAT-SECBINFHSA-N 1 2 212.268 2.089 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000291616459 386561072 /nfs/dbraw/zinc/56/10/72/386561072.db2.gz RJDNBDLXNOFAIP-ZDUSSCGKSA-N 1 2 245.330 2.168 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000291616459 386561081 /nfs/dbraw/zinc/56/10/81/386561081.db2.gz RJDNBDLXNOFAIP-ZDUSSCGKSA-N 1 2 245.330 2.168 20 0 BEADLO CC(C)(C)c1nc(NC2(CCO)CC2)cc[nH+]1 ZINC000644866996 386561799 /nfs/dbraw/zinc/56/17/99/386561799.db2.gz ZXLIXKOWENLLCD-UHFFFAOYSA-N 1 2 235.331 2.101 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NCCC1=CCCCC1 ZINC000278682374 386566838 /nfs/dbraw/zinc/56/68/38/386566838.db2.gz QKTXILIVZMAYJO-UHFFFAOYSA-N 1 2 247.342 2.267 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)NCCC1=CCCCC1 ZINC000278682374 386566844 /nfs/dbraw/zinc/56/68/44/386566844.db2.gz QKTXILIVZMAYJO-UHFFFAOYSA-N 1 2 247.342 2.267 20 0 BEADLO Cc1ccc2[nH+]c(CN3CC[C@@H](F)C3)cn2c1 ZINC000335407813 386567966 /nfs/dbraw/zinc/56/79/66/386567966.db2.gz VTTBZALHMXAMMI-LLVKDONJSA-N 1 2 233.290 2.187 20 0 BEADLO Cc1ccc2nc(C[N@@H+]3CC[C@@H](F)C3)cn2c1 ZINC000335407813 386567968 /nfs/dbraw/zinc/56/79/68/386567968.db2.gz VTTBZALHMXAMMI-LLVKDONJSA-N 1 2 233.290 2.187 20 0 BEADLO Cc1ccc2nc(C[N@H+]3CC[C@@H](F)C3)cn2c1 ZINC000335407813 386567970 /nfs/dbraw/zinc/56/79/70/386567970.db2.gz VTTBZALHMXAMMI-LLVKDONJSA-N 1 2 233.290 2.187 20 0 BEADLO NC(=O)c1csc(C[N@@H+]2CC[C@H](F)C2)c1 ZINC000335408926 386570901 /nfs/dbraw/zinc/57/09/01/386570901.db2.gz GJUSZLXLXFABNL-QMMMGPOBSA-N 1 2 228.292 2.175 20 0 BEADLO NC(=O)c1csc(C[N@H+]2CC[C@H](F)C2)c1 ZINC000335408926 386570905 /nfs/dbraw/zinc/57/09/05/386570905.db2.gz GJUSZLXLXFABNL-QMMMGPOBSA-N 1 2 228.292 2.175 20 0 BEADLO CC[C@H]1CC[C@H](C(=O)Nc2cc[nH+]cc2C)O1 ZINC000268095632 386620040 /nfs/dbraw/zinc/62/00/40/386620040.db2.gz HDZTVQWTKPFTGU-CMPLNLGQSA-N 1 2 234.299 2.286 20 0 BEADLO CC[C@@H](C)C[C@@H](CO)Nc1cccc[nH+]1 ZINC000645354666 386631274 /nfs/dbraw/zinc/63/12/74/386631274.db2.gz AVAXGFPUGMJFAI-MNOVXSKESA-N 1 2 208.305 2.291 20 0 BEADLO CCC[C@H](C(=O)NCCc1[nH]cc[nH+]1)C(C)C ZINC000179267386 386631532 /nfs/dbraw/zinc/63/15/32/386631532.db2.gz IYYFMTSCNKARJJ-NSHDSACASA-N 1 2 237.347 2.141 20 0 BEADLO Cc1ccc([S@@](=O)Cc2c[nH+]cn2C)cc1C ZINC000268233133 386633131 /nfs/dbraw/zinc/63/31/31/386633131.db2.gz VRLUYVXDTGEMLB-KRWDZBQOSA-N 1 2 248.351 2.345 20 0 BEADLO CC[C@H]([NH2+]Cc1nccn1C)c1c(C)noc1C ZINC000339788609 386633911 /nfs/dbraw/zinc/63/39/11/386633911.db2.gz SLTKBBYBLABMAY-NSHDSACASA-N 1 2 248.330 2.266 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)C1CCC(C)CC1 ZINC000279132754 386637237 /nfs/dbraw/zinc/63/72/37/386637237.db2.gz CDAIXEWXIKZYCQ-UHFFFAOYSA-N 1 2 249.358 2.298 20 0 BEADLO CCCC1(CNC(=O)CCc2[nH]cc[nH+]2)CCC1 ZINC000279138370 386638007 /nfs/dbraw/zinc/63/80/07/386638007.db2.gz FVLYXEFHYKJMAU-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO Cc1cc[nH+]c(NCCN(C)CC(F)(F)F)c1 ZINC000268294476 386638465 /nfs/dbraw/zinc/63/84/65/386638465.db2.gz FLQPFCVHDMVUKO-UHFFFAOYSA-N 1 2 247.264 2.296 20 0 BEADLO Cc1[nH+]cccc1Cc1noc([C@]2(C)C[C@H]2F)n1 ZINC000335509700 386642812 /nfs/dbraw/zinc/64/28/12/386642812.db2.gz GSQFLKDPOXZSNF-ZWNOBZJWSA-N 1 2 247.273 2.363 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)CCc2[nH]cc[nH+]2)[C@H]1C ZINC000279213487 386649316 /nfs/dbraw/zinc/64/93/16/386649316.db2.gz MSOATDINGRWLDZ-WOPDTQHZSA-N 1 2 249.358 2.283 20 0 BEADLO CCC1(CNC(=O)CCn2cc[nH+]c2)CCCC1 ZINC000268414995 386651122 /nfs/dbraw/zinc/65/11/22/386651122.db2.gz JDOPWYRSHHGSQV-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H](C)OCC1CC1 ZINC000644972788 386651492 /nfs/dbraw/zinc/65/14/92/386651492.db2.gz DBDHDIDYMHNRKT-NSHDSACASA-N 1 2 248.326 2.452 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)[C@H]1CCCC[C@H]1C ZINC000279237066 386653332 /nfs/dbraw/zinc/65/33/32/386653332.db2.gz PTBNOEVVXHCEKB-MFKMUULPSA-N 1 2 249.358 2.298 20 0 BEADLO COC[C@@H](C)CNc1cc[nH+]c2ccncc12 ZINC000267946354 386601589 /nfs/dbraw/zinc/60/15/89/386601589.db2.gz IMTPEOWAZFQPCK-JTQLQIEISA-N 1 2 231.299 2.324 20 0 BEADLO Cc1cnc(C[N@@H+]2CCOCC3(CC3)C2)s1 ZINC000335491839 386610416 /nfs/dbraw/zinc/61/04/16/386610416.db2.gz WGDYLPBFTGXASE-UHFFFAOYSA-N 1 2 238.356 2.064 20 0 BEADLO Cc1cnc(C[N@H+]2CCOCC3(CC3)C2)s1 ZINC000335491839 386610425 /nfs/dbraw/zinc/61/04/25/386610425.db2.gz WGDYLPBFTGXASE-UHFFFAOYSA-N 1 2 238.356 2.064 20 0 BEADLO Cn1cc(Cl)c(C[N@@H+]2CCCSCC2)n1 ZINC000335494470 386613786 /nfs/dbraw/zinc/61/37/86/386613786.db2.gz JHGVREDQFMCSPK-UHFFFAOYSA-N 1 2 245.779 2.012 20 0 BEADLO Cn1cc(Cl)c(C[N@H+]2CCCSCC2)n1 ZINC000335494470 386613791 /nfs/dbraw/zinc/61/37/91/386613791.db2.gz JHGVREDQFMCSPK-UHFFFAOYSA-N 1 2 245.779 2.012 20 0 BEADLO CC[C@@]1(C(C)C)C[C@H]1NC(=O)CCn1cc[nH+]c1 ZINC000457279041 386614026 /nfs/dbraw/zinc/61/40/26/386614026.db2.gz LJHLHDDKAOIZIU-OCCSQVGLSA-N 1 2 249.358 2.214 20 0 BEADLO CC1=CC[N@H+](Cc2nn(C)cc2Cl)CC1 ZINC000335495142 386615519 /nfs/dbraw/zinc/61/55/19/386615519.db2.gz LGPXYJPPKYINNP-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO CC1=CC[N@@H+](Cc2nn(C)cc2Cl)CC1 ZINC000335495142 386615526 /nfs/dbraw/zinc/61/55/26/386615526.db2.gz LGPXYJPPKYINNP-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO FC(F)c1noc(C[NH+]2CCC3(CC3)CC2)n1 ZINC000644927909 386617955 /nfs/dbraw/zinc/61/79/55/386617955.db2.gz UKZFXJFQJIJYBO-UHFFFAOYSA-N 1 2 243.257 2.383 20 0 BEADLO O=C(CCC1CC1)NCc1ccn2cc[nH+]c2c1 ZINC000268500353 386659300 /nfs/dbraw/zinc/65/93/00/386659300.db2.gz HTBOOFJCXDBHRL-UHFFFAOYSA-N 1 2 243.310 2.141 20 0 BEADLO CN(Cc1ncc(Cl)n1C)c1cccc[nH+]1 ZINC000301455483 386661504 /nfs/dbraw/zinc/66/15/04/386661504.db2.gz WGDBIXKUYIPHJM-UHFFFAOYSA-N 1 2 236.706 2.105 20 0 BEADLO Cc1cc(C[N@H+]2CCOC[C@@H]2CC(C)C)ncn1 ZINC000292401774 386663836 /nfs/dbraw/zinc/66/38/36/386663836.db2.gz JNYBFFLAJIPEQU-AWEZNQCLSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC[C@@H]2CC(C)C)ncn1 ZINC000292401774 386663840 /nfs/dbraw/zinc/66/38/40/386663840.db2.gz JNYBFFLAJIPEQU-AWEZNQCLSA-N 1 2 249.358 2.032 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)c1nccc2occc21 ZINC000428125876 386664969 /nfs/dbraw/zinc/66/49/69/386664969.db2.gz QZKWHKVOYQXZMC-UHFFFAOYSA-N 1 2 228.255 2.187 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1CCOC[C@@H]1C ZINC000335527090 386671511 /nfs/dbraw/zinc/67/15/11/386671511.db2.gz FQBQIDNRABCPNJ-JQWIXIFHSA-N 1 2 248.326 2.310 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)C[C@H]1CCCO1 ZINC000335528172 386672465 /nfs/dbraw/zinc/67/24/65/386672465.db2.gz BALFFGADRWPPQP-LLVKDONJSA-N 1 2 234.299 2.206 20 0 BEADLO Cc1ccoc1C[N@@H+](C)[C@H](C)c1nnc(C)o1 ZINC000292453709 386673849 /nfs/dbraw/zinc/67/38/49/386673849.db2.gz YDFZIZVYJLSHJP-SECBINFHSA-N 1 2 235.287 2.472 20 0 BEADLO Cc1ccoc1C[N@H+](C)[C@H](C)c1nnc(C)o1 ZINC000292453709 386673854 /nfs/dbraw/zinc/67/38/54/386673854.db2.gz YDFZIZVYJLSHJP-SECBINFHSA-N 1 2 235.287 2.472 20 0 BEADLO CO[C@H]1CC[N@H+](C/C(Cl)=C/Cl)C1 ZINC000268643151 386676538 /nfs/dbraw/zinc/67/65/38/386676538.db2.gz HWAMSSAVXIJASJ-NZGHECTNSA-N 1 2 210.104 2.026 20 0 BEADLO CO[C@H]1CC[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000268643151 386676547 /nfs/dbraw/zinc/67/65/47/386676547.db2.gz HWAMSSAVXIJASJ-NZGHECTNSA-N 1 2 210.104 2.026 20 0 BEADLO CC[C@@H]1CCC[C@H](CNCC(F)(F)C[NH3+])C1 ZINC000414927437 386682720 /nfs/dbraw/zinc/68/27/20/386682720.db2.gz LCMCJNCCFKZXFX-MNOVXSKESA-N 1 2 234.334 2.386 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)Cc1cncs1 ZINC000335531179 386681023 /nfs/dbraw/zinc/68/10/23/386681023.db2.gz WMKMNXBCRGXBBS-UHFFFAOYSA-N 1 2 247.323 2.336 20 0 BEADLO C[C@@H](O)[C@H]1CCCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000301882493 386681883 /nfs/dbraw/zinc/68/18/83/386681883.db2.gz MXWDVJXPQPHCRR-MNOVXSKESA-N 1 2 245.326 2.160 20 0 BEADLO CCn1c[nH+]cc1CN(CC(F)F)C1CC1 ZINC000417776991 386709917 /nfs/dbraw/zinc/70/99/17/386709917.db2.gz RYBBXJFZAVUVKZ-UHFFFAOYSA-N 1 2 229.274 2.133 20 0 BEADLO Cc1ccc(N(C)C(=O)CCc2[nH]cc[nH+]2)cc1 ZINC000279474892 386687987 /nfs/dbraw/zinc/68/79/87/386687987.db2.gz QCBAEORYEOHDKC-UHFFFAOYSA-N 1 2 243.310 2.314 20 0 BEADLO COC(=O)C[N@@H+]1CCC[C@@H]1c1ccc(OC)cc1 ZINC000247828744 386733623 /nfs/dbraw/zinc/73/36/23/386733623.db2.gz KKOZVYVDHZHHCW-CYBMUJFWSA-N 1 2 249.310 2.005 20 0 BEADLO COC(=O)C[N@H+]1CCC[C@@H]1c1ccc(OC)cc1 ZINC000247828744 386733630 /nfs/dbraw/zinc/73/36/30/386733630.db2.gz KKOZVYVDHZHHCW-CYBMUJFWSA-N 1 2 249.310 2.005 20 0 BEADLO C[NH2+]Cc1noc([C@@H](SC)c2ccccc2)n1 ZINC000414494647 386735008 /nfs/dbraw/zinc/73/50/08/386735008.db2.gz ADXJTSQMSKZJPB-NSHDSACASA-N 1 2 249.339 2.241 20 0 BEADLO COc1ncncc1C[N@H+](C)Cc1cccs1 ZINC000647999077 386738034 /nfs/dbraw/zinc/73/80/34/386738034.db2.gz YSXVISKWMPXLOQ-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1ncncc1C[N@@H+](C)Cc1cccs1 ZINC000647999077 386738040 /nfs/dbraw/zinc/73/80/40/386738040.db2.gz YSXVISKWMPXLOQ-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@]3(CC[C@@H](C)C3)C2)no1 ZINC000334140558 386740001 /nfs/dbraw/zinc/74/00/01/386740001.db2.gz HFGZVYGXALLNHA-ZWNOBZJWSA-N 1 2 235.331 2.390 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@]3(CC[C@@H](C)C3)C2)no1 ZINC000334140558 386740006 /nfs/dbraw/zinc/74/00/06/386740006.db2.gz HFGZVYGXALLNHA-ZWNOBZJWSA-N 1 2 235.331 2.390 20 0 BEADLO CC[C@H](Nc1nc(C)[nH+]c2c1CCCC2)[C@@H](C)O ZINC000450804282 386713522 /nfs/dbraw/zinc/71/35/22/386713522.db2.gz XYTZEOVEYGKCJN-SKDRFNHKSA-N 1 2 249.358 2.235 20 0 BEADLO O[C@@H]1CC[C@H]2CN(c3cccc[nH+]3)CC[C@H]2C1 ZINC000450804679 386713992 /nfs/dbraw/zinc/71/39/92/386713992.db2.gz NHVDUNZPVYOUEO-RWMBFGLXSA-N 1 2 232.327 2.069 20 0 BEADLO O[C@@H]1CC[C@H]2CN(c3cccc[nH+]3)CC[C@@H]2C1 ZINC000450804677 386715330 /nfs/dbraw/zinc/71/53/30/386715330.db2.gz NHVDUNZPVYOUEO-FRRDWIJNSA-N 1 2 232.327 2.069 20 0 BEADLO CC(C)COC1CC[NH+](Cc2cocn2)CC1 ZINC000191935685 386715644 /nfs/dbraw/zinc/71/56/44/386715644.db2.gz ZGRUZQWOTDALIC-UHFFFAOYSA-N 1 2 238.331 2.312 20 0 BEADLO c1nn[nH]c1CC[N@@H+]1CCC[C@H]1C1CCCCC1 ZINC000647959912 386720972 /nfs/dbraw/zinc/72/09/72/386720972.db2.gz UPMOHHAJIKNYED-AWEZNQCLSA-N 1 2 248.374 2.392 20 0 BEADLO c1nn[nH]c1CC[N@H+]1CCC[C@H]1C1CCCCC1 ZINC000647959912 386720981 /nfs/dbraw/zinc/72/09/81/386720981.db2.gz UPMOHHAJIKNYED-AWEZNQCLSA-N 1 2 248.374 2.392 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)/C=C/C(C)(C)C ZINC000269124345 386753230 /nfs/dbraw/zinc/75/32/30/386753230.db2.gz VBAUPRJJLRJCBR-VOTSOKGWSA-N 1 2 249.358 2.334 20 0 BEADLO COCc1ccccc1C[NH2+]Cc1cocn1 ZINC000192282742 386753202 /nfs/dbraw/zinc/75/32/02/386753202.db2.gz RDXWHBDUWRNVKA-UHFFFAOYSA-N 1 2 232.283 2.111 20 0 BEADLO C[C@H]([NH2+]Cc1cocn1)c1cccc(O)c1 ZINC000192308068 386754933 /nfs/dbraw/zinc/75/49/33/386754933.db2.gz ZVEATDDRXAWJHA-VIFPVBQESA-N 1 2 218.256 2.231 20 0 BEADLO Cn1cc(C[N@@H+]2CCC[C@@H]2CF)c(C(F)F)n1 ZINC000292992005 386760662 /nfs/dbraw/zinc/76/06/62/386760662.db2.gz IJUPLPPGRNDJMO-SECBINFHSA-N 1 2 247.264 2.292 20 0 BEADLO Cn1cc(C[N@H+]2CCC[C@@H]2CF)c(C(F)F)n1 ZINC000292992005 386760665 /nfs/dbraw/zinc/76/06/65/386760665.db2.gz IJUPLPPGRNDJMO-SECBINFHSA-N 1 2 247.264 2.292 20 0 BEADLO CC[C@H](NC(=O)CCn1cc[nH+]c1)C(C)(C)C ZINC000357375581 386770033 /nfs/dbraw/zinc/77/00/33/386770033.db2.gz VBKVLSZAYAKDIA-NSHDSACASA-N 1 2 237.347 2.214 20 0 BEADLO FC(F)(F)[C@H]([NH2+]CC[C@H]1CCOC1)C1CC1 ZINC000336668794 386795869 /nfs/dbraw/zinc/79/58/69/386795869.db2.gz GJMZTLCTAGEIFP-WCBMZHEXSA-N 1 2 237.265 2.344 20 0 BEADLO COC(=O)[C@@H](c1ccsc1)[N@@H+]1CCC[C@@H]1C ZINC000280048150 386772996 /nfs/dbraw/zinc/77/29/96/386772996.db2.gz OPKVCONGKSHHMS-GXSJLCMTSA-N 1 2 239.340 2.447 20 0 BEADLO COC(=O)[C@@H](c1ccsc1)[N@H+]1CCC[C@@H]1C ZINC000280048150 386772998 /nfs/dbraw/zinc/77/29/98/386772998.db2.gz OPKVCONGKSHHMS-GXSJLCMTSA-N 1 2 239.340 2.447 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C[C@@H]1CCC(=O)[C@@H]1C ZINC000280104802 386778559 /nfs/dbraw/zinc/77/85/59/386778559.db2.gz CGUBLMPTIJBZDF-MNOVXSKESA-N 1 2 246.310 2.334 20 0 BEADLO C[N@@H+](Cc1csc(Cl)n1)C[C@H]1CCCO1 ZINC000290130552 386782781 /nfs/dbraw/zinc/78/27/81/386782781.db2.gz UYWUKWQVGIXHFB-SECBINFHSA-N 1 2 246.763 2.407 20 0 BEADLO C[N@H+](Cc1csc(Cl)n1)C[C@H]1CCCO1 ZINC000290130552 386782787 /nfs/dbraw/zinc/78/27/87/386782787.db2.gz UYWUKWQVGIXHFB-SECBINFHSA-N 1 2 246.763 2.407 20 0 BEADLO FC(F)(F)c1cccnc1Cn1cc[nH+]c1 ZINC000428069915 386783826 /nfs/dbraw/zinc/78/38/26/386783826.db2.gz MGFFRPTYYOQERG-UHFFFAOYSA-N 1 2 227.189 2.345 20 0 BEADLO CCn1c[nH+]cc1CNc1cccc2c1OCO2 ZINC000417979045 386785122 /nfs/dbraw/zinc/78/51/22/386785122.db2.gz ILBBSIATODWOAN-UHFFFAOYSA-N 1 2 245.282 2.244 20 0 BEADLO C[C@@H](CC1CCCC1)C(=O)Nc1cc[nH+]cc1O ZINC000330543895 386785352 /nfs/dbraw/zinc/78/53/52/386785352.db2.gz JGZGJGHTKZUFGR-JTQLQIEISA-N 1 2 248.326 2.364 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ncn(-c3ccccc3)n2)[C@H]1C ZINC000293425382 386816411 /nfs/dbraw/zinc/81/64/11/386816411.db2.gz NJJSPCNWGDAQQJ-NEPJUHHUSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ncn(-c3ccccc3)n2)[C@H]1C ZINC000293425382 386816418 /nfs/dbraw/zinc/81/64/18/386816418.db2.gz NJJSPCNWGDAQQJ-NEPJUHHUSA-N 1 2 242.326 2.108 20 0 BEADLO c1c[nH+]c([C@H]2CCCN2Cc2cncs2)[nH]1 ZINC000334769959 386819501 /nfs/dbraw/zinc/81/95/01/386819501.db2.gz BWJNUCZVDLSDRL-SNVBAGLBSA-N 1 2 234.328 2.203 20 0 BEADLO CC(C)c1nnc(C[NH2+][C@H](C)c2ccccn2)[nH]1 ZINC000293283569 386797025 /nfs/dbraw/zinc/79/70/25/386797025.db2.gz UACJQWBVAAYPJR-SNVBAGLBSA-N 1 2 245.330 2.174 20 0 BEADLO Cn1cc2c(n1)CCC[C@@H]2[NH2+]Cc1cscn1 ZINC000280256351 386797573 /nfs/dbraw/zinc/79/75/73/386797573.db2.gz WYBMRCWKWMMZQY-NSHDSACASA-N 1 2 248.355 2.044 20 0 BEADLO CO[C@H]1CCC[C@H]1CNc1cc[nH+]c(C(C)C)n1 ZINC000340953003 386804887 /nfs/dbraw/zinc/80/48/87/386804887.db2.gz QACXONZDISOOKO-RYUDHWBXSA-N 1 2 249.358 2.249 20 0 BEADLO CC(C)CC[C@@H](O)C[N@H+](C)Cc1cscn1 ZINC000280333789 386805876 /nfs/dbraw/zinc/80/58/76/386805876.db2.gz QPFMPSSASFPACC-GFCCVEGCSA-N 1 2 242.388 2.372 20 0 BEADLO CC(C)CC[C@@H](O)C[N@@H+](C)Cc1cscn1 ZINC000280333789 386805884 /nfs/dbraw/zinc/80/58/84/386805884.db2.gz QPFMPSSASFPACC-GFCCVEGCSA-N 1 2 242.388 2.372 20 0 BEADLO CO[C@@H]1CCC[C@@H]1CNc1cc[nH+]c(C(C)C)n1 ZINC000340953004 386806616 /nfs/dbraw/zinc/80/66/16/386806616.db2.gz QACXONZDISOOKO-VXGBXAGGSA-N 1 2 249.358 2.249 20 0 BEADLO CC(C)c1nc(NCC2CCC2)cc[nH+]1 ZINC000336761833 386808133 /nfs/dbraw/zinc/80/81/33/386808133.db2.gz NPNMLDVSMXGYRD-UHFFFAOYSA-N 1 2 205.305 2.234 20 0 BEADLO Cc1nnc(C[NH2+][C@H](C)c2cccnc2)s1 ZINC000336671441 386810087 /nfs/dbraw/zinc/81/00/87/386810087.db2.gz GYYSFRXSRZNOAU-MRVPVSSYSA-N 1 2 234.328 2.092 20 0 BEADLO CC(C)C[C@@H](O)CNc1cc[nH+]c(C2CC2)n1 ZINC000301224665 386824513 /nfs/dbraw/zinc/82/45/13/386824513.db2.gz CTVNEJPSNSWHBY-LLVKDONJSA-N 1 2 235.331 2.173 20 0 BEADLO C[C@@H]1CCC[C@@H](C[N@H+](CCO)CC(F)F)C1 ZINC000193026727 386812219 /nfs/dbraw/zinc/81/22/19/386812219.db2.gz BAGXLTMXBNVGAC-GHMZBOCLSA-N 1 2 235.318 2.372 20 0 BEADLO C[C@@H]1CCC[C@@H](C[N@@H+](CCO)CC(F)F)C1 ZINC000193026727 386812223 /nfs/dbraw/zinc/81/22/23/386812223.db2.gz BAGXLTMXBNVGAC-GHMZBOCLSA-N 1 2 235.318 2.372 20 0 BEADLO CC/C=C\C[NH2+][C@H](CCCC)C(=O)OC ZINC000395047533 386812571 /nfs/dbraw/zinc/81/25/71/386812571.db2.gz LIYQLURCWQODMF-BPOWMSRESA-N 1 2 213.321 2.274 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1cc(C)sc1C ZINC000280439010 386813297 /nfs/dbraw/zinc/81/32/97/386813297.db2.gz CLAKXEHUGHLUOO-SECBINFHSA-N 1 2 241.356 2.358 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1cc(C)sc1C ZINC000280439010 386813301 /nfs/dbraw/zinc/81/33/01/386813301.db2.gz CLAKXEHUGHLUOO-SECBINFHSA-N 1 2 241.356 2.358 20 0 BEADLO CC[C@H](C[NH2+]CC(F)(F)CN)c1ccccc1 ZINC000414936438 386829052 /nfs/dbraw/zinc/82/90/52/386829052.db2.gz VXLNGKRSWQBMJP-LLVKDONJSA-N 1 2 242.313 2.364 20 0 BEADLO C[NH2+]Cc1noc(C2C[C@@H](C)C[C@H](C)C2)n1 ZINC000334778284 386830242 /nfs/dbraw/zinc/83/02/42/386830242.db2.gz OJWNSPDMMGBYFA-IUCAKERBSA-N 1 2 223.320 2.329 20 0 BEADLO CC1(C)C(CNC(=O)CCn2cc[nH+]c2)C1(C)C ZINC000280677652 386833833 /nfs/dbraw/zinc/83/38/33/386833833.db2.gz WBWLKOQJZLDPDV-UHFFFAOYSA-N 1 2 249.358 2.072 20 0 BEADLO Cc1nc(C(C)C)ccc1C[NH+]1CCN(C)CC1 ZINC000293553351 386836387 /nfs/dbraw/zinc/83/63/87/386836387.db2.gz RHXOXBGBZYLDQW-UHFFFAOYSA-N 1 2 247.386 2.261 20 0 BEADLO CC(=O)c1sccc1OCc1c[nH+]cn1C ZINC000280726128 386840919 /nfs/dbraw/zinc/84/09/19/386840919.db2.gz JMWFALZAINXOKO-UHFFFAOYSA-N 1 2 236.296 2.263 20 0 BEADLO CSCC[C@H](C)N(C)c1cc(C)[nH+]cn1 ZINC000301419350 386843334 /nfs/dbraw/zinc/84/33/34/386843334.db2.gz DJLLYSUUGLKFFS-JTQLQIEISA-N 1 2 225.361 2.363 20 0 BEADLO CCCC[C@H]([NH2+][C@H]1CC[C@@H]1SC)C(=O)OC ZINC000425335128 386847925 /nfs/dbraw/zinc/84/79/25/386847925.db2.gz HOPMXLXOTUNOOF-DCAQKATOSA-N 1 2 245.388 2.202 20 0 BEADLO C[N@H+](CCF)Cc1cncc(Br)c1 ZINC000293613951 386848914 /nfs/dbraw/zinc/84/89/14/386848914.db2.gz KEKAUQKJRFFSAR-UHFFFAOYSA-N 1 2 247.111 2.245 20 0 BEADLO C[N@@H+](CCF)Cc1cncc(Br)c1 ZINC000293613951 386848918 /nfs/dbraw/zinc/84/89/18/386848918.db2.gz KEKAUQKJRFFSAR-UHFFFAOYSA-N 1 2 247.111 2.245 20 0 BEADLO Cc1cc(N[C@H](C)CF)nc(C(C)C)[nH+]1 ZINC000336674405 386850423 /nfs/dbraw/zinc/85/04/23/386850423.db2.gz AEMRIBIVDHPCTE-SECBINFHSA-N 1 2 211.284 2.100 20 0 BEADLO Cc1ccsc1C[N@H+](C)Cc1ncc[nH]1 ZINC000349525700 386852131 /nfs/dbraw/zinc/85/21/31/386852131.db2.gz WCFPVVWATGPDJS-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1ccsc1C[N@@H+](C)Cc1ncc[nH]1 ZINC000349525700 386852135 /nfs/dbraw/zinc/85/21/35/386852135.db2.gz WCFPVVWATGPDJS-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO CO[C@]1(C)C[C@H](N(C)c2cc(C)[nH+]cn2)C1(C)C ZINC000301550166 386852577 /nfs/dbraw/zinc/85/25/77/386852577.db2.gz GMGKETULRRRCEF-SMDDNHRTSA-N 1 2 249.358 2.425 20 0 BEADLO Cn1cnnc1C[N@H+](C)[C@@H]1C=CCCCCC1 ZINC000293649138 386854627 /nfs/dbraw/zinc/85/46/27/386854627.db2.gz SFTPCLBMWBPNJW-GFCCVEGCSA-N 1 2 234.347 2.136 20 0 BEADLO Cn1cnnc1C[N@@H+](C)[C@@H]1C=CCCCCC1 ZINC000293649138 386854634 /nfs/dbraw/zinc/85/46/34/386854634.db2.gz SFTPCLBMWBPNJW-GFCCVEGCSA-N 1 2 234.347 2.136 20 0 BEADLO CN(C[C@H]1CCOC1)c1cc[nH+]c(C(C)(C)C)n1 ZINC000301562062 386855318 /nfs/dbraw/zinc/85/53/18/386855318.db2.gz ITGDFOMIBNGQOJ-LLVKDONJSA-N 1 2 249.358 2.247 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1CCC(F)(F)C1 ZINC000334790838 386856155 /nfs/dbraw/zinc/85/61/55/386856155.db2.gz MTHTWGGKUREODK-SECBINFHSA-N 1 2 240.253 2.186 20 0 BEADLO C[C@@H](C[NH+]1CC(O)(C(F)F)C1)c1ccccc1 ZINC000425345341 386856452 /nfs/dbraw/zinc/85/64/52/386856452.db2.gz GKLXHIJGMSXRFA-JTQLQIEISA-N 1 2 241.281 2.102 20 0 BEADLO C[C@@H](CCO)CNc1cc[nH+]c(C(C)(C)C)n1 ZINC000301564509 386856679 /nfs/dbraw/zinc/85/66/79/386856679.db2.gz JGAYSXGZSFCIPL-JTQLQIEISA-N 1 2 237.347 2.205 20 0 BEADLO CCC(=O)N1CC[N@H+](Cc2ccc(CC)cc2)C1 ZINC000425346018 386858852 /nfs/dbraw/zinc/85/88/52/386858852.db2.gz IRLSGLLQJRMNLD-UHFFFAOYSA-N 1 2 246.354 2.261 20 0 BEADLO CCC(=O)N1CC[N@@H+](Cc2ccc(CC)cc2)C1 ZINC000425346018 386858856 /nfs/dbraw/zinc/85/88/56/386858856.db2.gz IRLSGLLQJRMNLD-UHFFFAOYSA-N 1 2 246.354 2.261 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1ccc(F)cc1F ZINC000293687618 386860053 /nfs/dbraw/zinc/86/00/53/386860053.db2.gz WCQHPKIBLCHIEX-NSHDSACASA-N 1 2 227.254 2.186 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1ccc(F)cc1F ZINC000293687618 386860058 /nfs/dbraw/zinc/86/00/58/386860058.db2.gz WCQHPKIBLCHIEX-NSHDSACASA-N 1 2 227.254 2.186 20 0 BEADLO Cc1cc(CN(C)c2nc(C)[nH+]c(C)c2C)no1 ZINC000301671464 386864686 /nfs/dbraw/zinc/86/46/86/386864686.db2.gz FOIOGMUTQIWHGT-UHFFFAOYSA-N 1 2 246.314 2.335 20 0 BEADLO CC[C@H](NCc1c[nH+]cn1CC)C(F)(F)F ZINC000418006845 386865966 /nfs/dbraw/zinc/86/59/66/386865966.db2.gz FJPSECXZECGQER-VIFPVBQESA-N 1 2 235.253 2.334 20 0 BEADLO Cc1[nH]ccc1C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000334829542 386866582 /nfs/dbraw/zinc/86/65/82/386866582.db2.gz ZOXHUOHHCOLERX-NSHDSACASA-N 1 2 244.298 2.024 20 0 BEADLO Cc1nc(C[N@@H+]2CCOCC2(C)C)c(C)s1 ZINC000335745964 386867121 /nfs/dbraw/zinc/86/71/21/386867121.db2.gz GOPVVWFEENREOW-UHFFFAOYSA-N 1 2 240.372 2.371 20 0 BEADLO Cc1nc(C[N@H+]2CCOCC2(C)C)c(C)s1 ZINC000335745964 386867128 /nfs/dbraw/zinc/86/71/28/386867128.db2.gz GOPVVWFEENREOW-UHFFFAOYSA-N 1 2 240.372 2.371 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+]2CCOCC3(CC3)C2)o1 ZINC000335745758 386867905 /nfs/dbraw/zinc/86/79/05/386867905.db2.gz IAIJAOCFMHDUET-NSHDSACASA-N 1 2 236.315 2.156 20 0 BEADLO Cc1cnc([C@H](C)[N@H+]2CCOCC3(CC3)C2)o1 ZINC000335745758 386867910 /nfs/dbraw/zinc/86/79/10/386867910.db2.gz IAIJAOCFMHDUET-NSHDSACASA-N 1 2 236.315 2.156 20 0 BEADLO C[N@H+](CCF)Cc1cc(F)ccc1F ZINC000293739143 386872085 /nfs/dbraw/zinc/87/20/85/386872085.db2.gz VQSKONYERXRDCM-UHFFFAOYSA-N 1 2 203.207 2.366 20 0 BEADLO C[N@@H+](CCF)Cc1cc(F)ccc1F ZINC000293739143 386872089 /nfs/dbraw/zinc/87/20/89/386872089.db2.gz VQSKONYERXRDCM-UHFFFAOYSA-N 1 2 203.207 2.366 20 0 BEADLO Cn1c[nH+]cc1Cc1noc(/C=C/C(C)(C)C)n1 ZINC000357963362 386873337 /nfs/dbraw/zinc/87/33/37/386873337.db2.gz VBIAIFKUSDDVLA-AATRIKPKSA-N 1 2 246.314 2.453 20 0 BEADLO Cc1c[nH+]c(CNc2cnn(CC(C)C)c2)n1C ZINC000341274204 386874170 /nfs/dbraw/zinc/87/41/70/386874170.db2.gz DYMIKBQVYOJWGY-UHFFFAOYSA-N 1 2 247.346 2.193 20 0 BEADLO Fc1ccccc1C1C[NH+](Cc2cc[nH]n2)C1 ZINC000335751404 386877148 /nfs/dbraw/zinc/87/71/48/386877148.db2.gz UTXHENXZWQHRLI-UHFFFAOYSA-N 1 2 231.274 2.148 20 0 BEADLO CC(C)[C@@H](NC(=O)[C@H](C)C1CC1)c1[nH]cc[nH+]1 ZINC000331704061 386883087 /nfs/dbraw/zinc/88/30/87/386883087.db2.gz XMRVVLHGPPJUCK-MWLCHTKSSA-N 1 2 235.331 2.269 20 0 BEADLO Cc1c[nH+]c(CN[C@H](C)c2ccncc2F)n1C ZINC000341337202 386884758 /nfs/dbraw/zinc/88/47/58/386884758.db2.gz FSWJHQFDFOSNGU-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO Cc1cnc(C[NH2+][C@H](C)c2ccncc2F)n1C ZINC000341337202 386884763 /nfs/dbraw/zinc/88/47/63/386884763.db2.gz FSWJHQFDFOSNGU-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO CS(=O)(=O)Nc1cc[nH+]c(-c2ccccc2)c1 ZINC000335759099 386888596 /nfs/dbraw/zinc/88/85/96/386888596.db2.gz NSZWOHNEIFHICN-UHFFFAOYSA-N 1 2 248.307 2.120 20 0 BEADLO C[C@@H]1CCN(c2nc(N)c3ccccc3[nH+]2)[C@H]1C ZINC000301910279 386889873 /nfs/dbraw/zinc/88/98/73/386889873.db2.gz SBUVWBDMYMJTSR-ZJUUUORDSA-N 1 2 242.326 2.447 20 0 BEADLO CCc1ccc(C[N@@H+]2CCOCC23CC3)cn1 ZINC000335769737 386913884 /nfs/dbraw/zinc/91/38/84/386913884.db2.gz MSBKZBPCPVSMKZ-UHFFFAOYSA-N 1 2 232.327 2.009 20 0 BEADLO CCc1ccc(C[N@H+]2CCOCC23CC3)cn1 ZINC000335769737 386913887 /nfs/dbraw/zinc/91/38/87/386913887.db2.gz MSBKZBPCPVSMKZ-UHFFFAOYSA-N 1 2 232.327 2.009 20 0 BEADLO Cc1c[nH+]c(CNc2ccc3n[nH]cc3c2)n1C ZINC000341396156 386901546 /nfs/dbraw/zinc/90/15/46/386901546.db2.gz PDJIPXHRYPCHRQ-UHFFFAOYSA-N 1 2 241.298 2.217 20 0 BEADLO CCCCC[N@@H+]1CCCC[C@H]1c1n[nH]c(=O)[nH]1 ZINC000330865744 386906112 /nfs/dbraw/zinc/90/61/12/386906112.db2.gz XLQHNDFZVLUSQB-JTQLQIEISA-N 1 2 238.335 2.228 20 0 BEADLO CCCCC[N@H+]1CCCC[C@H]1c1n[nH]c(=O)[nH]1 ZINC000330865744 386906116 /nfs/dbraw/zinc/90/61/16/386906116.db2.gz XLQHNDFZVLUSQB-JTQLQIEISA-N 1 2 238.335 2.228 20 0 BEADLO Cn1ccnc1CNc1ccc2c(c1)CCC[NH2+]2 ZINC000334866334 386924279 /nfs/dbraw/zinc/92/42/79/386924279.db2.gz XZGVHFFMRVABQJ-UHFFFAOYSA-N 1 2 242.326 2.390 20 0 BEADLO CC(C)c1nc(NC[C@@H]2CC[C@@H](O)C2)cc[nH+]1 ZINC000302673476 386929402 /nfs/dbraw/zinc/92/94/02/386929402.db2.gz LORWPWPXMPEHGY-GHMZBOCLSA-N 1 2 235.331 2.173 20 0 BEADLO CC(C)c1nc(NC[C@H]2CC[C@H](O)C2)cc[nH+]1 ZINC000302673478 386929751 /nfs/dbraw/zinc/92/97/51/386929751.db2.gz LORWPWPXMPEHGY-QWRGUYRKSA-N 1 2 235.331 2.173 20 0 BEADLO CN(CC[C@H]1CCCO1)c1cccc[nH+]1 ZINC000302699651 386932179 /nfs/dbraw/zinc/93/21/79/386932179.db2.gz HWKJOFDYGOYPBY-LLVKDONJSA-N 1 2 206.289 2.087 20 0 BEADLO c1[nH+]cn2c1CN(c1nc3ccccc3o1)CC2 ZINC000368172015 386947839 /nfs/dbraw/zinc/94/78/39/386947839.db2.gz XLPPQZNYJFONNK-UHFFFAOYSA-N 1 2 240.266 2.045 20 0 BEADLO Cc1nc(N[C@@H]2C[C@H]2c2ccco2)cc[nH+]1 ZINC000334824648 386956153 /nfs/dbraw/zinc/95/61/53/386956153.db2.gz ZUBACZYWERUOFM-NXEZZACHSA-N 1 2 215.256 2.346 20 0 BEADLO c1ccc2nc(C[N@@H+]3CCO[C@H]4C[C@H]43)ccc2c1 ZINC000368334202 386961771 /nfs/dbraw/zinc/96/17/71/386961771.db2.gz VSGRNVDBVJBIKZ-CABCVRRESA-N 1 2 240.306 2.208 20 0 BEADLO c1ccc2nc(C[N@H+]3CCO[C@H]4C[C@H]43)ccc2c1 ZINC000368334202 386961775 /nfs/dbraw/zinc/96/17/75/386961775.db2.gz VSGRNVDBVJBIKZ-CABCVRRESA-N 1 2 240.306 2.208 20 0 BEADLO COC(=O)CCC[N@H+](CC(F)F)CC1CCC1 ZINC000341756319 386962156 /nfs/dbraw/zinc/96/21/56/386962156.db2.gz MFHGEONWGADSQB-UHFFFAOYSA-N 1 2 249.301 2.307 20 0 BEADLO COC(=O)CCC[N@@H+](CC(F)F)CC1CCC1 ZINC000341756319 386962161 /nfs/dbraw/zinc/96/21/61/386962161.db2.gz MFHGEONWGADSQB-UHFFFAOYSA-N 1 2 249.301 2.307 20 0 BEADLO CC[C@@]1(C)C[C@@H]1C(=O)Nc1c[nH+]ccc1OC ZINC000126014459 386965921 /nfs/dbraw/zinc/96/59/21/386965921.db2.gz BHDKICMLOHXSIF-RNCFNFMXSA-N 1 2 234.299 2.465 20 0 BEADLO CO[C@@H](C)C[N@H+](Cc1nnc(C)s1)C(C)C ZINC000358494275 386966813 /nfs/dbraw/zinc/96/68/13/386966813.db2.gz BXLIUFVKBLBVOZ-VIFPVBQESA-N 1 2 243.376 2.092 20 0 BEADLO CO[C@@H](C)C[N@@H+](Cc1nnc(C)s1)C(C)C ZINC000358494275 386966817 /nfs/dbraw/zinc/96/68/17/386966817.db2.gz BXLIUFVKBLBVOZ-VIFPVBQESA-N 1 2 243.376 2.092 20 0 BEADLO C[C@H](CC1CCCC1)C(=O)NCc1c[nH+]c[nH]1 ZINC000332281707 386968307 /nfs/dbraw/zinc/96/83/07/386968307.db2.gz ICPZPTWOMOLAJU-SNVBAGLBSA-N 1 2 235.331 2.242 20 0 BEADLO C[C@H](CC1CCCC1)C(=O)NCc1c[nH]c[nH+]1 ZINC000332281707 386968310 /nfs/dbraw/zinc/96/83/10/386968310.db2.gz ICPZPTWOMOLAJU-SNVBAGLBSA-N 1 2 235.331 2.242 20 0 BEADLO COCC[C@H]1CCCCN(c2cc(C)[nH+]cn2)C1 ZINC000341955521 387008522 /nfs/dbraw/zinc/00/85/22/387008522.db2.gz HFGSYQGMMDKGIX-CYBMUJFWSA-N 1 2 249.358 2.428 20 0 BEADLO CCN(C)c1ccc(/C=C/c2ccncn2)c[nH+]1 ZINC000358683835 386998876 /nfs/dbraw/zinc/99/88/76/386998876.db2.gz NHSHTTKZBFQRKZ-GQCTYLIASA-N 1 2 240.310 2.498 20 0 BEADLO CCCCC(=O)N[C@H](c1[nH+]ccn1C)C1CC1 ZINC000341685427 386951308 /nfs/dbraw/zinc/95/13/08/386951308.db2.gz DEVLMJKDOQOVBV-LBPRGKRZSA-N 1 2 235.331 2.178 20 0 BEADLO CCCCC[N@H+](CCOC)CC(F)F ZINC000117879153 387031603 /nfs/dbraw/zinc/03/16/03/387031603.db2.gz CLMUMKPABZIKGZ-UHFFFAOYSA-N 1 2 209.280 2.390 20 0 BEADLO CCCCC[N@@H+](CCOC)CC(F)F ZINC000117879153 387031606 /nfs/dbraw/zinc/03/16/06/387031606.db2.gz CLMUMKPABZIKGZ-UHFFFAOYSA-N 1 2 209.280 2.390 20 0 BEADLO Cc1cc[nH+]c(N[C@H]2C[C@@](C)(O)C2)c1Cl ZINC000334953826 387032728 /nfs/dbraw/zinc/03/27/28/387032728.db2.gz GTQDDFJSSQYJOL-DKTWLAJQSA-N 1 2 226.707 2.369 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)C1CCC(=O)CC1 ZINC000333453273 387035717 /nfs/dbraw/zinc/03/57/17/387035717.db2.gz ZCJQOZAJLFRALP-UHFFFAOYSA-N 1 2 246.310 2.396 20 0 BEADLO CC[C@@H](NC(=O)C1=C(C)CCC1)c1[nH]cc[nH+]1 ZINC000333574476 387044686 /nfs/dbraw/zinc/04/46/86/387044686.db2.gz URYXUUUJCOMBEN-LLVKDONJSA-N 1 2 233.315 2.477 20 0 BEADLO CC1(C)CC[C@@H](C(=O)NCCCn2cc[nH+]c2)C1 ZINC000359067891 387052756 /nfs/dbraw/zinc/05/27/56/387052756.db2.gz VEMLVGHRQFKZTP-GFCCVEGCSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1ccnc(N[C@@H]2C[C@@H](C)n3cc[nH+]c32)n1 ZINC000333760602 387053662 /nfs/dbraw/zinc/05/36/62/387053662.db2.gz ZRMKPOKNXHJLFI-NXEZZACHSA-N 1 2 229.287 2.099 20 0 BEADLO Cc1cc(CNC(=O)NC2CCC2)cc(C)[nH+]1 ZINC000334970073 387054801 /nfs/dbraw/zinc/05/48/01/387054801.db2.gz MEMBSQAAKBGVMK-UHFFFAOYSA-N 1 2 233.315 2.050 20 0 BEADLO CC[C@@H]([NH2+]Cc1cnc(C2CC2)nc1)C(F)F ZINC000459576978 387059959 /nfs/dbraw/zinc/05/99/59/387059959.db2.gz WHNVALKFFJGFSQ-SNVBAGLBSA-N 1 2 241.285 2.487 20 0 BEADLO Cn1c2ccccc2nc1C[N@@H+]1CC[C@@H](F)C1 ZINC000336222693 387061866 /nfs/dbraw/zinc/06/18/66/387061866.db2.gz CIFAZNMCNOHLLZ-SNVBAGLBSA-N 1 2 233.290 2.117 20 0 BEADLO Cn1c2ccccc2nc1C[N@H+]1CC[C@@H](F)C1 ZINC000336222693 387061870 /nfs/dbraw/zinc/06/18/70/387061870.db2.gz CIFAZNMCNOHLLZ-SNVBAGLBSA-N 1 2 233.290 2.117 20 0 BEADLO CC(C)N(Cc1c[nH+]cn1C(C)C)C1COC1 ZINC000425373888 387013777 /nfs/dbraw/zinc/01/37/77/387013777.db2.gz WBTNQTJACKAYBL-UHFFFAOYSA-N 1 2 237.347 2.073 20 0 BEADLO C[C@H]1CC2(CCC2)CN1C(=O)CCc1[nH]cc[nH+]1 ZINC000334937602 387013847 /nfs/dbraw/zinc/01/38/47/387013847.db2.gz CBQPUBVYIOZINX-NSHDSACASA-N 1 2 247.342 2.133 20 0 BEADLO Cc1cn2c([nH+]1)CN(C(=O)[C@@H](C)CC(C)C)CC2 ZINC000368870867 387018260 /nfs/dbraw/zinc/01/82/60/387018260.db2.gz URKIDUJKZFRTIT-NSHDSACASA-N 1 2 249.358 2.216 20 0 BEADLO Cn1ncc(Cl)c1C[NH+]1CC(CC(F)F)C1 ZINC000425366699 387024031 /nfs/dbraw/zinc/02/40/31/387024031.db2.gz QJPMZLUTJHEAQB-UHFFFAOYSA-N 1 2 249.692 2.161 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cncc(F)c1)c1nccn1C ZINC000359224661 387069978 /nfs/dbraw/zinc/06/99/78/387069978.db2.gz FKUDHEPXOAHNGR-VHSXEESVSA-N 1 2 248.305 2.366 20 0 BEADLO CCCn1cc(C[N@@H+]2CCO[C@H]3CCC[C@H]32)cn1 ZINC000352382721 387130399 /nfs/dbraw/zinc/13/03/99/387130399.db2.gz GBVJZYYHPYUUGF-KGLIPLIRSA-N 1 2 249.358 2.046 20 0 BEADLO CCCn1cc(C[N@H+]2CCO[C@H]3CCC[C@H]32)cn1 ZINC000352382721 387130406 /nfs/dbraw/zinc/13/04/06/387130406.db2.gz GBVJZYYHPYUUGF-KGLIPLIRSA-N 1 2 249.358 2.046 20 0 BEADLO CCn1cncc1C[N@H+](CC)Cc1ccncc1 ZINC000418054955 387077943 /nfs/dbraw/zinc/07/79/43/387077943.db2.gz HTSZPIOIACCNEQ-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CCn1cncc1C[N@@H+](CC)Cc1ccncc1 ZINC000418054955 387077946 /nfs/dbraw/zinc/07/79/46/387077946.db2.gz HTSZPIOIACCNEQ-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CCN(Cc1c[nH+]cn1CC)Cc1ccncc1 ZINC000418054955 387077947 /nfs/dbraw/zinc/07/79/47/387077947.db2.gz HTSZPIOIACCNEQ-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2occc2C)n(C)n1 ZINC000418065782 387081620 /nfs/dbraw/zinc/08/16/20/387081620.db2.gz MGKYUGGQQBJXPY-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2occc2C)n(C)n1 ZINC000418065782 387081626 /nfs/dbraw/zinc/08/16/26/387081626.db2.gz MGKYUGGQQBJXPY-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO Cc1c(Cl)c(C[N@@H+]2C[C@H]3CCC[C@@H]32)nn1C ZINC000334996433 387088657 /nfs/dbraw/zinc/08/86/57/387088657.db2.gz ZEZORBLNBQPGRS-KOLCDFICSA-N 1 2 239.750 2.366 20 0 BEADLO Cc1c(Cl)c(C[N@H+]2C[C@H]3CCC[C@@H]32)nn1C ZINC000334996433 387088659 /nfs/dbraw/zinc/08/86/59/387088659.db2.gz ZEZORBLNBQPGRS-KOLCDFICSA-N 1 2 239.750 2.366 20 0 BEADLO Cc1cc(CNC(=O)N[C@H]2CC[C@@H]2C)cc(C)[nH+]1 ZINC000334997337 387091111 /nfs/dbraw/zinc/09/11/11/387091111.db2.gz HQHVPTXEJRVKQW-ZANVPECISA-N 1 2 247.342 2.296 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cnccc2C)on1 ZINC000352342463 387092118 /nfs/dbraw/zinc/09/21/18/387092118.db2.gz SQQNPVZILVMWOD-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cnccc2C)on1 ZINC000352342463 387092122 /nfs/dbraw/zinc/09/21/22/387092122.db2.gz SQQNPVZILVMWOD-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CC[C@H](F)C[N@H+](C)Cc1ccnn1CC ZINC000352342182 387093590 /nfs/dbraw/zinc/09/35/90/387093590.db2.gz OZIWNYIZIPNKQE-JTQLQIEISA-N 1 2 213.300 2.083 20 0 BEADLO CC[C@H](F)C[N@@H+](C)Cc1ccnn1CC ZINC000352342182 387093594 /nfs/dbraw/zinc/09/35/94/387093594.db2.gz OZIWNYIZIPNKQE-JTQLQIEISA-N 1 2 213.300 2.083 20 0 BEADLO Cc1nc(N2CC3(C[C@H]2C)CCOCC3)cc[nH+]1 ZINC000645381367 387096838 /nfs/dbraw/zinc/09/68/38/387096838.db2.gz FJRWLBDCUVYXDA-LLVKDONJSA-N 1 2 247.342 2.180 20 0 BEADLO F[C@H]1CC[N@H+](Cc2ccc(Cl)cn2)C1 ZINC000336262894 387097367 /nfs/dbraw/zinc/09/73/67/387097367.db2.gz HTIDXGWIUKBFAC-VIFPVBQESA-N 1 2 214.671 2.279 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2ccc(Cl)cn2)C1 ZINC000336262894 387097371 /nfs/dbraw/zinc/09/73/71/387097371.db2.gz HTIDXGWIUKBFAC-VIFPVBQESA-N 1 2 214.671 2.279 20 0 BEADLO CN(CC(N)=O)c1[nH+]ccc2ccc(F)cc21 ZINC000336268209 387102031 /nfs/dbraw/zinc/10/20/31/387102031.db2.gz NRRXDWAZCSPPFO-UHFFFAOYSA-N 1 2 233.246 2.345 20 0 BEADLO C[C@H](O)CC[N@@H+]1CCn2c(cc3ccccc32)C1 ZINC000336273324 387106590 /nfs/dbraw/zinc/10/65/90/387106590.db2.gz AEUFMLPWPJIXMR-LBPRGKRZSA-N 1 2 244.338 2.228 20 0 BEADLO C[C@H](O)CC[N@H+]1CCn2c(cc3ccccc32)C1 ZINC000336273324 387106594 /nfs/dbraw/zinc/10/65/94/387106594.db2.gz AEUFMLPWPJIXMR-LBPRGKRZSA-N 1 2 244.338 2.228 20 0 BEADLO C[C@H]1CC2(CN1c1cccc[nH+]1)CCOCC2 ZINC000645381680 387107998 /nfs/dbraw/zinc/10/79/98/387107998.db2.gz GCACZMQKWVZWNH-LBPRGKRZSA-N 1 2 232.327 2.477 20 0 BEADLO Cc1c[nH]cc1C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000334948372 387110326 /nfs/dbraw/zinc/11/03/26/387110326.db2.gz PCVXFXRKXCDLHA-NSHDSACASA-N 1 2 244.298 2.024 20 0 BEADLO COC[C@@H]1CCN(c2cc(C)[nH+]c(C(C)C)n2)C1 ZINC000352364566 387113958 /nfs/dbraw/zinc/11/39/58/387113958.db2.gz FYDUINKKPYYNIN-GFCCVEGCSA-N 1 2 249.358 2.381 20 0 BEADLO c1cn(Cc2cnn(-c3ccccc3)c2)c[nH+]1 ZINC000070163115 387117894 /nfs/dbraw/zinc/11/78/94/387117894.db2.gz ONWTWBHVGHYTEQ-UHFFFAOYSA-N 1 2 224.267 2.117 20 0 BEADLO CCN(CC(C)C)C(=O)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000370606678 387128745 /nfs/dbraw/zinc/12/87/45/387128745.db2.gz NTLUNOPMMLZFJH-LLVKDONJSA-N 1 2 249.358 2.334 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCc2cn[nH]c2C1)c1cscn1 ZINC000336316313 387142302 /nfs/dbraw/zinc/14/23/02/387142302.db2.gz SOELHCXWCCPQKN-PSASIEDQSA-N 1 2 248.355 2.074 20 0 BEADLO Cc1noc(CCC[N@@H+]2CCC[C@H]2C(F)F)n1 ZINC000353170369 387147033 /nfs/dbraw/zinc/14/70/33/387147033.db2.gz GUKPVLFXOAGOAY-VIFPVBQESA-N 1 2 245.273 2.040 20 0 BEADLO Cc1noc(CCC[N@H+]2CCC[C@H]2C(F)F)n1 ZINC000353170369 387147037 /nfs/dbraw/zinc/14/70/37/387147037.db2.gz GUKPVLFXOAGOAY-VIFPVBQESA-N 1 2 245.273 2.040 20 0 BEADLO CO[C@@H](C)C[N@H+](C)Cc1ncc(Cl)s1 ZINC000353224273 387161815 /nfs/dbraw/zinc/16/18/15/387161815.db2.gz YLLPCFYMWIGQHR-ZETCQYMHSA-N 1 2 234.752 2.263 20 0 BEADLO CO[C@@H](C)C[N@@H+](C)Cc1ncc(Cl)s1 ZINC000353224273 387161824 /nfs/dbraw/zinc/16/18/24/387161824.db2.gz YLLPCFYMWIGQHR-ZETCQYMHSA-N 1 2 234.752 2.263 20 0 BEADLO Cc1cc(N2CC[C@H](CCO)C2)nc(C(C)C)[nH+]1 ZINC000229350852 387164601 /nfs/dbraw/zinc/16/46/01/387164601.db2.gz INCIZQCMJARJGG-GFCCVEGCSA-N 1 2 249.358 2.117 20 0 BEADLO Cc1nocc1C[N@@H+](C)Cc1cnccc1C ZINC000353267786 387169373 /nfs/dbraw/zinc/16/93/73/387169373.db2.gz OQNZNIQYCBJBON-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1nocc1C[N@H+](C)Cc1cnccc1C ZINC000353267786 387169378 /nfs/dbraw/zinc/16/93/78/387169378.db2.gz OQNZNIQYCBJBON-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CO[C@@H](C)C[N@H+](C)[C@@H](C)c1nc(C(C)C)no1 ZINC000353318711 387181254 /nfs/dbraw/zinc/18/12/54/387181254.db2.gz UDJWISYURDWPRJ-UWVGGRQHSA-N 1 2 241.335 2.221 20 0 BEADLO CO[C@@H](C)C[N@@H+](C)[C@@H](C)c1nc(C(C)C)no1 ZINC000353318711 387181259 /nfs/dbraw/zinc/18/12/59/387181259.db2.gz UDJWISYURDWPRJ-UWVGGRQHSA-N 1 2 241.335 2.221 20 0 BEADLO C[C@@H]1[N@H+](Cc2cncc(F)c2)CCOC1(C)C ZINC000336353178 387183426 /nfs/dbraw/zinc/18/34/26/387183426.db2.gz UJQGOLBKDUUCNU-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H]1[N@@H+](Cc2cncc(F)c2)CCOC1(C)C ZINC000336353178 387183435 /nfs/dbraw/zinc/18/34/35/387183435.db2.gz UJQGOLBKDUUCNU-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO CCc1cccc(F)c1C[NH+]1CCN(C)CC1 ZINC000353378734 387189149 /nfs/dbraw/zinc/18/91/49/387189149.db2.gz HUHXCYITQYASRN-UHFFFAOYSA-N 1 2 236.334 2.136 20 0 BEADLO CCc1cnc(CNc2[nH+]cccc2OC)o1 ZINC000231659566 387135115 /nfs/dbraw/zinc/13/51/15/387135115.db2.gz ISLIAGSSENQYNL-UHFFFAOYSA-N 1 2 233.271 2.253 20 0 BEADLO CCc1ccc([C@H](CO)[NH2+]Cc2ccon2)cc1 ZINC000359616786 387136576 /nfs/dbraw/zinc/13/65/76/387136576.db2.gz KPQUFGZHYYCJSY-AWEZNQCLSA-N 1 2 246.310 2.060 20 0 BEADLO Cc1nc(N(C)Cc2[nH]cc[nH+]2)sc1C ZINC000336307923 387136514 /nfs/dbraw/zinc/13/65/14/387136514.db2.gz XSUHZDJYXRZZDF-UHFFFAOYSA-N 1 2 222.317 2.119 20 0 BEADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1c[nH]cn1 ZINC000336310539 387138344 /nfs/dbraw/zinc/13/83/44/387138344.db2.gz AXRZLYSWPKVWBW-CBAPKCEASA-N 1 2 233.237 2.182 20 0 BEADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1c[nH]cn1 ZINC000336310539 387138347 /nfs/dbraw/zinc/13/83/47/387138347.db2.gz AXRZLYSWPKVWBW-CBAPKCEASA-N 1 2 233.237 2.182 20 0 BEADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cnc[nH]1 ZINC000336310539 387138350 /nfs/dbraw/zinc/13/83/50/387138350.db2.gz AXRZLYSWPKVWBW-CBAPKCEASA-N 1 2 233.237 2.182 20 0 BEADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1cnc[nH]1 ZINC000336310539 387138354 /nfs/dbraw/zinc/13/83/54/387138354.db2.gz AXRZLYSWPKVWBW-CBAPKCEASA-N 1 2 233.237 2.182 20 0 BEADLO C[C@@H](CC(=O)N[C@H]1C=CCCC1)n1cc[nH+]c1 ZINC000571686605 387138939 /nfs/dbraw/zinc/13/89/39/387138939.db2.gz DIEGKNMUTBBXRZ-RYUDHWBXSA-N 1 2 233.315 2.059 20 0 BEADLO COc1cc(C)[nH+]c(CS[C@H](C)[C@H](C)O)c1 ZINC000229863403 387212666 /nfs/dbraw/zinc/21/26/66/387212666.db2.gz PIRZBKQAHRMIDM-VHSXEESVSA-N 1 2 241.356 2.401 20 0 BEADLO Cc1c(N[C@H](c2[nH+]ccn2C)C2CC2)cnn1C ZINC000187779798 387213536 /nfs/dbraw/zinc/21/35/36/387213536.db2.gz CIQGLNZPUHGGRG-LBPRGKRZSA-N 1 2 245.330 2.025 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2CC2(C)C)c(C)c[nH+]1 ZINC000571983790 387213806 /nfs/dbraw/zinc/21/38/06/387213806.db2.gz ITHWZUVOQOCNGA-NSHDSACASA-N 1 2 233.315 2.040 20 0 BEADLO C[C@@H](c1nccc(N)n1)[N@H+](C)Cc1ccccc1 ZINC000571980567 387214449 /nfs/dbraw/zinc/21/44/49/387214449.db2.gz QCKPSGQVPXXLHK-NSHDSACASA-N 1 2 242.326 2.082 20 0 BEADLO C[C@@H](c1nccc(N)n1)[N@@H+](C)Cc1ccccc1 ZINC000571980567 387214452 /nfs/dbraw/zinc/21/44/52/387214452.db2.gz QCKPSGQVPXXLHK-NSHDSACASA-N 1 2 242.326 2.082 20 0 BEADLO Cc1cn[nH]c1CNc1cc(C)cc[nH+]1 ZINC000290047439 387232992 /nfs/dbraw/zinc/23/29/92/387232992.db2.gz WUXCSQFKTGPGSO-UHFFFAOYSA-N 1 2 202.261 2.034 20 0 BEADLO CCC[C@H]1C[C@H]1C(=O)Nc1cc[nH+]cc1C ZINC000360175439 387238724 /nfs/dbraw/zinc/23/87/24/387238724.db2.gz KRGKBNQZRSDXHQ-WDEREUQCSA-N 1 2 218.300 2.187 20 0 BEADLO Cc1cnc(C[N@@H+]2CCO[C@H](C3CC3)C2)s1 ZINC000336420495 387250611 /nfs/dbraw/zinc/25/06/11/387250611.db2.gz VGZNKIBOQWPDDB-NSHDSACASA-N 1 2 238.356 2.062 20 0 BEADLO Cc1cnc(C[N@H+]2CCO[C@H](C3CC3)C2)s1 ZINC000336420495 387250617 /nfs/dbraw/zinc/25/06/17/387250617.db2.gz VGZNKIBOQWPDDB-NSHDSACASA-N 1 2 238.356 2.062 20 0 BEADLO C[N@H+](Cc1ccc[nH]1)Cc1cncs1 ZINC000354035248 387315447 /nfs/dbraw/zinc/31/54/47/387315447.db2.gz WKAWKIRZWLTRQK-UHFFFAOYSA-N 1 2 207.302 2.103 20 0 BEADLO C[N@@H+](Cc1ccc[nH]1)Cc1cncs1 ZINC000354035248 387315451 /nfs/dbraw/zinc/31/54/51/387315451.db2.gz WKAWKIRZWLTRQK-UHFFFAOYSA-N 1 2 207.302 2.103 20 0 BEADLO CCC[C@@H]1CCC[N@H+](Cc2noc(C)n2)C1 ZINC000120836970 387276361 /nfs/dbraw/zinc/27/63/61/387276361.db2.gz AZVZSPIMVPHLFH-LLVKDONJSA-N 1 2 223.320 2.390 20 0 BEADLO CCC[C@@H]1CCC[N@@H+](Cc2noc(C)n2)C1 ZINC000120836970 387276364 /nfs/dbraw/zinc/27/63/64/387276364.db2.gz AZVZSPIMVPHLFH-LLVKDONJSA-N 1 2 223.320 2.390 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2ccccc2C)[nH]1 ZINC000353799645 387277966 /nfs/dbraw/zinc/27/79/66/387277966.db2.gz BBPPMAMTGVDDSI-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2ccccc2C)[nH]1 ZINC000353799645 387277973 /nfs/dbraw/zinc/27/79/73/387277973.db2.gz BBPPMAMTGVDDSI-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2CCC[C@@H](O)C2)c(C)[nH+]1 ZINC000336452701 387279698 /nfs/dbraw/zinc/27/96/98/387279698.db2.gz NLGOEVFADLSMMU-VXGBXAGGSA-N 1 2 248.326 2.188 20 0 BEADLO C[C@H](N[C@@H](C1CC1)C(F)(F)F)c1[nH+]ccn1C ZINC000352519735 387286737 /nfs/dbraw/zinc/28/67/37/387286737.db2.gz RGUMQLZNLQXPNA-CBAPKCEASA-N 1 2 247.264 2.412 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1CCC[C@@H](CO)C1 ZINC000572257141 387287106 /nfs/dbraw/zinc/28/71/06/387287106.db2.gz FCPXQPZOKVOEDW-VXGBXAGGSA-N 1 2 235.331 2.056 20 0 BEADLO CCC(=O)CCC[N@H+](C)[C@H](C)c1nc(C)no1 ZINC000572254817 387287301 /nfs/dbraw/zinc/28/73/01/387287301.db2.gz ZYUJNEFCHSJPSE-SECBINFHSA-N 1 2 239.319 2.130 20 0 BEADLO CCC(=O)CCC[N@@H+](C)[C@H](C)c1nc(C)no1 ZINC000572254817 387287304 /nfs/dbraw/zinc/28/73/04/387287304.db2.gz ZYUJNEFCHSJPSE-SECBINFHSA-N 1 2 239.319 2.130 20 0 BEADLO CC[C@@H](C)C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000336463681 387292912 /nfs/dbraw/zinc/29/29/12/387292912.db2.gz QAMMWGSOOMSHFW-SNVBAGLBSA-N 1 2 235.331 2.162 20 0 BEADLO CC[C@@H](C)C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000336463681 387292915 /nfs/dbraw/zinc/29/29/15/387292915.db2.gz QAMMWGSOOMSHFW-SNVBAGLBSA-N 1 2 235.331 2.162 20 0 BEADLO Cc1ccc(NC(=O)c2ccn(C)c2)c(C)[nH+]1 ZINC000336461471 387293473 /nfs/dbraw/zinc/29/34/73/387293473.db2.gz MSLNLDVBHNJNHQ-UHFFFAOYSA-N 1 2 229.283 2.289 20 0 BEADLO FC1(F)CC[N@H+](CCCc2ccncc2)C1 ZINC000360473529 387293621 /nfs/dbraw/zinc/29/36/21/387293621.db2.gz KICIXNOUFUTUNO-UHFFFAOYSA-N 1 2 226.270 2.355 20 0 BEADLO FC1(F)CC[N@@H+](CCCc2ccncc2)C1 ZINC000360473529 387293627 /nfs/dbraw/zinc/29/36/27/387293627.db2.gz KICIXNOUFUTUNO-UHFFFAOYSA-N 1 2 226.270 2.355 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NCCc1ccco1 ZINC000121161490 387303732 /nfs/dbraw/zinc/30/37/32/387303732.db2.gz NCSVDETWTLRLHZ-UHFFFAOYSA-N 1 2 245.282 2.347 20 0 BEADLO Cc1csc(C[N@H+]2CC(C)(C)OC[C@@H]2C)n1 ZINC000336531331 387354827 /nfs/dbraw/zinc/35/48/27/387354827.db2.gz WCMZKICGSXYRSR-JTQLQIEISA-N 1 2 240.372 2.451 20 0 BEADLO Cc1csc(C[N@@H+]2CC(C)(C)OC[C@@H]2C)n1 ZINC000336531331 387354831 /nfs/dbraw/zinc/35/48/31/387354831.db2.gz WCMZKICGSXYRSR-JTQLQIEISA-N 1 2 240.372 2.451 20 0 BEADLO C[C@@]1(CNc2cc(NC3CC3)nc[nH+]2)CCCO1 ZINC000515513564 387385036 /nfs/dbraw/zinc/38/50/36/387385036.db2.gz FZURCLONEVBHRZ-ZDUSSCGKSA-N 1 2 248.330 2.032 20 0 BEADLO C[C@@]1(CNc2cc(NC3CC3)[nH+]cn2)CCCO1 ZINC000515513564 387385039 /nfs/dbraw/zinc/38/50/39/387385039.db2.gz FZURCLONEVBHRZ-ZDUSSCGKSA-N 1 2 248.330 2.032 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCO[C@@H](C2CC2)C1 ZINC000373396817 387361483 /nfs/dbraw/zinc/36/14/83/387361483.db2.gz XEAQGRZISWNGPM-CQSZACIVSA-N 1 2 249.358 2.075 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCO[C@@H](C2CC2)C1 ZINC000373396817 387361487 /nfs/dbraw/zinc/36/14/87/387361487.db2.gz XEAQGRZISWNGPM-CQSZACIVSA-N 1 2 249.358 2.075 20 0 BEADLO COc1ccc(N[C@H]2C[C@@H](C)O[C@@H](C)C2)[nH+]c1 ZINC000648481683 387379330 /nfs/dbraw/zinc/37/93/30/387379330.db2.gz AXTVYNLTSPIWHS-URLYPYJESA-N 1 2 236.315 2.458 20 0 BEADLO Cc1ccc(NC(=O)[C@]2(C)CCOC2)c(C)[nH+]1 ZINC000336558251 387382179 /nfs/dbraw/zinc/38/21/79/387382179.db2.gz MMZJEHQQGDGCSB-CYBMUJFWSA-N 1 2 234.299 2.064 20 0 BEADLO CCn1cncc1C[N@H+](C)Cc1cccc(O)c1 ZINC000515004308 387321535 /nfs/dbraw/zinc/32/15/35/387321535.db2.gz HNOCXFYRYICTNM-UHFFFAOYSA-N 1 2 245.326 2.241 20 0 BEADLO CCn1cncc1C[N@@H+](C)Cc1cccc(O)c1 ZINC000515004308 387321542 /nfs/dbraw/zinc/32/15/42/387321542.db2.gz HNOCXFYRYICTNM-UHFFFAOYSA-N 1 2 245.326 2.241 20 0 BEADLO CCn1c[nH+]cc1CN(C)Cc1cccc(O)c1 ZINC000515004308 387321546 /nfs/dbraw/zinc/32/15/46/387321546.db2.gz HNOCXFYRYICTNM-UHFFFAOYSA-N 1 2 245.326 2.241 20 0 BEADLO COC(=O)[C@H]1CCCCC[N@@H+]1C/C=C/Cl ZINC000360987135 387382787 /nfs/dbraw/zinc/38/27/87/387382787.db2.gz YZSCJELCCNNABD-BREXMAIKSA-N 1 2 231.723 2.157 20 0 BEADLO COC(=O)[C@H]1CCCCC[N@H+]1C/C=C/Cl ZINC000360987135 387382789 /nfs/dbraw/zinc/38/27/89/387382789.db2.gz YZSCJELCCNNABD-BREXMAIKSA-N 1 2 231.723 2.157 20 0 BEADLO Cc1ccc2oc(N(C)Cc3[nH]cc[nH+]3)nc2c1 ZINC000354110639 387331565 /nfs/dbraw/zinc/33/15/65/387331565.db2.gz LEMXWPBCGNOLCD-UHFFFAOYSA-N 1 2 242.282 2.496 20 0 BEADLO Cc1ccc(NCc2cn(C(C)C)nn2)c[nH+]1 ZINC000286740941 387336393 /nfs/dbraw/zinc/33/63/93/387336393.db2.gz GEXRNCLIVAVIHW-UHFFFAOYSA-N 1 2 231.303 2.175 20 0 BEADLO CC[C@H](NC(=O)Cc1ccc(C)o1)c1[nH]cc[nH+]1 ZINC000525952507 387344243 /nfs/dbraw/zinc/34/42/43/387344243.db2.gz DVXYZEMFGGZZOZ-NSHDSACASA-N 1 2 247.298 2.121 20 0 BEADLO c1c[nH]c(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)n1 ZINC000374222293 387432981 /nfs/dbraw/zinc/43/29/81/387432981.db2.gz FGRBXSKITKCSQT-CYBMUJFWSA-N 1 2 243.310 2.063 20 0 BEADLO c1c[nH]c(C[N@H+]2CC[C@@H](Oc3ccccc3)C2)n1 ZINC000374222293 387432984 /nfs/dbraw/zinc/43/29/84/387432984.db2.gz FGRBXSKITKCSQT-CYBMUJFWSA-N 1 2 243.310 2.063 20 0 BEADLO c1ncc(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)[nH]1 ZINC000374259119 387435796 /nfs/dbraw/zinc/43/57/96/387435796.db2.gz NOEOVISMDCLATQ-CQSZACIVSA-N 1 2 243.310 2.063 20 0 BEADLO c1ncc(C[N@H+]2CC[C@@H](Oc3ccccc3)C2)[nH]1 ZINC000374259119 387435798 /nfs/dbraw/zinc/43/57/98/387435798.db2.gz NOEOVISMDCLATQ-CQSZACIVSA-N 1 2 243.310 2.063 20 0 BEADLO COCc1ccc(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)o1 ZINC000271072754 387438839 /nfs/dbraw/zinc/43/88/39/387438839.db2.gz ORJCJFYPSUQIDF-WDEREUQCSA-N 1 2 239.315 2.035 20 0 BEADLO COCc1ccc(C[N@H+]2C[C@@H](C)OC[C@@H]2C)o1 ZINC000271072754 387438846 /nfs/dbraw/zinc/43/88/46/387438846.db2.gz ORJCJFYPSUQIDF-WDEREUQCSA-N 1 2 239.315 2.035 20 0 BEADLO c1cn(Cc2cnc3ccccc3c2)c[nH+]1 ZINC000304139071 387441000 /nfs/dbraw/zinc/44/10/00/387441000.db2.gz GBGHAGXFWFCYLN-UHFFFAOYSA-N 1 2 209.252 2.480 20 0 BEADLO C[C@H]([NH2+]Cc1cc[nH]n1)c1ccccc1F ZINC000037764636 387443135 /nfs/dbraw/zinc/44/31/35/387443135.db2.gz HOMNUYBLZUKIOI-VIFPVBQESA-N 1 2 219.263 2.400 20 0 BEADLO CC(C)CCC(=O)N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000374354737 387446013 /nfs/dbraw/zinc/44/60/13/387446013.db2.gz VTMMJBLMUNDJEG-GFCCVEGCSA-N 1 2 249.358 2.172 20 0 BEADLO CCC[C@H]([NH2+]C1Cc2ccccc2C1)C(=O)OC ZINC000354931623 387449798 /nfs/dbraw/zinc/44/97/98/387449798.db2.gz OXZYWFFSKSMDBY-AWEZNQCLSA-N 1 2 247.338 2.085 20 0 BEADLO Cc1ccncc1C[N@@H+]1CCc2ncsc2C1 ZINC000354936791 387452279 /nfs/dbraw/zinc/45/22/79/387452279.db2.gz ZUDJIHHLHXUALA-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ccncc1C[N@H+]1CCc2ncsc2C1 ZINC000354936791 387452282 /nfs/dbraw/zinc/45/22/82/387452282.db2.gz ZUDJIHHLHXUALA-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1C[C@@H](C)OC[C@@H]1C ZINC000336617989 387458399 /nfs/dbraw/zinc/45/83/99/387458399.db2.gz PCEBOLIUXLOJLX-NWDGAFQWSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)n1nccc1C[N@H+]1C[C@@H](C)OC[C@@H]1C ZINC000336617989 387458404 /nfs/dbraw/zinc/45/84/04/387458404.db2.gz PCEBOLIUXLOJLX-NWDGAFQWSA-N 1 2 237.347 2.073 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)C[C@@H]1CCCCO1 ZINC000516087785 387458560 /nfs/dbraw/zinc/45/85/60/387458560.db2.gz BGWNRYCMMSVUML-LBPRGKRZSA-N 1 2 235.331 2.099 20 0 BEADLO O=C(Cc1ccco1)Nc1ccn2cc[nH+]c2c1 ZINC000350174565 387386378 /nfs/dbraw/zinc/38/63/78/387386378.db2.gz CRTAGBAKMLDIDT-UHFFFAOYSA-N 1 2 241.250 2.109 20 0 BEADLO Cc1c(NCCCc2ccc(C)[nH+]c2)cnn1C ZINC000354559768 387395830 /nfs/dbraw/zinc/39/58/30/387395830.db2.gz BMUSLCZSBMGIOE-UHFFFAOYSA-N 1 2 244.342 2.477 20 0 BEADLO C[C@H](CO)CNc1[nH+]ccc2ccc(F)cc21 ZINC000354574147 387398197 /nfs/dbraw/zinc/39/81/97/387398197.db2.gz VCUCYHDASOPEEL-VIFPVBQESA-N 1 2 234.274 2.414 20 0 BEADLO Cc1noc([C@H](C)[NH2+][C@@H](C)c2cccnc2)n1 ZINC000361094954 387400586 /nfs/dbraw/zinc/40/05/86/387400586.db2.gz FJMXMXCBSCCZFN-IUCAKERBSA-N 1 2 232.287 2.185 20 0 BEADLO CC[C@@H]1C[C@@H](Nc2[nH+]cccc2OC)CCO1 ZINC000648491213 387402223 /nfs/dbraw/zinc/40/22/23/387402223.db2.gz IJRWWNXLANXAJV-WDEREUQCSA-N 1 2 236.315 2.460 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C12CCC(CC1)C2 ZINC000336590304 387414371 /nfs/dbraw/zinc/41/43/71/387414371.db2.gz IZVIIKWBCNDSKA-UHFFFAOYSA-N 1 2 230.311 2.331 20 0 BEADLO OCC1(CCNc2ccc3ccccc3[nH+]2)CC1 ZINC000395867560 387493858 /nfs/dbraw/zinc/49/38/58/387493858.db2.gz XZCDMVWSIIWEHZ-UHFFFAOYSA-N 1 2 242.322 2.231 20 0 BEADLO Cl/C=C/C[N@@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000374858593 387494006 /nfs/dbraw/zinc/49/40/06/387494006.db2.gz RBFJYLUQPMCBGX-LXOKAJLYSA-N 1 2 211.696 2.299 20 0 BEADLO Cl/C=C/C[N@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000374858593 387494013 /nfs/dbraw/zinc/49/40/13/387494013.db2.gz RBFJYLUQPMCBGX-LXOKAJLYSA-N 1 2 211.696 2.299 20 0 BEADLO Cl/C=C/CN1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000374858593 387494016 /nfs/dbraw/zinc/49/40/16/387494016.db2.gz RBFJYLUQPMCBGX-LXOKAJLYSA-N 1 2 211.696 2.299 20 0 BEADLO Cc1nc(C)c(N[C@@H](C)Cn2cc[nH+]c2)nc1C ZINC000396875097 387504704 /nfs/dbraw/zinc/50/47/04/387504704.db2.gz ZSXHYUNVZRMUHU-VIFPVBQESA-N 1 2 245.330 2.099 20 0 BEADLO CC[C@@H](C)NC(=O)C[N@@H+]1Cc2ccc(C)cc2C1 ZINC000361590410 387505201 /nfs/dbraw/zinc/50/52/01/387505201.db2.gz YVFFESMQHOGFHZ-GFCCVEGCSA-N 1 2 246.354 2.225 20 0 BEADLO CC[C@@H](C)NC(=O)C[N@H+]1Cc2ccc(C)cc2C1 ZINC000361590410 387505203 /nfs/dbraw/zinc/50/52/03/387505203.db2.gz YVFFESMQHOGFHZ-GFCCVEGCSA-N 1 2 246.354 2.225 20 0 BEADLO CO[C@@H](C)CCC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000355304271 387516225 /nfs/dbraw/zinc/51/62/25/387516225.db2.gz HMHRGACBLCZEBY-JTQLQIEISA-N 1 2 247.298 2.088 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)Cc2c[nH+]cn2C)CC1 ZINC000527190810 387523421 /nfs/dbraw/zinc/52/34/21/387523421.db2.gz RLXDUDINUKYOST-NEPJUHHUSA-N 1 2 249.358 2.048 20 0 BEADLO CCC[C@H]1C[C@H]1C(=O)Nc1cc[nH+]cc1CC ZINC000361788396 387535089 /nfs/dbraw/zinc/53/50/89/387535089.db2.gz RNDGREYXSULSIQ-NWDGAFQWSA-N 1 2 232.327 2.441 20 0 BEADLO CCc1cccc(F)c1C[NH2+]Cc1cc[nH]n1 ZINC000527222510 387535434 /nfs/dbraw/zinc/53/54/34/387535434.db2.gz AZGNVTKVNBTDGZ-UHFFFAOYSA-N 1 2 233.290 2.401 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C[C@H]1C[C@@H]1C ZINC000361785680 387535733 /nfs/dbraw/zinc/53/57/33/387535733.db2.gz HDLMCFJNQCIXKH-GXSJLCMTSA-N 1 2 218.300 2.051 20 0 BEADLO CCOCC[N@@H+]1CCOc2cccc(F)c2C1 ZINC000374571178 387468863 /nfs/dbraw/zinc/46/88/63/387468863.db2.gz GQSBGXFENWGMKB-UHFFFAOYSA-N 1 2 239.290 2.057 20 0 BEADLO CCOCC[N@H+]1CCOc2cccc(F)c2C1 ZINC000374571178 387468870 /nfs/dbraw/zinc/46/88/70/387468870.db2.gz GQSBGXFENWGMKB-UHFFFAOYSA-N 1 2 239.290 2.057 20 0 BEADLO COC(=O)[C@@H](CC(F)F)[NH2+]CC1CCCCC1 ZINC000355083382 387477318 /nfs/dbraw/zinc/47/73/18/387477318.db2.gz WKNCCULJHNGJRE-SNVBAGLBSA-N 1 2 249.301 2.353 20 0 BEADLO Cc1cnc(C[N@@H+]2CCOC(C)(C)C2)s1 ZINC000336628056 387480622 /nfs/dbraw/zinc/48/06/22/387480622.db2.gz YPFBCQWAJHVPBL-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1cnc(C[N@H+]2CCOC(C)(C)C2)s1 ZINC000336628056 387480626 /nfs/dbraw/zinc/48/06/26/387480626.db2.gz YPFBCQWAJHVPBL-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1cnc(C[N@@H+]2CCc3ccccc3C2)nc1 ZINC000336627823 387481594 /nfs/dbraw/zinc/48/15/94/387481594.db2.gz SXGLXVAVQUNYIM-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1cnc(C[N@H+]2CCc3ccccc3C2)nc1 ZINC000336627823 387481598 /nfs/dbraw/zinc/48/15/98/387481598.db2.gz SXGLXVAVQUNYIM-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO O=C(CC(F)(F)F)Nc1ccn2cc[nH+]c2c1 ZINC000336629617 387482607 /nfs/dbraw/zinc/48/26/07/387482607.db2.gz CKYBQLVWQBXMPO-UHFFFAOYSA-N 1 2 243.188 2.225 20 0 BEADLO O=C(NCCCCn1cc[nH+]c1)[C@H]1CC=CCC1 ZINC000516268118 387490876 /nfs/dbraw/zinc/49/08/76/387490876.db2.gz AKXIQAKIMFYASB-ZDUSSCGKSA-N 1 2 247.342 2.136 20 0 BEADLO CC[N@H+](C[C@@H](C)OC)[C@@H](C)c1nnc(C)s1 ZINC000361559209 387491171 /nfs/dbraw/zinc/49/11/71/387491171.db2.gz NWKWBMOXIOXIKJ-BDAKNGLRSA-N 1 2 243.376 2.264 20 0 BEADLO CC[N@@H+](C[C@@H](C)OC)[C@@H](C)c1nnc(C)s1 ZINC000361559209 387491174 /nfs/dbraw/zinc/49/11/74/387491174.db2.gz NWKWBMOXIOXIKJ-BDAKNGLRSA-N 1 2 243.376 2.264 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H]1C[C@@H](c2ccccc2)[C@H]1C ZINC000355171984 387491840 /nfs/dbraw/zinc/49/18/40/387491840.db2.gz XBLAYPWFCOLABJ-ZMJPVWNMSA-N 1 2 247.338 2.330 20 0 BEADLO CCc1nn(C)cc1C[NH2+][C@@H](CC)C(F)F ZINC000648619224 387583563 /nfs/dbraw/zinc/58/35/63/387583563.db2.gz FKBCRFUPEPIBIY-JTQLQIEISA-N 1 2 231.290 2.116 20 0 BEADLO COC1(C)C[NH+](Cc2cccc(F)c2)C1 ZINC000362309026 387594082 /nfs/dbraw/zinc/59/40/82/387594082.db2.gz NSGZRXXQZKVABI-UHFFFAOYSA-N 1 2 209.264 2.046 20 0 BEADLO Fc1cccc(COCc2[nH]cc[nH+]2)c1 ZINC000123836846 387595109 /nfs/dbraw/zinc/59/51/09/387595109.db2.gz FJEXTINEFZYZBG-UHFFFAOYSA-N 1 2 206.220 2.266 20 0 BEADLO COc1cc(C[NH+]2CC(C)(OC)C2)ccc1C ZINC000362322186 387596188 /nfs/dbraw/zinc/59/61/88/387596188.db2.gz LZRDFGKRKQBBCI-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)C1(C)CCCCC1 ZINC000122870308 387608597 /nfs/dbraw/zinc/60/85/97/387608597.db2.gz OLVLHMWPQGJVRG-UHFFFAOYSA-N 1 2 249.358 2.349 20 0 BEADLO CCCCN(CC)C(=O)[C@H]1CCc2[nH+]ccn2C1 ZINC000376182172 387612307 /nfs/dbraw/zinc/61/23/07/387612307.db2.gz QDBCXZDMQJAUEF-LBPRGKRZSA-N 1 2 249.358 2.094 20 0 BEADLO COC(=O)[C@H](C)[N@@H+]1CCC(C)=C(c2ccco2)C1 ZINC000367222501 387614044 /nfs/dbraw/zinc/61/40/44/387614044.db2.gz BAYAIMHWSYOALF-NSHDSACASA-N 1 2 249.310 2.320 20 0 BEADLO COC(=O)[C@H](C)[N@H+]1CCC(C)=C(c2ccco2)C1 ZINC000367222501 387614047 /nfs/dbraw/zinc/61/40/47/387614047.db2.gz BAYAIMHWSYOALF-NSHDSACASA-N 1 2 249.310 2.320 20 0 BEADLO C[C@H](CC(C)(C)C)C(=O)NCCc1[nH]cc[nH+]1 ZINC000356089953 387615653 /nfs/dbraw/zinc/61/56/53/387615653.db2.gz GPXSRKHKBGCGOE-SNVBAGLBSA-N 1 2 237.347 2.141 20 0 BEADLO CCO[C@H](C)c1noc(COc2cc[nH+]cc2)n1 ZINC000356102436 387616660 /nfs/dbraw/zinc/61/66/60/387616660.db2.gz WTKNDHZNBPFTBR-SECBINFHSA-N 1 2 249.270 2.141 20 0 BEADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1ncccn1 ZINC000528766084 387620326 /nfs/dbraw/zinc/62/03/26/387620326.db2.gz CKRZTEGYHDJWFW-VIFPVBQESA-N 1 2 227.258 2.096 20 0 BEADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1ncccn1 ZINC000528766084 387620329 /nfs/dbraw/zinc/62/03/29/387620329.db2.gz CKRZTEGYHDJWFW-VIFPVBQESA-N 1 2 227.258 2.096 20 0 BEADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1ncccn1 ZINC000528766081 387621786 /nfs/dbraw/zinc/62/17/86/387621786.db2.gz CKRZTEGYHDJWFW-SECBINFHSA-N 1 2 227.258 2.096 20 0 BEADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1ncccn1 ZINC000528766081 387621791 /nfs/dbraw/zinc/62/17/91/387621791.db2.gz CKRZTEGYHDJWFW-SECBINFHSA-N 1 2 227.258 2.096 20 0 BEADLO Nc1[nH+]cccc1-c1cnc(C2CC2)o1 ZINC000527533257 387624596 /nfs/dbraw/zinc/62/45/96/387624596.db2.gz SKSQWNCTRMKDDR-UHFFFAOYSA-N 1 2 201.229 2.196 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2[C@H]3CCCO[C@H]32)c(C)[nH+]1 ZINC000355629885 387558605 /nfs/dbraw/zinc/55/86/05/387558605.db2.gz SUYYAAHTHQKGDI-RAIGVLPGSA-N 1 2 246.310 2.062 20 0 BEADLO CCCc1csc(C[N@H+](C)[C@@H]2CCOC2)n1 ZINC000426395695 387564705 /nfs/dbraw/zinc/56/47/05/387564705.db2.gz KMLLISKADSDAIX-LLVKDONJSA-N 1 2 240.372 2.316 20 0 BEADLO CCCc1csc(C[N@@H+](C)[C@@H]2CCOC2)n1 ZINC000426395695 387564707 /nfs/dbraw/zinc/56/47/07/387564707.db2.gz KMLLISKADSDAIX-LLVKDONJSA-N 1 2 240.372 2.316 20 0 BEADLO Cc1ccnc(NCCCNc2cccc[nH+]2)n1 ZINC000122637617 387571162 /nfs/dbraw/zinc/57/11/62/387571162.db2.gz JQFMJVRQUXVOQD-UHFFFAOYSA-N 1 2 243.314 2.094 20 0 BEADLO CCCCOCC[N@H+](C)Cc1nccs1 ZINC000355727540 387572849 /nfs/dbraw/zinc/57/28/49/387572849.db2.gz BSQWOGGWXBDZAH-UHFFFAOYSA-N 1 2 228.361 2.392 20 0 BEADLO CCCCOCC[N@@H+](C)Cc1nccs1 ZINC000355727540 387572851 /nfs/dbraw/zinc/57/28/51/387572851.db2.gz BSQWOGGWXBDZAH-UHFFFAOYSA-N 1 2 228.361 2.392 20 0 BEADLO CC[C@H](NC(=O)C[C@H]1C[C@@H]1C)c1[nH]cc[nH+]1 ZINC000355759695 387576441 /nfs/dbraw/zinc/57/64/41/387576441.db2.gz WEQPKJBZMCVXFG-AEJSXWLSSA-N 1 2 221.304 2.023 20 0 BEADLO CC[C@H](NC(=O)C[C@@H]1C[C@@H]1C)c1[nH]cc[nH+]1 ZINC000355759697 387576918 /nfs/dbraw/zinc/57/69/18/387576918.db2.gz WEQPKJBZMCVXFG-GUBZILKMSA-N 1 2 221.304 2.023 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccon2)ccn1 ZINC000527535939 387630138 /nfs/dbraw/zinc/63/01/38/387630138.db2.gz VQUHWFJNODNFAD-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccon2)ccn1 ZINC000527535939 387630143 /nfs/dbraw/zinc/63/01/43/387630143.db2.gz VQUHWFJNODNFAD-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO c1ccc(N2CC[C@]3(C2)CCCOC3)[nH+]c1 ZINC000376472669 387636537 /nfs/dbraw/zinc/63/65/37/387636537.db2.gz FHUFXACQAALYGC-ZDUSSCGKSA-N 1 2 218.300 2.089 20 0 BEADLO Cc1nc(C[N@@H+](C)Cc2ccn(C)c2)cs1 ZINC000125023931 387641968 /nfs/dbraw/zinc/64/19/68/387641968.db2.gz MCZBABUTRCZQBO-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1nc(C[N@H+](C)Cc2ccn(C)c2)cs1 ZINC000125023931 387641970 /nfs/dbraw/zinc/64/19/70/387641970.db2.gz MCZBABUTRCZQBO-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1nc(N2CCCCC[C@@H]2C)nc(N(C)C)[nH+]1 ZINC000362697679 387649408 /nfs/dbraw/zinc/64/94/08/387649408.db2.gz LFGAGYOFFJXFTI-JTQLQIEISA-N 1 2 249.362 2.015 20 0 BEADLO Cc1nc(N(C)C)nc(N2CCCCC[C@@H]2C)[nH+]1 ZINC000362697679 387649410 /nfs/dbraw/zinc/64/94/10/387649410.db2.gz LFGAGYOFFJXFTI-JTQLQIEISA-N 1 2 249.362 2.015 20 0 BEADLO CCN(CCCO)c1cc(C)[nH+]c(C(C)C)n1 ZINC000125360702 387654630 /nfs/dbraw/zinc/65/46/30/387654630.db2.gz YHKMJIWUKZJIOT-UHFFFAOYSA-N 1 2 237.347 2.117 20 0 BEADLO c1nc(C[N@@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)co1 ZINC000356516641 387667140 /nfs/dbraw/zinc/66/71/40/387667140.db2.gz FCVLCOHJTVVASC-QWHCGFSZSA-N 1 2 248.326 2.208 20 0 BEADLO c1nc(C[N@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)co1 ZINC000356516641 387667145 /nfs/dbraw/zinc/66/71/45/387667145.db2.gz FCVLCOHJTVVASC-QWHCGFSZSA-N 1 2 248.326 2.208 20 0 BEADLO C[C@@H]1C[C@H]1C[NH+]=c1[nH]c2ccc(F)cc2n1C ZINC000431015462 387670715 /nfs/dbraw/zinc/67/07/15/387670715.db2.gz PBRWSIBXQPQIKM-BDAKNGLRSA-N 1 2 233.290 2.202 20 0 BEADLO C[C@@H]1C[C@@H]1C[NH+]=c1[nH]c2ccc(F)cc2n1C ZINC000431015465 387671129 /nfs/dbraw/zinc/67/11/29/387671129.db2.gz PBRWSIBXQPQIKM-RKDXNWHRSA-N 1 2 233.290 2.202 20 0 BEADLO Cc1nn(C)cc1C[NH2+][C@@H](C)c1ncccc1F ZINC000527825862 387745562 /nfs/dbraw/zinc/74/55/62/387745562.db2.gz FFVKHZTURKFQRO-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ncccc2F)n(C)n1 ZINC000527827232 387745799 /nfs/dbraw/zinc/74/57/99/387745799.db2.gz AFWIUBDUYVIKCI-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO CCn1nccc1C[NH2+][C@@H](C)c1ncccc1F ZINC000527825876 387745949 /nfs/dbraw/zinc/74/59/49/387745949.db2.gz GCMJFMZWVOFWGZ-JTQLQIEISA-N 1 2 248.305 2.288 20 0 BEADLO Cc1n[nH]cc1C[NH2+][C@@H](C)c1ncccc1F ZINC000527826698 387746207 /nfs/dbraw/zinc/74/62/07/387746207.db2.gz SARBXBMSDPIMTF-VIFPVBQESA-N 1 2 234.278 2.103 20 0 BEADLO Cc1[nH]c(CN[C@@H](C)c2ncccc2F)[nH+]c1C ZINC000527828912 387748772 /nfs/dbraw/zinc/74/87/72/387748772.db2.gz YWVHSEJTWXUKAJ-JTQLQIEISA-N 1 2 248.305 2.411 20 0 BEADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1cc[nH]n1 ZINC000528772021 387698421 /nfs/dbraw/zinc/69/84/21/387698421.db2.gz KBAHZDCCIPMDAN-MRVPVSSYSA-N 1 2 215.247 2.029 20 0 BEADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1cc[nH]n1 ZINC000528772021 387698426 /nfs/dbraw/zinc/69/84/26/387698426.db2.gz KBAHZDCCIPMDAN-MRVPVSSYSA-N 1 2 215.247 2.029 20 0 BEADLO CC(C)c1nnc2n1CC[N@@H+](CC(C)(C)C)C2 ZINC000377195940 387699253 /nfs/dbraw/zinc/69/92/53/387699253.db2.gz LZGOILFYLDQUEP-UHFFFAOYSA-N 1 2 236.363 2.263 20 0 BEADLO CC(C)c1nnc2n1CC[N@H+](CC(C)(C)C)C2 ZINC000377195940 387699260 /nfs/dbraw/zinc/69/92/60/387699260.db2.gz LZGOILFYLDQUEP-UHFFFAOYSA-N 1 2 236.363 2.263 20 0 BEADLO Cc1cc[nH+]c(NCC(C)(C)O)c1Cl ZINC000306625012 387703128 /nfs/dbraw/zinc/70/31/28/387703128.db2.gz GLPHCLGNMTXKGH-UHFFFAOYSA-N 1 2 214.696 2.226 20 0 BEADLO c1c[nH]c(C[NH2+][C@H](c2ccccn2)C2CCC2)n1 ZINC000527770010 387704556 /nfs/dbraw/zinc/70/45/56/387704556.db2.gz CDJAMALCUIXUGY-AWEZNQCLSA-N 1 2 242.326 2.436 20 0 BEADLO C[C@@H]1CC[C@@H]1[NH+]=c1[nH]c2ccc(F)cc2n1C ZINC000431414995 387708383 /nfs/dbraw/zinc/70/83/83/387708383.db2.gz PKGVDYAQWWMUBI-SCZZXKLOSA-N 1 2 233.290 2.345 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cnn[nH]2)cc1C ZINC000452048103 387713101 /nfs/dbraw/zinc/71/31/01/387713101.db2.gz PDVRQDHSSZIMOO-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cnn[nH]2)cc1C ZINC000452048103 387713105 /nfs/dbraw/zinc/71/31/05/387713105.db2.gz PDVRQDHSSZIMOO-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2c[nH]nn2)cc1C ZINC000452048103 387713111 /nfs/dbraw/zinc/71/31/11/387713111.db2.gz PDVRQDHSSZIMOO-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2c[nH]nn2)cc1C ZINC000452048103 387713114 /nfs/dbraw/zinc/71/31/14/387713114.db2.gz PDVRQDHSSZIMOO-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO CNC(=O)c1cccc(COc2cc[nH+]cc2)c1 ZINC000431506847 387714117 /nfs/dbraw/zinc/71/41/17/387714117.db2.gz PMZHCZYHURUMLT-UHFFFAOYSA-N 1 2 242.278 2.020 20 0 BEADLO COc1ccc[nH+]c1N(C)Cc1nccs1 ZINC000527912408 387764372 /nfs/dbraw/zinc/76/43/72/387764372.db2.gz IACPLDHPBJJIOR-UHFFFAOYSA-N 1 2 235.312 2.183 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC[C@@H]1CC[C@@H](C)C1 ZINC000432269224 387779821 /nfs/dbraw/zinc/77/98/21/387779821.db2.gz JEBLKUYUDSXJGD-ZYHUDNBSSA-N 1 2 247.342 2.370 20 0 BEADLO CC[C@H](COC)Nc1cc[nH+]c(C(C)C)n1 ZINC000150916380 387782021 /nfs/dbraw/zinc/78/20/21/387782021.db2.gz FMJHAKLLZNRZJV-SNVBAGLBSA-N 1 2 223.320 2.437 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1CCC[C@H]1OC ZINC000527945390 387782067 /nfs/dbraw/zinc/78/20/67/387782067.db2.gz IOBGOUFOUJGREZ-WDEREUQCSA-N 1 2 236.315 2.317 20 0 BEADLO CC[N@@H+](Cc1cccs1)Cc1nnc(C)o1 ZINC000061785394 387787649 /nfs/dbraw/zinc/78/76/49/387787649.db2.gz DACHZEFZARONJE-UHFFFAOYSA-N 1 2 237.328 2.462 20 0 BEADLO CC[N@H+](Cc1cccs1)Cc1nnc(C)o1 ZINC000061785394 387787655 /nfs/dbraw/zinc/78/76/55/387787655.db2.gz DACHZEFZARONJE-UHFFFAOYSA-N 1 2 237.328 2.462 20 0 BEADLO CC[C@H]1CCN(c2[nH+]cccc2OC)C1 ZINC000527920890 387789716 /nfs/dbraw/zinc/78/97/16/387789716.db2.gz ZSFCWEXMZGTLGH-JTQLQIEISA-N 1 2 206.289 2.327 20 0 BEADLO COc1ccc[nH+]c1N1C[C@H]2CCC[C@@H]2C1 ZINC000527919785 387789951 /nfs/dbraw/zinc/78/99/51/387789951.db2.gz KGLPVTGZUJUVSP-GHMZBOCLSA-N 1 2 218.300 2.327 20 0 BEADLO CCc1cc(NCc2c[nH+]cn2C(C)C)n(C)n1 ZINC000424150958 387793414 /nfs/dbraw/zinc/79/34/14/387793414.db2.gz GXNXQKPCCBNLHV-UHFFFAOYSA-N 1 2 247.346 2.372 20 0 BEADLO COc1ccc[nH+]c1NCC1(CCO)CCC1 ZINC000527936397 387796391 /nfs/dbraw/zinc/79/63/91/387796391.db2.gz WYZDDRPIIUOJJA-UHFFFAOYSA-N 1 2 236.315 2.055 20 0 BEADLO COC(=O)C[N@H+](C)Cc1ccc(C)c(Cl)c1 ZINC000193713005 387802379 /nfs/dbraw/zinc/80/23/79/387802379.db2.gz JEVRGXGPYOAGRL-UHFFFAOYSA-N 1 2 241.718 2.253 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1ccc(C)c(Cl)c1 ZINC000193713005 387802384 /nfs/dbraw/zinc/80/23/84/387802384.db2.gz JEVRGXGPYOAGRL-UHFFFAOYSA-N 1 2 241.718 2.253 20 0 BEADLO COc1ccc[nH+]c1N1C[C@@H](C)O[C@@H](C2CC2)C1 ZINC000527995869 387805692 /nfs/dbraw/zinc/80/56/92/387805692.db2.gz VPCYGRPXPSUWFK-ZWNOBZJWSA-N 1 2 248.326 2.094 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CCC[C@H]1CCO ZINC000527970349 387813413 /nfs/dbraw/zinc/81/34/13/387813413.db2.gz YEKFKIRXEABCPE-QWRGUYRKSA-N 1 2 236.315 2.053 20 0 BEADLO COc1ccc[nH+]c1N1CC(C)=C[C@@H](C)C1 ZINC000527994983 387805783 /nfs/dbraw/zinc/80/57/83/387805783.db2.gz KCIGUWYWVLGPCI-SNVBAGLBSA-N 1 2 218.300 2.493 20 0 BEADLO CCC(F)(F)C[N@@H+]1CC[C@@H](CO)C[C@H]1C ZINC000639896206 387809839 /nfs/dbraw/zinc/80/98/39/387809839.db2.gz AOSDKHPCCDNVNU-NXEZZACHSA-N 1 2 221.291 2.125 20 0 BEADLO CCC(F)(F)C[N@H+]1CC[C@@H](CO)C[C@H]1C ZINC000639896206 387809846 /nfs/dbraw/zinc/80/98/46/387809846.db2.gz AOSDKHPCCDNVNU-NXEZZACHSA-N 1 2 221.291 2.125 20 0 BEADLO Cc1cc(F)c(C[NH2+]C[C@H](C)N(C)C)c(F)c1 ZINC000424153721 387810169 /nfs/dbraw/zinc/81/01/69/387810169.db2.gz KXYCGLBHFJQINU-JTQLQIEISA-N 1 2 242.313 2.313 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ncccc1F)c1ccn(C)n1 ZINC000528037143 387820200 /nfs/dbraw/zinc/82/02/00/387820200.db2.gz DGQJWZBZMYIOPD-ZJUUUORDSA-N 1 2 248.305 2.366 20 0 BEADLO Cc1cc(NCC[C@H]2CC=CCC2)nc[nH+]1 ZINC000528184185 387873066 /nfs/dbraw/zinc/87/30/66/387873066.db2.gz XSGZBZRAOOFWBL-LBPRGKRZSA-N 1 2 217.316 2.365 20 0 BEADLO CCC[C@H](CNc1cc[nH+]c(C2CC2)n1)OCC ZINC000528084029 387835553 /nfs/dbraw/zinc/83/55/53/387835553.db2.gz REOCJAGWZZXNFI-GFCCVEGCSA-N 1 2 249.358 2.393 20 0 BEADLO CC[C@H]1CCC[C@H]1CNC(=O)CCc1[nH]cc[nH+]1 ZINC000452513079 387845179 /nfs/dbraw/zinc/84/51/79/387845179.db2.gz AAMOCHCYNYIBAP-RYUDHWBXSA-N 1 2 249.358 2.285 20 0 BEADLO C1=CCC(CNc2cc(NCC3CC3)[nH+]cn2)C1 ZINC000528116345 387850610 /nfs/dbraw/zinc/85/06/10/387850610.db2.gz TVFRQPAIXCDCHS-UHFFFAOYSA-N 1 2 244.342 2.099 20 0 BEADLO C1=CCC(CNc2cc(NCC3CC3)nc[nH+]2)C1 ZINC000528116345 387850613 /nfs/dbraw/zinc/85/06/13/387850613.db2.gz TVFRQPAIXCDCHS-UHFFFAOYSA-N 1 2 244.342 2.099 20 0 BEADLO COc1ccnc(C[NH2+]Cc2cccc(C)c2)n1 ZINC000424166324 387851535 /nfs/dbraw/zinc/85/15/35/387851535.db2.gz AINKQWCIKUZOPZ-UHFFFAOYSA-N 1 2 243.310 2.083 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C1(CC(C)C)CC1 ZINC000452568793 387859757 /nfs/dbraw/zinc/85/97/57/387859757.db2.gz BUKQCYVCYWYVOO-UHFFFAOYSA-N 1 2 249.358 2.346 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C[C@H](C)C(C)C ZINC000452576787 387861233 /nfs/dbraw/zinc/86/12/33/387861233.db2.gz VIGCOZYOAKNMRZ-NSHDSACASA-N 1 2 237.347 2.201 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@H]1CCC[C@@H](C)C1 ZINC000452570986 387862682 /nfs/dbraw/zinc/86/26/82/387862682.db2.gz NCWPKRSAMONQKO-NEPJUHHUSA-N 1 2 249.358 2.346 20 0 BEADLO CCC(CC)[N@H+](CCOC)Cc1noc(C)n1 ZINC000064805957 387868084 /nfs/dbraw/zinc/86/80/84/387868084.db2.gz XIOUITCVXKBYPN-UHFFFAOYSA-N 1 2 241.335 2.015 20 0 BEADLO CCC(CC)[N@@H+](CCOC)Cc1noc(C)n1 ZINC000064805957 387868087 /nfs/dbraw/zinc/86/80/87/387868087.db2.gz XIOUITCVXKBYPN-UHFFFAOYSA-N 1 2 241.335 2.015 20 0 BEADLO Cc1nccc(C[NH2+]C(C)(C)c2nccs2)n1 ZINC000235965820 387868440 /nfs/dbraw/zinc/86/84/40/387868440.db2.gz RIFRWCWZOOUEMC-UHFFFAOYSA-N 1 2 248.355 2.266 20 0 BEADLO Cc1cc(N2CCC(F)(F)C[C@@H]2C)nc[nH+]1 ZINC000528209499 387870670 /nfs/dbraw/zinc/87/06/70/387870670.db2.gz SCLWRSXKNNRJAT-VIFPVBQESA-N 1 2 227.258 2.409 20 0 BEADLO COc1ccnc(C[NH2+]Cc2ccc(C)cc2)n1 ZINC000424173047 387871312 /nfs/dbraw/zinc/87/13/12/387871312.db2.gz OUIUULDREHNCLR-UHFFFAOYSA-N 1 2 243.310 2.083 20 0 BEADLO Cc1sccc1C[NH2+][C@@H](C)c1ncn(C)n1 ZINC000293148262 387890370 /nfs/dbraw/zinc/89/03/70/387890370.db2.gz DMFUJYVDXQSWHC-QMMMGPOBSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1cc2ccccc2[nH+]c1NCC1COC1 ZINC000528226420 387882628 /nfs/dbraw/zinc/88/26/28/387882628.db2.gz RPSAQIOMGHRUBK-UHFFFAOYSA-N 1 2 228.295 2.023 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@H]1[C@H](C2CC2)[C@@H]1C ZINC000528321319 387901787 /nfs/dbraw/zinc/90/17/87/387901787.db2.gz YJWAMONFDPWPRH-AQUOVQTQSA-N 1 2 246.310 2.321 20 0 BEADLO CCCC[N@H+](CC)Cc1nsc(N(C)C)n1 ZINC000163721678 387907688 /nfs/dbraw/zinc/90/76/88/387907688.db2.gz AUIIHQKDCNQHDC-UHFFFAOYSA-N 1 2 242.392 2.226 20 0 BEADLO CCCC[N@@H+](CC)Cc1nsc(N(C)C)n1 ZINC000163721678 387907690 /nfs/dbraw/zinc/90/76/90/387907690.db2.gz AUIIHQKDCNQHDC-UHFFFAOYSA-N 1 2 242.392 2.226 20 0 BEADLO Cc1cn[nH]c1C[NH2+][C@@H]1C[C@@]1(F)c1ccccc1 ZINC000424189460 387910357 /nfs/dbraw/zinc/91/03/57/387910357.db2.gz DQFXZSQAQMZLIN-ZIAGYGMSSA-N 1 2 245.301 2.445 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@@H]1C[C@@]1(F)c1ccccc1 ZINC000424189460 387910363 /nfs/dbraw/zinc/91/03/63/387910363.db2.gz DQFXZSQAQMZLIN-ZIAGYGMSSA-N 1 2 245.301 2.445 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)cs1 ZINC000438353048 387925961 /nfs/dbraw/zinc/92/59/61/387925961.db2.gz JEMVKWNHVXQHAP-AEJSXWLSSA-N 1 2 240.372 2.449 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)cs1 ZINC000438353048 387925963 /nfs/dbraw/zinc/92/59/63/387925963.db2.gz JEMVKWNHVXQHAP-AEJSXWLSSA-N 1 2 240.372 2.449 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)cs1 ZINC000438353053 387926800 /nfs/dbraw/zinc/92/68/00/387926800.db2.gz JEMVKWNHVXQHAP-LPEHRKFASA-N 1 2 240.372 2.449 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)cs1 ZINC000438353053 387926803 /nfs/dbraw/zinc/92/68/03/387926803.db2.gz JEMVKWNHVXQHAP-LPEHRKFASA-N 1 2 240.372 2.449 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cccc3c2OCO3)[C@@H](C)CO1 ZINC000245515231 387953696 /nfs/dbraw/zinc/95/36/96/387953696.db2.gz HEEXHXMBZBWCNJ-WDEREUQCSA-N 1 2 249.310 2.025 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cccc3c2OCO3)[C@@H](C)CO1 ZINC000245515231 387953700 /nfs/dbraw/zinc/95/37/00/387953700.db2.gz HEEXHXMBZBWCNJ-WDEREUQCSA-N 1 2 249.310 2.025 20 0 BEADLO COC[C@]1(C)CCN(c2cc[nH+]c(C(C)C)n2)C1 ZINC000450604726 387939349 /nfs/dbraw/zinc/93/93/49/387939349.db2.gz LZHINMJGARDPCZ-CQSZACIVSA-N 1 2 249.358 2.463 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2nnc(C)[nH]2)c(C)o1 ZINC000392343946 387956307 /nfs/dbraw/zinc/95/63/07/387956307.db2.gz DBSXMEHSSAAEFU-QMMMGPOBSA-N 1 2 234.303 2.174 20 0 BEADLO CCCC(=O)NCc1ccc(N(CC)CC)[nH+]c1 ZINC000057518393 387949242 /nfs/dbraw/zinc/94/92/42/387949242.db2.gz OAMJIQSLTXINLD-UHFFFAOYSA-N 1 2 249.358 2.344 20 0 BEADLO CC(C)C(C)(C)CNC(=O)C[NH+]1CC(C)(C)C1 ZINC000516979102 387964473 /nfs/dbraw/zinc/96/44/73/387964473.db2.gz LIFVKSAZUIDZLY-UHFFFAOYSA-N 1 2 240.391 2.127 20 0 BEADLO Cc1cc(NC(=O)N2[C@H](C)C[C@@H]2C)c(C)c[nH+]1 ZINC000548090026 387979177 /nfs/dbraw/zinc/97/91/77/387979177.db2.gz LNGSHUUPZLBORA-PHIMTYICSA-N 1 2 233.315 2.135 20 0 BEADLO C[N@H+](CC1=CCCC1)Cc1nnc2ccccn21 ZINC000645812888 387981576 /nfs/dbraw/zinc/98/15/76/387981576.db2.gz JAULHLKAKKNIQB-UHFFFAOYSA-N 1 2 242.326 2.271 20 0 BEADLO C[N@@H+](CC1=CCCC1)Cc1nnc2ccccn21 ZINC000645812888 387981580 /nfs/dbraw/zinc/98/15/80/387981580.db2.gz JAULHLKAKKNIQB-UHFFFAOYSA-N 1 2 242.326 2.271 20 0 BEADLO C[C@@H](O)CCSc1[nH+]cc2ccccn21 ZINC000439277215 387988970 /nfs/dbraw/zinc/98/89/70/387988970.db2.gz OFBZHLBTQXKIPO-SECBINFHSA-N 1 2 222.313 2.197 20 0 BEADLO CO[C@H](C)[C@H](C)Nc1ccc2c(c1)CC[NH2+]2 ZINC000423214213 387997195 /nfs/dbraw/zinc/99/71/95/387997195.db2.gz KYWBXKYZUDONIT-VHSXEESVSA-N 1 2 220.316 2.490 20 0 BEADLO Cc1cc(NC(=O)NC[C@H]2CCC[C@H]2C)cc[nH+]1 ZINC000439456927 387997981 /nfs/dbraw/zinc/99/79/81/387997981.db2.gz PELVVBQLAPICBM-ZYHUDNBSSA-N 1 2 247.342 2.370 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C(C)(C)C(C)C ZINC000439494257 388004698 /nfs/dbraw/zinc/00/46/98/388004698.db2.gz IVQYRXVFKWCATI-UHFFFAOYSA-N 1 2 223.320 2.017 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1nnc(C2CC2)n1C1CC1 ZINC000548754614 388009050 /nfs/dbraw/zinc/00/90/50/388009050.db2.gz AYOFVANKICTVLS-UWVGGRQHSA-N 1 2 246.358 2.473 20 0 BEADLO CC[C@@H]([NH2+][C@H](C)c1ccnn1C)C(F)F ZINC000453243629 388013070 /nfs/dbraw/zinc/01/30/70/388013070.db2.gz JAKRNFNHDXCZCQ-HTQZYQBOSA-N 1 2 217.263 2.114 20 0 BEADLO CO[C@@H]1C[C@H](Nc2cc[nH+]c(C3CC3)n2)C1(C)C ZINC000440190217 388035069 /nfs/dbraw/zinc/03/50/69/388035069.db2.gz IYTWFYKVJIRPHH-WDEREUQCSA-N 1 2 247.342 2.001 20 0 BEADLO CC[C@@H](F)C[NH+]1CCN(C[C@@H](F)CC)CC1 ZINC000440694989 388068160 /nfs/dbraw/zinc/06/81/60/388068160.db2.gz SIJJBQHKLMWWSK-TXEJJXNPSA-N 1 2 234.334 2.100 20 0 BEADLO CC[C@@H](F)CN1CC[NH+](C[C@@H](F)CC)CC1 ZINC000440694989 388068162 /nfs/dbraw/zinc/06/81/62/388068162.db2.gz SIJJBQHKLMWWSK-TXEJJXNPSA-N 1 2 234.334 2.100 20 0 BEADLO CC[C@@H](F)CN1CC[NH+](Cc2ccco2)CC1 ZINC000440697125 388068765 /nfs/dbraw/zinc/06/87/65/388068765.db2.gz LFNCVBRGECQZMA-GFCCVEGCSA-N 1 2 240.322 2.145 20 0 BEADLO CC[C@@H](F)C[NH+]1CCN(Cc2ccco2)CC1 ZINC000440697125 388068769 /nfs/dbraw/zinc/06/87/69/388068769.db2.gz LFNCVBRGECQZMA-GFCCVEGCSA-N 1 2 240.322 2.145 20 0 BEADLO Cn1c[nH+]cc1CNc1cccc(F)c1F ZINC000085169289 388084412 /nfs/dbraw/zinc/08/44/12/388084412.db2.gz OESSSHMDXKAUDL-UHFFFAOYSA-N 1 2 223.226 2.310 20 0 BEADLO CCc1cc(N)nc(SCc2cccnc2)[nH+]1 ZINC000447775439 388091902 /nfs/dbraw/zinc/09/19/02/388091902.db2.gz HWPRBHGGEDUBFM-UHFFFAOYSA-N 1 2 246.339 2.139 20 0 BEADLO CC[C@H]([NH2+][C@@H]1C[C@H]1C1CCCCC1)C(=O)OC ZINC000447793767 388092846 /nfs/dbraw/zinc/09/28/46/388092846.db2.gz AHHDUGRJVZPDPU-RWMBFGLXSA-N 1 2 239.359 2.496 20 0 BEADLO CCO[C@@H]1C[C@@H]([NH2+]Cc2ccn[nH]2)C12CCCC2 ZINC000085680480 388094212 /nfs/dbraw/zinc/09/42/12/388094212.db2.gz KKCKLJCBISAYFG-CHWSQXEVSA-N 1 2 249.358 2.237 20 0 BEADLO CN(CCCC[N@H+](C)CC(F)F)CC(F)F ZINC000118401520 388095795 /nfs/dbraw/zinc/09/57/95/388095795.db2.gz VOUUMMYCYYXTKS-UHFFFAOYSA-N 1 2 244.276 2.160 20 0 BEADLO CN(CCCC[N@@H+](C)CC(F)F)CC(F)F ZINC000118401520 388095797 /nfs/dbraw/zinc/09/57/97/388095797.db2.gz VOUUMMYCYYXTKS-UHFFFAOYSA-N 1 2 244.276 2.160 20 0 BEADLO FC(F)C[N@@H+]1CC[C@H](c2cccnc2)C1 ZINC000645982248 388115674 /nfs/dbraw/zinc/11/56/74/388115674.db2.gz SDMQKNXVFHFWBL-JTQLQIEISA-N 1 2 212.243 2.136 20 0 BEADLO FC(F)C[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000645982248 388115675 /nfs/dbraw/zinc/11/56/75/388115675.db2.gz SDMQKNXVFHFWBL-JTQLQIEISA-N 1 2 212.243 2.136 20 0 BEADLO C[C@@H]1CCC[C@@H](C[N@H+]2CC(=O)N(C3CC3)C2)C1 ZINC000447923067 388103341 /nfs/dbraw/zinc/10/33/41/388103341.db2.gz RBOILDXFDMYLKI-VXGBXAGGSA-N 1 2 236.359 2.077 20 0 BEADLO C[C@@H]1CCC[C@@H](C[N@@H+]2CC(=O)N(C3CC3)C2)C1 ZINC000447923067 388103345 /nfs/dbraw/zinc/10/33/45/388103345.db2.gz RBOILDXFDMYLKI-VXGBXAGGSA-N 1 2 236.359 2.077 20 0 BEADLO C[C@@H]1CCC[C@H](C[N@H+]2CC(=O)N(C3CC3)C2)C1 ZINC000447923064 388103994 /nfs/dbraw/zinc/10/39/94/388103994.db2.gz RBOILDXFDMYLKI-NEPJUHHUSA-N 1 2 236.359 2.077 20 0 BEADLO C[C@@H]1CCC[C@H](C[N@@H+]2CC(=O)N(C3CC3)C2)C1 ZINC000447923064 388103997 /nfs/dbraw/zinc/10/39/97/388103997.db2.gz RBOILDXFDMYLKI-NEPJUHHUSA-N 1 2 236.359 2.077 20 0 BEADLO CC[C@H](C)NC(=O)N[C@@H](C)c1[nH+]ccn1CC ZINC000454185528 388104369 /nfs/dbraw/zinc/10/43/69/388104369.db2.gz IHFPTOAMTVWLFT-UWVGGRQHSA-N 1 2 238.335 2.062 20 0 BEADLO CC[C@@H](C)NC(=O)NCc1c[nH+]c(C)cc1C ZINC000454188482 388105358 /nfs/dbraw/zinc/10/53/58/388105358.db2.gz OHMOEIFWKCMTMI-SNVBAGLBSA-N 1 2 235.331 2.296 20 0 BEADLO C[C@H](O)C[N@@H+](CC1=CCCC1)CC(F)F ZINC000645925861 388109604 /nfs/dbraw/zinc/10/96/04/388109604.db2.gz VNSCAHUGOKIQLZ-VIFPVBQESA-N 1 2 219.275 2.045 20 0 BEADLO C[C@H](O)C[N@H+](CC1=CCCC1)CC(F)F ZINC000645925861 388109606 /nfs/dbraw/zinc/10/96/06/388109606.db2.gz VNSCAHUGOKIQLZ-VIFPVBQESA-N 1 2 219.275 2.045 20 0 BEADLO CCOC(=O)C[N@H+](C[C@@H](F)CC)C(C)C ZINC000440498955 388045195 /nfs/dbraw/zinc/04/51/95/388045195.db2.gz LUOBSZFBFUSWOK-JTQLQIEISA-N 1 2 219.300 2.008 20 0 BEADLO CCOC(=O)C[N@@H+](C[C@@H](F)CC)C(C)C ZINC000440498955 388045197 /nfs/dbraw/zinc/04/51/97/388045197.db2.gz LUOBSZFBFUSWOK-JTQLQIEISA-N 1 2 219.300 2.008 20 0 BEADLO Fc1cccc(C[NH2+][C@@H]2CCn3ccnc32)c1F ZINC000648628015 388045437 /nfs/dbraw/zinc/04/54/37/388045437.db2.gz JNJVUPULMDMJIW-LLVKDONJSA-N 1 2 249.264 2.396 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)NC(CF)CF ZINC000455446231 388160065 /nfs/dbraw/zinc/16/00/65/388160065.db2.gz RYPUISHWKGQMLN-UHFFFAOYSA-N 1 2 243.257 2.128 20 0 BEADLO O=C(CCn1cc[nH+]c1)NC12CCC(CC1)CC2 ZINC000456240089 388187845 /nfs/dbraw/zinc/18/78/45/388187845.db2.gz DCSFJYUOJAZZCA-UHFFFAOYSA-N 1 2 247.342 2.112 20 0 BEADLO CCn1cc[nH+]c1CN(C)Cc1ccc(C)o1 ZINC000195513825 388165698 /nfs/dbraw/zinc/16/56/98/388165698.db2.gz VRQXEILAMLUKCO-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CC(F)(F)C[NH2+]Cc1ccc(O)cc1 ZINC000646244400 388170092 /nfs/dbraw/zinc/17/00/92/388170092.db2.gz BMCLEBDJVHLNNE-UHFFFAOYSA-N 1 2 201.216 2.137 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@]1(C)CC=CCC1 ZINC000456091542 388176684 /nfs/dbraw/zinc/17/66/84/388176684.db2.gz FPSBJPNWFIPPJE-CQSZACIVSA-N 1 2 247.342 2.266 20 0 BEADLO Cc1c[nH+]c(CN2CCC[C@](C)(F)C2)n1C ZINC000449348505 388178988 /nfs/dbraw/zinc/17/89/88/388178988.db2.gz GWSWMMUWDHXZEM-LBPRGKRZSA-N 1 2 225.311 2.053 20 0 BEADLO CC[C@@H]([NH2+]Cc1c[nH]c2nccnc12)C(F)F ZINC000449357100 388180716 /nfs/dbraw/zinc/18/07/16/388180716.db2.gz BMVRUNOKVDRATN-MRVPVSSYSA-N 1 2 240.257 2.043 20 0 BEADLO COC(=O)[C@H]([NH2+]C[C@H]1C[C@@H]1C)c1ccccc1 ZINC000488509126 388182774 /nfs/dbraw/zinc/18/27/74/388182774.db2.gz CJMGKXWXJUEKFH-CYZMBNFOSA-N 1 2 233.311 2.146 20 0 BEADLO CCOC(=O)c1ccc(C[NH+]2CC3(CC3)C2)o1 ZINC000449369123 388183984 /nfs/dbraw/zinc/18/39/84/388183984.db2.gz AXWLQAIYMQPSPR-UHFFFAOYSA-N 1 2 235.283 2.052 20 0 BEADLO CCOc1cccc(C[NH2+]C(CF)CF)c1 ZINC000449373160 388185260 /nfs/dbraw/zinc/18/52/60/388185260.db2.gz OTMMZKDJCIJUCQ-UHFFFAOYSA-N 1 2 229.270 2.483 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)NCCc2[nH]cc[nH+]2)C[C@H]1C ZINC000448947993 388122237 /nfs/dbraw/zinc/12/22/37/388122237.db2.gz BFLSIFJZXIRVPF-UTUOFQBUSA-N 1 2 249.358 2.141 20 0 BEADLO CCC[C@H]1CCC[C@H]1C(=O)NCCc1[nH]cc[nH+]1 ZINC000448955942 388123052 /nfs/dbraw/zinc/12/30/52/388123052.db2.gz YGQSFDDNQUTROV-NWDGAFQWSA-N 1 2 249.358 2.285 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2ccncc2F)CCO1 ZINC000449032397 388133380 /nfs/dbraw/zinc/13/33/80/388133380.db2.gz YHQXSMZFVPYNDI-GFCCVEGCSA-N 1 2 238.306 2.222 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2ccncc2F)CCO1 ZINC000449032397 388133382 /nfs/dbraw/zinc/13/33/82/388133382.db2.gz YHQXSMZFVPYNDI-GFCCVEGCSA-N 1 2 238.306 2.222 20 0 BEADLO Cc1ccc(N[C@H]2CCCOCC2)c[nH+]1 ZINC000164845044 388249105 /nfs/dbraw/zinc/24/91/05/388249105.db2.gz BDUWZPKBTKDYMX-NSHDSACASA-N 1 2 206.289 2.371 20 0 BEADLO CC(C)OC(=O)[C@H](C)[NH2+][C@@H](C)Cc1ccoc1 ZINC000449659399 388249950 /nfs/dbraw/zinc/24/99/50/388249950.db2.gz BFFCXIOJOBFQGI-QWRGUYRKSA-N 1 2 239.315 2.140 20 0 BEADLO CC(C)OC(=O)[C@H](C)[NH2+]C1Cc2ccccc2C1 ZINC000449663332 388250249 /nfs/dbraw/zinc/25/02/49/388250249.db2.gz ODOHBLLWEUGTMY-NSHDSACASA-N 1 2 247.338 2.084 20 0 BEADLO COc1cccc(C[N@@H+]2CC[C@@H](F)C2)c1OC ZINC000449389794 388191808 /nfs/dbraw/zinc/19/18/08/388191808.db2.gz UBVDKYHVBFHNBO-LLVKDONJSA-N 1 2 239.290 2.248 20 0 BEADLO COc1cccc(C[N@H+]2CC[C@@H](F)C2)c1OC ZINC000449389794 388191810 /nfs/dbraw/zinc/19/18/10/388191810.db2.gz UBVDKYHVBFHNBO-LLVKDONJSA-N 1 2 239.290 2.248 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)[C@H](C)C(C)C ZINC000456344961 388195672 /nfs/dbraw/zinc/19/56/72/388195672.db2.gz GEURYRPVAMEZEJ-GHMZBOCLSA-N 1 2 237.347 2.372 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)[C@@H](C)C(C)C ZINC000456344965 388195769 /nfs/dbraw/zinc/19/57/69/388195769.db2.gz GEURYRPVAMEZEJ-WDEREUQCSA-N 1 2 237.347 2.372 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@H]1CC1(C)C ZINC000456361230 388196465 /nfs/dbraw/zinc/19/64/65/388196465.db2.gz RWDLRXHRUSXPLX-VHSXEESVSA-N 1 2 235.331 2.126 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)C[C@H]1C[C@@H]1C ZINC000456350476 388197006 /nfs/dbraw/zinc/19/70/06/388197006.db2.gz KBUQQABCTHJMNO-GARJFASQSA-N 1 2 235.331 2.126 20 0 BEADLO CCC[C@H](C)C(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456371498 388197524 /nfs/dbraw/zinc/19/75/24/388197524.db2.gz IKCDYLXBYCEMIB-DCAQKATOSA-N 1 2 235.331 2.441 20 0 BEADLO C[C@H]1C[C@H](NC(=O)[C@H]2CC2(C)C)c2[nH+]ccn21 ZINC000456421001 388200328 /nfs/dbraw/zinc/20/03/28/388200328.db2.gz NARHJNRFAJWCPB-AEJSXWLSSA-N 1 2 233.315 2.051 20 0 BEADLO CC[N@H+](Cc1ccc(C)cc1OC)C1COC1 ZINC000449423984 388201463 /nfs/dbraw/zinc/20/14/63/388201463.db2.gz ISRPFCAZNNMMDO-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO CC[N@@H+](Cc1ccc(C)cc1OC)C1COC1 ZINC000449423984 388201464 /nfs/dbraw/zinc/20/14/64/388201464.db2.gz ISRPFCAZNNMMDO-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO FCC1CC[NH+](Cc2ccn(C(F)F)n2)CC1 ZINC000449458629 388210760 /nfs/dbraw/zinc/21/07/60/388210760.db2.gz PIWZNHLGTGXVSQ-UHFFFAOYSA-N 1 2 247.264 2.460 20 0 BEADLO CC[C@@H](NC(=O)c1c[nH+]c(C)[nH]1)C1CCCC1 ZINC000456655251 388213551 /nfs/dbraw/zinc/21/35/51/388213551.db2.gz HYEZXAOSKPBVJF-LLVKDONJSA-N 1 2 235.331 2.417 20 0 BEADLO CC[C@@H](NC(=O)Cc1[nH]c[nH+]c1C)C1CCCC1 ZINC000456666012 388213980 /nfs/dbraw/zinc/21/39/80/388213980.db2.gz STGNGFQRKAIFSV-GFCCVEGCSA-N 1 2 249.358 2.346 20 0 BEADLO CC[C@@H](NC(=O)Cc1[nH+]c[nH]c1C)C1CCCC1 ZINC000456666012 388213983 /nfs/dbraw/zinc/21/39/83/388213983.db2.gz STGNGFQRKAIFSV-GFCCVEGCSA-N 1 2 249.358 2.346 20 0 BEADLO CC(C)Cn1ncnc1C[N@H+](C)[C@H]1CC1(C)C ZINC000489496955 388218777 /nfs/dbraw/zinc/21/87/77/388218777.db2.gz NIRFNEUGNODPJZ-NSHDSACASA-N 1 2 236.363 2.164 20 0 BEADLO CC(C)Cn1ncnc1C[N@@H+](C)[C@H]1CC1(C)C ZINC000489496955 388218779 /nfs/dbraw/zinc/21/87/79/388218779.db2.gz NIRFNEUGNODPJZ-NSHDSACASA-N 1 2 236.363 2.164 20 0 BEADLO CC[C@H](C)C(=O)NCc1c[nH+]c(C)cc1C ZINC000456860966 388228241 /nfs/dbraw/zinc/22/82/41/388228241.db2.gz OJRKFKBOPNDPAP-VIFPVBQESA-N 1 2 220.316 2.361 20 0 BEADLO CC[C@@H](CC(C)C)C(=O)NCCn1cc[nH+]c1 ZINC000449574226 388236862 /nfs/dbraw/zinc/23/68/62/388236862.db2.gz TZIUWRYRYSDRDD-LBPRGKRZSA-N 1 2 237.347 2.072 20 0 BEADLO CCc1ncc(C[NH2+]Cc2occc2C)o1 ZINC000449608665 388241636 /nfs/dbraw/zinc/24/16/36/388241636.db2.gz JJIDDWWGZYDGNG-UHFFFAOYSA-N 1 2 220.272 2.428 20 0 BEADLO Cc1ccc(C[N@@H+](CC(F)F)C[C@H](C)O)cc1 ZINC000449631389 388245882 /nfs/dbraw/zinc/24/58/82/388245882.db2.gz PCMVFYSUIMEHGU-NSHDSACASA-N 1 2 243.297 2.443 20 0 BEADLO Cc1ccc(C[N@H+](CC(F)F)C[C@H](C)O)cc1 ZINC000449631389 388245885 /nfs/dbraw/zinc/24/58/85/388245885.db2.gz PCMVFYSUIMEHGU-NSHDSACASA-N 1 2 243.297 2.443 20 0 BEADLO COC1(C)C[NH+](C/C=C/c2ccccc2)C1 ZINC000459576514 388246346 /nfs/dbraw/zinc/24/63/46/388246346.db2.gz GIPWMKVGAMEZHM-RMKNXTFCSA-N 1 2 217.312 2.421 20 0 BEADLO Cc1ccc(N[C@@H]2CCO[C@H](C)C2)c[nH+]1 ZINC000164812495 388248067 /nfs/dbraw/zinc/24/80/67/388248067.db2.gz DMCODAFNRHVLAK-GHMZBOCLSA-N 1 2 206.289 2.369 20 0 BEADLO O=C(/C=C\C1CC1)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000491931189 388328467 /nfs/dbraw/zinc/32/84/67/388328467.db2.gz YEPBRXSYFOLLRM-FJOGCWAESA-N 1 2 245.326 2.082 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N1CCCC[C@H]1C ZINC000492299100 388340755 /nfs/dbraw/zinc/34/07/55/388340755.db2.gz LVUUISKMXGIRFF-QDZRJHCZSA-N 1 2 247.342 2.317 20 0 BEADLO Cc1cc(NC(=O)C=CC2CCC2)c(C)c[nH+]1 ZINC000492319488 388341473 /nfs/dbraw/zinc/34/14/73/388341473.db2.gz NJBSJSUNXITJFL-SREVYHEPSA-N 1 2 230.311 2.415 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N1CC[C@H](C)[C@H]1C ZINC000492410334 388343745 /nfs/dbraw/zinc/34/37/45/388343745.db2.gz RIZHQPLFFCHSNK-ABZJQCSKSA-N 1 2 247.342 2.173 20 0 BEADLO CC[C@@H]1CCN(C(=O)/C=C/c2[nH+]ccn2CC)C1 ZINC000492411046 388343867 /nfs/dbraw/zinc/34/38/67/388343867.db2.gz SCKXQCWOUVGURC-BTDICHCPSA-N 1 2 247.342 2.175 20 0 BEADLO CCC(C)(CC)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000646365866 388346312 /nfs/dbraw/zinc/34/63/12/388346312.db2.gz MQJFPXWGHCWHJU-SECBINFHSA-N 1 2 223.320 2.413 20 0 BEADLO CO[C@@H](C)[C@H](C)Nc1cc[nH+]c(C2CC2)n1 ZINC000276169153 388347321 /nfs/dbraw/zinc/34/73/21/388347321.db2.gz SXTJFPPKEKLPSX-IUCAKERBSA-N 1 2 221.304 2.189 20 0 BEADLO CN(CC(C)(C)C)c1nc[nH+]c(N)c1Cl ZINC000234254821 388354103 /nfs/dbraw/zinc/35/41/03/388354103.db2.gz NIWACUJWXPPHKQ-UHFFFAOYSA-N 1 2 228.727 2.195 20 0 BEADLO CN(CC(C)(C)C)c1[nH+]cnc(N)c1Cl ZINC000234254821 388354104 /nfs/dbraw/zinc/35/41/04/388354104.db2.gz NIWACUJWXPPHKQ-UHFFFAOYSA-N 1 2 228.727 2.195 20 0 BEADLO Cc1nc(N2C[C@H](C)CC[C@@H]2C)cc[nH+]1 ZINC000173783659 388365817 /nfs/dbraw/zinc/36/58/17/388365817.db2.gz OOARHCISJMQYCZ-ZJUUUORDSA-N 1 2 205.305 2.410 20 0 BEADLO COc1ccc2[nH+]c(NC[C@H](C)CO)ccc2c1 ZINC000193523455 388366385 /nfs/dbraw/zinc/36/63/85/388366385.db2.gz PLWOKLVQRQWDAF-JTQLQIEISA-N 1 2 246.310 2.284 20 0 BEADLO C[C@H](CO)[N@H+](C)Cc1ccc(Cl)nc1Cl ZINC000235463747 388369600 /nfs/dbraw/zinc/36/96/00/388369600.db2.gz CHOISMIUHOEWSV-SSDOTTSWSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@H](CO)[N@@H+](C)Cc1ccc(Cl)nc1Cl ZINC000235463747 388369603 /nfs/dbraw/zinc/36/96/03/388369603.db2.gz CHOISMIUHOEWSV-SSDOTTSWSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@H](Nc1nc[nH+]c(N)c1Cl)C1CCC1 ZINC000235561042 388371693 /nfs/dbraw/zinc/37/16/93/388371693.db2.gz APANTFSRNINEFU-LURJTMIESA-N 1 2 226.711 2.313 20 0 BEADLO C[C@H](Nc1[nH+]cnc(N)c1Cl)C1CCC1 ZINC000235561042 388371695 /nfs/dbraw/zinc/37/16/95/388371695.db2.gz APANTFSRNINEFU-LURJTMIESA-N 1 2 226.711 2.313 20 0 BEADLO COc1ccccc1[C@H](CO)Nc1cccc[nH+]1 ZINC000524687710 388373963 /nfs/dbraw/zinc/37/39/63/388373963.db2.gz KZRLPGXXSBRVHG-LBPRGKRZSA-N 1 2 244.294 2.236 20 0 BEADLO C[C@@H](CC(=O)N1C[C@@H](C)[C@H](C)[C@@H]1C)n1cc[nH+]c1 ZINC000573005365 388405569 /nfs/dbraw/zinc/40/55/69/388405569.db2.gz NABPLNVNGHMWIZ-VOAKCMCISA-N 1 2 249.358 2.337 20 0 BEADLO Nc1[nH+]cnc(N[C@H]2CC=CCC2)c1Cl ZINC000236393443 388379010 /nfs/dbraw/zinc/37/90/10/388379010.db2.gz CTGCNOJHIYGMJK-ZETCQYMHSA-N 1 2 224.695 2.233 20 0 BEADLO Nc1nc[nH+]c(N[C@H]2CC=CCC2)c1Cl ZINC000236393443 388379011 /nfs/dbraw/zinc/37/90/11/388379011.db2.gz CTGCNOJHIYGMJK-ZETCQYMHSA-N 1 2 224.695 2.233 20 0 BEADLO CC[C@H]([NH3+])C(=O)N[C@H]1CCC[C@H]1CCC(C)C ZINC000236946256 388386891 /nfs/dbraw/zinc/38/68/91/388386891.db2.gz BJFPJMBDDOXXSU-AVGNSLFASA-N 1 2 240.391 2.445 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1CCO[C@@H](C2CC2)C1 ZINC000572900067 388387061 /nfs/dbraw/zinc/38/70/61/388387061.db2.gz UNTIUPDXJFIRQC-CHWSQXEVSA-N 1 2 247.342 2.463 20 0 BEADLO COCc1cccc(C[NH2+]Cc2cocn2)c1 ZINC000237229064 388391979 /nfs/dbraw/zinc/39/19/79/388391979.db2.gz QNDCEDJHVONTSD-UHFFFAOYSA-N 1 2 232.283 2.111 20 0 BEADLO Cc1ccoc1C[NH2+][C@@H]1CCn2ccnc21 ZINC000293860352 388392849 /nfs/dbraw/zinc/39/28/49/388392849.db2.gz DGLNJCDXZVGRSL-SNVBAGLBSA-N 1 2 217.272 2.019 20 0 BEADLO CC[C@H]([NH2+]CC(F)(F)CO)c1ccsc1 ZINC000294455247 388400216 /nfs/dbraw/zinc/40/02/16/388400216.db2.gz SOGGGUWTUIIJTQ-VIFPVBQESA-N 1 2 235.299 2.416 20 0 BEADLO C[C@H]([NH2+][C@H]1C=CCCCCC1)c1ncn(C)n1 ZINC000294711295 388403203 /nfs/dbraw/zinc/40/32/03/388403203.db2.gz VDKZOMHBZJFHBX-RYUDHWBXSA-N 1 2 234.347 2.355 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C=CC1CCC1 ZINC000492065654 388333406 /nfs/dbraw/zinc/33/34/06/388333406.db2.gz IAMKAHMBGREXPK-WAYWQWQTSA-N 1 2 216.284 2.107 20 0 BEADLO C/C=C/C=C\C(=O)NCc1ccn2cc[nH+]c2c1 ZINC000492112151 388335354 /nfs/dbraw/zinc/33/53/54/388335354.db2.gz NGRFCNQJCPHNGH-IAROGAJJSA-N 1 2 241.294 2.083 20 0 BEADLO C/C=C(/C=C\C(=O)N1CC(n2cc[nH+]c2)C1)CC ZINC000492138844 388336240 /nfs/dbraw/zinc/33/62/40/388336240.db2.gz QOCHHQFPUJJXRF-JQFMXUTPSA-N 1 2 245.326 2.179 20 0 BEADLO C/C=C(/C=C/C(=O)N(C)Cc1[nH]cc[nH+]1)CC ZINC000492152086 388336493 /nfs/dbraw/zinc/33/64/93/388336493.db2.gz BWJPCFHSKAYVAH-HNGDNPSASA-N 1 2 233.315 2.281 20 0 BEADLO CCCC[C@H]([NH2+]C[C@](C)(CC)OC)C(=O)OC ZINC000322616365 388440716 /nfs/dbraw/zinc/44/07/16/388440716.db2.gz MHXXDHJCFJXVTB-AAEUAGOBSA-N 1 2 245.363 2.123 20 0 BEADLO C[NH2+]Cc1noc([C@H]2CCC[C@@H](C)C2)n1 ZINC000334554812 388445796 /nfs/dbraw/zinc/44/57/96/388445796.db2.gz DGSOUBBAFSULBF-BDAKNGLRSA-N 1 2 209.293 2.083 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)CC[C@H]1CCOC1 ZINC000176025484 388449578 /nfs/dbraw/zinc/44/95/78/388449578.db2.gz KBPSATLPNLQYLN-NSHDSACASA-N 1 2 234.299 2.145 20 0 BEADLO Cc1cc(NC(=O)Cc2ccc(O)cc2)cc[nH+]1 ZINC000082260973 388463417 /nfs/dbraw/zinc/46/34/17/388463417.db2.gz LWGXWMWMOAMLOC-UHFFFAOYSA-N 1 2 242.278 2.277 20 0 BEADLO C[C@H]([NH2+][C@H]1CSC[C@@H]1C)C(=O)OC(C)(C)C ZINC000336706009 388465471 /nfs/dbraw/zinc/46/54/71/388465471.db2.gz PSOZXBFVFMZCNU-GUBZILKMSA-N 1 2 245.388 2.058 20 0 BEADLO C[C@H](CC(=O)N1CCCCCC1)n1cc[nH+]c1 ZINC000573124394 388421699 /nfs/dbraw/zinc/42/16/99/388421699.db2.gz YYUZLDSSPULTCF-GFCCVEGCSA-N 1 2 235.331 2.237 20 0 BEADLO CC[C@@H](C)CN(CC)c1[nH+]cnc2c1cnn2C ZINC000175056269 388423257 /nfs/dbraw/zinc/42/32/57/388423257.db2.gz ONMJMODPDFSEGQ-SNVBAGLBSA-N 1 2 247.346 2.236 20 0 BEADLO CC[C@H](C)CN(CC)c1[nH+]cnc2c1cnn2C ZINC000175056285 388423527 /nfs/dbraw/zinc/42/35/27/388423527.db2.gz ONMJMODPDFSEGQ-JTQLQIEISA-N 1 2 247.346 2.236 20 0 BEADLO CCC[C@@H](CC(C)C)C(=O)NCc1c[nH+]c[nH]1 ZINC000308092095 388431339 /nfs/dbraw/zinc/43/13/39/388431339.db2.gz SWJZIJRKGBRSAW-NSHDSACASA-N 1 2 237.347 2.488 20 0 BEADLO CCC[C@@H](CC(C)C)C(=O)NCc1c[nH]c[nH+]1 ZINC000308092095 388431341 /nfs/dbraw/zinc/43/13/41/388431341.db2.gz SWJZIJRKGBRSAW-NSHDSACASA-N 1 2 237.347 2.488 20 0 BEADLO CC[C@@H](CC(C)C)C(=O)NCc1c[nH+]c[nH]1 ZINC000308088605 388431400 /nfs/dbraw/zinc/43/14/00/388431400.db2.gz NPRXZXISQMIPGW-JTQLQIEISA-N 1 2 223.320 2.098 20 0 BEADLO CC[C@@H](CC(C)C)C(=O)NCc1c[nH]c[nH+]1 ZINC000308088605 388431403 /nfs/dbraw/zinc/43/14/03/388431403.db2.gz NPRXZXISQMIPGW-JTQLQIEISA-N 1 2 223.320 2.098 20 0 BEADLO COc1c(O)cccc1C[N@@H+]1CCC[C@H](F)C1 ZINC000573258284 388435586 /nfs/dbraw/zinc/43/55/86/388435586.db2.gz WYNULBYNMINACW-NSHDSACASA-N 1 2 239.290 2.335 20 0 BEADLO COc1c(O)cccc1C[N@H+]1CCC[C@H](F)C1 ZINC000573258284 388435588 /nfs/dbraw/zinc/43/55/88/388435588.db2.gz WYNULBYNMINACW-NSHDSACASA-N 1 2 239.290 2.335 20 0 BEADLO C[C@H](c1nc(C2CC2)no1)[NH+]1[C@H](C)C[C@H]1C ZINC000548425959 388537236 /nfs/dbraw/zinc/53/72/36/388537236.db2.gz XFBWHSWZLSZYCU-IWSPIJDZSA-N 1 2 221.304 2.491 20 0 BEADLO CC[C@H](C)CN(C)C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000517172216 388540536 /nfs/dbraw/zinc/54/05/36/388540536.db2.gz UZFMMTOHNZADPT-WDEREUQCSA-N 1 2 237.347 2.093 20 0 BEADLO CC[C@H](C)CN(C)C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000517172216 388540539 /nfs/dbraw/zinc/54/05/39/388540539.db2.gz UZFMMTOHNZADPT-WDEREUQCSA-N 1 2 237.347 2.093 20 0 BEADLO C/C(Cl)=C/C[NH2+][C@H](C)c1csnn1 ZINC000528529344 388543684 /nfs/dbraw/zinc/54/36/84/388543684.db2.gz ZYGGHKSKEVSLOP-FXHNIGACSA-N 1 2 217.725 2.331 20 0 BEADLO CN(C)c1[nH+]cccc1N(C)C(=O)C1CCCC1 ZINC000079724340 388545348 /nfs/dbraw/zinc/54/53/48/388545348.db2.gz QYHILQMZOLWEIU-UHFFFAOYSA-N 1 2 247.342 2.301 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccco2)s1 ZINC000134999996 388482822 /nfs/dbraw/zinc/48/28/22/388482822.db2.gz NONRDNIYVOLESX-SSDOTTSWSA-N 1 2 223.301 2.290 20 0 BEADLO CCCc1nc(C[N@H+](C)CCC2CC2)no1 ZINC000135300648 388490565 /nfs/dbraw/zinc/49/05/65/388490565.db2.gz AGJPLLQLPADISS-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO CCCc1nc(C[N@@H+](C)CCC2CC2)no1 ZINC000135300648 388490566 /nfs/dbraw/zinc/49/05/66/388490566.db2.gz AGJPLLQLPADISS-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO C/C(Cl)=C\C[N@@H+](C(C)C)C1COC1 ZINC000528514552 388505758 /nfs/dbraw/zinc/50/57/58/388505758.db2.gz UOLMBWHDNJTYHO-RUDMXATFSA-N 1 2 203.713 2.238 20 0 BEADLO C/C(Cl)=C\C[N@H+](C(C)C)C1COC1 ZINC000528514552 388505760 /nfs/dbraw/zinc/50/57/60/388505760.db2.gz UOLMBWHDNJTYHO-RUDMXATFSA-N 1 2 203.713 2.238 20 0 BEADLO Cc1cc(NC[C@@H]2CC[C@@H](C)O2)nc(C(C)C)[nH+]1 ZINC000397856604 388506362 /nfs/dbraw/zinc/50/63/62/388506362.db2.gz BJAVGNLKGZEWNV-NEPJUHHUSA-N 1 2 249.358 2.310 20 0 BEADLO CC[N@H+](CCC(F)(F)F)Cc1cnns1 ZINC000649279185 388507370 /nfs/dbraw/zinc/50/73/70/388507370.db2.gz JKTPXSLNQVVILO-UHFFFAOYSA-N 1 2 239.266 2.312 20 0 BEADLO CC[N@@H+](CCC(F)(F)F)Cc1cnns1 ZINC000649279185 388507373 /nfs/dbraw/zinc/50/73/73/388507373.db2.gz JKTPXSLNQVVILO-UHFFFAOYSA-N 1 2 239.266 2.312 20 0 BEADLO CC(C)[C@H]([NH2+]Cc1ncccn1)c1cccnc1 ZINC000516878831 256805071 /nfs/dbraw/zinc/80/50/71/256805071.db2.gz XUALBVYYWUBHJZ-AWEZNQCLSA-N 1 2 242.326 2.359 20 0 BEADLO CC(C)[C@H]1C[C@@H]1C(=O)NCCCCn1cc[nH+]c1 ZINC000548121310 388515070 /nfs/dbraw/zinc/51/50/70/388515070.db2.gz GVNAAXDAYBJTKT-OLZOCXBDSA-N 1 2 249.358 2.072 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2C[C@@H]2C(C)C)c(C)c[nH+]1 ZINC000548192488 388520949 /nfs/dbraw/zinc/52/09/49/388520949.db2.gz ZPMKVVOTLNHBID-VXGBXAGGSA-N 1 2 232.327 2.351 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1CCOCC12CCC2 ZINC000528420396 388522080 /nfs/dbraw/zinc/52/20/80/388522080.db2.gz JPOBDKGTGNRTSZ-XCVCLJGOSA-N 1 2 215.724 2.384 20 0 BEADLO C/C(Cl)=C\C[N@H+]1CCOCC12CCC2 ZINC000528420396 388522083 /nfs/dbraw/zinc/52/20/83/388522083.db2.gz JPOBDKGTGNRTSZ-XCVCLJGOSA-N 1 2 215.724 2.384 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1CCO[C@@H](COC(C)C)C1 ZINC000528461058 388530260 /nfs/dbraw/zinc/53/02/60/388530260.db2.gz ZSAXHQNSOYABEE-KBVBDRTLSA-N 1 2 247.766 2.255 20 0 BEADLO C/C(Cl)=C\C[N@H+]1CCO[C@@H](COC(C)C)C1 ZINC000528461058 388530263 /nfs/dbraw/zinc/53/02/63/388530263.db2.gz ZSAXHQNSOYABEE-KBVBDRTLSA-N 1 2 247.766 2.255 20 0 BEADLO CC(C)n1cc(C[N@@H+]2C[C@H](C)OC[C@@H]2C)cn1 ZINC000245542956 388588338 /nfs/dbraw/zinc/58/83/38/388588338.db2.gz QKEUDTCHGQEEFI-RYUDHWBXSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)n1cc(C[N@H+]2C[C@H](C)OC[C@@H]2C)cn1 ZINC000245542956 388588339 /nfs/dbraw/zinc/58/83/39/388588339.db2.gz QKEUDTCHGQEEFI-RYUDHWBXSA-N 1 2 237.347 2.073 20 0 BEADLO Cc1ccnc(CNc2cc(C)[nH+]cn2)c1 ZINC000328309171 388598243 /nfs/dbraw/zinc/59/82/43/388598243.db2.gz WMDVEMKWGXXLRD-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO c1n[nH]cc1CCNc1ccc2ccccc2[nH+]1 ZINC000357628867 388551802 /nfs/dbraw/zinc/55/18/02/388551802.db2.gz NMRIGDXHKIHDLE-UHFFFAOYSA-N 1 2 238.294 2.034 20 0 BEADLO CC(C)(C(=O)NCCC1=CCCC1)c1c[nH]c[nH+]1 ZINC000548744871 388555962 /nfs/dbraw/zinc/55/59/62/388555962.db2.gz KVIOASZUYJTXEA-UHFFFAOYSA-N 1 2 247.342 2.304 20 0 BEADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1ccon1 ZINC000528766142 388569578 /nfs/dbraw/zinc/56/95/78/388569578.db2.gz JUOKEUCUMUYCDY-QMMMGPOBSA-N 1 2 216.231 2.294 20 0 BEADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1ccon1 ZINC000528766142 388569581 /nfs/dbraw/zinc/56/95/81/388569581.db2.gz JUOKEUCUMUYCDY-QMMMGPOBSA-N 1 2 216.231 2.294 20 0 BEADLO CCc1cnc(C[N@@H+]2CC[C@H](OC(F)F)C2)o1 ZINC000549080143 388572116 /nfs/dbraw/zinc/57/21/16/388572116.db2.gz OTOJQTLBISYIGU-VIFPVBQESA-N 1 2 246.257 2.051 20 0 BEADLO CCc1cnc(C[N@H+]2CC[C@H](OC(F)F)C2)o1 ZINC000549080143 388572117 /nfs/dbraw/zinc/57/21/17/388572117.db2.gz OTOJQTLBISYIGU-VIFPVBQESA-N 1 2 246.257 2.051 20 0 BEADLO COc1ccc([C@H]([NH2+]CC(F)F)C2CC2)cn1 ZINC000528846636 388578329 /nfs/dbraw/zinc/57/83/29/388578329.db2.gz JAKMSAQURQNKJG-GFCCVEGCSA-N 1 2 242.269 2.396 20 0 BEADLO COc1ccc([C@@H]([NH2+]CC(F)F)C2CC2)cn1 ZINC000528846637 388578417 /nfs/dbraw/zinc/57/84/17/388578417.db2.gz JAKMSAQURQNKJG-LBPRGKRZSA-N 1 2 242.269 2.396 20 0 BEADLO Cc1ccc(C[NH2+][C@H](CCO)c2ccco2)o1 ZINC000184520094 388579861 /nfs/dbraw/zinc/57/98/61/388579861.db2.gz SFERGESAUKLENA-GFCCVEGCSA-N 1 2 235.283 2.394 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+]Cc2cncn2C)s1 ZINC000125184386 388669252 /nfs/dbraw/zinc/66/92/52/388669252.db2.gz YQFBTUYTSBMXGZ-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO C[C@@H]1COC2(CCC2)C[N@@H+]1Cc1ccns1 ZINC000630076767 388627247 /nfs/dbraw/zinc/62/72/47/388627247.db2.gz NVACVFYZYYXHFF-SNVBAGLBSA-N 1 2 238.356 2.287 20 0 BEADLO C[C@@H]1COC2(CCC2)C[N@H+]1Cc1ccns1 ZINC000630076767 388627248 /nfs/dbraw/zinc/62/72/48/388627248.db2.gz NVACVFYZYYXHFF-SNVBAGLBSA-N 1 2 238.356 2.287 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CCCC12CCC2 ZINC000521896044 388639422 /nfs/dbraw/zinc/63/94/22/388639422.db2.gz KMLDQRMTKKFTSD-LLVKDONJSA-N 1 2 247.342 2.133 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CCCC12CCC2 ZINC000521896044 388639425 /nfs/dbraw/zinc/63/94/25/388639425.db2.gz KMLDQRMTKKFTSD-LLVKDONJSA-N 1 2 247.342 2.133 20 0 BEADLO Cc1ccn(C)c1C(=O)Nc1cc[nH+]c(C)c1 ZINC000189789463 388642809 /nfs/dbraw/zinc/64/28/09/388642809.db2.gz RBCCTROOCADRPY-UHFFFAOYSA-N 1 2 229.283 2.289 20 0 BEADLO O=C(CCCn1cc[nH+]c1)Nc1ccc(F)cc1 ZINC000620409252 388646835 /nfs/dbraw/zinc/64/68/35/388646835.db2.gz KAWMUQREGWDPEG-UHFFFAOYSA-N 1 2 247.273 2.441 20 0 BEADLO COC(=O)[C@](C)([NH2+]Cc1ccccc1)C1CC1 ZINC000037952511 388651294 /nfs/dbraw/zinc/65/12/94/388651294.db2.gz LMOSARGOMSLZJO-CQSZACIVSA-N 1 2 233.311 2.118 20 0 BEADLO C[NH2+]Cc1noc([C@H]2CCc3ccccc3C2)n1 ZINC000223634131 388655942 /nfs/dbraw/zinc/65/59/42/388655942.db2.gz NFWOOFQXBIUYAJ-LBPRGKRZSA-N 1 2 243.310 2.062 20 0 BEADLO CN(C)c1ccc(NCc2ccco2)[nH+]c1 ZINC000124577362 388663537 /nfs/dbraw/zinc/66/35/37/388663537.db2.gz VOVPVLDMYZCVQY-UHFFFAOYSA-N 1 2 217.272 2.353 20 0 BEADLO Cc1ccc(NCc2cccc(C(N)=O)c2)c[nH+]1 ZINC000128005383 388735824 /nfs/dbraw/zinc/73/58/24/388735824.db2.gz ZAFRRAVORJIPPF-UHFFFAOYSA-N 1 2 241.294 2.101 20 0 BEADLO CC1(C)C[NH+](CC(=O)Nc2cccc(F)c2)C1 ZINC000552916357 388740549 /nfs/dbraw/zinc/74/05/49/388740549.db2.gz LDNVDGZAPMFYGK-UHFFFAOYSA-N 1 2 236.290 2.106 20 0 BEADLO COC(=O)[C@@H]([NH2+]Cc1sccc1C)C1CC1 ZINC000227769398 388757633 /nfs/dbraw/zinc/75/76/33/388757633.db2.gz ZKSGVDPBBWTYLT-NSHDSACASA-N 1 2 239.340 2.098 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@H](c1cccnc1)C1CC1 ZINC000538420287 388689699 /nfs/dbraw/zinc/68/96/99/388689699.db2.gz LENZZHLKXVZHTP-AWEZNQCLSA-N 1 2 242.326 2.354 20 0 BEADLO CC(=O)Nc1ccc2[nH+]c(N(C)C)ccc2c1 ZINC000195057424 388695142 /nfs/dbraw/zinc/69/51/42/388695142.db2.gz XEZXPTGKLYRMMG-UHFFFAOYSA-N 1 2 229.283 2.259 20 0 BEADLO CC[C@@]1(C)C[N@@H+]([C@H](C)c2cnccn2)CCO1 ZINC000248983975 388702161 /nfs/dbraw/zinc/70/21/61/388702161.db2.gz VYLOUJBCLOCHJX-YPMHNXCESA-N 1 2 235.331 2.039 20 0 BEADLO CC[C@@]1(C)C[N@H+]([C@H](C)c2cnccn2)CCO1 ZINC000248983975 388702162 /nfs/dbraw/zinc/70/21/62/388702162.db2.gz VYLOUJBCLOCHJX-YPMHNXCESA-N 1 2 235.331 2.039 20 0 BEADLO Cc1cccc(C(=O)N[C@H](C)c2[nH+]ccn2C)c1 ZINC000082285377 388725433 /nfs/dbraw/zinc/72/54/33/388725433.db2.gz UVVGWKDFCLLFDG-LLVKDONJSA-N 1 2 243.310 2.220 20 0 BEADLO Cc1nc(C[N@H+]2C[C@@H](C)OC[C@@H]2C)sc1C ZINC000088576335 388732409 /nfs/dbraw/zinc/73/24/09/388732409.db2.gz OHYUFNGGJCFGOY-DTWKUNHWSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)sc1C ZINC000088576335 388732411 /nfs/dbraw/zinc/73/24/11/388732411.db2.gz OHYUFNGGJCFGOY-DTWKUNHWSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCC[C@H](CCO)CC1 ZINC000572541724 388800780 /nfs/dbraw/zinc/80/07/80/388800780.db2.gz HVQJRUBNIOMMFQ-ZDUSSCGKSA-N 1 2 249.358 2.082 20 0 BEADLO CCOC(=O)C[N@H+](CC)Cc1ccc(C)s1 ZINC000092399493 388802654 /nfs/dbraw/zinc/80/26/54/388802654.db2.gz ZBXUOCNKBAXDCY-UHFFFAOYSA-N 1 2 241.356 2.442 20 0 BEADLO CCOC(=O)C[N@@H+](CC)Cc1ccc(C)s1 ZINC000092399493 388802656 /nfs/dbraw/zinc/80/26/56/388802656.db2.gz ZBXUOCNKBAXDCY-UHFFFAOYSA-N 1 2 241.356 2.442 20 0 BEADLO Cc1nc(C[NH2+][C@H](C)c2cn[nH]c2)cs1 ZINC000229882075 388802889 /nfs/dbraw/zinc/80/28/89/388802889.db2.gz CXWHSJSJJWZMRU-SSDOTTSWSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1ccnc(N[C@@H](c2[nH+]ccn2C)C2CC2)n1 ZINC000553262372 388758410 /nfs/dbraw/zinc/75/84/10/388758410.db2.gz SEAYQVVMZKVXTM-LLVKDONJSA-N 1 2 243.314 2.082 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)[C@H]1CCc2c[nH+]cn2C1 ZINC000553313336 388762374 /nfs/dbraw/zinc/76/23/74/388762374.db2.gz HTMOEDYWYBXVRE-NEPJUHHUSA-N 1 2 249.358 2.093 20 0 BEADLO CSC1(CNc2nc[nH+]c(N)c2Cl)CC1 ZINC000227993453 388764161 /nfs/dbraw/zinc/76/41/61/388764161.db2.gz LAGRNUQJIRJTHD-UHFFFAOYSA-N 1 2 244.751 2.020 20 0 BEADLO CSC1(CNc2[nH+]cnc(N)c2Cl)CC1 ZINC000227993453 388764163 /nfs/dbraw/zinc/76/41/63/388764163.db2.gz LAGRNUQJIRJTHD-UHFFFAOYSA-N 1 2 244.751 2.020 20 0 BEADLO c1[nH+]c(SCc2csnn2)n2ccccc12 ZINC000554520416 388819065 /nfs/dbraw/zinc/81/90/65/388819065.db2.gz GMJMNJZAKDDCAC-UHFFFAOYSA-N 1 2 248.336 2.478 20 0 BEADLO Oc1ccc2c(c1)OCC[N@@H+](CC1(F)CC1)C2 ZINC000554878475 388834962 /nfs/dbraw/zinc/83/49/62/388834962.db2.gz SZJBEBQXINLWHG-UHFFFAOYSA-N 1 2 237.274 2.089 20 0 BEADLO Oc1ccc2c(c1)OCC[N@H+](CC1(F)CC1)C2 ZINC000554878475 388834964 /nfs/dbraw/zinc/83/49/64/388834964.db2.gz SZJBEBQXINLWHG-UHFFFAOYSA-N 1 2 237.274 2.089 20 0 BEADLO C[S@](=O)CCNc1[nH+]ccc2ccccc21 ZINC000229239690 388840486 /nfs/dbraw/zinc/84/04/86/388840486.db2.gz VPZDBTTWWLATAG-INIZCTEOSA-N 1 2 234.324 2.025 20 0 BEADLO CCCC[C@H]1CCC[C@@H]1NC(=O)Cn1cc[nH+]c1 ZINC000555221638 388841915 /nfs/dbraw/zinc/84/19/15/388841915.db2.gz KCXBYZMGEVGUON-STQMWFEESA-N 1 2 249.358 2.358 20 0 BEADLO CC[C@H](C)[C@@H](C)N(C(=O)Cn1cc[nH+]c1)C1CC1 ZINC000564639846 388881923 /nfs/dbraw/zinc/88/19/23/388881923.db2.gz ICWBHMWFCGLZMK-NWDGAFQWSA-N 1 2 249.358 2.309 20 0 BEADLO C[C@H]([NH2+]Cc1nnc2ccccn21)c1ccoc1 ZINC000094867712 388874731 /nfs/dbraw/zinc/87/47/31/388874731.db2.gz QGCKDRFYGZYORV-JTQLQIEISA-N 1 2 242.282 2.173 20 0 BEADLO C[C@@H]1CC=C(C(=O)N2CC(n3cc[nH+]c3)C2)CC1 ZINC000564535494 388877104 /nfs/dbraw/zinc/87/71/04/388877104.db2.gz SJUNFYHLWXXEOL-LLVKDONJSA-N 1 2 245.326 2.013 20 0 BEADLO CC[C@H](c1ccccc1)[N@@H+]1CCn2nncc2C1 ZINC000565169033 388920193 /nfs/dbraw/zinc/92/01/93/388920193.db2.gz BNCHJRWGFBXHBJ-CQSZACIVSA-N 1 2 242.326 2.245 20 0 BEADLO CC[C@H](c1ccccc1)[N@H+]1CCn2nncc2C1 ZINC000565169033 388920196 /nfs/dbraw/zinc/92/01/96/388920196.db2.gz BNCHJRWGFBXHBJ-CQSZACIVSA-N 1 2 242.326 2.245 20 0 BEADLO CC[C@H](F)C[N@@H+]1CCC(=O)CC12CCC2 ZINC000565173361 388922174 /nfs/dbraw/zinc/92/21/74/388922174.db2.gz TYWPFPCRWZREQX-JTQLQIEISA-N 1 2 213.296 2.322 20 0 BEADLO CC[C@H](F)C[N@H+]1CCC(=O)CC12CCC2 ZINC000565173361 388922177 /nfs/dbraw/zinc/92/21/77/388922177.db2.gz TYWPFPCRWZREQX-JTQLQIEISA-N 1 2 213.296 2.322 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000565191919 388924036 /nfs/dbraw/zinc/92/40/36/388924036.db2.gz LNALSHXVVRKKPE-NQBHXWOUSA-N 1 2 249.358 2.378 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000565191919 388924040 /nfs/dbraw/zinc/92/40/40/388924040.db2.gz LNALSHXVVRKKPE-NQBHXWOUSA-N 1 2 249.358 2.378 20 0 BEADLO c1ccc(N2CCC[C@]3(CCOC3)C2)[nH+]c1 ZINC000336272908 132246001 /nfs/dbraw/zinc/24/60/01/132246001.db2.gz JPRLUGFXCWYWGX-ZDUSSCGKSA-N 1 2 218.300 2.089 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C1C(C)(C)C1(C)C ZINC000267223448 388999996 /nfs/dbraw/zinc/99/99/96/388999996.db2.gz OKVIFBZMYUCECY-UHFFFAOYSA-N 1 2 235.331 2.017 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1cccn1C(C)C ZINC000270922489 389016361 /nfs/dbraw/zinc/01/63/61/389016361.db2.gz SBELJRFAEXHXQJ-UHFFFAOYSA-N 1 2 246.314 2.031 20 0 BEADLO Cc1nnc(C[NH2+][C@@H](C)c2cccc(O)c2)s1 ZINC000271766143 389023647 /nfs/dbraw/zinc/02/36/47/389023647.db2.gz FALAHUZXMAWKMT-QMMMGPOBSA-N 1 2 249.339 2.403 20 0 BEADLO Cc1cnc([C@H](C)[NH2+]Cc2ccno2)s1 ZINC000273244082 389039461 /nfs/dbraw/zinc/03/94/61/389039461.db2.gz BACMQVCEXWOYJV-QMMMGPOBSA-N 1 2 223.301 2.290 20 0 BEADLO C[C@@H](c1csnn1)[NH+]1CCC(C)CC1 ZINC000336190751 168185286 /nfs/dbraw/zinc/18/52/86/168185286.db2.gz ZVTMPMSEQHAQNK-VIFPVBQESA-N 1 2 211.334 2.331 20 0 BEADLO CC(C)(C)C(=O)N1CCC(Cn2cc[nH+]c2)CC1 ZINC000062129590 322818848 /nfs/dbraw/zinc/81/88/48/322818848.db2.gz NCKPHIHGLDFFHR-UHFFFAOYSA-N 1 2 249.358 2.168 20 0 BEADLO C[C@@H](C1CC1)n1cc(NCc2[nH+]ccn2C)cn1 ZINC000494477538 533376670 /nfs/dbraw/zinc/37/66/70/533376670.db2.gz QXWKOEXIGYCCBL-JTQLQIEISA-N 1 2 245.330 2.200 20 0 BEADLO COc1cccc(NC(=O)C=Cc2c[nH]c[nH+]2)c1 ZINC000493772428 533592067 /nfs/dbraw/zinc/59/20/67/533592067.db2.gz RBUPINIHCUMAIR-WAYWQWQTSA-N 1 2 243.266 2.070 20 0 BEADLO C[C@@H]1CCCC[C@H]1CNC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493694831 533594337 /nfs/dbraw/zinc/59/43/37/533594337.db2.gz OYSAZWDENCONGW-JIVBQCDMSA-N 1 2 247.342 2.365 20 0 BEADLO Cc1cc(N2C[C@@H](C)O[C@H](C)C2)nc(C2CC2)[nH+]1 ZINC000264611273 132178783 /nfs/dbraw/zinc/17/87/83/132178783.db2.gz FMRWFBRASUQZQO-GHMZBOCLSA-N 1 2 247.342 2.276 20 0 BEADLO Cc1noc([C@H]2CCCN(c3cccc[nH+]3)C2)n1 ZINC000264930530 132181356 /nfs/dbraw/zinc/18/13/56/132181356.db2.gz PDRFVKCSGNNJGL-NSHDSACASA-N 1 2 244.298 2.157 20 0 BEADLO c1cc2[nH+]ccc(N3CCSCC3)c2cn1 ZINC000267175419 132189065 /nfs/dbraw/zinc/18/90/65/132189065.db2.gz DDFQAAWYABRMIY-UHFFFAOYSA-N 1 2 231.324 2.183 20 0 BEADLO Cc1cc(N2CCC[C@](C)(O)C2)nc(C2CC2)[nH+]1 ZINC000271010620 132198557 /nfs/dbraw/zinc/19/85/57/132198557.db2.gz XVSBCDWGHQWGBE-AWEZNQCLSA-N 1 2 247.342 2.014 20 0 BEADLO Cc1cc(NC(N)=O)c[nH+]c1N1CCCC[C@@H]1C ZINC000272674187 132200787 /nfs/dbraw/zinc/20/07/87/132200787.db2.gz LPWFXAQUTNUCHB-JTQLQIEISA-N 1 2 248.330 2.259 20 0 BEADLO CO[C@H]1CN(c2cc[nH+]c(C3CC3)n2)CC[C@@H]1C ZINC000276013988 132205731 /nfs/dbraw/zinc/20/57/31/132205731.db2.gz MKMRQUQPGGXAFV-JQWIXIFHSA-N 1 2 247.342 2.215 20 0 BEADLO CO[C@@H]1CCN(c2cc[nH+]c(C3CC3)n2)[C@H](C)C1 ZINC000281673529 132211496 /nfs/dbraw/zinc/21/14/96/132211496.db2.gz PXDQTKAVVYTUEN-ZYHUDNBSSA-N 1 2 247.342 2.358 20 0 BEADLO CO[C@H]1CCN(c2cc[nH+]c(C3CC3)n2)[C@@H](C)C1 ZINC000281673525 132211672 /nfs/dbraw/zinc/21/16/72/132211672.db2.gz PXDQTKAVVYTUEN-JQWIXIFHSA-N 1 2 247.342 2.358 20 0 BEADLO CO[C@H]1CCN(c2cc[nH+]c(C3CC3)n2)[C@H](C)C1 ZINC000281673527 132211716 /nfs/dbraw/zinc/21/17/16/132211716.db2.gz PXDQTKAVVYTUEN-PWSUYJOCSA-N 1 2 247.342 2.358 20 0 BEADLO CCC[C@H]1CN(c2cc(C)[nH+]c(CC)n2)CCO1 ZINC000286478478 132214905 /nfs/dbraw/zinc/21/49/05/132214905.db2.gz LJGHSQFFDIQHLB-LBPRGKRZSA-N 1 2 249.358 2.353 20 0 BEADLO Cc1nc(N2CCC[C@H](C3CC3)C2)cc[nH+]1 ZINC000288188280 132216298 /nfs/dbraw/zinc/21/62/98/132216298.db2.gz JPZSSKREARKTRN-LBPRGKRZSA-N 1 2 217.316 2.411 20 0 BEADLO CCOC1(C)CCN(c2cccc[nH+]2)CC1 ZINC000291808446 132218226 /nfs/dbraw/zinc/21/82/26/132218226.db2.gz JZSDILMXMPHWQZ-UHFFFAOYSA-N 1 2 220.316 2.477 20 0 BEADLO CCOC1(C)CCN(c2cc[nH+]c(C)n2)CC1 ZINC000291944925 132218600 /nfs/dbraw/zinc/21/86/00/132218600.db2.gz TZCVPQSGWGORDY-UHFFFAOYSA-N 1 2 235.331 2.180 20 0 BEADLO CSC[C@@H]1CCCN(c2cc[nH+]c(C)n2)C1 ZINC000292187242 132218770 /nfs/dbraw/zinc/21/87/70/132218770.db2.gz FWXHQYHUDGLGCY-LLVKDONJSA-N 1 2 237.372 2.364 20 0 BEADLO Cc1nc(N2CCC[C@@](CO)(C(C)C)C2)cc[nH+]1 ZINC000294332031 132219369 /nfs/dbraw/zinc/21/93/69/132219369.db2.gz ZXBYYALTOVLPOS-CQSZACIVSA-N 1 2 249.358 2.020 20 0 BEADLO CO[C@@H]1CCN(c2cc[nH+]c(C)n2)CC1(C)C ZINC000295640302 132220866 /nfs/dbraw/zinc/22/08/66/132220866.db2.gz CCRNIEMTJHTEDH-LLVKDONJSA-N 1 2 235.331 2.036 20 0 BEADLO Cc1cc(N2CCS[C@H](C)[C@H]2C)nc[nH+]1 ZINC000301307301 132223427 /nfs/dbraw/zinc/22/34/27/132223427.db2.gz ZSCGFKSOMRLGLT-NXEZZACHSA-N 1 2 223.345 2.115 20 0 BEADLO CC1=C[C@H](C)CN(c2cc[nH+]c(C)n2)C1 ZINC000336526224 132248226 /nfs/dbraw/zinc/24/82/26/132248226.db2.gz YHCCMSDZCSSSII-VIFPVBQESA-N 1 2 203.289 2.187 20 0 BEADLO Cc1cc(N2C[C@@H](C)CC[C@@H]2C)nc[nH+]1 ZINC000301425135 132253676 /nfs/dbraw/zinc/25/36/76/132253676.db2.gz GNVIWIVTZKSGPL-ONGXEEELSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1cc(N2CCC[C@H](C)[C@@H]2C)nc[nH+]1 ZINC000301437856 132253749 /nfs/dbraw/zinc/25/37/49/132253749.db2.gz SMUUHYRALKGFPN-ONGXEEELSA-N 1 2 205.305 2.410 20 0 BEADLO CO[C@H]1CN(c2cc[nH+]c(C(C)C)n2)CC[C@H]1C ZINC000302587595 132264703 /nfs/dbraw/zinc/26/47/03/132264703.db2.gz VRGNBQNWRUPBBC-NEPJUHHUSA-N 1 2 249.358 2.461 20 0 BEADLO COCC1(C)CCN(c2cc[nH+]c(C)n2)CC1 ZINC000358470860 132275535 /nfs/dbraw/zinc/27/55/35/132275535.db2.gz PWEWIRVLHIXDLM-UHFFFAOYSA-N 1 2 235.331 2.038 20 0 BEADLO CO[C@]1(C)CCCN(c2nc(C)[nH+]c(C)c2C)C1 ZINC000359747308 132277715 /nfs/dbraw/zinc/27/77/15/132277715.db2.gz ORHPICQNCHQGEU-CQSZACIVSA-N 1 2 249.358 2.407 20 0 BEADLO OCc1ccc(-c2cccc3[nH+]ccn32)cc1 ZINC000061905881 1172714885 /nfs/dbraw/zinc/71/48/85/1172714885.db2.gz FWAXAKPZBYKJEV-UHFFFAOYSA-N 1 2 224.263 2.494 20 0 BEADLO C[C@H](CC(=O)NCc1[nH+]ccn1C)C(C)(C)C ZINC000342857351 133603252 /nfs/dbraw/zinc/60/32/52/133603252.db2.gz YALJGLTUHLFIBB-SNVBAGLBSA-N 1 2 237.347 2.109 20 0 BEADLO Cc1ccc(CN2CCn3cc[nH+]c3C2)s1 ZINC000334253355 133606140 /nfs/dbraw/zinc/60/61/40/133606140.db2.gz LYVCXXGXZNRWRL-UHFFFAOYSA-N 1 2 233.340 2.269 20 0 BEADLO Cc1cc(N[C@@H]2CC[C@@H](F)C2)nc(C2CC2)[nH+]1 ZINC000334739058 133745166 /nfs/dbraw/zinc/74/51/66/133745166.db2.gz LATNACPYPVIYJK-GHMZBOCLSA-N 1 2 235.306 2.387 20 0 BEADLO c1cn(CCc2nc(-c3ccsc3)no2)c[nH+]1 ZINC000349864752 133922905 /nfs/dbraw/zinc/92/29/05/133922905.db2.gz ZIBDTKNPOFBSSH-UHFFFAOYSA-N 1 2 246.295 2.237 20 0 BEADLO CC(C)[C@H](C)Sc1[nH+]cnc2c1cnn2C ZINC000335922968 134008061 /nfs/dbraw/zinc/00/80/61/134008061.db2.gz JUFMIBXHQKZRNV-QMMMGPOBSA-N 1 2 236.344 2.500 20 0 BEADLO OC1CCN(c2[nH+]ccc3ccc(F)cc32)CC1 ZINC000335932549 134011451 /nfs/dbraw/zinc/01/14/51/134011451.db2.gz XCRWMTRRGDQCCM-UHFFFAOYSA-N 1 2 246.285 2.335 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H]1CC[C@H](C)C1 ZINC000335954353 134022406 /nfs/dbraw/zinc/02/24/06/134022406.db2.gz XWBQBZLODQQEJS-ONGXEEELSA-N 1 2 218.300 2.187 20 0 BEADLO COC[C@H]1CC[N@H+](Cc2ncc(Cl)s2)C1 ZINC000351988953 134026300 /nfs/dbraw/zinc/02/63/00/134026300.db2.gz NXYJWVNHXSOHLY-QMMMGPOBSA-N 1 2 246.763 2.265 20 0 BEADLO COC[C@H]1CC[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000351988953 134026301 /nfs/dbraw/zinc/02/63/01/134026301.db2.gz NXYJWVNHXSOHLY-QMMMGPOBSA-N 1 2 246.763 2.265 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)nn1C ZINC000351992643 134031616 /nfs/dbraw/zinc/03/16/16/134031616.db2.gz FFEVTPSAVBGSIZ-VIFPVBQESA-N 1 2 243.301 2.206 20 0 BEADLO Cc1cc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)nn1C ZINC000351992643 134031617 /nfs/dbraw/zinc/03/16/17/134031617.db2.gz FFEVTPSAVBGSIZ-VIFPVBQESA-N 1 2 243.301 2.206 20 0 BEADLO CN(c1[nH+]ccc2ccc(F)cc21)C1CC(O)C1 ZINC000336004621 134048456 /nfs/dbraw/zinc/04/84/56/134048456.db2.gz HRWHHCMNDVCDPT-UHFFFAOYSA-N 1 2 246.285 2.333 20 0 BEADLO Cc1nnc(C[N@H+]2CC[C@H](C(F)(F)F)[C@H]2C)o1 ZINC000336006771 134049364 /nfs/dbraw/zinc/04/93/64/134049364.db2.gz ZUMWTXWNWOOPQV-SVRRBLITSA-N 1 2 249.236 2.151 20 0 BEADLO Cc1nnc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@H]2C)o1 ZINC000336006771 134049365 /nfs/dbraw/zinc/04/93/65/134049365.db2.gz ZUMWTXWNWOOPQV-SVRRBLITSA-N 1 2 249.236 2.151 20 0 BEADLO C[C@@H]1C[C@@H]1CC(=O)Nc1cccc2[nH+]ccn21 ZINC000336016994 134053281 /nfs/dbraw/zinc/05/32/81/134053281.db2.gz WGABCLYIAHMDQB-NXEZZACHSA-N 1 2 229.283 2.319 20 0 BEADLO Cc1ccnc(N2CCn3c[nH+]cc3C2)c1Cl ZINC000336022949 134056462 /nfs/dbraw/zinc/05/64/62/134056462.db2.gz SUZAWWPRSBCVKN-UHFFFAOYSA-N 1 2 248.717 2.260 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)Nc1ccc(C)cc1 ZINC000336044875 134063318 /nfs/dbraw/zinc/06/33/18/134063318.db2.gz ZDROXHMOWNRNNR-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1nnc(C2CCC2)n1C ZINC000336056034 134066414 /nfs/dbraw/zinc/06/64/14/134066414.db2.gz RBRXMZGTLCZMBA-NXEZZACHSA-N 1 2 234.347 2.065 20 0 BEADLO C[NH2+]Cc1noc([C@H]2CCCC(C)(C)C2)n1 ZINC000336059373 134067654 /nfs/dbraw/zinc/06/76/54/134067654.db2.gz DKVILDCXHJXICL-VIFPVBQESA-N 1 2 223.320 2.473 20 0 BEADLO Cc1cc(N2CC(C3CCCC3)C2)nc[nH+]1 ZINC000336078706 134073982 /nfs/dbraw/zinc/07/39/82/134073982.db2.gz XEYNDZTVECFYQT-UHFFFAOYSA-N 1 2 217.316 2.411 20 0 BEADLO Cc1nc(C[NH+]2CCC3(CCCC3)CC2)n[nH]1 ZINC000336110282 134086606 /nfs/dbraw/zinc/08/66/06/134086606.db2.gz DPCXSGAEBZGPMK-UHFFFAOYSA-N 1 2 234.347 2.269 20 0 BEADLO Cc1cc(NC(=O)N2CC3(C2)CCCC3)cc[nH+]1 ZINC000336119211 134089389 /nfs/dbraw/zinc/08/93/89/134089389.db2.gz MZYOPKKPEAHRCY-UHFFFAOYSA-N 1 2 245.326 2.220 20 0 BEADLO Cc1cc(NC(=O)N2CC[C@@H]3CCC[C@H]32)cc[nH+]1 ZINC000336119290 134089560 /nfs/dbraw/zinc/08/95/60/134089560.db2.gz VWFQZSCDBSHFSM-WCQYABFASA-N 1 2 245.326 2.218 20 0 BEADLO CC1(CC(=O)N2CCC(c3c[nH+]c[nH]3)CC2)CC1 ZINC000336122898 134091960 /nfs/dbraw/zinc/09/19/60/134091960.db2.gz MGYMBBJMEBVVOR-UHFFFAOYSA-N 1 2 247.342 2.306 20 0 BEADLO CC1(CC(=O)N2CCC(c3c[nH]c[nH+]3)CC2)CC1 ZINC000336122898 134091961 /nfs/dbraw/zinc/09/19/61/134091961.db2.gz MGYMBBJMEBVVOR-UHFFFAOYSA-N 1 2 247.342 2.306 20 0 BEADLO CC(C)(C)c1nnc(C[NH+]2CCCCC2)[nH]1 ZINC000336136894 134096534 /nfs/dbraw/zinc/09/65/34/134096534.db2.gz YUOPAOALOSBDFF-UHFFFAOYSA-N 1 2 222.336 2.088 20 0 BEADLO Cc1cc[nH]c1C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000336153530 134105130 /nfs/dbraw/zinc/10/51/30/134105130.db2.gz HUJOYAHAKYHQTI-SNVBAGLBSA-N 1 2 244.298 2.024 20 0 BEADLO c1cc(N2CC[C@H]2C2CC2)nc(C2CC2)[nH+]1 ZINC000336198610 134127187 /nfs/dbraw/zinc/12/71/87/134127187.db2.gz JPPRFCDQPXKSDK-NSHDSACASA-N 1 2 215.300 2.343 20 0 BEADLO CCN(C)C(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000336210174 134133956 /nfs/dbraw/zinc/13/39/56/134133956.db2.gz CFXLNJFIKKNZFS-JTQLQIEISA-N 1 2 236.319 2.008 20 0 BEADLO Fc1cnccc1CN1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000336212906 134134940 /nfs/dbraw/zinc/13/49/40/134134940.db2.gz VILYVHJSNUKUCT-LBPRGKRZSA-N 1 2 246.289 2.281 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@](C)(F)C2)cn1 ZINC000336215277 134136056 /nfs/dbraw/zinc/13/60/56/134136056.db2.gz GDAPTKGOZZCGCE-LBPRGKRZSA-N 1 2 223.295 2.109 20 0 BEADLO C[C@H]1C[N@H+](Cc2cc3cccnc3o2)CCO1 ZINC000336215932 134136734 /nfs/dbraw/zinc/13/67/34/134136734.db2.gz QXDRPHRSNQXFNR-JTQLQIEISA-N 1 2 232.283 2.049 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cc3cccnc3o2)CCO1 ZINC000336215932 134136735 /nfs/dbraw/zinc/13/67/35/134136735.db2.gz QXDRPHRSNQXFNR-JTQLQIEISA-N 1 2 232.283 2.049 20 0 BEADLO COc1cc(C)ccc1C[N@@H+]1CCOCC12CC2 ZINC000336216044 134136902 /nfs/dbraw/zinc/13/69/02/134136902.db2.gz XUEOOHKUSOQUDK-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO COc1cc(C)ccc1C[N@H+]1CCOCC12CC2 ZINC000336216044 134136903 /nfs/dbraw/zinc/13/69/03/134136903.db2.gz XUEOOHKUSOQUDK-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO CC(C)n1ccnc1C[N@@H+]1CCCO[C@H](C)C1 ZINC000170764484 134253445 /nfs/dbraw/zinc/25/34/45/134253445.db2.gz VAAPAFQYVMZVKE-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccnc1C[N@H+]1CCCO[C@H](C)C1 ZINC000170764484 134253446 /nfs/dbraw/zinc/25/34/46/134253446.db2.gz VAAPAFQYVMZVKE-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO c1c[nH]c(SCc2cn3ccccc3[nH+]2)n1 ZINC000172929331 134270595 /nfs/dbraw/zinc/27/05/95/134270595.db2.gz AABXMORMBVYRBX-UHFFFAOYSA-N 1 2 230.296 2.350 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H]1C[C@H]1C1CC1 ZINC000176975361 134295387 /nfs/dbraw/zinc/29/53/87/134295387.db2.gz ITPPVSAIOBSWRQ-VHSXEESVSA-N 1 2 232.283 2.075 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@H]1C[C@H]1C1CC1 ZINC000176975377 134295398 /nfs/dbraw/zinc/29/53/98/134295398.db2.gz ITPPVSAIOBSWRQ-UWVGGRQHSA-N 1 2 232.283 2.075 20 0 BEADLO COc1ccc2[nH+]c(N[C@@H](C)CO)ccc2c1 ZINC000179726006 134320158 /nfs/dbraw/zinc/32/01/58/134320158.db2.gz FYJKIRAPAMLHLC-VIFPVBQESA-N 1 2 232.283 2.036 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)CC1CCCCCC1 ZINC000179790645 134323957 /nfs/dbraw/zinc/32/39/57/134323957.db2.gz DJGJTVVIPNJEDJ-UHFFFAOYSA-N 1 2 222.336 2.207 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)CC1CCCCCC1 ZINC000179790645 134323958 /nfs/dbraw/zinc/32/39/58/134323958.db2.gz DJGJTVVIPNJEDJ-UHFFFAOYSA-N 1 2 222.336 2.207 20 0 BEADLO Cc1cc(NC(=O)NCc2ccoc2)cc[nH+]1 ZINC000179830352 134324395 /nfs/dbraw/zinc/32/43/95/134324395.db2.gz KXFRSLJOROMGMZ-UHFFFAOYSA-N 1 2 231.255 2.305 20 0 BEADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1cnc[nH]1 ZINC000179910005 134325249 /nfs/dbraw/zinc/32/52/49/134325249.db2.gz BBTTZPZVTYKZOI-NSHDSACASA-N 1 2 227.311 2.357 20 0 BEADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1cnc[nH]1 ZINC000179910005 134325250 /nfs/dbraw/zinc/32/52/50/134325250.db2.gz BBTTZPZVTYKZOI-NSHDSACASA-N 1 2 227.311 2.357 20 0 BEADLO COCc1nc(C[NH2+][C@H](C)c2ccccc2)no1 ZINC000182786899 134348228 /nfs/dbraw/zinc/34/82/28/134348228.db2.gz KZUITJPKMPYMTE-SNVBAGLBSA-N 1 2 247.298 2.067 20 0 BEADLO C[C@H]1CC(C(=O)NCCc2[nH]cc[nH+]2)C[C@H](C)C1 ZINC000183750285 134354036 /nfs/dbraw/zinc/35/40/36/134354036.db2.gz SFYIOIIVAWFAKV-GHMZBOCLSA-N 1 2 249.358 2.141 20 0 BEADLO CC[C@H](C)[C@H]([NH2+][C@H]1C=CCCC1)C(=O)OC ZINC000183669840 134355946 /nfs/dbraw/zinc/35/59/46/134355946.db2.gz YYLOMFSMLSZTJJ-SRVKXCTJSA-N 1 2 225.332 2.272 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1cc(O)cc(F)c1 ZINC000184148917 134359006 /nfs/dbraw/zinc/35/90/06/134359006.db2.gz AROHCHIGRNQARU-LBPRGKRZSA-N 1 2 239.290 2.142 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1cc(O)cc(F)c1 ZINC000184148917 134359007 /nfs/dbraw/zinc/35/90/07/134359007.db2.gz AROHCHIGRNQARU-LBPRGKRZSA-N 1 2 239.290 2.142 20 0 BEADLO CC1(C)C[N@H+](Cc2cc(O)cc(F)c2)CCO1 ZINC000184148875 134359281 /nfs/dbraw/zinc/35/92/81/134359281.db2.gz QAQMELDHUBRRTI-UHFFFAOYSA-N 1 2 239.290 2.142 20 0 BEADLO CC1(C)C[N@@H+](Cc2cc(O)cc(F)c2)CCO1 ZINC000184148875 134359282 /nfs/dbraw/zinc/35/92/82/134359282.db2.gz QAQMELDHUBRRTI-UHFFFAOYSA-N 1 2 239.290 2.142 20 0 BEADLO CO[C@H]1C[C@@H](Nc2cccc[nH+]2)C1(C)C ZINC000227822574 134389174 /nfs/dbraw/zinc/38/91/74/134389174.db2.gz YPIWFZKNIILKMY-ZJUUUORDSA-N 1 2 206.289 2.307 20 0 BEADLO COC(=O)[C@@H]([NH2+]CCc1cccc(C)c1)C1CC1 ZINC000227769679 134394313 /nfs/dbraw/zinc/39/43/13/134394313.db2.gz HUNAOUCUHWWIHB-AWEZNQCLSA-N 1 2 247.338 2.079 20 0 BEADLO CCn1cc[nH+]c1CNc1cccc(CO)c1 ZINC000051922412 134691878 /nfs/dbraw/zinc/69/18/78/134691878.db2.gz VPMYOAXQEANZQR-UHFFFAOYSA-N 1 2 231.299 2.007 20 0 BEADLO CC(C)c1nc(C[N@@H+]2CC[C@@H](C)[C@@H]2C)no1 ZINC000248370911 135000345 /nfs/dbraw/zinc/00/03/45/135000345.db2.gz YBZCKQUNLGUXEN-ZJUUUORDSA-N 1 2 223.320 2.423 20 0 BEADLO CC(C)c1nc(C[N@H+]2CC[C@@H](C)[C@@H]2C)no1 ZINC000248370911 135000346 /nfs/dbraw/zinc/00/03/46/135000346.db2.gz YBZCKQUNLGUXEN-ZJUUUORDSA-N 1 2 223.320 2.423 20 0 BEADLO CCCC[N@@H+]1CC(=O)N[C@@H]1[C@H]1CCCC[C@@H]1C ZINC000342256387 135258611 /nfs/dbraw/zinc/25/86/11/135258611.db2.gz ZSEOFMNTTOGRNP-OBJOEFQTSA-N 1 2 238.375 2.371 20 0 BEADLO CCCC[N@H+]1CC(=O)N[C@@H]1[C@H]1CCCC[C@@H]1C ZINC000342256387 135258612 /nfs/dbraw/zinc/25/86/12/135258612.db2.gz ZSEOFMNTTOGRNP-OBJOEFQTSA-N 1 2 238.375 2.371 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2CCCCC2(F)F)n1 ZINC000262231075 135286174 /nfs/dbraw/zinc/28/61/74/135286174.db2.gz NYQOVVYABOLJMV-ZETCQYMHSA-N 1 2 231.246 2.082 20 0 BEADLO Cc1c[nH+]ccc1CCNc1ccc(F)cn1 ZINC000342786362 135318981 /nfs/dbraw/zinc/31/89/81/135318981.db2.gz VGSMMPSWDLSRHY-UHFFFAOYSA-N 1 2 231.274 2.001 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)c1ccc(F)cc1 ZINC000334301342 135346680 /nfs/dbraw/zinc/34/66/80/135346680.db2.gz XHQVYUAHELHDGD-UHFFFAOYSA-N 1 2 247.273 2.063 20 0 BEADLO C[C@H]1CCC[C@H](NC(=O)C(C)(C)c2c[nH]c[nH+]2)C1 ZINC000334307306 135350128 /nfs/dbraw/zinc/35/01/28/135350128.db2.gz HQJPANRVURFXRF-QWRGUYRKSA-N 1 2 249.358 2.382 20 0 BEADLO Cc1csc([C@H](C)[NH2+]Cc2ccnc(C)n2)n1 ZINC000080274988 135368034 /nfs/dbraw/zinc/36/80/34/135368034.db2.gz QFZKFEIGTHBPJC-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO Cc1cc(F)cc2c1C[N@H+](Cc1cc[nH]n1)CC2 ZINC000334359186 135371370 /nfs/dbraw/zinc/37/13/70/135371370.db2.gz VMOHDDBMYRGRQP-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1cc(F)cc2c1C[N@@H+](Cc1cc[nH]n1)CC2 ZINC000334359186 135371371 /nfs/dbraw/zinc/37/13/71/135371371.db2.gz VMOHDDBMYRGRQP-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO CCc1cccnc1C(=O)Nc1cc[nH+]cc1C ZINC000334380355 135379962 /nfs/dbraw/zinc/37/99/62/135379962.db2.gz ILGLPUFEZNLOEI-UHFFFAOYSA-N 1 2 241.294 2.022 20 0 BEADLO F[C@@H]1CCC[C@@H]1[NH2+]Cc1cscn1 ZINC000307082968 135382729 /nfs/dbraw/zinc/38/27/29/135382729.db2.gz UZQWEUJOOFMPCP-BDAKNGLRSA-N 1 2 200.282 2.123 20 0 BEADLO C[N@H+](Cc1ccc(F)c(F)c1)Cc1cnccn1 ZINC000080965577 135384917 /nfs/dbraw/zinc/38/49/17/135384917.db2.gz HPKAGHVUXINNHC-UHFFFAOYSA-N 1 2 249.264 2.387 20 0 BEADLO C[N@@H+](Cc1ccc(F)c(F)c1)Cc1cnccn1 ZINC000080965577 135384919 /nfs/dbraw/zinc/38/49/19/135384919.db2.gz HPKAGHVUXINNHC-UHFFFAOYSA-N 1 2 249.264 2.387 20 0 BEADLO O[C@H]1CCC[C@@H](CNc2cccc[nH+]2)C1 ZINC000078305046 135392887 /nfs/dbraw/zinc/39/28/87/135392887.db2.gz WWHSLRQDUWSZGY-MNOVXSKESA-N 1 2 206.289 2.045 20 0 BEADLO CC1(C)C[N@H+](Cc2ccon2)[C@H]1[C@@H]1CCCO1 ZINC000334406763 135394366 /nfs/dbraw/zinc/39/43/66/135394366.db2.gz HYYHAVPIBRDMNG-RYUDHWBXSA-N 1 2 236.315 2.064 20 0 BEADLO CC1(C)C[N@@H+](Cc2ccon2)[C@H]1[C@@H]1CCCO1 ZINC000334406763 135394367 /nfs/dbraw/zinc/39/43/67/135394367.db2.gz HYYHAVPIBRDMNG-RYUDHWBXSA-N 1 2 236.315 2.064 20 0 BEADLO C[C@H](C(=O)N[C@H]1CCc2[nH+]c[nH]c2C1)C(C)(C)C ZINC000334417406 135398544 /nfs/dbraw/zinc/39/85/44/135398544.db2.gz OMIIPHLNSGDDMW-ZJUUUORDSA-N 1 2 249.358 2.065 20 0 BEADLO C[C@H](C(=O)N[C@H]1CCc2[nH]c[nH+]c2C1)C(C)(C)C ZINC000334417406 135398546 /nfs/dbraw/zinc/39/85/46/135398546.db2.gz OMIIPHLNSGDDMW-ZJUUUORDSA-N 1 2 249.358 2.065 20 0 BEADLO CO[C@H](C)CN(C)c1cc(C)[nH+]c(C(C)C)n1 ZINC000343807583 135699133 /nfs/dbraw/zinc/69/91/33/135699133.db2.gz LSIZENUMGQIOJI-LLVKDONJSA-N 1 2 237.347 2.380 20 0 BEADLO C[C@@H]([NH2+]c1ccc2c(c1)CCN2)[C@@H]1CCOC1 ZINC000335052724 135874486 /nfs/dbraw/zinc/87/44/86/135874486.db2.gz GYONJAHVPPEKAP-ZYHUDNBSSA-N 1 2 232.327 2.492 20 0 BEADLO C[C@@H](Nc1ccc2c(c1)CC[NH2+]2)[C@@H]1CCOC1 ZINC000335052724 135874487 /nfs/dbraw/zinc/87/44/87/135874487.db2.gz GYONJAHVPPEKAP-ZYHUDNBSSA-N 1 2 232.327 2.492 20 0 BEADLO Cc1cc(CNC(=O)NC2CC(C)C2)cc(C)[nH+]1 ZINC000335147231 135913251 /nfs/dbraw/zinc/91/32/51/135913251.db2.gz ORMLLZFWVMYBSL-UHFFFAOYSA-N 1 2 247.342 2.296 20 0 BEADLO COC(=O)C(C)(C)[NH2+]C[C@H]1C[C@@H]1c1ccccc1 ZINC000347630179 135992931 /nfs/dbraw/zinc/99/29/31/135992931.db2.gz IANOEQDQKVGQGJ-CHWSQXEVSA-N 1 2 247.338 2.331 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccn(C(F)F)n2)CCS1 ZINC000347710467 136002361 /nfs/dbraw/zinc/00/23/61/136002361.db2.gz VVXBIWNFKYLYGI-QMMMGPOBSA-N 1 2 247.314 2.216 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccn(C(F)F)n2)CCS1 ZINC000347710467 136002362 /nfs/dbraw/zinc/00/23/62/136002362.db2.gz VVXBIWNFKYLYGI-QMMMGPOBSA-N 1 2 247.314 2.216 20 0 BEADLO CC(C)n1ccc(C[N@@H+]2CCOCC3(CC3)C2)n1 ZINC000335315587 136024573 /nfs/dbraw/zinc/02/45/73/136024573.db2.gz KADFYRKVNJDCEL-UHFFFAOYSA-N 1 2 249.358 2.076 20 0 BEADLO CC(C)n1ccc(C[N@H+]2CCOCC3(CC3)C2)n1 ZINC000335315587 136024574 /nfs/dbraw/zinc/02/45/74/136024574.db2.gz KADFYRKVNJDCEL-UHFFFAOYSA-N 1 2 249.358 2.076 20 0 BEADLO CC(C)n1ccnc1C[N@@H+]1CCOCC2(CC2)C1 ZINC000335317622 136025388 /nfs/dbraw/zinc/02/53/88/136025388.db2.gz ZSJOHGKWQKGVNT-UHFFFAOYSA-N 1 2 249.358 2.076 20 0 BEADLO CC(C)n1ccnc1C[N@H+]1CCOCC2(CC2)C1 ZINC000335317622 136025389 /nfs/dbraw/zinc/02/53/89/136025389.db2.gz ZSJOHGKWQKGVNT-UHFFFAOYSA-N 1 2 249.358 2.076 20 0 BEADLO CCc1cnc(C[NH2+]Cc2ncccc2O)s1 ZINC000348044876 136029618 /nfs/dbraw/zinc/02/96/18/136029618.db2.gz QKXCONOGJSRLNN-UHFFFAOYSA-N 1 2 249.339 2.096 20 0 BEADLO Cc1nccc(C[N@@H+]2CCn3cccc3[C@H]2C)n1 ZINC000335327463 136052223 /nfs/dbraw/zinc/05/22/23/136052223.db2.gz KQMQVMGKLDIEMR-LLVKDONJSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1nccc(C[N@H+]2CCn3cccc3[C@H]2C)n1 ZINC000335327463 136052224 /nfs/dbraw/zinc/05/22/24/136052224.db2.gz KQMQVMGKLDIEMR-LLVKDONJSA-N 1 2 242.326 2.163 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C(C)(C)C(F)F ZINC000348291060 136062520 /nfs/dbraw/zinc/06/25/20/136062520.db2.gz XWUTUAHLNDGKFB-UHFFFAOYSA-N 1 2 242.269 2.296 20 0 BEADLO C[C@@H](O)CN(C)c1[nH+]ccc2cc(F)ccc21 ZINC000335348218 136067306 /nfs/dbraw/zinc/06/73/06/136067306.db2.gz HNACWGTYMORGJV-SECBINFHSA-N 1 2 234.274 2.191 20 0 BEADLO Cc1nc(N[C@H]2CCC[C@H](F)C2)cc[nH+]1 ZINC000335379757 136086893 /nfs/dbraw/zinc/08/68/93/136086893.db2.gz MOCITUCGSILPLB-UWVGGRQHSA-N 1 2 209.268 2.478 20 0 BEADLO Clc1cnccc1C[N@@H+]1C[C@@H]2C[C@H]1CS2 ZINC000335584667 136101154 /nfs/dbraw/zinc/10/11/54/136101154.db2.gz XOFQTMKLZXJMCT-UWVGGRQHSA-N 1 2 240.759 2.425 20 0 BEADLO Clc1cnccc1C[N@H+]1C[C@@H]2C[C@H]1CS2 ZINC000335584667 136101155 /nfs/dbraw/zinc/10/11/55/136101155.db2.gz XOFQTMKLZXJMCT-UWVGGRQHSA-N 1 2 240.759 2.425 20 0 BEADLO Fc1ccc(F)c(C[N@@H+]2CCCOCC2)c1 ZINC000335566917 136107806 /nfs/dbraw/zinc/10/78/06/136107806.db2.gz MTJJDCDLVIYZHX-UHFFFAOYSA-N 1 2 227.254 2.187 20 0 BEADLO Fc1ccc(F)c(C[N@H+]2CCCOCC2)c1 ZINC000335566917 136107807 /nfs/dbraw/zinc/10/78/07/136107807.db2.gz MTJJDCDLVIYZHX-UHFFFAOYSA-N 1 2 227.254 2.187 20 0 BEADLO CC(C)[C@@H](C)C(=O)NCc1[nH]c2c([nH+]1)CCCC2 ZINC001647345038 1172758846 /nfs/dbraw/zinc/75/88/46/1172758846.db2.gz XVQJTQGHJRUYCO-SNVBAGLBSA-N 1 2 249.358 2.197 20 0 BEADLO Cc1ccc(N[C@@H]2CCOC2(C)C)c[nH+]1 ZINC000294642740 397734539 /nfs/dbraw/zinc/73/45/39/397734539.db2.gz GJHMYQDDOYNVIS-LLVKDONJSA-N 1 2 206.289 2.369 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cccc(F)c2N)C[C@H](C)O1 ZINC000156332582 397758528 /nfs/dbraw/zinc/75/85/28/397758528.db2.gz KVIQOGWAUVVXNE-AOOOYVTPSA-N 1 2 238.306 2.017 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cccc(F)c2N)C[C@H](C)O1 ZINC000156332582 397758531 /nfs/dbraw/zinc/75/85/31/397758531.db2.gz KVIQOGWAUVVXNE-AOOOYVTPSA-N 1 2 238.306 2.017 20 0 BEADLO Cc1ccc(C)c(NC(=O)Cc2c[nH+]cn2C)c1 ZINC000188029813 397801196 /nfs/dbraw/zinc/80/11/96/397801196.db2.gz ORHPOXWKMKAOQV-UHFFFAOYSA-N 1 2 243.310 2.218 20 0 BEADLO C[C@@H]([NH2+]c1ccc(OCC(N)=O)cc1)C1CCC1 ZINC000182931628 397828475 /nfs/dbraw/zinc/82/84/75/397828475.db2.gz SOKRFKAAAQOUAX-SNVBAGLBSA-N 1 2 248.326 2.151 20 0 BEADLO CC(C)[C@H]1C[C@H]1C(=O)Nc1ccc[nH+]c1N(C)C ZINC000186090965 397876683 /nfs/dbraw/zinc/87/66/83/397876683.db2.gz PAICNFXLRWJIEO-GHMZBOCLSA-N 1 2 247.342 2.378 20 0 BEADLO C[C@@H]([NH2+]Cc1ncccn1)c1cccs1 ZINC000054459211 397965081 /nfs/dbraw/zinc/96/50/81/397965081.db2.gz UUDKXAMUPKTZAF-SECBINFHSA-N 1 2 219.313 2.389 20 0 BEADLO CCCN1CC[N@H+](C[C@@H](F)CC)C(C)(C)C1=O ZINC000440528146 397931059 /nfs/dbraw/zinc/93/10/59/397931059.db2.gz CXVKGRHSGCYERX-NSHDSACASA-N 1 2 244.354 2.067 20 0 BEADLO CCCN1CC[N@@H+](C[C@@H](F)CC)C(C)(C)C1=O ZINC000440528146 397931061 /nfs/dbraw/zinc/93/10/61/397931061.db2.gz CXVKGRHSGCYERX-NSHDSACASA-N 1 2 244.354 2.067 20 0 BEADLO Cc1nnsc1C[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000649577999 397966078 /nfs/dbraw/zinc/96/60/78/397966078.db2.gz BFRQDENIGIJIDR-VXNVDRBHSA-N 1 2 229.324 2.026 20 0 BEADLO Cc1nnsc1C[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000649577999 397966082 /nfs/dbraw/zinc/96/60/82/397966082.db2.gz BFRQDENIGIJIDR-VXNVDRBHSA-N 1 2 229.324 2.026 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccncc2F)[C@H](C)[C@@H](C)O1 ZINC000449264560 397953798 /nfs/dbraw/zinc/95/37/98/397953798.db2.gz MQZGPEOUPCNDBB-GMTAPVOTSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccncc2F)[C@H](C)[C@@H](C)O1 ZINC000449264560 397953801 /nfs/dbraw/zinc/95/38/01/397953801.db2.gz MQZGPEOUPCNDBB-GMTAPVOTSA-N 1 2 238.306 2.218 20 0 BEADLO Cc1ccc(C)c(C[N@H+](C)Cc2cnn[nH]2)c1 ZINC000450869944 397967817 /nfs/dbraw/zinc/96/78/17/397967817.db2.gz YLDBJRSCCXFCFE-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1ccc(C)c(C[N@@H+](C)Cc2cnn[nH]2)c1 ZINC000450869944 397967818 /nfs/dbraw/zinc/96/78/18/397967818.db2.gz YLDBJRSCCXFCFE-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1ccc(C)c(C[N@H+](C)Cc2c[nH]nn2)c1 ZINC000450869944 397967820 /nfs/dbraw/zinc/96/78/20/397967820.db2.gz YLDBJRSCCXFCFE-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1ccc(C)c(C[N@@H+](C)Cc2c[nH]nn2)c1 ZINC000450869944 397967822 /nfs/dbraw/zinc/96/78/22/397967822.db2.gz YLDBJRSCCXFCFE-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO COc1cc(C)ccc1C[NH2+]Cc1cocn1 ZINC000192324972 397893597 /nfs/dbraw/zinc/89/35/97/397893597.db2.gz LHHZVUQCDGGAGD-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO CN(CC(C)(C)C)C(=O)c1ccc2[nH+]ccn2c1 ZINC000264070433 397914887 /nfs/dbraw/zinc/91/48/87/397914887.db2.gz GHEPOGXGBGGKQT-UHFFFAOYSA-N 1 2 245.326 2.452 20 0 BEADLO C[C@H](CC(=O)N(C)c1ccccc1)n1cc[nH+]c1 ZINC000649537102 397926138 /nfs/dbraw/zinc/92/61/38/397926138.db2.gz TUOMEUQYFKCNLU-GFCCVEGCSA-N 1 2 243.310 2.497 20 0 BEADLO Cc1nc(C)c(C[NH2+]Cc2c(C)noc2C)o1 ZINC000383059614 397997987 /nfs/dbraw/zinc/99/79/87/397997987.db2.gz MYYJQRKWDMGTFJ-UHFFFAOYSA-N 1 2 235.287 2.186 20 0 BEADLO Cc1cc(N2CC[C@H](c3ccco3)C2)nc[nH+]1 ZINC000599937645 398045558 /nfs/dbraw/zinc/04/55/58/398045558.db2.gz IBIVCMBPUXZMEO-NSHDSACASA-N 1 2 229.283 2.372 20 0 BEADLO Cc1c[nH+]c(C)c(NCc2cnc(C)nc2)c1 ZINC000650241617 398003338 /nfs/dbraw/zinc/00/33/38/398003338.db2.gz CFNMVNFXXZWGRI-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO COc1ncncc1CNc1cc(C)c[nH+]c1C ZINC000650242744 398003887 /nfs/dbraw/zinc/00/38/87/398003887.db2.gz XIRVLWKHIHCVBE-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1CCCC[C@H]1F ZINC000641634607 398021401 /nfs/dbraw/zinc/02/14/01/398021401.db2.gz QRTFYZUMPXNRSZ-PSASIEDQSA-N 1 2 212.243 2.335 20 0 BEADLO c1snnc1C[N@@H+]1CCC12CCCC2 ZINC000649658809 398028600 /nfs/dbraw/zinc/02/86/00/398028600.db2.gz ZFDPIJZBNXNMKP-UHFFFAOYSA-N 1 2 209.318 2.057 20 0 BEADLO c1snnc1C[N@H+]1CCC12CCCC2 ZINC000649658809 398028603 /nfs/dbraw/zinc/02/86/03/398028603.db2.gz ZFDPIJZBNXNMKP-UHFFFAOYSA-N 1 2 209.318 2.057 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cc(C)on2)[C@@H](CC)CO1 ZINC000649722334 398065547 /nfs/dbraw/zinc/06/55/47/398065547.db2.gz LYSJBQJVWVVDLQ-STQMWFEESA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cc(C)on2)[C@@H](CC)CO1 ZINC000649722334 398065550 /nfs/dbraw/zinc/06/55/50/398065550.db2.gz LYSJBQJVWVVDLQ-STQMWFEESA-N 1 2 238.331 2.372 20 0 BEADLO CCCC(C)(C)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000283398836 398072786 /nfs/dbraw/zinc/07/27/86/398072786.db2.gz GXVDTOLNIMEONA-AATRIKPKSA-N 1 2 221.304 2.118 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1C[C@@H]2C=C[C@H]1CC2 ZINC000649704457 398051928 /nfs/dbraw/zinc/05/19/28/398051928.db2.gz ISIYQEMQXUIPAI-FRRDWIJNSA-N 1 2 242.322 2.353 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@@H+]1Cc1ccon1 ZINC000649715848 398057934 /nfs/dbraw/zinc/05/79/34/398057934.db2.gz NRODFKWLJMHSPU-LLVKDONJSA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@H+]1Cc1ccon1 ZINC000649715848 398057939 /nfs/dbraw/zinc/05/79/39/398057939.db2.gz NRODFKWLJMHSPU-LLVKDONJSA-N 1 2 224.304 2.064 20 0 BEADLO CCc1csc(NCCCn2cc[nH+]c2)n1 ZINC000061894373 398108888 /nfs/dbraw/zinc/10/88/88/398108888.db2.gz PBPRSLWUFFFSOQ-UHFFFAOYSA-N 1 2 236.344 2.404 20 0 BEADLO C[C@H](O)CCCOc1cccc(-n2cc[nH+]c2)c1 ZINC000418887531 398106188 /nfs/dbraw/zinc/10/61/88/398106188.db2.gz SCWQHSKHZXKNKE-LBPRGKRZSA-N 1 2 246.310 2.412 20 0 BEADLO Cc1[nH]c(C(=O)NC2CCC(C)(C)CC2)c[nH+]1 ZINC000266605816 398113042 /nfs/dbraw/zinc/11/30/42/398113042.db2.gz VJDZJDKSQCFTPO-UHFFFAOYSA-N 1 2 235.331 2.417 20 0 BEADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1nccn1C ZINC000528768094 398126584 /nfs/dbraw/zinc/12/65/84/398126584.db2.gz NJFYWILUEBNJLH-SECBINFHSA-N 1 2 229.274 2.040 20 0 BEADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1nccn1C ZINC000528768094 398126587 /nfs/dbraw/zinc/12/65/87/398126587.db2.gz NJFYWILUEBNJLH-SECBINFHSA-N 1 2 229.274 2.040 20 0 BEADLO CCn1nccc1C[N@H+](C)Cc1ccco1 ZINC000162157968 398132798 /nfs/dbraw/zinc/13/27/98/398132798.db2.gz DGPOOKBRTKTXJQ-UHFFFAOYSA-N 1 2 219.288 2.128 20 0 BEADLO CCn1nccc1C[N@@H+](C)Cc1ccco1 ZINC000162157968 398132800 /nfs/dbraw/zinc/13/28/00/398132800.db2.gz DGPOOKBRTKTXJQ-UHFFFAOYSA-N 1 2 219.288 2.128 20 0 BEADLO CC(C)COC(=O)C[N@H+](C)Cc1ccccc1 ZINC000121774539 167021054 /nfs/dbraw/zinc/02/10/54/167021054.db2.gz AGDRJKHNDSBTNJ-UHFFFAOYSA-N 1 2 235.327 2.318 20 0 BEADLO CC(C)COC(=O)C[N@@H+](C)Cc1ccccc1 ZINC000121774539 167021056 /nfs/dbraw/zinc/02/10/56/167021056.db2.gz AGDRJKHNDSBTNJ-UHFFFAOYSA-N 1 2 235.327 2.318 20 0 BEADLO CCc1ccc(C[NH2+]Cc2cnc(C)o2)o1 ZINC000398126387 322865360 /nfs/dbraw/zinc/86/53/60/322865360.db2.gz ZBSBMENVMHZUOJ-UHFFFAOYSA-N 1 2 220.272 2.428 20 0 BEADLO CC(C)SCC[N@H+](C)Cc1ncccn1 ZINC001648161283 1172804495 /nfs/dbraw/zinc/80/44/95/1172804495.db2.gz DFJQBHUKWRICNG-UHFFFAOYSA-N 1 2 225.361 2.050 20 0 BEADLO CC(C)SCC[N@@H+](C)Cc1ncccn1 ZINC001648161283 1172804498 /nfs/dbraw/zinc/80/44/98/1172804498.db2.gz DFJQBHUKWRICNG-UHFFFAOYSA-N 1 2 225.361 2.050 20 0 BEADLO CC(=O)C[N@@H+]1CCc2nc[nH]c2C12CCCCC2 ZINC001648312607 1172823187 /nfs/dbraw/zinc/82/31/87/1172823187.db2.gz XHFHKSKETQSNDS-UHFFFAOYSA-N 1 2 247.342 2.016 20 0 BEADLO CC(=O)C[N@H+]1CCc2nc[nH]c2C12CCCCC2 ZINC001648312607 1172823198 /nfs/dbraw/zinc/82/31/98/1172823198.db2.gz XHFHKSKETQSNDS-UHFFFAOYSA-N 1 2 247.342 2.016 20 0 BEADLO CC(C)c1nc(N2CC3(CC3)C2)cc[nH+]1 ZINC000334793126 487558566 /nfs/dbraw/zinc/55/85/66/487558566.db2.gz LTQQVTKOUQHTFO-UHFFFAOYSA-N 1 2 203.289 2.200 20 0 BEADLO c1n[nH]nc1C[N@@H+]1CCC[C@H](C2CCCC2)C1 ZINC001648624369 1172859504 /nfs/dbraw/zinc/85/95/04/1172859504.db2.gz LCHLFJXOXDYOOA-LBPRGKRZSA-N 1 2 234.347 2.207 20 0 BEADLO c1n[nH]nc1C[N@H+]1CCC[C@H](C2CCCC2)C1 ZINC001648624369 1172859509 /nfs/dbraw/zinc/85/95/09/1172859509.db2.gz LCHLFJXOXDYOOA-LBPRGKRZSA-N 1 2 234.347 2.207 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+]2CCC(F)(F)[C@H](C)C2)n1 ZINC000685590959 487560145 /nfs/dbraw/zinc/56/01/45/487560145.db2.gz CXYBUCXDTYAGQX-HTQZYQBOSA-N 1 2 245.273 2.416 20 0 BEADLO Cc1noc([C@@H](C)[N@H+]2CCC(F)(F)[C@H](C)C2)n1 ZINC000685590959 487560149 /nfs/dbraw/zinc/56/01/49/487560149.db2.gz CXYBUCXDTYAGQX-HTQZYQBOSA-N 1 2 245.273 2.416 20 0 BEADLO Cc1noc([C@H](C)[N@@H+]2CCC(F)(F)[C@H](C)C2)n1 ZINC000685590961 487560883 /nfs/dbraw/zinc/56/08/83/487560883.db2.gz CXYBUCXDTYAGQX-SFYZADRCSA-N 1 2 245.273 2.416 20 0 BEADLO Cc1noc([C@H](C)[N@H+]2CCC(F)(F)[C@H](C)C2)n1 ZINC000685590961 487560887 /nfs/dbraw/zinc/56/08/87/487560887.db2.gz CXYBUCXDTYAGQX-SFYZADRCSA-N 1 2 245.273 2.416 20 0 BEADLO FC1C[NH+](C[C@H]2CCOc3ccccc32)C1 ZINC000680334240 487560665 /nfs/dbraw/zinc/56/06/65/487560665.db2.gz KTUZGZKZECDECV-SNVBAGLBSA-N 1 2 221.275 2.206 20 0 BEADLO CC(C)OC(=O)[C@@H](C)[N@H+](C)CCSC(C)C ZINC000338271179 167167053 /nfs/dbraw/zinc/16/70/53/167167053.db2.gz MFSFYYYSJNLATO-LLVKDONJSA-N 1 2 247.404 2.400 20 0 BEADLO CC(C)OC(=O)[C@@H](C)[N@@H+](C)CCSC(C)C ZINC000338271179 167167056 /nfs/dbraw/zinc/16/70/56/167167056.db2.gz MFSFYYYSJNLATO-LLVKDONJSA-N 1 2 247.404 2.400 20 0 BEADLO C[C@@H]1C[C@@H]1Nc1[nH+]c(C2CC2)nc2[nH]ccc21 ZINC000631096115 487564917 /nfs/dbraw/zinc/56/49/17/487564917.db2.gz AHEGCOIKVYGSRY-XCBNKYQSSA-N 1 2 228.299 2.078 20 0 BEADLO COc1ccc(NC2CCC(OC)CC2)[nH+]c1 ZINC000680332405 487565643 /nfs/dbraw/zinc/56/56/43/487565643.db2.gz DQEQTEGPGPDGPZ-UHFFFAOYSA-N 1 2 236.315 2.460 20 0 BEADLO Cc1ccc2c(c1)N(Cc1c[nH+]cn1C)CC2 ZINC000674370121 487566642 /nfs/dbraw/zinc/56/66/42/487566642.db2.gz NMBCMGXYALITLQ-UHFFFAOYSA-N 1 2 227.311 2.291 20 0 BEADLO CCCC(C)(C)NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC000065174474 1172903911 /nfs/dbraw/zinc/90/39/11/1172903911.db2.gz TVTZZCVCZJIMBD-SNVBAGLBSA-N 1 2 223.320 2.139 20 0 BEADLO CCCn1cncc1C[NH2+]Cc1ncccc1F ZINC001651036207 1172916190 /nfs/dbraw/zinc/91/61/90/1172916190.db2.gz SETBDOJIIBOKKI-UHFFFAOYSA-N 1 2 248.305 2.117 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]CC1=CCCC1 ZINC000658290540 487578710 /nfs/dbraw/zinc/57/87/10/487578710.db2.gz BSHCHPWZYGQICI-VIFPVBQESA-N 1 2 205.305 2.479 20 0 BEADLO c1cc2cc(NCC[C@H]3CCOC3)[nH+]cc2[nH]1 ZINC000672250690 487591437 /nfs/dbraw/zinc/59/14/37/487591437.db2.gz ABKRJAKBFBNVEF-JTQLQIEISA-N 1 2 231.299 2.401 20 0 BEADLO CC(C)C1CCN(c2cc(CO)cc[nH+]2)CC1 ZINC000232545847 487605042 /nfs/dbraw/zinc/60/50/42/487605042.db2.gz NTXCDNDKSGECNH-UHFFFAOYSA-N 1 2 234.343 2.446 20 0 BEADLO CC(C)SCC[N@@H+]1CCC[C@@H]1c1ncon1 ZINC000374798290 167322910 /nfs/dbraw/zinc/32/29/10/167322910.db2.gz ZYYLXOHUVUOGFC-SNVBAGLBSA-N 1 2 241.360 2.348 20 0 BEADLO CC(C)SCC[N@H+]1CCC[C@@H]1c1ncon1 ZINC000374798290 167322912 /nfs/dbraw/zinc/32/29/12/167322912.db2.gz ZYYLXOHUVUOGFC-SNVBAGLBSA-N 1 2 241.360 2.348 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)NC2(C)CCC2)c2[nH+]ccn21 ZINC000556769589 322923004 /nfs/dbraw/zinc/92/30/04/322923004.db2.gz QFZIHORETQHKJW-NXEZZACHSA-N 1 2 248.330 2.131 20 0 BEADLO Cc1cc(NC(=O)NC2CC3(CCC3)C2)cc[nH+]1 ZINC000650106009 409583921 /nfs/dbraw/zinc/58/39/21/409583921.db2.gz FPJNSLQAOCTIJT-UHFFFAOYSA-N 1 2 245.326 2.266 20 0 BEADLO CCc1nocc1C[N@H+]1C[C@@H](CC)OC[C@H]1C ZINC000660912261 409959468 /nfs/dbraw/zinc/95/94/68/409959468.db2.gz IHDYZMIGJSSYOE-ZYHUDNBSSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1nocc1C[N@@H+]1C[C@@H](CC)OC[C@H]1C ZINC000660912261 409959474 /nfs/dbraw/zinc/95/94/74/409959474.db2.gz IHDYZMIGJSSYOE-ZYHUDNBSSA-N 1 2 238.331 2.236 20 0 BEADLO CC[C@H]1C[N@H+](Cc2coc(C)n2)[C@@H](CC)CO1 ZINC000660911632 409961265 /nfs/dbraw/zinc/96/12/65/409961265.db2.gz FHWFECSQLKMTQT-STQMWFEESA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2coc(C)n2)[C@@H](CC)CO1 ZINC000660911632 409961269 /nfs/dbraw/zinc/96/12/69/409961269.db2.gz FHWFECSQLKMTQT-STQMWFEESA-N 1 2 238.331 2.372 20 0 BEADLO Cc1nocc1C[N@H+]1C[C@H](C)OCC12CCC2 ZINC000651974533 409963725 /nfs/dbraw/zinc/96/37/25/409963725.db2.gz HGVVPIVZNZQHOZ-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO Cc1nocc1C[N@@H+]1C[C@H](C)OCC12CCC2 ZINC000651974533 409963733 /nfs/dbraw/zinc/96/37/33/409963733.db2.gz HGVVPIVZNZQHOZ-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO CCCn1ncnc1C[N@@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660929979 409977031 /nfs/dbraw/zinc/97/70/31/409977031.db2.gz DJWBZDVMGVSFLR-RYUDHWBXSA-N 1 2 234.347 2.063 20 0 BEADLO CCCn1ncnc1C[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660929979 409977037 /nfs/dbraw/zinc/97/70/37/409977037.db2.gz DJWBZDVMGVSFLR-RYUDHWBXSA-N 1 2 234.347 2.063 20 0 BEADLO CSc1ccc[nH+]c1NCc1ccnn1C ZINC000651970863 409941046 /nfs/dbraw/zinc/94/10/46/409941046.db2.gz NFROXLGJGFJRFE-UHFFFAOYSA-N 1 2 234.328 2.149 20 0 BEADLO CSc1ccc[nH+]c1NC1CCOCC1 ZINC000651971335 409943147 /nfs/dbraw/zinc/94/31/47/409943147.db2.gz AMAROKWWJHHYBR-UHFFFAOYSA-N 1 2 224.329 2.394 20 0 BEADLO c1cc(NC2CSC2)[nH+]cc1N1CCCC1 ZINC000644904268 410050343 /nfs/dbraw/zinc/05/03/43/410050343.db2.gz JGPLFMXHTZUIAQ-UHFFFAOYSA-N 1 2 235.356 2.209 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccccc2F)CCO1 ZINC000046513149 410178353 /nfs/dbraw/zinc/17/83/53/410178353.db2.gz ZGMVKFCNHOOSLY-LBPRGKRZSA-N 1 2 223.291 2.437 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccccc2F)CCO1 ZINC000046513149 410178363 /nfs/dbraw/zinc/17/83/63/410178363.db2.gz ZGMVKFCNHOOSLY-LBPRGKRZSA-N 1 2 223.291 2.437 20 0 BEADLO CCN(CC)C(=O)CCCNc1cccc[nH+]1 ZINC000267536537 169746407 /nfs/dbraw/zinc/74/64/07/169746407.db2.gz TUZIUXFDHYJADJ-UHFFFAOYSA-N 1 2 235.331 2.142 20 0 BEADLO COC(=O)C(C)(C)[NH2+]CCCc1ccccc1C ZINC000084677520 410465456 /nfs/dbraw/zinc/46/54/56/410465456.db2.gz PLPOYZSTCUPSIO-UHFFFAOYSA-N 1 2 249.354 2.469 20 0 BEADLO CCc1cc(NC[C@@H]2CCC[C@@H](C)O2)nc[nH+]1 ZINC000664394112 410576104 /nfs/dbraw/zinc/57/61/04/410576104.db2.gz KURGMIXFMTUYDY-PWSUYJOCSA-N 1 2 235.331 2.409 20 0 BEADLO OC[C@H](CNc1cc[nH+]c(C2CC2)n1)CC1CC1 ZINC000664462919 410586747 /nfs/dbraw/zinc/58/67/47/410586747.db2.gz RRAQYFGGIXHBCY-NSHDSACASA-N 1 2 247.342 2.175 20 0 BEADLO Cc1cc(N2CCC(c3ccon3)CC2)nc[nH+]1 ZINC000664565595 410604674 /nfs/dbraw/zinc/60/46/74/410604674.db2.gz RSXFFBMZIUXIKN-UHFFFAOYSA-N 1 2 244.298 2.157 20 0 BEADLO Cc1cc2ccccc2[nH+]c1N[C@H]1C[C@H](O)C1 ZINC000664643179 410614092 /nfs/dbraw/zinc/61/40/92/410614092.db2.gz SGBLCURVJQTJSK-HAQNSBGRSA-N 1 2 228.295 2.478 20 0 BEADLO CC(C)COC(=O)C[N@H+](C)Cc1cccs1 ZINC000272050308 167021218 /nfs/dbraw/zinc/02/12/18/167021218.db2.gz UFMSNMUPBZMQSF-UHFFFAOYSA-N 1 2 241.356 2.379 20 0 BEADLO CC(C)COC(=O)C[N@@H+](C)Cc1cccs1 ZINC000272050308 167021221 /nfs/dbraw/zinc/02/12/21/167021221.db2.gz UFMSNMUPBZMQSF-UHFFFAOYSA-N 1 2 241.356 2.379 20 0 BEADLO CC(C)NC(=O)[C@@H]1CCc2[nH+]c(C(C)C)[nH]c2C1 ZINC000336451572 167081683 /nfs/dbraw/zinc/08/16/83/167081683.db2.gz SAUZQLGZFBQNGD-SNVBAGLBSA-N 1 2 249.358 2.163 20 0 BEADLO CC(C)NC(=O)[C@@H]1CCc2[nH]c(C(C)C)[nH+]c2C1 ZINC000336451572 167081686 /nfs/dbraw/zinc/08/16/86/167081686.db2.gz SAUZQLGZFBQNGD-SNVBAGLBSA-N 1 2 249.358 2.163 20 0 BEADLO CC(C)OC(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000279300364 167160768 /nfs/dbraw/zinc/16/07/68/167160768.db2.gz QGTHHHNXSLOIJA-UHFFFAOYSA-N 1 2 237.303 2.065 20 0 BEADLO CC(C)OC(=O)N[C@@H](c1[nH]cc[nH+]1)C(C)C ZINC000296207909 167163971 /nfs/dbraw/zinc/16/39/71/167163971.db2.gz WIXZIDGIRQJJKI-SECBINFHSA-N 1 2 225.292 2.241 20 0 BEADLO CC(C)OC(=O)N[C@H](c1[nH]cc[nH+]1)C(C)C ZINC000296207912 167165503 /nfs/dbraw/zinc/16/55/03/167165503.db2.gz WIXZIDGIRQJJKI-VIFPVBQESA-N 1 2 225.292 2.241 20 0 BEADLO CC(C)OC(=O)[C@H](C)[N@H+](C)CCC(F)(F)F ZINC000355895557 167170596 /nfs/dbraw/zinc/17/05/96/167170596.db2.gz WAARDUFTGUXDBG-QMMMGPOBSA-N 1 2 241.253 2.211 20 0 BEADLO CC(C)OC(=O)[C@H](C)[N@@H+](C)CCC(F)(F)F ZINC000355895557 167170598 /nfs/dbraw/zinc/17/05/98/167170598.db2.gz WAARDUFTGUXDBG-QMMMGPOBSA-N 1 2 241.253 2.211 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CCC2(CCC2)CC1 ZINC000672253985 487619349 /nfs/dbraw/zinc/61/93/49/487619349.db2.gz PJLWHXRNPNFDTL-UHFFFAOYSA-N 1 2 247.342 2.053 20 0 BEADLO CC(C)Oc1cccc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)c1 ZINC000368639542 167304528 /nfs/dbraw/zinc/30/45/28/167304528.db2.gz VYYDEUHWMUGTDH-LSDHHAIUSA-N 1 2 247.338 2.447 20 0 BEADLO CC(C)Oc1cccc(C[N@H+]2CCO[C@@H]3C[C@@H]32)c1 ZINC000368639542 167304533 /nfs/dbraw/zinc/30/45/33/167304533.db2.gz VYYDEUHWMUGTDH-LSDHHAIUSA-N 1 2 247.338 2.447 20 0 BEADLO CC(C)Oc1ccccc1C[NH2+]Cc1cc[nH]n1 ZINC000041015168 167310297 /nfs/dbraw/zinc/31/02/97/167310297.db2.gz QSNGWAVEWFZKHI-UHFFFAOYSA-N 1 2 245.326 2.487 20 0 BEADLO CC[C@H]([NH2+][C@@H](C)c1c[nH]nc1C)C(F)F ZINC000651364347 410952178 /nfs/dbraw/zinc/95/21/78/410952178.db2.gz KTHKWVMQFVNELQ-RCOVLWMOSA-N 1 2 217.263 2.412 20 0 BEADLO CC[C@@H]([NH2+][C@@H](C)c1c[nH]nc1C)C(F)F ZINC000651364345 410952194 /nfs/dbraw/zinc/95/21/94/410952194.db2.gz KTHKWVMQFVNELQ-IMTBSYHQSA-N 1 2 217.263 2.412 20 0 BEADLO CC[C@H]([NH2+]Cc1cnn[nH]1)c1ccccc1F ZINC000398297038 410956595 /nfs/dbraw/zinc/95/65/95/410956595.db2.gz OVXRGAPGJVKRCM-LBPRGKRZSA-N 1 2 234.278 2.185 20 0 BEADLO Cc1cc(N2CCC[C@H](OC(C)C)C2)nc[nH+]1 ZINC000651386476 410969075 /nfs/dbraw/zinc/96/90/75/410969075.db2.gz NTIUWGLOJWHAJB-LBPRGKRZSA-N 1 2 235.331 2.179 20 0 BEADLO Cc1occc1CN(C)c1cc(CO)cc[nH+]1 ZINC000042449724 411009717 /nfs/dbraw/zinc/00/97/17/411009717.db2.gz VFTIUHMFWYOAJP-UHFFFAOYSA-N 1 2 232.283 2.112 20 0 BEADLO c1cc(C[NH2+]Cc2cccc3c2CCC3)[nH]n1 ZINC000651672089 411134867 /nfs/dbraw/zinc/13/48/67/411134867.db2.gz QDHUVLQSKSPQMN-UHFFFAOYSA-N 1 2 227.311 2.188 20 0 BEADLO COC[C@H](CC(C)(C)C)[NH2+]Cc1cn[nH]c1C ZINC000651716672 411138469 /nfs/dbraw/zinc/13/84/69/411138469.db2.gz DTHWXASZRBRCLE-LBPRGKRZSA-N 1 2 239.363 2.259 20 0 BEADLO CC1(C)CC[N@H+](Cc2cn[nH]n2)CC(C)(C)C1 ZINC000661625752 411086721 /nfs/dbraw/zinc/08/67/21/411086721.db2.gz GLXKRCZEUUAOME-UHFFFAOYSA-N 1 2 236.363 2.453 20 0 BEADLO CC1(C)CC[N@@H+](Cc2cn[nH]n2)CC(C)(C)C1 ZINC000661625752 411086726 /nfs/dbraw/zinc/08/67/26/411086726.db2.gz GLXKRCZEUUAOME-UHFFFAOYSA-N 1 2 236.363 2.453 20 0 BEADLO CC(C)c1nc(N[C@H](C)[C@@H]2CCCOC2)cc[nH+]1 ZINC000355572117 167686779 /nfs/dbraw/zinc/68/67/79/167686779.db2.gz ZRAVWRYVKTZINL-VXGBXAGGSA-N 1 2 249.358 2.249 20 0 BEADLO COCc1cc[nH+]c(N[C@H]2CCO[C@@H](C)C2)c1 ZINC000652068561 411104789 /nfs/dbraw/zinc/10/47/89/411104789.db2.gz HFOHYPFXTUQGDS-JQWIXIFHSA-N 1 2 236.315 2.207 20 0 BEADLO COCC[C@@H](C)Nc1cc(COC)cc[nH+]1 ZINC000652067956 411104924 /nfs/dbraw/zinc/10/49/24/411104924.db2.gz MRGKWYRKHGVUPE-SNVBAGLBSA-N 1 2 224.304 2.065 20 0 BEADLO CCOC[C@H](C)Nc1cc(COC)cc[nH+]1 ZINC000652068603 411105080 /nfs/dbraw/zinc/10/50/80/411105080.db2.gz ITHZIGBFOXDBPJ-JTQLQIEISA-N 1 2 224.304 2.065 20 0 BEADLO CC[C@H](COC)Nc1cc(COC)cc[nH+]1 ZINC000652068195 411105103 /nfs/dbraw/zinc/10/51/03/411105103.db2.gz VSXFIPQUPHLYPK-LLVKDONJSA-N 1 2 224.304 2.065 20 0 BEADLO COCc1cc[nH+]c(N[C@H](C)COC(C)C)c1 ZINC000652068174 411105380 /nfs/dbraw/zinc/10/53/80/411105380.db2.gz VGUIPCAEIPOLHM-LLVKDONJSA-N 1 2 238.331 2.453 20 0 BEADLO F[C@H]1CCC[N@H+](Cc2cnc3ccccn23)C1 ZINC000652077487 411108758 /nfs/dbraw/zinc/10/87/58/411108758.db2.gz GIKJWHBVTOFBBN-NSHDSACASA-N 1 2 233.290 2.268 20 0 BEADLO F[C@H]1CCC[N@@H+](Cc2cnc3ccccn23)C1 ZINC000652077487 411108760 /nfs/dbraw/zinc/10/87/60/411108760.db2.gz GIKJWHBVTOFBBN-NSHDSACASA-N 1 2 233.290 2.268 20 0 BEADLO COc1c(C)[nH+]cnc1N1CCC(C)CC1 ZINC000656105232 411178992 /nfs/dbraw/zinc/17/89/92/411178992.db2.gz QVAONYZUFUQUIH-UHFFFAOYSA-N 1 2 221.304 2.030 20 0 BEADLO COc1c(C)[nH+]cnc1NCCc1ccccc1 ZINC000656103938 411178998 /nfs/dbraw/zinc/17/89/98/411178998.db2.gz UKGAYXBWSNNDBM-UHFFFAOYSA-N 1 2 243.310 2.448 20 0 BEADLO COc1c(C)[nH+]cnc1NCC1CCCC1 ZINC000656107876 411179445 /nfs/dbraw/zinc/17/94/45/411179445.db2.gz AIACZLZYWUBEBY-UHFFFAOYSA-N 1 2 221.304 2.396 20 0 BEADLO CC[C@@H]1CCCN(c2nc[nH+]c(C)c2OC)C1 ZINC000656108075 411179925 /nfs/dbraw/zinc/17/99/25/411179925.db2.gz MGVMQABEKZPFNB-LLVKDONJSA-N 1 2 235.331 2.420 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H](C)c1ccccn1 ZINC000656106148 411179960 /nfs/dbraw/zinc/17/99/60/411179960.db2.gz XFTYPAPBPPCROZ-VIFPVBQESA-N 1 2 244.298 2.362 20 0 BEADLO CCCCOCCNc1nc[nH+]c(C)c1OC ZINC000656111919 411181831 /nfs/dbraw/zinc/18/18/31/411181831.db2.gz CRBLOTTYKAJCEB-UHFFFAOYSA-N 1 2 239.319 2.022 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1CCSC1 ZINC000656128997 411184275 /nfs/dbraw/zinc/18/42/75/411184275.db2.gz PRWYQHUDKOXNLL-VIFPVBQESA-N 1 2 209.318 2.011 20 0 BEADLO COc1c(C)[nH+]cnc1NCC1(C)CC1 ZINC000656137785 411185714 /nfs/dbraw/zinc/18/57/14/411185714.db2.gz WOVHRGHJXZYOEY-UHFFFAOYSA-N 1 2 207.277 2.006 20 0 BEADLO COC[C@@H]1CCCN(c2cccc[nH+]2)CC1 ZINC000336254320 411248213 /nfs/dbraw/zinc/24/82/13/411248213.db2.gz WWJCMPSNOKCFAO-GFCCVEGCSA-N 1 2 220.316 2.335 20 0 BEADLO COc1c(C)[nH+]cnc1N1C[C@@H]2CCC[C@@H]2C1 ZINC000656146979 411186012 /nfs/dbraw/zinc/18/60/12/411186012.db2.gz RQPRJGVLSWTPEL-PHIMTYICSA-N 1 2 233.315 2.030 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)C[C@@H]1CCCC[C@H]1O ZINC000656152686 411187560 /nfs/dbraw/zinc/18/75/60/411187560.db2.gz CKINGXBBXUMSSP-QWHCGFSZSA-N 1 2 249.358 2.081 20 0 BEADLO Cc1c[nH+]c(C)nc1NCC[C@H]1CCCCO1 ZINC000656155028 411188922 /nfs/dbraw/zinc/18/89/22/411188922.db2.gz GFWPOTXYOWAMHS-GFCCVEGCSA-N 1 2 235.331 2.465 20 0 BEADLO COc1c(C)[nH+]cnc1N1CCCC[C@@H](C)C1 ZINC000656163652 411189573 /nfs/dbraw/zinc/18/95/73/411189573.db2.gz IGHLOGGRKREINB-SNVBAGLBSA-N 1 2 235.331 2.420 20 0 BEADLO COc1ccc[nH+]c1NCC(C)(F)F ZINC000528024449 411244495 /nfs/dbraw/zinc/24/44/95/411244495.db2.gz FVSQCKNNJYEAAY-UHFFFAOYSA-N 1 2 202.204 2.157 20 0 BEADLO CO[C@H]1CC[C@H](Nc2nc(C)[nH+]cc2C)C1 ZINC000656176047 411192763 /nfs/dbraw/zinc/19/27/63/411192763.db2.gz UIMXELKVCZBALL-QWRGUYRKSA-N 1 2 221.304 2.073 20 0 BEADLO COc1c(C)[nH+]cnc1N(C)Cc1occc1C ZINC000656190689 411197081 /nfs/dbraw/zinc/19/70/81/411197081.db2.gz MWZDQTSUBJWZHQ-UHFFFAOYSA-N 1 2 247.298 2.331 20 0 BEADLO COCc1cc[nH+]c(N[C@H](C)[C@@H](C)OC)c1 ZINC000652330481 411202636 /nfs/dbraw/zinc/20/26/36/411202636.db2.gz HUJQIZFOXHZGIB-NXEZZACHSA-N 1 2 224.304 2.063 20 0 BEADLO C[C@H]([NH2+]Cc1c[nH]nn1)C1CCC(F)(F)CC1 ZINC000653872042 411202777 /nfs/dbraw/zinc/20/27/77/411202777.db2.gz NGYYMFJJQZJAEI-QMMMGPOBSA-N 1 2 244.289 2.108 20 0 BEADLO C[C@H]([NH2+]Cc1cn[nH]n1)C1CCC(F)(F)CC1 ZINC000653872042 411202780 /nfs/dbraw/zinc/20/27/80/411202780.db2.gz NGYYMFJJQZJAEI-QMMMGPOBSA-N 1 2 244.289 2.108 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000656199816 411204863 /nfs/dbraw/zinc/20/48/63/411204863.db2.gz DWXHJJMITXURNN-OUAUKWLOSA-N 1 2 233.315 2.394 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1CCCC[C@H]1F ZINC000656202019 411206052 /nfs/dbraw/zinc/20/60/52/411206052.db2.gz NPPANYIMYOHHIR-NXEZZACHSA-N 1 2 239.294 2.486 20 0 BEADLO COc1c(C)[nH+]cnc1N1CC[C@@H](C2CCC2)C1 ZINC000656201661 411206287 /nfs/dbraw/zinc/20/62/87/411206287.db2.gz OSCNNVZYOVWSRL-GFCCVEGCSA-N 1 2 247.342 2.420 20 0 BEADLO Cn1cc([C@H]2C[N@H+](CC(F)F)CC2(C)C)cn1 ZINC000653710692 411207386 /nfs/dbraw/zinc/20/73/86/411207386.db2.gz VOCDVIOPSCPTTD-SNVBAGLBSA-N 1 2 243.301 2.111 20 0 BEADLO Cn1cc([C@H]2C[N@@H+](CC(F)F)CC2(C)C)cn1 ZINC000653710692 411207390 /nfs/dbraw/zinc/20/73/90/411207390.db2.gz VOCDVIOPSCPTTD-SNVBAGLBSA-N 1 2 243.301 2.111 20 0 BEADLO CC[C@H]1C[C@@H](Nc2nc(C)[nH+]cc2C)CCO1 ZINC000656204960 411207443 /nfs/dbraw/zinc/20/74/43/411207443.db2.gz RTNGGYIIRMLQJX-RYUDHWBXSA-N 1 2 235.331 2.463 20 0 BEADLO COc1c(C)[nH+]cnc1NC[C@@H](C)CC(F)F ZINC000656203086 411207984 /nfs/dbraw/zinc/20/79/84/411207984.db2.gz AMDAPIPSJOXERD-ZETCQYMHSA-N 1 2 245.273 2.497 20 0 BEADLO C[C@@H]1C[C@H]1C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000048698145 411208943 /nfs/dbraw/zinc/20/89/43/411208943.db2.gz MOPBISHXAQHSDD-GHMZBOCLSA-N 1 2 241.294 2.467 20 0 BEADLO Cc1cc(N2CCC[C@H](OC3CCC3)C2)nc[nH+]1 ZINC000656217753 411212113 /nfs/dbraw/zinc/21/21/13/411212113.db2.gz SBTAWVRIPAYHOX-ZDUSSCGKSA-N 1 2 247.342 2.323 20 0 BEADLO C[C@H]([NH2+][C@H]1C[C@@H](C)n2ncnc21)c1ccoc1 ZINC000658101937 411246476 /nfs/dbraw/zinc/24/64/76/411246476.db2.gz NOTLIARIOCWGLU-YWVKMMECSA-N 1 2 232.287 2.228 20 0 BEADLO CCCC(C)(C)C(=O)NCc1[nH+]ccn1CC ZINC000652395195 411225096 /nfs/dbraw/zinc/22/50/96/411225096.db2.gz GRKYBGLDLTUCBC-UHFFFAOYSA-N 1 2 237.347 2.346 20 0 BEADLO Cc1cccc(C[NH2+][C@H]2CCCn3ccnc32)n1 ZINC000655698188 411247306 /nfs/dbraw/zinc/24/73/06/411247306.db2.gz ZGUVBHQIAVRGBJ-ZDUSSCGKSA-N 1 2 242.326 2.211 20 0 BEADLO CC(C)(NC(=O)c1ccsc1)c1[nH]cc[nH+]1 ZINC000652409880 411232250 /nfs/dbraw/zinc/23/22/50/411232250.db2.gz YNUDZJUAVSPYDK-UHFFFAOYSA-N 1 2 235.312 2.136 20 0 BEADLO Cc1cc(C(=O)NC(C)(C)c2[nH]cc[nH+]2)oc1C ZINC000652412243 411233829 /nfs/dbraw/zinc/23/38/29/411233829.db2.gz WHYCZDMQJVFVAM-UHFFFAOYSA-N 1 2 247.298 2.285 20 0 BEADLO COc1ccc(F)cc1C[NH2+]Cc1ccon1 ZINC000310477379 411238121 /nfs/dbraw/zinc/23/81/21/411238121.db2.gz CCDVEPZATKBCLZ-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO Cn1cc[nH+]c1-c1ccc(C[C@H](O)C2CC2)cc1 ZINC000656371735 411238323 /nfs/dbraw/zinc/23/83/23/411238323.db2.gz REHQYRWMZQWPBU-AWEZNQCLSA-N 1 2 242.322 2.401 20 0 BEADLO Cc1nsc(C)c1C[N@@H+]1CC[C@H](F)C1 ZINC000653732170 411273626 /nfs/dbraw/zinc/27/36/26/411273626.db2.gz QWEJPUFZDTVHNL-VIFPVBQESA-N 1 2 214.309 2.304 20 0 BEADLO Cc1nsc(C)c1C[N@H+]1CC[C@H](F)C1 ZINC000653732170 411273627 /nfs/dbraw/zinc/27/36/27/411273627.db2.gz QWEJPUFZDTVHNL-VIFPVBQESA-N 1 2 214.309 2.304 20 0 BEADLO Cc1nsc(C)c1C[N@@H+]1CC[C@@H](F)C1 ZINC000653732167 411274071 /nfs/dbraw/zinc/27/40/71/411274071.db2.gz QWEJPUFZDTVHNL-SECBINFHSA-N 1 2 214.309 2.304 20 0 BEADLO Cc1nsc(C)c1C[N@H+]1CC[C@@H](F)C1 ZINC000653732167 411274075 /nfs/dbraw/zinc/27/40/75/411274075.db2.gz QWEJPUFZDTVHNL-SECBINFHSA-N 1 2 214.309 2.304 20 0 BEADLO CC(C)(C(=O)N1CCC12CCCC2)c1c[nH+]c[nH]1 ZINC000652568893 411274737 /nfs/dbraw/zinc/27/47/37/411274737.db2.gz XABWDVUBJOWKRW-UHFFFAOYSA-N 1 2 247.342 2.232 20 0 BEADLO CCCC[C@@H](CC)[NH2+]Cc1nnc(COC)[nH]1 ZINC000658162855 411276391 /nfs/dbraw/zinc/27/63/91/411276391.db2.gz WLPLXWLLVMQINK-SNVBAGLBSA-N 1 2 240.351 2.010 20 0 BEADLO CC[C@H](C)CCNc1[nH+]cnc2c1cnn2C ZINC000656472654 411277308 /nfs/dbraw/zinc/27/73/08/411277308.db2.gz MYCROLHZTRJFCN-VIFPVBQESA-N 1 2 233.319 2.211 20 0 BEADLO CC(C)(C)n1cc(C[NH+]2CC(C(F)F)C2)cn1 ZINC000656690913 411329929 /nfs/dbraw/zinc/32/99/29/411329929.db2.gz PPVPALWOVVNZCX-UHFFFAOYSA-N 1 2 243.301 2.335 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@H]1CCC[C@H](C)O1 ZINC000658219553 411298608 /nfs/dbraw/zinc/29/86/08/411298608.db2.gz NJLDVFLUERWZLB-JBLDHEPKSA-N 1 2 237.347 2.326 20 0 BEADLO COCc1ccc(C[NH+]2CC(C(F)F)C2)o1 ZINC000656690021 411330515 /nfs/dbraw/zinc/33/05/15/411330515.db2.gz FOJUDFSVWDOVRD-UHFFFAOYSA-N 1 2 231.242 2.123 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1cc(C2CC2)no1 ZINC000659822557 411305625 /nfs/dbraw/zinc/30/56/25/411305625.db2.gz OGUDZIGCQOKBGI-ZJUUUORDSA-N 1 2 236.315 2.161 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1cc(C2CC2)no1 ZINC000659822557 411305629 /nfs/dbraw/zinc/30/56/29/411305629.db2.gz OGUDZIGCQOKBGI-ZJUUUORDSA-N 1 2 236.315 2.161 20 0 BEADLO FC1CC2(C1)C[NH+](Cc1n[nH]c3ccccc31)C2 ZINC000656693859 411331482 /nfs/dbraw/zinc/33/14/82/411331482.db2.gz GJLRXLUJOYMZRW-UHFFFAOYSA-N 1 2 245.301 2.497 20 0 BEADLO Cc1cnc(C[NH+]2CC(C(F)F)C2)s1 ZINC000656691968 411331511 /nfs/dbraw/zinc/33/15/11/411331511.db2.gz QLVZAHDQUKXKKD-UHFFFAOYSA-N 1 2 218.272 2.148 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)[C@H]2CC23CCC3)c2[nH+]ccn21 ZINC000654012559 411315063 /nfs/dbraw/zinc/31/50/63/411315063.db2.gz FWVNPXILRQTDQN-GMTAPVOTSA-N 1 2 245.326 2.195 20 0 BEADLO Cc1cnc(C[NH+]2CC3(CC(F)C3)C2)s1 ZINC000656693671 411331981 /nfs/dbraw/zinc/33/19/81/411331981.db2.gz QHQYXBJHCJFUHV-UHFFFAOYSA-N 1 2 226.320 2.385 20 0 BEADLO Cn1c[nH+]cc1CNc1ccc2c(c1)CCOC2 ZINC000656666147 411319733 /nfs/dbraw/zinc/31/97/33/411319733.db2.gz QTHHRQLYTUYWGC-UHFFFAOYSA-N 1 2 243.310 2.105 20 0 BEADLO Cn1ncc(Cl)c1C[NH+]1CC2(CC(F)C2)C1 ZINC000656695222 411332504 /nfs/dbraw/zinc/33/25/04/411332504.db2.gz AEHNJZUBWINZKT-UHFFFAOYSA-N 1 2 243.713 2.007 20 0 BEADLO C[C@H](N[C@@H]1CCCn2cc[nH+]c21)C(F)(F)F ZINC000655767498 411249768 /nfs/dbraw/zinc/24/97/68/411249768.db2.gz GMASQPCKJZLBNG-JGVFFNPUSA-N 1 2 233.237 2.258 20 0 BEADLO Cc1ccoc1C[NH2+][C@H]1CCCn2ccnc21 ZINC000655769835 411252197 /nfs/dbraw/zinc/25/21/97/411252197.db2.gz POQCXAPHLXQOJG-NSHDSACASA-N 1 2 231.299 2.409 20 0 BEADLO CCc1ncc(C[NH2+][C@@H]2CCCn3ccnc32)o1 ZINC000655773950 411257151 /nfs/dbraw/zinc/25/71/51/411257151.db2.gz LUZCRFYEWDAJMK-LLVKDONJSA-N 1 2 246.314 2.058 20 0 BEADLO C=C/C(C)=C\CC(=O)NCc1[nH+]ccn1CC ZINC000653770459 411350294 /nfs/dbraw/zinc/35/02/94/411350294.db2.gz QUXXPSWZLBUQPS-WDZFZDKYSA-N 1 2 233.315 2.042 20 0 BEADLO C[N@H+](Cc1ccsc1Cl)C(C)(C)C(N)=O ZINC000660648938 411373259 /nfs/dbraw/zinc/37/32/59/411373259.db2.gz ZZOLOEISTKSMKG-UHFFFAOYSA-N 1 2 246.763 2.097 20 0 BEADLO C[N@@H+](Cc1ccsc1Cl)C(C)(C)C(N)=O ZINC000660648938 411373263 /nfs/dbraw/zinc/37/32/63/411373263.db2.gz ZZOLOEISTKSMKG-UHFFFAOYSA-N 1 2 246.763 2.097 20 0 BEADLO COCC[N@H+](CC(F)F)CC1CC=CC1 ZINC000659876973 411360652 /nfs/dbraw/zinc/36/06/52/411360652.db2.gz DALCDSQLKWPHGL-UHFFFAOYSA-N 1 2 219.275 2.166 20 0 BEADLO COCC[N@@H+](CC(F)F)CC1CC=CC1 ZINC000659876973 411360653 /nfs/dbraw/zinc/36/06/53/411360653.db2.gz DALCDSQLKWPHGL-UHFFFAOYSA-N 1 2 219.275 2.166 20 0 BEADLO CCCc1nnc(NCc2[nH+]ccn2C(C)C)o1 ZINC000656769734 411362984 /nfs/dbraw/zinc/36/29/84/411362984.db2.gz HMFYSCXQGZGFAI-UHFFFAOYSA-N 1 2 249.318 2.412 20 0 BEADLO Cc1ccc(NCc2cnn3c2CCC3)c[nH+]1 ZINC000656769737 411363419 /nfs/dbraw/zinc/36/34/19/411363419.db2.gz HOLMRZWDJCUTMQ-UHFFFAOYSA-N 1 2 228.299 2.145 20 0 BEADLO COc1cc[nH+]cc1NCc1nccn1C(C)C ZINC000656769945 411363570 /nfs/dbraw/zinc/36/35/70/411363570.db2.gz KODGUZLQAUOOCH-UHFFFAOYSA-N 1 2 246.314 2.480 20 0 BEADLO Cc1c[nH+]cc(NCc2cnn3c2CCC3)c1 ZINC000656771559 411364824 /nfs/dbraw/zinc/36/48/24/411364824.db2.gz HPEITHGPTCUXHR-UHFFFAOYSA-N 1 2 228.299 2.145 20 0 BEADLO CC1(C)C[C@@H]1C(=O)Nc1cccc2[nH+]ccn21 ZINC000269830970 167985516 /nfs/dbraw/zinc/98/55/16/167985516.db2.gz JKNZIESKRZAXAF-SECBINFHSA-N 1 2 229.283 2.319 20 0 BEADLO CC(C)c1nc(C[N@@H+]2CC[C@@H]3C[C@@H]3C2)no1 ZINC000661969150 411337721 /nfs/dbraw/zinc/33/77/21/411337721.db2.gz BXXBNBFMVDGIJM-NXEZZACHSA-N 1 2 221.304 2.035 20 0 BEADLO CC(C)c1nc(C[N@H+]2CC[C@@H]3C[C@@H]3C2)no1 ZINC000661969150 411337723 /nfs/dbraw/zinc/33/77/23/411337723.db2.gz BXXBNBFMVDGIJM-NXEZZACHSA-N 1 2 221.304 2.035 20 0 BEADLO CCn1cc([C@@H](C)[NH2+][C@@H](C)c2nccn2C)cn1 ZINC000658338476 411346191 /nfs/dbraw/zinc/34/61/91/411346191.db2.gz YXLYZNVCOHIKFQ-MNOVXSKESA-N 1 2 247.346 2.048 20 0 BEADLO CC1(C[N@@H+]2CCCC[C@H]2C(F)F)COC1 ZINC000337402378 168024664 /nfs/dbraw/zinc/02/46/64/168024664.db2.gz LGIQCXZMEGOAPY-VIFPVBQESA-N 1 2 219.275 2.143 20 0 BEADLO CC1(C[N@H+]2CCCC[C@H]2C(F)F)COC1 ZINC000337402378 168024668 /nfs/dbraw/zinc/02/46/68/168024668.db2.gz LGIQCXZMEGOAPY-VIFPVBQESA-N 1 2 219.275 2.143 20 0 BEADLO CC1=C(C)C[N@H+](Cc2csnn2)CC1 ZINC000280428000 168085787 /nfs/dbraw/zinc/08/57/87/168085787.db2.gz BRRHWUYICNDMIF-UHFFFAOYSA-N 1 2 209.318 2.080 20 0 BEADLO CC1=C(C)C[N@@H+](Cc2csnn2)CC1 ZINC000280428000 168085789 /nfs/dbraw/zinc/08/57/89/168085789.db2.gz BRRHWUYICNDMIF-UHFFFAOYSA-N 1 2 209.318 2.080 20 0 BEADLO CC1=CCC[N@@H+]([C@@H](C(N)=O)c2ccc(F)cc2)C1 ZINC000280809104 168098987 /nfs/dbraw/zinc/09/89/87/168098987.db2.gz LSUGLTQEGLXYFD-CYBMUJFWSA-N 1 2 248.301 2.004 20 0 BEADLO CC1=CCC[N@H+]([C@@H](C(N)=O)c2ccc(F)cc2)C1 ZINC000280809104 168098990 /nfs/dbraw/zinc/09/89/90/168098990.db2.gz LSUGLTQEGLXYFD-CYBMUJFWSA-N 1 2 248.301 2.004 20 0 BEADLO CC1=CCC[N@H+](Cc2nnc(C(C)(C)C)[nH]2)C1 ZINC000293020041 168099737 /nfs/dbraw/zinc/09/97/37/168099737.db2.gz VHYNMAJBQSOWIK-UHFFFAOYSA-N 1 2 234.347 2.254 20 0 BEADLO CC1=CCC[N@@H+](Cc2nnc(C(C)(C)C)[nH]2)C1 ZINC000293020041 168099739 /nfs/dbraw/zinc/09/97/39/168099739.db2.gz VHYNMAJBQSOWIK-UHFFFAOYSA-N 1 2 234.347 2.254 20 0 BEADLO CC1=CCC[N@@H+](Cc2cn(C(C)C)nn2)C1 ZINC000289787250 168099882 /nfs/dbraw/zinc/09/98/82/168099882.db2.gz RRCKBJDFLKPSDH-UHFFFAOYSA-N 1 2 220.320 2.011 20 0 BEADLO CC1=CCC[N@H+](Cc2cn(C(C)C)nn2)C1 ZINC000289787250 168099883 /nfs/dbraw/zinc/09/98/83/168099883.db2.gz RRCKBJDFLKPSDH-UHFFFAOYSA-N 1 2 220.320 2.011 20 0 BEADLO CC1=CCC[N@@H+](Cc2nnc(C(C)C)o2)C1 ZINC000280722825 168100200 /nfs/dbraw/zinc/10/02/00/168100200.db2.gz FYIYLTQFTFPAHJ-UHFFFAOYSA-N 1 2 221.304 2.345 20 0 BEADLO CC1=CCC[N@H+](Cc2nnc(C(C)C)o2)C1 ZINC000280722825 168100204 /nfs/dbraw/zinc/10/02/04/168100204.db2.gz FYIYLTQFTFPAHJ-UHFFFAOYSA-N 1 2 221.304 2.345 20 0 BEADLO CC1=CCC[C@@H](C)[C@H]1C[N@H+](C)Cc1nnc[nH]1 ZINC000191074478 168102107 /nfs/dbraw/zinc/10/21/07/168102107.db2.gz VXBFXEZHMLBRDA-NEPJUHHUSA-N 1 2 234.347 2.229 20 0 BEADLO CC1=CCC[C@@H](C)[C@H]1C[N@@H+](C)Cc1nnc[nH]1 ZINC000191074478 168102109 /nfs/dbraw/zinc/10/21/09/168102109.db2.gz VXBFXEZHMLBRDA-NEPJUHHUSA-N 1 2 234.347 2.229 20 0 BEADLO CC1=CC[N@H+](Cc2cn(C(C)C)nn2)CC1 ZINC000289588628 168114651 /nfs/dbraw/zinc/11/46/51/168114651.db2.gz HVBDRPJDQTVOAM-UHFFFAOYSA-N 1 2 220.320 2.011 20 0 BEADLO CC1=CC[N@@H+](Cc2cn(C(C)C)nn2)CC1 ZINC000289588628 168114654 /nfs/dbraw/zinc/11/46/54/168114654.db2.gz HVBDRPJDQTVOAM-UHFFFAOYSA-N 1 2 220.320 2.011 20 0 BEADLO CCC(=CC(=O)N1CCn2cc(C)[nH+]c2C1)CC ZINC000374666595 168192291 /nfs/dbraw/zinc/19/22/91/168192291.db2.gz XTJXUCCAECVCLH-UHFFFAOYSA-N 1 2 247.342 2.280 20 0 BEADLO CCC(=CC(=O)NCc1[nH]c[nH+]c1C)CC ZINC000268305250 168194231 /nfs/dbraw/zinc/19/42/31/168194231.db2.gz ZOAYUCXXGATYIE-UHFFFAOYSA-N 1 2 221.304 2.081 20 0 BEADLO CCC(C)(C)C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000335158489 168267262 /nfs/dbraw/zinc/26/72/62/168267262.db2.gz ZHDDUSZYVNPYSD-NXEZZACHSA-N 1 2 235.331 2.441 20 0 BEADLO CCC(C)(C)C(=O)Nc1ccc(N)[nH+]c1 ZINC000061680244 168268695 /nfs/dbraw/zinc/26/86/95/168268695.db2.gz HDOWRXVKMVINDE-UHFFFAOYSA-N 1 2 207.277 2.039 20 0 BEADLO CCC(C)(CC)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000276657949 168306977 /nfs/dbraw/zinc/30/69/77/168306977.db2.gz XLFTVNNNGVGACM-VOTSOKGWSA-N 1 2 221.304 2.118 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)NC(C)(C)C1CC1 ZINC000492457052 411399330 /nfs/dbraw/zinc/39/93/30/411399330.db2.gz MSNGZJSKXWAXBN-FPLPWBNLSA-N 1 2 247.342 2.221 20 0 BEADLO Cc1c[nH+]c(C)c(NCc2nccn2C)c1 ZINC000404536413 411400304 /nfs/dbraw/zinc/40/03/04/411400304.db2.gz CNXNZGJIDSOLFR-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO Nc1ccc(NC(=O)[C@@H]2C[C@@H]2C2CCCC2)c[nH+]1 ZINC000653048575 411403993 /nfs/dbraw/zinc/40/39/93/411403993.db2.gz JMFZDCPAGSIZNW-VXGBXAGGSA-N 1 2 245.326 2.259 20 0 BEADLO OC1(CC[N@@H+]2CCCC(F)(F)C2)CCC1 ZINC000405126394 411418467 /nfs/dbraw/zinc/41/84/67/411418467.db2.gz ZHZBLRVPFTWPSG-UHFFFAOYSA-N 1 2 219.275 2.023 20 0 BEADLO OC1(CC[N@H+]2CCCC(F)(F)C2)CCC1 ZINC000405126394 411418470 /nfs/dbraw/zinc/41/84/70/411418470.db2.gz ZHZBLRVPFTWPSG-UHFFFAOYSA-N 1 2 219.275 2.023 20 0 BEADLO CC(C)(C)c1ncc(C[NH2+]Cc2ccno2)cn1 ZINC000306056601 411432258 /nfs/dbraw/zinc/43/22/58/411432258.db2.gz RFQRWQYZMRXIGX-UHFFFAOYSA-N 1 2 246.314 2.052 20 0 BEADLO CCc1nnc(SCc2c[nH+]cn2C)s1 ZINC000657273461 411437240 /nfs/dbraw/zinc/43/72/40/411437240.db2.gz ZVKSLHDIJGGPHD-UHFFFAOYSA-N 1 2 240.357 2.126 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C3CC3)no2)CCO1 ZINC000659837708 411470265 /nfs/dbraw/zinc/47/02/65/411470265.db2.gz HXETVEJLAIISPC-LLVKDONJSA-N 1 2 236.315 2.163 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C3CC3)no2)CCO1 ZINC000659837708 411470268 /nfs/dbraw/zinc/47/02/68/411470268.db2.gz HXETVEJLAIISPC-LLVKDONJSA-N 1 2 236.315 2.163 20 0 BEADLO Cc1[nH]c(CNc2cnn(C(C)C)c2)[nH+]c1C ZINC000657344284 411470910 /nfs/dbraw/zinc/47/09/10/411470910.db2.gz KHCHWCYSTNDMBB-UHFFFAOYSA-N 1 2 233.319 2.416 20 0 BEADLO Cc1c[nH]c(CNc2cnn(C(C)C)c2)[nH+]1 ZINC000657344322 411471030 /nfs/dbraw/zinc/47/10/30/411471030.db2.gz LNEPJOHOAIERLC-UHFFFAOYSA-N 1 2 219.292 2.108 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@@H]2CF)cs1 ZINC000293056275 411471535 /nfs/dbraw/zinc/47/15/35/411471535.db2.gz NGORPUIIVXKIHF-SNVBAGLBSA-N 1 2 214.309 2.385 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@@H]2CF)cs1 ZINC000293056275 411471538 /nfs/dbraw/zinc/47/15/38/411471538.db2.gz NGORPUIIVXKIHF-SNVBAGLBSA-N 1 2 214.309 2.385 20 0 BEADLO CC(C)n1ccnc1C[NH2+]Cc1cccc(O)c1 ZINC000657341106 411473232 /nfs/dbraw/zinc/47/32/32/411473232.db2.gz LPDZRDQOLPBJGP-UHFFFAOYSA-N 1 2 245.326 2.459 20 0 BEADLO CC[N@H+](Cc1cnn(C)c1)Cc1nc(C)oc1C ZINC000659868157 411483037 /nfs/dbraw/zinc/48/30/37/411483037.db2.gz NILYXNOUTMMPBC-UHFFFAOYSA-N 1 2 248.330 2.047 20 0 BEADLO CC[N@@H+](Cc1cnn(C)c1)Cc1nc(C)oc1C ZINC000659868157 411483039 /nfs/dbraw/zinc/48/30/39/411483039.db2.gz NILYXNOUTMMPBC-UHFFFAOYSA-N 1 2 248.330 2.047 20 0 BEADLO CC[C@H](NCc1[nH]cc(C)[nH+]1)c1nccs1 ZINC000657371831 411484436 /nfs/dbraw/zinc/48/44/36/411484436.db2.gz WXHAWGDORYFDOC-VIFPVBQESA-N 1 2 236.344 2.416 20 0 BEADLO COCC[N@H+](CC(F)F)C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000659876947 411486835 /nfs/dbraw/zinc/48/68/35/411486835.db2.gz CMOFCCAGUUTBHN-JGPRNRPPSA-N 1 2 233.302 2.246 20 0 BEADLO COCC[N@@H+](CC(F)F)C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000659876947 411486838 /nfs/dbraw/zinc/48/68/38/411486838.db2.gz CMOFCCAGUUTBHN-JGPRNRPPSA-N 1 2 233.302 2.246 20 0 BEADLO c1csc([C@H]2CCC[N@H+]2CCc2cnn[nH]2)c1 ZINC000647955546 411495979 /nfs/dbraw/zinc/49/59/79/411495979.db2.gz JDDWKDIBKMLVTA-LLVKDONJSA-N 1 2 248.355 2.246 20 0 BEADLO c1csc([C@H]2CCC[N@@H+]2CCc2cnn[nH]2)c1 ZINC000647955546 411495981 /nfs/dbraw/zinc/49/59/81/411495981.db2.gz JDDWKDIBKMLVTA-LLVKDONJSA-N 1 2 248.355 2.246 20 0 BEADLO Cc1c[nH]c(CNc2ccc(C)nc2)[nH+]1 ZINC000657402497 411496058 /nfs/dbraw/zinc/49/60/58/411496058.db2.gz GRACSNCNXDTCAW-UHFFFAOYSA-N 1 2 202.261 2.034 20 0 BEADLO CSc1ccncc1NCc1[nH]cc(C)[nH+]1 ZINC000657412916 411497252 /nfs/dbraw/zinc/49/72/52/411497252.db2.gz KNCXWCRMAGBZIR-UHFFFAOYSA-N 1 2 234.328 2.447 20 0 BEADLO COCc1ccccc1NCc1[nH]cc(C)[nH+]1 ZINC000657405105 411497513 /nfs/dbraw/zinc/49/75/13/411497513.db2.gz AVCLEJUYXIKXIW-UHFFFAOYSA-N 1 2 231.299 2.477 20 0 BEADLO CCn1nc(C)c(NCc2[nH]cc(C)[nH+]2)c1C ZINC000657413228 411500073 /nfs/dbraw/zinc/50/00/73/411500073.db2.gz JZMHIWIZRUCBHT-UHFFFAOYSA-N 1 2 233.319 2.163 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1cc(C2CC2)no1 ZINC000659935192 411503231 /nfs/dbraw/zinc/50/32/31/411503231.db2.gz WQPLHLWNVAPSHF-LLVKDONJSA-N 1 2 236.315 2.163 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1cc(C2CC2)no1 ZINC000659935192 411503233 /nfs/dbraw/zinc/50/32/33/411503233.db2.gz WQPLHLWNVAPSHF-LLVKDONJSA-N 1 2 236.315 2.163 20 0 BEADLO Cc1c(NCc2[nH+]ccn2C(C)C)cnn1C ZINC000657426970 411503721 /nfs/dbraw/zinc/50/37/21/411503721.db2.gz NRTOSQGLQYEBJI-UHFFFAOYSA-N 1 2 233.319 2.118 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC1CC2(CCC2)C1 ZINC000655166587 411508745 /nfs/dbraw/zinc/50/87/45/411508745.db2.gz FEBMIARDFOFSBG-SNVBAGLBSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC1CC2(CCC2)C1 ZINC000655166587 411508749 /nfs/dbraw/zinc/50/87/49/411508749.db2.gz FEBMIARDFOFSBG-SNVBAGLBSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NC1CC2(CCC2)C1 ZINC000655166586 411508933 /nfs/dbraw/zinc/50/89/33/411508933.db2.gz FEBMIARDFOFSBG-JTQLQIEISA-N 1 2 247.342 2.037 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NC1CC2(CCC2)C1 ZINC000655166586 411508934 /nfs/dbraw/zinc/50/89/34/411508934.db2.gz FEBMIARDFOFSBG-JTQLQIEISA-N 1 2 247.342 2.037 20 0 BEADLO CCC[C@]1(C)CCC[N@H+](CCc2cnn[nH]2)C1 ZINC000659970983 411513188 /nfs/dbraw/zinc/51/31/88/411513188.db2.gz MBQUNQJQVKWCIV-CYBMUJFWSA-N 1 2 236.363 2.249 20 0 BEADLO CCC[C@]1(C)CCC[N@@H+](CCc2cnn[nH]2)C1 ZINC000659970983 411513190 /nfs/dbraw/zinc/51/31/90/411513190.db2.gz MBQUNQJQVKWCIV-CYBMUJFWSA-N 1 2 236.363 2.249 20 0 BEADLO Cc1nc(C[N@@H+]2CCOC3(CCCC3)C2)co1 ZINC000660010919 411528070 /nfs/dbraw/zinc/52/80/70/411528070.db2.gz MQNUWTDQLBEOCG-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO Cc1nc(C[N@H+]2CCOC3(CCCC3)C2)co1 ZINC000660010919 411528073 /nfs/dbraw/zinc/52/80/73/411528073.db2.gz MQNUWTDQLBEOCG-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO Cc1[nH]c(CN[C@H]2C[C@H](C)n3ccnc32)[nH+]c1C ZINC000657483606 411528695 /nfs/dbraw/zinc/52/86/95/411528695.db2.gz MIZNYYPUSWIXBF-KWQFWETISA-N 1 2 245.330 2.019 20 0 BEADLO CCn1cc([C@@H](C)[NH2+]Cc2nc(C)c(C)[nH]2)cn1 ZINC000657485050 411530234 /nfs/dbraw/zinc/53/02/34/411530234.db2.gz JRHYIZCKUUHNCJ-LLVKDONJSA-N 1 2 247.346 2.094 20 0 BEADLO CCn1cc([C@@H](C)NCc2[nH]c(C)c(C)[nH+]2)cn1 ZINC000657485050 411530236 /nfs/dbraw/zinc/53/02/36/411530236.db2.gz JRHYIZCKUUHNCJ-LLVKDONJSA-N 1 2 247.346 2.094 20 0 BEADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)on1 ZINC000660032794 411530381 /nfs/dbraw/zinc/53/03/81/411530381.db2.gz SEKBVADTDOIJMY-GFCCVEGCSA-N 1 2 247.298 2.348 20 0 BEADLO COc1cc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)on1 ZINC000660032794 411530384 /nfs/dbraw/zinc/53/03/84/411530384.db2.gz SEKBVADTDOIJMY-GFCCVEGCSA-N 1 2 247.298 2.348 20 0 BEADLO CC[N@@H+]1C[C@H]([NH2+]CCC2(C)CC2)[C@@H](C)C1 ZINC000309044326 170035452 /nfs/dbraw/zinc/03/54/52/170035452.db2.gz NJBZITMIXGEEKS-RYUDHWBXSA-N 1 2 210.365 2.106 20 0 BEADLO CC[N@@H+]1C[C@H]([NH2+]C[C@@H](C)C(F)(F)F)[C@@H](C)C1 ZINC000309959445 170036019 /nfs/dbraw/zinc/03/60/19/170036019.db2.gz KHOIVUJNWKVACA-AEJSXWLSSA-N 1 2 238.297 2.115 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccnc2)nc(C)n1 ZINC000660124891 411541231 /nfs/dbraw/zinc/54/12/31/411541231.db2.gz DONRBMDUUSCDJA-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccnc2)nc(C)n1 ZINC000660124891 411541233 /nfs/dbraw/zinc/54/12/33/411541233.db2.gz DONRBMDUUSCDJA-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO CCNC(=O)NCCC[N@H+](CC)c1ccccc1 ZINC000061743355 170079175 /nfs/dbraw/zinc/07/91/75/170079175.db2.gz SBIJBBWLBMYUEQ-UHFFFAOYSA-N 1 2 249.358 2.222 20 0 BEADLO CCNC(=O)NCCC[N@@H+](CC)c1ccccc1 ZINC000061743355 170079177 /nfs/dbraw/zinc/07/91/77/170079177.db2.gz SBIJBBWLBMYUEQ-UHFFFAOYSA-N 1 2 249.358 2.222 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@H]2C[C@@]2(F)c2ccccc2)n1 ZINC000657496350 411535693 /nfs/dbraw/zinc/53/56/93/411535693.db2.gz RVOAZZLXMBNMBN-GXTWGEPZSA-N 1 2 245.301 2.445 20 0 BEADLO CCc1ccc(C[NH2+][C@H]2C[C@H](C)n3ncnc32)o1 ZINC000657567842 411553111 /nfs/dbraw/zinc/55/31/11/411553111.db2.gz FOIHNCMCMIXVQK-CABZTGNLSA-N 1 2 246.314 2.229 20 0 BEADLO Cc1cc(C[NH2+][C@H]2C[C@H](C)n3ncnc32)cs1 ZINC000657568415 411553140 /nfs/dbraw/zinc/55/31/40/411553140.db2.gz GFNIJYQKJBGIGX-KWQFWETISA-N 1 2 248.355 2.444 20 0 BEADLO C[C@H]1C[C@@H]([NH2+]Cc2cccc(F)c2)c2ncnn21 ZINC000657567095 411553225 /nfs/dbraw/zinc/55/32/25/411553225.db2.gz JEGJOYNMQFLPMQ-JOYOIKCWSA-N 1 2 246.289 2.213 20 0 BEADLO CO[C@@H](C[N@@H+]1CCC(F)(F)C1)C1CCC1 ZINC000660215693 411554696 /nfs/dbraw/zinc/55/46/96/411554696.db2.gz RJFKRUVFJJCIAA-JTQLQIEISA-N 1 2 219.275 2.143 20 0 BEADLO CO[C@@H](C[N@H+]1CCC(F)(F)C1)C1CCC1 ZINC000660215693 411554698 /nfs/dbraw/zinc/55/46/98/411554698.db2.gz RJFKRUVFJJCIAA-JTQLQIEISA-N 1 2 219.275 2.143 20 0 BEADLO c1[nH+]cc(N[C@@H]2CCOC2)c2c1CCCC2 ZINC000657532488 411545185 /nfs/dbraw/zinc/54/51/85/411545185.db2.gz AIZMERORNQITMZ-LLVKDONJSA-N 1 2 218.300 2.161 20 0 BEADLO CCNc1nc(C)[nH+]c2ccc(OC)cc21 ZINC000301922000 170176292 /nfs/dbraw/zinc/17/62/92/170176292.db2.gz FZDCRENALGIMJA-UHFFFAOYSA-N 1 2 217.272 2.379 20 0 BEADLO CCOC(=O)C[NH2+][C@H]1CCC[C@H]1c1ccccc1 ZINC000133497655 170227096 /nfs/dbraw/zinc/22/70/96/170227096.db2.gz LJMKGKDCPHFXQJ-KBPBESRZSA-N 1 2 247.338 2.475 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@@H](OC(F)F)C2)co1 ZINC000660235530 411557031 /nfs/dbraw/zinc/55/70/31/411557031.db2.gz GUEPHSOZXFQBFL-SNVBAGLBSA-N 1 2 246.257 2.187 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@@H](OC(F)F)C2)co1 ZINC000660235530 411557032 /nfs/dbraw/zinc/55/70/32/411557032.db2.gz GUEPHSOZXFQBFL-SNVBAGLBSA-N 1 2 246.257 2.187 20 0 BEADLO Fc1cccc(C(F)(F)C[NH2+][C@@H]2CCOC2)c1 ZINC000657584896 411557243 /nfs/dbraw/zinc/55/72/43/411557243.db2.gz ZOSQTZKLQIFTSG-LLVKDONJSA-N 1 2 245.244 2.296 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+](C)Cc1cccs1 ZINC000041392523 170247281 /nfs/dbraw/zinc/24/72/81/170247281.db2.gz VKCPAIGQOQDPBX-SECBINFHSA-N 1 2 227.329 2.132 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+](C)Cc1cccs1 ZINC000041392523 170247283 /nfs/dbraw/zinc/24/72/83/170247283.db2.gz VKCPAIGQOQDPBX-SECBINFHSA-N 1 2 227.329 2.132 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+]1CCc2cc(C)ccc2C1 ZINC000361850591 170267406 /nfs/dbraw/zinc/26/74/06/170267406.db2.gz RNTHOZJZEMJHMR-LBPRGKRZSA-N 1 2 247.338 2.305 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+]1CCc2cc(C)ccc2C1 ZINC000361850591 170267407 /nfs/dbraw/zinc/26/74/07/170267407.db2.gz RNTHOZJZEMJHMR-LBPRGKRZSA-N 1 2 247.338 2.305 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+]Cc1cccc(C)c1C ZINC000043314336 170268240 /nfs/dbraw/zinc/26/82/40/170268240.db2.gz XCVHZPQSYVMOII-LBPRGKRZSA-N 1 2 235.327 2.345 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+]Cc1cccc2cc[nH]c21 ZINC000083375268 170268788 /nfs/dbraw/zinc/26/87/88/170268788.db2.gz GMXANTLIYPEVLO-JTQLQIEISA-N 1 2 246.310 2.209 20 0 BEADLO CC(C)=CCC[N@@H+]1CC(F)(F)C[C@@H]1CO ZINC000660369291 411573408 /nfs/dbraw/zinc/57/34/08/411573408.db2.gz QOTNPEXNNGRYTO-SNVBAGLBSA-N 1 2 219.275 2.045 20 0 BEADLO CC(C)=CCC[N@H+]1CC(F)(F)C[C@@H]1CO ZINC000660369291 411573410 /nfs/dbraw/zinc/57/34/10/411573410.db2.gz QOTNPEXNNGRYTO-SNVBAGLBSA-N 1 2 219.275 2.045 20 0 BEADLO CCOC1CC(C(=O)Nc2cc[nH+]cc2CC)C1 ZINC000290181519 170322830 /nfs/dbraw/zinc/32/28/30/170322830.db2.gz RYLUEWKYXMCQMZ-UHFFFAOYSA-N 1 2 248.326 2.398 20 0 BEADLO CCOC1C[NH+](Cc2cccc(F)c2)C1 ZINC000297458344 170336660 /nfs/dbraw/zinc/33/66/60/170336660.db2.gz PWTCAHXEHKQOGN-UHFFFAOYSA-N 1 2 209.264 2.046 20 0 BEADLO CCOC1C[NH+](Cc2ccsc2C)C1 ZINC000297536425 170336672 /nfs/dbraw/zinc/33/66/72/170336672.db2.gz YCZNHCWVGGRKNU-UHFFFAOYSA-N 1 2 211.330 2.277 20 0 BEADLO CCOCC(C)(C)[NH2+]Cc1noc(C(C)C)n1 ZINC000339372266 170356272 /nfs/dbraw/zinc/35/62/72/170356272.db2.gz MVZVZZBORYSDRY-UHFFFAOYSA-N 1 2 241.335 2.098 20 0 BEADLO CCOCCCC(=O)Nc1cccc2[nH+]ccn21 ZINC000266150234 170366844 /nfs/dbraw/zinc/36/68/44/170366844.db2.gz KEQBRZCUEQILBG-UHFFFAOYSA-N 1 2 247.298 2.090 20 0 BEADLO CCOCC[N@H+](C)Cc1ncc(CC)s1 ZINC000175502519 170390934 /nfs/dbraw/zinc/39/09/34/170390934.db2.gz UPHALNQMUJGSLP-UHFFFAOYSA-N 1 2 228.361 2.174 20 0 BEADLO CCOCC[N@@H+](C)Cc1ncc(CC)s1 ZINC000175502519 170390936 /nfs/dbraw/zinc/39/09/36/170390936.db2.gz UPHALNQMUJGSLP-UHFFFAOYSA-N 1 2 228.361 2.174 20 0 BEADLO CCOCC[N@H+](C)Cc1nc(C)sc1C ZINC000357529192 170390996 /nfs/dbraw/zinc/39/09/96/170390996.db2.gz MHYZMKKIVXNJFP-UHFFFAOYSA-N 1 2 228.361 2.228 20 0 BEADLO CCOCC[N@@H+](C)Cc1nc(C)sc1C ZINC000357529192 170390998 /nfs/dbraw/zinc/39/09/98/170390998.db2.gz MHYZMKKIVXNJFP-UHFFFAOYSA-N 1 2 228.361 2.228 20 0 BEADLO CCOCC[N@H+](CC(F)F)CC1CCC1 ZINC000341755084 170392996 /nfs/dbraw/zinc/39/29/96/170392996.db2.gz CUINJQYQZFYPFF-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO CCOCC[N@@H+](CC(F)F)CC1CCC1 ZINC000341755084 170392997 /nfs/dbraw/zinc/39/29/97/170392997.db2.gz CUINJQYQZFYPFF-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO C[C@@H]([NH2+]Cc1cc(C2CC2)no1)c1ccn(C)n1 ZINC000660778627 411627512 /nfs/dbraw/zinc/62/75/12/411627512.db2.gz FZLBZQDTFKYYIU-SECBINFHSA-N 1 2 246.314 2.136 20 0 BEADLO CCc1nocc1C[N@@H+]1CCC(=O)CC12CCC2 ZINC000660821695 411646762 /nfs/dbraw/zinc/64/67/62/411646762.db2.gz ZMUMURHAEWADPO-UHFFFAOYSA-N 1 2 248.326 2.325 20 0 BEADLO CCc1nocc1C[N@H+]1CCC(=O)CC12CCC2 ZINC000660821695 411646764 /nfs/dbraw/zinc/64/67/64/411646764.db2.gz ZMUMURHAEWADPO-UHFFFAOYSA-N 1 2 248.326 2.325 20 0 BEADLO Cc1nocc1C[N@@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000660428499 411583458 /nfs/dbraw/zinc/58/34/58/411583458.db2.gz DDHQGDUTRWRPII-GFCCVEGCSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1nocc1C[N@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000660428499 411583460 /nfs/dbraw/zinc/58/34/60/411583460.db2.gz DDHQGDUTRWRPII-GFCCVEGCSA-N 1 2 232.287 2.043 20 0 BEADLO c1cc([C@H]2CCC[N@H+]2Cc2cncs2)n[nH]1 ZINC000660431750 411584423 /nfs/dbraw/zinc/58/44/23/411584423.db2.gz LWTZJQKBIGCOKN-LLVKDONJSA-N 1 2 234.328 2.203 20 0 BEADLO c1cc([C@H]2CCC[N@@H+]2Cc2cncs2)n[nH]1 ZINC000660431750 411584425 /nfs/dbraw/zinc/58/44/25/411584425.db2.gz LWTZJQKBIGCOKN-LLVKDONJSA-N 1 2 234.328 2.203 20 0 BEADLO OCC[N@H+](CCCC1CCC1)CC(F)F ZINC000660451749 411586505 /nfs/dbraw/zinc/58/65/05/411586505.db2.gz GCMQWNHWOXSMNN-UHFFFAOYSA-N 1 2 221.291 2.126 20 0 BEADLO OCC[N@@H+](CCCC1CCC1)CC(F)F ZINC000660451749 411586506 /nfs/dbraw/zinc/58/65/06/411586506.db2.gz GCMQWNHWOXSMNN-UHFFFAOYSA-N 1 2 221.291 2.126 20 0 BEADLO Cc1[nH]ncc1C[NH2+]C[C@H]1C(C)(C)C1(F)F ZINC000657736921 411588041 /nfs/dbraw/zinc/58/80/41/411588041.db2.gz GYHFVHLLOTXCFD-VIFPVBQESA-N 1 2 229.274 2.099 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@H](OC(F)F)C2)c(C)o1 ZINC000660489941 411593873 /nfs/dbraw/zinc/59/38/73/411593873.db2.gz SQMVDDHEGFRIBS-VIFPVBQESA-N 1 2 246.257 2.105 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@H](OC(F)F)C2)c(C)o1 ZINC000660489941 411593875 /nfs/dbraw/zinc/59/38/75/411593875.db2.gz SQMVDDHEGFRIBS-VIFPVBQESA-N 1 2 246.257 2.105 20 0 BEADLO CC(C)n1nccc1C[NH2+][C@@H](C)c1nccn1C ZINC000657792466 411598055 /nfs/dbraw/zinc/59/80/55/411598055.db2.gz BUIWMAKCGUDWCI-NSHDSACASA-N 1 2 247.346 2.048 20 0 BEADLO Cc1nn(C)cc1C[NH2+]CC(F)(F)C(C)(C)C ZINC000657793297 411599165 /nfs/dbraw/zinc/59/91/65/411599165.db2.gz JLFNGALQZMHOMB-UHFFFAOYSA-N 1 2 245.317 2.500 20 0 BEADLO CC(C)n1cc(C[NH2+][C@@H](C)c2nccn2C)cn1 ZINC000657794787 411599418 /nfs/dbraw/zinc/59/94/18/411599418.db2.gz WMUXITXXMTZHDZ-NSHDSACASA-N 1 2 247.346 2.048 20 0 BEADLO COc1cc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)on1 ZINC000660567577 411601822 /nfs/dbraw/zinc/60/18/22/411601822.db2.gz XHKHLGFQYDQPMU-QMMMGPOBSA-N 1 2 246.257 2.160 20 0 BEADLO COc1cc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)on1 ZINC000660567577 411601823 /nfs/dbraw/zinc/60/18/23/411601823.db2.gz XHKHLGFQYDQPMU-QMMMGPOBSA-N 1 2 246.257 2.160 20 0 BEADLO CC(C)(C)c1nnc(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)[nH]1 ZINC000660934624 411684100 /nfs/dbraw/zinc/68/41/00/411684100.db2.gz UCQCQNRHXXGNSI-QWRGUYRKSA-N 1 2 248.374 2.477 20 0 BEADLO CC(C)(C)c1nnc(C[N@H+]2C[C@@H]3CCCC[C@@H]32)[nH]1 ZINC000660934624 411684102 /nfs/dbraw/zinc/68/41/02/411684102.db2.gz UCQCQNRHXXGNSI-QWRGUYRKSA-N 1 2 248.374 2.477 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)Cc1ccc(Cl)cn1 ZINC000661088447 411699990 /nfs/dbraw/zinc/69/99/90/411699990.db2.gz IFJCYXJDAJCLIV-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO CO[C@H](C[N@H+](C)Cc1cnc[nH]1)c1ccccc1 ZINC000661091552 411703166 /nfs/dbraw/zinc/70/31/66/411703166.db2.gz ZNUZRDHXPONGIP-CQSZACIVSA-N 1 2 245.326 2.229 20 0 BEADLO CO[C@H](C[N@@H+](C)Cc1cnc[nH]1)c1ccccc1 ZINC000661091552 411703169 /nfs/dbraw/zinc/70/31/69/411703169.db2.gz ZNUZRDHXPONGIP-CQSZACIVSA-N 1 2 245.326 2.229 20 0 BEADLO CCCc1nsc(NCc2ccc[nH+]c2N)n1 ZINC000663962096 411792644 /nfs/dbraw/zinc/79/26/44/411792644.db2.gz KPKFSFPAGHYLRS-UHFFFAOYSA-N 1 2 249.343 2.080 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](Cc1ccn(C)n1)CC2 ZINC000661371045 411756841 /nfs/dbraw/zinc/75/68/41/411756841.db2.gz AREFUOCXDNSILQ-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](Cc1ccn(C)n1)CC2 ZINC000661371045 411756844 /nfs/dbraw/zinc/75/68/44/411756844.db2.gz AREFUOCXDNSILQ-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO OCC[N@@H+]1CCc2ccc(Cl)c(Cl)c2C1 ZINC000661373242 411759154 /nfs/dbraw/zinc/75/91/54/411759154.db2.gz MZHYDORFGRQXQW-UHFFFAOYSA-N 1 2 246.137 2.344 20 0 BEADLO OCC[N@H+]1CCc2ccc(Cl)c(Cl)c2C1 ZINC000661373242 411759156 /nfs/dbraw/zinc/75/91/56/411759156.db2.gz MZHYDORFGRQXQW-UHFFFAOYSA-N 1 2 246.137 2.344 20 0 BEADLO O[C@H]1CC[N@H+](CC23CCC(CC2)C3)CC1(F)F ZINC000661407547 411768560 /nfs/dbraw/zinc/76/85/60/411768560.db2.gz NBILAGVCMKZWEE-CXQJBGSLSA-N 1 2 245.313 2.269 20 0 BEADLO O[C@H]1CC[N@@H+](CC23CCC(CC2)C3)CC1(F)F ZINC000661407547 411768564 /nfs/dbraw/zinc/76/85/64/411768564.db2.gz NBILAGVCMKZWEE-CXQJBGSLSA-N 1 2 245.313 2.269 20 0 BEADLO C[C@@H](Nc1ccnc(C2CC2)n1)c1[nH]cc[nH+]1 ZINC000663929777 411778875 /nfs/dbraw/zinc/77/88/75/411778875.db2.gz LRUHVCAQDNGHIP-MRVPVSSYSA-N 1 2 229.287 2.250 20 0 BEADLO Cc1nocc1C[N@H+]1CC2(CCC2)OC[C@@H]1C ZINC000661464043 411782128 /nfs/dbraw/zinc/78/21/28/411782128.db2.gz XEEATVFOAJFIFP-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO Cc1nocc1C[N@@H+]1CC2(CCC2)OC[C@@H]1C ZINC000661464043 411782130 /nfs/dbraw/zinc/78/21/30/411782130.db2.gz XEEATVFOAJFIFP-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO C[C@H]1CN(c2cc[nH+]c(C3CC3)n2)[C@H]1C ZINC000663946695 411786322 /nfs/dbraw/zinc/78/63/22/411786322.db2.gz LNKQVORRGQQBQR-IUCAKERBSA-N 1 2 203.289 2.199 20 0 BEADLO Cc1nnc(C[N@H+](C)CCCOC(C)(C)C)o1 ZINC000661530814 411795590 /nfs/dbraw/zinc/79/55/90/411795590.db2.gz XVIAAZGRZUTJTA-UHFFFAOYSA-N 1 2 241.335 2.015 20 0 BEADLO Cc1nnc(C[N@@H+](C)CCCOC(C)(C)C)o1 ZINC000661530814 411795594 /nfs/dbraw/zinc/79/55/94/411795594.db2.gz XVIAAZGRZUTJTA-UHFFFAOYSA-N 1 2 241.335 2.015 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)Nc1ncc(C)cn1 ZINC000663975418 411798396 /nfs/dbraw/zinc/79/83/96/411798396.db2.gz QFZXBJOFUATENT-SNVBAGLBSA-N 1 2 231.303 2.175 20 0 BEADLO C[C@@H](c1ccccn1)[NH+]1C[C@@H](C)C(=O)[C@H](C)C1 ZINC000661544520 411799140 /nfs/dbraw/zinc/79/91/40/411799140.db2.gz DXCBTMHZGKCHKB-UTUOFQBUSA-N 1 2 232.327 2.300 20 0 BEADLO C[C@@H](c1cccnc1)[NH+]1C[C@@H](C)C(=O)[C@H](C)C1 ZINC000661552035 411801597 /nfs/dbraw/zinc/80/15/97/411801597.db2.gz YXBRBOOVDLVOJB-UTUOFQBUSA-N 1 2 232.327 2.300 20 0 BEADLO Cc1ccc(CCNc2ccc(C)nn2)[nH+]c1 ZINC000663993130 411805242 /nfs/dbraw/zinc/80/52/42/411805242.db2.gz HYWWQKSKEWVLTF-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO CNc1[nH+]cnc2c1cnn2CCCC1CCC1 ZINC000664000277 411809682 /nfs/dbraw/zinc/80/96/82/411809682.db2.gz RBELWHOJMSOKDC-UHFFFAOYSA-N 1 2 245.330 2.448 20 0 BEADLO Cc1cn(Cc2ccc(C(C)C)[nH+]c2C)nn1 ZINC000664084121 411847215 /nfs/dbraw/zinc/84/72/15/411847215.db2.gz NQUACRZFOGOCJC-UHFFFAOYSA-N 1 2 230.315 2.462 20 0 BEADLO OC/C=C\CNc1cc(C(F)(F)F)cc[nH+]1 ZINC000664235897 411892224 /nfs/dbraw/zinc/89/22/24/411892224.db2.gz KQNIXMPSYKTNHD-UPHRSURJSA-N 1 2 232.205 2.061 20 0 BEADLO C[C@H]1CCC[C@H](CNc2cccc[nH+]2)O1 ZINC000664392843 411938849 /nfs/dbraw/zinc/93/88/49/411938849.db2.gz LDSANZMAKLZKNE-WDEREUQCSA-N 1 2 206.289 2.451 20 0 BEADLO Cc1cc(NC[C@H]2CCC[C@@H](C)O2)nc[nH+]1 ZINC000664395837 411940919 /nfs/dbraw/zinc/94/09/19/411940919.db2.gz SSGKKQMTRBOZRV-GHMZBOCLSA-N 1 2 221.304 2.155 20 0 BEADLO COC1CC(CCNc2cc(C)[nH+]cn2)C1 ZINC000664141353 411869688 /nfs/dbraw/zinc/86/96/88/411869688.db2.gz RLZMTLCRDYSCLC-UHFFFAOYSA-N 1 2 221.304 2.012 20 0 BEADLO CCc1cc(NCCC2CC(OC)C2)nc[nH+]1 ZINC000664142495 411869957 /nfs/dbraw/zinc/86/99/57/411869957.db2.gz IBWJDVSBNYQHDI-UHFFFAOYSA-N 1 2 235.331 2.266 20 0 BEADLO CC1(C)C[C@H](Nc2cc(NC3CC3)[nH+]cn2)CO1 ZINC000664145379 411870595 /nfs/dbraw/zinc/87/05/95/411870595.db2.gz PIVLKAZSRNYVTR-JTQLQIEISA-N 1 2 248.330 2.030 20 0 BEADLO CC1(C)C[C@H](Nc2cc(NC3CC3)nc[nH+]2)CO1 ZINC000664145379 411870599 /nfs/dbraw/zinc/87/05/99/411870599.db2.gz PIVLKAZSRNYVTR-JTQLQIEISA-N 1 2 248.330 2.030 20 0 BEADLO CCc1cc(N[C@@]23C[C@@H]2CCC3)nc[nH+]1 ZINC000664162101 411876002 /nfs/dbraw/zinc/87/60/02/411876002.db2.gz UKIYZQXHBHCROX-CABZTGNLSA-N 1 2 203.289 2.394 20 0 BEADLO C[C@@H](O)C1(Nc2cc[nH+]c(C(C)(C)C)n2)CC1 ZINC000664549161 411982888 /nfs/dbraw/zinc/98/28/88/411982888.db2.gz GGTTWKSGULNHPT-SECBINFHSA-N 1 2 235.331 2.099 20 0 BEADLO COc1c(C)[nH+]cnc1NCCCc1ccco1 ZINC000664585368 411991882 /nfs/dbraw/zinc/99/18/82/411991882.db2.gz UPAIEJVRCOUPCT-UHFFFAOYSA-N 1 2 247.298 2.431 20 0 BEADLO C[C@@H](Nc1ncncc1Cl)c1[nH+]ccn1C ZINC000664608699 411997820 /nfs/dbraw/zinc/99/78/20/411997820.db2.gz JXQMYGUDTMPDFM-SSDOTTSWSA-N 1 2 237.694 2.037 20 0 BEADLO CCc1nsc(N[C@@H](C)c2[nH+]ccn2C)n1 ZINC000664608721 411998671 /nfs/dbraw/zinc/99/86/71/411998671.db2.gz KULAOCIXTMBOPN-ZETCQYMHSA-N 1 2 237.332 2.007 20 0 BEADLO CO[C@@]1(C)C[C@H]1Nc1[nH+]c2ccccc2n1C ZINC000664607201 411998757 /nfs/dbraw/zinc/99/87/57/411998757.db2.gz YSDWHDBBDXBDAR-YPMHNXCESA-N 1 2 231.299 2.163 20 0 BEADLO CN(CC1=CCSC1)c1cc[nH+]c(C2CC2)n1 ZINC000664639854 412001470 /nfs/dbraw/zinc/00/14/70/412001470.db2.gz FDNQCGFJRUVNBF-UHFFFAOYSA-N 1 2 247.367 2.463 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CC3CC2(C)C3)[nH+]1 ZINC000664694137 412011496 /nfs/dbraw/zinc/01/14/96/412011496.db2.gz RAQDSKARNBYGGV-UHFFFAOYSA-N 1 2 228.299 2.255 20 0 BEADLO C[C@@]12COC[C@H]1CN(c1[nH]c3ccccc3[nH+]1)C2 ZINC000664421420 411950886 /nfs/dbraw/zinc/95/08/86/411950886.db2.gz JZSFKMUBFVYWGO-QMTHXVAHSA-N 1 2 243.310 2.036 20 0 BEADLO Cc1cc(N2CCC[C@@H]2[C@@H](C)O)nc(C2CC2)[nH+]1 ZINC000664438207 411957750 /nfs/dbraw/zinc/95/77/50/411957750.db2.gz FGISWHFSMVGHMQ-ZYHUDNBSSA-N 1 2 247.342 2.012 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2cccc(N)c2)s1 ZINC000662257186 412051263 /nfs/dbraw/zinc/05/12/63/412051263.db2.gz QRJILAADFACHRJ-UHFFFAOYSA-N 1 2 248.355 2.061 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2cccc(N)c2)s1 ZINC000662257186 412051265 /nfs/dbraw/zinc/05/12/65/412051265.db2.gz QRJILAADFACHRJ-UHFFFAOYSA-N 1 2 248.355 2.061 20 0 BEADLO CCCOCc1nc(Cc2c[nH+]ccc2C)no1 ZINC000664982754 412055137 /nfs/dbraw/zinc/05/51/37/412055137.db2.gz XHJUULREQGLCPN-UHFFFAOYSA-N 1 2 247.298 2.290 20 0 BEADLO Cc1cc[nH+]cc1Cc1noc(C2(C)CC2)n1 ZINC000664981254 412055180 /nfs/dbraw/zinc/05/51/80/412055180.db2.gz YCXVSAPOBWCIRO-UHFFFAOYSA-N 1 2 229.283 2.415 20 0 BEADLO Cc1cc[nH+]cc1Cc1noc([C@H]2CCCO2)n1 ZINC000664979773 412055187 /nfs/dbraw/zinc/05/51/87/412055187.db2.gz BKRVOGKWUFYDJW-LLVKDONJSA-N 1 2 245.282 2.215 20 0 BEADLO Cc1cc[nH+]cc1Cc1noc(C(C)C)n1 ZINC000664979220 412055517 /nfs/dbraw/zinc/05/55/17/412055517.db2.gz VYTDBWCELLNGGC-UHFFFAOYSA-N 1 2 217.272 2.487 20 0 BEADLO CC[C@@H]1CC[N@@H+]1Cc1nccn1C(F)F ZINC000292422171 171025204 /nfs/dbraw/zinc/02/52/04/171025204.db2.gz MWVKSYZCJWJBSP-MRVPVSSYSA-N 1 2 215.247 2.263 20 0 BEADLO CC[C@@H]1CC[N@H+]1Cc1nccn1C(F)F ZINC000292422171 171025207 /nfs/dbraw/zinc/02/52/07/171025207.db2.gz MWVKSYZCJWJBSP-MRVPVSSYSA-N 1 2 215.247 2.263 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ncc(C)s2)C[C@H](C)O1 ZINC000180488633 171091855 /nfs/dbraw/zinc/09/18/55/171091855.db2.gz QRBCMLPLNSDVGY-GXSJLCMTSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ncc(C)s2)C[C@H](C)O1 ZINC000180488633 171091857 /nfs/dbraw/zinc/09/18/57/171091857.db2.gz QRBCMLPLNSDVGY-GXSJLCMTSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1noc([C@@H](C)[N@H+](C)CC2=CCSC2)n1 ZINC000662271638 412063532 /nfs/dbraw/zinc/06/35/32/412063532.db2.gz WMGRYQUNALKBAV-MRVPVSSYSA-N 1 2 239.344 2.044 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+](C)CC2=CCSC2)n1 ZINC000662271638 412063538 /nfs/dbraw/zinc/06/35/38/412063538.db2.gz WMGRYQUNALKBAV-MRVPVSSYSA-N 1 2 239.344 2.044 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1ccc(F)cn1 ZINC000276198805 171113332 /nfs/dbraw/zinc/11/33/32/171113332.db2.gz DYVSPBPIMLUREQ-ZWNOBZJWSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1ccc(F)cn1 ZINC000276198805 171113334 /nfs/dbraw/zinc/11/33/34/171113334.db2.gz DYVSPBPIMLUREQ-ZWNOBZJWSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1nc(C)cs1 ZINC000268047319 171113368 /nfs/dbraw/zinc/11/33/68/171113368.db2.gz SHMDQPKEFOESNS-GHMZBOCLSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1nc(C)cs1 ZINC000268047319 171113370 /nfs/dbraw/zinc/11/33/70/171113370.db2.gz SHMDQPKEFOESNS-GHMZBOCLSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[C@H]1Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000348188181 171133202 /nfs/dbraw/zinc/13/32/02/171133202.db2.gz UXACNTHHNCOEEF-MWLCHTKSSA-N 1 2 217.316 2.295 20 0 BEADLO CC[C@@](C)([NH2+]CCSC(C)C)C(=O)OC ZINC000336744426 171175491 /nfs/dbraw/zinc/17/54/91/171175491.db2.gz ZJHQRMHQEIHHQF-LLVKDONJSA-N 1 2 233.377 2.059 20 0 BEADLO CC[C@H](C)C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000336342823 171248651 /nfs/dbraw/zinc/24/86/51/171248651.db2.gz KOYBOSVHNNRALI-UWVGGRQHSA-N 1 2 221.304 2.119 20 0 BEADLO CC[C@H](C)C(=O)N1CC[C@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000125556889 171249138 /nfs/dbraw/zinc/24/91/38/171249138.db2.gz SBYAQSCPLYVKQA-RWMBFGLXSA-N 1 2 249.358 2.339 20 0 BEADLO CC[C@H](C)C(=O)N[C@@H](c1[nH+]ccn1C)C1CC1 ZINC000341710101 171253291 /nfs/dbraw/zinc/25/32/91/171253291.db2.gz VVAPSQAHMWYSKZ-GXSJLCMTSA-N 1 2 235.331 2.034 20 0 BEADLO CC[C@H](C)C(=O)N[C@@H](c1[nH]cc[nH+]1)C(C)C ZINC000276646545 171253295 /nfs/dbraw/zinc/25/32/95/171253295.db2.gz RMTZPLTYBCRJME-VHSXEESVSA-N 1 2 223.320 2.269 20 0 BEADLO CC[C@H](C)C(=O)N[C@H](c1[nH]cc[nH+]1)C(C)C ZINC000276646542 171253734 /nfs/dbraw/zinc/25/37/34/171253734.db2.gz RMTZPLTYBCRJME-UWVGGRQHSA-N 1 2 223.320 2.269 20 0 BEADLO CC[C@H](C)CCC(=O)NCCNc1cccc[nH+]1 ZINC000287042711 171266252 /nfs/dbraw/zinc/26/62/52/171266252.db2.gz JRJBXNWWFYUQJZ-LBPRGKRZSA-N 1 2 249.358 2.436 20 0 BEADLO CC[C@H](C)C[NH2+]c1ccc2c(c1)NC(=O)CO2 ZINC000020125636 171288099 /nfs/dbraw/zinc/28/80/99/171288099.db2.gz XZSUQFPKBAXIQL-VIFPVBQESA-N 1 2 234.299 2.476 20 0 BEADLO CC[C@H](C)[NH2+][C@@](C)(C(=O)OC)c1ccccc1 ZINC000038067055 171347523 /nfs/dbraw/zinc/34/75/23/171347523.db2.gz GXBHQYXHKJAQJL-SMDDNHRTSA-N 1 2 235.327 2.463 20 0 BEADLO CC[C@H](C)OCC(=O)Nc1cc[nH+]c(C)c1 ZINC000131733532 171354437 /nfs/dbraw/zinc/35/44/37/171354437.db2.gz BBFMPRPYOBREHB-JTQLQIEISA-N 1 2 222.288 2.144 20 0 BEADLO CC[C@H](C)[C@@H](O)CNc1cc(C)[nH+]c(C2CC2)n1 ZINC000265389745 171378102 /nfs/dbraw/zinc/37/81/02/171378102.db2.gz UCLGFOPIBVQEJU-CABZTGNLSA-N 1 2 249.358 2.481 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000330944733 171387380 /nfs/dbraw/zinc/38/73/80/171387380.db2.gz GMRYTUWBHXSLRZ-DCAQKATOSA-N 1 2 249.358 2.380 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)[C@H]1CCCc2[nH]c[nH+]c21 ZINC000330944733 171387381 /nfs/dbraw/zinc/38/73/81/171387381.db2.gz GMRYTUWBHXSLRZ-DCAQKATOSA-N 1 2 249.358 2.380 20 0 BEADLO CCOc1ccc(-c2[nH+]ccn2C)cc1N ZINC000665181648 412122084 /nfs/dbraw/zinc/12/20/84/412122084.db2.gz VMKOFCZWBHGXHB-UHFFFAOYSA-N 1 2 217.272 2.068 20 0 BEADLO CC[C@H](NC(=O)CC(C)C)c1[nH]cc[nH+]1 ZINC000125323859 171496661 /nfs/dbraw/zinc/49/66/61/171496661.db2.gz CFNKOMDHOWHACO-VIFPVBQESA-N 1 2 209.293 2.023 20 0 BEADLO CC[C@H]1CCN1C(=O)Nc1cc[nH+]c(C)c1 ZINC000297901790 171635459 /nfs/dbraw/zinc/63/54/59/171635459.db2.gz XOTQWIHSFVEVTK-NSHDSACASA-N 1 2 219.288 2.406 20 0 BEADLO CCc1cc(N)nc(S[C@@H](C)CC)[nH+]1 ZINC000330363807 171748092 /nfs/dbraw/zinc/74/80/92/171748092.db2.gz UCIBQSOGRWFILI-ZETCQYMHSA-N 1 2 211.334 2.342 20 0 BEADLO CCc1ccc([C@H](COC)NCc2[nH]cc[nH+]2)o1 ZINC000174477752 171842652 /nfs/dbraw/zinc/84/26/52/171842652.db2.gz MKKHUQCEUMXWOY-NSHDSACASA-N 1 2 249.314 2.042 20 0 BEADLO CCc1cccnc1[C@H](C)[NH2+]Cc1ccn(C)n1 ZINC000356881136 171900765 /nfs/dbraw/zinc/90/07/65/171900765.db2.gz UOKXXTFRHPDTPE-NSHDSACASA-N 1 2 244.342 2.228 20 0 BEADLO CCc1cnccc1[C@@H](C)[NH2+]Cc1nnc(C)o1 ZINC000361133700 171926991 /nfs/dbraw/zinc/92/69/91/171926991.db2.gz ZANGZPKKPYUOFC-SECBINFHSA-N 1 2 246.314 2.186 20 0 BEADLO CCc1nc([C@@H](C)[NH2+]Cc2cc[nH]n2)cs1 ZINC000111407171 172003319 /nfs/dbraw/zinc/00/33/19/172003319.db2.gz RRUXEUFLYFAVPV-MRVPVSSYSA-N 1 2 236.344 2.279 20 0 BEADLO CCc1nnc([C@H](C)[NH2+]Cc2ccc(C)o2)[nH]1 ZINC000270635021 172005774 /nfs/dbraw/zinc/00/57/74/172005774.db2.gz GQRCXAGVFFNZRH-VIFPVBQESA-N 1 2 234.303 2.119 20 0 BEADLO CCc1ncc(C[NH2+]CC(F)F)s1 ZINC000147430081 172019630 /nfs/dbraw/zinc/01/96/30/172019630.db2.gz QCDFXZHLMIBFFJ-UHFFFAOYSA-N 1 2 206.261 2.060 20 0 BEADLO CCc1nn(C)cc1C[NH2+][C@H](C)c1cc(C)on1 ZINC000337304606 172041154 /nfs/dbraw/zinc/04/11/54/172041154.db2.gz SFRNJKUMGQVVPH-SNVBAGLBSA-N 1 2 248.330 2.130 20 0 BEADLO CCc1nnc(C[NH2+]Cc2ccsc2)s1 ZINC000289696068 172051783 /nfs/dbraw/zinc/05/17/83/172051783.db2.gz DKYCLBYROPVEKB-UHFFFAOYSA-N 1 2 239.369 2.452 20 0 BEADLO CCc1nnc(C[NH2+][C@H](C)c2cccnc2)s1 ZINC000273183632 172053169 /nfs/dbraw/zinc/05/31/69/172053169.db2.gz QIPSAMSACPYUCK-SECBINFHSA-N 1 2 248.355 2.346 20 0 BEADLO CCc1nnc([C@@H](C)[N@H+]2CC=C(C)CC2)o1 ZINC000336438635 172064672 /nfs/dbraw/zinc/06/46/72/172064672.db2.gz UTYMUYCLZFJBAZ-SNVBAGLBSA-N 1 2 221.304 2.345 20 0 BEADLO CCc1nnc([C@@H](C)[N@@H+]2CC=C(C)CC2)o1 ZINC000336438635 172064675 /nfs/dbraw/zinc/06/46/75/172064675.db2.gz UTYMUYCLZFJBAZ-SNVBAGLBSA-N 1 2 221.304 2.345 20 0 BEADLO CCc1nnc([C@H](C)[N@@H+]2C[C@H](C)[C@@H]2C)o1 ZINC000339581754 172066610 /nfs/dbraw/zinc/06/66/10/172066610.db2.gz XGLFNCYVGYRSAB-CIUDSAMLSA-N 1 2 209.293 2.033 20 0 BEADLO CCc1nnc([C@H](C)[N@H+]2C[C@H](C)[C@@H]2C)o1 ZINC000339581754 172066612 /nfs/dbraw/zinc/06/66/12/172066612.db2.gz XGLFNCYVGYRSAB-CIUDSAMLSA-N 1 2 209.293 2.033 20 0 BEADLO CCc1nnsc1C(=O)Nc1cc[nH+]cc1C ZINC000107293162 172070784 /nfs/dbraw/zinc/07/07/84/172070784.db2.gz BMODWVROWQPDLJ-UHFFFAOYSA-N 1 2 248.311 2.056 20 0 BEADLO CCc1noc(C)c1C[NH2+][C@H](C)c1cnccn1 ZINC000340441897 172080420 /nfs/dbraw/zinc/08/04/20/172080420.db2.gz IOJSILHIRUYQCB-SECBINFHSA-N 1 2 246.314 2.186 20 0 BEADLO CCc1noc(CC)c1C[NH2+]Cc1cocn1 ZINC000192324217 172083935 /nfs/dbraw/zinc/08/39/35/172083935.db2.gz JUHZRGZMOQKDTC-UHFFFAOYSA-N 1 2 235.287 2.077 20 0 BEADLO CCc1noc([C@@H](C)[NH2+][C@H](C)c2cccnc2)n1 ZINC000182885682 172088544 /nfs/dbraw/zinc/08/85/44/172088544.db2.gz RIRIZYIRFIJLIO-NXEZZACHSA-N 1 2 246.314 2.439 20 0 BEADLO CCc1noc([C@H](C)[N@@H+]2C[C@@H](C)[C@@H]2C)n1 ZINC000339567469 172090746 /nfs/dbraw/zinc/09/07/46/172090746.db2.gz JAPZASPBJLHXGX-VGMNWLOBSA-N 1 2 209.293 2.033 20 0 BEADLO CCc1noc([C@H](C)[N@H+]2C[C@@H](C)[C@@H]2C)n1 ZINC000339567469 172090749 /nfs/dbraw/zinc/09/07/49/172090749.db2.gz JAPZASPBJLHXGX-VGMNWLOBSA-N 1 2 209.293 2.033 20 0 BEADLO CCc1nocc1C[N@H+](C)[C@@H](C)c1cnn(C)c1 ZINC000352778624 172095994 /nfs/dbraw/zinc/09/59/94/172095994.db2.gz VZAHUYVCTZYZPE-JTQLQIEISA-N 1 2 248.330 2.164 20 0 BEADLO CCc1nocc1C[N@@H+](C)[C@@H](C)c1cnn(C)c1 ZINC000352778624 172095996 /nfs/dbraw/zinc/09/59/96/172095996.db2.gz VZAHUYVCTZYZPE-JTQLQIEISA-N 1 2 248.330 2.164 20 0 BEADLO CCc1nocc1CN(C)Cc1[nH+]ccn1CC ZINC000339602552 172096568 /nfs/dbraw/zinc/09/65/68/172096568.db2.gz CGERZIKXQUPUAF-UHFFFAOYSA-N 1 2 248.330 2.085 20 0 BEADLO CCc1nocc1C[N@@H+]1CCc2ncsc2C1 ZINC000353096667 172097918 /nfs/dbraw/zinc/09/79/18/172097918.db2.gz NPAHWZUONCAYCG-UHFFFAOYSA-N 1 2 249.339 2.252 20 0 BEADLO CCc1nocc1C[N@H+]1CCc2ncsc2C1 ZINC000353096667 172097922 /nfs/dbraw/zinc/09/79/22/172097922.db2.gz NPAHWZUONCAYCG-UHFFFAOYSA-N 1 2 249.339 2.252 20 0 BEADLO CCn1cc(C[N@@H+]2CCn3cccc3[C@H]2C)cn1 ZINC000179564624 172165279 /nfs/dbraw/zinc/16/52/79/172165279.db2.gz RSABNMXWUVCBHG-GFCCVEGCSA-N 1 2 244.342 2.281 20 0 BEADLO CCn1cc(C[N@H+]2CCn3cccc3[C@H]2C)cn1 ZINC000179564624 172165282 /nfs/dbraw/zinc/16/52/82/172165282.db2.gz RSABNMXWUVCBHG-GFCCVEGCSA-N 1 2 244.342 2.281 20 0 BEADLO CCn1ccnc1C[N@@H+]1CCCc2occc2C1 ZINC000336500725 172220436 /nfs/dbraw/zinc/22/04/36/172220436.db2.gz QZILHMHVLXMNKF-UHFFFAOYSA-N 1 2 245.326 2.444 20 0 BEADLO CCn1ccnc1C[N@H+]1CCCc2occc2C1 ZINC000336500725 172220438 /nfs/dbraw/zinc/22/04/38/172220438.db2.gz QZILHMHVLXMNKF-UHFFFAOYSA-N 1 2 245.326 2.444 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C[C@@H]1C=CCCC1 ZINC000295823784 172221906 /nfs/dbraw/zinc/22/19/06/172221906.db2.gz UIJDAIDTXPZVOS-GFCCVEGCSA-N 1 2 247.342 2.266 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C[C@H]1C=CCCC1 ZINC000295823785 172221952 /nfs/dbraw/zinc/22/19/52/172221952.db2.gz UIJDAIDTXPZVOS-LBPRGKRZSA-N 1 2 247.342 2.266 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@H]1C[C@]1(C)C(C)C ZINC000295597766 172222102 /nfs/dbraw/zinc/22/21/02/172222102.db2.gz IFWQNUWJRXIQIY-BXUZGUMPSA-N 1 2 249.358 2.201 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@H]1CCCC1(C)C ZINC000295551242 172222591 /nfs/dbraw/zinc/22/25/91/172222591.db2.gz DTHAHJWEHQYQLG-LLVKDONJSA-N 1 2 249.358 2.346 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@@H]1C[C@@]1(C)C(C)C ZINC000295597769 172222694 /nfs/dbraw/zinc/22/26/94/172222694.db2.gz IFWQNUWJRXIQIY-FZMZJTMJSA-N 1 2 249.358 2.201 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@@H]1CCCC1(C)C ZINC000295551246 172223139 /nfs/dbraw/zinc/22/31/39/172223139.db2.gz DTHAHJWEHQYQLG-NSHDSACASA-N 1 2 249.358 2.346 20 0 BEADLO CCn1cc[nH+]c1CN[C@H](C)c1nccs1 ZINC000070732285 172224173 /nfs/dbraw/zinc/22/41/73/172224173.db2.gz XPARVYRYSRSPMR-SECBINFHSA-N 1 2 236.344 2.210 20 0 BEADLO CCn1cc[nH+]c1CN[C@H](C)c1cc(C)on1 ZINC000282723311 172224652 /nfs/dbraw/zinc/22/46/52/172224652.db2.gz QOGZUKWCXUJOOJ-SNVBAGLBSA-N 1 2 234.303 2.050 20 0 BEADLO CCn1cc[nH+]c1CNc1ncccc1F ZINC000279972630 172225966 /nfs/dbraw/zinc/22/59/66/172225966.db2.gz DNUKOHULGCEJQF-UHFFFAOYSA-N 1 2 220.251 2.049 20 0 BEADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)C1CC1 ZINC000281694042 172229734 /nfs/dbraw/zinc/22/97/34/172229734.db2.gz GQIJGJKFOQZLAW-LBPRGKRZSA-N 1 2 247.342 2.367 20 0 BEADLO CCn1cnnc1C[NH2+][C@H](C)c1ccccc1F ZINC000158339206 172236594 /nfs/dbraw/zinc/23/65/94/172236594.db2.gz SYLZOMSWNZOVSN-SNVBAGLBSA-N 1 2 248.305 2.288 20 0 BEADLO CCn1cnnc1C[NH2+][C@H](C)c1cc(C)c(C)o1 ZINC000281951061 172236885 /nfs/dbraw/zinc/23/68/85/172236885.db2.gz ANSAPTWVMGEXEQ-SNVBAGLBSA-N 1 2 248.330 2.359 20 0 BEADLO CCn1cnnc1C[NH2+][C@H]1CCCc2occc21 ZINC000219257220 172236988 /nfs/dbraw/zinc/23/69/88/172236988.db2.gz LZVYHVDCRGKRBY-NSHDSACASA-N 1 2 246.314 2.058 20 0 BEADLO CCn1cnnc1C[NH2+][C@@H](C)c1ccccc1F ZINC000158339047 172237026 /nfs/dbraw/zinc/23/70/26/172237026.db2.gz SYLZOMSWNZOVSN-JTQLQIEISA-N 1 2 248.305 2.288 20 0 BEADLO CCn1nc(C)c(C[NH2+][C@H](C)c2ccc(C)o2)n1 ZINC000294845533 172247754 /nfs/dbraw/zinc/24/77/54/172247754.db2.gz UKBSAFYFUFWXOW-LLVKDONJSA-N 1 2 248.330 2.359 20 0 BEADLO C[NH+](C)Cc1nc([C@H]2CCCCS2)no1 ZINC000334143042 172508052 /nfs/dbraw/zinc/50/80/52/172508052.db2.gz CCOBKMBQGRAOFQ-MRVPVSSYSA-N 1 2 227.333 2.089 20 0 BEADLO C[NH+](C)c1ccc(NCc2cocn2)cc1 ZINC000192327336 172556830 /nfs/dbraw/zinc/55/68/30/172556830.db2.gz JXTPAHWZZGLOTQ-UHFFFAOYSA-N 1 2 217.272 2.353 20 0 BEADLO C[NH2+]Cc1noc(C[C@@H](C)CC(C)C)n1 ZINC000336712004 173399539 /nfs/dbraw/zinc/39/95/39/173399539.db2.gz SMJMJQMXVQMSGJ-VIFPVBQESA-N 1 2 211.309 2.014 20 0 BEADLO COC1CCC(N(C)c2cc[nH+]c(C)n2)CC1 ZINC000266369255 174023750 /nfs/dbraw/zinc/02/37/50/174023750.db2.gz LKURRJMJIYISPZ-UHFFFAOYSA-N 1 2 235.331 2.179 20 0 BEADLO COCCCCC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000280753831 174176026 /nfs/dbraw/zinc/17/60/26/174176026.db2.gz LHTTVKYHAOLPCF-UHFFFAOYSA-N 1 2 247.298 2.090 20 0 BEADLO COCCCCSCCn1cc[nH+]c1 ZINC000285207075 174207141 /nfs/dbraw/zinc/20/71/41/174207141.db2.gz WPOLACWHEIUGLA-UHFFFAOYSA-N 1 2 214.334 2.043 20 0 BEADLO COCC[N@H+](C)Cc1ccn(C2CCCC2)n1 ZINC000357163955 174280324 /nfs/dbraw/zinc/28/03/24/174280324.db2.gz DGPWYNJNAGYCLS-UHFFFAOYSA-N 1 2 237.347 2.076 20 0 BEADLO COCC[N@@H+](C)Cc1ccn(C2CCCC2)n1 ZINC000357163955 174280325 /nfs/dbraw/zinc/28/03/25/174280325.db2.gz DGPWYNJNAGYCLS-UHFFFAOYSA-N 1 2 237.347 2.076 20 0 BEADLO COCC[N@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC000154046743 174281181 /nfs/dbraw/zinc/28/11/81/174281181.db2.gz LGZMXMRMZUBCJM-UHFFFAOYSA-N 1 2 245.326 2.155 20 0 BEADLO COCC[N@@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC000154046743 174281184 /nfs/dbraw/zinc/28/11/84/174281184.db2.gz LGZMXMRMZUBCJM-UHFFFAOYSA-N 1 2 245.326 2.155 20 0 BEADLO COCC[N@H+](C/C=C\Cl)Cc1cccnc1 ZINC000191120973 174285052 /nfs/dbraw/zinc/28/50/52/174285052.db2.gz WYXQLWQTPNBZSD-HYXAFXHYSA-N 1 2 240.734 2.283 20 0 BEADLO COCC[N@@H+](C/C=C\Cl)Cc1cccnc1 ZINC000191120973 174285053 /nfs/dbraw/zinc/28/50/53/174285053.db2.gz WYXQLWQTPNBZSD-HYXAFXHYSA-N 1 2 240.734 2.283 20 0 BEADLO COCC[N@H+](CCCCCF)CC(F)F ZINC000341879627 174290376 /nfs/dbraw/zinc/29/03/76/174290376.db2.gz BXMZJUQIQMPDFI-UHFFFAOYSA-N 1 2 227.270 2.340 20 0 BEADLO COCC[N@@H+](CCCCCF)CC(F)F ZINC000341879627 174290377 /nfs/dbraw/zinc/29/03/77/174290377.db2.gz BXMZJUQIQMPDFI-UHFFFAOYSA-N 1 2 227.270 2.340 20 0 BEADLO COCC[N@H+](Cc1ccon1)Cc1ccccc1 ZINC000077247185 174299851 /nfs/dbraw/zinc/29/98/51/174299851.db2.gz MOSGUDSNOSVFHC-UHFFFAOYSA-N 1 2 246.310 2.323 20 0 BEADLO COCC[N@@H+](Cc1ccon1)Cc1ccccc1 ZINC000077247185 174299854 /nfs/dbraw/zinc/29/98/54/174299854.db2.gz MOSGUDSNOSVFHC-UHFFFAOYSA-N 1 2 246.310 2.323 20 0 BEADLO COCCN(c1cc(C)[nH+]cn1)[C@H]1CC[C@H](C)C1 ZINC000302731824 174302385 /nfs/dbraw/zinc/30/23/85/174302385.db2.gz TUPSTPPBPJNNOS-AAEUAGOBSA-N 1 2 249.358 2.426 20 0 BEADLO COCC[N@@H+]1CCc2c(Cl)cc(F)cc2C1 ZINC000295770798 174315694 /nfs/dbraw/zinc/31/56/94/174315694.db2.gz SPQGUGLXDVVPFT-UHFFFAOYSA-N 1 2 243.709 2.484 20 0 BEADLO COCC[N@H+]1CCc2c(Cl)cc(F)cc2C1 ZINC000295770798 174315696 /nfs/dbraw/zinc/31/56/96/174315696.db2.gz SPQGUGLXDVVPFT-UHFFFAOYSA-N 1 2 243.709 2.484 20 0 BEADLO COCC[N@@H+]1CCn2c(Cl)ccc2[C@H]1C ZINC000283844238 174315791 /nfs/dbraw/zinc/31/57/91/174315791.db2.gz CNQSGPQOKSKUEA-SECBINFHSA-N 1 2 228.723 2.165 20 0 BEADLO COCC[N@H+]1CCn2c(Cl)ccc2[C@H]1C ZINC000283844238 174315792 /nfs/dbraw/zinc/31/57/92/174315792.db2.gz CNQSGPQOKSKUEA-SECBINFHSA-N 1 2 228.723 2.165 20 0 BEADLO COC[C@H]([NH2+]Cc1cc(C)no1)c1ccccc1 ZINC000223718749 174582306 /nfs/dbraw/zinc/58/23/06/174582306.db2.gz LXEJLJHXXRTWFG-AWEZNQCLSA-N 1 2 246.310 2.460 20 0 BEADLO COCc1cc[nH+]c(N[C@H]2CO[C@@H](C3CC3)C2)c1 ZINC000668293105 487629485 /nfs/dbraw/zinc/62/94/85/487629485.db2.gz UEQUNSKSXSJQAN-CHWSQXEVSA-N 1 2 248.326 2.207 20 0 BEADLO COc1ccc(C[N@@H+]2CCC(=O)[C@H](C)C2)cc1 ZINC000049693458 175098458 /nfs/dbraw/zinc/09/84/58/175098458.db2.gz AKXMOGXOTQJMHF-LLVKDONJSA-N 1 2 233.311 2.106 20 0 BEADLO COc1ccc(C[N@H+]2CCC(=O)[C@H](C)C2)cc1 ZINC000049693458 175098460 /nfs/dbraw/zinc/09/84/60/175098460.db2.gz AKXMOGXOTQJMHF-LLVKDONJSA-N 1 2 233.311 2.106 20 0 BEADLO COc1ccc(F)cc1-c1cc[nH+]c(N)c1 ZINC000082729973 175127484 /nfs/dbraw/zinc/12/74/84/175127484.db2.gz XXZQGOSXFWZKSD-UHFFFAOYSA-N 1 2 218.231 2.479 20 0 BEADLO COc1ccc(F)cc1C[N@@H+]1CCO[C@@H](C)C1 ZINC000290483153 175128900 /nfs/dbraw/zinc/12/89/00/175128900.db2.gz VMBJUPRYKZDDNR-JTQLQIEISA-N 1 2 239.290 2.055 20 0 BEADLO COc1ccc(F)cc1C[N@H+]1CCO[C@@H](C)C1 ZINC000290483153 175128902 /nfs/dbraw/zinc/12/89/02/175128902.db2.gz VMBJUPRYKZDDNR-JTQLQIEISA-N 1 2 239.290 2.055 20 0 BEADLO COc1ccc(F)cc1NCc1c[nH+]cn1C ZINC000155375252 175132492 /nfs/dbraw/zinc/13/24/92/175132492.db2.gz RSSOYXVROGRDBC-UHFFFAOYSA-N 1 2 235.262 2.180 20 0 BEADLO COc1ccc(OC)c(Nc2[nH+]cccc2N)c1 ZINC000020317683 175167487 /nfs/dbraw/zinc/16/74/87/175167487.db2.gz XUUMCCSLOOTNFE-UHFFFAOYSA-N 1 2 245.282 2.425 20 0 BEADLO COc1ccc([C@@H](C)[NH2+]Cc2nc(C)no2)cc1 ZINC000038034372 175176977 /nfs/dbraw/zinc/17/69/77/175176977.db2.gz ACTKEBKZKFBHMX-SECBINFHSA-N 1 2 247.298 2.237 20 0 BEADLO COc1ccc([C@H](C)[NH2+]Cc2ccn[nH]2)cc1 ZINC000041014175 175189188 /nfs/dbraw/zinc/18/91/88/175189188.db2.gz LVMDGWKOBDEPCO-JTQLQIEISA-N 1 2 231.299 2.269 20 0 BEADLO COc1cccc(CN(C)Cc2[nH]cc[nH+]2)c1 ZINC000264628842 175255563 /nfs/dbraw/zinc/25/55/63/175255563.db2.gz QTYFLRZVKMSCOG-UHFFFAOYSA-N 1 2 231.299 2.050 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2ncc[nH]2)c1 ZINC000264628842 175255564 /nfs/dbraw/zinc/25/55/64/175255564.db2.gz QTYFLRZVKMSCOG-UHFFFAOYSA-N 1 2 231.299 2.050 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2ncc[nH]2)c1 ZINC000264628842 175255567 /nfs/dbraw/zinc/25/55/67/175255567.db2.gz QTYFLRZVKMSCOG-UHFFFAOYSA-N 1 2 231.299 2.050 20 0 BEADLO COc1cccc(C[NH2+]Cc2cscn2)c1 ZINC000040420574 175266169 /nfs/dbraw/zinc/26/61/69/175266169.db2.gz UZMXHZAGCUMIGF-UHFFFAOYSA-N 1 2 234.324 2.442 20 0 BEADLO COc1cccc(NCc2c[nH+]cn2C)c1 ZINC000078779838 175278768 /nfs/dbraw/zinc/27/87/68/175278768.db2.gz KYBMOFUYJNDAIX-UHFFFAOYSA-N 1 2 217.272 2.041 20 0 BEADLO COc1cccc2c(NC[C@H](C)O)cc[nH+]c12 ZINC000275478793 175299830 /nfs/dbraw/zinc/29/98/30/175299830.db2.gz JPOXZTRACBUAFL-VIFPVBQESA-N 1 2 232.283 2.036 20 0 BEADLO COc1cccc2c(N(C)[C@@H](C)CO)cc[nH+]c12 ZINC000193489067 175300106 /nfs/dbraw/zinc/30/01/06/175300106.db2.gz AASBGXJWQVIQQW-JTQLQIEISA-N 1 2 246.310 2.060 20 0 BEADLO COc1ccccc1/C=C/C[N@@H+]1CCOC[C@H]1C ZINC000091810467 175314233 /nfs/dbraw/zinc/31/42/33/175314233.db2.gz UYVQSIORIKEGQC-VUDGCMKMSA-N 1 2 247.338 2.429 20 0 BEADLO COc1ccccc1/C=C/C[N@H+]1CCOC[C@H]1C ZINC000091810467 175314234 /nfs/dbraw/zinc/31/42/34/175314234.db2.gz UYVQSIORIKEGQC-VUDGCMKMSA-N 1 2 247.338 2.429 20 0 BEADLO COc1ccccc1C[N@H+](C)Cc1n[nH]cc1C ZINC000356058777 175326703 /nfs/dbraw/zinc/32/67/03/175326703.db2.gz GCECUVSFNUQCGX-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1ccccc1C[N@@H+](C)Cc1n[nH]cc1C ZINC000356058777 175326704 /nfs/dbraw/zinc/32/67/04/175326704.db2.gz GCECUVSFNUQCGX-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1ccccc1C[N@H+](C)Cc1[nH]ncc1C ZINC000356058777 175326707 /nfs/dbraw/zinc/32/67/07/175326707.db2.gz GCECUVSFNUQCGX-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1ccccc1C[N@@H+](C)Cc1[nH]ncc1C ZINC000356058777 175326709 /nfs/dbraw/zinc/32/67/09/175326709.db2.gz GCECUVSFNUQCGX-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1ccccc1C[N@@H+]1CCOCC12CC2 ZINC000339002413 175327826 /nfs/dbraw/zinc/32/78/26/175327826.db2.gz SKJQSPWOZWLGOR-UHFFFAOYSA-N 1 2 233.311 2.060 20 0 BEADLO COc1ccccc1C[N@H+]1CCOCC12CC2 ZINC000339002413 175327829 /nfs/dbraw/zinc/32/78/29/175327829.db2.gz SKJQSPWOZWLGOR-UHFFFAOYSA-N 1 2 233.311 2.060 20 0 BEADLO COc1ccccc1C[NH2+]Cc1n[nH]cc1C ZINC000283911253 175329804 /nfs/dbraw/zinc/32/98/04/175329804.db2.gz GHZWIGCETZFODR-UHFFFAOYSA-N 1 2 231.299 2.017 20 0 BEADLO COc1ccccc1C[NH2+]Cc1cc(C)no1 ZINC000044300954 175330453 /nfs/dbraw/zinc/33/04/53/175330453.db2.gz WFHKJPSEIJZBCO-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO COc1ccccc1[C@@H](C)[NH2+]Cc1cc[nH]n1 ZINC000036900115 175344375 /nfs/dbraw/zinc/34/43/75/175344375.db2.gz GGWGGKALLFBHED-SNVBAGLBSA-N 1 2 231.299 2.269 20 0 BEADLO COc1cc[nH+]c(CN(C)Cc2nccs2)c1 ZINC000266957547 175358892 /nfs/dbraw/zinc/35/88/92/175358892.db2.gz WLWMXSPUHVPJIF-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1cc[nH+]cc1COC(=O)C1(C)CCC1 ZINC000286940236 175372965 /nfs/dbraw/zinc/37/29/65/175372965.db2.gz JVZDJVMQJRQAPP-UHFFFAOYSA-N 1 2 235.283 2.324 20 0 BEADLO COc1cc[nH+]cc1COC(=O)CC(C)C ZINC000287191317 175373467 /nfs/dbraw/zinc/37/34/67/175373467.db2.gz PBBWMVMSPFPGQA-UHFFFAOYSA-N 1 2 223.272 2.180 20 0 BEADLO COc1cc[nH+]cc1CSCCC1(O)CC1 ZINC000342004927 175373583 /nfs/dbraw/zinc/37/35/83/175373583.db2.gz UMKDGONXLFEJSM-UHFFFAOYSA-N 1 2 239.340 2.238 20 0 BEADLO COc1cc[nH+]cc1COC(=O)[C@@H]1CC=CCC1 ZINC000288780672 175373725 /nfs/dbraw/zinc/37/37/25/175373725.db2.gz RYMRYNNKGXRREA-LLVKDONJSA-N 1 2 247.294 2.490 20 0 BEADLO COc1cc[nH+]cc1COC(=O)[C@@H](C)C1CC1 ZINC000286605906 175373752 /nfs/dbraw/zinc/37/37/52/175373752.db2.gz AJPXKWJJNLSABG-VIFPVBQESA-N 1 2 235.283 2.180 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C1(CCF)CC1 ZINC000290467465 175375169 /nfs/dbraw/zinc/37/51/69/175375169.db2.gz JTUQWJUAGRUURY-UHFFFAOYSA-N 1 2 238.262 2.169 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H](C)C(C)C ZINC000171934218 175375181 /nfs/dbraw/zinc/37/51/81/175375181.db2.gz CUUVMGVRNWLMCH-VIFPVBQESA-N 1 2 222.288 2.321 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H](C)C1CC1 ZINC000178461494 175375185 /nfs/dbraw/zinc/37/51/85/175375185.db2.gz YITABRHSTXZTFH-QMMMGPOBSA-N 1 2 220.272 2.075 20 0 BEADLO COc1cc[nH+]cc1NCc1ccco1 ZINC000119169080 175376221 /nfs/dbraw/zinc/37/62/21/175376221.db2.gz ZCSVDPAGDNTMPJ-UHFFFAOYSA-N 1 2 204.229 2.295 20 0 BEADLO COc1ccsc1C[N@H+](C1CC1)C1COC1 ZINC000296120035 175377537 /nfs/dbraw/zinc/37/75/37/175377537.db2.gz TTXQAZHETICZGO-UHFFFAOYSA-N 1 2 239.340 2.120 20 0 BEADLO COc1ccsc1C[N@@H+](C1CC1)C1COC1 ZINC000296120035 175377539 /nfs/dbraw/zinc/37/75/39/175377539.db2.gz TTXQAZHETICZGO-UHFFFAOYSA-N 1 2 239.340 2.120 20 0 BEADLO COc1nc(C)cc(C)c1C[N@@H+]1CC[C@@H](F)C1 ZINC000336263133 175389963 /nfs/dbraw/zinc/38/99/63/175389963.db2.gz SYVLOGQUEASURB-LLVKDONJSA-N 1 2 238.306 2.251 20 0 BEADLO COc1nc(C)cc(C)c1C[N@H+]1CC[C@@H](F)C1 ZINC000336263133 175389965 /nfs/dbraw/zinc/38/99/65/175389965.db2.gz SYVLOGQUEASURB-LLVKDONJSA-N 1 2 238.306 2.251 20 0 BEADLO COc1ncccc1C[NH2+][C@H](C)c1cc(C)on1 ZINC000282726596 175408452 /nfs/dbraw/zinc/40/84/52/175408452.db2.gz MILCIVLQSXYJHW-SNVBAGLBSA-N 1 2 247.298 2.237 20 0 BEADLO CSC[C@@H]1CCCN1c1cc(C)[nH+]cn1 ZINC000133341101 175518636 /nfs/dbraw/zinc/51/86/36/175518636.db2.gz BQWRUGLBJJCPGE-JTQLQIEISA-N 1 2 223.345 2.117 20 0 BEADLO C[C@@H](O)c1ncc(C[N@@H+]2CCC[C@H]2CF)s1 ZINC000294197813 176000629 /nfs/dbraw/zinc/00/06/29/176000629.db2.gz XQMLQZSCDRHRAG-BDAKNGLRSA-N 1 2 244.335 2.130 20 0 BEADLO C[C@@H](O)c1ncc(C[N@H+]2CCC[C@H]2CF)s1 ZINC000294197813 176000631 /nfs/dbraw/zinc/00/06/31/176000631.db2.gz XQMLQZSCDRHRAG-BDAKNGLRSA-N 1 2 244.335 2.130 20 0 BEADLO C[C@@H](c1ccccc1F)[N@H+](C)CC1OCCO1 ZINC000122207296 176024591 /nfs/dbraw/zinc/02/45/91/176024591.db2.gz KRZJQPJCZBJRDX-JTQLQIEISA-N 1 2 239.290 2.191 20 0 BEADLO C[C@@H](c1ccccc1F)[N@@H+](C)CC1OCCO1 ZINC000122207296 176024592 /nfs/dbraw/zinc/02/45/92/176024592.db2.gz KRZJQPJCZBJRDX-JTQLQIEISA-N 1 2 239.290 2.191 20 0 BEADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1ccon1 ZINC000177267164 176026188 /nfs/dbraw/zinc/02/61/88/176026188.db2.gz QKOJWMVYPJBALI-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1ccon1 ZINC000177267164 176026190 /nfs/dbraw/zinc/02/61/90/176026190.db2.gz QKOJWMVYPJBALI-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1ccn(C)n1 ZINC000336704171 176026805 /nfs/dbraw/zinc/02/68/05/176026805.db2.gz CPUGVSICESIALU-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1ccn(C)n1 ZINC000336704171 176026808 /nfs/dbraw/zinc/02/68/08/176026808.db2.gz CPUGVSICESIALU-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1cccs1)[N@H+](C)Cc1nccc(N)n1 ZINC000268707372 176032782 /nfs/dbraw/zinc/03/27/82/176032782.db2.gz WJDDXWNFBIZLSA-VIFPVBQESA-N 1 2 248.355 2.313 20 0 BEADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1nccc(N)n1 ZINC000268707372 176032783 /nfs/dbraw/zinc/03/27/83/176032783.db2.gz WJDDXWNFBIZLSA-VIFPVBQESA-N 1 2 248.355 2.313 20 0 BEADLO C[C@@H](c1cnccn1)[N@@H+]1CCC[C@@](C)(F)C1 ZINC000295451544 176036744 /nfs/dbraw/zinc/03/67/44/176036744.db2.gz PLPVWQFANBHAIO-CMPLNLGQSA-N 1 2 223.295 2.362 20 0 BEADLO C[C@@H](c1cnccn1)[N@H+]1CCC[C@@](C)(F)C1 ZINC000295451544 176036747 /nfs/dbraw/zinc/03/67/47/176036747.db2.gz PLPVWQFANBHAIO-CMPLNLGQSA-N 1 2 223.295 2.362 20 0 BEADLO C[C@@H](c1cnccn1)[N@@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000279821154 176037291 /nfs/dbraw/zinc/03/72/91/176037291.db2.gz QMXBZTDYRPMWNJ-AAEUAGOBSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H](c1cnccn1)[N@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000279821154 176037292 /nfs/dbraw/zinc/03/72/92/176037292.db2.gz QMXBZTDYRPMWNJ-AAEUAGOBSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1CCCC[C@H]1OCCn1cc[nH+]c1 ZINC000121755861 176090377 /nfs/dbraw/zinc/09/03/77/176090377.db2.gz QXWNOJZZQYRVCO-VXGBXAGGSA-N 1 2 208.305 2.478 20 0 BEADLO C[C@@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)[C@@H]1C ZINC000284073893 176090847 /nfs/dbraw/zinc/09/08/47/176090847.db2.gz RTNMJGXRWLKOOO-XIJCSBCJSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@@H]1CCCN1c1cc(N2CCCC2)[nH+]cn1 ZINC000264301529 176111278 /nfs/dbraw/zinc/11/12/78/176111278.db2.gz DNQJWTKKGHLTHB-LLVKDONJSA-N 1 2 232.331 2.066 20 0 BEADLO C[C@@H]1CCCN1c1cc(N2CCCC2)nc[nH+]1 ZINC000264301529 176111280 /nfs/dbraw/zinc/11/12/80/176111280.db2.gz DNQJWTKKGHLTHB-LLVKDONJSA-N 1 2 232.331 2.066 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N1C(=O)COc1cc[nH+]cc1 ZINC000276402575 176114552 /nfs/dbraw/zinc/11/45/52/176114552.db2.gz DKGWECMGNVKQKE-VXGBXAGGSA-N 1 2 248.326 2.250 20 0 BEADLO C[C@@H]1CCC[C@@H](CNC(=O)CCn2cc[nH+]c2)C1 ZINC000338052610 176118619 /nfs/dbraw/zinc/11/86/19/176118619.db2.gz QABSIQAWSVTQJI-CHWSQXEVSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@@H]1CCC[C@@H](CNC(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000283503862 176119009 /nfs/dbraw/zinc/11/90/09/176119009.db2.gz PEYNALOHNGWIEJ-IEVRTODYSA-N 1 2 247.342 2.365 20 0 BEADLO C[C@@H]1CCC[C@@]1(C)C(=O)N(C)Cc1[nH+]ccn1C ZINC000336236287 176134180 /nfs/dbraw/zinc/13/41/80/176134180.db2.gz ACCIHBZVCBHKCH-BXUZGUMPSA-N 1 2 249.358 2.205 20 0 BEADLO C[C@@H]1CCC[C@H](C(=O)N2CCn3c[nH+]cc3C2)C1 ZINC000336019465 176135809 /nfs/dbraw/zinc/13/58/09/176135809.db2.gz KRJCCZZSXROLGB-NEPJUHHUSA-N 1 2 247.342 2.052 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)[C@H]1CCC[C@@H](C)C1 ZINC000357018793 176136724 /nfs/dbraw/zinc/13/67/24/176136724.db2.gz MKVRYQLDGOODDY-UPJWGTAASA-N 1 2 249.358 2.214 20 0 BEADLO C[C@@H]1CCC[C@H](CNC(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000283503855 176138489 /nfs/dbraw/zinc/13/84/89/176138489.db2.gz PEYNALOHNGWIEJ-AIIUZBJTSA-N 1 2 247.342 2.365 20 0 BEADLO C[C@@H]1CCN(C(=O)CCn2cc[nH+]c2)C[C@@H](C)C1 ZINC000269792373 176155877 /nfs/dbraw/zinc/15/58/77/176155877.db2.gz HHWURTJPIPRCNH-OLZOCXBDSA-N 1 2 249.358 2.168 20 0 BEADLO C[C@@H]1CCN(CC(F)(F)F)C[C@@H]1n1cc[nH+]c1 ZINC000156527700 176168155 /nfs/dbraw/zinc/16/81/55/176168155.db2.gz GFGRWOPROYIROI-ZJUUUORDSA-N 1 2 247.264 2.328 20 0 BEADLO C[C@@H]1CCN(c2nc(N)c3ccccc3[nH+]2)C1 ZINC000301816876 176182675 /nfs/dbraw/zinc/18/26/75/176182675.db2.gz JTSWFQCIZBDJLP-SECBINFHSA-N 1 2 228.299 2.058 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NCc2[nH]cc[nH+]2)C[C@H]1C ZINC000294717208 176195105 /nfs/dbraw/zinc/19/51/05/176195105.db2.gz UWINCQCSUYMSLZ-GMTAPVOTSA-N 1 2 235.331 2.098 20 0 BEADLO C[C@@H]1CC[C@@H](NC(=O)CCn2cc[nH+]c2)[C@H](C)C1 ZINC000264967658 176210344 /nfs/dbraw/zinc/21/03/44/176210344.db2.gz FQBBKGYFUHTUHY-JHJVBQTASA-N 1 2 249.358 2.214 20 0 BEADLO C[C@@H]1CC[C@@H]([NH2+]c2ccc(OCC(N)=O)cc2)C1 ZINC000080451876 176214112 /nfs/dbraw/zinc/21/41/12/176214112.db2.gz CDYUGUUCFSKEME-ZYHUDNBSSA-N 1 2 248.326 2.151 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc(F)ccc2N)[C@H](C)CO1 ZINC000035782503 176302262 /nfs/dbraw/zinc/30/22/62/176302262.db2.gz GTRQQWJKVPJYGA-NXEZZACHSA-N 1 2 238.306 2.017 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2N)[C@H](C)CO1 ZINC000035782503 176302263 /nfs/dbraw/zinc/30/22/63/176302263.db2.gz GTRQQWJKVPJYGA-NXEZZACHSA-N 1 2 238.306 2.017 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc(N)cc2Cl)CCO1 ZINC000049962939 176304533 /nfs/dbraw/zinc/30/45/33/176304533.db2.gz VBOKZOIZCMVRRR-SECBINFHSA-N 1 2 240.734 2.143 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc(N)cc2Cl)CCO1 ZINC000049962939 176304535 /nfs/dbraw/zinc/30/45/35/176304535.db2.gz VBOKZOIZCMVRRR-SECBINFHSA-N 1 2 240.734 2.143 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cn(-c3ccccc3)nn2)[C@@H]1C ZINC000336468801 176309841 /nfs/dbraw/zinc/30/98/41/176309841.db2.gz XOLHQVJNHHVQAX-VXGBXAGGSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cn(-c3ccccc3)nn2)[C@@H]1C ZINC000336468801 176309844 /nfs/dbraw/zinc/30/98/44/176309844.db2.gz XOLHQVJNHHVQAX-VXGBXAGGSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cocn2)Cc2ccccc2O1 ZINC000292859701 176309975 /nfs/dbraw/zinc/30/99/75/176309975.db2.gz VFGNRZSHBQNRRF-LLVKDONJSA-N 1 2 244.294 2.458 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cocn2)Cc2ccccc2O1 ZINC000292859701 176309977 /nfs/dbraw/zinc/30/99/77/176309977.db2.gz VFGNRZSHBQNRRF-LLVKDONJSA-N 1 2 244.294 2.458 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cncs2)C[C@@H](C2CC2)O1 ZINC000280646243 176310243 /nfs/dbraw/zinc/31/02/43/176310243.db2.gz RRQNGXDFCMGPDX-SKDRFNHKSA-N 1 2 238.356 2.142 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cncs2)C[C@@H](C2CC2)O1 ZINC000280646243 176310245 /nfs/dbraw/zinc/31/02/45/176310245.db2.gz RRQNGXDFCMGPDX-SKDRFNHKSA-N 1 2 238.356 2.142 20 0 BEADLO C[C@@H]1COCC[C@@H]1CNc1cc[nH+]c(C2CC2)n1 ZINC000286326780 176339671 /nfs/dbraw/zinc/33/96/71/176339671.db2.gz KBPSKSRTYVKJEF-ZYHUDNBSSA-N 1 2 247.342 2.439 20 0 BEADLO C[C@@H]1COCC[C@H]1CNc1cc[nH+]c(C2CC2)n1 ZINC000286326775 176343942 /nfs/dbraw/zinc/34/39/42/176343942.db2.gz KBPSKSRTYVKJEF-PWSUYJOCSA-N 1 2 247.342 2.439 20 0 BEADLO C[C@@H]1C[C@@H](Nc2cc(NC3CC3)[nH+]cn2)CCO1 ZINC000334027495 176380717 /nfs/dbraw/zinc/38/07/17/176380717.db2.gz IHBPYBVXSMNHJS-KOLCDFICSA-N 1 2 248.330 2.030 20 0 BEADLO C[C@@H]1C[C@@H](Nc2cc(NC3CC3)nc[nH+]2)CCO1 ZINC000334027495 176380719 /nfs/dbraw/zinc/38/07/19/176380719.db2.gz IHBPYBVXSMNHJS-KOLCDFICSA-N 1 2 248.330 2.030 20 0 BEADLO C[C@H](NC(=O)CCc1[nH]cc[nH+]1)C1CCCC1 ZINC000287438764 176791425 /nfs/dbraw/zinc/79/14/25/176791425.db2.gz LSGWZFFZMWGNJG-JTQLQIEISA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccon1)c1cccnc1 ZINC000309544284 176914313 /nfs/dbraw/zinc/91/43/13/176914313.db2.gz GNHXSWZTJHENQT-ZJUUUORDSA-N 1 2 217.272 2.481 20 0 BEADLO C[C@H](O)[C@H](C)n1cc[nH+]c1-c1ccccc1 ZINC000044186920 177013323 /nfs/dbraw/zinc/01/33/23/177013323.db2.gz DWJCYQSLAZIJJS-QWRGUYRKSA-N 1 2 216.284 2.492 20 0 BEADLO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1cnnn1C ZINC000271028114 177034564 /nfs/dbraw/zinc/03/45/64/177034564.db2.gz FJQMMMUHDZLFFL-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1cnnn1C ZINC000271028114 177034566 /nfs/dbraw/zinc/03/45/66/177034566.db2.gz FJQMMMUHDZLFFL-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO C[C@H](c1cccc(F)c1)[N@H+](C)Cc1nncn1C ZINC000299656662 177036979 /nfs/dbraw/zinc/03/69/79/177036979.db2.gz ZJUVECWKPWSRMT-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO C[C@H](c1cccc(F)c1)[N@@H+](C)Cc1nncn1C ZINC000299656662 177036980 /nfs/dbraw/zinc/03/69/80/177036980.db2.gz ZJUVECWKPWSRMT-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO C[C@H](c1ccccc1)[N@H+](C)Cc1cn(C)nn1 ZINC000336701651 177038768 /nfs/dbraw/zinc/03/87/68/177038768.db2.gz PXUMJABXISAEPL-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1ccccc1)[N@@H+](C)Cc1cn(C)nn1 ZINC000336701651 177038769 /nfs/dbraw/zinc/03/87/69/177038769.db2.gz PXUMJABXISAEPL-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1cccnc1)[N@H+](C)Cc1ccno1 ZINC000271477426 177044882 /nfs/dbraw/zinc/04/48/82/177044882.db2.gz GSFLLKSCSQHDLG-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1ccno1 ZINC000271477426 177044884 /nfs/dbraw/zinc/04/48/84/177044884.db2.gz GSFLLKSCSQHDLG-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H](c1cnccn1)[N@H+](C)Cc1ccccn1 ZINC000275779650 177051090 /nfs/dbraw/zinc/05/10/90/177051090.db2.gz ZRGMJSHNAXPWBS-LLVKDONJSA-N 1 2 228.299 2.065 20 0 BEADLO C[C@H](c1cnccn1)[N@@H+](C)Cc1ccccn1 ZINC000275779650 177051091 /nfs/dbraw/zinc/05/10/91/177051091.db2.gz ZRGMJSHNAXPWBS-LLVKDONJSA-N 1 2 228.299 2.065 20 0 BEADLO C[C@H](c1cnccn1)[N@@H+]1CCC[C@@](C)(F)C1 ZINC000295451556 177051426 /nfs/dbraw/zinc/05/14/26/177051426.db2.gz PLPVWQFANBHAIO-ZYHUDNBSSA-N 1 2 223.295 2.362 20 0 BEADLO C[C@H](c1cnccn1)[N@H+]1CCC[C@@](C)(F)C1 ZINC000295451556 177051428 /nfs/dbraw/zinc/05/14/28/177051428.db2.gz PLPVWQFANBHAIO-ZYHUDNBSSA-N 1 2 223.295 2.362 20 0 BEADLO C[C@H](c1nncn1C)[N@H+](C)Cc1cccc(F)c1 ZINC000287323138 177054583 /nfs/dbraw/zinc/05/45/83/177054583.db2.gz NRPJFTKYHOTZNX-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO C[C@H](c1nncn1C)[N@@H+](C)Cc1cccc(F)c1 ZINC000287323138 177054585 /nfs/dbraw/zinc/05/45/85/177054585.db2.gz NRPJFTKYHOTZNX-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO C[C@H]1CC(NC(=O)CCc2[nH]cc[nH+]2)C[C@H](C)C1 ZINC000287674972 177064751 /nfs/dbraw/zinc/06/47/51/177064751.db2.gz PHCLMQAIQDXPPA-GHMZBOCLSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H]1CC/C(=C\C(=O)Nc2ccc(N)[nH+]c2)C1 ZINC000269152243 177067084 /nfs/dbraw/zinc/06/70/84/177067084.db2.gz QDMJGRXAMURPKF-HZAKCSEPSA-N 1 2 231.299 2.349 20 0 BEADLO C[C@H]1CCCC[C@@H]1N(C)C(=O)CCn1cc[nH+]c1 ZINC000299619731 177080691 /nfs/dbraw/zinc/08/06/91/177080691.db2.gz QAXFRJWKCXQMFG-STQMWFEESA-N 1 2 249.358 2.310 20 0 BEADLO C[C@H]1CCCC[C@@H]1NC(=O)CCc1c[nH+]cn1C ZINC000188422337 177081595 /nfs/dbraw/zinc/08/15/95/177081595.db2.gz SHYMUKBYTWFYJC-AAEUAGOBSA-N 1 2 249.358 2.048 20 0 BEADLO C[C@H]1CCCC[C@@H]1OCCn1cc[nH+]c1 ZINC000121755702 177084395 /nfs/dbraw/zinc/08/43/95/177084395.db2.gz QXWNOJZZQYRVCO-RYUDHWBXSA-N 1 2 208.305 2.478 20 0 BEADLO C[C@H]1CCC[N@@H+]1Cc1nccn1C(F)F ZINC000076115332 177110601 /nfs/dbraw/zinc/11/06/01/177110601.db2.gz FSBWCEXNEWWYTK-QMMMGPOBSA-N 1 2 215.247 2.263 20 0 BEADLO C[C@H]1CCC[N@H+]1Cc1nccn1C(F)F ZINC000076115332 177110602 /nfs/dbraw/zinc/11/06/02/177110602.db2.gz FSBWCEXNEWWYTK-QMMMGPOBSA-N 1 2 215.247 2.263 20 0 BEADLO C[C@@H]1CCCN1c1cc(N2CCC[C@@H]2C)nc[nH+]1 ZINC000267589044 177112316 /nfs/dbraw/zinc/11/23/16/177112316.db2.gz CPGRTHLBUAOCDY-TXEJJXNPSA-N 1 2 246.358 2.454 20 0 BEADLO C[C@@H]1CCCN1c1cc(N2CCC[C@@H]2C)[nH+]cn1 ZINC000267589044 177112317 /nfs/dbraw/zinc/11/23/17/177112317.db2.gz CPGRTHLBUAOCDY-TXEJJXNPSA-N 1 2 246.358 2.454 20 0 BEADLO C[C@@H]1CCC[C@H](C)N1C(=O)CCc1c[nH+]cn1C ZINC000280467359 177115049 /nfs/dbraw/zinc/11/50/49/177115049.db2.gz HWFDOFUZKJUYRA-TXEJJXNPSA-N 1 2 249.358 2.142 20 0 BEADLO C[C@@H]1CCC[C@H](C)CN1C(=O)CCn1cc[nH+]c1 ZINC000336578797 177115079 /nfs/dbraw/zinc/11/50/79/177115079.db2.gz GLRBTIKCVMYFNC-QWHCGFSZSA-N 1 2 249.358 2.310 20 0 BEADLO C[C@H]1CCC[C@@H](N(C)C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000287550804 177120752 /nfs/dbraw/zinc/12/07/52/177120752.db2.gz LUQJUQMITXSZPR-NWDGAFQWSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H]1CCC[C@@H]1CC(=O)N1CCn2c[nH+]cc2C1 ZINC000290955793 177123791 /nfs/dbraw/zinc/12/37/91/177123791.db2.gz QUUYQMXPVJMAOC-NWDGAFQWSA-N 1 2 247.342 2.052 20 0 BEADLO C[C@H]1CCN(c2cc[nH+]c3ccncc32)C1 ZINC000267964698 177171879 /nfs/dbraw/zinc/17/18/79/177171879.db2.gz LRICGKQXSHWRIX-JTQLQIEISA-N 1 2 213.284 2.476 20 0 BEADLO C[C@H]1CC[C@H](CC(=O)N(C)Cc2[nH+]ccn2C)C1 ZINC000268299930 177200346 /nfs/dbraw/zinc/20/03/46/177200346.db2.gz XQGSXQNZPURHSB-RYUDHWBXSA-N 1 2 249.358 2.205 20 0 BEADLO C[C@H]1CN(C(=O)C=Cc2c[nH]c[nH+]2)C(C)(C)C1 ZINC000284289608 177210666 /nfs/dbraw/zinc/21/06/66/177210666.db2.gz FZVFEEMWYBHROB-ORAHPGNNSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1ncc(C2CC2)o1 ZINC000293522031 177270586 /nfs/dbraw/zinc/27/05/86/177270586.db2.gz WDFWBOSOUOHJJB-DTWKUNHWSA-N 1 2 206.289 2.392 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1ncc(C2CC2)o1 ZINC000293522031 177270588 /nfs/dbraw/zinc/27/05/88/177270588.db2.gz WDFWBOSOUOHJJB-DTWKUNHWSA-N 1 2 206.289 2.392 20 0 BEADLO C[C@H]1C[N@H+](Cc2cocn2)Cc2ccccc2O1 ZINC000292859714 177271350 /nfs/dbraw/zinc/27/13/50/177271350.db2.gz VFGNRZSHBQNRRF-NSHDSACASA-N 1 2 244.294 2.458 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cocn2)Cc2ccccc2O1 ZINC000292859714 177271351 /nfs/dbraw/zinc/27/13/51/177271351.db2.gz VFGNRZSHBQNRRF-NSHDSACASA-N 1 2 244.294 2.458 20 0 BEADLO C[C@H]1CN(c2[nH+]ccc3ccc(F)cc32)C[C@H]1O ZINC000354874043 177277867 /nfs/dbraw/zinc/27/78/67/177277867.db2.gz GRAIBNXIBSEVIA-TVQRCGJNSA-N 1 2 246.285 2.191 20 0 BEADLO C[C@@H]1CN(c2[nH]c3ccccc3[nH+]2)C[C@H](C)O1 ZINC000263735960 177278549 /nfs/dbraw/zinc/27/85/49/177278549.db2.gz GVOCQXZADFJQTI-AOOOYVTPSA-N 1 2 231.299 2.177 20 0 BEADLO C[C@H]1COCCN(c2cc[nH+]c3ccncc32)C1 ZINC000371102283 177289043 /nfs/dbraw/zinc/28/90/43/177289043.db2.gz WCZBJMLYQVKSJI-LLVKDONJSA-N 1 2 243.310 2.103 20 0 BEADLO C[C@H]1COCC[N@H+](Cc2cnc(Cl)s2)C1 ZINC000307128819 177289352 /nfs/dbraw/zinc/28/93/52/177289352.db2.gz JRVXJLXZOQTYTQ-MRVPVSSYSA-N 1 2 246.763 2.265 20 0 BEADLO C[C@H]1COCC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC000307128819 177289353 /nfs/dbraw/zinc/28/93/53/177289353.db2.gz JRVXJLXZOQTYTQ-MRVPVSSYSA-N 1 2 246.763 2.265 20 0 BEADLO C[C@H]1COCC[N@@H+]1Cc1ccccc1OC1CC1 ZINC000290098007 177291902 /nfs/dbraw/zinc/29/19/02/177291902.db2.gz RTLUMLPUUWRUAB-LBPRGKRZSA-N 1 2 247.338 2.449 20 0 BEADLO C[C@H]1COCC[N@H+]1Cc1ccccc1OC1CC1 ZINC000290098007 177291904 /nfs/dbraw/zinc/29/19/04/177291904.db2.gz RTLUMLPUUWRUAB-LBPRGKRZSA-N 1 2 247.338 2.449 20 0 BEADLO C[C@H]1COCC[C@@H]1Nc1cc[nH+]c2ccncc12 ZINC000277390927 177295552 /nfs/dbraw/zinc/29/55/52/177295552.db2.gz GISMNONSXQPIIE-JQWIXIFHSA-N 1 2 243.310 2.467 20 0 BEADLO C[C@H]1C[C@@H](CSCCn2cc[nH+]c2)CCO1 ZINC000362457244 177326147 /nfs/dbraw/zinc/32/61/47/177326147.db2.gz PJCXYEJSAVDMQP-RYUDHWBXSA-N 1 2 240.372 2.431 20 0 BEADLO C[C@@H]1CCN(C(=O)C=Cc2c[nH]c[nH+]2)[C@@H](C)C1 ZINC000283834274 177355259 /nfs/dbraw/zinc/35/52/59/177355259.db2.gz GLZDROKQMCAFTG-YHROSDCASA-N 1 2 233.315 2.070 20 0 BEADLO C[C@H]1C[C@H](C)C[NH+](Cc2nc(C(F)F)no2)C1 ZINC000335100287 177358784 /nfs/dbraw/zinc/35/87/84/177358784.db2.gz NNIXNLIIZBYXQD-YUMQZZPRSA-N 1 2 245.273 2.485 20 0 BEADLO C[C@H]1C[C@H](O)CN1c1cc(C(F)(F)F)cc[nH+]1 ZINC000335797208 177374720 /nfs/dbraw/zinc/37/47/20/177374720.db2.gz PENNFYGDPRIVJF-CBAPKCEASA-N 1 2 246.232 2.060 20 0 BEADLO C[C@H]1C[C@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000029951530 177377188 /nfs/dbraw/zinc/37/71/88/177377188.db2.gz JWPQYGYGFMLHLX-GXFFZTMASA-N 1 2 241.294 2.467 20 0 BEADLO C[C@H]1OCC[N@H+](CCCC(C)(C)C)[C@@H]1C(N)=O ZINC000330562319 177398001 /nfs/dbraw/zinc/39/80/01/177398001.db2.gz KJVNIWKLJSFBRV-MNOVXSKESA-N 1 2 242.363 2.437 20 0 BEADLO C[C@H]1OCC[N@@H+](CCCC(C)(C)C)[C@@H]1C(N)=O ZINC000330562319 177398002 /nfs/dbraw/zinc/39/80/02/177398002.db2.gz KJVNIWKLJSFBRV-MNOVXSKESA-N 1 2 242.363 2.437 20 0 BEADLO CCc1[nH]c(CNC(=O)C2(C)CCCC2)c[nH+]1 ZINC001652461613 1173082832 /nfs/dbraw/zinc/08/28/32/1173082832.db2.gz ZFTKEDXCYXBVDA-UHFFFAOYSA-N 1 2 235.331 2.169 20 0 BEADLO CCc1[nH]cc(CNC(=O)C2(C)CCCC2)[nH+]1 ZINC001652461613 1173082836 /nfs/dbraw/zinc/08/28/36/1173082836.db2.gz ZFTKEDXCYXBVDA-UHFFFAOYSA-N 1 2 235.331 2.169 20 0 BEADLO CCc1[nH]c(CNC(=O)C[C@@H]2CC=CCC2)c[nH+]1 ZINC001652463796 1173087063 /nfs/dbraw/zinc/08/70/63/1173087063.db2.gz OLXGAQWJICZBGD-LLVKDONJSA-N 1 2 247.342 2.335 20 0 BEADLO CCc1[nH]cc(CNC(=O)C[C@@H]2CC=CCC2)[nH+]1 ZINC001652463796 1173087071 /nfs/dbraw/zinc/08/70/71/1173087071.db2.gz OLXGAQWJICZBGD-LLVKDONJSA-N 1 2 247.342 2.335 20 0 BEADLO COc1ccc(CCNc2cc[nH+]cc2F)cc1 ZINC000678786853 487642792 /nfs/dbraw/zinc/64/27/92/487642792.db2.gz SSTLODWXONWIGT-UHFFFAOYSA-N 1 2 246.285 2.306 20 0 BEADLO Cc1cc(N[C@H](C)Cc2ccncc2)nc[nH+]1 ZINC000487665111 225320163 /nfs/dbraw/zinc/32/01/63/225320163.db2.gz BQOYZNZOPUVFSZ-LLVKDONJSA-N 1 2 228.299 2.223 20 0 BEADLO Cc1noc(C)c1N(C)CCCn1cc[nH+]c1 ZINC000678805839 487646041 /nfs/dbraw/zinc/64/60/41/487646041.db2.gz GRMYGVBEVLNENC-UHFFFAOYSA-N 1 2 234.303 2.014 20 0 BEADLO C[C@@H]1C[C@@H]1c1noc(CCCn2cc[nH+]c2)n1 ZINC000680773956 487646364 /nfs/dbraw/zinc/64/63/64/487646364.db2.gz PAVHUBYECCDAEZ-ZJUUUORDSA-N 1 2 232.287 2.022 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)C=Cc2c[nH]c[nH+]2)[C@H](C)C1 ZINC000492815712 226060876 /nfs/dbraw/zinc/06/08/76/226060876.db2.gz XPISVJSKZSMGKA-ZOXFSHNNSA-N 1 2 247.342 2.364 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)Nc1ccc(F)cc1 ZINC000492866547 226070966 /nfs/dbraw/zinc/07/09/66/226070966.db2.gz QHFNISMRXRVQLI-AATRIKPKSA-N 1 2 231.230 2.201 20 0 BEADLO Cc1cc(O)ccc1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492868673 226071413 /nfs/dbraw/zinc/07/14/13/226071413.db2.gz TYKCINMQRVQWQK-GORDUTHDSA-N 1 2 243.266 2.076 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)NCCC1CCCC1 ZINC000492895726 226078108 /nfs/dbraw/zinc/07/81/08/226078108.db2.gz IJOHUEVWFOEDOF-WAYWQWQTSA-N 1 2 233.315 2.119 20 0 BEADLO CN(C(=O)C=Cc1c[nH]c[nH+]1)C1(C)CCCC1 ZINC000492897568 226078141 /nfs/dbraw/zinc/07/81/41/226078141.db2.gz KCJIPXPJBPIVIY-AATRIKPKSA-N 1 2 233.315 2.214 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CCCCCCC1 ZINC000493306839 226181468 /nfs/dbraw/zinc/18/14/68/226181468.db2.gz SKFXXWTZOLYKHQ-VOTSOKGWSA-N 1 2 233.315 2.216 20 0 BEADLO CN(C(=O)/C=C\c1[nH]cc[nH+]1)C(C1CC1)C1CC1 ZINC000493164906 226142827 /nfs/dbraw/zinc/14/28/27/226142827.db2.gz XARXDXYRHWMZJA-SREVYHEPSA-N 1 2 245.326 2.070 20 0 BEADLO C[C@H]1CC2(CCC2)CN1C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493676217 226248711 /nfs/dbraw/zinc/24/87/11/226248711.db2.gz SGPBJCSZUNZAAI-UFFNRZRYSA-N 1 2 245.326 2.214 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)N(CC1CC1)C1CCC1 ZINC000493793134 226254460 /nfs/dbraw/zinc/25/44/60/226254460.db2.gz RIHKKKFJUCEGAI-VOTSOKGWSA-N 1 2 245.326 2.214 20 0 BEADLO C[C@@H]1CCCC[C@@H]1N(C)C(=O)/C=C\c1[nH]cc[nH+]1 ZINC000493818310 226255575 /nfs/dbraw/zinc/25/55/75/226255575.db2.gz SKHZMYIFKULPAT-WZIXFXTNSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@H]([NH2+]Cc1noc2c1CCCC2)c1cn[nH]c1 ZINC000680833869 487655416 /nfs/dbraw/zinc/65/54/16/487655416.db2.gz HKNCXNUFLOJURG-VIFPVBQESA-N 1 2 246.314 2.127 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCC[C@@H]2c2cc[nH]n2)c1 ZINC000671628584 487656576 /nfs/dbraw/zinc/65/65/76/487656576.db2.gz UQRBSOVTGMBTHZ-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccnc(C[N@H+]2CCC[C@@H]2c2cc[nH]n2)c1 ZINC000671628584 487656579 /nfs/dbraw/zinc/65/65/79/487656579.db2.gz UQRBSOVTGMBTHZ-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cccnc1)C(F)F ZINC000228483502 487656720 /nfs/dbraw/zinc/65/67/20/487656720.db2.gz YGNASSQUHAMFFZ-JGVFFNPUSA-N 1 2 200.232 2.386 20 0 BEADLO C[C@H]([NH2+][C@@H](C)C(F)F)c1ccncc1 ZINC000228482556 487656777 /nfs/dbraw/zinc/65/67/77/487656777.db2.gz NJIUIJWKHHNXAZ-YUMQZZPRSA-N 1 2 200.232 2.386 20 0 BEADLO CC[C@H](C)[C@H](C[N@@H+]1CC[C@H]1C(F)F)OC ZINC000895431428 583671072 /nfs/dbraw/zinc/67/10/72/583671072.db2.gz MOFWGNPRCJXJDR-GUBZILKMSA-N 1 2 221.291 2.387 20 0 BEADLO CC[C@H](C)[C@H](C[N@H+]1CC[C@H]1C(F)F)OC ZINC000895431428 583671074 /nfs/dbraw/zinc/67/10/74/583671074.db2.gz MOFWGNPRCJXJDR-GUBZILKMSA-N 1 2 221.291 2.387 20 0 BEADLO Cc1cccc(NC(=O)C[NH+]2CC(C)(C)C2)c1 ZINC000557422498 322937074 /nfs/dbraw/zinc/93/70/74/322937074.db2.gz DSFSNVCQAIAEGD-UHFFFAOYSA-N 1 2 232.327 2.275 20 0 BEADLO OCc1ccc(C[NH2+]C2(C(F)F)CCCC2)o1 ZINC000674132061 487665834 /nfs/dbraw/zinc/66/58/34/487665834.db2.gz MVNVSDWJIWFXGS-UHFFFAOYSA-N 1 2 245.269 2.439 20 0 BEADLO CCc1cc(N[C@H]2CCO[C@H](C3CC3)C2)nc[nH+]1 ZINC000680899436 487669435 /nfs/dbraw/zinc/66/94/35/487669435.db2.gz MVNIWNJAHHXDOQ-STQMWFEESA-N 1 2 247.342 2.409 20 0 BEADLO Cc1ccc(F)cc1C[NH2+][C@H](C)c1ncn(C)n1 ZINC000391876852 262756670 /nfs/dbraw/zinc/75/66/70/262756670.db2.gz QSTUTZOKICNMMF-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO Cc1cccc(C[NH2+]Cc2cc[nH]n2)c1F ZINC000394959400 262758665 /nfs/dbraw/zinc/75/86/65/262758665.db2.gz MPLKSYXVUQSHDO-UHFFFAOYSA-N 1 2 219.263 2.147 20 0 BEADLO C[C@H]1CC[C@H](C[N@@H+]2CCC[C@@H]2C(F)F)O1 ZINC000513208684 229394566 /nfs/dbraw/zinc/39/45/66/229394566.db2.gz AXQVIPFQLMUBLQ-IVZWLZJFSA-N 1 2 219.275 2.283 20 0 BEADLO C[C@H]1CC[C@H](C[N@H+]2CCC[C@@H]2C(F)F)O1 ZINC000513208684 229394571 /nfs/dbraw/zinc/39/45/71/229394571.db2.gz AXQVIPFQLMUBLQ-IVZWLZJFSA-N 1 2 219.275 2.283 20 0 BEADLO CCc1cc(N[C@@H]2CCO[C@H]2CC)nc[nH+]1 ZINC000665740068 487681061 /nfs/dbraw/zinc/68/10/61/487681061.db2.gz APXAUYKBUGCMQG-MNOVXSKESA-N 1 2 221.304 2.018 20 0 BEADLO CC[N@H+](Cc1ccncc1)[C@H](C)c1nc(C)no1 ZINC000678083310 487694035 /nfs/dbraw/zinc/69/40/35/487694035.db2.gz ADHBGPSFBBIBPF-SNVBAGLBSA-N 1 2 246.314 2.356 20 0 BEADLO CC[N@@H+](Cc1ccncc1)[C@H](C)c1nc(C)no1 ZINC000678083310 487694039 /nfs/dbraw/zinc/69/40/39/487694039.db2.gz ADHBGPSFBBIBPF-SNVBAGLBSA-N 1 2 246.314 2.356 20 0 BEADLO CCOCn1c[nH+]c2c1C[C@H](C)[C@@H](C)C2 ZINC000308951980 487694276 /nfs/dbraw/zinc/69/42/76/487694276.db2.gz VLZYVGVZEWBRQF-UWVGGRQHSA-N 1 2 208.305 2.248 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H]1CC12CCC2 ZINC000675320493 487702145 /nfs/dbraw/zinc/70/21/45/487702145.db2.gz LENHXPLHSURQMD-VIFPVBQESA-N 1 2 232.283 2.219 20 0 BEADLO Cc1cc(C(=O)Nc2cc[nH+]c(C)c2)cs1 ZINC000671720857 487707254 /nfs/dbraw/zinc/70/72/54/487707254.db2.gz NFQQISZAAUUQHC-UHFFFAOYSA-N 1 2 232.308 2.434 20 0 BEADLO CCC(C)(CC)C(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000681058430 487708859 /nfs/dbraw/zinc/70/88/59/487708859.db2.gz MJDAENBTBPPBQR-SNVBAGLBSA-N 1 2 249.358 2.210 20 0 BEADLO CCC(C)(CC)C(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000681058430 487708864 /nfs/dbraw/zinc/70/88/64/487708864.db2.gz MJDAENBTBPPBQR-SNVBAGLBSA-N 1 2 249.358 2.210 20 0 BEADLO CNc1ccccc1C[NH2+]CC(C)(F)F ZINC000902574653 584637359 /nfs/dbraw/zinc/63/73/59/584637359.db2.gz IZNNRJRLEAOOSF-UHFFFAOYSA-N 1 2 214.259 2.473 20 0 BEADLO CCc1cc(NC[C@@H](C)CCOC)nc[nH+]1 ZINC000665743974 487720835 /nfs/dbraw/zinc/72/08/35/487720835.db2.gz FMODKNOYBPKCMD-JTQLQIEISA-N 1 2 223.320 2.124 20 0 BEADLO CCc1cc(N2C[C@H](CC)OC[C@@H]2C)nc(C)[nH+]1 ZINC000651405107 487727825 /nfs/dbraw/zinc/72/78/25/487727825.db2.gz JRHURKNQDFYOKE-GWCFXTLKSA-N 1 2 249.358 2.351 20 0 BEADLO CCN(c1cc[nH+]c(C2CC2)n1)[C@@H]1CCCOC1 ZINC000651415501 487735339 /nfs/dbraw/zinc/73/53/39/487735339.db2.gz GLVQJRYLOVCDMW-GFCCVEGCSA-N 1 2 247.342 2.359 20 0 BEADLO CCC(CC)(CC)C(=O)NCCc1[nH]cc[nH+]1 ZINC000675459904 487735443 /nfs/dbraw/zinc/73/54/43/487735443.db2.gz IHQKFWPJEMBOCT-UHFFFAOYSA-N 1 2 237.347 2.285 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1c1nc[nH+]c2c1OCCN2 ZINC000665710097 487737684 /nfs/dbraw/zinc/73/76/84/487737684.db2.gz WATKEEKLNRRMGP-ZJUUUORDSA-N 1 2 248.330 2.048 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1c1[nH+]cnc2c1OCCN2 ZINC000665710097 487737689 /nfs/dbraw/zinc/73/76/89/487737689.db2.gz WATKEEKLNRRMGP-ZJUUUORDSA-N 1 2 248.330 2.048 20 0 BEADLO CCC(C)(C)N(C)C(=O)[C@@H]1CCc2c[nH+]cn2C1 ZINC000668900534 487739072 /nfs/dbraw/zinc/73/90/72/487739072.db2.gz SUKSJLOWEHMHQQ-LLVKDONJSA-N 1 2 249.358 2.093 20 0 BEADLO CN(C)c1ccc(C[N@@H+]2CCC=C(F)C2)cn1 ZINC000681164178 487740032 /nfs/dbraw/zinc/74/00/32/487740032.db2.gz CJVPKTYHZQMOPU-UHFFFAOYSA-N 1 2 235.306 2.207 20 0 BEADLO CN(C)c1ccc(C[N@H+]2CCC=C(F)C2)cn1 ZINC000681164178 487740037 /nfs/dbraw/zinc/74/00/37/487740037.db2.gz CJVPKTYHZQMOPU-UHFFFAOYSA-N 1 2 235.306 2.207 20 0 BEADLO CCc1cc(NC[C@@H]2C[C@@H](C)O[C@@H]2C)nc[nH+]1 ZINC000665747392 487748883 /nfs/dbraw/zinc/74/88/83/487748883.db2.gz OFBJQJLZXMQUDM-MXWKQRLJSA-N 1 2 235.331 2.264 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CCc2ccsc2C1 ZINC000290328586 487751253 /nfs/dbraw/zinc/75/12/53/487751253.db2.gz CIKPFIJCDIEFAD-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CCc2ccsc2C1 ZINC000290328586 487751258 /nfs/dbraw/zinc/75/12/58/487751258.db2.gz CIKPFIJCDIEFAD-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCc2ccsc2C1 ZINC000290328586 487751261 /nfs/dbraw/zinc/75/12/61/487751261.db2.gz CIKPFIJCDIEFAD-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCc2ccsc2C1 ZINC000290328586 487751267 /nfs/dbraw/zinc/75/12/67/487751267.db2.gz CIKPFIJCDIEFAD-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cl/C=C(\Cl)C[N@@H+]1CCC[C@@H]2COC[C@@H]21 ZINC000839193456 585097922 /nfs/dbraw/zinc/09/79/22/585097922.db2.gz UYYISTNATNDOPO-OVGMLNDJSA-N 1 2 236.142 2.416 20 0 BEADLO Cl/C=C(\Cl)C[N@H+]1CCC[C@@H]2COC[C@@H]21 ZINC000839193456 585097923 /nfs/dbraw/zinc/09/79/23/585097923.db2.gz UYYISTNATNDOPO-OVGMLNDJSA-N 1 2 236.142 2.416 20 0 BEADLO Cc1cccn2cc(CNC(=O)CCCF)[nH+]c12 ZINC000668448421 487770205 /nfs/dbraw/zinc/77/02/05/487770205.db2.gz DECGGAXNENDREV-UHFFFAOYSA-N 1 2 249.289 2.009 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)C1CCC2(CC2)CC1 ZINC000668448768 487770690 /nfs/dbraw/zinc/77/06/90/487770690.db2.gz VEYTWOHVHMEKRA-UHFFFAOYSA-N 1 2 247.342 2.339 20 0 BEADLO COCCC1(C)C[NH+](Cc2ccncc2F)C1 ZINC000459638799 487783641 /nfs/dbraw/zinc/78/36/41/487783641.db2.gz UKSARNBVCPAXQI-UHFFFAOYSA-N 1 2 238.306 2.079 20 0 BEADLO CC1(C)C[C@H]1[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000675877083 487784829 /nfs/dbraw/zinc/78/48/29/487784829.db2.gz BVMSZFXLQAFGBB-VXGBXAGGSA-N 1 2 242.326 2.282 20 0 BEADLO COc1cccc2c1CC[C@H]2[NH2+]Cc1ccon1 ZINC000675926179 487792042 /nfs/dbraw/zinc/79/20/42/487792042.db2.gz SMZJMZSVGJKSDG-CYBMUJFWSA-N 1 2 244.294 2.460 20 0 BEADLO CCc1nc(C[NH+]2CC(CCOC)C2)cs1 ZINC000668473011 487797979 /nfs/dbraw/zinc/79/79/79/487797979.db2.gz UKUQTEHKQJVTBG-UHFFFAOYSA-N 1 2 240.372 2.174 20 0 BEADLO Cc1nnc(C[N@@H+](C)[C@@H]2C[C@H]2c2ccccc2)o1 ZINC000676043721 487804626 /nfs/dbraw/zinc/80/46/26/487804626.db2.gz LWKDRBPDCOXGQX-QWHCGFSZSA-N 1 2 243.310 2.366 20 0 BEADLO Cc1nnc(C[N@H+](C)[C@@H]2C[C@H]2c2ccccc2)o1 ZINC000676043721 487804629 /nfs/dbraw/zinc/80/46/29/487804629.db2.gz LWKDRBPDCOXGQX-QWHCGFSZSA-N 1 2 243.310 2.366 20 0 BEADLO Cc1nc(N(C)C)nc(NCC2(C(C)C)CC2)[nH+]1 ZINC000676083060 487811790 /nfs/dbraw/zinc/81/17/90/487811790.db2.gz XTQSDRWDGXFUQQ-UHFFFAOYSA-N 1 2 249.362 2.094 20 0 BEADLO Cc1nc(NCC2(C(C)C)CC2)nc(N(C)C)[nH+]1 ZINC000676083060 487811794 /nfs/dbraw/zinc/81/17/94/487811794.db2.gz XTQSDRWDGXFUQQ-UHFFFAOYSA-N 1 2 249.362 2.094 20 0 BEADLO CC(C)(C)C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000074828224 487822471 /nfs/dbraw/zinc/82/24/71/487822471.db2.gz BHOFTHSHPNZVFX-UHFFFAOYSA-N 1 2 235.331 2.162 20 0 BEADLO CC1=CCC[N@H+](Cn2cc(Cl)cn2)C1 ZINC000797822752 586132439 /nfs/dbraw/zinc/13/24/39/586132439.db2.gz QYEDTJBGNLLWPN-UHFFFAOYSA-N 1 2 211.696 2.146 20 0 BEADLO CC1=CCC[N@@H+](Cn2cc(Cl)cn2)C1 ZINC000797822752 586132440 /nfs/dbraw/zinc/13/24/40/586132440.db2.gz QYEDTJBGNLLWPN-UHFFFAOYSA-N 1 2 211.696 2.146 20 0 BEADLO C[C@H]1CSC[C@@H]1[NH2+]Cc1nnsc1Cl ZINC000306438480 322949443 /nfs/dbraw/zinc/94/94/43/322949443.db2.gz GKZJCFLPNOTJGV-FSPLSTOPSA-N 1 2 249.792 2.033 20 0 BEADLO FC1CC[NH+](Cc2nccs2)CC1 ZINC000880239878 590972244 /nfs/dbraw/zinc/97/22/44/590972244.db2.gz HZPRPUGDQDPFNH-UHFFFAOYSA-N 1 2 200.282 2.077 20 0 BEADLO Cc1ccc(CSc2nc(N)cc(C)[nH+]2)nc1 ZINC000676407414 487847936 /nfs/dbraw/zinc/84/79/36/487847936.db2.gz FXHBDHAIWJFLNL-UHFFFAOYSA-N 1 2 246.339 2.363 20 0 BEADLO COc1ccc[nH+]c1NCCc1ncccc1C ZINC000404832829 322951478 /nfs/dbraw/zinc/95/14/78/322951478.db2.gz ITSXBDLDVYMFBS-UHFFFAOYSA-N 1 2 243.310 2.448 20 0 BEADLO C[C@H]1CC[N@H+](Cc2cncc(F)c2)C[C@@H]1F ZINC000681751019 487853436 /nfs/dbraw/zinc/85/34/36/487853436.db2.gz PVTLUAZDJIWGCI-CABZTGNLSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2cncc(F)c2)C[C@@H]1F ZINC000681751019 487853439 /nfs/dbraw/zinc/85/34/39/487853439.db2.gz PVTLUAZDJIWGCI-CABZTGNLSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cncc(F)c2)C[C@H]1F ZINC000681751015 487853624 /nfs/dbraw/zinc/85/36/24/487853624.db2.gz PVTLUAZDJIWGCI-BXKDBHETSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cncc(F)c2)C[C@H]1F ZINC000681751015 487853630 /nfs/dbraw/zinc/85/36/30/487853630.db2.gz PVTLUAZDJIWGCI-BXKDBHETSA-N 1 2 226.270 2.401 20 0 BEADLO CCC[C@H](C)C[N@@H+]1CC[C@H](O)C(F)(F)C1 ZINC000668499833 487856563 /nfs/dbraw/zinc/85/65/63/487856563.db2.gz MSDFRIVYWZKKLY-UWVGGRQHSA-N 1 2 221.291 2.125 20 0 BEADLO CCC[C@H](C)C[N@H+]1CC[C@H](O)C(F)(F)C1 ZINC000668499833 487856568 /nfs/dbraw/zinc/85/65/68/487856568.db2.gz MSDFRIVYWZKKLY-UWVGGRQHSA-N 1 2 221.291 2.125 20 0 BEADLO Cc1ccnc([C@H](C)[NH2+]Cc2ccno2)c1 ZINC000564452845 322954972 /nfs/dbraw/zinc/95/49/72/322954972.db2.gz IFXGLRJXJVOXBO-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO FCC[C@H]1CCC[N@H+](Cc2csnn2)C1 ZINC000661687816 487865804 /nfs/dbraw/zinc/86/58/04/487865804.db2.gz CUJRWDSIYQYUSK-SECBINFHSA-N 1 2 229.324 2.110 20 0 BEADLO FCC[C@H]1CCC[N@@H+](Cc2csnn2)C1 ZINC000661687816 487865807 /nfs/dbraw/zinc/86/58/07/487865807.db2.gz CUJRWDSIYQYUSK-SECBINFHSA-N 1 2 229.324 2.110 20 0 BEADLO CCOc1cc(N[C@H](C)c2[nH]cc[nH+]2)nc(C)n1 ZINC000139887542 487869541 /nfs/dbraw/zinc/86/95/41/487869541.db2.gz LVIMCGDDAAKFQZ-MRVPVSSYSA-N 1 2 247.302 2.080 20 0 BEADLO C[C@@H](Cc1nc(C2CCC2)no1)n1cc[nH+]c1 ZINC000650534998 487875528 /nfs/dbraw/zinc/87/55/28/487875528.db2.gz KFMZHFRPODXTNT-VIFPVBQESA-N 1 2 232.287 2.337 20 0 BEADLO CO[C@@H]1C[C@H]([NH2+]CC(F)(F)C(F)F)C1(C)C ZINC000304541588 644914633 /nfs/dbraw/zinc/91/46/33/644914633.db2.gz NMWSWUYKLPVDSY-NKWVEPMBSA-N 1 2 243.244 2.290 20 0 BEADLO CC[C@@H](NC(=O)CCC(C)(F)F)c1[nH]cc[nH+]1 ZINC000682040517 487888519 /nfs/dbraw/zinc/88/85/19/487888519.db2.gz GNFIPKQDWLHUPY-MRVPVSSYSA-N 1 2 245.273 2.412 20 0 BEADLO Cn1cnnc1C[N@H+](C)C(C)(C)c1ccccc1 ZINC000671245691 487888807 /nfs/dbraw/zinc/88/88/07/487888807.db2.gz KFAPEBOSEMDYTN-UHFFFAOYSA-N 1 2 244.342 2.182 20 0 BEADLO Cn1cnnc1C[N@@H+](C)C(C)(C)c1ccccc1 ZINC000671245691 487888809 /nfs/dbraw/zinc/88/88/09/487888809.db2.gz KFAPEBOSEMDYTN-UHFFFAOYSA-N 1 2 244.342 2.182 20 0 BEADLO CC(C)n1ccnc1C[N@@H+]1CCCOC[C@H]1C ZINC000676712670 487900881 /nfs/dbraw/zinc/90/08/81/487900881.db2.gz LLXHZFBWKNISSM-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccnc1C[N@H+]1CCCOC[C@H]1C ZINC000676712670 487900885 /nfs/dbraw/zinc/90/08/85/487900885.db2.gz LLXHZFBWKNISSM-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO C[C@@H](c1nc(C2CC2)no1)[N@H+]1CC=CCC1 ZINC000679324373 487905897 /nfs/dbraw/zinc/90/58/97/487905897.db2.gz QMSPYKHKQKOASH-VIFPVBQESA-N 1 2 219.288 2.270 20 0 BEADLO C[C@@H](c1nc(C2CC2)no1)[N@@H+]1CC=CCC1 ZINC000679324373 487905903 /nfs/dbraw/zinc/90/59/03/487905903.db2.gz QMSPYKHKQKOASH-VIFPVBQESA-N 1 2 219.288 2.270 20 0 BEADLO CCC[C@H](C)[N@H+](C)Cc1nnn(C(C)(C)C)n1 ZINC000653492120 487922842 /nfs/dbraw/zinc/92/28/42/487922842.db2.gz ZBLZBKKUVSPGRV-JTQLQIEISA-N 1 2 239.367 2.049 20 0 BEADLO CCC[C@H](C)[N@@H+](C)Cc1nnn(C(C)(C)C)n1 ZINC000653492120 487922846 /nfs/dbraw/zinc/92/28/46/487922846.db2.gz ZBLZBKKUVSPGRV-JTQLQIEISA-N 1 2 239.367 2.049 20 0 BEADLO Cc1n[nH]cc1CNc1cc(C)c[nH+]c1C ZINC000404569923 487927546 /nfs/dbraw/zinc/92/75/46/487927546.db2.gz GXCADYXIMBHZAX-UHFFFAOYSA-N 1 2 216.288 2.342 20 0 BEADLO Cc1c[nH+]c(C)c(NCc2cnn(C)c2)c1 ZINC000404579468 487928248 /nfs/dbraw/zinc/92/82/48/487928248.db2.gz OUOOEUGDERPZRV-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CC[C@H](C(F)F)C2)s1 ZINC000669932269 487935349 /nfs/dbraw/zinc/93/53/49/487935349.db2.gz DDDMRRLXPOZBQJ-SVRRBLITSA-N 1 2 247.314 2.495 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CC[C@H](C(F)F)C2)s1 ZINC000669932269 487935354 /nfs/dbraw/zinc/93/53/54/487935354.db2.gz DDDMRRLXPOZBQJ-SVRRBLITSA-N 1 2 247.314 2.495 20 0 BEADLO CO[C@H]1CCCN(c2cc[nH+]c(C3CC3)n2)CC1 ZINC000679933264 487944750 /nfs/dbraw/zinc/94/47/50/487944750.db2.gz GHGBBCKRLGAWJQ-LBPRGKRZSA-N 1 2 247.342 2.359 20 0 BEADLO CC1(F)C[NH+](C[C@H](O)CCc2ccccc2)C1 ZINC000684607897 487945729 /nfs/dbraw/zinc/94/57/29/487945729.db2.gz OQCAKXPOKLVIQZ-CYBMUJFWSA-N 1 2 237.318 2.024 20 0 BEADLO C[C@@H]1CCCCN(C(=O)CCCn2cc[nH+]c2)C1 ZINC000681251583 487950995 /nfs/dbraw/zinc/95/09/95/487950995.db2.gz JNTZCIPGQPIIJR-CYBMUJFWSA-N 1 2 249.358 2.312 20 0 BEADLO CCOCCOc1ccccc1-n1cc[nH+]c1 ZINC000569380510 322964998 /nfs/dbraw/zinc/96/49/98/322964998.db2.gz QBRKPWRNFJMRFR-UHFFFAOYSA-N 1 2 232.283 2.288 20 0 BEADLO Cc1c[nH+]c(C)nc1NC[C@]1(C)CCCS1 ZINC000566485070 323001524 /nfs/dbraw/zinc/00/15/24/323001524.db2.gz XQLKQHURNAQOLL-LBPRGKRZSA-N 1 2 237.372 2.213 20 0 BEADLO CN(C)c1ccc(NCc2ccncc2)[nH+]c1 ZINC000150909421 323002457 /nfs/dbraw/zinc/00/24/57/323002457.db2.gz NAIHAPZJYXGAFU-UHFFFAOYSA-N 1 2 228.299 2.155 20 0 BEADLO Cc1ccc([S@@](=O)Cc2[nH+]ccn2C)cc1C ZINC000129240823 323008488 /nfs/dbraw/zinc/00/84/88/323008488.db2.gz GDLFEDBZNXRRKJ-QGZVFWFLSA-N 1 2 248.351 2.345 20 0 BEADLO CC(C)(C)C(C)(C)CNC(=O)Cn1cc[nH+]c1 ZINC000562063473 323011295 /nfs/dbraw/zinc/01/12/95/323011295.db2.gz DDYWRXSOLYMHMN-UHFFFAOYSA-N 1 2 237.347 2.072 20 0 BEADLO CC[C@@H]1CN(c2[nH+]ccc3ccccc32)C[C@H]1O ZINC000400275863 323015789 /nfs/dbraw/zinc/01/57/89/323015789.db2.gz GFVDLPCYGQLQBD-BXUZGUMPSA-N 1 2 242.322 2.442 20 0 BEADLO c1nc(C2CC2)sc1C[NH2+]Cc1ncccn1 ZINC000566807895 323016657 /nfs/dbraw/zinc/01/66/57/323016657.db2.gz IKIPTGACJWBAHO-UHFFFAOYSA-N 1 2 246.339 2.100 20 0 BEADLO CCC(C)(C)[C@@H]1CCCN1C(=O)Cn1cc[nH+]c1 ZINC000562346346 323017413 /nfs/dbraw/zinc/01/74/13/323017413.db2.gz XWKVTVIXWWATOM-LBPRGKRZSA-N 1 2 249.358 2.310 20 0 BEADLO C[C@H](O)C[N@H+](Cc1cocn1)Cc1ccccc1 ZINC000562418629 323019299 /nfs/dbraw/zinc/01/92/99/323019299.db2.gz YGZSQSGBITXDFC-LBPRGKRZSA-N 1 2 246.310 2.058 20 0 BEADLO C[C@H](O)C[N@@H+](Cc1cocn1)Cc1ccccc1 ZINC000562418629 323019300 /nfs/dbraw/zinc/01/93/00/323019300.db2.gz YGZSQSGBITXDFC-LBPRGKRZSA-N 1 2 246.310 2.058 20 0 BEADLO C[C@@H]1C[C@@H](NCC(C)(F)F)c2[nH+]ccn21 ZINC000562794100 323030910 /nfs/dbraw/zinc/03/09/10/323030910.db2.gz BMYNCUAVSGWGJN-HTQZYQBOSA-N 1 2 215.247 2.134 20 0 BEADLO CC1=C(C)CN(C(=O)[C@@H](C)Cc2c[nH+]c[nH]2)CC1 ZINC000570107685 323050261 /nfs/dbraw/zinc/05/02/61/323050261.db2.gz TVCASYKJFIYVFS-NSHDSACASA-N 1 2 247.342 2.157 20 0 BEADLO CC1=C(C)CN(C(=O)[C@@H](C)Cc2c[nH]c[nH+]2)CC1 ZINC000570107685 323050262 /nfs/dbraw/zinc/05/02/62/323050262.db2.gz TVCASYKJFIYVFS-NSHDSACASA-N 1 2 247.342 2.157 20 0 BEADLO Fc1ccc(CCn2cc[nH+]c2)cc1F ZINC000153337406 323050852 /nfs/dbraw/zinc/05/08/52/323050852.db2.gz WOMNNVIRWVDTCE-UHFFFAOYSA-N 1 2 208.211 2.404 20 0 BEADLO Cc1cc(NC(=O)C(C)(C)C2CC2)c(C)c[nH+]1 ZINC000570241384 323053931 /nfs/dbraw/zinc/05/39/31/323053931.db2.gz FVRGJOQBENBGEN-UHFFFAOYSA-N 1 2 232.327 2.495 20 0 BEADLO CCC[N@@H+]1CC(=O)N[C@@H]1[C@H]1CCCC(C)(C)C1 ZINC000570301089 323055689 /nfs/dbraw/zinc/05/56/89/323055689.db2.gz ZKBGQDKLKSBXIA-AAEUAGOBSA-N 1 2 238.375 2.371 20 0 BEADLO CCC[N@H+]1CC(=O)N[C@@H]1[C@H]1CCCC(C)(C)C1 ZINC000570301089 323055690 /nfs/dbraw/zinc/05/56/90/323055690.db2.gz ZKBGQDKLKSBXIA-AAEUAGOBSA-N 1 2 238.375 2.371 20 0 BEADLO Cc1oncc1C[N@@H+](C)Cc1cccc(C)n1 ZINC000570388656 323057926 /nfs/dbraw/zinc/05/79/26/323057926.db2.gz RPATXKYYPRNQDB-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1oncc1C[N@H+](C)Cc1cccc(C)n1 ZINC000570388656 323057927 /nfs/dbraw/zinc/05/79/27/323057927.db2.gz RPATXKYYPRNQDB-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO C[C@H]1CC[C@@H](CNc2cc(NC3CC3)nc[nH+]2)O1 ZINC000570421043 323059078 /nfs/dbraw/zinc/05/90/78/323059078.db2.gz DTPSAJJFTHWJEM-ONGXEEELSA-N 1 2 248.330 2.030 20 0 BEADLO C[C@H]1CC[C@@H](CNc2cc(NC3CC3)[nH+]cn2)O1 ZINC000570421043 323059079 /nfs/dbraw/zinc/05/90/79/323059079.db2.gz DTPSAJJFTHWJEM-ONGXEEELSA-N 1 2 248.330 2.030 20 0 BEADLO CCc1noc(C)c1C[N@@H+]1CCO[C@@H](C)[C@@H]1C ZINC000156369729 323065634 /nfs/dbraw/zinc/06/56/34/323065634.db2.gz KEOUOBOXAWGPEU-UWVGGRQHSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1noc(C)c1C[N@H+]1CCO[C@@H](C)[C@@H]1C ZINC000156369729 323065635 /nfs/dbraw/zinc/06/56/35/323065635.db2.gz KEOUOBOXAWGPEU-UWVGGRQHSA-N 1 2 238.331 2.155 20 0 BEADLO c1ccc2[nH+]c(N3CC[C@@H]4OCC[C@@H]4C3)[nH]c2c1 ZINC000570714135 323068252 /nfs/dbraw/zinc/06/82/52/323068252.db2.gz HTCWGHSVCSRZMR-MFKMUULPSA-N 1 2 243.310 2.178 20 0 BEADLO CC(C)CC[N@H+](C)Cc1noc(C2CC2)n1 ZINC000053611562 323077306 /nfs/dbraw/zinc/07/73/06/323077306.db2.gz CQEGZHXGJCGTFW-UHFFFAOYSA-N 1 2 223.320 2.425 20 0 BEADLO CC(C)CC[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000053611562 323077307 /nfs/dbraw/zinc/07/73/07/323077307.db2.gz CQEGZHXGJCGTFW-UHFFFAOYSA-N 1 2 223.320 2.425 20 0 BEADLO FC1(F)CC(C[N@@H+]2Cc3cccnc3C2)C1 ZINC000563023233 323080171 /nfs/dbraw/zinc/08/01/71/323080171.db2.gz TWHMAQCUMRAQNL-UHFFFAOYSA-N 1 2 224.254 2.443 20 0 BEADLO FC1(F)CC(C[N@H+]2Cc3cccnc3C2)C1 ZINC000563023233 323080172 /nfs/dbraw/zinc/08/01/72/323080172.db2.gz TWHMAQCUMRAQNL-UHFFFAOYSA-N 1 2 224.254 2.443 20 0 BEADLO Cc1ccc(CNc2cc[nH+]c(C3CC3)n2)nc1 ZINC000563052833 323082966 /nfs/dbraw/zinc/08/29/66/323082966.db2.gz DTJZHIWMGUBOLF-UHFFFAOYSA-N 1 2 240.310 2.091 20 0 BEADLO Cc1oncc1C[N@@H+](C)Cc1cccc(O)c1 ZINC000525833669 323100135 /nfs/dbraw/zinc/10/01/35/323100135.db2.gz KGUNOVZTDJDJSY-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO Cc1oncc1C[N@H+](C)Cc1cccc(O)c1 ZINC000525833669 323100136 /nfs/dbraw/zinc/10/01/36/323100136.db2.gz KGUNOVZTDJDJSY-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO Cc1[nH]c(CNCc2cnc(C3CC3)o2)[nH+]c1C ZINC000572663383 323102220 /nfs/dbraw/zinc/10/22/20/323102220.db2.gz NOQDCOJHNSKSAT-UHFFFAOYSA-N 1 2 246.314 2.182 20 0 BEADLO CC(C)(NC(=O)C1C(C)(C)C1(C)C)c1[nH]cc[nH+]1 ZINC000563282022 323107955 /nfs/dbraw/zinc/10/79/55/323107955.db2.gz DKLCBSRIMTWXQS-UHFFFAOYSA-N 1 2 249.358 2.443 20 0 BEADLO Cc1occc1C(=O)Nc1ccc[nH+]c1N(C)C ZINC000047975904 323112991 /nfs/dbraw/zinc/11/29/91/323112991.db2.gz PJVIFYQVBCODTF-UHFFFAOYSA-N 1 2 245.282 2.301 20 0 BEADLO CCC(CC)[C@@H](C)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000534180631 323114549 /nfs/dbraw/zinc/11/45/49/323114549.db2.gz VINFHHNCJZLUGG-LLVKDONJSA-N 1 2 249.358 2.339 20 0 BEADLO COC(=O)[C@@](C)([NH2+]Cc1cccc(C)c1)C1CC1 ZINC000534315620 323116348 /nfs/dbraw/zinc/11/63/48/323116348.db2.gz YYIMMKQIIFSFBV-HNNXBMFYSA-N 1 2 247.338 2.426 20 0 BEADLO CCn1nccc1C[N@H+](C)Cc1cccc(O)c1 ZINC000534330157 323116945 /nfs/dbraw/zinc/11/69/45/323116945.db2.gz LDQFZDBYECRUHC-UHFFFAOYSA-N 1 2 245.326 2.241 20 0 BEADLO CCn1nccc1C[N@@H+](C)Cc1cccc(O)c1 ZINC000534330157 323116946 /nfs/dbraw/zinc/11/69/46/323116946.db2.gz LDQFZDBYECRUHC-UHFFFAOYSA-N 1 2 245.326 2.241 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N(C)C1CCCCC1 ZINC000563367199 323121518 /nfs/dbraw/zinc/12/15/18/323121518.db2.gz DOLNIZZBXSABLO-LLVKDONJSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N(C)C1CCCCC1 ZINC000563367199 323121519 /nfs/dbraw/zinc/12/15/19/323121519.db2.gz DOLNIZZBXSABLO-LLVKDONJSA-N 1 2 249.358 2.379 20 0 BEADLO Cc1c[nH+]c(C)nc1NCC(C)(C)OCC1CC1 ZINC000563422851 323124203 /nfs/dbraw/zinc/12/42/03/323124203.db2.gz CKQPYFBFYPYPQI-UHFFFAOYSA-N 1 2 249.358 2.132 20 0 BEADLO Cc1[nH]c(CNc2ccnn2CC(C)C)[nH+]c1C ZINC000563438433 323125679 /nfs/dbraw/zinc/12/56/79/323125679.db2.gz ATFVGQOLVCFPMO-UHFFFAOYSA-N 1 2 247.346 2.491 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCCC2(CC2)C1 ZINC000563425257 323126098 /nfs/dbraw/zinc/12/60/98/323126098.db2.gz IEVCDZUIGMDTIL-UHFFFAOYSA-N 1 2 217.316 2.474 20 0 BEADLO Cc1[nH]c(CN[C@@H]2CCC[C@@H]2F)[nH+]c1C ZINC000563442160 323126642 /nfs/dbraw/zinc/12/66/42/323126642.db2.gz XYWYAKKXKFIJLG-VHSXEESVSA-N 1 2 211.284 2.007 20 0 BEADLO C[C@@H](NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1)C(C)(C)C ZINC000563547632 323129734 /nfs/dbraw/zinc/12/97/34/323129734.db2.gz MWQDOTBMSAYINA-VHSXEESVSA-N 1 2 237.347 2.139 20 0 BEADLO C[C@@H](NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1)C(C)(C)C ZINC000563547632 323129735 /nfs/dbraw/zinc/12/97/35/323129735.db2.gz MWQDOTBMSAYINA-VHSXEESVSA-N 1 2 237.347 2.139 20 0 BEADLO CC[N@H+](Cc1ncccc1Cl)[C@H]1CCOC1 ZINC000528508383 323150853 /nfs/dbraw/zinc/15/08/53/323150853.db2.gz IAHBNJRPZUXVJJ-JTQLQIEISA-N 1 2 240.734 2.346 20 0 BEADLO Cc1nc(F)ccc1C[N@@H+]1CCC[C@H]1CF ZINC000294036688 323152207 /nfs/dbraw/zinc/15/22/07/323152207.db2.gz OOIBIXNMHMODFM-NSHDSACASA-N 1 2 226.270 2.463 20 0 BEADLO Cc1nc(F)ccc1C[N@H+]1CCC[C@H]1CF ZINC000294036688 323152208 /nfs/dbraw/zinc/15/22/08/323152208.db2.gz OOIBIXNMHMODFM-NSHDSACASA-N 1 2 226.270 2.463 20 0 BEADLO CCc1cc(C[NH2+][C@@H](C)c2ccccn2)on1 ZINC000535041590 323163973 /nfs/dbraw/zinc/16/39/73/323163973.db2.gz PXQVNCZJIJLBGY-JTQLQIEISA-N 1 2 231.299 2.483 20 0 BEADLO CCN(C(=O)Nc1cc(C)[nH+]cc1C)C1CC1 ZINC000535059902 323164841 /nfs/dbraw/zinc/16/48/41/323164841.db2.gz ZRRZVNUIAYLYFY-UHFFFAOYSA-N 1 2 233.315 2.137 20 0 BEADLO CC(C)[C@H](C)CNc1nc(N)c2ccccc2[nH+]1 ZINC000535720936 323189113 /nfs/dbraw/zinc/18/91/13/323189113.db2.gz IARWVTJOHGIBQC-SNVBAGLBSA-N 1 2 244.342 2.168 20 0 BEADLO Cc1cc(NC(=O)NC[C@@H]2CC2(C)C)c(C)c[nH+]1 ZINC000536619187 323198698 /nfs/dbraw/zinc/19/86/98/323198698.db2.gz JSBKWKYASOPSMS-NSHDSACASA-N 1 2 247.342 2.288 20 0 BEADLO CC[N@@H+](Cc1noc(C2CC2)n1)CC(C)C ZINC000054316780 323204079 /nfs/dbraw/zinc/20/40/79/323204079.db2.gz ORGBWKAQPYIPSO-UHFFFAOYSA-N 1 2 223.320 2.425 20 0 BEADLO CC[N@H+](Cc1noc(C2CC2)n1)CC(C)C ZINC000054316780 323204080 /nfs/dbraw/zinc/20/40/80/323204080.db2.gz ORGBWKAQPYIPSO-UHFFFAOYSA-N 1 2 223.320 2.425 20 0 BEADLO CC(C)(O)[C@H]1CCCN1c1cc[nH+]c(C2CC2)n1 ZINC000301969250 323312914 /nfs/dbraw/zinc/31/29/14/323312914.db2.gz BHWHXFHJKJFHTN-LLVKDONJSA-N 1 2 247.342 2.094 20 0 BEADLO CCn1c[nH+]cc1CNc1cn(C)nc1C1CC1 ZINC000418084023 323347696 /nfs/dbraw/zinc/34/76/96/323347696.db2.gz UJMHDZBNAMPZGR-UHFFFAOYSA-N 1 2 245.330 2.126 20 0 BEADLO Cc1occc1C[NH2+]Cc1nn(C)cc1Cl ZINC000320991148 323370887 /nfs/dbraw/zinc/37/08/87/323370887.db2.gz QSCZFOFHGNUUTI-UHFFFAOYSA-N 1 2 239.706 2.265 20 0 BEADLO CC(C)=CCC[C@@H](C)NC(=O)Cc1c[nH+]cn1C ZINC000571990102 323518852 /nfs/dbraw/zinc/51/88/52/323518852.db2.gz BLZXZVDPVTWOQD-GFCCVEGCSA-N 1 2 249.358 2.214 20 0 BEADLO COc1ccc[nH+]c1N(C)CCc1nccs1 ZINC000527940251 323721050 /nfs/dbraw/zinc/72/10/50/323721050.db2.gz WFQRIWIYXFOMAC-UHFFFAOYSA-N 1 2 249.339 2.226 20 0 BEADLO O[C@]12C[C@H]1CN(c1[nH+]ccc3ccccc31)CC2 ZINC000528056233 323754309 /nfs/dbraw/zinc/75/43/09/323754309.db2.gz YXNNOPDAMIEYNM-SWLSCSKDSA-N 1 2 240.306 2.196 20 0 BEADLO c1ccc2[nH]c(=[NH+]CC[C@H]3CCCOC3)[nH]c2c1 ZINC000528071574 323758039 /nfs/dbraw/zinc/75/80/39/323758039.db2.gz FVEGLPUGYSYCIN-LLVKDONJSA-N 1 2 245.326 2.213 20 0 BEADLO COCCC1CCN(c2cc[nH+]c(C)n2)CC1 ZINC000528087927 323761566 /nfs/dbraw/zinc/76/15/66/323761566.db2.gz FBGJFVSWLAXCLL-UHFFFAOYSA-N 1 2 235.331 2.038 20 0 BEADLO CCN(c1noc(C[NH+](C)C)n1)c1ccccc1 ZINC000528223265 323784372 /nfs/dbraw/zinc/78/43/72/323784372.db2.gz STOJUMMYIVIOOL-UHFFFAOYSA-N 1 2 246.314 2.289 20 0 BEADLO CC(C)c1cc(NCC2COC2)nc(C(C)C)[nH+]1 ZINC000528225630 323784953 /nfs/dbraw/zinc/78/49/53/323784953.db2.gz JOMNCNYIAZBYOU-UHFFFAOYSA-N 1 2 249.358 2.204 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)/C=C/c1[nH+]ccn1CC ZINC000492452894 324163612 /nfs/dbraw/zinc/16/36/12/324163612.db2.gz FIEZGRJPKZRZBY-BRQSLIGTSA-N 1 2 249.358 2.467 20 0 BEADLO CC[C@H](NC(=O)[C@@H]1[C@H](C)[C@H]1C1CC1)c1[nH]cc[nH+]1 ZINC000529054995 324239096 /nfs/dbraw/zinc/23/90/96/324239096.db2.gz YUUHHXHEPTWLJP-NUGNTBJXSA-N 1 2 247.342 2.269 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@H]1CCCC12CC2 ZINC000529448929 324301414 /nfs/dbraw/zinc/30/14/14/324301414.db2.gz WKWPVCBQDIWKGH-LLVKDONJSA-N 1 2 247.342 2.100 20 0 BEADLO CC(C)n1ccc(C[NH2+]Cc2ccc(F)cn2)n1 ZINC000529552039 324339262 /nfs/dbraw/zinc/33/92/62/324339262.db2.gz WWMXULONSDGJBM-UHFFFAOYSA-N 1 2 248.305 2.288 20 0 BEADLO CC1(C)CCC[C@@H]1CCNC(=O)Cc1[nH]cc[nH+]1 ZINC000529565195 324344430 /nfs/dbraw/zinc/34/44/30/324344430.db2.gz TWFWBDBJMOLXHP-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO Fc1ccc(C[N@H+]2CCC[C@H](F)C2)nc1 ZINC000529618215 324366163 /nfs/dbraw/zinc/36/61/63/324366163.db2.gz GPZVEGDNUARBSB-JTQLQIEISA-N 1 2 212.243 2.155 20 0 BEADLO Fc1ccc(C[N@@H+]2CCC[C@H](F)C2)nc1 ZINC000529618215 324366164 /nfs/dbraw/zinc/36/61/64/324366164.db2.gz GPZVEGDNUARBSB-JTQLQIEISA-N 1 2 212.243 2.155 20 0 BEADLO C[C@@H](O)CN(C)c1[nH+]ccc2ccccc21 ZINC000123793834 324600092 /nfs/dbraw/zinc/60/00/92/324600092.db2.gz NYUURIXXIUSVHI-SNVBAGLBSA-N 1 2 216.284 2.052 20 0 BEADLO CCC(=O)NCc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000539778691 324858328 /nfs/dbraw/zinc/85/83/28/324858328.db2.gz KKAQUSXYHZZMRF-UHFFFAOYSA-N 1 2 229.283 2.103 20 0 BEADLO CC[C@@]1(C)C[N@H+](Cc2cc(C)nc(C)n2)CCO1 ZINC000660380204 487966648 /nfs/dbraw/zinc/96/66/48/487966648.db2.gz JUXWUFHGNXHVPE-AWEZNQCLSA-N 1 2 249.358 2.094 20 0 BEADLO CC[C@@]1(C)C[N@@H+](Cc2cc(C)nc(C)n2)CCO1 ZINC000660380204 487966652 /nfs/dbraw/zinc/96/66/52/487966652.db2.gz JUXWUFHGNXHVPE-AWEZNQCLSA-N 1 2 249.358 2.094 20 0 BEADLO c1cn(Cc2ccccc2)c(Cn2cc[nH+]c2)n1 ZINC000129976676 325000099 /nfs/dbraw/zinc/00/00/99/325000099.db2.gz SZQYKRPANVOWSE-UHFFFAOYSA-N 1 2 238.294 2.176 20 0 BEADLO CC[N@H+](Cc1cccc(F)c1)[C@@H](C)C(=O)OC ZINC000130203908 325023855 /nfs/dbraw/zinc/02/38/55/325023855.db2.gz QHNNBAUSWZHCJZ-JTQLQIEISA-N 1 2 239.290 2.209 20 0 BEADLO CC[N@@H+](Cc1cccc(F)c1)[C@@H](C)C(=O)OC ZINC000130203908 325023858 /nfs/dbraw/zinc/02/38/58/325023858.db2.gz QHNNBAUSWZHCJZ-JTQLQIEISA-N 1 2 239.290 2.209 20 0 BEADLO COc1cccc(C[NH2+][C@H](C)c2nnc(C)o2)c1 ZINC000542616392 325037751 /nfs/dbraw/zinc/03/77/51/325037751.db2.gz XOEOFWICPNFUKR-SECBINFHSA-N 1 2 247.298 2.237 20 0 BEADLO Cc1nc(N[C@@]2(C)CCOC2)c2c([nH+]1)CCCC2 ZINC000542949035 325065143 /nfs/dbraw/zinc/06/51/43/325065143.db2.gz QOKQIEPJEUHCSK-AWEZNQCLSA-N 1 2 247.342 2.255 20 0 BEADLO CCc1cc(C[NH2+][C@H](CC)c2ccn(C)n2)on1 ZINC000543592096 325095822 /nfs/dbraw/zinc/09/58/22/325095822.db2.gz TZQONMDVXKNNDO-GFCCVEGCSA-N 1 2 248.330 2.211 20 0 BEADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1cc[nH]n1 ZINC000543740692 325107852 /nfs/dbraw/zinc/10/78/52/325107852.db2.gz UIGBXXSKYDIZNA-SNVBAGLBSA-N 1 2 230.315 2.218 20 0 BEADLO Cc1cccc(C(=O)Nc2cc[nH+]cc2O)c1F ZINC000131276092 325133727 /nfs/dbraw/zinc/13/37/27/325133727.db2.gz HJAACDUWUKVOMB-UHFFFAOYSA-N 1 2 246.241 2.487 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2ccc(C)cn2)CCO1 ZINC000131502654 325156985 /nfs/dbraw/zinc/15/69/85/325156985.db2.gz YFMPDSVJRGDHEC-CQSZACIVSA-N 1 2 234.343 2.391 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2ccc(C)cn2)CCO1 ZINC000131502654 325156987 /nfs/dbraw/zinc/15/69/87/325156987.db2.gz YFMPDSVJRGDHEC-CQSZACIVSA-N 1 2 234.343 2.391 20 0 BEADLO Cn1c[nH+]cc1Cc1noc([C@H]2CC=CCC2)n1 ZINC000545142771 325180029 /nfs/dbraw/zinc/18/00/29/325180029.db2.gz RQPSASUHUBEHEW-JTQLQIEISA-N 1 2 244.298 2.218 20 0 BEADLO Clc1snnc1C[N@@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000132034955 325195851 /nfs/dbraw/zinc/19/58/51/325195851.db2.gz OTHMMOSNAZKVET-OCAPTIKFSA-N 1 2 243.763 2.423 20 0 BEADLO Clc1snnc1C[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000132034955 325195854 /nfs/dbraw/zinc/19/58/54/325195854.db2.gz OTHMMOSNAZKVET-OCAPTIKFSA-N 1 2 243.763 2.423 20 0 BEADLO COC(=O)[C@H](c1cccnc1)[NH+]1CCCCCC1 ZINC000132431159 325216319 /nfs/dbraw/zinc/21/63/19/325216319.db2.gz YKXHWTBPBVIHSG-ZDUSSCGKSA-N 1 2 248.326 2.172 20 0 BEADLO CC(C)c1nc(N2CCC[C@H]2C[C@@H](C)O)cc[nH+]1 ZINC000133353040 325289623 /nfs/dbraw/zinc/28/96/23/325289623.db2.gz VHECGHRPKJQVCI-NEPJUHHUSA-N 1 2 249.358 2.340 20 0 BEADLO CC(C)(C)[C@H](NCCn1cc[nH+]c1)C(F)(F)F ZINC000546628807 325295611 /nfs/dbraw/zinc/29/56/11/325295611.db2.gz BLJSPKWKWNINCE-VIFPVBQESA-N 1 2 249.280 2.450 20 0 BEADLO Cc1cccc([C@@H](C)[NH+]2CCS(=O)CC2)c1 ZINC000075720613 325308335 /nfs/dbraw/zinc/30/83/35/325308335.db2.gz RJDVSVQGCIBNJL-GFCCVEGCSA-N 1 2 237.368 2.120 20 0 BEADLO C[C@@H]1C[NH+](Cc2nnsc2Cl)C[C@H]1C ZINC000076112066 325332041 /nfs/dbraw/zinc/33/20/41/325332041.db2.gz SMCDDKDBWKDGJC-RNFRBKRXSA-N 1 2 231.752 2.279 20 0 BEADLO CCCC[C@H]([NH2+]CCc1ccco1)C(=O)OC ZINC000135130786 325396527 /nfs/dbraw/zinc/39/65/27/325396527.db2.gz HPYJEAHKYMIHSY-LBPRGKRZSA-N 1 2 239.315 2.144 20 0 BEADLO Cc1cc(C)c(NCc2c[nH+]cn2C)cc1CO ZINC000682458316 487968029 /nfs/dbraw/zinc/96/80/29/487968029.db2.gz STLHUOCWPDZBRK-UHFFFAOYSA-N 1 2 245.326 2.141 20 0 BEADLO Cc1cc(CNc2[nH+]c3ccccc3n2C)no1 ZINC000079046421 325441096 /nfs/dbraw/zinc/44/10/96/325441096.db2.gz SWWNULWDFXYBDF-UHFFFAOYSA-N 1 2 242.282 2.482 20 0 BEADLO COc1cccc(C[NH2+][C@@H](C)c2nccs2)n1 ZINC000080305552 325479762 /nfs/dbraw/zinc/47/97/62/325479762.db2.gz GRMYJDQPJMWYEJ-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO COc1cc[nH+]c(CN2Cc3cccnc3C2)c1 ZINC000550654118 325536369 /nfs/dbraw/zinc/53/63/69/325536369.db2.gz RFGKCKHXPVUJJX-UHFFFAOYSA-N 1 2 241.294 2.001 20 0 BEADLO CC(C)(C)C1=CCN(C(=O)Cn2cc[nH+]c2)CC1 ZINC000550812406 325539874 /nfs/dbraw/zinc/53/98/74/325539874.db2.gz LBJXQEWQKRCEMX-UHFFFAOYSA-N 1 2 247.342 2.088 20 0 BEADLO COc1cc[nH+]cc1CSc1cnccn1 ZINC000553432910 325689805 /nfs/dbraw/zinc/68/98/05/325689805.db2.gz BLOWIUBPIKBFAF-UHFFFAOYSA-N 1 2 233.296 2.173 20 0 BEADLO CCCC[C@@H]1CCC[C@@H]1NC(=O)Cn1cc[nH+]c1 ZINC000555221635 325749828 /nfs/dbraw/zinc/74/98/28/325749828.db2.gz KCXBYZMGEVGUON-OLZOCXBDSA-N 1 2 249.358 2.358 20 0 BEADLO Cc1c[nH+]c(C)nc1N1C[C@H](C)OC(C)(C)C1 ZINC000564460063 325793638 /nfs/dbraw/zinc/79/36/38/325793638.db2.gz ASNNQMZIDGFFTE-JTQLQIEISA-N 1 2 235.331 2.097 20 0 BEADLO CC(C)c1nc(C[NH+]2C[C@H]3CCC[C@@H]3C2)no1 ZINC000153281006 325936496 /nfs/dbraw/zinc/93/64/96/325936496.db2.gz JPKRWVJSQBXVBF-GHMZBOCLSA-N 1 2 235.331 2.425 20 0 BEADLO Cn1ncc2c1nc[nH+]c2N[C@@H]1CCC[C@@H](F)C1 ZINC000566161495 326004546 /nfs/dbraw/zinc/00/45/46/326004546.db2.gz ZUYXNYXUZRRBGK-RKDXNWHRSA-N 1 2 249.293 2.056 20 0 BEADLO CC(C)(NC(=O)CC1CCCC1)c1[nH]cc[nH+]1 ZINC000566365226 326038051 /nfs/dbraw/zinc/03/80/51/326038051.db2.gz NDDITYDEXMCSTQ-UHFFFAOYSA-N 1 2 235.331 2.341 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1nccc(N)n1)c1ccccc1 ZINC000566416074 326042704 /nfs/dbraw/zinc/04/27/04/326042704.db2.gz MJAJBHNLIJFSDE-QWRGUYRKSA-N 1 2 242.326 2.301 20 0 BEADLO Cc1cc(C)cc(C[NH2+]Cc2ncccn2)c1 ZINC000566499637 326059193 /nfs/dbraw/zinc/05/91/93/326059193.db2.gz BAOIDSVVXHXRKH-UHFFFAOYSA-N 1 2 227.311 2.383 20 0 BEADLO CC[C@]1(C)CCN(C(=O)C[C@@H](C)n2cc[nH+]c2)C1 ZINC000566623217 326069468 /nfs/dbraw/zinc/06/94/68/326069468.db2.gz BKMRSAPRCMNVRB-TZMCWYRMSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC[C@@H](F)C2)cn1 ZINC000566625405 326069526 /nfs/dbraw/zinc/06/95/26/326069526.db2.gz RJJORIGABAPOPZ-GFCCVEGCSA-N 1 2 208.280 2.324 20 0 BEADLO Cc1ccc(C[N@H+]2CCC[C@@H](F)C2)cn1 ZINC000566625405 326069528 /nfs/dbraw/zinc/06/95/28/326069528.db2.gz RJJORIGABAPOPZ-GFCCVEGCSA-N 1 2 208.280 2.324 20 0 BEADLO Cc1c[nH+]c(C)nc1N1C[C@@H](C)S[C@H](C)C1 ZINC000566630288 326070014 /nfs/dbraw/zinc/07/00/14/326070014.db2.gz RRVMQYNYNQYCMJ-NXEZZACHSA-N 1 2 237.372 2.424 20 0 BEADLO CC1=C(C)C[C@H](C(=O)NCCn2cc[nH+]c2)CC1 ZINC000566856492 326088994 /nfs/dbraw/zinc/08/89/94/326088994.db2.gz CUGBNNNGIJSGNE-CYBMUJFWSA-N 1 2 247.342 2.136 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CCC[C@H](F)C2)cn1 ZINC000566861941 326089532 /nfs/dbraw/zinc/08/95/32/326089532.db2.gz YBOJEKMQEZGMTN-LBPRGKRZSA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1cc(C[N@H+]2CCC[C@H](F)C2)cn1 ZINC000566861941 326089534 /nfs/dbraw/zinc/08/95/34/326089534.db2.gz YBOJEKMQEZGMTN-LBPRGKRZSA-N 1 2 225.311 2.398 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)NCCC(C)C)ccn12 ZINC000566922952 326094652 /nfs/dbraw/zinc/09/46/52/326094652.db2.gz FCCHQYFQHLXTCM-UHFFFAOYSA-N 1 2 245.326 2.419 20 0 BEADLO CCOc1ncccc1NCc1[nH]c(C)c(C)[nH+]1 ZINC000567250891 326150580 /nfs/dbraw/zinc/15/05/80/326150580.db2.gz XYQNLHIPKCRXTQ-UHFFFAOYSA-N 1 2 246.314 2.432 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@H]2CC3CCC2CC3)c[nH+]1 ZINC000567274366 326154392 /nfs/dbraw/zinc/15/43/92/326154392.db2.gz SOXSRDDEFQUQRS-HTAVTVPLSA-N 1 2 247.342 2.274 20 0 BEADLO Cc1cc([NH2+]C[C@@H]2C[C@H]2C)ccc1-n1cnnn1 ZINC000567302527 326159319 /nfs/dbraw/zinc/15/93/19/326159319.db2.gz ODGDXJQYRDRJBU-KOLCDFICSA-N 1 2 243.314 2.039 20 0 BEADLO CC(C)Cn1ccnc1C[NH2+]CC1(F)CC1 ZINC000309606039 326162443 /nfs/dbraw/zinc/16/24/43/326162443.db2.gz LGMWCQXNBMPQAD-UHFFFAOYSA-N 1 2 225.311 2.131 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NC1(C)CCCC1 ZINC000567403722 326184431 /nfs/dbraw/zinc/18/44/31/326184431.db2.gz RFCYEEPJLSTSFD-JTQLQIEISA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NC1(C)CCCC1 ZINC000567403722 326184433 /nfs/dbraw/zinc/18/44/33/326184433.db2.gz RFCYEEPJLSTSFD-JTQLQIEISA-N 1 2 235.331 2.037 20 0 BEADLO Cc1[nH+]c2ccccn2c1CSc1cn[nH]n1 ZINC000155931206 326214774 /nfs/dbraw/zinc/21/47/74/326214774.db2.gz DLVGGGRTYKVPDD-UHFFFAOYSA-N 1 2 245.311 2.053 20 0 BEADLO Cc1[nH+]c2ccccn2c1CSc1c[nH]nn1 ZINC000155931206 326214777 /nfs/dbraw/zinc/21/47/77/326214777.db2.gz DLVGGGRTYKVPDD-UHFFFAOYSA-N 1 2 245.311 2.053 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@@H+]1Cc1nc2ccccc2o1 ZINC000156082583 326218158 /nfs/dbraw/zinc/21/81/58/326218158.db2.gz DBIGTKLFXGIYRR-MNOVXSKESA-N 1 2 246.310 2.437 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1nc2ccccc2o1 ZINC000156082583 326218160 /nfs/dbraw/zinc/21/81/60/326218160.db2.gz DBIGTKLFXGIYRR-MNOVXSKESA-N 1 2 246.310 2.437 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2nc3ccccc3o2)[C@@H]1C ZINC000156082818 326218272 /nfs/dbraw/zinc/21/82/72/326218272.db2.gz DBIGTKLFXGIYRR-GHMZBOCLSA-N 1 2 246.310 2.437 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2nc3ccccc3o2)[C@@H]1C ZINC000156082818 326218274 /nfs/dbraw/zinc/21/82/74/326218274.db2.gz DBIGTKLFXGIYRR-GHMZBOCLSA-N 1 2 246.310 2.437 20 0 BEADLO CC1(C)CC[C@H]1NC(=O)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000567772361 326256833 /nfs/dbraw/zinc/25/68/33/326256833.db2.gz AHGHFVGQTGHJES-MWLCHTKSSA-N 1 2 247.342 2.134 20 0 BEADLO CC1(C)CC[C@H]1NC(=O)[C@@H]1CCCc2[nH]c[nH+]c21 ZINC000567772361 326256834 /nfs/dbraw/zinc/25/68/34/326256834.db2.gz AHGHFVGQTGHJES-MWLCHTKSSA-N 1 2 247.342 2.134 20 0 BEADLO CC[C@@H]1CCCC[N@@H+]1Cc1csnn1 ZINC000157463379 326276541 /nfs/dbraw/zinc/27/65/41/326276541.db2.gz MGPDNBSQLZKONY-SNVBAGLBSA-N 1 2 211.334 2.303 20 0 BEADLO CC[C@@H]1CCCC[N@H+]1Cc1csnn1 ZINC000157463379 326276542 /nfs/dbraw/zinc/27/65/42/326276542.db2.gz MGPDNBSQLZKONY-SNVBAGLBSA-N 1 2 211.334 2.303 20 0 BEADLO CCc1nc(CNc2nc(C)[nH+]cc2C)cs1 ZINC000568242875 326333261 /nfs/dbraw/zinc/33/32/61/326333261.db2.gz ZJAMRVWRGGQXBV-UHFFFAOYSA-N 1 2 248.355 2.146 20 0 BEADLO COc1ccc(OC)c(CNc2c[nH]c[nH+]2)c1 ZINC000569190165 326394334 /nfs/dbraw/zinc/39/43/34/326394334.db2.gz AGUUEOBMHJEFAF-UHFFFAOYSA-N 1 2 233.271 2.039 20 0 BEADLO CCc1nocc1COc1cc[nH+]cc1 ZINC000569238097 326396998 /nfs/dbraw/zinc/39/69/98/326396998.db2.gz KUWIYRHEUMGQAL-UHFFFAOYSA-N 1 2 204.229 2.211 20 0 BEADLO C[C@@H](CC(=O)NC[C@H]1CCC[C@H]1C)n1cc[nH+]c1 ZINC000573123162 326431172 /nfs/dbraw/zinc/43/11/72/326431172.db2.gz BROHGNZUFAXQQM-FRRDWIJNSA-N 1 2 249.358 2.387 20 0 BEADLO CC(C)c1nc(N(C)C[C@@H]2CCC[C@@H]2O)cc[nH+]1 ZINC000166884686 326436367 /nfs/dbraw/zinc/43/63/67/326436367.db2.gz BGERZQHYKUQEMZ-RYUDHWBXSA-N 1 2 249.358 2.197 20 0 BEADLO CC(C)[C@H](C)N(C)C(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000666027482 487986465 /nfs/dbraw/zinc/98/64/65/487986465.db2.gz RZDGHVVWMYBBHK-WDEREUQCSA-N 1 2 249.358 2.018 20 0 BEADLO CC(C)[C@H](C)N(C)C(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000666027317 487986552 /nfs/dbraw/zinc/98/65/52/487986552.db2.gz PXYWFPBGPKTWPF-QJPTWQEYSA-N 1 2 249.358 2.027 20 0 BEADLO CC(C)[C@H](C)N(C)C(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000666027482 487986457 /nfs/dbraw/zinc/98/64/57/487986457.db2.gz RZDGHVVWMYBBHK-WDEREUQCSA-N 1 2 249.358 2.018 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)C1[C@@H]2CCCCCC[C@@H]12 ZINC000668604280 487997334 /nfs/dbraw/zinc/99/73/34/487997334.db2.gz MWUWMKZGBJMYRS-GHMZBOCLSA-N 1 2 247.342 2.242 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)C1CC2(C1)CCCCC2 ZINC000668603707 487997526 /nfs/dbraw/zinc/99/75/26/487997526.db2.gz JOCFOXIFKJZYIG-UHFFFAOYSA-N 1 2 247.342 2.386 20 0 BEADLO Cc1cc(N[C@@H](CO)CC2CC2)nc(C2CC2)[nH+]1 ZINC000677237586 488002476 /nfs/dbraw/zinc/00/24/76/488002476.db2.gz XUBGVVWLAPPKQI-GFCCVEGCSA-N 1 2 247.342 2.235 20 0 BEADLO Oc1ccc2c(c1)[C@@H]([NH2+]Cc1csnn1)CC2 ZINC000668615267 488008746 /nfs/dbraw/zinc/00/87/46/488008746.db2.gz LFBBYBPMZLFEOP-LBPRGKRZSA-N 1 2 247.323 2.021 20 0 BEADLO CCc1cc(N[C@H](CC)[C@H]2CCCO2)nc[nH+]1 ZINC000677308979 488012284 /nfs/dbraw/zinc/01/22/84/488012284.db2.gz YIHUDPDPAJIECC-VXGBXAGGSA-N 1 2 235.331 2.409 20 0 BEADLO C[NH+]1CCN(Cc2cc3ccncc3s2)CC1 ZINC000667462004 488013310 /nfs/dbraw/zinc/01/33/10/488013310.db2.gz VNYNJUYXVYPYTA-UHFFFAOYSA-N 1 2 247.367 2.044 20 0 BEADLO CC(C)(C)c1nc(NC[C@H]2CC[C@@H](O)C2)cc[nH+]1 ZINC000682721543 488026274 /nfs/dbraw/zinc/02/62/74/488026274.db2.gz ZBKGXBQHUPXSLX-WDEREUQCSA-N 1 2 249.358 2.347 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CCC2(C)C)cc[nH+]1 ZINC000668635891 488034746 /nfs/dbraw/zinc/03/47/46/488034746.db2.gz QGIJPORRTMDZEF-NSHDSACASA-N 1 2 218.300 2.187 20 0 BEADLO FC(F)C1C[NH+](Cc2cnc3ccccn23)C1 ZINC000677474311 488045109 /nfs/dbraw/zinc/04/51/09/488045109.db2.gz GJUXCJOZRFTRHE-UHFFFAOYSA-N 1 2 237.253 2.031 20 0 BEADLO Cc1ncsc1CNc1nc(C)[nH+]cc1C ZINC000656119568 488050807 /nfs/dbraw/zinc/05/08/07/488050807.db2.gz UIASXRNPVBCSJD-UHFFFAOYSA-N 1 2 234.328 2.470 20 0 BEADLO CC(C)(C)CN(CCO)c1cc[nH+]c(C2CC2)n1 ZINC000677508099 488058531 /nfs/dbraw/zinc/05/85/31/488058531.db2.gz CXTHTDWRZWCXIR-UHFFFAOYSA-N 1 2 249.358 2.199 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCCC1(F)F)c1ccc(=O)[nH]n1 ZINC000672620641 488061983 /nfs/dbraw/zinc/06/19/83/488061983.db2.gz OSPOBPCNSIRNEL-VXNVDRBHSA-N 1 2 243.257 2.021 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCCC1(F)F)c1ccc(=O)[nH]n1 ZINC000672620630 488062483 /nfs/dbraw/zinc/06/24/83/488062483.db2.gz OSPOBPCNSIRNEL-APPZFPTMSA-N 1 2 243.257 2.021 20 0 BEADLO CC[C@H](NC(=O)[C@@H]1CC=CCC1)c1[nH]cc[nH+]1 ZINC000140543505 488063885 /nfs/dbraw/zinc/06/38/85/488063885.db2.gz WTODVSICCOVMFP-MNOVXSKESA-N 1 2 233.315 2.333 20 0 BEADLO O=C(Cn1cc[nH+]c1)N(C1CC1)C1CCCCC1 ZINC000075682109 488067970 /nfs/dbraw/zinc/06/79/70/488067970.db2.gz XUBDJPWLIMTUQX-UHFFFAOYSA-N 1 2 247.342 2.207 20 0 BEADLO Cc1occc1C[NH2+]Cc1cn(C(C)(C)C)nn1 ZINC000682940170 488068579 /nfs/dbraw/zinc/06/85/79/488068579.db2.gz SBOPWNNWFCRPKY-UHFFFAOYSA-N 1 2 248.330 2.224 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C1CC2(CC2)C1 ZINC000667679948 488085226 /nfs/dbraw/zinc/08/52/26/488085226.db2.gz STCPMLRXQIPQSP-UHFFFAOYSA-N 1 2 232.283 2.219 20 0 BEADLO Cc1cnc(C[N@H+](C)CCOC(C)(C)C)nc1 ZINC000677691875 488093974 /nfs/dbraw/zinc/09/39/74/488093974.db2.gz LETPNADKHOCSFI-UHFFFAOYSA-N 1 2 237.347 2.032 20 0 BEADLO Cc1cnc(C[N@@H+](C)CCOC(C)(C)C)nc1 ZINC000677691875 488093977 /nfs/dbraw/zinc/09/39/77/488093977.db2.gz LETPNADKHOCSFI-UHFFFAOYSA-N 1 2 237.347 2.032 20 0 BEADLO Cc1cn[nH]c1C[NH2+]Cc1cc(C(C)C)no1 ZINC000685616086 488094629 /nfs/dbraw/zinc/09/46/29/488094629.db2.gz AJGMLLQZSSMMLX-UHFFFAOYSA-N 1 2 234.303 2.119 20 0 BEADLO Cc1c[nH]nc1C[NH2+]Cc1cc(C(C)C)no1 ZINC000685616086 488094634 /nfs/dbraw/zinc/09/46/34/488094634.db2.gz AJGMLLQZSSMMLX-UHFFFAOYSA-N 1 2 234.303 2.119 20 0 BEADLO CCc1nnc(C[N@@H+]2CC[C@H](C(F)(F)F)C2)o1 ZINC000677713907 488097225 /nfs/dbraw/zinc/09/72/25/488097225.db2.gz NEJDPFJADZUUBO-ZETCQYMHSA-N 1 2 249.236 2.016 20 0 BEADLO CCc1nnc(C[N@H+]2CC[C@H](C(F)(F)F)C2)o1 ZINC000677713907 488097229 /nfs/dbraw/zinc/09/72/29/488097229.db2.gz NEJDPFJADZUUBO-ZETCQYMHSA-N 1 2 249.236 2.016 20 0 BEADLO Cc1noc([C@H](C)[N@@H+]2CC[C@@H](C(F)(F)F)C2)n1 ZINC000677714020 488097241 /nfs/dbraw/zinc/09/72/41/488097241.db2.gz NZTIEHLVIGBEOQ-POYBYMJQSA-N 1 2 249.236 2.323 20 0 BEADLO Cc1noc([C@H](C)[N@H+]2CC[C@@H](C(F)(F)F)C2)n1 ZINC000677714020 488097248 /nfs/dbraw/zinc/09/72/48/488097248.db2.gz NZTIEHLVIGBEOQ-POYBYMJQSA-N 1 2 249.236 2.323 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2cc(C)ccn2)s1 ZINC000683023435 488097562 /nfs/dbraw/zinc/09/75/62/488097562.db2.gz SKJSFYGXAWFUJN-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO Cc1cc(N[C@@H]2C[C@H]2C(F)(F)F)nc[nH+]1 ZINC000378676023 488100015 /nfs/dbraw/zinc/10/00/15/488100015.db2.gz PGTLMQIWQCKGFN-RNFRBKRXSA-N 1 2 217.194 2.148 20 0 BEADLO Cc1noc(C[N@@H+](C)Cc2ccc(C)c(F)c2)n1 ZINC000683048769 488103768 /nfs/dbraw/zinc/10/37/68/488103768.db2.gz ZELGAUVQNNPHLC-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO Cc1noc(C[N@H+](C)Cc2ccc(C)c(F)c2)n1 ZINC000683048769 488103771 /nfs/dbraw/zinc/10/37/71/488103771.db2.gz ZELGAUVQNNPHLC-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO CCc1nnc([C@H](C)[N@@H+]2CC[C@H](C(F)F)C2)o1 ZINC000677730326 488107790 /nfs/dbraw/zinc/10/77/90/488107790.db2.gz BSIRFYNQVNPZHM-YUMQZZPRSA-N 1 2 245.273 2.280 20 0 BEADLO CCc1nnc([C@H](C)[N@H+]2CC[C@H](C(F)F)C2)o1 ZINC000677730326 488107794 /nfs/dbraw/zinc/10/77/94/488107794.db2.gz BSIRFYNQVNPZHM-YUMQZZPRSA-N 1 2 245.273 2.280 20 0 BEADLO Cc1cnc(C[NH+]2CC3(C2)CC(F)(F)C3)o1 ZINC000677732466 488109840 /nfs/dbraw/zinc/10/98/40/488109840.db2.gz GSEKZPKVBUBZCO-UHFFFAOYSA-N 1 2 228.242 2.214 20 0 BEADLO CCC[C@H]1CCC[C@H]1C(=O)NCc1c[nH+]cn1C ZINC000296147427 487536471 /nfs/dbraw/zinc/53/64/71/487536471.db2.gz SECBVVHMEDIOOG-WCQYABFASA-N 1 2 249.358 2.253 20 0 BEADLO CC(C)(C)CCCNC(=O)CCc1c[nH+]c[nH]1 ZINC000526005743 487539311 /nfs/dbraw/zinc/53/93/11/487539311.db2.gz XCOVDILKPVLQIR-UHFFFAOYSA-N 1 2 237.347 2.285 20 0 BEADLO CC(C)(C)CCCNC(=O)CCc1c[nH]c[nH+]1 ZINC000526005743 487539318 /nfs/dbraw/zinc/53/93/18/487539318.db2.gz XCOVDILKPVLQIR-UHFFFAOYSA-N 1 2 237.347 2.285 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2C[C@@H]2C)c(C)[nH+]1 ZINC000119393080 487544370 /nfs/dbraw/zinc/54/43/70/487544370.db2.gz POWMDDFOMLIRAW-OIBJUYFYSA-N 1 2 204.273 2.293 20 0 BEADLO CN(C)c1cc[nH+]c(NC(=O)c2ccsc2)c1 ZINC000680256921 487553423 /nfs/dbraw/zinc/55/34/23/487553423.db2.gz PWXNHLIPZSIAPH-UHFFFAOYSA-N 1 2 247.323 2.461 20 0 BEADLO Cc1c[nH]cc1C(=O)Nc1cc(N(C)C)cc[nH+]1 ZINC000680255624 487553530 /nfs/dbraw/zinc/55/35/30/487553530.db2.gz PDZOOIILZSNIFQ-UHFFFAOYSA-N 1 2 244.298 2.036 20 0 BEADLO Nc1nc(N2CC[C@H]3C[C@H]3C2)[nH+]c2ccccc12 ZINC000664523855 487554108 /nfs/dbraw/zinc/55/41/08/487554108.db2.gz JVNLBJSTGCDJEW-UWVGGRQHSA-N 1 2 240.310 2.058 20 0 BEADLO CCc1nnc(C[N@H+](C)[C@@H]2CCSC2)s1 ZINC000680069992 487530866 /nfs/dbraw/zinc/53/08/66/487530866.db2.gz MFLHTGAZICHOQF-MRVPVSSYSA-N 1 2 243.401 2.038 20 0 BEADLO CCc1nnc(C[N@@H+](C)[C@@H]2CCSC2)s1 ZINC000680069992 487530869 /nfs/dbraw/zinc/53/08/69/487530869.db2.gz MFLHTGAZICHOQF-MRVPVSSYSA-N 1 2 243.401 2.038 20 0 BEADLO CC1(C(=O)N2CCC[C@H](n3cc[nH+]c3)C2)CCC1 ZINC000674240235 487531264 /nfs/dbraw/zinc/53/12/64/487531264.db2.gz HSKINYRSFNWHHJ-LBPRGKRZSA-N 1 2 247.342 2.237 20 0 BEADLO Cc1cn2c([nH+]1)CN([C@H](C)c1ncc(C)o1)CC2 ZINC000679869998 487478733 /nfs/dbraw/zinc/47/87/33/487478733.db2.gz UKJFIYODRLXZEN-LLVKDONJSA-N 1 2 246.314 2.065 20 0 BEADLO c1cn2c(n1)[C@@H]([NH2+]Cc1ccoc1)CCC2 ZINC000655696981 487494288 /nfs/dbraw/zinc/49/42/88/487494288.db2.gz GFMBXQYMINGIJH-NSHDSACASA-N 1 2 217.272 2.101 20 0 BEADLO C[C@H](Nc1cc[nH+]c(C(C)(C)C)n1)C(C)(C)O ZINC000674064208 487503937 /nfs/dbraw/zinc/50/39/37/487503937.db2.gz LPNJHMXWPYWIET-VIFPVBQESA-N 1 2 237.347 2.345 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)[C@@H](C)C1CCCC1 ZINC000674082100 487513381 /nfs/dbraw/zinc/51/33/81/487513381.db2.gz ATZDCMSUGOQEFP-RYUDHWBXSA-N 1 2 249.358 2.214 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)[C@@H](C)C1CCCC1 ZINC000674082098 487513605 /nfs/dbraw/zinc/51/36/05/487513605.db2.gz ATZDCMSUGOQEFP-NEPJUHHUSA-N 1 2 249.358 2.214 20 0 BEADLO CC(C)(C)c1nc(NCc2cocn2)cc[nH+]1 ZINC000674065329 487507361 /nfs/dbraw/zinc/50/73/61/487507361.db2.gz CMQHVZVADJDTMI-UHFFFAOYSA-N 1 2 232.287 2.374 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H](C)C1CCCC1 ZINC000674136196 487525711 /nfs/dbraw/zinc/52/57/11/487525711.db2.gz LGUJPHFLBFNHKF-VIFPVBQESA-N 1 2 235.331 2.161 20 0 BEADLO Oc1ccc(C[NH2+]C2(C(F)F)CC2)cc1 ZINC000379931311 488159670 /nfs/dbraw/zinc/15/96/70/488159670.db2.gz OOTLECIIXZJIQH-UHFFFAOYSA-N 1 2 213.227 2.280 20 0 BEADLO CC(C)c1noc(Cc2cn3c([nH+]2)CCCC3)n1 ZINC000351395998 487659176 /nfs/dbraw/zinc/65/91/76/487659176.db2.gz DSKBJUPEIAGMLV-UHFFFAOYSA-N 1 2 246.314 2.317 20 0 BEADLO CCC(C)(C)CC(=O)Nc1cc[nH+]cc1N(C)C ZINC000681358120 487783957 /nfs/dbraw/zinc/78/39/57/487783957.db2.gz QGDRCDOJQIUCFH-UHFFFAOYSA-N 1 2 249.358 2.334 20 0 BEADLO c1cn(-c2cccc(NCc3cn[nH]c3)c2)c[nH+]1 ZINC000676320454 487836624 /nfs/dbraw/zinc/83/66/24/487836624.db2.gz WFFPFCCJUTXOLJ-UHFFFAOYSA-N 1 2 239.282 2.208 20 0 BEADLO c1cc(N2CCC[C@@H]3C[C@@H]32)nc(C2CC2)[nH+]1 ZINC000672323841 487919583 /nfs/dbraw/zinc/91/95/83/487919583.db2.gz TUOOWAVVMAVHFD-MNOVXSKESA-N 1 2 215.300 2.343 20 0 BEADLO Cc1ccccc1C[N@@H+]1CCc2cn[nH]c2C1 ZINC000676795194 487930933 /nfs/dbraw/zinc/93/09/33/487930933.db2.gz HALBSDYTGIKBDP-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1ccccc1C[N@H+]1CCc2cn[nH]c2C1 ZINC000676795194 487930939 /nfs/dbraw/zinc/93/09/39/487930939.db2.gz HALBSDYTGIKBDP-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO CCn1cc(C[NH2+][C@H]2CCCc3occc32)nn1 ZINC000404518952 488166709 /nfs/dbraw/zinc/16/67/09/488166709.db2.gz YUAQQNAFUJVXQH-LBPRGKRZSA-N 1 2 246.314 2.058 20 0 BEADLO CCn1cc(C[NH2+]Cc2cc(C)ccc2F)nn1 ZINC000404519001 488166724 /nfs/dbraw/zinc/16/67/24/488166724.db2.gz YXQSGWZEYSSDHZ-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO COc1cccc(C[NH2+]Cc2cocn2)c1F ZINC000397894650 488166834 /nfs/dbraw/zinc/16/68/34/488166834.db2.gz QJFYLZMSXMOMQV-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO CN(CC(C)(C)C)C(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000667972330 488172749 /nfs/dbraw/zinc/17/27/49/488172749.db2.gz MPBYVRQKWYSGMK-JTQLQIEISA-N 1 2 249.358 2.019 20 0 BEADLO CN(CC(C)(C)C)C(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000667972330 488172752 /nfs/dbraw/zinc/17/27/52/488172752.db2.gz MPBYVRQKWYSGMK-JTQLQIEISA-N 1 2 249.358 2.019 20 0 BEADLO C[C@@H](C(=O)NCCCn1cc[nH+]c1)C1CCCC1 ZINC000674076643 488179340 /nfs/dbraw/zinc/17/93/40/488179340.db2.gz MWEUTNLAHSUOGF-GFCCVEGCSA-N 1 2 249.358 2.216 20 0 BEADLO c1nnc(C[N@H+]2CC=CCC2)n1-c1ccccc1 ZINC000683523985 488185750 /nfs/dbraw/zinc/18/57/50/488185750.db2.gz QFJGXUJGLPMXER-UHFFFAOYSA-N 1 2 240.310 2.029 20 0 BEADLO c1nnc(C[N@@H+]2CC=CCC2)n1-c1ccccc1 ZINC000683523985 488185752 /nfs/dbraw/zinc/18/57/52/488185752.db2.gz QFJGXUJGLPMXER-UHFFFAOYSA-N 1 2 240.310 2.029 20 0 BEADLO COCc1cccc(C[N@H+](C)Cc2ncc[nH]2)c1 ZINC000678052530 488187465 /nfs/dbraw/zinc/18/74/65/488187465.db2.gz GWJIPKKMCSFNPQ-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO COCc1cccc(C[N@@H+](C)Cc2ncc[nH]2)c1 ZINC000678052530 488187467 /nfs/dbraw/zinc/18/74/67/488187467.db2.gz GWJIPKKMCSFNPQ-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO CCc1cc(NC2C[C@@H](C)O[C@H](C)C2)nc[nH+]1 ZINC000678070937 488190877 /nfs/dbraw/zinc/19/08/77/488190877.db2.gz KMMUMBVVQHHHBM-NXEZZACHSA-N 1 2 235.331 2.407 20 0 BEADLO Cc1cc(NC(=O)NCCC2CC2)c(C)c[nH+]1 ZINC000678097172 488197719 /nfs/dbraw/zinc/19/77/19/488197719.db2.gz SEYXSXIAOWLKTG-UHFFFAOYSA-N 1 2 233.315 2.042 20 0 BEADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1csnn1 ZINC000678120180 488199887 /nfs/dbraw/zinc/19/98/87/488199887.db2.gz BLRUEMZPIIAARI-DTORHVGOSA-N 1 2 211.334 2.301 20 0 BEADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1csnn1 ZINC000678120180 488199889 /nfs/dbraw/zinc/19/98/89/488199889.db2.gz BLRUEMZPIIAARI-DTORHVGOSA-N 1 2 211.334 2.301 20 0 BEADLO C[C@@H]1C[N@H+](Cc2[nH]nc3ccccc32)[C@H](C)CO1 ZINC000678154118 488209097 /nfs/dbraw/zinc/20/90/97/488209097.db2.gz ZVHLHYHAHWAYGC-GHMZBOCLSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2[nH]nc3ccccc32)[C@H](C)CO1 ZINC000678154118 488209100 /nfs/dbraw/zinc/20/91/00/488209100.db2.gz ZVHLHYHAHWAYGC-GHMZBOCLSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1C[N@H+](Cc2n[nH]c3ccccc32)[C@H](C)CO1 ZINC000678154118 488209102 /nfs/dbraw/zinc/20/91/02/488209102.db2.gz ZVHLHYHAHWAYGC-GHMZBOCLSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2n[nH]c3ccccc32)[C@H](C)CO1 ZINC000678154118 488209105 /nfs/dbraw/zinc/20/91/05/488209105.db2.gz ZVHLHYHAHWAYGC-GHMZBOCLSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1C[N@H+](Cc2[nH]nc3ccccc32)[C@@H](C)CO1 ZINC000678154121 488209324 /nfs/dbraw/zinc/20/93/24/488209324.db2.gz ZVHLHYHAHWAYGC-WDEREUQCSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2[nH]nc3ccccc32)[C@@H](C)CO1 ZINC000678154121 488209327 /nfs/dbraw/zinc/20/93/27/488209327.db2.gz ZVHLHYHAHWAYGC-WDEREUQCSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1C[N@H+](Cc2n[nH]c3ccccc32)[C@@H](C)CO1 ZINC000678154121 488209330 /nfs/dbraw/zinc/20/93/30/488209330.db2.gz ZVHLHYHAHWAYGC-WDEREUQCSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2n[nH]c3ccccc32)[C@@H](C)CO1 ZINC000678154121 488209333 /nfs/dbraw/zinc/20/93/33/488209333.db2.gz ZVHLHYHAHWAYGC-WDEREUQCSA-N 1 2 245.326 2.172 20 0 BEADLO Cc1cn2ccc(NC(=O)NC3CCC3)cc2[nH+]1 ZINC000668154186 488210777 /nfs/dbraw/zinc/21/07/77/488210777.db2.gz HTJYZDARQXIYCL-UHFFFAOYSA-N 1 2 244.298 2.317 20 0 BEADLO c1c(C[NH+]2CC3(C2)CCCC3)nnn1C1CCC1 ZINC000668173542 488214236 /nfs/dbraw/zinc/21/42/36/488214236.db2.gz LBDDGJHWEYHXAW-UHFFFAOYSA-N 1 2 246.358 2.379 20 0 BEADLO CC[C@@H]1CC[N@@H+]1Cc1c(C(F)(F)F)cnn1C ZINC000668189657 488218913 /nfs/dbraw/zinc/21/89/13/488218913.db2.gz KVAYIQMEYIEDRG-MRVPVSSYSA-N 1 2 247.264 2.423 20 0 BEADLO CC[C@@H]1CC[N@H+]1Cc1c(C(F)(F)F)cnn1C ZINC000668189657 488218915 /nfs/dbraw/zinc/21/89/15/488218915.db2.gz KVAYIQMEYIEDRG-MRVPVSSYSA-N 1 2 247.264 2.423 20 0 BEADLO CCc1ncc(C[N@H+](C)Cc2cn[nH]c2)s1 ZINC000678262345 488229322 /nfs/dbraw/zinc/22/93/22/488229322.db2.gz NDFJNDSLJRRXMA-UHFFFAOYSA-N 1 2 236.344 2.061 20 0 BEADLO C[N@H+](Cc1cn[nH]c1)Cc1c[nH]nc1C(C)(C)C ZINC000678265995 488230043 /nfs/dbraw/zinc/23/00/43/488230043.db2.gz HRFJBGIXRUIQFG-UHFFFAOYSA-N 1 2 247.346 2.062 20 0 BEADLO C[N@@H+](Cc1cn[nH]c1)Cc1c[nH]nc1C(C)(C)C ZINC000678265995 488230046 /nfs/dbraw/zinc/23/00/46/488230046.db2.gz HRFJBGIXRUIQFG-UHFFFAOYSA-N 1 2 247.346 2.062 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2[nH]nc3ccccc32)[C@H]1C ZINC000678267370 488231364 /nfs/dbraw/zinc/23/13/64/488231364.db2.gz PQBAHEAGJSFAIH-WDEREUQCSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2[nH]nc3ccccc32)[C@H]1C ZINC000678267370 488231365 /nfs/dbraw/zinc/23/13/65/488231365.db2.gz PQBAHEAGJSFAIH-WDEREUQCSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2n[nH]c3ccccc32)[C@H]1C ZINC000678267370 488231367 /nfs/dbraw/zinc/23/13/67/488231367.db2.gz PQBAHEAGJSFAIH-WDEREUQCSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2n[nH]c3ccccc32)[C@H]1C ZINC000678267370 488231369 /nfs/dbraw/zinc/23/13/69/488231369.db2.gz PQBAHEAGJSFAIH-WDEREUQCSA-N 1 2 245.326 2.172 20 0 BEADLO CCC[C@H](C)CC(=O)N[C@@H]1CCc2c[nH+]cn2C1 ZINC000672145236 488240966 /nfs/dbraw/zinc/24/09/66/488240966.db2.gz BAUBUMRZOHQVJP-NWDGAFQWSA-N 1 2 249.358 2.140 20 0 BEADLO CCC(C)(CC)C(=O)N[C@@H]1CCc2c[nH+]cn2C1 ZINC000672149710 488241072 /nfs/dbraw/zinc/24/10/72/488241072.db2.gz VTCGYEWTOALORZ-LLVKDONJSA-N 1 2 249.358 2.140 20 0 BEADLO CN(Cc1cn(C)c[nH+]1)Cc1ccccc1F ZINC000683899508 488241376 /nfs/dbraw/zinc/24/13/76/488241376.db2.gz WORKYBBOOQTLHB-UHFFFAOYSA-N 1 2 233.290 2.191 20 0 BEADLO Fc1ccc(N2CCC[C@H](n3cc[nH+]c3)C2)nc1 ZINC000672207641 488244922 /nfs/dbraw/zinc/24/49/22/488244922.db2.gz MYPSXAMQBDPQHV-LBPRGKRZSA-N 1 2 246.289 2.259 20 0 BEADLO CCCCNc1cc(N2CCC[C@@H]2C)nc(N)[nH+]1 ZINC000672226699 488246392 /nfs/dbraw/zinc/24/63/92/488246392.db2.gz SXEIODVKTMRHTF-JTQLQIEISA-N 1 2 249.362 2.260 20 0 BEADLO CCCCNc1cc(N2CCC[C@@H]2C)[nH+]c(N)n1 ZINC000672226699 488246394 /nfs/dbraw/zinc/24/63/94/488246394.db2.gz SXEIODVKTMRHTF-JTQLQIEISA-N 1 2 249.362 2.260 20 0 BEADLO COc1ccncc1C[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000672553079 488259599 /nfs/dbraw/zinc/25/95/99/488259599.db2.gz ZNBKLAMHYMUTEY-ZYHUDNBSSA-N 1 2 238.306 2.270 20 0 BEADLO COc1ccncc1C[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000672553079 488259600 /nfs/dbraw/zinc/25/96/00/488259600.db2.gz ZNBKLAMHYMUTEY-ZYHUDNBSSA-N 1 2 238.306 2.270 20 0 BEADLO CC[C@H]1CCC[C@@H](NC(=O)Cc2c[nH+]cn2C)C1 ZINC000672918929 488269028 /nfs/dbraw/zinc/26/90/28/488269028.db2.gz BCHMNQNMPJJCNR-NWDGAFQWSA-N 1 2 249.358 2.048 20 0 BEADLO CC(C)CCN(C)C(=O)C(C)(C)c1c[nH+]c[nH]1 ZINC000684190310 488272818 /nfs/dbraw/zinc/27/28/18/488272818.db2.gz FMMKBKLSEBQUQG-UHFFFAOYSA-N 1 2 237.347 2.192 20 0 BEADLO CCc1noc(C[N@@H+]2CCC(C)=C(C)C2)n1 ZINC000684629526 488335224 /nfs/dbraw/zinc/33/52/24/488335224.db2.gz QFLZGWHGGRJIMO-UHFFFAOYSA-N 1 2 221.304 2.174 20 0 BEADLO CCc1noc(C[N@H+]2CCC(C)=C(C)C2)n1 ZINC000684629526 488335227 /nfs/dbraw/zinc/33/52/27/488335227.db2.gz QFLZGWHGGRJIMO-UHFFFAOYSA-N 1 2 221.304 2.174 20 0 BEADLO COC[C@H]1CCCN(c2cc[nH+]cc2F)C1 ZINC000678787492 488283519 /nfs/dbraw/zinc/28/35/19/488283519.db2.gz PQWOKWDTODFCNF-JTQLQIEISA-N 1 2 224.279 2.084 20 0 BEADLO COc1cccc(CCNc2cc[nH+]cc2F)c1 ZINC000678789177 488283531 /nfs/dbraw/zinc/28/35/31/488283531.db2.gz SUUHRJKLXMXJTI-UHFFFAOYSA-N 1 2 246.285 2.306 20 0 BEADLO C(c1nc2c(s1)CCC2)[NH+]1CCSCC1 ZINC000678812954 488286051 /nfs/dbraw/zinc/28/60/51/488286051.db2.gz YWJHBSDBVIEWLY-UHFFFAOYSA-N 1 2 240.397 2.181 20 0 BEADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1cn(C)cn1 ZINC000673608611 488297717 /nfs/dbraw/zinc/29/77/17/488297717.db2.gz DRWFHMHCWHRBFX-UHFFFAOYSA-N 1 2 248.330 2.050 20 0 BEADLO CC(C)(C)OCCCOCc1[nH]cc[nH+]1 ZINC000679010460 488302850 /nfs/dbraw/zinc/30/28/50/488302850.db2.gz YFGBTUMRYIPIAW-UHFFFAOYSA-N 1 2 212.293 2.132 20 0 BEADLO C[C@H]([NH2+]Cc1cocn1)c1cccc(CO)c1 ZINC000679050982 488304977 /nfs/dbraw/zinc/30/49/77/488304977.db2.gz UNIMUABLQOFFPL-JTQLQIEISA-N 1 2 232.283 2.018 20 0 BEADLO CC[C@@H](Nc1ccc(OC)c[nH+]1)[C@H]1CCOC1 ZINC000679068461 488305690 /nfs/dbraw/zinc/30/56/90/488305690.db2.gz DTGKRVIKRPNBEG-CMPLNLGQSA-N 1 2 236.315 2.317 20 0 BEADLO COc1ccc[nH+]c1N[C@H](C)C[C@@H]1CCOC1 ZINC000679092321 488308192 /nfs/dbraw/zinc/30/81/92/488308192.db2.gz ZKIWHZWYSPHBLS-MNOVXSKESA-N 1 2 236.315 2.317 20 0 BEADLO COc1cc[nH+]cc1NC(=O)CCC(F)F ZINC000684420537 488310317 /nfs/dbraw/zinc/31/03/17/488310317.db2.gz OZCDXSBVNHOSSB-UHFFFAOYSA-N 1 2 230.214 2.074 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)cn1 ZINC000679217735 488317094 /nfs/dbraw/zinc/31/70/94/488317094.db2.gz AUEPIXRHKCZRFV-CMPLNLGQSA-N 1 2 238.306 2.270 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@H](C)[C@H](F)C2)cn1 ZINC000679217735 488317096 /nfs/dbraw/zinc/31/70/96/488317096.db2.gz AUEPIXRHKCZRFV-CMPLNLGQSA-N 1 2 238.306 2.270 20 0 BEADLO COc1cccc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)n1 ZINC000679219252 488317505 /nfs/dbraw/zinc/31/75/05/488317505.db2.gz FNYQUDOGHNOLMJ-ZYHUDNBSSA-N 1 2 238.306 2.270 20 0 BEADLO COc1cccc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)n1 ZINC000679219252 488317507 /nfs/dbraw/zinc/31/75/07/488317507.db2.gz FNYQUDOGHNOLMJ-ZYHUDNBSSA-N 1 2 238.306 2.270 20 0 BEADLO C[C@H]1CC[N@H+](CCOCC(F)(F)F)C[C@@H]1F ZINC000679217490 488317618 /nfs/dbraw/zinc/31/76/18/488317618.db2.gz GBIOBCNKBHBZAX-IUCAKERBSA-N 1 2 243.244 2.245 20 0 BEADLO C[C@H]1CC[N@@H+](CCOCC(F)(F)F)C[C@@H]1F ZINC000679217490 488317620 /nfs/dbraw/zinc/31/76/20/488317620.db2.gz GBIOBCNKBHBZAX-IUCAKERBSA-N 1 2 243.244 2.245 20 0 BEADLO CC[C@@H](NC(=O)CCC(F)F)c1[nH]cc[nH+]1 ZINC000684478060 488320114 /nfs/dbraw/zinc/32/01/14/488320114.db2.gz ORMUWVKIPQAIPQ-SSDOTTSWSA-N 1 2 231.246 2.022 20 0 BEADLO C1=CCN(c2cc(N3CCCCC3)[nH+]cn2)CC1 ZINC000679280352 488327692 /nfs/dbraw/zinc/32/76/92/488327692.db2.gz ZPEFGFMYHZXCPA-UHFFFAOYSA-N 1 2 244.342 2.233 20 0 BEADLO C1=CCN(c2cc(N3CCCCC3)nc[nH+]2)CC1 ZINC000679280352 488327693 /nfs/dbraw/zinc/32/76/93/488327693.db2.gz ZPEFGFMYHZXCPA-UHFFFAOYSA-N 1 2 244.342 2.233 20 0 BEADLO Cc1nc(N2CC=CCC2)c(C)c(C)[nH+]1 ZINC000679279534 488328211 /nfs/dbraw/zinc/32/82/11/488328211.db2.gz AEBURRQXCBOWSF-UHFFFAOYSA-N 1 2 203.289 2.168 20 0 BEADLO O=C(C[N@H+]1CC=CCC1)Nc1cccc(F)c1 ZINC000679324561 488337726 /nfs/dbraw/zinc/33/77/26/488337726.db2.gz WYDLYWQJYLRCGY-UHFFFAOYSA-N 1 2 234.274 2.026 20 0 BEADLO O=C(C[N@@H+]1CC=CCC1)Nc1cccc(F)c1 ZINC000679324561 488337728 /nfs/dbraw/zinc/33/77/28/488337728.db2.gz WYDLYWQJYLRCGY-UHFFFAOYSA-N 1 2 234.274 2.026 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CCCCO1 ZINC000679365009 488347033 /nfs/dbraw/zinc/34/70/33/488347033.db2.gz WOKZUDSHFRFLMO-GAFUQQFSSA-N 1 2 237.347 2.326 20 0 BEADLO Cc1cn2c([nH+]1)CN(c1nc(C)c(C)s1)CC2 ZINC000679846269 488368461 /nfs/dbraw/zinc/36/84/61/488368461.db2.gz ZBQXEGWOXCCOES-UHFFFAOYSA-N 1 2 248.355 2.285 20 0 BEADLO CC[C@H]1C[N@H+](Cc2[nH]ncc2C)[C@@H](CC)CO1 ZINC000651913301 490154771 /nfs/dbraw/zinc/15/47/71/490154771.db2.gz RYILNOSMWUTUEO-RYUDHWBXSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2[nH]ncc2C)[C@@H](CC)CO1 ZINC000651913301 490154773 /nfs/dbraw/zinc/15/47/73/490154773.db2.gz RYILNOSMWUTUEO-RYUDHWBXSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@H]1C[N@H+](Cc2n[nH]cc2C)[C@@H](CC)CO1 ZINC000651913301 490154777 /nfs/dbraw/zinc/15/47/77/490154777.db2.gz RYILNOSMWUTUEO-RYUDHWBXSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2n[nH]cc2C)[C@@H](CC)CO1 ZINC000651913301 490154780 /nfs/dbraw/zinc/15/47/80/490154780.db2.gz RYILNOSMWUTUEO-RYUDHWBXSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@H]1CCC[N@H+](Cc2noc(C)n2)C1 ZINC000045943469 490157551 /nfs/dbraw/zinc/15/75/51/490157551.db2.gz SSOHRHYOXNYAGJ-JTQLQIEISA-N 1 2 209.293 2.000 20 0 BEADLO CC[C@H]1CCC[N@@H+](Cc2noc(C)n2)C1 ZINC000045943469 490157557 /nfs/dbraw/zinc/15/75/57/490157557.db2.gz SSOHRHYOXNYAGJ-JTQLQIEISA-N 1 2 209.293 2.000 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H](C)OCC23CCC3)on1 ZINC000649822091 490205235 /nfs/dbraw/zinc/20/52/35/490205235.db2.gz YGDBWWOGUUYJMC-LLVKDONJSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H](C)OCC23CCC3)on1 ZINC000649822091 490205242 /nfs/dbraw/zinc/20/52/42/490205242.db2.gz YGDBWWOGUUYJMC-LLVKDONJSA-N 1 2 236.315 2.126 20 0 BEADLO COc1ccccc1C[NH2+][C@@H](C)c1nccn1C ZINC000070443262 490212714 /nfs/dbraw/zinc/21/27/14/490212714.db2.gz WZQUISYXOOMUHH-NSHDSACASA-N 1 2 245.326 2.280 20 0 BEADLO COc1ccccc1C[NH2+][C@H](C)c1nccn1C ZINC000070443263 490212847 /nfs/dbraw/zinc/21/28/47/490212847.db2.gz WZQUISYXOOMUHH-LLVKDONJSA-N 1 2 245.326 2.280 20 0 BEADLO COc1ccc(OCCOCc2[nH]cc[nH+]2)cc1 ZINC000123806243 490261219 /nfs/dbraw/zinc/26/12/19/490261219.db2.gz DNOKPXAWLZQKCG-UHFFFAOYSA-N 1 2 248.282 2.014 20 0 BEADLO CCc1cc(-c2[nH+]ccn2C)ccc1N ZINC000084194070 490380138 /nfs/dbraw/zinc/38/01/38/490380138.db2.gz YNHUZCMDJZMDOZ-UHFFFAOYSA-N 1 2 201.273 2.232 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)Nc1ccc(F)cc1 ZINC000074727122 490500787 /nfs/dbraw/zinc/50/07/87/490500787.db2.gz JNYJUYCIJUCDHE-UHFFFAOYSA-N 1 2 233.246 2.120 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)Nc1ccc(F)cc1 ZINC000074727122 490500798 /nfs/dbraw/zinc/50/07/98/490500798.db2.gz JNYJUYCIJUCDHE-UHFFFAOYSA-N 1 2 233.246 2.120 20 0 BEADLO CCC(=O)c1cccc(NC(=O)[C@H](C)[NH+](C)C)c1 ZINC000126702356 490513771 /nfs/dbraw/zinc/51/37/71/490513771.db2.gz SJJDWXATRUFLOK-JTQLQIEISA-N 1 2 248.326 2.168 20 0 BEADLO CO[C@]1(C)C[C@@H]([N@H+](C)CC(F)F)C1(C)C ZINC000076151939 490550719 /nfs/dbraw/zinc/55/07/19/490550719.db2.gz XNTPRFORDVFLST-LDYMZIIASA-N 1 2 221.291 2.387 20 0 BEADLO CO[C@]1(C)C[C@@H]([N@@H+](C)CC(F)F)C1(C)C ZINC000076151939 490550723 /nfs/dbraw/zinc/55/07/23/490550723.db2.gz XNTPRFORDVFLST-LDYMZIIASA-N 1 2 221.291 2.387 20 0 BEADLO Cc1nc(C[NH2+][C@H](C)c2nccnc2C)cs1 ZINC000219103416 490553422 /nfs/dbraw/zinc/55/34/22/490553422.db2.gz DEGXQFSVVTUZLP-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1c1cc(CO)cc[nH+]1 ZINC000136427493 490562981 /nfs/dbraw/zinc/56/29/81/490562981.db2.gz KXIBBZGBDUUDAT-CMPLNLGQSA-N 1 2 220.316 2.341 20 0 BEADLO C[C@H]1CC[C@H]1NC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000672668749 490615881 /nfs/dbraw/zinc/61/58/81/490615881.db2.gz PIYSPQRGLJOZJA-GXSJLCMTSA-N 1 2 244.298 2.254 20 0 BEADLO Cc1nc(C[N@H+]2CC3(CCC3)OC[C@H]2C)co1 ZINC000661462786 490681248 /nfs/dbraw/zinc/68/12/48/490681248.db2.gz KCQSUACJXHUHDR-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1nc(C[N@@H+]2CC3(CCC3)OC[C@H]2C)co1 ZINC000661462786 490681253 /nfs/dbraw/zinc/68/12/53/490681253.db2.gz KCQSUACJXHUHDR-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1ccc(N[C@H]2CCCOC2)c(C)[nH+]1 ZINC000087151759 491066002 /nfs/dbraw/zinc/06/60/02/491066002.db2.gz HZHCSDMYDWFTII-NSHDSACASA-N 1 2 206.289 2.289 20 0 BEADLO COc1ccc(NCc2c(C)nn(C)c2C)[nH+]c1 ZINC000225894223 491097066 /nfs/dbraw/zinc/09/70/66/491097066.db2.gz HTSHZHFBZGSPKA-UHFFFAOYSA-N 1 2 246.314 2.053 20 0 BEADLO Cc1ncc([C@H](C)[NH2+]Cc2ccon2)s1 ZINC000090418701 491126728 /nfs/dbraw/zinc/12/67/28/491126728.db2.gz VOHOWTXNPWULNI-ZETCQYMHSA-N 1 2 223.301 2.290 20 0 BEADLO Cc1ccncc1[C@@H](C)[NH2+]CC(F)F ZINC000308679619 491137717 /nfs/dbraw/zinc/13/77/17/491137717.db2.gz XGKBCKVSOSBOII-MRVPVSSYSA-N 1 2 200.232 2.306 20 0 BEADLO CC(C)c1nc(N[C@@H](C)C[C@H](C)O)cc[nH+]1 ZINC000309370817 491147613 /nfs/dbraw/zinc/14/76/13/491147613.db2.gz QKXYKWFOMBPVDH-UWVGGRQHSA-N 1 2 223.320 2.171 20 0 BEADLO CC(C)c1nc(N2CC[C@@H]3C[C@@H]32)cc[nH+]1 ZINC000804688311 582526573 /nfs/dbraw/zinc/52/65/73/582526573.db2.gz IOIIRSGDFYKSOB-ZJUUUORDSA-N 1 2 203.289 2.199 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2C[C@H]3[C@@H](C2)C3(F)F)s1 ZINC000844457062 582592443 /nfs/dbraw/zinc/59/24/43/582592443.db2.gz ISRMDSOGVLDCBW-NJUXHZRNSA-N 1 2 245.298 2.104 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)s1 ZINC000844457062 582592445 /nfs/dbraw/zinc/59/24/45/582592445.db2.gz ISRMDSOGVLDCBW-NJUXHZRNSA-N 1 2 245.298 2.104 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493143141 533860852 /nfs/dbraw/zinc/86/08/52/533860852.db2.gz AAUJNXALFWGWRX-PVTPVBHGSA-N 1 2 233.315 2.118 20 0 BEADLO CCONC(=O)C[NH2+][C@@H](C)C1CCCCCC1 ZINC000846091914 582644613 /nfs/dbraw/zinc/64/46/13/582644613.db2.gz QQHKGYJNHALMTB-NSHDSACASA-N 1 2 242.363 2.003 20 0 BEADLO Cc1ccc(CNC(=O)C=Cc2c[nH]c[nH+]2)cc1 ZINC000492823399 533965783 /nfs/dbraw/zinc/96/57/83/533965783.db2.gz NCDVFTSQAILMFA-SREVYHEPSA-N 1 2 241.294 2.048 20 0 BEADLO CC[C@@H]1COCCN1c1cc[nH+]c(C(C)C)n1 ZINC000115522159 535837459 /nfs/dbraw/zinc/83/74/59/535837459.db2.gz ORSQLUADWFPVOH-LLVKDONJSA-N 1 2 235.331 2.215 20 0 BEADLO C[C@@H]1CC[C@H](C)N(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493231631 534219559 /nfs/dbraw/zinc/21/95/59/534219559.db2.gz YBHNZWCMIDSGNR-PVTPVBHGSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@@H]1CC[C@H](N(C)C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492761519 534244161 /nfs/dbraw/zinc/24/41/61/534244161.db2.gz GLYSIONMQYCTNJ-UIALCFJWSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@@H](N(C)C(=O)C=Cc1c[nH]c[nH+]1)C(C)(C)C ZINC000493577173 534280778 /nfs/dbraw/zinc/28/07/78/534280778.db2.gz DHGDYKQLSUJCIO-VQCYPWCPSA-N 1 2 235.331 2.316 20 0 BEADLO FC(F)CN(Cc1[nH+]ccn1C1CC1)C1CC1 ZINC000891991671 582755079 /nfs/dbraw/zinc/75/50/79/582755079.db2.gz GUBATAAQWIZGQJ-UHFFFAOYSA-N 1 2 241.285 2.448 20 0 BEADLO CC(C)(C(=O)Nc1ccccc1O)c1c[nH+]c[nH]1 ZINC000336052469 534381961 /nfs/dbraw/zinc/38/19/61/534381961.db2.gz SVYOSOMRXBGBTM-UHFFFAOYSA-N 1 2 245.282 2.032 20 0 BEADLO CC(C)(C(=O)Nc1ccccc1O)c1c[nH]c[nH+]1 ZINC000336052469 534381973 /nfs/dbraw/zinc/38/19/73/534381973.db2.gz SVYOSOMRXBGBTM-UHFFFAOYSA-N 1 2 245.282 2.032 20 0 BEADLO COCCCCCNc1cccc([C@@H](C)O)[nH+]1 ZINC000892133350 582797760 /nfs/dbraw/zinc/79/77/60/582797760.db2.gz OHWPSXOBWFHYMP-LLVKDONJSA-N 1 2 238.331 2.364 20 0 BEADLO c1ccc(NCCC[C@H]2CCOC2)[nH+]c1 ZINC000402218793 534496232 /nfs/dbraw/zinc/49/62/32/534496232.db2.gz NWYXHSOYSJVJCZ-NSHDSACASA-N 1 2 206.289 2.310 20 0 BEADLO COC(=O)[C@@H](c1cccc(Cl)c1)[NH+](C)C ZINC000095532607 523653415 /nfs/dbraw/zinc/65/34/15/523653415.db2.gz DYRGKXWOHAXGIO-SNVBAGLBSA-N 1 2 227.691 2.116 20 0 BEADLO COc1ccccc1C[NH2+][C@@H](C)c1ccn(C)n1 ZINC000020349327 524490032 /nfs/dbraw/zinc/49/00/32/524490032.db2.gz WFUXYSBZUPKHMG-NSHDSACASA-N 1 2 245.326 2.280 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CC2(C1)CCCCC2 ZINC000493363338 534801489 /nfs/dbraw/zinc/80/14/89/534801489.db2.gz ZZTVOLWLHSLBSB-PLNGDYQASA-N 1 2 245.326 2.216 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N[C@H](C1CC1)C1CCC1 ZINC000493427874 534802363 /nfs/dbraw/zinc/80/23/63/534802363.db2.gz RIWCHEJIMFRKSK-AFNCTOJWSA-N 1 2 245.326 2.118 20 0 BEADLO Cc1cscc1CNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492901456 534831856 /nfs/dbraw/zinc/83/18/56/534831856.db2.gz PIELKVMLLGWUKQ-NSCUHMNNSA-N 1 2 247.323 2.109 20 0 BEADLO CC(C)c1nc(N2CCC3(CCO3)CC2)cc[nH+]1 ZINC000374410153 534908714 /nfs/dbraw/zinc/90/87/14/534908714.db2.gz RQMXIHFSTCHAOQ-UHFFFAOYSA-N 1 2 247.342 2.359 20 0 BEADLO CC(C)Cn1cc[nH+]c1CNC(=O)CC1CCC1 ZINC000080501967 534910923 /nfs/dbraw/zinc/91/09/23/534910923.db2.gz FZNPMIBJBDXYOL-UHFFFAOYSA-N 1 2 249.358 2.346 20 0 BEADLO CC(C)(C)[C@@H]1CCN(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493630878 526668349 /nfs/dbraw/zinc/66/83/49/526668349.db2.gz ZYVYVAFMLOOXQC-SGUJLRQBSA-N 1 2 247.342 2.318 20 0 BEADLO CC(C)(C)[C@H]1CCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492902084 526721692 /nfs/dbraw/zinc/72/16/92/526721692.db2.gz QLJNOFCCXOBPHO-ZHRWSRJISA-N 1 2 247.342 2.460 20 0 BEADLO CC(C)(C)/C=C\C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000493313242 527553477 /nfs/dbraw/zinc/55/34/77/527553477.db2.gz ADVTXORRBJOFOI-SREVYHEPSA-N 1 2 235.331 2.363 20 0 BEADLO CC(C)(C)C=CC(=O)Nc1ccc(N)[nH+]c1 ZINC000493340772 527557447 /nfs/dbraw/zinc/55/74/47/527557447.db2.gz VXLZRDUNGWQDJW-SREVYHEPSA-N 1 2 219.288 2.035 20 0 BEADLO C/C=C/C=C\C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000492921612 527592818 /nfs/dbraw/zinc/59/28/18/527592818.db2.gz FFLXRUIGELHRQD-IAROGAJJSA-N 1 2 245.326 2.179 20 0 BEADLO CC=CC=CC(=O)NC(C)(C)c1[nH]cc(C)[nH+]1 ZINC000493787766 527599642 /nfs/dbraw/zinc/59/96/42/527599642.db2.gz LARPZOMPBRFVSG-MDAAKZFYSA-N 1 2 233.315 2.202 20 0 BEADLO C/C=C/C=C\C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000493430596 527613215 /nfs/dbraw/zinc/61/32/15/527613215.db2.gz YQFJSZUQZXFCEE-IAROGAJJSA-N 1 2 227.267 2.405 20 0 BEADLO CC(C)(C)C(C)(C)NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493205851 527617666 /nfs/dbraw/zinc/61/76/66/527617666.db2.gz LOQJXQFNZXLYLO-VOTSOKGWSA-N 1 2 235.331 2.364 20 0 BEADLO CC(C)(C)CCCNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492892963 527661626 /nfs/dbraw/zinc/66/16/26/527661626.db2.gz FTJNYDYLJLFJNA-WAYWQWQTSA-N 1 2 235.331 2.365 20 0 BEADLO CC(C)CCN(C(=O)/C=C/c1[nH]cc[nH+]1)C1CC1 ZINC000493608036 527706524 /nfs/dbraw/zinc/70/65/24/527706524.db2.gz BRQHHZBRXSOMAF-AATRIKPKSA-N 1 2 247.342 2.460 20 0 BEADLO CCCN(C(=O)/C=C/c1[nH]cc[nH+]1)C(C)C ZINC000493204937 527719956 /nfs/dbraw/zinc/71/99/56/527719956.db2.gz JUOFDCMXRHJYMY-AATRIKPKSA-N 1 2 221.304 2.070 20 0 BEADLO CC(C)[C@H]1N(C(=O)C=Cc2c[nH]c[nH+]2)CC1(C)C ZINC000492811406 527888556 /nfs/dbraw/zinc/88/85/56/527888556.db2.gz UABINJFSERHZPY-CFHLNLSMSA-N 1 2 247.342 2.316 20 0 BEADLO CCCC1(CNC(=O)/C=C/c2[nH]cc[nH+]2)CC1 ZINC000493400392 528037561 /nfs/dbraw/zinc/03/75/61/528037561.db2.gz JDSWOUFJCXPZCW-ONEGZZNKSA-N 1 2 233.315 2.119 20 0 BEADLO CC(C)[C@@H](C)N(C(=O)/C=C/c1[nH]cc[nH+]1)C1CC1 ZINC000493363374 528397385 /nfs/dbraw/zinc/39/73/85/528397385.db2.gz CBSMNTDHFXMDBM-XUIVZRPNSA-N 1 2 247.342 2.458 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493074672 528883462 /nfs/dbraw/zinc/88/34/62/528883462.db2.gz VFYBGGXLYXFROB-VQCYPWCPSA-N 1 2 221.304 2.070 20 0 BEADLO CCN(C(=O)/C=C/c1[nH+]ccn1CC)C(C)C ZINC000492494869 528908031 /nfs/dbraw/zinc/90/80/31/528908031.db2.gz SYILJMNKPWUVIC-BQYQJAHWSA-N 1 2 235.331 2.173 20 0 BEADLO CC1(C)CCC[C@H]1CNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492994680 528987256 /nfs/dbraw/zinc/98/72/56/528987256.db2.gz KHCWMRVURVJSAG-GZTOBOFZSA-N 1 2 247.342 2.365 20 0 BEADLO CCC1(CC)CCN(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493720674 529044231 /nfs/dbraw/zinc/04/42/31/529044231.db2.gz IRERPTXJIKPMCC-AATRIKPKSA-N 1 2 247.342 2.462 20 0 BEADLO CC[C@@H]1CCCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492771021 529268273 /nfs/dbraw/zinc/26/82/73/529268273.db2.gz HCCZJVJMCHTXJS-ZHRWSRJISA-N 1 2 233.315 2.214 20 0 BEADLO CC[C@H](CC(=O)NCCc1[nH]cc[nH+]1)C(C)C ZINC000174759230 529304527 /nfs/dbraw/zinc/30/45/27/529304527.db2.gz UONBOQNNCBUIIR-LLVKDONJSA-N 1 2 237.347 2.141 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492774158 529335999 /nfs/dbraw/zinc/33/59/99/529335999.db2.gz WKPQUNGEZAIZJE-ZXIUILOBSA-N 1 2 233.315 2.212 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCOC(C)(C)C1 ZINC000335920762 535146279 /nfs/dbraw/zinc/14/62/79/535146279.db2.gz JUYGLJOHUQWBLC-UHFFFAOYSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCOC(C)(C)C1 ZINC000335920762 535146281 /nfs/dbraw/zinc/14/62/81/535146281.db2.gz JUYGLJOHUQWBLC-UHFFFAOYSA-N 1 2 237.347 2.075 20 0 BEADLO CC1=C(C)CN(c2nc[nH+]c(N)c2Cl)CC1 ZINC000281001543 535235903 /nfs/dbraw/zinc/23/59/03/535235903.db2.gz OCSQQAGSEKPHGK-UHFFFAOYSA-N 1 2 238.722 2.259 20 0 BEADLO CC1=C(C)CN(c2[nH+]cnc(N)c2Cl)CC1 ZINC000281001543 535235911 /nfs/dbraw/zinc/23/59/11/535235911.db2.gz OCSQQAGSEKPHGK-UHFFFAOYSA-N 1 2 238.722 2.259 20 0 BEADLO CC1(C)CC[N@H+](Cc2csnn2)CCS1 ZINC000335556033 535317331 /nfs/dbraw/zinc/31/73/31/535317331.db2.gz DLQPXEDXKHWTAO-UHFFFAOYSA-N 1 2 243.401 2.256 20 0 BEADLO CC1(C)CC[N@@H+](Cc2csnn2)CCS1 ZINC000335556033 535317337 /nfs/dbraw/zinc/31/73/37/535317337.db2.gz DLQPXEDXKHWTAO-UHFFFAOYSA-N 1 2 243.401 2.256 20 0 BEADLO CCn1nnc(C)c1C[NH+]1Cc2ccccc2C1 ZINC000335591375 535912006 /nfs/dbraw/zinc/91/20/06/535912006.db2.gz VLTVYZYKARQAPC-UHFFFAOYSA-N 1 2 242.326 2.122 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H]1CC[C@@H](C)C1 ZINC000336143580 536086060 /nfs/dbraw/zinc/08/60/60/536086060.db2.gz VPOBCHJFLQIPRN-PWSUYJOCSA-N 1 2 232.327 2.441 20 0 BEADLO CC[C@H]1C[N@@H+]([C@H](C)c2noc(C)n2)CCS1 ZINC000336122194 536159665 /nfs/dbraw/zinc/15/96/65/536159665.db2.gz VRRJMRGSSLTQFP-SCZZXKLOSA-N 1 2 241.360 2.266 20 0 BEADLO CC[C@H]1C[N@H+]([C@H](C)c2noc(C)n2)CCS1 ZINC000336122194 536159667 /nfs/dbraw/zinc/15/96/67/536159667.db2.gz VRRJMRGSSLTQFP-SCZZXKLOSA-N 1 2 241.360 2.266 20 0 BEADLO CCc1ccc(C[N@H+]2CCOCC2(C)C)cn1 ZINC000336002053 536178121 /nfs/dbraw/zinc/17/81/21/536178121.db2.gz SDZGSDSLZFXBSB-UHFFFAOYSA-N 1 2 234.343 2.255 20 0 BEADLO CCc1ccc(C[N@@H+]2CCOCC2(C)C)cn1 ZINC000336002053 536178119 /nfs/dbraw/zinc/17/81/19/536178119.db2.gz SDZGSDSLZFXBSB-UHFFFAOYSA-N 1 2 234.343 2.255 20 0 BEADLO C[N@@H+](CCCC1CCCC1)Cc1nnc[nH]1 ZINC000176170420 536329503 /nfs/dbraw/zinc/32/95/03/536329503.db2.gz QKPAMLUGLOIUBT-UHFFFAOYSA-N 1 2 222.336 2.207 20 0 BEADLO C[N@H+](CCCC1CCCC1)Cc1nnc[nH]1 ZINC000176170420 536329501 /nfs/dbraw/zinc/32/95/01/536329501.db2.gz QKPAMLUGLOIUBT-UHFFFAOYSA-N 1 2 222.336 2.207 20 0 BEADLO COC(=O)C(C)(C)[N@H+](C)Cc1ccc(F)cc1 ZINC000258868185 536427432 /nfs/dbraw/zinc/42/74/32/536427432.db2.gz UGGDLBFSTIQUME-UHFFFAOYSA-N 1 2 239.290 2.209 20 0 BEADLO COC(=O)C(C)(C)[N@@H+](C)Cc1ccc(F)cc1 ZINC000258868185 536427433 /nfs/dbraw/zinc/42/74/33/536427433.db2.gz UGGDLBFSTIQUME-UHFFFAOYSA-N 1 2 239.290 2.209 20 0 BEADLO COC1(C)CCN(c2cccc[nH+]2)CC1 ZINC000271613760 536566943 /nfs/dbraw/zinc/56/69/43/536566943.db2.gz CSJWCTGPLLWKSA-UHFFFAOYSA-N 1 2 206.289 2.087 20 0 BEADLO COC[C@@H](CNc1ccc2ccccc2[nH+]1)OC ZINC000227702823 536630426 /nfs/dbraw/zinc/63/04/26/536630426.db2.gz NRDPAWLTGBUTAX-GFCCVEGCSA-N 1 2 246.310 2.308 20 0 BEADLO COC(=O)[C@H](C1CC1)[N@H+](C)Cc1cccs1 ZINC000084093455 536644970 /nfs/dbraw/zinc/64/49/70/536644970.db2.gz HOOMZAZQJNQETI-NSHDSACASA-N 1 2 239.340 2.132 20 0 BEADLO COC(=O)[C@H](C1CC1)[N@@H+](C)Cc1cccs1 ZINC000084093455 536644974 /nfs/dbraw/zinc/64/49/74/536644974.db2.gz HOOMZAZQJNQETI-NSHDSACASA-N 1 2 239.340 2.132 20 0 BEADLO CO[C@H]1CCCN(c2nc(C)[nH+]c(C)c2C)C1 ZINC000301698463 536712787 /nfs/dbraw/zinc/71/27/87/536712787.db2.gz RDIZAOKWWJDQEL-LBPRGKRZSA-N 1 2 235.331 2.017 20 0 BEADLO CCc1cc(N[C@@H](CC)CCO)nc(CC)[nH+]1 ZINC000892651166 582939844 /nfs/dbraw/zinc/93/98/44/582939844.db2.gz VNDQSVYWMPQTQN-JTQLQIEISA-N 1 2 237.347 2.174 20 0 BEADLO CC[C@@H](C)C(=O)O[C@@H]1CCn2c(C)c[nH+]c21 ZINC000893519452 583156124 /nfs/dbraw/zinc/15/61/24/583156124.db2.gz QALUUQNSDOEYCW-PSASIEDQSA-N 1 2 222.288 2.226 20 0 BEADLO CS/C=C/C(=O)O[C@@H]1CCn2c(C)c[nH+]c21 ZINC000893524754 583157345 /nfs/dbraw/zinc/15/73/45/583157345.db2.gz LHGLDIPCJBPSFL-OTQAPUNGSA-N 1 2 238.312 2.056 20 0 BEADLO CC(C)=CC(=O)O[C@H]1CCn2c(C)c[nH+]c21 ZINC000893517919 583156228 /nfs/dbraw/zinc/15/62/28/583156228.db2.gz UWCYPOHGAIGQFV-JTQLQIEISA-N 1 2 220.272 2.146 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CCCC[C@@H]2C)c1C ZINC000893871066 583235946 /nfs/dbraw/zinc/23/59/46/583235946.db2.gz DKWTWNWMMQBZJE-VIFPVBQESA-N 1 2 207.321 2.401 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CCCC[C@@H]2C)c1C ZINC000893871066 583235948 /nfs/dbraw/zinc/23/59/48/583235948.db2.gz DKWTWNWMMQBZJE-VIFPVBQESA-N 1 2 207.321 2.401 20 0 BEADLO CC(C)Cn1cc[nH+]c1CNc1cc(F)ncn1 ZINC000853373937 588738766 /nfs/dbraw/zinc/73/87/66/588738766.db2.gz UFVAAMKXSANDPJ-UHFFFAOYSA-N 1 2 249.293 2.080 20 0 BEADLO CCCCC[N@H+](Cn1nc(C)oc1=O)C(C)C ZINC000853491104 588746092 /nfs/dbraw/zinc/74/60/92/588746092.db2.gz LNSRLZMPJXBGLI-UHFFFAOYSA-N 1 2 241.335 2.003 20 0 BEADLO CCCCC[N@@H+](Cn1nc(C)oc1=O)C(C)C ZINC000853491104 588746093 /nfs/dbraw/zinc/74/60/93/588746093.db2.gz LNSRLZMPJXBGLI-UHFFFAOYSA-N 1 2 241.335 2.003 20 0 BEADLO Fc1cnc(N2CCCC[C@H]2c2[nH]cc[nH+]2)cn1 ZINC000853411421 588741639 /nfs/dbraw/zinc/74/16/39/588741639.db2.gz LXHPKVUMBKIVLX-VIFPVBQESA-N 1 2 247.277 2.070 20 0 BEADLO O=C1CCCN1C[N@H+]1CC[C@@H]1c1ccc(F)cc1 ZINC000853544593 588748319 /nfs/dbraw/zinc/74/83/19/588748319.db2.gz WOWRNBDAACWBSJ-CYBMUJFWSA-N 1 2 248.301 2.152 20 0 BEADLO O=C1CCCN1C[N@@H+]1CC[C@@H]1c1ccc(F)cc1 ZINC000853544593 588748320 /nfs/dbraw/zinc/74/83/20/588748320.db2.gz WOWRNBDAACWBSJ-CYBMUJFWSA-N 1 2 248.301 2.152 20 0 BEADLO CC(C)c1nc(N2C[C@@H](C)[C@@H]2C)cc[nH+]1 ZINC000853650812 588752211 /nfs/dbraw/zinc/75/22/11/588752211.db2.gz WSRKHRVEPBDUAK-ZJUUUORDSA-N 1 2 205.305 2.445 20 0 BEADLO CC(C)c1nc(N2CC[C@H]2C(F)F)cc[nH+]1 ZINC000853650995 588752255 /nfs/dbraw/zinc/75/22/55/588752255.db2.gz ZDDKYSGVGVHJKK-QMMMGPOBSA-N 1 2 227.258 2.444 20 0 BEADLO CC(C)(C)OCC(N)=[NH+]OCCC1CCC1 ZINC000853688147 588756603 /nfs/dbraw/zinc/75/66/03/588756603.db2.gz HCUCNJXAOYDLCS-UHFFFAOYSA-N 1 2 228.336 2.490 20 0 BEADLO CC(C)c1nc(N2CC[C@H]3C[C@H]3C2)cc[nH+]1 ZINC000853903265 588767953 /nfs/dbraw/zinc/76/79/53/588767953.db2.gz ZLRVJHJLJNFQKW-QWRGUYRKSA-N 1 2 217.316 2.446 20 0 BEADLO C[C@@H](Nc1cncc(Cl)n1)c1[nH+]ccn1C ZINC000853967966 588770438 /nfs/dbraw/zinc/77/04/38/588770438.db2.gz ZJQFARDUDMOVAU-SSDOTTSWSA-N 1 2 237.694 2.037 20 0 BEADLO CC(C)OC[C@H]([NH3+])c1nc([C@H](C)C2CC2)no1 ZINC000854143119 588776959 /nfs/dbraw/zinc/77/69/59/588776959.db2.gz JIBYIUFCGVPFHG-SCZZXKLOSA-N 1 2 239.319 2.008 20 0 BEADLO CC(C)c1nc(NC[C@H](O)C(C)(C)C)cc[nH+]1 ZINC000112334671 588793994 /nfs/dbraw/zinc/79/39/94/588793994.db2.gz KHABRNIPXJFKJA-JTQLQIEISA-N 1 2 237.347 2.419 20 0 BEADLO CC(C)=CCC[C@H](C)NC(=O)Cc1[nH]cc[nH+]1 ZINC000854749171 588805251 /nfs/dbraw/zinc/80/52/51/588805251.db2.gz FMUFNYSUZBWCAT-NSHDSACASA-N 1 2 235.331 2.203 20 0 BEADLO CCC[C@@H](NC(=O)Cc1[nH]cc[nH+]1)C(C)(C)C ZINC000854779814 588809002 /nfs/dbraw/zinc/80/90/02/588809002.db2.gz HUWMZIODHXDQAY-SNVBAGLBSA-N 1 2 237.347 2.283 20 0 BEADLO CCC[C@H](NC(=O)Cc1[nH]cc[nH+]1)C1CCC1 ZINC000854917556 588816735 /nfs/dbraw/zinc/81/67/35/588816735.db2.gz FVPDBEVAKFXGCV-NSHDSACASA-N 1 2 235.331 2.037 20 0 BEADLO CCC(F)(F)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000854961095 588818886 /nfs/dbraw/zinc/81/88/86/588818886.db2.gz QIAMKPWLQSVHLT-UHFFFAOYSA-N 1 2 242.269 2.360 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)[C@H]2CCC2(C)C)S1 ZINC000854989187 588819790 /nfs/dbraw/zinc/81/97/90/588819790.db2.gz ABEQTQMWRGVRFV-JGVFFNPUSA-N 1 2 226.345 2.030 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)N[C@@H]1CCC[C@H](C2CC2)C1 ZINC000854993942 588820103 /nfs/dbraw/zinc/82/01/03/588820103.db2.gz RCVPDBZQMZWCAO-NWDGAFQWSA-N 1 2 247.342 2.037 20 0 BEADLO CCCCCCC(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000855134554 588822915 /nfs/dbraw/zinc/82/29/15/588822915.db2.gz SDHWEEHXLXXDDZ-UHFFFAOYSA-N 1 2 223.320 2.339 20 0 BEADLO CCCCCCC(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000855134554 588822916 /nfs/dbraw/zinc/82/29/16/588822916.db2.gz SDHWEEHXLXXDDZ-UHFFFAOYSA-N 1 2 223.320 2.339 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)C1(F)CCCCC1 ZINC000855136157 588823352 /nfs/dbraw/zinc/82/33/52/588823352.db2.gz MRCFYZZSHQQJRN-UHFFFAOYSA-N 1 2 239.294 2.041 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)C1(F)CCCCC1 ZINC000855136157 588823353 /nfs/dbraw/zinc/82/33/53/588823353.db2.gz MRCFYZZSHQQJRN-UHFFFAOYSA-N 1 2 239.294 2.041 20 0 BEADLO CC=C(C=CC(=O)N(C)Cc1c[nH+]c[nH]1)CC ZINC000855136138 588823479 /nfs/dbraw/zinc/82/34/79/588823479.db2.gz LXYYVRUBJCURDN-HNGDNPSASA-N 1 2 233.315 2.281 20 0 BEADLO CC=C(C=CC(=O)N(C)Cc1c[nH]c[nH+]1)CC ZINC000855136138 588823480 /nfs/dbraw/zinc/82/34/80/588823480.db2.gz LXYYVRUBJCURDN-HNGDNPSASA-N 1 2 233.315 2.281 20 0 BEADLO CCc1noc(Cc2cn3cc(F)ccc3[nH+]2)n1 ZINC000866849603 582460359 /nfs/dbraw/zinc/46/03/59/582460359.db2.gz UBKLUEHYXJHLSB-UHFFFAOYSA-N 1 2 246.245 2.010 20 0 BEADLO CCC1(C)C[NH+](Cc2cn(C3CCC3)nn2)C1 ZINC000668233734 582467220 /nfs/dbraw/zinc/46/72/20/582467220.db2.gz KIQJDYCTOHNOBZ-UHFFFAOYSA-N 1 2 234.347 2.235 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@H]1CC=CC[C@H]1C ZINC000890765568 582542663 /nfs/dbraw/zinc/54/26/63/582542663.db2.gz KQJNBLMRWYELBD-NTZNESFSSA-N 1 2 247.342 2.059 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@H]1CC=CC[C@H]1C ZINC000890765568 582542665 /nfs/dbraw/zinc/54/26/65/582542665.db2.gz KQJNBLMRWYELBD-NTZNESFSSA-N 1 2 247.342 2.059 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccc(F)cn2)[C@H](C)CO1 ZINC000844391618 582580680 /nfs/dbraw/zinc/58/06/80/582580680.db2.gz SCGSQCKPAUESCF-MFKMUULPSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccc(F)cn2)[C@H](C)CO1 ZINC000844391618 582580681 /nfs/dbraw/zinc/58/06/81/582580681.db2.gz SCGSQCKPAUESCF-MFKMUULPSA-N 1 2 238.306 2.220 20 0 BEADLO CCCC(C)(C)C(=O)OCCn1cc[nH+]c1 ZINC000845358334 582611970 /nfs/dbraw/zinc/61/19/70/582611970.db2.gz ZZRPVLZEHPBNKO-UHFFFAOYSA-N 1 2 224.304 2.253 20 0 BEADLO CCc1cc(N[C@@H](CO)CC(C)(C)C)nc[nH+]1 ZINC000393487128 582665161 /nfs/dbraw/zinc/66/51/61/582665161.db2.gz SXMFBIAMZHHQLX-LLVKDONJSA-N 1 2 237.347 2.248 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)C1(C2CC2)CC1 ZINC000891330291 582665754 /nfs/dbraw/zinc/66/57/54/582665754.db2.gz IRZVDIGCQVDUQB-SNVBAGLBSA-N 1 2 247.342 2.270 20 0 BEADLO COCCNc1cc2c(cccc2OC)c[nH+]1 ZINC000891391999 582676686 /nfs/dbraw/zinc/67/66/86/582676686.db2.gz ZBRDEOLZVMJFMX-UHFFFAOYSA-N 1 2 232.283 2.302 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccnn2C2CCC2)C[C@H](C)O1 ZINC000891400942 582677931 /nfs/dbraw/zinc/67/79/31/582677931.db2.gz DVIKPRNFUVCYAZ-TXEJJXNPSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccnn2C2CCC2)C[C@H](C)O1 ZINC000891400942 582677932 /nfs/dbraw/zinc/67/79/32/582677932.db2.gz DVIKPRNFUVCYAZ-TXEJJXNPSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@@H]1C[C@H](C)CN(c2nccn3c[nH+]cc23)C1 ZINC000891405032 582679212 /nfs/dbraw/zinc/67/92/12/582679212.db2.gz AKEYWZLPEPAGKB-PHIMTYICSA-N 1 2 230.315 2.212 20 0 BEADLO CC[C@H](CO)Nc1cc(C2CC2)[nH+]c(C2CC2)n1 ZINC000891412993 582680822 /nfs/dbraw/zinc/68/08/22/582680822.db2.gz HMPXATMDLCFEGD-LLVKDONJSA-N 1 2 247.342 2.414 20 0 BEADLO CCc1cc(NCCSC)nc(CC)[nH+]1 ZINC000891511310 582694635 /nfs/dbraw/zinc/69/46/35/582694635.db2.gz TYTZOQNUCRKLSS-UHFFFAOYSA-N 1 2 225.361 2.376 20 0 BEADLO CN(C)c1cc(N(C)Cc2ccsc2)nc[nH+]1 ZINC000891579005 582698957 /nfs/dbraw/zinc/69/89/57/582698957.db2.gz SNKMQPWQZPFJKU-UHFFFAOYSA-N 1 2 248.355 2.241 20 0 BEADLO CN(C)c1cc(N(C)Cc2ccsc2)[nH+]cn1 ZINC000891579005 582698958 /nfs/dbraw/zinc/69/89/58/582698958.db2.gz SNKMQPWQZPFJKU-UHFFFAOYSA-N 1 2 248.355 2.241 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H](C)OC[C@H]2C)cnc1F ZINC000891669877 582708215 /nfs/dbraw/zinc/70/82/15/582708215.db2.gz FYPHHZLHEWOOJW-MNOVXSKESA-N 1 2 238.306 2.138 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H](C)OC[C@H]2C)cnc1F ZINC000891669877 582708216 /nfs/dbraw/zinc/70/82/16/582708216.db2.gz FYPHHZLHEWOOJW-MNOVXSKESA-N 1 2 238.306 2.138 20 0 BEADLO C[C@H]1C[N@H+](Cc2cnn(C3CCC3)c2)[C@@H](C)CO1 ZINC000891672934 582708224 /nfs/dbraw/zinc/70/82/24/582708224.db2.gz ZIFZNLFCIKJHJQ-RYUDHWBXSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cnn(C3CCC3)c2)[C@@H](C)CO1 ZINC000891672934 582708226 /nfs/dbraw/zinc/70/82/26/582708226.db2.gz ZIFZNLFCIKJHJQ-RYUDHWBXSA-N 1 2 249.358 2.217 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H](C)OC[C@H]2C)cnc1F ZINC000891669874 582708327 /nfs/dbraw/zinc/70/83/27/582708327.db2.gz FYPHHZLHEWOOJW-GHMZBOCLSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H](C)OC[C@H]2C)cnc1F ZINC000891669874 582708328 /nfs/dbraw/zinc/70/83/28/582708328.db2.gz FYPHHZLHEWOOJW-GHMZBOCLSA-N 1 2 238.306 2.138 20 0 BEADLO CN(C)c1cc(NC(C2CC2)C2CC2)[nH+]cn1 ZINC000891672193 582708830 /nfs/dbraw/zinc/70/88/30/582708830.db2.gz WYNRCJMMTNQZPT-UHFFFAOYSA-N 1 2 232.331 2.143 20 0 BEADLO CN(C)c1cc(NC(C2CC2)C2CC2)nc[nH+]1 ZINC000891672193 582708834 /nfs/dbraw/zinc/70/88/34/582708834.db2.gz WYNRCJMMTNQZPT-UHFFFAOYSA-N 1 2 232.331 2.143 20 0 BEADLO c1c(N2CCC2)nc(C2CC2)[nH+]c1C1CC1 ZINC000891671834 582708918 /nfs/dbraw/zinc/70/89/18/582708918.db2.gz QPNRABQMTBGQTL-UHFFFAOYSA-N 1 2 215.300 2.442 20 0 BEADLO C[C@@H](O)c1cccc(NCCc2cccnc2)[nH+]1 ZINC000891683912 582710299 /nfs/dbraw/zinc/71/02/99/582710299.db2.gz BFZGIAFSXBFAJA-LLVKDONJSA-N 1 2 243.310 2.185 20 0 BEADLO CCc1cc(N2C[C@@H](C)OC[C@H]2C)nc(CC)[nH+]1 ZINC000891734854 582715479 /nfs/dbraw/zinc/71/54/79/582715479.db2.gz YLVJOUPBQMQVTH-GHMZBOCLSA-N 1 2 249.358 2.215 20 0 BEADLO CCc1cc(N(C)C2CC2)nc(CC)[nH+]1 ZINC000891770633 582718593 /nfs/dbraw/zinc/71/85/93/582718593.db2.gz RQJANCAUFGPCRG-UHFFFAOYSA-N 1 2 205.305 2.200 20 0 BEADLO Cn1nc2c(c1C[N@H+](C)Cc1ccoc1)CCC2 ZINC000891779132 582719605 /nfs/dbraw/zinc/71/96/05/582719605.db2.gz FHFMPYAHMBUKRK-UHFFFAOYSA-N 1 2 245.326 2.134 20 0 BEADLO Cn1nc2c(c1C[N@@H+](C)Cc1ccoc1)CCC2 ZINC000891779132 582719606 /nfs/dbraw/zinc/71/96/06/582719606.db2.gz FHFMPYAHMBUKRK-UHFFFAOYSA-N 1 2 245.326 2.134 20 0 BEADLO C[C@H](O)c1cccc(NC[C@H]2C[C@H]2C)[nH+]1 ZINC000891824412 582726751 /nfs/dbraw/zinc/72/67/51/582726751.db2.gz BVLVNPYBKBKYSN-KXUCPTDWSA-N 1 2 206.289 2.203 20 0 BEADLO Cc1cnnc(NCCCNc2cccc[nH+]2)c1 ZINC000891868725 582732091 /nfs/dbraw/zinc/73/20/91/582732091.db2.gz MHJSLDAQDVYYLR-UHFFFAOYSA-N 1 2 243.314 2.094 20 0 BEADLO CC(C)CCN(C)c1cc(N(C)C)[nH+]cn1 ZINC000891916146 582737853 /nfs/dbraw/zinc/73/78/53/582737853.db2.gz NQSTZJJWMZPQOS-UHFFFAOYSA-N 1 2 222.336 2.025 20 0 BEADLO CC(C)CCN(C)c1cc(N(C)C)nc[nH+]1 ZINC000891916146 582737855 /nfs/dbraw/zinc/73/78/55/582737855.db2.gz NQSTZJJWMZPQOS-UHFFFAOYSA-N 1 2 222.336 2.025 20 0 BEADLO CCC1(CC)CCCN(C(=O)Cc2[nH]cc[nH+]2)C1 ZINC000855821392 588849508 /nfs/dbraw/zinc/84/95/08/588849508.db2.gz DOCKTAKSIKFCSD-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO CCc1cc(NCc2c[nH]nc2C)nc(CC)[nH+]1 ZINC000892003068 582758939 /nfs/dbraw/zinc/75/89/39/582758939.db2.gz YGWZQVWAEOVMBB-UHFFFAOYSA-N 1 2 245.330 2.245 20 0 BEADLO CC(C)[C@@H]1CCCN1c1nccn2c[nH+]cc12 ZINC000892010208 582761069 /nfs/dbraw/zinc/76/10/69/582761069.db2.gz RIDMSQYIWGIZLR-NSHDSACASA-N 1 2 230.315 2.354 20 0 BEADLO CC(C)[C@H](C)N(C)c1cc(N(C)C)[nH+]cn1 ZINC000892007311 582761187 /nfs/dbraw/zinc/76/11/87/582761187.db2.gz GSUFECPIOVKCMA-JTQLQIEISA-N 1 2 222.336 2.023 20 0 BEADLO CC(C)[C@H](C)N(C)c1cc(N(C)C)nc[nH+]1 ZINC000892007311 582761188 /nfs/dbraw/zinc/76/11/88/582761188.db2.gz GSUFECPIOVKCMA-JTQLQIEISA-N 1 2 222.336 2.023 20 0 BEADLO C[C@@H](O)c1cccc(NCCOC(C)(C)C)[nH+]1 ZINC000892131732 582797525 /nfs/dbraw/zinc/79/75/25/582797525.db2.gz NFUGPNPCXHTLQX-SNVBAGLBSA-N 1 2 238.331 2.362 20 0 BEADLO Cc1cccn2c(NC(=O)C(C)(C)F)c[nH+]c12 ZINC000855902872 588853262 /nfs/dbraw/zinc/85/32/62/588853262.db2.gz NVYLXNARYYBKEM-UHFFFAOYSA-N 1 2 235.262 2.329 20 0 BEADLO CCCCC1(NC(=O)CCc2[nH]cc[nH+]2)CC1 ZINC000889528756 582821225 /nfs/dbraw/zinc/82/12/25/582821225.db2.gz YACBNRYLWOXLJN-UHFFFAOYSA-N 1 2 235.331 2.181 20 0 BEADLO Cc1cc(NC(=O)CCn2cccc2)cc[nH+]1 ZINC000073610001 582825892 /nfs/dbraw/zinc/82/58/92/582825892.db2.gz PZRFHAXKWADMBJ-UHFFFAOYSA-N 1 2 229.283 2.220 20 0 BEADLO C[C@@H]1CC[N@H+](Cn2ccc(C(F)(F)F)n2)C1 ZINC000725778270 582848331 /nfs/dbraw/zinc/84/83/31/582848331.db2.gz LKAVDSQOURGDKY-MRVPVSSYSA-N 1 2 233.237 2.201 20 0 BEADLO C[C@@H]1CC[N@@H+](Cn2ccc(C(F)(F)F)n2)C1 ZINC000725778270 582848332 /nfs/dbraw/zinc/84/83/32/582848332.db2.gz LKAVDSQOURGDKY-MRVPVSSYSA-N 1 2 233.237 2.201 20 0 BEADLO C[C@@H]1CC[N@H+](Cn2nc3ccccn3c2=S)C1 ZINC000725778277 582848863 /nfs/dbraw/zinc/84/88/63/582848863.db2.gz DFFNYNQJJKROJM-SNVBAGLBSA-N 1 2 248.355 2.165 20 0 BEADLO C[C@@H]1CC[N@@H+](Cn2nc3ccccn3c2=S)C1 ZINC000725778277 582848866 /nfs/dbraw/zinc/84/88/66/582848866.db2.gz DFFNYNQJJKROJM-SNVBAGLBSA-N 1 2 248.355 2.165 20 0 BEADLO Cc1noc(C)c1[C@@H](C)[NH2+][C@H](C)c1nccn1C ZINC000092326937 582855610 /nfs/dbraw/zinc/85/56/10/582855610.db2.gz VHPZNLYAJWNWCF-PSASIEDQSA-N 1 2 248.330 2.437 20 0 BEADLO CC[C@@H](C)CN(C)c1nccn2c[nH+]cc12 ZINC000892455040 582890666 /nfs/dbraw/zinc/89/06/66/582890666.db2.gz XPNWEKLAILCWFB-SNVBAGLBSA-N 1 2 218.304 2.212 20 0 BEADLO CNc1cc(N2CC[C@@H](c3ccco3)C2)nc[nH+]1 ZINC000892454637 582890789 /nfs/dbraw/zinc/89/07/89/582890789.db2.gz OWLQHXHYJVYWPR-SNVBAGLBSA-N 1 2 244.298 2.105 20 0 BEADLO CNc1cc(N2CC[C@@H](c3ccco3)C2)[nH+]cn1 ZINC000892454637 582890791 /nfs/dbraw/zinc/89/07/91/582890791.db2.gz OWLQHXHYJVYWPR-SNVBAGLBSA-N 1 2 244.298 2.105 20 0 BEADLO CCc1cc(NC[C@]2(C)CCOC2)nc(CC)[nH+]1 ZINC000892509675 582902069 /nfs/dbraw/zinc/90/20/69/582902069.db2.gz AMIQCJTYRWMOBS-AWEZNQCLSA-N 1 2 249.358 2.440 20 0 BEADLO C[C@H](O)CCNc1cc(C2CC2)[nH+]c(C2CC2)n1 ZINC000892540491 582908596 /nfs/dbraw/zinc/90/85/96/582908596.db2.gz LSJCLVCPNCPACH-VIFPVBQESA-N 1 2 247.342 2.414 20 0 BEADLO C[C@H](O)c1cccc(NCCc2cscn2)[nH+]1 ZINC000892597060 582924424 /nfs/dbraw/zinc/92/44/24/582924424.db2.gz NNLKLFXOQMLPCS-VIFPVBQESA-N 1 2 249.339 2.246 20 0 BEADLO CCc1cc(N2CC[C@H](COC)C2)nc(CC)[nH+]1 ZINC000892634233 582934795 /nfs/dbraw/zinc/93/47/95/582934795.db2.gz ZLRQGWJYKKTCBJ-NSHDSACASA-N 1 2 249.358 2.074 20 0 BEADLO Cc1cc(C[NH2+]Cc2cnc(F)c(C)c2)no1 ZINC000892675879 582949466 /nfs/dbraw/zinc/94/94/66/582949466.db2.gz GGADIAAORKWZSW-UHFFFAOYSA-N 1 2 235.262 2.115 20 0 BEADLO Cc1cc(N(C)CC[C@@H](C)O)nc(C2CCC2)[nH+]1 ZINC000892684405 582954225 /nfs/dbraw/zinc/95/42/25/582954225.db2.gz RNGQNYYEWHLTGM-LLVKDONJSA-N 1 2 249.358 2.260 20 0 BEADLO CC[N@H+](Cc1cnon1)Cc1ccccc1C ZINC000851719205 582963775 /nfs/dbraw/zinc/96/37/75/582963775.db2.gz HHTGSDHVYLQBBC-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1cnon1)Cc1ccccc1C ZINC000851719205 582963778 /nfs/dbraw/zinc/96/37/78/582963778.db2.gz HHTGSDHVYLQBBC-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CCc1cc(NCc2ccon2)nc(CC)[nH+]1 ZINC000892784783 582981654 /nfs/dbraw/zinc/98/16/54/582981654.db2.gz MDJRCWPALHYDLO-UHFFFAOYSA-N 1 2 232.287 2.202 20 0 BEADLO CCc1cc(N[C@](C)(CC)CO)nc(CC)[nH+]1 ZINC000892841702 582993937 /nfs/dbraw/zinc/99/39/37/582993937.db2.gz WQAGGSVGGWQQNB-CYBMUJFWSA-N 1 2 237.347 2.174 20 0 BEADLO CCc1cc(N[C@@](C)(CC)CO)nc(CC)[nH+]1 ZINC000892841703 582993940 /nfs/dbraw/zinc/99/39/40/582993940.db2.gz WQAGGSVGGWQQNB-ZDUSSCGKSA-N 1 2 237.347 2.174 20 0 BEADLO C[C@H](O)c1cccc(NC[C@H]2CCCS2)[nH+]1 ZINC000892885584 583003460 /nfs/dbraw/zinc/00/34/60/583003460.db2.gz ZUFXPHSWGRQQTC-VHSXEESVSA-N 1 2 238.356 2.442 20 0 BEADLO COc1cccc2c[nH+]c(N[C@H]3CCOC3)cc21 ZINC000892954215 583018613 /nfs/dbraw/zinc/01/86/13/583018613.db2.gz UYZBIAVEIITEJK-NSHDSACASA-N 1 2 244.294 2.444 20 0 BEADLO CCc1cc(N[C@@]2(C)CCOC2)nc(CC)[nH+]1 ZINC000892986116 583025756 /nfs/dbraw/zinc/02/57/56/583025756.db2.gz SYTFLWPHOCBQEQ-ZDUSSCGKSA-N 1 2 235.331 2.192 20 0 BEADLO CCc1cc(N[C@@H](C)c2cn[nH]c2)nc(CC)[nH+]1 ZINC000892995792 583026792 /nfs/dbraw/zinc/02/67/92/583026792.db2.gz SSHNHYVMOAPMGK-VIFPVBQESA-N 1 2 245.330 2.498 20 0 BEADLO CNc1cc(N[C@@H](C)c2ccc[nH]2)nc[nH+]1 ZINC000893021013 583030172 /nfs/dbraw/zinc/03/01/72/583030172.db2.gz BWLKEDLQBCWAST-QMMMGPOBSA-N 1 2 217.276 2.020 20 0 BEADLO CNc1cc(N[C@@H](C)c2ccc[nH]2)[nH+]cn1 ZINC000893021013 583030174 /nfs/dbraw/zinc/03/01/74/583030174.db2.gz BWLKEDLQBCWAST-QMMMGPOBSA-N 1 2 217.276 2.020 20 0 BEADLO C[C@H]1CCN(c2nccn3c[nH+]cc23)C[C@H]1C ZINC000893055416 583038197 /nfs/dbraw/zinc/03/81/97/583038197.db2.gz CHWBWVPWGMISTO-WDEREUQCSA-N 1 2 230.315 2.212 20 0 BEADLO CCc1cc(NCC2(CO)CCC2)nc(CC)[nH+]1 ZINC000893148931 583057742 /nfs/dbraw/zinc/05/77/42/583057742.db2.gz DJGSZMAEZRRIHP-UHFFFAOYSA-N 1 2 249.358 2.176 20 0 BEADLO COC(OC)[C@@H](C)Nc1cc[nH+]c(C(C)C)n1 ZINC000853681990 583061454 /nfs/dbraw/zinc/06/14/54/583061454.db2.gz YEEUQQTYZAXVPQ-SECBINFHSA-N 1 2 239.319 2.019 20 0 BEADLO C[C@@H](CC(F)(F)F)Nc1cc(N(C)C)nc[nH+]1 ZINC000893207166 583070973 /nfs/dbraw/zinc/07/09/73/583070973.db2.gz ZXHJEDOYGSGEFP-ZETCQYMHSA-N 1 2 248.252 2.295 20 0 BEADLO C[C@@H](CC(F)(F)F)Nc1cc(N(C)C)[nH+]cn1 ZINC000893207166 583070974 /nfs/dbraw/zinc/07/09/74/583070974.db2.gz ZXHJEDOYGSGEFP-ZETCQYMHSA-N 1 2 248.252 2.295 20 0 BEADLO CC(C)(C)c1ncc(C[NH2+]Cc2cocn2)cn1 ZINC000397928295 583113020 /nfs/dbraw/zinc/11/30/20/583113020.db2.gz OVJKCHDJGMEGGW-UHFFFAOYSA-N 1 2 246.314 2.052 20 0 BEADLO Cc1ccc(NCc2cn(C)nc2Cl)c[nH+]1 ZINC000856773556 588877215 /nfs/dbraw/zinc/87/72/15/588877215.db2.gz JWFPEKIERGTNGJ-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO Cc1nn(C)c(C)c1C[NH2+][C@H]1CCCC1(F)F ZINC000398162062 583121455 /nfs/dbraw/zinc/12/14/55/583121455.db2.gz CKRORLBOZHLNQT-NSHDSACASA-N 1 2 243.301 2.314 20 0 BEADLO C[C@H](O)c1cccc(NC[C@@H]2CCC=CO2)[nH+]1 ZINC000893367748 583127246 /nfs/dbraw/zinc/12/72/46/583127246.db2.gz LUEWWYNZJNYFKW-QWRGUYRKSA-N 1 2 234.299 2.240 20 0 BEADLO CO[C@H](C)CNc1cc(C)[nH+]c(C2CCC2)n1 ZINC000893397232 583136122 /nfs/dbraw/zinc/13/61/22/583136122.db2.gz PAGBJAKRYXJXKC-SNVBAGLBSA-N 1 2 235.331 2.499 20 0 BEADLO C[C@@H]1CCN(c2nccn3c[nH+]cc23)CCS1 ZINC000893480964 583151942 /nfs/dbraw/zinc/15/19/42/583151942.db2.gz SEJNFMVZDLDUDF-SNVBAGLBSA-N 1 2 248.355 2.061 20 0 BEADLO Cc1c[nH+]c2n1CC[C@H]2OC(=O)c1ccccc1 ZINC000893515366 583155611 /nfs/dbraw/zinc/15/56/11/583155611.db2.gz FZZBRHJAOGSXEV-GFCCVEGCSA-N 1 2 242.278 2.493 20 0 BEADLO Cc1c[nH+]c2n1CC[C@H]2OC(=O)C1CCCC1 ZINC000893514932 583155668 /nfs/dbraw/zinc/15/56/68/583155668.db2.gz CWZCZGBHITYDFK-LLVKDONJSA-N 1 2 234.299 2.370 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2ccccn2)o1 ZINC000893544145 583159869 /nfs/dbraw/zinc/15/98/69/583159869.db2.gz CQHABKGJXNTDLJ-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2ccccn2)o1 ZINC000893544145 583159872 /nfs/dbraw/zinc/15/98/72/583159872.db2.gz CQHABKGJXNTDLJ-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1ccc(CN2CCC[C@@H]2c2[nH]cc[nH+]2)o1 ZINC000893573049 583165613 /nfs/dbraw/zinc/16/56/13/583165613.db2.gz VSWSEIADXOQLPZ-LLVKDONJSA-N 1 2 247.298 2.348 20 0 BEADLO COc1ccc(CN2CCC[C@H]2c2[nH]cc[nH+]2)o1 ZINC000893573050 583165751 /nfs/dbraw/zinc/16/57/51/583165751.db2.gz VSWSEIADXOQLPZ-NSHDSACASA-N 1 2 247.298 2.348 20 0 BEADLO CCc1cc(N2CC(C)(F)C2)nc(CC)[nH+]1 ZINC000893589990 583168106 /nfs/dbraw/zinc/16/81/06/583168106.db2.gz LOXBIQHQRWOZJA-UHFFFAOYSA-N 1 2 223.295 2.150 20 0 BEADLO CCn1ccc(C[NH2+]Cc2cc(C)oc2C)n1 ZINC000840955340 583183071 /nfs/dbraw/zinc/18/30/71/583183071.db2.gz QJHFNHGFTFYKAB-UHFFFAOYSA-N 1 2 233.315 2.403 20 0 BEADLO COC(=O)c1occc1C[NH+]1CC(CC2CC2)C1 ZINC000857065990 588884937 /nfs/dbraw/zinc/88/49/37/588884937.db2.gz CIWFEOLJAOAFCV-UHFFFAOYSA-N 1 2 249.310 2.298 20 0 BEADLO CCO[C@H]1CCC[N@H+](Cc2n[nH]c(C)c2C)C1 ZINC000893864232 583234987 /nfs/dbraw/zinc/23/49/87/583234987.db2.gz UTCFIANEQDRBRA-LBPRGKRZSA-N 1 2 237.347 2.027 20 0 BEADLO CCO[C@H]1CCC[N@@H+](Cc2n[nH]c(C)c2C)C1 ZINC000893864232 583234991 /nfs/dbraw/zinc/23/49/91/583234991.db2.gz UTCFIANEQDRBRA-LBPRGKRZSA-N 1 2 237.347 2.027 20 0 BEADLO CN(C)c1cc(N2CCC[C@@H](C3CC3)C2)nc[nH+]1 ZINC000893882192 583240886 /nfs/dbraw/zinc/24/08/86/583240886.db2.gz GATKMBHRUMXOIG-GFCCVEGCSA-N 1 2 246.358 2.169 20 0 BEADLO CN(C)c1cc(N2CCC[C@@H](C3CC3)C2)[nH+]cn1 ZINC000893882192 583240887 /nfs/dbraw/zinc/24/08/87/583240887.db2.gz GATKMBHRUMXOIG-GFCCVEGCSA-N 1 2 246.358 2.169 20 0 BEADLO CC[C@]1(C)CN(Cc2[nH+]ccn2C2CC2)CCO1 ZINC000893907162 583243948 /nfs/dbraw/zinc/24/39/48/583243948.db2.gz HKHNFGDEWOZSLV-CQSZACIVSA-N 1 2 249.358 2.219 20 0 BEADLO COC1CC[NH+](Cc2nc(C(C)C)c[nH]2)CC1 ZINC000893914112 583245858 /nfs/dbraw/zinc/24/58/58/583245858.db2.gz CVKZGWYCZHXXJW-UHFFFAOYSA-N 1 2 237.347 2.144 20 0 BEADLO CC(C)c1nc(N2CC3(C2)CCOCC3)cc[nH+]1 ZINC000893938687 583253453 /nfs/dbraw/zinc/25/34/53/583253453.db2.gz RJLPRGZJOMOXBM-UHFFFAOYSA-N 1 2 247.342 2.217 20 0 BEADLO CN(C)c1cc(N2CCC(C3CC3)CC2)nc[nH+]1 ZINC000893948273 583258503 /nfs/dbraw/zinc/25/85/03/583258503.db2.gz CIOJTBXIQHOJAR-UHFFFAOYSA-N 1 2 246.358 2.169 20 0 BEADLO CN(C)c1cc(N2CCC(C3CC3)CC2)[nH+]cn1 ZINC000893948273 583258504 /nfs/dbraw/zinc/25/85/04/583258504.db2.gz CIOJTBXIQHOJAR-UHFFFAOYSA-N 1 2 246.358 2.169 20 0 BEADLO CCCSC[C@@H](C)[NH2+][C@H](C)C(=O)OCC ZINC000893951585 583259942 /nfs/dbraw/zinc/25/99/42/583259942.db2.gz XJRLKPZSIGZJJB-NXEZZACHSA-N 1 2 233.377 2.059 20 0 BEADLO CCC[N@H+](CC(=O)OCC)Cc1cc(C)co1 ZINC000893968950 583264149 /nfs/dbraw/zinc/26/41/49/583264149.db2.gz GFWXJRKCACBUMA-UHFFFAOYSA-N 1 2 239.315 2.363 20 0 BEADLO CCC[N@@H+](CC(=O)OCC)Cc1cc(C)co1 ZINC000893968950 583264151 /nfs/dbraw/zinc/26/41/51/583264151.db2.gz GFWXJRKCACBUMA-UHFFFAOYSA-N 1 2 239.315 2.363 20 0 BEADLO COC[C@H]1CCN1c1cc(C)[nH+]c(C2CCC2)n1 ZINC000893975792 583264978 /nfs/dbraw/zinc/26/49/78/583264978.db2.gz IZSFFFIQVYADEC-GFCCVEGCSA-N 1 2 247.342 2.278 20 0 BEADLO CCc1cc(N2C[C@@H](C)[C@H]2C)nc(CC)[nH+]1 ZINC000894001414 583271392 /nfs/dbraw/zinc/27/13/92/583271392.db2.gz WLEMAYSHPUGCKS-NXEZZACHSA-N 1 2 219.332 2.446 20 0 BEADLO Cc1ncoc1C[NH+]1Cc2ccccc2C1 ZINC000894005113 583272811 /nfs/dbraw/zinc/27/28/11/583272811.db2.gz AVFLRZBRDLLNFM-UHFFFAOYSA-N 1 2 214.268 2.499 20 0 BEADLO CCC[C@H](CNc1cccc([C@H](C)O)[nH+]1)OC ZINC000894017129 583273451 /nfs/dbraw/zinc/27/34/51/583273451.db2.gz XUDAGIHUSIZNEZ-WDEREUQCSA-N 1 2 238.331 2.362 20 0 BEADLO C[C@@]1(F)CCCN(c2nccn3c[nH+]cc23)C1 ZINC000894006256 583273562 /nfs/dbraw/zinc/27/35/62/583273562.db2.gz RTUUKIVROFSGGP-GFCCVEGCSA-N 1 2 234.278 2.058 20 0 BEADLO CCc1cc(N2CC3(CC3)C2)nc(CC)[nH+]1 ZINC000894015949 583276316 /nfs/dbraw/zinc/27/63/16/583276316.db2.gz FGXWUMPLEJMIKD-UHFFFAOYSA-N 1 2 217.316 2.202 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2[nH]nc(C)c2C)CCO1 ZINC000894034627 583278083 /nfs/dbraw/zinc/27/80/83/583278083.db2.gz AQWWCTQFQKLPSC-LBPRGKRZSA-N 1 2 237.347 2.027 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2[nH]nc(C)c2C)CCO1 ZINC000894034627 583278086 /nfs/dbraw/zinc/27/80/86/583278086.db2.gz AQWWCTQFQKLPSC-LBPRGKRZSA-N 1 2 237.347 2.027 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2[nH]nc(C)c2C)CCO1 ZINC000894034626 583278346 /nfs/dbraw/zinc/27/83/46/583278346.db2.gz AQWWCTQFQKLPSC-GFCCVEGCSA-N 1 2 237.347 2.027 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2[nH]nc(C)c2C)CCO1 ZINC000894034626 583278347 /nfs/dbraw/zinc/27/83/47/583278347.db2.gz AQWWCTQFQKLPSC-GFCCVEGCSA-N 1 2 237.347 2.027 20 0 BEADLO C[C@H](CCCCO)Nc1cccc([C@H](C)O)[nH+]1 ZINC000894037463 583282844 /nfs/dbraw/zinc/28/28/44/583282844.db2.gz NLUFRYFZIXVQHR-MNOVXSKESA-N 1 2 238.331 2.098 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CC[C@@H](C)[C@@H]2C)c1C ZINC000894084302 583295648 /nfs/dbraw/zinc/29/56/48/583295648.db2.gz KCSCZJYNXFUVEL-KCJUWKMLSA-N 1 2 207.321 2.257 20 0 BEADLO CCOc1ccc(CN(C)Cc2[nH]cc[nH+]2)o1 ZINC000894089641 583299109 /nfs/dbraw/zinc/29/91/09/583299109.db2.gz HCURTBMISIRYEL-UHFFFAOYSA-N 1 2 235.287 2.033 20 0 BEADLO CCc1nc(CNc2cccc([C@@H](C)O)[nH+]2)co1 ZINC000894098429 583302536 /nfs/dbraw/zinc/30/25/36/583302536.db2.gz RHYLMSYZEBYWRM-SECBINFHSA-N 1 2 247.298 2.297 20 0 BEADLO COCCOc1ccccc1NCc1c[nH+]c[nH]1 ZINC000894121498 583311453 /nfs/dbraw/zinc/31/14/53/583311453.db2.gz BZHFLWZQAWLKSJ-UHFFFAOYSA-N 1 2 247.298 2.047 20 0 BEADLO COCCOc1ccccc1NCc1c[nH]c[nH+]1 ZINC000894121498 583311457 /nfs/dbraw/zinc/31/14/57/583311457.db2.gz BZHFLWZQAWLKSJ-UHFFFAOYSA-N 1 2 247.298 2.047 20 0 BEADLO Cc1nn(C)c(C[NH+]2[C@@H](C)C[C@@H]2C)c1Cl ZINC000894138540 583315092 /nfs/dbraw/zinc/31/50/92/583315092.db2.gz FZLKFNPKICMXMA-YUMQZZPRSA-N 1 2 227.739 2.365 20 0 BEADLO Cc1nc(C[NH2+]Cc2ocnc2C)cs1 ZINC000894166366 583322476 /nfs/dbraw/zinc/32/24/76/583322476.db2.gz XTCICWAKFSRKEK-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO CN(C)c1cc(N[C@@H]2CCC[C@@H]3C[C@@H]32)[nH+]cn1 ZINC000894166581 583323936 /nfs/dbraw/zinc/32/39/36/583323936.db2.gz FEVAFFSUZQQKMP-OUAUKWLOSA-N 1 2 232.331 2.143 20 0 BEADLO CN(C)c1cc(N[C@@H]2CCC[C@@H]3C[C@@H]32)nc[nH+]1 ZINC000894166581 583323938 /nfs/dbraw/zinc/32/39/38/583323938.db2.gz FEVAFFSUZQQKMP-OUAUKWLOSA-N 1 2 232.331 2.143 20 0 BEADLO COCC[C@H](C)CNc1cccc([C@@H](C)O)[nH+]1 ZINC000894184762 583333060 /nfs/dbraw/zinc/33/30/60/583333060.db2.gz GADMCVBDHHZDBZ-WDEREUQCSA-N 1 2 238.331 2.219 20 0 BEADLO Cc1ccc(C[NH+]2CC(OC(C)(C)C)C2)cn1 ZINC000877769432 583346952 /nfs/dbraw/zinc/34/69/52/583346952.db2.gz BYHWXNXEHJJXQQ-UHFFFAOYSA-N 1 2 234.343 2.389 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1cnc(C)cn1 ZINC000726597537 583362221 /nfs/dbraw/zinc/36/22/21/583362221.db2.gz CAQUVWMRFOTJRN-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1cnc(C)cn1 ZINC000726597537 583362222 /nfs/dbraw/zinc/36/22/22/583362222.db2.gz CAQUVWMRFOTJRN-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO FC1(F)CC[N@H+](C[C@@H]2CCC3(CCC3)O2)C1 ZINC000878380403 583371662 /nfs/dbraw/zinc/37/16/62/583371662.db2.gz ZTASEJBQICRHGH-JTQLQIEISA-N 1 2 231.286 2.429 20 0 BEADLO FC1(F)CC[N@@H+](C[C@@H]2CCC3(CCC3)O2)C1 ZINC000878380403 583371663 /nfs/dbraw/zinc/37/16/63/583371663.db2.gz ZTASEJBQICRHGH-JTQLQIEISA-N 1 2 231.286 2.429 20 0 BEADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1cnc[nH]1)CCO2 ZINC000894231325 583384603 /nfs/dbraw/zinc/38/46/03/583384603.db2.gz QOMWCHUJEOXMQD-LBPRGKRZSA-N 1 2 247.273 2.162 20 0 BEADLO Cn1c[nH+]cc1COC(=O)/C=C/c1ccccc1 ZINC000747784952 583388835 /nfs/dbraw/zinc/38/88/35/583388835.db2.gz WVUTYDMVKGNIPA-BQYQJAHWSA-N 1 2 242.278 2.177 20 0 BEADLO Cc1cc(C)cc(C(=O)OCc2c[nH+]cn2C)c1 ZINC000747784932 583389057 /nfs/dbraw/zinc/38/90/57/583389057.db2.gz WJGVHGYMPFWEPR-UHFFFAOYSA-N 1 2 244.294 2.394 20 0 BEADLO Cn1c[nH+]cc1COC(=O)CCC(C)(C)C ZINC000747785086 583389220 /nfs/dbraw/zinc/38/92/20/583389220.db2.gz ZLSURONFNADAHS-UHFFFAOYSA-N 1 2 224.304 2.290 20 0 BEADLO Cc1ncoc1C[NH2+]Cc1cc(C(C)C)no1 ZINC000894257129 583395242 /nfs/dbraw/zinc/39/52/42/583395242.db2.gz ZKGSRVROVISQJU-UHFFFAOYSA-N 1 2 235.287 2.384 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCOCC23CC3)o1 ZINC000894280528 583408131 /nfs/dbraw/zinc/40/81/31/583408131.db2.gz WWLWKTIDWHOGIH-UHFFFAOYSA-N 1 2 237.299 2.043 20 0 BEADLO CCOc1ccc(C[N@H+]2CCOCC23CC3)o1 ZINC000894280528 583408133 /nfs/dbraw/zinc/40/81/33/583408133.db2.gz WWLWKTIDWHOGIH-UHFFFAOYSA-N 1 2 237.299 2.043 20 0 BEADLO Cc1c(NCc2c[nH+]c[nH]2)cnn1CC(C)C ZINC000894373816 583441134 /nfs/dbraw/zinc/44/11/34/583441134.db2.gz YNMNJVGCBAOZTP-UHFFFAOYSA-N 1 2 233.319 2.183 20 0 BEADLO Cc1c(NCc2c[nH]c[nH+]2)cnn1CC(C)C ZINC000894373816 583441137 /nfs/dbraw/zinc/44/11/37/583441137.db2.gz YNMNJVGCBAOZTP-UHFFFAOYSA-N 1 2 233.319 2.183 20 0 BEADLO CC[C@@H](O)CNc1ccc2ccc(OC)cc2[nH+]1 ZINC000894550265 583482806 /nfs/dbraw/zinc/48/28/06/583482806.db2.gz ISRUYGHJVXQRGG-LLVKDONJSA-N 1 2 246.310 2.426 20 0 BEADLO COc1cccc(C)c1CN(C)Cc1[nH]cc[nH+]1 ZINC000894586000 583488913 /nfs/dbraw/zinc/48/89/13/583488913.db2.gz KOOFNQDFRLFUIS-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO Cc1ncoc1C[N@@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000894595534 583492949 /nfs/dbraw/zinc/49/29/49/583492949.db2.gz HPPOUJCHSKRDAD-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1ncoc1C[N@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000894595534 583492952 /nfs/dbraw/zinc/49/29/52/583492952.db2.gz HPPOUJCHSKRDAD-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1n[nH]c(C[N@H+]2C[C@H](C)O[C@@H](C3CC3)C2)c1C ZINC000894598230 583493744 /nfs/dbraw/zinc/49/37/44/583493744.db2.gz XKXPTDFUHKBCBZ-LKFCYVNXSA-N 1 2 249.358 2.026 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2C[C@H](C)O[C@@H](C3CC3)C2)c1C ZINC000894598230 583493746 /nfs/dbraw/zinc/49/37/46/583493746.db2.gz XKXPTDFUHKBCBZ-LKFCYVNXSA-N 1 2 249.358 2.026 20 0 BEADLO CN(C[C@H]1CC1(C)C)c1nccn2c[nH+]cc12 ZINC000894651210 583499960 /nfs/dbraw/zinc/49/99/60/583499960.db2.gz OXAFDUBNARGUMP-SNVBAGLBSA-N 1 2 230.315 2.212 20 0 BEADLO CC(C)[N@H+](Cc1cnn(C2CCC2)c1)C1COC1 ZINC000894659078 583504555 /nfs/dbraw/zinc/50/45/55/583504555.db2.gz MXNNNOLSXCOWOK-UHFFFAOYSA-N 1 2 249.358 2.217 20 0 BEADLO CC(C)[N@@H+](Cc1cnn(C2CCC2)c1)C1COC1 ZINC000894659078 583504557 /nfs/dbraw/zinc/50/45/57/583504557.db2.gz MXNNNOLSXCOWOK-UHFFFAOYSA-N 1 2 249.358 2.217 20 0 BEADLO CCOc1ccc(C[N@@H+]2CC[C@H](F)C2)o1 ZINC000894673207 583504561 /nfs/dbraw/zinc/50/45/61/583504561.db2.gz YGECDTYHAHFZOX-VIFPVBQESA-N 1 2 213.252 2.222 20 0 BEADLO CCOc1ccc(C[N@H+]2CC[C@H](F)C2)o1 ZINC000894673207 583504562 /nfs/dbraw/zinc/50/45/62/583504562.db2.gz YGECDTYHAHFZOX-VIFPVBQESA-N 1 2 213.252 2.222 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CCC[C@H]2[C@@H]2CCCO2)c1C ZINC000894691024 583508413 /nfs/dbraw/zinc/50/84/13/583508413.db2.gz UPRCWIOPDFLXSD-KBPBESRZSA-N 1 2 249.358 2.170 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)c1C ZINC000894691024 583508415 /nfs/dbraw/zinc/50/84/15/583508415.db2.gz UPRCWIOPDFLXSD-KBPBESRZSA-N 1 2 249.358 2.170 20 0 BEADLO CCc1nnc(C[N@@H+]2CC[C@H]2C2CC2)s1 ZINC000894690932 583508624 /nfs/dbraw/zinc/50/86/24/583508624.db2.gz UKDINESOUFWNNF-VIFPVBQESA-N 1 2 223.345 2.085 20 0 BEADLO CCc1nnc(C[N@H+]2CC[C@H]2C2CC2)s1 ZINC000894690932 583508627 /nfs/dbraw/zinc/50/86/27/583508627.db2.gz UKDINESOUFWNNF-VIFPVBQESA-N 1 2 223.345 2.085 20 0 BEADLO CCc1cc(NCc2nc(C)c[nH]2)nc(CC)[nH+]1 ZINC000894791107 583520525 /nfs/dbraw/zinc/52/05/25/583520525.db2.gz SOAFXELEKDEFKN-UHFFFAOYSA-N 1 2 245.330 2.245 20 0 BEADLO CC(C)c1c[nH]c(C[NH+]2CC(C3CC3)C2)n1 ZINC000894813850 583524312 /nfs/dbraw/zinc/52/43/12/583524312.db2.gz SELMAORYBVPEDX-UHFFFAOYSA-N 1 2 219.332 2.375 20 0 BEADLO CCn1cc(C[NH+]2CC3(C2)CCCCC3)nn1 ZINC000894821735 583525525 /nfs/dbraw/zinc/52/55/25/583525525.db2.gz IXTVHQKDPXKXAF-UHFFFAOYSA-N 1 2 234.347 2.064 20 0 BEADLO CCc1nnc(C[NH+]2CC(C)(CC)C2)s1 ZINC000894839981 583529777 /nfs/dbraw/zinc/52/97/77/583529777.db2.gz MOKINMWSIQZGLW-UHFFFAOYSA-N 1 2 225.361 2.332 20 0 BEADLO CCC1(C)C[NH+](Cc2nccn2C2CC2)C1 ZINC000894840976 583529958 /nfs/dbraw/zinc/52/99/58/583529958.db2.gz TVYCOQWNILXSGJ-UHFFFAOYSA-N 1 2 219.332 2.450 20 0 BEADLO CO[C@H](C)CC(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000726945348 583533123 /nfs/dbraw/zinc/53/31/23/583533123.db2.gz OECHZJLSQUUUMB-SNVBAGLBSA-N 1 2 247.298 2.006 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+]2C[C@@H](C)[C@H]2C)n1 ZINC000894862224 583534950 /nfs/dbraw/zinc/53/49/50/583534950.db2.gz UXLSHZLISMRKBK-NXEZZACHSA-N 1 2 207.321 2.373 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+]2C[C@@H](C)[C@H]2C)n1 ZINC000894862224 583534952 /nfs/dbraw/zinc/53/49/52/583534952.db2.gz UXLSHZLISMRKBK-NXEZZACHSA-N 1 2 207.321 2.373 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc(C(F)(F)F)nn2C)[C@H]1C ZINC000894862269 583535565 /nfs/dbraw/zinc/53/55/65/583535565.db2.gz WPCJKTHTKIHSPA-SFYZADRCSA-N 1 2 247.264 2.279 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc(C(F)(F)F)nn2C)[C@H]1C ZINC000894862269 583535567 /nfs/dbraw/zinc/53/55/67/583535567.db2.gz WPCJKTHTKIHSPA-SFYZADRCSA-N 1 2 247.264 2.279 20 0 BEADLO CCn1ccnc1[C@@H](C)[NH2+][C@H](C)c1cnccn1 ZINC000894911954 583555108 /nfs/dbraw/zinc/55/51/08/583555108.db2.gz OXORMSPXLLOZGB-GHMZBOCLSA-N 1 2 245.330 2.105 20 0 BEADLO COC1C[NH+](C/C=C/c2cccc(F)c2)C1 ZINC000894969034 583560779 /nfs/dbraw/zinc/56/07/79/583560779.db2.gz CSFLYRUXOSTUHO-HWKANZROSA-N 1 2 221.275 2.170 20 0 BEADLO CC(C)c1c[nH]c(CN2CC(C(F)F)C2)[nH+]1 ZINC000894976640 583562223 /nfs/dbraw/zinc/56/22/23/583562223.db2.gz MVOKXGINZOGYCX-UHFFFAOYSA-N 1 2 229.274 2.230 20 0 BEADLO CC(C)c1c[nH]c(CN2CC3(CC(F)C3)C2)[nH+]1 ZINC000894977033 583563406 /nfs/dbraw/zinc/56/34/06/583563406.db2.gz RHQYAWLVLUTQGP-UHFFFAOYSA-N 1 2 237.322 2.467 20 0 BEADLO C[C@@H]([NH2+][C@@H]1C[C@H]1C1CCC1)C(=O)OC(C)(C)C ZINC000895008917 583569478 /nfs/dbraw/zinc/56/94/78/583569478.db2.gz IPZTXPLWOFMMKF-ADEWGFFLSA-N 1 2 239.359 2.495 20 0 BEADLO F[C@]1(c2ccccc2)C[C@H]1[NH2+]Cc1cnc[nH]1 ZINC000895053583 583574509 /nfs/dbraw/zinc/57/45/09/583574509.db2.gz OIFFKTWROVEUGO-OLZOCXBDSA-N 1 2 231.274 2.137 20 0 BEADLO C[C@H](O)c1cccc(NCCc2ccns2)[nH+]1 ZINC000895131730 583601074 /nfs/dbraw/zinc/60/10/74/583601074.db2.gz ZSYGFFYUEOOPNZ-VIFPVBQESA-N 1 2 249.339 2.246 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccc(OC)o2)[C@H](C)CO1 ZINC000895147110 583605009 /nfs/dbraw/zinc/60/50/09/583605009.db2.gz NNTUEZBFRAEXTA-GHMZBOCLSA-N 1 2 239.315 2.288 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccc(OC)o2)[C@H](C)CO1 ZINC000895147110 583605012 /nfs/dbraw/zinc/60/50/12/583605012.db2.gz NNTUEZBFRAEXTA-GHMZBOCLSA-N 1 2 239.315 2.288 20 0 BEADLO CCc1ncc(C[NH2+][C@H]2CCCc3cn[nH]c32)o1 ZINC000857869341 588916825 /nfs/dbraw/zinc/91/68/25/588916825.db2.gz NATFTJFQPKFZBM-NSHDSACASA-N 1 2 246.314 2.127 20 0 BEADLO CCc1ncc(C[NH2+][C@H]2CCCc3c[nH]nc32)o1 ZINC000857869341 588916827 /nfs/dbraw/zinc/91/68/27/588916827.db2.gz NATFTJFQPKFZBM-NSHDSACASA-N 1 2 246.314 2.127 20 0 BEADLO COc1c(C)cccc1C[NH2+]Cc1cnc[nH]1 ZINC000895188210 583619883 /nfs/dbraw/zinc/61/98/83/583619883.db2.gz PHICSLVJMNQCEF-UHFFFAOYSA-N 1 2 231.299 2.017 20 0 BEADLO COc1c(C)cccc1C[NH2+]Cc1c[nH]cn1 ZINC000895188210 583619885 /nfs/dbraw/zinc/61/98/85/583619885.db2.gz PHICSLVJMNQCEF-UHFFFAOYSA-N 1 2 231.299 2.017 20 0 BEADLO O=C(CCCn1cc[nH+]c1)NC1CCC=CCC1 ZINC000895211689 583626028 /nfs/dbraw/zinc/62/60/28/583626028.db2.gz KOSWYAKRIGOGSJ-UHFFFAOYSA-N 1 2 247.342 2.278 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2CCO[C@](C)(C3CC3)C2)c1C ZINC000895231248 583629142 /nfs/dbraw/zinc/62/91/42/583629142.db2.gz QCYVZGHNHJKUNO-AWEZNQCLSA-N 1 2 249.358 2.027 20 0 BEADLO Cc1n[nH]c(C[N@H+]2CCO[C@](C)(C3CC3)C2)c1C ZINC000895231248 583629143 /nfs/dbraw/zinc/62/91/43/583629143.db2.gz QCYVZGHNHJKUNO-AWEZNQCLSA-N 1 2 249.358 2.027 20 0 BEADLO CNc1cc(CNc2nc(C)cc(C)n2)cc[nH+]1 ZINC000895254636 583633587 /nfs/dbraw/zinc/63/35/87/583633587.db2.gz CXOYOGOXHMXNKW-UHFFFAOYSA-N 1 2 243.314 2.142 20 0 BEADLO Cc1ccncc1C[N@@H+]1Cc2ccncc2C1 ZINC000857878735 588919655 /nfs/dbraw/zinc/91/96/55/588919655.db2.gz LHOGGIZWEHUIJI-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO Cc1ccncc1C[N@H+]1Cc2ccncc2C1 ZINC000857878735 588919656 /nfs/dbraw/zinc/91/96/56/588919656.db2.gz LHOGGIZWEHUIJI-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO CC1(C)CC[C@@H](C[N@@H+]2Cc3ccncc3C2)O1 ZINC000857879799 588919681 /nfs/dbraw/zinc/91/96/81/588919681.db2.gz RBPPUSKVKNDRCC-ZDUSSCGKSA-N 1 2 232.327 2.355 20 0 BEADLO CC1(C)CC[C@@H](C[N@H+]2Cc3ccncc3C2)O1 ZINC000857879799 588919682 /nfs/dbraw/zinc/91/96/82/588919682.db2.gz RBPPUSKVKNDRCC-ZDUSSCGKSA-N 1 2 232.327 2.355 20 0 BEADLO c1csc(CC2C[NH+](Cc3c[nH]cn3)C2)c1 ZINC000895410058 583666710 /nfs/dbraw/zinc/66/67/10/583666710.db2.gz CLGVVNOOQLXZCP-UHFFFAOYSA-N 1 2 233.340 2.146 20 0 BEADLO c1csc(CC2C[NH+](Cc3cnc[nH]3)C2)c1 ZINC000895410058 583666711 /nfs/dbraw/zinc/66/67/11/583666711.db2.gz CLGVVNOOQLXZCP-UHFFFAOYSA-N 1 2 233.340 2.146 20 0 BEADLO CO[C@H](CC(C)C)C[N@@H+]1CC[C@@H]1C(F)F ZINC000895432049 583670746 /nfs/dbraw/zinc/67/07/46/583670746.db2.gz TZQIPIOCLRYNGG-NXEZZACHSA-N 1 2 221.291 2.387 20 0 BEADLO CO[C@H](CC(C)C)C[N@H+]1CC[C@@H]1C(F)F ZINC000895432049 583670749 /nfs/dbraw/zinc/67/07/49/583670749.db2.gz TZQIPIOCLRYNGG-NXEZZACHSA-N 1 2 221.291 2.387 20 0 BEADLO CCC[C@@H](C[N@@H+]1CC[C@@H]1C(F)F)OC ZINC000895431961 583670845 /nfs/dbraw/zinc/67/08/45/583670845.db2.gz RZEGVSRCAIUWET-DTWKUNHWSA-N 1 2 207.264 2.141 20 0 BEADLO CCC[C@@H](C[N@H+]1CC[C@@H]1C(F)F)OC ZINC000895431961 583670847 /nfs/dbraw/zinc/67/08/47/583670847.db2.gz RZEGVSRCAIUWET-DTWKUNHWSA-N 1 2 207.264 2.141 20 0 BEADLO FC(F)[C@H]1CC[N@@H+]1C[C@H]1CCSC1 ZINC000895432855 583671582 /nfs/dbraw/zinc/67/15/82/583671582.db2.gz QUFMLFSFXXXIBP-HTQZYQBOSA-N 1 2 207.289 2.079 20 0 BEADLO FC(F)[C@H]1CC[N@H+]1C[C@H]1CCSC1 ZINC000895432855 583671585 /nfs/dbraw/zinc/67/15/85/583671585.db2.gz QUFMLFSFXXXIBP-HTQZYQBOSA-N 1 2 207.289 2.079 20 0 BEADLO COC(=O)c1coc(C[NH2+]Cc2cc(C)co2)c1 ZINC000895448012 583675857 /nfs/dbraw/zinc/67/58/57/583675857.db2.gz VSPRJBUKICDYOU-UHFFFAOYSA-N 1 2 249.266 2.257 20 0 BEADLO CCc1nc(N[C@@H]2CCO[C@H]2C2CC2)cc[nH+]1 ZINC000895543318 583688815 /nfs/dbraw/zinc/68/88/15/583688815.db2.gz IXMMWYJOPVMIBQ-MFKMUULPSA-N 1 2 233.315 2.018 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CCC[C@H](CF)C2)c1C ZINC000895545664 583689027 /nfs/dbraw/zinc/68/90/27/583689027.db2.gz UYFHAGRTKBENKU-LLVKDONJSA-N 1 2 225.311 2.208 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CCC[C@H](CF)C2)c1C ZINC000895545664 583689028 /nfs/dbraw/zinc/68/90/28/583689028.db2.gz UYFHAGRTKBENKU-LLVKDONJSA-N 1 2 225.311 2.208 20 0 BEADLO CSC1CC(Nc2c[nH+]cc(N(C)C)c2)C1 ZINC000895698373 583710893 /nfs/dbraw/zinc/71/08/93/583710893.db2.gz BXBWKWZTXJXGDS-UHFFFAOYSA-N 1 2 237.372 2.454 20 0 BEADLO C[C@@H]1CCN(c2cc[nH+]c3ccncc32)CCO1 ZINC000895761351 583722041 /nfs/dbraw/zinc/72/20/41/583722041.db2.gz XPJSWSOMLIQPNX-LLVKDONJSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1ncoc1C[NH2+]Cc1cc(C2CC2)no1 ZINC000895764540 583722308 /nfs/dbraw/zinc/72/23/08/583722308.db2.gz RBFJBJREQOZRSL-UHFFFAOYSA-N 1 2 233.271 2.138 20 0 BEADLO c1cnc([C@@H](Nc2cccc[nH+]2)C2CC2)nc1 ZINC000895779326 583726567 /nfs/dbraw/zinc/72/65/67/583726567.db2.gz FPACZQRZQMANPW-LBPRGKRZSA-N 1 2 226.283 2.435 20 0 BEADLO CCC/C(C)=C/C(=O)N[C@H]1CCn2c[nH+]cc2C1 ZINC000857952388 588924997 /nfs/dbraw/zinc/92/49/97/588924997.db2.gz SFRKQPMRDTVMEA-VNKGSWCUSA-N 1 2 247.342 2.061 20 0 BEADLO CC[C@H](Cc1ccc(C)cc1)[NH2+][C@H]1CCOC1=O ZINC000895803740 583731539 /nfs/dbraw/zinc/73/15/39/583731539.db2.gz JUBAQPBBRUAREE-KGLIPLIRSA-N 1 2 247.338 2.221 20 0 BEADLO Cc1ccc(C2CC([NH2+][C@H]3CCOC3=O)C2)cc1 ZINC000895804881 583732003 /nfs/dbraw/zinc/73/20/03/583732003.db2.gz NDMVUKVQLHZZAH-RUXDESIVSA-N 1 2 245.322 2.146 20 0 BEADLO C[C@H]1COC[C@H]1Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000895904301 583742957 /nfs/dbraw/zinc/74/29/57/583742957.db2.gz BHWOVDYCEKXZEN-VHSXEESVSA-N 1 2 235.331 2.221 20 0 BEADLO O=C(/C=C\C1CCCC1)N[C@@H]1CCn2c[nH+]cc21 ZINC000857976533 588926044 /nfs/dbraw/zinc/92/60/44/588926044.db2.gz GTKHJEXAUDXZKF-FOQNGQEVSA-N 1 2 245.326 2.191 20 0 BEADLO CCCC(C)(C)C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857976176 588926264 /nfs/dbraw/zinc/92/62/64/588926264.db2.gz YYFHRBFWBLREEX-JTQLQIEISA-N 1 2 235.331 2.270 20 0 BEADLO Cc1csc(C(=O)N[C@@H]2CCn3c[nH+]cc32)c1 ZINC000857976247 588926272 /nfs/dbraw/zinc/92/62/72/588926272.db2.gz AJBODNGSFHRWBU-SECBINFHSA-N 1 2 247.323 2.128 20 0 BEADLO C[NH+](C)C1(c2nc(Cc3ccccc3)no2)CC1 ZINC000895943227 583750396 /nfs/dbraw/zinc/75/03/96/583750396.db2.gz WIDHNQCUJZRLHP-UHFFFAOYSA-N 1 2 243.310 2.211 20 0 BEADLO COc1ccc(C[NH+]2CC(OC(C)C)C2)cc1 ZINC000895952818 583751581 /nfs/dbraw/zinc/75/15/81/583751581.db2.gz PSFONVFNUJDBTI-UHFFFAOYSA-N 1 2 235.327 2.304 20 0 BEADLO COCc1cccc(C[NH+]2CC(OC(C)C)C2)c1 ZINC000895955945 583752605 /nfs/dbraw/zinc/75/26/05/583752605.db2.gz ZHPPDPPODRKLMY-UHFFFAOYSA-N 1 2 249.354 2.442 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@H](OC)C2)s1 ZINC000895968675 583755180 /nfs/dbraw/zinc/75/51/80/583755180.db2.gz QMKLPZFNBHXDNG-LBPRGKRZSA-N 1 2 241.356 2.115 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@H](OC)C2)s1 ZINC000895968675 583755181 /nfs/dbraw/zinc/75/51/81/583755181.db2.gz QMKLPZFNBHXDNG-LBPRGKRZSA-N 1 2 241.356 2.115 20 0 BEADLO COCC1C[NH+](Cc2c(F)cccc2F)C1 ZINC000895971223 583755899 /nfs/dbraw/zinc/75/58/99/583755899.db2.gz IUYSDVPESIPSRJ-UHFFFAOYSA-N 1 2 227.254 2.043 20 0 BEADLO COCC1C[NH+](Cc2ccc(F)cc2F)C1 ZINC000895971654 583756101 /nfs/dbraw/zinc/75/61/01/583756101.db2.gz NISZFKLAQHUTIO-UHFFFAOYSA-N 1 2 227.254 2.043 20 0 BEADLO C/C(=C\C(=O)N[C@H]1CCn2c[nH+]cc21)C(C)(C)C ZINC000857977759 588927007 /nfs/dbraw/zinc/92/70/07/588927007.db2.gz ZIIYDYAKAIKKJO-HUYFXPKMSA-N 1 2 247.342 2.437 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857978881 588927188 /nfs/dbraw/zinc/92/71/88/588927188.db2.gz RKLJAGGUYYTGPL-UTUOFQBUSA-N 1 2 247.342 2.270 20 0 BEADLO CC(C)C(C)(C)C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857980120 588927382 /nfs/dbraw/zinc/92/73/82/588927382.db2.gz ULGSKDWJKFTHRA-SNVBAGLBSA-N 1 2 235.331 2.126 20 0 BEADLO COCCOC[C@H](C)Nc1c[nH+]c(C)c(C)c1 ZINC000896020436 583763824 /nfs/dbraw/zinc/76/38/24/583763824.db2.gz ATXVKTWCSRQRRI-NSHDSACASA-N 1 2 238.331 2.162 20 0 BEADLO CC(C)C[C@H](C)C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857982590 588928052 /nfs/dbraw/zinc/92/80/52/588928052.db2.gz QMZYSIPIFVDYJA-WDEREUQCSA-N 1 2 235.331 2.126 20 0 BEADLO C[C@@H](C(=O)N[C@H]1CCn2c[nH+]cc21)C1CCCC1 ZINC000857982025 588928200 /nfs/dbraw/zinc/92/82/00/588928200.db2.gz DJESFHPQWTXCKV-PWSUYJOCSA-N 1 2 247.342 2.270 20 0 BEADLO O=C(C[C@H]1C=CCCC1)N[C@@H]1CCn2c[nH+]cc21 ZINC000857981122 588928235 /nfs/dbraw/zinc/92/82/35/588928235.db2.gz ACBZNPGYURUWSO-NWDGAFQWSA-N 1 2 245.326 2.191 20 0 BEADLO C[C@@H]1CC/C(=C\C(=O)N[C@@H]2CCn3c[nH+]cc32)C1 ZINC000857984031 588928721 /nfs/dbraw/zinc/92/87/21/588928721.db2.gz XBYIKKBRWFPMOV-CKRBCLJCSA-N 1 2 245.326 2.191 20 0 BEADLO CSCC1CCN(c2cc(C)[nH+]cn2)CC1 ZINC000896208728 583783413 /nfs/dbraw/zinc/78/34/13/583783413.db2.gz FIFFZAKMRYUBDC-UHFFFAOYSA-N 1 2 237.372 2.364 20 0 BEADLO Cc1nc(N[C@@H]2CCS[C@H](C)C2)cc[nH+]1 ZINC000896246640 583784989 /nfs/dbraw/zinc/78/49/89/583784989.db2.gz QJYPUUIBFHRICY-PSASIEDQSA-N 1 2 223.345 2.481 20 0 BEADLO C[C@@H]1CCC[C@@H](C(=O)N[C@H]2CCn3c[nH+]cc32)C1 ZINC000857985744 588929189 /nfs/dbraw/zinc/92/91/89/588929189.db2.gz IPMHAXVIHCRGSS-UTUOFQBUSA-N 1 2 247.342 2.270 20 0 BEADLO C[C@@H]1CCC[C@H](C(=O)N[C@H]2CCn3c[nH+]cc32)C1 ZINC000857985745 588929465 /nfs/dbraw/zinc/92/94/65/588929465.db2.gz IPMHAXVIHCRGSS-WOPDTQHZSA-N 1 2 247.342 2.270 20 0 BEADLO CC(C)=CC(=O)N1CCNc2[nH+]cc(C)cc21 ZINC000857995094 588929800 /nfs/dbraw/zinc/92/98/00/588929800.db2.gz ZYHVYVYUICHFQY-UHFFFAOYSA-N 1 2 231.299 2.115 20 0 BEADLO CCO[C@H]1CCN(c2cc[nH+]c(C(C)C)n2)C1 ZINC000896406244 583800662 /nfs/dbraw/zinc/80/06/62/583800662.db2.gz BDTUOQSDEQGKND-NSHDSACASA-N 1 2 235.331 2.215 20 0 BEADLO F[C@@H]1COc2ccccc2[C@H]1[NH2+]C1CSC1 ZINC000896421914 583801564 /nfs/dbraw/zinc/80/15/64/583801564.db2.gz DVPUMNGVRZBENH-ZYHUDNBSSA-N 1 2 239.315 2.163 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N[C@H]2CC=CCC2)c[nH+]1 ZINC000896460419 583803523 /nfs/dbraw/zinc/80/35/23/583803523.db2.gz VDZYAXCRSVGJOI-LBPRGKRZSA-N 1 2 247.342 2.152 20 0 BEADLO CCc1cnc(C[N@@H+]2CCO[C@H](C)CC2)s1 ZINC000896585188 583815104 /nfs/dbraw/zinc/81/51/04/583815104.db2.gz SPZNHAXZQWWMBU-SNVBAGLBSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1cnc(C[N@H+]2CCO[C@H](C)CC2)s1 ZINC000896585188 583815106 /nfs/dbraw/zinc/81/51/06/583815106.db2.gz SPZNHAXZQWWMBU-SNVBAGLBSA-N 1 2 240.372 2.316 20 0 BEADLO CCCCc1cc(N[C@H]2C[C@H](CO)C2)nc[nH+]1 ZINC000896694839 583824615 /nfs/dbraw/zinc/82/46/15/583824615.db2.gz ISAISJJOONYYHE-UMSPYCQHSA-N 1 2 235.331 2.002 20 0 BEADLO CC(C)(/C=C/Cl)[NH2+]Cc1csnn1 ZINC000896746305 583829614 /nfs/dbraw/zinc/82/96/14/583829614.db2.gz CBCNEANYMBAYTN-ONEGZZNKSA-N 1 2 217.725 2.159 20 0 BEADLO CC(C)(/C=C\Cl)[NH2+]Cc1ccon1 ZINC000896748502 583830047 /nfs/dbraw/zinc/83/00/47/583830047.db2.gz WHKDUKCQULWCMS-PLNGDYQASA-N 1 2 200.669 2.295 20 0 BEADLO Cn1ncc2c1nc[nH+]c2NCC(C)(C)C1CC1 ZINC000896786127 583833882 /nfs/dbraw/zinc/83/38/82/583833882.db2.gz TYAXWCKJYOUGLX-UHFFFAOYSA-N 1 2 245.330 2.211 20 0 BEADLO CCc1cc(NCC2(C3(O)CCC3)CC2)nc[nH+]1 ZINC000896807553 583835048 /nfs/dbraw/zinc/83/50/48/583835048.db2.gz ITLTZNSMAMTUSX-UHFFFAOYSA-N 1 2 247.342 2.146 20 0 BEADLO Cc1[nH+]cnc(NC[C@H]2CC[C@H](C3CC3)O2)c1C ZINC000896801291 583835171 /nfs/dbraw/zinc/83/51/71/583835171.db2.gz MGOUCBRTVZTZOR-CHWSQXEVSA-N 1 2 247.342 2.463 20 0 BEADLO Cc1cc(NCC[C@@H]2CCCC[C@@H]2O)nc[nH+]1 ZINC000896814734 583836023 /nfs/dbraw/zinc/83/60/23/583836023.db2.gz XEBHSGKZKMCAFF-RYUDHWBXSA-N 1 2 235.331 2.138 20 0 BEADLO CCC[C@H](CC)C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000896905736 583851317 /nfs/dbraw/zinc/85/13/17/583851317.db2.gz LQEVXGCYMPOPGU-NSHDSACASA-N 1 2 237.347 2.469 20 0 BEADLO CCCC(C)(C)C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000896908312 583851833 /nfs/dbraw/zinc/85/18/33/583851833.db2.gz ZEBWNDXWFXWEBD-UHFFFAOYSA-N 1 2 237.347 2.469 20 0 BEADLO Cc1[nH]c(CNC(=O)C2=CC[C@H](C)CC2)[nH+]c1C ZINC000896909126 583852325 /nfs/dbraw/zinc/85/23/25/583852325.db2.gz BCNNKIJTBQAUEV-VIFPVBQESA-N 1 2 247.342 2.389 20 0 BEADLO Cc1[nH]c(CNC(=O)/C=C2\CC[C@@H](C)C2)[nH+]c1C ZINC000896916367 583854936 /nfs/dbraw/zinc/85/49/36/583854936.db2.gz DEWCTYRHERZCCG-SZJBZFAYSA-N 1 2 247.342 2.389 20 0 BEADLO Cc1[nH]c(CNC(=O)C=C2CC[C@@H](C)C2)[nH+]c1C ZINC000896916367 583854937 /nfs/dbraw/zinc/85/49/37/583854937.db2.gz DEWCTYRHERZCCG-SZJBZFAYSA-N 1 2 247.342 2.389 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H]2CCC[C@@H](C)C2)[nH+]c1C ZINC000896918702 583855918 /nfs/dbraw/zinc/85/59/18/583855918.db2.gz FJSVYOFZJNHDHN-BXKDBHETSA-N 1 2 249.358 2.469 20 0 BEADLO Cc1[nH]c(CNC(=O)c2ccccc2C)[nH+]c1C ZINC000896929804 583860297 /nfs/dbraw/zinc/86/02/97/583860297.db2.gz NHMBKLKDENAPRG-UHFFFAOYSA-N 1 2 243.310 2.265 20 0 BEADLO Cc1[nH]c(CNC(=O)CC(C)(C)C)[nH+]c1C ZINC000896929807 583860717 /nfs/dbraw/zinc/86/07/17/583860717.db2.gz NKLCSBLTJNQSQN-UHFFFAOYSA-N 1 2 223.320 2.079 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CCC(F)(C2CC2)CC1 ZINC000896945771 583862823 /nfs/dbraw/zinc/86/28/23/583862823.db2.gz AHOZLTUFMKFLPB-UHFFFAOYSA-N 1 2 237.322 2.432 20 0 BEADLO Cc1cc(N[C@@H]2CCC[C@@H]2CO)nc(C2CC2)[nH+]1 ZINC000896961891 583864458 /nfs/dbraw/zinc/86/44/58/583864458.db2.gz LCHOMXGITXVJCE-VXGBXAGGSA-N 1 2 247.342 2.235 20 0 BEADLO COC(=O)[C@@H]1C[C@@H]2C[C@H](Nc3cccc[nH+]3)[C@@H]2C1 ZINC000897011913 583869707 /nfs/dbraw/zinc/86/97/07/583869707.db2.gz XSBKSWBCUCPDFI-KKOKHZNYSA-N 1 2 246.310 2.081 20 0 BEADLO C[C@@H]1CC2(CC(Nc3cc[nH+]cc3F)C2)CO1 ZINC000897046841 583872878 /nfs/dbraw/zinc/87/28/78/583872878.db2.gz WEBWZIVCKWXNBD-TTXORMCVSA-N 1 2 236.290 2.012 20 0 BEADLO CC(C)Cc1cc(N[C@H]2CC23CC(O)C3)nc[nH+]1 ZINC000897086291 583878610 /nfs/dbraw/zinc/87/86/10/583878610.db2.gz CTGZPORCCQAEDQ-LXVYMNJGSA-N 1 2 247.342 2.000 20 0 BEADLO C[C@@H](CCO)[NH2+]c1ccc2c(c1)C[C@H](C)O2 ZINC000897107182 583880835 /nfs/dbraw/zinc/88/08/35/583880835.db2.gz BPVNAWQSSAIPOB-UWVGGRQHSA-N 1 2 221.300 2.193 20 0 BEADLO CCc1nc(N[C@@H](CCO)C2CCCC2)cc[nH+]1 ZINC000897116711 583881673 /nfs/dbraw/zinc/88/16/73/583881673.db2.gz MPBMWLSQEKKMLY-LBPRGKRZSA-N 1 2 249.358 2.392 20 0 BEADLO CO[C@@H]1CC[C@H]1N(C)c1[nH]c2ccccc2[nH+]1 ZINC000897149209 583884749 /nfs/dbraw/zinc/88/47/49/583884749.db2.gz QHHDEMJPWKMWPE-VXGBXAGGSA-N 1 2 231.299 2.177 20 0 BEADLO Cc1cc(N[C@@H]2C[C@@H]3CCC[C@@H]23)nc[nH+]1 ZINC000897176234 583889220 /nfs/dbraw/zinc/88/92/20/583889220.db2.gz QHPQTIJIMRSNCU-HBNTYKKESA-N 1 2 203.289 2.386 20 0 BEADLO CNc1cc(N[C@@H]2C[C@H]3CCC[C@H]32)[nH+]cn1 ZINC000897177005 583890184 /nfs/dbraw/zinc/89/01/84/583890184.db2.gz ILXQVLLNNWHXBF-OPRDCNLKSA-N 1 2 218.304 2.119 20 0 BEADLO Nc1[nH+]cnc(N[C@@H]2C[C@@H]3CCC[C@H]23)c1Cl ZINC000897179710 583891001 /nfs/dbraw/zinc/89/10/01/583891001.db2.gz JUZNCGIBWWBFSS-BIIVOSGPSA-N 1 2 238.722 2.313 20 0 BEADLO Nc1nc[nH+]c(N[C@@H]2C[C@@H]3CCC[C@H]23)c1Cl ZINC000897179710 583891002 /nfs/dbraw/zinc/89/10/02/583891002.db2.gz JUZNCGIBWWBFSS-BIIVOSGPSA-N 1 2 238.722 2.313 20 0 BEADLO Cc1nc(N[C@@H]2C[C@@H]3CCC[C@H]23)cc[nH+]1 ZINC000897178343 583891234 /nfs/dbraw/zinc/89/12/34/583891234.db2.gz AWNAJTPVAQSGIE-GARJFASQSA-N 1 2 203.289 2.386 20 0 BEADLO CC(C)c1ccccc1C[NH2+]Cc1cnn[nH]1 ZINC000858198218 588938438 /nfs/dbraw/zinc/93/84/38/588938438.db2.gz RDOKNOIICUFZGN-UHFFFAOYSA-N 1 2 230.315 2.218 20 0 BEADLO CC(C)c1ccccc1C[NH2+]Cc1c[nH]nn1 ZINC000858198218 588938439 /nfs/dbraw/zinc/93/84/39/588938439.db2.gz RDOKNOIICUFZGN-UHFFFAOYSA-N 1 2 230.315 2.218 20 0 BEADLO CC(C)c1ccccc1C[NH2+]Cc1cn[nH]n1 ZINC000858198218 588938440 /nfs/dbraw/zinc/93/84/40/588938440.db2.gz RDOKNOIICUFZGN-UHFFFAOYSA-N 1 2 230.315 2.218 20 0 BEADLO CC[N@H+](Cc1nc(CCCCF)no1)C1CC1 ZINC000897207861 583894920 /nfs/dbraw/zinc/89/49/20/583894920.db2.gz WBHFIMMCWODABD-UHFFFAOYSA-N 1 2 241.310 2.346 20 0 BEADLO CC[N@@H+](Cc1nc(CCCCF)no1)C1CC1 ZINC000897207861 583894923 /nfs/dbraw/zinc/89/49/23/583894923.db2.gz WBHFIMMCWODABD-UHFFFAOYSA-N 1 2 241.310 2.346 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N[C@@H](C)C2CCC2)c[nH+]1 ZINC000897217961 583897131 /nfs/dbraw/zinc/89/71/31/583897131.db2.gz JINFWIVPIFTZRC-NSHDSACASA-N 1 2 249.358 2.231 20 0 BEADLO C[C@H](Nc1cnn(CC2CC2)c1)c1[nH]cc[nH+]1 ZINC000796894906 583897559 /nfs/dbraw/zinc/89/75/59/583897559.db2.gz ZFBGXBYCAYDBQN-VIFPVBQESA-N 1 2 231.303 2.189 20 0 BEADLO O=C(OCCn1cc[nH+]c1)[C@@]12C[C@@H]1CCCC2 ZINC000869704150 583899579 /nfs/dbraw/zinc/89/95/79/583899579.db2.gz NZVACQYUDWMTPX-AAEUAGOBSA-N 1 2 234.299 2.007 20 0 BEADLO OCc1cc[nH+]c(N[C@H]2CCOC23CCCC3)c1 ZINC000897322301 583922101 /nfs/dbraw/zinc/92/21/01/583922101.db2.gz BQHSHIYHJKLGSA-LBPRGKRZSA-N 1 2 248.326 2.088 20 0 BEADLO CCn1c[nH+]c2c1CCN(Cc1cc(C)co1)C2 ZINC000897333685 583924075 /nfs/dbraw/zinc/92/40/75/583924075.db2.gz KOGNPOUPXLBIEC-UHFFFAOYSA-N 1 2 245.326 2.363 20 0 BEADLO CCn1c[nH+]c2c1CCN(Cc1ccco1)C2 ZINC000897336674 583924691 /nfs/dbraw/zinc/92/46/91/583924691.db2.gz KWJFQILJAIQCKJ-UHFFFAOYSA-N 1 2 231.299 2.054 20 0 BEADLO Cc1cc(N2CC(Cc3ccoc3)C2)nc[nH+]1 ZINC000897349674 583928937 /nfs/dbraw/zinc/92/89/37/583928937.db2.gz XZJWWPULEFSBIR-UHFFFAOYSA-N 1 2 229.283 2.057 20 0 BEADLO C[C@@H]1CC=CC[C@H]1Nc1cc[nH+]cc1F ZINC000897392729 583948674 /nfs/dbraw/zinc/94/86/74/583948674.db2.gz LWNDPWOUIQETIW-MWLCHTKSSA-N 1 2 206.264 2.409 20 0 BEADLO CCC/C=C\C(=O)Nc1c[nH+]ccc1OC ZINC000729352498 583993670 /nfs/dbraw/zinc/99/36/70/583993670.db2.gz RKXUJOVCWUIFEE-WAYWQWQTSA-N 1 2 220.272 2.385 20 0 BEADLO CCC/C=C/C(=O)Nc1c[nH+]ccc1OC ZINC000729352497 583993991 /nfs/dbraw/zinc/99/39/91/583993991.db2.gz RKXUJOVCWUIFEE-AATRIKPKSA-N 1 2 220.272 2.385 20 0 BEADLO CC(C)c1c[nH+]cc(N[C@H]2CCCNC(=O)C2)c1 ZINC000897707408 584041855 /nfs/dbraw/zinc/04/18/55/584041855.db2.gz NFMPBGUZCOEXKP-LBPRGKRZSA-N 1 2 247.342 2.286 20 0 BEADLO CC(C)c1c[nH+]cc(N[C@@H]2CCNC(=O)CC2)c1 ZINC000897707650 584042329 /nfs/dbraw/zinc/04/23/29/584042329.db2.gz WNCGIGRFWCSLMC-LBPRGKRZSA-N 1 2 247.342 2.286 20 0 BEADLO Cn1cnc(C[NH2+]Cc2cnc(C3CC3)s2)c1 ZINC000898045636 584073459 /nfs/dbraw/zinc/07/34/59/584073459.db2.gz QIVTZSNQAZTZEN-UHFFFAOYSA-N 1 2 248.355 2.044 20 0 BEADLO O[C@H]1CC[N@H+](Cc2cc3ccccc3[nH]2)C[C@H]1F ZINC000898186101 584093069 /nfs/dbraw/zinc/09/30/69/584093069.db2.gz AYQUUXBXUDFJBE-OCCSQVGLSA-N 1 2 248.301 2.073 20 0 BEADLO O[C@H]1CC[N@@H+](Cc2cc3ccccc3[nH]2)C[C@H]1F ZINC000898186101 584093071 /nfs/dbraw/zinc/09/30/71/584093071.db2.gz AYQUUXBXUDFJBE-OCCSQVGLSA-N 1 2 248.301 2.073 20 0 BEADLO O[C@@H]1CC[N@H+](Cc2cc3ccccc3[nH]2)C[C@H]1F ZINC000898186103 584093306 /nfs/dbraw/zinc/09/33/06/584093306.db2.gz AYQUUXBXUDFJBE-TZMCWYRMSA-N 1 2 248.301 2.073 20 0 BEADLO O[C@@H]1CC[N@@H+](Cc2cc3ccccc3[nH]2)C[C@H]1F ZINC000898186103 584093308 /nfs/dbraw/zinc/09/33/08/584093308.db2.gz AYQUUXBXUDFJBE-TZMCWYRMSA-N 1 2 248.301 2.073 20 0 BEADLO Cc1ccc(C[N@@H+]2CC[C@H](O)[C@H](F)C2)c(F)c1 ZINC000898184539 584093444 /nfs/dbraw/zinc/09/34/44/584093444.db2.gz UQPSFQJETWIFIH-OLZOCXBDSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1ccc(C[N@H+]2CC[C@H](O)[C@H](F)C2)c(F)c1 ZINC000898184539 584093445 /nfs/dbraw/zinc/09/34/45/584093445.db2.gz UQPSFQJETWIFIH-OLZOCXBDSA-N 1 2 241.281 2.039 20 0 BEADLO CCC(F)(F)CN[C@H](C)c1[nH]cc[nH+]1 ZINC000858507070 588961366 /nfs/dbraw/zinc/96/13/66/588961366.db2.gz KYXXUVGWFVEFJY-SSDOTTSWSA-N 1 2 203.236 2.106 20 0 BEADLO CC(C)c1cncc(NC(=O)Cn2cc[nH+]c2)c1 ZINC000888238625 584121796 /nfs/dbraw/zinc/12/17/96/584121796.db2.gz XCHODYHRIVPFGA-UHFFFAOYSA-N 1 2 244.298 2.040 20 0 BEADLO CC(C)=C(C)CC(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000898812229 584160249 /nfs/dbraw/zinc/16/02/49/584160249.db2.gz ZMBFXFVCSATFPY-NSHDSACASA-N 1 2 233.315 2.191 20 0 BEADLO CC(C)(CNC(=O)CC1CCCC1)n1cc[nH+]c1 ZINC000898893433 584165007 /nfs/dbraw/zinc/16/50/07/584165007.db2.gz KDWQZJUSIQWPJM-UHFFFAOYSA-N 1 2 249.358 2.315 20 0 BEADLO C[C@@H]1CCN1C(=O)c1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000899199861 584180778 /nfs/dbraw/zinc/18/07/78/584180778.db2.gz JWHWYUHQFBHHKU-SNVBAGLBSA-N 1 2 241.294 2.311 20 0 BEADLO C[C@@H](c1ccccc1)[S@](=O)Cc1[nH+]ccn1C ZINC000899296816 584194689 /nfs/dbraw/zinc/19/46/89/584194689.db2.gz DTOLEPLOHAEJNJ-APPDUMDISA-N 1 2 248.351 2.430 20 0 BEADLO Cc1cc(CNc2nccnc2F)cc(C)[nH+]1 ZINC000858572789 588967778 /nfs/dbraw/zinc/96/77/78/588967778.db2.gz VDKIRMLAEHFBIC-UHFFFAOYSA-N 1 2 232.262 2.240 20 0 BEADLO Cc1cccc([C@@H](O)C[NH+]2CC(OC(C)C)C2)c1 ZINC000899901588 584249924 /nfs/dbraw/zinc/24/99/24/584249924.db2.gz PQBJYZSXSZLRRS-HNNXBMFYSA-N 1 2 249.354 2.138 20 0 BEADLO C[C@@H]1CCCC[C@@H]1NC(=O)CNc1cccc[nH+]1 ZINC000899937329 584258603 /nfs/dbraw/zinc/25/86/03/584258603.db2.gz OVHQEDMSSSTGQZ-NEPJUHHUSA-N 1 2 247.342 2.188 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N(C)C2CCCC2)c[nH+]1 ZINC000900072153 584268966 /nfs/dbraw/zinc/26/89/66/584268966.db2.gz VXNDGAZAUZZNAP-UHFFFAOYSA-N 1 2 249.358 2.328 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N(C)[C@H](C)C2CC2)c[nH+]1 ZINC000900074200 584269334 /nfs/dbraw/zinc/26/93/34/584269334.db2.gz VAOVXYGYNMYAOA-LLVKDONJSA-N 1 2 249.358 2.184 20 0 BEADLO C[C@H](N(C)C(=O)CNc1cccc[nH+]1)C(C)(C)C ZINC000900119996 584274928 /nfs/dbraw/zinc/27/49/28/584274928.db2.gz UKLOWRSTGQLXHA-NSHDSACASA-N 1 2 249.358 2.387 20 0 BEADLO CCCC[C@H](CC)CNC(=O)Cc1c[nH]c[nH+]1 ZINC000900111394 584276386 /nfs/dbraw/zinc/27/63/86/584276386.db2.gz UMGVFFPCGCNTSH-NSHDSACASA-N 1 2 237.347 2.285 20 0 BEADLO CCCC[C@H](CC)CNC(=O)Cc1c[nH+]c[nH]1 ZINC000900111394 584276387 /nfs/dbraw/zinc/27/63/87/584276387.db2.gz UMGVFFPCGCNTSH-NSHDSACASA-N 1 2 237.347 2.285 20 0 BEADLO CC(C)N(CC1CC1)C(=O)CNc1cccc[nH+]1 ZINC000900181934 584282965 /nfs/dbraw/zinc/28/29/65/584282965.db2.gz QYHUZZDHGTYYDF-UHFFFAOYSA-N 1 2 247.342 2.141 20 0 BEADLO C[C@H](c1cccs1)N(C)C(=O)Cc1c[nH+]c[nH]1 ZINC000900244980 584288636 /nfs/dbraw/zinc/28/86/36/584288636.db2.gz FHYIOBAZWJFKBF-SECBINFHSA-N 1 2 249.339 2.233 20 0 BEADLO CCC[C@H](CC)NC(=O)CNc1cccc[nH+]1 ZINC000900419835 584307004 /nfs/dbraw/zinc/30/70/04/584307004.db2.gz ZOZMOIUBDHAGOO-NSHDSACASA-N 1 2 235.331 2.188 20 0 BEADLO CCCC(C)(C)NC(=O)CNc1cccc[nH+]1 ZINC000900445271 584315601 /nfs/dbraw/zinc/31/56/01/584315601.db2.gz FCOZCKOKYFCNQP-UHFFFAOYSA-N 1 2 235.331 2.188 20 0 BEADLO CCC[C@@H]1CCCC[C@@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000900555893 584322871 /nfs/dbraw/zinc/32/28/71/584322871.db2.gz GYHOBPQIFRKPSX-YPMHNXCESA-N 1 2 249.358 2.427 20 0 BEADLO CCC[C@@H]1CCCC[C@@H]1NC(=O)Cc1c[nH+]c[nH]1 ZINC000900555893 584322873 /nfs/dbraw/zinc/32/28/73/584322873.db2.gz GYHOBPQIFRKPSX-YPMHNXCESA-N 1 2 249.358 2.427 20 0 BEADLO CCN(C(=O)Cc1c[nH+]c[nH]1)[C@H]1CCCC[C@@H]1C ZINC000900531009 584323085 /nfs/dbraw/zinc/32/30/85/584323085.db2.gz VFYCQCDTNMBACC-AAEUAGOBSA-N 1 2 249.358 2.379 20 0 BEADLO CC(C)N(C(=O)Cc1c[nH+]c[nH]1)C1CCCC1 ZINC000900566273 584326200 /nfs/dbraw/zinc/32/62/00/584326200.db2.gz SREYCRYCESLHEN-UHFFFAOYSA-N 1 2 235.331 2.132 20 0 BEADLO CC(C)[C@H]1CCCC[C@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000900566996 584326342 /nfs/dbraw/zinc/32/63/42/584326342.db2.gz TXVKEJCSBMYRFP-CHWSQXEVSA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)[C@H]1CCCC[C@H]1NC(=O)Cc1c[nH+]c[nH]1 ZINC000900566996 584326345 /nfs/dbraw/zinc/32/63/45/584326345.db2.gz TXVKEJCSBMYRFP-CHWSQXEVSA-N 1 2 249.358 2.283 20 0 BEADLO C/C=C\c1cn(Cc2cc(C)cc(C)[nH+]2)nn1 ZINC000900622289 584332828 /nfs/dbraw/zinc/33/28/28/584332828.db2.gz PBOJNKJPTZHGDY-PLNGDYQASA-N 1 2 228.299 2.371 20 0 BEADLO C/C(=C(/F)C(=O)N(C)Cc1[nH]cc[nH+]1)C1CC1 ZINC000900623705 584333150 /nfs/dbraw/zinc/33/31/50/584333150.db2.gz COCNDMLALQJEHF-FLIBITNWSA-N 1 2 237.278 2.022 20 0 BEADLO C[C@@H](NC(=O)CNc1cccc[nH+]1)C1CCCC1 ZINC000900711429 584344018 /nfs/dbraw/zinc/34/40/18/584344018.db2.gz AZELJOPKUSNJJA-LLVKDONJSA-N 1 2 247.342 2.188 20 0 BEADLO C[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)Cc1c[nH+]c[nH]1 ZINC000900737192 584347549 /nfs/dbraw/zinc/34/75/49/584347549.db2.gz RUTFHTAIFMPNRC-NTZNESFSSA-N 1 2 247.342 2.132 20 0 BEADLO CC[C@@H]1CCCCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC000900791604 584352155 /nfs/dbraw/zinc/35/21/55/584352155.db2.gz GVZNSZUWMHAQQP-GFCCVEGCSA-N 1 2 235.331 2.133 20 0 BEADLO CC[C@@H]1CCC[C@H](NC(=O)Cc2c[nH]c[nH+]2)C1 ZINC000900806915 584353470 /nfs/dbraw/zinc/35/34/70/584353470.db2.gz OGYJYAPCUJXFIM-MNOVXSKESA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@@H]1CCC[C@H](NC(=O)Cc2c[nH+]c[nH]2)C1 ZINC000900806915 584353472 /nfs/dbraw/zinc/35/34/72/584353472.db2.gz OGYJYAPCUJXFIM-MNOVXSKESA-N 1 2 235.331 2.037 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)N[C@@H]1CC[C@@H]2CCC[C@@H]2C1 ZINC000900851145 584357161 /nfs/dbraw/zinc/35/71/61/584357161.db2.gz AGLSPGWPQQUHEP-QJPTWQEYSA-N 1 2 247.342 2.037 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)N[C@@H]1CC[C@@H]2CCC[C@@H]2C1 ZINC000900851145 584357162 /nfs/dbraw/zinc/35/71/62/584357162.db2.gz AGLSPGWPQQUHEP-QJPTWQEYSA-N 1 2 247.342 2.037 20 0 BEADLO CC[C@@H](C)C[C@H](C)NC(=O)CNc1cccc[nH+]1 ZINC000900861686 584358449 /nfs/dbraw/zinc/35/84/49/584358449.db2.gz DJMXDFUBSXWIKI-NEPJUHHUSA-N 1 2 249.358 2.434 20 0 BEADLO C[C@H]1CC(C)(C)CC[C@@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000900953711 584366532 /nfs/dbraw/zinc/36/65/32/584366532.db2.gz FOGGHJCQVVIHGU-JQWIXIFHSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H]1CC(C)(C)CC[C@@H]1NC(=O)Cc1c[nH+]c[nH]1 ZINC000900953711 584366534 /nfs/dbraw/zinc/36/65/34/584366534.db2.gz FOGGHJCQVVIHGU-JQWIXIFHSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@H](O)[C@H](C)C(=O)Nc1ccc(C)[nH+]c1C ZINC000901014395 584374401 /nfs/dbraw/zinc/37/44/01/584374401.db2.gz VJQULUIBPDKWRZ-CABZTGNLSA-N 1 2 236.315 2.044 20 0 BEADLO CC(C)C1CCC(NC(=O)Cc2c[nH]c[nH+]2)CC1 ZINC000901089697 584383737 /nfs/dbraw/zinc/38/37/37/584383737.db2.gz MTERMJLJORZWQV-UHFFFAOYSA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)C1CCC(NC(=O)Cc2c[nH+]c[nH]2)CC1 ZINC000901089697 584383738 /nfs/dbraw/zinc/38/37/38/584383738.db2.gz MTERMJLJORZWQV-UHFFFAOYSA-N 1 2 249.358 2.283 20 0 BEADLO CO[C@@H](C)Sc1[nH+]cc2ccccn21 ZINC000901411805 584441065 /nfs/dbraw/zinc/44/10/65/584441065.db2.gz WIZPAEGOUAXGTJ-MRVPVSSYSA-N 1 2 208.286 2.419 20 0 BEADLO C[C@@H](CO)C[NH2+]c1ccc2c(c1)C[C@H](C)O2 ZINC000901447341 584447330 /nfs/dbraw/zinc/44/73/30/584447330.db2.gz MSHRRFKUTDFSBI-ZJUUUORDSA-N 1 2 221.300 2.050 20 0 BEADLO C[C@@H](CO)C[NH2+]c1ccc2c(c1)C[C@@H](C)O2 ZINC000901447334 584447351 /nfs/dbraw/zinc/44/73/51/584447351.db2.gz MSHRRFKUTDFSBI-NXEZZACHSA-N 1 2 221.300 2.050 20 0 BEADLO C[C@H]1Cc2cc([NH2+]CCC3(O)CC3)ccc2O1 ZINC000901448603 584447732 /nfs/dbraw/zinc/44/77/32/584447732.db2.gz VUAKKBOSHDVMBU-JTQLQIEISA-N 1 2 233.311 2.337 20 0 BEADLO CC(C)n1c[nH+]cc1C=Cc1nccc(=O)[nH]1 ZINC000901477631 584448948 /nfs/dbraw/zinc/44/89/48/584448948.db2.gz QNYKTTKGOWWTTF-ONEGZZNKSA-N 1 2 230.271 2.130 20 0 BEADLO CC(C)n1c[nH+]cc1C=Cc1nccc(=O)[nH]1 ZINC000901477630 584449083 /nfs/dbraw/zinc/44/90/83/584449083.db2.gz QNYKTTKGOWWTTF-ARJAWSKDSA-N 1 2 230.271 2.130 20 0 BEADLO CC(C)c1c[nH]c(C=Cc2nccc(=O)[nH]2)[nH+]1 ZINC000901477627 584449206 /nfs/dbraw/zinc/44/92/06/584449206.db2.gz QIJZVGVAPUQBRU-ONEGZZNKSA-N 1 2 230.271 2.199 20 0 BEADLO CC(C)c1c[nH]c(C=Cc2n[nH]cc2C=O)[nH+]1 ZINC000901464886 584451295 /nfs/dbraw/zinc/45/12/95/584451295.db2.gz PJTWGNPFQSGMAI-ONEGZZNKSA-N 1 2 230.271 2.239 20 0 BEADLO CCCOC(=O)NCC[NH+]1Cc2ccccc2C1 ZINC000858917440 588984894 /nfs/dbraw/zinc/98/48/94/588984894.db2.gz OGYNVWBZAXSXTM-UHFFFAOYSA-N 1 2 248.326 2.138 20 0 BEADLO CCCOC(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000858927073 588985724 /nfs/dbraw/zinc/98/57/24/588985724.db2.gz GIPGNAFRAWJTTJ-UHFFFAOYSA-N 1 2 237.303 2.067 20 0 BEADLO Cn1c[nH+]c(CSCc2ccncc2)c1 ZINC000901632258 584471900 /nfs/dbraw/zinc/47/19/00/584471900.db2.gz WMCOKYIOJKAVIH-UHFFFAOYSA-N 1 2 219.313 2.249 20 0 BEADLO c1ccc2[nH+]c(CCSC3COC3)[nH]c2c1 ZINC000901634315 584472935 /nfs/dbraw/zinc/47/29/35/584472935.db2.gz QVHFQFMHLLSVRW-UHFFFAOYSA-N 1 2 234.324 2.237 20 0 BEADLO O=C1OCCN1C[N@H+](Cc1ccccc1)C1CC1 ZINC000902041210 584515364 /nfs/dbraw/zinc/51/53/64/584515364.db2.gz MNXOMAFXRIEGQZ-UHFFFAOYSA-N 1 2 246.310 2.061 20 0 BEADLO O=C1OCCN1C[N@@H+](Cc1ccccc1)C1CC1 ZINC000902041210 584515365 /nfs/dbraw/zinc/51/53/65/584515365.db2.gz MNXOMAFXRIEGQZ-UHFFFAOYSA-N 1 2 246.310 2.061 20 0 BEADLO CCc1cc(NCc2[nH]c(C)c(C)[nH+]2)no1 ZINC000902050776 584517321 /nfs/dbraw/zinc/51/73/21/584517321.db2.gz VZHLJJYKSDHGNN-UHFFFAOYSA-N 1 2 220.276 2.189 20 0 BEADLO Cc1[nH]c(CNc2ccc(C3CC3)nn2)[nH+]c1C ZINC000902076987 584520630 /nfs/dbraw/zinc/52/06/30/584520630.db2.gz BASSDOPBLSYUFY-UHFFFAOYSA-N 1 2 243.314 2.306 20 0 BEADLO CCOc1cncc(CNc2cc[nH+]c(C)n2)c1 ZINC000902125859 584528866 /nfs/dbraw/zinc/52/88/66/584528866.db2.gz CQNHRJZSNCIBRF-UHFFFAOYSA-N 1 2 244.298 2.191 20 0 BEADLO CCn1cccc1CNc1cc[nH+]c(C)n1 ZINC000902124190 584528995 /nfs/dbraw/zinc/52/89/95/584528995.db2.gz CMIAMBGPZXSVOB-UHFFFAOYSA-N 1 2 216.288 2.219 20 0 BEADLO Cn1nc(C[NH+]2C3CCC2CC3)cc1Cl ZINC000859071290 588996826 /nfs/dbraw/zinc/99/68/26/588996826.db2.gz FWZFAWPLGAIOJN-UHFFFAOYSA-N 1 2 225.723 2.200 20 0 BEADLO Cc1cnc(NCc2c[nH+]cn2C(C)C)cn1 ZINC000902209596 584538771 /nfs/dbraw/zinc/53/87/71/584538771.db2.gz CYLUZWWMBCKRTF-UHFFFAOYSA-N 1 2 231.303 2.175 20 0 BEADLO CC(C)OCC(N)=[NH+]OCCCC(C)(F)F ZINC000902222271 584540654 /nfs/dbraw/zinc/54/06/54/584540654.db2.gz YNBYZJSIKHCAPC-UHFFFAOYSA-N 1 2 238.278 2.345 20 0 BEADLO Cc1ccc(OCc2ccc(N(C)C)[nH+]c2)cn1 ZINC000902227370 584541184 /nfs/dbraw/zinc/54/11/84/584541184.db2.gz ABPXLYNBEZGCKC-UHFFFAOYSA-N 1 2 243.310 2.430 20 0 BEADLO CCn1cnc(C[NH2+]Cc2cc(C(C)C)no2)c1 ZINC000902243400 584546358 /nfs/dbraw/zinc/54/63/58/584546358.db2.gz OSYIDIPNNRWGAY-UHFFFAOYSA-N 1 2 248.330 2.304 20 0 BEADLO CCn1c[nH+]c(CNCc2cc(C(C)C)no2)c1 ZINC000902243400 584546359 /nfs/dbraw/zinc/54/63/59/584546359.db2.gz OSYIDIPNNRWGAY-UHFFFAOYSA-N 1 2 248.330 2.304 20 0 BEADLO CC1CC[NH+](Cc2cc(Cl)n(C)n2)CC1 ZINC000859062664 588995715 /nfs/dbraw/zinc/99/57/15/588995715.db2.gz BDIPQHQNVAKBAT-UHFFFAOYSA-N 1 2 227.739 2.305 20 0 BEADLO FC1(F)[C@@H]2C[C@@H](COCc3[nH]cc[nH+]3)C[C@@H]21 ZINC000902395352 584584885 /nfs/dbraw/zinc/58/48/85/584584885.db2.gz DJBQZJAWMGWDSB-PSVAKVPMSA-N 1 2 228.242 2.218 20 0 BEADLO CCn1c[nH+]c(CNc2cnn(C(C)(C)C)c2)c1 ZINC000902418333 584591664 /nfs/dbraw/zinc/59/16/64/584591664.db2.gz DRJHELLEOSLZRC-UHFFFAOYSA-N 1 2 247.346 2.467 20 0 BEADLO CCn1c[nH+]c(CN[C@@H]2CCCC2(F)F)c1 ZINC000902561230 584634602 /nfs/dbraw/zinc/63/46/02/584634602.db2.gz SBSVFPDEIRWUJF-SNVBAGLBSA-N 1 2 229.274 2.180 20 0 BEADLO CCn1cnc(C[NH2+]Cc2ccc(C)c(C)n2)c1 ZINC000902596909 584636940 /nfs/dbraw/zinc/63/69/40/584636940.db2.gz RNGXIZLXYHDEBP-UHFFFAOYSA-N 1 2 244.342 2.205 20 0 BEADLO C[C@@H](O)CCOc1ccc2c[nH+]ccc2c1 ZINC000902637031 584648291 /nfs/dbraw/zinc/64/82/91/584648291.db2.gz GMXAZUSHUVRIAG-SNVBAGLBSA-N 1 2 217.268 2.385 20 0 BEADLO COC/C(C)=C\CO[NH+]=C(N)Cc1ccccc1 ZINC000902699601 584654874 /nfs/dbraw/zinc/65/48/74/584654874.db2.gz KGPSOPMFFKICCL-WQLSENKSSA-N 1 2 248.326 2.320 20 0 BEADLO CCn1c[nH+]c(CNc2cnn(C3CCC3)c2)c1 ZINC000902686605 584655830 /nfs/dbraw/zinc/65/58/30/584655830.db2.gz VIALVOOVZPTDJV-UHFFFAOYSA-N 1 2 245.330 2.437 20 0 BEADLO CCOc1ccn(Cc2cc(C)cc(C)[nH+]2)n1 ZINC000902768885 584667370 /nfs/dbraw/zinc/66/73/70/584667370.db2.gz WQBQAECXDPLKIN-UHFFFAOYSA-N 1 2 231.299 2.342 20 0 BEADLO CC[C@@H](COc1ccc2c(c1)[nH+]cn2C)OC ZINC000902781069 584670223 /nfs/dbraw/zinc/67/02/23/584670223.db2.gz DFNZCWNPQTUBBD-JTQLQIEISA-N 1 2 234.299 2.377 20 0 BEADLO C[C@H]([NH2+][C@@H]1CC[C@@H]2[C@H]3OCC[C@H]3[C@@H]21)C(F)(F)F ZINC000902995214 584708951 /nfs/dbraw/zinc/70/89/51/584708951.db2.gz WWJYBPVRWQCRCZ-XBJGVBRDSA-N 1 2 249.276 2.340 20 0 BEADLO CCCn1cc([C@@H](C)[NH2+]CC(C)(C)F)nn1 ZINC000903074333 584726816 /nfs/dbraw/zinc/72/68/16/584726816.db2.gz VCDJOIDXLCQBPA-SECBINFHSA-N 1 2 228.315 2.087 20 0 BEADLO C[C@H]([NH2+]Cc1cn(C)cn1)c1cc(O)cc(F)c1 ZINC000903352092 584755359 /nfs/dbraw/zinc/75/53/59/584755359.db2.gz QQPIUAOUPFHAKF-VIFPVBQESA-N 1 2 249.289 2.116 20 0 BEADLO c1ccc(CCOCCCN2CC=CC[NH2+]2)cc1 ZINC000903488689 584780579 /nfs/dbraw/zinc/78/05/79/584780579.db2.gz RTVSKTCNRBAFAP-UHFFFAOYSA-N 1 2 246.354 2.012 20 0 BEADLO CCc1ccc(CCN2CC=CC[NH2+]2)cc1 ZINC000903488738 584780664 /nfs/dbraw/zinc/78/06/64/584780664.db2.gz UQBPKRPHXNXASF-UHFFFAOYSA-N 1 2 216.328 2.168 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+]1CC[C@H]2CC[C@@]21C[NH3+] ZINC000903856427 584809420 /nfs/dbraw/zinc/80/94/20/584809420.db2.gz QWYWNCLFZNXYFE-UKRRQHHQSA-N 1 2 248.345 2.447 20 0 BEADLO CCO[C@H](c1noc([C@@H](C)[NH+](C)C)n1)C(C)C ZINC000904129566 584842830 /nfs/dbraw/zinc/84/28/30/584842830.db2.gz GTOLSRXULFENHZ-ZJUUUORDSA-N 1 2 241.335 2.426 20 0 BEADLO C[C@H]1[N@H+](Cc2ccnc(F)c2)CCOC1(C)C ZINC000859166013 589012850 /nfs/dbraw/zinc/01/28/50/589012850.db2.gz OJPWFPAMANLMMK-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H]1[N@@H+](Cc2ccnc(F)c2)CCOC1(C)C ZINC000859166013 589012852 /nfs/dbraw/zinc/01/28/52/589012852.db2.gz OJPWFPAMANLMMK-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO C[Si](C)(CCn1ccnc1)CCn1cc[nH+]c1 ZINC000859167972 589013065 /nfs/dbraw/zinc/01/30/65/589013065.db2.gz HABRRRZROQJYOX-UHFFFAOYSA-N 1 2 248.406 2.488 20 0 BEADLO COCCC(C)(C)CNc1cc(CO)cc[nH+]1 ZINC000641515538 584889295 /nfs/dbraw/zinc/88/92/95/584889295.db2.gz TXEFLQLCVDWJDN-UHFFFAOYSA-N 1 2 238.331 2.049 20 0 BEADLO CCCOC(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000859180926 589015303 /nfs/dbraw/zinc/01/53/03/589015303.db2.gz RPMNNWGWERXWRW-RKDXNWHRSA-N 1 2 223.276 2.025 20 0 BEADLO Cc1occc1C(=O)OCCCn1cc[nH+]c1 ZINC000763293436 584921235 /nfs/dbraw/zinc/92/12/35/584921235.db2.gz GTOWTYPHHAGCKV-UHFFFAOYSA-N 1 2 234.255 2.032 20 0 BEADLO CO[C@H]1CCC[N@H+](Cc2ncc(C(C)C)o2)C1 ZINC000733309135 584946662 /nfs/dbraw/zinc/94/66/62/584946662.db2.gz BHFBHPBARIBTEO-NSHDSACASA-N 1 2 238.331 2.409 20 0 BEADLO CO[C@H]1CCC[N@@H+](Cc2ncc(C(C)C)o2)C1 ZINC000733309135 584946663 /nfs/dbraw/zinc/94/66/63/584946663.db2.gz BHFBHPBARIBTEO-NSHDSACASA-N 1 2 238.331 2.409 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2nc(C)no2)c(C)o1 ZINC000734004977 584956221 /nfs/dbraw/zinc/95/62/21/584956221.db2.gz YNPLKOXLXNIXKL-QMMMGPOBSA-N 1 2 235.287 2.439 20 0 BEADLO Cc1nonc1C[N@H+]1Cc2ccccc2C[C@H]1C ZINC000741797166 584956993 /nfs/dbraw/zinc/95/69/93/584956993.db2.gz HYUNIUFIPMCWTM-SNVBAGLBSA-N 1 2 243.310 2.325 20 0 BEADLO Cc1nonc1C[N@@H+]1Cc2ccccc2C[C@H]1C ZINC000741797166 584956994 /nfs/dbraw/zinc/95/69/94/584956994.db2.gz HYUNIUFIPMCWTM-SNVBAGLBSA-N 1 2 243.310 2.325 20 0 BEADLO Cc1nonc1C[N@@H+]1CCc2c(C)cccc2C1 ZINC000734148870 584957698 /nfs/dbraw/zinc/95/76/98/584957698.db2.gz ONVZBHCFYKRIGG-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1nonc1C[N@H+]1CCc2c(C)cccc2C1 ZINC000734148870 584957699 /nfs/dbraw/zinc/95/76/99/584957699.db2.gz ONVZBHCFYKRIGG-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1nonc1C[N@H+](Cc1ccccn1)C(C)C ZINC000734147823 584957715 /nfs/dbraw/zinc/95/77/15/584957715.db2.gz YSXFSJWSBQLWFI-UHFFFAOYSA-N 1 2 246.314 2.184 20 0 BEADLO Cc1nonc1C[N@@H+](Cc1ccccn1)C(C)C ZINC000734147823 584957716 /nfs/dbraw/zinc/95/77/16/584957716.db2.gz YSXFSJWSBQLWFI-UHFFFAOYSA-N 1 2 246.314 2.184 20 0 BEADLO NC(Cc1ccccc1)=[NH+]OCC1CCOCC1 ZINC000735488393 584977826 /nfs/dbraw/zinc/97/78/26/584977826.db2.gz JBAKJQXRTBSVBF-UHFFFAOYSA-N 1 2 248.326 2.154 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)[C@]2(C)CCC[C@@H]2C)S1 ZINC000819781061 585007577 /nfs/dbraw/zinc/00/75/77/585007577.db2.gz KZWCXQHEQXVYOS-YGOYTEALSA-N 1 2 240.372 2.420 20 0 BEADLO COc1c(C)c[nH+]c(COC(=O)[C@H]2C[C@@H]2C)c1C ZINC000736742474 585011364 /nfs/dbraw/zinc/01/13/64/585011364.db2.gz GJBKQZKQRKPZQU-KWQFWETISA-N 1 2 249.310 2.406 20 0 BEADLO CC1=C(C)C[C@H](C(=O)NCc2cn(C)c[nH+]2)CC1 ZINC000890105131 585023458 /nfs/dbraw/zinc/02/34/58/585023458.db2.gz XBKDOTOQYGHEGP-GFCCVEGCSA-N 1 2 247.342 2.173 20 0 BEADLO C[C@H]1C[C@H](C(=O)NCc2cn(C)c[nH+]2)C[C@@H](C)C1 ZINC000890109266 585023789 /nfs/dbraw/zinc/02/37/89/585023789.db2.gz ILERLMXLJFZJLA-GDNZZTSVSA-N 1 2 249.358 2.109 20 0 BEADLO CC[C@@H](CC(F)F)C(=O)OCCn1cc[nH+]c1 ZINC000838399032 585056359 /nfs/dbraw/zinc/05/63/59/585056359.db2.gz XAUXECNBGLBBEF-VIFPVBQESA-N 1 2 246.257 2.108 20 0 BEADLO CCn1ncc(C[N@H+](C)Cc2ccccc2C)n1 ZINC000838784087 585070130 /nfs/dbraw/zinc/07/01/30/585070130.db2.gz NVLWJAQAZKJXDP-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1ncc(C[N@@H+](C)Cc2ccccc2C)n1 ZINC000838784087 585070131 /nfs/dbraw/zinc/07/01/31/585070131.db2.gz NVLWJAQAZKJXDP-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1ncc(C[N@H+](C)Cc2ccc(F)cc2)n1 ZINC000838788145 585070425 /nfs/dbraw/zinc/07/04/25/585070425.db2.gz SFBAMJNTJGOYHM-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO CCn1ncc(C[N@@H+](C)Cc2ccc(F)cc2)n1 ZINC000838788145 585070426 /nfs/dbraw/zinc/07/04/26/585070426.db2.gz SFBAMJNTJGOYHM-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO CC[C@H](CC(F)F)C(=O)OCc1c[nH+]cn1C ZINC000838809292 585070724 /nfs/dbraw/zinc/07/07/24/585070724.db2.gz DADHKRIQHYWREU-MRVPVSSYSA-N 1 2 246.257 2.145 20 0 BEADLO CN(C)c1[nH+]cccc1COC(=O)/C=C/C1CC1 ZINC000838952301 585080721 /nfs/dbraw/zinc/08/07/21/585080721.db2.gz GWFWBDRTXPMVAG-BQYQJAHWSA-N 1 2 246.310 2.157 20 0 BEADLO O[C@@H](C[NH2+][C@H](c1ccccc1)C(F)F)C1CC1 ZINC000839029211 585088310 /nfs/dbraw/zinc/08/83/10/585088310.db2.gz XOTSWXOFUDYGRX-NWDGAFQWSA-N 1 2 241.281 2.353 20 0 BEADLO CCn1ncc(C[N@@H+]2CC3(CCC3)[C@H]2C2CC2)n1 ZINC000839107872 585091442 /nfs/dbraw/zinc/09/14/42/585091442.db2.gz NMCONQATSCTLNB-CYBMUJFWSA-N 1 2 246.358 2.063 20 0 BEADLO CCn1ncc(C[N@H+]2CC3(CCC3)[C@H]2C2CC2)n1 ZINC000839107872 585091443 /nfs/dbraw/zinc/09/14/43/585091443.db2.gz NMCONQATSCTLNB-CYBMUJFWSA-N 1 2 246.358 2.063 20 0 BEADLO COC1C[NH+](Cc2cnc3ccccc3c2)C1 ZINC000839127553 585093361 /nfs/dbraw/zinc/09/33/61/585093361.db2.gz FUHYJDDRSLXMDV-UHFFFAOYSA-N 1 2 228.295 2.065 20 0 BEADLO O=C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1coc(C2CC2)n1 ZINC000839131949 585093997 /nfs/dbraw/zinc/09/39/97/585093997.db2.gz QTZIWZCOIFPSSR-TXEJJXNPSA-N 1 2 246.310 2.248 20 0 BEADLO O=C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1coc(C2CC2)n1 ZINC000839131949 585093998 /nfs/dbraw/zinc/09/39/98/585093998.db2.gz QTZIWZCOIFPSSR-TXEJJXNPSA-N 1 2 246.310 2.248 20 0 BEADLO CCc1ccc(C[NH+]2CC(O)(C(C)C)C2)o1 ZINC000839132203 585094184 /nfs/dbraw/zinc/09/41/84/585094184.db2.gz CVAPFUAQXOXCQY-UHFFFAOYSA-N 1 2 223.316 2.045 20 0 BEADLO CCOC1(C)C[NH+](Cc2ccc(F)nc2C)C1 ZINC000839142340 585094725 /nfs/dbraw/zinc/09/47/25/585094725.db2.gz IEEKMMSYIWDOIJ-UHFFFAOYSA-N 1 2 238.306 2.140 20 0 BEADLO Cc1ccoc1COC(=O)CCCn1cc[nH+]c1 ZINC000839375767 585102291 /nfs/dbraw/zinc/10/22/91/585102291.db2.gz CQXSPYZJCYWBCY-UHFFFAOYSA-N 1 2 248.282 2.308 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+]CCc1cc(C)cc(C)c1 ZINC000740898820 585107775 /nfs/dbraw/zinc/10/77/75/585107775.db2.gz ZRZWJLMABJMJDN-ZDUSSCGKSA-N 1 2 249.354 2.387 20 0 BEADLO Cc1nc(NC[C@@H](O)c2ccccc2F)cc[nH+]1 ZINC000742254372 585124354 /nfs/dbraw/zinc/12/43/54/585124354.db2.gz AYNKMZKAHLASTM-GFCCVEGCSA-N 1 2 247.273 2.070 20 0 BEADLO CCCn1cc(Nc2[nH+]cnc3[nH]ccc32)cn1 ZINC000742419763 585126000 /nfs/dbraw/zinc/12/60/00/585126000.db2.gz OTOCDJLAFZKUPB-UHFFFAOYSA-N 1 2 242.286 2.308 20 0 BEADLO Cc1ccc([C@@H](C)C(=O)N(C)Cc2[nH]cc[nH+]2)o1 ZINC000742649429 585129432 /nfs/dbraw/zinc/12/94/32/585129432.db2.gz APWVUGSHPDMLAN-SNVBAGLBSA-N 1 2 247.298 2.073 20 0 BEADLO C[C@@H](O)CC[N@@H+]1CCn2c(Cl)ccc2[C@@H]1C ZINC000839527730 585139519 /nfs/dbraw/zinc/13/95/19/585139519.db2.gz HFJISHPYFDIQFH-ZJUUUORDSA-N 1 2 242.750 2.289 20 0 BEADLO C[C@@H](O)CC[N@H+]1CCn2c(Cl)ccc2[C@@H]1C ZINC000839527730 585139520 /nfs/dbraw/zinc/13/95/20/585139520.db2.gz HFJISHPYFDIQFH-ZJUUUORDSA-N 1 2 242.750 2.289 20 0 BEADLO CC[N@@H+]1CCCC[C@H]1C(=O)OC[Si](C)(C)C ZINC000745083548 585156054 /nfs/dbraw/zinc/15/60/54/585156054.db2.gz NAHQFVDEVHAHMP-NSHDSACASA-N 1 2 243.423 2.281 20 0 BEADLO CC[N@H+]1CCCC[C@H]1C(=O)OC[Si](C)(C)C ZINC000745083548 585156055 /nfs/dbraw/zinc/15/60/55/585156055.db2.gz NAHQFVDEVHAHMP-NSHDSACASA-N 1 2 243.423 2.281 20 0 BEADLO CC=C(C)C(=O)Nc1cc(C)[nH+]cc1C ZINC000747106661 585175094 /nfs/dbraw/zinc/17/50/94/585175094.db2.gz CYWMPWBHNYKMEO-YVMONPNESA-N 1 2 204.273 2.025 20 0 BEADLO Cc1cc(NC(=O)C=C2CCC2)c(C)c[nH+]1 ZINC000747111792 585175197 /nfs/dbraw/zinc/17/51/97/585175197.db2.gz KZHJYSJZOPRLLI-UHFFFAOYSA-N 1 2 216.284 2.169 20 0 BEADLO Cn1c[nH+]cc1COC(=O)C1CCCCCC1 ZINC000747779104 585184328 /nfs/dbraw/zinc/18/43/28/585184328.db2.gz BYJDLGIUAXLSNC-UHFFFAOYSA-N 1 2 236.315 2.434 20 0 BEADLO CCOC[C@H]1CC[N@H+](CC(F)(F)C(F)F)C1 ZINC000747965930 585185938 /nfs/dbraw/zinc/18/59/38/585185938.db2.gz FSPIKOJLFPJSSY-QMMMGPOBSA-N 1 2 243.244 2.245 20 0 BEADLO CCOC[C@H]1CC[N@@H+](CC(F)(F)C(F)F)C1 ZINC000747965930 585185939 /nfs/dbraw/zinc/18/59/39/585185939.db2.gz FSPIKOJLFPJSSY-QMMMGPOBSA-N 1 2 243.244 2.245 20 0 BEADLO Cc1noc(C)c1C[NH2+]Cc1cccc(F)n1 ZINC000747936755 585186271 /nfs/dbraw/zinc/18/62/71/585186271.db2.gz ZTLAESANDFJYSI-UHFFFAOYSA-N 1 2 235.262 2.115 20 0 BEADLO C[C@@H](C(=O)NC1=[NH+]CCS1)C1CCCC1 ZINC000749335424 585201360 /nfs/dbraw/zinc/20/13/60/585201360.db2.gz MOAUFFYLMTZUNG-MRVPVSSYSA-N 1 2 226.345 2.032 20 0 BEADLO CO[C@H](C)CC(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC000749565419 585203926 /nfs/dbraw/zinc/20/39/26/585203926.db2.gz PCSOKXJMRGRSMU-MRVPVSSYSA-N 1 2 247.298 2.235 20 0 BEADLO Cc1ccc(NC(=O)/C=C\C2CC2)c(N(C)C)[nH+]1 ZINC000749992775 585209450 /nfs/dbraw/zinc/20/94/50/585209450.db2.gz OJYSHMDGPMRSFY-CLFYSBASSA-N 1 2 245.326 2.361 20 0 BEADLO CC(C)=C(C)C(=O)NCc1ccc[nH+]c1N(C)C ZINC000751350327 585226992 /nfs/dbraw/zinc/22/69/92/585226992.db2.gz OJTISTPRSXTGBO-UHFFFAOYSA-N 1 2 247.342 2.120 20 0 BEADLO Cc1nonc1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC000751479381 585231541 /nfs/dbraw/zinc/23/15/41/585231541.db2.gz OJMMBBVGFREZKJ-ZDUSSCGKSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1nonc1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000751479381 585231542 /nfs/dbraw/zinc/23/15/42/585231542.db2.gz OJMMBBVGFREZKJ-ZDUSSCGKSA-N 1 2 244.298 2.110 20 0 BEADLO CS/C=C\C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000751582897 585233790 /nfs/dbraw/zinc/23/37/90/585233790.db2.gz WPASZCSMAKGOEJ-DAXSKMNVSA-N 1 2 233.296 2.150 20 0 BEADLO C[C@H]1CC/C(=C\C(=O)N2CC(n3cc[nH+]c3)C2)C1 ZINC000753616145 585264080 /nfs/dbraw/zinc/26/40/80/585264080.db2.gz FOVQRTMPXLKBQU-WBOGTDJTSA-N 1 2 245.326 2.013 20 0 BEADLO CN(C)c1cc(C[N@@H+]2CCC=C(F)C2)ccn1 ZINC000754096207 585278412 /nfs/dbraw/zinc/27/84/12/585278412.db2.gz BZVZZDQMRHGWGW-UHFFFAOYSA-N 1 2 235.306 2.207 20 0 BEADLO CN(C)c1cc(C[N@H+]2CCC=C(F)C2)ccn1 ZINC000754096207 585278413 /nfs/dbraw/zinc/27/84/13/585278413.db2.gz BZVZZDQMRHGWGW-UHFFFAOYSA-N 1 2 235.306 2.207 20 0 BEADLO Cn1c[nH+]cc1COC(=O)CC1=CCCCC1 ZINC000754682823 585289264 /nfs/dbraw/zinc/28/92/64/585289264.db2.gz LGVHQWZXAKLHLU-UHFFFAOYSA-N 1 2 234.299 2.354 20 0 BEADLO CN(C)c1cc(COC(=O)C=C2CCC2)cc[nH+]1 ZINC000755887160 585309410 /nfs/dbraw/zinc/30/94/10/585309410.db2.gz AGZCDKLRWWPLAT-UHFFFAOYSA-N 1 2 246.310 2.301 20 0 BEADLO C/C=C/C=C\C(=O)OCc1cc[nH+]c(N(C)C)c1 ZINC000755904234 585309745 /nfs/dbraw/zinc/30/97/45/585309745.db2.gz QWBVAGOLSRUCCR-DEQVHDEQSA-N 1 2 246.310 2.323 20 0 BEADLO CC/C=C(/C)C(=O)N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000756131247 585314908 /nfs/dbraw/zinc/31/49/08/585314908.db2.gz QRMXUBNAHLNOJU-DKRCXCIFSA-N 1 2 247.342 2.092 20 0 BEADLO CCC/C=C\C(=O)N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000756130418 585314916 /nfs/dbraw/zinc/31/49/16/585314916.db2.gz LWJADGLRBBOMCD-FOQNGQEVSA-N 1 2 247.342 2.092 20 0 BEADLO Cc1cc(CNc2cc[nH+]c(C(C)C)n2)ncn1 ZINC000756949966 585325545 /nfs/dbraw/zinc/32/55/45/585325545.db2.gz IPKBBPKJXATMFJ-UHFFFAOYSA-N 1 2 243.314 2.311 20 0 BEADLO Cc1ccc2[nH+]c(COC(=O)C3CCC3)cn2c1 ZINC000758022402 585348309 /nfs/dbraw/zinc/34/83/09/585348309.db2.gz UYFHHTBPNDVQLX-UHFFFAOYSA-N 1 2 244.294 2.486 20 0 BEADLO CCC(=CC(=O)N(C)Cc1[nH]cc[nH+]1)CC ZINC000759191179 585365104 /nfs/dbraw/zinc/36/51/04/585365104.db2.gz BYXJZMDBWVBSCY-UHFFFAOYSA-N 1 2 221.304 2.115 20 0 BEADLO C[C@H]1CO[C@@H](c2ccccc2)C[N@@H+]1CCF ZINC000759340172 585368769 /nfs/dbraw/zinc/36/87/69/585368769.db2.gz SHJBXFFHAFAUQG-WCQYABFASA-N 1 2 223.291 2.418 20 0 BEADLO C[C@H]1CO[C@@H](c2ccccc2)C[N@H+]1CCF ZINC000759340172 585368770 /nfs/dbraw/zinc/36/87/70/585368770.db2.gz SHJBXFFHAFAUQG-WCQYABFASA-N 1 2 223.291 2.418 20 0 BEADLO FCCN1CC[N@H+](CCF)C2(CCCCC2)C1 ZINC000759346793 585370297 /nfs/dbraw/zinc/37/02/97/585370297.db2.gz JWMPNFXYFPAXPI-UHFFFAOYSA-N 1 2 246.345 2.246 20 0 BEADLO FCCN1CC[N@@H+](CCF)C2(CCCCC2)C1 ZINC000759346793 585370298 /nfs/dbraw/zinc/37/02/98/585370298.db2.gz JWMPNFXYFPAXPI-UHFFFAOYSA-N 1 2 246.345 2.246 20 0 BEADLO C[C@@H]1C[N@H+](CCF)[C@H](c2ccccc2)CO1 ZINC000759347598 585370831 /nfs/dbraw/zinc/37/08/31/585370831.db2.gz REKRESIGWJJLKV-YPMHNXCESA-N 1 2 223.291 2.418 20 0 BEADLO C[C@@H]1C[N@@H+](CCF)[C@H](c2ccccc2)CO1 ZINC000759347598 585370832 /nfs/dbraw/zinc/37/08/32/585370832.db2.gz REKRESIGWJJLKV-YPMHNXCESA-N 1 2 223.291 2.418 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)c1cc(Cl)cs1 ZINC000760324612 585390240 /nfs/dbraw/zinc/39/02/40/585390240.db2.gz WWPUYZCJZHXQFT-UHFFFAOYSA-N 1 2 241.703 2.055 20 0 BEADLO Cc1cnc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)o1 ZINC000761048389 585404221 /nfs/dbraw/zinc/40/42/21/585404221.db2.gz XZKZFVCTULTDAC-MRVPVSSYSA-N 1 2 234.221 2.367 20 0 BEADLO Cc1cnc(C[N@H+]2CC[C@@H](C(F)(F)F)C2)o1 ZINC000761048389 585404222 /nfs/dbraw/zinc/40/42/22/585404222.db2.gz XZKZFVCTULTDAC-MRVPVSSYSA-N 1 2 234.221 2.367 20 0 BEADLO c1ccc(-c2nc(C[N@@H+]3CC[C@H]4C[C@H]43)no2)cc1 ZINC000761101520 585409440 /nfs/dbraw/zinc/40/94/40/585409440.db2.gz YUGCVXUACOYYSB-NWDGAFQWSA-N 1 2 241.294 2.331 20 0 BEADLO c1ccc(-c2nc(C[N@H+]3CC[C@H]4C[C@H]43)no2)cc1 ZINC000761101520 585409441 /nfs/dbraw/zinc/40/94/41/585409441.db2.gz YUGCVXUACOYYSB-NWDGAFQWSA-N 1 2 241.294 2.331 20 0 BEADLO CCC[C@H](C)c1noc(CCn2cc[nH+]c2)n1 ZINC000761842896 585419873 /nfs/dbraw/zinc/41/98/73/585419873.db2.gz LJVKFBWTWZVGMI-JTQLQIEISA-N 1 2 234.303 2.412 20 0 BEADLO c1cn(C2CC2)c(SCCn2cc[nH+]c2)n1 ZINC000762193173 585428962 /nfs/dbraw/zinc/42/89/62/585428962.db2.gz GYJSOKHKHJCDMG-UHFFFAOYSA-N 1 2 234.328 2.207 20 0 BEADLO CC(C)c1cnc(CN(C)Cc2[nH]cc[nH+]2)o1 ZINC000762316705 585430684 /nfs/dbraw/zinc/43/06/84/585430684.db2.gz ODNJUYSUTXGDAQ-UHFFFAOYSA-N 1 2 234.303 2.153 20 0 BEADLO C[C@@H](O)[C@@H](C)SCc1cc[nH+]c(N(C)C)c1 ZINC000762478330 585432933 /nfs/dbraw/zinc/43/29/33/585432933.db2.gz FWTABWMTLYNEGE-NXEZZACHSA-N 1 2 240.372 2.150 20 0 BEADLO CCC/C=C\C(=O)NCc1ccn2cc[nH+]c2c1 ZINC000762560335 585433992 /nfs/dbraw/zinc/43/39/92/585433992.db2.gz CPKJRSLAPKWBNS-PLNGDYQASA-N 1 2 243.310 2.307 20 0 BEADLO O=C(CC1CCCC1)OCCn1cc[nH+]c1 ZINC000763114485 585443173 /nfs/dbraw/zinc/44/31/73/585443173.db2.gz IOQZXGZNYZYGBS-UHFFFAOYSA-N 1 2 222.288 2.007 20 0 BEADLO Cc1ccc(F)cc1C(=O)OCCn1cc[nH+]c1 ZINC000763111571 585443422 /nfs/dbraw/zinc/44/34/22/585443422.db2.gz AGHSLPQXKHRHTL-UHFFFAOYSA-N 1 2 248.257 2.188 20 0 BEADLO COc1ccc(C[N@H+](C)C/C=C/Cl)cn1 ZINC000764374829 585464229 /nfs/dbraw/zinc/46/42/29/585464229.db2.gz ZPHMAFGNJLXXFO-ZZXKWVIFSA-N 1 2 226.707 2.275 20 0 BEADLO COc1ccc(C[N@@H+](C)C/C=C/Cl)cn1 ZINC000764374829 585464230 /nfs/dbraw/zinc/46/42/30/585464230.db2.gz ZPHMAFGNJLXXFO-ZZXKWVIFSA-N 1 2 226.707 2.275 20 0 BEADLO CC(C)n1cccc1C(=O)OCc1c[nH+]cn1C ZINC000764663244 585470333 /nfs/dbraw/zinc/47/03/33/585470333.db2.gz NFQVMWXQPWUJNY-UHFFFAOYSA-N 1 2 247.298 2.160 20 0 BEADLO CN(c1[nH+]cnc2c1cnn2C(C)(C)C)C1CC1 ZINC000766392390 585501726 /nfs/dbraw/zinc/50/17/26/585501726.db2.gz QYBBEXADACBMHA-UHFFFAOYSA-N 1 2 245.330 2.180 20 0 BEADLO COc1cc[nH+]cc1COC(=O)c1ccc(C)o1 ZINC000805332823 585504588 /nfs/dbraw/zinc/50/45/88/585504588.db2.gz AOENUQKOQFYOMD-UHFFFAOYSA-N 1 2 247.250 2.349 20 0 BEADLO COc1cc[nH+]cc1COC(=O)C=C(C)C ZINC000805333440 585505730 /nfs/dbraw/zinc/50/57/30/585505730.db2.gz JAHVSIVWYGMNRW-UHFFFAOYSA-N 1 2 221.256 2.100 20 0 BEADLO C[C@H]1CC[C@H](OC(=O)CCCn2cc[nH+]c2)C1 ZINC000767519379 585521767 /nfs/dbraw/zinc/52/17/67/585521767.db2.gz UXAJUTIASWWPCH-RYUDHWBXSA-N 1 2 236.315 2.395 20 0 BEADLO C[C@H]1CC[C@@H](OC(=O)CCCn2cc[nH+]c2)C1 ZINC000767519378 585521796 /nfs/dbraw/zinc/52/17/96/585521796.db2.gz UXAJUTIASWWPCH-NWDGAFQWSA-N 1 2 236.315 2.395 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OCc1ccccn1 ZINC000767535351 585522061 /nfs/dbraw/zinc/52/20/61/585522061.db2.gz XGDPMQOKJBLHBM-UHFFFAOYSA-N 1 2 241.294 2.437 20 0 BEADLO CN(C/C(Cl)=C\Cl)Cc1[nH+]ccn1C ZINC000767549538 585522244 /nfs/dbraw/zinc/52/22/44/585522244.db2.gz KBDLVQTUDFVGFB-VMPITWQZSA-N 1 2 234.130 2.171 20 0 BEADLO CC/C=C(\C)C(=O)OCc1c[nH+]ccc1OC ZINC000805358939 585531027 /nfs/dbraw/zinc/53/10/27/585531027.db2.gz VEFOJKLDRYCEJO-BJMVGYQFSA-N 1 2 235.283 2.490 20 0 BEADLO C/C=C(\C)C(=O)N1CCC[C@H](c2[nH+]ccn2C)C1 ZINC000768132411 585532404 /nfs/dbraw/zinc/53/24/04/585532404.db2.gz HRGOLQQAILLITI-QNCMIEPLSA-N 1 2 247.342 2.092 20 0 BEADLO CCC/C(C)=C/C(=O)N(C)CCCn1cc[nH+]c1 ZINC000768323518 585535683 /nfs/dbraw/zinc/53/56/83/585535683.db2.gz JEFXKVKAZUNPTM-ACCUITESSA-N 1 2 249.358 2.478 20 0 BEADLO CC/C=C\CCO[NH+]=C(N)COC(C)C ZINC000768926502 585546168 /nfs/dbraw/zinc/54/61/68/585546168.db2.gz KIJMXSNHIWSVAG-WAYWQWQTSA-N 1 2 214.309 2.266 20 0 BEADLO COc1cc[nH+]cc1COC(=O)c1ccoc1 ZINC000805377882 585547342 /nfs/dbraw/zinc/54/73/42/585547342.db2.gz IZRMGUWUVOKDGD-UHFFFAOYSA-N 1 2 233.223 2.040 20 0 BEADLO C[C@@H]1CCC[C@@H]1CC(=O)OCCn1cc[nH+]c1 ZINC000769184117 585550764 /nfs/dbraw/zinc/55/07/64/585550764.db2.gz QCGXXLPPJPFKFC-VXGBXAGGSA-N 1 2 236.315 2.253 20 0 BEADLO CC(C)C[C@@H](C)OC(=O)NCc1c[nH+]c[nH]1 ZINC000859235988 589023240 /nfs/dbraw/zinc/02/32/40/589023240.db2.gz QPTQEUYZDKUOTL-SECBINFHSA-N 1 2 225.292 2.071 20 0 BEADLO CC(C)C[C@@H](C)OC(=O)NCc1c[nH]c[nH+]1 ZINC000859235988 589023242 /nfs/dbraw/zinc/02/32/42/589023242.db2.gz QPTQEUYZDKUOTL-SECBINFHSA-N 1 2 225.292 2.071 20 0 BEADLO CC1(C)CCCN1C(=O)c1cccc2[nH+]ccn21 ZINC000770432350 585574026 /nfs/dbraw/zinc/57/40/26/585574026.db2.gz MNTSCVSWJNHOCV-UHFFFAOYSA-N 1 2 243.310 2.349 20 0 BEADLO CC(C)(C)c1nc(N[C@@](C)(CO)C2CC2)cc[nH+]1 ZINC000770463145 585574693 /nfs/dbraw/zinc/57/46/93/585574693.db2.gz RVKSAXMNJQCMLZ-AWEZNQCLSA-N 1 2 249.358 2.347 20 0 BEADLO C[C@H]1CC[N@H+](Cc2ccnc(F)c2)C[C@@H]1F ZINC000859240152 589023533 /nfs/dbraw/zinc/02/35/33/589023533.db2.gz UMNPDLGHJAMSDC-ONGXEEELSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2ccnc(F)c2)C[C@@H]1F ZINC000859240152 589023535 /nfs/dbraw/zinc/02/35/35/589023535.db2.gz UMNPDLGHJAMSDC-ONGXEEELSA-N 1 2 226.270 2.401 20 0 BEADLO CCC[C@@](C)(O)C(=O)Nc1ccc(C)[nH+]c1C ZINC000771550811 585596078 /nfs/dbraw/zinc/59/60/78/585596078.db2.gz IJGZCHUEYKCZAB-CYBMUJFWSA-N 1 2 236.315 2.188 20 0 BEADLO Cc1ccc(COC(=O)c2cccn2C)c(C)[nH+]1 ZINC000771845064 585602303 /nfs/dbraw/zinc/60/23/03/585602303.db2.gz GFFIFSWKXSQWBJ-UHFFFAOYSA-N 1 2 244.294 2.394 20 0 BEADLO Cc1ccc(COC(=O)[C@@H]2C[C@@H]2C)c(C)[nH+]1 ZINC000771889436 585603930 /nfs/dbraw/zinc/60/39/30/585603930.db2.gz JHFMROQCCNOTKZ-QPUJVOFHSA-N 1 2 219.284 2.398 20 0 BEADLO Cc1ccc(COC(=O)C2CCOCC2)c(C)[nH+]1 ZINC000771946526 585605254 /nfs/dbraw/zinc/60/52/54/585605254.db2.gz KMFUGATWNDLVAR-UHFFFAOYSA-N 1 2 249.310 2.168 20 0 BEADLO C[C@@H](C(=O)OCCn1cc[nH+]c1)C1CCCC1 ZINC000771993329 585606268 /nfs/dbraw/zinc/60/62/68/585606268.db2.gz IBLPWGRUHBEWIQ-LLVKDONJSA-N 1 2 236.315 2.253 20 0 BEADLO C/C=C(/C=C\C(=O)OCCn1cc[nH+]c1)CC ZINC000772001961 585606566 /nfs/dbraw/zinc/60/65/66/585606566.db2.gz MAOMFKKTPNSHBK-JQFMXUTPSA-N 1 2 234.299 2.339 20 0 BEADLO C/C=C(/C=C/C(=O)OCCn1cc[nH+]c1)CC ZINC000772001962 585606590 /nfs/dbraw/zinc/60/65/90/585606590.db2.gz MAOMFKKTPNSHBK-VLLKVAHVSA-N 1 2 234.299 2.339 20 0 BEADLO CCO[C@H](C)C(=O)OCc1ccc(C)[nH+]c1C ZINC000772011612 585606825 /nfs/dbraw/zinc/60/68/25/585606825.db2.gz WUUWHJUGPJHNQA-LLVKDONJSA-N 1 2 237.299 2.167 20 0 BEADLO CCO[C@@H](C)C(=O)OCc1ccc(C)[nH+]c1C ZINC000772011613 585606881 /nfs/dbraw/zinc/60/68/81/585606881.db2.gz WUUWHJUGPJHNQA-NSHDSACASA-N 1 2 237.299 2.167 20 0 BEADLO CCO[C@@H]1C[C@@H]1C(=O)OCc1ccc(C)[nH+]c1C ZINC000772027377 585607241 /nfs/dbraw/zinc/60/72/41/585607241.db2.gz YXISTXOLQOMQTK-QWHCGFSZSA-N 1 2 249.310 2.167 20 0 BEADLO CC(C)n1cccc1C(=O)OCCn1cc[nH+]c1 ZINC000772038712 585607331 /nfs/dbraw/zinc/60/73/31/585607331.db2.gz SECXDVRPDNJHKT-UHFFFAOYSA-N 1 2 247.298 2.123 20 0 BEADLO Cc1cc(C(=O)OCc2ccc(C)[nH+]c2C)n[nH]1 ZINC000772038258 585607539 /nfs/dbraw/zinc/60/75/39/585607539.db2.gz URQVHYAYNQOQIE-UHFFFAOYSA-N 1 2 245.282 2.087 20 0 BEADLO Cc1ccc(COC(=O)c2cc[nH]c2)c(C)[nH+]1 ZINC000772184812 585609717 /nfs/dbraw/zinc/60/97/17/585609717.db2.gz JNPJASATRNIXAM-UHFFFAOYSA-N 1 2 230.267 2.384 20 0 BEADLO Cc1ccc(COC(=O)[C@@H]2CCO[C@@H]2C)c(C)[nH+]1 ZINC000772237353 585610614 /nfs/dbraw/zinc/61/06/14/585610614.db2.gz XEZGJBNEFCJEOV-DGCLKSJQSA-N 1 2 249.310 2.167 20 0 BEADLO CN(C)c1cc(CSc2ncco2)cc[nH+]1 ZINC000772248508 585610908 /nfs/dbraw/zinc/61/09/08/585610908.db2.gz UGSFIRRXUWDDNV-UHFFFAOYSA-N 1 2 235.312 2.428 20 0 BEADLO CCc1noc(C)c1[C@@H](C)[NH2+]Cc1ccn(C)n1 ZINC000773131962 585632199 /nfs/dbraw/zinc/63/21/99/585632199.db2.gz NFRKDWBIGLILKQ-SECBINFHSA-N 1 2 248.330 2.130 20 0 BEADLO COc1cc[nH+]cc1COC(=O)[C@@H]1C[C@@H]1C1CC1 ZINC000805486755 585640433 /nfs/dbraw/zinc/64/04/33/585640433.db2.gz JRFDGTHZKZIXFL-VXGBXAGGSA-N 1 2 247.294 2.180 20 0 BEADLO COc1cc[nH+]cc1COC(=O)[C@@H]1C[C@H]1C1CC1 ZINC000805486751 585640474 /nfs/dbraw/zinc/64/04/74/585640474.db2.gz JRFDGTHZKZIXFL-NWDGAFQWSA-N 1 2 247.294 2.180 20 0 BEADLO COc1cc[nH+]cc1COC(=O)[C@H]1C[C@@H]1C1CC1 ZINC000805486749 585640490 /nfs/dbraw/zinc/64/04/90/585640490.db2.gz JRFDGTHZKZIXFL-NEPJUHHUSA-N 1 2 247.294 2.180 20 0 BEADLO CCC[C@H](C)OC(=O)[C@@H](C)[NH+]1CCSCC1 ZINC000774986255 585669917 /nfs/dbraw/zinc/66/99/17/585669917.db2.gz GAWXNZSWNGTXJG-WDEREUQCSA-N 1 2 245.388 2.156 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1C(=O)OCCn1cc[nH+]c1 ZINC000775085557 585671943 /nfs/dbraw/zinc/67/19/43/585671943.db2.gz XXSBERFNGVRKBD-WCQYABFASA-N 1 2 236.315 2.109 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1C(=O)OCCn1cc[nH+]c1 ZINC000775085559 585672045 /nfs/dbraw/zinc/67/20/45/585672045.db2.gz XXSBERFNGVRKBD-YPMHNXCESA-N 1 2 236.315 2.109 20 0 BEADLO Cc1nonc1C[NH2+][C@@H](c1ccccn1)C(C)C ZINC000775447101 585678243 /nfs/dbraw/zinc/67/82/43/585678243.db2.gz XGSPGGUSXCDUMZ-CYBMUJFWSA-N 1 2 246.314 2.260 20 0 BEADLO CC(C)[C@H](C)N(C)C(=O)c1cccc2[nH+]ccn21 ZINC000776796144 585705583 /nfs/dbraw/zinc/70/55/83/585705583.db2.gz NAJKKZHEUUEIDB-NSHDSACASA-N 1 2 245.326 2.451 20 0 BEADLO COCCn1cc[nH+]c1-c1ccnc(Cl)c1 ZINC000776833435 585705990 /nfs/dbraw/zinc/70/59/90/585705990.db2.gz QZRKZUOTBFNGAY-UHFFFAOYSA-N 1 2 237.690 2.245 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)c1cccc2[nH+]ccn21 ZINC000776851467 585706124 /nfs/dbraw/zinc/70/61/24/585706124.db2.gz CEXFHKDNBFBBQN-WDEREUQCSA-N 1 2 245.326 2.499 20 0 BEADLO c1c[nH+]c(COCc2cccc3nsnc32)[nH]1 ZINC000776861713 585706370 /nfs/dbraw/zinc/70/63/70/585706370.db2.gz ZYQAXCNYMUDOMP-UHFFFAOYSA-N 1 2 246.295 2.131 20 0 BEADLO COc1ccc(N[C@@H](C)C[C@H]2CCOC2)[nH+]c1 ZINC000777199873 585709375 /nfs/dbraw/zinc/70/93/75/585709375.db2.gz CMBOMYWDCWNYQB-WDEREUQCSA-N 1 2 236.315 2.317 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1ccc(CF)cc1 ZINC000777565873 585715187 /nfs/dbraw/zinc/71/51/87/585715187.db2.gz HTLSSZXTPFLKOT-UHFFFAOYSA-N 1 2 239.290 2.151 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1ccc(CF)cc1 ZINC000777565873 585715188 /nfs/dbraw/zinc/71/51/88/585715188.db2.gz HTLSSZXTPFLKOT-UHFFFAOYSA-N 1 2 239.290 2.151 20 0 BEADLO C[C@H]1[N@H+](Cc2ccc(F)nc2)CCOC1(C)C ZINC000779156897 585746063 /nfs/dbraw/zinc/74/60/63/585746063.db2.gz AGLSOCOWMCQMJW-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H]1[N@@H+](Cc2ccc(F)nc2)CCOC1(C)C ZINC000779156897 585746064 /nfs/dbraw/zinc/74/60/64/585746064.db2.gz AGLSOCOWMCQMJW-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO C[N@H+](Cc1ccc(F)nc1)Cc1ccccn1 ZINC000779165658 585746606 /nfs/dbraw/zinc/74/66/06/585746606.db2.gz KLFYRXBKKHZNNL-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[N@@H+](Cc1ccc(F)nc1)Cc1ccccn1 ZINC000779165658 585746607 /nfs/dbraw/zinc/74/66/07/585746607.db2.gz KLFYRXBKKHZNNL-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[C@@H](CCO)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000779423541 585754939 /nfs/dbraw/zinc/75/49/39/585754939.db2.gz QJSZAVSKGNOIHL-JTQLQIEISA-N 1 2 249.289 2.194 20 0 BEADLO CC/C(C)=C(\C)C(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000780986523 585787858 /nfs/dbraw/zinc/78/78/58/585787858.db2.gz NIZRIIMNMLMHIA-USKTWTLRSA-N 1 2 247.342 2.130 20 0 BEADLO CCC(C)=C(C)C(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000780986523 585787859 /nfs/dbraw/zinc/78/78/59/585787859.db2.gz NIZRIIMNMLMHIA-USKTWTLRSA-N 1 2 247.342 2.130 20 0 BEADLO COC(=O)[C@@H]1CCCCC[N@@H+]1C/C=C\Cl ZINC000781348042 585795191 /nfs/dbraw/zinc/79/51/91/585795191.db2.gz YZSCJELCCNNABD-BXKUYDPTSA-N 1 2 231.723 2.157 20 0 BEADLO COC(=O)[C@@H]1CCCCC[N@H+]1C/C=C\Cl ZINC000781348042 585795192 /nfs/dbraw/zinc/79/51/92/585795192.db2.gz YZSCJELCCNNABD-BXKUYDPTSA-N 1 2 231.723 2.157 20 0 BEADLO CC1(C)CC[C@H](C(=O)NC2=[NH+]CCS2)C1 ZINC000781600302 585800192 /nfs/dbraw/zinc/80/01/92/585800192.db2.gz DZHTWBRAABZUDZ-QMMMGPOBSA-N 1 2 226.345 2.032 20 0 BEADLO C[C@H]1CC[C@H](NC(=O)c2cccc3[nH+]ccn32)C1 ZINC000781606301 585800292 /nfs/dbraw/zinc/80/02/92/585800292.db2.gz LKVSRIKWWGHPCU-QWRGUYRKSA-N 1 2 243.310 2.253 20 0 BEADLO C[C@@H](Nc1cccc2c1OCO2)c1[nH+]ccn1C ZINC000782777018 585824390 /nfs/dbraw/zinc/82/43/90/585824390.db2.gz FLZYUPIFXJYWKC-SECBINFHSA-N 1 2 245.282 2.322 20 0 BEADLO Cc1ccnc(C[NH2+][C@H](C)c2cnccc2C)n1 ZINC000782999249 585826892 /nfs/dbraw/zinc/82/68/92/585826892.db2.gz NTAUVHIRYGHTPS-GFCCVEGCSA-N 1 2 242.326 2.339 20 0 BEADLO NC(Cc1cccc(F)c1)=[NH+]OCC1CC1 ZINC000783153392 585828557 /nfs/dbraw/zinc/82/85/57/585828557.db2.gz WPTBXHQSWDYYAY-UHFFFAOYSA-N 1 2 222.263 2.277 20 0 BEADLO NC(Cc1cccc(F)c1)=[NH+]OCc1ccno1 ZINC000783153296 585828720 /nfs/dbraw/zinc/82/87/20/585828720.db2.gz VAQSHNUHEJQDQJ-UHFFFAOYSA-N 1 2 249.245 2.055 20 0 BEADLO C[C@H](CC(=O)OCCCn1cc[nH+]c1)C1CC1 ZINC000783197685 585830177 /nfs/dbraw/zinc/83/01/77/585830177.db2.gz CDLZDXUOBDMXHU-LLVKDONJSA-N 1 2 236.315 2.253 20 0 BEADLO CCC(C)(C)C(=O)OCCCn1cc[nH+]c1 ZINC000783390901 585834206 /nfs/dbraw/zinc/83/42/06/585834206.db2.gz YNXVZEPHVWQHRE-UHFFFAOYSA-N 1 2 224.304 2.253 20 0 BEADLO CC(C)CO[C@@H](C)C(N)=[NH+]OCCC1CC1 ZINC000783558976 585836922 /nfs/dbraw/zinc/83/69/22/585836922.db2.gz HZFSORRSKQJAOR-JTQLQIEISA-N 1 2 228.336 2.346 20 0 BEADLO CC(C)(C)OCC(N)=[NH+]OCCC1CC1 ZINC000783568640 585837170 /nfs/dbraw/zinc/83/71/70/585837170.db2.gz ZVIZCHWOXRHMOS-UHFFFAOYSA-N 1 2 214.309 2.100 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)OCCCn1cc[nH+]c1 ZINC000784614453 585864738 /nfs/dbraw/zinc/86/47/38/585864738.db2.gz RMYMFRRPRWTSGG-NWDGAFQWSA-N 1 2 238.331 2.499 20 0 BEADLO COc1ccc([NH2+]CC2(C)CC2)cc1NC(N)=O ZINC000785558412 585875524 /nfs/dbraw/zinc/87/55/24/585875524.db2.gz ANAJLQUVGXYUCP-UHFFFAOYSA-N 1 2 249.314 2.398 20 0 BEADLO Fc1ccc(C[NH+]2CC3(C2)CC(F)(F)C3)nc1 ZINC000787275954 585904702 /nfs/dbraw/zinc/90/47/02/585904702.db2.gz TYAZZEJKXPPKLX-UHFFFAOYSA-N 1 2 242.244 2.452 20 0 BEADLO COc1ccc([NH2+]C[C@H]2C[C@@H]2C)cc1NC(N)=O ZINC000787317109 585906881 /nfs/dbraw/zinc/90/68/81/585906881.db2.gz YLLKJSGCWNVIDY-DTWKUNHWSA-N 1 2 249.314 2.254 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2cccnc2F)no1 ZINC000788801579 585930638 /nfs/dbraw/zinc/93/06/38/585930638.db2.gz BBBABIASEDZAQM-SECBINFHSA-N 1 2 235.262 2.368 20 0 BEADLO C/C=C(/CC)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000789758658 585949372 /nfs/dbraw/zinc/94/93/72/585949372.db2.gz PQOWDIZHCRXEGG-RYHWZFLVSA-N 1 2 247.342 2.403 20 0 BEADLO C/C=C(/CC)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000789758654 585949523 /nfs/dbraw/zinc/94/95/23/585949523.db2.gz PQOWDIZHCRXEGG-RPHDBTCBSA-N 1 2 247.342 2.403 20 0 BEADLO Cn1cc[nH+]c1CCCOC(=O)CC(C)(C)C ZINC000789792409 585950140 /nfs/dbraw/zinc/95/01/40/585950140.db2.gz STOFPKZCVOEUEH-UHFFFAOYSA-N 1 2 238.331 2.332 20 0 BEADLO C/C=C(\CC)C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000789849697 585951610 /nfs/dbraw/zinc/95/16/10/585951610.db2.gz UPRBLIPZQBRZQE-LLGDCAAFSA-N 1 2 221.304 2.333 20 0 BEADLO CC=C(CC)C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000789849697 585951611 /nfs/dbraw/zinc/95/16/11/585951611.db2.gz UPRBLIPZQBRZQE-LLGDCAAFSA-N 1 2 221.304 2.333 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1nnc(C(C)(C)C)o1 ZINC000791572371 585984446 /nfs/dbraw/zinc/98/44/46/585984446.db2.gz DZHCFROEBVOGGO-RKDXNWHRSA-N 1 2 223.320 2.350 20 0 BEADLO Cc1cccn2cc(COC(=O)C3CCC3)[nH+]c12 ZINC000805966678 585989720 /nfs/dbraw/zinc/98/97/20/585989720.db2.gz QOQKIHNOAPQXNK-UHFFFAOYSA-N 1 2 244.294 2.486 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)OCc1cc[nH+]c(N)c1 ZINC000792119219 585995955 /nfs/dbraw/zinc/99/59/55/585995955.db2.gz SMPVJLWYMUVQPF-UWVGGRQHSA-N 1 2 236.315 2.389 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1C(=O)OCc1cc[nH+]c(N)c1 ZINC000792151123 585996628 /nfs/dbraw/zinc/99/66/28/585996628.db2.gz MGJOXABBUWSPDC-RISCZKNCSA-N 1 2 248.326 2.389 20 0 BEADLO Nc1cc(COC(=O)C2=CCCCC2)cc[nH+]1 ZINC000792169774 585996965 /nfs/dbraw/zinc/99/69/65/585996965.db2.gz HXXBOJNZONIPSC-UHFFFAOYSA-N 1 2 232.283 2.207 20 0 BEADLO CCC[N@H+](CCF)[C@@H](CC)C(=O)OCC ZINC000792374397 586000538 /nfs/dbraw/zinc/00/05/38/586000538.db2.gz ARLDEKZZEFMIQN-JTQLQIEISA-N 1 2 219.300 2.010 20 0 BEADLO CCC[N@@H+](CCF)[C@@H](CC)C(=O)OCC ZINC000792374397 586000539 /nfs/dbraw/zinc/00/05/39/586000539.db2.gz ARLDEKZZEFMIQN-JTQLQIEISA-N 1 2 219.300 2.010 20 0 BEADLO Cc1coc(C)c1C(=O)OCc1cc[nH+]c(N)c1 ZINC000792780259 586005070 /nfs/dbraw/zinc/00/50/70/586005070.db2.gz CGSXYUWEARJUKQ-UHFFFAOYSA-N 1 2 246.266 2.231 20 0 BEADLO CCn1ccnc1C[NH+]1CCC(F)(F)CC1 ZINC000793361794 586017514 /nfs/dbraw/zinc/01/75/14/586017514.db2.gz LTPKFMQYUYUYTI-UHFFFAOYSA-N 1 2 229.274 2.134 20 0 BEADLO CCn1cc[nH+]c1CN1CCC(F)(F)CC1 ZINC000793361794 586017515 /nfs/dbraw/zinc/01/75/15/586017515.db2.gz LTPKFMQYUYUYTI-UHFFFAOYSA-N 1 2 229.274 2.134 20 0 BEADLO CC[C@H](O)C[N@@H+]1CCn2c(Cl)ccc2[C@H]1C ZINC000794442852 586039710 /nfs/dbraw/zinc/03/97/10/586039710.db2.gz HVOHQQRYIMCIIC-ZJUUUORDSA-N 1 2 242.750 2.289 20 0 BEADLO CC[C@H](O)C[N@H+]1CCn2c(Cl)ccc2[C@H]1C ZINC000794442852 586039711 /nfs/dbraw/zinc/03/97/11/586039711.db2.gz HVOHQQRYIMCIIC-ZJUUUORDSA-N 1 2 242.750 2.289 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OC[C@@H]1CCCO1 ZINC000794517796 586041428 /nfs/dbraw/zinc/04/14/28/586041428.db2.gz GWEHGKPMWOMENO-NSHDSACASA-N 1 2 234.299 2.021 20 0 BEADLO CC(C)CO[C@@H](C)C(N)=[NH+]OCCCCF ZINC000795215531 586072316 /nfs/dbraw/zinc/07/23/16/586072316.db2.gz RUAONWIXLGMQCT-JTQLQIEISA-N 1 2 234.315 2.296 20 0 BEADLO CC(C)c1cnc(CN2CCc3[nH+]c[nH]c3C2)o1 ZINC000859308262 589029912 /nfs/dbraw/zinc/02/99/12/589029912.db2.gz HMGOIMMYZWOGFN-UHFFFAOYSA-N 1 2 246.314 2.079 20 0 BEADLO c1nc(C[N@@H+]2CC[C@@H]2c2ccccc2)c[nH]1 ZINC000796442846 586103488 /nfs/dbraw/zinc/10/34/88/586103488.db2.gz PUPPBIDEZYMSEI-CYBMUJFWSA-N 1 2 213.284 2.357 20 0 BEADLO c1nc(C[N@H+]2CC[C@@H]2c2ccccc2)c[nH]1 ZINC000796442846 586103489 /nfs/dbraw/zinc/10/34/89/586103489.db2.gz PUPPBIDEZYMSEI-CYBMUJFWSA-N 1 2 213.284 2.357 20 0 BEADLO c1ncc(C[N@@H+]2CC[C@@H]2c2ccccc2)[nH]1 ZINC000796442846 586103490 /nfs/dbraw/zinc/10/34/90/586103490.db2.gz PUPPBIDEZYMSEI-CYBMUJFWSA-N 1 2 213.284 2.357 20 0 BEADLO c1ncc(C[N@H+]2CC[C@@H]2c2ccccc2)[nH]1 ZINC000796442846 586103491 /nfs/dbraw/zinc/10/34/91/586103491.db2.gz PUPPBIDEZYMSEI-CYBMUJFWSA-N 1 2 213.284 2.357 20 0 BEADLO CCCCOC(=O)[C@@H](C)[NH+]1CCC(F)(F)CC1 ZINC000796541617 586106301 /nfs/dbraw/zinc/10/63/01/586106301.db2.gz VOTBZDKOAWRONQ-SNVBAGLBSA-N 1 2 249.301 2.449 20 0 BEADLO CCc1noc([C@H](C)[NH+]2CCC(F)(F)CC2)n1 ZINC000796542260 586106508 /nfs/dbraw/zinc/10/65/08/586106508.db2.gz DDRNEJQKBVWAQQ-QMMMGPOBSA-N 1 2 245.273 2.424 20 0 BEADLO FC1(F)CC[NH+](Cc2nnc(C3CC3)o2)CC1 ZINC000796542921 586106870 /nfs/dbraw/zinc/10/68/70/586106870.db2.gz LZJZIEQPQFWRSG-UHFFFAOYSA-N 1 2 243.257 2.178 20 0 BEADLO CC(C)c1cc(CN[C@H](C)c2[nH]cc[nH+]2)on1 ZINC000796760304 586111652 /nfs/dbraw/zinc/11/16/52/586111652.db2.gz KHAQUGMHUYWSQA-SECBINFHSA-N 1 2 234.303 2.372 20 0 BEADLO CC(C)c1cc(C[NH2+][C@H](C)c2ncc[nH]2)on1 ZINC000796760304 586111653 /nfs/dbraw/zinc/11/16/53/586111653.db2.gz KHAQUGMHUYWSQA-SECBINFHSA-N 1 2 234.303 2.372 20 0 BEADLO Cc1noc(C)c1[C@H](C)[NH2+][C@@H](C)c1ncc[nH]1 ZINC000796764881 586111745 /nfs/dbraw/zinc/11/17/45/586111745.db2.gz VSRIAIXFWSMXPH-CBAPKCEASA-N 1 2 234.303 2.426 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCCc2[nH]ncc21)c1ccc[nH]1 ZINC000796845213 586114562 /nfs/dbraw/zinc/11/45/62/586114562.db2.gz HDHVGCNRDVHKPS-BXKDBHETSA-N 1 2 230.315 2.466 20 0 BEADLO C[C@@H](Nc1cccc2c1OCO2)c1[nH]cc[nH+]1 ZINC000796940281 586117339 /nfs/dbraw/zinc/11/73/39/586117339.db2.gz YAVJRRRSCHALTR-MRVPVSSYSA-N 1 2 231.255 2.312 20 0 BEADLO c1n[nH]c2c1[C@H]([NH2+]CCOCC1CCC1)CCC2 ZINC000796940408 586117393 /nfs/dbraw/zinc/11/73/93/586117393.db2.gz HKYOFJGGEBWIQZ-CYBMUJFWSA-N 1 2 249.358 2.193 20 0 BEADLO C[C@H](Nc1cccc2c1OCO2)c1[nH]cc[nH+]1 ZINC000796940283 586117474 /nfs/dbraw/zinc/11/74/74/586117474.db2.gz YAVJRRRSCHALTR-QMMMGPOBSA-N 1 2 231.255 2.312 20 0 BEADLO Cc1cc[nH]c1C(=O)Nc1cccc2[nH+]ccn21 ZINC000798110821 586137264 /nfs/dbraw/zinc/13/72/64/586137264.db2.gz NKGRRAOQJKRLJS-UHFFFAOYSA-N 1 2 240.266 2.223 20 0 BEADLO Cc1cc(N2CC[C@H](c3ccccn3)C2)nc[nH+]1 ZINC000798414799 586143713 /nfs/dbraw/zinc/14/37/13/586143713.db2.gz BHOMZFZKMKMNHP-LBPRGKRZSA-N 1 2 240.310 2.174 20 0 BEADLO Cc1nn(C(C)C)cc1C[NH2+]Cc1ccon1 ZINC000798492270 586144078 /nfs/dbraw/zinc/14/40/78/586144078.db2.gz BPBJDZRFFHYPLL-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO CCCc1occc1C(=O)OCCn1cc[nH+]c1 ZINC000798713706 586148833 /nfs/dbraw/zinc/14/88/33/586148833.db2.gz HPENQBOOSISQPA-UHFFFAOYSA-N 1 2 248.282 2.286 20 0 BEADLO C[C@@H]1C[C@H]1COC(=O)[C@H](c1ccccc1)[NH+](C)C ZINC000798820558 586150605 /nfs/dbraw/zinc/15/06/05/586150605.db2.gz JECRTCVGPCIDBG-XBFCOCLRSA-N 1 2 247.338 2.489 20 0 BEADLO C[C@@H]1C[C@@H]1COC(=O)[C@H](c1ccccc1)[NH+](C)C ZINC000798820555 586150724 /nfs/dbraw/zinc/15/07/24/586150724.db2.gz JECRTCVGPCIDBG-BNOWGMLFSA-N 1 2 247.338 2.489 20 0 BEADLO Fc1cncc([C@H]([NH2+]Cc2ccon2)C2CC2)c1 ZINC000798929105 586154043 /nfs/dbraw/zinc/15/40/43/586154043.db2.gz LNBXBVRRIXOUOL-CYBMUJFWSA-N 1 2 247.273 2.450 20 0 BEADLO CS[C@H]1CC[N@H+](Cc2cc(Cl)n(C)n2)C1 ZINC000859322206 589031541 /nfs/dbraw/zinc/03/15/41/589031541.db2.gz LDCXNFKHCWIANR-VIFPVBQESA-N 1 2 245.779 2.011 20 0 BEADLO CS[C@H]1CC[N@@H+](Cc2cc(Cl)n(C)n2)C1 ZINC000859322206 589031542 /nfs/dbraw/zinc/03/15/42/589031542.db2.gz LDCXNFKHCWIANR-VIFPVBQESA-N 1 2 245.779 2.011 20 0 BEADLO OCC[C@H](Cc1ccccc1)Nc1cccc[nH+]1 ZINC000799332103 586171646 /nfs/dbraw/zinc/17/16/46/586171646.db2.gz UFPMGRBDQLVNDD-CQSZACIVSA-N 1 2 242.322 2.487 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2CCC=CO2)c(C)[nH+]1 ZINC000799683392 586191796 /nfs/dbraw/zinc/19/17/96/586191796.db2.gz OTFCVDDVJHLHNX-GFCCVEGCSA-N 1 2 232.283 2.330 20 0 BEADLO FC(F)[C@H]1CCCC[N@@H+]1CCC1OCCCO1 ZINC000800447572 586220054 /nfs/dbraw/zinc/22/00/54/586220054.db2.gz IXDPMKQFECJVGP-SNVBAGLBSA-N 1 2 249.301 2.259 20 0 BEADLO FC(F)[C@H]1CCCC[N@H+]1CCC1OCCCO1 ZINC000800447572 586220056 /nfs/dbraw/zinc/22/00/56/586220056.db2.gz IXDPMKQFECJVGP-SNVBAGLBSA-N 1 2 249.301 2.259 20 0 BEADLO Oc1ccc2c(c1)C[N@@H+](C/C=C\Cl)C2 ZINC000859475831 589040012 /nfs/dbraw/zinc/04/00/12/589040012.db2.gz KCSGUPALEISYEO-RJRFIUFISA-N 1 2 209.676 2.460 20 0 BEADLO Oc1ccc2c(c1)C[N@H+](C/C=C\Cl)C2 ZINC000859475831 589040014 /nfs/dbraw/zinc/04/00/14/589040014.db2.gz KCSGUPALEISYEO-RJRFIUFISA-N 1 2 209.676 2.460 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)O[C@H]2CC[N@H+](CCF)C2)C1 ZINC000802234228 586297146 /nfs/dbraw/zinc/29/71/46/586297146.db2.gz BGDDNKMUCZSKNW-WOPDTQHZSA-N 1 2 243.322 2.010 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)O[C@H]2CC[N@@H+](CCF)C2)C1 ZINC000802234228 586297148 /nfs/dbraw/zinc/29/71/48/586297148.db2.gz BGDDNKMUCZSKNW-WOPDTQHZSA-N 1 2 243.322 2.010 20 0 BEADLO CC1(C(=O)O[C@H]2CC[N@H+](CCF)C2)CCCC1 ZINC000802237649 586297350 /nfs/dbraw/zinc/29/73/50/586297350.db2.gz IGBIKLOWTRABPD-NSHDSACASA-N 1 2 243.322 2.154 20 0 BEADLO CC1(C(=O)O[C@H]2CC[N@@H+](CCF)C2)CCCC1 ZINC000802237649 586297352 /nfs/dbraw/zinc/29/73/52/586297352.db2.gz IGBIKLOWTRABPD-NSHDSACASA-N 1 2 243.322 2.154 20 0 BEADLO Cc1ccoc1C[N@@H+]1CCO[C@H](C(F)F)C1 ZINC000802653785 586307558 /nfs/dbraw/zinc/30/75/58/586307558.db2.gz SPAWPLDWZQWAIH-JTQLQIEISA-N 1 2 231.242 2.054 20 0 BEADLO Cc1ccoc1C[N@H+]1CCO[C@H](C(F)F)C1 ZINC000802653785 586307560 /nfs/dbraw/zinc/30/75/60/586307560.db2.gz SPAWPLDWZQWAIH-JTQLQIEISA-N 1 2 231.242 2.054 20 0 BEADLO C[C@H]1CCN(C[N@@H+]2Cc3ccccc3[C@@H]2C)C1=O ZINC000840020365 586383063 /nfs/dbraw/zinc/38/30/63/586383063.db2.gz ZSUILELLHMFBTE-RYUDHWBXSA-N 1 2 244.338 2.389 20 0 BEADLO C[C@H]1CCN(C[N@H+]2Cc3ccccc3[C@@H]2C)C1=O ZINC000840020365 586383064 /nfs/dbraw/zinc/38/30/64/586383064.db2.gz ZSUILELLHMFBTE-RYUDHWBXSA-N 1 2 244.338 2.389 20 0 BEADLO CCC/C(C)=C\C(=O)N[C@H]1CCc2c[nH+]cn2C1 ZINC000804335650 586391386 /nfs/dbraw/zinc/39/13/86/586391386.db2.gz CSZLQOYHTUMSQG-RDQDRAATSA-N 1 2 247.342 2.061 20 0 BEADLO c1cc2cc(NC[C@@H]3CCCOC3)[nH+]cc2[nH]1 ZINC000804365182 586392953 /nfs/dbraw/zinc/39/29/53/586392953.db2.gz HAGKAAYJHOLGSZ-JTQLQIEISA-N 1 2 231.299 2.401 20 0 BEADLO CC[C@@H](Nc1ncc(SC)cn1)c1[nH]cc[nH+]1 ZINC000804629442 586404213 /nfs/dbraw/zinc/40/42/13/586404213.db2.gz UAUOATRFYVFSGU-SECBINFHSA-N 1 2 249.343 2.485 20 0 BEADLO CC[NH2+]Cc1noc(C[C@@H]2CC[C@@H](C)C2)n1 ZINC000843144985 586436626 /nfs/dbraw/zinc/43/66/26/586436626.db2.gz RBQSUFDDWDZORE-NXEZZACHSA-N 1 2 223.320 2.158 20 0 BEADLO CC[NH2+]Cc1noc(/C=C\c2ccsc2)n1 ZINC000843145099 586444305 /nfs/dbraw/zinc/44/43/05/586444305.db2.gz CVQQTVQQDDDMMA-ARJAWSKDSA-N 1 2 235.312 2.411 20 0 BEADLO CC[C@@H]1CC(=O)N(C[N@@H+]2CCC[C@@](C)(F)C2)C1 ZINC000840097950 586445735 /nfs/dbraw/zinc/44/57/35/586445735.db2.gz BFTKMINAKUXOKR-DGCLKSJQSA-N 1 2 242.338 2.026 20 0 BEADLO CC[C@@H]1CC(=O)N(C[N@H+]2CCC[C@@](C)(F)C2)C1 ZINC000840097950 586445737 /nfs/dbraw/zinc/44/57/37/586445737.db2.gz BFTKMINAKUXOKR-DGCLKSJQSA-N 1 2 242.338 2.026 20 0 BEADLO C[C@]1(F)CCC[N@H+](Cn2cccnc2=S)C1 ZINC000840101787 586446295 /nfs/dbraw/zinc/44/62/95/586446295.db2.gz VKDIWMNEHSPOPH-NSHDSACASA-N 1 2 241.335 2.394 20 0 BEADLO C[C@]1(F)CCC[N@@H+](Cn2cccnc2=S)C1 ZINC000840101787 586446297 /nfs/dbraw/zinc/44/62/97/586446297.db2.gz VKDIWMNEHSPOPH-NSHDSACASA-N 1 2 241.335 2.394 20 0 BEADLO COc1ccc(C)cc1C[NH2+]Cc1cn(C)cn1 ZINC000808377000 586470156 /nfs/dbraw/zinc/47/01/56/586470156.db2.gz GYEZTBPEUWNNJF-UHFFFAOYSA-N 1 2 245.326 2.027 20 0 BEADLO COc1ccc(F)cc1NCc1cn(C)c[nH+]1 ZINC000808402515 586471521 /nfs/dbraw/zinc/47/15/21/586471521.db2.gz WENQGFXJAUOUNP-UHFFFAOYSA-N 1 2 235.262 2.180 20 0 BEADLO CC(C)=CCOC(=O)CCc1ccc(N)[nH+]c1 ZINC000808528645 586477868 /nfs/dbraw/zinc/47/78/68/586477868.db2.gz JROQTKTZDCQTHJ-UHFFFAOYSA-N 1 2 234.299 2.106 20 0 BEADLO Cc1cc(NC(=O)C2(F)CCCCC2)cc[nH+]1 ZINC000809987030 586528602 /nfs/dbraw/zinc/52/86/02/586528602.db2.gz SXFWXERHALIJNJ-UHFFFAOYSA-N 1 2 236.290 2.423 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCC[C@H]2c2cc[nH]n2)o1 ZINC000809996281 586530092 /nfs/dbraw/zinc/53/00/92/586530092.db2.gz WFCLAMAWUBDOSE-LBPRGKRZSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCC[C@H]2c2cc[nH]n2)o1 ZINC000809996281 586530094 /nfs/dbraw/zinc/53/00/94/586530094.db2.gz WFCLAMAWUBDOSE-LBPRGKRZSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C1(F)CCCCC1 ZINC000810467158 586539648 /nfs/dbraw/zinc/53/96/48/586539648.db2.gz WQRCWBLCMDLDHU-UHFFFAOYSA-N 1 2 239.294 2.007 20 0 BEADLO Cc1ccc(COCc2[nH]cc[nH+]2)c(Cl)n1 ZINC000840204176 586541128 /nfs/dbraw/zinc/54/11/28/586541128.db2.gz UIOOKKRKTSSETR-UHFFFAOYSA-N 1 2 237.690 2.483 20 0 BEADLO Cc1cc(C(=O)NCc2c[nH+]cn2C)c(C)s1 ZINC000810754973 586546294 /nfs/dbraw/zinc/54/62/94/586546294.db2.gz JULUXFQUAIHUBE-UHFFFAOYSA-N 1 2 249.339 2.028 20 0 BEADLO Cc1ccc(C[N@@H+](C)[C@@H]2CC(C)(C)OC2=O)o1 ZINC000814179972 586615717 /nfs/dbraw/zinc/61/57/17/586615717.db2.gz LCQJCDINICLLEH-LLVKDONJSA-N 1 2 237.299 2.114 20 0 BEADLO Cc1ccc(C[N@H+](C)[C@@H]2CC(C)(C)OC2=O)o1 ZINC000814179972 586615718 /nfs/dbraw/zinc/61/57/18/586615718.db2.gz LCQJCDINICLLEH-LLVKDONJSA-N 1 2 237.299 2.114 20 0 BEADLO Cc1ccc(C[N@@H+](C)[C@H]2CC(C)(C)OC2=O)o1 ZINC000814179973 586615914 /nfs/dbraw/zinc/61/59/14/586615914.db2.gz LCQJCDINICLLEH-NSHDSACASA-N 1 2 237.299 2.114 20 0 BEADLO Cc1ccc(C[N@H+](C)[C@H]2CC(C)(C)OC2=O)o1 ZINC000814179973 586615915 /nfs/dbraw/zinc/61/59/15/586615915.db2.gz LCQJCDINICLLEH-NSHDSACASA-N 1 2 237.299 2.114 20 0 BEADLO O=C(NC1=[NH+]CCS1)[C@@H]1CC2CCC1CC2 ZINC000814255855 586620724 /nfs/dbraw/zinc/62/07/24/586620724.db2.gz BMWFBVQSMPBGES-UDNWOFFPSA-N 1 2 238.356 2.032 20 0 BEADLO NC(Cc1cccc(F)c1)=[NH+]OC1CCC1 ZINC000814265584 586620857 /nfs/dbraw/zinc/62/08/57/586620857.db2.gz NWNRRYBNUPJYID-UHFFFAOYSA-N 1 2 222.263 2.419 20 0 BEADLO NC(COc1ccccc1F)=[NH+]OC1CCC1 ZINC000814265970 586620884 /nfs/dbraw/zinc/62/08/84/586620884.db2.gz UEEZLLLVAGZZSF-UHFFFAOYSA-N 1 2 238.262 2.255 20 0 BEADLO CC(C)CO[C@H](C)C(N)=[NH+]OC1CCC1 ZINC000814265062 586621045 /nfs/dbraw/zinc/62/10/45/586621045.db2.gz MLOCMBUIKKAIHJ-SECBINFHSA-N 1 2 214.309 2.098 20 0 BEADLO CCC(=CC(=O)NCc1c[nH+]ccc1OC)CC ZINC000814327664 586621532 /nfs/dbraw/zinc/62/15/32/586621532.db2.gz OTFWWTBVAFNRPE-UHFFFAOYSA-N 1 2 248.326 2.453 20 0 BEADLO Cc1cc(NCc2ncccn2)nc(C2CC2)[nH+]1 ZINC000840325644 586630546 /nfs/dbraw/zinc/63/05/46/586630546.db2.gz KBNQBEZPLRKRSI-UHFFFAOYSA-N 1 2 241.298 2.065 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)OC[C@H]3C[C@@H]3C)ccn12 ZINC000859734466 589057807 /nfs/dbraw/zinc/05/78/07/589057807.db2.gz CCKPGNIXJKKZLW-JOYOIKCWSA-N 1 2 244.294 2.456 20 0 BEADLO Cc1[nH]c2ccc(NC(=O)C(C)(F)F)cc2[nH+]1 ZINC000814850884 586638963 /nfs/dbraw/zinc/63/89/63/586638963.db2.gz AFLBCXYASUFNPL-UHFFFAOYSA-N 1 2 239.225 2.465 20 0 BEADLO CCCCOC(=O)[C@H](C)[NH2+]C(C)(C)COCC ZINC000815136556 586667049 /nfs/dbraw/zinc/66/70/49/586667049.db2.gz GMMYLMFMEAESLZ-NSHDSACASA-N 1 2 245.363 2.123 20 0 BEADLO CCn1ccnc1[C@H]1CCCC[N@@H+]1CCF ZINC000815107772 586667474 /nfs/dbraw/zinc/66/74/74/586667474.db2.gz UDMRSGBCFBARNU-LLVKDONJSA-N 1 2 225.311 2.400 20 0 BEADLO CCn1ccnc1[C@H]1CCCC[N@H+]1CCF ZINC000815107772 586667475 /nfs/dbraw/zinc/66/74/75/586667475.db2.gz UDMRSGBCFBARNU-LLVKDONJSA-N 1 2 225.311 2.400 20 0 BEADLO CCn1cc[nH+]c1[C@H]1CCCCN1CCF ZINC000815107772 586667476 /nfs/dbraw/zinc/66/74/76/586667476.db2.gz UDMRSGBCFBARNU-LLVKDONJSA-N 1 2 225.311 2.400 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nnc(C(C)(C)C)o2)[C@@H]1C ZINC000815162001 586671395 /nfs/dbraw/zinc/67/13/95/586671395.db2.gz FYUPPFBWLPEFTG-RKDXNWHRSA-N 1 2 223.320 2.207 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nnc(C(C)(C)C)o2)[C@@H]1C ZINC000815162001 586671397 /nfs/dbraw/zinc/67/13/97/586671397.db2.gz FYUPPFBWLPEFTG-RKDXNWHRSA-N 1 2 223.320 2.207 20 0 BEADLO Cc1[nH+]c(C(C)C)ccc1COC(=O)C1COC1 ZINC000815235805 586675253 /nfs/dbraw/zinc/67/52/53/586675253.db2.gz GHPHFUPOTHZKSI-UHFFFAOYSA-N 1 2 249.310 2.203 20 0 BEADLO C[C@H]1CSCC[N@@H+]1Cc1cnn(C)c1Cl ZINC000816511704 586737488 /nfs/dbraw/zinc/73/74/88/586737488.db2.gz IKHQQURYFIQCPA-QMMMGPOBSA-N 1 2 245.779 2.011 20 0 BEADLO C[C@H]1CSCC[N@H+]1Cc1cnn(C)c1Cl ZINC000816511704 586737489 /nfs/dbraw/zinc/73/74/89/586737489.db2.gz IKHQQURYFIQCPA-QMMMGPOBSA-N 1 2 245.779 2.011 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1cc(C)nc(Cl)c1 ZINC000816636680 586745791 /nfs/dbraw/zinc/74/57/91/586745791.db2.gz FBDIEBMBDCLKAJ-LLVKDONJSA-N 1 2 240.734 2.264 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1cc(C)nc(Cl)c1 ZINC000816636680 586745793 /nfs/dbraw/zinc/74/57/93/586745793.db2.gz FBDIEBMBDCLKAJ-LLVKDONJSA-N 1 2 240.734 2.264 20 0 BEADLO Cc1ccc(NC(=O)Cc2[nH]cc[nH+]2)cc1F ZINC000816820314 586766276 /nfs/dbraw/zinc/76/62/76/586766276.db2.gz IFUMSOZWSPMHTP-UHFFFAOYSA-N 1 2 233.246 2.038 20 0 BEADLO CCN(Cc1cccs1)C(=O)Cc1[nH]cc[nH+]1 ZINC000816845674 586768347 /nfs/dbraw/zinc/76/83/47/586768347.db2.gz YSFBQOIJLMGTEB-UHFFFAOYSA-N 1 2 249.339 2.062 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)NCCC1CCCCC1 ZINC000816861362 586769052 /nfs/dbraw/zinc/76/90/52/586769052.db2.gz VBPDFLOREODNRK-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)NCC1CCCCCCC1 ZINC000816894078 586769352 /nfs/dbraw/zinc/76/93/52/586769352.db2.gz OLZIDIURTMLWRJ-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO Cc1cc(CNC(=O)N2CCCCC2)cc(C)[nH+]1 ZINC000817388083 586800030 /nfs/dbraw/zinc/80/00/30/586800030.db2.gz AFJYFSYFTMTWLT-UHFFFAOYSA-N 1 2 247.342 2.394 20 0 BEADLO CCn1cnnc1SCCc1cc[nH+]cc1C ZINC000817577597 586812670 /nfs/dbraw/zinc/81/26/70/586812670.db2.gz CHQKODMPVQPVHI-UHFFFAOYSA-N 1 2 248.355 2.336 20 0 BEADLO Cc1cc(CNC(=O)[C@H]2CCC=CO2)cc(C)[nH+]1 ZINC000817621380 586814474 /nfs/dbraw/zinc/81/44/74/586814474.db2.gz SQYGWNZVGKTJQQ-CYBMUJFWSA-N 1 2 246.310 2.007 20 0 BEADLO Cn1cnc(C[NH2+][C@H]2C[C@@]2(F)c2ccccc2)c1 ZINC000818229934 586880453 /nfs/dbraw/zinc/88/04/53/586880453.db2.gz IMGMUZVDUKWIFM-UONOGXRCSA-N 1 2 245.301 2.147 20 0 BEADLO Cc1ccccc1[C@@H](O)C[NH2+]CC(C)(F)F ZINC000819332071 586953075 /nfs/dbraw/zinc/95/30/75/586953075.db2.gz JEPDKNIGKLRPAU-NSHDSACASA-N 1 2 229.270 2.273 20 0 BEADLO O=C(C(F)=C1CCC1)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000819456080 586965827 /nfs/dbraw/zinc/96/58/27/586965827.db2.gz IUXMYLCNEGVVOO-SNVBAGLBSA-N 1 2 249.289 2.481 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)C2CCCCC2)S1 ZINC000819758954 586990409 /nfs/dbraw/zinc/99/04/09/586990409.db2.gz CGULSZAGWNPNGP-QMMMGPOBSA-N 1 2 226.345 2.174 20 0 BEADLO C[C@@H](CC(=O)NC1=[NH+]C[C@@H](C)S1)C1CC1 ZINC000819766432 586991710 /nfs/dbraw/zinc/99/17/10/586991710.db2.gz OGJFVNHVXUFCAM-JGVFFNPUSA-N 1 2 226.345 2.030 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)[C@@H]2CCC(C)(C)C2)S1 ZINC000819775639 586992413 /nfs/dbraw/zinc/99/24/13/586992413.db2.gz IRZNCFVRDXCONO-RKDXNWHRSA-N 1 2 240.372 2.420 20 0 BEADLO CC/C(C)=C(/C)C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819777915 586992923 /nfs/dbraw/zinc/99/29/23/586992923.db2.gz WHINDJJIBANVMH-XZZQCUQZSA-N 1 2 226.345 2.340 20 0 BEADLO CC[C@@H](C)CC(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819779928 586994093 /nfs/dbraw/zinc/99/40/93/586994093.db2.gz BJTPZAVSZLKBFO-SFYZADRCSA-N 1 2 214.334 2.030 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)CC(C)(C)C2CC2)S1 ZINC000819780716 586994243 /nfs/dbraw/zinc/99/42/43/586994243.db2.gz IUTMIOHDMDASJS-MRVPVSSYSA-N 1 2 240.372 2.420 20 0 BEADLO CC=C(C=CC(=O)N1CCc2[nH]c[nH+]c2C1)CC ZINC000819967851 587008813 /nfs/dbraw/zinc/00/88/13/587008813.db2.gz NXNUZPOUICKYLH-BCTKWJPASA-N 1 2 245.326 2.207 20 0 BEADLO CC=C(C=CC(=O)N1CCc2[nH+]c[nH]c2C1)CC ZINC000819967851 587008815 /nfs/dbraw/zinc/00/88/15/587008815.db2.gz NXNUZPOUICKYLH-BCTKWJPASA-N 1 2 245.326 2.207 20 0 BEADLO CCN(CC(C)(C)C)C(=O)/C=C/c1cn(C)c[nH+]1 ZINC000819997550 587012428 /nfs/dbraw/zinc/01/24/28/587012428.db2.gz MBJJUOQRWKYISY-BQYQJAHWSA-N 1 2 249.358 2.328 20 0 BEADLO CC(C(=O)N[C@H](C)c1[nH]cc[nH+]1)=C1CCCC1 ZINC000820267634 587039485 /nfs/dbraw/zinc/03/94/85/587039485.db2.gz GSGUYELFJQTZPJ-SNVBAGLBSA-N 1 2 233.315 2.477 20 0 BEADLO C[C@H]1CCN(c2nccs2)C[C@@H]1n1cc[nH+]c1 ZINC000820674833 587065276 /nfs/dbraw/zinc/06/52/76/587065276.db2.gz CDEKKPBZBHHOBF-QWRGUYRKSA-N 1 2 248.355 2.427 20 0 BEADLO CCC1(NC(=O)/C=C/c2cn(C)c[nH+]2)CCCC1 ZINC000821141856 587098312 /nfs/dbraw/zinc/09/83/12/587098312.db2.gz ANQRVOXYYUKFOP-VOTSOKGWSA-N 1 2 247.342 2.272 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)C1(C)CC=CC1 ZINC000821306803 587106448 /nfs/dbraw/zinc/10/64/48/587106448.db2.gz BIUMXIZTAUGUDD-LLVKDONJSA-N 1 2 247.342 2.437 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)C(F)=C1CCC1 ZINC000821370913 587113396 /nfs/dbraw/zinc/11/33/96/587113396.db2.gz RVXCSNTUPGQZTL-UHFFFAOYSA-N 1 2 238.262 2.224 20 0 BEADLO FC1=CCC[N@H+](Cc2ccc3nonc3c2)C1 ZINC000821402036 587117343 /nfs/dbraw/zinc/11/73/43/587117343.db2.gz LJAMRMHMVSJFMU-UHFFFAOYSA-N 1 2 233.246 2.282 20 0 BEADLO FC1=CCC[N@@H+](Cc2ccc3nonc3c2)C1 ZINC000821402036 587117344 /nfs/dbraw/zinc/11/73/44/587117344.db2.gz LJAMRMHMVSJFMU-UHFFFAOYSA-N 1 2 233.246 2.282 20 0 BEADLO O=C(OCc1ccc[nH+]c1N1CCCC1)C1CC1 ZINC000821609268 587132406 /nfs/dbraw/zinc/13/24/06/587132406.db2.gz PMBNNUDKHOPIII-UHFFFAOYSA-N 1 2 246.310 2.135 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)[C@]2(C)C=CCC2)c2[nH+]ccn21 ZINC000821786944 587138084 /nfs/dbraw/zinc/13/80/84/587138084.db2.gz PJNURRMEIMXTRH-JTNHKYCSSA-N 1 2 245.326 2.361 20 0 BEADLO Cc1ccc(-c2nn[nH]n2)c(NCCC(C)C)[nH+]1 ZINC000822215290 587158568 /nfs/dbraw/zinc/15/85/68/587158568.db2.gz UVKMMJINOLZGGF-UHFFFAOYSA-N 1 2 246.318 2.028 20 0 BEADLO C[C@@H]1CCC[C@@]1(C)C(=O)NC1=[NH+]CCS1 ZINC000822234478 587159042 /nfs/dbraw/zinc/15/90/42/587159042.db2.gz VSVBKUDAUSDUMV-LDYMZIIASA-N 1 2 226.345 2.032 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)NC1=[NH+]CCS1 ZINC000822234390 587159156 /nfs/dbraw/zinc/15/91/56/587159156.db2.gz RNZOIPGZCGQFJB-BDAKNGLRSA-N 1 2 226.345 2.032 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)NC2=[NH+]CCS2)C[C@@H]1C ZINC000822234316 587159296 /nfs/dbraw/zinc/15/92/96/587159296.db2.gz OEEMYTHXEIRDQH-UTLUCORTSA-N 1 2 240.372 2.278 20 0 BEADLO C[C@H](CC(C)(C)C)NC(=O)/C=C/c1cn(C)c[nH+]1 ZINC000822276437 587160236 /nfs/dbraw/zinc/16/02/36/587160236.db2.gz FEYXCRMQOMQQJG-XUIVZRPNSA-N 1 2 249.358 2.374 20 0 BEADLO Cn1c[nH+]c(/C=C/C(=O)N[C@@]2(C)CC=CCC2)c1 ZINC000822492796 587171651 /nfs/dbraw/zinc/17/16/51/587171651.db2.gz IHHHXEWKUGCDLZ-UZYOAWRESA-N 1 2 245.326 2.048 20 0 BEADLO Fc1cc(C[NH+]2CC(CC(F)F)C2)c(F)cn1 ZINC000822520905 587172795 /nfs/dbraw/zinc/17/27/95/587172795.db2.gz RFZJTFICKDGPRO-UHFFFAOYSA-N 1 2 248.223 2.447 20 0 BEADLO Cn1ncc(C[NH+]2CC(CC(F)F)C2)c1Cl ZINC000822520668 587172930 /nfs/dbraw/zinc/17/29/30/587172930.db2.gz LBBKFNBTNLCTMZ-UHFFFAOYSA-N 1 2 249.692 2.161 20 0 BEADLO C[C@H]1COCC[N@@H+]1CC[C@H]1CC1(Cl)Cl ZINC000822579798 587175994 /nfs/dbraw/zinc/17/59/94/587175994.db2.gz JALBLMNBHWLNCC-IUCAKERBSA-N 1 2 238.158 2.291 20 0 BEADLO C[C@H]1COCC[N@H+]1CC[C@H]1CC1(Cl)Cl ZINC000822579798 587175995 /nfs/dbraw/zinc/17/59/95/587175995.db2.gz JALBLMNBHWLNCC-IUCAKERBSA-N 1 2 238.158 2.291 20 0 BEADLO CCC[C@H](CC)C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000823005760 587197526 /nfs/dbraw/zinc/19/75/26/587197526.db2.gz CKJLTJSYQMYUAO-JTQLQIEISA-N 1 2 235.331 2.121 20 0 BEADLO CCC[C@H](CC)C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000823005760 587197527 /nfs/dbraw/zinc/19/75/27/587197527.db2.gz CKJLTJSYQMYUAO-JTQLQIEISA-N 1 2 235.331 2.121 20 0 BEADLO CCc1cccc(C)c1NC(=O)Cc1[nH]cc[nH+]1 ZINC000823012942 587198188 /nfs/dbraw/zinc/19/81/88/587198188.db2.gz RZHQNCYVBKLADV-UHFFFAOYSA-N 1 2 243.310 2.462 20 0 BEADLO CC/C(C)=C/C(=O)N1CC(Oc2cc[nH+]cc2)C1 ZINC000823050518 587199465 /nfs/dbraw/zinc/19/94/65/587199465.db2.gz BPQIMPYCXBGRIX-DHZHZOJOSA-N 1 2 246.310 2.028 20 0 BEADLO CCC[C@H](CC)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000823084723 587201946 /nfs/dbraw/zinc/20/19/46/587201946.db2.gz DHPNWTPSORVOCE-ZJUUUORDSA-N 1 2 223.320 2.413 20 0 BEADLO CCC[C@H](CC)C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000823237434 587210298 /nfs/dbraw/zinc/21/02/98/587210298.db2.gz VNOBPHOLWIYUNN-WDEREUQCSA-N 1 2 235.331 2.270 20 0 BEADLO CC(C)=C(C)CC(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000823237353 587210405 /nfs/dbraw/zinc/21/04/05/587210405.db2.gz SRSVJBACUNPWJA-LLVKDONJSA-N 1 2 233.315 2.191 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)N(C1CC1)C1CCCCC1 ZINC000823306056 587215224 /nfs/dbraw/zinc/21/52/24/587215224.db2.gz PPKGBDNBFTVNMH-UHFFFAOYSA-N 1 2 247.342 2.276 20 0 BEADLO CN(CCC(C)(C)C)C(=O)/C=C/c1cn(C)c[nH+]1 ZINC000823522663 587229459 /nfs/dbraw/zinc/22/94/59/587229459.db2.gz LJCBAGNGVSPILM-VOTSOKGWSA-N 1 2 249.358 2.328 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)/C=C\[C@H]1CCCO1 ZINC000823837080 587242385 /nfs/dbraw/zinc/24/23/85/587242385.db2.gz XBGCOWJQWWTKKF-FOQNGQEVSA-N 1 2 246.310 2.372 20 0 BEADLO Cc1cc(C[NH2+]C(CF)CF)cnc1Cl ZINC000824555712 587276304 /nfs/dbraw/zinc/27/63/04/587276304.db2.gz XBGSZSSXJKZRNL-UHFFFAOYSA-N 1 2 234.677 2.441 20 0 BEADLO CCc1nc(C[NH2+]Cc2occc2C)co1 ZINC000825051245 587300591 /nfs/dbraw/zinc/30/05/91/587300591.db2.gz ZUZBBMDQROJJIV-UHFFFAOYSA-N 1 2 220.272 2.428 20 0 BEADLO CC1CCC(C)(NC(=O)Cc2[nH]cc[nH+]2)CC1 ZINC000825113694 587305301 /nfs/dbraw/zinc/30/53/01/587305301.db2.gz IRDQFQQQQKTACZ-UHFFFAOYSA-N 1 2 235.331 2.037 20 0 BEADLO O=C(C[C@@H]1CC=CCC1)N[C@@H]1CCn2c[nH+]cc21 ZINC000825514318 587322709 /nfs/dbraw/zinc/32/27/09/587322709.db2.gz ZWDFRZFQPRCLCP-VXGBXAGGSA-N 1 2 245.326 2.191 20 0 BEADLO Cc1[nH]c(C(=O)NCCCCC2CC2)c[nH+]1 ZINC000825680242 587331739 /nfs/dbraw/zinc/33/17/39/587331739.db2.gz GTKMZYPUOPVYSK-UHFFFAOYSA-N 1 2 221.304 2.028 20 0 BEADLO CC1(C)C[C@]1(C)NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000825684602 587332358 /nfs/dbraw/zinc/33/23/58/587332358.db2.gz YDIQFPMLRVGFGG-AWEZNQCLSA-N 1 2 243.310 2.481 20 0 BEADLO FC1(F)CCN(Cc2c[nH+]c3n2CCC3)CC1 ZINC000825748468 587337054 /nfs/dbraw/zinc/33/70/54/587337054.db2.gz BUFHUBXXYRRMIM-UHFFFAOYSA-N 1 2 241.285 2.060 20 0 BEADLO Cc1[nH]c(C(=O)NCC(C)(C)C(C)(F)F)c[nH+]1 ZINC000825857029 587341758 /nfs/dbraw/zinc/34/17/58/587341758.db2.gz YCRRVBGMVKRDKB-UHFFFAOYSA-N 1 2 245.273 2.129 20 0 BEADLO CCC[C@@H]1CCCC[C@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000825928119 587345825 /nfs/dbraw/zinc/34/58/25/587345825.db2.gz MUQDBYIKUWZOGB-VXGBXAGGSA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@@H](C)C(=O)NC[C@@H]1c2ccccc2C[N@H+]1C ZINC000826731804 587360540 /nfs/dbraw/zinc/36/05/40/587360540.db2.gz ZMXNFLRYTRZERZ-BXUZGUMPSA-N 1 2 246.354 2.335 20 0 BEADLO CC[C@@H](C)C(=O)NC[C@@H]1c2ccccc2C[N@@H+]1C ZINC000826731804 587360541 /nfs/dbraw/zinc/36/05/41/587360541.db2.gz ZMXNFLRYTRZERZ-BXUZGUMPSA-N 1 2 246.354 2.335 20 0 BEADLO COCC[N@H+](CCF)Cc1ccc(Cl)o1 ZINC000827060378 587369414 /nfs/dbraw/zinc/36/94/14/587369414.db2.gz GSQFPHIWTPLQKV-UHFFFAOYSA-N 1 2 235.686 2.351 20 0 BEADLO COCC[N@@H+](CCF)Cc1ccc(Cl)o1 ZINC000827060378 587369415 /nfs/dbraw/zinc/36/94/15/587369415.db2.gz GSQFPHIWTPLQKV-UHFFFAOYSA-N 1 2 235.686 2.351 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC000827556745 587388163 /nfs/dbraw/zinc/38/81/63/587388163.db2.gz CDVJUGYOIQAVLA-GHMZBOCLSA-N 1 2 247.342 2.441 20 0 BEADLO Cc1ccc([N@H+](C)C[C@H]2CCNC(=O)CC2)cc1 ZINC000827641077 587393899 /nfs/dbraw/zinc/39/38/99/587393899.db2.gz HORAWGDVIZKSJC-CYBMUJFWSA-N 1 2 246.354 2.348 20 0 BEADLO Cc1ccc([N@@H+](C)C[C@H]2CCNC(=O)CC2)cc1 ZINC000827641077 587393900 /nfs/dbraw/zinc/39/39/00/587393900.db2.gz HORAWGDVIZKSJC-CYBMUJFWSA-N 1 2 246.354 2.348 20 0 BEADLO Cc1cccc2c1CC[N@H+](Cc1cnns1)C2 ZINC000827685644 587396481 /nfs/dbraw/zinc/39/64/81/587396481.db2.gz PWFPRIWQAPEZFV-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cccc2c1CC[N@@H+](Cc1cnns1)C2 ZINC000827685644 587396483 /nfs/dbraw/zinc/39/64/83/587396483.db2.gz PWFPRIWQAPEZFV-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO CC[C@H](C)[C@@H]([NH2+]CC1=CCCC1)C(=O)OC ZINC000828236141 587426927 /nfs/dbraw/zinc/42/69/27/587426927.db2.gz ZDDZWKSSGAIQTB-CMPLNLGQSA-N 1 2 225.332 2.274 20 0 BEADLO CC[C@H](C)[C@@H]1CCCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC000828276426 587430803 /nfs/dbraw/zinc/43/08/03/587430803.db2.gz KLVRWFZPNQUCHD-RYUDHWBXSA-N 1 2 249.358 2.379 20 0 BEADLO Cc1nocc1C(=O)OCc1ccc(C)[nH+]c1C ZINC000860432780 589099542 /nfs/dbraw/zinc/09/95/42/589099542.db2.gz JMENCXFSZZXUJZ-UHFFFAOYSA-N 1 2 246.266 2.352 20 0 BEADLO CC1(C)CC[N@@H+]1Cc1nnc(C2CC2)s1 ZINC000828334557 587436484 /nfs/dbraw/zinc/43/64/84/587436484.db2.gz UHYUNLXNBHLVCD-UHFFFAOYSA-N 1 2 223.345 2.400 20 0 BEADLO CC1(C)CC[N@H+]1Cc1nnc(C2CC2)s1 ZINC000828334557 587436485 /nfs/dbraw/zinc/43/64/85/587436485.db2.gz UHYUNLXNBHLVCD-UHFFFAOYSA-N 1 2 223.345 2.400 20 0 BEADLO CC[C@H]1CCC[C@@H](NC(=O)Cc2[nH]cc[nH+]2)C1 ZINC000828507484 587445884 /nfs/dbraw/zinc/44/58/84/587445884.db2.gz ZBRKRXSFVAIAQB-WDEREUQCSA-N 1 2 235.331 2.037 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)N[C@@H]1CC[C@@H]2CCC[C@@H]2C1 ZINC000828794663 587462327 /nfs/dbraw/zinc/46/23/27/587462327.db2.gz ISHJJPCFHOSCMY-QJPTWQEYSA-N 1 2 247.342 2.037 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)N[C@@H]1CC[C@H]2CCC[C@@H]2C1 ZINC000828794662 587462423 /nfs/dbraw/zinc/46/24/23/587462423.db2.gz ISHJJPCFHOSCMY-IJLUTSLNSA-N 1 2 247.342 2.037 20 0 BEADLO CCc1nc(CNc2cccc[nH+]2)co1 ZINC000829177693 587486909 /nfs/dbraw/zinc/48/69/09/587486909.db2.gz GINATTQQNURZBC-UHFFFAOYSA-N 1 2 203.245 2.244 20 0 BEADLO CC/C(C)=C\C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000829542045 587502959 /nfs/dbraw/zinc/50/29/59/587502959.db2.gz FJKDGXAJDDHDNC-QROTZFDESA-N 1 2 221.304 2.333 20 0 BEADLO CCC(C)=CC(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000829542045 587502960 /nfs/dbraw/zinc/50/29/60/587502960.db2.gz FJKDGXAJDDHDNC-QROTZFDESA-N 1 2 221.304 2.333 20 0 BEADLO CC(C)C[C@H]1CCCN(C(=O)Cc2[nH]cc[nH+]2)C1 ZINC000830100474 587535821 /nfs/dbraw/zinc/53/58/21/587535821.db2.gz YJYVZGARVLAKSR-GFCCVEGCSA-N 1 2 249.358 2.237 20 0 BEADLO CC(C)C[C@@H]1CCCN(C(=O)Cc2[nH]cc[nH+]2)C1 ZINC000830100475 587535866 /nfs/dbraw/zinc/53/58/66/587535866.db2.gz YJYVZGARVLAKSR-LBPRGKRZSA-N 1 2 249.358 2.237 20 0 BEADLO F[C@H]1CC[N@H+](Cc2cccc3nsnc32)C1 ZINC000830474728 587553600 /nfs/dbraw/zinc/55/36/00/587553600.db2.gz PXEXUKPNGBCBJS-VIFPVBQESA-N 1 2 237.303 2.235 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2cccc3nsnc32)C1 ZINC000830474728 587553602 /nfs/dbraw/zinc/55/36/02/587553602.db2.gz PXEXUKPNGBCBJS-VIFPVBQESA-N 1 2 237.303 2.235 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)C1CC2(CCC2)C1 ZINC000830622700 587561105 /nfs/dbraw/zinc/56/11/05/587561105.db2.gz PONIJCKXTXVQRP-UHFFFAOYSA-N 1 2 248.326 2.086 20 0 BEADLO O=C1C[C@@H](Oc2ccc([NH2+]C3CCCC3)cc2)N1 ZINC000830633788 587561996 /nfs/dbraw/zinc/56/19/96/587561996.db2.gz ZXYNEIOHVTXYBY-CQSZACIVSA-N 1 2 246.310 2.266 20 0 BEADLO CC(C)c1cccnc1NC(=O)Cc1[nH]cc[nH+]1 ZINC000831012631 587583003 /nfs/dbraw/zinc/58/30/03/587583003.db2.gz PCEKLHBDDRTQFF-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO O[C@@H](C[N@@H+]1CC[C@H](F)C1)c1ccccc1Cl ZINC000831196286 587591266 /nfs/dbraw/zinc/59/12/66/587591266.db2.gz UMYMAECKWBMKNT-CABZTGNLSA-N 1 2 243.709 2.417 20 0 BEADLO O[C@@H](C[N@H+]1CC[C@H](F)C1)c1ccccc1Cl ZINC000831196286 587591268 /nfs/dbraw/zinc/59/12/68/587591268.db2.gz UMYMAECKWBMKNT-CABZTGNLSA-N 1 2 243.709 2.417 20 0 BEADLO CO[C@H]1CC[N@H+](CC(F)(F)C(F)F)C[C@@H]1C ZINC000831528340 587616805 /nfs/dbraw/zinc/61/68/05/587616805.db2.gz NTLYEALVAGHAIA-YUMQZZPRSA-N 1 2 243.244 2.244 20 0 BEADLO CO[C@H]1CC[N@@H+](CC(F)(F)C(F)F)C[C@@H]1C ZINC000831528340 587616806 /nfs/dbraw/zinc/61/68/06/587616806.db2.gz NTLYEALVAGHAIA-YUMQZZPRSA-N 1 2 243.244 2.244 20 0 BEADLO O=C([C@H]1C[C@H]2C[C@H]2C1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000831607641 587623344 /nfs/dbraw/zinc/62/33/44/587623344.db2.gz UTKLEWRNYQFILA-QCNOEVLYSA-N 1 2 245.326 2.119 20 0 BEADLO CC1(CNC(=O)Cc2[nH]cc[nH+]2)CCCCCC1 ZINC000831738908 587629751 /nfs/dbraw/zinc/62/97/51/587629751.db2.gz IRRYTUZIDLYNPI-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO CCCONC(=O)Nc1c(C)cc[nH+]c1C ZINC000831793769 587632467 /nfs/dbraw/zinc/63/24/67/587632467.db2.gz YGBWNBBXDKQPTB-UHFFFAOYSA-N 1 2 223.276 2.162 20 0 BEADLO O=C(N[C@@H]1CCn2cc[nH+]c21)C1=CCCCCC1 ZINC000833271299 587703286 /nfs/dbraw/zinc/70/32/86/587703286.db2.gz GELARPPOYPYNRL-GFCCVEGCSA-N 1 2 245.326 2.335 20 0 BEADLO CC[C@H](C)CCC(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833271637 587703558 /nfs/dbraw/zinc/70/35/58/587703558.db2.gz IMUXTZYRAMKXCK-WDEREUQCSA-N 1 2 235.331 2.270 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833272799 587704062 /nfs/dbraw/zinc/70/40/62/587704062.db2.gz SOZZPPCXAQUFQR-IJLUTSLNSA-N 1 2 247.342 2.126 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833278754 587704087 /nfs/dbraw/zinc/70/40/87/587704087.db2.gz VBTLOLSTXSUQDB-GARJFASQSA-N 1 2 235.331 2.126 20 0 BEADLO CC1(C)CC[C@H](C(=O)N[C@@H]2CCn3cc[nH+]c32)C1 ZINC000833277943 587704157 /nfs/dbraw/zinc/70/41/57/587704157.db2.gz KJUVHRXTQXLOAI-WDEREUQCSA-N 1 2 247.342 2.270 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833278225 587704254 /nfs/dbraw/zinc/70/42/54/587704254.db2.gz PNQPSBMEQCZAAL-WDMOLILDSA-N 1 2 247.342 2.126 20 0 BEADLO Cc1sccc1C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833272219 587704278 /nfs/dbraw/zinc/70/42/78/587704278.db2.gz MTDFPWFLIKTPEY-JTQLQIEISA-N 1 2 247.323 2.128 20 0 BEADLO Cc1sccc1C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833272221 587704320 /nfs/dbraw/zinc/70/43/20/587704320.db2.gz MTDFPWFLIKTPEY-SNVBAGLBSA-N 1 2 247.323 2.128 20 0 BEADLO CCC1(C(=O)N[C@H]2CCn3cc[nH+]c32)CCC1 ZINC000833283172 587704429 /nfs/dbraw/zinc/70/44/29/587704429.db2.gz AMUVUYXDIMWDAM-JTQLQIEISA-N 1 2 233.315 2.024 20 0 BEADLO C/C(=C\C(=O)N[C@H]1CCn2cc[nH+]c21)C(C)(C)C ZINC000833286667 587704443 /nfs/dbraw/zinc/70/44/43/587704443.db2.gz ZGBJODURZRSTSG-USKTWTLRSA-N 1 2 247.342 2.437 20 0 BEADLO C[C@@H]1CC[C@H](CC(=O)N[C@H]2CCn3cc[nH+]c32)C1 ZINC000833283226 587704507 /nfs/dbraw/zinc/70/45/07/587704507.db2.gz ASOXLRSIBUSKEP-WOPDTQHZSA-N 1 2 247.342 2.270 20 0 BEADLO C/C(=C/C(=O)N[C@@H]1CCn2cc[nH+]c21)C(C)(C)C ZINC000833286664 587704735 /nfs/dbraw/zinc/70/47/35/587704735.db2.gz ZGBJODURZRSTSG-DWOQACPDSA-N 1 2 247.342 2.437 20 0 BEADLO C[C@@H](C(=O)N[C@@H]1CCn2cc[nH+]c21)C(C)(C)C ZINC000833292885 587705090 /nfs/dbraw/zinc/70/50/90/587705090.db2.gz OGWYYHMPLMDKSK-VHSXEESVSA-N 1 2 235.331 2.126 20 0 BEADLO Cc1ccsc1C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833304882 587705136 /nfs/dbraw/zinc/70/51/36/587705136.db2.gz IOKGOTWGFMMAHQ-SECBINFHSA-N 1 2 247.323 2.128 20 0 BEADLO O=C(CCC1CCCC1)N[C@@H]1CCn2cc[nH+]c21 ZINC000833304799 587705383 /nfs/dbraw/zinc/70/53/83/587705383.db2.gz IJOMITUKPCMMTH-GFCCVEGCSA-N 1 2 247.342 2.415 20 0 BEADLO CCOC1C[NH+](C[C@H](O)c2cc(C)cc(C)c2)C1 ZINC000834378008 587753455 /nfs/dbraw/zinc/75/34/55/587753455.db2.gz KXGGFEDGPQATMY-HNNXBMFYSA-N 1 2 249.354 2.058 20 0 BEADLO CC(C)[C@H](C)[NH2+]c1ccc(O[C@@H]2CC(=O)N2)cc1 ZINC000834892705 587769562 /nfs/dbraw/zinc/76/95/62/587769562.db2.gz CVSFRLJGAZLBML-IINYFYTJSA-N 1 2 248.326 2.368 20 0 BEADLO CC(C)(C(=O)OCCn1cc[nH+]c1)C1CCC1 ZINC000835350490 587797975 /nfs/dbraw/zinc/79/79/75/587797975.db2.gz PPMYOMUDSWZTGW-UHFFFAOYSA-N 1 2 236.315 2.253 20 0 BEADLO Cc1[nH+]c2cc(OC(=O)C(F)F)ccc2n1C ZINC000835505260 587806372 /nfs/dbraw/zinc/80/63/72/587806372.db2.gz XKEPBDKMAHLVSV-UHFFFAOYSA-N 1 2 240.209 2.052 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)N2CCCCC2)c2[nH+]ccn21 ZINC000836240935 587829485 /nfs/dbraw/zinc/82/94/85/587829485.db2.gz RWYVLSXIDWGJPI-WDEREUQCSA-N 1 2 248.330 2.084 20 0 BEADLO O=C(NC1=[NH+]CCS1)C1(C2CCC2)CCC1 ZINC000836247819 587829646 /nfs/dbraw/zinc/82/96/46/587829646.db2.gz BBLGWRPTRCYNAU-UHFFFAOYSA-N 1 2 238.356 2.176 20 0 BEADLO C/C(=C\C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21)C1CC1 ZINC000836952612 587843680 /nfs/dbraw/zinc/84/36/80/587843680.db2.gz BUYPOFUFZMCPPD-XIIPPOOFSA-N 1 2 245.326 2.361 20 0 BEADLO C[C@H](CC(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21)C1CC1 ZINC000836954574 587843741 /nfs/dbraw/zinc/84/37/41/587843741.db2.gz LYPXJPYEQYPAGC-SCVCMEIPSA-N 1 2 247.342 2.441 20 0 BEADLO C/C=C(/CC)C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000836962481 587844329 /nfs/dbraw/zinc/84/43/29/587844329.db2.gz ZTRZUCAFWATEID-BGBMWRPTSA-N 1 2 233.315 2.361 20 0 BEADLO Cc1ccc([S@@](=O)Cc2[nH+]ccn2C)s1 ZINC000840878827 587927689 /nfs/dbraw/zinc/92/76/89/587927689.db2.gz RGMIFRMAHDOHLW-HNNXBMFYSA-N 1 2 240.353 2.098 20 0 BEADLO COc1ccc([NH2+]C[C@@H]2CCCOC2)cc1N ZINC000841039867 587938458 /nfs/dbraw/zinc/93/84/58/587938458.db2.gz DPDFPHFVFDQBKS-JTQLQIEISA-N 1 2 236.315 2.116 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccc(C)cn2)n(C)n1 ZINC000841879118 587979881 /nfs/dbraw/zinc/97/98/81/587979881.db2.gz YIRWMNAQSGHYHM-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccc(C)cn2)n(C)n1 ZINC000841879118 587979882 /nfs/dbraw/zinc/97/98/82/587979882.db2.gz YIRWMNAQSGHYHM-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO CC[C@@H](CO[NH+]=C(N)Cc1cccs1)OC ZINC000842027238 587988131 /nfs/dbraw/zinc/98/81/31/587988131.db2.gz AFCBXTOBEFIOSG-VIFPVBQESA-N 1 2 242.344 2.214 20 0 BEADLO COC1(CO[NH+]=C(N)c2ccccc2)CCC1 ZINC000842012867 587988945 /nfs/dbraw/zinc/98/89/45/587988945.db2.gz BAUKKUGVGUFFBS-UHFFFAOYSA-N 1 2 234.299 2.102 20 0 BEADLO CC(C)C[C@H](C)O[NH+]=C(N)[C@@H]1CCCO1 ZINC000842047834 587992713 /nfs/dbraw/zinc/99/27/13/587992713.db2.gz UWSOBOXCKVMWLK-UWVGGRQHSA-N 1 2 214.309 2.098 20 0 BEADLO Cc1[nH+]c(C(C)C)ccc1CONC(=O)C1CC1 ZINC000842106270 588000455 /nfs/dbraw/zinc/00/04/55/588000455.db2.gz INCUIQVGUFOLBC-UHFFFAOYSA-N 1 2 248.326 2.471 20 0 BEADLO CC[NH2+]Cc1noc(C[C@@H](CC)C(C)C)n1 ZINC000843144902 588083636 /nfs/dbraw/zinc/08/36/36/588083636.db2.gz NPVPOKYYLKVOSP-SNVBAGLBSA-N 1 2 225.336 2.404 20 0 BEADLO CC[NH2+]Cc1noc([C@H]2CCC(C)(C)C2)n1 ZINC000843144663 588087149 /nfs/dbraw/zinc/08/71/49/588087149.db2.gz GLVDXQUVQZFFKU-VIFPVBQESA-N 1 2 223.320 2.473 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C1(C(F)F)CC1 ZINC000843539099 588121024 /nfs/dbraw/zinc/12/10/24/588121024.db2.gz KYIFFSHCOFWFSD-UHFFFAOYSA-N 1 2 242.225 2.074 20 0 BEADLO Cc1cc(NC(=O)C2(C(F)F)CC2)c(C)c[nH+]1 ZINC000843570353 588124911 /nfs/dbraw/zinc/12/49/11/588124911.db2.gz IUIRBRJBAOOMFA-UHFFFAOYSA-N 1 2 240.253 2.104 20 0 BEADLO CN(C(=O)c1cccc2[nH+]ccn21)C(C)(C)C ZINC000843712234 588134467 /nfs/dbraw/zinc/13/44/67/588134467.db2.gz DJABSXPJFNEGGI-UHFFFAOYSA-N 1 2 231.299 2.205 20 0 BEADLO Cc1[nH]c2ccc(NC(=O)C3(F)CC3)cc2[nH+]1 ZINC000843758825 588137711 /nfs/dbraw/zinc/13/77/11/588137711.db2.gz BJEWGNMOQXFCKM-UHFFFAOYSA-N 1 2 233.246 2.312 20 0 BEADLO Cc1[nH]c2cc(NC(=O)C3(F)CC3)ccc2[nH+]1 ZINC000843758825 588137712 /nfs/dbraw/zinc/13/77/12/588137712.db2.gz BJEWGNMOQXFCKM-UHFFFAOYSA-N 1 2 233.246 2.312 20 0 BEADLO CCn1ccc(C[NH2+][C@@H](C)c2c(C)noc2C)n1 ZINC000844313934 588183536 /nfs/dbraw/zinc/18/35/36/588183536.db2.gz XHQJCXKNJGEFQK-VIFPVBQESA-N 1 2 248.330 2.359 20 0 BEADLO O=C(NC1=[NH+]CCS1)[C@H]1C[C@H]1C1CCCC1 ZINC000844317333 588184594 /nfs/dbraw/zinc/18/45/94/588184594.db2.gz QPZYBXLBUNGFTF-UWVGGRQHSA-N 1 2 238.356 2.032 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1Cc1nccc(C)n1 ZINC000844387380 588188958 /nfs/dbraw/zinc/18/89/58/588188958.db2.gz QWQAWEWEEROSFU-OLZOCXBDSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@H+]1Cc1nccc(C)n1 ZINC000844387380 588188960 /nfs/dbraw/zinc/18/89/60/588188960.db2.gz QWQAWEWEEROSFU-OLZOCXBDSA-N 1 2 249.358 2.174 20 0 BEADLO C[C@@H](CC(=O)NCCC1CCC1)n1cc[nH+]c1 ZINC000844423728 588191528 /nfs/dbraw/zinc/19/15/28/588191528.db2.gz WRCIAUSZBARMQY-NSHDSACASA-N 1 2 235.331 2.141 20 0 BEADLO CCc1nc(C[N@@H+]2C[C@H]3[C@@H](C2)C3(F)F)cs1 ZINC000844449781 588194920 /nfs/dbraw/zinc/19/49/20/588194920.db2.gz DYQSLLTXUKNLSH-DTORHVGOSA-N 1 2 244.310 2.402 20 0 BEADLO CCc1nc(C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)cs1 ZINC000844449781 588194921 /nfs/dbraw/zinc/19/49/21/588194921.db2.gz DYQSLLTXUKNLSH-DTORHVGOSA-N 1 2 244.310 2.402 20 0 BEADLO CCCCOC(=O)C[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000844472553 588198339 /nfs/dbraw/zinc/19/83/39/588198339.db2.gz YKLWITNGFPQVJD-LLVKDONJSA-N 1 2 247.285 2.061 20 0 BEADLO CCCCOC(=O)C[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000844472553 588198340 /nfs/dbraw/zinc/19/83/40/588198340.db2.gz YKLWITNGFPQVJD-LLVKDONJSA-N 1 2 247.285 2.061 20 0 BEADLO CC[C@H](C(=O)OC(C)(C)C)[N@H+](C)CCC(C)=O ZINC000844476621 588198465 /nfs/dbraw/zinc/19/84/65/588198465.db2.gz HGMROAUULBGUDW-LLVKDONJSA-N 1 2 243.347 2.018 20 0 BEADLO CC[C@H](C(=O)OC(C)(C)C)[N@@H+](C)CCC(C)=O ZINC000844476621 588198466 /nfs/dbraw/zinc/19/84/66/588198466.db2.gz HGMROAUULBGUDW-LLVKDONJSA-N 1 2 243.347 2.018 20 0 BEADLO COC/C(C)=C/C(=O)Nc1c(C)cc[nH+]c1C ZINC000844524917 588200536 /nfs/dbraw/zinc/20/05/36/588200536.db2.gz DWSQUOTVLXAJJI-VQHVLOKHSA-N 1 2 234.299 2.230 20 0 BEADLO CCCC(C)(C)C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000844551210 588202091 /nfs/dbraw/zinc/20/20/91/588202091.db2.gz DLQKTRUGEFAPMP-SNVBAGLBSA-N 1 2 235.331 2.270 20 0 BEADLO CCCC(C)(C)C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000844551209 588202117 /nfs/dbraw/zinc/20/21/17/588202117.db2.gz DLQKTRUGEFAPMP-JTQLQIEISA-N 1 2 235.331 2.270 20 0 BEADLO FC1(F)C[C@]12CC[N@H+](Cn1cc(Cl)cn1)C2 ZINC000844756266 588216127 /nfs/dbraw/zinc/21/61/27/588216127.db2.gz JJMBONXRSRHHGB-VIFPVBQESA-N 1 2 247.676 2.225 20 0 BEADLO FC1(F)C[C@]12CC[N@@H+](Cn1cc(Cl)cn1)C2 ZINC000844756266 588216128 /nfs/dbraw/zinc/21/61/28/588216128.db2.gz JJMBONXRSRHHGB-VIFPVBQESA-N 1 2 247.676 2.225 20 0 BEADLO C/C=C/C(=O)NCCn1c(C)[nH+]c2ccccc21 ZINC000105836382 588224960 /nfs/dbraw/zinc/22/49/60/588224960.db2.gz STNDHLCMZRWWRG-ZZXKWVIFSA-N 1 2 243.310 2.037 20 0 BEADLO O=C(OCCn1cc[nH+]c1)[C@H]1C[C@@H]1C1CCCC1 ZINC000845337783 588227032 /nfs/dbraw/zinc/22/70/32/588227032.db2.gz AFBLNWSOUNSFKR-OLZOCXBDSA-N 1 2 248.326 2.253 20 0 BEADLO CC(C)c1[nH]ccc1C(=O)OCc1c[nH+]cn1C ZINC000845478723 588229917 /nfs/dbraw/zinc/22/99/17/588229917.db2.gz CVUUWGJOYJSMAG-UHFFFAOYSA-N 1 2 247.298 2.229 20 0 BEADLO CC1(OC(=O)Cc2cn3c([nH+]2)CCCC3)CCC1 ZINC000845483804 588230294 /nfs/dbraw/zinc/23/02/94/588230294.db2.gz OIDOVYDJPGHEGD-UHFFFAOYSA-N 1 2 248.326 2.248 20 0 BEADLO C[C@H](CC(=O)OC[C@@H](C)C1CC1)n1cc[nH+]c1 ZINC000845546606 588232841 /nfs/dbraw/zinc/23/28/41/588232841.db2.gz WMONMDLUADYNQE-GHMZBOCLSA-N 1 2 236.315 2.424 20 0 BEADLO C[C@H](CC(=O)OC[C@@H]1CC1(F)F)n1cc[nH+]c1 ZINC000845581163 588233868 /nfs/dbraw/zinc/23/38/68/588233868.db2.gz FOLHCXKSQUSUEV-BDAKNGLRSA-N 1 2 244.241 2.033 20 0 BEADLO Cc1nc(N2C[C@H]3[C@@H](C2)C3(F)F)c(C)c(C)[nH+]1 ZINC000845755900 588243869 /nfs/dbraw/zinc/24/38/69/588243869.db2.gz ZMTSUEDPAYCLDR-AOOOYVTPSA-N 1 2 239.269 2.103 20 0 BEADLO CCONC(=O)C[NH2+][C@H](C)C[C@@H](C)CC(C)C ZINC000846090779 588256367 /nfs/dbraw/zinc/25/63/67/588256367.db2.gz DRNAZDJLOYSAFE-NWDGAFQWSA-N 1 2 244.379 2.105 20 0 BEADLO COCc1cc[nH+]c(N[C@H]2CC[C@@H]2C)c1 ZINC000846117248 588257637 /nfs/dbraw/zinc/25/76/37/588257637.db2.gz LGJUZGATJSGCGG-ONGXEEELSA-N 1 2 206.289 2.438 20 0 BEADLO C[C@H](O)c1ncc(C[N@@H+]2CCC[C@H](F)C2)s1 ZINC000846120529 588258023 /nfs/dbraw/zinc/25/80/23/588258023.db2.gz RHDGWAYFIWAHTA-IUCAKERBSA-N 1 2 244.335 2.130 20 0 BEADLO C[C@H](O)c1ncc(C[N@H+]2CCC[C@H](F)C2)s1 ZINC000846120529 588258024 /nfs/dbraw/zinc/25/80/24/588258024.db2.gz RHDGWAYFIWAHTA-IUCAKERBSA-N 1 2 244.335 2.130 20 0 BEADLO F[C@@H]1CCC[N@H+](Cc2cn3ccccc3n2)C1 ZINC000846120303 588258077 /nfs/dbraw/zinc/25/80/77/588258077.db2.gz ODIKFRHPOMYNOF-LLVKDONJSA-N 1 2 233.290 2.268 20 0 BEADLO F[C@@H]1CCC[N@@H+](Cc2cn3ccccc3n2)C1 ZINC000846120303 588258078 /nfs/dbraw/zinc/25/80/78/588258078.db2.gz ODIKFRHPOMYNOF-LLVKDONJSA-N 1 2 233.290 2.268 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](C)c2ncc[nH]2)c1 ZINC000846211375 588260423 /nfs/dbraw/zinc/26/04/23/588260423.db2.gz DSXPIWCHHXIDGV-VIFPVBQESA-N 1 2 232.287 2.124 20 0 BEADLO CC(C(=O)NC(C)(C)c1[nH]cc[nH+]1)=C1CCC1 ZINC000846246696 588262435 /nfs/dbraw/zinc/26/24/35/588262435.db2.gz JBPPLMRNZKJPKZ-UHFFFAOYSA-N 1 2 233.315 2.261 20 0 BEADLO CC(C)(NC(=O)C=C1CCCC1)c1[nH]cc[nH+]1 ZINC000846245093 588262589 /nfs/dbraw/zinc/26/25/89/588262589.db2.gz DHPRMJYQGWMSBZ-UHFFFAOYSA-N 1 2 233.315 2.261 20 0 BEADLO CC[C@@H](C)N(OC)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000846637637 588280616 /nfs/dbraw/zinc/28/06/16/588280616.db2.gz CYZAIVAHZKYRRQ-MNOVXSKESA-N 1 2 239.319 2.023 20 0 BEADLO c1nsnc1C[NH+]1CCCCCCC1 ZINC000846761868 588286442 /nfs/dbraw/zinc/28/64/42/588286442.db2.gz FVTZMSAJWSWCPO-UHFFFAOYSA-N 1 2 211.334 2.304 20 0 BEADLO CC[C@H]1CCCC[N@@H+]1Cc1cnsn1 ZINC000846768511 588286861 /nfs/dbraw/zinc/28/68/61/588286861.db2.gz MLROLDLSXPMIMY-JTQLQIEISA-N 1 2 211.334 2.303 20 0 BEADLO CC[C@H]1CCCC[N@H+]1Cc1cnsn1 ZINC000846768511 588286862 /nfs/dbraw/zinc/28/68/62/588286862.db2.gz MLROLDLSXPMIMY-JTQLQIEISA-N 1 2 211.334 2.303 20 0 BEADLO c1nsnc1C[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000846805761 588289555 /nfs/dbraw/zinc/28/95/55/588289555.db2.gz IGQFGLVYRYZGTC-GXSJLCMTSA-N 1 2 223.345 2.303 20 0 BEADLO c1nsnc1C[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000846805761 588289556 /nfs/dbraw/zinc/28/95/56/588289556.db2.gz IGQFGLVYRYZGTC-GXSJLCMTSA-N 1 2 223.345 2.303 20 0 BEADLO C[C@@H]1CCC[N@H+](Cc2cnsn2)[C@@H]1C ZINC000846806962 588289934 /nfs/dbraw/zinc/28/99/34/588289934.db2.gz RTJKHMWEPOZLDB-RKDXNWHRSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]1CCC[N@@H+](Cc2cnsn2)[C@@H]1C ZINC000846806962 588289935 /nfs/dbraw/zinc/28/99/35/588289935.db2.gz RTJKHMWEPOZLDB-RKDXNWHRSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@H]1CC[C@H](C)[N@H+](Cc2cnsn2)C1 ZINC000846808120 588290048 /nfs/dbraw/zinc/29/00/48/588290048.db2.gz PZRGMVCSDNSQFD-IUCAKERBSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@H]1CC[C@H](C)[N@@H+](Cc2cnsn2)C1 ZINC000846808120 588290049 /nfs/dbraw/zinc/29/00/49/588290049.db2.gz PZRGMVCSDNSQFD-IUCAKERBSA-N 1 2 211.334 2.159 20 0 BEADLO Fc1cc(C[N@@H+]2CC[C@H]3C[C@H]32)cnc1Cl ZINC000846837130 588291730 /nfs/dbraw/zinc/29/17/30/588291730.db2.gz KRMASHORFIZTRV-WCBMZHEXSA-N 1 2 226.682 2.468 20 0 BEADLO Fc1cc(C[N@H+]2CC[C@H]3C[C@H]32)cnc1Cl ZINC000846837130 588291731 /nfs/dbraw/zinc/29/17/31/588291731.db2.gz KRMASHORFIZTRV-WCBMZHEXSA-N 1 2 226.682 2.468 20 0 BEADLO CCc1cnccc1[C@H](C)[NH2+]Cc1cnsn1 ZINC000846852328 588293347 /nfs/dbraw/zinc/29/33/47/588293347.db2.gz XRMGLBRNSQPBKB-VIFPVBQESA-N 1 2 248.355 2.346 20 0 BEADLO Cc1ccc(C(C)(C)[NH2+]Cc2cnsn2)cn1 ZINC000846855646 588293394 /nfs/dbraw/zinc/29/33/94/588293394.db2.gz IIUZUVSWVPBNHE-UHFFFAOYSA-N 1 2 248.355 2.266 20 0 BEADLO CON1CC[NH+]([C@@H](C)c2ccccc2F)CC1 ZINC000846976927 588299891 /nfs/dbraw/zinc/29/98/91/588299891.db2.gz KRGNHDQSIFQVFC-NSHDSACASA-N 1 2 238.306 2.066 20 0 BEADLO O[C@@H](C[NH+]1Cc2cc(F)c(F)cc2C1)C1CC1 ZINC000847049679 588305011 /nfs/dbraw/zinc/30/50/11/588305011.db2.gz WNISOHTXEHTLLA-ZDUSSCGKSA-N 1 2 239.265 2.051 20 0 BEADLO Cc1nsc(C)c1COCc1[nH]cc[nH+]1 ZINC000848434976 588384501 /nfs/dbraw/zinc/38/45/01/588384501.db2.gz OPIZLDXEFFNYRX-UHFFFAOYSA-N 1 2 223.301 2.200 20 0 BEADLO COc1c(C)[nH+]cnc1NCCC1CCC1 ZINC000848670947 588404451 /nfs/dbraw/zinc/40/44/51/588404451.db2.gz QDTUPEUQDRFQLP-UHFFFAOYSA-N 1 2 221.304 2.396 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1CCC1(C)C ZINC000848704945 588406800 /nfs/dbraw/zinc/40/68/00/588406800.db2.gz BZNFQNGACVCFQP-SECBINFHSA-N 1 2 221.304 2.394 20 0 BEADLO COc1c(C)[nH+]cnc1N1CCC[C@@](C)(F)C1 ZINC000848713813 588408165 /nfs/dbraw/zinc/40/81/65/588408165.db2.gz UTCIEJMKDDUBDZ-GFCCVEGCSA-N 1 2 239.294 2.122 20 0 BEADLO COCC1(CNc2cc[nH+]c(C(C)C)n2)CC1 ZINC000848757446 588411910 /nfs/dbraw/zinc/41/19/10/588411910.db2.gz XWIZIIMKYNNNAU-UHFFFAOYSA-N 1 2 235.331 2.439 20 0 BEADLO C[C@H]1CSCC[N@@H+]1Cc1cnc(Cl)n1C ZINC000848887546 588417527 /nfs/dbraw/zinc/41/75/27/588417527.db2.gz YQZIYRLWNWPROC-QMMMGPOBSA-N 1 2 245.779 2.011 20 0 BEADLO C[C@H]1CSCC[N@H+]1Cc1cnc(Cl)n1C ZINC000848887546 588417528 /nfs/dbraw/zinc/41/75/28/588417528.db2.gz YQZIYRLWNWPROC-QMMMGPOBSA-N 1 2 245.779 2.011 20 0 BEADLO Cc1csc(C[NH+]2CC3(CC3(F)F)C2)n1 ZINC000848921830 588420777 /nfs/dbraw/zinc/42/07/77/588420777.db2.gz HOWNPEFQQFSALW-UHFFFAOYSA-N 1 2 230.283 2.293 20 0 BEADLO CC(C)OC[C@H]([NH3+])c1nc(-c2ccccc2)no1 ZINC000849228124 588463694 /nfs/dbraw/zinc/46/36/94/588463694.db2.gz DLUOWHABGJFMSY-NSHDSACASA-N 1 2 247.298 2.161 20 0 BEADLO COc1cc(C)c([NH2+]CC[C@@H](C)O)cc1C ZINC000849316216 588471869 /nfs/dbraw/zinc/47/18/69/588471869.db2.gz VXSIUSTZNWBPRM-LLVKDONJSA-N 1 2 223.316 2.495 20 0 BEADLO Cc1[nH]c(CNc2ccnn2CC2CC2)[nH+]c1C ZINC000850191844 588525619 /nfs/dbraw/zinc/52/56/19/588525619.db2.gz OZEWZOTVOCWHDF-UHFFFAOYSA-N 1 2 245.330 2.245 20 0 BEADLO CC(C)n1ccnc1C[NH2+]Cc1cccc(F)n1 ZINC000850221935 588530217 /nfs/dbraw/zinc/53/02/17/588530217.db2.gz PNAJRBARTSMZAA-UHFFFAOYSA-N 1 2 248.305 2.288 20 0 BEADLO Cc1c[nH]c(CNc2cc3c(cc2C)OCO3)[nH+]1 ZINC000850242234 588531449 /nfs/dbraw/zinc/53/14/49/588531449.db2.gz LWMUGDLYAGTQBJ-UHFFFAOYSA-N 1 2 245.282 2.367 20 0 BEADLO COc1cc[nH+]cc1COC(=O)[C@H]1C[C@H]2C[C@H]2C1 ZINC000850264732 588533451 /nfs/dbraw/zinc/53/34/51/588533451.db2.gz MGWRNAFXNIQFTH-URLYPYJESA-N 1 2 247.294 2.180 20 0 BEADLO CC(C)n1ccnc1C[NH2+]Cc1cccnc1F ZINC000850282335 588534704 /nfs/dbraw/zinc/53/47/04/588534704.db2.gz YGIDBRXKHQTKAJ-UHFFFAOYSA-N 1 2 248.305 2.288 20 0 BEADLO CC(C)n1cc[nH+]c1CNCc1cccnc1F ZINC000850282335 588534705 /nfs/dbraw/zinc/53/47/05/588534705.db2.gz YGIDBRXKHQTKAJ-UHFFFAOYSA-N 1 2 248.305 2.288 20 0 BEADLO CCONC(=O)C[NH2+][C@@H]1CCC[C@@H](CC)CC1 ZINC000850337870 588537253 /nfs/dbraw/zinc/53/72/53/588537253.db2.gz BNCWNCTVOOGBLG-VXGBXAGGSA-N 1 2 242.363 2.003 20 0 BEADLO C1=C[C@H]([NH2+][C@@H](c2nnc[nH]2)c2ccccc2)CC1 ZINC000850510877 588555187 /nfs/dbraw/zinc/55/51/87/588555187.db2.gz XBZREBHILUJUPI-QWHCGFSZSA-N 1 2 240.310 2.202 20 0 BEADLO Cc1ccc(COC(=O)[C@@H]2C[C@H](C)CO2)c(C)[nH+]1 ZINC000885577127 588562184 /nfs/dbraw/zinc/56/21/84/588562184.db2.gz UWZAGEDGTOFGOD-ZANVPECISA-N 1 2 249.310 2.167 20 0 BEADLO CC1(C)CC[C@@H]1C(=O)O[C@H]1CC[N@H+](CCF)C1 ZINC000850997355 588582636 /nfs/dbraw/zinc/58/26/36/588582636.db2.gz DUTVXKRHWGAPKP-WDEREUQCSA-N 1 2 243.322 2.010 20 0 BEADLO CC1(C)CC[C@@H]1C(=O)O[C@H]1CC[N@@H+](CCF)C1 ZINC000850997355 588582637 /nfs/dbraw/zinc/58/26/37/588582637.db2.gz DUTVXKRHWGAPKP-WDEREUQCSA-N 1 2 243.322 2.010 20 0 BEADLO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1cnon1 ZINC000851710960 588615134 /nfs/dbraw/zinc/61/51/34/588615134.db2.gz SCPITQUMPOEYLF-VIFPVBQESA-N 1 2 235.262 2.402 20 0 BEADLO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1cnon1 ZINC000851710960 588615135 /nfs/dbraw/zinc/61/51/35/588615135.db2.gz SCPITQUMPOEYLF-VIFPVBQESA-N 1 2 235.262 2.402 20 0 BEADLO CC(C)[N@@H+](Cc1cnon1)Cc1ccco1 ZINC000851738157 588620810 /nfs/dbraw/zinc/62/08/10/588620810.db2.gz BABOSJYLCJAJHT-UHFFFAOYSA-N 1 2 221.260 2.073 20 0 BEADLO CC(C)[N@H+](Cc1cnon1)Cc1ccco1 ZINC000851738157 588620811 /nfs/dbraw/zinc/62/08/11/588620811.db2.gz BABOSJYLCJAJHT-UHFFFAOYSA-N 1 2 221.260 2.073 20 0 BEADLO CC1(C)OC[C@@H](CC[N@H+](CC(F)F)C2CC2)O1 ZINC000851762366 588624418 /nfs/dbraw/zinc/62/44/18/588624418.db2.gz OHQKQKWYBPTVMC-SNVBAGLBSA-N 1 2 249.301 2.258 20 0 BEADLO CC1(C)OC[C@@H](CC[N@@H+](CC(F)F)C2CC2)O1 ZINC000851762366 588624419 /nfs/dbraw/zinc/62/44/19/588624419.db2.gz OHQKQKWYBPTVMC-SNVBAGLBSA-N 1 2 249.301 2.258 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnon2)[C@@H]1c1ccccc1 ZINC000851799404 588630481 /nfs/dbraw/zinc/63/04/81/588630481.db2.gz AEHUBPCMJQDVNO-MFKMUULPSA-N 1 2 229.283 2.263 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnon2)[C@@H]1c1ccccc1 ZINC000851799404 588630482 /nfs/dbraw/zinc/63/04/82/588630482.db2.gz AEHUBPCMJQDVNO-MFKMUULPSA-N 1 2 229.283 2.263 20 0 BEADLO C[C@H]1[N@H+](Cc2cccc(F)n2)CCOC1(C)C ZINC000851814510 588633042 /nfs/dbraw/zinc/63/30/42/588633042.db2.gz SJEVPVHUYVLUBE-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H]1[N@@H+](Cc2cccc(F)n2)CCOC1(C)C ZINC000851814510 588633043 /nfs/dbraw/zinc/63/30/43/588633043.db2.gz SJEVPVHUYVLUBE-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO CN(CC=C(Cl)Cl)Cc1[nH+]ccn1C ZINC000851870145 588637277 /nfs/dbraw/zinc/63/72/77/588637277.db2.gz BIBIEVSXCQSBFJ-UHFFFAOYSA-N 1 2 234.130 2.171 20 0 BEADLO CCCCCC[C@H](O)C[N@H+](C)Cc1ncc[nH]1 ZINC000851873922 588638069 /nfs/dbraw/zinc/63/80/69/588638069.db2.gz UNCWKKVESVBDJB-LBPRGKRZSA-N 1 2 239.363 2.173 20 0 BEADLO CCCCCC[C@H](O)C[N@@H+](C)Cc1ncc[nH]1 ZINC000851873922 588638070 /nfs/dbraw/zinc/63/80/70/588638070.db2.gz UNCWKKVESVBDJB-LBPRGKRZSA-N 1 2 239.363 2.173 20 0 BEADLO COc1ccc(F)cc1CN(C)Cc1[nH]cc[nH+]1 ZINC000851875901 588638233 /nfs/dbraw/zinc/63/82/33/588638233.db2.gz QZEMKYKVULJPAS-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO Fc1cccc2c1C[N@H+](CCOC(F)F)CC2 ZINC000851884727 588639936 /nfs/dbraw/zinc/63/99/36/588639936.db2.gz AKAMQZMAPRDWBP-UHFFFAOYSA-N 1 2 245.244 2.423 20 0 BEADLO Fc1cccc2c1C[N@@H+](CCOC(F)F)CC2 ZINC000851884727 588639937 /nfs/dbraw/zinc/63/99/37/588639937.db2.gz AKAMQZMAPRDWBP-UHFFFAOYSA-N 1 2 245.244 2.423 20 0 BEADLO CC[C@H]([NH2+]Cc1cnon1)c1ccc(OC)cc1 ZINC000851893058 588641302 /nfs/dbraw/zinc/64/13/02/588641302.db2.gz OYPJHBZTKROQLR-ZDUSSCGKSA-N 1 2 247.298 2.319 20 0 BEADLO CC(C)([NH2+]Cc1cnon1)c1cccc(F)c1 ZINC000851901042 588641651 /nfs/dbraw/zinc/64/16/51/588641651.db2.gz BFEFDPIYXMLZGV-UHFFFAOYSA-N 1 2 235.262 2.234 20 0 BEADLO CC[C@H]([NH2+]Cc1cnon1)c1ccccc1OC ZINC000851896510 588641685 /nfs/dbraw/zinc/64/16/85/588641685.db2.gz JMVHKWOBOQKQQE-LBPRGKRZSA-N 1 2 247.298 2.319 20 0 BEADLO CCOc1cccc([C@@H](C)[NH2+]Cc2cnon2)c1 ZINC000851897895 588641919 /nfs/dbraw/zinc/64/19/19/588641919.db2.gz RZYGRAVBZUUTRR-SNVBAGLBSA-N 1 2 247.298 2.319 20 0 BEADLO CC(C)[C@H]1C[N@H+](Cc2cccc(F)n2)CCO1 ZINC000851911083 588642771 /nfs/dbraw/zinc/64/27/71/588642771.db2.gz UMNONXHNTYCOAI-GFCCVEGCSA-N 1 2 238.306 2.078 20 0 BEADLO CC(C)[C@H]1C[N@@H+](Cc2cccc(F)n2)CCO1 ZINC000851911083 588642772 /nfs/dbraw/zinc/64/27/72/588642772.db2.gz UMNONXHNTYCOAI-GFCCVEGCSA-N 1 2 238.306 2.078 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cccc(F)n2)[C@H](C)[C@H](C)O1 ZINC000851967770 588648620 /nfs/dbraw/zinc/64/86/20/588648620.db2.gz FINPGGJLFVBPDM-MXWKQRLJSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cccc(F)n2)[C@H](C)[C@H](C)O1 ZINC000851967770 588648621 /nfs/dbraw/zinc/64/86/21/588648621.db2.gz FINPGGJLFVBPDM-MXWKQRLJSA-N 1 2 238.306 2.218 20 0 BEADLO Fc1cccc(C[N@@H+]2CCc3ncsc3C2)n1 ZINC000851968183 588648721 /nfs/dbraw/zinc/64/87/21/588648721.db2.gz KUPSLIPXSSVIRX-UHFFFAOYSA-N 1 2 249.314 2.236 20 0 BEADLO Fc1cccc(C[N@H+]2CCc3ncsc3C2)n1 ZINC000851968183 588648722 /nfs/dbraw/zinc/64/87/22/588648722.db2.gz KUPSLIPXSSVIRX-UHFFFAOYSA-N 1 2 249.314 2.236 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cccc(F)n2)[C@H](C)[C@@H](C)O1 ZINC000851967768 588648870 /nfs/dbraw/zinc/64/88/70/588648870.db2.gz FINPGGJLFVBPDM-GMTAPVOTSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cccc(F)n2)[C@H](C)[C@@H](C)O1 ZINC000851967768 588648871 /nfs/dbraw/zinc/64/88/71/588648871.db2.gz FINPGGJLFVBPDM-GMTAPVOTSA-N 1 2 238.306 2.218 20 0 BEADLO Fc1cccc(C[N@H+]2CC[C@H](OC(F)F)C2)n1 ZINC000852018410 588655718 /nfs/dbraw/zinc/65/57/18/588655718.db2.gz MVNMEUOHJLWHIW-VIFPVBQESA-N 1 2 246.232 2.034 20 0 BEADLO Fc1cccc(C[N@@H+]2CC[C@H](OC(F)F)C2)n1 ZINC000852018410 588655719 /nfs/dbraw/zinc/65/57/19/588655719.db2.gz MVNMEUOHJLWHIW-VIFPVBQESA-N 1 2 246.232 2.034 20 0 BEADLO FC(F)(F)C[C@@H]1CCC[N@H+](Cc2cnon2)C1 ZINC000852185060 588670468 /nfs/dbraw/zinc/67/04/68/588670468.db2.gz JWWABOMLUSGUEL-QMMMGPOBSA-N 1 2 249.236 2.234 20 0 BEADLO FC(F)(F)C[C@@H]1CCC[N@@H+](Cc2cnon2)C1 ZINC000852185060 588670469 /nfs/dbraw/zinc/67/04/69/588670469.db2.gz JWWABOMLUSGUEL-QMMMGPOBSA-N 1 2 249.236 2.234 20 0 BEADLO FC(F)(F)C[C@H]1CCC[N@H+](Cc2cnon2)C1 ZINC000852184959 588670567 /nfs/dbraw/zinc/67/05/67/588670567.db2.gz JWWABOMLUSGUEL-MRVPVSSYSA-N 1 2 249.236 2.234 20 0 BEADLO FC(F)(F)C[C@H]1CCC[N@@H+](Cc2cnon2)C1 ZINC000852184959 588670568 /nfs/dbraw/zinc/67/05/68/588670568.db2.gz JWWABOMLUSGUEL-MRVPVSSYSA-N 1 2 249.236 2.234 20 0 BEADLO CC[C@H]([NH2+]Cc1cnon1)c1ccccc1F ZINC000852211496 588672677 /nfs/dbraw/zinc/67/26/77/588672677.db2.gz LZOCPJBQYYBMSY-LBPRGKRZSA-N 1 2 235.262 2.450 20 0 BEADLO CN(CC=C(Cl)Cl)Cc1c[nH+]c[nH]1 ZINC000852288516 588675837 /nfs/dbraw/zinc/67/58/37/588675837.db2.gz PEMKUZDFDIUZTB-UHFFFAOYSA-N 1 2 220.103 2.161 20 0 BEADLO CN(CC=C(Cl)Cl)Cc1c[nH]c[nH+]1 ZINC000852288516 588675838 /nfs/dbraw/zinc/67/58/38/588675838.db2.gz PEMKUZDFDIUZTB-UHFFFAOYSA-N 1 2 220.103 2.161 20 0 BEADLO Cc1nonc1C[NH+]1CCC(c2ccco2)CC1 ZINC000852320511 588678213 /nfs/dbraw/zinc/67/82/13/588678213.db2.gz AXLSPRYMQXPBLD-UHFFFAOYSA-N 1 2 247.298 2.351 20 0 BEADLO COC(=O)[C@@]1([NH2+]C/C=C\Cl)CC[C@@H](C)CC1 ZINC000852471657 588683094 /nfs/dbraw/zinc/68/30/94/588683094.db2.gz BKWBYHQQIVNXJX-DOACPPLWSA-N 1 2 245.750 2.450 20 0 BEADLO CC(C)COC(=O)C[NH2+]C1(CC(C)C)CC1 ZINC000852682651 588695341 /nfs/dbraw/zinc/69/53/41/588695341.db2.gz IEQOCKRXOKPYLV-UHFFFAOYSA-N 1 2 227.348 2.354 20 0 BEADLO CC1(C)C[C@]1([NH2+]Cc1cnon1)c1ccccc1 ZINC000852772208 588701464 /nfs/dbraw/zinc/70/14/64/588701464.db2.gz HNYDOXQXLSHPFP-AWEZNQCLSA-N 1 2 243.310 2.485 20 0 BEADLO C[N@@H+](Cc1cnsn1)C[C@H]1CC1(C)C ZINC000852773300 588701603 /nfs/dbraw/zinc/70/16/03/588701603.db2.gz XMWGVXMOPJBGGI-MRVPVSSYSA-N 1 2 211.334 2.016 20 0 BEADLO C[N@H+](Cc1cnsn1)C[C@H]1CC1(C)C ZINC000852773300 588701604 /nfs/dbraw/zinc/70/16/04/588701604.db2.gz XMWGVXMOPJBGGI-MRVPVSSYSA-N 1 2 211.334 2.016 20 0 BEADLO Cc1cocc1C(=O)OCCCc1[nH+]ccn1C ZINC000860683505 589114320 /nfs/dbraw/zinc/11/43/20/589114320.db2.gz BLGUCPAQRDBRJB-UHFFFAOYSA-N 1 2 248.282 2.111 20 0 BEADLO C[C@H]1SCC[N@H+](Cn2cc(Cl)cn2)[C@@H]1C ZINC000118382475 589169209 /nfs/dbraw/zinc/16/92/09/589169209.db2.gz WQKZQIYAPQGZGQ-RKDXNWHRSA-N 1 2 245.779 2.320 20 0 BEADLO C[C@H]1SCC[N@@H+](Cn2cc(Cl)cn2)[C@@H]1C ZINC000118382475 589169210 /nfs/dbraw/zinc/16/92/10/589169210.db2.gz WQKZQIYAPQGZGQ-RKDXNWHRSA-N 1 2 245.779 2.320 20 0 BEADLO Cc1c(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ccnc1F ZINC000862212558 589194713 /nfs/dbraw/zinc/19/47/13/589194713.db2.gz RDRKVSDWXJQDRF-AOOOYVTPSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1c(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccnc1F ZINC000862212558 589194715 /nfs/dbraw/zinc/19/47/15/589194715.db2.gz RDRKVSDWXJQDRF-AOOOYVTPSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1ncc(C[N@@H+]2CCC[C@](C)(F)C2)o1 ZINC000862381581 589206562 /nfs/dbraw/zinc/20/65/62/589206562.db2.gz FXWMMEAMHVMZLX-NSHDSACASA-N 1 2 212.268 2.307 20 0 BEADLO Cc1ncc(C[N@H+]2CCC[C@](C)(F)C2)o1 ZINC000862381581 589206563 /nfs/dbraw/zinc/20/65/63/589206563.db2.gz FXWMMEAMHVMZLX-NSHDSACASA-N 1 2 212.268 2.307 20 0 BEADLO Cc1c(C[NH+]2CC3(CC3(F)F)C2)ccnc1F ZINC000862402918 589209080 /nfs/dbraw/zinc/20/90/80/589209080.db2.gz SNNTVUSZHFBTAJ-UHFFFAOYSA-N 1 2 242.244 2.370 20 0 BEADLO Fc1cc(C[N@H+]2CCC[C@H](F)C2)ccn1 ZINC000862402241 589209513 /nfs/dbraw/zinc/20/95/13/589209513.db2.gz KHVLQIMFRLKJBT-JTQLQIEISA-N 1 2 212.243 2.155 20 0 BEADLO Fc1cc(C[N@@H+]2CCC[C@H](F)C2)ccn1 ZINC000862402241 589209514 /nfs/dbraw/zinc/20/95/14/589209514.db2.gz KHVLQIMFRLKJBT-JTQLQIEISA-N 1 2 212.243 2.155 20 0 BEADLO Oc1ccc(F)c(C[N@H+]2C[C@@H]3C[C@@H]3C2)c1F ZINC000862443271 589213995 /nfs/dbraw/zinc/21/39/95/589213995.db2.gz NLBWPLNMUGNHMI-OCAPTIKFSA-N 1 2 225.238 2.122 20 0 BEADLO Oc1ccc(F)c(C[N@@H+]2C[C@@H]3C[C@@H]3C2)c1F ZINC000862443271 589213993 /nfs/dbraw/zinc/21/39/93/589213993.db2.gz NLBWPLNMUGNHMI-OCAPTIKFSA-N 1 2 225.238 2.122 20 0 BEADLO CC[C@H]1CC(=O)N(C[NH+]2Cc3ccccc3C2)C1 ZINC000119301780 589263255 /nfs/dbraw/zinc/26/32/55/589263255.db2.gz HIQMQZCLMMZSKO-LBPRGKRZSA-N 1 2 244.338 2.218 20 0 BEADLO C[C@@H]1C[C@H]1CO[NH+]=C(N)COc1ccccc1 ZINC000863453028 589288985 /nfs/dbraw/zinc/28/89/85/589288985.db2.gz AOWVERGEQWHNLU-MNOVXSKESA-N 1 2 234.299 2.220 20 0 BEADLO C[C@@H]1C[C@H]1CO[NH+]=C(N)c1ccc(F)c(F)c1 ZINC000863456565 589289559 /nfs/dbraw/zinc/28/95/59/589289559.db2.gz VOZXLVXVOMKDMU-APPZFPTMSA-N 1 2 240.253 2.467 20 0 BEADLO COC1(C(N)=[NH+]OCc2cccnc2)CCCC1 ZINC000863478433 589292212 /nfs/dbraw/zinc/29/22/12/589292212.db2.gz OQYGFJZZNSZZNZ-UHFFFAOYSA-N 1 2 249.314 2.039 20 0 BEADLO COC1(C(N)=[NH+]OC[C@H]2C[C@@H]2C)CCCC1 ZINC000863477521 589292244 /nfs/dbraw/zinc/29/22/44/589292244.db2.gz NSHLVYVJWTUQFY-VHSXEESVSA-N 1 2 226.320 2.100 20 0 BEADLO Nc1ccc(-c2cnn([C@@H]3CCCCO3)c2)c[nH+]1 ZINC000863725822 589313101 /nfs/dbraw/zinc/31/31/01/589313101.db2.gz BZRJDAJJPCCJMJ-ZDUSSCGKSA-N 1 2 244.298 2.226 20 0 BEADLO C/C=C/C[C@@H]1CCCN(C(=O)Cc2[nH]cc[nH+]2)C1 ZINC000863817301 589321269 /nfs/dbraw/zinc/32/12/69/589321269.db2.gz JVPVBNJORAVJOG-QAVQXKDTSA-N 1 2 247.342 2.157 20 0 BEADLO CC(C)c1[nH+]cc(-c2cnn3cccnc23)n1C ZINC000863975192 589331012 /nfs/dbraw/zinc/33/10/12/589331012.db2.gz JQVKSDGWHNYHDN-UHFFFAOYSA-N 1 2 241.298 2.253 20 0 BEADLO C[C@H](O)c1cccc(N2CCC(C)(F)CC2)[nH+]1 ZINC000864089742 589342846 /nfs/dbraw/zinc/34/28/46/589342846.db2.gz XHJBPZMXHLFQAC-JTQLQIEISA-N 1 2 238.306 2.463 20 0 BEADLO C[C@H](O)c1cccc(N[C@@H]2CO[C@H](C3CC3)C2)[nH+]1 ZINC000864090602 589343433 /nfs/dbraw/zinc/34/34/33/589343433.db2.gz GTYUFZNTFUFCME-GAFUQQFSSA-N 1 2 248.326 2.114 20 0 BEADLO CC1(C(=O)Nc2ccc(-n3cc[nH+]c3)nc2)CC1 ZINC000120237354 589394039 /nfs/dbraw/zinc/39/40/39/589394039.db2.gz MJOULEYAJWRIBJ-UHFFFAOYSA-N 1 2 242.282 2.006 20 0 BEADLO CC/C=C(/F)C(=O)Nc1ccc[nH+]c1N(C)C ZINC000864971572 589403000 /nfs/dbraw/zinc/40/30/00/589403000.db2.gz ADQDUCLDNPBTHZ-RMKNXTFCSA-N 1 2 237.278 2.350 20 0 BEADLO Cc1ccc([N@H+](C)CC[C@H]2CCOC2=O)cc1 ZINC000120376949 589408537 /nfs/dbraw/zinc/40/85/37/589408537.db2.gz UDDYXUUKJDUERA-LBPRGKRZSA-N 1 2 233.311 2.384 20 0 BEADLO Cc1ccc([N@@H+](C)CC[C@H]2CCOC2=O)cc1 ZINC000120376949 589408539 /nfs/dbraw/zinc/40/85/39/589408539.db2.gz UDDYXUUKJDUERA-LBPRGKRZSA-N 1 2 233.311 2.384 20 0 BEADLO Cc1ccc(COCc2[nH]cc[nH+]2)nc1Cl ZINC000865361854 589426185 /nfs/dbraw/zinc/42/61/85/589426185.db2.gz CFPVAMLKEYCRIF-UHFFFAOYSA-N 1 2 237.690 2.483 20 0 BEADLO Cn1cccc1C(=O)Cn1c[nH+]c(C(C)(C)C)c1 ZINC000865375206 589428464 /nfs/dbraw/zinc/42/84/64/589428464.db2.gz GGMBFGVQFPSVMK-UHFFFAOYSA-N 1 2 245.326 2.402 20 0 BEADLO CC(C)(C)c1cn(Cc2cnns2)c[nH+]1 ZINC000865376676 589428735 /nfs/dbraw/zinc/42/87/35/589428735.db2.gz YKBMZIVBCIOKNE-UHFFFAOYSA-N 1 2 222.317 2.080 20 0 BEADLO CC(C)(C)c1cn(C[C@@H]2CC3(CC3)C(=O)O2)c[nH+]1 ZINC000865376467 589428757 /nfs/dbraw/zinc/42/87/57/589428757.db2.gz OLWVQHJMZGNXKK-JTQLQIEISA-N 1 2 248.326 2.276 20 0 BEADLO Nc1nc(NC2CCCC2)nc(C2CCCC2)[nH+]1 ZINC000865400401 589432344 /nfs/dbraw/zinc/43/23/44/589432344.db2.gz BWCYRBLCPZZLLI-UHFFFAOYSA-N 1 2 247.346 2.466 20 0 BEADLO Nc1nc(NC2CCCC2)[nH+]c(C2CCCC2)n1 ZINC000865400401 589432346 /nfs/dbraw/zinc/43/23/46/589432346.db2.gz BWCYRBLCPZZLLI-UHFFFAOYSA-N 1 2 247.346 2.466 20 0 BEADLO CC(C)Cc1cc(NCc2cnn(C)c2)nc[nH+]1 ZINC000865460030 589438113 /nfs/dbraw/zinc/43/81/13/589438113.db2.gz HODOCYDWKBTECQ-UHFFFAOYSA-N 1 2 245.330 2.021 20 0 BEADLO CC[C@@H](CCO)Nc1cc(CC(C)C)[nH+]cn1 ZINC000865554574 589445708 /nfs/dbraw/zinc/44/57/08/589445708.db2.gz ODGZWFYYEHCWIY-NSHDSACASA-N 1 2 237.347 2.248 20 0 BEADLO CCCCc1cc(N[C@@H](CCO)C2CC2)nc[nH+]1 ZINC000865552635 589446047 /nfs/dbraw/zinc/44/60/47/589446047.db2.gz NBPSUYLDGYOXHN-ZDUSSCGKSA-N 1 2 249.358 2.392 20 0 BEADLO CCCCc1cc(NCc2nonc2C)nc[nH+]1 ZINC000865562743 589447118 /nfs/dbraw/zinc/44/71/18/589447118.db2.gz NVPVKPAADATBIX-UHFFFAOYSA-N 1 2 247.302 2.123 20 0 BEADLO FC1(F)CCC[C@@H]1NCc1cn(C2CC2)c[nH+]1 ZINC000865569454 589447404 /nfs/dbraw/zinc/44/74/04/589447404.db2.gz PQEGMROXLNCNSP-NSHDSACASA-N 1 2 241.285 2.495 20 0 BEADLO CC(C)Cc1cc(NC[C@H]2CCC[C@@H]2O)nc[nH+]1 ZINC000865565923 589447676 /nfs/dbraw/zinc/44/76/76/589447676.db2.gz SQYBTHUOXLLBAG-YPMHNXCESA-N 1 2 249.358 2.248 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C ZINC000865574960 589447793 /nfs/dbraw/zinc/44/77/93/589447793.db2.gz HVAYMSFKWLIERV-HJQYOEGKSA-N 1 2 230.311 2.043 20 0 BEADLO C[C@@H]1CCCN1c1nc(N)[nH+]c(C2CCCC2)n1 ZINC000865570762 589447891 /nfs/dbraw/zinc/44/78/91/589447891.db2.gz CCOLNUMCYQKDEP-SECBINFHSA-N 1 2 247.346 2.100 20 0 BEADLO C[C@@H]1CCCN1c1nc(N)nc(C2CCCC2)[nH+]1 ZINC000865570762 589447893 /nfs/dbraw/zinc/44/78/93/589447893.db2.gz CCOLNUMCYQKDEP-SECBINFHSA-N 1 2 247.346 2.100 20 0 BEADLO FCC(CF)[NH2+]Cc1cnc(Cl)c(F)c1 ZINC000865583412 589449144 /nfs/dbraw/zinc/44/91/44/589449144.db2.gz QVFRFUBLLNTGOG-UHFFFAOYSA-N 1 2 238.640 2.271 20 0 BEADLO FC(F)(F)c1c[nH+]ccc1N1CCCO1 ZINC000865668230 589455441 /nfs/dbraw/zinc/45/54/41/589455441.db2.gz HSDBDNMRAAAACB-UHFFFAOYSA-N 1 2 218.178 2.242 20 0 BEADLO CC(C)Cc1cc(N2CCC(=O)[C@H](C)C2)nc[nH+]1 ZINC000865686051 589456120 /nfs/dbraw/zinc/45/61/20/589456120.db2.gz CGJWLJDPVTUVDD-LLVKDONJSA-N 1 2 247.342 2.090 20 0 BEADLO Cc1[nH]c(CN[C@@H]2CCCC[C@@H]2F)[nH+]c1C ZINC000865697419 589457208 /nfs/dbraw/zinc/45/72/08/589457208.db2.gz ZTZKUBNFHOGIMO-WDEREUQCSA-N 1 2 225.311 2.397 20 0 BEADLO CO[C@H](C)CNc1[nH+]cnc2[nH]c(Cl)cc21 ZINC000865714265 589457909 /nfs/dbraw/zinc/45/79/09/589457909.db2.gz JTZKIGNAEQRFFU-ZCFIWIBFSA-N 1 2 240.694 2.058 20 0 BEADLO CC(C)Cc1cc(NC[C@@H]2CC[C@@H](O)C2)nc[nH+]1 ZINC000865720754 589458253 /nfs/dbraw/zinc/45/82/53/589458253.db2.gz KGNUGKDPEKAJSD-DGCLKSJQSA-N 1 2 249.358 2.248 20 0 BEADLO Cc1[nH]ncc1C[NH2+]C(C)(C)[C@@H]1CCCCO1 ZINC000865748021 589460671 /nfs/dbraw/zinc/46/06/71/589460671.db2.gz YIOPIEOKKLUDLJ-LBPRGKRZSA-N 1 2 237.347 2.155 20 0 BEADLO CCCNc1cc(NCC2=CCCOC2)nc[nH+]1 ZINC000865810472 589462898 /nfs/dbraw/zinc/46/28/98/589462898.db2.gz OFFDGMJHDOJIMD-UHFFFAOYSA-N 1 2 248.330 2.057 20 0 BEADLO CCCNc1cc(NCC2=CCCOC2)[nH+]cn1 ZINC000865810472 589462899 /nfs/dbraw/zinc/46/28/99/589462899.db2.gz OFFDGMJHDOJIMD-UHFFFAOYSA-N 1 2 248.330 2.057 20 0 BEADLO C[C@@H]1CN(c2[nH+]cnc3[nH]c(Cl)cc32)[C@@H]1C ZINC000865839215 589464440 /nfs/dbraw/zinc/46/44/40/589464440.db2.gz JRSFOMYUASFLOF-RNFRBKRXSA-N 1 2 236.706 2.408 20 0 BEADLO CCc1csc(NCc2ccc[nH+]c2N)n1 ZINC000865850268 589464874 /nfs/dbraw/zinc/46/48/74/589464874.db2.gz PCHWLKDKRYJHKU-UHFFFAOYSA-N 1 2 234.328 2.295 20 0 BEADLO Cc1cc(C(F)(F)F)c[nH+]c1NC/C=C/CO ZINC000865935928 589469155 /nfs/dbraw/zinc/46/91/55/589469155.db2.gz AJTKIXZUNQJWBJ-NSCUHMNNSA-N 1 2 246.232 2.369 20 0 BEADLO CC1(C)[C@H]2[C@H](CCCN2c2cccc[nH+]2)[C@@H]1O ZINC000866000134 589472049 /nfs/dbraw/zinc/47/20/49/589472049.db2.gz QZKKLBGCFNMKTQ-UHTWSYAYSA-N 1 2 232.327 2.067 20 0 BEADLO Cc1cc(N[C@@H]2CC(C)(C)CC[C@H]2O)nc[nH+]1 ZINC000866050650 589474235 /nfs/dbraw/zinc/47/42/35/589474235.db2.gz YFTIWUALHHRJKW-GHMZBOCLSA-N 1 2 235.331 2.137 20 0 BEADLO c1ccc(N2CC[C@H]3CSC[C@H]3C2)[nH+]c1 ZINC000866205620 589480041 /nfs/dbraw/zinc/48/00/41/589480041.db2.gz GOOQJTXWZRLOCO-WDEREUQCSA-N 1 2 220.341 2.271 20 0 BEADLO Fc1cc(C[NH2+][C@H]2CCCc3[nH]ncc32)ccn1 ZINC000866474850 589494912 /nfs/dbraw/zinc/49/49/12/589494912.db2.gz OMDBXPZCAAEPPZ-NSHDSACASA-N 1 2 246.289 2.111 20 0 BEADLO CC(C)CCOC(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000867757093 589533244 /nfs/dbraw/zinc/53/32/44/589533244.db2.gz WODRIERWEXLFQM-UHFFFAOYSA-N 1 2 225.292 2.024 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@@]12C[C@@H]1CCCC2 ZINC000868662513 589571500 /nfs/dbraw/zinc/57/15/00/589571500.db2.gz PHLQFQILYBRLSZ-FZMZJTMJSA-N 1 2 247.342 2.100 20 0 BEADLO C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000868731768 589575008 /nfs/dbraw/zinc/57/50/08/589575008.db2.gz KHOVILGMSMVXBQ-YTWAJWBKSA-N 1 2 247.342 2.053 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)[C@@H]2C[C@H]2C)c1 ZINC000122285783 589576768 /nfs/dbraw/zinc/57/67/68/589576768.db2.gz LVCSUHXHBJQPRM-PRHODGIISA-N 1 2 235.283 2.098 20 0 BEADLO CC[C@H](C)C(=O)OCc1cc(OC)cc(C)[nH+]1 ZINC000122392491 589584836 /nfs/dbraw/zinc/58/48/36/589584836.db2.gz DCCYPYSZQGHWKJ-VIFPVBQESA-N 1 2 237.299 2.488 20 0 BEADLO CC[C@@H](C)C(=O)OCc1cc(OC)cc(C)[nH+]1 ZINC000122392282 589584909 /nfs/dbraw/zinc/58/49/09/589584909.db2.gz DCCYPYSZQGHWKJ-SECBINFHSA-N 1 2 237.299 2.488 20 0 BEADLO C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)OCCCn1cc[nH+]c1 ZINC000869886300 589635237 /nfs/dbraw/zinc/63/52/37/589635237.db2.gz DVDXZPATXZOKAS-VOAKCMCISA-N 1 2 248.326 2.109 20 0 BEADLO CCc1sc(Cn2cc[nH+]c2)nc1C ZINC000871600925 589773575 /nfs/dbraw/zinc/77/35/75/589773575.db2.gz ZAOLPHUZSLNBQE-UHFFFAOYSA-N 1 2 207.302 2.259 20 0 BEADLO Clc1cccc(COCc2[nH]cc[nH+]2)n1 ZINC000123751677 589793576 /nfs/dbraw/zinc/79/35/76/589793576.db2.gz NVYJTSTWPYJMRO-UHFFFAOYSA-N 1 2 223.663 2.175 20 0 BEADLO CO[C@H]1C[C@@H](CO[NH+]=C(N)c2ccccc2C)C1 ZINC000871718384 589798123 /nfs/dbraw/zinc/79/81/23/589798123.db2.gz FPTYFARHMLVOJP-TXEJJXNPSA-N 1 2 248.326 2.267 20 0 BEADLO CC(C)OCC(N)=[NH+]OC1CC(C)(C)C1 ZINC000871726877 589799002 /nfs/dbraw/zinc/79/90/02/589799002.db2.gz DHGIZJJNXMTSAK-UHFFFAOYSA-N 1 2 214.309 2.098 20 0 BEADLO CC(C)OCC(N)=[NH+]OCC1CC2(CCC2)C1 ZINC000871727576 589799934 /nfs/dbraw/zinc/79/99/34/589799934.db2.gz JTRMBYDFSHZYAV-UHFFFAOYSA-N 1 2 240.347 2.490 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OCC1CC2(CCC2)C1 ZINC000871735061 589801297 /nfs/dbraw/zinc/80/12/97/589801297.db2.gz MFRPSIUYGTXMQK-VIFPVBQESA-N 1 2 226.320 2.100 20 0 BEADLO NC(Cc1cccnc1)=[NH+]OCCCC1CC1 ZINC000871737771 589802189 /nfs/dbraw/zinc/80/21/89/589802189.db2.gz KZWSZVUTFYERAB-UHFFFAOYSA-N 1 2 233.315 2.313 20 0 BEADLO CC[C@@H](C)CO[NH+]=C(N)COC1CCC1 ZINC000871775827 589813597 /nfs/dbraw/zinc/81/35/97/589813597.db2.gz QCNOOVHKESNJKB-SECBINFHSA-N 1 2 214.309 2.100 20 0 BEADLO CC(C)=CCO[NH+]=C(N)COC1CCC1 ZINC000871778730 589814671 /nfs/dbraw/zinc/81/46/71/589814671.db2.gz UOLJQGBBCWNWIN-UHFFFAOYSA-N 1 2 212.293 2.020 20 0 BEADLO Cc1nonc1C[NH2+][C@H]1CCc2c1cccc2F ZINC000871937169 589835070 /nfs/dbraw/zinc/83/50/70/589835070.db2.gz BSYCZPNWYPAMTJ-LBPRGKRZSA-N 1 2 247.273 2.294 20 0 BEADLO CC(C)(C)c1cn(C[C@H](O)c2ccccn2)c[nH+]1 ZINC000871988980 589853792 /nfs/dbraw/zinc/85/37/92/589853792.db2.gz JATVWMMIEJLGCN-LBPRGKRZSA-N 1 2 245.326 2.309 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]C[C@H]1CC(C)(C)CO1 ZINC000872107682 589873590 /nfs/dbraw/zinc/87/35/90/589873590.db2.gz QSPDOJVSQOYCMX-MWLCHTKSSA-N 1 2 237.347 2.184 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@@H]1C[C@H]2CCC[C@H]2O1 ZINC000872110064 589874395 /nfs/dbraw/zinc/87/43/95/589874395.db2.gz VLQKHDUGYGVYHT-WSXWTOPLSA-N 1 2 249.358 2.326 20 0 BEADLO Cc1nc(NC[C@@H]2C[C@H]3CCC[C@@H]3O2)cc[nH+]1 ZINC000872699773 589963097 /nfs/dbraw/zinc/96/30/97/589963097.db2.gz UAKZJNHUJQWKQJ-WOPDTQHZSA-N 1 2 233.315 2.155 20 0 BEADLO c1cc2[nH+]ccc(N[C@H]3CC34CCC4)c2cn1 ZINC000872775727 589968440 /nfs/dbraw/zinc/96/84/40/589968440.db2.gz XTJZVCDWCGIJOQ-ZDUSSCGKSA-N 1 2 225.295 2.406 20 0 BEADLO Cc1cccc(F)c1C[NH2+]Cc1ccon1 ZINC000873063491 589982148 /nfs/dbraw/zinc/98/21/48/589982148.db2.gz WIKXNQWIGLXHRS-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO FC1(C[NH2+]Cc2ncc(Cl)s2)CC1 ZINC000873165348 589989108 /nfs/dbraw/zinc/98/91/08/589989108.db2.gz KZAULERTPMWTHE-UHFFFAOYSA-N 1 2 220.700 2.388 20 0 BEADLO CCC[C@H](CC)C(=O)O[C@@H]1CC[N@H+](CCF)C1 ZINC000873525594 590053766 /nfs/dbraw/zinc/05/37/66/590053766.db2.gz XYEWHTNCCZYLOZ-NWDGAFQWSA-N 1 2 245.338 2.400 20 0 BEADLO CCC[C@H](CC)C(=O)O[C@@H]1CC[N@@H+](CCF)C1 ZINC000873525594 590053768 /nfs/dbraw/zinc/05/37/68/590053768.db2.gz XYEWHTNCCZYLOZ-NWDGAFQWSA-N 1 2 245.338 2.400 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2ncc[nH]2)o1 ZINC000124673032 590072220 /nfs/dbraw/zinc/07/22/20/590072220.db2.gz FAEOQGISCVDUIB-VIFPVBQESA-N 1 2 205.261 2.162 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ccccn1)c1ncc[nH]1 ZINC000124672179 590072616 /nfs/dbraw/zinc/07/26/16/590072616.db2.gz DWYOTHJMNINHTP-UWVGGRQHSA-N 1 2 216.288 2.217 20 0 BEADLO CSCC[C@H](C)Nc1cc(C)[nH+]cn1 ZINC000124768239 590084610 /nfs/dbraw/zinc/08/46/10/590084610.db2.gz RCFBDVDTGZUJOX-QMMMGPOBSA-N 1 2 211.334 2.339 20 0 BEADLO Cc1cc(NC(=O)C2(OC(C)C)CCC2)cc[nH+]1 ZINC000874461667 590112610 /nfs/dbraw/zinc/11/26/10/590112610.db2.gz OTNIUZKIKLHNLM-UHFFFAOYSA-N 1 2 248.326 2.098 20 0 BEADLO O=C(N[C@H]1CC12CCC2)c1cccc2[nH+]ccn21 ZINC000874782157 590133287 /nfs/dbraw/zinc/13/32/87/590133287.db2.gz IOTRNXVMCMOLOE-NSHDSACASA-N 1 2 241.294 2.007 20 0 BEADLO CCCn1cc(C[N@H+](C)[C@H](C)c2ccco2)nn1 ZINC000876574210 590217571 /nfs/dbraw/zinc/21/75/71/590217571.db2.gz QHTFULTXGNJTIC-LLVKDONJSA-N 1 2 248.330 2.474 20 0 BEADLO CCCn1cc(C[N@@H+](C)[C@H](C)c2ccco2)nn1 ZINC000876574210 590217573 /nfs/dbraw/zinc/21/75/73/590217573.db2.gz QHTFULTXGNJTIC-LLVKDONJSA-N 1 2 248.330 2.474 20 0 BEADLO COc1cnc(F)c(C[N@H+]2CC=C(C)CC2)c1 ZINC000876749750 590236803 /nfs/dbraw/zinc/23/68/03/590236803.db2.gz MAIXWOGDUVLTFS-UHFFFAOYSA-N 1 2 236.290 2.381 20 0 BEADLO COc1cnc(F)c(C[N@@H+]2CC=C(C)CC2)c1 ZINC000876749750 590236804 /nfs/dbraw/zinc/23/68/04/590236804.db2.gz MAIXWOGDUVLTFS-UHFFFAOYSA-N 1 2 236.290 2.381 20 0 BEADLO Cc1cnc(C[NH2+]Cc2ccc([C@@H](C)O)cc2)o1 ZINC000876967710 590262760 /nfs/dbraw/zinc/26/27/60/590262760.db2.gz LQFHEUSIEUQDIO-LLVKDONJSA-N 1 2 246.310 2.326 20 0 BEADLO Fc1cccc(C[NH2+]Cc2cc(C3CC3)no2)n1 ZINC000877115292 590288057 /nfs/dbraw/zinc/28/80/57/590288057.db2.gz LDQTUTSFDPMUDL-UHFFFAOYSA-N 1 2 247.273 2.376 20 0 BEADLO Cc1cnc(C[NH2+][C@H](C)c2ccc[nH]2)o1 ZINC000877123979 590289524 /nfs/dbraw/zinc/28/95/24/590289524.db2.gz HJSNPBJHQVHONC-SECBINFHSA-N 1 2 205.261 2.162 20 0 BEADLO C[N@H+](Cc1nc(Cl)cs1)CC(C)(C)CO ZINC000877561562 590360168 /nfs/dbraw/zinc/36/01/68/590360168.db2.gz OCDWYLLZUOHHPS-UHFFFAOYSA-N 1 2 248.779 2.247 20 0 BEADLO C[N@@H+](Cc1nc(Cl)cs1)CC(C)(C)CO ZINC000877561562 590360170 /nfs/dbraw/zinc/36/01/70/590360170.db2.gz OCDWYLLZUOHHPS-UHFFFAOYSA-N 1 2 248.779 2.247 20 0 BEADLO CCOc1cc(F)cc(C[NH2+]Cc2ncc[nH]2)c1 ZINC000877673735 590390085 /nfs/dbraw/zinc/39/00/85/590390085.db2.gz QRXDZZOFBGFSAA-UHFFFAOYSA-N 1 2 249.289 2.237 20 0 BEADLO CC(C)(C)OC1C[NH+](Cc2cccc(O)c2)C1 ZINC000877771945 590421954 /nfs/dbraw/zinc/42/19/54/590421954.db2.gz HAADUABSLCQMRX-UHFFFAOYSA-N 1 2 235.327 2.392 20 0 BEADLO Cn1cccc1C[NH+]1CC(OC(C)(C)C)C1 ZINC000877772281 590422561 /nfs/dbraw/zinc/42/25/61/590422561.db2.gz XERZDXAUDANKMM-UHFFFAOYSA-N 1 2 222.332 2.024 20 0 BEADLO C[C@]1(C(F)(F)F)CC[N@H+](Cc2ccon2)C1 ZINC000877812411 590427304 /nfs/dbraw/zinc/42/73/04/590427304.db2.gz PDMKUGSEKQZRTA-VIFPVBQESA-N 1 2 234.221 2.449 20 0 BEADLO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccon2)C1 ZINC000877812411 590427307 /nfs/dbraw/zinc/42/73/07/590427307.db2.gz PDMKUGSEKQZRTA-VIFPVBQESA-N 1 2 234.221 2.449 20 0 BEADLO FC(F)(F)[C@H]1CC[N@H+](CC2(F)CC2)CCO1 ZINC000877820199 590427916 /nfs/dbraw/zinc/42/79/16/590427916.db2.gz NJZAWXCPFRADIE-MRVPVSSYSA-N 1 2 241.228 2.142 20 0 BEADLO FC(F)(F)[C@H]1CC[N@@H+](CC2(F)CC2)CCO1 ZINC000877820199 590427917 /nfs/dbraw/zinc/42/79/17/590427917.db2.gz NJZAWXCPFRADIE-MRVPVSSYSA-N 1 2 241.228 2.142 20 0 BEADLO CC(C)(C)c1nc(COCc2[nH]cc[nH+]2)co1 ZINC000877883092 590437902 /nfs/dbraw/zinc/43/79/02/590437902.db2.gz BPIXEGQDYRWELF-UHFFFAOYSA-N 1 2 235.287 2.412 20 0 BEADLO FC(F)(F)SCCOCc1[nH]cc[nH+]1 ZINC000877884334 590438757 /nfs/dbraw/zinc/43/87/57/590438757.db2.gz VHIQHKUMZGZNIR-UHFFFAOYSA-N 1 2 226.223 2.179 20 0 BEADLO CC1(C)COCC[N@@H+]1CCCOC(F)(F)F ZINC000877995416 590468985 /nfs/dbraw/zinc/46/89/85/590468985.db2.gz GXXITIMDPXGFOK-UHFFFAOYSA-N 1 2 241.253 2.024 20 0 BEADLO CC1(C)COCC[N@H+]1CCCOC(F)(F)F ZINC000877995416 590468986 /nfs/dbraw/zinc/46/89/86/590468986.db2.gz GXXITIMDPXGFOK-UHFFFAOYSA-N 1 2 241.253 2.024 20 0 BEADLO CC(C)[C@@H](O)CC[N@H+](CC(F)F)C1CC1 ZINC000878084459 590489235 /nfs/dbraw/zinc/48/92/35/590489235.db2.gz TWBDOJFQXYHWRN-JTQLQIEISA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)[C@@H](O)CC[N@@H+](CC(F)F)C1CC1 ZINC000878084459 590489236 /nfs/dbraw/zinc/48/92/36/590489236.db2.gz TWBDOJFQXYHWRN-JTQLQIEISA-N 1 2 221.291 2.123 20 0 BEADLO Cc1conc1C[N@H+]1CCOC[C@H]1CC(C)C ZINC000878106240 590495393 /nfs/dbraw/zinc/49/53/93/590495393.db2.gz FUMKDQBUFVKFGK-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1conc1C[N@@H+]1CCOC[C@H]1CC(C)C ZINC000878106240 590495394 /nfs/dbraw/zinc/49/53/94/590495394.db2.gz FUMKDQBUFVKFGK-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO CC(C)[C@H](O)CC[N@H+](CC(F)F)C(C)C ZINC000878200361 590523489 /nfs/dbraw/zinc/52/34/89/590523489.db2.gz OFORMFJTAMJGNU-SNVBAGLBSA-N 1 2 223.307 2.369 20 0 BEADLO CC(C)[C@H](O)CC[N@@H+](CC(F)F)C(C)C ZINC000878200361 590523490 /nfs/dbraw/zinc/52/34/90/590523490.db2.gz OFORMFJTAMJGNU-SNVBAGLBSA-N 1 2 223.307 2.369 20 0 BEADLO CCC(F)(F)C[NH+]1CCC(OC(C)=O)CC1 ZINC000878295767 590536559 /nfs/dbraw/zinc/53/65/59/590536559.db2.gz VNRSFVPUJLBYAI-UHFFFAOYSA-N 1 2 235.274 2.059 20 0 BEADLO C[C@H]1CCOCC[N@@H+]1Cc1scnc1Cl ZINC000878373470 590555598 /nfs/dbraw/zinc/55/55/98/590555598.db2.gz MEWOVGCYCMQALV-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@H]1CCOCC[N@H+]1Cc1scnc1Cl ZINC000878373470 590555601 /nfs/dbraw/zinc/55/56/01/590555601.db2.gz MEWOVGCYCMQALV-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCOCC[C@@H]1C ZINC000878374602 590555688 /nfs/dbraw/zinc/55/56/88/590555688.db2.gz VFDLXMFVMOBRKW-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CCC(F)(F)C[N@H+]1CCOCC[C@@H]1C ZINC000878374602 590555690 /nfs/dbraw/zinc/55/56/90/590555690.db2.gz VFDLXMFVMOBRKW-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1nccn1CC(F)F ZINC000878533700 590587789 /nfs/dbraw/zinc/58/77/89/590587789.db2.gz RGRVEBFVOVPKPF-DTORHVGOSA-N 1 2 229.274 2.131 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1nccn1CC(F)F ZINC000878533700 590587790 /nfs/dbraw/zinc/58/77/90/590587790.db2.gz RGRVEBFVOVPKPF-DTORHVGOSA-N 1 2 229.274 2.131 20 0 BEADLO c1cnc2c(c1)C[N@@H+](C[C@H]1CC3(CCC3)CO1)C2 ZINC000878548266 590590510 /nfs/dbraw/zinc/59/05/10/590590510.db2.gz IHEUJXUYQPHAPI-CYBMUJFWSA-N 1 2 244.338 2.356 20 0 BEADLO c1cnc2c(c1)C[N@H+](C[C@H]1CC3(CCC3)CO1)C2 ZINC000878548266 590590511 /nfs/dbraw/zinc/59/05/11/590590511.db2.gz IHEUJXUYQPHAPI-CYBMUJFWSA-N 1 2 244.338 2.356 20 0 BEADLO C=C/C=C/CC[N@H+](CC(F)F)C[C@H](C)O ZINC000878685127 590609204 /nfs/dbraw/zinc/60/92/04/590609204.db2.gz QVOCSAJEZPMCCA-YEZKRMTDSA-N 1 2 219.275 2.067 20 0 BEADLO C=C/C=C/CC[N@@H+](CC(F)F)C[C@H](C)O ZINC000878685127 590609205 /nfs/dbraw/zinc/60/92/05/590609205.db2.gz QVOCSAJEZPMCCA-YEZKRMTDSA-N 1 2 219.275 2.067 20 0 BEADLO Cc1nccnc1C[N@@H+]1CCC=C(Cl)C1 ZINC000878790829 590622534 /nfs/dbraw/zinc/62/25/34/590622534.db2.gz XTJRGQKFPAGFON-UHFFFAOYSA-N 1 2 223.707 2.113 20 0 BEADLO Cc1nccnc1C[N@H+]1CCC=C(Cl)C1 ZINC000878790829 590622535 /nfs/dbraw/zinc/62/25/35/590622535.db2.gz XTJRGQKFPAGFON-UHFFFAOYSA-N 1 2 223.707 2.113 20 0 BEADLO FC(F)COCC[N@@H+]1CCC=C(Cl)C1 ZINC000878791073 590623634 /nfs/dbraw/zinc/62/36/34/590623634.db2.gz CNEDVPOMYQKCJV-UHFFFAOYSA-N 1 2 225.666 2.097 20 0 BEADLO FC(F)COCC[N@H+]1CCC=C(Cl)C1 ZINC000878791073 590623636 /nfs/dbraw/zinc/62/36/36/590623636.db2.gz CNEDVPOMYQKCJV-UHFFFAOYSA-N 1 2 225.666 2.097 20 0 BEADLO FC(F)OCC[N@@H+]1CCC=C(Cl)C1 ZINC000878790966 590623824 /nfs/dbraw/zinc/62/38/24/590623824.db2.gz ZJPGPDIHQZRVAX-UHFFFAOYSA-N 1 2 211.639 2.054 20 0 BEADLO FC(F)OCC[N@H+]1CCC=C(Cl)C1 ZINC000878790966 590623825 /nfs/dbraw/zinc/62/38/25/590623825.db2.gz ZJPGPDIHQZRVAX-UHFFFAOYSA-N 1 2 211.639 2.054 20 0 BEADLO CC[C@@H]1CCC[C@]1(C)C(=O)NCc1[nH]cc[nH+]1 ZINC000878816933 590627221 /nfs/dbraw/zinc/62/72/21/590627221.db2.gz XYBYDEKMAWAMDD-MFKMUULPSA-N 1 2 235.331 2.242 20 0 BEADLO Cc1nc(C)c(C[N@H+](C)Cc2ccns2)o1 ZINC000878898851 590643270 /nfs/dbraw/zinc/64/32/70/590643270.db2.gz APAAYMYCBYRXAD-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1nc(C)c(C[N@@H+](C)Cc2ccns2)o1 ZINC000878898851 590643274 /nfs/dbraw/zinc/64/32/74/590643274.db2.gz APAAYMYCBYRXAD-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO CC[C@@H]1CCC[C@]1(C)C(=O)NCc1c[nH+]c[nH]1 ZINC000878907883 590645527 /nfs/dbraw/zinc/64/55/27/590645527.db2.gz RJIWCVUNGJAZFI-MFKMUULPSA-N 1 2 235.331 2.242 20 0 BEADLO CC[C@@H]1CCC[C@]1(C)C(=O)NCc1c[nH]c[nH+]1 ZINC000878907883 590645531 /nfs/dbraw/zinc/64/55/31/590645531.db2.gz RJIWCVUNGJAZFI-MFKMUULPSA-N 1 2 235.331 2.242 20 0 BEADLO Cc1conc1C[NH+]1CCC2(CCCC2=O)CC1 ZINC000878968996 590663782 /nfs/dbraw/zinc/66/37/82/590663782.db2.gz HLMCLMASYOJQNI-UHFFFAOYSA-N 1 2 248.326 2.318 20 0 BEADLO C=C/C=C\CC[N@@H+](C)Cc1nnc(C)s1 ZINC000878997568 590672854 /nfs/dbraw/zinc/67/28/54/590672854.db2.gz ACKJBZYNAXITFP-WAYWQWQTSA-N 1 2 223.345 2.411 20 0 BEADLO C=C/C=C\CC[N@H+](C)Cc1nnc(C)s1 ZINC000878997568 590672855 /nfs/dbraw/zinc/67/28/55/590672855.db2.gz ACKJBZYNAXITFP-WAYWQWQTSA-N 1 2 223.345 2.411 20 0 BEADLO Cc1nnc(C[N@H+](C)CCCC2CC2)s1 ZINC000878998988 590674456 /nfs/dbraw/zinc/67/44/56/590674456.db2.gz ZPUDVHDKRBKAHE-UHFFFAOYSA-N 1 2 225.361 2.469 20 0 BEADLO Cc1nnc(C[N@@H+](C)CCCC2CC2)s1 ZINC000878998988 590674463 /nfs/dbraw/zinc/67/44/63/590674463.db2.gz ZPUDVHDKRBKAHE-UHFFFAOYSA-N 1 2 225.361 2.469 20 0 BEADLO Cc1ncc([C@H](C)[NH2+]Cc2nccc(C)n2)s1 ZINC000879251673 590721280 /nfs/dbraw/zinc/72/12/80/590721280.db2.gz AFPBOGLFICUFQG-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO Cc1ccnc(C[NH+]2CCC(C)(F)CC2)n1 ZINC000879382161 590758499 /nfs/dbraw/zinc/75/84/99/590758499.db2.gz RFLOOWGRANVKFF-UHFFFAOYSA-N 1 2 223.295 2.109 20 0 BEADLO OCCCCCC[N@@H+]1OC2CCC1CC2 ZINC000879799465 590877081 /nfs/dbraw/zinc/87/70/81/590877081.db2.gz DRHOYXHYMUPGNX-UHFFFAOYSA-N 1 2 213.321 2.098 20 0 BEADLO OCCCCCC[N@H+]1OC2CCC1CC2 ZINC000879799465 590877083 /nfs/dbraw/zinc/87/70/83/590877083.db2.gz DRHOYXHYMUPGNX-UHFFFAOYSA-N 1 2 213.321 2.098 20 0 BEADLO C[C@]1(C(F)(F)F)CC[N@H+](Cc2ncccn2)C1 ZINC000880003739 590906709 /nfs/dbraw/zinc/90/67/09/590906709.db2.gz MULDRVFTZOJJIL-JTQLQIEISA-N 1 2 245.248 2.251 20 0 BEADLO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2ncccn2)C1 ZINC000880003739 590906712 /nfs/dbraw/zinc/90/67/12/590906712.db2.gz MULDRVFTZOJJIL-JTQLQIEISA-N 1 2 245.248 2.251 20 0 BEADLO CCCc1noc(C[N@@H+]2CCC[C@@H](CF)C2)n1 ZINC000880231241 590963036 /nfs/dbraw/zinc/96/30/36/590963036.db2.gz WFJKBZIYMIOYKC-JTQLQIEISA-N 1 2 241.310 2.204 20 0 BEADLO CCCc1noc(C[N@H+]2CCC[C@@H](CF)C2)n1 ZINC000880231241 590963038 /nfs/dbraw/zinc/96/30/38/590963038.db2.gz WFJKBZIYMIOYKC-JTQLQIEISA-N 1 2 241.310 2.204 20 0 BEADLO CCCc1noc(C[N@@H+]2CCC[C@H](CF)C2)n1 ZINC000880231242 590963314 /nfs/dbraw/zinc/96/33/14/590963314.db2.gz WFJKBZIYMIOYKC-SNVBAGLBSA-N 1 2 241.310 2.204 20 0 BEADLO CCCc1noc(C[N@H+]2CCC[C@H](CF)C2)n1 ZINC000880231242 590963320 /nfs/dbraw/zinc/96/33/20/590963320.db2.gz WFJKBZIYMIOYKC-SNVBAGLBSA-N 1 2 241.310 2.204 20 0 BEADLO CC(C)c1noc(C[N@@H+]2CCC[C@H](CF)C2)n1 ZINC000880230753 590963746 /nfs/dbraw/zinc/96/37/46/590963746.db2.gz OVOVGMDUMRDYCB-SNVBAGLBSA-N 1 2 241.310 2.375 20 0 BEADLO CC(C)c1noc(C[N@H+]2CCC[C@H](CF)C2)n1 ZINC000880230753 590963749 /nfs/dbraw/zinc/96/37/49/590963749.db2.gz OVOVGMDUMRDYCB-SNVBAGLBSA-N 1 2 241.310 2.375 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CCC[C@H](CF)C2)o1 ZINC000880231972 590963779 /nfs/dbraw/zinc/96/37/79/590963779.db2.gz CIMUOWUXRUTQCC-SNVBAGLBSA-N 1 2 241.310 2.375 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CCC[C@H](CF)C2)o1 ZINC000880231972 590963781 /nfs/dbraw/zinc/96/37/81/590963781.db2.gz CIMUOWUXRUTQCC-SNVBAGLBSA-N 1 2 241.310 2.375 20 0 BEADLO CC(C)(C)c1nnc(C[NH+]2CCC(F)CC2)[nH]1 ZINC000880239250 590972320 /nfs/dbraw/zinc/97/23/20/590972320.db2.gz COSCEISQUHBELE-UHFFFAOYSA-N 1 2 240.326 2.036 20 0 BEADLO CCCNc1cc(N[C@H](C)CSC)nc[nH+]1 ZINC000128320194 590979355 /nfs/dbraw/zinc/97/93/55/590979355.db2.gz MOMXWKQKCOEZPT-SECBINFHSA-N 1 2 240.376 2.462 20 0 BEADLO CCCNc1cc(N[C@H](C)CSC)[nH+]cn1 ZINC000128320194 590979356 /nfs/dbraw/zinc/97/93/56/590979356.db2.gz MOMXWKQKCOEZPT-SECBINFHSA-N 1 2 240.376 2.462 20 0 BEADLO CC(C)(C)c1noc(C[N@@H+]2CC[C@@H](CF)C2)n1 ZINC000880290904 590985360 /nfs/dbraw/zinc/98/53/60/590985360.db2.gz GMQBHPKIKUIEBB-VIFPVBQESA-N 1 2 241.310 2.159 20 0 BEADLO CC(C)(C)c1noc(C[N@H+]2CC[C@@H](CF)C2)n1 ZINC000880290904 590985361 /nfs/dbraw/zinc/98/53/61/590985361.db2.gz GMQBHPKIKUIEBB-VIFPVBQESA-N 1 2 241.310 2.159 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)C[C@@H]2C[C@H]2C2CC2)S1 ZINC000880353466 591009537 /nfs/dbraw/zinc/00/95/37/591009537.db2.gz DKJDLCFDCHFFMW-HGNGGELXSA-N 1 2 238.356 2.030 20 0 BEADLO FC(F)(F)CC[NH2+]C1(c2ncccn2)CCC1 ZINC000880365658 591010611 /nfs/dbraw/zinc/01/06/11/591010611.db2.gz NYLHKSWFOZYXFQ-UHFFFAOYSA-N 1 2 245.248 2.398 20 0 BEADLO C[C@H]1c2sccc2CC[N@H+]1Cc1cnon1 ZINC000880376063 591015848 /nfs/dbraw/zinc/01/58/48/591015848.db2.gz CMXMCQXVYSAWIS-QMMMGPOBSA-N 1 2 235.312 2.250 20 0 BEADLO C[C@H]1c2sccc2CC[N@@H+]1Cc1cnon1 ZINC000880376063 591015852 /nfs/dbraw/zinc/01/58/52/591015852.db2.gz CMXMCQXVYSAWIS-QMMMGPOBSA-N 1 2 235.312 2.250 20 0 BEADLO OC[C@H]1C=CC[N@@H+]1Cc1c(F)cccc1Cl ZINC000880483158 591056256 /nfs/dbraw/zinc/05/62/56/591056256.db2.gz BUJQXVCLHRULIR-SECBINFHSA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@H]1C=CC[N@H+]1Cc1c(F)cccc1Cl ZINC000880483158 591056261 /nfs/dbraw/zinc/05/62/61/591056261.db2.gz BUJQXVCLHRULIR-SECBINFHSA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@H]1C=CC[N@@H+]1Cc1cc(F)ccc1Cl ZINC000880488530 591064159 /nfs/dbraw/zinc/06/41/59/591064159.db2.gz GZYXYRBVKLFRRB-LLVKDONJSA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@H]1C=CC[N@H+]1Cc1cc(F)ccc1Cl ZINC000880488530 591064162 /nfs/dbraw/zinc/06/41/62/591064162.db2.gz GZYXYRBVKLFRRB-LLVKDONJSA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@@H]1C=CC[N@@H+]1Cc1ccc(Cl)c(F)c1 ZINC000880489315 591065401 /nfs/dbraw/zinc/06/54/01/591065401.db2.gz SINZZDOSFUXSEP-JTQLQIEISA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@@H]1C=CC[N@H+]1Cc1ccc(Cl)c(F)c1 ZINC000880489315 591065406 /nfs/dbraw/zinc/06/54/06/591065406.db2.gz SINZZDOSFUXSEP-JTQLQIEISA-N 1 2 241.693 2.212 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3ncncc3C2)cs1 ZINC000880597672 591106599 /nfs/dbraw/zinc/10/65/99/591106599.db2.gz CYUYTIQOOXYKTR-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cc(C[N@H+]2CCc3ncncc3C2)cs1 ZINC000880597672 591106600 /nfs/dbraw/zinc/10/66/00/591106600.db2.gz CYUYTIQOOXYKTR-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1[nH+]cnc(NCCc2ccccn2)c1C ZINC000881738795 591268466 /nfs/dbraw/zinc/26/84/66/591268466.db2.gz CQFVGZCXLFVKRW-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO Cc1ncnc(NCCNc2cccc[nH+]2)c1C ZINC000881771598 591269961 /nfs/dbraw/zinc/26/99/61/591269961.db2.gz XPUZLWMVCWDHDN-UHFFFAOYSA-N 1 2 243.314 2.012 20 0 BEADLO Cc1[nH+]cnc(N2C[C@@H]3[C@H](C2)C3(C)C)c1C ZINC000882024867 591288795 /nfs/dbraw/zinc/28/87/95/591288795.db2.gz ZTBZGTFIMRUGAF-PHIMTYICSA-N 1 2 217.316 2.186 20 0 BEADLO Cc1[nH+]cnc(N2C[C@H](C)[C@H](C)C2)c1C ZINC000882036815 591290283 /nfs/dbraw/zinc/29/02/83/591290283.db2.gz MWJIKCHDXAFFKN-DTORHVGOSA-N 1 2 205.305 2.186 20 0 BEADLO Cc1[nH+]cnc(N2C[C@@H](C)[C@H](C)C2)c1C ZINC000882036817 591290334 /nfs/dbraw/zinc/29/03/34/591290334.db2.gz MWJIKCHDXAFFKN-RKDXNWHRSA-N 1 2 205.305 2.186 20 0 BEADLO Cc1[nH+]cnc(NCC2(CCO)CCCC2)c1C ZINC000882040873 591291638 /nfs/dbraw/zinc/29/16/38/591291638.db2.gz ZPEFHSKTDINPOY-UHFFFAOYSA-N 1 2 249.358 2.448 20 0 BEADLO Cc1[nH+]cnc(NCc2ccc(F)cn2)c1C ZINC000882099687 591298075 /nfs/dbraw/zinc/29/80/75/591298075.db2.gz YGVOPKYJHBHRJE-UHFFFAOYSA-N 1 2 232.262 2.240 20 0 BEADLO Cc1[nH+]cnc(N(C)CCC2CC2)c1C ZINC000882121303 591301316 /nfs/dbraw/zinc/30/13/16/591301316.db2.gz FSBYBUWXKUCVOW-UHFFFAOYSA-N 1 2 205.305 2.330 20 0 BEADLO Cc1[nH+]cnc(NCc2ncccc2F)c1C ZINC000882125614 591301518 /nfs/dbraw/zinc/30/15/18/591301518.db2.gz KTOWGYRJRRRYPN-UHFFFAOYSA-N 1 2 232.262 2.240 20 0 BEADLO C[C@@H](Nc1cc(CO)cc[nH+]1)c1ccc[nH]1 ZINC000882139248 591304886 /nfs/dbraw/zinc/30/48/86/591304886.db2.gz UIYYKXPSUCZRHL-SECBINFHSA-N 1 2 217.272 2.075 20 0 BEADLO CCC1(CO)CCN(c2nc[nH+]c(C)c2C)CC1 ZINC000882145708 591305673 /nfs/dbraw/zinc/30/56/73/591305673.db2.gz UDTAGEHAZLBCHG-UHFFFAOYSA-N 1 2 249.358 2.082 20 0 BEADLO Cc1[nH+]cnc(NC2C[C@@H](C)O[C@H](C)C2)c1C ZINC000882148624 591306287 /nfs/dbraw/zinc/30/62/87/591306287.db2.gz FQNRSNCSZXGKTJ-RKDXNWHRSA-N 1 2 235.331 2.461 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2CCO[C@H](C)C2)c1C ZINC000882154339 591307506 /nfs/dbraw/zinc/30/75/06/591307506.db2.gz YKEDERMAPFIFBA-KCJUWKMLSA-N 1 2 221.304 2.073 20 0 BEADLO Cc1[nH+]cnc(N(C)C[C@H]2CCCC[C@H]2O)c1C ZINC000882165546 591309379 /nfs/dbraw/zinc/30/93/79/591309379.db2.gz AZQDWFXWZZKVFP-CHWSQXEVSA-N 1 2 249.358 2.081 20 0 BEADLO Cc1[nH+]cnc(N(C)C[C@@H]2CCCC[C@@H]2O)c1C ZINC000882165549 591309795 /nfs/dbraw/zinc/30/97/95/591309795.db2.gz AZQDWFXWZZKVFP-STQMWFEESA-N 1 2 249.358 2.081 20 0 BEADLO C[C@@H]1CC[C@H](Nc2cc(CO)cc[nH+]2)C1 ZINC000882228926 591318055 /nfs/dbraw/zinc/31/80/55/591318055.db2.gz GIFYAVGETHNDRA-KOLCDFICSA-N 1 2 206.289 2.174 20 0 BEADLO Fc1c[nH+]ccc1N1CCC(F)(F)CC1 ZINC000882290204 591326908 /nfs/dbraw/zinc/32/69/08/591326908.db2.gz HEUFXOCABFHGNO-UHFFFAOYSA-N 1 2 216.206 2.456 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2C[C@@H]2c2cccnc2)c1C ZINC000882325907 591331538 /nfs/dbraw/zinc/33/15/38/591331538.db2.gz UNKUFCVBPCKJSL-OLZOCXBDSA-N 1 2 240.310 2.456 20 0 BEADLO Cc1[nH+]cnc(NC[C@H]2CCOC[C@@H]2C)c1C ZINC000882353880 591336769 /nfs/dbraw/zinc/33/67/69/591336769.db2.gz VGCBWQMFKBWXOK-JOYOIKCWSA-N 1 2 235.331 2.178 20 0 BEADLO CCC(C)(C)c1nnc(NCc2c[nH+]cn2C)o1 ZINC000882385009 591341381 /nfs/dbraw/zinc/34/13/81/591341381.db2.gz YNCYMJQYWZMXMG-UHFFFAOYSA-N 1 2 249.318 2.103 20 0 BEADLO CS[C@@H]1CCN(c2nc[nH+]c(C)c2C)C1 ZINC000882412020 591343723 /nfs/dbraw/zinc/34/37/23/591343723.db2.gz UTOODRQTVMWHFO-SNVBAGLBSA-N 1 2 223.345 2.035 20 0 BEADLO Cc1cnc(C)c(N[C@@H]2C[C@@H](C)n3cc[nH+]c32)n1 ZINC000882426597 591346509 /nfs/dbraw/zinc/34/65/09/591346509.db2.gz NBATXDMUWAAUSG-MWLCHTKSSA-N 1 2 243.314 2.408 20 0 BEADLO CCc1ncc(CNc2nc[nH+]c(C)c2C)o1 ZINC000882428524 591347061 /nfs/dbraw/zinc/34/70/61/591347061.db2.gz KLLPEMQIQAQTSE-UHFFFAOYSA-N 1 2 232.287 2.256 20 0 BEADLO Cc1n[nH]c(C)c1CCNc1nc[nH+]c(C)c1C ZINC000882429187 591347729 /nfs/dbraw/zinc/34/77/29/591347729.db2.gz HHBUVXZUTKESPZ-UHFFFAOYSA-N 1 2 245.330 2.088 20 0 BEADLO COC[C@H]1CCCN(c2nc[nH+]c(C)c2C)CC1 ZINC000882435166 591348580 /nfs/dbraw/zinc/34/85/80/591348580.db2.gz XQXWQGOLHMKHBE-ZDUSSCGKSA-N 1 2 249.358 2.346 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2C[C@H](C)O[C@H]2C)c1C ZINC000882459684 591351749 /nfs/dbraw/zinc/35/17/49/591351749.db2.gz MEVHJDNJICVPOP-UWJYBYFXSA-N 1 2 235.331 2.319 20 0 BEADLO Cc1ccnc([C@H](C)Nc2nc[nH+]c(C)c2C)n1 ZINC000882469919 591353136 /nfs/dbraw/zinc/35/31/36/591353136.db2.gz VXEBMUGYUFSIGU-NSHDSACASA-N 1 2 243.314 2.365 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2C[C@H]3C[C@H]3C2)c1C ZINC000882485595 591361612 /nfs/dbraw/zinc/36/16/12/591361612.db2.gz CTEPZZLUHLMYRU-JGPRNRPPSA-N 1 2 203.289 2.304 20 0 BEADLO CCC[C@@H](CCO)Nc1nc[nH+]c(C)c1C ZINC000882678539 591410400 /nfs/dbraw/zinc/41/04/00/591410400.db2.gz UWSDUJJYNNSGPH-NSHDSACASA-N 1 2 223.320 2.056 20 0 BEADLO CS[C@H]1C[C@H](Nc2nc[nH+]c(C)c2C)C1 ZINC000882687210 591411336 /nfs/dbraw/zinc/41/13/36/591411336.db2.gz BULFNVOBKLVQPX-MGCOHNPYSA-N 1 2 223.345 2.399 20 0 BEADLO COCC(C)(C)CCNc1cc(CO)cc[nH+]1 ZINC000882715376 591419590 /nfs/dbraw/zinc/41/95/90/591419590.db2.gz ZGGNRLWLVYVNAF-UHFFFAOYSA-N 1 2 238.331 2.049 20 0 BEADLO COC(=O)Cc1cc[nH+]c(NC[C@H]2C=CCC2)c1 ZINC000882756575 591430530 /nfs/dbraw/zinc/43/05/30/591430530.db2.gz HBJHBCYDCOCCES-NSHDSACASA-N 1 2 246.310 2.175 20 0 BEADLO C=C/C=C/CCNc1cc(CO)cc[nH+]1 ZINC000882795953 591441696 /nfs/dbraw/zinc/44/16/96/591441696.db2.gz XZOVFCITHSYALE-ONEGZZNKSA-N 1 2 204.273 2.118 20 0 BEADLO CO[C@H]1C[C@H](CNc2[nH+]c(C)nc3[nH]ccc32)C1 ZINC000882798035 591441930 /nfs/dbraw/zinc/44/19/30/591441930.db2.gz NWCCEKVJMLILRQ-MGCOHNPYSA-N 1 2 246.314 2.103 20 0 BEADLO COc1ccc[nH+]c1N1CCC[C@@H](CF)C1 ZINC000882804299 591444611 /nfs/dbraw/zinc/44/46/11/591444611.db2.gz ZXLNHLYNHZGKDN-JTQLQIEISA-N 1 2 224.279 2.276 20 0 BEADLO COC[C@H]1C[C@@H](Nc2cc(C)[nH+]c(C3CC3)n2)C1 ZINC000882906094 591472704 /nfs/dbraw/zinc/47/27/04/591472704.db2.gz LKGLHRMQWCZKHW-KLPPZKSPSA-N 1 2 247.342 2.499 20 0 BEADLO FC(F)(F)OCCCOc1cc[nH+]cc1 ZINC000882988357 591496035 /nfs/dbraw/zinc/49/60/35/591496035.db2.gz MBNZKLDNVWKNHU-UHFFFAOYSA-N 1 2 221.178 2.387 20 0 BEADLO COc1ccc[nH+]c1NC1CCC2(COC2)CC1 ZINC000882994355 591499439 /nfs/dbraw/zinc/49/94/39/591499439.db2.gz BLPHYGTUUOZOPL-UHFFFAOYSA-N 1 2 248.326 2.461 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ccc[nH]2)no1 ZINC000883077474 591535650 /nfs/dbraw/zinc/53/56/50/591535650.db2.gz LHESOQWUCZOHKV-VIFPVBQESA-N 1 2 205.261 2.162 20 0 BEADLO CSc1ccc(C[NH2+][C@H]2CCn3ccnc32)o1 ZINC000883131508 591546813 /nfs/dbraw/zinc/54/68/13/591546813.db2.gz FTDBGBAYHDGCTJ-JTQLQIEISA-N 1 2 249.339 2.433 20 0 BEADLO CC(C)c1c[nH]c(C[NH2+][C@H](C)c2ccn(C)n2)n1 ZINC000883145063 591550871 /nfs/dbraw/zinc/55/08/71/591550871.db2.gz LPALGMDFOQBSMV-SNVBAGLBSA-N 1 2 247.346 2.117 20 0 BEADLO CCc1cc(NCc2[nH]cc(C(C)C)[nH+]2)nn1C ZINC000883147553 591552580 /nfs/dbraw/zinc/55/25/80/591552580.db2.gz ZUFYIVMTZDVWSV-UHFFFAOYSA-N 1 2 247.346 2.441 20 0 BEADLO Cc1cc(NCC2=CCCOC2)c[nH+]c1C ZINC000883342121 591621167 /nfs/dbraw/zinc/62/11/67/591621167.db2.gz LHMCKUZHGSKIMJ-UHFFFAOYSA-N 1 2 218.300 2.457 20 0 BEADLO Cc1cc(NCc2cc[nH]n2)c[nH+]c1C ZINC000883342260 591621323 /nfs/dbraw/zinc/62/13/23/591621323.db2.gz QTUQKHUEYWRQJF-UHFFFAOYSA-N 1 2 202.261 2.034 20 0 BEADLO Cc1cc(NCc2cnn(C)c2)c[nH+]c1C ZINC000883342407 591622089 /nfs/dbraw/zinc/62/20/89/591622089.db2.gz WOFTTYJETVROLB-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO CC(C)(C)c1nn(C[NH+]2CCCC2)c(=S)[nH]1 ZINC000029218396 591779784 /nfs/dbraw/zinc/77/97/84/591779784.db2.gz XGTUPXVTOWHQFF-UHFFFAOYSA-N 1 2 240.376 2.291 20 0 BEADLO CCn1cc(C[N@H+](C)[C@@H](C)c2ccco2)nn1 ZINC000883999139 591789607 /nfs/dbraw/zinc/78/96/07/591789607.db2.gz HHWGMIDWBZHNGD-JTQLQIEISA-N 1 2 234.303 2.084 20 0 BEADLO CCn1cc(C[N@@H+](C)[C@@H](C)c2ccco2)nn1 ZINC000883999139 591789609 /nfs/dbraw/zinc/78/96/09/591789609.db2.gz HHWGMIDWBZHNGD-JTQLQIEISA-N 1 2 234.303 2.084 20 0 BEADLO Clc1ccc(NCCNc2cccc[nH+]2)nn1 ZINC000883998875 591789823 /nfs/dbraw/zinc/78/98/23/591789823.db2.gz DFQMJLWWSZTWDY-UHFFFAOYSA-N 1 2 249.705 2.049 20 0 BEADLO CCCNc1cc(N[C@@H](CC)COC)nc[nH+]1 ZINC000134146908 591893342 /nfs/dbraw/zinc/89/33/42/591893342.db2.gz DTVMFXYQUAWECT-JTQLQIEISA-N 1 2 238.335 2.135 20 0 BEADLO CCCNc1cc(N[C@@H](CC)COC)[nH+]cn1 ZINC000134146908 591893345 /nfs/dbraw/zinc/89/33/45/591893345.db2.gz DTVMFXYQUAWECT-JTQLQIEISA-N 1 2 238.335 2.135 20 0 BEADLO CCSCCC[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000134774685 591950351 /nfs/dbraw/zinc/95/03/51/591950351.db2.gz BVOZIOJTEDDAEP-SNVBAGLBSA-N 1 2 247.404 2.449 20 0 BEADLO CCc1nc(N2CCO[C@@H](C(C)(C)C)C2)cc[nH+]1 ZINC000884490571 591955216 /nfs/dbraw/zinc/95/52/16/591955216.db2.gz AIMVZLNLHNOCDE-LLVKDONJSA-N 1 2 249.358 2.290 20 0 BEADLO CCc1nc(N2CCC[C@](C)(OC)CC2)cc[nH+]1 ZINC000884494426 591955837 /nfs/dbraw/zinc/95/58/37/591955837.db2.gz SOFVHPXIWGIOHO-AWEZNQCLSA-N 1 2 249.358 2.434 20 0 BEADLO CCc1nc(N2CCC[C@@](C)(OC)C2)cc[nH+]1 ZINC000884492237 591955983 /nfs/dbraw/zinc/95/59/83/591955983.db2.gz PUHZOTJFHJYPRN-CYBMUJFWSA-N 1 2 235.331 2.044 20 0 BEADLO CCc1nc(N2CC[C@H](OC)C[C@H]2C)cc[nH+]1 ZINC000884497300 591956597 /nfs/dbraw/zinc/95/65/97/591956597.db2.gz UOGOKHQBXATLHJ-MNOVXSKESA-N 1 2 235.331 2.043 20 0 BEADLO CCc1nc(N[C@@]2(CC)CCOC2)cc[nH+]1 ZINC000884497070 591957117 /nfs/dbraw/zinc/95/71/17/591957117.db2.gz OBKIRXFHLVACQK-LBPRGKRZSA-N 1 2 221.304 2.020 20 0 BEADLO CCc1nc(N2CC3(C2)CC(F)(F)C3)cc[nH+]1 ZINC000884497290 591957123 /nfs/dbraw/zinc/95/71/23/591957123.db2.gz UKQSHYVTRQFMHG-UHFFFAOYSA-N 1 2 239.269 2.275 20 0 BEADLO CCc1nc(N[C@H]2C[C@@H]2c2cccnc2)cc[nH+]1 ZINC000884500043 591957485 /nfs/dbraw/zinc/95/74/85/591957485.db2.gz USCCRQCARUDWME-NEPJUHHUSA-N 1 2 240.310 2.402 20 0 BEADLO CCc1nc(N2CC[C@@H]2C2CC2)cc[nH+]1 ZINC000884518846 591964076 /nfs/dbraw/zinc/96/40/76/591964076.db2.gz BIZOXJWZMMTAJO-SNVBAGLBSA-N 1 2 203.289 2.028 20 0 BEADLO CCc1nc(N[C@H](C)C2(OC)CCC2)cc[nH+]1 ZINC000884531314 591968967 /nfs/dbraw/zinc/96/89/67/591968967.db2.gz JEQJPLDHDSZKNU-SNVBAGLBSA-N 1 2 235.331 2.409 20 0 BEADLO CCc1nc(N2CCOC[C@@H]2CC(C)C)cc[nH+]1 ZINC000884559770 591979714 /nfs/dbraw/zinc/97/97/14/591979714.db2.gz DHPUGYCHRWIVHQ-LBPRGKRZSA-N 1 2 249.358 2.290 20 0 BEADLO CCc1nc(N[C@@H]2C[C@H](C)O[C@@H]2C)cc[nH+]1 ZINC000884570710 591984528 /nfs/dbraw/zinc/98/45/28/591984528.db2.gz WQIOLNLCQUOGSL-IVZWLZJFSA-N 1 2 221.304 2.017 20 0 BEADLO CCc1nc(N[C@H](CC)C[C@H](C)O)cc[nH+]1 ZINC000884575928 591984824 /nfs/dbraw/zinc/98/48/24/591984824.db2.gz WDRALJXMHAESJL-VHSXEESVSA-N 1 2 223.320 2.000 20 0 BEADLO CCc1nc(N[C@@H](C)c2nccnc2C)cc[nH+]1 ZINC000884579672 591985789 /nfs/dbraw/zinc/98/57/89/591985789.db2.gz GHNGWUSKFVGDLA-JTQLQIEISA-N 1 2 243.314 2.311 20 0 BEADLO CCc1nc(NC[C@H]2CC(C)(C)CO2)cc[nH+]1 ZINC000884578647 591985964 /nfs/dbraw/zinc/98/59/64/591985964.db2.gz FYFOTCZVJJBRRD-SNVBAGLBSA-N 1 2 235.331 2.266 20 0 BEADLO CCc1nc(N2CCC[C@H](C(C)(C)O)C2)cc[nH+]1 ZINC000884578675 591986222 /nfs/dbraw/zinc/98/62/22/591986222.db2.gz GXCLUXMUXHOQOH-NSHDSACASA-N 1 2 249.358 2.026 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@@H]([C@H]2CCCO2)C1 ZINC000884743424 592016493 /nfs/dbraw/zinc/01/64/93/592016493.db2.gz YJMAHUZLBIJASC-ZWNOBZJWSA-N 1 2 236.290 2.226 20 0 BEADLO CN(CCCF)c1cc[nH+]c(C2CC2)n1 ZINC000884857435 592025495 /nfs/dbraw/zinc/02/54/95/592025495.db2.gz XIDGEWDMTKTZTA-UHFFFAOYSA-N 1 2 209.268 2.150 20 0 BEADLO Cc1n[nH]c(C[NH2+]Cc2cc(C(C)C)no2)c1C ZINC000885985221 592121700 /nfs/dbraw/zinc/12/17/00/592121700.db2.gz BPMRTMPFHPZVIP-UHFFFAOYSA-N 1 2 248.330 2.428 20 0 BEADLO FC(F)C[N@H+](C[C@@H]1C[C@@]12CCOC2)C1CC1 ZINC000886002076 592127381 /nfs/dbraw/zinc/12/73/81/592127381.db2.gz QCEIRGJSXDAMKA-JOYOIKCWSA-N 1 2 231.286 2.143 20 0 BEADLO FC(F)C[N@@H+](C[C@@H]1C[C@@]12CCOC2)C1CC1 ZINC000886002076 592127382 /nfs/dbraw/zinc/12/73/82/592127382.db2.gz QCEIRGJSXDAMKA-JOYOIKCWSA-N 1 2 231.286 2.143 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)NCC1CCC=CCC1 ZINC000886017438 592131770 /nfs/dbraw/zinc/13/17/70/592131770.db2.gz BAHDDMJNVCXURN-UHFFFAOYSA-N 1 2 247.342 2.205 20 0 BEADLO COc1ccc(C)[nH+]c1NCc1n[nH]c(C)c1C ZINC000886026590 592135654 /nfs/dbraw/zinc/13/56/54/592135654.db2.gz ZGNDNUFPYGXJTM-UHFFFAOYSA-N 1 2 246.314 2.351 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@@H+]1CCSC(F)(F)F ZINC000886041165 592139028 /nfs/dbraw/zinc/13/90/28/592139028.db2.gz KWEBMDRVEGAUDZ-SFYZADRCSA-N 1 2 243.294 2.349 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@H+]1CCSC(F)(F)F ZINC000886041165 592139029 /nfs/dbraw/zinc/13/90/29/592139029.db2.gz KWEBMDRVEGAUDZ-SFYZADRCSA-N 1 2 243.294 2.349 20 0 BEADLO Cc1n[nH]c(CNc2c[nH+]ccc2C)c1C ZINC000886041988 592139273 /nfs/dbraw/zinc/13/92/73/592139273.db2.gz UHHRZXVHVAGAQZ-UHFFFAOYSA-N 1 2 216.288 2.342 20 0 BEADLO C[C@H]1OCC[N@H+](CCSC(F)(F)F)[C@@H]1C ZINC000886041163 592139365 /nfs/dbraw/zinc/13/93/65/592139365.db2.gz KWEBMDRVEGAUDZ-HTQZYQBOSA-N 1 2 243.294 2.349 20 0 BEADLO C[C@H]1OCC[N@@H+](CCSC(F)(F)F)[C@@H]1C ZINC000886041163 592139367 /nfs/dbraw/zinc/13/93/67/592139367.db2.gz KWEBMDRVEGAUDZ-HTQZYQBOSA-N 1 2 243.294 2.349 20 0 BEADLO CCC(F)(F)C[NH2+]Cc1[nH]nc(C)c1C ZINC000886169708 592168698 /nfs/dbraw/zinc/16/86/98/592168698.db2.gz GMCMNJUPKXFJFN-UHFFFAOYSA-N 1 2 217.263 2.161 20 0 BEADLO Cc1coc(C[NH2+]Cc2ncnn2C(C)(C)C)c1 ZINC000886106754 592156288 /nfs/dbraw/zinc/15/62/88/592156288.db2.gz CJRKCRPFJHTUDQ-UHFFFAOYSA-N 1 2 248.330 2.224 20 0 BEADLO Cc1n[nH]c(C[NH2+]Cc2cc(C3CC3)no2)c1C ZINC000886269173 592191602 /nfs/dbraw/zinc/19/16/02/592191602.db2.gz NVJATTHKEIGMTL-UHFFFAOYSA-N 1 2 246.314 2.182 20 0 BEADLO O[C@@H]1CC[N@H+](CC[C@@H]2C[C@H]2C2CC2)CC1(F)F ZINC000886277609 592196045 /nfs/dbraw/zinc/19/60/45/592196045.db2.gz WOKYHBAVYSFIPC-GRYCIOLGSA-N 1 2 245.313 2.125 20 0 BEADLO O[C@@H]1CC[N@@H+](CC[C@@H]2C[C@H]2C2CC2)CC1(F)F ZINC000886277609 592196048 /nfs/dbraw/zinc/19/60/48/592196048.db2.gz WOKYHBAVYSFIPC-GRYCIOLGSA-N 1 2 245.313 2.125 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)C[C@H]1CC[C@H](C2CC2)O1 ZINC000886306000 592203827 /nfs/dbraw/zinc/20/38/27/592203827.db2.gz WFFXKPAYOQPLMX-ZIAGYGMSSA-N 1 2 249.358 2.108 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)C[C@H]1CC[C@H](C2CC2)O1 ZINC000886306000 592203828 /nfs/dbraw/zinc/20/38/28/592203828.db2.gz WFFXKPAYOQPLMX-ZIAGYGMSSA-N 1 2 249.358 2.108 20 0 BEADLO CO[C@H](C)c1nc(C[N@@H+]2C[C@@H]3C[C@@H]3C2)cs1 ZINC000886336709 592211815 /nfs/dbraw/zinc/21/18/15/592211815.db2.gz VRRDZAUBHLGJMU-BBBLOLIVSA-N 1 2 238.356 2.302 20 0 BEADLO CO[C@H](C)c1nc(C[N@H+]2C[C@@H]3C[C@@H]3C2)cs1 ZINC000886336709 592211818 /nfs/dbraw/zinc/21/18/18/592211818.db2.gz VRRDZAUBHLGJMU-BBBLOLIVSA-N 1 2 238.356 2.302 20 0 BEADLO Cc1cccc(C[NH2+][C@@H](C)c2ncco2)n1 ZINC000886532534 592249485 /nfs/dbraw/zinc/24/94/85/592249485.db2.gz KUZSDCGCNHUHAP-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO Fc1cccnc1C[NH2+][C@H]1CCc2cccnc21 ZINC000886555560 592259205 /nfs/dbraw/zinc/25/92/05/592259205.db2.gz WDUBTEVRUIFLRB-LBPRGKRZSA-N 1 2 243.285 2.393 20 0 BEADLO COC(=O)[C@@H]1CC[C@H]([NH2+]c2ccc(OC)cc2)C1 ZINC000886564229 592262074 /nfs/dbraw/zinc/26/20/74/592262074.db2.gz QLWKKMFWOKQQMT-PWSUYJOCSA-N 1 2 249.310 2.449 20 0 BEADLO CC/C(C)=C\C(=O)N1CCc2c([nH+]cn2CC)C1 ZINC000886611422 592274128 /nfs/dbraw/zinc/27/41/28/592274128.db2.gz BHZSJGKIYSBPIV-FLIBITNWSA-N 1 2 247.342 2.144 20 0 BEADLO C/C=C(/CC)C(=O)N1CCc2c([nH+]cn2CC)C1 ZINC000886614855 592275820 /nfs/dbraw/zinc/27/58/20/592275820.db2.gz LWBGUENRQUOCQC-WCIBSUBMSA-N 1 2 247.342 2.144 20 0 BEADLO CCc1ncc(C[NH2+][C@H]2CCc3cccnc32)o1 ZINC000886620407 592278298 /nfs/dbraw/zinc/27/82/98/592278298.db2.gz JFCCFYRANVZPMW-LBPRGKRZSA-N 1 2 243.310 2.409 20 0 BEADLO C[C@H]([NH2+]Cc1cc(C2CC2)no1)c1cnccn1 ZINC000886683005 592302998 /nfs/dbraw/zinc/30/29/98/592302998.db2.gz VDUPRMQCKVOTIS-VIFPVBQESA-N 1 2 244.298 2.193 20 0 BEADLO FC(F)C[N@H+](CCOC(F)F)C1CCC1 ZINC000887102171 592442519 /nfs/dbraw/zinc/44/25/19/592442519.db2.gz GEGVFIRTVYNBGB-UHFFFAOYSA-N 1 2 229.217 2.345 20 0 BEADLO FC(F)C[N@@H+](CCOC(F)F)C1CCC1 ZINC000887102171 592442522 /nfs/dbraw/zinc/44/25/22/592442522.db2.gz GEGVFIRTVYNBGB-UHFFFAOYSA-N 1 2 229.217 2.345 20 0 BEADLO Cc1nnc([C@H](C)[N@H+](C)CCCF)s1 ZINC000887141034 592454585 /nfs/dbraw/zinc/45/45/85/592454585.db2.gz CHAQWXHELMIXBT-ZETCQYMHSA-N 1 2 217.313 2.199 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+](C)CCCF)s1 ZINC000887141034 592454590 /nfs/dbraw/zinc/45/45/90/592454590.db2.gz CHAQWXHELMIXBT-ZETCQYMHSA-N 1 2 217.313 2.199 20 0 BEADLO CCCC[C@@H](C)c1nc(C[NH2+]CC)no1 ZINC000300909236 592524767 /nfs/dbraw/zinc/52/47/67/592524767.db2.gz JUOYRMSDASNFKG-SECBINFHSA-N 1 2 211.309 2.473 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC1(C2CC2)CCC1 ZINC000887934413 592561280 /nfs/dbraw/zinc/56/12/80/592561280.db2.gz XIAVLHDHVTVFIN-UHFFFAOYSA-N 1 2 245.326 2.266 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)C1(C2CC2)CC1 ZINC000889225120 592590249 /nfs/dbraw/zinc/59/02/49/592590249.db2.gz HPLNBFJNYLKEKN-UHFFFAOYSA-N 1 2 241.294 2.463 20 0 BEADLO CCCCC1(C(=O)NCc2cn(C)c[nH+]2)CC1 ZINC000890100707 592680637 /nfs/dbraw/zinc/68/06/37/592680637.db2.gz WKYNSTLICKJLJN-UHFFFAOYSA-N 1 2 235.331 2.007 20 0 BEADLO CC[C@@H]1CCCC[C@H]1C(=O)NCc1cn(C)c[nH+]1 ZINC000890106485 592681517 /nfs/dbraw/zinc/68/15/17/592681517.db2.gz ALDPPCQIXNNVSS-DGCLKSJQSA-N 1 2 249.358 2.253 20 0 BEADLO CC[C@@H](CC(C)C)C(=O)NCc1cn(C)c[nH+]1 ZINC000890104695 592682042 /nfs/dbraw/zinc/68/20/42/592682042.db2.gz PBWZTTOUQWYHMO-NSHDSACASA-N 1 2 237.347 2.109 20 0 BEADLO Cn1c[nH+]c(CNC(=O)CCCC2CCCC2)c1 ZINC000890109469 592682733 /nfs/dbraw/zinc/68/27/33/592682733.db2.gz CCWYHPSSXHCLSB-UHFFFAOYSA-N 1 2 249.358 2.397 20 0 BEADLO CCC[C@H]1CCC[C@H]1C(=O)NCc1cn(C)c[nH+]1 ZINC000890107810 592683046 /nfs/dbraw/zinc/68/30/46/592683046.db2.gz QXUPZRKDWHRIBQ-WCQYABFASA-N 1 2 249.358 2.253 20 0 BEADLO Cn1c[nH+]c(CNC(=O)C2CCCCCCC2)c1 ZINC000890114213 592684005 /nfs/dbraw/zinc/68/40/05/592684005.db2.gz YLAAKCFNFBUDJY-UHFFFAOYSA-N 1 2 249.358 2.397 20 0 BEADLO CC(C)CC(C)(C)C(=O)NCc1cn(C)c[nH+]1 ZINC000890109557 592684161 /nfs/dbraw/zinc/68/41/61/592684161.db2.gz DUAYBUNRVXEOSX-UHFFFAOYSA-N 1 2 237.347 2.109 20 0 BEADLO CCCC(CCC)C(=O)NCc1cn(C)c[nH+]1 ZINC000890110286 592684493 /nfs/dbraw/zinc/68/44/93/592684493.db2.gz YHUFSXZZLBJICS-UHFFFAOYSA-N 1 2 237.347 2.253 20 0 BEADLO CNc1cc(N[C@@H](C)C2CCC2)[nH+]cn1 ZINC000124428540 634422302 /nfs/dbraw/zinc/42/23/02/634422302.db2.gz NNEWVIXPMOCNDD-QMMMGPOBSA-N 1 2 206.293 2.119 20 0 BEADLO CC1(C)CCC[C@H](CNC(=O)Cc2c[nH]c[nH+]2)C1 ZINC000909398717 634613255 /nfs/dbraw/zinc/61/32/55/634613255.db2.gz MYQLFWOUWSMMOX-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]C/C=C\Cl)no1 ZINC000308328058 631223380 /nfs/dbraw/zinc/22/33/80/631223380.db2.gz IDQLBJGLDCUQCF-TUUFMJSCSA-N 1 2 200.669 2.386 20 0 BEADLO C[C@@H]1CCOCC[N@@H+]1C/C(Cl)=C\Cl ZINC000308310264 631277459 /nfs/dbraw/zinc/27/74/59/631277459.db2.gz QVFDCXMGXPJTNG-GTUWVTDSSA-N 1 2 224.131 2.416 20 0 BEADLO C[C@@H]1CCOCC[N@H+]1C/C(Cl)=C\Cl ZINC000308310264 631277465 /nfs/dbraw/zinc/27/74/65/631277465.db2.gz QVFDCXMGXPJTNG-GTUWVTDSSA-N 1 2 224.131 2.416 20 0 BEADLO CCc1[nH]nc(Cl)c1C[N@H+](C)C1CC1 ZINC000891619998 631412848 /nfs/dbraw/zinc/41/28/48/631412848.db2.gz LZRCJSGXJXFNLA-UHFFFAOYSA-N 1 2 213.712 2.220 20 0 BEADLO CCc1[nH]nc(Cl)c1C[N@@H+](C)C1CC1 ZINC000891619998 631412849 /nfs/dbraw/zinc/41/28/49/631412849.db2.gz LZRCJSGXJXFNLA-UHFFFAOYSA-N 1 2 213.712 2.220 20 0 BEADLO CCC[C@@H](C)N(C)c1nccn2c[nH+]cc12 ZINC000891809508 631497692 /nfs/dbraw/zinc/49/76/92/631497692.db2.gz NRWBKXUYQKIBRB-SNVBAGLBSA-N 1 2 218.304 2.354 20 0 BEADLO C[C@@H](c1cc(F)ccc1F)[N@@H+]1CC[C@@H]1CO ZINC000934027499 631617957 /nfs/dbraw/zinc/61/79/57/631617957.db2.gz VAFCWTUJPRKLRT-WCBMZHEXSA-N 1 2 227.254 2.092 20 0 BEADLO C[C@@H](c1cc(F)ccc1F)[N@H+]1CC[C@@H]1CO ZINC000934027499 631617966 /nfs/dbraw/zinc/61/79/66/631617966.db2.gz VAFCWTUJPRKLRT-WCBMZHEXSA-N 1 2 227.254 2.092 20 0 BEADLO Cc1nc(C[NH2+][C@@H](C)c2cncs2)[nH]c1C ZINC000934196660 631726974 /nfs/dbraw/zinc/72/69/74/631726974.db2.gz WGLQKDBMLMKUGX-VIFPVBQESA-N 1 2 236.344 2.334 20 0 BEADLO Cc1[nH]c(CN[C@@H](C)c2cncs2)[nH+]c1C ZINC000934196660 631726978 /nfs/dbraw/zinc/72/69/78/631726978.db2.gz WGLQKDBMLMKUGX-VIFPVBQESA-N 1 2 236.344 2.334 20 0 BEADLO C[C@@H]1CCCN(c2nccn3c[nH+]cc23)CC1 ZINC000892103163 631729086 /nfs/dbraw/zinc/72/90/86/631729086.db2.gz UYUOYPQNWPLJDP-LLVKDONJSA-N 1 2 230.315 2.356 20 0 BEADLO Cc1occc1C[NH2+][C@@H](C)c1ncc[nH]1 ZINC000309154797 631910715 /nfs/dbraw/zinc/91/07/15/631910715.db2.gz XCXIQAZVDOYZCM-QMMMGPOBSA-N 1 2 205.261 2.162 20 0 BEADLO Cc1ccc(C[N@@H+]2CC[C@@H](O)[C@@H](F)C2)cc1F ZINC000934569437 631939786 /nfs/dbraw/zinc/93/97/86/631939786.db2.gz YEEKVLLYJRNLEZ-QWHCGFSZSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1ccc(C[N@H+]2CC[C@@H](O)[C@@H](F)C2)cc1F ZINC000934569437 631939790 /nfs/dbraw/zinc/93/97/90/631939790.db2.gz YEEKVLLYJRNLEZ-QWHCGFSZSA-N 1 2 241.281 2.039 20 0 BEADLO C[C@H](c1ccc(F)cc1)[N@@H+]1CC[C@@H](O)[C@H](F)C1 ZINC000934582514 631952896 /nfs/dbraw/zinc/95/28/96/631952896.db2.gz QRNGULWDQBVLFG-OASPWFOLSA-N 1 2 241.281 2.291 20 0 BEADLO C[C@H](c1ccc(F)cc1)[N@H+]1CC[C@@H](O)[C@H](F)C1 ZINC000934582514 631952901 /nfs/dbraw/zinc/95/29/01/631952901.db2.gz QRNGULWDQBVLFG-OASPWFOLSA-N 1 2 241.281 2.291 20 0 BEADLO CC[NH2+]Cc1noc(Cc2ccc(C)cc2)n1 ZINC000051860829 631973502 /nfs/dbraw/zinc/97/35/02/631973502.db2.gz ZMJLRXNOMKLFGH-UHFFFAOYSA-N 1 2 231.299 2.078 20 0 BEADLO CCC1CC[NH+](Cn2ncn(C)c2=S)CC1 ZINC000077447284 632111061 /nfs/dbraw/zinc/11/10/61/632111061.db2.gz NLGFSLDYMOBYQI-UHFFFAOYSA-N 1 2 240.376 2.031 20 0 BEADLO CC[NH2+]Cc1noc(C2(CC)CCC2)n1 ZINC000309527103 632470005 /nfs/dbraw/zinc/47/00/05/632470005.db2.gz AYHZEEKWRNNXMM-UHFFFAOYSA-N 1 2 209.293 2.011 20 0 BEADLO CC[C@@]1([NH2+]CC(F)(F)C(F)F)CCOC1 ZINC000309164434 632655252 /nfs/dbraw/zinc/65/52/52/632655252.db2.gz IIKOUQDZLRKGEC-MRVPVSSYSA-N 1 2 229.217 2.046 20 0 BEADLO C[C@@H]([NH2+]C[C@H](C)O)C(F)(F)c1ccccc1 ZINC000924528261 632696588 /nfs/dbraw/zinc/69/65/88/632696588.db2.gz MSCHEGIIQTYKSY-VHSXEESVSA-N 1 2 229.270 2.137 20 0 BEADLO Cc1nonc1[C@@H](C)[NH2+]Cc1ccccc1 ZINC000924541017 632784223 /nfs/dbraw/zinc/78/42/23/632784223.db2.gz IAPDIBLIWAXDKB-SECBINFHSA-N 1 2 217.272 2.229 20 0 BEADLO COc1cc([C@H](C)[NH2+][C@H](C)c2ccccn2)on1 ZINC000924543806 632795296 /nfs/dbraw/zinc/79/52/96/632795296.db2.gz SCCFRYVRIPDHAU-ZJUUUORDSA-N 1 2 247.298 2.490 20 0 BEADLO C[C@@H](O)[C@H]([NH2+][C@@H](C)c1ncco1)c1ccccc1 ZINC000926730599 632900063 /nfs/dbraw/zinc/90/00/63/632900063.db2.gz ACRQDFFJUMXEJU-LOWVWBTDSA-N 1 2 246.310 2.447 20 0 BEADLO CCCOC(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000180775446 633052205 /nfs/dbraw/zinc/05/22/05/633052205.db2.gz VULSNWDFURLXMY-UHFFFAOYSA-N 1 2 230.267 2.439 20 0 BEADLO Cc1ncoc1C[N@@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000894741824 635918800 /nfs/dbraw/zinc/91/88/00/635918800.db2.gz YYEYHEJDUZQNNU-GFCCVEGCSA-N 1 2 246.314 2.433 20 0 BEADLO Cc1ncoc1C[N@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000894741824 635918803 /nfs/dbraw/zinc/91/88/03/635918803.db2.gz YYEYHEJDUZQNNU-GFCCVEGCSA-N 1 2 246.314 2.433 20 0 BEADLO CCc1cc(N2CCC[C@H]2COC)nc(CC)[nH+]1 ZINC000894758205 635921664 /nfs/dbraw/zinc/92/16/64/635921664.db2.gz DHQMLCWPNJEJMZ-LBPRGKRZSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@H]1COCC[N@H+](C/C(Cl)=C/Cl)C1 ZINC000306260247 635961780 /nfs/dbraw/zinc/96/17/80/635961780.db2.gz UWOKPAQACLUFTO-HMXLAXJASA-N 1 2 224.131 2.274 20 0 BEADLO C[C@H]1COCC[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000306260247 635961784 /nfs/dbraw/zinc/96/17/84/635961784.db2.gz UWOKPAQACLUFTO-HMXLAXJASA-N 1 2 224.131 2.274 20 0 BEADLO C[N@H+](C/C(Cl)=C/Cl)[C@@H]1CCCOC1 ZINC000306747241 635975666 /nfs/dbraw/zinc/97/56/66/635975666.db2.gz FONSDPIIKSZXHH-BZJXQOFCSA-N 1 2 224.131 2.416 20 0 BEADLO C[N@@H+](C/C(Cl)=C/Cl)[C@@H]1CCCOC1 ZINC000306747241 635975669 /nfs/dbraw/zinc/97/56/69/635975669.db2.gz FONSDPIIKSZXHH-BZJXQOFCSA-N 1 2 224.131 2.416 20 0 BEADLO COC[C@@H](C)[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000237168772 636030731 /nfs/dbraw/zinc/03/07/31/636030731.db2.gz KRKXZENLQVRHPF-BDAKNGLRSA-N 1 2 241.335 2.053 20 0 BEADLO CCCC(=O)NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000049355760 636073644 /nfs/dbraw/zinc/07/36/44/636073644.db2.gz RFVCTJDILJHLTB-UHFFFAOYSA-N 1 2 243.310 2.289 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccon2)cs1 ZINC000308558005 633752195 /nfs/dbraw/zinc/75/21/95/633752195.db2.gz VIGLLASYKNJCOC-UHFFFAOYSA-N 1 2 208.286 2.334 20 0 BEADLO Cc1sccc1C[NH2+]Cc1ccon1 ZINC000308693523 633786900 /nfs/dbraw/zinc/78/69/00/633786900.db2.gz SCNVUOJTLAIQLA-UHFFFAOYSA-N 1 2 208.286 2.334 20 0 BEADLO Fc1ccccc1C1([NH2+]Cc2cnns2)CC1 ZINC000294932810 633828599 /nfs/dbraw/zinc/82/85/99/633828599.db2.gz HLVCGHUREBQYKV-UHFFFAOYSA-N 1 2 249.314 2.456 20 0 BEADLO Cc1cc(C[NH2+]Cc2cc(C)oc2C)no1 ZINC000309856406 633856994 /nfs/dbraw/zinc/85/69/94/633856994.db2.gz KPUFEJPRVUWGFM-UHFFFAOYSA-N 1 2 220.272 2.483 20 0 BEADLO CC(C)COC(=O)C[N@@H+]1CCSC(C)(C)C1 ZINC000181473704 633917630 /nfs/dbraw/zinc/91/76/30/633917630.db2.gz JJFQPMMCTSJKBH-UHFFFAOYSA-N 1 2 245.388 2.013 20 0 BEADLO CC(C)COC(=O)C[N@H+]1CCSC(C)(C)C1 ZINC000181473704 633917632 /nfs/dbraw/zinc/91/76/32/633917632.db2.gz JJFQPMMCTSJKBH-UHFFFAOYSA-N 1 2 245.388 2.013 20 0 BEADLO Fc1cc(C[NH2+]Cc2ccco2)c(F)cn1 ZINC000309642785 633982595 /nfs/dbraw/zinc/98/25/95/633982595.db2.gz PDHAJDLFPMHDLN-UHFFFAOYSA-N 1 2 224.210 2.243 20 0 BEADLO CC[C@@H]1C[C@H]1C[N@H+](C)Cc1noc(C2CC2)n1 ZINC000930737107 634077025 /nfs/dbraw/zinc/07/70/25/634077025.db2.gz JWTNOULABYMMBP-KOLCDFICSA-N 1 2 235.331 2.425 20 0 BEADLO CC[C@@H]1C[C@H]1C[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000930737107 634077027 /nfs/dbraw/zinc/07/70/27/634077027.db2.gz JWTNOULABYMMBP-KOLCDFICSA-N 1 2 235.331 2.425 20 0 BEADLO CC(=O)NCCCCC[N@@H+]1CCCC(F)(F)C1 ZINC000930847248 634135301 /nfs/dbraw/zinc/13/53/01/634135301.db2.gz CSMDGQKFMQYPDG-UHFFFAOYSA-N 1 2 248.317 2.024 20 0 BEADLO CC(=O)NCCCCC[N@H+]1CCCC(F)(F)C1 ZINC000930847248 634135304 /nfs/dbraw/zinc/13/53/04/634135304.db2.gz CSMDGQKFMQYPDG-UHFFFAOYSA-N 1 2 248.317 2.024 20 0 BEADLO Cc1cc(C[NH2+]Cc2cocn2)cc(C)c1O ZINC000397958399 634230243 /nfs/dbraw/zinc/23/02/43/634230243.db2.gz GLNJRSGMJCDLBA-UHFFFAOYSA-N 1 2 232.283 2.287 20 0 BEADLO CCC[C@@](C)([NH2+]C[C@@H]1CCC=CO1)C(=O)OC ZINC000194174937 634309136 /nfs/dbraw/zinc/30/91/36/634309136.db2.gz RIGUDMHEKFIDQR-WCQYABFASA-N 1 2 241.331 2.001 20 0 BEADLO Cc1ccc(O)c(C[N@H+](C)Cc2ccns2)n1 ZINC000895453844 636144320 /nfs/dbraw/zinc/14/43/20/636144320.db2.gz QLKLFGJYNDUGFV-UHFFFAOYSA-N 1 2 249.339 2.184 20 0 BEADLO Cc1ccc(O)c(C[N@@H+](C)Cc2ccns2)n1 ZINC000895453844 636144324 /nfs/dbraw/zinc/14/43/24/636144324.db2.gz QLKLFGJYNDUGFV-UHFFFAOYSA-N 1 2 249.339 2.184 20 0 BEADLO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)C(F)F)[C@@H]1SC ZINC000895725751 636175219 /nfs/dbraw/zinc/17/52/19/636175219.db2.gz SMBDMJNOEZOKOR-MAUMQABQSA-N 1 2 239.331 2.139 20 0 BEADLO C[C@@H](NCc1ccon1)c1cn2c([nH+]1)CCCC2 ZINC000925211265 636390144 /nfs/dbraw/zinc/39/01/44/636390144.db2.gz IRMJBXYZKKNESZ-SNVBAGLBSA-N 1 2 246.314 2.058 20 0 BEADLO C[C@@H](c1nc([C@H]2CCCS2)no1)[NH+](C)C ZINC000350610304 636433618 /nfs/dbraw/zinc/43/36/18/636433618.db2.gz YTJVGYMQSOHOMB-JGVFFNPUSA-N 1 2 227.333 2.260 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1cncc(F)c1)c1ncc[nH]1 ZINC000235533107 636635180 /nfs/dbraw/zinc/63/51/80/636635180.db2.gz VFYIAUAIMMABIJ-IUCAKERBSA-N 1 2 234.278 2.356 20 0 BEADLO O=C1c2ccccc2C/C1=C\c1[nH]cc[nH+]1 ZINC000067647679 636758436 /nfs/dbraw/zinc/75/84/36/636758436.db2.gz JCDKUOVYFABQKF-CSKARUKUSA-N 1 2 210.236 2.232 20 0 BEADLO C=C(Cl)C[N@H+]1CCC[C@H]1C(=O)N(CC)CC ZINC000067653289 636759386 /nfs/dbraw/zinc/75/93/86/636759386.db2.gz JMUGILYWESCBCD-NSHDSACASA-N 1 2 244.766 2.072 20 0 BEADLO C=C(Cl)C[N@@H+]1CCC[C@H]1C(=O)N(CC)CC ZINC000067653289 636759409 /nfs/dbraw/zinc/75/94/09/636759409.db2.gz JMUGILYWESCBCD-NSHDSACASA-N 1 2 244.766 2.072 20 0 BEADLO Cc1nnc(Cn2c[nH+]c(C(C)(C)C)c2)s1 ZINC000865376333 636813225 /nfs/dbraw/zinc/81/32/25/636813225.db2.gz JPAKGVBRBYFZAZ-UHFFFAOYSA-N 1 2 236.344 2.389 20 0 BEADLO CC(C)Cc1noc([C@@H]2C[C@H]2c2c[nH]c[nH+]2)n1 ZINC000923753651 636828116 /nfs/dbraw/zinc/82/81/16/636828116.db2.gz WJRYQZUNDRCHKT-RKDXNWHRSA-N 1 2 232.287 2.262 20 0 BEADLO CC[C@@H]1C[C@H]1CNC(=O)C(C)(C)n1c[nH+]c(C)c1 ZINC000897898292 636845291 /nfs/dbraw/zinc/84/52/91/636845291.db2.gz FBPKCDBZMSYUSJ-NEPJUHHUSA-N 1 2 249.358 2.089 20 0 BEADLO CNc1cc(N[C@H]2CC[C@@H](C)C2)[nH+]cn1 ZINC000128148416 637008514 /nfs/dbraw/zinc/00/85/14/637008514.db2.gz QOWXHBNGAGUWHI-BDAKNGLRSA-N 1 2 206.293 2.119 20 0 BEADLO CC/C=C(\C)C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000898906911 637064358 /nfs/dbraw/zinc/06/43/58/637064358.db2.gz JZDCWVTXGQBABT-IZZDOVSWSA-N 1 2 235.331 2.091 20 0 BEADLO Cc1cn(C(C)(C)C(=O)NCC2=CCCC2)c[nH+]1 ZINC000898978748 637068030 /nfs/dbraw/zinc/06/80/30/637068030.db2.gz YDSRGXYZMHILRK-UHFFFAOYSA-N 1 2 247.342 2.153 20 0 BEADLO C[C@H](NC(=O)Cc1c[nH]c[nH+]1)C1CCCCC1 ZINC000900822696 637193021 /nfs/dbraw/zinc/19/30/21/637193021.db2.gz GGUVMROEXUOXBP-JTQLQIEISA-N 1 2 235.331 2.037 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@]2(C)CCC[C@@H]2C)[nH+]c1C ZINC000901000042 637225742 /nfs/dbraw/zinc/22/57/42/637225742.db2.gz IRYKDCOSZCIDOY-XPTSAGLGSA-N 1 2 249.358 2.469 20 0 BEADLO CC1(C)CCCC[C@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000901025984 637226821 /nfs/dbraw/zinc/22/68/21/637226821.db2.gz MAKRRZWTGUGISR-LLVKDONJSA-N 1 2 235.331 2.037 20 0 BEADLO CC(C)C[C@H]1CCCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC000901029260 637229919 /nfs/dbraw/zinc/22/99/19/637229919.db2.gz MKOBYWKLXNZHIG-CYBMUJFWSA-N 1 2 249.358 2.379 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCO[C@H]3C[C@H]32)c(C)c1 ZINC000668186192 637295269 /nfs/dbraw/zinc/29/52/69/637295269.db2.gz DIGLKIQPUADJAB-CABCVRRESA-N 1 2 247.338 2.367 20 0 BEADLO CCOc1ccc(C[N@H+]2CCO[C@H]3C[C@H]32)c(C)c1 ZINC000668186192 637295289 /nfs/dbraw/zinc/29/52/89/637295289.db2.gz DIGLKIQPUADJAB-CABCVRRESA-N 1 2 247.338 2.367 20 0 BEADLO CC[C@@H](C)C(=O)N1CCC[C@@H](c2[nH+]ccn2C)C1 ZINC000347416142 637379676 /nfs/dbraw/zinc/37/96/76/637379676.db2.gz IYGUADNSJDDDOV-VXGBXAGGSA-N 1 2 249.358 2.172 20 0 BEADLO Cc1c2c(ccc1-c1[nH]cc[nH+]1)OCC2 ZINC000904859956 637499000 /nfs/dbraw/zinc/49/90/00/637499000.db2.gz UEWYMETWMFKNHI-UHFFFAOYSA-N 1 2 200.241 2.320 20 0 BEADLO CN(C)c1cc(-c2ccccc2CCO)cc[nH+]1 ZINC000904850248 637507485 /nfs/dbraw/zinc/50/74/85/637507485.db2.gz SWLUVJCIVVEUJY-UHFFFAOYSA-N 1 2 242.322 2.349 20 0 BEADLO Cc1[nH+]cc(-c2c3c(ccc2F)OCO3)n1C ZINC000904871802 637514211 /nfs/dbraw/zinc/51/42/11/637514211.db2.gz AZQIFYQTOWXFRW-UHFFFAOYSA-N 1 2 234.230 2.263 20 0 BEADLO Cc1cc(C)c(C(=O)NC(C)C)c(C)[nH+]1 ZINC000905006417 637543165 /nfs/dbraw/zinc/54/31/65/637543165.db2.gz NCMIXNYGFXIINM-UHFFFAOYSA-N 1 2 206.289 2.145 20 0 BEADLO CCCNC(=O)c1c(C)cc(C)[nH+]c1C ZINC000905079591 637580362 /nfs/dbraw/zinc/58/03/62/637580362.db2.gz BCBPPYFZQQYOPB-UHFFFAOYSA-N 1 2 206.289 2.147 20 0 BEADLO CC(C)(C)C(F)(F)C[NH2+]C[C@](C)(O)C(F)F ZINC000905380321 637782793 /nfs/dbraw/zinc/78/27/93/637782793.db2.gz FFIUHVFKYSFZRO-VIFPVBQESA-N 1 2 245.260 2.274 20 0 BEADLO Cn1c[nH+]cc1CNc1nnc(C2CCCC2)o1 ZINC000905426548 637813045 /nfs/dbraw/zinc/81/30/45/637813045.db2.gz BKFLKXWJYUSQDZ-UHFFFAOYSA-N 1 2 247.302 2.073 20 0 BEADLO CC[C@H](C)[C@@H]([NH2+][C@@H]1CC12CCC2)C(=O)OC ZINC000905779787 637907942 /nfs/dbraw/zinc/90/79/42/637907942.db2.gz ZMDJUULDDPXUOH-HBNTYKKESA-N 1 2 225.332 2.106 20 0 BEADLO CC[C@H](C)[C@@H]([NH2+]C[C@@]1(C)CC1(F)F)C(=O)OC ZINC000905772391 637927657 /nfs/dbraw/zinc/92/76/57/637927657.db2.gz DSNBQVNZTIWSJF-IQJOONFLSA-N 1 2 249.301 2.209 20 0 BEADLO CCCCCC(=O)OCCn1cc[nH+]c1 ZINC000149115918 638125737 /nfs/dbraw/zinc/12/57/37/638125737.db2.gz WODZPUDRKHWQRH-UHFFFAOYSA-N 1 2 210.277 2.007 20 0 BEADLO CC(C)C1(C)CCN(C(=O)Cc2c[nH+]c[nH]2)CC1 ZINC000907526762 638395933 /nfs/dbraw/zinc/39/59/33/638395933.db2.gz SROKFSHNAQHKON-UHFFFAOYSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@H]1CCC[C@@H](NC(=O)Cc2c[nH]c[nH+]2)CC1 ZINC000907629600 638424284 /nfs/dbraw/zinc/42/42/84/638424284.db2.gz FYUCKLLJHQOHHQ-WDEREUQCSA-N 1 2 235.331 2.037 20 0 BEADLO CC1=C(C)CN(C(=O)CNc2cccc[nH+]2)CC1 ZINC000907930993 638507600 /nfs/dbraw/zinc/50/76/00/638507600.db2.gz ZFMCEXBMPISJMV-UHFFFAOYSA-N 1 2 245.326 2.062 20 0 BEADLO C[C@@H]1CCC[C@@H](CNC(=O)Cc2c[nH]c[nH+]2)[C@H]1C ZINC000907924209 638513728 /nfs/dbraw/zinc/51/37/28/638513728.db2.gz IFQZJLKBUGDAFS-WOPDTQHZSA-N 1 2 249.358 2.141 20 0 BEADLO C=C=CCNC(=O)c1c(C)cc(C)[nH+]c1C ZINC000908336918 638656653 /nfs/dbraw/zinc/65/66/53/638656653.db2.gz ZDGFBYSOBLCBIU-UHFFFAOYSA-N 1 2 216.284 2.078 20 0 BEADLO Cc1cc(C)c(C(=O)N[C@@H](C)CF)c(C)[nH+]1 ZINC000908377364 638674233 /nfs/dbraw/zinc/67/42/33/638674233.db2.gz GETIVAYTKMVOGZ-VIFPVBQESA-N 1 2 224.279 2.095 20 0 BEADLO C/C=C(\CC)C(=O)OCCCc1[nH+]ccn1C ZINC000802790128 639230782 /nfs/dbraw/zinc/23/07/82/639230782.db2.gz UNIDLVYKIQGBEN-NYYWCZLTSA-N 1 2 236.315 2.252 20 0 BEADLO Cn1c[nH+]cc1Cc1noc([C@]2(C)C=CCC2)n1 ZINC000923961184 639391576 /nfs/dbraw/zinc/39/15/76/639391576.db2.gz HTSQAUZPLSPNLT-CYBMUJFWSA-N 1 2 244.298 2.002 20 0 BEADLO Cc1cc(C)c(C(=O)N[C@@H]2CC23CC3)c(C)[nH+]1 ZINC000911297338 639614586 /nfs/dbraw/zinc/61/45/86/639614586.db2.gz ZPZBFDVRXLHCHB-LLVKDONJSA-N 1 2 230.311 2.289 20 0 BEADLO CN(C(=O)CCc1c[nH+]cn1C)c1ccsc1 ZINC000912005681 639919236 /nfs/dbraw/zinc/91/92/36/639919236.db2.gz BYNOCGJKXHURMB-UHFFFAOYSA-N 1 2 249.339 2.077 20 0 BEADLO CC1(C)C[C@](C)([NH2+]CCc2ccccc2)C(=O)O1 ZINC000930874194 639964948 /nfs/dbraw/zinc/96/49/48/639964948.db2.gz FPVURXHVLGDKQZ-HNNXBMFYSA-N 1 2 247.338 2.303 20 0 BEADLO COCC[N@H+](CCF)[C@H](C)c1ccc(F)nc1 ZINC000930973336 640004244 /nfs/dbraw/zinc/00/42/44/640004244.db2.gz IRLNRIZKJOPETB-SNVBAGLBSA-N 1 2 244.285 2.200 20 0 BEADLO COCC[N@@H+](CCF)[C@H](C)c1ccc(F)nc1 ZINC000930973336 640004248 /nfs/dbraw/zinc/00/42/48/640004248.db2.gz IRLNRIZKJOPETB-SNVBAGLBSA-N 1 2 244.285 2.200 20 0 BEADLO Cc1cc(C)c(C(=O)N[C@@H]2C=CCC2)c(C)[nH+]1 ZINC000912388839 640048040 /nfs/dbraw/zinc/04/80/40/640048040.db2.gz YROQVDPOBIYWLS-GFCCVEGCSA-N 1 2 230.311 2.455 20 0 BEADLO C[C@H](c1ncccn1)[N@H+](C)CC1=CCSC1 ZINC000931070612 640059545 /nfs/dbraw/zinc/05/95/45/640059545.db2.gz FSEURWOHBQDRAO-SNVBAGLBSA-N 1 2 235.356 2.143 20 0 BEADLO C[C@H](c1ncccn1)[N@@H+](C)CC1=CCSC1 ZINC000931070612 640059551 /nfs/dbraw/zinc/05/95/51/640059551.db2.gz FSEURWOHBQDRAO-SNVBAGLBSA-N 1 2 235.356 2.143 20 0 BEADLO CC/C=C\CC[N@@H+]1CCC[C@H]1c1nnc[nH]1 ZINC000931139855 640077015 /nfs/dbraw/zinc/07/70/15/640077015.db2.gz AUKLYUWLSRFVBZ-BYCRGOAPSA-N 1 2 220.320 2.298 20 0 BEADLO CC/C=C\CC[N@H+]1CCC[C@H]1c1nnc[nH]1 ZINC000931139855 640077020 /nfs/dbraw/zinc/07/70/20/640077020.db2.gz AUKLYUWLSRFVBZ-BYCRGOAPSA-N 1 2 220.320 2.298 20 0 BEADLO c1nnc(C[N@@H+]2CC[C@H]3CC[C@@H](C2)S3)s1 ZINC000931174810 640089459 /nfs/dbraw/zinc/08/94/59/640089459.db2.gz VJJUDHVTOUPMOQ-BDAKNGLRSA-N 1 2 241.385 2.008 20 0 BEADLO c1nnc(C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)s1 ZINC000931174810 640089461 /nfs/dbraw/zinc/08/94/61/640089461.db2.gz VJJUDHVTOUPMOQ-BDAKNGLRSA-N 1 2 241.385 2.008 20 0 BEADLO CC/C(C)=C/C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000912613943 640136917 /nfs/dbraw/zinc/13/69/17/640136917.db2.gz DOCGUCUPCRHRCO-DHZHZOJOSA-N 1 2 235.331 2.091 20 0 BEADLO Cc1cc(C)c(C(=O)N2CC[C@H]3C[C@H]3C2)c(C)[nH+]1 ZINC000912679320 640163789 /nfs/dbraw/zinc/16/37/89/640163789.db2.gz VKTKHEWNLJFKHU-STQMWFEESA-N 1 2 244.338 2.489 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2Cc3c[nH]nc3[C@H](C)C2)o1 ZINC000931461258 640219776 /nfs/dbraw/zinc/21/97/76/640219776.db2.gz RZNWXZDFJMYQRR-MRVPVSSYSA-N 1 2 246.314 2.134 20 0 BEADLO Cc1nc(C)c(C[N@H+]2Cc3c[nH]nc3[C@H](C)C2)o1 ZINC000931461258 640219781 /nfs/dbraw/zinc/21/97/81/640219781.db2.gz RZNWXZDFJMYQRR-MRVPVSSYSA-N 1 2 246.314 2.134 20 0 BEADLO CCC(NC(=O)Cc1c[nH]c[nH+]1)(C1CC1)C1CC1 ZINC000912996435 640277732 /nfs/dbraw/zinc/27/77/32/640277732.db2.gz PARONJRCSGWMMW-UHFFFAOYSA-N 1 2 247.342 2.037 20 0 BEADLO CC/C=C(/C)C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000075532254 640402153 /nfs/dbraw/zinc/40/21/53/640402153.db2.gz GIYNZTASIIHPIH-DKRCXCIFSA-N 1 2 247.342 2.472 20 0 BEADLO Clc1csc(NCCCn2cc[nH+]c2)n1 ZINC000164977548 640521610 /nfs/dbraw/zinc/52/16/10/640521610.db2.gz FGSAMQOEUWEYHH-UHFFFAOYSA-N 1 2 242.735 2.495 20 0 BEADLO CCCCC1(C(=O)NCCc2[nH]cc[nH+]2)CC1 ZINC000932475257 640543222 /nfs/dbraw/zinc/54/32/22/640543222.db2.gz LZSBUZFXZBIMIQ-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCn2cccc2C1 ZINC000932527167 640566224 /nfs/dbraw/zinc/56/62/24/640566224.db2.gz YOAUKLRLWRTEDZ-UHFFFAOYSA-N 1 2 214.259 2.349 20 0 BEADLO CCC(F)(F)C[N@H+]1CCn2cccc2C1 ZINC000932527167 640566228 /nfs/dbraw/zinc/56/62/28/640566228.db2.gz YOAUKLRLWRTEDZ-UHFFFAOYSA-N 1 2 214.259 2.349 20 0 BEADLO CC1(CCC(=O)NCCCCn2cc[nH+]c2)CC1 ZINC000932717586 640603528 /nfs/dbraw/zinc/60/35/28/640603528.db2.gz BVVKJHPOIGJUAO-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO O=C(C[C@@H]1CC=CCC1)N1CC(n2cc[nH+]c2)C1 ZINC000932827807 640614880 /nfs/dbraw/zinc/61/48/80/640614880.db2.gz ZVDAVWVSRALXLZ-GFCCVEGCSA-N 1 2 245.326 2.013 20 0 BEADLO CC(C)[NH2+][C@H](C)C(=O)OCc1ccccc1 ZINC000224860213 640646818 /nfs/dbraw/zinc/64/68/18/640646818.db2.gz RKOVHAUSINPHKN-LLVKDONJSA-N 1 2 221.300 2.116 20 0 BEADLO c1cn(CCSCCC[C@H]2CCOC2)c[nH+]1 ZINC000592458335 640710737 /nfs/dbraw/zinc/71/07/37/640710737.db2.gz LAMCJNKYRCYHAA-LBPRGKRZSA-N 1 2 240.372 2.433 20 0 BEADLO Cc1cc(NC(=O)c2cnc(Cl)cn2)cc[nH+]1 ZINC000227597400 640842321 /nfs/dbraw/zinc/84/23/21/640842321.db2.gz RGHCMBKYEYPOQR-UHFFFAOYSA-N 1 2 248.673 2.086 20 0 BEADLO CC[NH+]1CC(NC(=O)C(C)(C)C2CCCC2)C1 ZINC001030453670 640866476 /nfs/dbraw/zinc/86/64/76/640866476.db2.gz IGTQDDLRRUIOCE-UHFFFAOYSA-N 1 2 238.375 2.023 20 0 BEADLO COc1cc([NH2+]C[C@H]2CCSC2)ccc1N ZINC000228546876 640879940 /nfs/dbraw/zinc/87/99/40/640879940.db2.gz PVLAKVYCCPSOGR-SECBINFHSA-N 1 2 238.356 2.442 20 0 BEADLO Cc1cccc2c1CC[N@H+](Cc1ncc[nH]1)C2 ZINC000171928396 641024107 /nfs/dbraw/zinc/02/41/07/641024107.db2.gz JNWIRQORYPQCRR-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1cccc2c1CC[N@@H+](Cc1ncc[nH]1)C2 ZINC000171928396 641024110 /nfs/dbraw/zinc/02/41/10/641024110.db2.gz JNWIRQORYPQCRR-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO CNc1cc(NCc2ccc(C)o2)nc[nH+]1 ZINC000087827884 641060422 /nfs/dbraw/zinc/06/04/22/641060422.db2.gz DYYPOXYFALLVCS-UHFFFAOYSA-N 1 2 218.260 2.032 20 0 BEADLO CNc1cc(NCc2ccc(C)o2)[nH+]cn1 ZINC000087827884 641060425 /nfs/dbraw/zinc/06/04/25/641060425.db2.gz DYYPOXYFALLVCS-UHFFFAOYSA-N 1 2 218.260 2.032 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@H+](C)Cc1ncccc1Cl ZINC000934107613 641070157 /nfs/dbraw/zinc/07/01/57/641070157.db2.gz XKNOFLRIUWCJOM-NWDGAFQWSA-N 1 2 240.734 2.344 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@@H+](C)Cc1ncccc1Cl ZINC000934107613 641070161 /nfs/dbraw/zinc/07/01/61/641070161.db2.gz XKNOFLRIUWCJOM-NWDGAFQWSA-N 1 2 240.734 2.344 20 0 BEADLO COC[C@@H]([NH2+]CC(F)(F)C(F)F)C(C)C ZINC000230627723 641074334 /nfs/dbraw/zinc/07/43/34/641074334.db2.gz YIBYQVSDSVIRTG-SSDOTTSWSA-N 1 2 231.233 2.147 20 0 BEADLO CO[C@H]1CC[C@@H]1[N@H+](C)Cc1csc(C)n1 ZINC000934120132 641084580 /nfs/dbraw/zinc/08/45/80/641084580.db2.gz ZZXCHRIJNHWYSD-QWRGUYRKSA-N 1 2 226.345 2.061 20 0 BEADLO CO[C@H]1CC[C@@H]1[N@@H+](C)Cc1csc(C)n1 ZINC000934120132 641084583 /nfs/dbraw/zinc/08/45/83/641084583.db2.gz ZZXCHRIJNHWYSD-QWRGUYRKSA-N 1 2 226.345 2.061 20 0 BEADLO CCCCC1([NH2+][C@@H](C)C(=O)OCC)CC1 ZINC000934209061 641103370 /nfs/dbraw/zinc/10/33/70/641103370.db2.gz JEEIFJHGZPCLBU-JTQLQIEISA-N 1 2 213.321 2.250 20 0 BEADLO C[C@H]1CCC[N@@H+]1Cn1ccc(C(F)(F)F)n1 ZINC000173529032 641182144 /nfs/dbraw/zinc/18/21/44/641182144.db2.gz OGNGRLSEWLNRIA-QMMMGPOBSA-N 1 2 233.237 2.344 20 0 BEADLO C[C@H]1CCC[N@H+]1Cn1ccc(C(F)(F)F)n1 ZINC000173529032 641182148 /nfs/dbraw/zinc/18/21/48/641182148.db2.gz OGNGRLSEWLNRIA-QMMMGPOBSA-N 1 2 233.237 2.344 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+]1CC[C@H](O)[C@H](F)C1 ZINC000934574992 641203342 /nfs/dbraw/zinc/20/33/42/641203342.db2.gz VSJMPTPBINNNFY-OLZOCXBDSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1ccc(F)cc1C[N@H+]1CC[C@H](O)[C@H](F)C1 ZINC000934574992 641203345 /nfs/dbraw/zinc/20/33/45/641203345.db2.gz VSJMPTPBINNNFY-OLZOCXBDSA-N 1 2 241.281 2.039 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@@H+]1CCS[C@H](CC)C1 ZINC000174357207 641278588 /nfs/dbraw/zinc/27/85/88/641278588.db2.gz SRFSFTQPMMKVQC-GHMZBOCLSA-N 1 2 245.388 2.156 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@H+]1CCS[C@H](CC)C1 ZINC000174357207 641278596 /nfs/dbraw/zinc/27/85/96/641278596.db2.gz SRFSFTQPMMKVQC-GHMZBOCLSA-N 1 2 245.388 2.156 20 0 BEADLO C[C@@H](c1nc(COc2ccccc2)no1)[NH+](C)C ZINC000350591992 641364354 /nfs/dbraw/zinc/36/43/54/641364354.db2.gz GQRIRHADJGHOSP-JTQLQIEISA-N 1 2 247.298 2.271 20 0 BEADLO O=C(CNc1cccc[nH+]1)NCCCCC1CC1 ZINC000913754705 641466685 /nfs/dbraw/zinc/46/66/85/641466685.db2.gz VSLJDUCSOYESML-UHFFFAOYSA-N 1 2 247.342 2.190 20 0 BEADLO C[C@H]1C[C@H](C)N1C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000935737226 641472977 /nfs/dbraw/zinc/47/29/77/641472977.db2.gz JAZRCGXCYIUNQO-IUCAKERBSA-N 1 2 229.283 2.186 20 0 BEADLO CCCCC1(C(=O)NCc2c[nH+]cn2C)CC1 ZINC000936025221 641519867 /nfs/dbraw/zinc/51/98/67/641519867.db2.gz ZNHLQVPXLURLQA-UHFFFAOYSA-N 1 2 235.331 2.007 20 0 BEADLO CC[C@H](C)C(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC000152590524 641620984 /nfs/dbraw/zinc/62/09/84/641620984.db2.gz DHPKIMVJCZPZMP-VIFPVBQESA-N 1 2 235.331 2.441 20 0 BEADLO Cc1ccc(NC(=O)C2CCC2)c(N(C)C)[nH+]1 ZINC000152791617 641648899 /nfs/dbraw/zinc/64/88/99/641648899.db2.gz GVQGGIBAHURMOU-UHFFFAOYSA-N 1 2 233.315 2.195 20 0 BEADLO C[C@H](c1ncccn1)[N@H+](C)CCOC(C)(C)C ZINC000929856257 641786930 /nfs/dbraw/zinc/78/69/30/641786930.db2.gz UXUSIRLQBOMJAS-LLVKDONJSA-N 1 2 237.347 2.285 20 0 BEADLO C[C@H](c1ncccn1)[N@@H+](C)CCOC(C)(C)C ZINC000929856257 641786937 /nfs/dbraw/zinc/78/69/37/641786937.db2.gz UXUSIRLQBOMJAS-LLVKDONJSA-N 1 2 237.347 2.285 20 0 BEADLO CC(C)(C)c1nnc(C[NH+]2C3CCC2CC3)o1 ZINC000915360091 641821508 /nfs/dbraw/zinc/82/15/08/641821508.db2.gz LYXHNQJYMVXSGF-UHFFFAOYSA-N 1 2 235.331 2.494 20 0 BEADLO CS[C@H]1CC[C@@H](Nc2cc[nH+]c(C)n2)C1 ZINC000078477647 641926457 /nfs/dbraw/zinc/92/64/57/641926457.db2.gz DWYAZYBNPNICAD-ZJUUUORDSA-N 1 2 223.345 2.481 20 0 BEADLO Cc1ccnc(SCc2c[nH+]cn2C)c1 ZINC000918800921 642267493 /nfs/dbraw/zinc/26/74/93/642267493.db2.gz LVBNJJZVKFMPAP-UHFFFAOYSA-N 1 2 219.313 2.416 20 0 BEADLO COc1nnc(C[NH+]2C[C@@H](C)C[C@H](C)C2)s1 ZINC000920257340 642461679 /nfs/dbraw/zinc/46/16/79/642461679.db2.gz NYTVZLKIMQTRTJ-IUCAKERBSA-N 1 2 241.360 2.025 20 0 BEADLO COc1nnc(C[N@H+](C)[C@@H](C)C(C)(C)C)s1 ZINC000920258349 642464497 /nfs/dbraw/zinc/46/44/97/642464497.db2.gz MYVHXXQGHJATLT-QMMMGPOBSA-N 1 2 243.376 2.413 20 0 BEADLO COc1nnc(C[N@@H+](C)[C@@H](C)C(C)(C)C)s1 ZINC000920258349 642464504 /nfs/dbraw/zinc/46/45/04/642464504.db2.gz MYVHXXQGHJATLT-QMMMGPOBSA-N 1 2 243.376 2.413 20 0 BEADLO COc1nnc(C[N@H+](C)[C@@H](C)C(C)C)s1 ZINC000929201161 642561240 /nfs/dbraw/zinc/56/12/40/642561240.db2.gz MQJUMXAHKYOZDZ-QMMMGPOBSA-N 1 2 229.349 2.023 20 0 BEADLO COc1nnc(C[N@@H+](C)[C@@H](C)C(C)C)s1 ZINC000929201161 642561248 /nfs/dbraw/zinc/56/12/48/642561248.db2.gz MQJUMXAHKYOZDZ-QMMMGPOBSA-N 1 2 229.349 2.023 20 0 BEADLO CCSCCOC(=O)[C@@H]1CCCC[N@@H+]1CC ZINC000175465652 642685818 /nfs/dbraw/zinc/68/58/18/642685818.db2.gz OVTUCHPRCMUPRM-NSHDSACASA-N 1 2 245.388 2.157 20 0 BEADLO CCSCCOC(=O)[C@@H]1CCCC[N@H+]1CC ZINC000175465652 642685824 /nfs/dbraw/zinc/68/58/24/642685824.db2.gz OVTUCHPRCMUPRM-NSHDSACASA-N 1 2 245.388 2.157 20 0 BEADLO C[C@]1(O)CC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000180634415 642804362 /nfs/dbraw/zinc/80/43/62/642804362.db2.gz ZJIHSYTZUSBAQT-LBPRGKRZSA-N 1 2 241.718 2.002 20 0 BEADLO C[C@]1(O)CC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000180634415 642804363 /nfs/dbraw/zinc/80/43/63/642804363.db2.gz ZJIHSYTZUSBAQT-LBPRGKRZSA-N 1 2 241.718 2.002 20 0 BEADLO C#CCCOC(=O)[C@H](c1ccccc1)[N@@H+](C)CC ZINC000181147014 642843605 /nfs/dbraw/zinc/84/36/05/642843605.db2.gz QSURVBGWVVHTOW-AWEZNQCLSA-N 1 2 245.322 2.246 20 0 BEADLO C#CCCOC(=O)[C@H](c1ccccc1)[N@H+](C)CC ZINC000181147014 642843609 /nfs/dbraw/zinc/84/36/09/642843609.db2.gz QSURVBGWVVHTOW-AWEZNQCLSA-N 1 2 245.322 2.246 20 0 BEADLO C=CCOC(=O)[C@@H](c1ccccc1)[NH+](C)C ZINC000181977762 642934588 /nfs/dbraw/zinc/93/45/88/642934588.db2.gz MLIWNJORSSDGMJ-GFCCVEGCSA-N 1 2 219.284 2.019 20 0 BEADLO C[NH+](C)[C@@H](C(=O)OCC1CC1)c1ccccc1 ZINC000181974188 642935430 /nfs/dbraw/zinc/93/54/30/642935430.db2.gz JRARKKXDQJNLTD-CYBMUJFWSA-N 1 2 233.311 2.243 20 0 BEADLO CC(C)COC(=O)[C@H](c1ccccc1)[NH+](C)C ZINC000181983155 642936503 /nfs/dbraw/zinc/93/65/03/642936503.db2.gz BCOWKXNEYPWJOV-ZDUSSCGKSA-N 1 2 235.327 2.489 20 0 BEADLO C[C@H](CSC(C)(C)C)[NH2+]CC(F)(F)CO ZINC000184688169 643228329 /nfs/dbraw/zinc/22/83/29/643228329.db2.gz CMZWZEZGHDVBFT-MRVPVSSYSA-N 1 2 241.347 2.124 20 0 BEADLO Cc1cc(C)cc([C@H](O)C[N@@H+](C)C[C@@H](C)C#N)c1 ZINC000075682639 643252341 /nfs/dbraw/zinc/25/23/41/643252341.db2.gz HFFKBDRVPRDROJ-DZGCQCFKSA-N 1 2 246.354 2.428 20 0 BEADLO Cc1cc(C)cc([C@H](O)C[N@H+](C)C[C@@H](C)C#N)c1 ZINC000075682639 643252350 /nfs/dbraw/zinc/25/23/50/643252350.db2.gz HFFKBDRVPRDROJ-DZGCQCFKSA-N 1 2 246.354 2.428 20 0 BEADLO Cc1ccc(C[NH2+]Cc2c[nH]cn2)cc1F ZINC000082394040 643308793 /nfs/dbraw/zinc/30/87/93/643308793.db2.gz HWSUEKGBCMLAJX-UHFFFAOYSA-N 1 2 219.263 2.147 20 0 BEADLO C[C@@H]1CC[C@H](O)C[N@@H+]1Cc1cnc(Cl)s1 ZINC000307210189 643422815 /nfs/dbraw/zinc/42/28/15/643422815.db2.gz MAWRGUBGAOIUGJ-SFYZADRCSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H]1CC[C@H](O)C[N@H+]1Cc1cnc(Cl)s1 ZINC000307210189 643422818 /nfs/dbraw/zinc/42/28/18/643422818.db2.gz MAWRGUBGAOIUGJ-SFYZADRCSA-N 1 2 246.763 2.142 20 0 BEADLO Cc1nn(C)c(Cl)c1C[NH+]1CC(C)(C)C1 ZINC000307383066 643458282 /nfs/dbraw/zinc/45/82/82/643458282.db2.gz CVVJPPIKEHXFRI-UHFFFAOYSA-N 1 2 227.739 2.224 20 0 BEADLO CCc1ccc(C[NH2+]Cc2nonc2C)cc1 ZINC000234199114 643579079 /nfs/dbraw/zinc/57/90/79/643579079.db2.gz NEYAXEAAJGVYEG-UHFFFAOYSA-N 1 2 231.299 2.230 20 0 BEADLO FCC[NH2+]Cc1occc1Br ZINC000307755187 643624122 /nfs/dbraw/zinc/62/41/22/643624122.db2.gz CRVXAMUTJCTGST-UHFFFAOYSA-N 1 2 222.057 2.101 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccnn2C2CCC2)on1 ZINC000921689216 643749703 /nfs/dbraw/zinc/74/97/03/643749703.db2.gz PXGLCRHDZGIAST-UHFFFAOYSA-N 1 2 246.314 2.194 20 0 BEADLO CC1(C(=O)OCc2ccc(N)[nH+]c2)CCCC1 ZINC000922220920 643908277 /nfs/dbraw/zinc/90/82/77/643908277.db2.gz DATCGBUMBRODLG-UHFFFAOYSA-N 1 2 234.299 2.287 20 0 BEADLO CCC/C=C/C(=O)OCc1ccc[nH+]c1N ZINC000922352964 643979589 /nfs/dbraw/zinc/97/95/89/643979589.db2.gz WOCNXOTYVSQLAV-QPJJXVBHSA-N 1 2 220.272 2.063 20 0 BEADLO CC(C)(C)/C=C\C(=O)OCc1ccc(N)[nH+]c1 ZINC000922438402 643993788 /nfs/dbraw/zinc/99/37/88/643993788.db2.gz MYFCNFIQSOFLSM-SREVYHEPSA-N 1 2 234.299 2.309 20 0 BEADLO C[C@H]1CC/C(=C/C(=O)OCc2ccc(N)[nH+]c2)C1 ZINC000922516446 644006254 /nfs/dbraw/zinc/00/62/54/644006254.db2.gz HQFMYNFDJLTWBO-QBQSQJOESA-N 1 2 246.310 2.453 20 0 BEADLO Nc1ccc(COC(=O)CCC2CCC2)c[nH+]1 ZINC000922511243 644009015 /nfs/dbraw/zinc/00/90/15/644009015.db2.gz ZKJUPVCGSNVNBS-UHFFFAOYSA-N 1 2 234.299 2.287 20 0 BEADLO Cn1ccc(C[NH2+][C@@H](c2ccccn2)C2CC2)n1 ZINC000922584811 644034294 /nfs/dbraw/zinc/03/42/94/644034294.db2.gz AUBHPAASCPSOMP-CQSZACIVSA-N 1 2 242.326 2.056 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)OCc2ccc[nH+]c2N)C1 ZINC000922586783 644036259 /nfs/dbraw/zinc/03/62/59/644036259.db2.gz JOKUYEYINAQXFG-ZJUUUORDSA-N 1 2 234.299 2.143 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)OCc2ccc[nH+]c2N)C1 ZINC000922586780 644036644 /nfs/dbraw/zinc/03/66/44/644036644.db2.gz JOKUYEYINAQXFG-NXEZZACHSA-N 1 2 234.299 2.143 20 0 BEADLO C[C@@H]1CCC[C@H]1C(=O)OCc1ccc(N)[nH+]c1 ZINC000922606069 644041288 /nfs/dbraw/zinc/04/12/88/644041288.db2.gz VDTSCBGGGRUPIV-MWLCHTKSSA-N 1 2 234.299 2.143 20 0 BEADLO Nc1[nH+]cccc1COC(=O)C[C@H]1C=CCCC1 ZINC000922623787 644043263 /nfs/dbraw/zinc/04/32/63/644043263.db2.gz YHQQHNGYFUJYDG-NSHDSACASA-N 1 2 246.310 2.453 20 0 BEADLO C/C=C(/CC)C(=O)OCc1ccc(N)[nH+]c1 ZINC000922638846 644045590 /nfs/dbraw/zinc/04/55/90/644045590.db2.gz GCIGRXMAHPFTML-KMKOMSMNSA-N 1 2 220.272 2.063 20 0 BEADLO CC[C@H](C)CC(=O)OCc1ccc(N)[nH+]c1 ZINC000922640473 644053977 /nfs/dbraw/zinc/05/39/77/644053977.db2.gz DNKWLDQWJDCMQG-VIFPVBQESA-N 1 2 222.288 2.143 20 0 BEADLO CC(C(=O)OCc1ccc(N)[nH+]c1)=C1CCC1 ZINC000922788918 644096601 /nfs/dbraw/zinc/09/66/01/644096601.db2.gz YTOFOXKFBQYWPB-UHFFFAOYSA-N 1 2 232.283 2.207 20 0 BEADLO Nc1[nH+]cccc1COC(=O)[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000922811223 644099417 /nfs/dbraw/zinc/09/94/17/644099417.db2.gz OXNQFIWDVORBGF-UMNHJUIQSA-N 1 2 246.310 2.143 20 0 BEADLO Nc1[nH+]cccc1COC(=O)[C@@H]1CCC[C@H]2C[C@H]21 ZINC000922854278 644119946 /nfs/dbraw/zinc/11/99/46/644119946.db2.gz LTMWQBWVQKTFCQ-MVWJERBFSA-N 1 2 246.310 2.143 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1nccs1)c1ccnn1C ZINC000192251745 644141275 /nfs/dbraw/zinc/14/12/75/644141275.db2.gz HCHHDNRXAPFCKW-BDAKNGLRSA-N 1 2 236.344 2.288 20 0 BEADLO C[C@@H]1CC=CC[C@H]1C(=O)OCc1ccc[nH+]c1N ZINC000922940300 644191360 /nfs/dbraw/zinc/19/13/60/644191360.db2.gz CMMYQSTYEUZCAU-ZYHUDNBSSA-N 1 2 246.310 2.309 20 0 BEADLO Cn1nc(C2CC2)cc1C[NH2+]Cc1nccs1 ZINC000922946852 644197950 /nfs/dbraw/zinc/19/79/50/644197950.db2.gz BDDCLTWDUQNODM-UHFFFAOYSA-N 1 2 248.355 2.044 20 0 BEADLO CCc1onc(C)c1C[NH2+]Cc1ccc(F)cn1 ZINC000922982864 644209535 /nfs/dbraw/zinc/20/95/35/644209535.db2.gz WPJJIZYZZCPUEM-UHFFFAOYSA-N 1 2 249.289 2.369 20 0 BEADLO CCC[C@](C)([NH2+]C[C@H]1CCC=CO1)C(=O)OC ZINC000194174954 644306621 /nfs/dbraw/zinc/30/66/21/644306621.db2.gz RIGUDMHEKFIDQR-YPMHNXCESA-N 1 2 241.331 2.001 20 0 BEADLO CC(C)CO[NH+]=C(N)c1ccc(F)cc1 ZINC000085260186 644438213 /nfs/dbraw/zinc/43/82/13/644438213.db2.gz QXZWYENWDRCTTB-UHFFFAOYSA-N 1 2 210.252 2.119 20 0 BEADLO OC[C@H]1CCCC[N@@H+]1C/C(Cl)=C/Cl ZINC000086001399 644453648 /nfs/dbraw/zinc/45/36/48/644453648.db2.gz ZFTQGHTZWGNLIC-BZJXQOFCSA-N 1 2 224.131 2.152 20 0 BEADLO OC[C@H]1CCCC[N@H+]1C/C(Cl)=C/Cl ZINC000086001399 644453652 /nfs/dbraw/zinc/45/36/52/644453652.db2.gz ZFTQGHTZWGNLIC-BZJXQOFCSA-N 1 2 224.131 2.152 20 0 BEADLO CC1(C(=O)OCCn2cc[nH+]c2)CCCC1 ZINC000771874622 644690637 /nfs/dbraw/zinc/69/06/37/644690637.db2.gz CJBFWENRTZOLIK-UHFFFAOYSA-N 1 2 222.288 2.007 20 0 BEADLO Cc1cc(F)ccc1[C@H](O)Cn1cc[nH+]c1 ZINC000304481847 644910407 /nfs/dbraw/zinc/91/04/07/644910407.db2.gz BBIFPRSMYWCYSY-GFCCVEGCSA-N 1 2 220.247 2.064 20 0 BEADLO CC(C)=CC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000817459216 644984003 /nfs/dbraw/zinc/98/40/03/644984003.db2.gz SVVYODDOYSAJBG-UHFFFAOYSA-N 1 2 218.300 2.281 20 0 BEADLO CCCCN(C(=O)Cc1[nH]cc[nH+]1)[C@@H](C)CC ZINC000826883642 645068707 /nfs/dbraw/zinc/06/87/07/645068707.db2.gz YLCRTNNVTMJZAX-NSHDSACASA-N 1 2 237.347 2.379 20 0 BEADLO O=C(c1cc2c[nH+]ccc2[nH]1)N(C1CC1)C1CC1 ZINC000827239010 645075393 /nfs/dbraw/zinc/07/53/93/645075393.db2.gz GACGTZGXWOUORS-UHFFFAOYSA-N 1 2 241.294 2.330 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCCC[C@H]1F)c1cc(CO)on1 ZINC000926587797 645302184 /nfs/dbraw/zinc/30/21/84/645302184.db2.gz QDYKPAIYQHLWIR-FBIMIBRVSA-N 1 2 242.294 2.098 20 0 BEADLO Cc1nonc1[C@H](C)[NH2+]Cc1cc(C)nc(C)c1 ZINC000926601085 645310024 /nfs/dbraw/zinc/31/00/24/645310024.db2.gz LVZVYXVVMOCZBW-JTQLQIEISA-N 1 2 246.314 2.241 20 0 BEADLO C[C@@H](CC(=O)OC1CCCC1)n1cc[nH+]c1 ZINC000844268001 645320042 /nfs/dbraw/zinc/32/00/42/645320042.db2.gz GBXPTPWZCXIYGZ-JTQLQIEISA-N 1 2 222.288 2.320 20 0 BEADLO FC1(F)C[C@@]12CCC[N@H+](Cc1cnns1)C2 ZINC000844444660 645334062 /nfs/dbraw/zinc/33/40/62/645334062.db2.gz SHRVWYOYXZTLCN-SECBINFHSA-N 1 2 245.298 2.159 20 0 BEADLO FC1(F)C[C@@]12CCC[N@@H+](Cc1cnns1)C2 ZINC000844444660 645334066 /nfs/dbraw/zinc/33/40/66/645334066.db2.gz SHRVWYOYXZTLCN-SECBINFHSA-N 1 2 245.298 2.159 20 0 BEADLO C/C=C(/C)COC(=O)Cc1cn2c([nH+]1)CCCC2 ZINC000845612910 645371504 /nfs/dbraw/zinc/37/15/04/645371504.db2.gz RJNHKWPGCCJZBQ-JYOAFUTRSA-N 1 2 248.326 2.271 20 0 BEADLO C[C@@H]([N@@H+]1CCO[C@@H](C(F)F)C1)C1(Cl)CC1 ZINC000926824833 645442939 /nfs/dbraw/zinc/44/29/39/645442939.db2.gz ZZIZMXJFBOIKRX-HTQZYQBOSA-N 1 2 239.693 2.112 20 0 BEADLO C[C@@H]([N@H+]1CCO[C@@H](C(F)F)C1)C1(Cl)CC1 ZINC000926824833 645442949 /nfs/dbraw/zinc/44/29/49/645442949.db2.gz ZZIZMXJFBOIKRX-HTQZYQBOSA-N 1 2 239.693 2.112 20 0 BEADLO C[C@H]([N@@H+]1CCO[C@H](C(F)F)C1)C1(Cl)CC1 ZINC000926824836 645444666 /nfs/dbraw/zinc/44/46/66/645444666.db2.gz ZZIZMXJFBOIKRX-YUMQZZPRSA-N 1 2 239.693 2.112 20 0 BEADLO C[C@H]([N@H+]1CCO[C@H](C(F)F)C1)C1(Cl)CC1 ZINC000926824836 645444673 /nfs/dbraw/zinc/44/46/73/645444673.db2.gz ZZIZMXJFBOIKRX-YUMQZZPRSA-N 1 2 239.693 2.112 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)o1 ZINC000930251580 645535230 /nfs/dbraw/zinc/53/52/30/645535230.db2.gz LNWUFCVVKCHHFP-GARJFASQSA-N 1 2 238.331 2.235 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)o1 ZINC000930251580 645535235 /nfs/dbraw/zinc/53/52/35/645535235.db2.gz LNWUFCVVKCHHFP-GARJFASQSA-N 1 2 238.331 2.235 20 0 BEADLO CCc1onc(C)c1C[NH2+][C@H](C)c1ncc[nH]1 ZINC000927133217 645564050 /nfs/dbraw/zinc/56/40/50/645564050.db2.gz VSTIWTJRUQNCFX-SECBINFHSA-N 1 2 234.303 2.119 20 0 BEADLO CCc1onc(C)c1C[N@@H+]1CCOC(C)(C)C1 ZINC000929118462 645953357 /nfs/dbraw/zinc/95/33/57/645953357.db2.gz MZZOPLFWYZDVEO-UHFFFAOYSA-N 1 2 238.331 2.156 20 0 BEADLO CCc1onc(C)c1C[N@H+]1CCOC(C)(C)C1 ZINC000929118462 645953369 /nfs/dbraw/zinc/95/33/69/645953369.db2.gz MZZOPLFWYZDVEO-UHFFFAOYSA-N 1 2 238.331 2.156 20 0 BEADLO COc1nnc(C[NH+]2CCCCCCC2)s1 ZINC000929128956 645961898 /nfs/dbraw/zinc/96/18/98/645961898.db2.gz UHWNLFDPFKDATE-UHFFFAOYSA-N 1 2 241.360 2.313 20 0 BEADLO Cc1cn(C)nc1C[N@H+](C)Cc1ccc(F)cc1 ZINC000929136835 645964574 /nfs/dbraw/zinc/96/45/74/645964574.db2.gz RPVFDMUDQLHESI-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1cn(C)nc1C[N@@H+](C)Cc1ccc(F)cc1 ZINC000929136835 645964581 /nfs/dbraw/zinc/96/45/81/645964581.db2.gz RPVFDMUDQLHESI-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1cc(C)nc(C[N@H+]2C[C@@H](C)OC[C@@H]2C)c1 ZINC000929181782 645991722 /nfs/dbraw/zinc/99/17/22/645991722.db2.gz HFTGGYUOAIBEMP-QWHCGFSZSA-N 1 2 234.343 2.308 20 0 BEADLO Cc1cc(C)nc(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)c1 ZINC000929181782 645991729 /nfs/dbraw/zinc/99/17/29/645991729.db2.gz HFTGGYUOAIBEMP-QWHCGFSZSA-N 1 2 234.343 2.308 20 0 BEADLO C[C@H]1c2cccn2CC[N@H+]1Cc1ccc(N)nc1 ZINC000929190036 645992897 /nfs/dbraw/zinc/99/28/97/645992897.db2.gz DVHYTSDRDKBWNN-NSHDSACASA-N 1 2 242.326 2.042 20 0 BEADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1ccc(N)nc1 ZINC000929190036 645992907 /nfs/dbraw/zinc/99/29/07/645992907.db2.gz DVHYTSDRDKBWNN-NSHDSACASA-N 1 2 242.326 2.042 20 0 BEADLO COC/C(C)=C\C[N@H+](C)Cc1cc(C)on1 ZINC000929259443 646043739 /nfs/dbraw/zinc/04/37/39/646043739.db2.gz YOMOHGIHHRGTMF-YHYXMXQVSA-N 1 2 224.304 2.008 20 0 BEADLO COC/C(C)=C\C[N@@H+](C)Cc1cc(C)on1 ZINC000929259443 646043743 /nfs/dbraw/zinc/04/37/43/646043743.db2.gz YOMOHGIHHRGTMF-YHYXMXQVSA-N 1 2 224.304 2.008 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@H](C)OC[C@@H]2CC)o1 ZINC000929268174 646049586 /nfs/dbraw/zinc/04/95/86/646049586.db2.gz GUQFUVSHVXFEOJ-QWRGUYRKSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@H](C)OC[C@@H]2CC)o1 ZINC000929268174 646049592 /nfs/dbraw/zinc/04/95/92/646049592.db2.gz GUQFUVSHVXFEOJ-QWRGUYRKSA-N 1 2 238.331 2.236 20 0 BEADLO CC(C)n1cc([C@H](C)[NH2+]Cc2cccnc2)nn1 ZINC000924535892 646052569 /nfs/dbraw/zinc/05/25/69/646052569.db2.gz ZGEKYDWHEUIQLH-NSHDSACASA-N 1 2 245.330 2.105 20 0 BEADLO COc1cc([C@H](C)[NH2+][C@@H](C)c2ccccn2)on1 ZINC000924543802 646063827 /nfs/dbraw/zinc/06/38/27/646063827.db2.gz SCCFRYVRIPDHAU-UWVGGRQHSA-N 1 2 247.298 2.490 20 0 BEADLO COc1cccc(C[NH2+][C@@H](C)c2nonc2C)c1 ZINC000924563089 646067639 /nfs/dbraw/zinc/06/76/39/646067639.db2.gz FDOKCBURLFGAFB-VIFPVBQESA-N 1 2 247.298 2.237 20 0 BEADLO Cc1nonc1[C@H](C)[NH2+][C@H](C)c1cccnc1 ZINC000924564384 646067840 /nfs/dbraw/zinc/06/78/40/646067840.db2.gz MWVITIYRXASOIK-BDAKNGLRSA-N 1 2 232.287 2.185 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCCc2occc21)c1cnn(C)n1 ZINC000924645014 646083398 /nfs/dbraw/zinc/08/33/98/646083398.db2.gz UJPJABYVEDTJHG-MWLCHTKSSA-N 1 2 246.314 2.136 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@H](C)OC(C)(C)C2)o1 ZINC000929347446 646090098 /nfs/dbraw/zinc/09/00/98/646090098.db2.gz GLIVWLZDBCUNJI-JTQLQIEISA-N 1 2 238.331 2.236 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@H](C)OC(C)(C)C2)o1 ZINC000929347446 646090103 /nfs/dbraw/zinc/09/01/03/646090103.db2.gz GLIVWLZDBCUNJI-JTQLQIEISA-N 1 2 238.331 2.236 20 0 BEADLO CCc1onc(C)c1C[N@@H+]1CCOCC1(C)C ZINC000929346980 646091080 /nfs/dbraw/zinc/09/10/80/646091080.db2.gz FDDBPZPOFMCWRN-UHFFFAOYSA-N 1 2 238.331 2.156 20 0 BEADLO CCc1onc(C)c1C[N@H+]1CCOCC1(C)C ZINC000929346980 646091086 /nfs/dbraw/zinc/09/10/86/646091086.db2.gz FDDBPZPOFMCWRN-UHFFFAOYSA-N 1 2 238.331 2.156 20 0 BEADLO COc1nnc(C[N@@H+]2CCC[C@@H](C)[C@@H]2C)s1 ZINC000929703370 646258390 /nfs/dbraw/zinc/25/83/90/646258390.db2.gz MEIXGXWYONVYCK-BDAKNGLRSA-N 1 2 241.360 2.167 20 0 BEADLO COc1nnc(C[N@H+]2CCC[C@@H](C)[C@@H]2C)s1 ZINC000929703370 646258395 /nfs/dbraw/zinc/25/83/95/646258395.db2.gz MEIXGXWYONVYCK-BDAKNGLRSA-N 1 2 241.360 2.167 20 0 BEADLO CCc1onc(C)c1C[N@@H+]1CCO[C@@H](C)[C@@H]1C ZINC000929848135 646357967 /nfs/dbraw/zinc/35/79/67/646357967.db2.gz QTLGGVJQLMSOSL-QWRGUYRKSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1onc(C)c1C[N@H+]1CCO[C@@H](C)[C@@H]1C ZINC000929848135 646357971 /nfs/dbraw/zinc/35/79/71/646357971.db2.gz QTLGGVJQLMSOSL-QWRGUYRKSA-N 1 2 238.331 2.155 20 0 BEADLO FC(F)(F)[C@H]1CCC[C@H](Cn2cc[nH+]c2)O1 ZINC000929865363 646366442 /nfs/dbraw/zinc/36/64/42/646366442.db2.gz CWGUBLIJXVBSNR-RKDXNWHRSA-N 1 2 234.221 2.383 20 0 BEADLO C1=C[C@H]2CC[C@@H](C1)[N@H+]2Cc1noc2c1COCC2 ZINC000930076049 646422227 /nfs/dbraw/zinc/42/22/27/646422227.db2.gz BQJSSUYFQTXGBQ-WDEREUQCSA-N 1 2 246.310 2.040 20 0 BEADLO C1=C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1noc2c1COCC2 ZINC000930076049 646422233 /nfs/dbraw/zinc/42/22/33/646422233.db2.gz BQJSSUYFQTXGBQ-WDEREUQCSA-N 1 2 246.310 2.040 20 0 BEADLO CCc1ncc(C[N@@H+]2CCOC[C@@]2(C)CC)o1 ZINC000930124504 646446418 /nfs/dbraw/zinc/44/64/18/646446418.db2.gz VQBLAGMFSYGQSC-CYBMUJFWSA-N 1 2 238.331 2.238 20 0 BEADLO CCc1ncc(C[N@H+]2CCOC[C@@]2(C)CC)o1 ZINC000930124504 646446424 /nfs/dbraw/zinc/44/64/24/646446424.db2.gz VQBLAGMFSYGQSC-CYBMUJFWSA-N 1 2 238.331 2.238 20 0 BEADLO COc1nnc(C[N@@H+]2CC[C@H](C)[C@@H](C)C2)s1 ZINC000930144878 646457437 /nfs/dbraw/zinc/45/74/37/646457437.db2.gz HFFALROBLKOJCI-IUCAKERBSA-N 1 2 241.360 2.025 20 0 BEADLO COc1nnc(C[N@H+]2CC[C@H](C)[C@@H](C)C2)s1 ZINC000930144878 646457440 /nfs/dbraw/zinc/45/74/40/646457440.db2.gz HFFALROBLKOJCI-IUCAKERBSA-N 1 2 241.360 2.025 20 0 BEADLO FC1=CCC[N@H+](CCOC2CCSCC2)C1 ZINC000930173680 646475611 /nfs/dbraw/zinc/47/56/11/646475611.db2.gz KTZKLGAAOAGOIK-UHFFFAOYSA-N 1 2 245.363 2.458 20 0 BEADLO FC1=CCC[N@@H+](CCOC2CCSCC2)C1 ZINC000930173680 646475613 /nfs/dbraw/zinc/47/56/13/646475613.db2.gz KTZKLGAAOAGOIK-UHFFFAOYSA-N 1 2 245.363 2.458 20 0 BEADLO Cc1cc(NC(=O)C[C@H]([NH3+])C(F)F)ccc1F ZINC000724738660 711609662 /nfs/dbraw/zinc/60/96/62/711609662.db2.gz IODDBXYGQMSKAV-VIFPVBQESA-N 1 2 246.232 2.055 20 0 BEADLO C[NH+](C)[C@@H](C(=O)OCC(F)F)c1ccccc1 ZINC000181997990 711698836 /nfs/dbraw/zinc/69/88/36/711698836.db2.gz BZFBQTKPYAMKRH-LLVKDONJSA-N 1 2 243.253 2.098 20 0 BEADLO COC[C@H](C)[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000237241242 711777657 /nfs/dbraw/zinc/77/76/57/711777657.db2.gz KRKXZENLQVRHPF-IUCAKERBSA-N 1 2 241.335 2.053 20 0 BEADLO Fc1c[nH+]ccc1NCC[C@@H]1CCSC1 ZINC000704911850 712121884 /nfs/dbraw/zinc/12/18/84/712121884.db2.gz MUKFPJDEZQFMFN-SECBINFHSA-N 1 2 226.320 2.198 20 0 BEADLO C[C@@H](CF)[NH2+]Cc1c(Cl)nc(Cl)n1C ZINC000379645028 712390680 /nfs/dbraw/zinc/39/06/80/712390680.db2.gz XJNNAXSZRMVZJO-YFKPBYRVSA-N 1 2 240.109 2.175 20 0 BEADLO C[C@@H]1CC[C@H](O)C[N@H+]1Cc1scnc1Cl ZINC000713740478 712470461 /nfs/dbraw/zinc/47/04/61/712470461.db2.gz LEZOINYMHLZFOJ-SFYZADRCSA-N 1 2 246.763 2.142 20 0 BEADLO Cc1cc(CNc2cc[nH+]cc2F)sn1 ZINC000379927082 712631323 /nfs/dbraw/zinc/63/13/23/712631323.db2.gz LZYITLDROLHOFL-UHFFFAOYSA-N 1 2 223.276 2.020 20 0 BEADLO CCC[C@H]([NH2+]C[C@@H]1CCC=CO1)C(=O)OCC ZINC000379919831 712626947 /nfs/dbraw/zinc/62/69/47/712626947.db2.gz QCOKUEZLKWHZFK-RYUDHWBXSA-N 1 2 241.331 2.001 20 0 BEADLO CCCCOC(=O)C[NH2+][C@H]1CCC1(C)C ZINC000379990139 712644926 /nfs/dbraw/zinc/64/49/26/712644926.db2.gz XCWXQUDCVUSFGR-JTQLQIEISA-N 1 2 213.321 2.108 20 0 BEADLO c1cnc2ncc(-c3cc[nH+]c4c3CCN4)cc2n1 ZINC001244044049 1169765161 /nfs/dbraw/zinc/76/51/61/1169765161.db2.gz RZMPGSLKLZOKJS-UHFFFAOYSA-N 1 2 249.277 2.055 20 0 BEADLO Cc1cc(C[NH2+]Cc2cocn2)cnc1Cl ZINC000381352607 710626912 /nfs/dbraw/zinc/62/69/12/710626912.db2.gz CDLHOLXQDVZFNV-UHFFFAOYSA-N 1 2 237.690 2.321 20 0 BEADLO CCC[C@@H]([NH2+][C@@H]1CC12CCC2)C(=O)OCC ZINC000721220453 712899236 /nfs/dbraw/zinc/89/92/36/712899236.db2.gz JJJFWYMSZOXLHP-GHMZBOCLSA-N 1 2 225.332 2.250 20 0 BEADLO CCC[C@@]1([NH2+]CC(F)(F)C(F)F)CCOC1 ZINC000381575379 710656453 /nfs/dbraw/zinc/65/64/53/710656453.db2.gz ZNVIKOWDEGJRMX-SECBINFHSA-N 1 2 243.244 2.436 20 0 BEADLO CCCC[C@H]([NH2+][C@H]1CC12CCC2)C(=O)OC ZINC000721223265 712899571 /nfs/dbraw/zinc/89/95/71/712899571.db2.gz UNYOMQUTYQPOHT-QWRGUYRKSA-N 1 2 225.332 2.250 20 0 BEADLO Cc1nc(NC[C@@H]2CC[C@H](C3CC3)O2)cc[nH+]1 ZINC000722307559 710707078 /nfs/dbraw/zinc/70/70/78/710707078.db2.gz CHYIDJAZZRQEKV-NWDGAFQWSA-N 1 2 233.315 2.155 20 0 BEADLO Cc1ccc(NC(=O)C[C@@H]([NH3+])C(F)F)cc1C ZINC000724763628 710746222 /nfs/dbraw/zinc/74/62/22/710746222.db2.gz ZGGUGFQWSKXFFM-SNVBAGLBSA-N 1 2 242.269 2.224 20 0 BEADLO CCC(=O)N(C)C1C[NH+](Cc2ccc(C)cc2)C1 ZINC001042382893 710777034 /nfs/dbraw/zinc/77/70/34/710777034.db2.gz MQGJBNQBDTYUKD-UHFFFAOYSA-N 1 2 246.354 2.048 20 0 BEADLO CC[C@@H](O)c1nccn1Cc1cc(C)cc(C)[nH+]1 ZINC000902733697 710886362 /nfs/dbraw/zinc/88/63/62/710886362.db2.gz FBUYCDAOIUEBNO-CYBMUJFWSA-N 1 2 245.326 2.387 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2cnn(C)n2)cc1F ZINC000386147128 711023460 /nfs/dbraw/zinc/02/34/60/711023460.db2.gz BYTBYECJEAQIFK-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO C[C@H]1CSC[C@@H]1[NH2+]CC(F)(F)C(F)F ZINC000388939487 711070372 /nfs/dbraw/zinc/07/03/72/711070372.db2.gz WUXHUNLVKWQGEI-WDSKDSINSA-N 1 2 231.258 2.228 20 0 BEADLO CCCCOC(=O)[C@H](C)[NH2+]C1(C2CC2)CC1 ZINC000390779941 711132959 /nfs/dbraw/zinc/13/29/59/711132959.db2.gz IPWBXXICSSGYIM-JTQLQIEISA-N 1 2 225.332 2.250 20 0 BEADLO Fc1cccc2c1CC[C@@H]2[NH2+]Cc1csnn1 ZINC000398486508 711411301 /nfs/dbraw/zinc/41/13/01/711411301.db2.gz UMSQDQXEZIMHEB-LBPRGKRZSA-N 1 2 249.314 2.454 20 0 BEADLO Cc1cccc(F)c1C[NH2+]Cc1ncc[nH]1 ZINC000381386988 710630796 /nfs/dbraw/zinc/63/07/96/710630796.db2.gz NANHLNZCINOXTL-UHFFFAOYSA-N 1 2 219.263 2.147 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2ccc(C)c(F)c2)[nH]1 ZINC000392459708 711147989 /nfs/dbraw/zinc/14/79/89/711147989.db2.gz MDKJYHOZKOEQSU-VIFPVBQESA-N 1 2 248.305 2.411 20 0 BEADLO Cc1cc(C)c(CNC(=O)C(C)(C)F)c[nH+]1 ZINC000397082898 711376860 /nfs/dbraw/zinc/37/68/60/711376860.db2.gz GUAOAYFUTNGCIV-UHFFFAOYSA-N 1 2 224.279 2.063 20 0 BEADLO c1nc(C[NH2+]Cc2cccc3c2NCCC3)co1 ZINC000397783921 711391371 /nfs/dbraw/zinc/39/13/71/711391371.db2.gz PTSMTJIIDNHQSQ-UHFFFAOYSA-N 1 2 243.310 2.323 20 0 BEADLO Fc1ccc2c(c1)CC[C@H]2[NH2+]Cc1c[nH]cn1 ZINC000134287494 711498695 /nfs/dbraw/zinc/49/86/95/711498695.db2.gz LSTJNIJXRZMOGR-CYBMUJFWSA-N 1 2 231.274 2.326 20 0 BEADLO Cc1nc(N[C@H](C2CC2)[C@@H]2CCCOC2)cc[nH+]1 ZINC000723869769 711541276 /nfs/dbraw/zinc/54/12/76/711541276.db2.gz UBDRPWITCNEMTJ-TZMCWYRMSA-N 1 2 247.342 2.402 20 0 BEADLO CCCCCCC(=O)NCc1c[nH+]cn1C ZINC000291099482 711557917 /nfs/dbraw/zinc/55/79/17/711557917.db2.gz BJRXALASFMRRNW-UHFFFAOYSA-N 1 2 223.320 2.007 20 0 BEADLO [NH3+][C@@H](CC(=O)NC1CCCCCCC1)C(F)F ZINC000724759523 711610561 /nfs/dbraw/zinc/61/05/61/711610561.db2.gz QKTOYNWRFSQDBK-JTQLQIEISA-N 1 2 248.317 2.198 20 0 BEADLO CN(C(=O)C[C@H]([NH3+])C(F)F)C1CCCCCC1 ZINC000724760028 711610602 /nfs/dbraw/zinc/61/06/02/711610602.db2.gz UIYPNHYTLHLOCC-JTQLQIEISA-N 1 2 248.317 2.150 20 0 BEADLO COc1ccccc1C[NH2+][C@H]1CCn2ccnc21 ZINC000382307037 711659093 /nfs/dbraw/zinc/65/90/93/711659093.db2.gz QZFDWHKQDCSXTC-LBPRGKRZSA-N 1 2 243.310 2.126 20 0 BEADLO CCCCOC(=O)[C@H](C)[NH2+][C@@H]1CSC[C@@H]1C ZINC000310023002 711702222 /nfs/dbraw/zinc/70/22/22/711702222.db2.gz OEJHQNLGLMENJX-GARJFASQSA-N 1 2 245.388 2.059 20 0 BEADLO C[C@H]1[C@@H](C)N(c2cc(N(C)C)[nH+]cn2)C[C@H]1C ZINC000894235687 711765525 /nfs/dbraw/zinc/76/55/25/711765525.db2.gz OXIOWVXDTXYFRK-GMTAPVOTSA-N 1 2 234.347 2.023 20 0 BEADLO C[C@H]1[C@@H](C)N(c2cc(N(C)C)nc[nH+]2)C[C@H]1C ZINC000894235687 711765526 /nfs/dbraw/zinc/76/55/26/711765526.db2.gz OXIOWVXDTXYFRK-GMTAPVOTSA-N 1 2 234.347 2.023 20 0 BEADLO C[C@@H]1CC[C@@H](O)C[N@@H+]1Cc1cnc(Cl)s1 ZINC000307210109 711773948 /nfs/dbraw/zinc/77/39/48/711773948.db2.gz MAWRGUBGAOIUGJ-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H]1CC[C@@H](O)C[N@H+]1Cc1cnc(Cl)s1 ZINC000307210109 711773949 /nfs/dbraw/zinc/77/39/49/711773949.db2.gz MAWRGUBGAOIUGJ-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO Cc1cc(F)ncc1C[N@@H+]1CCC[C@@H](F)C1 ZINC000895191323 711779899 /nfs/dbraw/zinc/77/98/99/711779899.db2.gz NTRXQTCVXGIWHJ-LLVKDONJSA-N 1 2 226.270 2.463 20 0 BEADLO Cc1cc(F)ncc1C[N@H+]1CCC[C@@H](F)C1 ZINC000895191323 711779900 /nfs/dbraw/zinc/77/99/00/711779900.db2.gz NTRXQTCVXGIWHJ-LLVKDONJSA-N 1 2 226.270 2.463 20 0 BEADLO CC[C@@](C)(C[NH2+]C(C)(C)C(=O)OC(C)C)OC ZINC000898507114 711801748 /nfs/dbraw/zinc/80/17/48/711801748.db2.gz PELZVTJHFRRSLN-ZDUSSCGKSA-N 1 2 245.363 2.121 20 0 BEADLO CCn1cc([C@@H](C)[NH2+][C@H](C)c2ncc[nH]2)cn1 ZINC000138994563 711839725 /nfs/dbraw/zinc/83/97/25/711839725.db2.gz XFDCNVKJXGBENL-NXEZZACHSA-N 1 2 233.319 2.038 20 0 BEADLO c1cc(-c2noc([C@H]3C[C@@H]3c3c[nH]c[nH+]3)n2)co1 ZINC000924005395 711867781 /nfs/dbraw/zinc/86/77/81/711867781.db2.gz CDDZUJOKKRFFMW-IUCAKERBSA-N 1 2 242.238 2.324 20 0 BEADLO Cc1ccc(C(=O)OCc2c[nH+]cn2C)c(F)c1 ZINC000085987114 711956771 /nfs/dbraw/zinc/95/67/71/711956771.db2.gz DNRNBXFZRBHXIU-UHFFFAOYSA-N 1 2 248.257 2.225 20 0 BEADLO C[C@H](F)CC[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000702552778 712055205 /nfs/dbraw/zinc/05/52/05/712055205.db2.gz CSTHDISJZSRUKR-IUCAKERBSA-N 1 2 219.300 2.054 20 0 BEADLO C[C@@H](F)CC[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000702552776 712055253 /nfs/dbraw/zinc/05/52/53/712055253.db2.gz CSTHDISJZSRUKR-BDAKNGLRSA-N 1 2 219.300 2.054 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2CCCC23CC3)n1 ZINC000707085507 712164727 /nfs/dbraw/zinc/16/47/27/712164727.db2.gz INFHUTQNVRJQFI-VIFPVBQESA-N 1 2 221.304 2.227 20 0 BEADLO COCC1([N@H+](C)Cc2cccnc2Cl)CC1 ZINC000707147386 712166146 /nfs/dbraw/zinc/16/61/46/712166146.db2.gz MUXUWYKORCXHDQ-UHFFFAOYSA-N 1 2 240.734 2.346 20 0 BEADLO COCC1([N@@H+](C)Cc2cccnc2Cl)CC1 ZINC000707147386 712166148 /nfs/dbraw/zinc/16/61/48/712166148.db2.gz MUXUWYKORCXHDQ-UHFFFAOYSA-N 1 2 240.734 2.346 20 0 BEADLO C[C@H](O)C[N@H+](C/C(Cl)=C\Cl)C1CC1 ZINC000709487208 712222754 /nfs/dbraw/zinc/22/27/54/712222754.db2.gz YZWMJRFZTNNGMF-PUSOHNNWSA-N 1 2 224.131 2.151 20 0 BEADLO C[C@H](O)C[N@@H+](C/C(Cl)=C\Cl)C1CC1 ZINC000709487208 712222755 /nfs/dbraw/zinc/22/27/55/712222755.db2.gz YZWMJRFZTNNGMF-PUSOHNNWSA-N 1 2 224.131 2.151 20 0 BEADLO Cc1nc(NC[C@H]2CCC(C)(C)CO2)cc[nH+]1 ZINC000710639402 712264426 /nfs/dbraw/zinc/26/44/26/712264426.db2.gz RABRSVXCSXROBN-LLVKDONJSA-N 1 2 235.331 2.402 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCn2ccnc21)c1ccco1 ZINC000379017403 712368441 /nfs/dbraw/zinc/36/84/41/712368441.db2.gz RCCINODALNBXPS-ZJUUUORDSA-N 1 2 217.272 2.272 20 0 BEADLO C[C@@H]1COCC[N@H+](C/C(Cl)=C\Cl)C1 ZINC000379358272 712376086 /nfs/dbraw/zinc/37/60/86/712376086.db2.gz UWOKPAQACLUFTO-DHFUWRPHSA-N 1 2 224.131 2.274 20 0 BEADLO C[C@@H]1COCC[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000379358272 712376088 /nfs/dbraw/zinc/37/60/88/712376088.db2.gz UWOKPAQACLUFTO-DHFUWRPHSA-N 1 2 224.131 2.274 20 0 BEADLO COCC(C)(C)CSc1nc(N)cc(C)[nH+]1 ZINC000712655405 712439793 /nfs/dbraw/zinc/43/97/93/712439793.db2.gz FXFBQJQOGOGKCU-UHFFFAOYSA-N 1 2 241.360 2.132 20 0 BEADLO CCCn1cc(C[NH2+]Cc2ccccc2F)nn1 ZINC000714498253 712492140 /nfs/dbraw/zinc/49/21/40/712492140.db2.gz IJDYFFWGWITMOD-UHFFFAOYSA-N 1 2 248.305 2.117 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ccccc1F)c1cn(C)nn1 ZINC000715876942 712538741 /nfs/dbraw/zinc/53/87/41/712538741.db2.gz JBDHLPCDLXFNRR-NXEZZACHSA-N 1 2 248.305 2.366 20 0 BEADLO C[C@H]([NH2+]Cc1cscn1)c1ccns1 ZINC000715943612 712544548 /nfs/dbraw/zinc/54/45/48/712544548.db2.gz NCEGMWIBZMDWJY-ZETCQYMHSA-N 1 2 225.342 2.450 20 0 BEADLO C[C@H]1C[N@H+](CC[C@H]2CC2(Cl)Cl)CCO1 ZINC000822564895 712591207 /nfs/dbraw/zinc/59/12/07/712591207.db2.gz YXTMMVASHINSJH-IUCAKERBSA-N 1 2 238.158 2.291 20 0 BEADLO C[C@H]1C[N@@H+](CC[C@H]2CC2(Cl)Cl)CCO1 ZINC000822564895 712591208 /nfs/dbraw/zinc/59/12/08/712591208.db2.gz YXTMMVASHINSJH-IUCAKERBSA-N 1 2 238.158 2.291 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCn2cccc2C1 ZINC000932523523 712717456 /nfs/dbraw/zinc/71/74/56/712717456.db2.gz BRIACGHVCPMMRB-UHFFFAOYSA-N 1 2 244.342 2.281 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCn2cccc2C1 ZINC000932523523 712717458 /nfs/dbraw/zinc/71/74/58/712717458.db2.gz BRIACGHVCPMMRB-UHFFFAOYSA-N 1 2 244.342 2.281 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@@H](C)CCc1ccco1 ZINC000042322095 712720507 /nfs/dbraw/zinc/72/05/07/712720507.db2.gz NUINMPQUYGZFCI-QWRGUYRKSA-N 1 2 239.315 2.142 20 0 BEADLO Cc1nnc(C[NH2+][C@@H]2CCc3c2cccc3F)o1 ZINC000718884126 712787448 /nfs/dbraw/zinc/78/74/48/712787448.db2.gz WBEFLFOCUSCDSD-GFCCVEGCSA-N 1 2 247.273 2.294 20 0 BEADLO COCCCC[N@@H+]1CC[C@H](CF)C(F)(F)C1 ZINC001209214091 957357686 /nfs/dbraw/zinc/35/76/86/957357686.db2.gz KSJGCCJHODETJY-SNVBAGLBSA-N 1 2 239.281 2.340 20 0 BEADLO COCCCC[N@H+]1CC[C@H](CF)C(F)(F)C1 ZINC001209214091 957357697 /nfs/dbraw/zinc/35/76/97/957357697.db2.gz KSJGCCJHODETJY-SNVBAGLBSA-N 1 2 239.281 2.340 20 0 BEADLO CC(C)Oc1cc(NC(C)(C)CCO)cc[nH+]1 ZINC001167739503 960359447 /nfs/dbraw/zinc/35/94/47/960359447.db2.gz KSOMLZSLTMMJCH-UHFFFAOYSA-N 1 2 238.331 2.442 20 0 BEADLO C[N@H+](Cc1cc(O)cc(Cl)c1)C1(C)COC1 ZINC001140797771 960578582 /nfs/dbraw/zinc/57/85/82/960578582.db2.gz QFZKSLWJPFZYQV-UHFFFAOYSA-N 1 2 241.718 2.266 20 0 BEADLO C[N@@H+](Cc1cc(O)cc(Cl)c1)C1(C)COC1 ZINC001140797771 960578594 /nfs/dbraw/zinc/57/85/94/960578594.db2.gz QFZKSLWJPFZYQV-UHFFFAOYSA-N 1 2 241.718 2.266 20 0 BEADLO CC[N@H+](Cc1cc(O)cc(Cl)c1)C1COC1 ZINC001140797494 960580996 /nfs/dbraw/zinc/58/09/96/960580996.db2.gz BAPCUVDUWXGUCM-UHFFFAOYSA-N 1 2 241.718 2.266 20 0 BEADLO CC[N@@H+](Cc1cc(O)cc(Cl)c1)C1COC1 ZINC001140797494 960581017 /nfs/dbraw/zinc/58/10/17/960581017.db2.gz BAPCUVDUWXGUCM-UHFFFAOYSA-N 1 2 241.718 2.266 20 0 BEADLO Cc1ncccc1C[N@H+](C)Cc1cnco1 ZINC001140932911 960711187 /nfs/dbraw/zinc/71/11/87/960711187.db2.gz FOXQWJDZIFWZHM-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ncccc1C[N@@H+](C)Cc1cnco1 ZINC001140932911 960711193 /nfs/dbraw/zinc/71/11/93/960711193.db2.gz FOXQWJDZIFWZHM-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO C1=C[C@@H]([NH2+][C@@H]2CCCc3[nH]ncc32)CC1 ZINC000698203049 965099002 /nfs/dbraw/zinc/09/90/02/965099002.db2.gz DNMWTPQOGANDPC-MWLCHTKSSA-N 1 2 203.289 2.095 20 0 BEADLO Cc1ccc(C[N@H+]2CCC(=O)C(C)(C)C2)o1 ZINC001203297515 966603105 /nfs/dbraw/zinc/60/31/05/966603105.db2.gz HIMZWRDNXJPPMR-UHFFFAOYSA-N 1 2 221.300 2.389 20 0 BEADLO CC[N@H+](Cc1ccccc1Cl)C1CN(C)C1 ZINC001203388174 966624312 /nfs/dbraw/zinc/62/43/12/966624312.db2.gz MASVPPXCISRNPO-UHFFFAOYSA-N 1 2 238.762 2.476 20 0 BEADLO CC[N@@H+](Cc1ccccc1Cl)C1CN(C)C1 ZINC001203388174 966624332 /nfs/dbraw/zinc/62/43/32/966624332.db2.gz MASVPPXCISRNPO-UHFFFAOYSA-N 1 2 238.762 2.476 20 0 BEADLO C[N@@H+](Cc1ccsc1)Cc1cnoc1 ZINC001205703713 967788912 /nfs/dbraw/zinc/78/89/12/967788912.db2.gz JPFUPATVXQJXNP-UHFFFAOYSA-N 1 2 208.286 2.368 20 0 BEADLO C[N@H+](Cc1ccsc1)Cc1cnoc1 ZINC001205703713 967788925 /nfs/dbraw/zinc/78/89/25/967788925.db2.gz JPFUPATVXQJXNP-UHFFFAOYSA-N 1 2 208.286 2.368 20 0 BEADLO C[N@H+](Cc1nc(Br)cs1)C1CC1 ZINC001137774516 968049368 /nfs/dbraw/zinc/04/93/68/968049368.db2.gz YQQNFBLDSVQRRD-UHFFFAOYSA-N 1 2 247.161 2.500 20 0 BEADLO C[N@@H+](Cc1nc(Br)cs1)C1CC1 ZINC001137774516 968049378 /nfs/dbraw/zinc/04/93/78/968049378.db2.gz YQQNFBLDSVQRRD-UHFFFAOYSA-N 1 2 247.161 2.500 20 0 BEADLO Cc1cc(C[NH2+]Cc2ncccc2F)cnc1F ZINC001657304888 1165981845 /nfs/dbraw/zinc/98/18/45/1165981845.db2.gz ADEWONFVJJTATH-UHFFFAOYSA-N 1 2 249.264 2.353 20 0 BEADLO CCC(=CC(=O)NCc1[nH]c(C)c(C)[nH+]1)CC ZINC000822528350 968522265 /nfs/dbraw/zinc/52/22/65/968522265.db2.gz HDZVKWRKYDJPDL-UHFFFAOYSA-N 1 2 235.331 2.389 20 0 BEADLO CC(=O)[C@H]1CCCC[N@@H+]1Cc1scnc1C ZINC001206991504 968529586 /nfs/dbraw/zinc/52/95/86/968529586.db2.gz JMMZSIKXPIYYSM-LLVKDONJSA-N 1 2 238.356 2.395 20 0 BEADLO CC(=O)[C@H]1CCCC[N@H+]1Cc1scnc1C ZINC001206991504 968529594 /nfs/dbraw/zinc/52/95/94/968529594.db2.gz JMMZSIKXPIYYSM-LLVKDONJSA-N 1 2 238.356 2.395 20 0 BEADLO COC(=O)[C@@H]([NH3+])c1ccc(C=C(C)C)cc1 ZINC001240638815 968602167 /nfs/dbraw/zinc/60/21/67/968602167.db2.gz HSAGOZCGBYBQKC-LBPRGKRZSA-N 1 2 219.284 2.283 20 0 BEADLO C[C@H]1C[C@H]1c1nnc([C@@H]([NH3+])c2ccccc2)o1 ZINC000224321340 1166232004 /nfs/dbraw/zinc/23/20/04/1166232004.db2.gz TVSRZZWGFWMHLR-GDPRMGEGSA-N 1 2 229.283 2.241 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1cccc(F)c1C ZINC000399738677 1166253031 /nfs/dbraw/zinc/25/30/31/1166253031.db2.gz WVCYSIBEABXCDJ-UHFFFAOYSA-N 1 2 247.273 2.096 20 0 BEADLO COC(=O)[C@@H]1C[C@@H](F)C[N@@H+]1CCC1CCCC1 ZINC001208690217 969196048 /nfs/dbraw/zinc/19/60/48/969196048.db2.gz BIQLKSKCOFQTGX-NEPJUHHUSA-N 1 2 243.322 2.152 20 0 BEADLO COC(=O)[C@@H]1C[C@@H](F)C[N@H+]1CCC1CCCC1 ZINC001208690217 969196050 /nfs/dbraw/zinc/19/60/50/969196050.db2.gz BIQLKSKCOFQTGX-NEPJUHHUSA-N 1 2 243.322 2.152 20 0 BEADLO CC/C=C\CC[N@@H+]1CCCC(=O)[C@@H](F)C1 ZINC001208726501 969211402 /nfs/dbraw/zinc/21/14/02/969211402.db2.gz XYNZLIBUHSEYIG-BYCRGOAPSA-N 1 2 213.296 2.346 20 0 BEADLO CC/C=C\CC[N@H+]1CCCC(=O)[C@@H](F)C1 ZINC001208726501 969211411 /nfs/dbraw/zinc/21/14/11/969211411.db2.gz XYNZLIBUHSEYIG-BYCRGOAPSA-N 1 2 213.296 2.346 20 0 BEADLO C[N@@H+]1CC=C(N=c2cc(Cl)[nH]cc2O)CC1 ZINC001208793157 969236258 /nfs/dbraw/zinc/23/62/58/969236258.db2.gz DVFOPXGYHHCVOK-UHFFFAOYSA-N 1 2 239.706 2.072 20 0 BEADLO C[N@@H+]1CCCC[C@@H]1CN[C@H]1CCc2cccnc21 ZINC000299928757 1166336754 /nfs/dbraw/zinc/33/67/54/1166336754.db2.gz KCWKYPBKLHGPFF-KGLIPLIRSA-N 1 2 245.370 2.143 20 0 BEADLO C[N@H+]1CCCC[C@@H]1CN[C@H]1CCc2cccnc21 ZINC000299928757 1166336758 /nfs/dbraw/zinc/33/67/58/1166336758.db2.gz KCWKYPBKLHGPFF-KGLIPLIRSA-N 1 2 245.370 2.143 20 0 BEADLO Cc1cccc(NC(=O)C[C@H]([NH3+])C(F)F)c1C ZINC000724761995 1166363204 /nfs/dbraw/zinc/36/32/04/1166363204.db2.gz LQVOEZAFGCVIDP-VIFPVBQESA-N 1 2 242.269 2.224 20 0 BEADLO O[C@@H]1CC[N@@H+](C2CCC3(CC3)CC2)CC1(F)F ZINC001254446682 969636761 /nfs/dbraw/zinc/63/67/61/969636761.db2.gz BZXHGKLSQDZKEY-LLVKDONJSA-N 1 2 245.313 2.411 20 0 BEADLO O[C@@H]1CC[N@H+](C2CCC3(CC3)CC2)CC1(F)F ZINC001254446682 969636766 /nfs/dbraw/zinc/63/67/66/969636766.db2.gz BZXHGKLSQDZKEY-LLVKDONJSA-N 1 2 245.313 2.411 20 0 BEADLO CC[C@H]1CCC[C@@H](C[NH2+]Cc2ncn[nH]2)C1 ZINC000394534721 1166596391 /nfs/dbraw/zinc/59/63/91/1166596391.db2.gz CCSLWPJIGXRAAB-WDEREUQCSA-N 1 2 222.336 2.111 20 0 BEADLO CN(C)c1ccc(Nc2cccnc2)c[nH+]1 ZINC000208083819 1166632989 /nfs/dbraw/zinc/63/29/89/1166632989.db2.gz REFYJQYCXNGBMF-UHFFFAOYSA-N 1 2 214.272 2.286 20 0 BEADLO Cc1cc([C@H](C)Nc2cc(N)nc[nH+]2)c(C)o1 ZINC000112750324 1166632481 /nfs/dbraw/zinc/63/24/81/1166632481.db2.gz YGMUDEONTZTTGI-QMMMGPOBSA-N 1 2 232.287 2.442 20 0 BEADLO C[N@H+](CC(F)F)[C@H]1CCOC(C)(C)C1 ZINC001255552921 970331639 /nfs/dbraw/zinc/33/16/39/970331639.db2.gz GUPDXJNLPAXLGK-QMMMGPOBSA-N 1 2 207.264 2.141 20 0 BEADLO C[N@@H+](CC(F)F)[C@H]1CCOC(C)(C)C1 ZINC001255552921 970331656 /nfs/dbraw/zinc/33/16/56/970331656.db2.gz GUPDXJNLPAXLGK-QMMMGPOBSA-N 1 2 207.264 2.141 20 0 BEADLO C[C@H](CC(F)(F)F)[N@H+]1CCC(=O)[C@H](F)CC1 ZINC001255646581 970425208 /nfs/dbraw/zinc/42/52/08/970425208.db2.gz PFFPHXYCMZAOIZ-HTQZYQBOSA-N 1 2 241.228 2.330 20 0 BEADLO C[C@H](CC(F)(F)F)[N@@H+]1CCC(=O)[C@H](F)CC1 ZINC001255646581 970425214 /nfs/dbraw/zinc/42/52/14/970425214.db2.gz PFFPHXYCMZAOIZ-HTQZYQBOSA-N 1 2 241.228 2.330 20 0 BEADLO Cc1ccc(C[NH2+]Cc2nnc[nH]2)cc1Cl ZINC000235896367 1166796947 /nfs/dbraw/zinc/79/69/47/1166796947.db2.gz UQRKBWMGYVIPMW-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO Cc1nnc(C[NH2+][C@@H](C)c2cccc(F)c2)n1C ZINC000042337921 1166810947 /nfs/dbraw/zinc/81/09/47/1166810947.db2.gz CVMNLBYCYHIEHU-VIFPVBQESA-N 1 2 248.305 2.113 20 0 BEADLO CCC[C@H]([NH2+][C@@H](C)CSCC)C(=O)OCC ZINC000219499354 1166825501 /nfs/dbraw/zinc/82/55/01/1166825501.db2.gz DRNMUAOVZLDOAX-QWRGUYRKSA-N 1 2 247.404 2.449 20 0 BEADLO Cc1cc(CO[C@H]2CCOC[C@H]2F)cc(C)[nH+]1 ZINC001223425982 1166863515 /nfs/dbraw/zinc/86/35/15/1166863515.db2.gz WIVJHRFTKQAWIP-OLZOCXBDSA-N 1 2 239.290 2.342 20 0 BEADLO CCSC[C@H](C)[NH2+]C(CC)(CC)C(=O)OC ZINC001173302584 975204399 /nfs/dbraw/zinc/20/43/99/975204399.db2.gz STOWIIYYQPDPIX-JTQLQIEISA-N 1 2 247.404 2.449 20 0 BEADLO C[C@H](CC(F)(F)F)[N@@H+]1CCC(=O)[C@H](C)C1 ZINC000300362098 1167070974 /nfs/dbraw/zinc/07/09/74/1167070974.db2.gz JNTPZPWWPCIFLB-HTQZYQBOSA-N 1 2 223.238 2.238 20 0 BEADLO C[C@H](CC(F)(F)F)[N@H+]1CCC(=O)[C@H](C)C1 ZINC000300362098 1167070977 /nfs/dbraw/zinc/07/09/77/1167070977.db2.gz JNTPZPWWPCIFLB-HTQZYQBOSA-N 1 2 223.238 2.238 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]C/C=C\C1CC1 ZINC000382160961 1167089967 /nfs/dbraw/zinc/08/99/67/1167089967.db2.gz SQQNSKPRSZALHG-ZBJFTSOASA-N 1 2 205.305 2.335 20 0 BEADLO CO[C@@H](C[NH2+][C@@H](C)c1noc(C)n1)CC(C)C ZINC001332961831 975342372 /nfs/dbraw/zinc/34/23/72/975342372.db2.gz OUYTUICNYUQHDP-GXSJLCMTSA-N 1 2 241.335 2.090 20 0 BEADLO Cc1ccccc1-c1nnc(Cn2cc[nH+]c2)o1 ZINC000158756111 1167158077 /nfs/dbraw/zinc/15/80/77/1167158077.db2.gz WDBHXBRUKUGXHX-UHFFFAOYSA-N 1 2 240.266 2.290 20 0 BEADLO COC(=O)CCCC[C@H](C)[NH+]1CC(C)(F)C1 ZINC001173448217 975387792 /nfs/dbraw/zinc/38/77/92/975387792.db2.gz VKQALNTUJQHIBU-JTQLQIEISA-N 1 2 231.311 2.152 20 0 BEADLO Cc1cc(OC2C[NH+](C(C)C)C2)cnc1F ZINC001228587055 976356266 /nfs/dbraw/zinc/35/62/66/976356266.db2.gz PADAGHNPDNTVHS-UHFFFAOYSA-N 1 2 224.279 2.001 20 0 BEADLO C[N@H+](Cc1ccc(Cl)c(O)c1)C1(C)COC1 ZINC001231737815 977719069 /nfs/dbraw/zinc/71/90/69/977719069.db2.gz WEGPGLHTYUEZFQ-UHFFFAOYSA-N 1 2 241.718 2.266 20 0 BEADLO C[N@@H+](Cc1ccc(Cl)c(O)c1)C1(C)COC1 ZINC001231737815 977719078 /nfs/dbraw/zinc/71/90/78/977719078.db2.gz WEGPGLHTYUEZFQ-UHFFFAOYSA-N 1 2 241.718 2.266 20 0 BEADLO Oc1c[nH]c(Cl)cc1=[NH+]C1=CCOCC1 ZINC001176141802 977924318 /nfs/dbraw/zinc/92/43/18/977924318.db2.gz JUBNVZCGFDDGKH-UHFFFAOYSA-N 1 2 226.663 2.157 20 0 BEADLO F[C@H]1CSC2(C[NH+](Cc3cnsc3)C2)C1 ZINC001232230707 977966115 /nfs/dbraw/zinc/96/61/15/977966115.db2.gz TYFPJTJXUWQSSG-SECBINFHSA-N 1 2 244.360 2.173 20 0 BEADLO CCOc1ncc(C[N@@H+]2CC[C@@H](F)C2)cc1C ZINC001232302998 977997991 /nfs/dbraw/zinc/99/79/91/977997991.db2.gz PUUQPMUDJROCBI-GFCCVEGCSA-N 1 2 238.306 2.333 20 0 BEADLO CCOc1ncc(C[N@H+]2CC[C@@H](F)C2)cc1C ZINC001232302998 977998004 /nfs/dbraw/zinc/99/80/04/977998004.db2.gz PUUQPMUDJROCBI-GFCCVEGCSA-N 1 2 238.306 2.333 20 0 BEADLO COCC1C[NH+](Cc2ccc(C(F)(F)F)o2)C1 ZINC001232438935 978080540 /nfs/dbraw/zinc/08/05/40/978080540.db2.gz CQEBNFPVCIJMSF-UHFFFAOYSA-N 1 2 249.232 2.377 20 0 BEADLO CO[C@H]1C[N@H+](Cc2c(C)cccc2F)C[C@@H]1F ZINC001232482673 978133716 /nfs/dbraw/zinc/13/37/16/978133716.db2.gz UWBDIFPBIQSKOB-STQMWFEESA-N 1 2 241.281 2.303 20 0 BEADLO CO[C@H]1C[N@@H+](Cc2c(C)cccc2F)C[C@@H]1F ZINC001232482673 978133723 /nfs/dbraw/zinc/13/37/23/978133723.db2.gz UWBDIFPBIQSKOB-STQMWFEESA-N 1 2 241.281 2.303 20 0 BEADLO Cc1cccc(F)c1C[N@@H+]1CCO[C@H](C)C1 ZINC001232491200 978144082 /nfs/dbraw/zinc/14/40/82/978144082.db2.gz VUYUEISTMUZGMZ-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cccc(F)c1C[N@H+]1CCO[C@H](C)C1 ZINC001232491200 978144089 /nfs/dbraw/zinc/14/40/89/978144089.db2.gz VUYUEISTMUZGMZ-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO FCc1cccc(C[N@@H+]2CC[C@H](F)C2)n1 ZINC001232535809 978162755 /nfs/dbraw/zinc/16/27/55/978162755.db2.gz LYRJSFQOBGUXBE-VIFPVBQESA-N 1 2 212.243 2.095 20 0 BEADLO FCc1cccc(C[N@H+]2CC[C@H](F)C2)n1 ZINC001232535809 978162758 /nfs/dbraw/zinc/16/27/58/978162758.db2.gz LYRJSFQOBGUXBE-VIFPVBQESA-N 1 2 212.243 2.095 20 0 BEADLO C[NH+](C)Cc1cc(F)c(O)c(Br)c1 ZINC001232630032 978207124 /nfs/dbraw/zinc/20/71/24/978207124.db2.gz IUIXQLJEJHRGGX-UHFFFAOYSA-N 1 2 248.095 2.355 20 0 BEADLO CC[N@H+](Cc1ccnc(Cl)c1C)C1COC1 ZINC001232753899 978261645 /nfs/dbraw/zinc/26/16/45/978261645.db2.gz SFNZINSAOPICKE-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO CC[N@@H+](Cc1ccnc(Cl)c1C)C1COC1 ZINC001232753899 978261654 /nfs/dbraw/zinc/26/16/54/978261654.db2.gz SFNZINSAOPICKE-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO C[N@H+](CCF)Cc1ccc(OC(F)F)nc1 ZINC001232959486 978363631 /nfs/dbraw/zinc/36/36/31/978363631.db2.gz OHEPNHUJQALDSC-UHFFFAOYSA-N 1 2 234.221 2.084 20 0 BEADLO C[N@@H+](CCF)Cc1ccc(OC(F)F)nc1 ZINC001232959486 978363642 /nfs/dbraw/zinc/36/36/42/978363642.db2.gz OHEPNHUJQALDSC-UHFFFAOYSA-N 1 2 234.221 2.084 20 0 BEADLO Cc1ccc(Nc2ncccn2)c(C)[nH+]1 ZINC001203363901 978919576 /nfs/dbraw/zinc/91/95/76/978919576.db2.gz YRUZBKJRAZPYFG-UHFFFAOYSA-N 1 2 200.245 2.232 20 0 BEADLO Fc1cnc(C[N@H+]2CCCCC23CC3)nc1 ZINC001235019891 978955820 /nfs/dbraw/zinc/95/58/20/978955820.db2.gz ZQSBKNLPPQIJKW-UHFFFAOYSA-N 1 2 221.279 2.134 20 0 BEADLO Cc1ncn(C)c1C[N@@H+]1CC[C@](C)(F)[C@@H](F)C1 ZINC001235539562 979079027 /nfs/dbraw/zinc/07/90/27/979079027.db2.gz VSZKOPWDNLGCDZ-RYUDHWBXSA-N 1 2 243.301 2.001 20 0 BEADLO Cc1ncn(C)c1C[N@H+]1CC[C@](C)(F)[C@@H](F)C1 ZINC001235539562 979079038 /nfs/dbraw/zinc/07/90/38/979079038.db2.gz VSZKOPWDNLGCDZ-RYUDHWBXSA-N 1 2 243.301 2.001 20 0 BEADLO CC1(C)C[NH2+]CCN1Cc1ccc(S)cc1 ZINC001235826163 979162226 /nfs/dbraw/zinc/16/22/26/979162226.db2.gz UUHLHRLZFKNWDY-UHFFFAOYSA-N 1 2 236.384 2.159 20 0 BEADLO FC1CC[NH+](Cc2nccnc2Cl)CC1 ZINC001236614015 979681559 /nfs/dbraw/zinc/68/15/59/979681559.db2.gz NTMGWEHBPSIDCF-UHFFFAOYSA-N 1 2 229.686 2.064 20 0 BEADLO CCCCN(CC)C(=O)[C@@H](C)n1cc[nH+]c1 ZINC000044983696 1168317283 /nfs/dbraw/zinc/31/72/83/1168317283.db2.gz BEIJWMFBAABVTN-LLVKDONJSA-N 1 2 223.320 2.093 20 0 BEADLO C[C@H](C(=O)Nc1ccccc1F)n1cc[nH+]c1 ZINC000053898537 1168329571 /nfs/dbraw/zinc/32/95/71/1168329571.db2.gz QTPWPKWYEUGQEM-SECBINFHSA-N 1 2 233.246 2.222 20 0 BEADLO CCc1ccc(N2CCSCC2)[nH+]c1 ZINC000205175862 1168337112 /nfs/dbraw/zinc/33/71/12/1168337112.db2.gz ORIJMUSDRWGHBL-UHFFFAOYSA-N 1 2 208.330 2.197 20 0 BEADLO CC[N@@H+]1CCN(CC2OC=CC2=S)[C@H](C)C1 ZINC001237186334 979836839 /nfs/dbraw/zinc/83/68/39/979836839.db2.gz LOOQBJZCGXWMON-SNVBAGLBSA-N 1 2 240.372 2.094 20 0 BEADLO CC[N@H+]1CCN(CC2OC=CC2=S)[C@H](C)C1 ZINC001237186334 979836843 /nfs/dbraw/zinc/83/68/43/979836843.db2.gz LOOQBJZCGXWMON-SNVBAGLBSA-N 1 2 240.372 2.094 20 0 BEADLO CCN1CC[N@H+](CC2OC=CC2=S)[C@H](C)C1 ZINC001237186334 979836848 /nfs/dbraw/zinc/83/68/48/979836848.db2.gz LOOQBJZCGXWMON-SNVBAGLBSA-N 1 2 240.372 2.094 20 0 BEADLO CCN1CC[N@@H+](CC2OC=CC2=S)[C@H](C)C1 ZINC001237186334 979836850 /nfs/dbraw/zinc/83/68/50/979836850.db2.gz LOOQBJZCGXWMON-SNVBAGLBSA-N 1 2 240.372 2.094 20 0 BEADLO Nc1cccc(C[N@@H+]2C[C@@H](F)C[C@H]2CF)c1 ZINC001237217037 979848457 /nfs/dbraw/zinc/84/84/57/979848457.db2.gz LUNTVWFJKBGEIV-JQWIXIFHSA-N 1 2 226.270 2.151 20 0 BEADLO Nc1cccc(C[N@H+]2C[C@@H](F)C[C@H]2CF)c1 ZINC001237217037 979848462 /nfs/dbraw/zinc/84/84/62/979848462.db2.gz LUNTVWFJKBGEIV-JQWIXIFHSA-N 1 2 226.270 2.151 20 0 BEADLO Cc1cccnc1C[NH+]1CC(C(F)(F)F)C1 ZINC000336189069 1168435954 /nfs/dbraw/zinc/43/59/54/1168435954.db2.gz ZGBXGTRNOMECOQ-UHFFFAOYSA-N 1 2 230.233 2.384 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@@H]2C)c(F)c1O ZINC001238357400 980243564 /nfs/dbraw/zinc/24/35/64/980243564.db2.gz JWQLBLDMNGWBCX-QMMMGPOBSA-N 1 2 225.263 2.134 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@@H]2C)c(F)c1O ZINC001238357400 980243572 /nfs/dbraw/zinc/24/35/72/980243572.db2.gz JWQLBLDMNGWBCX-QMMMGPOBSA-N 1 2 225.263 2.134 20 0 BEADLO Cc1cc(C[N@H+](C)CCF)ncc1Cl ZINC001238423118 980249738 /nfs/dbraw/zinc/24/97/38/980249738.db2.gz WDMDPWJNIWBNEW-UHFFFAOYSA-N 1 2 216.687 2.445 20 0 BEADLO Cc1cc(C[N@@H+](C)CCF)ncc1Cl ZINC001238423118 980249741 /nfs/dbraw/zinc/24/97/41/980249741.db2.gz WDMDPWJNIWBNEW-UHFFFAOYSA-N 1 2 216.687 2.445 20 0 BEADLO CC(C)(O)/C=C/c1ccn2cc[nH+]c2c1 ZINC001239150800 980467200 /nfs/dbraw/zinc/46/72/00/980467200.db2.gz IBNUSCKRMBWJTO-HWKANZROSA-N 1 2 202.257 2.118 20 0 BEADLO CSc1nc(NCCn2cccc2)cc(C)[nH+]1 ZINC001156299356 1168491056 /nfs/dbraw/zinc/49/10/56/1168491056.db2.gz FFVIFLPILBYDRM-UHFFFAOYSA-N 1 2 248.355 2.421 20 0 BEADLO Cc1c[nH+]cc(N[C@H]2CCCOC2)c1C ZINC001169665804 1168499822 /nfs/dbraw/zinc/49/98/22/1168499822.db2.gz KTCZIAPOHZOEMQ-NSHDSACASA-N 1 2 206.289 2.289 20 0 BEADLO CC(C)CC[C@H]1CCC[C@@H]1[NH2+]Cc1ncn[nH]1 ZINC001347114017 980976006 /nfs/dbraw/zinc/97/60/06/980976006.db2.gz NXYUFYLFLJPHBB-NEPJUHHUSA-N 1 2 236.363 2.499 20 0 BEADLO C[C@@H]1CSCC[N@@H+]1Cc1cnn(C)c1Cl ZINC000816511703 1168604206 /nfs/dbraw/zinc/60/42/06/1168604206.db2.gz IKHQQURYFIQCPA-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO C[C@@H]1CSCC[N@H+]1Cc1cnn(C)c1Cl ZINC000816511703 1168604211 /nfs/dbraw/zinc/60/42/11/1168604211.db2.gz IKHQQURYFIQCPA-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO Fc1ccc2[nH]nc(C[N@@H+]3C[C@@H]4C[C@@H]4C3)c2c1 ZINC001144192583 1168647330 /nfs/dbraw/zinc/64/73/30/1168647330.db2.gz FGPWNLTXKXOYHQ-DTORHVGOSA-N 1 2 231.274 2.154 20 0 BEADLO Fc1ccc2[nH]nc(C[N@H+]3C[C@@H]4C[C@@H]4C3)c2c1 ZINC001144192583 1168647333 /nfs/dbraw/zinc/64/73/33/1168647333.db2.gz FGPWNLTXKXOYHQ-DTORHVGOSA-N 1 2 231.274 2.154 20 0 BEADLO Fc1cccc2c1CC[C@H]([N@@H+]1CCO[C@@H]3C[C@@H]31)C2 ZINC001171442924 1168672059 /nfs/dbraw/zinc/67/20/59/1168672059.db2.gz USGHRYDPYIXYPH-TUKIKUTGSA-N 1 2 247.313 2.156 20 0 BEADLO Fc1cccc2c1CC[C@H]([N@H+]1CCO[C@@H]3C[C@@H]31)C2 ZINC001171442924 1168672064 /nfs/dbraw/zinc/67/20/64/1168672064.db2.gz USGHRYDPYIXYPH-TUKIKUTGSA-N 1 2 247.313 2.156 20 0 BEADLO CS[C@H]1CC[C@H]([N@H+](C)Cc2cnsn2)C1 ZINC001349761264 981705450 /nfs/dbraw/zinc/70/54/50/981705450.db2.gz WFVAJJDAKQIHKW-UWVGGRQHSA-N 1 2 243.401 2.254 20 0 BEADLO CS[C@H]1CC[C@H]([N@@H+](C)Cc2cnsn2)C1 ZINC001349761264 981705465 /nfs/dbraw/zinc/70/54/65/981705465.db2.gz WFVAJJDAKQIHKW-UWVGGRQHSA-N 1 2 243.401 2.254 20 0 BEADLO CCC=C(C)C(=O)Nc1c(C)c[nH+]cc1C ZINC001349791271 981744766 /nfs/dbraw/zinc/74/47/66/981744766.db2.gz GHDPTIYVQJTLOM-RMKNXTFCSA-N 1 2 218.300 2.415 20 0 BEADLO CCC(CC)COC(=O)NCc1c[nH+]cn1C ZINC001194679394 981853850 /nfs/dbraw/zinc/85/38/50/981853850.db2.gz MKKNRMASHHVKFS-UHFFFAOYSA-N 1 2 239.319 2.083 20 0 BEADLO CSc1ccc(C[N@H+]2CC[C@]23CCOC3)o1 ZINC001350326474 981927174 /nfs/dbraw/zinc/92/71/74/981927174.db2.gz CPVNLXFRSYBNSA-GFCCVEGCSA-N 1 2 239.340 2.366 20 0 BEADLO COc1cc(-c2cc[nH+]c(N)c2)ccc1F ZINC001241418710 982569019 /nfs/dbraw/zinc/56/90/19/982569019.db2.gz GUQFHAWUJNRVNX-UHFFFAOYSA-N 1 2 218.231 2.479 20 0 BEADLO Cc1nc(NCC2(CO)CCC2)cc(C(C)C)[nH+]1 ZINC000717686749 1169030487 /nfs/dbraw/zinc/03/04/87/1169030487.db2.gz SMDDXRFVGNNYDT-UHFFFAOYSA-N 1 2 249.358 2.483 20 0 BEADLO CCC[C@@H](C)C[N@H+]1C[C@H](F)C[C@H]1C(=O)OC ZINC001201538492 983295216 /nfs/dbraw/zinc/29/52/16/983295216.db2.gz HECTYQGCCAZPMW-MXWKQRLJSA-N 1 2 231.311 2.008 20 0 BEADLO CCC[N@@H+]1Cc2cccc(C(=O)OC)c2C1 ZINC001201643338 983396525 /nfs/dbraw/zinc/39/65/25/983396525.db2.gz GHAXPLCBVZUBCL-UHFFFAOYSA-N 1 2 219.284 2.199 20 0 BEADLO CCC[N@H+]1Cc2cccc(C(=O)OC)c2C1 ZINC001201643338 983396533 /nfs/dbraw/zinc/39/65/33/983396533.db2.gz GHAXPLCBVZUBCL-UHFFFAOYSA-N 1 2 219.284 2.199 20 0 BEADLO CCn1ccnc1[C@H](C)[NH2+]Cc1cncs1 ZINC001202388637 983630971 /nfs/dbraw/zinc/63/09/71/983630971.db2.gz WGTORFBCHNIEJB-VIFPVBQESA-N 1 2 236.344 2.210 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)[C@H](C)n1cc[nH+]c1 ZINC000052902293 1169133808 /nfs/dbraw/zinc/13/38/08/1169133808.db2.gz VDZAWQPZIZJHAI-MNOVXSKESA-N 1 2 223.320 2.091 20 0 BEADLO CCCCCOC(=O)C[NH2+][C@@H](C)CCOCC ZINC001172423032 974697276 /nfs/dbraw/zinc/69/72/76/974697276.db2.gz YRVYRDWCDSJBAS-LBPRGKRZSA-N 1 2 245.363 2.125 20 0 BEADLO COC(=O)C[N@H+](Cc1cc(C)co1)CC(C)C ZINC001331554687 974761278 /nfs/dbraw/zinc/76/12/78/974761278.db2.gz XCWDWEXKMFHMCC-UHFFFAOYSA-N 1 2 239.315 2.219 20 0 BEADLO CCOC(=O)C(C)(C)[NH2+][C@H](C)CCOC(C)C ZINC001172438522 974796050 /nfs/dbraw/zinc/79/60/50/974796050.db2.gz SBVKVHKKCXTMLK-LLVKDONJSA-N 1 2 245.363 2.121 20 0 BEADLO COc1cc(C[N@@H+]2CC[C@H](F)C2)ccc1F ZINC001117748152 1169307336 /nfs/dbraw/zinc/30/73/36/1169307336.db2.gz PWLSGNONGYLXSP-JTQLQIEISA-N 1 2 227.254 2.378 20 0 BEADLO COc1cc(C[N@H+]2CC[C@H](F)C2)ccc1F ZINC001117748152 1169307344 /nfs/dbraw/zinc/30/73/44/1169307344.db2.gz PWLSGNONGYLXSP-JTQLQIEISA-N 1 2 227.254 2.378 20 0 BEADLO C[C@H](OCc1c[nH+]cn1C)c1ccncc1 ZINC001222594974 972591002 /nfs/dbraw/zinc/59/10/02/972591002.db2.gz KLEHGZXLEUKBJR-JTQLQIEISA-N 1 2 217.272 2.093 20 0 BEADLO CC[C@H](C)[C@@H]1CCCC[N@@H+]1Cc1nc[nH]n1 ZINC001327545040 972623079 /nfs/dbraw/zinc/62/30/79/972623079.db2.gz CZBPFXTVRGRJEA-QWRGUYRKSA-N 1 2 222.336 2.205 20 0 BEADLO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cc1nc[nH]n1 ZINC001327545040 972623089 /nfs/dbraw/zinc/62/30/89/972623089.db2.gz CZBPFXTVRGRJEA-QWRGUYRKSA-N 1 2 222.336 2.205 20 0 BEADLO Cc1cc(COCC(=O)OC(C)C)cc(C)[nH+]1 ZINC001223419412 973048848 /nfs/dbraw/zinc/04/88/48/973048848.db2.gz DFAPJMOODWSEHP-UHFFFAOYSA-N 1 2 237.299 2.167 20 0 BEADLO C[NH+]1CC(OC(C)(C)c2ccccc2)C1 ZINC001223956163 973352998 /nfs/dbraw/zinc/35/29/98/973352998.db2.gz QUHQQIXNYJQIQB-UHFFFAOYSA-N 1 2 205.301 2.252 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2c(c1)[C@@H](O)CCO2 ZINC001243476923 970771504 /nfs/dbraw/zinc/77/15/04/970771504.db2.gz WISNAWLYVOVOOT-LBPRGKRZSA-N 1 2 242.278 2.147 20 0 BEADLO Cc1nc2c(ncc(-c3ccc[nH+]c3N)c2C)[nH]1 ZINC001243478553 970771622 /nfs/dbraw/zinc/77/16/22/970771622.db2.gz ZCIMYYIOONRRBN-UHFFFAOYSA-N 1 2 239.282 2.219 20 0 BEADLO CCOC1CCC([NH+]2CC(C)(F)C2)CC1 ZINC001256436671 970836940 /nfs/dbraw/zinc/83/69/40/970836940.db2.gz MXWHLNQRYCRFKP-UHFFFAOYSA-N 1 2 215.312 2.378 20 0 BEADLO CC1=C(C)CN(C(=O)[C@H](C)n2cc[nH+]c2)CC1 ZINC001256441801 970842200 /nfs/dbraw/zinc/84/22/00/970842200.db2.gz UZGODXOOIURVEN-LBPRGKRZSA-N 1 2 233.315 2.013 20 0 BEADLO CNc1cc(N[C@@H]2CC[C@@H]3C[C@@H]3C2)[nH+]cn1 ZINC000403078954 970875203 /nfs/dbraw/zinc/87/52/03/970875203.db2.gz ANXWCPCZXLZOJI-OPRDCNLKSA-N 1 2 218.304 2.119 20 0 BEADLO CC(C)[N@@H+]1CC[C@H]1c1nnc([C@@H]2C[C@H]2C)o1 ZINC001256702084 970931301 /nfs/dbraw/zinc/93/13/01/970931301.db2.gz XOWSEXSYCBGMOP-BBBLOLIVSA-N 1 2 221.304 2.348 20 0 BEADLO CC(C)[N@H+]1CC[C@H]1c1nnc([C@@H]2C[C@H]2C)o1 ZINC001256702084 970931312 /nfs/dbraw/zinc/93/13/12/970931312.db2.gz XOWSEXSYCBGMOP-BBBLOLIVSA-N 1 2 221.304 2.348 20 0 BEADLO CCOC(=O)c1ccc(C2=C[NH2+]CCC2)nc1C ZINC001243947275 971033224 /nfs/dbraw/zinc/03/32/24/971033224.db2.gz HJFFTAIFMKDAPD-UHFFFAOYSA-N 1 2 246.310 2.291 20 0 BEADLO NC(=O)CCNc1[nH+]ccc2cc(Cl)ccc21 ZINC001158105368 971070027 /nfs/dbraw/zinc/07/00/27/971070027.db2.gz CMICELPEFYSHNA-UHFFFAOYSA-N 1 2 249.701 2.176 20 0 BEADLO c1cn2ccc(NC3=CCCOC3)cc2[nH+]1 ZINC001216506929 971107736 /nfs/dbraw/zinc/10/77/36/971107736.db2.gz BXUIHQDRXKELIA-UHFFFAOYSA-N 1 2 215.256 2.050 20 0 BEADLO CC(C)C[C@@H](OCC[NH+]1CCOCC1)C(C)C ZINC001210206604 1169520363 /nfs/dbraw/zinc/52/03/63/1169520363.db2.gz HCKSUSCJFGYFEN-CQSZACIVSA-N 1 2 243.391 2.406 20 0 BEADLO CCC[C@H](CC)[N@@H+]1CCC(=O)[C@H](F)C1 ZINC001257264683 971164715 /nfs/dbraw/zinc/16/47/15/971164715.db2.gz QSQVAPYBCCZIMA-VHSXEESVSA-N 1 2 201.285 2.178 20 0 BEADLO CCC[C@H](CC)[N@H+]1CCC(=O)[C@H](F)C1 ZINC001257264683 971164719 /nfs/dbraw/zinc/16/47/19/971164719.db2.gz QSQVAPYBCCZIMA-VHSXEESVSA-N 1 2 201.285 2.178 20 0 BEADLO Cn1c[nH+]c2cc(Nc3cncc(N)c3)ccc21 ZINC001210440091 1169528482 /nfs/dbraw/zinc/52/84/82/1169528482.db2.gz SWHGVAPVBGRAHT-UHFFFAOYSA-N 1 2 239.282 2.294 20 0 BEADLO CCC[C@@H](C(=O)OCC)[NH+]1CCC(F)(F)CC1 ZINC000405049196 971188443 /nfs/dbraw/zinc/18/84/43/971188443.db2.gz GTYMSVXDFIFWPN-JTQLQIEISA-N 1 2 249.301 2.449 20 0 BEADLO CCc1nnc([C@@H]2CC[C@@H](C(F)(F)F)C[NH2+]2)o1 ZINC001217706049 971350392 /nfs/dbraw/zinc/35/03/92/971350392.db2.gz LOZNCTOUDIJVOZ-RQJHMYQMSA-N 1 2 249.236 2.235 20 0 BEADLO COc1cc(/C(C)=C/C=C/[NH3+])ccc1CO ZINC001244667601 971398297 /nfs/dbraw/zinc/39/82/97/971398297.db2.gz YZRVVSOHAJQXAR-DROBUMMNSA-N 1 2 219.284 2.063 20 0 BEADLO Nc1[nH+]cccc1-c1ccc(CO)c(F)c1F ZINC001244720725 971407001 /nfs/dbraw/zinc/40/70/01/971407001.db2.gz KQALDXQOEYIPBO-UHFFFAOYSA-N 1 2 236.221 2.101 20 0 BEADLO CCCCC[C@H](C)[NH2+]CC(=O)OCCC ZINC001257506663 971427281 /nfs/dbraw/zinc/42/72/81/971427281.db2.gz RGISTOYKQAUZQV-NSHDSACASA-N 1 2 215.337 2.498 20 0 BEADLO CC(C)c1nc(C[NH2+][C@@H]2CCCSC2)no1 ZINC001257657889 971460535 /nfs/dbraw/zinc/46/05/35/971460535.db2.gz MBHRHBODQLCZLQ-SECBINFHSA-N 1 2 241.360 2.178 20 0 BEADLO C[NH+](C)Cc1nnc(CCCc2ccccc2)o1 ZINC001257734899 971494994 /nfs/dbraw/zinc/49/49/94/971494994.db2.gz BJCIFNBSBHAJPF-UHFFFAOYSA-N 1 2 245.326 2.307 20 0 BEADLO C[NH+](C)C1(c2nnc(CC(C)(C)C)o2)CC1 ZINC001257866246 971509481 /nfs/dbraw/zinc/50/94/81/971509481.db2.gz OXGQJDUTEMVVAN-UHFFFAOYSA-N 1 2 223.320 2.209 20 0 BEADLO C[C@@H](C[NH+](C)C)Oc1cccc(S)c1 ZINC001226015397 1169599432 /nfs/dbraw/zinc/59/94/32/1169599432.db2.gz JOICBUPKXJQINE-VIFPVBQESA-N 1 2 211.330 2.304 20 0 BEADLO CCCCNC(=O)Cn1c[nH+]c(C(C)(C)C)c1 ZINC001330324747 974233688 /nfs/dbraw/zinc/23/36/88/974233688.db2.gz YEUHKBZHIBAXHP-UHFFFAOYSA-N 1 2 237.347 2.097 20 0 BEADLO CC1(C)[C@@H]2C[C@@H]([N@@H+]3CC(F)(F)C[C@H]3CO)C[C@@H]21 ZINC001170739569 971685797 /nfs/dbraw/zinc/68/57/97/971685797.db2.gz PFVYSBTXVBWOGF-XWLWVQCSSA-N 1 2 245.313 2.123 20 0 BEADLO CC1(C)[C@@H]2C[C@@H]([N@H+]3CC(F)(F)C[C@H]3CO)C[C@@H]21 ZINC001170739569 971685807 /nfs/dbraw/zinc/68/58/07/971685807.db2.gz PFVYSBTXVBWOGF-XWLWVQCSSA-N 1 2 245.313 2.123 20 0 BEADLO C[C@@H](O)[C@H](C)[NH2+]CC(F)(F)c1cccc(F)c1 ZINC001330608280 974357058 /nfs/dbraw/zinc/35/70/58/974357058.db2.gz FBRDAYHYFRFQSZ-DTWKUNHWSA-N 1 2 247.260 2.276 20 0 BEADLO CCC=CNc1cc(NC(C)=O)cc[nH+]1 ZINC001170763861 971748066 /nfs/dbraw/zinc/74/80/66/971748066.db2.gz NAVXIEPIYGTHCZ-GQCTYLIASA-N 1 2 205.261 2.376 20 0 BEADLO Cc1cc(-c2cnc3c(c2)CCCN3)c[nH+]c1N ZINC001245540416 971852692 /nfs/dbraw/zinc/85/26/92/971852692.db2.gz CZLCNHOBRAOGCE-UHFFFAOYSA-N 1 2 240.310 2.035 20 0 BEADLO Cc1cc(-c2ncnc(C)c2C)c[nH+]c1N ZINC001245535502 971850655 /nfs/dbraw/zinc/85/06/55/971850655.db2.gz AFPUWMYLRDFUJU-UHFFFAOYSA-N 1 2 214.272 2.046 20 0 BEADLO F[C@H]1C[N@H+](C[C@@H]2CCCCO2)CCC1(F)F ZINC001207954760 956893214 /nfs/dbraw/zinc/89/32/14/956893214.db2.gz UEQYRCJFLSKAMG-UWVGGRQHSA-N 1 2 237.265 2.235 20 0 BEADLO F[C@H]1C[N@@H+](C[C@@H]2CCCCO2)CCC1(F)F ZINC001207954760 956893230 /nfs/dbraw/zinc/89/32/30/956893230.db2.gz UEQYRCJFLSKAMG-UWVGGRQHSA-N 1 2 237.265 2.235 20 0 BEADLO Fc1cccc2c1C[C@H]([N@@H+]1CCO[C@@H]3C[C@@H]31)CC2 ZINC001171006031 972233817 /nfs/dbraw/zinc/23/38/17/972233817.db2.gz VTEFSIPBOIZLGD-BYCMXARLSA-N 1 2 247.313 2.156 20 0 BEADLO Fc1cccc2c1C[C@H]([N@H+]1CCO[C@@H]3C[C@@H]31)CC2 ZINC001171006031 972233823 /nfs/dbraw/zinc/23/38/23/972233823.db2.gz VTEFSIPBOIZLGD-BYCMXARLSA-N 1 2 247.313 2.156 20 0 BEADLO CCN(CCn1cccn1)c1[nH+]ccc(F)c1C ZINC001167060223 957029175 /nfs/dbraw/zinc/02/91/75/957029175.db2.gz OTYRCKXCLMADQD-UHFFFAOYSA-N 1 2 248.305 2.252 20 0 BEADLO CCN1CC[N@H+](C[C@H](C)C(F)(F)F)C[C@H]1C ZINC001208897793 957219921 /nfs/dbraw/zinc/21/99/21/957219921.db2.gz JDEPBZPARQKLGX-VHSXEESVSA-N 1 2 238.297 2.211 20 0 BEADLO CCN1CC[N@@H+](C[C@H](C)C(F)(F)F)C[C@H]1C ZINC001208897793 957219936 /nfs/dbraw/zinc/21/99/36/957219936.db2.gz JDEPBZPARQKLGX-VHSXEESVSA-N 1 2 238.297 2.211 20 0 BEADLO Nc1cc(F)cnc1Nc1ccc2[nH]c[nH+]c2c1 ZINC001209844841 957542095 /nfs/dbraw/zinc/54/20/95/957542095.db2.gz QMKOCVDETDTTBI-UHFFFAOYSA-N 1 2 243.245 2.423 20 0 BEADLO COc1ccc(Nc2c[nH+]c(C)c(N)c2)cn1 ZINC001210285817 957715194 /nfs/dbraw/zinc/71/51/94/957715194.db2.gz SQHHDRLGTDSOQL-UHFFFAOYSA-N 1 2 230.271 2.119 20 0 BEADLO Cc1cc2cc(NCc3cccnn3)[nH+]cc2[nH]1 ZINC001167321804 957748887 /nfs/dbraw/zinc/74/88/87/957748887.db2.gz XYBLRXUTFYDOHM-UHFFFAOYSA-N 1 2 239.282 2.273 20 0 BEADLO COc1cccc2[nH+]c(NC3CC(=O)C3)ccc21 ZINC001167335993 957787907 /nfs/dbraw/zinc/78/79/07/957787907.db2.gz NLXOCLDXOYWUPP-UHFFFAOYSA-N 1 2 242.278 2.387 20 0 BEADLO Cn1c[nH+]cc1-c1cccc(NC2CC(=O)C2)c1 ZINC001167344841 957822780 /nfs/dbraw/zinc/82/27/80/957822780.db2.gz WYJQBEGEAGAVIW-UHFFFAOYSA-N 1 2 241.294 2.231 20 0 BEADLO CC(C)COc1cc(NC2CC(=O)C2)cc[nH+]1 ZINC001167348237 957851948 /nfs/dbraw/zinc/85/19/48/957851948.db2.gz TXANEJGZKWLAAO-UHFFFAOYSA-N 1 2 234.299 2.260 20 0 BEADLO Cc1cc(NC2CC(=O)C2)[nH+]c2cc[nH]c21 ZINC001167348414 957854561 /nfs/dbraw/zinc/85/45/61/957854561.db2.gz XAAOHNBIEACWRN-UHFFFAOYSA-N 1 2 215.256 2.015 20 0 BEADLO Cc1nonc1C[NH2+]Cc1cc(C)cc(C)c1 ZINC000693194959 957856975 /nfs/dbraw/zinc/85/69/75/957856975.db2.gz XEWSCMXKPAWLJX-UHFFFAOYSA-N 1 2 231.299 2.285 20 0 BEADLO CC=C(C)Nc1ccc[nH+]c1N1CCOCC1 ZINC001210792101 957887425 /nfs/dbraw/zinc/88/74/25/957887425.db2.gz JTBXBTAXPPDVLM-QDEBKDIKSA-N 1 2 233.315 2.254 20 0 BEADLO Cc1cccn2c(CN3CC(C)(F)C3)c[nH+]c12 ZINC001136959294 972305062 /nfs/dbraw/zinc/30/50/62/972305062.db2.gz AXYXLHYSCSRPHH-UHFFFAOYSA-N 1 2 233.290 2.187 20 0 BEADLO Cc1cccn2c(CN3CC(F)(F)C3)c[nH+]c12 ZINC001136958560 972305306 /nfs/dbraw/zinc/30/53/06/972305306.db2.gz VVZFKOCFQGYCIY-UHFFFAOYSA-N 1 2 237.253 2.094 20 0 BEADLO C[C@H](C(=O)N1CCC[C@H](C2CC2)C1)n1cc[nH+]c1 ZINC001347513573 957956755 /nfs/dbraw/zinc/95/67/55/957956755.db2.gz IHGSVQBPFKBMQY-YPMHNXCESA-N 1 2 247.342 2.093 20 0 BEADLO CC(C)[C@@](C)(Nc1ccc(C2CC2)c[nH+]1)C(N)=O ZINC001167415041 958043571 /nfs/dbraw/zinc/04/35/71/958043571.db2.gz GZQVBBZHMKXMJS-CQSZACIVSA-N 1 2 247.342 2.271 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCc2cnccc2C1 ZINC001207133299 958130482 /nfs/dbraw/zinc/13/04/82/958130482.db2.gz NPMQUTKADAOXHJ-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCc2cnccc2C1 ZINC001207133299 958130499 /nfs/dbraw/zinc/13/04/99/958130499.db2.gz NPMQUTKADAOXHJ-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO COc1ncc(C[NH+]2CC(C(F)F)C2)cc1C ZINC001137009978 972323245 /nfs/dbraw/zinc/32/32/45/972323245.db2.gz YSFXSUXWBGQRGW-UHFFFAOYSA-N 1 2 242.269 2.096 20 0 BEADLO Cc1c[nH+]cc(N(C)c2ncccc2N)c1C ZINC001213523184 958200641 /nfs/dbraw/zinc/20/06/41/958200641.db2.gz MZJYSLAVLDZLFW-UHFFFAOYSA-N 1 2 228.299 2.444 20 0 BEADLO Cc1c[nH+]cc(Nc2nccn3ccnc23)c1C ZINC001213525419 958202970 /nfs/dbraw/zinc/20/29/70/958202970.db2.gz VLNZWNWOMNQMMW-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO c1cc(C[N@@H+]2C[C@H]3CC[C@@H]2CO3)cc2c1COC2 ZINC001137030746 972333281 /nfs/dbraw/zinc/33/32/81/972333281.db2.gz LBXVAGQRGUIWNA-HUUCEWRRSA-N 1 2 245.322 2.080 20 0 BEADLO c1cc(C[N@H+]2C[C@H]3CC[C@@H]2CO3)cc2c1COC2 ZINC001137030746 972333284 /nfs/dbraw/zinc/33/32/84/972333284.db2.gz LBXVAGQRGUIWNA-HUUCEWRRSA-N 1 2 245.322 2.080 20 0 BEADLO CCOc1ccc(C[NH2+]Cc2csnn2)cc1 ZINC000398465963 958276224 /nfs/dbraw/zinc/27/62/24/958276224.db2.gz LDOWOUJNLUWPJT-UHFFFAOYSA-N 1 2 249.339 2.227 20 0 BEADLO Cc1nc(N[C@@H](C)c2ccc(F)cn2)cc[nH+]1 ZINC001167483638 958441730 /nfs/dbraw/zinc/44/17/30/958441730.db2.gz VPBKVAYUJSVMAH-QMMMGPOBSA-N 1 2 232.262 2.492 20 0 BEADLO Cc1c(F)cc(F)cc1C[N@@H+](C)C1(C)COC1 ZINC001143767641 972356741 /nfs/dbraw/zinc/35/67/41/972356741.db2.gz GDOGLTKPDDZAAA-UHFFFAOYSA-N 1 2 241.281 2.494 20 0 BEADLO Cc1c(F)cc(F)cc1C[N@H+](C)C1(C)COC1 ZINC001143767641 972356748 /nfs/dbraw/zinc/35/67/48/972356748.db2.gz GDOGLTKPDDZAAA-UHFFFAOYSA-N 1 2 241.281 2.494 20 0 BEADLO CC1=CC[C@@H](CC[N@@H+]2C[C@@H]3C[C@H]2C(=O)O3)C1(C)C ZINC001207277876 958860240 /nfs/dbraw/zinc/86/02/40/958860240.db2.gz WSYMALZZMIYHBV-AVGNSLFASA-N 1 2 249.354 2.369 20 0 BEADLO CC1=CC[C@@H](CC[N@H+]2C[C@@H]3C[C@H]2C(=O)O3)C1(C)C ZINC001207277876 958860241 /nfs/dbraw/zinc/86/02/41/958860241.db2.gz WSYMALZZMIYHBV-AVGNSLFASA-N 1 2 249.354 2.369 20 0 BEADLO C[C@H](OCCn1cc[nH+]c1)c1ccncc1 ZINC001222134546 972384851 /nfs/dbraw/zinc/38/48/51/972384851.db2.gz GBAXVJKCAZIZGA-NSHDSACASA-N 1 2 217.272 2.056 20 0 BEADLO CC1(C)C(=O)CCC[C@@H]1OCCn1cc[nH+]c1 ZINC001222139702 972385683 /nfs/dbraw/zinc/38/56/83/972385683.db2.gz USSMKQJCPBCZLG-LBPRGKRZSA-N 1 2 236.315 2.048 20 0 BEADLO C[C@H](OCCn1cc[nH+]c1)c1ncccc1F ZINC001222139809 972387531 /nfs/dbraw/zinc/38/75/31/972387531.db2.gz XOTGGZAZPJFREI-JTQLQIEISA-N 1 2 235.262 2.195 20 0 BEADLO COc1ccc(C[NH+]2CC=CC2)c(F)c1F ZINC001143902697 972388566 /nfs/dbraw/zinc/38/85/66/972388566.db2.gz JGFOQOGSTRLDKD-UHFFFAOYSA-N 1 2 225.238 2.345 20 0 BEADLO COc1ccc(C[NH+]2CC(C)C2)c(F)c1F ZINC001143902584 972390280 /nfs/dbraw/zinc/39/02/80/972390280.db2.gz IWCQVVHHWQXJPQ-UHFFFAOYSA-N 1 2 227.254 2.425 20 0 BEADLO Cc1cc(NCc2cc[nH+]c(N)c2)ccc1N ZINC001167616712 959076099 /nfs/dbraw/zinc/07/60/99/959076099.db2.gz NGRHUBFDXNGYHD-UHFFFAOYSA-N 1 2 228.299 2.167 20 0 BEADLO Nc1cc(CNc2ccc3cc[nH]c3n2)cc[nH+]1 ZINC001167617408 959088014 /nfs/dbraw/zinc/08/80/14/959088014.db2.gz LWMVXFAXBUYFQK-UHFFFAOYSA-N 1 2 239.282 2.152 20 0 BEADLO CC(C)(C)[C@@H]1CCCN(c2cc(N)nc[nH+]2)C1 ZINC000708466462 959475933 /nfs/dbraw/zinc/47/59/33/959475933.db2.gz IEUUHRFRVBGLRS-SNVBAGLBSA-N 1 2 234.347 2.321 20 0 BEADLO C[C@@H]([NH2+]Cc1ccsc1)c1cc(CO)on1 ZINC000309786278 959695212 /nfs/dbraw/zinc/69/52/12/959695212.db2.gz OCZPMSUPDPKMMT-MRVPVSSYSA-N 1 2 238.312 2.079 20 0 BEADLO Oc1ccccc1CCNc1cccc[nH+]1 ZINC000309493565 959887737 /nfs/dbraw/zinc/88/77/37/959887737.db2.gz JLFURTWHPKLKOL-UHFFFAOYSA-N 1 2 214.268 2.442 20 0 BEADLO C[C@@H](NC(=O)[C@@H](C)n1cc[nH+]c1)c1ccsc1 ZINC001327188022 972483123 /nfs/dbraw/zinc/48/31/23/972483123.db2.gz OWGRQMBNYYXXHM-NXEZZACHSA-N 1 2 249.339 2.383 20 0 BEADLO C[C@@]1(F)CCC[N@H+](Cc2csnn2)CC1 ZINC001140992791 960163854 /nfs/dbraw/zinc/16/38/54/960163854.db2.gz XTRZFULPLJUHOF-SNVBAGLBSA-N 1 2 229.324 2.252 20 0 BEADLO C[C@@]1(F)CCC[N@@H+](Cc2csnn2)CC1 ZINC001140992791 960163860 /nfs/dbraw/zinc/16/38/60/960163860.db2.gz XTRZFULPLJUHOF-SNVBAGLBSA-N 1 2 229.324 2.252 20 0 BEADLO Fc1c[nH+]ccc1NC1(C2CCOCC2)CC1 ZINC001167743870 960439486 /nfs/dbraw/zinc/43/94/86/960439486.db2.gz RKEFWYUNLIOKBR-UHFFFAOYSA-N 1 2 236.290 2.014 20 0 BEADLO CO[C@@H]1C[N@H+](Cc2cc(F)ccc2C)C[C@@H]1F ZINC001140589760 960445080 /nfs/dbraw/zinc/44/50/80/960445080.db2.gz MJMLKHULCBJOAU-QWHCGFSZSA-N 1 2 241.281 2.303 20 0 BEADLO CO[C@@H]1C[N@@H+](Cc2cc(F)ccc2C)C[C@@H]1F ZINC001140589760 960445086 /nfs/dbraw/zinc/44/50/86/960445086.db2.gz MJMLKHULCBJOAU-QWHCGFSZSA-N 1 2 241.281 2.303 20 0 BEADLO Cc1ccc(F)cc1C[N@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001140594643 960449411 /nfs/dbraw/zinc/44/94/11/960449411.db2.gz GCMNMEAXKGXTON-BETUJISGSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001140594643 960449416 /nfs/dbraw/zinc/44/94/16/960449416.db2.gz GCMNMEAXKGXTON-BETUJISGSA-N 1 2 221.275 2.107 20 0 BEADLO C[C@@H]1C[NH+](Cc2c[nH]c3ccncc23)C[C@@H](C)O1 ZINC001140799383 960583405 /nfs/dbraw/zinc/58/34/05/960583405.db2.gz BNWNOGQAUYKBFQ-GHMZBOCLSA-N 1 2 245.326 2.172 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC(=O)[C@@H](C)C2)c1C ZINC001140858424 960635019 /nfs/dbraw/zinc/63/50/19/960635019.db2.gz JCMFAELAYQQCNS-JTQLQIEISA-N 1 2 220.316 2.042 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC(=O)[C@@H](C)C2)c1C ZINC001140858424 960635029 /nfs/dbraw/zinc/63/50/29/960635029.db2.gz JCMFAELAYQQCNS-JTQLQIEISA-N 1 2 220.316 2.042 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)[nH]n1 ZINC001203076215 960677526 /nfs/dbraw/zinc/67/75/26/960677526.db2.gz YQBRPBXGNAYDKZ-VIFPVBQESA-N 1 2 247.264 2.492 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@H](C(F)(F)F)C2)[nH]n1 ZINC001203076215 960677537 /nfs/dbraw/zinc/67/75/37/960677537.db2.gz YQBRPBXGNAYDKZ-VIFPVBQESA-N 1 2 247.264 2.492 20 0 BEADLO Fc1cccc2c1CC[N@H+](Cc1cnco1)C2 ZINC001140934137 960716711 /nfs/dbraw/zinc/71/67/11/960716711.db2.gz UXTBUZNUXBAPQL-UHFFFAOYSA-N 1 2 232.258 2.372 20 0 BEADLO Fc1cccc2c1CC[N@@H+](Cc1cnco1)C2 ZINC001140934137 960716723 /nfs/dbraw/zinc/71/67/23/960716723.db2.gz UXTBUZNUXBAPQL-UHFFFAOYSA-N 1 2 232.258 2.372 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ncco2)CCC1(F)F ZINC001141004338 960801128 /nfs/dbraw/zinc/80/11/28/960801128.db2.gz CCMAVFKUTDBSRH-MRVPVSSYSA-N 1 2 216.231 2.152 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ncco2)CCC1(F)F ZINC001141004338 960801129 /nfs/dbraw/zinc/80/11/29/960801129.db2.gz CCMAVFKUTDBSRH-MRVPVSSYSA-N 1 2 216.231 2.152 20 0 BEADLO C[C@]1(F)CCCC[N@H+](Cc2ncco2)C1 ZINC001141005099 960806239 /nfs/dbraw/zinc/80/62/39/960806239.db2.gz UAPGLVZUQQMFON-NSHDSACASA-N 1 2 212.268 2.389 20 0 BEADLO C[C@]1(F)CCCC[N@@H+](Cc2ncco2)C1 ZINC001141005099 960806241 /nfs/dbraw/zinc/80/62/41/960806241.db2.gz UAPGLVZUQQMFON-NSHDSACASA-N 1 2 212.268 2.389 20 0 BEADLO c1coc(C[NH+]2CC3(C2)CCCCC3)n1 ZINC001141011068 960814217 /nfs/dbraw/zinc/81/42/17/960814217.db2.gz NOCZUCYVCFVLGW-UHFFFAOYSA-N 1 2 206.289 2.441 20 0 BEADLO Cc1ncoc1C[N@@H+]1CCc2ncc(C)cc2C1 ZINC001141055167 960854458 /nfs/dbraw/zinc/85/44/58/960854458.db2.gz QUEFCRAGXAXQQB-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1ncoc1C[N@H+]1CCc2ncc(C)cc2C1 ZINC001141055167 960854464 /nfs/dbraw/zinc/85/44/64/960854464.db2.gz QUEFCRAGXAXQQB-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO CCCCc1[nH]c(CN2CCOCC23CC3)c[nH+]1 ZINC001141071286 960859836 /nfs/dbraw/zinc/85/98/36/960859836.db2.gz IOZYBWZSOBRINB-UHFFFAOYSA-N 1 2 249.358 2.117 20 0 BEADLO CCCCc1[nH]cc(CN2CCOCC23CC3)[nH+]1 ZINC001141071286 960859848 /nfs/dbraw/zinc/85/98/48/960859848.db2.gz IOZYBWZSOBRINB-UHFFFAOYSA-N 1 2 249.358 2.117 20 0 BEADLO CCCCc1[nH]cc(CN2CCCCO2)[nH+]1 ZINC001141067571 960863458 /nfs/dbraw/zinc/86/34/58/960863458.db2.gz HULZKLPSCIOAIA-UHFFFAOYSA-N 1 2 223.320 2.280 20 0 BEADLO CCCCc1[nH]c(CN2CCCCO2)c[nH+]1 ZINC001141067571 960863467 /nfs/dbraw/zinc/86/34/67/960863467.db2.gz HULZKLPSCIOAIA-UHFFFAOYSA-N 1 2 223.320 2.280 20 0 BEADLO CCCCc1ncc(C[N@@H+]2CC[C@H](C(C)=O)C2)[nH]1 ZINC001141071109 960864347 /nfs/dbraw/zinc/86/43/47/960864347.db2.gz BTDMYBIHFWDUGG-LBPRGKRZSA-N 1 2 249.358 2.163 20 0 BEADLO CCCCc1ncc(C[N@H+]2CC[C@H](C(C)=O)C2)[nH]1 ZINC001141071109 960864348 /nfs/dbraw/zinc/86/43/48/960864348.db2.gz BTDMYBIHFWDUGG-LBPRGKRZSA-N 1 2 249.358 2.163 20 0 BEADLO CCCCc1nc(C[N@@H+]2CC[C@H](C(C)=O)C2)c[nH]1 ZINC001141071109 960864352 /nfs/dbraw/zinc/86/43/52/960864352.db2.gz BTDMYBIHFWDUGG-LBPRGKRZSA-N 1 2 249.358 2.163 20 0 BEADLO CCCCc1nc(C[N@H+]2CC[C@H](C(C)=O)C2)c[nH]1 ZINC001141071109 960864357 /nfs/dbraw/zinc/86/43/57/960864357.db2.gz BTDMYBIHFWDUGG-LBPRGKRZSA-N 1 2 249.358 2.163 20 0 BEADLO FC(F)[C@@H]1CCC[N@H+](Cc2cocn2)C1 ZINC001141129952 960874579 /nfs/dbraw/zinc/87/45/79/960874579.db2.gz YCWVLLFLNIXQIN-MRVPVSSYSA-N 1 2 216.231 2.152 20 0 BEADLO FC(F)[C@@H]1CCC[N@@H+](Cc2cocn2)C1 ZINC001141129952 960874583 /nfs/dbraw/zinc/87/45/83/960874583.db2.gz YCWVLLFLNIXQIN-MRVPVSSYSA-N 1 2 216.231 2.152 20 0 BEADLO Cn1c[nH+]c2ccc(NC3(CO)CCCC3)cc21 ZINC001167805484 961074597 /nfs/dbraw/zinc/07/45/97/961074597.db2.gz ZQLXJJZGLUYBII-UHFFFAOYSA-N 1 2 245.326 2.290 20 0 BEADLO Cc1cc(CO[C@H]2C(=O)OCC2(C)C)cc(C)[nH+]1 ZINC001223418906 961299081 /nfs/dbraw/zinc/29/90/81/961299081.db2.gz CQSRUNCLXWLUOM-LBPRGKRZSA-N 1 2 249.310 2.167 20 0 BEADLO COc1cccc2nc(NC=[NH2+])ccc21 ZINC001167863771 961324158 /nfs/dbraw/zinc/32/41/58/961324158.db2.gz FLESUBKUTOUNDC-UHFFFAOYSA-N 1 2 201.229 2.262 20 0 BEADLO COC(=O)c1cc(NC=[NH2+])nc2ccccc21 ZINC001167863544 961325385 /nfs/dbraw/zinc/32/53/85/961325385.db2.gz DAUJMXQCFQXSCY-UHFFFAOYSA-N 1 2 229.239 2.040 20 0 BEADLO Cc1nc(Cl)nc(Cl)c1NC=[NH2+] ZINC001167868038 961352471 /nfs/dbraw/zinc/35/24/71/961352471.db2.gz DTMQLNLDNXIUIU-UHFFFAOYSA-N 1 2 205.048 2.111 20 0 BEADLO CC(C)(C)c1nc[nH]c1C[N@@H+]1CC[C@H](F)C1 ZINC001142213252 961352695 /nfs/dbraw/zinc/35/26/95/961352695.db2.gz RZWXOANTRGMQAQ-VIFPVBQESA-N 1 2 225.311 2.251 20 0 BEADLO CC(C)(C)c1nc[nH]c1C[N@H+]1CC[C@H](F)C1 ZINC001142213252 961352710 /nfs/dbraw/zinc/35/27/10/961352710.db2.gz RZWXOANTRGMQAQ-VIFPVBQESA-N 1 2 225.311 2.251 20 0 BEADLO CSc1ncc(C[NH+]2CCCC2)c(Cl)n1 ZINC001142408623 961428334 /nfs/dbraw/zinc/42/83/34/961428334.db2.gz SWQWUCSLOMZHEQ-UHFFFAOYSA-N 1 2 243.763 2.448 20 0 BEADLO CCC=C(C)C(=O)Nc1cc[nH+]c2c1CCC2 ZINC001142665660 961574631 /nfs/dbraw/zinc/57/46/31/961574631.db2.gz TYSHVIZGLGXGKF-BJMVGYQFSA-N 1 2 230.311 2.287 20 0 BEADLO CN(Cc1cccn2cc[nH+]c12)CC(F)(F)F ZINC001142944472 961846584 /nfs/dbraw/zinc/84/65/84/961846584.db2.gz LYMNHFHYPCGBPJ-UHFFFAOYSA-N 1 2 243.232 2.328 20 0 BEADLO C[NH+](C)Cc1occc1Br ZINC001143116462 961882033 /nfs/dbraw/zinc/88/20/33/961882033.db2.gz CFBLCEZGMZYOBH-UHFFFAOYSA-N 1 2 204.067 2.104 20 0 BEADLO Cc1ccc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)c(N)n1 ZINC001143194579 961927809 /nfs/dbraw/zinc/92/78/09/961927809.db2.gz BKFYCNHIQKZWLJ-BXKDBHETSA-N 1 2 237.322 2.152 20 0 BEADLO Cc1ccc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)c(N)n1 ZINC001143194579 961927846 /nfs/dbraw/zinc/92/78/46/961927846.db2.gz BKFYCNHIQKZWLJ-BXKDBHETSA-N 1 2 237.322 2.152 20 0 BEADLO C[C@@H](C(=O)N1CC[C@@H]2CCCC[C@@H]21)n1cc[nH+]c1 ZINC001143209868 961954117 /nfs/dbraw/zinc/95/41/17/961954117.db2.gz WGNMXAANKAKGSC-AVGNSLFASA-N 1 2 247.342 2.235 20 0 BEADLO Cc1cc(Nc2ccn3cc[nH+]c3c2)nn1C ZINC001204951148 962158765 /nfs/dbraw/zinc/15/87/65/962158765.db2.gz OAXQPYUJHNVBBI-UHFFFAOYSA-N 1 2 227.271 2.120 20 0 BEADLO CCC/C=C/C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000729372093 962187520 /nfs/dbraw/zinc/18/75/20/962187520.db2.gz NODOZTQVKLRJBR-LVDDQXARSA-N 1 2 247.342 2.403 20 0 BEADLO Nc1ccc(N2CCC[C@@H]2c2nccs2)[nH+]c1 ZINC000710788768 962472889 /nfs/dbraw/zinc/47/28/89/962472889.db2.gz WWOUDCRJNSTCSC-SNVBAGLBSA-N 1 2 246.339 2.462 20 0 BEADLO CCSc1cc[nH+]c(NCC2COC2)c1 ZINC001154637938 962803255 /nfs/dbraw/zinc/80/32/55/962803255.db2.gz KGTHHYOPNBABCO-UHFFFAOYSA-N 1 2 224.329 2.252 20 0 BEADLO C[C@@H](C(=O)N1CCCCC[C@@H]1C)n1cc[nH+]c1 ZINC001154674975 962832515 /nfs/dbraw/zinc/83/25/15/962832515.db2.gz KYRBIERCVXLMRI-RYUDHWBXSA-N 1 2 235.331 2.235 20 0 BEADLO CC(C)[C@H]1COCC[N@@H+]1Cc1ccc(F)nc1 ZINC001137741518 962838516 /nfs/dbraw/zinc/83/85/16/962838516.db2.gz FXEHRWAWPDFRDH-GFCCVEGCSA-N 1 2 238.306 2.078 20 0 BEADLO CC(C)[C@H]1COCC[N@H+]1Cc1ccc(F)nc1 ZINC001137741518 962838519 /nfs/dbraw/zinc/83/85/19/962838519.db2.gz FXEHRWAWPDFRDH-GFCCVEGCSA-N 1 2 238.306 2.078 20 0 BEADLO CC(F)(F)CNc1ccc(Cl)c(N)[nH+]1 ZINC001154860358 962877325 /nfs/dbraw/zinc/87/73/25/962877325.db2.gz TXYVAOGJBVMWPT-UHFFFAOYSA-N 1 2 221.638 2.384 20 0 BEADLO CCOc1ccc[nH+]c1NCc1cnoc1C ZINC001154887028 962883251 /nfs/dbraw/zinc/88/32/51/962883251.db2.gz AFTVDULQBNXSFF-UHFFFAOYSA-N 1 2 233.271 2.389 20 0 BEADLO Cc1nc(N[C@@H](CO)CC(C)C)c2c([nH+]1)CCC2 ZINC001154959906 962923073 /nfs/dbraw/zinc/92/30/73/962923073.db2.gz AWWAPFPIDZVJKA-LLVKDONJSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1ccc(CN2CCC(F)(F)[C@@H]([NH3+])C2)s1 ZINC001206655268 963079233 /nfs/dbraw/zinc/07/92/33/963079233.db2.gz GIVCYWDDOIJNSY-JTQLQIEISA-N 1 2 246.326 2.225 20 0 BEADLO Cc1cc(F)cc(C[N@@H+]2CC[C@@H](O)[C@@H](F)C2)c1 ZINC001143580288 963149492 /nfs/dbraw/zinc/14/94/92/963149492.db2.gz CQRVVCOMALUAIF-QWHCGFSZSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cc(F)cc(C[N@H+]2CC[C@@H](O)[C@@H](F)C2)c1 ZINC001143580288 963149497 /nfs/dbraw/zinc/14/94/97/963149497.db2.gz CQRVVCOMALUAIF-QWHCGFSZSA-N 1 2 241.281 2.039 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1cc(C)cc(F)c1 ZINC001143580560 963167735 /nfs/dbraw/zinc/16/77/35/963167735.db2.gz NZKANRKACOYLLW-UHFFFAOYSA-N 1 2 209.264 2.155 20 0 BEADLO CC(=O)C[N@H+](C)Cc1cc(C)cc(F)c1 ZINC001143580560 963167746 /nfs/dbraw/zinc/16/77/46/963167746.db2.gz NZKANRKACOYLLW-UHFFFAOYSA-N 1 2 209.264 2.155 20 0 BEADLO Cc1cc(N2CCOCC23CC3)nc(C(C)C)[nH+]1 ZINC001155840704 963182563 /nfs/dbraw/zinc/18/25/63/963182563.db2.gz ZTXYSDJRIYWDKW-UHFFFAOYSA-N 1 2 247.342 2.278 20 0 BEADLO CC[C@H](C)Nc1[nH+]c(C)nc2c1ccn2C ZINC001167998125 963198326 /nfs/dbraw/zinc/19/83/26/963198326.db2.gz GHTRHUCAGQQCQI-QMMMGPOBSA-N 1 2 218.304 2.487 20 0 BEADLO CC[C@@H](C)Nc1nc(NC2CC2)c(OC)c[nH+]1 ZINC001167999966 963216035 /nfs/dbraw/zinc/21/60/35/963216035.db2.gz NUTBRZRJCHTMGT-MRVPVSSYSA-N 1 2 236.319 2.270 20 0 BEADLO c1cn(CCCNc2cncnc2C2CC2)c[nH+]1 ZINC001161688463 963226775 /nfs/dbraw/zinc/22/67/75/963226775.db2.gz SOQPDKDYJUCVIX-UHFFFAOYSA-N 1 2 243.314 2.053 20 0 BEADLO COc1c[nH+]c(NCCn2cccc2)c(C)c1 ZINC001156299829 963305871 /nfs/dbraw/zinc/30/58/71/963305871.db2.gz SMGKBWGPOQECLY-UHFFFAOYSA-N 1 2 231.299 2.312 20 0 BEADLO COc1cc(C)c[nH+]c1NC[C@@H]1CCCCO1 ZINC001156377139 963325081 /nfs/dbraw/zinc/32/50/81/963325081.db2.gz AOPICIDLXVFEJI-NSHDSACASA-N 1 2 236.315 2.380 20 0 BEADLO CCSc1cc[nH+]c(NC2CC(=O)C2)c1 ZINC001156617998 963413027 /nfs/dbraw/zinc/41/30/27/963413027.db2.gz IZVOHYCFECCSPK-UHFFFAOYSA-N 1 2 222.313 2.337 20 0 BEADLO Cc1cccc2c1C[N@H+](Cc1cncn1C)C2 ZINC001204383939 963449925 /nfs/dbraw/zinc/44/99/25/963449925.db2.gz OJBBDDMTNLWYLA-UHFFFAOYSA-N 1 2 227.311 2.244 20 0 BEADLO Cc1cccc2c1C[N@@H+](Cc1cncn1C)C2 ZINC001204383939 963449929 /nfs/dbraw/zinc/44/99/29/963449929.db2.gz OJBBDDMTNLWYLA-UHFFFAOYSA-N 1 2 227.311 2.244 20 0 BEADLO Nc1cc(CNc2cc(Cl)ccn2)cc[nH+]1 ZINC001156755535 963453921 /nfs/dbraw/zinc/45/39/21/963453921.db2.gz FYXJPVWFZOAHAD-UHFFFAOYSA-N 1 2 234.690 2.324 20 0 BEADLO C=Cc1ccc(NCc2cc[nH+]c(N)c2)nc1 ZINC001156760184 963454196 /nfs/dbraw/zinc/45/41/96/963454196.db2.gz FQTDPPGHKFIGET-UHFFFAOYSA-N 1 2 226.283 2.314 20 0 BEADLO Nc1cc(CNc2cccc(Cl)n2)cc[nH+]1 ZINC001156756145 963454936 /nfs/dbraw/zinc/45/49/36/963454936.db2.gz PHJKKOLILKTRCD-UHFFFAOYSA-N 1 2 234.690 2.324 20 0 BEADLO Cc1nc(Cl)cnc1NCc1cc[nH+]c(N)c1 ZINC001156757113 963455000 /nfs/dbraw/zinc/45/50/00/963455000.db2.gz MKZWHRBBJXCCNT-UHFFFAOYSA-N 1 2 249.705 2.028 20 0 BEADLO COC(=O)CCN(C)c1ccc(C(C)C)c[nH+]1 ZINC001156809494 963466844 /nfs/dbraw/zinc/46/68/44/963466844.db2.gz UPIAHIAWSMQEFF-UHFFFAOYSA-N 1 2 236.315 2.204 20 0 BEADLO CCCN(C)c1nc(NC(C)C)c(OC)c[nH+]1 ZINC001156872307 963475068 /nfs/dbraw/zinc/47/50/68/963475068.db2.gz SHZCVXVWUNINGG-UHFFFAOYSA-N 1 2 238.335 2.152 20 0 BEADLO Cc1cc(CNc2[nH+]ccc(F)c2C)nn1C ZINC001156948220 963498359 /nfs/dbraw/zinc/49/83/59/963498359.db2.gz VVSQCBYASBMVOA-UHFFFAOYSA-N 1 2 234.278 2.183 20 0 BEADLO CCN(CCn1cc[nH+]c1)c1ncc(C)cc1F ZINC001157459653 963619559 /nfs/dbraw/zinc/61/95/59/963619559.db2.gz FTPYHXMBARYVJI-UHFFFAOYSA-N 1 2 248.305 2.252 20 0 BEADLO C[NH+]1CC(Oc2cc(F)cc3cccnc32)C1 ZINC001227977048 963641680 /nfs/dbraw/zinc/64/16/80/963641680.db2.gz SUSLAJJPLAHHTE-UHFFFAOYSA-N 1 2 232.258 2.067 20 0 BEADLO CCOc1ccc[nH+]c1NCc1cnc(C)nc1 ZINC001157605853 963674751 /nfs/dbraw/zinc/67/47/51/963674751.db2.gz MHMZAQBVLKJJNM-UHFFFAOYSA-N 1 2 244.298 2.191 20 0 BEADLO Cc1cc[nH+]c(N[C@@H](C)C(C)(C)C)c1C(N)=O ZINC001157876238 963752303 /nfs/dbraw/zinc/75/23/03/963752303.db2.gz RLUBDCKKSPYQBZ-VIFPVBQESA-N 1 2 235.331 2.335 20 0 BEADLO FC1(CNc2ccn3cc[nH+]c3c2)CCOCC1 ZINC001168124374 963794097 /nfs/dbraw/zinc/79/40/97/963794097.db2.gz PXEVYUFCMVJWDG-UHFFFAOYSA-N 1 2 249.289 2.265 20 0 BEADLO Cc1cc(NCC2OCCO2)[nH+]c2ccccc12 ZINC001158198595 963828571 /nfs/dbraw/zinc/82/85/71/963828571.db2.gz QELBAFVBKBVXTC-UHFFFAOYSA-N 1 2 244.294 2.328 20 0 BEADLO COc1c[nH+]c(N[C@H]2CCC[C@@H](O)C2)c(C)c1 ZINC001158364863 963855414 /nfs/dbraw/zinc/85/54/14/963855414.db2.gz WFPUGXANIBLGBD-WDEREUQCSA-N 1 2 236.315 2.114 20 0 BEADLO C[C@H](Nc1ccc(Cl)c(N)[nH+]1)c1cnccn1 ZINC001158611954 963892618 /nfs/dbraw/zinc/89/26/18/963892618.db2.gz YXXQRJJHLALQFX-ZETCQYMHSA-N 1 2 249.705 2.280 20 0 BEADLO CCOC(=O)C1([NH2+]C2CCC(C)CC2)CC1 ZINC001168200523 963966853 /nfs/dbraw/zinc/96/68/53/963966853.db2.gz HGLPCEVDZOHXMR-UHFFFAOYSA-N 1 2 225.332 2.250 20 0 BEADLO CCN(CC)c1cc(N2C3CCC2CC3)nc[nH+]1 ZINC001159082549 963992589 /nfs/dbraw/zinc/99/25/89/963992589.db2.gz LOODUWAPENCJDX-UHFFFAOYSA-N 1 2 246.358 2.454 20 0 BEADLO CCN(CC)c1cc(N2C3CCC2CC3)[nH+]cn1 ZINC001159082549 963992592 /nfs/dbraw/zinc/99/25/92/963992592.db2.gz LOODUWAPENCJDX-UHFFFAOYSA-N 1 2 246.358 2.454 20 0 BEADLO Cc1c[nH+]c(N2C3CCC2CC3)nc1NC1CC1 ZINC001159079742 963993519 /nfs/dbraw/zinc/99/35/19/963993519.db2.gz MDASJKIHHPRWND-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO Fc1ccccc1-c1noc(C[NH+]2CCC2)n1 ZINC001212093165 964251515 /nfs/dbraw/zinc/25/15/15/964251515.db2.gz JNBCCMGTMVTBNB-UHFFFAOYSA-N 1 2 233.246 2.081 20 0 BEADLO Cc1c(F)cccc1-c1noc(C[NH+]2CCC2)n1 ZINC001212093308 964251916 /nfs/dbraw/zinc/25/19/16/964251916.db2.gz QIEBHYAPBSCCQN-UHFFFAOYSA-N 1 2 247.273 2.390 20 0 BEADLO CCC1(Nc2[nH+]cc(OC)c3cc[nH]c32)COC1 ZINC001168321416 964441342 /nfs/dbraw/zinc/44/13/42/964441342.db2.gz KAUZYOUKYAMPHS-UHFFFAOYSA-N 1 2 247.298 2.162 20 0 BEADLO CC[C@H](COC)Nc1cc(C)[nH+]c(SC)n1 ZINC001160931647 964443682 /nfs/dbraw/zinc/44/36/82/964443682.db2.gz DWLCEBAFLXJEIQ-SECBINFHSA-N 1 2 241.360 2.344 20 0 BEADLO CCC1(Nc2ccc(N3CCCC3)[nH+]c2)COC1 ZINC001168323502 964446456 /nfs/dbraw/zinc/44/64/56/964446456.db2.gz GYNGYLBMRFEOJP-UHFFFAOYSA-N 1 2 247.342 2.273 20 0 BEADLO Cc1noc(C2(Nc3[nH+]ccc(F)c3C)CC2)n1 ZINC001161307738 964566370 /nfs/dbraw/zinc/56/63/70/964566370.db2.gz PIAVPDCFXVNECM-UHFFFAOYSA-N 1 2 248.261 2.322 20 0 BEADLO Cc1cc(-c2ccc[nH+]c2N)c(F)cn1 ZINC000200110439 964576839 /nfs/dbraw/zinc/57/68/39/964576839.db2.gz NIGPALCCCZIYLY-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO S=c1ccc(NCCCn2cc[nH+]c2)c[nH]1 ZINC001161684956 964684661 /nfs/dbraw/zinc/68/46/61/964684661.db2.gz ZBPDSDNCGMZKJR-UHFFFAOYSA-N 1 2 234.328 2.069 20 0 BEADLO COc1c[nH+]c(N[C@@H]2CCO[C@@H](C)C2)c(C)c1 ZINC001161690620 964687408 /nfs/dbraw/zinc/68/74/08/964687408.db2.gz JEUIMAAPDBQDAQ-WDEREUQCSA-N 1 2 236.315 2.378 20 0 BEADLO COc1cc(C)c[nH+]c1N[C@@H]1CCO[C@H](C)C1 ZINC001161690749 964687526 /nfs/dbraw/zinc/68/75/26/964687526.db2.gz BDXFGAPBFLCMMR-GHMZBOCLSA-N 1 2 236.315 2.378 20 0 BEADLO c1cn(CCCNc2cnc3c(c2)CN=N3)c[nH+]1 ZINC001161688958 964688456 /nfs/dbraw/zinc/68/84/56/964688456.db2.gz DTAWECJNEBKEAP-UHFFFAOYSA-N 1 2 242.286 2.378 20 0 BEADLO Cc1cc(NCCc2cnoc2)nc(C2CC2)[nH+]1 ZINC001161701977 964696759 /nfs/dbraw/zinc/69/67/59/964696759.db2.gz IIRBRPGSPSPMAQ-UHFFFAOYSA-N 1 2 244.298 2.305 20 0 BEADLO Cc1cc[nH+]c(N[C@H]2CC=CCC2)c1C(N)=O ZINC001161752890 964737859 /nfs/dbraw/zinc/73/78/59/964737859.db2.gz VWKWWQQQKHZFIU-JTQLQIEISA-N 1 2 231.299 2.010 20 0 BEADLO c1ccn(-c2ccc(NC3CCOCC3)[nH+]c2)c1 ZINC001161861427 964797228 /nfs/dbraw/zinc/79/72/28/964797228.db2.gz BDYHVDCPBCRMKS-UHFFFAOYSA-N 1 2 243.310 2.463 20 0 BEADLO COc1cc(C)c[nH+]c1NCc1nccnc1C ZINC001162002562 964845649 /nfs/dbraw/zinc/84/56/49/964845649.db2.gz RSVMREITDAGUTJ-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO CCOc1ccc[nH+]c1N[C@@H]1CCOC[C@@H]1F ZINC001162347422 964939848 /nfs/dbraw/zinc/93/98/48/964939848.db2.gz AELDMPBTPYIQDP-VHSXEESVSA-N 1 2 240.278 2.019 20 0 BEADLO C[C@@]1(O)CC[C@@H](Nc2cccc[nH+]2)CC1 ZINC001162354198 964941464 /nfs/dbraw/zinc/94/14/64/964941464.db2.gz KCIJGGNLSANTFR-UMSPYCQHSA-N 1 2 206.289 2.187 20 0 BEADLO CC(C)(C)C(=[NH2+])Nc1nccc2c1NC(=O)C2 ZINC001162657975 965093821 /nfs/dbraw/zinc/09/38/21/965093821.db2.gz YKAOLXWFBCXQHR-UHFFFAOYSA-N 1 2 232.287 2.011 20 0 BEADLO COc1cc[nH+]cc1NCc1ccncc1C ZINC001162719776 965143217 /nfs/dbraw/zinc/14/32/17/965143217.db2.gz GGLICDJRZRLTOB-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO Cc1[nH]c(CN2CCCC(F)(F)[C@H](F)C2)c[nH+]1 ZINC001232461183 965356863 /nfs/dbraw/zinc/35/68/63/965356863.db2.gz YICQBIVUSLSTKI-SNVBAGLBSA-N 1 2 247.264 2.287 20 0 BEADLO Cc1[nH]cc(CN2CCCC(F)(F)[C@H](F)C2)[nH+]1 ZINC001232461183 965356879 /nfs/dbraw/zinc/35/68/79/965356879.db2.gz YICQBIVUSLSTKI-SNVBAGLBSA-N 1 2 247.264 2.287 20 0 BEADLO CCOC(=O)c1c(C)cc(N2CCC2)[nH+]c1C ZINC001163537932 965431654 /nfs/dbraw/zinc/43/16/54/965431654.db2.gz VVLDBSYUTOHFLP-UHFFFAOYSA-N 1 2 234.299 2.085 20 0 BEADLO Cc1cc(N2CCC2)nc(C(C)(C)C)[nH+]1 ZINC001163538028 965433972 /nfs/dbraw/zinc/43/39/72/965433972.db2.gz DAMAASWXFRZYID-UHFFFAOYSA-N 1 2 205.305 2.293 20 0 BEADLO CCOC(=O)c1cc2cc[nH+]c(N(C)CC)c2[nH]1 ZINC001163583797 965464876 /nfs/dbraw/zinc/46/48/76/965464876.db2.gz QGQRYNZOPJMAMD-UHFFFAOYSA-N 1 2 247.298 2.196 20 0 BEADLO CCCN(CCOC)c1[nH+]c(C)ccc1OC ZINC001163647302 965494938 /nfs/dbraw/zinc/49/49/38/965494938.db2.gz NVORHGJDCDWYQR-UHFFFAOYSA-N 1 2 238.331 2.261 20 0 BEADLO C[NH+]1CC(Oc2ccnc(-c3ccccc3)c2)C1 ZINC001233621762 965538197 /nfs/dbraw/zinc/53/81/97/965538197.db2.gz SFKJPSSKEGYQOW-UHFFFAOYSA-N 1 2 240.306 2.441 20 0 BEADLO COCC1CN(c2ccc(C(C)(C)C)c[nH+]2)C1 ZINC001163734708 965551319 /nfs/dbraw/zinc/55/13/19/965551319.db2.gz QEYWVWGFONXJFA-UHFFFAOYSA-N 1 2 234.343 2.462 20 0 BEADLO CCOC(=O)c1c(C)cc(N2CC=CC2)[nH+]c1C ZINC001163917250 965628787 /nfs/dbraw/zinc/62/87/87/965628787.db2.gz PVXHRXQXOQMRDN-UHFFFAOYSA-N 1 2 246.310 2.251 20 0 BEADLO CSc1cc[nH+]c(N(C)Cc2ncccn2)c1 ZINC001163926779 965636482 /nfs/dbraw/zinc/63/64/82/965636482.db2.gz IRUJBFJGVJXEQM-UHFFFAOYSA-N 1 2 246.339 2.230 20 0 BEADLO c1cc(C2CC2)[nH+]c(N2Cc3cncnc3C2)c1 ZINC001163986674 965685154 /nfs/dbraw/zinc/68/51/54/965685154.db2.gz WCEJGCKCEMHXSN-UHFFFAOYSA-N 1 2 238.294 2.269 20 0 BEADLO CC(C)(C)C(=O)CNc1ccn2cc[nH+]c2c1 ZINC001164002259 965686199 /nfs/dbraw/zinc/68/61/99/965686199.db2.gz BMHRVCUBLFNWLO-UHFFFAOYSA-N 1 2 231.299 2.361 20 0 BEADLO Cc1nc(N2CC[C@@H](C)[C@H](F)C2)c2c([nH+]1)CCC2 ZINC001164177135 965780184 /nfs/dbraw/zinc/78/01/84/965780184.db2.gz BOMXIUVGIBOGHI-BXKDBHETSA-N 1 2 249.333 2.458 20 0 BEADLO CC(C(=O)NCCCn1cc[nH+]c1)=C1CCCC1 ZINC000176497428 965790739 /nfs/dbraw/zinc/79/07/39/965790739.db2.gz PHAFCIZDPGWUNN-UHFFFAOYSA-N 1 2 247.342 2.280 20 0 BEADLO CC(C)c1ccc(N2CC[C@@H](C)[C@H](O)C2)[nH+]c1 ZINC001164273586 965814701 /nfs/dbraw/zinc/81/47/01/965814701.db2.gz SOSDMWCKGFWSLQ-DGCLKSJQSA-N 1 2 234.343 2.412 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@@H](C)COc1ccccc1 ZINC000699426423 965868413 /nfs/dbraw/zinc/86/84/13/965868413.db2.gz NGGDZWPVPGASKG-NSHDSACASA-N 1 2 245.326 2.275 20 0 BEADLO CCCc1cc(N2CC(C)(F)C2)nc(C)[nH+]1 ZINC001164589000 965928662 /nfs/dbraw/zinc/92/86/62/965928662.db2.gz HSTNLAREWUBULM-UHFFFAOYSA-N 1 2 223.295 2.286 20 0 BEADLO Cc1cc(Cl)c(C)c(N2CC[C@@](C)(O)C2)[nH+]1 ZINC001165227973 965992846 /nfs/dbraw/zinc/99/28/46/965992846.db2.gz GJFAYDZFLAQDCC-GFCCVEGCSA-N 1 2 240.734 2.313 20 0 BEADLO CCc1ccc(C[N@@H+]2C[C@H]3CC[C@@H]2CO3)o1 ZINC001204396441 966013124 /nfs/dbraw/zinc/01/31/24/966013124.db2.gz BUQJQDXRXIZDPN-ZYHUDNBSSA-N 1 2 221.300 2.205 20 0 BEADLO CCc1ccc(C[N@H+]2C[C@H]3CC[C@@H]2CO3)o1 ZINC001204396441 966013138 /nfs/dbraw/zinc/01/31/38/966013138.db2.gz BUQJQDXRXIZDPN-ZYHUDNBSSA-N 1 2 221.300 2.205 20 0 BEADLO CC[N@H+](Cc1ncc(Cl)cn1)C1CC1 ZINC001235419023 966059504 /nfs/dbraw/zinc/05/95/04/966059504.db2.gz WDSZQNCBTGQLEE-UHFFFAOYSA-N 1 2 211.696 2.114 20 0 BEADLO CC[N@@H+](Cc1ncc(Cl)cn1)C1CC1 ZINC001235419023 966059519 /nfs/dbraw/zinc/05/95/19/966059519.db2.gz WDSZQNCBTGQLEE-UHFFFAOYSA-N 1 2 211.696 2.114 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1C[C@H]1C(C)(C)C ZINC000699750476 966060666 /nfs/dbraw/zinc/06/06/66/966060666.db2.gz BBFUEXHPFHMUBL-NXEZZACHSA-N 1 2 235.331 2.017 20 0 BEADLO C[C@@H]1COC[C@@H]1Nc1[nH+]c2ccccc2n1C ZINC000699752084 966067615 /nfs/dbraw/zinc/06/76/15/966067615.db2.gz CTFIPHHPVOUWNK-KOLCDFICSA-N 1 2 231.299 2.020 20 0 BEADLO C[C@H]1COC[C@@H]1[NH2+]CC(F)(F)c1ccccc1 ZINC000699759948 966068638 /nfs/dbraw/zinc/06/86/38/966068638.db2.gz OHTGXLLKEXRBRW-JQWIXIFHSA-N 1 2 241.281 2.403 20 0 BEADLO Cc1coc(C(=O)OCCCc2[nH+]ccn2C)c1 ZINC001263388660 1169885611 /nfs/dbraw/zinc/88/56/11/1169885611.db2.gz ZHDBZPRDZYCBNW-UHFFFAOYSA-N 1 2 248.282 2.111 20 0 BEADLO C[C@H](Cc1cccc(F)c1)[N@@H+]1CCO[C@H]2C[C@H]21 ZINC001168499843 966087608 /nfs/dbraw/zinc/08/76/08/966087608.db2.gz GKHGRUNHPNLFDS-HONMWMINSA-N 1 2 235.302 2.230 20 0 BEADLO C[C@H](Cc1cccc(F)c1)[N@H+]1CCO[C@H]2C[C@H]21 ZINC001168499843 966087626 /nfs/dbraw/zinc/08/76/26/966087626.db2.gz GKHGRUNHPNLFDS-HONMWMINSA-N 1 2 235.302 2.230 20 0 BEADLO COC(C)(C)CNc1[nH+]c(C)nc2c1ccn2C ZINC001165803421 966164717 /nfs/dbraw/zinc/16/47/17/966164717.db2.gz JKEHYXXHYZDXBF-UHFFFAOYSA-N 1 2 248.330 2.114 20 0 BEADLO CC(C)COc1cc(N[C@H](C)CCO)cc[nH+]1 ZINC001165965440 966212788 /nfs/dbraw/zinc/21/27/88/966212788.db2.gz BAMKSVNNYXETNH-LLVKDONJSA-N 1 2 238.331 2.299 20 0 BEADLO CNc1ccc(NC2(c3cccnn3)CC2)c[nH+]1 ZINC001168512959 966219066 /nfs/dbraw/zinc/21/90/66/966219066.db2.gz FXJBCTIQRJAMKK-UHFFFAOYSA-N 1 2 241.298 2.015 20 0 BEADLO Cc1c(F)cc[nH+]c1N1CCCCC12COC2 ZINC001166692513 966368748 /nfs/dbraw/zinc/36/87/48/966368748.db2.gz UFWFULXNKDIMCH-UHFFFAOYSA-N 1 2 236.290 2.288 20 0 BEADLO Cc1nc(N(C)CC2(C)COC2)cc(C(C)C)[nH+]1 ZINC001166709054 966372940 /nfs/dbraw/zinc/37/29/40/966372940.db2.gz GLVVPSPOZJKXNZ-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO Cc1cccc(CCN(C)c2cc(N)nc[nH+]2)c1 ZINC001166824540 966427955 /nfs/dbraw/zinc/42/79/55/966427955.db2.gz IIHFVHWFYHLRNP-UHFFFAOYSA-N 1 2 242.326 2.046 20 0 BEADLO CCSc1cc[nH+]c(N(C)CC2COC2)c1 ZINC001166948725 966474345 /nfs/dbraw/zinc/47/43/45/966474345.db2.gz IJLJQKUKIPZIIU-UHFFFAOYSA-N 1 2 238.356 2.276 20 0 BEADLO CCCc1cc(N2CC[C@@H](O)C[C@H]2C)nc(C)[nH+]1 ZINC001166964581 966491435 /nfs/dbraw/zinc/49/14/35/966491435.db2.gz XJFBNYRCSPLPRF-ZWNOBZJWSA-N 1 2 249.358 2.087 20 0 BEADLO Cc1c(F)cc[nH+]c1N1C[C@H](C)O[C@@H](C)C1 ZINC001166966194 966491879 /nfs/dbraw/zinc/49/18/79/966491879.db2.gz FGDGYOKPHXDOCH-IUCAKERBSA-N 1 2 224.279 2.143 20 0 BEADLO CN(c1[nH+]ccc2ccccc21)C1(C)COC1 ZINC001166984393 966505397 /nfs/dbraw/zinc/50/53/97/966505397.db2.gz DAECUOUWDXGMDV-UHFFFAOYSA-N 1 2 228.295 2.460 20 0 BEADLO Cn1cccc1C[N@@H+]1CCC[C@@H]1c1ncccn1 ZINC001203270576 966592983 /nfs/dbraw/zinc/59/29/83/966592983.db2.gz JVHSABJTLLEEJM-CYBMUJFWSA-N 1 2 242.326 2.152 20 0 BEADLO Cn1cccc1C[N@H+]1CCC[C@@H]1c1ncccn1 ZINC001203270576 966592993 /nfs/dbraw/zinc/59/29/93/966592993.db2.gz JVHSABJTLLEEJM-CYBMUJFWSA-N 1 2 242.326 2.152 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC(=O)C(C)(C)C2)o1 ZINC001203297515 966603099 /nfs/dbraw/zinc/60/30/99/966603099.db2.gz HIMZWRDNXJPPMR-UHFFFAOYSA-N 1 2 221.300 2.389 20 0 BEADLO Cc1ccc(Nc2ccn3cnnc3c2)c(C)[nH+]1 ZINC001203369824 966618561 /nfs/dbraw/zinc/61/85/61/966618561.db2.gz CLCJXIWUPYMCSH-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cc1ccc(Nc2cncc(CO)c2)c(C)[nH+]1 ZINC001203369823 966618915 /nfs/dbraw/zinc/61/89/15/966618915.db2.gz STOQNMVZFWYLLS-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO Cc1ccc(Nc2ncccc2CCO)c(C)[nH+]1 ZINC001203373163 966619094 /nfs/dbraw/zinc/61/90/94/966619094.db2.gz IKRJZIPNNVFOFK-UHFFFAOYSA-N 1 2 243.310 2.372 20 0 BEADLO CNc1ccc(Nc2cc(C)on2)c[nH+]1 ZINC001203446511 966646421 /nfs/dbraw/zinc/64/64/21/966646421.db2.gz BMUPNUODGDDLIQ-UHFFFAOYSA-N 1 2 204.233 2.163 20 0 BEADLO CNc1ccc(Nc2ncc(F)s2)c[nH+]1 ZINC001203447266 966648365 /nfs/dbraw/zinc/64/83/65/966648365.db2.gz KUOBALIHKZFSNF-UHFFFAOYSA-N 1 2 224.264 2.463 20 0 BEADLO CCOc1cnc(Nc2ccc(NC)[nH+]c2)cn1 ZINC001203450085 966652111 /nfs/dbraw/zinc/65/21/11/966652111.db2.gz SBVBTCBVDTXCSF-UHFFFAOYSA-N 1 2 245.286 2.056 20 0 BEADLO CCOc1cc[nH+]cc1Nc1ccc(N)nc1F ZINC001203611265 966707332 /nfs/dbraw/zinc/70/73/32/966707332.db2.gz MRAGOUCBVRLAAK-UHFFFAOYSA-N 1 2 248.261 2.340 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2cnc3ccnn3c2)c1 ZINC001203655826 966717637 /nfs/dbraw/zinc/71/76/37/966717637.db2.gz CKAHNZLQCFQKPF-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO COc1nccnc1Nc1cc(C)c[nH+]c1C ZINC001203656264 966722315 /nfs/dbraw/zinc/72/23/15/966722315.db2.gz OQYHISAPYCCIOI-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2c(N)ncnc2Cl)c1 ZINC001203654633 966722851 /nfs/dbraw/zinc/72/28/51/966722851.db2.gz NXXCYNVUMSBOGW-UHFFFAOYSA-N 1 2 249.705 2.468 20 0 BEADLO CNc1ccc(Nc2ccccc2CO)c[nH+]1 ZINC001203455538 966734571 /nfs/dbraw/zinc/73/45/71/966734571.db2.gz USEXKFUPTIXJPH-UHFFFAOYSA-N 1 2 229.283 2.359 20 0 BEADLO CC(=O)OC1C[NH+](Cc2cc(C)ccc2C)C1 ZINC001203749942 966763152 /nfs/dbraw/zinc/76/31/52/966763152.db2.gz WXRGBPNCRTUDCM-UHFFFAOYSA-N 1 2 233.311 2.051 20 0 BEADLO CC(=Cc1ccco1)C(=O)Nc1cc[nH+]c(C)c1 ZINC001127730145 966773386 /nfs/dbraw/zinc/77/33/86/966773386.db2.gz LHBAZFBGLTZENN-CSKARUKUSA-N 1 2 242.278 2.447 20 0 BEADLO COc1cc(C)c(C[N@@H+]2CCO[C@H]3C[C@H]32)cc1C ZINC001203759091 966776146 /nfs/dbraw/zinc/77/61/46/966776146.db2.gz VVXBETREIIVCTJ-HIFRSBDPSA-N 1 2 247.338 2.285 20 0 BEADLO COc1cc(C)c(C[N@H+]2CCO[C@H]3C[C@H]32)cc1C ZINC001203759091 966776161 /nfs/dbraw/zinc/77/61/61/966776161.db2.gz VVXBETREIIVCTJ-HIFRSBDPSA-N 1 2 247.338 2.285 20 0 BEADLO O=C1CCC[N@H+](Cc2cccc(F)c2)CC1 ZINC001203785180 966780858 /nfs/dbraw/zinc/78/08/58/966780858.db2.gz KARYPPBHAYGJER-UHFFFAOYSA-N 1 2 221.275 2.381 20 0 BEADLO O=C1CCC[N@@H+](Cc2cccc(F)c2)CC1 ZINC001203785180 966780853 /nfs/dbraw/zinc/78/08/53/966780853.db2.gz KARYPPBHAYGJER-UHFFFAOYSA-N 1 2 221.275 2.381 20 0 BEADLO CCCOC1C[NH+](Cc2cccc(OC)c2)C1 ZINC001203822324 966787367 /nfs/dbraw/zinc/78/73/67/966787367.db2.gz MFHAHXPEGQLRJQ-UHFFFAOYSA-N 1 2 235.327 2.306 20 0 BEADLO Cc1cccc(C[N@@H+]2CCn3nccc3C2)c1 ZINC001203891934 966813073 /nfs/dbraw/zinc/81/30/73/966813073.db2.gz CCHHKNAJBXNPGY-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO Cc1cccc(C[N@H+]2CCn3nccc3C2)c1 ZINC001203891934 966813078 /nfs/dbraw/zinc/81/30/78/966813078.db2.gz CCHHKNAJBXNPGY-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCC(=O)[C@@H](C)C2)cc1 ZINC001203961756 966833357 /nfs/dbraw/zinc/83/33/57/966833357.db2.gz JWFFGFHAYCDTHV-LBPRGKRZSA-N 1 2 247.338 2.496 20 0 BEADLO CCOc1ccc(C[N@H+]2CCC(=O)[C@@H](C)C2)cc1 ZINC001203961756 966833360 /nfs/dbraw/zinc/83/33/60/966833360.db2.gz JWFFGFHAYCDTHV-LBPRGKRZSA-N 1 2 247.338 2.496 20 0 BEADLO CC1(C)C[N@H+](Cc2ncc[nH]2)CCC1(F)F ZINC001203978349 966834722 /nfs/dbraw/zinc/83/47/22/966834722.db2.gz UHOHTXVWFSBPRO-UHFFFAOYSA-N 1 2 229.274 2.277 20 0 BEADLO CC1(C)C[N@@H+](Cc2ncc[nH]2)CCC1(F)F ZINC001203978349 966834725 /nfs/dbraw/zinc/83/47/25/966834725.db2.gz UHOHTXVWFSBPRO-UHFFFAOYSA-N 1 2 229.274 2.277 20 0 BEADLO F[C@H]1CCC[N@H+](Cc2ccc3c(c2)OCO3)C1 ZINC001204052108 966871566 /nfs/dbraw/zinc/87/15/66/966871566.db2.gz FDZMMXUYFBQQHE-NSHDSACASA-N 1 2 237.274 2.349 20 0 BEADLO F[C@H]1CCC[N@@H+](Cc2ccc3c(c2)OCO3)C1 ZINC001204052108 966871572 /nfs/dbraw/zinc/87/15/72/966871572.db2.gz FDZMMXUYFBQQHE-NSHDSACASA-N 1 2 237.274 2.349 20 0 BEADLO Cc1ccc(C)c(Nc2ccc(CO)nc2)[nH+]1 ZINC001212372402 966935458 /nfs/dbraw/zinc/93/54/58/966935458.db2.gz HXOOUKMUIQJDCZ-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO COc1cc2c(cn1)CC[N@H+](Cc1ccoc1)C2 ZINC001204247972 966945626 /nfs/dbraw/zinc/94/56/26/966945626.db2.gz RKBJFOBIBNKROE-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1cc2c(cn1)CC[N@@H+](Cc1ccoc1)C2 ZINC001204247972 966945630 /nfs/dbraw/zinc/94/56/30/966945630.db2.gz RKBJFOBIBNKROE-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO CSc1cc(Nc2ccc(CO)nc2)cc[nH+]1 ZINC001212377110 966954368 /nfs/dbraw/zinc/95/43/68/966954368.db2.gz TZYHFYQYQZCBIP-UHFFFAOYSA-N 1 2 247.323 2.434 20 0 BEADLO CCc1ccc(C[N@H+](C)Cc2ccno2)o1 ZINC001204394906 966990690 /nfs/dbraw/zinc/99/06/90/966990690.db2.gz VMTMSUIUUGBFIP-UHFFFAOYSA-N 1 2 220.272 2.462 20 0 BEADLO CCc1ccc(C[N@@H+](C)Cc2ccno2)o1 ZINC001204394906 966990699 /nfs/dbraw/zinc/99/06/99/966990699.db2.gz VMTMSUIUUGBFIP-UHFFFAOYSA-N 1 2 220.272 2.462 20 0 BEADLO CCC[N@H+](C)[C@H](C)c1ncc(C(=O)OC)s1 ZINC001204422078 966997913 /nfs/dbraw/zinc/99/79/13/966997913.db2.gz KAWABQOHCAGGQO-MRVPVSSYSA-N 1 2 242.344 2.333 20 0 BEADLO CCC[N@@H+](C)[C@H](C)c1ncc(C(=O)OC)s1 ZINC001204422078 966997922 /nfs/dbraw/zinc/99/79/22/966997922.db2.gz KAWABQOHCAGGQO-MRVPVSSYSA-N 1 2 242.344 2.333 20 0 BEADLO CCC[N@H+](CCC(C)=O)CC(=O)OC(C)(C)C ZINC000186327417 966999683 /nfs/dbraw/zinc/99/96/83/966999683.db2.gz BEFOITGENZGLIT-UHFFFAOYSA-N 1 2 243.347 2.019 20 0 BEADLO CCC[N@@H+](CCC(C)=O)CC(=O)OC(C)(C)C ZINC000186327417 966999692 /nfs/dbraw/zinc/99/96/92/966999692.db2.gz BEFOITGENZGLIT-UHFFFAOYSA-N 1 2 243.347 2.019 20 0 BEADLO C[C@@H]1CC(=O)CC[N@@H+]1Cc1ccc2c(c1)CCO2 ZINC001204487472 967007992 /nfs/dbraw/zinc/00/79/92/967007992.db2.gz JMLPWFQXAFQCBI-LLVKDONJSA-N 1 2 245.322 2.175 20 0 BEADLO C[C@@H]1CC(=O)CC[N@H+]1Cc1ccc2c(c1)CCO2 ZINC001204487472 967007997 /nfs/dbraw/zinc/00/79/97/967007997.db2.gz JMLPWFQXAFQCBI-LLVKDONJSA-N 1 2 245.322 2.175 20 0 BEADLO Cc1c(F)cccc1C[N@@H+]1CCOCC12CC2 ZINC001204509869 967017367 /nfs/dbraw/zinc/01/73/67/967017367.db2.gz FYCLHRUKTRISRW-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1c(F)cccc1C[N@H+]1CCOCC12CC2 ZINC001204509869 967017374 /nfs/dbraw/zinc/01/73/74/967017374.db2.gz FYCLHRUKTRISRW-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cncnc2)oc1C ZINC001204540856 967043278 /nfs/dbraw/zinc/04/32/78/967043278.db2.gz CVDPJUBGGFITHO-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cncnc2)oc1C ZINC001204540856 967043295 /nfs/dbraw/zinc/04/32/95/967043295.db2.gz CVDPJUBGGFITHO-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1nc[nH]c1C[N@@H+]1CCc2ccc(F)cc2C1 ZINC001204589535 967078846 /nfs/dbraw/zinc/07/88/46/967078846.db2.gz HKUUZILHANJAHW-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1nc[nH]c1C[N@H+]1CCc2ccc(F)cc2C1 ZINC001204589535 967078854 /nfs/dbraw/zinc/07/88/54/967078854.db2.gz HKUUZILHANJAHW-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1nc[nH]c1C[N@@H+]1CCc2c(F)cccc2C1 ZINC001204590217 967080355 /nfs/dbraw/zinc/08/03/55/967080355.db2.gz FAJNBRRTEZGMQP-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1nc[nH]c1C[N@H+]1CCc2c(F)cccc2C1 ZINC001204590217 967080374 /nfs/dbraw/zinc/08/03/74/967080374.db2.gz FAJNBRRTEZGMQP-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1nc[nH]c1C[N@@H+]1CCc2cc(F)ccc2C1 ZINC001204593669 967092017 /nfs/dbraw/zinc/09/20/17/967092017.db2.gz XKJMSFJTRFVHJM-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1nc[nH]c1C[N@H+]1CCc2cc(F)ccc2C1 ZINC001204593669 967092027 /nfs/dbraw/zinc/09/20/27/967092027.db2.gz XKJMSFJTRFVHJM-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO CC(C)(C)C(=O)Cc1ccn2cc[nH+]c2c1 ZINC001249919176 967159385 /nfs/dbraw/zinc/15/93/85/967159385.db2.gz LHSJBXXLJBQHPG-UHFFFAOYSA-N 1 2 216.284 2.492 20 0 BEADLO COC(=O)c1c[nH]c2nc[nH+]c(C3=CCCC3)c12 ZINC001239785780 967166724 /nfs/dbraw/zinc/16/67/24/967166724.db2.gz MWKFOKMTDWIBKO-UHFFFAOYSA-N 1 2 243.266 2.263 20 0 BEADLO C[N@H+](CCCCO)Cc1scnc1Cl ZINC000721934284 967256839 /nfs/dbraw/zinc/25/68/39/967256839.db2.gz XKPANVJHTVSISO-UHFFFAOYSA-N 1 2 234.752 2.001 20 0 BEADLO C[N@@H+](CCCCO)Cc1scnc1Cl ZINC000721934284 967256852 /nfs/dbraw/zinc/25/68/52/967256852.db2.gz XKPANVJHTVSISO-UHFFFAOYSA-N 1 2 234.752 2.001 20 0 BEADLO CCOc1cc(C[N@@H+]2CC[C@H](F)C2)ccn1 ZINC001250001888 967261465 /nfs/dbraw/zinc/26/14/65/967261465.db2.gz FWHKGWUSNQKGAB-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO CCOc1cc(C[N@H+]2CC[C@H](F)C2)ccn1 ZINC001250001888 967261472 /nfs/dbraw/zinc/26/14/72/967261472.db2.gz FWHKGWUSNQKGAB-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO COc1cccnc1Nc1ccn2cc[nH+]c2c1 ZINC001204959462 967263405 /nfs/dbraw/zinc/26/34/05/967263405.db2.gz NZVISAIZPVEJGZ-UHFFFAOYSA-N 1 2 240.266 2.482 20 0 BEADLO Nc1cn(-c2ccn3cc[nH+]c3c2)c2cccnc12 ZINC001204966414 967264114 /nfs/dbraw/zinc/26/41/14/967264114.db2.gz REZOVMAAXKUTLP-UHFFFAOYSA-N 1 2 249.277 2.255 20 0 BEADLO c1cn2ccc(Nc3nonc3C3CC3)cc2[nH+]1 ZINC001204966162 967266141 /nfs/dbraw/zinc/26/61/41/967266141.db2.gz OVSKLVAEKKRCAF-UHFFFAOYSA-N 1 2 241.254 2.338 20 0 BEADLO CCOc1cc(C[N@@H+]2CCC[C@H](F)C2)ccn1 ZINC001250009122 967269353 /nfs/dbraw/zinc/26/93/53/967269353.db2.gz CYNSZBUAZHNQSJ-LBPRGKRZSA-N 1 2 238.306 2.414 20 0 BEADLO CCOc1cc(C[N@H+]2CCC[C@H](F)C2)ccn1 ZINC001250009122 967269359 /nfs/dbraw/zinc/26/93/59/967269359.db2.gz CYNSZBUAZHNQSJ-LBPRGKRZSA-N 1 2 238.306 2.414 20 0 BEADLO CCOc1cc(OC)ccc1C[N@H+](C)CCF ZINC001250071214 967337685 /nfs/dbraw/zinc/33/76/85/967337685.db2.gz LPXWVQYNEOSZCM-UHFFFAOYSA-N 1 2 241.306 2.495 20 0 BEADLO CCOc1cc(OC)ccc1C[N@@H+](C)CCF ZINC001250071214 967337693 /nfs/dbraw/zinc/33/76/93/967337693.db2.gz LPXWVQYNEOSZCM-UHFFFAOYSA-N 1 2 241.306 2.495 20 0 BEADLO CC(=O)[C@@H]1C[N@H+](Cc2cccc(C)c2C)CCO1 ZINC001205103848 967352220 /nfs/dbraw/zinc/35/22/20/967352220.db2.gz WKIAAOBWHLBNQD-HNNXBMFYSA-N 1 2 247.338 2.093 20 0 BEADLO CC(=O)[C@@H]1C[N@@H+](Cc2cccc(C)c2C)CCO1 ZINC001205103848 967352231 /nfs/dbraw/zinc/35/22/31/967352231.db2.gz WKIAAOBWHLBNQD-HNNXBMFYSA-N 1 2 247.338 2.093 20 0 BEADLO Cc1nn(C)c(C)c1-c1cccc2[nH+]ccn21 ZINC001240144296 967368145 /nfs/dbraw/zinc/36/81/45/967368145.db2.gz NSZFHHMDQSKALX-UHFFFAOYSA-N 1 2 226.283 2.352 20 0 BEADLO CCc1ccc(-c2ccc3[nH+]ccn3c2)nn1 ZINC001240214406 967425489 /nfs/dbraw/zinc/42/54/89/967425489.db2.gz NJSYPEDYVHLRCL-UHFFFAOYSA-N 1 2 224.267 2.354 20 0 BEADLO Nc1cn2ccc(-c3cncc(F)c3)cc2[nH+]1 ZINC001240235977 967443471 /nfs/dbraw/zinc/44/34/71/967443471.db2.gz YCEZFWHYPSVPEH-UHFFFAOYSA-N 1 2 228.230 2.118 20 0 BEADLO CNc1ccc(Nc2ccnc(SC)n2)c[nH+]1 ZINC001203448343 967449717 /nfs/dbraw/zinc/44/97/17/967449717.db2.gz YCVIOECRHWDEPG-UHFFFAOYSA-N 1 2 247.327 2.379 20 0 BEADLO CCn1nccc1Nc1cccc(C)[nH+]1 ZINC001205267655 967460358 /nfs/dbraw/zinc/46/03/58/967460358.db2.gz AZWUDMGFTGEONL-UHFFFAOYSA-N 1 2 202.261 2.350 20 0 BEADLO CC1(C)OC[C@@H](Cc2ccc3[nH+]ccn3c2)O1 ZINC001250183604 967486964 /nfs/dbraw/zinc/48/69/64/967486964.db2.gz QNLMMQUCFQSWEI-LLVKDONJSA-N 1 2 232.283 2.028 20 0 BEADLO Nc1[nH+]cccc1-c1ccc(F)c2n[nH]cc21 ZINC001205336767 967549478 /nfs/dbraw/zinc/54/94/78/967549478.db2.gz GIKCGWISRXADBQ-UHFFFAOYSA-N 1 2 228.230 2.346 20 0 BEADLO C[C@@H](CCCC(C)(C)O)Nc1cc[nH+]cc1F ZINC001168712613 967598476 /nfs/dbraw/zinc/59/84/76/967598476.db2.gz SAJXXZVHEWNPND-JTQLQIEISA-N 1 2 240.322 2.384 20 0 BEADLO Cc1c(F)cccc1CC[NH+]1CCOCC1 ZINC001250275996 967599389 /nfs/dbraw/zinc/59/93/89/967599389.db2.gz TXECRDWBKDLSPF-UHFFFAOYSA-N 1 2 223.291 2.009 20 0 BEADLO Cc1c(CC[NH+]2CCOCC2)ccc(F)c1F ZINC001250277493 967610212 /nfs/dbraw/zinc/61/02/12/967610212.db2.gz HZVRERVDRFDOEF-UHFFFAOYSA-N 1 2 241.281 2.148 20 0 BEADLO COc1ccc(OC)c(CCn2cc[nH+]c2)c1 ZINC001250315352 967677320 /nfs/dbraw/zinc/67/73/20/967677320.db2.gz KGJRFWNYQNOAGR-UHFFFAOYSA-N 1 2 232.283 2.143 20 0 BEADLO COCc1ccccc1CCn1cc[nH+]c1 ZINC001250315932 967677758 /nfs/dbraw/zinc/67/77/58/967677758.db2.gz XNSQOANJNPNPOW-UHFFFAOYSA-N 1 2 216.284 2.272 20 0 BEADLO CC(C)(O)c1cccc(CCn2cc[nH+]c2)c1 ZINC001250315848 967677827 /nfs/dbraw/zinc/67/78/27/967677827.db2.gz SXHYLNJOBCUZQP-UHFFFAOYSA-N 1 2 230.311 2.353 20 0 BEADLO COc1cc(CCn2cc[nH+]c2)ccc1F ZINC001250316256 967678416 /nfs/dbraw/zinc/67/84/16/967678416.db2.gz FLHBDNPIBIPLEL-UHFFFAOYSA-N 1 2 220.247 2.274 20 0 BEADLO c1cn(CCc2ccc(C3CC3)nc2)c[nH+]1 ZINC001250316338 967679036 /nfs/dbraw/zinc/67/90/36/967679036.db2.gz JQLGEHVBUCRVKL-UHFFFAOYSA-N 1 2 213.284 2.398 20 0 BEADLO Cn1ncc2ccc(CCn3cc[nH+]c3)cc21 ZINC001250315452 967679658 /nfs/dbraw/zinc/67/96/58/967679658.db2.gz MBUMNIIINBHYID-UHFFFAOYSA-N 1 2 226.283 2.013 20 0 BEADLO c1cn(CCc2ccc3n[nH]cc3c2)c[nH+]1 ZINC001250315436 967679992 /nfs/dbraw/zinc/67/99/92/967679992.db2.gz LTDYYRNFACRFNQ-UHFFFAOYSA-N 1 2 212.256 2.002 20 0 BEADLO Fc1cc(F)cc(CCn2cc[nH+]c2)c1 ZINC001250315827 967682233 /nfs/dbraw/zinc/68/22/33/967682233.db2.gz SAUIZZWDSXIRRD-UHFFFAOYSA-N 1 2 208.211 2.404 20 0 BEADLO CC(=O)c1cccc(CCn2cc[nH+]c2)c1 ZINC001250315843 967682693 /nfs/dbraw/zinc/68/26/93/967682693.db2.gz STAHLBOVQBVVED-UHFFFAOYSA-N 1 2 214.268 2.328 20 0 BEADLO Cc1ccc(CCn2cc[nH+]c2)c(O)c1 ZINC001250316783 967685475 /nfs/dbraw/zinc/68/54/75/967685475.db2.gz XQCWXELGFMSYIG-UHFFFAOYSA-N 1 2 202.257 2.140 20 0 BEADLO COc1ccc(C)c(CCn2cc[nH+]c2)c1 ZINC001250318639 967686123 /nfs/dbraw/zinc/68/61/23/967686123.db2.gz IBARJDNKCAEZNC-UHFFFAOYSA-N 1 2 216.284 2.443 20 0 BEADLO c1cnn(-c2ccccc2CCn2cc[nH+]c2)c1 ZINC001250319538 967692493 /nfs/dbraw/zinc/69/24/93/967692493.db2.gz UNYGPRWQCZLEIV-UHFFFAOYSA-N 1 2 238.294 2.312 20 0 BEADLO Oc1cccc(CCn2cc[nH+]c2)c1Cl ZINC001250318986 967692817 /nfs/dbraw/zinc/69/28/17/967692817.db2.gz OQWQGTCELIOUME-UHFFFAOYSA-N 1 2 222.675 2.485 20 0 BEADLO c1cn(CCc2ccnc(OC3CC3)c2)c[nH+]1 ZINC001250319997 967695804 /nfs/dbraw/zinc/69/58/04/967695804.db2.gz WSKYDNRFYYLCQK-UHFFFAOYSA-N 1 2 229.283 2.062 20 0 BEADLO Fc1ccc(CCn2cc[nH+]c2)c2c[nH]nc21 ZINC001250320546 967697445 /nfs/dbraw/zinc/69/74/45/967697445.db2.gz OJXBYPUFKZYRIG-UHFFFAOYSA-N 1 2 230.246 2.141 20 0 BEADLO CCc1cc(CCn2cc[nH+]c2)ccc1N ZINC001250320923 967699069 /nfs/dbraw/zinc/69/90/69/967699069.db2.gz SWRFALUJHUHJII-UHFFFAOYSA-N 1 2 215.300 2.270 20 0 BEADLO Fc1cccc2c1CC[N@H+](Cc1cnoc1)C2 ZINC001205724153 967804023 /nfs/dbraw/zinc/80/40/23/967804023.db2.gz HEJMRCRHKBJYSF-UHFFFAOYSA-N 1 2 232.258 2.372 20 0 BEADLO Fc1cccc2c1CC[N@@H+](Cc1cnoc1)C2 ZINC001205724153 967804026 /nfs/dbraw/zinc/80/40/26/967804026.db2.gz HEJMRCRHKBJYSF-UHFFFAOYSA-N 1 2 232.258 2.372 20 0 BEADLO FC(F)Cc1ccc[nH+]c1N1CCCC1 ZINC001250389701 967807031 /nfs/dbraw/zinc/80/70/31/967807031.db2.gz JSDKBRLJQYIMPJ-UHFFFAOYSA-N 1 2 212.243 2.489 20 0 BEADLO CC(C)OCCc1ccc(N(C)C)[nH+]c1 ZINC001250403533 967811510 /nfs/dbraw/zinc/81/15/10/967811510.db2.gz CYPLRRAUUSDJHL-UHFFFAOYSA-N 1 2 208.305 2.115 20 0 BEADLO C[C@@H]1C(=O)CC[N@H+](Cc2cnoc2)C12CCCC2 ZINC001205762408 967816129 /nfs/dbraw/zinc/81/61/29/967816129.db2.gz LVJZKRMZYIRRIP-LLVKDONJSA-N 1 2 248.326 2.398 20 0 BEADLO C[C@@H]1C(=O)CC[N@@H+](Cc2cnoc2)C12CCCC2 ZINC001205762408 967816133 /nfs/dbraw/zinc/81/61/33/967816133.db2.gz LVJZKRMZYIRRIP-LLVKDONJSA-N 1 2 248.326 2.398 20 0 BEADLO CC(C)OCCc1ccn2cc[nH+]c2c1 ZINC001250411590 967818538 /nfs/dbraw/zinc/81/85/38/967818538.db2.gz ZSFURYLSDHYDAR-UHFFFAOYSA-N 1 2 204.273 2.302 20 0 BEADLO COc1nc(NC(=[NH2+])C(C)(C)C)cn2ccnc12 ZINC001162664883 967884354 /nfs/dbraw/zinc/88/43/54/967884354.db2.gz USCPNKHWBMXURB-UHFFFAOYSA-N 1 2 247.302 2.173 20 0 BEADLO Nc1[nH+]cccc1-c1ccnc2ccncc21 ZINC001250503735 967995685 /nfs/dbraw/zinc/99/56/85/967995685.db2.gz IGVOFAFGZSBKLP-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO c1c2c(cc3[nH+]c(CC4CC4)[nH]c13)OCC2 ZINC001250573219 968092247 /nfs/dbraw/zinc/09/22/47/968092247.db2.gz XEIBKRCCJSERHI-UHFFFAOYSA-N 1 2 214.268 2.450 20 0 BEADLO Cc1cc(O)cc(-c2ccc[nH+]c2N)c1 ZINC001206226800 968153448 /nfs/dbraw/zinc/15/34/48/968153448.db2.gz QDFOGZJFSXBGFQ-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO Cc1ccc2[nH]c(CCC3OCCO3)[nH+]c2c1 ZINC001250608584 968155353 /nfs/dbraw/zinc/15/53/53/968155353.db2.gz YQTVRVRYELUYEA-UHFFFAOYSA-N 1 2 232.283 2.177 20 0 BEADLO CC1(Nc2ccn3cc(N)[nH+]c3c2)CCC1 ZINC001164032651 968158587 /nfs/dbraw/zinc/15/85/87/968158587.db2.gz MAYWPKBDFBGXGW-UHFFFAOYSA-N 1 2 216.288 2.271 20 0 BEADLO O=C1CCCN(c2cc(C3CC3)cc[nH+]2)C[C@@H]1F ZINC001164136997 968174009 /nfs/dbraw/zinc/17/40/09/968174009.db2.gz RGAOOBMJRNRBCD-LBPRGKRZSA-N 1 2 248.301 2.466 20 0 BEADLO Cc1cccc2c1cc[nH+]c2N1C[C@@H](O)[C@@H](F)C1 ZINC001164112602 968176017 /nfs/dbraw/zinc/17/60/17/968176017.db2.gz BBHAZZZLGCPSAE-QWHCGFSZSA-N 1 2 246.285 2.062 20 0 BEADLO Cc1c(F)cc[nH+]c1N1CCC(=O)[C@H](C)CC1 ZINC001164369695 968230094 /nfs/dbraw/zinc/23/00/94/968230094.db2.gz YMYGSDJYKIVJFQ-SECBINFHSA-N 1 2 236.290 2.335 20 0 BEADLO C[C@@H](C(=O)N(C)[C@H]1CCCC[C@H]1C)n1cc[nH+]c1 ZINC001251283771 968280657 /nfs/dbraw/zinc/28/06/57/968280657.db2.gz OCPCYRWPOKFAIP-AGIUHOORSA-N 1 2 249.358 2.481 20 0 BEADLO COc1cc(C)ccc1C[N@H+](C)C1(C)COC1 ZINC001206769856 968465422 /nfs/dbraw/zinc/46/54/22/968465422.db2.gz KVOMCHBBFRKLKO-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO COc1cc(C)ccc1C[N@@H+](C)C1(C)COC1 ZINC001206769856 968465424 /nfs/dbraw/zinc/46/54/24/968465424.db2.gz KVOMCHBBFRKLKO-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO Cc1nc(C[NH+]2CC(c3cccnc3)C2)cs1 ZINC001206802386 968485157 /nfs/dbraw/zinc/48/51/57/968485157.db2.gz GRZHNBGRZXHPHY-UHFFFAOYSA-N 1 2 245.351 2.446 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H](C)C[C@H]2CF)no1 ZINC001206818414 968489887 /nfs/dbraw/zinc/48/98/87/968489887.db2.gz QMRYAWDIZVABNB-KWQFWETISA-N 1 2 212.268 2.163 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H](C)C[C@H]2CF)no1 ZINC001206818414 968489891 /nfs/dbraw/zinc/48/98/91/968489891.db2.gz QMRYAWDIZVABNB-KWQFWETISA-N 1 2 212.268 2.163 20 0 BEADLO CCCC[C@@H](O)CNc1cc[nH+]c(OC)c1 ZINC001252079020 968496128 /nfs/dbraw/zinc/49/61/28/968496128.db2.gz GCIDOJWNDMBEQB-LLVKDONJSA-N 1 2 224.304 2.053 20 0 BEADLO O=c1cccc(C[NH+]2CC3(C2)CC(F)(F)C3)[nH]1 ZINC001207065250 968596792 /nfs/dbraw/zinc/59/67/92/968596792.db2.gz MGJMBALLOJJLIM-UHFFFAOYSA-N 1 2 240.253 2.018 20 0 BEADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1cccc(=O)[nH]1 ZINC001207074216 968609202 /nfs/dbraw/zinc/60/92/02/968609202.db2.gz ZLEOIPSSEZDLKF-LLVKDONJSA-N 1 2 243.310 2.166 20 0 BEADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1cccc(=O)[nH]1 ZINC001207074216 968609204 /nfs/dbraw/zinc/60/92/04/968609204.db2.gz ZLEOIPSSEZDLKF-LLVKDONJSA-N 1 2 243.310 2.166 20 0 BEADLO C[C@H]1c2cccn2CC[N@H+]1Cc1cccc(=O)[nH]1 ZINC001207074217 968610025 /nfs/dbraw/zinc/61/00/25/968610025.db2.gz ZLEOIPSSEZDLKF-NSHDSACASA-N 1 2 243.310 2.166 20 0 BEADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1cccc(=O)[nH]1 ZINC001207074217 968610032 /nfs/dbraw/zinc/61/00/32/968610032.db2.gz ZLEOIPSSEZDLKF-NSHDSACASA-N 1 2 243.310 2.166 20 0 BEADLO Cc1[nH]c(CNC(=O)C2(C)CCCC2)[nH+]c1C ZINC000825106555 968634347 /nfs/dbraw/zinc/63/43/47/968634347.db2.gz LCDGVLDCKMJCFC-UHFFFAOYSA-N 1 2 235.331 2.223 20 0 BEADLO Nc1[nH+]cccc1-c1cc(F)ccc1O ZINC001240696576 968644654 /nfs/dbraw/zinc/64/46/54/968644654.db2.gz IXHYWRVVVBUWJB-UHFFFAOYSA-N 1 2 204.204 2.176 20 0 BEADLO Cc1nccc(C[N@@H+](C)Cc2cccnc2C)n1 ZINC001207168587 968676486 /nfs/dbraw/zinc/67/64/86/968676486.db2.gz ILLQUXNIPSHYGE-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1nccc(C[N@H+](C)Cc2cccnc2C)n1 ZINC001207168587 968676491 /nfs/dbraw/zinc/67/64/91/968676491.db2.gz ILLQUXNIPSHYGE-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO COC(=O)[C@@H]1CC[N@@H+]1CC1CCC(F)(F)CC1 ZINC001207343255 968725950 /nfs/dbraw/zinc/72/59/50/968725950.db2.gz WDINLODUPMRHBS-JTQLQIEISA-N 1 2 247.285 2.059 20 0 BEADLO COC(=O)[C@@H]1CC[N@H+]1CC1CCC(F)(F)CC1 ZINC001207343255 968725956 /nfs/dbraw/zinc/72/59/56/968725956.db2.gz WDINLODUPMRHBS-JTQLQIEISA-N 1 2 247.285 2.059 20 0 BEADLO Clc1cccc(CC[N@H+]2C[C@H]3C[C@@H](C2)O3)c1 ZINC001207426353 968766561 /nfs/dbraw/zinc/76/65/61/968766561.db2.gz UJLRYBKFXRQCED-BETUJISGSA-N 1 2 237.730 2.356 20 0 BEADLO Clc1cccc(CC[N@@H+]2C[C@H]3C[C@@H](C2)O3)c1 ZINC001207426353 968766567 /nfs/dbraw/zinc/76/65/67/968766567.db2.gz UJLRYBKFXRQCED-BETUJISGSA-N 1 2 237.730 2.356 20 0 BEADLO CCCOC1C[NH+](CCc2ccccc2OC)C1 ZINC001207455938 968779428 /nfs/dbraw/zinc/77/94/28/968779428.db2.gz GNWNPYSAXIEUGT-UHFFFAOYSA-N 1 2 249.354 2.349 20 0 BEADLO Cc1cc(C(F)(F)F)ccc1C[NH+]1CC(O)C1 ZINC000336627184 968791815 /nfs/dbraw/zinc/79/18/15/968791815.db2.gz WWEKWXUZPLKDDO-UHFFFAOYSA-N 1 2 245.244 2.190 20 0 BEADLO CCCOC1C[NH+](CCc2ccccc2F)C1 ZINC001207501968 968807008 /nfs/dbraw/zinc/80/70/08/968807008.db2.gz BIKGUXZEGLWEFH-UHFFFAOYSA-N 1 2 237.318 2.479 20 0 BEADLO C1=C[C@@H]2C[C@H]1C[C@H]2CN1CC[NH+](CC2CC2)CC1 ZINC001207627173 968841110 /nfs/dbraw/zinc/84/11/10/968841110.db2.gz TUJXTIZBDIUIRD-XHSDSOJGSA-N 1 2 246.398 2.226 20 0 BEADLO Cc1ccc(-c2nnc(Cc3c[nH]c[nH+]3)o2)cc1 ZINC001252631020 968890035 /nfs/dbraw/zinc/89/00/35/968890035.db2.gz HOBHJUBPVFRHAA-UHFFFAOYSA-N 1 2 240.266 2.359 20 0 BEADLO Nc1ccccc1-c1c[nH+]c2c(c1)CCCN2 ZINC001241079712 968896844 /nfs/dbraw/zinc/89/68/44/968896844.db2.gz ZTFGOEHTIZFWGH-UHFFFAOYSA-N 1 2 225.295 2.332 20 0 BEADLO Cc1ccc(-c2nnc(C[NH+]3CCC3)o2)cc1 ZINC001252663046 968898778 /nfs/dbraw/zinc/89/87/78/968898778.db2.gz BXJWTUJLPDWDPB-UHFFFAOYSA-N 1 2 229.283 2.251 20 0 BEADLO CCC[C@@H](O)CNc1c[nH+]c(C)cc1C ZINC001252774469 968940795 /nfs/dbraw/zinc/94/07/95/968940795.db2.gz NDGIFYDKQDWTFZ-LLVKDONJSA-N 1 2 208.305 2.271 20 0 BEADLO COC(=O)c1ccc(-c2cc[nH+]c(N)c2)cc1C ZINC001241164187 968942126 /nfs/dbraw/zinc/94/21/26/968942126.db2.gz XQLUKPBEDIHXQU-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO Nc1cc(-c2ccc3nsnc3c2)cc[nH+]1 ZINC001241163294 968942226 /nfs/dbraw/zinc/94/22/26/968942226.db2.gz SZBBDXCEKJDOGK-UHFFFAOYSA-N 1 2 228.280 2.336 20 0 BEADLO Cc1ccc(CCC[NH+]2CCC(=O)CC2)o1 ZINC001207944675 968943267 /nfs/dbraw/zinc/94/32/67/968943267.db2.gz SOFIXCCNHPHCAQ-UHFFFAOYSA-N 1 2 221.300 2.186 20 0 BEADLO Nc1cc(-c2cnc3c(c2)CCC3)cc[nH+]1 ZINC001241161976 968944217 /nfs/dbraw/zinc/94/42/17/968944217.db2.gz DBXFSQLZELKROJ-UHFFFAOYSA-N 1 2 211.268 2.215 20 0 BEADLO CCC[C@H](O)CNc1ccc(N2CCCC2)[nH+]c1 ZINC001252779784 968952744 /nfs/dbraw/zinc/95/27/44/968952744.db2.gz UUGXEZOWRHDWBC-ZDUSSCGKSA-N 1 2 249.358 2.255 20 0 BEADLO Fc1cnccc1-c1cc(-n2cc[nH+]c2)ccn1 ZINC001241225449 968953016 /nfs/dbraw/zinc/95/30/16/968953016.db2.gz OJIGOJPDBZECCO-UHFFFAOYSA-N 1 2 240.241 2.468 20 0 BEADLO COc1ncc(-c2ccc3[nH+]ccn3c2)s1 ZINC001241413284 968994379 /nfs/dbraw/zinc/99/43/79/968994379.db2.gz RJPHIIWVNYWWQP-UHFFFAOYSA-N 1 2 231.280 2.466 20 0 BEADLO c1ncc(-c2cc(N3CCOCC3)cc[nH+]2)s1 ZINC001241495758 969010106 /nfs/dbraw/zinc/01/01/06/969010106.db2.gz FBQBNPFJHKHLDW-UHFFFAOYSA-N 1 2 247.323 2.042 20 0 BEADLO Cc1[nH]c[nH+]c1NC[C@](C)(O)c1ccccc1 ZINC001253096165 969076136 /nfs/dbraw/zinc/07/61/36/969076136.db2.gz ZJESPODTUBJFAI-ZDUSSCGKSA-N 1 2 231.299 2.038 20 0 BEADLO Nc1cn2ccc(-c3cnn(C4CC4)c3)cc2[nH+]1 ZINC001241906628 969139731 /nfs/dbraw/zinc/13/97/31/969139731.db2.gz LKWHJSGPZHIWEG-UHFFFAOYSA-N 1 2 239.282 2.115 20 0 BEADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ncc[nH]1 ZINC001242018897 969175508 /nfs/dbraw/zinc/17/55/08/969175508.db2.gz CYGUATVETYYJKN-UHFFFAOYSA-N 1 2 240.266 2.271 20 0 BEADLO O=C1NCCC[C@H]1c1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001242020093 969175802 /nfs/dbraw/zinc/17/58/02/969175802.db2.gz OWDCRJDKWFWDRE-LBPRGKRZSA-N 1 2 241.294 2.070 20 0 BEADLO CCCCC[C@H](O)CNc1cc[nH+]c(C)n1 ZINC001253520258 969198076 /nfs/dbraw/zinc/19/80/76/969198076.db2.gz JEGKAUVXANYBCU-NSHDSACASA-N 1 2 223.320 2.138 20 0 BEADLO CCCCC[C@H](O)C[N@@H+]1C[C@@H](F)C[C@H]1CF ZINC001253525223 969201206 /nfs/dbraw/zinc/20/12/06/969201206.db2.gz LDWBRGNUSUERJB-SRVKXCTJSA-N 1 2 235.318 2.310 20 0 BEADLO CCCCC[C@H](O)C[N@H+]1C[C@@H](F)C[C@H]1CF ZINC001253525223 969201209 /nfs/dbraw/zinc/20/12/09/969201209.db2.gz LDWBRGNUSUERJB-SRVKXCTJSA-N 1 2 235.318 2.310 20 0 BEADLO CC(=O)N1CCC[C@H](CNc2ccc[nH+]c2C)C1 ZINC001168781605 969205719 /nfs/dbraw/zinc/20/57/19/969205719.db2.gz NHKPAWBIYKOGPX-CYBMUJFWSA-N 1 2 247.342 2.060 20 0 BEADLO Fc1c[nH+]ccc1NCCCCc1ccccn1 ZINC001168795105 969219381 /nfs/dbraw/zinc/21/93/81/969219381.db2.gz KJCQJLGQSXAGPI-UHFFFAOYSA-N 1 2 245.301 2.472 20 0 BEADLO C[N@H+]1CC=C(N=c2cc(Cl)[nH]cc2O)CC1 ZINC001208793157 969236249 /nfs/dbraw/zinc/23/62/49/969236249.db2.gz DVFOPXGYHHCVOK-UHFFFAOYSA-N 1 2 239.706 2.072 20 0 BEADLO CC(=O)NCc1ccc(NCCC2CCC2)[nH+]c1 ZINC001168887287 969262595 /nfs/dbraw/zinc/26/25/95/969262595.db2.gz YPELJZVJEPBJQY-UHFFFAOYSA-N 1 2 247.342 2.320 20 0 BEADLO C[C@H](C[N@H+]1CCC(=O)[C@@H](F)CC1)C(F)(F)F ZINC001208896579 969288169 /nfs/dbraw/zinc/28/81/69/969288169.db2.gz XFRIYSFHKLVEKZ-SFYZADRCSA-N 1 2 241.228 2.188 20 0 BEADLO C[C@H](C[N@@H+]1CCC(=O)[C@@H](F)CC1)C(F)(F)F ZINC001208896579 969288176 /nfs/dbraw/zinc/28/81/76/969288176.db2.gz XFRIYSFHKLVEKZ-SFYZADRCSA-N 1 2 241.228 2.188 20 0 BEADLO FC[C@@H]1C[C@H](F)C[N@@H+]1CCCc1cccnc1 ZINC001209173263 969372597 /nfs/dbraw/zinc/37/25/97/969372597.db2.gz YWYGTJPJUILCSG-STQMWFEESA-N 1 2 240.297 2.396 20 0 BEADLO FC[C@@H]1C[C@H](F)C[N@H+]1CCCc1cccnc1 ZINC001209173263 969372601 /nfs/dbraw/zinc/37/26/01/969372601.db2.gz YWYGTJPJUILCSG-STQMWFEESA-N 1 2 240.297 2.396 20 0 BEADLO c1csc(CC[N@@H+]2Cc3cncnc3C2)c1 ZINC001209224039 969409376 /nfs/dbraw/zinc/40/93/76/969409376.db2.gz RYDHSOXSMYYVDR-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1csc(CC[N@H+]2Cc3cncnc3C2)c1 ZINC001209224039 969409380 /nfs/dbraw/zinc/40/93/80/969409380.db2.gz RYDHSOXSMYYVDR-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO Cc1ccc2cc(N[C@H]3COC(=O)C3)[nH+]cc2c1 ZINC001169121263 969416641 /nfs/dbraw/zinc/41/66/41/969416641.db2.gz VBBOJRVZDZNEMU-GFCCVEGCSA-N 1 2 242.278 2.271 20 0 BEADLO C[C@@H]1CC[N@H+](CCCC2OCCO2)CC1(F)F ZINC001209303673 969432251 /nfs/dbraw/zinc/43/22/51/969432251.db2.gz MUSRXBOFAKBXPN-SNVBAGLBSA-N 1 2 249.301 2.117 20 0 BEADLO C[C@@H]1CC[N@@H+](CCCC2OCCO2)CC1(F)F ZINC001209303673 969432253 /nfs/dbraw/zinc/43/22/53/969432253.db2.gz MUSRXBOFAKBXPN-SNVBAGLBSA-N 1 2 249.301 2.117 20 0 BEADLO O=C1CCC[N@H+](CC2Cc3ccccc3C2)C1 ZINC001209321658 969443496 /nfs/dbraw/zinc/44/34/96/969443496.db2.gz ICRHJRUYSXXEJP-UHFFFAOYSA-N 1 2 229.323 2.066 20 0 BEADLO O=C1CCC[N@@H+](CC2Cc3ccccc3C2)C1 ZINC001209321658 969443499 /nfs/dbraw/zinc/44/34/99/969443499.db2.gz ICRHJRUYSXXEJP-UHFFFAOYSA-N 1 2 229.323 2.066 20 0 BEADLO COc1cccnc1CNc1cccc[nH+]1 ZINC001169202680 969485170 /nfs/dbraw/zinc/48/51/70/969485170.db2.gz KFRLOHRAIBXNRL-UHFFFAOYSA-N 1 2 215.256 2.097 20 0 BEADLO COC(=O)C[N@H+](C)Cc1c[nH]c2c1cccc2C ZINC001209495337 969526752 /nfs/dbraw/zinc/52/67/52/969526752.db2.gz UWMGARCSYYDNPT-UHFFFAOYSA-N 1 2 246.310 2.081 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1c[nH]c2c1cccc2C ZINC001209495337 969526756 /nfs/dbraw/zinc/52/67/56/969526756.db2.gz UWMGARCSYYDNPT-UHFFFAOYSA-N 1 2 246.310 2.081 20 0 BEADLO c1cc2ccc(C[N@@H+]3CCC34COC4)cc2[nH]1 ZINC001209513259 969530931 /nfs/dbraw/zinc/53/09/31/969530931.db2.gz ZJOIXEITSOFIMJ-UHFFFAOYSA-N 1 2 228.295 2.143 20 0 BEADLO c1cc2ccc(C[N@H+]3CCC34COC4)cc2[nH]1 ZINC001209513259 969530941 /nfs/dbraw/zinc/53/09/41/969530941.db2.gz ZJOIXEITSOFIMJ-UHFFFAOYSA-N 1 2 228.295 2.143 20 0 BEADLO Cc1cnc2c(c1)C[N@@H+](Cc1cncs1)CC2 ZINC001209550937 969537946 /nfs/dbraw/zinc/53/79/46/969537946.db2.gz PMPSQOOASMNJJA-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cnc2c(c1)C[N@H+](Cc1cncs1)CC2 ZINC001209550937 969537949 /nfs/dbraw/zinc/53/79/49/969537949.db2.gz PMPSQOOASMNJJA-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ccc(C[N@@H+]2CCc3ncsc3C2)[nH]1 ZINC001209574487 969539563 /nfs/dbraw/zinc/53/95/63/969539563.db2.gz NSHBAMFLIXUSMM-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1ccc(C[N@H+]2CCc3ncsc3C2)[nH]1 ZINC001209574487 969539573 /nfs/dbraw/zinc/53/95/73/969539573.db2.gz NSHBAMFLIXUSMM-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1nc2c(s1)C[N@H+](Cc1c[nH]nc1C)CC2 ZINC001209555996 969543999 /nfs/dbraw/zinc/54/39/99/969543999.db2.gz QBDWKCCBLTWJTC-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO Cc1nc2c(s1)C[N@@H+](Cc1c[nH]nc1C)CC2 ZINC001209555996 969544002 /nfs/dbraw/zinc/54/40/02/969544002.db2.gz QBDWKCCBLTWJTC-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO C[N@@H+](Cc1ccon1)C[C@@H]1Cc2ccccc2O1 ZINC001209566805 969551447 /nfs/dbraw/zinc/55/14/47/969551447.db2.gz UCJPNEYEMSHHDU-ZDUSSCGKSA-N 1 2 244.294 2.110 20 0 BEADLO C[N@H+](Cc1ccon1)C[C@@H]1Cc2ccccc2O1 ZINC001209566805 969551450 /nfs/dbraw/zinc/55/14/50/969551450.db2.gz UCJPNEYEMSHHDU-ZDUSSCGKSA-N 1 2 244.294 2.110 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cnc(C)nc2)[nH]1 ZINC001209578898 969561026 /nfs/dbraw/zinc/56/10/26/969561026.db2.gz QQQBYSUCFTUVKC-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cnc(C)nc2)[nH]1 ZINC001209578898 969561030 /nfs/dbraw/zinc/56/10/30/969561030.db2.gz QQQBYSUCFTUVKC-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Fc1ccc2c(C[N@@H+]3CCO[C@@H]4C[C@@H]43)c[nH]c2c1 ZINC001209696201 969574669 /nfs/dbraw/zinc/57/46/69/969574669.db2.gz SLNFWFGYUMEYRD-UONOGXRCSA-N 1 2 246.285 2.280 20 0 BEADLO Fc1ccc2c(C[N@H+]3CCO[C@@H]4C[C@@H]43)c[nH]c2c1 ZINC001209696201 969574672 /nfs/dbraw/zinc/57/46/72/969574672.db2.gz SLNFWFGYUMEYRD-UONOGXRCSA-N 1 2 246.285 2.280 20 0 BEADLO Fc1ccc2c(C[N@@H+]3CCO[C@H]4C[C@H]43)c[nH]c2c1 ZINC001209696200 969576095 /nfs/dbraw/zinc/57/60/95/969576095.db2.gz SLNFWFGYUMEYRD-KGLIPLIRSA-N 1 2 246.285 2.280 20 0 BEADLO Fc1ccc2c(C[N@H+]3CCO[C@H]4C[C@H]43)c[nH]c2c1 ZINC001209696200 969576102 /nfs/dbraw/zinc/57/61/02/969576102.db2.gz SLNFWFGYUMEYRD-KGLIPLIRSA-N 1 2 246.285 2.280 20 0 BEADLO Cc1cccc2c1C[N@H+](Cc1cnccn1)C2 ZINC001209783853 969615935 /nfs/dbraw/zinc/61/59/35/969615935.db2.gz YXDDPHCOFPWZDV-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO Cc1cccc2c1C[N@@H+](Cc1cnccn1)C2 ZINC001209783853 969615939 /nfs/dbraw/zinc/61/59/39/969615939.db2.gz YXDDPHCOFPWZDV-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO c1coc(C[N@H+](Cc2cnccn2)C2CC2)c1 ZINC001209788303 969621737 /nfs/dbraw/zinc/62/17/37/969621737.db2.gz KIEXJNANVDAZMY-UHFFFAOYSA-N 1 2 229.283 2.234 20 0 BEADLO c1coc(C[N@@H+](Cc2cnccn2)C2CC2)c1 ZINC001209788303 969621747 /nfs/dbraw/zinc/62/17/47/969621747.db2.gz KIEXJNANVDAZMY-UHFFFAOYSA-N 1 2 229.283 2.234 20 0 BEADLO Cc1cc(Nc2ccc3[nH]c[nH+]c3c2)nn1C ZINC001209841618 969653192 /nfs/dbraw/zinc/65/31/92/969653192.db2.gz XWIDGCVKRKFOIK-UHFFFAOYSA-N 1 2 227.271 2.348 20 0 BEADLO Oc1cncc(Nc2ccc3[nH]c[nH+]c3c2)c1 ZINC001209842279 969653258 /nfs/dbraw/zinc/65/32/58/969653258.db2.gz GUFXYUDQBKBWLM-UHFFFAOYSA-N 1 2 226.239 2.407 20 0 BEADLO FCCn1cnc(Nc2ccc3[nH]c[nH+]c3c2)c1 ZINC001209849333 969663353 /nfs/dbraw/zinc/66/33/53/969663353.db2.gz XFWHOSHYKKCREX-UHFFFAOYSA-N 1 2 245.261 2.473 20 0 BEADLO C[C@@H]1C[NH2+]C[C@H](C)N1Cc1ccc(S)cc1 ZINC001209885216 969682475 /nfs/dbraw/zinc/68/24/75/969682475.db2.gz BUXFSUXADCWEEL-PHIMTYICSA-N 1 2 236.384 2.158 20 0 BEADLO c1nnc(Nc2ccc3c[nH+]ccc3c2)o1 ZINC001210043427 969774713 /nfs/dbraw/zinc/77/47/13/969774713.db2.gz DNFDORYDCRUAPR-UHFFFAOYSA-N 1 2 212.212 2.361 20 0 BEADLO Cn1cc(Nc2ccc3c[nH+]ccc3c2)nn1 ZINC001210045445 969777447 /nfs/dbraw/zinc/77/74/47/969777447.db2.gz KLZOGKZSXGJPNR-UHFFFAOYSA-N 1 2 225.255 2.107 20 0 BEADLO c1ccc2c(c1)CC[C@H]2OCC[NH+]1CCOCC1 ZINC001210191197 969825586 /nfs/dbraw/zinc/82/55/86/969825586.db2.gz CQZXQSDNLXQGMB-OAHLLOKOSA-N 1 2 247.338 2.023 20 0 BEADLO Cn1ncc(N)c1Nc1cccc2cc[nH+]cc21 ZINC001210224540 969837310 /nfs/dbraw/zinc/83/73/10/969837310.db2.gz RCSAIYMRGWIBJU-UHFFFAOYSA-N 1 2 239.282 2.294 20 0 BEADLO CO[C@@H](C)CNc1ccc(Cn2cc[nH+]c2)cc1 ZINC001169776917 969840097 /nfs/dbraw/zinc/84/00/97/969840097.db2.gz SHTLOTFPPSITMM-LBPRGKRZSA-N 1 2 245.326 2.378 20 0 BEADLO Cc1cnc(C)c(Nc2c[nH+]c(C)c(N)c2)n1 ZINC001210283732 969850961 /nfs/dbraw/zinc/85/09/61/969850961.db2.gz AUUUDJRXIUIMIZ-UHFFFAOYSA-N 1 2 229.287 2.123 20 0 BEADLO Cc1[nH+]cc(Nc2noc3cnccc23)cc1N ZINC001210287613 969853199 /nfs/dbraw/zinc/85/31/99/969853199.db2.gz XUPGIAUNSCLZFG-UHFFFAOYSA-N 1 2 241.254 2.252 20 0 BEADLO Cc1[nH+]cc(Nc2cncc(N(C)C)c2)cc1N ZINC001210287124 969854389 /nfs/dbraw/zinc/85/43/89/969854389.db2.gz LTIMHJKGEYOEQP-UHFFFAOYSA-N 1 2 243.314 2.177 20 0 BEADLO CCc1cc(Nc2c[nH+]c(C)c(N)c2)on1 ZINC001210286874 969854833 /nfs/dbraw/zinc/85/48/33/969854833.db2.gz FAJRCRFQNHYEKO-UHFFFAOYSA-N 1 2 218.260 2.266 20 0 BEADLO COc1cc(Nc2c[nH+]c(C)c(N)c2)ccn1 ZINC001210287369 969855138 /nfs/dbraw/zinc/85/51/38/969855138.db2.gz ROBGUTIIITXEQU-UHFFFAOYSA-N 1 2 230.271 2.119 20 0 BEADLO Cc1[nH+]cc(Nc2cnn3ccccc23)cc1N ZINC001210289172 969855778 /nfs/dbraw/zinc/85/57/78/969855778.db2.gz XMSYEZQABZXGOS-UHFFFAOYSA-N 1 2 239.282 2.364 20 0 BEADLO Cc1[nH+]cc(Nc2ccc(F)nc2F)cc1N ZINC001210288399 969857173 /nfs/dbraw/zinc/85/71/73/969857173.db2.gz HERCPCMHBWYKLP-UHFFFAOYSA-N 1 2 236.225 2.389 20 0 BEADLO COc1ccc(Nc2c[nH+]c(C)c(N)c2)c(O)c1 ZINC001210290561 969858551 /nfs/dbraw/zinc/85/85/51/969858551.db2.gz OGWQWGHQKYMYAQ-UHFFFAOYSA-N 1 2 245.282 2.430 20 0 BEADLO Cc1[nH+]cc(Nc2ccc(F)cc2CO)cc1N ZINC001210289569 969859431 /nfs/dbraw/zinc/85/94/31/969859431.db2.gz RUKQEUAMGMFJAG-UHFFFAOYSA-N 1 2 247.273 2.347 20 0 BEADLO Cc1[nH+]cc(Nc2cccc(CO)c2)cc1N ZINC001210290254 969859829 /nfs/dbraw/zinc/85/98/29/969859829.db2.gz GXJWLVSTEZIJOZ-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO Cc1cc(-c2cccc(F)c2O)c[nH+]c1N ZINC001242350651 969899098 /nfs/dbraw/zinc/89/90/98/969899098.db2.gz JHXJORBPPNBANT-UHFFFAOYSA-N 1 2 218.231 2.484 20 0 BEADLO Oc1c(Cl)cccc1-c1ncnc2c1C[NH2+]C2 ZINC001242362590 969906745 /nfs/dbraw/zinc/90/67/45/969906745.db2.gz JUJOCCMHVHHXCX-UHFFFAOYSA-N 1 2 247.685 2.106 20 0 BEADLO CC(=O)c1cc(Nc2cccc(C)[nH+]2)ccn1 ZINC001210588029 969966612 /nfs/dbraw/zinc/96/66/12/969966612.db2.gz HFYKCVXOAVAIFI-UHFFFAOYSA-N 1 2 227.267 2.153 20 0 BEADLO CCCN(C)c1[nH+]c(C)cc(C)c1C(=O)OC ZINC001156877967 970020346 /nfs/dbraw/zinc/02/03/46/970020346.db2.gz LIWJULXPKUTMKU-UHFFFAOYSA-N 1 2 236.315 2.331 20 0 BEADLO CCc1cnc(Nc2cc(C)[nH+]c(OC)c2)cn1 ZINC001210775226 970027354 /nfs/dbraw/zinc/02/73/54/970027354.db2.gz UDASKLYQENVTCU-UHFFFAOYSA-N 1 2 244.298 2.495 20 0 BEADLO Cc1nc2c(s1)C[N@@H+]([C@H]1CCSC1)C2 ZINC001255296642 970059104 /nfs/dbraw/zinc/05/91/04/970059104.db2.gz UYPFTNJXLVIBQE-QMMMGPOBSA-N 1 2 226.370 2.273 20 0 BEADLO Cc1nc2c(s1)C[N@H+]([C@H]1CCSC1)C2 ZINC001255296642 970059109 /nfs/dbraw/zinc/05/91/09/970059109.db2.gz UYPFTNJXLVIBQE-QMMMGPOBSA-N 1 2 226.370 2.273 20 0 BEADLO [NH2+]=CNc1cc2ccc(Cl)nc2cn1 ZINC001157079240 970080449 /nfs/dbraw/zinc/08/04/49/970080449.db2.gz UUGCFIJECMSTJA-UHFFFAOYSA-N 1 2 206.636 2.302 20 0 BEADLO Cc1nc(C2CC2)nc(Cl)c1NC=[NH2+] ZINC001157080475 970080841 /nfs/dbraw/zinc/08/08/41/970080841.db2.gz WQFBNGFXGHNELN-UHFFFAOYSA-N 1 2 210.668 2.335 20 0 BEADLO CCCC[C@H](C)[N@@H+]1CC[C@H](O)C(F)(F)C1 ZINC001255330631 970112595 /nfs/dbraw/zinc/11/25/95/970112595.db2.gz VNRASGOUIHTNNZ-UWVGGRQHSA-N 1 2 221.291 2.267 20 0 BEADLO CCCC[C@H](C)[N@H+]1CC[C@H](O)C(F)(F)C1 ZINC001255330631 970112598 /nfs/dbraw/zinc/11/25/98/970112598.db2.gz VNRASGOUIHTNNZ-UWVGGRQHSA-N 1 2 221.291 2.267 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1ccncn1 ZINC001242918046 970147853 /nfs/dbraw/zinc/14/78/53/970147853.db2.gz AORUCOVJBCGSFL-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO COCc1cncc(-c2cc[nH+]c3c2CCN3)c1 ZINC001242956330 970172468 /nfs/dbraw/zinc/17/24/68/970172468.db2.gz AOPDLTNBZPYLQP-UHFFFAOYSA-N 1 2 241.294 2.258 20 0 BEADLO Cc1nc(N(C)CCO)cc(C2CCCCC2)[nH+]1 ZINC001157390346 970234510 /nfs/dbraw/zinc/23/45/10/970234510.db2.gz NFDWVJMOWSVUFP-UHFFFAOYSA-N 1 2 249.358 2.261 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(F)c(C2OCCO2)c1 ZINC001243068002 970255525 /nfs/dbraw/zinc/25/55/25/970255525.db2.gz RZHLYXKVPXHFBH-UHFFFAOYSA-N 1 2 248.257 2.272 20 0 BEADLO Cn1c[nH+]cc1-c1ccnc(OC2CCC2)c1 ZINC001243069108 970259415 /nfs/dbraw/zinc/25/94/15/970259415.db2.gz AAFQNHBLIJZLMI-UHFFFAOYSA-N 1 2 229.283 2.413 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1C[C@H](F)C1 ZINC001157452661 970309870 /nfs/dbraw/zinc/30/98/70/970309870.db2.gz GZAOGGOJIYOONP-KYZUINATSA-N 1 2 210.252 2.250 20 0 BEADLO COCc1cc[nH+]c(NC[C@H]2C[C@H](F)C2)c1 ZINC001157453227 970314116 /nfs/dbraw/zinc/31/41/16/970314116.db2.gz YVEWBRKRTMQHBQ-XYPYZODXSA-N 1 2 224.279 2.388 20 0 BEADLO Cc1cc(C)c(Nc2cccnn2)c[nH+]1 ZINC001213503645 970326871 /nfs/dbraw/zinc/32/68/71/970326871.db2.gz QOJCHCWXAQZNAK-UHFFFAOYSA-N 1 2 200.245 2.232 20 0 BEADLO Cc1nnc(Nc2c[nH+]c(C)cc2C)o1 ZINC001213503457 970331397 /nfs/dbraw/zinc/33/13/97/970331397.db2.gz HJJPMCKZJRICJS-UHFFFAOYSA-N 1 2 204.233 2.133 20 0 BEADLO Cc1cc(C)c(Nc2cnc3cnccn32)c[nH+]1 ZINC001213510378 970335660 /nfs/dbraw/zinc/33/56/60/970335660.db2.gz AGNSOITUFZVEMJ-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cc1c[nH+]cc(Nc2ccnn2C2COC2)c1C ZINC001213525304 970343868 /nfs/dbraw/zinc/34/38/68/970343868.db2.gz QTCUSVWAZSDHDU-UHFFFAOYSA-N 1 2 244.298 2.210 20 0 BEADLO Cc1c[nH+]cc(Nc2ccn3cnnc3c2)c1C ZINC001213527263 970345730 /nfs/dbraw/zinc/34/57/30/970345730.db2.gz FNGRFZHWDPURED-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cc1cc(Nc2c[nH+]cc(C)c2C)n(C)n1 ZINC001213523328 970345947 /nfs/dbraw/zinc/34/59/47/970345947.db2.gz QAFCDDBEXDVFCR-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO Cc1c[nH+]cc(Nc2cc3n(n2)CCCO3)c1C ZINC001213528356 970354431 /nfs/dbraw/zinc/35/44/31/970354431.db2.gz BWGGFLUHPYCGGI-UHFFFAOYSA-N 1 2 244.298 2.421 20 0 BEADLO Cc1cnc(F)c(-c2ccn3cc(N)[nH+]c3c2)c1 ZINC001243164044 970400780 /nfs/dbraw/zinc/40/07/80/970400780.db2.gz NSELGYGHBFCKRQ-UHFFFAOYSA-N 1 2 242.257 2.426 20 0 BEADLO C[C@H](Cc1ccccc1F)[N@@H+]1CCO[C@H]2C[C@H]21 ZINC001255857301 970524550 /nfs/dbraw/zinc/52/45/50/970524550.db2.gz PYFLJPIDJYHJOC-HONMWMINSA-N 1 2 235.302 2.230 20 0 BEADLO C[C@H](Cc1ccccc1F)[N@H+]1CCO[C@H]2C[C@H]21 ZINC001255857301 970524563 /nfs/dbraw/zinc/52/45/63/970524563.db2.gz PYFLJPIDJYHJOC-HONMWMINSA-N 1 2 235.302 2.230 20 0 BEADLO CC[C@H]1C[C@@H]([N@H+](C)CC(F)F)CCO1 ZINC001170240069 970616048 /nfs/dbraw/zinc/61/60/48/970616048.db2.gz CQXPZBCHAUSCDX-IUCAKERBSA-N 1 2 207.264 2.141 20 0 BEADLO CC[C@H]1C[C@@H]([N@@H+](C)CC(F)F)CCO1 ZINC001170240069 970616059 /nfs/dbraw/zinc/61/60/59/970616059.db2.gz CQXPZBCHAUSCDX-IUCAKERBSA-N 1 2 207.264 2.141 20 0 BEADLO C/C(=C/c1ccco1)c1nnc(C[NH+](C)C)o1 ZINC001327354528 972557508 /nfs/dbraw/zinc/55/75/08/972557508.db2.gz PKAVRRXNDMMIIV-CLFYSBASSA-N 1 2 233.271 2.285 20 0 BEADLO C[NH+](C)Cc1nnc([C@H]2CCCCC2(F)F)o1 ZINC001327355159 972558087 /nfs/dbraw/zinc/55/80/87/972558087.db2.gz TVBLRVSIHRRKSX-MRVPVSSYSA-N 1 2 245.273 2.424 20 0 BEADLO Cc1c(O)cccc1C[NH+]1CC2(C1)CCCCO2 ZINC001144109425 972580950 /nfs/dbraw/zinc/58/09/50/972580950.db2.gz BNVAAWORGJODKL-UHFFFAOYSA-N 1 2 247.338 2.456 20 0 BEADLO C[C@H](OCc1c[nH+]cn1C)c1cccnc1 ZINC001222586703 972587071 /nfs/dbraw/zinc/58/70/71/972587071.db2.gz OIVOLFVSJLIHRH-JTQLQIEISA-N 1 2 217.272 2.093 20 0 BEADLO CC[C@H](C)[C@H]1CCCC[N@@H+]1Cc1nc[nH]n1 ZINC001327545231 972624870 /nfs/dbraw/zinc/62/48/70/972624870.db2.gz CZBPFXTVRGRJEA-WDEREUQCSA-N 1 2 222.336 2.205 20 0 BEADLO CC[C@H](C)[C@H]1CCCC[N@H+]1Cc1nc[nH]n1 ZINC001327545231 972624880 /nfs/dbraw/zinc/62/48/80/972624880.db2.gz CZBPFXTVRGRJEA-WDEREUQCSA-N 1 2 222.336 2.205 20 0 BEADLO Nc1[nH+]cccc1-c1ccc(F)c(CO)c1F ZINC001222695770 972634980 /nfs/dbraw/zinc/63/49/80/972634980.db2.gz BEWDRUMACQUCIR-UHFFFAOYSA-N 1 2 236.221 2.101 20 0 BEADLO Cc1cc([C@H](C)NC(=O)Cc2[nH]cc[nH+]2)c(C)o1 ZINC001327815872 972740320 /nfs/dbraw/zinc/74/03/20/972740320.db2.gz MEQDIDHXUUOJHJ-VIFPVBQESA-N 1 2 247.298 2.039 20 0 BEADLO CCc1cccc(C[N@@H+]2CCC23COC3)c1 ZINC001144323858 972763351 /nfs/dbraw/zinc/76/33/51/972763351.db2.gz RPWYCOBUMYDEBQ-UHFFFAOYSA-N 1 2 217.312 2.224 20 0 BEADLO CCc1cccc(C[N@H+]2CCC23COC3)c1 ZINC001144323858 972763372 /nfs/dbraw/zinc/76/33/72/972763372.db2.gz RPWYCOBUMYDEBQ-UHFFFAOYSA-N 1 2 217.312 2.224 20 0 BEADLO CCOC(=O)c1[nH]ccc1C[NH+]1CC(C)(C)C1 ZINC001144328765 972766912 /nfs/dbraw/zinc/76/69/12/972766912.db2.gz GIXSRKYHWFETRX-UHFFFAOYSA-N 1 2 236.315 2.033 20 0 BEADLO Cc1ccoc1CN(C)C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001327886980 972786242 /nfs/dbraw/zinc/78/62/42/972786242.db2.gz MBSHLRZPSMATLA-LLVKDONJSA-N 1 2 247.298 2.004 20 0 BEADLO COCCN(Cc1[nH+]cn2ccccc12)C(C)C ZINC001144622622 972895966 /nfs/dbraw/zinc/89/59/66/972895966.db2.gz LDBHQVHEBLHWKC-UHFFFAOYSA-N 1 2 247.342 2.191 20 0 BEADLO O[C@@H]1CC[N@H+](Cc2cc(F)c(F)cc2Cl)C1 ZINC001144721812 972970467 /nfs/dbraw/zinc/97/04/67/972970467.db2.gz DKNQRPDXCUSAFB-MRVPVSSYSA-N 1 2 247.672 2.185 20 0 BEADLO O[C@@H]1CC[N@@H+](Cc2cc(F)c(F)cc2Cl)C1 ZINC001144721812 972970491 /nfs/dbraw/zinc/97/04/91/972970491.db2.gz DKNQRPDXCUSAFB-MRVPVSSYSA-N 1 2 247.672 2.185 20 0 BEADLO Fc1ccc(C2([NH2+]Cc3nnc[nH]3)CCC2)cc1 ZINC001328393722 973016299 /nfs/dbraw/zinc/01/62/99/973016299.db2.gz JAHNDERXAMRBDI-UHFFFAOYSA-N 1 2 246.289 2.113 20 0 BEADLO CC[C@H]([NH2+]Cc1cnon1)c1ccc(F)cc1 ZINC001328393742 973018525 /nfs/dbraw/zinc/01/85/25/973018525.db2.gz JCWMEDPZJDBQSF-LBPRGKRZSA-N 1 2 235.262 2.450 20 0 BEADLO C[C@H]1C[N@H+](Cc2cnsn2)CC(C)(C)C1 ZINC000846851357 973051457 /nfs/dbraw/zinc/05/14/57/973051457.db2.gz QXMNKCWSGBDJFA-SECBINFHSA-N 1 2 225.361 2.406 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cnsn2)CC(C)(C)C1 ZINC000846851357 973051468 /nfs/dbraw/zinc/05/14/68/973051468.db2.gz QXMNKCWSGBDJFA-SECBINFHSA-N 1 2 225.361 2.406 20 0 BEADLO COC(=O)C1CC(OCc2cc(C)[nH+]c(C)c2)C1 ZINC001223422189 973062461 /nfs/dbraw/zinc/06/24/61/973062461.db2.gz UOPGOMOYYQHDIR-UHFFFAOYSA-N 1 2 249.310 2.167 20 0 BEADLO C[C@H]1C[C@H]([N@@H+]2CC[C@H](N)C(F)(F)C2)C[C@@H](C)C1 ZINC001246837636 973138033 /nfs/dbraw/zinc/13/80/33/973138033.db2.gz RHMDZYPXUBKKNV-QCNOEVLYSA-N 1 2 246.345 2.479 20 0 BEADLO C[C@H]1C[C@H]([N@H+]2CC[C@H](N)C(F)(F)C2)C[C@@H](C)C1 ZINC001246837636 973138046 /nfs/dbraw/zinc/13/80/46/973138046.db2.gz RHMDZYPXUBKKNV-QCNOEVLYSA-N 1 2 246.345 2.479 20 0 BEADLO C[NH+]1CC(OCc2cc3ccccc3o2)C1 ZINC001223647034 973217548 /nfs/dbraw/zinc/21/75/48/973217548.db2.gz IEXJXPLRHYLDQP-UHFFFAOYSA-N 1 2 217.268 2.263 20 0 BEADLO C[C@@H](C(=O)NC[C@@H]1CCCC12CC2)n1cc[nH+]c1 ZINC001329280707 973634424 /nfs/dbraw/zinc/63/44/24/973634424.db2.gz JIIFIGMWYCHGGK-RYUDHWBXSA-N 1 2 247.342 2.141 20 0 BEADLO c1cnc(C[NH2+][C@H]2CCCc3ncccc32)nc1 ZINC001329677866 973880891 /nfs/dbraw/zinc/88/08/91/973880891.db2.gz CYYBPCPHRACVTK-ZDUSSCGKSA-N 1 2 240.310 2.039 20 0 BEADLO CN(C)c1cc(N(C)Cc2ccccc2)nc[nH+]1 ZINC000585415322 973908537 /nfs/dbraw/zinc/90/85/37/973908537.db2.gz PJCRNJKKLOLAJF-UHFFFAOYSA-N 1 2 242.326 2.179 20 0 BEADLO CN(C)c1cc(N(C)Cc2ccccc2)[nH+]cn1 ZINC000585415322 973908556 /nfs/dbraw/zinc/90/85/56/973908556.db2.gz PJCRNJKKLOLAJF-UHFFFAOYSA-N 1 2 242.326 2.179 20 0 BEADLO C[C@@H]1C[C@H](C)CN(c2cc(N(C)C)[nH+]cn2)C1 ZINC000585414998 973914035 /nfs/dbraw/zinc/91/40/35/973914035.db2.gz GWZWTNOQYREQDX-PHIMTYICSA-N 1 2 234.347 2.025 20 0 BEADLO C[C@@H]1C[C@H](C)CN(c2cc(N(C)C)nc[nH+]2)C1 ZINC000585414998 973914046 /nfs/dbraw/zinc/91/40/46/973914046.db2.gz GWZWTNOQYREQDX-PHIMTYICSA-N 1 2 234.347 2.025 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1c1nnc(C[NH+](C)C)o1 ZINC001330100962 974106267 /nfs/dbraw/zinc/10/62/67/974106267.db2.gz QETGGKOVDQVKOX-JOYOIKCWSA-N 1 2 223.320 2.281 20 0 BEADLO CC(C)(C)ONC(=O)Nc1ccc2[nH+]ccn2c1 ZINC001330166800 974137895 /nfs/dbraw/zinc/13/78/95/974137895.db2.gz ILEYWPVIPWPTGH-UHFFFAOYSA-N 1 2 248.286 2.186 20 0 BEADLO CCCC[C@@H](C)N(C)C(=O)[C@H](C)n1cc[nH+]c1 ZINC001330192869 974153021 /nfs/dbraw/zinc/15/30/21/974153021.db2.gz RTHSCCMBCHSSTL-NEPJUHHUSA-N 1 2 237.347 2.481 20 0 BEADLO c1nc(C[N@@H+](CC2CC2)C2CCCCC2)n[nH]1 ZINC001330547912 974305212 /nfs/dbraw/zinc/30/52/12/974305212.db2.gz TYKXLOZKFNEGGI-UHFFFAOYSA-N 1 2 234.347 2.349 20 0 BEADLO c1nc(C[N@H+](CC2CC2)C2CCCCC2)n[nH]1 ZINC001330547912 974305224 /nfs/dbraw/zinc/30/52/24/974305224.db2.gz TYKXLOZKFNEGGI-UHFFFAOYSA-N 1 2 234.347 2.349 20 0 BEADLO CCCCOC(=O)[C@@H](C)Oc1cc[nH+]cc1 ZINC001225290839 974362596 /nfs/dbraw/zinc/36/25/96/974362596.db2.gz JWTOVJWHXADMEE-SNVBAGLBSA-N 1 2 223.272 2.192 20 0 BEADLO Cc1nc([C@H](C)[NH2+][C@H](C)[C@@H]2CC2(F)F)no1 ZINC001330621595 974364754 /nfs/dbraw/zinc/36/47/54/974364754.db2.gz LMRQLQDHSVOUEC-CHKWXVPMSA-N 1 2 231.246 2.072 20 0 BEADLO COC(=O)[C@H]1CCC[C@H](Oc2cc[nH+]cc2)C1 ZINC001225295332 974370217 /nfs/dbraw/zinc/37/02/17/974370217.db2.gz KRDHEBHMYBHFHP-JQWIXIFHSA-N 1 2 235.283 2.192 20 0 BEADLO CC1(C)C[C@H](Oc2cc[nH+]cc2)CCO1 ZINC001225296246 974372926 /nfs/dbraw/zinc/37/29/26/974372926.db2.gz SFZJZOBYFUYPBZ-LLVKDONJSA-N 1 2 207.273 2.418 20 0 BEADLO CC[NH+]1CC(Oc2cc(C)cc(OC)c2)C1 ZINC001225337813 974413984 /nfs/dbraw/zinc/41/39/84/974413984.db2.gz QHHWFZWLSHDHER-UHFFFAOYSA-N 1 2 221.300 2.087 20 0 BEADLO CC(C)C1(O)C[NH+](Cc2cccn2C2CC2)C1 ZINC001330867185 974511132 /nfs/dbraw/zinc/51/11/32/974511132.db2.gz JVPUOIPCOWUVCV-UHFFFAOYSA-N 1 2 234.343 2.026 20 0 BEADLO Cc1ccc2cccnc2c1OC1C[NH+](C)C1 ZINC001225475956 974516608 /nfs/dbraw/zinc/51/66/08/974516608.db2.gz MKKHTXQSMNIURO-UHFFFAOYSA-N 1 2 228.295 2.236 20 0 BEADLO CC1(C)C[C@@H]([N@@H+]2CCC(F)(F)[C@@H](F)C2)CO1 ZINC001172283289 974543181 /nfs/dbraw/zinc/54/31/81/974543181.db2.gz JKLGDJHLSSKIDA-BDAKNGLRSA-N 1 2 237.265 2.233 20 0 BEADLO CC1(C)C[C@@H]([N@H+]2CCC(F)(F)[C@@H](F)C2)CO1 ZINC001172283289 974543186 /nfs/dbraw/zinc/54/31/86/974543186.db2.gz JKLGDJHLSSKIDA-BDAKNGLRSA-N 1 2 237.265 2.233 20 0 BEADLO CCc1nn(C[N@H+]2CC[C@H](CC)C2)c(=S)o1 ZINC001331007906 974556622 /nfs/dbraw/zinc/55/66/22/974556622.db2.gz OIDCCRBTHIRMBQ-VIFPVBQESA-N 1 2 241.360 2.457 20 0 BEADLO CCc1nn(C[N@@H+]2CC[C@H](CC)C2)c(=S)o1 ZINC001331007906 974556630 /nfs/dbraw/zinc/55/66/30/974556630.db2.gz OIDCCRBTHIRMBQ-VIFPVBQESA-N 1 2 241.360 2.457 20 0 BEADLO C[C@]1(C2CCCCC2)CC[N@@H+]1Cc1nnc[nH]1 ZINC001331160970 974627413 /nfs/dbraw/zinc/62/74/13/974627413.db2.gz BKDQENAPWTWYCV-CYBMUJFWSA-N 1 2 234.347 2.349 20 0 BEADLO C[C@]1(C2CCCCC2)CC[N@H+]1Cc1nnc[nH]1 ZINC001331160970 974627416 /nfs/dbraw/zinc/62/74/16/974627416.db2.gz BKDQENAPWTWYCV-CYBMUJFWSA-N 1 2 234.347 2.349 20 0 BEADLO CCCCOC(=O)[C@H](C)[NH2+][C@@H](C)CCOCC ZINC001172412212 974678169 /nfs/dbraw/zinc/67/81/69/974678169.db2.gz VMDGQCLLNMOABZ-RYUDHWBXSA-N 1 2 245.363 2.123 20 0 BEADLO Fc1cccc2[nH]cc(C[NH+]3CCOCC3)c21 ZINC000258490168 974714941 /nfs/dbraw/zinc/71/49/41/974714941.db2.gz FNODUINZOZTARR-UHFFFAOYSA-N 1 2 234.274 2.139 20 0 BEADLO COC(=O)C[N@@H+](Cc1cc(C)co1)CC(C)C ZINC001331554687 974761271 /nfs/dbraw/zinc/76/12/71/974761271.db2.gz XCWDWEXKMFHMCC-UHFFFAOYSA-N 1 2 239.315 2.219 20 0 BEADLO CC(C)[NH+]1CC(Oc2noc3ccccc32)C1 ZINC001226400160 974881270 /nfs/dbraw/zinc/88/12/70/974881270.db2.gz JTZNXXOTHNOZHY-UHFFFAOYSA-N 1 2 232.283 2.299 20 0 BEADLO Clc1ccc2c(c1)C[C@H]([N@@H+]1CCC13COC3)C2 ZINC001172716999 974907233 /nfs/dbraw/zinc/90/72/33/974907233.db2.gz CUNGIIAADZUXQB-CYBMUJFWSA-N 1 2 249.741 2.282 20 0 BEADLO Clc1ccc2c(c1)C[C@H]([N@H+]1CCC13COC3)C2 ZINC001172716999 974907236 /nfs/dbraw/zinc/90/72/36/974907236.db2.gz CUNGIIAADZUXQB-CYBMUJFWSA-N 1 2 249.741 2.282 20 0 BEADLO Cc1nc([C@H](C)[NH2+]CC2=CCCC2)no1 ZINC001332126173 974966386 /nfs/dbraw/zinc/96/63/86/974966386.db2.gz XHJRBXBEIIVLIR-QMMMGPOBSA-N 1 2 207.277 2.139 20 0 BEADLO CO[C@@H]1CCC[C@H]([N@H+](C)CC(F)F)C1 ZINC001172947784 975002649 /nfs/dbraw/zinc/00/26/49/975002649.db2.gz AUMIBKWEKRPGTF-DTWKUNHWSA-N 1 2 207.264 2.141 20 0 BEADLO CO[C@@H]1CCC[C@H]([N@@H+](C)CC(F)F)C1 ZINC001172947784 975002655 /nfs/dbraw/zinc/00/26/55/975002655.db2.gz AUMIBKWEKRPGTF-DTWKUNHWSA-N 1 2 207.264 2.141 20 0 BEADLO Cc1nocc1Nc1cccn2cc[nH+]c12 ZINC001212718728 975231794 /nfs/dbraw/zinc/23/17/94/975231794.db2.gz XQONITORQHTOIV-UHFFFAOYSA-N 1 2 214.228 2.374 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1CC(C)(C)C1(C)C ZINC001332893779 975309140 /nfs/dbraw/zinc/30/91/40/975309140.db2.gz PKCDPHGVIWFASD-JTQLQIEISA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1CC(C)(C)C1(C)C ZINC001332893779 975309145 /nfs/dbraw/zinc/30/91/45/975309145.db2.gz PKCDPHGVIWFASD-JTQLQIEISA-N 1 2 249.358 2.235 20 0 BEADLO CC[NH+]1CC(Oc2ccccc2N2CCCC2)C1 ZINC001227195912 975310308 /nfs/dbraw/zinc/31/03/08/975310308.db2.gz JTFZBXVEUZTZNG-UHFFFAOYSA-N 1 2 246.354 2.370 20 0 BEADLO Cc1cc[nH+]c(C)c1OC[C@H]1COC(C)(C)O1 ZINC001227261019 975335365 /nfs/dbraw/zinc/33/53/65/975335365.db2.gz WJUIGQMWZJDZRK-NSHDSACASA-N 1 2 237.299 2.229 20 0 BEADLO COC(=O)[C@@H]1CCC[C@@H]1Oc1c(C)cc[nH+]c1C ZINC001227264460 975341205 /nfs/dbraw/zinc/34/12/05/975341205.db2.gz MPHAXQQDDDNUOS-NEPJUHHUSA-N 1 2 249.310 2.419 20 0 BEADLO CCC[C@H](C[NH2+][C@](C)(CCC)C(=O)OC)OC ZINC001332975752 975349268 /nfs/dbraw/zinc/34/92/68/975349268.db2.gz KPIOKYWZLXBGDS-DGCLKSJQSA-N 1 2 245.363 2.123 20 0 BEADLO CCn1ccc(C[N@H+](C)[C@H](C)c2ncccn2)c1 ZINC001332981992 975356044 /nfs/dbraw/zinc/35/60/44/975356044.db2.gz LXOIXVBWRIXHPE-GFCCVEGCSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1ccc(C[N@@H+](C)[C@H](C)c2ncccn2)c1 ZINC001332981992 975356049 /nfs/dbraw/zinc/35/60/49/975356049.db2.gz LXOIXVBWRIXHPE-GFCCVEGCSA-N 1 2 244.342 2.491 20 0 BEADLO CCN(C#N)CC[N@H+](CC)Cc1ccccc1F ZINC001333020147 975375121 /nfs/dbraw/zinc/37/51/21/975375121.db2.gz WYAJWOSFGKUBQS-UHFFFAOYSA-N 1 2 249.333 2.451 20 0 BEADLO CCN(C#N)CC[N@@H+](CC)Cc1ccccc1F ZINC001333020147 975375128 /nfs/dbraw/zinc/37/51/28/975375128.db2.gz WYAJWOSFGKUBQS-UHFFFAOYSA-N 1 2 249.333 2.451 20 0 BEADLO CCC/C(C)=C\c1nnc(C[NH+](C)C)o1 ZINC001333079680 975399639 /nfs/dbraw/zinc/39/96/39/975399639.db2.gz XXAIAJUCBYBNHU-CLFYSBASSA-N 1 2 209.293 2.335 20 0 BEADLO O=C1Cc2cc(-c3ccn4cc[nH+]c4c3)ccc2N1 ZINC001206202411 975411110 /nfs/dbraw/zinc/41/11/10/975411110.db2.gz DEDBOTHAASDXMU-UHFFFAOYSA-N 1 2 249.273 2.496 20 0 BEADLO Cc1ccc(O)c(OC2C[NH+](C(C)C)C2)c1 ZINC001227535529 975518965 /nfs/dbraw/zinc/51/89/65/975518965.db2.gz BJIPXYRZAGLTSF-UHFFFAOYSA-N 1 2 221.300 2.172 20 0 BEADLO c1cn2cccc(Nc3cccnc3)c2[nH+]1 ZINC001173854612 975772147 /nfs/dbraw/zinc/77/21/47/975772147.db2.gz LRILPIZCUXQGEE-UHFFFAOYSA-N 1 2 210.240 2.473 20 0 BEADLO CC[NH+]1CC(Oc2noc3cc(F)ccc32)C1 ZINC001227924643 975791491 /nfs/dbraw/zinc/79/14/91/975791491.db2.gz BPFZNRGNFAYECC-UHFFFAOYSA-N 1 2 236.246 2.050 20 0 BEADLO CC[NH+]1CC(Oc2noc3ccc(F)cc32)C1 ZINC001227999541 975844217 /nfs/dbraw/zinc/84/42/17/975844217.db2.gz FIELOLKUVIZZGP-UHFFFAOYSA-N 1 2 236.246 2.050 20 0 BEADLO CC1(C)CCC[C@H]1[C@H]1CC[N@H+](Cc2nnc[nH]2)C1 ZINC001333607417 975888433 /nfs/dbraw/zinc/88/84/33/975888433.db2.gz VJJVVEDEBMLCCP-RYUDHWBXSA-N 1 2 248.374 2.453 20 0 BEADLO CC1(C)CCC[C@H]1[C@H]1CC[N@@H+](Cc2nnc[nH]2)C1 ZINC001333607417 975888438 /nfs/dbraw/zinc/88/84/38/975888438.db2.gz VJJVVEDEBMLCCP-RYUDHWBXSA-N 1 2 248.374 2.453 20 0 BEADLO Oc1cnc(Cl)cc1Nc1cc[nH+]cc1 ZINC001173881188 975913825 /nfs/dbraw/zinc/91/38/25/975913825.db2.gz FSWMZRSVQPPHLR-UHFFFAOYSA-N 1 2 221.647 2.001 20 0 BEADLO COc1ccc(Nc2ccn3cc[nH+]c3c2)cn1 ZINC001173959119 976007422 /nfs/dbraw/zinc/00/74/22/976007422.db2.gz ATGOJUNWMAFPHG-UHFFFAOYSA-N 1 2 240.266 2.482 20 0 BEADLO CCc1nn(C[N@@H+]2C[C@H](C)[C@H](C)C2)c(=S)o1 ZINC001333789756 976077169 /nfs/dbraw/zinc/07/71/69/976077169.db2.gz FZJYTZKSPYCPLV-DTORHVGOSA-N 1 2 241.360 2.313 20 0 BEADLO CCc1nn(C[N@H+]2C[C@H](C)[C@H](C)C2)c(=S)o1 ZINC001333789756 976077192 /nfs/dbraw/zinc/07/71/92/976077192.db2.gz FZJYTZKSPYCPLV-DTORHVGOSA-N 1 2 241.360 2.313 20 0 BEADLO Cc1[nH]c2ccc(OC[C@@H]3CCO3)cc2[nH+]1 ZINC001228327977 976119632 /nfs/dbraw/zinc/11/96/32/976119632.db2.gz YORMCJCQGHSTBJ-JTQLQIEISA-N 1 2 218.256 2.039 20 0 BEADLO Cc1cc2cc(OC3C[NH+](C)C3)ccc2[nH]1 ZINC001228448130 976221413 /nfs/dbraw/zinc/22/14/13/976221413.db2.gz CHYKAQVIVGCPMD-UHFFFAOYSA-N 1 2 216.284 2.169 20 0 BEADLO Cc1cccc2ccc(OC3C[NH+](C)C3)nc12 ZINC001228629904 976387176 /nfs/dbraw/zinc/38/71/76/976387176.db2.gz XSOOGJVOPAYSEL-UHFFFAOYSA-N 1 2 228.295 2.236 20 0 BEADLO COc1cc(Nc2c(C)nn(C)c2C)cc(C)[nH+]1 ZINC001174225788 976419934 /nfs/dbraw/zinc/41/99/34/976419934.db2.gz OQVVQQXRXPYXSX-UHFFFAOYSA-N 1 2 246.314 2.493 20 0 BEADLO CC[NH+]1CC(Oc2noc3cccc(F)c32)C1 ZINC001228715772 976452793 /nfs/dbraw/zinc/45/27/93/976452793.db2.gz JEZSRKNNANRGEZ-UHFFFAOYSA-N 1 2 236.246 2.050 20 0 BEADLO C[NH+]1CC(Oc2ccc3ccoc3c2)C1 ZINC001228724668 976456712 /nfs/dbraw/zinc/45/67/12/976456712.db2.gz NJJRZZMJJOQNAB-UHFFFAOYSA-N 1 2 203.241 2.126 20 0 BEADLO Cc1cn2c(cccc2Nc2cn[nH]c2)[nH+]1 ZINC001174292310 976463602 /nfs/dbraw/zinc/46/36/02/976463602.db2.gz NNCFGHJKXNCDCH-UHFFFAOYSA-N 1 2 213.244 2.109 20 0 BEADLO CC[NH+]1CC(Oc2nccc3cccc(F)c32)C1 ZINC001228733738 976469341 /nfs/dbraw/zinc/46/93/41/976469341.db2.gz VFAWGFMMCPAUKR-UHFFFAOYSA-N 1 2 246.285 2.457 20 0 BEADLO CCC(C)(C)c1noc(C2([NH+](C)C)CC2)n1 ZINC001334421328 976509776 /nfs/dbraw/zinc/50/97/76/976509776.db2.gz GUIKQEYKRCJXSI-UHFFFAOYSA-N 1 2 223.320 2.308 20 0 BEADLO CCOc1cc[nH+]cc1Nc1cnn(C)c1C ZINC001174387878 976637434 /nfs/dbraw/zinc/63/74/34/976637434.db2.gz CLAXOXOUWXFIKE-UHFFFAOYSA-N 1 2 232.287 2.266 20 0 BEADLO Cc1n[nH]cc1Nc1[nH+]c2ccccc2n1C ZINC001174470712 976774626 /nfs/dbraw/zinc/77/46/26/976774626.db2.gz CJNYIEGGGKFOHU-UHFFFAOYSA-N 1 2 227.271 2.348 20 0 BEADLO Cc1n[nH]cc1Nc1ccc(C)[nH+]c1C ZINC001174471698 976774920 /nfs/dbraw/zinc/77/49/20/976774920.db2.gz QPXONCDGWUOBAE-UHFFFAOYSA-N 1 2 202.261 2.474 20 0 BEADLO CCN(C)c1ccc(Nc2c[nH]nc2C)c[nH+]1 ZINC001174472814 976781267 /nfs/dbraw/zinc/78/12/67/976781267.db2.gz BHWNMOAWPKAVQS-UHFFFAOYSA-N 1 2 231.303 2.313 20 0 BEADLO Cc1n[nH]cc1Nc1ccc2c(c1)[nH+]cn2C ZINC001174476488 976795973 /nfs/dbraw/zinc/79/59/73/976795973.db2.gz HPNXENNURMRHBT-UHFFFAOYSA-N 1 2 227.271 2.348 20 0 BEADLO Cc1c[nH+]c(Nc2ccc(N)cc2F)c(N)c1 ZINC001174479507 976801051 /nfs/dbraw/zinc/80/10/51/976801051.db2.gz KYIZASBFBGRQHJ-UHFFFAOYSA-N 1 2 232.262 2.437 20 0 BEADLO COCCn1cc(Nc2c[nH+]c(C)cc2C)cn1 ZINC001174550839 976851513 /nfs/dbraw/zinc/85/15/13/976851513.db2.gz NKZLREFSQKTCGM-UHFFFAOYSA-N 1 2 246.314 2.285 20 0 BEADLO CC(C)=CNc1ccc[nH+]c1N1CCOCC1 ZINC001174557692 976867362 /nfs/dbraw/zinc/86/73/62/976867362.db2.gz ORMGZXCUPYBGNQ-UHFFFAOYSA-N 1 2 233.315 2.254 20 0 BEADLO Cc1cc(O)ccc1N(C)c1[nH+]cccc1N ZINC001174559483 976873912 /nfs/dbraw/zinc/87/39/12/976873912.db2.gz MDZJCXUWRVYBLO-UHFFFAOYSA-N 1 2 229.283 2.446 20 0 BEADLO CCCCc1ccc(O)cc1OC1C[NH+](C)C1 ZINC001229573164 976897834 /nfs/dbraw/zinc/89/78/34/976897834.db2.gz SSOSWNDKPKGITB-UHFFFAOYSA-N 1 2 235.327 2.428 20 0 BEADLO Cc1cc(-n2[nH]c(=O)c3ccc(N)cc32)cc[nH+]1 ZINC001174658231 976953612 /nfs/dbraw/zinc/95/36/12/976953612.db2.gz XLGJTJLHFUJYOY-UHFFFAOYSA-N 1 2 240.266 2.017 20 0 BEADLO Cc1cc(-n2[nH]c(=O)c3cc(N)ccc32)cc[nH+]1 ZINC001174656853 976954034 /nfs/dbraw/zinc/95/40/34/976954034.db2.gz KJDOIJUTKJRQBX-UHFFFAOYSA-N 1 2 240.266 2.017 20 0 BEADLO Nc1ccc[nH+]c1Nc1ccc(O)c(F)c1 ZINC001174734172 976977113 /nfs/dbraw/zinc/97/71/13/976977113.db2.gz ZULVROCYTUJUDV-UHFFFAOYSA-N 1 2 219.219 2.252 20 0 BEADLO c1cn(-c2ccc(OC[C@H]3CCO3)cc2)c[nH+]1 ZINC001229951976 977035174 /nfs/dbraw/zinc/03/51/74/977035174.db2.gz WUAMNMHBZPESDT-CYBMUJFWSA-N 1 2 230.267 2.040 20 0 BEADLO c1cn(-c2ccc(O[C@@H]3CCOC3)cc2)c[nH+]1 ZINC001229951995 977035201 /nfs/dbraw/zinc/03/52/01/977035201.db2.gz WZVYRSTXAZUZRP-CYBMUJFWSA-N 1 2 230.267 2.040 20 0 BEADLO c1cn(-c2ccc(OC[C@@H]3CCCO3)cc2)c[nH+]1 ZINC001229952002 977035406 /nfs/dbraw/zinc/03/54/06/977035406.db2.gz XBOTWLKGCVKIPY-AWEZNQCLSA-N 1 2 244.294 2.430 20 0 BEADLO c1cn(-c2ccc(OC3CC3)cc2)c[nH+]1 ZINC001229954349 977037840 /nfs/dbraw/zinc/03/78/40/977037840.db2.gz ODTQAPKOHGJZOK-UHFFFAOYSA-N 1 2 200.241 2.414 20 0 BEADLO CC(=O)[C@@H](C)Oc1ccc(-n2cc[nH+]c2)cc1 ZINC001229954492 977040882 /nfs/dbraw/zinc/04/08/82/977040882.db2.gz PSMKVYUZBYYDRL-LLVKDONJSA-N 1 2 230.267 2.229 20 0 BEADLO CCN(C)c1ccc(Nc2cc(C)nn2C)c[nH+]1 ZINC001174819850 977070658 /nfs/dbraw/zinc/07/06/58/977070658.db2.gz FZUPIQAOYSGSDS-UHFFFAOYSA-N 1 2 245.330 2.323 20 0 BEADLO CCc1cc(N2CC[C@@H]2C)nc(CC)[nH+]1 ZINC001335518436 977114840 /nfs/dbraw/zinc/11/48/40/977114840.db2.gz CWZGEVPHQSMQLL-VIFPVBQESA-N 1 2 205.305 2.200 20 0 BEADLO CNc1cc(N[C@@H](C)c2cncc(F)c2)nc[nH+]1 ZINC001335528250 977119241 /nfs/dbraw/zinc/11/92/41/977119241.db2.gz VKKBXOOLXWCNMR-QMMMGPOBSA-N 1 2 247.277 2.226 20 0 BEADLO CNc1cc(N[C@@H](C)c2cncc(F)c2)[nH+]cn1 ZINC001335528250 977119247 /nfs/dbraw/zinc/11/92/47/977119247.db2.gz VKKBXOOLXWCNMR-QMMMGPOBSA-N 1 2 247.277 2.226 20 0 BEADLO CC(C)Cc1cc(O)ccc1OC1C[NH+](C)C1 ZINC001230209905 977128960 /nfs/dbraw/zinc/12/89/60/977128960.db2.gz BWSFKTNPUHCGKN-UHFFFAOYSA-N 1 2 235.327 2.284 20 0 BEADLO Cc1ccc(Nc2[nH+]cccc2CCO)cc1N ZINC001174935865 977177322 /nfs/dbraw/zinc/17/73/22/977177322.db2.gz ZVDHKFIXMKQOPA-UHFFFAOYSA-N 1 2 243.310 2.251 20 0 BEADLO CCN(C)c1ccc(Nc2ccncc2F)c[nH+]1 ZINC001175198571 977301696 /nfs/dbraw/zinc/30/16/96/977301696.db2.gz MYXPGVMAWBBSEL-UHFFFAOYSA-N 1 2 246.289 2.237 20 0 BEADLO CN(C)c1ccc(Nc2ccco2)c[nH+]1 ZINC001175341398 977363341 /nfs/dbraw/zinc/36/33/41/977363341.db2.gz JZBYXBIWFAIOBN-UHFFFAOYSA-N 1 2 203.245 2.484 20 0 BEADLO CCn1cnc(Nc2ccc(N(C)C)[nH+]c2)c1 ZINC001175343133 977365851 /nfs/dbraw/zinc/36/58/51/977365851.db2.gz XVDDFQWRYZECLA-UHFFFAOYSA-N 1 2 231.303 2.108 20 0 BEADLO Oc1cc2c(cc1OC1CCC1)CC[NH+]=C2 ZINC001230919092 977378793 /nfs/dbraw/zinc/37/87/93/977378793.db2.gz CBMIYXVNSSYMMG-UHFFFAOYSA-N 1 2 217.268 2.299 20 0 BEADLO CC[C@H](COc1cc2c(cc1O)C=[NH+]CC2)OC ZINC001230921811 977382695 /nfs/dbraw/zinc/38/26/95/977382695.db2.gz TZZRUJAZHXOGJW-GFCCVEGCSA-N 1 2 249.310 2.171 20 0 BEADLO CN(C)c1ccc(Nc2cnc(Cl)nc2)c[nH+]1 ZINC001175338289 977386739 /nfs/dbraw/zinc/38/67/39/977386739.db2.gz BEWVUOLNSOWUJI-UHFFFAOYSA-N 1 2 249.705 2.335 20 0 BEADLO CN(C)c1ccc(Nc2cncnc2Cl)c[nH+]1 ZINC001175338262 977387475 /nfs/dbraw/zinc/38/74/75/977387475.db2.gz AOYWUIDGXYQQGM-UHFFFAOYSA-N 1 2 249.705 2.335 20 0 BEADLO CN(C)c1ccc(Nc2cnsc2)c[nH+]1 ZINC001175340668 977387806 /nfs/dbraw/zinc/38/78/06/977387806.db2.gz BOYSLCJKNHDHMS-UHFFFAOYSA-N 1 2 220.301 2.348 20 0 BEADLO c1nnsc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175350152 977391215 /nfs/dbraw/zinc/39/12/15/977391215.db2.gz UQDLBMUTIQYVTE-UHFFFAOYSA-N 1 2 247.327 2.277 20 0 BEADLO COc1cc[nH+]c(Nc2cnc3n[nH]cc3c2)c1 ZINC001175400801 977409981 /nfs/dbraw/zinc/40/99/81/977409981.db2.gz KUIMWTIDPSFBPS-UHFFFAOYSA-N 1 2 241.254 2.105 20 0 BEADLO Nc1ccc[nH+]c1Nc1ccc2nccnc2c1 ZINC001175487354 977441762 /nfs/dbraw/zinc/44/17/62/977441762.db2.gz XMAKUCCRJZZRSO-UHFFFAOYSA-N 1 2 237.266 2.351 20 0 BEADLO Cc1cc(O)c[nH+]c1Nc1cccc(CO)c1 ZINC001175509974 977484981 /nfs/dbraw/zinc/48/49/81/977484981.db2.gz SMTHROBTBDMOTD-UHFFFAOYSA-N 1 2 230.267 2.332 20 0 BEADLO C[NH+]1CC(Oc2cnc3cc(F)ccc3c2)C1 ZINC001231136077 977505068 /nfs/dbraw/zinc/50/50/68/977505068.db2.gz SSYDSVMAIZGKKH-UHFFFAOYSA-N 1 2 232.258 2.067 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1noc(CC2CCC2)n1 ZINC001336118002 977516224 /nfs/dbraw/zinc/51/62/24/977516224.db2.gz UMPSLMCOYUAQCK-UHFFFAOYSA-N 1 2 244.298 2.365 20 0 BEADLO CCC[C@H]1CCCN1C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001336161617 977546448 /nfs/dbraw/zinc/54/64/48/977546448.db2.gz BJMSQLMHOKOXBB-NEPJUHHUSA-N 1 2 235.331 2.235 20 0 BEADLO COc1ccc(C)nc1N=C1CCC[N@H+](C)C1 ZINC001175576555 977576228 /nfs/dbraw/zinc/57/62/28/977576228.db2.gz IZTGOZOHLGAKJU-UHFFFAOYSA-N 1 2 233.315 2.030 20 0 BEADLO COc1ccc(C)nc1N=C1CCC[N@@H+](C)C1 ZINC001175576555 977576233 /nfs/dbraw/zinc/57/62/33/977576233.db2.gz IZTGOZOHLGAKJU-UHFFFAOYSA-N 1 2 233.315 2.030 20 0 BEADLO CCCOC1C[NH+](Cc2c[nH]c3cccnc23)C1 ZINC001231489302 977609669 /nfs/dbraw/zinc/60/96/69/977609669.db2.gz FHDMHPACBXNDIF-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO COc1cc(F)ccc1C[N@H+](C)CCF ZINC001231604603 977650067 /nfs/dbraw/zinc/65/00/67/977650067.db2.gz BPPKSJFWBDGHDA-UHFFFAOYSA-N 1 2 215.243 2.236 20 0 BEADLO COc1cc(F)ccc1C[N@@H+](C)CCF ZINC001231604603 977650068 /nfs/dbraw/zinc/65/00/68/977650068.db2.gz BPPKSJFWBDGHDA-UHFFFAOYSA-N 1 2 215.243 2.236 20 0 BEADLO CCc1ccc(C[N@@H+]2CCC(=O)C(C)(C)C2)nc1 ZINC001231641986 977660636 /nfs/dbraw/zinc/66/06/36/977660636.db2.gz MODBGURLUQKCKE-UHFFFAOYSA-N 1 2 246.354 2.445 20 0 BEADLO CCc1ccc(C[N@H+]2CCC(=O)C(C)(C)C2)nc1 ZINC001231641986 977660641 /nfs/dbraw/zinc/66/06/41/977660641.db2.gz MODBGURLUQKCKE-UHFFFAOYSA-N 1 2 246.354 2.445 20 0 BEADLO CCc1ccc(C[N@@H+]2CCCC(=O)CC2)nc1 ZINC001231638317 977661000 /nfs/dbraw/zinc/66/10/00/977661000.db2.gz NPKMTZLIYJCWPB-UHFFFAOYSA-N 1 2 232.327 2.199 20 0 BEADLO CCc1ccc(C[N@H+]2CCCC(=O)CC2)nc1 ZINC001231638317 977661006 /nfs/dbraw/zinc/66/10/06/977661006.db2.gz NPKMTZLIYJCWPB-UHFFFAOYSA-N 1 2 232.327 2.199 20 0 BEADLO COc1ncc(F)cc1C[N@@H+]1CCC[C@H]2C[C@H]21 ZINC001231743230 977729488 /nfs/dbraw/zinc/72/94/88/977729488.db2.gz ZTVAJMNPDLSCHK-JOYOIKCWSA-N 1 2 236.290 2.214 20 0 BEADLO COc1ncc(F)cc1C[N@H+]1CCC[C@H]2C[C@H]21 ZINC001231743230 977729496 /nfs/dbraw/zinc/72/94/96/977729496.db2.gz ZTVAJMNPDLSCHK-JOYOIKCWSA-N 1 2 236.290 2.214 20 0 BEADLO CCOc1ncccc1C[NH+]1CCSCC1 ZINC001231762225 977733868 /nfs/dbraw/zinc/73/38/68/977733868.db2.gz HDFDDOAKLLBCQC-UHFFFAOYSA-N 1 2 238.356 2.029 20 0 BEADLO CCc1ccc(N2CC[C@@H](COC)C2)[nH+]c1 ZINC001336517725 977740863 /nfs/dbraw/zinc/74/08/63/977740863.db2.gz AMDUUWDXIVEHKD-GFCCVEGCSA-N 1 2 220.316 2.117 20 0 BEADLO CSc1ccccc1C[N@@H+]1CCC12COC2 ZINC001231784682 977750043 /nfs/dbraw/zinc/75/00/43/977750043.db2.gz ADVGTUIQTZVQBS-UHFFFAOYSA-N 1 2 235.352 2.383 20 0 BEADLO CSc1ccccc1C[N@H+]1CCC12COC2 ZINC001231784682 977750054 /nfs/dbraw/zinc/75/00/54/977750054.db2.gz ADVGTUIQTZVQBS-UHFFFAOYSA-N 1 2 235.352 2.383 20 0 BEADLO CC(C)(C)Oc1ccc(C[NH+]2CC(C)(O)C2)cc1 ZINC001231803594 977758501 /nfs/dbraw/zinc/75/85/01/977758501.db2.gz CASKYEQSLKPGQS-UHFFFAOYSA-N 1 2 249.354 2.431 20 0 BEADLO CC[N@H+](Cc1ccnc(C(F)F)c1)C1COC1 ZINC001231893075 977793534 /nfs/dbraw/zinc/79/35/34/977793534.db2.gz RUXONFACQJMTIK-UHFFFAOYSA-N 1 2 242.269 2.240 20 0 BEADLO CC[N@@H+](Cc1ccnc(C(F)F)c1)C1COC1 ZINC001231893075 977793546 /nfs/dbraw/zinc/79/35/46/977793546.db2.gz RUXONFACQJMTIK-UHFFFAOYSA-N 1 2 242.269 2.240 20 0 BEADLO COc1cccc2c(C[NH+]3CC(OC)C3)c[nH]c21 ZINC001231896577 977794334 /nfs/dbraw/zinc/79/43/34/977794334.db2.gz YUKHYCPHOGGTDI-UHFFFAOYSA-N 1 2 246.310 2.007 20 0 BEADLO CC(=O)[C@@H]1CCC[N@@H+]1Cc1cnc(F)cc1C ZINC001231986381 977828053 /nfs/dbraw/zinc/82/80/53/977828053.db2.gz KUSPXHLETIORGH-LBPRGKRZSA-N 1 2 236.290 2.083 20 0 BEADLO CC(=O)[C@@H]1CCC[N@H+]1Cc1cnc(F)cc1C ZINC001231986381 977828056 /nfs/dbraw/zinc/82/80/56/977828056.db2.gz KUSPXHLETIORGH-LBPRGKRZSA-N 1 2 236.290 2.083 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccno2)cc(C)n1 ZINC001232003146 977836002 /nfs/dbraw/zinc/83/60/02/977836002.db2.gz JZKZMAICIJDKLO-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccno2)cc(C)n1 ZINC001232003146 977836007 /nfs/dbraw/zinc/83/60/07/977836007.db2.gz JZKZMAICIJDKLO-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO C/C=C\C[C@H]1CCCN(c2cc(N)nc[nH+]2)C1 ZINC001336702994 977865259 /nfs/dbraw/zinc/86/52/59/977865259.db2.gz IYVYYYCHZFMSRM-QUCGXOGASA-N 1 2 232.331 2.241 20 0 BEADLO F[C@H]1CC[N@H+](Cc2cc3ncccc3[nH]2)C1 ZINC001232062223 977872955 /nfs/dbraw/zinc/87/29/55/977872955.db2.gz YFBXLBZTRGTPKJ-VIFPVBQESA-N 1 2 219.263 2.107 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2cc3ncccc3[nH]2)C1 ZINC001232062223 977872958 /nfs/dbraw/zinc/87/29/58/977872958.db2.gz YFBXLBZTRGTPKJ-VIFPVBQESA-N 1 2 219.263 2.107 20 0 BEADLO CC1(C)COCC[N@@H+]1Cc1cc2ncccc2[nH]1 ZINC001232070647 977881984 /nfs/dbraw/zinc/88/19/84/977881984.db2.gz WVPYFZBQHUKWSF-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO CC1(C)COCC[N@H+]1Cc1cc2ncccc2[nH]1 ZINC001232070647 977881989 /nfs/dbraw/zinc/88/19/89/977881989.db2.gz WVPYFZBQHUKWSF-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO Nc1cc2c(ccn2-c2[nH]cc[nH+]2)c(F)c1 ZINC001176085627 977890092 /nfs/dbraw/zinc/89/00/92/977890092.db2.gz UMHZXJDGUKSEFX-UHFFFAOYSA-N 1 2 216.219 2.075 20 0 BEADLO Cc1ccc(NC2=CCOCC2)c(C)[nH+]1 ZINC001176138787 977912055 /nfs/dbraw/zinc/91/20/55/977912055.db2.gz FQKYNWDPUADALS-UHFFFAOYSA-N 1 2 204.273 2.415 20 0 BEADLO C[N@H+](Cc1ccns1)C1CC(F)(F)C1 ZINC001232189686 977913019 /nfs/dbraw/zinc/91/30/19/977913019.db2.gz LJIFXINKRUMECK-UHFFFAOYSA-N 1 2 218.272 2.373 20 0 BEADLO C[N@@H+](Cc1ccns1)C1CC(F)(F)C1 ZINC001232189686 977913025 /nfs/dbraw/zinc/91/30/25/977913025.db2.gz LJIFXINKRUMECK-UHFFFAOYSA-N 1 2 218.272 2.373 20 0 BEADLO c1cn2c(cccc2NC2=CCOCC2)[nH+]1 ZINC001176139122 977913594 /nfs/dbraw/zinc/91/35/94/977913594.db2.gz KZPKLRHLOKKHJZ-UHFFFAOYSA-N 1 2 215.256 2.050 20 0 BEADLO Cn1c2ccccc2[nH]c1=[NH+]C1=CCOCC1 ZINC001176139834 977917768 /nfs/dbraw/zinc/91/77/68/977917768.db2.gz ZIXFOBLJKBSHPD-UHFFFAOYSA-N 1 2 229.283 2.289 20 0 BEADLO c1c[nH+]c(N2CCCC2)c(NC2=CCOCC2)c1 ZINC001176139945 977919161 /nfs/dbraw/zinc/91/91/61/977919161.db2.gz KRSIWRLPZIOCNN-UHFFFAOYSA-N 1 2 245.326 2.398 20 0 BEADLO Cc1cc(C)c(NC2=CCOCC2)c[nH+]1 ZINC001176141367 977922160 /nfs/dbraw/zinc/92/21/60/977922160.db2.gz ZWPVBHOLMBTFBI-UHFFFAOYSA-N 1 2 204.273 2.415 20 0 BEADLO CCc1cccc(NC2=CCOCC2)[nH+]1 ZINC001176141769 977924144 /nfs/dbraw/zinc/92/41/44/977924144.db2.gz IGWGJNOOLSFFHN-UHFFFAOYSA-N 1 2 204.273 2.360 20 0 BEADLO Fc1cccc2c(C[NH+]3CCOCC3)ccnc12 ZINC001232208514 977940255 /nfs/dbraw/zinc/94/02/55/977940255.db2.gz XSNNEAIVSHBRLN-UHFFFAOYSA-N 1 2 246.285 2.206 20 0 BEADLO COc1cc[nH+]cc1Nc1ncc(F)s1 ZINC001176117235 977943135 /nfs/dbraw/zinc/94/31/35/977943135.db2.gz WWAJMLIERUUSSO-UHFFFAOYSA-N 1 2 225.248 2.429 20 0 BEADLO COc1cc[nH+]cc1-n1cc(N)c2ncccc21 ZINC001176117852 977944241 /nfs/dbraw/zinc/94/42/41/977944241.db2.gz AGUOGENAWDCAJM-UHFFFAOYSA-N 1 2 240.266 2.011 20 0 BEADLO C[N@H+](Cc1ccnc(C(C)(C)C)c1)C1COC1 ZINC001232216183 977945340 /nfs/dbraw/zinc/94/53/40/977945340.db2.gz RDDMKNVQVOTXAZ-UHFFFAOYSA-N 1 2 234.343 2.210 20 0 BEADLO C[N@@H+](Cc1ccnc(C(C)(C)C)c1)C1COC1 ZINC001232216183 977945353 /nfs/dbraw/zinc/94/53/53/977945353.db2.gz RDDMKNVQVOTXAZ-UHFFFAOYSA-N 1 2 234.343 2.210 20 0 BEADLO COc1cc[nH+]cc1Nc1nccs1 ZINC001176118397 977947113 /nfs/dbraw/zinc/94/71/13/977947113.db2.gz FDFXDPZGRFXOKV-UHFFFAOYSA-N 1 2 207.258 2.290 20 0 BEADLO COc1cc[nH+]cc1Nc1nocc1C ZINC001176119573 977949126 /nfs/dbraw/zinc/94/91/26/977949126.db2.gz UXGUUOHVVZNYTN-UHFFFAOYSA-N 1 2 205.217 2.130 20 0 BEADLO COc1cc[nH+]cc1Nc1ccc(CO)cc1F ZINC001176120455 977949327 /nfs/dbraw/zinc/94/93/27/977949327.db2.gz BDLNVHQQLXFBLE-UHFFFAOYSA-N 1 2 248.257 2.465 20 0 BEADLO COc1cc[nH+]cc1Nc1cnnc(Cl)c1 ZINC001176119521 977949981 /nfs/dbraw/zinc/94/99/81/977949981.db2.gz ROOPERRXQFKQFN-UHFFFAOYSA-N 1 2 236.662 2.277 20 0 BEADLO COc1cc[nH+]cc1-n1cnc2ccc(N)cc21 ZINC001176120604 977950716 /nfs/dbraw/zinc/95/07/16/977950716.db2.gz GOFIPTQPLYGUMD-UHFFFAOYSA-N 1 2 240.266 2.011 20 0 BEADLO COc1cc[nH+]cc1Nc1cc(C)on1 ZINC001176118815 977950819 /nfs/dbraw/zinc/95/08/19/977950819.db2.gz JHAYLYFIXANQPX-UHFFFAOYSA-N 1 2 205.217 2.130 20 0 BEADLO CCOc1cc(Nc2c[nH+]ccc2OC)no1 ZINC001176119671 977951636 /nfs/dbraw/zinc/95/16/36/977951636.db2.gz YOIASWIIXHUXDV-UHFFFAOYSA-N 1 2 235.243 2.221 20 0 BEADLO COc1cc[nH+]cc1Nc1c(C)ncnc1C ZINC001176119038 977951918 /nfs/dbraw/zinc/95/19/18/977951918.db2.gz SXTCJRQAVMMZEX-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO COc1cc[nH+]cc1Nc1c(N)cccc1OC ZINC001176124201 977956038 /nfs/dbraw/zinc/95/60/38/977956038.db2.gz KRBMDWVEAVZFKL-UHFFFAOYSA-N 1 2 245.282 2.425 20 0 BEADLO COc1cc[nH+]cc1Nc1cccn2nccc12 ZINC001176121771 977958056 /nfs/dbraw/zinc/95/80/56/977958056.db2.gz OWPCMBQCIZLWHR-UHFFFAOYSA-N 1 2 240.266 2.482 20 0 BEADLO COc1cc[nH+]cc1Nc1cc2ccccn2n1 ZINC001176121734 977958242 /nfs/dbraw/zinc/95/82/42/977958242.db2.gz MXXGNOMJXIMUEQ-UHFFFAOYSA-N 1 2 240.266 2.482 20 0 BEADLO O=c1ccc(Nc2cccc3[nH+]ccn32)c[nH]1 ZINC001176124768 977958889 /nfs/dbraw/zinc/95/88/89/977958889.db2.gz QBPOVGMNPIRIEG-UHFFFAOYSA-N 1 2 226.239 2.179 20 0 BEADLO CNc1cc(NC2CC3(CC3(F)F)C2)[nH+]cn1 ZINC001336814089 977977270 /nfs/dbraw/zinc/97/72/70/977977270.db2.gz XMCKZMOQPQMEEQ-UHFFFAOYSA-N 1 2 240.257 2.118 20 0 BEADLO COCc1cccc(C[N@@H+]2C[C@@H](F)C[C@H]2C)n1 ZINC001232252400 977979692 /nfs/dbraw/zinc/97/96/92/977979692.db2.gz VEDVXMACXXBMGM-MNOVXSKESA-N 1 2 238.306 2.160 20 0 BEADLO COCc1cccc(C[N@H+]2C[C@@H](F)C[C@H]2C)n1 ZINC001232252400 977979707 /nfs/dbraw/zinc/97/97/07/977979707.db2.gz VEDVXMACXXBMGM-MNOVXSKESA-N 1 2 238.306 2.160 20 0 BEADLO CSc1ccc(C[N@H+](C)CCF)cn1 ZINC001232330934 978003630 /nfs/dbraw/zinc/00/36/30/978003630.db2.gz JUZLMRPECILZDM-UHFFFAOYSA-N 1 2 214.309 2.205 20 0 BEADLO CSc1ccc(C[N@@H+](C)CCF)cn1 ZINC001232330934 978003643 /nfs/dbraw/zinc/00/36/43/978003643.db2.gz JUZLMRPECILZDM-UHFFFAOYSA-N 1 2 214.309 2.205 20 0 BEADLO Cc1ncc(Nc2cccc3[nH+]ccn32)cn1 ZINC001176394134 978068214 /nfs/dbraw/zinc/06/82/14/978068214.db2.gz SZGDKYQTBXJEIF-UHFFFAOYSA-N 1 2 225.255 2.176 20 0 BEADLO Cc1cccc(F)c1C[N@H+]1C[C@@H]2C[C@H]1CN2C ZINC001232484266 978133293 /nfs/dbraw/zinc/13/32/93/978133293.db2.gz ZVIHTXQCQAAWPP-RYUDHWBXSA-N 1 2 234.318 2.022 20 0 BEADLO Cc1cccc(F)c1C[N@@H+]1C[C@@H]2C[C@H]1CN2C ZINC001232484266 978133300 /nfs/dbraw/zinc/13/33/00/978133300.db2.gz ZVIHTXQCQAAWPP-RYUDHWBXSA-N 1 2 234.318 2.022 20 0 BEADLO Cc1cccc(F)c1C[N@@H+]1C[C@H](F)C[C@H]1CO ZINC001232481892 978133849 /nfs/dbraw/zinc/13/38/49/978133849.db2.gz KCVMRBKIMRAOKN-MNOVXSKESA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cccc(F)c1C[N@H+]1C[C@H](F)C[C@H]1CO ZINC001232481892 978133855 /nfs/dbraw/zinc/13/38/55/978133855.db2.gz KCVMRBKIMRAOKN-MNOVXSKESA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cccc(F)c1C[N@@H+]1C[C@@H]2C[C@H]1CO2 ZINC001232484978 978137680 /nfs/dbraw/zinc/13/76/80/978137680.db2.gz OMTJPQWIAKZGFJ-QWRGUYRKSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1cccc(F)c1C[N@H+]1C[C@@H]2C[C@H]1CO2 ZINC001232484978 978137689 /nfs/dbraw/zinc/13/76/89/978137689.db2.gz OMTJPQWIAKZGFJ-QWRGUYRKSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1ccc(C[N@@H+]2CCn3nccc3C2)cc1 ZINC001204174984 978143606 /nfs/dbraw/zinc/14/36/06/978143606.db2.gz JQBAISHNDKPLKH-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO Cc1ccc(C[N@H+]2CCn3nccc3C2)cc1 ZINC001204174984 978143610 /nfs/dbraw/zinc/14/36/10/978143610.db2.gz JQBAISHNDKPLKH-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1cccc(CF)n1 ZINC001232534446 978161023 /nfs/dbraw/zinc/16/10/23/978161023.db2.gz DISUUSDOPOGDNV-NXEZZACHSA-N 1 2 226.270 2.483 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1cccc(CF)n1 ZINC001232534446 978161030 /nfs/dbraw/zinc/16/10/30/978161030.db2.gz DISUUSDOPOGDNV-NXEZZACHSA-N 1 2 226.270 2.483 20 0 BEADLO C[C@@H]1C[NH+](Cc2cccc(CF)n2)C[C@@H](C)O1 ZINC001232531473 978161765 /nfs/dbraw/zinc/16/17/65/978161765.db2.gz BKERJDAQFTVSSK-GHMZBOCLSA-N 1 2 238.306 2.160 20 0 BEADLO Cn1cnc(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001176744377 978171541 /nfs/dbraw/zinc/17/15/41/978171541.db2.gz VSECDGAJEHEPAB-UHFFFAOYSA-N 1 2 243.314 2.159 20 0 BEADLO CNc1ccccc1C[N@@H+]1CCC(=O)C[C@@H]1C ZINC001232665990 978218984 /nfs/dbraw/zinc/21/89/84/978218984.db2.gz FLAKZRRYHKOIRQ-NSHDSACASA-N 1 2 232.327 2.282 20 0 BEADLO CNc1ccccc1C[N@H+]1CCC(=O)C[C@@H]1C ZINC001232665990 978218993 /nfs/dbraw/zinc/21/89/93/978218993.db2.gz FLAKZRRYHKOIRQ-NSHDSACASA-N 1 2 232.327 2.282 20 0 BEADLO CCc1ccc(N2CCC[C@@](O)(CC)C2)[nH+]c1 ZINC001337237745 978236377 /nfs/dbraw/zinc/23/63/77/978236377.db2.gz COTTVOMRUGNQOV-AWEZNQCLSA-N 1 2 234.343 2.385 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1cscc1C ZINC001596689766 978247148 /nfs/dbraw/zinc/24/71/48/978247148.db2.gz PPBMOTSOHDXKLQ-SNVBAGLBSA-N 1 2 224.329 2.089 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1cscc1C ZINC001596689766 978247162 /nfs/dbraw/zinc/24/71/62/978247162.db2.gz PPBMOTSOHDXKLQ-SNVBAGLBSA-N 1 2 224.329 2.089 20 0 BEADLO c1nc2cccc(C[NH+]3CC4(CCO4)C3)c2s1 ZINC001232735193 978254450 /nfs/dbraw/zinc/25/44/50/978254450.db2.gz ITMZZWPTRFCSIO-UHFFFAOYSA-N 1 2 246.335 2.271 20 0 BEADLO C[C@H]1CCC(F)(F)CN1Cc1c[nH+]cn1C ZINC001176899266 978255995 /nfs/dbraw/zinc/25/59/95/978255995.db2.gz YDHDTHOLWMFKKS-VIFPVBQESA-N 1 2 229.274 2.040 20 0 BEADLO CCCn1cnc(C[N@@H+]2CCn3cccc3C2)c1 ZINC001232798220 978287397 /nfs/dbraw/zinc/28/73/97/978287397.db2.gz BOCUXYOCWYJIFJ-UHFFFAOYSA-N 1 2 244.342 2.110 20 0 BEADLO CCCn1cnc(C[N@H+]2CCn3cccc3C2)c1 ZINC001232798220 978287414 /nfs/dbraw/zinc/28/74/14/978287414.db2.gz BOCUXYOCWYJIFJ-UHFFFAOYSA-N 1 2 244.342 2.110 20 0 BEADLO COc1cc(O)cc(C[NH+]2CC(C(F)F)C2)c1 ZINC001232808958 978297423 /nfs/dbraw/zinc/29/74/23/978297423.db2.gz KHYDIPQVOWNJMM-UHFFFAOYSA-N 1 2 243.253 2.098 20 0 BEADLO CC(C)c1oncc1NC(=O)CCc1c[nH]c[nH+]1 ZINC001337355357 978300853 /nfs/dbraw/zinc/30/08/53/978300853.db2.gz DPOCIGMXBQMMGE-UHFFFAOYSA-N 1 2 248.286 2.092 20 0 BEADLO CC(C)c1oncc1NC(=O)CCc1c[nH+]c[nH]1 ZINC001337355357 978300862 /nfs/dbraw/zinc/30/08/62/978300862.db2.gz DPOCIGMXBQMMGE-UHFFFAOYSA-N 1 2 248.286 2.092 20 0 BEADLO Cc1cc(O)cc(C[N@@H+]2CCC(=O)[C@H](C)C2)c1 ZINC001232880752 978319541 /nfs/dbraw/zinc/31/95/41/978319541.db2.gz RXFPUSOIEQXNOF-LLVKDONJSA-N 1 2 233.311 2.112 20 0 BEADLO Cc1cc(O)cc(C[N@H+]2CCC(=O)[C@H](C)C2)c1 ZINC001232880752 978319552 /nfs/dbraw/zinc/31/95/52/978319552.db2.gz RXFPUSOIEQXNOF-LLVKDONJSA-N 1 2 233.311 2.112 20 0 BEADLO CCC[C@@H]1CCCN1C(=O)Cc1[nH]c[nH+]c1C ZINC001337421735 978331647 /nfs/dbraw/zinc/33/16/47/978331647.db2.gz XJUOCICZSURRGY-LLVKDONJSA-N 1 2 235.331 2.052 20 0 BEADLO c1cn(-c2ccc(NCc3ccon3)cc2)c[nH+]1 ZINC001177387206 978343372 /nfs/dbraw/zinc/34/33/72/978343372.db2.gz BTFPOSDRGOKGPQ-UHFFFAOYSA-N 1 2 240.266 2.472 20 0 BEADLO O=C1CCC[N@H+](Cc2ccc3ncoc3c2)CC1 ZINC001232939638 978345700 /nfs/dbraw/zinc/34/57/00/978345700.db2.gz KGDVNKMNLVVPKE-UHFFFAOYSA-N 1 2 244.294 2.383 20 0 BEADLO O=C1CCC[N@@H+](Cc2ccc3ncoc3c2)CC1 ZINC001232939638 978345709 /nfs/dbraw/zinc/34/57/09/978345709.db2.gz KGDVNKMNLVVPKE-UHFFFAOYSA-N 1 2 244.294 2.383 20 0 BEADLO C[C@@H]1COCC[N@@H+]1Cc1ccc2ncoc2c1 ZINC001232937635 978348655 /nfs/dbraw/zinc/34/86/55/978348655.db2.gz FVARWFLRKPWPQR-SNVBAGLBSA-N 1 2 232.283 2.049 20 0 BEADLO C[C@@H]1COCC[N@H+]1Cc1ccc2ncoc2c1 ZINC001232937635 978348669 /nfs/dbraw/zinc/34/86/69/978348669.db2.gz FVARWFLRKPWPQR-SNVBAGLBSA-N 1 2 232.283 2.049 20 0 BEADLO FC(F)Oc1ccc(C[N@@H+]2CC[C@@H](F)C2)cn1 ZINC001232953914 978356712 /nfs/dbraw/zinc/35/67/12/978356712.db2.gz NPCPBIQRIPSNSX-SECBINFHSA-N 1 2 246.232 2.227 20 0 BEADLO FC(F)Oc1ccc(C[N@H+]2CC[C@@H](F)C2)cn1 ZINC001232953914 978356725 /nfs/dbraw/zinc/35/67/25/978356725.db2.gz NPCPBIQRIPSNSX-SECBINFHSA-N 1 2 246.232 2.227 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)CCc1ccoc1 ZINC001337508911 978381537 /nfs/dbraw/zinc/38/15/37/978381537.db2.gz JAZGLGLOYRBGCQ-UHFFFAOYSA-N 1 2 244.294 2.285 20 0 BEADLO Cc1cc(C)c(C[N@@H+]2CCCC(=O)CC2)cn1 ZINC001233005810 978395708 /nfs/dbraw/zinc/39/57/08/978395708.db2.gz SEWMVNQWNBLTGK-UHFFFAOYSA-N 1 2 232.327 2.253 20 0 BEADLO Cc1cc(C)c(C[N@H+]2CCCC(=O)CC2)cn1 ZINC001233005810 978395714 /nfs/dbraw/zinc/39/57/14/978395714.db2.gz SEWMVNQWNBLTGK-UHFFFAOYSA-N 1 2 232.327 2.253 20 0 BEADLO Cc1cc(O)c[nH+]c1Nc1ccccc1N ZINC001206307786 978396416 /nfs/dbraw/zinc/39/64/16/978396416.db2.gz CMHCEAGKGWTFDC-UHFFFAOYSA-N 1 2 215.256 2.421 20 0 BEADLO C[C@@H]1C[C@H](O)CC[N@@H+]1Cc1scnc1Cl ZINC000721941846 978433352 /nfs/dbraw/zinc/43/33/52/978433352.db2.gz JENKJWFKBHZJKK-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H]1C[C@H](O)CC[N@H+]1Cc1scnc1Cl ZINC000721941846 978433362 /nfs/dbraw/zinc/43/33/62/978433362.db2.gz JENKJWFKBHZJKK-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO Fc1cccc(CC[NH2+]Cc2ccn[nH]2)c1F ZINC001177839893 978455482 /nfs/dbraw/zinc/45/54/82/978455482.db2.gz GKWIBAAVZYPBPA-UHFFFAOYSA-N 1 2 237.253 2.020 20 0 BEADLO F[C@H]1CCC[N@H+](Cc2nc3ccccn3n2)CC1 ZINC001233069721 978458146 /nfs/dbraw/zinc/45/81/46/978458146.db2.gz YYANBDMEMUQJIC-NSHDSACASA-N 1 2 248.305 2.053 20 0 BEADLO F[C@H]1CCC[N@@H+](Cc2nc3ccccn3n2)CC1 ZINC001233069721 978458151 /nfs/dbraw/zinc/45/81/51/978458151.db2.gz YYANBDMEMUQJIC-NSHDSACASA-N 1 2 248.305 2.053 20 0 BEADLO Cc1cc(C[N@@H+]2CCCC(=O)CC2)cnc1C ZINC001233158312 978478916 /nfs/dbraw/zinc/47/89/16/978478916.db2.gz HNJPJIRQGQQVAY-UHFFFAOYSA-N 1 2 232.327 2.253 20 0 BEADLO Cc1cc(C[N@H+]2CCCC(=O)CC2)cnc1C ZINC001233158312 978478923 /nfs/dbraw/zinc/47/89/23/978478923.db2.gz HNJPJIRQGQQVAY-UHFFFAOYSA-N 1 2 232.327 2.253 20 0 BEADLO Cc1c[nH]c(=O)c(C[N@@H+]2Cc3cccnc3C2)c1 ZINC001233189257 978489898 /nfs/dbraw/zinc/48/98/98/978489898.db2.gz RXLUWXCIAQEFNC-UHFFFAOYSA-N 1 2 241.294 2.006 20 0 BEADLO Cc1c[nH]c(=O)c(C[N@H+]2Cc3cccnc3C2)c1 ZINC001233189257 978489902 /nfs/dbraw/zinc/48/99/02/978489902.db2.gz RXLUWXCIAQEFNC-UHFFFAOYSA-N 1 2 241.294 2.006 20 0 BEADLO CCCC1CCN(C(=O)CCc2[nH]cc[nH+]2)CC1 ZINC001177994590 978494257 /nfs/dbraw/zinc/49/42/57/978494257.db2.gz HQJYOSGXADXEEA-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO Cc1cc(F)cc(N2CCO[C@H](C)[C@@H]2C)[nH+]1 ZINC001337808631 978504041 /nfs/dbraw/zinc/50/40/41/978504041.db2.gz HFGIHNONMYGNHF-VHSXEESVSA-N 1 2 224.279 2.143 20 0 BEADLO Cc1cc(F)cc(N2CCO[C@H](C)[C@H]2C)[nH+]1 ZINC001337808629 978504958 /nfs/dbraw/zinc/50/49/58/978504958.db2.gz HFGIHNONMYGNHF-NXEZZACHSA-N 1 2 224.279 2.143 20 0 BEADLO CCCOC1C[NH+](Cc2cccc3c2CCO3)C1 ZINC001233276573 978523635 /nfs/dbraw/zinc/52/36/35/978523635.db2.gz RFVPIMIKJVTAEF-UHFFFAOYSA-N 1 2 247.338 2.232 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cccc3c2CCO3)CCC1=O ZINC001233274263 978526184 /nfs/dbraw/zinc/52/61/84/978526184.db2.gz JZPBGOSVXHWWLZ-LLVKDONJSA-N 1 2 245.322 2.032 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cccc3c2CCO3)CCC1=O ZINC001233274263 978526189 /nfs/dbraw/zinc/52/61/89/978526189.db2.gz JZPBGOSVXHWWLZ-LLVKDONJSA-N 1 2 245.322 2.032 20 0 BEADLO Cc1cnsc1C[N@@H+]1C[C@@H]2C[C@@H]2[C@@H](F)C1 ZINC001233318753 978549032 /nfs/dbraw/zinc/54/90/32/978549032.db2.gz PDTPEAKIDPLQDA-GUBZILKMSA-N 1 2 226.320 2.241 20 0 BEADLO Cc1cnsc1C[N@H+]1C[C@@H]2C[C@@H]2[C@@H](F)C1 ZINC001233318753 978549039 /nfs/dbraw/zinc/54/90/39/978549039.db2.gz PDTPEAKIDPLQDA-GUBZILKMSA-N 1 2 226.320 2.241 20 0 BEADLO Cc1ncc(C[N@@H+]2CCC(=O)[C@@H]3CCCC[C@H]32)o1 ZINC001233364809 978571642 /nfs/dbraw/zinc/57/16/42/978571642.db2.gz DVTZIOOGYYZOCB-CHWSQXEVSA-N 1 2 248.326 2.317 20 0 BEADLO Cc1ncc(C[N@H+]2CCC(=O)[C@@H]3CCCC[C@H]32)o1 ZINC001233364809 978571648 /nfs/dbraw/zinc/57/16/48/978571648.db2.gz DVTZIOOGYYZOCB-CHWSQXEVSA-N 1 2 248.326 2.317 20 0 BEADLO Cc1ncc(C[N@@H+]2CCC(=O)[C@H]3CCCC[C@H]32)o1 ZINC001233364811 978573575 /nfs/dbraw/zinc/57/35/75/978573575.db2.gz DVTZIOOGYYZOCB-QWHCGFSZSA-N 1 2 248.326 2.317 20 0 BEADLO Cc1ncc(C[N@H+]2CCC(=O)[C@H]3CCCC[C@H]32)o1 ZINC001233364811 978573582 /nfs/dbraw/zinc/57/35/82/978573582.db2.gz DVTZIOOGYYZOCB-QWHCGFSZSA-N 1 2 248.326 2.317 20 0 BEADLO C[N@H+](CCF)Cc1cnc2cccc(Cl)n12 ZINC001233360234 978573621 /nfs/dbraw/zinc/57/36/21/978573621.db2.gz FBRQAONBJNXFDU-UHFFFAOYSA-N 1 2 241.697 2.389 20 0 BEADLO C[N@@H+](CCF)Cc1cnc2cccc(Cl)n12 ZINC001233360234 978573624 /nfs/dbraw/zinc/57/36/24/978573624.db2.gz FBRQAONBJNXFDU-UHFFFAOYSA-N 1 2 241.697 2.389 20 0 BEADLO Cc1cc(F)cc(N2CC[C@H](C(C)(C)O)C2)[nH+]1 ZINC001337953575 978574805 /nfs/dbraw/zinc/57/48/05/978574805.db2.gz AHYVHIGRKWVWHK-JTQLQIEISA-N 1 2 238.306 2.126 20 0 BEADLO CC1(C2CC2)CCN(c2cc(N)nc[nH+]2)CC1 ZINC001337993605 978583706 /nfs/dbraw/zinc/58/37/06/978583706.db2.gz VVBMCEZEVPLLNS-UHFFFAOYSA-N 1 2 232.331 2.075 20 0 BEADLO CSc1cnc(NCc2[nH]c(C)c(C)[nH+]2)nc1 ZINC001338084675 978607489 /nfs/dbraw/zinc/60/74/89/978607489.db2.gz QHSJQUMEFDIKME-UHFFFAOYSA-N 1 2 249.343 2.151 20 0 BEADLO Cc1nc(CNc2nc(C)[nH+]c(C)c2C)[nH]c1C ZINC001338083240 978609351 /nfs/dbraw/zinc/60/93/51/978609351.db2.gz GSIWSTHZLFUGQM-UHFFFAOYSA-N 1 2 245.330 2.354 20 0 BEADLO CCc1nc(N2C[C@@H](C)OCC[C@H]2C)cc(C)[nH+]1 ZINC001338096217 978611676 /nfs/dbraw/zinc/61/16/76/978611676.db2.gz GGVUTAFTYXZZJP-VXGBXAGGSA-N 1 2 249.358 2.351 20 0 BEADLO Cc1cc(C(=O)Nc2c(C)c[nH+]cc2C)c(C)[nH]1 ZINC001338242684 978642350 /nfs/dbraw/zinc/64/23/50/978642350.db2.gz NROJICLMEVSVGZ-UHFFFAOYSA-N 1 2 243.310 2.318 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1cc(C)c(C)s1 ZINC001233664677 978665646 /nfs/dbraw/zinc/66/56/46/978665646.db2.gz KOVNCYIEKWTWPM-UHFFFAOYSA-N 1 2 241.356 2.360 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1cc(C)c(C)s1 ZINC001233664677 978665648 /nfs/dbraw/zinc/66/56/48/978665648.db2.gz KOVNCYIEKWTWPM-UHFFFAOYSA-N 1 2 241.356 2.360 20 0 BEADLO C[C@H]1CC[N@H+](Cc2ccoc2)CCC1=O ZINC001204241535 978692761 /nfs/dbraw/zinc/69/27/61/978692761.db2.gz GGZUUBZXACNCIM-JTQLQIEISA-N 1 2 207.273 2.081 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2ccoc2)CCC1=O ZINC001204241535 978692768 /nfs/dbraw/zinc/69/27/68/978692768.db2.gz GGZUUBZXACNCIM-JTQLQIEISA-N 1 2 207.273 2.081 20 0 BEADLO CC[C@H](C)C(=O)N1CCC(c2c[nH+]cn2C)CC1 ZINC001338519241 978699883 /nfs/dbraw/zinc/69/98/83/978699883.db2.gz POBZLHOIEAGDBK-NSHDSACASA-N 1 2 249.358 2.172 20 0 BEADLO CC(C)[NH+]1CC(Oc2cc(F)c(F)cc2O)C1 ZINC001233974972 978744730 /nfs/dbraw/zinc/74/47/30/978744730.db2.gz NNHWIPOVJHMCFG-UHFFFAOYSA-N 1 2 243.253 2.142 20 0 BEADLO Cl/C=C/C[NH2+]Cc1cn(-c2ccccc2)nn1 ZINC001179747279 978750867 /nfs/dbraw/zinc/75/08/67/978750867.db2.gz IVJYJAHWBWVWRM-QPJJXVBHSA-N 1 2 248.717 2.109 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)COC1(C)CCC1 ZINC001338993769 978767493 /nfs/dbraw/zinc/76/74/93/978767493.db2.gz WWGPWPCFTOZBHF-UHFFFAOYSA-N 1 2 248.326 2.018 20 0 BEADLO CC(C)Oc1cccc(OC2C[NH+](C)C2)c1 ZINC001234287837 978812617 /nfs/dbraw/zinc/81/26/17/978812617.db2.gz DWGRUGNOJANOOE-UHFFFAOYSA-N 1 2 221.300 2.167 20 0 BEADLO CC(C)CCc1c[nH+]c2c(c1)OCCN2C ZINC001249964859 978864264 /nfs/dbraw/zinc/86/42/64/978864264.db2.gz SCLYGPBZZYGLQT-UHFFFAOYSA-N 1 2 220.316 2.499 20 0 BEADLO CCc1ccc(N2CCC[C@H]2CC(=O)OC)[nH+]c1 ZINC001339629831 978881460 /nfs/dbraw/zinc/88/14/60/978881460.db2.gz VRVZIDUACZJKST-LBPRGKRZSA-N 1 2 248.326 2.176 20 0 BEADLO Cc1ccc(Nc2ccncn2)c(C)[nH+]1 ZINC001203363874 978921066 /nfs/dbraw/zinc/92/10/66/978921066.db2.gz YIIBMWCPMAJAJG-UHFFFAOYSA-N 1 2 200.245 2.232 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2ncc(F)cn2)[C@@H](C)C1 ZINC001235011790 978953507 /nfs/dbraw/zinc/95/35/07/978953507.db2.gz TVJSWZJZWLUZQW-ZJUUUORDSA-N 1 2 223.295 2.236 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2ncc(F)cn2)[C@@H](C)C1 ZINC001235011790 978953510 /nfs/dbraw/zinc/95/35/10/978953510.db2.gz TVJSWZJZWLUZQW-ZJUUUORDSA-N 1 2 223.295 2.236 20 0 BEADLO Fc1cnc(C[N@@H+]2CCCCC23CC3)nc1 ZINC001235019891 978955812 /nfs/dbraw/zinc/95/58/12/978955812.db2.gz ZQSBKNLPPQIJKW-UHFFFAOYSA-N 1 2 221.279 2.134 20 0 BEADLO Sc1ccc(CN2CCCCC23C[NH2+]C3)cc1 ZINC001235101468 978974641 /nfs/dbraw/zinc/97/46/41/978974641.db2.gz GPKLYXRQZMHHMI-UHFFFAOYSA-N 1 2 248.395 2.303 20 0 BEADLO CCc1cccc(C[N@H+](C)Cc2cncnc2)n1 ZINC001235268497 979014718 /nfs/dbraw/zinc/01/47/18/979014718.db2.gz WOMSINXKPVLGLA-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO CCc1cccc(C[N@@H+](C)Cc2cncnc2)n1 ZINC001235268497 979014728 /nfs/dbraw/zinc/01/47/28/979014728.db2.gz WOMSINXKPVLGLA-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO CC1(C)[C@@H]2C[N@@H+](Cc3ncc(Cl)cn3)C[C@@H]21 ZINC001235413138 979037308 /nfs/dbraw/zinc/03/73/08/979037308.db2.gz BTOMTTRBBIUFIO-AOOOYVTPSA-N 1 2 237.734 2.218 20 0 BEADLO CC1(C)[C@@H]2C[N@H+](Cc3ncc(Cl)cn3)C[C@@H]21 ZINC001235413138 979037311 /nfs/dbraw/zinc/03/73/11/979037311.db2.gz BTOMTTRBBIUFIO-AOOOYVTPSA-N 1 2 237.734 2.218 20 0 BEADLO C[C@H]1CCC[N@H+](Cc2ncc(Cl)cn2)C1 ZINC001235408125 979038360 /nfs/dbraw/zinc/03/83/60/979038360.db2.gz YWRWKRVKNAXHCL-VIFPVBQESA-N 1 2 225.723 2.362 20 0 BEADLO C[C@H]1CCC[N@@H+](Cc2ncc(Cl)cn2)C1 ZINC001235408125 979038366 /nfs/dbraw/zinc/03/83/66/979038366.db2.gz YWRWKRVKNAXHCL-VIFPVBQESA-N 1 2 225.723 2.362 20 0 BEADLO CO[C@H]1CC[N@H+](Cc2cncc(F)c2Cl)C1 ZINC001235488160 979052400 /nfs/dbraw/zinc/05/24/00/979052400.db2.gz IXTFVARXESFZDT-VIFPVBQESA-N 1 2 244.697 2.095 20 0 BEADLO CO[C@H]1CC[N@@H+](Cc2cncc(F)c2Cl)C1 ZINC001235488160 979052408 /nfs/dbraw/zinc/05/24/08/979052408.db2.gz IXTFVARXESFZDT-VIFPVBQESA-N 1 2 244.697 2.095 20 0 BEADLO C[N@H+](Cc1cncc(F)c1Cl)C1CC1 ZINC001235488652 979053280 /nfs/dbraw/zinc/05/32/80/979053280.db2.gz NDKYJJQEWQXHDG-UHFFFAOYSA-N 1 2 214.671 2.468 20 0 BEADLO C[N@@H+](Cc1cncc(F)c1Cl)C1CC1 ZINC001235488652 979053284 /nfs/dbraw/zinc/05/32/84/979053284.db2.gz NDKYJJQEWQXHDG-UHFFFAOYSA-N 1 2 214.671 2.468 20 0 BEADLO COCCOCc1ccc(Cn2cc[nH+]c2)cc1 ZINC001250003122 979080136 /nfs/dbraw/zinc/08/01/36/979080136.db2.gz LPIDYZQVYOZJHY-UHFFFAOYSA-N 1 2 246.310 2.094 20 0 BEADLO Cc1ncn(C)c1C[NH+]1Cc2ccccc2C1 ZINC001235539831 979081736 /nfs/dbraw/zinc/08/17/36/979081736.db2.gz CGJNGGOUVFFAOZ-UHFFFAOYSA-N 1 2 227.311 2.244 20 0 BEADLO C[C@H]1CC[N@@H+]1Cc1nc2cc(F)ccc2[nH]1 ZINC001235683911 979120210 /nfs/dbraw/zinc/12/02/10/979120210.db2.gz QMBYWEYJWKWZSX-QMMMGPOBSA-N 1 2 219.263 2.296 20 0 BEADLO C[C@H]1CC[N@H+]1Cc1nc2cc(F)ccc2[nH]1 ZINC001235683911 979120218 /nfs/dbraw/zinc/12/02/18/979120218.db2.gz QMBYWEYJWKWZSX-QMMMGPOBSA-N 1 2 219.263 2.296 20 0 BEADLO COc1ncc(C[N@@H+]2CC[C@@H]2C)cc1Cl ZINC001235696685 979123037 /nfs/dbraw/zinc/12/30/37/979123037.db2.gz JWRBCMVVYFIGAU-QMMMGPOBSA-N 1 2 226.707 2.338 20 0 BEADLO COc1ncc(C[N@H+]2CC[C@@H]2C)cc1Cl ZINC001235696685 979123046 /nfs/dbraw/zinc/12/30/46/979123046.db2.gz JWRBCMVVYFIGAU-QMMMGPOBSA-N 1 2 226.707 2.338 20 0 BEADLO COc1ncc(C[N@@H+]2CC[C@H]2C)cc1Cl ZINC001235696684 979124458 /nfs/dbraw/zinc/12/44/58/979124458.db2.gz JWRBCMVVYFIGAU-MRVPVSSYSA-N 1 2 226.707 2.338 20 0 BEADLO COc1ncc(C[N@H+]2CC[C@H]2C)cc1Cl ZINC001235696684 979124463 /nfs/dbraw/zinc/12/44/63/979124463.db2.gz JWRBCMVVYFIGAU-MRVPVSSYSA-N 1 2 226.707 2.338 20 0 BEADLO CC[C@@H](CC(C)C)C(=O)N(CC)C1C[NH+](C)C1 ZINC001181829654 979323704 /nfs/dbraw/zinc/32/37/04/979323704.db2.gz AZRBZFJAXKLHJF-LBPRGKRZSA-N 1 2 240.391 2.221 20 0 BEADLO Cc1ccc(Nc2cc(=O)[nH]c(=S)[nH]2)c(C)[nH+]1 ZINC001203368310 979323888 /nfs/dbraw/zinc/32/38/88/979323888.db2.gz XRKSZMQJNVSMBX-UHFFFAOYSA-N 1 2 248.311 2.226 20 0 BEADLO Nc1[nH+]cccc1-c1cccnc1N1CCCC1 ZINC001236122792 979399648 /nfs/dbraw/zinc/39/96/48/979399648.db2.gz HKDCOOXVOWRLSM-UHFFFAOYSA-N 1 2 240.310 2.326 20 0 BEADLO C[C@H]1c2cc(-c3ccc(N)[nH+]c3)ccc2NC1=O ZINC001236311536 979518720 /nfs/dbraw/zinc/51/87/20/979518720.db2.gz BMRQJDQZPQNVGU-QMMMGPOBSA-N 1 2 239.278 2.386 20 0 BEADLO Cc1ccc(O)cc1-c1ccc(N)[nH+]c1 ZINC001236313482 979519344 /nfs/dbraw/zinc/51/93/44/979519344.db2.gz PUJZZJQPYJNVGP-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO COC(=O)c1ccc(-c2ccc(N)[nH+]c2)c(C)c1 ZINC001236313088 979522173 /nfs/dbraw/zinc/52/21/73/979522173.db2.gz ICWHJXUOXSOVEF-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO COCOc1ccc(-c2ccc(N)[nH+]c2)cc1 ZINC001236318689 979532653 /nfs/dbraw/zinc/53/26/53/979532653.db2.gz ZYXGYPPTVGXIDV-UHFFFAOYSA-N 1 2 230.267 2.314 20 0 BEADLO CC(C)[N@@H+]1CC[C@H]1C(=O)Nc1ccsc1 ZINC001182829559 979653389 /nfs/dbraw/zinc/65/33/89/979653389.db2.gz BVFOCWDYWSHPNP-JTQLQIEISA-N 1 2 224.329 2.169 20 0 BEADLO CC(C)[N@H+]1CC[C@H]1C(=O)Nc1ccsc1 ZINC001182829559 979653393 /nfs/dbraw/zinc/65/33/93/979653393.db2.gz BVFOCWDYWSHPNP-JTQLQIEISA-N 1 2 224.329 2.169 20 0 BEADLO Cc1cn2c(cccc2-c2cncc(O)c2)[nH+]1 ZINC001236582149 979661913 /nfs/dbraw/zinc/66/19/13/979661913.db2.gz VBZISZINRAAOEJ-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCc3cnccc3C2)o1 ZINC001236590186 979671804 /nfs/dbraw/zinc/67/18/04/979671804.db2.gz VUJCUGXNPQDTLH-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCc3cnccc3C2)o1 ZINC001236590186 979671809 /nfs/dbraw/zinc/67/18/09/979671809.db2.gz VUJCUGXNPQDTLH-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO CC1(F)CC[NH+](Cc2nccnc2Cl)CC1 ZINC001236614021 979679751 /nfs/dbraw/zinc/67/97/51/979679751.db2.gz OBRADNIVFBOLOD-UHFFFAOYSA-N 1 2 243.713 2.454 20 0 BEADLO CCOc1ncc(C[N@@H+]2CC[C@H]2C)cc1F ZINC001236694004 979693813 /nfs/dbraw/zinc/69/38/13/979693813.db2.gz XIZASLLQRTVXTA-SECBINFHSA-N 1 2 224.279 2.214 20 0 BEADLO CCOc1ncc(C[N@H+]2CC[C@H]2C)cc1F ZINC001236694004 979693820 /nfs/dbraw/zinc/69/38/20/979693820.db2.gz XIZASLLQRTVXTA-SECBINFHSA-N 1 2 224.279 2.214 20 0 BEADLO Oc1cc(C[NH+]2CCSCC2)ccc1F ZINC001236699574 979696572 /nfs/dbraw/zinc/69/65/72/979696572.db2.gz QJHBAYDCEBBLMF-UHFFFAOYSA-N 1 2 227.304 2.080 20 0 BEADLO CCOc1cncc(C[N@@H+]2C[C@H](F)C[C@H]2C)c1 ZINC001236838902 979754456 /nfs/dbraw/zinc/75/44/56/979754456.db2.gz WDSCNKMZNZIRMX-ZYHUDNBSSA-N 1 2 238.306 2.413 20 0 BEADLO CCOc1cncc(C[N@H+]2C[C@H](F)C[C@H]2C)c1 ZINC001236838902 979754469 /nfs/dbraw/zinc/75/44/69/979754469.db2.gz WDSCNKMZNZIRMX-ZYHUDNBSSA-N 1 2 238.306 2.413 20 0 BEADLO c1cc(N2CCCC2)[nH+]cc1C[C@H]1CCCO1 ZINC001250105131 979781413 /nfs/dbraw/zinc/78/14/13/979781413.db2.gz XPXWCKACWJSDNB-CYBMUJFWSA-N 1 2 232.327 2.403 20 0 BEADLO COc1nc(Cl)ccc1C[N@@H+]1CC[C@H]1C ZINC001237243666 979855327 /nfs/dbraw/zinc/85/53/27/979855327.db2.gz XDTSZFBLPKYRGY-MRVPVSSYSA-N 1 2 226.707 2.338 20 0 BEADLO COc1nc(Cl)ccc1C[N@H+]1CC[C@H]1C ZINC001237243666 979855334 /nfs/dbraw/zinc/85/53/34/979855334.db2.gz XDTSZFBLPKYRGY-MRVPVSSYSA-N 1 2 226.707 2.338 20 0 BEADLO CCOC(=O)c1nc(C[N@H+](C)CC)sc1C ZINC001237225901 979856584 /nfs/dbraw/zinc/85/65/84/979856584.db2.gz AHOBVSDAPBWSBU-UHFFFAOYSA-N 1 2 242.344 2.080 20 0 BEADLO CCOC(=O)c1nc(C[N@@H+](C)CC)sc1C ZINC001237225901 979856590 /nfs/dbraw/zinc/85/65/90/979856590.db2.gz AHOBVSDAPBWSBU-UHFFFAOYSA-N 1 2 242.344 2.080 20 0 BEADLO Cc1cc(F)cc(C)c1C[NH+]1CC2(CCO2)C1 ZINC001237321115 979862393 /nfs/dbraw/zinc/86/23/93/979862393.db2.gz JJQHPHXFSPQFAD-UHFFFAOYSA-N 1 2 235.302 2.417 20 0 BEADLO CCc1cccc(C)c1C[N@H+](C)CC(=O)OC ZINC001237329137 979870579 /nfs/dbraw/zinc/87/05/79/979870579.db2.gz IRZXJAYOLKUPIC-UHFFFAOYSA-N 1 2 235.327 2.162 20 0 BEADLO CCc1cccc(C)c1C[N@@H+](C)CC(=O)OC ZINC001237329137 979870583 /nfs/dbraw/zinc/87/05/83/979870583.db2.gz IRZXJAYOLKUPIC-UHFFFAOYSA-N 1 2 235.327 2.162 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@H]1CC[C@@H]2C[C@@H]2CC1 ZINC001342724330 979879521 /nfs/dbraw/zinc/87/95/21/979879521.db2.gz FQTSUXSCPOPUSM-ZSBIGDGJSA-N 1 2 248.326 2.290 20 0 BEADLO CC(C)(CC1CCC1)C(=O)NCCn1cc[nH+]c1 ZINC001183893199 979899485 /nfs/dbraw/zinc/89/94/85/979899485.db2.gz IFIRNBJFQQWXNB-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO C[N@@H+](CCCF)Cc1ccc(O)c(F)c1F ZINC001183897980 979899573 /nfs/dbraw/zinc/89/95/73/979899573.db2.gz OMECETFEFKFIFW-UHFFFAOYSA-N 1 2 233.233 2.462 20 0 BEADLO CC(C)N(C(=O)CCc1ccc(N)[nH+]c1)C(C)C ZINC001183929236 979909443 /nfs/dbraw/zinc/90/94/43/979909443.db2.gz LZETVARGNRCCLH-UHFFFAOYSA-N 1 2 249.358 2.242 20 0 BEADLO CCn1c[nH+]cc1CN1CC[C@@](C)(F)[C@@H](F)C1 ZINC001237587709 979944244 /nfs/dbraw/zinc/94/42/44/979944244.db2.gz HWISBLPRUYOJDX-NWDGAFQWSA-N 1 2 243.301 2.175 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)C(C)(C)Cc1ccccc1 ZINC001237609831 979972990 /nfs/dbraw/zinc/97/29/90/979972990.db2.gz CHRRADSTJYITDG-UHFFFAOYSA-N 1 2 244.342 2.258 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)C(C)(C)Cc1ccccc1 ZINC001237609831 979973001 /nfs/dbraw/zinc/97/30/01/979973001.db2.gz CHRRADSTJYITDG-UHFFFAOYSA-N 1 2 244.342 2.258 20 0 BEADLO COc1cccc(F)c1C[NH2+]Cc1cc(C)n[nH]1 ZINC001343079093 980000980 /nfs/dbraw/zinc/00/09/80/980000980.db2.gz ZRAXSLUIOIIOFP-UHFFFAOYSA-N 1 2 249.289 2.156 20 0 BEADLO CCc1ncc(C[N@@H+]2CCOC3(CC3)C2)s1 ZINC001237829832 980079413 /nfs/dbraw/zinc/07/94/13/980079413.db2.gz BCGQMRWAOHBLGF-UHFFFAOYSA-N 1 2 238.356 2.070 20 0 BEADLO CCc1ncc(C[N@H+]2CCOC3(CC3)C2)s1 ZINC001237829832 980079421 /nfs/dbraw/zinc/07/94/21/980079421.db2.gz BCGQMRWAOHBLGF-UHFFFAOYSA-N 1 2 238.356 2.070 20 0 BEADLO CCOc1ccc(C[N@H+](C)C2COC2)cc1F ZINC001237956217 980118403 /nfs/dbraw/zinc/11/84/03/980118403.db2.gz LENZDZVJLLSFIC-UHFFFAOYSA-N 1 2 239.290 2.055 20 0 BEADLO CCOc1ccc(C[N@@H+](C)C2COC2)cc1F ZINC001237956217 980118407 /nfs/dbraw/zinc/11/84/07/980118407.db2.gz LENZDZVJLLSFIC-UHFFFAOYSA-N 1 2 239.290 2.055 20 0 BEADLO CC[N@H+](Cc1cncc(C2CC2)c1)C1COC1 ZINC001238191835 980217075 /nfs/dbraw/zinc/21/70/75/980217075.db2.gz ZLBJFEMPUWJNQY-UHFFFAOYSA-N 1 2 232.327 2.180 20 0 BEADLO CC[N@@H+](Cc1cncc(C2CC2)c1)C1COC1 ZINC001238191835 980217088 /nfs/dbraw/zinc/21/70/88/980217088.db2.gz ZLBJFEMPUWJNQY-UHFFFAOYSA-N 1 2 232.327 2.180 20 0 BEADLO c1ncc(C2CC2)cc1C[N@@H+]1CCOC2(CC2)C1 ZINC001238193210 980218322 /nfs/dbraw/zinc/21/83/22/980218322.db2.gz HUXLVBXFIZXQPX-UHFFFAOYSA-N 1 2 244.338 2.324 20 0 BEADLO c1ncc(C2CC2)cc1C[N@H+]1CCOC2(CC2)C1 ZINC001238193210 980218326 /nfs/dbraw/zinc/21/83/26/980218326.db2.gz HUXLVBXFIZXQPX-UHFFFAOYSA-N 1 2 244.338 2.324 20 0 BEADLO COc1cc(C[NH+]2CC=CC2)c(Cl)cn1 ZINC001238361056 980242627 /nfs/dbraw/zinc/24/26/27/980242627.db2.gz PSJPIEHPMJJACS-UHFFFAOYSA-N 1 2 224.691 2.115 20 0 BEADLO Cc1nc(Cc2c[nH+]c(C)c(N)c2)cs1 ZINC001250196416 980246675 /nfs/dbraw/zinc/24/66/75/980246675.db2.gz DUILVKMXRXXQCW-UHFFFAOYSA-N 1 2 219.313 2.328 20 0 BEADLO Cc1cnc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)c(C)c1 ZINC001238426548 980255763 /nfs/dbraw/zinc/25/57/63/980255763.db2.gz OBCUZHKJNGZOML-BETUJISGSA-N 1 2 232.327 2.062 20 0 BEADLO Cc1cnc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c(C)c1 ZINC001238426548 980255767 /nfs/dbraw/zinc/25/57/67/980255767.db2.gz OBCUZHKJNGZOML-BETUJISGSA-N 1 2 232.327 2.062 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2ccncn2)c(C)c1 ZINC001238436729 980262648 /nfs/dbraw/zinc/26/26/48/980262648.db2.gz HSJCPQKYSWAWLG-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2ccncn2)c(C)c1 ZINC001238436729 980262665 /nfs/dbraw/zinc/26/26/65/980262665.db2.gz HSJCPQKYSWAWLG-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO CC(C)Oc1cncc(C[N@H+](C)CCF)c1 ZINC001238472856 980275409 /nfs/dbraw/zinc/27/54/09/980275409.db2.gz BZTSXVXFTXRVGU-UHFFFAOYSA-N 1 2 226.295 2.270 20 0 BEADLO CC(C)Oc1cncc(C[N@@H+](C)CCF)c1 ZINC001238472856 980275417 /nfs/dbraw/zinc/27/54/17/980275417.db2.gz BZTSXVXFTXRVGU-UHFFFAOYSA-N 1 2 226.295 2.270 20 0 BEADLO CC(C)Oc1cc(C[NH+](C)C)c(F)cn1 ZINC001238793189 980316984 /nfs/dbraw/zinc/31/69/84/980316984.db2.gz FLWQFAZJEQXUPF-UHFFFAOYSA-N 1 2 212.268 2.070 20 0 BEADLO COc1cc(C)c(C)cc1C[NH+]1CC(OC)C1 ZINC001238757019 980317942 /nfs/dbraw/zinc/31/79/42/980317942.db2.gz AIRWUDSHFPXUAN-UHFFFAOYSA-N 1 2 235.327 2.143 20 0 BEADLO CCOc1cc(C)c(-c2c[nH+]cn2C)cn1 ZINC001238974796 980401330 /nfs/dbraw/zinc/40/13/30/980401330.db2.gz CYPICQIOPVSCTP-UHFFFAOYSA-N 1 2 217.272 2.189 20 0 BEADLO COc1cc(Nc2cc(C)c[nH+]c2C)ncn1 ZINC001203654071 980476906 /nfs/dbraw/zinc/47/69/06/980476906.db2.gz CBPNXCUPEOQEPC-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO c1nocc1-c1ccccc1C[NH+]1CCOCC1 ZINC001239186427 980491337 /nfs/dbraw/zinc/49/13/37/980491337.db2.gz QQXUMFJIDKMMCY-UHFFFAOYSA-N 1 2 244.294 2.174 20 0 BEADLO c1nocc1-c1cccc(C[NH+]2CCOCC2)c1 ZINC001239186611 980491430 /nfs/dbraw/zinc/49/14/30/980491430.db2.gz WTXABGJTKICKNA-UHFFFAOYSA-N 1 2 244.294 2.174 20 0 BEADLO COCCn1cnc(Nc2cc(C)c[nH+]c2C)c1 ZINC001203660454 980514615 /nfs/dbraw/zinc/51/46/15/980514615.db2.gz KOTGDWXWRMIECM-UHFFFAOYSA-N 1 2 246.314 2.285 20 0 BEADLO CNc1ccc(-c2c[nH+]c(N)c(C)c2)c(F)n1 ZINC001239420913 980570704 /nfs/dbraw/zinc/57/07/04/980570704.db2.gz KGCCLMMKOVQEAG-UHFFFAOYSA-N 1 2 232.262 2.215 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)OCC(C)(C)n1cc[nH+]c1 ZINC001345251605 980591456 /nfs/dbraw/zinc/59/14/56/980591456.db2.gz HWLUVMWMCPSRCX-GHMZBOCLSA-N 1 2 236.315 2.208 20 0 BEADLO CCN(C(=O)c1c(C)cccc1C)C1C[NH+](C)C1 ZINC001189058611 980737530 /nfs/dbraw/zinc/73/75/30/980737530.db2.gz WQMFWLBENNAXEJ-UHFFFAOYSA-N 1 2 246.354 2.080 20 0 BEADLO Cc1cc(O)cc(CCn2cc[nH+]c2)c1 ZINC001250320539 980762213 /nfs/dbraw/zinc/76/22/13/980762213.db2.gz OESUEWBUZLDFMU-UHFFFAOYSA-N 1 2 202.257 2.140 20 0 BEADLO CC[C@@H]1CCCN(C(=O)CCc2[nH+]ccn2C)C1 ZINC001346172798 980774745 /nfs/dbraw/zinc/77/47/45/980774745.db2.gz BJDMZVISKDHDDJ-GFCCVEGCSA-N 1 2 249.358 2.001 20 0 BEADLO c1cn(-c2ccc(CN3CCCO3)cc2)c[nH+]1 ZINC000273202644 980809608 /nfs/dbraw/zinc/80/96/08/980809608.db2.gz RWHIVKWSEWBYFD-UHFFFAOYSA-N 1 2 229.283 2.010 20 0 BEADLO COc1ccc(-c2cc[nH+]c3c2CCN3)cn1 ZINC001239727814 980880908 /nfs/dbraw/zinc/88/09/08/980880908.db2.gz NCHLFMOEXZYAQG-UHFFFAOYSA-N 1 2 227.267 2.120 20 0 BEADLO CNc1cc(-c2ccc(OC)nc2)cc[nH+]1 ZINC001239728434 980882001 /nfs/dbraw/zinc/88/20/01/980882001.db2.gz JOVOCHMKNMYFRC-UHFFFAOYSA-N 1 2 215.256 2.194 20 0 BEADLO NC(=O)c1ccccc1-c1ccc2[nH+]ccn2c1 ZINC001239761216 980899757 /nfs/dbraw/zinc/89/97/57/980899757.db2.gz ODNZINFKUWNWHJ-UHFFFAOYSA-N 1 2 237.262 2.100 20 0 BEADLO COc1ncccc1-c1cccc2[nH+]ccn21 ZINC001239855878 980996500 /nfs/dbraw/zinc/99/65/00/980996500.db2.gz NRDOOCIENKQVOI-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO Cc1cc[nH+]c(C)c1-c1ccc(C(N)=O)cc1 ZINC001239872023 981014121 /nfs/dbraw/zinc/01/41/21/981014121.db2.gz QUYLDTUTADLXRE-UHFFFAOYSA-N 1 2 226.279 2.464 20 0 BEADLO COC1C[NH+](Cc2cc3ccncc3s2)C1 ZINC001347395236 981066650 /nfs/dbraw/zinc/06/66/50/981066650.db2.gz OCZVDIUJQDGAJC-UHFFFAOYSA-N 1 2 234.324 2.127 20 0 BEADLO CC(C)c1ccccc1NC(=O)NC1C[NH+](C)C1 ZINC001192268213 981140149 /nfs/dbraw/zinc/14/01/49/981140149.db2.gz ZLIPBBQHZKGJIJ-UHFFFAOYSA-N 1 2 247.342 2.246 20 0 BEADLO Cc1nn(C)c(C)c1-c1ccn2cc[nH+]c2c1 ZINC001240143627 981144253 /nfs/dbraw/zinc/14/42/53/981144253.db2.gz UHKVPTMHPJGSKF-UHFFFAOYSA-N 1 2 226.283 2.352 20 0 BEADLO c1cc2c[nH+]c(-c3ccc4n[nH]cc4c3)nc2[nH]1 ZINC001240208836 981155078 /nfs/dbraw/zinc/15/50/78/981155078.db2.gz OCNWBRVSTLMKLC-UHFFFAOYSA-N 1 2 235.250 2.453 20 0 BEADLO Cc1cnc(-c2ccc3[nH+]ccn3c2)c(N)c1 ZINC001240216108 981163754 /nfs/dbraw/zinc/16/37/54/981163754.db2.gz CIVFIBXBLRMEJT-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO CCOc1cncc(-c2ccc3[nH+]ccn3c2)n1 ZINC001240215373 981164438 /nfs/dbraw/zinc/16/44/38/981164438.db2.gz QKOJOFSUSSZJKM-UHFFFAOYSA-N 1 2 240.266 2.190 20 0 BEADLO Cc1ncncc1-c1ccc2[nH+]ccn2c1 ZINC001240218026 981167601 /nfs/dbraw/zinc/16/76/01/981167601.db2.gz WSLXAOXQTKGTDI-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO Cc1cc(-c2ccc3[nH+]ccn3c2)cn(C)c1=O ZINC001240219059 981170537 /nfs/dbraw/zinc/17/05/37/981170537.db2.gz XAZOSGVGZYCALV-UHFFFAOYSA-N 1 2 239.278 2.008 20 0 BEADLO c1cn2cc(-c3cc[nH+]c4c3CCN4)ccc2n1 ZINC001240221448 981176297 /nfs/dbraw/zinc/17/62/97/981176297.db2.gz SMVDAEJBRWEVHP-UHFFFAOYSA-N 1 2 236.278 2.364 20 0 BEADLO Cc1[nH]c(CN2CCC[C@H]2C(F)F)[nH+]c1C ZINC001193022116 981226347 /nfs/dbraw/zinc/22/63/47/981226347.db2.gz OMAPZQILUVVNFL-VIFPVBQESA-N 1 2 229.274 2.256 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@@H](C)C1CCC1 ZINC001347973711 981232478 /nfs/dbraw/zinc/23/24/78/981232478.db2.gz VXXMKODBMQIMJM-JTQLQIEISA-N 1 2 236.315 2.382 20 0 BEADLO Cn1cc(-c2cc(N)c(C(F)(F)F)c[nH+]2)cn1 ZINC001240294487 981240201 /nfs/dbraw/zinc/24/02/01/981240201.db2.gz WLZCIOVMMYVULM-UHFFFAOYSA-N 1 2 242.204 2.083 20 0 BEADLO CCCCCNC(=O)Nc1c[nH+]c(C)n1C ZINC001193301457 981288117 /nfs/dbraw/zinc/28/81/17/981288117.db2.gz UXCJSLIJAFKABZ-UHFFFAOYSA-N 1 2 224.308 2.040 20 0 BEADLO CCc1ccc(N2CCC[C@H](CO)[C@H]2C)[nH+]c1 ZINC001348214938 981310142 /nfs/dbraw/zinc/31/01/42/981310142.db2.gz PJHXKYPNYZXXAI-DGCLKSJQSA-N 1 2 234.343 2.241 20 0 BEADLO Cc1cc(-c2cncnc2)c2[nH+]ccn2c1 ZINC001240375831 981326249 /nfs/dbraw/zinc/32/62/49/981326249.db2.gz SUOOEADGPJGPHT-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO c1cn(Cc2ccccc2-c2cncnc2)c[nH+]1 ZINC001240376092 981326986 /nfs/dbraw/zinc/32/69/86/981326986.db2.gz WLNZYQQLYXUNFR-UHFFFAOYSA-N 1 2 236.278 2.388 20 0 BEADLO Fc1ccc(-c2cncnc2)cc1-n1cc[nH+]c1 ZINC001240379826 981336612 /nfs/dbraw/zinc/33/66/12/981336612.db2.gz YWQIBZFNGCEVTG-UHFFFAOYSA-N 1 2 240.241 2.468 20 0 BEADLO Cc1c(-c2cn3cc[nH+]c3cc2C)cnn1C ZINC001240381754 981339969 /nfs/dbraw/zinc/33/99/69/981339969.db2.gz JNPLPBROWMVDOF-UHFFFAOYSA-N 1 2 226.283 2.352 20 0 BEADLO Cc1c(-c2ccc3[nH+]ccn3c2)cnn1C ZINC001240381275 981341781 /nfs/dbraw/zinc/34/17/81/981341781.db2.gz HUNYNNRSXAIXIA-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO c1cc2ncc(-c3ccn4cc[nH+]c4c3)cn2n1 ZINC001240429538 981380374 /nfs/dbraw/zinc/38/03/74/981380374.db2.gz QHLCZAJQLGNCKH-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO c1cc(C[NH2+][C@@H]2CCCc3ncccc32)no1 ZINC001348559088 981391184 /nfs/dbraw/zinc/39/11/84/981391184.db2.gz CGQGRXRDIBILHJ-CYBMUJFWSA-N 1 2 229.283 2.237 20 0 BEADLO COc1cnc(-c2ccn3cc[nH+]c3c2)nc1C ZINC001240495982 981415191 /nfs/dbraw/zinc/41/51/91/981415191.db2.gz FGCNFWRPYSSIDH-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO CCOc1ncccc1-c1c[nH+]c(N)c(C)c1 ZINC001240495021 981415755 /nfs/dbraw/zinc/41/57/55/981415755.db2.gz IXBVYOVFSPOHQH-UHFFFAOYSA-N 1 2 229.283 2.433 20 0 BEADLO COc1cc(-c2ccn3cc[nH+]c3c2)nc(C)n1 ZINC001240496045 981415972 /nfs/dbraw/zinc/41/59/72/981415972.db2.gz DWEMFNPBAPZZLS-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO Cc1cc(-c2ccn3cc[nH+]c3c2)ncn1 ZINC001240496948 981418911 /nfs/dbraw/zinc/41/89/11/981418911.db2.gz RKTVTNGKJNLPGJ-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO CCC1CCN(C(=O)CCc2[nH+]ccn2C)CC1 ZINC001348701271 981425192 /nfs/dbraw/zinc/42/51/92/981425192.db2.gz JZLJKLLCSFFUAS-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO CC[C@H](F)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC001348720537 981425984 /nfs/dbraw/zinc/42/59/84/981425984.db2.gz WGKUTCFCTFOMPG-JTQLQIEISA-N 1 2 235.262 2.329 20 0 BEADLO CCc1cc(-c2ccn3cc[nH+]c3c2)ncn1 ZINC001240504305 981430888 /nfs/dbraw/zinc/43/08/88/981430888.db2.gz MUSMYKAQBKGBLU-UHFFFAOYSA-N 1 2 224.267 2.354 20 0 BEADLO Cc1ncc(-c2ccn3cc[nH+]c3c2)c(C)n1 ZINC001240510594 981435764 /nfs/dbraw/zinc/43/57/64/981435764.db2.gz OGGAHLWDXCTUNG-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO CCC(C)(C)CCNC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001348751800 981436657 /nfs/dbraw/zinc/43/66/57/981436657.db2.gz BSLLXNNECPCDTO-LLVKDONJSA-N 1 2 237.347 2.387 20 0 BEADLO Cc1cc(-c2ccn3cc[nH+]c3c2)cn(C)c1=O ZINC001240511575 981437450 /nfs/dbraw/zinc/43/74/50/981437450.db2.gz ICSITMVHOPMDDV-UHFFFAOYSA-N 1 2 239.278 2.008 20 0 BEADLO CCn1nccc1-c1ccc2[nH+]ccn2c1 ZINC001240699944 981627595 /nfs/dbraw/zinc/62/75/95/981627595.db2.gz VYHRFVAXRDBWDG-UHFFFAOYSA-N 1 2 212.256 2.218 20 0 BEADLO CS[C@@H]1CC[C@H]([N@H+](C)Cc2cnsn2)C1 ZINC001349761265 981710360 /nfs/dbraw/zinc/71/03/60/981710360.db2.gz WFVAJJDAKQIHKW-VHSXEESVSA-N 1 2 243.401 2.254 20 0 BEADLO CS[C@@H]1CC[C@H]([N@@H+](C)Cc2cnsn2)C1 ZINC001349761265 981710371 /nfs/dbraw/zinc/71/03/71/981710371.db2.gz WFVAJJDAKQIHKW-VHSXEESVSA-N 1 2 243.401 2.254 20 0 BEADLO Fc1c[nH+]ccc1NC1CC2(CC2(F)F)C1 ZINC001349772916 981725332 /nfs/dbraw/zinc/72/53/32/981725332.db2.gz GYFWZBHXVSXIGZ-UHFFFAOYSA-N 1 2 228.217 2.242 20 0 BEADLO Cc1ncccc1-c1cc[nH+]c2c1CCN2 ZINC001240728313 981774039 /nfs/dbraw/zinc/77/40/39/981774039.db2.gz IETYCNSRCVIKKW-UHFFFAOYSA-N 1 2 211.268 2.420 20 0 BEADLO C[NH+](C)Cc1nnc(C2CC3(CC3(F)F)C2)o1 ZINC001349986864 981837865 /nfs/dbraw/zinc/83/78/65/981837865.db2.gz RUOBCZHCZRFYMK-UHFFFAOYSA-N 1 2 243.257 2.034 20 0 BEADLO COc1ccc(-c2c[nH+]cn2C)cc1C ZINC001240864365 981911222 /nfs/dbraw/zinc/91/12/22/981911222.db2.gz QLTXRCBNTGAQNF-UHFFFAOYSA-N 1 2 202.257 2.404 20 0 BEADLO CSc1ccc(C[N@@H+]2CC[C@]23CCOC3)o1 ZINC001350326474 981927166 /nfs/dbraw/zinc/92/71/66/981927166.db2.gz CPVNLXFRSYBNSA-GFCCVEGCSA-N 1 2 239.340 2.366 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cnn(CC(C)C)c1 ZINC001240888187 981939391 /nfs/dbraw/zinc/93/93/91/981939391.db2.gz PVBVQWGWKXXGCN-KGUOMNFLSA-N 1 2 205.305 2.415 20 0 BEADLO COCCCc1[nH+]c2ccc(F)c(F)c2n1C ZINC001250603235 981959993 /nfs/dbraw/zinc/95/99/93/981959993.db2.gz NNVAGOYXLFSPOL-UHFFFAOYSA-N 1 2 240.253 2.431 20 0 BEADLO c1cc2c(cc[nH+]c2-c2cnn3cccnc23)[nH]1 ZINC001240917799 981971885 /nfs/dbraw/zinc/97/18/85/981971885.db2.gz BYEADOLEIJDGHW-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO Cc1ccc(-c2cccc(O)c2)[nH+]c1N ZINC001240923407 981985226 /nfs/dbraw/zinc/98/52/26/981985226.db2.gz VBNBFJUCMNZBCH-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO CN(CCC(F)(F)F)Cc1c[nH+]c2n1CCC2 ZINC001350613670 982023392 /nfs/dbraw/zinc/02/33/92/982023392.db2.gz ZOKUUSDLXOTANI-UHFFFAOYSA-N 1 2 247.264 2.214 20 0 BEADLO Cc1ccc(-c2ccn3cc(N)[nH+]c3c2)cc1N ZINC001240962636 982041009 /nfs/dbraw/zinc/04/10/09/982041009.db2.gz UZTPPVFBUKITBH-UHFFFAOYSA-N 1 2 238.294 2.474 20 0 BEADLO Cc1ccccc1NC(=O)CCc1[nH+]ccn1C ZINC001350786413 982082358 /nfs/dbraw/zinc/08/23/58/982082358.db2.gz RRMGIPMMUQMYAD-UHFFFAOYSA-N 1 2 243.310 2.300 20 0 BEADLO CCC[C@H]1CCCN1C(=O)CCc1[nH+]ccn1C ZINC001350814304 982095679 /nfs/dbraw/zinc/09/56/79/982095679.db2.gz JOHMJVOUENQCEH-LBPRGKRZSA-N 1 2 249.358 2.144 20 0 BEADLO CCC[C@H](C)CCNC(=O)[C@H](C)n1cc[nH+]c1 ZINC001350847084 982100970 /nfs/dbraw/zinc/10/09/70/982100970.db2.gz GNNGOFGHKISKHK-RYUDHWBXSA-N 1 2 237.347 2.387 20 0 BEADLO O=c1[nH]cccc1-c1cc2[nH]ccc2c[nH+]1 ZINC001241102251 982209804 /nfs/dbraw/zinc/20/98/04/982209804.db2.gz XFAOBZQCSBKVSY-UHFFFAOYSA-N 1 2 211.224 2.331 20 0 BEADLO CCCCC1(C(=O)N[C@@H](C)Cn2cc[nH+]c2)CC1 ZINC001351289359 982269914 /nfs/dbraw/zinc/26/99/14/982269914.db2.gz SNKJBINQRXLHNK-LBPRGKRZSA-N 1 2 249.358 2.358 20 0 BEADLO Nc1cc(-c2ccc3ncoc3c2)cc[nH+]1 ZINC001241162305 982300716 /nfs/dbraw/zinc/30/07/16/982300716.db2.gz HLZNMENXPRSDCO-UHFFFAOYSA-N 1 2 211.224 2.472 20 0 BEADLO Nc1cc(-c2cccc3cncnc32)cc[nH+]1 ZINC001241170120 982315456 /nfs/dbraw/zinc/31/54/56/982315456.db2.gz DYOYCJLKXTYIJC-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO COCc1cc(OC)ccc1-c1cc[nH+]c(N)c1 ZINC001241175597 982321831 /nfs/dbraw/zinc/32/18/31/982321831.db2.gz GGJWKQQHNRYTIC-UHFFFAOYSA-N 1 2 244.294 2.486 20 0 BEADLO Cc1cnc2[nH]ccc2c1-c1cc[nH+]c(N)c1 ZINC001241175688 982325242 /nfs/dbraw/zinc/32/52/42/982325242.db2.gz KEYXTXVUHSVURV-UHFFFAOYSA-N 1 2 224.267 2.467 20 0 BEADLO Fc1cnccc1-c1c[nH+]c2c(c1)CCCN2 ZINC001241230251 982383193 /nfs/dbraw/zinc/38/31/93/982383193.db2.gz VAGSKDHCWPMWDN-UHFFFAOYSA-N 1 2 229.258 2.284 20 0 BEADLO Cc1nnc(C[NH2+][C@H](C)c2ccc[nH]2)s1 ZINC001352012740 982438026 /nfs/dbraw/zinc/43/80/26/982438026.db2.gz YNZWRXDYLWBXLR-SSDOTTSWSA-N 1 2 222.317 2.025 20 0 BEADLO C[C@@H](c1ccccc1)[N@@H+]1CCn2nccc2C1 ZINC001196410759 982450279 /nfs/dbraw/zinc/45/02/79/982450279.db2.gz UMQHVYOWZFGNKF-LBPRGKRZSA-N 1 2 227.311 2.460 20 0 BEADLO C[C@@H](c1ccccc1)[N@H+]1CCn2nccc2C1 ZINC001196410759 982450291 /nfs/dbraw/zinc/45/02/91/982450291.db2.gz UMQHVYOWZFGNKF-LBPRGKRZSA-N 1 2 227.311 2.460 20 0 BEADLO C[C@H]([NH2+]Cc1ncc[nH]1)c1cc2cnccc2o1 ZINC001197230196 982543751 /nfs/dbraw/zinc/54/37/51/982543751.db2.gz KONORESMODQNHP-VIFPVBQESA-N 1 2 242.282 2.402 20 0 BEADLO Cn1ncc2cccc(-c3ccc[nH+]c3N)c21 ZINC001241457262 982611354 /nfs/dbraw/zinc/61/13/54/982611354.db2.gz ZTCKIJOULZLJHS-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO OCc1cccc(-c2ccn3cc[nH+]c3c2)c1 ZINC001241508169 982662879 /nfs/dbraw/zinc/66/28/79/982662879.db2.gz BGZRMTVVQDIVRU-UHFFFAOYSA-N 1 2 224.263 2.494 20 0 BEADLO OCc1cccc(-c2ccc3[nH+]ccn3c2)c1 ZINC001241509701 982667248 /nfs/dbraw/zinc/66/72/48/982667248.db2.gz PLRVNJSECRFXMA-UHFFFAOYSA-N 1 2 224.263 2.494 20 0 BEADLO CNc1cc(-c2cccc(CO)c2)cc[nH+]1 ZINC001241511080 982671494 /nfs/dbraw/zinc/67/14/94/982671494.db2.gz MTIPSUWYPBHESR-UHFFFAOYSA-N 1 2 214.268 2.283 20 0 BEADLO CC[C@H](C)CNC(=S)Nc1cc[nH+]cc1C ZINC001200243426 982737645 /nfs/dbraw/zinc/73/76/45/982737645.db2.gz ZLNMXOUOTDGFCS-VIFPVBQESA-N 1 2 237.372 2.144 20 0 BEADLO Cc1cnc(=S)n(C[NH+]2CCC(F)CC2)c1 ZINC001353196771 982761811 /nfs/dbraw/zinc/76/18/11/982761811.db2.gz QXBIJTPBDKQBSM-UHFFFAOYSA-N 1 2 241.335 2.312 20 0 BEADLO OCc1ccc(-c2ccn3cc[nH+]c3c2)cc1 ZINC001241557446 982779692 /nfs/dbraw/zinc/77/96/92/982779692.db2.gz BBUSPVYYPBTDTR-UHFFFAOYSA-N 1 2 224.263 2.494 20 0 BEADLO CNc1cc(-c2ccc(CO)cc2)cc[nH+]1 ZINC001241559212 982786931 /nfs/dbraw/zinc/78/69/31/982786931.db2.gz ONVLYFLFGGUFSP-UHFFFAOYSA-N 1 2 214.268 2.283 20 0 BEADLO Oc1ccc2c(c1)CC[N@@H+](Cc1ccns1)C2 ZINC001198827773 982839144 /nfs/dbraw/zinc/83/91/44/982839144.db2.gz FZWFUYPEMAAPCA-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO Oc1ccc2c(c1)CC[N@H+](Cc1ccns1)C2 ZINC001198827773 982839145 /nfs/dbraw/zinc/83/91/45/982839145.db2.gz FZWFUYPEMAAPCA-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO Nc1cn2ccc(-c3cccc4c[nH]nc43)cc2[nH+]1 ZINC001241621585 982856000 /nfs/dbraw/zinc/85/60/00/982856000.db2.gz QKGIHGRXNKLXGM-UHFFFAOYSA-N 1 2 249.277 2.460 20 0 BEADLO CCOc1ccc(-c2cc[nH+]c(N)c2)cn1 ZINC001241704105 982963106 /nfs/dbraw/zinc/96/31/06/982963106.db2.gz QPJGHCBYOICBEP-UHFFFAOYSA-N 1 2 215.256 2.125 20 0 BEADLO CCCCNC(=S)Nc1cccc2[nH+]ccn21 ZINC001200444750 982996917 /nfs/dbraw/zinc/99/69/17/982996917.db2.gz OJKKFFIPIQWFPZ-UHFFFAOYSA-N 1 2 248.355 2.421 20 0 BEADLO COC(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000082345968 983028407 /nfs/dbraw/zinc/02/84/07/983028407.db2.gz QVSKGRBSJWALRF-UHFFFAOYSA-N 1 2 217.228 2.051 20 0 BEADLO Cc1cc(NC(=S)Nc2cccnc2)cc[nH+]1 ZINC001199885751 983040754 /nfs/dbraw/zinc/04/07/54/983040754.db2.gz CSSAMPSWVKKYDY-UHFFFAOYSA-N 1 2 244.323 2.016 20 0 BEADLO Cc1cc(-c2ccc(F)c(CO)c2)c[nH+]c1N ZINC001241790288 983051438 /nfs/dbraw/zinc/05/14/38/983051438.db2.gz ZEKLMUNZSDNPBO-UHFFFAOYSA-N 1 2 232.258 2.271 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H]2CC23CCCC3)[nH+]c1C ZINC001353888233 983053676 /nfs/dbraw/zinc/05/36/76/983053676.db2.gz UHSICIDRCXAIKJ-NSHDSACASA-N 1 2 247.342 2.223 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CC[C@@H]1C(C)(C)C ZINC001353979580 983107118 /nfs/dbraw/zinc/10/71/18/983107118.db2.gz VPEATUXGFXNESD-ZYHUDNBSSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CC[C@@H]1C(C)(C)C ZINC001353979580 983107126 /nfs/dbraw/zinc/10/71/26/983107126.db2.gz VPEATUXGFXNESD-ZYHUDNBSSA-N 1 2 249.358 2.235 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@@H](CCO)C2)[nH+]1 ZINC001354102462 983155893 /nfs/dbraw/zinc/15/58/93/983155893.db2.gz QZFIPJYSAHBCRM-NSHDSACASA-N 1 2 238.306 2.128 20 0 BEADLO CC(=O)c1ncccc1Nc1ccc(N)[nH+]c1 ZINC001201279459 983156686 /nfs/dbraw/zinc/15/66/86/983156686.db2.gz WIUGLIKVTLCZHV-UHFFFAOYSA-N 1 2 228.255 2.005 20 0 BEADLO CC(=O)c1ccc(Nc2ccc(N)[nH+]c2)cc1O ZINC001201286209 983162886 /nfs/dbraw/zinc/16/28/86/983162886.db2.gz ZCSIBXIFMPIIKO-UHFFFAOYSA-N 1 2 243.266 2.316 20 0 BEADLO C[C@@H](O)c1ccc(Nc2ccc(N)[nH+]c2)cc1 ZINC001201287092 983165559 /nfs/dbraw/zinc/16/55/59/983165559.db2.gz SRDGROSKBSEDBP-SECBINFHSA-N 1 2 229.283 2.461 20 0 BEADLO CN(c1ccc(N)[nH+]c1)c1ccccc1N ZINC001201287187 983166950 /nfs/dbraw/zinc/16/69/50/983166950.db2.gz YGVCSKVHTJMPTI-UHFFFAOYSA-N 1 2 214.272 2.014 20 0 BEADLO Cn1cc2cccc(Nc3ccc(N)[nH+]c3)c2n1 ZINC001201287174 983167169 /nfs/dbraw/zinc/16/71/69/983167169.db2.gz XMFSTZMYTWAPTF-UHFFFAOYSA-N 1 2 239.282 2.294 20 0 BEADLO C[C@@H](O)c1ccccc1Nc1ccc(N)[nH+]c1 ZINC001201292019 983168095 /nfs/dbraw/zinc/16/80/95/983168095.db2.gz UIZSOCKJQJXAFE-SECBINFHSA-N 1 2 229.283 2.461 20 0 BEADLO Nc1ccc(N2CCCc3cccc(N)c32)c[nH+]1 ZINC001201291994 983168665 /nfs/dbraw/zinc/16/86/65/983168665.db2.gz SHPHXNMXZAXMLB-UHFFFAOYSA-N 1 2 240.310 2.330 20 0 BEADLO COc1cc(O)ccc1Nc1ccc(N)[nH+]c1 ZINC001201291178 983170215 /nfs/dbraw/zinc/17/02/15/983170215.db2.gz DPANWJXRCLMPLV-UHFFFAOYSA-N 1 2 231.255 2.122 20 0 BEADLO Nc1ccc(Nc2ccc(F)cc2CO)c[nH+]1 ZINC001201292560 983171855 /nfs/dbraw/zinc/17/18/55/983171855.db2.gz ZZKHQUYIGFRLQJ-UHFFFAOYSA-N 1 2 233.246 2.039 20 0 BEADLO Nc1ccc(Nc2nccnc2C2CC2)c[nH+]1 ZINC001201273027 983175434 /nfs/dbraw/zinc/17/54/34/983175434.db2.gz ZBWZRNUCBZCQFN-UHFFFAOYSA-N 1 2 227.271 2.075 20 0 BEADLO CC(C)(C)n1cc(Nc2ccc(N)[nH+]c2)cn1 ZINC001201276347 983176095 /nfs/dbraw/zinc/17/60/95/983176095.db2.gz UNSGOSZDNNYUIM-UHFFFAOYSA-N 1 2 231.303 2.359 20 0 BEADLO Nc1ccc(Nc2nc(F)c(F)cc2F)c[nH+]1 ZINC001201276044 983176135 /nfs/dbraw/zinc/17/61/35/983176135.db2.gz PFHMEZYMQTYWCZ-UHFFFAOYSA-N 1 2 240.188 2.220 20 0 BEADLO Nc1ccc(Nc2ncc(Cl)cc2O)c[nH+]1 ZINC001201275994 983176261 /nfs/dbraw/zinc/17/62/61/983176261.db2.gz NXFZWRWPCVTAGF-UHFFFAOYSA-N 1 2 236.662 2.161 20 0 BEADLO Cc1ncc(Nc2ccc(N)[nH+]c2)c(Cl)n1 ZINC001201275443 983176465 /nfs/dbraw/zinc/17/64/65/983176465.db2.gz FRLQLETZTZUVLC-UHFFFAOYSA-N 1 2 235.678 2.159 20 0 BEADLO CC(=O)c1ccncc1Nc1ccc(N)[nH+]c1 ZINC001201275708 983176663 /nfs/dbraw/zinc/17/66/63/983176663.db2.gz JFOWDDPAYBSIBQ-UHFFFAOYSA-N 1 2 228.255 2.005 20 0 BEADLO COc1cc(C)c(Nc2ccc(N)[nH+]c2)cn1 ZINC001201275606 983177318 /nfs/dbraw/zinc/17/73/18/983177318.db2.gz GWGFUBIKSFNTDP-UHFFFAOYSA-N 1 2 230.271 2.119 20 0 BEADLO COc1ccc(C)nc1Nc1ccc(N)[nH+]c1 ZINC001201278360 983177991 /nfs/dbraw/zinc/17/79/91/983177991.db2.gz IDJLXQZUHJWGKV-UHFFFAOYSA-N 1 2 230.271 2.119 20 0 BEADLO Nc1ccc(Nc2ccn3ccnc3c2)c[nH+]1 ZINC001201278852 983178237 /nfs/dbraw/zinc/17/82/37/983178237.db2.gz IADHTTCMALTCKK-UHFFFAOYSA-N 1 2 225.255 2.055 20 0 BEADLO Nc1ccc(Nc2ncccc2Cl)c[nH+]1 ZINC001201278528 983178969 /nfs/dbraw/zinc/17/89/69/983178969.db2.gz KMONXSKTLCGNOC-UHFFFAOYSA-N 1 2 220.663 2.456 20 0 BEADLO Cc1cc2ccc(N)cc2n1-c1ccc(N)[nH+]c1 ZINC001201295810 983182583 /nfs/dbraw/zinc/18/25/83/983182583.db2.gz SBLRUIALHCMYPH-UHFFFAOYSA-N 1 2 238.294 2.498 20 0 BEADLO Cc1cc(-c2[nH]cc[nH+]2)ccc1N1CCOCC1 ZINC001242017282 983217418 /nfs/dbraw/zinc/21/74/18/983217418.db2.gz HLHZCMINEZPJED-UHFFFAOYSA-N 1 2 243.310 2.222 20 0 BEADLO Cc1cn2cc(NC(=S)NC3CC3)ccc2[nH+]1 ZINC001200622152 983267926 /nfs/dbraw/zinc/26/79/26/983267926.db2.gz YOINFUWLVMZEKC-UHFFFAOYSA-N 1 2 246.339 2.092 20 0 BEADLO CCC[C@@H](C)C[N@@H+]1C[C@H](F)C[C@H]1C(=O)OC ZINC001201538492 983295209 /nfs/dbraw/zinc/29/52/09/983295209.db2.gz HECTYQGCCAZPMW-MXWKQRLJSA-N 1 2 231.311 2.008 20 0 BEADLO CSc1ccnc(-c2c[nH+]c(N)cc2C)n1 ZINC001242070628 983303892 /nfs/dbraw/zinc/30/38/92/983303892.db2.gz GLKXCZIWFQJRBA-UHFFFAOYSA-N 1 2 232.312 2.151 20 0 BEADLO Fc1cncc(F)c1C[N@@H+]1CCCSCC1 ZINC001354459064 983307462 /nfs/dbraw/zinc/30/74/62/983307462.db2.gz BZENESVLQMFROO-UHFFFAOYSA-N 1 2 244.310 2.299 20 0 BEADLO Fc1cncc(F)c1C[N@H+]1CCCSCC1 ZINC001354459064 983307468 /nfs/dbraw/zinc/30/74/68/983307468.db2.gz BZENESVLQMFROO-UHFFFAOYSA-N 1 2 244.310 2.299 20 0 BEADLO Cn1nc(C(F)(F)F)cc1C[N@@H+]1CC[C@H]2C[C@H]21 ZINC001354461837 983309256 /nfs/dbraw/zinc/30/92/56/983309256.db2.gz ZVGPEDNJRIRYCK-IONNQARKSA-N 1 2 245.248 2.033 20 0 BEADLO Cn1nc(C(F)(F)F)cc1C[N@H+]1CC[C@H]2C[C@H]21 ZINC001354461837 983309259 /nfs/dbraw/zinc/30/92/59/983309259.db2.gz ZVGPEDNJRIRYCK-IONNQARKSA-N 1 2 245.248 2.033 20 0 BEADLO CCCc1ccnc(-c2c[nH+]c(N)cc2C)n1 ZINC001242072835 983311261 /nfs/dbraw/zinc/31/12/61/983311261.db2.gz RKNFDIQAEWPDMJ-UHFFFAOYSA-N 1 2 228.299 2.382 20 0 BEADLO Cc1cc2ncnc(-c3c[nH+]c(N)cc3C)c2[nH]1 ZINC001242073060 983311641 /nfs/dbraw/zinc/31/16/41/983311641.db2.gz VOVXZVXJDRAJOT-UHFFFAOYSA-N 1 2 239.282 2.219 20 0 BEADLO C=Cc1cnc(-c2c[nH+]c(N)cc2C)nc1 ZINC001242078159 983325579 /nfs/dbraw/zinc/32/55/79/983325579.db2.gz CZVFWGBZOQMKOF-UHFFFAOYSA-N 1 2 212.256 2.072 20 0 BEADLO Cc1cc(-c2cccc(N)[nH+]2)ccc1O ZINC001242099194 983341285 /nfs/dbraw/zinc/34/12/85/983341285.db2.gz VIOZQLGGBFSCPA-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO Cc1noc(C)c1-c1cc(N(C)C)cc[nH+]1 ZINC001242103751 983346326 /nfs/dbraw/zinc/34/63/26/983346326.db2.gz HZNCGYIIGDGZAY-UHFFFAOYSA-N 1 2 217.272 2.419 20 0 BEADLO CCCC[C@@H](O)CNc1[nH+]cccc1OC ZINC001252079761 983383448 /nfs/dbraw/zinc/38/34/48/983383448.db2.gz QWFOWYJGADUFJT-SNVBAGLBSA-N 1 2 224.304 2.053 20 0 BEADLO c1ccc(CCC[NH+]2CC(N3CCCC3)C2)cc1 ZINC001201664216 983406779 /nfs/dbraw/zinc/40/67/79/983406779.db2.gz XECURKOPPUSZKK-UHFFFAOYSA-N 1 2 244.382 2.399 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(OCC2CC2)nc1 ZINC001242214873 983408011 /nfs/dbraw/zinc/40/80/11/983408011.db2.gz UWNWLUKQRRRVPA-UHFFFAOYSA-N 1 2 229.283 2.271 20 0 BEADLO C[C@H](Nc1cc(N(C)C)nc[nH+]1)c1cscn1 ZINC001355320358 983470518 /nfs/dbraw/zinc/47/05/18/983470518.db2.gz DAKLIJPDDDHHBW-QMMMGPOBSA-N 1 2 249.343 2.172 20 0 BEADLO C[C@H](Nc1cc(N(C)C)[nH+]cn1)c1cscn1 ZINC001355320358 983470529 /nfs/dbraw/zinc/47/05/29/983470529.db2.gz DAKLIJPDDDHHBW-QMMMGPOBSA-N 1 2 249.343 2.172 20 0 BEADLO CC(C)(C)CC[NH+]1CC(O)(C(F)(F)F)C1 ZINC001202065000 983543379 /nfs/dbraw/zinc/54/33/79/983543379.db2.gz GFZQHNKVBNBVBC-UHFFFAOYSA-N 1 2 225.254 2.032 20 0 BEADLO COc1nn(C)cc1NCc1cc(C)[nH+]c(C)c1 ZINC001202220931 983605092 /nfs/dbraw/zinc/60/50/92/983605092.db2.gz WBKQYWNSJUGVDK-UHFFFAOYSA-N 1 2 246.314 2.053 20 0 BEADLO Cc1ncc(-c2cc[nH+]c3c2CCN3)cc1N ZINC001242411553 983719230 /nfs/dbraw/zinc/71/92/30/983719230.db2.gz ODJLGFOZORTHDF-UHFFFAOYSA-N 1 2 226.283 2.002 20 0 BEADLO C[C@H](c1ccccc1)[N@H+](CCO)Cc1ccon1 ZINC001473292215 983744362 /nfs/dbraw/zinc/74/43/62/983744362.db2.gz VMGQDQGAZDJPHM-GFCCVEGCSA-N 1 2 246.310 2.230 20 0 BEADLO C[C@H](c1ccccc1)[N@@H+](CCO)Cc1ccon1 ZINC001473292215 983744368 /nfs/dbraw/zinc/74/43/68/983744368.db2.gz VMGQDQGAZDJPHM-GFCCVEGCSA-N 1 2 246.310 2.230 20 0 BEADLO Cn1ccc(-c2ccccc2Cn2cc[nH+]c2)n1 ZINC001242459179 983770023 /nfs/dbraw/zinc/77/00/23/983770023.db2.gz BVRBQPRUPOZMNL-UHFFFAOYSA-N 1 2 238.294 2.332 20 0 BEADLO CC(C)NC(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC001202516966 983848853 /nfs/dbraw/zinc/84/88/53/983848853.db2.gz AYTDROOQMXLPBR-UHFFFAOYSA-N 1 2 244.298 2.402 20 0 BEADLO CCC[C@@H](O)CNc1cccc(-n2cc[nH+]c2)c1 ZINC001252786481 983884485 /nfs/dbraw/zinc/88/44/85/983884485.db2.gz IATJWEKMPQTZIV-CQSZACIVSA-N 1 2 245.326 2.445 20 0 BEADLO Cc1nccnc1[C@H](C)[NH2+]Cc1ccncc1F ZINC000873187085 983899826 /nfs/dbraw/zinc/89/98/26/983899826.db2.gz KXSILBDBWKARIA-JTQLQIEISA-N 1 2 246.289 2.170 20 0 BEADLO CC(C)n1cc(C[N@@H+]2C[C@H](F)C[C@H]2C)cn1 ZINC001137072772 983908248 /nfs/dbraw/zinc/90/82/48/983908248.db2.gz FZFNGVYAZDYCON-ZYHUDNBSSA-N 1 2 225.311 2.396 20 0 BEADLO CC(C)n1cc(C[N@H+]2C[C@H](F)C[C@H]2C)cn1 ZINC001137072772 983908260 /nfs/dbraw/zinc/90/82/60/983908260.db2.gz FZFNGVYAZDYCON-ZYHUDNBSSA-N 1 2 225.311 2.396 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2ocnc2c1 ZINC001242597016 983930551 /nfs/dbraw/zinc/93/05/51/983930551.db2.gz DFXNGASMMXZXHD-UHFFFAOYSA-N 1 2 211.224 2.472 20 0 BEADLO CCNC(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001202546147 983952391 /nfs/dbraw/zinc/95/23/91/983952391.db2.gz NPLYPARHOGRWMY-UHFFFAOYSA-N 1 2 230.271 2.014 20 0 BEADLO C[C@@H](O)c1ccc(-c2ccc[nH+]c2N)cc1 ZINC001242646566 984017795 /nfs/dbraw/zinc/01/77/95/984017795.db2.gz SIUPAIDIUASCLG-SECBINFHSA-N 1 2 214.268 2.384 20 0 BEADLO COc1cc(Nc2cccc(=O)[nH]2)cc(C)[nH+]1 ZINC001212788793 984026854 /nfs/dbraw/zinc/02/68/54/984026854.db2.gz JEMGIXDCZJEQHH-UHFFFAOYSA-N 1 2 231.255 2.243 20 0 BEADLO c1cc(-c2cc(N3CCCC3)cc[nH+]2)ncn1 ZINC001242916975 984287523 /nfs/dbraw/zinc/28/75/23/984287523.db2.gz XGIDGJYTRYHASU-UHFFFAOYSA-N 1 2 226.283 2.139 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1cncc(CO)c1 ZINC001242972073 984341512 /nfs/dbraw/zinc/34/15/12/984341512.db2.gz KZRUZGMIMHJDSP-UHFFFAOYSA-N 1 2 239.278 2.197 20 0 BEADLO COC(=O)c1cc(C)cc(-c2c[nH+]cn2C)c1 ZINC001243023712 984376182 /nfs/dbraw/zinc/37/61/82/984376182.db2.gz WEDMHMNNZWYXDK-UHFFFAOYSA-N 1 2 230.267 2.182 20 0 BEADLO COC(=O)c1cc(C)cc(-c2ccc[nH+]c2N)c1 ZINC001243023325 984376794 /nfs/dbraw/zinc/37/67/94/984376794.db2.gz BFUPJESPKIEHHX-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO COC(=O)[C@H]([NH3+])c1ccc(-c2ccoc2C)cc1 ZINC001243062897 984446552 /nfs/dbraw/zinc/44/65/52/984446552.db2.gz WWBWXKYFWYEFNR-CYBMUJFWSA-N 1 2 245.278 2.428 20 0 BEADLO Cn1c[nH+]cc1-c1ccccc1C1OCCO1 ZINC001243067940 984483980 /nfs/dbraw/zinc/48/39/80/984483980.db2.gz REDOMZLKCOARIP-UHFFFAOYSA-N 1 2 230.267 2.133 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(OC2CCC2)nc1 ZINC001243069364 984486695 /nfs/dbraw/zinc/48/66/95/984486695.db2.gz GAYXWMNNOHUAOK-UHFFFAOYSA-N 1 2 229.283 2.413 20 0 BEADLO COc1ncnc2ccc(-c3c[nH+]cn3C)cc21 ZINC001243068509 984490439 /nfs/dbraw/zinc/49/04/39/984490439.db2.gz BESVDCCJPCAXSQ-UHFFFAOYSA-N 1 2 240.266 2.039 20 0 BEADLO C[C@H]1C(=O)Nc2cc(-c3c[nH+]cn3C)ccc21 ZINC001243069829 984493303 /nfs/dbraw/zinc/49/33/03/984493303.db2.gz ZAPSMVKPJBIWIH-MRVPVSSYSA-N 1 2 227.267 2.143 20 0 BEADLO COC(=O)c1cc(F)c(C)c(-c2c[nH+]cn2C)c1 ZINC001243071515 984497784 /nfs/dbraw/zinc/49/77/84/984497784.db2.gz UQFRBIJNKCSDDX-UHFFFAOYSA-N 1 2 248.257 2.321 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2[nH]c(=S)[nH]c2c1 ZINC001243071747 984504788 /nfs/dbraw/zinc/50/47/88/984504788.db2.gz ZTAXKCVFWPUBJI-UHFFFAOYSA-N 1 2 230.296 2.252 20 0 BEADLO Cn1c[nH+]cc1-c1cnc2c(c1)NCC2(C)C ZINC001243071925 984505634 /nfs/dbraw/zinc/50/56/34/984505634.db2.gz JPLAMMGPEOZSHE-UHFFFAOYSA-N 1 2 228.299 2.185 20 0 BEADLO Cc1ccc(N(C)C)cc1-c1c[nH+]cn1C ZINC001243073058 984508766 /nfs/dbraw/zinc/50/87/66/984508766.db2.gz XMJDALKKXPZOOO-UHFFFAOYSA-N 1 2 215.300 2.462 20 0 BEADLO Cc1cc(-c2ccc(N)[nH+]c2)ccc1CO ZINC001243191372 984664705 /nfs/dbraw/zinc/66/47/05/984664705.db2.gz FGPAOKBXQMLSRG-UHFFFAOYSA-N 1 2 214.268 2.132 20 0 BEADLO Cc1cc(-c2ccc(CO)c(C)c2)c[nH+]c1N ZINC001243192789 984672477 /nfs/dbraw/zinc/67/24/77/984672477.db2.gz TYPZNKBFSLGMNW-UHFFFAOYSA-N 1 2 228.295 2.440 20 0 BEADLO CC(=O)Oc1ccc(-c2ccc[nH+]c2N)cc1 ZINC001243363474 984842980 /nfs/dbraw/zinc/84/29/80/984842980.db2.gz YMYKISMQJKNKJL-UHFFFAOYSA-N 1 2 228.251 2.256 20 0 BEADLO Cc1cc(-c2ccc[nH+]c2N)cnc1F ZINC001243396835 984886029 /nfs/dbraw/zinc/88/60/29/984886029.db2.gz TYBVJFXZVRPMFD-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO O=c1cc(-c2ccc3[nH+]ccn3c2)cc[nH]1 ZINC001243424924 984896561 /nfs/dbraw/zinc/89/65/61/984896561.db2.gz HJVCYFPWNRJTJA-UHFFFAOYSA-N 1 2 211.224 2.102 20 0 BEADLO COC(=[NH2+])c1cccc(-c2cccnc2N)c1 ZINC001243473094 985017161 /nfs/dbraw/zinc/01/71/61/985017161.db2.gz GAMXZJAMYJYAGC-UHFFFAOYSA-N 1 2 227.267 2.303 20 0 BEADLO CCOc1cc(-c2ccc[nH+]c2N)ccn1 ZINC001243472407 985017829 /nfs/dbraw/zinc/01/78/29/985017829.db2.gz JSNVJMMWSMLQIY-UHFFFAOYSA-N 1 2 215.256 2.125 20 0 BEADLO C[C@H]1c2cc(-c3ccc[nH+]c3N)ccc2NC1=O ZINC001243474106 985021608 /nfs/dbraw/zinc/02/16/08/985021608.db2.gz JVXBYKAHTNWMSF-QMMMGPOBSA-N 1 2 239.278 2.386 20 0 BEADLO Nc1[nH+]cccc1-c1cccc2c1CCN2 ZINC001243473420 985023454 /nfs/dbraw/zinc/02/34/54/985023454.db2.gz AQBFDTCKWLJVDC-UHFFFAOYSA-N 1 2 211.268 2.299 20 0 BEADLO C[S@@](=N)(=O)c1ccc(-c2ccc[nH+]c2N)cc1 ZINC001243473980 985024085 /nfs/dbraw/zinc/02/40/85/985024085.db2.gz QMJWAQASOODGKN-QGZVFWFLSA-N 1 2 247.323 2.366 20 0 BEADLO CC(C)(C)c1ncc(-c2ccc[nH+]c2N)cn1 ZINC001243474074 985025289 /nfs/dbraw/zinc/02/52/89/985025289.db2.gz STMMYEGEYKKPGZ-UHFFFAOYSA-N 1 2 228.299 2.418 20 0 BEADLO CC(=O)Nc1ccc(F)cc1-c1ccc[nH+]c1N ZINC001243474877 985027848 /nfs/dbraw/zinc/02/78/48/985027848.db2.gz SZMLFPZBIVPUIB-UHFFFAOYSA-N 1 2 245.257 2.428 20 0 BEADLO COC(=O)c1ccc(C)c(-c2ccc[nH+]c2N)c1 ZINC001243475465 985028614 /nfs/dbraw/zinc/02/86/14/985028614.db2.gz ZZXAEFHJNKVVLG-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO CC(C)c1ncc(-c2ccc[nH+]c2N)cn1 ZINC001243476317 985029732 /nfs/dbraw/zinc/02/97/32/985029732.db2.gz BAVMWESHMZRFHV-UHFFFAOYSA-N 1 2 214.272 2.244 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2c(c1)CCC(=O)O2 ZINC001243475398 985030445 /nfs/dbraw/zinc/03/04/45/985030445.db2.gz YGYIRSONFLVSLH-UHFFFAOYSA-N 1 2 240.262 2.182 20 0 BEADLO Nc1[nH+]cccc1-c1cccc2ocnc21 ZINC001243476404 985031931 /nfs/dbraw/zinc/03/19/31/985031931.db2.gz RMDNDLHCDDFWJM-UHFFFAOYSA-N 1 2 211.224 2.472 20 0 BEADLO Cc1cc2c(cc1-c1ccc[nH+]c1N)CC(=O)N2 ZINC001243477208 985034427 /nfs/dbraw/zinc/03/44/27/985034427.db2.gz MPHGSQMWJGAVDO-UHFFFAOYSA-N 1 2 239.278 2.134 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1ccsc1C ZINC001454683787 985042227 /nfs/dbraw/zinc/04/22/27/985042227.db2.gz LCCTUEIGRBPWFO-JTQLQIEISA-N 1 2 224.329 2.089 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1ccsc1C ZINC001454683787 985042238 /nfs/dbraw/zinc/04/22/38/985042238.db2.gz LCCTUEIGRBPWFO-JTQLQIEISA-N 1 2 224.329 2.089 20 0 BEADLO Cc1ccnc(F)c1-c1ccn2cc(N)[nH+]c2c1 ZINC001243551014 985107795 /nfs/dbraw/zinc/10/77/95/985107795.db2.gz DLCSAYHASBSEME-UHFFFAOYSA-N 1 2 242.257 2.426 20 0 BEADLO CCc1[nH]c(CNC(=O)/C=C\C(C)(C)C)c[nH+]1 ZINC001456144266 985114128 /nfs/dbraw/zinc/11/41/28/985114128.db2.gz VUAWFWWIMMWHDC-SREVYHEPSA-N 1 2 235.331 2.191 20 0 BEADLO CCc1[nH]cc(CNC(=O)C=CC(C)(C)C)[nH+]1 ZINC001456144266 985114138 /nfs/dbraw/zinc/11/41/38/985114138.db2.gz VUAWFWWIMMWHDC-SREVYHEPSA-N 1 2 235.331 2.191 20 0 BEADLO CCc1[nH]c(CNC(=O)/C=C2/CC[C@H](C)C2)c[nH+]1 ZINC001456144743 985116368 /nfs/dbraw/zinc/11/63/68/985116368.db2.gz XPAVEMQICFXJHN-QBQSQJOESA-N 1 2 247.342 2.335 20 0 BEADLO CCc1[nH]cc(CNC(=O)C=C2CC[C@H](C)C2)[nH+]1 ZINC001456144743 985116376 /nfs/dbraw/zinc/11/63/76/985116376.db2.gz XPAVEMQICFXJHN-QBQSQJOESA-N 1 2 247.342 2.335 20 0 BEADLO CCc1[nH]c(CNC(=O)/C=C/C(C)(C)C)c[nH+]1 ZINC001456144270 985119436 /nfs/dbraw/zinc/11/94/36/985119436.db2.gz VUAWFWWIMMWHDC-VOTSOKGWSA-N 1 2 235.331 2.191 20 0 BEADLO CCc1[nH]cc(CNC(=O)C=CC(C)(C)C)[nH+]1 ZINC001456144270 985119447 /nfs/dbraw/zinc/11/94/47/985119447.db2.gz VUAWFWWIMMWHDC-VOTSOKGWSA-N 1 2 235.331 2.191 20 0 BEADLO Nc1cc(-c2c(Cl)cccc2CO)cc[nH+]1 ZINC001243712373 985240064 /nfs/dbraw/zinc/24/00/64/985240064.db2.gz YLBHWPJIQURHCI-UHFFFAOYSA-N 1 2 234.686 2.477 20 0 BEADLO Cc1cc(-c2cccc(=O)[nH]2)c2[nH+]ccn2c1 ZINC001243740497 985286191 /nfs/dbraw/zinc/28/61/91/985286191.db2.gz YYRULGQMFBPPFG-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO c1nsnc1C[N@H+](C1CC1)C1CCCC1 ZINC000687821323 985402157 /nfs/dbraw/zinc/40/21/57/985402157.db2.gz STZHVOKJYJAZEA-UHFFFAOYSA-N 1 2 223.345 2.445 20 0 BEADLO c1nsnc1C[N@@H+](C1CC1)C1CCCC1 ZINC000687821323 985402180 /nfs/dbraw/zinc/40/21/80/985402180.db2.gz STZHVOKJYJAZEA-UHFFFAOYSA-N 1 2 223.345 2.445 20 0 BEADLO CO[C@H]1CC=C(c2ccc(N)[nH+]c2)CC1 ZINC001243813777 985407933 /nfs/dbraw/zinc/40/79/33/985407933.db2.gz JMFYRLLXJYDLGQ-NSHDSACASA-N 1 2 204.273 2.246 20 0 BEADLO Cc1nc(Cl)nn1Cc1ccc(C)[nH+]c1C ZINC001459235984 985411391 /nfs/dbraw/zinc/41/13/91/985411391.db2.gz JCZSKLLRIKQDTD-UHFFFAOYSA-N 1 2 236.706 2.300 20 0 BEADLO COCOc1cccc(-c2ccc[nH+]c2N)c1 ZINC001243826075 985428002 /nfs/dbraw/zinc/42/80/02/985428002.db2.gz VKOUJHLLBJDXLF-UHFFFAOYSA-N 1 2 230.267 2.314 20 0 BEADLO Nc1[nH+]cccc1-c1ccc(CO)c(Cl)c1 ZINC001243821518 985429795 /nfs/dbraw/zinc/42/97/95/985429795.db2.gz MGBJQQRGMVLQOR-UHFFFAOYSA-N 1 2 234.686 2.477 20 0 BEADLO c1cn(C[C@H]2CCCC23CCOCC3)c[nH+]1 ZINC001459689297 985584285 /nfs/dbraw/zinc/58/42/85/985584285.db2.gz XHLNAAQBKSVIRX-GFCCVEGCSA-N 1 2 220.316 2.480 20 0 BEADLO c1n[nH]c2c1[C@H]([NH2+][C@@H]1COC3(CCC3)C1)CCC2 ZINC000688285208 985604478 /nfs/dbraw/zinc/60/44/78/985604478.db2.gz XBVPEHUUSFJHMH-CMPLNLGQSA-N 1 2 247.342 2.088 20 0 BEADLO c1ccc2nnc(C3=C[NH2+]CCC3)cc2c1 ZINC001243947504 985620680 /nfs/dbraw/zinc/62/06/80/985620680.db2.gz KHNYCOAXWXDQIJ-UHFFFAOYSA-N 1 2 211.268 2.354 20 0 BEADLO FC(F)(F)c1nccc(C2=C[NH2+]CCC2)n1 ZINC001243947308 985620835 /nfs/dbraw/zinc/62/08/35/985620835.db2.gz IZKBEVHDLPPJQV-UHFFFAOYSA-N 1 2 229.205 2.220 20 0 BEADLO c1nc2c(ccnc2C2=C[NH2+]CCC2)s1 ZINC001243946915 985621715 /nfs/dbraw/zinc/62/17/15/985621715.db2.gz BDKPVPUQIYFQRS-UHFFFAOYSA-N 1 2 217.297 2.416 20 0 BEADLO FC(F)(F)c1cnc(C2=C[NH2+]CCC2)cn1 ZINC001243946969 985625615 /nfs/dbraw/zinc/62/56/15/985625615.db2.gz AXOOSGVVVJWROW-UHFFFAOYSA-N 1 2 229.205 2.220 20 0 BEADLO CC(C)c1nccc(C2=C[NH2+]CCC2)n1 ZINC001243948117 985629493 /nfs/dbraw/zinc/62/94/93/985629493.db2.gz UNDPMMGOWLTGOM-UHFFFAOYSA-N 1 2 203.289 2.324 20 0 BEADLO c1cc(C2CCC2)nnc1C1=C[NH2+]CCC1 ZINC001243948938 985636066 /nfs/dbraw/zinc/63/60/66/985636066.db2.gz GMLJKJNNAKHFPY-UHFFFAOYSA-N 1 2 215.300 2.468 20 0 BEADLO CSc1c[nH]c2ncnc(C3=C[NH2+]CCC3)c12 ZINC001243949854 985645724 /nfs/dbraw/zinc/64/57/24/985645724.db2.gz RSHQHDQZXIPMKK-UHFFFAOYSA-N 1 2 246.339 2.356 20 0 BEADLO Cc1ccc(C[N@H+](CCO)C2CC2)c(Cl)n1 ZINC000688554242 985682392 /nfs/dbraw/zinc/68/23/92/985682392.db2.gz RCUXZQBTLXJUPE-UHFFFAOYSA-N 1 2 240.734 2.000 20 0 BEADLO Cc1ccc(C[N@@H+](CCO)C2CC2)c(Cl)n1 ZINC000688554242 985682401 /nfs/dbraw/zinc/68/24/01/985682401.db2.gz RCUXZQBTLXJUPE-UHFFFAOYSA-N 1 2 240.734 2.000 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc2nc(N)ncc2c1 ZINC001243991545 985720630 /nfs/dbraw/zinc/72/06/30/985720630.db2.gz SZPWFCRMVZIOID-YGQDEOHPSA-N 1 2 226.283 2.088 20 0 BEADLO CC1(C)C[N@H+](CC2=NOCC2)[C@H]1c1cccnc1 ZINC001460541083 985862205 /nfs/dbraw/zinc/86/22/05/985862205.db2.gz IALQUQWPQZARLH-ZDUSSCGKSA-N 1 2 245.326 2.241 20 0 BEADLO CC1(C)C[N@@H+](CC2=NOCC2)[C@H]1c1cccnc1 ZINC001460541083 985862214 /nfs/dbraw/zinc/86/22/14/985862214.db2.gz IALQUQWPQZARLH-ZDUSSCGKSA-N 1 2 245.326 2.241 20 0 BEADLO COCOc1cccc(Nc2[nH+]cccc2N)c1 ZINC001212895920 985898204 /nfs/dbraw/zinc/89/82/04/985898204.db2.gz JUWKGUQKIRHSTP-UHFFFAOYSA-N 1 2 245.282 2.390 20 0 BEADLO Nc1ncc(Nc2cccc3cc[nH+]cc32)cn1 ZINC001212964261 985979000 /nfs/dbraw/zinc/97/90/00/985979000.db2.gz MEGHNLWOQXAOSS-UHFFFAOYSA-N 1 2 237.266 2.351 20 0 BEADLO Nc1cc(-c2cc(F)c(CO)c(F)c2)cc[nH+]1 ZINC001244343198 985986508 /nfs/dbraw/zinc/98/65/08/985986508.db2.gz PARCTFUMNYWSEE-UHFFFAOYSA-N 1 2 236.221 2.101 20 0 BEADLO Cc1cc(N)ccc1-c1ccn2cc(N)[nH+]c2c1 ZINC001244368381 986002972 /nfs/dbraw/zinc/00/29/72/986002972.db2.gz WAQIWTASMQVUKJ-UHFFFAOYSA-N 1 2 238.294 2.474 20 0 BEADLO CCc1cn(CC(=O)N[C@@H]2CCCC[C@@H]2C)c[nH+]1 ZINC001459257936 986073159 /nfs/dbraw/zinc/07/31/59/986073159.db2.gz DOBUIDXIASHGIJ-WCQYABFASA-N 1 2 249.358 2.140 20 0 BEADLO CC[NH+](CC)c1ccc(Nc2ncn(C)n2)cc1 ZINC001212968023 986084069 /nfs/dbraw/zinc/08/40/69/986084069.db2.gz FFSJIVNIFJKYLD-UHFFFAOYSA-N 1 2 245.330 2.405 20 0 BEADLO CC[NH+](CC)c1ccc(Nc2nonc2N)cc1 ZINC001212968336 986084870 /nfs/dbraw/zinc/08/48/70/986084870.db2.gz WXYXDBDODIXTGO-UHFFFAOYSA-N 1 2 247.302 2.242 20 0 BEADLO Cc1ccc(-c2ccc[nH+]c2N)c(CO)c1 ZINC001244489350 986193509 /nfs/dbraw/zinc/19/35/09/986193509.db2.gz NCWLLOGPUSMNJZ-UHFFFAOYSA-N 1 2 214.268 2.132 20 0 BEADLO Cc1c(F)cncc1-c1ccn2cc(N)[nH+]c2c1 ZINC001244832417 986373023 /nfs/dbraw/zinc/37/30/23/986373023.db2.gz UGXNLRBRHOAPDD-UHFFFAOYSA-N 1 2 242.257 2.426 20 0 BEADLO Cc1cc(-c2cncc(F)c2C)c[nH+]c1N ZINC001244835923 986381957 /nfs/dbraw/zinc/38/19/57/986381957.db2.gz MOVIBNJXQCFUJD-UHFFFAOYSA-N 1 2 217.247 2.482 20 0 BEADLO COc1ccc(-c2cc[nH+]c(N(C)C)c2)cc1N ZINC001244898434 986427374 /nfs/dbraw/zinc/42/73/74/986427374.db2.gz ZIFQZQIGZIQMFK-UHFFFAOYSA-N 1 2 243.310 2.405 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc(CO)cc1F ZINC001244912364 986455050 /nfs/dbraw/zinc/45/50/50/986455050.db2.gz ROALGRWWCRTGSL-YGQDEOHPSA-N 1 2 207.248 2.194 20 0 BEADLO CNc1cc(-c2c[nH+]c(N)c(C)c2)ccn1 ZINC001244970680 986543896 /nfs/dbraw/zinc/54/38/96/986543896.db2.gz ADBIVBBYTVGGRQ-UHFFFAOYSA-N 1 2 214.272 2.076 20 0 BEADLO CNc1cc(-c2cc3nc[nH]c3nc2C)cc[nH+]1 ZINC001244972193 986547730 /nfs/dbraw/zinc/54/77/30/986547730.db2.gz JQMGNEHXWHRZND-UHFFFAOYSA-N 1 2 239.282 2.370 20 0 BEADLO CC(C)c1cc(NC(=O)CCc2c[nH]c[nH+]2)no1 ZINC001465490908 986724059 /nfs/dbraw/zinc/72/40/59/986724059.db2.gz BYSOEGDSAMMNHV-UHFFFAOYSA-N 1 2 248.286 2.092 20 0 BEADLO CC(C)c1cc(NC(=O)CCc2c[nH+]c[nH]2)no1 ZINC001465490908 986724066 /nfs/dbraw/zinc/72/40/66/986724066.db2.gz BYSOEGDSAMMNHV-UHFFFAOYSA-N 1 2 248.286 2.092 20 0 BEADLO Cc1cc(C)c(C[N@@H+]2CCC(=O)[C@@H](C)C2)[nH]1 ZINC001137323129 986770748 /nfs/dbraw/zinc/77/07/48/986770748.db2.gz YMOHXKXFIZVYKV-JTQLQIEISA-N 1 2 220.316 2.042 20 0 BEADLO Cc1cc(C)c(C[N@H+]2CCC(=O)[C@@H](C)C2)[nH]1 ZINC001137323129 986770758 /nfs/dbraw/zinc/77/07/58/986770758.db2.gz YMOHXKXFIZVYKV-JTQLQIEISA-N 1 2 220.316 2.042 20 0 BEADLO CCOc1ccc[nH+]c1N[C@@H](CO)C(C)(C)C ZINC000393939495 986865035 /nfs/dbraw/zinc/86/50/35/986865035.db2.gz WRERFIRCXIGYKA-NSHDSACASA-N 1 2 238.331 2.299 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccnc(C)c2)n(C)n1 ZINC001137413103 986884248 /nfs/dbraw/zinc/88/42/48/986884248.db2.gz XUNSQDSTHFKIMV-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccnc(C)c2)n(C)n1 ZINC001137413103 986884252 /nfs/dbraw/zinc/88/42/52/986884252.db2.gz XUNSQDSTHFKIMV-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO CCCC[C@H](C)[NH2+]CC(F)(F)C(=O)OCC ZINC001255313544 986906476 /nfs/dbraw/zinc/90/64/76/986906476.db2.gz NGPMBZOUYGJCHZ-VIFPVBQESA-N 1 2 237.290 2.353 20 0 BEADLO COC(=O)c1ccccc1-c1c[nH+]c(N)c(C)c1 ZINC001245535838 986911031 /nfs/dbraw/zinc/91/10/31/986911031.db2.gz CATBUIKLNJPNIF-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO c1cn(-c2ccc(-c3cccnn3)cc2)c[nH+]1 ZINC001245534415 986911474 /nfs/dbraw/zinc/91/14/74/986911474.db2.gz HLPPWDUGFTUSTM-UHFFFAOYSA-N 1 2 222.251 2.329 20 0 BEADLO COCOc1ccc(-c2c[nH+]c(N)c(C)c2)nc1 ZINC001245536137 986912804 /nfs/dbraw/zinc/91/28/04/986912804.db2.gz QLBBVKYPPSBWIC-UHFFFAOYSA-N 1 2 245.282 2.017 20 0 BEADLO Cc1cc(-c2ccc(=S)[nH]c2)c[nH+]c1N ZINC001245537859 986919524 /nfs/dbraw/zinc/91/95/24/986919524.db2.gz GENSSMGKIVCEOO-UHFFFAOYSA-N 1 2 217.297 2.323 20 0 BEADLO Cc1cc(-c2cc(F)cc(F)n2)c[nH+]c1N ZINC001245538454 986919737 /nfs/dbraw/zinc/91/97/37/986919737.db2.gz GIRBVIJUZMJZDF-UHFFFAOYSA-N 1 2 221.210 2.312 20 0 BEADLO COc1cc(-c2c[nH+]c(N)c(C)c2)ncc1F ZINC001245538755 986920017 /nfs/dbraw/zinc/92/00/17/986920017.db2.gz PCGLBCFGEDUNBO-UHFFFAOYSA-N 1 2 233.246 2.182 20 0 BEADLO Cc1cc(-c2c[nH+]c(N)c(C)c2)ncc1F ZINC001245537038 986922062 /nfs/dbraw/zinc/92/20/62/986922062.db2.gz WKKCCMACBXRQCT-UHFFFAOYSA-N 1 2 217.247 2.482 20 0 BEADLO Cc1cc(-c2nc(C)nc3c2CCC3)c[nH+]c1N ZINC001245538854 986923944 /nfs/dbraw/zinc/92/39/44/986923944.db2.gz QSZGWGDMMMEWLN-UHFFFAOYSA-N 1 2 240.310 2.226 20 0 BEADLO Nc1cc[nH+]c(-c2cc(O)c(F)c(F)c2F)c1 ZINC001245633487 987009100 /nfs/dbraw/zinc/00/91/00/987009100.db2.gz FJKAKTJJJHBENJ-UHFFFAOYSA-N 1 2 240.184 2.454 20 0 BEADLO Nc1cn2ccc(-c3c(O)cccc3F)cc2[nH+]1 ZINC001245654547 987030495 /nfs/dbraw/zinc/03/04/95/987030495.db2.gz UIGOAMLMUGREKT-UHFFFAOYSA-N 1 2 243.241 2.428 20 0 BEADLO CCOC1C[NH+]([C@H](C)CC(F)(F)F)C1 ZINC001255645963 987042678 /nfs/dbraw/zinc/04/26/78/987042678.db2.gz KGCIVDUILWBACG-SSDOTTSWSA-N 1 2 211.227 2.048 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC001470566833 987053934 /nfs/dbraw/zinc/05/39/34/987053934.db2.gz HTTHLHAWCHXWOP-VXGBXAGGSA-N 1 2 249.358 2.171 20 0 BEADLO C[C@@H](Cc1ccccc1F)[NH+]1CC2(CCO2)C1 ZINC001255851033 987074283 /nfs/dbraw/zinc/07/42/83/987074283.db2.gz JRFHEPWMZYOHOH-NSHDSACASA-N 1 2 235.302 2.231 20 0 BEADLO C[C@H]1CCC[C@H]1N1N=C(C2CC[NH2+]CC2)CC1=O ZINC001245918076 987150295 /nfs/dbraw/zinc/15/02/95/987150295.db2.gz VHWRRRCOXJBUIQ-GXFFZTMASA-N 1 2 249.358 2.417 20 0 BEADLO CC[C@@H](C)N1N=C(C2CC[NH2+]CC2)CC1=O ZINC001245917422 987153290 /nfs/dbraw/zinc/15/32/90/987153290.db2.gz JZEXCQWFOZGNQW-SECBINFHSA-N 1 2 223.320 2.027 20 0 BEADLO Cc1ccc(C2=NN(CC[NH+](C)C)C(=O)C2)cc1 ZINC001245919658 987159555 /nfs/dbraw/zinc/15/95/55/987159555.db2.gz UAXMGZLWOFNXTO-UHFFFAOYSA-N 1 2 245.326 2.126 20 0 BEADLO Cc1ccc(-c2cc(=O)n(CC[NH+](C)C)[nH]2)cc1 ZINC001245919658 987159569 /nfs/dbraw/zinc/15/95/69/987159569.db2.gz UAXMGZLWOFNXTO-UHFFFAOYSA-N 1 2 245.326 2.126 20 0 BEADLO COc1ccc[nH+]c1NCC1SCCS1 ZINC000692880488 987297952 /nfs/dbraw/zinc/29/79/52/987297952.db2.gz NDIBVEDVWUVISJ-UHFFFAOYSA-N 1 2 242.369 2.308 20 0 BEADLO C[C@H](C(=O)N1CCC[C@@H]2CCC[C@@H]21)n1cc[nH+]c1 ZINC001116127965 987451389 /nfs/dbraw/zinc/45/13/89/987451389.db2.gz VPYDDAHMABZTOJ-AGIUHOORSA-N 1 2 247.342 2.235 20 0 BEADLO CC[C@H](C)[C@H](C)[N@@H+]1CCOCC(F)(F)C1 ZINC001473526870 987468621 /nfs/dbraw/zinc/46/86/21/987468621.db2.gz LGGXNBUUWCHIBP-UWVGGRQHSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@H](C)[C@H](C)[N@H+]1CCOCC(F)(F)C1 ZINC001473526870 987468627 /nfs/dbraw/zinc/46/86/27/987468627.db2.gz LGGXNBUUWCHIBP-UWVGGRQHSA-N 1 2 221.291 2.389 20 0 BEADLO C[C@@H](C(=O)N[C@H]1CCCC1(C)C)n1cc[nH+]c1 ZINC001116210034 987478730 /nfs/dbraw/zinc/47/87/30/987478730.db2.gz GWOZOVGPDSEPKR-QWRGUYRKSA-N 1 2 235.331 2.139 20 0 BEADLO C[C@H](C(=O)N1C[C@H]2CCCC[C@@H]2C1)n1cc[nH+]c1 ZINC001116210853 987479299 /nfs/dbraw/zinc/47/92/99/987479299.db2.gz QWRBOMLOFGMBEI-JHJVBQTASA-N 1 2 247.342 2.093 20 0 BEADLO CCc1ncc(C[NH2+][C@H]2CCn3ccnc32)s1 ZINC001474155667 987649350 /nfs/dbraw/zinc/64/93/50/987649350.db2.gz NBFBZPJZNQHXKB-JTQLQIEISA-N 1 2 248.355 2.137 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC3(CCCCC3)C2)[nH]n1 ZINC001116861955 987738154 /nfs/dbraw/zinc/73/81/54/987738154.db2.gz DTDHNUXSUQUEQD-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1cc(C[N@H+]2CCOC3(CCCCC3)C2)[nH]n1 ZINC001116861955 987738158 /nfs/dbraw/zinc/73/81/58/987738158.db2.gz DTDHNUXSUQUEQD-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO CC1(C)CCC(N[C@@H]2C[NH2+]CC2(F)F)CC1 ZINC001246459567 987815880 /nfs/dbraw/zinc/81/58/80/987815880.db2.gz KVPDAZBDMKLRSP-SNVBAGLBSA-N 1 2 232.318 2.152 20 0 BEADLO CC1(C)CCC([NH2+][C@@H]2CNCC2(F)F)CC1 ZINC001246459567 987815885 /nfs/dbraw/zinc/81/58/85/987815885.db2.gz KVPDAZBDMKLRSP-SNVBAGLBSA-N 1 2 232.318 2.152 20 0 BEADLO Cc1cc(N[C@@H](C)[C@@H](C)O)ccc1[NH+](C)C ZINC001118155622 988062238 /nfs/dbraw/zinc/06/22/38/988062238.db2.gz LZZBNVIONGXRRX-WDEREUQCSA-N 1 2 222.332 2.242 20 0 BEADLO CC/C=C/CC[NH+]1CC(NC(=O)c2ccco2)C1 ZINC001494333145 988127898 /nfs/dbraw/zinc/12/78/98/988127898.db2.gz JYJQQPDFQUYLKY-ONEGZZNKSA-N 1 2 248.326 2.050 20 0 BEADLO CC(C)OC(=O)C[N@@H+]1CC[C@H]1Cc1ccccc1 ZINC001322422601 988266785 /nfs/dbraw/zinc/26/67/85/988266785.db2.gz MMJWSIYQAFEICR-AWEZNQCLSA-N 1 2 247.338 2.255 20 0 BEADLO CC(C)OC(=O)C[N@H+]1CC[C@H]1Cc1ccccc1 ZINC001322422601 988266797 /nfs/dbraw/zinc/26/67/97/988266797.db2.gz MMJWSIYQAFEICR-AWEZNQCLSA-N 1 2 247.338 2.255 20 0 BEADLO C[NH+](C)Cc1nnc(/C=C\C2CCCC2)o1 ZINC001118433107 988349434 /nfs/dbraw/zinc/34/94/34/988349434.db2.gz PLXFOPDZMWLQDQ-FPLPWBNLSA-N 1 2 221.304 2.335 20 0 BEADLO C[C@H]([NH2+][C@@H]1C[C@H](C)n2ncnc21)c1cncs1 ZINC001118489108 988380756 /nfs/dbraw/zinc/38/07/56/988380756.db2.gz DHLRYYNDFLMPJR-XHNCKOQMSA-N 1 2 249.343 2.091 20 0 BEADLO c1nnc(C[N@@H+](CC2CCCCC2)C2CC2)[nH]1 ZINC001118493562 988383123 /nfs/dbraw/zinc/38/31/23/988383123.db2.gz YWKMISZKJOJCBW-UHFFFAOYSA-N 1 2 234.347 2.349 20 0 BEADLO c1nnc(C[N@H+](CC2CCCCC2)C2CC2)[nH]1 ZINC001118493562 988383127 /nfs/dbraw/zinc/38/31/27/988383127.db2.gz YWKMISZKJOJCBW-UHFFFAOYSA-N 1 2 234.347 2.349 20 0 BEADLO CC(C)C[C@H]1CCC[N@H+](Cc2nnc[nH]2)C1 ZINC001118496577 988391752 /nfs/dbraw/zinc/39/17/52/988391752.db2.gz ZDXGRWDOWDMOLC-LLVKDONJSA-N 1 2 222.336 2.063 20 0 BEADLO CC(C)C[C@H]1CCC[N@@H+](Cc2nnc[nH]2)C1 ZINC001118496577 988391765 /nfs/dbraw/zinc/39/17/65/988391765.db2.gz ZDXGRWDOWDMOLC-LLVKDONJSA-N 1 2 222.336 2.063 20 0 BEADLO c1nc(C[N@@H+]2CCC[C@H]2C2CCCCC2)n[nH]1 ZINC001118557058 988430796 /nfs/dbraw/zinc/43/07/96/988430796.db2.gz BEEXQDRLLQTRFW-LBPRGKRZSA-N 1 2 234.347 2.349 20 0 BEADLO c1nc(C[N@H+]2CCC[C@H]2C2CCCCC2)n[nH]1 ZINC001118557058 988430803 /nfs/dbraw/zinc/43/08/03/988430803.db2.gz BEEXQDRLLQTRFW-LBPRGKRZSA-N 1 2 234.347 2.349 20 0 BEADLO C[C@@H](C(=O)N1CCC[C@H]1C(C)(C)C)n1cc[nH+]c1 ZINC001323203626 988473600 /nfs/dbraw/zinc/47/36/00/988473600.db2.gz CXGWJHCUSSRXJF-RYUDHWBXSA-N 1 2 249.358 2.481 20 0 BEADLO CN(C)c1ncccc1C[N@H+](C)Cc1ccco1 ZINC001323648872 988573173 /nfs/dbraw/zinc/57/31/73/988573173.db2.gz BBIFKIKVQFHOHM-UHFFFAOYSA-N 1 2 245.326 2.373 20 0 BEADLO CN(C)c1ncccc1C[N@@H+](C)Cc1ccco1 ZINC001323648872 988573185 /nfs/dbraw/zinc/57/31/85/988573185.db2.gz BBIFKIKVQFHOHM-UHFFFAOYSA-N 1 2 245.326 2.373 20 0 BEADLO CCCC[C@H](COC)[NH2+][C@@H](C)c1noc(C)n1 ZINC001323767943 988606713 /nfs/dbraw/zinc/60/67/13/988606713.db2.gz LDYOALLUNGQTFG-GXSJLCMTSA-N 1 2 241.335 2.234 20 0 BEADLO Cc1nc([C@H](C)[NH2+]CCOc2ccccc2)no1 ZINC001323798448 988618485 /nfs/dbraw/zinc/61/84/85/988618485.db2.gz TYSMINIHMCMESH-JTQLQIEISA-N 1 2 247.298 2.108 20 0 BEADLO Cc1nc([C@@H](C)[NH2+]CCOc2ccccc2)no1 ZINC001323798450 988622472 /nfs/dbraw/zinc/62/24/72/988622472.db2.gz TYSMINIHMCMESH-SNVBAGLBSA-N 1 2 247.298 2.108 20 0 BEADLO CC[C@@H](CSC)[N@H+](C)Cc1cc(C)[nH]n1 ZINC001323817730 988623580 /nfs/dbraw/zinc/62/35/80/988623580.db2.gz WEBHBGMOVBYKMG-NSHDSACASA-N 1 2 227.377 2.292 20 0 BEADLO CC[C@@H](CSC)[N@@H+](C)Cc1cc(C)[nH]n1 ZINC001323817730 988623584 /nfs/dbraw/zinc/62/35/84/988623584.db2.gz WEBHBGMOVBYKMG-NSHDSACASA-N 1 2 227.377 2.292 20 0 BEADLO COC[C@@H](CC(C)C)[NH2+][C@@H](C)c1noc(C)n1 ZINC001324047801 988679748 /nfs/dbraw/zinc/67/97/48/988679748.db2.gz SWYXWBZDXSTEDY-GXSJLCMTSA-N 1 2 241.335 2.090 20 0 BEADLO Cc1ccc(Cc2nnc(C[NH+](C)C)o2)cc1 ZINC001324175498 988737353 /nfs/dbraw/zinc/73/73/53/988737353.db2.gz XLNSWKHAAPXCBT-UHFFFAOYSA-N 1 2 231.299 2.030 20 0 BEADLO Cc1cccc(CCc2nnc(C[NH+](C)C)o2)c1 ZINC001324179476 988743013 /nfs/dbraw/zinc/74/30/13/988743013.db2.gz ZFNBUEBJPQMOBY-UHFFFAOYSA-N 1 2 245.326 2.225 20 0 BEADLO C[C@H](NC(=O)Cc1[nH]cc[nH+]1)[C@@]12C[C@@H]1CCCC2 ZINC001118991349 988780306 /nfs/dbraw/zinc/78/03/06/988780306.db2.gz VDEOMCNKDYDALF-COPLHBTASA-N 1 2 247.342 2.037 20 0 BEADLO FC[C@@H]1CCC[N@H+](Cc2nc(C3CC3)no2)C1 ZINC001119268541 988872530 /nfs/dbraw/zinc/87/25/30/988872530.db2.gz ILJRJAUZHGBVLJ-VIFPVBQESA-N 1 2 239.294 2.129 20 0 BEADLO FC[C@@H]1CCC[N@@H+](Cc2nc(C3CC3)no2)C1 ZINC001119268541 988872533 /nfs/dbraw/zinc/87/25/33/988872533.db2.gz ILJRJAUZHGBVLJ-VIFPVBQESA-N 1 2 239.294 2.129 20 0 BEADLO Cc1cc(C[NH+]2CCC(C)(F)CC2)n[nH]1 ZINC001119303895 988919439 /nfs/dbraw/zinc/91/94/39/988919439.db2.gz LKHZIBFLAAZCTF-UHFFFAOYSA-N 1 2 211.284 2.042 20 0 BEADLO CCC[C@H]1CCCN1C(=O)CCn1cc[nH+]c1 ZINC001514711715 988927890 /nfs/dbraw/zinc/92/78/90/988927890.db2.gz UATWNULZVUJIGC-LBPRGKRZSA-N 1 2 235.331 2.064 20 0 BEADLO CC[C@@H]1CCC[C@@H]1CNC(=O)[C@H](C)n1cc[nH+]c1 ZINC001324790664 988979459 /nfs/dbraw/zinc/97/94/59/988979459.db2.gz NWBJCYOIPSMKJZ-YNEHKIRRSA-N 1 2 249.358 2.387 20 0 BEADLO C[C@@H](C(=O)N1CC(C)(C)C[C@@H]1C)n1cc[nH+]c1 ZINC001325251007 989135206 /nfs/dbraw/zinc/13/52/06/989135206.db2.gz ZPBOHGJJMLQGFV-QWRGUYRKSA-N 1 2 235.331 2.091 20 0 BEADLO Cc1cccnc1[C@H](C)Nc1cc(CO)cc[nH+]1 ZINC001516144060 989140237 /nfs/dbraw/zinc/14/02/37/989140237.db2.gz UYNQHYGGBXFOHG-NSHDSACASA-N 1 2 243.310 2.450 20 0 BEADLO CC[C@H](C)[C@@H]([NH2+]C/C=C/C1CC1)C(=O)OC ZINC001119560399 989162175 /nfs/dbraw/zinc/16/21/75/989162175.db2.gz QSNWMURMAMKWBP-SKNSLPIRSA-N 1 2 225.332 2.130 20 0 BEADLO Fc1ccc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)c2[nH]ccc21 ZINC001248818393 989172628 /nfs/dbraw/zinc/17/26/28/989172628.db2.gz KQTPGMVJEDJFJD-QWHCGFSZSA-N 1 2 246.285 2.280 20 0 BEADLO Fc1ccc(C[N@H+]2CCO[C@@H]3C[C@@H]32)c2[nH]ccc21 ZINC001248818393 989172635 /nfs/dbraw/zinc/17/26/35/989172635.db2.gz KQTPGMVJEDJFJD-QWHCGFSZSA-N 1 2 246.285 2.280 20 0 BEADLO C[C@@H](C(=O)N(C)C1CC(C)(C)C1)n1cc[nH+]c1 ZINC001325462688 989190456 /nfs/dbraw/zinc/19/04/56/989190456.db2.gz TWZTVHPSVDXPGW-JTQLQIEISA-N 1 2 235.331 2.091 20 0 BEADLO CC(C)Sc1nccc(C[NH+]2CCC2)n1 ZINC001248829076 989192014 /nfs/dbraw/zinc/19/20/14/989192014.db2.gz PXOWPJBECLRUCF-UHFFFAOYSA-N 1 2 223.345 2.183 20 0 BEADLO C[C@H](C(=O)N(C)C1CC(C)(C)C1)n1cc[nH+]c1 ZINC001325462689 989192758 /nfs/dbraw/zinc/19/27/58/989192758.db2.gz TWZTVHPSVDXPGW-SNVBAGLBSA-N 1 2 235.331 2.091 20 0 BEADLO Cn1ccnc1C[NH+]1CC(c2ccc(F)cc2)C1 ZINC001325501164 989194810 /nfs/dbraw/zinc/19/48/10/989194810.db2.gz CEULSZPNHBOYNI-UHFFFAOYSA-N 1 2 245.301 2.159 20 0 BEADLO COCC1C[NH+](Cc2ccc(Cl)c(C)n2)C1 ZINC001248869044 989207394 /nfs/dbraw/zinc/20/73/94/989207394.db2.gz GSCJPKPDZKLEDU-UHFFFAOYSA-N 1 2 240.734 2.122 20 0 BEADLO COc1ccc2[nH]c(C[N@@H+]3CC[C@H]3C)nc2c1 ZINC001249411933 989273240 /nfs/dbraw/zinc/27/32/40/989273240.db2.gz OJRDCNAADVZMBB-SECBINFHSA-N 1 2 231.299 2.166 20 0 BEADLO COc1ccc2[nH]c(C[N@H+]3CC[C@H]3C)nc2c1 ZINC001249411933 989273245 /nfs/dbraw/zinc/27/32/45/989273245.db2.gz OJRDCNAADVZMBB-SECBINFHSA-N 1 2 231.299 2.166 20 0 BEADLO CC[C@@H](C)c1nn(C)cc1C[N@H+](C)CCF ZINC001249410726 989274712 /nfs/dbraw/zinc/27/47/12/989274712.db2.gz CRWIGNJMYIYYCI-SNVBAGLBSA-N 1 2 227.327 2.335 20 0 BEADLO CC[C@@H](C)c1nn(C)cc1C[N@@H+](C)CCF ZINC001249410726 989274720 /nfs/dbraw/zinc/27/47/20/989274720.db2.gz CRWIGNJMYIYYCI-SNVBAGLBSA-N 1 2 227.327 2.335 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@@H]1CC[C@@H](C)C1 ZINC001518049737 989278051 /nfs/dbraw/zinc/27/80/51/989278051.db2.gz XFBHOOKGPKPGSZ-GHMZBOCLSA-N 1 2 236.315 2.382 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@@H]3CCO[C@H]3C2)ns1 ZINC001249569342 989305693 /nfs/dbraw/zinc/30/56/93/989305693.db2.gz XAFMFZYZKMUAPD-PWSUYJOCSA-N 1 2 238.356 2.062 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@@H]3CCO[C@H]3C2)ns1 ZINC001249569342 989305697 /nfs/dbraw/zinc/30/56/97/989305697.db2.gz XAFMFZYZKMUAPD-PWSUYJOCSA-N 1 2 238.356 2.062 20 0 BEADLO CC(=O)[C@@H]1CCC[N@H+](Cc2cc(C)sn2)C1 ZINC001249589060 989306049 /nfs/dbraw/zinc/30/60/49/989306049.db2.gz RKODZGSUQCDUFA-LLVKDONJSA-N 1 2 238.356 2.253 20 0 BEADLO CC(=O)[C@@H]1CCC[N@@H+](Cc2cc(C)sn2)C1 ZINC001249589060 989306062 /nfs/dbraw/zinc/30/60/62/989306062.db2.gz RKODZGSUQCDUFA-LLVKDONJSA-N 1 2 238.356 2.253 20 0 BEADLO CCCO[C@H]1CC[N@H+](Cc2cc(C)sn2)C1 ZINC001249580838 989309378 /nfs/dbraw/zinc/30/93/78/989309378.db2.gz BCFJRYDFWIXDLD-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO CCCO[C@H]1CC[N@@H+](Cc2cc(C)sn2)C1 ZINC001249580838 989309390 /nfs/dbraw/zinc/30/93/90/989309390.db2.gz BCFJRYDFWIXDLD-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO Cc1cc(C[N@H+](C)C[C@H]2CCCCO2)ns1 ZINC001249583109 989317938 /nfs/dbraw/zinc/31/79/38/989317938.db2.gz ZGAVCLVFIFTVAR-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO Cc1cc(C[N@@H+](C)C[C@H]2CCCCO2)ns1 ZINC001249583109 989317946 /nfs/dbraw/zinc/31/79/46/989317946.db2.gz ZGAVCLVFIFTVAR-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2cc(C)nnc2C)CCO1 ZINC001119690744 989339405 /nfs/dbraw/zinc/33/94/05/989339405.db2.gz BNVDVEPXDWOPPO-CQSZACIVSA-N 1 2 249.358 2.094 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2cc(C)nnc2C)CCO1 ZINC001119690744 989339415 /nfs/dbraw/zinc/33/94/15/989339415.db2.gz BNVDVEPXDWOPPO-CQSZACIVSA-N 1 2 249.358 2.094 20 0 BEADLO CC[NH2+]Cc1noc([C@H]2CCC[C@H](F)C2)n1 ZINC001326236887 989440721 /nfs/dbraw/zinc/44/07/21/989440721.db2.gz RMWBSACZNMPLDX-IUCAKERBSA-N 1 2 227.283 2.175 20 0 BEADLO C[NH+](C)Cc1nnc(C=C(C2CC2)C2CC2)o1 ZINC001326292083 989472321 /nfs/dbraw/zinc/47/23/21/989472321.db2.gz FRSPKYOSRALMHE-UHFFFAOYSA-N 1 2 233.315 2.335 20 0 BEADLO CC(C)OC1C[NH+](CCCC(F)(F)F)C1 ZINC001119974788 989530224 /nfs/dbraw/zinc/53/02/24/989530224.db2.gz LJOZERGBLDLQLD-UHFFFAOYSA-N 1 2 225.254 2.438 20 0 BEADLO C[C@H](c1ccccc1)[C@H](O)C[NH2+]CC(F)F ZINC001120583880 989758426 /nfs/dbraw/zinc/75/84/26/989758426.db2.gz ZSKTURGXNCXXNY-MWLCHTKSSA-N 1 2 229.270 2.006 20 0 BEADLO CN(CCCc1ccccc1)c1cc(N)nc[nH+]1 ZINC001120771039 989873676 /nfs/dbraw/zinc/87/36/76/989873676.db2.gz JMJZMFFMTCKXJG-UHFFFAOYSA-N 1 2 242.326 2.128 20 0 BEADLO CCC1(O)CCN(c2cc(F)cc(C)[nH+]2)CC1 ZINC001120818313 989901869 /nfs/dbraw/zinc/90/18/69/989901869.db2.gz QVPUDPHILIXOQJ-UHFFFAOYSA-N 1 2 238.306 2.270 20 0 BEADLO CCO[C@H]1CCN(c2ccc(CC)c[nH+]2)C1 ZINC001120876629 989944253 /nfs/dbraw/zinc/94/42/53/989944253.db2.gz IDKMLNVAYOMSJQ-LBPRGKRZSA-N 1 2 220.316 2.259 20 0 BEADLO Cc1cnc(N2CCC(c3c[nH]c[nH+]3)CC2)o1 ZINC001120906519 989958826 /nfs/dbraw/zinc/95/88/26/989958826.db2.gz OTFDTPGOBRSGGJ-UHFFFAOYSA-N 1 2 232.287 2.090 20 0 BEADLO CC(C)C[C@@H]1CCCN(c2cc(N)nc[nH+]2)C1 ZINC001120910027 989963683 /nfs/dbraw/zinc/96/36/83/989963683.db2.gz KHFAAVQMDZHGIM-NSHDSACASA-N 1 2 234.347 2.321 20 0 BEADLO Cc1cc(N(C)Cc2cn[nH]c2)nc(C2CC2)[nH+]1 ZINC001120961904 989988810 /nfs/dbraw/zinc/98/88/10/989988810.db2.gz BPVFZBCUOFUNPV-UHFFFAOYSA-N 1 2 243.314 2.022 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H]1C[C@H]2C[C@H]2C1 ZINC001121138861 990023755 /nfs/dbraw/zinc/02/37/55/990023755.db2.gz DRVXRBPKXSOHCB-GDNZZTSVSA-N 1 2 230.311 2.105 20 0 BEADLO C[C@@H]1CCC(C)(C)N1C(=O)CCc1[nH+]ccn1C ZINC001528483104 990290993 /nfs/dbraw/zinc/29/09/93/990290993.db2.gz GUZOAGGBPJDSCM-LLVKDONJSA-N 1 2 249.358 2.142 20 0 BEADLO Cc1coc(C(=O)OCC(C)(C)n2cc[nH+]c2)c1 ZINC001123050411 990496263 /nfs/dbraw/zinc/49/62/63/990496263.db2.gz MXKQLUWOTQPHNZ-UHFFFAOYSA-N 1 2 248.282 2.377 20 0 BEADLO O=C(Nc1ccc(F)cc1)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC001540402652 990615833 /nfs/dbraw/zinc/61/58/33/990615833.db2.gz SONPEROYTNMJEG-GHMZBOCLSA-N 1 2 245.257 2.291 20 0 BEADLO O=C(Nc1ccc(F)cc1)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC001540402652 990615842 /nfs/dbraw/zinc/61/58/42/990615842.db2.gz SONPEROYTNMJEG-GHMZBOCLSA-N 1 2 245.257 2.291 20 0 BEADLO Cn1cc[nH+]c1CCC(=O)N[C@@H]1CCCC1(C)C ZINC001123751033 990660483 /nfs/dbraw/zinc/66/04/83/990660483.db2.gz KTJTXICNSXBDKG-LLVKDONJSA-N 1 2 249.358 2.048 20 0 BEADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)[C@H]1C[C@@H]1F ZINC001542442208 990665081 /nfs/dbraw/zinc/66/50/81/990665081.db2.gz MNDXYFKDZPKTCS-QWRGUYRKSA-N 1 2 245.257 2.373 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@H]1CCCC(C)(C)C1 ZINC001556231679 990811685 /nfs/dbraw/zinc/81/16/85/990811685.db2.gz KOSPWFAAALWHCZ-NSHDSACASA-N 1 2 249.358 2.346 20 0 BEADLO C[N@H+](Cc1cncs1)Cc1ccc(F)nc1 ZINC001137742967 990846948 /nfs/dbraw/zinc/84/69/48/990846948.db2.gz SEFKXRAKMDRSAZ-UHFFFAOYSA-N 1 2 237.303 2.309 20 0 BEADLO C[N@@H+](Cc1cncs1)Cc1ccc(F)nc1 ZINC001137742967 990846950 /nfs/dbraw/zinc/84/69/50/990846950.db2.gz SEFKXRAKMDRSAZ-UHFFFAOYSA-N 1 2 237.303 2.309 20 0 BEADLO C[C@@H]1CC[N@@H+]1Cc1scnc1Cl ZINC001137817479 990851781 /nfs/dbraw/zinc/85/17/81/990851781.db2.gz VGBAOVDRZQZLLM-ZCFIWIBFSA-N 1 2 202.710 2.391 20 0 BEADLO C[C@@H]1CC[N@H+]1Cc1scnc1Cl ZINC001137817479 990851783 /nfs/dbraw/zinc/85/17/83/990851783.db2.gz VGBAOVDRZQZLLM-ZCFIWIBFSA-N 1 2 202.710 2.391 20 0 BEADLO OC[C@@H]1CCC[N@@H+]1Cc1c(F)ccc(F)c1F ZINC001137926846 990870420 /nfs/dbraw/zinc/87/04/20/990870420.db2.gz DIFHHJUQBQQPEW-QMMMGPOBSA-N 1 2 245.244 2.061 20 0 BEADLO OC[C@@H]1CCC[N@H+]1Cc1c(F)ccc(F)c1F ZINC001137926846 990870425 /nfs/dbraw/zinc/87/04/25/990870425.db2.gz DIFHHJUQBQQPEW-QMMMGPOBSA-N 1 2 245.244 2.061 20 0 BEADLO C[C@@]1(O)CC[N@H+](Cc2c(F)ccc(F)c2F)C1 ZINC001137927267 990870601 /nfs/dbraw/zinc/87/06/01/990870601.db2.gz UTEHCRLGIFCSHZ-GFCCVEGCSA-N 1 2 245.244 2.061 20 0 BEADLO C[C@@]1(O)CC[N@@H+](Cc2c(F)ccc(F)c2F)C1 ZINC001137927267 990870602 /nfs/dbraw/zinc/87/06/02/990870602.db2.gz UTEHCRLGIFCSHZ-GFCCVEGCSA-N 1 2 245.244 2.061 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1c[nH]nc1-c1cccs1 ZINC001138151223 990889494 /nfs/dbraw/zinc/88/94/94/990889494.db2.gz LRZJWEVSANQMPQ-UHFFFAOYSA-N 1 2 249.339 2.159 20 0 BEADLO CC(=O)C[N@H+](C)Cc1c[nH]nc1-c1cccs1 ZINC001138151223 990889496 /nfs/dbraw/zinc/88/94/96/990889496.db2.gz LRZJWEVSANQMPQ-UHFFFAOYSA-N 1 2 249.339 2.159 20 0 BEADLO C[C@@]1(F)CCC[N@H+](Cc2cc(O)cc(O)c2)C1 ZINC001138324047 990914999 /nfs/dbraw/zinc/91/49/99/990914999.db2.gz HQFZDQIAGIBCGL-CYBMUJFWSA-N 1 2 239.290 2.422 20 0 BEADLO C[C@@]1(F)CCC[N@@H+](Cc2cc(O)cc(O)c2)C1 ZINC001138324047 990915002 /nfs/dbraw/zinc/91/50/02/990915002.db2.gz HQFZDQIAGIBCGL-CYBMUJFWSA-N 1 2 239.290 2.422 20 0 BEADLO Oc1cc(O)cc(C[N@@H+]2CCC[C@@H](F)C2)c1 ZINC001138328625 990918621 /nfs/dbraw/zinc/91/86/21/990918621.db2.gz QIBBTYMVXAUQLF-SNVBAGLBSA-N 1 2 225.263 2.032 20 0 BEADLO Oc1cc(O)cc(C[N@H+]2CCC[C@@H](F)C2)c1 ZINC001138328625 990918628 /nfs/dbraw/zinc/91/86/28/990918628.db2.gz QIBBTYMVXAUQLF-SNVBAGLBSA-N 1 2 225.263 2.032 20 0 BEADLO CCC(=O)N1CCC[C@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001558351365 990940688 /nfs/dbraw/zinc/94/06/88/990940688.db2.gz KGTISKNJYBGDCQ-JTQLQIEISA-N 1 2 221.304 2.100 20 0 BEADLO CC[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)[C@@H]1C ZINC001138451237 990947998 /nfs/dbraw/zinc/94/79/98/990947998.db2.gz AWYDFACGXJGTJL-DDHJBXDOSA-N 1 2 247.342 2.160 20 0 BEADLO CC[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)[C@@H]1C ZINC001138451237 990948002 /nfs/dbraw/zinc/94/80/02/990948002.db2.gz AWYDFACGXJGTJL-DDHJBXDOSA-N 1 2 247.342 2.160 20 0 BEADLO CC[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)[C@H]1C ZINC001138451239 990949413 /nfs/dbraw/zinc/94/94/13/990949413.db2.gz AWYDFACGXJGTJL-NNYUYHANSA-N 1 2 247.342 2.160 20 0 BEADLO CC[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)[C@H]1C ZINC001138451239 990949421 /nfs/dbraw/zinc/94/94/21/990949421.db2.gz AWYDFACGXJGTJL-NNYUYHANSA-N 1 2 247.342 2.160 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)[C@@H]2CC2(C)C)[nH+]1 ZINC001558561444 990969152 /nfs/dbraw/zinc/96/91/52/990969152.db2.gz RWAFXDKJXLESHS-JTQLQIEISA-N 1 2 235.331 2.195 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)[C@@H]2CC2(C)C)c[nH+]1 ZINC001558561444 990969166 /nfs/dbraw/zinc/96/91/66/990969166.db2.gz RWAFXDKJXLESHS-JTQLQIEISA-N 1 2 235.331 2.195 20 0 BEADLO CCCn1ncc(C[N@@H+]2CCCC(=O)CC2)c1C ZINC001138635383 990985364 /nfs/dbraw/zinc/98/53/64/990985364.db2.gz OZXMDDAEGQDDTN-UHFFFAOYSA-N 1 2 249.358 2.157 20 0 BEADLO CCCn1ncc(C[N@H+]2CCCC(=O)CC2)c1C ZINC001138635383 990985375 /nfs/dbraw/zinc/98/53/75/990985375.db2.gz OZXMDDAEGQDDTN-UHFFFAOYSA-N 1 2 249.358 2.157 20 0 BEADLO C[N@H+](Cc1ccno1)Cc1cnc2[nH]ccc2c1 ZINC001138739723 991028735 /nfs/dbraw/zinc/02/87/35/991028735.db2.gz DQSXQXVDKTVBHF-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO C[N@@H+](Cc1ccno1)Cc1cnc2[nH]ccc2c1 ZINC001138739723 991028742 /nfs/dbraw/zinc/02/87/42/991028742.db2.gz DQSXQXVDKTVBHF-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO Fc1ncccc1C[NH+]1CC(c2cccnc2)C1 ZINC001138794602 991058209 /nfs/dbraw/zinc/05/82/09/991058209.db2.gz YOHMGTRVUNDNTN-UHFFFAOYSA-N 1 2 243.285 2.215 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@H](C)Cc2ccco2)no1 ZINC001258187604 991092200 /nfs/dbraw/zinc/09/22/00/991092200.db2.gz YDBNVIZQIOHOFR-SECBINFHSA-N 1 2 235.287 2.034 20 0 BEADLO Cc1nc(C[N@H+](C)[C@H](C)Cc2ccco2)no1 ZINC001258187604 991092209 /nfs/dbraw/zinc/09/22/09/991092209.db2.gz YDBNVIZQIOHOFR-SECBINFHSA-N 1 2 235.287 2.034 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@@H](C)Cc2ccco2)no1 ZINC001258187605 991096393 /nfs/dbraw/zinc/09/63/93/991096393.db2.gz YDBNVIZQIOHOFR-VIFPVBQESA-N 1 2 235.287 2.034 20 0 BEADLO Cc1nc(C[N@H+](C)[C@@H](C)Cc2ccco2)no1 ZINC001258187605 991096410 /nfs/dbraw/zinc/09/64/10/991096410.db2.gz YDBNVIZQIOHOFR-VIFPVBQESA-N 1 2 235.287 2.034 20 0 BEADLO Cc1[nH+]cc2n1CCN([C@@H](C)Cc1ccco1)C2 ZINC001258186936 991096790 /nfs/dbraw/zinc/09/67/90/991096790.db2.gz AWLHLJJSVIWPON-NSHDSACASA-N 1 2 245.326 2.231 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CC[C@H](F)C(F)(F)CC2)n1 ZINC001138935503 991104030 /nfs/dbraw/zinc/10/40/30/991104030.db2.gz SNQDCKLQZZBHFM-VIFPVBQESA-N 1 2 247.264 2.287 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CC[C@H](F)C(F)(F)CC2)n1 ZINC001138935503 991104039 /nfs/dbraw/zinc/10/40/39/991104039.db2.gz SNQDCKLQZZBHFM-VIFPVBQESA-N 1 2 247.264 2.287 20 0 BEADLO CCc1cn(CC(=O)N2[C@H](C)CCC[C@@H]2C)c[nH+]1 ZINC001559466441 991114173 /nfs/dbraw/zinc/11/41/73/991114173.db2.gz UXIRLXKYFMAELY-TXEJJXNPSA-N 1 2 249.358 2.235 20 0 BEADLO CCc1cn(Cc2ncccc2C)c[nH+]1 ZINC001559466071 991114192 /nfs/dbraw/zinc/11/41/92/991114192.db2.gz KHYYMZNXVZLXFM-UHFFFAOYSA-N 1 2 201.273 2.197 20 0 BEADLO CCOC(=O)C1([NH2+][C@@H](C)CCSC)CCC1 ZINC001258206871 991129065 /nfs/dbraw/zinc/12/90/65/991129065.db2.gz YRQXRVMTBBFQMG-JTQLQIEISA-N 1 2 245.388 2.203 20 0 BEADLO CSCC[C@@H](C)[N@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001258216134 991142600 /nfs/dbraw/zinc/14/26/00/991142600.db2.gz UVQMSHRXWYHZNN-HLTSFMKQSA-N 1 2 209.305 2.120 20 0 BEADLO CSCC[C@@H](C)[N@@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001258216134 991142605 /nfs/dbraw/zinc/14/26/05/991142605.db2.gz UVQMSHRXWYHZNN-HLTSFMKQSA-N 1 2 209.305 2.120 20 0 BEADLO COC(=O)C1([NH2+][C@@H]2CCCC(C)(C)C2)CC1 ZINC001258275312 991199372 /nfs/dbraw/zinc/19/93/72/991199372.db2.gz JTTAYMACHSYYGW-SNVBAGLBSA-N 1 2 225.332 2.250 20 0 BEADLO CC(C)CCc1nnc(CCn2cc[nH+]c2)o1 ZINC001258282970 991216393 /nfs/dbraw/zinc/21/63/93/991216393.db2.gz SUULGSPGBKQFAQ-UHFFFAOYSA-N 1 2 234.303 2.097 20 0 BEADLO CCCOC(=O)C[NH2+][C@@H](C)CC(C)(C)SC ZINC001258330540 991257642 /nfs/dbraw/zinc/25/76/42/991257642.db2.gz XUEAYXBABNXVBS-JTQLQIEISA-N 1 2 247.404 2.449 20 0 BEADLO COc1cc(C[N@H+](C)C2COC2)ccc1Cl ZINC001139621575 991294775 /nfs/dbraw/zinc/29/47/75/991294775.db2.gz LYJWOAOXXAEMJR-UHFFFAOYSA-N 1 2 241.718 2.179 20 0 BEADLO COc1cc(C[N@@H+](C)C2COC2)ccc1Cl ZINC001139621575 991294797 /nfs/dbraw/zinc/29/47/97/991294797.db2.gz LYJWOAOXXAEMJR-UHFFFAOYSA-N 1 2 241.718 2.179 20 0 BEADLO O[C@@H]1C[N@H+](Cc2ccccc2C(F)F)C[C@@H]1F ZINC001139795998 991373442 /nfs/dbraw/zinc/37/34/42/991373442.db2.gz SLYLOVPMILSIIY-WDEREUQCSA-N 1 2 245.244 2.139 20 0 BEADLO O[C@@H]1C[N@@H+](Cc2ccccc2C(F)F)C[C@@H]1F ZINC001139795998 991373452 /nfs/dbraw/zinc/37/34/52/991373452.db2.gz SLYLOVPMILSIIY-WDEREUQCSA-N 1 2 245.244 2.139 20 0 BEADLO Cn1c(C[N@H+](C)C2COC2)cc2ccccc21 ZINC001139871390 991407711 /nfs/dbraw/zinc/40/77/11/991407711.db2.gz BSTGOCBVNUCJAF-UHFFFAOYSA-N 1 2 230.311 2.009 20 0 BEADLO Cn1c(C[N@@H+](C)C2COC2)cc2ccccc21 ZINC001139871390 991407713 /nfs/dbraw/zinc/40/77/13/991407713.db2.gz BSTGOCBVNUCJAF-UHFFFAOYSA-N 1 2 230.311 2.009 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc3ccccc3cn2)CCO1 ZINC001139994984 991472608 /nfs/dbraw/zinc/47/26/08/991472608.db2.gz GDXZPUHDUMANBA-GFCCVEGCSA-N 1 2 242.322 2.456 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc3ccccc3cn2)CCO1 ZINC001139994984 991472614 /nfs/dbraw/zinc/47/26/14/991472614.db2.gz GDXZPUHDUMANBA-GFCCVEGCSA-N 1 2 242.322 2.456 20 0 BEADLO OCc1cc[nH+]c(NCc2cccc(F)c2)c1 ZINC001560510697 991490208 /nfs/dbraw/zinc/49/02/08/991490208.db2.gz HMTUPCVHQGNYKV-UHFFFAOYSA-N 1 2 232.258 2.325 20 0 BEADLO Cc1cccc(CNc2cc(CO)cc[nH+]2)c1 ZINC001560510662 991491399 /nfs/dbraw/zinc/49/13/99/991491399.db2.gz FWQVHMQWVHOLFF-UHFFFAOYSA-N 1 2 228.295 2.494 20 0 BEADLO O=c1cc(CNc2cc3cc[nH]c3c[nH+]2)cc[nH]1 ZINC001560518459 991492868 /nfs/dbraw/zinc/49/28/68/991492868.db2.gz WHWDYRRSUINECF-UHFFFAOYSA-N 1 2 240.266 2.276 20 0 BEADLO Oc1ccc(F)c(C[NH+]2CC3(CSC3)C2)c1 ZINC001140052234 991500786 /nfs/dbraw/zinc/50/07/86/991500786.db2.gz KCOFKKGLIALVEL-UHFFFAOYSA-N 1 2 239.315 2.080 20 0 BEADLO Oc1ccc(C[N@@H+]2CCC[C@@H]2CF)c(F)c1 ZINC001140130563 991532727 /nfs/dbraw/zinc/53/27/27/991532727.db2.gz SAMADZUBHOFMET-SNVBAGLBSA-N 1 2 227.254 2.465 20 0 BEADLO Oc1ccc(C[N@H+]2CCC[C@@H]2CF)c(F)c1 ZINC001140130563 991532737 /nfs/dbraw/zinc/53/27/37/991532737.db2.gz SAMADZUBHOFMET-SNVBAGLBSA-N 1 2 227.254 2.465 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1cccc(F)n1 ZINC001140130960 991533934 /nfs/dbraw/zinc/53/39/34/991533934.db2.gz AIQZNXGZCMXEPM-BDAKNGLRSA-N 1 2 212.243 2.153 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1cccc(F)n1 ZINC001140130960 991533943 /nfs/dbraw/zinc/53/39/43/991533943.db2.gz AIQZNXGZCMXEPM-BDAKNGLRSA-N 1 2 212.243 2.153 20 0 BEADLO C[NH+](C)Cc1sc(N2CCCC2)nc1Cl ZINC001140362879 991627637 /nfs/dbraw/zinc/62/76/37/991627637.db2.gz XWFUPQDEOAVVMG-UHFFFAOYSA-N 1 2 245.779 2.458 20 0 BEADLO c1cn(C2CC2)c(C[NH+]2CC3(CCC3)C2)n1 ZINC001560875805 991633422 /nfs/dbraw/zinc/63/34/22/991633422.db2.gz HIRGXPKHFLUZLO-UHFFFAOYSA-N 1 2 217.316 2.204 20 0 BEADLO C[C@@H](C(=O)N1CCC[C@@H]1C1CCC1)n1cc[nH+]c1 ZINC001318227881 991636342 /nfs/dbraw/zinc/63/63/42/991636342.db2.gz YYADYUBLEDNNPN-WCQYABFASA-N 1 2 247.342 2.235 20 0 BEADLO c1cc(C[NH+]2CC3(CCO3)C2)cc2c1CCC2 ZINC001203034251 991637338 /nfs/dbraw/zinc/63/73/38/991637338.db2.gz VGFDHCYZTMEWCZ-UHFFFAOYSA-N 1 2 229.323 2.150 20 0 BEADLO C[C@H](C(=O)N1CCC[C@@H]1C1CCC1)n1cc[nH+]c1 ZINC001318227880 991637555 /nfs/dbraw/zinc/63/75/55/991637555.db2.gz YYADYUBLEDNNPN-DGCLKSJQSA-N 1 2 247.342 2.235 20 0 BEADLO Cn1cc(Cl)c(C[NH2+][C@@H]2CCCC[C@H]2F)n1 ZINC001560884913 991638094 /nfs/dbraw/zinc/63/80/94/991638094.db2.gz LHNNASWGNAEUJX-NXEZZACHSA-N 1 2 245.729 2.444 20 0 BEADLO Clc1ccc2ncc(C[NH+]3CC=CC3)n2c1 ZINC001140426685 991638276 /nfs/dbraw/zinc/63/82/76/991638276.db2.gz ZPBTWZPOZBSYPV-UHFFFAOYSA-N 1 2 233.702 2.360 20 0 BEADLO C[C@@H](CCO)[N@H+](C)Cc1c(Cl)ccnc1F ZINC001560912520 991649972 /nfs/dbraw/zinc/64/99/72/991649972.db2.gz JDGCIZBOALGXNA-QMMMGPOBSA-N 1 2 246.713 2.077 20 0 BEADLO C[C@@H](CCO)[N@@H+](C)Cc1c(Cl)ccnc1F ZINC001560912520 991649976 /nfs/dbraw/zinc/64/99/76/991649976.db2.gz JDGCIZBOALGXNA-QMMMGPOBSA-N 1 2 246.713 2.077 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1cc(F)cc(Cl)c1 ZINC001140537503 991660976 /nfs/dbraw/zinc/66/09/76/991660976.db2.gz VATPKDCGWFNTIF-UHFFFAOYSA-N 1 2 229.682 2.500 20 0 BEADLO CC(=O)C[N@H+](C)Cc1cc(F)cc(Cl)c1 ZINC001140537503 991660978 /nfs/dbraw/zinc/66/09/78/991660978.db2.gz VATPKDCGWFNTIF-UHFFFAOYSA-N 1 2 229.682 2.500 20 0 BEADLO Nc1cc(N[C@H]2CCc3cc(F)ccc32)[nH+]cn1 ZINC001318519233 991671225 /nfs/dbraw/zinc/67/12/25/991671225.db2.gz MUJLRANBLZPCKN-NSHDSACASA-N 1 2 244.273 2.297 20 0 BEADLO Cc1cc(C[NH+]2CC3(C2)CCCCO3)ccc1O ZINC001140573822 991672616 /nfs/dbraw/zinc/67/26/16/991672616.db2.gz UGSFSPZKVOTXNA-UHFFFAOYSA-N 1 2 247.338 2.456 20 0 BEADLO Cc1cc(C[N@H+]2CCC(=O)C[C@H]2C)ccc1O ZINC001140574990 991676045 /nfs/dbraw/zinc/67/60/45/991676045.db2.gz YIPHSLWXOFIQMN-LLVKDONJSA-N 1 2 233.311 2.254 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(=O)C[C@H]2C)ccc1O ZINC001140574990 991676049 /nfs/dbraw/zinc/67/60/49/991676049.db2.gz YIPHSLWXOFIQMN-LLVKDONJSA-N 1 2 233.311 2.254 20 0 BEADLO Cn1cc(Cl)c(C[N@@H+]2CCC[C@@H](CF)C2)n1 ZINC001560985261 991679627 /nfs/dbraw/zinc/67/96/27/991679627.db2.gz VHEREULNMKNQMP-VIFPVBQESA-N 1 2 245.729 2.255 20 0 BEADLO Cn1cc(Cl)c(C[N@H+]2CCC[C@@H](CF)C2)n1 ZINC001560985261 991679635 /nfs/dbraw/zinc/67/96/35/991679635.db2.gz VHEREULNMKNQMP-VIFPVBQESA-N 1 2 245.729 2.255 20 0 BEADLO C[C@@H](Cc1cccc(Cl)c1)[NH+]1CC(C)(O)C1 ZINC001258744702 991692415 /nfs/dbraw/zinc/69/24/15/991692415.db2.gz FCBUJYKDGASGKB-JTQLQIEISA-N 1 2 239.746 2.338 20 0 BEADLO CC[C@H](Cc1ccccc1)[NH2+]C1(C(=O)OC)CC1 ZINC001258838173 991872704 /nfs/dbraw/zinc/87/27/04/991872704.db2.gz PHRIMJYASCXTSA-CYBMUJFWSA-N 1 2 247.338 2.303 20 0 BEADLO CC[C@]1(C)CCN(C(=O)[C@H](C)n2cc[nH+]c2)C1 ZINC001319610027 991905810 /nfs/dbraw/zinc/90/58/10/991905810.db2.gz PEYMFJSTBQCUBR-WCQYABFASA-N 1 2 235.331 2.093 20 0 BEADLO Cc1cc(C[N@@H+]2CCOCC3(CCCC3)C2)n[nH]1 ZINC001320422155 992199642 /nfs/dbraw/zinc/19/96/42/992199642.db2.gz BPOYBAQSDXWJIS-UHFFFAOYSA-N 1 2 249.358 2.111 20 0 BEADLO Cc1cc(C[N@H+]2CCOCC3(CCCC3)C2)n[nH]1 ZINC001320422155 992199648 /nfs/dbraw/zinc/19/96/48/992199648.db2.gz BPOYBAQSDXWJIS-UHFFFAOYSA-N 1 2 249.358 2.111 20 0 BEADLO CCN(CC(C)(C)C)C(=O)[C@H](C)n1cc[nH+]c1 ZINC001261224304 992204055 /nfs/dbraw/zinc/20/40/55/992204055.db2.gz ADCAPZPSPJYRSH-NSHDSACASA-N 1 2 237.347 2.339 20 0 BEADLO CC(C)c1ocnc1C[N@@H+]1CCCOCC1 ZINC001320547348 992240063 /nfs/dbraw/zinc/24/00/63/992240063.db2.gz DZCRLZGAVRRSPQ-UHFFFAOYSA-N 1 2 224.304 2.020 20 0 BEADLO CC(C)c1ocnc1C[N@H+]1CCCOCC1 ZINC001320547348 992240076 /nfs/dbraw/zinc/24/00/76/992240076.db2.gz DZCRLZGAVRRSPQ-UHFFFAOYSA-N 1 2 224.304 2.020 20 0 BEADLO CC(C)C(C)(C)CNC(=O)[C@H](C)n1cc[nH+]c1 ZINC001320563827 992248611 /nfs/dbraw/zinc/24/86/11/992248611.db2.gz SPIRCGVPBLSTBQ-NSHDSACASA-N 1 2 237.347 2.243 20 0 BEADLO COC(=O)C[N@H+](CCC(F)(F)F)CC(C)C ZINC001320814751 992369309 /nfs/dbraw/zinc/36/93/09/992369309.db2.gz VUJKIKYLEOJAPI-UHFFFAOYSA-N 1 2 241.253 2.070 20 0 BEADLO COC(=O)C[N@@H+](CCC(F)(F)F)CC(C)C ZINC001320814751 992369319 /nfs/dbraw/zinc/36/93/19/992369319.db2.gz VUJKIKYLEOJAPI-UHFFFAOYSA-N 1 2 241.253 2.070 20 0 BEADLO C[NH+](C)Cc1nnc([C@H]2CCC[C@@H](F)C2)o1 ZINC001261575501 992395929 /nfs/dbraw/zinc/39/59/29/992395929.db2.gz KEZZSBIKZKOFIM-DTWKUNHWSA-N 1 2 227.283 2.127 20 0 BEADLO C[C@H](C(=O)N1CC(C2CCCC2)C1)n1cc[nH+]c1 ZINC001321240509 992500798 /nfs/dbraw/zinc/50/07/98/992500798.db2.gz KLGITXQIWYMDTK-LLVKDONJSA-N 1 2 247.342 2.093 20 0 BEADLO CC(C)(C)c1cn(C[C@](C)(O)C(F)F)c[nH+]1 ZINC001262168137 992735929 /nfs/dbraw/zinc/73/59/29/992735929.db2.gz MJMKSFUBOHFGEO-NSHDSACASA-N 1 2 232.274 2.197 20 0 BEADLO C[C@@H](C(=O)N[C@H]1CCCC2(CC2)C1)n1cc[nH+]c1 ZINC001262347578 992849309 /nfs/dbraw/zinc/84/93/09/992849309.db2.gz JBRAOFBCZCAWEY-RYUDHWBXSA-N 1 2 247.342 2.283 20 0 BEADLO CN(C)c1cc(N2CCC[C@H]2C2CCC2)nc[nH+]1 ZINC001262683072 993023142 /nfs/dbraw/zinc/02/31/42/993023142.db2.gz VJASYOPMTFJASB-LBPRGKRZSA-N 1 2 246.358 2.312 20 0 BEADLO CN(C)c1cc(N2CCC[C@H]2C2CCC2)[nH+]cn1 ZINC001262683072 993023147 /nfs/dbraw/zinc/02/31/47/993023147.db2.gz VJASYOPMTFJASB-LBPRGKRZSA-N 1 2 246.358 2.312 20 0 BEADLO CC(C)=CCC[C@@H](C)NC(=O)C[C@@H]([NH3+])C(F)F ZINC001575390016 993035077 /nfs/dbraw/zinc/03/50/77/993035077.db2.gz NUXIHBDPLFCIBD-NXEZZACHSA-N 1 2 248.317 2.220 20 0 BEADLO C[C@@H](Nc1cc(CO)cc[nH+]1)C1(C)CC1 ZINC001262710670 993050417 /nfs/dbraw/zinc/05/04/17/993050417.db2.gz YGOBQIUGHLEZMF-SECBINFHSA-N 1 2 206.289 2.174 20 0 BEADLO CCNc1ccc(Nc2ccnc(C)n2)c[nH+]1 ZINC001262735352 993056803 /nfs/dbraw/zinc/05/68/03/993056803.db2.gz ALXFRRMESGCRSK-UHFFFAOYSA-N 1 2 229.287 2.355 20 0 BEADLO C[C@@H]([NH2+]Cc1ccc2[nH]ccc2c1)c1cnn[nH]1 ZINC001575695660 993096649 /nfs/dbraw/zinc/09/66/49/993096649.db2.gz GKPPTVBYPKDYRZ-SECBINFHSA-N 1 2 241.298 2.137 20 0 BEADLO CC[C@@H]([NH2+][C@@H]1C[C@@H]2CC[C@@H](C2)C1)c1cn[nH]n1 ZINC001576288601 993259064 /nfs/dbraw/zinc/25/90/64/993259064.db2.gz HSMWWHKYDUAWIY-WRWGMCAJSA-N 1 2 234.347 2.424 20 0 BEADLO CC[C@@H]([NH2+][C@@H]1C[C@@H]2CC[C@@H](C2)C1)c1c[nH]nn1 ZINC001576288601 993259073 /nfs/dbraw/zinc/25/90/73/993259073.db2.gz HSMWWHKYDUAWIY-WRWGMCAJSA-N 1 2 234.347 2.424 20 0 BEADLO CC(C)[C@@H](C)C(=O)OCCCc1c[nH+]cn1C ZINC001263510080 993351836 /nfs/dbraw/zinc/35/18/36/993351836.db2.gz QCUXMEHMLMGHQT-LLVKDONJSA-N 1 2 238.331 2.188 20 0 BEADLO CC[C@@H]1C[C@H]1C[NH2+][C@](C)(CC)c1cn[nH]n1 ZINC001576608418 993365759 /nfs/dbraw/zinc/36/57/59/993365759.db2.gz AIGROKOLKNRERS-JFGNBEQYSA-N 1 2 222.336 2.066 20 0 BEADLO CC[C@@H]1C[C@H]1C[NH2+][C@](C)(CC)c1c[nH]nn1 ZINC001576608418 993365766 /nfs/dbraw/zinc/36/57/66/993365766.db2.gz AIGROKOLKNRERS-JFGNBEQYSA-N 1 2 222.336 2.066 20 0 BEADLO CC[C@@H]1C[C@H]1C[NH2+][C@@](C)(CC)c1cn[nH]n1 ZINC001576608419 993366610 /nfs/dbraw/zinc/36/66/10/993366610.db2.gz AIGROKOLKNRERS-SCVCMEIPSA-N 1 2 222.336 2.066 20 0 BEADLO CC[C@@H]1C[C@H]1C[NH2+][C@@](C)(CC)c1c[nH]nn1 ZINC001576608419 993366615 /nfs/dbraw/zinc/36/66/15/993366615.db2.gz AIGROKOLKNRERS-SCVCMEIPSA-N 1 2 222.336 2.066 20 0 BEADLO CC(C)(COC(=O)CC1CCC1)n1cc[nH+]c1 ZINC001263543414 993376631 /nfs/dbraw/zinc/37/66/31/993376631.db2.gz AKBTXAYHLPLMPL-UHFFFAOYSA-N 1 2 236.315 2.352 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2ncc(C)s2)[nH]n1 ZINC000381219016 993379195 /nfs/dbraw/zinc/37/91/95/993379195.db2.gz ILTZQPGMJGMVQV-SECBINFHSA-N 1 2 236.344 2.334 20 0 BEADLO c1cc2cc(N[C@H]3CCCOC3)[nH+]cc2[nH]1 ZINC000381268655 993382242 /nfs/dbraw/zinc/38/22/42/993382242.db2.gz UWXOHJAZRKMUNT-JTQLQIEISA-N 1 2 217.272 2.154 20 0 BEADLO CC[C@H]([NH2+]Cc1ncn[nH]1)C1CCCCC1 ZINC000381551156 993405063 /nfs/dbraw/zinc/40/50/63/993405063.db2.gz MUBDBJSSTKGFNJ-NSHDSACASA-N 1 2 222.336 2.253 20 0 BEADLO COc1cc2[nH+]c([C@@H]3CCOC3)[nH]c2cc1C ZINC000586912833 993417912 /nfs/dbraw/zinc/41/79/12/993417912.db2.gz WUDFSJTUFNGQOR-SECBINFHSA-N 1 2 232.283 2.384 20 0 BEADLO CCn1c[nH+]cc1COC(=O)C[C@@H]1CC[C@H]2C[C@H]21 ZINC001263663113 993454465 /nfs/dbraw/zinc/45/44/65/993454465.db2.gz VEUBLMTYQZNIEK-GMXVVIOVSA-N 1 2 248.326 2.382 20 0 BEADLO CCn1c[nH+]cc1COC(=O)c1cc(C)co1 ZINC001263662663 993455410 /nfs/dbraw/zinc/45/54/10/993455410.db2.gz IUSWTDKPYQDRJM-UHFFFAOYSA-N 1 2 234.255 2.161 20 0 BEADLO C[C@@H](C[N@@H+]1CCCC(=O)C1)c1ccccc1 ZINC000384679652 993613677 /nfs/dbraw/zinc/61/36/77/993613677.db2.gz DJBBXNKJRDXFFI-LBPRGKRZSA-N 1 2 217.312 2.455 20 0 BEADLO C[C@@H](C[N@H+]1CCCC(=O)C1)c1ccccc1 ZINC000384679652 993613686 /nfs/dbraw/zinc/61/36/86/993613686.db2.gz DJBBXNKJRDXFFI-LBPRGKRZSA-N 1 2 217.312 2.455 20 0 BEADLO Cc1ccnc(C[NH2+]Cc2nccs2)c1 ZINC000392860854 993888352 /nfs/dbraw/zinc/88/83/52/993888352.db2.gz MQMNGCHXALNOMU-UHFFFAOYSA-N 1 2 219.313 2.136 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1ccc(Cl)cc1 ZINC001290165988 994528976 /nfs/dbraw/zinc/52/89/76/994528976.db2.gz RBYOOIHAMMDVJI-LLVKDONJSA-N 1 2 238.718 2.373 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1ccc(Cl)cc1 ZINC001290165988 994528989 /nfs/dbraw/zinc/52/89/89/994528989.db2.gz RBYOOIHAMMDVJI-LLVKDONJSA-N 1 2 238.718 2.373 20 0 BEADLO C[C@H]1CC[C@H]1NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001333969984 994551291 /nfs/dbraw/zinc/55/12/91/994551291.db2.gz SNTUYKWHKWTQQF-WCBMZHEXSA-N 1 2 229.283 2.091 20 0 BEADLO C[C@@H]1CC[C@@H]1NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001333969972 994552582 /nfs/dbraw/zinc/55/25/82/994552582.db2.gz SNTUYKWHKWTQQF-SCZZXKLOSA-N 1 2 229.283 2.091 20 0 BEADLO CC[C@@H]1CCC[C@@H](NC(=O)Cc2[nH]c[nH+]c2C)C1 ZINC001293702021 994661746 /nfs/dbraw/zinc/66/17/46/994661746.db2.gz GRKYTGVGVSRADO-VXGBXAGGSA-N 1 2 249.358 2.346 20 0 BEADLO CC(C)CCCCNC(=O)CCc1[nH]cc[nH+]1 ZINC001293790081 994664561 /nfs/dbraw/zinc/66/45/61/994664561.db2.gz RKIKMSRCNPWPRZ-UHFFFAOYSA-N 1 2 237.347 2.285 20 0 BEADLO C=C/C=C\CC(=O)NCCCNc1cccc[nH+]1 ZINC001293928264 994674092 /nfs/dbraw/zinc/67/40/92/994674092.db2.gz DILUWNMYBJGMRE-ARJAWSKDSA-N 1 2 245.326 2.132 20 0 BEADLO C=C/C=C\CCNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001303176435 995137846 /nfs/dbraw/zinc/13/78/46/995137846.db2.gz LQVCAIIWWTUUSN-ARJAWSKDSA-N 1 2 241.294 2.425 20 0 BEADLO CC(C)c1oncc1NC(=O)CCn1cc[nH+]c1 ZINC001337356727 995170526 /nfs/dbraw/zinc/17/05/26/995170526.db2.gz MTSWJPOUXVGBLU-UHFFFAOYSA-N 1 2 248.286 2.023 20 0 BEADLO COc1nscc1C[N@@H+]1CCS[C@H](C)C1 ZINC001308025883 995523016 /nfs/dbraw/zinc/52/30/16/995523016.db2.gz YLMQDNLWENLPSF-MRVPVSSYSA-N 1 2 244.385 2.089 20 0 BEADLO COc1nscc1C[N@H+]1CCS[C@H](C)C1 ZINC001308025883 995523022 /nfs/dbraw/zinc/52/30/22/995523022.db2.gz YLMQDNLWENLPSF-MRVPVSSYSA-N 1 2 244.385 2.089 20 0 BEADLO CCC[C@H]([NH2+]Cc1cc[nH]n1)c1ccccn1 ZINC001308248688 995602017 /nfs/dbraw/zinc/60/20/17/995602017.db2.gz LGFXYSIHDXMAGX-LBPRGKRZSA-N 1 2 230.315 2.436 20 0 BEADLO CCc1ccc(C[NH+]2CCC(=O)CC2)s1 ZINC000019438834 1170124108 /nfs/dbraw/zinc/12/41/08/1170124108.db2.gz DRMKNCCJOBQPRA-UHFFFAOYSA-N 1 2 223.341 2.475 20 0 BEADLO CCc1nnc([C@H](C)[NH2+]Cc2ccc(F)cc2)[nH]1 ZINC001620887872 1170165026 /nfs/dbraw/zinc/16/50/26/1170165026.db2.gz XGDLTQLHLOEOML-VIFPVBQESA-N 1 2 248.305 2.357 20 0 BEADLO FC1CN(c2nc3ccccc3n3c[nH+]cc23)C1 ZINC001612177444 1170451970 /nfs/dbraw/zinc/45/19/70/1170451970.db2.gz FDKIMAMDZVXTGY-UHFFFAOYSA-N 1 2 242.257 2.041 20 0 BEADLO C[C@H]1CN(C(=O)c2cccc3[nH+]ccn32)C[C@@H]1C ZINC001618560484 1170641389 /nfs/dbraw/zinc/64/13/89/1170641389.db2.gz LXFXRQQFITVFPY-QWRGUYRKSA-N 1 2 243.310 2.062 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)Nc1cc(C)cc(F)c1 ZINC001622411762 1170886184 /nfs/dbraw/zinc/88/61/84/1170886184.db2.gz WXVRSONNDSXIIJ-UHFFFAOYSA-N 1 2 247.273 2.347 20 0 BEADLO C[C@H]1C[C@H]1c1[nH]c2cc3c(cc2[nH+]1)OCCO3 ZINC000037400496 1170941324 /nfs/dbraw/zinc/94/13/24/1170941324.db2.gz ADPKWYQMWRMXHC-JGVFFNPUSA-N 1 2 230.267 2.458 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)[C@@H]1CCC[C@@H](C)C1 ZINC001623929412 1170986149 /nfs/dbraw/zinc/98/61/49/1170986149.db2.gz FXIFJFLBJVQBKW-ZYHUDNBSSA-N 1 2 249.358 2.298 20 0 BEADLO CCO/C=C/C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC001627313059 1171163762 /nfs/dbraw/zinc/16/37/62/1171163762.db2.gz FVLVFXMFBYJZFB-VOTSOKGWSA-N 1 2 245.282 2.131 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1C[C@@H](C)CCC[C@H]1C ZINC001628176238 1171213862 /nfs/dbraw/zinc/21/38/62/1171213862.db2.gz WYJDXLYWBAANCM-WDEREUQCSA-N 1 2 249.358 2.298 20 0 BEADLO CC[C@H](CC(F)F)C(=O)NCc1[nH]c[nH+]c1C ZINC001630479671 1171398161 /nfs/dbraw/zinc/39/81/61/1171398161.db2.gz CUSGPWZBTXFQBV-MRVPVSSYSA-N 1 2 245.273 2.016 20 0 BEADLO C=C/C=C\CC(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC001632283273 1171501214 /nfs/dbraw/zinc/50/12/14/1171501214.db2.gz QJDPYQKFOVYBTF-MVZIDQBPSA-N 1 2 245.326 2.248 20 0 BEADLO CC(C)c1cc(NC(=O)CCc2[nH]cc[nH+]2)no1 ZINC001634642551 1171668995 /nfs/dbraw/zinc/66/89/95/1171668995.db2.gz JDPVWANQCGIFQP-UHFFFAOYSA-N 1 2 248.286 2.092 20 0 BEADLO c1cn(CCCNc2ccc3c(c2)OCO3)c[nH+]1 ZINC000049327861 1171688683 /nfs/dbraw/zinc/68/86/83/1171688683.db2.gz HWPPGXBSZACUKB-UHFFFAOYSA-N 1 2 245.282 2.114 20 0 BEADLO CCc1[nH]c(CNC(=O)C[C@H]2CCC[C@H]2C)c[nH+]1 ZINC001635610461 1171742556 /nfs/dbraw/zinc/74/25/56/1171742556.db2.gz MQTFXOQLTXGBAH-GHMZBOCLSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)C[C@H]2CCC[C@H]2C)[nH+]1 ZINC001635610461 1171742561 /nfs/dbraw/zinc/74/25/61/1171742561.db2.gz MQTFXOQLTXGBAH-GHMZBOCLSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]c(CNC(=O)C[C@@H]2CC[C@@H]3C[C@@H]32)c[nH+]1 ZINC001635610673 1171743284 /nfs/dbraw/zinc/74/32/84/1171743284.db2.gz QWFYNUYCHBWREU-SCVCMEIPSA-N 1 2 247.342 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)C[C@@H]2CC[C@@H]3C[C@@H]32)[nH+]1 ZINC001635610673 1171743290 /nfs/dbraw/zinc/74/32/90/1171743290.db2.gz QWFYNUYCHBWREU-SCVCMEIPSA-N 1 2 247.342 2.025 20 0 BEADLO CCc1[nH]c(CNC(=O)C[C@@H]2CC[C@H]3C[C@H]32)c[nH+]1 ZINC001635610670 1171744042 /nfs/dbraw/zinc/74/40/42/1171744042.db2.gz QWFYNUYCHBWREU-JBLDHEPKSA-N 1 2 247.342 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)C[C@@H]2CC[C@H]3C[C@H]32)[nH+]1 ZINC001635610670 1171744053 /nfs/dbraw/zinc/74/40/53/1171744053.db2.gz QWFYNUYCHBWREU-JBLDHEPKSA-N 1 2 247.342 2.025 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1ccc(C)c(O)c1C ZINC001635820285 1171765064 /nfs/dbraw/zinc/76/50/64/1171765064.db2.gz AUZNTOJKSKSZGU-LBPRGKRZSA-N 1 2 248.326 2.042 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1ccc(C)c(O)c1C ZINC001635820285 1171765071 /nfs/dbraw/zinc/76/50/71/1171765071.db2.gz AUZNTOJKSKSZGU-LBPRGKRZSA-N 1 2 248.326 2.042 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)C2(C3CC3)CC2)[nH+]1 ZINC001636016999 1171784959 /nfs/dbraw/zinc/78/49/59/1171784959.db2.gz UUOXMDQGTAMBIT-UHFFFAOYSA-N 1 2 247.342 2.340 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)C2(C3CC3)CC2)c[nH+]1 ZINC001636016999 1171784961 /nfs/dbraw/zinc/78/49/61/1171784961.db2.gz UUOXMDQGTAMBIT-UHFFFAOYSA-N 1 2 247.342 2.340 20 0 BEADLO CCCNc1ccc(Cn2ccccc2=O)c[nH+]1 ZINC000050818472 1171843561 /nfs/dbraw/zinc/84/35/61/1171843561.db2.gz HISPOGHHXTWBMR-UHFFFAOYSA-N 1 2 243.310 2.114 20 0 BEADLO CC(C)c1coc(NC(=O)CCc2[nH]cc[nH+]2)n1 ZINC001637055364 1171896814 /nfs/dbraw/zinc/89/68/14/1171896814.db2.gz DLVYBTWOVHDCMX-UHFFFAOYSA-N 1 2 248.286 2.092 20 0 BEADLO COc1cc(C)[nH+]c(COCc2n[nH]cc2C)c1 ZINC000650346129 398136556 /nfs/dbraw/zinc/13/65/56/398136556.db2.gz RCLJKILYAPFWFC-UHFFFAOYSA-N 1 2 247.298 2.147 20 0 BEADLO CCC(CC)(CC)NC(=O)Cc1[nH]c[nH+]c1C ZINC000279379339 168316166 /nfs/dbraw/zinc/31/61/66/168316166.db2.gz HTTQQRIUIWYDPW-UHFFFAOYSA-N 1 2 237.347 2.346 20 0 BEADLO C[N@H+](Cc1cnccn1)Cc1ccc(F)cc1F ZINC000084863562 136211624 /nfs/dbraw/zinc/21/16/24/136211624.db2.gz DGRADPQBLJREDB-UHFFFAOYSA-N 1 2 249.264 2.387 20 0 BEADLO C[N@@H+](Cc1cnccn1)Cc1ccc(F)cc1F ZINC000084863562 136211625 /nfs/dbraw/zinc/21/16/25/136211625.db2.gz DGRADPQBLJREDB-UHFFFAOYSA-N 1 2 249.264 2.387 20 0 BEADLO Nc1[nH+]cnc(N[C@@H]2CCCC[C@H]2F)c1Cl ZINC000378701451 346810986 /nfs/dbraw/zinc/81/09/86/346810986.db2.gz JXNKJJOOGVGOCT-RNFRBKRXSA-N 1 2 244.701 2.405 20 0 BEADLO Nc1nc[nH+]c(N[C@@H]2CCCC[C@H]2F)c1Cl ZINC000378701451 346810990 /nfs/dbraw/zinc/81/09/90/346810990.db2.gz JXNKJJOOGVGOCT-RNFRBKRXSA-N 1 2 244.701 2.405 20 0 BEADLO CCC(C)(C)NC(=O)[C@@H]1CCn2cc(C)[nH+]c2C1 ZINC000623721377 349475751 /nfs/dbraw/zinc/47/57/51/349475751.db2.gz YKLLFTKFBKKSLI-LLVKDONJSA-N 1 2 249.358 2.059 20 0 BEADLO CC(C)n1cc(C[NH2+][C@H](C)C(F)F)cn1 ZINC000389924698 398149561 /nfs/dbraw/zinc/14/95/61/398149561.db2.gz UZKKFUIMTRVLNI-MRVPVSSYSA-N 1 2 217.263 2.207 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@H](OCC(C)C)C2)no1 ZINC000119681382 178004059 /nfs/dbraw/zinc/00/40/59/178004059.db2.gz OGRHRKCPNINKPQ-ZDUSSCGKSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@H](OCC(C)C)C2)no1 ZINC000119681382 178004060 /nfs/dbraw/zinc/00/40/60/178004060.db2.gz OGRHRKCPNINKPQ-ZDUSSCGKSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cc(C[N@@H+]2CC[S@@](=O)[C@@H](C)C2)cs1 ZINC000336224009 178004095 /nfs/dbraw/zinc/00/40/95/178004095.db2.gz AXVKVEWSEVJNMX-ZUZCIYMTSA-N 1 2 243.397 2.009 20 0 BEADLO Cc1cc(C[N@H+]2CC[S@@](=O)[C@@H](C)C2)cs1 ZINC000336224009 178004097 /nfs/dbraw/zinc/00/40/97/178004097.db2.gz AXVKVEWSEVJNMX-ZUZCIYMTSA-N 1 2 243.397 2.009 20 0 BEADLO COC(=O)[C@H]([NH2+][C@@H]1C=CCCCCC1)C1CC1 ZINC000339107905 398151232 /nfs/dbraw/zinc/15/12/32/398151232.db2.gz KPQLJPBOUWSMLW-CHWSQXEVSA-N 1 2 237.343 2.417 20 0 BEADLO Cc1cc(C[N@@H+]2CCn3cccc3[C@H]2C)n(C)n1 ZINC000335153323 178005573 /nfs/dbraw/zinc/00/55/73/178005573.db2.gz HNMKXZIADPJFCA-GFCCVEGCSA-N 1 2 244.342 2.107 20 0 BEADLO Cc1cc(C[N@H+]2CCn3cccc3[C@H]2C)n(C)n1 ZINC000335153323 178005574 /nfs/dbraw/zinc/00/55/74/178005574.db2.gz HNMKXZIADPJFCA-GFCCVEGCSA-N 1 2 244.342 2.107 20 0 BEADLO COc1cc(C)[nH+]c(CN[C@@H](C)C(F)F)c1 ZINC000389953194 398152243 /nfs/dbraw/zinc/15/22/43/398152243.db2.gz YGVCJPVBBYSMFY-QMMMGPOBSA-N 1 2 230.258 2.142 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2cccnc2)no1 ZINC000044296626 178032296 /nfs/dbraw/zinc/03/22/96/178032296.db2.gz HNFZVMDEMLFXRM-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO Cc1ccc(C[NH2+]CC(C)(F)F)cn1 ZINC000378734899 346817844 /nfs/dbraw/zinc/81/78/44/346817844.db2.gz MMVYRYIHSARSKM-UHFFFAOYSA-N 1 2 200.232 2.135 20 0 BEADLO CC(C)CC[C@@H](C)NC(=O)CCn1cc[nH+]c1 ZINC000072619967 398182120 /nfs/dbraw/zinc/18/21/20/398182120.db2.gz ZCYBECPJEOMHMC-GFCCVEGCSA-N 1 2 237.347 2.214 20 0 BEADLO C[N@H+](Cc1cocn1)C1CC(OC(C)(C)C)C1 ZINC000421377794 192323189 /nfs/dbraw/zinc/32/31/89/192323189.db2.gz UISVZLQMBIZARC-UHFFFAOYSA-N 1 2 238.331 2.453 20 0 BEADLO C[N@@H+](Cc1cocn1)C1CC(OC(C)(C)C)C1 ZINC000421377794 192323191 /nfs/dbraw/zinc/32/31/91/192323191.db2.gz UISVZLQMBIZARC-UHFFFAOYSA-N 1 2 238.331 2.453 20 0 BEADLO Cc1cc(Cl)ccc1C[NH+]1CCOCC1 ZINC000136132553 178066191 /nfs/dbraw/zinc/06/61/91/178066191.db2.gz SJLNPDGNADQQGE-UHFFFAOYSA-N 1 2 225.719 2.481 20 0 BEADLO Cc1cc(Cl)ccc1C(=O)NCc1[nH]cc[nH+]1 ZINC000125371854 178066413 /nfs/dbraw/zinc/06/64/13/178066413.db2.gz XPDBMURPXLRJGH-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000649907988 398182631 /nfs/dbraw/zinc/18/26/31/398182631.db2.gz DNBLWHIPKNEYJO-CBAPKCEASA-N 1 2 245.298 2.330 20 0 BEADLO C[C@@H](c1csnn1)[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000649907988 398182632 /nfs/dbraw/zinc/18/26/32/398182632.db2.gz DNBLWHIPKNEYJO-CBAPKCEASA-N 1 2 245.298 2.330 20 0 BEADLO Cc1cc(Cl)cnc1NCc1c[nH+]cn1C ZINC000292494206 178071827 /nfs/dbraw/zinc/07/18/27/178071827.db2.gz JIKVLRCNOBPFKZ-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO Cc1cc(Cl)cnc1NCc1[nH+]ccn1C ZINC000292577269 178071886 /nfs/dbraw/zinc/07/18/86/178071886.db2.gz PCZFWCBFPARUDI-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO Cc1cc(F)cc(NC(=O)CCc2[nH]cc[nH+]2)c1 ZINC000355033816 178078187 /nfs/dbraw/zinc/07/81/87/178078187.db2.gz XSIFYSOZWTUMEN-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+]1CCO[C@H](C)C1 ZINC000179865022 178084748 /nfs/dbraw/zinc/08/47/48/178084748.db2.gz WQZQNQXUBUBQQJ-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cc(F)ccc1C[N@H+]1CCO[C@H](C)C1 ZINC000179865022 178084750 /nfs/dbraw/zinc/08/47/50/178084750.db2.gz WQZQNQXUBUBQQJ-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cc(N(C)CC(C)(C)O)nc(C(C)C)[nH+]1 ZINC000092969888 178096159 /nfs/dbraw/zinc/09/61/59/178096159.db2.gz HTLFAPQAXZCIDO-UHFFFAOYSA-N 1 2 237.347 2.116 20 0 BEADLO CCC(CC)C(=O)N[C@H](c1[nH+]ccn1C)C1CC1 ZINC000341685461 168340045 /nfs/dbraw/zinc/34/00/45/168340045.db2.gz DHFBGYUFHCSBAI-LBPRGKRZSA-N 1 2 249.358 2.424 20 0 BEADLO COc1ccc(C[N@@H+](C)[C@H](C)c2ccco2)nn1 ZINC000338239161 187326321 /nfs/dbraw/zinc/32/63/21/187326321.db2.gz ZTEMWEIXKNIUSQ-SNVBAGLBSA-N 1 2 247.298 2.271 20 0 BEADLO Cc1cc(N)nc(SCc2ncccc2C)[nH+]1 ZINC000092849715 178109854 /nfs/dbraw/zinc/10/98/54/178109854.db2.gz IGCCMLCEQUSCKU-UHFFFAOYSA-N 1 2 246.339 2.363 20 0 BEADLO Cc1cc(N2CCCCC[C@H]2C[C@@H](C)O)nc[nH+]1 ZINC000336785034 178112674 /nfs/dbraw/zinc/11/26/74/178112674.db2.gz AVVAFFRNNLPQON-OLZOCXBDSA-N 1 2 249.358 2.305 20 0 BEADLO Cc1cc(N2CCC2)nc(-c2ccncc2)[nH+]1 ZINC000112073566 178112794 /nfs/dbraw/zinc/11/27/94/178112794.db2.gz ZKMOLBFVBBVWND-UHFFFAOYSA-N 1 2 226.283 2.057 20 0 BEADLO COc1ccc(C[N@H+](C)[C@H](C)c2ccco2)nn1 ZINC000338239161 187326319 /nfs/dbraw/zinc/32/63/19/187326319.db2.gz ZTEMWEIXKNIUSQ-SNVBAGLBSA-N 1 2 247.298 2.271 20 0 BEADLO Cc1cc(N2CC[C@@H](OCCC(C)C)C2)nc[nH+]1 ZINC000301572453 178118220 /nfs/dbraw/zinc/11/82/20/178118220.db2.gz MQOYHQGHMYIYMM-CYBMUJFWSA-N 1 2 249.358 2.426 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H](C)C1CC1 ZINC000175319557 365544024 /nfs/dbraw/zinc/54/40/24/365544024.db2.gz DLKDNHYLLPMHLE-SECBINFHSA-N 1 2 204.273 2.375 20 0 BEADLO Cc1cc(NC(=O)CCc2[nH]cc[nH+]2)ccc1F ZINC000353087970 178127817 /nfs/dbraw/zinc/12/78/17/178127817.db2.gz VPNMPKXJSUQPHQ-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO C[C@@H]1C[C@H]([NH2+]Cc2ccoc2)c2nccn21 ZINC000293853259 398204808 /nfs/dbraw/zinc/20/48/08/398204808.db2.gz CVCOGGMHUDVCEZ-KOLCDFICSA-N 1 2 217.272 2.272 20 0 BEADLO Cc1cc(NC(=O)COc2ccccc2)cc[nH+]1 ZINC000010163092 178132003 /nfs/dbraw/zinc/13/20/03/178132003.db2.gz STXQPBWCVXHDSZ-UHFFFAOYSA-N 1 2 242.278 2.408 20 0 BEADLO Cc1cc(NC(=O)CSC2CC2)cc[nH+]1 ZINC000294864572 178133005 /nfs/dbraw/zinc/13/30/05/178133005.db2.gz BGYVHJLIGOJWJQ-UHFFFAOYSA-N 1 2 222.313 2.224 20 0 BEADLO Cc1cc(NC(=O)N(C)CC(F)F)cc[nH+]1 ZINC000119934093 178135917 /nfs/dbraw/zinc/13/59/17/178135917.db2.gz CWTUNIXFJSUNHC-UHFFFAOYSA-N 1 2 229.230 2.119 20 0 BEADLO Cc1cc(NC(=O)N2CCC=C(F)C2)cc[nH+]1 ZINC000274656160 178136498 /nfs/dbraw/zinc/13/64/98/178136498.db2.gz OFXMBOKHLFYCGC-UHFFFAOYSA-N 1 2 235.262 2.481 20 0 BEADLO Cc1cc(NC(=O)NC[C@H]2C[C@H]2C)cc[nH+]1 ZINC000271079473 178140116 /nfs/dbraw/zinc/14/01/16/178140116.db2.gz QGQGXSXUXUEYNW-PSASIEDQSA-N 1 2 219.288 2.168 20 0 BEADLO Cc1cc(NC[C@@H](C)CCO)nc(C2CC2)[nH+]1 ZINC000266215001 178165530 /nfs/dbraw/zinc/16/55/30/178165530.db2.gz OOEYHUCDORNPPW-VIFPVBQESA-N 1 2 235.331 2.093 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CCCS2)cc[nH+]1 ZINC000266540409 178144895 /nfs/dbraw/zinc/14/48/95/178144895.db2.gz GREVVSLCLBFGAB-JTQLQIEISA-N 1 2 222.313 2.224 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)Cc1scnc1C1CC1 ZINC000494931046 538927180 /nfs/dbraw/zinc/92/71/80/538927180.db2.gz NOKSXRIFJRXXEZ-UHFFFAOYSA-N 1 2 248.355 2.376 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)Cc1scnc1C1CC1 ZINC000494931046 538927182 /nfs/dbraw/zinc/92/71/82/538927182.db2.gz NOKSXRIFJRXXEZ-UHFFFAOYSA-N 1 2 248.355 2.376 20 0 BEADLO Cc1cc(NC(=O)[C@]2(C)C[C@H]3CC[C@@H]2O3)cc[nH+]1 ZINC000191633143 178149204 /nfs/dbraw/zinc/14/92/04/178149204.db2.gz CQLSUZFBRWKQQD-MBNYWOFBSA-N 1 2 246.310 2.286 20 0 BEADLO Cc1cc(NCC(C)(C)CCO)nc(C2CC2)[nH+]1 ZINC000266202935 178155833 /nfs/dbraw/zinc/15/58/33/178155833.db2.gz KAQHYZTVVZAKPY-UHFFFAOYSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1cc(NCC2=CCCOC2)nc(C2CC2)[nH+]1 ZINC000288557779 178157378 /nfs/dbraw/zinc/15/73/78/178157378.db2.gz PYKBFFJEUWQATH-UHFFFAOYSA-N 1 2 245.326 2.421 20 0 BEADLO Cc1cc(NCCC(C)(C)O)nc(C(C)C)[nH+]1 ZINC000302363331 178158032 /nfs/dbraw/zinc/15/80/32/178158032.db2.gz BWWLACUDGLLPOH-UHFFFAOYSA-N 1 2 237.347 2.481 20 0 BEADLO CC(C)Cc1noc(C[N@@H+]2C[C@@H](C)[C@H]2C)n1 ZINC000339575502 187329642 /nfs/dbraw/zinc/32/96/42/187329642.db2.gz SJQWYFLOTQQTSK-NXEZZACHSA-N 1 2 223.320 2.108 20 0 BEADLO CC(C)Cc1noc(C[N@H+]2C[C@@H](C)[C@H]2C)n1 ZINC000339575502 187329643 /nfs/dbraw/zinc/32/96/43/187329643.db2.gz SJQWYFLOTQQTSK-NXEZZACHSA-N 1 2 223.320 2.108 20 0 BEADLO Cc1cc(NCCc2cccc(O)c2)nc[nH+]1 ZINC000301258907 178163033 /nfs/dbraw/zinc/16/30/33/178163033.db2.gz URPLKUVDAWBZSH-UHFFFAOYSA-N 1 2 229.283 2.145 20 0 BEADLO Cc1cc(NCCc2ccco2)nc[nH+]1 ZINC000040727374 178163598 /nfs/dbraw/zinc/16/35/98/178163598.db2.gz NUTWBBYQRCRXJH-UHFFFAOYSA-N 1 2 203.245 2.033 20 0 BEADLO Cc1cc(NC[C@H](O)C(C)C)nc(C(C)C)[nH+]1 ZINC000125348630 178168479 /nfs/dbraw/zinc/16/84/79/178168479.db2.gz LDVQOTMKSMXZTJ-NSHDSACASA-N 1 2 237.347 2.337 20 0 BEADLO Cc1cc(NC[C@H]2CC[C@@H](O)C2)nc(C2CC2)[nH+]1 ZINC000191638656 178170538 /nfs/dbraw/zinc/17/05/38/178170538.db2.gz BAYXIRGSERGIFY-CMPLNLGQSA-N 1 2 247.342 2.235 20 0 BEADLO Cc1cc(NCc2cccc3c2OCO3)nc[nH+]1 ZINC000040727448 178172758 /nfs/dbraw/zinc/17/27/58/178172758.db2.gz BRWXATJFHGLVJY-UHFFFAOYSA-N 1 2 243.266 2.126 20 0 BEADLO Cc1cc(N[C@H]2CCCC[C@@H]2O)nc(C2CC2)[nH+]1 ZINC000186105571 178188576 /nfs/dbraw/zinc/18/85/76/178188576.db2.gz VCKYLNYOUAWSJG-RYUDHWBXSA-N 1 2 247.342 2.378 20 0 BEADLO Cc1cc(N[C@@H](C)c2ccncc2F)nc[nH+]1 ZINC000337824033 178180246 /nfs/dbraw/zinc/18/02/46/178180246.db2.gz RZHUUHBFVPLDFE-VIFPVBQESA-N 1 2 232.262 2.492 20 0 BEADLO Cc1cc(N[C@@H]2CCO[C@H](C(C)C)C2)nc[nH+]1 ZINC000357216547 178183089 /nfs/dbraw/zinc/18/30/89/178183089.db2.gz YCBIDVTYQNNZJB-NEPJUHHUSA-N 1 2 235.331 2.401 20 0 BEADLO Cc1cc(N[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)nc[nH+]1 ZINC000301799248 178184640 /nfs/dbraw/zinc/18/46/40/178184640.db2.gz BLMFIHMEBFNTSE-UHTWSYAYSA-N 1 2 245.326 2.155 20 0 BEADLO Cc1cc(N[C@H](C)CCCO)nc(C2CC2)[nH+]1 ZINC000268000318 178185945 /nfs/dbraw/zinc/18/59/45/178185945.db2.gz BJBXWIPPVQKXQC-SECBINFHSA-N 1 2 235.331 2.235 20 0 BEADLO Cc1cc(N[C@H](C)[C@H]2CCCCO2)nc[nH+]1 ZINC000309762501 178186135 /nfs/dbraw/zinc/18/61/35/178186135.db2.gz IZEPDTRYCQKQNL-GHMZBOCLSA-N 1 2 221.304 2.155 20 0 BEADLO Cc1cc(N[C@H](C)c2cncc(F)c2)nc[nH+]1 ZINC000359099093 178186909 /nfs/dbraw/zinc/18/69/09/178186909.db2.gz NVIWKUWPWDPMSJ-SECBINFHSA-N 1 2 232.262 2.492 20 0 BEADLO Cc1cc(N[C@H](C)c2ccncc2F)nc[nH+]1 ZINC000337824032 178188007 /nfs/dbraw/zinc/18/80/07/178188007.db2.gz RZHUUHBFVPLDFE-SECBINFHSA-N 1 2 232.262 2.492 20 0 BEADLO c1c[nH+]c(-c2ccc(O[C@H]3CCOC3)cc2)[nH]1 ZINC000649428211 398229493 /nfs/dbraw/zinc/22/94/93/398229493.db2.gz LDFQJSQMFMOEIM-LBPRGKRZSA-N 1 2 230.267 2.244 20 0 BEADLO Cc1nn(C)c(C)c1Nc1cc(C)[nH+]c(C)n1 ZINC000298282715 178191618 /nfs/dbraw/zinc/19/16/18/178191618.db2.gz LUGVWAJORGVXSS-UHFFFAOYSA-N 1 2 231.303 2.187 20 0 BEADLO Cc1cc(Nc2cnn(C)c2)nc(C(C)C)[nH+]1 ZINC000035781555 178193612 /nfs/dbraw/zinc/19/36/12/178193612.db2.gz MJHTWXOYFYRSOQ-UHFFFAOYSA-N 1 2 231.303 2.386 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2[nH]ncc2C)C[C@H](CC)O1 ZINC000421385471 192325239 /nfs/dbraw/zinc/32/52/39/192325239.db2.gz GMIGZEUGQAQZMN-TXEJJXNPSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2[nH]ncc2C)C[C@H](CC)O1 ZINC000421385471 192325242 /nfs/dbraw/zinc/32/52/42/192325242.db2.gz GMIGZEUGQAQZMN-TXEJJXNPSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2n[nH]cc2C)C[C@H](CC)O1 ZINC000421385471 192325245 /nfs/dbraw/zinc/32/52/45/192325245.db2.gz GMIGZEUGQAQZMN-TXEJJXNPSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2n[nH]cc2C)C[C@H](CC)O1 ZINC000421385471 192325247 /nfs/dbraw/zinc/32/52/47/192325247.db2.gz GMIGZEUGQAQZMN-TXEJJXNPSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cocn2)C[C@H](CC)O1 ZINC000421392239 192328117 /nfs/dbraw/zinc/32/81/17/192328117.db2.gz QQRXVKJIXCPGFN-TXEJJXNPSA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cocn2)C[C@H](CC)O1 ZINC000421392239 192328119 /nfs/dbraw/zinc/32/81/19/192328119.db2.gz QQRXVKJIXCPGFN-TXEJJXNPSA-N 1 2 224.304 2.064 20 0 BEADLO COC(=O)[C@H](C)[NH2+]C1CC2(C1)CCCCC2 ZINC000421401634 192330800 /nfs/dbraw/zinc/33/08/00/192330800.db2.gz VSJCYQXTVRNTOR-JTQLQIEISA-N 1 2 225.332 2.250 20 0 BEADLO CCc1cnc(C[N@@H+]2CC[C@@]23CCOC3)s1 ZINC000421400567 192331072 /nfs/dbraw/zinc/33/10/72/192331072.db2.gz KDFMRBUXHAYCIK-LBPRGKRZSA-N 1 2 238.356 2.070 20 0 BEADLO CCc1cnc(C[N@H+]2CC[C@@]23CCOC3)s1 ZINC000421400567 192331074 /nfs/dbraw/zinc/33/10/74/192331074.db2.gz KDFMRBUXHAYCIK-LBPRGKRZSA-N 1 2 238.356 2.070 20 0 BEADLO CC(C)(C)C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cn1 ZINC000649433440 398235044 /nfs/dbraw/zinc/23/50/44/398235044.db2.gz STTJAYAWYFUGBK-UHFFFAOYSA-N 1 2 244.298 2.456 20 0 BEADLO Cc1cscc1NC(=O)CCc1c[nH+]c[nH]1 ZINC000280115353 538936759 /nfs/dbraw/zinc/93/67/59/538936759.db2.gz BATMURFBYWXYSP-UHFFFAOYSA-N 1 2 235.312 2.351 20 0 BEADLO Cc1cscc1NC(=O)CCc1c[nH]c[nH+]1 ZINC000280115353 538936760 /nfs/dbraw/zinc/93/67/60/538936760.db2.gz BATMURFBYWXYSP-UHFFFAOYSA-N 1 2 235.312 2.351 20 0 BEADLO Cc1cnc(NCCc2cccc(C)[nH+]2)nc1 ZINC000280559636 538937017 /nfs/dbraw/zinc/93/70/17/538937017.db2.gz UOUGHFLSSLEUJR-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccno2)on1 ZINC000336585348 178241428 /nfs/dbraw/zinc/24/14/28/178241428.db2.gz JHZJUOGJDCCNER-NSHDSACASA-N 1 2 233.271 2.308 20 0 BEADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccno2)on1 ZINC000336585348 178241429 /nfs/dbraw/zinc/24/14/29/178241429.db2.gz JHZJUOGJDCCNER-NSHDSACASA-N 1 2 233.271 2.308 20 0 BEADLO Nc1ccc(-c2ccc3c(c2)CCO3)c[nH+]1 ZINC000052886418 1171997482 /nfs/dbraw/zinc/99/74/82/1171997482.db2.gz JWJADRCBXJOMIB-UHFFFAOYSA-N 1 2 212.252 2.266 20 0 BEADLO C(c1noc(C2CCC2)n1)[N@@H+]1CC[C@H]2C[C@H]2C1 ZINC000625556304 343989923 /nfs/dbraw/zinc/98/99/23/343989923.db2.gz DVPFFKFWFVKLKC-QWRGUYRKSA-N 1 2 233.315 2.179 20 0 BEADLO C(c1noc(C2CCC2)n1)[N@H+]1CC[C@H]2C[C@H]2C1 ZINC000625556304 343989925 /nfs/dbraw/zinc/98/99/25/343989925.db2.gz DVPFFKFWFVKLKC-QWRGUYRKSA-N 1 2 233.315 2.179 20 0 BEADLO COC(=O)C[N@@H+]1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000076184563 398233786 /nfs/dbraw/zinc/23/37/86/398233786.db2.gz BLTBRMOBDYAQMW-MNOVXSKESA-N 1 2 237.299 2.226 20 0 BEADLO COC(=O)C[N@H+]1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000076184563 398233789 /nfs/dbraw/zinc/23/37/89/398233789.db2.gz BLTBRMOBDYAQMW-MNOVXSKESA-N 1 2 237.299 2.226 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ncccn2)C[C@H](C)C1(F)F ZINC000625654815 398237148 /nfs/dbraw/zinc/23/71/48/398237148.db2.gz RAJJXOOIJUTPCX-AOOOYVTPSA-N 1 2 241.285 2.200 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ncccn2)C[C@H](C)C1(F)F ZINC000625654815 398237149 /nfs/dbraw/zinc/23/71/49/398237149.db2.gz RAJJXOOIJUTPCX-AOOOYVTPSA-N 1 2 241.285 2.200 20 0 BEADLO Cc1cc[nH]c1C(=O)N[C@H](c1[nH]cc[nH+]1)C(C)C ZINC000283160290 178315224 /nfs/dbraw/zinc/31/52/24/178315224.db2.gz ZHIWYKKNGDCEQG-JTQLQIEISA-N 1 2 246.314 2.173 20 0 BEADLO Cc1cc(NCc2cncn2C)nc(C2CC2)[nH+]1 ZINC000291066425 538946804 /nfs/dbraw/zinc/94/68/04/538946804.db2.gz GKZLISPLFRYGBP-UHFFFAOYSA-N 1 2 243.314 2.008 20 0 BEADLO c1cc(C[NH2+][C@@H]2CCCc3occc32)no1 ZINC000169220134 538946910 /nfs/dbraw/zinc/94/69/10/538946910.db2.gz LIHNUGHKLMAPBF-LLVKDONJSA-N 1 2 218.256 2.435 20 0 BEADLO Cc1ccc(-n2cc[nH+]c2)c(C(=O)N2CCC2)c1 ZINC000336622811 178346946 /nfs/dbraw/zinc/34/69/46/178346946.db2.gz VWECMXXPZNXWIE-UHFFFAOYSA-N 1 2 241.294 2.027 20 0 BEADLO Cc1ccc(NC(=O)[C@H](C)OCC2CC2)c(C)[nH+]1 ZINC000176208144 538950141 /nfs/dbraw/zinc/95/01/41/538950141.db2.gz OZGXFQVAILLZOS-NSHDSACASA-N 1 2 248.326 2.452 20 0 BEADLO CCC[C@H](C[N@H+](C)CC(=O)OC(C)(C)C)OC ZINC000602450958 349552277 /nfs/dbraw/zinc/55/22/77/349552277.db2.gz CYFUBTRFSQCXKO-LLVKDONJSA-N 1 2 245.363 2.075 20 0 BEADLO CCC[C@H](C[N@@H+](C)CC(=O)OC(C)(C)C)OC ZINC000602450958 349552280 /nfs/dbraw/zinc/55/22/80/349552280.db2.gz CYFUBTRFSQCXKO-LLVKDONJSA-N 1 2 245.363 2.075 20 0 BEADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccno1 ZINC000066864565 361826731 /nfs/dbraw/zinc/82/67/31/361826731.db2.gz PEAOXTBHZNQHNY-SNVBAGLBSA-N 1 2 217.272 2.053 20 0 BEADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1ccno1 ZINC000066864565 361826734 /nfs/dbraw/zinc/82/67/34/361826734.db2.gz PEAOXTBHZNQHNY-SNVBAGLBSA-N 1 2 217.272 2.053 20 0 BEADLO CN(CCOC(C)(C)C)c1cccc[nH+]1 ZINC000201998921 538950081 /nfs/dbraw/zinc/95/00/81/538950081.db2.gz MOHRPBSKZGZMIW-UHFFFAOYSA-N 1 2 208.305 2.333 20 0 BEADLO Cc1ccc(NC(=O)[C@]2(C)C[C@@H]2F)c(C)[nH+]1 ZINC000335088368 136233024 /nfs/dbraw/zinc/23/30/24/136233024.db2.gz XSHGITGNLQRNKG-CMPLNLGQSA-N 1 2 222.263 2.385 20 0 BEADLO CCc1cc(N[C@@H](C)c2[nH+]ccn2CC)ncn1 ZINC000649470530 398270269 /nfs/dbraw/zinc/27/02/69/398270269.db2.gz RKHBMAVJLDUBTK-JTQLQIEISA-N 1 2 245.330 2.429 20 0 BEADLO C[C@H]1CCN(CC(F)F)C[C@@H]1n1cc[nH+]c1 ZINC000179483770 538955345 /nfs/dbraw/zinc/95/53/45/538955345.db2.gz SAPZTIYBBCIJIH-UWVGGRQHSA-N 1 2 229.274 2.031 20 0 BEADLO Cc1ncc([C@H](C)[NH2+]CC(C)(F)F)c(C)n1 ZINC000378853078 346844580 /nfs/dbraw/zinc/84/45/80/346844580.db2.gz HOHPNJDVEYRRPP-ZETCQYMHSA-N 1 2 229.274 2.399 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]CCOCCC(C)C ZINC000180327208 538957878 /nfs/dbraw/zinc/95/78/78/538957878.db2.gz AEARNTNUGPNYRD-NSHDSACASA-N 1 2 239.363 2.431 20 0 BEADLO c1ncc(C[N@@H+]2CCOC3(CCCCC3)C2)cn1 ZINC000179934167 538956684 /nfs/dbraw/zinc/95/66/84/538956684.db2.gz ITXZLWNGWYSFHD-UHFFFAOYSA-N 1 2 247.342 2.012 20 0 BEADLO c1ncc(C[N@H+]2CCOC3(CCCCC3)C2)cn1 ZINC000179934167 538956685 /nfs/dbraw/zinc/95/66/85/538956685.db2.gz ITXZLWNGWYSFHD-UHFFFAOYSA-N 1 2 247.342 2.012 20 0 BEADLO COC(=O)[C@H](C)[NH2+]C[C@H](C)c1ccc(C)cc1 ZINC000600150729 342691248 /nfs/dbraw/zinc/69/12/48/342691248.db2.gz JSAYYUYQIPSVPZ-RYUDHWBXSA-N 1 2 235.327 2.250 20 0 BEADLO CC(C)NC(=O)c1cccc(Cn2cc[nH+]c2)c1 ZINC000047268555 398276686 /nfs/dbraw/zinc/27/66/86/398276686.db2.gz IAJXZGOBAAJPCW-UHFFFAOYSA-N 1 2 243.310 2.070 20 0 BEADLO CCCNC(=O)c1cccc(Cn2cc[nH+]c2)c1 ZINC000047269404 398276865 /nfs/dbraw/zinc/27/68/65/398276865.db2.gz NUZKPYIAICRRPC-UHFFFAOYSA-N 1 2 243.310 2.071 20 0 BEADLO Clc1cnc(C[NH2+]Cc2ccno2)s1 ZINC000231885743 342741819 /nfs/dbraw/zinc/74/18/19/342741819.db2.gz SRBWZQVAQDXUMA-UHFFFAOYSA-N 1 2 229.692 2.074 20 0 BEADLO Cc1ccc(F)c(C[NH2+]Cc2ccno2)c1 ZINC000231881863 342742771 /nfs/dbraw/zinc/74/27/71/342742771.db2.gz KOLPNXQJCFROPD-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO Cc1cc(CNC(=O)CCCF)cc(C)[nH+]1 ZINC000616365063 342724129 /nfs/dbraw/zinc/72/41/29/342724129.db2.gz VDGWUXVEXFVXEX-UHFFFAOYSA-N 1 2 224.279 2.064 20 0 BEADLO CCC[C@H](C)NC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000649488487 398283653 /nfs/dbraw/zinc/28/36/53/398283653.db2.gz PEYNSWRRCJDWSD-QWRGUYRKSA-N 1 2 223.320 2.139 20 0 BEADLO CC[C@]1(C(C)C)C[C@@H]1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493449183 529388294 /nfs/dbraw/zinc/38/82/94/529388294.db2.gz GDTWJHPKURYMDI-KIZSPLDGSA-N 1 2 247.342 2.364 20 0 BEADLO CCn1nc(C)cc1-c1c[nH+]c2n1CCCC2 ZINC000630051654 361912082 /nfs/dbraw/zinc/91/20/82/361912082.db2.gz CJWZQOSSVNTSSD-UHFFFAOYSA-N 1 2 230.315 2.411 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@@H]1CCC(C)(C)O1 ZINC000187862147 538977184 /nfs/dbraw/zinc/97/71/84/538977184.db2.gz PJCNLSCTHJQXIV-ONGXEEELSA-N 1 2 237.347 2.326 20 0 BEADLO C/C=C\CNc1cc(N2CCCC2)nc[nH+]1 ZINC000624655210 342809627 /nfs/dbraw/zinc/80/96/27/342809627.db2.gz MVDGOUPXVXIZDK-IHWYPQMZSA-N 1 2 218.304 2.065 20 0 BEADLO C/C=C\CNc1cc(N2CCCC2)[nH+]cn1 ZINC000624655210 342809629 /nfs/dbraw/zinc/80/96/29/342809629.db2.gz MVDGOUPXVXIZDK-IHWYPQMZSA-N 1 2 218.304 2.065 20 0 BEADLO C/C=C\CNc1[nH+]c(C)nc2[nH]ccc21 ZINC000624656063 342809802 /nfs/dbraw/zinc/80/98/02/342809802.db2.gz FBSWFZWFADQCOE-ARJAWSKDSA-N 1 2 202.261 2.206 20 0 BEADLO CC[C@@H]1CCCCN1C(=O)CCc1c[nH+]c[nH]1 ZINC000188385494 538978496 /nfs/dbraw/zinc/97/84/96/538978496.db2.gz IJUQKBXFSJQKSM-GFCCVEGCSA-N 1 2 235.331 2.133 20 0 BEADLO CC[C@@H]1CCCCN1C(=O)CCc1c[nH]c[nH+]1 ZINC000188385494 538978498 /nfs/dbraw/zinc/97/84/98/538978498.db2.gz IJUQKBXFSJQKSM-GFCCVEGCSA-N 1 2 235.331 2.133 20 0 BEADLO Cc1cc2ccccc2[nH+]c1NC[C@H]1C[C@@H](O)C1 ZINC000624666544 342813635 /nfs/dbraw/zinc/81/36/35/342813635.db2.gz GWNRIIZSXLRWML-BJHJDKERSA-N 1 2 242.322 2.148 20 0 BEADLO Cc1c(-c2c[nH+]c(C(C)C)n2C)cnn1C ZINC000630051048 361914547 /nfs/dbraw/zinc/91/45/47/361914547.db2.gz IYTQWWDYERRQAU-UHFFFAOYSA-N 1 2 218.304 2.252 20 0 BEADLO C[C@H]1C[C@@H]1CNc1cc2cc[nH]c2c[nH+]1 ZINC000380246712 538987882 /nfs/dbraw/zinc/98/78/82/538987882.db2.gz OJBPAJOYVFYDJO-WCBMZHEXSA-N 1 2 201.273 2.053 20 0 BEADLO Cc1ncc([C@H](C)[NH2+]Cc2cocn2)s1 ZINC000380253289 538987905 /nfs/dbraw/zinc/98/79/05/538987905.db2.gz PRQBUIHJAWDKID-ZETCQYMHSA-N 1 2 223.301 2.290 20 0 BEADLO Cc1cc(N2CC3(C2)CCCO3)nc(C2CC2)[nH+]1 ZINC000624542985 344004601 /nfs/dbraw/zinc/00/46/01/344004601.db2.gz FRYADYOJFKZKNA-UHFFFAOYSA-N 1 2 245.326 2.032 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N1CCC[C@@H]2CCC[C@@H]21 ZINC000189439331 538983110 /nfs/dbraw/zinc/98/31/10/538983110.db2.gz HSAQIBPBUMGZAY-AAEUAGOBSA-N 1 2 247.342 2.133 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N1CCC[C@@H]2CCC[C@@H]21 ZINC000189439331 538983112 /nfs/dbraw/zinc/98/31/12/538983112.db2.gz HSAQIBPBUMGZAY-AAEUAGOBSA-N 1 2 247.342 2.133 20 0 BEADLO CCn1c[nH+]cc1CN1CCOc2ccccc21 ZINC000335621270 136239489 /nfs/dbraw/zinc/23/94/89/136239489.db2.gz IHARURVOFFUWOX-UHFFFAOYSA-N 1 2 243.310 2.302 20 0 BEADLO CC(C)(CC(F)(F)F)[NH2+]Cc1ccn[nH]1 ZINC000380103396 538985386 /nfs/dbraw/zinc/98/53/86/538985386.db2.gz MLRKBFQPXGFMLT-UHFFFAOYSA-N 1 2 221.226 2.230 20 0 BEADLO Cc1ccncc1[C@H](C)[NH2+]Cc1cocn1 ZINC000381525374 539003028 /nfs/dbraw/zinc/00/30/28/539003028.db2.gz WJKWEIBFMUZRLJ-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO COc1ccc(N[C@H]2CCCOCC2)[nH+]c1 ZINC000381575100 539004268 /nfs/dbraw/zinc/00/42/68/539004268.db2.gz YBCZECYSCFCVJA-JTQLQIEISA-N 1 2 222.288 2.071 20 0 BEADLO COc1ccc(NC[C@H]2CC=CCC2)[nH+]c1 ZINC000381614508 539004477 /nfs/dbraw/zinc/00/44/77/539004477.db2.gz UMUJKQAAWVIKFV-NSHDSACASA-N 1 2 218.300 2.280 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)CCc2c[nH+]c[nH]2)C[C@@H]1C ZINC000193809902 539007772 /nfs/dbraw/zinc/00/77/72/539007772.db2.gz SKAXGMBKNFXYEQ-WOPDTQHZSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)CCc2c[nH]c[nH+]2)C[C@@H]1C ZINC000193809902 539007773 /nfs/dbraw/zinc/00/77/73/539007773.db2.gz SKAXGMBKNFXYEQ-WOPDTQHZSA-N 1 2 249.358 2.283 20 0 BEADLO Cc1cc(NC(=O)C[NH+]2CC(C)(C)C2)cs1 ZINC000634423597 361945554 /nfs/dbraw/zinc/94/55/54/361945554.db2.gz UDWCAHCDMMJVFO-UHFFFAOYSA-N 1 2 238.356 2.337 20 0 BEADLO Cc1cc(NC(=O)CCc2[nH]cc[nH+]2)cs1 ZINC000634423819 361945576 /nfs/dbraw/zinc/94/55/76/361945576.db2.gz BKFCYBJLPSKDSV-UHFFFAOYSA-N 1 2 235.312 2.351 20 0 BEADLO C[C@H]1CCC[C@@H](N(C)C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000192604874 538996025 /nfs/dbraw/zinc/99/60/25/538996025.db2.gz WXYSKUCXMGXIFY-WCQYABFASA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H]1CCC[C@@H](N(C)C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000192604874 538996027 /nfs/dbraw/zinc/99/60/27/538996027.db2.gz WXYSKUCXMGXIFY-WCQYABFASA-N 1 2 249.358 2.379 20 0 BEADLO CCc1cc(N[C@H]2CCCOCC2)nc[nH+]1 ZINC000390226953 539020492 /nfs/dbraw/zinc/02/04/92/539020492.db2.gz BLKDUPIQYNSNLU-NSHDSACASA-N 1 2 221.304 2.020 20 0 BEADLO COCCC[C@@H](C)Nc1ccc(OC)c[nH+]1 ZINC000390660295 539026974 /nfs/dbraw/zinc/02/69/74/539026974.db2.gz RZGVFHZQHBYIGC-SNVBAGLBSA-N 1 2 224.304 2.317 20 0 BEADLO CCc1cc(N[C@@H](C)[C@H]2CCCOC2)nc[nH+]1 ZINC000388898158 539015495 /nfs/dbraw/zinc/01/54/95/539015495.db2.gz MDCLDOWRCYBHDO-QWRGUYRKSA-N 1 2 235.331 2.266 20 0 BEADLO Cc1cnc([C@H](C)[NH+]2C[C@H](C)O[C@@H](C)C2)o1 ZINC000348896439 136243552 /nfs/dbraw/zinc/24/35/52/136243552.db2.gz VDBIECJXDMKQBJ-DCAQKATOSA-N 1 2 224.304 2.153 20 0 BEADLO CCC[N@H+](CCc1cncc(C)n1)CC(F)F ZINC000649504074 398301108 /nfs/dbraw/zinc/30/11/08/398301108.db2.gz JGRVBEWEBGTKNP-UHFFFAOYSA-N 1 2 243.301 2.305 20 0 BEADLO CCC[N@@H+](CCc1cncc(C)n1)CC(F)F ZINC000649504074 398301109 /nfs/dbraw/zinc/30/11/09/398301109.db2.gz JGRVBEWEBGTKNP-UHFFFAOYSA-N 1 2 243.301 2.305 20 0 BEADLO CC(C)[C@H](C)[N@H+](C)Cc1nsc(N(C)C)n1 ZINC000533462127 342861109 /nfs/dbraw/zinc/86/11/09/342861109.db2.gz RJIMSUYWFORVQL-VIFPVBQESA-N 1 2 242.392 2.080 20 0 BEADLO CC(C)[C@H](C)[N@@H+](C)Cc1nsc(N(C)C)n1 ZINC000533462127 342861110 /nfs/dbraw/zinc/86/11/10/342861110.db2.gz RJIMSUYWFORVQL-VIFPVBQESA-N 1 2 242.392 2.080 20 0 BEADLO COc1cncc(C[N@H+](C)[C@H](C)c2ccco2)n1 ZINC000625111577 342865136 /nfs/dbraw/zinc/86/51/36/342865136.db2.gz PPBNSXWYXJMEBY-SNVBAGLBSA-N 1 2 247.298 2.271 20 0 BEADLO COc1cncc(C[N@@H+](C)[C@H](C)c2ccco2)n1 ZINC000625111577 342865138 /nfs/dbraw/zinc/86/51/38/342865138.db2.gz PPBNSXWYXJMEBY-SNVBAGLBSA-N 1 2 247.298 2.271 20 0 BEADLO C[C@H](c1ccccc1)[N@H+](C)Cc1nccc(N)n1 ZINC000351333990 136244302 /nfs/dbraw/zinc/24/43/02/136244302.db2.gz DCSJKCMIMXDUSY-LLVKDONJSA-N 1 2 242.326 2.082 20 0 BEADLO C[C@H](c1ccccc1)[N@@H+](C)Cc1nccc(N)n1 ZINC000351333990 136244303 /nfs/dbraw/zinc/24/43/03/136244303.db2.gz DCSJKCMIMXDUSY-LLVKDONJSA-N 1 2 242.326 2.082 20 0 BEADLO Cc1cccc(CCSC[C@H]2C[C@@H](O)C2)[nH+]1 ZINC000583994493 342857218 /nfs/dbraw/zinc/85/72/18/342857218.db2.gz DNFLLWLMKLBXOO-BJHJDKERSA-N 1 2 237.368 2.437 20 0 BEADLO OC[C@]1(F)CC[N@H+](Cc2ccc(Cl)s2)C1 ZINC000335645985 136243823 /nfs/dbraw/zinc/24/38/23/136243823.db2.gz QYCZGXOQUNHTFC-JTQLQIEISA-N 1 2 249.738 2.308 20 0 BEADLO OC[C@]1(F)CC[N@@H+](Cc2ccc(Cl)s2)C1 ZINC000335645985 136243824 /nfs/dbraw/zinc/24/38/24/136243824.db2.gz QYCZGXOQUNHTFC-JTQLQIEISA-N 1 2 249.738 2.308 20 0 BEADLO C[N@H+](Cc1cc(O)ccc1Cl)[C@@H]1CCOC1 ZINC000625155707 342895766 /nfs/dbraw/zinc/89/57/66/342895766.db2.gz RMCYFEZREIOFBK-SNVBAGLBSA-N 1 2 241.718 2.266 20 0 BEADLO CCO[C@@]1(C)C[C@H]1Nc1[nH+]cccc1OC ZINC000624556851 344008238 /nfs/dbraw/zinc/00/82/38/344008238.db2.gz WSRUKGZPPPRLFT-PWSUYJOCSA-N 1 2 222.288 2.070 20 0 BEADLO Cc1cnc([C@H](C)[NH2+]Cc2cnns2)s1 ZINC000309016152 342881268 /nfs/dbraw/zinc/88/12/68/342881268.db2.gz ZPHJMJJFFONNTF-ZETCQYMHSA-N 1 2 240.357 2.154 20 0 BEADLO C[C@H](O)CNc1ccc2ccccc2[nH+]1 ZINC000035100493 342882297 /nfs/dbraw/zinc/88/22/97/342882297.db2.gz LKNACODNIRCAMY-VIFPVBQESA-N 1 2 202.257 2.028 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CC[C@@H]3C[C@@H]3C2)cc[nH+]1 ZINC000421496945 192346057 /nfs/dbraw/zinc/34/60/57/192346057.db2.gz OIGQEIGFDJSJJR-IJLUTSLNSA-N 1 2 230.311 2.187 20 0 BEADLO CCCCc1cc(N[C@@H](C)C2(CO)CC2)nc[nH+]1 ZINC000631367672 342890722 /nfs/dbraw/zinc/89/07/22/342890722.db2.gz VAGBMMVNRVUJFP-NSHDSACASA-N 1 2 249.358 2.392 20 0 BEADLO C[C@@H]1CCC[N@@H+]1Cc1noc(C2CCC2)n1 ZINC000625202037 342910111 /nfs/dbraw/zinc/91/01/11/342910111.db2.gz AKBSUJYAGLVMMZ-SECBINFHSA-N 1 2 221.304 2.321 20 0 BEADLO C[C@@H]1CCC[N@H+]1Cc1noc(C2CCC2)n1 ZINC000625202037 342910113 /nfs/dbraw/zinc/91/01/13/342910113.db2.gz AKBSUJYAGLVMMZ-SECBINFHSA-N 1 2 221.304 2.321 20 0 BEADLO C[C@@H]([NH2+]Cc1csnn1)c1cccs1 ZINC000036902110 342912926 /nfs/dbraw/zinc/91/29/26/342912926.db2.gz XONZABBEQDKFLL-SSDOTTSWSA-N 1 2 225.342 2.450 20 0 BEADLO C[C@H]1C[C@H](Nc2cnn(CCF)c2)c2[nH+]ccn21 ZINC000624127940 346875285 /nfs/dbraw/zinc/87/52/85/346875285.db2.gz VWCSFBXGHASIFL-ONGXEEELSA-N 1 2 249.293 2.167 20 0 BEADLO C[C@H](c1ccccc1F)[N@@H+]1CCc2nn[nH]c2C1 ZINC000351610429 136248258 /nfs/dbraw/zinc/24/82/58/136248258.db2.gz VWTJNXJGAZZGLM-SECBINFHSA-N 1 2 246.289 2.063 20 0 BEADLO C[C@H](c1ccccc1F)[N@H+]1CCc2nn[nH]c2C1 ZINC000351610429 136248259 /nfs/dbraw/zinc/24/82/59/136248259.db2.gz VWTJNXJGAZZGLM-SECBINFHSA-N 1 2 246.289 2.063 20 0 BEADLO C[C@@H](N[C@H](C)C(C)(F)F)c1[nH]cc[nH+]1 ZINC000453274867 488187544 /nfs/dbraw/zinc/18/75/44/488187544.db2.gz BCSKTMHYAVAQMG-RNFRBKRXSA-N 1 2 203.236 2.104 20 0 BEADLO Cc1cccc(C[NH2+][C@@H]2C[C@H](C)n3ccnc32)n1 ZINC000379013715 346884844 /nfs/dbraw/zinc/88/48/44/346884844.db2.gz PMZRHDDNPBGRLP-WCQYABFASA-N 1 2 242.326 2.382 20 0 BEADLO Cc1cccc(C[NH2+][C@H]2C[C@H](C)n3ccnc32)n1 ZINC000379013713 346884878 /nfs/dbraw/zinc/88/48/78/346884878.db2.gz PMZRHDDNPBGRLP-AAEUAGOBSA-N 1 2 242.326 2.382 20 0 BEADLO CC[C@H](NC(=O)C=Cc1c[nH]c[nH+]1)[C@@H]1CC1(C)C ZINC000493449705 529456681 /nfs/dbraw/zinc/45/66/81/529456681.db2.gz IIDYMPZFTMUVKH-WTIVYXKASA-N 1 2 247.342 2.364 20 0 BEADLO CC[C@H](NC(=O)/C=C/c1[nH]cc[nH+]1)[C@@H]1CC1(C)C ZINC000493466191 529456996 /nfs/dbraw/zinc/45/69/96/529456996.db2.gz NBUAFJFMCNIYIY-PZIAFJOJSA-N 1 2 247.342 2.364 20 0 BEADLO CC[C@H](NC(=O)C=Cc1c[nH]c[nH+]1)[C@H]1CC1(C)C ZINC000493449699 529457066 /nfs/dbraw/zinc/45/70/66/529457066.db2.gz IIDYMPZFTMUVKH-AIIUZBJTSA-N 1 2 247.342 2.364 20 0 BEADLO CC[C@H](NC(=O)C=Cc1c[nH]c[nH+]1)[C@@H]1CC1(C)C ZINC000493449708 529458036 /nfs/dbraw/zinc/45/80/36/529458036.db2.gz IIDYMPZFTMUVKH-YGABWQLJSA-N 1 2 247.342 2.364 20 0 BEADLO C[C@H]1CCC[N@@H+]1CC(=O)c1ccccc1F ZINC000037911537 398335231 /nfs/dbraw/zinc/33/52/31/398335231.db2.gz FDTLZWYPFCCTLZ-JTQLQIEISA-N 1 2 221.275 2.493 20 0 BEADLO C[C@H]1CCC[N@H+]1CC(=O)c1ccccc1F ZINC000037911537 398335232 /nfs/dbraw/zinc/33/52/32/398335232.db2.gz FDTLZWYPFCCTLZ-JTQLQIEISA-N 1 2 221.275 2.493 20 0 BEADLO CC(C)OC(=O)[C@H](C)[NH2+][C@H]1CCC12CCC2 ZINC000602682770 349674263 /nfs/dbraw/zinc/67/42/63/349674263.db2.gz RRVMECSVPZEWFH-QWRGUYRKSA-N 1 2 225.332 2.249 20 0 BEADLO COC[C@@H](C)CNc1cc[nH+]c(C2CC2)n1 ZINC000171865407 398343726 /nfs/dbraw/zinc/34/37/26/398343726.db2.gz UEHMKJUNOUSQPQ-VIFPVBQESA-N 1 2 221.304 2.048 20 0 BEADLO CC(C)C1(CNC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)CC1 ZINC000635660757 398344349 /nfs/dbraw/zinc/34/43/49/398344349.db2.gz CMJYMNUPINEYDJ-GHMZBOCLSA-N 1 2 247.342 2.066 20 0 BEADLO CC(C)C1(CNC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)CC1 ZINC000635660757 398344350 /nfs/dbraw/zinc/34/43/50/398344350.db2.gz CMJYMNUPINEYDJ-GHMZBOCLSA-N 1 2 247.342 2.066 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1C[C@H]1C ZINC000643903113 398344396 /nfs/dbraw/zinc/34/43/96/398344396.db2.gz QMEQNVAGJDKSQO-SCZZXKLOSA-N 1 2 204.273 2.293 20 0 BEADLO Cc1ccc(CCNc2ncc(Cl)cn2)c[nH+]1 ZINC000301493368 187205628 /nfs/dbraw/zinc/20/56/28/187205628.db2.gz QJWHIKFUGWMSCH-UHFFFAOYSA-N 1 2 248.717 2.488 20 0 BEADLO C/C=C/C[C@H](CO)Nc1cc[nH+]c(C(C)C)n1 ZINC000302249186 187206662 /nfs/dbraw/zinc/20/66/62/187206662.db2.gz MEUJBRJNEUEUQC-SGUJLRQBSA-N 1 2 235.331 2.339 20 0 BEADLO CCc1csc(NCCc2cn(C)c[nH+]2)n1 ZINC000313485419 259335661 /nfs/dbraw/zinc/33/56/61/259335661.db2.gz OHZQEVNOEXTSLK-UHFFFAOYSA-N 1 2 236.344 2.094 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N1C[C@H](C)[C@@H](C)C1 ZINC000492529772 529552607 /nfs/dbraw/zinc/55/26/07/529552607.db2.gz GTRDHPBTYMDQJK-WTIVYXKASA-N 1 2 247.342 2.031 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N1C[C@H](C)[C@H](C)C1 ZINC000492529769 529552726 /nfs/dbraw/zinc/55/27/26/529552726.db2.gz GTRDHPBTYMDQJK-MTJJXUSZSA-N 1 2 247.342 2.031 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)NCC1(CC)CC1 ZINC000492487301 529554279 /nfs/dbraw/zinc/55/42/79/529554279.db2.gz CKBDTZBWRMCOGH-AATRIKPKSA-N 1 2 247.342 2.223 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N(C)C(C)(C)C ZINC000493458068 529556350 /nfs/dbraw/zinc/55/63/50/529556350.db2.gz GDOLVBMGYAIKEX-FPLPWBNLSA-N 1 2 235.331 2.173 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)NC(C)(C)C(C)C ZINC000493865895 529559084 /nfs/dbraw/zinc/55/90/84/529559084.db2.gz AAQXPHFYLFOTMX-FPLPWBNLSA-N 1 2 249.358 2.467 20 0 BEADLO COc1ccc[nH+]c1NCc1ncc(C)s1 ZINC000234950701 342966042 /nfs/dbraw/zinc/96/60/42/342966042.db2.gz RSSZQNKLONXUOC-UHFFFAOYSA-N 1 2 235.312 2.467 20 0 BEADLO CC(C)N(C(=O)CCc1c[nH+]cn1C)C1CCC1 ZINC000356137827 187212279 /nfs/dbraw/zinc/21/22/79/187212279.db2.gz BGLFMJKAHOIMFP-UHFFFAOYSA-N 1 2 249.358 2.142 20 0 BEADLO CCN(C#N)CC[N@H+](C)Cc1cc(C)ccc1F ZINC000602818682 349760139 /nfs/dbraw/zinc/76/01/39/349760139.db2.gz NCNRRCVWIGPDQY-UHFFFAOYSA-N 1 2 249.333 2.369 20 0 BEADLO CCN(C#N)CC[N@@H+](C)Cc1cc(C)ccc1F ZINC000602818682 349760141 /nfs/dbraw/zinc/76/01/41/349760141.db2.gz NCNRRCVWIGPDQY-UHFFFAOYSA-N 1 2 249.333 2.369 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)Cc1ccccn1 ZINC000351872558 136260668 /nfs/dbraw/zinc/26/06/68/136260668.db2.gz DRFISVKPWCKQHI-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)Cc1ccccn1 ZINC000351872558 136260669 /nfs/dbraw/zinc/26/06/69/136260669.db2.gz DRFISVKPWCKQHI-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CC(C)C[C@H](C)C[N@@H+]1CC(F)(F)C[C@@H]1CO ZINC000369052312 187221246 /nfs/dbraw/zinc/22/12/46/187221246.db2.gz ASSKLNDFJMBUDO-WDEREUQCSA-N 1 2 235.318 2.371 20 0 BEADLO CC(C)C[C@H](C)C[N@H+]1CC(F)(F)C[C@@H]1CO ZINC000369052312 187221248 /nfs/dbraw/zinc/22/12/48/187221248.db2.gz ASSKLNDFJMBUDO-WDEREUQCSA-N 1 2 235.318 2.371 20 0 BEADLO C[C@@H]1C[NH+](Cc2ccon2)C[C@@H](C)C1(F)F ZINC000625646304 344024457 /nfs/dbraw/zinc/02/44/57/344024457.db2.gz AMBACTFKHVNCAQ-RKDXNWHRSA-N 1 2 230.258 2.398 20 0 BEADLO C[C@H]1C[NH+](Cc2ccon2)C[C@H](C)C1(F)F ZINC000625646303 344024462 /nfs/dbraw/zinc/02/44/62/344024462.db2.gz AMBACTFKHVNCAQ-IUCAKERBSA-N 1 2 230.258 2.398 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ncc[nH]2)C[C@H](C)C1(F)F ZINC000625648558 344025008 /nfs/dbraw/zinc/02/50/08/344025008.db2.gz IIQDKOSSQWVVSH-DTORHVGOSA-N 1 2 229.274 2.133 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ncc[nH]2)C[C@H](C)C1(F)F ZINC000625648558 344025010 /nfs/dbraw/zinc/02/50/10/344025010.db2.gz IIQDKOSSQWVVSH-DTORHVGOSA-N 1 2 229.274 2.133 20 0 BEADLO Cc1noc(C[NH+]2C[C@@H](C)C(F)(F)[C@H](C)C2)n1 ZINC000625647464 344025033 /nfs/dbraw/zinc/02/50/33/344025033.db2.gz MHELDEAVUMZZJS-HTQZYQBOSA-N 1 2 245.273 2.101 20 0 BEADLO Oc1ccc(SCCn2cc[nH+]c2)cc1 ZINC000038078897 343059670 /nfs/dbraw/zinc/05/96/70/343059670.db2.gz JZECHODECWMNDX-UHFFFAOYSA-N 1 2 220.297 2.381 20 0 BEADLO Cc1csc(C[NH2+][C@@H](C)c2nccnc2C)n1 ZINC000187735145 187229153 /nfs/dbraw/zinc/22/91/53/187229153.db2.gz ANTQRDIRGSMGNI-JTQLQIEISA-N 1 2 248.355 2.401 20 0 BEADLO CCCN(CCC)C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000576886003 365715218 /nfs/dbraw/zinc/71/52/18/365715218.db2.gz TUCLDCPLCMRHAM-NSHDSACASA-N 1 2 237.347 2.237 20 0 BEADLO CCCN(CCC)C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000576886003 365715226 /nfs/dbraw/zinc/71/52/26/365715226.db2.gz TUCLDCPLCMRHAM-NSHDSACASA-N 1 2 237.347 2.237 20 0 BEADLO CC(C)CCC(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000125413566 343173588 /nfs/dbraw/zinc/17/35/88/343173588.db2.gz ZKBRWRQABMAKIL-SECBINFHSA-N 1 2 209.293 2.023 20 0 BEADLO C[C@H]1C[C@H](C)[N@H+](Cc2nnsc2Cl)C1 ZINC000125700635 343174264 /nfs/dbraw/zinc/17/42/64/343174264.db2.gz LCJLGTSJPQPJHW-BQBZGAKWSA-N 1 2 231.752 2.422 20 0 BEADLO C[C@H]1C[C@H](C)[N@@H+](Cc2nnsc2Cl)C1 ZINC000125700635 343174267 /nfs/dbraw/zinc/17/42/67/343174267.db2.gz LCJLGTSJPQPJHW-BQBZGAKWSA-N 1 2 231.752 2.422 20 0 BEADLO C([NH2+]C1(C2CC2)CC1)c1noc(C2CCC2)n1 ZINC000625320843 343234350 /nfs/dbraw/zinc/23/43/50/343234350.db2.gz VSELBJYMUFEYAG-UHFFFAOYSA-N 1 2 233.315 2.369 20 0 BEADLO CC[C@H]1CCCC[N@@H+]1Cc1noc(C)n1 ZINC000051124116 346931829 /nfs/dbraw/zinc/93/18/29/346931829.db2.gz REFRATSPNTUGGH-JTQLQIEISA-N 1 2 209.293 2.143 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C[C@@H](C)C(F)(F)F ZINC000625356279 343247615 /nfs/dbraw/zinc/24/76/15/343247615.db2.gz XUCBGPXVXMOVIJ-MRVPVSSYSA-N 1 2 246.232 2.339 20 0 BEADLO CC[C@H]1CCCC[N@H+]1Cc1noc(C)n1 ZINC000051124116 346931832 /nfs/dbraw/zinc/93/18/32/346931832.db2.gz REFRATSPNTUGGH-JTQLQIEISA-N 1 2 209.293 2.143 20 0 BEADLO CC[C@H]([NH2+][C@H](C)c1ccccc1)C(=O)OC ZINC000034431770 343270915 /nfs/dbraw/zinc/27/09/15/343270915.db2.gz KWPWOWNUGHMEDM-PWSUYJOCSA-N 1 2 221.300 2.289 20 0 BEADLO Cn1c[nH+]cc1Cn1cc(C2CCCCC2)nn1 ZINC000641038137 362150545 /nfs/dbraw/zinc/15/05/45/362150545.db2.gz LANYFLYXIMJDJB-UHFFFAOYSA-N 1 2 245.330 2.108 20 0 BEADLO CC(C)/C=C/c1cn(CCCn2cc[nH+]c2)nn1 ZINC000641055594 362166456 /nfs/dbraw/zinc/16/64/56/362166456.db2.gz XPYHXNHLRRXUIX-SNAWJCMRSA-N 1 2 245.330 2.234 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+](Cc2nc(C(F)F)no2)C1 ZINC000335613037 136295685 /nfs/dbraw/zinc/29/56/85/136295685.db2.gz RMEPQXQXRSTXOP-RQJHMYQMSA-N 1 2 231.246 2.238 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+](Cc2nc(C(F)F)no2)C1 ZINC000335613037 136295686 /nfs/dbraw/zinc/29/56/86/136295686.db2.gz RMEPQXQXRSTXOP-RQJHMYQMSA-N 1 2 231.246 2.238 20 0 BEADLO COc1cc(Nc2[nH+]cccc2N)cc(OC)c1 ZINC000034964505 187257026 /nfs/dbraw/zinc/25/70/26/187257026.db2.gz KYWGCKHHWJLLSG-UHFFFAOYSA-N 1 2 245.282 2.425 20 0 BEADLO C[C@H]1C[C@@H]1CNc1ccc(Cn2cc[nH+]c2)cn1 ZINC000348838067 136302282 /nfs/dbraw/zinc/30/22/82/136302282.db2.gz LUKKZUFAGWMUCU-WCQYABFASA-N 1 2 242.326 2.394 20 0 BEADLO CC(C)c1nc2[nH]ccc2c(NCC(F)F)[nH+]1 ZINC000631138167 343344741 /nfs/dbraw/zinc/34/47/41/343344741.db2.gz DVPPNTDXIMJLPD-UHFFFAOYSA-N 1 2 240.257 2.180 20 0 BEADLO CC(C)[C@H](C)[NH2+]c1ccc(OCC(N)=O)cc1 ZINC000037041309 187259569 /nfs/dbraw/zinc/25/95/69/187259569.db2.gz JAWHPNDVKRXEKO-JTQLQIEISA-N 1 2 236.315 2.007 20 0 BEADLO C[C@H](CCC(C)(C)C)C(=O)NCc1c[nH+]c[nH]1 ZINC000349126130 136322420 /nfs/dbraw/zinc/32/24/20/136322420.db2.gz FXPYFHIEYLAZQV-SNVBAGLBSA-N 1 2 237.347 2.488 20 0 BEADLO C[C@H](CCC(C)(C)C)C(=O)NCc1c[nH]c[nH+]1 ZINC000349126130 136322421 /nfs/dbraw/zinc/32/24/21/136322421.db2.gz FXPYFHIEYLAZQV-SNVBAGLBSA-N 1 2 237.347 2.488 20 0 BEADLO CSc1ccc([C@@H](C)[NH2+]Cc2nnc[nH]2)cc1 ZINC000037919384 187261224 /nfs/dbraw/zinc/26/12/24/187261224.db2.gz YLKTXBWIHGFNQT-SECBINFHSA-N 1 2 248.355 2.377 20 0 BEADLO CC(C)[C@H](NC(=O)[C@H]1[C@@H]2CCC[C@@H]21)c1[nH]cc[nH+]1 ZINC000276583238 187338771 /nfs/dbraw/zinc/33/87/71/187338771.db2.gz JPKOGSQSOOMFBC-QCNOEVLYSA-N 1 2 247.342 2.269 20 0 BEADLO C[C@@H]1C[C@H]1CC(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000335722182 136346343 /nfs/dbraw/zinc/34/63/43/136346343.db2.gz PDBFXQZCENTSNY-PWSUYJOCSA-N 1 2 247.342 2.162 20 0 BEADLO C[C@@H](NCc1cn2ccccc2[nH+]1)c1ccon1 ZINC000349197417 136331373 /nfs/dbraw/zinc/33/13/73/136331373.db2.gz JDTUZDZSHOXQAF-SNVBAGLBSA-N 1 2 242.282 2.173 20 0 BEADLO Cc1cc(NC(=O)NC(C)(C)C2CC2)cc[nH+]1 ZINC000335704769 136335161 /nfs/dbraw/zinc/33/51/61/136335161.db2.gz PPKHRYYAFBTJBE-UHFFFAOYSA-N 1 2 233.315 2.122 20 0 BEADLO CC1(C)CCC[C@H]1C(=O)N1CCn2cc[nH+]c2C1 ZINC000335707576 136336579 /nfs/dbraw/zinc/33/65/79/136336579.db2.gz OLLGDUPBZCKHLB-NSHDSACASA-N 1 2 247.342 2.052 20 0 BEADLO C/C=C(/CC)C(=O)NCCCNc1cccc[nH+]1 ZINC000276582756 187338926 /nfs/dbraw/zinc/33/89/26/187338926.db2.gz UQMCLLBJSYHUAQ-BASWHVEKSA-N 1 2 247.342 2.356 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H](C)CCc1ccccc1 ZINC000042304314 343434491 /nfs/dbraw/zinc/43/44/91/343434491.db2.gz CVDPSKOARRFWKX-NWDGAFQWSA-N 1 2 235.327 2.159 20 0 BEADLO Cc1cnc(C[N@H+]2CCS[C@H](C)[C@@H]2C)nc1 ZINC000335718373 136340378 /nfs/dbraw/zinc/34/03/78/136340378.db2.gz KECGXWRVDZEOQQ-WDEREUQCSA-N 1 2 237.372 2.111 20 0 BEADLO Cc1cnc(C[N@@H+]2CCS[C@H](C)[C@@H]2C)nc1 ZINC000335718373 136340379 /nfs/dbraw/zinc/34/03/79/136340379.db2.gz KECGXWRVDZEOQQ-WDEREUQCSA-N 1 2 237.372 2.111 20 0 BEADLO CC[C@H](C)NC(=O)c1ccc2[nH+]c(C)n(C)c2c1 ZINC000335843394 136354555 /nfs/dbraw/zinc/35/45/55/136354555.db2.gz DBHCJXAPPBNNJJ-VIFPVBQESA-N 1 2 245.326 2.410 20 0 BEADLO C[C@@H]1C[C@@H]1CC(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000335842937 136354722 /nfs/dbraw/zinc/35/47/22/136354722.db2.gz FRSVHNFYJGOAIT-ZYHUDNBSSA-N 1 2 247.342 2.162 20 0 BEADLO C[C@@H]1C[C@@H]1CC(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000335842937 136354723 /nfs/dbraw/zinc/35/47/23/136354723.db2.gz FRSVHNFYJGOAIT-ZYHUDNBSSA-N 1 2 247.342 2.162 20 0 BEADLO C[C@@H]1C[C@@H]1CC(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000353991759 136363620 /nfs/dbraw/zinc/36/36/20/136363620.db2.gz DMKPGSZXTJJHAM-GRYCIOLGSA-N 1 2 247.342 2.162 20 0 BEADLO CO[C@@H](C)C[NH2+][C@H]1CCc2ccccc21 ZINC000167012647 136368079 /nfs/dbraw/zinc/36/80/79/136368079.db2.gz XTGIODNVNKFUTJ-GWCFXTLKSA-N 1 2 205.301 2.298 20 0 BEADLO Cc1cc(N)nc(SCCC2CCC2)[nH+]1 ZINC000398651537 488221514 /nfs/dbraw/zinc/22/15/14/488221514.db2.gz BDQNLJXFTHKWAC-UHFFFAOYSA-N 1 2 223.345 2.480 20 0 BEADLO C[C@@H]1COCC[N@@H+]1Cc1cccc(F)c1 ZINC000046774803 343550118 /nfs/dbraw/zinc/55/01/18/343550118.db2.gz ZKWNCTZUQDUSMB-SNVBAGLBSA-N 1 2 209.264 2.046 20 0 BEADLO C[C@@H]1COCC[N@H+]1Cc1cccc(F)c1 ZINC000046774803 343550119 /nfs/dbraw/zinc/55/01/19/343550119.db2.gz ZKWNCTZUQDUSMB-SNVBAGLBSA-N 1 2 209.264 2.046 20 0 BEADLO CCC[C@@H]([NH2+][C@H]1CCC(F)(F)C1)C(=O)OCC ZINC000310556068 343535485 /nfs/dbraw/zinc/53/54/85/343535485.db2.gz IFWVJUQYXRGRLQ-VHSXEESVSA-N 1 2 249.301 2.496 20 0 BEADLO CCC[C@H]([NH2+][C@@H]1CCC(F)(F)C1)C(=O)OCC ZINC000310556069 343535727 /nfs/dbraw/zinc/53/57/27/343535727.db2.gz IFWVJUQYXRGRLQ-ZJUUUORDSA-N 1 2 249.301 2.496 20 0 BEADLO CC[C@H]([NH2+][C@@H]1C[C@@]1(C)c1ccccc1)C(=O)OC ZINC000619183034 343544553 /nfs/dbraw/zinc/54/45/53/343544553.db2.gz MZBFKUJETBXYJH-GUTXKFCHSA-N 1 2 247.338 2.258 20 0 BEADLO Cc1ncsc1CNc1cc[nH+]c(C)n1 ZINC000070837197 343501078 /nfs/dbraw/zinc/50/10/78/343501078.db2.gz GGKHAYFRVQKODT-UHFFFAOYSA-N 1 2 220.301 2.162 20 0 BEADLO Cc1[nH+]cccc1N[C@@H]1CCCOCC1 ZINC000085726843 343604358 /nfs/dbraw/zinc/60/43/58/343604358.db2.gz YDLGPAKEIWQPAX-LLVKDONJSA-N 1 2 206.289 2.371 20 0 BEADLO CC(C)C(CNC(=O)C=Cc1c[nH]c[nH+]1)C(C)C ZINC000283171579 187344338 /nfs/dbraw/zinc/34/43/38/187344338.db2.gz PJBMAPIASXFZTF-AATRIKPKSA-N 1 2 249.358 2.467 20 0 BEADLO CCN(C#N)CC[N@@H+]1CC(C)(C)[C@@H]1c1ccco1 ZINC000602927976 349821517 /nfs/dbraw/zinc/82/15/17/349821517.db2.gz UXFIDOFDYDVIMX-ZDUSSCGKSA-N 1 2 247.342 2.465 20 0 BEADLO CCN(C#N)CC[N@H+]1CC(C)(C)[C@@H]1c1ccco1 ZINC000602927976 349821519 /nfs/dbraw/zinc/82/15/19/349821519.db2.gz UXFIDOFDYDVIMX-ZDUSSCGKSA-N 1 2 247.342 2.465 20 0 BEADLO CC(C)[C@H]1CCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000283474158 187343862 /nfs/dbraw/zinc/34/38/62/187343862.db2.gz MPCNDNOLGPQPGM-BTDICHCPSA-N 1 2 233.315 2.070 20 0 BEADLO CCN1CC[N@H+](Cc2ccc(C)o2)C[C@@H]1C ZINC000678261733 488229042 /nfs/dbraw/zinc/22/90/42/488229042.db2.gz QCQBQHHWIILAKH-NSHDSACASA-N 1 2 222.332 2.114 20 0 BEADLO CCN1CC[N@@H+](Cc2ccc(C)o2)C[C@@H]1C ZINC000678261733 488229045 /nfs/dbraw/zinc/22/90/45/488229045.db2.gz QCQBQHHWIILAKH-NSHDSACASA-N 1 2 222.332 2.114 20 0 BEADLO C[C@@H](c1ccccc1F)[NH+]1CCOCC1 ZINC000051151248 346962342 /nfs/dbraw/zinc/96/23/42/346962342.db2.gz XIBUZXFGJAFKNW-JTQLQIEISA-N 1 2 209.264 2.219 20 0 BEADLO Cc1nc(N2CC[C@@H](c3ccncc3)C2)cc[nH+]1 ZINC000624358887 343737228 /nfs/dbraw/zinc/73/72/28/343737228.db2.gz XQOQBRHLKRCAFJ-CYBMUJFWSA-N 1 2 240.310 2.174 20 0 BEADLO CC(C)n1cc([C@H](C)[NH2+]Cc2nccn2C)cn1 ZINC000557808252 343738098 /nfs/dbraw/zinc/73/80/98/343738098.db2.gz LFDKMKRGULWCCH-NSHDSACASA-N 1 2 247.346 2.048 20 0 BEADLO CC(C)[N@H+]1C[C@H](C(F)(F)F)O[C@@H](C)C1 ZINC000205888214 343715528 /nfs/dbraw/zinc/71/55/28/343715528.db2.gz XSCWACQSHFYURQ-JGVFFNPUSA-N 1 2 211.227 2.046 20 0 BEADLO CC(C)[N@@H+]1C[C@H](C(F)(F)F)O[C@@H](C)C1 ZINC000205888214 343715530 /nfs/dbraw/zinc/71/55/30/343715530.db2.gz XSCWACQSHFYURQ-JGVFFNPUSA-N 1 2 211.227 2.046 20 0 BEADLO CC[C@H]1CCN1C(=O)c1ccn2c(C)c[nH+]c2c1 ZINC000576597386 343754610 /nfs/dbraw/zinc/75/46/10/343754610.db2.gz QTVGADDSACSMEX-LBPRGKRZSA-N 1 2 243.310 2.267 20 0 BEADLO Cc1cc(CNC(=O)[C@H]2C[C@@H]2C2CC2)cc(C)[nH+]1 ZINC000421573737 192364534 /nfs/dbraw/zinc/36/45/34/192364534.db2.gz BWLXYGMODJQKBW-KGLIPLIRSA-N 1 2 244.338 2.361 20 0 BEADLO Cc1nccnc1C[N@H+](C)Cc1ccsc1 ZINC000621710041 343763437 /nfs/dbraw/zinc/76/34/37/343763437.db2.gz POQDOKYWNKSEFM-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1nccnc1C[N@@H+](C)Cc1ccsc1 ZINC000621710041 343763439 /nfs/dbraw/zinc/76/34/39/343763439.db2.gz POQDOKYWNKSEFM-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO COc1ccc[nH+]c1N(C)CC1=CCSC1 ZINC000624410984 343763477 /nfs/dbraw/zinc/76/34/77/343763477.db2.gz PITYHHILSJBPIY-UHFFFAOYSA-N 1 2 236.340 2.200 20 0 BEADLO CCc1cc(NC[C@@H](C)SC)nc[nH+]1 ZINC000159242986 349872203 /nfs/dbraw/zinc/87/22/03/349872203.db2.gz KIWYHWXUNCUJSO-MRVPVSSYSA-N 1 2 211.334 2.202 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CCOCC23CCC3)cn1 ZINC000179787738 346997079 /nfs/dbraw/zinc/99/70/79/346997079.db2.gz CDPSVBPGDKWLMP-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO CC(C)n1cc(C[N@H+]2CCOCC23CCC3)cn1 ZINC000179787738 346997080 /nfs/dbraw/zinc/99/70/80/346997080.db2.gz CDPSVBPGDKWLMP-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO O=C1CC(c2ccsc2)=NN1C1CC[NH2+]CC1 ZINC000409437773 343849014 /nfs/dbraw/zinc/84/90/14/343849014.db2.gz IONJUSTWKSVRRK-UHFFFAOYSA-N 1 2 249.339 2.242 20 0 BEADLO O=c1cc(-c2ccsc2)[nH]n1C1CC[NH2+]CC1 ZINC000409437773 343849018 /nfs/dbraw/zinc/84/90/18/343849018.db2.gz IONJUSTWKSVRRK-UHFFFAOYSA-N 1 2 249.339 2.242 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cocn2)[C@@H](CC)CO1 ZINC000651913017 537827569 /nfs/dbraw/zinc/82/75/69/537827569.db2.gz KOPXMUAGJDLVDU-RYUDHWBXSA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cocn2)[C@@H](CC)CO1 ZINC000651913017 537827581 /nfs/dbraw/zinc/82/75/81/537827581.db2.gz KOPXMUAGJDLVDU-RYUDHWBXSA-N 1 2 224.304 2.064 20 0 BEADLO COc1ccc(F)cc1C[NH2+][C@@H](C)c1ncc[nH]1 ZINC000287442524 537834968 /nfs/dbraw/zinc/83/49/68/537834968.db2.gz LBAUAJHVAJYGQF-VIFPVBQESA-N 1 2 249.289 2.408 20 0 BEADLO Cc1ccc(CN(Cc2[nH+]ccn2C)C2CC2)o1 ZINC000624482109 343906183 /nfs/dbraw/zinc/90/61/83/343906183.db2.gz ABEWNZQTLUXLAT-UHFFFAOYSA-N 1 2 245.326 2.486 20 0 BEADLO CCc1nc(C[NH+]2CCC3(CC3)CC2)no1 ZINC000363458778 343942487 /nfs/dbraw/zinc/94/24/87/343942487.db2.gz BGCKZQYDLICFON-UHFFFAOYSA-N 1 2 221.304 2.008 20 0 BEADLO CCOc1cccc(CNc2c[nH]c[nH+]2)c1 ZINC000393747121 343923147 /nfs/dbraw/zinc/92/31/47/343923147.db2.gz NMXDXURCEHXHJP-UHFFFAOYSA-N 1 2 217.272 2.421 20 0 BEADLO CNC(=O)c1ccc(CNc2cccc[nH+]2)cc1 ZINC000048786416 187355944 /nfs/dbraw/zinc/35/59/44/187355944.db2.gz XPICTXGBTCMMJE-UHFFFAOYSA-N 1 2 241.294 2.053 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2nc(C)c[nH]2)c1 ZINC000628119442 343971331 /nfs/dbraw/zinc/97/13/31/343971331.db2.gz SWQLWYROCMOCDA-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2nc(C)c[nH]2)c1 ZINC000628119442 343971332 /nfs/dbraw/zinc/97/13/32/343971332.db2.gz SWQLWYROCMOCDA-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cscn2)cn1 ZINC000058395718 178618001 /nfs/dbraw/zinc/61/80/01/178618001.db2.gz RHYZNXCGPCXNTP-UHFFFAOYSA-N 1 2 219.313 2.136 20 0 BEADLO CC(C)COCC[N@@H+]1Cc2ccc(O)cc2C1 ZINC000625727711 344058750 /nfs/dbraw/zinc/05/87/50/344058750.db2.gz IQVZJJYPBRJTKZ-UHFFFAOYSA-N 1 2 235.327 2.380 20 0 BEADLO CC(C)COCC[N@H+]1Cc2ccc(O)cc2C1 ZINC000625727711 344058751 /nfs/dbraw/zinc/05/87/51/344058751.db2.gz IQVZJJYPBRJTKZ-UHFFFAOYSA-N 1 2 235.327 2.380 20 0 BEADLO CCc1nocc1C[N@@H+]1Cc2ccc(O)cc2C1 ZINC000625727943 344059150 /nfs/dbraw/zinc/05/91/50/344059150.db2.gz RLWRNNDETXVOSL-UHFFFAOYSA-N 1 2 244.294 2.458 20 0 BEADLO CCc1nocc1C[N@H+]1Cc2ccc(O)cc2C1 ZINC000625727943 344059152 /nfs/dbraw/zinc/05/91/52/344059152.db2.gz RLWRNNDETXVOSL-UHFFFAOYSA-N 1 2 244.294 2.458 20 0 BEADLO CC(C)C[C@@H](C(=O)N1CC[C@H]1C)n1cc[nH+]c1 ZINC000641247387 362327112 /nfs/dbraw/zinc/32/71/12/362327112.db2.gz RAPATEIRJAUGLZ-NEPJUHHUSA-N 1 2 235.331 2.091 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)Nc1cc(C2CC2)ncn1 ZINC000641286847 362344766 /nfs/dbraw/zinc/34/47/66/362344766.db2.gz DYKLNAHVOWZHFJ-JTQLQIEISA-N 1 2 243.314 2.051 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)Nc1cc(C2CC2)ncn1 ZINC000641286848 362344952 /nfs/dbraw/zinc/34/49/52/362344952.db2.gz DYKLNAHVOWZHFJ-SNVBAGLBSA-N 1 2 243.314 2.051 20 0 BEADLO CC(C)c1nnc(C[NH+](C2CC2)C2CC2)o1 ZINC000625837642 344090170 /nfs/dbraw/zinc/09/01/70/344090170.db2.gz NHKWHWNSCRNCBG-UHFFFAOYSA-N 1 2 221.304 2.320 20 0 BEADLO CCc1cnc(C[NH+](C2CC2)C2CC2)o1 ZINC000625839156 344091996 /nfs/dbraw/zinc/09/19/96/344091996.db2.gz SWJABKSOFWHPCO-UHFFFAOYSA-N 1 2 206.289 2.364 20 0 BEADLO CC(C)c1nnc(C[NH+](C2CC2)C2CC2)[nH]1 ZINC000625840881 344092272 /nfs/dbraw/zinc/09/22/72/344092272.db2.gz FKLULSFPSRDOPO-UHFFFAOYSA-N 1 2 220.320 2.055 20 0 BEADLO c1cc(C[N@@H+]2CCc3sccc3C2)on1 ZINC000078445229 344097535 /nfs/dbraw/zinc/09/75/35/344097535.db2.gz PURSNAVTVNYDIF-UHFFFAOYSA-N 1 2 220.297 2.294 20 0 BEADLO c1cc(C[N@H+]2CCc3sccc3C2)on1 ZINC000078445229 344097536 /nfs/dbraw/zinc/09/75/36/344097536.db2.gz PURSNAVTVNYDIF-UHFFFAOYSA-N 1 2 220.297 2.294 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cnc(C3CC3)o2)CCO1 ZINC000628129361 344157016 /nfs/dbraw/zinc/15/70/16/344157016.db2.gz YBNLIYPQVKHXHM-LLVKDONJSA-N 1 2 236.315 2.163 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cnc(C3CC3)o2)CCO1 ZINC000628129361 344157019 /nfs/dbraw/zinc/15/70/19/344157019.db2.gz YBNLIYPQVKHXHM-LLVKDONJSA-N 1 2 236.315 2.163 20 0 BEADLO CC(C)[C@@H](CCO)Nc1cc[nH+]c2ccncc12 ZINC000085688566 344208290 /nfs/dbraw/zinc/20/82/90/344208290.db2.gz APWSPMCNMUSKEC-GFCCVEGCSA-N 1 2 245.326 2.449 20 0 BEADLO Fc1cnccc1N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000641342203 362370724 /nfs/dbraw/zinc/37/07/24/362370724.db2.gz BXMBAGQOAJSYDM-NSHDSACASA-N 1 2 246.289 2.259 20 0 BEADLO CC[C@@H]([NH2+]Cc1ncn(C)n1)c1ccc(C)cc1 ZINC000090969932 344275942 /nfs/dbraw/zinc/27/59/42/344275942.db2.gz CLVQKNXLSSAURS-CYBMUJFWSA-N 1 2 244.342 2.364 20 0 BEADLO CCc1cc(N[C@@H]2C[C@H](C)O[C@@H]2C)nc[nH+]1 ZINC000385090277 344323397 /nfs/dbraw/zinc/32/33/97/344323397.db2.gz GDLUUQPHXVXKLS-IQJOONFLSA-N 1 2 221.304 2.017 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@@H]1CCc2cc(N)ccc21 ZINC000094087912 344325329 /nfs/dbraw/zinc/32/53/29/344325329.db2.gz KZJOEXFFLUEABK-CQSZACIVSA-N 1 2 242.326 2.077 20 0 BEADLO CC[C@H]1CN(c2cc[nH+]cc2F)C[C@H](C)O1 ZINC000641368722 362380029 /nfs/dbraw/zinc/38/00/29/362380029.db2.gz XXJVKUMXIADUAO-UWVGGRQHSA-N 1 2 224.279 2.224 20 0 BEADLO Cc1[nH]c2ccc(CSCCO)cc2[nH+]1 ZINC000603309391 349910361 /nfs/dbraw/zinc/91/03/61/349910361.db2.gz AHWBEXKBJHJDTG-UHFFFAOYSA-N 1 2 222.313 2.097 20 0 BEADLO Cc1[nH]c2cc(CSCCO)ccc2[nH+]1 ZINC000603309391 349910363 /nfs/dbraw/zinc/91/03/63/349910363.db2.gz AHWBEXKBJHJDTG-UHFFFAOYSA-N 1 2 222.313 2.097 20 0 BEADLO CO[C@@H](C(=O)Nc1c(C)cc[nH+]c1C)C1CCC1 ZINC000622866653 344435220 /nfs/dbraw/zinc/43/52/20/344435220.db2.gz NHIJDFVLTJNKHR-CYBMUJFWSA-N 1 2 248.326 2.452 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)CCC1CCCC1 ZINC000042512043 344442195 /nfs/dbraw/zinc/44/21/95/344442195.db2.gz XNNQWUDQIOAFEC-LBPRGKRZSA-N 1 2 249.358 2.358 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)CCC1CCCC1 ZINC000042512046 344442242 /nfs/dbraw/zinc/44/22/42/344442242.db2.gz XNNQWUDQIOAFEC-GFCCVEGCSA-N 1 2 249.358 2.358 20 0 BEADLO COC(C)(C)C[C@H](C)Nc1cc[nH+]cc1F ZINC000641399664 362393648 /nfs/dbraw/zinc/39/36/48/362393648.db2.gz RLCYMNZSHJUNNC-VIFPVBQESA-N 1 2 226.295 2.258 20 0 BEADLO CO[C@@H](CNc1cc[nH+]cc1F)C(C)(C)C ZINC000641407660 362400023 /nfs/dbraw/zinc/40/00/23/362400023.db2.gz AAEVYWZYQOFEFW-NSHDSACASA-N 1 2 226.295 2.116 20 0 BEADLO CC(C)[C@@H](O)C(C)(C)CNc1cc[nH+]cc1F ZINC000641459923 362433502 /nfs/dbraw/zinc/43/35/02/362433502.db2.gz FHPLYRDYWWVCTG-GFCCVEGCSA-N 1 2 240.322 2.098 20 0 BEADLO CC1(C)C[C@@H](Nc2cc[nH+]cc2F)CCO1 ZINC000641461551 362435655 /nfs/dbraw/zinc/43/56/55/362435655.db2.gz WKSRUAHOVYMTTH-VIFPVBQESA-N 1 2 224.279 2.012 20 0 BEADLO C[C@@H](Nc1cc(CO)cc[nH+]1)C1CCC1 ZINC000641462344 362436537 /nfs/dbraw/zinc/43/65/37/362436537.db2.gz RPSMJYVIAKUWFY-SECBINFHSA-N 1 2 206.289 2.174 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@@H](C2CC2)C1 ZINC000641467591 362441800 /nfs/dbraw/zinc/44/18/00/362441800.db2.gz KEUOUEYQZLMWHX-SNVBAGLBSA-N 1 2 206.264 2.457 20 0 BEADLO C[C@@H]1CC(Nc2cc[nH+]cc2F)C[C@@H](C)O1 ZINC000641473940 362442956 /nfs/dbraw/zinc/44/29/56/362442956.db2.gz QXYNRAIYQXLLLW-RKDXNWHRSA-N 1 2 224.279 2.011 20 0 BEADLO CC(C)(C)c1cc[nH+]c(NCCc2nc[nH]n2)c1 ZINC000641433181 362416616 /nfs/dbraw/zinc/41/66/16/362416616.db2.gz AUMDKNFSUPAXOV-UHFFFAOYSA-N 1 2 245.330 2.152 20 0 BEADLO COCC1(C)CCN(c2cc[nH+]cc2F)CC1 ZINC000641480093 362449983 /nfs/dbraw/zinc/44/99/83/362449983.db2.gz QBFYGADVGOTKSZ-UHFFFAOYSA-N 1 2 238.306 2.474 20 0 BEADLO CN(C[C@H]1CCCC[C@H]1O)c1cc[nH+]cc1F ZINC000641483524 362451363 /nfs/dbraw/zinc/45/13/63/362451363.db2.gz RHNSAIFKSJRRIE-ZWNOBZJWSA-N 1 2 238.306 2.208 20 0 BEADLO Fc1c[nH+]ccc1NCC[C@@H]1CCCCO1 ZINC000641485038 362453477 /nfs/dbraw/zinc/45/34/77/362453477.db2.gz HNGPLLKBNXTEMZ-JTQLQIEISA-N 1 2 224.279 2.014 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1CCO[C@H](C2CC2)C1 ZINC000641491430 362459510 /nfs/dbraw/zinc/45/95/10/362459510.db2.gz PFRKFHALLAOEGJ-MFKMUULPSA-N 1 2 236.290 2.012 20 0 BEADLO CO[C@@]1(C)CCCN(c2cc[nH+]cc2F)C1 ZINC000641545974 362493375 /nfs/dbraw/zinc/49/33/75/362493375.db2.gz RDYXGXVKXRXWSI-LBPRGKRZSA-N 1 2 224.279 2.226 20 0 BEADLO COC(=O)[C@@H](c1cccc(OC)c1)[NH+]1CCCC1 ZINC000259503906 344656415 /nfs/dbraw/zinc/65/64/15/344656415.db2.gz ZXYMPXCPQKXVDB-CYBMUJFWSA-N 1 2 249.310 2.005 20 0 BEADLO FCC[C@H]1C[N@H+](Cc2cccc(F)c2)CCO1 ZINC000625998860 344660385 /nfs/dbraw/zinc/66/03/85/344660385.db2.gz AANDPAMGJNWLFB-ZDUSSCGKSA-N 1 2 241.281 2.386 20 0 BEADLO FCC[C@H]1C[N@@H+](Cc2cccc(F)c2)CCO1 ZINC000625998860 344660387 /nfs/dbraw/zinc/66/03/87/344660387.db2.gz AANDPAMGJNWLFB-ZDUSSCGKSA-N 1 2 241.281 2.386 20 0 BEADLO Oc1cccc2c1CC[N@H+](Cc1cncs1)C2 ZINC000626028628 344681187 /nfs/dbraw/zinc/68/11/87/344681187.db2.gz RQODYDRUMMTBRA-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO Oc1cccc2c1CC[N@@H+](Cc1cncs1)C2 ZINC000626028628 344681189 /nfs/dbraw/zinc/68/11/89/344681189.db2.gz RQODYDRUMMTBRA-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO FCC[C@@H]1C[N@H+](Cc2ccc(F)cc2)CCO1 ZINC000626000098 344661784 /nfs/dbraw/zinc/66/17/84/344661784.db2.gz IWYURTLDGOZYDT-CYBMUJFWSA-N 1 2 241.281 2.386 20 0 BEADLO FCC[C@@H]1C[N@@H+](Cc2ccc(F)cc2)CCO1 ZINC000626000098 344661786 /nfs/dbraw/zinc/66/17/86/344661786.db2.gz IWYURTLDGOZYDT-CYBMUJFWSA-N 1 2 241.281 2.386 20 0 BEADLO CCC(CC)(CCO)CNc1cc[nH+]c(C)n1 ZINC000075065596 344764440 /nfs/dbraw/zinc/76/44/40/344764440.db2.gz VUAWPFXOBPSWMD-UHFFFAOYSA-N 1 2 237.347 2.386 20 0 BEADLO CO[C@]1(C)C[C@@H](Nc2cc[nH+]c(C)n2)C1(C)C ZINC000075064683 344764603 /nfs/dbraw/zinc/76/46/03/344764603.db2.gz KFTYKMUJYGINRL-ZWNOBZJWSA-N 1 2 235.331 2.401 20 0 BEADLO CCc1cnc(C[N@H+](CC)C[C@H]2CCCO2)o1 ZINC000075676158 344784128 /nfs/dbraw/zinc/78/41/28/344784128.db2.gz MUDYRASCCBJXGM-GFCCVEGCSA-N 1 2 238.331 2.238 20 0 BEADLO CCc1cnc(C[N@@H+](CC)C[C@H]2CCCO2)o1 ZINC000075676158 344784131 /nfs/dbraw/zinc/78/41/31/344784131.db2.gz MUDYRASCCBJXGM-GFCCVEGCSA-N 1 2 238.331 2.238 20 0 BEADLO Cc1nc(C[NH+]2CCC(C(C)C)CC2)no1 ZINC000075833193 344792970 /nfs/dbraw/zinc/79/29/70/344792970.db2.gz WOTAIDUCIYXLPR-UHFFFAOYSA-N 1 2 223.320 2.246 20 0 BEADLO C[C@H]1C[NH+](Cc2noc(C3CC3)n2)C[C@@H]1C ZINC000076111533 344795795 /nfs/dbraw/zinc/79/57/95/344795795.db2.gz JWCZIWMJNURNRS-IUCAKERBSA-N 1 2 221.304 2.035 20 0 BEADLO C[C@@H](c1cccs1)N(C)C(=O)Cn1cc[nH+]c1 ZINC000076830362 344806908 /nfs/dbraw/zinc/80/69/08/344806908.db2.gz AKHAUZWMUYMTIF-JTQLQIEISA-N 1 2 249.339 2.164 20 0 BEADLO O=C1OCC[C@H]1[N@@H+]1CCC[C@@H]1c1ccsc1 ZINC000076989478 344811892 /nfs/dbraw/zinc/81/18/92/344811892.db2.gz IWGOMGDTFNTYNL-GHMZBOCLSA-N 1 2 237.324 2.201 20 0 BEADLO O=C1OCC[C@H]1[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000076989478 344811893 /nfs/dbraw/zinc/81/18/93/344811893.db2.gz IWGOMGDTFNTYNL-GHMZBOCLSA-N 1 2 237.324 2.201 20 0 BEADLO CC(C)[N@H+](Cc1ccon1)Cc1ccccn1 ZINC000077267975 344814641 /nfs/dbraw/zinc/81/46/41/344814641.db2.gz LPKZZDFOEIBECY-UHFFFAOYSA-N 1 2 231.299 2.480 20 0 BEADLO CC(C)[N@@H+](Cc1ccon1)Cc1ccccn1 ZINC000077267975 344814644 /nfs/dbraw/zinc/81/46/44/344814644.db2.gz LPKZZDFOEIBECY-UHFFFAOYSA-N 1 2 231.299 2.480 20 0 BEADLO CCC[C@@](C)([NH2+]CCC(F)(F)F)C(=O)OC ZINC000077285629 344815034 /nfs/dbraw/zinc/81/50/34/344815034.db2.gz AYCJMZOZVAZCRZ-SECBINFHSA-N 1 2 241.253 2.260 20 0 BEADLO Cc1nocc1CNc1cc[nH+]c(C(C)(C)C)n1 ZINC000631440327 344837385 /nfs/dbraw/zinc/83/73/85/344837385.db2.gz OLXNLWDPHDDFNU-UHFFFAOYSA-N 1 2 246.314 2.105 20 0 BEADLO Cc1nc(NCCCc2nccs2)cc[nH+]1 ZINC000078257472 344839148 /nfs/dbraw/zinc/83/91/48/344839148.db2.gz MCSCPQYWVOKHQQ-UHFFFAOYSA-N 1 2 234.328 2.286 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2CCO[C@@H](C)C2)c(C)[nH+]1 ZINC000271961945 178744522 /nfs/dbraw/zinc/74/45/22/178744522.db2.gz GUWHSUXCCAXMSN-CMPLNLGQSA-N 1 2 248.326 2.452 20 0 BEADLO Cc1nc(C[NH+]2C[C@H](C)S[C@@H](C)C2)[nH]c1C ZINC000628156262 344848029 /nfs/dbraw/zinc/84/80/29/344848029.db2.gz JENFKCBHKGDOFM-IUCAKERBSA-N 1 2 239.388 2.352 20 0 BEADLO Cc1[nH]c(CN2C[C@H](C)S[C@@H](C)C2)[nH+]c1C ZINC000628156262 344848030 /nfs/dbraw/zinc/84/80/30/344848030.db2.gz JENFKCBHKGDOFM-IUCAKERBSA-N 1 2 239.388 2.352 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2CCO[C@H](C)C2)c(C)[nH+]1 ZINC000271961951 178749257 /nfs/dbraw/zinc/74/92/57/178749257.db2.gz GUWHSUXCCAXMSN-PWSUYJOCSA-N 1 2 248.326 2.452 20 0 BEADLO Cc1nc(NCc2ccn(C(C)C)n2)cc[nH+]1 ZINC000078295077 344843688 /nfs/dbraw/zinc/84/36/88/344843688.db2.gz DYPMFKRWPVXYJA-UHFFFAOYSA-N 1 2 231.303 2.175 20 0 BEADLO CO[C@@H]1CCCC[C@@H]1Nc1cccc[nH+]1 ZINC000078427345 344867374 /nfs/dbraw/zinc/86/73/74/344867374.db2.gz DGKMEVVBNAVDRC-WDEREUQCSA-N 1 2 206.289 2.451 20 0 BEADLO CCOC[C@H](Nc1cc(CO)cc[nH+]1)C(C)C ZINC000641550967 362496037 /nfs/dbraw/zinc/49/60/37/362496037.db2.gz ZRCSGWWCLOWAIS-LBPRGKRZSA-N 1 2 238.331 2.047 20 0 BEADLO Cc1ncc(C[N@H+]2CCOC[C@H]2CC(C)C)o1 ZINC000628172593 344892794 /nfs/dbraw/zinc/89/27/94/344892794.db2.gz NFJWFFYJTQLRAH-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1ncc(C[N@@H+]2CCOC[C@H]2CC(C)C)o1 ZINC000628172593 344892796 /nfs/dbraw/zinc/89/27/96/344892796.db2.gz NFJWFFYJTQLRAH-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO CC(C)(C)c1noc(C[NH+]2CCCCC2)n1 ZINC000078777946 344903903 /nfs/dbraw/zinc/90/39/03/344903903.db2.gz IHKSYSBOFKOOGA-UHFFFAOYSA-N 1 2 223.320 2.353 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCS[C@@H](C)[C@@H]2C)n1 ZINC000628178782 344913337 /nfs/dbraw/zinc/91/33/37/344913337.db2.gz BTSFMUKTRMHCSS-UWVGGRQHSA-N 1 2 225.361 2.044 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCS[C@@H](C)[C@@H]2C)n1 ZINC000628178782 344913339 /nfs/dbraw/zinc/91/33/39/344913339.db2.gz BTSFMUKTRMHCSS-UWVGGRQHSA-N 1 2 225.361 2.044 20 0 BEADLO CC[C@H]1CCCC[C@@H]1C[N@H+](C)Cc1nnc[nH]1 ZINC000628179658 344915779 /nfs/dbraw/zinc/91/57/79/344915779.db2.gz JPZRSERYJYDDEP-NWDGAFQWSA-N 1 2 236.363 2.453 20 0 BEADLO CC[C@H]1CCCC[C@@H]1C[N@@H+](C)Cc1nnc[nH]1 ZINC000628179658 344915780 /nfs/dbraw/zinc/91/57/80/344915780.db2.gz JPZRSERYJYDDEP-NWDGAFQWSA-N 1 2 236.363 2.453 20 0 BEADLO c1coc(C[NH2+]Cc2cnc(C3CC3)o2)c1 ZINC000628199406 344969482 /nfs/dbraw/zinc/96/94/82/344969482.db2.gz QLRICIROGSLHLR-UHFFFAOYSA-N 1 2 218.256 2.435 20 0 BEADLO Cc1[nH+]c2ccccn2c1CS[C@@H](C)CO ZINC000079105624 344939017 /nfs/dbraw/zinc/93/90/17/344939017.db2.gz YYPZQBIVQIXEOV-VIFPVBQESA-N 1 2 236.340 2.257 20 0 BEADLO Cc1ncc(C[N@@H+]2CCO[C@H](c3ccco3)C2)o1 ZINC000628187812 344941063 /nfs/dbraw/zinc/94/10/63/344941063.db2.gz AVVGCYISGKDSLB-ZDUSSCGKSA-N 1 2 248.282 2.150 20 0 BEADLO Cc1ncc(C[N@H+]2CCO[C@H](c3ccco3)C2)o1 ZINC000628187812 344941065 /nfs/dbraw/zinc/94/10/65/344941065.db2.gz AVVGCYISGKDSLB-ZDUSSCGKSA-N 1 2 248.282 2.150 20 0 BEADLO COC(=O)[C@H](c1cccnc1)[NH+]1CCC(C)CC1 ZINC000127709802 187296116 /nfs/dbraw/zinc/29/61/16/187296116.db2.gz SWGFXTGGBIHVRM-ZDUSSCGKSA-N 1 2 248.326 2.028 20 0 BEADLO C[C@@H](CC(=O)N[C@@H]1CCC[C@@H]2C[C@@H]21)n1cc[nH+]c1 ZINC000583443892 344979923 /nfs/dbraw/zinc/97/99/23/344979923.db2.gz GJRBMNKRUWZSFL-QNWHQSFQSA-N 1 2 247.342 2.139 20 0 BEADLO Fc1c[nH+]ccc1NC[C@H]1CCC(F)(F)C1 ZINC000641549050 362497259 /nfs/dbraw/zinc/49/72/59/362497259.db2.gz QAIKGQFVTVYGBV-QMMMGPOBSA-N 1 2 230.233 2.490 20 0 BEADLO Fc1c[nH+]ccc1NC[C@@H]1CCC(F)(F)C1 ZINC000641549049 362497623 /nfs/dbraw/zinc/49/76/23/362497623.db2.gz QAIKGQFVTVYGBV-MRVPVSSYSA-N 1 2 230.233 2.490 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2ccc(C)nc2)CCO1 ZINC000153922965 345002452 /nfs/dbraw/zinc/00/24/52/345002452.db2.gz AHGHZJKNRWBJKG-AWEZNQCLSA-N 1 2 234.343 2.391 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2ccc(C)nc2)CCO1 ZINC000153922965 345002462 /nfs/dbraw/zinc/00/24/62/345002462.db2.gz AHGHZJKNRWBJKG-AWEZNQCLSA-N 1 2 234.343 2.391 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2ccc(C)nc2)CCO1 ZINC000153922860 345002812 /nfs/dbraw/zinc/00/28/12/345002812.db2.gz AHGHZJKNRWBJKG-CQSZACIVSA-N 1 2 234.343 2.391 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2ccc(C)nc2)CCO1 ZINC000153922860 345002814 /nfs/dbraw/zinc/00/28/14/345002814.db2.gz AHGHZJKNRWBJKG-CQSZACIVSA-N 1 2 234.343 2.391 20 0 BEADLO COC(=O)C1([NH2+]CCSC)CCCCCC1 ZINC000154753572 345048309 /nfs/dbraw/zinc/04/83/09/345048309.db2.gz FHGSWIMQUXLXEA-UHFFFAOYSA-N 1 2 245.388 2.205 20 0 BEADLO OCc1cc[nH+]c(NCC2=CCCCC2)c1 ZINC000641614382 362550866 /nfs/dbraw/zinc/55/08/66/362550866.db2.gz GHRZNUKXSUMEDJ-UHFFFAOYSA-N 1 2 218.300 2.486 20 0 BEADLO CCO[C@@H]1CCN(c2cc[nH+]cc2F)C[C@H]1C ZINC000641618608 362552282 /nfs/dbraw/zinc/55/22/82/362552282.db2.gz INRNZQUWZMWXDZ-ZWNOBZJWSA-N 1 2 238.306 2.472 20 0 BEADLO CC(=O)Nc1cccc(NCc2[nH]cc[nH+]2)c1C ZINC000155392898 345079900 /nfs/dbraw/zinc/07/99/00/345079900.db2.gz YNUOBPVOSBRRSC-UHFFFAOYSA-N 1 2 244.298 2.289 20 0 BEADLO OCc1cc[nH+]c(NC[C@@H]2C[C@H]2C2CC2)c1 ZINC000641623070 362554275 /nfs/dbraw/zinc/55/42/75/362554275.db2.gz DFSLAAFIEURRQF-RYUDHWBXSA-N 1 2 218.300 2.032 20 0 BEADLO Fc1c[nH+]ccc1NCC1(C(F)(F)F)CC1 ZINC000641594866 362536204 /nfs/dbraw/zinc/53/62/04/362536204.db2.gz SIISJXQYBIXETC-UHFFFAOYSA-N 1 2 234.196 2.397 20 0 BEADLO O=C(Cn1cc[nH+]c1)NCCCC1CCCCC1 ZINC000079934010 345060288 /nfs/dbraw/zinc/06/02/88/345060288.db2.gz WKMGATLBNJKFIK-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO Fc1c[nH+]ccc1NCCC1(F)CCC1 ZINC000641599318 362540355 /nfs/dbraw/zinc/54/03/55/362540355.db2.gz KMPMNOKSMYPCDG-UHFFFAOYSA-N 1 2 212.243 2.337 20 0 BEADLO O=C(CCCC1CCCC1)NCc1[nH]cc[nH+]1 ZINC000080209128 345119874 /nfs/dbraw/zinc/11/98/74/345119874.db2.gz WIKGJNXGUNJEAJ-UHFFFAOYSA-N 1 2 235.331 2.386 20 0 BEADLO C[C@@H]1CN(c2cc[nH+]cc2F)CC2(CCC2)O1 ZINC000641649104 362575552 /nfs/dbraw/zinc/57/55/52/362575552.db2.gz XSBBREMJAQXZTN-SNVBAGLBSA-N 1 2 236.290 2.369 20 0 BEADLO CN(Cc1ccccn1)c1cc[nH+]cc1F ZINC000678788688 488283156 /nfs/dbraw/zinc/28/31/56/488283156.db2.gz MTRHMBLFYQNNMI-UHFFFAOYSA-N 1 2 217.247 2.252 20 0 BEADLO CC[C@H](Nc1cc[nH+]cc1F)[C@@H]1CCCCO1 ZINC000641655095 362578720 /nfs/dbraw/zinc/57/87/20/362578720.db2.gz CLPMGQCSCWRRLV-AAEUAGOBSA-N 1 2 238.306 2.402 20 0 BEADLO CC(C)(C)O[C@H]1C[C@H](Nc2cc[nH+]cc2F)C1 ZINC000641655694 362579607 /nfs/dbraw/zinc/57/96/07/362579607.db2.gz VVGFCHZUUSPXKD-MGCOHNPYSA-N 1 2 238.306 2.401 20 0 BEADLO CC1(C)C[C@H](O)CCN(c2cc[nH+]cc2F)C1 ZINC000641629490 362559280 /nfs/dbraw/zinc/55/92/80/362559280.db2.gz LQBLQAWVAZAHNC-SNVBAGLBSA-N 1 2 238.306 2.208 20 0 BEADLO CCn1cc([C@@H](C)Nc2cc[nH+]cc2F)cn1 ZINC000641629465 362559590 /nfs/dbraw/zinc/55/95/90/362559590.db2.gz LLUSZPCQEMXUSM-SECBINFHSA-N 1 2 234.278 2.032 20 0 BEADLO CO[C@H](CNc1cc(CO)cc[nH+]1)CC(C)C ZINC000641637974 362566272 /nfs/dbraw/zinc/56/62/72/362566272.db2.gz MZXJXYGZMDOFPE-LBPRGKRZSA-N 1 2 238.331 2.047 20 0 BEADLO CC(F)(F)C[NH2+]Cc1ccc2nccnc2c1 ZINC000634981471 345161247 /nfs/dbraw/zinc/16/12/47/345161247.db2.gz JOPBHFDGHYZQIT-UHFFFAOYSA-N 1 2 237.253 2.375 20 0 BEADLO CCCc1nc(C)c(C[NH2+]Cc2ccon2)o1 ZINC000634981978 345161776 /nfs/dbraw/zinc/16/17/76/345161776.db2.gz YOKKMTXQRSLRCH-UHFFFAOYSA-N 1 2 235.287 2.213 20 0 BEADLO COc1cc(C)ccc1[NH2+][C@H]1CCNC(=O)CC1 ZINC000634970437 345145544 /nfs/dbraw/zinc/14/55/44/345145544.db2.gz QTIRFKZMKBJZIT-LLVKDONJSA-N 1 2 248.326 2.084 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CCCc2[nH+]c[nH]c21)C(C)(C)C ZINC000582129244 345147195 /nfs/dbraw/zinc/14/71/95/345147195.db2.gz OZSRLPRWWCDHIL-NXEZZACHSA-N 1 2 249.358 2.380 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CCCc2[nH]c[nH+]c21)C(C)(C)C ZINC000582129244 345147196 /nfs/dbraw/zinc/14/71/96/345147196.db2.gz OZSRLPRWWCDHIL-NXEZZACHSA-N 1 2 249.358 2.380 20 0 BEADLO Cc1ccc(NCc2ccon2)c(C)[nH+]1 ZINC000634971595 345149150 /nfs/dbraw/zinc/14/91/50/345149150.db2.gz ABAQQRGXWUCOJM-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO CC[C@H](C)NC(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC000635056993 345230900 /nfs/dbraw/zinc/23/09/00/345230900.db2.gz OCVXZPOORVRARA-RYUDHWBXSA-N 1 2 237.347 2.385 20 0 BEADLO CC(C)C[C@H](C(=O)N1CCCC1)n1cc[nH+]c1 ZINC000635058086 345231974 /nfs/dbraw/zinc/23/19/74/345231974.db2.gz ABKPZMCFRNWPNQ-GFCCVEGCSA-N 1 2 235.331 2.093 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CCCC[C@@H]2CC)[nH+]1 ZINC000635058369 345232297 /nfs/dbraw/zinc/23/22/97/345232297.db2.gz LABKJCCQKDWNHZ-LBPRGKRZSA-N 1 2 249.358 2.306 20 0 BEADLO CN(C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)c1ccccc1 ZINC000635059160 345232834 /nfs/dbraw/zinc/23/28/34/345232834.db2.gz QAHYIQIRRWJJIW-VXGBXAGGSA-N 1 2 241.294 2.176 20 0 BEADLO CN(C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)c1ccccc1 ZINC000635059160 345232836 /nfs/dbraw/zinc/23/28/36/345232836.db2.gz QAHYIQIRRWJJIW-VXGBXAGGSA-N 1 2 241.294 2.176 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)cc1 ZINC000635061081 345233606 /nfs/dbraw/zinc/23/36/06/345233606.db2.gz NYOASWIGIKHLNC-VXGBXAGGSA-N 1 2 241.294 2.460 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)cc1 ZINC000635061081 345233609 /nfs/dbraw/zinc/23/36/09/345233609.db2.gz NYOASWIGIKHLNC-VXGBXAGGSA-N 1 2 241.294 2.460 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@@H]2CCCC[C@@H]2C)[nH+]1 ZINC000635080262 345242180 /nfs/dbraw/zinc/24/21/80/345242180.db2.gz ZMZMLIAHDNSSEB-CMPLNLGQSA-N 1 2 249.358 2.210 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@H]2CCCC[C@H]2C)[nH+]1 ZINC000635080264 345242266 /nfs/dbraw/zinc/24/22/66/345242266.db2.gz ZMZMLIAHDNSSEB-PWSUYJOCSA-N 1 2 249.358 2.210 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccco1)c1nccn1C ZINC000132084685 345316311 /nfs/dbraw/zinc/31/63/11/345316311.db2.gz DKMFVBBDEGETLJ-LLVKDONJSA-N 1 2 219.288 2.254 20 0 BEADLO C[C@H]1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635229352 345279065 /nfs/dbraw/zinc/27/90/65/345279065.db2.gz NKQOYEMXJWFAMT-NNYUYHANSA-N 1 2 247.342 2.208 20 0 BEADLO C[C@H]1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635229352 345279067 /nfs/dbraw/zinc/27/90/67/345279067.db2.gz NKQOYEMXJWFAMT-NNYUYHANSA-N 1 2 247.342 2.208 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635229350 345279223 /nfs/dbraw/zinc/27/92/23/345279223.db2.gz NKQOYEMXJWFAMT-DDHJBXDOSA-N 1 2 247.342 2.208 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635229350 345279226 /nfs/dbraw/zinc/27/92/26/345279226.db2.gz NKQOYEMXJWFAMT-DDHJBXDOSA-N 1 2 247.342 2.208 20 0 BEADLO CCc1c[nH]c(CC(=O)N(CC(C)C)C2CC2)[nH+]1 ZINC000635233831 345280961 /nfs/dbraw/zinc/28/09/61/345280961.db2.gz BNDFTRNONQFFKA-UHFFFAOYSA-N 1 2 249.358 2.162 20 0 BEADLO CCc1c[nH]c(CC(=O)N(C)[C@H](C)C(C)C)[nH+]1 ZINC000635233823 345281192 /nfs/dbraw/zinc/28/11/92/345281192.db2.gz BJPKXFXRCJLRKJ-SNVBAGLBSA-N 1 2 237.347 2.018 20 0 BEADLO CC(C)[C@H](C)N(C)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635236642 345281200 /nfs/dbraw/zinc/28/12/00/345281200.db2.gz WVGQWBOGLYAVDK-HBNTYKKESA-N 1 2 235.331 2.016 20 0 BEADLO CC(C)[C@H](C)N(C)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635236642 345281202 /nfs/dbraw/zinc/28/12/02/345281202.db2.gz WVGQWBOGLYAVDK-HBNTYKKESA-N 1 2 235.331 2.016 20 0 BEADLO CC[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635267857 345291181 /nfs/dbraw/zinc/29/11/81/345291181.db2.gz TZIQGSLMAXFTRB-IJLUTSLNSA-N 1 2 247.342 2.162 20 0 BEADLO CC[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635267857 345291184 /nfs/dbraw/zinc/29/11/84/345291184.db2.gz TZIQGSLMAXFTRB-IJLUTSLNSA-N 1 2 247.342 2.162 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@@H](C)[C@@H](C)CC)[nH+]1 ZINC000635419790 345360002 /nfs/dbraw/zinc/36/00/02/345360002.db2.gz GXEFZSAHEVLCLD-UWVGGRQHSA-N 1 2 237.347 2.065 20 0 BEADLO c1c(CSc2cnccn2)[nH+]c2ccccn12 ZINC000080616255 345364241 /nfs/dbraw/zinc/36/42/41/345364241.db2.gz OQXUQWUYLMDSST-UHFFFAOYSA-N 1 2 242.307 2.417 20 0 BEADLO C[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)CC1 ZINC000635447069 345373058 /nfs/dbraw/zinc/37/30/58/345373058.db2.gz OXFOKVSRSHEKJI-QJPTWQEYSA-N 1 2 247.342 2.162 20 0 BEADLO C[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)CC1 ZINC000635447069 345373060 /nfs/dbraw/zinc/37/30/60/345373060.db2.gz OXFOKVSRSHEKJI-QJPTWQEYSA-N 1 2 247.342 2.162 20 0 BEADLO CCN(C(=O)[C@@H](C)n1cc[nH+]c1)c1ccccc1 ZINC000053898745 1172061011 /nfs/dbraw/zinc/06/10/11/1172061011.db2.gz YNWSHDCDTKSFFZ-GFCCVEGCSA-N 1 2 243.310 2.497 20 0 BEADLO CSCCCSCc1cn(C)c[nH+]1 ZINC000603335700 349927393 /nfs/dbraw/zinc/92/73/93/349927393.db2.gz MYPVAHHFMHXQHU-UHFFFAOYSA-N 1 2 216.375 2.406 20 0 BEADLO Cc1c[nH+]cc(N[C@@H](C)CCn2cccn2)c1 ZINC000159331986 345425351 /nfs/dbraw/zinc/42/53/51/345425351.db2.gz QKYACOVWBPXYRI-LBPRGKRZSA-N 1 2 230.315 2.477 20 0 BEADLO Cn1cc(CNc2cc[nH+]c(C(C)(C)C)n2)cn1 ZINC000080785789 345447316 /nfs/dbraw/zinc/44/73/16/345447316.db2.gz IPCUBBVCGBJYGS-UHFFFAOYSA-N 1 2 245.330 2.120 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2ccno2)cc1O ZINC000080962605 345455383 /nfs/dbraw/zinc/45/53/83/345455383.db2.gz GBCYEGQNKPLYGW-UHFFFAOYSA-N 1 2 248.282 2.021 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2ccno2)cc1O ZINC000080962605 345455384 /nfs/dbraw/zinc/45/53/84/345455384.db2.gz GBCYEGQNKPLYGW-UHFFFAOYSA-N 1 2 248.282 2.021 20 0 BEADLO C[C@H](CNC(=O)/C=C/C(C)(C)C)Cn1cc[nH+]c1 ZINC000081801575 345492766 /nfs/dbraw/zinc/49/27/66/345492766.db2.gz HGNIXQVJDVBNOW-BTDICHCPSA-N 1 2 249.358 2.238 20 0 BEADLO C[C@@H]1CCC[C@H](CNc2cc[nH+]cc2F)O1 ZINC000641660294 362586942 /nfs/dbraw/zinc/58/69/42/362586942.db2.gz WNTUPLBMQXLCEM-NXEZZACHSA-N 1 2 224.279 2.012 20 0 BEADLO Cc1nsc(NCCc2ccc(C)[nH+]c2)n1 ZINC000080981860 345458397 /nfs/dbraw/zinc/45/83/97/345458397.db2.gz CBNOUAJDHLHXNN-UHFFFAOYSA-N 1 2 234.328 2.205 20 0 BEADLO CSC[C@@H](C)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000081000914 345458502 /nfs/dbraw/zinc/45/85/02/345458502.db2.gz OQVFFXSESDUKCB-SSDOTTSWSA-N 1 2 236.344 2.430 20 0 BEADLO CC(C)[C@H](C)C(=O)NCCCNc1cccc[nH+]1 ZINC000172345746 187305283 /nfs/dbraw/zinc/30/52/83/187305283.db2.gz VWGXCWLXEPFWQI-LBPRGKRZSA-N 1 2 249.358 2.292 20 0 BEADLO C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)Cn1cc[nH+]c1 ZINC000081410442 345472634 /nfs/dbraw/zinc/47/26/34/345472634.db2.gz GMQQWBWKJWZSRH-AGIUHOORSA-N 1 2 247.342 2.063 20 0 BEADLO O=C(Cn1cc[nH+]c1)N1CCC2(CCCC2)CC1 ZINC000081432277 345474730 /nfs/dbraw/zinc/47/47/30/345474730.db2.gz AGYNHGZJGHJSGF-UHFFFAOYSA-N 1 2 247.342 2.066 20 0 BEADLO C(c1nc(C2CC2)no1)[N@@H+]1CCC12CCC2 ZINC000081545059 345477725 /nfs/dbraw/zinc/47/77/25/345477725.db2.gz QVEFIPWSCCWGHB-UHFFFAOYSA-N 1 2 219.288 2.075 20 0 BEADLO C(c1nc(C2CC2)no1)[N@H+]1CCC12CCC2 ZINC000081545059 345477726 /nfs/dbraw/zinc/47/77/26/345477726.db2.gz QVEFIPWSCCWGHB-UHFFFAOYSA-N 1 2 219.288 2.075 20 0 BEADLO CC[C@H](CCO)Nc1cc[nH+]c2ccncc12 ZINC000085687943 345528872 /nfs/dbraw/zinc/52/88/72/345528872.db2.gz ZBLFIZGBLDJTGE-SNVBAGLBSA-N 1 2 231.299 2.203 20 0 BEADLO c1cc2[nH+]ccc(NCCOCC3CC3)c2cn1 ZINC000085685667 345529105 /nfs/dbraw/zinc/52/91/05/345529105.db2.gz ONNPBYKJBHPMED-UHFFFAOYSA-N 1 2 243.310 2.468 20 0 BEADLO CCC[C@H](O)CNc1cc[nH+]c2ccncc12 ZINC000085686751 345529219 /nfs/dbraw/zinc/52/92/19/345529219.db2.gz JPOPVGGTLXRXLI-JTQLQIEISA-N 1 2 231.299 2.203 20 0 BEADLO Cn1c[nH+]c(CSCc2ccccn2)c1 ZINC000603355821 349931846 /nfs/dbraw/zinc/93/18/46/349931846.db2.gz CNDJVLJLVBDENN-UHFFFAOYSA-N 1 2 219.313 2.249 20 0 BEADLO Cc1cc(N[C@@H](C)CO)c2cccc(F)c2[nH+]1 ZINC000091013486 345580088 /nfs/dbraw/zinc/58/00/88/345580088.db2.gz ZKOGESCAHUMALM-VIFPVBQESA-N 1 2 234.274 2.475 20 0 BEADLO Cc1cc(CSCCn2cc[nH+]c2)on1 ZINC000090199666 345567326 /nfs/dbraw/zinc/56/73/26/345567326.db2.gz RQBUAXXKBJYELF-UHFFFAOYSA-N 1 2 223.301 2.113 20 0 BEADLO CCc1c[nH]c(CC(=O)N(C)C[C@H](C)CC)[nH+]1 ZINC000635545503 345569760 /nfs/dbraw/zinc/56/97/60/345569760.db2.gz DDQULXJNSCQKHO-SNVBAGLBSA-N 1 2 237.347 2.019 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1sccc1OC ZINC000091980460 345613925 /nfs/dbraw/zinc/61/39/25/345613925.db2.gz SLYMEUKMHYEIEJ-SNVBAGLBSA-N 1 2 241.356 2.368 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1sccc1OC ZINC000091980460 345613927 /nfs/dbraw/zinc/61/39/27/345613927.db2.gz SLYMEUKMHYEIEJ-SNVBAGLBSA-N 1 2 241.356 2.368 20 0 BEADLO Cc1cc(C)c(NC(=O)[C@@H]2CCO[C@@H]2C)c(C)[nH+]1 ZINC000092303424 345628766 /nfs/dbraw/zinc/62/87/66/345628766.db2.gz SQDBBTRMFFBRPB-VXGBXAGGSA-N 1 2 248.326 2.370 20 0 BEADLO C[C@@]1(C(F)F)CN(c2cc[nH+]cc2F)CCO1 ZINC000641673306 362597791 /nfs/dbraw/zinc/59/77/91/362597791.db2.gz YCLZIFXGAYLTOU-NSHDSACASA-N 1 2 246.232 2.081 20 0 BEADLO CSCCCN(C)c1cc[nH+]cc1F ZINC000603366141 349933722 /nfs/dbraw/zinc/93/37/22/349933722.db2.gz KTFPUDRBAPPPSE-UHFFFAOYSA-N 1 2 214.309 2.410 20 0 BEADLO Cc1cc2ccccc2[nH+]c1N1C[C@H]2C[C@@]2(O)C1 ZINC000641713579 362626956 /nfs/dbraw/zinc/62/69/56/362626956.db2.gz OBIQHBOREMHBLC-IUODEOHRSA-N 1 2 240.306 2.114 20 0 BEADLO COCC[N@H+](CC(F)F)[C@H]1CC[C@@H](C)C1 ZINC000092965777 345650038 /nfs/dbraw/zinc/65/00/38/345650038.db2.gz SQDRKOYXHJLLAI-ZJUUUORDSA-N 1 2 221.291 2.389 20 0 BEADLO COCC[N@@H+](CC(F)F)[C@H]1CC[C@@H](C)C1 ZINC000092965777 345650039 /nfs/dbraw/zinc/65/00/39/345650039.db2.gz SQDRKOYXHJLLAI-ZJUUUORDSA-N 1 2 221.291 2.389 20 0 BEADLO C[C@@H](Nc1cc[nH+]c(C(C)(C)C)n1)C(F)F ZINC000641729567 362644757 /nfs/dbraw/zinc/64/47/57/362644757.db2.gz HDTKRPAFYVSEOM-SSDOTTSWSA-N 1 2 229.274 2.262 20 0 BEADLO CC1(C)CCCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635556621 345707866 /nfs/dbraw/zinc/70/78/66/345707866.db2.gz JORLDFHUUPBSMO-GHMZBOCLSA-N 1 2 247.342 2.162 20 0 BEADLO CC1(C)CCCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635556621 345707869 /nfs/dbraw/zinc/70/78/69/345707869.db2.gz JORLDFHUUPBSMO-GHMZBOCLSA-N 1 2 247.342 2.162 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@H](C)C2CCCC2)[nH+]1 ZINC000635567127 345813364 /nfs/dbraw/zinc/81/33/64/345813364.db2.gz QJACRQBMBONVCK-SNVBAGLBSA-N 1 2 249.358 2.210 20 0 BEADLO Cc1cc(N[C@@H]2C[C@H](C)O[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000631463188 345775822 /nfs/dbraw/zinc/77/58/22/345775822.db2.gz ATQMZZOHCNGQHW-HOSYDEDBSA-N 1 2 247.342 2.062 20 0 BEADLO CC[C@H](Nc1ncnc2c1CCC2)c1[nH]cc[nH+]1 ZINC000139793276 345802263 /nfs/dbraw/zinc/80/22/63/345802263.db2.gz QCZIBQPLIIHZSM-JTQLQIEISA-N 1 2 243.314 2.252 20 0 BEADLO CCCN(CCC)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000139889950 345804253 /nfs/dbraw/zinc/80/42/53/345804253.db2.gz CFOJHMYJYVMSHJ-AATRIKPKSA-N 1 2 221.304 2.072 20 0 BEADLO CC(C)SCCNc1cc[nH+]cc1F ZINC000603379531 349939346 /nfs/dbraw/zinc/93/93/46/349939346.db2.gz LJNHFCGDNNKQSX-UHFFFAOYSA-N 1 2 214.309 2.196 20 0 BEADLO Cn1cccc1C[NH2+][C@H]1CCCC1(F)F ZINC000389906553 537918797 /nfs/dbraw/zinc/91/87/97/537918797.db2.gz HFYFSARXSYRGQV-JTQLQIEISA-N 1 2 214.259 2.303 20 0 BEADLO CC(C)C[C@@H](C(=O)N1CCC[C@@H]1C)n1cc[nH+]c1 ZINC000635628868 345903396 /nfs/dbraw/zinc/90/33/96/345903396.db2.gz RVGRGVDWCYFAEB-STQMWFEESA-N 1 2 249.358 2.481 20 0 BEADLO C[C@@H]1CC[C@H](C)N(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635632864 345910706 /nfs/dbraw/zinc/91/07/06/345910706.db2.gz VEZKOZDZOZMUMA-WRWGMCAJSA-N 1 2 247.342 2.160 20 0 BEADLO C[C@@H]1CC[C@H](C)N(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635632864 345910708 /nfs/dbraw/zinc/91/07/08/345910708.db2.gz VEZKOZDZOZMUMA-WRWGMCAJSA-N 1 2 247.342 2.160 20 0 BEADLO Cc1cn2ccc(C(=O)NC3CC(C)C3)cc2[nH+]1 ZINC000635642123 345914949 /nfs/dbraw/zinc/91/49/49/345914949.db2.gz LHFNOFFSGYKHNM-UHFFFAOYSA-N 1 2 243.310 2.171 20 0 BEADLO CNc1cc(NCc2ccccc2)nc[nH+]1 ZINC000087807767 345942007 /nfs/dbraw/zinc/94/20/07/345942007.db2.gz YPBIKJGGTCYHDD-UHFFFAOYSA-N 1 2 214.272 2.130 20 0 BEADLO CNc1cc(NCc2ccccc2)[nH+]cn1 ZINC000087807767 345942009 /nfs/dbraw/zinc/94/20/09/345942009.db2.gz YPBIKJGGTCYHDD-UHFFFAOYSA-N 1 2 214.272 2.130 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CC[C@@H](C(C)C)C2)[nH+]1 ZINC000635667131 345973161 /nfs/dbraw/zinc/97/31/61/345973161.db2.gz LCFGSENQPRBLGM-LLVKDONJSA-N 1 2 249.358 2.019 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)c1ccco1 ZINC000074859412 345981910 /nfs/dbraw/zinc/98/19/10/345981910.db2.gz GWVVEJRZLVOAOE-UHFFFAOYSA-N 1 2 227.223 2.180 20 0 BEADLO CCOC(=O)[C@@H](Cc1ccccc1)[NH2+][C@@H]1C[C@H]1C ZINC000585729243 345982967 /nfs/dbraw/zinc/98/29/67/345982967.db2.gz XRAPYIGNAKEBLN-MRVWCRGKSA-N 1 2 247.338 2.159 20 0 BEADLO COCCCCN(C)c1cc[nH+]c(C2CC2)n1 ZINC000419019360 192094106 /nfs/dbraw/zinc/09/41/06/192094106.db2.gz VANPBKOCUULRJG-UHFFFAOYSA-N 1 2 235.331 2.217 20 0 BEADLO CC1(C)CC[C@@H](NC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635758465 346051880 /nfs/dbraw/zinc/05/18/80/346051880.db2.gz RATVUHYYZBBFPG-GMTAPVOTSA-N 1 2 247.342 2.208 20 0 BEADLO CC1(C)CC[C@@H](NC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635758465 346051882 /nfs/dbraw/zinc/05/18/82/346051882.db2.gz RATVUHYYZBBFPG-GMTAPVOTSA-N 1 2 247.342 2.208 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CCCC[C@@H](C)C2)[nH+]1 ZINC000635814926 346071511 /nfs/dbraw/zinc/07/15/11/346071511.db2.gz WMQLBEWBMXRLMS-LLVKDONJSA-N 1 2 249.358 2.163 20 0 BEADLO C[C@@H](CCC1CC1)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635810464 346073875 /nfs/dbraw/zinc/07/38/75/346073875.db2.gz XFUNLUQMIIWRKA-MVWJERBFSA-N 1 2 247.342 2.208 20 0 BEADLO C[C@@H](CCC1CC1)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635810464 346073878 /nfs/dbraw/zinc/07/38/78/346073878.db2.gz XFUNLUQMIIWRKA-MVWJERBFSA-N 1 2 247.342 2.208 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@]2(C)CCC[C@H]2C)c[nH+]1 ZINC001639097830 1172073748 /nfs/dbraw/zinc/07/37/48/1172073748.db2.gz QNMMKAWHBPZTKY-YGRLFVJLSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@]2(C)CCC[C@H]2C)[nH+]1 ZINC001639097830 1172073757 /nfs/dbraw/zinc/07/37/57/1172073757.db2.gz QNMMKAWHBPZTKY-YGRLFVJLSA-N 1 2 249.358 2.415 20 0 BEADLO CC(C)=CCNC(=O)c1ccn2cc(C)[nH+]c2c1 ZINC000635846313 346089148 /nfs/dbraw/zinc/08/91/48/346089148.db2.gz WWEGPDBNJNVTGK-UHFFFAOYSA-N 1 2 243.310 2.339 20 0 BEADLO CN(C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C1(C)CCCC1 ZINC000635869841 346092296 /nfs/dbraw/zinc/09/22/96/346092296.db2.gz SOINECJOXSJEIF-GHMZBOCLSA-N 1 2 247.342 2.304 20 0 BEADLO CN(C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C1(C)CCCC1 ZINC000635869841 346092297 /nfs/dbraw/zinc/09/22/97/346092297.db2.gz SOINECJOXSJEIF-GHMZBOCLSA-N 1 2 247.342 2.304 20 0 BEADLO Cc1cn2ccc(C(=O)N3[C@H](C)C[C@@H]3C)cc2[nH+]1 ZINC000635875808 346096065 /nfs/dbraw/zinc/09/60/65/346096065.db2.gz PURBCVMFDURGKT-PHIMTYICSA-N 1 2 243.310 2.266 20 0 BEADLO CC[C@@H]1C[C@H]1NC(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC000635889135 346099177 /nfs/dbraw/zinc/09/91/77/346099177.db2.gz JHXHWNSWOFWSMJ-JHJVBQTASA-N 1 2 249.358 2.385 20 0 BEADLO C[C@@H]1CCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635892859 346104150 /nfs/dbraw/zinc/10/41/50/346104150.db2.gz DMEAZWMIQCALAB-WRWGMCAJSA-N 1 2 247.342 2.066 20 0 BEADLO C[C@@H]1CCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635892859 346104153 /nfs/dbraw/zinc/10/41/53/346104153.db2.gz DMEAZWMIQCALAB-WRWGMCAJSA-N 1 2 247.342 2.066 20 0 BEADLO c1nc(N2CCCC2)cc(NC[C@H]2CC23CC3)[nH+]1 ZINC000418999275 192096648 /nfs/dbraw/zinc/09/66/48/192096648.db2.gz WTVLMBNFNQGKAD-LLVKDONJSA-N 1 2 244.342 2.289 20 0 BEADLO c1nc(NC[C@H]2CC23CC3)cc(N2CCCC2)[nH+]1 ZINC000418999275 192096649 /nfs/dbraw/zinc/09/66/49/192096649.db2.gz WTVLMBNFNQGKAD-LLVKDONJSA-N 1 2 244.342 2.289 20 0 BEADLO CCc1c[nH]c(CC(=O)NC(C)(C)C2CCC2)[nH+]1 ZINC000635992439 346143007 /nfs/dbraw/zinc/14/30/07/346143007.db2.gz SFCLACVRYFJAOA-UHFFFAOYSA-N 1 2 249.358 2.210 20 0 BEADLO CCN(C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)[C@H](C)C(C)C ZINC000635940859 346124530 /nfs/dbraw/zinc/12/45/30/346124530.db2.gz AAISOWVPCCGWED-IJLUTSLNSA-N 1 2 249.358 2.406 20 0 BEADLO CCN(C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)[C@H](C)C(C)C ZINC000635940859 346124531 /nfs/dbraw/zinc/12/45/31/346124531.db2.gz AAISOWVPCCGWED-IJLUTSLNSA-N 1 2 249.358 2.406 20 0 BEADLO Cn1c[nH+]cc1CCC(=O)N[C@@H]1CCCC1(C)C ZINC000193459205 187315790 /nfs/dbraw/zinc/31/57/90/187315790.db2.gz HOTVTYRILTWKSQ-GFCCVEGCSA-N 1 2 249.358 2.048 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)CC(C)=C(C)C ZINC000635984346 346138335 /nfs/dbraw/zinc/13/83/35/346138335.db2.gz SFOJNOLHLPEWPB-UHFFFAOYSA-N 1 2 235.331 2.266 20 0 BEADLO CCC1(NC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)CCCC1 ZINC000635981510 346146367 /nfs/dbraw/zinc/14/63/67/346146367.db2.gz SVOYFMSRNCOQDM-GHMZBOCLSA-N 1 2 247.342 2.352 20 0 BEADLO CCC1(NC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)CCCC1 ZINC000635981510 346146369 /nfs/dbraw/zinc/14/63/69/346146369.db2.gz SVOYFMSRNCOQDM-GHMZBOCLSA-N 1 2 247.342 2.352 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@H]2C[C@]2(C)C(C)C)[nH+]1 ZINC000636018277 346157347 /nfs/dbraw/zinc/15/73/47/346157347.db2.gz KRPMKQWCGREWSQ-SMDDNHRTSA-N 1 2 249.358 2.065 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@@H]2C[C@@]2(C)C(C)C)[nH+]1 ZINC000636018276 346157518 /nfs/dbraw/zinc/15/75/18/346157518.db2.gz KRPMKQWCGREWSQ-RISCZKNCSA-N 1 2 249.358 2.065 20 0 BEADLO Cc1[nH]c(CN(C)Cc2ccc(C)cn2)[nH+]c1C ZINC000628249679 346218844 /nfs/dbraw/zinc/21/88/44/346218844.db2.gz NXHYTKSVNNMUOT-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)n1 ZINC000628255607 346249420 /nfs/dbraw/zinc/24/94/20/346249420.db2.gz SEWHQYGTIWKAQU-DTWKUNHWSA-N 1 2 247.264 2.491 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)n1 ZINC000628255607 346249421 /nfs/dbraw/zinc/24/94/21/346249421.db2.gz SEWHQYGTIWKAQU-DTWKUNHWSA-N 1 2 247.264 2.491 20 0 BEADLO Cc1c[nH]c(CN2CCCC[C@@H]2c2cc[nH]n2)[nH+]1 ZINC000628271658 346282457 /nfs/dbraw/zinc/28/24/57/346282457.db2.gz LRKOZIUZFWEBLP-GFCCVEGCSA-N 1 2 245.330 2.168 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC(F)(F)[C@H](C)C2)n1 ZINC000628285088 346296894 /nfs/dbraw/zinc/29/68/94/346296894.db2.gz HVWQFIGLJBDFMN-MRVPVSSYSA-N 1 2 229.274 2.195 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC(F)(F)[C@H](C)C2)n1 ZINC000628285088 346296897 /nfs/dbraw/zinc/29/68/97/346296897.db2.gz HVWQFIGLJBDFMN-MRVPVSSYSA-N 1 2 229.274 2.195 20 0 BEADLO Cc1cccc(C)c1C[NH2+]CC(F)(F)CO ZINC000231777270 179036794 /nfs/dbraw/zinc/03/67/94/179036794.db2.gz XIYXLIPHZWEFSY-UHFFFAOYSA-N 1 2 229.270 2.021 20 0 BEADLO Cc1cccc(C)c1C[NH2+][C@]1(C)CCOC1=O ZINC000289654598 179038653 /nfs/dbraw/zinc/03/86/53/179038653.db2.gz TYBQIAQPCHJGLX-CQSZACIVSA-N 1 2 233.311 2.099 20 0 BEADLO Cn1c[nH+]cc1CC[N@@H+]1CCC[C@H]2CCC[C@H]21 ZINC000335135144 187320108 /nfs/dbraw/zinc/32/01/08/187320108.db2.gz ZLGTUOAZNSDGSV-TZMCWYRMSA-N 1 2 233.359 2.227 20 0 BEADLO CN(CCC(C)(C)C)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636063716 346308022 /nfs/dbraw/zinc/30/80/22/346308022.db2.gz UWXBGJGDXPNDLA-GHMZBOCLSA-N 1 2 249.358 2.408 20 0 BEADLO CN(CCC(C)(C)C)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636063716 346308025 /nfs/dbraw/zinc/30/80/25/346308025.db2.gz UWXBGJGDXPNDLA-GHMZBOCLSA-N 1 2 249.358 2.408 20 0 BEADLO CCc1nc(CNc2cc[nH+]cc2Cl)n[nH]1 ZINC000295063577 346354952 /nfs/dbraw/zinc/35/49/52/346354952.db2.gz ZHPYAVJSSOTGET-UHFFFAOYSA-N 1 2 237.694 2.028 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@H](C(C)C)C2CC2)[nH+]1 ZINC000636227115 346360285 /nfs/dbraw/zinc/36/02/85/346360285.db2.gz OITRDAQVLGUHMX-CQSZACIVSA-N 1 2 249.358 2.065 20 0 BEADLO CN(C[C@@H]1CC1(C)C)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636237032 346364549 /nfs/dbraw/zinc/36/45/49/346364549.db2.gz CZFOACVSJYIKQW-HBNTYKKESA-N 1 2 247.342 2.018 20 0 BEADLO CN(C[C@@H]1CC1(C)C)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636237032 346364551 /nfs/dbraw/zinc/36/45/51/346364551.db2.gz CZFOACVSJYIKQW-HBNTYKKESA-N 1 2 247.342 2.018 20 0 BEADLO Cc1nnc(NCCCc2cccc(C)[nH+]2)o1 ZINC000286641588 179056508 /nfs/dbraw/zinc/05/65/08/179056508.db2.gz TXDZYHBRDJNXRQ-UHFFFAOYSA-N 1 2 232.287 2.126 20 0 BEADLO Cc1cccc(CCCNc2nncs2)[nH+]1 ZINC000295749866 179056588 /nfs/dbraw/zinc/05/65/88/179056588.db2.gz ZPUGPPQJIHFIKK-UHFFFAOYSA-N 1 2 234.328 2.286 20 0 BEADLO CCC[C@H]([NH2+]CC[C@@H](C)F)C(=O)OCC ZINC000419166229 192101463 /nfs/dbraw/zinc/10/14/63/192101463.db2.gz BBPCJWMIKACWME-ZJUUUORDSA-N 1 2 219.300 2.056 20 0 BEADLO CC(C)CCCNC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000563372151 323121664 /nfs/dbraw/zinc/12/16/64/323121664.db2.gz WSRQQTOIBSEVIL-LLVKDONJSA-N 1 2 237.347 2.141 20 0 BEADLO CC(C)CCCNC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000563372151 323121665 /nfs/dbraw/zinc/12/16/65/323121665.db2.gz WSRQQTOIBSEVIL-LLVKDONJSA-N 1 2 237.347 2.141 20 0 BEADLO CC[C@@H](O)COc1cccc(-n2cc[nH+]c2)c1 ZINC000157031694 346375821 /nfs/dbraw/zinc/37/58/21/346375821.db2.gz UXXMZLXJYKJTEJ-GFCCVEGCSA-N 1 2 232.283 2.022 20 0 BEADLO Cc1cscc1NC(=O)C[NH+]1CC(C)(C)C1 ZINC000563381839 323121884 /nfs/dbraw/zinc/12/18/84/323121884.db2.gz YBWDFEKZCVIQBB-UHFFFAOYSA-N 1 2 238.356 2.337 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2cccc(C)c2)[nH]1 ZINC000268245837 179068426 /nfs/dbraw/zinc/06/84/26/179068426.db2.gz BAJWZMXYIFACSB-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2cccc(C)c2)[nH]1 ZINC000268245837 179068428 /nfs/dbraw/zinc/06/84/28/179068428.db2.gz BAJWZMXYIFACSB-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO CCc1nnc(C[NH2+][C@H](C)c2ccsc2)[nH]1 ZINC000282449331 346404584 /nfs/dbraw/zinc/40/45/84/346404584.db2.gz IQXQUKUKYOFQBN-MRVPVSSYSA-N 1 2 236.344 2.279 20 0 BEADLO Cc1ccc(SCc2[nH+]ccn2C)nc1 ZINC000336475651 187368414 /nfs/dbraw/zinc/36/84/14/187368414.db2.gz XKTWNUHPXTYBLM-UHFFFAOYSA-N 1 2 219.313 2.416 20 0 BEADLO C[N@H+](CCOC(C)(C)C)CC(=O)OC(C)(C)C ZINC000170645572 346429176 /nfs/dbraw/zinc/42/91/76/346429176.db2.gz SYZQZPHIZRGSTE-UHFFFAOYSA-N 1 2 245.363 2.075 20 0 BEADLO C[N@@H+](CCOC(C)(C)C)CC(=O)OC(C)(C)C ZINC000170645572 346429178 /nfs/dbraw/zinc/42/91/78/346429178.db2.gz SYZQZPHIZRGSTE-UHFFFAOYSA-N 1 2 245.363 2.075 20 0 BEADLO COc1ccsc1C[NH2+][C@@H](C)C(F)F ZINC000641794264 362734080 /nfs/dbraw/zinc/73/40/80/362734080.db2.gz UMXBPIXYAJRFMG-LURJTMIESA-N 1 2 221.272 2.500 20 0 BEADLO FC(F)C[N@@H+]1CC[C@@H](c2ccco2)C1 ZINC000603416345 349963630 /nfs/dbraw/zinc/96/36/30/349963630.db2.gz ZUPSJQRJXJKVAU-MRVPVSSYSA-N 1 2 201.216 2.334 20 0 BEADLO FC(F)C[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000603416345 349963633 /nfs/dbraw/zinc/96/36/33/349963633.db2.gz ZUPSJQRJXJKVAU-MRVPVSSYSA-N 1 2 201.216 2.334 20 0 BEADLO Cc1cccc(C[NH2+]Cc2cocn2)c1 ZINC000237637726 179095089 /nfs/dbraw/zinc/09/50/89/179095089.db2.gz CUEVZTFWGCQLDT-UHFFFAOYSA-N 1 2 202.257 2.273 20 0 BEADLO Cc1ccc(F)cc1CNc1c[nH]c[nH+]1 ZINC000380329970 346519152 /nfs/dbraw/zinc/51/91/52/346519152.db2.gz NSQOQSQKTIOYMA-UHFFFAOYSA-N 1 2 205.236 2.469 20 0 BEADLO CC[C@H](NC(=O)[C@H]1C[C@@H]1C1CC1)c1[nH]cc[nH+]1 ZINC000332924001 346488902 /nfs/dbraw/zinc/48/89/02/346488902.db2.gz VEODRKGHDAJUCP-VWYCJHECSA-N 1 2 233.315 2.023 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)CCc1cscn1 ZINC000170956035 346489567 /nfs/dbraw/zinc/48/95/67/346489567.db2.gz SVQUYOKIZFEIOB-UHFFFAOYSA-N 1 2 247.323 2.418 20 0 BEADLO Cc1cc(CCNc2cccc[nH+]2)on1 ZINC000380156170 346559940 /nfs/dbraw/zinc/55/99/40/346559940.db2.gz ZBUFOSPYMNMDRA-UHFFFAOYSA-N 1 2 203.245 2.033 20 0 BEADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1nccn1C ZINC000162548894 346526825 /nfs/dbraw/zinc/52/68/25/346526825.db2.gz VUKGSVGBJFRPEF-ZDUSSCGKSA-N 1 2 244.342 2.398 20 0 BEADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1nccn1C ZINC000162548894 346526831 /nfs/dbraw/zinc/52/68/31/346526831.db2.gz VUKGSVGBJFRPEF-ZDUSSCGKSA-N 1 2 244.342 2.398 20 0 BEADLO CC[C@@H](Nc1cc(C)[nH+]cn1)[C@@H]1CCCO1 ZINC000301824749 346592599 /nfs/dbraw/zinc/59/25/99/346592599.db2.gz IKAHUNPVUFIZDG-MNOVXSKESA-N 1 2 221.304 2.155 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C(C)(C)C1CCC1 ZINC000380195346 346569077 /nfs/dbraw/zinc/56/90/77/346569077.db2.gz YVCYKMIUISYIJB-UHFFFAOYSA-N 1 2 235.331 2.161 20 0 BEADLO COCCC(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000589093004 346665721 /nfs/dbraw/zinc/66/57/21/346665721.db2.gz PAADZWKSKGUOEM-UHFFFAOYSA-N 1 2 245.282 2.052 20 0 BEADLO Cc1cccc(NC(=O)Cc2c[nH+]cn2C)c1C ZINC000188033374 346701686 /nfs/dbraw/zinc/70/16/86/346701686.db2.gz VJZQMAYOGFCIBM-UHFFFAOYSA-N 1 2 243.310 2.218 20 0 BEADLO Cn1c[nH+]cc1CC(=O)Nc1ccc(Cl)cc1 ZINC000188036181 346707179 /nfs/dbraw/zinc/70/71/79/346707179.db2.gz UWNLBYHXHZHYFB-UHFFFAOYSA-N 1 2 249.701 2.255 20 0 BEADLO Cc1cc(C[NH2+]Cc2[nH]nc3ccccc32)no1 ZINC000589644115 346724931 /nfs/dbraw/zinc/72/49/31/346724931.db2.gz CIVVRGKQTSLKEG-UHFFFAOYSA-N 1 2 242.282 2.149 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccc3c[nH]nc3c2)no1 ZINC000589644445 346724953 /nfs/dbraw/zinc/72/49/53/346724953.db2.gz QCWQZSDCECLJEL-UHFFFAOYSA-N 1 2 242.282 2.149 20 0 BEADLO CC(C)[C@@H]1C[N@@H+]([C@@H](C)c2cccnc2)CCN1C ZINC000336605970 187370834 /nfs/dbraw/zinc/37/08/34/187370834.db2.gz KUQKYRCKGYQJOM-ZFWWWQNUSA-N 1 2 247.386 2.415 20 0 BEADLO CC(C)[C@@H]1C[N@H+]([C@@H](C)c2cccnc2)CCN1C ZINC000336605970 187370836 /nfs/dbraw/zinc/37/08/36/187370836.db2.gz KUQKYRCKGYQJOM-ZFWWWQNUSA-N 1 2 247.386 2.415 20 0 BEADLO CCCCCC(=O)N1CC(Oc2cc[nH+]cc2)C1 ZINC000589987268 346761101 /nfs/dbraw/zinc/76/11/01/346761101.db2.gz BGXXKVUFZVLKKP-UHFFFAOYSA-N 1 2 248.326 2.252 20 0 BEADLO Cc1cn[nH]c1CNc1cccc(C)[nH+]1 ZINC000290053317 179151310 /nfs/dbraw/zinc/15/13/10/179151310.db2.gz XDZZJUGTPFMCRT-UHFFFAOYSA-N 1 2 202.261 2.034 20 0 BEADLO C[C@H]1CC[C@H](C)N(C(=O)CCCn2cc[nH+]c2)C1 ZINC000075277354 346743142 /nfs/dbraw/zinc/74/31/42/346743142.db2.gz UTCSEFVMULSAEJ-STQMWFEESA-N 1 2 249.358 2.310 20 0 BEADLO C[C@@H](CC(=O)Nc1cncc(F)c1)n1cc[nH+]c1 ZINC000577182399 365864127 /nfs/dbraw/zinc/86/41/27/365864127.db2.gz XBWZZMXRKKDSHI-VIFPVBQESA-N 1 2 248.261 2.007 20 0 BEADLO C[C@H]1CN(c2[nH+]ccc3ccccc32)C[C@@H]1O ZINC000387846220 347109096 /nfs/dbraw/zinc/10/90/96/347109096.db2.gz CCMGQNNJWQEPSH-GWCFXTLKSA-N 1 2 228.295 2.052 20 0 BEADLO Cc1cccc(OCC[N@@H+]2CCOCC23CC3)c1 ZINC000338590997 179166816 /nfs/dbraw/zinc/16/68/16/179166816.db2.gz GNCWIOOLLLROHE-UHFFFAOYSA-N 1 2 247.338 2.239 20 0 BEADLO Cc1cccc(OCC[N@H+]2CCOCC23CC3)c1 ZINC000338590997 179166818 /nfs/dbraw/zinc/16/68/18/179166818.db2.gz GNCWIOOLLLROHE-UHFFFAOYSA-N 1 2 247.338 2.239 20 0 BEADLO Cc1cccc([C@@H](C)C(=O)NCc2c[nH+]c[nH]2)c1 ZINC000359131923 179179118 /nfs/dbraw/zinc/17/91/18/179179118.db2.gz MUDJSEBSPRWLDN-LLVKDONJSA-N 1 2 243.310 2.138 20 0 BEADLO Cc1cccc([C@@H](C)C(=O)NCc2c[nH]c[nH+]2)c1 ZINC000359131923 179179120 /nfs/dbraw/zinc/17/91/20/179179120.db2.gz MUDJSEBSPRWLDN-LLVKDONJSA-N 1 2 243.310 2.138 20 0 BEADLO CC(C)=CCNC(=O)c1ccn2c(C)c[nH+]c2c1 ZINC000582071642 347172312 /nfs/dbraw/zinc/17/23/12/347172312.db2.gz YYQVNYKHDLNTDC-UHFFFAOYSA-N 1 2 243.310 2.339 20 0 BEADLO CC1(CC(=O)N2CCc3[nH]c[nH+]c3C2)CCCC1 ZINC000627372375 347218749 /nfs/dbraw/zinc/21/87/49/347218749.db2.gz KUBNSJXMEQIINK-UHFFFAOYSA-N 1 2 247.342 2.265 20 0 BEADLO CC1(CC(=O)N2CCc3[nH+]c[nH]c3C2)CCCC1 ZINC000627372375 347218750 /nfs/dbraw/zinc/21/87/50/347218750.db2.gz KUBNSJXMEQIINK-UHFFFAOYSA-N 1 2 247.342 2.265 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2ccncn2)o1 ZINC000395803334 362799366 /nfs/dbraw/zinc/79/93/66/362799366.db2.gz AYMZIXSGUPALPE-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO CCCC[C@@H](C)C(=O)Nc1ccc(N)[nH+]c1 ZINC000300946736 347286437 /nfs/dbraw/zinc/28/64/37/347286437.db2.gz OLSCDTMEXPCREE-SECBINFHSA-N 1 2 221.304 2.429 20 0 BEADLO Fc1ccccc1-c1noc(Cn2cc[nH+]c2)n1 ZINC000187941067 347269418 /nfs/dbraw/zinc/26/94/18/347269418.db2.gz ZOOBYURDOXAMIS-UHFFFAOYSA-N 1 2 244.229 2.121 20 0 BEADLO CO[C@@H]([C@@H](C)Nc1cc(C)[nH+]cn1)C1CC1 ZINC000388259930 347274097 /nfs/dbraw/zinc/27/40/97/347274097.db2.gz CPUBNRSNDCLEOZ-SKDRFNHKSA-N 1 2 221.304 2.010 20 0 BEADLO Cc1ccccc1N(C)C(=O)CCc1c[nH+]c[nH]1 ZINC000623047573 347303803 /nfs/dbraw/zinc/30/38/03/347303803.db2.gz HKBRDAAWYQJFDX-UHFFFAOYSA-N 1 2 243.310 2.314 20 0 BEADLO Cc1ccccc1N(C)C(=O)CCc1c[nH]c[nH+]1 ZINC000623047573 347303805 /nfs/dbraw/zinc/30/38/05/347303805.db2.gz HKBRDAAWYQJFDX-UHFFFAOYSA-N 1 2 243.310 2.314 20 0 BEADLO CCN(CCC1CC1)C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000581262418 347372105 /nfs/dbraw/zinc/37/21/05/347372105.db2.gz ONMHNBFOOOTBDI-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO CCN(CCC1CC1)C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000581262418 347372108 /nfs/dbraw/zinc/37/21/08/347372108.db2.gz ONMHNBFOOOTBDI-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)[C@@H]1C[C@@H]1C1CCCC1 ZINC000616921243 347450269 /nfs/dbraw/zinc/45/02/69/347450269.db2.gz KOLRHURPQTVOOH-CHWSQXEVSA-N 1 2 247.342 2.194 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)[C@@H]1C[C@@H]1C1CCCC1 ZINC000616921243 347450271 /nfs/dbraw/zinc/45/02/71/347450271.db2.gz KOLRHURPQTVOOH-CHWSQXEVSA-N 1 2 247.342 2.194 20 0 BEADLO Cc1cccc2[nH+]c(CSC[C@@H](C)O)cn21 ZINC000298343896 179229803 /nfs/dbraw/zinc/22/98/03/179229803.db2.gz SMXINBAMFYXHFF-SNVBAGLBSA-N 1 2 236.340 2.257 20 0 BEADLO Cc1cccc2[nH+]c(CN(C)CC(F)F)cn21 ZINC000103488075 179229850 /nfs/dbraw/zinc/22/98/50/179229850.db2.gz DWNDPTNBJFGSBB-UHFFFAOYSA-N 1 2 239.269 2.340 20 0 BEADLO Cc1cccc2[nH+]c(CSC[C@H](C)O)cn21 ZINC000298343889 179229959 /nfs/dbraw/zinc/22/99/59/179229959.db2.gz SMXINBAMFYXHFF-JTQLQIEISA-N 1 2 236.340 2.257 20 0 BEADLO Cc1cccc2[nH+]c(CNC(=O)C(C)(C)F)cn21 ZINC000179385497 179230363 /nfs/dbraw/zinc/23/03/63/179230363.db2.gz DQZCAFFEUODDPM-UHFFFAOYSA-N 1 2 249.289 2.007 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)C(C)(C)C1CCC1 ZINC000616921716 347451555 /nfs/dbraw/zinc/45/15/55/347451555.db2.gz AKZHUNKAQAGLJS-UHFFFAOYSA-N 1 2 235.331 2.194 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)C(C)(C)C1CCC1 ZINC000616921716 347451557 /nfs/dbraw/zinc/45/15/57/347451557.db2.gz AKZHUNKAQAGLJS-UHFFFAOYSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@H]1CCCC[C@@H]1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616921607 347451676 /nfs/dbraw/zinc/45/16/76/347451676.db2.gz XGMBTBSSKKSOTQ-JQWIXIFHSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@H]1CCCC[C@@H]1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616921607 347451678 /nfs/dbraw/zinc/45/16/78/347451678.db2.gz XGMBTBSSKKSOTQ-JQWIXIFHSA-N 1 2 235.331 2.194 20 0 BEADLO Cc1cc(C)cc(C(=O)N(C)Cc2c[nH+]c[nH]2)c1 ZINC000616922219 347452117 /nfs/dbraw/zinc/45/21/17/347452117.db2.gz UMKYDPRAZLBNSZ-UHFFFAOYSA-N 1 2 243.310 2.299 20 0 BEADLO Cc1cc(C)cc(C(=O)N(C)Cc2c[nH]c[nH+]2)c1 ZINC000616922219 347452118 /nfs/dbraw/zinc/45/21/18/347452118.db2.gz UMKYDPRAZLBNSZ-UHFFFAOYSA-N 1 2 243.310 2.299 20 0 BEADLO CC[C@H](CC(F)F)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616922201 347452529 /nfs/dbraw/zinc/45/25/29/347452529.db2.gz SZLIYSPOOHUERV-MRVPVSSYSA-N 1 2 245.273 2.050 20 0 BEADLO CC[C@H](CC(F)F)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616922201 347452531 /nfs/dbraw/zinc/45/25/31/347452531.db2.gz SZLIYSPOOHUERV-MRVPVSSYSA-N 1 2 245.273 2.050 20 0 BEADLO Cc1ccsc1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616922257 347452648 /nfs/dbraw/zinc/45/26/48/347452648.db2.gz VTHKTSIVWJOBDW-UHFFFAOYSA-N 1 2 235.312 2.052 20 0 BEADLO Cc1ccsc1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616922257 347452649 /nfs/dbraw/zinc/45/26/49/347452649.db2.gz VTHKTSIVWJOBDW-UHFFFAOYSA-N 1 2 235.312 2.052 20 0 BEADLO CC(C)C[C@H](C)CC(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616924382 347454415 /nfs/dbraw/zinc/45/44/15/347454415.db2.gz HINLRUFZINLONZ-NSHDSACASA-N 1 2 237.347 2.440 20 0 BEADLO CC(C)C[C@H](C)CC(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616924382 347454420 /nfs/dbraw/zinc/45/44/20/347454420.db2.gz HINLRUFZINLONZ-NSHDSACASA-N 1 2 237.347 2.440 20 0 BEADLO C[C@@H]1CC(C(=O)N(C)Cc2c[nH+]c[nH]2)C[C@@H](C)C1 ZINC000616927524 347454841 /nfs/dbraw/zinc/45/48/41/347454841.db2.gz KNIFCWFZKJPJRA-QWRGUYRKSA-N 1 2 249.358 2.440 20 0 BEADLO C[C@@H]1CC(C(=O)N(C)Cc2c[nH]c[nH+]2)C[C@@H](C)C1 ZINC000616927524 347454846 /nfs/dbraw/zinc/45/48/46/347454846.db2.gz KNIFCWFZKJPJRA-QWRGUYRKSA-N 1 2 249.358 2.440 20 0 BEADLO CC[C@@H](CC(=O)N(C)Cc1c[nH+]c[nH]1)C(C)C ZINC000616924392 347455026 /nfs/dbraw/zinc/45/50/26/347455026.db2.gz HUOARYKORXSGPW-NSHDSACASA-N 1 2 237.347 2.440 20 0 BEADLO CC[C@@H](CC(=O)N(C)Cc1c[nH]c[nH+]1)C(C)C ZINC000616924392 347455027 /nfs/dbraw/zinc/45/50/27/347455027.db2.gz HUOARYKORXSGPW-NSHDSACASA-N 1 2 237.347 2.440 20 0 BEADLO CCC[C@@H](C)CC(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616924704 347456324 /nfs/dbraw/zinc/45/63/24/347456324.db2.gz SWDDNTGUMVCAKE-SNVBAGLBSA-N 1 2 223.320 2.194 20 0 BEADLO CCC[C@@H](C)CC(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616924704 347456327 /nfs/dbraw/zinc/45/63/27/347456327.db2.gz SWDDNTGUMVCAKE-SNVBAGLBSA-N 1 2 223.320 2.194 20 0 BEADLO Cc1nc(C[NH2+]Cc2cccnc2)cs1 ZINC000020253307 347436333 /nfs/dbraw/zinc/43/63/33/347436333.db2.gz MLZQJXJWBQBYKP-UHFFFAOYSA-N 1 2 219.313 2.136 20 0 BEADLO C[C@@H](C(=O)N(C)Cc1c[nH+]c[nH]1)C1CCCC1 ZINC000616925704 347457229 /nfs/dbraw/zinc/45/72/29/347457229.db2.gz NOESUYUBKHDXIB-SNVBAGLBSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@@H](C(=O)N(C)Cc1c[nH]c[nH+]1)C1CCCC1 ZINC000616925704 347457232 /nfs/dbraw/zinc/45/72/32/347457232.db2.gz NOESUYUBKHDXIB-SNVBAGLBSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@H](C(=O)N(C)Cc1c[nH+]c[nH]1)c1cccs1 ZINC000616925756 347457277 /nfs/dbraw/zinc/45/72/77/347457277.db2.gz PGCCPXBTWGPGIK-VIFPVBQESA-N 1 2 249.339 2.233 20 0 BEADLO C[C@H](C(=O)N(C)Cc1c[nH]c[nH+]1)c1cccs1 ZINC000616925756 347457278 /nfs/dbraw/zinc/45/72/78/347457278.db2.gz PGCCPXBTWGPGIK-VIFPVBQESA-N 1 2 249.339 2.233 20 0 BEADLO Cc1cccc2[nH+]c(CNC(=O)C3CCC3)cn21 ZINC000068571952 179228992 /nfs/dbraw/zinc/22/89/92/179228992.db2.gz WOOQMPZHDGFVSO-UHFFFAOYSA-N 1 2 243.310 2.059 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@H]1CCCc2ccccc2C1 ZINC000590652743 347483278 /nfs/dbraw/zinc/48/32/78/347483278.db2.gz VFCDNQFHMRWVGR-RISCZKNCSA-N 1 2 247.338 2.085 20 0 BEADLO O=C(c1ccc2[nH+]ccn2c1)N1C2CCC1CC2 ZINC000590661096 347487827 /nfs/dbraw/zinc/48/78/27/347487827.db2.gz LBOFPPGEZRRLBA-UHFFFAOYSA-N 1 2 241.294 2.101 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)N(C)Cc2c[nH+]c[nH]2)C[C@@H]1C ZINC000616928732 347494710 /nfs/dbraw/zinc/49/47/10/347494710.db2.gz KCAPNHPHXPHOOH-WOPDTQHZSA-N 1 2 249.358 2.440 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)N(C)Cc2c[nH]c[nH+]2)C[C@@H]1C ZINC000616928732 347494711 /nfs/dbraw/zinc/49/47/11/347494711.db2.gz KCAPNHPHXPHOOH-WOPDTQHZSA-N 1 2 249.358 2.440 20 0 BEADLO C[C@H]1CCC[C@]1(C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616928692 347494785 /nfs/dbraw/zinc/49/47/85/347494785.db2.gz JEQXZEAIIFMCNJ-GWCFXTLKSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@H]1CCC[C@]1(C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616928692 347494787 /nfs/dbraw/zinc/49/47/87/347494787.db2.gz JEQXZEAIIFMCNJ-GWCFXTLKSA-N 1 2 235.331 2.194 20 0 BEADLO CC[C@H](C)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000590728997 347497415 /nfs/dbraw/zinc/49/74/15/347497415.db2.gz NXORRQRGTLMKQN-RYUDHWBXSA-N 1 2 235.331 2.093 20 0 BEADLO CCCCC(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000590730868 347497541 /nfs/dbraw/zinc/49/75/41/347497541.db2.gz OIERMJCDVOJYCZ-LBPRGKRZSA-N 1 2 235.331 2.237 20 0 BEADLO CCC(CC)[C@@H](C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616926949 347459259 /nfs/dbraw/zinc/45/92/59/347459259.db2.gz WGSSIXZXEIEKEQ-SNVBAGLBSA-N 1 2 237.347 2.440 20 0 BEADLO CCC(CC)[C@@H](C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616926949 347459263 /nfs/dbraw/zinc/45/92/63/347459263.db2.gz WGSSIXZXEIEKEQ-SNVBAGLBSA-N 1 2 237.347 2.440 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)[C@@H]1CC2CCC1CC2 ZINC000616929328 347497567 /nfs/dbraw/zinc/49/75/67/347497567.db2.gz YJJAOWUWTWDQHA-GCZXYKMCSA-N 1 2 247.342 2.194 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)[C@@H]1CC2CCC1CC2 ZINC000616929328 347497568 /nfs/dbraw/zinc/49/75/68/347497568.db2.gz YJJAOWUWTWDQHA-GCZXYKMCSA-N 1 2 247.342 2.194 20 0 BEADLO CCCCC(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000590730867 347497584 /nfs/dbraw/zinc/49/75/84/347497584.db2.gz OIERMJCDVOJYCZ-GFCCVEGCSA-N 1 2 235.331 2.237 20 0 BEADLO CCC[C@@H](C(=O)N(C)Cc1c[nH+]c[nH]1)C(C)C ZINC000616927021 347459906 /nfs/dbraw/zinc/45/99/06/347459906.db2.gz YPGMMBKSWRLROZ-GFCCVEGCSA-N 1 2 237.347 2.440 20 0 BEADLO CCC[C@@H](C(=O)N(C)Cc1c[nH]c[nH+]1)C(C)C ZINC000616927021 347459907 /nfs/dbraw/zinc/45/99/07/347459907.db2.gz YPGMMBKSWRLROZ-GFCCVEGCSA-N 1 2 237.347 2.440 20 0 BEADLO CCC[C@@H](C)C(=O)NCc1[nH]c2c([nH+]1)CCCC2 ZINC001639296423 1172092711 /nfs/dbraw/zinc/09/27/11/1172092711.db2.gz UUHJNISVDVXXAM-SNVBAGLBSA-N 1 2 249.358 2.341 20 0 BEADLO CC[C@H](C)N(CC)C(=O)[C@@H]1CCn2cc[nH+]c2C1 ZINC000616974548 347545950 /nfs/dbraw/zinc/54/59/50/347545950.db2.gz NQFMOHGWBIICBS-NWDGAFQWSA-N 1 2 249.358 2.093 20 0 BEADLO C[C@@H]1CCCC[C@@H]1CC(=O)NCc1[nH+]ccn1C ZINC000590736974 347501693 /nfs/dbraw/zinc/50/16/93/347501693.db2.gz UJESCPBTZKSPBM-VXGBXAGGSA-N 1 2 249.358 2.253 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N1C(=O)CCCn1cc[nH+]c1 ZINC000590885749 347579607 /nfs/dbraw/zinc/57/96/07/347579607.db2.gz PDSTULSZSAUJNQ-CHWSQXEVSA-N 1 2 249.358 2.453 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)[C@H]1CCc2[nH+]ccn2C1 ZINC000616976611 347547266 /nfs/dbraw/zinc/54/72/66/347547266.db2.gz TXWCUCARHSQLEK-NEPJUHHUSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1ccccc1C[NH+]1CC(OCC(F)F)C1 ZINC000358776938 179271759 /nfs/dbraw/zinc/27/17/59/179271759.db2.gz DOUXJHCSINFAON-UHFFFAOYSA-N 1 2 241.281 2.461 20 0 BEADLO C[C@H]1C[C@@H]1C(=O)NCCCCNc1cccc[nH+]1 ZINC000591063058 347612640 /nfs/dbraw/zinc/61/26/40/347612640.db2.gz HNKHFMUTWRTGIX-RYUDHWBXSA-N 1 2 247.342 2.046 20 0 BEADLO Cc1ccccc1C[N@@H+](C)[C@H](C)c1nncn1C ZINC000286674686 179270045 /nfs/dbraw/zinc/27/00/45/179270045.db2.gz ARESFOSSKUHMGO-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1ccccc1C[N@H+](C)[C@H](C)c1nncn1C ZINC000286674686 179270046 /nfs/dbraw/zinc/27/00/46/179270046.db2.gz ARESFOSSKUHMGO-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1ccccc1COCc1[nH]cc[nH+]1 ZINC000123743390 179286147 /nfs/dbraw/zinc/28/61/47/179286147.db2.gz AZTBMQUNLHDWDW-UHFFFAOYSA-N 1 2 202.257 2.435 20 0 BEADLO CC[C@H](C)C[C@H]([NH2+][C@@H]1CCSC1)C(=O)OC ZINC000592517603 347794419 /nfs/dbraw/zinc/79/44/19/347794419.db2.gz WOVSNKWDSMWAOY-AXFHLTTASA-N 1 2 245.388 2.059 20 0 BEADLO CC[N@H+](CCSC)Cc1c(Cl)cnn1C ZINC000592531935 347797040 /nfs/dbraw/zinc/79/70/40/347797040.db2.gz XYYMOZQXGROZHY-UHFFFAOYSA-N 1 2 247.795 2.258 20 0 BEADLO CC[N@@H+](CCSC)Cc1c(Cl)cnn1C ZINC000592531935 347797042 /nfs/dbraw/zinc/79/70/42/347797042.db2.gz XYYMOZQXGROZHY-UHFFFAOYSA-N 1 2 247.795 2.258 20 0 BEADLO Cc1ccccc1C[C@H](CO)Nc1cccc[nH+]1 ZINC000302720021 179291829 /nfs/dbraw/zinc/29/18/29/179291829.db2.gz OSDUYQHQSMBFHO-CQSZACIVSA-N 1 2 242.322 2.406 20 0 BEADLO CCO/C=C/C(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000493528018 347867212 /nfs/dbraw/zinc/86/72/12/347867212.db2.gz PJNBRESRYHNZSA-CDCCAWJDSA-N 1 2 249.314 2.014 20 0 BEADLO CCc1cccc(C[NH2+][C@@H](CC)C(=O)OC)c1 ZINC000593183228 347869039 /nfs/dbraw/zinc/86/90/39/347869039.db2.gz QYVFXVYVUGLELE-ZDUSSCGKSA-N 1 2 235.327 2.290 20 0 BEADLO FC(F)O[C@H]1CCC[N@H+](Cc2nccs2)C1 ZINC000679682192 488364292 /nfs/dbraw/zinc/36/42/92/488364292.db2.gz NFPPSFZYACFNFH-QMMMGPOBSA-N 1 2 248.298 2.347 20 0 BEADLO FC(F)O[C@H]1CCC[N@@H+](Cc2nccs2)C1 ZINC000679682192 488364293 /nfs/dbraw/zinc/36/42/93/488364293.db2.gz NFPPSFZYACFNFH-QMMMGPOBSA-N 1 2 248.298 2.347 20 0 BEADLO COC(=O)C(C)(C)[NH2+]Cc1cccc2c1CCC2 ZINC000593610767 347920327 /nfs/dbraw/zinc/92/03/27/347920327.db2.gz CKANSVIRXDBRMJ-UHFFFAOYSA-N 1 2 247.338 2.217 20 0 BEADLO Cc1ccccc1[C@H](C)[NH2+]CC(F)(F)CO ZINC000184688868 179337069 /nfs/dbraw/zinc/33/70/69/179337069.db2.gz YFAPTVDJKNBNCV-JTQLQIEISA-N 1 2 229.270 2.273 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nnsc2Cl)[C@H]1C ZINC000306159338 323172543 /nfs/dbraw/zinc/17/25/43/323172543.db2.gz NOQIMBTXNZPWPQ-RQJHMYQMSA-N 1 2 231.752 2.422 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nnsc2Cl)[C@H]1C ZINC000306159338 323172544 /nfs/dbraw/zinc/17/25/44/323172544.db2.gz NOQIMBTXNZPWPQ-RQJHMYQMSA-N 1 2 231.752 2.422 20 0 BEADLO Cc1cccn2cc(CNC(=O)C3CCC3)[nH+]c12 ZINC000071435480 179356461 /nfs/dbraw/zinc/35/64/61/179356461.db2.gz XCWLLKFCRYEXPH-UHFFFAOYSA-N 1 2 243.310 2.059 20 0 BEADLO CCC[C@H]([NH2+]C[C@]1(C)CC1(F)F)C(=O)OCC ZINC000594733253 348109024 /nfs/dbraw/zinc/10/90/24/348109024.db2.gz ZZONNCMNCWMODG-ONGXEEELSA-N 1 2 249.301 2.353 20 0 BEADLO COC(=O)C[N@H+](C)Cc1cccc(SC)c1 ZINC000595287801 348212474 /nfs/dbraw/zinc/21/24/74/348212474.db2.gz MKSLILBAAWLSDF-UHFFFAOYSA-N 1 2 239.340 2.013 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1cccc(SC)c1 ZINC000595287801 348212476 /nfs/dbraw/zinc/21/24/76/348212476.db2.gz MKSLILBAAWLSDF-UHFFFAOYSA-N 1 2 239.340 2.013 20 0 BEADLO CCC[C@@H]([NH2+]Cc1ncc[nH]1)c1ccccn1 ZINC000595626811 348292872 /nfs/dbraw/zinc/29/28/72/348292872.db2.gz ZFGBYBPIRQRPES-LLVKDONJSA-N 1 2 230.315 2.436 20 0 BEADLO Cc1cccnc1C[NH2+][C@@H](C)c1ccon1 ZINC000309814159 179383540 /nfs/dbraw/zinc/38/35/40/179383540.db2.gz UXVKOJHUPRMHOD-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO Cc1cccnc1SCCn1cc[nH+]c1 ZINC000286622011 179394445 /nfs/dbraw/zinc/39/44/45/179394445.db2.gz VAAGPYLZBZLFNE-UHFFFAOYSA-N 1 2 219.313 2.379 20 0 BEADLO CC[C@H](C[N@@H+]1CC[C@@H](C)C(F)(F)C1)OC ZINC000419314900 192121301 /nfs/dbraw/zinc/12/13/01/192121301.db2.gz VAWIZIUJDXTSTE-NXEZZACHSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@H](C[N@H+]1CC[C@@H](C)C(F)(F)C1)OC ZINC000419314900 192121303 /nfs/dbraw/zinc/12/13/03/192121303.db2.gz VAWIZIUJDXTSTE-NXEZZACHSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@@H]([NH2+][C@@H]1Cc2ccccc2[C@@H]1C)C(=O)OC ZINC000595703859 348308561 /nfs/dbraw/zinc/30/85/61/348308561.db2.gz AQRVEIMGWJTLEW-ZLKJLUDKSA-N 1 2 247.338 2.256 20 0 BEADLO COC(=O)[C@@](C)(CCF)[NH2+]CCCC(C)C ZINC000595773887 348337282 /nfs/dbraw/zinc/33/72/82/348337282.db2.gz FURNTUAHXOZARY-GFCCVEGCSA-N 1 2 233.327 2.304 20 0 BEADLO CC/C=C\CC[NH2+][C@](C)(CCF)C(=O)OC ZINC000595776571 348338871 /nfs/dbraw/zinc/33/88/71/348338871.db2.gz TZHJONAKRFBXPT-FOQNGQEVSA-N 1 2 231.311 2.224 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@H]2CCC[C@@H]2C)c1 ZINC000596115284 348442410 /nfs/dbraw/zinc/44/24/10/348442410.db2.gz UDPVGJWTZARHIS-JQWIXIFHSA-N 1 2 248.326 2.398 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N2[C@H](C)CC[C@@H]2C)c1 ZINC000596162485 348459770 /nfs/dbraw/zinc/45/97/70/348459770.db2.gz LAWFJGQLTZRZBS-PHIMTYICSA-N 1 2 248.326 2.174 20 0 BEADLO CC[C@@H]1CCN(c2cc(CC(=O)OC)cc[nH+]2)C1 ZINC000596165909 348460538 /nfs/dbraw/zinc/46/05/38/348460538.db2.gz VCLWQMKUEIHCLY-LLVKDONJSA-N 1 2 248.326 2.033 20 0 BEADLO CCSC1(CNc2cc[nH+]c(C3CC3)n2)CC1 ZINC000596511252 348573087 /nfs/dbraw/zinc/57/30/87/348573087.db2.gz LEJJBYLPDFLTMD-UHFFFAOYSA-N 1 2 249.383 2.474 20 0 BEADLO Cc1cnc(C[N@@H+]2CCOC[C@H]2C2CC2)s1 ZINC000180840613 179594716 /nfs/dbraw/zinc/59/47/16/179594716.db2.gz OUWOTUXOUMUMJJ-NSHDSACASA-N 1 2 238.356 2.062 20 0 BEADLO Cc1cnc(C[N@H+]2CCOC[C@H]2C2CC2)s1 ZINC000180840613 179594718 /nfs/dbraw/zinc/59/47/18/179594718.db2.gz OUWOTUXOUMUMJJ-NSHDSACASA-N 1 2 238.356 2.062 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1nccn1C)c1ccco1 ZINC000070007636 490194896 /nfs/dbraw/zinc/19/48/96/490194896.db2.gz PFVQAXKUTLZHLO-ZJUUUORDSA-N 1 2 219.288 2.425 20 0 BEADLO CCc1ccc(C[NH2+]Cc2conc2C)o1 ZINC000397887136 362932332 /nfs/dbraw/zinc/93/23/32/362932332.db2.gz DNTIGNRNKRICPN-UHFFFAOYSA-N 1 2 220.272 2.428 20 0 BEADLO CCc1ncc(CN(C)Cc2c[nH+]c[nH]2)s1 ZINC000093324359 538020858 /nfs/dbraw/zinc/02/08/58/538020858.db2.gz DAZJTTZUGWJUNH-UHFFFAOYSA-N 1 2 236.344 2.061 20 0 BEADLO Cc1noc([C@@H](C)[N@H+](C)Cc2ccoc2C)n1 ZINC000055082794 349084612 /nfs/dbraw/zinc/08/46/12/349084612.db2.gz DHEXBXBXDWKTEG-MRVPVSSYSA-N 1 2 235.287 2.472 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+](C)Cc2ccoc2C)n1 ZINC000055082794 349084614 /nfs/dbraw/zinc/08/46/14/349084614.db2.gz DHEXBXBXDWKTEG-MRVPVSSYSA-N 1 2 235.287 2.472 20 0 BEADLO COc1ccc[nH+]c1N(C)CCCSC ZINC000599073990 349087653 /nfs/dbraw/zinc/08/76/53/349087653.db2.gz IBGKWKOUQBQNAP-UHFFFAOYSA-N 1 2 226.345 2.280 20 0 BEADLO Cc1ncc(C[NH2+]Cc2cnc(C3CC3)o2)o1 ZINC000628302266 349093207 /nfs/dbraw/zinc/09/32/07/349093207.db2.gz WYCAEDKQSBBFQF-UHFFFAOYSA-N 1 2 233.271 2.138 20 0 BEADLO CCCc1[nH]ccc1C(=O)Nc1cc[nH+]c(C)c1 ZINC000421767208 192381041 /nfs/dbraw/zinc/38/10/41/192381041.db2.gz KAWPYSRFEVWYAQ-UHFFFAOYSA-N 1 2 243.310 2.345 20 0 BEADLO COC(=O)CCCC[N@@H+]1CCCC[C@@H]1C(F)F ZINC000599399216 349171606 /nfs/dbraw/zinc/17/16/06/349171606.db2.gz LBMXNKQIXJSSQX-SNVBAGLBSA-N 1 2 249.301 2.449 20 0 BEADLO COC(=O)CCCC[N@H+]1CCCC[C@@H]1C(F)F ZINC000599399216 349171610 /nfs/dbraw/zinc/17/16/10/349171610.db2.gz LBMXNKQIXJSSQX-SNVBAGLBSA-N 1 2 249.301 2.449 20 0 BEADLO CCOc1nnc(C[N@H+](C)CCC(C)C)s1 ZINC000063525742 349201712 /nfs/dbraw/zinc/20/17/12/349201712.db2.gz GEJAHELVPYZRHL-UHFFFAOYSA-N 1 2 243.376 2.415 20 0 BEADLO CCOc1nnc(C[N@@H+](C)CCC(C)C)s1 ZINC000063525742 349201714 /nfs/dbraw/zinc/20/17/14/349201714.db2.gz GEJAHELVPYZRHL-UHFFFAOYSA-N 1 2 243.376 2.415 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CCC[C@H](C)[C@@H]2C)c[nH+]1 ZINC000264603338 179888987 /nfs/dbraw/zinc/88/89/87/179888987.db2.gz FKFPTQXFWFGMEL-ATZCPNFKSA-N 1 2 235.331 2.273 20 0 BEADLO CCCCc1nc(C[N@@H+]2CCC[C@@H]2C)no1 ZINC000076117152 535099473 /nfs/dbraw/zinc/09/94/73/535099473.db2.gz PXHGQWCXYZSCJO-JTQLQIEISA-N 1 2 223.320 2.397 20 0 BEADLO CCCCc1nc(C[N@H+]2CCC[C@@H]2C)no1 ZINC000076117152 535099476 /nfs/dbraw/zinc/09/94/76/535099476.db2.gz PXHGQWCXYZSCJO-JTQLQIEISA-N 1 2 223.320 2.397 20 0 BEADLO Cc1nc(N2CCC[C@@](C)(O)CC2)c(C)c(C)[nH+]1 ZINC000369538470 179905452 /nfs/dbraw/zinc/90/54/52/179905452.db2.gz AQBHCXLHPHRDIE-CQSZACIVSA-N 1 2 249.358 2.143 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)c1cncs1 ZINC000603886185 350048503 /nfs/dbraw/zinc/04/85/03/350048503.db2.gz XCJNXNGAFHKLTP-UHFFFAOYSA-N 1 2 244.279 2.043 20 0 BEADLO Cc1nc2[nH]ccc2c(N2C[C@@H](C)[C@H](C)C2)[nH+]1 ZINC000336541635 180003629 /nfs/dbraw/zinc/00/36/29/180003629.db2.gz DXZIGQQPPUWQCP-RKDXNWHRSA-N 1 2 230.315 2.359 20 0 BEADLO Cn1cc[nH+]c1Cn1cnc2cc(F)c(F)cc21 ZINC000131877477 191017642 /nfs/dbraw/zinc/01/76/42/191017642.db2.gz BHQJXMZYADVZRY-UHFFFAOYSA-N 1 2 248.236 2.096 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H]2CC[C@@H]2C)[nH+]1 ZINC000336729946 180023862 /nfs/dbraw/zinc/02/38/62/180023862.db2.gz DMPXNYDXTNLWFP-OIBJUYFYSA-N 1 2 216.288 2.477 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H]2CCO[C@H](C)C2)[nH+]1 ZINC000354705679 180024383 /nfs/dbraw/zinc/02/43/83/180024383.db2.gz AQHYVXHGXFDKPP-PSASIEDQSA-N 1 2 246.314 2.246 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@H]2CC[C@H]2C)[nH+]1 ZINC000336729947 180025004 /nfs/dbraw/zinc/02/50/04/180025004.db2.gz DMPXNYDXTNLWFP-XCBNKYQSSA-N 1 2 216.288 2.477 20 0 BEADLO Cc1nc([C@@H](C)[NH+]2CCC3(CC3)CC2)no1 ZINC000368122390 180033312 /nfs/dbraw/zinc/03/33/12/180033312.db2.gz IXBKXRBISNWEBB-SECBINFHSA-N 1 2 221.304 2.315 20 0 BEADLO Cc1nnc([C@H](C)[NH+]2CCC(C(F)F)CC2)[nH]1 ZINC000336283903 180047180 /nfs/dbraw/zinc/04/71/80/180047180.db2.gz ALJHAWNKOXFYFT-ZETCQYMHSA-N 1 2 244.289 2.151 20 0 BEADLO Cc1ncc(C[N@@H+]2CC(C)(C)OCC2(C)C)cn1 ZINC000604388851 350119818 /nfs/dbraw/zinc/11/98/18/350119818.db2.gz KJWFZYOTYVAIAX-UHFFFAOYSA-N 1 2 249.358 2.174 20 0 BEADLO Cc1ncc(C[N@H+]2CC(C)(C)OCC2(C)C)cn1 ZINC000604388851 350119821 /nfs/dbraw/zinc/11/98/21/350119821.db2.gz KJWFZYOTYVAIAX-UHFFFAOYSA-N 1 2 249.358 2.174 20 0 BEADLO Cc1[nH+]c2cc(OC(=O)C(C)C)ccc2n1C ZINC000296273206 180083434 /nfs/dbraw/zinc/08/34/34/180083434.db2.gz UOWOVURKEDJQRI-UHFFFAOYSA-N 1 2 232.283 2.443 20 0 BEADLO Cc1nc(NC[C@@H]2C[C@H]2C)c2c([nH+]1)CCCC2 ZINC000359716921 180067935 /nfs/dbraw/zinc/06/79/35/180067935.db2.gz NHJQSXXWKZKKOI-KOLCDFICSA-N 1 2 231.343 2.154 20 0 BEADLO Cc1nc(N[C@H](C)CCCO)c2c([nH+]1)CCCC2 ZINC000272828509 180069607 /nfs/dbraw/zinc/06/96/07/180069607.db2.gz GMERTCRPLLIVAA-SNVBAGLBSA-N 1 2 249.358 2.237 20 0 BEADLO Cc1nc(N[C@H](C)[C@@H](C)CO)c2c([nH+]1)CCCC2 ZINC000272822242 180069756 /nfs/dbraw/zinc/06/97/56/180069756.db2.gz FJPQYYJRNXWPEQ-VHSXEESVSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1nc(N[C@@H]2C[C@H]2C)c2c([nH+]1)CCCC2 ZINC000302041190 180070024 /nfs/dbraw/zinc/07/00/24/180070024.db2.gz IBEHOXVJPUNQPF-PRHODGIISA-N 1 2 217.316 2.484 20 0 BEADLO Cc1[nH+]c2ccccc2n1[C@@H](C)[C@H](C)O ZINC000044184404 180103541 /nfs/dbraw/zinc/10/35/41/180103541.db2.gz ZMTRFGWKMYMZKD-IUCAKERBSA-N 1 2 204.273 2.287 20 0 BEADLO Cc1[nH]c(C(=O)NC2CCC(F)(F)CC2)c[nH+]1 ZINC000336576179 180129049 /nfs/dbraw/zinc/12/90/49/180129049.db2.gz JCFQYNYZEGVOMH-UHFFFAOYSA-N 1 2 243.257 2.026 20 0 BEADLO C[C@H](c1ccncc1)[N@@H+]1CCC(=O)[C@H](C)C1 ZINC000251862034 538063288 /nfs/dbraw/zinc/06/32/88/538063288.db2.gz SOUQNDSSMUNRBD-GHMZBOCLSA-N 1 2 218.300 2.054 20 0 BEADLO C[C@H](c1ccncc1)[N@H+]1CCC(=O)[C@H](C)C1 ZINC000251862034 538063297 /nfs/dbraw/zinc/06/32/97/538063297.db2.gz SOUQNDSSMUNRBD-GHMZBOCLSA-N 1 2 218.300 2.054 20 0 BEADLO Cc1ncc(C[NH2+][C@H]2C[C@@H](C)n3ccnc32)s1 ZINC000294133890 180158618 /nfs/dbraw/zinc/15/86/18/180158618.db2.gz OSHQIOAGMVNYGG-KCJUWKMLSA-N 1 2 248.355 2.444 20 0 BEADLO CC[C@@H](C)[N@H+](C)Cc1noc(C(C)C)n1 ZINC000104688286 191066085 /nfs/dbraw/zinc/06/60/85/191066085.db2.gz GQOZUKUEJBDTBF-SECBINFHSA-N 1 2 211.309 2.423 20 0 BEADLO CC[C@@H](C)[N@@H+](C)Cc1noc(C(C)C)n1 ZINC000104688286 191066088 /nfs/dbraw/zinc/06/60/88/191066088.db2.gz GQOZUKUEJBDTBF-SECBINFHSA-N 1 2 211.309 2.423 20 0 BEADLO Cc1cc(N2CC[C@H]2C)nc(C2CC2)[nH+]1 ZINC000604758648 350184091 /nfs/dbraw/zinc/18/40/91/350184091.db2.gz PHPUQKCFEAMSTH-SECBINFHSA-N 1 2 203.289 2.261 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+]Cc2ccnc(C)n2)s1 ZINC000124021266 180191650 /nfs/dbraw/zinc/19/16/50/180191650.db2.gz UMNVUPMPBXJQJX-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO Cn1cc([C@@H]([NH2+]Cc2cocn2)C(C)(C)C)cn1 ZINC000428861292 191079745 /nfs/dbraw/zinc/07/97/45/191079745.db2.gz JSMKVSWRPRRDRG-GFCCVEGCSA-N 1 2 248.330 2.285 20 0 BEADLO Cc1nc(NCC2(C(F)F)CC2)cc[nH+]1 ZINC000309167865 180198668 /nfs/dbraw/zinc/19/86/68/180198668.db2.gz JWGAXKJWTABACR-UHFFFAOYSA-N 1 2 213.231 2.242 20 0 BEADLO Cc1nc(NCC2([C@H](C)CCO)CCC2)cc[nH+]1 ZINC000271756107 180199193 /nfs/dbraw/zinc/19/91/93/180199193.db2.gz CUBJVTZLJKBMTG-LLVKDONJSA-N 1 2 249.358 2.386 20 0 BEADLO Cc1nc(NC[C@@H](C)c2nccs2)cc[nH+]1 ZINC000182669972 180199963 /nfs/dbraw/zinc/19/99/63/180199963.db2.gz GYQHNJUGDHOKCR-MRVPVSSYSA-N 1 2 234.328 2.457 20 0 BEADLO Cc1nc(NC[C@@]2(C)CCCC[C@H]2O)cc[nH+]1 ZINC000175060171 180200459 /nfs/dbraw/zinc/20/04/59/180200459.db2.gz ZUZAMDRLRRTMGK-DGCLKSJQSA-N 1 2 235.331 2.138 20 0 BEADLO Cc1nc(NCCc2cccc(O)c2)cc[nH+]1 ZINC000301430095 180200812 /nfs/dbraw/zinc/20/08/12/180200812.db2.gz VHISGJZBABRVBN-UHFFFAOYSA-N 1 2 229.283 2.145 20 0 BEADLO C[N@H+](Cc1cncnc1)Cc1ccc(F)cc1F ZINC000349818450 538071691 /nfs/dbraw/zinc/07/16/91/538071691.db2.gz JHYUYXLJAXBCMR-UHFFFAOYSA-N 1 2 249.264 2.387 20 0 BEADLO Cc1nc(NC[C@@H]2CSCCS2)cc[nH+]1 ZINC000130295066 180201653 /nfs/dbraw/zinc/20/16/53/180201653.db2.gz AAACBEAQXFGOHF-SECBINFHSA-N 1 2 241.385 2.046 20 0 BEADLO C[N@@H+](Cc1cncnc1)Cc1ccc(F)cc1F ZINC000349818450 538071703 /nfs/dbraw/zinc/07/17/03/538071703.db2.gz JHYUYXLJAXBCMR-UHFFFAOYSA-N 1 2 249.264 2.387 20 0 BEADLO Cc1nc(N[C@@H](CO)CCC(C)(C)C)cc[nH+]1 ZINC000360242754 180203329 /nfs/dbraw/zinc/20/33/29/180203329.db2.gz RBZOXHNLOLLVBL-LLVKDONJSA-N 1 2 237.347 2.384 20 0 BEADLO Cc1nc(N[C@H](CO)CCC(C)(C)C)cc[nH+]1 ZINC000360242755 180205162 /nfs/dbraw/zinc/20/51/62/180205162.db2.gz RBZOXHNLOLLVBL-NSHDSACASA-N 1 2 237.347 2.384 20 0 BEADLO Cc1nc(N[C@H](C)COCC(F)(F)F)cc[nH+]1 ZINC000266357300 180205517 /nfs/dbraw/zinc/20/55/17/180205517.db2.gz KFNRMWWVBSUZHY-SSDOTTSWSA-N 1 2 249.236 2.164 20 0 BEADLO Cc1nc(N[C@H]2CCCSC2)cc[nH+]1 ZINC000129210811 180206040 /nfs/dbraw/zinc/20/60/40/180206040.db2.gz QBIIVXLVOQNUIV-VIFPVBQESA-N 1 2 209.318 2.093 20 0 BEADLO Cc1nc(N[C@@H]2CSC2(C)C)cc[nH+]1 ZINC000276572688 180206135 /nfs/dbraw/zinc/20/61/35/180206135.db2.gz NJAHGOUTUDJTOG-MRVPVSSYSA-N 1 2 209.318 2.091 20 0 BEADLO Cc1nc(N[C@@H]2CS[C@H](C)C2)cc[nH+]1 ZINC000307171415 180206355 /nfs/dbraw/zinc/20/63/55/180206355.db2.gz OEKPEWUULYQPPD-APPZFPTMSA-N 1 2 209.318 2.091 20 0 BEADLO Cc1nc(NCC2CCC(F)(F)CC2)cc[nH+]1 ZINC000336982667 180180320 /nfs/dbraw/zinc/18/03/20/180180320.db2.gz FFXKWJFYYNQPET-UHFFFAOYSA-N 1 2 241.285 2.444 20 0 BEADLO Cc1[nH+]cccc1NCC[C@@H]1CCOC1 ZINC000309089480 180225801 /nfs/dbraw/zinc/22/58/01/180225801.db2.gz BQWNRCCVBFYECU-LLVKDONJSA-N 1 2 206.289 2.229 20 0 BEADLO CCc1ccc([C@H](CO)[NH2+]Cc2cocn2)cc1 ZINC000428878312 191080923 /nfs/dbraw/zinc/08/09/23/191080923.db2.gz CAKAUVXNZZMQNH-AWEZNQCLSA-N 1 2 246.310 2.060 20 0 BEADLO COC(=O)[C@H](c1cccnc1)[N@@H+]1CCC[C@H](C)C1 ZINC000127685652 191086479 /nfs/dbraw/zinc/08/64/79/191086479.db2.gz KOYMGDWDHNZTHE-AAEUAGOBSA-N 1 2 248.326 2.028 20 0 BEADLO COC(=O)[C@H](c1cccnc1)[N@H+]1CCC[C@H](C)C1 ZINC000127685652 191086482 /nfs/dbraw/zinc/08/64/82/191086482.db2.gz KOYMGDWDHNZTHE-AAEUAGOBSA-N 1 2 248.326 2.028 20 0 BEADLO c1sc(C[N@@H+]2CCCOCC2)nc1C1CC1 ZINC000335149705 538088980 /nfs/dbraw/zinc/08/89/80/538088980.db2.gz VFCLCWYOVUXGQR-UHFFFAOYSA-N 1 2 238.356 2.243 20 0 BEADLO c1sc(C[N@H+]2CCCOCC2)nc1C1CC1 ZINC000335149705 538088985 /nfs/dbraw/zinc/08/89/85/538088985.db2.gz VFCLCWYOVUXGQR-UHFFFAOYSA-N 1 2 238.356 2.243 20 0 BEADLO O=C(NCC1CCC1)Nc1ccc2[nH+]ccn2c1 ZINC000606581249 350374386 /nfs/dbraw/zinc/37/43/86/350374386.db2.gz WKENGORPIACCCG-UHFFFAOYSA-N 1 2 244.298 2.256 20 0 BEADLO CC(C)Oc1cccc(C[NH2+]Cc2ccn[nH]2)c1 ZINC000041015711 350403961 /nfs/dbraw/zinc/40/39/61/350403961.db2.gz NOZZFWIWXQUWHO-UHFFFAOYSA-N 1 2 245.326 2.487 20 0 BEADLO COc1ccc(C)cc1C[NH2+]Cc1cc[nH]n1 ZINC000041015049 350404529 /nfs/dbraw/zinc/40/45/29/350404529.db2.gz FKSMZBSILFHJDL-UHFFFAOYSA-N 1 2 231.299 2.017 20 0 BEADLO CC[N@H+](Cc1nc(CC(F)(F)F)no1)C1CC1 ZINC000336680067 350436927 /nfs/dbraw/zinc/43/69/27/350436927.db2.gz CIUTUJFJIVXKOE-UHFFFAOYSA-N 1 2 249.236 2.159 20 0 BEADLO CC[N@@H+](Cc1nc(CC(F)(F)F)no1)C1CC1 ZINC000336680067 350436929 /nfs/dbraw/zinc/43/69/29/350436929.db2.gz CIUTUJFJIVXKOE-UHFFFAOYSA-N 1 2 249.236 2.159 20 0 BEADLO CCc1nc(C[N@H+](C)CC(C)(C)C)no1 ZINC000336642948 350413710 /nfs/dbraw/zinc/41/37/10/350413710.db2.gz BDDNXRBGRBYOCC-UHFFFAOYSA-N 1 2 211.309 2.110 20 0 BEADLO CCc1nc(C[N@@H+](C)CC(C)(C)C)no1 ZINC000336642948 350413713 /nfs/dbraw/zinc/41/37/13/350413713.db2.gz BDDNXRBGRBYOCC-UHFFFAOYSA-N 1 2 211.309 2.110 20 0 BEADLO CCc1nc(C[N@@H+](CC)C2CCC2)no1 ZINC000336646259 350415489 /nfs/dbraw/zinc/41/54/89/350415489.db2.gz JYILHPXPJISJLC-UHFFFAOYSA-N 1 2 209.293 2.006 20 0 BEADLO CCc1nc(C[N@H+](CC)C2CCC2)no1 ZINC000336646259 350415492 /nfs/dbraw/zinc/41/54/92/350415492.db2.gz JYILHPXPJISJLC-UHFFFAOYSA-N 1 2 209.293 2.006 20 0 BEADLO Cc1nn(C)c(C)c1CNc1cc[nH+]cc1F ZINC000192149250 180341365 /nfs/dbraw/zinc/34/13/65/180341365.db2.gz AVMNLORROFNXID-UHFFFAOYSA-N 1 2 234.278 2.183 20 0 BEADLO CCc1nc(C[N@@H+]2CC[C@](C)(CC)C2)no1 ZINC000336691837 350447840 /nfs/dbraw/zinc/44/78/40/350447840.db2.gz CKVNGACETLOGFE-LBPRGKRZSA-N 1 2 223.320 2.254 20 0 BEADLO CCc1nc(C[N@H+]2CC[C@](C)(CC)C2)no1 ZINC000336691837 350447843 /nfs/dbraw/zinc/44/78/43/350447843.db2.gz CKVNGACETLOGFE-LBPRGKRZSA-N 1 2 223.320 2.254 20 0 BEADLO O=C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccn1 ZINC000054600802 1172127843 /nfs/dbraw/zinc/12/78/43/1172127843.db2.gz MHKAQRSOGLHGFW-BETUJISGSA-N 1 2 230.311 2.168 20 0 BEADLO O=C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccn1 ZINC000054600802 1172127850 /nfs/dbraw/zinc/12/78/50/1172127850.db2.gz MHKAQRSOGLHGFW-BETUJISGSA-N 1 2 230.311 2.168 20 0 BEADLO CC[N@H+](Cc1cc(C)n(C)n1)Cc1ccncc1 ZINC000336712395 350469447 /nfs/dbraw/zinc/46/94/47/350469447.db2.gz OJNBWZLYEPEGTG-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CC[N@@H+](Cc1cc(C)n(C)n1)Cc1ccncc1 ZINC000336712395 350469450 /nfs/dbraw/zinc/46/94/50/350469450.db2.gz OJNBWZLYEPEGTG-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO Cc1nn(C)cc1[C@H](C)Nc1cccc[nH+]1 ZINC000134134052 180382890 /nfs/dbraw/zinc/38/28/90/180382890.db2.gz BIHJMQNNTJJAGV-VIFPVBQESA-N 1 2 216.288 2.297 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C1(CF)CCC1 ZINC000577495253 365968069 /nfs/dbraw/zinc/96/80/69/365968069.db2.gz QHOFERIRQCRDLM-UHFFFAOYSA-N 1 2 238.262 2.169 20 0 BEADLO CC(C)[C@@H](C)CNC(=O)CCCn1cc[nH+]c1 ZINC000606808295 350613194 /nfs/dbraw/zinc/61/31/94/350613194.db2.gz VXJIYIUXPIGDNR-LBPRGKRZSA-N 1 2 237.347 2.072 20 0 BEADLO Fc1cccc(C[NH2+]Cc2cocn2)c1F ZINC000309505925 350679142 /nfs/dbraw/zinc/67/91/42/350679142.db2.gz NCOSCCILRCSSMU-UHFFFAOYSA-N 1 2 224.210 2.243 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@H](F)C2)s1 ZINC000563273213 350749016 /nfs/dbraw/zinc/74/90/16/350749016.db2.gz MCWVMRDKOQYREF-VIFPVBQESA-N 1 2 214.309 2.385 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@H](F)C2)s1 ZINC000563273213 350749019 /nfs/dbraw/zinc/74/90/19/350749019.db2.gz MCWVMRDKOQYREF-VIFPVBQESA-N 1 2 214.309 2.385 20 0 BEADLO C[C@@H]1CC(C)(C)CC[C@H]1[NH2+]Cc1c[nH]nn1 ZINC000334622625 350726426 /nfs/dbraw/zinc/72/64/26/350726426.db2.gz BVNDQCIDFHXBLS-MWLCHTKSSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@@H]1CC(C)(C)CC[C@H]1[NH2+]Cc1cn[nH]n1 ZINC000334622625 350726430 /nfs/dbraw/zinc/72/64/30/350726430.db2.gz BVNDQCIDFHXBLS-MWLCHTKSSA-N 1 2 222.336 2.109 20 0 BEADLO CC(C)CCc1noc(C[N@@H+]2C[C@H](C)[C@H]2C)n1 ZINC000339575367 350765459 /nfs/dbraw/zinc/76/54/59/350765459.db2.gz ZCNSVEFVEZWGHU-WDEREUQCSA-N 1 2 237.347 2.498 20 0 BEADLO CC(C)CCc1noc(C[N@H+]2C[C@H](C)[C@H]2C)n1 ZINC000339575367 350765464 /nfs/dbraw/zinc/76/54/64/350765464.db2.gz ZCNSVEFVEZWGHU-WDEREUQCSA-N 1 2 237.347 2.498 20 0 BEADLO Cc1ncc(C[NH2+]Cc2ccc(C)c(C)n2)o1 ZINC000628308472 350783043 /nfs/dbraw/zinc/78/30/43/350783043.db2.gz QZKUSYVSSZCBAY-UHFFFAOYSA-N 1 2 231.299 2.285 20 0 BEADLO CO[C@@H]1CC[C@H](Nc2cc(NC3CC3)[nH+]cn2)C1 ZINC000577599753 366012006 /nfs/dbraw/zinc/01/20/06/366012006.db2.gz PUMVQVLAJMBILN-WDEREUQCSA-N 1 2 248.330 2.030 20 0 BEADLO CO[C@@H]1CC[C@H](Nc2cc(NC3CC3)nc[nH+]2)C1 ZINC000577599753 366012012 /nfs/dbraw/zinc/01/20/12/366012012.db2.gz PUMVQVLAJMBILN-WDEREUQCSA-N 1 2 248.330 2.030 20 0 BEADLO CCc1nc(C)c(C[NH2+]Cc2nccn2CC)o1 ZINC000382516678 350852632 /nfs/dbraw/zinc/85/26/32/350852632.db2.gz UPLMRNBEGQWQPD-UHFFFAOYSA-N 1 2 248.330 2.052 20 0 BEADLO CCc1nc(C)c(CNCc2[nH+]ccn2CC)o1 ZINC000382516678 350852635 /nfs/dbraw/zinc/85/26/35/350852635.db2.gz UPLMRNBEGQWQPD-UHFFFAOYSA-N 1 2 248.330 2.052 20 0 BEADLO CCc1nc(N2CCC[C@H]2C(C)(C)O)cc(C)[nH+]1 ZINC000340015132 350920391 /nfs/dbraw/zinc/92/03/91/350920391.db2.gz KRCLSPFTJUDWAD-NSHDSACASA-N 1 2 249.358 2.087 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CS[C@H](C)C1 ZINC000397901965 350988563 /nfs/dbraw/zinc/98/85/63/350988563.db2.gz VMMXAJXVWHXDTA-BDAKNGLRSA-N 1 2 224.329 2.396 20 0 BEADLO CCc1nc(C[NH2+]Cc2cnc(C)o2)cs1 ZINC000398055082 362994111 /nfs/dbraw/zinc/99/41/11/362994111.db2.gz HQZNSHNOVOIOKT-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO Cc1cc(C[NH2+]Cc2cnn[nH]2)ccc1Cl ZINC000623578595 363011113 /nfs/dbraw/zinc/01/11/13/363011113.db2.gz OVIKLABQLGZDPX-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO Cc1cc(C[NH2+]Cc2c[nH]nn2)ccc1Cl ZINC000623578595 363011114 /nfs/dbraw/zinc/01/11/14/363011114.db2.gz OVIKLABQLGZDPX-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO CC[C@H]1CCC[C@@H](C[NH2+]Cc2c[nH]nn2)C1 ZINC000398388078 351128152 /nfs/dbraw/zinc/12/81/52/351128152.db2.gz JMAXQJFXERURNL-WDEREUQCSA-N 1 2 222.336 2.111 20 0 BEADLO CC[C@H]1CCC[C@@H](C[NH2+]Cc2cn[nH]n2)C1 ZINC000398388078 351128153 /nfs/dbraw/zinc/12/81/53/351128153.db2.gz JMAXQJFXERURNL-WDEREUQCSA-N 1 2 222.336 2.111 20 0 BEADLO Cc1nc(NCCC(F)(F)F)cc[nH+]1 ZINC000063100555 351140365 /nfs/dbraw/zinc/14/03/65/351140365.db2.gz WHCMIZPAMQQNEP-UHFFFAOYSA-N 1 2 205.183 2.149 20 0 BEADLO CC[C@H]1CCC[C@H]([NH2+]Cc2c[nH]nn2)CC1 ZINC000398415821 351142630 /nfs/dbraw/zinc/14/26/30/351142630.db2.gz SJUMMKZETJTDBA-QWRGUYRKSA-N 1 2 222.336 2.253 20 0 BEADLO CC[C@H]1CCC[C@H]([NH2+]Cc2cn[nH]n2)CC1 ZINC000398415821 351142633 /nfs/dbraw/zinc/14/26/33/351142633.db2.gz SJUMMKZETJTDBA-QWRGUYRKSA-N 1 2 222.336 2.253 20 0 BEADLO Cc1ncc(C[N@H+]2C[C@@H](C)OC3(CCC3)C2)o1 ZINC000628322818 351212621 /nfs/dbraw/zinc/21/26/21/351212621.db2.gz MOTYRIVGTKHOLM-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1ncc(C[N@@H+]2C[C@@H](C)OC3(CCC3)C2)o1 ZINC000628322818 351212622 /nfs/dbraw/zinc/21/26/22/351212622.db2.gz MOTYRIVGTKHOLM-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C1CCC1 ZINC000265049982 351261972 /nfs/dbraw/zinc/26/19/72/351261972.db2.gz YJPGFOLGRKYOLL-UHFFFAOYSA-N 1 2 204.273 2.383 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)CC[C@H]1CCOC1 ZINC000267586713 351316563 /nfs/dbraw/zinc/31/65/63/351316563.db2.gz MMPQMGCWPVDOBM-NSHDSACASA-N 1 2 248.326 2.399 20 0 BEADLO O=C(CCn1cc[nH+]c1)NCCC1=CCCCC1 ZINC000072622570 351326644 /nfs/dbraw/zinc/32/66/44/351326644.db2.gz ZEVFUSPEFWJHJB-UHFFFAOYSA-N 1 2 247.342 2.280 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H](C)n1cccn1 ZINC000265196563 351265594 /nfs/dbraw/zinc/26/55/94/351265594.db2.gz JHFAXAUKZVHXOP-SNVBAGLBSA-N 1 2 244.298 2.040 20 0 BEADLO C[C@H]([NH2+]Cc1ccns1)c1cscn1 ZINC000404349614 351389127 /nfs/dbraw/zinc/38/91/27/351389127.db2.gz KCVHXPBUJMVNKE-ZETCQYMHSA-N 1 2 225.342 2.450 20 0 BEADLO CCc1nnc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)[nH]1 ZINC000273174542 351511650 /nfs/dbraw/zinc/51/16/50/351511650.db2.gz GTIBXXFISULTJY-LLVKDONJSA-N 1 2 245.330 2.032 20 0 BEADLO CCc1nnc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)[nH]1 ZINC000273174542 351511653 /nfs/dbraw/zinc/51/16/53/351511653.db2.gz GTIBXXFISULTJY-LLVKDONJSA-N 1 2 245.330 2.032 20 0 BEADLO C[C@@H]1CCCN(C(=O)CCCn2cc[nH+]c2)[C@@H]1C ZINC000607525494 351573927 /nfs/dbraw/zinc/57/39/27/351573927.db2.gz MIBGNYORBUJRFJ-CHWSQXEVSA-N 1 2 249.358 2.310 20 0 BEADLO CC[C@@H]1CCCCN1C(=O)CCc1c[nH+]cn1C ZINC000276695297 351644548 /nfs/dbraw/zinc/64/45/48/351644548.db2.gz QNJWPDWLTYMIMN-GFCCVEGCSA-N 1 2 249.358 2.144 20 0 BEADLO CC[C@@H](NC(=O)CCc1c[nH+]c[nH]1)[C@@H]1CC1(C)C ZINC000577840447 366078698 /nfs/dbraw/zinc/07/86/98/366078698.db2.gz XMFMCXLBUBWTTD-NWDGAFQWSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@@H](NC(=O)CCc1c[nH]c[nH+]1)[C@@H]1CC1(C)C ZINC000577840447 366078707 /nfs/dbraw/zinc/07/87/07/366078707.db2.gz XMFMCXLBUBWTTD-NWDGAFQWSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1C(=O)NCc1[nH]cc[nH+]1 ZINC000280475367 351845822 /nfs/dbraw/zinc/84/58/22/351845822.db2.gz IQDZBBJPXYUHHY-MNOVXSKESA-N 1 2 235.331 2.242 20 0 BEADLO Cc1ccc(CN2CCn3cc[nH+]c3C2)c(F)c1 ZINC000638011577 351889146 /nfs/dbraw/zinc/88/91/46/351889146.db2.gz CCPSDDHYSLHYMU-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccc[nH]2)sn1 ZINC000638149631 352013699 /nfs/dbraw/zinc/01/36/99/352013699.db2.gz CBOIVRBEOKYJMO-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccc[nH]2)sn1 ZINC000638149631 352013702 /nfs/dbraw/zinc/01/37/02/352013702.db2.gz CBOIVRBEOKYJMO-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO CC1(C)CCC[C@@H]1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000284545681 351999886 /nfs/dbraw/zinc/99/98/86/351999886.db2.gz XNGXURAJEXHTOU-QRGHLMKCSA-N 1 2 233.315 2.118 20 0 BEADLO C[N@H+](Cc1ccc[nH]1)Cc1ccns1 ZINC000638149954 352013935 /nfs/dbraw/zinc/01/39/35/352013935.db2.gz HRASNGSPQQKVSL-UHFFFAOYSA-N 1 2 207.302 2.103 20 0 BEADLO C[N@@H+](Cc1ccc[nH]1)Cc1ccns1 ZINC000638149954 352013938 /nfs/dbraw/zinc/01/39/38/352013938.db2.gz HRASNGSPQQKVSL-UHFFFAOYSA-N 1 2 207.302 2.103 20 0 BEADLO Cn1cc(C[NH2+][C@@H]2CCCc3scnc32)cn1 ZINC000623871971 352058791 /nfs/dbraw/zinc/05/87/91/352058791.db2.gz QTGGFYOIAIEHOB-SNVBAGLBSA-N 1 2 248.355 2.044 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+](C)Cc2cccs2)[nH]1 ZINC000411149901 191164115 /nfs/dbraw/zinc/16/41/15/191164115.db2.gz UBGRDSRWMIRECG-MRVPVSSYSA-N 1 2 236.344 2.368 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+](C)Cc2cccs2)[nH]1 ZINC000411149901 191164117 /nfs/dbraw/zinc/16/41/17/191164117.db2.gz UBGRDSRWMIRECG-MRVPVSSYSA-N 1 2 236.344 2.368 20 0 BEADLO CC(C)[C@@H]1CCCC[C@@H]1NC(=O)Cn1cc[nH+]c1 ZINC000073380015 352334685 /nfs/dbraw/zinc/33/46/85/352334685.db2.gz VCPGKKYPURJTNP-STQMWFEESA-N 1 2 249.358 2.214 20 0 BEADLO CCC1(NC(=O)c2c[nH+]c(C)[nH]2)CCCC1 ZINC000296466855 187700308 /nfs/dbraw/zinc/70/03/08/187700308.db2.gz ZWLPCRKRXAGNBO-UHFFFAOYSA-N 1 2 221.304 2.171 20 0 BEADLO CCCC[C@H](C)C(=O)NCc1[nH+]ccn1CC ZINC000295507356 352415848 /nfs/dbraw/zinc/41/58/48/352415848.db2.gz HBVZLHPDHUQQHY-NSHDSACASA-N 1 2 237.347 2.346 20 0 BEADLO OC1(CC[N@@H+]2CCCC[C@@H]2C(F)F)CCC1 ZINC000411694436 191204407 /nfs/dbraw/zinc/20/44/07/191204407.db2.gz RNFITUSRHHJION-SNVBAGLBSA-N 1 2 233.302 2.411 20 0 BEADLO OC1(CC[N@H+]2CCCC[C@@H]2C(F)F)CCC1 ZINC000411694436 191204409 /nfs/dbraw/zinc/20/44/09/191204409.db2.gz RNFITUSRHHJION-SNVBAGLBSA-N 1 2 233.302 2.411 20 0 BEADLO Cn1ccnc1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC000336398012 180741801 /nfs/dbraw/zinc/74/18/01/180741801.db2.gz QTDHNVHJHIYHAE-ZDUSSCGKSA-N 1 2 242.326 2.152 20 0 BEADLO Cn1ccnc1C[N@H+]1CCC[C@H]1c1cccnc1 ZINC000336398012 180741804 /nfs/dbraw/zinc/74/18/04/180741804.db2.gz QTDHNVHJHIYHAE-ZDUSSCGKSA-N 1 2 242.326 2.152 20 0 BEADLO C[C@@H](C[NH2+]Cc1cc(C2CC2)no1)N(C)C1CC1 ZINC000638574374 352404444 /nfs/dbraw/zinc/40/44/44/352404444.db2.gz DCKFOEDINWAQHP-JTQLQIEISA-N 1 2 249.358 2.124 20 0 BEADLO C[C@H](O)CC[NH2+][C@@H](c1ccccc1)C(F)F ZINC000411761134 191209410 /nfs/dbraw/zinc/20/94/10/191209410.db2.gz UCWFIRCSFMHOTP-ONGXEEELSA-N 1 2 229.270 2.353 20 0 BEADLO COC(=O)c1cc(C[N@@H+]2CC[C@H](F)C2)cs1 ZINC000411774535 191210396 /nfs/dbraw/zinc/21/03/96/191210396.db2.gz OZLCEGVUGVSCCE-VIFPVBQESA-N 1 2 243.303 2.079 20 0 BEADLO COC(=O)c1cc(C[N@H+]2CC[C@H](F)C2)cs1 ZINC000411774535 191210399 /nfs/dbraw/zinc/21/03/99/191210399.db2.gz OZLCEGVUGVSCCE-VIFPVBQESA-N 1 2 243.303 2.079 20 0 BEADLO CCc1noc(C[N@H+](C)Cc2ccccc2)n1 ZINC000073600066 352520642 /nfs/dbraw/zinc/52/06/42/352520642.db2.gz LPJLASGHWLFPKD-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1noc(C[N@@H+](C)Cc2ccccc2)n1 ZINC000073600066 352520645 /nfs/dbraw/zinc/52/06/45/352520645.db2.gz LPJLASGHWLFPKD-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CO[C@@H](C)C[N@@H+]1Cc2ccc(C(C)=O)cc2C1 ZINC000411957267 191233150 /nfs/dbraw/zinc/23/31/50/191233150.db2.gz YZWVNMRXFKOGQT-JTQLQIEISA-N 1 2 233.311 2.240 20 0 BEADLO CO[C@@H](C)C[N@H+]1Cc2ccc(C(C)=O)cc2C1 ZINC000411957267 191233152 /nfs/dbraw/zinc/23/31/52/191233152.db2.gz YZWVNMRXFKOGQT-JTQLQIEISA-N 1 2 233.311 2.240 20 0 BEADLO CCC[C@H](CNc1ccc(N(C)C)c[nH+]1)OC ZINC000638760491 352695007 /nfs/dbraw/zinc/69/50/07/352695007.db2.gz SPWOLPTXPQWPKP-GFCCVEGCSA-N 1 2 237.347 2.375 20 0 BEADLO CCC[C@@H](CNc1ccc(N(C)C)c[nH+]1)OC ZINC000638760492 352695193 /nfs/dbraw/zinc/69/51/93/352695193.db2.gz SPWOLPTXPQWPKP-LBPRGKRZSA-N 1 2 237.347 2.375 20 0 BEADLO Cc1ccc(NCCC[C@H]2CCO2)c[nH+]1 ZINC000638761834 352699351 /nfs/dbraw/zinc/69/93/51/352699351.db2.gz LVBATSISESEUPK-LBPRGKRZSA-N 1 2 206.289 2.371 20 0 BEADLO CC[N@H+](Cc1cc[nH]n1)Cc1occc1C ZINC000412026608 191239302 /nfs/dbraw/zinc/23/93/02/191239302.db2.gz MGMGNRCFNHJLNL-UHFFFAOYSA-N 1 2 219.288 2.333 20 0 BEADLO CC[N@@H+](Cc1cc[nH]n1)Cc1occc1C ZINC000412026608 191239303 /nfs/dbraw/zinc/23/93/03/191239303.db2.gz MGMGNRCFNHJLNL-UHFFFAOYSA-N 1 2 219.288 2.333 20 0 BEADLO CCN(Cc1[nH+]ccn1C)Cc1occc1C ZINC000412027397 191239597 /nfs/dbraw/zinc/23/95/97/191239597.db2.gz PGIPUKOBYXGLHA-UHFFFAOYSA-N 1 2 233.315 2.344 20 0 BEADLO CC[N@@H+](Cc1nccn1C)Cc1occc1C ZINC000412027397 191239599 /nfs/dbraw/zinc/23/95/99/191239599.db2.gz PGIPUKOBYXGLHA-UHFFFAOYSA-N 1 2 233.315 2.344 20 0 BEADLO CC[N@H+](Cc1nccn1C)Cc1occc1C ZINC000412027397 191239602 /nfs/dbraw/zinc/23/96/02/191239602.db2.gz PGIPUKOBYXGLHA-UHFFFAOYSA-N 1 2 233.315 2.344 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+](CC)Cc1occc1C ZINC000412028263 191240555 /nfs/dbraw/zinc/24/05/55/191240555.db2.gz RPDRXSLUQKDUFH-LLVKDONJSA-N 1 2 239.315 2.362 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+](CC)Cc1occc1C ZINC000412028263 191240558 /nfs/dbraw/zinc/24/05/58/191240558.db2.gz RPDRXSLUQKDUFH-LLVKDONJSA-N 1 2 239.315 2.362 20 0 BEADLO CC[N@H+](Cc1noc(C)n1)C1CC(C)(C)C1 ZINC000412029012 191241303 /nfs/dbraw/zinc/24/13/03/191241303.db2.gz CCYIQAAQTSRYED-UHFFFAOYSA-N 1 2 223.320 2.389 20 0 BEADLO CC[N@@H+](Cc1noc(C)n1)C1CC(C)(C)C1 ZINC000412029012 191241304 /nfs/dbraw/zinc/24/13/04/191241304.db2.gz CCYIQAAQTSRYED-UHFFFAOYSA-N 1 2 223.320 2.389 20 0 BEADLO Cc1nc(N(C)Cc2ccsc2)cc[nH+]1 ZINC000608078254 352683129 /nfs/dbraw/zinc/68/31/29/352683129.db2.gz KILHTMYEAHAJJR-UHFFFAOYSA-N 1 2 219.313 2.483 20 0 BEADLO COc1ccc2[nH+]c(N3CCOCC3)ccc2c1 ZINC000032011314 352734219 /nfs/dbraw/zinc/73/42/19/352734219.db2.gz XSLDBWZLBGPIAO-UHFFFAOYSA-N 1 2 244.294 2.080 20 0 BEADLO Cc1c[nH+]cc(N[C@H](C)C[C@H]2CCCC(=O)N2)c1 ZINC000638787529 352743259 /nfs/dbraw/zinc/74/32/59/352743259.db2.gz KIOAQOJAUKQZPL-VXGBXAGGSA-N 1 2 247.342 2.249 20 0 BEADLO Cc1c[nH+]cc(NCCC[C@@H]2CCO2)c1 ZINC000638787554 352743492 /nfs/dbraw/zinc/74/34/92/352743492.db2.gz OKJJARUZMAHCLS-GFCCVEGCSA-N 1 2 206.289 2.371 20 0 BEADLO COC[C@@H]([NH2+]Cc1ncc[nH]1)c1ccc(F)cc1 ZINC000342333540 352744285 /nfs/dbraw/zinc/74/42/85/352744285.db2.gz ZINSKBYYBGDUDK-GFCCVEGCSA-N 1 2 249.289 2.026 20 0 BEADLO COC[C@H]([NH2+]Cc1ncc[nH]1)c1ccc(F)cc1 ZINC000342333541 352744599 /nfs/dbraw/zinc/74/45/99/352744599.db2.gz ZINSKBYYBGDUDK-LBPRGKRZSA-N 1 2 249.289 2.026 20 0 BEADLO Cc1[nH+]cccc1NCCC[C@H]1CCO1 ZINC000638787209 352744652 /nfs/dbraw/zinc/74/46/52/352744652.db2.gz WONKAUMXILMGKL-NSHDSACASA-N 1 2 206.289 2.371 20 0 BEADLO Cc1nc(N2CC(Oc3ccccc3)C2)cc[nH+]1 ZINC000608082693 352746871 /nfs/dbraw/zinc/74/68/71/352746871.db2.gz PJYQXKSBABYYJC-UHFFFAOYSA-N 1 2 241.294 2.053 20 0 BEADLO Cc1nc(C[N@H+]2CCO[C@H](C)[C@@H]2C)c(C)s1 ZINC000334184918 352773144 /nfs/dbraw/zinc/77/31/44/352773144.db2.gz DIJXEAXRFOYOMF-DTWKUNHWSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nc(C[N@@H+]2CCO[C@H](C)[C@@H]2C)c(C)s1 ZINC000334184918 352773147 /nfs/dbraw/zinc/77/31/47/352773147.db2.gz DIJXEAXRFOYOMF-DTWKUNHWSA-N 1 2 240.372 2.369 20 0 BEADLO OC[C@@H]1C[C@@H](F)C[N@@H+]1Cc1sccc1Cl ZINC000334218917 352820112 /nfs/dbraw/zinc/82/01/12/352820112.db2.gz IRVJDELQAXECRB-SFYZADRCSA-N 1 2 249.738 2.306 20 0 BEADLO OC[C@@H]1C[C@@H](F)C[N@H+]1Cc1sccc1Cl ZINC000334218917 352820114 /nfs/dbraw/zinc/82/01/14/352820114.db2.gz IRVJDELQAXECRB-SFYZADRCSA-N 1 2 249.738 2.306 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CC[C@H](C(C)C)C1 ZINC000334193244 352785352 /nfs/dbraw/zinc/78/53/52/352785352.db2.gz JAYHEBPRTLZJJT-LBPRGKRZSA-N 1 2 247.342 2.322 20 0 BEADLO Cc1nocc1C[N@@H+]1C[C@@]2(CCCO2)[C@@H]1C1CC1 ZINC000334205429 352800166 /nfs/dbraw/zinc/80/01/66/352800166.db2.gz XTVNYGAYCDBRII-KBPBESRZSA-N 1 2 248.326 2.126 20 0 BEADLO Cc1nocc1C[N@H+]1C[C@@]2(CCCO2)[C@@H]1C1CC1 ZINC000334205429 352800170 /nfs/dbraw/zinc/80/01/70/352800170.db2.gz XTVNYGAYCDBRII-KBPBESRZSA-N 1 2 248.326 2.126 20 0 BEADLO c1nnsc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000334210264 352807803 /nfs/dbraw/zinc/80/78/03/352807803.db2.gz NVKCNHIRIMLRGN-GFCCVEGCSA-N 1 2 231.324 2.485 20 0 BEADLO c1nnsc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000334210264 352807805 /nfs/dbraw/zinc/80/78/05/352807805.db2.gz NVKCNHIRIMLRGN-GFCCVEGCSA-N 1 2 231.324 2.485 20 0 BEADLO Cc1cnc(C[N@@H+]2CCc3sccc3C2)cn1 ZINC000334211413 352808335 /nfs/dbraw/zinc/80/83/35/352808335.db2.gz GXGSPJRCMFKZTH-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cnc(C[N@H+]2CCc3sccc3C2)cn1 ZINC000334211413 352808338 /nfs/dbraw/zinc/80/83/38/352808338.db2.gz GXGSPJRCMFKZTH-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@]1(C)C[C@H]2C[C@H]2C1 ZINC000334258706 352869626 /nfs/dbraw/zinc/86/96/26/352869626.db2.gz PJOVCPGGOYCMBT-GNXNZQSNSA-N 1 2 230.311 2.187 20 0 BEADLO OC[C@@H]1C[C@H](F)C[N@@H+]1Cc1cccc(Cl)c1 ZINC000334259150 352870520 /nfs/dbraw/zinc/87/05/20/352870520.db2.gz TWRMMCXMVZZHFX-RYUDHWBXSA-N 1 2 243.709 2.245 20 0 BEADLO OC[C@@H]1C[C@H](F)C[N@H+]1Cc1cccc(Cl)c1 ZINC000334259150 352870523 /nfs/dbraw/zinc/87/05/23/352870523.db2.gz TWRMMCXMVZZHFX-RYUDHWBXSA-N 1 2 243.709 2.245 20 0 BEADLO CC(C)C[C@@H](C)Nc1[nH+]cnc2c1cnn2C ZINC000037265054 187907572 /nfs/dbraw/zinc/90/75/72/187907572.db2.gz QAAHJXUBPZFHDO-SECBINFHSA-N 1 2 233.319 2.210 20 0 BEADLO CCc1nc(N2[C@H](C)C[C@@H]2C)cc(C)[nH+]1 ZINC000334251629 352887822 /nfs/dbraw/zinc/88/78/22/352887822.db2.gz VMGLIULPIKUIMD-AOOOYVTPSA-N 1 2 205.305 2.335 20 0 BEADLO C[C@@]1(O)CCN(c2[nH+]ccc3ccc(F)cc32)C1 ZINC000334252658 352889297 /nfs/dbraw/zinc/88/92/97/352889297.db2.gz LKJUOUSPEZLMGS-CQSZACIVSA-N 1 2 246.285 2.335 20 0 BEADLO CC[C@]1(C)COCC[N@@H+]1Cc1nc(C)c(C)o1 ZINC000334341427 352977446 /nfs/dbraw/zinc/97/74/46/352977446.db2.gz OJPCUFMSTPBIRL-CYBMUJFWSA-N 1 2 238.331 2.292 20 0 BEADLO CC[C@]1(C)COCC[N@H+]1Cc1nc(C)c(C)o1 ZINC000334341427 352977447 /nfs/dbraw/zinc/97/74/47/352977447.db2.gz OJPCUFMSTPBIRL-CYBMUJFWSA-N 1 2 238.331 2.292 20 0 BEADLO Oc1cccc(C[N@@H+]2CCC[C@H]2c2ncc[nH]2)c1 ZINC000334327728 352964205 /nfs/dbraw/zinc/96/42/05/352964205.db2.gz CDUYOPMPDDRCAW-ZDUSSCGKSA-N 1 2 243.310 2.452 20 0 BEADLO Oc1cccc(C[N@H+]2CCC[C@H]2c2ncc[nH]2)c1 ZINC000334327728 352964207 /nfs/dbraw/zinc/96/42/07/352964207.db2.gz CDUYOPMPDDRCAW-ZDUSSCGKSA-N 1 2 243.310 2.452 20 0 BEADLO CC[N@H+](CCC(F)(F)F)Cc1cc[nH]n1 ZINC000092753897 538107786 /nfs/dbraw/zinc/10/77/86/538107786.db2.gz BSCHCPVVKPCGOT-UHFFFAOYSA-N 1 2 221.226 2.184 20 0 BEADLO CC[N@@H+](CCC(F)(F)F)Cc1cc[nH]n1 ZINC000092753897 538107787 /nfs/dbraw/zinc/10/77/87/538107787.db2.gz BSCHCPVVKPCGOT-UHFFFAOYSA-N 1 2 221.226 2.184 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@@H](C(C)C)C2)sn1 ZINC000638910577 353074585 /nfs/dbraw/zinc/07/45/85/353074585.db2.gz ACXGXRUHZSVWFD-GFCCVEGCSA-N 1 2 240.372 2.308 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@@H](C(C)C)C2)sn1 ZINC000638910577 353074587 /nfs/dbraw/zinc/07/45/87/353074587.db2.gz ACXGXRUHZSVWFD-GFCCVEGCSA-N 1 2 240.372 2.308 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1nc(C)c(C)o1 ZINC000334429728 353104499 /nfs/dbraw/zinc/10/44/99/353104499.db2.gz ZFGSLPLYZPYOCR-CABZTGNLSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1nc(C)c(C)o1 ZINC000334429728 353104501 /nfs/dbraw/zinc/10/45/01/353104501.db2.gz ZFGSLPLYZPYOCR-CABZTGNLSA-N 1 2 238.331 2.291 20 0 BEADLO Cn1cc[nH+]c1[C@H](C1CC1)N1CCC=C(F)C1 ZINC000638935721 353100001 /nfs/dbraw/zinc/10/00/01/353100001.db2.gz BGYRPLYOHLSKDW-LBPRGKRZSA-N 1 2 235.306 2.430 20 0 BEADLO COc1cc[nH+]c(CN(C)CC(F)(F)F)c1 ZINC000269393723 188024208 /nfs/dbraw/zinc/02/42/08/188024208.db2.gz BDGFWAXPPUVWDG-UHFFFAOYSA-N 1 2 234.221 2.084 20 0 BEADLO c1coc(C[NH2+][C@H]2CCCc3cn[nH]c32)c1 ZINC000268887352 188024659 /nfs/dbraw/zinc/02/46/59/188024659.db2.gz ZDWOSCWCVSLNJB-NSHDSACASA-N 1 2 217.272 2.170 20 0 BEADLO c1coc(C[NH2+][C@H]2CCCc3c[nH]nc32)c1 ZINC000268887352 188024661 /nfs/dbraw/zinc/02/46/61/188024661.db2.gz ZDWOSCWCVSLNJB-NSHDSACASA-N 1 2 217.272 2.170 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2cccnc2)nc1 ZINC000272034801 188026242 /nfs/dbraw/zinc/02/62/42/188026242.db2.gz XGBPSLFCEXBOHE-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2cccnc2)nc1 ZINC000272034801 188026243 /nfs/dbraw/zinc/02/62/43/188026243.db2.gz XGBPSLFCEXBOHE-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO CC1(C)C[C@@H]1[NH2+][C@H](c1ncc[nH]1)c1ccccn1 ZINC000278639635 188030440 /nfs/dbraw/zinc/03/04/40/188030440.db2.gz HMAORADYFJEBGJ-RYUDHWBXSA-N 1 2 242.326 2.282 20 0 BEADLO C=Cn1cc(C[N@@H+]2CCO[C@@H](C(C)(C)C)C2)cn1 ZINC000280411949 188031350 /nfs/dbraw/zinc/03/13/50/188031350.db2.gz IAELWLKFZAMIEG-CYBMUJFWSA-N 1 2 249.358 2.231 20 0 BEADLO C=Cn1cc(C[N@H+]2CCO[C@@H](C(C)(C)C)C2)cn1 ZINC000280411949 188031352 /nfs/dbraw/zinc/03/13/52/188031352.db2.gz IAELWLKFZAMIEG-CYBMUJFWSA-N 1 2 249.358 2.231 20 0 BEADLO COc1nccc(C[N@H+](C)Cc2ccc(C)o2)n1 ZINC000294519874 188038638 /nfs/dbraw/zinc/03/86/38/188038638.db2.gz FHCBLGWGTGFNSR-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1nccc(C[N@@H+](C)Cc2ccc(C)o2)n1 ZINC000294519874 188038639 /nfs/dbraw/zinc/03/86/39/188038639.db2.gz FHCBLGWGTGFNSR-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO c1nn[nH]c1C[N@@H+]1CCC=C(c2ccccc2)C1 ZINC000295482379 188039884 /nfs/dbraw/zinc/03/98/84/188039884.db2.gz YTJFOUNLHWMDQS-UHFFFAOYSA-N 1 2 240.310 2.094 20 0 BEADLO c1nn[nH]c1C[N@H+]1CCC=C(c2ccccc2)C1 ZINC000295482379 188039885 /nfs/dbraw/zinc/03/98/85/188039885.db2.gz YTJFOUNLHWMDQS-UHFFFAOYSA-N 1 2 240.310 2.094 20 0 BEADLO c1[nH]nnc1C[N@@H+]1CCC=C(c2ccccc2)C1 ZINC000295482379 188039887 /nfs/dbraw/zinc/03/98/87/188039887.db2.gz YTJFOUNLHWMDQS-UHFFFAOYSA-N 1 2 240.310 2.094 20 0 BEADLO c1[nH]nnc1C[N@H+]1CCC=C(c2ccccc2)C1 ZINC000295482379 188039888 /nfs/dbraw/zinc/03/98/88/188039888.db2.gz YTJFOUNLHWMDQS-UHFFFAOYSA-N 1 2 240.310 2.094 20 0 BEADLO c1n[nH]nc1C[N@@H+]1CCC=C(c2ccccc2)C1 ZINC000295482379 188039890 /nfs/dbraw/zinc/03/98/90/188039890.db2.gz YTJFOUNLHWMDQS-UHFFFAOYSA-N 1 2 240.310 2.094 20 0 BEADLO c1n[nH]nc1C[N@H+]1CCC=C(c2ccccc2)C1 ZINC000295482379 188039892 /nfs/dbraw/zinc/03/98/92/188039892.db2.gz YTJFOUNLHWMDQS-UHFFFAOYSA-N 1 2 240.310 2.094 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@](C)(F)C2)nc1 ZINC000336322888 188055443 /nfs/dbraw/zinc/05/54/43/188055443.db2.gz LHKMZXWGQJSHRM-LBPRGKRZSA-N 1 2 224.279 2.024 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@](C)(F)C2)nc1 ZINC000336322888 188055446 /nfs/dbraw/zinc/05/54/46/188055446.db2.gz LHKMZXWGQJSHRM-LBPRGKRZSA-N 1 2 224.279 2.024 20 0 BEADLO CC(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000336318776 188055574 /nfs/dbraw/zinc/05/55/74/188055574.db2.gz GCFASVOBEWYYEI-UHFFFAOYSA-N 1 2 215.256 2.344 20 0 BEADLO CC(C)[C@H](C)C(=O)N[C@H](c1[nH+]ccn1C)C1CC1 ZINC000341717016 188044768 /nfs/dbraw/zinc/04/47/68/188044768.db2.gz IBMLUYOSRKKPQS-JQWIXIFHSA-N 1 2 249.358 2.280 20 0 BEADLO FC(F)C[NH2+]CC1=Cc2ccccc2OC1 ZINC000298101581 180901645 /nfs/dbraw/zinc/90/16/45/180901645.db2.gz NPIGYQHKZXQWAO-UHFFFAOYSA-N 1 2 225.238 2.317 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]CCc1nccs1 ZINC000134555401 538113116 /nfs/dbraw/zinc/11/31/16/538113116.db2.gz DBHITBQNFCQQSU-QMMMGPOBSA-N 1 2 236.344 2.068 20 0 BEADLO CC(C)[C@H](C)N(C)c1nc[nH+]c(N)c1Cl ZINC000232719557 353269240 /nfs/dbraw/zinc/26/92/40/353269240.db2.gz GPNYRIVQUQBRAR-ZETCQYMHSA-N 1 2 228.727 2.193 20 0 BEADLO CC(C)[C@H](C)N(C)c1[nH+]cnc(N)c1Cl ZINC000232719557 353269241 /nfs/dbraw/zinc/26/92/41/353269241.db2.gz GPNYRIVQUQBRAR-ZETCQYMHSA-N 1 2 228.727 2.193 20 0 BEADLO COC1CC(N(C)c2[nH+]c3ccccc3n2C)C1 ZINC000343266455 353280736 /nfs/dbraw/zinc/28/07/36/353280736.db2.gz DOYVOCGDBWMCOT-UHFFFAOYSA-N 1 2 245.326 2.187 20 0 BEADLO COc1ccc(N[C@H]2CCO[C@H](C)C2)[nH+]c1 ZINC000225835402 538114219 /nfs/dbraw/zinc/11/42/19/538114219.db2.gz IJFYJMCQQVCPDW-ZJUUUORDSA-N 1 2 222.288 2.070 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](CC(=O)NCC(C)C)C2 ZINC000361604372 188244317 /nfs/dbraw/zinc/24/43/17/188244317.db2.gz SVCBHRXXKQHWKG-UHFFFAOYSA-N 1 2 246.354 2.083 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](CC(=O)NCC(C)C)C2 ZINC000361604372 188244319 /nfs/dbraw/zinc/24/43/19/188244319.db2.gz SVCBHRXXKQHWKG-UHFFFAOYSA-N 1 2 246.354 2.083 20 0 BEADLO C(c1noc(C2CC2)n1)[N@@H+]1CC2CCC1CC2 ZINC000367565569 188246767 /nfs/dbraw/zinc/24/67/67/188246767.db2.gz RIWMXTLZKVFGKV-UHFFFAOYSA-N 1 2 233.315 2.321 20 0 BEADLO C(c1noc(C2CC2)n1)[N@H+]1CC2CCC1CC2 ZINC000367565569 188246768 /nfs/dbraw/zinc/24/67/68/188246768.db2.gz RIWMXTLZKVFGKV-UHFFFAOYSA-N 1 2 233.315 2.321 20 0 BEADLO C(c1noc(C2CC2)n1)[N@@H+]1CC[C@H](C2CC2)C1 ZINC000378313939 188251838 /nfs/dbraw/zinc/25/18/38/188251838.db2.gz HJABZYGPDYEUFT-NSHDSACASA-N 1 2 233.315 2.179 20 0 BEADLO C(c1noc(C2CC2)n1)[N@H+]1CC[C@H](C2CC2)C1 ZINC000378313939 188251839 /nfs/dbraw/zinc/25/18/39/188251839.db2.gz HJABZYGPDYEUFT-NSHDSACASA-N 1 2 233.315 2.179 20 0 BEADLO CCc1ncc(C[N@H+](C)CCF)s1 ZINC000268309677 188261547 /nfs/dbraw/zinc/26/15/47/188261547.db2.gz PLHJDXPGZLWEMJ-UHFFFAOYSA-N 1 2 202.298 2.107 20 0 BEADLO CCc1ncc(C[N@@H+](C)CCF)s1 ZINC000268309677 188261548 /nfs/dbraw/zinc/26/15/48/188261548.db2.gz PLHJDXPGZLWEMJ-UHFFFAOYSA-N 1 2 202.298 2.107 20 0 BEADLO Cc1csc(C(=O)N(C)Cc2[nH+]ccn2C)c1 ZINC000293598262 188268414 /nfs/dbraw/zinc/26/84/14/188268414.db2.gz CRSXEVGZYADFMH-UHFFFAOYSA-N 1 2 249.339 2.062 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+]C[C@H](C)c1ccccc1 ZINC000049370164 188299297 /nfs/dbraw/zinc/29/92/97/188299297.db2.gz RZZQPQXCTVDMBT-NWDGAFQWSA-N 1 2 235.327 2.331 20 0 BEADLO FCCn1c[nH+]c2cc(F)c(F)cc21 ZINC000123887779 180937647 /nfs/dbraw/zinc/93/76/47/180937647.db2.gz YGNQQAFUTUFXMT-UHFFFAOYSA-N 1 2 200.163 2.284 20 0 BEADLO CCO[C@@H]1C[C@@H]1[NH2+]Cc1ncc(Cl)s1 ZINC000308496341 353357540 /nfs/dbraw/zinc/35/75/40/353357540.db2.gz DIKXYUYAJBHIDR-NKWVEPMBSA-N 1 2 232.736 2.064 20 0 BEADLO CC[C@]1(C)COCC[N@@H+]1Cc1ccns1 ZINC000639058968 353365523 /nfs/dbraw/zinc/36/55/23/353365523.db2.gz WIWZKKRLAHQGEL-LLVKDONJSA-N 1 2 226.345 2.144 20 0 BEADLO CC[C@]1(C)COCC[N@H+]1Cc1ccns1 ZINC000639058968 353365525 /nfs/dbraw/zinc/36/55/25/353365525.db2.gz WIWZKKRLAHQGEL-LLVKDONJSA-N 1 2 226.345 2.144 20 0 BEADLO C[C@@H]1CCC[C@H](CC(=O)NCc2[nH+]ccn2C)C1 ZINC000343283296 353344059 /nfs/dbraw/zinc/34/40/59/353344059.db2.gz ASSFNEXCEGMDEI-NEPJUHHUSA-N 1 2 249.358 2.253 20 0 BEADLO CN(CCc1nccs1)c1cccc[nH+]1 ZINC000157802135 188333187 /nfs/dbraw/zinc/33/31/87/188333187.db2.gz NWXYSIDDKRGZNW-UHFFFAOYSA-N 1 2 219.313 2.217 20 0 BEADLO COc1ccc(NC[C@@H]2CCSC2)[nH+]c1 ZINC000226385255 538115703 /nfs/dbraw/zinc/11/57/03/538115703.db2.gz HOFYGDOJJLYGJL-VIFPVBQESA-N 1 2 224.329 2.255 20 0 BEADLO CC(C)CO[C@@H]1CC[N@H+](Cc2cscn2)C1 ZINC000177409095 188341160 /nfs/dbraw/zinc/34/11/60/188341160.db2.gz XXNAIGSZXCAXHG-GFCCVEGCSA-N 1 2 240.372 2.390 20 0 BEADLO CC(C)CO[C@@H]1CC[N@@H+](Cc2cscn2)C1 ZINC000177409095 188341162 /nfs/dbraw/zinc/34/11/62/188341162.db2.gz XXNAIGSZXCAXHG-GFCCVEGCSA-N 1 2 240.372 2.390 20 0 BEADLO c1coc(C[NH2+][C@@H]2CCCc3cn[nH]c32)c1 ZINC000268887351 188374288 /nfs/dbraw/zinc/37/42/88/188374288.db2.gz ZDWOSCWCVSLNJB-LLVKDONJSA-N 1 2 217.272 2.170 20 0 BEADLO CC(C)[N@H+](Cc1ccco1)Cc1nccc(N)n1 ZINC000269690020 188374986 /nfs/dbraw/zinc/37/49/86/188374986.db2.gz VYYWEZZAVJRCPG-UHFFFAOYSA-N 1 2 246.314 2.062 20 0 BEADLO CC(C)[N@@H+](Cc1ccco1)Cc1nccc(N)n1 ZINC000269690020 188374988 /nfs/dbraw/zinc/37/49/88/188374988.db2.gz VYYWEZZAVJRCPG-UHFFFAOYSA-N 1 2 246.314 2.062 20 0 BEADLO COc1cc(C)[nH+]c(CSc2ncc[nH]2)c1 ZINC000270119753 188375180 /nfs/dbraw/zinc/37/51/80/188375180.db2.gz JTJNMCUJPXOEAS-UHFFFAOYSA-N 1 2 235.312 2.414 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)sn1 ZINC000639085530 353425565 /nfs/dbraw/zinc/42/55/65/353425565.db2.gz HJNAYYLPNXTAMD-GARJFASQSA-N 1 2 240.372 2.449 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)sn1 ZINC000639085530 353425566 /nfs/dbraw/zinc/42/55/66/353425566.db2.gz HJNAYYLPNXTAMD-GARJFASQSA-N 1 2 240.372 2.449 20 0 BEADLO Cc1cnc([C@@H](C)Nc2cc[nH+]c(C)n2)o1 ZINC000226547897 538116678 /nfs/dbraw/zinc/11/66/78/538116678.db2.gz VGUQVMDOJNASCW-MRVPVSSYSA-N 1 2 218.260 2.255 20 0 BEADLO CC(C)(C)[C@@H]1CCCN1C(=O)CCn1cc[nH+]c1 ZINC000264246495 188370342 /nfs/dbraw/zinc/37/03/42/188370342.db2.gz OFGCZYWDFQDGRZ-LBPRGKRZSA-N 1 2 249.358 2.310 20 0 BEADLO COc1ccc(OCc2c[nH+]cn2C)cc1 ZINC000258213984 188370946 /nfs/dbraw/zinc/37/09/46/188370946.db2.gz OWNQHWSNCAEBLY-UHFFFAOYSA-N 1 2 218.256 2.008 20 0 BEADLO Cc1ccc(CCC(=O)NCc2[nH]cc[nH+]2)s1 ZINC000291436025 188390657 /nfs/dbraw/zinc/39/06/57/188390657.db2.gz YYGYFKUNAZRBHB-UHFFFAOYSA-N 1 2 249.339 2.029 20 0 BEADLO Cc1ccc2c(c1)CCN2Cc1c[nH+]cn1C ZINC000271559678 188376297 /nfs/dbraw/zinc/37/62/97/188376297.db2.gz MZMQUIBBFFXMIE-UHFFFAOYSA-N 1 2 227.311 2.291 20 0 BEADLO CC[C@]1(C)C[N@H+](Cc2ccns2)CCO1 ZINC000639089031 353445656 /nfs/dbraw/zinc/44/56/56/353445656.db2.gz BUQQVOOWMRJHGT-LLVKDONJSA-N 1 2 226.345 2.144 20 0 BEADLO CC[C@]1(C)C[N@@H+](Cc2ccns2)CCO1 ZINC000639089031 353445658 /nfs/dbraw/zinc/44/56/58/353445658.db2.gz BUQQVOOWMRJHGT-LLVKDONJSA-N 1 2 226.345 2.144 20 0 BEADLO CC(C)(CC(=O)NCc1[nH]cc[nH+]1)C(F)(F)F ZINC000280761826 188383127 /nfs/dbraw/zinc/38/31/27/188383127.db2.gz QWDHMANVMKTOQB-UHFFFAOYSA-N 1 2 249.236 2.005 20 0 BEADLO CC(C)(C)[C@@H]1C[N@H+](Cc2cncs2)CCO1 ZINC000280545768 188384108 /nfs/dbraw/zinc/38/41/08/188384108.db2.gz SWEJCOPULOSPQD-NSHDSACASA-N 1 2 240.372 2.390 20 0 BEADLO CC(C)(C)[C@@H]1C[N@@H+](Cc2cncs2)CCO1 ZINC000280545768 188384109 /nfs/dbraw/zinc/38/41/09/188384109.db2.gz SWEJCOPULOSPQD-NSHDSACASA-N 1 2 240.372 2.390 20 0 BEADLO c1cc2[nH+]ccc(NCC3=CCCOC3)c2cn1 ZINC000288641152 188388282 /nfs/dbraw/zinc/38/82/82/188388282.db2.gz XIWAUAXLOUUVHC-UHFFFAOYSA-N 1 2 241.294 2.388 20 0 BEADLO CC1(C)C[C@H]1NC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000290757272 188389364 /nfs/dbraw/zinc/38/93/64/188389364.db2.gz RGDWFPOQMFKJCY-SNVBAGLBSA-N 1 2 244.298 2.254 20 0 BEADLO Cc1cc(C)c(NC(=O)COC(F)F)c(C)[nH+]1 ZINC000340778399 188398271 /nfs/dbraw/zinc/39/82/71/188398271.db2.gz PGVDIBDXMYMMCZ-UHFFFAOYSA-N 1 2 244.241 2.185 20 0 BEADLO CC(C)N(C(=O)COc1cc[nH+]cc1)C(C)C ZINC000292414359 188391729 /nfs/dbraw/zinc/39/17/29/188391729.db2.gz JWRNRBMAXBBFHS-UHFFFAOYSA-N 1 2 236.315 2.106 20 0 BEADLO CC1(C)C[C@@H]1[NH2+][C@H](c1cccs1)c1nnc[nH]1 ZINC000294697082 188392576 /nfs/dbraw/zinc/39/25/76/188392576.db2.gz IVIQRBJKLDKJPQ-VHSXEESVSA-N 1 2 248.355 2.344 20 0 BEADLO CC(C)=CC(=O)N1CC(C)(C)[C@@H]1c1[nH+]ccn1C ZINC000296011183 188394221 /nfs/dbraw/zinc/39/42/21/188394221.db2.gz WHHVDXDADAYIMJ-LBPRGKRZSA-N 1 2 247.342 2.296 20 0 BEADLO COC1(C)C[NH+](Cc2cc3cccnc3o2)C1 ZINC000334511140 353496143 /nfs/dbraw/zinc/49/61/43/353496143.db2.gz LCOQLXLHVPARDD-UHFFFAOYSA-N 1 2 232.283 2.049 20 0 BEADLO C[C@H](C[NH2+]Cc1c[nH]nn1)C1CCCCC1 ZINC000398416585 363235993 /nfs/dbraw/zinc/23/59/93/363235993.db2.gz SQWCIUJQALYCJP-SNVBAGLBSA-N 1 2 222.336 2.111 20 0 BEADLO C[C@H](C[NH2+]Cc1cn[nH]n1)C1CCCCC1 ZINC000398416585 363235998 /nfs/dbraw/zinc/23/59/98/363235998.db2.gz SQWCIUJQALYCJP-SNVBAGLBSA-N 1 2 222.336 2.111 20 0 BEADLO Cc1cnc(C[NH2+]C[C@@H]2CCCCN2C2CC2)o1 ZINC000639108352 353649176 /nfs/dbraw/zinc/64/91/76/353649176.db2.gz XWZXIDHMCVFDIL-ZDUSSCGKSA-N 1 2 249.358 2.090 20 0 BEADLO Cc1c[nH+]c(C)nc1N1C[C@@H](C)OC2(CCC2)C1 ZINC000577887533 366098785 /nfs/dbraw/zinc/09/87/85/366098785.db2.gz UZRQFYOJGKJZPY-LLVKDONJSA-N 1 2 247.342 2.241 20 0 BEADLO C[C@H]([NH2+]Cc1c[nH]nn1)[C@H]1CC2CCC1CC2 ZINC000398472242 363250632 /nfs/dbraw/zinc/25/06/32/363250632.db2.gz XOOMLSMTHYOKMK-HHISKICNSA-N 1 2 234.347 2.109 20 0 BEADLO C[C@H]([NH2+]Cc1cn[nH]n1)[C@H]1CC2CCC1CC2 ZINC000398472242 363250633 /nfs/dbraw/zinc/25/06/33/363250633.db2.gz XOOMLSMTHYOKMK-HHISKICNSA-N 1 2 234.347 2.109 20 0 BEADLO Fc1cccc2c1CN(CCn1cc[nH+]c1)C2 ZINC000335159299 181006856 /nfs/dbraw/zinc/00/68/56/181006856.db2.gz YXLVCSZJHVFVTQ-UHFFFAOYSA-N 1 2 231.274 2.038 20 0 BEADLO Fc1cccc2c1C[N@H+](CCn1ccnc1)C2 ZINC000335159299 181006859 /nfs/dbraw/zinc/00/68/59/181006859.db2.gz YXLVCSZJHVFVTQ-UHFFFAOYSA-N 1 2 231.274 2.038 20 0 BEADLO Fc1cccc2c1C[N@@H+](CCn1ccnc1)C2 ZINC000335159299 181006862 /nfs/dbraw/zinc/00/68/62/181006862.db2.gz YXLVCSZJHVFVTQ-UHFFFAOYSA-N 1 2 231.274 2.038 20 0 BEADLO CC(C)(C)[C@H]1C[N@H+](Cc2ccns2)CCO1 ZINC000639120331 353767580 /nfs/dbraw/zinc/76/75/80/353767580.db2.gz VVAJYFHBJXSFER-LLVKDONJSA-N 1 2 240.372 2.390 20 0 BEADLO CC(C)(C)[C@H]1C[N@@H+](Cc2ccns2)CCO1 ZINC000639120331 353767585 /nfs/dbraw/zinc/76/75/85/353767585.db2.gz VVAJYFHBJXSFER-LLVKDONJSA-N 1 2 240.372 2.390 20 0 BEADLO Cc1[nH+]c2cc(NC(=O)[C@H]3C[C@H]3C)ccc2n1C ZINC000608248454 353770311 /nfs/dbraw/zinc/77/03/11/353770311.db2.gz NYEHWNNMUYKSBM-KCJUWKMLSA-N 1 2 243.310 2.476 20 0 BEADLO Cc1csc(C[NH2+]Cc2c(C)noc2C)n1 ZINC000037988481 358480823 /nfs/dbraw/zinc/48/08/23/358480823.db2.gz VDVWQRZINXJXST-UHFFFAOYSA-N 1 2 237.328 2.346 20 0 BEADLO Fc1ccccc1C1([NH2+]Cc2cc[nH]n2)CC1 ZINC000130530329 181010752 /nfs/dbraw/zinc/01/07/52/181010752.db2.gz KTDVFHAIEYPKIM-UHFFFAOYSA-N 1 2 231.274 2.328 20 0 BEADLO CCc1nc(C[NH2+]Cc2[nH]ncc2C)cs1 ZINC000336783267 353745746 /nfs/dbraw/zinc/74/57/46/353745746.db2.gz ZYCQZBBGMGBEPR-UHFFFAOYSA-N 1 2 236.344 2.027 20 0 BEADLO CCc1nc(C[NH2+]Cc2n[nH]cc2C)cs1 ZINC000336783267 353745748 /nfs/dbraw/zinc/74/57/48/353745748.db2.gz ZYCQZBBGMGBEPR-UHFFFAOYSA-N 1 2 236.344 2.027 20 0 BEADLO C[C@]1(O)CCC[N@H+](Cc2csc(Cl)n2)C1 ZINC000296419317 353824581 /nfs/dbraw/zinc/82/45/81/353824581.db2.gz XHXUMPQPXQDTOQ-JTQLQIEISA-N 1 2 246.763 2.143 20 0 BEADLO C[C@]1(O)CCC[N@@H+](Cc2csc(Cl)n2)C1 ZINC000296419317 353824586 /nfs/dbraw/zinc/82/45/86/353824586.db2.gz XHXUMPQPXQDTOQ-JTQLQIEISA-N 1 2 246.763 2.143 20 0 BEADLO Cn1cc[nH+]c1[C@@H](NC1(C(F)F)CC1)C1CC1 ZINC000639140447 353849036 /nfs/dbraw/zinc/84/90/36/353849036.db2.gz XQSDWRAYTHSORQ-VIFPVBQESA-N 1 2 241.285 2.259 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2CCSC[C@@H](C)C2)no1 ZINC000334534802 353914749 /nfs/dbraw/zinc/91/47/49/353914749.db2.gz GISRIPNZNNIXRQ-IUCAKERBSA-N 1 2 241.360 2.124 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2CCSC[C@@H](C)C2)no1 ZINC000334534802 353914750 /nfs/dbraw/zinc/91/47/50/353914750.db2.gz GISRIPNZNNIXRQ-IUCAKERBSA-N 1 2 241.360 2.124 20 0 BEADLO CC/C=C\CC[N@H+](C)Cc1noc(C)n1 ZINC000343618618 353946434 /nfs/dbraw/zinc/94/64/34/353946434.db2.gz TZZRJSOUNMVPDJ-WAYWQWQTSA-N 1 2 209.293 2.166 20 0 BEADLO CC/C=C\CC[N@@H+](C)Cc1noc(C)n1 ZINC000343618618 353946438 /nfs/dbraw/zinc/94/64/38/353946438.db2.gz TZZRJSOUNMVPDJ-WAYWQWQTSA-N 1 2 209.293 2.166 20 0 BEADLO c1cc(N2CCC[C@@]23CCOC3)nc(C2CC2)[nH+]1 ZINC000343706708 353967723 /nfs/dbraw/zinc/96/77/23/353967723.db2.gz KRTGVJLUXBJQGU-AWEZNQCLSA-N 1 2 245.326 2.113 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CCc3ccsc3C2)[nH]1 ZINC000334553679 353997062 /nfs/dbraw/zinc/99/70/62/353997062.db2.gz JFUUJDSWNNLWKZ-QMMMGPOBSA-N 1 2 248.355 2.294 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CCc3ccsc3C2)[nH]1 ZINC000334553679 353997064 /nfs/dbraw/zinc/99/70/64/353997064.db2.gz JFUUJDSWNNLWKZ-QMMMGPOBSA-N 1 2 248.355 2.294 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccc3c(c2)COC3)no1 ZINC000343732231 353988911 /nfs/dbraw/zinc/98/89/11/353988911.db2.gz GJNPQUITSRBVOU-UHFFFAOYSA-N 1 2 244.294 2.303 20 0 BEADLO CC1=C[C@H](C)C[N@H+](Cc2noc(C3CC3)n2)C1 ZINC000334551850 353992496 /nfs/dbraw/zinc/99/24/96/353992496.db2.gz YTVDNMLWABHZDA-VIFPVBQESA-N 1 2 233.315 2.345 20 0 BEADLO CC1=C[C@H](C)C[N@@H+](Cc2noc(C3CC3)n2)C1 ZINC000334551850 353992499 /nfs/dbraw/zinc/99/24/99/353992499.db2.gz YTVDNMLWABHZDA-VIFPVBQESA-N 1 2 233.315 2.345 20 0 BEADLO Cc1cc(CNc2c[nH+]ccc2C)no1 ZINC000334555054 353999297 /nfs/dbraw/zinc/99/92/97/353999297.db2.gz ANSMGAZMZAOWDT-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO Fc1cccc2c1CC[N@H+](Cc1cnccn1)C2 ZINC000334558063 354006102 /nfs/dbraw/zinc/00/61/02/354006102.db2.gz JRKZIVIEDQAXNN-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1cccc2c1CC[N@@H+](Cc1cnccn1)C2 ZINC000334558063 354006106 /nfs/dbraw/zinc/00/61/06/354006106.db2.gz JRKZIVIEDQAXNN-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO CC[C@]1(C)C[C@H]1C(=O)NC[C@H](C)Cn1cc[nH+]c1 ZINC000343784762 354018528 /nfs/dbraw/zinc/01/85/28/354018528.db2.gz VDALKTPTYIIOEH-SGMGOOAPSA-N 1 2 249.358 2.072 20 0 BEADLO Cc1nc2[nH]ccc2c(NCC[C@H]2CCOC2)[nH+]1 ZINC000343859071 354024302 /nfs/dbraw/zinc/02/43/02/354024302.db2.gz FDZDMJGCVWMMEF-JTQLQIEISA-N 1 2 246.314 2.056 20 0 BEADLO CC(C)CCC[N@@H+]1CCOCC(F)(F)C1 ZINC000344074843 354133504 /nfs/dbraw/zinc/13/35/04/354133504.db2.gz RDQQFWBSAPGDGR-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO CC(C)CCC[N@H+]1CCOCC(F)(F)C1 ZINC000344074843 354133505 /nfs/dbraw/zinc/13/35/05/354133505.db2.gz RDQQFWBSAPGDGR-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO Cc1cc(N2CC(C(C)(C)C)C2)nc[nH+]1 ZINC000334576112 354108268 /nfs/dbraw/zinc/10/82/68/354108268.db2.gz JNZKMAMKVOPPNU-UHFFFAOYSA-N 1 2 205.305 2.267 20 0 BEADLO CC(C)(C)c1nnc(C[N@@H+]2CCC3(CCC3)C2)[nH]1 ZINC000334578471 354123353 /nfs/dbraw/zinc/12/33/53/354123353.db2.gz JOILBBWRMQBJMX-UHFFFAOYSA-N 1 2 248.374 2.478 20 0 BEADLO CC(C)(C)c1nnc(C[N@H+]2CCC3(CCC3)C2)[nH]1 ZINC000334578471 354123356 /nfs/dbraw/zinc/12/33/56/354123356.db2.gz JOILBBWRMQBJMX-UHFFFAOYSA-N 1 2 248.374 2.478 20 0 BEADLO COc1cc[nH+]cc1CSc1cccnn1 ZINC000344175004 354173065 /nfs/dbraw/zinc/17/30/65/354173065.db2.gz SBTXJHAQTIZSNR-UHFFFAOYSA-N 1 2 233.296 2.173 20 0 BEADLO Cc1ccc(F)c(NC(=O)CCc2[nH]cc[nH+]2)c1 ZINC000344202649 354162317 /nfs/dbraw/zinc/16/23/17/354162317.db2.gz WSGZPPUGXYSLKF-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO O=C(NCC1CC1)c1cccc(-n2cc[nH+]c2)c1 ZINC000344301750 354213678 /nfs/dbraw/zinc/21/36/78/354213678.db2.gz VCOVMIDRPKVOCS-UHFFFAOYSA-N 1 2 241.294 2.012 20 0 BEADLO FC1CN(Cc2cn3cc(Cl)ccc3[nH+]2)C1 ZINC000334587945 354214143 /nfs/dbraw/zinc/21/41/43/354214143.db2.gz CKFTVJJZPKDENQ-UHFFFAOYSA-N 1 2 239.681 2.141 20 0 BEADLO CC(C)c1[nH]cc(CNc2ncc(F)cn2)[nH+]1 ZINC001640458684 1172172516 /nfs/dbraw/zinc/17/25/16/1172172516.db2.gz GLRDXZXEULAMKO-UHFFFAOYSA-N 1 2 235.266 2.074 20 0 BEADLO CC(C)c1[nH]c(CNc2ncc(F)cn2)c[nH+]1 ZINC001640458684 1172172519 /nfs/dbraw/zinc/17/25/19/1172172519.db2.gz GLRDXZXEULAMKO-UHFFFAOYSA-N 1 2 235.266 2.074 20 0 BEADLO CCc1[nH+]c(C)ccc1OCC[C@H](C)O ZINC000232204105 363365366 /nfs/dbraw/zinc/36/53/66/363365366.db2.gz RYACIYMUYBKWLE-JTQLQIEISA-N 1 2 209.289 2.102 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)C(C)(C)C2CC2)c2[nH+]ccn21 ZINC000334611021 354294517 /nfs/dbraw/zinc/29/45/17/354294517.db2.gz HYVQSCCHXVAJAN-GXSJLCMTSA-N 1 2 247.342 2.441 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N3CCC[C@@H]3C)ccn12 ZINC000577962388 366145970 /nfs/dbraw/zinc/14/59/70/366145970.db2.gz SJFOANKGYJPLKE-JTQLQIEISA-N 1 2 243.310 2.267 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N3CCC[C@H]3C)ccn12 ZINC000577962389 366146301 /nfs/dbraw/zinc/14/63/01/366146301.db2.gz SJFOANKGYJPLKE-SNVBAGLBSA-N 1 2 243.310 2.267 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+]1CCS[C@@H](C)CC1 ZINC000334620366 354357321 /nfs/dbraw/zinc/35/73/21/354357321.db2.gz QKTOFYPJKWJVMH-IUCAKERBSA-N 1 2 243.401 2.427 20 0 BEADLO C[C@@H](c1csnn1)[N@H+]1CCS[C@@H](C)CC1 ZINC000334620366 354357324 /nfs/dbraw/zinc/35/73/24/354357324.db2.gz QKTOFYPJKWJVMH-IUCAKERBSA-N 1 2 243.401 2.427 20 0 BEADLO CC[C@@H]([NH2+]Cc1cn[nH]c1C)c1ccncc1 ZINC000344548394 354314956 /nfs/dbraw/zinc/31/49/56/354314956.db2.gz IPVDQOGCVOCHSQ-CYBMUJFWSA-N 1 2 230.315 2.354 20 0 BEADLO CC(C)c1nnc(C[NH2+]Cc2ccncc2)s1 ZINC000344640880 354319972 /nfs/dbraw/zinc/31/99/72/354319972.db2.gz NUAJRHATYJFRHV-UHFFFAOYSA-N 1 2 248.355 2.346 20 0 BEADLO Fc1ccc(F)c(C[NH2+]Cc2ccon2)c1 ZINC000086452671 491061775 /nfs/dbraw/zinc/06/17/75/491061775.db2.gz MKSMADZEVSZYII-UHFFFAOYSA-N 1 2 224.210 2.243 20 0 BEADLO CC(C)c1nnc(C[NH2+]Cc2ccccn2)s1 ZINC000344683902 354333587 /nfs/dbraw/zinc/33/35/87/354333587.db2.gz ONRZWLVEIBSYGO-UHFFFAOYSA-N 1 2 248.355 2.346 20 0 BEADLO Cn1cc([C@@H]([NH2+]Cc2c[nH]cn2)C(C)(C)C)cn1 ZINC000344802781 354378101 /nfs/dbraw/zinc/37/81/01/354378101.db2.gz DZTWEJXMQGEUGF-GFCCVEGCSA-N 1 2 247.346 2.020 20 0 BEADLO C[C@@H](Nc1ccc(-n2cc[nH+]c2)cc1)[C@H](C)O ZINC000578007342 366176202 /nfs/dbraw/zinc/17/62/02/366176202.db2.gz LZAQZLSDDZGBON-MNOVXSKESA-N 1 2 231.299 2.054 20 0 BEADLO C[C@H]1CCC[C@]1(C)C(=O)N1CCn2cc[nH+]c2C1 ZINC000334667043 354406117 /nfs/dbraw/zinc/40/61/17/354406117.db2.gz WMYPVLHNKNRAFY-FZMZJTMJSA-N 1 2 247.342 2.052 20 0 BEADLO CCn1ccnc1C[N@@H+]1CCC(F)(F)[C@H](C)C1 ZINC000334669023 354409127 /nfs/dbraw/zinc/40/91/27/354409127.db2.gz OUFMVLPXFCDMPG-SNVBAGLBSA-N 1 2 243.301 2.380 20 0 BEADLO CCn1ccnc1C[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000334669023 354409129 /nfs/dbraw/zinc/40/91/29/354409129.db2.gz OUFMVLPXFCDMPG-SNVBAGLBSA-N 1 2 243.301 2.380 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CCC(F)(F)[C@H](C)C2)o1 ZINC000334669787 354410811 /nfs/dbraw/zinc/41/08/11/354410811.db2.gz WWAWCLKMGAQFPK-SFYZADRCSA-N 1 2 245.273 2.416 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CCC(F)(F)[C@H](C)C2)o1 ZINC000334669787 354410814 /nfs/dbraw/zinc/41/08/14/354410814.db2.gz WWAWCLKMGAQFPK-SFYZADRCSA-N 1 2 245.273 2.416 20 0 BEADLO CC(C)n1ncnc1C[N@@H+]1CC(C)(C)[C@@H]1C1CC1 ZINC000639190099 354410842 /nfs/dbraw/zinc/41/08/42/354410842.db2.gz KVEFTDJYDMGYCD-ZDUSSCGKSA-N 1 2 248.374 2.479 20 0 BEADLO CC(C)n1ncnc1C[N@H+]1CC(C)(C)[C@@H]1C1CC1 ZINC000639190099 354410845 /nfs/dbraw/zinc/41/08/45/354410845.db2.gz KVEFTDJYDMGYCD-ZDUSSCGKSA-N 1 2 248.374 2.479 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+]1CCCC2(CC2)C1 ZINC000334674049 354417107 /nfs/dbraw/zinc/41/71/07/354417107.db2.gz CNYPDEZPRDDUAS-VIFPVBQESA-N 1 2 223.345 2.475 20 0 BEADLO C[C@@H](c1csnn1)[N@H+]1CCCC2(CC2)C1 ZINC000334674049 354417109 /nfs/dbraw/zinc/41/71/09/354417109.db2.gz CNYPDEZPRDDUAS-VIFPVBQESA-N 1 2 223.345 2.475 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCSC[C@@H]1C1CC1 ZINC000334679666 354425202 /nfs/dbraw/zinc/42/52/02/354425202.db2.gz UDTOBZRRVQIKCD-GFCCVEGCSA-N 1 2 237.372 2.046 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCSC[C@@H]1C1CC1 ZINC000334679666 354425205 /nfs/dbraw/zinc/42/52/05/354425205.db2.gz UDTOBZRRVQIKCD-GFCCVEGCSA-N 1 2 237.372 2.046 20 0 BEADLO O=C(Nc1c[nH+]c2n1CCCC2)C1CC=CC1 ZINC000334651844 354444498 /nfs/dbraw/zinc/44/44/98/354444498.db2.gz FPTAMUMYOYGVIR-UHFFFAOYSA-N 1 2 231.299 2.124 20 0 BEADLO CC(C)[C@H](C)C(=O)Nc1c[nH+]c2n1CCCC2 ZINC000334653175 354446666 /nfs/dbraw/zinc/44/66/66/354446666.db2.gz LESZOKIMFAGCAH-JTQLQIEISA-N 1 2 235.331 2.450 20 0 BEADLO Cc1[nH]ccc1C(=O)Nc1c[nH+]c2n1CCCC2 ZINC000334653399 354446816 /nfs/dbraw/zinc/44/68/16/354446816.db2.gz PPOQMMDOLTUXIC-UHFFFAOYSA-N 1 2 244.298 2.108 20 0 BEADLO CC1=CC[N@H+]([C@H](C)c2csnn2)CC1 ZINC000334654652 354448029 /nfs/dbraw/zinc/44/80/29/354448029.db2.gz QQUVBAGGHXKEIL-SECBINFHSA-N 1 2 209.318 2.251 20 0 BEADLO CC1=CC[N@@H+]([C@H](C)c2csnn2)CC1 ZINC000334654652 354448031 /nfs/dbraw/zinc/44/80/31/354448031.db2.gz QQUVBAGGHXKEIL-SECBINFHSA-N 1 2 209.318 2.251 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1nnc(C(C)(C)C)[nH]1 ZINC000334659320 354455992 /nfs/dbraw/zinc/45/59/92/354455992.db2.gz ITTQXKSVXKWUQS-DTORHVGOSA-N 1 2 222.336 2.085 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1nnc(C(C)(C)C)[nH]1 ZINC000334659320 354455993 /nfs/dbraw/zinc/45/59/93/354455993.db2.gz ITTQXKSVXKWUQS-DTORHVGOSA-N 1 2 222.336 2.085 20 0 BEADLO Cc1cc(CN2CCn3cc[nH+]c3C2)cs1 ZINC000334661978 354461505 /nfs/dbraw/zinc/46/15/05/354461505.db2.gz KKDYSCVYIJTGRX-UHFFFAOYSA-N 1 2 233.340 2.269 20 0 BEADLO Cn1c[nH+]cc1Cc1nc(CC2CCCC2)no1 ZINC000349714683 366219533 /nfs/dbraw/zinc/21/95/33/366219533.db2.gz STRKDDSCVXYZHC-UHFFFAOYSA-N 1 2 246.314 2.127 20 0 BEADLO C[C@H]1C[C@@H]1CC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000334731045 354531133 /nfs/dbraw/zinc/53/11/33/354531133.db2.gz KQLVLECBNQEZQP-VHSXEESVSA-N 1 2 229.283 2.319 20 0 BEADLO Cc1[nH]c(C(=O)NC(C)(C)C2CCC2)c[nH+]1 ZINC000334736823 354538515 /nfs/dbraw/zinc/53/85/15/354538515.db2.gz QIVAPCYSRVSEKO-UHFFFAOYSA-N 1 2 221.304 2.027 20 0 BEADLO Cc1cc(N[C@H]2CC[C@H](F)C2)nc(C2CC2)[nH+]1 ZINC000334739064 354542083 /nfs/dbraw/zinc/54/20/83/354542083.db2.gz LATNACPYPVIYJK-QWRGUYRKSA-N 1 2 235.306 2.387 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)c2ccsc2)c2[nH+]ccn21 ZINC000334740218 354543674 /nfs/dbraw/zinc/54/36/74/354543674.db2.gz HWPFPBOZWQMZMI-SCZZXKLOSA-N 1 2 247.323 2.380 20 0 BEADLO Cc1cc(CNc2ccc(C)[nH+]c2)no1 ZINC000334721634 354521532 /nfs/dbraw/zinc/52/15/32/354521532.db2.gz LCHKCUIMXIGZBV-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO CC1(C)CC=C(C(=O)NCc2[nH]cc[nH+]2)CC1 ZINC000334723091 354523318 /nfs/dbraw/zinc/52/33/18/354523318.db2.gz GBDWZSVANIHBBC-UHFFFAOYSA-N 1 2 233.315 2.162 20 0 BEADLO CC(C)c1nc(N[C@H]2CS[C@@H](C)C2)cc[nH+]1 ZINC000334802716 354559005 /nfs/dbraw/zinc/55/90/05/354559005.db2.gz ADHAQDPTQKKAKU-VHSXEESVSA-N 1 2 237.372 2.328 20 0 BEADLO C[C@H]1C[C@H](Nc2cc[nH+]c3ccncc23)CS1 ZINC000334805568 354561927 /nfs/dbraw/zinc/56/19/27/354561927.db2.gz KTKGZXSVFWBZGG-UWVGGRQHSA-N 1 2 245.351 2.358 20 0 BEADLO FC1(F)CN(c2cccc[nH+]2)CC1(F)F ZINC000334805234 354562006 /nfs/dbraw/zinc/56/20/06/354562006.db2.gz XEEGCWSMDZAJJE-UHFFFAOYSA-N 1 2 220.169 2.172 20 0 BEADLO CCc1noc(C)c1C[N@@H+]1CC[C@H](F)C1 ZINC000334811523 354569212 /nfs/dbraw/zinc/56/92/12/354569212.db2.gz NBDAHAYTPQLXPT-VIFPVBQESA-N 1 2 212.268 2.089 20 0 BEADLO CCc1noc(C)c1C[N@H+]1CC[C@H](F)C1 ZINC000334811523 354569216 /nfs/dbraw/zinc/56/92/16/354569216.db2.gz NBDAHAYTPQLXPT-VIFPVBQESA-N 1 2 212.268 2.089 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CC[C@@H](F)C1 ZINC000334813380 354570788 /nfs/dbraw/zinc/57/07/88/354570788.db2.gz RPKKXXHNRJYYLE-SNVBAGLBSA-N 1 2 211.284 2.008 20 0 BEADLO C[C@H]1CC[N@H+](CCC2(O)CCC2)CC1(F)F ZINC000334813669 354571045 /nfs/dbraw/zinc/57/10/45/354571045.db2.gz YMLHDHDEQCQBOE-JTQLQIEISA-N 1 2 233.302 2.269 20 0 BEADLO C[C@H]1CC[N@@H+](CCC2(O)CCC2)CC1(F)F ZINC000334813669 354571047 /nfs/dbraw/zinc/57/10/47/354571047.db2.gz YMLHDHDEQCQBOE-JTQLQIEISA-N 1 2 233.302 2.269 20 0 BEADLO Cc1ccnc(C[NH+]2C[C@@H](C)S[C@H](C)C2)n1 ZINC000334754368 354575613 /nfs/dbraw/zinc/57/56/13/354575613.db2.gz HGNOQTROQQZACG-GHMZBOCLSA-N 1 2 237.372 2.111 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@]1(C)CCCC[C@@H]1C ZINC000334762576 354583084 /nfs/dbraw/zinc/58/30/84/354583084.db2.gz XEVNHKVZDQQQBA-IINYFYTJSA-N 1 2 249.358 2.346 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@]1(C)CCCC[C@@H]1C ZINC000334762576 354583087 /nfs/dbraw/zinc/58/30/87/354583087.db2.gz XEVNHKVZDQQQBA-IINYFYTJSA-N 1 2 249.358 2.346 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)C2CC(C)(C)C2)c2[nH+]ccn21 ZINC000334768317 354589641 /nfs/dbraw/zinc/58/96/41/354589641.db2.gz JJVNGWZUOAIOEI-KOLCDFICSA-N 1 2 247.342 2.441 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2ccncc2F)C1 ZINC000334767988 354589779 /nfs/dbraw/zinc/58/97/79/354589779.db2.gz ABUUCGUYLIFRSO-NSHDSACASA-N 1 2 212.243 2.155 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2ccncc2F)C1 ZINC000334767988 354589783 /nfs/dbraw/zinc/58/97/83/354589783.db2.gz ABUUCGUYLIFRSO-NSHDSACASA-N 1 2 212.243 2.155 20 0 BEADLO CC1(C)CC[N@H+](Cc2nc(C(F)F)no2)C1 ZINC000335097076 354636565 /nfs/dbraw/zinc/63/65/65/354636565.db2.gz JGMMUZQZHOXNOD-UHFFFAOYSA-N 1 2 231.246 2.239 20 0 BEADLO CC1(C)CC[N@@H+](Cc2nc(C(F)F)no2)C1 ZINC000335097076 354636568 /nfs/dbraw/zinc/63/65/68/354636568.db2.gz JGMMUZQZHOXNOD-UHFFFAOYSA-N 1 2 231.246 2.239 20 0 BEADLO Cc1ccsc1C[N@@H+]1CC[S@@](=O)[C@@H](C)C1 ZINC000335085426 354618682 /nfs/dbraw/zinc/61/86/82/354618682.db2.gz LCAKKYAHMNJFBI-ZUZCIYMTSA-N 1 2 243.397 2.009 20 0 BEADLO Cc1ccsc1C[N@H+]1CC[S@@](=O)[C@@H](C)C1 ZINC000335085426 354618683 /nfs/dbraw/zinc/61/86/83/354618683.db2.gz LCAKKYAHMNJFBI-ZUZCIYMTSA-N 1 2 243.397 2.009 20 0 BEADLO CC(C)n1cncc1C[N@@H+]1CC[C@@](C)(F)C1 ZINC000335085768 354619404 /nfs/dbraw/zinc/61/94/04/354619404.db2.gz NKHXKJCOWRSICY-GFCCVEGCSA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1cncc1C[N@H+]1CC[C@@](C)(F)C1 ZINC000335085768 354619405 /nfs/dbraw/zinc/61/94/05/354619405.db2.gz NKHXKJCOWRSICY-GFCCVEGCSA-N 1 2 225.311 2.398 20 0 BEADLO Cc1cc(C[NH+]2CC(n3ccnn3)C2)c(C)s1 ZINC000335107472 354692716 /nfs/dbraw/zinc/69/27/16/354692716.db2.gz DTCZBCFFWPXSNE-UHFFFAOYSA-N 1 2 248.355 2.013 20 0 BEADLO C[C@@H]1C[C@@H](C)C[NH+](Cc2nc(C(F)F)no2)C1 ZINC000335100277 354708928 /nfs/dbraw/zinc/70/89/28/354708928.db2.gz NNIXNLIIZBYXQD-HTQZYQBOSA-N 1 2 245.273 2.485 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nc(C(F)F)no2)[C@@H]1C ZINC000335100386 354709066 /nfs/dbraw/zinc/70/90/66/354709066.db2.gz SLVWBUFCTZFBSW-RNFRBKRXSA-N 1 2 231.246 2.238 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nc(C(F)F)no2)[C@@H]1C ZINC000335100386 354709070 /nfs/dbraw/zinc/70/90/70/354709070.db2.gz SLVWBUFCTZFBSW-RNFRBKRXSA-N 1 2 231.246 2.238 20 0 BEADLO CC(C)n1cncc1C[N@@H+]1CC[C@@H](F)C1 ZINC000335101555 354711965 /nfs/dbraw/zinc/71/19/65/354711965.db2.gz TWWVVKLIITXLIJ-SNVBAGLBSA-N 1 2 211.284 2.008 20 0 BEADLO CC(C)n1cncc1C[N@H+]1CC[C@@H](F)C1 ZINC000335101555 354711967 /nfs/dbraw/zinc/71/19/67/354711967.db2.gz TWWVVKLIITXLIJ-SNVBAGLBSA-N 1 2 211.284 2.008 20 0 BEADLO CCCN(CC1CC1)C(=O)C(C)(C)c1c[nH+]c[nH]1 ZINC000345632948 354719391 /nfs/dbraw/zinc/71/93/91/354719391.db2.gz CJNHGFMKCUEGTA-UHFFFAOYSA-N 1 2 249.358 2.336 20 0 BEADLO COc1cc[nH+]cc1NC(=O)CC1(C)CC1 ZINC000345743357 354749559 /nfs/dbraw/zinc/74/95/59/354749559.db2.gz PWIZLZDKBFPOMU-UHFFFAOYSA-N 1 2 220.272 2.219 20 0 BEADLO C[C@H]1CC[C@H](CC(=O)N(C)Cc2[nH]cc[nH+]2)C1 ZINC000345659563 354739536 /nfs/dbraw/zinc/73/95/36/354739536.db2.gz YPFRLPHXFSYCFH-QWRGUYRKSA-N 1 2 235.331 2.194 20 0 BEADLO CC(C)[C@H](C)CNc1nc[nH+]c(N)c1Cl ZINC000232726092 363382787 /nfs/dbraw/zinc/38/27/87/363382787.db2.gz PSPFKAGGAYNNKW-SSDOTTSWSA-N 1 2 228.727 2.416 20 0 BEADLO CC(C)[C@H](C)CNc1[nH+]cnc(N)c1Cl ZINC000232726092 363382793 /nfs/dbraw/zinc/38/27/93/363382793.db2.gz PSPFKAGGAYNNKW-SSDOTTSWSA-N 1 2 228.727 2.416 20 0 BEADLO CCC(=O)CCC[N@H+](C)Cc1cscn1 ZINC000232842280 363385646 /nfs/dbraw/zinc/38/56/46/363385646.db2.gz BWCSRFMNUNSTPW-UHFFFAOYSA-N 1 2 226.345 2.334 20 0 BEADLO CCC(=O)CCC[N@@H+](C)Cc1cscn1 ZINC000232842280 363385653 /nfs/dbraw/zinc/38/56/53/363385653.db2.gz BWCSRFMNUNSTPW-UHFFFAOYSA-N 1 2 226.345 2.334 20 0 BEADLO CC(C)Cn1cc[nH+]c1CNC(=O)CC1(C)CC1 ZINC000346026202 354828987 /nfs/dbraw/zinc/82/89/87/354828987.db2.gz CQMWZDBVTFPYGI-UHFFFAOYSA-N 1 2 249.358 2.346 20 0 BEADLO CC(C)c1nc(C[NH+]2CCC(C)CC2)no1 ZINC000053602488 363418208 /nfs/dbraw/zinc/41/82/08/363418208.db2.gz HLFAWIUYQQCUOK-UHFFFAOYSA-N 1 2 223.320 2.425 20 0 BEADLO Cc1cc(N2CCC[C@@H]2C2CCOCC2)nc[nH+]1 ZINC000346255301 354881497 /nfs/dbraw/zinc/88/14/97/354881497.db2.gz CJTGSJYCYLXCQL-CYBMUJFWSA-N 1 2 247.342 2.180 20 0 BEADLO CC(C)c1nc(N2C[C@H](C)OC[C@@H]2C)cc[nH+]1 ZINC000346591540 354986633 /nfs/dbraw/zinc/98/66/33/354986633.db2.gz JDRJNMJOFQAHLW-QWRGUYRKSA-N 1 2 235.331 2.214 20 0 BEADLO CC(C)n1ncc2cc(Cn3cc[nH+]c3)cnc21 ZINC000346622794 354995955 /nfs/dbraw/zinc/99/59/55/354995955.db2.gz VBDDMZQRBPZWAQ-UHFFFAOYSA-N 1 2 241.298 2.257 20 0 BEADLO Cc1nc([C@H](C)[NH2+]Cc2ccn(C)n2)cs1 ZINC000113427618 354996406 /nfs/dbraw/zinc/99/64/06/354996406.db2.gz RITBREIZEYNPKZ-QMMMGPOBSA-N 1 2 236.344 2.036 20 0 BEADLO C[C@@H]1COCC[N@@H+]1CCc1cccc(F)c1F ZINC000335205871 355041111 /nfs/dbraw/zinc/04/11/11/355041111.db2.gz IDLOVVKHWUVDGM-SNVBAGLBSA-N 1 2 241.281 2.228 20 0 BEADLO C[C@@H]1COCC[N@H+]1CCc1cccc(F)c1F ZINC000335205871 355041114 /nfs/dbraw/zinc/04/11/14/355041114.db2.gz IDLOVVKHWUVDGM-SNVBAGLBSA-N 1 2 241.281 2.228 20 0 BEADLO Cc1cc(N2CCOC(C)(C)C2)nc(C2CC2)[nH+]1 ZINC000346663651 355005605 /nfs/dbraw/zinc/00/56/05/355005605.db2.gz ASLZRQMRRHLTTO-UHFFFAOYSA-N 1 2 247.342 2.278 20 0 BEADLO Cc1cccc(C[N@@H+]2CCC[C@@H]2c2ncc[nH]2)n1 ZINC000335189539 355021651 /nfs/dbraw/zinc/02/16/51/355021651.db2.gz CLHJTALFPWIAGX-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc(C[N@H+]2CCC[C@@H]2c2ncc[nH]2)n1 ZINC000335189539 355021655 /nfs/dbraw/zinc/02/16/55/355021655.db2.gz CLHJTALFPWIAGX-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CCC[C@@H](F)C2)cc[nH+]1 ZINC000335228064 355069926 /nfs/dbraw/zinc/06/99/26/355069926.db2.gz ANXFTZKDCWDYLF-WDEREUQCSA-N 1 2 236.290 2.279 20 0 BEADLO CC[C@]1(C)COCC[N@@H+]1Cc1nccs1 ZINC000335183437 355082086 /nfs/dbraw/zinc/08/20/86/355082086.db2.gz UCQXTZPPENIVAJ-LLVKDONJSA-N 1 2 226.345 2.144 20 0 BEADLO CC[C@]1(C)COCC[N@H+]1Cc1nccs1 ZINC000335183437 355082089 /nfs/dbraw/zinc/08/20/89/355082089.db2.gz UCQXTZPPENIVAJ-LLVKDONJSA-N 1 2 226.345 2.144 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CCCCC2)[nH+]1 ZINC000335231480 355091605 /nfs/dbraw/zinc/09/16/05/355091605.db2.gz QGOVLTYDBJSIOM-UHFFFAOYSA-N 1 2 216.288 2.257 20 0 BEADLO C[C@H](C1CC1)N(C)C(=O)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000335234829 355095250 /nfs/dbraw/zinc/09/52/50/355095250.db2.gz LSCHUVRZKAMZSI-KOLCDFICSA-N 1 2 247.342 2.087 20 0 BEADLO CCC1(C)CN(C(=O)[C@H]2CCCc3[nH+]c[nH]c32)C1 ZINC000335237525 355099288 /nfs/dbraw/zinc/09/92/88/355099288.db2.gz GVXIJEVRHPUXCD-JTQLQIEISA-N 1 2 247.342 2.088 20 0 BEADLO COc1cc(CNc2cc(C)[nH+]cn2)ccc1C ZINC000346946423 355161216 /nfs/dbraw/zinc/16/12/16/355161216.db2.gz NLVRQWSEYUMURT-UHFFFAOYSA-N 1 2 243.310 2.136 20 0 BEADLO Cc1cc(N[C@H](C)COCC(F)(F)F)nc[nH+]1 ZINC000346946891 355161640 /nfs/dbraw/zinc/16/16/40/355161640.db2.gz VYEVCVITCWNVMF-MRVPVSSYSA-N 1 2 249.236 2.164 20 0 BEADLO C[C@@H](c1nncn1C)[N@H+](C)Cc1ccc(F)cc1 ZINC000346850856 355137814 /nfs/dbraw/zinc/13/78/14/355137814.db2.gz RXLXWNUPSIYSJE-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO C[C@@H](c1nncn1C)[N@@H+](C)Cc1ccc(F)cc1 ZINC000346850856 355137817 /nfs/dbraw/zinc/13/78/17/355137817.db2.gz RXLXWNUPSIYSJE-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO Fc1ccc(C[NH2+]Cc2cc[nH]n2)c(Cl)c1 ZINC000124265646 324612534 /nfs/dbraw/zinc/61/25/34/324612534.db2.gz RCHGDGIPUKCXJH-UHFFFAOYSA-N 1 2 239.681 2.492 20 0 BEADLO C[C@@H](c1cnn(C)c1)[N@H+](C)Cc1cncc(F)c1 ZINC000346969972 355175118 /nfs/dbraw/zinc/17/51/18/355175118.db2.gz QQWHCXXYVNXDQF-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO C[C@@H](c1cnn(C)c1)[N@@H+](C)Cc1cncc(F)c1 ZINC000346969972 355175121 /nfs/dbraw/zinc/17/51/21/355175121.db2.gz QQWHCXXYVNXDQF-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO Cn1cc(CNc2ccc3c(c2)CCC[NH2+]3)cn1 ZINC000335244135 355181878 /nfs/dbraw/zinc/18/18/78/355181878.db2.gz XAGGJTAZPKUHSY-UHFFFAOYSA-N 1 2 242.326 2.390 20 0 BEADLO Cc1occc1SCC[N@H+]1CCOC[C@H]1C ZINC000412997587 191333454 /nfs/dbraw/zinc/33/34/54/191333454.db2.gz HOQZOJYKSDJJQT-SNVBAGLBSA-N 1 2 241.356 2.401 20 0 BEADLO Cc1occc1SCC[N@@H+]1CCOC[C@H]1C ZINC000412997587 191333455 /nfs/dbraw/zinc/33/34/55/191333455.db2.gz HOQZOJYKSDJJQT-SNVBAGLBSA-N 1 2 241.356 2.401 20 0 BEADLO Cc1ccc(CSC[C@H](C)O)c(C)[nH+]1 ZINC000413011132 191339549 /nfs/dbraw/zinc/33/95/49/191339549.db2.gz CGCLUCGJAPVUJP-VIFPVBQESA-N 1 2 211.330 2.312 20 0 BEADLO COCC[C@H](C)CNc1cc[nH+]c(C(C)C)n1 ZINC000413491940 191389068 /nfs/dbraw/zinc/38/90/68/191389068.db2.gz KZQPKRSVWBVFJC-NSHDSACASA-N 1 2 237.347 2.106 20 0 BEADLO c1nc(N2CCC3(CCC3)C2)cc(NC2CC2)[nH+]1 ZINC000413187766 191362748 /nfs/dbraw/zinc/36/27/48/191362748.db2.gz FMLVHBPOXROLLW-UHFFFAOYSA-N 1 2 244.342 2.431 20 0 BEADLO c1nc(NC2CC2)cc(N2CCC3(CCC3)C2)[nH+]1 ZINC000413187766 191362750 /nfs/dbraw/zinc/36/27/50/191362750.db2.gz FMLVHBPOXROLLW-UHFFFAOYSA-N 1 2 244.342 2.431 20 0 BEADLO COC1([C@H](C)Nc2cc(C)[nH+]cn2)CCC1 ZINC000413555661 191397443 /nfs/dbraw/zinc/39/74/43/191397443.db2.gz CYRFDQAVKJRNCU-JTQLQIEISA-N 1 2 221.304 2.155 20 0 BEADLO F[C@H]1CCC[C@H]1Nc1cc(NC2CC2)[nH+]cn1 ZINC000413296778 191369382 /nfs/dbraw/zinc/36/93/82/191369382.db2.gz KOGAIVTUUPYNMV-VHSXEESVSA-N 1 2 236.294 2.353 20 0 BEADLO F[C@H]1CCC[C@H]1Nc1cc(NC2CC2)nc[nH+]1 ZINC000413296778 191369384 /nfs/dbraw/zinc/36/93/84/191369384.db2.gz KOGAIVTUUPYNMV-VHSXEESVSA-N 1 2 236.294 2.353 20 0 BEADLO CCO[C@H]1C[C@@H](Nc2cc(C)[nH+]c(C3CC3)n2)C1 ZINC000413385284 191378182 /nfs/dbraw/zinc/37/81/82/191378182.db2.gz HFRZZUWOKVYJOM-TXEJJXNPSA-N 1 2 247.342 2.064 20 0 BEADLO CCOC[C@H]1CCCCN1c1cc[nH+]c(C)n1 ZINC000413432503 191378828 /nfs/dbraw/zinc/37/88/28/191378828.db2.gz WLGKHEBUUDTJRU-GFCCVEGCSA-N 1 2 235.331 2.180 20 0 BEADLO CO[C@@H]1C[C@@H](Nc2cc[nH+]c(C)n2)C12CCC2 ZINC000413435300 191380364 /nfs/dbraw/zinc/38/03/64/191380364.db2.gz FNFXCIINDVGTCO-GHMZBOCLSA-N 1 2 233.315 2.155 20 0 BEADLO COc1ccc2oc(C[NH+]3CC(C)(O)C3)cc2c1 ZINC000639253834 355293004 /nfs/dbraw/zinc/29/30/04/355293004.db2.gz RVYHKHVEZBZYJD-UHFFFAOYSA-N 1 2 247.294 2.008 20 0 BEADLO COCC1(C)C[NH+](Cc2nc3ccccc3o2)C1 ZINC000639254894 355295052 /nfs/dbraw/zinc/29/50/52/355295052.db2.gz GESMWPZZQQTGLL-UHFFFAOYSA-N 1 2 246.310 2.296 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NCc1ncc(C)o1 ZINC000639247345 355277013 /nfs/dbraw/zinc/27/70/13/355277013.db2.gz JBFRZEVUMWHRBM-SNVBAGLBSA-N 1 2 234.303 2.050 20 0 BEADLO CCc1cc(NCc2nc(C)c(C)s2)nc[nH+]1 ZINC000608368999 355380966 /nfs/dbraw/zinc/38/09/66/355380966.db2.gz RYDAPUYKYOAXHF-UHFFFAOYSA-N 1 2 248.355 2.146 20 0 BEADLO c1cc(C[N@@H+]2CCOC[C@@H]2C2CCC2)sn1 ZINC000639284870 355386139 /nfs/dbraw/zinc/38/61/39/355386139.db2.gz DGLRVYXJUGCMJH-GFCCVEGCSA-N 1 2 238.356 2.144 20 0 BEADLO c1cc(C[N@H+]2CCOC[C@@H]2C2CCC2)sn1 ZINC000639284870 355386140 /nfs/dbraw/zinc/38/61/40/355386140.db2.gz DGLRVYXJUGCMJH-GFCCVEGCSA-N 1 2 238.356 2.144 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1coc(C)c1 ZINC000335779033 355405820 /nfs/dbraw/zinc/40/58/20/355405820.db2.gz GAUJLSJRTSGBFS-UHFFFAOYSA-N 1 2 230.267 2.220 20 0 BEADLO Cc1nn(C)cc1[C@@H](C)[NH2+][C@@H](C)c1ccon1 ZINC000349857041 355502135 /nfs/dbraw/zinc/50/21/35/355502135.db2.gz ITWWNASFYVXQIC-SCZZXKLOSA-N 1 2 234.303 2.128 20 0 BEADLO CC(C)c1nc(C[N@@H+]2C[C@H](C)C[C@H]2C)no1 ZINC000335805978 355476534 /nfs/dbraw/zinc/47/65/34/355476534.db2.gz JJUMMLOLOQDHHP-NXEZZACHSA-N 1 2 223.320 2.423 20 0 BEADLO CC(C)c1nc(C[N@H+]2C[C@H](C)C[C@H]2C)no1 ZINC000335805978 355476538 /nfs/dbraw/zinc/47/65/38/355476538.db2.gz JJUMMLOLOQDHHP-NXEZZACHSA-N 1 2 223.320 2.423 20 0 BEADLO Cn1nc2c(c1CNc1cccc[nH+]1)CCCC2 ZINC000335823651 355544226 /nfs/dbraw/zinc/54/42/26/355544226.db2.gz NWLPRKKJBCWAGU-UHFFFAOYSA-N 1 2 242.326 2.306 20 0 BEADLO C[NH2+]Cc1noc([C@@H](F)Cc2ccccc2)n1 ZINC000349914548 355525732 /nfs/dbraw/zinc/52/57/32/355525732.db2.gz SYVPGIOIEGTZDC-JTQLQIEISA-N 1 2 235.262 2.042 20 0 BEADLO C[NH2+]Cc1noc([C@@H](C)c2ccccc2F)n1 ZINC000349919132 355526568 /nfs/dbraw/zinc/52/65/68/355526568.db2.gz GGYYUTRNNBQLFU-QMMMGPOBSA-N 1 2 235.262 2.080 20 0 BEADLO Cc1ccncc1CN(C)c1cccc[nH+]1 ZINC000335852067 355582426 /nfs/dbraw/zinc/58/24/26/355582426.db2.gz OQMZAEUFZNGMGP-UHFFFAOYSA-N 1 2 213.284 2.421 20 0 BEADLO COCc1cc[nH+]c(NC[C@H](OC)C2CC2)c1 ZINC000639309946 355666065 /nfs/dbraw/zinc/66/60/65/355666065.db2.gz ANTSCZKLYOYJCP-LBPRGKRZSA-N 1 2 236.315 2.065 20 0 BEADLO F[C@H]1CCC[N@H+](Cc2cc(C3CC3)no2)C1 ZINC000639311835 355671975 /nfs/dbraw/zinc/67/19/75/355671975.db2.gz FDMAKFPINYSROO-JTQLQIEISA-N 1 2 224.279 2.486 20 0 BEADLO F[C@H]1CCC[N@@H+](Cc2cc(C3CC3)no2)C1 ZINC000639311835 355671977 /nfs/dbraw/zinc/67/19/77/355671977.db2.gz FDMAKFPINYSROO-JTQLQIEISA-N 1 2 224.279 2.486 20 0 BEADLO NC(=O)[C@@H]1CC[C@H](Nc2cccc[nH+]2)C1 ZINC000336254087 181204283 /nfs/dbraw/zinc/20/42/83/181204283.db2.gz MDXBEPDPHTVALV-BDAKNGLRSA-N 1 2 205.261 2.197 20 0 BEADLO Cn1ccnc1[C@@H](C1CC1)[N@@H+]1CCC[C@H](F)C1 ZINC000639313833 355693710 /nfs/dbraw/zinc/69/37/10/355693710.db2.gz ZGQCTHURFAWDFJ-NWDGAFQWSA-N 1 2 237.322 2.305 20 0 BEADLO Cn1ccnc1[C@@H](C1CC1)[N@H+]1CCC[C@H](F)C1 ZINC000639313833 355693711 /nfs/dbraw/zinc/69/37/11/355693711.db2.gz ZGQCTHURFAWDFJ-NWDGAFQWSA-N 1 2 237.322 2.305 20 0 BEADLO CCc1ncc(C[NH2+][C@H](C)c2cscn2)cn1 ZINC000582192959 355695274 /nfs/dbraw/zinc/69/52/74/355695274.db2.gz YXFXMCFBVIEFPK-SECBINFHSA-N 1 2 248.355 2.346 20 0 BEADLO COc1cncc(C[N@@H+]2CCC[C@@H](F)C2)c1C ZINC000639313280 355685607 /nfs/dbraw/zinc/68/56/07/355685607.db2.gz PGKDOYGVBTZYDF-GFCCVEGCSA-N 1 2 238.306 2.333 20 0 BEADLO COc1cncc(C[N@H+]2CCC[C@@H](F)C2)c1C ZINC000639313280 355685610 /nfs/dbraw/zinc/68/56/10/355685610.db2.gz PGKDOYGVBTZYDF-GFCCVEGCSA-N 1 2 238.306 2.333 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1ccoc1 ZINC000350654848 355737380 /nfs/dbraw/zinc/73/73/80/355737380.db2.gz HSOYKRMWULUEFU-UHFFFAOYSA-N 1 2 220.272 2.462 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1ccoc1 ZINC000350654848 355737384 /nfs/dbraw/zinc/73/73/84/355737384.db2.gz HSOYKRMWULUEFU-UHFFFAOYSA-N 1 2 220.272 2.462 20 0 BEADLO CCc1nocc1C[N@@H+]1C[C@@H](C)O[C@H](CC)C1 ZINC000350699735 355743805 /nfs/dbraw/zinc/74/38/05/355743805.db2.gz LQOGUJCWUNNCDN-ZYHUDNBSSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1nocc1C[N@H+]1C[C@@H](C)O[C@H](CC)C1 ZINC000350699735 355743806 /nfs/dbraw/zinc/74/38/06/355743806.db2.gz LQOGUJCWUNNCDN-ZYHUDNBSSA-N 1 2 238.331 2.236 20 0 BEADLO Cc1cnc(C[NH+]2CC(Cc3ccco3)C2)o1 ZINC000639348931 355789819 /nfs/dbraw/zinc/78/98/19/355789819.db2.gz GQLKXSXBXRJJRJ-UHFFFAOYSA-N 1 2 232.283 2.251 20 0 BEADLO CCc1cnc(C[N@H+](C)C[C@H]2CCCCO2)o1 ZINC000608493093 355818537 /nfs/dbraw/zinc/81/85/37/355818537.db2.gz FXSQDYSVCADPHI-GFCCVEGCSA-N 1 2 238.331 2.238 20 0 BEADLO CCc1cnc(C[N@@H+](C)C[C@H]2CCCCO2)o1 ZINC000608493093 355818540 /nfs/dbraw/zinc/81/85/40/355818540.db2.gz FXSQDYSVCADPHI-GFCCVEGCSA-N 1 2 238.331 2.238 20 0 BEADLO CCc1cnc(C[N@H+](C)C[C@@H]2CCCCO2)o1 ZINC000608493094 355818598 /nfs/dbraw/zinc/81/85/98/355818598.db2.gz FXSQDYSVCADPHI-LBPRGKRZSA-N 1 2 238.331 2.238 20 0 BEADLO CCc1cnc(C[N@@H+](C)C[C@@H]2CCCCO2)o1 ZINC000608493094 355818601 /nfs/dbraw/zinc/81/86/01/355818601.db2.gz FXSQDYSVCADPHI-LBPRGKRZSA-N 1 2 238.331 2.238 20 0 BEADLO C[C@@H](Nc1c[nH+]cc(N(C)C)c1)[C@@H]1CCCO1 ZINC000639364945 355837758 /nfs/dbraw/zinc/83/77/58/355837758.db2.gz KOPUDKQWBOLLHX-MFKMUULPSA-N 1 2 235.331 2.127 20 0 BEADLO C[C@@H](Nc1c[nH+]cc(N(C)C)c1)[C@@H]1CCCOC1 ZINC000639366503 355844639 /nfs/dbraw/zinc/84/46/39/355844639.db2.gz WTGSBPLWELUXQW-VXGBXAGGSA-N 1 2 249.358 2.375 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)C1CCCCCC1 ZINC000336043092 134062746 /nfs/dbraw/zinc/06/27/46/134062746.db2.gz LZRDUPDWTUONPJ-UHFFFAOYSA-N 1 2 249.358 2.442 20 0 BEADLO C[C@@H]1CN(c2cccc[nH+]2)C[C@@H](C(F)(F)F)O1 ZINC000608754084 355975303 /nfs/dbraw/zinc/97/53/03/355975303.db2.gz WDAQDGPQHGGPCZ-BDAKNGLRSA-N 1 2 246.232 2.238 20 0 BEADLO CCOC[C@@H]([NH2+][C@H](C)c1noc(C)n1)C(C)C ZINC000352114712 134069464 /nfs/dbraw/zinc/06/94/64/134069464.db2.gz CCPPLMMJZSJNFB-MWLCHTKSSA-N 1 2 241.335 2.090 20 0 BEADLO C/C=C\C[C@@H](CO)Nc1ccc2ccccc2[nH+]1 ZINC000351562669 356017745 /nfs/dbraw/zinc/01/77/45/356017745.db2.gz KSDCDCMUJABXSY-ZRMMWKCHSA-N 1 2 242.322 2.396 20 0 BEADLO COC(=O)[C@@H](CC(C)C)[N@@H+]1CC[C@](C)(F)C1 ZINC000351738624 356076673 /nfs/dbraw/zinc/07/66/73/356076673.db2.gz XRDIRJPVPZHTHX-PWSUYJOCSA-N 1 2 231.311 2.008 20 0 BEADLO COC(=O)[C@@H](CC(C)C)[N@H+]1CC[C@](C)(F)C1 ZINC000351738624 356076675 /nfs/dbraw/zinc/07/66/75/356076675.db2.gz XRDIRJPVPZHTHX-PWSUYJOCSA-N 1 2 231.311 2.008 20 0 BEADLO CCCC(C)(C)CC(=O)N[C@H]1Cc2c[nH+]cn2C1 ZINC000623259927 356092912 /nfs/dbraw/zinc/09/29/12/356092912.db2.gz ODNQJDOBMUXNLM-NSHDSACASA-N 1 2 249.358 2.140 20 0 BEADLO C[C@@H](F)CC[N@H+](C)Cc1nccn1C(F)F ZINC000351863606 356100964 /nfs/dbraw/zinc/10/09/64/356100964.db2.gz QRONWRXOAONGPG-MRVPVSSYSA-N 1 2 235.253 2.458 20 0 BEADLO C[C@@H](F)CC[N@@H+](C)Cc1nccn1C(F)F ZINC000351863606 356100966 /nfs/dbraw/zinc/10/09/66/356100966.db2.gz QRONWRXOAONGPG-MRVPVSSYSA-N 1 2 235.253 2.458 20 0 BEADLO Cc1c(C[N@@H+]2CCn3cccc3[C@H]2C)cnn1C ZINC000335918828 356166185 /nfs/dbraw/zinc/16/61/85/356166185.db2.gz BCFOFILXQQYLEC-GFCCVEGCSA-N 1 2 244.342 2.107 20 0 BEADLO Cc1c(C[N@H+]2CCn3cccc3[C@H]2C)cnn1C ZINC000335918828 356166189 /nfs/dbraw/zinc/16/61/89/356166189.db2.gz BCFOFILXQQYLEC-GFCCVEGCSA-N 1 2 244.342 2.107 20 0 BEADLO C[C@H](c1ccccc1)[N@@H+]1CC[S@](=O)[C@@H](C)C1 ZINC000351898277 356170011 /nfs/dbraw/zinc/17/00/11/356170011.db2.gz PEQRKMGCQCDXAU-OZVIIMIRSA-N 1 2 237.368 2.200 20 0 BEADLO C[C@H](c1ccccc1)[N@H+]1CC[S@](=O)[C@@H](C)C1 ZINC000351898277 356170014 /nfs/dbraw/zinc/17/00/14/356170014.db2.gz PEQRKMGCQCDXAU-OZVIIMIRSA-N 1 2 237.368 2.200 20 0 BEADLO Cc1cc(NC(=O)N(C)[C@H]2CC2(C)C)cc[nH+]1 ZINC000336095847 134079908 /nfs/dbraw/zinc/07/99/08/134079908.db2.gz UJLXBZGQTNVNAE-NSHDSACASA-N 1 2 233.315 2.074 20 0 BEADLO CC1(C)CN(Cc2[nH+]ccn2CC(F)(F)F)C1 ZINC000639405989 356199221 /nfs/dbraw/zinc/19/92/21/356199221.db2.gz QDOFULMAXXDVSL-UHFFFAOYSA-N 1 2 247.264 2.287 20 0 BEADLO CCc1nc(C)c(C[N@@H+]2C[C@H](C)OC[C@@H]2C)o1 ZINC000336116407 134088752 /nfs/dbraw/zinc/08/87/52/134088752.db2.gz XKOLIOOGRCEAOR-UWVGGRQHSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1nc(C)c(C[N@H+]2C[C@H](C)OC[C@@H]2C)o1 ZINC000336116407 134088753 /nfs/dbraw/zinc/08/87/53/134088753.db2.gz XKOLIOOGRCEAOR-UWVGGRQHSA-N 1 2 238.331 2.155 20 0 BEADLO CCC(F)(F)C[NH+]1CCC([C@@H](C)O)CC1 ZINC000639487073 356303261 /nfs/dbraw/zinc/30/32/61/356303261.db2.gz WIZGUIMYAZADHQ-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO C[N@@H+](Cc1nccs1)C[C@@H]1CC(C)(C)CO1 ZINC000639507248 356334767 /nfs/dbraw/zinc/33/47/67/356334767.db2.gz KLUBXDSPRWYQQK-JTQLQIEISA-N 1 2 240.372 2.390 20 0 BEADLO C[N@H+](Cc1nccs1)C[C@@H]1CC(C)(C)CO1 ZINC000639507248 356334770 /nfs/dbraw/zinc/33/47/70/356334770.db2.gz KLUBXDSPRWYQQK-JTQLQIEISA-N 1 2 240.372 2.390 20 0 BEADLO CCCOc1ccc2c(c1)CC[N@@H+](CC(C)=O)C2 ZINC000639541394 356394746 /nfs/dbraw/zinc/39/47/46/356394746.db2.gz MHHPYSYVEIUYQR-UHFFFAOYSA-N 1 2 247.338 2.423 20 0 BEADLO CCCOc1ccc2c(c1)CC[N@H+](CC(C)=O)C2 ZINC000639541394 356394749 /nfs/dbraw/zinc/39/47/49/356394749.db2.gz MHHPYSYVEIUYQR-UHFFFAOYSA-N 1 2 247.338 2.423 20 0 BEADLO CC(C)NC(=O)C[NH2+]C1(C(F)F)CCCCC1 ZINC000352196564 134098638 /nfs/dbraw/zinc/09/86/38/134098638.db2.gz ZYNTWHMJZWYFCN-UHFFFAOYSA-N 1 2 248.317 2.069 20 0 BEADLO CCCC[C@H](CC)C(=O)N[C@H]1Cc2c[nH+]cn2C1 ZINC000623274824 356408377 /nfs/dbraw/zinc/40/83/77/356408377.db2.gz WBWJVGFOGITWGE-RYUDHWBXSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1nc(CNc2cccc[nH+]2)cs1 ZINC000041042999 358505170 /nfs/dbraw/zinc/50/51/70/358505170.db2.gz RXWBGOUEJOUKDU-UHFFFAOYSA-N 1 2 205.286 2.459 20 0 BEADLO CC1(C[NH2+]Cc2[nH]ncc2Br)CC1 ZINC000379390354 356451961 /nfs/dbraw/zinc/45/19/61/356451961.db2.gz NRBXYSYSXAZGLY-UHFFFAOYSA-N 1 2 244.136 2.062 20 0 BEADLO Cc1cc(CNC(=O)N[C@@H](C)C2CC2)cc(C)[nH+]1 ZINC000420770909 192259131 /nfs/dbraw/zinc/25/91/31/192259131.db2.gz KODKHQVRESXLHP-NSHDSACASA-N 1 2 247.342 2.296 20 0 BEADLO Cc1cc(N2CC[C@]23CCOC3)nc(C2CC2)[nH+]1 ZINC000420633914 192252547 /nfs/dbraw/zinc/25/25/47/192252547.db2.gz CNWVTCSNDAEDLI-CQSZACIVSA-N 1 2 245.326 2.032 20 0 BEADLO Cc1cc(N2C[C@@H](O)CC[C@H]2C)nc(C2CC2)[nH+]1 ZINC000420642177 192254128 /nfs/dbraw/zinc/25/41/28/192254128.db2.gz SOQNZRXUZCFABO-PWSUYJOCSA-N 1 2 247.342 2.012 20 0 BEADLO Cc1cc(N2CC[C@@]23CCOC3)nc(C(C)C)[nH+]1 ZINC000420646022 192254170 /nfs/dbraw/zinc/25/41/70/192254170.db2.gz VLNLQINMKJOPCC-AWEZNQCLSA-N 1 2 247.342 2.278 20 0 BEADLO COc1ccnc(NCc2cc(C)[nH+]c(C)c2)n1 ZINC000420649205 192255217 /nfs/dbraw/zinc/25/52/17/192255217.db2.gz FPJLUTPPDUOTBY-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO CC[C@@H](C)CNc1[nH+]c(C)nc2[nH]ccc21 ZINC000420652843 192255291 /nfs/dbraw/zinc/25/52/91/192255291.db2.gz NGTCWKLMIUMMHG-MRVPVSSYSA-N 1 2 218.304 2.146 20 0 BEADLO CSCCN(C)c1[nH+]c2ccccc2n1C ZINC000179315076 366242360 /nfs/dbraw/zinc/24/23/60/366242360.db2.gz GYTVVRQZEPZVFC-UHFFFAOYSA-N 1 2 235.356 2.373 20 0 BEADLO Cc1cc(CNC(=O)NC[C@H]2C[C@@H]2C)cc(C)[nH+]1 ZINC000420812049 192262677 /nfs/dbraw/zinc/26/26/77/192262677.db2.gz WTQZRKBMNSWRJK-TVQRCGJNSA-N 1 2 247.342 2.154 20 0 BEADLO CC(=O)C[NH2+][C@@H](COCC(C)C)c1ccco1 ZINC000639577088 356498552 /nfs/dbraw/zinc/49/85/52/356498552.db2.gz BVMKUWOGQAWYJD-LBPRGKRZSA-N 1 2 239.315 2.172 20 0 BEADLO CC(=O)C[NH2+][C@H](c1ncc(C)s1)C1CC1 ZINC000639581581 356502357 /nfs/dbraw/zinc/50/23/57/356502357.db2.gz YNOKTIVVENIYPC-JTQLQIEISA-N 1 2 224.329 2.081 20 0 BEADLO COCc1ccc([C@H]2CCC[N@@H+]2CC(C)=O)o1 ZINC000639586231 356505358 /nfs/dbraw/zinc/50/53/58/356505358.db2.gz COACFSOQSDYETF-GFCCVEGCSA-N 1 2 237.299 2.152 20 0 BEADLO COCc1ccc([C@H]2CCC[N@H+]2CC(C)=O)o1 ZINC000639586231 356505363 /nfs/dbraw/zinc/50/53/63/356505363.db2.gz COACFSOQSDYETF-GFCCVEGCSA-N 1 2 237.299 2.152 20 0 BEADLO CCC(F)(F)C[NH2+][C@H](CO)c1ccc(F)cc1 ZINC000639594529 356513882 /nfs/dbraw/zinc/51/38/82/356513882.db2.gz GILWQFZHRCNYJS-LLVKDONJSA-N 1 2 247.260 2.494 20 0 BEADLO CC[C@@H]1C[NH+](Cc2ncc(C)cn2)C[C@@H](CC)O1 ZINC000420950019 192276072 /nfs/dbraw/zinc/27/60/72/192276072.db2.gz FWLNDMWNNXFEDR-CHWSQXEVSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[NH+](Cc2cnc(C)cn2)C[C@@H](CC)O1 ZINC000420955250 192277488 /nfs/dbraw/zinc/27/74/88/192277488.db2.gz LDXMILUVWMEPMW-ZIAGYGMSSA-N 1 2 249.358 2.174 20 0 BEADLO CCC(F)(F)C[N@@H+]1CC[C@@H](O)C(C)(C)C1 ZINC000639603361 356524069 /nfs/dbraw/zinc/52/40/69/356524069.db2.gz ORKOJICHVXLKKG-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO CCC(F)(F)C[N@H+]1CC[C@@H](O)C(C)(C)C1 ZINC000639603361 356524072 /nfs/dbraw/zinc/52/40/72/356524072.db2.gz ORKOJICHVXLKKG-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO c1cc(C[N@@H+]2CCC[C@@H]2c2cc[nH]n2)sn1 ZINC000639616599 356533965 /nfs/dbraw/zinc/53/39/65/356533965.db2.gz JGYKONWLPFXFAP-LLVKDONJSA-N 1 2 234.328 2.203 20 0 BEADLO c1cc(C[N@H+]2CCC[C@@H]2c2cc[nH]n2)sn1 ZINC000639616599 356533969 /nfs/dbraw/zinc/53/39/69/356533969.db2.gz JGYKONWLPFXFAP-LLVKDONJSA-N 1 2 234.328 2.203 20 0 BEADLO CC[C@@H]1C[NH+](Cc2ncc(C)o2)C[C@@H](CC)O1 ZINC000420962444 192282856 /nfs/dbraw/zinc/28/28/56/192282856.db2.gz UHNBNYWGFJRLHM-VXGBXAGGSA-N 1 2 238.331 2.372 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCc2cc[nH]c(=O)c2C1 ZINC000639630293 356546049 /nfs/dbraw/zinc/54/60/49/356546049.db2.gz DDJOISVEKGVEFV-UHFFFAOYSA-N 1 2 242.269 2.191 20 0 BEADLO CCC(F)(F)C[N@H+]1CCc2cc[nH]c(=O)c2C1 ZINC000639630293 356546051 /nfs/dbraw/zinc/54/60/51/356546051.db2.gz DDJOISVEKGVEFV-UHFFFAOYSA-N 1 2 242.269 2.191 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1nc(C2CCC2)no1 ZINC000639618378 356535554 /nfs/dbraw/zinc/53/55/54/356535554.db2.gz JZMGYQDSCYPBTO-DTORHVGOSA-N 1 2 221.304 2.320 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1nc(C2CCC2)no1 ZINC000639618378 356535558 /nfs/dbraw/zinc/53/55/58/356535558.db2.gz JZMGYQDSCYPBTO-DTORHVGOSA-N 1 2 221.304 2.320 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1nc(CC2CC2)no1 ZINC000639618840 356535927 /nfs/dbraw/zinc/53/59/27/356535927.db2.gz RYJJNCLPHMCIKB-DTORHVGOSA-N 1 2 221.304 2.005 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1nc(CC2CC2)no1 ZINC000639618840 356535930 /nfs/dbraw/zinc/53/59/30/356535930.db2.gz RYJJNCLPHMCIKB-DTORHVGOSA-N 1 2 221.304 2.005 20 0 BEADLO Cc1cc(N2CC[C@@H](F)C2)nc(C(C)C)[nH+]1 ZINC000336188981 134122533 /nfs/dbraw/zinc/12/25/33/134122533.db2.gz RDNUVJLGTQZGKN-SNVBAGLBSA-N 1 2 223.295 2.457 20 0 BEADLO CC(C)n1cc(C[N@@H+]2C[C@@H](C)OC[C@H]2C)cn1 ZINC000179518981 366266393 /nfs/dbraw/zinc/26/63/93/366266393.db2.gz QKEUDTCHGQEEFI-VXGBXAGGSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)n1cc(C[N@H+]2C[C@@H](C)OC[C@H]2C)cn1 ZINC000179518981 366266396 /nfs/dbraw/zinc/26/63/96/366266396.db2.gz QKEUDTCHGQEEFI-VXGBXAGGSA-N 1 2 237.347 2.073 20 0 BEADLO Clc1cnccc1C[N@@H+]1CC[C@@]12CCOC2 ZINC000421016416 192303207 /nfs/dbraw/zinc/30/32/07/192303207.db2.gz JCAGVEWZJJHPDO-LBPRGKRZSA-N 1 2 238.718 2.100 20 0 BEADLO Clc1cnccc1C[N@H+]1CC[C@@]12CCOC2 ZINC000421016416 192303208 /nfs/dbraw/zinc/30/32/08/192303208.db2.gz JCAGVEWZJJHPDO-LBPRGKRZSA-N 1 2 238.718 2.100 20 0 BEADLO CC(C)n1cc[nH+]c1CSC[C@H]1C[C@@H](O)C1 ZINC000421213380 192312882 /nfs/dbraw/zinc/31/28/82/192312882.db2.gz AFWCHTHMAXBETE-PHIMTYICSA-N 1 2 240.372 2.468 20 0 BEADLO CCc1[nH+]c(C)ccc1OC[C@H]1C[C@@H](O)C1 ZINC000421219291 192315566 /nfs/dbraw/zinc/31/55/66/192315566.db2.gz UQSTYVPRBFHGDK-PHIMTYICSA-N 1 2 221.300 2.102 20 0 BEADLO CCC(F)(F)C[N@H+](C1CC1)C1(CO)CCC1 ZINC000639671715 356588736 /nfs/dbraw/zinc/58/87/36/356588736.db2.gz YKOBHPLAFMMXGP-UHFFFAOYSA-N 1 2 233.302 2.411 20 0 BEADLO CCC(F)(F)C[N@@H+](C1CC1)C1(CO)CCC1 ZINC000639671715 356588738 /nfs/dbraw/zinc/58/87/38/356588738.db2.gz YKOBHPLAFMMXGP-UHFFFAOYSA-N 1 2 233.302 2.411 20 0 BEADLO CCC(C)(CC)C(=O)N[C@H]1CCn2c[nH+]cc2C1 ZINC000623304118 356594783 /nfs/dbraw/zinc/59/47/83/356594783.db2.gz QXRFPGJMJAZWEO-NSHDSACASA-N 1 2 249.358 2.140 20 0 BEADLO CC(=O)C[N@@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000639665002 356579560 /nfs/dbraw/zinc/57/95/60/356579560.db2.gz JZPPFYNGZNLNIP-GFCCVEGCSA-N 1 2 219.284 2.396 20 0 BEADLO CC(=O)C[N@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000639665002 356579561 /nfs/dbraw/zinc/57/95/61/356579561.db2.gz JZPPFYNGZNLNIP-GFCCVEGCSA-N 1 2 219.284 2.396 20 0 BEADLO Cc1cc(NC(=O)CC2CC(F)(F)C2)cc[nH+]1 ZINC000336215921 134136652 /nfs/dbraw/zinc/13/66/52/134136652.db2.gz QPCVMVNSSTXDQL-UHFFFAOYSA-N 1 2 240.253 2.186 20 0 BEADLO CC(C)CN(C)c1nc(N)c2ccccc2[nH+]1 ZINC000301872423 356584633 /nfs/dbraw/zinc/58/46/33/356584633.db2.gz JCBVLUIDAWJQOC-UHFFFAOYSA-N 1 2 230.315 2.304 20 0 BEADLO CCOCCn1c[nH+]c2cc(F)c(F)cc21 ZINC000162831318 202077345 /nfs/dbraw/zinc/07/73/45/202077345.db2.gz JPFBSKQPZTZCTH-UHFFFAOYSA-N 1 2 226.226 2.351 20 0 BEADLO C[C@]1(CNc2cc(CO)cc[nH+]2)C[C@H]2C[C@H]2C1 ZINC000630094270 363535248 /nfs/dbraw/zinc/53/52/48/363535248.db2.gz YROGFCYBSQIBTK-IMRBUKKESA-N 1 2 232.327 2.422 20 0 BEADLO CCc1cc(NCC2(OC)CCC2)nc[nH+]1 ZINC000227304043 491098744 /nfs/dbraw/zinc/09/87/44/491098744.db2.gz LMLYAKAEOJMGPH-UHFFFAOYSA-N 1 2 221.304 2.020 20 0 BEADLO CC(=O)C[NH2+][C@H](Cc1ccccc1)c1ncco1 ZINC000639749901 356643758 /nfs/dbraw/zinc/64/37/58/356643758.db2.gz LMMGMQGTJBLEPF-CYBMUJFWSA-N 1 2 244.294 2.137 20 0 BEADLO OCc1cc[nH+]c(N2CCC(CCF)CC2)c1 ZINC000630095107 363545748 /nfs/dbraw/zinc/54/57/48/363545748.db2.gz SEKZEHKNPFLHRZ-UHFFFAOYSA-N 1 2 238.306 2.150 20 0 BEADLO CCC[C@H](C)[C@H](CO)Nc1cccc[nH+]1 ZINC000578136526 366310818 /nfs/dbraw/zinc/31/08/18/366310818.db2.gz RJEUPSXJXXMCQC-QWRGUYRKSA-N 1 2 208.305 2.291 20 0 BEADLO CCOC(=O)C(C)(C)[NH2+]CC1=CCCCC1 ZINC000450344079 202135517 /nfs/dbraw/zinc/13/55/17/202135517.db2.gz ANKKYVZXBJGGQJ-UHFFFAOYSA-N 1 2 225.332 2.418 20 0 BEADLO Cc1cc(NCc2cc(C)c(O)c(C)c2)nc[nH+]1 ZINC000352784703 134152344 /nfs/dbraw/zinc/15/23/44/134152344.db2.gz QLWVJLHVWADNAM-UHFFFAOYSA-N 1 2 243.310 2.141 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)c1cccc(Cl)c1 ZINC000041534690 358511175 /nfs/dbraw/zinc/51/11/75/358511175.db2.gz NOUOUVRVSZDWKB-UHFFFAOYSA-N 1 2 249.701 2.004 20 0 BEADLO C[C@@H](O)[C@H](C)SCc1c[nH+]c2ccccn12 ZINC000179900534 366330148 /nfs/dbraw/zinc/33/01/48/366330148.db2.gz NEMWJGAPOHJEOR-ZJUUUORDSA-N 1 2 236.340 2.337 20 0 BEADLO Cc1cnc([C@H](C)[N@H+](C)Cc2ccns2)cn1 ZINC000639807754 356777591 /nfs/dbraw/zinc/77/75/91/356777591.db2.gz LBSUUHGGLPDKRH-JTQLQIEISA-N 1 2 248.355 2.435 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+](C)Cc2ccns2)cn1 ZINC000639807754 356777593 /nfs/dbraw/zinc/77/75/93/356777593.db2.gz LBSUUHGGLPDKRH-JTQLQIEISA-N 1 2 248.355 2.435 20 0 BEADLO Cc1ccc(NC(=O)N2CC=CC2)c(C)[nH+]1 ZINC000639796320 356752607 /nfs/dbraw/zinc/75/26/07/356752607.db2.gz SOTMUYFCZCHIDB-UHFFFAOYSA-N 1 2 217.272 2.102 20 0 BEADLO CCC(F)(F)C[N@H+]1C[C@]2(C)COC[C@]2(C)C1 ZINC000639801673 356764728 /nfs/dbraw/zinc/76/47/28/356764728.db2.gz RMGRBRKTOLBOPC-PHIMTYICSA-N 1 2 233.302 2.390 20 0 BEADLO CCC(F)(F)C[N@@H+]1C[C@]2(C)COC[C@]2(C)C1 ZINC000639801673 356764729 /nfs/dbraw/zinc/76/47/29/356764729.db2.gz RMGRBRKTOLBOPC-PHIMTYICSA-N 1 2 233.302 2.390 20 0 BEADLO CC[C@@H]1CCCC[C@H]1C(=O)NCc1c[nH+]c[nH]1 ZINC000356158964 356790066 /nfs/dbraw/zinc/79/00/66/356790066.db2.gz WTRGXOVZIQTCJK-ZYHUDNBSSA-N 1 2 235.331 2.242 20 0 BEADLO CC[C@@H]1CCCC[C@H]1C(=O)NCc1c[nH]c[nH+]1 ZINC000356158964 356790071 /nfs/dbraw/zinc/79/00/71/356790071.db2.gz WTRGXOVZIQTCJK-ZYHUDNBSSA-N 1 2 235.331 2.242 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)C[C@@H]1CCCCC1(F)F ZINC000450478934 202179763 /nfs/dbraw/zinc/17/97/63/202179763.db2.gz KFGBWZJDPOJAEY-VIFPVBQESA-N 1 2 244.289 2.062 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)C[C@@H]1CCCCC1(F)F ZINC000450478934 202179765 /nfs/dbraw/zinc/17/97/65/202179765.db2.gz KFGBWZJDPOJAEY-VIFPVBQESA-N 1 2 244.289 2.062 20 0 BEADLO CO[C@H]1C[N@H+](CCCCC(F)(F)F)CCO1 ZINC000639832887 356816267 /nfs/dbraw/zinc/81/62/67/356816267.db2.gz DWBSENWVHVAHCK-SECBINFHSA-N 1 2 241.253 2.024 20 0 BEADLO CO[C@H]1C[N@@H+](CCCCC(F)(F)F)CCO1 ZINC000639832887 356816270 /nfs/dbraw/zinc/81/62/70/356816270.db2.gz DWBSENWVHVAHCK-SECBINFHSA-N 1 2 241.253 2.024 20 0 BEADLO CO[C@H]1C[N@@H+]([C@H](C)c2ccc(F)cc2)CCO1 ZINC000639836595 356821970 /nfs/dbraw/zinc/82/19/70/356821970.db2.gz UZFMGBDJIUPTFB-ZWNOBZJWSA-N 1 2 239.290 2.191 20 0 BEADLO CO[C@H]1C[N@H+]([C@H](C)c2ccc(F)cc2)CCO1 ZINC000639836595 356821974 /nfs/dbraw/zinc/82/19/74/356821974.db2.gz UZFMGBDJIUPTFB-ZWNOBZJWSA-N 1 2 239.290 2.191 20 0 BEADLO CCCc1ccc(C[N@@H+]2CCO[C@@H](OC)C2)cc1 ZINC000639840072 356831632 /nfs/dbraw/zinc/83/16/32/356831632.db2.gz VKMDUGGOCWBBFK-OAHLLOKOSA-N 1 2 249.354 2.444 20 0 BEADLO CCCc1ccc(C[N@H+]2CCO[C@@H](OC)C2)cc1 ZINC000639840072 356831634 /nfs/dbraw/zinc/83/16/34/356831634.db2.gz VKMDUGGOCWBBFK-OAHLLOKOSA-N 1 2 249.354 2.444 20 0 BEADLO CC(C)(C)C1CC(NC(=O)CCc2[nH]cc[nH+]2)C1 ZINC000356064274 356787347 /nfs/dbraw/zinc/78/73/47/356787347.db2.gz NXBBPCPVKRIENH-UHFFFAOYSA-N 1 2 249.358 2.283 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2ncccn2)on1 ZINC000639840980 356836440 /nfs/dbraw/zinc/83/64/40/356836440.db2.gz QJYVYUPPNOBSCT-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2ncccn2)on1 ZINC000639840980 356836444 /nfs/dbraw/zinc/83/64/44/356836444.db2.gz QJYVYUPPNOBSCT-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NC1CCC2(CC2)CC1 ZINC000281852045 538708938 /nfs/dbraw/zinc/70/89/38/538708938.db2.gz NAWHAAVUQPXINX-UHFFFAOYSA-N 1 2 247.342 2.181 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NC1CCC2(CC2)CC1 ZINC000281852045 538708949 /nfs/dbraw/zinc/70/89/49/538708949.db2.gz NAWHAAVUQPXINX-UHFFFAOYSA-N 1 2 247.342 2.181 20 0 BEADLO CCN(c1cc[nH+]c(C(C)C)n1)[C@H]1CCOC1 ZINC000359969714 356899157 /nfs/dbraw/zinc/89/91/57/356899157.db2.gz WKZJTQQIRKLXPO-NSHDSACASA-N 1 2 235.331 2.215 20 0 BEADLO CCc1csc(NCCNc2cccc[nH+]2)n1 ZINC000362411524 356945301 /nfs/dbraw/zinc/94/53/01/356945301.db2.gz URKGYDOFVIAZFS-UHFFFAOYSA-N 1 2 248.355 2.046 20 0 BEADLO Cc1cc(CNc2c[nH]c[nH+]2)ccc1F ZINC000389846984 357053337 /nfs/dbraw/zinc/05/33/37/357053337.db2.gz PAKBIDMSINQFSB-UHFFFAOYSA-N 1 2 205.236 2.469 20 0 BEADLO Cc1nc(NCCCC(C)(C)C)cc[nH+]1 ZINC000389884992 357059790 /nfs/dbraw/zinc/05/97/90/357059790.db2.gz QUGVXOJJYPHYFY-UHFFFAOYSA-N 1 2 207.321 2.445 20 0 BEADLO C[C@@H]1C[N@H+](C/C=C\c2ccccc2)CC[S@]1=O ZINC000610080553 357067961 /nfs/dbraw/zinc/06/79/61/357067961.db2.gz VLTUBPJDDGOVAV-SOIKEBEJSA-N 1 2 249.379 2.153 20 0 BEADLO C[C@@H]1C[N@@H+](C/C=C\c2ccccc2)CC[S@]1=O ZINC000610080553 357067963 /nfs/dbraw/zinc/06/79/63/357067963.db2.gz VLTUBPJDDGOVAV-SOIKEBEJSA-N 1 2 249.379 2.153 20 0 BEADLO C[C@@H]1C[N@H+](C/C=C\c2ccccc2)CC[S@@]1=O ZINC000610080554 357068058 /nfs/dbraw/zinc/06/80/58/357068058.db2.gz VLTUBPJDDGOVAV-BXBHMFDASA-N 1 2 249.379 2.153 20 0 BEADLO C[C@@H]1C[N@@H+](C/C=C\c2ccccc2)CC[S@@]1=O ZINC000610080554 357068060 /nfs/dbraw/zinc/06/80/60/357068060.db2.gz VLTUBPJDDGOVAV-BXBHMFDASA-N 1 2 249.379 2.153 20 0 BEADLO c1[nH]cc(N[C@H]2CCCC23CCOCC3)[nH+]1 ZINC000390280268 357088046 /nfs/dbraw/zinc/08/80/46/357088046.db2.gz VAHUDEUMMIIGER-JTQLQIEISA-N 1 2 221.304 2.171 20 0 BEADLO CCn1ccnc1C[NH2+]Cc1occc1C ZINC000390363077 357090013 /nfs/dbraw/zinc/09/00/13/357090013.db2.gz SIMNJXOXSCSZLH-UHFFFAOYSA-N 1 2 219.288 2.094 20 0 BEADLO CC(C)CCN(C(=O)CCc1c[nH+]c[nH]1)C1CC1 ZINC000354949586 538786755 /nfs/dbraw/zinc/78/67/55/538786755.db2.gz KLSLJWVYPNIEID-UHFFFAOYSA-N 1 2 249.358 2.379 20 0 BEADLO CC(C)CCN(C(=O)CCc1c[nH]c[nH+]1)C1CC1 ZINC000354949586 538786759 /nfs/dbraw/zinc/78/67/59/538786759.db2.gz KLSLJWVYPNIEID-UHFFFAOYSA-N 1 2 249.358 2.379 20 0 BEADLO OC[C@@H](Nc1cccc[nH+]1)C1CCCCC1 ZINC000390797291 357116497 /nfs/dbraw/zinc/11/64/97/357116497.db2.gz TXVDZNINWWDLGU-GFCCVEGCSA-N 1 2 220.316 2.435 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]CC(C)(C)F)no1 ZINC000631659962 357190716 /nfs/dbraw/zinc/19/07/16/357190716.db2.gz CYMWHONNXYEAGN-MRVPVSSYSA-N 1 2 200.257 2.382 20 0 BEADLO C[C@H](CCC1CC1)NC(=O)CCc1c[nH+]c[nH]1 ZINC000356249489 538809812 /nfs/dbraw/zinc/80/98/12/538809812.db2.gz FSIOHHAPOHCNPE-SNVBAGLBSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H](CCC1CC1)NC(=O)CCc1c[nH]c[nH+]1 ZINC000356249489 538809816 /nfs/dbraw/zinc/80/98/16/538809816.db2.gz FSIOHHAPOHCNPE-SNVBAGLBSA-N 1 2 235.331 2.037 20 0 BEADLO CCOC(=O)C[N@@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000610212714 357281828 /nfs/dbraw/zinc/28/18/28/357281828.db2.gz XYQVCEJBFPQOLY-ZDUSSCGKSA-N 1 2 249.310 2.092 20 0 BEADLO CCOC(=O)C[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000610212714 357281832 /nfs/dbraw/zinc/28/18/32/357281832.db2.gz XYQVCEJBFPQOLY-ZDUSSCGKSA-N 1 2 249.310 2.092 20 0 BEADLO CSC1(CNc2nc(C)[nH+]cc2C)CCC1 ZINC000583703998 357283611 /nfs/dbraw/zinc/28/36/11/357283611.db2.gz QZIGLHLZJRCACS-UHFFFAOYSA-N 1 2 237.372 2.213 20 0 BEADLO c1nnsc1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC000582467507 357293575 /nfs/dbraw/zinc/29/35/75/357293575.db2.gz FAWPWUVIZCLDOC-GFCCVEGCSA-N 1 2 246.339 2.270 20 0 BEADLO c1nnsc1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000582467507 357293578 /nfs/dbraw/zinc/29/35/78/357293578.db2.gz FAWPWUVIZCLDOC-GFCCVEGCSA-N 1 2 246.339 2.270 20 0 BEADLO Cc1cc(CNc2c[nH]c[nH+]2)cc(C)c1O ZINC000393801365 357300427 /nfs/dbraw/zinc/30/04/27/357300427.db2.gz MFHBXXDOGMQWGM-UHFFFAOYSA-N 1 2 217.272 2.344 20 0 BEADLO CS[C@@H]1CCN(c2nc(C)[nH+]cc2C)C1 ZINC000582555582 357343300 /nfs/dbraw/zinc/34/33/00/357343300.db2.gz BCRCHDFZBLEZHL-SNVBAGLBSA-N 1 2 223.345 2.035 20 0 BEADLO CCc1cccc(CNc2ccc(CO)c[nH+]2)c1 ZINC000582670580 357360529 /nfs/dbraw/zinc/36/05/29/357360529.db2.gz DQQKXLURMTXBNU-UHFFFAOYSA-N 1 2 242.322 2.170 20 0 BEADLO COC(=O)[C@@H]([NH2+]C[C@H]1CCCC1(F)F)C(C)C ZINC000394661573 357367907 /nfs/dbraw/zinc/36/79/07/357367907.db2.gz OQIYEVGTHOLRQI-ZJUUUORDSA-N 1 2 249.301 2.209 20 0 BEADLO CCC[C@@H](C)[C@@H]1CCCN1C(=O)Cn1cc[nH+]c1 ZINC000582937994 357440682 /nfs/dbraw/zinc/44/06/82/357440682.db2.gz YOQURHRSOBDMCX-OLZOCXBDSA-N 1 2 249.358 2.310 20 0 BEADLO FC(F)(F)C1C[NH+](CCc2ccccn2)C1 ZINC000583185024 357511738 /nfs/dbraw/zinc/51/17/38/357511738.db2.gz VWNIHPLSPKMZMF-UHFFFAOYSA-N 1 2 230.233 2.118 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CC12CCOCC2 ZINC000395662079 357445366 /nfs/dbraw/zinc/44/53/66/357445366.db2.gz ZDWFWYYNBGVDFL-NSHDSACASA-N 1 2 234.299 2.071 20 0 BEADLO COc1cc(C)ccc1[NH2+]C[C@H](C)CO ZINC000157976827 538845454 /nfs/dbraw/zinc/84/54/54/538845454.db2.gz VCSOAJXHFHZMPZ-JTQLQIEISA-N 1 2 209.289 2.044 20 0 BEADLO COc1cc(C)ccc1[NH2+]C[C@@H](C)CO ZINC000157976679 538845663 /nfs/dbraw/zinc/84/56/63/538845663.db2.gz VCSOAJXHFHZMPZ-SNVBAGLBSA-N 1 2 209.289 2.044 20 0 BEADLO Cc1nnsc1C[N@@H+](C)Cc1cnccc1C ZINC000583028011 357463344 /nfs/dbraw/zinc/46/33/44/357463344.db2.gz GVDRWZBFAQGCSR-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO Cc1nnsc1C[N@H+](C)Cc1cnccc1C ZINC000583028011 357463350 /nfs/dbraw/zinc/46/33/50/357463350.db2.gz GVDRWZBFAQGCSR-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO c1nc(C[N@@H+]2CCC=C(c3ccccn3)C2)c[nH]1 ZINC000583032905 357464705 /nfs/dbraw/zinc/46/47/05/357464705.db2.gz XUGAFMZPWATIOU-UHFFFAOYSA-N 1 2 240.310 2.094 20 0 BEADLO c1nc(C[N@H+]2CCC=C(c3ccccn3)C2)c[nH]1 ZINC000583032905 357464709 /nfs/dbraw/zinc/46/47/09/357464709.db2.gz XUGAFMZPWATIOU-UHFFFAOYSA-N 1 2 240.310 2.094 20 0 BEADLO c1ncc(C[N@@H+]2CCC=C(c3ccccn3)C2)[nH]1 ZINC000583032905 357464714 /nfs/dbraw/zinc/46/47/14/357464714.db2.gz XUGAFMZPWATIOU-UHFFFAOYSA-N 1 2 240.310 2.094 20 0 BEADLO c1ncc(C[N@H+]2CCC=C(c3ccccn3)C2)[nH]1 ZINC000583032905 357464718 /nfs/dbraw/zinc/46/47/18/357464718.db2.gz XUGAFMZPWATIOU-UHFFFAOYSA-N 1 2 240.310 2.094 20 0 BEADLO Cn1c[nH+]cc1CCC(=O)Nc1cccc(F)c1 ZINC000188393265 357530157 /nfs/dbraw/zinc/53/01/57/357530157.db2.gz UVAFAQCBXUXCFF-UHFFFAOYSA-N 1 2 247.273 2.131 20 0 BEADLO CCCc1nc(C[N@@H+]2CCCC[C@H]2C)no1 ZINC000054982886 363583631 /nfs/dbraw/zinc/58/36/31/363583631.db2.gz SZDAZCCMTJQJNA-SNVBAGLBSA-N 1 2 223.320 2.397 20 0 BEADLO CCCc1nc(C[N@H+]2CCCC[C@H]2C)no1 ZINC000054982886 363583633 /nfs/dbraw/zinc/58/36/33/363583633.db2.gz SZDAZCCMTJQJNA-SNVBAGLBSA-N 1 2 223.320 2.397 20 0 BEADLO COC(C)(C)CCSc1nc(N)cc(C)[nH+]1 ZINC000231028282 357596288 /nfs/dbraw/zinc/59/62/88/357596288.db2.gz ZARWLVAJEIHBME-UHFFFAOYSA-N 1 2 241.360 2.274 20 0 BEADLO Cc1cnc(C[NH+]2CC(C)(C)OC(C)(C)C2)o1 ZINC000189656962 357656052 /nfs/dbraw/zinc/65/60/52/357656052.db2.gz WQGKEEUSLMDDRZ-UHFFFAOYSA-N 1 2 238.331 2.372 20 0 BEADLO c1coc([C@@H]2C[N@H+](C[C@@H]3CCC=CO3)CCO2)c1 ZINC000191087830 357748757 /nfs/dbraw/zinc/74/87/57/357748757.db2.gz DNPKBLFWVIZNIV-JSGCOSHPSA-N 1 2 249.310 2.346 20 0 BEADLO c1coc([C@@H]2C[N@@H+](C[C@@H]3CCC=CO3)CCO2)c1 ZINC000191087830 357748759 /nfs/dbraw/zinc/74/87/59/357748759.db2.gz DNPKBLFWVIZNIV-JSGCOSHPSA-N 1 2 249.310 2.346 20 0 BEADLO CC(C)(NC(=O)[C@@H]1C[C@H]1C1CCC1)c1[nH]cc[nH+]1 ZINC000583268621 357764063 /nfs/dbraw/zinc/76/40/63/357764063.db2.gz UARPWSPKODIYCD-WDEREUQCSA-N 1 2 247.342 2.197 20 0 BEADLO Cc1nocc1C[NH2+][C@H](C)c1cscn1 ZINC000397932937 357802434 /nfs/dbraw/zinc/80/24/34/357802434.db2.gz VLXIGUPIYVNMMD-MRVPVSSYSA-N 1 2 223.301 2.290 20 0 BEADLO C[N@H+](Cc1cccc(F)c1)Cc1ncccn1 ZINC000191905472 357804073 /nfs/dbraw/zinc/80/40/73/357804073.db2.gz DTJMJKNIDOGRCD-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[N@@H+](Cc1cccc(F)c1)Cc1ncccn1 ZINC000191905472 357804076 /nfs/dbraw/zinc/80/40/76/357804076.db2.gz DTJMJKNIDOGRCD-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO Fc1cccc(C2([NH2+]Cc3ncccn3)CC2)c1 ZINC000192158573 357824963 /nfs/dbraw/zinc/82/49/63/357824963.db2.gz YGQFSIHJWCHHRQ-UHFFFAOYSA-N 1 2 243.285 2.395 20 0 BEADLO Cc1conc1NCc1cccc2[nH+]ccn21 ZINC000191566013 357785251 /nfs/dbraw/zinc/78/52/51/357785251.db2.gz IPQMOYHKLRQGOP-UHFFFAOYSA-N 1 2 228.255 2.243 20 0 BEADLO COc1cccc2c1cc[nH+]c2NCC(C)(C)O ZINC000234908650 357836685 /nfs/dbraw/zinc/83/66/85/357836685.db2.gz IBRLCVHZPKXGSY-UHFFFAOYSA-N 1 2 246.310 2.426 20 0 BEADLO COc1cccc2c1cc[nH+]c2N[C@H]1CCOC1 ZINC000235045754 357842036 /nfs/dbraw/zinc/84/20/36/357842036.db2.gz SCWFOAJGSXUKCU-JTQLQIEISA-N 1 2 244.294 2.444 20 0 BEADLO CCOC(=O)C[N@H+](CC)CCSC(C)C ZINC000379809907 357910373 /nfs/dbraw/zinc/91/03/73/357910373.db2.gz NYRODDDGNLPPSR-UHFFFAOYSA-N 1 2 233.377 2.013 20 0 BEADLO CCOC(=O)C[N@@H+](CC)CCSC(C)C ZINC000379809907 357910376 /nfs/dbraw/zinc/91/03/76/357910376.db2.gz NYRODDDGNLPPSR-UHFFFAOYSA-N 1 2 233.377 2.013 20 0 BEADLO c1coc(CC2C[NH+](Cc3nccs3)C2)c1 ZINC000628432595 357918947 /nfs/dbraw/zinc/91/89/47/357918947.db2.gz KCNBZMYNUUUMDP-UHFFFAOYSA-N 1 2 234.324 2.411 20 0 BEADLO Cc1nc(C[NH2+][C@@H](C)c2cnccn2)cs1 ZINC000070025501 491117425 /nfs/dbraw/zinc/11/74/25/491117425.db2.gz PZERYCGLYNLOCT-QMMMGPOBSA-N 1 2 234.328 2.092 20 0 BEADLO Fc1ccccc1C[NH2+]Cc1ccno1 ZINC000219222392 357988928 /nfs/dbraw/zinc/98/89/28/357988928.db2.gz PDXJDMSBQBNECH-UHFFFAOYSA-N 1 2 206.220 2.104 20 0 BEADLO Fc1cnccc1C[NH+]1CC(Cc2ccco2)C1 ZINC000628433016 357991532 /nfs/dbraw/zinc/99/15/32/357991532.db2.gz CDGQYMJKDXAWKH-UHFFFAOYSA-N 1 2 246.285 2.488 20 0 BEADLO CCn1ccnc1[C@H](C)NCc1[nH]c(C)c(C)[nH+]1 ZINC000584540882 358049067 /nfs/dbraw/zinc/04/90/67/358049067.db2.gz OIEZDDHGZMMPJY-NSHDSACASA-N 1 2 247.346 2.094 20 0 BEADLO C[N@H+](CCc1cccs1)CC(F)F ZINC000103487471 358068860 /nfs/dbraw/zinc/06/88/60/358068860.db2.gz CRAMJQYACUCZRT-UHFFFAOYSA-N 1 2 205.273 2.488 20 0 BEADLO C[N@@H+](CCc1cccs1)CC(F)F ZINC000103487471 358068861 /nfs/dbraw/zinc/06/88/61/358068861.db2.gz CRAMJQYACUCZRT-UHFFFAOYSA-N 1 2 205.273 2.488 20 0 BEADLO CC(C)n1ncnc1C[NH2+]Cc1ccsc1 ZINC000083978140 491120356 /nfs/dbraw/zinc/12/03/56/491120356.db2.gz NXPWBFSBLANBPW-UHFFFAOYSA-N 1 2 236.344 2.210 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@H]1CCC(C)(C)C1 ZINC000583881014 358115079 /nfs/dbraw/zinc/11/50/79/358115079.db2.gz PSSIBNJRXPLPLC-MNOVXSKESA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@H]1CCC(C)(C)C1 ZINC000583881014 358115082 /nfs/dbraw/zinc/11/50/82/358115082.db2.gz PSSIBNJRXPLPLC-MNOVXSKESA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H](c1csnn1)[NH+]1CCC(C)(F)CC1 ZINC000640071474 358162029 /nfs/dbraw/zinc/16/20/29/358162029.db2.gz OHHOLKPIHYUJGI-QMMMGPOBSA-N 1 2 229.324 2.423 20 0 BEADLO CC(C)c1nc(N(C)CC(C)(C)CO)cc[nH+]1 ZINC000450650941 202224602 /nfs/dbraw/zinc/22/46/02/202224602.db2.gz DEPYSPODNLSYST-UHFFFAOYSA-N 1 2 237.347 2.055 20 0 BEADLO c1c(CN2CCCCCO2)[nH+]c2ccccn12 ZINC000640122388 358201994 /nfs/dbraw/zinc/20/19/94/358201994.db2.gz QPVYWIMNGGMZDA-UHFFFAOYSA-N 1 2 231.299 2.252 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H](C)C(F)F ZINC000640129071 358207288 /nfs/dbraw/zinc/20/72/88/358207288.db2.gz SXURGQDCPFTGAK-QMMMGPOBSA-N 1 2 243.257 2.474 20 0 BEADLO Cc1ncc([C@H](C)[NH2+]Cc2nccn2C)s1 ZINC000090407850 491126326 /nfs/dbraw/zinc/12/63/26/491126326.db2.gz GBDJWXPWSVKVMM-QMMMGPOBSA-N 1 2 236.344 2.036 20 0 BEADLO O[C@@H]1CCC[C@H]1[C@@H]1CCCN1c1cccc[nH+]1 ZINC000450706323 202240225 /nfs/dbraw/zinc/24/02/25/202240225.db2.gz OPKAWDNQBBSHKO-RWMBFGLXSA-N 1 2 232.327 2.211 20 0 BEADLO CC[C@](C)(CNc1cc[nH+]c2ccncc12)OC ZINC000450720687 202243394 /nfs/dbraw/zinc/24/33/94/202243394.db2.gz ZHFRBJRESKACME-CQSZACIVSA-N 1 2 245.326 2.279 20 0 BEADLO Cc1cncc(NCCc2[nH+]cccc2C)n1 ZINC000450737990 202250952 /nfs/dbraw/zinc/25/09/52/202250952.db2.gz LIBRESBYCYOCLQ-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO C[C@@H](NC(=O)[C@H](C)c1ccccc1)c1[nH]cc[nH+]1 ZINC000227874096 358364359 /nfs/dbraw/zinc/36/43/59/358364359.db2.gz MBSIYQIZOMFBQJ-GHMZBOCLSA-N 1 2 243.310 2.391 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)C=C1CCCCC1 ZINC000055996546 363608459 /nfs/dbraw/zinc/60/84/59/363608459.db2.gz TWFWYWSYOWRJEA-GFCCVEGCSA-N 1 2 247.342 2.278 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@H](C)c1ccccc1C ZINC000035014285 358450362 /nfs/dbraw/zinc/45/03/62/358450362.db2.gz AHPWAAINTFLQLH-MNOVXSKESA-N 1 2 221.300 2.207 20 0 BEADLO CC[C@H](OC)c1nc(Cc2ccc[nH+]c2C)no1 ZINC000351236252 366457238 /nfs/dbraw/zinc/45/72/38/366457238.db2.gz PJHBIPATJKNPEO-NSHDSACASA-N 1 2 247.298 2.461 20 0 BEADLO Cc1noc(C[N@@H+](C)Cc2sccc2C)n1 ZINC000042473758 358524496 /nfs/dbraw/zinc/52/44/96/358524496.db2.gz FTKQLSHFGHVBGL-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1noc(C[N@H+](C)Cc2sccc2C)n1 ZINC000042473758 358524501 /nfs/dbraw/zinc/52/45/01/358524501.db2.gz FTKQLSHFGHVBGL-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO CCc1cn([C@H]2CCC(C)(C)C2=O)c[nH+]1 ZINC001641418884 1172248379 /nfs/dbraw/zinc/24/83/79/1172248379.db2.gz SKIOBEQBCCBCCG-JTQLQIEISA-N 1 2 206.289 2.376 20 0 BEADLO CCc1[nH+]c2ccccc2n1Cc1nc(C)no1 ZINC000131247193 358666699 /nfs/dbraw/zinc/66/66/99/358666699.db2.gz PPMZKNJRHBVJHS-UHFFFAOYSA-N 1 2 242.282 2.338 20 0 BEADLO CC(C)c1cc(N[C@@H](C)Cn2cc[nH+]c2)ncn1 ZINC000049235901 358676847 /nfs/dbraw/zinc/67/68/47/358676847.db2.gz AFWONZMCFDQWCD-NSHDSACASA-N 1 2 245.330 2.297 20 0 BEADLO CC[C@@H](OC)C(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC000049447124 358689301 /nfs/dbraw/zinc/68/93/01/358689301.db2.gz LFCHJKQPGHFUAE-GFCCVEGCSA-N 1 2 247.298 2.235 20 0 BEADLO CC[C@@H](OC)C(=O)Nc1ccc2[nH+]c(C)[nH]c2c1 ZINC000049447124 358689303 /nfs/dbraw/zinc/68/93/03/358689303.db2.gz LFCHJKQPGHFUAE-GFCCVEGCSA-N 1 2 247.298 2.235 20 0 BEADLO COC(=O)C[N@H+](Cc1ccc(C)c(C)c1)C1CC1 ZINC000133111158 358745154 /nfs/dbraw/zinc/74/51/54/358745154.db2.gz QSNMXQMICATOAC-UHFFFAOYSA-N 1 2 247.338 2.441 20 0 BEADLO COC(=O)C[N@@H+](Cc1ccc(C)c(C)c1)C1CC1 ZINC000133111158 358745155 /nfs/dbraw/zinc/74/51/55/358745155.db2.gz QSNMXQMICATOAC-UHFFFAOYSA-N 1 2 247.338 2.441 20 0 BEADLO CC(C)c1nc(N2CCO[C@H](C)[C@H]2C)cc[nH+]1 ZINC000132250968 358713611 /nfs/dbraw/zinc/71/36/11/358713611.db2.gz VXMFFCPLJBKRKH-GHMZBOCLSA-N 1 2 235.331 2.214 20 0 BEADLO Cc1nnsc1C[N@@H+](C)[C@H](C)c1ccccn1 ZINC000578239961 366466457 /nfs/dbraw/zinc/46/64/57/366466457.db2.gz ARJKRUIKTLSVMR-SNVBAGLBSA-N 1 2 248.355 2.435 20 0 BEADLO Cc1nnsc1C[N@H+](C)[C@H](C)c1ccccn1 ZINC000578239961 366466461 /nfs/dbraw/zinc/46/64/61/366466461.db2.gz ARJKRUIKTLSVMR-SNVBAGLBSA-N 1 2 248.355 2.435 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@@H](CC)C2)no1 ZINC000054316227 358857988 /nfs/dbraw/zinc/85/79/88/358857988.db2.gz MOSAUEPSYRWMOL-SNVBAGLBSA-N 1 2 223.320 2.254 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@@H](CC)C2)no1 ZINC000054316227 358857992 /nfs/dbraw/zinc/85/79/92/358857992.db2.gz MOSAUEPSYRWMOL-SNVBAGLBSA-N 1 2 223.320 2.254 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@H](CC)C2)no1 ZINC000054316226 358858314 /nfs/dbraw/zinc/85/83/14/358858314.db2.gz MOSAUEPSYRWMOL-JTQLQIEISA-N 1 2 223.320 2.254 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@H](CC)C2)no1 ZINC000054316226 358858316 /nfs/dbraw/zinc/85/83/16/358858316.db2.gz MOSAUEPSYRWMOL-JTQLQIEISA-N 1 2 223.320 2.254 20 0 BEADLO CCCCc1nc(C[N@H+](CC)C2CC2)no1 ZINC000053607478 358835718 /nfs/dbraw/zinc/83/57/18/358835718.db2.gz KPAVUWUJHAXEEB-UHFFFAOYSA-N 1 2 223.320 2.397 20 0 BEADLO CCCCc1nc(C[N@@H+](CC)C2CC2)no1 ZINC000053607478 358835722 /nfs/dbraw/zinc/83/57/22/358835722.db2.gz KPAVUWUJHAXEEB-UHFFFAOYSA-N 1 2 223.320 2.397 20 0 BEADLO CCc1nnc(C[N@H+](C)Cc2cccc(F)c2)o1 ZINC000054114353 358853942 /nfs/dbraw/zinc/85/39/42/358853942.db2.gz PAJCSPYUJWDLPW-UHFFFAOYSA-N 1 2 249.289 2.403 20 0 BEADLO CCc1nnc(C[N@@H+](C)Cc2cccc(F)c2)o1 ZINC000054114353 358853949 /nfs/dbraw/zinc/85/39/49/358853949.db2.gz PAJCSPYUJWDLPW-UHFFFAOYSA-N 1 2 249.289 2.403 20 0 BEADLO Cc1ccncc1[C@H](C)[NH2+]CC(F)F ZINC000308679624 491137699 /nfs/dbraw/zinc/13/76/99/491137699.db2.gz XGKBCKVSOSBOII-QMMMGPOBSA-N 1 2 200.232 2.306 20 0 BEADLO CCOc1cc(N[C@@H](CC)c2[nH]cc[nH+]2)ncn1 ZINC000139841686 358914536 /nfs/dbraw/zinc/91/45/36/358914536.db2.gz GHVITQJSDXVYFO-VIFPVBQESA-N 1 2 247.302 2.162 20 0 BEADLO C[C@@H](Cc1nc(C(C)(C)C)no1)n1cc[nH+]c1 ZINC000351396854 366521541 /nfs/dbraw/zinc/52/15/41/366521541.db2.gz FBYMFRHSWLJVFY-VIFPVBQESA-N 1 2 234.303 2.367 20 0 BEADLO Cc1nc(NC[C@@H]2Cc3ccccc3O2)cc[nH+]1 ZINC000054935974 358879628 /nfs/dbraw/zinc/87/96/28/358879628.db2.gz UPTPAQUTMPUVLI-LBPRGKRZSA-N 1 2 241.294 2.201 20 0 BEADLO Cc1nc(NCCOc2ccccc2)cc[nH+]1 ZINC000054936333 358879751 /nfs/dbraw/zinc/87/97/51/358879751.db2.gz RWWWNDKVBWKDEX-UHFFFAOYSA-N 1 2 229.283 2.276 20 0 BEADLO COc1cccc(CNc2cc[nH+]c(C)n2)c1 ZINC000054935916 358879870 /nfs/dbraw/zinc/87/98/70/358879870.db2.gz WNAZFOLNGXDYAU-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO Cc1ccc(-c2n[nH]cc2C[NH2+]CC(F)F)o1 ZINC000136577491 358881728 /nfs/dbraw/zinc/88/17/28/358881728.db2.gz OZSOFDQMRUAJSB-UHFFFAOYSA-N 1 2 241.241 2.333 20 0 BEADLO CC(C)CCOCC[NH+]1CCN(C(C)C)CC1 ZINC000056283541 358897229 /nfs/dbraw/zinc/89/72/29/358897229.db2.gz DXNQUCJRMFYNSE-UHFFFAOYSA-N 1 2 242.407 2.075 20 0 BEADLO Cc1cc(C[N@@H+](C)CCOCCC(C)C)no1 ZINC000056493252 358898101 /nfs/dbraw/zinc/89/81/01/358898101.db2.gz DAFJNONGUSKQJE-UHFFFAOYSA-N 1 2 240.347 2.478 20 0 BEADLO Cc1cc(C[N@H+](C)CCOCCC(C)C)no1 ZINC000056493252 358898103 /nfs/dbraw/zinc/89/81/03/358898103.db2.gz DAFJNONGUSKQJE-UHFFFAOYSA-N 1 2 240.347 2.478 20 0 BEADLO CC[C@H](NC(=O)c1occc1C)c1[nH]cc[nH+]1 ZINC000140601050 358923745 /nfs/dbraw/zinc/92/37/45/358923745.db2.gz RDQIETAQTQHFNR-VIFPVBQESA-N 1 2 233.271 2.192 20 0 BEADLO CC[C@H](NC(=O)c1ccoc1C)c1[nH]cc[nH+]1 ZINC000140665660 358923833 /nfs/dbraw/zinc/92/38/33/358923833.db2.gz VGLSBZMZZUMKDD-JTQLQIEISA-N 1 2 233.271 2.192 20 0 BEADLO Cc1nc(NCc2ccc3c(c2)OCO3)cc[nH+]1 ZINC000061674946 358936586 /nfs/dbraw/zinc/93/65/86/358936586.db2.gz ZMTQOHNNFPTTHY-UHFFFAOYSA-N 1 2 243.266 2.126 20 0 BEADLO C(C[N@@H+]1OC2CCC1CC2)C1CCOCC1 ZINC000640230721 358943429 /nfs/dbraw/zinc/94/34/29/358943429.db2.gz SADQFLISVSEOAA-UHFFFAOYSA-N 1 2 225.332 2.362 20 0 BEADLO C(C[N@H+]1OC2CCC1CC2)C1CCOCC1 ZINC000640230721 358943430 /nfs/dbraw/zinc/94/34/30/358943430.db2.gz SADQFLISVSEOAA-UHFFFAOYSA-N 1 2 225.332 2.362 20 0 BEADLO Cc1nc(N2CCCO[C@H](C)C2)c(C)c(C)[nH+]1 ZINC000177824488 134300270 /nfs/dbraw/zinc/30/02/70/134300270.db2.gz JAXOECALNCYNDU-SECBINFHSA-N 1 2 235.331 2.017 20 0 BEADLO C(C[C@@H]1CCOC1)C[N@@H+]1OC2CCC1CC2 ZINC000640232894 358957646 /nfs/dbraw/zinc/95/76/46/358957646.db2.gz ZKOIDAJECRHUTQ-PNESKVBLSA-N 1 2 225.332 2.362 20 0 BEADLO C(C[C@@H]1CCOC1)C[N@H+]1OC2CCC1CC2 ZINC000640232894 358957649 /nfs/dbraw/zinc/95/76/49/358957649.db2.gz ZKOIDAJECRHUTQ-PNESKVBLSA-N 1 2 225.332 2.362 20 0 BEADLO CC(C)C[N@H+](C)Cc1noc(C(C)C)n1 ZINC000065960921 358991601 /nfs/dbraw/zinc/99/16/01/358991601.db2.gz JBBHKCAYVSCHKK-UHFFFAOYSA-N 1 2 211.309 2.281 20 0 BEADLO CC(C)C[N@@H+](C)Cc1noc(C(C)C)n1 ZINC000065960921 358991606 /nfs/dbraw/zinc/99/16/06/358991606.db2.gz JBBHKCAYVSCHKK-UHFFFAOYSA-N 1 2 211.309 2.281 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)c1coc2ccccc12 ZINC000070991645 359069902 /nfs/dbraw/zinc/06/99/02/359069902.db2.gz GNUOLMHKVGUFQI-UHFFFAOYSA-N 1 2 241.250 2.086 20 0 BEADLO c1cn(-c2cccc(OCc3ccon3)c2)c[nH+]1 ZINC000072674460 359088775 /nfs/dbraw/zinc/08/87/75/359088775.db2.gz BQYXFHOCVRCGMZ-UHFFFAOYSA-N 1 2 241.250 2.439 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc3ccccc3n2)CCO1 ZINC000073516564 359102376 /nfs/dbraw/zinc/10/23/76/359102376.db2.gz WVNYWDDCUMBKOF-GFCCVEGCSA-N 1 2 242.322 2.456 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc3ccccc3n2)CCO1 ZINC000073516564 359102380 /nfs/dbraw/zinc/10/23/80/359102380.db2.gz WVNYWDDCUMBKOF-GFCCVEGCSA-N 1 2 242.322 2.456 20 0 BEADLO FC(F)C1([NH2+]Cc2cn[nH]c2)CCCC1 ZINC000308868866 491139224 /nfs/dbraw/zinc/13/92/24/491139224.db2.gz IBOWFDIGUKWKSP-UHFFFAOYSA-N 1 2 215.247 2.077 20 0 BEADLO Cc1ncc(C[N@H+]2CCO[C@H](C)[C@H]2C)s1 ZINC000248183228 359258939 /nfs/dbraw/zinc/25/89/39/359258939.db2.gz WVCTWPLEMJIOPS-RKDXNWHRSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ncc(C[N@@H+]2CCO[C@H](C)[C@H]2C)s1 ZINC000248183228 359258943 /nfs/dbraw/zinc/25/89/43/359258943.db2.gz WVCTWPLEMJIOPS-RKDXNWHRSA-N 1 2 226.345 2.061 20 0 BEADLO C[C@H]1CC[N@H+](Cc2noc(C3CC3)n2)[C@H]1C ZINC000248368017 359271188 /nfs/dbraw/zinc/27/11/88/359271188.db2.gz USLWZHWWGGJGIT-IUCAKERBSA-N 1 2 221.304 2.177 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2noc(C3CC3)n2)[C@H]1C ZINC000248368017 359271190 /nfs/dbraw/zinc/27/11/90/359271190.db2.gz USLWZHWWGGJGIT-IUCAKERBSA-N 1 2 221.304 2.177 20 0 BEADLO CC(C)[C@H]1C[C@H](Nc2c[nH]c[nH+]2)CS1 ZINC000306220854 359346816 /nfs/dbraw/zinc/34/68/16/359346816.db2.gz OXZMOBBVRBMCCR-DTWKUNHWSA-N 1 2 211.334 2.352 20 0 BEADLO CCCC[C@H](C(=O)OC)[N@@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000611501616 359383412 /nfs/dbraw/zinc/38/34/12/359383412.db2.gz FUDQYADZTHFAME-SDDRHHMPSA-N 1 2 245.338 2.398 20 0 BEADLO CCCC[C@H](C(=O)OC)[N@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000611501616 359383415 /nfs/dbraw/zinc/38/34/15/359383415.db2.gz FUDQYADZTHFAME-SDDRHHMPSA-N 1 2 245.338 2.398 20 0 BEADLO C[C@@H](C(=O)OC(C)(C)C)[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000611502493 359385355 /nfs/dbraw/zinc/38/53/55/359385355.db2.gz UEDYBLHZQYPSGU-VWYCJHECSA-N 1 2 245.338 2.397 20 0 BEADLO C[C@@H](C(=O)OC(C)(C)C)[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000611502493 359385357 /nfs/dbraw/zinc/38/53/57/359385357.db2.gz UEDYBLHZQYPSGU-VWYCJHECSA-N 1 2 245.338 2.397 20 0 BEADLO COC(=O)C[N@@H+]1CCC[C@H]1/C=C\c1ccccc1 ZINC000611554680 359396589 /nfs/dbraw/zinc/39/65/89/359396589.db2.gz RZWYGUBMAMPRSK-CMUBDUJZSA-N 1 2 245.322 2.337 20 0 BEADLO COC(=O)C[N@H+]1CCC[C@H]1/C=C\c1ccccc1 ZINC000611554680 359396594 /nfs/dbraw/zinc/39/65/94/359396594.db2.gz RZWYGUBMAMPRSK-CMUBDUJZSA-N 1 2 245.322 2.337 20 0 BEADLO CCn1cc(C[N@H+](C)Cc2cncc(F)c2)cn1 ZINC000572432516 359498316 /nfs/dbraw/zinc/49/83/16/359498316.db2.gz IBORZWWXILMOSC-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO CCn1cc(C[N@@H+](C)Cc2cncc(F)c2)cn1 ZINC000572432516 359498320 /nfs/dbraw/zinc/49/83/20/359498320.db2.gz IBORZWWXILMOSC-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO Cc1onc(NC(=O)C[C@@H](C)n2cc[nH+]c2)c1C ZINC000580459984 359565807 /nfs/dbraw/zinc/56/58/07/359565807.db2.gz XXIUEGRFGNGSCW-MRVPVSSYSA-N 1 2 248.286 2.078 20 0 BEADLO COc1cccc(C[NH2+]Cc2ncc(C)s2)n1 ZINC000191213871 359538894 /nfs/dbraw/zinc/53/88/94/359538894.db2.gz LDPLKPJFCJDKCH-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO Fc1cccc2c1CC[C@H]2[NH2+]Cc1ncccn1 ZINC000580451531 359559514 /nfs/dbraw/zinc/55/95/14/359559514.db2.gz HBFUGTCIZRRABV-CYBMUJFWSA-N 1 2 243.285 2.393 20 0 BEADLO OC[C@@H]([C@H](Nc1cccc[nH+]1)C1CC1)C1CC1 ZINC000450778872 202264828 /nfs/dbraw/zinc/26/48/28/202264828.db2.gz NZFYQTBJVUZNSH-TZMCWYRMSA-N 1 2 232.327 2.291 20 0 BEADLO CO[C@H]1CCN(c2cc[nH+]c(C3CC3)n2)C[C@@H]1C ZINC000450780786 202264327 /nfs/dbraw/zinc/26/43/27/202264327.db2.gz YPORXNZATSOASP-JQWIXIFHSA-N 1 2 247.342 2.215 20 0 BEADLO CC(C)(CC(F)(F)F)[NH2+]Cc1csnn1 ZINC000308997203 491142136 /nfs/dbraw/zinc/14/21/36/491142136.db2.gz MYMJHBQMMHUUIX-UHFFFAOYSA-N 1 2 239.266 2.359 20 0 BEADLO CC(C)CC[C@H]1CCC[C@H]1[NH2+]Cc1c[nH]nn1 ZINC000450820174 202274866 /nfs/dbraw/zinc/27/48/66/202274866.db2.gz NLQGZRARUJWODW-DGCLKSJQSA-N 1 2 236.363 2.499 20 0 BEADLO CC(C)CC[C@H]1CCC[C@H]1[NH2+]Cc1cn[nH]n1 ZINC000450820174 202274870 /nfs/dbraw/zinc/27/48/70/202274870.db2.gz NLQGZRARUJWODW-DGCLKSJQSA-N 1 2 236.363 2.499 20 0 BEADLO CO[C@H]([C@@H](C)Nc1cc[nH+]c(C2CC2)n1)C1CC1 ZINC000450855728 202289874 /nfs/dbraw/zinc/28/98/74/202289874.db2.gz GRHCISYBUZYMMM-NOZJJQNGSA-N 1 2 247.342 2.001 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)CCc1cccnc1 ZINC000107288644 359738015 /nfs/dbraw/zinc/73/80/15/359738015.db2.gz TUZLBBFQEOPAGK-UHFFFAOYSA-N 1 2 241.294 2.356 20 0 BEADLO CO[C@H](C(=O)Nc1ccc(C)[nH+]c1C)C1CCC1 ZINC000612227309 359741000 /nfs/dbraw/zinc/74/10/00/359741000.db2.gz SFLPXVYNJCUOBD-ZDUSSCGKSA-N 1 2 248.326 2.452 20 0 BEADLO COCCSc1[nH+]cc2ccccn21 ZINC000057881290 359787331 /nfs/dbraw/zinc/78/73/31/359787331.db2.gz DLYAFQJLDATMOG-UHFFFAOYSA-N 1 2 208.286 2.073 20 0 BEADLO CC(C)=CCCNc1nc(C)[nH+]cc1C ZINC000578380241 366547692 /nfs/dbraw/zinc/54/76/92/366547692.db2.gz XLQODGJOFVKKBF-UHFFFAOYSA-N 1 2 205.305 2.284 20 0 BEADLO CCc1nc(N2CCCC[C@H]2COC)cc(C)[nH+]1 ZINC000450930811 202312725 /nfs/dbraw/zinc/31/27/25/202312725.db2.gz GDRMUEUOTLBIMN-LBPRGKRZSA-N 1 2 249.358 2.353 20 0 BEADLO COC[C@@H]1CCCN(c2cc[nH+]c(C)n2)CC1 ZINC000450945334 202317190 /nfs/dbraw/zinc/31/71/90/202317190.db2.gz KITLNFMCYRURNL-GFCCVEGCSA-N 1 2 235.331 2.038 20 0 BEADLO COC[C@@H]1CCCN(c2cc(C)[nH+]cn2)CC1 ZINC000450952175 202318138 /nfs/dbraw/zinc/31/81/38/202318138.db2.gz ZVYBSYXCDIJOQY-GFCCVEGCSA-N 1 2 235.331 2.038 20 0 BEADLO OCCC[C@@H]1CCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000450957374 202318673 /nfs/dbraw/zinc/31/86/73/202318673.db2.gz UIVSXGZPVPSUCR-LLVKDONJSA-N 1 2 245.326 2.162 20 0 BEADLO CC(C)c1nc(N2CC[C@H](CCCO)C2)cc[nH+]1 ZINC000450950834 202318679 /nfs/dbraw/zinc/31/86/79/202318679.db2.gz DQFUSXWPWALLNH-LBPRGKRZSA-N 1 2 249.358 2.199 20 0 BEADLO CC(C)CC1(C)CC[NH+](Cc2c[nH]nn2)CC1 ZINC000451042955 202336236 /nfs/dbraw/zinc/33/62/36/202336236.db2.gz RJTYLCIRLFTNAH-UHFFFAOYSA-N 1 2 236.363 2.453 20 0 BEADLO CC(C)CC1(C)CC[NH+](Cc2cnn[nH]2)CC1 ZINC000451042955 202336238 /nfs/dbraw/zinc/33/62/38/202336238.db2.gz RJTYLCIRLFTNAH-UHFFFAOYSA-N 1 2 236.363 2.453 20 0 BEADLO CC(C)CC1(C)CC[NH+](Cc2cn[nH]n2)CC1 ZINC000451042955 202336242 /nfs/dbraw/zinc/33/62/42/202336242.db2.gz RJTYLCIRLFTNAH-UHFFFAOYSA-N 1 2 236.363 2.453 20 0 BEADLO CC(C)(O)CNc1ccc(-n2cc[nH+]c2)cc1 ZINC000578436549 366566768 /nfs/dbraw/zinc/56/67/68/366566768.db2.gz ZOCOYPKBKFHAGX-UHFFFAOYSA-N 1 2 231.299 2.055 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)N[C@H](c1[nH]cc[nH+]1)C(C)C ZINC000451101259 202351837 /nfs/dbraw/zinc/35/18/37/202351837.db2.gz BOSGAVCTIYFNIE-MXWKQRLJSA-N 1 2 235.331 2.269 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000578515567 366585655 /nfs/dbraw/zinc/58/56/55/366585655.db2.gz ZBFWCSIPYUWIMD-HZMBPMFUSA-N 1 2 249.358 2.443 20 0 BEADLO CC(C)[N@H+](Cc1nc2ccccc2o1)C1COC1 ZINC000451119528 202356618 /nfs/dbraw/zinc/35/66/18/202356618.db2.gz FQALSBUAYWPWPC-UHFFFAOYSA-N 1 2 246.310 2.437 20 0 BEADLO CC(C)[N@@H+](Cc1nc2ccccc2o1)C1COC1 ZINC000451119528 202356620 /nfs/dbraw/zinc/35/66/20/202356620.db2.gz FQALSBUAYWPWPC-UHFFFAOYSA-N 1 2 246.310 2.437 20 0 BEADLO CCC(C)(C)NC(=O)C[N@@H+]1CCC[C@](C)(F)C1 ZINC000451123384 202359852 /nfs/dbraw/zinc/35/98/52/202359852.db2.gz VKDVEYSCGAYLTA-ZDUSSCGKSA-N 1 2 244.354 2.115 20 0 BEADLO CCC(C)(C)NC(=O)C[N@H+]1CCC[C@](C)(F)C1 ZINC000451123384 202359853 /nfs/dbraw/zinc/35/98/53/202359853.db2.gz VKDVEYSCGAYLTA-ZDUSSCGKSA-N 1 2 244.354 2.115 20 0 BEADLO CCCc1nc(C)c(C[N@@H+]2CC[C@H](F)C2)o1 ZINC000451195517 202376318 /nfs/dbraw/zinc/37/63/18/202376318.db2.gz LXQUXBDWSHYMRE-JTQLQIEISA-N 1 2 226.295 2.479 20 0 BEADLO CCCc1nc(C)c(C[N@H+]2CC[C@H](F)C2)o1 ZINC000451195517 202376320 /nfs/dbraw/zinc/37/63/20/202376320.db2.gz LXQUXBDWSHYMRE-JTQLQIEISA-N 1 2 226.295 2.479 20 0 BEADLO CC(C)(O)CNc1cc2ccccc2c[nH+]1 ZINC000631096793 359909621 /nfs/dbraw/zinc/90/96/21/359909621.db2.gz KRSHYYQXMSHHKF-UHFFFAOYSA-N 1 2 216.284 2.418 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC1CC(C(C)(C)C)C1 ZINC000578806368 366650885 /nfs/dbraw/zinc/65/08/85/366650885.db2.gz HSJPZQGAZRBDMW-UHFFFAOYSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)NC1CC(C(C)(C)C)C1 ZINC000578806368 366650891 /nfs/dbraw/zinc/65/08/91/366650891.db2.gz HSJPZQGAZRBDMW-UHFFFAOYSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)[C@H]2CC=CCC2)[nH+]1 ZINC000578899845 366671637 /nfs/dbraw/zinc/67/16/37/366671637.db2.gz DPRICMPCBZTDKI-NSHDSACASA-N 1 2 247.342 2.426 20 0 BEADLO CC[C@@]1(C)CCN(C(=O)[C@H](C)Cc2c[nH+]c[nH]2)C1 ZINC000578905800 366672431 /nfs/dbraw/zinc/67/24/31/366672431.db2.gz JNGCDLKDAVEXAB-RISCZKNCSA-N 1 2 249.358 2.237 20 0 BEADLO CC[C@@]1(C)CCN(C(=O)[C@H](C)Cc2c[nH]c[nH+]2)C1 ZINC000578905800 366672438 /nfs/dbraw/zinc/67/24/38/366672438.db2.gz JNGCDLKDAVEXAB-RISCZKNCSA-N 1 2 249.358 2.237 20 0 BEADLO CCn1ncnc1C[NH2+][C@H](C)c1ccc(F)cc1 ZINC000088590511 359969188 /nfs/dbraw/zinc/96/91/88/359969188.db2.gz UVJHLICPLXYDFM-SNVBAGLBSA-N 1 2 248.305 2.288 20 0 BEADLO CSc1ccccc1C(=O)NCc1c[nH+]c[nH]1 ZINC000088753093 359975545 /nfs/dbraw/zinc/97/55/45/359975545.db2.gz OKLOQSMZMOVSKT-UHFFFAOYSA-N 1 2 247.323 2.062 20 0 BEADLO CSc1ccccc1C(=O)NCc1c[nH]c[nH+]1 ZINC000088753093 359975548 /nfs/dbraw/zinc/97/55/48/359975548.db2.gz OKLOQSMZMOVSKT-UHFFFAOYSA-N 1 2 247.323 2.062 20 0 BEADLO CC[C@H](C(=O)NCc1c[nH+]c[nH]1)c1ccccc1 ZINC000088752961 359975849 /nfs/dbraw/zinc/97/58/49/359975849.db2.gz CNSJNWCHFROKHZ-ZDUSSCGKSA-N 1 2 243.310 2.220 20 0 BEADLO CC[C@H](C(=O)NCc1c[nH]c[nH+]1)c1ccccc1 ZINC000088752961 359975851 /nfs/dbraw/zinc/97/58/51/359975851.db2.gz CNSJNWCHFROKHZ-ZDUSSCGKSA-N 1 2 243.310 2.220 20 0 BEADLO COCCCCCSCCn1cc[nH+]c1 ZINC000090201408 360063339 /nfs/dbraw/zinc/06/33/39/360063339.db2.gz QMSSPYPIKKUNID-UHFFFAOYSA-N 1 2 228.361 2.433 20 0 BEADLO Cc1cc(C[NH2+]Cc2cncn2C(C)C)on1 ZINC000090208917 360065673 /nfs/dbraw/zinc/06/56/73/360065673.db2.gz LMPJLUNJYBIQCJ-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO CC1(C)C[N@H+](Cc2cccc3c2OCO3)CCO1 ZINC000091917398 360136102 /nfs/dbraw/zinc/13/61/02/360136102.db2.gz RBWGICNBNAOGGC-UHFFFAOYSA-N 1 2 249.310 2.026 20 0 BEADLO CC1(C)C[N@@H+](Cc2cccc3c2OCO3)CCO1 ZINC000091917398 360136111 /nfs/dbraw/zinc/13/61/11/360136111.db2.gz RBWGICNBNAOGGC-UHFFFAOYSA-N 1 2 249.310 2.026 20 0 BEADLO Cn1ncc2c1nc[nH+]c2NC1C(C)(C)C1(C)C ZINC000092817534 360201693 /nfs/dbraw/zinc/20/16/93/360201693.db2.gz NEXIWVRYXRMCHG-UHFFFAOYSA-N 1 2 245.330 2.210 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccnc2C)no1 ZINC000092254900 360159237 /nfs/dbraw/zinc/15/92/37/360159237.db2.gz RGMLFIFEJLYEEN-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccnc2C)no1 ZINC000092254900 360159243 /nfs/dbraw/zinc/15/92/43/360159243.db2.gz RGMLFIFEJLYEEN-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO C[N@H+](Cc1cc(F)cc(F)c1)Cc1cnccn1 ZINC000092590780 360184961 /nfs/dbraw/zinc/18/49/61/360184961.db2.gz KZUWGPGUWGKGRJ-UHFFFAOYSA-N 1 2 249.264 2.387 20 0 BEADLO C[N@@H+](Cc1cc(F)cc(F)c1)Cc1cnccn1 ZINC000092590780 360184966 /nfs/dbraw/zinc/18/49/66/360184966.db2.gz KZUWGPGUWGKGRJ-UHFFFAOYSA-N 1 2 249.264 2.387 20 0 BEADLO COC(=O)c1ccc(CNc2ccc[nH+]c2C)[nH]1 ZINC000093085992 360216093 /nfs/dbraw/zinc/21/60/93/360216093.db2.gz GMWVALUDGYFNSH-UHFFFAOYSA-N 1 2 245.282 2.117 20 0 BEADLO CCOC(=O)C(C)(C)[N@H+](C)Cc1occc1C ZINC000093359584 360236933 /nfs/dbraw/zinc/23/69/33/360236933.db2.gz UNHJMVITNNFXLV-UHFFFAOYSA-N 1 2 239.315 2.362 20 0 BEADLO CCOC(=O)C(C)(C)[N@@H+](C)Cc1occc1C ZINC000093359584 360236934 /nfs/dbraw/zinc/23/69/34/360236934.db2.gz UNHJMVITNNFXLV-UHFFFAOYSA-N 1 2 239.315 2.362 20 0 BEADLO c1[nH]cc(NC2CCC3(CCCO3)CC2)[nH+]1 ZINC000309339920 491148046 /nfs/dbraw/zinc/14/80/46/491148046.db2.gz JYXOWDAGXJLRTE-UHFFFAOYSA-N 1 2 221.304 2.313 20 0 BEADLO COCc1ccc(C[N@@H+]2CCO[C@H](C)[C@H]2C)o1 ZINC000093417712 360240634 /nfs/dbraw/zinc/24/06/34/360240634.db2.gz CZHDEFIIGZSDLM-GHMZBOCLSA-N 1 2 239.315 2.035 20 0 BEADLO COCc1ccc(C[N@H+]2CCO[C@H](C)[C@H]2C)o1 ZINC000093417712 360240642 /nfs/dbraw/zinc/24/06/42/360240642.db2.gz CZHDEFIIGZSDLM-GHMZBOCLSA-N 1 2 239.315 2.035 20 0 BEADLO c1nc(C[NH2+]Cc2scnc2C2CC2)co1 ZINC000309346516 491148138 /nfs/dbraw/zinc/14/81/38/491148138.db2.gz LTJDODFFTVYYQK-UHFFFAOYSA-N 1 2 235.312 2.298 20 0 BEADLO Cc1cccc(CSc2nc(N)cc(C)[nH+]2)n1 ZINC000096731174 360353209 /nfs/dbraw/zinc/35/32/09/360353209.db2.gz GWWSZHCMBYZARP-UHFFFAOYSA-N 1 2 246.339 2.363 20 0 BEADLO Cc1cc[nH+]cc1NCc1ncnn1C(C)C ZINC000631098359 360338119 /nfs/dbraw/zinc/33/81/19/360338119.db2.gz NJUHCDJBOPSJFW-UHFFFAOYSA-N 1 2 231.303 2.175 20 0 BEADLO O=C(Nc1cc[nH+]cc1O)[C@H]1CCCC2(CC2)C1 ZINC000613086299 360347744 /nfs/dbraw/zinc/34/77/44/360347744.db2.gz KWWJBUMMUFCMAK-JTQLQIEISA-N 1 2 246.310 2.118 20 0 BEADLO Cc1ncc(C[N@@H+]2CCOC(C)(C)C2)s1 ZINC000098132814 360389226 /nfs/dbraw/zinc/38/92/26/360389226.db2.gz YESJLXAUXFBYQX-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1ncc(C[N@H+]2CCOC(C)(C)C2)s1 ZINC000098132814 360389230 /nfs/dbraw/zinc/38/92/30/360389230.db2.gz YESJLXAUXFBYQX-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO CC[C@H]([NH2+]Cc1ccn(C)n1)c1nccs1 ZINC000096811844 360356719 /nfs/dbraw/zinc/35/67/19/360356719.db2.gz KKKCMKFHURBJLG-JTQLQIEISA-N 1 2 236.344 2.118 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@H]1CCCC12CC2 ZINC000633780764 360496064 /nfs/dbraw/zinc/49/60/64/360496064.db2.gz VAYPRJCSUNPBOI-PWSUYJOCSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@H]1CCCC12CC2 ZINC000633780764 360496067 /nfs/dbraw/zinc/49/60/67/360496067.db2.gz VAYPRJCSUNPBOI-PWSUYJOCSA-N 1 2 247.342 2.037 20 0 BEADLO CCc1cc(NCCc2ccc[nH]2)nc[nH+]1 ZINC000309487904 491149624 /nfs/dbraw/zinc/14/96/24/491149624.db2.gz WAVWSSCZHZKWOA-UHFFFAOYSA-N 1 2 216.288 2.022 20 0 BEADLO COC[C@H](Nc1ccc(C)[nH+]c1)C1CC1 ZINC000154256114 360791745 /nfs/dbraw/zinc/79/17/45/360791745.db2.gz DGGBGMZFPCHKRM-LBPRGKRZSA-N 1 2 206.289 2.227 20 0 BEADLO C/C=C\CNC(=O)c1ccc2[nH+]c(C)n(C)c2c1 ZINC000629032662 360813909 /nfs/dbraw/zinc/81/39/09/360813909.db2.gz GHIBDDQBPIYRAY-PLNGDYQASA-N 1 2 243.310 2.188 20 0 BEADLO C[C@H]1C[C@@H]1CSc1[nH+]cnc2c1cnn2C ZINC000629113833 360882571 /nfs/dbraw/zinc/88/25/71/360882571.db2.gz ZQCPUPDREFYHPU-JGVFFNPUSA-N 1 2 234.328 2.111 20 0 BEADLO CC[C@@H]1C[C@@H](Nc2c[nH+]cc(N(C)C)c2)CO1 ZINC000631203729 360911048 /nfs/dbraw/zinc/91/10/48/360911048.db2.gz TUFVMMIMDIJRKI-DGCLKSJQSA-N 1 2 235.331 2.127 20 0 BEADLO Cc1nc(SCc2[nH+]ccn2C)oc1C ZINC000064653346 360952508 /nfs/dbraw/zinc/95/25/08/360952508.db2.gz SUCMVIQBBPEJPL-UHFFFAOYSA-N 1 2 223.301 2.317 20 0 BEADLO Cc1nc(NC(=O)C[C@@H](C)n2cc[nH+]c2)oc1C ZINC001641739928 1172290339 /nfs/dbraw/zinc/29/03/39/1172290339.db2.gz GCMUUHHIYIPPPB-MRVPVSSYSA-N 1 2 248.286 2.078 20 0 BEADLO C[C@@H](NC(=O)c1c[nH]cc1C1CC1)c1[nH]cc[nH+]1 ZINC000640354071 361099260 /nfs/dbraw/zinc/09/92/60/361099260.db2.gz HMFNAUDPXMTRNV-MRVPVSSYSA-N 1 2 244.298 2.106 20 0 BEADLO CCC[C@@H]1C[N@@H+]([C@@H](C)c2cnc(C)cn2)CCO1 ZINC000428296966 201007331 /nfs/dbraw/zinc/00/73/31/201007331.db2.gz ZDHAPUVJJNFAHT-QWHCGFSZSA-N 1 2 249.358 2.347 20 0 BEADLO CCC[C@@H]1C[N@H+]([C@@H](C)c2cnc(C)cn2)CCO1 ZINC000428296966 201007333 /nfs/dbraw/zinc/00/73/33/201007333.db2.gz ZDHAPUVJJNFAHT-QWHCGFSZSA-N 1 2 249.358 2.347 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H]2CCOC2(C)C)[nH+]1 ZINC000579075896 366704611 /nfs/dbraw/zinc/70/46/11/366704611.db2.gz OSTDWHIFCOULPK-SNVBAGLBSA-N 1 2 246.314 2.246 20 0 BEADLO Cc1nc(C(C)(C)[NH2+][C@@H]2C=CCCC2)no1 ZINC000066539494 361302003 /nfs/dbraw/zinc/30/20/03/361302003.db2.gz SUVXJWDTHYITQS-SNVBAGLBSA-N 1 2 221.304 2.311 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1nccc(N)n1)c1ccccc1 ZINC000579123375 366718052 /nfs/dbraw/zinc/71/80/52/366718052.db2.gz MJAJBHNLIJFSDE-GHMZBOCLSA-N 1 2 242.326 2.301 20 0 BEADLO CCN(CC1CC1)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000579013390 366695548 /nfs/dbraw/zinc/69/55/48/366695548.db2.gz BBGWINYOMIOFSI-LLVKDONJSA-N 1 2 235.331 2.093 20 0 BEADLO CN(C)c1[nH+]cccc1N(C)C(=O)CC1(C)CC1 ZINC000428521136 201025652 /nfs/dbraw/zinc/02/56/52/201025652.db2.gz ZAEGWEDUWVAABV-UHFFFAOYSA-N 1 2 247.342 2.301 20 0 BEADLO Cc1cc(N(C)[C@H]2CC[C@@H](C)C2)nc[nH+]1 ZINC000428669683 201034122 /nfs/dbraw/zinc/03/41/22/201034122.db2.gz QLUKEBHHPMZAAF-KOLCDFICSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1ncc(C[NH2+]Cc2nc(C)c(C)s2)o1 ZINC000397907386 363773338 /nfs/dbraw/zinc/77/33/38/363773338.db2.gz FTYYSWWEFMXEJP-UHFFFAOYSA-N 1 2 237.328 2.346 20 0 BEADLO Cn1c[nH+]cc1CNc1ccc(Cl)cn1 ZINC000181538032 366822586 /nfs/dbraw/zinc/82/25/86/366822586.db2.gz PCLAOICUGJIQFN-UHFFFAOYSA-N 1 2 222.679 2.081 20 0 BEADLO CC[C@@H]1CC[N@@H+]1Cc1cn(C(C)(C)C)nn1 ZINC000430188944 201151283 /nfs/dbraw/zinc/15/12/83/201151283.db2.gz CAKOSKFBWSVFST-LLVKDONJSA-N 1 2 222.336 2.017 20 0 BEADLO CC[C@@H]1CC[N@H+]1Cc1cn(C(C)(C)C)nn1 ZINC000430188944 201151287 /nfs/dbraw/zinc/15/12/87/201151287.db2.gz CAKOSKFBWSVFST-LLVKDONJSA-N 1 2 222.336 2.017 20 0 BEADLO Cc1nc2[nH]ccc2c(NC[C@@H](C)C(C)C)[nH+]1 ZINC000433803448 201193902 /nfs/dbraw/zinc/19/39/02/201193902.db2.gz MMPCLSDWHWLEML-SECBINFHSA-N 1 2 232.331 2.392 20 0 BEADLO CC[C@@H](Nc1cc[nH+]c(C)n1)[C@H]1CCCO1 ZINC000153191704 201225774 /nfs/dbraw/zinc/22/57/74/201225774.db2.gz UYCSCNBHRFJPIQ-GHMZBOCLSA-N 1 2 221.304 2.155 20 0 BEADLO CC[C@H](CO)Nc1ccc(-c2ccncc2)c[nH+]1 ZINC000629691604 361619515 /nfs/dbraw/zinc/61/95/15/361619515.db2.gz YMVRJBKQSVOFMM-CYBMUJFWSA-N 1 2 243.310 2.326 20 0 BEADLO Cc1[nH]cc(-c2cc(C)ccc2CO)[nH+]1 ZINC000629741271 361678288 /nfs/dbraw/zinc/67/82/88/361678288.db2.gz SSKZDIABINIHPV-UHFFFAOYSA-N 1 2 202.257 2.186 20 0 BEADLO FCC[NH2+][C@H](c1ccc(F)cc1)c1cnccn1 ZINC000436316609 201321017 /nfs/dbraw/zinc/32/10/17/201321017.db2.gz SKUPFSUQSGWYEX-CYBMUJFWSA-N 1 2 249.264 2.264 20 0 BEADLO C[N@H+](Cc1ccno1)Cc1cccc(O)c1 ZINC000080920927 363895839 /nfs/dbraw/zinc/89/58/39/363895839.db2.gz IREJUILUYRAFEL-UHFFFAOYSA-N 1 2 218.256 2.012 20 0 BEADLO C[N@@H+](Cc1ccno1)Cc1cccc(O)c1 ZINC000080920927 363895841 /nfs/dbraw/zinc/89/58/41/363895841.db2.gz IREJUILUYRAFEL-UHFFFAOYSA-N 1 2 218.256 2.012 20 0 BEADLO CCCCc1cc(NC[C@H](CC)OC)nc[nH+]1 ZINC000631278684 364044135 /nfs/dbraw/zinc/04/41/35/364044135.db2.gz KEVDTWBOVKVKHA-LBPRGKRZSA-N 1 2 237.347 2.078 20 0 BEADLO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1ccnc(C)n1 ZINC000092328081 541345536 /nfs/dbraw/zinc/34/55/36/541345536.db2.gz VLRTUGYPDUDVDT-MRVPVSSYSA-N 1 2 246.314 2.241 20 0 BEADLO Cc1cc(C[NH2+][C@H]2COCc3ccccc32)on1 ZINC000225996613 541361920 /nfs/dbraw/zinc/36/19/20/541361920.db2.gz SNFBXIMTNQJQCV-AWEZNQCLSA-N 1 2 244.294 2.344 20 0 BEADLO C=C/C(C)=C/CC(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000615159000 364551049 /nfs/dbraw/zinc/55/10/49/364551049.db2.gz XCNGCCHXWFJKPQ-NAZIUFLLSA-N 1 2 219.288 2.109 20 0 BEADLO CC[C@@H]1CCC[C@@H]1Nc1[nH+]cnc2c1cnn2C ZINC000268237114 364729077 /nfs/dbraw/zinc/72/90/77/364729077.db2.gz MQLHMWRWNVOXGQ-KOLCDFICSA-N 1 2 245.330 2.354 20 0 BEADLO CCc1cnc(C[NH2+]Cc2conc2C)s1 ZINC000293681258 364765588 /nfs/dbraw/zinc/76/55/88/364765588.db2.gz VOJQATCXWYEPHH-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO CC[C@@H]([NH2+]Cc1c[nH]nn1)c1ccc(OC)cc1 ZINC000296284214 364784723 /nfs/dbraw/zinc/78/47/23/364784723.db2.gz LFWNHVKZNSARGC-CYBMUJFWSA-N 1 2 246.314 2.054 20 0 BEADLO CC[C@@H]([NH2+]Cc1cn[nH]n1)c1ccc(OC)cc1 ZINC000296284214 364784731 /nfs/dbraw/zinc/78/47/31/364784731.db2.gz LFWNHVKZNSARGC-CYBMUJFWSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cccc(CNc2nc(C)[nH+]cc2C)c1 ZINC000573625135 364878110 /nfs/dbraw/zinc/87/81/10/364878110.db2.gz WTSHQARVEVMUJP-UHFFFAOYSA-N 1 2 227.311 2.436 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)Cc1ccco1 ZINC000573672750 364888545 /nfs/dbraw/zinc/88/85/45/364888545.db2.gz QCMRPFAHPNRAPO-UHFFFAOYSA-N 1 2 217.272 2.323 20 0 BEADLO CC(C)(O)CCSc1[nH+]cnc2[nH]ccc21 ZINC000573933464 364950665 /nfs/dbraw/zinc/95/06/65/364950665.db2.gz GNLAFAPPFJZYHR-UHFFFAOYSA-N 1 2 237.328 2.211 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccn(C)n1)c1ccoc1 ZINC000573901467 364939999 /nfs/dbraw/zinc/93/99/99/364939999.db2.gz MRGLKNIGJGZRCB-ZJUUUORDSA-N 1 2 219.288 2.425 20 0 BEADLO Cc1cc(C)c(NC(=O)NCCCF)c(C)[nH+]1 ZINC000574014527 364966415 /nfs/dbraw/zinc/96/64/15/364966415.db2.gz YMOJPGBXGRBEDF-UHFFFAOYSA-N 1 2 239.294 2.488 20 0 BEADLO CC(C)[C@@H]1CCN1C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000574092428 364986513 /nfs/dbraw/zinc/98/65/13/364986513.db2.gz TZBQTKCOGWMZSG-NEPJUHHUSA-N 1 2 235.331 2.091 20 0 BEADLO CC(C)C[C@H](C)NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000574216939 365013242 /nfs/dbraw/zinc/01/32/42/365013242.db2.gz NCKGVVNIYLXSTJ-QWRGUYRKSA-N 1 2 237.347 2.139 20 0 BEADLO CC(C)C[C@H](C)NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000574216939 365013247 /nfs/dbraw/zinc/01/32/47/365013247.db2.gz NCKGVVNIYLXSTJ-QWRGUYRKSA-N 1 2 237.347 2.139 20 0 BEADLO CC(C)C[C@@H](C)NC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000574216937 365013420 /nfs/dbraw/zinc/01/34/20/365013420.db2.gz NCKGVVNIYLXSTJ-GHMZBOCLSA-N 1 2 237.347 2.139 20 0 BEADLO CC(C)C[C@@H](C)NC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000574216937 365013424 /nfs/dbraw/zinc/01/34/24/365013424.db2.gz NCKGVVNIYLXSTJ-GHMZBOCLSA-N 1 2 237.347 2.139 20 0 BEADLO COCCOc1cccc(CNc2c[nH]c[nH+]2)c1 ZINC000574247206 365018312 /nfs/dbraw/zinc/01/83/12/365018312.db2.gz ZWKHLHCQTIKNOZ-UHFFFAOYSA-N 1 2 247.298 2.047 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC[C@H](F)C2)nc1 ZINC000574578765 365095101 /nfs/dbraw/zinc/09/51/01/365095101.db2.gz TYOLRGSYIHUMEK-NSHDSACASA-N 1 2 208.280 2.324 20 0 BEADLO Cc1ccc(C[N@H+]2CCC[C@H](F)C2)nc1 ZINC000574578765 365095107 /nfs/dbraw/zinc/09/51/07/365095107.db2.gz TYOLRGSYIHUMEK-NSHDSACASA-N 1 2 208.280 2.324 20 0 BEADLO OC1(CC[NH2+]c2ccc(-n3cccn3)cc2)CC1 ZINC000442855080 192996676 /nfs/dbraw/zinc/99/66/76/192996676.db2.gz LVCRTXKKDYDVPB-UHFFFAOYSA-N 1 2 243.310 2.199 20 0 BEADLO CC(C)(NC(=O)[C@H]1CC=CCC1)c1[nH]cc[nH+]1 ZINC000574763027 365138458 /nfs/dbraw/zinc/13/84/58/365138458.db2.gz GPNJUSADFVWQTE-JTQLQIEISA-N 1 2 233.315 2.117 20 0 BEADLO FC1(C[NH+]2CCN(Cc3ccccc3)CC2)CC1 ZINC000575039927 365174047 /nfs/dbraw/zinc/17/40/47/365174047.db2.gz VJNVYKVTLUAHIS-UHFFFAOYSA-N 1 2 248.345 2.306 20 0 BEADLO CC1(C)C[N@H+](Cc2cocn2)[C@@H]2CCC[C@H]2O1 ZINC000442972096 193007212 /nfs/dbraw/zinc/00/72/12/193007212.db2.gz WUYIVTDEOLXKTK-VXGBXAGGSA-N 1 2 236.315 2.207 20 0 BEADLO CC1(C)C[N@@H+](Cc2cocn2)[C@@H]2CCC[C@H]2O1 ZINC000442972096 193007214 /nfs/dbraw/zinc/00/72/14/193007214.db2.gz WUYIVTDEOLXKTK-VXGBXAGGSA-N 1 2 236.315 2.207 20 0 BEADLO CC(C)c1noc(C[N@@H+]2CCS[C@H](C)C2)n1 ZINC000171692396 365227442 /nfs/dbraw/zinc/22/74/42/365227442.db2.gz HXWHXIJESKWBJV-SECBINFHSA-N 1 2 241.360 2.130 20 0 BEADLO CC(C)c1noc(C[N@H+]2CCS[C@H](C)C2)n1 ZINC000171692396 365227447 /nfs/dbraw/zinc/22/74/47/365227447.db2.gz HXWHXIJESKWBJV-SECBINFHSA-N 1 2 241.360 2.130 20 0 BEADLO C[C@H]([NH+]=c1[nH]c2cccc(F)c2n1C)C1CC1 ZINC000443419828 193021420 /nfs/dbraw/zinc/02/14/20/193021420.db2.gz RMDOAUGSNDVPAR-QMMMGPOBSA-N 1 2 233.290 2.345 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)Nc1ccc(F)cc1 ZINC000622273616 370814023 /nfs/dbraw/zinc/81/40/23/370814023.db2.gz WKHXOCXAAUDESN-SECBINFHSA-N 1 2 247.273 2.366 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)Nc1ccc(F)cc1 ZINC000622273616 370814025 /nfs/dbraw/zinc/81/40/25/370814025.db2.gz WKHXOCXAAUDESN-SECBINFHSA-N 1 2 247.273 2.366 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)Nc1ccc(F)cc1 ZINC000622273617 370814169 /nfs/dbraw/zinc/81/41/69/370814169.db2.gz WKHXOCXAAUDESN-VIFPVBQESA-N 1 2 247.273 2.366 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)Nc1ccc(F)cc1 ZINC000622273617 370814172 /nfs/dbraw/zinc/81/41/72/370814172.db2.gz WKHXOCXAAUDESN-VIFPVBQESA-N 1 2 247.273 2.366 20 0 BEADLO Fc1ccc2c(c1)CC[C@H]2[NH2+]Cc1ncccn1 ZINC000575430538 365320394 /nfs/dbraw/zinc/32/03/94/365320394.db2.gz BVHKKSDWPLYLLG-CYBMUJFWSA-N 1 2 243.285 2.393 20 0 BEADLO CC[C@]1(C)CCC[N@H+](Cc2noc(C)n2)C1 ZINC000174193878 365476408 /nfs/dbraw/zinc/47/64/08/365476408.db2.gz LGVXINYAQLPTEM-GFCCVEGCSA-N 1 2 223.320 2.390 20 0 BEADLO CC[C@]1(C)CCC[N@@H+](Cc2noc(C)n2)C1 ZINC000174193878 365476415 /nfs/dbraw/zinc/47/64/15/365476415.db2.gz LGVXINYAQLPTEM-GFCCVEGCSA-N 1 2 223.320 2.390 20 0 BEADLO C[C@@H](Nc1cc(NC2CC2)[nH+]cn1)c1ccon1 ZINC000576008019 365446751 /nfs/dbraw/zinc/44/67/51/365446751.db2.gz JVEBPSLICUNIJA-MRVPVSSYSA-N 1 2 245.286 2.212 20 0 BEADLO C[C@@H](Nc1cc(NC2CC2)nc[nH+]1)c1ccon1 ZINC000576008019 365446755 /nfs/dbraw/zinc/44/67/55/365446755.db2.gz JVEBPSLICUNIJA-MRVPVSSYSA-N 1 2 245.286 2.212 20 0 BEADLO COc1ccc2c(c1)C[C@H](Nc1c[nH]c[nH+]1)CC2 ZINC000576156372 365502523 /nfs/dbraw/zinc/50/25/23/365502523.db2.gz MILKHBZLWHADMQ-GFCCVEGCSA-N 1 2 243.310 2.388 20 0 BEADLO CC1=C(C)C[C@H](C(=O)Nc2cc[nH+]cc2O)CC1 ZINC000576162216 365506222 /nfs/dbraw/zinc/50/62/22/365506222.db2.gz BFYNQTRZDLOZOR-LLVKDONJSA-N 1 2 246.310 2.284 20 0 BEADLO Cc1ncc(CN(C)c2nc(C)[nH+]cc2C)s1 ZINC000579780729 367005144 /nfs/dbraw/zinc/00/51/44/367005144.db2.gz FFLFNVRTMAYTNR-UHFFFAOYSA-N 1 2 248.355 2.495 20 0 BEADLO Cc1ccc(Cn2cccc(C)c2=O)c(C)[nH+]1 ZINC000185367037 367129384 /nfs/dbraw/zinc/12/93/84/367129384.db2.gz GSHDNECTBLPVOS-UHFFFAOYSA-N 1 2 228.295 2.217 20 0 BEADLO Cc1c[nH+]c(C)nc1NC[C@H](C)C(F)(F)F ZINC000579972961 367109539 /nfs/dbraw/zinc/10/95/39/367109539.db2.gz QWCITBFLXWBFEY-ZETCQYMHSA-N 1 2 233.237 2.126 20 0 BEADLO Cc1ccccc1[C@H]1C[N@@H+]([C@H]2CCOC2)CCO1 ZINC000580730333 367152262 /nfs/dbraw/zinc/15/22/62/367152262.db2.gz MRUMERYPIJIKLO-DZGCQCFKSA-N 1 2 247.338 2.157 20 0 BEADLO Cc1ccccc1[C@H]1C[N@H+]([C@H]2CCOC2)CCO1 ZINC000580730333 367152267 /nfs/dbraw/zinc/15/22/67/367152267.db2.gz MRUMERYPIJIKLO-DZGCQCFKSA-N 1 2 247.338 2.157 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H]2COCC2(C)C)[nH+]1 ZINC000581172371 367282909 /nfs/dbraw/zinc/28/29/09/367282909.db2.gz HXGYVLMLUGDSKD-SNVBAGLBSA-N 1 2 246.314 2.103 20 0 BEADLO Cc1ccc(C[NH2+]Cc2ncccn2)cc1C ZINC000581083714 367260154 /nfs/dbraw/zinc/26/01/54/367260154.db2.gz YICFDEBAGSTATF-UHFFFAOYSA-N 1 2 227.311 2.383 20 0 BEADLO C[C@@H](c1ccco1)[N@H+](C)CC(=O)c1cccn1C ZINC000194980735 367327916 /nfs/dbraw/zinc/32/79/16/367327916.db2.gz ZQUSXZUEWANIHY-NSHDSACASA-N 1 2 246.310 2.494 20 0 BEADLO C[C@@H](c1ccco1)[N@@H+](C)CC(=O)c1cccn1C ZINC000194980735 367327923 /nfs/dbraw/zinc/32/79/23/367327923.db2.gz ZQUSXZUEWANIHY-NSHDSACASA-N 1 2 246.310 2.494 20 0 BEADLO CC(C)(C)[C@@H](NCc1c[nH+]c[nH]1)C(F)(F)F ZINC000381358387 367387494 /nfs/dbraw/zinc/38/74/94/367387494.db2.gz CRHUUBWYRFWBMC-MRVPVSSYSA-N 1 2 235.253 2.476 20 0 BEADLO CC(C)(C)[C@@H](NCc1c[nH]c[nH+]1)C(F)(F)F ZINC000381358387 367387503 /nfs/dbraw/zinc/38/75/03/367387503.db2.gz CRHUUBWYRFWBMC-MRVPVSSYSA-N 1 2 235.253 2.476 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CSC[C@@H]1C)C(=O)OC(C)(C)C ZINC000381557507 367429398 /nfs/dbraw/zinc/42/93/98/367429398.db2.gz PSOZXBFVFMZCNU-IVZWLZJFSA-N 1 2 245.388 2.058 20 0 BEADLO Fc1cc(CNc2c[nH]c[nH+]2)cc(F)c1F ZINC000381820758 367460930 /nfs/dbraw/zinc/46/09/30/367460930.db2.gz KPTQMHYSBYSIHG-UHFFFAOYSA-N 1 2 227.189 2.439 20 0 BEADLO Cc1nc(N[C@H](C)CC(C)(C)C)cc[nH+]1 ZINC000384398357 367689535 /nfs/dbraw/zinc/68/95/35/367689535.db2.gz BZJHYQBPYJBIHJ-SECBINFHSA-N 1 2 207.321 2.444 20 0 BEADLO Cc1cc(N2CCC[C@@H](O)[C@H]2C)nc(C(C)C)[nH+]1 ZINC000385016713 367773777 /nfs/dbraw/zinc/77/37/77/367773777.db2.gz NXROFOLQDGRRMB-VXGBXAGGSA-N 1 2 249.358 2.258 20 0 BEADLO Cc1cc(N2CCC[C@@H](O)[C@@H]2C)nc(C(C)C)[nH+]1 ZINC000385016701 367773922 /nfs/dbraw/zinc/77/39/22/367773922.db2.gz NXROFOLQDGRRMB-NWDGAFQWSA-N 1 2 249.358 2.258 20 0 BEADLO CC/C=C\C[NH+]=c1[nH]c2ccccc2[nH]1 ZINC000385030980 367775899 /nfs/dbraw/zinc/77/58/99/367775899.db2.gz PTUGGHXHEUKHJX-UTCJRWHESA-N 1 2 201.273 2.363 20 0 BEADLO C[C@@H](CC(=O)N1CC[C@@H](C)[C@@H](C)C1)n1cc[nH+]c1 ZINC000581888948 367877872 /nfs/dbraw/zinc/87/78/72/367877872.db2.gz ZXWIGIOXQYZLGN-AGIUHOORSA-N 1 2 249.358 2.339 20 0 BEADLO C[C@@H]1[C@@H](C)[C@H](C)CN1c1cc(CO)cc[nH+]1 ZINC000399532593 368174596 /nfs/dbraw/zinc/17/45/96/368174596.db2.gz NRYKTFPUMJTLTD-OUAUKWLOSA-N 1 2 220.316 2.055 20 0 BEADLO CN(C)c1c[nH+]cc(NCc2cccn2C)c1 ZINC000630956311 368149428 /nfs/dbraw/zinc/14/94/28/368149428.db2.gz BJDFGIQTFNCBRP-UHFFFAOYSA-N 1 2 230.315 2.098 20 0 BEADLO Cc1ncccc1CNc1c[nH+]cc(N(C)C)c1 ZINC000630957150 368153522 /nfs/dbraw/zinc/15/35/22/368153522.db2.gz MUSXSJGLOKGENF-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO CC(C)(C)CC(=O)NCCNc1cccc[nH+]1 ZINC000063707161 368592960 /nfs/dbraw/zinc/59/29/60/368592960.db2.gz QFCLZPAYXNZWGA-UHFFFAOYSA-N 1 2 235.331 2.046 20 0 BEADLO Cc1ncsc1C[N@H+](C)Cc1ccno1 ZINC000066564718 368653748 /nfs/dbraw/zinc/65/37/48/368653748.db2.gz MERWSRTZVCSNQO-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO Cc1ncsc1C[N@@H+](C)Cc1ccno1 ZINC000066564718 368653749 /nfs/dbraw/zinc/65/37/49/368653749.db2.gz MERWSRTZVCSNQO-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO Cc1cc(C)c(CNC(=O)[C@@H](C)C2CC2)c[nH+]1 ZINC000456852854 202986143 /nfs/dbraw/zinc/98/61/43/202986143.db2.gz XLCOULSUIHPCGA-NSHDSACASA-N 1 2 232.327 2.361 20 0 BEADLO C[C@H](CC(C)(C)C)NC(=O)CCc1[nH]cc[nH+]1 ZINC000457195426 203017543 /nfs/dbraw/zinc/01/75/43/203017543.db2.gz QFAWGOUJCUTVKH-SNVBAGLBSA-N 1 2 237.347 2.283 20 0 BEADLO Nc1ccc(NC(=O)CC2=CCCCC2)c[nH+]1 ZINC000110535184 368768763 /nfs/dbraw/zinc/76/87/63/368768763.db2.gz PHPCETWEDXDIET-UHFFFAOYSA-N 1 2 231.299 2.493 20 0 BEADLO Cc1cccc(NC(=O)CCn2cc[nH+]c2)c1 ZINC000072615484 368775238 /nfs/dbraw/zinc/77/52/38/368775238.db2.gz UPLBVOGRYRHMDH-UHFFFAOYSA-N 1 2 229.283 2.220 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)[C@@H]2CCC2(C)C)c2[nH+]ccn21 ZINC000615963975 368800673 /nfs/dbraw/zinc/80/06/73/368800673.db2.gz UTWMJRCDCSKNRB-VWYCJHECSA-N 1 2 247.342 2.441 20 0 BEADLO Cc1noc(C[N@H+]2CCC[C@@H]2c2cccn2C)n1 ZINC000073641853 368812164 /nfs/dbraw/zinc/81/21/64/368812164.db2.gz AWBOOEHDEWZGOL-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1noc(C[N@@H+]2CCC[C@@H]2c2cccn2C)n1 ZINC000073641853 368812168 /nfs/dbraw/zinc/81/21/68/368812168.db2.gz AWBOOEHDEWZGOL-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO CCC[C@]1(C)CCCN(C(=O)Cn2cc[nH+]c2)C1 ZINC000074195111 368832821 /nfs/dbraw/zinc/83/28/21/368832821.db2.gz MGGQDOMLFPAWKG-CQSZACIVSA-N 1 2 249.358 2.312 20 0 BEADLO CCN(C(=O)Cn1cc[nH+]c1)[C@@H]1CCCC[C@@H]1C ZINC000073306487 368799690 /nfs/dbraw/zinc/79/96/90/368799690.db2.gz MTKVJUIBYAWVJT-QWHCGFSZSA-N 1 2 249.358 2.310 20 0 BEADLO CCc1nnc(C[N@H+](C)CCCSC)s1 ZINC000619623978 368941399 /nfs/dbraw/zinc/94/13/99/368941399.db2.gz MJDHSRJMPWUMTK-UHFFFAOYSA-N 1 2 245.417 2.285 20 0 BEADLO CCc1nnc(C[N@@H+](C)CCCSC)s1 ZINC000619623978 368941405 /nfs/dbraw/zinc/94/14/05/368941405.db2.gz MJDHSRJMPWUMTK-UHFFFAOYSA-N 1 2 245.417 2.285 20 0 BEADLO C[C@@H]1CCC(C)(C)N1C(=O)CCc1[nH]cc[nH+]1 ZINC000616164786 368999542 /nfs/dbraw/zinc/99/95/42/368999542.db2.gz IIPFFUNDYZMIOJ-SNVBAGLBSA-N 1 2 235.331 2.132 20 0 BEADLO COC(=O)[C@@](C)([NH2+][C@@H]1C=CCCC1)C1CC1 ZINC000309950052 326176761 /nfs/dbraw/zinc/17/67/61/326176761.db2.gz FSALSZICEODKKP-YPMHNXCESA-N 1 2 223.316 2.026 20 0 BEADLO Cn1c[nH+]c(CCNC(=O)C2CCCCCC2)c1 ZINC000457868375 203114539 /nfs/dbraw/zinc/11/45/39/203114539.db2.gz XIGACEHDFZLJQZ-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO CC[C@@H](NC(=O)c1ccc2[nH+]ccn2c1)C1CC1 ZINC000618866595 369229538 /nfs/dbraw/zinc/22/95/38/369229538.db2.gz QWXLBSZBSFZBPE-GFCCVEGCSA-N 1 2 243.310 2.253 20 0 BEADLO CC[C@@](C)(NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1)C1CC1 ZINC000618950908 369244323 /nfs/dbraw/zinc/24/43/23/369244323.db2.gz GCBIEDUEBARKCA-IINYFYTJSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@@](C)(NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1)C1CC1 ZINC000618950908 369244326 /nfs/dbraw/zinc/24/43/26/369244326.db2.gz GCBIEDUEBARKCA-IINYFYTJSA-N 1 2 249.358 2.283 20 0 BEADLO CCN(C(=O)NCc1c[nH+]c(C)cc1C)C1CC1 ZINC000459111445 203234291 /nfs/dbraw/zinc/23/42/91/203234291.db2.gz GHVZATVEHAXSAO-UHFFFAOYSA-N 1 2 247.342 2.392 20 0 BEADLO Cc1occc1C[N@@H+](C)Cc1cnccn1 ZINC000459331379 203257154 /nfs/dbraw/zinc/25/71/54/203257154.db2.gz VTGSGRYIZQKQMH-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1occc1C[N@H+](C)Cc1cnccn1 ZINC000459331379 203257156 /nfs/dbraw/zinc/25/71/56/203257156.db2.gz VTGSGRYIZQKQMH-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO CCn1nccc1C[NH2+]CC(F)(F)CC ZINC000623679976 369381902 /nfs/dbraw/zinc/38/19/02/369381902.db2.gz RQIYYEITWBJGQW-UHFFFAOYSA-N 1 2 217.263 2.038 20 0 BEADLO COC1C[NH+](Cc2cc3cc(F)ccc3o2)C1 ZINC000459587002 203306768 /nfs/dbraw/zinc/30/67/68/203306768.db2.gz UQRIWWZSEUPOPM-UHFFFAOYSA-N 1 2 235.258 2.403 20 0 BEADLO COC1C[NH+](CCc2cccc(Cl)c2)C1 ZINC000459583988 203307808 /nfs/dbraw/zinc/30/78/08/203307808.db2.gz QJLIWXKCRYECHR-UHFFFAOYSA-N 1 2 225.719 2.213 20 0 BEADLO Cc1ccc(C[NH+]2CC(OCC(F)F)C2)cc1 ZINC000459592220 203308861 /nfs/dbraw/zinc/30/88/61/203308861.db2.gz MWPSINOPAJGTKZ-UHFFFAOYSA-N 1 2 241.281 2.461 20 0 BEADLO COC1C[NH+](Cc2cccc3c2OC(C)(C)C3)C1 ZINC000459591484 203309435 /nfs/dbraw/zinc/30/94/35/203309435.db2.gz ZYUJHLZQWHZELD-UHFFFAOYSA-N 1 2 247.338 2.231 20 0 BEADLO OCCC1C[NH+](Cc2c(F)cccc2Cl)C1 ZINC000459599088 203311805 /nfs/dbraw/zinc/31/18/05/203311805.db2.gz YESSISFSBUDIMY-UHFFFAOYSA-N 1 2 243.709 2.293 20 0 BEADLO CCOC1C[NH+](C/C=C\c2ccccc2OC)C1 ZINC000459602335 203314514 /nfs/dbraw/zinc/31/45/14/203314514.db2.gz DKMRGVICLBKKKD-VURMDHGXSA-N 1 2 247.338 2.429 20 0 BEADLO COC1C[NH+](C/C=C\c2ccc(F)cc2)C1 ZINC000459572359 203304563 /nfs/dbraw/zinc/30/45/63/203304563.db2.gz AHJDAKQNMPULJG-IHWYPQMZSA-N 1 2 221.275 2.170 20 0 BEADLO CCOC1(C)C[NH+](Cc2sccc2OC)C1 ZINC000459626508 203321135 /nfs/dbraw/zinc/32/11/35/203321135.db2.gz UNEBTEMEWFMSBK-UHFFFAOYSA-N 1 2 241.356 2.368 20 0 BEADLO COCCC1(C)C[NH+](Cc2cncc(F)c2)C1 ZINC000459636723 203327089 /nfs/dbraw/zinc/32/70/89/203327089.db2.gz QKJBLLLETCRYAV-UHFFFAOYSA-N 1 2 238.306 2.079 20 0 BEADLO CCC1(C)C[NH+](Cc2cn(C(C)(C)C)nn2)C1 ZINC000459641403 203328171 /nfs/dbraw/zinc/32/81/71/203328171.db2.gz YEGRFFAQTIOAEO-UHFFFAOYSA-N 1 2 236.363 2.265 20 0 BEADLO CC(C)Nc1[nH+]c(C2CC2)nc2[nH]ccc21 ZINC000631029828 370956684 /nfs/dbraw/zinc/95/66/84/370956684.db2.gz IJESRJUCKIOAEO-UHFFFAOYSA-N 1 2 216.288 2.078 20 0 BEADLO COCCCNc1[nH+]c(C2CC2)nc2[nH]ccc21 ZINC000631032040 370969887 /nfs/dbraw/zinc/96/98/87/370969887.db2.gz PTOXKMNUAWVWRE-UHFFFAOYSA-N 1 2 246.314 2.235 20 0 BEADLO C[C@@H]([NH2+]Cc1cc(O)cc(F)c1)c1ccn(C)n1 ZINC000459757243 203358787 /nfs/dbraw/zinc/35/87/87/203358787.db2.gz PULFDPHMLGSVQZ-SECBINFHSA-N 1 2 249.289 2.116 20 0 BEADLO COC(=O)CC[N@@H+]1Cc2ccc(Cl)cc2C1 ZINC000459766156 203360661 /nfs/dbraw/zinc/36/06/61/203360661.db2.gz PACSSBJDALGFIK-UHFFFAOYSA-N 1 2 239.702 2.219 20 0 BEADLO COC(=O)CC[N@H+]1Cc2ccc(Cl)cc2C1 ZINC000459766156 203360665 /nfs/dbraw/zinc/36/06/65/203360665.db2.gz PACSSBJDALGFIK-UHFFFAOYSA-N 1 2 239.702 2.219 20 0 BEADLO Cc1cc(N)nc(S[C@@H](C)c2ccncc2)[nH+]1 ZINC000619950608 369641539 /nfs/dbraw/zinc/64/15/39/369641539.db2.gz ZZYVAMSFCZERCF-VIFPVBQESA-N 1 2 246.339 2.446 20 0 BEADLO CC(C)[C@H](NC(=O)C(C)(C)c1c[nH]c[nH+]1)C1CC1 ZINC000620044497 369687578 /nfs/dbraw/zinc/68/75/78/369687578.db2.gz IRULZDUXNQQBLC-LBPRGKRZSA-N 1 2 249.358 2.238 20 0 BEADLO C[C@@H](CC(=O)N[C@]1(C)CC1(C)C)n1cc[nH+]c1 ZINC000620084531 369723192 /nfs/dbraw/zinc/72/31/92/369723192.db2.gz BZKBVWXIUQXKAA-GXFFZTMASA-N 1 2 235.331 2.139 20 0 BEADLO CCC[C@@H](C)C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620599358 369949380 /nfs/dbraw/zinc/94/93/80/369949380.db2.gz FHSFOCCWJSLHJA-ZJUUUORDSA-N 1 2 223.320 2.034 20 0 BEADLO C[C@@H](NC(=O)[C@@H](C)C(C)(C)C)c1[nH+]ccn1C ZINC000620600481 369950685 /nfs/dbraw/zinc/95/06/85/369950685.db2.gz OCBJFMJTUPTUGU-NXEZZACHSA-N 1 2 237.347 2.280 20 0 BEADLO C[C@H](NC(=O)C1=CCCCCC1)c1[nH+]ccn1C ZINC000620603288 369952012 /nfs/dbraw/zinc/95/20/12/369952012.db2.gz GOPWFCVMSBSEJI-NSHDSACASA-N 1 2 247.342 2.488 20 0 BEADLO C[C@@H](C(=O)N[C@@H](C)c1[nH+]ccn1C)C1CCCC1 ZINC000620603637 369952130 /nfs/dbraw/zinc/95/21/30/369952130.db2.gz MEAYXXWZPSRZSE-MNOVXSKESA-N 1 2 249.358 2.424 20 0 BEADLO C[C@@H](NC(=O)[C@H](C)C1CCCC1)c1[nH+]ccn1C ZINC000620603636 369952142 /nfs/dbraw/zinc/95/21/42/369952142.db2.gz MEAYXXWZPSRZSE-GHMZBOCLSA-N 1 2 249.358 2.424 20 0 BEADLO C=C/C(C)=C/CC(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620605890 369954418 /nfs/dbraw/zinc/95/44/18/369954418.db2.gz MFWSZRJCAIHSRO-CDCCAWJDSA-N 1 2 233.315 2.120 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620607267 369955475 /nfs/dbraw/zinc/95/54/75/369955475.db2.gz FYACQDKJKOEBPM-GMTAPVOTSA-N 1 2 235.331 2.034 20 0 BEADLO C[C@H](NC(=O)[C@H]1CCCC[C@@H]1C)c1[nH+]ccn1C ZINC000620612563 369957897 /nfs/dbraw/zinc/95/78/97/369957897.db2.gz YKWMDGDOUJTVCW-SRVKXCTJSA-N 1 2 249.358 2.424 20 0 BEADLO COCCCC(=O)Nc1ccn2cc(C)[nH+]c2c1 ZINC000620648879 369972212 /nfs/dbraw/zinc/97/22/12/369972212.db2.gz NHRYOLFBDJOJLQ-UHFFFAOYSA-N 1 2 247.298 2.008 20 0 BEADLO Cc1cn2ccc(NC(=O)[C@H]3C[C@@H]3C)cc2[nH+]1 ZINC000620648009 369972389 /nfs/dbraw/zinc/97/23/89/369972389.db2.gz QMMAFEVGMXGXAJ-KWQFWETISA-N 1 2 229.283 2.237 20 0 BEADLO Cc1cn2ccc(NC(=O)[C@H]3C[C@H]3C)cc2[nH+]1 ZINC000620648008 369972570 /nfs/dbraw/zinc/97/25/70/369972570.db2.gz QMMAFEVGMXGXAJ-KCJUWKMLSA-N 1 2 229.283 2.237 20 0 BEADLO CCO[C@@H](C)C(=O)Nc1ccn2cc(C)[nH+]c2c1 ZINC000620648889 369972794 /nfs/dbraw/zinc/97/27/94/369972794.db2.gz NUIZCDYRGQHNIB-JTQLQIEISA-N 1 2 247.298 2.006 20 0 BEADLO CC[C@@H]1CCC[C@H](C)N1C(=O)CCn1cc[nH+]c1 ZINC000620575173 369932441 /nfs/dbraw/zinc/93/24/41/369932441.db2.gz KBKPBRBJBMZWEO-QWHCGFSZSA-N 1 2 249.358 2.453 20 0 BEADLO CCC(C)(C)C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620594883 369948144 /nfs/dbraw/zinc/94/81/44/369948144.db2.gz IARNKJQJXGIUFM-VIFPVBQESA-N 1 2 223.320 2.034 20 0 BEADLO CC(C)[N@@H+]1C[C@@H](C)O[C@@H](C(F)(F)F)C1 ZINC000205888193 370033052 /nfs/dbraw/zinc/03/30/52/370033052.db2.gz XSCWACQSHFYURQ-HTQZYQBOSA-N 1 2 211.227 2.046 20 0 BEADLO CC(C)[N@H+]1C[C@@H](C)O[C@@H](C(F)(F)F)C1 ZINC000205888193 370033056 /nfs/dbraw/zinc/03/30/56/370033056.db2.gz XSCWACQSHFYURQ-HTQZYQBOSA-N 1 2 211.227 2.046 20 0 BEADLO COc1ccc(F)c(C[NH2+]Cc2nc(C)c[nH]2)c1 ZINC000621376327 370317162 /nfs/dbraw/zinc/31/71/62/370317162.db2.gz YOHRTSPZRZAGFU-UHFFFAOYSA-N 1 2 249.289 2.156 20 0 BEADLO Cc1ccnc([C@H](C)Nc2cc(C)[nH+]cn2)n1 ZINC000621329211 370261828 /nfs/dbraw/zinc/26/18/28/370261828.db2.gz UJQNEWAKISPJGI-JTQLQIEISA-N 1 2 229.287 2.057 20 0 BEADLO COCC[N@H+](CC(F)F)C1CCCC1 ZINC000112976757 370368103 /nfs/dbraw/zinc/36/81/03/370368103.db2.gz UFBGSXCMIXVZJI-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO COCC[N@@H+](CC(F)F)C1CCCC1 ZINC000112976757 370368110 /nfs/dbraw/zinc/36/81/10/370368110.db2.gz UFBGSXCMIXVZJI-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO CC1(C)CCCN(C(=O)CCCn2cc[nH+]c2)C1 ZINC000112680289 370343896 /nfs/dbraw/zinc/34/38/96/370343896.db2.gz BWGWWXHHAQCRFM-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO CN(CC(C)(C)C)c1cc(-n2cc[nH+]c2)ncn1 ZINC000077215730 370400803 /nfs/dbraw/zinc/40/08/03/370400803.db2.gz VVVOBUWHIZUDFG-UHFFFAOYSA-N 1 2 245.330 2.145 20 0 BEADLO Cc1nccnc1C[N@@H+]1CCn2cccc2[C@H]1C ZINC000621709927 370455660 /nfs/dbraw/zinc/45/56/60/370455660.db2.gz LFUHEIBIHOCKMV-GFCCVEGCSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1nccnc1C[N@H+]1CCn2cccc2[C@H]1C ZINC000621709927 370455666 /nfs/dbraw/zinc/45/56/66/370455666.db2.gz LFUHEIBIHOCKMV-GFCCVEGCSA-N 1 2 242.326 2.163 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1nccnc1C ZINC000621713972 370461351 /nfs/dbraw/zinc/46/13/51/370461351.db2.gz CPYITGPHIJQHQN-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1nccnc1C ZINC000621713972 370461357 /nfs/dbraw/zinc/46/13/57/370461357.db2.gz CPYITGPHIJQHQN-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO Cc1c[nH]nc1C[NH+]1CC(Cc2ccsc2)C1 ZINC000621741456 370500439 /nfs/dbraw/zinc/50/04/39/370500439.db2.gz SWHKQRGKDSSAFK-UHFFFAOYSA-N 1 2 247.367 2.454 20 0 BEADLO Cc1cn[nH]c1C[NH+]1CC(Cc2ccsc2)C1 ZINC000621741456 370500440 /nfs/dbraw/zinc/50/04/40/370500440.db2.gz SWHKQRGKDSSAFK-UHFFFAOYSA-N 1 2 247.367 2.454 20 0 BEADLO c1cc(C[NH+]2CC(Cc3ccsc3)C2)n[nH]1 ZINC000621741084 370501418 /nfs/dbraw/zinc/50/14/18/370501418.db2.gz AOGKEKDYGNGQST-UHFFFAOYSA-N 1 2 233.340 2.146 20 0 BEADLO CCOc1cncc(C[NH+]2CC(C(F)F)C2)c1 ZINC000621730600 370484799 /nfs/dbraw/zinc/48/47/99/370484799.db2.gz QLACTJRASCYOPF-UHFFFAOYSA-N 1 2 242.269 2.177 20 0 BEADLO Cc1cn[nH]c1C[NH+]1CC(C)(c2ccccc2)C1 ZINC000621736056 370493265 /nfs/dbraw/zinc/49/32/65/370493265.db2.gz XNYPKLMAJRVULG-UHFFFAOYSA-N 1 2 241.338 2.492 20 0 BEADLO C[C@H](c1ccco1)c1noc(Cn2cc[nH+]c2)n1 ZINC000621794420 370542051 /nfs/dbraw/zinc/54/20/51/370542051.db2.gz SYQPCFCDRHCJRF-SECBINFHSA-N 1 2 244.254 2.059 20 0 BEADLO CCc1cc(NC[C@@H]2CCC[C@H](O)C2)nc[nH+]1 ZINC000078304936 370549770 /nfs/dbraw/zinc/54/97/70/370549770.db2.gz VBXQRVFBJWKOES-PWSUYJOCSA-N 1 2 235.331 2.002 20 0 BEADLO CCc1cc(NC[C@@H]2CCC[C@@H](O)C2)nc[nH+]1 ZINC000078304940 370550119 /nfs/dbraw/zinc/55/01/19/370550119.db2.gz VBXQRVFBJWKOES-ZYHUDNBSSA-N 1 2 235.331 2.002 20 0 BEADLO C[C@H]1CCN(C(=O)C(C)(C)c2c[nH+]c[nH]2)C[C@H]1C ZINC000621938467 370610293 /nfs/dbraw/zinc/61/02/93/370610293.db2.gz BQQLIFMIDCMNSQ-WDEREUQCSA-N 1 2 249.358 2.192 20 0 BEADLO Cc1cc(C)c(CNC(=O)c2cccnc2)c[nH+]1 ZINC000622667483 371047151 /nfs/dbraw/zinc/04/71/51/371047151.db2.gz IPNKRIHIVFCPOB-UHFFFAOYSA-N 1 2 241.294 2.023 20 0 BEADLO CCn1cnnc1C[NH2+]Cc1ccc(C)cc1F ZINC000631043041 371007096 /nfs/dbraw/zinc/00/70/96/371007096.db2.gz QBQHHPOPLPRHOC-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO Cc1occc1C[NH2+]Cc1ncnn1C(C)C ZINC000631050292 371098369 /nfs/dbraw/zinc/09/83/69/371098369.db2.gz XJUHRJGICCJJMC-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO Cc1cc(NCC(F)(F)F)nc(C2CC2)[nH+]1 ZINC000623892054 371142655 /nfs/dbraw/zinc/14/26/55/371142655.db2.gz CDWMBVVDMDFVEK-UHFFFAOYSA-N 1 2 231.221 2.059 20 0 BEADLO CCCCc1cc(NCCCCOC)nc[nH+]1 ZINC000631060743 371206307 /nfs/dbraw/zinc/20/63/07/371206307.db2.gz SOUNVCQEGCOKKL-UHFFFAOYSA-N 1 2 237.347 2.080 20 0 BEADLO CCCCc1cc(NC2CCOCC2)nc[nH+]1 ZINC000631063817 371239279 /nfs/dbraw/zinc/23/92/79/371239279.db2.gz GOLFBQJDIVIEOM-UHFFFAOYSA-N 1 2 235.331 2.410 20 0 BEADLO COc1ccc[nH+]c1N1CCC[C@@H](OC)CC1 ZINC000624095459 371303419 /nfs/dbraw/zinc/30/34/19/371303419.db2.gz DKYJHCCGNBPBTF-LLVKDONJSA-N 1 2 236.315 2.096 20 0 BEADLO CCCCc1cc(NC[C@@H]2CCCCO2)nc[nH+]1 ZINC000631072244 371337665 /nfs/dbraw/zinc/33/76/65/371337665.db2.gz CVPGELULAIIZGT-ZDUSSCGKSA-N 1 2 249.358 2.222 20 0 BEADLO CCC(F)(F)C[NH2+][C@@H]1CN(C2CC2)C[C@@H]1C ZINC000624147622 371341891 /nfs/dbraw/zinc/34/18/91/371341891.db2.gz GMSLGFYXPVDDDF-GXSJLCMTSA-N 1 2 232.318 2.104 20 0 BEADLO CCC(F)(F)CN[C@@H]1CCCn2cc[nH+]c21 ZINC000624148515 371345011 /nfs/dbraw/zinc/34/50/11/371345011.db2.gz GYLDPXXEKKMJLK-SECBINFHSA-N 1 2 229.274 2.353 20 0 BEADLO CCC(F)(F)C[NH2+][C@H]1CCCc2nn(C)cc21 ZINC000624148861 371346205 /nfs/dbraw/zinc/34/62/05/371346205.db2.gz PUZNKGMHJSRDSA-JTQLQIEISA-N 1 2 243.301 2.432 20 0 BEADLO CCCCc1cc(NCc2ccoc2)nc[nH+]1 ZINC000631073134 371347667 /nfs/dbraw/zinc/34/76/67/371347667.db2.gz DWHKQCKXEDGOLT-UHFFFAOYSA-N 1 2 231.299 2.446 20 0 BEADLO CCc1noc(C[NH2+][C@H](C)c2ccccc2)n1 ZINC000125737231 371391137 /nfs/dbraw/zinc/39/11/37/371391137.db2.gz IAOFLZAWXFXVIG-SNVBAGLBSA-N 1 2 231.299 2.483 20 0 BEADLO CCc1noc(C[NH2+][C@@H](C)c2ccccc2)n1 ZINC000125736994 371391251 /nfs/dbraw/zinc/39/12/51/371391251.db2.gz IAOFLZAWXFXVIG-JTQLQIEISA-N 1 2 231.299 2.483 20 0 BEADLO COc1ccc2[nH+]c(N[C@@H](C)CCO)ccc2c1 ZINC000156603460 371462385 /nfs/dbraw/zinc/46/23/85/371462385.db2.gz XDOMPIJAPUMRTE-JTQLQIEISA-N 1 2 246.310 2.426 20 0 BEADLO CCC[C@@H](CNc1cc(CC)[nH+]cn1)OCC ZINC000624437030 371510357 /nfs/dbraw/zinc/51/03/57/371510357.db2.gz PVJCUWUJVHKNOT-LBPRGKRZSA-N 1 2 237.347 2.078 20 0 BEADLO C[C@@H]1CCC[C@@H]1CC(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627369734 371588709 /nfs/dbraw/zinc/58/87/09/371588709.db2.gz BKGHDRCUANAILV-GHMZBOCLSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@@H]1CCC[C@@H]1CC(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627369734 371588718 /nfs/dbraw/zinc/58/87/18/371588718.db2.gz BKGHDRCUANAILV-GHMZBOCLSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@@]1(C(=O)N2CCc3[nH]c[nH+]c3C2)CC=CCC1 ZINC000627373316 371590902 /nfs/dbraw/zinc/59/09/02/371590902.db2.gz NVJKNFXTCKUTOX-CQSZACIVSA-N 1 2 245.326 2.041 20 0 BEADLO C[C@@]1(C(=O)N2CCc3[nH+]c[nH]c3C2)CC=CCC1 ZINC000627373316 371590906 /nfs/dbraw/zinc/59/09/06/371590906.db2.gz NVJKNFXTCKUTOX-CQSZACIVSA-N 1 2 245.326 2.041 20 0 BEADLO CCCC(C)(C)C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627374580 371592098 /nfs/dbraw/zinc/59/20/98/371592098.db2.gz XKZAEGXACFZSCZ-UHFFFAOYSA-N 1 2 235.331 2.121 20 0 BEADLO CCCC(C)(C)C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627374580 371592107 /nfs/dbraw/zinc/59/21/07/371592107.db2.gz XKZAEGXACFZSCZ-UHFFFAOYSA-N 1 2 235.331 2.121 20 0 BEADLO C[C@H](c1cccc(F)c1)[NH+]1CCOCC1 ZINC000056267294 371627216 /nfs/dbraw/zinc/62/72/16/371627216.db2.gz UXCATGDZXAYVBM-SNVBAGLBSA-N 1 2 209.264 2.219 20 0 BEADLO C[C@@H](NC(=O)C[C@@H](C)C(F)(F)F)c1[nH]cc[nH+]1 ZINC000627465867 371638540 /nfs/dbraw/zinc/63/85/40/371638540.db2.gz QTXUOBRTUIGXEN-RNFRBKRXSA-N 1 2 249.236 2.175 20 0 BEADLO C[C@@](CO)([NH2+]Cc1cscn1)c1ccccc1 ZINC000227212374 371803079 /nfs/dbraw/zinc/80/30/79/371803079.db2.gz ZNWJPWNCWRMLBZ-ZDUSSCGKSA-N 1 2 248.351 2.140 20 0 BEADLO CCc1cc(NC[C@@H](O)CC(C)(C)C)nc[nH+]1 ZINC000227356942 371843267 /nfs/dbraw/zinc/84/32/67/371843267.db2.gz DVQRQKGPRYLFEF-NSHDSACASA-N 1 2 237.347 2.248 20 0 BEADLO Cc1cc(C)c(CNC(=O)C23CC(C2)C3)c[nH+]1 ZINC000627685543 371842844 /nfs/dbraw/zinc/84/28/44/371842844.db2.gz WPAKCLPFRZMSBZ-UHFFFAOYSA-N 1 2 230.311 2.115 20 0 BEADLO COC(=O)[C@H]([NH2+][C@H]1CCc2ccccc21)C1CC1 ZINC000227768056 371933169 /nfs/dbraw/zinc/93/31/69/371933169.db2.gz RAAAGDAEZDQPCU-UONOGXRCSA-N 1 2 245.322 2.215 20 0 BEADLO CCOC(=O)C[N@H+](C)[C@H](C)c1cccc(F)c1 ZINC000058398228 372020297 /nfs/dbraw/zinc/02/02/97/372020297.db2.gz WQJHFCJJMDNQPA-SNVBAGLBSA-N 1 2 239.290 2.382 20 0 BEADLO CCOC(=O)C[N@@H+](C)[C@H](C)c1cccc(F)c1 ZINC000058398228 372020303 /nfs/dbraw/zinc/02/03/03/372020303.db2.gz WQJHFCJJMDNQPA-SNVBAGLBSA-N 1 2 239.290 2.382 20 0 BEADLO C[C@H]1C[C@@H]([NH2+]Cc2ccns2)c2nccn21 ZINC000404338453 372082333 /nfs/dbraw/zinc/08/23/33/372082333.db2.gz DATXNFJQSWXAKU-WCBMZHEXSA-N 1 2 234.328 2.135 20 0 BEADLO C[C@@H]1C[C@H]([NH2+]Cc2ccns2)c2nccn21 ZINC000404338452 372082458 /nfs/dbraw/zinc/08/24/58/372082458.db2.gz DATXNFJQSWXAKU-SCZZXKLOSA-N 1 2 234.328 2.135 20 0 BEADLO CCc1cc(C[NH2+]Cc2occc2C)on1 ZINC000164659531 372179491 /nfs/dbraw/zinc/17/94/91/372179491.db2.gz IBJQCSCYOBHPGP-UHFFFAOYSA-N 1 2 220.272 2.428 20 0 BEADLO C[C@H]1CN(c2cc3ccccc3c[nH+]2)C[C@H]1O ZINC000631189041 372223205 /nfs/dbraw/zinc/22/32/05/372223205.db2.gz XEBOYRSRYVYUJS-GXFFZTMASA-N 1 2 228.295 2.052 20 0 BEADLO CC(C)OC[C@@H](C)Nc1c[nH+]cc(N(C)C)c1 ZINC000631203992 372233572 /nfs/dbraw/zinc/23/35/72/372233572.db2.gz WFNZUFAGZCVWCU-LLVKDONJSA-N 1 2 237.347 2.373 20 0 BEADLO Cc1cn[nH]c1C[NH2+]Cc1cccc(F)c1F ZINC000631207058 372237155 /nfs/dbraw/zinc/23/71/55/372237155.db2.gz RVAPPPPIFJIVDK-UHFFFAOYSA-N 1 2 237.253 2.286 20 0 BEADLO Cc1c[nH]nc1C[NH2+]Cc1cccc(F)c1F ZINC000631207058 372237159 /nfs/dbraw/zinc/23/71/59/372237159.db2.gz RVAPPPPIFJIVDK-UHFFFAOYSA-N 1 2 237.253 2.286 20 0 BEADLO O=c1ccc(C[NH2+][C@@H]2CCCC2(F)F)c[nH]1 ZINC000631136220 372204463 /nfs/dbraw/zinc/20/44/63/372204463.db2.gz JQPGSPCBNYFQDV-SECBINFHSA-N 1 2 228.242 2.065 20 0 BEADLO O=c1ccc(C[NH2+]C2(C(F)F)CCCC2)c[nH]1 ZINC000631140615 372206493 /nfs/dbraw/zinc/20/64/93/372206493.db2.gz BHSGFWHKCRHWKS-UHFFFAOYSA-N 1 2 242.269 2.455 20 0 BEADLO CN(CC1(CO)CC1)c1cc2ccccc2c[nH+]1 ZINC000631232158 372252129 /nfs/dbraw/zinc/25/21/29/372252129.db2.gz PCXMCTBYKXOFDF-UHFFFAOYSA-N 1 2 242.322 2.444 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cc3n(n2)CCCC3)o1 ZINC000631243274 372256646 /nfs/dbraw/zinc/25/66/46/372256646.db2.gz YVUSUNXQXBHFIU-UHFFFAOYSA-N 1 2 245.326 2.411 20 0 BEADLO Cc1nc(N(C)CCF)c2c([nH+]1)CCCC2 ZINC000631295309 372280803 /nfs/dbraw/zinc/28/08/03/372280803.db2.gz HLSWMDOXUWDQQE-UHFFFAOYSA-N 1 2 223.295 2.070 20 0 BEADLO c1cc2c(nc(C3CC3)[nH+]c2N[C@H]2CC23CC3)[nH]1 ZINC000631309747 372288401 /nfs/dbraw/zinc/28/84/01/372288401.db2.gz VNGBGDWQZKFUFK-JTQLQIEISA-N 1 2 240.310 2.222 20 0 BEADLO CCc1nc(N2CC[C@@H]2C(F)(F)F)cc(C)[nH+]1 ZINC000631344217 372304686 /nfs/dbraw/zinc/30/46/86/372304686.db2.gz TYCVWZSORGWNCV-MRVPVSSYSA-N 1 2 245.248 2.488 20 0 BEADLO CCCCc1cc(N[C@@H](CO)C2CCC2)nc[nH+]1 ZINC000631350909 372307428 /nfs/dbraw/zinc/30/74/28/372307428.db2.gz HTVDIKFEMKRSOS-ZDUSSCGKSA-N 1 2 249.358 2.392 20 0 BEADLO Nc1[nH+]cnc(N[C@@H]2CCCC23CC3)c1Cl ZINC000631419565 372351269 /nfs/dbraw/zinc/35/12/69/372351269.db2.gz WEBBQSLBUBEJJY-SSDOTTSWSA-N 1 2 238.722 2.457 20 0 BEADLO Nc1nc[nH+]c(N[C@@H]2CCCC23CC3)c1Cl ZINC000631419565 372351271 /nfs/dbraw/zinc/35/12/71/372351271.db2.gz WEBBQSLBUBEJJY-SSDOTTSWSA-N 1 2 238.722 2.457 20 0 BEADLO CCC[C@H](CCO)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000631426612 372356432 /nfs/dbraw/zinc/35/64/32/372356432.db2.gz KIGVHIGCURZOON-SNVBAGLBSA-N 1 2 248.330 2.229 20 0 BEADLO Cc1[nH]c2nc[nH+]c(SCCCO)c2c1C ZINC000631438963 372364528 /nfs/dbraw/zinc/36/45/28/372364528.db2.gz FLKLAXFZNLGMOH-UHFFFAOYSA-N 1 2 237.328 2.049 20 0 BEADLO COc1ccc2c(c1)CC[C@@H]2[NH2+]Cc1ccn[nH]1 ZINC000631579591 372438368 /nfs/dbraw/zinc/43/83/68/372438368.db2.gz HZKVLHHYPXTTLA-AWEZNQCLSA-N 1 2 243.310 2.195 20 0 BEADLO CCC(C)(C)C(=O)NCc1ccc[nH+]c1N(C)C ZINC000171192712 372453038 /nfs/dbraw/zinc/45/30/38/372453038.db2.gz YKWVOFBDFGINCA-UHFFFAOYSA-N 1 2 249.358 2.200 20 0 BEADLO C[C@H](Nc1cnn2c1CCCC2)c1[nH+]ccn1C ZINC000631714797 372520974 /nfs/dbraw/zinc/52/09/74/372520974.db2.gz VJUTVIVWPPFFEW-JTQLQIEISA-N 1 2 245.330 2.126 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2C[C@@H](C)O[C@H]2C)c(C)[nH+]1 ZINC000631743432 372544249 /nfs/dbraw/zinc/54/42/49/372544249.db2.gz UQTKDMFYNOKKTI-ADEWGFFLSA-N 1 2 248.326 2.450 20 0 BEADLO O=C(C[C@H]1C=CCC1)Nc1cc[nH+]cc1O ZINC000109890890 182024550 /nfs/dbraw/zinc/02/45/50/182024550.db2.gz DFVMDMDVOMIMCP-VIFPVBQESA-N 1 2 218.256 2.082 20 0 BEADLO OCC[N@H+](CC(F)F)[C@H]1CCc2ccccc21 ZINC000172256670 372921298 /nfs/dbraw/zinc/92/12/98/372921298.db2.gz KIVZEFOIPAVVQN-LBPRGKRZSA-N 1 2 241.281 2.233 20 0 BEADLO OCC[N@@H+](CC(F)F)[C@H]1CCc2ccccc21 ZINC000172256670 372921306 /nfs/dbraw/zinc/92/13/06/372921306.db2.gz KIVZEFOIPAVVQN-LBPRGKRZSA-N 1 2 241.281 2.233 20 0 BEADLO O=C(Cn1cc[nH+]c1)NC1CCCCCCC1 ZINC000029594119 182071342 /nfs/dbraw/zinc/07/13/42/182071342.db2.gz HDUAJOKPJRDFOE-UHFFFAOYSA-N 1 2 235.331 2.112 20 0 BEADLO O=C(Cn1cc[nH+]c1)N1CCC[C@H]2CCCC[C@@H]21 ZINC000266308907 182071376 /nfs/dbraw/zinc/07/13/76/182071376.db2.gz SJYIPWWPFDEBHR-OLZOCXBDSA-N 1 2 247.342 2.064 20 0 BEADLO Cc1cncc(C(=O)Nc2cc[nH+]cc2C)c1 ZINC000173124437 373210775 /nfs/dbraw/zinc/21/07/75/373210775.db2.gz VGHNSAZIXRRCHI-UHFFFAOYSA-N 1 2 227.267 2.346 20 0 BEADLO O=C(NC1CCC1)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000336234022 182103509 /nfs/dbraw/zinc/10/35/09/182103509.db2.gz MNPSPOOXFFSPHF-NSHDSACASA-N 1 2 248.330 2.199 20 0 BEADLO O=C(NC1CCCC1)c1ccc2[nH+]ccn2c1 ZINC000057776107 182111923 /nfs/dbraw/zinc/11/19/23/182111923.db2.gz WYVCWHGQNVYYKM-UHFFFAOYSA-N 1 2 229.283 2.007 20 0 BEADLO CC[C@@H](Nc1nc(C)[nH+]c(N)n1)c1ccccc1 ZINC000380787710 373544211 /nfs/dbraw/zinc/54/42/11/373544211.db2.gz ZFHHRIKMONOOQC-LLVKDONJSA-N 1 2 243.314 2.156 20 0 BEADLO CC[C@@H](Nc1nc(N)nc(C)[nH+]1)c1ccccc1 ZINC000380787710 373544218 /nfs/dbraw/zinc/54/42/18/373544218.db2.gz ZFHHRIKMONOOQC-LLVKDONJSA-N 1 2 243.314 2.156 20 0 BEADLO O=C(NCC1CCCC1)c1ccc2[nH+]ccn2c1 ZINC000264010518 182146480 /nfs/dbraw/zinc/14/64/80/182146480.db2.gz OIWKCOZSLBIVEH-UHFFFAOYSA-N 1 2 243.310 2.254 20 0 BEADLO CCCc1noc(C[NH+]2CCCCC2)n1 ZINC000192497351 205952720 /nfs/dbraw/zinc/95/27/20/205952720.db2.gz PZGBVZQZOOYXMM-UHFFFAOYSA-N 1 2 209.293 2.008 20 0 BEADLO Cn1ccnc1C[NH2+][C@@H]1C[C@]1(F)c1ccccc1 ZINC000424192671 206035493 /nfs/dbraw/zinc/03/54/93/206035493.db2.gz JOIIRBUKCSZSOA-OCCSQVGLSA-N 1 2 245.301 2.147 20 0 BEADLO Cn1cc[nH+]c1CN[C@@H]1C[C@]1(F)c1ccccc1 ZINC000424192671 206035497 /nfs/dbraw/zinc/03/54/97/206035497.db2.gz JOIIRBUKCSZSOA-OCCSQVGLSA-N 1 2 245.301 2.147 20 0 BEADLO CC/C=C/CCn1ncc2c1nc[nH+]c2NC ZINC000194425038 206090043 /nfs/dbraw/zinc/09/00/43/206090043.db2.gz NZLYOLUZIZGPTF-SNAWJCMRSA-N 1 2 231.303 2.224 20 0 BEADLO CCO[C@H](C[NH2+]Cc1ccn[nH]1)c1ccccc1 ZINC000194463917 206091428 /nfs/dbraw/zinc/09/14/28/206091428.db2.gz URMRBBJQQAGYBO-CQSZACIVSA-N 1 2 245.326 2.277 20 0 BEADLO COc1ccc(OC)c(C[N@@H+]2CC[C@H](F)C2)c1 ZINC000449392049 206096295 /nfs/dbraw/zinc/09/62/95/206096295.db2.gz ZZZZFDOOLCTVKL-NSHDSACASA-N 1 2 239.290 2.248 20 0 BEADLO COc1ccc(OC)c(C[N@H+]2CC[C@H](F)C2)c1 ZINC000449392049 206096301 /nfs/dbraw/zinc/09/63/01/206096301.db2.gz ZZZZFDOOLCTVKL-NSHDSACASA-N 1 2 239.290 2.248 20 0 BEADLO O=C(N[C@H]1CC=CCC1)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000370491142 182326907 /nfs/dbraw/zinc/32/69/07/182326907.db2.gz KNIZKYXNVQJEGU-WDEREUQCSA-N 1 2 245.326 2.055 20 0 BEADLO O=C(N[C@H]1CC=CCC1)[C@@H]1CCCc2[nH]c[nH+]c21 ZINC000370491142 182326908 /nfs/dbraw/zinc/32/69/08/182326908.db2.gz KNIZKYXNVQJEGU-WDEREUQCSA-N 1 2 245.326 2.055 20 0 BEADLO CCOC1C[NH+](Cc2ccc(CC)o2)C1 ZINC000459604224 206135046 /nfs/dbraw/zinc/13/50/46/206135046.db2.gz JCVDBPVQEQNEDE-UHFFFAOYSA-N 1 2 209.289 2.063 20 0 BEADLO CCc1ccc(C[NH+]2CC(C)(OC)C2)o1 ZINC000459580728 206136177 /nfs/dbraw/zinc/13/61/77/206136177.db2.gz JYGMKFMLIZCOSE-UHFFFAOYSA-N 1 2 209.289 2.063 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)[C@@H]1CCCS1 ZINC000266691695 182375017 /nfs/dbraw/zinc/37/50/17/182375017.db2.gz VUJWQOBVIWJNCV-VIFPVBQESA-N 1 2 247.323 2.168 20 0 BEADLO OCC(F)(F)C[NH2+]C1CC(c2ccccc2)C1 ZINC000184695536 183034211 /nfs/dbraw/zinc/03/42/11/183034211.db2.gz XJFFZYLOAFDVEW-UHFFFAOYSA-N 1 2 241.281 2.150 20 0 BEADLO OCC(F)(F)CNc1ccc2ccccc2[nH+]1 ZINC000231780450 183035148 /nfs/dbraw/zinc/03/51/48/183035148.db2.gz QSKHAIWAUNQIQF-UHFFFAOYSA-N 1 2 238.237 2.274 20 0 BEADLO OCC(F)(F)C[NH2+][C@H]1CCCc2ccccc21 ZINC000184697107 183035797 /nfs/dbraw/zinc/03/57/97/183035797.db2.gz LQZUAXSJKWIRQA-LBPRGKRZSA-N 1 2 241.281 2.281 20 0 BEADLO OCCN(CC1CCCCC1)c1cccc[nH+]1 ZINC000362695246 183065512 /nfs/dbraw/zinc/06/55/12/183065512.db2.gz TUTOVPDTIJLLNH-UHFFFAOYSA-N 1 2 234.343 2.461 20 0 BEADLO OCC[N@H+](CCCc1ccsc1)CC(F)F ZINC000361358255 183066731 /nfs/dbraw/zinc/06/67/31/183066731.db2.gz WHDQBHJFSLDXBD-UHFFFAOYSA-N 1 2 249.326 2.240 20 0 BEADLO OCC[N@@H+](CCCc1ccsc1)CC(F)F ZINC000361358255 183066735 /nfs/dbraw/zinc/06/67/35/183066735.db2.gz WHDQBHJFSLDXBD-UHFFFAOYSA-N 1 2 249.326 2.240 20 0 BEADLO OC[C@@H](Nc1cc[nH+]c(C2CC2)n1)C1CCCC1 ZINC000290896648 183111601 /nfs/dbraw/zinc/11/16/01/183111601.db2.gz URBOLOZLLDXPQV-GFCCVEGCSA-N 1 2 247.342 2.317 20 0 BEADLO CCCC[C@H]([NH2+][C@@H]1C[C@H]1C1CC1)C(=O)OC ZINC000310016232 169012592 /nfs/dbraw/zinc/01/25/92/169012592.db2.gz LAWAOYUOLRJIJL-SDDRHHMPSA-N 1 2 225.332 2.106 20 0 BEADLO CCCC[C@H]([NH2+][C@@H]1CC[C@H](F)C1)C(=O)OC ZINC000336747535 169012687 /nfs/dbraw/zinc/01/26/87/169012687.db2.gz XGSVOLIKOSHDHH-AXFHLTTASA-N 1 2 231.311 2.198 20 0 BEADLO CCCCc1noc(C[N@@H+]2C[C@@H](C)[C@@H]2C)n1 ZINC000339575911 169030524 /nfs/dbraw/zinc/03/05/24/169030524.db2.gz UPQFBEKAWQFDSU-ZJUUUORDSA-N 1 2 223.320 2.252 20 0 BEADLO CCCCc1noc(C[N@H+]2C[C@@H](C)[C@@H]2C)n1 ZINC000339575911 169030527 /nfs/dbraw/zinc/03/05/27/169030527.db2.gz UPQFBEKAWQFDSU-ZJUUUORDSA-N 1 2 223.320 2.252 20 0 BEADLO OC[C@H]1CCC[C@@H](CNc2cccc[nH+]2)C1 ZINC000348230924 183152321 /nfs/dbraw/zinc/15/23/21/183152321.db2.gz RQYNQMMATMPTJJ-NEPJUHHUSA-N 1 2 220.316 2.292 20 0 BEADLO O[C@@H](CNc1cc[nH+]c(C2CC2)n1)c1ccco1 ZINC000110199364 183182366 /nfs/dbraw/zinc/18/23/66/183182366.db2.gz JGMCLCSGVICKRU-JTQLQIEISA-N 1 2 245.282 2.093 20 0 BEADLO OCc1cccc(NCc2ccc(Cl)o2)[nH+]1 ZINC000309640738 183167430 /nfs/dbraw/zinc/16/74/30/183167430.db2.gz ONABWBQRFUQOAC-UHFFFAOYSA-N 1 2 238.674 2.432 20 0 BEADLO O[C@@H]1CCC[N@H+](Cc2cc(F)c(F)c(F)c2)C1 ZINC000158773575 183193575 /nfs/dbraw/zinc/19/35/75/183193575.db2.gz KHYKCYQVCXJPIC-SECBINFHSA-N 1 2 245.244 2.061 20 0 BEADLO O[C@@H]1CCC[N@@H+](Cc2cc(F)c(F)c(F)c2)C1 ZINC000158773575 183193577 /nfs/dbraw/zinc/19/35/77/183193577.db2.gz KHYKCYQVCXJPIC-SECBINFHSA-N 1 2 245.244 2.061 20 0 BEADLO O[C@H]1CCCC[C@@H]1CNc1cccc[nH+]1 ZINC000077208287 183231221 /nfs/dbraw/zinc/23/12/21/183231221.db2.gz XYUQNZIYORXHSP-MNOVXSKESA-N 1 2 206.289 2.045 20 0 BEADLO CCC[N@H+](C)[C@H](C(=O)OC)c1ccc(F)cc1 ZINC000101547029 169087216 /nfs/dbraw/zinc/08/72/16/169087216.db2.gz NTBYERZZPBCHTA-LBPRGKRZSA-N 1 2 239.290 2.382 20 0 BEADLO CCC[N@@H+](C)[C@H](C(=O)OC)c1ccc(F)cc1 ZINC000101547029 169087218 /nfs/dbraw/zinc/08/72/18/169087218.db2.gz NTBYERZZPBCHTA-LBPRGKRZSA-N 1 2 239.290 2.382 20 0 BEADLO CCCN(CC(C)C)C(=O)CCc1[nH]cc[nH+]1 ZINC000287533624 169104802 /nfs/dbraw/zinc/10/48/02/169104802.db2.gz KYHLQHFPSUONLD-UHFFFAOYSA-N 1 2 237.347 2.237 20 0 BEADLO Cl/C=C(\Cl)C[N@@H+]1CCn2nccc2C1 ZINC001643955793 1172516500 /nfs/dbraw/zinc/51/65/00/1172516500.db2.gz MYYOJZQTKLBULS-YVMONPNESA-N 1 2 232.114 2.018 20 0 BEADLO Cl/C=C(\Cl)C[N@H+]1CCn2nccc2C1 ZINC001643955793 1172516506 /nfs/dbraw/zinc/51/65/06/1172516506.db2.gz MYYOJZQTKLBULS-YVMONPNESA-N 1 2 232.114 2.018 20 0 BEADLO CCCN(CCC)C(=O)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000364764624 169143369 /nfs/dbraw/zinc/14/33/69/169143369.db2.gz OTAXUBICUHFDMA-LLVKDONJSA-N 1 2 249.358 2.478 20 0 BEADLO Oc1cccc(C[NH2+]Cc2nccs2)c1 ZINC000040443937 183291133 /nfs/dbraw/zinc/29/11/33/183291133.db2.gz QJEZMKOJAKZRNH-UHFFFAOYSA-N 1 2 220.297 2.139 20 0 BEADLO Oc1cccc(SCCn2cc[nH+]c2)c1 ZINC000126994787 183294304 /nfs/dbraw/zinc/29/43/04/183294304.db2.gz PAQHGOXNTQKIFK-UHFFFAOYSA-N 1 2 220.297 2.381 20 0 BEADLO Oc1cccc2c1C[C@@H](Nc1cccc[nH+]1)C2 ZINC000336365670 183296984 /nfs/dbraw/zinc/29/69/84/183296984.db2.gz VIHUZALTFSEEOO-NSHDSACASA-N 1 2 226.279 2.367 20 0 BEADLO c1c[nH+]c(CN2CCO[C@H](C3CCCCC3)C2)[nH]1 ZINC000336526642 183325390 /nfs/dbraw/zinc/32/53/90/183325390.db2.gz IZYFXFCFHKZBRJ-ZDUSSCGKSA-N 1 2 249.358 2.191 20 0 BEADLO c1c[nH]c([C@@H]2CCC[N@H+]2Cc2cocn2)c1 ZINC000277962742 183327468 /nfs/dbraw/zinc/32/74/68/183327468.db2.gz JENOLKFRFLMQAX-LBPRGKRZSA-N 1 2 217.272 2.340 20 0 BEADLO c1c[nH]c([C@@H]2CCC[N@@H+]2Cc2cocn2)c1 ZINC000277962742 183327472 /nfs/dbraw/zinc/32/74/72/183327472.db2.gz JENOLKFRFLMQAX-LBPRGKRZSA-N 1 2 217.272 2.340 20 0 BEADLO c1cc(C[N@H+](Cc2ccncc2)C2CC2)no1 ZINC000093221518 183339213 /nfs/dbraw/zinc/33/92/13/183339213.db2.gz YPXMWLBAMAPXRF-UHFFFAOYSA-N 1 2 229.283 2.234 20 0 BEADLO c1cc(C[N@@H+](Cc2ccncc2)C2CC2)no1 ZINC000093221518 183339216 /nfs/dbraw/zinc/33/92/16/183339216.db2.gz YPXMWLBAMAPXRF-UHFFFAOYSA-N 1 2 229.283 2.234 20 0 BEADLO c1cc(C[N@@H+]2CCCC[C@@H]2c2cc[nH]n2)on1 ZINC000285213516 183340249 /nfs/dbraw/zinc/34/02/49/183340249.db2.gz ACUNAUMUSUPPFM-GFCCVEGCSA-N 1 2 232.287 2.125 20 0 BEADLO c1cc(C[N@H+]2CCCC[C@@H]2c2cc[nH]n2)on1 ZINC000285213516 183340250 /nfs/dbraw/zinc/34/02/50/183340250.db2.gz ACUNAUMUSUPPFM-GFCCVEGCSA-N 1 2 232.287 2.125 20 0 BEADLO c1cc(C[N@H+]2CCC[C@H](OCC3CC3)C2)no1 ZINC000368412525 183342842 /nfs/dbraw/zinc/34/28/42/183342842.db2.gz SDRWWNXLIJJAKO-ZDUSSCGKSA-N 1 2 236.315 2.066 20 0 BEADLO c1cc(C[N@@H+]2CCC[C@H](OCC3CC3)C2)no1 ZINC000368412525 183342844 /nfs/dbraw/zinc/34/28/44/183342844.db2.gz SDRWWNXLIJJAKO-ZDUSSCGKSA-N 1 2 236.315 2.066 20 0 BEADLO c1c[nH]c([C@@H]2CCC[N@H+]2Cc2ccncc2)n1 ZINC000336337024 183343204 /nfs/dbraw/zinc/34/32/04/183343204.db2.gz OJTXNVZOEBSTRQ-LBPRGKRZSA-N 1 2 228.299 2.142 20 0 BEADLO c1c[nH]c([C@@H]2CCC[N@@H+]2Cc2ccncc2)n1 ZINC000336337024 183343205 /nfs/dbraw/zinc/34/32/05/183343205.db2.gz OJTXNVZOEBSTRQ-LBPRGKRZSA-N 1 2 228.299 2.142 20 0 BEADLO c1cc(N[C@@H]2C[C@@H]3OCCC[C@@H]23)nc(C2CC2)[nH+]1 ZINC000302557495 183359314 /nfs/dbraw/zinc/35/93/14/183359314.db2.gz LVAMLRGELLJBQT-TUAOUCFPSA-N 1 2 245.326 2.333 20 0 BEADLO c1cc(C[NH2+]Cc2noc3c2CCCC3)ccn1 ZINC000269376998 183352442 /nfs/dbraw/zinc/35/24/42/183352442.db2.gz NXMYEICQTJARFE-UHFFFAOYSA-N 1 2 243.310 2.238 20 0 BEADLO c1cc(CNc2cccc(-n3cc[nH+]c3)c2)n[nH]1 ZINC000036940141 183357502 /nfs/dbraw/zinc/35/75/02/183357502.db2.gz ZBVPGAMYCQETJJ-UHFFFAOYSA-N 1 2 239.282 2.208 20 0 BEADLO c1cc(OC2COC2)ccc1[NH2+]CC1CC1 ZINC000186505705 183358355 /nfs/dbraw/zinc/35/83/55/183358355.db2.gz DLXCJQITVOJRCR-UHFFFAOYSA-N 1 2 219.284 2.286 20 0 BEADLO c1cc(NCC2CCCC2)nc(C2CC2)[nH+]1 ZINC000336660097 183334118 /nfs/dbraw/zinc/33/41/18/183334118.db2.gz JKBJUGGRIZRVSJ-UHFFFAOYSA-N 1 2 217.316 2.378 20 0 BEADLO c1cc2cc(C[N@@H+]3CCO[C@@H]4C[C@@H]43)ccc2o1 ZINC000366560363 183374815 /nfs/dbraw/zinc/37/48/15/183374815.db2.gz POEAHOXYWMGDKQ-GXTWGEPZSA-N 1 2 229.279 2.406 20 0 BEADLO c1cc2cc(C[N@H+]3CCO[C@@H]4C[C@@H]43)ccc2o1 ZINC000366560363 183374817 /nfs/dbraw/zinc/37/48/17/183374817.db2.gz POEAHOXYWMGDKQ-GXTWGEPZSA-N 1 2 229.279 2.406 20 0 BEADLO CCCNC(=O)[C@@H]1CCc2[nH+]c(C(C)C)[nH]c2C1 ZINC000370223390 169245383 /nfs/dbraw/zinc/24/53/83/169245383.db2.gz CHNDJCLUYUIMBR-SNVBAGLBSA-N 1 2 249.358 2.164 20 0 BEADLO CCCNC(=O)[C@@H]1CCc2[nH]c(C(C)C)[nH+]c2C1 ZINC000370223390 169245385 /nfs/dbraw/zinc/24/53/85/169245385.db2.gz CHNDJCLUYUIMBR-SNVBAGLBSA-N 1 2 249.358 2.164 20 0 BEADLO c1ccc(-c2nc(C[NH+]3CCCC3)no2)cc1 ZINC000053398419 183382463 /nfs/dbraw/zinc/38/24/63/183382463.db2.gz LNVXLLOVHIKASY-UHFFFAOYSA-N 1 2 229.283 2.332 20 0 BEADLO CCC[NH2+][C@@](CC)(C(=O)OC)c1ccccc1 ZINC000037513261 169284324 /nfs/dbraw/zinc/28/43/24/169284324.db2.gz RWVVNFNFUUJUOI-CQSZACIVSA-N 1 2 235.327 2.465 20 0 BEADLO CCC[NH2+][C@@H](Cc1ccc(C)cc1)C(=O)OC ZINC000281057828 169279098 /nfs/dbraw/zinc/27/90/98/169279098.db2.gz SOPYMHDFHWKDAM-ZDUSSCGKSA-N 1 2 235.327 2.079 20 0 BEADLO CCCNc1nc(C)[nH+]c2c1CCCC2 ZINC000050852430 169295790 /nfs/dbraw/zinc/29/57/90/169295790.db2.gz DEELEMSQZZZYPV-UHFFFAOYSA-N 1 2 205.305 2.486 20 0 BEADLO CCCSCC(=O)Nc1c[nH+]ccc1OC ZINC000299527296 169338989 /nfs/dbraw/zinc/33/89/89/169338989.db2.gz YHIWWTOBTBTBJD-UHFFFAOYSA-N 1 2 240.328 2.172 20 0 BEADLO CCC[C@@H](C)C(=O)N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000339472417 169349011 /nfs/dbraw/zinc/34/90/11/169349011.db2.gz YMGDRPZMQPHWAM-NEPJUHHUSA-N 1 2 249.358 2.172 20 0 BEADLO CC1CCC(C[N@H+](C)Cc2nnc[nH]2)CC1 ZINC000179798942 134323707 /nfs/dbraw/zinc/32/37/07/134323707.db2.gz IBGVWIVSTUJUAV-UHFFFAOYSA-N 1 2 222.336 2.063 20 0 BEADLO CC1CCC(C[N@@H+](C)Cc2nnc[nH]2)CC1 ZINC000179798942 134323708 /nfs/dbraw/zinc/32/37/08/134323708.db2.gz IBGVWIVSTUJUAV-UHFFFAOYSA-N 1 2 222.336 2.063 20 0 BEADLO CCC[C@H](C)C(=O)NCCCCn1cc[nH+]c1 ZINC000522189245 259611311 /nfs/dbraw/zinc/61/13/11/259611311.db2.gz OLKREORMAUGFDK-LBPRGKRZSA-N 1 2 237.347 2.216 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ncc[nH]2)s1 ZINC000111218208 383843213 /nfs/dbraw/zinc/84/32/13/383843213.db2.gz FYQSPGRMSJZBJX-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ncc[nH]2)s1 ZINC000111218208 383843219 /nfs/dbraw/zinc/84/32/19/383843219.db2.gz FYQSPGRMSJZBJX-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1ccc(CN(C)Cc2[nH]cc[nH+]2)s1 ZINC000111218208 383843223 /nfs/dbraw/zinc/84/32/23/383843223.db2.gz FYQSPGRMSJZBJX-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO CC[C@H](NCc1[nH]cc[nH+]1)c1nc(C)cs1 ZINC000066594079 383873043 /nfs/dbraw/zinc/87/30/43/383873043.db2.gz ZCIIEUAEWMWODT-VIFPVBQESA-N 1 2 236.344 2.416 20 0 BEADLO CC[C@H]([NH2+]Cc1ncc[nH]1)c1nc(C)cs1 ZINC000066594079 383873051 /nfs/dbraw/zinc/87/30/51/383873051.db2.gz ZCIIEUAEWMWODT-VIFPVBQESA-N 1 2 236.344 2.416 20 0 BEADLO Cc1csc(C[N@H+]2C[C@@H](C)OC[C@@H]2C)n1 ZINC000088576332 383911526 /nfs/dbraw/zinc/91/15/26/383911526.db2.gz FPCJABFDCLMOBO-VHSXEESVSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1csc(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)n1 ZINC000088576332 383911532 /nfs/dbraw/zinc/91/15/32/383911532.db2.gz FPCJABFDCLMOBO-VHSXEESVSA-N 1 2 226.345 2.061 20 0 BEADLO CC(C)n1nccc1C[N@H+](C(C)C)C1COC1 ZINC000449351766 383926845 /nfs/dbraw/zinc/92/68/45/383926845.db2.gz RDECSTVBLWRPFK-UHFFFAOYSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)n1nccc1C[N@@H+](C(C)C)C1COC1 ZINC000449351766 383926853 /nfs/dbraw/zinc/92/68/53/383926853.db2.gz RDECSTVBLWRPFK-UHFFFAOYSA-N 1 2 237.347 2.073 20 0 BEADLO CC[C@@H]([NH2+]Cc1cnn2ccccc12)C(F)F ZINC000449361533 383978798 /nfs/dbraw/zinc/97/87/98/383978798.db2.gz KWWPZICFZMAHDQ-SNVBAGLBSA-N 1 2 239.269 2.468 20 0 BEADLO COC[C@H]([NH3+])c1nc(C2CCCCCC2)no1 ZINC000159353535 384003316 /nfs/dbraw/zinc/00/33/16/384003316.db2.gz PKQDVCAARHBPGP-JTQLQIEISA-N 1 2 239.319 2.154 20 0 BEADLO Cc1[nH]ncc1CNc1ccc(C[NH+](C)C)cc1 ZINC000037141475 383945619 /nfs/dbraw/zinc/94/56/19/383945619.db2.gz MKVPCGPIYDZHJZ-UHFFFAOYSA-N 1 2 244.342 2.392 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]Cc1cc(C)cc(N)c1 ZINC000643542054 383951224 /nfs/dbraw/zinc/95/12/24/383951224.db2.gz VSQUGOYAYYWSFB-SNVBAGLBSA-N 1 2 244.342 2.460 20 0 BEADLO FC1(F)CC[C@H](CN2CC[NH+](C3CC3)CC2)C1 ZINC000336471269 383964224 /nfs/dbraw/zinc/96/42/24/383964224.db2.gz IXNLQMIFIJQHJI-NSHDSACASA-N 1 2 244.329 2.202 20 0 BEADLO Fc1ccc(C[NH2+][C@@H]2CCn3ccnc32)cc1F ZINC000293862516 383966557 /nfs/dbraw/zinc/96/65/57/383966557.db2.gz DKGAFBRLOSYJEO-GFCCVEGCSA-N 1 2 249.264 2.396 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CCCCC2(C)C)c[nH+]1 ZINC000268133008 384022655 /nfs/dbraw/zinc/02/26/55/384022655.db2.gz BUYBXDHGODFYCX-LLVKDONJSA-N 1 2 235.331 2.417 20 0 BEADLO CCC1(C)CCN(C(=O)Cc2c[nH+]cn2C)CC1 ZINC000558493783 384043433 /nfs/dbraw/zinc/04/34/33/384043433.db2.gz ZWQOKRYYWCKBNG-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO CC(=O)Nc1ccc(C[NH2+]C(CF)CF)cc1 ZINC000449374099 384052516 /nfs/dbraw/zinc/05/25/16/384052516.db2.gz WSGNAIFXHGWSMN-UHFFFAOYSA-N 1 2 242.269 2.042 20 0 BEADLO COCc1ccccc1NCc1c[nH+]cn1C ZINC000090165392 384031139 /nfs/dbraw/zinc/03/11/39/384031139.db2.gz YHPQDOUBBOEUJW-UHFFFAOYSA-N 1 2 231.299 2.179 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)Cc1cccc(F)c1 ZINC000114461107 384037921 /nfs/dbraw/zinc/03/79/21/384037921.db2.gz SYBDPRZLHVWKHD-UHFFFAOYSA-N 1 2 219.263 2.181 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)Cc1cccc(F)c1 ZINC000114461107 384037927 /nfs/dbraw/zinc/03/79/27/384037927.db2.gz SYBDPRZLHVWKHD-UHFFFAOYSA-N 1 2 219.263 2.181 20 0 BEADLO Cc1cc(C)cc([C@H](C)[NH2+]Cc2ncn(C)n2)c1 ZINC000090969195 384087328 /nfs/dbraw/zinc/08/73/28/384087328.db2.gz CVRJTWHIPSLBPO-LBPRGKRZSA-N 1 2 244.342 2.283 20 0 BEADLO CC[C@H]1CN(c2cc(C)[nH+]c(C3CC3)n2)CCO1 ZINC000116259945 384126129 /nfs/dbraw/zinc/12/61/29/384126129.db2.gz DJQZYSXVMLUDDR-LBPRGKRZSA-N 1 2 247.342 2.278 20 0 BEADLO Cc1nc(C[NH+]2C[C@@H](C)O[C@H](C)C2)c(C)s1 ZINC000336555929 384132950 /nfs/dbraw/zinc/13/29/50/384132950.db2.gz JLPZIKBPQMGZDO-RKDXNWHRSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1ccc(F)c(C[N@H+]2CCOC[C@H]2C)c1 ZINC000091800562 384148896 /nfs/dbraw/zinc/14/88/96/384148896.db2.gz ZNFPNPQPZFGLFL-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ccc(F)c(C[N@@H+]2CCOC[C@H]2C)c1 ZINC000091800562 384148901 /nfs/dbraw/zinc/14/89/01/384148901.db2.gz ZNFPNPQPZFGLFL-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO CC[C@@H](NC(=O)C[C@@H]1C=CCC1)c1[nH]cc[nH+]1 ZINC000140607443 384156335 /nfs/dbraw/zinc/15/63/35/384156335.db2.gz FPRSVQIYHZSSRG-GHMZBOCLSA-N 1 2 233.315 2.333 20 0 BEADLO Cc1csc(C[N@@H+]2CCc3ncccc3C2)n1 ZINC000367845340 384171680 /nfs/dbraw/zinc/17/16/80/384171680.db2.gz CVZYZZLUJJNBML-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1csc(C[N@H+]2CCc3ncccc3C2)n1 ZINC000367845340 384171688 /nfs/dbraw/zinc/17/16/88/384171688.db2.gz CVZYZZLUJJNBML-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO COCc1ccc(C[N@@H+]2C[C@H](C)OC[C@H]2C)o1 ZINC000092017142 384158992 /nfs/dbraw/zinc/15/89/92/384158992.db2.gz ORJCJFYPSUQIDF-MNOVXSKESA-N 1 2 239.315 2.035 20 0 BEADLO COCc1ccc(C[N@H+]2C[C@H](C)OC[C@H]2C)o1 ZINC000092017142 384158995 /nfs/dbraw/zinc/15/89/95/384158995.db2.gz ORJCJFYPSUQIDF-MNOVXSKESA-N 1 2 239.315 2.035 20 0 BEADLO CCc1ccc(C[N@@H+]2C[C@H](C)OC[C@@H]2C)o1 ZINC000092017680 384159081 /nfs/dbraw/zinc/15/90/81/384159081.db2.gz BTLKDFWOYMQXFY-QWRGUYRKSA-N 1 2 223.316 2.451 20 0 BEADLO CCc1ccc(C[N@H+]2C[C@H](C)OC[C@@H]2C)o1 ZINC000092017680 384159084 /nfs/dbraw/zinc/15/90/84/384159084.db2.gz BTLKDFWOYMQXFY-QWRGUYRKSA-N 1 2 223.316 2.451 20 0 BEADLO CCOc1cccc(C[N@@H+]2CC[C@@H](F)C2)n1 ZINC000449391845 384159173 /nfs/dbraw/zinc/15/91/73/384159173.db2.gz INECQBLQRIXFPA-SNVBAGLBSA-N 1 2 224.279 2.024 20 0 BEADLO CCOc1cccc(C[N@H+]2CC[C@@H](F)C2)n1 ZINC000449391845 384159175 /nfs/dbraw/zinc/15/91/75/384159175.db2.gz INECQBLQRIXFPA-SNVBAGLBSA-N 1 2 224.279 2.024 20 0 BEADLO C[C@H]([NH2+]Cc1nc2ccccc2o1)c1cn[nH]c1 ZINC000358831877 384180045 /nfs/dbraw/zinc/18/00/45/384180045.db2.gz VJRYLMCNDIVZTH-VIFPVBQESA-N 1 2 242.282 2.402 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2CCC[C@@H]3C[C@@H]32)cc[nH+]1 ZINC000518715735 384210628 /nfs/dbraw/zinc/21/06/28/384210628.db2.gz NZZKMSLVQKJSHC-KGYLQXTDSA-N 1 2 245.326 2.122 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC(C)(C)O[C@@H]2CCC[C@H]21 ZINC000336422354 384224427 /nfs/dbraw/zinc/22/44/27/384224427.db2.gz XPDFJSSFDIASPW-CHWSQXEVSA-N 1 2 249.358 2.250 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC(C)(C)O[C@@H]2CCC[C@H]21 ZINC000336422354 384224431 /nfs/dbraw/zinc/22/44/31/384224431.db2.gz XPDFJSSFDIASPW-CHWSQXEVSA-N 1 2 249.358 2.250 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)Nc1cccc(Cl)n1 ZINC000082461277 384226216 /nfs/dbraw/zinc/22/62/16/384226216.db2.gz KUHIMOGNYUDALB-VIFPVBQESA-N 1 2 236.706 2.432 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cn[nH]c2C)CCS1 ZINC000093502437 384244868 /nfs/dbraw/zinc/24/48/68/384244868.db2.gz DCBWGRSPDPYPOX-NSHDSACASA-N 1 2 225.361 2.046 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cn[nH]c2C)CCS1 ZINC000093502437 384244875 /nfs/dbraw/zinc/24/48/75/384244875.db2.gz DCBWGRSPDPYPOX-NSHDSACASA-N 1 2 225.361 2.046 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2ccco2)CCO1 ZINC000093508449 384245885 /nfs/dbraw/zinc/24/58/85/384245885.db2.gz PSJPEJIPTYKRRK-LLVKDONJSA-N 1 2 209.289 2.281 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2ccco2)CCO1 ZINC000093508449 384245888 /nfs/dbraw/zinc/24/58/88/384245888.db2.gz PSJPEJIPTYKRRK-LLVKDONJSA-N 1 2 209.289 2.281 20 0 BEADLO C[C@H](CO)SCc1ccc(-n2cc[nH+]c2)cc1 ZINC000133197688 384277546 /nfs/dbraw/zinc/27/75/46/384277546.db2.gz QGOORYQUIOHLCF-LLVKDONJSA-N 1 2 248.351 2.486 20 0 BEADLO CC(C)[NH2+]c1ccc(N2CCOCC2)c(F)c1 ZINC000133048527 384269722 /nfs/dbraw/zinc/26/97/22/384269722.db2.gz AZQQXTDEJIQXFX-UHFFFAOYSA-N 1 2 238.306 2.483 20 0 BEADLO Cn1cnnc1[C@@H]1CCC[N@@H+]1Cc1cccs1 ZINC000093809773 384273500 /nfs/dbraw/zinc/27/35/00/384273500.db2.gz MONYVHZRGRSKFV-NSHDSACASA-N 1 2 248.355 2.214 20 0 BEADLO Cn1cnnc1[C@@H]1CCC[N@H+]1Cc1cccs1 ZINC000093809773 384273504 /nfs/dbraw/zinc/27/35/04/384273504.db2.gz MONYVHZRGRSKFV-NSHDSACASA-N 1 2 248.355 2.214 20 0 BEADLO COCc1ccc(CNc2c[nH+]ccc2OC)o1 ZINC000119155225 384241807 /nfs/dbraw/zinc/24/18/07/384241807.db2.gz VKTZFVJZBWLLQV-UHFFFAOYSA-N 1 2 248.282 2.442 20 0 BEADLO C[C@@H](NC(=O)[C@H](C)c1cccs1)c1[nH]cc[nH+]1 ZINC000560698169 384305726 /nfs/dbraw/zinc/30/57/26/384305726.db2.gz LTHKXBHXFSLYBT-RKDXNWHRSA-N 1 2 249.339 2.452 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]Cc1ccc(CO)cc1 ZINC000647322569 384316129 /nfs/dbraw/zinc/31/61/29/384316129.db2.gz AYMUNKPJMJHYOR-JTQLQIEISA-N 1 2 245.326 2.061 20 0 BEADLO CC(=O)NC1CCC(Nc2c[nH+]cc(C)c2)CC1 ZINC000133870605 384316903 /nfs/dbraw/zinc/31/69/03/384316903.db2.gz BXYNIOAEBMGQKO-UHFFFAOYSA-N 1 2 247.342 2.249 20 0 BEADLO CC[C@H]1CCCN1C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000517748593 384281912 /nfs/dbraw/zinc/28/19/12/384281912.db2.gz NNJMTWMVALDFME-RYUDHWBXSA-N 1 2 235.331 2.235 20 0 BEADLO C[C@H](Nc1nc[nH+]c(N)c1Cl)c1ccccn1 ZINC000235561329 384284036 /nfs/dbraw/zinc/28/40/36/384284036.db2.gz BUGZUUTVJUVGPD-ZETCQYMHSA-N 1 2 249.705 2.280 20 0 BEADLO C[C@H](Nc1[nH+]cnc(N)c1Cl)c1ccccn1 ZINC000235561329 384284044 /nfs/dbraw/zinc/28/40/44/384284044.db2.gz BUGZUUTVJUVGPD-ZETCQYMHSA-N 1 2 249.705 2.280 20 0 BEADLO CCCCc1nc(C[N@H+](C)C2CCC2)no1 ZINC000173919465 384289420 /nfs/dbraw/zinc/28/94/20/384289420.db2.gz NHVLCSORKQKOIA-UHFFFAOYSA-N 1 2 223.320 2.397 20 0 BEADLO CCCCc1nc(C[N@@H+](C)C2CCC2)no1 ZINC000173919465 384289431 /nfs/dbraw/zinc/28/94/31/384289431.db2.gz NHVLCSORKQKOIA-UHFFFAOYSA-N 1 2 223.320 2.397 20 0 BEADLO CC[C@H]([NH2+]Cc1ccc(C)s1)C(=O)OC ZINC000083355605 384292916 /nfs/dbraw/zinc/29/29/16/384292916.db2.gz LLGBGXVAUZIKLU-JTQLQIEISA-N 1 2 227.329 2.098 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccon2)CCS1 ZINC000076072602 384356127 /nfs/dbraw/zinc/35/61/27/384356127.db2.gz LRMUHJMICNOVDH-JTQLQIEISA-N 1 2 212.318 2.002 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccon2)CCS1 ZINC000076072602 384356133 /nfs/dbraw/zinc/35/61/33/384356133.db2.gz LRMUHJMICNOVDH-JTQLQIEISA-N 1 2 212.318 2.002 20 0 BEADLO CC(C)[C@@H]1CCN(C(=O)C(C)(C)c2c[nH+]c[nH]2)C1 ZINC000621908263 384372496 /nfs/dbraw/zinc/37/24/96/384372496.db2.gz ROFZIUQBRQJLAK-LLVKDONJSA-N 1 2 249.358 2.192 20 0 BEADLO C[C@H]1OCC[C@H]1Nc1ccc([NH+](C)C)cc1 ZINC000134085935 384329998 /nfs/dbraw/zinc/32/99/98/384329998.db2.gz CVTSBAJUQSYEHV-ZWNOBZJWSA-N 1 2 220.316 2.342 20 0 BEADLO CC[C@@H]([NH2+]CCCc1ccccc1)C(=O)OC ZINC000134924420 384399902 /nfs/dbraw/zinc/39/99/02/384399902.db2.gz PJPVJUDNVHFBRJ-CYBMUJFWSA-N 1 2 235.327 2.160 20 0 BEADLO Cn1c[nH+]c(CCNC(=O)C2(C)CCCCC2)c1 ZINC000562652436 384404857 /nfs/dbraw/zinc/40/48/57/384404857.db2.gz INKDJRQXHWXRHN-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO CCc1ccccc1C[NH2+][C@H](CC)C(=O)OC ZINC000134976964 384405046 /nfs/dbraw/zinc/40/50/46/384405046.db2.gz QITIJKSTXVYJGE-CYBMUJFWSA-N 1 2 235.327 2.290 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2cccn2C)s1 ZINC000135000568 384407036 /nfs/dbraw/zinc/40/70/36/384407036.db2.gz CPCLDTLUIDOHJA-QMMMGPOBSA-N 1 2 236.344 2.036 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCCc2nn(C)cc21)c1ccon1 ZINC000530518757 384407256 /nfs/dbraw/zinc/40/72/56/384407256.db2.gz WVQIBEFALBGEKJ-SKDRFNHKSA-N 1 2 246.314 2.136 20 0 BEADLO CC(C)C[C@@H]1COCC[N@@H+]1Cc1nccs1 ZINC000135080582 384412417 /nfs/dbraw/zinc/41/24/17/384412417.db2.gz KTTVJPILPHXNSE-LLVKDONJSA-N 1 2 240.372 2.390 20 0 BEADLO CC(C)C[C@@H]1COCC[N@H+]1Cc1nccs1 ZINC000135080582 384412424 /nfs/dbraw/zinc/41/24/24/384412424.db2.gz KTTVJPILPHXNSE-LLVKDONJSA-N 1 2 240.372 2.390 20 0 BEADLO Cc1ccc(C)c(C[NH2+][C@H](C)c2ncn(C)n2)c1 ZINC000275799986 384415225 /nfs/dbraw/zinc/41/52/25/384415225.db2.gz JYTICGXWMVJAKK-GFCCVEGCSA-N 1 2 244.342 2.283 20 0 BEADLO Fc1cccc(F)c1CCOCc1[nH]cc[nH+]1 ZINC000647119480 384422379 /nfs/dbraw/zinc/42/23/79/384422379.db2.gz VTBWDOVXLCJUTP-UHFFFAOYSA-N 1 2 238.237 2.447 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CCC[C@@H]1C ZINC000121520184 384423896 /nfs/dbraw/zinc/42/38/96/384423896.db2.gz UGGRUFALNXBHOQ-JTQLQIEISA-N 1 2 219.288 2.406 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@H](C)C1CC1 ZINC000120721147 384376126 /nfs/dbraw/zinc/37/61/26/384376126.db2.gz SLOUIAGCFKPMBO-SECBINFHSA-N 1 2 219.288 2.310 20 0 BEADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccccn1 ZINC000078471396 384447529 /nfs/dbraw/zinc/44/75/29/384447529.db2.gz WLYCAQFDGHBWJX-GFCCVEGCSA-N 1 2 227.311 2.460 20 0 BEADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1ccccn1 ZINC000078471396 384447534 /nfs/dbraw/zinc/44/75/34/384447534.db2.gz WLYCAQFDGHBWJX-GFCCVEGCSA-N 1 2 227.311 2.460 20 0 BEADLO CCCCNc1cc(NCCCC)[nH+]c(N)n1 ZINC000002567203 384441323 /nfs/dbraw/zinc/44/13/23/384441323.db2.gz OQDVYRWIFQYRFT-UHFFFAOYSA-N 1 2 237.351 2.483 20 0 BEADLO C[C@@H]([NH2+][C@H]1C[C@@H](C)[C@H]1C)C(=O)OC(C)(C)C ZINC000309888496 384461778 /nfs/dbraw/zinc/46/17/78/384461778.db2.gz ZKKPEVNVFFDLOY-DBIOUOCHSA-N 1 2 227.348 2.351 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCCc2c1cnn2C)C(C)(F)F ZINC000335658696 384462773 /nfs/dbraw/zinc/46/27/73/384462773.db2.gz WJXDNRNDFRCIBK-PSASIEDQSA-N 1 2 243.301 2.431 20 0 BEADLO CCCCNC(=O)Nc1cc[nH+]c(C)c1 ZINC000096713128 384471983 /nfs/dbraw/zinc/47/19/83/384471983.db2.gz FVFASLYVLOMCFC-UHFFFAOYSA-N 1 2 207.277 2.312 20 0 BEADLO c1[nH+]c2c(cc1N[C@@H]1CCOC1)CCCC2 ZINC000336475919 384477015 /nfs/dbraw/zinc/47/70/15/384477015.db2.gz VIIAGFKTMAMLIP-LLVKDONJSA-N 1 2 218.300 2.161 20 0 BEADLO CS[C@@H](C)CNC(=O)Nc1cc[nH+]cc1C ZINC000122144730 384458604 /nfs/dbraw/zinc/45/86/04/384458604.db2.gz QLYDZWYJONTKKA-VIFPVBQESA-N 1 2 239.344 2.263 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)[C@H]1CCC(C)(C)C1 ZINC000359065282 384497833 /nfs/dbraw/zinc/49/78/33/384497833.db2.gz SSDMFTFLWZNTNX-RYUDHWBXSA-N 1 2 249.358 2.214 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)[C@@H]1CCC(C)(C)C1 ZINC000359065284 384497872 /nfs/dbraw/zinc/49/78/72/384497872.db2.gz SSDMFTFLWZNTNX-VXGBXAGGSA-N 1 2 249.358 2.214 20 0 BEADLO CC[N@H+](CCCC(=O)OC)c1ccccc1 ZINC000037286360 384493550 /nfs/dbraw/zinc/49/35/50/384493550.db2.gz WFVOFOQOIUNKQC-UHFFFAOYSA-N 1 2 221.300 2.466 20 0 BEADLO CC[N@@H+](CCCC(=O)OC)c1ccccc1 ZINC000037286360 384493551 /nfs/dbraw/zinc/49/35/51/384493551.db2.gz WFVOFOQOIUNKQC-UHFFFAOYSA-N 1 2 221.300 2.466 20 0 BEADLO OCc1cc[nH+]c(N[C@@H]2CC[C@H]3C[C@H]3C2)c1 ZINC000403098733 384515732 /nfs/dbraw/zinc/51/57/32/384515732.db2.gz CBBGPCRFVMZYCZ-SDDRHHMPSA-N 1 2 218.300 2.174 20 0 BEADLO Cc1ccc(NC(=O)COC(C)C)c(C)[nH+]1 ZINC000122910315 384518474 /nfs/dbraw/zinc/51/84/74/384518474.db2.gz LKOHHKZOSBYDGL-UHFFFAOYSA-N 1 2 222.288 2.062 20 0 BEADLO Cc1cc(N[C@H]2CC23CC3)nc(C2CC2)[nH+]1 ZINC000335105824 384551390 /nfs/dbraw/zinc/55/13/90/384551390.db2.gz VQEIYHATILPYHG-JTQLQIEISA-N 1 2 215.300 2.049 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)CCc2c[nH+]c[nH]2)[C@H]1C ZINC000248816221 384554452 /nfs/dbraw/zinc/55/44/52/384554452.db2.gz CZRNERWZZRERPQ-MDZLAQPJSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)CCc2c[nH]c[nH+]2)[C@H]1C ZINC000248816221 384554460 /nfs/dbraw/zinc/55/44/60/384554460.db2.gz CZRNERWZZRERPQ-MDZLAQPJSA-N 1 2 249.358 2.283 20 0 BEADLO COCc1cccc(NCc2[nH]cc[nH+]2)c1 ZINC000049714877 384561013 /nfs/dbraw/zinc/56/10/13/384561013.db2.gz KBCIYRNQMDQABV-UHFFFAOYSA-N 1 2 217.272 2.168 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)[C@H]1CC1(C)C ZINC000123220228 384538620 /nfs/dbraw/zinc/53/86/20/384538620.db2.gz NYZOHHJGWBZHKL-SECBINFHSA-N 1 2 233.315 2.132 20 0 BEADLO Cc1cc(C)c(C(=O)NCc2[nH]cc[nH+]2)c(C)c1 ZINC000080587478 384569827 /nfs/dbraw/zinc/56/98/27/384569827.db2.gz OJZSCLQNLHCDMR-UHFFFAOYSA-N 1 2 243.310 2.265 20 0 BEADLO Cc1nc(C(C)(C)[NH2+]CCSC(C)C)no1 ZINC000309586370 384571181 /nfs/dbraw/zinc/57/11/81/384571181.db2.gz RWCFPHMESZKWCZ-UHFFFAOYSA-N 1 2 243.376 2.344 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)Nc1cc[nH+]c(C)c1 ZINC000359914853 384610544 /nfs/dbraw/zinc/61/05/44/384610544.db2.gz BWICBUUJAHMGHC-ZYHUDNBSSA-N 1 2 218.300 2.187 20 0 BEADLO COC[C@@H]([NH2+]Cc1cncs1)c1ccco1 ZINC000124349308 384634023 /nfs/dbraw/zinc/63/40/23/384634023.db2.gz GRSLRSDAWINMBW-SNVBAGLBSA-N 1 2 238.312 2.213 20 0 BEADLO C[NH+](C)c1ccc(NCc2ccc(CO)o2)cc1 ZINC000081572692 384621964 /nfs/dbraw/zinc/62/19/64/384621964.db2.gz QKQAYQPHGRIXNT-UHFFFAOYSA-N 1 2 246.310 2.450 20 0 BEADLO COC[C@H]([NH2+]Cc1cc(C)no1)c1ccco1 ZINC000184572438 384622249 /nfs/dbraw/zinc/62/22/49/384622249.db2.gz VMVMJIRMHMQARY-NSHDSACASA-N 1 2 236.271 2.053 20 0 BEADLO Cc1nc(C[NH+]2CCSCC2)sc1C ZINC000081666038 384629068 /nfs/dbraw/zinc/62/90/68/384629068.db2.gz LYCZAYYFDPWMFC-UHFFFAOYSA-N 1 2 228.386 2.309 20 0 BEADLO FC(F)C[N@@H+]1CCOC[C@H](C2CCC2)C1 ZINC000367822927 384633883 /nfs/dbraw/zinc/63/38/83/384633883.db2.gz MWTJHQOENMWKFC-SNVBAGLBSA-N 1 2 219.275 2.000 20 0 BEADLO FC(F)C[N@H+]1CCOC[C@H](C2CCC2)C1 ZINC000367822927 384633891 /nfs/dbraw/zinc/63/38/91/384633891.db2.gz MWTJHQOENMWKFC-SNVBAGLBSA-N 1 2 219.275 2.000 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1C[C@H](C)CC1(C)C ZINC000517962044 384596006 /nfs/dbraw/zinc/59/60/06/384596006.db2.gz YJPDIKPOIRDSLA-GHMZBOCLSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1C[C@H](C)CC1(C)C ZINC000517962044 384596011 /nfs/dbraw/zinc/59/60/11/384596011.db2.gz YJPDIKPOIRDSLA-GHMZBOCLSA-N 1 2 249.358 2.235 20 0 BEADLO Cc1[nH]c(CN[C@@H](C)c2cccnc2)[nH+]c1C ZINC000517964356 384596062 /nfs/dbraw/zinc/59/60/62/384596062.db2.gz CPIVRTGGAZLZCT-NSHDSACASA-N 1 2 230.315 2.272 20 0 BEADLO COCc1cnc(C[NH2+]Cc2ccoc2)s1 ZINC000309851142 384667372 /nfs/dbraw/zinc/66/73/72/384667372.db2.gz IYGQLGSVGRDEHF-UHFFFAOYSA-N 1 2 238.312 2.172 20 0 BEADLO CC(=O)CSc1[nH+]cc2ccccn21 ZINC000334919629 384668005 /nfs/dbraw/zinc/66/80/05/384668005.db2.gz MLIRQLVCJVJHMO-UHFFFAOYSA-N 1 2 206.270 2.015 20 0 BEADLO CN(C)c1ccc(NCc2cccn2C)c[nH+]1 ZINC000050595380 384634544 /nfs/dbraw/zinc/63/45/44/384634544.db2.gz CELRRNBNPAXFSN-UHFFFAOYSA-N 1 2 230.315 2.098 20 0 BEADLO c1ccc2[nH+]c(N3CCOC4(CCC4)C3)[nH]c2c1 ZINC000270844681 384636345 /nfs/dbraw/zinc/63/63/45/384636345.db2.gz XECJQPLREOAHCS-UHFFFAOYSA-N 1 2 243.310 2.322 20 0 BEADLO Cc1cc(N[C@@H]2CC[C@@H]3C[C@@H]3C2)nc[nH+]1 ZINC000403342033 384638624 /nfs/dbraw/zinc/63/86/24/384638624.db2.gz GLUHDDIKXXCGCN-GMTAPVOTSA-N 1 2 203.289 2.386 20 0 BEADLO Cc1ccc2c(c1)[C@@H]([NH2+]CC(F)(F)CO)CC2 ZINC000184713153 384639953 /nfs/dbraw/zinc/63/99/53/384639953.db2.gz BHPVGRCCCXWWQM-LBPRGKRZSA-N 1 2 241.281 2.200 20 0 BEADLO CCc1cc(N[C@H](C)C(F)F)nc[nH+]1 ZINC000306754155 384677777 /nfs/dbraw/zinc/67/77/77/384677777.db2.gz MQBVMYLXODYFTJ-ZCFIWIBFSA-N 1 2 201.220 2.105 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H]1CC2CCC1CC2 ZINC000380193163 384684827 /nfs/dbraw/zinc/68/48/27/384684827.db2.gz XVLFJJAVNCISBA-MCIGGMRASA-N 1 2 247.342 2.161 20 0 BEADLO COC(=O)C[N@H+](C)[C@H](C)c1cccc(C)c1 ZINC000173500087 384685037 /nfs/dbraw/zinc/68/50/37/384685037.db2.gz OCZZXICRBGBGLP-LLVKDONJSA-N 1 2 221.300 2.161 20 0 BEADLO COC(=O)C[N@@H+](C)[C@H](C)c1cccc(C)c1 ZINC000173500087 384685041 /nfs/dbraw/zinc/68/50/41/384685041.db2.gz OCZZXICRBGBGLP-LLVKDONJSA-N 1 2 221.300 2.161 20 0 BEADLO Cc1cnc([C@H](C)[NH2+]Cc2ccn(C)n2)s1 ZINC000125182238 384701049 /nfs/dbraw/zinc/70/10/49/384701049.db2.gz LGTJULXDLWTQAY-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO Cc1cnc([C@H](C)[NH2+]Cc2ccnn2C)s1 ZINC000125174654 384701634 /nfs/dbraw/zinc/70/16/34/384701634.db2.gz GDUWDJYRBMQPPZ-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO COC(=O)C[NH2+]C1(Cc2ccccc2)CCCC1 ZINC000185828394 384775445 /nfs/dbraw/zinc/77/54/45/384775445.db2.gz ZFDIJACKFOFXAQ-UHFFFAOYSA-N 1 2 247.338 2.305 20 0 BEADLO CCc1cc(N)nc(S[C@@H](C)CCOC)[nH+]1 ZINC000279079720 384778622 /nfs/dbraw/zinc/77/86/22/384778622.db2.gz LPKPPSBCMDOIGH-QMMMGPOBSA-N 1 2 241.360 2.138 20 0 BEADLO COc1ncc(C[N@H+](C)Cc2ccccn2)s1 ZINC000643890275 384729116 /nfs/dbraw/zinc/72/91/16/384729116.db2.gz BYPMEIBTMXCACX-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1ncc(C[N@@H+](C)Cc2ccccn2)s1 ZINC000643890275 384729125 /nfs/dbraw/zinc/72/91/25/384729125.db2.gz BYPMEIBTMXCACX-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO Cc1ncc(C[NH2+]Cc2nc(C)c(C)[nH]2)s1 ZINC000568269460 384731783 /nfs/dbraw/zinc/73/17/83/384731783.db2.gz LTIOYWGMGZJQEY-UHFFFAOYSA-N 1 2 236.344 2.081 20 0 BEADLO Cc1ncc(CNCc2[nH]c(C)c(C)[nH+]2)s1 ZINC000568269460 384731791 /nfs/dbraw/zinc/73/17/91/384731791.db2.gz LTIOYWGMGZJQEY-UHFFFAOYSA-N 1 2 236.344 2.081 20 0 BEADLO Cc1cnc(SCCCn2cc[nH+]c2)nc1 ZINC000185528567 384735200 /nfs/dbraw/zinc/73/52/00/384735200.db2.gz DTCIFKKTSIRWHR-UHFFFAOYSA-N 1 2 234.328 2.164 20 0 BEADLO CC(C)c1csc(CNCc2[nH]cc[nH+]2)n1 ZINC000125610225 384735366 /nfs/dbraw/zinc/73/53/66/384735366.db2.gz XEHWOEXCANJHJU-UHFFFAOYSA-N 1 2 236.344 2.279 20 0 BEADLO Cc1cnc(C[N@@H+]2CCO[C@@H]3CCC[C@@H]32)s1 ZINC000271441211 384737510 /nfs/dbraw/zinc/73/75/10/384737510.db2.gz CPICJAGEHMJOJJ-WDEREUQCSA-N 1 2 238.356 2.205 20 0 BEADLO Cc1cnc(C[N@H+]2CCO[C@@H]3CCC[C@@H]32)s1 ZINC000271441211 384737516 /nfs/dbraw/zinc/73/75/16/384737516.db2.gz CPICJAGEHMJOJJ-WDEREUQCSA-N 1 2 238.356 2.205 20 0 BEADLO CCS[C@@H]1CCC[C@H]1[NH2+][C@@H](CC)C(=O)OC ZINC000300393106 384746127 /nfs/dbraw/zinc/74/61/27/384746127.db2.gz WFFSXXJKKVFDJS-HBNTYKKESA-N 1 2 245.388 2.202 20 0 BEADLO C[C@H]1OCC[C@@H]1SCCCn1cc[nH+]c1 ZINC000185635255 384752287 /nfs/dbraw/zinc/75/22/87/384752287.db2.gz NOFSLMDLGNYFAU-MNOVXSKESA-N 1 2 226.345 2.184 20 0 BEADLO CCOC(=O)CC[C@@H]1CCC[N@H+](CC(F)F)C1 ZINC000178858809 384762504 /nfs/dbraw/zinc/76/25/04/384762504.db2.gz NDEHTHKFROSLGD-JTQLQIEISA-N 1 2 249.301 2.307 20 0 BEADLO CCOC(=O)CC[C@@H]1CCC[N@@H+](CC(F)F)C1 ZINC000178858809 384762513 /nfs/dbraw/zinc/76/25/13/384762513.db2.gz NDEHTHKFROSLGD-JTQLQIEISA-N 1 2 249.301 2.307 20 0 BEADLO CCOC(=O)CC[C@H]1CCC[N@H+](CC(F)F)C1 ZINC000178858819 384763403 /nfs/dbraw/zinc/76/34/03/384763403.db2.gz NDEHTHKFROSLGD-SNVBAGLBSA-N 1 2 249.301 2.307 20 0 BEADLO CCOC(=O)CC[C@H]1CCC[N@@H+](CC(F)F)C1 ZINC000178858819 384763410 /nfs/dbraw/zinc/76/34/10/384763410.db2.gz NDEHTHKFROSLGD-SNVBAGLBSA-N 1 2 249.301 2.307 20 0 BEADLO Cc1c(Cl)c(C[N@@H+](C)C(C)C)nn1C ZINC000334986682 384765447 /nfs/dbraw/zinc/76/54/47/384765447.db2.gz STPCMMJPJIGSIN-UHFFFAOYSA-N 1 2 215.728 2.222 20 0 BEADLO Cc1c(Cl)c(C[N@H+](C)C(C)C)nn1C ZINC000334986682 384765455 /nfs/dbraw/zinc/76/54/55/384765455.db2.gz STPCMMJPJIGSIN-UHFFFAOYSA-N 1 2 215.728 2.222 20 0 BEADLO COC(=O)C(C)(C)[NH2+]Cc1ccc2[nH]ccc2c1 ZINC000083375285 384767621 /nfs/dbraw/zinc/76/76/21/384767621.db2.gz HAGSJWOUKLBFOU-UHFFFAOYSA-N 1 2 246.310 2.209 20 0 BEADLO COC(=O)C(C)(C)[NH2+]Cc1cccc2cc[nH]c21 ZINC000083375284 384768436 /nfs/dbraw/zinc/76/84/36/384768436.db2.gz YXBMQCVQZGPOSQ-UHFFFAOYSA-N 1 2 246.310 2.209 20 0 BEADLO CC(C)[N@H+](CCC[C@H](C)O)CC(F)F ZINC000308578489 384819424 /nfs/dbraw/zinc/81/94/24/384819424.db2.gz NZQHAYKKKHMTRN-VIFPVBQESA-N 1 2 209.280 2.123 20 0 BEADLO CC(C)[N@@H+](CCC[C@H](C)O)CC(F)F ZINC000308578489 384819429 /nfs/dbraw/zinc/81/94/29/384819429.db2.gz NZQHAYKKKHMTRN-VIFPVBQESA-N 1 2 209.280 2.123 20 0 BEADLO CC[C@H](F)CSc1nc(N)cc(C)[nH+]1 ZINC000308576274 384822702 /nfs/dbraw/zinc/82/27/02/384822702.db2.gz MVYUYEBDYAXHLC-ZETCQYMHSA-N 1 2 215.297 2.207 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2ccon2)nc1 ZINC000309778055 384824995 /nfs/dbraw/zinc/82/49/95/384824995.db2.gz MDGDWMIEUMBHLG-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO CC[N@H+](CCCNC(C)=O)c1ccccc1 ZINC000053639173 384800147 /nfs/dbraw/zinc/80/01/47/384800147.db2.gz RVMMVSWCIQNXMZ-UHFFFAOYSA-N 1 2 220.316 2.039 20 0 BEADLO CC[N@@H+](CCCNC(C)=O)c1ccccc1 ZINC000053639173 384800156 /nfs/dbraw/zinc/80/01/56/384800156.db2.gz RVMMVSWCIQNXMZ-UHFFFAOYSA-N 1 2 220.316 2.039 20 0 BEADLO CCC(O)(CC)CCNc1cc(C)[nH+]cn1 ZINC000310035834 384804276 /nfs/dbraw/zinc/80/42/76/384804276.db2.gz UDLIHPOFMNHKMO-UHFFFAOYSA-N 1 2 223.320 2.138 20 0 BEADLO CCC[C@H]([NH2+][C@@H]1CSC1(C)C)C(=O)OCC ZINC000310039951 384809090 /nfs/dbraw/zinc/80/90/90/384809090.db2.gz XLPQPCPRBJNOMM-VHSXEESVSA-N 1 2 245.388 2.202 20 0 BEADLO CCc1cc(N)nc(SC/C=C/Cl)[nH+]1 ZINC000279129857 384889593 /nfs/dbraw/zinc/88/95/93/384889593.db2.gz VWLXCCQNTZPRNL-ONEGZZNKSA-N 1 2 229.736 2.466 20 0 BEADLO C[C@]1(CNc2cccc[nH+]2)CCCC[C@H]1O ZINC000301485596 384876793 /nfs/dbraw/zinc/87/67/93/384876793.db2.gz HIJLVUGUKJOVRF-DGCLKSJQSA-N 1 2 220.316 2.435 20 0 BEADLO CCCc1nc(C[N@H+](C)[C@@H](C)CC)no1 ZINC000104688223 384838584 /nfs/dbraw/zinc/83/85/84/384838584.db2.gz SIFUKHKLDVXSRU-VIFPVBQESA-N 1 2 211.309 2.252 20 0 BEADLO CCCc1nc(C[N@@H+](C)[C@@H](C)CC)no1 ZINC000104688223 384838590 /nfs/dbraw/zinc/83/85/90/384838590.db2.gz SIFUKHKLDVXSRU-VIFPVBQESA-N 1 2 211.309 2.252 20 0 BEADLO CC[C@H](c1ccccc1)[N@H+](C)Cc1nnc[nH]1 ZINC000174812181 384842647 /nfs/dbraw/zinc/84/26/47/384842647.db2.gz JRBDPTSENUASIL-GFCCVEGCSA-N 1 2 230.315 2.388 20 0 BEADLO CC[C@H](c1ccccc1)[N@@H+](C)Cc1nnc[nH]1 ZINC000174812181 384842655 /nfs/dbraw/zinc/84/26/55/384842655.db2.gz JRBDPTSENUASIL-GFCCVEGCSA-N 1 2 230.315 2.388 20 0 BEADLO C[C@@H]([NH2+][C@H](CCO)c1ccco1)c1ccccn1 ZINC000186515359 384846473 /nfs/dbraw/zinc/84/64/73/384846473.db2.gz PAVMHBGMRKXTHT-DGCLKSJQSA-N 1 2 246.310 2.449 20 0 BEADLO CO[C@@H](C)c1nc(C[N@H+](C)C2CC2)cs1 ZINC000175095566 384868153 /nfs/dbraw/zinc/86/81/53/384868153.db2.gz XIPVZDQXCWTLDE-QMMMGPOBSA-N 1 2 226.345 2.445 20 0 BEADLO CO[C@@H](C)c1nc(C[N@@H+](C)C2CC2)cs1 ZINC000175095566 384868158 /nfs/dbraw/zinc/86/81/58/384868158.db2.gz XIPVZDQXCWTLDE-QMMMGPOBSA-N 1 2 226.345 2.445 20 0 BEADLO CO[C@H](C)CNc1[nH+]ccc(C)c1Cl ZINC000306438444 384950935 /nfs/dbraw/zinc/95/09/35/384950935.db2.gz IIRLRALQSDQKHN-MRVPVSSYSA-N 1 2 214.696 2.490 20 0 BEADLO CCS[C@@H](C)c1noc(C[NH+]2CCCC2)n1 ZINC000119696950 384951416 /nfs/dbraw/zinc/95/14/16/384951416.db2.gz KSWCEVZHILIYPP-VIFPVBQESA-N 1 2 241.360 2.480 20 0 BEADLO CC(C)(C)c1nc(NCC(F)F)cc[nH+]1 ZINC000301598140 384892895 /nfs/dbraw/zinc/89/28/95/384892895.db2.gz TUROWBYYPUADNS-UHFFFAOYSA-N 1 2 215.247 2.451 20 0 BEADLO CC(C)(C)/C=C/C(=O)NCCCCn1cc[nH+]c1 ZINC000491837666 384895399 /nfs/dbraw/zinc/89/53/99/384895399.db2.gz ILSFCWFRKAQHSO-VOTSOKGWSA-N 1 2 249.358 2.382 20 0 BEADLO COc1cc[nH+]cc1NC(=O)CCc1ccoc1 ZINC000177200858 384900406 /nfs/dbraw/zinc/90/04/06/384900406.db2.gz OIENZPPQJJPPIX-UHFFFAOYSA-N 1 2 246.266 2.255 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000127476217 384900846 /nfs/dbraw/zinc/90/08/46/384900846.db2.gz HITBASWHJVNWJV-CYBMUJFWSA-N 1 2 230.315 2.383 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000127476217 384900850 /nfs/dbraw/zinc/90/08/50/384900850.db2.gz HITBASWHJVNWJV-CYBMUJFWSA-N 1 2 230.315 2.383 20 0 BEADLO Cc1cc(N[C@@H]2CCC[C@H]2O)nc(C(C)C)[nH+]1 ZINC000301673909 384908143 /nfs/dbraw/zinc/90/81/43/384908143.db2.gz RMNGMTOTLDHEGS-GHMZBOCLSA-N 1 2 235.331 2.234 20 0 BEADLO CC(C)c1nc(N2CCSCC2)cc[nH+]1 ZINC000106464766 384915539 /nfs/dbraw/zinc/91/55/39/384915539.db2.gz DOFRCFBAZTXLOV-UHFFFAOYSA-N 1 2 223.345 2.153 20 0 BEADLO Nc1nc(NCC2CC2)[nH+]c2ccccc12 ZINC000301857304 384937001 /nfs/dbraw/zinc/93/70/01/384937001.db2.gz DJZNWXGFKWZYIJ-UHFFFAOYSA-N 1 2 214.272 2.034 20 0 BEADLO Cc1cc(NCC[C@@H](C)F)nc(C(C)C)[nH+]1 ZINC000338758532 384945830 /nfs/dbraw/zinc/94/58/30/384945830.db2.gz WGWJAFANWILBAO-SECBINFHSA-N 1 2 225.311 2.490 20 0 BEADLO c1ccc2[nH+]c(NCC3=CCOCC3)ccc2c1 ZINC000336193992 384947589 /nfs/dbraw/zinc/94/75/89/384947589.db2.gz IROGAFIQVJJXBM-UHFFFAOYSA-N 1 2 240.306 2.415 20 0 BEADLO C[C@@H](N[C@@H](C)C(F)(F)F)c1[nH+]ccn1C ZINC000336760638 384972744 /nfs/dbraw/zinc/97/27/44/384972744.db2.gz MHFPHCRKIMMLMQ-RQJHMYQMSA-N 1 2 221.226 2.022 20 0 BEADLO CCCCN(C)C(=O)c1ccc2[nH+]ccn2c1 ZINC000057910824 384973032 /nfs/dbraw/zinc/97/30/32/384973032.db2.gz URINMXHSCFEPSY-UHFFFAOYSA-N 1 2 231.299 2.206 20 0 BEADLO COCc1cnc(C[NH2+][C@H]2CCC[C@H]2F)s1 ZINC000339584383 385021803 /nfs/dbraw/zinc/02/18/03/385021803.db2.gz MANHUQQOZOJQEM-ZJUUUORDSA-N 1 2 244.335 2.270 20 0 BEADLO COc1ncccc1C[NH2+][C@@H](C)c1nccs1 ZINC000086509848 385023283 /nfs/dbraw/zinc/02/32/83/385023283.db2.gz ZBPWDYBZLVXTNW-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO Fc1cc(F)cc(C[NH2+]CC(F)F)c1 ZINC000147722711 385016915 /nfs/dbraw/zinc/01/69/15/385016915.db2.gz UIDRCCOQHNYYHK-UHFFFAOYSA-N 1 2 207.170 2.320 20 0 BEADLO Cc1cc(NC[C@@H]2CCCC2(F)F)nc[nH+]1 ZINC000336232726 385057723 /nfs/dbraw/zinc/05/77/23/385057723.db2.gz LLOBNEMMFGFOHE-VIFPVBQESA-N 1 2 227.258 2.054 20 0 BEADLO Cc1nc(C[N@@H+]2CCSC(C)(C)CC2)no1 ZINC000334152009 385080649 /nfs/dbraw/zinc/08/06/49/385080649.db2.gz UOKDJURDKLNGLE-UHFFFAOYSA-N 1 2 241.360 2.096 20 0 BEADLO Cc1nc(C[N@H+]2CCSC(C)(C)CC2)no1 ZINC000334152009 385080653 /nfs/dbraw/zinc/08/06/53/385080653.db2.gz UOKDJURDKLNGLE-UHFFFAOYSA-N 1 2 241.360 2.096 20 0 BEADLO Nc1nc(N2CCC=C(F)C2)[nH+]c2ccccc12 ZINC000557593740 385037146 /nfs/dbraw/zinc/03/71/46/385037146.db2.gz ADPHCKKRIIBBNU-UHFFFAOYSA-N 1 2 244.273 2.106 20 0 BEADLO CCO[C@H]1C[C@@H]1C(=O)Nc1ccc(C)[nH+]c1C ZINC000176208782 385040746 /nfs/dbraw/zinc/04/07/46/385040746.db2.gz ZIBLHXDRCBREDI-JQWIXIFHSA-N 1 2 234.299 2.062 20 0 BEADLO CC[C@H](O)CNc1ccc(-n2cc[nH+]c2)cc1 ZINC000644691047 385110176 /nfs/dbraw/zinc/11/01/76/385110176.db2.gz LPADZFVAGBNJJK-ZDUSSCGKSA-N 1 2 231.299 2.055 20 0 BEADLO Cc1ccc(NC(=O)N(C)C2CC2)c(C)[nH+]1 ZINC000176752141 385141413 /nfs/dbraw/zinc/14/14/13/385141413.db2.gz VTIVHPIRTVLERT-UHFFFAOYSA-N 1 2 219.288 2.325 20 0 BEADLO CC[C@H]1CCN(C(=O)c2ccc3[nH+]ccn3c2)C1 ZINC000176593296 385115918 /nfs/dbraw/zinc/11/59/18/385115918.db2.gz JGCSDBLLAUFBOT-NSHDSACASA-N 1 2 243.310 2.206 20 0 BEADLO Cc1[nH+]cn(-c2ccc(NC[C@@H](C)O)cc2)c1C ZINC000644702534 385119401 /nfs/dbraw/zinc/11/94/01/385119401.db2.gz SAWNTMCFOYTTCM-SNVBAGLBSA-N 1 2 245.326 2.282 20 0 BEADLO CC(C)Oc1ccc(C[N@@H+]2CCO[C@H]3C[C@H]32)cc1 ZINC000644716427 385134620 /nfs/dbraw/zinc/13/46/20/385134620.db2.gz JSBGAVWHBGDQMC-CABCVRRESA-N 1 2 247.338 2.447 20 0 BEADLO CC(C)Oc1ccc(C[N@H+]2CCO[C@H]3C[C@H]32)cc1 ZINC000644716427 385134628 /nfs/dbraw/zinc/13/46/28/385134628.db2.gz JSBGAVWHBGDQMC-CABCVRRESA-N 1 2 247.338 2.447 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2ccccc2)o1 ZINC000061745464 385136652 /nfs/dbraw/zinc/13/66/52/385136652.db2.gz NZCUQKKXAFUBTP-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2ccccc2)o1 ZINC000061745464 385136659 /nfs/dbraw/zinc/13/66/59/385136659.db2.gz NZCUQKKXAFUBTP-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO CCc1nc(C)c(C[NH2+][C@H](C)c2ncc[nH]2)o1 ZINC000291973501 385087742 /nfs/dbraw/zinc/08/77/42/385087742.db2.gz UGNWGZKXOFHPQU-SECBINFHSA-N 1 2 234.303 2.119 20 0 BEADLO CCc1nc(C)c(CN[C@H](C)c2[nH]cc[nH+]2)o1 ZINC000291973501 385087747 /nfs/dbraw/zinc/08/77/47/385087747.db2.gz UGNWGZKXOFHPQU-SECBINFHSA-N 1 2 234.303 2.119 20 0 BEADLO CCc1ccc(C[NH2+][C@@H]2CCCn3ncnc32)o1 ZINC000151180365 385091233 /nfs/dbraw/zinc/09/12/33/385091233.db2.gz YEHWKHXKDMVWPK-GFCCVEGCSA-N 1 2 246.314 2.058 20 0 BEADLO C[C@@H](N[C@@H](C)C(F)(F)F)c1[nH]cc[nH+]1 ZINC000287224304 385097553 /nfs/dbraw/zinc/09/75/53/385097553.db2.gz GGVMYBZYRBZHEJ-RITPCOANSA-N 1 2 207.199 2.011 20 0 BEADLO C[C@@H]([NH2+]c1ccc2c(c1)CCO2)[C@H]1CCOC1 ZINC000165287958 385098816 /nfs/dbraw/zinc/09/88/16/385098816.db2.gz IGONCHIZHCKQQQ-PWSUYJOCSA-N 1 2 233.311 2.458 20 0 BEADLO FC(F)n1ccnc1C[NH2+]Cc1cncs1 ZINC000157454036 385185382 /nfs/dbraw/zinc/18/53/82/385185382.db2.gz UARLDHGWABJSAD-UHFFFAOYSA-N 1 2 244.270 2.025 20 0 BEADLO Cc1cc(C)c(C[N@H+](C)Cc2nnc[nH]2)c(C)c1 ZINC000177132696 385188974 /nfs/dbraw/zinc/18/89/74/385188974.db2.gz HEDAKFOSSGCHLH-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO Cc1cc(C)c(C[N@@H+](C)Cc2nnc[nH]2)c(C)c1 ZINC000177132696 385188976 /nfs/dbraw/zinc/18/89/76/385188976.db2.gz HEDAKFOSSGCHLH-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO C[N@H+](CCCOc1ccccc1)Cc1ncc[nH]1 ZINC000109829940 385193563 /nfs/dbraw/zinc/19/35/63/385193563.db2.gz UGKSCHBTMJMYEB-UHFFFAOYSA-N 1 2 245.326 2.311 20 0 BEADLO C[N@@H+](CCCOc1ccccc1)Cc1ncc[nH]1 ZINC000109829940 385193567 /nfs/dbraw/zinc/19/35/67/385193567.db2.gz UGKSCHBTMJMYEB-UHFFFAOYSA-N 1 2 245.326 2.311 20 0 BEADLO c1nc(NCC2CC2)cc(NCCCC2CC2)[nH+]1 ZINC000533887518 385194198 /nfs/dbraw/zinc/19/41/98/385194198.db2.gz FMZBPBCWIKUFFW-UHFFFAOYSA-N 1 2 246.358 2.323 20 0 BEADLO c1nc(NCCCC2CC2)cc(NCC2CC2)[nH+]1 ZINC000533887518 385194203 /nfs/dbraw/zinc/19/42/03/385194203.db2.gz FMZBPBCWIKUFFW-UHFFFAOYSA-N 1 2 246.358 2.323 20 0 BEADLO Cc1ccc(NC(=O)N[C@@H]2C[C@H]2C)c(C)[nH+]1 ZINC000176761129 385145539 /nfs/dbraw/zinc/14/55/39/385145539.db2.gz JHOZNUVJNARALK-RDDDGLTNSA-N 1 2 219.288 2.228 20 0 BEADLO O=C(c1cc[nH]c1)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000109265080 385146247 /nfs/dbraw/zinc/14/62/47/385146247.db2.gz VFDJBMHZIUSSKL-NSHDSACASA-N 1 2 244.298 2.105 20 0 BEADLO Cc1[nH]ncc1C[NH2+]Cc1cc2ccccc2[nH]1 ZINC000119725950 385164201 /nfs/dbraw/zinc/16/42/01/385164201.db2.gz YYJLFDORJUKBSN-UHFFFAOYSA-N 1 2 240.310 2.489 20 0 BEADLO CCSc1cc(C[NH2+]Cc2ncc[nH]2)ccn1 ZINC000189588533 385166299 /nfs/dbraw/zinc/16/62/99/385166299.db2.gz ACUQVZBCWGJVKK-UHFFFAOYSA-N 1 2 248.355 2.207 20 0 BEADLO CCC[C@@H](OC)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000648313652 385171477 /nfs/dbraw/zinc/17/14/77/385171477.db2.gz SQSRVEWWQUPZMM-LLVKDONJSA-N 1 2 247.298 2.088 20 0 BEADLO CCC[C@H](OC)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000648313653 385173799 /nfs/dbraw/zinc/17/37/99/385173799.db2.gz SQSRVEWWQUPZMM-NSHDSACASA-N 1 2 247.298 2.088 20 0 BEADLO COC[C@H](Cc1ccccc1)[NH2+]CC(C)(F)F ZINC000559875951 385209334 /nfs/dbraw/zinc/20/93/34/385209334.db2.gz CTICZSQIFZIPBT-LBPRGKRZSA-N 1 2 243.297 2.489 20 0 BEADLO Fc1cccc(C2([NH2+]Cc3ncc[nH]3)CC2)c1 ZINC000152868214 385219576 /nfs/dbraw/zinc/21/95/76/385219576.db2.gz FMWKDAXMVMWKHI-UHFFFAOYSA-N 1 2 231.274 2.328 20 0 BEADLO c1ccc(NCCCCNc2cnccn2)[nH+]c1 ZINC000110491232 385242534 /nfs/dbraw/zinc/24/25/34/385242534.db2.gz BAOQEYGRUMTHGE-UHFFFAOYSA-N 1 2 243.314 2.176 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H](C)[C@H](C)c1ccccc1 ZINC000177481293 385251354 /nfs/dbraw/zinc/25/13/54/385251354.db2.gz GLWJGVMAWUBBFY-SRVKXCTJSA-N 1 2 235.327 2.330 20 0 BEADLO Cc1nc(C[NH2+][C@H](CO)c2ccccc2)oc1C ZINC000063003067 385203152 /nfs/dbraw/zinc/20/31/52/385203152.db2.gz GSZOGPRJOLIAJH-CYBMUJFWSA-N 1 2 246.310 2.115 20 0 BEADLO CCC[C@H]([NH2+]CC1(C(F)F)CC1)C(=O)OCC ZINC000360595048 385267940 /nfs/dbraw/zinc/26/79/40/385267940.db2.gz CMMUJVNSSIHAQG-VIFPVBQESA-N 1 2 249.301 2.353 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2nncn2C)cc1F ZINC000110975666 385273264 /nfs/dbraw/zinc/27/32/64/385273264.db2.gz AHYGPNSCQAIBCA-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO Cn1c2ccccc2[nH+]c1N[C@H]1COCC1(C)C ZINC000313056427 385283123 /nfs/dbraw/zinc/28/31/23/385283123.db2.gz BAGAXWPRGWUPNC-LBPRGKRZSA-N 1 2 245.326 2.410 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3c[nH]nc3C2)cs1 ZINC000648376297 385284700 /nfs/dbraw/zinc/28/47/00/385284700.db2.gz BNCAHMFPBSTYNC-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1cc(C[N@H+]2CCc3c[nH]nc3C2)cs1 ZINC000648376297 385284708 /nfs/dbraw/zinc/28/47/08/385284708.db2.gz BNCAHMFPBSTYNC-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3cn[nH]c3C2)cs1 ZINC000648376297 385284714 /nfs/dbraw/zinc/28/47/14/385284714.db2.gz BNCAHMFPBSTYNC-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1cc(C[N@H+]2CCc3cn[nH]c3C2)cs1 ZINC000648376297 385284718 /nfs/dbraw/zinc/28/47/18/385284718.db2.gz BNCAHMFPBSTYNC-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO CC[C@H]1C[NH+](Cc2ccno2)C[C@H](CC)O1 ZINC000569224047 385293281 /nfs/dbraw/zinc/29/32/81/385293281.db2.gz ATCPZUHOCWQOIL-QWRGUYRKSA-N 1 2 224.304 2.064 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@@H+]1Cc1ccnc(Cl)c1 ZINC000178585869 385301524 /nfs/dbraw/zinc/30/15/24/385301524.db2.gz SKNSRIUESXBNIW-ZJUUUORDSA-N 1 2 240.734 2.344 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1ccnc(Cl)c1 ZINC000178585869 385301528 /nfs/dbraw/zinc/30/15/28/385301528.db2.gz SKNSRIUESXBNIW-ZJUUUORDSA-N 1 2 240.734 2.344 20 0 BEADLO CO[C@@H](C)[C@H](C)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000191902080 385331919 /nfs/dbraw/zinc/33/19/19/385331919.db2.gz IZSHKTNIOPKVEO-UWVGGRQHSA-N 1 2 235.331 2.498 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cocn2)CCS1 ZINC000191944197 385334597 /nfs/dbraw/zinc/33/45/97/385334597.db2.gz YITHSTWWJCNWMJ-JTQLQIEISA-N 1 2 212.318 2.002 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cocn2)CCS1 ZINC000191944197 385334603 /nfs/dbraw/zinc/33/46/03/385334603.db2.gz YITHSTWWJCNWMJ-JTQLQIEISA-N 1 2 212.318 2.002 20 0 BEADLO Cc1csc(C[NH2+][C@H](C)c2ccnn2C)n1 ZINC000192250390 385350739 /nfs/dbraw/zinc/35/07/39/385350739.db2.gz WPAHZFBFYYERQV-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO FCC[NH2+]Cc1c[nH]c(-c2ccccc2)n1 ZINC000280675422 385350823 /nfs/dbraw/zinc/35/08/23/385350823.db2.gz MPHLESZPSCUNMA-UHFFFAOYSA-N 1 2 219.263 2.136 20 0 BEADLO COc1ccc(CNc2ccc(C)[nH+]c2)cn1 ZINC000158132220 385351166 /nfs/dbraw/zinc/35/11/66/385351166.db2.gz FLXSTPIRWDTMFB-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)C[C@@H]1C=CCC1 ZINC000154800308 385354994 /nfs/dbraw/zinc/35/49/94/385354994.db2.gz MFEGXIWTGATEFH-CYBMUJFWSA-N 1 2 247.342 2.088 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)[C@H]1CC=CCC1 ZINC000154859835 385361925 /nfs/dbraw/zinc/36/19/25/385361925.db2.gz MMPFJDONROOEOV-ZDUSSCGKSA-N 1 2 247.342 2.088 20 0 BEADLO CCc1ccc(C[NH2+][C@H](CC)C(=O)OC)s1 ZINC000192833995 385373168 /nfs/dbraw/zinc/37/31/68/385373168.db2.gz OAPOFUPKLWLWKE-LLVKDONJSA-N 1 2 241.356 2.352 20 0 BEADLO C[N@H+](Cc1ccoc1)Cc1ccncc1F ZINC000449016141 385374262 /nfs/dbraw/zinc/37/42/62/385374262.db2.gz NDZVSBPEQYLHMU-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO C[N@@H+](Cc1ccoc1)Cc1ccncc1F ZINC000449016141 385374266 /nfs/dbraw/zinc/37/42/66/385374266.db2.gz NDZVSBPEQYLHMU-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO COC(=O)[C@@H](C)[NH2+]C[C@@H](C)Cc1ccccc1 ZINC000193097586 385384871 /nfs/dbraw/zinc/38/48/71/385384871.db2.gz JTGKLOBVCAOXSS-NWDGAFQWSA-N 1 2 235.327 2.016 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N[C@@H]1CC=CCC1 ZINC000492529921 385394839 /nfs/dbraw/zinc/39/48/39/385394839.db2.gz HGIHJBGWUOECNU-JLVNDZCYSA-N 1 2 245.326 2.141 20 0 BEADLO Cc1[nH]c2ccc(NC(=O)[C@@H]3C[C@H]3C)cc2[nH+]1 ZINC000647661117 385399702 /nfs/dbraw/zinc/39/97/02/385399702.db2.gz RZVPMFZJIKFQEW-GMSGAONNSA-N 1 2 229.283 2.466 20 0 BEADLO Cc1c[nH]nc1CNc1c[nH+]cc(C)c1 ZINC000289421751 385403214 /nfs/dbraw/zinc/40/32/14/385403214.db2.gz CRZAKZJACGRFKU-UHFFFAOYSA-N 1 2 202.261 2.034 20 0 BEADLO CC1(C)CCCC[C@@H]1C(=O)NCCn1cc[nH+]c1 ZINC000193809842 385412906 /nfs/dbraw/zinc/41/29/06/385412906.db2.gz KOVVLZYCPHDPJG-GFCCVEGCSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1c[nH+]c(CNc2ccccc2)n1C ZINC000309192501 385457858 /nfs/dbraw/zinc/45/78/58/385457858.db2.gz PWYFWIWLCRXXNJ-UHFFFAOYSA-N 1 2 201.273 2.341 20 0 BEADLO Fc1ccc(/C=C/C[NH+]2CCOCC2)cc1 ZINC000156383840 385449712 /nfs/dbraw/zinc/44/97/12/385449712.db2.gz OIZDOINUSQSPAS-OWOJBTEDSA-N 1 2 221.275 2.171 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)NCC12CCC(CC1)C2 ZINC000492769352 385427180 /nfs/dbraw/zinc/42/71/80/385427180.db2.gz PQQRNCLWOSPIDE-UPHRSURJSA-N 1 2 245.326 2.119 20 0 BEADLO COC(=O)C[N@H+](C)CC(C)(C)c1ccccc1 ZINC000179710165 385485881 /nfs/dbraw/zinc/48/58/81/385485881.db2.gz AAGCHYHQJXEPKP-UHFFFAOYSA-N 1 2 235.327 2.069 20 0 BEADLO COC(=O)C[N@@H+](C)CC(C)(C)c1ccccc1 ZINC000179710165 385485883 /nfs/dbraw/zinc/48/58/83/385485883.db2.gz AAGCHYHQJXEPKP-UHFFFAOYSA-N 1 2 235.327 2.069 20 0 BEADLO C[N@H+](CCCO)Cc1nc(Cl)ccc1Cl ZINC000281886801 385459432 /nfs/dbraw/zinc/45/94/32/385459432.db2.gz PSJXTCODWFOQQY-UHFFFAOYSA-N 1 2 249.141 2.203 20 0 BEADLO C[N@@H+](CCCO)Cc1nc(Cl)ccc1Cl ZINC000281886801 385459435 /nfs/dbraw/zinc/45/94/35/385459435.db2.gz PSJXTCODWFOQQY-UHFFFAOYSA-N 1 2 249.141 2.203 20 0 BEADLO CC[C@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492896430 385460152 /nfs/dbraw/zinc/46/01/52/385460152.db2.gz JCXKRIUKNNIWRQ-QRGHLMKCSA-N 1 2 233.315 2.072 20 0 BEADLO CC(C)c1nc(N2CCOC(C)(C)C2)cc[nH+]1 ZINC000110202347 385494182 /nfs/dbraw/zinc/49/41/82/385494182.db2.gz PMPJTVRVJXSGKC-UHFFFAOYSA-N 1 2 235.331 2.215 20 0 BEADLO CO[C@@H]1CCCN(C(=O)Nc2cc[nH+]cc2C)C1 ZINC000179863425 385496711 /nfs/dbraw/zinc/49/67/11/385496711.db2.gz YHMOIDMQBFHLRG-LLVKDONJSA-N 1 2 249.314 2.033 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+]1CCO[C@H](C)C1 ZINC000179897187 385498412 /nfs/dbraw/zinc/49/84/12/385498412.db2.gz JKSYMQQWOXAQJL-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ccc(F)cc1C[N@H+]1CCO[C@H](C)C1 ZINC000179897187 385498416 /nfs/dbraw/zinc/49/84/16/385498416.db2.gz JKSYMQQWOXAQJL-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO CNc1ccc(C(=O)Nc2cc[nH+]cc2C)cn1 ZINC000111044375 385500399 /nfs/dbraw/zinc/50/03/99/385500399.db2.gz KBRWDUHWDMNHMZ-UHFFFAOYSA-N 1 2 242.282 2.079 20 0 BEADLO CC(C)c1nc(NC[C@@H]2CCCO2)cc[nH+]1 ZINC000106461813 385509597 /nfs/dbraw/zinc/50/95/97/385509597.db2.gz WYYIEXMYDVQBCW-JTQLQIEISA-N 1 2 221.304 2.191 20 0 BEADLO CC(C)c1nc(N2C[C@@H](C)O[C@H](C)C2)cc[nH+]1 ZINC000106461749 385510319 /nfs/dbraw/zinc/51/03/19/385510319.db2.gz ALKFCTOFNHTLBN-GHMZBOCLSA-N 1 2 235.331 2.214 20 0 BEADLO C[C@H]1CC(C)(C)CN1C(=O)/C=C\c1[nH]cc[nH+]1 ZINC000493069272 385511117 /nfs/dbraw/zinc/51/11/17/385511117.db2.gz GRZZIMRDCCWMGY-LWTINBJPSA-N 1 2 233.315 2.070 20 0 BEADLO CC(C)c1nc(C[NH2+][C@H]2CSC[C@H]2C)no1 ZINC000309316966 385528806 /nfs/dbraw/zinc/52/88/06/385528806.db2.gz DHYBSBVENBZAJR-BDAKNGLRSA-N 1 2 241.360 2.034 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493143142 385532656 /nfs/dbraw/zinc/53/26/56/385532656.db2.gz AAUJNXALFWGWRX-XIJCSBCJSA-N 1 2 233.315 2.118 20 0 BEADLO Cc1cc(NCC(C)(F)F)nc(C(C)C)[nH+]1 ZINC000378855070 385537549 /nfs/dbraw/zinc/53/75/49/385537549.db2.gz JMEOKRQXCLFFMZ-UHFFFAOYSA-N 1 2 229.274 2.397 20 0 BEADLO CC(C)[C@H]1CCCN1C(=O)/C=C\c1[nH]cc[nH+]1 ZINC000493162318 385540052 /nfs/dbraw/zinc/54/00/52/385540052.db2.gz SKFQECBZCSEQFE-ISALQUGTSA-N 1 2 233.315 2.070 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CCO[C@@H](C)[C@@H]1C ZINC000180726381 385542901 /nfs/dbraw/zinc/54/29/01/385542901.db2.gz RKKNYZYSMRTQNJ-QWRGUYRKSA-N 1 2 249.314 2.031 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CC(C3CC3)C2)[nH+]1 ZINC000643170204 385546193 /nfs/dbraw/zinc/54/61/93/385546193.db2.gz FPGUOKJSVBBGGN-UHFFFAOYSA-N 1 2 228.299 2.113 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ncc(C)s2)C[C@H](C)O1 ZINC000180488649 385525794 /nfs/dbraw/zinc/52/57/94/385525794.db2.gz QRBCMLPLNSDVGY-ONGXEEELSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ncc(C)s2)C[C@H](C)O1 ZINC000180488649 385525799 /nfs/dbraw/zinc/52/57/99/385525799.db2.gz QRBCMLPLNSDVGY-ONGXEEELSA-N 1 2 240.372 2.451 20 0 BEADLO COC(=O)[C@@H](C)[NH2+]CCc1cccc(Cl)c1 ZINC000291454820 385528069 /nfs/dbraw/zinc/52/80/69/385528069.db2.gz MMZCVOPFAVWRFQ-SECBINFHSA-N 1 2 241.718 2.034 20 0 BEADLO CC[C@H](N[C@@H](C)c1[nH+]ccn1C)C(F)(F)F ZINC000309412581 385574288 /nfs/dbraw/zinc/57/42/88/385574288.db2.gz CACPYEXNYQVCOM-YUMQZZPRSA-N 1 2 235.253 2.412 20 0 BEADLO CO[C@H](C)CCC(=O)Nc1cc[nH+]cc1C ZINC000181387439 385574638 /nfs/dbraw/zinc/57/46/38/385574638.db2.gz QHDSGFGJEVNKPK-SNVBAGLBSA-N 1 2 222.288 2.144 20 0 BEADLO Cc1ccoc1CNc1ccc(CO)c[nH+]1 ZINC000291507555 385551507 /nfs/dbraw/zinc/55/15/07/385551507.db2.gz IBJSRLDVBVLQLK-UHFFFAOYSA-N 1 2 218.256 2.087 20 0 BEADLO Cc1ccc(CC(=O)Nc2cc[nH+]cc2C)cn1 ZINC000107289335 385561572 /nfs/dbraw/zinc/56/15/72/385561572.db2.gz WCGXOPPWLXHPSX-UHFFFAOYSA-N 1 2 241.294 2.275 20 0 BEADLO CO[C@H](C)CCC(=O)Nc1ccc(C)[nH+]c1C ZINC000181684993 385594172 /nfs/dbraw/zinc/59/41/72/385594172.db2.gz MMDDOGVBOBHFBB-SNVBAGLBSA-N 1 2 236.315 2.452 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1ccc2c(c1)CCC2 ZINC000280758884 385601843 /nfs/dbraw/zinc/60/18/43/385601843.db2.gz FFZXPYCJDMONJZ-NSHDSACASA-N 1 2 247.338 2.169 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1ccc2c(c1)CCC2 ZINC000280758884 385601848 /nfs/dbraw/zinc/60/18/48/385601848.db2.gz FFZXPYCJDMONJZ-NSHDSACASA-N 1 2 247.338 2.169 20 0 BEADLO C[C@H]([NH2+][C@H]1CCOC1=O)C(C)(C)c1ccccc1 ZINC000181770606 385602430 /nfs/dbraw/zinc/60/24/30/385602430.db2.gz LTEKMUJAVFRKIV-AAEUAGOBSA-N 1 2 247.338 2.258 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1ccc(C)c(C)c1 ZINC000280791763 385604558 /nfs/dbraw/zinc/60/45/58/385604558.db2.gz HPPCAPFXJYDETM-GFCCVEGCSA-N 1 2 235.327 2.297 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(C)c(C)c1 ZINC000280791763 385604565 /nfs/dbraw/zinc/60/45/65/385604565.db2.gz HPPCAPFXJYDETM-GFCCVEGCSA-N 1 2 235.327 2.297 20 0 BEADLO COC(=O)[C@H]([NH2+][C@@H]1C[C@H]1c1ccccc1)C1CC1 ZINC000300064804 385586249 /nfs/dbraw/zinc/58/62/49/385586249.db2.gz RSRPHSOCWFUFIN-BFHYXJOUSA-N 1 2 245.322 2.084 20 0 BEADLO CO[C@H](C)COc1cccc(-n2cc[nH+]c2)c1 ZINC000181660310 385591854 /nfs/dbraw/zinc/59/18/54/385591854.db2.gz VEZJUUDMLWTJNF-LLVKDONJSA-N 1 2 232.283 2.286 20 0 BEADLO Cc1nc(C[N@@H+]2CCOC(C)(C)[C@H]2C)cs1 ZINC000335418847 385607294 /nfs/dbraw/zinc/60/72/94/385607294.db2.gz DYZJPRDANKNEBR-SECBINFHSA-N 1 2 240.372 2.451 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)CC1CC(C)(C)C1 ZINC000340058510 385607290 /nfs/dbraw/zinc/60/72/90/385607290.db2.gz JLOVDMRFXOEVIU-UHFFFAOYSA-N 1 2 235.331 2.194 20 0 BEADLO Cc1nc(C[N@H+]2CCOC(C)(C)[C@H]2C)cs1 ZINC000335418847 385607300 /nfs/dbraw/zinc/60/73/00/385607300.db2.gz DYZJPRDANKNEBR-SECBINFHSA-N 1 2 240.372 2.451 20 0 BEADLO CO[C@@H](C)CCC(=O)Nc1cc[nH+]c(C)c1 ZINC000181822412 385608338 /nfs/dbraw/zinc/60/83/38/385608338.db2.gz PGWCNVHRPWWKKA-JTQLQIEISA-N 1 2 222.288 2.144 20 0 BEADLO CC[C@H](SC)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000280836312 385610526 /nfs/dbraw/zinc/61/05/26/385610526.db2.gz UWSVZQVQPMEYRF-JTQLQIEISA-N 1 2 249.339 2.414 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)N[C@@H](C1CC1)C1CCC1 ZINC000493743746 385613337 /nfs/dbraw/zinc/61/33/37/385613337.db2.gz DRHMYXDAHNGAPS-PSKZRQQASA-N 1 2 245.326 2.118 20 0 BEADLO CO[C@@H](CCNc1cccc[nH+]1)C(F)(F)F ZINC000309500542 385637731 /nfs/dbraw/zinc/63/77/31/385637731.db2.gz ZQFFHNGRRVHYCI-QMMMGPOBSA-N 1 2 234.221 2.461 20 0 BEADLO CC(C)c1nc(N[C@H]2CCO[C@H](C)C2)cc[nH+]1 ZINC000354709656 385640203 /nfs/dbraw/zinc/64/02/03/385640203.db2.gz FUJBGCXTWUMLTG-MNOVXSKESA-N 1 2 235.331 2.001 20 0 BEADLO Cc1cscc1NC(=O)CCc1c[nH+]cn1C ZINC000281254521 385649753 /nfs/dbraw/zinc/64/97/53/385649753.db2.gz QLBPGQVBIUWRQF-UHFFFAOYSA-N 1 2 249.339 2.361 20 0 BEADLO C[C@@]1(F)CCC[N@H+](CCOCC(F)(F)F)C1 ZINC000451118717 385659046 /nfs/dbraw/zinc/65/90/46/385659046.db2.gz YSVOGYSNRVJUJZ-SECBINFHSA-N 1 2 243.244 2.389 20 0 BEADLO C[C@@]1(F)CCC[N@@H+](CCOCC(F)(F)F)C1 ZINC000451118717 385659054 /nfs/dbraw/zinc/65/90/54/385659054.db2.gz YSVOGYSNRVJUJZ-SECBINFHSA-N 1 2 243.244 2.389 20 0 BEADLO C[C@]1(CNc2ccc(CO)c[nH+]2)CCCS1 ZINC000647913117 385683288 /nfs/dbraw/zinc/68/32/88/385683288.db2.gz QBMBMOAUAOWKEB-GFCCVEGCSA-N 1 2 238.356 2.272 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2nnc(C3CC3)[nH]2)o1 ZINC000182576227 385683610 /nfs/dbraw/zinc/68/36/10/385683610.db2.gz GRKIQIBVDFDWJJ-SECBINFHSA-N 1 2 246.314 2.434 20 0 BEADLO CO[C@H](C)C[N@@H+]1CCCC[C@H]1C(F)F ZINC000337515289 385699432 /nfs/dbraw/zinc/69/94/32/385699432.db2.gz LLHSKDQHQMOGJV-BDAKNGLRSA-N 1 2 207.264 2.141 20 0 BEADLO CO[C@H](C)C[N@H+]1CCCC[C@H]1C(F)F ZINC000337515289 385699436 /nfs/dbraw/zinc/69/94/36/385699436.db2.gz LLHSKDQHQMOGJV-BDAKNGLRSA-N 1 2 207.264 2.141 20 0 BEADLO FC(F)(F)C1=CC[N@H+](Cc2ccno2)CC1 ZINC000270360009 385700302 /nfs/dbraw/zinc/70/03/02/385700302.db2.gz XTXNWDKGOXLGEE-UHFFFAOYSA-N 1 2 232.205 2.369 20 0 BEADLO FC(F)(F)C1=CC[N@@H+](Cc2ccno2)CC1 ZINC000270360009 385700307 /nfs/dbraw/zinc/70/03/07/385700307.db2.gz XTXNWDKGOXLGEE-UHFFFAOYSA-N 1 2 232.205 2.369 20 0 BEADLO Cn1c[nH+]cc1C[S@](=O)CCCC(C)(C)C ZINC000281805672 385702984 /nfs/dbraw/zinc/70/29/84/385702984.db2.gz ISGNXLPVVRJRQE-MRXNPFEDSA-N 1 2 242.388 2.495 20 0 BEADLO C[C@H]([NH2+][C@H](C1CC1)C(F)(F)F)[C@H]1CCOC1 ZINC000336735619 385707761 /nfs/dbraw/zinc/70/77/61/385707761.db2.gz IFHRILGCVYPFAD-UJNFCWOMSA-N 1 2 237.265 2.342 20 0 BEADLO c1nc(C[NH+]2CCSCC2)oc1C1CC1 ZINC000270461465 385710241 /nfs/dbraw/zinc/71/02/41/385710241.db2.gz AJABZWZWWXAIGE-UHFFFAOYSA-N 1 2 224.329 2.101 20 0 BEADLO CCCc1noc(C[NH2+][C@@H](C)c2cccnc2)n1 ZINC000182886831 385716364 /nfs/dbraw/zinc/71/63/64/385716364.db2.gz GYNZKSWGMINPIZ-JTQLQIEISA-N 1 2 246.314 2.268 20 0 BEADLO CN(C[C@H]1CCOC1)c1[nH]c2ccccc2[nH+]1 ZINC000270573250 385718748 /nfs/dbraw/zinc/71/87/48/385718748.db2.gz NPLNIENKJAVIAN-SNVBAGLBSA-N 1 2 231.299 2.036 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cscn2)CCCO1 ZINC000281404447 385666492 /nfs/dbraw/zinc/66/64/92/385666492.db2.gz XRGFCPPHUNDZHB-NSHDSACASA-N 1 2 226.345 2.144 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cscn2)CCCO1 ZINC000281404447 385666497 /nfs/dbraw/zinc/66/64/97/385666497.db2.gz XRGFCPPHUNDZHB-NSHDSACASA-N 1 2 226.345 2.144 20 0 BEADLO Fc1ccc(F)c(C[NH+]2CC3(C2)CCOC3)c1 ZINC000294016771 385786049 /nfs/dbraw/zinc/78/60/49/385786049.db2.gz NGNZBARSUAWGPE-UHFFFAOYSA-N 1 2 239.265 2.187 20 0 BEADLO CC[C@@H](C)CCC(=O)N[C@@H]1CCn2cc[nH+]c2C1 ZINC000354852987 385744141 /nfs/dbraw/zinc/74/41/41/385744141.db2.gz RUSHEQNLIGTSAZ-VXGBXAGGSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1O[C@H](C)C[C@@H]1C ZINC000408462694 385747748 /nfs/dbraw/zinc/74/77/48/385747748.db2.gz AFQTYAIWDMVFNK-OPQQBVKSSA-N 1 2 248.326 2.450 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2cc(O)cc(F)c2)[C@H]1C ZINC000186228574 385749819 /nfs/dbraw/zinc/74/98/19/385749819.db2.gz ZYDWMAAZZAFEGM-VHSXEESVSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2cc(O)cc(F)c2)[C@H]1C ZINC000186228574 385749825 /nfs/dbraw/zinc/74/98/25/385749825.db2.gz ZYDWMAAZZAFEGM-VHSXEESVSA-N 1 2 239.290 2.141 20 0 BEADLO CC(=O)Cn1c[nH+]c2cc(C)c(C)cc21 ZINC000035044958 385762355 /nfs/dbraw/zinc/76/23/55/385762355.db2.gz JHCUOZMOFZGPTI-UHFFFAOYSA-N 1 2 202.257 2.242 20 0 BEADLO O=C(CCCC1CCCC1)NCc1c[nH+]c[nH]1 ZINC000331588736 385771758 /nfs/dbraw/zinc/77/17/58/385771758.db2.gz AVZZYIDSEACAJJ-UHFFFAOYSA-N 1 2 235.331 2.386 20 0 BEADLO O=C(CCCC1CCCC1)NCc1c[nH]c[nH+]1 ZINC000331588736 385771764 /nfs/dbraw/zinc/77/17/64/385771764.db2.gz AVZZYIDSEACAJJ-UHFFFAOYSA-N 1 2 235.331 2.386 20 0 BEADLO CC(C)C(C)(C)CNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000282727782 385783121 /nfs/dbraw/zinc/78/31/21/385783121.db2.gz CHSUMZXPXYKIKG-AATRIKPKSA-N 1 2 235.331 2.221 20 0 BEADLO CCCc1nc(C(=O)Nc2cc[nH+]cc2C)co1 ZINC000337784674 385783363 /nfs/dbraw/zinc/78/33/63/385783363.db2.gz AKBJZMCWSXPWQF-UHFFFAOYSA-N 1 2 245.282 2.005 20 0 BEADLO CN(C[C@@H]1CCOC1)c1[nH]c2ccccc2[nH+]1 ZINC000270573248 385719148 /nfs/dbraw/zinc/71/91/48/385719148.db2.gz NPLNIENKJAVIAN-JTQLQIEISA-N 1 2 231.299 2.036 20 0 BEADLO CN(C[C@H]1CCCO1)c1[nH]c2ccccc2[nH+]1 ZINC000270563093 385720290 /nfs/dbraw/zinc/72/02/90/385720290.db2.gz KOBCFSJDMHTICF-SNVBAGLBSA-N 1 2 231.299 2.178 20 0 BEADLO COC[C@@H]1CCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000270591238 385722851 /nfs/dbraw/zinc/72/28/51/385722851.db2.gz SRWJPVSKSGGDAY-SNVBAGLBSA-N 1 2 231.299 2.036 20 0 BEADLO Cn1c[nH+]cc1COc1ccc2c(c1)CCCO2 ZINC000289919828 385725353 /nfs/dbraw/zinc/72/53/53/385725353.db2.gz UPMJETGBJAESHW-UHFFFAOYSA-N 1 2 244.294 2.324 20 0 BEADLO C[C@@H]1[C@@H](C)[S@](=O)CC[N@@H+]1Cc1cccs1 ZINC000271180143 385799424 /nfs/dbraw/zinc/79/94/24/385799424.db2.gz HIPKSPKQPCFKLL-IQMDTDKHSA-N 1 2 243.397 2.089 20 0 BEADLO C[C@@H]1[C@@H](C)[S@](=O)CC[N@H+]1Cc1cccs1 ZINC000271180143 385799427 /nfs/dbraw/zinc/79/94/27/385799427.db2.gz HIPKSPKQPCFKLL-IQMDTDKHSA-N 1 2 243.397 2.089 20 0 BEADLO Cn1ccc(C[N@@H+]2CCc3ccc(F)cc3C2)n1 ZINC000271189237 385800283 /nfs/dbraw/zinc/80/02/83/385800283.db2.gz OWFYCKUUQBKGJE-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1ccc(C[N@H+]2CCc3ccc(F)cc3C2)n1 ZINC000271189237 385800293 /nfs/dbraw/zinc/80/02/93/385800293.db2.gz OWFYCKUUQBKGJE-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO C[C@@H]1[C@H](C)[S@](=O)CC[N@@H+]1Cc1cccs1 ZINC000271180139 385800784 /nfs/dbraw/zinc/80/07/84/385800784.db2.gz HIPKSPKQPCFKLL-HFBDOXOYSA-N 1 2 243.397 2.089 20 0 BEADLO C[C@@H]1[C@H](C)[S@](=O)CC[N@H+]1Cc1cccs1 ZINC000271180139 385800788 /nfs/dbraw/zinc/80/07/88/385800788.db2.gz HIPKSPKQPCFKLL-HFBDOXOYSA-N 1 2 243.397 2.089 20 0 BEADLO CC(C)[C@@H](NC(=O)CC1CC1)c1[nH]cc[nH+]1 ZINC000283051170 385806991 /nfs/dbraw/zinc/80/69/91/385806991.db2.gz QDUMLLIHOIIQNK-LLVKDONJSA-N 1 2 221.304 2.023 20 0 BEADLO CC(C)[C@H](NC(=O)CCC1CC1)c1[nH]cc[nH+]1 ZINC000283142029 385809635 /nfs/dbraw/zinc/80/96/35/385809635.db2.gz XWQGEQYFJMIIAL-LBPRGKRZSA-N 1 2 235.331 2.413 20 0 BEADLO c1ccc(NC[C@H]2COC3(CCCC3)O2)[nH+]c1 ZINC000271336565 385818683 /nfs/dbraw/zinc/81/86/83/385818683.db2.gz BVUOXRHQPIBTAO-NSHDSACASA-N 1 2 234.299 2.179 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@H]2CCCC2(C)C)c[nH+]1 ZINC000294219567 385824512 /nfs/dbraw/zinc/82/45/12/385824512.db2.gz QPISDKULDIFXPF-SNVBAGLBSA-N 1 2 235.331 2.274 20 0 BEADLO CC1(C)C[N@H+](Cc2cn[nH]c2)[C@H]1c1cccnc1 ZINC000644835301 385829899 /nfs/dbraw/zinc/82/98/99/385829899.db2.gz JYBBRJLPVUUCNN-ZDUSSCGKSA-N 1 2 242.326 2.388 20 0 BEADLO CC1(C)C[N@@H+](Cc2cn[nH]c2)[C@H]1c1cccnc1 ZINC000644835301 385829903 /nfs/dbraw/zinc/82/99/03/385829903.db2.gz JYBBRJLPVUUCNN-ZDUSSCGKSA-N 1 2 242.326 2.388 20 0 BEADLO OCc1cc[nH+]c(N2CCC3(CCC3)CC2)c1 ZINC000308747026 385835422 /nfs/dbraw/zinc/83/54/22/385835422.db2.gz KGZGBGAPUCTUNI-UHFFFAOYSA-N 1 2 232.327 2.344 20 0 BEADLO Cc1c[nH+]c(CNc2ccc(C)nc2)n1C ZINC000336717306 385837208 /nfs/dbraw/zinc/83/72/08/385837208.db2.gz WQDLLSMBMGQCSA-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO Cc1cn[nH]c1C[N@@H+](C)Cc1ccccc1 ZINC000283926836 385841215 /nfs/dbraw/zinc/84/12/15/385841215.db2.gz HFYVSUUTJPLTBY-UHFFFAOYSA-N 1 2 215.300 2.350 20 0 BEADLO Cc1cn[nH]c1C[N@H+](C)Cc1ccccc1 ZINC000283926836 385841219 /nfs/dbraw/zinc/84/12/19/385841219.db2.gz HFYVSUUTJPLTBY-UHFFFAOYSA-N 1 2 215.300 2.350 20 0 BEADLO CCCC[C@](C)(CO)Nc1cc(C)[nH+]cn1 ZINC000645343590 385842431 /nfs/dbraw/zinc/84/24/31/385842431.db2.gz FRYJNXDQQQLWNM-GFCCVEGCSA-N 1 2 223.320 2.138 20 0 BEADLO CCCCC[NH2+][C@@H](c1nnc[nH]1)c1cccnc1 ZINC000284035974 385847646 /nfs/dbraw/zinc/84/76/46/385847646.db2.gz JNJSWYUZTLXTKS-GFCCVEGCSA-N 1 2 245.330 2.069 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)cc1F ZINC000644837082 385849057 /nfs/dbraw/zinc/84/90/57/385849057.db2.gz HJVKGMSEZVCHKE-QWHCGFSZSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@@H]3C[C@@H]32)cc1F ZINC000644837082 385849060 /nfs/dbraw/zinc/84/90/60/385849060.db2.gz HJVKGMSEZVCHKE-QWHCGFSZSA-N 1 2 221.275 2.107 20 0 BEADLO c1cc2cc(C[N@@H+]3CCO[C@@H]4C[C@@H]43)ccc2cn1 ZINC000644837602 385849906 /nfs/dbraw/zinc/84/99/06/385849906.db2.gz LARFWKAJEUSGSV-LSDHHAIUSA-N 1 2 240.306 2.208 20 0 BEADLO c1cc2cc(C[N@H+]3CCO[C@@H]4C[C@@H]43)ccc2cn1 ZINC000644837602 385849909 /nfs/dbraw/zinc/84/99/09/385849909.db2.gz LARFWKAJEUSGSV-LSDHHAIUSA-N 1 2 240.306 2.208 20 0 BEADLO COC(=O)[C@H]([NH2+]Cc1ccc(C)cc1)C(C)C ZINC000068740515 385851557 /nfs/dbraw/zinc/85/15/57/385851557.db2.gz HVFGCDVTMOAPHT-CYBMUJFWSA-N 1 2 235.327 2.282 20 0 BEADLO COC(=O)C[NH2+][C@H](c1ccccc1C)C1CC1 ZINC000271790215 385851733 /nfs/dbraw/zinc/85/17/33/385851733.db2.gz IWEOJKUWNLQCAR-AWEZNQCLSA-N 1 2 233.311 2.209 20 0 BEADLO COC(=O)[C@H]([NH2+]Cc1ccccc1C)C(C)C ZINC000069150195 385852625 /nfs/dbraw/zinc/85/26/25/385852625.db2.gz ZJAQBBYWEFTHBP-CYBMUJFWSA-N 1 2 235.327 2.282 20 0 BEADLO CCCOc1cccc(C[N@@H+]2CCO[C@H]3C[C@H]32)c1 ZINC000644838548 385853595 /nfs/dbraw/zinc/85/35/95/385853595.db2.gz QZJCISNLKQZIQC-CABCVRRESA-N 1 2 247.338 2.449 20 0 BEADLO CCCOc1cccc(C[N@H+]2CCO[C@H]3C[C@H]32)c1 ZINC000644838548 385853598 /nfs/dbraw/zinc/85/35/98/385853598.db2.gz QZJCISNLKQZIQC-CABCVRRESA-N 1 2 247.338 2.449 20 0 BEADLO CC(C)c1ccoc1C(=O)NCCn1cc[nH+]c1 ZINC000284144297 385854105 /nfs/dbraw/zinc/85/41/05/385854105.db2.gz VPQQIGOOPQZXFR-UHFFFAOYSA-N 1 2 247.298 2.030 20 0 BEADLO CCC1(CC)CN(C(=O)CCc2c[nH+]cn2C)C1 ZINC000294470347 385854570 /nfs/dbraw/zinc/85/45/70/385854570.db2.gz QWLGRCBMCDHMMF-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1ccc(F)c(C)c1 ZINC000271165874 385796509 /nfs/dbraw/zinc/79/65/09/385796509.db2.gz SAASTLOMGQRZDO-UHFFFAOYSA-N 1 2 239.290 2.129 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1ccc(F)c(C)c1 ZINC000271165874 385796513 /nfs/dbraw/zinc/79/65/13/385796513.db2.gz SAASTLOMGQRZDO-UHFFFAOYSA-N 1 2 239.290 2.129 20 0 BEADLO CO[C@H]1CC[N@H+](Cc2cc(F)c(F)c(F)c2)C1 ZINC000271176587 385796666 /nfs/dbraw/zinc/79/66/66/385796666.db2.gz JKNUODCNKZQVLO-VIFPVBQESA-N 1 2 245.244 2.325 20 0 BEADLO CO[C@H]1CC[N@@H+](Cc2cc(F)c(F)c(F)c2)C1 ZINC000271176587 385796671 /nfs/dbraw/zinc/79/66/71/385796671.db2.gz JKNUODCNKZQVLO-VIFPVBQESA-N 1 2 245.244 2.325 20 0 BEADLO FC(F)[C@@H]1CCC[N@@H+]1CCc1ccccn1 ZINC000353197987 385797602 /nfs/dbraw/zinc/79/76/02/385797602.db2.gz XNSSGSNEGKWKSZ-NSHDSACASA-N 1 2 226.270 2.354 20 0 BEADLO FC(F)[C@@H]1CCC[N@H+]1CCc1ccccn1 ZINC000353197987 385797607 /nfs/dbraw/zinc/79/76/07/385797607.db2.gz XNSSGSNEGKWKSZ-NSHDSACASA-N 1 2 226.270 2.354 20 0 BEADLO CSCc1cnc(C[NH2+]CCF)s1 ZINC000294758410 385892441 /nfs/dbraw/zinc/89/24/41/385892441.db2.gz SAGCZBNIAYNVNI-UHFFFAOYSA-N 1 2 220.338 2.065 20 0 BEADLO Fc1cccc(C[NH2+]Cc2nnc(C3CC3)[nH]2)c1 ZINC000294821276 385900602 /nfs/dbraw/zinc/90/06/02/385900602.db2.gz OWECCAIFTYCRBB-UHFFFAOYSA-N 1 2 246.289 2.111 20 0 BEADLO Cc1noc([C@@H](c2ccccc2)[NH+](C)C)n1 ZINC000285234821 385908531 /nfs/dbraw/zinc/90/85/31/385908531.db2.gz GDHJFXFPSQSQSJ-LLVKDONJSA-N 1 2 217.272 2.029 20 0 BEADLO CC[C@@H](C)CCC(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000285292671 385913450 /nfs/dbraw/zinc/91/34/50/385913450.db2.gz VMWZEYUBXDYUOK-VXGBXAGGSA-N 1 2 237.347 2.214 20 0 BEADLO C[C@@H](O)c1cc(NCc2c[nH+]cn2C)ccc1F ZINC000285389735 385922313 /nfs/dbraw/zinc/92/23/13/385922313.db2.gz DFBMOLWTZJZDKQ-SECBINFHSA-N 1 2 249.289 2.225 20 0 BEADLO c1n[nH]c2c1CC[N@@H+]([C@H]1C[C@H]1c1ccccc1)C2 ZINC000643375260 385924701 /nfs/dbraw/zinc/92/47/01/385924701.db2.gz UEQGGPJLALPSKM-ZFWWWQNUSA-N 1 2 239.322 2.324 20 0 BEADLO c1n[nH]c2c1CC[N@H+]([C@H]1C[C@H]1c1ccccc1)C2 ZINC000643375260 385924705 /nfs/dbraw/zinc/92/47/05/385924705.db2.gz UEQGGPJLALPSKM-ZFWWWQNUSA-N 1 2 239.322 2.324 20 0 BEADLO Cn1ccc(C[N@@H+]2CCC[C@@H]2c2ccncc2)n1 ZINC000272081801 385872865 /nfs/dbraw/zinc/87/28/65/385872865.db2.gz WMCIVCCMVQGYTG-CQSZACIVSA-N 1 2 242.326 2.152 20 0 BEADLO Cn1ccc(C[N@H+]2CCC[C@@H]2c2ccncc2)n1 ZINC000272081801 385872870 /nfs/dbraw/zinc/87/28/70/385872870.db2.gz WMCIVCCMVQGYTG-CQSZACIVSA-N 1 2 242.326 2.152 20 0 BEADLO CN(CCOCc1[nH]cc[nH+]1)c1ccccc1 ZINC000272068954 385872922 /nfs/dbraw/zinc/87/29/22/385872922.db2.gz QQBBVCUBPGQWJO-UHFFFAOYSA-N 1 2 231.299 2.063 20 0 BEADLO CC[C@H]1CC[C@H](C)N1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000284525036 385873410 /nfs/dbraw/zinc/87/34/10/385873410.db2.gz WKPQUNGEZAIZJE-HMZXWZJTSA-N 1 2 233.315 2.212 20 0 BEADLO CCOc1ncc(C)cc1NCc1c[nH+]cn1C ZINC000294664433 385881111 /nfs/dbraw/zinc/88/11/11/385881111.db2.gz AAYFGBIAABFIJC-UHFFFAOYSA-N 1 2 246.314 2.134 20 0 BEADLO CO[C@H]1C[C@@H]([N@H+](C)Cc2csc(Cl)n2)C1 ZINC000295154348 385980444 /nfs/dbraw/zinc/98/04/44/385980444.db2.gz FSRINPHKIGITHZ-DTORHVGOSA-N 1 2 246.763 2.406 20 0 BEADLO CO[C@H]1C[C@@H]([N@@H+](C)Cc2csc(Cl)n2)C1 ZINC000295154348 385980450 /nfs/dbraw/zinc/98/04/50/385980450.db2.gz FSRINPHKIGITHZ-DTORHVGOSA-N 1 2 246.763 2.406 20 0 BEADLO CO[C@H](C)C[N@H+](C)Cc1csc(C2CC2)n1 ZINC000285508261 385933795 /nfs/dbraw/zinc/93/37/95/385933795.db2.gz DFPBAJHQEAKTPQ-SECBINFHSA-N 1 2 240.372 2.487 20 0 BEADLO CO[C@H](C)C[N@@H+](C)Cc1csc(C2CC2)n1 ZINC000285508261 385933800 /nfs/dbraw/zinc/93/38/00/385933800.db2.gz DFPBAJHQEAKTPQ-SECBINFHSA-N 1 2 240.372 2.487 20 0 BEADLO F[C@@H]1CN(c2cc[nH+]c3ccncc32)C[C@@H]1F ZINC000295014934 385944674 /nfs/dbraw/zinc/94/46/74/385944674.db2.gz PSXXQKCOMBHTQO-AOOOYVTPSA-N 1 2 235.237 2.126 20 0 BEADLO C[C@H]([NH2+]c1ccc2c(c1)CCN2)[C@H]1CCOC1 ZINC000335052722 385951933 /nfs/dbraw/zinc/95/19/33/385951933.db2.gz GYONJAHVPPEKAP-JQWIXIFHSA-N 1 2 232.327 2.492 20 0 BEADLO C[C@H](Nc1ccc2c(c1)CC[NH2+]2)[C@H]1CCOC1 ZINC000335052722 385951934 /nfs/dbraw/zinc/95/19/34/385951934.db2.gz GYONJAHVPPEKAP-JQWIXIFHSA-N 1 2 232.327 2.492 20 0 BEADLO C[C@H]1OCC[C@H]1Nc1ccc2c(c1)CC[NH2+]2 ZINC000335054920 385954863 /nfs/dbraw/zinc/95/48/63/385954863.db2.gz ORPLUMIGZXMUIG-BXKDBHETSA-N 1 2 218.300 2.244 20 0 BEADLO Cn1cc(Cl)c(C[N@@H+]2CC[C@H](C(F)F)C2)n1 ZINC000643251531 385962231 /nfs/dbraw/zinc/96/22/31/385962231.db2.gz JBWTZUVBSUIYJD-ZETCQYMHSA-N 1 2 249.692 2.161 20 0 BEADLO Cn1cc(Cl)c(C[N@H+]2CC[C@H](C(F)F)C2)n1 ZINC000643251531 385962236 /nfs/dbraw/zinc/96/22/36/385962236.db2.gz JBWTZUVBSUIYJD-ZETCQYMHSA-N 1 2 249.692 2.161 20 0 BEADLO Cc1c(Cl)cncc1NCc1[nH+]ccn1C ZINC000295109222 385969599 /nfs/dbraw/zinc/96/95/99/385969599.db2.gz LKPLYTSPCTVPHI-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO Cc1noc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)n1 ZINC000335014845 385970552 /nfs/dbraw/zinc/97/05/52/385970552.db2.gz MMTVMFQYBZIUOR-LLVKDONJSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1noc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)n1 ZINC000335014845 385970557 /nfs/dbraw/zinc/97/05/57/385970557.db2.gz MMTVMFQYBZIUOR-LLVKDONJSA-N 1 2 232.287 2.043 20 0 BEADLO O=C([C@@H]1C[C@H]1C1CC1)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000345066217 386000961 /nfs/dbraw/zinc/00/09/61/386000961.db2.gz VRPCSDCFIUMRBD-QJPTWQEYSA-N 1 2 245.326 2.119 20 0 BEADLO CC[C@H]([NH2+][C@@H]1CCO[C@H](C)C1)C(F)(F)F ZINC000336750210 386001398 /nfs/dbraw/zinc/00/13/98/386001398.db2.gz DSRLRBVTOFGTCE-HLTSFMKQSA-N 1 2 225.254 2.484 20 0 BEADLO Cc1c[nH]cc1C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000335068904 386013893 /nfs/dbraw/zinc/01/38/93/386013893.db2.gz NYBPNGKIVTWJQP-UHFFFAOYSA-N 1 2 243.310 2.265 20 0 BEADLO COC[C@@H](C)[N@H+](C)Cc1c(F)ccc(O)c1F ZINC000295358586 386017104 /nfs/dbraw/zinc/01/71/04/386017104.db2.gz NONGLTIOTWUBAQ-MRVPVSSYSA-N 1 2 245.269 2.137 20 0 BEADLO COC[C@@H](C)[N@@H+](C)Cc1c(F)ccc(O)c1F ZINC000295358586 386017114 /nfs/dbraw/zinc/01/71/14/386017114.db2.gz NONGLTIOTWUBAQ-MRVPVSSYSA-N 1 2 245.269 2.137 20 0 BEADLO Cc1cc[nH+]c(NC[C@H](O)C(C)C)c1Cl ZINC000336752823 386018315 /nfs/dbraw/zinc/01/83/15/386018315.db2.gz HFKBBSONCWBLSY-VIFPVBQESA-N 1 2 228.723 2.472 20 0 BEADLO CCCC[C@](C)(CO)Nc1cc(CC)[nH+]cn1 ZINC000645345113 386019392 /nfs/dbraw/zinc/01/93/92/386019392.db2.gz RHWLDZSSMFYPKK-CYBMUJFWSA-N 1 2 237.347 2.392 20 0 BEADLO Cc1cc(CNC(=O)C(C)(C)C)cc(C)[nH+]1 ZINC000335070538 386019763 /nfs/dbraw/zinc/01/97/63/386019763.db2.gz CBHOFDQKAQPLRF-UHFFFAOYSA-N 1 2 220.316 2.361 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1 ZINC000295364265 386021456 /nfs/dbraw/zinc/02/14/56/386021456.db2.gz REEILFGECZOKPC-JBLDHEPKSA-N 1 2 249.358 2.407 20 0 BEADLO CC(=O)c1cccc(C[N@H+]2CCOC[C@@H]2C)c1 ZINC000295385914 386023021 /nfs/dbraw/zinc/02/30/21/386023021.db2.gz AXLYICSRNLNDQZ-NSHDSACASA-N 1 2 233.311 2.110 20 0 BEADLO CC(=O)c1cccc(C[N@@H+]2CCOC[C@@H]2C)c1 ZINC000295385914 386023028 /nfs/dbraw/zinc/02/30/28/386023028.db2.gz AXLYICSRNLNDQZ-NSHDSACASA-N 1 2 233.311 2.110 20 0 BEADLO CC[C@@H]1CCC[C@]2(C1)NC(=O)C[N@@H+]2CC(C)C ZINC000414178820 386023247 /nfs/dbraw/zinc/02/32/47/386023247.db2.gz KHTWKASGGYZSOH-OCCSQVGLSA-N 1 2 238.375 2.371 20 0 BEADLO CC[C@@H]1CCC[C@]2(C1)NC(=O)C[N@H+]2CC(C)C ZINC000414178820 386023253 /nfs/dbraw/zinc/02/32/53/386023253.db2.gz KHTWKASGGYZSOH-OCCSQVGLSA-N 1 2 238.375 2.371 20 0 BEADLO Cc1cc(NC[C@H]2CCCCC2(F)F)nc[nH+]1 ZINC000390888722 386023299 /nfs/dbraw/zinc/02/32/99/386023299.db2.gz XXJYGIAYFUOIAS-SNVBAGLBSA-N 1 2 241.285 2.444 20 0 BEADLO O[C@H]1CCCN(c2[nH+]ccc3ccc(F)cc32)C1 ZINC000334421609 386025834 /nfs/dbraw/zinc/02/58/34/386025834.db2.gz DABGSDRANCOKEN-LBPRGKRZSA-N 1 2 246.285 2.335 20 0 BEADLO C[C@]1(F)CCC[N@H+](Cc2cn3cccnc3n2)C1 ZINC000295400470 386026136 /nfs/dbraw/zinc/02/61/36/386026136.db2.gz LZYMLMOOZAHZPJ-ZDUSSCGKSA-N 1 2 248.305 2.053 20 0 BEADLO C[C@]1(F)CCC[N@@H+](Cc2cn3cccnc3n2)C1 ZINC000295400470 386026143 /nfs/dbraw/zinc/02/61/43/386026143.db2.gz LZYMLMOOZAHZPJ-ZDUSSCGKSA-N 1 2 248.305 2.053 20 0 BEADLO CCC[N@@H+]1CC(=O)N[C@]12CCC[C@@H](CC)C2 ZINC000414187100 386027880 /nfs/dbraw/zinc/02/78/80/386027880.db2.gz QAMWESMZELLKIN-DGCLKSJQSA-N 1 2 224.348 2.125 20 0 BEADLO CCC[N@H+]1CC(=O)N[C@]12CCC[C@@H](CC)C2 ZINC000414187100 386027882 /nfs/dbraw/zinc/02/78/82/386027882.db2.gz QAMWESMZELLKIN-DGCLKSJQSA-N 1 2 224.348 2.125 20 0 BEADLO CC(C)=CC[N@@H+]1CCOC[C@@H]1c1c(C)n[nH]c1C ZINC000334423176 386028985 /nfs/dbraw/zinc/02/89/85/386028985.db2.gz RTTQAWNLWJNOEW-CYBMUJFWSA-N 1 2 249.358 2.366 20 0 BEADLO CC(C)=CC[N@H+]1CCOC[C@@H]1c1c(C)n[nH]c1C ZINC000334423176 386028988 /nfs/dbraw/zinc/02/89/88/386028988.db2.gz RTTQAWNLWJNOEW-CYBMUJFWSA-N 1 2 249.358 2.366 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2nccn2C)cs1 ZINC000295472713 386037081 /nfs/dbraw/zinc/03/70/81/386037081.db2.gz RNAZJAUMSVATBW-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2nccn2C)cs1 ZINC000295472713 386037086 /nfs/dbraw/zinc/03/70/86/386037086.db2.gz RNAZJAUMSVATBW-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1cc(CN(C)Cc2[nH+]ccn2C)cs1 ZINC000295472713 386037092 /nfs/dbraw/zinc/03/70/92/386037092.db2.gz RNAZJAUMSVATBW-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO CCCCC[N@@H+]1CC(=O)N[C@@]12CC[C@H](C)C2 ZINC000414200793 386038297 /nfs/dbraw/zinc/03/82/97/386038297.db2.gz DLQTUOQOTUPHDP-AAEUAGOBSA-N 1 2 224.348 2.125 20 0 BEADLO CCCCC[N@H+]1CC(=O)N[C@@]12CC[C@H](C)C2 ZINC000414200793 386038302 /nfs/dbraw/zinc/03/83/02/386038302.db2.gz DLQTUOQOTUPHDP-AAEUAGOBSA-N 1 2 224.348 2.125 20 0 BEADLO Cc1ccc(C(=O)Nc2ccn3cc[nH+]c3c2)o1 ZINC000355288879 386039048 /nfs/dbraw/zinc/03/90/48/386039048.db2.gz KWOUAPJXYLJMGX-UHFFFAOYSA-N 1 2 241.250 2.488 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2ccccn2)s1 ZINC000295490576 386039039 /nfs/dbraw/zinc/03/90/39/386039039.db2.gz SQQDCUJMWILFEC-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2ccccn2)s1 ZINC000295490576 386039044 /nfs/dbraw/zinc/03/90/44/386039044.db2.gz SQQDCUJMWILFEC-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1nc(C[N@@H+](C(C)C)C2COC2)sc1C ZINC000295480407 386041348 /nfs/dbraw/zinc/04/13/48/386041348.db2.gz RJCWSTKKDVYBJA-UHFFFAOYSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nc(C[N@H+](C(C)C)C2COC2)sc1C ZINC000295480407 386041352 /nfs/dbraw/zinc/04/13/52/386041352.db2.gz RJCWSTKKDVYBJA-UHFFFAOYSA-N 1 2 240.372 2.369 20 0 BEADLO CCC(CC)[C@H](C)c1nc(C[NH2+]C)no1 ZINC000414642149 386042316 /nfs/dbraw/zinc/04/23/16/386042316.db2.gz KNPVKIKBSPXWBO-QMMMGPOBSA-N 1 2 211.309 2.329 20 0 BEADLO C[C@@H]1CCCC[C@H]1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000335076245 386044375 /nfs/dbraw/zinc/04/43/75/386044375.db2.gz KIBDZYSDENGWIW-GHMZBOCLSA-N 1 2 235.331 2.194 20 0 BEADLO CC[C@@H](C)[NH2+][C@H](c1nnc[nH]1)c1ccc(F)cc1 ZINC000295895233 386101913 /nfs/dbraw/zinc/10/19/13/386101913.db2.gz IKRXCXQGIUHACO-SKDRFNHKSA-N 1 2 248.305 2.421 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1CC(=O)Nc1ccccc1F ZINC000334454011 386102802 /nfs/dbraw/zinc/10/28/02/386102802.db2.gz DWKVUPLQGPFYPP-VHSXEESVSA-N 1 2 236.290 2.104 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1CC(=O)Nc1ccccc1F ZINC000334454011 386102810 /nfs/dbraw/zinc/10/28/10/386102810.db2.gz DWKVUPLQGPFYPP-VHSXEESVSA-N 1 2 236.290 2.104 20 0 BEADLO CCO[C@@H](C)c1noc(C[N@H+](C)C2CCC2)n1 ZINC000075840675 386104321 /nfs/dbraw/zinc/10/43/21/386104321.db2.gz TVPAFVYOUCVGFY-VIFPVBQESA-N 1 2 239.319 2.151 20 0 BEADLO CCO[C@@H](C)c1noc(C[N@@H+](C)C2CCC2)n1 ZINC000075840675 386104326 /nfs/dbraw/zinc/10/43/26/386104326.db2.gz TVPAFVYOUCVGFY-VIFPVBQESA-N 1 2 239.319 2.151 20 0 BEADLO C[C@H](O)C[N@@H+]1Cc2ccc(Cl)cc2C1 ZINC000335170258 386107108 /nfs/dbraw/zinc/10/71/08/386107108.db2.gz SSEQPAISHXUNCK-QMMMGPOBSA-N 1 2 211.692 2.036 20 0 BEADLO C[C@H](O)C[N@H+]1Cc2ccc(Cl)cc2C1 ZINC000335170258 386107112 /nfs/dbraw/zinc/10/71/12/386107112.db2.gz SSEQPAISHXUNCK-QMMMGPOBSA-N 1 2 211.692 2.036 20 0 BEADLO Cc1noc(C[NH2+][C@@H](C)c2ccccc2)n1 ZINC000037980604 386108868 /nfs/dbraw/zinc/10/88/68/386108868.db2.gz DVDZNGGBAPVKFN-VIFPVBQESA-N 1 2 217.272 2.229 20 0 BEADLO C/C=C/C[C@H](CO)Nc1cc[nH+]c2ccncc12 ZINC000274474906 386108843 /nfs/dbraw/zinc/10/88/43/386108843.db2.gz NBTWTFMEDYGNSV-KXMPLOMGSA-N 1 2 243.310 2.369 20 0 BEADLO Cc1coc(C)c1C(=O)Nc1cc[nH+]cc1C ZINC000334456626 386109349 /nfs/dbraw/zinc/10/93/49/386109349.db2.gz HQVOMFPYIWXIOI-UHFFFAOYSA-N 1 2 230.267 2.274 20 0 BEADLO Cc1nc(C[NH+]2CC3(CC(F)C3)C2)cs1 ZINC000647929713 386111463 /nfs/dbraw/zinc/11/14/63/386111463.db2.gz DSKSUWAZKDJATO-UHFFFAOYSA-N 1 2 226.320 2.385 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@@H]3C[C@H]2CS3)cs1 ZINC000335172222 386113766 /nfs/dbraw/zinc/11/37/66/386113766.db2.gz JGJMHUFFIRXRAD-UWVGGRQHSA-N 1 2 226.370 2.141 20 0 BEADLO Cc1nc(C[N@H+]2C[C@@H]3C[C@H]2CS3)cs1 ZINC000335172222 386113775 /nfs/dbraw/zinc/11/37/75/386113775.db2.gz JGJMHUFFIRXRAD-UWVGGRQHSA-N 1 2 226.370 2.141 20 0 BEADLO CCN(CC)C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000335186036 386124166 /nfs/dbraw/zinc/12/41/66/386124166.db2.gz YPIRKXXDLTUINO-JTQLQIEISA-N 1 2 236.319 2.008 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2cccc(C)n2)CCO1 ZINC000340234652 386058006 /nfs/dbraw/zinc/05/80/06/386058006.db2.gz BNAVWTQEGUSSGB-CQSZACIVSA-N 1 2 234.343 2.391 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2cccc(C)n2)CCO1 ZINC000340234652 386058010 /nfs/dbraw/zinc/05/80/10/386058010.db2.gz BNAVWTQEGUSSGB-CQSZACIVSA-N 1 2 234.343 2.391 20 0 BEADLO CCc1ccc(/C=C\c2nc(C[NH2+]C)no2)o1 ZINC000414649048 386059149 /nfs/dbraw/zinc/05/91/49/386059149.db2.gz WDSVMZWHLHNDQP-SREVYHEPSA-N 1 2 233.271 2.115 20 0 BEADLO CCc1cnccc1[C@H](C)[NH2+]Cc1csnn1 ZINC000345208899 386059878 /nfs/dbraw/zinc/05/98/78/386059878.db2.gz FOEGETFSPYHGFZ-VIFPVBQESA-N 1 2 248.355 2.346 20 0 BEADLO CCc1ccccc1C[N@H+](C)Cc1nncn1C ZINC000286914171 386084613 /nfs/dbraw/zinc/08/46/13/386084613.db2.gz JYNQWPVRFCYQBV-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO CCc1ccccc1C[N@@H+](C)Cc1nncn1C ZINC000286914171 386084620 /nfs/dbraw/zinc/08/46/20/386084620.db2.gz JYNQWPVRFCYQBV-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO CCC[C@H](C)CC(=O)NCc1[nH+]ccn1CC ZINC000295779514 386085424 /nfs/dbraw/zinc/08/54/24/386085424.db2.gz QBCYVJVHYXZLAB-NSHDSACASA-N 1 2 237.347 2.346 20 0 BEADLO C[C@H](c1nc(Cc2c[nH+]cn2C)no1)C1CCC1 ZINC000351265975 386088167 /nfs/dbraw/zinc/08/81/67/386088167.db2.gz HCMHLFSJWCWBDC-VIFPVBQESA-N 1 2 246.314 2.298 20 0 BEADLO CCC1(NC(=O)CCc2[nH]cc[nH+]2)CCCC1 ZINC000296169071 386144336 /nfs/dbraw/zinc/14/43/36/386144336.db2.gz NLBLXGBDECYVBS-UHFFFAOYSA-N 1 2 235.331 2.181 20 0 BEADLO CCC1(NC(=O)Cc2[nH]c[nH+]c2C)CCCC1 ZINC000296162891 386145222 /nfs/dbraw/zinc/14/52/22/386145222.db2.gz NEHNIJFMKLNEEN-UHFFFAOYSA-N 1 2 235.331 2.100 20 0 BEADLO CCC1(NC(=O)Cc2[nH+]c[nH]c2C)CCCC1 ZINC000296162891 386145228 /nfs/dbraw/zinc/14/52/28/386145228.db2.gz NEHNIJFMKLNEEN-UHFFFAOYSA-N 1 2 235.331 2.100 20 0 BEADLO CO[C@@H](C[N@@H+]1CC[C@H](C)C(F)(F)C1)C1CC1 ZINC000425482285 386153195 /nfs/dbraw/zinc/15/31/95/386153195.db2.gz QKBOZROPHJIUBD-ONGXEEELSA-N 1 2 233.302 2.389 20 0 BEADLO CO[C@@H](C[N@H+]1CC[C@H](C)C(F)(F)C1)C1CC1 ZINC000425482285 386153198 /nfs/dbraw/zinc/15/31/98/386153198.db2.gz QKBOZROPHJIUBD-ONGXEEELSA-N 1 2 233.302 2.389 20 0 BEADLO c1nnc([C@H]([NH2+]C2CCC2)c2ccccc2)[nH]1 ZINC000274824386 386154765 /nfs/dbraw/zinc/15/47/65/386154765.db2.gz HTFIPMDPINXYKZ-GFCCVEGCSA-N 1 2 228.299 2.036 20 0 BEADLO Cc1cc(N[C@H]2CCC[C@@H]2F)nc(C2CC2)[nH+]1 ZINC000338844830 386156857 /nfs/dbraw/zinc/15/68/57/386156857.db2.gz SECHXDBHDTXWET-QWRGUYRKSA-N 1 2 235.306 2.387 20 0 BEADLO Cc1cc(N[C@@H]2CCC[C@@H]2F)nc(C2CC2)[nH+]1 ZINC000338844831 386157374 /nfs/dbraw/zinc/15/73/74/386157374.db2.gz SECHXDBHDTXWET-WDEREUQCSA-N 1 2 235.306 2.387 20 0 BEADLO CC(C)[C@H]1[N@H+](Cc2csnn2)CC1(C)C ZINC000334477050 386162225 /nfs/dbraw/zinc/16/22/25/386162225.db2.gz ONKRCQQNSBWRSF-SNVBAGLBSA-N 1 2 225.361 2.405 20 0 BEADLO CC(C)[C@H]1[N@@H+](Cc2csnn2)CC1(C)C ZINC000334477050 386162229 /nfs/dbraw/zinc/16/22/29/386162229.db2.gz ONKRCQQNSBWRSF-SNVBAGLBSA-N 1 2 225.361 2.405 20 0 BEADLO FC(F)CN(CCn1cc[nH+]c1)CC1CCC1 ZINC000346163503 386171595 /nfs/dbraw/zinc/17/15/95/386171595.db2.gz MGRDURVEYHMELF-UHFFFAOYSA-N 1 2 243.301 2.250 20 0 BEADLO Cc1cn2cc(NC(=O)COC(C)C)ccc2[nH+]1 ZINC000263745580 386171903 /nfs/dbraw/zinc/17/19/03/386171903.db2.gz BOKSYMKVICLURJ-UHFFFAOYSA-N 1 2 247.298 2.006 20 0 BEADLO C[C@H](CNc1cc[nH+]c(C2CC2)n1)CC(F)F ZINC000645304895 386173363 /nfs/dbraw/zinc/17/33/63/386173363.db2.gz NCRHEINLVGOMAK-QMMMGPOBSA-N 1 2 241.285 2.479 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)[C@H]1CC12CC2 ZINC000643305630 386178775 /nfs/dbraw/zinc/17/87/75/386178775.db2.gz BLEMOPRQPMMCPS-SNVBAGLBSA-N 1 2 227.267 2.073 20 0 BEADLO CSCCC(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000263826723 386179164 /nfs/dbraw/zinc/17/91/64/386179164.db2.gz NTCQYDVMCDQFIE-UHFFFAOYSA-N 1 2 249.339 2.334 20 0 BEADLO Cc1cn2cc(NC(=O)NOC(C)C)ccc2[nH+]1 ZINC000296528867 386181444 /nfs/dbraw/zinc/18/14/44/386181444.db2.gz PIYZUNLLBNFWLZ-UHFFFAOYSA-N 1 2 248.286 2.104 20 0 BEADLO CC(C)n1ccnc1C[NH2+][C@H](C)c1cn[nH]c1 ZINC000275128535 386181861 /nfs/dbraw/zinc/18/18/61/386181861.db2.gz BJFMVKKKFHVSLY-SNVBAGLBSA-N 1 2 233.319 2.038 20 0 BEADLO CC(C)n1ccnc1C[NH2+][C@@H](C)c1cn[nH]c1 ZINC000275128533 386183098 /nfs/dbraw/zinc/18/30/98/386183098.db2.gz BJFMVKKKFHVSLY-JTQLQIEISA-N 1 2 233.319 2.038 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)C[C@@H]1C=CCCC1 ZINC000275124459 386183349 /nfs/dbraw/zinc/18/33/49/386183349.db2.gz WKTPLSSMYGQLIM-GFCCVEGCSA-N 1 2 247.342 2.125 20 0 BEADLO C[N@H+](Cc1cccs1)Cc1cnns1 ZINC000296572319 386184681 /nfs/dbraw/zinc/18/46/81/386184681.db2.gz QLXGJUNKHRUCOT-UHFFFAOYSA-N 1 2 225.342 2.232 20 0 BEADLO C[N@@H+](Cc1cccs1)Cc1cnns1 ZINC000296572319 386184687 /nfs/dbraw/zinc/18/46/87/386184687.db2.gz QLXGJUNKHRUCOT-UHFFFAOYSA-N 1 2 225.342 2.232 20 0 BEADLO CC[C@H](OC)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000263889919 386187250 /nfs/dbraw/zinc/18/72/50/386187250.db2.gz ZPGALTOSYLYWOB-NSHDSACASA-N 1 2 247.298 2.006 20 0 BEADLO CC(=O)c1cccc(C[N@H+]2C[C@H](C)OC[C@H]2C)c1 ZINC000296586773 386187748 /nfs/dbraw/zinc/18/77/48/386187748.db2.gz ROBPQYUQZXWMRL-NEPJUHHUSA-N 1 2 247.338 2.498 20 0 BEADLO CC(=O)c1cccc(C[N@@H+]2C[C@H](C)OC[C@H]2C)c1 ZINC000296586773 386187755 /nfs/dbraw/zinc/18/77/55/386187755.db2.gz ROBPQYUQZXWMRL-NEPJUHHUSA-N 1 2 247.338 2.498 20 0 BEADLO C[C@H]1CC(C(=O)NCc2c[nH+]c[nH]2)C[C@H](C)C1 ZINC000334466446 386126576 /nfs/dbraw/zinc/12/65/76/386126576.db2.gz DHOOVHJSVBBASY-NXEZZACHSA-N 1 2 235.331 2.098 20 0 BEADLO C[C@H]1CC(C(=O)NCc2c[nH]c[nH+]2)C[C@H](C)C1 ZINC000334466446 386126583 /nfs/dbraw/zinc/12/65/83/386126583.db2.gz DHOOVHJSVBBASY-NXEZZACHSA-N 1 2 235.331 2.098 20 0 BEADLO Cc1nc(N[C@@H](C)C2CCCCC2)nc(N)[nH+]1 ZINC000310126536 386129743 /nfs/dbraw/zinc/12/97/43/386129743.db2.gz WXXWLSVTTFHIKB-QMMMGPOBSA-N 1 2 235.335 2.143 20 0 BEADLO Cc1nc(N)nc(N[C@@H](C)C2CCCCC2)[nH+]1 ZINC000310126536 386129754 /nfs/dbraw/zinc/12/97/54/386129754.db2.gz WXXWLSVTTFHIKB-QMMMGPOBSA-N 1 2 235.335 2.143 20 0 BEADLO C/C=C(\C)C(=O)N1CC(C)(C)[C@@H]1c1[nH+]ccn1C ZINC000296063579 386132230 /nfs/dbraw/zinc/13/22/30/386132230.db2.gz GFVFKAUMCLWRGM-RUYJGKKWSA-N 1 2 247.342 2.296 20 0 BEADLO FCC1CC[NH+](Cc2nc(C(F)F)no2)CC1 ZINC000425470834 386133542 /nfs/dbraw/zinc/13/35/42/386133542.db2.gz FTOJQHNBUMSQST-UHFFFAOYSA-N 1 2 249.236 2.189 20 0 BEADLO O=C(CCn1cc[nH+]c1)N1CCC[C@@H]1C1CCC1 ZINC000264006604 386202547 /nfs/dbraw/zinc/20/25/47/386202547.db2.gz VMDUGAZTTDVJHB-CYBMUJFWSA-N 1 2 247.342 2.064 20 0 BEADLO CC[C@@H](C)N(CCO)c1cc(C)[nH+]c(C2CC2)n1 ZINC000288511658 386210520 /nfs/dbraw/zinc/21/05/20/386210520.db2.gz NAPJCIKUTIZMMC-LLVKDONJSA-N 1 2 249.358 2.260 20 0 BEADLO CCC[C@@H]1CCCN(C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000288553825 386214545 /nfs/dbraw/zinc/21/45/45/386214545.db2.gz WLYGGOORBAAGSV-GFCCVEGCSA-N 1 2 249.358 2.381 20 0 BEADLO C[C@@H](C[N@H+](C)Cc1c[nH]nn1)c1ccccc1 ZINC000297034741 386220236 /nfs/dbraw/zinc/22/02/36/386220236.db2.gz HOKJFVCCVHXBCD-NSHDSACASA-N 1 2 230.315 2.040 20 0 BEADLO C[C@@H](C[N@H+](C)Cc1cn[nH]n1)c1ccccc1 ZINC000297034741 386220254 /nfs/dbraw/zinc/22/02/54/386220254.db2.gz HOKJFVCCVHXBCD-NSHDSACASA-N 1 2 230.315 2.040 20 0 BEADLO C[C@@H](C[N@@H+](C)Cc1cn[nH]n1)c1ccccc1 ZINC000297034741 386220264 /nfs/dbraw/zinc/22/02/64/386220264.db2.gz HOKJFVCCVHXBCD-NSHDSACASA-N 1 2 230.315 2.040 20 0 BEADLO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1ccn(C)n1 ZINC000288623830 386222608 /nfs/dbraw/zinc/22/26/08/386222608.db2.gz RXMRPZSFNXIEAN-YGRLFVJLSA-N 1 2 243.310 2.032 20 0 BEADLO CC[C@@H](C)C[C@@H](C)NC(=O)CCc1[nH]cc[nH+]1 ZINC000288621606 386223083 /nfs/dbraw/zinc/22/30/83/386223083.db2.gz DKUXMVVDRRJYMJ-GHMZBOCLSA-N 1 2 237.347 2.283 20 0 BEADLO CC[C@@H](C)C(=O)OCc1c[nH+]ccc1OC ZINC000288639521 386223629 /nfs/dbraw/zinc/22/36/29/386223629.db2.gz KXXAZJAIHPHLTH-SECBINFHSA-N 1 2 223.272 2.180 20 0 BEADLO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1cc[nH]n1 ZINC000288649054 386224768 /nfs/dbraw/zinc/22/47/68/386224768.db2.gz UYYOFSIJSZCDQH-ZANVPECISA-N 1 2 229.283 2.022 20 0 BEADLO CCOc1ccc(C[N@H+](C)Cc2ncc[nH]2)cc1 ZINC000340561938 386228006 /nfs/dbraw/zinc/22/80/06/386228006.db2.gz BXVBFWNTPOGABF-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO CCOc1ccc(C[N@@H+](C)Cc2ncc[nH]2)cc1 ZINC000340561938 386228009 /nfs/dbraw/zinc/22/80/09/386228009.db2.gz BXVBFWNTPOGABF-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO CCOc1ccc(CN(C)Cc2[nH]cc[nH+]2)cc1 ZINC000340561938 386228015 /nfs/dbraw/zinc/22/80/15/386228015.db2.gz BXVBFWNTPOGABF-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)CC1=CCCCC1 ZINC000264403844 386234549 /nfs/dbraw/zinc/23/45/49/386234549.db2.gz GPZKIAANMPWIAQ-LBPRGKRZSA-N 1 2 247.342 2.278 20 0 BEADLO C[C@@H](C(=O)OC(C)(C)C)[N@@H+]1CCS[C@H](C)C1 ZINC000125220202 386234590 /nfs/dbraw/zinc/23/45/90/386234590.db2.gz GQZRPGWXQZNPTJ-ZJUUUORDSA-N 1 2 245.388 2.154 20 0 BEADLO C[C@@H](C(=O)OC(C)(C)C)[N@H+]1CCS[C@H](C)C1 ZINC000125220202 386234593 /nfs/dbraw/zinc/23/45/93/386234593.db2.gz GQZRPGWXQZNPTJ-ZJUUUORDSA-N 1 2 245.388 2.154 20 0 BEADLO C[C@H](C[N@H+](C)Cc1nnc[nH]1)c1ccc(F)cc1 ZINC000275745927 386235436 /nfs/dbraw/zinc/23/54/36/386235436.db2.gz RSUNCEUKUUVJTK-SNVBAGLBSA-N 1 2 248.305 2.179 20 0 BEADLO C[C@H](C[N@@H+](C)Cc1nnc[nH]1)c1ccc(F)cc1 ZINC000275745927 386235440 /nfs/dbraw/zinc/23/54/40/386235440.db2.gz RSUNCEUKUUVJTK-SNVBAGLBSA-N 1 2 248.305 2.179 20 0 BEADLO COC(C)(C)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000264437996 386237266 /nfs/dbraw/zinc/23/72/66/386237266.db2.gz MRGAGRNQYCHFOB-UHFFFAOYSA-N 1 2 247.298 2.006 20 0 BEADLO COC1(CC[N@@H+]2CCC(F)(F)C2)CCC1 ZINC000339077552 386237981 /nfs/dbraw/zinc/23/79/81/386237981.db2.gz SFHAUPQMDAEQCG-UHFFFAOYSA-N 1 2 219.275 2.287 20 0 BEADLO COC1(CC[N@H+]2CCC(F)(F)C2)CCC1 ZINC000339077552 386237985 /nfs/dbraw/zinc/23/79/85/386237985.db2.gz SFHAUPQMDAEQCG-UHFFFAOYSA-N 1 2 219.275 2.287 20 0 BEADLO c1nnc([C@H]([NH2+]CCC2CC2)c2ccccc2)[nH]1 ZINC000275822877 386243959 /nfs/dbraw/zinc/24/39/59/386243959.db2.gz KFPSTAQLRGHVMQ-CYBMUJFWSA-N 1 2 242.326 2.284 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)CC(F)(F)F ZINC000264546308 386245392 /nfs/dbraw/zinc/24/53/92/386245392.db2.gz RAYWLVJPCGXOFE-UHFFFAOYSA-N 1 2 218.178 2.281 20 0 BEADLO CN(c1cc[nH+]c(C2CC2)n1)[C@H]1CC[C@H](O)CC1 ZINC000275842732 386247449 /nfs/dbraw/zinc/24/74/49/386247449.db2.gz HFFZPWKCYJRMJV-HAQNSBGRSA-N 1 2 247.342 2.094 20 0 BEADLO CCCCN(CCOC)c1cccc[nH+]1 ZINC000264560237 386248296 /nfs/dbraw/zinc/24/82/96/386248296.db2.gz OKKIWSXWVLMTGU-UHFFFAOYSA-N 1 2 208.305 2.335 20 0 BEADLO Cc1cnc(C[N@H+](C)CCC(F)(F)F)o1 ZINC000336649181 386261179 /nfs/dbraw/zinc/26/11/79/386261179.db2.gz QKEUAMKZELWWLT-UHFFFAOYSA-N 1 2 222.210 2.367 20 0 BEADLO Cc1cnc(C[N@@H+](C)CCC(F)(F)F)o1 ZINC000336649181 386261180 /nfs/dbraw/zinc/26/11/80/386261180.db2.gz QKEUAMKZELWWLT-UHFFFAOYSA-N 1 2 222.210 2.367 20 0 BEADLO FC(F)C[N@H+](C[C@@H]1CCCOC1)C1CC1 ZINC000336646507 386254524 /nfs/dbraw/zinc/25/45/24/386254524.db2.gz KMRRMLOVZLDVQP-VIFPVBQESA-N 1 2 219.275 2.143 20 0 BEADLO FC(F)C[N@@H+](C[C@@H]1CCCOC1)C1CC1 ZINC000336646507 386254526 /nfs/dbraw/zinc/25/45/26/386254526.db2.gz KMRRMLOVZLDVQP-VIFPVBQESA-N 1 2 219.275 2.143 20 0 BEADLO FC(F)C[N@H+](C[C@H]1CCCOC1)C1CC1 ZINC000336646501 386255351 /nfs/dbraw/zinc/25/53/51/386255351.db2.gz KMRRMLOVZLDVQP-SECBINFHSA-N 1 2 219.275 2.143 20 0 BEADLO FC(F)C[N@@H+](C[C@H]1CCCOC1)C1CC1 ZINC000336646501 386255355 /nfs/dbraw/zinc/25/53/55/386255355.db2.gz KMRRMLOVZLDVQP-SECBINFHSA-N 1 2 219.275 2.143 20 0 BEADLO CC[C@H](NC(=O)c1c[nH+]c(C)[nH]1)[C@H]1CC1(C)C ZINC000416280770 386255711 /nfs/dbraw/zinc/25/57/11/386255711.db2.gz ZJWOVAVVIKKYIG-ZJUUUORDSA-N 1 2 235.331 2.273 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCC[C@@H](F)C2)o1 ZINC000628326473 386288569 /nfs/dbraw/zinc/28/85/69/386288569.db2.gz ICUWDMNCSZZDNU-SNVBAGLBSA-N 1 2 212.268 2.225 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCC[C@@H](F)C2)o1 ZINC000628326473 386288573 /nfs/dbraw/zinc/28/85/73/386288573.db2.gz ICUWDMNCSZZDNU-SNVBAGLBSA-N 1 2 212.268 2.225 20 0 BEADLO Cc1cccc([C@H](C)[NH2+]Cc2nccc(N)n2)c1 ZINC000452093583 386295545 /nfs/dbraw/zinc/29/55/45/386295545.db2.gz UOKXBZXXFIFOBR-NSHDSACASA-N 1 2 242.326 2.048 20 0 BEADLO C[N@H+](Cc1cocn1)[C@H](CCO)c1ccccc1 ZINC000276284164 386296300 /nfs/dbraw/zinc/29/63/00/386296300.db2.gz FUMVDIREBSAYCJ-CQSZACIVSA-N 1 2 246.310 2.230 20 0 BEADLO C[N@@H+](Cc1cocn1)[C@H](CCO)c1ccccc1 ZINC000276284164 386296306 /nfs/dbraw/zinc/29/63/06/386296306.db2.gz FUMVDIREBSAYCJ-CQSZACIVSA-N 1 2 246.310 2.230 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H](C)C2CCCC2)c[nH+]1 ZINC000265065402 386302398 /nfs/dbraw/zinc/30/23/98/386302398.db2.gz XFOMZHBXCHYXBB-QMMMGPOBSA-N 1 2 221.304 2.027 20 0 BEADLO C[C@H](Nc1cccc[nH+]1)C(=O)N1CCCC[C@H]1C ZINC000265105749 386306203 /nfs/dbraw/zinc/30/62/03/386306203.db2.gz GIWSXGNRZJJXFR-NEPJUHHUSA-N 1 2 247.342 2.283 20 0 BEADLO CO[C@@H](C)[C@H](C)Nc1[nH+]c2ccccc2n1C ZINC000276357566 386308706 /nfs/dbraw/zinc/30/87/06/386308706.db2.gz VIHYQZPVAYEFDP-UWVGGRQHSA-N 1 2 233.315 2.409 20 0 BEADLO CSCCC[N@H+](C)Cc1nc(C(C)C)no1 ZINC000336668936 386308801 /nfs/dbraw/zinc/30/88/01/386308801.db2.gz TXPPQRHGBBPRHL-UHFFFAOYSA-N 1 2 243.376 2.378 20 0 BEADLO CSCCC[N@@H+](C)Cc1nc(C(C)C)no1 ZINC000336668936 386308806 /nfs/dbraw/zinc/30/88/06/386308806.db2.gz TXPPQRHGBBPRHL-UHFFFAOYSA-N 1 2 243.376 2.378 20 0 BEADLO c1snnc1C[N@@H+]1CC[C@H]1Cc1ccccc1 ZINC000336678410 386317300 /nfs/dbraw/zinc/31/73/00/386317300.db2.gz AOBGUDZWJMTKMM-ZDUSSCGKSA-N 1 2 245.351 2.355 20 0 BEADLO c1snnc1C[N@H+]1CC[C@H]1Cc1ccccc1 ZINC000336678410 386317306 /nfs/dbraw/zinc/31/73/06/386317306.db2.gz AOBGUDZWJMTKMM-ZDUSSCGKSA-N 1 2 245.351 2.355 20 0 BEADLO Cc1nocc1C[NH2+][C@H]1CCN(C2CCCC2)C1 ZINC000339244034 386317814 /nfs/dbraw/zinc/31/78/14/386317814.db2.gz UOYHSXYCIDIFCW-ZDUSSCGKSA-N 1 2 249.358 2.090 20 0 BEADLO COC(=O)[C@H]([NH2+]Cc1ccc(C)c(C)c1)C1CC1 ZINC000276438260 386320815 /nfs/dbraw/zinc/32/08/15/386320815.db2.gz IHYIKZFDWROPMN-CQSZACIVSA-N 1 2 247.338 2.345 20 0 BEADLO CCOc1nnc(C[N@H+](C)C[C@@H](C)CC)s1 ZINC000336675070 386322102 /nfs/dbraw/zinc/32/21/02/386322102.db2.gz LXRRYDDJUCKPPP-VIFPVBQESA-N 1 2 243.376 2.415 20 0 BEADLO CCOc1nnc(C[N@@H+](C)C[C@@H](C)CC)s1 ZINC000336675070 386322108 /nfs/dbraw/zinc/32/21/08/386322108.db2.gz LXRRYDDJUCKPPP-VIFPVBQESA-N 1 2 243.376 2.415 20 0 BEADLO C[C@@H](C(=O)N[C@@H](C)Cn1cc[nH+]c1)C(C)(C)C ZINC000265245727 386322614 /nfs/dbraw/zinc/32/26/14/386322614.db2.gz RFZCMSLYRAEDMK-QWRGUYRKSA-N 1 2 237.347 2.070 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC000289142004 386265922 /nfs/dbraw/zinc/26/59/22/386265922.db2.gz AKABPOALYDZJAQ-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000289142004 386265926 /nfs/dbraw/zinc/26/59/26/386265926.db2.gz AKABPOALYDZJAQ-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO CCC[C@]1(CO)CCN(c2cccc[nH+]2)C1 ZINC000289125111 386266918 /nfs/dbraw/zinc/26/69/18/386266918.db2.gz RBANZVUDYKLZFW-ZDUSSCGKSA-N 1 2 220.316 2.071 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CCCC[C@H]2C)c[nH+]1 ZINC000264740519 386267050 /nfs/dbraw/zinc/26/70/50/386267050.db2.gz RFXNRLYAVOBCHB-PSASIEDQSA-N 1 2 221.304 2.027 20 0 BEADLO CC[C@](C)(CO)Nc1cc(C)[nH+]c(C(C)C)n1 ZINC000080882439 386267952 /nfs/dbraw/zinc/26/79/52/386267952.db2.gz LQPUTOUKVBASOO-CYBMUJFWSA-N 1 2 237.347 2.481 20 0 BEADLO CCN(C[C@@H]1CCCO1)c1cccc[nH+]1 ZINC000264805540 386271336 /nfs/dbraw/zinc/27/13/36/386271336.db2.gz DCXBOQOWQSGBMD-NSHDSACASA-N 1 2 206.289 2.087 20 0 BEADLO COCc1cc(CNc2ccc(C)[nH+]c2)no1 ZINC000297707663 386272263 /nfs/dbraw/zinc/27/22/63/386272263.db2.gz QXMFTYQDNKHTNP-UHFFFAOYSA-N 1 2 233.271 2.137 20 0 BEADLO C[C@H](C1CC1)N(C(=O)C=Cc1c[nH]c[nH+]1)C1CC1 ZINC000276533139 386341287 /nfs/dbraw/zinc/34/12/87/386341287.db2.gz DZCIFEWRTFQWGX-LJJSCBMDSA-N 1 2 245.326 2.212 20 0 BEADLO Cn1c[nH+]cc1Cc1noc(C2CC(C)(C)C2)n1 ZINC000334491395 386343843 /nfs/dbraw/zinc/34/38/43/386343843.db2.gz BYSQBCOESKQKBU-UHFFFAOYSA-N 1 2 246.314 2.298 20 0 BEADLO CCc1ccc(CC[NH2+][C@]2(C)CCOC2=O)cc1 ZINC000289766031 386352805 /nfs/dbraw/zinc/35/28/05/386352805.db2.gz ZNWNLRUIAQBEAB-OAHLLOKOSA-N 1 2 247.338 2.087 20 0 BEADLO CCN(C(=O)C=Cc1c[nH]c[nH+]1)C1CCCC1 ZINC000276657961 386358780 /nfs/dbraw/zinc/35/87/80/386358780.db2.gz XLLOVTYZSWPPEA-BQYQJAHWSA-N 1 2 233.315 2.214 20 0 BEADLO CCOc1ccccc1C[NH2+]Cc1[nH]ncc1C ZINC000289825689 386361118 /nfs/dbraw/zinc/36/11/18/386361118.db2.gz JLTAOVGJNJFVCB-UHFFFAOYSA-N 1 2 245.326 2.407 20 0 BEADLO CCOc1ccccc1C[NH2+]Cc1n[nH]cc1C ZINC000289825689 386361122 /nfs/dbraw/zinc/36/11/22/386361122.db2.gz JLTAOVGJNJFVCB-UHFFFAOYSA-N 1 2 245.326 2.407 20 0 BEADLO CCOc1nnc(C[N@@H+]2CCCC2(C)C)s1 ZINC000336691731 386362391 /nfs/dbraw/zinc/36/23/91/386362391.db2.gz BUXVVXIHUULOSU-UHFFFAOYSA-N 1 2 241.360 2.311 20 0 BEADLO CCOc1nnc(C[N@H+]2CCCC2(C)C)s1 ZINC000336691731 386362395 /nfs/dbraw/zinc/36/23/95/386362395.db2.gz BUXVVXIHUULOSU-UHFFFAOYSA-N 1 2 241.360 2.311 20 0 BEADLO CC[C@]1(C)C[N@H+](Cc2cncc(F)c2)CCO1 ZINC000276711516 386367763 /nfs/dbraw/zinc/36/77/63/386367763.db2.gz GTNYCGPDHYIXMZ-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO CC[C@]1(C)C[N@@H+](Cc2cncc(F)c2)CCO1 ZINC000276711516 386367771 /nfs/dbraw/zinc/36/77/71/386367771.db2.gz GTNYCGPDHYIXMZ-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO C[C@@H](CNC(=O)C1CCCCC1)Cn1cc[nH+]c1 ZINC000265791745 386370095 /nfs/dbraw/zinc/37/00/95/386370095.db2.gz URZAADPPAPVHHY-LBPRGKRZSA-N 1 2 249.358 2.216 20 0 BEADLO CCC[C@H](C)C(=O)NC[C@H](C)Cn1cc[nH+]c1 ZINC000265778303 386371212 /nfs/dbraw/zinc/37/12/12/386371212.db2.gz GJHHEENMRVXIDS-RYUDHWBXSA-N 1 2 237.347 2.072 20 0 BEADLO Cc1cnn([C@@H]2CC[N@H+](Cc3cscn3)C2)c1 ZINC000289929415 386374529 /nfs/dbraw/zinc/37/45/29/386374529.db2.gz OXZIAVQDPPFNPR-GFCCVEGCSA-N 1 2 248.355 2.095 20 0 BEADLO Cc1cnn([C@@H]2CC[N@@H+](Cc3cscn3)C2)c1 ZINC000289929415 386374534 /nfs/dbraw/zinc/37/45/34/386374534.db2.gz OXZIAVQDPPFNPR-GFCCVEGCSA-N 1 2 248.355 2.095 20 0 BEADLO CC(C)C(=O)N1CCC(Nc2cccc[nH+]2)CC1 ZINC000298716275 386375809 /nfs/dbraw/zinc/37/58/09/386375809.db2.gz MCFAXFMMMIGLJB-UHFFFAOYSA-N 1 2 247.342 2.141 20 0 BEADLO Cc1noc(C)c1COc1cc[nH+]cc1 ZINC000276475745 386329623 /nfs/dbraw/zinc/32/96/23/386329623.db2.gz QOWPQGHBVHRWOO-UHFFFAOYSA-N 1 2 204.229 2.265 20 0 BEADLO Cc1ccc(CCC[NH2+][C@]2(C)CCOC2=O)cc1 ZINC000289588166 386332294 /nfs/dbraw/zinc/33/22/94/386332294.db2.gz PNWZTNOTPHJAKQ-OAHLLOKOSA-N 1 2 247.338 2.223 20 0 BEADLO CC(C)c1nc(NC[C@H]2C[C@@H]2C)cc[nH+]1 ZINC000336773774 386334322 /nfs/dbraw/zinc/33/43/22/386334322.db2.gz ZCPUOJGCNGWLKE-VHSXEESVSA-N 1 2 205.305 2.090 20 0 BEADLO Cc1csc(C[N@@H+](C)Cc2cccnc2)n1 ZINC000118403490 386438624 /nfs/dbraw/zinc/43/86/24/386438624.db2.gz KXTLQMRPVBESJK-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1csc(C[N@H+](C)Cc2cccnc2)n1 ZINC000118403490 386438631 /nfs/dbraw/zinc/43/86/31/386438631.db2.gz KXTLQMRPVBESJK-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO c1ccc(N2CCC3(C2)CCOCC3)[nH+]c1 ZINC000266470217 386440158 /nfs/dbraw/zinc/44/01/58/386440158.db2.gz NYJJUESPWFFQHI-UHFFFAOYSA-N 1 2 218.300 2.089 20 0 BEADLO COc1ncncc1C[N@H+](C)Cc1occc1C ZINC000648037920 386442565 /nfs/dbraw/zinc/44/25/65/386442565.db2.gz GGQSVHXBQPLABP-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1ncncc1C[N@@H+](C)Cc1occc1C ZINC000648037920 386442569 /nfs/dbraw/zinc/44/25/69/386442569.db2.gz GGQSVHXBQPLABP-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO Nc1ccc(NC(=O)CCC2CCC2)c[nH+]1 ZINC000238133885 386446260 /nfs/dbraw/zinc/44/62/60/386446260.db2.gz RBDZHEBNLGYXDG-UHFFFAOYSA-N 1 2 219.288 2.183 20 0 BEADLO Cc1nnc(C[N@@H+](Cc2ccco2)C(C)C)n1C ZINC000299406772 386448129 /nfs/dbraw/zinc/44/81/29/386448129.db2.gz XWQRMVAZCIKGQN-UHFFFAOYSA-N 1 2 248.330 2.127 20 0 BEADLO Cc1nnc(C[N@H+](Cc2ccco2)C(C)C)n1C ZINC000299406772 386448136 /nfs/dbraw/zinc/44/81/36/386448136.db2.gz XWQRMVAZCIKGQN-UHFFFAOYSA-N 1 2 248.330 2.127 20 0 BEADLO COc1cc([C@@H](C)[NH2+]Cc2cc(C)on2)ccn1 ZINC000347552916 386450003 /nfs/dbraw/zinc/45/00/03/386450003.db2.gz GWYBABGJUDDURD-SNVBAGLBSA-N 1 2 247.298 2.237 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CCC[C@H](C)CC2)c[nH+]1 ZINC000276969485 386398036 /nfs/dbraw/zinc/39/80/36/386398036.db2.gz TWIQVTHFKKCTNH-GXSJLCMTSA-N 1 2 235.331 2.417 20 0 BEADLO Cc1cc(C)c(CNc2cc[nH+]c(C)n2)c(=O)[nH]1 ZINC000266095695 386398598 /nfs/dbraw/zinc/39/85/98/386398598.db2.gz GGFQRGHUXWCGQL-UHFFFAOYSA-N 1 2 244.298 2.115 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@@H](C)c2cccnc2)nn1C ZINC000336700751 386401061 /nfs/dbraw/zinc/40/10/61/386401061.db2.gz HARXWRGTCJVDDP-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cc(C[N@H+](C)[C@@H](C)c2cccnc2)nn1C ZINC000336700751 386401065 /nfs/dbraw/zinc/40/10/65/386401065.db2.gz HARXWRGTCJVDDP-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO CCCc1nc(C[N@@H+]2C[C@H](C)[C@H](C)C2)no1 ZINC000336701932 386404160 /nfs/dbraw/zinc/40/41/60/386404160.db2.gz MIWQAIYFSQZFHA-AOOOYVTPSA-N 1 2 223.320 2.110 20 0 BEADLO CCCc1nc(C[N@H+]2C[C@H](C)[C@H](C)C2)no1 ZINC000336701932 386404164 /nfs/dbraw/zinc/40/41/64/386404164.db2.gz MIWQAIYFSQZFHA-AOOOYVTPSA-N 1 2 223.320 2.110 20 0 BEADLO CCOCC[C@H](O)Cn1c(C)[nH+]c2ccccc21 ZINC000277604379 386451879 /nfs/dbraw/zinc/45/18/79/386451879.db2.gz XHCFXHINFLRJSA-LBPRGKRZSA-N 1 2 248.326 2.132 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H]1C[C@@H]1C1CC1 ZINC000340339392 386435683 /nfs/dbraw/zinc/43/56/83/386435683.db2.gz JIAAJBSDLQBZNL-NEPJUHHUSA-N 1 2 230.311 2.051 20 0 BEADLO C[C@@H]1CN(Cc2[nH+]ccn2CC(F)(F)F)[C@H]1C ZINC000339573241 386471758 /nfs/dbraw/zinc/47/17/58/386471758.db2.gz KMMXREUHLZWGFR-BDAKNGLRSA-N 1 2 247.264 2.286 20 0 BEADLO CO[C@@H](C)[C@@H](C)Nc1nc(C)[nH+]c2c1CCCC2 ZINC000290766528 386473603 /nfs/dbraw/zinc/47/36/03/386473603.db2.gz UXZUVVGRHKENKH-ZJUUUORDSA-N 1 2 249.358 2.499 20 0 BEADLO O=C(CCn1cc[nH+]c1)NCCCC1CCCC1 ZINC000299624984 386474975 /nfs/dbraw/zinc/47/49/75/386474975.db2.gz RHTSXGQTZSCDNN-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO Cc1ccc2[nH+]cc(CNc3cccnn3)n2c1 ZINC000191839074 386476138 /nfs/dbraw/zinc/47/61/38/386476138.db2.gz XIRHMOCGWNCJIZ-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO CCN(C(=O)CCn1cc[nH+]c1)c1ccccc1 ZINC000299646478 386478552 /nfs/dbraw/zinc/47/85/52/386478552.db2.gz MVCIURFDBNECPK-UHFFFAOYSA-N 1 2 243.310 2.326 20 0 BEADLO O=C(CC1CCCCC1)N1CCn2c[nH+]cc2C1 ZINC000290856682 386480839 /nfs/dbraw/zinc/48/08/39/386480839.db2.gz BCPJWPVTEPGTEK-UHFFFAOYSA-N 1 2 247.342 2.196 20 0 BEADLO Cc1occc1CNc1ccc(CO)c[nH+]1 ZINC000414442595 386481115 /nfs/dbraw/zinc/48/11/15/386481115.db2.gz GYZAFNSRCSZZHK-UHFFFAOYSA-N 1 2 218.256 2.087 20 0 BEADLO C[C@@H](C[NH2+][C@@]1(C)CCOC1=O)Cc1ccccc1 ZINC000290864113 386482613 /nfs/dbraw/zinc/48/26/13/386482613.db2.gz JVRVBYHLXFREHF-DOMZBBRYSA-N 1 2 247.338 2.160 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)c1cc(F)c[nH]1 ZINC000645406836 386486462 /nfs/dbraw/zinc/48/64/62/386486462.db2.gz XSQWOWRWOXSSQT-UHFFFAOYSA-N 1 2 244.229 2.054 20 0 BEADLO C[C@H]1CN(c2cccc[nH+]2)CC2(CCC2)O1 ZINC000335430766 386486435 /nfs/dbraw/zinc/48/64/35/386486435.db2.gz UWFPQFHMJMPFED-NSHDSACASA-N 1 2 218.300 2.229 20 0 BEADLO CC(C)(C)CCC(=O)N1CCn2c[nH+]cc2C1 ZINC000290901002 386486653 /nfs/dbraw/zinc/48/66/53/386486653.db2.gz HJPGBPRQPJSGPL-UHFFFAOYSA-N 1 2 235.331 2.052 20 0 BEADLO c1cc2c(s1)C[N@H+](Cc1cocn1)CC2 ZINC000278184698 386497123 /nfs/dbraw/zinc/49/71/23/386497123.db2.gz PVFFLORTZOHKEM-UHFFFAOYSA-N 1 2 220.297 2.294 20 0 BEADLO c1cc2c(s1)C[N@@H+](Cc1cocn1)CC2 ZINC000278184698 386497129 /nfs/dbraw/zinc/49/71/29/386497129.db2.gz PVFFLORTZOHKEM-UHFFFAOYSA-N 1 2 220.297 2.294 20 0 BEADLO Cc1nc(NCc2cc(F)cc(F)c2)cc[nH+]1 ZINC000335440353 386500005 /nfs/dbraw/zinc/50/00/05/386500005.db2.gz KEZZGWRHWCPWCT-UHFFFAOYSA-N 1 2 235.237 2.097 20 0 BEADLO CCC1(C(=O)NCc2cn3ccccc3[nH+]2)CC1 ZINC000267188521 386506365 /nfs/dbraw/zinc/50/63/65/386506365.db2.gz JRNGHHNJJNOBHB-UHFFFAOYSA-N 1 2 243.310 2.141 20 0 BEADLO c1ncc(C[N@@H+]2CCOC[C@H]2C2CCC2)s1 ZINC000335449471 386520587 /nfs/dbraw/zinc/52/05/87/386520587.db2.gz MJLPPDZDLCTJHU-LBPRGKRZSA-N 1 2 238.356 2.144 20 0 BEADLO c1ncc(C[N@H+]2CCOC[C@H]2C2CCC2)s1 ZINC000335449471 386520593 /nfs/dbraw/zinc/52/05/93/386520593.db2.gz MJLPPDZDLCTJHU-LBPRGKRZSA-N 1 2 238.356 2.144 20 0 BEADLO Cc1c[nH+]c(C)nc1NC1CC(F)(F)C1 ZINC000519645503 386521918 /nfs/dbraw/zinc/52/19/18/386521918.db2.gz GPMVKPQEAGWVHU-UHFFFAOYSA-N 1 2 213.231 2.303 20 0 BEADLO CSC[C@H]1CCC[N@H+](Cc2csnn2)C1 ZINC000336720758 386454318 /nfs/dbraw/zinc/45/43/18/386454318.db2.gz ZYVWEVWNTBOKPH-VIFPVBQESA-N 1 2 243.401 2.113 20 0 BEADLO CSC[C@H]1CCC[N@@H+](Cc2csnn2)C1 ZINC000336720758 386454320 /nfs/dbraw/zinc/45/43/20/386454320.db2.gz ZYVWEVWNTBOKPH-VIFPVBQESA-N 1 2 243.401 2.113 20 0 BEADLO Cc1ccc(Cc2nc(CC3CC3)no2)c[nH+]1 ZINC000266603884 386455728 /nfs/dbraw/zinc/45/57/28/386455728.db2.gz QBGYCWMKWYMVCI-UHFFFAOYSA-N 1 2 229.283 2.316 20 0 BEADLO CN(CCCCCO)c1[nH]c2ccccc2[nH+]1 ZINC000227109200 386461017 /nfs/dbraw/zinc/46/10/17/386461017.db2.gz VTSQHSZHTQUNMW-UHFFFAOYSA-N 1 2 233.315 2.162 20 0 BEADLO CO[C@H](C)[C@@H](C)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000290654076 386464104 /nfs/dbraw/zinc/46/41/04/386464104.db2.gz IZSHKTNIOPKVEO-NXEZZACHSA-N 1 2 235.331 2.498 20 0 BEADLO CCC1(C(=O)NCCc2[nH]cc[nH+]2)CCCCC1 ZINC000184164484 386575383 /nfs/dbraw/zinc/57/53/83/386575383.db2.gz VUYAUGDASOTQQR-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO Fc1ccc(F)c2c1CCN(Cc1[nH]cc[nH+]1)C2 ZINC000267737577 386578876 /nfs/dbraw/zinc/57/88/76/386578876.db2.gz NUWQCMNTQWZMBB-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO Cl/C=C(\Cl)C[N@@H+]1CC[C@@H](n2cccn2)C1 ZINC000291756934 386579485 /nfs/dbraw/zinc/57/94/85/386579485.db2.gz KYTRUWPHPLMTBU-ABRRARGCSA-N 1 2 246.141 2.449 20 0 BEADLO Cl/C=C(\Cl)C[N@H+]1CC[C@@H](n2cccn2)C1 ZINC000291756934 386579488 /nfs/dbraw/zinc/57/94/88/386579488.db2.gz KYTRUWPHPLMTBU-ABRRARGCSA-N 1 2 246.141 2.449 20 0 BEADLO COC(C)(C)CC(=O)Nc1cc[nH+]cc1C ZINC000278771331 386581828 /nfs/dbraw/zinc/58/18/28/386581828.db2.gz SYMDVKZMXFBXDA-UHFFFAOYSA-N 1 2 222.288 2.144 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCCc2occc21)c1ncnn1C ZINC000278810383 386590724 /nfs/dbraw/zinc/59/07/24/386590724.db2.gz RXDPYHBULHCCSW-KOLCDFICSA-N 1 2 246.314 2.136 20 0 BEADLO CS[C@H]1CCN(c2nc(C)[nH+]c(C)c2C)C1 ZINC000335420445 386592081 /nfs/dbraw/zinc/59/20/81/386592081.db2.gz HYVKRXSVSMDJFN-NSHDSACASA-N 1 2 237.372 2.344 20 0 BEADLO CC(C)c1nc(NCCC(F)(F)F)cc[nH+]1 ZINC000336757114 386593338 /nfs/dbraw/zinc/59/33/38/386593338.db2.gz YXPJSUHQBCJLDL-UHFFFAOYSA-N 1 2 233.237 2.386 20 0 BEADLO CCC1(CNC(=O)c2c[nH+]c(C)[nH]2)CCC1 ZINC000267888202 386594838 /nfs/dbraw/zinc/59/48/38/386594838.db2.gz UDWPINXHTDXOJU-UHFFFAOYSA-N 1 2 221.304 2.028 20 0 BEADLO CC[C@@H]([NH2+]CC(=O)OC)c1ccc(C)cc1 ZINC000019885566 386595619 /nfs/dbraw/zinc/59/56/19/386595619.db2.gz TYGWRVXQSKVZHF-GFCCVEGCSA-N 1 2 221.300 2.209 20 0 BEADLO CCC[C@H](C)C(=O)Nc1ccc(N)[nH+]c1 ZINC000061680562 386533351 /nfs/dbraw/zinc/53/33/51/386533351.db2.gz ALLCVJJHOBHKMV-QMMMGPOBSA-N 1 2 207.277 2.039 20 0 BEADLO CC1(C(=O)N2CCC(n3cc[nH+]c3)CC2)CCC1 ZINC000267406691 386540634 /nfs/dbraw/zinc/54/06/34/386540634.db2.gz YOLFBFXEWNXRJY-UHFFFAOYSA-N 1 2 247.342 2.237 20 0 BEADLO FC(F)(F)C[C@H]1CC[N@H+](Cc2ccon2)C1 ZINC000278620313 386554295 /nfs/dbraw/zinc/55/42/95/386554295.db2.gz FWIUWMFOIHUNRY-MRVPVSSYSA-N 1 2 234.221 2.449 20 0 BEADLO FC(F)(F)C[C@H]1CC[N@@H+](Cc2ccon2)C1 ZINC000278620313 386554300 /nfs/dbraw/zinc/55/43/00/386554300.db2.gz FWIUWMFOIHUNRY-MRVPVSSYSA-N 1 2 234.221 2.449 20 0 BEADLO Cc1cc(NC[C@H]2CCCC(F)(F)C2)nc[nH+]1 ZINC000336915654 386556025 /nfs/dbraw/zinc/55/60/25/386556025.db2.gz BJTVFRBDHPNPHK-JTQLQIEISA-N 1 2 241.285 2.444 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1cc(C)cc(C)c1 ZINC000278637922 386558692 /nfs/dbraw/zinc/55/86/92/386558692.db2.gz GTRJQCSYLGRTAH-GFCCVEGCSA-N 1 2 235.327 2.297 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1cc(C)cc(C)c1 ZINC000278637922 386558695 /nfs/dbraw/zinc/55/86/95/386558695.db2.gz GTRJQCSYLGRTAH-GFCCVEGCSA-N 1 2 235.327 2.297 20 0 BEADLO Cc1ccoc1CN(C)c1cc[nH+]c(C)n1 ZINC000291628813 386561099 /nfs/dbraw/zinc/56/10/99/386561099.db2.gz BKAGFRQNDOVKCX-UHFFFAOYSA-N 1 2 217.272 2.323 20 0 BEADLO CCCc1nc(C)c(C[NH2+]Cc2cocn2)o1 ZINC000291653539 386564577 /nfs/dbraw/zinc/56/45/77/386564577.db2.gz DCMYSVMZJASWTI-UHFFFAOYSA-N 1 2 235.287 2.213 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)c1ccoc1C1CC1 ZINC000336992617 386565416 /nfs/dbraw/zinc/56/54/16/386565416.db2.gz MCULBWBUZARQKT-UHFFFAOYSA-N 1 2 245.282 2.152 20 0 BEADLO FC(F)(F)C[C@H]1CC[N@H+](Cc2ncc[nH]2)C1 ZINC000278720382 386572186 /nfs/dbraw/zinc/57/21/86/386572186.db2.gz KPLAFKBPURFNGS-MRVPVSSYSA-N 1 2 233.237 2.184 20 0 BEADLO FC(F)(F)C[C@H]1CC[N@@H+](Cc2ncc[nH]2)C1 ZINC000278720382 386572191 /nfs/dbraw/zinc/57/21/91/386572191.db2.gz KPLAFKBPURFNGS-MRVPVSSYSA-N 1 2 233.237 2.184 20 0 BEADLO CCc1ncc(C[N@@H+]2CC[C@@H](F)C2)s1 ZINC000335410140 386573721 /nfs/dbraw/zinc/57/37/21/386573721.db2.gz PSEJWUVQASYXJO-MRVPVSSYSA-N 1 2 214.309 2.249 20 0 BEADLO CCc1ncc(C[N@H+]2CC[C@@H](F)C2)s1 ZINC000335410140 386573726 /nfs/dbraw/zinc/57/37/26/386573726.db2.gz PSEJWUVQASYXJO-MRVPVSSYSA-N 1 2 214.309 2.249 20 0 BEADLO Cc1[nH]c(C(=O)NCC2(C)CCCCC2)c[nH+]1 ZINC000268236094 386632945 /nfs/dbraw/zinc/63/29/45/386632945.db2.gz TXZQRHGQUILZME-UHFFFAOYSA-N 1 2 235.331 2.418 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccccc2F)n(C)n1 ZINC000417744543 386634274 /nfs/dbraw/zinc/63/42/74/386634274.db2.gz NALXQOPGPMKCKK-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccccc2F)n(C)n1 ZINC000417744543 386634278 /nfs/dbraw/zinc/63/42/78/386634278.db2.gz NALXQOPGPMKCKK-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO CC[C@H]1CCC[C@@H]1NC(=O)c1c[nH+]c(C)[nH]1 ZINC000268270899 386635321 /nfs/dbraw/zinc/63/53/21/386635321.db2.gz SNTOWPCZNLQUHL-UWVGGRQHSA-N 1 2 221.304 2.027 20 0 BEADLO CCC1(C(=O)NCCCn2cc[nH+]c2)CCCC1 ZINC000268341995 386646423 /nfs/dbraw/zinc/64/64/23/386646423.db2.gz PMAWDLACQPPISV-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H](C)OCC1CC1 ZINC000644972787 386651938 /nfs/dbraw/zinc/65/19/38/386651938.db2.gz DBDHDIDYMHNRKT-LLVKDONJSA-N 1 2 248.326 2.452 20 0 BEADLO Cc1[nH]nc(C(=O)Nc2ccc(C)[nH+]c2C)c1C ZINC000267985645 386608445 /nfs/dbraw/zinc/60/84/45/386608445.db2.gz HNTLCPGARZXGSM-UHFFFAOYSA-N 1 2 244.298 2.291 20 0 BEADLO Cc1ccc(NC(=O)[C@@]2(C)CCCO2)c(C)[nH+]1 ZINC000268023512 386609237 /nfs/dbraw/zinc/60/92/37/386609237.db2.gz ULQAWGSIMMCRKE-CYBMUJFWSA-N 1 2 234.299 2.206 20 0 BEADLO [NH3+]CC(F)(F)CN[C@@H]1CCCC[C@@H]1C1CC1 ZINC000414923988 386614122 /nfs/dbraw/zinc/61/41/22/386614122.db2.gz FYPLNXIEQBIOIR-GHMZBOCLSA-N 1 2 232.318 2.139 20 0 BEADLO CCc1nc(C[N@@H+]2CCCC23CCC3)no1 ZINC000335520725 386659963 /nfs/dbraw/zinc/65/99/63/386659963.db2.gz ITKZHFLOTBGNHE-UHFFFAOYSA-N 1 2 221.304 2.151 20 0 BEADLO CCc1nc(C[N@H+]2CCCC23CCC3)no1 ZINC000335520725 386659969 /nfs/dbraw/zinc/65/99/69/386659969.db2.gz ITKZHFLOTBGNHE-UHFFFAOYSA-N 1 2 221.304 2.151 20 0 BEADLO CC(C)n1c[nH+]cc1CN(C)CC(F)F ZINC000425326539 386660123 /nfs/dbraw/zinc/66/01/23/386660123.db2.gz OBCJUVVPSGXPJS-UHFFFAOYSA-N 1 2 217.263 2.161 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CC[C@@H](C)[C@H](C)C1 ZINC000520426551 386672281 /nfs/dbraw/zinc/67/22/81/386672281.db2.gz LRXYUYZMSNQBDT-IJLUTSLNSA-N 1 2 249.358 2.093 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CC[C@@H](C)[C@H](C)C1 ZINC000520426551 386672283 /nfs/dbraw/zinc/67/22/83/386672283.db2.gz LRXYUYZMSNQBDT-IJLUTSLNSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@H]([NH2+]C[C@@H]1CCc2ccccc21)C(=O)OC ZINC000192847938 386677124 /nfs/dbraw/zinc/67/71/24/386677124.db2.gz HBFMHUIUURKIHT-JSGCOSHPSA-N 1 2 247.338 2.258 20 0 BEADLO Cc1cc(C(=O)Nc2c(C)cc[nH+]c2C)no1 ZINC000335531575 386681591 /nfs/dbraw/zinc/68/15/91/386681591.db2.gz SZKSDFJPJQZNKL-UHFFFAOYSA-N 1 2 231.255 2.247 20 0 BEADLO CCc1cc(N[C@H](C)c2cc[nH]c(=O)c2)nc[nH+]1 ZINC000645046365 386688512 /nfs/dbraw/zinc/68/85/12/386688512.db2.gz XGQKMHYHPMXLNS-SECBINFHSA-N 1 2 244.298 2.313 20 0 BEADLO Cn1nc(C2CC2)nc1C[N@@H+]1CCCC2(CC2)C1 ZINC000335469586 386688598 /nfs/dbraw/zinc/68/85/98/386688598.db2.gz IHHMJFCRQVKGPQ-UHFFFAOYSA-N 1 2 246.358 2.069 20 0 BEADLO Cn1nc(C2CC2)nc1C[N@H+]1CCCC2(CC2)C1 ZINC000335469586 386688606 /nfs/dbraw/zinc/68/86/06/386688606.db2.gz IHHMJFCRQVKGPQ-UHFFFAOYSA-N 1 2 246.358 2.069 20 0 BEADLO CCC(=O)N1CC[N@H+](Cc2ccc(C)cc2)C1 ZINC000335484034 386711685 /nfs/dbraw/zinc/71/16/85/386711685.db2.gz NXJBISARYODCKK-UHFFFAOYSA-N 1 2 232.327 2.007 20 0 BEADLO CCC(=O)N1CC[N@@H+](Cc2ccc(C)cc2)C1 ZINC000335484034 386711689 /nfs/dbraw/zinc/71/16/89/386711689.db2.gz NXJBISARYODCKK-UHFFFAOYSA-N 1 2 232.327 2.007 20 0 BEADLO COc1ccc(N[C@@H](C)[C@]2(C)CCCO2)[nH+]c1 ZINC000645437396 386691791 /nfs/dbraw/zinc/69/17/91/386691791.db2.gz CBECRJHOGDLEFW-GWCFXTLKSA-N 1 2 236.315 2.460 20 0 BEADLO COc1ccc(N[C@H](C)[C@]2(C)CCCO2)[nH+]c1 ZINC000645437405 386692636 /nfs/dbraw/zinc/69/26/36/386692636.db2.gz CBECRJHOGDLEFW-MFKMUULPSA-N 1 2 236.315 2.460 20 0 BEADLO CC(C)(C)CCC[N@@H+]1CCOC[C@@H]1C(N)=O ZINC000330381699 386694178 /nfs/dbraw/zinc/69/41/78/386694178.db2.gz INCMHBLPKDGHJJ-SNVBAGLBSA-N 1 2 228.336 2.049 20 0 BEADLO CC(C)(C)CCC[N@H+]1CCOC[C@@H]1C(N)=O ZINC000330381699 386694183 /nfs/dbraw/zinc/69/41/83/386694183.db2.gz INCMHBLPKDGHJJ-SNVBAGLBSA-N 1 2 228.336 2.049 20 0 BEADLO Cc1nc(N2CC[C@@H]3OCC[C@@H]3C2)c(C)c(C)[nH+]1 ZINC000645328731 386701408 /nfs/dbraw/zinc/70/14/08/386701408.db2.gz YOSDFYQRGRKJHO-OLZOCXBDSA-N 1 2 247.342 2.017 20 0 BEADLO Cc1ccc(C[NH2+][C@@H]2CCCc3cn[nH]c32)o1 ZINC000268836420 386702312 /nfs/dbraw/zinc/70/23/12/386702312.db2.gz LZBNLFWAENDMAN-GFCCVEGCSA-N 1 2 231.299 2.478 20 0 BEADLO Cc1ccc(C[NH2+][C@@H]2CCCc3c[nH]nc32)o1 ZINC000268836420 386702314 /nfs/dbraw/zinc/70/23/14/386702314.db2.gz LZBNLFWAENDMAN-GFCCVEGCSA-N 1 2 231.299 2.478 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CCC[C@H](C)[C@H]2C)c[nH+]1 ZINC000264603340 386707314 /nfs/dbraw/zinc/70/73/14/386707314.db2.gz FKFPTQXFWFGMEL-IQJOONFLSA-N 1 2 235.331 2.273 20 0 BEADLO COC(=O)[C@H](CC1CC1)[NH2+]Cc1ccccc1C ZINC000414494176 386731659 /nfs/dbraw/zinc/73/16/59/386731659.db2.gz UYCWIISRIGTPIV-AWEZNQCLSA-N 1 2 247.338 2.426 20 0 BEADLO Cc1cnccc1SCc1[nH+]ccn1C ZINC000292836110 386733396 /nfs/dbraw/zinc/73/33/96/386733396.db2.gz RAFUTFKCLRTLJW-UHFFFAOYSA-N 1 2 219.313 2.416 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2nc3ccccc3[nH]2)C1 ZINC000335483521 386712783 /nfs/dbraw/zinc/71/27/83/386712783.db2.gz XHZNHBSRTTVZQE-ZDUSSCGKSA-N 1 2 233.290 2.497 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2nc3ccccc3[nH]2)C1 ZINC000335483521 386712789 /nfs/dbraw/zinc/71/27/89/386712789.db2.gz XHZNHBSRTTVZQE-ZDUSSCGKSA-N 1 2 233.290 2.497 20 0 BEADLO FC1(C[N@@H+]2CCO[C@H](Cc3ccccc3)C2)CC1 ZINC000526983845 386713850 /nfs/dbraw/zinc/71/38/50/386713850.db2.gz GUEGKSHBIOUOMT-CQSZACIVSA-N 1 2 249.329 2.432 20 0 BEADLO FC1(C[N@H+]2CCO[C@H](Cc3ccccc3)C2)CC1 ZINC000526983845 386713855 /nfs/dbraw/zinc/71/38/55/386713855.db2.gz GUEGKSHBIOUOMT-CQSZACIVSA-N 1 2 249.329 2.432 20 0 BEADLO CSCC[N@H+](C)Cc1ncc(C2CC2)o1 ZINC000340689997 386714474 /nfs/dbraw/zinc/71/44/74/386714474.db2.gz NPPNOJLNVPLNTO-UHFFFAOYSA-N 1 2 226.345 2.347 20 0 BEADLO CSCC[N@@H+](C)Cc1ncc(C2CC2)o1 ZINC000340689997 386714484 /nfs/dbraw/zinc/71/44/84/386714484.db2.gz NPPNOJLNVPLNTO-UHFFFAOYSA-N 1 2 226.345 2.347 20 0 BEADLO COC(=O)[C@H](CC1CC1)[NH2+]Cc1cccc(C)c1 ZINC000414490507 386716576 /nfs/dbraw/zinc/71/65/76/386716576.db2.gz OJCFGIZJTURFAH-AWEZNQCLSA-N 1 2 247.338 2.426 20 0 BEADLO CCn1ccc(C[NH2+]Cc2occc2C)n1 ZINC000414489285 386719701 /nfs/dbraw/zinc/71/97/01/386719701.db2.gz YDWBXYNMYXQSHO-UHFFFAOYSA-N 1 2 219.288 2.094 20 0 BEADLO CCc1ccc([C@@H](C)[NH2+][C@H](C)c2nncn2C)o1 ZINC000268930048 386721723 /nfs/dbraw/zinc/72/17/23/386721723.db2.gz SLDRCJUKAKNPAR-NXEZZACHSA-N 1 2 248.330 2.382 20 0 BEADLO CS[C@H]1CC[N@H+](Cc2nn(C)cc2Cl)C1 ZINC000335541791 386723068 /nfs/dbraw/zinc/72/30/68/386723068.db2.gz YYQLUWWCQSORSR-QMMMGPOBSA-N 1 2 245.779 2.011 20 0 BEADLO O=C([C@H]1[C@@H]2CCC[C@@H]21)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000357130298 386723028 /nfs/dbraw/zinc/72/30/28/386723028.db2.gz QSQZZHKYXSGOOU-WHOHXGKFSA-N 1 2 245.326 2.119 20 0 BEADLO CS[C@H]1CC[N@@H+](Cc2nn(C)cc2Cl)C1 ZINC000335541791 386723073 /nfs/dbraw/zinc/72/30/73/386723073.db2.gz YYQLUWWCQSORSR-QMMMGPOBSA-N 1 2 245.779 2.011 20 0 BEADLO CN(Cc1cn2c([nH+]1)CCCC2)CC1(F)CC1 ZINC000526988617 386723898 /nfs/dbraw/zinc/72/38/98/386723898.db2.gz FJBJJPOFWYSHAF-UHFFFAOYSA-N 1 2 237.322 2.153 20 0 BEADLO COCc1cnc(C[NH+]2[C@H](C)C[C@H]2C)s1 ZINC000526989444 386726523 /nfs/dbraw/zinc/72/65/23/386726523.db2.gz CDUTXOZRXXGCGG-RKDXNWHRSA-N 1 2 226.345 2.272 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@@H](C(C)(C)C)C2)ncn1 ZINC000292788440 386729034 /nfs/dbraw/zinc/72/90/34/386729034.db2.gz JVVNJNAJYQGQNQ-CYBMUJFWSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@@H](C(C)(C)C)C2)ncn1 ZINC000292788440 386729039 /nfs/dbraw/zinc/72/90/39/386729039.db2.gz JVVNJNAJYQGQNQ-CYBMUJFWSA-N 1 2 249.358 2.032 20 0 BEADLO c1cn(-c2cccc(NCc3cocn3)c2)c[nH+]1 ZINC000192329109 386764492 /nfs/dbraw/zinc/76/44/92/386764492.db2.gz RYVYGQJFMWVLGZ-UHFFFAOYSA-N 1 2 240.266 2.472 20 0 BEADLO Cn1cc(Cl)c(C[NH+]2CCC(CF)CC2)n1 ZINC000335537855 386741941 /nfs/dbraw/zinc/74/19/41/386741941.db2.gz FRGYCMHEVWJAAU-UHFFFAOYSA-N 1 2 245.729 2.255 20 0 BEADLO Cn1c[nH+]cc1Cc1noc(CC2CCCC2)n1 ZINC000329735697 386795878 /nfs/dbraw/zinc/79/58/78/386795878.db2.gz SBZJCQOJRXDICI-UHFFFAOYSA-N 1 2 246.314 2.127 20 0 BEADLO FC[C@H]1CCC[N@@H+]1Cc1ccc(F)cn1 ZINC000293086193 386775350 /nfs/dbraw/zinc/77/53/50/386775350.db2.gz PDEARGKDYZCRRE-LLVKDONJSA-N 1 2 212.243 2.155 20 0 BEADLO FC[C@H]1CCC[N@H+]1Cc1ccc(F)cn1 ZINC000293086193 386775358 /nfs/dbraw/zinc/77/53/58/386775358.db2.gz PDEARGKDYZCRRE-LLVKDONJSA-N 1 2 212.243 2.155 20 0 BEADLO CO[C@@H]1C[C@@H](N(C)c2cc(C)[nH+]cn2)C12CCC2 ZINC000450861319 386780662 /nfs/dbraw/zinc/78/06/62/386780662.db2.gz PMULZQNXCCNUGS-VXGBXAGGSA-N 1 2 247.342 2.179 20 0 BEADLO CCn1cncc1C[N@H+](CC)Cc1ccccn1 ZINC000417804236 386780966 /nfs/dbraw/zinc/78/09/66/386780966.db2.gz ZBXIQPWVTDDOIL-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CCn1cncc1C[N@@H+](CC)Cc1ccccn1 ZINC000417804236 386780969 /nfs/dbraw/zinc/78/09/69/386780969.db2.gz ZBXIQPWVTDDOIL-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CC[N@H+](Cc1cc(C)nn1C)Cc1ccccn1 ZINC000417803016 386781059 /nfs/dbraw/zinc/78/10/59/386781059.db2.gz XRSAKYQMCMEXIZ-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CC[N@@H+](Cc1cc(C)nn1C)Cc1ccccn1 ZINC000417803016 386781061 /nfs/dbraw/zinc/78/10/61/386781061.db2.gz XRSAKYQMCMEXIZ-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CC[C@@H](C)CC(=O)NCc1c[nH+]ccc1OC ZINC000293154514 386782899 /nfs/dbraw/zinc/78/28/99/386782899.db2.gz BKYHGSAQAODXMB-SNVBAGLBSA-N 1 2 236.315 2.143 20 0 BEADLO CCCC[C@@H](CC)NCC(F)(F)C[NH3+] ZINC000414933349 386784276 /nfs/dbraw/zinc/78/42/76/386784276.db2.gz TTYLHLBHYMMAMT-SECBINFHSA-N 1 2 208.296 2.139 20 0 BEADLO c1cnc(Nc2ccc(N3CCCC3)[nH+]c2)nc1 ZINC000301098856 386817998 /nfs/dbraw/zinc/81/79/98/386817998.db2.gz XCCLLVRYDBLHJA-UHFFFAOYSA-N 1 2 241.298 2.215 20 0 BEADLO CCC[C@@](C)(CC)C(=O)NCc1[nH]cc[nH+]1 ZINC000280558617 386822154 /nfs/dbraw/zinc/82/21/54/386822154.db2.gz QCGMVVHLYDPVKR-GFCCVEGCSA-N 1 2 223.320 2.242 20 0 BEADLO CC[C@@H](NC(=O)[C@@H](C)C1CC1)c1[nH]cc[nH+]1 ZINC000125329688 386797104 /nfs/dbraw/zinc/79/71/04/386797104.db2.gz UJJVGHUCUCBPNO-WCBMZHEXSA-N 1 2 221.304 2.023 20 0 BEADLO CC[C@@H](NC(=O)[C@H](C)C(C)C)c1[nH]cc[nH+]1 ZINC000125335298 386797949 /nfs/dbraw/zinc/79/79/49/386797949.db2.gz SBEDEXCHEDKIOQ-NXEZZACHSA-N 1 2 223.320 2.269 20 0 BEADLO CCCC[NH2+][C@H](c1cccs1)c1nnc[nH]1 ZINC000293279226 386798456 /nfs/dbraw/zinc/79/84/56/386798456.db2.gz CUJWPKVIHUROJJ-SNVBAGLBSA-N 1 2 236.344 2.345 20 0 BEADLO CC(C)[C@](C)(O)CNc1cc[nH+]c(C2CC2)n1 ZINC000301228940 386824126 /nfs/dbraw/zinc/82/41/26/386824126.db2.gz HSQBWSNNSCDDHM-CYBMUJFWSA-N 1 2 235.331 2.173 20 0 BEADLO CO[C@H]1CCC[C@@H]1CNc1cc[nH+]c(C2CC2)n1 ZINC000340945271 386806063 /nfs/dbraw/zinc/80/60/63/386806063.db2.gz CPVKPWMUXIRCPM-NEPJUHHUSA-N 1 2 247.342 2.003 20 0 BEADLO CO[C@H]1CCC[C@@H]1CNc1cc[nH+]c(C(C)C)n1 ZINC000340953001 386806279 /nfs/dbraw/zinc/80/62/79/386806279.db2.gz QACXONZDISOOKO-NEPJUHHUSA-N 1 2 249.358 2.249 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)Cc1cccs1 ZINC000357592328 386809609 /nfs/dbraw/zinc/80/96/09/386809609.db2.gz ITEDWYXOBZMYSS-UHFFFAOYSA-N 1 2 246.335 2.309 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)Cc1ccccc1 ZINC000357578694 386809752 /nfs/dbraw/zinc/80/97/52/386809752.db2.gz CWEOPEYQUFMWHH-UHFFFAOYSA-N 1 2 240.306 2.247 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)[C@H]1[C@@H]2CCC[C@@H]21 ZINC000456341586 386813429 /nfs/dbraw/zinc/81/34/29/386813429.db2.gz DERAKMWAXUEFMA-WYUUTHIRSA-N 1 2 247.342 2.126 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H]1CCCC12CC2 ZINC000528467267 386825676 /nfs/dbraw/zinc/82/56/76/386825676.db2.gz TVRDUSXBOADHFF-LLVKDONJSA-N 1 2 230.311 2.331 20 0 BEADLO COC[C@@H]([NH2+]Cc1cnns1)c1ccccc1 ZINC000290145458 386829204 /nfs/dbraw/zinc/82/92/04/386829204.db2.gz WEUIADLKYOHATD-GFCCVEGCSA-N 1 2 249.339 2.015 20 0 BEADLO C[NH2+]Cc1noc([C@H]2C[C@H](C)C[C@H](C)C2)n1 ZINC000334778285 386831149 /nfs/dbraw/zinc/83/11/49/386831149.db2.gz OJWNSPDMMGBYFA-MYJAWHEDSA-N 1 2 223.320 2.329 20 0 BEADLO Cc1c[nH+]c(CNCc2cccc(F)c2)n1C ZINC000341129007 386838218 /nfs/dbraw/zinc/83/82/18/386838218.db2.gz NULMEWYSBLFPDW-UHFFFAOYSA-N 1 2 233.290 2.157 20 0 BEADLO CC1(CC(F)F)C[NH+](Cc2ccon2)C1 ZINC000639282975 386844033 /nfs/dbraw/zinc/84/40/33/386844033.db2.gz HPTZHTNBQXQTRY-UHFFFAOYSA-N 1 2 216.231 2.152 20 0 BEADLO C[C@@]1(CO)CCC[C@@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000301454739 386846099 /nfs/dbraw/zinc/84/60/99/386846099.db2.gz MNVZUAXIZNHQLV-FZMZJTMJSA-N 1 2 247.342 2.317 20 0 BEADLO CC[C@H](Nc1cc(C)[nH+]cn1)c1noc(C)n1 ZINC000301484802 386848540 /nfs/dbraw/zinc/84/85/40/386848540.db2.gz VTUKMTRDKGPREO-VIFPVBQESA-N 1 2 233.275 2.040 20 0 BEADLO Cc1nc(N2CCOc3ccccc3C2)cc[nH+]1 ZINC000585381052 386852415 /nfs/dbraw/zinc/85/24/15/386852415.db2.gz FGEXSJJCDVZNFI-UHFFFAOYSA-N 1 2 241.294 2.184 20 0 BEADLO c1coc(C[N@@H+]2C[C@]3(CCCO3)[C@H]2C2CC2)c1 ZINC000293862128 386891277 /nfs/dbraw/zinc/89/12/77/386891277.db2.gz CBKKWDULSWSILZ-ZIAGYGMSSA-N 1 2 233.311 2.423 20 0 BEADLO c1coc(C[N@H+]2C[C@]3(CCCO3)[C@H]2C2CC2)c1 ZINC000293862128 386891279 /nfs/dbraw/zinc/89/12/79/386891279.db2.gz CBKKWDULSWSILZ-ZIAGYGMSSA-N 1 2 233.311 2.423 20 0 BEADLO C[N@H+](CCF)Cc1cnc2ccc(Cl)cn12 ZINC000293673594 386858961 /nfs/dbraw/zinc/85/89/61/386858961.db2.gz PADVLRSLLYODBM-UHFFFAOYSA-N 1 2 241.697 2.389 20 0 BEADLO C[N@@H+](CCF)Cc1cnc2ccc(Cl)cn12 ZINC000293673594 386858966 /nfs/dbraw/zinc/85/89/66/386858966.db2.gz PADVLRSLLYODBM-UHFFFAOYSA-N 1 2 241.697 2.389 20 0 BEADLO CCC1(C(=O)Nc2cc[nH+]cc2C)CCC1 ZINC000335742864 386861335 /nfs/dbraw/zinc/86/13/35/386861335.db2.gz FRQZDFQLCMDLNN-UHFFFAOYSA-N 1 2 218.300 2.331 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+]1CCO[C@@H](CF)C1 ZINC000334828690 386865051 /nfs/dbraw/zinc/86/50/51/386865051.db2.gz KOXVQVROIVFGMN-ZDUSSCGKSA-N 1 2 241.281 2.304 20 0 BEADLO Cc1cc(F)ccc1C[N@H+]1CCO[C@@H](CF)C1 ZINC000334828690 386865054 /nfs/dbraw/zinc/86/50/54/386865054.db2.gz KOXVQVROIVFGMN-ZDUSSCGKSA-N 1 2 241.281 2.304 20 0 BEADLO Cc1nc(N2C[C@@H]3[C@H](C2)C3(C)C)c(C)c(C)[nH+]1 ZINC000301668914 386865381 /nfs/dbraw/zinc/86/53/81/386865381.db2.gz DLLYUJYYCSUVDS-TXEJJXNPSA-N 1 2 231.343 2.494 20 0 BEADLO CC[C@H](O)C[NH2+][C@@H](Cc1ccccc1)C(F)F ZINC000293716582 386867304 /nfs/dbraw/zinc/86/73/04/386867304.db2.gz PGHPOSOTDIJGIC-RYUDHWBXSA-N 1 2 243.297 2.223 20 0 BEADLO CCC(CC)c1nc(Cc2c[nH+]cn2C)no1 ZINC000357936881 386868425 /nfs/dbraw/zinc/86/84/25/386868425.db2.gz ORGHTMDWYBFPDF-UHFFFAOYSA-N 1 2 234.303 2.298 20 0 BEADLO FC(F)(F)c1csc(-n2cc[nH+]c2)n1 ZINC000301716714 386873014 /nfs/dbraw/zinc/87/30/14/386873014.db2.gz HEZZIPJEKSVRJG-UHFFFAOYSA-N 1 2 219.191 2.348 20 0 BEADLO CCCCN(C)c1nc(N)c2ccccc2[nH+]1 ZINC000301756103 386875509 /nfs/dbraw/zinc/87/55/09/386875509.db2.gz DMAWVNUOSBXNSP-UHFFFAOYSA-N 1 2 230.315 2.448 20 0 BEADLO CC(C)c1nc(N[C@](C)(CO)C2CC2)cc[nH+]1 ZINC000301793163 386879902 /nfs/dbraw/zinc/87/99/02/386879902.db2.gz XKEMTCSXOJBYFV-CYBMUJFWSA-N 1 2 235.331 2.173 20 0 BEADLO CC(C)c1nc(N[C@@](C)(CO)C2CC2)cc[nH+]1 ZINC000301793164 386880168 /nfs/dbraw/zinc/88/01/68/386880168.db2.gz XKEMTCSXOJBYFV-ZDUSSCGKSA-N 1 2 235.331 2.173 20 0 BEADLO C[C@H]1c2ccccc2C[N@H+]1C[C@@H](O)C(F)(F)F ZINC000334839401 386882490 /nfs/dbraw/zinc/88/24/90/386882490.db2.gz YRKOTNBWQVEKDM-GZMMTYOYSA-N 1 2 245.244 2.486 20 0 BEADLO C[C@H]1c2ccccc2C[N@@H+]1C[C@@H](O)C(F)(F)F ZINC000334839401 386882491 /nfs/dbraw/zinc/88/24/91/386882491.db2.gz YRKOTNBWQVEKDM-GZMMTYOYSA-N 1 2 245.244 2.486 20 0 BEADLO CCCC[NH2+][C@H](c1nnc[nH]1)c1ccc(F)cc1 ZINC000293826350 386887271 /nfs/dbraw/zinc/88/72/71/386887271.db2.gz SGOZRNRSGRXCGA-LBPRGKRZSA-N 1 2 248.305 2.423 20 0 BEADLO COCC[C@H](C)Nc1nc(N)c2ccccc2[nH+]1 ZINC000301874557 386887392 /nfs/dbraw/zinc/88/73/92/386887392.db2.gz JSJAKGJUEKNHNI-VIFPVBQESA-N 1 2 246.314 2.049 20 0 BEADLO FC(F)[C@H](Cc1ccccc1)[NH2+][C@@H]1CCOC1 ZINC000358246420 386920064 /nfs/dbraw/zinc/92/00/64/386920064.db2.gz DMNHZNHODLFMQL-NEPJUHHUSA-N 1 2 241.281 2.241 20 0 BEADLO FC(F)[C@@H](Cc1ccccc1)[NH2+][C@H]1CCOC1 ZINC000358246425 386918856 /nfs/dbraw/zinc/91/88/56/386918856.db2.gz DMNHZNHODLFMQL-NWDGAFQWSA-N 1 2 241.281 2.241 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@H](CF)C2)ccc1F ZINC000334864503 386919133 /nfs/dbraw/zinc/91/91/33/386919133.db2.gz PRWIYUKNRYXSFX-GFCCVEGCSA-N 1 2 241.281 2.304 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@H](CF)C2)ccc1F ZINC000334864503 386919139 /nfs/dbraw/zinc/91/91/39/386919139.db2.gz PRWIYUKNRYXSFX-GFCCVEGCSA-N 1 2 241.281 2.304 20 0 BEADLO Cc1[nH]ncc1C[NH2+]C(C)(C)c1ccc(C)nc1 ZINC000330812601 386895890 /nfs/dbraw/zinc/89/58/90/386895890.db2.gz KONXZINBQSNSKZ-UHFFFAOYSA-N 1 2 244.342 2.446 20 0 BEADLO CC[C@H](CCO)Nc1nc(C)[nH+]c2c1CCCC2 ZINC000302038444 386899818 /nfs/dbraw/zinc/89/98/18/386899818.db2.gz GUIOUIOLMAHDLR-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)[C@@H]1CC=CCC1 ZINC000456396417 386908992 /nfs/dbraw/zinc/90/89/92/386908992.db2.gz SISKDJORVULQDX-VXGBXAGGSA-N 1 2 247.342 2.437 20 0 BEADLO CC(C)(C)c1nc(N[C@H]2C[C@H](O)C2(C)C)cc[nH+]1 ZINC000302403607 386921680 /nfs/dbraw/zinc/92/16/80/386921680.db2.gz KLLVHCCTSVMTGZ-UWVGGRQHSA-N 1 2 249.358 2.345 20 0 BEADLO CC(C)(C)c1nc(N[C@H]2C[C@@H](O)C2(C)C)cc[nH+]1 ZINC000302403608 386922042 /nfs/dbraw/zinc/92/20/42/386922042.db2.gz KLLVHCCTSVMTGZ-VHSXEESVSA-N 1 2 249.358 2.345 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@@H](CF)C2)cc1F ZINC000334865472 386922545 /nfs/dbraw/zinc/92/25/45/386922545.db2.gz UHNQZZMFJFPWPA-LBPRGKRZSA-N 1 2 241.281 2.304 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@@H](CF)C2)cc1F ZINC000334865472 386922549 /nfs/dbraw/zinc/92/25/49/386922549.db2.gz UHNQZZMFJFPWPA-LBPRGKRZSA-N 1 2 241.281 2.304 20 0 BEADLO Cc1ccc(CCNc2ncncc2Cl)c[nH+]1 ZINC000302539141 386924552 /nfs/dbraw/zinc/92/45/52/386924552.db2.gz HGNCRQMYKKLQNC-UHFFFAOYSA-N 1 2 248.717 2.488 20 0 BEADLO CC(C)n1ncnc1C[N@@H+]1C[C@H]2CCCC[C@H]21 ZINC000368001880 386929034 /nfs/dbraw/zinc/92/90/34/386929034.db2.gz RYXNITTVNVZHSD-VXGBXAGGSA-N 1 2 234.347 2.233 20 0 BEADLO CC(C)n1ncnc1C[N@H+]1C[C@H]2CCCC[C@H]21 ZINC000368001880 386929044 /nfs/dbraw/zinc/92/90/44/386929044.db2.gz RYXNITTVNVZHSD-VXGBXAGGSA-N 1 2 234.347 2.233 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC[C@H]2c2ccco2)n1C ZINC000116293616 386933294 /nfs/dbraw/zinc/93/32/94/386933294.db2.gz DXVYCXKCCBYMRE-NSHDSACASA-N 1 2 246.314 2.054 20 0 BEADLO Cc1nnc(C[N@H+]2CCC[C@H]2c2ccco2)n1C ZINC000116293616 386933300 /nfs/dbraw/zinc/93/33/00/386933300.db2.gz DXVYCXKCCBYMRE-NSHDSACASA-N 1 2 246.314 2.054 20 0 BEADLO CO[C@@H]1CC[C@@H](Nc2cc[nH+]c(C3CC3)n2)C1 ZINC000302750099 386934625 /nfs/dbraw/zinc/93/46/25/386934625.db2.gz GRQGDPWUDBVZKK-GHMZBOCLSA-N 1 2 233.315 2.333 20 0 BEADLO Cc1nnc(C[N@@H+]2C[C@H]3CCCC[C@H]32)s1 ZINC000368099994 386941012 /nfs/dbraw/zinc/94/10/12/386941012.db2.gz OROYVHSEFAJURU-NXEZZACHSA-N 1 2 223.345 2.221 20 0 BEADLO Cc1nnc(C[N@H+]2C[C@H]3CCCC[C@H]32)s1 ZINC000368099994 386941020 /nfs/dbraw/zinc/94/10/20/386941020.db2.gz OROYVHSEFAJURU-NXEZZACHSA-N 1 2 223.345 2.221 20 0 BEADLO CCC[C@H](C)C(=O)N[C@@H](c1[nH+]ccn1C)C1CC1 ZINC000341714877 386954094 /nfs/dbraw/zinc/95/40/94/386954094.db2.gz RRWOVZXPRFPYTE-CMPLNLGQSA-N 1 2 249.358 2.424 20 0 BEADLO CC[C@H]([NH2+]C[C@H]1CCCOC1)C(F)(F)F ZINC000336763243 386955028 /nfs/dbraw/zinc/95/50/28/386955028.db2.gz OTDWMZQJDWUADZ-BDAKNGLRSA-N 1 2 225.254 2.344 20 0 BEADLO Cn1cc[nH+]c1[C@@H](NC(=O)CC1CCC1)C1CC1 ZINC000341719348 386955854 /nfs/dbraw/zinc/95/58/54/386955854.db2.gz MTAFJZQUUWBBKR-ZDUSSCGKSA-N 1 2 247.342 2.178 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@]12CC[C@@H](C)[C@H](C)C2 ZINC000639426715 386962112 /nfs/dbraw/zinc/96/21/12/386962112.db2.gz HRVRSMOYNMRFOT-JTNHKYCSSA-N 1 2 238.375 2.369 20 0 BEADLO Cc1ccnc(C[NH2+][C@@H](C)c2cccc(O)c2)n1 ZINC000341811932 386974748 /nfs/dbraw/zinc/97/47/48/386974748.db2.gz YOWAEYCCTGLWJI-NSHDSACASA-N 1 2 243.310 2.341 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CC(C)(C)C[C@H]1C ZINC000334900654 386975136 /nfs/dbraw/zinc/97/51/36/386975136.db2.gz YRMWYZNUIQWKQM-LLVKDONJSA-N 1 2 247.342 2.464 20 0 BEADLO FC(F)OC[C@@H]1CC[N@H+](Cc2cscn2)C1 ZINC000353020316 386990796 /nfs/dbraw/zinc/99/07/96/386990796.db2.gz ADYDVVGNEXJKMY-MRVPVSSYSA-N 1 2 248.298 2.204 20 0 BEADLO FC(F)OC[C@@H]1CC[N@@H+](Cc2cscn2)C1 ZINC000353020316 386990800 /nfs/dbraw/zinc/99/08/00/386990800.db2.gz ADYDVVGNEXJKMY-MRVPVSSYSA-N 1 2 248.298 2.204 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+]1CCO[C@H]2C[C@H]21 ZINC000368636124 386995168 /nfs/dbraw/zinc/99/51/68/386995168.db2.gz HGTZRYHVJZWMIO-OLZOCXBDSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1ccc(F)cc1C[N@H+]1CCO[C@H]2C[C@H]21 ZINC000368636124 386995173 /nfs/dbraw/zinc/99/51/73/386995173.db2.gz HGTZRYHVJZWMIO-OLZOCXBDSA-N 1 2 221.275 2.107 20 0 BEADLO Cn1ncc2c1nc[nH+]c2NCC1CCCCC1 ZINC000029078423 387003856 /nfs/dbraw/zinc/00/38/56/387003856.db2.gz ASMKWDPKADUPNB-UHFFFAOYSA-N 1 2 245.330 2.356 20 0 BEADLO CCCCC(=O)N[C@@H](c1[nH+]ccn1C)C1CC1 ZINC000341685425 386950901 /nfs/dbraw/zinc/95/09/01/386950901.db2.gz DEVLMJKDOQOVBV-GFCCVEGCSA-N 1 2 235.331 2.178 20 0 BEADLO CC(C)CC(=O)N1CCC[C@H](c2[nH+]ccn2C)C1 ZINC000369351971 387040429 /nfs/dbraw/zinc/04/04/29/387040429.db2.gz GYNSIOUOXLQQRA-LBPRGKRZSA-N 1 2 249.358 2.172 20 0 BEADLO Cc1cc(N2CCC(=O)[C@@H](C)C2)nc(C2CC2)[nH+]1 ZINC000188549058 387041647 /nfs/dbraw/zinc/04/16/47/387041647.db2.gz VZIZWIHVUOZYBC-VIFPVBQESA-N 1 2 245.326 2.078 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)[C@@H]1CCC(C)(C)C1 ZINC000359065281 387052359 /nfs/dbraw/zinc/05/23/59/387052359.db2.gz SSDMFTFLWZNTNX-NWDGAFQWSA-N 1 2 249.358 2.214 20 0 BEADLO Cc1nc(N2CCC[C@](C)(O)CC2)c(C)c(C)[nH+]1 ZINC000369538469 387053423 /nfs/dbraw/zinc/05/34/23/387053423.db2.gz AQBHCXLHPHRDIE-AWEZNQCLSA-N 1 2 249.358 2.143 20 0 BEADLO Cc1cc(CNC(=O)N(C)C(C)C)cc(C)[nH+]1 ZINC000334969996 387054755 /nfs/dbraw/zinc/05/47/55/387054755.db2.gz LIMDNKJXBMUNMQ-UHFFFAOYSA-N 1 2 235.331 2.248 20 0 BEADLO CC(C)(C)n1cc(C[N@@H+]2CC[C@H](F)C2)cn1 ZINC000336222789 387061284 /nfs/dbraw/zinc/06/12/84/387061284.db2.gz KMCDOZSASMHGLR-NSHDSACASA-N 1 2 225.311 2.182 20 0 BEADLO CC(C)(C)n1cc(C[N@H+]2CC[C@H](F)C2)cn1 ZINC000336222789 387061289 /nfs/dbraw/zinc/06/12/89/387061289.db2.gz KMCDOZSASMHGLR-NSHDSACASA-N 1 2 225.311 2.182 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1ncnn1-c1ccccc1 ZINC000334975419 387062337 /nfs/dbraw/zinc/06/23/37/387062337.db2.gz JRXBCISOYLDCCU-RYUDHWBXSA-N 1 2 242.326 2.250 20 0 BEADLO Cc1ccc(CSc2nccnc2N)c(C)[nH+]1 ZINC000359181570 387064933 /nfs/dbraw/zinc/06/49/33/387064933.db2.gz ZDJDHDODLZEVFL-UHFFFAOYSA-N 1 2 246.339 2.363 20 0 BEADLO CO[C@H](C)C(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000118643139 387065462 /nfs/dbraw/zinc/06/54/62/387065462.db2.gz DTMYRGOXAFZVRP-SECBINFHSA-N 1 2 245.282 2.050 20 0 BEADLO COC(=O)[C@@H]([NH2+][C@H]1CCCC(F)(F)C1)C1CC1 ZINC000358844628 387022624 /nfs/dbraw/zinc/02/26/24/387022624.db2.gz DLYRMPWFOJPRSF-UWVGGRQHSA-N 1 2 247.285 2.106 20 0 BEADLO CC(C)C[C@H](C)C[N@@H+]1CC(F)(F)C[C@H]1CO ZINC000369052311 387026045 /nfs/dbraw/zinc/02/60/45/387026045.db2.gz ASSKLNDFJMBUDO-QWRGUYRKSA-N 1 2 235.318 2.371 20 0 BEADLO CC(C)C[C@H](C)C[N@H+]1CC(F)(F)C[C@H]1CO ZINC000369052311 387026050 /nfs/dbraw/zinc/02/60/50/387026050.db2.gz ASSKLNDFJMBUDO-QWRGUYRKSA-N 1 2 235.318 2.371 20 0 BEADLO C[C@@H](CC(=O)NC(C1CC1)C1CC1)n1cc[nH+]c1 ZINC000519161991 387026508 /nfs/dbraw/zinc/02/65/08/387026508.db2.gz WAEVDPUNPCFTQL-JTQLQIEISA-N 1 2 247.342 2.139 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CC[C@H]1C(C)C ZINC000334981864 387070692 /nfs/dbraw/zinc/07/06/92/387070692.db2.gz RMCMOKUXNULWRG-LBPRGKRZSA-N 1 2 233.315 2.074 20 0 BEADLO COC(=O)c1ccc(C[N@H+](C)Cc2ccoc2)[nH]1 ZINC000359243062 387071978 /nfs/dbraw/zinc/07/19/78/387071978.db2.gz WUYWEKSPYSBBSP-UHFFFAOYSA-N 1 2 248.282 2.026 20 0 BEADLO COC(=O)c1ccc(C[N@@H+](C)Cc2ccoc2)[nH]1 ZINC000359243062 387071983 /nfs/dbraw/zinc/07/19/83/387071983.db2.gz WUYWEKSPYSBBSP-UHFFFAOYSA-N 1 2 248.282 2.026 20 0 BEADLO c1c[nH]c(C[N@@H+]2Cc3ccccc3C3(CC3)C2)n1 ZINC000186165337 387073274 /nfs/dbraw/zinc/07/32/74/387073274.db2.gz QMGJGHJWNWCGLT-UHFFFAOYSA-N 1 2 239.322 2.457 20 0 BEADLO c1c[nH]c(C[N@H+]2Cc3ccccc3C3(CC3)C2)n1 ZINC000186165337 387073280 /nfs/dbraw/zinc/07/32/80/387073280.db2.gz QMGJGHJWNWCGLT-UHFFFAOYSA-N 1 2 239.322 2.457 20 0 BEADLO c1c[nH+]c(CN2Cc3ccccc3C3(CC3)C2)[nH]1 ZINC000186165337 387073283 /nfs/dbraw/zinc/07/32/83/387073283.db2.gz QMGJGHJWNWCGLT-UHFFFAOYSA-N 1 2 239.322 2.457 20 0 BEADLO Cc1cc(C(=O)N(C)Cc2[nH]cc[nH+]2)ccc1F ZINC000070981008 387085617 /nfs/dbraw/zinc/08/56/17/387085617.db2.gz AZJUIZWXECFGOE-UHFFFAOYSA-N 1 2 247.273 2.129 20 0 BEADLO O=S1CC[NH+](Cc2cccc(C3CC3)c2)CC1 ZINC000334995081 387086521 /nfs/dbraw/zinc/08/65/21/387086521.db2.gz OEXKNQIYQSXDJV-UHFFFAOYSA-N 1 2 249.379 2.128 20 0 BEADLO Cc1cc(CNC(=O)N[C@@H]2CC[C@@H]2C)cc(C)[nH+]1 ZINC000334997335 387087450 /nfs/dbraw/zinc/08/74/50/387087450.db2.gz HQHVPTXEJRVKQW-TVQRCGJNSA-N 1 2 247.342 2.296 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@H](F)C2)c(C)s1 ZINC000336262571 387097580 /nfs/dbraw/zinc/09/75/80/387097580.db2.gz CBIBWMFKFXSWGL-SECBINFHSA-N 1 2 214.309 2.304 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@H](F)C2)c(C)s1 ZINC000336262571 387097587 /nfs/dbraw/zinc/09/75/87/387097587.db2.gz CBIBWMFKFXSWGL-SECBINFHSA-N 1 2 214.309 2.304 20 0 BEADLO Cc1ccc(NC(=O)c2cccn2C)c(C)[nH+]1 ZINC000119172298 387103433 /nfs/dbraw/zinc/10/34/33/387103433.db2.gz AZNXYMILRLMUDQ-UHFFFAOYSA-N 1 2 229.283 2.289 20 0 BEADLO COc1ncccc1C[N@@H+]1CCC[C@@](C)(F)C1 ZINC000336275221 387106470 /nfs/dbraw/zinc/10/64/70/387106470.db2.gz DUBSBKUHGVXIOJ-CYBMUJFWSA-N 1 2 238.306 2.414 20 0 BEADLO COc1ncccc1C[N@H+]1CCC[C@@](C)(F)C1 ZINC000336275221 387106473 /nfs/dbraw/zinc/10/64/73/387106473.db2.gz DUBSBKUHGVXIOJ-CYBMUJFWSA-N 1 2 238.306 2.414 20 0 BEADLO Cc1c[nH]cc1C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000334948371 387110797 /nfs/dbraw/zinc/11/07/97/387110797.db2.gz PCVXFXRKXCDLHA-LLVKDONJSA-N 1 2 244.298 2.024 20 0 BEADLO CCOCCC1(CNc2cc(C)[nH+]cn2)CC1 ZINC000127697259 387121030 /nfs/dbraw/zinc/12/10/30/387121030.db2.gz QTYNSVRIIDVAIO-UHFFFAOYSA-N 1 2 235.331 2.404 20 0 BEADLO Cc1cc(C)c(CNC(=O)C2=CCCC2)c[nH+]1 ZINC000335029617 387125141 /nfs/dbraw/zinc/12/51/41/387125141.db2.gz QXLDUEDIHPFXPL-UHFFFAOYSA-N 1 2 230.311 2.425 20 0 BEADLO C[C@H](C(=O)N(C)Cc1[nH]cc[nH+]1)c1ccccc1 ZINC000228905925 387126667 /nfs/dbraw/zinc/12/66/67/387126667.db2.gz PRMOLBQMGIBALH-NSHDSACASA-N 1 2 243.310 2.172 20 0 BEADLO CC(C)(C(=O)N1CCn2c[nH+]cc2C1)C1CCC1 ZINC000336298699 387128416 /nfs/dbraw/zinc/12/84/16/387128416.db2.gz MCRIFICNNQGRGQ-UHFFFAOYSA-N 1 2 247.342 2.052 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCc2cn[nH]c2C1)c1cscn1 ZINC000336316315 387141901 /nfs/dbraw/zinc/14/19/01/387141901.db2.gz SOELHCXWCCPQKN-WCBMZHEXSA-N 1 2 248.355 2.074 20 0 BEADLO CCc1ccc(C[N@H+](C)C(C)(C)C(=O)OC)o1 ZINC000353148641 387145228 /nfs/dbraw/zinc/14/52/28/387145228.db2.gz ZGRAHFCHVNCLTA-UHFFFAOYSA-N 1 2 239.315 2.225 20 0 BEADLO CCc1ccc(C[N@@H+](C)C(C)(C)C(=O)OC)o1 ZINC000353148641 387145232 /nfs/dbraw/zinc/14/52/32/387145232.db2.gz ZGRAHFCHVNCLTA-UHFFFAOYSA-N 1 2 239.315 2.225 20 0 BEADLO COC(=O)C(C)(C)[N@H+](C)Cc1ccc(C)s1 ZINC000353149805 387145512 /nfs/dbraw/zinc/14/55/12/387145512.db2.gz BCDQNVHHPAMNAZ-UHFFFAOYSA-N 1 2 241.356 2.440 20 0 BEADLO COC(=O)C(C)(C)[N@@H+](C)Cc1ccc(C)s1 ZINC000353149805 387145516 /nfs/dbraw/zinc/14/55/16/387145516.db2.gz BCDQNVHHPAMNAZ-UHFFFAOYSA-N 1 2 241.356 2.440 20 0 BEADLO CC[C@@H]1CCC[C@H]1NC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000571699831 387149699 /nfs/dbraw/zinc/14/96/99/387149699.db2.gz LEHJFKGPAAKXAC-NQBHXWOUSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@@H]1CCC[C@H]1NC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000571699831 387149701 /nfs/dbraw/zinc/14/97/01/387149701.db2.gz LEHJFKGPAAKXAC-NQBHXWOUSA-N 1 2 249.358 2.283 20 0 BEADLO FC(F)[C@@H]1CCC[N@@H+]1CCc1cccnc1 ZINC000353181333 387149922 /nfs/dbraw/zinc/14/99/22/387149922.db2.gz LUGICZDWFJRKPP-NSHDSACASA-N 1 2 226.270 2.354 20 0 BEADLO FC(F)[C@@H]1CCC[N@H+]1CCc1cccnc1 ZINC000353181333 387149925 /nfs/dbraw/zinc/14/99/25/387149925.db2.gz LUGICZDWFJRKPP-NSHDSACASA-N 1 2 226.270 2.354 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2ncc(C3CC3)o2)C1 ZINC000336324860 387152105 /nfs/dbraw/zinc/15/21/05/387152105.db2.gz LCWSWFHSTGFYOU-GFCCVEGCSA-N 1 2 224.279 2.486 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2ncc(C3CC3)o2)C1 ZINC000336324860 387152110 /nfs/dbraw/zinc/15/21/10/387152110.db2.gz LCWSWFHSTGFYOU-GFCCVEGCSA-N 1 2 224.279 2.486 20 0 BEADLO CC(C)c1[nH]c2c([nH+]1)CC[C@H](C(N)=O)C2 ZINC000336328165 387157376 /nfs/dbraw/zinc/15/73/76/387157376.db2.gz GOKOIQQENHWWLR-ZETCQYMHSA-N 1 2 207.277 2.173 20 0 BEADLO CC(C)c1[nH]c2c([nH+]1)C[C@@H](C(N)=O)CC2 ZINC000336328165 387157381 /nfs/dbraw/zinc/15/73/81/387157381.db2.gz GOKOIQQENHWWLR-ZETCQYMHSA-N 1 2 207.277 2.173 20 0 BEADLO Cc1cnc(CN2CCC[C@@H]2c2[nH]cc[nH+]2)o1 ZINC000336360141 387193401 /nfs/dbraw/zinc/19/34/01/387193401.db2.gz HSNPXFKVGBTFMQ-SNVBAGLBSA-N 1 2 232.287 2.043 20 0 BEADLO CCc1ccc(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)cn1 ZINC000336346831 387176550 /nfs/dbraw/zinc/17/65/50/387176550.db2.gz YLLGXNOHGQLVJZ-NWDGAFQWSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1ccc(C[N@H+]2C[C@@H](C)OC[C@@H]2C)cn1 ZINC000336346831 387176557 /nfs/dbraw/zinc/17/65/57/387176557.db2.gz YLLGXNOHGQLVJZ-NWDGAFQWSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1ccc([C@H](C)[NH2+][C@H](C)c2ncnn2C)o1 ZINC000353335348 387183699 /nfs/dbraw/zinc/18/36/99/387183699.db2.gz KYCFLBROZPZOFH-VHSXEESVSA-N 1 2 248.330 2.382 20 0 BEADLO C[C@@H](CNC(=O)C1CC(C)(C)C1)Cn1cc[nH+]c1 ZINC000353367203 387189511 /nfs/dbraw/zinc/18/95/11/387189511.db2.gz YFEYKQUBWXQMMN-NSHDSACASA-N 1 2 249.358 2.072 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CCC[C@@H]1C1CC1 ZINC000371313623 387191694 /nfs/dbraw/zinc/19/16/94/387191694.db2.gz MMDGDNQUPXLIBE-CYBMUJFWSA-N 1 2 245.326 2.218 20 0 BEADLO C[NH+](C)Cc1nc(C2CCCCC2)no1 ZINC000336371099 387203472 /nfs/dbraw/zinc/20/34/72/387203472.db2.gz MCNCRIRQEUELCD-UHFFFAOYSA-N 1 2 209.293 2.179 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2C[C@H](C)[C@@H]2C)o1 ZINC000336375561 387205428 /nfs/dbraw/zinc/20/54/28/387205428.db2.gz YHYLANSLBXZRAQ-IUCAKERBSA-N 1 2 209.293 2.033 20 0 BEADLO CC(C)c1nnc(C[N@H+]2C[C@H](C)[C@@H]2C)o1 ZINC000336375561 387205433 /nfs/dbraw/zinc/20/54/33/387205433.db2.gz YHYLANSLBXZRAQ-IUCAKERBSA-N 1 2 209.293 2.033 20 0 BEADLO CC[C@@H](O)CNc1cc(C)[nH+]c(C(C)C)n1 ZINC000229994288 387208929 /nfs/dbraw/zinc/20/89/29/387208929.db2.gz BOPPFNOQUHXZRX-SNVBAGLBSA-N 1 2 223.320 2.091 20 0 BEADLO CC[C@@H](O)CNc1cc(C(F)(F)F)cc[nH+]1 ZINC000229995487 387209341 /nfs/dbraw/zinc/20/93/41/387209341.db2.gz CLZVZPDINHNRNI-MRVPVSSYSA-N 1 2 234.221 2.283 20 0 BEADLO CCO[C@@H]1C[C@@H]1Nc1nc(C)[nH+]c2c1CCCC2 ZINC000571982893 387214431 /nfs/dbraw/zinc/21/44/31/387214431.db2.gz GRXVNLVIIICRLB-QWHCGFSZSA-N 1 2 247.342 2.253 20 0 BEADLO CCO[C@@H]1C[C@H]1Nc1nc(C)[nH+]c2c1CCCC2 ZINC000571982890 387214440 /nfs/dbraw/zinc/21/44/40/387214440.db2.gz GRXVNLVIIICRLB-CHWSQXEVSA-N 1 2 247.342 2.253 20 0 BEADLO CC(C)=CCC[C@H](C)NC(=O)Cc1c[nH+]cn1C ZINC000571990103 387214756 /nfs/dbraw/zinc/21/47/56/387214756.db2.gz BLZXZVDPVTWOQD-LBPRGKRZSA-N 1 2 249.358 2.214 20 0 BEADLO C[N@H+](Cc1c(F)cccc1Cl)C1CC(O)C1 ZINC000353495392 387216181 /nfs/dbraw/zinc/21/61/81/387216181.db2.gz NHNNSYUQRHDGOB-UHFFFAOYSA-N 1 2 243.709 2.434 20 0 BEADLO C[N@@H+](Cc1c(F)cccc1Cl)C1CC(O)C1 ZINC000353495392 387216185 /nfs/dbraw/zinc/21/61/85/387216185.db2.gz NHNNSYUQRHDGOB-UHFFFAOYSA-N 1 2 243.709 2.434 20 0 BEADLO CCN(C(=O)c1ccc2[nH+]ccn2c1)C1CCC1 ZINC000336395293 387223168 /nfs/dbraw/zinc/22/31/68/387223168.db2.gz CBKFSEBQWYHRCA-UHFFFAOYSA-N 1 2 243.310 2.349 20 0 BEADLO CCC[C@@H]1C[C@@H]1C(=O)Nc1cc[nH+]cc1C ZINC000360175437 387238861 /nfs/dbraw/zinc/23/88/61/387238861.db2.gz KRGKBNQZRSDXHQ-MNOVXSKESA-N 1 2 218.300 2.187 20 0 BEADLO CCC1(NC(=O)N[C@H]2C[C@@H](C)n3cc[nH+]c32)CC1 ZINC000334098217 387195138 /nfs/dbraw/zinc/19/51/38/387195138.db2.gz UKZSJXAZDYWGAV-ZJUUUORDSA-N 1 2 248.330 2.131 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)[C@@H]1CCCC[C@@H]1C ZINC000424590350 387200212 /nfs/dbraw/zinc/20/02/12/387200212.db2.gz LCULRSXJALJWMJ-YNEHKIRRSA-N 1 2 249.358 2.214 20 0 BEADLO CC[C@@H]1[C@H](C)CCN1C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000514949055 387312010 /nfs/dbraw/zinc/31/20/10/387312010.db2.gz FUZILWVMIASIRQ-NTZNESFSSA-N 1 2 249.358 2.235 20 0 BEADLO CC[C@@H]1[C@H](C)CCN1C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000514949055 387312014 /nfs/dbraw/zinc/31/20/14/387312014.db2.gz FUZILWVMIASIRQ-NTZNESFSSA-N 1 2 249.358 2.235 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@H](c3ccco3)C2)on1 ZINC000336485049 387313802 /nfs/dbraw/zinc/31/38/02/387313802.db2.gz HONNCIWNKGKBIF-ZDUSSCGKSA-N 1 2 248.282 2.150 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@H](c3ccco3)C2)on1 ZINC000336485049 387313805 /nfs/dbraw/zinc/31/38/05/387313805.db2.gz HONNCIWNKGKBIF-ZDUSSCGKSA-N 1 2 248.282 2.150 20 0 BEADLO CC[C@@H](C)CCC(=O)NCc1[nH]c[nH+]c1C ZINC000353700376 387261459 /nfs/dbraw/zinc/26/14/59/387261459.db2.gz WNFGTVXOIFUKQD-SECBINFHSA-N 1 2 223.320 2.161 20 0 BEADLO Cc1cn2cc(NC(=O)N3CC(C)C3)ccc2[nH+]1 ZINC000336436447 387263435 /nfs/dbraw/zinc/26/34/35/387263435.db2.gz QJCHHKAKVUTXIM-UHFFFAOYSA-N 1 2 244.298 2.126 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)n1 ZINC000336445856 387271882 /nfs/dbraw/zinc/27/18/82/387271882.db2.gz XJMDPEPOTMGFCS-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccnc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)n1 ZINC000336445856 387271886 /nfs/dbraw/zinc/27/18/86/387271886.db2.gz XJMDPEPOTMGFCS-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO CC[C@H]1CCCN1C(=O)Nc1cc[nH+]cc1C ZINC000336445386 387272359 /nfs/dbraw/zinc/27/23/59/387272359.db2.gz UZGUEKBMSNRSBT-NSHDSACASA-N 1 2 233.315 2.218 20 0 BEADLO Cc1cn2c([nH+]1)CN(C(=O)C(C)(C)C(C)C)CC2 ZINC000372630498 387317807 /nfs/dbraw/zinc/31/78/07/387317807.db2.gz HYPLDDLTEJBOPI-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO CCC[C@H]1CCC[N@H+](Cc2noc(C)n2)C1 ZINC000120837130 387276454 /nfs/dbraw/zinc/27/64/54/387276454.db2.gz AZVZSPIMVPHLFH-NSHDSACASA-N 1 2 223.320 2.390 20 0 BEADLO CCC[C@H]1CCC[N@@H+](Cc2noc(C)n2)C1 ZINC000120837130 387276458 /nfs/dbraw/zinc/27/64/58/387276458.db2.gz AZVZSPIMVPHLFH-NSHDSACASA-N 1 2 223.320 2.390 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@H]1CC[C@@H](C)C[C@H]1C ZINC000514731641 387282396 /nfs/dbraw/zinc/28/23/96/387282396.db2.gz QMBVLPFLSJJMDK-CKYFFXLPSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@@H]1CC[C@@H](C)C[C@H]1C ZINC000514731641 387282400 /nfs/dbraw/zinc/28/24/00/387282400.db2.gz QMBVLPFLSJJMDK-CKYFFXLPSA-N 1 2 249.358 2.202 20 0 BEADLO C[C@H](N[C@H](C1CC1)C(F)(F)F)c1[nH+]ccn1C ZINC000352519736 387286511 /nfs/dbraw/zinc/28/65/11/387286511.db2.gz RGUMQLZNLQXPNA-IONNQARKSA-N 1 2 247.264 2.412 20 0 BEADLO C[N@H+](CCCc1ccncc1)CC(F)F ZINC000360457854 387288598 /nfs/dbraw/zinc/28/85/98/387288598.db2.gz WOQIXFYIDWIQHY-UHFFFAOYSA-N 1 2 214.259 2.211 20 0 BEADLO C[N@@H+](CCCc1ccncc1)CC(F)F ZINC000360457854 387288601 /nfs/dbraw/zinc/28/86/01/387288601.db2.gz WOQIXFYIDWIQHY-UHFFFAOYSA-N 1 2 214.259 2.211 20 0 BEADLO CCC[C@@H]1C[C@H]1NC(=O)Nc1cc(C)[nH+]cc1C ZINC000514875807 387302453 /nfs/dbraw/zinc/30/24/53/387302453.db2.gz XFAADOUCJUMZGM-DGCLKSJQSA-N 1 2 247.342 2.430 20 0 BEADLO CC(C)[C@H](C)C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000336537289 387359924 /nfs/dbraw/zinc/35/99/24/387359924.db2.gz OQVWNIKWWNAGBE-WDEREUQCSA-N 1 2 235.331 2.365 20 0 BEADLO C[C@@H]1c2ccccc2CN1Cc1[nH+]ccn1C ZINC000336552724 387373357 /nfs/dbraw/zinc/37/33/57/387373357.db2.gz MHUYHMYZFZPSDQ-LLVKDONJSA-N 1 2 227.311 2.497 20 0 BEADLO C[C@@H]1c2ccccc2C[N@H+]1Cc1nccn1C ZINC000336552724 387373362 /nfs/dbraw/zinc/37/33/62/387373362.db2.gz MHUYHMYZFZPSDQ-LLVKDONJSA-N 1 2 227.311 2.497 20 0 BEADLO C[C@@H]1c2ccccc2C[N@@H+]1Cc1nccn1C ZINC000336552724 387373365 /nfs/dbraw/zinc/37/33/65/387373365.db2.gz MHUYHMYZFZPSDQ-LLVKDONJSA-N 1 2 227.311 2.497 20 0 BEADLO CC[C@H]1C[C@H](Nc2ccc(OC)c[nH+]2)CCO1 ZINC000648481893 387381474 /nfs/dbraw/zinc/38/14/74/387381474.db2.gz QXWLHLJYVQUGAR-MNOVXSKESA-N 1 2 236.315 2.460 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2CCO[C@@H]2C)c(C)[nH+]1 ZINC000336494265 387320124 /nfs/dbraw/zinc/32/01/24/387320124.db2.gz JUKBHIUZQUONLK-MNOVXSKESA-N 1 2 234.299 2.062 20 0 BEADLO CC(C)=CC(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000360665603 387330256 /nfs/dbraw/zinc/33/02/56/387330256.db2.gz XAHLOXNHDODTKK-UHFFFAOYSA-N 1 2 233.315 2.082 20 0 BEADLO CC(C)=CC(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000360665603 387330259 /nfs/dbraw/zinc/33/02/59/387330259.db2.gz XAHLOXNHDODTKK-UHFFFAOYSA-N 1 2 233.315 2.082 20 0 BEADLO Cn1cc(C[N@@H+]2CC[C@](C)(F)C2)c(C(F)F)n1 ZINC000336506237 387331869 /nfs/dbraw/zinc/33/18/69/387331869.db2.gz FEHILEJKTQTQDR-NSHDSACASA-N 1 2 247.264 2.292 20 0 BEADLO Cn1cc(C[N@H+]2CC[C@](C)(F)C2)c(C(F)F)n1 ZINC000336506237 387331872 /nfs/dbraw/zinc/33/18/72/387331872.db2.gz FEHILEJKTQTQDR-NSHDSACASA-N 1 2 247.264 2.292 20 0 BEADLO COc1cc(C)nc(C[N@@H+]2CC[C@](C)(F)C2)c1 ZINC000336511839 387335740 /nfs/dbraw/zinc/33/57/40/387335740.db2.gz SSOINLHMVHKRLX-ZDUSSCGKSA-N 1 2 238.306 2.333 20 0 BEADLO COc1cc(C)nc(C[N@H+]2CC[C@](C)(F)C2)c1 ZINC000336511839 387335744 /nfs/dbraw/zinc/33/57/44/387335744.db2.gz SSOINLHMVHKRLX-ZDUSSCGKSA-N 1 2 238.306 2.333 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@H]2[C@@H]3CCC[C@@H]32)[nH+]1 ZINC000515195747 387345852 /nfs/dbraw/zinc/34/58/52/387345852.db2.gz BQJRHCHAIAKUKK-JZYVYDRUSA-N 1 2 228.299 2.477 20 0 BEADLO Cc1ccc(NC(=O)[C@@]2(C)CCOC2)c(C)[nH+]1 ZINC000336558252 387383508 /nfs/dbraw/zinc/38/35/08/387383508.db2.gz MMZJEHQQGDGCSB-ZDUSSCGKSA-N 1 2 234.299 2.064 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000360800928 387351429 /nfs/dbraw/zinc/35/14/29/387351429.db2.gz IWZGMHZKJJPQMS-GWCFXTLKSA-N 1 2 235.331 2.050 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H]1CCCO[C@@H]1C ZINC000191457381 387428723 /nfs/dbraw/zinc/42/87/23/387428723.db2.gz WXSSCWZXRVJWNW-MNOVXSKESA-N 1 2 234.299 2.144 20 0 BEADLO CC(C)[C@H]1C[N@@H+]([C@H](C)c2cccnc2)CCN1C ZINC000336605969 387449509 /nfs/dbraw/zinc/44/95/09/387449509.db2.gz KUQKYRCKGYQJOM-UKRRQHHQSA-N 1 2 247.386 2.415 20 0 BEADLO CC(C)[C@H]1C[N@H+]([C@H](C)c2cccnc2)CCN1C ZINC000336605969 387449513 /nfs/dbraw/zinc/44/95/13/387449513.db2.gz KUQKYRCKGYQJOM-UKRRQHHQSA-N 1 2 247.386 2.415 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC000336562506 387388710 /nfs/dbraw/zinc/38/87/10/387388710.db2.gz BCOFZTDOVLKAEM-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000336562506 387388712 /nfs/dbraw/zinc/38/87/12/387388712.db2.gz BCOFZTDOVLKAEM-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC(C)(C)[C@@H]1[C@@H]1CCCO1 ZINC000336562408 387389302 /nfs/dbraw/zinc/38/93/02/387389302.db2.gz ZHMPFRQHLWOLMK-STQMWFEESA-N 1 2 249.358 2.108 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC(C)(C)[C@@H]1[C@@H]1CCCO1 ZINC000336562408 387389305 /nfs/dbraw/zinc/38/93/05/387389305.db2.gz ZHMPFRQHLWOLMK-STQMWFEESA-N 1 2 249.358 2.108 20 0 BEADLO CC(C)CCCCC(=O)N1CC(n2cc[nH+]c2)C1 ZINC000515604919 387398240 /nfs/dbraw/zinc/39/82/40/387398240.db2.gz KMCFQDKJQAOHRQ-UHFFFAOYSA-N 1 2 249.358 2.483 20 0 BEADLO CCN(CC)C(=O)C[N@@H+]1Cc2ccccc2[C@H]1C ZINC000361085353 387398598 /nfs/dbraw/zinc/39/85/98/387398598.db2.gz FAKOZLOSDQEECE-GFCCVEGCSA-N 1 2 246.354 2.432 20 0 BEADLO CCN(CC)C(=O)C[N@H+]1Cc2ccccc2[C@H]1C ZINC000361085353 387398603 /nfs/dbraw/zinc/39/86/03/387398603.db2.gz FAKOZLOSDQEECE-GFCCVEGCSA-N 1 2 246.354 2.432 20 0 BEADLO Cc1ccnc(C[NH2+][C@H](C)c2cccnc2)n1 ZINC000361085134 387399455 /nfs/dbraw/zinc/39/94/55/387399455.db2.gz GLKJNAAQWOXBFJ-LLVKDONJSA-N 1 2 228.299 2.031 20 0 BEADLO CC[C@H]1C[C@@H](Nc2[nH+]cccc2OC)CCO1 ZINC000648491212 387401474 /nfs/dbraw/zinc/40/14/74/387401474.db2.gz IJRWWNXLANXAJV-QWRGUYRKSA-N 1 2 236.315 2.460 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)C/C=C\c1ccccc1 ZINC000361194517 387413784 /nfs/dbraw/zinc/41/37/84/387413784.db2.gz TWBGSDMWOHBARQ-MQGYJPLLSA-N 1 2 233.311 2.193 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)C/C=C\c1ccccc1 ZINC000361194517 387413793 /nfs/dbraw/zinc/41/37/93/387413793.db2.gz TWBGSDMWOHBARQ-MQGYJPLLSA-N 1 2 233.311 2.193 20 0 BEADLO CC(=O)CCCC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000421919834 387502368 /nfs/dbraw/zinc/50/23/68/387502368.db2.gz MYYVTEHZVMKENT-UHFFFAOYSA-N 1 2 248.326 2.074 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cocn2)CC2(CCCC2)O1 ZINC000648076899 387502656 /nfs/dbraw/zinc/50/26/56/387502656.db2.gz OXZOKLKFMAWCTP-LLVKDONJSA-N 1 2 236.315 2.208 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cocn2)CC2(CCCC2)O1 ZINC000648076899 387502662 /nfs/dbraw/zinc/50/26/62/387502662.db2.gz OXZOKLKFMAWCTP-LLVKDONJSA-N 1 2 236.315 2.208 20 0 BEADLO CCn1cc[nH+]c1CNc1nc(C)c(C)nc1C ZINC000396874333 387504855 /nfs/dbraw/zinc/50/48/55/387504855.db2.gz LFXKTKYPEOLMTB-UHFFFAOYSA-N 1 2 245.330 2.230 20 0 BEADLO CC[C@@H](C(=O)OC)[N@@H+]1Cc2ccc(C)cc2C1 ZINC000361602353 387507111 /nfs/dbraw/zinc/50/71/11/387507111.db2.gz MQMBSZUOUPKRFS-ZDUSSCGKSA-N 1 2 233.311 2.262 20 0 BEADLO CC[C@@H](C(=O)OC)[N@H+]1Cc2ccc(C)cc2C1 ZINC000361602353 387507117 /nfs/dbraw/zinc/50/71/17/387507117.db2.gz MQMBSZUOUPKRFS-ZDUSSCGKSA-N 1 2 233.311 2.262 20 0 BEADLO Cc1ccc(F)c(C[N@@H+](C)Cc2ccnn2C)c1 ZINC000355275901 387510265 /nfs/dbraw/zinc/51/02/65/387510265.db2.gz FDCHMSRLIMVCNC-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1ccc(F)c(C[N@H+](C)Cc2ccnn2C)c1 ZINC000355275901 387510272 /nfs/dbraw/zinc/51/02/72/387510272.db2.gz FDCHMSRLIMVCNC-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO C[C@H]1CCC[C@@H](NC(=O)Cc2c[nH+]cn2C)CC1 ZINC000527190811 387523242 /nfs/dbraw/zinc/52/32/42/387523242.db2.gz RLXDUDINUKYOST-NWDGAFQWSA-N 1 2 249.358 2.048 20 0 BEADLO CC(C)[N@H+](Cc1ccco1)Cc1ncccn1 ZINC000361715145 387524385 /nfs/dbraw/zinc/52/43/85/387524385.db2.gz YGLISXHXRZBYGJ-UHFFFAOYSA-N 1 2 231.299 2.480 20 0 BEADLO CC(C)[N@@H+](Cc1ccco1)Cc1ncccn1 ZINC000361715145 387524390 /nfs/dbraw/zinc/52/43/90/387524390.db2.gz YGLISXHXRZBYGJ-UHFFFAOYSA-N 1 2 231.299 2.480 20 0 BEADLO Cc1nnc(CSc2[nH+]cc3ccccn32)o1 ZINC000026371267 387527677 /nfs/dbraw/zinc/52/76/77/387527677.db2.gz LSWZEGOFRNQGKQ-UHFFFAOYSA-N 1 2 246.295 2.318 20 0 BEADLO Cc1ccnc(NCc2c[nH+]c(C)cc2C)n1 ZINC000397033419 387534471 /nfs/dbraw/zinc/53/44/71/387534471.db2.gz YVQIUCVLGUJFNE-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C[C@H]1C[C@H]1C ZINC000361785682 387535559 /nfs/dbraw/zinc/53/55/59/387535559.db2.gz HDLMCFJNQCIXKH-MWLCHTKSSA-N 1 2 218.300 2.051 20 0 BEADLO C[N@H+](CC(=O)Nc1ccccc1)CC1(F)CC1 ZINC000527218986 387539158 /nfs/dbraw/zinc/53/91/58/387539158.db2.gz GBZAPRXJMVKSPI-UHFFFAOYSA-N 1 2 236.290 2.059 20 0 BEADLO C[N@@H+](CC(=O)Nc1ccccc1)CC1(F)CC1 ZINC000527218986 387539159 /nfs/dbraw/zinc/53/91/59/387539159.db2.gz GBZAPRXJMVKSPI-UHFFFAOYSA-N 1 2 236.290 2.059 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC[C@H]2c2ccccn2)o1 ZINC000516161945 387474719 /nfs/dbraw/zinc/47/47/19/387474719.db2.gz JHHKVSSOSAQGAO-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1nnc(C[N@H+]2CCC[C@H]2c2ccccn2)o1 ZINC000516161945 387474724 /nfs/dbraw/zinc/47/47/24/387474724.db2.gz JHHKVSSOSAQGAO-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO CN1CC[N@H+](CC2(F)CC2)[C@H](c2ccccc2)C1 ZINC000527509611 387587348 /nfs/dbraw/zinc/58/73/48/387587348.db2.gz GHYIBGYRNZSNTM-AWEZNQCLSA-N 1 2 248.345 2.477 20 0 BEADLO CN1CC[N@@H+](CC2(F)CC2)[C@H](c2ccccc2)C1 ZINC000527509611 387587350 /nfs/dbraw/zinc/58/73/50/387587350.db2.gz GHYIBGYRNZSNTM-AWEZNQCLSA-N 1 2 248.345 2.477 20 0 BEADLO CCOc1ccc(C[NH+]2CC(C)(OC)C2)cc1 ZINC000362310015 387594680 /nfs/dbraw/zinc/59/46/80/387594680.db2.gz VVLHYHOVKJAOFP-UHFFFAOYSA-N 1 2 235.327 2.306 20 0 BEADLO CC[C@H]1CCCC[C@H]1C(=O)NCCc1[nH]cc[nH+]1 ZINC000355985354 387601878 /nfs/dbraw/zinc/60/18/78/387601878.db2.gz KPBCSAYBCCKGMS-NWDGAFQWSA-N 1 2 249.358 2.285 20 0 BEADLO CCC[C@](C)(CC)C(=O)NCCc1[nH]cc[nH+]1 ZINC000355994539 387603056 /nfs/dbraw/zinc/60/30/56/387603056.db2.gz VCNSFWWDXNFRRP-ZDUSSCGKSA-N 1 2 237.347 2.285 20 0 BEADLO CC(C)c1nc(N2CCC[C@](C)(O)CC2)cc[nH+]1 ZINC000376114793 387608461 /nfs/dbraw/zinc/60/84/61/387608461.db2.gz NXEPADZQWXABTN-AWEZNQCLSA-N 1 2 249.358 2.341 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2csnn2)ccn1 ZINC000527540929 387612064 /nfs/dbraw/zinc/61/20/64/387612064.db2.gz YRNXFZMVIAAZAQ-SECBINFHSA-N 1 2 234.328 2.092 20 0 BEADLO CC(C)c1nc(NCCc2ccncc2)cc[nH+]1 ZINC000356085389 387614337 /nfs/dbraw/zinc/61/43/37/387614337.db2.gz FNUHYOSNHLZYKV-UHFFFAOYSA-N 1 2 242.326 2.072 20 0 BEADLO C[C@@H](CC(C)(C)C)C(=O)NCc1[nH]cc[nH+]1 ZINC000356098241 387615828 /nfs/dbraw/zinc/61/58/28/387615828.db2.gz VQDVVEFWJCLFJS-VIFPVBQESA-N 1 2 223.320 2.098 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@H]1CCc2c1cccc2O ZINC000038011361 387570374 /nfs/dbraw/zinc/57/03/74/387570374.db2.gz BBPKRRKMNRHDGH-ZDUSSCGKSA-N 1 2 243.310 2.201 20 0 BEADLO CC(C)(C)c1nc(C[NH2+]CCF)cs1 ZINC000280596171 387573041 /nfs/dbraw/zinc/57/30/41/387573041.db2.gz BUAHKCNSFHFRIX-UHFFFAOYSA-N 1 2 216.325 2.500 20 0 BEADLO CC[C@H](NC(=O)C[C@H]1C[C@H]1C)c1[nH]cc[nH+]1 ZINC000355759696 387577204 /nfs/dbraw/zinc/57/72/04/387577204.db2.gz WEQPKJBZMCVXFG-BBBLOLIVSA-N 1 2 221.304 2.023 20 0 BEADLO Cc1c[nH+]c(CN2CCC(F)(F)[C@@H](C)C2)n1C ZINC000356242044 387631678 /nfs/dbraw/zinc/63/16/78/387631678.db2.gz DWPUJXKNAWZJDS-VIFPVBQESA-N 1 2 243.301 2.206 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)n1C ZINC000356242044 387631686 /nfs/dbraw/zinc/63/16/86/387631686.db2.gz DWPUJXKNAWZJDS-VIFPVBQESA-N 1 2 243.301 2.206 20 0 BEADLO Cc1cnc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)n1C ZINC000356242044 387631690 /nfs/dbraw/zinc/63/16/90/387631690.db2.gz DWPUJXKNAWZJDS-VIFPVBQESA-N 1 2 243.301 2.206 20 0 BEADLO C[C@H](NC(=O)CCn1cc[nH+]c1)C1CCCCC1 ZINC000356317061 387642608 /nfs/dbraw/zinc/64/26/08/387642608.db2.gz JZIDFBDDECIAGY-LBPRGKRZSA-N 1 2 249.358 2.358 20 0 BEADLO CC[C@H](Nc1nccc(C)n1)c1[nH]cc[nH+]1 ZINC000125229886 387647783 /nfs/dbraw/zinc/64/77/83/387647783.db2.gz KRMTZLJTHMJBMI-VIFPVBQESA-N 1 2 217.276 2.071 20 0 BEADLO CCC[C@H](CC)NC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000362699014 387650821 /nfs/dbraw/zinc/65/08/21/387650821.db2.gz MDZNULPWYMRCKC-JTQLQIEISA-N 1 2 237.347 2.382 20 0 BEADLO CC[N@H+](CCO)Cc1ncc(Cl)cc1Cl ZINC000305785848 387652739 /nfs/dbraw/zinc/65/27/39/387652739.db2.gz BRLPGCFVGPVVJT-UHFFFAOYSA-N 1 2 249.141 2.203 20 0 BEADLO CC[N@@H+](CCO)Cc1ncc(Cl)cc1Cl ZINC000305785848 387652743 /nfs/dbraw/zinc/65/27/43/387652743.db2.gz BRLPGCFVGPVVJT-UHFFFAOYSA-N 1 2 249.141 2.203 20 0 BEADLO CC(C)CC(=O)N1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000125578489 387662013 /nfs/dbraw/zinc/66/20/13/387662013.db2.gz SAHZZSJOYLQGIY-STQMWFEESA-N 1 2 249.358 2.339 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)NC[C@H](C)Cn1cc[nH+]c1 ZINC000362821081 387662371 /nfs/dbraw/zinc/66/23/71/387662371.db2.gz UWUBHNOLHWKVFF-YNEHKIRRSA-N 1 2 249.358 2.072 20 0 BEADLO Cc1cc(C[NH2+]C2(C(F)F)CC2)ccn1 ZINC000527704454 387668050 /nfs/dbraw/zinc/66/80/50/387668050.db2.gz PAORHMAIRGUVIX-UHFFFAOYSA-N 1 2 212.243 2.277 20 0 BEADLO C[C@@H]([NH+]=c1[nH]c2ccc(F)cc2n1C)C1CC1 ZINC000431029278 387669748 /nfs/dbraw/zinc/66/97/48/387669748.db2.gz ZZAJSWUARXQJEA-MRVPVSSYSA-N 1 2 233.290 2.345 20 0 BEADLO C[C@H]1C[C@@H]1C[NH+]=c1[nH]c2ccc(F)cc2n1C ZINC000431015463 387670071 /nfs/dbraw/zinc/67/00/71/387670071.db2.gz PBRWSIBXQPQIKM-DTWKUNHWSA-N 1 2 233.290 2.202 20 0 BEADLO CCc1nnc(C[NH2+]Cc2ccnc(C)c2)s1 ZINC000527713149 387670058 /nfs/dbraw/zinc/67/00/58/387670058.db2.gz WNRDSHFXEOGFHE-UHFFFAOYSA-N 1 2 248.355 2.094 20 0 BEADLO COc1ncccc1C[N@H+](C)Cc1ccoc1 ZINC000362921568 387671810 /nfs/dbraw/zinc/67/18/10/387671810.db2.gz GKZINBDHBVFILC-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1ncccc1C[N@@H+](C)Cc1ccoc1 ZINC000362921568 387671813 /nfs/dbraw/zinc/67/18/13/387671813.db2.gz GKZINBDHBVFILC-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO CCN(CC)C(=O)N[C@@H](C)c1[nH+]ccn1CC ZINC000451932947 387681354 /nfs/dbraw/zinc/68/13/54/387681354.db2.gz OFBKTMPRKOZMPF-JTQLQIEISA-N 1 2 238.335 2.015 20 0 BEADLO C[C@H]([NH2+][C@H]1CCCSC1)C(=O)OC(C)(C)C ZINC000126456126 387682953 /nfs/dbraw/zinc/68/29/53/387682953.db2.gz NOHWSLQSQZDZAU-UWVGGRQHSA-N 1 2 245.388 2.202 20 0 BEADLO CC[C@@H](F)CN1CC[N@H+](C[C@@H](F)CC)C[C@@H]1C ZINC000440768663 387690143 /nfs/dbraw/zinc/69/01/43/387690143.db2.gz ZXLIGMBOLTUARW-RWMBFGLXSA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@@H](F)CN1CC[N@@H+](C[C@@H](F)CC)C[C@@H]1C ZINC000440768663 387690147 /nfs/dbraw/zinc/69/01/47/387690147.db2.gz ZXLIGMBOLTUARW-RWMBFGLXSA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCN(C[C@@H](F)CC)C[C@@H]1C ZINC000440768663 387690149 /nfs/dbraw/zinc/69/01/49/387690149.db2.gz ZXLIGMBOLTUARW-RWMBFGLXSA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCN(C[C@@H](F)CC)C[C@@H]1C ZINC000440768663 387690153 /nfs/dbraw/zinc/69/01/53/387690153.db2.gz ZXLIGMBOLTUARW-RWMBFGLXSA-N 1 2 248.361 2.489 20 0 BEADLO C[C@H]1CN(c2[nH+]ccc3ccccc32)CCO1 ZINC000527834312 387747759 /nfs/dbraw/zinc/74/77/59/387747759.db2.gz NUHGQYIOEFZYGU-NSHDSACASA-N 1 2 228.295 2.460 20 0 BEADLO Cc1ccoc1C(=O)N[C@@H](c1[nH]cc[nH+]1)C(C)C ZINC000431411369 387708940 /nfs/dbraw/zinc/70/89/40/387708940.db2.gz YOIJMABJYCFSOI-SNVBAGLBSA-N 1 2 247.298 2.438 20 0 BEADLO COC(=O)c1coc(COc2cc[nH+]cc2)c1 ZINC000431503903 387713390 /nfs/dbraw/zinc/71/33/90/387713390.db2.gz CNXRSSCIKKLBQD-UHFFFAOYSA-N 1 2 233.223 2.040 20 0 BEADLO Cc1ccc(C(N)=O)cc1Oc1cc[nH+]cc1 ZINC000115316643 387718570 /nfs/dbraw/zinc/71/85/70/387718570.db2.gz IDTLVOCREJKTCI-UHFFFAOYSA-N 1 2 228.251 2.281 20 0 BEADLO COc1ccc[nH+]c1N1C[C@@H]2CCC[C@H]2C1 ZINC000527919787 387789899 /nfs/dbraw/zinc/78/98/99/387789899.db2.gz KGLPVTGZUJUVSP-QWRGUYRKSA-N 1 2 218.300 2.327 20 0 BEADLO CCc1ccc([C@H](C)[NH2+]Cc2cnn(CC)n2)o1 ZINC000527922023 387790104 /nfs/dbraw/zinc/79/01/04/387790104.db2.gz RNNGDNCVTRXIAX-JTQLQIEISA-N 1 2 248.330 2.304 20 0 BEADLO Cc1cn2c([nH+]1)CN(Cc1ccsc1)CC2 ZINC000378630586 387790760 /nfs/dbraw/zinc/79/07/60/387790760.db2.gz FXEFPEXXXUUWRO-UHFFFAOYSA-N 1 2 233.340 2.269 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CCC[C@@H]2OCC[C@@H]21 ZINC000527925608 387791491 /nfs/dbraw/zinc/79/14/91/387791491.db2.gz MOTCGLSXOGRHOH-UTUOFQBUSA-N 1 2 248.326 2.460 20 0 BEADLO COc1ccc[nH+]c1N1CCC2(CCC2)C1 ZINC000527922947 387791815 /nfs/dbraw/zinc/79/18/15/387791815.db2.gz YUNAWGZTWGTTGA-UHFFFAOYSA-N 1 2 218.300 2.471 20 0 BEADLO CN(CC1(CO)CC1)c1[nH+]ccc2ccccc21 ZINC000527981751 387799792 /nfs/dbraw/zinc/79/97/92/387799792.db2.gz VKTNQKLFYMLTJG-UHFFFAOYSA-N 1 2 242.322 2.444 20 0 BEADLO C[N@@H+](Cc1ccccc1F)Cc1cccnc1N ZINC000052728610 387806860 /nfs/dbraw/zinc/80/68/60/387806860.db2.gz XCLFNVQPSVRRPQ-UHFFFAOYSA-N 1 2 245.301 2.435 20 0 BEADLO C[N@H+](Cc1ccccc1F)Cc1cccnc1N ZINC000052728610 387806864 /nfs/dbraw/zinc/80/68/64/387806864.db2.gz XCLFNVQPSVRRPQ-UHFFFAOYSA-N 1 2 245.301 2.435 20 0 BEADLO c1cn2c([nH+]1)[C@@H](Nc1cccc3c1OCC3)CC2 ZINC000527960273 387809055 /nfs/dbraw/zinc/80/90/55/387809055.db2.gz XQLNTPYUHYMQMU-LBPRGKRZSA-N 1 2 241.294 2.375 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1CCC(C)(C)O1 ZINC000527968275 387810861 /nfs/dbraw/zinc/81/08/61/387810861.db2.gz QUCYVBXPURAXGO-JTQLQIEISA-N 1 2 236.315 2.460 20 0 BEADLO COc1ccc[nH+]c1NC[C@H](O)c1ccc(C)o1 ZINC000527903147 387760204 /nfs/dbraw/zinc/76/02/04/387760204.db2.gz QUHHKLYKPSRUGL-JTQLQIEISA-N 1 2 248.282 2.137 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ncccc1F)c1ccncn1 ZINC000528038670 387820052 /nfs/dbraw/zinc/82/00/52/387820052.db2.gz WVJKDPHDCORZQS-UWVGGRQHSA-N 1 2 246.289 2.423 20 0 BEADLO OCC1(CNc2cccc[nH+]2)CC2(CCC2)C1 ZINC000432831182 387831337 /nfs/dbraw/zinc/83/13/37/387831337.db2.gz SZTIHJQVXSECIX-UHFFFAOYSA-N 1 2 232.327 2.436 20 0 BEADLO Cc1nc(NCC[C@@H]2CC=CCC2)cc[nH+]1 ZINC000528182382 387873392 /nfs/dbraw/zinc/87/33/92/387873392.db2.gz DWFCBCGPSVZLOR-GFCCVEGCSA-N 1 2 217.316 2.365 20 0 BEADLO O[C@@H]1C[C@@H]2CN(c3[nH+]ccc4ccccc43)C[C@@H]12 ZINC000528057383 387839830 /nfs/dbraw/zinc/83/98/30/387839830.db2.gz HFZDWJZDFPUIPP-MRVWCRGKSA-N 1 2 240.306 2.052 20 0 BEADLO CC[C@H](NC(=O)[C@@H]1C[C@@H]1C(C)C)c1[nH]cc[nH+]1 ZINC000442814116 387846600 /nfs/dbraw/zinc/84/66/00/387846600.db2.gz UVJCBFRTVFHUSZ-MXWKQRLJSA-N 1 2 235.331 2.269 20 0 BEADLO C1=CCC(CNc2cc(NC3CC3)nc[nH+]2)C1 ZINC000528112253 387847645 /nfs/dbraw/zinc/84/76/45/387847645.db2.gz CKEYGSBDZHXCCX-UHFFFAOYSA-N 1 2 230.315 2.429 20 0 BEADLO C1=CCC(CNc2cc(NC3CC3)[nH+]cn2)C1 ZINC000528112253 387847648 /nfs/dbraw/zinc/84/76/48/387847648.db2.gz CKEYGSBDZHXCCX-UHFFFAOYSA-N 1 2 230.315 2.429 20 0 BEADLO FC1(F)CC[N@H+](CCC[C@H]2CCOC2)C1 ZINC000645847553 387857706 /nfs/dbraw/zinc/85/77/06/387857706.db2.gz DJSBHJVYVFJHEE-JTQLQIEISA-N 1 2 219.275 2.144 20 0 BEADLO FC1(F)CC[N@@H+](CCC[C@H]2CCOC2)C1 ZINC000645847553 387857710 /nfs/dbraw/zinc/85/77/10/387857710.db2.gz DJSBHJVYVFJHEE-JTQLQIEISA-N 1 2 219.275 2.144 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@@H]1C[C@H]1CC(C)C ZINC000452568466 387859859 /nfs/dbraw/zinc/85/98/59/387859859.db2.gz BKUNWBIJCHKZNZ-VXGBXAGGSA-N 1 2 249.358 2.201 20 0 BEADLO CC(C)n1c[nH+]cc1CN[C@H](C)c1ccon1 ZINC000424170659 387861860 /nfs/dbraw/zinc/86/18/60/387861860.db2.gz KJXDLIQJNVSRQI-SNVBAGLBSA-N 1 2 234.303 2.303 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)c1ccc(C)cc1 ZINC000452571274 387862452 /nfs/dbraw/zinc/86/24/52/387862452.db2.gz CCKYZVNLANLGMW-UHFFFAOYSA-N 1 2 243.310 2.141 20 0 BEADLO CC[N@@H+]1Cc2ccccc2C[C@H]1c1nnc(C)o1 ZINC000193865281 387867248 /nfs/dbraw/zinc/86/72/48/387867248.db2.gz JQMQMUITJWEOMK-ZDUSSCGKSA-N 1 2 243.310 2.497 20 0 BEADLO CC[N@H+]1Cc2ccccc2C[C@H]1c1nnc(C)o1 ZINC000193865281 387867252 /nfs/dbraw/zinc/86/72/52/387867252.db2.gz JQMQMUITJWEOMK-ZDUSSCGKSA-N 1 2 243.310 2.497 20 0 BEADLO CC(C)O[C@@]1(C)C[C@H]1Nc1cccc[nH+]1 ZINC000528203085 387869778 /nfs/dbraw/zinc/86/97/78/387869778.db2.gz LJKAZBPNKDAMRB-PWSUYJOCSA-N 1 2 206.289 2.450 20 0 BEADLO Cc1nc(N2CCC(F)(F)C[C@@H]2C)cc[nH+]1 ZINC000528207999 387871473 /nfs/dbraw/zinc/87/14/73/387871473.db2.gz NECRVZBZJKKXSL-QMMMGPOBSA-N 1 2 227.258 2.409 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CCC[C@@H]1CCO ZINC000527970348 387814432 /nfs/dbraw/zinc/81/44/32/387814432.db2.gz YEKFKIRXEABCPE-MNOVXSKESA-N 1 2 236.315 2.053 20 0 BEADLO FC(F)C1CC[NH+](Cc2cocn2)CC1 ZINC000432755253 387815170 /nfs/dbraw/zinc/81/51/70/387815170.db2.gz SICXGLFJIIQINS-UHFFFAOYSA-N 1 2 216.231 2.152 20 0 BEADLO CCc1[nH]nc(NCc2c[nH+]cn2C(C)C)c1C ZINC000424155126 387816207 /nfs/dbraw/zinc/81/62/07/387816207.db2.gz NLXGKBAFGKVNCL-UHFFFAOYSA-N 1 2 247.346 2.092 20 0 BEADLO COc1ccc[nH+]c1N1CCO[C@@H](C2CCC2)C1 ZINC000528033344 387817157 /nfs/dbraw/zinc/81/71/57/387817157.db2.gz AYEARGWTJYUWPA-CYBMUJFWSA-N 1 2 248.326 2.096 20 0 BEADLO C/C(Cl)=C\C[N@H+]1C[C@H](C)OC[C@@H]1C ZINC000528339099 387895209 /nfs/dbraw/zinc/89/52/09/387895209.db2.gz IWTUYYPVJCXWBG-DQRKKKBRSA-N 1 2 203.713 2.238 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1C[C@H](C)OC[C@@H]1C ZINC000528339099 387895213 /nfs/dbraw/zinc/89/52/13/387895213.db2.gz IWTUYYPVJCXWBG-DQRKKKBRSA-N 1 2 203.713 2.238 20 0 BEADLO COC[C@@H](Nc1ccc(C)[nH+]c1)C(C)C ZINC000154259744 387898254 /nfs/dbraw/zinc/89/82/54/387898254.db2.gz NMJJQMPWJRBILP-GFCCVEGCSA-N 1 2 208.305 2.473 20 0 BEADLO CC(=O)NCCC[N@@H+](C)c1cccc(C)c1C ZINC000195028336 387901600 /nfs/dbraw/zinc/90/16/00/387901600.db2.gz CINPEHUUBKWBPA-UHFFFAOYSA-N 1 2 234.343 2.266 20 0 BEADLO CC(=O)NCCC[N@H+](C)c1cccc(C)c1C ZINC000195028336 387901605 /nfs/dbraw/zinc/90/16/05/387901605.db2.gz CINPEHUUBKWBPA-UHFFFAOYSA-N 1 2 234.343 2.266 20 0 BEADLO CSCC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000195174925 387907102 /nfs/dbraw/zinc/90/71/02/387907102.db2.gz NZPZJTVKORCRPY-UHFFFAOYSA-N 1 2 247.323 2.378 20 0 BEADLO Cc1cn[nH]c1C[NH2+][C@H]1C[C@@]1(F)c1ccccc1 ZINC000424189458 387910558 /nfs/dbraw/zinc/91/05/58/387910558.db2.gz DQFXZSQAQMZLIN-UONOGXRCSA-N 1 2 245.301 2.445 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@H]1C[C@@]1(F)c1ccccc1 ZINC000424189458 387910561 /nfs/dbraw/zinc/91/05/61/387910561.db2.gz DQFXZSQAQMZLIN-UONOGXRCSA-N 1 2 245.301 2.445 20 0 BEADLO FC(F)(F)C[C@H]1CC[N@H+](Cc2ncccn2)C1 ZINC000444706262 387912825 /nfs/dbraw/zinc/91/28/25/387912825.db2.gz WCBFZGLFEYFZMO-SECBINFHSA-N 1 2 245.248 2.251 20 0 BEADLO FC(F)(F)C[C@H]1CC[N@@H+](Cc2ncccn2)C1 ZINC000444706262 387912829 /nfs/dbraw/zinc/91/28/29/387912829.db2.gz WCBFZGLFEYFZMO-SECBINFHSA-N 1 2 245.248 2.251 20 0 BEADLO Cc1cc(NC(=O)c2cc(F)ccc2O)cc[nH+]1 ZINC000080001065 387920106 /nfs/dbraw/zinc/92/01/06/387920106.db2.gz SWHXGKHTRWLBNO-UHFFFAOYSA-N 1 2 246.241 2.487 20 0 BEADLO C[N@H+](Cc1ncc(Cl)s1)CC1(CO)CC1 ZINC000438337205 387923358 /nfs/dbraw/zinc/92/33/58/387923358.db2.gz FBHOOWBNHHWKNB-UHFFFAOYSA-N 1 2 246.763 2.001 20 0 BEADLO C[N@@H+](Cc1ncc(Cl)s1)CC1(CO)CC1 ZINC000438337205 387923360 /nfs/dbraw/zinc/92/33/60/387923360.db2.gz FBHOOWBNHHWKNB-UHFFFAOYSA-N 1 2 246.763 2.001 20 0 BEADLO Oc1cccc(C[N@@H+]2CCc3ncsc3C2)c1 ZINC000438358153 387927728 /nfs/dbraw/zinc/92/77/28/387927728.db2.gz FNZUKQBKORDVIF-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO Oc1cccc(C[N@H+]2CCc3ncsc3C2)c1 ZINC000438358153 387927733 /nfs/dbraw/zinc/92/77/33/387927733.db2.gz FNZUKQBKORDVIF-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nccs2)[C@H](C)[C@H](C)O1 ZINC000438359279 387928758 /nfs/dbraw/zinc/92/87/58/387928758.db2.gz PWNLTDVLWSVYAD-BBBLOLIVSA-N 1 2 226.345 2.141 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nccs2)[C@H](C)[C@H](C)O1 ZINC000438359279 387928762 /nfs/dbraw/zinc/92/87/62/387928762.db2.gz PWNLTDVLWSVYAD-BBBLOLIVSA-N 1 2 226.345 2.141 20 0 BEADLO CC(C)C[C@@H](CO)Nc1[nH+]c2ccccc2n1C ZINC000079045330 387938287 /nfs/dbraw/zinc/93/82/87/387938287.db2.gz AMXVZYHJVPPIJX-NSHDSACASA-N 1 2 247.342 2.392 20 0 BEADLO C[C@H]1CCCN(c2cc(NC3CC3)[nH+]cn2)C1 ZINC000244202195 387941821 /nfs/dbraw/zinc/94/18/21/387941821.db2.gz VPIXDRQHEIOFOB-JTQLQIEISA-N 1 2 232.331 2.287 20 0 BEADLO C[C@H]1CCCN(c2cc(NC3CC3)nc[nH+]2)C1 ZINC000244202195 387941828 /nfs/dbraw/zinc/94/18/28/387941828.db2.gz VPIXDRQHEIOFOB-JTQLQIEISA-N 1 2 232.331 2.287 20 0 BEADLO CCOC(=O)C[N@@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000245422723 387946284 /nfs/dbraw/zinc/94/62/84/387946284.db2.gz JBRBGILTPHFWDM-RISCZKNCSA-N 1 2 233.311 2.243 20 0 BEADLO CCOC(=O)C[N@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000245422723 387946287 /nfs/dbraw/zinc/94/62/87/387946287.db2.gz JBRBGILTPHFWDM-RISCZKNCSA-N 1 2 233.311 2.243 20 0 BEADLO COC(=O)[C@H](C)[N@@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000245431314 387946589 /nfs/dbraw/zinc/94/65/89/387946589.db2.gz NYMYSHKKOFDPQR-NTZNESFSSA-N 1 2 233.311 2.241 20 0 BEADLO COC(=O)[C@H](C)[N@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000245431314 387946593 /nfs/dbraw/zinc/94/65/93/387946593.db2.gz NYMYSHKKOFDPQR-NTZNESFSSA-N 1 2 233.311 2.241 20 0 BEADLO Cc1cc(NC(=O)N2[C@@H](C)C[C@@H]2C)c(C)c[nH+]1 ZINC000548090027 387978662 /nfs/dbraw/zinc/97/86/62/387978662.db2.gz LNGSHUUPZLBORA-QWRGUYRKSA-N 1 2 233.315 2.135 20 0 BEADLO CC[C@@H]([NH2+][C@H](C)C(F)(F)F)[C@@H]1CCOC1 ZINC000424334659 387979049 /nfs/dbraw/zinc/97/90/49/387979049.db2.gz YXRRZJRIKGWTKO-IWSPIJDZSA-N 1 2 225.254 2.342 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@@H](C)[C@H]2C)o1 ZINC000245767353 387981807 /nfs/dbraw/zinc/98/18/07/387981807.db2.gz RCIYZWGFPWZQQP-MNOVXSKESA-N 1 2 223.316 2.451 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@@H](C)[C@H]2C)o1 ZINC000245767353 387981813 /nfs/dbraw/zinc/98/18/13/387981813.db2.gz RCIYZWGFPWZQQP-MNOVXSKESA-N 1 2 223.316 2.451 20 0 BEADLO CC[C@H](C)[NH2+][C@H](c1cn[nH]n1)c1ccc(F)cc1 ZINC000453056856 387974305 /nfs/dbraw/zinc/97/43/05/387974305.db2.gz LVRXTHCLZXFWMW-ZANVPECISA-N 1 2 248.305 2.421 20 0 BEADLO CC[C@H](C)[NH2+][C@H](c1c[nH]nn1)c1ccc(F)cc1 ZINC000453056856 387974308 /nfs/dbraw/zinc/97/43/08/387974308.db2.gz LVRXTHCLZXFWMW-ZANVPECISA-N 1 2 248.305 2.421 20 0 BEADLO Cc1ncsc1C[N@H+]1CCO[C@H](C)[C@H]1C ZINC000245782579 387983159 /nfs/dbraw/zinc/98/31/59/387983159.db2.gz UMMOSZIQGZJNLO-NXEZZACHSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ncsc1C[N@@H+]1CCO[C@H](C)[C@H]1C ZINC000245782579 387983160 /nfs/dbraw/zinc/98/31/60/387983160.db2.gz UMMOSZIQGZJNLO-NXEZZACHSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCS[C@H](C)[C@H]1C ZINC000245768310 387983269 /nfs/dbraw/zinc/98/32/69/387983269.db2.gz RFPVCHKRLZJQPS-NXEZZACHSA-N 1 2 225.361 2.044 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCS[C@H](C)[C@H]1C ZINC000245768310 387983270 /nfs/dbraw/zinc/98/32/70/387983270.db2.gz RFPVCHKRLZJQPS-NXEZZACHSA-N 1 2 225.361 2.044 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC[C@@H]1CCC[C@H]1C ZINC000439431110 387997903 /nfs/dbraw/zinc/99/79/03/387997903.db2.gz LPJKKGXOQFWIER-PWSUYJOCSA-N 1 2 247.342 2.370 20 0 BEADLO Cc1nc(C[N@H+](C)CC2CCCCC2)no1 ZINC000045915003 388004552 /nfs/dbraw/zinc/00/45/52/388004552.db2.gz QJEPWIAVAUYOPJ-UHFFFAOYSA-N 1 2 223.320 2.390 20 0 BEADLO Cc1nc(C[N@@H+](C)CC2CCCCC2)no1 ZINC000045915003 388004557 /nfs/dbraw/zinc/00/45/57/388004557.db2.gz QJEPWIAVAUYOPJ-UHFFFAOYSA-N 1 2 223.320 2.390 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)Nc1c[nH]c2ccccc12 ZINC001645450300 1172669484 /nfs/dbraw/zinc/66/94/84/1172669484.db2.gz HAFWZTBFIXIENZ-UHFFFAOYSA-N 1 2 240.266 2.072 20 0 BEADLO C[C@H]1C[N@H+](Cc2ncnn2C)[C@H]1c1ccccc1 ZINC000246108648 388011633 /nfs/dbraw/zinc/01/16/33/388011633.db2.gz BUZVLPAHPMFRHG-SMDDNHRTSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ncnn2C)[C@H]1c1ccccc1 ZINC000246108648 388011635 /nfs/dbraw/zinc/01/16/35/388011635.db2.gz BUZVLPAHPMFRHG-SMDDNHRTSA-N 1 2 242.326 2.008 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC1(C(F)F)CC1 ZINC000453211651 388011899 /nfs/dbraw/zinc/01/18/99/388011899.db2.gz LAWWSUGTFQMKEV-MRVPVSSYSA-N 1 2 229.274 2.351 20 0 BEADLO Cc1csc(C[N@H+]2C[C@@H](C)OC[C@H]2C)n1 ZINC000246171550 388017154 /nfs/dbraw/zinc/01/71/54/388017154.db2.gz FPCJABFDCLMOBO-NXEZZACHSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1csc(C[N@@H+]2C[C@@H](C)OC[C@H]2C)n1 ZINC000246171550 388017159 /nfs/dbraw/zinc/01/71/59/388017159.db2.gz FPCJABFDCLMOBO-NXEZZACHSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ccc(NC(=O)CCOCC2CC2)c(C)[nH+]1 ZINC000446434739 388020445 /nfs/dbraw/zinc/02/04/45/388020445.db2.gz NYGDAQCCBCDYPR-UHFFFAOYSA-N 1 2 248.326 2.454 20 0 BEADLO CC[C@H](F)C[N@@H+]1CC[S@](=O)C(CC)(CC)C1 ZINC000440497535 388044398 /nfs/dbraw/zinc/04/43/98/388044398.db2.gz HUXZXRHBNGUPBA-ZBEGNZNMSA-N 1 2 249.395 2.358 20 0 BEADLO CC[C@H](F)C[N@H+]1CC[S@](=O)C(CC)(CC)C1 ZINC000440497535 388044402 /nfs/dbraw/zinc/04/44/02/388044402.db2.gz HUXZXRHBNGUPBA-ZBEGNZNMSA-N 1 2 249.395 2.358 20 0 BEADLO Cc1nccnc1[C@H](C)[NH2+][C@H](C)c1ccon1 ZINC000446890301 388043122 /nfs/dbraw/zinc/04/31/22/388043122.db2.gz IYIUSNLMYMBWFL-SCZZXKLOSA-N 1 2 232.287 2.185 20 0 BEADLO CC[C@@H]([NH2+][C@H](C)c1cnn(C)c1)C(F)F ZINC000453251413 388026518 /nfs/dbraw/zinc/02/65/18/388026518.db2.gz TWFRCUVSSGWPRO-VXNVDRBHSA-N 1 2 217.263 2.114 20 0 BEADLO CC[C@H]([NH2+][C@@H](C)c1cnn(C)c1)C(F)F ZINC000453251411 388026674 /nfs/dbraw/zinc/02/66/74/388026674.db2.gz TWFRCUVSSGWPRO-CBAPKCEASA-N 1 2 217.263 2.114 20 0 BEADLO Cc1c(Cl)c(C[N@@H+](C)CC(C)C)nn1C ZINC000421332761 388027023 /nfs/dbraw/zinc/02/70/23/388027023.db2.gz WBQBSRYBSUOQQL-UHFFFAOYSA-N 1 2 229.755 2.470 20 0 BEADLO Cc1c(Cl)c(C[N@H+](C)CC(C)C)nn1C ZINC000421332761 388027028 /nfs/dbraw/zinc/02/70/28/388027028.db2.gz WBQBSRYBSUOQQL-UHFFFAOYSA-N 1 2 229.755 2.470 20 0 BEADLO CC(C)CCn1c2ccccc2[nH+]c1NCCO ZINC000006855613 388031580 /nfs/dbraw/zinc/03/15/80/388031580.db2.gz VOKRUOQIUMIHIM-UHFFFAOYSA-N 1 2 247.342 2.487 20 0 BEADLO CC[C@H](F)C[N@@H+]1CC[C@@H](C)C[C@H]1C(=O)OC ZINC000440533340 388052236 /nfs/dbraw/zinc/05/22/36/388052236.db2.gz QMWUGLOKWBALAP-VWYCJHECSA-N 1 2 231.311 2.008 20 0 BEADLO CC[C@H](F)C[N@H+]1CC[C@@H](C)C[C@H]1C(=O)OC ZINC000440533340 388052239 /nfs/dbraw/zinc/05/22/39/388052239.db2.gz QMWUGLOKWBALAP-VWYCJHECSA-N 1 2 231.311 2.008 20 0 BEADLO CCOC(=O)C[N@H+](C[C@@H](F)CC)C1CCC1 ZINC000440532406 388053728 /nfs/dbraw/zinc/05/37/28/388053728.db2.gz OKDPZBSFDJKIPU-JTQLQIEISA-N 1 2 231.311 2.152 20 0 BEADLO CCOC(=O)C[N@@H+](C[C@@H](F)CC)C1CCC1 ZINC000440532406 388053732 /nfs/dbraw/zinc/05/37/32/388053732.db2.gz OKDPZBSFDJKIPU-JTQLQIEISA-N 1 2 231.311 2.152 20 0 BEADLO CC[C@H](F)CN1CC[NH+](Cc2ccco2)CC1 ZINC000440697126 388068394 /nfs/dbraw/zinc/06/83/94/388068394.db2.gz LFNCVBRGECQZMA-LBPRGKRZSA-N 1 2 240.322 2.145 20 0 BEADLO CC[C@H](F)C[NH+]1CCN(Cc2ccco2)CC1 ZINC000440697126 388068397 /nfs/dbraw/zinc/06/83/97/388068397.db2.gz LFNCVBRGECQZMA-LBPRGKRZSA-N 1 2 240.322 2.145 20 0 BEADLO CCC[N@H+](CC(F)F)CC1(CC(=O)OC)CC1 ZINC000440704034 388070863 /nfs/dbraw/zinc/07/08/63/388070863.db2.gz UGUPKGAQLJHUPS-UHFFFAOYSA-N 1 2 249.301 2.307 20 0 BEADLO CCC[N@@H+](CC(F)F)CC1(CC(=O)OC)CC1 ZINC000440704034 388070866 /nfs/dbraw/zinc/07/08/66/388070866.db2.gz UGUPKGAQLJHUPS-UHFFFAOYSA-N 1 2 249.301 2.307 20 0 BEADLO CC[C@@H](F)C[NH+]1CCC(c2ccn[nH]2)CC1 ZINC000440701673 388071585 /nfs/dbraw/zinc/07/15/85/388071585.db2.gz JJIWCOBYEPJOBR-LLVKDONJSA-N 1 2 225.311 2.337 20 0 BEADLO CC(C)C[N@H+](Cc1cnn(C)c1)Cc1cocn1 ZINC000453607588 388091275 /nfs/dbraw/zinc/09/12/75/388091275.db2.gz GMXFHJMWDZXWFP-UHFFFAOYSA-N 1 2 248.330 2.066 20 0 BEADLO CC(C)C[N@@H+](Cc1cnn(C)c1)Cc1cocn1 ZINC000453607588 388091278 /nfs/dbraw/zinc/09/12/78/388091278.db2.gz GMXFHJMWDZXWFP-UHFFFAOYSA-N 1 2 248.330 2.066 20 0 BEADLO CC[C@]1(C(C)C)C[C@H]1[NH2+]Cc1ccn[nH]1 ZINC000453605570 388091444 /nfs/dbraw/zinc/09/14/44/388091444.db2.gz CXWQIAOQADIFEU-VXGBXAGGSA-N 1 2 207.321 2.324 20 0 BEADLO CCO[C@H]1C[C@@H]([NH2+]Cc2ccn[nH]2)C12CCCC2 ZINC000085680482 388094571 /nfs/dbraw/zinc/09/45/71/388094571.db2.gz KKCKLJCBISAYFG-OLZOCXBDSA-N 1 2 249.358 2.237 20 0 BEADLO CC[C@@H](CSC)Nc1cc[nH+]c(C)n1 ZINC000162134231 388115898 /nfs/dbraw/zinc/11/58/98/388115898.db2.gz FOFGQDXSWLLGBB-VIFPVBQESA-N 1 2 211.334 2.339 20 0 BEADLO Clc1ncc(C[N@@H+]2CCCOCC2)s1 ZINC000086776841 388108754 /nfs/dbraw/zinc/10/87/54/388108754.db2.gz AXLLOYIZJBLVSC-UHFFFAOYSA-N 1 2 232.736 2.019 20 0 BEADLO Clc1ncc(C[N@H+]2CCCOCC2)s1 ZINC000086776841 388108756 /nfs/dbraw/zinc/10/87/56/388108756.db2.gz AXLLOYIZJBLVSC-UHFFFAOYSA-N 1 2 232.736 2.019 20 0 BEADLO CC[C@@H](F)C[N@H+]([C@@H](C)C(=O)OC)C1CCC1 ZINC000440522107 388048649 /nfs/dbraw/zinc/04/86/49/388048649.db2.gz YORQYIAAIXMEEZ-VHSXEESVSA-N 1 2 231.311 2.151 20 0 BEADLO CC[C@@H](F)C[N@@H+]([C@@H](C)C(=O)OC)C1CCC1 ZINC000440522107 388048651 /nfs/dbraw/zinc/04/86/51/388048651.db2.gz YORQYIAAIXMEEZ-VHSXEESVSA-N 1 2 231.311 2.151 20 0 BEADLO CC[C@H](F)C[N@H+]([C@@H](C)C(=O)OC)C1CCC1 ZINC000440522106 388049210 /nfs/dbraw/zinc/04/92/10/388049210.db2.gz YORQYIAAIXMEEZ-UWVGGRQHSA-N 1 2 231.311 2.151 20 0 BEADLO CC[C@H](F)C[N@@H+]([C@@H](C)C(=O)OC)C1CCC1 ZINC000440522106 388049213 /nfs/dbraw/zinc/04/92/13/388049213.db2.gz YORQYIAAIXMEEZ-UWVGGRQHSA-N 1 2 231.311 2.151 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCN(C)[C@H](C(C)C)C1 ZINC000440521714 388050211 /nfs/dbraw/zinc/05/02/11/388050211.db2.gz XZWUEWPBJPZHAG-NEPJUHHUSA-N 1 2 216.344 2.007 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCN(C)[C@H](C(C)C)C1 ZINC000440521714 388050214 /nfs/dbraw/zinc/05/02/14/388050214.db2.gz XZWUEWPBJPZHAG-NEPJUHHUSA-N 1 2 216.344 2.007 20 0 BEADLO CC[C@H](F)C[N@@H+]1CCC[C@H](c2n[nH]c(C)n2)C1 ZINC000440518095 388050807 /nfs/dbraw/zinc/05/08/07/388050807.db2.gz JHJJCJYEMDMSAI-QWRGUYRKSA-N 1 2 240.326 2.041 20 0 BEADLO CC[C@H](F)C[N@H+]1CCC[C@H](c2n[nH]c(C)n2)C1 ZINC000440518095 388050811 /nfs/dbraw/zinc/05/08/11/388050811.db2.gz JHJJCJYEMDMSAI-QWRGUYRKSA-N 1 2 240.326 2.041 20 0 BEADLO CC/C=C/CNC(=O)NCc1c[nH+]c(C)cc1C ZINC000455316551 388156007 /nfs/dbraw/zinc/15/60/07/388156007.db2.gz DMMNXYWIFYCDGQ-AATRIKPKSA-N 1 2 247.342 2.464 20 0 BEADLO CCc1nocc1C[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000646153345 388157249 /nfs/dbraw/zinc/15/72/49/388157249.db2.gz IRMSVPCHYQJJIP-KOLCDFICSA-N 1 2 226.295 2.417 20 0 BEADLO CCc1nocc1C[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000646153345 388157250 /nfs/dbraw/zinc/15/72/50/388157250.db2.gz IRMSVPCHYQJJIP-KOLCDFICSA-N 1 2 226.295 2.417 20 0 BEADLO Cc1nocc1C[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000646153312 388157437 /nfs/dbraw/zinc/15/74/37/388157437.db2.gz CXYLAMKBAVHIAN-LDYMZIIASA-N 1 2 212.268 2.163 20 0 BEADLO Cc1nocc1C[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000646153312 388157440 /nfs/dbraw/zinc/15/74/40/388157440.db2.gz CXYLAMKBAVHIAN-LDYMZIIASA-N 1 2 212.268 2.163 20 0 BEADLO F[C@H]1CC[N@H+](Cc2[nH]nc3ccccc32)C1 ZINC000648720666 388158051 /nfs/dbraw/zinc/15/80/51/388158051.db2.gz LQBYQDWQBXTHKT-VIFPVBQESA-N 1 2 219.263 2.107 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2[nH]nc3ccccc32)C1 ZINC000648720666 388158052 /nfs/dbraw/zinc/15/80/52/388158052.db2.gz LQBYQDWQBXTHKT-VIFPVBQESA-N 1 2 219.263 2.107 20 0 BEADLO F[C@H]1CC[N@H+](Cc2n[nH]c3ccccc32)C1 ZINC000648720666 388158054 /nfs/dbraw/zinc/15/80/54/388158054.db2.gz LQBYQDWQBXTHKT-VIFPVBQESA-N 1 2 219.263 2.107 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2n[nH]c3ccccc32)C1 ZINC000648720666 388158056 /nfs/dbraw/zinc/15/80/56/388158056.db2.gz LQBYQDWQBXTHKT-VIFPVBQESA-N 1 2 219.263 2.107 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)C1(C2CCC2)CCC1 ZINC000455434196 388159823 /nfs/dbraw/zinc/15/98/23/388159823.db2.gz OJGMZGGEQKNIFF-UHFFFAOYSA-N 1 2 247.342 2.007 20 0 BEADLO CCc1ccc(C[NH2+]C(CF)CF)cn1 ZINC000449379692 388187700 /nfs/dbraw/zinc/18/77/00/388187700.db2.gz JOOXLJOLSIYMKU-UHFFFAOYSA-N 1 2 214.259 2.041 20 0 BEADLO C[C@@H]1CCC[C@H](C(=O)N2CCc3[nH]c[nH+]c3C2)C1 ZINC000646260688 388172051 /nfs/dbraw/zinc/17/20/51/388172051.db2.gz ZRTHBNPCXUZQTL-MNOVXSKESA-N 1 2 247.342 2.121 20 0 BEADLO C[C@@H]1CCC[C@H](C(=O)N2CCc3[nH+]c[nH]c3C2)C1 ZINC000646260688 388172053 /nfs/dbraw/zinc/17/20/53/388172053.db2.gz ZRTHBNPCXUZQTL-MNOVXSKESA-N 1 2 247.342 2.121 20 0 BEADLO Fc1ccc(C[N@H+](C2CC2)C2COC2)cc1F ZINC000449350678 388178694 /nfs/dbraw/zinc/17/86/94/388178694.db2.gz LEHIGPSJTGBBHJ-UHFFFAOYSA-N 1 2 239.265 2.328 20 0 BEADLO Fc1ccc(C[N@@H+](C2CC2)C2COC2)cc1F ZINC000449350678 388178698 /nfs/dbraw/zinc/17/86/98/388178698.db2.gz LEHIGPSJTGBBHJ-UHFFFAOYSA-N 1 2 239.265 2.328 20 0 BEADLO C[C@H]1C[C@H]1CNc1ccc(N2CCCC2)c[nH+]1 ZINC000488446618 388179214 /nfs/dbraw/zinc/17/92/14/388179214.db2.gz UOHDZSQTPZUELS-RYUDHWBXSA-N 1 2 231.343 2.172 20 0 BEADLO CC[C@H]([NH2+]Cc1ccc(OC)nc1)C(F)F ZINC000449365451 388183577 /nfs/dbraw/zinc/18/35/77/388183577.db2.gz VXOGYPAOEREMAH-VIFPVBQESA-N 1 2 230.258 2.224 20 0 BEADLO COC(=O)[C@H]([NH2+]C[C@@H]1C[C@@H]1C)c1ccccc1 ZINC000488509129 388183570 /nfs/dbraw/zinc/18/35/70/388183570.db2.gz CJMGKXWXJUEKFH-WCFLWFBJSA-N 1 2 233.311 2.146 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)N(C)Cc2[nH]cc[nH+]2)C[C@H]1C ZINC000448935979 388121069 /nfs/dbraw/zinc/12/10/69/388121069.db2.gz KRLFURVULMAVPX-IJLUTSLNSA-N 1 2 249.358 2.440 20 0 BEADLO COc1ccccc1C1([NH2+]Cc2cnc[nH]2)CC1 ZINC000646001505 388122822 /nfs/dbraw/zinc/12/28/22/388122822.db2.gz OUEOXUQWEPFFGW-UHFFFAOYSA-N 1 2 243.310 2.197 20 0 BEADLO C[C@H]1COC(C)(C)CN1c1cc[nH+]cc1F ZINC000641533389 388152270 /nfs/dbraw/zinc/15/22/70/388152270.db2.gz VVHXWVMPIPKHIM-VIFPVBQESA-N 1 2 224.279 2.224 20 0 BEADLO Cc1ccc(N[C@@H](C)[C@H]2CCOC2)c[nH+]1 ZINC000162931538 388254702 /nfs/dbraw/zinc/25/47/02/388254702.db2.gz VDRIBUMYDMWKEJ-QWRGUYRKSA-N 1 2 206.289 2.227 20 0 BEADLO CCOC(C)(C)CNc1cc(C)[nH+]cn1 ZINC000167062923 388255931 /nfs/dbraw/zinc/25/59/31/388255931.db2.gz KVOVAPBDXZALND-UHFFFAOYSA-N 1 2 209.293 2.012 20 0 BEADLO CC(C)CCC(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456355598 388196225 /nfs/dbraw/zinc/19/62/25/388196225.db2.gz ATQIIZANFIMPBR-GHMZBOCLSA-N 1 2 235.331 2.441 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)CC1CCC1 ZINC000456349896 388196269 /nfs/dbraw/zinc/19/62/69/388196269.db2.gz JOMIUHSHTWTTEP-JTQLQIEISA-N 1 2 235.331 2.270 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)[C@H]1C[C@@H]1C1CC1 ZINC000456356441 388196302 /nfs/dbraw/zinc/19/63/02/388196302.db2.gz OVYHROFOJNUUIO-JLLWLGSASA-N 1 2 247.342 2.126 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)N[C@@H](C)c1[nH+]ccn1CC ZINC000456351219 388196369 /nfs/dbraw/zinc/19/63/69/388196369.db2.gz MDAMQGMNOGVZRZ-HBNTYKKESA-N 1 2 235.331 2.126 20 0 BEADLO CC[C@H](C)C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456356509 388196424 /nfs/dbraw/zinc/19/64/24/388196424.db2.gz BDVRLNHQALLDOO-LPEHRKFASA-N 1 2 221.304 2.051 20 0 BEADLO Fc1ccccc1C[NH2+]Cc1nnc(C2CC2)[nH]1 ZINC000449405224 388196746 /nfs/dbraw/zinc/19/67/46/388196746.db2.gz JPWYSBZMPGTTHF-UHFFFAOYSA-N 1 2 246.289 2.111 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)CCC1CC1 ZINC000456348783 388197042 /nfs/dbraw/zinc/19/70/42/388197042.db2.gz ILJAWTMQMBWCHH-SNVBAGLBSA-N 1 2 235.331 2.270 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)C[C@@H]2C=CCC2)c2[nH+]ccn21 ZINC000456372334 388197225 /nfs/dbraw/zinc/19/72/25/388197225.db2.gz IUUNZPRFNGUZTD-UTUOFQBUSA-N 1 2 245.326 2.361 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)c1c[nH]cc1C ZINC000456393874 388199333 /nfs/dbraw/zinc/19/93/33/388199333.db2.gz QXNKKCRCZDQKMH-JTQLQIEISA-N 1 2 246.314 2.031 20 0 BEADLO CC[C@H](C)C(=O)N[C@H](C)c1[nH+]ccn1CC ZINC000456404018 388199402 /nfs/dbraw/zinc/19/94/02/388199402.db2.gz WYOXHLWCOPASFL-VHSXEESVSA-N 1 2 223.320 2.126 20 0 BEADLO CC[C@]1(C)C[C@@H]1C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456419151 388200289 /nfs/dbraw/zinc/20/02/89/388200289.db2.gz LMMCJPJLDJYPCY-ZHSDAYTOSA-N 1 2 247.342 2.441 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)[C@H]2CC2(C)C)c2[nH+]ccn21 ZINC000456421004 388200359 /nfs/dbraw/zinc/20/03/59/388200359.db2.gz NARHJNRFAJWCPB-BBBLOLIVSA-N 1 2 233.315 2.051 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456426853 388201023 /nfs/dbraw/zinc/20/10/23/388201023.db2.gz QRJOOAKRNQXBOR-DBIOUOCHSA-N 1 2 233.315 2.051 20 0 BEADLO C[N@H+](CC(=O)OC(C)(C)C)[C@H]1CC1(C)C ZINC000489416225 388212757 /nfs/dbraw/zinc/21/27/57/388212757.db2.gz SREZFRBEIYBYIQ-VIFPVBQESA-N 1 2 213.321 2.058 20 0 BEADLO C[N@@H+](CC(=O)OC(C)(C)C)[C@H]1CC1(C)C ZINC000489416225 388212760 /nfs/dbraw/zinc/21/27/60/388212760.db2.gz SREZFRBEIYBYIQ-VIFPVBQESA-N 1 2 213.321 2.058 20 0 BEADLO CC(C)c1noc(C[N@H+](C)[C@H]2CC2(C)C)n1 ZINC000489433763 388213924 /nfs/dbraw/zinc/21/39/24/388213924.db2.gz IZVSVPGREUJAQL-VIFPVBQESA-N 1 2 223.320 2.423 20 0 BEADLO CC(C)c1noc(C[N@@H+](C)[C@H]2CC2(C)C)n1 ZINC000489433763 388213927 /nfs/dbraw/zinc/21/39/27/388213927.db2.gz IZVSVPGREUJAQL-VIFPVBQESA-N 1 2 223.320 2.423 20 0 BEADLO CO[C@](C)(C[NH2+]Cc1ccn[nH]1)c1ccccc1 ZINC000449485163 388216325 /nfs/dbraw/zinc/21/63/25/388216325.db2.gz PIKCUGRHRSNJFP-CQSZACIVSA-N 1 2 245.326 2.061 20 0 BEADLO CC[C@@H]1CC[C@H](C)N(C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000456824201 388225547 /nfs/dbraw/zinc/22/55/47/388225547.db2.gz UZCHMYIWKBVPFX-NWDGAFQWSA-N 1 2 249.358 2.379 20 0 BEADLO Cc1cc(C)c(CNC(=O)CC(F)(F)F)c[nH+]1 ZINC000456863488 388228432 /nfs/dbraw/zinc/22/84/32/388228432.db2.gz RAQPGVUFKKUFDZ-UHFFFAOYSA-N 1 2 246.232 2.267 20 0 BEADLO c1nc(C[N@@H+]2CCOCC23CCCCC3)co1 ZINC000449621998 388244298 /nfs/dbraw/zinc/24/42/98/388244298.db2.gz CCPWTUPFDLGZPS-UHFFFAOYSA-N 1 2 236.315 2.210 20 0 BEADLO c1nc(C[N@H+]2CCOCC23CCCCC3)co1 ZINC000449621998 388244300 /nfs/dbraw/zinc/24/43/00/388244300.db2.gz CCPWTUPFDLGZPS-UHFFFAOYSA-N 1 2 236.315 2.210 20 0 BEADLO CC[C@H]([NH2+]Cc1cnc(C2CC2)nc1)C(F)F ZINC000459576973 388246382 /nfs/dbraw/zinc/24/63/82/388246382.db2.gz WHNVALKFFJGFSQ-JTQLQIEISA-N 1 2 241.285 2.487 20 0 BEADLO Cc1ccc(N[C@@H]2CCO[C@@H](C)C2)c[nH+]1 ZINC000164812722 388248226 /nfs/dbraw/zinc/24/82/26/388248226.db2.gz DMCODAFNRHVLAK-WDEREUQCSA-N 1 2 206.289 2.369 20 0 BEADLO CC/C=C/CC[N@@H+](CC(F)F)C[C@H](C)O ZINC000451839306 388299667 /nfs/dbraw/zinc/29/96/67/388299667.db2.gz RLMNPGJGYQUPEN-YEZKRMTDSA-N 1 2 221.291 2.291 20 0 BEADLO CC/C=C/CC[N@H+](CC(F)F)C[C@H](C)O ZINC000451839306 388299668 /nfs/dbraw/zinc/29/96/68/388299668.db2.gz RLMNPGJGYQUPEN-YEZKRMTDSA-N 1 2 221.291 2.291 20 0 BEADLO CC/C=C\CC[N@@H+](CC(F)F)C[C@H](C)O ZINC000451839303 388299945 /nfs/dbraw/zinc/29/99/45/388299945.db2.gz RLMNPGJGYQUPEN-LWTINBJPSA-N 1 2 221.291 2.291 20 0 BEADLO CC/C=C\CC[N@H+](CC(F)F)C[C@H](C)O ZINC000451839303 388299946 /nfs/dbraw/zinc/29/99/46/388299946.db2.gz RLMNPGJGYQUPEN-LWTINBJPSA-N 1 2 221.291 2.291 20 0 BEADLO CC=CC=CC(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000492060287 388333306 /nfs/dbraw/zinc/33/33/06/388333306.db2.gz WCBOHTOTCNIJKB-IAROGAJJSA-N 1 2 245.326 2.248 20 0 BEADLO CC=CC=CC(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000492060287 388333307 /nfs/dbraw/zinc/33/33/07/388333307.db2.gz WCBOHTOTCNIJKB-IAROGAJJSA-N 1 2 245.326 2.248 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)[C@H](F)C(C)C)[nH+]1 ZINC001645476865 1172672664 /nfs/dbraw/zinc/67/26/64/1172672664.db2.gz XNSYQKOPRQTMPD-SNVBAGLBSA-N 1 2 241.310 2.143 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)[C@H](F)C(C)C)c[nH+]1 ZINC001645476865 1172672668 /nfs/dbraw/zinc/67/26/68/1172672668.db2.gz XNSYQKOPRQTMPD-SNVBAGLBSA-N 1 2 241.310 2.143 20 0 BEADLO CC=CC=CC(=O)Nc1cc(C)[nH+]cc1C ZINC000492298654 388340555 /nfs/dbraw/zinc/34/05/55/388340555.db2.gz XADIAKSFSRNRRI-YTXTXJHMSA-N 1 2 216.284 2.191 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000516582835 388358455 /nfs/dbraw/zinc/35/84/55/388358455.db2.gz MEOYULIEOGHXCH-MXWKQRLJSA-N 1 2 235.331 2.413 20 0 BEADLO O=C(NCc1c[nH+]c[nH]1)[C@@H]1CCCC[C@H]1C1CC1 ZINC000648791597 388359602 /nfs/dbraw/zinc/35/96/02/388359602.db2.gz FNSLPOVWGNGOPR-QWHCGFSZSA-N 1 2 247.342 2.242 20 0 BEADLO O=C(NCc1c[nH]c[nH+]1)[C@@H]1CCCC[C@H]1C1CC1 ZINC000648791597 388359604 /nfs/dbraw/zinc/35/96/04/388359604.db2.gz FNSLPOVWGNGOPR-QWHCGFSZSA-N 1 2 247.342 2.242 20 0 BEADLO CO[C@H](C)[C@@H](C)Nc1cc[nH+]c(C2CC2)n1 ZINC000290754881 388369491 /nfs/dbraw/zinc/36/94/91/388369491.db2.gz SXTJFPPKEKLPSX-RKDXNWHRSA-N 1 2 221.304 2.189 20 0 BEADLO CC[C@@H](C)CC(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000164503708 388379474 /nfs/dbraw/zinc/37/94/74/388379474.db2.gz QXXUTPFXUFJVNM-RKDXNWHRSA-N 1 2 209.293 2.023 20 0 BEADLO CCC[C@H]([NH3+])C(=O)N[C@H]1c2ccccc2C[C@@H]1C ZINC000236914777 388386726 /nfs/dbraw/zinc/38/67/26/388386726.db2.gz SLUNWWJZZVIGJN-LEWSCRJBSA-N 1 2 246.354 2.164 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1CCO[C@@H](C2CC2)C1 ZINC000572900069 388386721 /nfs/dbraw/zinc/38/67/21/388386721.db2.gz UNTIUPDXJFIRQC-QWHCGFSZSA-N 1 2 247.342 2.463 20 0 BEADLO CCOc1ccccc1C[NH2+]Cc1cocn1 ZINC000236942115 388386865 /nfs/dbraw/zinc/38/68/65/388386865.db2.gz BLPKTDABOHSGQS-UHFFFAOYSA-N 1 2 232.283 2.363 20 0 BEADLO CC[C@H](COC)[NH2+][C@H](CC)C(=O)OC(C)(C)C ZINC000572908597 388388124 /nfs/dbraw/zinc/38/81/24/388388124.db2.gz JNWIWJROWBMBOW-GHMZBOCLSA-N 1 2 245.363 2.121 20 0 BEADLO Fc1cccc(C[NH2+]Cc2cocn2)c1 ZINC000237791290 388397759 /nfs/dbraw/zinc/39/77/59/388397759.db2.gz TVBQJWYNHMHXHC-UHFFFAOYSA-N 1 2 206.220 2.104 20 0 BEADLO Cc1cc(N2CC[C@@H](c3cccnc3)C2)nc[nH+]1 ZINC000572956070 388398375 /nfs/dbraw/zinc/39/83/75/388398375.db2.gz KLQKXAJZQJWKBC-CYBMUJFWSA-N 1 2 240.310 2.174 20 0 BEADLO COc1nccc(C[NH2+][C@@H](C)c2ccc(C)o2)n1 ZINC000294668234 388403137 /nfs/dbraw/zinc/40/31/37/388403137.db2.gz DFBYMAOZZIIKAL-JTQLQIEISA-N 1 2 247.298 2.237 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)/C=C\C(C)(C)C ZINC000492184545 388337494 /nfs/dbraw/zinc/33/74/94/388337494.db2.gz VBAUPRJJLRJCBR-SREVYHEPSA-N 1 2 249.358 2.334 20 0 BEADLO Cc1csc(C[N@H+]2C[C@@H](C)OC(C)(C)C2)n1 ZINC000173203389 388338780 /nfs/dbraw/zinc/33/87/80/388338780.db2.gz RDQISILDVLPGFI-SNVBAGLBSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1csc(C[N@@H+]2C[C@@H](C)OC(C)(C)C2)n1 ZINC000173203389 388338781 /nfs/dbraw/zinc/33/87/81/388338781.db2.gz RDQISILDVLPGFI-SNVBAGLBSA-N 1 2 240.372 2.451 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)/C=C/C1CCC1 ZINC000492231757 388339016 /nfs/dbraw/zinc/33/90/16/388339016.db2.gz LTKWPNHRZPFWTR-VOTSOKGWSA-N 1 2 247.342 2.088 20 0 BEADLO CCC(C)(C)OCCNc1cc(C)[nH+]cn1 ZINC000308515694 388441159 /nfs/dbraw/zinc/44/11/59/388441159.db2.gz WCCICTKAMYGEGN-UHFFFAOYSA-N 1 2 223.320 2.402 20 0 BEADLO CCCCNC(=O)Cc1cn2cccc(C)c2[nH+]1 ZINC000041287551 388457720 /nfs/dbraw/zinc/45/77/20/388457720.db2.gz RQOZMIFFFVBTPQ-UHFFFAOYSA-N 1 2 245.326 2.102 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)[C@H]1C[C@H]1C1CC1 ZINC000176707598 388459117 /nfs/dbraw/zinc/45/91/17/388459117.db2.gz VVOCIMXEJRMQBO-QWRGUYRKSA-N 1 2 245.326 2.132 20 0 BEADLO c1ccc2cc(N3CCOCC3)[nH+]cc2c1 ZINC000034590754 388473949 /nfs/dbraw/zinc/47/39/49/388473949.db2.gz NTTACASAYVUHIL-UHFFFAOYSA-N 1 2 214.268 2.071 20 0 BEADLO Cc1ccc2[nH+]c(CSc3cn[nH]n3)cn2c1 ZINC000177369097 388481989 /nfs/dbraw/zinc/48/19/89/388481989.db2.gz JELJKRFKZMRPNF-UHFFFAOYSA-N 1 2 245.311 2.053 20 0 BEADLO Cc1ccc2[nH+]c(CSc3c[nH]nn3)cn2c1 ZINC000177369097 388481990 /nfs/dbraw/zinc/48/19/90/388481990.db2.gz JELJKRFKZMRPNF-UHFFFAOYSA-N 1 2 245.311 2.053 20 0 BEADLO FC1(F)CCCC[C@H]1C[NH2+]Cc1ccn[nH]1 ZINC000295120672 388408627 /nfs/dbraw/zinc/40/86/27/388408627.db2.gz NDEJWNMMRZTQEO-VIFPVBQESA-N 1 2 229.274 2.325 20 0 BEADLO CCc1cc(N2C[C@@H](C)OC(C)(C)C2)nc(C)[nH+]1 ZINC000172711607 388410420 /nfs/dbraw/zinc/41/04/20/388410420.db2.gz ILYDDARIPJOXBY-SNVBAGLBSA-N 1 2 249.358 2.351 20 0 BEADLO COc1ccc(N[C@@H]2CCOC2(C)C)[nH+]c1 ZINC000328391288 388414699 /nfs/dbraw/zinc/41/46/99/388414699.db2.gz OFCDXPQSHVQVDR-SNVBAGLBSA-N 1 2 222.288 2.070 20 0 BEADLO Oc1cccc(C[NH2+]Cc2cc[nH]n2)c1Cl ZINC000328474094 388415589 /nfs/dbraw/zinc/41/55/89/388415589.db2.gz OAKUIIDOQBLKNU-UHFFFAOYSA-N 1 2 237.690 2.059 20 0 BEADLO CC[C@@H]1C[N@H+](C/C=C(/C)Cl)C[C@H](C)[S@]1=O ZINC000528506884 388537500 /nfs/dbraw/zinc/53/75/00/388537500.db2.gz MSRGTVWXETZQIH-BVBFKCSSSA-N 1 2 249.807 2.360 20 0 BEADLO CC[C@@H]1C[N@@H+](C/C=C(/C)Cl)C[C@H](C)[S@]1=O ZINC000528506884 388537504 /nfs/dbraw/zinc/53/75/04/388537504.db2.gz MSRGTVWXETZQIH-BVBFKCSSSA-N 1 2 249.807 2.360 20 0 BEADLO C[C@H](CC(=O)N[C@H]1CCC[C@H]1C)n1cc[nH+]c1 ZINC000517153868 388539105 /nfs/dbraw/zinc/53/91/05/388539105.db2.gz ILPVVDGBOSJHKX-UTUOFQBUSA-N 1 2 235.331 2.139 20 0 BEADLO C[C@@H](O)C[N@H+](CC(F)F)CC1CC(C)(C)C1 ZINC000528522902 388542687 /nfs/dbraw/zinc/54/26/87/388542687.db2.gz WYUQLGZKDPANKL-SECBINFHSA-N 1 2 235.318 2.371 20 0 BEADLO C[C@@H](O)C[N@@H+](CC(F)F)CC1CC(C)(C)C1 ZINC000528522902 388542689 /nfs/dbraw/zinc/54/26/89/388542689.db2.gz WYUQLGZKDPANKL-SECBINFHSA-N 1 2 235.318 2.371 20 0 BEADLO CCCC[C@@H]([NH2+]C[C@H]1CCCS1)C(=O)OC ZINC000135245255 388487066 /nfs/dbraw/zinc/48/70/66/388487066.db2.gz QLGKNYREAKVHRI-GHMZBOCLSA-N 1 2 245.388 2.203 20 0 BEADLO c1[nH+]c2ccccn2c1CSc1ncccn1 ZINC000177898048 388493190 /nfs/dbraw/zinc/49/31/90/388493190.db2.gz MZBRDVUPCOSWDG-UHFFFAOYSA-N 1 2 242.307 2.417 20 0 BEADLO Cc1cc(C(=O)NCCc2[nH]cc[nH+]2)sc1C ZINC000135484835 388497194 /nfs/dbraw/zinc/49/71/94/388497194.db2.gz GUNOQXDLLNEGHS-UHFFFAOYSA-N 1 2 249.339 2.061 20 0 BEADLO Cc1cc(NCCC2(O)CCC2)nc(C(C)C)[nH+]1 ZINC000343143031 388498505 /nfs/dbraw/zinc/49/85/05/388498505.db2.gz PCBCUNDCPDJESH-UHFFFAOYSA-N 1 2 249.358 2.047 20 0 BEADLO c1cc2cccc(C[NH2+]Cc3csnn3)c2[nH]1 ZINC000343472096 388500209 /nfs/dbraw/zinc/50/02/09/388500209.db2.gz QQUSMJWGPSECHS-UHFFFAOYSA-N 1 2 244.323 2.309 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1CCOC[C@@H]1[C@@H]1CCCO1 ZINC000528510265 388507180 /nfs/dbraw/zinc/50/71/80/388507180.db2.gz XWSRHNNOYDRREY-KAZJJLNOSA-N 1 2 245.750 2.009 20 0 BEADLO C/C(Cl)=C\C[N@H+]1CCOC[C@@H]1[C@@H]1CCCO1 ZINC000528510265 388507182 /nfs/dbraw/zinc/50/71/82/388507182.db2.gz XWSRHNNOYDRREY-KAZJJLNOSA-N 1 2 245.750 2.009 20 0 BEADLO Cc1csc(C[NH2+]Cc2ccn[nH]2)c1 ZINC000344622170 388507968 /nfs/dbraw/zinc/50/79/68/388507968.db2.gz LJMABESXBAAALK-UHFFFAOYSA-N 1 2 207.302 2.069 20 0 BEADLO COC(=O)[C@H](c1ccccc1)[N@H+]1[C@H](C)C[C@@H]1C ZINC000548097106 388510458 /nfs/dbraw/zinc/51/04/58/388510458.db2.gz GDCPVRIVLAAYHA-LOWVWBTDSA-N 1 2 233.311 2.383 20 0 BEADLO COC(=O)[C@H](c1ccccc1)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548097106 388510460 /nfs/dbraw/zinc/51/04/60/388510460.db2.gz GDCPVRIVLAAYHA-LOWVWBTDSA-N 1 2 233.311 2.383 20 0 BEADLO CC[C@@H](CO)N(C)c1cc(C(F)(F)F)cc[nH+]1 ZINC000345824803 388516877 /nfs/dbraw/zinc/51/68/77/388516877.db2.gz CKRZTVZJLJRUAS-VIFPVBQESA-N 1 2 248.248 2.308 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CC[C@H](OCC(C)C)C1 ZINC000516878077 388522956 /nfs/dbraw/zinc/52/29/56/388522956.db2.gz WVIZNIPHRKRVSV-ZDUSSCGKSA-N 1 2 249.358 2.345 20 0 BEADLO Cc1nc(C[N@H+](C)CC2CC(C)(C)C2)no1 ZINC000528437505 388526023 /nfs/dbraw/zinc/52/60/23/388526023.db2.gz HZTCLGPTNQQGBE-UHFFFAOYSA-N 1 2 223.320 2.246 20 0 BEADLO Cc1nc(C[N@@H+](C)CC2CC(C)(C)C2)no1 ZINC000528437505 388526026 /nfs/dbraw/zinc/52/60/26/388526026.db2.gz HZTCLGPTNQQGBE-UHFFFAOYSA-N 1 2 223.320 2.246 20 0 BEADLO C/C(Cl)=C/C[NH2+][C@H](C)c1nnc(C)o1 ZINC000528450359 388527093 /nfs/dbraw/zinc/52/70/93/388527093.db2.gz KTIBCAMXKPIAGB-FXXDRWHHSA-N 1 2 215.684 2.171 20 0 BEADLO C[C@@H]([NH2+]Cc1ncccc1Cl)c1cn[nH]c1 ZINC000528445366 388527369 /nfs/dbraw/zinc/52/73/69/388527369.db2.gz CJDCJVKGKBHDTG-MRVPVSSYSA-N 1 2 236.706 2.309 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1CCO[C@@H](COC(C)C)C1 ZINC000528461057 388530251 /nfs/dbraw/zinc/53/02/51/388530251.db2.gz ZSAXHQNSOYABEE-CSXHZRMWSA-N 1 2 247.766 2.255 20 0 BEADLO C/C(Cl)=C/C[N@H+]1CCO[C@@H](COC(C)C)C1 ZINC000528461057 388530254 /nfs/dbraw/zinc/53/02/54/388530254.db2.gz ZSAXHQNSOYABEE-CSXHZRMWSA-N 1 2 247.766 2.255 20 0 BEADLO C[C@H](CC(=O)N(C)Cc1[nH]cc[nH+]1)c1ccco1 ZINC000528474003 388530962 /nfs/dbraw/zinc/53/09/62/388530962.db2.gz GDXUTGOOPMRZTL-SNVBAGLBSA-N 1 2 247.298 2.155 20 0 BEADLO CCc1noc([C@H](C)[NH+]2[C@H](C)C[C@H]2C)n1 ZINC000548424815 388535747 /nfs/dbraw/zinc/53/57/47/388535747.db2.gz XAYXOJYEPPKIBM-HLTSFMKQSA-N 1 2 209.293 2.176 20 0 BEADLO CC[C@H]([NH2+]Cc1ncccn1)c1ccncc1 ZINC000517041979 388536384 /nfs/dbraw/zinc/53/63/84/388536384.db2.gz HSLKJGIVWJXMLS-LBPRGKRZSA-N 1 2 228.299 2.113 20 0 BEADLO c1ccc(OCC[N@@H+]2Cc3cccnc3C2)cc1 ZINC000550657260 388612096 /nfs/dbraw/zinc/61/20/96/388612096.db2.gz NAEZVOAZSNXAGW-UHFFFAOYSA-N 1 2 240.306 2.476 20 0 BEADLO c1ccc(OCC[N@H+]2Cc3cccnc3C2)cc1 ZINC000550657260 388612097 /nfs/dbraw/zinc/61/20/97/388612097.db2.gz NAEZVOAZSNXAGW-UHFFFAOYSA-N 1 2 240.306 2.476 20 0 BEADLO CC(C)Cc1noc(C[NH+]2[C@H](C)C[C@H]2C)n1 ZINC000548754312 388557119 /nfs/dbraw/zinc/55/71/19/388557119.db2.gz TVRNLKUAXKOQHB-NXEZZACHSA-N 1 2 223.320 2.251 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC[C@@H]1CCC[C@@H]1C ZINC000521067099 388561459 /nfs/dbraw/zinc/56/14/59/388561459.db2.gz YWUZQCHWAQEYJI-TUAOUCFPSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC[C@@H]1CCC[C@@H]1C ZINC000521067099 388561460 /nfs/dbraw/zinc/56/14/60/388561460.db2.gz YWUZQCHWAQEYJI-TUAOUCFPSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@H](NC(=O)Cc1c[nH+]cn1C)C1CCCCC1 ZINC000548813237 388563870 /nfs/dbraw/zinc/56/38/70/388563870.db2.gz RICQKIDMPHNJJH-NSHDSACASA-N 1 2 249.358 2.048 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCC(CF)CC1 ZINC000521272176 388567865 /nfs/dbraw/zinc/56/78/65/388567865.db2.gz SSIUFVFGCKAPJB-UHFFFAOYSA-N 1 2 223.295 2.279 20 0 BEADLO Cc1nnc([C@H](C)[NH+]2[C@@H](C)C[C@@H]2C)s1 ZINC000549172690 388574374 /nfs/dbraw/zinc/57/43/74/388574374.db2.gz IATHUUFXUYHFIK-FXQIFTODSA-N 1 2 211.334 2.390 20 0 BEADLO CC[C@H]1CC[N@H+](Cc2noc(C3CC3)n2)C1 ZINC000125792323 388678109 /nfs/dbraw/zinc/67/81/09/388678109.db2.gz NSUPPPOIIGOXEY-VIFPVBQESA-N 1 2 221.304 2.179 20 0 BEADLO CC[C@H]1CC[N@@H+](Cc2noc(C3CC3)n2)C1 ZINC000125792323 388678110 /nfs/dbraw/zinc/67/81/10/388678110.db2.gz NSUPPPOIIGOXEY-VIFPVBQESA-N 1 2 221.304 2.179 20 0 BEADLO C[C@@H]1CC[C@@H]1[NH2+][C@H](c1cccs1)c1nnc[nH]1 ZINC000551201107 388623662 /nfs/dbraw/zinc/62/36/62/388623662.db2.gz PKAQLYIBOVZWHN-WCABBAIRSA-N 1 2 248.355 2.344 20 0 BEADLO C[C@@H]1CC[C@@H]1[NH2+][C@@H](c1cccs1)c1nnc[nH]1 ZINC000551201108 388623714 /nfs/dbraw/zinc/62/37/14/388623714.db2.gz PKAQLYIBOVZWHN-YWVKMMECSA-N 1 2 248.355 2.344 20 0 BEADLO COc1ccc[nH+]c1NCc1c(C)nn(C)c1C ZINC000128175822 388740034 /nfs/dbraw/zinc/74/00/34/388740034.db2.gz UPCXVWNZLDHEBP-UHFFFAOYSA-N 1 2 246.314 2.053 20 0 BEADLO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2ccoc2)[nH]1 ZINC000539063364 388746401 /nfs/dbraw/zinc/74/64/01/388746401.db2.gz BPZMXGVDYRDHQB-IUCAKERBSA-N 1 2 234.303 2.372 20 0 BEADLO CCc1cc(C[NH2+][C@@H](CC)c2nccn2C)on1 ZINC000539317936 388753378 /nfs/dbraw/zinc/75/33/78/388753378.db2.gz JPAFNKDISJFGNX-LBPRGKRZSA-N 1 2 248.330 2.211 20 0 BEADLO O=C(NCCCNc1cccc[nH+]1)C1=CCCC1 ZINC000126250969 388692048 /nfs/dbraw/zinc/69/20/48/388692048.db2.gz KVBLAPHBFHWDAV-UHFFFAOYSA-N 1 2 245.326 2.110 20 0 BEADLO C[N@H+](CCO)Cc1csc(C2CCCC2)n1 ZINC000195250453 388702721 /nfs/dbraw/zinc/70/27/21/388702721.db2.gz MWNWLJQNZKCTMK-UHFFFAOYSA-N 1 2 240.372 2.225 20 0 BEADLO C[N@@H+](CCO)Cc1csc(C2CCCC2)n1 ZINC000195250453 388702723 /nfs/dbraw/zinc/70/27/23/388702723.db2.gz MWNWLJQNZKCTMK-UHFFFAOYSA-N 1 2 240.372 2.225 20 0 BEADLO C[N@H+](CCOC(C)(C)C)Cc1cscn1 ZINC000065953834 388707431 /nfs/dbraw/zinc/70/74/31/388707431.db2.gz BBNMASOGHFKBCG-UHFFFAOYSA-N 1 2 228.361 2.390 20 0 BEADLO C[N@@H+](CCOC(C)(C)C)Cc1cscn1 ZINC000065953834 388707434 /nfs/dbraw/zinc/70/74/34/388707434.db2.gz BBNMASOGHFKBCG-UHFFFAOYSA-N 1 2 228.361 2.390 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2csnn2)C[C@@H]1C ZINC000127652577 388728949 /nfs/dbraw/zinc/72/89/49/388728949.db2.gz QAIBKEVFFVNJFW-BDAKNGLRSA-N 1 2 211.334 2.016 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2csnn2)C[C@@H]1C ZINC000127652577 388728952 /nfs/dbraw/zinc/72/89/52/388728952.db2.gz QAIBKEVFFVNJFW-BDAKNGLRSA-N 1 2 211.334 2.016 20 0 BEADLO CC[C@@H](C)NC(=O)C[N@H+](C)[C@H](C)c1ccco1 ZINC000249831181 388733320 /nfs/dbraw/zinc/73/33/20/388733320.db2.gz OFQBARGEOYARSQ-GHMZBOCLSA-N 1 2 238.331 2.187 20 0 BEADLO CC[C@@H](C)NC(=O)C[N@@H+](C)[C@H](C)c1ccco1 ZINC000249831181 388733321 /nfs/dbraw/zinc/73/33/21/388733321.db2.gz OFQBARGEOYARSQ-GHMZBOCLSA-N 1 2 238.331 2.187 20 0 BEADLO c1ccc(NCC2SCCS2)[nH+]c1 ZINC000575460385 388806277 /nfs/dbraw/zinc/80/62/77/388806277.db2.gz JQZSDYWTSVKJDS-UHFFFAOYSA-N 1 2 212.343 2.300 20 0 BEADLO CSCC[C@@H](C)[N@H+](C)Cc1csnn1 ZINC000129023124 388811753 /nfs/dbraw/zinc/81/17/53/388811753.db2.gz DAUMYADDILHNBL-MRVPVSSYSA-N 1 2 231.390 2.112 20 0 BEADLO CSCC[C@@H](C)[N@@H+](C)Cc1csnn1 ZINC000129023124 388811757 /nfs/dbraw/zinc/81/17/57/388811757.db2.gz DAUMYADDILHNBL-MRVPVSSYSA-N 1 2 231.390 2.112 20 0 BEADLO CCC[C@H](C)N(C)C(=O)[C@H]1CCc2c[nH+]cn2C1 ZINC000553313338 388762469 /nfs/dbraw/zinc/76/24/69/388762469.db2.gz HTMOEDYWYBXVRE-RYUDHWBXSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1cc(N[C@H]2C[C@H]2C2CC2)nc(C2CC2)[nH+]1 ZINC000362375616 177709744 /nfs/dbraw/zinc/70/97/44/177709744.db2.gz KGPFVSCHQRMFOD-RYUDHWBXSA-N 1 2 229.327 2.295 20 0 BEADLO Cc1oncc1C[N@H+]1CCOC[C@@H]1CC(C)C ZINC000128645762 388779384 /nfs/dbraw/zinc/77/93/84/388779384.db2.gz MSMNMNYQQFYVMX-ZDUSSCGKSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1oncc1C[N@@H+]1CCOC[C@@H]1CC(C)C ZINC000128645762 388779388 /nfs/dbraw/zinc/77/93/88/388779388.db2.gz MSMNMNYQQFYVMX-ZDUSSCGKSA-N 1 2 238.331 2.230 20 0 BEADLO CC(C)[C@H]1CCN(c2nc[nH+]c(N)c2Cl)C1 ZINC000232732632 388855971 /nfs/dbraw/zinc/85/59/71/388855971.db2.gz XDDYRDDLWLSPJC-QMMMGPOBSA-N 1 2 240.738 2.195 20 0 BEADLO CC(C)[C@H]1CCN(c2[nH+]cnc(N)c2Cl)C1 ZINC000232732632 388855973 /nfs/dbraw/zinc/85/59/73/388855973.db2.gz XDDYRDDLWLSPJC-QMMMGPOBSA-N 1 2 240.738 2.195 20 0 BEADLO CCC1(CNc2nc[nH+]c(N)c2Cl)CC1 ZINC000233016503 388861113 /nfs/dbraw/zinc/86/11/13/388861113.db2.gz XYMFXNVUULJBTR-UHFFFAOYSA-N 1 2 226.711 2.314 20 0 BEADLO CCC1(CNc2[nH+]cnc(N)c2Cl)CC1 ZINC000233016503 388861115 /nfs/dbraw/zinc/86/11/15/388861115.db2.gz XYMFXNVUULJBTR-UHFFFAOYSA-N 1 2 226.711 2.314 20 0 BEADLO CCC[C@@H]([NH2+]Cc1ccn[nH]1)c1cccnc1 ZINC000541744225 388866173 /nfs/dbraw/zinc/86/61/73/388866173.db2.gz GUWKRRDDKNDCAZ-CYBMUJFWSA-N 1 2 230.315 2.436 20 0 BEADLO CC(C)(NC(=O)Cc1cccs1)c1[nH]cc[nH+]1 ZINC000564802574 388889780 /nfs/dbraw/zinc/88/97/80/388889780.db2.gz MQENYSRFFWFSCZ-UHFFFAOYSA-N 1 2 249.339 2.065 20 0 BEADLO Cc1c[nH+]c(C)nc1N1C[C@@H](C)OC(C)(C)C1 ZINC000564460065 388875544 /nfs/dbraw/zinc/87/55/44/388875544.db2.gz ASNNQMZIDGFFTE-SNVBAGLBSA-N 1 2 235.331 2.097 20 0 BEADLO C[C@@H](CC(=O)N1CC(C2CCC2)C1)n1cc[nH+]c1 ZINC000565086642 388913369 /nfs/dbraw/zinc/91/33/69/388913369.db2.gz QYJLSWQOIMBTPV-NSHDSACASA-N 1 2 247.342 2.093 20 0 BEADLO CC[C@@H](c1ccccc1)[N@@H+]1CCn2nncc2C1 ZINC000565169023 388920086 /nfs/dbraw/zinc/92/00/86/388920086.db2.gz BNCHJRWGFBXHBJ-AWEZNQCLSA-N 1 2 242.326 2.245 20 0 BEADLO CC[C@@H](c1ccccc1)[N@H+]1CCn2nncc2C1 ZINC000565169023 388920089 /nfs/dbraw/zinc/92/00/89/388920089.db2.gz BNCHJRWGFBXHBJ-AWEZNQCLSA-N 1 2 242.326 2.245 20 0 BEADLO COC1(C)CCN(c2nc(C)[nH+]cc2C)CC1 ZINC000565230545 388929264 /nfs/dbraw/zinc/92/92/64/388929264.db2.gz SNSXMVCEOXDFLM-UHFFFAOYSA-N 1 2 235.331 2.099 20 0 BEADLO Cc1[nH]c(CNCc2ccc(O)c(F)c2)[nH+]c1C ZINC000565608508 388958216 /nfs/dbraw/zinc/95/82/16/388958216.db2.gz CMDANCARWNOPKD-UHFFFAOYSA-N 1 2 249.289 2.161 20 0 BEADLO C[C@@H]1C[C@H]1CNc1cc[nH+]c(C2CC2)n1 ZINC000264901438 388992506 /nfs/dbraw/zinc/99/25/06/388992506.db2.gz VYKCNSSBSJPWIT-SCZZXKLOSA-N 1 2 203.289 2.422 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CC[C@@H](C2CC2)C1 ZINC000336472552 177647952 /nfs/dbraw/zinc/64/79/52/177647952.db2.gz IRECQRZDFKIJAG-GFCCVEGCSA-N 1 2 245.326 2.076 20 0 BEADLO CCCCCCC(=O)NCc1[nH]c[nH+]c1C ZINC000267267068 388999788 /nfs/dbraw/zinc/99/97/88/388999788.db2.gz UYHSSFWFRYQOTI-UHFFFAOYSA-N 1 2 223.320 2.305 20 0 BEADLO OCC[C@H]1CCC[C@@H]1Nc1cccc[nH+]1 ZINC000275024816 389051340 /nfs/dbraw/zinc/05/13/40/389051340.db2.gz MZKBWYOIKVJQDR-MNOVXSKESA-N 1 2 206.289 2.045 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+]Cc2ccno2)s1 ZINC000273244079 389040019 /nfs/dbraw/zinc/04/00/19/389040019.db2.gz BACMQVCEXWOYJV-MRVPVSSYSA-N 1 2 223.301 2.290 20 0 BEADLO C[C@@H](C1CC1)N(C(=O)C=Cc1c[nH]c[nH+]1)C1CC1 ZINC000492808794 533363902 /nfs/dbraw/zinc/36/39/02/533363902.db2.gz DZCIFEWRTFQWGX-VAWSOJLPSA-N 1 2 245.326 2.212 20 0 BEADLO C[C@@H](CC(C)(C)C)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493663641 533466403 /nfs/dbraw/zinc/46/64/03/533466403.db2.gz YFUSNQLCBGDKTG-PORFMDCZSA-N 1 2 235.331 2.364 20 0 BEADLO C[C@@H]1CCCC[C@H]1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492822361 533606989 /nfs/dbraw/zinc/60/69/89/533606989.db2.gz INNNRDWNORWUFW-PCQKXGFJSA-N 1 2 233.315 2.118 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)c2[nH+]ccn21 ZINC000496625134 533631772 /nfs/dbraw/zinc/63/17/72/533631772.db2.gz NFFPXHZDZAJOTK-RKDXNWHRSA-N 1 2 237.303 2.414 20 0 BEADLO C[C@H]1CCN(c2cc(N3CCCCC3)[nH+]cn2)C1 ZINC000264306145 132178754 /nfs/dbraw/zinc/17/87/54/132178754.db2.gz FJUZJGHRZNMUPR-LBPRGKRZSA-N 1 2 246.358 2.313 20 0 BEADLO C[C@H]1CCN(c2cc(N3CCCCC3)nc[nH+]2)C1 ZINC000264306145 132178757 /nfs/dbraw/zinc/17/87/57/132178757.db2.gz FJUZJGHRZNMUPR-LBPRGKRZSA-N 1 2 246.358 2.313 20 0 BEADLO CC[C@@H]1CN(c2cc[nH+]c(C3CC3)n2)C[C@@H](C)O1 ZINC000264691588 132179691 /nfs/dbraw/zinc/17/96/91/132179691.db2.gz CHUBOKQWVFJVKN-ZYHUDNBSSA-N 1 2 247.342 2.358 20 0 BEADLO C[C@H]1CN(Cc2[nH+]ccn2C)c2ccccc2O1 ZINC000264767698 132180479 /nfs/dbraw/zinc/18/04/79/132180479.db2.gz ZYHVEZLRPZUIEK-NSHDSACASA-N 1 2 243.310 2.208 20 0 BEADLO CCOC[C@H]1CCCN(c2cc[nH+]c(C)n2)C1 ZINC000266361231 132186183 /nfs/dbraw/zinc/18/61/83/132186183.db2.gz KSGBEVHMCVMHSM-LBPRGKRZSA-N 1 2 235.331 2.038 20 0 BEADLO C[C@@H]1COCCN1c1cc(C(F)(F)F)cc[nH+]1 ZINC000267391851 132190045 /nfs/dbraw/zinc/19/00/45/132190045.db2.gz NSDKWHCWKGUKAQ-MRVPVSSYSA-N 1 2 246.232 2.326 20 0 BEADLO CC1=CCN(c2cc(NCC3CC3)[nH+]cn2)CC1 ZINC000270197660 132195933 /nfs/dbraw/zinc/19/59/33/132195933.db2.gz FDUBKHKDDXPQQI-UHFFFAOYSA-N 1 2 244.342 2.455 20 0 BEADLO CC1=CCN(c2cc(NCC3CC3)nc[nH+]2)CC1 ZINC000270197660 132195936 /nfs/dbraw/zinc/19/59/36/132195936.db2.gz FDUBKHKDDXPQQI-UHFFFAOYSA-N 1 2 244.342 2.455 20 0 BEADLO Cc1nc(N2CC(C)(C)OC(C)(C)C2)cc[nH+]1 ZINC000276045235 132205836 /nfs/dbraw/zinc/20/58/36/132205836.db2.gz OCTINPFLSYHVBH-UHFFFAOYSA-N 1 2 235.331 2.179 20 0 BEADLO CC(C)(C)[C@H]1CN(c2cccc[nH+]2)CCO1 ZINC000279557212 132209658 /nfs/dbraw/zinc/20/96/58/132209658.db2.gz TUUFTXFPZBGFQD-LLVKDONJSA-N 1 2 220.316 2.333 20 0 BEADLO Cc1nc(N2CCCC[C@H]2c2cc[nH]n2)cc[nH+]1 ZINC000288885119 132216415 /nfs/dbraw/zinc/21/64/15/132216415.db2.gz GZXHPQBRUUIBOE-LBPRGKRZSA-N 1 2 243.314 2.240 20 0 BEADLO Cc1nc(N2CC[C@@]3(C)[C@@H](C2)C3(F)F)cc[nH+]1 ZINC000291910174 132218528 /nfs/dbraw/zinc/21/85/28/132218528.db2.gz KTUXGODFAARHDM-KOLCDFICSA-N 1 2 239.269 2.267 20 0 BEADLO CO[C@H]1CCN(c2cccc[nH+]2)CC1(C)C ZINC000295734429 132220926 /nfs/dbraw/zinc/22/09/26/132220926.db2.gz MGHBGUISLYHDGM-NSHDSACASA-N 1 2 220.316 2.333 20 0 BEADLO Cc1nc(N2CCOC3(CCC3)C2)c(C)c(C)[nH+]1 ZINC000301860360 132224666 /nfs/dbraw/zinc/22/46/66/132224666.db2.gz DKFJKMFQXNPQIV-UHFFFAOYSA-N 1 2 247.342 2.161 20 0 BEADLO c1cnn(C2CCN(c3cccc[nH+]3)CC2)c1 ZINC000071711418 132231843 /nfs/dbraw/zinc/23/18/43/132231843.db2.gz UNDLUFOEGXBHLU-UHFFFAOYSA-N 1 2 228.299 2.120 20 0 BEADLO CCO[C@@H]1CCN(c2cccc[nH+]2)C[C@@H]1C ZINC000336261351 132245606 /nfs/dbraw/zinc/24/56/06/132245606.db2.gz FNJPMFBJRFHJLN-NWDGAFQWSA-N 1 2 220.316 2.333 20 0 BEADLO COCC1(C)CCN(c2cccc[nH+]2)CC1 ZINC000336379828 132247313 /nfs/dbraw/zinc/24/73/13/132247313.db2.gz XLEKYSQZHKWXNV-UHFFFAOYSA-N 1 2 220.316 2.335 20 0 BEADLO Cc1cc(N2CC[C@@]3(C)[C@@H](C2)C3(F)F)nc[nH+]1 ZINC000336497392 132248319 /nfs/dbraw/zinc/24/83/19/132248319.db2.gz NOUJYJFRJOZWJV-KOLCDFICSA-N 1 2 239.269 2.267 20 0 BEADLO c1ccc(N2CCC[C@@H]([C@@H]3CCOC3)C2)[nH+]c1 ZINC000336549193 132248741 /nfs/dbraw/zinc/24/87/41/132248741.db2.gz PDEGGUCCEDMFCF-CHWSQXEVSA-N 1 2 232.327 2.335 20 0 BEADLO CC[C@@H]1CCCN(c2cc(C)[nH+]cn2)C1 ZINC000301222545 132251503 /nfs/dbraw/zinc/25/15/03/132251503.db2.gz BHZZVEVKHDMJGR-LLVKDONJSA-N 1 2 205.305 2.411 20 0 BEADLO CCOC[C@H]1CCCN(c2cc(C)[nH+]cn2)C1 ZINC000301304373 132252559 /nfs/dbraw/zinc/25/25/59/132252559.db2.gz XFDJRUKLIQYGEI-LBPRGKRZSA-N 1 2 235.331 2.038 20 0 BEADLO Cc1cc(N2C[C@H](C)CC[C@@H]2C)nc[nH+]1 ZINC000301425133 132253630 /nfs/dbraw/zinc/25/36/30/132253630.db2.gz GNVIWIVTZKSGPL-KOLCDFICSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1cc(N2CCSC(C)(C)C2)nc[nH+]1 ZINC000301587160 132255078 /nfs/dbraw/zinc/25/50/78/132255078.db2.gz RPDQMHNPWRIALM-UHFFFAOYSA-N 1 2 223.345 2.117 20 0 BEADLO CC[C@H]1CN(c2nc(C)[nH+]c(C)c2C)C[C@H](C)O1 ZINC000301632151 132255337 /nfs/dbraw/zinc/25/53/37/132255337.db2.gz BVXOALRVCBMYOO-ZANVPECISA-N 1 2 249.358 2.406 20 0 BEADLO Cc1cc(N2CCCC(C)(C)C2)nc[nH+]1 ZINC000112695726 132268100 /nfs/dbraw/zinc/26/81/00/132268100.db2.gz TZUNYOKXPDZEKO-UHFFFAOYSA-N 1 2 205.305 2.411 20 0 BEADLO Cc1cc(N2CC[C@@H](C)[C@@H](O)C2)nc(C(C)C)[nH+]1 ZINC000221207965 132291092 /nfs/dbraw/zinc/29/10/92/132291092.db2.gz OXCNAXFSWMGPOB-PWSUYJOCSA-N 1 2 249.358 2.116 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CCO[C@@H](C)C1 ZINC000225869254 322840426 /nfs/dbraw/zinc/84/04/26/322840426.db2.gz AECSODVLXSMCGU-UWVGGRQHSA-N 1 2 222.288 2.070 20 0 BEADLO CC[C@H]([NH2+]Cc1ccn(C)n1)c1ccc(F)cn1 ZINC000161352388 133513757 /nfs/dbraw/zinc/51/37/57/133513757.db2.gz MJXSWJVKVJYQEP-LBPRGKRZSA-N 1 2 248.305 2.195 20 0 BEADLO Cc1ncc([C@H](C)[NH2+][C@@H](C)c2ccon2)c(C)n1 ZINC000349833928 133918027 /nfs/dbraw/zinc/91/80/27/133918027.db2.gz MIULMHJNJNETOG-WPRPVWTQSA-N 1 2 246.314 2.493 20 0 BEADLO CC1(CC(=O)N2CCC[C@H](c3[nH]cc[nH+]3)C2)CC1 ZINC000335822505 133928962 /nfs/dbraw/zinc/92/89/62/133928962.db2.gz NKZZCVQDHMZVDW-NSHDSACASA-N 1 2 247.342 2.306 20 0 BEADLO C[C@H](CC1CCOCC1)C[NH+]1CC(F)C1 ZINC000350392041 133953962 /nfs/dbraw/zinc/95/39/62/133953962.db2.gz MKZPOZKDZOGJTA-SNVBAGLBSA-N 1 2 215.312 2.093 20 0 BEADLO C[C@H]1c2ccccc2C[N@H+]1CC(=O)N(C)C1CC1 ZINC000335923443 134007923 /nfs/dbraw/zinc/00/79/23/134007923.db2.gz XIAFTDBJHIIIOT-NSHDSACASA-N 1 2 244.338 2.184 20 0 BEADLO C[C@H]1c2ccccc2C[N@@H+]1CC(=O)N(C)C1CC1 ZINC000335923443 134007924 /nfs/dbraw/zinc/00/79/24/134007924.db2.gz XIAFTDBJHIIIOT-NSHDSACASA-N 1 2 244.338 2.184 20 0 BEADLO CC[C@@H]1CCCN1C(=O)Nc1cc[nH+]c(C)c1 ZINC000335940791 134017390 /nfs/dbraw/zinc/01/73/90/134017390.db2.gz QZJSMXJYJUMSER-GFCCVEGCSA-N 1 2 233.315 2.218 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+]2CCOC3(CCC3)C2)o1 ZINC000335946278 134020117 /nfs/dbraw/zinc/02/01/17/134020117.db2.gz JBWDDHGWHIIDOD-LLVKDONJSA-N 1 2 236.315 2.299 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+]2CCOC3(CCC3)C2)o1 ZINC000335946278 134020118 /nfs/dbraw/zinc/02/01/18/134020118.db2.gz JBWDDHGWHIIDOD-LLVKDONJSA-N 1 2 236.315 2.299 20 0 BEADLO C[C@H](c1nncn1C)[N@@H+]1Cc2ccccc2[C@H]1C ZINC000335961979 134026932 /nfs/dbraw/zinc/02/69/32/134026932.db2.gz RSNDNOHNOFYMJJ-GHMZBOCLSA-N 1 2 242.326 2.453 20 0 BEADLO C[C@H](c1nncn1C)[N@H+]1Cc2ccccc2[C@H]1C ZINC000335961979 134026933 /nfs/dbraw/zinc/02/69/33/134026933.db2.gz RSNDNOHNOFYMJJ-GHMZBOCLSA-N 1 2 242.326 2.453 20 0 BEADLO Cc1ncc(C[N@H+]2CCOC[C@H]2CC(C)C)cn1 ZINC000352001578 134033757 /nfs/dbraw/zinc/03/37/57/134033757.db2.gz CGXZLDKPKLTANH-CQSZACIVSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1ncc(C[N@@H+]2CCOC[C@H]2CC(C)C)cn1 ZINC000352001578 134033758 /nfs/dbraw/zinc/03/37/58/134033758.db2.gz CGXZLDKPKLTANH-CQSZACIVSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H](C)CC(C)(C)C2)no1 ZINC000335992436 134041143 /nfs/dbraw/zinc/04/11/43/134041143.db2.gz CVFDZSJXPSRFMH-SECBINFHSA-N 1 2 223.320 2.246 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H](C)CC(C)(C)C2)no1 ZINC000335992436 134041144 /nfs/dbraw/zinc/04/11/44/134041144.db2.gz CVFDZSJXPSRFMH-SECBINFHSA-N 1 2 223.320 2.246 20 0 BEADLO C[C@H]1C[N@H+](Cc2csnn2)CC(C)(C)C1 ZINC000335996177 134042351 /nfs/dbraw/zinc/04/23/51/134042351.db2.gz YHURYADZQCIOFG-SECBINFHSA-N 1 2 225.361 2.406 20 0 BEADLO C[C@H]1C[N@@H+](Cc2csnn2)CC(C)(C)C1 ZINC000335996177 134042352 /nfs/dbraw/zinc/04/23/52/134042352.db2.gz YHURYADZQCIOFG-SECBINFHSA-N 1 2 225.361 2.406 20 0 BEADLO C[C@H]1CCN(C(=O)CCn2cc[nH+]c2)CC1(C)C ZINC000336004588 134048563 /nfs/dbraw/zinc/04/85/63/134048563.db2.gz BOLHJMGDBXTMSP-LBPRGKRZSA-N 1 2 249.358 2.168 20 0 BEADLO C[C@H]1C[C@H]1C[NH+]=c1[nH]c2c(cccc2F)n1C ZINC000352075233 134055661 /nfs/dbraw/zinc/05/56/61/134055661.db2.gz CATFDTYGANZYRL-IUCAKERBSA-N 1 2 233.290 2.202 20 0 BEADLO CC[C@H]1C[C@@H](C)CN1c1cc(C)[nH+]cn1 ZINC000336039601 134060444 /nfs/dbraw/zinc/06/04/44/134060444.db2.gz HALZSQULZPNMEX-KOLCDFICSA-N 1 2 205.305 2.410 20 0 BEADLO CN(Cc1c[nH+]cn1C)c1ccc(F)c(F)c1 ZINC000336082956 134075705 /nfs/dbraw/zinc/07/57/05/134075705.db2.gz YIRCBCHBIXVZMO-UHFFFAOYSA-N 1 2 237.253 2.335 20 0 BEADLO CCc1occc1C(=O)Nc1cc[nH+]c(C)c1 ZINC000336111726 134086840 /nfs/dbraw/zinc/08/68/40/134086840.db2.gz JLAGPQQLKQDUHJ-UHFFFAOYSA-N 1 2 230.267 2.220 20 0 BEADLO CCc1nc(C)c(C[N@@H+]2C[C@@H](C)OC[C@H]2C)o1 ZINC000336116406 134088543 /nfs/dbraw/zinc/08/85/43/134088543.db2.gz XKOLIOOGRCEAOR-NXEZZACHSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1nc(C)c(C[N@H+]2C[C@@H](C)OC[C@H]2C)o1 ZINC000336116406 134088544 /nfs/dbraw/zinc/08/85/44/134088544.db2.gz XKOLIOOGRCEAOR-NXEZZACHSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1nc(C)c(C[N@@H+]2C[C@H](C)OC[C@H]2C)o1 ZINC000336116409 134088615 /nfs/dbraw/zinc/08/86/15/134088615.db2.gz XKOLIOOGRCEAOR-ZJUUUORDSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1nc(C)c(C[N@H+]2C[C@H](C)OC[C@H]2C)o1 ZINC000336116409 134088616 /nfs/dbraw/zinc/08/86/16/134088616.db2.gz XKOLIOOGRCEAOR-ZJUUUORDSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1nc(C)c(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)o1 ZINC000336118891 134089341 /nfs/dbraw/zinc/08/93/41/134089341.db2.gz XSYPZICKNZSRDA-AOOOYVTPSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1nc(C)c(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)o1 ZINC000336118891 134089342 /nfs/dbraw/zinc/08/93/42/134089342.db2.gz XSYPZICKNZSRDA-AOOOYVTPSA-N 1 2 238.331 2.155 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CC[C@H]2CCC[C@H]21 ZINC000336121698 134091481 /nfs/dbraw/zinc/09/14/81/134091481.db2.gz QTOWAMUAQKDMJT-DGCLKSJQSA-N 1 2 245.326 2.218 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@@H](C)c2noc(C)n2)CCS1 ZINC000336122197 134091610 /nfs/dbraw/zinc/09/16/10/134091610.db2.gz VRRJMRGSSLTQFP-WCBMZHEXSA-N 1 2 241.360 2.266 20 0 BEADLO CC[C@@H]1C[N@H+]([C@@H](C)c2noc(C)n2)CCS1 ZINC000336122197 134091611 /nfs/dbraw/zinc/09/16/11/134091611.db2.gz VRRJMRGSSLTQFP-WCBMZHEXSA-N 1 2 241.360 2.266 20 0 BEADLO C[C@@H]1C[C@H](COc2cc[nH+]cc2)CCO1 ZINC000336134213 134095608 /nfs/dbraw/zinc/09/56/08/134095608.db2.gz XWVAVPHSAWKVFA-GHMZBOCLSA-N 1 2 207.273 2.276 20 0 BEADLO C[C@H](C(=O)N1CCC(c2c[nH+]c[nH]2)CC1)C1CC1 ZINC000336142621 134100870 /nfs/dbraw/zinc/10/08/70/134100870.db2.gz PXGMNJTYRMPNER-JTQLQIEISA-N 1 2 247.342 2.162 20 0 BEADLO C[C@H](C(=O)N1CCC(c2c[nH]c[nH+]2)CC1)C1CC1 ZINC000336142621 134100871 /nfs/dbraw/zinc/10/08/71/134100871.db2.gz PXGMNJTYRMPNER-JTQLQIEISA-N 1 2 247.342 2.162 20 0 BEADLO C[C@@H](C(=O)N1CCC(c2c[nH+]c[nH]2)CC1)C1CC1 ZINC000336142622 134100938 /nfs/dbraw/zinc/10/09/38/134100938.db2.gz PXGMNJTYRMPNER-SNVBAGLBSA-N 1 2 247.342 2.162 20 0 BEADLO C[C@@H](C(=O)N1CCC(c2c[nH]c[nH+]2)CC1)C1CC1 ZINC000336142622 134100939 /nfs/dbraw/zinc/10/09/39/134100939.db2.gz PXGMNJTYRMPNER-SNVBAGLBSA-N 1 2 247.342 2.162 20 0 BEADLO C[C@@H]1C[C@@H](C)N(C(=O)c2ccc3[nH+]ccn3c2)C1 ZINC000336183755 134120646 /nfs/dbraw/zinc/12/06/46/134120646.db2.gz ZICCGRXLAZXQEH-GHMZBOCLSA-N 1 2 243.310 2.205 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@H]1CC[C@@H](C)C1 ZINC000336183918 134120683 /nfs/dbraw/zinc/12/06/83/134120683.db2.gz GDLUTQHQBCLYQS-KOLCDFICSA-N 1 2 233.315 2.122 20 0 BEADLO c1cc(N2CC[C@@H]2C2CC2)nc(C2CC2)[nH+]1 ZINC000336198609 134127189 /nfs/dbraw/zinc/12/71/89/134127189.db2.gz JPPRFCDQPXKSDK-LLVKDONJSA-N 1 2 215.300 2.343 20 0 BEADLO CCN(C)C(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000336210175 134133996 /nfs/dbraw/zinc/13/39/96/134133996.db2.gz CFXLNJFIKKNZFS-SNVBAGLBSA-N 1 2 236.319 2.008 20 0 BEADLO C[C@@H]1COCC[N@@H+]1Cc1ccnn1C1CCCC1 ZINC000336213095 134134979 /nfs/dbraw/zinc/13/49/79/134134979.db2.gz AOCOTSDRHNXXDN-GFCCVEGCSA-N 1 2 249.358 2.219 20 0 BEADLO C[C@@H]1COCC[N@H+]1Cc1ccnn1C1CCCC1 ZINC000336213095 134134980 /nfs/dbraw/zinc/13/49/80/134134980.db2.gz AOCOTSDRHNXXDN-GFCCVEGCSA-N 1 2 249.358 2.219 20 0 BEADLO COc1cc(F)cc(C[N@@H+]2CCO[C@@H](C)C2)c1 ZINC000336217822 134137804 /nfs/dbraw/zinc/13/78/04/134137804.db2.gz SFXDMAKBYXHSIR-JTQLQIEISA-N 1 2 239.290 2.055 20 0 BEADLO COc1cc(F)cc(C[N@H+]2CCO[C@@H](C)C2)c1 ZINC000336217822 134137805 /nfs/dbraw/zinc/13/78/05/134137805.db2.gz SFXDMAKBYXHSIR-JTQLQIEISA-N 1 2 239.290 2.055 20 0 BEADLO CC(C)[C@H](C)CNC(=O)c1ccc2[nH+]ccn2c1 ZINC000172450584 134266229 /nfs/dbraw/zinc/26/62/29/134266229.db2.gz SRAJSIZAZXGAEN-LLVKDONJSA-N 1 2 245.326 2.356 20 0 BEADLO Cc1cnc([C@H]([NH2+]Cc2cnc[nH]2)C2CC2)s1 ZINC000174545742 134282296 /nfs/dbraw/zinc/28/22/96/134282296.db2.gz YRQKLDIEHMWWJI-LLVKDONJSA-N 1 2 248.355 2.416 20 0 BEADLO C[N@H+](Cc1nccs1)Cc1ccncc1 ZINC000175299511 134286844 /nfs/dbraw/zinc/28/68/44/134286844.db2.gz CWOPRAKWNHZVOU-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO C[N@@H+](Cc1nccs1)Cc1ccncc1 ZINC000175299511 134286845 /nfs/dbraw/zinc/28/68/45/134286845.db2.gz CWOPRAKWNHZVOU-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H]1C[C@@H]1C1CC1 ZINC000176975334 134295514 /nfs/dbraw/zinc/29/55/14/134295514.db2.gz ITPPVSAIOBSWRQ-NXEZZACHSA-N 1 2 232.283 2.075 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)CC1CCC(C)(C)CC1 ZINC000179794292 134323988 /nfs/dbraw/zinc/32/39/88/134323988.db2.gz PCYJCBGQBXTGBY-UHFFFAOYSA-N 1 2 236.363 2.453 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)CC1CCC(C)(C)CC1 ZINC000179794292 134323989 /nfs/dbraw/zinc/32/39/89/134323989.db2.gz PCYJCBGQBXTGBY-UHFFFAOYSA-N 1 2 236.363 2.453 20 0 BEADLO Cc1cc(NC(=O)c2ccncc2F)cc[nH+]1 ZINC000226225902 134361367 /nfs/dbraw/zinc/36/13/67/134361367.db2.gz GFBBHMCOAXWZPD-UHFFFAOYSA-N 1 2 231.230 2.176 20 0 BEADLO CCOC(=O)C[N@@H+]1C[C@H](C)C[C@@H]1c1cccnc1 ZINC000184897876 134369695 /nfs/dbraw/zinc/36/96/95/134369695.db2.gz CSUAXBZBRVXPPA-DGCLKSJQSA-N 1 2 248.326 2.028 20 0 BEADLO CCOC(=O)C[N@H+]1C[C@H](C)C[C@@H]1c1cccnc1 ZINC000184897876 134369696 /nfs/dbraw/zinc/36/96/96/134369696.db2.gz CSUAXBZBRVXPPA-DGCLKSJQSA-N 1 2 248.326 2.028 20 0 BEADLO CCN(CC)c1ccc(NCC2(C)COC2)c[nH+]1 ZINC000227522067 134382736 /nfs/dbraw/zinc/38/27/36/134382736.db2.gz YNNGFRXBPAKLKV-UHFFFAOYSA-N 1 2 249.358 2.376 20 0 BEADLO CCC[N@H+](C)Cc1noc(C(C)(C)C)n1 ZINC000063756022 134396475 /nfs/dbraw/zinc/39/64/75/134396475.db2.gz FOBIDAVVCGKBPN-UHFFFAOYSA-N 1 2 211.309 2.209 20 0 BEADLO CCC[N@@H+](C)Cc1noc(C(C)(C)C)n1 ZINC000063756022 134396476 /nfs/dbraw/zinc/39/64/76/134396476.db2.gz FOBIDAVVCGKBPN-UHFFFAOYSA-N 1 2 211.309 2.209 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H](C)[C@@H](C)c1ccccc1 ZINC000193097278 134592652 /nfs/dbraw/zinc/59/26/52/134592652.db2.gz GLWJGVMAWUBBFY-GRYCIOLGSA-N 1 2 235.327 2.330 20 0 BEADLO Cc1cc(NC(=O)CCOCC(C)C)cc[nH+]1 ZINC000075936778 134989739 /nfs/dbraw/zinc/98/97/39/134989739.db2.gz MXAGECPQQJMWTQ-UHFFFAOYSA-N 1 2 236.315 2.391 20 0 BEADLO Cc1csc([C@@H](C)[NH2+]Cc2ccnn2C)n1 ZINC000070732500 135010740 /nfs/dbraw/zinc/01/07/40/135010740.db2.gz WBADAVJZQQZWDL-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO CC[C@H]([NH2+][C@H]1C[C@H]1c1ccccc1)C(=O)OC ZINC000252721804 135103100 /nfs/dbraw/zinc/10/31/00/135103100.db2.gz OTOJEOINIMJWSJ-AVGNSLFASA-N 1 2 233.311 2.084 20 0 BEADLO Cc1ccc(C(=O)Nc2cc[nH+]c(C)c2)n1C ZINC000078230969 135109270 /nfs/dbraw/zinc/10/92/70/135109270.db2.gz CWRXKLFUNFLWFZ-UHFFFAOYSA-N 1 2 229.283 2.289 20 0 BEADLO Cc1cc(N[C@@H]2CCOC2)nc(C(C)C)[nH+]1 ZINC000087787912 135171485 /nfs/dbraw/zinc/17/14/85/135171485.db2.gz VEJGDNYURZPKSF-SNVBAGLBSA-N 1 2 221.304 2.109 20 0 BEADLO Cc1cc(CNc2[nH+]c3ccccc3n2C)on1 ZINC000079046477 135268061 /nfs/dbraw/zinc/26/80/61/135268061.db2.gz LZLACQXKNYGMKI-UHFFFAOYSA-N 1 2 242.282 2.482 20 0 BEADLO C[NH2+]Cc1noc([C@H]2CCCCC2(F)F)n1 ZINC000262231074 135285959 /nfs/dbraw/zinc/28/59/59/135285959.db2.gz NYQOVVYABOLJMV-SSDOTTSWSA-N 1 2 231.246 2.082 20 0 BEADLO FC1(F)CCN(c2cc[nH+]c3ccncc32)C1 ZINC000334298261 135335017 /nfs/dbraw/zinc/33/50/17/135335017.db2.gz NVLGOSWOAPUQPY-UHFFFAOYSA-N 1 2 235.237 2.475 20 0 BEADLO Cc1cc(N2CCC[C@H]2C(C)C)nc[nH+]1 ZINC000334313383 135351563 /nfs/dbraw/zinc/35/15/63/135351563.db2.gz NIORYXIZNMMHNA-NSHDSACASA-N 1 2 205.305 2.410 20 0 BEADLO Fc1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)cc1F ZINC000334351110 135368578 /nfs/dbraw/zinc/36/85/78/135368578.db2.gz GESOVXRRQMWSSN-PHIMTYICSA-N 1 2 239.265 2.328 20 0 BEADLO Fc1ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)cc1F ZINC000334351110 135368579 /nfs/dbraw/zinc/36/85/79/135368579.db2.gz GESOVXRRQMWSSN-PHIMTYICSA-N 1 2 239.265 2.328 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CC[C@](C)(F)C2)cn1 ZINC000334354130 135370053 /nfs/dbraw/zinc/37/00/53/135370053.db2.gz JGINJPIZHRHQCI-LBPRGKRZSA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1cc(C[N@H+]2CC[C@](C)(F)C2)cn1 ZINC000334354130 135370055 /nfs/dbraw/zinc/37/00/55/135370055.db2.gz JGINJPIZHRHQCI-LBPRGKRZSA-N 1 2 225.311 2.398 20 0 BEADLO Cn1cccc1C[N@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000334357712 135370157 /nfs/dbraw/zinc/37/01/57/135370157.db2.gz QRDRJNROPHUUFY-KGLIPLIRSA-N 1 2 234.343 2.169 20 0 BEADLO CC[C@H](C)[N@H+](C)CC[NH2+][C@@H]1CC[C@H](C)C1 ZINC000164488177 135370452 /nfs/dbraw/zinc/37/04/52/135370452.db2.gz KOYWOJNTSUNJNL-RWMBFGLXSA-N 1 2 212.381 2.495 20 0 BEADLO CC[C@H](C)N(C)CC[NH2+][C@@H]1CC[C@H](C)C1 ZINC000164488177 135370454 /nfs/dbraw/zinc/37/04/54/135370454.db2.gz KOYWOJNTSUNJNL-RWMBFGLXSA-N 1 2 212.381 2.495 20 0 BEADLO CC1C[NH+](Cc2cncc(Br)c2)C1 ZINC000306390070 135372268 /nfs/dbraw/zinc/37/22/68/135372268.db2.gz XXXKRGJQHWWKTF-UHFFFAOYSA-N 1 2 241.132 2.296 20 0 BEADLO Cn1ncnc1C[N@@H+]1CCC[C@H]1c1ccsc1 ZINC000334366694 135374145 /nfs/dbraw/zinc/37/41/45/135374145.db2.gz QCFMTKIBCGLXDT-NSHDSACASA-N 1 2 248.355 2.214 20 0 BEADLO Cn1ncnc1C[N@H+]1CCC[C@H]1c1ccsc1 ZINC000334366694 135374146 /nfs/dbraw/zinc/37/41/46/135374146.db2.gz QCFMTKIBCGLXDT-NSHDSACASA-N 1 2 248.355 2.214 20 0 BEADLO OC[C@@]1(F)CC[N@H+](Cc2ccccc2Cl)C1 ZINC000334420570 135399945 /nfs/dbraw/zinc/39/99/45/135399945.db2.gz AEKHAFVTMCTBRN-GFCCVEGCSA-N 1 2 243.709 2.246 20 0 BEADLO OC[C@@]1(F)CC[N@@H+](Cc2ccccc2Cl)C1 ZINC000334420570 135399947 /nfs/dbraw/zinc/39/99/47/135399947.db2.gz AEKHAFVTMCTBRN-GFCCVEGCSA-N 1 2 243.709 2.246 20 0 BEADLO c1cc(C[NH2+][C@H]2CSc3ccccc32)n[nH]1 ZINC000083748879 135455593 /nfs/dbraw/zinc/45/55/93/135455593.db2.gz BWAKNBBOOBMRNU-NSHDSACASA-N 1 2 231.324 2.346 20 0 BEADLO Cc1cc(NC(=O)N(C)[C@H]2CC[C@H](C)C2)cc[nH+]1 ZINC000335231522 135968204 /nfs/dbraw/zinc/96/82/04/135968204.db2.gz RFFDCPYESXFGCK-GWCFXTLKSA-N 1 2 247.342 2.464 20 0 BEADLO CCc1nc(C[NH2+]Cc2ncccc2O)cs1 ZINC000347803608 136013472 /nfs/dbraw/zinc/01/34/72/136013472.db2.gz FSOZXEPZMAXPQX-UHFFFAOYSA-N 1 2 249.339 2.096 20 0 BEADLO O=C(C1=CCCCCC1)N1CCn2cc[nH+]c2C1 ZINC000335318224 136025787 /nfs/dbraw/zinc/02/57/87/136025787.db2.gz ARHUISPVYHRXGS-UHFFFAOYSA-N 1 2 245.326 2.116 20 0 BEADLO CCN(C)C(=O)C[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000335311963 136030115 /nfs/dbraw/zinc/03/01/15/136030115.db2.gz YWFBREZFCSGYQT-NSHDSACASA-N 1 2 232.327 2.042 20 0 BEADLO CCN(C)C(=O)C[N@H+]1Cc2ccccc2[C@@H]1C ZINC000335311963 136030116 /nfs/dbraw/zinc/03/01/16/136030116.db2.gz YWFBREZFCSGYQT-NSHDSACASA-N 1 2 232.327 2.042 20 0 BEADLO O=C(C1=CCCC1)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000335314553 136031814 /nfs/dbraw/zinc/03/18/14/136031814.db2.gz GETFBKDYJABQPZ-LLVKDONJSA-N 1 2 231.299 2.184 20 0 BEADLO CC[C@H](Nc1cc(C)[nH+]cn1)C1CCOCC1 ZINC000348181228 136043241 /nfs/dbraw/zinc/04/32/41/136043241.db2.gz NGYUCKWOVSOEFD-LBPRGKRZSA-N 1 2 235.331 2.402 20 0 BEADLO O=C(C1CC=CC1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000335323249 136050445 /nfs/dbraw/zinc/05/04/45/136050445.db2.gz ANHVXUZSMHYWKZ-NSHDSACASA-N 1 2 231.299 2.039 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)C1=C(C)CCC1 ZINC000348329282 136071192 /nfs/dbraw/zinc/07/11/92/136071192.db2.gz QPNPMVJRSUVHEQ-UHFFFAOYSA-N 1 2 246.310 2.207 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)CCC1CCC1 ZINC000348365477 136073340 /nfs/dbraw/zinc/07/33/40/136073340.db2.gz BQRKSJXMENTEKJ-UHFFFAOYSA-N 1 2 248.326 2.287 20 0 BEADLO Cc1nc(N[C@H]2CCC[C@@H](F)C2)cc[nH+]1 ZINC000335379759 136086803 /nfs/dbraw/zinc/08/68/03/136086803.db2.gz MOCITUCGSILPLB-ZJUUUORDSA-N 1 2 209.268 2.478 20 0 BEADLO Cn1c2c(cccc2F)[nH+]c1N1CC[C@H](F)C1 ZINC000335398604 136093241 /nfs/dbraw/zinc/09/32/41/136093241.db2.gz BAWJTBCMFYQKDT-QMMMGPOBSA-N 1 2 237.253 2.261 20 0 BEADLO CC1(C(N)=O)C[NH+](Cc2ccncc2Cl)C1 ZINC000335398121 136093412 /nfs/dbraw/zinc/09/34/12/136093412.db2.gz RNIYVJKGCFBIDU-UHFFFAOYSA-N 1 2 239.706 2.092 20 0 BEADLO Cc1nc(N2CC[C@H](F)C2)c2c([nH+]1)CCCC2 ZINC000335401801 136094489 /nfs/dbraw/zinc/09/44/89/136094489.db2.gz VATIIOPOZMSXOS-JTQLQIEISA-N 1 2 235.306 2.212 20 0 BEADLO O[C@@H]1CCCN(c2[nH+]ccc3cc(F)ccc32)C1 ZINC000335589301 136102558 /nfs/dbraw/zinc/10/25/58/136102558.db2.gz HOUFHZBANTVDCZ-GFCCVEGCSA-N 1 2 246.285 2.335 20 0 BEADLO Cc1cc[nH+]cc1Cn1cnc(C(C)(C)C)n1 ZINC000335595960 136104782 /nfs/dbraw/zinc/10/47/82/136104782.db2.gz LJWPEHXCCDFFJV-UHFFFAOYSA-N 1 2 230.315 2.327 20 0 BEADLO Cc1cc(C)c(CNC(=O)N2[C@@H](C)C[C@@H]2C)c[nH+]1 ZINC000335576064 136111134 /nfs/dbraw/zinc/11/11/34/136111134.db2.gz DADJVJHCTPWHRM-RYUDHWBXSA-N 1 2 247.342 2.391 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)CCC2CC2)[nH+]1 ZINC001647824486 1172766043 /nfs/dbraw/zinc/76/60/43/1172766043.db2.gz HFGJSTBWKDFFMH-UHFFFAOYSA-N 1 2 235.331 2.340 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)CCC2CC2)c[nH+]1 ZINC001647824486 1172766048 /nfs/dbraw/zinc/76/60/48/1172766048.db2.gz HFGJSTBWKDFFMH-UHFFFAOYSA-N 1 2 235.331 2.340 20 0 BEADLO Cc1ccc(N[C@@H](C)c2cn[nH]c2)c[nH+]1 ZINC000281087402 397751579 /nfs/dbraw/zinc/75/15/79/397751579.db2.gz VAAVVLUWJBATNS-VIFPVBQESA-N 1 2 202.261 2.286 20 0 BEADLO CC[C@@H](C)[C@H](C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000356556782 397931385 /nfs/dbraw/zinc/93/13/85/397931385.db2.gz YVUBSDZUMAZHNX-ZJUUUORDSA-N 1 2 223.320 2.050 20 0 BEADLO Cc1nnsc1C[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000649577996 397966374 /nfs/dbraw/zinc/96/63/74/397966374.db2.gz BFRQDENIGIJIDR-APPZFPTMSA-N 1 2 229.324 2.026 20 0 BEADLO Cc1nnsc1C[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000649577996 397966376 /nfs/dbraw/zinc/96/63/76/397966376.db2.gz BFRQDENIGIJIDR-APPZFPTMSA-N 1 2 229.324 2.026 20 0 BEADLO Cc1nnsc1C[N@H+]1CC[C@H](C)[C@H](F)C1 ZINC000649577998 397966499 /nfs/dbraw/zinc/96/64/99/397966499.db2.gz BFRQDENIGIJIDR-IONNQARKSA-N 1 2 229.324 2.026 20 0 BEADLO Cc1nnsc1C[N@@H+]1CC[C@H](C)[C@H](F)C1 ZINC000649577998 397966502 /nfs/dbraw/zinc/96/65/02/397966502.db2.gz BFRQDENIGIJIDR-IONNQARKSA-N 1 2 229.324 2.026 20 0 BEADLO COC(=O)[C@H]([NH2+]CC1(C)CC1)c1ccccc1 ZINC000358965223 397945188 /nfs/dbraw/zinc/94/51/88/397945188.db2.gz MMTUNIFVKVZJBS-GFCCVEGCSA-N 1 2 233.311 2.290 20 0 BEADLO COc1ccc(NCc2oc(C)nc2C)[nH+]c1 ZINC000382476624 397952312 /nfs/dbraw/zinc/95/23/12/397952312.db2.gz GWKMSNCOULOZSY-UHFFFAOYSA-N 1 2 233.271 2.307 20 0 BEADLO CC[C@H]([NH2+][C@@H]1C[C@H]1CC(C)(C)C)C(=O)OC ZINC000593182557 397956517 /nfs/dbraw/zinc/95/65/17/397956517.db2.gz UBUVCBBYPLBNLN-GARJFASQSA-N 1 2 227.348 2.352 20 0 BEADLO CC(C)c1cc(C(=O)Nc2ccc(N)[nH+]c2)on1 ZINC000269150216 397956519 /nfs/dbraw/zinc/95/65/19/397956519.db2.gz MWYAHACTBSJTEI-UHFFFAOYSA-N 1 2 246.270 2.028 20 0 BEADLO Fc1ccc2c(c1)C[N@@H+](Cc1ccno1)CC2 ZINC000269613317 397958229 /nfs/dbraw/zinc/95/82/29/397958229.db2.gz CACLZDBUIUWFEZ-UHFFFAOYSA-N 1 2 232.258 2.372 20 0 BEADLO Fc1ccc2c(c1)C[N@H+](Cc1ccno1)CC2 ZINC000269613317 397958231 /nfs/dbraw/zinc/95/82/31/397958231.db2.gz CACLZDBUIUWFEZ-UHFFFAOYSA-N 1 2 232.258 2.372 20 0 BEADLO Clc1ccc(C[NH+]2CC3(C2)CCOC3)o1 ZINC000336576490 397909804 /nfs/dbraw/zinc/90/98/04/397909804.db2.gz ZQXVORBAGOQOGK-UHFFFAOYSA-N 1 2 227.691 2.155 20 0 BEADLO CCCCCCC(=O)NCc1[nH+]ccn1C ZINC000264307416 397919081 /nfs/dbraw/zinc/91/90/81/397919081.db2.gz NAIRUWAVVCCPDI-UHFFFAOYSA-N 1 2 223.320 2.007 20 0 BEADLO O[C@H]1CCCC[C@H]1C[N@H+](CC(F)F)C1CC1 ZINC000382218993 397923664 /nfs/dbraw/zinc/92/36/64/397923664.db2.gz MNYOFRTYIUDJAU-ONGXEEELSA-N 1 2 233.302 2.267 20 0 BEADLO O[C@H]1CCCC[C@H]1C[N@@H+](CC(F)F)C1CC1 ZINC000382218993 397923668 /nfs/dbraw/zinc/92/36/68/397923668.db2.gz MNYOFRTYIUDJAU-ONGXEEELSA-N 1 2 233.302 2.267 20 0 BEADLO Cn1cc(Cl)c(C[NH2+]Cc2ccccc2)n1 ZINC000307380738 397996659 /nfs/dbraw/zinc/99/66/59/397996659.db2.gz FXYRROKMJHHKMK-UHFFFAOYSA-N 1 2 235.718 2.363 20 0 BEADLO CC(=O)C[N@@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000639876246 398000167 /nfs/dbraw/zinc/00/01/67/398000167.db2.gz BPZKXMCTLARGSY-GFCCVEGCSA-N 1 2 218.300 2.054 20 0 BEADLO CC(=O)C[N@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000639876246 398000172 /nfs/dbraw/zinc/00/01/72/398000172.db2.gz BPZKXMCTLARGSY-GFCCVEGCSA-N 1 2 218.300 2.054 20 0 BEADLO CCC[C@H]1CCC[C@H]1c1nc(C[NH2+]C)no1 ZINC000414648108 398001279 /nfs/dbraw/zinc/00/12/79/398001279.db2.gz VECLUDGCDSAGTD-VHSXEESVSA-N 1 2 223.320 2.473 20 0 BEADLO CC[C@@H](C)NC(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000117559587 398002168 /nfs/dbraw/zinc/00/21/68/398002168.db2.gz XTDAZQZMBFLVFR-LLVKDONJSA-N 1 2 243.310 2.401 20 0 BEADLO COCc1cc[nH+]c(NCc2c(C)n[nH]c2C)c1 ZINC000650245010 398007463 /nfs/dbraw/zinc/00/74/63/398007463.db2.gz YQOZEKCCMIXRLS-UHFFFAOYSA-N 1 2 246.314 2.180 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1C(=O)N(C)Cc1[nH+]ccn1C ZINC000274672766 398012317 /nfs/dbraw/zinc/01/23/17/398012317.db2.gz KBMYJNGMXNFULP-FZMZJTMJSA-N 1 2 249.358 2.061 20 0 BEADLO Clc1nc(C[N@@H+]2CC[C@@H]3C[C@@H]32)cs1 ZINC000575597795 398017343 /nfs/dbraw/zinc/01/73/43/398017343.db2.gz SKBSYCXKOQFBAK-SVRRBLITSA-N 1 2 214.721 2.391 20 0 BEADLO Clc1nc(C[N@H+]2CC[C@@H]3C[C@@H]32)cs1 ZINC000575597795 398017347 /nfs/dbraw/zinc/01/73/47/398017347.db2.gz SKBSYCXKOQFBAK-SVRRBLITSA-N 1 2 214.721 2.391 20 0 BEADLO Cc1ccc([C@H](C)Nc2nc(C)[nH+]c(N)n2)cc1 ZINC000197838884 398021093 /nfs/dbraw/zinc/02/10/93/398021093.db2.gz MULBNHNNKWZCCN-VIFPVBQESA-N 1 2 243.314 2.244 20 0 BEADLO Cc1ccc([C@H](C)Nc2nc(N)nc(C)[nH+]2)cc1 ZINC000197838884 398021094 /nfs/dbraw/zinc/02/10/94/398021094.db2.gz MULBNHNNKWZCCN-VIFPVBQESA-N 1 2 243.314 2.244 20 0 BEADLO Cc1ccc([C@@H](C)Nc2nc(C)[nH+]c(N)n2)cc1 ZINC000197838876 398021229 /nfs/dbraw/zinc/02/12/29/398021229.db2.gz MULBNHNNKWZCCN-SECBINFHSA-N 1 2 243.314 2.244 20 0 BEADLO Cc1ccc([C@@H](C)Nc2nc(N)nc(C)[nH+]2)cc1 ZINC000197838876 398021232 /nfs/dbraw/zinc/02/12/32/398021232.db2.gz MULBNHNNKWZCCN-SECBINFHSA-N 1 2 243.314 2.244 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1cccc(F)c1)c1ncn(C)n1 ZINC000275598719 398041030 /nfs/dbraw/zinc/04/10/30/398041030.db2.gz IYESIOPREACWSR-UWVGGRQHSA-N 1 2 248.305 2.366 20 0 BEADLO CCCCNC(=O)CC[N@@H+]1CCCC(F)(F)C1 ZINC000649692965 398041260 /nfs/dbraw/zinc/04/12/60/398041260.db2.gz LRKGYVYKVOXIOH-UHFFFAOYSA-N 1 2 248.317 2.024 20 0 BEADLO CCCCNC(=O)CC[N@H+]1CCCC(F)(F)C1 ZINC000649692965 398041262 /nfs/dbraw/zinc/04/12/62/398041262.db2.gz LRKGYVYKVOXIOH-UHFFFAOYSA-N 1 2 248.317 2.024 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N1CCC[C@@H]2CCC[C@@H]21 ZINC000279262255 398042450 /nfs/dbraw/zinc/04/24/50/398042450.db2.gz VEJRLFZARVQSKH-RYUDHWBXSA-N 1 2 247.342 2.133 20 0 BEADLO CCc1nc(C[N@@H+]2CCOCC[C@@H]2C)cs1 ZINC000362047083 397980295 /nfs/dbraw/zinc/98/02/95/397980295.db2.gz QCARSBRVNQTZPK-JTQLQIEISA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nc(C[N@H+]2CCOCC[C@@H]2C)cs1 ZINC000362047083 397980296 /nfs/dbraw/zinc/98/02/96/397980296.db2.gz QCARSBRVNQTZPK-JTQLQIEISA-N 1 2 240.372 2.316 20 0 BEADLO CCO[C@@H]1C[C@H](Nc2cccc[nH+]2)[C@@]12CCCO2 ZINC000272669834 397982917 /nfs/dbraw/zinc/98/29/17/397982917.db2.gz KDKVYUSQQRVWNJ-SCRDCRAPSA-N 1 2 248.326 2.220 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccno2)[C@H](CC)CO1 ZINC000649718937 398061523 /nfs/dbraw/zinc/06/15/23/398061523.db2.gz JIQHBRQDVQUKQJ-GHMZBOCLSA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccno2)[C@H](CC)CO1 ZINC000649718937 398061525 /nfs/dbraw/zinc/06/15/25/398061525.db2.gz JIQHBRQDVQUKQJ-GHMZBOCLSA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@H]1C[N@H+](Cc2nc(C)cs2)[C@H](C)CO1 ZINC000649734451 398074419 /nfs/dbraw/zinc/07/44/19/398074419.db2.gz WWGOVWJFBPSQMR-MNOVXSKESA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2nc(C)cs2)[C@H](C)CO1 ZINC000649734451 398074421 /nfs/dbraw/zinc/07/44/21/398074421.db2.gz WWGOVWJFBPSQMR-MNOVXSKESA-N 1 2 240.372 2.451 20 0 BEADLO Cc1cnc(NCCc2[nH+]cccc2C)nc1 ZINC000295769285 398086986 /nfs/dbraw/zinc/08/69/86/398086986.db2.gz PQMRTTXHYGAMSI-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@@H+]1Cc1cc(C)on1 ZINC000649714814 398056580 /nfs/dbraw/zinc/05/65/80/398056580.db2.gz MXPOTLUAQKAXQV-LBPRGKRZSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@H+]1Cc1cc(C)on1 ZINC000649714814 398056583 /nfs/dbraw/zinc/05/65/83/398056583.db2.gz MXPOTLUAQKAXQV-LBPRGKRZSA-N 1 2 238.331 2.372 20 0 BEADLO CCc1cc(N[C@H](C)CC(C)(C)O)nc[nH+]1 ZINC000384908232 398116133 /nfs/dbraw/zinc/11/61/33/398116133.db2.gz PJHOVFSVJPITDI-SECBINFHSA-N 1 2 223.320 2.000 20 0 BEADLO CCn1cc(C[N@H+](Cc2cc[nH]n2)C(C)C)cn1 ZINC000649814395 398120025 /nfs/dbraw/zinc/12/00/25/398120025.db2.gz MINUHJAFNVHURN-UHFFFAOYSA-N 1 2 247.346 2.037 20 0 BEADLO CCn1cc(C[N@@H+](Cc2cc[nH]n2)C(C)C)cn1 ZINC000649814395 398120030 /nfs/dbraw/zinc/12/00/30/398120030.db2.gz MINUHJAFNVHURN-UHFFFAOYSA-N 1 2 247.346 2.037 20 0 BEADLO CC1(C)CCC[C@H]1CNC(=O)CCn1cc[nH+]c1 ZINC000294035575 398120363 /nfs/dbraw/zinc/12/03/63/398120363.db2.gz DNAFAJIWNMTSDW-LBPRGKRZSA-N 1 2 249.358 2.216 20 0 BEADLO CCn1cc[nH+]c1CN1C[C@@H](C)OCC12CCC2 ZINC000649822812 398125477 /nfs/dbraw/zinc/12/54/77/398125477.db2.gz QBVWDAWARRQCDR-GFCCVEGCSA-N 1 2 249.358 2.046 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1C[C@@H](C)O[C@@H]1C ZINC000385058106 398128703 /nfs/dbraw/zinc/12/87/03/398128703.db2.gz CMROLIVKRQHWBC-OPRDCNLKSA-N 1 2 222.288 2.068 20 0 BEADLO COc1ccc(N[C@@H]2C[C@H](C)O[C@H]2C)[nH+]c1 ZINC000385083779 398132074 /nfs/dbraw/zinc/13/20/74/398132074.db2.gz FLMPZERTWSWYRN-ATZCPNFKSA-N 1 2 222.288 2.068 20 0 BEADLO CC(C)C[NH2+]c1ccc(-n2cncn2)cc1 ZINC000037768983 167016619 /nfs/dbraw/zinc/01/66/19/167016619.db2.gz FFGWPLOXWXVLCZ-UHFFFAOYSA-N 1 2 216.288 2.335 20 0 BEADLO Cc1cc(N2CC3(CCCC3)OC[C@@H]2C)nc[nH+]1 ZINC000664529668 487560999 /nfs/dbraw/zinc/56/09/99/487560999.db2.gz CCRXAOTXKRVMTC-LBPRGKRZSA-N 1 2 247.342 2.323 20 0 BEADLO CC(C)n1cc(C[NH2+]Cc2ncccc2F)cn1 ZINC000556410153 322911064 /nfs/dbraw/zinc/91/10/64/322911064.db2.gz GBEPIMWKAUBRRI-UHFFFAOYSA-N 1 2 248.305 2.288 20 0 BEADLO CCc1cc(N[C@@H]2C[C@H]2C)nc(CC)[nH+]1 ZINC001651299351 1172941822 /nfs/dbraw/zinc/94/18/22/1172941822.db2.gz UTCOBEHDPWDGTL-PSASIEDQSA-N 1 2 205.305 2.422 20 0 BEADLO CC1(C[NH+]2Cc3cc(F)c(F)cc3C2)COC1 ZINC000653833132 487595567 /nfs/dbraw/zinc/59/55/67/487595567.db2.gz BMYLCXMXMLMPNX-UHFFFAOYSA-N 1 2 239.265 2.317 20 0 BEADLO C[C@@H](N(C)C(=O)CCCn1cc[nH+]c1)C1(C)CC1 ZINC000674537522 487596275 /nfs/dbraw/zinc/59/62/75/487596275.db2.gz HOXQRJRHGNUSOW-GFCCVEGCSA-N 1 2 249.358 2.310 20 0 BEADLO CC(C)(C)C[C@@H]1CCN(C(=O)Cn2cc[nH+]c2)C1 ZINC000556693516 322919068 /nfs/dbraw/zinc/91/90/68/322919068.db2.gz NJLBDSWHBUBQES-LBPRGKRZSA-N 1 2 249.358 2.168 20 0 BEADLO Cc1cc(NC[C@H](CO)C2CC2)nc(C2CC2)[nH+]1 ZINC000685931651 487599808 /nfs/dbraw/zinc/59/98/08/487599808.db2.gz VMDLJRZKGQDUMN-GFCCVEGCSA-N 1 2 247.342 2.093 20 0 BEADLO Fc1cccnc1N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000674650513 487602082 /nfs/dbraw/zinc/60/20/82/487602082.db2.gz OQBNEXLZHJOYBG-LLVKDONJSA-N 1 2 246.289 2.259 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@](C)(C(F)F)C2)o1 ZINC000668823681 487604862 /nfs/dbraw/zinc/60/48/62/487604862.db2.gz BECAFAMQIQPJKE-LBPRGKRZSA-N 1 2 245.269 2.444 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@](C)(C(F)F)C2)o1 ZINC000668823681 487604867 /nfs/dbraw/zinc/60/48/67/487604867.db2.gz BECAFAMQIQPJKE-LBPRGKRZSA-N 1 2 245.269 2.444 20 0 BEADLO CC(C)SCC[N@@H+]1CCC(F)(F)C1 ZINC000336645030 167322315 /nfs/dbraw/zinc/32/23/15/167322315.db2.gz UBHBEYJFFZVWMW-UHFFFAOYSA-N 1 2 209.305 2.469 20 0 BEADLO CC(C)SCC[N@H+]1CCC(F)(F)C1 ZINC000336645030 167322317 /nfs/dbraw/zinc/32/23/17/167322317.db2.gz UBHBEYJFFZVWMW-UHFFFAOYSA-N 1 2 209.305 2.469 20 0 BEADLO Cc1ccoc1C[N@@H+]1CCO[C@@](C)(C(F)F)C1 ZINC000668824037 487606977 /nfs/dbraw/zinc/60/69/77/487606977.db2.gz DSLOYLFQUONTEL-GFCCVEGCSA-N 1 2 245.269 2.444 20 0 BEADLO Cc1ccoc1C[N@H+]1CCO[C@@](C)(C(F)F)C1 ZINC000668824037 487606981 /nfs/dbraw/zinc/60/69/81/487606981.db2.gz DSLOYLFQUONTEL-GFCCVEGCSA-N 1 2 245.269 2.444 20 0 BEADLO CSc1ccc[nH+]c1NCc1ccn(C)n1 ZINC000651970923 409940251 /nfs/dbraw/zinc/94/02/51/409940251.db2.gz OZUYKYQMQKSMOO-UHFFFAOYSA-N 1 2 234.328 2.149 20 0 BEADLO CSc1ccc[nH+]c1NCc1c[nH]nc1C ZINC000651971177 409941019 /nfs/dbraw/zinc/94/10/19/409941019.db2.gz YRLNPSWAPFYJPU-UHFFFAOYSA-N 1 2 234.328 2.447 20 0 BEADLO COC[C@@H](C)Nc1[nH+]cccc1SC ZINC000651971389 409942134 /nfs/dbraw/zinc/94/21/34/409942134.db2.gz CIBQJRRPJVNTFR-MRVPVSSYSA-N 1 2 212.318 2.250 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2ccco2)o1 ZINC000628120423 410021819 /nfs/dbraw/zinc/02/18/19/410021819.db2.gz MFLZHBJURQXCDA-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2ccco2)o1 ZINC000628120423 410021831 /nfs/dbraw/zinc/02/18/31/410021831.db2.gz MFLZHBJURQXCDA-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO C[C@@H](NC(=O)CCC(C)(F)F)c1[nH]cc[nH+]1 ZINC000655401889 410205690 /nfs/dbraw/zinc/20/56/90/410205690.db2.gz VFPCRSFQFPEMRV-SSDOTTSWSA-N 1 2 231.246 2.022 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CCC[C@@H](F)C1)c1[nH]cc[nH+]1 ZINC000655401978 410206053 /nfs/dbraw/zinc/20/60/53/410206053.db2.gz ONGPOUKKEWMJCN-KXUCPTDWSA-N 1 2 239.294 2.115 20 0 BEADLO COC[C@H](Cn1c[nH+]c2cc(C)c(C)cc21)OC ZINC000663931560 410385005 /nfs/dbraw/zinc/38/50/05/410385005.db2.gz CAMCAZDTGGEZJL-LBPRGKRZSA-N 1 2 248.326 2.315 20 0 BEADLO C[C@@]1(NC(=O)CCCn2cc[nH+]c2)CC=CCC1 ZINC000655454985 410450793 /nfs/dbraw/zinc/45/07/93/410450793.db2.gz IJZWXVUYBUIKTJ-CQSZACIVSA-N 1 2 247.342 2.278 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@@H](C)C1CCCC1 ZINC000650789168 410436321 /nfs/dbraw/zinc/43/63/21/410436321.db2.gz BEIZLDSVXAVFNA-NSHDSACASA-N 1 2 249.358 2.346 20 0 BEADLO CO[C@@H](CNc1cc(C)[nH+]cn1)C1CCCC1 ZINC000664559568 410603334 /nfs/dbraw/zinc/60/33/34/410603334.db2.gz DCLOWSXQZLTCOD-LBPRGKRZSA-N 1 2 235.331 2.402 20 0 BEADLO C[C@H](CC(=O)N1CCC[C@@H](C)C1)n1cc[nH+]c1 ZINC000650985527 410674294 /nfs/dbraw/zinc/67/42/94/410674294.db2.gz SSCNGPSGRXQJKQ-VXGBXAGGSA-N 1 2 235.331 2.093 20 0 BEADLO CC/C=C/CC[N@@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000661405463 410617686 /nfs/dbraw/zinc/61/76/86/410617686.db2.gz DLTXCUBZUKAAMC-HMDXOVGESA-N 1 2 219.275 2.045 20 0 BEADLO CC/C=C/CC[N@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000661405463 410617688 /nfs/dbraw/zinc/61/76/88/410617688.db2.gz DLTXCUBZUKAAMC-HMDXOVGESA-N 1 2 219.275 2.045 20 0 BEADLO CC/C=C/CC[N@@H+]1CC[C@H](O)C(F)(F)C1 ZINC000661405462 410617878 /nfs/dbraw/zinc/61/78/78/410617878.db2.gz DLTXCUBZUKAAMC-FSIBCCDJSA-N 1 2 219.275 2.045 20 0 BEADLO CC/C=C/CC[N@H+]1CC[C@H](O)C(F)(F)C1 ZINC000661405462 410617886 /nfs/dbraw/zinc/61/78/86/410617886.db2.gz DLTXCUBZUKAAMC-FSIBCCDJSA-N 1 2 219.275 2.045 20 0 BEADLO CC(C)[C@H](C)N(C)c1cc(CO)cc[nH+]1 ZINC000040878265 410894464 /nfs/dbraw/zinc/89/44/64/410894464.db2.gz UDHXKNQPSCDALS-JTQLQIEISA-N 1 2 208.305 2.055 20 0 BEADLO CC[C@H]1CCCCN1c1cc(CO)cc[nH+]1 ZINC000040877259 410896332 /nfs/dbraw/zinc/89/63/32/410896332.db2.gz LUCBTHSSLQVIGE-LBPRGKRZSA-N 1 2 220.316 2.343 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)[C@@H]1C[C@H]1C1CCCC1 ZINC000651292533 410903884 /nfs/dbraw/zinc/90/38/84/410903884.db2.gz NVTNZKVYSJXCJI-NWDGAFQWSA-N 1 2 247.342 2.194 20 0 BEADLO CC(C)NC(=O)OC1C[NH+](Cc2ccccc2)C1 ZINC000297522477 167080142 /nfs/dbraw/zinc/08/01/42/167080142.db2.gz YJCGQRILKRHHPE-UHFFFAOYSA-N 1 2 248.326 2.005 20 0 BEADLO CC(C)CN(C(=O)[C@H](C)n1cc[nH+]c1)C(C)C ZINC000066645643 1173035145 /nfs/dbraw/zinc/03/51/45/1173035145.db2.gz KBEKEZJPCHPIFF-LBPRGKRZSA-N 1 2 237.347 2.337 20 0 BEADLO CC(C)[C@@H](C)C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000264968032 167347800 /nfs/dbraw/zinc/34/78/00/167347800.db2.gz GHMGIAWGHCMDBS-NEPJUHHUSA-N 1 2 249.358 2.408 20 0 BEADLO C[C@@H](C(=O)N1CC(n2cc[nH+]c2)C1)C1CCCC1 ZINC000674094401 487619400 /nfs/dbraw/zinc/61/94/00/487619400.db2.gz SZSHPTYAGFGKFP-LLVKDONJSA-N 1 2 247.342 2.093 20 0 BEADLO CC(C)[C@@H](C)NC(=O)c1ccc2[nH+]ccn2c1 ZINC000057776895 167378029 /nfs/dbraw/zinc/37/80/29/167378029.db2.gz LAQBSQFWBUDNOU-SNVBAGLBSA-N 1 2 231.299 2.109 20 0 BEADLO FC1(F)CCC[C@H]1N[C@@H]1CCn2cc[nH+]c21 ZINC000398068934 410939896 /nfs/dbraw/zinc/93/98/96/410939896.db2.gz DCHXUSZJONNXSS-RKDXNWHRSA-N 1 2 227.258 2.105 20 0 BEADLO CC(C)[C@@H](CCO)Nc1cc[nH+]c(C2CC2)n1 ZINC000266211999 167393723 /nfs/dbraw/zinc/39/37/23/167393723.db2.gz GIHIGFQQNUFMPJ-LLVKDONJSA-N 1 2 235.331 2.173 20 0 BEADLO CCCC(C)(C)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000651344215 410925248 /nfs/dbraw/zinc/92/52/48/410925248.db2.gz XOHDKARHQGNYNU-UHFFFAOYSA-N 1 2 235.331 2.093 20 0 BEADLO CCC[C@H](C[NH2+][C@H](C)c1cn[nH]c1C)OC ZINC000651374154 410959592 /nfs/dbraw/zinc/95/95/92/410959592.db2.gz IAOIZIUCSVYMCQ-MWLCHTKSSA-N 1 2 225.336 2.184 20 0 BEADLO Cc1cc(N2CCC23CCCC3)nc[nH+]1 ZINC000651373419 410959839 /nfs/dbraw/zinc/95/98/39/410959839.db2.gz ISFNEKQAKXPOII-UHFFFAOYSA-N 1 2 203.289 2.308 20 0 BEADLO Cc1cc(N2CCCC(F)(F)C2)nc[nH+]1 ZINC000651384648 410967459 /nfs/dbraw/zinc/96/74/59/410967459.db2.gz BBYCOUTYVIYRKC-UHFFFAOYSA-N 1 2 213.231 2.021 20 0 BEADLO Cc1cc(N2CCC[C@@H](OC(C)C)C2)nc[nH+]1 ZINC000651386475 410968230 /nfs/dbraw/zinc/96/82/30/410968230.db2.gz NTIUWGLOJWHAJB-GFCCVEGCSA-N 1 2 235.331 2.179 20 0 BEADLO Cc1cc(N[C@@H](C2CC2)C2CCOCC2)nc[nH+]1 ZINC000651402713 410984234 /nfs/dbraw/zinc/98/42/34/410984234.db2.gz BWEUTZLGEUEJHW-AWEZNQCLSA-N 1 2 247.342 2.402 20 0 BEADLO CCC1CCN(c2cc(CO)cc[nH+]2)CC1 ZINC000042447253 411009077 /nfs/dbraw/zinc/00/90/77/411009077.db2.gz GNWXCZUEHRBBLJ-UHFFFAOYSA-N 1 2 220.316 2.200 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]CCC(C)(F)F ZINC000651360412 410947687 /nfs/dbraw/zinc/94/76/87/410947687.db2.gz XKZOSVFKIMGSDV-SSDOTTSWSA-N 1 2 217.263 2.414 20 0 BEADLO Cc1cc2ccccc2[nH+]c1N[C@H](CO)CCF ZINC000651463199 411046915 /nfs/dbraw/zinc/04/69/15/411046915.db2.gz NCAQCXAFLPDELX-LBPRGKRZSA-N 1 2 248.301 2.098 20 0 BEADLO Cn1ncc2c1nc[nH+]c2NC1CC2(CCC2)C1 ZINC000651473624 411055109 /nfs/dbraw/zinc/05/51/09/411055109.db2.gz WTJJIPFVBAEITM-UHFFFAOYSA-N 1 2 243.314 2.108 20 0 BEADLO CCO[C@@H]1CCC[C@H]1[NH2+][C@@H](C)c1cn[nH]c1C ZINC000651478460 411060954 /nfs/dbraw/zinc/06/09/54/411060954.db2.gz QQNLNBGFUMSOLZ-ZWKOPEQDSA-N 1 2 237.347 2.326 20 0 BEADLO CC(C)c1nc(NCC[C@H](C)F)cc[nH+]1 ZINC000338755303 167686676 /nfs/dbraw/zinc/68/66/76/167686676.db2.gz OOOICLRDPNBQLE-VIFPVBQESA-N 1 2 211.284 2.182 20 0 BEADLO CC(C)c1nc(N[C@@H]2CCCC[C@H]2O)cc[nH+]1 ZINC000106465305 167688996 /nfs/dbraw/zinc/68/89/96/167688996.db2.gz AQJCAIPIJUCESS-GHMZBOCLSA-N 1 2 235.331 2.315 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2COC(C)(C)C2)c1 ZINC000652067710 411103068 /nfs/dbraw/zinc/10/30/68/411103068.db2.gz DKEVXAHOHUOGDV-NSHDSACASA-N 1 2 236.315 2.207 20 0 BEADLO COCc1cc[nH+]c(NC[C@@H]2CCSC2)c1 ZINC000652068222 411104804 /nfs/dbraw/zinc/10/48/04/411104804.db2.gz WGFUFDYDFXVDRJ-NSHDSACASA-N 1 2 238.356 2.393 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2CCCOCC2)c1 ZINC000652068037 411104948 /nfs/dbraw/zinc/10/49/48/411104948.db2.gz PRBIXYFXBMDKIX-GFCCVEGCSA-N 1 2 236.315 2.209 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2CSC[C@@H]2C)c1 ZINC000652068285 411105193 /nfs/dbraw/zinc/10/51/93/411105193.db2.gz XYBOBYDLDRDUIB-GXSJLCMTSA-N 1 2 238.356 2.391 20 0 BEADLO F[C@@H]1CCC[N@H+](Cc2cccc3c2OCO3)C1 ZINC000652079423 411112130 /nfs/dbraw/zinc/11/21/30/411112130.db2.gz FRZBGXUKASQLRL-LLVKDONJSA-N 1 2 237.274 2.349 20 0 BEADLO F[C@@H]1CCC[N@@H+](Cc2cccc3c2OCO3)C1 ZINC000652079423 411112132 /nfs/dbraw/zinc/11/21/32/411112132.db2.gz FRZBGXUKASQLRL-LLVKDONJSA-N 1 2 237.274 2.349 20 0 BEADLO c1cn(Cc2nc([C@@H]3CCC[C@@H]4C[C@@H]43)no2)c[nH+]1 ZINC000656049262 411170794 /nfs/dbraw/zinc/17/07/94/411170794.db2.gz LWURJNBNRUXJJO-MXWKQRLJSA-N 1 2 244.298 2.218 20 0 BEADLO COc1ccc(N[C@H]2CCCn3nccc32)[nH+]c1 ZINC000657949006 411177802 /nfs/dbraw/zinc/17/78/02/411177802.db2.gz DIIYHCGGSIHRTL-NSHDSACASA-N 1 2 244.298 2.234 20 0 BEADLO COc1ccc(N[C@H](C)C2(OC)CCC2)[nH+]c1 ZINC000657950787 411178643 /nfs/dbraw/zinc/17/86/43/411178643.db2.gz UNPNIGSGCZYTMU-SNVBAGLBSA-N 1 2 236.315 2.460 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@H](C)c1ccccn1 ZINC000656106147 411179827 /nfs/dbraw/zinc/17/98/27/411179827.db2.gz XFTYPAPBPPCROZ-SECBINFHSA-N 1 2 244.298 2.362 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1CCSC1 ZINC000656128992 411184404 /nfs/dbraw/zinc/18/44/04/411184404.db2.gz PRWYQHUDKOXNLL-SECBINFHSA-N 1 2 209.318 2.011 20 0 BEADLO COc1c(C)[nH+]cnc1N1CC[C@@H](C)[C@@H]1C ZINC000656138180 411185515 /nfs/dbraw/zinc/18/55/15/411185515.db2.gz PFEXXPLUUIFOJW-SCZZXKLOSA-N 1 2 221.304 2.028 20 0 BEADLO COc1c(C)[nH+]cnc1N1CC[C@H](C(C)C)C1 ZINC000656146579 411186423 /nfs/dbraw/zinc/18/64/23/411186423.db2.gz YIAWAZVPORPLMF-NSHDSACASA-N 1 2 235.331 2.276 20 0 BEADLO Cc1c[nH+]c(C)nc1NCC[C@@H]1CCCCO1 ZINC000656155029 411188509 /nfs/dbraw/zinc/18/85/09/411188509.db2.gz GFWPOTXYOWAMHS-LBPRGKRZSA-N 1 2 235.331 2.465 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@H](C)c1ncc(C)o1 ZINC000656153181 411188563 /nfs/dbraw/zinc/18/85/63/411188563.db2.gz GZUWJFUOEMEAAT-SECBINFHSA-N 1 2 248.286 2.263 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H](C)c1ncc(C)o1 ZINC000656153183 411188818 /nfs/dbraw/zinc/18/88/18/411188818.db2.gz GZUWJFUOEMEAAT-VIFPVBQESA-N 1 2 248.286 2.263 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+][C@H](C)COCC1CC1 ZINC000652287521 411189919 /nfs/dbraw/zinc/18/99/19/411189919.db2.gz ZHZVPUNVFBLXOU-NXEZZACHSA-N 1 2 237.347 2.184 20 0 BEADLO CC(C)[C@H](O)C[NH+]1Cc2cc(F)c(F)cc2C1 ZINC000653830513 411195543 /nfs/dbraw/zinc/19/55/43/411195543.db2.gz BYEGRVPKOJEFMN-CYBMUJFWSA-N 1 2 241.281 2.297 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@H]2CCCn3nccc32)no1 ZINC000658005379 411195711 /nfs/dbraw/zinc/19/57/11/411195711.db2.gz ZGMRZKMJCNTTBL-QWRGUYRKSA-N 1 2 246.314 2.365 20 0 BEADLO FC1(F)CCC[C@H]1[NH2+][C@@H]1CCCn2nccc21 ZINC000658016347 411198796 /nfs/dbraw/zinc/19/87/96/411198796.db2.gz XAGIKRLIRNRDCX-MWLCHTKSSA-N 1 2 241.285 2.495 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](C)[C@@H](C)OC)c1 ZINC000652330483 411202156 /nfs/dbraw/zinc/20/21/56/411202156.db2.gz HUJQIZFOXHZGIB-VHSXEESVSA-N 1 2 224.304 2.063 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1CS[C@H](C)C1 ZINC000656202138 411205784 /nfs/dbraw/zinc/20/57/84/411205784.db2.gz USWKWRCESOHMLN-APPZFPTMSA-N 1 2 239.344 2.100 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1CS[C@@H](C)C1 ZINC000656202140 411206838 /nfs/dbraw/zinc/20/68/38/411206838.db2.gz USWKWRCESOHMLN-CBAPKCEASA-N 1 2 239.344 2.100 20 0 BEADLO Cc1cc(C)c(CNC(=O)N2CC[C@@H]2C)c[nH+]1 ZINC000656254072 411218621 /nfs/dbraw/zinc/21/86/21/411218621.db2.gz XNSLYXDPKYWPQP-NSHDSACASA-N 1 2 233.315 2.002 20 0 BEADLO Cc1ccc(C[NH+]2CC3(CC3(F)F)C2)nc1 ZINC000656266409 411221874 /nfs/dbraw/zinc/22/18/74/411221874.db2.gz WBSVLVCCAHDWMV-UHFFFAOYSA-N 1 2 224.254 2.231 20 0 BEADLO c1coc(C[NH2+][C@H]2CCCn3ccnc32)c1 ZINC000655683937 411225150 /nfs/dbraw/zinc/22/51/50/411225150.db2.gz JIRKDVURSPFGRO-NSHDSACASA-N 1 2 217.272 2.101 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCCn2ccnc21)c1ccccn1 ZINC000655684655 411226204 /nfs/dbraw/zinc/22/62/04/411226204.db2.gz UEQWWKZWNMWJPO-DGCLKSJQSA-N 1 2 242.326 2.464 20 0 BEADLO Cc1nc(CN[C@@H]2CCCn3cc[nH+]c32)cs1 ZINC000655698202 411247424 /nfs/dbraw/zinc/24/74/24/411247424.db2.gz ZPUQDGDOAXJQGQ-LLVKDONJSA-N 1 2 248.355 2.273 20 0 BEADLO CC[C@@]1(C)C[C@@H]1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000652411833 411234104 /nfs/dbraw/zinc/23/41/04/411234104.db2.gz ZNNCLNAYTAZUQU-RNCFNFMXSA-N 1 2 235.331 2.197 20 0 BEADLO Cc1cc(F)cc(NC(=O)NCc2[nH]cc[nH+]2)c1 ZINC000092092118 411268854 /nfs/dbraw/zinc/26/88/54/411268854.db2.gz VEIXUGOUQUVNJD-UHFFFAOYSA-N 1 2 248.261 2.179 20 0 BEADLO CCc1cc(C[NH2+][C@@H]2CCCn3ccnc32)on1 ZINC000655715793 411269481 /nfs/dbraw/zinc/26/94/81/411269481.db2.gz NSCZHCCQEJKEHC-GFCCVEGCSA-N 1 2 246.314 2.058 20 0 BEADLO Cn1ncc2c1nc[nH+]c2NCCCC1CCC1 ZINC000656473169 411277146 /nfs/dbraw/zinc/27/71/46/411277146.db2.gz JHJMPSBYMCTHJF-UHFFFAOYSA-N 1 2 245.330 2.356 20 0 BEADLO c1c[nH+]c(Cn2cc(C3CCCCC3)nn2)[nH]1 ZINC000656469184 411280715 /nfs/dbraw/zinc/28/07/15/411280715.db2.gz CGFIPPCPDBKURE-UHFFFAOYSA-N 1 2 231.303 2.097 20 0 BEADLO C[C@H]1CC[N@H+](CCn2cc(Cl)cn2)C[C@H]1F ZINC000656494604 411284044 /nfs/dbraw/zinc/28/40/44/411284044.db2.gz VYBHCSBFRGIAIH-GXSJLCMTSA-N 1 2 245.729 2.216 20 0 BEADLO C[C@H]1CC[N@@H+](CCn2cc(Cl)cn2)C[C@H]1F ZINC000656494604 411284045 /nfs/dbraw/zinc/28/40/45/411284045.db2.gz VYBHCSBFRGIAIH-GXSJLCMTSA-N 1 2 245.729 2.216 20 0 BEADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2cnccn2)o1 ZINC000656490075 411285138 /nfs/dbraw/zinc/28/51/38/411285138.db2.gz IFNMNRBXCUFDDL-ZWNOBZJWSA-N 1 2 243.310 2.483 20 0 BEADLO Cc1cnc(C[NH2+][C@@H]2CCCn3ccnc32)s1 ZINC000655720421 411289119 /nfs/dbraw/zinc/28/91/19/411289119.db2.gz WOLMBIQECFKNBT-SNVBAGLBSA-N 1 2 248.355 2.273 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1cc(C)nc(C)n1 ZINC000659840905 411329407 /nfs/dbraw/zinc/32/94/07/411329407.db2.gz LPJCCLVTAVSDGQ-BXUZGUMPSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1cc(C)nc(C)n1 ZINC000659840905 411329409 /nfs/dbraw/zinc/32/94/09/411329409.db2.gz LPJCCLVTAVSDGQ-BXUZGUMPSA-N 1 2 249.358 2.093 20 0 BEADLO CC(C)OC[C@H]([NH3+])c1nc(C2CCCC2)no1 ZINC000656559716 411303359 /nfs/dbraw/zinc/30/33/59/411303359.db2.gz WLYROUJTDMBBAD-JTQLQIEISA-N 1 2 239.319 2.152 20 0 BEADLO Cc1cc(-n2cccn2)ccc1[NH2+]CC[C@H](C)O ZINC000656650469 411315642 /nfs/dbraw/zinc/31/56/42/411315642.db2.gz AIYIISVYPSNBQF-LBPRGKRZSA-N 1 2 245.326 2.364 20 0 BEADLO c1nc(C[NH+]2CC(Cc3ccccc3)C2)co1 ZINC000656651930 411316355 /nfs/dbraw/zinc/31/63/55/411316355.db2.gz YJGOHNCIPIIVMZ-UHFFFAOYSA-N 1 2 228.295 2.349 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CC(Cc2ccccc2)C1 ZINC000656651713 411316587 /nfs/dbraw/zinc/31/65/87/411316587.db2.gz DAERFLSHRLFJGW-UHFFFAOYSA-N 1 2 241.338 2.393 20 0 BEADLO CCOC1C[NH+](Cc2nccc3ccccc32)C1 ZINC000656657859 411317572 /nfs/dbraw/zinc/31/75/72/411317572.db2.gz APTDLJULRZXFIE-UHFFFAOYSA-N 1 2 242.322 2.456 20 0 BEADLO CCn1ccc(NCc2[nH+]ccn2C(C)C)n1 ZINC000656661837 411319218 /nfs/dbraw/zinc/31/92/18/411319218.db2.gz IIVMLAZZNJQZHD-UHFFFAOYSA-N 1 2 233.319 2.293 20 0 BEADLO Cc1ncc([C@@H](C)[NH2+]Cc2ncccn2)s1 ZINC000658278319 411319967 /nfs/dbraw/zinc/31/99/67/411319967.db2.gz DQKVXGQLZJQFPD-MRVPVSSYSA-N 1 2 234.328 2.092 20 0 BEADLO C[C@H]([NH2+][C@H]1C[C@H](C)n2ncnc21)c1ccncc1 ZINC000656678564 411323341 /nfs/dbraw/zinc/32/33/41/411323341.db2.gz ADYAQZGPUIPXBY-NHCYSSNCSA-N 1 2 243.314 2.030 20 0 BEADLO COc1cc(C[N@H+](C)[C@@H](C)c2ccncc2)on1 ZINC000660140172 411256016 /nfs/dbraw/zinc/25/60/16/411256016.db2.gz KBBZJWTYJPGGJG-JTQLQIEISA-N 1 2 247.298 2.271 20 0 BEADLO COc1cc(C[N@@H+](C)[C@@H](C)c2ccncc2)on1 ZINC000660140172 411256020 /nfs/dbraw/zinc/25/60/20/411256020.db2.gz KBBZJWTYJPGGJG-JTQLQIEISA-N 1 2 247.298 2.271 20 0 BEADLO C[N@H+](Cc1cscn1)[C@H]1COC(C)(C)C1 ZINC000659857905 411349311 /nfs/dbraw/zinc/34/93/11/411349311.db2.gz OFWFZFHCQGNKMH-SNVBAGLBSA-N 1 2 226.345 2.142 20 0 BEADLO C[N@@H+](Cc1cscn1)[C@H]1COC(C)(C)C1 ZINC000659857905 411349315 /nfs/dbraw/zinc/34/93/15/411349315.db2.gz OFWFZFHCQGNKMH-SNVBAGLBSA-N 1 2 226.345 2.142 20 0 BEADLO Cc1c[nH+]c(C)c(NCc2cc3n(n2)CCC3)c1 ZINC000656776214 411356901 /nfs/dbraw/zinc/35/69/01/411356901.db2.gz JFSXNVOOJGXHBH-UHFFFAOYSA-N 1 2 242.326 2.453 20 0 BEADLO CC(C)n1cc[nH+]c1CNc1cccnc1 ZINC000656769655 411362857 /nfs/dbraw/zinc/36/28/57/411362857.db2.gz RZAVTVNDYUUGOV-UHFFFAOYSA-N 1 2 216.288 2.471 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC(=O)CC23CCC3)nc1 ZINC000653764927 411345453 /nfs/dbraw/zinc/34/54/53/411345453.db2.gz IUYLILWEORSWGP-UHFFFAOYSA-N 1 2 244.338 2.478 20 0 BEADLO Cc1ccc(C[N@H+]2CCC(=O)CC23CCC3)nc1 ZINC000653764927 411345455 /nfs/dbraw/zinc/34/54/55/411345455.db2.gz IUYLILWEORSWGP-UHFFFAOYSA-N 1 2 244.338 2.478 20 0 BEADLO CC1(C)[C@@H]2CN(c3cc[nH+]c(C4CC4)n3)C[C@@H]21 ZINC000266272915 168013409 /nfs/dbraw/zinc/01/34/09/168013409.db2.gz ROROAUPGBWLERA-PHIMTYICSA-N 1 2 229.327 2.446 20 0 BEADLO CCc1cccc(CNC(=O)c2c[nH+]c(C)[nH]2)c1 ZINC000652924863 411346474 /nfs/dbraw/zinc/34/64/74/411346474.db2.gz YYJDNABEDAZJHE-UHFFFAOYSA-N 1 2 243.310 2.211 20 0 BEADLO CC1(Cc2noc(Cn3cc[nH+]c3)n2)CCCC1 ZINC000289079204 168053263 /nfs/dbraw/zinc/05/32/63/168053263.db2.gz JFUPUUYIQCAIIM-UHFFFAOYSA-N 1 2 246.314 2.437 20 0 BEADLO CC1(NC(=O)C=Cc2c[nH]c[nH+]2)CCCCC1 ZINC000283582556 168055272 /nfs/dbraw/zinc/05/52/72/168055272.db2.gz WPGDEIFQZHIXBL-AATRIKPKSA-N 1 2 233.315 2.262 20 0 BEADLO CC1(CC(F)(F)F)C[NH+](Cc2cn[nH]c2)C1 ZINC000656822330 411376877 /nfs/dbraw/zinc/37/68/77/411376877.db2.gz KFIBZTOZEAYIDI-UHFFFAOYSA-N 1 2 233.237 2.184 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2CCC(C)=C(C)C2)no1 ZINC000289402996 168086531 /nfs/dbraw/zinc/08/65/31/168086531.db2.gz OFWHLKRUQCLHCP-SNVBAGLBSA-N 1 2 221.304 2.481 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2CCC(C)=C(C)C2)no1 ZINC000289402996 168086534 /nfs/dbraw/zinc/08/65/34/168086534.db2.gz OFWHLKRUQCLHCP-SNVBAGLBSA-N 1 2 221.304 2.481 20 0 BEADLO CC1=CCC[N@@H+](Cc2ncnn2CC(C)C)C1 ZINC000280824097 168100612 /nfs/dbraw/zinc/10/06/12/168100612.db2.gz NTQVARXHYRUSPD-UHFFFAOYSA-N 1 2 234.347 2.086 20 0 BEADLO CC1=CCC[N@H+](Cc2ncnn2CC(C)C)C1 ZINC000280824097 168100614 /nfs/dbraw/zinc/10/06/14/168100614.db2.gz NTQVARXHYRUSPD-UHFFFAOYSA-N 1 2 234.347 2.086 20 0 BEADLO CC1=CC[N@H+](Cc2nc(CC(C)C)no2)CC1 ZINC000270394347 168114385 /nfs/dbraw/zinc/11/43/85/168114385.db2.gz YSDFDVLIGIIGMY-UHFFFAOYSA-N 1 2 235.331 2.420 20 0 BEADLO CC1=CC[N@@H+](Cc2nc(CC(C)C)no2)CC1 ZINC000270394347 168114388 /nfs/dbraw/zinc/11/43/88/168114388.db2.gz YSDFDVLIGIIGMY-UHFFFAOYSA-N 1 2 235.331 2.420 20 0 BEADLO CC1=CC[N@H+](Cc2nnc(C(C)C)o2)CC1 ZINC000270340833 168116240 /nfs/dbraw/zinc/11/62/40/168116240.db2.gz NNMCLULLUFTIFI-UHFFFAOYSA-N 1 2 221.304 2.345 20 0 BEADLO CC1=CC[N@@H+](Cc2nnc(C(C)C)o2)CC1 ZINC000270340833 168116242 /nfs/dbraw/zinc/11/62/42/168116242.db2.gz NNMCLULLUFTIFI-UHFFFAOYSA-N 1 2 221.304 2.345 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CC(C)=C[C@H](C)C1 ZINC000336139510 168126498 /nfs/dbraw/zinc/12/64/98/168126498.db2.gz FVKYJESVNVBARY-JTQLQIEISA-N 1 2 245.326 2.242 20 0 BEADLO C[C@@H]([NH2+]C1CC(C)C1)C(=O)OC(C)(C)C ZINC000123439195 168148275 /nfs/dbraw/zinc/14/82/75/168148275.db2.gz HJVGRYPNCFKAEK-HWOCKDDLSA-N 1 2 213.321 2.105 20 0 BEADLO CC1CCC(C)(NC(=O)CCc2c[nH+]c[nH]2)CC1 ZINC000188836961 168150119 /nfs/dbraw/zinc/15/01/19/168150119.db2.gz IKEUFTCNEFPFMQ-UHFFFAOYSA-N 1 2 249.358 2.427 20 0 BEADLO CC1CCC(C)(NC(=O)CCc2c[nH]c[nH+]2)CC1 ZINC000188836961 168150121 /nfs/dbraw/zinc/15/01/21/168150121.db2.gz IKEUFTCNEFPFMQ-UHFFFAOYSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@H](c1csnn1)[NH+]1CCC(C)CC1 ZINC000336190750 168186959 /nfs/dbraw/zinc/18/69/59/168186959.db2.gz ZVTMPMSEQHAQNK-SECBINFHSA-N 1 2 211.334 2.331 20 0 BEADLO CCC(=CC(=O)N(C)CCCn1cc[nH+]c1)CC ZINC000269005134 168192919 /nfs/dbraw/zinc/19/29/19/168192919.db2.gz WQJJQDHKFYGZQC-UHFFFAOYSA-N 1 2 249.358 2.478 20 0 BEADLO CCC(=CC(=O)NC[C@H](C)Cn1cc[nH+]c1)CC ZINC000268272568 168193639 /nfs/dbraw/zinc/19/36/39/168193639.db2.gz NVRKEXTZTXKYRE-LBPRGKRZSA-N 1 2 249.358 2.382 20 0 BEADLO CCC(=CC(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1)CC ZINC000371307274 168196019 /nfs/dbraw/zinc/19/60/19/168196019.db2.gz CKKXSIJYPQCAOL-LLVKDONJSA-N 1 2 247.342 2.130 20 0 BEADLO CCC(=CC(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1)CC ZINC000371307274 168196020 /nfs/dbraw/zinc/19/60/20/168196020.db2.gz CKKXSIJYPQCAOL-LLVKDONJSA-N 1 2 247.342 2.130 20 0 BEADLO CCC(C)(C)C(=O)NCCCNc1cccc[nH+]1 ZINC000136178651 168264614 /nfs/dbraw/zinc/26/46/14/168264614.db2.gz JJZFAYDEUIVYJS-UHFFFAOYSA-N 1 2 249.358 2.436 20 0 BEADLO CCC(C)(C)C(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000335158490 168268235 /nfs/dbraw/zinc/26/82/35/168268235.db2.gz ZHDDUSZYVNPYSD-UWVGGRQHSA-N 1 2 235.331 2.441 20 0 BEADLO CCC(C)(C)c1nc(Cc2c[nH+]cn2C)no1 ZINC000357938618 168306512 /nfs/dbraw/zinc/30/65/12/168306512.db2.gz SHQTVUSLKKADDE-UHFFFAOYSA-N 1 2 234.303 2.082 20 0 BEADLO CCC(C)(CC)NC(=O)CCc1[nH]cc[nH+]1 ZINC000279566472 168307253 /nfs/dbraw/zinc/30/72/53/168307253.db2.gz ZAWSNNIQSIAUNN-UHFFFAOYSA-N 1 2 223.320 2.037 20 0 BEADLO Cc1c[nH+]c(C)c(NCc2cc[nH]n2)c1 ZINC000404495337 411398921 /nfs/dbraw/zinc/39/89/21/411398921.db2.gz UHONYQFJLOAIBO-UHFFFAOYSA-N 1 2 202.261 2.034 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)NC(C)(C)C1CC1 ZINC000492457051 411399321 /nfs/dbraw/zinc/39/93/21/411399321.db2.gz MSNGZJSKXWAXBN-BQYQJAHWSA-N 1 2 247.342 2.221 20 0 BEADLO Cn1cnc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000659814856 411461457 /nfs/dbraw/zinc/46/14/57/411461457.db2.gz XFZCVRPUPAISTB-VIFPVBQESA-N 1 2 247.264 2.194 20 0 BEADLO Cn1cnc(C[N@H+]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000659814856 411461460 /nfs/dbraw/zinc/46/14/60/411461460.db2.gz XFZCVRPUPAISTB-VIFPVBQESA-N 1 2 247.264 2.194 20 0 BEADLO c1c(C[N@@H+]2CCO[C@H](C3CC3)C2)onc1C1CC1 ZINC000660323410 411412186 /nfs/dbraw/zinc/41/21/86/411412186.db2.gz URWZPKUQMQKWMW-AWEZNQCLSA-N 1 2 248.326 2.163 20 0 BEADLO c1c(C[N@H+]2CCO[C@H](C3CC3)C2)onc1C1CC1 ZINC000660323410 411412188 /nfs/dbraw/zinc/41/21/88/411412188.db2.gz URWZPKUQMQKWMW-AWEZNQCLSA-N 1 2 248.326 2.163 20 0 BEADLO CCCNC(=O)CCC[N@@H+]1CCC[C@H]1C(F)F ZINC000653594452 411429836 /nfs/dbraw/zinc/42/98/36/411429836.db2.gz TXBLIATZLMBRNX-JTQLQIEISA-N 1 2 248.317 2.022 20 0 BEADLO CCCNC(=O)CCC[N@H+]1CCC[C@H]1C(F)F ZINC000653594452 411429838 /nfs/dbraw/zinc/42/98/38/411429838.db2.gz TXBLIATZLMBRNX-JTQLQIEISA-N 1 2 248.317 2.022 20 0 BEADLO CCc1nnc(SCc2[nH+]ccn2C)s1 ZINC000657273538 411437410 /nfs/dbraw/zinc/43/74/10/411437410.db2.gz RSOVNWONOOMUOF-UHFFFAOYSA-N 1 2 240.357 2.126 20 0 BEADLO CC(C)n1ccnc1C[NH2+]Cc1cccnc1 ZINC000657286803 411445439 /nfs/dbraw/zinc/44/54/39/411445439.db2.gz RQOQSZWEAGBNRV-UHFFFAOYSA-N 1 2 230.315 2.149 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1O[C@H](C)C[C@@H]1C ZINC000281832370 411454197 /nfs/dbraw/zinc/45/41/97/411454197.db2.gz IIUZZNZLOUFYDT-OPQQBVKSSA-N 1 2 248.326 2.396 20 0 BEADLO Cc1cc(CNCc2[nH+]ccn2C(C)C)no1 ZINC000657329483 411467786 /nfs/dbraw/zinc/46/77/86/411467786.db2.gz MMLMBLZPKPDLMR-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO Cc1c[nH]c(CNc2ccnn2[C@@H](C)C2CC2)[nH+]1 ZINC000657344189 411469146 /nfs/dbraw/zinc/46/91/46/411469146.db2.gz YRJMGKYDWIKTLY-JTQLQIEISA-N 1 2 245.330 2.498 20 0 BEADLO CCOc1ccc(C[NH2+]Cc2ccn[nH]2)c(C)c1 ZINC000657354926 411474235 /nfs/dbraw/zinc/47/42/35/411474235.db2.gz ZFEWZYHMACABNC-UHFFFAOYSA-N 1 2 245.326 2.407 20 0 BEADLO C[C@H](CCC1CC1)NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000655003741 411474473 /nfs/dbraw/zinc/47/44/73/411474473.db2.gz UHYPGICMXAQHMB-WDEREUQCSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](CCC1CC1)NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000655003741 411474475 /nfs/dbraw/zinc/47/44/75/411474475.db2.gz UHYPGICMXAQHMB-WDEREUQCSA-N 1 2 249.358 2.283 20 0 BEADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cn(C)cn2)on1 ZINC000659847594 411475546 /nfs/dbraw/zinc/47/55/46/411475546.db2.gz YMJXIROMKXMZLJ-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cn(C)cn2)on1 ZINC000659847594 411475550 /nfs/dbraw/zinc/47/55/50/411475550.db2.gz YMJXIROMKXMZLJ-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@@H]2C[C@@]2(F)c2ccccc2)n1 ZINC000657496357 411535353 /nfs/dbraw/zinc/53/53/53/411535353.db2.gz RVOAZZLXMBNMBN-TZMCWYRMSA-N 1 2 245.301 2.445 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@@H](C)c2c(C)noc2C)n1 ZINC000657367813 411480041 /nfs/dbraw/zinc/48/00/41/411480041.db2.gz RPOITYFZYNOEPT-QMMMGPOBSA-N 1 2 234.303 2.174 20 0 BEADLO COC[C@H]([NH2+]Cc1nc(C)c[nH]1)c1ccccc1 ZINC000657369333 411480699 /nfs/dbraw/zinc/48/06/99/411480699.db2.gz YZPSFEALXKKQBJ-ZDUSSCGKSA-N 1 2 245.326 2.195 20 0 BEADLO COC[C@@H](NCc1[nH]cc(C)[nH+]1)c1ccc(C)o1 ZINC000657382711 411488211 /nfs/dbraw/zinc/48/82/11/411488211.db2.gz IWQCFNMRYAVHHJ-LLVKDONJSA-N 1 2 249.314 2.097 20 0 BEADLO CC[C@H]1C[C@H](Nc2ccc(C)[nH+]c2)CO1 ZINC000657402864 411497376 /nfs/dbraw/zinc/49/73/76/411497376.db2.gz KGFZLAJOJRCYTO-RYUDHWBXSA-N 1 2 206.289 2.369 20 0 BEADLO CC(C)[C@H]1CCC[N@H+](CCc2cnn[nH]2)CC1 ZINC000659931006 411502350 /nfs/dbraw/zinc/50/23/50/411502350.db2.gz JACNREPJSCMCOU-LBPRGKRZSA-N 1 2 236.363 2.105 20 0 BEADLO CC(C)[C@H]1CCC[N@@H+](CCc2cnn[nH]2)CC1 ZINC000659931006 411502351 /nfs/dbraw/zinc/50/23/51/411502351.db2.gz JACNREPJSCMCOU-LBPRGKRZSA-N 1 2 236.363 2.105 20 0 BEADLO Cc1c[nH]c(CNc2cccc(CCCO)c2)[nH+]1 ZINC000657432977 411505822 /nfs/dbraw/zinc/50/58/22/411505822.db2.gz RNLFNLGOIPQBOD-UHFFFAOYSA-N 1 2 245.326 2.255 20 0 BEADLO COc1cc(NCc2[nH]cc(C)[nH+]2)ccc1F ZINC000657443415 411512744 /nfs/dbraw/zinc/51/27/44/411512744.db2.gz LUNIGKVSCIZQJT-UHFFFAOYSA-N 1 2 235.262 2.478 20 0 BEADLO C[C@H](CO)N(C)c1[nH+]ccc2ccc(F)cc21 ZINC000334452885 411517069 /nfs/dbraw/zinc/51/70/69/411517069.db2.gz ZOSXBGSWFDKRCI-SECBINFHSA-N 1 2 234.274 2.191 20 0 BEADLO CCCn1nccc1C[NH2+]CC(C)(F)F ZINC000657474957 411524245 /nfs/dbraw/zinc/52/42/45/411524245.db2.gz HXUZTZIYOOLZAQ-UHFFFAOYSA-N 1 2 217.263 2.038 20 0 BEADLO Cc1[nH]c(CN[C@H]2CCC[C@H]2F)[nH+]c1C ZINC000657477150 411524700 /nfs/dbraw/zinc/52/47/00/411524700.db2.gz XYWYAKKXKFIJLG-ZJUUUORDSA-N 1 2 211.284 2.007 20 0 BEADLO CCC[C@H](CC)NC(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000660499023 411531669 /nfs/dbraw/zinc/53/16/69/411531669.db2.gz HHCRNRDXDMDTNA-JTQLQIEISA-N 1 2 238.335 2.130 20 0 BEADLO CCC[C@H](CC)NC(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000660499023 411531671 /nfs/dbraw/zinc/53/16/71/411531671.db2.gz HHCRNRDXDMDTNA-JTQLQIEISA-N 1 2 238.335 2.130 20 0 BEADLO CCC[C@@H](CC)NC(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000660499025 411531679 /nfs/dbraw/zinc/53/16/79/411531679.db2.gz HHCRNRDXDMDTNA-SNVBAGLBSA-N 1 2 238.335 2.130 20 0 BEADLO CCC[C@@H](CC)NC(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000660499025 411531680 /nfs/dbraw/zinc/53/16/80/411531680.db2.gz HHCRNRDXDMDTNA-SNVBAGLBSA-N 1 2 238.335 2.130 20 0 BEADLO CC[N@@H+]1CCSC[C@H]1c1nccs1 ZINC000187043849 170007029 /nfs/dbraw/zinc/00/70/29/170007029.db2.gz TZJQGUKLFGBRFF-QMMMGPOBSA-N 1 2 214.359 2.253 20 0 BEADLO CC[N@H+]1CCSC[C@H]1c1nccs1 ZINC000187043849 170007030 /nfs/dbraw/zinc/00/70/30/170007030.db2.gz TZJQGUKLFGBRFF-QMMMGPOBSA-N 1 2 214.359 2.253 20 0 BEADLO COc1cc(C[NH2+][C@@H](C)c2cccc(O)c2)on1 ZINC000660192677 411552353 /nfs/dbraw/zinc/55/23/53/411552353.db2.gz UMGLSOYXFTWEKA-VIFPVBQESA-N 1 2 248.282 2.240 20 0 BEADLO C[C@@H]1C[C@H]([NH2+]Cc2ccccc2F)c2ncnn21 ZINC000657566960 411553390 /nfs/dbraw/zinc/55/33/90/411553390.db2.gz GFKIBMXLMOIVRZ-SKDRFNHKSA-N 1 2 246.289 2.213 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)c(C)o1 ZINC000660222100 411556288 /nfs/dbraw/zinc/55/62/88/411556288.db2.gz TUBBPFQVAZMETJ-KWQFWETISA-N 1 2 226.295 2.471 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)c(C)o1 ZINC000660222100 411556289 /nfs/dbraw/zinc/55/62/89/411556289.db2.gz TUBBPFQVAZMETJ-KWQFWETISA-N 1 2 226.295 2.471 20 0 BEADLO CCOC(=O)CCCCCn1cc[nH+]c1 ZINC000039320233 170199346 /nfs/dbraw/zinc/19/93/46/170199346.db2.gz BUSHGTZWACEKSA-UHFFFAOYSA-N 1 2 210.277 2.007 20 0 BEADLO CCOC(=O)C[N@H+](Cc1ccccc1)C1CC1 ZINC000043643347 170217829 /nfs/dbraw/zinc/21/78/29/170217829.db2.gz JNJSSPIYVVHAAH-UHFFFAOYSA-N 1 2 233.311 2.214 20 0 BEADLO CCOC(=O)C[N@@H+](Cc1ccccc1)C1CC1 ZINC000043643347 170217831 /nfs/dbraw/zinc/21/78/31/170217831.db2.gz JNJSSPIYVVHAAH-UHFFFAOYSA-N 1 2 233.311 2.214 20 0 BEADLO CCOC(=O)C[N@H+]1CC=C(C(C)(C)C)CC1 ZINC000340189318 170218529 /nfs/dbraw/zinc/21/85/29/170218529.db2.gz OMSWOJFKTBSXHI-UHFFFAOYSA-N 1 2 225.332 2.228 20 0 BEADLO CCOC(=O)C[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000340189318 170218531 /nfs/dbraw/zinc/21/85/31/170218531.db2.gz OMSWOJFKTBSXHI-UHFFFAOYSA-N 1 2 225.332 2.228 20 0 BEADLO Cc1cn[nH]c1C[NH2+][C@@H](C)c1cscn1 ZINC000657600323 411558498 /nfs/dbraw/zinc/55/84/98/411558498.db2.gz OHWAYVJMBHZOAU-QMMMGPOBSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@@H](C)c1cscn1 ZINC000657600323 411558499 /nfs/dbraw/zinc/55/84/99/411558499.db2.gz OHWAYVJMBHZOAU-QMMMGPOBSA-N 1 2 222.317 2.025 20 0 BEADLO CCOC(=O)[C@@H](Cc1ccccc1)[NH2+]CC(C)C ZINC000037966240 170252902 /nfs/dbraw/zinc/25/29/02/170252902.db2.gz BISCJSKHFILGST-CQSZACIVSA-N 1 2 249.354 2.406 20 0 BEADLO CCOC(=O)[C@H](CC)[N@H+](C)Cc1ccoc1 ZINC000082761050 170271336 /nfs/dbraw/zinc/27/13/36/170271336.db2.gz WOKTYZOSZLPWPF-NSHDSACASA-N 1 2 225.288 2.053 20 0 BEADLO CCOC(=O)[C@H](CC)[N@@H+](C)Cc1ccoc1 ZINC000082761050 170271337 /nfs/dbraw/zinc/27/13/37/170271337.db2.gz WOKTYZOSZLPWPF-NSHDSACASA-N 1 2 225.288 2.053 20 0 BEADLO CCOC(=O)[C@H]1CCC[N@@H+]1Cc1ccsc1 ZINC000050064971 170281389 /nfs/dbraw/zinc/28/13/89/170281389.db2.gz RSNZUFRUXASGMQ-LLVKDONJSA-N 1 2 239.340 2.276 20 0 BEADLO CCOC(=O)[C@H]1CCC[N@H+]1Cc1ccsc1 ZINC000050064971 170281392 /nfs/dbraw/zinc/28/13/92/170281392.db2.gz RSNZUFRUXASGMQ-LLVKDONJSA-N 1 2 239.340 2.276 20 0 BEADLO CCOC(=O)[C@](C)([NH2+]CC1CC1)c1ccccc1 ZINC000037968102 170283728 /nfs/dbraw/zinc/28/37/28/170283728.db2.gz YFLLLSDLDYUFBE-OAHLLOKOSA-N 1 2 247.338 2.465 20 0 BEADLO CCOC1C[NH+](Cc2cc(C)c(O)c(C)c2)C1 ZINC000297399090 170336695 /nfs/dbraw/zinc/33/66/95/170336695.db2.gz KIGBMRBDJZKTRU-UHFFFAOYSA-N 1 2 235.327 2.230 20 0 BEADLO CCOCC(C)(C)[NH2+]Cc1nc(C(C)C)no1 ZINC000339370365 170356484 /nfs/dbraw/zinc/35/64/84/170356484.db2.gz VJKPGDZIFVYYSM-UHFFFAOYSA-N 1 2 241.335 2.098 20 0 BEADLO CCOCCCC(=O)Nc1cc[nH+]c(C)c1 ZINC000076340635 170366932 /nfs/dbraw/zinc/36/69/32/170366932.db2.gz BRAQBRLHXJJIGR-UHFFFAOYSA-N 1 2 222.288 2.145 20 0 BEADLO CCOCCN(CC)c1[nH+]c2ccccc2n1C ZINC000270545685 170397163 /nfs/dbraw/zinc/39/71/63/170397163.db2.gz DRBNLUBIIWKULM-UHFFFAOYSA-N 1 2 247.342 2.436 20 0 BEADLO C[N@H+](Cc1ccsc1Cl)C1(CO)CC1 ZINC000660544910 411598197 /nfs/dbraw/zinc/59/81/97/411598197.db2.gz WXNJKBNQTHHONL-UHFFFAOYSA-N 1 2 231.748 2.358 20 0 BEADLO C[N@@H+](Cc1ccsc1Cl)C1(CO)CC1 ZINC000660544910 411598198 /nfs/dbraw/zinc/59/81/98/411598198.db2.gz WXNJKBNQTHHONL-UHFFFAOYSA-N 1 2 231.748 2.358 20 0 BEADLO CO[C@@H](C[NH2+]Cc1ccn[nH]1)C1CCCCC1 ZINC000657782174 411598192 /nfs/dbraw/zinc/59/81/92/411598192.db2.gz KXGMHEVFHLYKLA-ZDUSSCGKSA-N 1 2 237.347 2.095 20 0 BEADLO CC(C)(C)C(F)(F)C[NH2+]Cc1cn[nH]c1 ZINC000657793819 411599156 /nfs/dbraw/zinc/59/91/56/411599156.db2.gz PVCWNKFORBFUTM-UHFFFAOYSA-N 1 2 217.263 2.181 20 0 BEADLO CCOc1ccc(NCc2nc(C)c[nH]2)[nH+]c1C ZINC000657797024 411599401 /nfs/dbraw/zinc/59/94/01/411599401.db2.gz YOFDDLVUCFPHIA-UHFFFAOYSA-N 1 2 246.314 2.432 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2cc(C3CC3)no2)C1 ZINC000660692331 411617910 /nfs/dbraw/zinc/61/79/10/411617910.db2.gz OHLZILWMYPBGSN-SECBINFHSA-N 1 2 210.252 2.096 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2cc(C3CC3)no2)C1 ZINC000660692331 411617911 /nfs/dbraw/zinc/61/79/11/411617911.db2.gz OHLZILWMYPBGSN-SECBINFHSA-N 1 2 210.252 2.096 20 0 BEADLO CC[C@@H](C)[N@H+](CC)Cc1nsc(N(C)C)n1 ZINC000661107441 411710767 /nfs/dbraw/zinc/71/07/67/411710767.db2.gz MADBQVZYMHOVEI-SECBINFHSA-N 1 2 242.392 2.225 20 0 BEADLO CC[C@@H](C)[N@@H+](CC)Cc1nsc(N(C)C)n1 ZINC000661107441 411710769 /nfs/dbraw/zinc/71/07/69/411710769.db2.gz MADBQVZYMHOVEI-SECBINFHSA-N 1 2 242.392 2.225 20 0 BEADLO CCN(CCOC)c1[nH+]ccc2c(N)cccc21 ZINC000663420265 411655608 /nfs/dbraw/zinc/65/56/08/411655608.db2.gz GEDSKTOGUPQZDW-UHFFFAOYSA-N 1 2 245.326 2.290 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)Cc1ncc(Cl)s1 ZINC000661088206 411698957 /nfs/dbraw/zinc/69/89/57/411698957.db2.gz GUARSVBXZVMUPM-UHFFFAOYSA-N 1 2 242.735 2.152 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)Cc1ncc(Cl)s1 ZINC000661088206 411698961 /nfs/dbraw/zinc/69/89/61/411698961.db2.gz GUARSVBXZVMUPM-UHFFFAOYSA-N 1 2 242.735 2.152 20 0 BEADLO c1nn[nH]c1CC[N@@H+]1CCCC2(CCCC2)CC1 ZINC000661230854 411736929 /nfs/dbraw/zinc/73/69/29/411736929.db2.gz FOUXWNUEPSOXJX-UHFFFAOYSA-N 1 2 248.374 2.394 20 0 BEADLO c1nn[nH]c1CC[N@H+]1CCCC2(CCCC2)CC1 ZINC000661230854 411736931 /nfs/dbraw/zinc/73/69/31/411736931.db2.gz FOUXWNUEPSOXJX-UHFFFAOYSA-N 1 2 248.374 2.394 20 0 BEADLO c1nn[nH]c1C[N@@H+]1CCCC2(CCCC2)CC1 ZINC000661231633 411737446 /nfs/dbraw/zinc/73/74/46/411737446.db2.gz QQIAUSJRPDGGBH-UHFFFAOYSA-N 1 2 234.347 2.351 20 0 BEADLO c1nn[nH]c1C[N@H+]1CCCC2(CCCC2)CC1 ZINC000661231633 411737448 /nfs/dbraw/zinc/73/74/48/411737448.db2.gz QQIAUSJRPDGGBH-UHFFFAOYSA-N 1 2 234.347 2.351 20 0 BEADLO O[C@H]1CC[N@H+](CC2CCCCC2)CC1(F)F ZINC000661394882 411767188 /nfs/dbraw/zinc/76/71/88/411767188.db2.gz BIEAPTUCIBANNW-NSHDSACASA-N 1 2 233.302 2.269 20 0 BEADLO O[C@H]1CC[N@@H+](CC2CCCCC2)CC1(F)F ZINC000661394882 411767190 /nfs/dbraw/zinc/76/71/90/411767190.db2.gz BIEAPTUCIBANNW-NSHDSACASA-N 1 2 233.302 2.269 20 0 BEADLO O[C@@H]1CC[N@H+](CC2CCCCC2)CC1(F)F ZINC000661394881 411768050 /nfs/dbraw/zinc/76/80/50/411768050.db2.gz BIEAPTUCIBANNW-LLVKDONJSA-N 1 2 233.302 2.269 20 0 BEADLO O[C@@H]1CC[N@@H+](CC2CCCCC2)CC1(F)F ZINC000661394881 411768054 /nfs/dbraw/zinc/76/80/54/411768054.db2.gz BIEAPTUCIBANNW-LLVKDONJSA-N 1 2 233.302 2.269 20 0 BEADLO CC(C)C[C@@H](C)[N@@H+]1CC[C@H](O)C(F)(F)C1 ZINC000661411781 411771211 /nfs/dbraw/zinc/77/12/11/411771211.db2.gz AQEYFLDBTRYJGF-ZJUUUORDSA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)C[C@@H](C)[N@H+]1CC[C@H](O)C(F)(F)C1 ZINC000661411781 411771214 /nfs/dbraw/zinc/77/12/14/411771214.db2.gz AQEYFLDBTRYJGF-ZJUUUORDSA-N 1 2 221.291 2.123 20 0 BEADLO CO[C@@H](C)CN(C)c1[nH+]ccc2c(N)cccc21 ZINC000663909687 411771504 /nfs/dbraw/zinc/77/15/04/411771504.db2.gz RDZYIGAVJOMSPA-JTQLQIEISA-N 1 2 245.326 2.288 20 0 BEADLO COc1ccnc(C[NH2+][C@@H](C)c2cscn2)c1 ZINC000661426317 411773600 /nfs/dbraw/zinc/77/36/00/411773600.db2.gz WTPPIFVRZGIFAX-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO Cc1cc(C[N@H+]2CC3(CCC3)OC[C@@H]2C)on1 ZINC000661462806 411779497 /nfs/dbraw/zinc/77/94/97/411779497.db2.gz KJMGRLGGDMPQSF-NSHDSACASA-N 1 2 236.315 2.126 20 0 BEADLO Cc1cc(C[N@@H+]2CC3(CCC3)OC[C@@H]2C)on1 ZINC000661462806 411779502 /nfs/dbraw/zinc/77/95/02/411779502.db2.gz KJMGRLGGDMPQSF-NSHDSACASA-N 1 2 236.315 2.126 20 0 BEADLO C[C@H]1COC2(CCC2)C[N@@H+]1Cc1nccs1 ZINC000661470621 411782731 /nfs/dbraw/zinc/78/27/31/411782731.db2.gz UPQNXRINVIRJFR-JTQLQIEISA-N 1 2 238.356 2.287 20 0 BEADLO C[C@H]1COC2(CCC2)C[N@H+]1Cc1nccs1 ZINC000661470621 411782734 /nfs/dbraw/zinc/78/27/34/411782734.db2.gz UPQNXRINVIRJFR-JTQLQIEISA-N 1 2 238.356 2.287 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CC[C@@H]2C(F)F)[nH+]1 ZINC000663947108 411785638 /nfs/dbraw/zinc/78/56/38/411785638.db2.gz ZZQXQWHMNKAEDO-MRVPVSSYSA-N 1 2 238.241 2.110 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CC[C@H]2C(F)F)[nH+]1 ZINC000663947113 411785751 /nfs/dbraw/zinc/78/57/51/411785751.db2.gz ZZQXQWHMNKAEDO-QMMMGPOBSA-N 1 2 238.241 2.110 20 0 BEADLO Cc1noc(C[NH+]2CCC(c3ccco3)CC2)n1 ZINC000661160730 411723386 /nfs/dbraw/zinc/72/33/86/411723386.db2.gz BRZLNKNWPLZKNX-UHFFFAOYSA-N 1 2 247.298 2.351 20 0 BEADLO Cc1ccc(N2CCCC[C@H]2c2[nH]cc[nH+]2)nn1 ZINC000663691898 411724217 /nfs/dbraw/zinc/72/42/17/411724217.db2.gz CAKPYOOIWWXONC-NSHDSACASA-N 1 2 243.314 2.240 20 0 BEADLO Cc1cccc([C@@H](C)[N@H+](C)Cc2cn(C)nn2)c1 ZINC000661746930 411864191 /nfs/dbraw/zinc/86/41/91/411864191.db2.gz KWQPKUKQIFBHMH-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cccc([C@@H](C)[N@@H+](C)Cc2cn(C)nn2)c1 ZINC000661746930 411864195 /nfs/dbraw/zinc/86/41/95/411864195.db2.gz KWQPKUKQIFBHMH-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cn1c[nH+]cc1Cn1ncc(Cl)c1C1CC1 ZINC000664150855 411864610 /nfs/dbraw/zinc/86/46/10/411864610.db2.gz CKZIUMFMSPLUCW-UHFFFAOYSA-N 1 2 236.706 2.196 20 0 BEADLO C[C@H](c1ccccn1)[NH+]1C[C@@H](C)C(=O)[C@H](C)C1 ZINC000661544519 411798281 /nfs/dbraw/zinc/79/82/81/411798281.db2.gz DXCBTMHZGKCHKB-IJLUTSLNSA-N 1 2 232.327 2.300 20 0 BEADLO Cc1csc(NCCNc2cc(C)[nH+]cn2)n1 ZINC000663991017 411805030 /nfs/dbraw/zinc/80/50/30/411805030.db2.gz ZUKGQBOPSXSKCL-UHFFFAOYSA-N 1 2 249.343 2.074 20 0 BEADLO CNc1[nH+]cnc2c1cnn2CCC1CCC1 ZINC000664000275 411808894 /nfs/dbraw/zinc/80/88/94/411808894.db2.gz QVHUPULVHVGHLT-UHFFFAOYSA-N 1 2 231.303 2.058 20 0 BEADLO Cc1ccc(NCc2cc(C)[nH+]c(C)c2)nn1 ZINC000664027478 411818014 /nfs/dbraw/zinc/81/80/14/411818014.db2.gz ZGWBMMYYTSSANW-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+](C)CC2=CCCOC2)o1 ZINC000661652805 411829950 /nfs/dbraw/zinc/82/99/50/411829950.db2.gz CROOBAVTXKFLNZ-LLVKDONJSA-N 1 2 236.315 2.323 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+](C)CC2=CCCOC2)o1 ZINC000661652805 411829954 /nfs/dbraw/zinc/82/99/54/411829954.db2.gz CROOBAVTXKFLNZ-LLVKDONJSA-N 1 2 236.315 2.323 20 0 BEADLO CC(C)n1cc(OCc2ccc[nH+]c2N)cn1 ZINC000664104637 411855606 /nfs/dbraw/zinc/85/56/06/411855606.db2.gz GKYVEENYGKQJLR-UHFFFAOYSA-N 1 2 232.287 2.020 20 0 BEADLO CN(CC1=CCCOC1)c1[nH]c2ccccc2[nH+]1 ZINC000664363686 411930753 /nfs/dbraw/zinc/93/07/53/411930753.db2.gz OMHDQMMOPBHESA-UHFFFAOYSA-N 1 2 243.310 2.346 20 0 BEADLO CCc1cc(NCCc2ccoc2)nc[nH+]1 ZINC000664379806 411935661 /nfs/dbraw/zinc/93/56/61/411935661.db2.gz HZWBRFPFCOCXHS-UHFFFAOYSA-N 1 2 217.272 2.287 20 0 BEADLO C[C@@H]1CCN(c2cccc[nH+]2)C[C@H](C)O1 ZINC000664469574 411967685 /nfs/dbraw/zinc/96/76/85/411967685.db2.gz LBYVIHQVMMMWGO-MNOVXSKESA-N 1 2 206.289 2.085 20 0 BEADLO c1cc2[nH+]ccc(N3CC[C@H]4C[C@H]4C3)c2cn1 ZINC000664522911 411975788 /nfs/dbraw/zinc/97/57/88/411975788.db2.gz GXHHQYCTZVHHGH-QWRGUYRKSA-N 1 2 225.295 2.476 20 0 BEADLO Cc1nc(N2CC3(CCCC3)OC[C@H]2C)cc[nH+]1 ZINC000664532974 411980878 /nfs/dbraw/zinc/98/08/78/411980878.db2.gz WEEABSZLOCGSFO-LLVKDONJSA-N 1 2 247.342 2.323 20 0 BEADLO CN(CC1=CCSC1)c1cccc[nH+]1 ZINC000664639926 412002062 /nfs/dbraw/zinc/00/20/62/412002062.db2.gz GCROITVRRKWOLK-UHFFFAOYSA-N 1 2 206.314 2.191 20 0 BEADLO Cc1cc[nH+]c(NCCOCCF)c1Cl ZINC000664674314 412009286 /nfs/dbraw/zinc/00/92/86/412009286.db2.gz LGVHYGINXBSNKR-UHFFFAOYSA-N 1 2 232.686 2.441 20 0 BEADLO CC(C)(C)c1nc(NCCOCCF)cc[nH+]1 ZINC000664675314 412009577 /nfs/dbraw/zinc/00/95/77/412009577.db2.gz SDIVYGMSMMFTNE-UHFFFAOYSA-N 1 2 241.310 2.172 20 0 BEADLO CC[C@@H](Nc1nccc(C)n1)c1[nH]cc[nH+]1 ZINC000125230107 170917945 /nfs/dbraw/zinc/91/79/45/170917945.db2.gz KRMTZLJTHMJBMI-SECBINFHSA-N 1 2 217.276 2.071 20 0 BEADLO C[C@H]1CN(c2cccc[nH+]2)C[C@@](C)(C(F)F)O1 ZINC000664691268 412010286 /nfs/dbraw/zinc/01/02/86/412010286.db2.gz WXWOVIOGUDQIMT-CABZTGNLSA-N 1 2 242.269 2.331 20 0 BEADLO CCC(CC)CCC[N@H+](C)Cc1n[nH]c(=O)[nH]1 ZINC000662037022 411951900 /nfs/dbraw/zinc/95/19/00/411951900.db2.gz JZPYEHJMCGKVOR-UHFFFAOYSA-N 1 2 240.351 2.159 20 0 BEADLO CCC(CC)CCC[N@@H+](C)Cc1n[nH]c(=O)[nH]1 ZINC000662037022 411951901 /nfs/dbraw/zinc/95/19/01/411951901.db2.gz JZPYEHJMCGKVOR-UHFFFAOYSA-N 1 2 240.351 2.159 20 0 BEADLO CCO[C@H](C)c1nc(Cc2c[nH+]ccc2C)no1 ZINC000664982596 412055793 /nfs/dbraw/zinc/05/57/93/412055793.db2.gz SOMIZQMFPIZZBF-SNVBAGLBSA-N 1 2 247.298 2.461 20 0 BEADLO Cc1cc[nH+]cc1Cc1noc([C@H]2C[C@H]2C)n1 ZINC000664981578 412055827 /nfs/dbraw/zinc/05/58/27/412055827.db2.gz XJARBDXFRTZYAH-KOLCDFICSA-N 1 2 229.283 2.487 20 0 BEADLO CC[C@@H]1CCN1C(=O)Nc1cc[nH+]c(C)c1 ZINC000297901781 171019345 /nfs/dbraw/zinc/01/93/45/171019345.db2.gz XOTQWIHSFVEVTK-LLVKDONJSA-N 1 2 219.288 2.406 20 0 BEADLO CC[C@@H]1CC[C@H]1[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000309620889 171060874 /nfs/dbraw/zinc/06/08/74/171060874.db2.gz DFUSKTLBWFSTHX-GMTAPVOTSA-N 1 2 227.348 2.495 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccc(F)cn2)C[C@H](C)O1 ZINC000276360047 171089129 /nfs/dbraw/zinc/08/91/29/171089129.db2.gz MBZDRGGZQHDSPY-GXFFZTMASA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccc(F)cn2)C[C@H](C)O1 ZINC000276360047 171089132 /nfs/dbraw/zinc/08/91/32/171089132.db2.gz MBZDRGGZQHDSPY-GXFFZTMASA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cncs2)C[C@@H](C)O1 ZINC000245566868 171090150 /nfs/dbraw/zinc/09/01/50/171090150.db2.gz TZPNNMZWCOWOJA-NXEZZACHSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cncs2)C[C@@H](C)O1 ZINC000245566868 171090152 /nfs/dbraw/zinc/09/01/52/171090152.db2.gz TZPNNMZWCOWOJA-NXEZZACHSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cscn2)CCS1 ZINC000174362989 171090432 /nfs/dbraw/zinc/09/04/32/171090432.db2.gz KWCMUCMXWKSCFH-SNVBAGLBSA-N 1 2 228.386 2.471 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cscn2)CCS1 ZINC000174362989 171090436 /nfs/dbraw/zinc/09/04/36/171090436.db2.gz KWCMUCMXWKSCFH-SNVBAGLBSA-N 1 2 228.386 2.471 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ncc(C)cn2)CCS1 ZINC000336349574 171091974 /nfs/dbraw/zinc/09/19/74/171091974.db2.gz DACZEORQTFTCCN-LLVKDONJSA-N 1 2 237.372 2.112 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ncc(C)cn2)CCS1 ZINC000336349574 171091976 /nfs/dbraw/zinc/09/19/76/171091976.db2.gz DACZEORQTFTCCN-LLVKDONJSA-N 1 2 237.372 2.112 20 0 BEADLO CC[C@@H]1CN(c2cccc[nH+]2)CCCO1 ZINC000281729232 171098378 /nfs/dbraw/zinc/09/83/78/171098378.db2.gz COWYKMZZVZYSTK-LLVKDONJSA-N 1 2 206.289 2.087 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1nc(C)sc1C ZINC000336388013 171105271 /nfs/dbraw/zinc/10/52/71/171105271.db2.gz UYFYLPYUDCVLJI-LLVKDONJSA-N 1 2 240.372 2.371 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1nc(C)sc1C ZINC000336388013 171105274 /nfs/dbraw/zinc/10/52/74/171105274.db2.gz UYFYLPYUDCVLJI-LLVKDONJSA-N 1 2 240.372 2.371 20 0 BEADLO CC[C@@H]1[C@H](C)CCN1c1cc[nH+]c(C)n1 ZINC000185929183 171160136 /nfs/dbraw/zinc/16/01/36/171160136.db2.gz KRPYEIDGSGLRSF-MWLCHTKSSA-N 1 2 205.305 2.410 20 0 BEADLO CC[C@@](C)([NH2+]CCc1ccc(C)cc1)C(=O)OC ZINC000293032796 171175876 /nfs/dbraw/zinc/17/58/76/171175876.db2.gz DIJWGRFLHDNZDB-OAHLLOKOSA-N 1 2 249.354 2.469 20 0 BEADLO CC[C@@](C)(OC)C(=O)Nc1cc[nH+]cc1C ZINC000280794594 171191985 /nfs/dbraw/zinc/19/19/85/171191985.db2.gz UZEUIGWNETVDLP-GFCCVEGCSA-N 1 2 222.288 2.144 20 0 BEADLO CC[C@@]1(C)CCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000283922321 171197346 /nfs/dbraw/zinc/19/73/46/171197346.db2.gz KBIFOZUALOYETQ-GJBLVYBDSA-N 1 2 247.342 2.462 20 0 BEADLO CC[C@@]1(C)CCCN(C(=O)CCn2cc[nH+]c2)C1 ZINC000266302884 171198135 /nfs/dbraw/zinc/19/81/35/171198135.db2.gz KNXINMZIRLLDBN-AWEZNQCLSA-N 1 2 249.358 2.312 20 0 BEADLO CC[C@H](C)CC(=O)N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000358940730 171259125 /nfs/dbraw/zinc/25/91/25/171259125.db2.gz WXCZDIOEIYXFSW-RYUDHWBXSA-N 1 2 249.358 2.172 20 0 BEADLO CC[C@H](C)CC(=O)NCc1cn2ccccc2[nH+]1 ZINC000276539181 171260615 /nfs/dbraw/zinc/26/06/15/171260615.db2.gz DTCZOXCRVKCEKF-NSHDSACASA-N 1 2 245.326 2.387 20 0 BEADLO CC[C@H](C)CCC(=O)N[C@H]1CCn2cc[nH+]c2C1 ZINC000354852986 171268238 /nfs/dbraw/zinc/26/82/38/171268238.db2.gz RUSHEQNLIGTSAZ-RYUDHWBXSA-N 1 2 249.358 2.140 20 0 BEADLO CC[C@H](C)CN(C)c1nc[nH+]c(N)c1Cl ZINC000233990012 171276213 /nfs/dbraw/zinc/27/62/13/171276213.db2.gz RZZLVYLIQDTCBO-ZETCQYMHSA-N 1 2 228.727 2.195 20 0 BEADLO CC[C@H](C)CN(C)c1[nH+]cnc(N)c1Cl ZINC000233990012 171276215 /nfs/dbraw/zinc/27/62/15/171276215.db2.gz RZZLVYLIQDTCBO-ZETCQYMHSA-N 1 2 228.727 2.195 20 0 BEADLO CC[C@H](C)C[NH2+][C@@H](Cc1ccccc1)C(=O)OC ZINC000276493659 171287157 /nfs/dbraw/zinc/28/71/57/171287157.db2.gz QMMOVPDDAZYCNY-JSGCOSHPSA-N 1 2 249.354 2.406 20 0 BEADLO CC[C@H](C)NC(=O)Cn1c(C)[nH+]c2ccccc21 ZINC000005627766 171328765 /nfs/dbraw/zinc/32/87/65/171328765.db2.gz HIKUVFROMWMJHZ-JTQLQIEISA-N 1 2 245.326 2.259 20 0 BEADLO CC[C@H](C)[NH2+]C1(C(=O)OC)Cc2ccccc2C1 ZINC000038067329 171339585 /nfs/dbraw/zinc/33/95/85/171339585.db2.gz FEWOVVOTIUCMNT-NSHDSACASA-N 1 2 247.338 2.085 20 0 BEADLO CC[C@H](C)[NH2+][C@H](c1cccs1)c1nnc[nH]1 ZINC000295964889 171345849 /nfs/dbraw/zinc/34/58/49/171345849.db2.gz MKCKCFHSCSRFDC-WCBMZHEXSA-N 1 2 236.344 2.344 20 0 BEADLO CC[C@H](C)Nc1nc(N(C)C)nc(C(C)C)[nH+]1 ZINC000271003032 171350179 /nfs/dbraw/zinc/35/01/79/171350179.db2.gz YQLIKUBBTVOLML-VIFPVBQESA-N 1 2 237.351 2.271 20 0 BEADLO CC[C@H](C)Nc1nc(C(C)C)[nH+]c(N(C)C)n1 ZINC000271003032 171350181 /nfs/dbraw/zinc/35/01/81/171350181.db2.gz YQLIKUBBTVOLML-VIFPVBQESA-N 1 2 237.351 2.271 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000356808152 171360145 /nfs/dbraw/zinc/36/01/45/171360145.db2.gz XJRFWGREDJTPFR-HBNTYKKESA-N 1 2 249.358 2.065 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000356808152 171360147 /nfs/dbraw/zinc/36/01/47/171360147.db2.gz XJRFWGREDJTPFR-HBNTYKKESA-N 1 2 249.358 2.065 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+]1CC2CC1(C)C2 ZINC000662385956 412137775 /nfs/dbraw/zinc/13/77/75/412137775.db2.gz MOXNJOYBRYCUEI-JEUQWKINSA-N 1 2 209.318 2.083 20 0 BEADLO C[C@@H](c1csnn1)[N@H+]1CC2CC1(C)C2 ZINC000662385956 412137780 /nfs/dbraw/zinc/13/77/80/412137780.db2.gz MOXNJOYBRYCUEI-JEUQWKINSA-N 1 2 209.318 2.083 20 0 BEADLO CC[C@H](C)[C@H]([NH2+]CCSC(C)C)C(=O)OC ZINC000310036777 171399299 /nfs/dbraw/zinc/39/92/99/171399299.db2.gz UOAUSJHBIFSBEL-QWRGUYRKSA-N 1 2 247.404 2.305 20 0 BEADLO CC[C@H]([NH2+]Cc1ncn(C)n1)c1ccc(F)cc1 ZINC000134212771 171533609 /nfs/dbraw/zinc/53/36/09/171533609.db2.gz WIHZWCMWQUHUDB-LBPRGKRZSA-N 1 2 248.305 2.195 20 0 BEADLO CC[C@H]([NH2+][C@H]1CCOC1=O)c1ccccc1 ZINC000019876279 171548503 /nfs/dbraw/zinc/54/85/03/171548503.db2.gz VOTZOMCBZGJFFD-RYUDHWBXSA-N 1 2 219.284 2.043 20 0 BEADLO CC[C@]1(C)CCN(C(=O)CCc2c[nH+]cn2C)C1 ZINC000339163460 171713625 /nfs/dbraw/zinc/71/36/25/171713625.db2.gz NYAVEQISSYRFSV-CQSZACIVSA-N 1 2 249.358 2.001 20 0 BEADLO c1cn(Cc2nc(CC3CC3)cs2)c[nH+]1 ZINC000663219294 412394320 /nfs/dbraw/zinc/39/43/20/412394320.db2.gz HBWLWRYWAYPWJO-UHFFFAOYSA-N 1 2 219.313 2.340 20 0 BEADLO CCc1ccc([C@H](C)[NH2+]Cc2nncn2CC)o1 ZINC000158499691 171839608 /nfs/dbraw/zinc/83/96/08/171839608.db2.gz AEGKMVYZDNHHBR-JTQLQIEISA-N 1 2 248.330 2.304 20 0 BEADLO CCc1cccc(NC(=O)Cc2[nH]c[nH+]c2C)c1 ZINC000278613866 171859807 /nfs/dbraw/zinc/85/98/07/171859807.db2.gz LYQIDLFYHNDVAT-UHFFFAOYSA-N 1 2 243.310 2.462 20 0 BEADLO CCc1cn(Cc2nnc(C(C)(C)C)o2)c[nH+]1 ZINC001652207841 1173046386 /nfs/dbraw/zinc/04/63/86/1173046386.db2.gz FTSLTEQMHYIHPU-UHFFFAOYSA-N 1 2 234.303 2.174 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)CO[C@H](C)CC ZINC000269860115 171924929 /nfs/dbraw/zinc/92/49/29/171924929.db2.gz KMFSBPOUTBBISC-SNVBAGLBSA-N 1 2 236.315 2.398 20 0 BEADLO CCc1nc([C@@H](C)[NH2+]CCF)cs1 ZINC000308488888 172002283 /nfs/dbraw/zinc/00/22/83/172002283.db2.gz QHRKSTLYLPHENC-SSDOTTSWSA-N 1 2 202.298 2.326 20 0 BEADLO CCc1ncc(C[N@@H+]2CCO[C@@H](CC)C2)s1 ZINC000271024585 172017842 /nfs/dbraw/zinc/01/78/42/172017842.db2.gz CUIHDYOCFWWHQU-JTQLQIEISA-N 1 2 240.372 2.316 20 0 BEADLO CCc1ncc(C[N@H+]2CCO[C@@H](CC)C2)s1 ZINC000271024585 172017845 /nfs/dbraw/zinc/01/78/45/172017845.db2.gz CUIHDYOCFWWHQU-JTQLQIEISA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nn(C)cc1N[C@H](C)c1[nH+]ccn1CC ZINC000296830178 172044224 /nfs/dbraw/zinc/04/42/24/172044224.db2.gz MMTSKVFAAUREHT-SNVBAGLBSA-N 1 2 247.346 2.372 20 0 BEADLO CCc1nnc(C[NH2+]Cc2occc2C)s1 ZINC000289739796 172051523 /nfs/dbraw/zinc/05/15/23/172051523.db2.gz HKQLSCJDIPZPPX-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO CCc1noc(C)c1C[NH2+]Cc1cscn1 ZINC000292853332 172079763 /nfs/dbraw/zinc/07/97/63/172079763.db2.gz CAXAZWGKOQWBMJ-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO CCc1noc([C@@H](C)[N@H+]2CC=C(C)CC2)n1 ZINC000270340976 172089679 /nfs/dbraw/zinc/08/96/79/172089679.db2.gz NRRXXBKKASKQGX-SNVBAGLBSA-N 1 2 221.304 2.345 20 0 BEADLO CCc1noc([C@@H](C)[N@@H+]2CC=C(C)CC2)n1 ZINC000270340976 172089681 /nfs/dbraw/zinc/08/96/81/172089681.db2.gz NRRXXBKKASKQGX-SNVBAGLBSA-N 1 2 221.304 2.345 20 0 BEADLO CCc1nocc1C[N@H+](C)[C@H](C)c1cnn(C)c1 ZINC000352778625 172096330 /nfs/dbraw/zinc/09/63/30/172096330.db2.gz VZAHUYVCTZYZPE-SNVBAGLBSA-N 1 2 248.330 2.164 20 0 BEADLO CCc1nocc1C[N@@H+](C)[C@H](C)c1cnn(C)c1 ZINC000352778625 172096331 /nfs/dbraw/zinc/09/63/31/172096331.db2.gz VZAHUYVCTZYZPE-SNVBAGLBSA-N 1 2 248.330 2.164 20 0 BEADLO CCn1cc(CNc2ccc[nH+]c2C)cn1 ZINC000125067411 172175613 /nfs/dbraw/zinc/17/56/13/172175613.db2.gz JCSJNFNVRUVBHB-UHFFFAOYSA-N 1 2 216.288 2.219 20 0 BEADLO CCn1cc(CNc2ccc(C)[nH+]c2)cn1 ZINC000124836163 172176004 /nfs/dbraw/zinc/17/60/04/172176004.db2.gz ACJZOSZTKUOPAA-UHFFFAOYSA-N 1 2 216.288 2.219 20 0 BEADLO CCn1cccc1C[N@H+](C)Cc1ccon1 ZINC000267387597 172203796 /nfs/dbraw/zinc/20/37/96/172203796.db2.gz HARIPNQXBCJIQS-UHFFFAOYSA-N 1 2 219.288 2.128 20 0 BEADLO CCn1cccc1C[N@@H+](C)Cc1ccon1 ZINC000267387597 172203801 /nfs/dbraw/zinc/20/38/01/172203801.db2.gz HARIPNQXBCJIQS-UHFFFAOYSA-N 1 2 219.288 2.128 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)/C=C1/CC[C@@H](C)C1 ZINC000295718422 172222256 /nfs/dbraw/zinc/22/22/56/172222256.db2.gz KKBBYSWFDNBLKQ-ZGSOTFDTSA-N 1 2 247.342 2.266 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C1C(C)(C)C1(C)C ZINC000295765935 172222361 /nfs/dbraw/zinc/22/23/61/172222361.db2.gz OULOYEKEKOHQDA-UHFFFAOYSA-N 1 2 249.358 2.201 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)CC1(C)CCCC1 ZINC000295739319 172222471 /nfs/dbraw/zinc/22/24/71/172222471.db2.gz SONNHODIFUCTOZ-UHFFFAOYSA-N 1 2 249.358 2.490 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)c1cc(C)cs1 ZINC000295718441 172222938 /nfs/dbraw/zinc/22/29/38/172222938.db2.gz QCJQTWUIECKEQE-UHFFFAOYSA-N 1 2 249.339 2.203 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C(C)(C)C(C)C ZINC000295823779 172223110 /nfs/dbraw/zinc/22/31/10/172223110.db2.gz UIBBKWYXDZJIEV-UHFFFAOYSA-N 1 2 237.347 2.201 20 0 BEADLO CCn1ccnc1C[NH2+][C@@H](C)c1cncc(F)c1 ZINC000272788905 172224248 /nfs/dbraw/zinc/22/42/48/172224248.db2.gz SOHMGKZCTZFEBG-JTQLQIEISA-N 1 2 248.305 2.288 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)Nc1ccc(OC)nc1 ZINC000296701445 172229560 /nfs/dbraw/zinc/22/95/60/172229560.db2.gz HROTWWDCGWEXOA-JTQLQIEISA-N 1 2 246.314 2.480 20 0 BEADLO CCn1cnnc1C[NH2+]Cc1cccc(C)c1F ZINC000296407316 172236146 /nfs/dbraw/zinc/23/61/46/172236146.db2.gz LWGFHSJOQOHGAK-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO CCn1cnnc1C[NH2+][C@@H](C)c1ccc(C)o1 ZINC000158487361 172237104 /nfs/dbraw/zinc/23/71/04/172237104.db2.gz IRUCUUMJCGSBMX-JTQLQIEISA-N 1 2 234.303 2.050 20 0 BEADLO CCn1nccc1CC[N@@H+]1CCC[C@H]1C(F)F ZINC000353170390 172259141 /nfs/dbraw/zinc/25/91/41/172259141.db2.gz GXANEPHRDIGOQV-NSHDSACASA-N 1 2 243.301 2.175 20 0 BEADLO CCn1nccc1CC[N@H+]1CCC[C@H]1C(F)F ZINC000353170390 172259145 /nfs/dbraw/zinc/25/91/45/172259145.db2.gz GXANEPHRDIGOQV-NSHDSACASA-N 1 2 243.301 2.175 20 0 BEADLO CCn1nccc1C[N@H+](C)Cc1occc1C ZINC000292899569 172263230 /nfs/dbraw/zinc/26/32/30/172263230.db2.gz ZTRVQDNIHOCWMK-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CCn1nccc1C[N@@H+](C)Cc1occc1C ZINC000292899569 172263234 /nfs/dbraw/zinc/26/32/34/172263234.db2.gz ZTRVQDNIHOCWMK-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CCn1nccc1C[N@H+](C)Cc1ccc(F)cn1 ZINC000352340810 172264902 /nfs/dbraw/zinc/26/49/02/172264902.db2.gz DVDZINJELWXMRT-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO CCn1nccc1C[N@@H+](C)Cc1ccc(F)cn1 ZINC000352340810 172264903 /nfs/dbraw/zinc/26/49/03/172264903.db2.gz DVDZINJELWXMRT-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO CCn1nccc1C[N@@H+]1CCC[C@@](C)(F)C1 ZINC000296040347 172265734 /nfs/dbraw/zinc/26/57/34/172265734.db2.gz OAOVNNPSDXYNOY-GFCCVEGCSA-N 1 2 225.311 2.227 20 0 BEADLO CCn1nccc1C[N@H+]1CCC[C@@](C)(F)C1 ZINC000296040347 172265736 /nfs/dbraw/zinc/26/57/36/172265736.db2.gz OAOVNNPSDXYNOY-GFCCVEGCSA-N 1 2 225.311 2.227 20 0 BEADLO CCn1ncnc1C[NH2+][C@H](C)c1ccc(C)o1 ZINC000088589963 172283230 /nfs/dbraw/zinc/28/32/30/172283230.db2.gz CTGFLWIRSUWRDZ-SNVBAGLBSA-N 1 2 234.303 2.050 20 0 BEADLO CCn1ncnc1C[NH2+][C@H]1CCCc2occc21 ZINC000359050498 172284310 /nfs/dbraw/zinc/28/43/10/172284310.db2.gz AMOSHLXCYAZJRF-NSHDSACASA-N 1 2 246.314 2.058 20 0 BEADLO CN(C(=O)COc1cc[nH+]cc1)C1CCCCC1 ZINC000276460717 172313389 /nfs/dbraw/zinc/31/33/89/172313389.db2.gz NYKMUPVPPUIBCO-UHFFFAOYSA-N 1 2 248.326 2.252 20 0 BEADLO Cc1noc(C(C)(C)[NH2+]Cc2ccc(O)cc2)n1 ZINC000671310007 487624954 /nfs/dbraw/zinc/62/49/54/487624954.db2.gz LSVNWRWXVAWLAD-UHFFFAOYSA-N 1 2 247.298 2.109 20 0 BEADLO C[N@@H+]1CCC[C@H]1C(=O)Nc1ccccc1Cl ZINC000082326395 173051393 /nfs/dbraw/zinc/05/13/93/173051393.db2.gz VNOYZXHHFKYSSM-NSHDSACASA-N 1 2 238.718 2.373 20 0 BEADLO C[N@H+]1CCC[C@H]1C(=O)Nc1ccccc1Cl ZINC000082326395 173051396 /nfs/dbraw/zinc/05/13/96/173051396.db2.gz VNOYZXHHFKYSSM-NSHDSACASA-N 1 2 238.718 2.373 20 0 BEADLO CNC(=O)c1cccc(CNc2cccc[nH+]2)c1 ZINC000048558132 173311880 /nfs/dbraw/zinc/31/18/80/173311880.db2.gz WZFCPOSOOMVSAW-UHFFFAOYSA-N 1 2 241.294 2.053 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2CCCC2(C)C)n1 ZINC000226694321 173399691 /nfs/dbraw/zinc/39/96/91/173399691.db2.gz KUZNFPSUSPFCGI-QMMMGPOBSA-N 1 2 209.293 2.083 20 0 BEADLO CNc1cc(-c2ccnc(OC)c2)cc[nH+]1 ZINC000091364330 173471950 /nfs/dbraw/zinc/47/19/50/173471950.db2.gz SFRYBDGYFFCCCM-UHFFFAOYSA-N 1 2 215.256 2.194 20 0 BEADLO COC(=O)C(C)(C)CCNc1ccc[nH+]c1C ZINC000354575873 173502500 /nfs/dbraw/zinc/50/25/00/173502500.db2.gz VIQRZBRVISIMBJ-UHFFFAOYSA-N 1 2 236.315 2.391 20 0 BEADLO COC(=O)[C@H](CC(F)F)[NH2+]C[C@@H]1CC=CCC1 ZINC000355048839 173794420 /nfs/dbraw/zinc/79/44/20/173794420.db2.gz KHMKWUWLOCKTHK-ZJUUUORDSA-N 1 2 247.285 2.129 20 0 BEADLO COC1(C[NH2+]CC(F)(F)C(F)F)CCCC1 ZINC000336760108 174001607 /nfs/dbraw/zinc/00/16/07/174001607.db2.gz JNXNOSKMBKGMSI-UHFFFAOYSA-N 1 2 243.244 2.436 20 0 BEADLO COC1(CNc2cc[nH+]c(C)n2)CCCC1 ZINC000295028882 174006914 /nfs/dbraw/zinc/00/69/14/174006914.db2.gz VTUWDIIWEDMTNB-UHFFFAOYSA-N 1 2 221.304 2.156 20 0 BEADLO COC1(CNc2cc[nH+]c(C3CC3)n2)CCC1 ZINC000272546341 174007020 /nfs/dbraw/zinc/00/70/20/174007020.db2.gz SOZKQBBVELDVLY-UHFFFAOYSA-N 1 2 233.315 2.335 20 0 BEADLO COC1C[NH+](Cc2ccc(OC(C)C)cc2)C1 ZINC000358462623 174035732 /nfs/dbraw/zinc/03/57/32/174035732.db2.gz SXRLVHJWJISLEH-UHFFFAOYSA-N 1 2 235.327 2.304 20 0 BEADLO COCC1(C(=O)Nc2cc[nH+]c(C)c2)CCC1 ZINC000284180616 174090292 /nfs/dbraw/zinc/09/02/92/174090292.db2.gz ZFDOAPPUJPZILJ-UHFFFAOYSA-N 1 2 234.299 2.145 20 0 BEADLO COCC1(C[N@H+](C)CC(F)F)CCC1 ZINC000361294044 174095599 /nfs/dbraw/zinc/09/55/99/174095599.db2.gz BWKJFJARHBYHCA-UHFFFAOYSA-N 1 2 207.264 2.000 20 0 BEADLO COCC1(C[N@@H+](C)CC(F)F)CCC1 ZINC000361294044 174095600 /nfs/dbraw/zinc/09/56/00/174095600.db2.gz BWKJFJARHBYHCA-UHFFFAOYSA-N 1 2 207.264 2.000 20 0 BEADLO COCCC1(C)C[NH+](Cc2csc(C)n2)C1 ZINC000297426709 174153038 /nfs/dbraw/zinc/15/30/38/174153038.db2.gz NZOOYOITMHSNTQ-UHFFFAOYSA-N 1 2 240.372 2.310 20 0 BEADLO COCCC[N@H+](C)C/C(Cl)=C/Cl ZINC000268687417 174216505 /nfs/dbraw/zinc/21/65/05/174216505.db2.gz QFNUKMWDKGQOQI-VURMDHGXSA-N 1 2 212.120 2.274 20 0 BEADLO COCCC[N@@H+](C)C/C(Cl)=C/Cl ZINC000268687417 174216507 /nfs/dbraw/zinc/21/65/07/174216507.db2.gz QFNUKMWDKGQOQI-VURMDHGXSA-N 1 2 212.120 2.274 20 0 BEADLO COCCCCNc1[nH+]ccc(C)c1Cl ZINC000336772598 174196228 /nfs/dbraw/zinc/19/62/28/174196228.db2.gz XTRAMJLQWAMEQL-UHFFFAOYSA-N 1 2 228.723 2.304 20 0 BEADLO COCCC[N@H+](C)Cc1c(F)ccc(O)c1F ZINC000295268165 174218166 /nfs/dbraw/zinc/21/81/66/174218166.db2.gz HKHBGQUAHDZRTJ-UHFFFAOYSA-N 1 2 245.269 2.139 20 0 BEADLO COCCC[N@@H+](C)Cc1c(F)ccc(O)c1F ZINC000295268165 174218167 /nfs/dbraw/zinc/21/81/67/174218167.db2.gz HKHBGQUAHDZRTJ-UHFFFAOYSA-N 1 2 245.269 2.139 20 0 BEADLO COCCC[N@@H+]1CCCC[C@H]1C(F)F ZINC000337411191 174227867 /nfs/dbraw/zinc/22/78/67/174227867.db2.gz OZEFTGZOKXGGQI-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO COCCC[N@H+]1CCCC[C@H]1C(F)F ZINC000337411191 174227872 /nfs/dbraw/zinc/22/78/72/174227872.db2.gz OZEFTGZOKXGGQI-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO COCCN(C)c1cc(C(F)(F)F)cc[nH+]1 ZINC000267337423 174284021 /nfs/dbraw/zinc/28/40/21/174284021.db2.gz CYGZATFRJSDKQS-UHFFFAOYSA-N 1 2 234.221 2.183 20 0 BEADLO COCC[N@H+](Cc1c[nH]cn1)Cc1ccccc1 ZINC000179590900 174299302 /nfs/dbraw/zinc/29/93/02/174299302.db2.gz PRNNQMVZWASAEQ-UHFFFAOYSA-N 1 2 245.326 2.058 20 0 BEADLO COCC[N@@H+](Cc1c[nH]cn1)Cc1ccccc1 ZINC000179590900 174299304 /nfs/dbraw/zinc/29/93/04/174299304.db2.gz PRNNQMVZWASAEQ-UHFFFAOYSA-N 1 2 245.326 2.058 20 0 BEADLO COCC[N@H+](Cc1cnc[nH]1)Cc1ccccc1 ZINC000179590900 174299305 /nfs/dbraw/zinc/29/93/05/174299305.db2.gz PRNNQMVZWASAEQ-UHFFFAOYSA-N 1 2 245.326 2.058 20 0 BEADLO COCC[N@@H+](Cc1cnc[nH]1)Cc1ccccc1 ZINC000179590900 174299306 /nfs/dbraw/zinc/29/93/06/174299306.db2.gz PRNNQMVZWASAEQ-UHFFFAOYSA-N 1 2 245.326 2.058 20 0 BEADLO COCC[N@@H+]1CCc2c3ccccc3[nH]c2C1 ZINC000126402866 174316025 /nfs/dbraw/zinc/31/60/25/174316025.db2.gz MIQGOOOONBVICE-UHFFFAOYSA-N 1 2 230.311 2.172 20 0 BEADLO COCC[N@H+]1CCc2c3ccccc3[nH]c2C1 ZINC000126402866 174316028 /nfs/dbraw/zinc/31/60/28/174316028.db2.gz MIQGOOOONBVICE-UHFFFAOYSA-N 1 2 230.311 2.172 20 0 BEADLO COCC[N@@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000120819444 174318692 /nfs/dbraw/zinc/31/86/92/174318692.db2.gz FIRSGEGUMGLERD-ZYHUDNBSSA-N 1 2 241.356 2.156 20 0 BEADLO COCC[N@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000120819444 174318695 /nfs/dbraw/zinc/31/86/95/174318695.db2.gz FIRSGEGUMGLERD-ZYHUDNBSSA-N 1 2 241.356 2.156 20 0 BEADLO COCC[C@@H]([NH2+]Cc1ncc[nH]1)c1ccc(C)o1 ZINC000272388623 174393862 /nfs/dbraw/zinc/39/38/62/174393862.db2.gz ZBUHSQQSDXYQOJ-LLVKDONJSA-N 1 2 249.314 2.179 20 0 BEADLO COCC[C@H]([NH2+]Cc1ccon1)c1ccco1 ZINC000273294936 174417348 /nfs/dbraw/zinc/41/73/48/174417348.db2.gz QHKDLGSPQKRXOK-NSHDSACASA-N 1 2 236.271 2.135 20 0 BEADLO COCc1cnc(C[NH2+][C@@H]2CCC[C@H]2F)s1 ZINC000339584380 174636425 /nfs/dbraw/zinc/63/64/25/174636425.db2.gz MANHUQQOZOJQEM-NXEZZACHSA-N 1 2 244.335 2.270 20 0 BEADLO Cc1cccc(OC[C@H](C)[NH2+]Cc2ccn[nH]2)c1 ZINC000066989187 1173064542 /nfs/dbraw/zinc/06/45/42/1173064542.db2.gz OPIFXSAPODRXQP-LBPRGKRZSA-N 1 2 245.326 2.275 20 0 BEADLO COc1ccc(CCNc2cc(C)[nH+]cn2)cc1 ZINC000040727026 175092737 /nfs/dbraw/zinc/09/27/37/175092737.db2.gz PPYHJRHECKXWQC-UHFFFAOYSA-N 1 2 243.310 2.448 20 0 BEADLO COc1ccc(C[NH2+]Cc2csc(C)n2)cn1 ZINC000020253378 175108702 /nfs/dbraw/zinc/10/87/02/175108702.db2.gz SGGUZMPLTZGGIH-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1cc[nH]n1 ZINC000037089996 175131891 /nfs/dbraw/zinc/13/18/91/175131891.db2.gz VKZKJAARRWKHLQ-SECBINFHSA-N 1 2 249.289 2.408 20 0 BEADLO COc1ccc([NH2+]CC2=CCCOC2)c(OC)c1 ZINC000126633074 175151146 /nfs/dbraw/zinc/15/11/46/175151146.db2.gz OHEARWUTHFOBDW-UHFFFAOYSA-N 1 2 249.310 2.462 20 0 BEADLO COc1ccc(NCc2[nH]cc[nH+]2)cc1OC ZINC000049714516 175153258 /nfs/dbraw/zinc/15/32/58/175153258.db2.gz LNCSUMUSWLMCIK-UHFFFAOYSA-N 1 2 233.271 2.039 20 0 BEADLO COc1ccc([C@@H](C)[NH2+]Cc2csnn2)cc1 ZINC000090339921 175177490 /nfs/dbraw/zinc/17/74/90/175177490.db2.gz SZSLNXUITZMLKO-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO COc1ccc2[nH+]c(C)cc(OCCCO)c2c1 ZINC000172067367 175227928 /nfs/dbraw/zinc/22/79/28/175227928.db2.gz PVTTWUFPRIXUSG-UHFFFAOYSA-N 1 2 247.294 2.313 20 0 BEADLO COc1cccc(C2([NH2+]Cc3ncc[nH]3)CC2)c1 ZINC000150905551 175247837 /nfs/dbraw/zinc/24/78/37/175247837.db2.gz PDFATVFRKPLILJ-UHFFFAOYSA-N 1 2 243.310 2.197 20 0 BEADLO COc1cccc(CN(C)c2cc[nH+]c(C)n2)c1 ZINC000266143315 175255259 /nfs/dbraw/zinc/25/52/59/175255259.db2.gz RCTHJIXSSILDPB-UHFFFAOYSA-N 1 2 243.310 2.430 20 0 BEADLO COc1cccc(NCc2c[nH+]c[nH]2)c1 ZINC000054763376 175279347 /nfs/dbraw/zinc/27/93/47/175279347.db2.gz FSZKIXMXGMEUDY-UHFFFAOYSA-N 1 2 203.245 2.030 20 0 BEADLO COc1cccc(NCc2c[nH]c[nH+]2)c1 ZINC000054763376 175279349 /nfs/dbraw/zinc/27/93/49/175279349.db2.gz FSZKIXMXGMEUDY-UHFFFAOYSA-N 1 2 203.245 2.030 20 0 BEADLO COc1ccccc1C[NH2+]Cc1cc(C)on1 ZINC000044295842 175330679 /nfs/dbraw/zinc/33/06/79/175330679.db2.gz MWRZAHMLCAPXMC-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO COc1ccnc(C[N@H+](C)Cc2cccnc2)c1 ZINC000273230940 175358192 /nfs/dbraw/zinc/35/81/92/175358192.db2.gz WDVIESJYSWZMJA-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1ccnc(C[N@@H+](C)Cc2cccnc2)c1 ZINC000273230940 175358194 /nfs/dbraw/zinc/35/81/94/175358194.db2.gz WDVIESJYSWZMJA-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1cc[nH+]c(CN(C)Cc2cccnc2)c1 ZINC000273230940 175358196 /nfs/dbraw/zinc/35/81/96/175358196.db2.gz WDVIESJYSWZMJA-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1ccnc(C[N@H+](C)Cc2ccoc2)c1 ZINC000359381498 175358668 /nfs/dbraw/zinc/35/86/68/175358668.db2.gz DGWMUKFBGDFJHP-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1ccnc(C[N@@H+](C)Cc2ccoc2)c1 ZINC000359381498 175358669 /nfs/dbraw/zinc/35/86/69/175358669.db2.gz DGWMUKFBGDFJHP-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1cc[nH+]c(CN(C)Cc2ccoc2)c1 ZINC000359381498 175358671 /nfs/dbraw/zinc/35/86/71/175358671.db2.gz DGWMUKFBGDFJHP-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1cc[nH+]c(CN2CCC[C@H]2C(F)F)c1 ZINC000353172308 175359460 /nfs/dbraw/zinc/35/94/60/175359460.db2.gz NNKNVOLOYWUUSS-NSHDSACASA-N 1 2 242.269 2.320 20 0 BEADLO COc1cc[nH+]cc1COc1cccc(C)n1 ZINC000341336688 175373099 /nfs/dbraw/zinc/37/30/99/175373099.db2.gz IKKWXVIGUCDLOS-UHFFFAOYSA-N 1 2 230.267 2.373 20 0 BEADLO COc1cc[nH+]cc1CSC1=NCCS1 ZINC000286503447 175373831 /nfs/dbraw/zinc/37/38/31/175373831.db2.gz ISNQXPDYZZDQMG-UHFFFAOYSA-N 1 2 240.353 2.426 20 0 BEADLO COc1cc[nH+]cc1COC(=O)CC1CCC1 ZINC000286957983 175374213 /nfs/dbraw/zinc/37/42/13/175374213.db2.gz LAIBIWSDYLXLQV-UHFFFAOYSA-N 1 2 235.283 2.324 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C[C@H]1C=CCC1 ZINC000299502866 175375193 /nfs/dbraw/zinc/37/51/93/175375193.db2.gz QVEMINVQXHBCHQ-JTQLQIEISA-N 1 2 232.283 2.385 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H]1C[C@H]1C(C)C ZINC000185210462 175375341 /nfs/dbraw/zinc/37/53/41/175375341.db2.gz SJTTYPDNEXKVRZ-VHSXEESVSA-N 1 2 234.299 2.321 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C(C)(C)C(F)F ZINC000361687367 175375629 /nfs/dbraw/zinc/37/56/29/175375629.db2.gz RZIOTDHIGATRJU-UHFFFAOYSA-N 1 2 244.241 2.320 20 0 BEADLO COc1nc(C)cc(C)c1COCc1[nH]cc[nH+]1 ZINC000286493758 175390006 /nfs/dbraw/zinc/39/00/06/175390006.db2.gz LQBDNMMODVABSS-UHFFFAOYSA-N 1 2 247.298 2.147 20 0 BEADLO CS[C@H]1CC[N@@H+]([C@@H](C)c2csnn2)C1 ZINC000336262130 175569784 /nfs/dbraw/zinc/56/97/84/175569784.db2.gz XKTXVAVRDPBKLB-YUMQZZPRSA-N 1 2 229.374 2.036 20 0 BEADLO CS[C@H]1CC[N@H+]([C@@H](C)c2csnn2)C1 ZINC000336262130 175569785 /nfs/dbraw/zinc/56/97/85/175569785.db2.gz XKTXVAVRDPBKLB-YUMQZZPRSA-N 1 2 229.374 2.036 20 0 BEADLO C[C@@H]([NH2+]C/C=C/c1ccccc1)c1ncn(C)n1 ZINC000275817785 175856131 /nfs/dbraw/zinc/85/61/31/175856131.db2.gz MINDPUYBRGVTNO-UVMWJGKXSA-N 1 2 242.326 2.179 20 0 BEADLO C[C@@H](Nc1cc[nH+]c(C2CC2)n1)[C@@H]1CCOC1 ZINC000266187925 175934847 /nfs/dbraw/zinc/93/48/47/175934847.db2.gz AZWKEXAIPPCJFE-MWLCHTKSSA-N 1 2 233.315 2.191 20 0 BEADLO C[C@@H](O)[C@H](C)n1cc[nH+]c1-c1ccccc1 ZINC000044186916 176011148 /nfs/dbraw/zinc/01/11/48/176011148.db2.gz DWJCYQSLAZIJJS-WDEREUQCSA-N 1 2 216.284 2.492 20 0 BEADLO C[C@@H](c1cccs1)[N@H+](C)Cc1cnn(C)n1 ZINC000290060487 176033376 /nfs/dbraw/zinc/03/33/76/176033376.db2.gz SMSZCJCFOFVSBZ-VIFPVBQESA-N 1 2 236.344 2.070 20 0 BEADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1cnn(C)n1 ZINC000290060487 176033378 /nfs/dbraw/zinc/03/33/78/176033378.db2.gz SMSZCJCFOFVSBZ-VIFPVBQESA-N 1 2 236.344 2.070 20 0 BEADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1cnns1 ZINC000290121314 176035605 /nfs/dbraw/zinc/03/56/05/176035605.db2.gz UEVSBUDTDDEZRU-VIFPVBQESA-N 1 2 234.328 2.126 20 0 BEADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1cnns1 ZINC000290121314 176035606 /nfs/dbraw/zinc/03/56/06/176035606.db2.gz UEVSBUDTDDEZRU-VIFPVBQESA-N 1 2 234.328 2.126 20 0 BEADLO C[C@@H](c1cnccn1)[N@H+](C)Cc1ccccn1 ZINC000275779653 176036242 /nfs/dbraw/zinc/03/62/42/176036242.db2.gz ZRGMJSHNAXPWBS-NSHDSACASA-N 1 2 228.299 2.065 20 0 BEADLO C[C@@H](c1cnccn1)[N@@H+](C)Cc1ccccn1 ZINC000275779653 176036243 /nfs/dbraw/zinc/03/62/43/176036243.db2.gz ZRGMJSHNAXPWBS-NSHDSACASA-N 1 2 228.299 2.065 20 0 BEADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CC[C@@H](O)C1 ZINC000304489791 176039495 /nfs/dbraw/zinc/03/94/95/176039495.db2.gz LIPPDCODHRWWAT-VHSXEESVSA-N 1 2 238.331 2.100 20 0 BEADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC[C@@H](O)C1 ZINC000304489791 176039497 /nfs/dbraw/zinc/03/94/97/176039497.db2.gz LIPPDCODHRWWAT-VHSXEESVSA-N 1 2 238.331 2.100 20 0 BEADLO C[C@@H]1CCCC[C@@H]1NC(=O)CCc1[nH]cc[nH+]1 ZINC000279265925 176078919 /nfs/dbraw/zinc/07/89/19/176078919.db2.gz VOJCUYAOJDJVDO-MNOVXSKESA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H]1CCCC[C@@H]1Nc1[nH+]cnc2c1cnn2C ZINC000014207694 176081536 /nfs/dbraw/zinc/08/15/36/176081536.db2.gz HGCUIXQXJDMQEP-KOLCDFICSA-N 1 2 245.330 2.354 20 0 BEADLO C[C@@H]1CCCC[C@@H]1OCCn1cc[nH+]c1 ZINC000121755570 176082348 /nfs/dbraw/zinc/08/23/48/176082348.db2.gz QXWNOJZZQYRVCO-NEPJUHHUSA-N 1 2 208.305 2.478 20 0 BEADLO C[C@@H]1CCC[N@@H+]1Cc1ncc(Cl)n1C ZINC000076117859 176110111 /nfs/dbraw/zinc/11/01/11/176110111.db2.gz DBLKLUALNCLLRO-MRVPVSSYSA-N 1 2 213.712 2.058 20 0 BEADLO C[C@@H]1CCC[N@H+]1Cc1ncc(Cl)n1C ZINC000076117859 176110112 /nfs/dbraw/zinc/11/01/12/176110112.db2.gz DBLKLUALNCLLRO-MRVPVSSYSA-N 1 2 213.712 2.058 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)CCc2[nH]cc[nH+]2)CC1 ZINC000289277649 176121987 /nfs/dbraw/zinc/12/19/87/176121987.db2.gz YXVCGXRMSXXCIA-VXGBXAGGSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@@H]1CCC[C@@H]1CC(=O)NCCCn1cc[nH+]c1 ZINC000185864640 176127115 /nfs/dbraw/zinc/12/71/15/176127115.db2.gz QOGFFTWEUIPSHD-CHWSQXEVSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@@H]1CCC[C@@H]1Nc1nc[nH+]c(N)c1Cl ZINC000235251612 176132478 /nfs/dbraw/zinc/13/24/78/176132478.db2.gz RIHYDDFAFVJAFV-RQJHMYQMSA-N 1 2 226.711 2.313 20 0 BEADLO C[C@@H]1CCC[C@@H]1Nc1[nH+]cnc(N)c1Cl ZINC000235251612 176132480 /nfs/dbraw/zinc/13/24/80/176132480.db2.gz RIHYDDFAFVJAFV-RQJHMYQMSA-N 1 2 226.711 2.313 20 0 BEADLO C[C@@H]1CCC[C@H]1CC(=O)N1CCn2c[nH+]cc2C1 ZINC000290955791 176147618 /nfs/dbraw/zinc/14/76/18/176147618.db2.gz QUUYQMXPVJMAOC-NEPJUHHUSA-N 1 2 247.342 2.052 20 0 BEADLO C[C@@H]1CCN(C(=O)CCc2[nH]cc[nH+]2)CC1(C)C ZINC000287686787 176155315 /nfs/dbraw/zinc/15/53/15/176155315.db2.gz FFGNZKKEBUMCDP-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H]1CCN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000264646937 176181564 /nfs/dbraw/zinc/18/15/64/176181564.db2.gz HOBOOLYJUIVOTG-SECBINFHSA-N 1 2 203.289 2.200 20 0 BEADLO C[C@@H]1CC[C@@H](CC(=O)Nc2ccc(N)[nH+]c2)C1 ZINC000151668256 176201346 /nfs/dbraw/zinc/20/13/46/176201346.db2.gz PHSWGSGRLYPDBR-NXEZZACHSA-N 1 2 233.315 2.429 20 0 BEADLO C[C@H]1CC[C@H](Nc2[nH+]cnc3c2cnn3C)CC1 ZINC000252952966 176215132 /nfs/dbraw/zinc/21/51/32/176215132.db2.gz GCBMSQLAFRKYRD-MGCOHNPYSA-N 1 2 245.330 2.354 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)NCc2[nH+]ccn2C)C[C@H]1C ZINC000294487647 176221598 /nfs/dbraw/zinc/22/15/98/176221598.db2.gz GEINAWQNWVKDHB-UTUOFQBUSA-N 1 2 249.358 2.109 20 0 BEADLO C[C@@H]1C[NH+](Cc2cccs2)C[C@@H](C)S1=O ZINC000336462216 176307074 /nfs/dbraw/zinc/30/70/74/176307074.db2.gz NEKZVWUPLJRJMI-NXEZZACHSA-N 1 2 243.397 2.089 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ncn(-c3ccccc3)n2)[C@@H]1C ZINC000293425394 176311759 /nfs/dbraw/zinc/31/17/59/176311759.db2.gz NJJSPCNWGDAQQJ-VXGBXAGGSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ncn(-c3ccccc3)n2)[C@@H]1C ZINC000293425394 176311760 /nfs/dbraw/zinc/31/17/60/176311760.db2.gz NJJSPCNWGDAQQJ-VXGBXAGGSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@@H]1CN(c2cc[nH+]c(C3CC3)n2)C[C@H]1C ZINC000267664200 176320105 /nfs/dbraw/zinc/32/01/05/176320105.db2.gz NNGACLQZUYLVCW-NXEZZACHSA-N 1 2 217.316 2.446 20 0 BEADLO C[C@H]1CN(c2nc(N)c3ccccc3[nH+]2)C[C@H]1C ZINC000301859972 176320455 /nfs/dbraw/zinc/32/04/55/176320455.db2.gz CACWUQQSTPYNHP-AOOOYVTPSA-N 1 2 242.326 2.304 20 0 BEADLO C[C@@H]1CSCC[N@@H+]1Cc1ncc(C2CC2)o1 ZINC000270607929 176351447 /nfs/dbraw/zinc/35/14/47/176351447.db2.gz MTDGPEIIISVFQX-SECBINFHSA-N 1 2 238.356 2.489 20 0 BEADLO C[C@@H]1CSCC[N@H+]1Cc1ncc(C2CC2)o1 ZINC000270607929 176351448 /nfs/dbraw/zinc/35/14/48/176351448.db2.gz MTDGPEIIISVFQX-SECBINFHSA-N 1 2 238.356 2.489 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1cnn(C)c1C(F)(F)F ZINC000336582551 176364104 /nfs/dbraw/zinc/36/41/04/176364104.db2.gz HOJGQHSQIGDZQH-HTQZYQBOSA-N 1 2 247.264 2.422 20 0 BEADLO C[C@@H]1C[C@@H]1CC(=O)NCCCNc1cccc[nH+]1 ZINC000354379481 176389850 /nfs/dbraw/zinc/38/98/50/176389850.db2.gz CLJIMKHYKOTIFZ-VXGBXAGGSA-N 1 2 247.342 2.046 20 0 BEADLO C[C@@H]1C[C@@H]1CNc1cc[nH+]c(C2CC2)n1 ZINC000264901437 176398850 /nfs/dbraw/zinc/39/88/50/176398850.db2.gz VYKCNSSBSJPWIT-PSASIEDQSA-N 1 2 203.289 2.422 20 0 BEADLO C[C@H](O)c1cc(NCc2[nH]cc[nH+]2)ccc1F ZINC000285416513 177016681 /nfs/dbraw/zinc/01/66/81/177016681.db2.gz GGZXGNNHNCLFTH-QMMMGPOBSA-N 1 2 235.262 2.214 20 0 BEADLO C[C@H](SCCn1cc[nH+]c1)c1cnccn1 ZINC000185710683 177027318 /nfs/dbraw/zinc/02/73/18/177027318.db2.gz AUGRKCIUZLHMRN-JTQLQIEISA-N 1 2 234.328 2.168 20 0 BEADLO C[C@H](c1ccccn1)[N@H+](C)Cc1ccno1 ZINC000271090966 177042542 /nfs/dbraw/zinc/04/25/42/177042542.db2.gz TYPPKWUTHIYVEI-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1ccno1 ZINC000271090966 177042544 /nfs/dbraw/zinc/04/25/44/177042544.db2.gz TYPPKWUTHIYVEI-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H](c1ccccn1)[N@H+](C)Cc1cncn1C ZINC000179258728 177042945 /nfs/dbraw/zinc/04/29/45/177042945.db2.gz RWFZSHKQNIFJPG-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1cncn1C ZINC000179258728 177042946 /nfs/dbraw/zinc/04/29/46/177042946.db2.gz RWFZSHKQNIFJPG-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1ccco1)[N@H+](CC(=O)NC1CC1)C1CC1 ZINC000086233297 177047328 /nfs/dbraw/zinc/04/73/28/177047328.db2.gz MGYDBZZGKQKTCO-SNVBAGLBSA-N 1 2 248.326 2.084 20 0 BEADLO C[C@H](c1ccco1)[N@@H+](CC(=O)NC1CC1)C1CC1 ZINC000086233297 177047329 /nfs/dbraw/zinc/04/73/29/177047329.db2.gz MGYDBZZGKQKTCO-SNVBAGLBSA-N 1 2 248.326 2.084 20 0 BEADLO C[C@H](c1ccco1)[N@H+](C)Cc1cc[nH]n1 ZINC000131144039 177047505 /nfs/dbraw/zinc/04/75/05/177047505.db2.gz RDOXKCXCVUZLED-SECBINFHSA-N 1 2 205.261 2.196 20 0 BEADLO C[C@H](c1ccco1)[N@@H+](C)Cc1cc[nH]n1 ZINC000131144039 177047507 /nfs/dbraw/zinc/04/75/07/177047507.db2.gz RDOXKCXCVUZLED-SECBINFHSA-N 1 2 205.261 2.196 20 0 BEADLO C[C@H](c1cnccn1)[N@H+](C)CCC(F)(F)F ZINC000342186447 177050958 /nfs/dbraw/zinc/05/09/58/177050958.db2.gz JBSCHWKGNCRZKH-MRVPVSSYSA-N 1 2 233.237 2.422 20 0 BEADLO C[C@H](c1cnccn1)[N@@H+](C)CCC(F)(F)F ZINC000342186447 177050960 /nfs/dbraw/zinc/05/09/60/177050960.db2.gz JBSCHWKGNCRZKH-MRVPVSSYSA-N 1 2 233.237 2.422 20 0 BEADLO C[C@H](c1csnn1)[NH+]1CCC(CF)CC1 ZINC000336261737 177052353 /nfs/dbraw/zinc/05/23/53/177052353.db2.gz MFKVSGZCQNYPMM-MRVPVSSYSA-N 1 2 229.324 2.281 20 0 BEADLO C[C@H](c1nncn1C)[N@H+](C)Cc1cccs1 ZINC000287422289 177054032 /nfs/dbraw/zinc/05/40/32/177054032.db2.gz SZIBWRUOFSQRKP-SECBINFHSA-N 1 2 236.344 2.070 20 0 BEADLO C[C@H](c1nncn1C)[N@@H+](C)Cc1cccs1 ZINC000287422289 177054033 /nfs/dbraw/zinc/05/40/33/177054033.db2.gz SZIBWRUOFSQRKP-SECBINFHSA-N 1 2 236.344 2.070 20 0 BEADLO C[C@H]1CCCC[C@H]1N(C)C(=O)CCc1[nH]cc[nH+]1 ZINC000279259317 177087272 /nfs/dbraw/zinc/08/72/72/177087272.db2.gz SZNCSSDGWJCADP-NWDGAFQWSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H]1CCCC[C@H]1NC(=O)COc1cc[nH+]cc1 ZINC000276389745 177088179 /nfs/dbraw/zinc/08/81/79/177088179.db2.gz BNAMOQJELGHAIZ-WCQYABFASA-N 1 2 248.326 2.155 20 0 BEADLO C[C@H]1CCCN1c1cc(N2CCCC2)[nH+]cn1 ZINC000264301530 177111908 /nfs/dbraw/zinc/11/19/08/177111908.db2.gz DNQJWTKKGHLTHB-NSHDSACASA-N 1 2 232.331 2.066 20 0 BEADLO C[C@H]1CCCN1c1cc(N2CCCC2)nc[nH+]1 ZINC000264301530 177111909 /nfs/dbraw/zinc/11/19/09/177111909.db2.gz DNQJWTKKGHLTHB-NSHDSACASA-N 1 2 232.331 2.066 20 0 BEADLO C[C@@H]1CCC[C@H](C)N1C(=O)COc1cc[nH+]cc1 ZINC000276402568 177114892 /nfs/dbraw/zinc/11/48/92/177114892.db2.gz DKGWECMGNVKQKE-TXEJJXNPSA-N 1 2 248.326 2.250 20 0 BEADLO C[C@H]1CCC[C@@H](CNc2ccc(CO)c[nH+]2)C1 ZINC000356311100 177119353 /nfs/dbraw/zinc/11/93/53/177119353.db2.gz WAEIDMRLLHFEBM-NWDGAFQWSA-N 1 2 234.343 2.234 20 0 BEADLO C[C@H]1CCC[C@@H](NC(=O)CCc2c[nH+]cn2C)C1 ZINC000188572939 177121257 /nfs/dbraw/zinc/12/12/57/177121257.db2.gz HESBZOMPCFTBLW-NWDGAFQWSA-N 1 2 249.358 2.048 20 0 BEADLO C[C@H]1CCC[C@H](C(=O)N(C)Cc2[nH]cc[nH+]2)C1 ZINC000335835790 177128168 /nfs/dbraw/zinc/12/81/68/177128168.db2.gz WXPFQDDIGSINPR-QWRGUYRKSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)C[C@@H]1CCC[C@@H]1C ZINC000274388963 177139992 /nfs/dbraw/zinc/13/99/92/177139992.db2.gz BRMRZTLWWNPHHL-XQQFMLRXSA-N 1 2 249.358 2.214 20 0 BEADLO C[C@H]1CCC[C@H]1NC(=O)c1ccc2[nH+]ccn2c1 ZINC000264394440 177142037 /nfs/dbraw/zinc/14/20/37/177142037.db2.gz TWQPTLJNNGKWCQ-CMPLNLGQSA-N 1 2 243.310 2.253 20 0 BEADLO C[C@H]1CCC[C@H]1[NH2+]c1ccc(OCC(N)=O)cc1 ZINC000086673352 177142813 /nfs/dbraw/zinc/14/28/13/177142813.db2.gz BCXGEBSNDASSLL-GXFFZTMASA-N 1 2 248.326 2.151 20 0 BEADLO C[C@H]1CCN(C(=O)CCc2[nH]cc[nH+]2)C[C@H](C)C1 ZINC000287586364 177146653 /nfs/dbraw/zinc/14/66/53/177146653.db2.gz GUPZQAVOTSUADI-NWDGAFQWSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@H]1CCN(C(=O)Nc2ccn3cc[nH+]c3c2)C1 ZINC000280922008 177151519 /nfs/dbraw/zinc/15/15/19/177151519.db2.gz GKYSVJDJYQWBQQ-JTQLQIEISA-N 1 2 244.298 2.208 20 0 BEADLO C[C@H]1CC[C@@H]([NH2+]c2ccc(OCC(N)=O)cc2)C1 ZINC000080451879 177194184 /nfs/dbraw/zinc/19/41/84/177194184.db2.gz CDYUGUUCFSKEME-CMPLNLGQSA-N 1 2 248.326 2.151 20 0 BEADLO C[C@H]1CC[C@H](C)[NH+]1Cc1noc(C2CC2)n1 ZINC000123053685 177200420 /nfs/dbraw/zinc/20/04/20/177200420.db2.gz GRGACPZIPRQOQK-IUCAKERBSA-N 1 2 221.304 2.320 20 0 BEADLO C[C@H]1CC[S@](=O)CC[N@@H+]1Cc1ccsc1 ZINC000336348268 177208251 /nfs/dbraw/zinc/20/82/51/177208251.db2.gz FSOAMWFTRSLZBN-BONVTDFDSA-N 1 2 243.397 2.091 20 0 BEADLO C[C@H]1CC[S@](=O)CC[N@H+]1Cc1ccsc1 ZINC000336348268 177208253 /nfs/dbraw/zinc/20/82/53/177208253.db2.gz FSOAMWFTRSLZBN-BONVTDFDSA-N 1 2 243.397 2.091 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccncc2F)CC(C)(C)O1 ZINC000336221209 177267213 /nfs/dbraw/zinc/26/72/13/177267213.db2.gz QTEZZBUTZJRTSR-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccncc2F)CC(C)(C)O1 ZINC000336221209 177267214 /nfs/dbraw/zinc/26/72/14/177267214.db2.gz QTEZZBUTZJRTSR-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccnc(Cl)c2)C[C@H](C)O1 ZINC000050165734 177268595 /nfs/dbraw/zinc/26/85/95/177268595.db2.gz VRYRBXWZQRSPNX-AOOOYVTPSA-N 1 2 240.734 2.344 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccnc(Cl)c2)C[C@H](C)O1 ZINC000050165734 177268596 /nfs/dbraw/zinc/26/85/96/177268596.db2.gz VRYRBXWZQRSPNX-AOOOYVTPSA-N 1 2 240.734 2.344 20 0 BEADLO C[C@H]1C[N@H+](Cc2cnn(C)n2)[C@@H]1c1ccccc1 ZINC000289790233 177269524 /nfs/dbraw/zinc/26/95/24/177269524.db2.gz LOURMEDZNSWIAC-FZMZJTMJSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cnn(C)n2)[C@@H]1c1ccccc1 ZINC000289790233 177269525 /nfs/dbraw/zinc/26/95/25/177269525.db2.gz LOURMEDZNSWIAC-FZMZJTMJSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@H]1C[N@H+](Cc2nccs2)C[C@H](C2CC2)O1 ZINC000279302063 177271806 /nfs/dbraw/zinc/27/18/06/177271806.db2.gz MHOHXINFZYTRPH-GXSJLCMTSA-N 1 2 238.356 2.142 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nccs2)C[C@H](C2CC2)O1 ZINC000279302063 177271808 /nfs/dbraw/zinc/27/18/08/177271808.db2.gz MHOHXINFZYTRPH-GXSJLCMTSA-N 1 2 238.356 2.142 20 0 BEADLO C[C@H]1COCC[N@@H+]1CC1=Cc2ccccc2OC1 ZINC000091810436 177291642 /nfs/dbraw/zinc/29/16/42/177291642.db2.gz IWPGZUYQVNUHIW-LBPRGKRZSA-N 1 2 245.322 2.183 20 0 BEADLO C[C@H]1COCC[N@H+]1CC1=Cc2ccccc2OC1 ZINC000091810436 177291644 /nfs/dbraw/zinc/29/16/44/177291644.db2.gz IWPGZUYQVNUHIW-LBPRGKRZSA-N 1 2 245.322 2.183 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)NCc2[nH]cc[nH+]2)C[C@@H]1C ZINC000294719002 177308940 /nfs/dbraw/zinc/30/89/40/177308940.db2.gz UWINCQCSUYMSLZ-VWYCJHECSA-N 1 2 235.331 2.098 20 0 BEADLO C[C@H]1C[C@@H]([NH2+]Cc2ccco2)c2nccn21 ZINC000294284768 177333489 /nfs/dbraw/zinc/33/34/89/177333489.db2.gz YTKSHRXZNVNENH-GXSJLCMTSA-N 1 2 217.272 2.272 20 0 BEADLO C[C@H]1C[C@@H](Nc2ncc(Cl)cn2)c2[nH+]ccn21 ZINC000333642706 177334460 /nfs/dbraw/zinc/33/44/60/177334460.db2.gz CKSVTRADPPLRQL-IONNQARKSA-N 1 2 249.705 2.444 20 0 BEADLO C[C@H]1C[C@@H]1C[NH+]=c1[nH]c2cccc(F)c2n1C ZINC000357319030 177343708 /nfs/dbraw/zinc/34/37/08/177343708.db2.gz UDUHHMCKDGFUTH-DTWKUNHWSA-N 1 2 233.290 2.202 20 0 BEADLO C[C@H]1C[C@H](O)CN1c1[nH+]ccc2ccc(F)cc21 ZINC000336367894 177374634 /nfs/dbraw/zinc/37/46/34/177374634.db2.gz QXPSIJYABSGWJJ-CABZTGNLSA-N 1 2 246.285 2.333 20 0 BEADLO C[C@H]1C[C@H](c2cccnc2)[N@H+](Cc2cnc[nH]2)C1 ZINC000336351805 177375268 /nfs/dbraw/zinc/37/52/68/177375268.db2.gz JGGXJIQKHOSDMJ-SMDDNHRTSA-N 1 2 242.326 2.388 20 0 BEADLO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2cnc[nH]2)C1 ZINC000336351805 177375269 /nfs/dbraw/zinc/37/52/69/177375269.db2.gz JGGXJIQKHOSDMJ-SMDDNHRTSA-N 1 2 242.326 2.388 20 0 BEADLO C[C@H]1C[C@H]1CC(=O)N(C)c1ccc[nH+]c1N(C)C ZINC000361882578 177377896 /nfs/dbraw/zinc/37/78/96/177377896.db2.gz IVZBEHJVSKRDHQ-QWRGUYRKSA-N 1 2 247.342 2.157 20 0 BEADLO C[C@H]1Cc2ccccc2N1Cc1[nH+]ccn1C ZINC000070921226 177390272 /nfs/dbraw/zinc/39/02/72/177390272.db2.gz MNRSHRMCEPTXNH-NSHDSACASA-N 1 2 227.311 2.371 20 0 BEADLO C[C@@H]1Cc2c([nH+]cn2Cc2nccn2C)C[C@@H]1C ZINC000296142659 177391133 /nfs/dbraw/zinc/39/11/33/177391133.db2.gz ZVNNMBFXJHRDDP-WDEREUQCSA-N 1 2 244.342 2.036 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2cc(O)cc(F)c2)[C@@H]1C ZINC000186228553 177398191 /nfs/dbraw/zinc/39/81/91/177398191.db2.gz ZYDWMAAZZAFEGM-NXEZZACHSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2cc(O)cc(F)c2)[C@@H]1C ZINC000186228553 177398193 /nfs/dbraw/zinc/39/81/93/177398193.db2.gz ZYDWMAAZZAFEGM-NXEZZACHSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@H]1CC(C)(C)CN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493195490 224691061 /nfs/dbraw/zinc/69/10/61/224691061.db2.gz IISCPMCBOXMPQI-YEZKRMTDSA-N 1 2 233.315 2.070 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H]2CC[C@@H](C)C2)c[nH+]1 ZINC001652464170 1173087332 /nfs/dbraw/zinc/08/73/32/1173087332.db2.gz WRLFYKXNDJBIQS-NXEZZACHSA-N 1 2 235.331 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H]2CC[C@@H](C)C2)[nH+]1 ZINC001652464170 1173087336 /nfs/dbraw/zinc/08/73/36/1173087336.db2.gz WRLFYKXNDJBIQS-NXEZZACHSA-N 1 2 235.331 2.025 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)COC(C)(C)C ZINC000272179565 487642900 /nfs/dbraw/zinc/64/29/00/487642900.db2.gz IRPYJWPKTDATDI-UHFFFAOYSA-N 1 2 236.315 2.398 20 0 BEADLO Cc1ccccc1NC(=O)CCc1[nH]cc[nH+]1 ZINC000479445935 225184092 /nfs/dbraw/zinc/18/40/92/225184092.db2.gz MKQXWCWDVAEZRG-UHFFFAOYSA-N 1 2 229.283 2.289 20 0 BEADLO Cc1ccsc1[C@@H](CO)Nc1cc[nH+]c(C)n1 ZINC000487614190 225318402 /nfs/dbraw/zinc/31/84/02/225318402.db2.gz BWSDQRKKHIFXBA-SNVBAGLBSA-N 1 2 249.339 2.300 20 0 BEADLO Cc1cc(N[C@@H](C)Cc2ccncc2)nc[nH+]1 ZINC000487665117 225320646 /nfs/dbraw/zinc/32/06/46/225320646.db2.gz BQOYZNZOPUVFSZ-NSHDSACASA-N 1 2 228.299 2.223 20 0 BEADLO Cc1cc(N2CCOC[C@H](C3CCC3)C2)nc[nH+]1 ZINC000488734125 225425430 /nfs/dbraw/zinc/42/54/30/225425430.db2.gz LGCPPJKVONVJKK-CYBMUJFWSA-N 1 2 247.342 2.038 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)C=Cc2c[nH]c[nH+]2)C[C@@H]1C ZINC000492809066 226057792 /nfs/dbraw/zinc/05/77/92/226057792.db2.gz FLIARZJWXUCGPF-QGDURGIVSA-N 1 2 247.342 2.364 20 0 BEADLO Cc1cscc1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492812463 226058363 /nfs/dbraw/zinc/05/83/63/226058363.db2.gz MVGWPCDEGOWCDT-IHWYPQMZSA-N 1 2 233.296 2.432 20 0 BEADLO C[C@@H]1C[C@H](C)[C@@H](C)N(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492815369 226059804 /nfs/dbraw/zinc/05/98/04/226059804.db2.gz WVAIFADUWQGCTO-DKLPLTIYSA-N 1 2 247.342 2.316 20 0 BEADLO Cn1c[nH+]cc1Cc1noc([C@H]2CC23CCC3)n1 ZINC000680808476 487648956 /nfs/dbraw/zinc/64/89/56/487648956.db2.gz ZCQDDMTWSHQGIN-SNVBAGLBSA-N 1 2 244.298 2.052 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C=CC1CCCC1 ZINC000493088087 226123467 /nfs/dbraw/zinc/12/34/67/226123467.db2.gz UEZPFPORUVNRCZ-VOTSOKGWSA-N 1 2 230.311 2.497 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)N(C1CCC1)C1CCC1 ZINC000493273492 226172269 /nfs/dbraw/zinc/17/22/69/226172269.db2.gz QHCCBRSLSQQBNN-BQYQJAHWSA-N 1 2 245.326 2.357 20 0 BEADLO Cc1cc(NC(=O)C=Cc2c[nH]c[nH+]2)ccc1O ZINC000493494232 226232562 /nfs/dbraw/zinc/23/25/62/226232562.db2.gz UBJHJTHKCFOJRA-HWKANZROSA-N 1 2 243.266 2.076 20 0 BEADLO C[C@@H](NC(=O)/C=C\c1[nH]cc[nH+]1)C1CCCC1 ZINC000493510197 226236144 /nfs/dbraw/zinc/23/61/44/226236144.db2.gz GQUHTMIBQWOWDT-JYESYGNLSA-N 1 2 233.315 2.118 20 0 BEADLO O=C(/C=C\C1CCCC1)NCCCn1cc[nH+]c1 ZINC000493520068 226238514 /nfs/dbraw/zinc/23/85/14/226238514.db2.gz JNLMHGDUNIVQFK-SREVYHEPSA-N 1 2 247.342 2.136 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)NC12CCC(CC1)CC2 ZINC000493574535 226244154 /nfs/dbraw/zinc/24/41/54/226244154.db2.gz BALNZZHVLZSVDH-UPHRSURJSA-N 1 2 245.326 2.262 20 0 BEADLO C[C@H](N(C)C(=O)C=Cc1c[nH]c[nH+]1)C(C)(C)C ZINC000493577171 226244187 /nfs/dbraw/zinc/24/41/87/226244187.db2.gz DHGDYKQLSUJCIO-GFVADAIESA-N 1 2 235.331 2.316 20 0 BEADLO CN(C(=O)C=Cc1c[nH]c[nH+]1)C1CC(C)(C)C1 ZINC000493648249 226247655 /nfs/dbraw/zinc/24/76/55/226247655.db2.gz RVGXZCKSRRKLTL-PLNGDYQASA-N 1 2 233.315 2.070 20 0 BEADLO CN(C(=O)C=Cc1c[nH]c[nH+]1)C(C1CC1)C1CC1 ZINC000493696943 226249806 /nfs/dbraw/zinc/24/98/06/226249806.db2.gz UQMXRGGZZIOWHO-SREVYHEPSA-N 1 2 245.326 2.070 20 0 BEADLO C[C@@H]1C[C@H](C)[C@@H](C)N(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493697465 226249843 /nfs/dbraw/zinc/24/98/43/226249843.db2.gz VIXCIVUXZRBQOU-HCSCIRHASA-N 1 2 247.342 2.316 20 0 BEADLO CN(C(=O)/C=C/c1[nH]cc[nH+]1)[C@H]1CCC(C)(C)C1 ZINC000493697222 226249903 /nfs/dbraw/zinc/24/99/03/226249903.db2.gz YQDGILNEKBATSK-ZWNMCFTASA-N 1 2 247.342 2.460 20 0 BEADLO Nc1ccc(NC(=O)C=CC2CCCC2)c[nH+]1 ZINC000493717467 226250823 /nfs/dbraw/zinc/25/08/23/226250823.db2.gz DJPGCBHZSXANDW-VMPITWQZSA-N 1 2 231.299 2.179 20 0 BEADLO C[C@H]1CCCCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493785531 226253990 /nfs/dbraw/zinc/25/39/90/226253990.db2.gz HXOOQBOJNYUXAE-MLRMMBSGSA-N 1 2 233.315 2.214 20 0 BEADLO CN(C(=O)C=Cc1c[nH]c[nH+]1)[C@H]1CCC(C)(C)C1 ZINC000493812184 226255048 /nfs/dbraw/zinc/25/50/48/226255048.db2.gz BORONPAHVIKSIM-RXNFCKPNSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@@H]1CCCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493829521 226256238 /nfs/dbraw/zinc/25/62/38/226256238.db2.gz WZHOLOZKCARPOQ-ISALQUGTSA-N 1 2 233.315 2.072 20 0 BEADLO Cc1cc(CNC(=O)OCCCF)cc(C)[nH+]1 ZINC000495939259 226292650 /nfs/dbraw/zinc/29/26/50/226292650.db2.gz FKNXVAXAWGCCQD-UHFFFAOYSA-N 1 2 240.278 2.284 20 0 BEADLO Cc1cc(C[NH2+]Cc2nc(C)c(C)s2)on1 ZINC000087375807 487650752 /nfs/dbraw/zinc/65/07/52/487650752.db2.gz OWGVILAFUWHQET-UHFFFAOYSA-N 1 2 237.328 2.346 20 0 BEADLO Cc1nc(NC[C@@H]2CC[C@H]3C[C@H]3C2)cc[nH+]1 ZINC000403593956 322935308 /nfs/dbraw/zinc/93/53/08/322935308.db2.gz DTVGUJDCKWPYEE-GRYCIOLGSA-N 1 2 217.316 2.055 20 0 BEADLO COc1ccccc1C[NH2+][C@@H](C)C(F)F ZINC000228478303 487655186 /nfs/dbraw/zinc/65/51/86/487655186.db2.gz PZLZFKASFOTTJZ-QMMMGPOBSA-N 1 2 215.243 2.438 20 0 BEADLO CC[C@]1(Nc2[nH+]c(C)nc3[nH]ccc32)CCOC1 ZINC000672275877 487655631 /nfs/dbraw/zinc/65/56/31/487655631.db2.gz CVAPOEDBWQJIHF-ZDUSSCGKSA-N 1 2 246.314 2.247 20 0 BEADLO O=C(CCCC1CCCC1)NCCc1[nH]cc[nH+]1 ZINC000174763432 229392496 /nfs/dbraw/zinc/39/24/96/229392496.db2.gz CIZZZSBLAFVGNZ-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO CC[C@@H]1CCCCCN1C(=O)Cc1c[nH+]cn1C ZINC000557712580 322941315 /nfs/dbraw/zinc/94/13/15/322941315.db2.gz CZWHPSGIJSCGGK-GFCCVEGCSA-N 1 2 249.358 2.144 20 0 BEADLO CC[C@]1(C)CCN(C(=O)CCCn2cc[nH+]c2)C1 ZINC000675179924 487677811 /nfs/dbraw/zinc/67/78/11/487677811.db2.gz MZQGUFDYQHNVKU-CQSZACIVSA-N 1 2 249.358 2.312 20 0 BEADLO CCO[C@H](C)c1noc(C[N@H+](C)C(C)C)n1 ZINC000115945472 487683526 /nfs/dbraw/zinc/68/35/26/487683526.db2.gz YMPXEEDLKZJMEU-SECBINFHSA-N 1 2 227.308 2.007 20 0 BEADLO CCO[C@H](C)c1noc(C[N@@H+](C)C(C)C)n1 ZINC000115945472 487683534 /nfs/dbraw/zinc/68/35/34/487683534.db2.gz YMPXEEDLKZJMEU-SECBINFHSA-N 1 2 227.308 2.007 20 0 BEADLO CCC(C)(CC)C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000680995358 487689254 /nfs/dbraw/zinc/68/92/54/487689254.db2.gz LEOMMVBMNXSYRF-LLVKDONJSA-N 1 2 237.347 2.214 20 0 BEADLO Cc1cc(NC[C@H]2CC[C@@H](C)O2)nc(C(C)C)[nH+]1 ZINC000397856608 262937843 /nfs/dbraw/zinc/93/78/43/262937843.db2.gz BJAVGNLKGZEWNV-VXGBXAGGSA-N 1 2 249.358 2.310 20 0 BEADLO C/C(Cl)=C\C[N@@H+](C)Cc1cnn(C)c1C ZINC000528485251 262951091 /nfs/dbraw/zinc/95/10/91/262951091.db2.gz LYTCROCQCUIXKZ-WEVVVXLNSA-N 1 2 227.739 2.303 20 0 BEADLO C/C(Cl)=C\C[N@H+](C)Cc1cnn(C)c1C ZINC000528485251 262951092 /nfs/dbraw/zinc/95/10/92/262951092.db2.gz LYTCROCQCUIXKZ-WEVVVXLNSA-N 1 2 227.739 2.303 20 0 BEADLO Clc1cccnc1CN1CCc2[nH+]c[nH]c2C1 ZINC000528501832 262953379 /nfs/dbraw/zinc/95/33/79/262953379.db2.gz DNVBVFBMGRHJAZ-UHFFFAOYSA-N 1 2 248.717 2.016 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1occ2c1CCC2 ZINC000671706119 487699254 /nfs/dbraw/zinc/69/92/54/487699254.db2.gz YPOHSFIOYCYSEX-UHFFFAOYSA-N 1 2 242.278 2.146 20 0 BEADLO C[C@@H](c1cnccn1)[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000681031132 487701512 /nfs/dbraw/zinc/70/15/12/487701512.db2.gz WGZCSDDNEPMFPD-VWYCJHECSA-N 1 2 223.295 2.218 20 0 BEADLO C[C@@H](c1cnccn1)[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000681031132 487701514 /nfs/dbraw/zinc/70/15/14/487701514.db2.gz WGZCSDDNEPMFPD-VWYCJHECSA-N 1 2 223.295 2.218 20 0 BEADLO C[C@H](c1cnccn1)[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000681031022 487701777 /nfs/dbraw/zinc/70/17/77/487701777.db2.gz WGZCSDDNEPMFPD-GMTAPVOTSA-N 1 2 223.295 2.218 20 0 BEADLO C[C@H](c1cnccn1)[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000681031022 487701782 /nfs/dbraw/zinc/70/17/82/487701782.db2.gz WGZCSDDNEPMFPD-GMTAPVOTSA-N 1 2 223.295 2.218 20 0 BEADLO CCC(C)(CC)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000681046851 487705689 /nfs/dbraw/zinc/70/56/89/487705689.db2.gz RJFGDHKNCGPFAV-UHFFFAOYSA-N 1 2 235.331 2.093 20 0 BEADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1cn(C)cn1 ZINC000683900292 487710756 /nfs/dbraw/zinc/71/07/56/487710756.db2.gz SKRRAIFXTVYJAC-AWEZNQCLSA-N 1 2 244.342 2.398 20 0 BEADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1cn(C)cn1 ZINC000683900292 487710758 /nfs/dbraw/zinc/71/07/58/487710758.db2.gz SKRRAIFXTVYJAC-AWEZNQCLSA-N 1 2 244.342 2.398 20 0 BEADLO CCc1cc(N2C[C@@H](CC)OC[C@H]2C)nc(C)[nH+]1 ZINC000651405110 487727798 /nfs/dbraw/zinc/72/77/98/487727798.db2.gz JRHURKNQDFYOKE-ZWNOBZJWSA-N 1 2 249.358 2.351 20 0 BEADLO COC[C@H]1CCC[N@H+](CC(F)(F)C(F)F)C1 ZINC000736621436 585008318 /nfs/dbraw/zinc/00/83/18/585008318.db2.gz JHTHLDOEUAYXGN-QMMMGPOBSA-N 1 2 243.244 2.245 20 0 BEADLO COC[C@H]1CCC[N@@H+](CC(F)(F)C(F)F)C1 ZINC000736621436 585008319 /nfs/dbraw/zinc/00/83/19/585008319.db2.gz JHTHLDOEUAYXGN-QMMMGPOBSA-N 1 2 243.244 2.245 20 0 BEADLO OCCC[N@H+](Cc1ncc(Cl)s1)C1CC1 ZINC000681166541 487740530 /nfs/dbraw/zinc/74/05/30/487740530.db2.gz PXHGIVPQUFNUCU-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO OCCC[N@@H+](Cc1ncc(Cl)s1)C1CC1 ZINC000681166541 487740532 /nfs/dbraw/zinc/74/05/32/487740532.db2.gz PXHGIVPQUFNUCU-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)[C@@H]1CCSC1 ZINC000675567315 487749480 /nfs/dbraw/zinc/74/94/80/487749480.db2.gz JHVJHDOPOROMNU-SECBINFHSA-N 1 2 247.323 2.026 20 0 BEADLO C[C@@H]1[C@@H](C)[C@H](C)CN1C(=O)CCCn1cc[nH+]c1 ZINC000667912482 487760492 /nfs/dbraw/zinc/76/04/92/487760492.db2.gz BZMKLMDKAUKGOH-FRRDWIJNSA-N 1 2 249.358 2.166 20 0 BEADLO C[C@@H]1CN(C(=O)CCCn2cc[nH+]c2)[C@@H](C)[C@H]1C ZINC000667912481 487760554 /nfs/dbraw/zinc/76/05/54/487760554.db2.gz BZMKLMDKAUKGOH-AGIUHOORSA-N 1 2 249.358 2.166 20 0 BEADLO COC1(C)C[NH+](Cc2scnc2C2CC2)C1 ZINC000459582132 487774623 /nfs/dbraw/zinc/77/46/23/487774623.db2.gz LRNNLEZTINIMMM-UHFFFAOYSA-N 1 2 238.356 2.241 20 0 BEADLO COc1nccc(C[NH+]2Cc3ccccc3C2)n1 ZINC000294702201 487778894 /nfs/dbraw/zinc/77/88/94/487778894.db2.gz FFBRKKOUZRKPIN-UHFFFAOYSA-N 1 2 241.294 2.001 20 0 BEADLO CC(C)C[C@@H](C)C(=O)Nc1cc[nH+]cc1N(C)C ZINC000681363691 487784854 /nfs/dbraw/zinc/78/48/54/487784854.db2.gz UXORLKRKSGFJBR-LLVKDONJSA-N 1 2 249.358 2.190 20 0 BEADLO Cc1ncc(C[NH+]2CC(C(F)F)C2)s1 ZINC000769151929 585550285 /nfs/dbraw/zinc/55/02/85/585550285.db2.gz BJGGMBHAYNZBPN-UHFFFAOYSA-N 1 2 218.272 2.148 20 0 BEADLO c1c[nH+]c([C@H]2CCCCN2Cc2ccon2)[nH]1 ZINC000675894052 487788778 /nfs/dbraw/zinc/78/87/78/487788778.db2.gz ZQOBEBOFQUGZRH-LLVKDONJSA-N 1 2 232.287 2.125 20 0 BEADLO CCn1cc[nH+]c1CN1CC[C@H](C)[C@@H](F)C1 ZINC000679228452 487790198 /nfs/dbraw/zinc/79/01/98/487790198.db2.gz XOGCEBRZHICYRJ-QWRGUYRKSA-N 1 2 225.311 2.083 20 0 BEADLO CCn1ccnc1C[N@H+](C)CCOC(C)(C)C ZINC000676043422 487804154 /nfs/dbraw/zinc/80/41/54/487804154.db2.gz ZVXXCWVQVSRSEU-UHFFFAOYSA-N 1 2 239.363 2.150 20 0 BEADLO CCn1ccnc1C[N@@H+](C)CCOC(C)(C)C ZINC000676043422 487804158 /nfs/dbraw/zinc/80/41/58/487804158.db2.gz ZVXXCWVQVSRSEU-UHFFFAOYSA-N 1 2 239.363 2.150 20 0 BEADLO Cc1nnsc1CNc1ccc(C)[nH+]c1 ZINC000394716883 487805100 /nfs/dbraw/zinc/80/51/00/487805100.db2.gz HAHNRYIBNSPPDU-UHFFFAOYSA-N 1 2 220.301 2.162 20 0 BEADLO CC/C=C/CC[N@@H+]1CCOC[C@@H]1c1ccnn1C ZINC000649884720 487813582 /nfs/dbraw/zinc/81/35/82/487813582.db2.gz ZBHBJGAGXKMGJO-ISZGNANSSA-N 1 2 249.358 2.150 20 0 BEADLO CC/C=C/CC[N@H+]1CCOC[C@@H]1c1ccnn1C ZINC000649884720 487813584 /nfs/dbraw/zinc/81/35/84/487813584.db2.gz ZBHBJGAGXKMGJO-ISZGNANSSA-N 1 2 249.358 2.150 20 0 BEADLO CO[C@@H](C[NH2+][C@H](C)c1cn[nH]c1C)CC(C)C ZINC000669424970 487814584 /nfs/dbraw/zinc/81/45/84/487814584.db2.gz JQLWPWXQDQXYPW-ZYHUDNBSSA-N 1 2 239.363 2.430 20 0 BEADLO CC[C@@H](NC(=O)Nc1cc(C)[nH+]cc1C)C1CC1 ZINC000666496166 487822342 /nfs/dbraw/zinc/82/23/42/487822342.db2.gz KKOSPQKVPDCTLO-GFCCVEGCSA-N 1 2 247.342 2.430 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2[C@H](C=C(C)C)C2(C)C)n1 ZINC000666572909 487833207 /nfs/dbraw/zinc/83/32/07/487833207.db2.gz VCECYPSHNFZPHI-ONGXEEELSA-N 1 2 235.331 2.495 20 0 BEADLO CCc1cc(N[C@@H]2CCC[C@H]2CCO)nc[nH+]1 ZINC000681674670 487838003 /nfs/dbraw/zinc/83/80/03/487838003.db2.gz CMXMFFCGTHUMJT-CMPLNLGQSA-N 1 2 235.331 2.002 20 0 BEADLO CCCOC(=O)[C@H](C)[NH2+][C@@H]1CCC1(C)C ZINC000846959470 588298514 /nfs/dbraw/zinc/29/85/14/588298514.db2.gz IRVMPSMNISCPDK-VHSXEESVSA-N 1 2 213.321 2.106 20 0 BEADLO CCOC[C@H](C)[NH2+]Cc1n[nH]c2ccccc21 ZINC000681697904 487842733 /nfs/dbraw/zinc/84/27/33/487842733.db2.gz ILYGXNOKAHJAML-JTQLQIEISA-N 1 2 233.315 2.078 20 0 BEADLO CC(C)C(C)(C)NC(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000668113846 487843495 /nfs/dbraw/zinc/84/34/95/487843495.db2.gz BIRGHKHGVABGFK-JTQLQIEISA-N 1 2 249.358 2.065 20 0 BEADLO CC(C)C(C)(C)NC(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000668113846 487843498 /nfs/dbraw/zinc/84/34/98/487843498.db2.gz BIRGHKHGVABGFK-JTQLQIEISA-N 1 2 249.358 2.065 20 0 BEADLO O=C(NCc1c[nH+]c[nH]1)C1[C@H]2CCCCCC[C@H]12 ZINC000668996333 487844694 /nfs/dbraw/zinc/84/46/94/487844694.db2.gz YUVUHDOLKNCKQA-RYUDHWBXSA-N 1 2 247.342 2.242 20 0 BEADLO O=C(NCc1c[nH]c[nH+]1)C1[C@H]2CCCCCC[C@H]12 ZINC000668996333 487844698 /nfs/dbraw/zinc/84/46/98/487844698.db2.gz YUVUHDOLKNCKQA-RYUDHWBXSA-N 1 2 247.342 2.242 20 0 BEADLO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1ccon1 ZINC000077247420 487846363 /nfs/dbraw/zinc/84/63/63/487846363.db2.gz NOEJMDGGYSYUTC-ZDUSSCGKSA-N 1 2 231.299 2.350 20 0 BEADLO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1ccon1 ZINC000077247420 487846368 /nfs/dbraw/zinc/84/63/68/487846368.db2.gz NOEJMDGGYSYUTC-ZDUSSCGKSA-N 1 2 231.299 2.350 20 0 BEADLO Cc1ccc(NC(=O)NCc2[nH]cc[nH+]2)cc1C ZINC000119132391 487857692 /nfs/dbraw/zinc/85/76/92/487857692.db2.gz RKSRDIYLQNKQEF-UHFFFAOYSA-N 1 2 244.298 2.348 20 0 BEADLO FCC[C@@H]1CCC[N@H+](Cc2csnn2)C1 ZINC000661687817 487865451 /nfs/dbraw/zinc/86/54/51/487865451.db2.gz CUJRWDSIYQYUSK-VIFPVBQESA-N 1 2 229.324 2.110 20 0 BEADLO FCC[C@@H]1CCC[N@@H+](Cc2csnn2)C1 ZINC000661687817 487865456 /nfs/dbraw/zinc/86/54/56/487865456.db2.gz CUJRWDSIYQYUSK-VIFPVBQESA-N 1 2 229.324 2.110 20 0 BEADLO CCc1nc(C[N@@H+]2CCCOC[C@H]2C)cs1 ZINC000676710428 487897128 /nfs/dbraw/zinc/89/71/28/487897128.db2.gz DHIVCYTWUDKRIG-SNVBAGLBSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nc(C[N@H+]2CCCOC[C@H]2C)cs1 ZINC000676710428 487897133 /nfs/dbraw/zinc/89/71/33/487897133.db2.gz DHIVCYTWUDKRIG-SNVBAGLBSA-N 1 2 240.372 2.316 20 0 BEADLO COc1ccc(NCc2ncc(C)s2)[nH+]c1 ZINC000234958015 487896533 /nfs/dbraw/zinc/89/65/33/487896533.db2.gz ITUUWISNNXOFCF-UHFFFAOYSA-N 1 2 235.312 2.467 20 0 BEADLO COc1cnccc1[C@@H](C)[NH2+]Cc1cc(C)no1 ZINC000682095464 487909418 /nfs/dbraw/zinc/90/94/18/487909418.db2.gz VOKHIPLSTXEQQX-SNVBAGLBSA-N 1 2 247.298 2.237 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](C)[C@@H]2CCCO2)c1 ZINC000652331183 487920808 /nfs/dbraw/zinc/92/08/08/487920808.db2.gz ZXUCJOKVWVUKSE-JQWIXIFHSA-N 1 2 236.315 2.207 20 0 BEADLO CC=CC[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000682220725 487928638 /nfs/dbraw/zinc/92/86/38/487928638.db2.gz FZAUYFRHWYWNRZ-QAVQXKDTSA-N 1 2 228.299 2.060 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCc3c[nH]nc3C2)s1 ZINC000676794309 487931010 /nfs/dbraw/zinc/93/10/10/487931010.db2.gz UHBKLGGAWHTMPU-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCc3c[nH]nc3C2)s1 ZINC000676794309 487931017 /nfs/dbraw/zinc/93/10/17/487931017.db2.gz UHBKLGGAWHTMPU-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO CCn1cc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)cn1 ZINC000679357781 487932040 /nfs/dbraw/zinc/93/20/40/487932040.db2.gz AZVCYFUGFNMEDH-CMPLNLGQSA-N 1 2 225.311 2.083 20 0 BEADLO CCn1cc(C[N@H+]2CC[C@H](C)[C@H](F)C2)cn1 ZINC000679357781 487932043 /nfs/dbraw/zinc/93/20/43/487932043.db2.gz AZVCYFUGFNMEDH-CMPLNLGQSA-N 1 2 225.311 2.083 20 0 BEADLO CC(C)(C)CNC(=O)C[NH+]1Cc2ccccc2C1 ZINC000676804731 487934258 /nfs/dbraw/zinc/93/42/58/487934258.db2.gz QLDQXPGZAHTPQP-UHFFFAOYSA-N 1 2 246.354 2.165 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CC[C@H](C(F)F)C2)s1 ZINC000669932270 487935452 /nfs/dbraw/zinc/93/54/52/487935452.db2.gz DDDMRRLXPOZBQJ-XPUUQOCRSA-N 1 2 247.314 2.495 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CC[C@H](C(F)F)C2)s1 ZINC000669932270 487935456 /nfs/dbraw/zinc/93/54/56/487935456.db2.gz DDDMRRLXPOZBQJ-XPUUQOCRSA-N 1 2 247.314 2.495 20 0 BEADLO CC[C@H](C)CN(C)C(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000668565965 487941968 /nfs/dbraw/zinc/94/19/68/487941968.db2.gz PASRIDOODYGYSC-WDEREUQCSA-N 1 2 249.358 2.019 20 0 BEADLO CC[C@H](C)CN(C)C(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000668565965 487941970 /nfs/dbraw/zinc/94/19/70/487941970.db2.gz PASRIDOODYGYSC-WDEREUQCSA-N 1 2 249.358 2.019 20 0 BEADLO C[C@H](O)C[C@H](C)Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000679934144 487944519 /nfs/dbraw/zinc/94/45/19/487944519.db2.gz YXFXIUYEEYQXQD-UWVGGRQHSA-N 1 2 237.347 2.345 20 0 BEADLO Cc1cc(N[C@@H](C)C[C@H](C)O)nc(C2CC2)[nH+]1 ZINC000679934102 487945558 /nfs/dbraw/zinc/94/55/58/487945558.db2.gz YDMPIJPPMBPTHU-WPRPVWTQSA-N 1 2 235.331 2.234 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)[C@@]23C[C@@H]2CCC3)[nH+]1 ZINC000569464086 322967018 /nfs/dbraw/zinc/96/70/18/322967018.db2.gz WPRDUHMHYHBIMQ-HZMBPMFUSA-N 1 2 247.342 2.260 20 0 BEADLO Cc1c[nH+]c(C)nc1NC[C@@H]1C[C@H]1C(C)C ZINC000566480953 323001059 /nfs/dbraw/zinc/00/10/59/323001059.db2.gz CUWKIEYWDCRHII-RYUDHWBXSA-N 1 2 219.332 2.219 20 0 BEADLO Cc1noc([C@@H]2CCC[N@@H+]2CC2(F)CC2)n1 ZINC000561967171 323009619 /nfs/dbraw/zinc/00/96/19/323009619.db2.gz IPBPNAHKUDKEFG-VIFPVBQESA-N 1 2 225.267 2.017 20 0 BEADLO Cc1noc([C@@H]2CCC[N@H+]2CC2(F)CC2)n1 ZINC000561967171 323009620 /nfs/dbraw/zinc/00/96/20/323009620.db2.gz IPBPNAHKUDKEFG-VIFPVBQESA-N 1 2 225.267 2.017 20 0 BEADLO C[C@H]1CC[C@H](C(=O)N2CCn3c[nH+]cc3C2)CC1 ZINC000564732728 323012465 /nfs/dbraw/zinc/01/24/65/323012465.db2.gz IIAVGYZLUYBMBD-HAQNSBGRSA-N 1 2 247.342 2.052 20 0 BEADLO c1nc(C[N@@H+]2CCC[C@@H]2c2ccccn2)co1 ZINC000562418416 323019442 /nfs/dbraw/zinc/01/94/42/323019442.db2.gz WYKWFZVQKICEBH-CYBMUJFWSA-N 1 2 229.283 2.407 20 0 BEADLO c1nc(C[N@H+]2CCC[C@@H]2c2ccccn2)co1 ZINC000562418416 323019443 /nfs/dbraw/zinc/01/94/43/323019443.db2.gz WYKWFZVQKICEBH-CYBMUJFWSA-N 1 2 229.283 2.407 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1NC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000562657564 323026755 /nfs/dbraw/zinc/02/67/55/323026755.db2.gz GHYUTOFXLWGZPR-IINYFYTJSA-N 1 2 249.358 2.238 20 0 BEADLO Cc1cc(NC(=O)[C@]23C[C@H]2CCC3)c(C)c[nH+]1 ZINC000562944458 323034569 /nfs/dbraw/zinc/03/45/69/323034569.db2.gz MFJVGCCJWOSRGL-BXUZGUMPSA-N 1 2 230.311 2.249 20 0 BEADLO CC(C)[C@H](NC(=O)[C@]12C[C@H]1CCC2)c1[nH]cc[nH+]1 ZINC000562949699 323034681 /nfs/dbraw/zinc/03/46/81/323034681.db2.gz SNXJLKNSXUPEAR-UHIISALHSA-N 1 2 247.342 2.413 20 0 BEADLO CC(C)O[C@@H]1CC[N@@H+]([C@@H](C)c2csnn2)C1 ZINC000572718166 323035955 /nfs/dbraw/zinc/03/59/55/323035955.db2.gz ZFGHJVLFRPARSD-VHSXEESVSA-N 1 2 241.360 2.098 20 0 BEADLO CC(C)O[C@@H]1CC[N@H+]([C@@H](C)c2csnn2)C1 ZINC000572718166 323035956 /nfs/dbraw/zinc/03/59/56/323035956.db2.gz ZFGHJVLFRPARSD-VHSXEESVSA-N 1 2 241.360 2.098 20 0 BEADLO CC(C)O[C@@H]1CC[N@@H+]([C@H](C)c2csnn2)C1 ZINC000572718165 323036034 /nfs/dbraw/zinc/03/60/34/323036034.db2.gz ZFGHJVLFRPARSD-NXEZZACHSA-N 1 2 241.360 2.098 20 0 BEADLO CC(C)O[C@@H]1CC[N@H+]([C@H](C)c2csnn2)C1 ZINC000572718165 323036035 /nfs/dbraw/zinc/03/60/35/323036035.db2.gz ZFGHJVLFRPARSD-NXEZZACHSA-N 1 2 241.360 2.098 20 0 BEADLO CC1(C)CCC[C@@H](CNC(=O)Cn2cc[nH+]c2)C1 ZINC000572957839 323036059 /nfs/dbraw/zinc/03/60/59/323036059.db2.gz CRQWKCPWDPBEPB-GFCCVEGCSA-N 1 2 249.358 2.216 20 0 BEADLO CC[C@@]1(C(C)C)C[C@H]1NC(=O)CCc1c[nH+]c[nH]1 ZINC000562962525 323036469 /nfs/dbraw/zinc/03/64/69/323036469.db2.gz UNOCZVPKVGMABD-OCCSQVGLSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@@]1(C(C)C)C[C@H]1NC(=O)CCc1c[nH]c[nH+]1 ZINC000562962525 323036470 /nfs/dbraw/zinc/03/64/70/323036470.db2.gz UNOCZVPKVGMABD-OCCSQVGLSA-N 1 2 249.358 2.283 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)NC[C@@H]3C[C@@H]3C)ccn12 ZINC000569739847 323039628 /nfs/dbraw/zinc/03/96/28/323039628.db2.gz KOQMIZCNWFVBMN-CABZTGNLSA-N 1 2 243.310 2.029 20 0 BEADLO CC(C)[C@H](C)N(C)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000569814432 323041363 /nfs/dbraw/zinc/04/13/63/323041363.db2.gz XEWYYMDDFKINCK-NEPJUHHUSA-N 1 2 237.347 2.337 20 0 BEADLO C[C@@H](CC(=O)N1[C@H](C)CC[C@H]1C)n1cc[nH+]c1 ZINC000570048440 323048160 /nfs/dbraw/zinc/04/81/60/323048160.db2.gz VFUIDAWOLYTERJ-UTUOFQBUSA-N 1 2 235.331 2.234 20 0 BEADLO CC(=O)c1cc(C[NH+]2CCC(CF)CC2)on1 ZINC000570222559 323053298 /nfs/dbraw/zinc/05/32/98/323053298.db2.gz CNKYEJBBVFUFFT-UHFFFAOYSA-N 1 2 240.278 2.059 20 0 BEADLO CCC[N@@H+]1CC(=O)N[C@H]1[C@H]1CCCC(C)(C)C1 ZINC000570301091 323055671 /nfs/dbraw/zinc/05/56/71/323055671.db2.gz ZKBGQDKLKSBXIA-WCQYABFASA-N 1 2 238.375 2.371 20 0 BEADLO CCC[N@H+]1CC(=O)N[C@H]1[C@H]1CCCC(C)(C)C1 ZINC000570301091 323055672 /nfs/dbraw/zinc/05/56/72/323055672.db2.gz ZKBGQDKLKSBXIA-WCQYABFASA-N 1 2 238.375 2.371 20 0 BEADLO c1cn(-c2ccc(CNc3c[nH]cn3)cc2)c[nH+]1 ZINC000570326065 323056405 /nfs/dbraw/zinc/05/64/05/323056405.db2.gz HYUPZLLSXQOPQI-UHFFFAOYSA-N 1 2 239.282 2.208 20 0 BEADLO CCC(CC)CNC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000570519766 323062348 /nfs/dbraw/zinc/06/23/48/323062348.db2.gz ZWQZGSNWYLIZOX-NSHDSACASA-N 1 2 237.347 2.387 20 0 BEADLO CCn1ccnc1C[NH+]1CC(C)(CC)C1 ZINC000570660452 323066241 /nfs/dbraw/zinc/06/62/41/323066241.db2.gz VVHWFUBOAWJCBJ-UHFFFAOYSA-N 1 2 207.321 2.135 20 0 BEADLO CSCCCN(C)c1nc(C)[nH+]cc1C ZINC000572781261 323069607 /nfs/dbraw/zinc/06/96/07/323069607.db2.gz IHVLKXYBCDYFEC-UHFFFAOYSA-N 1 2 225.361 2.283 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@H]2CC23CC3)[nH+]1 ZINC000563019768 323080106 /nfs/dbraw/zinc/08/01/06/323080106.db2.gz QJRVEPHVHZIJBZ-VIFPVBQESA-N 1 2 214.272 2.231 20 0 BEADLO Cc1ccc(CNc2cc[nH+]c(C)n2)nc1C ZINC000314361128 323080944 /nfs/dbraw/zinc/08/09/44/323080944.db2.gz XRWQNXKRHBJIDB-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO CCC1(C(=O)NCCCCn2cc[nH+]c2)CCC1 ZINC000531435439 323089614 /nfs/dbraw/zinc/08/96/14/323089614.db2.gz YEYRNDQDBYOGSU-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1Nc1[nH+]cnc2c1cnn2C ZINC000397383641 323090523 /nfs/dbraw/zinc/09/05/23/323090523.db2.gz OGKYGAXGTRZFTB-ZWNOBZJWSA-N 1 2 245.330 2.210 20 0 BEADLO Cc1nsc(C)c1C[N@H+]1CCO[C@@H](C)[C@@H]1C ZINC000563350751 323120008 /nfs/dbraw/zinc/12/00/08/323120008.db2.gz QHGCUBJGCVOMIR-UWVGGRQHSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nsc(C)c1C[N@@H+]1CCO[C@@H](C)[C@@H]1C ZINC000563350751 323120009 /nfs/dbraw/zinc/12/00/09/323120009.db2.gz QHGCUBJGCVOMIR-UWVGGRQHSA-N 1 2 240.372 2.369 20 0 BEADLO O=C1CC[N@H+](Cc2cccnc2)C2(CCC2)C1 ZINC000563364148 323121142 /nfs/dbraw/zinc/12/11/42/323121142.db2.gz DPEFYFSTFOZJEN-UHFFFAOYSA-N 1 2 230.311 2.169 20 0 BEADLO O=C1CC[N@@H+](Cc2cccnc2)C2(CCC2)C1 ZINC000563364148 323121143 /nfs/dbraw/zinc/12/11/43/323121143.db2.gz DPEFYFSTFOZJEN-UHFFFAOYSA-N 1 2 230.311 2.169 20 0 BEADLO CC(C)CCCNC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000563372152 323121817 /nfs/dbraw/zinc/12/18/17/323121817.db2.gz WSRQQTOIBSEVIL-NSHDSACASA-N 1 2 237.347 2.141 20 0 BEADLO CC(C)CCCNC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000563372152 323121818 /nfs/dbraw/zinc/12/18/18/323121818.db2.gz WSRQQTOIBSEVIL-NSHDSACASA-N 1 2 237.347 2.141 20 0 BEADLO CCCN(C(=O)[C@H]1CCn2c[nH+]cc2C1)C(C)C ZINC000563407893 323122379 /nfs/dbraw/zinc/12/23/79/323122379.db2.gz LOEVBCASYBGOCS-LBPRGKRZSA-N 1 2 249.358 2.093 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CC(C(F)(F)F)C1 ZINC000572811338 323143809 /nfs/dbraw/zinc/14/38/09/323143809.db2.gz AXVZOHIKWCHJJX-UHFFFAOYSA-N 1 2 247.264 2.458 20 0 BEADLO Cc1cnn(C)c1C[N@H+](C)Cc1cccc(O)c1 ZINC000571511618 323146278 /nfs/dbraw/zinc/14/62/78/323146278.db2.gz NVNOQFWWNKZJID-UHFFFAOYSA-N 1 2 245.326 2.066 20 0 BEADLO Cc1cnn(C)c1C[N@@H+](C)Cc1cccc(O)c1 ZINC000571511618 323146279 /nfs/dbraw/zinc/14/62/79/323146279.db2.gz NVNOQFWWNKZJID-UHFFFAOYSA-N 1 2 245.326 2.066 20 0 BEADLO CCc1cnc(C[N@H+](C)CCSC)o1 ZINC000531968222 323160185 /nfs/dbraw/zinc/16/01/85/323160185.db2.gz AKGPCQIVDBTJGR-UHFFFAOYSA-N 1 2 214.334 2.032 20 0 BEADLO CCc1cnc(C[N@@H+](C)CCSC)o1 ZINC000531968222 323160186 /nfs/dbraw/zinc/16/01/86/323160186.db2.gz AKGPCQIVDBTJGR-UHFFFAOYSA-N 1 2 214.334 2.032 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CC2(C)C)c(C)c[nH+]1 ZINC000535035565 323164073 /nfs/dbraw/zinc/16/40/73/323164073.db2.gz ATMCWXJINRPLTP-SNVBAGLBSA-N 1 2 218.300 2.105 20 0 BEADLO CCCCN(C(=O)Cn1cc[nH+]c1)[C@@H](C)CC ZINC000563699652 323174189 /nfs/dbraw/zinc/17/41/89/323174189.db2.gz YNHFZUGMOHHNSQ-LBPRGKRZSA-N 1 2 237.347 2.310 20 0 BEADLO CN(C)c1ccc(NCC2(F)CC2)[nH+]c1 ZINC000308846502 323179720 /nfs/dbraw/zinc/17/97/20/323179720.db2.gz AHTYBBSDRXWFAH-UHFFFAOYSA-N 1 2 209.268 2.062 20 0 BEADLO COC[C@H](C)CNc1ccc(SC)c[nH+]1 ZINC000308918806 323181519 /nfs/dbraw/zinc/18/15/19/323181519.db2.gz GQPCNQHQPLQFQZ-SECBINFHSA-N 1 2 226.345 2.498 20 0 BEADLO CC[C@H]1CCCC[C@@H]1CNC(=O)Cn1cc[nH+]c1 ZINC000563861122 323181559 /nfs/dbraw/zinc/18/15/59/323181559.db2.gz LIFADLPDXDLQAR-QWHCGFSZSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@H]([NH2+]C/C=C\c1ccccc1)c1ncn(C)n1 ZINC000391979520 323183801 /nfs/dbraw/zinc/18/38/01/323183801.db2.gz MINDPUYBRGVTNO-PWWFUAJNSA-N 1 2 242.326 2.179 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CCC(OC(C)C)CC1 ZINC000535796677 323191689 /nfs/dbraw/zinc/19/16/89/323191689.db2.gz RILDQZFMORRODX-UHFFFAOYSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NCC[C@H]1CC=CCC1 ZINC000529869169 323193266 /nfs/dbraw/zinc/19/32/66/323193266.db2.gz RVTWYPMCWCHJBR-LBPRGKRZSA-N 1 2 247.342 2.123 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)NCC[C@H]1CC=CCC1 ZINC000529869169 323193267 /nfs/dbraw/zinc/19/32/67/323193267.db2.gz RVTWYPMCWCHJBR-LBPRGKRZSA-N 1 2 247.342 2.123 20 0 BEADLO CCn1cc(C[N@H+](C)Cc2ccc(C)cn2)cn1 ZINC000536669571 323200304 /nfs/dbraw/zinc/20/03/04/323200304.db2.gz RDZJDXVMWZGYRZ-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1cc(C[N@@H+](C)Cc2ccc(C)cn2)cn1 ZINC000536669571 323200305 /nfs/dbraw/zinc/20/03/05/323200305.db2.gz RDZJDXVMWZGYRZ-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO O=C(NCCc1[nH]cc[nH+]1)[C@H]1CC12CCCCC2 ZINC000532167806 323208216 /nfs/dbraw/zinc/20/82/16/323208216.db2.gz XQYGREBPXIXQQT-LLVKDONJSA-N 1 2 247.342 2.039 20 0 BEADLO c1[nH+]c(SC[C@@H]2CCOC2)n2ccccc12 ZINC000042152672 323244166 /nfs/dbraw/zinc/24/41/66/323244166.db2.gz MHWHAUUOOZZOFD-SNVBAGLBSA-N 1 2 234.324 2.463 20 0 BEADLO CC(C)c1nc(N2[C@H](C)C[C@@H]2C)nc(N(C)C)[nH+]1 ZINC000530379574 323383688 /nfs/dbraw/zinc/38/36/88/323383688.db2.gz HTTVFHVPEWXUQU-AOOOYVTPSA-N 1 2 249.362 2.048 20 0 BEADLO Cc1ncsc1CN(C)c1nc(C)[nH+]cc1C ZINC000571895413 323500410 /nfs/dbraw/zinc/50/04/10/323500410.db2.gz STJJXNNMOILKLB-UHFFFAOYSA-N 1 2 248.355 2.495 20 0 BEADLO Cc1cc[nH+]c(NCCn2cccn2)c1Cl ZINC000309692916 487959353 /nfs/dbraw/zinc/95/93/53/487959353.db2.gz KEIPXTVVEVLXSI-UHFFFAOYSA-N 1 2 236.706 2.352 20 0 BEADLO COc1ccc[nH+]c1N1CC[C@H](C2CC2)C1 ZINC000527942942 323721695 /nfs/dbraw/zinc/72/16/95/323721695.db2.gz HMCADJPOXTZTCV-NSHDSACASA-N 1 2 218.300 2.327 20 0 BEADLO COc1ccc[nH+]c1N1CCC(F)(F)CC1 ZINC000527996061 323733499 /nfs/dbraw/zinc/73/34/99/323733499.db2.gz RDPIHSOPZIGMNQ-UHFFFAOYSA-N 1 2 228.242 2.326 20 0 BEADLO C[C@H](N[C@H]1CCn2cc[nH+]c21)c1ncccc1F ZINC000528037049 323744585 /nfs/dbraw/zinc/74/45/85/323744585.db2.gz ANTBGWAHHAXPMI-ONGXEEELSA-N 1 2 246.289 2.213 20 0 BEADLO CCO[C@H](CC)C(=O)Nc1ccc(C)[nH+]c1C ZINC000119147639 323914621 /nfs/dbraw/zinc/91/46/21/323914621.db2.gz TVDJIHUBVMXSOB-GFCCVEGCSA-N 1 2 236.315 2.452 20 0 BEADLO c1ncc(C[NH2+]Cc2cn3ccccc3n2)s1 ZINC000122152791 324032198 /nfs/dbraw/zinc/03/21/98/324032198.db2.gz YNMLZOXXODMTRE-UHFFFAOYSA-N 1 2 244.323 2.081 20 0 BEADLO CC(C)(NC(=O)[C@@H]1CCCC12CC2)c1[nH]cc[nH+]1 ZINC000529455376 324303831 /nfs/dbraw/zinc/30/38/31/324303831.db2.gz AZJPKARRPCNLOP-JTQLQIEISA-N 1 2 247.342 2.341 20 0 BEADLO C[C@@H]1[C@@H](C(=O)NC(C)(C)c2[nH]cc[nH+]2)[C@@H]1C1CC1 ZINC000529461381 324305557 /nfs/dbraw/zinc/30/55/57/324305557.db2.gz ZHGGDJKMILCJJT-INTQDDNPSA-N 1 2 247.342 2.053 20 0 BEADLO O=C(NCC1CC=CC1)c1ccc2[nH+]ccn2c1 ZINC000529713189 324387931 /nfs/dbraw/zinc/38/79/31/324387931.db2.gz RCYDRTTVQWXPBS-UHFFFAOYSA-N 1 2 241.294 2.030 20 0 BEADLO C[C@@H]1CN(c2cccc[nH+]2)CC(C)(C)O1 ZINC000068463530 324875231 /nfs/dbraw/zinc/87/52/31/324875231.db2.gz VPKKGDMRFTVXMJ-SNVBAGLBSA-N 1 2 206.289 2.085 20 0 BEADLO Cc1ccc([S@](=O)Cc2[nH+]ccn2C)cc1C ZINC000129241020 324930977 /nfs/dbraw/zinc/93/09/77/324930977.db2.gz GDLFEDBZNXRRKJ-KRWDZBQOSA-N 1 2 248.351 2.345 20 0 BEADLO Cc1cc(C(=O)NCc2[nH]cc[nH+]2)ccc1Cl ZINC000129627265 324968066 /nfs/dbraw/zinc/96/80/66/324968066.db2.gz ZAUOOJIUIMOEQW-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO FC(F)(F)CCCC[NH+]1CCOCC1 ZINC000130517966 325060834 /nfs/dbraw/zinc/06/08/34/325060834.db2.gz BGHXHUURCIXUOH-UHFFFAOYSA-N 1 2 211.227 2.051 20 0 BEADLO CN(C)c1ccccc1-c1c[nH+]cn1C ZINC000115307479 487967081 /nfs/dbraw/zinc/96/70/81/487967081.db2.gz BDEBMBUIONTBJE-UHFFFAOYSA-N 1 2 201.273 2.153 20 0 BEADLO CC[C@@H]([NH2+]Cc1cccc(C)n1)c1ccn(C)n1 ZINC000543603832 325096524 /nfs/dbraw/zinc/09/65/24/325096524.db2.gz XCFWKHBQUMCVQS-CYBMUJFWSA-N 1 2 244.342 2.364 20 0 BEADLO CO[C@@H](C)COc1ccccc1-n1cc[nH+]c1 ZINC000543911124 325122081 /nfs/dbraw/zinc/12/20/81/325122081.db2.gz ROISDXGEPNGMMB-NSHDSACASA-N 1 2 232.283 2.286 20 0 BEADLO Fc1cc2[nH+]cn(C[C@@H]3CCCO3)c2cc1F ZINC000131292639 325134737 /nfs/dbraw/zinc/13/47/37/325134737.db2.gz JPEORXXRYAPUHJ-QMMMGPOBSA-N 1 2 238.237 2.494 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1ccccc1O ZINC000131382909 325144586 /nfs/dbraw/zinc/14/45/86/325144586.db2.gz AKZJFOCWIKQJDW-UHFFFAOYSA-N 1 2 244.250 2.048 20 0 BEADLO Cn1c[nH+]cc1Cc1noc([C@@H]2CC=CCC2)n1 ZINC000545142772 325179858 /nfs/dbraw/zinc/17/98/58/325179858.db2.gz RQPSASUHUBEHEW-SNVBAGLBSA-N 1 2 244.298 2.218 20 0 BEADLO Cc1cc(NC(=O)CCOC(C)C)cc[nH+]1 ZINC000073688593 325210039 /nfs/dbraw/zinc/21/00/39/325210039.db2.gz XFQKETNJXMBSCE-UHFFFAOYSA-N 1 2 222.288 2.144 20 0 BEADLO C[C@@H]1CC[C@H](c2nc(Cc3c[nH+]cn3C)no2)C1 ZINC000547257105 325334248 /nfs/dbraw/zinc/33/42/48/325334248.db2.gz KHVGBYPXCMTGJI-ZJUUUORDSA-N 1 2 246.314 2.298 20 0 BEADLO Cc1nnc(C[NH2+][C@@H](C)c2cncc(C)c2)s1 ZINC000547354269 325347006 /nfs/dbraw/zinc/34/70/06/325347006.db2.gz SDJBKYMDGOIDNO-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO C[C@H]1CCC[C@H]1CC(=O)N1CC(n2cc[nH+]c2)C1 ZINC000547424661 325353120 /nfs/dbraw/zinc/35/31/20/325353120.db2.gz IRLLPFAYHVIYFN-RYUDHWBXSA-N 1 2 247.342 2.093 20 0 BEADLO C[C@H]1CCC[C@@H]1CC(=O)N1CC(n2cc[nH+]c2)C1 ZINC000547424660 325353145 /nfs/dbraw/zinc/35/31/45/325353145.db2.gz IRLLPFAYHVIYFN-NWDGAFQWSA-N 1 2 247.342 2.093 20 0 BEADLO COC[C@H]([NH2+]Cc1ccc(C)cn1)c1ccco1 ZINC000134384580 325356479 /nfs/dbraw/zinc/35/64/79/325356479.db2.gz BHZVLLSNOPIOSU-ZDUSSCGKSA-N 1 2 246.310 2.460 20 0 BEADLO Cc1cc(NC(=O)N2CCC=C(F)C2)c(C)c[nH+]1 ZINC000547465069 325359042 /nfs/dbraw/zinc/35/90/42/325359042.db2.gz HMRMSZQKDIFKPR-UHFFFAOYSA-N 1 2 249.289 2.211 20 0 BEADLO Cc1cc(NC(=O)C2CC=CC2)cc[nH+]1 ZINC000076999468 325362815 /nfs/dbraw/zinc/36/28/15/325362815.db2.gz GURZJNRDBYYBFW-UHFFFAOYSA-N 1 2 202.257 2.295 20 0 BEADLO Cc1nnc(C[NH2+][C@@H](C)c2ccoc2)s1 ZINC000134722649 325373222 /nfs/dbraw/zinc/37/32/22/325373222.db2.gz XAFGTOCOWMJDMP-ZETCQYMHSA-N 1 2 223.301 2.290 20 0 BEADLO C[C@@H]1C[C@@H](C)N1Cc1[nH+]ccn1CC(F)(F)F ZINC000547769992 325395010 /nfs/dbraw/zinc/39/50/10/325395010.db2.gz NVNUCEFIMPYPPC-RKDXNWHRSA-N 1 2 247.264 2.428 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1nc(CC(F)(F)F)no1 ZINC000548096214 325428509 /nfs/dbraw/zinc/42/85/09/325428509.db2.gz IIBMYORIDUXICE-BQBZGAKWSA-N 1 2 249.236 2.157 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1nc(CC(F)(F)F)no1 ZINC000548096216 325428528 /nfs/dbraw/zinc/42/85/28/325428528.db2.gz IIBMYORIDUXICE-RNFRBKRXSA-N 1 2 249.236 2.157 20 0 BEADLO CC1(C(=O)N2CC(n3cc[nH+]c3)C2)CCCCC1 ZINC000548367764 325451248 /nfs/dbraw/zinc/45/12/48/325451248.db2.gz OBMVJBBZLVKKKX-UHFFFAOYSA-N 1 2 247.342 2.237 20 0 BEADLO Cc1nnc([C@H](C)[NH+]2[C@H](C)C[C@H]2C)s1 ZINC000549172703 325498237 /nfs/dbraw/zinc/49/82/37/325498237.db2.gz IATHUUFXUYHFIK-PRJMDXOYSA-N 1 2 211.334 2.390 20 0 BEADLO C[C@H]1CC[C@H](NC(=O)CCc2c[nH+]cn2C)CC1 ZINC000248819505 325622096 /nfs/dbraw/zinc/62/20/96/325622096.db2.gz BFEQZNLPJQKBCF-HAQNSBGRSA-N 1 2 249.358 2.048 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2CCC2(C)C)c(C)c[nH+]1 ZINC000554298241 325712605 /nfs/dbraw/zinc/71/26/05/325712605.db2.gz UVGGHNMMOWHKJO-GFCCVEGCSA-N 1 2 247.342 2.430 20 0 BEADLO CC[C@H](C)[C@H](C)N(C(=O)Cn1cc[nH+]c1)C1CC1 ZINC000564639847 325798849 /nfs/dbraw/zinc/79/88/49/325798849.db2.gz ICWBHMWFCGLZMK-RYUDHWBXSA-N 1 2 249.358 2.309 20 0 BEADLO CCCCN(CC)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000564731760 325803629 /nfs/dbraw/zinc/80/36/29/325803629.db2.gz HOUPINUZAUDATI-LBPRGKRZSA-N 1 2 237.347 2.483 20 0 BEADLO CC[C@@H]([NH2+][C@@H](C)c1cncnc1C)C(F)F ZINC000565219661 325878379 /nfs/dbraw/zinc/87/83/79/325878379.db2.gz XLRKMMZVOXKLDV-WCBMZHEXSA-N 1 2 229.274 2.479 20 0 BEADLO Cc1ccc(NC(=O)N[C@H]2CC23CC3)c(C)[nH+]1 ZINC000566143725 326002631 /nfs/dbraw/zinc/00/26/31/326002631.db2.gz HWVHFXTZBJGPMV-NSHDSACASA-N 1 2 231.299 2.372 20 0 BEADLO C[C@H](CC(=O)N(C)[C@@H]1CC1(C)C)n1cc[nH+]c1 ZINC000566302830 326031269 /nfs/dbraw/zinc/03/12/69/326031269.db2.gz AWQLOEHMJFGICS-GHMZBOCLSA-N 1 2 235.331 2.091 20 0 BEADLO C[C@H](CC(=O)N(C)[C@H]1CC1(C)C)n1cc[nH+]c1 ZINC000566302831 326031380 /nfs/dbraw/zinc/03/13/80/326031380.db2.gz AWQLOEHMJFGICS-MNOVXSKESA-N 1 2 235.331 2.091 20 0 BEADLO C[C@@H](CC(=O)N(C)Cc1ccoc1)n1cc[nH+]c1 ZINC000566308556 326032185 /nfs/dbraw/zinc/03/21/85/326032185.db2.gz TWBVPJIGWDGESZ-NSHDSACASA-N 1 2 247.298 2.086 20 0 BEADLO C[C@H](CC(=O)N1C[C@H](C)C[C@@H]1C)n1cc[nH+]c1 ZINC000566328555 326033576 /nfs/dbraw/zinc/03/35/76/326033576.db2.gz PQLGFVSZUQMQIT-UTUOFQBUSA-N 1 2 235.331 2.091 20 0 BEADLO CCCC1(CNC(=O)[C@@H](C)Cc2c[nH+]c[nH]2)CC1 ZINC000566443730 326048255 /nfs/dbraw/zinc/04/82/55/326048255.db2.gz ZIXVNQAZCSALLH-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO CCCC1(CNC(=O)[C@@H](C)Cc2c[nH]c[nH+]2)CC1 ZINC000566443730 326048258 /nfs/dbraw/zinc/04/82/58/326048258.db2.gz ZIXVNQAZCSALLH-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO CC(C)[C@@H]1CCCN1C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000567059672 326108865 /nfs/dbraw/zinc/10/88/65/326108865.db2.gz DKQGJBYKBVECKR-AAEUAGOBSA-N 1 2 249.358 2.235 20 0 BEADLO CC(C)[C@@H]1CCCN1C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000567059672 326108868 /nfs/dbraw/zinc/10/88/68/326108868.db2.gz DKQGJBYKBVECKR-AAEUAGOBSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H]1CCCC[C@H]1CC(=O)NCc1c[nH+]cn1C ZINC000567287322 326156449 /nfs/dbraw/zinc/15/64/49/326156449.db2.gz VDBPVYCRHWYALA-NEPJUHHUSA-N 1 2 249.358 2.253 20 0 BEADLO CC(C)[C@H]1CCN(C(=O)[C@@H](C)Cc2c[nH+]c[nH]2)C1 ZINC000567288462 326156496 /nfs/dbraw/zinc/15/64/96/326156496.db2.gz PWBUDCGVFKXSKT-RYUDHWBXSA-N 1 2 249.358 2.093 20 0 BEADLO CC(C)[C@H]1CCN(C(=O)[C@@H](C)Cc2c[nH]c[nH+]2)C1 ZINC000567288462 326156497 /nfs/dbraw/zinc/15/64/97/326156497.db2.gz PWBUDCGVFKXSKT-RYUDHWBXSA-N 1 2 249.358 2.093 20 0 BEADLO CCC1(C(=O)N(C)CCCn2cc[nH+]c2)CCC1 ZINC000155013940 326179004 /nfs/dbraw/zinc/17/90/04/326179004.db2.gz ZQIAQPNPXNGBMK-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO Cc1cc(C(=O)NCc2[nH]cc[nH+]2)cc(C)c1F ZINC000155455241 326196350 /nfs/dbraw/zinc/19/63/50/326196350.db2.gz UECPLDSYUAUKHW-UHFFFAOYSA-N 1 2 247.273 2.096 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N3[C@H](C)C[C@H]3C)ccn12 ZINC000567751295 326255511 /nfs/dbraw/zinc/25/55/11/326255511.db2.gz XYCZSPSOYYTCMD-NXEZZACHSA-N 1 2 243.310 2.266 20 0 BEADLO C[C@@H](CC(=O)N[C@@H]1C[C@H]1C1CCC1)n1cc[nH+]c1 ZINC000568057614 326301484 /nfs/dbraw/zinc/30/14/84/326301484.db2.gz IEVUSMBHYYFVAT-WCFLWFBJSA-N 1 2 247.342 2.139 20 0 BEADLO Fc1cccc2c1CN(Cc1[nH]cc[nH+]1)CC2 ZINC000157979486 326302387 /nfs/dbraw/zinc/30/23/87/326302387.db2.gz WBPIBLKVSCTLLK-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO CC[C@H]1CCC[C@@H]1NC(=O)C[NH+]1CC(C)(C)C1 ZINC000568197180 326324714 /nfs/dbraw/zinc/32/47/14/326324714.db2.gz YOARZUGXQQYAOY-RYUDHWBXSA-N 1 2 238.375 2.023 20 0 BEADLO CCC1(NC(=O)[C@@H](C)Cc2c[nH+]c[nH]2)CCCC1 ZINC000568228442 326329706 /nfs/dbraw/zinc/32/97/06/326329706.db2.gz ZXHPXSQJQZEBBX-NSHDSACASA-N 1 2 249.358 2.427 20 0 BEADLO CCC1(NC(=O)[C@@H](C)Cc2c[nH]c[nH+]2)CCCC1 ZINC000568228442 326329707 /nfs/dbraw/zinc/32/97/07/326329707.db2.gz ZXHPXSQJQZEBBX-NSHDSACASA-N 1 2 249.358 2.427 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CC2(CCC2(F)F)C1 ZINC000568247740 326333859 /nfs/dbraw/zinc/33/38/59/326333859.db2.gz VPZHSHVZECXVKT-UHFFFAOYSA-N 1 2 239.269 2.329 20 0 BEADLO COc1ccc(NCc2[nH]c(C)c(C)[nH+]2)cn1 ZINC000568273170 326339119 /nfs/dbraw/zinc/33/91/19/326339119.db2.gz LRJGEUZNBCONSH-UHFFFAOYSA-N 1 2 232.287 2.042 20 0 BEADLO c1cc(CNc2c[nH]c[nH+]2)n(C2CCCC2)n1 ZINC000568354713 326348475 /nfs/dbraw/zinc/34/84/75/326348475.db2.gz PRJAXNZHADLDKQ-UHFFFAOYSA-N 1 2 231.303 2.333 20 0 BEADLO COCC1(CC(=O)Nc2c(C)cc[nH+]c2C)CC1 ZINC000568988659 326385035 /nfs/dbraw/zinc/38/50/35/326385035.db2.gz ZLWMUMKAJNEBEC-UHFFFAOYSA-N 1 2 248.326 2.454 20 0 BEADLO c1[nH]cc(N[C@@H]2CCC[C@H]([C@H]3CCOC3)C2)[nH+]1 ZINC000569161464 326393190 /nfs/dbraw/zinc/39/31/90/326393190.db2.gz AGVDQWDLXUNRDE-SDDRHHMPSA-N 1 2 235.331 2.417 20 0 BEADLO CC[C@H](C)[C@@H]1CCCCN1C(=O)Cn1cc[nH+]c1 ZINC000573148815 326432151 /nfs/dbraw/zinc/43/21/51/326432151.db2.gz BEYMZNAKAFVLEY-STQMWFEESA-N 1 2 249.358 2.310 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N3CC(C)(C)C3)ccn12 ZINC000655038838 487974646 /nfs/dbraw/zinc/97/46/46/487974646.db2.gz QTMIKSCHRFAUTF-UHFFFAOYSA-N 1 2 243.310 2.125 20 0 BEADLO CCC[C@@H](C)C[N@@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000682558783 487987580 /nfs/dbraw/zinc/98/75/80/487987580.db2.gz PEADHUCFNNWNLK-ZJUUUORDSA-N 1 2 221.291 2.125 20 0 BEADLO CCC[C@@H](C)C[N@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000682558783 487987584 /nfs/dbraw/zinc/98/75/84/487987584.db2.gz PEADHUCFNNWNLK-ZJUUUORDSA-N 1 2 221.291 2.125 20 0 BEADLO CCC(CC)C[N@@H+]1C[C@H](O)CC(F)(F)C1 ZINC000682558118 487989031 /nfs/dbraw/zinc/98/90/31/487989031.db2.gz HKXWEYLYVOIDJE-SNVBAGLBSA-N 1 2 221.291 2.125 20 0 BEADLO CCC(CC)C[N@H+]1C[C@H](O)CC(F)(F)C1 ZINC000682558118 487989035 /nfs/dbraw/zinc/98/90/35/487989035.db2.gz HKXWEYLYVOIDJE-SNVBAGLBSA-N 1 2 221.291 2.125 20 0 BEADLO CCc1cc(NC[C@@H]2CCOC[C@@H]2C)nc[nH+]1 ZINC000672329358 487997406 /nfs/dbraw/zinc/99/74/06/487997406.db2.gz BCDLDBZTHNIOFR-QWRGUYRKSA-N 1 2 235.331 2.124 20 0 BEADLO CCc1cc(NC[C@@H]2CCOC[C@H]2C)nc[nH+]1 ZINC000672329357 487997481 /nfs/dbraw/zinc/99/74/81/487997481.db2.gz BCDLDBZTHNIOFR-MNOVXSKESA-N 1 2 235.331 2.124 20 0 BEADLO CSC1(CNc2c[nH+]cc(N(C)C)c2)CC1 ZINC000602723269 487998185 /nfs/dbraw/zinc/99/81/85/487998185.db2.gz FFWYIBLWFWDPKY-UHFFFAOYSA-N 1 2 237.372 2.455 20 0 BEADLO CCN1CC[N@@H+]([C@@H](C)c2cccnc2)C[C@@H]1C ZINC000677195628 487998280 /nfs/dbraw/zinc/99/82/80/487998280.db2.gz PIMSUFVODWSHMK-STQMWFEESA-N 1 2 233.359 2.169 20 0 BEADLO CCN1CC[N@H+]([C@@H](C)c2cccnc2)C[C@@H]1C ZINC000677195628 487998281 /nfs/dbraw/zinc/99/82/81/487998281.db2.gz PIMSUFVODWSHMK-STQMWFEESA-N 1 2 233.359 2.169 20 0 BEADLO CCN1CC[N@@H+]([C@H](C)c2cccnc2)C[C@H]1C ZINC000677195624 487998678 /nfs/dbraw/zinc/99/86/78/487998678.db2.gz PIMSUFVODWSHMK-CHWSQXEVSA-N 1 2 233.359 2.169 20 0 BEADLO CCN1CC[N@H+]([C@H](C)c2cccnc2)C[C@H]1C ZINC000677195624 487998680 /nfs/dbraw/zinc/99/86/80/487998680.db2.gz PIMSUFVODWSHMK-CHWSQXEVSA-N 1 2 233.359 2.169 20 0 BEADLO CC[C@H]1CC[C@H]1Nc1ccc(N(C)CCO)c[nH+]1 ZINC000672606830 488014014 /nfs/dbraw/zinc/01/40/14/488014014.db2.gz FKKHVGKMSWRJRP-WCQYABFASA-N 1 2 249.358 2.111 20 0 BEADLO Fc1cccn2cc(C[NH2+]Cc3ccco3)nc12 ZINC000677319053 488015452 /nfs/dbraw/zinc/01/54/52/488015452.db2.gz JAVGTQNGBYQSDG-UHFFFAOYSA-N 1 2 245.257 2.356 20 0 BEADLO COCc1csc(C[N@@H+]2CCO[C@@H](C)C2)c1 ZINC000667492357 488025575 /nfs/dbraw/zinc/02/55/75/488025575.db2.gz FNAHMXRWZOWJNG-JTQLQIEISA-N 1 2 241.356 2.115 20 0 BEADLO COCc1csc(C[N@H+]2CCO[C@@H](C)C2)c1 ZINC000667492357 488025578 /nfs/dbraw/zinc/02/55/78/488025578.db2.gz FNAHMXRWZOWJNG-JTQLQIEISA-N 1 2 241.356 2.115 20 0 BEADLO CC[C@@H](C)CCNC(=O)Nc1cc[nH+]c(C)c1 ZINC000666491813 488027113 /nfs/dbraw/zinc/02/71/13/488027113.db2.gz CQPZRLNLSZWXOF-SNVBAGLBSA-N 1 2 235.331 2.370 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cnc(C)nc2)nc1 ZINC000682788466 488041511 /nfs/dbraw/zinc/04/15/11/488041511.db2.gz XXPJCOLSVLTJBS-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cnc(C)nc2)nc1 ZINC000682788466 488041517 /nfs/dbraw/zinc/04/15/17/488041517.db2.gz XXPJCOLSVLTJBS-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1occc1CN(C)Cc1c[nH+]c2n1CCC2 ZINC000667551693 488042511 /nfs/dbraw/zinc/04/25/11/488042511.db2.gz VCLBDXUDBXAVHK-UHFFFAOYSA-N 1 2 245.326 2.363 20 0 BEADLO OC[C@@H]1CCC[N@@H+]1Cc1ccc(F)c(F)c1F ZINC000667552390 488042414 /nfs/dbraw/zinc/04/24/14/488042414.db2.gz FJFLLNWLIMUCIM-VIFPVBQESA-N 1 2 245.244 2.061 20 0 BEADLO OC[C@@H]1CCC[N@H+]1Cc1ccc(F)c(F)c1F ZINC000667552390 488042419 /nfs/dbraw/zinc/04/24/19/488042419.db2.gz FJFLLNWLIMUCIM-VIFPVBQESA-N 1 2 245.244 2.061 20 0 BEADLO Cc1cc(N[C@H]2C[C@@H]2c2cccnc2)nc[nH+]1 ZINC000670325245 488048663 /nfs/dbraw/zinc/04/86/63/488048663.db2.gz ODVLYPHHOYKUPI-NEPJUHHUSA-N 1 2 226.283 2.148 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCCC1(F)F)c1ccc(=O)[nH]n1 ZINC000672620640 488061897 /nfs/dbraw/zinc/06/18/97/488061897.db2.gz OSPOBPCNSIRNEL-IONNQARKSA-N 1 2 243.257 2.021 20 0 BEADLO CC(C)CCN(C)C(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000666183674 488072026 /nfs/dbraw/zinc/07/20/26/488072026.db2.gz UPJIURRMWFBTRL-LLVKDONJSA-N 1 2 249.358 2.019 20 0 BEADLO CC(C)CCN(C)C(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000666183674 488072033 /nfs/dbraw/zinc/07/20/33/488072033.db2.gz UPJIURRMWFBTRL-LLVKDONJSA-N 1 2 249.358 2.019 20 0 BEADLO C[C@H]1COCCC[N@@H+]1Cc1ncc(C2CC2)o1 ZINC000677695056 488094011 /nfs/dbraw/zinc/09/40/11/488094011.db2.gz BPWZRRRMNFKRLJ-JTQLQIEISA-N 1 2 236.315 2.163 20 0 BEADLO C[C@H]1COCCC[N@H+]1Cc1ncc(C2CC2)o1 ZINC000677695056 488094014 /nfs/dbraw/zinc/09/40/14/488094014.db2.gz BPWZRRRMNFKRLJ-JTQLQIEISA-N 1 2 236.315 2.163 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCC=C(F)C2)c1 ZINC000683019106 488095060 /nfs/dbraw/zinc/09/50/60/488095060.db2.gz HFZFAZPHDLOZQA-UHFFFAOYSA-N 1 2 206.264 2.449 20 0 BEADLO Cc1ccnc(C[N@H+]2CCC=C(F)C2)c1 ZINC000683019106 488095067 /nfs/dbraw/zinc/09/50/67/488095067.db2.gz HFZFAZPHDLOZQA-UHFFFAOYSA-N 1 2 206.264 2.449 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCOCC23CCC3)c1 ZINC000683018316 488095546 /nfs/dbraw/zinc/09/55/46/488095546.db2.gz PXWPWAXQMTWIKS-UHFFFAOYSA-N 1 2 232.327 2.145 20 0 BEADLO Cc1ccnc(C[N@H+]2CCOCC23CCC3)c1 ZINC000683018316 488095550 /nfs/dbraw/zinc/09/55/50/488095550.db2.gz PXWPWAXQMTWIKS-UHFFFAOYSA-N 1 2 232.327 2.145 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+]2CC[C@@H](C(F)(F)F)C2)n1 ZINC000677714019 488097788 /nfs/dbraw/zinc/09/77/88/488097788.db2.gz NZTIEHLVIGBEOQ-HTRCEHHLSA-N 1 2 249.236 2.323 20 0 BEADLO Cc1noc([C@@H](C)[N@H+]2CC[C@@H](C(F)(F)F)C2)n1 ZINC000677714019 488097792 /nfs/dbraw/zinc/09/77/92/488097792.db2.gz NZTIEHLVIGBEOQ-HTRCEHHLSA-N 1 2 249.236 2.323 20 0 BEADLO CCn1ccc(C[N@H+](C)[C@@H](C)c2nnc(C)o2)c1 ZINC000683031302 488102317 /nfs/dbraw/zinc/10/23/17/488102317.db2.gz UNRNKXFIQHYRRI-JTQLQIEISA-N 1 2 248.330 2.392 20 0 BEADLO CCn1ccc(C[N@@H+](C)[C@@H](C)c2nnc(C)o2)c1 ZINC000683031302 488102319 /nfs/dbraw/zinc/10/23/19/488102319.db2.gz UNRNKXFIQHYRRI-JTQLQIEISA-N 1 2 248.330 2.392 20 0 BEADLO COCC1([N@H+](C)Cc2nc(C)cs2)CC1 ZINC000677728986 488106315 /nfs/dbraw/zinc/10/63/15/488106315.db2.gz REBDASRVFCINEQ-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO COCC1([N@@H+](C)Cc2nc(C)cs2)CC1 ZINC000677728986 488106322 /nfs/dbraw/zinc/10/63/22/488106322.db2.gz REBDASRVFCINEQ-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO CC[C@H](C(N)=O)[N@@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000451833119 488114664 /nfs/dbraw/zinc/11/46/64/488114664.db2.gz HOLODVWGYFBJTP-PWSUYJOCSA-N 1 2 248.326 2.071 20 0 BEADLO CC[C@H](C(N)=O)[N@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000451833119 488114674 /nfs/dbraw/zinc/11/46/74/488114674.db2.gz HOLODVWGYFBJTP-PWSUYJOCSA-N 1 2 248.326 2.071 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cn(C)nn2)c(C)c1 ZINC000677759799 488119384 /nfs/dbraw/zinc/11/93/84/488119384.db2.gz BBJXNFHDOBFELU-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cn(C)nn2)c(C)c1 ZINC000677759799 488119389 /nfs/dbraw/zinc/11/93/89/488119389.db2.gz BBJXNFHDOBFELU-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO CC[C@@H]([NH2+]Cc1ncnn1C)c1ccccc1F ZINC000180683086 488120712 /nfs/dbraw/zinc/12/07/12/488120712.db2.gz HQUQBAONBVMWSV-GFCCVEGCSA-N 1 2 248.305 2.195 20 0 BEADLO Cc1cnc(CN2CCCC[C@H]2c2[nH]cc[nH+]2)o1 ZINC000675893875 488132266 /nfs/dbraw/zinc/13/22/66/488132266.db2.gz UEXIVEKWLQBNDZ-NSHDSACASA-N 1 2 246.314 2.433 20 0 BEADLO CC1(C)CCC[C@H]1NC(=O)CCCn1cc[nH+]c1 ZINC000674260170 487541138 /nfs/dbraw/zinc/54/11/38/487541138.db2.gz NHRFLXGWBIKIHC-GFCCVEGCSA-N 1 2 249.358 2.358 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2C[C@H]2C)c(C)[nH+]1 ZINC000119393458 487543419 /nfs/dbraw/zinc/54/34/19/487543419.db2.gz POWMDDFOMLIRAW-XCBNKYQSSA-N 1 2 204.273 2.293 20 0 BEADLO Cc1nc([C@H](C)[N@@H+](C)CCC(C)C)no1 ZINC000685561475 487543815 /nfs/dbraw/zinc/54/38/15/487543815.db2.gz DWMVVEKYCSUSIJ-VIFPVBQESA-N 1 2 211.309 2.417 20 0 BEADLO Cc1nc([C@H](C)[N@H+](C)CCC(C)C)no1 ZINC000685561475 487543822 /nfs/dbraw/zinc/54/38/22/487543822.db2.gz DWMVVEKYCSUSIJ-VIFPVBQESA-N 1 2 211.309 2.417 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2C[C@@H]2C)c(C)[nH+]1 ZINC000119393195 487543988 /nfs/dbraw/zinc/54/39/88/487543988.db2.gz POWMDDFOMLIRAW-XVKPBYJWSA-N 1 2 204.273 2.293 20 0 BEADLO CCn1nccc1C[NH2+][C@@H](C)c1nccs1 ZINC000119128672 487530472 /nfs/dbraw/zinc/53/04/72/487530472.db2.gz MWPTZJQLWZYOAT-VIFPVBQESA-N 1 2 236.344 2.210 20 0 BEADLO Cc1ccoc1C(=O)Nc1cc(N(C)C)cc[nH+]1 ZINC000680257833 487553226 /nfs/dbraw/zinc/55/32/26/487553226.db2.gz WCTFPHKVWXFXCA-UHFFFAOYSA-N 1 2 245.282 2.301 20 0 BEADLO Cc1occc1C(=O)Nc1cc(N(C)C)cc[nH+]1 ZINC000680258489 487554247 /nfs/dbraw/zinc/55/42/47/487554247.db2.gz OYUMLXWKFQAFLK-UHFFFAOYSA-N 1 2 245.282 2.301 20 0 BEADLO CCc1nnc(C[N@H+](C)[C@H]2CCSC2)s1 ZINC000680069993 487530745 /nfs/dbraw/zinc/53/07/45/487530745.db2.gz MFLHTGAZICHOQF-QMMMGPOBSA-N 1 2 243.401 2.038 20 0 BEADLO CCc1nnc(C[N@@H+](C)[C@H]2CCSC2)s1 ZINC000680069993 487530747 /nfs/dbraw/zinc/53/07/47/487530747.db2.gz MFLHTGAZICHOQF-QMMMGPOBSA-N 1 2 243.401 2.038 20 0 BEADLO C[C@H](C(=O)Nc1ccc2[nH+]ccn2c1)C1CC1 ZINC000673899970 487472333 /nfs/dbraw/zinc/47/23/33/487472333.db2.gz RSKVJGCQSWKNJY-VIFPVBQESA-N 1 2 229.283 2.319 20 0 BEADLO Fc1cncc([C@@H]([NH2+]Cc2cocn2)C2CC2)c1 ZINC000684960117 487474899 /nfs/dbraw/zinc/47/48/99/487474899.db2.gz FWCGKGGJOZIVNE-ZDUSSCGKSA-N 1 2 247.273 2.450 20 0 BEADLO C[N@H+](Cc1cn[nH]c1)Cc1ccccc1F ZINC000673927305 487481718 /nfs/dbraw/zinc/48/17/18/487481718.db2.gz DRLSBXKICIUTLA-UHFFFAOYSA-N 1 2 219.263 2.181 20 0 BEADLO C[N@@H+](Cc1cn[nH]c1)Cc1ccccc1F ZINC000673927305 487481722 /nfs/dbraw/zinc/48/17/22/487481722.db2.gz DRLSBXKICIUTLA-UHFFFAOYSA-N 1 2 219.263 2.181 20 0 BEADLO CCc1cc(NC[C@@]2(C)CCCC[C@H]2O)nc[nH+]1 ZINC000673933463 487484342 /nfs/dbraw/zinc/48/43/42/487484342.db2.gz UGAKCASWFREULE-TZMCWYRMSA-N 1 2 249.358 2.392 20 0 BEADLO Cc1noc([C@H](C)[N@@H+]2CCCc3occc3C2)n1 ZINC000685057824 487498155 /nfs/dbraw/zinc/49/81/55/487498155.db2.gz YPGSXJNKRNIRJW-VIFPVBQESA-N 1 2 247.298 2.480 20 0 BEADLO Cc1noc([C@H](C)[N@H+]2CCCc3occc3C2)n1 ZINC000685057824 487498160 /nfs/dbraw/zinc/49/81/60/487498160.db2.gz YPGSXJNKRNIRJW-VIFPVBQESA-N 1 2 247.298 2.480 20 0 BEADLO C[N@H+](C/C(Cl)=C/Cl)[C@@H]1CCOC1 ZINC000268697619 487502508 /nfs/dbraw/zinc/50/25/08/487502508.db2.gz UJTSUXIQHBAYKB-RBMBQVQZSA-N 1 2 210.104 2.026 20 0 BEADLO C[N@@H+](C/C(Cl)=C/Cl)[C@@H]1CCOC1 ZINC000268697619 487502515 /nfs/dbraw/zinc/50/25/15/487502515.db2.gz UJTSUXIQHBAYKB-RBMBQVQZSA-N 1 2 210.104 2.026 20 0 BEADLO COc1ccc(N[C@H](C)COC(C)C)[nH+]c1 ZINC000381313984 487504573 /nfs/dbraw/zinc/50/45/73/487504573.db2.gz QUJQQDDWYZEYJU-SNVBAGLBSA-N 1 2 224.304 2.316 20 0 BEADLO C[C@@H](C(=O)N(C)Cc1[nH+]ccn1C)C1CCCC1 ZINC000674089152 487515831 /nfs/dbraw/zinc/51/58/31/487515831.db2.gz KQNANFPZKOSLPH-LLVKDONJSA-N 1 2 249.358 2.205 20 0 BEADLO CCCn1nccc1C[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000667943151 488164067 /nfs/dbraw/zinc/16/40/67/488164067.db2.gz BHTQBXRKWRTWQC-YPMHNXCESA-N 1 2 239.338 2.473 20 0 BEADLO CCCn1nccc1C[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000667943151 488164070 /nfs/dbraw/zinc/16/40/70/488164070.db2.gz BHTQBXRKWRTWQC-YPMHNXCESA-N 1 2 239.338 2.473 20 0 BEADLO CCCn1nccc1C[N@@H+]1CC[C@H](C)[C@H](F)C1 ZINC000667943150 488165175 /nfs/dbraw/zinc/16/51/75/488165175.db2.gz BHTQBXRKWRTWQC-WCQYABFASA-N 1 2 239.338 2.473 20 0 BEADLO CCCn1nccc1C[N@H+]1CC[C@H](C)[C@H](F)C1 ZINC000667943150 488165180 /nfs/dbraw/zinc/16/51/80/488165180.db2.gz BHTQBXRKWRTWQC-WCQYABFASA-N 1 2 239.338 2.473 20 0 BEADLO COc1ccc(F)cc1C[N@H+](C)Cc1cn[nH]c1 ZINC000674753488 487613122 /nfs/dbraw/zinc/61/31/22/487613122.db2.gz RRMXOPLEVWODCM-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO COc1ccc(F)cc1C[N@@H+](C)Cc1cn[nH]c1 ZINC000674753488 487613124 /nfs/dbraw/zinc/61/31/24/487613124.db2.gz RRMXOPLEVWODCM-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO Cc1cc(C(=O)N[C@H](C)Cn2cc[nH+]c2)cs1 ZINC000671656839 487674649 /nfs/dbraw/zinc/67/46/49/487674649.db2.gz LOSMUMCMFDFVPP-SECBINFHSA-N 1 2 249.339 2.072 20 0 BEADLO C[C@H](Cc1nc(-c2ccoc2)no1)n1cc[nH+]c1 ZINC000351513513 487679628 /nfs/dbraw/zinc/67/96/28/487679628.db2.gz PWTJAALQPXALKL-SECBINFHSA-N 1 2 244.254 2.330 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)[C@@H]1CC12CCC2 ZINC000675331793 487709675 /nfs/dbraw/zinc/70/96/75/487709675.db2.gz ULQNOCDGJFLOCR-NSHDSACASA-N 1 2 241.294 2.463 20 0 BEADLO CN(C)c1c[nH+]ccc1NC(=O)CCC(C)(C)C ZINC000681358184 487783660 /nfs/dbraw/zinc/78/36/60/487783660.db2.gz SPXFIEAKHXYPQB-UHFFFAOYSA-N 1 2 249.358 2.334 20 0 BEADLO CCc1cc(N(C)CCOC(C)(C)C)nc[nH+]1 ZINC000676029951 487800981 /nfs/dbraw/zinc/80/09/81/487800981.db2.gz BEVMSTBQCWNULX-UHFFFAOYSA-N 1 2 237.347 2.290 20 0 BEADLO CCC(CC)CNc1nc(N(C)C)nc(C)[nH+]1 ZINC000676079445 487810405 /nfs/dbraw/zinc/81/04/05/487810405.db2.gz RUUSXRLVLBLDGU-UHFFFAOYSA-N 1 2 237.351 2.094 20 0 BEADLO CCC(CC)CNc1nc(C)[nH+]c(N(C)C)n1 ZINC000676079445 487810409 /nfs/dbraw/zinc/81/04/09/487810409.db2.gz RUUSXRLVLBLDGU-UHFFFAOYSA-N 1 2 237.351 2.094 20 0 BEADLO CCN(CC)c1ccc(NCc2cn[nH]c2)c[nH+]1 ZINC000676494035 487856938 /nfs/dbraw/zinc/85/69/38/487856938.db2.gz BGTFUPBBQDXLOC-UHFFFAOYSA-N 1 2 245.330 2.263 20 0 BEADLO CC[C@H](C)OCC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000676882300 487940752 /nfs/dbraw/zinc/94/07/52/487940752.db2.gz KUCKDPZBMTXFSL-JTQLQIEISA-N 1 2 247.298 2.088 20 0 BEADLO FC(F)Oc1ccc[nH+]c1NCc1cn[nH]c1 ZINC000682527995 487977519 /nfs/dbraw/zinc/97/75/19/487977519.db2.gz ZPLRTCZTFOZCMS-UHFFFAOYSA-N 1 2 240.213 2.018 20 0 BEADLO CC[N@H+](CCC(F)(F)F)Cc1ncccn1 ZINC000683006067 488088189 /nfs/dbraw/zinc/08/81/89/488088189.db2.gz IFXNCGPYFARPBG-UHFFFAOYSA-N 1 2 233.237 2.251 20 0 BEADLO CC[N@@H+](CCC(F)(F)F)Cc1ncccn1 ZINC000683006067 488088192 /nfs/dbraw/zinc/08/81/92/488088192.db2.gz IFXNCGPYFARPBG-UHFFFAOYSA-N 1 2 233.237 2.251 20 0 BEADLO CN(Cc1ncc(C(C)(C)C)o1)Cc1[nH]cc[nH+]1 ZINC000677802944 488125499 /nfs/dbraw/zinc/12/54/99/488125499.db2.gz UVICOAWHOMMYMA-UHFFFAOYSA-N 1 2 248.330 2.327 20 0 BEADLO O=C(CCCn1cc[nH+]c1)N[C@H]1CC12CCCC2 ZINC000683255681 488139679 /nfs/dbraw/zinc/13/96/79/488139679.db2.gz SGMQSQPNPGVFBA-LBPRGKRZSA-N 1 2 247.342 2.112 20 0 BEADLO CC1(C)CCC[C@@H]1CNC(=O)CCc1c[nH+]c[nH]1 ZINC000294305728 488147656 /nfs/dbraw/zinc/14/76/56/488147656.db2.gz XGFLMRNPTYLNSQ-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO CC1(C)CCC[C@@H]1CNC(=O)CCc1c[nH]c[nH+]1 ZINC000294305728 488147661 /nfs/dbraw/zinc/14/76/61/488147661.db2.gz XGFLMRNPTYLNSQ-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO c1cc(N2CCC23CCOCC3)nc(C2CC2)[nH+]1 ZINC000683396670 488156836 /nfs/dbraw/zinc/15/68/36/488156836.db2.gz JAOPFLHVKKSKBM-UHFFFAOYSA-N 1 2 245.326 2.113 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CO[C@@H](C2CC2)C1 ZINC000667918946 488158270 /nfs/dbraw/zinc/15/82/70/488158270.db2.gz QDBNHYAUQRKFDN-ZYHUDNBSSA-N 1 2 234.299 2.070 20 0 BEADLO CCn1cc(C[NH2+][C@H](C)c2ccc(C)o2)nn1 ZINC000404469233 488164964 /nfs/dbraw/zinc/16/49/64/488164964.db2.gz ZPOFSVVGEDCHFW-SNVBAGLBSA-N 1 2 234.303 2.050 20 0 BEADLO Cc1nc(N[C@H](CO)CC2CCCC2)cc[nH+]1 ZINC000677957716 488165988 /nfs/dbraw/zinc/16/59/88/488165988.db2.gz WESMNLJSOROBNI-LBPRGKRZSA-N 1 2 235.331 2.138 20 0 BEADLO CCc1cc(N[C@@H]2C[C@@H](C)O[C@@H](C)C2)nc[nH+]1 ZINC000678070938 488190933 /nfs/dbraw/zinc/19/09/33/488190933.db2.gz KMMUMBVVQHHHBM-PEGIJTEDSA-N 1 2 235.331 2.407 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CC(C(C)(C)C)C1 ZINC000334597753 488194434 /nfs/dbraw/zinc/19/44/34/488194434.db2.gz YPDHRVAZSHVBSL-UHFFFAOYSA-N 1 2 207.321 2.196 20 0 BEADLO Cc1occc1CNC(=O)Nc1cc[nH+]cc1C ZINC000678096467 488197701 /nfs/dbraw/zinc/19/77/01/488197701.db2.gz BSPULBZHBFFBDX-UHFFFAOYSA-N 1 2 245.282 2.035 20 0 BEADLO CC1=CCC[N@H+](Cc2cn(C3CCC3)nn2)C1 ZINC000668100066 488202710 /nfs/dbraw/zinc/20/27/10/488202710.db2.gz BCWUJIWOVJJMJQ-UHFFFAOYSA-N 1 2 232.331 2.155 20 0 BEADLO CC1=CCC[N@@H+](Cc2cn(C3CCC3)nn2)C1 ZINC000668100066 488202713 /nfs/dbraw/zinc/20/27/13/488202713.db2.gz BCWUJIWOVJJMJQ-UHFFFAOYSA-N 1 2 232.331 2.155 20 0 BEADLO CCCc1ccc(C[NH2+]Cc2ncn(C)n2)cc1 ZINC000678158235 488210615 /nfs/dbraw/zinc/21/06/15/488210615.db2.gz YQWDMHXNKRIRHS-UHFFFAOYSA-N 1 2 244.342 2.057 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1[nH]nc2ccccc21 ZINC000678182585 488214400 /nfs/dbraw/zinc/21/44/00/488214400.db2.gz VWPCJOYDUSMNOJ-LLVKDONJSA-N 1 2 245.326 2.174 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1[nH]nc2ccccc21 ZINC000678182585 488214401 /nfs/dbraw/zinc/21/44/01/488214401.db2.gz VWPCJOYDUSMNOJ-LLVKDONJSA-N 1 2 245.326 2.174 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1n[nH]c2ccccc21 ZINC000678182585 488214403 /nfs/dbraw/zinc/21/44/03/488214403.db2.gz VWPCJOYDUSMNOJ-LLVKDONJSA-N 1 2 245.326 2.174 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1n[nH]c2ccccc21 ZINC000678182585 488214405 /nfs/dbraw/zinc/21/44/05/488214405.db2.gz VWPCJOYDUSMNOJ-LLVKDONJSA-N 1 2 245.326 2.174 20 0 BEADLO CC[C@H]1CC[N@@H+]1Cc1cc(C(F)(F)F)nn1C ZINC000668189887 488218594 /nfs/dbraw/zinc/21/85/94/488218594.db2.gz SDGFWOYWRUHTQJ-QMMMGPOBSA-N 1 2 247.264 2.423 20 0 BEADLO CC[C@H]1CC[N@H+]1Cc1cc(C(F)(F)F)nn1C ZINC000668189887 488218598 /nfs/dbraw/zinc/21/85/98/488218598.db2.gz SDGFWOYWRUHTQJ-QMMMGPOBSA-N 1 2 247.264 2.423 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)C1CCC2(CC2)CC1 ZINC000668194013 488219554 /nfs/dbraw/zinc/21/95/54/488219554.db2.gz WZJWUWHRJBERKX-UHFFFAOYSA-N 1 2 247.342 2.007 20 0 BEADLO Cn1cc(Cl)cc1C[N@H+](C)Cc1cn[nH]c1 ZINC000678337084 488241854 /nfs/dbraw/zinc/24/18/54/488241854.db2.gz AQIOXQSASDSRRZ-UHFFFAOYSA-N 1 2 238.722 2.034 20 0 BEADLO Cn1cc(Cl)cc1C[N@@H+](C)Cc1cn[nH]c1 ZINC000678337084 488241857 /nfs/dbraw/zinc/24/18/57/488241857.db2.gz AQIOXQSASDSRRZ-UHFFFAOYSA-N 1 2 238.722 2.034 20 0 BEADLO Cc1cccc(NC(=O)C(C)(C)c2c[nH+]c[nH]2)n1 ZINC000683917928 488244407 /nfs/dbraw/zinc/24/44/07/488244407.db2.gz QOYHYEBGKUOBFP-UHFFFAOYSA-N 1 2 244.298 2.029 20 0 BEADLO Cc1cccc(NC(=O)C(C)(C)c2c[nH]c[nH+]2)n1 ZINC000683917928 488244409 /nfs/dbraw/zinc/24/44/09/488244409.db2.gz QOYHYEBGKUOBFP-UHFFFAOYSA-N 1 2 244.298 2.029 20 0 BEADLO CCc1nc(Nc2cnn(C)c2C)cc(C)[nH+]1 ZINC000672235583 488247070 /nfs/dbraw/zinc/24/70/70/488247070.db2.gz JDMPAKNYXAEYHO-UHFFFAOYSA-N 1 2 231.303 2.133 20 0 BEADLO FC(F)[C@H]1CCN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000672275049 488249444 /nfs/dbraw/zinc/24/94/44/488249444.db2.gz FNFDFVIUOHUQRM-VIFPVBQESA-N 1 2 239.269 2.445 20 0 BEADLO Nc1nc(N2CCC[C@@H]3C[C@@H]32)[nH+]c2ccccc12 ZINC000672323091 488251084 /nfs/dbraw/zinc/25/10/84/488251084.db2.gz XESDPOZFJSPTJR-SKDRFNHKSA-N 1 2 240.310 2.201 20 0 BEADLO C[C@H](c1nncn1C)[N@H+](C)Cc1ccsc1 ZINC000672535649 488258218 /nfs/dbraw/zinc/25/82/18/488258218.db2.gz OZSHSEGOHZTDEO-SECBINFHSA-N 1 2 236.344 2.070 20 0 BEADLO C[C@H](c1nncn1C)[N@@H+](C)Cc1ccsc1 ZINC000672535649 488258219 /nfs/dbraw/zinc/25/82/19/488258219.db2.gz OZSHSEGOHZTDEO-SECBINFHSA-N 1 2 236.344 2.070 20 0 BEADLO Cc1cc(=O)[nH]c([C@@H](C)[N@H+](C)Cc2ccoc2)n1 ZINC000684089317 488265503 /nfs/dbraw/zinc/26/55/03/488265503.db2.gz SWDWFFUVOBTJRG-SNVBAGLBSA-N 1 2 247.298 2.277 20 0 BEADLO Cc1cc(=O)[nH]c([C@@H](C)[N@@H+](C)Cc2ccoc2)n1 ZINC000684089317 488265505 /nfs/dbraw/zinc/26/55/05/488265505.db2.gz SWDWFFUVOBTJRG-SNVBAGLBSA-N 1 2 247.298 2.277 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)NCc1cocn1 ZINC000672766689 488265692 /nfs/dbraw/zinc/26/56/92/488265692.db2.gz WJXPXBOYFQDOJG-UHFFFAOYSA-N 1 2 246.270 2.008 20 0 BEADLO Cc1c(C[N@H+](C)Cc2cc(C)ccn2)cnn1C ZINC000684107518 488267025 /nfs/dbraw/zinc/26/70/25/488267025.db2.gz KDFXHODHACEPSJ-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1c(C[N@@H+](C)Cc2cc(C)ccn2)cnn1C ZINC000684107518 488267026 /nfs/dbraw/zinc/26/70/26/488267026.db2.gz KDFXHODHACEPSJ-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO CC[C@@H]1CCC[C@H](NC(=O)Cc2c[nH+]cn2C)C1 ZINC000672918928 488268927 /nfs/dbraw/zinc/26/89/27/488268927.db2.gz BCHMNQNMPJJCNR-NEPJUHHUSA-N 1 2 249.358 2.048 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N1C2CCCC1CCC2 ZINC000672931900 488269444 /nfs/dbraw/zinc/26/94/44/488269444.db2.gz QNIKFULBSQXERB-UHFFFAOYSA-N 1 2 247.342 2.276 20 0 BEADLO Cc1cc(C(=O)Nc2cc(N(C)C)cc[nH+]2)co1 ZINC000672951058 488269867 /nfs/dbraw/zinc/26/98/67/488269867.db2.gz UMMBNORQHMCDFB-UHFFFAOYSA-N 1 2 245.282 2.301 20 0 BEADLO Cc1cc(NC(=O)C(C)(C)C(F)F)c(C)c[nH+]1 ZINC000684218371 488278963 /nfs/dbraw/zinc/27/89/63/488278963.db2.gz XBJBBQRFOIPDGM-UHFFFAOYSA-N 1 2 242.269 2.350 20 0 BEADLO Fc1c[nH+]ccc1N1C[C@H]2CCC[C@@H]2C1 ZINC000678787368 488282602 /nfs/dbraw/zinc/28/26/02/488282602.db2.gz LDECZAJRGPLUQV-NXEZZACHSA-N 1 2 206.264 2.457 20 0 BEADLO CC(C)Cn1ccnc1CNc1cc[nH+]cc1F ZINC000678787399 488282731 /nfs/dbraw/zinc/28/27/31/488282731.db2.gz NFZISXLSCJWUJZ-UHFFFAOYSA-N 1 2 248.305 2.107 20 0 BEADLO CCc1nn(C)cc1C[N@H+](C)Cc1ccoc1 ZINC000678819973 488287100 /nfs/dbraw/zinc/28/71/00/488287100.db2.gz YTOIBZHEOOXZJS-UHFFFAOYSA-N 1 2 233.315 2.208 20 0 BEADLO CCc1nn(C)cc1C[N@@H+](C)Cc1ccoc1 ZINC000678819973 488287104 /nfs/dbraw/zinc/28/71/04/488287104.db2.gz YTOIBZHEOOXZJS-UHFFFAOYSA-N 1 2 233.315 2.208 20 0 BEADLO c1cc(COc2cccc(-n3cc[nH+]c3)c2)on1 ZINC000673626724 488298175 /nfs/dbraw/zinc/29/81/75/488298175.db2.gz KDEWDUKSADYUQF-UHFFFAOYSA-N 1 2 241.250 2.439 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CCC[C@H](OC)C1 ZINC000684391631 488304592 /nfs/dbraw/zinc/30/45/92/488304592.db2.gz CTDVXQBAHWNMRC-MNOVXSKESA-N 1 2 236.315 2.460 20 0 BEADLO CCn1cc([C@H](C)Nc2ccc(OC)c[nH+]2)cn1 ZINC000679069380 488305331 /nfs/dbraw/zinc/30/53/31/488305331.db2.gz HKHBIYMFSJKKDP-JTQLQIEISA-N 1 2 246.314 2.480 20 0 BEADLO COCc1cnc(C[NH+]2CC(C(C)C)C2)s1 ZINC000684408344 488307901 /nfs/dbraw/zinc/30/79/01/488307901.db2.gz IXYMBNKHGIALOY-UHFFFAOYSA-N 1 2 240.372 2.377 20 0 BEADLO CCc1cc(NCc2csc(NC)n2)nc[nH+]1 ZINC000673885177 488311394 /nfs/dbraw/zinc/31/13/94/488311394.db2.gz LXZPBUHXDMWMIV-UHFFFAOYSA-N 1 2 249.343 2.149 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)cn1 ZINC000679217738 488317066 /nfs/dbraw/zinc/31/70/66/488317066.db2.gz AUEPIXRHKCZRFV-JQWIXIFHSA-N 1 2 238.306 2.270 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)cn1 ZINC000679217738 488317069 /nfs/dbraw/zinc/31/70/69/488317069.db2.gz AUEPIXRHKCZRFV-JQWIXIFHSA-N 1 2 238.306 2.270 20 0 BEADLO C[C@@H]1CC[C@@H](CNC(=O)CCCn2cc[nH+]c2)C1 ZINC000684515131 488324728 /nfs/dbraw/zinc/32/47/28/488324728.db2.gz QNUYCJRCZNGEFX-CHWSQXEVSA-N 1 2 249.358 2.216 20 0 BEADLO CO[C@]1(C)CCC[N@H+](CC(F)F)CC1 ZINC000684622934 488334542 /nfs/dbraw/zinc/33/45/42/488334542.db2.gz NDMJEGGQTHXRGT-SNVBAGLBSA-N 1 2 207.264 2.143 20 0 BEADLO CO[C@]1(C)CCC[N@@H+](CC(F)F)CC1 ZINC000684622934 488334544 /nfs/dbraw/zinc/33/45/44/488334544.db2.gz NDMJEGGQTHXRGT-SNVBAGLBSA-N 1 2 207.264 2.143 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cncs2)C[C@@H]1F ZINC000679357695 488344301 /nfs/dbraw/zinc/34/43/01/488344301.db2.gz DGDHGAFBVYKYTA-SCZZXKLOSA-N 1 2 214.309 2.323 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cncs2)C[C@@H]1F ZINC000679357695 488344303 /nfs/dbraw/zinc/34/43/03/488344303.db2.gz DGDHGAFBVYKYTA-SCZZXKLOSA-N 1 2 214.309 2.323 20 0 BEADLO CCCN(c1cc(-n2cc[nH+]c2)ncn1)C1CC1 ZINC000679389751 488349274 /nfs/dbraw/zinc/34/92/74/488349274.db2.gz LNPZRSKFHKLUQG-UHFFFAOYSA-N 1 2 243.314 2.041 20 0 BEADLO C[C@H]1CCC[C@@H]1CNC(=O)CCCn1cc[nH+]c1 ZINC000684945475 488354486 /nfs/dbraw/zinc/35/44/86/488354486.db2.gz FQNRLJJQWBBICJ-QWHCGFSZSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1nc(N[C@H](C)C(C)(C)O)c2c([nH+]1)CCCC2 ZINC000679836470 488367477 /nfs/dbraw/zinc/36/74/77/488367477.db2.gz HQRQDSAQQADACS-SECBINFHSA-N 1 2 249.358 2.235 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@H](OCC(C)C)C2)co1 ZINC000660003117 490129786 /nfs/dbraw/zinc/12/97/86/490129786.db2.gz MOMCROAPAONXIS-ZDUSSCGKSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@H](OCC(C)C)C2)co1 ZINC000660003117 490129792 /nfs/dbraw/zinc/12/97/92/490129792.db2.gz MOMCROAPAONXIS-ZDUSSCGKSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1[nH]ccc1C(=O)Nc1cc[nH+]c(C)c1 ZINC000074716920 490204138 /nfs/dbraw/zinc/20/41/38/490204138.db2.gz NARQJWHEIFUFQO-UHFFFAOYSA-N 1 2 215.256 2.279 20 0 BEADLO Cc1nnc(C[NH+]2C[C@@H](C)C(F)(F)[C@H](C)C2)o1 ZINC000625644669 490318884 /nfs/dbraw/zinc/31/88/84/490318884.db2.gz CACOXOBWTAPIIN-HTQZYQBOSA-N 1 2 245.273 2.101 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)c(C)c1 ZINC000668186195 490336917 /nfs/dbraw/zinc/33/69/17/490336917.db2.gz DIGLKIQPUADJAB-LSDHHAIUSA-N 1 2 247.338 2.367 20 0 BEADLO CCOc1ccc(C[N@H+]2CCO[C@@H]3C[C@@H]32)c(C)c1 ZINC000668186195 490336924 /nfs/dbraw/zinc/33/69/24/490336924.db2.gz DIGLKIQPUADJAB-LSDHHAIUSA-N 1 2 247.338 2.367 20 0 BEADLO Cc1cc(NC(=O)c2ccoc2)cc[nH+]1 ZINC000073069498 490418855 /nfs/dbraw/zinc/41/88/55/490418855.db2.gz PNTBEQHEYLWIOF-UHFFFAOYSA-N 1 2 202.213 2.235 20 0 BEADLO CN(Cc1ccccc1)C(=O)CCc1c[nH+]c[nH]1 ZINC000074726851 490500335 /nfs/dbraw/zinc/50/03/35/490500335.db2.gz YAECUJXOCOZIBM-UHFFFAOYSA-N 1 2 243.310 2.001 20 0 BEADLO CN(Cc1ccccc1)C(=O)CCc1c[nH]c[nH+]1 ZINC000074726851 490500339 /nfs/dbraw/zinc/50/03/39/490500339.db2.gz YAECUJXOCOZIBM-UHFFFAOYSA-N 1 2 243.310 2.001 20 0 BEADLO CN(C(=O)CCc1c[nH+]c[nH]1)c1ccccc1 ZINC000074727061 490500959 /nfs/dbraw/zinc/50/09/59/490500959.db2.gz CARLNDSMJBQJPI-UHFFFAOYSA-N 1 2 229.283 2.005 20 0 BEADLO CN(C(=O)CCc1c[nH]c[nH+]1)c1ccccc1 ZINC000074727061 490500966 /nfs/dbraw/zinc/50/09/66/490500966.db2.gz CARLNDSMJBQJPI-UHFFFAOYSA-N 1 2 229.283 2.005 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)Nc1cccc(F)c1 ZINC000074727260 490502264 /nfs/dbraw/zinc/50/22/64/490502264.db2.gz VRPNCSIDISAMSL-UHFFFAOYSA-N 1 2 233.246 2.120 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)Nc1cccc(F)c1 ZINC000074727260 490502269 /nfs/dbraw/zinc/50/22/69/490502269.db2.gz VRPNCSIDISAMSL-UHFFFAOYSA-N 1 2 233.246 2.120 20 0 BEADLO Cc1ccc(Cl)cc1C(=O)NCc1[nH]cc[nH+]1 ZINC000128620075 490584817 /nfs/dbraw/zinc/58/48/17/490584817.db2.gz BWYBWURFJTYTBS-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO CC[C@@H](C)CNc1cccc(CC(=O)OC)[nH+]1 ZINC000191653089 491070841 /nfs/dbraw/zinc/07/08/41/491070841.db2.gz KRPMQJKZHPWGHJ-SNVBAGLBSA-N 1 2 236.315 2.255 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)Nc1nc(C2CC2)ns1 ZINC000087641226 491091246 /nfs/dbraw/zinc/09/12/46/491091246.db2.gz ORYWTYIUXVFFCY-QMMMGPOBSA-N 1 2 249.343 2.113 20 0 BEADLO COC[C@H]1CCCN1C(=O)Nc1cc[nH+]cc1C ZINC000121221309 491102319 /nfs/dbraw/zinc/10/23/19/491102319.db2.gz SCAHWMDZVVEDMM-LLVKDONJSA-N 1 2 249.314 2.033 20 0 BEADLO Cn1cc(C[NH2+]C2(C(F)F)CCCC2)cn1 ZINC000309510196 491150566 /nfs/dbraw/zinc/15/05/66/491150566.db2.gz OZXYOGDLDSWYTQ-UHFFFAOYSA-N 1 2 229.274 2.088 20 0 BEADLO COc1ccc(NCc2cccn2C)[nH+]c1 ZINC000309903011 491158001 /nfs/dbraw/zinc/15/80/01/491158001.db2.gz IRHVTAROSMQWDB-UHFFFAOYSA-N 1 2 217.272 2.041 20 0 BEADLO COC(=O)[C@H]1CCC[C@H]([NH+]2CC(C)(F)C2)CC1 ZINC001172779045 974938462 /nfs/dbraw/zinc/93/84/62/974938462.db2.gz ADVJAYVPGJIHQJ-QWRGUYRKSA-N 1 2 243.322 2.152 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493465692 533729588 /nfs/dbraw/zinc/72/95/88/533729588.db2.gz ZDIVMPFWOHVDBR-BYAJROORSA-N 1 2 247.342 2.460 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccc(OC)o2)C[C@H](C)O1 ZINC000891805165 582724366 /nfs/dbraw/zinc/72/43/66/582724366.db2.gz FBONXBLEIPRMMB-WDEREUQCSA-N 1 2 239.315 2.288 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccc(OC)o2)C[C@H](C)O1 ZINC000891805165 582724367 /nfs/dbraw/zinc/72/43/67/582724367.db2.gz FBONXBLEIPRMMB-WDEREUQCSA-N 1 2 239.315 2.288 20 0 BEADLO C[C@@]1(NC(=O)C=Cc2c[nH]c[nH+]2)CC=CCC1 ZINC000493699263 534272803 /nfs/dbraw/zinc/27/28/03/534272803.db2.gz YBRZRNOWDJTGSD-CFHLNLSMSA-N 1 2 231.299 2.038 20 0 BEADLO C[C@@H](N(C)C(=O)C=Cc1c[nH]c[nH+]1)C1(C)CC1 ZINC000493380394 534280444 /nfs/dbraw/zinc/28/04/44/534280444.db2.gz FPUZUYSNYVKSFJ-ORAHPGNNSA-N 1 2 233.315 2.070 20 0 BEADLO CCc1nc(N2C[C@@H](CC)O[C@@H](C)C2)cc(C)[nH+]1 ZINC000342228240 536126119 /nfs/dbraw/zinc/12/61/19/536126119.db2.gz WRHGWJVIIRMCJS-NWDGAFQWSA-N 1 2 249.358 2.351 20 0 BEADLO Cc1ccsc1CNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492772597 534471319 /nfs/dbraw/zinc/47/13/19/534471319.db2.gz UDXQZOUUQCAAJX-IHWYPQMZSA-N 1 2 247.323 2.109 20 0 BEADLO CCn1ccnc1C[NH2+]Cc1ccccc1OC ZINC000022864156 523539370 /nfs/dbraw/zinc/53/93/70/523539370.db2.gz NIZCRCVKTBWAOB-UHFFFAOYSA-N 1 2 245.326 2.201 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)NC12CCC(CC1)CC2 ZINC000493148124 534786181 /nfs/dbraw/zinc/78/61/81/534786181.db2.gz IVULPVKCESTNQQ-OWOJBTEDSA-N 1 2 245.326 2.262 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)N1C[C@@H]2CCCC[C@@H]2C1 ZINC000493230140 534786691 /nfs/dbraw/zinc/78/66/91/534786691.db2.gz KJWICGXAKMRQIF-MTJJXUSZSA-N 1 2 245.326 2.072 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)Nc1ccccc1 ZINC000492820777 534804781 /nfs/dbraw/zinc/80/47/81/534804781.db2.gz CCCLOOTVXNUEOS-SREVYHEPSA-N 1 2 213.240 2.062 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)Nc1cccc(F)c1 ZINC000493557206 534805221 /nfs/dbraw/zinc/80/52/21/534805221.db2.gz OTOJHAVOIUUGJY-PLNGDYQASA-N 1 2 231.230 2.201 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N[C@H]1CC12CCCCC2 ZINC000492813641 534805496 /nfs/dbraw/zinc/80/54/96/534805496.db2.gz QDSRNUJFQHVIBX-RXNFCKPNSA-N 1 2 245.326 2.262 20 0 BEADLO Cc1ccc(-c2noc([C@H]3CSC[NH2+]3)n2)cc1 ZINC000229002797 525885516 /nfs/dbraw/zinc/88/55/16/525885516.db2.gz HPCKKZXRBSIPBY-SNVBAGLBSA-N 1 2 247.323 2.380 20 0 BEADLO CN(Cc1cccc2[nH+]ccn21)CC(F)F ZINC000342639564 536477817 /nfs/dbraw/zinc/47/78/17/536477817.db2.gz UKIQETITCHNZBF-UHFFFAOYSA-N 1 2 225.242 2.031 20 0 BEADLO CC(C)(CCNC(=O)/C=C/c1[nH]cc[nH+]1)C1CC1 ZINC000493354382 527031844 /nfs/dbraw/zinc/03/18/44/527031844.db2.gz PEVVSUAKQYOXLS-AATRIKPKSA-N 1 2 247.342 2.365 20 0 BEADLO C/C=C(/C=C\C(=O)NCc1[nH+]ccn1CC)CC ZINC000493761414 527560956 /nfs/dbraw/zinc/56/09/56/527560956.db2.gz VWJIMDLHIFLLHY-GGRVGPCSSA-N 1 2 247.342 2.432 20 0 BEADLO CC(C)C(C)(C)CNC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493558921 527563052 /nfs/dbraw/zinc/56/30/52/527563052.db2.gz PZMGZRSMZPUBGN-AATRIKPKSA-N 1 2 235.331 2.221 20 0 BEADLO C/C=C/C=C/C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000493430597 527587836 /nfs/dbraw/zinc/58/78/36/527587836.db2.gz YQFJSZUQZXFCEE-MQQKCMAXSA-N 1 2 227.267 2.405 20 0 BEADLO CCC[C@@H]1CCCN(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493674992 527743084 /nfs/dbraw/zinc/74/30/84/527743084.db2.gz BEIYYISFOTVHOC-NNNHXZLVSA-N 1 2 247.342 2.462 20 0 BEADLO CC(C)CC[C@H](C)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492855528 527836350 /nfs/dbraw/zinc/83/63/50/527836350.db2.gz AFNBEJIJWIQQSY-ZADCQDASSA-N 1 2 235.331 2.364 20 0 BEADLO CC(C)CN(C(=O)/C=C/c1[nH]cc[nH+]1)C(C)C ZINC000493590926 527887721 /nfs/dbraw/zinc/88/77/21/527887721.db2.gz PQYQSMRRUDROEI-AATRIKPKSA-N 1 2 235.331 2.316 20 0 BEADLO CCCN(CC)C(=O)/C=C\c1[nH+]ccn1CC ZINC000492528697 527947280 /nfs/dbraw/zinc/94/72/80/527947280.db2.gz FTXUYYQDXRCBNK-FPLPWBNLSA-N 1 2 235.331 2.175 20 0 BEADLO CCCC1(CNC(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000493854799 528037064 /nfs/dbraw/zinc/03/70/64/528037064.db2.gz XRAGKLKTBQBMPG-ARJAWSKDSA-N 1 2 233.315 2.119 20 0 BEADLO CC(C)c1cc(NCc2ccc(N)[nH+]c2)ncn1 ZINC000308379137 528050889 /nfs/dbraw/zinc/05/08/89/528050889.db2.gz QZGFYHQRRJKQKJ-UHFFFAOYSA-N 1 2 243.314 2.189 20 0 BEADLO CCN(CC1CCC1)C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493729744 528336395 /nfs/dbraw/zinc/33/63/95/528336395.db2.gz ULGVJMQFIKUSRT-VOTSOKGWSA-N 1 2 233.315 2.072 20 0 BEADLO CCC[C@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493613343 528369864 /nfs/dbraw/zinc/36/98/64/528369864.db2.gz OTVLDZVOARSDRI-SYTKJHMZSA-N 1 2 247.342 2.462 20 0 BEADLO CC(C)C[C@@H]1CCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492979822 528382507 /nfs/dbraw/zinc/38/25/07/528382507.db2.gz FZSAMCMQTMQCBE-MVZIDQBPSA-N 1 2 247.342 2.318 20 0 BEADLO CCO/C=C\C(=O)Nc1c(C)cc[nH+]c1C ZINC000493098719 528538562 /nfs/dbraw/zinc/53/85/62/528538562.db2.gz SDGVQLLPATYBPK-VURMDHGXSA-N 1 2 220.272 2.187 20 0 BEADLO CC(C)N(C(=O)C=Cc1c[nH]c[nH+]1)C1CCC1 ZINC000492772546 528765898 /nfs/dbraw/zinc/76/58/98/528765898.db2.gz SYSGPNYQIWBDRZ-SREVYHEPSA-N 1 2 233.315 2.212 20 0 BEADLO CCN(C(=O)/C=C/c1[nH]cc[nH+]1)C1CC(C)(C)C1 ZINC000493563691 528908267 /nfs/dbraw/zinc/90/82/67/528908267.db2.gz WOCLSAFRKWBCHE-AATRIKPKSA-N 1 2 247.342 2.460 20 0 BEADLO CC1(C)CCCCN(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493269307 528910204 /nfs/dbraw/zinc/91/02/04/528910204.db2.gz QDQKABUQKLQWKQ-AATRIKPKSA-N 1 2 247.342 2.462 20 0 BEADLO CC1(C)CCCN(C(=O)/C=C\c2[nH]cc[nH+]2)CC1 ZINC000493807642 528923787 /nfs/dbraw/zinc/92/37/87/528923787.db2.gz DSRAEVWGYDGHHJ-PLNGDYQASA-N 1 2 247.342 2.462 20 0 BEADLO CC1(C)CCC[C@@H]1NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493416393 528965550 /nfs/dbraw/zinc/96/55/50/528965550.db2.gz IBHUPKOWWXOMFG-PORFMDCZSA-N 1 2 233.315 2.118 20 0 BEADLO CCC1(CC)CN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493803233 529060155 /nfs/dbraw/zinc/06/01/55/529060155.db2.gz NSQLEWWZNQBTLK-WAYWQWQTSA-N 1 2 233.315 2.072 20 0 BEADLO CC[C@@H]1CCCCN1C(=O)/C=C\c1[nH]cc[nH+]1 ZINC000493391797 529268123 /nfs/dbraw/zinc/26/81/23/529268123.db2.gz AISQUFPRUFYAJY-JMEBYUIHSA-N 1 2 233.315 2.214 20 0 BEADLO CC[C@@H](C)CN(CC)C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493203902 529314964 /nfs/dbraw/zinc/31/49/64/529314964.db2.gz SSRWSOKRCDYLCI-XUIVZRPNSA-N 1 2 235.331 2.318 20 0 BEADLO CC[C@@H]1CCC[C@H]1CNC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493364236 529318721 /nfs/dbraw/zinc/31/87/21/529318721.db2.gz ZVPWVDBUPMTBTO-JIVBQCDMSA-N 1 2 247.342 2.365 20 0 BEADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2cccnc2)o1 ZINC000182883011 534988033 /nfs/dbraw/zinc/98/80/33/534988033.db2.gz ILTPBKMVQHSMAP-JTQLQIEISA-N 1 2 246.314 2.439 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CCOC3(CCC3)C2)cn1 ZINC000179886309 535060119 /nfs/dbraw/zinc/06/01/19/535060119.db2.gz UXJCZEJXJKVJPQ-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO CC(C)n1cc(C[N@H+]2CCOC3(CCC3)C2)cn1 ZINC000179886309 535060127 /nfs/dbraw/zinc/06/01/27/535060127.db2.gz UXJCZEJXJKVJPQ-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO CC(C)C[N@@H+]1CC(=O)N[C@]12CC[C@H](C)[C@@H](C)C2 ZINC000342444548 535066112 /nfs/dbraw/zinc/06/61/12/535066112.db2.gz CLYLHERAHOUFEI-SGMGOOAPSA-N 1 2 238.375 2.227 20 0 BEADLO CC(C)C[N@H+]1CC(=O)N[C@]12CC[C@H](C)[C@@H](C)C2 ZINC000342444548 535066115 /nfs/dbraw/zinc/06/61/15/535066115.db2.gz CLYLHERAHOUFEI-SGMGOOAPSA-N 1 2 238.375 2.227 20 0 BEADLO CCC1(C(=O)NCc2c[nH+]ccc2OC)CCC1 ZINC000348238510 535251345 /nfs/dbraw/zinc/25/13/45/535251345.db2.gz BZORFLQPLQTGBW-UHFFFAOYSA-N 1 2 248.326 2.287 20 0 BEADLO CCOC(=O)c1c(C)onc1C[NH+](CC)CC ZINC000351332611 535674388 /nfs/dbraw/zinc/67/43/88/535674388.db2.gz ALNRYXNEDZYJIL-UHFFFAOYSA-N 1 2 240.303 2.002 20 0 BEADLO CCN(CC)c1ccc(Nc2ncccn2)c[nH+]1 ZINC000067447601 535689802 /nfs/dbraw/zinc/68/98/02/535689802.db2.gz ZIWDBRLRFCEVQF-UHFFFAOYSA-N 1 2 243.314 2.461 20 0 BEADLO CCc1nnc([C@@H](C)[N@@H+]2CC[C@](C)(F)C2)o1 ZINC000335354770 535857556 /nfs/dbraw/zinc/85/75/56/535857556.db2.gz HFADDQWWQDUXCT-KCJUWKMLSA-N 1 2 227.283 2.127 20 0 BEADLO CCc1nnc([C@@H](C)[N@H+]2CC[C@](C)(F)C2)o1 ZINC000335354770 535857557 /nfs/dbraw/zinc/85/75/57/535857557.db2.gz HFADDQWWQDUXCT-KCJUWKMLSA-N 1 2 227.283 2.127 20 0 BEADLO CC[C@@]1(C)CN(c2cccc[nH+]2)CCO1 ZINC000276035493 536060349 /nfs/dbraw/zinc/06/03/49/536060349.db2.gz MPYJJJNTQWMWSX-LBPRGKRZSA-N 1 2 206.289 2.087 20 0 BEADLO CCc1nc(N2C[C@H](C)OC[C@@H]2CC)cc(C)[nH+]1 ZINC000287802645 536126839 /nfs/dbraw/zinc/12/68/39/536126839.db2.gz JUTAMUFAXBLPEZ-RYUDHWBXSA-N 1 2 249.358 2.351 20 0 BEADLO CN(c1cc(N2CCCCC2)[nH+]cn1)C1CCC1 ZINC000267524400 536488090 /nfs/dbraw/zinc/48/80/90/536488090.db2.gz NIRRRELJWKTOMK-UHFFFAOYSA-N 1 2 246.358 2.456 20 0 BEADLO CN(c1cc(N2CCCCC2)nc[nH+]1)C1CCC1 ZINC000267524400 536488091 /nfs/dbraw/zinc/48/80/91/536488091.db2.gz NIRRRELJWKTOMK-UHFFFAOYSA-N 1 2 246.358 2.456 20 0 BEADLO COC1(C)CCN(c2nc(C)[nH+]c(C)c2C)CC1 ZINC000340905797 536567895 /nfs/dbraw/zinc/56/78/95/536567895.db2.gz VYJOEOZZNXPKFA-UHFFFAOYSA-N 1 2 249.358 2.407 20 0 BEADLO Cc1ccoc1C[N@H+]1CCCc2[nH]ncc2C1 ZINC000668840697 566330753 /nfs/dbraw/zinc/33/07/53/566330753.db2.gz ICZIWDVZEYOAMK-UHFFFAOYSA-N 1 2 231.299 2.260 20 0 BEADLO Cc1ccoc1C[N@@H+]1CCCc2[nH]ncc2C1 ZINC000668840697 566330749 /nfs/dbraw/zinc/33/07/49/566330749.db2.gz ICZIWDVZEYOAMK-UHFFFAOYSA-N 1 2 231.299 2.260 20 0 BEADLO COC(=O)c1sccc1C[N@@H+]1C[C@H](C)[C@@H]1C ZINC000339582865 566373531 /nfs/dbraw/zinc/37/35/31/566373531.db2.gz RZDSGDIQQOUORC-IUCAKERBSA-N 1 2 239.340 2.375 20 0 BEADLO COC(=O)c1sccc1C[N@H+]1C[C@H](C)[C@@H]1C ZINC000339582865 566373534 /nfs/dbraw/zinc/37/35/34/566373534.db2.gz RZDSGDIQQOUORC-IUCAKERBSA-N 1 2 239.340 2.375 20 0 BEADLO CCc1cc(N[C@@H](C)[C@@H](C)OC)nc(CC)[nH+]1 ZINC000893409967 583138947 /nfs/dbraw/zinc/13/89/47/583138947.db2.gz XZWOKVLXFYUDKF-VHSXEESVSA-N 1 2 237.347 2.437 20 0 BEADLO CCc1cc(NCCC[C@@H](C)O)nc(CC)[nH+]1 ZINC000893562336 583164211 /nfs/dbraw/zinc/16/42/11/583164211.db2.gz SLAHHMDCELAHPB-SNVBAGLBSA-N 1 2 237.347 2.174 20 0 BEADLO Cc1[nH]nc(C[NH+]2CCCCCC2)c1C ZINC000893870819 583235591 /nfs/dbraw/zinc/23/55/91/583235591.db2.gz HVHJOSCVLMIWJJ-UHFFFAOYSA-N 1 2 207.321 2.403 20 0 BEADLO CCCC[N@H+](C)Cc1ncc(C(=O)OC)s1 ZINC000893872319 583238026 /nfs/dbraw/zinc/23/80/26/583238026.db2.gz QTZQKSOYRWGFIQ-UHFFFAOYSA-N 1 2 242.344 2.162 20 0 BEADLO CCCC[N@@H+](C)Cc1ncc(C(=O)OC)s1 ZINC000893872319 583238029 /nfs/dbraw/zinc/23/80/29/583238029.db2.gz QTZQKSOYRWGFIQ-UHFFFAOYSA-N 1 2 242.344 2.162 20 0 BEADLO CCCSC[C@@H](C)[NH2+][C@@H](C)C(=O)OCC ZINC000893951624 583260072 /nfs/dbraw/zinc/26/00/72/583260072.db2.gz XJRLKPZSIGZJJB-ZJUUUORDSA-N 1 2 233.377 2.059 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2C[C@H](C)C[C@H]2C)c1C ZINC000894046353 583287255 /nfs/dbraw/zinc/28/72/55/583287255.db2.gz WGFYIVZTWBBUQV-RKDXNWHRSA-N 1 2 207.321 2.257 20 0 BEADLO Cc1[nH]nc(C[N@H+]2C[C@H](C)C[C@H]2C)c1C ZINC000894046353 583287258 /nfs/dbraw/zinc/28/72/58/583287258.db2.gz WGFYIVZTWBBUQV-RKDXNWHRSA-N 1 2 207.321 2.257 20 0 BEADLO CC(C)Cn1cc[nH+]c1CNc1cnc(F)cn1 ZINC000853373737 588738779 /nfs/dbraw/zinc/73/87/79/588738779.db2.gz LXSRVSQRDOGHPQ-UHFFFAOYSA-N 1 2 249.293 2.080 20 0 BEADLO CCCC[NH+](CCCC)Cn1nc(C)oc1=O ZINC000853489915 588745539 /nfs/dbraw/zinc/74/55/39/588745539.db2.gz XGMFENZFRQAUBX-UHFFFAOYSA-N 1 2 241.335 2.004 20 0 BEADLO CC1(C)C[C@@H](O[NH+]=C(N)Cc2ccccc2)CO1 ZINC000853656250 588752669 /nfs/dbraw/zinc/75/26/69/588752669.db2.gz WGYYOPRTBSYQPU-GFCCVEGCSA-N 1 2 248.326 2.295 20 0 BEADLO CC(C)OCC(N)=[NH+]OCC12CCC(CC1)C2 ZINC000853657370 588752971 /nfs/dbraw/zinc/75/29/71/588752971.db2.gz AQFOARAEFHCNLZ-UHFFFAOYSA-N 1 2 240.347 2.490 20 0 BEADLO CC1=NO[C@@H](CNc2cc[nH+]c(C(C)C)n2)C1 ZINC000853660617 588753617 /nfs/dbraw/zinc/75/36/17/588753617.db2.gz IFSAFRLBAMTFSI-SNVBAGLBSA-N 1 2 234.303 2.177 20 0 BEADLO CC1=NO[C@H](CNc2cc(C)[nH+]c(C3CC3)n2)C1 ZINC000853661301 588753710 /nfs/dbraw/zinc/75/37/10/588753710.db2.gz SUFQPQNEIFPYPT-NSHDSACASA-N 1 2 246.314 2.239 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)Nc1cnc(F)cn1 ZINC000853668779 588753999 /nfs/dbraw/zinc/75/39/99/588753999.db2.gz ZQBWWRHECYZMOZ-MRVPVSSYSA-N 1 2 235.266 2.005 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OC[C@H]1CCCC[C@H]1C ZINC000853673127 588754666 /nfs/dbraw/zinc/75/46/66/588754666.db2.gz AZPKVQMZYSLDPB-GMTAPVOTSA-N 1 2 228.336 2.346 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OCC12CCC(CC1)C2 ZINC000853674453 588755003 /nfs/dbraw/zinc/75/50/03/588755003.db2.gz ZIWIYCGIKZCLTL-GRZMOONWSA-N 1 2 226.320 2.100 20 0 BEADLO NC(Cc1cccnc1)=[NH+]OCCC1CCC1 ZINC000853678716 588755106 /nfs/dbraw/zinc/75/51/06/588755106.db2.gz NDAZLXGPRZFZFU-UHFFFAOYSA-N 1 2 233.315 2.313 20 0 BEADLO CCC(CC)CO[NH+]=C(N)[C@H]1CCCO1 ZINC000853698081 588757601 /nfs/dbraw/zinc/75/76/01/588757601.db2.gz MNWMOBFRGAQZLS-SNVBAGLBSA-N 1 2 214.309 2.100 20 0 BEADLO Cc1c[nH+]c(CCNc2cnc(F)cn2)c(C)c1 ZINC000853715204 588758733 /nfs/dbraw/zinc/75/87/33/588758733.db2.gz HOLLTNVWOXAODW-UHFFFAOYSA-N 1 2 246.289 2.282 20 0 BEADLO C1=C[C@@H](Nc2cc[nH+]c(C3CC3)n2)CC1 ZINC000853800347 588764032 /nfs/dbraw/zinc/76/40/32/588764032.db2.gz CZZPVTJUOVFVAW-SNVBAGLBSA-N 1 2 201.273 2.485 20 0 BEADLO CC(C)c1nc(N(C)C)nc(N[C@@H]2C=CCC2)[nH+]1 ZINC000853799949 588764058 /nfs/dbraw/zinc/76/40/58/588764058.db2.gz NCXYJHSEWBZHAT-SNVBAGLBSA-N 1 2 247.346 2.192 20 0 BEADLO CC(C)c1nc(N[C@@H]2C=CCC2)nc(N(C)C)[nH+]1 ZINC000853799949 588764059 /nfs/dbraw/zinc/76/40/59/588764059.db2.gz NCXYJHSEWBZHAT-SNVBAGLBSA-N 1 2 247.346 2.192 20 0 BEADLO CC(C)c1nc(N[C@@H](C)C2(CO)CC2)cc[nH+]1 ZINC000853803842 588764312 /nfs/dbraw/zinc/76/43/12/588764312.db2.gz LJVXUQKSRYXTAS-JTQLQIEISA-N 1 2 235.331 2.173 20 0 BEADLO CC(C)c1nc(N2C[C@H](C)C(O)[C@@H](C)C2)cc[nH+]1 ZINC000853833670 588765178 /nfs/dbraw/zinc/76/51/78/588765178.db2.gz KKDQVBCPOJJASI-QWRGUYRKSA-N 1 2 249.358 2.053 20 0 BEADLO CC(C)c1nc(N2C[C@@H]3COC[C@]3(C)C2)cc[nH+]1 ZINC000853858487 588766388 /nfs/dbraw/zinc/76/63/88/588766388.db2.gz MYFJOGWHVCZDSN-RISCZKNCSA-N 1 2 247.342 2.073 20 0 BEADLO CC(C)c1nc(N2CC[C@@H]3COC[C@@H]3C2)cc[nH+]1 ZINC000853934489 588769591 /nfs/dbraw/zinc/76/95/91/588769591.db2.gz RHJDKORWFYMUHZ-NEPJUHHUSA-N 1 2 247.342 2.073 20 0 BEADLO CC(C)c1nc(N2C[C@H](C)[C@@](C)(CO)C2)cc[nH+]1 ZINC000853965218 588770521 /nfs/dbraw/zinc/77/05/21/588770521.db2.gz VMHVZRTVSCWFEG-SMDDNHRTSA-N 1 2 249.358 2.055 20 0 BEADLO CCC[C@@H](C)c1noc([C@@H]([NH3+])COC(C)C)n1 ZINC000854138348 588774952 /nfs/dbraw/zinc/77/49/52/588774952.db2.gz HIELBQXGUPQPDZ-ZJUUUORDSA-N 1 2 241.335 2.398 20 0 BEADLO CC[NH2+]Cc1noc([C@@H](C)Cc2ccco2)n1 ZINC000854132062 588775727 /nfs/dbraw/zinc/77/57/27/588775727.db2.gz JTVDDLZMVZIQOX-VIFPVBQESA-N 1 2 235.287 2.118 20 0 BEADLO CC[NH2+]Cc1noc(/C=C(/C)c2ccco2)n1 ZINC000854132003 588775787 /nfs/dbraw/zinc/77/57/87/588775787.db2.gz HAEQHYXJWMORCV-CLFYSBASSA-N 1 2 233.271 2.333 20 0 BEADLO Nc1cccc(C[NH2+][C@@H]2CCCc3[nH]ncc32)c1 ZINC000854215795 588779674 /nfs/dbraw/zinc/77/96/74/588779674.db2.gz NMKKPKFQXGCZQW-CYBMUJFWSA-N 1 2 242.326 2.159 20 0 BEADLO CC1=CC[C@@](C)(C(=O)NC2=[NH+]CCS2)CC1 ZINC000854292456 588782649 /nfs/dbraw/zinc/78/26/49/588782649.db2.gz FNSMTJWTAHSPMH-GFCCVEGCSA-N 1 2 238.356 2.342 20 0 BEADLO Cc1cc(C)cc(CC(=O)NC2=[NH+]CCS2)c1 ZINC000854292176 588782701 /nfs/dbraw/zinc/78/27/01/588782701.db2.gz DFMVMOMFTZYSQX-UHFFFAOYSA-N 1 2 248.351 2.065 20 0 BEADLO CCC(F)(F)C(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000854845195 588813004 /nfs/dbraw/zinc/81/30/04/588813004.db2.gz KTHNYJNUVIFKCR-YUMQZZPRSA-N 1 2 243.257 2.050 20 0 BEADLO C[C@H](NC(=O)Cc1[nH]cc[nH+]1)[C@H]1CCC[C@H](C)C1 ZINC000854895538 588815646 /nfs/dbraw/zinc/81/56/46/588815646.db2.gz WQNUPGZMPUDOAV-SRVKXCTJSA-N 1 2 249.358 2.283 20 0 BEADLO CCC(=CC(=O)N(C)Cc1c[nH+]c[nH]1)CC ZINC000855134166 588822681 /nfs/dbraw/zinc/82/26/81/588822681.db2.gz HLRCMQKKSCJBGA-UHFFFAOYSA-N 1 2 221.304 2.115 20 0 BEADLO CCC(=CC(=O)N(C)Cc1c[nH]c[nH+]1)CC ZINC000855134166 588822682 /nfs/dbraw/zinc/82/26/82/588822682.db2.gz HLRCMQKKSCJBGA-UHFFFAOYSA-N 1 2 221.304 2.115 20 0 BEADLO CC(C(=O)N(C)Cc1c[nH+]c[nH]1)=C1CCCC1 ZINC000855134485 588822911 /nfs/dbraw/zinc/82/29/11/588822911.db2.gz PNQAHOKTTLYHJX-UHFFFAOYSA-N 1 2 233.315 2.259 20 0 BEADLO CC(C(=O)N(C)Cc1c[nH]c[nH+]1)=C1CCCC1 ZINC000855134485 588822912 /nfs/dbraw/zinc/82/29/12/588822912.db2.gz PNQAHOKTTLYHJX-UHFFFAOYSA-N 1 2 233.315 2.259 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N[C@H]3C=CCC3)ccn12 ZINC000855434812 588836180 /nfs/dbraw/zinc/83/61/80/588836180.db2.gz QOQAPSOOAYDWFN-LBPRGKRZSA-N 1 2 241.294 2.091 20 0 BEADLO C/C=C(\C)C(=O)NCc1c(C)[nH+]c2ccccn21 ZINC000890853963 582581092 /nfs/dbraw/zinc/58/10/92/582581092.db2.gz XAVQRALISDRLEA-ONNFQVAWSA-N 1 2 243.310 2.225 20 0 BEADLO FC(F)C[NH2+]Cc1ccc(Cl)nc1 ZINC000113351045 588837472 /nfs/dbraw/zinc/83/74/72/588837472.db2.gz QDQGMLOVCICKPV-UHFFFAOYSA-N 1 2 206.623 2.090 20 0 BEADLO C[C@H](CC(=O)OC[C@]1(C)C[C@@H]1F)n1cc[nH+]c1 ZINC000845611852 582615727 /nfs/dbraw/zinc/61/57/27/582615727.db2.gz QOCKYPURTHQPPO-SCVCMEIPSA-N 1 2 240.278 2.126 20 0 BEADLO CC1(C)C(C)(C)C1(C)NC(=O)CCc1c[nH+]c[nH]1 ZINC000891162719 582617648 /nfs/dbraw/zinc/61/76/48/582617648.db2.gz MRZYWHISYPRRDL-UHFFFAOYSA-N 1 2 249.358 2.283 20 0 BEADLO CC1(C)C(C)(C)C1(C)NC(=O)CCc1c[nH]c[nH+]1 ZINC000891162719 582617650 /nfs/dbraw/zinc/61/76/50/582617650.db2.gz MRZYWHISYPRRDL-UHFFFAOYSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@H]1CCCCN1c1nccn2c[nH+]cc12 ZINC000891395039 582676927 /nfs/dbraw/zinc/67/69/27/582676927.db2.gz UWTMGXQSMJOPSF-NSHDSACASA-N 1 2 230.315 2.498 20 0 BEADLO C[C@@H](O)c1cccc(NCCc2ccccn2)[nH+]1 ZINC000891427166 582682483 /nfs/dbraw/zinc/68/24/83/582682483.db2.gz RJBHNBGVINWRPV-LLVKDONJSA-N 1 2 243.310 2.185 20 0 BEADLO C[C@@H](O)CNc1cc(C2CC2)[nH+]c(C2CC2)n1 ZINC000891437932 582685265 /nfs/dbraw/zinc/68/52/65/582685265.db2.gz YQKARNATXFQMPJ-MRVPVSSYSA-N 1 2 233.315 2.024 20 0 BEADLO CCn1cc(C[N@H+](C)Cc2ccco2)c(C)n1 ZINC000891486551 582692516 /nfs/dbraw/zinc/69/25/16/582692516.db2.gz BAWPQRFEADUOJP-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CCn1cc(C[N@@H+](C)Cc2ccco2)c(C)n1 ZINC000891486551 582692518 /nfs/dbraw/zinc/69/25/18/582692518.db2.gz BAWPQRFEADUOJP-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO c1cn(-c2cc(C3CC3)nc(C3CC3)n2)c[nH+]1 ZINC000891547969 582695846 /nfs/dbraw/zinc/69/58/46/582695846.db2.gz TZVORCIMSRQRNJ-UHFFFAOYSA-N 1 2 226.283 2.417 20 0 BEADLO Cc1cc(CN(C)Cc2[nH+]ccn2C2CC2)no1 ZINC000891671178 582708333 /nfs/dbraw/zinc/70/83/33/582708333.db2.gz MHHDBRWCQTVFEO-UHFFFAOYSA-N 1 2 246.314 2.146 20 0 BEADLO CCc1cc(N2CCO[C@@H](CC)C2)nc(CC)[nH+]1 ZINC000891684796 582709670 /nfs/dbraw/zinc/70/96/70/582709670.db2.gz XICPZDYOINUCKT-LBPRGKRZSA-N 1 2 249.358 2.217 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1cnn(C2CCC2)c1 ZINC000891715810 582712806 /nfs/dbraw/zinc/71/28/06/582712806.db2.gz HBFYVTSAANDRKY-CYBMUJFWSA-N 1 2 249.358 2.219 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1cnn(C2CCC2)c1 ZINC000891715810 582712807 /nfs/dbraw/zinc/71/28/07/582712807.db2.gz HBFYVTSAANDRKY-CYBMUJFWSA-N 1 2 249.358 2.219 20 0 BEADLO CC[C@H]1CN(Cc2[nH+]ccn2C2CC2)C[C@H](C)O1 ZINC000891805450 582724547 /nfs/dbraw/zinc/72/45/47/582724547.db2.gz JGLURSIBERDGOX-AAEUAGOBSA-N 1 2 249.358 2.217 20 0 BEADLO CCc1cc(Nc2cnn(C)c2)nc(CC)[nH+]1 ZINC000891911056 582736339 /nfs/dbraw/zinc/73/63/39/582736339.db2.gz MSMBTHXWVUVUPG-UHFFFAOYSA-N 1 2 231.303 2.079 20 0 BEADLO COCCN(C)c1ccc2ccc(OC)cc2[nH+]1 ZINC000891940972 582741913 /nfs/dbraw/zinc/74/19/13/582741913.db2.gz QFMWYKVJAYZCCM-UHFFFAOYSA-N 1 2 246.310 2.326 20 0 BEADLO CNc1cc(NCc2ccoc2C)nc[nH+]1 ZINC000891965903 582749186 /nfs/dbraw/zinc/74/91/86/582749186.db2.gz WRQBQKVICGCLCB-UHFFFAOYSA-N 1 2 218.260 2.032 20 0 BEADLO CNc1cc(NCc2ccoc2C)[nH+]cn1 ZINC000891965903 582749187 /nfs/dbraw/zinc/74/91/87/582749187.db2.gz WRQBQKVICGCLCB-UHFFFAOYSA-N 1 2 218.260 2.032 20 0 BEADLO C[C@@H](O)c1cccc(NC[C@@H]2CCCCO2)[nH+]1 ZINC000892003047 582758784 /nfs/dbraw/zinc/75/87/84/582758784.db2.gz YCPLBXQMHYRCRP-MNOVXSKESA-N 1 2 236.315 2.116 20 0 BEADLO C[C@@H](O)c1cccc(NC[C@H]2CCCCO2)[nH+]1 ZINC000892003046 582758801 /nfs/dbraw/zinc/75/88/01/582758801.db2.gz YCPLBXQMHYRCRP-GHMZBOCLSA-N 1 2 236.315 2.116 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2ccnn2C2CCC2)[C@H]1C ZINC000892050516 582775959 /nfs/dbraw/zinc/77/59/59/582775959.db2.gz ZMJQQUKSARFGGG-NWDGAFQWSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2ccnn2C2CCC2)[C@H]1C ZINC000892050516 582775960 /nfs/dbraw/zinc/77/59/60/582775960.db2.gz ZMJQQUKSARFGGG-NWDGAFQWSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2ccnn2C2CCC2)[C@@H]1C ZINC000892050518 582776152 /nfs/dbraw/zinc/77/61/52/582776152.db2.gz ZMJQQUKSARFGGG-VXGBXAGGSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2ccnn2C2CCC2)[C@@H]1C ZINC000892050518 582776154 /nfs/dbraw/zinc/77/61/54/582776154.db2.gz ZMJQQUKSARFGGG-VXGBXAGGSA-N 1 2 249.358 2.217 20 0 BEADLO CC(C)CCCC[N@H+](C)Cc1nnc[nH]1 ZINC000892073338 582786338 /nfs/dbraw/zinc/78/63/38/582786338.db2.gz MFTMZWZCYUGFOT-UHFFFAOYSA-N 1 2 210.325 2.063 20 0 BEADLO CC(C)CCCC[N@@H+](C)Cc1nnc[nH]1 ZINC000892073338 582786339 /nfs/dbraw/zinc/78/63/39/582786339.db2.gz MFTMZWZCYUGFOT-UHFFFAOYSA-N 1 2 210.325 2.063 20 0 BEADLO CO[C@H](C)CC(=O)Nc1c[nH+]c2c(C)cccn12 ZINC000855903368 588853359 /nfs/dbraw/zinc/85/33/59/588853359.db2.gz YZWQCFSGLLWTTI-SNVBAGLBSA-N 1 2 247.298 2.006 20 0 BEADLO Cc1noc(C)c1[C@H](C)[NH2+][C@@H](C)c1nccn1C ZINC000092326935 582855079 /nfs/dbraw/zinc/85/50/79/582855079.db2.gz VHPZNLYAJWNWCF-WPRPVWTQSA-N 1 2 248.330 2.437 20 0 BEADLO C[C@H]1CCC[C@@H]1Nc1cc(N(C)C)nc[nH+]1 ZINC000892341667 582861790 /nfs/dbraw/zinc/86/17/90/582861790.db2.gz DFKQYGBMYARQCB-UWVGGRQHSA-N 1 2 220.320 2.143 20 0 BEADLO C[C@H]1CCC[C@@H]1Nc1cc(N(C)C)[nH+]cn1 ZINC000892341667 582861791 /nfs/dbraw/zinc/86/17/91/582861791.db2.gz DFKQYGBMYARQCB-UWVGGRQHSA-N 1 2 220.320 2.143 20 0 BEADLO CCc1cc(C[NH2+]Cc2c(C)noc2CC)on1 ZINC000892396592 582875490 /nfs/dbraw/zinc/87/54/90/582875490.db2.gz CSJVRMSHISQFHK-UHFFFAOYSA-N 1 2 249.314 2.386 20 0 BEADLO CCc1nnc(C[N@@H+]2CC[C@H]2C(C)C)s1 ZINC000892403069 582876929 /nfs/dbraw/zinc/87/69/29/582876929.db2.gz JXFNFFBJLAZLHE-VIFPVBQESA-N 1 2 225.361 2.331 20 0 BEADLO CCc1nnc(C[N@H+]2CC[C@H]2C(C)C)s1 ZINC000892403069 582876931 /nfs/dbraw/zinc/87/69/31/582876931.db2.gz JXFNFFBJLAZLHE-VIFPVBQESA-N 1 2 225.361 2.331 20 0 BEADLO CO[C@@H](C)CC(=O)Nc1ccn2cc(C)[nH+]c2c1 ZINC000856288738 588867513 /nfs/dbraw/zinc/86/75/13/588867513.db2.gz XOGGULMFWBXLTB-JTQLQIEISA-N 1 2 247.298 2.006 20 0 BEADLO CCC[NH2+]Cc1ncc(Br)cc1O ZINC000892443159 582888126 /nfs/dbraw/zinc/88/81/26/582888126.db2.gz BDRDDOHVSOSVBE-UHFFFAOYSA-N 1 2 245.120 2.049 20 0 BEADLO CCCC[C@H](COC)Nc1cc(NC)[nH+]cn1 ZINC000892602876 582926032 /nfs/dbraw/zinc/92/60/32/582926032.db2.gz GQNQEPUYZQMOLO-SNVBAGLBSA-N 1 2 238.335 2.135 20 0 BEADLO CCCC[C@H](COC)Nc1cc(NC)nc[nH+]1 ZINC000892602876 582926035 /nfs/dbraw/zinc/92/60/35/582926035.db2.gz GQNQEPUYZQMOLO-SNVBAGLBSA-N 1 2 238.335 2.135 20 0 BEADLO Cc1cc(N[C@@H](C)CCO)nc(C2CCC2)[nH+]1 ZINC000892617108 582930934 /nfs/dbraw/zinc/93/09/34/582930934.db2.gz RLRYUDRZSHMJIB-VIFPVBQESA-N 1 2 235.331 2.235 20 0 BEADLO CCc1cc(N[C@H](CC)CCO)nc(CC)[nH+]1 ZINC000892651167 582939821 /nfs/dbraw/zinc/93/98/21/582939821.db2.gz VNDQSVYWMPQTQN-SNVBAGLBSA-N 1 2 237.347 2.174 20 0 BEADLO COc1ccc(C[NH2+]Cc2c(C)noc2C)o1 ZINC000892673639 582948497 /nfs/dbraw/zinc/94/84/97/582948497.db2.gz IIPGBZIJFIKBTE-UHFFFAOYSA-N 1 2 236.271 2.183 20 0 BEADLO C[C@@H](NC(=O)/C=C1/CC[C@@H](C)C1)c1[nH+]ccn1C ZINC000856277649 588866599 /nfs/dbraw/zinc/86/65/99/588866599.db2.gz NMWHNVJKXOHBBA-ZQKHDVBCSA-N 1 2 247.342 2.344 20 0 BEADLO CCC(=CC(=O)N[C@@H](C)c1[nH+]ccn1C)CC ZINC000856278096 588866731 /nfs/dbraw/zinc/86/67/31/588866731.db2.gz XOTCFWYFJHHQOA-JTQLQIEISA-N 1 2 235.331 2.344 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2cnon2)cc1 ZINC000851893899 582977713 /nfs/dbraw/zinc/97/77/13/582977713.db2.gz MVWDZKVGNVCIOG-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO Cc1cc(N2CC[C@@](C)(O)C2)nc(C2CCC2)[nH+]1 ZINC000892807047 582986255 /nfs/dbraw/zinc/98/62/55/582986255.db2.gz PTOYAEOIKSRENE-CQSZACIVSA-N 1 2 247.342 2.014 20 0 BEADLO Cc1cc(C)cc(C[N@H+](C)Cc2cnon2)c1 ZINC000851988938 582990193 /nfs/dbraw/zinc/99/01/93/582990193.db2.gz QMELFIHAOOULLT-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cc(C)cc(C[N@@H+](C)Cc2cnon2)c1 ZINC000851988938 582990195 /nfs/dbraw/zinc/99/01/95/582990195.db2.gz QMELFIHAOOULLT-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CCC1(CNc2cc(N(C)C)nc[nH+]2)CC1 ZINC000892844811 582994617 /nfs/dbraw/zinc/99/46/17/582994617.db2.gz LUDHWDMBUBULLN-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO CCC1(CNc2cc(N(C)C)[nH+]cn2)CC1 ZINC000892844811 582994619 /nfs/dbraw/zinc/99/46/19/582994619.db2.gz LUDHWDMBUBULLN-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO Cc1cc(N(CCO)C(C)C)nc(C2CCC2)[nH+]1 ZINC000892877890 583001644 /nfs/dbraw/zinc/00/16/44/583001644.db2.gz HDADPCULPJTMFH-UHFFFAOYSA-N 1 2 249.358 2.260 20 0 BEADLO CN(C)c1cc(N[C@@H]2CCC(F)(F)C2)[nH+]cn1 ZINC000892938329 583012933 /nfs/dbraw/zinc/01/29/33/583012933.db2.gz LKJVOABMLDPNSW-MRVPVSSYSA-N 1 2 242.273 2.142 20 0 BEADLO CN(C)c1cc(N[C@@H]2CCC(F)(F)C2)nc[nH+]1 ZINC000892938329 583012935 /nfs/dbraw/zinc/01/29/35/583012935.db2.gz LKJVOABMLDPNSW-MRVPVSSYSA-N 1 2 242.273 2.142 20 0 BEADLO Cc1c[nH+]ccc1CCNc1nccnc1Cl ZINC000892977470 583024639 /nfs/dbraw/zinc/02/46/39/583024639.db2.gz OCYUQLSCVCTKPZ-UHFFFAOYSA-N 1 2 248.717 2.488 20 0 BEADLO C[C@H](Nc1cc(N(C)C)nc[nH+]1)c1ccc[nH]1 ZINC000893020581 583031306 /nfs/dbraw/zinc/03/13/06/583031306.db2.gz ATFLTAITFVFUBJ-VIFPVBQESA-N 1 2 231.303 2.044 20 0 BEADLO C[C@H](Nc1cc(N(C)C)[nH+]cn1)c1ccc[nH]1 ZINC000893020581 583031307 /nfs/dbraw/zinc/03/13/07/583031307.db2.gz ATFLTAITFVFUBJ-VIFPVBQESA-N 1 2 231.303 2.044 20 0 BEADLO COCCOC[C@H](C)Nc1ccc(C)[nH+]c1C ZINC000893197616 583068894 /nfs/dbraw/zinc/06/88/94/583068894.db2.gz HYBVRYJKZFJFRF-NSHDSACASA-N 1 2 238.331 2.162 20 0 BEADLO C[C@H]1CCCCN(c2nccn3c[nH+]cc23)C1 ZINC000893245797 583077594 /nfs/dbraw/zinc/07/75/94/583077594.db2.gz SVFUYHJIZVABLH-NSHDSACASA-N 1 2 230.315 2.356 20 0 BEADLO CC(C)c1cnc(C[N@@H+]2CCOCC[C@@H]2C)o1 ZINC000775569942 583093864 /nfs/dbraw/zinc/09/38/64/583093864.db2.gz JWCGMULSMFKDGK-NSHDSACASA-N 1 2 238.331 2.409 20 0 BEADLO CC(C)c1cnc(C[N@H+]2CCOCC[C@@H]2C)o1 ZINC000775569942 583093865 /nfs/dbraw/zinc/09/38/65/583093865.db2.gz JWCGMULSMFKDGK-NSHDSACASA-N 1 2 238.331 2.409 20 0 BEADLO Cc1c[nH+]c2n1CC[C@@H]2OC(=O)c1ccoc1 ZINC000893517085 583155644 /nfs/dbraw/zinc/15/56/44/583155644.db2.gz CQWRVLIUNFUITC-JTQLQIEISA-N 1 2 232.239 2.086 20 0 BEADLO Cc1c[nH+]c2n1CC[C@H]2OC(=O)c1ccco1 ZINC000893516398 583155683 /nfs/dbraw/zinc/15/56/83/583155683.db2.gz KUDYRLZDBUKAIP-SECBINFHSA-N 1 2 232.239 2.086 20 0 BEADLO CC(C)=CC(=O)O[C@@H]1CCn2c(C)c[nH+]c21 ZINC000893517920 583156097 /nfs/dbraw/zinc/15/60/97/583156097.db2.gz UWCYPOHGAIGQFV-SNVBAGLBSA-N 1 2 220.272 2.146 20 0 BEADLO CCCCC(=O)O[C@@H]1CCn2c(C)c[nH+]c21 ZINC000893520085 583156143 /nfs/dbraw/zinc/15/61/43/583156143.db2.gz VOOLMOXUEKCBNZ-SNVBAGLBSA-N 1 2 222.288 2.370 20 0 BEADLO OCCCCNc1cc(C2CC2)[nH+]c(C2CC2)n1 ZINC000893544099 583160164 /nfs/dbraw/zinc/16/01/64/583160164.db2.gz JKZRZLSHRULJSV-UHFFFAOYSA-N 1 2 247.342 2.416 20 0 BEADLO CNc1cc(N2CCC(C)=C(C)C2)nc[nH+]1 ZINC000893642069 583184154 /nfs/dbraw/zinc/18/41/54/583184154.db2.gz LRJRCLVHYQGDIT-UHFFFAOYSA-N 1 2 218.304 2.065 20 0 BEADLO CNc1cc(N2CCC(C)=C(C)C2)[nH+]cn1 ZINC000893642069 583184155 /nfs/dbraw/zinc/18/41/55/583184155.db2.gz LRJRCLVHYQGDIT-UHFFFAOYSA-N 1 2 218.304 2.065 20 0 BEADLO C[C@@H](O)c1cccc(N[C@@H]2CSC2(C)C)[nH+]1 ZINC000893728808 583215789 /nfs/dbraw/zinc/21/57/89/583215789.db2.gz WEIGOUZUXJXPAS-PSASIEDQSA-N 1 2 238.356 2.441 20 0 BEADLO C[C@H](CO)N(C)c1cc(C2CC2)[nH+]c(C2CC2)n1 ZINC000893740757 583216702 /nfs/dbraw/zinc/21/67/02/583216702.db2.gz XGYRYEYDOMSGKH-SECBINFHSA-N 1 2 247.342 2.048 20 0 BEADLO COc1ccc(C[N@@H+]2C[C@H](C)O[C@H](C)[C@H]2C)o1 ZINC000893889053 583243802 /nfs/dbraw/zinc/24/38/02/583243802.db2.gz SRAFCRDXJCPWIV-HBNTYKKESA-N 1 2 239.315 2.286 20 0 BEADLO COc1ccc(C[N@H+]2C[C@H](C)O[C@H](C)[C@H]2C)o1 ZINC000893889053 583243806 /nfs/dbraw/zinc/24/38/06/583243806.db2.gz SRAFCRDXJCPWIV-HBNTYKKESA-N 1 2 239.315 2.286 20 0 BEADLO CC[C@@]1(C)C[N@H+](Cc2ccc(OC)o2)CCO1 ZINC000893907164 583244337 /nfs/dbraw/zinc/24/43/37/583244337.db2.gz HKQLIOFSJQZYHC-ZDUSSCGKSA-N 1 2 239.315 2.289 20 0 BEADLO CC[C@@]1(C)C[N@@H+](Cc2ccc(OC)o2)CCO1 ZINC000893907164 583244339 /nfs/dbraw/zinc/24/43/39/583244339.db2.gz HKQLIOFSJQZYHC-ZDUSSCGKSA-N 1 2 239.315 2.289 20 0 BEADLO Cc1nc(N2CC3(C2)CCOCC3)c(C)c(C)[nH+]1 ZINC000893937126 583253543 /nfs/dbraw/zinc/25/35/43/583253543.db2.gz FTQFERORKRIERS-UHFFFAOYSA-N 1 2 247.342 2.019 20 0 BEADLO COCC(C)(C)CNc1cccc([C@@H](C)O)[nH+]1 ZINC000893952250 583260332 /nfs/dbraw/zinc/26/03/32/583260332.db2.gz WDQCZPGQMMDSPK-SNVBAGLBSA-N 1 2 238.331 2.219 20 0 BEADLO CCc1cc(N(C)CCF)nc(CC)[nH+]1 ZINC000893998110 583269376 /nfs/dbraw/zinc/26/93/76/583269376.db2.gz ANXXTHUODMPVLQ-UHFFFAOYSA-N 1 2 211.284 2.007 20 0 BEADLO CCc1cc(NC[C@@H](OC)C2CC2)nc(CC)[nH+]1 ZINC000893989482 583270135 /nfs/dbraw/zinc/27/01/35/583270135.db2.gz WSVGJGVNOZCVRR-GFCCVEGCSA-N 1 2 249.358 2.438 20 0 BEADLO CCc1cc(N2CC[C@H]2C(F)F)nc(CC)[nH+]1 ZINC000894000880 583271162 /nfs/dbraw/zinc/27/11/62/583271162.db2.gz SCAVMZDGNZQIPO-VIFPVBQESA-N 1 2 241.285 2.445 20 0 BEADLO C[C@@H](O)c1cccc(N2CCC[C@](C)(F)C2)[nH+]1 ZINC000894004851 583272946 /nfs/dbraw/zinc/27/29/46/583272946.db2.gz AYRFFFJRPWZCBJ-MFKMUULPSA-N 1 2 238.306 2.463 20 0 BEADLO CC[C@@](C)(CNc1cccc([C@H](C)O)[nH+]1)OC ZINC000894053116 583289858 /nfs/dbraw/zinc/28/98/58/583289858.db2.gz INIVBOCWYWWJHP-GWCFXTLKSA-N 1 2 238.331 2.362 20 0 BEADLO C[C@H](O)c1cccc(N[C@H]2CC23CCOCC3)[nH+]1 ZINC000894081505 583294274 /nfs/dbraw/zinc/29/42/74/583294274.db2.gz ZKBVZYDXIODYME-JQWIXIFHSA-N 1 2 248.326 2.116 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CC[C@H](C)[C@@H]2C)c1C ZINC000894084303 583295299 /nfs/dbraw/zinc/29/52/99/583295299.db2.gz KCSCZJYNXFUVEL-KWQFWETISA-N 1 2 207.321 2.257 20 0 BEADLO CCCc1ncc(CNc2cc(NC)[nH+]cn2)o1 ZINC000894100422 583304764 /nfs/dbraw/zinc/30/47/64/583304764.db2.gz ZDXDPGOQFHPGLV-UHFFFAOYSA-N 1 2 247.302 2.071 20 0 BEADLO CCCc1ncc(CNc2cc(NC)nc[nH+]2)o1 ZINC000894100422 583304765 /nfs/dbraw/zinc/30/47/65/583304765.db2.gz ZDXDPGOQFHPGLV-UHFFFAOYSA-N 1 2 247.302 2.071 20 0 BEADLO CC1C[NH+](Cc2nc(C(C)(C)C)co2)C1 ZINC000894158861 583321347 /nfs/dbraw/zinc/32/13/47/583321347.db2.gz PQFILAQBYPKHGB-UHFFFAOYSA-N 1 2 208.305 2.424 20 0 BEADLO CN(C)c1cc(N[C@H]2CCC[C@@H]3C[C@@H]32)[nH+]cn1 ZINC000894166582 583323818 /nfs/dbraw/zinc/32/38/18/583323818.db2.gz FEVAFFSUZQQKMP-VWYCJHECSA-N 1 2 232.331 2.143 20 0 BEADLO CN(C)c1cc(N[C@H]2CCC[C@@H]3C[C@@H]32)nc[nH+]1 ZINC000894166582 583323823 /nfs/dbraw/zinc/32/38/23/583323823.db2.gz FEVAFFSUZQQKMP-VWYCJHECSA-N 1 2 232.331 2.143 20 0 BEADLO Cc1ncoc1C[NH2+]C[C@@H](CC(C)C)N(C)C ZINC000894168340 583324281 /nfs/dbraw/zinc/32/42/81/583324281.db2.gz QWELVLGIVYTSCO-GFCCVEGCSA-N 1 2 239.363 2.049 20 0 BEADLO CCc1onc(C)c1CNc1ccc(CO)c[nH+]1 ZINC000894226284 583383698 /nfs/dbraw/zinc/38/36/98/583383698.db2.gz IBSFYFIMQSUNSO-UHFFFAOYSA-N 1 2 247.298 2.045 20 0 BEADLO Cc1cc(N[C@H]2C[C@@](C)(O)C2)nc(C2CCC2)[nH+]1 ZINC000894232859 583385687 /nfs/dbraw/zinc/38/56/87/583385687.db2.gz LGVMJCPUFHQMHC-VDISTLRHSA-N 1 2 247.342 2.378 20 0 BEADLO Clc1cccc2c1OC[C@@H]2[NH2+]Cc1cnc[nH]1 ZINC000894344345 583430573 /nfs/dbraw/zinc/43/05/73/583430573.db2.gz QKPBSFSYXQEFSK-NSHDSACASA-N 1 2 249.701 2.286 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+]2CC=CCC2)n1 ZINC000894424729 583455200 /nfs/dbraw/zinc/45/52/00/583455200.db2.gz ZIKLLBIUZAVYAT-UHFFFAOYSA-N 1 2 205.305 2.295 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+]2CC=CCC2)n1 ZINC000894424729 583455202 /nfs/dbraw/zinc/45/52/02/583455202.db2.gz ZIKLLBIUZAVYAT-UHFFFAOYSA-N 1 2 205.305 2.295 20 0 BEADLO COC1(C)CC[NH+](Cc2n[nH]c(C)c2C)CC1 ZINC000894424028 583455330 /nfs/dbraw/zinc/45/53/30/583455330.db2.gz ACEXFIVWLAYKMC-UHFFFAOYSA-N 1 2 237.347 2.027 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+]2CCCSCC2)n1 ZINC000894421327 583455675 /nfs/dbraw/zinc/45/56/75/583455675.db2.gz CWDYGRZWEFXXPP-UHFFFAOYSA-N 1 2 239.388 2.472 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+]2CCCSCC2)n1 ZINC000894421327 583455677 /nfs/dbraw/zinc/45/56/77/583455677.db2.gz CWDYGRZWEFXXPP-UHFFFAOYSA-N 1 2 239.388 2.472 20 0 BEADLO c1[nH]c(CN2CC3(CC3)c3ccccc32)c[nH+]1 ZINC000894429868 583456468 /nfs/dbraw/zinc/45/64/68/583456468.db2.gz RJACBITXGQHPLD-UHFFFAOYSA-N 1 2 225.295 2.462 20 0 BEADLO c1[nH]cc(CN2CC3(CC3)c3ccccc32)[nH+]1 ZINC000894429868 583456469 /nfs/dbraw/zinc/45/64/69/583456469.db2.gz RJACBITXGQHPLD-UHFFFAOYSA-N 1 2 225.295 2.462 20 0 BEADLO CC[C@]1(C)C[N@H+](Cc2[nH]nc(C)c2C)CCO1 ZINC000894535330 583479829 /nfs/dbraw/zinc/47/98/29/583479829.db2.gz ZEBDHXXMZUWNGS-CYBMUJFWSA-N 1 2 237.347 2.027 20 0 BEADLO CC[C@]1(C)C[N@@H+](Cc2[nH]nc(C)c2C)CCO1 ZINC000894535330 583479831 /nfs/dbraw/zinc/47/98/31/583479831.db2.gz ZEBDHXXMZUWNGS-CYBMUJFWSA-N 1 2 237.347 2.027 20 0 BEADLO CCc1cc(N2CC[C@@H]3C[C@@H]3C2)nc(CC)[nH+]1 ZINC000894591836 583492081 /nfs/dbraw/zinc/49/20/81/583492081.db2.gz AZMDIGCJWHDONJ-GHMZBOCLSA-N 1 2 231.343 2.448 20 0 BEADLO CO[C@@]1(C)CCC[N@H+](Cc2n[nH]c(C)c2C)C1 ZINC000894597044 583492912 /nfs/dbraw/zinc/49/29/12/583492912.db2.gz IMGDHQSMGWFIRE-ZDUSSCGKSA-N 1 2 237.347 2.027 20 0 BEADLO CO[C@@]1(C)CCC[N@@H+](Cc2n[nH]c(C)c2C)C1 ZINC000894597044 583492914 /nfs/dbraw/zinc/49/29/14/583492914.db2.gz IMGDHQSMGWFIRE-ZDUSSCGKSA-N 1 2 237.347 2.027 20 0 BEADLO Cc1nn(C)c(C[N@H+]2C[C@H](C)[C@H]2C)c1Cl ZINC000894629163 583496866 /nfs/dbraw/zinc/49/68/66/583496866.db2.gz UOFPRKCYTIKAGK-IONNQARKSA-N 1 2 227.739 2.222 20 0 BEADLO Cc1nn(C)c(C[N@@H+]2C[C@H](C)[C@H]2C)c1Cl ZINC000894629163 583496867 /nfs/dbraw/zinc/49/68/67/583496867.db2.gz UOFPRKCYTIKAGK-IONNQARKSA-N 1 2 227.739 2.222 20 0 BEADLO COc1nccc(C[N@@H+]2C[C@@H](C)[C@H]2C)c1F ZINC000894628639 583497679 /nfs/dbraw/zinc/49/76/79/583497679.db2.gz QBYQSUWZUMGSIP-RKDXNWHRSA-N 1 2 224.279 2.070 20 0 BEADLO COc1nccc(C[N@H+]2C[C@@H](C)[C@H]2C)c1F ZINC000894628639 583497681 /nfs/dbraw/zinc/49/76/81/583497681.db2.gz QBYQSUWZUMGSIP-RKDXNWHRSA-N 1 2 224.279 2.070 20 0 BEADLO CCc1[nH]nc(Cl)c1C[N@@H+]1CC[C@@H](F)C1 ZINC000894670133 583503439 /nfs/dbraw/zinc/50/34/39/583503439.db2.gz CNHVPCOSNNCGHN-SSDOTTSWSA-N 1 2 231.702 2.169 20 0 BEADLO CCc1[nH]nc(Cl)c1C[N@H+]1CC[C@@H](F)C1 ZINC000894670133 583503440 /nfs/dbraw/zinc/50/34/40/583503440.db2.gz CNHVPCOSNNCGHN-SSDOTTSWSA-N 1 2 231.702 2.169 20 0 BEADLO C(c1nnc(C2CC2)s1)[N@@H+]1CC[C@H]1C1CC1 ZINC000894691407 583507889 /nfs/dbraw/zinc/50/78/89/583507889.db2.gz YSZSBVBGDXCIOQ-JTQLQIEISA-N 1 2 235.356 2.400 20 0 BEADLO C(c1nnc(C2CC2)s1)[N@H+]1CC[C@H]1C1CC1 ZINC000894691407 583507890 /nfs/dbraw/zinc/50/78/90/583507890.db2.gz YSZSBVBGDXCIOQ-JTQLQIEISA-N 1 2 235.356 2.400 20 0 BEADLO CCOc1ccc(C[NH2+]Cc2conc2C)o1 ZINC000894697638 583509229 /nfs/dbraw/zinc/50/92/29/583509229.db2.gz ONUDOERVFUUOAE-UHFFFAOYSA-N 1 2 236.271 2.265 20 0 BEADLO Cc1ncccc1CNc1cccc([C@@H](C)O)[nH+]1 ZINC000894753165 583515926 /nfs/dbraw/zinc/51/59/26/583515926.db2.gz JQURSZBQLHOIRH-LLVKDONJSA-N 1 2 243.310 2.450 20 0 BEADLO CCc1nc(N2CC(C)(C)CC[C@@H]2CO)cc[nH+]1 ZINC000894789334 583519524 /nfs/dbraw/zinc/51/95/24/583519524.db2.gz DRLIVGITHHLUJK-LLVKDONJSA-N 1 2 249.358 2.026 20 0 BEADLO Cc1cc[nH+]c(N)c1CN[C@H]1CCCC1(F)F ZINC000894784994 583521254 /nfs/dbraw/zinc/52/12/54/583521254.db2.gz PJNLSQVQJUKELZ-JTQLQIEISA-N 1 2 241.285 2.250 20 0 BEADLO CN(C)c1cc(N2CCCC3(CC3)CC2)nc[nH+]1 ZINC000894816387 583523716 /nfs/dbraw/zinc/52/37/16/583523716.db2.gz HYQSREYRWIHBIV-UHFFFAOYSA-N 1 2 246.358 2.313 20 0 BEADLO CN(C)c1cc(N2CCCC3(CC3)CC2)[nH+]cn1 ZINC000894816387 583523717 /nfs/dbraw/zinc/52/37/17/583523717.db2.gz HYQSREYRWIHBIV-UHFFFAOYSA-N 1 2 246.358 2.313 20 0 BEADLO CCc1[nH]nc(Cl)c1C[NH+]1CC(C(F)F)C1 ZINC000894828978 583527262 /nfs/dbraw/zinc/52/72/62/583527262.db2.gz WFXQLJTYFSXPFT-UHFFFAOYSA-N 1 2 249.692 2.322 20 0 BEADLO FC1CC2(C1)C[NH+](Cc1nccn1C1CC1)C2 ZINC000894830623 583527944 /nfs/dbraw/zinc/52/79/44/583527944.db2.gz PMTHWTYVROOUBP-UHFFFAOYSA-N 1 2 235.306 2.152 20 0 BEADLO FC1CC2(C1)CN(Cc1[nH+]ccn1C1CC1)C2 ZINC000894830623 583527945 /nfs/dbraw/zinc/52/79/45/583527945.db2.gz PMTHWTYVROOUBP-UHFFFAOYSA-N 1 2 235.306 2.152 20 0 BEADLO COc1cc(NCc2c[nH+]c[nH]2)cc(OC)c1C ZINC000894855183 583532529 /nfs/dbraw/zinc/53/25/29/583532529.db2.gz OAJMRHZQNYBEPL-UHFFFAOYSA-N 1 2 247.298 2.347 20 0 BEADLO COc1cc(NCc2c[nH]c[nH+]2)cc(OC)c1C ZINC000894855183 583532532 /nfs/dbraw/zinc/53/25/32/583532532.db2.gz OAJMRHZQNYBEPL-UHFFFAOYSA-N 1 2 247.298 2.347 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1cc(C(F)(F)F)nn1C ZINC000894862268 583535332 /nfs/dbraw/zinc/53/53/32/583535332.db2.gz WPCJKTHTKIHSPA-JGVFFNPUSA-N 1 2 247.264 2.279 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1cc(C(F)(F)F)nn1C ZINC000894862268 583535333 /nfs/dbraw/zinc/53/53/33/583535333.db2.gz WPCJKTHTKIHSPA-JGVFFNPUSA-N 1 2 247.264 2.279 20 0 BEADLO CN(C)c1cc(N[C@@H]2CCCC23CC3)[nH+]cn1 ZINC000894862724 583537409 /nfs/dbraw/zinc/53/74/09/583537409.db2.gz ICDFCMYKJHLCHI-SNVBAGLBSA-N 1 2 232.331 2.287 20 0 BEADLO CN(C)c1cc(N[C@@H]2CCCC23CC3)nc[nH+]1 ZINC000894862724 583537410 /nfs/dbraw/zinc/53/74/10/583537410.db2.gz ICDFCMYKJHLCHI-SNVBAGLBSA-N 1 2 232.331 2.287 20 0 BEADLO CCOc1ccc(C[NH2+][C@H](C)c2ccn(C)n2)o1 ZINC000894866372 583537668 /nfs/dbraw/zinc/53/76/68/583537668.db2.gz UWZQBJNNDVZMSH-SNVBAGLBSA-N 1 2 249.314 2.263 20 0 BEADLO Cc1coc(C[N@@H+](C(C)C)C2COC2)c1 ZINC000894868799 583538970 /nfs/dbraw/zinc/53/89/70/583538970.db2.gz HOFJLOFNJWGBNA-UHFFFAOYSA-N 1 2 209.289 2.197 20 0 BEADLO Cc1coc(C[N@H+](C(C)C)C2COC2)c1 ZINC000894868799 583538973 /nfs/dbraw/zinc/53/89/73/583538973.db2.gz HOFJLOFNJWGBNA-UHFFFAOYSA-N 1 2 209.289 2.197 20 0 BEADLO CC(C)c1c[nH]c(CN2CC[C@H](F)C2)[nH+]1 ZINC000894874464 583540936 /nfs/dbraw/zinc/54/09/36/583540936.db2.gz NVOGNRJWMDHMBQ-VIFPVBQESA-N 1 2 211.284 2.077 20 0 BEADLO Cc1cc(N2CC(OC(C)C)C2)nc(C2CC2)[nH+]1 ZINC000894967595 583560814 /nfs/dbraw/zinc/56/08/14/583560814.db2.gz MTZWPDGTOCXXAY-UHFFFAOYSA-N 1 2 247.342 2.276 20 0 BEADLO CC1(O)C[NH+](Cc2cc3c(cccc3O)s2)C1 ZINC000894976997 583563100 /nfs/dbraw/zinc/56/31/00/583563100.db2.gz PJXXKHWRYBDRQQ-UHFFFAOYSA-N 1 2 249.335 2.174 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+]2CCC[C@@H]3COC[C@@H]32)n1 ZINC000894986553 583564428 /nfs/dbraw/zinc/56/44/28/583564428.db2.gz WNULVLIYEUBHLX-YPMHNXCESA-N 1 2 249.358 2.144 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+]2CCC[C@@H]3COC[C@@H]32)n1 ZINC000894986553 583564429 /nfs/dbraw/zinc/56/44/29/583564429.db2.gz WNULVLIYEUBHLX-YPMHNXCESA-N 1 2 249.358 2.144 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2CCO[C@@H](C3CCC3)C2)c1C ZINC000894987425 583565429 /nfs/dbraw/zinc/56/54/29/583565429.db2.gz PYHAHNAMYIWOEP-CQSZACIVSA-N 1 2 249.358 2.027 20 0 BEADLO Cc1n[nH]c(C[N@H+]2CCO[C@@H](C3CCC3)C2)c1C ZINC000894987425 583565430 /nfs/dbraw/zinc/56/54/30/583565430.db2.gz PYHAHNAMYIWOEP-CQSZACIVSA-N 1 2 249.358 2.027 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H](O)CC(C)(C)C)c1C ZINC000881993234 583589897 /nfs/dbraw/zinc/58/98/97/583589897.db2.gz PCBPMAMLNWAQET-NSHDSACASA-N 1 2 237.347 2.302 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2CCO[C@H](C)C2)c1C ZINC000882153313 583595445 /nfs/dbraw/zinc/59/54/45/583595445.db2.gz FKVBCGOLIIDUBY-BXKDBHETSA-N 1 2 235.331 2.320 20 0 BEADLO CC(C)c1c[nH]c(CN2CCC[C@H](F)C2)[nH+]1 ZINC000895150216 583606305 /nfs/dbraw/zinc/60/63/05/583606305.db2.gz HWXFGXYGLBTMOP-JTQLQIEISA-N 1 2 225.311 2.467 20 0 BEADLO F[C@@H]1CCCN(Cc2[nH+]ccn2C2CC2)C1 ZINC000895191894 583621657 /nfs/dbraw/zinc/62/16/57/583621657.db2.gz ULAVSPQAKKKQLR-SNVBAGLBSA-N 1 2 223.295 2.152 20 0 BEADLO CNc1cc(CNc2ncnc(C)c2C)cc[nH+]1 ZINC000895255664 583633972 /nfs/dbraw/zinc/63/39/72/583633972.db2.gz KFMBGGNVAMRHHJ-UHFFFAOYSA-N 1 2 243.314 2.142 20 0 BEADLO CC1=NO[C@@H](C[NH2+]Cc2nc(Cl)cs2)C1 ZINC000895300210 583641854 /nfs/dbraw/zinc/64/18/54/583641854.db2.gz KCBHYNZLLBMRET-SSDOTTSWSA-N 1 2 245.735 2.051 20 0 BEADLO C[C@@H](CCO)Nc1c[nH+]cc2c1CCCC2 ZINC000895310170 583646909 /nfs/dbraw/zinc/64/69/09/583646909.db2.gz RQCRFXSOFHUFBS-JTQLQIEISA-N 1 2 220.316 2.143 20 0 BEADLO Cc1scc(C(=O)NCc2c[nH+]cn2C)c1C ZINC000335715663 583665383 /nfs/dbraw/zinc/66/53/83/583665383.db2.gz NLYCKHUACSXMRK-UHFFFAOYSA-N 1 2 249.339 2.028 20 0 BEADLO Cc1coc(C[N@@H+]2CCO[C@@H](CCF)C2)c1 ZINC000895404367 583667687 /nfs/dbraw/zinc/66/76/87/583667687.db2.gz FDQWXXLXVWALOH-NSHDSACASA-N 1 2 227.279 2.148 20 0 BEADLO Cc1coc(C[N@H+]2CCO[C@@H](CCF)C2)c1 ZINC000895404367 583667690 /nfs/dbraw/zinc/66/76/90/583667690.db2.gz FDQWXXLXVWALOH-NSHDSACASA-N 1 2 227.279 2.148 20 0 BEADLO Cc1cc(C[N@@H+]2Cc3ccncc3C2)ccn1 ZINC000857881156 588920044 /nfs/dbraw/zinc/92/00/44/588920044.db2.gz CSXVNMRVZVLPIC-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO Cc1cc(C[N@H+]2Cc3ccncc3C2)ccn1 ZINC000857881156 588920045 /nfs/dbraw/zinc/92/00/45/588920045.db2.gz CSXVNMRVZVLPIC-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO CC(C)n1c[nH+]cc1CN1CC[C@@H]1C(F)F ZINC000895431106 583670146 /nfs/dbraw/zinc/67/01/46/583670146.db2.gz JPXVNQAGQSVAKL-SNVBAGLBSA-N 1 2 229.274 2.303 20 0 BEADLO CC[C@](C)(C[N@@H+]1CC[C@H]1C(F)F)OC ZINC000895431993 583670915 /nfs/dbraw/zinc/67/09/15/583670915.db2.gz SEOPWMIPDJSXIK-WCBMZHEXSA-N 1 2 207.264 2.141 20 0 BEADLO CC[C@](C)(C[N@H+]1CC[C@H]1C(F)F)OC ZINC000895431993 583670916 /nfs/dbraw/zinc/67/09/16/583670916.db2.gz SEOPWMIPDJSXIK-WCBMZHEXSA-N 1 2 207.264 2.141 20 0 BEADLO C[C@H]([NH2+][C@H]1[C@@H]2CCC[C@@H]21)C(=O)OC(C)(C)C ZINC000895432744 583671467 /nfs/dbraw/zinc/67/14/67/583671467.db2.gz DDNMNWJAMUAYKC-UKKRHICBSA-N 1 2 225.332 2.105 20 0 BEADLO CCC[C@@H](C)NC(=O)C(C)(C)n1c[nH+]c(C)c1 ZINC000895446445 583675818 /nfs/dbraw/zinc/67/58/18/583675818.db2.gz AVLXMMHCZUMARZ-SNVBAGLBSA-N 1 2 237.347 2.231 20 0 BEADLO Cc1cc[nH+]c(N)c1CN(C)Cc1ccns1 ZINC000895452447 583676384 /nfs/dbraw/zinc/67/63/84/583676384.db2.gz MZWKHYPTNNZWGF-UHFFFAOYSA-N 1 2 248.355 2.061 20 0 BEADLO Cn1ncc(C[NH+]2CCC(F)CC2)c1Cl ZINC000895547035 583686808 /nfs/dbraw/zinc/68/68/08/583686808.db2.gz IMUNHARPWQFNBD-UHFFFAOYSA-N 1 2 231.702 2.007 20 0 BEADLO C[C@@H]1C[C@H]1[C@@H]1C[C@H]1Nc1cc[nH+]cc1F ZINC000895536761 583686964 /nfs/dbraw/zinc/68/69/64/583686964.db2.gz HKNBCQJAYCSSHN-KZFFXBSXSA-N 1 2 206.264 2.099 20 0 BEADLO CCC(F)(F)C[NH2+]Cc1cn(C)nc1C1CC1 ZINC000895598090 583695195 /nfs/dbraw/zinc/69/51/95/583695195.db2.gz OLMVSROSZRUYES-UHFFFAOYSA-N 1 2 243.301 2.432 20 0 BEADLO Cc1nc(NCc2cc(C(F)F)on2)cc[nH+]1 ZINC000895606644 583697237 /nfs/dbraw/zinc/69/72/37/583697237.db2.gz BQGHEWZHUHMBFJ-UHFFFAOYSA-N 1 2 240.213 2.323 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CCC2(CCCCO2)CC1 ZINC000895659184 583701593 /nfs/dbraw/zinc/70/15/93/583701593.db2.gz USDYCPRDANFCMK-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1nn(C(C)C)c(C)c1C[NH2+]Cc1ncc[nH]1 ZINC000895705111 583710066 /nfs/dbraw/zinc/71/00/66/583710066.db2.gz VNJBIQMIMXPIST-UHFFFAOYSA-N 1 2 247.346 2.094 20 0 BEADLO CCc1nn(C)c(CC)c1C[NH2+][C@H](C)C(F)F ZINC000895728925 583713454 /nfs/dbraw/zinc/71/34/54/583713454.db2.gz BXJWKWXHXJMVRA-MRVPVSSYSA-N 1 2 245.317 2.288 20 0 BEADLO Cc1cc(N[C@H](c2ncccn2)C2CC2)nc[nH+]1 ZINC000895776912 583726377 /nfs/dbraw/zinc/72/63/77/583726377.db2.gz OAMAAHBQBSGZSI-LBPRGKRZSA-N 1 2 241.298 2.138 20 0 BEADLO COC(C)(C)[C@H](C)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000895786593 583727344 /nfs/dbraw/zinc/72/73/44/583727344.db2.gz VODYJHBZCIVKEK-QMMMGPOBSA-N 1 2 248.330 2.492 20 0 BEADLO CCC/C(C)=C/C(=O)N[C@@H]1CCn2c[nH+]cc2C1 ZINC000857952390 588924789 /nfs/dbraw/zinc/92/47/89/588924789.db2.gz SFRKQPMRDTVMEA-YTRUQHMWSA-N 1 2 247.342 2.061 20 0 BEADLO O=C1OCC[C@@H]1[NH2+][C@@H]1CC[C@@H](c2ccccc2)C1 ZINC000895803031 583731597 /nfs/dbraw/zinc/73/15/97/583731597.db2.gz AIQQJDRCOHTGII-MCIONIFRSA-N 1 2 245.322 2.228 20 0 BEADLO CC/C(C)=C(/C)C(=O)N[C@H]1CCn2c[nH+]cc2C1 ZINC000857946644 588925059 /nfs/dbraw/zinc/92/50/59/588925059.db2.gz XJBDJLFCTHIJNI-WEHUKYGOSA-N 1 2 247.342 2.061 20 0 BEADLO CC(C)[C@H](C[NH2+][C@H]1CCOC1=O)c1ccccc1 ZINC000895807160 583732011 /nfs/dbraw/zinc/73/20/11/583732011.db2.gz LCRMODDEMZDWNE-KBPBESRZSA-N 1 2 247.338 2.331 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CC[C@H]([C@@H]3CCCO3)C2)c1C ZINC000895845920 583735999 /nfs/dbraw/zinc/73/59/99/583735999.db2.gz RPLQDOHBDDAIDA-JSGCOSHPSA-N 1 2 249.358 2.027 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CC[C@H]([C@@H]3CCCO3)C2)c1C ZINC000895845920 583736000 /nfs/dbraw/zinc/73/60/00/583736000.db2.gz RPLQDOHBDDAIDA-JSGCOSHPSA-N 1 2 249.358 2.027 20 0 BEADLO Cc1cn(C(C)(C)C(=O)NC[C@@H](C)C2CC2)c[nH+]1 ZINC000895871079 583737602 /nfs/dbraw/zinc/73/76/02/583737602.db2.gz YILMUCJKSILWSR-SNVBAGLBSA-N 1 2 249.358 2.089 20 0 BEADLO Cc1cc(N[C@H]2COC[C@H]2C)nc(C2CC2)[nH+]1 ZINC000895905268 583742844 /nfs/dbraw/zinc/74/28/44/583742844.db2.gz KLADSHTWUNAPEF-KCJUWKMLSA-N 1 2 233.315 2.109 20 0 BEADLO C[C@@H]1COC[C@@H]1Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000895904302 583743135 /nfs/dbraw/zinc/74/31/35/583743135.db2.gz BHWOVDYCEKXZEN-ZJUUUORDSA-N 1 2 235.331 2.221 20 0 BEADLO Cc1cc(N[C@H]2COC[C@@H]2C)nc(C2CCC2)[nH+]1 ZINC000895911266 583745665 /nfs/dbraw/zinc/74/56/65/583745665.db2.gz XIWRKLVCWLHUJX-CABZTGNLSA-N 1 2 247.342 2.499 20 0 BEADLO CO[C@@H]1CC[C@@H](C)[N@H+](Cc2n[nH]c(C)c2C)C1 ZINC000895927649 583748809 /nfs/dbraw/zinc/74/88/09/583748809.db2.gz OJCVYCJGTHCDLX-BXKDBHETSA-N 1 2 237.347 2.026 20 0 BEADLO CO[C@@H]1CC[C@@H](C)[N@@H+](Cc2n[nH]c(C)c2C)C1 ZINC000895927649 583748811 /nfs/dbraw/zinc/74/88/11/583748811.db2.gz OJCVYCJGTHCDLX-BXKDBHETSA-N 1 2 237.347 2.026 20 0 BEADLO Cc1sccc1C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857976500 588926312 /nfs/dbraw/zinc/92/63/12/588926312.db2.gz FVJSIEQBRONMSV-SNVBAGLBSA-N 1 2 247.323 2.128 20 0 BEADLO CO[C@H]1C[N@H+](Cc2csc(C)c2C)CCO1 ZINC000895964571 583753647 /nfs/dbraw/zinc/75/36/47/583753647.db2.gz YIVXCQCBVMZUCL-GFCCVEGCSA-N 1 2 241.356 2.170 20 0 BEADLO CO[C@H]1C[N@@H+](Cc2csc(C)c2C)CCO1 ZINC000895964571 583753648 /nfs/dbraw/zinc/75/36/48/583753648.db2.gz YIVXCQCBVMZUCL-GFCCVEGCSA-N 1 2 241.356 2.170 20 0 BEADLO CC[C@H](C)CCC(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857977153 588926701 /nfs/dbraw/zinc/92/67/01/588926701.db2.gz AUVDIKKSXUEGFC-WDEREUQCSA-N 1 2 235.331 2.270 20 0 BEADLO CO[C@@H]1C[N@H+](C/C(C)=C\c2ccccc2)CCO1 ZINC000895970813 583756065 /nfs/dbraw/zinc/75/60/65/583756065.db2.gz VHKAFFDBNWLSAX-WVUXNXBLSA-N 1 2 247.338 2.395 20 0 BEADLO CO[C@@H]1C[N@@H+](C/C(C)=C\c2ccccc2)CCO1 ZINC000895970813 583756067 /nfs/dbraw/zinc/75/60/67/583756067.db2.gz VHKAFFDBNWLSAX-WVUXNXBLSA-N 1 2 247.338 2.395 20 0 BEADLO COCC1C[NH+](Cc2cccc(F)c2F)C1 ZINC000895971492 583756254 /nfs/dbraw/zinc/75/62/54/583756254.db2.gz QZNPHIBFBIJLDC-UHFFFAOYSA-N 1 2 227.254 2.043 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857978882 588927650 /nfs/dbraw/zinc/92/76/50/588927650.db2.gz RKLJAGGUYYTGPL-WOPDTQHZSA-N 1 2 247.342 2.270 20 0 BEADLO CC/C(C)=C(\C)C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857979236 588927708 /nfs/dbraw/zinc/92/77/08/588927708.db2.gz ACDIPHAHQSFOGG-USKTWTLRSA-N 1 2 233.315 2.191 20 0 BEADLO Cc1cnc(CNc2cc(CO)cc[nH+]2)c(C)c1 ZINC000896098336 583770204 /nfs/dbraw/zinc/77/02/04/583770204.db2.gz FMGMAZXBJGOGOT-UHFFFAOYSA-N 1 2 243.310 2.198 20 0 BEADLO C[C@H](C(=O)N[C@H]1CCn2c[nH+]cc21)C1CCCC1 ZINC000857982024 588928054 /nfs/dbraw/zinc/92/80/54/588928054.db2.gz DJESFHPQWTXCKV-JQWIXIFHSA-N 1 2 247.342 2.270 20 0 BEADLO CCc1nc(NC[C@]2(C)CCCCO2)cc[nH+]1 ZINC000896179639 583779533 /nfs/dbraw/zinc/77/95/33/583779533.db2.gz WBYVWDLGXZENBI-ZDUSSCGKSA-N 1 2 235.331 2.410 20 0 BEADLO Cc1nc(NC[C@]2(C)CCCCO2)cc[nH+]1 ZINC000896185184 583780162 /nfs/dbraw/zinc/78/01/62/583780162.db2.gz VGJFBJVPYLTBCF-LBPRGKRZSA-N 1 2 221.304 2.156 20 0 BEADLO CCC[C@H](C)CC(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857983547 588928763 /nfs/dbraw/zinc/92/87/63/588928763.db2.gz BMGBVXDMWGGXKF-QWRGUYRKSA-N 1 2 235.331 2.270 20 0 BEADLO CCCC1(C(=O)N[C@@H]2CCn3c[nH+]cc32)CCC1 ZINC000857983387 588928802 /nfs/dbraw/zinc/92/88/02/588928802.db2.gz QSFMOGVKPUUEKA-LLVKDONJSA-N 1 2 247.342 2.415 20 0 BEADLO Cc1nc(NC[C@@]2(C)CCCCO2)cc[nH+]1 ZINC000896185183 583780383 /nfs/dbraw/zinc/78/03/83/583780383.db2.gz VGJFBJVPYLTBCF-GFCCVEGCSA-N 1 2 221.304 2.156 20 0 BEADLO CC(C)(C)/C=C\C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857985962 588929192 /nfs/dbraw/zinc/92/91/92/588929192.db2.gz MTNHCXTVHRXTMY-AYYIZTPMSA-N 1 2 233.315 2.046 20 0 BEADLO C[C@H]1C[C@H](Nc2cc[nH+]cc2F)CCS1 ZINC000896250589 583787117 /nfs/dbraw/zinc/78/71/17/583787117.db2.gz SLWKRCQAXNUJHK-DTWKUNHWSA-N 1 2 226.320 2.339 20 0 BEADLO O=C(CC1=CCCCC1)N[C@@H]1CCn2c[nH+]cc21 ZINC000857986651 588929397 /nfs/dbraw/zinc/92/93/97/588929397.db2.gz OCLLYIGAJROCOW-GFCCVEGCSA-N 1 2 245.326 2.335 20 0 BEADLO Cc1ccccc1C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857989730 588929692 /nfs/dbraw/zinc/92/96/92/588929692.db2.gz JVSIWEHIZOQDPQ-GFCCVEGCSA-N 1 2 241.294 2.066 20 0 BEADLO Cc1c[nH+]c2c(c1)N(C(=O)C(C)(C)C)CCN2 ZINC000857995522 588929796 /nfs/dbraw/zinc/92/97/96/588929796.db2.gz CCXJLNPSFNHOQK-UHFFFAOYSA-N 1 2 233.315 2.195 20 0 BEADLO Cc1cn(C(C)(C)C(=O)NC[C@H]2CC2(C)C)c[nH+]1 ZINC000896327421 583794185 /nfs/dbraw/zinc/79/41/85/583794185.db2.gz BFTVQJPZNHRJMG-LLVKDONJSA-N 1 2 249.358 2.089 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@@H](C)C(F)F)n(C)n1 ZINC000883400934 583794446 /nfs/dbraw/zinc/79/44/46/583794446.db2.gz YJGYYNKLZSMCQY-YUMQZZPRSA-N 1 2 217.263 2.033 20 0 BEADLO CCCCCC(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857990501 588929970 /nfs/dbraw/zinc/92/99/70/588929970.db2.gz WDFZFLNXILRISV-SNVBAGLBSA-N 1 2 221.304 2.024 20 0 BEADLO O=C(N[C@H]1CCn2c[nH+]cc21)C1CCCCC1 ZINC000857991400 588930039 /nfs/dbraw/zinc/93/00/39/588930039.db2.gz XOGPTNDHYJQITL-NSHDSACASA-N 1 2 233.315 2.024 20 0 BEADLO Cc1c[nH+]c2c(c1)N(C(=O)[C@H](C)C(C)C)CCN2 ZINC000857996598 588930142 /nfs/dbraw/zinc/93/01/42/588930142.db2.gz BXGUVIXKAGEHLR-LLVKDONJSA-N 1 2 247.342 2.441 20 0 BEADLO Cc1ccc(C(=O)N[C@H]2CCn3c[nH+]cc32)cc1 ZINC000857990675 588930165 /nfs/dbraw/zinc/93/01/65/588930165.db2.gz QVYKATYPGLSODA-LBPRGKRZSA-N 1 2 241.294 2.066 20 0 BEADLO Cc1c[nH+]c2c(c1)N(C(=O)[C@@H]1CC1(C)C)CCN2 ZINC000858000300 588930421 /nfs/dbraw/zinc/93/04/21/588930421.db2.gz YWCYPQWYJFGRKN-JTQLQIEISA-N 1 2 245.326 2.195 20 0 BEADLO Cc1c[nH+]c2c(c1)N(C(=O)/C=C/C1CC1)CCN2 ZINC000857997367 588930483 /nfs/dbraw/zinc/93/04/83/588930483.db2.gz LWXBNKVHYPNJQB-SNAWJCMRSA-N 1 2 243.310 2.115 20 0 BEADLO Cc1cc(NCc2cc(C3CC3)n(C)n2)nc[nH+]1 ZINC000896528117 583808332 /nfs/dbraw/zinc/80/83/32/583808332.db2.gz URCNQXZHYCNVLY-UHFFFAOYSA-N 1 2 243.314 2.008 20 0 BEADLO c1coc(C[N@@H+]2CCn3cccc3C2)c1 ZINC000896758289 583829769 /nfs/dbraw/zinc/82/97/69/583829769.db2.gz UCRFQRQDGIJVKL-UHFFFAOYSA-N 1 2 202.257 2.097 20 0 BEADLO c1coc(C[N@H+]2CCn3cccc3C2)c1 ZINC000896758289 583829770 /nfs/dbraw/zinc/82/97/70/583829770.db2.gz UCRFQRQDGIJVKL-UHFFFAOYSA-N 1 2 202.257 2.097 20 0 BEADLO Cc1nnc(C[NH2+]C(C)(C)/C=C\Cl)s1 ZINC000896748510 583830146 /nfs/dbraw/zinc/83/01/46/583830146.db2.gz WPXQCEWMSJLIOF-PLNGDYQASA-N 1 2 231.752 2.467 20 0 BEADLO Oc1ccc(C[N@@H+]2CCn3cccc3C2)cc1F ZINC000896761449 583831727 /nfs/dbraw/zinc/83/17/27/583831727.db2.gz OUGBNZUHKAZYHR-UHFFFAOYSA-N 1 2 246.285 2.349 20 0 BEADLO Oc1ccc(C[N@H+]2CCn3cccc3C2)cc1F ZINC000896761449 583831729 /nfs/dbraw/zinc/83/17/29/583831729.db2.gz OUGBNZUHKAZYHR-UHFFFAOYSA-N 1 2 246.285 2.349 20 0 BEADLO Cc1[nH]c(CNC(=O)C2CCC=CCC2)[nH+]c1C ZINC000896905890 583851365 /nfs/dbraw/zinc/85/13/65/583851365.db2.gz NLXDJLWUDCIKFF-UHFFFAOYSA-N 1 2 247.342 2.389 20 0 BEADLO Cc1[nH]c(CNC(=O)C[C@@H]2C=CCCC2)[nH+]c1C ZINC000896913430 583854011 /nfs/dbraw/zinc/85/40/11/583854011.db2.gz FFUNSNPFVNRVKO-GFCCVEGCSA-N 1 2 247.342 2.389 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@H](C)C2CCCC2)[nH+]c1C ZINC000896916087 583854912 /nfs/dbraw/zinc/85/49/12/583854912.db2.gz UJEVHENCRDVCDB-SECBINFHSA-N 1 2 249.358 2.469 20 0 BEADLO Cc1[nH]c(CNC(=O)C[C@@H]2CC[C@@H](C)C2)[nH+]c1C ZINC000896917182 583855518 /nfs/dbraw/zinc/85/55/18/583855518.db2.gz QXTBMVXERSSLLB-BXKDBHETSA-N 1 2 249.358 2.469 20 0 BEADLO C[NH+](C)C1(c2nc(C3(C)CCCC3)no2)CC1 ZINC000896943838 583863108 /nfs/dbraw/zinc/86/31/08/583863108.db2.gz JSXQCJPSRNUQDG-UHFFFAOYSA-N 1 2 235.331 2.452 20 0 BEADLO Cc1[nH+]cnc(NC2CC3(C2)CO[C@@H](C)C3)c1C ZINC000897044882 583873082 /nfs/dbraw/zinc/87/30/82/583873082.db2.gz PTFYBRKBCQJYHE-VOALNZTBSA-N 1 2 247.342 2.463 20 0 BEADLO CO[C@H]1CC[C@@H]1N(C)c1cc[nH+]c(C(C)C)n1 ZINC000897149067 583884437 /nfs/dbraw/zinc/88/44/37/583884437.db2.gz NQDLCLKNCZNGHR-QWRGUYRKSA-N 1 2 235.331 2.214 20 0 BEADLO CCc1cc(N(C)[C@@H]2CC[C@@H]2OC)nc(CC)[nH+]1 ZINC000897139964 583884507 /nfs/dbraw/zinc/88/45/07/583884507.db2.gz LSGRGJMHBQNUMI-NEPJUHHUSA-N 1 2 249.358 2.215 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1C[C@@H]2CCC[C@@H]12 ZINC000897177013 583890169 /nfs/dbraw/zinc/89/01/69/583890169.db2.gz IMQROFMZRAFLGU-YGOYTEALSA-N 1 2 206.264 2.243 20 0 BEADLO CCc1cc(N[C@H](C)Cc2cccnc2)nc[nH+]1 ZINC000897195016 583893621 /nfs/dbraw/zinc/89/36/21/583893621.db2.gz GIYIUWWQOZGMKR-LLVKDONJSA-N 1 2 242.326 2.477 20 0 BEADLO CCC(F)(F)C[NH2+]Cc1cnc(Cl)n1C ZINC000858258612 588941199 /nfs/dbraw/zinc/94/11/99/588941199.db2.gz LRTGTPXXAOSRAX-UHFFFAOYSA-N 1 2 237.681 2.208 20 0 BEADLO CCOc1ccc(C[NH2+]Cc2cncc(O)c2)o1 ZINC000897305139 583913172 /nfs/dbraw/zinc/91/31/72/583913172.db2.gz ORLJUMXUMQPLQI-UHFFFAOYSA-N 1 2 248.282 2.069 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@@H](C)c1ccns1 ZINC000858317198 588944581 /nfs/dbraw/zinc/94/45/81/588944581.db2.gz VINRRWFMUJPDSY-QMMMGPOBSA-N 1 2 222.317 2.025 20 0 BEADLO c1c[nH+]c(-c2cccc(CO[C@@H]3CCOC3)c2)[nH]1 ZINC000653510836 583959947 /nfs/dbraw/zinc/95/99/47/583959947.db2.gz ODONJJGPHRUEQI-CYBMUJFWSA-N 1 2 244.294 2.382 20 0 BEADLO CCn1cnn(C[N@@H+]2C[C@H](C)C[C@H]2C)c1=S ZINC000740858749 583971671 /nfs/dbraw/zinc/97/16/71/583971671.db2.gz GMKNQEQIHLKALG-NXEZZACHSA-N 1 2 240.376 2.122 20 0 BEADLO CCn1cnn(C[N@H+]2C[C@H](C)C[C@H]2C)c1=S ZINC000740858749 583971672 /nfs/dbraw/zinc/97/16/72/583971672.db2.gz GMKNQEQIHLKALG-NXEZZACHSA-N 1 2 240.376 2.122 20 0 BEADLO c1cc(N[C@H]2COC[C@@H]2C2CC2)nc(C2CC2)[nH+]1 ZINC000897448810 583986833 /nfs/dbraw/zinc/98/68/33/583986833.db2.gz YDKHNLHYYJNSCK-NEPJUHHUSA-N 1 2 245.326 2.191 20 0 BEADLO CCC/C=C\C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000729351376 583993835 /nfs/dbraw/zinc/99/38/35/583993835.db2.gz QUURTSBPXLEPIR-PLNGDYQASA-N 1 2 247.342 2.472 20 0 BEADLO CC[C@H](NC(=O)C(C)=C(C)C)c1[nH]cc[nH+]1 ZINC000785420999 584007210 /nfs/dbraw/zinc/00/72/10/584007210.db2.gz JDUPXSPRZRJRAL-JTQLQIEISA-N 1 2 221.304 2.333 20 0 BEADLO CC(C)=CCNC(=O)C(C)(C)n1c[nH+]c(C)c1 ZINC000897547200 584016138 /nfs/dbraw/zinc/01/61/38/584016138.db2.gz OXXCDCONNSYOQL-UHFFFAOYSA-N 1 2 235.331 2.009 20 0 BEADLO CCC[C@@H]([NH2+][C@@H]1CC[C@H](C)SC1)C(=O)OC ZINC000897834063 584052598 /nfs/dbraw/zinc/05/25/98/584052598.db2.gz GJOMBWQAFZTMCK-HBNTYKKESA-N 1 2 245.388 2.202 20 0 BEADLO CCCSC[C@@H](C)[NH2+][C@H](CCC)C(=O)OC ZINC000897833514 584052822 /nfs/dbraw/zinc/05/28/22/584052822.db2.gz NIGULHWSUJRROI-GHMZBOCLSA-N 1 2 247.404 2.449 20 0 BEADLO Cn1cnc(C[NH2+]Cc2sccc2Cl)c1 ZINC000898043004 584080244 /nfs/dbraw/zinc/08/02/44/584080244.db2.gz AMPXKTLZFWTOKP-UHFFFAOYSA-N 1 2 241.747 2.425 20 0 BEADLO Cc1cccc(C[N@@H+]2CC[C@@H](O)[C@H](F)C2)c1F ZINC000898187523 584093707 /nfs/dbraw/zinc/09/37/07/584093707.db2.gz GIYZAMVAPXVIPW-VXGBXAGGSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cccc(C[N@H+]2CC[C@@H](O)[C@H](F)C2)c1F ZINC000898187523 584093708 /nfs/dbraw/zinc/09/37/08/584093708.db2.gz GIYZAMVAPXVIPW-VXGBXAGGSA-N 1 2 241.281 2.039 20 0 BEADLO O=C(N[C@H]1CCn2c[nH+]cc21)C1CCC=CCC1 ZINC000898810033 584160220 /nfs/dbraw/zinc/16/02/20/584160220.db2.gz HLHRQVWUZIWXMP-LBPRGKRZSA-N 1 2 245.326 2.191 20 0 BEADLO CCC[C@@H](C)C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000898899784 584164950 /nfs/dbraw/zinc/16/49/50/584164950.db2.gz PGMXICCXSHAISQ-LLVKDONJSA-N 1 2 237.347 2.171 20 0 BEADLO CC(C)(CNC(=O)[C@@H]1CC=CCC1)n1cc[nH+]c1 ZINC000898893711 584165575 /nfs/dbraw/zinc/16/55/75/584165575.db2.gz QEAKCNNFGOZWOL-GFCCVEGCSA-N 1 2 247.342 2.091 20 0 BEADLO C[C@@H](c1ccccc1)[S@@](=O)Cc1[nH+]ccn1C ZINC000899296987 584194393 /nfs/dbraw/zinc/19/43/93/584194393.db2.gz DTOLEPLOHAEJNJ-GTNSWQLSSA-N 1 2 248.351 2.430 20 0 BEADLO CCCN(CC1CC1)C(=O)CNc1cccc[nH+]1 ZINC000899937373 584258379 /nfs/dbraw/zinc/25/83/79/584258379.db2.gz HTBUEUWFCYKGLR-UHFFFAOYSA-N 1 2 247.342 2.142 20 0 BEADLO CCCCCC[C@H](C)NC(=O)Cc1c[nH]c[nH+]1 ZINC000900081525 584272415 /nfs/dbraw/zinc/27/24/15/584272415.db2.gz JAPCMKPQYREMDL-NSHDSACASA-N 1 2 237.347 2.427 20 0 BEADLO CCCCCC[C@H](C)NC(=O)Cc1c[nH+]c[nH]1 ZINC000900081525 584272417 /nfs/dbraw/zinc/27/24/17/584272417.db2.gz JAPCMKPQYREMDL-NSHDSACASA-N 1 2 237.347 2.427 20 0 BEADLO CCCCN(C(=O)CNc1cccc[nH+]1)C1CC1 ZINC000900129291 584280593 /nfs/dbraw/zinc/28/05/93/584280593.db2.gz KWJOBTKGALEHOF-UHFFFAOYSA-N 1 2 247.342 2.285 20 0 BEADLO Cc1ccc([C@H](C)NC(=O)Cc2c[nH]c[nH+]2)s1 ZINC000900334888 584294173 /nfs/dbraw/zinc/29/41/73/584294173.db2.gz CIYHEXIKIGLHHK-VIFPVBQESA-N 1 2 249.339 2.200 20 0 BEADLO Cc1ccc([C@H](C)NC(=O)Cc2c[nH+]c[nH]2)s1 ZINC000900334888 584294175 /nfs/dbraw/zinc/29/41/75/584294175.db2.gz CIYHEXIKIGLHHK-VIFPVBQESA-N 1 2 249.339 2.200 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)CNc1cccc[nH+]1 ZINC000900365668 584297196 /nfs/dbraw/zinc/29/71/96/584297196.db2.gz PVILJBRHRSBEBQ-QWRGUYRKSA-N 1 2 235.331 2.044 20 0 BEADLO CCOC(=O)C1=CC[C@@H](Nc2cccc[nH+]2)C1 ZINC000858734984 588975513 /nfs/dbraw/zinc/97/55/13/588975513.db2.gz RIGZHQFHCITGGD-LLVKDONJSA-N 1 2 232.283 2.145 20 0 BEADLO CC(C)(C)C1CCN(C(=O)Cc2c[nH+]c[nH]2)CC1 ZINC000900733496 584347279 /nfs/dbraw/zinc/34/72/79/584347279.db2.gz GSSHRNXJDALEPA-UHFFFAOYSA-N 1 2 249.358 2.237 20 0 BEADLO CCC[C@@H]1[C@@H](C)CCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC000900870521 584363785 /nfs/dbraw/zinc/36/37/85/584363785.db2.gz UEONNFVSYXSHFM-WCQYABFASA-N 1 2 249.358 2.379 20 0 BEADLO CC(C)CC1CCN(C(=O)Cc2c[nH+]c[nH]2)CC1 ZINC000901060553 584380330 /nfs/dbraw/zinc/38/03/30/584380330.db2.gz PVKAHGRSNNIBKB-UHFFFAOYSA-N 1 2 249.358 2.237 20 0 BEADLO Cn1c[nH+]c(/C=C/C(=O)OC2CCCCC2)c1 ZINC000901142076 584390658 /nfs/dbraw/zinc/39/06/58/584390658.db2.gz SGNYFVOGINRRQW-BQYQJAHWSA-N 1 2 234.299 2.309 20 0 BEADLO Fc1cccc(-c2cc([C@H]3COCC[NH2+]3)on2)c1 ZINC000901398997 584438889 /nfs/dbraw/zinc/43/88/89/584438889.db2.gz AKACTPQMJBCJNM-GFCCVEGCSA-N 1 2 248.257 2.142 20 0 BEADLO Fc1ccccc1-c1cc([C@H]2COCC[NH2+]2)on1 ZINC000901399425 584438959 /nfs/dbraw/zinc/43/89/59/584438959.db2.gz HBULXXYOSOWGHN-GFCCVEGCSA-N 1 2 248.257 2.142 20 0 BEADLO C[C@H](CO)C[NH2+]c1ccc2c(c1)C[C@H](C)O2 ZINC000901447336 584447175 /nfs/dbraw/zinc/44/71/75/584447175.db2.gz MSHRRFKUTDFSBI-UWVGGRQHSA-N 1 2 221.300 2.050 20 0 BEADLO CCc1ccc(C[N@H+](C)CN2CCOC2=O)cc1 ZINC000902028335 584513351 /nfs/dbraw/zinc/51/33/51/584513351.db2.gz PDUGJVVMRMOKOE-UHFFFAOYSA-N 1 2 248.326 2.091 20 0 BEADLO CCc1ccc(C[N@@H+](C)CN2CCOC2=O)cc1 ZINC000902028335 584513353 /nfs/dbraw/zinc/51/33/53/584513353.db2.gz PDUGJVVMRMOKOE-UHFFFAOYSA-N 1 2 248.326 2.091 20 0 BEADLO COc1cncc(CNc2cc[nH+]c(C)n2)c1C ZINC000902126146 584528957 /nfs/dbraw/zinc/52/89/57/584528957.db2.gz FTMMQIJLSCJXTM-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO Cc1cc(NCc2cncnc2)nc(C(C)C)[nH+]1 ZINC000902186404 584533492 /nfs/dbraw/zinc/53/34/92/584533492.db2.gz SXQKYQFAVZIILO-UHFFFAOYSA-N 1 2 243.314 2.311 20 0 BEADLO Cc1cc(NCc2ccnn2CC(C)C)nc[nH+]1 ZINC000902195560 584536424 /nfs/dbraw/zinc/53/64/24/584536424.db2.gz MNJZHZMJCXRBEC-UHFFFAOYSA-N 1 2 245.330 2.250 20 0 BEADLO Cc1nn(C(C)C)cc1CNc1cc(C)[nH+]cn1 ZINC000902196541 584536523 /nfs/dbraw/zinc/53/65/23/584536523.db2.gz SGAUBZCKWOXAMY-UHFFFAOYSA-N 1 2 245.330 2.483 20 0 BEADLO COc1cncc(CNc2cc(C)[nH+]cn2)c1C ZINC000902193781 584536637 /nfs/dbraw/zinc/53/66/37/584536637.db2.gz BGPPHISFGWMNTP-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO CCn1c[nH+]c(CNc2cccc(CO)c2)c1 ZINC000902302045 584553506 /nfs/dbraw/zinc/55/35/06/584553506.db2.gz JWVRVTNUPXPQLB-UHFFFAOYSA-N 1 2 231.299 2.007 20 0 BEADLO CCNc1ccccc1C[NH2+]Cc1ccon1 ZINC000902300697 584553572 /nfs/dbraw/zinc/55/35/72/584553572.db2.gz OZXXDHIDQLTAQQ-UHFFFAOYSA-N 1 2 231.299 2.396 20 0 BEADLO CCCOC(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000859058214 588995104 /nfs/dbraw/zinc/99/51/04/588995104.db2.gz QLPMWLPZAHWHIO-SNVBAGLBSA-N 1 2 237.303 2.136 20 0 BEADLO CCn1c[nH+]c(CNc2cnn(CC3CC3)c2)c1 ZINC000902417589 584590928 /nfs/dbraw/zinc/59/09/28/584590928.db2.gz ADLGPLXAIWTRBW-UHFFFAOYSA-N 1 2 245.330 2.122 20 0 BEADLO C[C@H]([NH2+]Cc1csc(N)n1)c1ccco1 ZINC000902486880 584626136 /nfs/dbraw/zinc/62/61/36/584626136.db2.gz DOHZHSFYWJWPHX-ZETCQYMHSA-N 1 2 223.301 2.169 20 0 BEADLO CCn1c[nH+]c(CNc2ccn(C(C)C)n2)c1 ZINC000902540513 584629023 /nfs/dbraw/zinc/62/90/23/584629023.db2.gz NMKAFEIQXZOQBT-UHFFFAOYSA-N 1 2 233.319 2.293 20 0 BEADLO CCn1c[nH+]c(CN[C@H]2CCCC2(F)F)c1 ZINC000902561229 584634524 /nfs/dbraw/zinc/63/45/24/584634524.db2.gz SBSVFPDEIRWUJF-JTQLQIEISA-N 1 2 229.274 2.180 20 0 BEADLO c1cn(CCSC[C@@H]2C[C@@]23CCOC3)c[nH+]1 ZINC000902547316 584635196 /nfs/dbraw/zinc/63/51/96/584635196.db2.gz OOHJVTJPCZPPJU-NWDGAFQWSA-N 1 2 238.356 2.043 20 0 BEADLO c1cn(CCSC[C@H]2C[C@]23CCOC3)c[nH+]1 ZINC000902547315 584635397 /nfs/dbraw/zinc/63/53/97/584635397.db2.gz OOHJVTJPCZPPJU-NEPJUHHUSA-N 1 2 238.356 2.043 20 0 BEADLO CCn1cnc(C[NH2+]Cc2occc2C)c1 ZINC000902574637 584637428 /nfs/dbraw/zinc/63/74/28/584637428.db2.gz INBPFVZGOBJVBJ-UHFFFAOYSA-N 1 2 219.288 2.094 20 0 BEADLO CNc1ccc(C)cc1C[NH2+]C(CF)CF ZINC000902578213 584637730 /nfs/dbraw/zinc/63/77/30/584637730.db2.gz OPRGVWJDYXSBSC-UHFFFAOYSA-N 1 2 228.286 2.434 20 0 BEADLO Cn1c[nH+]c(CNc2cccnc2C2CC2)c1 ZINC000902694556 584656952 /nfs/dbraw/zinc/65/69/52/584656952.db2.gz GZUVNTDKLNCNEG-UHFFFAOYSA-N 1 2 228.299 2.305 20 0 BEADLO Cn1c[nH+]c2cc(OCCC(C)(C)O)ccc21 ZINC000902781479 584669995 /nfs/dbraw/zinc/66/99/95/584669995.db2.gz VWJOVCUFWMGQNG-UHFFFAOYSA-N 1 2 234.299 2.113 20 0 BEADLO CC(C)[C@@H](O)CCOc1ccc2c(c1)[nH+]cn2C ZINC000902781199 584670083 /nfs/dbraw/zinc/67/00/83/584670083.db2.gz JIMYOYVWYFRHJB-AWEZNQCLSA-N 1 2 248.326 2.359 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1ccnc(F)c1 ZINC000859078226 588997916 /nfs/dbraw/zinc/99/79/16/588997916.db2.gz ZKUXZMYISQIKDX-CMPLNLGQSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccnc(F)c1 ZINC000859078226 588997917 /nfs/dbraw/zinc/99/79/17/588997917.db2.gz ZKUXZMYISQIKDX-CMPLNLGQSA-N 1 2 238.306 2.220 20 0 BEADLO Cc1cccc(F)c1C[NH2+][C@H](C)c1cn(C)nn1 ZINC000902821680 584675569 /nfs/dbraw/zinc/67/55/69/584675569.db2.gz KHGOFQZANIZFLT-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO O=C(C[N@H+]1CCC[C@H](F)C1)Nc1ccccc1 ZINC000903000342 584715370 /nfs/dbraw/zinc/71/53/70/584715370.db2.gz FGQRJLVCWOGVOG-NSHDSACASA-N 1 2 236.290 2.059 20 0 BEADLO O=C(C[N@@H+]1CCC[C@H](F)C1)Nc1ccccc1 ZINC000903000342 584715371 /nfs/dbraw/zinc/71/53/71/584715371.db2.gz FGQRJLVCWOGVOG-NSHDSACASA-N 1 2 236.290 2.059 20 0 BEADLO CCO[C@H](C)c1nc(-c2c[nH+]c(N)cc2C)no1 ZINC000904271846 584858386 /nfs/dbraw/zinc/85/83/86/584858386.db2.gz CAGZXHRCGBVERF-MRVPVSSYSA-N 1 2 248.286 2.120 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1noc(C2CC=CC2)n1 ZINC000904269473 584858571 /nfs/dbraw/zinc/85/85/71/584858571.db2.gz HQUOHCIQGNWUDI-UHFFFAOYSA-N 1 2 242.282 2.456 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)/C=C/C1CCCC1 ZINC000830789117 584908687 /nfs/dbraw/zinc/90/86/87/584908687.db2.gz WPWMUMOQZIBQEY-VOTSOKGWSA-N 1 2 248.326 2.252 20 0 BEADLO CCCCc1nc(C[N@@H+]2CC[C@@H]3C[C@@H]32)no1 ZINC000761093207 584909585 /nfs/dbraw/zinc/90/95/85/584909585.db2.gz NBASXIUSDBDPID-ZJUUUORDSA-N 1 2 221.304 2.006 20 0 BEADLO CCCCc1nc(C[N@H+]2CC[C@@H]3C[C@@H]32)no1 ZINC000761093207 584909586 /nfs/dbraw/zinc/90/95/86/584909586.db2.gz NBASXIUSDBDPID-ZJUUUORDSA-N 1 2 221.304 2.006 20 0 BEADLO CC(C)c1cnc(C[N@H+](C)C[C@@H]2CCCO2)o1 ZINC000733309258 584946810 /nfs/dbraw/zinc/94/68/10/584946810.db2.gz HMWJPVVATUIBFF-NSHDSACASA-N 1 2 238.331 2.409 20 0 BEADLO CC(C)c1cnc(C[N@@H+](C)C[C@@H]2CCCO2)o1 ZINC000733309258 584946811 /nfs/dbraw/zinc/94/68/11/584946811.db2.gz HMWJPVVATUIBFF-NSHDSACASA-N 1 2 238.331 2.409 20 0 BEADLO Cc1nonc1C[N@@H+](C)Cc1cccc(F)c1 ZINC000734148546 584957745 /nfs/dbraw/zinc/95/77/45/584957745.db2.gz ZDSHNAHWIUKUGR-UHFFFAOYSA-N 1 2 235.262 2.149 20 0 BEADLO Cc1nonc1C[N@H+](C)Cc1cccc(F)c1 ZINC000734148546 584957746 /nfs/dbraw/zinc/95/77/46/584957746.db2.gz ZDSHNAHWIUKUGR-UHFFFAOYSA-N 1 2 235.262 2.149 20 0 BEADLO Cc1[nH]c2ccc(NC(=O)C3=COCC3)cc2[nH+]1 ZINC000734122166 584957921 /nfs/dbraw/zinc/95/79/21/584957921.db2.gz XVSRVGFJYXYOQJ-UHFFFAOYSA-N 1 2 243.266 2.114 20 0 BEADLO Cc1[nH]c2cc(NC(=O)C3=COCC3)ccc2[nH+]1 ZINC000734122166 584957922 /nfs/dbraw/zinc/95/79/22/584957922.db2.gz XVSRVGFJYXYOQJ-UHFFFAOYSA-N 1 2 243.266 2.114 20 0 BEADLO CCCC[C@](C)(CO)Nc1cc[nH+]c(CC)n1 ZINC000884542785 584958844 /nfs/dbraw/zinc/95/88/44/584958844.db2.gz MNTPQSIZTDZEMP-CYBMUJFWSA-N 1 2 237.347 2.392 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)C[C@H]2C=CCCC2)S1 ZINC000819781540 585007838 /nfs/dbraw/zinc/00/78/38/585007838.db2.gz KGJUGMHTRDVRBC-ZJUUUORDSA-N 1 2 238.356 2.340 20 0 BEADLO COc1c(C)c[nH+]c(COC(=O)[C@H]2C[C@H]2C)c1C ZINC000736742472 585011339 /nfs/dbraw/zinc/01/13/39/585011339.db2.gz GJBKQZKQRKPZQU-KCJUWKMLSA-N 1 2 249.310 2.406 20 0 BEADLO CCn1cnn(C[N@H+](CC)C2CCC2)c1=S ZINC000738054882 585040657 /nfs/dbraw/zinc/04/06/57/585040657.db2.gz QDSBGPRYWUCCFC-UHFFFAOYSA-N 1 2 240.376 2.266 20 0 BEADLO CCn1cnn(C[N@@H+](CC)C2CCC2)c1=S ZINC000738054882 585040658 /nfs/dbraw/zinc/04/06/58/585040658.db2.gz QDSBGPRYWUCCFC-UHFFFAOYSA-N 1 2 240.376 2.266 20 0 BEADLO CC/C(C)=C\C(=O)OCc1cc[nH+]c(N)c1 ZINC000838044780 585043812 /nfs/dbraw/zinc/04/38/12/585043812.db2.gz QTVSEZUPGSMMEU-TWGQIWQCSA-N 1 2 220.272 2.063 20 0 BEADLO C[C@@H]1CC=C(C(=O)OCc2cc[nH+]c(N)c2)CC1 ZINC000838348674 585054101 /nfs/dbraw/zinc/05/41/01/585054101.db2.gz IAZYQWUIJYDYGC-SNVBAGLBSA-N 1 2 246.310 2.453 20 0 BEADLO CCn1ncc(C[NH2+][C@@H](C)c2cccc(F)c2)n1 ZINC000838894510 585078881 /nfs/dbraw/zinc/07/88/81/585078881.db2.gz JLEHXDUXQXOKHN-JTQLQIEISA-N 1 2 248.305 2.288 20 0 BEADLO C[C@@H](C(=O)OCc1ccc[nH+]c1N(C)C)C1CC1 ZINC000838955069 585080744 /nfs/dbraw/zinc/08/07/44/585080744.db2.gz ZFJLKZQDUARHAD-SNVBAGLBSA-N 1 2 248.326 2.237 20 0 BEADLO CN(C)c1[nH+]cccc1COC(=O)CC1(C)CC1 ZINC000838954280 585080758 /nfs/dbraw/zinc/08/07/58/585080758.db2.gz KVUHDQPKMJLOJO-UHFFFAOYSA-N 1 2 248.326 2.381 20 0 BEADLO CCn1ncc(C[NH+]2CC3(C2)CCCCC3)n1 ZINC000839131435 585093672 /nfs/dbraw/zinc/09/36/72/585093672.db2.gz AFFVMJNNKZNOSN-UHFFFAOYSA-N 1 2 234.347 2.064 20 0 BEADLO CCn1nc(C)c(C[NH+]2CC(C3CCCC3)C2)n1 ZINC000839143653 585094711 /nfs/dbraw/zinc/09/47/11/585094711.db2.gz QXIISBSNCDXDJW-UHFFFAOYSA-N 1 2 248.374 2.228 20 0 BEADLO C[C@@H]([NH2+]C/C(Cl)=C\Cl)c1ccn(C)n1 ZINC000839195752 585098532 /nfs/dbraw/zinc/09/85/32/585098532.db2.gz GSSJAFADFYRIBG-KBUNYLKBSA-N 1 2 234.130 2.390 20 0 BEADLO C[N@@H+](Cc1ccon1)C[C@H]1CC1(Cl)Cl ZINC000740423473 585101695 /nfs/dbraw/zinc/10/16/95/585101695.db2.gz IEOOVXKCPYIULV-SSDOTTSWSA-N 1 2 235.114 2.300 20 0 BEADLO C[N@H+](Cc1ccon1)C[C@H]1CC1(Cl)Cl ZINC000740423473 585101696 /nfs/dbraw/zinc/10/16/96/585101696.db2.gz IEOOVXKCPYIULV-SSDOTTSWSA-N 1 2 235.114 2.300 20 0 BEADLO Cc1cc(N[C@@H](CCO)C2CC2)nc(C2CC2)[nH+]1 ZINC000741241672 585111303 /nfs/dbraw/zinc/11/13/03/585111303.db2.gz KBZCYXLYRJHLTE-LBPRGKRZSA-N 1 2 247.342 2.235 20 0 BEADLO Cc1[nH]nc(NCc2[nH]cc(C(C)C)[nH+]2)c1C ZINC000886197480 585111702 /nfs/dbraw/zinc/11/17/02/585111702.db2.gz AIQFGOQXFISBAN-UHFFFAOYSA-N 1 2 233.319 2.485 20 0 BEADLO CCc1cc(NC[C@H](O)c2ccc(C)o2)nc[nH+]1 ZINC000741244963 585111763 /nfs/dbraw/zinc/11/17/63/585111763.db2.gz ZTPGGKWQJXRUDV-NSHDSACASA-N 1 2 247.298 2.086 20 0 BEADLO CCCOC(=O)[C@H](C)[N@@H+]1CCS[C@H](C)[C@H]1C ZINC000741796481 585119730 /nfs/dbraw/zinc/11/97/30/585119730.db2.gz GARYZDVFRSQOKG-OUAUKWLOSA-N 1 2 245.388 2.154 20 0 BEADLO CCCOC(=O)[C@H](C)[N@H+]1CCS[C@H](C)[C@H]1C ZINC000741796481 585119731 /nfs/dbraw/zinc/11/97/31/585119731.db2.gz GARYZDVFRSQOKG-OUAUKWLOSA-N 1 2 245.388 2.154 20 0 BEADLO O=C(/C=C/C1CC1)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000742633747 585129279 /nfs/dbraw/zinc/12/92/79/585129279.db2.gz HFEKGYFYXONLSA-GFUIURDCSA-N 1 2 245.326 2.013 20 0 BEADLO FC(F)(F)c1ccn(C[NH+]2C3CCC2CC3)n1 ZINC000744129339 585144456 /nfs/dbraw/zinc/14/44/56/585144456.db2.gz OREPYVYLFOXTQJ-UHFFFAOYSA-N 1 2 245.248 2.486 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2ccnc(F)c2)CCO1 ZINC000859210036 589019527 /nfs/dbraw/zinc/01/95/27/589019527.db2.gz PJPLDWQWQFWDAV-LBPRGKRZSA-N 1 2 238.306 2.222 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2ccnc(F)c2)CCO1 ZINC000859210036 589019529 /nfs/dbraw/zinc/01/95/29/589019529.db2.gz PJPLDWQWQFWDAV-LBPRGKRZSA-N 1 2 238.306 2.222 20 0 BEADLO CCCC[N@H+](Cn1ccsc1=O)C1CC1 ZINC000746603315 585170733 /nfs/dbraw/zinc/17/07/33/585170733.db2.gz NQOBZWAJZOJPPT-UHFFFAOYSA-N 1 2 226.345 2.132 20 0 BEADLO CCCC[N@@H+](Cn1ccsc1=O)C1CC1 ZINC000746603315 585170734 /nfs/dbraw/zinc/17/07/34/585170734.db2.gz NQOBZWAJZOJPPT-UHFFFAOYSA-N 1 2 226.345 2.132 20 0 BEADLO Cn1nc(C[N@@H+]2CC[C@H](C(F)F)C2)cc1Cl ZINC000859216671 589019803 /nfs/dbraw/zinc/01/98/03/589019803.db2.gz DWQAENYTPHNUSM-ZETCQYMHSA-N 1 2 249.692 2.161 20 0 BEADLO Cn1nc(C[N@H+]2CC[C@H](C(F)F)C2)cc1Cl ZINC000859216671 589019805 /nfs/dbraw/zinc/01/98/05/589019805.db2.gz DWQAENYTPHNUSM-ZETCQYMHSA-N 1 2 249.692 2.161 20 0 BEADLO CCCCCC(=O)OCc1c[nH+]cn1C ZINC000747779145 585184221 /nfs/dbraw/zinc/18/42/21/585184221.db2.gz CYSVLJUYLUUIGB-UHFFFAOYSA-N 1 2 210.277 2.044 20 0 BEADLO Cc1ccc(C(=O)OCc2c[nH+]cn2C)s1 ZINC000747778998 585184304 /nfs/dbraw/zinc/18/43/04/585184304.db2.gz AEJOKOVBAWGOIJ-UHFFFAOYSA-N 1 2 236.296 2.147 20 0 BEADLO COc1cc[nH+]cc1NC(=O)/C=C\c1ccco1 ZINC000748204562 585189177 /nfs/dbraw/zinc/18/91/77/585189177.db2.gz OXDAWQKAYJEOPI-PLNGDYQASA-N 1 2 244.250 2.335 20 0 BEADLO Cc1ccc([C@@H](C)C(=O)NCc2[nH]c[nH+]c2C)o1 ZINC000748405873 585192367 /nfs/dbraw/zinc/19/23/67/585192367.db2.gz OCBHWXUHJVVFDX-SECBINFHSA-N 1 2 247.298 2.039 20 0 BEADLO Cc1ccc([C@H](C)C(=O)NCc2[nH]c[nH+]c2C)o1 ZINC000748405874 585192411 /nfs/dbraw/zinc/19/24/11/585192411.db2.gz OCBHWXUHJVVFDX-VIFPVBQESA-N 1 2 247.298 2.039 20 0 BEADLO CC(C)=C(C)C(=O)NCCCNc1cccc[nH+]1 ZINC000751383775 585228963 /nfs/dbraw/zinc/22/89/63/585228963.db2.gz BMIPYRSYRKZMDH-UHFFFAOYSA-N 1 2 247.342 2.356 20 0 BEADLO C[C@H]1C[NH+](Cn2ncsc2=S)C[C@@H]1C ZINC000751925482 585239258 /nfs/dbraw/zinc/23/92/58/585239258.db2.gz FRBVMKUGVTZZAJ-YUMQZZPRSA-N 1 2 229.374 2.219 20 0 BEADLO CC(=O)c1ccccc1NCc1c[nH+]cn1C ZINC000753134993 585254010 /nfs/dbraw/zinc/25/40/10/585254010.db2.gz ZKVRDFGTBWTWCY-UHFFFAOYSA-N 1 2 229.283 2.235 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)/C=C1\CC[C@@H](C)C1 ZINC000753585342 585262684 /nfs/dbraw/zinc/26/26/84/585262684.db2.gz VECDPQKXXLATSI-CDRMENOJSA-N 1 2 247.342 2.134 20 0 BEADLO CC(C(=O)N(C)Cc1[nH]cc[nH+]1)=C1CCCC1 ZINC000753610281 585263878 /nfs/dbraw/zinc/26/38/78/585263878.db2.gz WTBQMBKKXNSTMD-UHFFFAOYSA-N 1 2 233.315 2.259 20 0 BEADLO CC(C)C1CN(C(=O)c2cccc3[nH+]ccn32)C1 ZINC000753749459 585268115 /nfs/dbraw/zinc/26/81/15/585268115.db2.gz QFBHBIVBVRIZHN-UHFFFAOYSA-N 1 2 243.310 2.062 20 0 BEADLO C[C@H]1COC(C)(C)C[N@@H+]1Cc1ccc(F)nc1 ZINC000754155244 585279372 /nfs/dbraw/zinc/27/93/72/585279372.db2.gz DZTGEPNHBKUREM-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H]1COC(C)(C)C[N@H+]1Cc1ccc(F)nc1 ZINC000754155244 585279373 /nfs/dbraw/zinc/27/93/73/585279373.db2.gz DZTGEPNHBKUREM-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2nccc(N)n2)s1 ZINC000754660115 585288861 /nfs/dbraw/zinc/28/88/61/585288861.db2.gz FBHDZPASCOQYDF-SECBINFHSA-N 1 2 248.355 2.280 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1nccc(C)n1 ZINC000756513385 585320502 /nfs/dbraw/zinc/32/05/02/585320502.db2.gz CRTSXJZQIWATQK-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1nccc(C)n1 ZINC000756513385 585320503 /nfs/dbraw/zinc/32/05/03/585320503.db2.gz CRTSXJZQIWATQK-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO C[C@@H]1C[N@H+](C/C=C\c2ccccc2)CCN1C ZINC000839533953 585329092 /nfs/dbraw/zinc/32/90/92/585329092.db2.gz PTYKIVWMIVPZQA-DEBLGDTFSA-N 1 2 230.355 2.336 20 0 BEADLO C[C@@H]1C[N@@H+](C/C=C\c2ccccc2)CCN1C ZINC000839533953 585329093 /nfs/dbraw/zinc/32/90/93/585329093.db2.gz PTYKIVWMIVPZQA-DEBLGDTFSA-N 1 2 230.355 2.336 20 0 BEADLO COc1ccc(C)cc1C[N@H+](C)CCF ZINC000759331842 585367912 /nfs/dbraw/zinc/36/79/12/585367912.db2.gz GMRYWVURYXPDQI-UHFFFAOYSA-N 1 2 211.280 2.405 20 0 BEADLO COc1ccc(C)cc1C[N@@H+](C)CCF ZINC000759331842 585367913 /nfs/dbraw/zinc/36/79/13/585367913.db2.gz GMRYWVURYXPDQI-UHFFFAOYSA-N 1 2 211.280 2.405 20 0 BEADLO Fc1cc(CN2CCC[C@H]2c2[nH]cc[nH+]2)ccn1 ZINC000859223034 589021560 /nfs/dbraw/zinc/02/15/60/589021560.db2.gz PKKGVJKAHDXXIO-NSHDSACASA-N 1 2 246.289 2.281 20 0 BEADLO Cn1cccc1C[N@H+](C)Cn1cccnc1=S ZINC000760407890 585391872 /nfs/dbraw/zinc/39/18/72/585391872.db2.gz PPCZFYCUWQHORZ-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO Cn1cccc1C[N@@H+](C)Cn1cccnc1=S ZINC000760407890 585391873 /nfs/dbraw/zinc/39/18/73/585391873.db2.gz PPCZFYCUWQHORZ-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO C/C=C/C(=O)N(C)CCCc1[nH+]ccn1CCC ZINC000760629749 585394928 /nfs/dbraw/zinc/39/49/28/585394928.db2.gz VGUJUNDXHZGHGX-QPJJXVBHSA-N 1 2 249.358 2.260 20 0 BEADLO Cc1cnc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)nc1 ZINC000761058947 585404466 /nfs/dbraw/zinc/40/44/66/585404466.db2.gz VGDIAEPEFMLGAP-SECBINFHSA-N 1 2 245.248 2.169 20 0 BEADLO Cc1cnc(C[N@H+]2CC[C@@H](C(F)(F)F)C2)nc1 ZINC000761058947 585404467 /nfs/dbraw/zinc/40/44/67/585404467.db2.gz VGDIAEPEFMLGAP-SECBINFHSA-N 1 2 245.248 2.169 20 0 BEADLO CCCCc1noc(C[N@@H+]2CC[C@H]3C[C@H]32)n1 ZINC000761084442 585407141 /nfs/dbraw/zinc/40/71/41/585407141.db2.gz ANCJHVCCHPALCK-VHSXEESVSA-N 1 2 221.304 2.006 20 0 BEADLO CCCCc1noc(C[N@H+]2CC[C@H]3C[C@H]32)n1 ZINC000761084442 585407142 /nfs/dbraw/zinc/40/71/42/585407142.db2.gz ANCJHVCCHPALCK-VHSXEESVSA-N 1 2 221.304 2.006 20 0 BEADLO COC(=O)[C@H](c1ccc(F)cc1)[N@@H+]1CC[C@@H]2C[C@@H]21 ZINC000761086555 585407508 /nfs/dbraw/zinc/40/75/08/585407508.db2.gz DUJHGQIRBYVYLM-WXHSDQCUSA-N 1 2 249.285 2.134 20 0 BEADLO COC(=O)[C@H](c1ccc(F)cc1)[N@H+]1CC[C@@H]2C[C@@H]21 ZINC000761086555 585407509 /nfs/dbraw/zinc/40/75/09/585407509.db2.gz DUJHGQIRBYVYLM-WXHSDQCUSA-N 1 2 249.285 2.134 20 0 BEADLO CCCCc1nc(C[N@@H+]2CC[C@H]3C[C@H]32)no1 ZINC000761093203 585408213 /nfs/dbraw/zinc/40/82/13/585408213.db2.gz NBASXIUSDBDPID-VHSXEESVSA-N 1 2 221.304 2.006 20 0 BEADLO CCCCc1nc(C[N@H+]2CC[C@H]3C[C@H]32)no1 ZINC000761093203 585408214 /nfs/dbraw/zinc/40/82/14/585408214.db2.gz NBASXIUSDBDPID-VHSXEESVSA-N 1 2 221.304 2.006 20 0 BEADLO Cn1c(Cl)cnc1C[N@@H+]1CC[C@@H](C(F)F)C1 ZINC000761107876 585409755 /nfs/dbraw/zinc/40/97/55/585409755.db2.gz JBESLUFIJCDSLV-SSDOTTSWSA-N 1 2 249.692 2.161 20 0 BEADLO Cn1c(Cl)cnc1C[N@H+]1CC[C@@H](C(F)F)C1 ZINC000761107876 585409756 /nfs/dbraw/zinc/40/97/56/585409756.db2.gz JBESLUFIJCDSLV-SSDOTTSWSA-N 1 2 249.692 2.161 20 0 BEADLO CCc1oc(C(=O)OCc2c[nH+]cn2C)cc1C ZINC000761234944 585412666 /nfs/dbraw/zinc/41/26/66/585412666.db2.gz MPYQBEVCUPINGB-UHFFFAOYSA-N 1 2 248.282 2.241 20 0 BEADLO Cc1nc2sccn2c1C[N@H+](C)CCF ZINC000761909374 585422786 /nfs/dbraw/zinc/42/27/86/585422786.db2.gz COMKSUULWZMSMN-UHFFFAOYSA-N 1 2 227.308 2.106 20 0 BEADLO Cc1nc2sccn2c1C[N@@H+](C)CCF ZINC000761909374 585422787 /nfs/dbraw/zinc/42/27/87/585422787.db2.gz COMKSUULWZMSMN-UHFFFAOYSA-N 1 2 227.308 2.106 20 0 BEADLO CC(C)c1nnc([C@@H](C)[NH2+]Cc2ccoc2)[nH]1 ZINC000762627503 585434563 /nfs/dbraw/zinc/43/45/63/585434563.db2.gz JYKRTZXDXFDWGP-SECBINFHSA-N 1 2 234.303 2.372 20 0 BEADLO Cc1cc(N[C@@](C)(CO)C2CC2)nc(C2CC2)[nH+]1 ZINC000762956179 585439840 /nfs/dbraw/zinc/43/98/40/585439840.db2.gz DUNIVNXXUFAXNO-AWEZNQCLSA-N 1 2 247.342 2.235 20 0 BEADLO Cc1cc(N[C@](C)(CO)C2CC2)nc(C2CC2)[nH+]1 ZINC000762956182 585439855 /nfs/dbraw/zinc/43/98/55/585439855.db2.gz DUNIVNXXUFAXNO-CQSZACIVSA-N 1 2 247.342 2.235 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)C(F)=C1CCCC1 ZINC000763045299 585442149 /nfs/dbraw/zinc/44/21/49/585442149.db2.gz VGILIUTZWKJYMT-UHFFFAOYSA-N 1 2 237.278 2.166 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OCC1CC1 ZINC000763161438 585443745 /nfs/dbraw/zinc/44/37/45/585443745.db2.gz FQNXUHQMLDIXEE-UHFFFAOYSA-N 1 2 204.273 2.252 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)c1ccc(F)cc1 ZINC000763286691 585445871 /nfs/dbraw/zinc/44/58/71/585445871.db2.gz BXYVZBVNMUWRCS-UHFFFAOYSA-N 1 2 248.257 2.269 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@@H](C)Cc1ccccc1C ZINC000763285759 585445955 /nfs/dbraw/zinc/44/59/55/585445955.db2.gz TVNQTBDGMMQCDT-STQMWFEESA-N 1 2 249.354 2.467 20 0 BEADLO CCOC(=O)C[N@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000763622333 585451277 /nfs/dbraw/zinc/45/12/77/585451277.db2.gz CGZQOENPDSBWDN-NSHDSACASA-N 1 2 233.311 2.169 20 0 BEADLO CCOC(=O)C[N@@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000763622333 585451278 /nfs/dbraw/zinc/45/12/78/585451278.db2.gz CGZQOENPDSBWDN-NSHDSACASA-N 1 2 233.311 2.169 20 0 BEADLO C[C@H](OC(=O)CCCn1cc[nH+]c1)C1CC1 ZINC000764383974 585464341 /nfs/dbraw/zinc/46/43/41/585464341.db2.gz XSLCHYXLLAWELS-JTQLQIEISA-N 1 2 222.288 2.005 20 0 BEADLO CC(C)C[C@H](C)C(=O)OCc1c[nH+]cn1C ZINC000765610937 585491389 /nfs/dbraw/zinc/49/13/89/585491389.db2.gz MGRQEZGJAUFLMO-JTQLQIEISA-N 1 2 224.304 2.146 20 0 BEADLO CCC(C)(CC)C(=O)OCCn1cc[nH+]c1 ZINC000767609815 585523057 /nfs/dbraw/zinc/52/30/57/585523057.db2.gz DCPLIVBXVLBPQJ-UHFFFAOYSA-N 1 2 224.304 2.253 20 0 BEADLO CO[C@H](C)CSCc1cc[nH+]c(N(C)C)c1 ZINC000767873951 585527242 /nfs/dbraw/zinc/52/72/42/585527242.db2.gz IYOPYISPPBULMU-SNVBAGLBSA-N 1 2 240.372 2.416 20 0 BEADLO Cc1cc(NC(=O)N[C@H](C)c2ccc[nH]2)cc[nH+]1 ZINC000767896523 585527856 /nfs/dbraw/zinc/52/78/56/585527856.db2.gz GWKXNQLIMWSGMJ-SNVBAGLBSA-N 1 2 244.298 2.023 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@H](C)c1ccc[nH]1 ZINC000767915183 585528071 /nfs/dbraw/zinc/52/80/71/585528071.db2.gz FHYQTLDKUAAWNJ-SNVBAGLBSA-N 1 2 244.298 2.023 20 0 BEADLO c1cc([C@@H]2CCC[N@@H+](Cc3ccoc3)C2)[nH]n1 ZINC000768893488 585545666 /nfs/dbraw/zinc/54/56/66/585545666.db2.gz WSVGFMQYKKOPIU-GFCCVEGCSA-N 1 2 231.299 2.382 20 0 BEADLO c1cc([C@@H]2CCC[N@H+](Cc3ccoc3)C2)[nH]n1 ZINC000768893488 585545667 /nfs/dbraw/zinc/54/56/67/585545667.db2.gz WSVGFMQYKKOPIU-GFCCVEGCSA-N 1 2 231.299 2.382 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@@H](F)c1ccccc1 ZINC000769303052 585553016 /nfs/dbraw/zinc/55/30/16/585553016.db2.gz DVYATLYCIVXAOY-LBPRGKRZSA-N 1 2 248.257 2.174 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OC[C@H]1CCCOC1 ZINC000769879844 585565954 /nfs/dbraw/zinc/56/59/54/585565954.db2.gz YGJSAQZFOGOUNY-LBPRGKRZSA-N 1 2 248.326 2.268 20 0 BEADLO CC(C)CN(C)C(=O)c1cccc2[nH+]ccn21 ZINC000770417496 585574053 /nfs/dbraw/zinc/57/40/53/585574053.db2.gz BIVRWANLPAOMFN-UHFFFAOYSA-N 1 2 231.299 2.062 20 0 BEADLO CS/C=C\C(=O)OCc1cccc2[nH+]ccn21 ZINC000771639028 585598152 /nfs/dbraw/zinc/59/81/52/585598152.db2.gz WMGHZOGHUSYKHE-YVMONPNESA-N 1 2 248.307 2.254 20 0 BEADLO O=C(C=C(C1CC1)C1CC1)OCCn1cc[nH+]c1 ZINC000771921359 585604568 /nfs/dbraw/zinc/60/45/68/585604568.db2.gz DAGOLWMBWKPZNB-UHFFFAOYSA-N 1 2 246.310 2.173 20 0 BEADLO C[C@@H](CC(C)(C)C)C(=O)NC1=[NH+]CCS1 ZINC000771928343 585604649 /nfs/dbraw/zinc/60/46/49/585604649.db2.gz LNKJUQPJBFCLKK-QMMMGPOBSA-N 1 2 228.361 2.278 20 0 BEADLO CCC[C@H](C)CC(=O)OCCn1cc[nH+]c1 ZINC000771940140 585605274 /nfs/dbraw/zinc/60/52/74/585605274.db2.gz VZRICQCVDXJBNG-NSHDSACASA-N 1 2 224.304 2.253 20 0 BEADLO Cc1cc(C(=O)OCCn2cc[nH+]c2)ccc1F ZINC000771950097 585605453 /nfs/dbraw/zinc/60/54/53/585605453.db2.gz MBBSRYHJXTZQIB-UHFFFAOYSA-N 1 2 248.257 2.188 20 0 BEADLO CC(C)(C)/C=C\C(=O)OCCn1cc[nH+]c1 ZINC000771974580 585605668 /nfs/dbraw/zinc/60/56/68/585605668.db2.gz YUQNIOBCCSPSEU-PLNGDYQASA-N 1 2 222.288 2.029 20 0 BEADLO CCC(C)(C)CC(=O)OCCn1cc[nH+]c1 ZINC000771986588 585606099 /nfs/dbraw/zinc/60/60/99/585606099.db2.gz SEKBEPFGBANOEA-UHFFFAOYSA-N 1 2 224.304 2.253 20 0 BEADLO C[C@H]1CC[C@H](CC(=O)OCCn2cc[nH+]c2)C1 ZINC000772002331 585606518 /nfs/dbraw/zinc/60/65/18/585606518.db2.gz HWTFSHNKQKMFFW-RYUDHWBXSA-N 1 2 236.315 2.253 20 0 BEADLO C[C@@H]1CC[C@H](CC(=O)OCCn2cc[nH+]c2)C1 ZINC000772002329 585606693 /nfs/dbraw/zinc/60/66/93/585606693.db2.gz HWTFSHNKQKMFFW-NEPJUHHUSA-N 1 2 236.315 2.253 20 0 BEADLO Cc1ccc(COC(=O)[C@H]2CCO[C@@H]2C)c(C)[nH+]1 ZINC000772237355 585610591 /nfs/dbraw/zinc/61/05/91/585610591.db2.gz XEZGJBNEFCJEOV-YPMHNXCESA-N 1 2 249.310 2.167 20 0 BEADLO CC1(C)CCC[C@@H]1C(=O)OCCn1cc[nH+]c1 ZINC000772604192 585618927 /nfs/dbraw/zinc/61/89/27/585618927.db2.gz WUULTPLBHOQLSD-LLVKDONJSA-N 1 2 236.315 2.253 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1C(=O)OCc1c[nH+]cn1C ZINC000774140785 585651451 /nfs/dbraw/zinc/65/14/51/585651451.db2.gz UZUXWKWHXKXPQZ-AAEUAGOBSA-N 1 2 236.315 2.146 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)OCc1c[nH+]cn1C ZINC000774139387 585651567 /nfs/dbraw/zinc/65/15/67/585651567.db2.gz PXOWKRRAFOFUOL-UXBLZVDNSA-N 1 2 236.315 2.456 20 0 BEADLO CCC[C@H](C)OC(=O)[C@H](C)[NH+]1CCSCC1 ZINC000774986254 585669941 /nfs/dbraw/zinc/66/99/41/585669941.db2.gz GAWXNZSWNGTXJG-QWRGUYRKSA-N 1 2 245.388 2.156 20 0 BEADLO CCC[C@@H](C)OC(=O)[C@@H](C)[NH+]1CCSCC1 ZINC000774986250 585669961 /nfs/dbraw/zinc/66/99/61/585669961.db2.gz GAWXNZSWNGTXJG-GHMZBOCLSA-N 1 2 245.388 2.156 20 0 BEADLO COc1cc[nH+]cc1COC(=O)CC(C)(F)F ZINC000805538548 585673625 /nfs/dbraw/zinc/67/36/25/585673625.db2.gz OTKBFLKAGLJYRS-UHFFFAOYSA-N 1 2 245.225 2.179 20 0 BEADLO COC(=O)[C@H]1C[C@H](C)CC[N@@H+]1Cc1ccoc1 ZINC000775996965 585689182 /nfs/dbraw/zinc/68/91/82/585689182.db2.gz ATAPLWXBUOWALE-ZYHUDNBSSA-N 1 2 237.299 2.053 20 0 BEADLO COC(=O)[C@H]1C[C@H](C)CC[N@H+]1Cc1ccoc1 ZINC000775996965 585689183 /nfs/dbraw/zinc/68/91/83/585689183.db2.gz ATAPLWXBUOWALE-ZYHUDNBSSA-N 1 2 237.299 2.053 20 0 BEADLO CCCCC[C@H](C)NC(=O)Cc1c[nH+]cn1C ZINC000776326041 585695663 /nfs/dbraw/zinc/69/56/63/585695663.db2.gz VRRLTLDZFFNWFR-NSHDSACASA-N 1 2 237.347 2.048 20 0 BEADLO CC(C)C(C)(C)NC(=O)c1cccc2[nH+]ccn21 ZINC000776886555 585706393 /nfs/dbraw/zinc/70/63/93/585706393.db2.gz LXAMVYVFDIOWAH-UHFFFAOYSA-N 1 2 245.326 2.499 20 0 BEADLO COc1ccc(N[C@H](C)C[C@@H]2CCOC2)[nH+]c1 ZINC000777199869 585709409 /nfs/dbraw/zinc/70/94/09/585709409.db2.gz CMBOMYWDCWNYQB-MNOVXSKESA-N 1 2 236.315 2.317 20 0 BEADLO COc1ccc[nH+]c1N[C@H](C)c1cnccn1 ZINC000777292320 585709890 /nfs/dbraw/zinc/70/98/90/585709890.db2.gz WRJPQCGZMORRKJ-SECBINFHSA-N 1 2 230.271 2.053 20 0 BEADLO C/C=C(\C)C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000777456508 585712604 /nfs/dbraw/zinc/71/26/04/585712604.db2.gz SAZWYVUXNLVJIG-RZCNENHTSA-N 1 2 219.288 2.039 20 0 BEADLO C/C=C(\C)C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000777456507 585712812 /nfs/dbraw/zinc/71/28/12/585712812.db2.gz SAZWYVUXNLVJIG-OTVCUZDGSA-N 1 2 219.288 2.039 20 0 BEADLO COc1ccc(NCc2ccc(F)nc2)[nH+]c1 ZINC000777733001 585719186 /nfs/dbraw/zinc/71/91/86/585719186.db2.gz DZRYZHDSFOEFLN-UHFFFAOYSA-N 1 2 233.246 2.236 20 0 BEADLO CN(C)c1ccc(NCc2ccc(F)nc2)c[nH+]1 ZINC000777732627 585719342 /nfs/dbraw/zinc/71/93/42/585719342.db2.gz PMWCIUATMXLUAE-UHFFFAOYSA-N 1 2 246.289 2.294 20 0 BEADLO O[C@@H](C[N@@H+]1CCC=C(F)C1)c1ccccc1F ZINC000778961422 585743210 /nfs/dbraw/zinc/74/32/10/585743210.db2.gz UXSLTVHRQYVEBI-ZDUSSCGKSA-N 1 2 239.265 2.418 20 0 BEADLO O[C@@H](C[N@H+]1CCC=C(F)C1)c1ccccc1F ZINC000778961422 585743211 /nfs/dbraw/zinc/74/32/11/585743211.db2.gz UXSLTVHRQYVEBI-ZDUSSCGKSA-N 1 2 239.265 2.418 20 0 BEADLO Clc1ncccc1C[N@H+]1CC=CCC1 ZINC000778966200 585743316 /nfs/dbraw/zinc/74/33/16/585743316.db2.gz IKQOBWXGAXGNKC-UHFFFAOYSA-N 1 2 208.692 2.497 20 0 BEADLO Clc1ncccc1C[N@@H+]1CC=CCC1 ZINC000778966200 585743317 /nfs/dbraw/zinc/74/33/17/585743317.db2.gz IKQOBWXGAXGNKC-UHFFFAOYSA-N 1 2 208.692 2.497 20 0 BEADLO Cc1ccc([C@H](O)C[NH2+][C@H](C)c2cn[nH]c2C)o1 ZINC000779071212 585744683 /nfs/dbraw/zinc/74/46/83/585744683.db2.gz DBDWNGOWLXQPIP-BXKDBHETSA-N 1 2 249.314 2.004 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1ccc(F)nc1 ZINC000779147778 585745708 /nfs/dbraw/zinc/74/57/08/585745708.db2.gz KYMHQQBTNSEEKS-PWSUYJOCSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1ccc(F)nc1 ZINC000779147778 585745709 /nfs/dbraw/zinc/74/57/09/585745709.db2.gz KYMHQQBTNSEEKS-PWSUYJOCSA-N 1 2 238.306 2.220 20 0 BEADLO C[NH+](C)[C@@H](C(=O)OCCCF)c1ccccc1 ZINC000780094558 585772534 /nfs/dbraw/zinc/77/25/34/585772534.db2.gz OQKFNJITPQOXPY-GFCCVEGCSA-N 1 2 239.290 2.192 20 0 BEADLO CC/C(C)=C(\C)C(=O)OCCn1cc[nH+]c1 ZINC000780215366 585773579 /nfs/dbraw/zinc/77/35/79/585773579.db2.gz JKMPKKVLJRZKOL-ZHACJKMWSA-N 1 2 222.288 2.173 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)OCCn1cc[nH+]c1 ZINC000780242682 585774540 /nfs/dbraw/zinc/77/45/40/585774540.db2.gz OCLQNLPHCCQREM-QWRGUYRKSA-N 1 2 224.304 2.109 20 0 BEADLO CC1(C(=O)OCCn2cc[nH+]c2)CCCCC1 ZINC000781268797 585794054 /nfs/dbraw/zinc/79/40/54/585794054.db2.gz MVXHMXIGLMWZHI-UHFFFAOYSA-N 1 2 236.315 2.397 20 0 BEADLO CN(C)c1cc(CSc2ncccn2)cc[nH+]1 ZINC000782111884 585807848 /nfs/dbraw/zinc/80/78/48/585807848.db2.gz WUQSPEAHVXPDAZ-UHFFFAOYSA-N 1 2 246.339 2.230 20 0 BEADLO CN(C)c1cc(CSc2ncc[nH]2)cc[nH+]1 ZINC000782113206 585808022 /nfs/dbraw/zinc/80/80/22/585808022.db2.gz XWTVQBGERUNRGB-UHFFFAOYSA-N 1 2 234.328 2.163 20 0 BEADLO Cl/C=C(/Cl)C[N@@H+]1CCOCC2(CC2)C1 ZINC000782539145 585819805 /nfs/dbraw/zinc/81/98/05/585819805.db2.gz QZDBCGRWICREDS-WEVVVXLNSA-N 1 2 236.142 2.418 20 0 BEADLO Cl/C=C(/Cl)C[N@H+]1CCOCC2(CC2)C1 ZINC000782539145 585819806 /nfs/dbraw/zinc/81/98/06/585819806.db2.gz QZDBCGRWICREDS-WEVVVXLNSA-N 1 2 236.142 2.418 20 0 BEADLO Cc1cn2c([nH+]1)CN(C(=O)/C=C\C(C)(C)C)CC2 ZINC000782727662 585824314 /nfs/dbraw/zinc/82/43/14/585824314.db2.gz IJUCQDYGALRTMC-WAYWQWQTSA-N 1 2 247.342 2.136 20 0 BEADLO C[C@H](Nc1cccc2c1OCO2)c1[nH+]ccn1C ZINC000782777019 585824396 /nfs/dbraw/zinc/82/43/96/585824396.db2.gz FLZYUPIFXJYWKC-VIFPVBQESA-N 1 2 245.282 2.322 20 0 BEADLO CSCCO[NH+]=C(N)Cc1cccc(F)c1 ZINC000783146529 585828449 /nfs/dbraw/zinc/82/84/49/585828449.db2.gz CLSTYBPOWWUOIX-UHFFFAOYSA-N 1 2 242.319 2.230 20 0 BEADLO NC(Cc1cccc(F)c1)=[NH+]OCc1ccon1 ZINC000783147366 585828488 /nfs/dbraw/zinc/82/84/88/585828488.db2.gz HAUVDZWLHMJQFD-UHFFFAOYSA-N 1 2 249.245 2.055 20 0 BEADLO C[C@@H]1CC[C@@H]1[NH2+]c1ccc(-n2ccnn2)cc1 ZINC000783585017 585837464 /nfs/dbraw/zinc/83/74/64/585837464.db2.gz IHSSGBWBBLEDCI-MFKMUULPSA-N 1 2 228.299 2.478 20 0 BEADLO CC(C)[C@@H](F)C(=O)Nc1ccc[nH+]c1N(C)C ZINC000784051831 585848182 /nfs/dbraw/zinc/84/81/82/585848182.db2.gz QBNWGNONXGAKIP-SNVBAGLBSA-N 1 2 239.294 2.080 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)[C@@H]1CC12CCC2 ZINC000784138138 585851130 /nfs/dbraw/zinc/85/11/30/585851130.db2.gz IRZMKOUQVNTSQI-NSHDSACASA-N 1 2 234.299 2.007 20 0 BEADLO CCCC1(C(=O)OCCCn2cc[nH+]c2)CC1 ZINC000784145600 585851609 /nfs/dbraw/zinc/85/16/09/585851609.db2.gz CCLSMKFYAHTKMY-UHFFFAOYSA-N 1 2 236.315 2.397 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)C12CCC(CC1)C2 ZINC000784673294 585865501 /nfs/dbraw/zinc/86/55/01/585865501.db2.gz COMCOIWTMYFCSD-UHFFFAOYSA-N 1 2 248.326 2.397 20 0 BEADLO Cc1cc(C(=O)OCCCn2cc[nH+]c2)co1 ZINC000784845515 585866925 /nfs/dbraw/zinc/86/69/25/585866925.db2.gz ZGFODDOWBVUBQG-UHFFFAOYSA-N 1 2 234.255 2.032 20 0 BEADLO CC(C)C(C)(C)C(=O)OCCCn1cc[nH+]c1 ZINC000784875551 585867371 /nfs/dbraw/zinc/86/73/71/585867371.db2.gz MNIHOIVJRWIILV-UHFFFAOYSA-N 1 2 238.331 2.499 20 0 BEADLO CCC/C=C/C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000785421860 585873237 /nfs/dbraw/zinc/87/32/37/585873237.db2.gz VQZPZDVVMQBOBV-FGEFZZPRSA-N 1 2 221.304 2.333 20 0 BEADLO CCCC=CC(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000785421860 585873238 /nfs/dbraw/zinc/87/32/38/585873238.db2.gz VQZPZDVVMQBOBV-FGEFZZPRSA-N 1 2 221.304 2.333 20 0 BEADLO COc1ccc([NH2+]CC2CC2)cc1NC(N)=O ZINC000785562695 585875461 /nfs/dbraw/zinc/87/54/61/585875461.db2.gz JFYIUFFAVLFGIW-UHFFFAOYSA-N 1 2 235.287 2.008 20 0 BEADLO CC[C@]1(C)C[N@H+](Cc2ccc(F)nc2)CCO1 ZINC000785984018 585884791 /nfs/dbraw/zinc/88/47/91/585884791.db2.gz BSZZKPOTVIRZKO-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO CC[C@]1(C)C[N@@H+](Cc2ccc(F)nc2)CCO1 ZINC000785984018 585884792 /nfs/dbraw/zinc/88/47/92/585884792.db2.gz BSZZKPOTVIRZKO-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OCC[C@H]1CCCO1 ZINC000786731567 585896821 /nfs/dbraw/zinc/89/68/21/585896821.db2.gz CELUSBNYRXWHES-GFCCVEGCSA-N 1 2 248.326 2.411 20 0 BEADLO Cc1nc(F)ccc1C[N@H+]1CCO[C@@H](C)[C@@H]1C ZINC000787174301 585902481 /nfs/dbraw/zinc/90/24/81/585902481.db2.gz BCJBULQGRWUZJS-QWRGUYRKSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1nc(F)ccc1C[N@@H+]1CCO[C@@H](C)[C@@H]1C ZINC000787174301 585902482 /nfs/dbraw/zinc/90/24/82/585902482.db2.gz BCJBULQGRWUZJS-QWRGUYRKSA-N 1 2 238.306 2.138 20 0 BEADLO Nc1cc(COC(=O)Cc2ccsc2)cc[nH+]1 ZINC000787592558 585912555 /nfs/dbraw/zinc/91/25/55/585912555.db2.gz PFIWEZRTTMMPLG-UHFFFAOYSA-N 1 2 248.307 2.011 20 0 BEADLO C/C(=C/C(=O)OCc1cc[nH+]c(N)c1)C1CC1 ZINC000787607505 585912763 /nfs/dbraw/zinc/91/27/63/585912763.db2.gz PKFSHNVZBQILLL-TWGQIWQCSA-N 1 2 232.283 2.063 20 0 BEADLO C/C(=C\C(=O)OCc1cc[nH+]c(N)c1)C1CC1 ZINC000787607503 585912801 /nfs/dbraw/zinc/91/28/01/585912801.db2.gz PKFSHNVZBQILLL-RMKNXTFCSA-N 1 2 232.283 2.063 20 0 BEADLO CCOc1cccc(CN(C)Cc2[nH]cc[nH+]2)c1 ZINC000787770808 585915672 /nfs/dbraw/zinc/91/56/72/585915672.db2.gz XCSXLSWCTJIZGA-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO CCOc1cccc(C[N@H+](C)Cc2ncc[nH]2)c1 ZINC000787770808 585915673 /nfs/dbraw/zinc/91/56/73/585915673.db2.gz XCSXLSWCTJIZGA-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO CCOc1cccc(C[N@@H+](C)Cc2ncc[nH]2)c1 ZINC000787770808 585915674 /nfs/dbraw/zinc/91/56/74/585915674.db2.gz XCSXLSWCTJIZGA-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OCCCCOC(C)(C)C ZINC000788786645 585930218 /nfs/dbraw/zinc/93/02/18/585930218.db2.gz HNEMHGJZYWQEMT-SNVBAGLBSA-N 1 2 246.351 2.115 20 0 BEADLO COc1ccsc1CN(C)Cc1[nH]cc[nH+]1 ZINC000788833827 585931208 /nfs/dbraw/zinc/93/12/08/585931208.db2.gz WQCVSZPVBPSXFT-UHFFFAOYSA-N 1 2 237.328 2.112 20 0 BEADLO C[C@@H]1CN(c2ccccc2F)CC[N@@H+]1CCF ZINC000789497236 585943675 /nfs/dbraw/zinc/94/36/75/585943675.db2.gz JKKUHGNRXIOZFF-LLVKDONJSA-N 1 2 240.297 2.306 20 0 BEADLO C[C@@H]1CN(c2ccccc2F)CC[N@H+]1CCF ZINC000789497236 585943676 /nfs/dbraw/zinc/94/36/76/585943676.db2.gz JKKUHGNRXIOZFF-LLVKDONJSA-N 1 2 240.297 2.306 20 0 BEADLO CCCCCC(=O)OCCc1c[nH+]cn1C ZINC000789777612 585949819 /nfs/dbraw/zinc/94/98/19/585949819.db2.gz SQYGJJGPSGMJPU-UHFFFAOYSA-N 1 2 224.304 2.086 20 0 BEADLO Cn1cc[nH+]c1CCCOC(=O)C1CCCC1 ZINC000789786344 585950071 /nfs/dbraw/zinc/95/00/71/585950071.db2.gz CWGPSKYNQWAMOG-UHFFFAOYSA-N 1 2 236.315 2.086 20 0 BEADLO C/C=C(/CC)C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000789838763 585951470 /nfs/dbraw/zinc/95/14/70/585951470.db2.gz ITPNZPZYQZFRDK-CGXZDELUSA-N 1 2 233.315 2.430 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)c1ccc(C)cc1 ZINC000791346444 585978115 /nfs/dbraw/zinc/97/81/15/585978115.db2.gz UWMYZRZKAYCTQB-UHFFFAOYSA-N 1 2 243.310 2.232 20 0 BEADLO CCSCSc1[nH+]cnc2c1cnn2C ZINC000791437158 585981466 /nfs/dbraw/zinc/98/14/66/585981466.db2.gz GUQUBRZDACXVAL-UHFFFAOYSA-N 1 2 240.357 2.166 20 0 BEADLO CC[C@H]1CC[C@@H]1[NH2+]c1ccc(OCC(N)=O)cc1 ZINC000806151980 585983820 /nfs/dbraw/zinc/98/38/20/585983820.db2.gz NGVUDWJMXIKHCZ-GWCFXTLKSA-N 1 2 248.326 2.151 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1cnn(-c2ccccc2)n1 ZINC000791568244 585984427 /nfs/dbraw/zinc/98/44/27/585984427.db2.gz MXQVCQGEMJGHHJ-RYUDHWBXSA-N 1 2 242.326 2.250 20 0 BEADLO Nc1cc(COC(=O)[C@H]2CC23CCCC3)cc[nH+]1 ZINC000791976230 585992656 /nfs/dbraw/zinc/99/26/56/585992656.db2.gz BUQPDFHQOJSLIC-LLVKDONJSA-N 1 2 246.310 2.287 20 0 BEADLO C[C@@H]1CC/C(=C\C(=O)OCc2cc[nH+]c(N)c2)C1 ZINC000791994935 585992868 /nfs/dbraw/zinc/99/28/68/585992868.db2.gz JXWLIPQBJQLYTB-MXBGMFSPSA-N 1 2 246.310 2.453 20 0 BEADLO Cc1cc(C)c(C(=O)OCc2cc[nH+]c(N)c2)o1 ZINC000791992463 585992911 /nfs/dbraw/zinc/99/29/11/585992911.db2.gz WDOQDFAGNZEONC-UHFFFAOYSA-N 1 2 246.266 2.231 20 0 BEADLO Nc1cc(COC(=O)C(C2CC2)C2CC2)cc[nH+]1 ZINC000792063828 585995258 /nfs/dbraw/zinc/99/52/58/585995258.db2.gz MJCMWODJPQBKRP-UHFFFAOYSA-N 1 2 246.310 2.143 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1C(=O)OCc1cc[nH+]c(N)c1 ZINC000792151121 585996648 /nfs/dbraw/zinc/99/66/48/585996648.db2.gz MGJOXABBUWSPDC-BXUZGUMPSA-N 1 2 248.326 2.389 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCC[C@@H]2c2ncc[nH]2)c1 ZINC000792270009 585998779 /nfs/dbraw/zinc/99/87/79/585998779.db2.gz ZFJHFDQITYHLEP-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccnc(C[N@H+]2CCC[C@@H]2c2ncc[nH]2)c1 ZINC000792270009 585998780 /nfs/dbraw/zinc/99/87/80/585998780.db2.gz ZFJHFDQITYHLEP-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO CC(C)([NH2+]Cc1cnn2ccccc12)C(F)F ZINC000793253810 586014922 /nfs/dbraw/zinc/01/49/22/586014922.db2.gz ILNLSHJBGXKIKI-UHFFFAOYSA-N 1 2 239.269 2.468 20 0 BEADLO c1c[nH+]c(-c2cccc(-c3cc[nH]n3)c2)[nH]1 ZINC000793364606 586017412 /nfs/dbraw/zinc/01/74/12/586017412.db2.gz ZBYKQWZYOVADCZ-UHFFFAOYSA-N 1 2 210.240 2.467 20 0 BEADLO COc1ccc(N[C@@H](C)c2cc(C)nn2C)[nH+]c1 ZINC000793551280 586022761 /nfs/dbraw/zinc/02/27/61/586022761.db2.gz YPXVKIPWPSTPLM-JTQLQIEISA-N 1 2 246.314 2.305 20 0 BEADLO Cc1cccn2cc(COC(=O)[C@H]3C[C@H]3C)[nH+]c12 ZINC000794637367 586046046 /nfs/dbraw/zinc/04/60/46/586046046.db2.gz AWSYOKNKYXQFDO-PWSUYJOCSA-N 1 2 244.294 2.342 20 0 BEADLO Fc1cc(C[N@@H+]2CCC[C@@H]2c2cc[nH]n2)ccn1 ZINC000859282883 589028039 /nfs/dbraw/zinc/02/80/39/589028039.db2.gz XVRRZQMYWGUOEX-GFCCVEGCSA-N 1 2 246.289 2.281 20 0 BEADLO Fc1cc(C[N@H+]2CCC[C@@H]2c2cc[nH]n2)ccn1 ZINC000859282883 589028040 /nfs/dbraw/zinc/02/80/40/589028040.db2.gz XVRRZQMYWGUOEX-GFCCVEGCSA-N 1 2 246.289 2.281 20 0 BEADLO CO[C@H](C(=O)OCc1ccc(C)[nH+]c1C)C1CC1 ZINC000795831340 586092925 /nfs/dbraw/zinc/09/29/25/586092925.db2.gz DRVRVDYGISTUNN-ZDUSSCGKSA-N 1 2 249.310 2.167 20 0 BEADLO CC1(C)CC(CC(=O)OCCn2cc[nH+]c2)C1 ZINC000796278243 586099853 /nfs/dbraw/zinc/09/98/53/586099853.db2.gz VEFOJOMTFYDVEI-UHFFFAOYSA-N 1 2 236.315 2.253 20 0 BEADLO Cc1noc(C)c1[C@@H](C)[NH2+][C@H](C)c1ncc[nH]1 ZINC000796764887 586111703 /nfs/dbraw/zinc/11/17/03/586111703.db2.gz VSRIAIXFWSMXPH-VXNVDRBHSA-N 1 2 234.303 2.426 20 0 BEADLO Cc1nc(N2CC[C@@H](c3ccccn3)C2)cc[nH+]1 ZINC000798416374 586143707 /nfs/dbraw/zinc/14/37/07/586143707.db2.gz OSCWQZNWRPNHPG-GFCCVEGCSA-N 1 2 240.310 2.174 20 0 BEADLO FC(F)(F)c1cc(C[N@H+]2CC=CCC2)[nH]n1 ZINC000799734899 586195783 /nfs/dbraw/zinc/19/57/83/586195783.db2.gz RHAWEMDMYWPXCK-UHFFFAOYSA-N 1 2 231.221 2.190 20 0 BEADLO FC(F)(F)c1cc(C[N@@H+]2CC=CCC2)[nH]n1 ZINC000799734899 586195784 /nfs/dbraw/zinc/19/57/84/586195784.db2.gz RHAWEMDMYWPXCK-UHFFFAOYSA-N 1 2 231.221 2.190 20 0 BEADLO CC(C)SCC[N@@H+]1CCO[C@H](C(F)F)C1 ZINC000801560631 586262881 /nfs/dbraw/zinc/26/28/81/586262881.db2.gz RVKZFLRMCPOJGN-VIFPVBQESA-N 1 2 239.331 2.094 20 0 BEADLO CC(C)SCC[N@H+]1CCO[C@H](C(F)F)C1 ZINC000801560631 586262882 /nfs/dbraw/zinc/26/28/82/586262882.db2.gz RVKZFLRMCPOJGN-VIFPVBQESA-N 1 2 239.331 2.094 20 0 BEADLO Cc1ccccc1C[N@@H+]1CCO[C@@H](C(F)F)C1 ZINC000801566560 586264211 /nfs/dbraw/zinc/26/42/11/586264211.db2.gz PGZMMXKPBZCVCO-GFCCVEGCSA-N 1 2 241.281 2.461 20 0 BEADLO Cc1ccccc1C[N@H+]1CCO[C@@H](C(F)F)C1 ZINC000801566560 586264214 /nfs/dbraw/zinc/26/42/14/586264214.db2.gz PGZMMXKPBZCVCO-GFCCVEGCSA-N 1 2 241.281 2.461 20 0 BEADLO CNc1[nH+]c(C)ccc1C(=O)OC[C@@H]1C[C@H]1C ZINC000859501290 589041294 /nfs/dbraw/zinc/04/12/94/589041294.db2.gz KIUWDYDQCJENNV-SCZZXKLOSA-N 1 2 234.299 2.245 20 0 BEADLO CC(C)C(C)(C)C(=O)O[C@H]1CC[N@H+](CCF)C1 ZINC000802238669 586299231 /nfs/dbraw/zinc/29/92/31/586299231.db2.gz JUFYPYCJIIKOGG-NSHDSACASA-N 1 2 245.338 2.256 20 0 BEADLO CC(C)C(C)(C)C(=O)O[C@H]1CC[N@@H+](CCF)C1 ZINC000802238669 586299232 /nfs/dbraw/zinc/29/92/32/586299232.db2.gz JUFYPYCJIIKOGG-NSHDSACASA-N 1 2 245.338 2.256 20 0 BEADLO CC/C=C(/C)C(=O)OCCCc1[nH+]ccn1C ZINC000802783646 586313707 /nfs/dbraw/zinc/31/37/07/586313707.db2.gz APGSVARYLFXKNI-WDZFZDKYSA-N 1 2 236.315 2.252 20 0 BEADLO CC[C@@H](C)CCC(=O)OCCc1c[nH+]cn1C ZINC000802777708 586313869 /nfs/dbraw/zinc/31/38/69/586313869.db2.gz OPNYZMQUCYOSAQ-LLVKDONJSA-N 1 2 238.331 2.332 20 0 BEADLO Cn1cc[nH+]c1CCCOC(=O)C1(C)CCC1 ZINC000802788732 586314137 /nfs/dbraw/zinc/31/41/37/586314137.db2.gz PCVRCJQTKRIWMA-UHFFFAOYSA-N 1 2 236.315 2.086 20 0 BEADLO CCC[C@H](C)C(=O)OCCCc1[nH+]ccn1C ZINC000802786571 586314263 /nfs/dbraw/zinc/31/42/63/586314263.db2.gz UKYFQZZWNYXZRG-NSHDSACASA-N 1 2 238.331 2.332 20 0 BEADLO CC[C@H](C)CC(=O)OCCCc1[nH+]ccn1C ZINC000802786529 586314331 /nfs/dbraw/zinc/31/43/31/586314331.db2.gz SYACKTFCMDRLJS-NSHDSACASA-N 1 2 238.331 2.332 20 0 BEADLO Cc1cc(C(=O)OCCn2cc[nH+]c2)cs1 ZINC000802814735 586315403 /nfs/dbraw/zinc/31/54/03/586315403.db2.gz CUCDEBKZHDPFLJ-UHFFFAOYSA-N 1 2 236.296 2.110 20 0 BEADLO CCC/C(C)=C/C(=O)N[C@@H]1CCc2c[nH+]cn2C1 ZINC000804335654 586391689 /nfs/dbraw/zinc/39/16/89/586391689.db2.gz CSZLQOYHTUMSQG-YTRUQHMWSA-N 1 2 247.342 2.061 20 0 BEADLO CC[NH2+]Cc1noc([C@@H](C)c2ccccc2F)n1 ZINC000843145002 586436790 /nfs/dbraw/zinc/43/67/90/586436790.db2.gz REUKQIFPXJLLNG-VIFPVBQESA-N 1 2 249.289 2.470 20 0 BEADLO CC[NH2+]Cc1noc([C@@H](C)c2cccc(F)c2)n1 ZINC000843145098 586444472 /nfs/dbraw/zinc/44/44/72/586444472.db2.gz TYJKASGVKIRRKR-VIFPVBQESA-N 1 2 249.289 2.470 20 0 BEADLO CC[C@@H]1CC(=O)N(C[N@@H+]2CCC[C@](C)(F)C2)C1 ZINC000840097952 586445852 /nfs/dbraw/zinc/44/58/52/586445852.db2.gz BFTKMINAKUXOKR-YPMHNXCESA-N 1 2 242.338 2.026 20 0 BEADLO CC[C@@H]1CC(=O)N(C[N@H+]2CCC[C@](C)(F)C2)C1 ZINC000840097952 586445854 /nfs/dbraw/zinc/44/58/54/586445854.db2.gz BFTKMINAKUXOKR-YPMHNXCESA-N 1 2 242.338 2.026 20 0 BEADLO CS[C@H]1CC[N@H+](Cn2ncsc2=S)C1 ZINC000840112547 586449001 /nfs/dbraw/zinc/44/90/01/586449001.db2.gz DWPQVHFEODWYDL-ZETCQYMHSA-N 1 2 247.414 2.069 20 0 BEADLO CS[C@H]1CC[N@@H+](Cn2ncsc2=S)C1 ZINC000840112547 586449003 /nfs/dbraw/zinc/44/90/03/586449003.db2.gz DWPQVHFEODWYDL-ZETCQYMHSA-N 1 2 247.414 2.069 20 0 BEADLO CS[C@@H]1CC[N@H+](Cn2ncsc2=S)C1 ZINC000840112546 586449079 /nfs/dbraw/zinc/44/90/79/586449079.db2.gz DWPQVHFEODWYDL-SSDOTTSWSA-N 1 2 247.414 2.069 20 0 BEADLO CS[C@@H]1CC[N@@H+](Cn2ncsc2=S)C1 ZINC000840112546 586449080 /nfs/dbraw/zinc/44/90/80/586449080.db2.gz DWPQVHFEODWYDL-SSDOTTSWSA-N 1 2 247.414 2.069 20 0 BEADLO CC(C)=CCO[NH+]=C(N)c1ccccc1 ZINC000808244335 586468657 /nfs/dbraw/zinc/46/86/57/586468657.db2.gz VUGKDUUTKCHGRO-UHFFFAOYSA-N 1 2 204.273 2.499 20 0 BEADLO C[C@@H](C1CC1)n1nccc1NCc1cn(C)c[nH+]1 ZINC000808384380 586470011 /nfs/dbraw/zinc/47/00/11/586470011.db2.gz GYLILKCANQPWSK-JTQLQIEISA-N 1 2 245.330 2.200 20 0 BEADLO C[N@H+](CC[C@H](O)c1ccccc1)Cc1ccon1 ZINC000808727940 586485305 /nfs/dbraw/zinc/48/53/05/586485305.db2.gz KXIRDKVWCGKLKS-AWEZNQCLSA-N 1 2 246.310 2.230 20 0 BEADLO C[N@@H+](CC[C@H](O)c1ccccc1)Cc1ccon1 ZINC000808727940 586485307 /nfs/dbraw/zinc/48/53/07/586485307.db2.gz KXIRDKVWCGKLKS-AWEZNQCLSA-N 1 2 246.310 2.230 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccoc2)C[C@@H](C)[S@@]1=O ZINC000809699426 586513786 /nfs/dbraw/zinc/51/37/86/586513786.db2.gz OCOHFLLARUMPIQ-SIVJFFJCSA-N 1 2 241.356 2.011 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccoc2)C[C@@H](C)[S@@]1=O ZINC000809699426 586513787 /nfs/dbraw/zinc/51/37/87/586513787.db2.gz OCOHFLLARUMPIQ-SIVJFFJCSA-N 1 2 241.356 2.011 20 0 BEADLO FC(F)C[C@@H]1COCC[N@@H+]1Cc1ccoc1 ZINC000809712527 586514379 /nfs/dbraw/zinc/51/43/79/586514379.db2.gz PPYXFYUZBUWRHR-SNVBAGLBSA-N 1 2 231.242 2.136 20 0 BEADLO FC(F)C[C@@H]1COCC[N@H+]1Cc1ccoc1 ZINC000809712527 586514380 /nfs/dbraw/zinc/51/43/80/586514380.db2.gz PPYXFYUZBUWRHR-SNVBAGLBSA-N 1 2 231.242 2.136 20 0 BEADLO CCOc1ccccc1C[NH2+]Cc1nonc1C ZINC000809743707 586515952 /nfs/dbraw/zinc/51/59/52/586515952.db2.gz ARZPOZFBPPGLAE-UHFFFAOYSA-N 1 2 247.298 2.067 20 0 BEADLO Cc1nonc1C[NH2+]Cc1ccc(F)cc1C ZINC000809744825 586516470 /nfs/dbraw/zinc/51/64/70/586516470.db2.gz FHACRRNXNOIAEC-UHFFFAOYSA-N 1 2 235.262 2.115 20 0 BEADLO Cc1nonc1C[NH2+]Cc1ccc(C)c(C)c1 ZINC000809743874 586516558 /nfs/dbraw/zinc/51/65/58/586516558.db2.gz KXSITXVQXKJCDU-UHFFFAOYSA-N 1 2 231.299 2.285 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCC[C@H]2c2ncc[nH]2)o1 ZINC000809970414 586527269 /nfs/dbraw/zinc/52/72/69/586527269.db2.gz YGQKLUCCOQIVNW-NSHDSACASA-N 1 2 246.314 2.352 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCC[C@H]2c2ncc[nH]2)o1 ZINC000809970414 586527271 /nfs/dbraw/zinc/52/72/71/586527271.db2.gz YGQKLUCCOQIVNW-NSHDSACASA-N 1 2 246.314 2.352 20 0 BEADLO Cc1nc(C)c(CN2CCC[C@H]2c2[nH]cc[nH+]2)o1 ZINC000809970414 586527273 /nfs/dbraw/zinc/52/72/73/586527273.db2.gz YGQKLUCCOQIVNW-NSHDSACASA-N 1 2 246.314 2.352 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCC[C@@H]2c2ncc[nH]2)o1 ZINC000809970413 586527553 /nfs/dbraw/zinc/52/75/53/586527553.db2.gz YGQKLUCCOQIVNW-LLVKDONJSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCC[C@@H]2c2ncc[nH]2)o1 ZINC000809970413 586527554 /nfs/dbraw/zinc/52/75/54/586527554.db2.gz YGQKLUCCOQIVNW-LLVKDONJSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1nc(C)c(CN2CCC[C@@H]2c2[nH]cc[nH+]2)o1 ZINC000809970413 586527555 /nfs/dbraw/zinc/52/75/55/586527555.db2.gz YGQKLUCCOQIVNW-LLVKDONJSA-N 1 2 246.314 2.352 20 0 BEADLO CCC[C@H](C)c1noc(Cc2c[nH+]cn2C)n1 ZINC000810283992 586537919 /nfs/dbraw/zinc/53/79/19/586537919.db2.gz HPAVYNYWLRRAKY-VIFPVBQESA-N 1 2 234.303 2.298 20 0 BEADLO Cn1c[nH+]cc1COC(=O)C1(F)CCCCC1 ZINC000810601784 586542220 /nfs/dbraw/zinc/54/22/20/586542220.db2.gz IVORPODLCSYXPQ-UHFFFAOYSA-N 1 2 240.278 2.136 20 0 BEADLO Cc1cc(CNc2ccc(CO)c[nH+]2)c(C)o1 ZINC000811501022 586559896 /nfs/dbraw/zinc/55/98/96/586559896.db2.gz CXXQOSGEBKFNQO-UHFFFAOYSA-N 1 2 232.283 2.396 20 0 BEADLO Cc1cc(C(F)(F)F)nn1C[N@H+]1CC=CCC1 ZINC000811762927 586566621 /nfs/dbraw/zinc/56/66/21/586566621.db2.gz XEMPIBLKYALDDA-UHFFFAOYSA-N 1 2 245.248 2.430 20 0 BEADLO Cc1cc(C(F)(F)F)nn1C[N@@H+]1CC=CCC1 ZINC000811762927 586566622 /nfs/dbraw/zinc/56/66/22/586566622.db2.gz XEMPIBLKYALDDA-UHFFFAOYSA-N 1 2 245.248 2.430 20 0 BEADLO CCC1(C)CN(C(=O)c2cccc3[nH+]ccn32)C1 ZINC000812693122 586582728 /nfs/dbraw/zinc/58/27/28/586582728.db2.gz PTKGTZNTWDFIEC-UHFFFAOYSA-N 1 2 243.310 2.206 20 0 BEADLO C1=CO[C@@H](CNc2cc(NC3CC3)nc[nH+]2)CC1 ZINC000840292490 586604920 /nfs/dbraw/zinc/60/49/20/586604920.db2.gz XYAUVEBSZGBEQS-LLVKDONJSA-N 1 2 246.314 2.156 20 0 BEADLO C1=CO[C@@H](CNc2cc(NC3CC3)[nH+]cn2)CC1 ZINC000840292490 586604921 /nfs/dbraw/zinc/60/49/21/586604921.db2.gz XYAUVEBSZGBEQS-LLVKDONJSA-N 1 2 246.314 2.156 20 0 BEADLO c1cc(COc2cc[nH+]cc2)c2c(c1)OCCO2 ZINC000814266214 586620902 /nfs/dbraw/zinc/62/09/02/586620902.db2.gz YTVHKPXFRIZRQE-UHFFFAOYSA-N 1 2 243.262 2.432 20 0 BEADLO O=C(OCCn1cc[nH+]c1)[C@@H]1CC2CCC1CC2 ZINC000814498913 586623306 /nfs/dbraw/zinc/62/33/06/586623306.db2.gz ZMZRTADYSQILSU-WXRRBKDZSA-N 1 2 248.326 2.253 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@H]1CC2CCC1CC2 ZINC000815967433 586700404 /nfs/dbraw/zinc/70/04/04/586700404.db2.gz ATZNQWZQHUNUCG-XIVSLSHWSA-N 1 2 248.326 2.290 20 0 BEADLO CC1=CC[N@H+](Cc2cnn(C)c2Cl)CC1 ZINC000816513432 586738445 /nfs/dbraw/zinc/73/84/45/586738445.db2.gz QHBFTMIKUXPTSI-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO CC1=CC[N@@H+](Cc2cnn(C)c2Cl)CC1 ZINC000816513432 586738447 /nfs/dbraw/zinc/73/84/47/586738447.db2.gz QHBFTMIKUXPTSI-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1cnc(Cl)c(C)c1 ZINC000816637208 586745852 /nfs/dbraw/zinc/74/58/52/586745852.db2.gz WPGJWHAVZYFEDO-NSHDSACASA-N 1 2 240.734 2.264 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1cnc(Cl)c(C)c1 ZINC000816637208 586745855 /nfs/dbraw/zinc/74/58/55/586745855.db2.gz WPGJWHAVZYFEDO-NSHDSACASA-N 1 2 240.734 2.264 20 0 BEADLO C[N@H+](CCF)Cc1ccc(Br)cn1 ZINC000816640176 586746730 /nfs/dbraw/zinc/74/67/30/586746730.db2.gz XQTBUSUBLJDURD-UHFFFAOYSA-N 1 2 247.111 2.245 20 0 BEADLO C[N@@H+](CCF)Cc1ccc(Br)cn1 ZINC000816640176 586746733 /nfs/dbraw/zinc/74/67/33/586746733.db2.gz XQTBUSUBLJDURD-UHFFFAOYSA-N 1 2 247.111 2.245 20 0 BEADLO C[C@@H]1C[N@H+](Cc2coc(C3CC3)n2)[C@H]1C ZINC000816648139 586750063 /nfs/dbraw/zinc/75/00/63/586750063.db2.gz FVHUZTWQXBTQMR-BDAKNGLRSA-N 1 2 206.289 2.392 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2coc(C3CC3)n2)[C@H]1C ZINC000816648139 586750064 /nfs/dbraw/zinc/75/00/64/586750064.db2.gz FVHUZTWQXBTQMR-BDAKNGLRSA-N 1 2 206.289 2.392 20 0 BEADLO C[C@@H]1C[N@H+](Cc2coc(C3CC3)n2)[C@@H]1C ZINC000816648142 586750384 /nfs/dbraw/zinc/75/03/84/586750384.db2.gz FVHUZTWQXBTQMR-RKDXNWHRSA-N 1 2 206.289 2.392 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2coc(C3CC3)n2)[C@@H]1C ZINC000816648142 586750387 /nfs/dbraw/zinc/75/03/87/586750387.db2.gz FVHUZTWQXBTQMR-RKDXNWHRSA-N 1 2 206.289 2.392 20 0 BEADLO CCCCC[C@H](C)NC(=O)Cc1[nH]cc[nH+]1 ZINC000816839418 586767697 /nfs/dbraw/zinc/76/76/97/586767697.db2.gz FETDKYJEPNMWSV-JTQLQIEISA-N 1 2 223.320 2.037 20 0 BEADLO CCC1CCC(CNC(=O)Cc2[nH]cc[nH+]2)CC1 ZINC000816895029 586769421 /nfs/dbraw/zinc/76/94/21/586769421.db2.gz ZJMDEOSUSLTZKB-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO CC(C)[C@H]1CCCN(C(=O)Cc2[nH]cc[nH+]2)CC1 ZINC000816925917 586771794 /nfs/dbraw/zinc/77/17/94/586771794.db2.gz BXQTXBLTXHBGAE-LBPRGKRZSA-N 1 2 249.358 2.237 20 0 BEADLO COc1cccc2c1C[N@H+](CCOC(F)F)C2 ZINC000859939278 589072405 /nfs/dbraw/zinc/07/24/05/589072405.db2.gz FRAAWPCHOCMNBG-UHFFFAOYSA-N 1 2 243.253 2.250 20 0 BEADLO COc1cccc2c1C[N@@H+](CCOC(F)F)C2 ZINC000859939278 589072407 /nfs/dbraw/zinc/07/24/07/589072407.db2.gz FRAAWPCHOCMNBG-UHFFFAOYSA-N 1 2 243.253 2.250 20 0 BEADLO Cc1cc(F)ccc1[C@H](O)C[NH2+]CC(C)(F)F ZINC000819331893 586952972 /nfs/dbraw/zinc/95/29/72/586952972.db2.gz FHEVKENYVFOUEV-LLVKDONJSA-N 1 2 247.260 2.412 20 0 BEADLO CC[C@H](O)CNc1ccc([NH+](C)C)c(C)c1 ZINC000819409158 586961814 /nfs/dbraw/zinc/96/18/14/586961814.db2.gz XTZGEAOFEAUWOA-LBPRGKRZSA-N 1 2 222.332 2.244 20 0 BEADLO O[C@H](CNc1ccc(-n2cc[nH+]c2)cc1)C1CC1 ZINC000819447279 586964861 /nfs/dbraw/zinc/96/48/61/586964861.db2.gz WLBBYVMAHYXGPP-CQSZACIVSA-N 1 2 243.310 2.055 20 0 BEADLO CCC[C@H](C)CC(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819767349 586991379 /nfs/dbraw/zinc/99/13/79/586991379.db2.gz SGVYKHTYRQLFQW-DTWKUNHWSA-N 1 2 228.361 2.420 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)[C@H]2CCCC2(C)C)S1 ZINC000819781194 586993772 /nfs/dbraw/zinc/99/37/72/586993772.db2.gz JIWWIGSCVFVMGE-RKDXNWHRSA-N 1 2 240.372 2.420 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819780658 586993798 /nfs/dbraw/zinc/99/37/98/586993798.db2.gz IGPYUPARJDVHLH-VDDIYKPWSA-N 1 2 240.372 2.276 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)[C@@]2(C)CC=CCC2)S1 ZINC000819781073 586993829 /nfs/dbraw/zinc/99/38/29/586993829.db2.gz LDXIPNIRNWMULJ-CABZTGNLSA-N 1 2 238.356 2.340 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819780657 586994063 /nfs/dbraw/zinc/99/40/63/586994063.db2.gz IGPYUPARJDVHLH-PTRXPTGYSA-N 1 2 240.372 2.276 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)C[C@@H]2C=CCCC2)S1 ZINC000819781537 586994115 /nfs/dbraw/zinc/99/41/15/586994115.db2.gz KGJUGMHTRDVRBC-NXEZZACHSA-N 1 2 238.356 2.340 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)C2=CCCCCC2)S1 ZINC000819784019 586994696 /nfs/dbraw/zinc/99/46/96/586994696.db2.gz WJLXZFBGRSKLDQ-SECBINFHSA-N 1 2 238.356 2.484 20 0 BEADLO C=C/C(C)=C/CC(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819783964 586994700 /nfs/dbraw/zinc/99/47/00/586994700.db2.gz VKIAPYGVUXLLDV-QRJSTWQJSA-N 1 2 224.329 2.116 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)[C@H]2CCCC[C@H]2C)S1 ZINC000819784512 586994760 /nfs/dbraw/zinc/99/47/60/586994760.db2.gz ROTMWBHNTHVJAL-BBBLOLIVSA-N 1 2 240.372 2.420 20 0 BEADLO CCc1c[nH]c(CC(=O)N2C[C@@H](C)CC2(C)C)[nH+]1 ZINC000820526349 587052659 /nfs/dbraw/zinc/05/26/59/587052659.db2.gz KXJCDLCSCLDTRL-JTQLQIEISA-N 1 2 249.358 2.162 20 0 BEADLO C=C=CCNc1[nH+]cnc2c1cnn2C(C)(C)C ZINC000820586916 587056799 /nfs/dbraw/zinc/05/67/99/587056799.db2.gz XLSFVIWHZJFEIC-UHFFFAOYSA-N 1 2 243.314 2.334 20 0 BEADLO COc1cc([C@@H](C)[NH2+]Cc2ccco2)on1 ZINC000820805587 587073761 /nfs/dbraw/zinc/07/37/61/587073761.db2.gz NKSJMQLZAAKNDB-MRVPVSSYSA-N 1 2 222.244 2.127 20 0 BEADLO OC1(c2ccc(Cl)cc2)C[NH+](CCCF)C1 ZINC000821263814 587104004 /nfs/dbraw/zinc/10/40/04/587104004.db2.gz ZNYPDEFGCZPLMK-UHFFFAOYSA-N 1 2 243.709 2.203 20 0 BEADLO CC(C)C(=O)OCCc1cn2ccccc2[nH+]1 ZINC000821594556 587131582 /nfs/dbraw/zinc/13/15/82/587131582.db2.gz SJGHGNJNCBOVKS-UHFFFAOYSA-N 1 2 232.283 2.076 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)C2(C)CC=CC2)c2[nH+]ccn21 ZINC000821787315 587137953 /nfs/dbraw/zinc/13/79/53/587137953.db2.gz SIKIPQXBJCHVES-MNOVXSKESA-N 1 2 245.326 2.361 20 0 BEADLO CCC[C@@H](CC)C(=O)N[C@H]1CCn2cc[nH+]c2C1 ZINC000822131797 587155480 /nfs/dbraw/zinc/15/54/80/587155480.db2.gz FBUPQFODRMCYPR-NEPJUHHUSA-N 1 2 249.358 2.140 20 0 BEADLO C[C@@H]1CCC[C@]1(C)C(=O)NC1=[NH+]CCS1 ZINC000822234476 587158798 /nfs/dbraw/zinc/15/87/98/587158798.db2.gz VSVBKUDAUSDUMV-KCJUWKMLSA-N 1 2 226.345 2.032 20 0 BEADLO CCC[C@H]1CCC[C@H]1C(=O)NC1=[NH+]CCS1 ZINC000822234364 587158947 /nfs/dbraw/zinc/15/89/47/587158947.db2.gz PVQPDHMFTCYTAN-VHSXEESVSA-N 1 2 240.372 2.422 20 0 BEADLO CC[C@H]1CCC[C@H]1C(=O)NC1=[NH+]CCS1 ZINC000822234391 587159024 /nfs/dbraw/zinc/15/90/24/587159024.db2.gz RNZOIPGZCGQFJB-DTWKUNHWSA-N 1 2 226.345 2.032 20 0 BEADLO C[C@@H]1C[C@H]1C(=O)OCc1[nH]c[nH+]c1C(C)(C)C ZINC000822307959 587161461 /nfs/dbraw/zinc/16/14/61/587161461.db2.gz JAXBFWXXJSJSIA-RKDXNWHRSA-N 1 2 236.315 2.406 20 0 BEADLO CC(C)(C)c1[nH+]c[nH]c1COC(=O)C1CC1 ZINC000822327014 587162505 /nfs/dbraw/zinc/16/25/05/587162505.db2.gz ZDAHYJBXVHAYRR-UHFFFAOYSA-N 1 2 222.288 2.160 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CCCC23CCC3)[nH+]1 ZINC000822478701 587170470 /nfs/dbraw/zinc/17/04/70/587170470.db2.gz KVKDMSGNQMFXNY-UHFFFAOYSA-N 1 2 247.342 2.060 20 0 BEADLO CS[C@H]1CC[C@H]1[NH2+][C@@H](C)C(=O)OCC(C)C ZINC000822475953 587170645 /nfs/dbraw/zinc/17/06/45/587170645.db2.gz DZIWOKCCRPAGPJ-AXFHLTTASA-N 1 2 245.388 2.058 20 0 BEADLO CC/C(C)=C\C(=O)NCc1ccc[nH+]c1N(C)C ZINC000822509985 587172746 /nfs/dbraw/zinc/17/27/46/587172746.db2.gz RQZDCDSHYGAVFW-LUAWRHEFSA-N 1 2 247.342 2.120 20 0 BEADLO CCN(C(=O)Cc1[nH]cc[nH+]1)c1ccccc1C ZINC000822553968 587174815 /nfs/dbraw/zinc/17/48/15/587174815.db2.gz PXYMYOVIEMCZDO-UHFFFAOYSA-N 1 2 243.310 2.314 20 0 BEADLO CCC[C@@H](CC)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000823084722 587201936 /nfs/dbraw/zinc/20/19/36/587201936.db2.gz DHPNWTPSORVOCE-NXEZZACHSA-N 1 2 223.320 2.413 20 0 BEADLO CC(C)=C(C)CC(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000823237354 587210290 /nfs/dbraw/zinc/21/02/90/587210290.db2.gz SRSVJBACUNPWJA-NSHDSACASA-N 1 2 233.315 2.191 20 0 BEADLO C[C@@H]1CCN(C(=O)/C=C\c2cn(C)c[nH+]2)[C@H](C)C1 ZINC000823259274 587211872 /nfs/dbraw/zinc/21/18/72/587211872.db2.gz BNBLDLVANVPNNF-XLMCQVRKSA-N 1 2 247.342 2.080 20 0 BEADLO CCC[C@H](CC)C(=O)NCc1[nH+]ccn1CC ZINC000823308381 587215605 /nfs/dbraw/zinc/21/56/05/587215605.db2.gz YJEKCSLKISQCNP-NSHDSACASA-N 1 2 237.347 2.346 20 0 BEADLO CN(CCC(C)(C)C)C(=O)/C=C\c1cn(C)c[nH+]1 ZINC000823522662 587229370 /nfs/dbraw/zinc/22/93/70/587229370.db2.gz LJCBAGNGVSPILM-SREVYHEPSA-N 1 2 249.358 2.328 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)C(=O)C(C)(C)C ZINC000823836297 587241715 /nfs/dbraw/zinc/24/17/15/587241715.db2.gz IEAPFBJAYDZWGW-UHFFFAOYSA-N 1 2 234.299 2.252 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)C[C@H]1CCCOC1 ZINC000823837090 587241961 /nfs/dbraw/zinc/24/19/61/587241961.db2.gz XUZNDXMQRVJJRS-GFCCVEGCSA-N 1 2 248.326 2.454 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)/C=C\[C@@H]1CCCO1 ZINC000823837079 587242066 /nfs/dbraw/zinc/24/20/66/587242066.db2.gz XBGCOWJQWWTKKF-FJOGCWAESA-N 1 2 246.310 2.372 20 0 BEADLO CCC[C@H](CC)C(=O)N[C@@H]1CCn2c[nH+]cc2C1 ZINC000824046121 587251156 /nfs/dbraw/zinc/25/11/56/587251156.db2.gz JDAANBUPZXNNAH-NWDGAFQWSA-N 1 2 249.358 2.140 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1cc(F)ncc1F ZINC000824314220 587266049 /nfs/dbraw/zinc/26/60/49/587266049.db2.gz HVXJPIIZDJEMLV-YUMQZZPRSA-N 1 2 212.243 2.343 20 0 BEADLO CCc1nn(C)c(Cl)c1C[N@@H+]1CC[C@H](F)C1 ZINC000824570373 587277287 /nfs/dbraw/zinc/27/72/87/587277287.db2.gz CQLKGEBLOXDNCJ-QMMMGPOBSA-N 1 2 245.729 2.180 20 0 BEADLO CCc1nn(C)c(Cl)c1C[N@H+]1CC[C@H](F)C1 ZINC000824570373 587277288 /nfs/dbraw/zinc/27/72/88/587277288.db2.gz CQLKGEBLOXDNCJ-QMMMGPOBSA-N 1 2 245.729 2.180 20 0 BEADLO C[C@@H]1C[C@@H]2C[C@@H]2C[C@@H]1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000824629276 587280273 /nfs/dbraw/zinc/28/02/73/587280273.db2.gz RMLOMYPFOFBNKU-UZWSLXQKSA-N 1 2 247.342 2.050 20 0 BEADLO C[C@@H]1C[C@@H]2C[C@@H]2C[C@@H]1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000824629276 587280274 /nfs/dbraw/zinc/28/02/74/587280274.db2.gz RMLOMYPFOFBNKU-UZWSLXQKSA-N 1 2 247.342 2.050 20 0 BEADLO Cn1c(Cl)cnc1C[N@@H+]1CC[C@@H]1C1CC1 ZINC000824655676 587281642 /nfs/dbraw/zinc/28/16/42/587281642.db2.gz YQVGLEIOIRKKDV-SECBINFHSA-N 1 2 225.723 2.058 20 0 BEADLO Cn1c(Cl)cnc1C[N@H+]1CC[C@@H]1C1CC1 ZINC000824655676 587281643 /nfs/dbraw/zinc/28/16/43/587281643.db2.gz YQVGLEIOIRKKDV-SECBINFHSA-N 1 2 225.723 2.058 20 0 BEADLO CC(C)(CNC(=O)CCC1(C)CC1)n1cc[nH+]c1 ZINC000825531260 587323595 /nfs/dbraw/zinc/32/35/95/587323595.db2.gz JQLQZTYKQVVWME-UHFFFAOYSA-N 1 2 249.358 2.315 20 0 BEADLO CC(C(=O)Nc1cc[nH+]c(C)c1)=C1CCC1 ZINC000825862913 587342617 /nfs/dbraw/zinc/34/26/17/587342617.db2.gz JRCXGNKRMNSUFU-UHFFFAOYSA-N 1 2 216.284 2.251 20 0 BEADLO CC(C)[C@@H]1CCCC[C@@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000826043942 587349548 /nfs/dbraw/zinc/34/95/48/587349548.db2.gz WMOJLSPLCPFXTK-RYUDHWBXSA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)[C@@H]1CCC[C@H](NC(=O)Cc2[nH]cc[nH+]2)C1 ZINC000826131767 587351178 /nfs/dbraw/zinc/35/11/78/587351178.db2.gz ZWSKQAZKFYPBHG-NEPJUHHUSA-N 1 2 249.358 2.283 20 0 BEADLO COc1cncc(C[N@@H+]2CCC[C@H](F)C2)c1 ZINC000826143097 587351390 /nfs/dbraw/zinc/35/13/90/587351390.db2.gz SDVODSSRWYGGAM-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO COc1cncc(C[N@H+]2CCC[C@H](F)C2)c1 ZINC000826143097 587351391 /nfs/dbraw/zinc/35/13/91/587351391.db2.gz SDVODSSRWYGGAM-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO CC[C@@H](C)[C@H](C)N(C(=O)Cc1[nH]cc[nH+]1)C1CC1 ZINC000826564070 587355070 /nfs/dbraw/zinc/35/50/70/587355070.db2.gz ARQYLYMGFXZKPF-MNOVXSKESA-N 1 2 249.358 2.378 20 0 BEADLO CC[C@@H](C)[C@@H](C)N(C(=O)Cc1[nH]cc[nH+]1)C1CC1 ZINC000826564064 587355170 /nfs/dbraw/zinc/35/51/70/587355170.db2.gz ARQYLYMGFXZKPF-GHMZBOCLSA-N 1 2 249.358 2.378 20 0 BEADLO C[N@@H+]1Cc2ccccc2[C@H]1CNC(=O)C1(C)CC1 ZINC000826708809 587359790 /nfs/dbraw/zinc/35/97/90/587359790.db2.gz FTHFHSCAMRDSBB-CYBMUJFWSA-N 1 2 244.338 2.089 20 0 BEADLO C[N@H+]1Cc2ccccc2[C@H]1CNC(=O)C1(C)CC1 ZINC000826708809 587359791 /nfs/dbraw/zinc/35/97/91/587359791.db2.gz FTHFHSCAMRDSBB-CYBMUJFWSA-N 1 2 244.338 2.089 20 0 BEADLO CC[C@H](C)C(=O)NC[C@H]1c2ccccc2C[N@H+]1C ZINC000826731805 587360506 /nfs/dbraw/zinc/36/05/06/587360506.db2.gz ZMXNFLRYTRZERZ-FZMZJTMJSA-N 1 2 246.354 2.335 20 0 BEADLO CC[C@H](C)C(=O)NC[C@H]1c2ccccc2C[N@@H+]1C ZINC000826731805 587360507 /nfs/dbraw/zinc/36/05/07/587360507.db2.gz ZMXNFLRYTRZERZ-FZMZJTMJSA-N 1 2 246.354 2.335 20 0 BEADLO Cc1cc(C[NH2+][C@H]2C[C@@H](O)c3ccccc32)no1 ZINC000827170358 587371818 /nfs/dbraw/zinc/37/18/18/587371818.db2.gz IDFSGBFELRIGSA-UONOGXRCSA-N 1 2 244.294 2.251 20 0 BEADLO CC(C)c1ccccc1C(=O)NCc1[nH]cc[nH+]1 ZINC000827301279 587376102 /nfs/dbraw/zinc/37/61/02/587376102.db2.gz YGXRWCXNIYZJRS-UHFFFAOYSA-N 1 2 243.310 2.463 20 0 BEADLO Cc1c[nH]c(CNC(=O)[C@@H]2C[C@@H]3CCCC[C@H]23)[nH+]1 ZINC000827582715 587390422 /nfs/dbraw/zinc/39/04/22/587390422.db2.gz VVRYXCWXDFTCGG-SDDRHHMPSA-N 1 2 247.342 2.161 20 0 BEADLO Cc1c[nH]c(CNC(=O)[C@@H]2CC[C@@H]3C[C@@H]3CC2)[nH+]1 ZINC000827582655 587390725 /nfs/dbraw/zinc/39/07/25/587390725.db2.gz STNBYRHUCZFCTC-CNDDSTCGSA-N 1 2 247.342 2.161 20 0 BEADLO CC/C(C)=C\C(=O)N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000827722061 587399438 /nfs/dbraw/zinc/39/94/38/587399438.db2.gz XWIVTVYCHQKWJI-MMRAYRKESA-N 1 2 247.342 2.092 20 0 BEADLO c1cn(Cc2ccccc2OC2CC2)c[nH+]1 ZINC000828109498 587419629 /nfs/dbraw/zinc/41/96/29/587419629.db2.gz ITSJHRPCEHPGMJ-UHFFFAOYSA-N 1 2 214.268 2.473 20 0 BEADLO Cc1ccc(C[NH+]2CC(C(F)(F)F)C2)nc1 ZINC000828408455 587440365 /nfs/dbraw/zinc/44/03/65/587440365.db2.gz SUQMPRAQUVNOJT-UHFFFAOYSA-N 1 2 230.233 2.384 20 0 BEADLO Nc1ccc(CCC(=O)OCC2=CCCC2)c[nH+]1 ZINC000828955974 587475489 /nfs/dbraw/zinc/47/54/89/587475489.db2.gz FBVGGVZGOFGJSC-UHFFFAOYSA-N 1 2 246.310 2.250 20 0 BEADLO CCC[C@H]1[C@@H](C)CCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC000829016237 587479894 /nfs/dbraw/zinc/47/98/94/587479894.db2.gz PXVJBIINUPGFGT-RYUDHWBXSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H]1C[C@H](Nc2cncc(Cl)n2)c2[nH+]ccn21 ZINC000829126842 587483749 /nfs/dbraw/zinc/48/37/49/587483749.db2.gz OHNNGAKDCBLDQU-SFYZADRCSA-N 1 2 249.705 2.444 20 0 BEADLO CCC[C@H](C)CCNC(=O)/C=C\c1cn(C)c[nH+]1 ZINC000829165414 587486034 /nfs/dbraw/zinc/48/60/34/587486034.db2.gz QIIBFQWVLCOJMJ-DGMVEKRQSA-N 1 2 249.358 2.376 20 0 BEADLO C[C@@H]1CC(C)(C)CC[C@@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000829663328 587508502 /nfs/dbraw/zinc/50/85/02/587508502.db2.gz FEMNWRARRDFAKH-MNOVXSKESA-N 1 2 249.358 2.283 20 0 BEADLO CCC[C@H](C)[C@H]1CCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC000830498829 587554285 /nfs/dbraw/zinc/55/42/85/587554285.db2.gz RBCOJDQICCRSLV-NWDGAFQWSA-N 1 2 249.358 2.379 20 0 BEADLO Nc1cc(COC(=O)/C=C/C2CCCC2)cc[nH+]1 ZINC000830788565 587570311 /nfs/dbraw/zinc/57/03/11/587570311.db2.gz REBFLQJUGPFLIT-AATRIKPKSA-N 1 2 246.310 2.453 20 0 BEADLO O[C@@]1(C(F)F)CC[N@H+](C/C(Cl)=C\Cl)C1 ZINC000831176036 587589668 /nfs/dbraw/zinc/58/96/68/587589668.db2.gz RKVJWBCLTUQYID-HFSLJOEWSA-N 1 2 246.084 2.007 20 0 BEADLO O[C@@]1(C(F)F)CC[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000831176036 587589670 /nfs/dbraw/zinc/58/96/70/587589670.db2.gz RKVJWBCLTUQYID-HFSLJOEWSA-N 1 2 246.084 2.007 20 0 BEADLO O=C([C@H]1C[C@H]2C[C@H]2C1)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000831607639 587623158 /nfs/dbraw/zinc/62/31/58/587623158.db2.gz UTKLEWRNYQFILA-NOOOWODRSA-N 1 2 245.326 2.119 20 0 BEADLO CCC(F)(F)C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000831607804 587623591 /nfs/dbraw/zinc/62/35/91/587623591.db2.gz WPUGIEXYYLXEAN-QMMMGPOBSA-N 1 2 243.257 2.119 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)Nc1ccc(C2CC2)cc1 ZINC000831629331 587624449 /nfs/dbraw/zinc/62/44/49/587624449.db2.gz LOKIHPKCMGPLJA-UHFFFAOYSA-N 1 2 241.294 2.468 20 0 BEADLO CCC[C@@H]1CCCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC000832147548 587646659 /nfs/dbraw/zinc/64/66/59/587646659.db2.gz JKBKYBULVKVHDT-LLVKDONJSA-N 1 2 235.331 2.133 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833272545 587703817 /nfs/dbraw/zinc/70/38/17/587703817.db2.gz PIUKWPCXEGEVHC-UTUOFQBUSA-N 1 2 247.342 2.270 20 0 BEADLO C/C(=C/C(=O)N[C@H]1CCn2cc[nH+]c21)C(C)(C)C ZINC000833286665 587704587 /nfs/dbraw/zinc/70/45/87/587704587.db2.gz ZGBJODURZRSTSG-JUDLJHIGSA-N 1 2 247.342 2.437 20 0 BEADLO CCCC1(C(=O)N[C@H]2CCn3cc[nH+]c32)CC1 ZINC000833284713 587704716 /nfs/dbraw/zinc/70/47/16/587704716.db2.gz KFNATXUAXBDELR-JTQLQIEISA-N 1 2 233.315 2.024 20 0 BEADLO O=C(CCC1CCC1)N[C@H]1CCn2cc[nH+]c21 ZINC000833285797 587704724 /nfs/dbraw/zinc/70/47/24/587704724.db2.gz SWJFAHGIAQGNRP-NSHDSACASA-N 1 2 233.315 2.024 20 0 BEADLO CC(C)(C)CCC(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833292681 587704748 /nfs/dbraw/zinc/70/47/48/587704748.db2.gz KCIDIGIZIHIYQB-SNVBAGLBSA-N 1 2 235.331 2.270 20 0 BEADLO Cc1ccc(C(=O)N[C@@H]2CCn3cc[nH+]c32)cc1 ZINC000833305477 587705313 /nfs/dbraw/zinc/70/53/13/587705313.db2.gz QJOHFROROKJABI-GFCCVEGCSA-N 1 2 241.294 2.066 20 0 BEADLO Cc1ccc(C(=O)N[C@H]2CCn3cc[nH+]c32)cc1 ZINC000833305478 587705492 /nfs/dbraw/zinc/70/54/92/587705492.db2.gz QJOHFROROKJABI-LBPRGKRZSA-N 1 2 241.294 2.066 20 0 BEADLO O=C(CC1CCCC1)N[C@@H]1CCn2cc[nH+]c21 ZINC000833303818 587705524 /nfs/dbraw/zinc/70/55/24/587705524.db2.gz ASZXVVJZNFAFPV-LLVKDONJSA-N 1 2 233.315 2.024 20 0 BEADLO O=C1C[C@@H](Oc2ccc([NH2+]CC3CCC3)cc2)N1 ZINC000834664343 587763384 /nfs/dbraw/zinc/76/33/84/587763384.db2.gz PLJYULGZQTZAFO-CQSZACIVSA-N 1 2 246.310 2.123 20 0 BEADLO CC1CCC(C)(CNC(=O)Cc2[nH]cc[nH+]2)CC1 ZINC000834808920 587767253 /nfs/dbraw/zinc/76/72/53/587767253.db2.gz WIOIIOGAHCYZKT-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)[C@]1(C)CC=CCC1 ZINC000835323523 587796439 /nfs/dbraw/zinc/79/64/39/587796439.db2.gz NESCSEVVPDQMJD-CQSZACIVSA-N 1 2 248.326 2.252 20 0 BEADLO C[C@H]1CCC[C@@]1(C)C(=O)OCCn1cc[nH+]c1 ZINC000835349764 587798085 /nfs/dbraw/zinc/79/80/85/587798085.db2.gz KATXXTSQMNFGBC-WCQYABFASA-N 1 2 236.315 2.253 20 0 BEADLO Cc1[nH+]c2cc(OC(=O)[C@H]3C[C@@H]3C)ccc2n1C ZINC000835503225 587806044 /nfs/dbraw/zinc/80/60/44/587806044.db2.gz BZDNOHORDLORTG-KWQFWETISA-N 1 2 244.294 2.443 20 0 BEADLO CC/C=C(/F)C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000867179764 587834881 /nfs/dbraw/zinc/83/48/81/587834881.db2.gz PUBIGEGPOPNJIB-WXLQGSQKSA-N 1 2 237.278 2.337 20 0 BEADLO CC/C=C(\F)C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000867179758 587834902 /nfs/dbraw/zinc/83/49/02/587834902.db2.gz PUBIGEGPOPNJIB-FWAPLPHYSA-N 1 2 237.278 2.337 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)NOC1CCC1 ZINC000836608979 587835649 /nfs/dbraw/zinc/83/56/49/587835649.db2.gz GIKCJYXBXSLFHT-UHFFFAOYSA-N 1 2 235.287 2.304 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CCCCCCCC1 ZINC000836921391 587842916 /nfs/dbraw/zinc/84/29/16/587842916.db2.gz GBFQEOPMRBEQCA-UHFFFAOYSA-N 1 2 249.358 2.443 20 0 BEADLO CCCCCCC(=O)NCCc1cn(C)c[nH+]1 ZINC000837714840 587892256 /nfs/dbraw/zinc/89/22/56/587892256.db2.gz JHHDZQIDSJHEKD-UHFFFAOYSA-N 1 2 237.347 2.049 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)NCCc1cn(C)c[nH+]1 ZINC000837717635 587892420 /nfs/dbraw/zinc/89/24/20/587892420.db2.gz HVHCZZCOGGSUSU-DHZHZOJOSA-N 1 2 249.358 2.071 20 0 BEADLO CCc1ncc(C[NH+]2CCC(F)(F)CC2)cn1 ZINC000840940978 587930837 /nfs/dbraw/zinc/93/08/37/587930837.db2.gz LOINJFHMVABSER-UHFFFAOYSA-N 1 2 241.285 2.270 20 0 BEADLO CC[C@H](CC(=O)NC1=[NH+]CCS1)C(C)C ZINC000104213233 587949252 /nfs/dbraw/zinc/94/92/52/587949252.db2.gz ZPBBGGHJKUQKHO-SECBINFHSA-N 1 2 228.361 2.278 20 0 BEADLO CC[C@@H](CO[NH+]=C(N)c1ccccc1C)OC ZINC000842013186 587988882 /nfs/dbraw/zinc/98/88/82/587988882.db2.gz IHLFXZQHQUSRMJ-NSHDSACASA-N 1 2 236.315 2.267 20 0 BEADLO CC[C@H](CO[NH+]=C(N)c1cccc(F)c1)OC ZINC000842026129 587989849 /nfs/dbraw/zinc/98/98/49/587989849.db2.gz HNRSSYKZLXDRAI-LLVKDONJSA-N 1 2 240.278 2.097 20 0 BEADLO CC[NH2+]Cc1noc(/C=C/c2ncccc2C)n1 ZINC000843140956 588086424 /nfs/dbraw/zinc/08/64/24/588086424.db2.gz FZMXMGDTXFZZAL-VOTSOKGWSA-N 1 2 244.298 2.053 20 0 BEADLO CCCCCCOCc1nc(C[NH2+]CC)no1 ZINC000843144837 588086541 /nfs/dbraw/zinc/08/65/41/588086541.db2.gz LPYAYPHTCGVGEB-UHFFFAOYSA-N 1 2 241.335 2.276 20 0 BEADLO CC[NH2+]Cc1noc(/C=C/c2cccs2)n1 ZINC000843145565 588087098 /nfs/dbraw/zinc/08/70/98/588087098.db2.gz KQSMBQYPLLOPAG-AATRIKPKSA-N 1 2 235.312 2.411 20 0 BEADLO C[C@H]1Cc2cc(-c3[nH]cc[nH+]3)ccc2O1 ZINC000844228056 588173716 /nfs/dbraw/zinc/17/37/16/588173716.db2.gz XETNLZDELCQLBO-QMMMGPOBSA-N 1 2 200.241 2.400 20 0 BEADLO O=C(NC1=[NH+]CCS1)[C@@H]1C[C@H]1C1CCCC1 ZINC000844317334 588184301 /nfs/dbraw/zinc/18/43/01/588184301.db2.gz QPZYBXLBUNGFTF-VHSXEESVSA-N 1 2 238.356 2.032 20 0 BEADLO Cc1nnsc1C[NH+]1CCC(F)(F)CC1 ZINC000844323970 588185249 /nfs/dbraw/zinc/18/52/49/588185249.db2.gz DZVPNEFTFUMZAO-UHFFFAOYSA-N 1 2 233.287 2.078 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nccc(C)n2)[C@H](CC)CO1 ZINC000844387379 588188834 /nfs/dbraw/zinc/18/88/34/588188834.db2.gz QWQAWEWEEROSFU-CHWSQXEVSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nccc(C)n2)[C@H](CC)CO1 ZINC000844387379 588188835 /nfs/dbraw/zinc/18/88/35/588188835.db2.gz QWQAWEWEEROSFU-CHWSQXEVSA-N 1 2 249.358 2.174 20 0 BEADLO FC1(F)C[C@@]12CCC[N@H+](Cc1csnn1)C2 ZINC000844439845 588193500 /nfs/dbraw/zinc/19/35/00/588193500.db2.gz AFENPIGRKNNPGP-SECBINFHSA-N 1 2 245.298 2.159 20 0 BEADLO FC1(F)C[C@@]12CCC[N@@H+](Cc1csnn1)C2 ZINC000844439845 588193502 /nfs/dbraw/zinc/19/35/02/588193502.db2.gz AFENPIGRKNNPGP-SECBINFHSA-N 1 2 245.298 2.159 20 0 BEADLO C[C@@H](CC(=O)O[C@@H](C)C1CC1)n1cc[nH+]c1 ZINC000844457638 588196659 /nfs/dbraw/zinc/19/66/59/588196659.db2.gz DJHOMUTUMMVHHG-UWVGGRQHSA-N 1 2 222.288 2.176 20 0 BEADLO C[C@H](CC(=O)N[C@@H]1CC[C@@H](C)C1)n1cc[nH+]c1 ZINC000844491978 588199592 /nfs/dbraw/zinc/19/95/92/588199592.db2.gz VJUOEWNNQLRKMT-IJLUTSLNSA-N 1 2 235.331 2.139 20 0 BEADLO C[C@H](CC(=O)OC/C=C\Cl)n1cc[nH+]c1 ZINC000845279450 588225208 /nfs/dbraw/zinc/22/52/08/588225208.db2.gz WOAUGRKVWXRPCI-PKRMOACSSA-N 1 2 228.679 2.130 20 0 BEADLO C[C@H](CC(=O)O[C@@H]1C=CCCC1)n1cc[nH+]c1 ZINC000845282339 588225356 /nfs/dbraw/zinc/22/53/56/588225356.db2.gz NZHIKTJMVSFOIK-VXGBXAGGSA-N 1 2 234.299 2.486 20 0 BEADLO C[C@@H](CC(=O)OCC1CCC1)n1cc[nH+]c1 ZINC000845280766 588225432 /nfs/dbraw/zinc/22/54/32/588225432.db2.gz DQLXYEUWPSXGET-JTQLQIEISA-N 1 2 222.288 2.178 20 0 BEADLO C[C@H]1CC[C@H](C(=O)OCc2c[nH+]cn2C)CC1 ZINC000845479754 588229923 /nfs/dbraw/zinc/22/99/23/588229923.db2.gz ULPRXKDXSRLDCH-XYPYZODXSA-N 1 2 236.315 2.290 20 0 BEADLO C[C@H](CC(=O)OCC1CC=CC1)n1cc[nH+]c1 ZINC000845492497 588230586 /nfs/dbraw/zinc/23/05/86/588230586.db2.gz GBIWLXRBNKDKKP-LLVKDONJSA-N 1 2 234.299 2.344 20 0 BEADLO C[C@H](CC(=O)OCC1(C)CC1)n1cc[nH+]c1 ZINC000845546833 588233275 /nfs/dbraw/zinc/23/32/75/588233275.db2.gz DQVSFYYIJDUUJZ-SNVBAGLBSA-N 1 2 222.288 2.178 20 0 BEADLO C[C@H](CC(=O)OC1CC(C)C1)n1cc[nH+]c1 ZINC000845573548 588233661 /nfs/dbraw/zinc/23/36/61/588233661.db2.gz BADOGVCPEUAEFX-HSOILSAZSA-N 1 2 222.288 2.176 20 0 BEADLO Cc1nc(N2CCC[C@@]3(CC3(F)F)C2)cc[nH+]1 ZINC000845743861 588243573 /nfs/dbraw/zinc/24/35/73/588243573.db2.gz YSJSYLYNAAHERX-LLVKDONJSA-N 1 2 239.269 2.411 20 0 BEADLO CCCC[C@H]1CCC[C@@H]1[NH2+]CC(=O)NOCC ZINC000846090500 588256147 /nfs/dbraw/zinc/25/61/47/588256147.db2.gz BMTSMTKAYWGHEU-RYUDHWBXSA-N 1 2 242.363 2.003 20 0 BEADLO Cc1nc(F)ccc1C[N@@H+]1CCC[C@@H](F)C1 ZINC000846119956 588258049 /nfs/dbraw/zinc/25/80/49/588258049.db2.gz LIFVGNCMRXRHLS-LLVKDONJSA-N 1 2 226.270 2.463 20 0 BEADLO Cc1nc(F)ccc1C[N@H+]1CCC[C@@H](F)C1 ZINC000846119956 588258050 /nfs/dbraw/zinc/25/80/50/588258050.db2.gz LIFVGNCMRXRHLS-LLVKDONJSA-N 1 2 226.270 2.463 20 0 BEADLO Fc1cncc(C[N@H+]2CCC[C@H](F)C2)c1 ZINC000846119904 588258154 /nfs/dbraw/zinc/25/81/54/588258154.db2.gz JUSLMIMJLWOIND-JTQLQIEISA-N 1 2 212.243 2.155 20 0 BEADLO Fc1cncc(C[N@@H+]2CCC[C@H](F)C2)c1 ZINC000846119904 588258155 /nfs/dbraw/zinc/25/81/55/588258155.db2.gz JUSLMIMJLWOIND-JTQLQIEISA-N 1 2 212.243 2.155 20 0 BEADLO C[C@@H](CC(=O)NC(C)(C)c1[nH]cc[nH+]1)C1CC1 ZINC000846247122 588262393 /nfs/dbraw/zinc/26/23/93/588262393.db2.gz VBMHCTRGIVKGEV-VIFPVBQESA-N 1 2 235.331 2.197 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)[C@@H]2CC[C@@H](C)CC2)S1 ZINC000846270609 588263307 /nfs/dbraw/zinc/26/33/07/588263307.db2.gz JXHPQDAOSRPYCQ-GUBZILKMSA-N 1 2 240.372 2.420 20 0 BEADLO CCCC(C)(C)C(=O)NC1=[NH+]C[C@H](C)S1 ZINC000846269907 588263471 /nfs/dbraw/zinc/26/34/71/588263471.db2.gz XALIMJSEGQROOC-QMMMGPOBSA-N 1 2 228.361 2.420 20 0 BEADLO C[C@H]1Cc2cc([NH2+]CC3(C)COC3)ccc2O1 ZINC000846748957 588284782 /nfs/dbraw/zinc/28/47/82/588284782.db2.gz PPBMBLJBCPINHH-JTQLQIEISA-N 1 2 233.311 2.458 20 0 BEADLO C[C@@H]1C[C@H](C)C[N@@H+](Cc2cnsn2)C1 ZINC000846768431 588286882 /nfs/dbraw/zinc/28/68/82/588286882.db2.gz JTNSVFTXUKUOLB-DTORHVGOSA-N 1 2 211.334 2.016 20 0 BEADLO C[C@@H]1C[C@H](C)C[N@H+](Cc2cnsn2)C1 ZINC000846768431 588286883 /nfs/dbraw/zinc/28/68/83/588286883.db2.gz JTNSVFTXUKUOLB-DTORHVGOSA-N 1 2 211.334 2.016 20 0 BEADLO CC[N@H+](Cc1cnsn1)C1CCCC1 ZINC000846774053 588287206 /nfs/dbraw/zinc/28/72/06/588287206.db2.gz ONDFDFWBSUJVJF-UHFFFAOYSA-N 1 2 211.334 2.303 20 0 BEADLO CC[N@@H+](Cc1cnsn1)C1CCCC1 ZINC000846774053 588287207 /nfs/dbraw/zinc/28/72/07/588287207.db2.gz ONDFDFWBSUJVJF-UHFFFAOYSA-N 1 2 211.334 2.303 20 0 BEADLO Cc1c[nH+]cc(NCc2cnc(Cl)n2C)c1 ZINC000846775078 588287612 /nfs/dbraw/zinc/28/76/12/588287612.db2.gz YZSBVPCEOUZJFW-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO Fc1cc(C[N@@H+]2CCCOCC2)cnc1Cl ZINC000846791750 588288286 /nfs/dbraw/zinc/28/82/86/588288286.db2.gz SBKIPCIQEFZSIJ-UHFFFAOYSA-N 1 2 244.697 2.096 20 0 BEADLO Fc1cc(C[N@H+]2CCCOCC2)cnc1Cl ZINC000846791750 588288287 /nfs/dbraw/zinc/28/82/87/588288287.db2.gz SBKIPCIQEFZSIJ-UHFFFAOYSA-N 1 2 244.697 2.096 20 0 BEADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1cnsn1 ZINC000846804276 588289465 /nfs/dbraw/zinc/28/94/65/588289465.db2.gz YSBAFYNYTHPYKZ-DTORHVGOSA-N 1 2 211.334 2.301 20 0 BEADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1cnsn1 ZINC000846804276 588289466 /nfs/dbraw/zinc/28/94/66/588289466.db2.gz YSBAFYNYTHPYKZ-DTORHVGOSA-N 1 2 211.334 2.301 20 0 BEADLO c1nsnc1C[N@@H+]1CCC[C@H]2CCC[C@@H]21 ZINC000846805762 588289592 /nfs/dbraw/zinc/28/95/92/588289592.db2.gz IGQFGLVYRYZGTC-KOLCDFICSA-N 1 2 223.345 2.303 20 0 BEADLO c1nsnc1C[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC000846805762 588289593 /nfs/dbraw/zinc/28/95/93/588289593.db2.gz IGQFGLVYRYZGTC-KOLCDFICSA-N 1 2 223.345 2.303 20 0 BEADLO CO[C@H]1CC[N@H+](Cc2cnc(Cl)c(F)c2)C1 ZINC000846812352 588290771 /nfs/dbraw/zinc/29/07/71/588290771.db2.gz UHUMLEWGTKHYOJ-VIFPVBQESA-N 1 2 244.697 2.095 20 0 BEADLO CO[C@H]1CC[N@@H+](Cc2cnc(Cl)c(F)c2)C1 ZINC000846812352 588290772 /nfs/dbraw/zinc/29/07/72/588290772.db2.gz UHUMLEWGTKHYOJ-VIFPVBQESA-N 1 2 244.697 2.095 20 0 BEADLO Cc1ccc(C[NH+]2CC(C(F)(F)F)C2)cn1 ZINC000846832781 588291553 /nfs/dbraw/zinc/29/15/53/588291553.db2.gz UGXFTYQJHNYIRX-UHFFFAOYSA-N 1 2 230.233 2.384 20 0 BEADLO C[C@H]1CC[N@H+](Cc2cnsn2)CC1(C)C ZINC000846856722 588293915 /nfs/dbraw/zinc/29/39/15/588293915.db2.gz SAPUNRCJCZZERR-VIFPVBQESA-N 1 2 225.361 2.406 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2cnsn2)CC1(C)C ZINC000846856722 588293916 /nfs/dbraw/zinc/29/39/16/588293916.db2.gz SAPUNRCJCZZERR-VIFPVBQESA-N 1 2 225.361 2.406 20 0 BEADLO CC[N@@H+](Cc1cnsn1)CC1CCC1 ZINC000846881902 588295167 /nfs/dbraw/zinc/29/51/67/588295167.db2.gz DNYYMMSOCRXXRW-UHFFFAOYSA-N 1 2 211.334 2.160 20 0 BEADLO CC[N@H+](Cc1cnsn1)CC1CCC1 ZINC000846881902 588295168 /nfs/dbraw/zinc/29/51/68/588295168.db2.gz DNYYMMSOCRXXRW-UHFFFAOYSA-N 1 2 211.334 2.160 20 0 BEADLO CC(C)(C)[C@H]1CCCN(C(=O)Cc2[nH]cc[nH+]2)C1 ZINC000846937990 588297667 /nfs/dbraw/zinc/29/76/67/588297667.db2.gz MRPWIGXFODLTPL-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO CON1CC[NH+](Cc2ccc(Cl)s2)CC1 ZINC000846974502 588299438 /nfs/dbraw/zinc/29/94/38/588299438.db2.gz BLIODLKVTORVFV-UHFFFAOYSA-N 1 2 246.763 2.081 20 0 BEADLO CC[NH2+]Cc1noc(/C(C)=C\c2cccnc2)n1 ZINC000848618366 588402134 /nfs/dbraw/zinc/40/21/34/588402134.db2.gz SORQSBVNHGOLDM-YFHOEESVSA-N 1 2 244.298 2.135 20 0 BEADLO COc1c(C)[nH+]cnc1NCC(C)(C)SC ZINC000848670688 588404691 /nfs/dbraw/zinc/40/46/91/588404691.db2.gz VYYVFYDOXRQEPO-UHFFFAOYSA-N 1 2 241.360 2.347 20 0 BEADLO CCc1nc(N2Cc3ccncc3C2)cc(C)[nH+]1 ZINC000848727388 588408894 /nfs/dbraw/zinc/40/88/94/588408894.db2.gz ZQWMRUVYYNLUHR-UHFFFAOYSA-N 1 2 240.310 2.263 20 0 BEADLO Cn1c(Cl)ncc1C[N@H+](C)Cc1ccoc1 ZINC000848884154 588417004 /nfs/dbraw/zinc/41/70/04/588417004.db2.gz YVWZKPMWRDSZLJ-UHFFFAOYSA-N 1 2 239.706 2.299 20 0 BEADLO Cn1c(Cl)ncc1C[N@@H+](C)Cc1ccoc1 ZINC000848884154 588417005 /nfs/dbraw/zinc/41/70/05/588417005.db2.gz YVWZKPMWRDSZLJ-UHFFFAOYSA-N 1 2 239.706 2.299 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1cnc(Cl)n1C ZINC000848908461 588419352 /nfs/dbraw/zinc/41/93/52/588419352.db2.gz VFRWTLRMCVNYNS-HTQZYQBOSA-N 1 2 213.712 2.056 20 0 BEADLO CCc1cc(NCc2[nH+]ccn2C(C)C)nn1C ZINC000850329033 588536840 /nfs/dbraw/zinc/53/68/40/588536840.db2.gz GQKUBONDFACUGF-UHFFFAOYSA-N 1 2 247.346 2.372 20 0 BEADLO O[C@@H]1C[C@H]([NH2+]Cc2cscn2)c2ccccc21 ZINC000850371776 588540978 /nfs/dbraw/zinc/54/09/78/588540978.db2.gz LVNJYHKJUUHBNX-QWHCGFSZSA-N 1 2 246.335 2.411 20 0 BEADLO Cn1c[nH+]c(CNCC(F)(F)C(C)(C)C)c1 ZINC000850410565 588545208 /nfs/dbraw/zinc/54/52/08/588545208.db2.gz WJENTWXFQFTKMW-UHFFFAOYSA-N 1 2 231.290 2.191 20 0 BEADLO CCc1nc(C[NH2+][C@@H]2CCCn3nccc32)co1 ZINC000850472498 588548806 /nfs/dbraw/zinc/54/88/06/588548806.db2.gz IVLAMVLNKQSFGN-LLVKDONJSA-N 1 2 246.314 2.058 20 0 BEADLO c1c[nH]c([C@H]([NH2+][C@@H]2C=CCC2)c2cccnc2)n1 ZINC000850510895 588555314 /nfs/dbraw/zinc/55/53/14/588555314.db2.gz XEZOMNMLGSRNMU-CHWSQXEVSA-N 1 2 240.310 2.202 20 0 BEADLO C[C@H](CC(=O)OCC1CC(C)C1)n1cc[nH+]c1 ZINC000851465321 588606538 /nfs/dbraw/zinc/60/65/38/588606538.db2.gz YSWKNNAKIZWBQO-MOENNCHZSA-N 1 2 236.315 2.424 20 0 BEADLO CCC(F)(F)COC(=O)[C@@H]1CCCC[N@@H+]1C ZINC000851490735 588607732 /nfs/dbraw/zinc/60/77/32/588607732.db2.gz FFBUHKBJJSWAPC-VIFPVBQESA-N 1 2 235.274 2.059 20 0 BEADLO CCC(F)(F)COC(=O)[C@@H]1CCCC[N@H+]1C ZINC000851490735 588607733 /nfs/dbraw/zinc/60/77/33/588607733.db2.gz FFBUHKBJJSWAPC-VIFPVBQESA-N 1 2 235.274 2.059 20 0 BEADLO CCC[N@H+](Cc1cnon1)Cc1ccccc1 ZINC000851713126 588615925 /nfs/dbraw/zinc/61/59/25/588615925.db2.gz YHENYHZTPSSQPO-UHFFFAOYSA-N 1 2 231.299 2.482 20 0 BEADLO CCC[N@@H+](Cc1cnon1)Cc1ccccc1 ZINC000851713126 588615926 /nfs/dbraw/zinc/61/59/26/588615926.db2.gz YHENYHZTPSSQPO-UHFFFAOYSA-N 1 2 231.299 2.482 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cccc(F)n2)CC(C)(C)O1 ZINC000851735807 588620388 /nfs/dbraw/zinc/62/03/88/588620388.db2.gz BWMKQGRNWKBTQN-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cccc(F)n2)CC(C)(C)O1 ZINC000851735807 588620389 /nfs/dbraw/zinc/62/03/89/588620389.db2.gz BWMKQGRNWKBTQN-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cnon2)s1 ZINC000851749803 588622662 /nfs/dbraw/zinc/62/26/62/588622662.db2.gz NATAWPVCRJHGIQ-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cnon2)s1 ZINC000851749803 588622663 /nfs/dbraw/zinc/62/26/63/588622663.db2.gz NATAWPVCRJHGIQ-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO C[N@H+](CC=C(Cl)Cl)[C@@H]1CCOC1 ZINC000851762013 588624784 /nfs/dbraw/zinc/62/47/84/588624784.db2.gz HGYRFSISJPBUMG-SSDOTTSWSA-N 1 2 210.104 2.026 20 0 BEADLO C[N@@H+](CC=C(Cl)Cl)[C@@H]1CCOC1 ZINC000851762013 588624785 /nfs/dbraw/zinc/62/47/85/588624785.db2.gz HGYRFSISJPBUMG-SSDOTTSWSA-N 1 2 210.104 2.026 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cccc(F)n2)C[C@H](C)O1 ZINC000851767628 588625185 /nfs/dbraw/zinc/62/51/85/588625185.db2.gz BMGMFSISEVADGI-CMPLNLGQSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cccc(F)n2)C[C@H](C)O1 ZINC000851767628 588625186 /nfs/dbraw/zinc/62/51/86/588625186.db2.gz BMGMFSISEVADGI-CMPLNLGQSA-N 1 2 238.306 2.220 20 0 BEADLO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1cnon1 ZINC000851798743 588630259 /nfs/dbraw/zinc/63/02/59/588630259.db2.gz NCSKZSXJFZIYRQ-CYBMUJFWSA-N 1 2 246.314 2.135 20 0 BEADLO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1cnon1 ZINC000851798743 588630260 /nfs/dbraw/zinc/63/02/60/588630260.db2.gz NCSKZSXJFZIYRQ-CYBMUJFWSA-N 1 2 246.314 2.135 20 0 BEADLO CC(C)([NH2+]Cc1cnon1)c1ccc(F)cc1 ZINC000851838829 588634234 /nfs/dbraw/zinc/63/42/34/588634234.db2.gz UAGAOCKYLXXILS-UHFFFAOYSA-N 1 2 235.262 2.234 20 0 BEADLO C[C@H](NC(=O)OC(C)(C)C)c1[nH+]ccn1C ZINC000851856079 588635292 /nfs/dbraw/zinc/63/52/92/588635292.db2.gz GUCSXCIARNUJIQ-QMMMGPOBSA-N 1 2 225.292 2.006 20 0 BEADLO Fc1cccc(C[NH+]2CC3(C2)CC(F)(F)C3)n1 ZINC000851880191 588638960 /nfs/dbraw/zinc/63/89/60/588638960.db2.gz QCUDFWRBWDLRIC-UHFFFAOYSA-N 1 2 242.244 2.452 20 0 BEADLO Fc1cccc(CN2CCC[C@@H]2c2[nH]cc[nH+]2)n1 ZINC000851886204 588639973 /nfs/dbraw/zinc/63/99/73/588639973.db2.gz DBCAURVPIWXHLO-LLVKDONJSA-N 1 2 246.289 2.281 20 0 BEADLO CCOc1ccc([C@@H](C)[NH2+]Cc2cnon2)cc1 ZINC000851893957 588641742 /nfs/dbraw/zinc/64/17/42/588641742.db2.gz OSRQASMSCYWOCO-SNVBAGLBSA-N 1 2 247.298 2.319 20 0 BEADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1cnon1 ZINC000851912630 588643046 /nfs/dbraw/zinc/64/30/46/588643046.db2.gz OCIRFAXYFLCASR-YUMQZZPRSA-N 1 2 249.236 2.232 20 0 BEADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1cnon1 ZINC000851912630 588643047 /nfs/dbraw/zinc/64/30/47/588643047.db2.gz OCIRFAXYFLCASR-YUMQZZPRSA-N 1 2 249.236 2.232 20 0 BEADLO COC(CC[N@@H+]1CCCC[C@@H]1C(F)F)OC ZINC000852016070 588655206 /nfs/dbraw/zinc/65/52/06/588655206.db2.gz UCAWKMOLGUUJIM-SECBINFHSA-N 1 2 237.290 2.115 20 0 BEADLO COC(CC[N@H+]1CCCC[C@@H]1C(F)F)OC ZINC000852016070 588655207 /nfs/dbraw/zinc/65/52/07/588655207.db2.gz UCAWKMOLGUUJIM-SECBINFHSA-N 1 2 237.290 2.115 20 0 BEADLO F[C@]1(c2ccccc2)CC[N@H+](Cc2cnon2)C1 ZINC000852018136 588655681 /nfs/dbraw/zinc/65/56/81/588655681.db2.gz KJOMKYJFWCVRJO-CYBMUJFWSA-N 1 2 247.273 2.140 20 0 BEADLO F[C@]1(c2ccccc2)CC[N@@H+](Cc2cnon2)C1 ZINC000852018136 588655682 /nfs/dbraw/zinc/65/56/82/588655682.db2.gz KJOMKYJFWCVRJO-CYBMUJFWSA-N 1 2 247.273 2.140 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cnon2)cc1C ZINC000852149904 588667468 /nfs/dbraw/zinc/66/74/68/588667468.db2.gz NPSVDDXLNLOJNA-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cnon2)cc1C ZINC000852149904 588667469 /nfs/dbraw/zinc/66/74/69/588667469.db2.gz NPSVDDXLNLOJNA-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO C[N@H+](Cc1cnc[nH]1)C[C@@]1(C)CC1(Cl)Cl ZINC000852288212 588676042 /nfs/dbraw/zinc/67/60/42/588676042.db2.gz LNOTUKCCIZHPQF-SECBINFHSA-N 1 2 248.157 2.425 20 0 BEADLO C[N@@H+](Cc1cnc[nH]1)C[C@@]1(C)CC1(Cl)Cl ZINC000852288212 588676043 /nfs/dbraw/zinc/67/60/43/588676043.db2.gz LNOTUKCCIZHPQF-SECBINFHSA-N 1 2 248.157 2.425 20 0 BEADLO C[N@H+](Cc1c[nH]cn1)C[C@@]1(C)CC1(Cl)Cl ZINC000852288212 588676044 /nfs/dbraw/zinc/67/60/44/588676044.db2.gz LNOTUKCCIZHPQF-SECBINFHSA-N 1 2 248.157 2.425 20 0 BEADLO C[N@@H+](Cc1c[nH]cn1)C[C@@]1(C)CC1(Cl)Cl ZINC000852288212 588676045 /nfs/dbraw/zinc/67/60/45/588676045.db2.gz LNOTUKCCIZHPQF-SECBINFHSA-N 1 2 248.157 2.425 20 0 BEADLO COc1ccc(C[NH2+][C@H](C)c2cscn2)nc1 ZINC000852416200 588681594 /nfs/dbraw/zinc/68/15/94/588681594.db2.gz FZZVJHAFPCFTRT-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO CCCCCC[NH2+][C@](C)(CCF)C(=O)OC ZINC000852577527 588691577 /nfs/dbraw/zinc/69/15/77/588691577.db2.gz VMMGOPXMBARZTL-GFCCVEGCSA-N 1 2 233.327 2.448 20 0 BEADLO CC(C)(C)c1nnc(C[N@@H+]2CC[C@H]3C[C@H]3C2)o1 ZINC000852634099 588693387 /nfs/dbraw/zinc/69/33/87/588693387.db2.gz FYGYNDYBKFHYED-UWVGGRQHSA-N 1 2 235.331 2.209 20 0 BEADLO CC(C)(C)c1nnc(C[N@H+]2CC[C@H]3C[C@H]3C2)o1 ZINC000852634099 588693388 /nfs/dbraw/zinc/69/33/88/588693388.db2.gz FYGYNDYBKFHYED-UWVGGRQHSA-N 1 2 235.331 2.209 20 0 BEADLO C[N@@H+](Cc1cnsn1)C[C@@H]1CC1(C)C ZINC000852773301 588701699 /nfs/dbraw/zinc/70/16/99/588701699.db2.gz XMWGVXMOPJBGGI-QMMMGPOBSA-N 1 2 211.334 2.016 20 0 BEADLO C[N@H+](Cc1cnsn1)C[C@@H]1CC1(C)C ZINC000852773301 588701700 /nfs/dbraw/zinc/70/17/00/588701700.db2.gz XMWGVXMOPJBGGI-QMMMGPOBSA-N 1 2 211.334 2.016 20 0 BEADLO Cc1cocc1C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000860553295 589105802 /nfs/dbraw/zinc/10/58/02/589105802.db2.gz IMURGNUPRUVHJE-NSHDSACASA-N 1 2 245.282 2.288 20 0 BEADLO CCCCCCC(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000861759121 589176434 /nfs/dbraw/zinc/17/64/34/589176434.db2.gz GNXIAFMSZXZWJP-UHFFFAOYSA-N 1 2 235.331 2.265 20 0 BEADLO CCCCCCC(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000861759121 589176436 /nfs/dbraw/zinc/17/64/36/589176436.db2.gz GNXIAFMSZXZWJP-UHFFFAOYSA-N 1 2 235.331 2.265 20 0 BEADLO CCCCOC(=O)C[N@@H+]1CCS[C@@H](C)[C@@H]1C ZINC000118534325 589177018 /nfs/dbraw/zinc/17/70/18/589177018.db2.gz IZYBAPIRTRKPGS-QWRGUYRKSA-N 1 2 245.388 2.156 20 0 BEADLO CCCCOC(=O)C[N@H+]1CCS[C@@H](C)[C@@H]1C ZINC000118534325 589177020 /nfs/dbraw/zinc/17/70/20/589177020.db2.gz IZYBAPIRTRKPGS-QWRGUYRKSA-N 1 2 245.388 2.156 20 0 BEADLO CCSCCSc1nc(N)cc(C)[nH+]1 ZINC000118611008 589182764 /nfs/dbraw/zinc/18/27/64/589182764.db2.gz VOEZPRWNCUWGRF-UHFFFAOYSA-N 1 2 229.374 2.212 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccnc(F)c2C)CCO1 ZINC000862216560 589194806 /nfs/dbraw/zinc/19/48/06/589194806.db2.gz ZOYRFRLSHZVWFP-LBPRGKRZSA-N 1 2 238.306 2.140 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccnc(F)c2C)CCO1 ZINC000862216560 589194808 /nfs/dbraw/zinc/19/48/08/589194808.db2.gz ZOYRFRLSHZVWFP-LBPRGKRZSA-N 1 2 238.306 2.140 20 0 BEADLO Cc1c(C[N@H+]2C[C@@H](C)OC[C@H]2C)ccnc1F ZINC000862223536 589195465 /nfs/dbraw/zinc/19/54/65/589195465.db2.gz QPSJPFAOIMGEAC-NXEZZACHSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1c(C[N@@H+]2C[C@@H](C)OC[C@H]2C)ccnc1F ZINC000862223536 589195467 /nfs/dbraw/zinc/19/54/67/589195467.db2.gz QPSJPFAOIMGEAC-NXEZZACHSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1c(C[N@@H+]2CCOC(C)(C)C2)ccnc1F ZINC000862226896 589195555 /nfs/dbraw/zinc/19/55/55/589195555.db2.gz HFSLDQFOKPOPOY-UHFFFAOYSA-N 1 2 238.306 2.140 20 0 BEADLO Cc1c(C[N@H+]2CCOC(C)(C)C2)ccnc1F ZINC000862226896 589195556 /nfs/dbraw/zinc/19/55/56/589195556.db2.gz HFSLDQFOKPOPOY-UHFFFAOYSA-N 1 2 238.306 2.140 20 0 BEADLO Cc1c[nH]c(CN2CCC[C@@H]2c2cc(C)on2)[nH+]1 ZINC000862225716 589195585 /nfs/dbraw/zinc/19/55/85/589195585.db2.gz ZPINKRSFSVQZGB-GFCCVEGCSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1c[nH]c(CN2CCc3c(F)cccc3C2)[nH+]1 ZINC000862242169 589196121 /nfs/dbraw/zinc/19/61/21/589196121.db2.gz YYIRSWAUGWSRSY-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1c(C[N@H+]2CCO[C@@H](C)[C@H]2C)ccnc1F ZINC000862245740 589196669 /nfs/dbraw/zinc/19/66/69/589196669.db2.gz WIVQGAFMHPDBEL-MNOVXSKESA-N 1 2 238.306 2.138 20 0 BEADLO Cc1c(C[N@@H+]2CCO[C@@H](C)[C@H]2C)ccnc1F ZINC000862245740 589196671 /nfs/dbraw/zinc/19/66/71/589196671.db2.gz WIVQGAFMHPDBEL-MNOVXSKESA-N 1 2 238.306 2.138 20 0 BEADLO Cc1c(F)nccc1C[NH2+]CC(C)(F)F ZINC000862377692 589205889 /nfs/dbraw/zinc/20/58/89/589205889.db2.gz KKAAERSQZIPLMU-UHFFFAOYSA-N 1 2 218.222 2.274 20 0 BEADLO Cc1ncc(C[N@@H+]2CCC[C@@](C)(F)C2)o1 ZINC000862381580 589206436 /nfs/dbraw/zinc/20/64/36/589206436.db2.gz FXWMMEAMHVMZLX-LLVKDONJSA-N 1 2 212.268 2.307 20 0 BEADLO Cc1ncc(C[N@H+]2CCC[C@@](C)(F)C2)o1 ZINC000862381580 589206438 /nfs/dbraw/zinc/20/64/38/589206438.db2.gz FXWMMEAMHVMZLX-LLVKDONJSA-N 1 2 212.268 2.307 20 0 BEADLO Fc1cc(C[NH+]2CC(CC(F)F)C2)ccn1 ZINC000862398079 589209228 /nfs/dbraw/zinc/20/92/28/589209228.db2.gz WFACGDHKFJZWLE-UHFFFAOYSA-N 1 2 230.233 2.308 20 0 BEADLO Cc1c(C[N@@H+]2CCC[C@H](F)C2)ccnc1F ZINC000862403374 589209309 /nfs/dbraw/zinc/20/93/09/589209309.db2.gz ZETQMJMIHMZRGW-NSHDSACASA-N 1 2 226.270 2.463 20 0 BEADLO Cc1c(C[N@H+]2CCC[C@H](F)C2)ccnc1F ZINC000862403374 589209310 /nfs/dbraw/zinc/20/93/10/589209310.db2.gz ZETQMJMIHMZRGW-NSHDSACASA-N 1 2 226.270 2.463 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@@H](CCF)C2)c(C)o1 ZINC000862529080 589217807 /nfs/dbraw/zinc/21/78/07/589217807.db2.gz AMJDZQSIKUQJSO-ZDUSSCGKSA-N 1 2 241.306 2.457 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@@H](CCF)C2)c(C)o1 ZINC000862529080 589217808 /nfs/dbraw/zinc/21/78/08/589217808.db2.gz AMJDZQSIKUQJSO-ZDUSSCGKSA-N 1 2 241.306 2.457 20 0 BEADLO Cc1nc(CC(N)=[NH+]OC[C@@H]2C[C@@H]2C)cs1 ZINC000863455542 589288930 /nfs/dbraw/zinc/28/89/30/589288930.db2.gz MFFLPDKZOPBDNY-CBAPKCEASA-N 1 2 239.344 2.148 20 0 BEADLO Cc1nc(CC(N)=[NH+]OC[C@@H]2C[C@H]2C)cs1 ZINC000863455541 589289127 /nfs/dbraw/zinc/28/91/27/589289127.db2.gz MFFLPDKZOPBDNY-APPZFPTMSA-N 1 2 239.344 2.148 20 0 BEADLO COC1(C(N)=[NH+]OCC=C(C)C)CCCC1 ZINC000863477808 589292324 /nfs/dbraw/zinc/29/23/24/589292324.db2.gz WHQDVNGPQWTTTA-UHFFFAOYSA-N 1 2 226.320 2.410 20 0 BEADLO C[C@@H](CCO)Nc1ccc(-c2ccncc2)c[nH+]1 ZINC000863677496 589310585 /nfs/dbraw/zinc/31/05/85/589310585.db2.gz MMLUTCZRDDOVCV-NSHDSACASA-N 1 2 243.310 2.326 20 0 BEADLO Cc1cc(-c2ccc(N[C@@H](C)CO)[nH+]c2)ccn1 ZINC000863693510 589311315 /nfs/dbraw/zinc/31/13/15/589311315.db2.gz FFKZGDTVKKPMKO-NSHDSACASA-N 1 2 243.310 2.245 20 0 BEADLO Nc1ccc(-c2cnn([C@H]3CCCCO3)c2)c[nH+]1 ZINC000863725821 589312980 /nfs/dbraw/zinc/31/29/80/589312980.db2.gz BZRJDAJJPCCJMJ-CYBMUJFWSA-N 1 2 244.298 2.226 20 0 BEADLO c1[nH+]c2n(c1-c1ccc3nonc3c1)CCCC2 ZINC000863974125 589331113 /nfs/dbraw/zinc/33/11/13/589331113.db2.gz CIIDGRYTVVQIDO-UHFFFAOYSA-N 1 2 240.266 2.423 20 0 BEADLO Cn1c(C[NH+]2CCC(C)(F)CC2)cnc1Cl ZINC000864051065 589334785 /nfs/dbraw/zinc/33/47/85/589334785.db2.gz ZPYZJNZOYZOQHT-UHFFFAOYSA-N 1 2 245.729 2.398 20 0 BEADLO C[C@@H](O)c1cccc(N2CCC(C)(F)CC2)[nH+]1 ZINC000864089744 589343004 /nfs/dbraw/zinc/34/30/04/589343004.db2.gz XHJBPZMXHLFQAC-SNVBAGLBSA-N 1 2 238.306 2.463 20 0 BEADLO Cc1[nH]cc(-c2ccc([C@H](C)O)cc2)[nH+]1 ZINC000864549807 589377970 /nfs/dbraw/zinc/37/79/70/589377970.db2.gz JASCLLGWYUWMJD-QMMMGPOBSA-N 1 2 202.257 2.438 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C ZINC000865069444 589407368 /nfs/dbraw/zinc/40/73/68/589407368.db2.gz GVEWBXCYXMAQKE-GWOFURMSSA-N 1 2 246.310 2.321 20 0 BEADLO Cc1cc(=O)[nH]c(C=Cc2cn(C3CC3)c[nH+]2)n1 ZINC000865225148 589414654 /nfs/dbraw/zinc/41/46/54/589414654.db2.gz ZAAGULIZBBSYPL-GORDUTHDSA-N 1 2 242.282 2.192 20 0 BEADLO C(=C\c1ccncn1)\c1cn(C2CC2)c[nH+]1 ZINC000865222113 589414868 /nfs/dbraw/zinc/41/48/68/589414868.db2.gz OPMOVOGOHXSJJE-UPHRSURJSA-N 1 2 212.256 2.178 20 0 BEADLO CCCn1cc(CNc2c[nH+]ccc2CC)nn1 ZINC000865293741 589420248 /nfs/dbraw/zinc/42/02/48/589420248.db2.gz URXYOJONOYOGAG-UHFFFAOYSA-N 1 2 245.330 2.258 20 0 BEADLO CC(C)(C)c1cn(COC2CCOCC2)c[nH+]1 ZINC000865376349 589428428 /nfs/dbraw/zinc/42/84/28/589428428.db2.gz KFWAEXMAEHDJLY-UHFFFAOYSA-N 1 2 238.331 2.334 20 0 BEADLO CC(C)n1ncnc1Cn1c[nH+]c(C(C)(C)C)c1 ZINC000865376444 589428949 /nfs/dbraw/zinc/42/89/49/589428949.db2.gz NSNFDICYGSJMBI-UHFFFAOYSA-N 1 2 247.346 2.401 20 0 BEADLO COCCCNc1cc(CC(C)C)[nH+]cn1 ZINC000865397508 589431987 /nfs/dbraw/zinc/43/19/87/589431987.db2.gz IKUGPCYHXDFQLJ-UHFFFAOYSA-N 1 2 223.320 2.124 20 0 BEADLO CSCCNc1cc(CC(C)C)[nH+]cn1 ZINC000865409002 589433580 /nfs/dbraw/zinc/43/35/80/589433580.db2.gz PWJGQTDYPOQTRT-UHFFFAOYSA-N 1 2 225.361 2.450 20 0 BEADLO COC[C@H](C)CNc1cc(CC(C)C)[nH+]cn1 ZINC000865469651 589438797 /nfs/dbraw/zinc/43/87/97/589438797.db2.gz RHUTVIOKLMKOIQ-LLVKDONJSA-N 1 2 237.347 2.370 20 0 BEADLO CCCn1cc(NCc2cn(C3CC3)c[nH+]2)cn1 ZINC000865495382 589441286 /nfs/dbraw/zinc/44/12/86/589441286.db2.gz IGIOZLUFDWIYRE-UHFFFAOYSA-N 1 2 245.330 2.437 20 0 BEADLO CC(C)Cc1cc(NC[C@](C)(O)C2CC2)nc[nH+]1 ZINC000865535806 589444420 /nfs/dbraw/zinc/44/44/20/589444420.db2.gz SPHJDVDNABBGCD-AWEZNQCLSA-N 1 2 249.358 2.248 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1C[C@H]1C(C)(C)C ZINC000865574871 589447819 /nfs/dbraw/zinc/44/78/19/589447819.db2.gz FVCFTLAFWIUUAK-GHMZBOCLSA-N 1 2 232.327 2.433 20 0 BEADLO CC(C)Cc1cc(NC[C@H](C)CCO)nc[nH+]1 ZINC000865571794 589447911 /nfs/dbraw/zinc/44/79/11/589447911.db2.gz WDARYLFSTHIXHZ-LLVKDONJSA-N 1 2 237.347 2.106 20 0 BEADLO C[C@@H](CF)[NH2+]Cc1cccnc1Br ZINC000865579220 589448641 /nfs/dbraw/zinc/44/86/41/589448641.db2.gz VGEGYEDTBRXOGQ-ZETCQYMHSA-N 1 2 247.111 2.292 20 0 BEADLO CCc1ncc(C[NH2+]Cc2cn(C3CC3)cn2)o1 ZINC000865591394 589449975 /nfs/dbraw/zinc/44/99/75/589449975.db2.gz GEJVEFIVBLTWBG-UHFFFAOYSA-N 1 2 246.314 2.058 20 0 BEADLO CCc1ncc(CNCc2cn(C3CC3)c[nH+]2)o1 ZINC000865591394 589449976 /nfs/dbraw/zinc/44/99/76/589449976.db2.gz GEJVEFIVBLTWBG-UHFFFAOYSA-N 1 2 246.314 2.058 20 0 BEADLO CC(C)Cc1cc(N[C@H](C)CCCO)nc[nH+]1 ZINC000865605967 589450563 /nfs/dbraw/zinc/45/05/63/589450563.db2.gz LEIOJALSIVMDJD-LLVKDONJSA-N 1 2 237.347 2.248 20 0 BEADLO Cc1c(Cl)cccc1C[NH2+]Cc1cnn[nH]1 ZINC000865638220 589453519 /nfs/dbraw/zinc/45/35/19/589453519.db2.gz ZAMJIAPDBJVFML-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO Cc1c(Cl)cccc1C[NH2+]Cc1c[nH]nn1 ZINC000865638220 589453520 /nfs/dbraw/zinc/45/35/20/589453520.db2.gz ZAMJIAPDBJVFML-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO Cc1c(Cl)cccc1C[NH2+]Cc1cn[nH]n1 ZINC000865638220 589453521 /nfs/dbraw/zinc/45/35/21/589453521.db2.gz ZAMJIAPDBJVFML-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO CC(C)Cc1cc(N[C@H]2C[C@H](O)C2(C)C)nc[nH+]1 ZINC000865688929 589456012 /nfs/dbraw/zinc/45/60/12/589456012.db2.gz RJEWLXIUHNENSB-RYUDHWBXSA-N 1 2 249.358 2.246 20 0 BEADLO CO[C@@H](C)CNc1[nH+]cnc2[nH]c(Cl)cc21 ZINC000865714264 589457932 /nfs/dbraw/zinc/45/79/32/589457932.db2.gz JTZKIGNAEQRFFU-LURJTMIESA-N 1 2 240.694 2.058 20 0 BEADLO CC(C)Cc1cc(NC[C@@H]2CC[C@H](O)C2)nc[nH+]1 ZINC000865720757 589458137 /nfs/dbraw/zinc/45/81/37/589458137.db2.gz KGNUGKDPEKAJSD-YPMHNXCESA-N 1 2 249.358 2.248 20 0 BEADLO CCC=C(F)C(=O)Nc1cc[nH+]c(C)c1 ZINC000865740741 589460063 /nfs/dbraw/zinc/46/00/63/589460063.db2.gz JAGDRNGHWVIGCH-ONNFQVAWSA-N 1 2 208.236 2.014 20 0 BEADLO CC1(F)CN(c2[nH+]cnc3[nH]c(Cl)cc32)C1 ZINC000865740540 589460191 /nfs/dbraw/zinc/46/01/91/589460191.db2.gz GCMNNUXELDSBQQ-UHFFFAOYSA-N 1 2 240.669 2.111 20 0 BEADLO FC(F)(F)[C@@H]1CC=CC[C@H]1[NH2+]Cc1ccn[nH]1 ZINC000865832363 589463860 /nfs/dbraw/zinc/46/38/60/589463860.db2.gz NHJRLXWCQZXOGR-NXEZZACHSA-N 1 2 245.248 2.396 20 0 BEADLO C[C@@H]([NH2+]Cc1coc(C2CC2)n1)c1ccnn1C ZINC000865839018 589464340 /nfs/dbraw/zinc/46/43/40/589464340.db2.gz GRRQMJBUSADPCY-SECBINFHSA-N 1 2 246.314 2.136 20 0 BEADLO C[C@H](O)c1ccc(N2CCC[C@](C)(F)C2)[nH+]c1 ZINC000865840087 589464399 /nfs/dbraw/zinc/46/43/99/589464399.db2.gz DDRFJISBXBPBJQ-GWCFXTLKSA-N 1 2 238.306 2.463 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C ZINC000865859523 589465751 /nfs/dbraw/zinc/46/57/51/589465751.db2.gz BLUBSLGCSXLUAO-FTYKPCCVSA-N 1 2 244.338 2.297 20 0 BEADLO CCCCc1cc(NCc2ncccn2)nc[nH+]1 ZINC000865867934 589466079 /nfs/dbraw/zinc/46/60/79/589466079.db2.gz IQBNAYFXWKFJOH-UHFFFAOYSA-N 1 2 243.314 2.221 20 0 BEADLO C[C@@H](Nc1ccc([C@H](C)O)c[nH+]1)c1ccn(C)n1 ZINC000865872719 589466444 /nfs/dbraw/zinc/46/64/44/589466444.db2.gz STROQGWAZCSVSH-ZJUUUORDSA-N 1 2 246.314 2.042 20 0 BEADLO CCCCCOC(=O)[C@@H](C)[NH+]1CCSCC1 ZINC000120806888 589469181 /nfs/dbraw/zinc/46/91/81/589469181.db2.gz ACSMJKNFQMXFCH-LLVKDONJSA-N 1 2 245.388 2.157 20 0 BEADLO Cc1cc(C(F)(F)F)c[nH+]c1NC/C=C\CO ZINC000865935927 589469290 /nfs/dbraw/zinc/46/92/90/589469290.db2.gz AJTKIXZUNQJWBJ-IHWYPQMZSA-N 1 2 246.232 2.369 20 0 BEADLO CC(C)c1nc(NCC[C@H](O)C(F)F)cc[nH+]1 ZINC000866038337 589473573 /nfs/dbraw/zinc/47/35/73/589473573.db2.gz LARRLJJVMDLQKF-QMMMGPOBSA-N 1 2 245.273 2.028 20 0 BEADLO CCc1nc(N2C[C@H](OC)CC[C@H]2C)cc(C)[nH+]1 ZINC000866072665 589474750 /nfs/dbraw/zinc/47/47/50/589474750.db2.gz LXRLPEXWMUVXIB-VXGBXAGGSA-N 1 2 249.358 2.351 20 0 BEADLO CS[C@H]1C[C@H](Nc2nc[nH+]c(N)c2Cl)C1 ZINC000866103302 589476354 /nfs/dbraw/zinc/47/63/54/589476354.db2.gz ZUYSDUAWWUJHNT-IZLXSQMJSA-N 1 2 244.751 2.018 20 0 BEADLO CS[C@H]1C[C@H](Nc2[nH+]cnc(N)c2Cl)C1 ZINC000866103302 589476355 /nfs/dbraw/zinc/47/63/55/589476355.db2.gz ZUYSDUAWWUJHNT-IZLXSQMJSA-N 1 2 244.751 2.018 20 0 BEADLO CNc1nc(C(=O)Nc2cc[nH+]cc2C)cs1 ZINC000120917434 589477393 /nfs/dbraw/zinc/47/73/93/589477393.db2.gz LSSRDVQBRZQOTQ-UHFFFAOYSA-N 1 2 248.311 2.141 20 0 BEADLO C[C@@H](O)c1ccc(N[C@H](C)c2ccnn2C)[nH+]c1 ZINC000866253406 589483112 /nfs/dbraw/zinc/48/31/12/589483112.db2.gz YIJQLHBECNTHQL-NXEZZACHSA-N 1 2 246.314 2.042 20 0 BEADLO CCc1cc(NCC[C@@H](O)C2CCCC2)nc[nH+]1 ZINC000866303777 589485405 /nfs/dbraw/zinc/48/54/05/589485405.db2.gz PUBFUKYHBCLFDZ-CYBMUJFWSA-N 1 2 249.358 2.392 20 0 BEADLO O[C@H](CCNc1cccc[nH+]1)C1CCCC1 ZINC000866303936 589485427 /nfs/dbraw/zinc/48/54/27/589485427.db2.gz RNUCURILOGXDIC-GFCCVEGCSA-N 1 2 220.316 2.435 20 0 BEADLO Cc1cccc(C[C@H](C)[NH2+]CC(F)(F)CO)c1 ZINC000866340247 589487075 /nfs/dbraw/zinc/48/70/75/589487075.db2.gz IBZGOJSFVRBPTC-NSHDSACASA-N 1 2 243.297 2.143 20 0 BEADLO C/C=C(/C)C(=O)N1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000121072049 589492830 /nfs/dbraw/zinc/49/28/30/589492830.db2.gz DGHLHOWGGOPKRO-BXVXIVLCSA-N 1 2 246.310 2.028 20 0 BEADLO CCn1ccnc1[C@@H](C)[NH2+][C@@H](C)c1ccnn1C ZINC000866613997 589505078 /nfs/dbraw/zinc/50/50/78/589505078.db2.gz KRCOZYAREUSMNQ-WDEREUQCSA-N 1 2 247.346 2.048 20 0 BEADLO C[C@@H](CCO)[NH2+]c1ccc(N(C)C)c(F)c1 ZINC000866624875 589505837 /nfs/dbraw/zinc/50/58/37/589505837.db2.gz FARLDXZUDKJCKB-VIFPVBQESA-N 1 2 226.295 2.075 20 0 BEADLO CCC=C(F)C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000867459795 589520631 /nfs/dbraw/zinc/52/06/31/589520631.db2.gz ZICJHNFQHZZEOL-QRJSTWQJSA-N 1 2 225.267 2.240 20 0 BEADLO CC/C=C(/F)C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000867459795 589520633 /nfs/dbraw/zinc/52/06/33/589520633.db2.gz ZICJHNFQHZZEOL-QRJSTWQJSA-N 1 2 225.267 2.240 20 0 BEADLO CCCCCCNC(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000867995568 589543004 /nfs/dbraw/zinc/54/30/04/589543004.db2.gz FDUAROVBPWQRRZ-UHFFFAOYSA-N 1 2 238.335 2.131 20 0 BEADLO CC/C=C(/F)C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000868738068 589574904 /nfs/dbraw/zinc/57/49/04/589574904.db2.gz HDLDNLFKEBHANV-CXQRGBQISA-N 1 2 237.278 2.269 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)c2ccoc2)c1 ZINC000122604808 589609367 /nfs/dbraw/zinc/60/93/67/589609367.db2.gz ILVRBUQDEYMSEQ-UHFFFAOYSA-N 1 2 247.250 2.349 20 0 BEADLO Nc1cc(COC(=O)[C@]23C[C@H]2CCCC3)cc[nH+]1 ZINC000869705164 589623884 /nfs/dbraw/zinc/62/38/84/589623884.db2.gz XRGLXFILXFZOKO-BXUZGUMPSA-N 1 2 246.310 2.287 20 0 BEADLO Nc1cc(COC(=O)[C@@]23C[C@@H]2CCCC3)cc[nH+]1 ZINC000869705167 589623947 /nfs/dbraw/zinc/62/39/47/589623947.db2.gz XRGLXFILXFZOKO-FZMZJTMJSA-N 1 2 246.310 2.287 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)C(C)(C)C)c1 ZINC000122761521 589630583 /nfs/dbraw/zinc/63/05/83/589630583.db2.gz MVOBTVRVPURVNL-UHFFFAOYSA-N 1 2 237.299 2.488 20 0 BEADLO Cc1ccc(NC(=O)c2ccc[nH]2)c(N(C)C)[nH+]1 ZINC000122844172 589638988 /nfs/dbraw/zinc/63/89/88/589638988.db2.gz GICZKOGMZXOQKY-UHFFFAOYSA-N 1 2 244.298 2.036 20 0 BEADLO CC(=O)[C@H](C)SCc1[nH+]ccn1CC(F)F ZINC000871656668 589782900 /nfs/dbraw/zinc/78/29/00/589782900.db2.gz SVMYMASXJNJIIQ-QMMMGPOBSA-N 1 2 248.298 2.359 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OC[C@H]1CCO[C@H]1C ZINC000871719478 589797649 /nfs/dbraw/zinc/79/76/49/589797649.db2.gz WXNUZRAPMPRWJA-NWDGAFQWSA-N 1 2 248.326 2.267 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OC[C@@H](C)C(C)(C)C ZINC000871735568 589801145 /nfs/dbraw/zinc/80/11/45/589801145.db2.gz ULBYKKXCLBATNB-BDAKNGLRSA-N 1 2 216.325 2.202 20 0 BEADLO CC[C@H](C)CO[NH+]=C(N)COC1CCC1 ZINC000871775828 589812651 /nfs/dbraw/zinc/81/26/51/589812651.db2.gz QCNOOVHKESNJKB-VIFPVBQESA-N 1 2 214.309 2.100 20 0 BEADLO CC(C)(C)c1cn(CC2(O)CCC2)c[nH+]1 ZINC000871989359 589854953 /nfs/dbraw/zinc/85/49/53/589854953.db2.gz MGXYKBUVXJZKDF-UHFFFAOYSA-N 1 2 208.305 2.096 20 0 BEADLO C[C@H]([NH2+]Cc1ccon1)c1cc(O)ccc1F ZINC000872040501 589859292 /nfs/dbraw/zinc/85/92/92/589859292.db2.gz LZJAHWAKERCMDP-QMMMGPOBSA-N 1 2 236.246 2.370 20 0 BEADLO C[C@H]([NH2+]Cc1ccn(C)n1)c1cccc(O)c1F ZINC000872053769 589861292 /nfs/dbraw/zinc/86/12/92/589861292.db2.gz MQOXEHNYNWOVJP-VIFPVBQESA-N 1 2 249.289 2.116 20 0 BEADLO Cc1nonc1C[NH2+][C@@H](c1cccnc1)C(C)C ZINC000872135234 589878515 /nfs/dbraw/zinc/87/85/15/589878515.db2.gz CMZDWAGZUJGYMY-CYBMUJFWSA-N 1 2 246.314 2.260 20 0 BEADLO Cc1nonc1C[NH2+][C@H](c1cccnc1)C(C)C ZINC000872135235 589878621 /nfs/dbraw/zinc/87/86/21/589878621.db2.gz CMZDWAGZUJGYMY-ZDUSSCGKSA-N 1 2 246.314 2.260 20 0 BEADLO CCn1ncc(N[C@H](C)c2[nH+]ccn2C)c1C ZINC000872137599 589879857 /nfs/dbraw/zinc/87/98/57/589879857.db2.gz MVDJCTCARAYFKD-SECBINFHSA-N 1 2 233.319 2.118 20 0 BEADLO CC[NH2+]Cc1noc(C2CCC=CCC2)n1 ZINC000872170596 589887875 /nfs/dbraw/zinc/88/78/75/589887875.db2.gz GNSLOUJCRZMPKP-UHFFFAOYSA-N 1 2 221.304 2.393 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C1(C2CC2)CC1 ZINC000888597117 589896566 /nfs/dbraw/zinc/89/65/66/589896566.db2.gz JHQBVPJLRSJYEC-UHFFFAOYSA-N 1 2 232.283 2.219 20 0 BEADLO CC1(C)C[N@H+](CN2CCCC2=O)[C@H]1c1ccco1 ZINC000872633287 589957525 /nfs/dbraw/zinc/95/75/25/589957525.db2.gz CTHXBLNQNRKAKL-ZDUSSCGKSA-N 1 2 248.326 2.242 20 0 BEADLO CC1(C)C[N@@H+](CN2CCCC2=O)[C@H]1c1ccco1 ZINC000872633287 589957528 /nfs/dbraw/zinc/95/75/28/589957528.db2.gz CTHXBLNQNRKAKL-ZDUSSCGKSA-N 1 2 248.326 2.242 20 0 BEADLO CCc1cc(NC[C@@H]2C[C@H]3CCC[C@@H]3O2)nc[nH+]1 ZINC000872696310 589962513 /nfs/dbraw/zinc/96/25/13/589962513.db2.gz PXCKMARFVHLHIF-WXHSDQCUSA-N 1 2 247.342 2.409 20 0 BEADLO Cc1nc(N[C@@H](C)c2nccnc2C)cc[nH+]1 ZINC000872768149 589967010 /nfs/dbraw/zinc/96/70/10/589967010.db2.gz DIENBWKARLQTQC-VIFPVBQESA-N 1 2 229.287 2.057 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]Cc1cc(N)cc(F)c1 ZINC000873288491 590022600 /nfs/dbraw/zinc/02/26/00/590022600.db2.gz HBFZZTQBZONAMN-QMMMGPOBSA-N 1 2 248.305 2.290 20 0 BEADLO Nc1cc(COC(=O)C2CCC=CCC2)cc[nH+]1 ZINC000873430620 590043633 /nfs/dbraw/zinc/04/36/33/590043633.db2.gz UCZYYNKKQQJRGV-UHFFFAOYSA-N 1 2 246.310 2.453 20 0 BEADLO CCC[C@H](CC)C(=O)NCCCn1cc[nH+]c1 ZINC000873733614 590069291 /nfs/dbraw/zinc/06/92/91/590069291.db2.gz ULEKBQUWKSHEDR-LBPRGKRZSA-N 1 2 237.347 2.216 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccccn1)c1ncc[nH]1 ZINC000124672564 590072160 /nfs/dbraw/zinc/07/21/60/590072160.db2.gz DWYOTHJMNINHTP-VHSXEESVSA-N 1 2 216.288 2.217 20 0 BEADLO CCn1ccc(C(=O)Nc2cc[nH+]cc2C)c1C ZINC000874443111 590110737 /nfs/dbraw/zinc/11/07/37/590110737.db2.gz ZKZCVPAIQZTYAS-UHFFFAOYSA-N 1 2 243.310 2.194 20 0 BEADLO Cc1cc(NC(=O)C2(C)CC(F)(F)C2)cc[nH+]1 ZINC000874461500 590112635 /nfs/dbraw/zinc/11/26/35/590112635.db2.gz KNLNCZYVKNFPHL-UHFFFAOYSA-N 1 2 240.253 2.186 20 0 BEADLO CCC1(CC)CCCN1C(=O)Cc1c[nH+]cn1C ZINC000874630592 590120259 /nfs/dbraw/zinc/12/02/59/590120259.db2.gz UFYLYZAUYDIWMT-UHFFFAOYSA-N 1 2 249.358 2.144 20 0 BEADLO O=C(N[C@@H]1CC12CCC2)c1cccc2[nH+]ccn21 ZINC000874782156 590133155 /nfs/dbraw/zinc/13/31/55/590133155.db2.gz IOTRNXVMCMOLOE-LLVKDONJSA-N 1 2 241.294 2.007 20 0 BEADLO CCC[C@H](CC)C(=O)Nc1ccc(N)[nH+]c1 ZINC000876523503 590207864 /nfs/dbraw/zinc/20/78/64/590207864.db2.gz YFOHPHVCZGIYCD-VIFPVBQESA-N 1 2 221.304 2.429 20 0 BEADLO OCC1CC[NH+](Cc2nc(Cl)cs2)CC1 ZINC000876564562 590216509 /nfs/dbraw/zinc/21/65/09/590216509.db2.gz LOZJSWHAEBRCCG-UHFFFAOYSA-N 1 2 246.763 2.001 20 0 BEADLO C[N@H+](Cc1nc(Cl)cs1)C1CC1 ZINC000876580339 590218658 /nfs/dbraw/zinc/21/86/58/590218658.db2.gz JMRKFYHOFXZUSU-UHFFFAOYSA-N 1 2 202.710 2.391 20 0 BEADLO C[N@@H+](Cc1nc(Cl)cs1)C1CC1 ZINC000876580339 590218659 /nfs/dbraw/zinc/21/86/59/590218659.db2.gz JMRKFYHOFXZUSU-UHFFFAOYSA-N 1 2 202.710 2.391 20 0 BEADLO COc1cnc(F)c(C[N@@H+]2CCC2(C)C)c1 ZINC000876743576 590236424 /nfs/dbraw/zinc/23/64/24/590236424.db2.gz IOZAMNYNENDQST-UHFFFAOYSA-N 1 2 224.279 2.214 20 0 BEADLO COc1cnc(F)c(C[N@H+]2CCC2(C)C)c1 ZINC000876743576 590236425 /nfs/dbraw/zinc/23/64/25/590236425.db2.gz IOZAMNYNENDQST-UHFFFAOYSA-N 1 2 224.279 2.214 20 0 BEADLO CO[C@@H]1CC[N@H+](Cc2nc(Cl)cs2)C1 ZINC000876751410 590238154 /nfs/dbraw/zinc/23/81/54/590238154.db2.gz YNRWIUBZZHFGED-SSDOTTSWSA-N 1 2 232.736 2.017 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2nc(Cl)cs2)C1 ZINC000876751410 590238155 /nfs/dbraw/zinc/23/81/55/590238155.db2.gz YNRWIUBZZHFGED-SSDOTTSWSA-N 1 2 232.736 2.017 20 0 BEADLO CC[C@]1(O)CC[N@H+](Cc2nc(Cl)cs2)C1 ZINC000877440666 590328121 /nfs/dbraw/zinc/32/81/21/590328121.db2.gz GSPMQSVEJCMPEI-JTQLQIEISA-N 1 2 246.763 2.143 20 0 BEADLO CC[C@]1(O)CC[N@@H+](Cc2nc(Cl)cs2)C1 ZINC000877440666 590328123 /nfs/dbraw/zinc/32/81/23/590328123.db2.gz GSPMQSVEJCMPEI-JTQLQIEISA-N 1 2 246.763 2.143 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+][C@H](C)Cc1cccc(C)c1 ZINC000877471218 590334561 /nfs/dbraw/zinc/33/45/61/590334561.db2.gz QGMIZONDVBMZLU-CHWSQXEVSA-N 1 2 249.354 2.467 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@H](C)Cc1cccc(C)c1 ZINC000877471219 590335213 /nfs/dbraw/zinc/33/52/13/590335213.db2.gz QGMIZONDVBMZLU-OLZOCXBDSA-N 1 2 249.354 2.467 20 0 BEADLO Nc1c(Cl)cccc1C[NH2+]CC(F)F ZINC000877518400 590345720 /nfs/dbraw/zinc/34/57/20/590345720.db2.gz SGRYVMXGNYNIPI-UHFFFAOYSA-N 1 2 220.650 2.277 20 0 BEADLO C[C@H](CO)[N@H+](C)Cc1c(Cl)cncc1Cl ZINC000877527654 590349397 /nfs/dbraw/zinc/34/93/97/590349397.db2.gz UNAJACIXJQKXKN-SSDOTTSWSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@H](CO)[N@@H+](C)Cc1c(Cl)cncc1Cl ZINC000877527654 590349398 /nfs/dbraw/zinc/34/93/98/590349398.db2.gz UNAJACIXJQKXKN-SSDOTTSWSA-N 1 2 249.141 2.201 20 0 BEADLO CC[C@@H]1CC[N@@H+]1Cc1cc(OC)cnc1F ZINC000877547715 590353910 /nfs/dbraw/zinc/35/39/10/590353910.db2.gz HOGFTIDUFVSNQE-SNVBAGLBSA-N 1 2 224.279 2.214 20 0 BEADLO CC[C@@H]1CC[N@H+]1Cc1cc(OC)cnc1F ZINC000877547715 590353912 /nfs/dbraw/zinc/35/39/12/590353912.db2.gz HOGFTIDUFVSNQE-SNVBAGLBSA-N 1 2 224.279 2.214 20 0 BEADLO COc1cccc(C)c1C[NH2+]C(CF)CF ZINC000877556011 590356911 /nfs/dbraw/zinc/35/69/11/590356911.db2.gz IWBLQXSOMKBBEK-UHFFFAOYSA-N 1 2 229.270 2.401 20 0 BEADLO ClC1(Cl)C[C@@H]1C[NH+]1CC2(C1)CCCO2 ZINC000877653554 590385289 /nfs/dbraw/zinc/38/52/89/590385289.db2.gz NDMRBYFYMOHDBP-MRVPVSSYSA-N 1 2 236.142 2.045 20 0 BEADLO C[C@H](O)c1ncc(C[NH+]2CC(C)(C)C2)s1 ZINC000877717337 590400069 /nfs/dbraw/zinc/40/00/69/590400069.db2.gz IQZWUSVELQONPK-QMMMGPOBSA-N 1 2 226.345 2.038 20 0 BEADLO Cc1noc(C)c1C[NH+]1CC(OC(C)(C)C)C1 ZINC000877772161 590422639 /nfs/dbraw/zinc/42/26/39/590422639.db2.gz QTBHLAVYEAUMGK-UHFFFAOYSA-N 1 2 238.331 2.291 20 0 BEADLO Cc1[nH+]c2cc(OCCOC3CC3)ccc2n1C ZINC000877883663 590438313 /nfs/dbraw/zinc/43/83/13/590438313.db2.gz RNTFXYSOXVYFAC-UHFFFAOYSA-N 1 2 246.310 2.440 20 0 BEADLO CC[C@H]1C[N@H+](CCCOC(F)(F)F)CCO1 ZINC000877958456 590457442 /nfs/dbraw/zinc/45/74/42/590457442.db2.gz UYVWSODVGZNRKL-VIFPVBQESA-N 1 2 241.253 2.024 20 0 BEADLO CC[C@H]1C[N@@H+](CCCOC(F)(F)F)CCO1 ZINC000877958456 590457445 /nfs/dbraw/zinc/45/74/45/590457445.db2.gz UYVWSODVGZNRKL-VIFPVBQESA-N 1 2 241.253 2.024 20 0 BEADLO C(c1nc2c(o1)CCCC2)[NH+]1CCSCC1 ZINC000877967666 590460905 /nfs/dbraw/zinc/46/09/05/590460905.db2.gz NTYGAOQYXRFJAM-UHFFFAOYSA-N 1 2 238.356 2.102 20 0 BEADLO CC(=O)C[N@@H+]1[C@H](C)CO[C@H](c2ccccc2)[C@H]1C ZINC000878096090 590492645 /nfs/dbraw/zinc/49/26/45/590492645.db2.gz LGDVTIYKTRHRQO-KYOSRNDESA-N 1 2 247.338 2.426 20 0 BEADLO CC(=O)C[N@H+]1[C@H](C)CO[C@H](c2ccccc2)[C@H]1C ZINC000878096090 590492646 /nfs/dbraw/zinc/49/26/46/590492646.db2.gz LGDVTIYKTRHRQO-KYOSRNDESA-N 1 2 247.338 2.426 20 0 BEADLO CC(=O)C[N@@H+]1[C@H](C)CO[C@@H](c2ccccc2)[C@@H]1C ZINC000878096091 590492949 /nfs/dbraw/zinc/49/29/49/590492949.db2.gz LGDVTIYKTRHRQO-OSAQELSMSA-N 1 2 247.338 2.426 20 0 BEADLO CC(=O)C[N@H+]1[C@H](C)CO[C@@H](c2ccccc2)[C@@H]1C ZINC000878096091 590492953 /nfs/dbraw/zinc/49/29/53/590492953.db2.gz LGDVTIYKTRHRQO-OSAQELSMSA-N 1 2 247.338 2.426 20 0 BEADLO C[N@@H+](Cc1ccon1)C[C@@H]1CC2(CCC2)CO1 ZINC000878123759 590500186 /nfs/dbraw/zinc/50/01/86/590500186.db2.gz FERYGLDCZOOHGD-LBPRGKRZSA-N 1 2 236.315 2.066 20 0 BEADLO C[N@H+](Cc1ccon1)C[C@@H]1CC2(CCC2)CO1 ZINC000878123759 590500188 /nfs/dbraw/zinc/50/01/88/590500188.db2.gz FERYGLDCZOOHGD-LBPRGKRZSA-N 1 2 236.315 2.066 20 0 BEADLO CC[N@H+](Cc1nocc1C)Cc1ccccn1 ZINC000878186227 590519433 /nfs/dbraw/zinc/51/94/33/590519433.db2.gz HKFARIVRHHRFIV-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1nocc1C)Cc1ccccn1 ZINC000878186227 590519434 /nfs/dbraw/zinc/51/94/34/590519434.db2.gz HKFARIVRHHRFIV-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO C[N@@H+](Cc1ncc[nH]1)C[C@H]1CCC(C)(C)CO1 ZINC000878315398 590542365 /nfs/dbraw/zinc/54/23/65/590542365.db2.gz NJDHNGZZTIGDLE-LLVKDONJSA-N 1 2 237.347 2.047 20 0 BEADLO C[N@H+](Cc1ncc[nH]1)C[C@H]1CCC(C)(C)CO1 ZINC000878315398 590542366 /nfs/dbraw/zinc/54/23/66/590542366.db2.gz NJDHNGZZTIGDLE-LLVKDONJSA-N 1 2 237.347 2.047 20 0 BEADLO CC[N@H+](Cc1nocc1C)Cc1ccncc1 ZINC000878328798 590547590 /nfs/dbraw/zinc/54/75/90/590547590.db2.gz OTTKYQCLYAQPBK-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1nocc1C)Cc1ccncc1 ZINC000878328798 590547591 /nfs/dbraw/zinc/54/75/91/590547591.db2.gz OTTKYQCLYAQPBK-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CCOCC[N@H+](C)Cc1nc2c(o1)CCCC2 ZINC000878339799 590550359 /nfs/dbraw/zinc/55/03/59/590550359.db2.gz FOXIFZNUMSBICC-UHFFFAOYSA-N 1 2 238.331 2.022 20 0 BEADLO CCOCC[N@@H+](C)Cc1nc2c(o1)CCCC2 ZINC000878339799 590550361 /nfs/dbraw/zinc/55/03/61/590550361.db2.gz FOXIFZNUMSBICC-UHFFFAOYSA-N 1 2 238.331 2.022 20 0 BEADLO FC1(F)CC[N@H+](C[C@@H]2C[C@H]3CCC[C@@H]3O2)C1 ZINC000878380303 590556179 /nfs/dbraw/zinc/55/61/79/590556179.db2.gz WGUGAIJFMFTHTC-VWYCJHECSA-N 1 2 231.286 2.285 20 0 BEADLO FC1(F)CC[N@@H+](C[C@@H]2C[C@H]3CCC[C@@H]3O2)C1 ZINC000878380303 590556182 /nfs/dbraw/zinc/55/61/82/590556182.db2.gz WGUGAIJFMFTHTC-VWYCJHECSA-N 1 2 231.286 2.285 20 0 BEADLO Cc1conc1C[NH+]1CCC(F)(F)CC1 ZINC000878543137 590589267 /nfs/dbraw/zinc/58/92/67/590589267.db2.gz XCVSKQJSWTXVMJ-UHFFFAOYSA-N 1 2 216.231 2.214 20 0 BEADLO c1cnc2c(c1)C[N@@H+](C[C@@H]1C[C@H]3CCC[C@H]3O1)C2 ZINC000878548930 590590591 /nfs/dbraw/zinc/59/05/91/590590591.db2.gz YVJNYUOFEDXHRQ-OSAQELSMSA-N 1 2 244.338 2.355 20 0 BEADLO c1cnc2c(c1)C[N@H+](C[C@@H]1C[C@H]3CCC[C@H]3O1)C2 ZINC000878548930 590590592 /nfs/dbraw/zinc/59/05/92/590590592.db2.gz YVJNYUOFEDXHRQ-OSAQELSMSA-N 1 2 244.338 2.355 20 0 BEADLO CC[C@@H]1CCC[C@]1(C)C(=O)NCc1[nH+]ccn1C ZINC000878722413 590616568 /nfs/dbraw/zinc/61/65/68/590616568.db2.gz UICOZOGBHJLEFK-RISCZKNCSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1nocc1C[N@@H+]1CCC=C(Cl)C1 ZINC000878790132 590622432 /nfs/dbraw/zinc/62/24/32/590622432.db2.gz NDGUGTOAFTUSRN-UHFFFAOYSA-N 1 2 212.680 2.311 20 0 BEADLO Cc1nocc1C[N@H+]1CCC=C(Cl)C1 ZINC000878790132 590622433 /nfs/dbraw/zinc/62/24/33/590622433.db2.gz NDGUGTOAFTUSRN-UHFFFAOYSA-N 1 2 212.680 2.311 20 0 BEADLO C[C@H](C(=O)NC(C)(C)C)[N@@H+]1CCC=C(Cl)C1 ZINC000878794045 590624291 /nfs/dbraw/zinc/62/42/91/590624291.db2.gz YYQOUFYGJRTGIH-SECBINFHSA-N 1 2 244.766 2.118 20 0 BEADLO C[C@H](C(=O)NC(C)(C)C)[N@H+]1CCC=C(Cl)C1 ZINC000878794045 590624292 /nfs/dbraw/zinc/62/42/92/590624292.db2.gz YYQOUFYGJRTGIH-SECBINFHSA-N 1 2 244.766 2.118 20 0 BEADLO COc1cc[nH+]c(CN2CCC=C(Cl)C2)c1 ZINC000878793926 590624485 /nfs/dbraw/zinc/62/44/85/590624485.db2.gz NPLVZDXDYPGMNN-UHFFFAOYSA-N 1 2 238.718 2.419 20 0 BEADLO Cc1oncc1C[N@@H+]1CCC[C@@H]1c1ncccn1 ZINC000878978975 590666850 /nfs/dbraw/zinc/66/68/50/590666850.db2.gz TWCAXFCRLYFAOR-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1oncc1C[N@H+]1CCC[C@@H]1c1ncccn1 ZINC000878978975 590666852 /nfs/dbraw/zinc/66/68/52/590666852.db2.gz TWCAXFCRLYFAOR-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1cc(NC(=O)NC[C@H]2C=CCC2)c(C)c[nH+]1 ZINC000879075030 590693545 /nfs/dbraw/zinc/69/35/45/590693545.db2.gz DHOKISWTZZEXFK-LBPRGKRZSA-N 1 2 245.326 2.208 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC[C@]1(C)CC1(C)C ZINC000879073900 590693609 /nfs/dbraw/zinc/69/36/09/590693609.db2.gz ZXOZZSHHHUKAHX-AWEZNQCLSA-N 1 2 247.342 2.370 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)C1CC(OC(C)C)C1 ZINC000879188949 590712420 /nfs/dbraw/zinc/71/24/20/590712420.db2.gz UGCBOGTWQALYMO-UHFFFAOYSA-N 1 2 237.347 2.106 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)C1CC(OC(C)C)C1 ZINC000879188949 590712424 /nfs/dbraw/zinc/71/24/24/590712424.db2.gz UGCBOGTWQALYMO-UHFFFAOYSA-N 1 2 237.347 2.106 20 0 BEADLO CCCCOC(=O)C[NH+]1CCC(CCF)CC1 ZINC000879208559 590715019 /nfs/dbraw/zinc/71/50/19/590715019.db2.gz AQWFJNGISLJGNG-UHFFFAOYSA-N 1 2 245.338 2.401 20 0 BEADLO FC(F)Cn1cc[nH+]c1CN1CCCCCO1 ZINC000879512554 590781425 /nfs/dbraw/zinc/78/14/25/590781425.db2.gz PUOXZXUSQMZEGK-UHFFFAOYSA-N 1 2 245.273 2.066 20 0 BEADLO CC(C)[N@@H+]1CCO[C@](C)(C(F)(F)F)C1 ZINC000879506324 590783241 /nfs/dbraw/zinc/78/32/41/590783241.db2.gz MBULMQBKGITONO-QMMMGPOBSA-N 1 2 211.227 2.048 20 0 BEADLO CC(C)[N@H+]1CCO[C@](C)(C(F)(F)F)C1 ZINC000879506324 590783243 /nfs/dbraw/zinc/78/32/43/590783243.db2.gz MBULMQBKGITONO-QMMMGPOBSA-N 1 2 211.227 2.048 20 0 BEADLO CSCC[N@@H+]1CCO[C@@](C)(C(F)(F)F)C1 ZINC000879501680 590783412 /nfs/dbraw/zinc/78/34/12/590783412.db2.gz PPRCNRSHQSWFPC-MRVPVSSYSA-N 1 2 243.294 2.003 20 0 BEADLO CSCC[N@H+]1CCO[C@@](C)(C(F)(F)F)C1 ZINC000879501680 590783413 /nfs/dbraw/zinc/78/34/13/590783413.db2.gz PPRCNRSHQSWFPC-MRVPVSSYSA-N 1 2 243.294 2.003 20 0 BEADLO CCON(CC)Cc1cn2ccccc2[nH+]1 ZINC000879794918 590872878 /nfs/dbraw/zinc/87/28/78/590872878.db2.gz KHSGAJFWHJUEED-UHFFFAOYSA-N 1 2 219.288 2.108 20 0 BEADLO CO[C@@H]1CC[C@H]([N@@H+]2OC3CCC2CC3)C1 ZINC000879799138 590877033 /nfs/dbraw/zinc/87/70/33/590877033.db2.gz GLYAKONWQAHMEA-POSLAHMBSA-N 1 2 211.305 2.112 20 0 BEADLO CO[C@@H]1CC[C@H]([N@H+]2OC3CCC2CC3)C1 ZINC000879799138 590877035 /nfs/dbraw/zinc/87/70/35/590877035.db2.gz GLYAKONWQAHMEA-POSLAHMBSA-N 1 2 211.305 2.112 20 0 BEADLO FC(F)(F)[C@@H]1CC[N@H+](C/C=C\Cl)CCO1 ZINC000880044903 590913715 /nfs/dbraw/zinc/91/37/15/590913715.db2.gz UUYZTEJJPUFJMQ-CJKINAQCSA-N 1 2 243.656 2.392 20 0 BEADLO FC(F)(F)[C@@H]1CC[N@@H+](C/C=C\Cl)CCO1 ZINC000880044903 590913716 /nfs/dbraw/zinc/91/37/16/590913716.db2.gz UUYZTEJJPUFJMQ-CJKINAQCSA-N 1 2 243.656 2.392 20 0 BEADLO Cc1coc(C(=O)N[C@H]2C[C@H](C)n3cc[nH+]c32)c1 ZINC000880227285 590961300 /nfs/dbraw/zinc/96/13/00/590961300.db2.gz JETRVFVXPBSGFC-UWVGGRQHSA-N 1 2 245.282 2.220 20 0 BEADLO FC[C@@H]1CCC[N@H+](Cc2noc(C3CC3)n2)C1 ZINC000880233007 590964572 /nfs/dbraw/zinc/96/45/72/590964572.db2.gz SSFNSOQSBJVTHA-VIFPVBQESA-N 1 2 239.294 2.129 20 0 BEADLO FC[C@@H]1CCC[N@@H+](Cc2noc(C3CC3)n2)C1 ZINC000880233007 590964574 /nfs/dbraw/zinc/96/45/74/590964574.db2.gz SSFNSOQSBJVTHA-VIFPVBQESA-N 1 2 239.294 2.129 20 0 BEADLO CCc1nnc(C[N@@H+]2CCC[C@@H](CF)C2)s1 ZINC000880236890 590968606 /nfs/dbraw/zinc/96/86/06/590968606.db2.gz LHYXTKVINGIQFO-VIFPVBQESA-N 1 2 243.351 2.282 20 0 BEADLO CCc1nnc(C[N@H+]2CCC[C@@H](CF)C2)s1 ZINC000880236890 590968609 /nfs/dbraw/zinc/96/86/09/590968609.db2.gz LHYXTKVINGIQFO-VIFPVBQESA-N 1 2 243.351 2.282 20 0 BEADLO COC(=O)c1ccoc1C[NH+]1CCC(F)CC1 ZINC000880239524 590972284 /nfs/dbraw/zinc/97/22/84/590972284.db2.gz JZVFTCUKJXREFD-UHFFFAOYSA-N 1 2 241.262 2.000 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CC[C@H](CF)C2)s1 ZINC000880299794 590994958 /nfs/dbraw/zinc/99/49/58/590994958.db2.gz LPNAMTNSTNZHLX-SECBINFHSA-N 1 2 243.351 2.453 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CC[C@H](CF)C2)s1 ZINC000880299794 590994960 /nfs/dbraw/zinc/99/49/60/590994960.db2.gz LPNAMTNSTNZHLX-SECBINFHSA-N 1 2 243.351 2.453 20 0 BEADLO Fc1ccccc1C[N@@H+]1CCc2ncncc2C1 ZINC000880594156 591104458 /nfs/dbraw/zinc/10/44/58/591104458.db2.gz PJQJVQXXVFEOFI-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1ccccc1C[N@H+]1CCc2ncncc2C1 ZINC000880594156 591104461 /nfs/dbraw/zinc/10/44/61/591104461.db2.gz PJQJVQXXVFEOFI-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Cc1[nH+]cnc(N2CCCCCC2)c1C ZINC000881732129 591267583 /nfs/dbraw/zinc/26/75/83/591267583.db2.gz DBIVLTFMWFUZMC-UHFFFAOYSA-N 1 2 205.305 2.474 20 0 BEADLO Cc1ncnc(NC[C@@H](C)Cn2cc[nH+]c2)c1C ZINC000881819568 591272851 /nfs/dbraw/zinc/27/28/51/591272851.db2.gz ZCVBBSRSCZSYTH-SNVBAGLBSA-N 1 2 245.330 2.038 20 0 BEADLO Cc1ccc(CNc2nc[nH+]c(C)c2C)cn1 ZINC000881814788 591272870 /nfs/dbraw/zinc/27/28/70/591272870.db2.gz OZUMQHFKOPVFGD-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO CC[C@H](C)[C@@](C)(O)CNc1nc[nH+]c(C)c1C ZINC000881978073 591284707 /nfs/dbraw/zinc/28/47/07/591284707.db2.gz XNLNNJLOACZUEJ-ZANVPECISA-N 1 2 237.347 2.302 20 0 BEADLO Cc1[nH+]cnc(N2CCC3(C2)CCOCC3)c1C ZINC000882038553 591290679 /nfs/dbraw/zinc/29/06/79/591290679.db2.gz CCHXBKOXYQEKHS-UHFFFAOYSA-N 1 2 247.342 2.100 20 0 BEADLO CO[C@H](CNc1nc[nH+]c(C)c1C)C(C)C ZINC000882040762 591291786 /nfs/dbraw/zinc/29/17/86/591291786.db2.gz WQJAGHPXTSBITP-LLVKDONJSA-N 1 2 223.320 2.176 20 0 BEADLO CO[C@@H]1C[C@@H](Nc2nc[nH+]c(C)c2C)C1(C)C ZINC000882071300 591293753 /nfs/dbraw/zinc/29/37/53/591293753.db2.gz BNWCZLHBXLAWMT-GHMZBOCLSA-N 1 2 235.331 2.319 20 0 BEADLO Cc1[nH+]cnc(NC[C@H]2CCCS2)c1C ZINC000882079995 591294681 /nfs/dbraw/zinc/29/46/81/591294681.db2.gz DNTWZNQXAZUKJO-SNVBAGLBSA-N 1 2 223.345 2.401 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2CC[C@@H](CO)CC2)c1C ZINC000882084175 591295474 /nfs/dbraw/zinc/29/54/74/591295474.db2.gz KUVBQZKYCODRNI-TXEJJXNPSA-N 1 2 235.331 2.056 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2CCC[C@@H]3OCC[C@H]32)c1C ZINC000882092921 591296248 /nfs/dbraw/zinc/29/62/48/591296248.db2.gz NPLXRIJROZJYKR-XQQFMLRXSA-N 1 2 247.342 2.463 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2CCC[C@H]3OCC[C@@H]32)c1C ZINC000882092919 591296352 /nfs/dbraw/zinc/29/63/52/591296352.db2.gz NPLXRIJROZJYKR-JHJVBQTASA-N 1 2 247.342 2.463 20 0 BEADLO CO[C@@H]1CCCN(c2nc[nH+]c(C)c2C)CC1 ZINC000882175837 591311251 /nfs/dbraw/zinc/31/12/51/591311251.db2.gz WPGRRFHISZJLHC-GFCCVEGCSA-N 1 2 235.331 2.099 20 0 BEADLO Cc1[nH+]cnc(N2CCCC3(CC3)C2)c1C ZINC000882199722 591314878 /nfs/dbraw/zinc/31/48/78/591314878.db2.gz PSXZBAHWAJNMLK-UHFFFAOYSA-N 1 2 217.316 2.474 20 0 BEADLO CC[C@]1(CO)CCCN(c2nc[nH+]c(C)c2C)C1 ZINC000882212087 591316659 /nfs/dbraw/zinc/31/66/59/591316659.db2.gz MLRJARRCMKYLCS-AWEZNQCLSA-N 1 2 249.358 2.082 20 0 BEADLO Cc1[nH+]cnc(NCCOC(F)(F)F)c1C ZINC000882244089 591320602 /nfs/dbraw/zinc/32/06/02/591320602.db2.gz MQMUXTCPOAOWJF-UHFFFAOYSA-N 1 2 235.209 2.042 20 0 BEADLO CSC1(CNc2nc[nH+]c(C)c2C)CC1 ZINC000882277645 591323432 /nfs/dbraw/zinc/32/34/32/591323432.db2.gz PAEUTXHJWJKBAG-UHFFFAOYSA-N 1 2 223.345 2.401 20 0 BEADLO Cc1[nH+]cnc(NC[C@H]2CCSC2)c1C ZINC000882280929 591325890 /nfs/dbraw/zinc/32/58/90/591325890.db2.gz OPUAOUHPQWLSQB-SNVBAGLBSA-N 1 2 223.345 2.258 20 0 BEADLO CC1(C)CC[C@H]1Nc1cc(CO)cc[nH+]1 ZINC000882363684 591337894 /nfs/dbraw/zinc/33/78/94/591337894.db2.gz JAGGZILLMBCVBF-SNVBAGLBSA-N 1 2 206.289 2.174 20 0 BEADLO Cc1[nH+]cnc(NC[C@]2(O)CCCC2(C)C)c1C ZINC000882400011 591342295 /nfs/dbraw/zinc/34/22/95/591342295.db2.gz BJRLTNYQHHSRRM-CQSZACIVSA-N 1 2 249.358 2.447 20 0 BEADLO Cc1[nH+]cnc(NC[C@@]2(O)CCC[C@H]2C)c1C ZINC000882402986 591343223 /nfs/dbraw/zinc/34/32/23/591343223.db2.gz DDPNOBAFEBGDPS-RNCFNFMXSA-N 1 2 235.331 2.056 20 0 BEADLO CO[C@@H]1CCN(c2nc[nH+]c(C)c2C)CC1(C)C ZINC000882419375 591345585 /nfs/dbraw/zinc/34/55/85/591345585.db2.gz HVMSFBBHBDKBMR-GFCCVEGCSA-N 1 2 249.358 2.345 20 0 BEADLO Cc1[nH+]cnc(NC[C@H]2CCCC[C@@H]2O)c1C ZINC000882426392 591346541 /nfs/dbraw/zinc/34/65/41/591346541.db2.gz RATVKXAHXIUBEC-NEPJUHHUSA-N 1 2 235.331 2.056 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)Nc1nc(C)cnc1C ZINC000882426821 591346862 /nfs/dbraw/zinc/34/68/62/591346862.db2.gz QMDRRZRMWBLZQW-LLVKDONJSA-N 1 2 245.330 2.483 20 0 BEADLO Cc1[nH+]cnc(N2CC[C@@H](O)CC(C)(C)C2)c1C ZINC000882428114 591347085 /nfs/dbraw/zinc/34/70/85/591347085.db2.gz NBIDULLFLFYZSZ-GFCCVEGCSA-N 1 2 249.358 2.081 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2CCS[C@H]2C)c1C ZINC000882519384 591381487 /nfs/dbraw/zinc/38/14/87/591381487.db2.gz VVQHCWMKAIVIKZ-UWVGGRQHSA-N 1 2 223.345 2.399 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2CCC[C@H](C)O2)c1C ZINC000882620672 591401670 /nfs/dbraw/zinc/40/16/70/591401670.db2.gz RLOUKODRNWXBNA-CABZTGNLSA-N 1 2 235.331 2.463 20 0 BEADLO Cc1ncnc(Nc2c[nH+]cc(N(C)C)c2)c1C ZINC000882679449 591409727 /nfs/dbraw/zinc/40/97/27/591409727.db2.gz ZEVGXEJEZJHAHT-UHFFFAOYSA-N 1 2 243.314 2.298 20 0 BEADLO CC(C)c1nc(NCC2CSC2)cc[nH+]1 ZINC000882679450 591410268 /nfs/dbraw/zinc/41/02/68/591410268.db2.gz KXMNUBNKEDKSEF-UHFFFAOYSA-N 1 2 223.345 2.375 20 0 BEADLO Fc1c[nH+]ccc1NC[C@@H]1C[C@@H]2CCC[C@H]2O1 ZINC000882715500 591418976 /nfs/dbraw/zinc/41/89/76/591418976.db2.gz DXDFXZJVRVETBG-OUJBWJOFSA-N 1 2 236.290 2.012 20 0 BEADLO CCOC1CC2(C[C@@H]2Nc2nc[nH+]c(C)c2C)C1 ZINC000882720051 591421058 /nfs/dbraw/zinc/42/10/58/591421058.db2.gz IUYQXOAIJXOUTJ-LXVYMNJGSA-N 1 2 247.342 2.463 20 0 BEADLO CCNC(=S)Nc1ccc(C)[nH+]c1C ZINC000130102540 591437552 /nfs/dbraw/zinc/43/75/52/591437552.db2.gz SQUUFXLTWFQFMG-UHFFFAOYSA-N 1 2 209.318 2.005 20 0 BEADLO C=C/C=C\CCNc1nc[nH+]c(C)c1OC ZINC000882795694 591441501 /nfs/dbraw/zinc/44/15/01/591441501.db2.gz RGQFZEHEWMODNB-WAYWQWQTSA-N 1 2 219.288 2.338 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CC[C@H](CF)C2)[nH+]1 ZINC000882840835 591451059 /nfs/dbraw/zinc/45/10/59/591451059.db2.gz GAXRVBLFBNVGTJ-SECBINFHSA-N 1 2 234.278 2.062 20 0 BEADLO Cc1nc(N2CC[C@H](c3nccs3)C2)cc[nH+]1 ZINC000882859566 591456429 /nfs/dbraw/zinc/45/64/29/591456429.db2.gz IRWCVPPAKHQCCF-JTQLQIEISA-N 1 2 246.339 2.235 20 0 BEADLO Cc1cc(C[NH2+]Cc2nc(C(C)C)c[nH]2)on1 ZINC000882983906 591493480 /nfs/dbraw/zinc/49/34/80/591493480.db2.gz RQWLIWHLKYSTQT-UHFFFAOYSA-N 1 2 234.303 2.119 20 0 BEADLO CCc1cc(C[NH2+]Cc2nc(C(C)C)c[nH]2)[nH]n1 ZINC000882997373 591499861 /nfs/dbraw/zinc/49/98/61/591499861.db2.gz LNTZRCCRMQVABC-UHFFFAOYSA-N 1 2 247.346 2.108 20 0 BEADLO CC1(C)C[C@H](O[NH+]=C(N)c2ccccc2)CO1 ZINC000883048771 591528052 /nfs/dbraw/zinc/52/80/52/591528052.db2.gz VYALJEXUWVVTDP-NSHDSACASA-N 1 2 234.299 2.101 20 0 BEADLO CCn1nccc1C[NH2+]Cc1nc(C(C)C)c[nH]1 ZINC000883182628 591564799 /nfs/dbraw/zinc/56/47/99/591564799.db2.gz HGAZSMNAXLOJIF-UHFFFAOYSA-N 1 2 247.346 2.039 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cc[nH]n2)c(Cl)n1 ZINC000883292691 591609505 /nfs/dbraw/zinc/60/95/05/591609505.db2.gz WQBWLYBPCZFJET-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO CC[N@@H+]1CC[C@@H]1CNCc1nc2ccccc2o1 ZINC000883358648 591628900 /nfs/dbraw/zinc/62/89/00/591628900.db2.gz OUHWDKMGKJDDIQ-LLVKDONJSA-N 1 2 245.326 2.012 20 0 BEADLO CC[N@H+]1CC[C@@H]1CNCc1nc2ccccc2o1 ZINC000883358648 591628903 /nfs/dbraw/zinc/62/89/03/591628903.db2.gz OUHWDKMGKJDDIQ-LLVKDONJSA-N 1 2 245.326 2.012 20 0 BEADLO CCc1ccc(NCc2c[nH+]c3n2CCC3)[nH+]c1 ZINC000883383868 591639588 /nfs/dbraw/zinc/63/95/88/591639588.db2.gz ICSMDDQLNNSFBJ-UHFFFAOYSA-N 1 2 242.326 2.399 20 0 BEADLO CCc1ccc(NCc2cnc3n2CCC3)[nH+]c1 ZINC000883383868 591639591 /nfs/dbraw/zinc/63/95/91/591639591.db2.gz ICSMDDQLNNSFBJ-UHFFFAOYSA-N 1 2 242.326 2.399 20 0 BEADLO CC(C)c1c[nH]c(CN[C@@H](C)C(F)F)[nH+]1 ZINC000883408349 591651859 /nfs/dbraw/zinc/65/18/59/591651859.db2.gz USMZOGJUXOHULH-ZETCQYMHSA-N 1 2 217.263 2.276 20 0 BEADLO Cc1cccc([C@H](C)C(=O)NC2=[NH+]CCS2)c1 ZINC000132860037 591743215 /nfs/dbraw/zinc/74/32/15/591743215.db2.gz SAXBAMHPLALTFM-JTQLQIEISA-N 1 2 248.351 2.318 20 0 BEADLO C[C@@H]1CCC[C@H](C(=O)NC2=[NH+]CCS2)C1 ZINC000133415634 591789411 /nfs/dbraw/zinc/78/94/11/591789411.db2.gz IUBAGXSZVLNGTC-BDAKNGLRSA-N 1 2 226.345 2.032 20 0 BEADLO C[C@@H]1CCN(C(=O)N2CCC[C@H]2c2[nH]cc[nH+]2)C1 ZINC000800105972 591822960 /nfs/dbraw/zinc/82/29/60/591822960.db2.gz ZDZZGHJIPOEFJA-MNOVXSKESA-N 1 2 248.330 2.008 20 0 BEADLO Fc1ccc2c(c1)CC[C@@H]2[NH2+]Cc1ccn[nH]1 ZINC000134287523 591912064 /nfs/dbraw/zinc/91/20/64/591912064.db2.gz LZGIHCPUOZSHQC-ZDUSSCGKSA-N 1 2 231.274 2.326 20 0 BEADLO CCc1nc(N2CCCC[C@H]2C[C@@H](C)O)cc[nH+]1 ZINC000884490981 591955412 /nfs/dbraw/zinc/95/54/12/591955412.db2.gz KPLIFPXMZHHNQZ-NEPJUHHUSA-N 1 2 249.358 2.169 20 0 BEADLO CCc1nc(N2CCC[C@@H]3C[C@@H]32)cc[nH+]1 ZINC000884504250 591959331 /nfs/dbraw/zinc/95/93/31/591959331.db2.gz DRZJXMDANYWNGY-ZJUUUORDSA-N 1 2 203.289 2.028 20 0 BEADLO CCC[C@]1(CO)CCN(c2cc[nH+]c(CC)n2)C1 ZINC000884511061 591960972 /nfs/dbraw/zinc/96/09/72/591960972.db2.gz WXRWKWQIGXCHDK-AWEZNQCLSA-N 1 2 249.358 2.028 20 0 BEADLO CCc1nnc(CNc2cc[nH+]c(CC)n2)s1 ZINC000884511543 591961345 /nfs/dbraw/zinc/96/13/45/591961345.db2.gz JZKCRBQIPLNWOF-UHFFFAOYSA-N 1 2 249.343 2.065 20 0 BEADLO CCc1nocc1CN(C)c1cc[nH+]c(CC)n1 ZINC000884516817 591962915 /nfs/dbraw/zinc/96/29/15/591962915.db2.gz VIHJFVLXSDQTBS-UHFFFAOYSA-N 1 2 246.314 2.226 20 0 BEADLO CCc1nc(N[C@@H]2CCOC2(C)C)cc[nH+]1 ZINC000884519649 591964252 /nfs/dbraw/zinc/96/42/52/591964252.db2.gz YTQAOBJZWRNVRM-SECBINFHSA-N 1 2 221.304 2.018 20 0 BEADLO CCC[C@H](CNc1cc[nH+]c(CC)n1)OC ZINC000884518072 591964369 /nfs/dbraw/zinc/96/43/69/591964369.db2.gz DQUNJGVXVALQKL-SNVBAGLBSA-N 1 2 223.320 2.266 20 0 BEADLO CCc1nc(N[C@@H]2CCC[C@H]2OC)cc[nH+]1 ZINC000884522472 591965830 /nfs/dbraw/zinc/96/58/30/591965830.db2.gz ZHUZLGMCSREVMZ-NXEZZACHSA-N 1 2 221.304 2.018 20 0 BEADLO CCc1nc(NC2CCC(OC)CC2)cc[nH+]1 ZINC000884526684 591966959 /nfs/dbraw/zinc/96/69/59/591966959.db2.gz AQEUCNXPGUUTKD-UHFFFAOYSA-N 1 2 235.331 2.409 20 0 BEADLO CCc1nc(N[C@H]2C[C@H](OC)C23CCC3)cc[nH+]1 ZINC000884528680 591967592 /nfs/dbraw/zinc/96/75/92/591967592.db2.gz WHLIYOGWWOKMHV-QWRGUYRKSA-N 1 2 247.342 2.409 20 0 BEADLO CCc1nc(N[C@H](CC)[C@@H](O)C(C)C)cc[nH+]1 ZINC000884530342 591968612 /nfs/dbraw/zinc/96/86/12/591968612.db2.gz JQAZAZXAPLZARW-MFKMUULPSA-N 1 2 237.347 2.246 20 0 BEADLO CCc1nc(NCCCC2(O)CCC2)cc[nH+]1 ZINC000884533180 591969727 /nfs/dbraw/zinc/96/97/27/591969727.db2.gz APZLVCCXZXQBJR-UHFFFAOYSA-N 1 2 235.331 2.146 20 0 BEADLO CCc1nc(N2C[C@H](CC)O[C@@H](CC)C2)cc[nH+]1 ZINC000884534030 591969897 /nfs/dbraw/zinc/96/98/97/591969897.db2.gz XCFIJZNHIGQOOR-RYUDHWBXSA-N 1 2 249.358 2.433 20 0 BEADLO CCc1nc(N[C@H](CO)C[C@H](C)CC)cc[nH+]1 ZINC000884542665 591972244 /nfs/dbraw/zinc/97/22/44/591972244.db2.gz KJPWBAVAGZBIMK-MNOVXSKESA-N 1 2 237.347 2.248 20 0 BEADLO CCc1nc(N[C@H]2CCS[C@@H]2C)cc[nH+]1 ZINC000884543998 591973140 /nfs/dbraw/zinc/97/31/40/591973140.db2.gz SYSJTQRLBHWLCD-BDAKNGLRSA-N 1 2 223.345 2.345 20 0 BEADLO CCc1nc(N2C[C@H](CC)OC[C@H]2C)cc[nH+]1 ZINC000884544586 591973702 /nfs/dbraw/zinc/97/37/02/591973702.db2.gz KPFJYHVQKIBFIW-MNOVXSKESA-N 1 2 235.331 2.043 20 0 BEADLO CCc1nc(N2CCCC(F)(F)C2)cc[nH+]1 ZINC000884544633 591973775 /nfs/dbraw/zinc/97/37/75/591973775.db2.gz LTLUHIOUQUHWFE-UHFFFAOYSA-N 1 2 227.258 2.275 20 0 BEADLO CCc1nc(N[C@H](C)COCC2CC2)cc[nH+]1 ZINC000884545463 591974424 /nfs/dbraw/zinc/97/44/24/591974424.db2.gz IKAKDVSBUKIKQC-SNVBAGLBSA-N 1 2 235.331 2.266 20 0 BEADLO CCc1nc(N(C)Cc2ccns2)cc[nH+]1 ZINC000884554668 591976998 /nfs/dbraw/zinc/97/69/98/591976998.db2.gz ZCDNOXATLIVJKP-UHFFFAOYSA-N 1 2 234.328 2.132 20 0 BEADLO CCc1nc(N2CCC[C@@H](C)[C@H]2CCO)cc[nH+]1 ZINC000884554870 591977162 /nfs/dbraw/zinc/97/71/62/591977162.db2.gz DXWSNWIKXFKGFU-VXGBXAGGSA-N 1 2 249.358 2.026 20 0 BEADLO CCc1nc(N2CC3(CCC3)OC[C@H]2C)cc[nH+]1 ZINC000884554794 591977695 /nfs/dbraw/zinc/97/76/95/591977695.db2.gz CLGKFQLXDLSAKX-LLVKDONJSA-N 1 2 247.342 2.187 20 0 BEADLO CCc1nc(NC[C@H]2CCC[C@@H](C)O2)cc[nH+]1 ZINC000884557156 591978563 /nfs/dbraw/zinc/97/85/63/591978563.db2.gz ISTCULGMZLCUPC-GHMZBOCLSA-N 1 2 235.331 2.409 20 0 BEADLO CCc1nc(N2CCC(CCOC)CC2)cc[nH+]1 ZINC000884562883 591981001 /nfs/dbraw/zinc/98/10/01/591981001.db2.gz NQZUKDUHZMQSTO-UHFFFAOYSA-N 1 2 249.358 2.292 20 0 BEADLO CCc1nc(NCC2CC=CC2)cc[nH+]1 ZINC000884563620 591981183 /nfs/dbraw/zinc/98/11/83/591981183.db2.gz KHUHLQRLTJROLU-UHFFFAOYSA-N 1 2 203.289 2.417 20 0 BEADLO CCc1nc(N[C@H]2[C@@H](C)[C@@H](C)O[C@H]2C)cc[nH+]1 ZINC000884565728 591982014 /nfs/dbraw/zinc/98/20/14/591982014.db2.gz RKAFNRCTKWVCSN-WJZNIJOASA-N 1 2 235.331 2.263 20 0 BEADLO CCc1nc(N2C[C@H](OC)CC[C@@H]2C)cc[nH+]1 ZINC000884571025 591982167 /nfs/dbraw/zinc/98/21/67/591982167.db2.gz FJROHGYONPDMBA-WDEREUQCSA-N 1 2 235.331 2.043 20 0 BEADLO CCc1nc(N[C@H]2CO[C@H](C3CC3)C2)cc[nH+]1 ZINC000884566135 591982398 /nfs/dbraw/zinc/98/23/98/591982398.db2.gz CIHZOCVXBRCRDM-MNOVXSKESA-N 1 2 233.315 2.018 20 0 BEADLO CCC[C@H](CCO)Nc1cc[nH+]c(CC)n1 ZINC000884569433 591983337 /nfs/dbraw/zinc/98/33/37/591983337.db2.gz NFWMQJMICHYSKB-SNVBAGLBSA-N 1 2 223.320 2.002 20 0 BEADLO CCc1nc(N2C[C@@H]3CC=CC[C@@H]3C2)cc[nH+]1 ZINC000884573550 591983912 /nfs/dbraw/zinc/98/39/12/591983912.db2.gz OXCJCIFQDHDBFG-TXEJJXNPSA-N 1 2 229.327 2.441 20 0 BEADLO CCOC1CC2(C[C@H]2Nc2cc[nH+]c(CC)n2)C1 ZINC000884579877 591985752 /nfs/dbraw/zinc/98/57/52/591985752.db2.gz KUWRNBLZKFTYJS-IQLKVPPVSA-N 1 2 247.342 2.409 20 0 BEADLO CCc1nc(N2CCC[C@H](CF)C2)cc[nH+]1 ZINC000884581323 591986845 /nfs/dbraw/zinc/98/68/45/591986845.db2.gz ZNFMLZBFSAAWBI-SNVBAGLBSA-N 1 2 223.295 2.225 20 0 BEADLO Cc1nc(N2C[C@@H]3C[C@@H]3C2)c2c([nH+]1)CCCC2 ZINC000884588385 591988565 /nfs/dbraw/zinc/98/85/65/591988565.db2.gz GTXFUCVCMIXZSJ-PHIMTYICSA-N 1 2 229.327 2.120 20 0 BEADLO Fc1c[nH+]ccc1N1C[C@@H]2CSC[C@@H]2C1 ZINC000884644676 592001629 /nfs/dbraw/zinc/00/16/29/592001629.db2.gz XSEPMCXSEGWARK-DTORHVGOSA-N 1 2 224.304 2.020 20 0 BEADLO C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1CNc1cc(CO)cc[nH+]1 ZINC000884649257 592002511 /nfs/dbraw/zinc/00/25/11/592002511.db2.gz XTTLZBVFZCSCPN-FOUMNBMASA-N 1 2 232.327 2.278 20 0 BEADLO C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1CNc1cc(CO)cc[nH+]1 ZINC000884649260 592002702 /nfs/dbraw/zinc/00/27/02/592002702.db2.gz XTTLZBVFZCSCPN-XEZLXBQYSA-N 1 2 232.327 2.278 20 0 BEADLO Fc1c[nH+]ccc1NC[C@H]1CC2(CCC2)CO1 ZINC000884661536 592006776 /nfs/dbraw/zinc/00/67/76/592006776.db2.gz UIKQSVCPLPLOQB-SNVBAGLBSA-N 1 2 236.290 2.014 20 0 BEADLO CC1(C)C[N@H+](CCSC(F)(F)F)CCO1 ZINC000885930884 592109618 /nfs/dbraw/zinc/10/96/18/592109618.db2.gz KMDWHIYYWHSCFH-UHFFFAOYSA-N 1 2 243.294 2.350 20 0 BEADLO CC1(C)C[N@@H+](CCSC(F)(F)F)CCO1 ZINC000885930884 592109619 /nfs/dbraw/zinc/10/96/19/592109619.db2.gz KMDWHIYYWHSCFH-UHFFFAOYSA-N 1 2 243.294 2.350 20 0 BEADLO Cc1coc(C[NH2+]Cc2cccc(F)n2)c1 ZINC000886041084 592138681 /nfs/dbraw/zinc/13/86/81/592138681.db2.gz KFCFHSHBLMETOY-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO CCc1ncc(C[NH2+]Cc2cc(C)co2)o1 ZINC000886136249 592160403 /nfs/dbraw/zinc/16/04/03/592160403.db2.gz JMDRCPFEOZZBPC-UHFFFAOYSA-N 1 2 220.272 2.428 20 0 BEADLO O[C@@H]1C[N@H+](CC[C@@H]2C[C@H]2C2CC2)CC(F)(F)C1 ZINC000886166260 592167520 /nfs/dbraw/zinc/16/75/20/592167520.db2.gz CZUPRVDAMBKDRG-WOPDTQHZSA-N 1 2 245.313 2.125 20 0 BEADLO O[C@@H]1C[N@@H+](CC[C@@H]2C[C@H]2C2CC2)CC(F)(F)C1 ZINC000886166260 592167522 /nfs/dbraw/zinc/16/75/22/592167522.db2.gz CZUPRVDAMBKDRG-WOPDTQHZSA-N 1 2 245.313 2.125 20 0 BEADLO c1cc2c(cn1)C[N@H+](C[C@@H]1CC[C@H](C3CC3)O1)C2 ZINC000886203527 592176066 /nfs/dbraw/zinc/17/60/66/592176066.db2.gz XEILHSZPURKDRN-LSDHHAIUSA-N 1 2 244.338 2.355 20 0 BEADLO c1cc2c(cn1)C[N@@H+](C[C@@H]1CC[C@H](C3CC3)O1)C2 ZINC000886203527 592176068 /nfs/dbraw/zinc/17/60/68/592176068.db2.gz XEILHSZPURKDRN-LSDHHAIUSA-N 1 2 244.338 2.355 20 0 BEADLO CCn1cc[nH+]c1CNCc1cc(C2CC2)no1 ZINC000886272690 592192615 /nfs/dbraw/zinc/19/26/15/592192615.db2.gz ZBDBTJFZZWDFHG-UHFFFAOYSA-N 1 2 246.314 2.058 20 0 BEADLO CCn1ccnc1C[NH2+]Cc1cc(C2CC2)no1 ZINC000886272690 592192618 /nfs/dbraw/zinc/19/26/18/592192618.db2.gz ZBDBTJFZZWDFHG-UHFFFAOYSA-N 1 2 246.314 2.058 20 0 BEADLO Cc1ncsc1C[NH2+][C@H](C)c1ncco1 ZINC000886274054 592194038 /nfs/dbraw/zinc/19/40/38/592194038.db2.gz LPBWHXLUFJAQAC-MRVPVSSYSA-N 1 2 223.301 2.290 20 0 BEADLO CCOC(=O)C[NH2+][C@@H](Cc1ccccc1)C(C)C ZINC000886422579 592224315 /nfs/dbraw/zinc/22/43/15/592224315.db2.gz SNCMTAQFUNDXQE-AWEZNQCLSA-N 1 2 249.354 2.406 20 0 BEADLO COC(=O)[C@H]1CC[C@H](Nc2ccc[nH+]c2C)C1 ZINC000886578441 592266636 /nfs/dbraw/zinc/26/66/36/592266636.db2.gz XDHVJTNBDIBBIV-QWRGUYRKSA-N 1 2 234.299 2.144 20 0 BEADLO COC(=O)[C@@H]1CC[C@H](Nc2ccc(C)[nH+]c2)C1 ZINC000886577106 592267358 /nfs/dbraw/zinc/26/73/58/592267358.db2.gz XDOCANKBYOFSSE-MNOVXSKESA-N 1 2 234.299 2.144 20 0 BEADLO CCc1nc(C[NH2+][C@@H]2CCc3cccnc32)co1 ZINC000886620382 592277924 /nfs/dbraw/zinc/27/79/24/592277924.db2.gz IOKRDKAXNWQNJY-GFCCVEGCSA-N 1 2 243.310 2.409 20 0 BEADLO C[C@H]([NH2+][C@H]1CCc2cccnc21)c1ccn(C)n1 ZINC000886625716 592281524 /nfs/dbraw/zinc/28/15/24/592281524.db2.gz YJCQEAJGRMXHIY-GWCFXTLKSA-N 1 2 242.326 2.153 20 0 BEADLO C[C@H](NCc1cc(C2CC2)no1)c1[nH]cc[nH+]1 ZINC000886684840 592303014 /nfs/dbraw/zinc/30/30/14/592303014.db2.gz UFRWDDNYLYGPJY-QMMMGPOBSA-N 1 2 232.287 2.126 20 0 BEADLO C[C@H]([NH2+]Cc1cc(C2CC2)no1)c1ncc[nH]1 ZINC000886684840 592303020 /nfs/dbraw/zinc/30/30/20/592303020.db2.gz UFRWDDNYLYGPJY-QMMMGPOBSA-N 1 2 232.287 2.126 20 0 BEADLO CCCCC(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000075552360 592314021 /nfs/dbraw/zinc/31/40/21/592314021.db2.gz IHNNKEMVFPJONN-NSHDSACASA-N 1 2 235.331 2.306 20 0 BEADLO CCOCC[N@H+](CC(F)F)C1CCC1 ZINC000887098762 592440376 /nfs/dbraw/zinc/44/03/76/592440376.db2.gz AQPLQKUEWVENAD-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO CCOCC[N@@H+](CC(F)F)C1CCC1 ZINC000887098762 592440382 /nfs/dbraw/zinc/44/03/82/592440382.db2.gz AQPLQKUEWVENAD-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO O=C1OCC[C@@H]1CC[N@@H+](CC(F)F)C1CCC1 ZINC000887100963 592441738 /nfs/dbraw/zinc/44/17/38/592441738.db2.gz ZFIPKOINKWXMKX-VIFPVBQESA-N 1 2 247.285 2.059 20 0 BEADLO O=C1OCC[C@@H]1CC[N@H+](CC(F)F)C1CCC1 ZINC000887100963 592441740 /nfs/dbraw/zinc/44/17/40/592441740.db2.gz ZFIPKOINKWXMKX-VIFPVBQESA-N 1 2 247.285 2.059 20 0 BEADLO FC(F)C[N@H+](CCC1OCCCO1)C1CCC1 ZINC000887100672 592441938 /nfs/dbraw/zinc/44/19/38/592441938.db2.gz LDGFNYFYQOOCEA-UHFFFAOYSA-N 1 2 249.301 2.259 20 0 BEADLO FC(F)C[N@@H+](CCC1OCCCO1)C1CCC1 ZINC000887100672 592441942 /nfs/dbraw/zinc/44/19/42/592441942.db2.gz LDGFNYFYQOOCEA-UHFFFAOYSA-N 1 2 249.301 2.259 20 0 BEADLO CCC(=O)CC[N@H+](CC(F)F)C1CCC1 ZINC000887102513 592443483 /nfs/dbraw/zinc/44/34/83/592443483.db2.gz RYZUGPQWZSLWDM-UHFFFAOYSA-N 1 2 219.275 2.475 20 0 BEADLO CCC(=O)CC[N@@H+](CC(F)F)C1CCC1 ZINC000887102513 592443484 /nfs/dbraw/zinc/44/34/84/592443484.db2.gz RYZUGPQWZSLWDM-UHFFFAOYSA-N 1 2 219.275 2.475 20 0 BEADLO C[N@H+](CCCF)Cc1nc(C(C)(C)C)no1 ZINC000887136005 592450433 /nfs/dbraw/zinc/45/04/33/592450433.db2.gz GDRWPECOUPGNLR-UHFFFAOYSA-N 1 2 229.299 2.159 20 0 BEADLO C[N@@H+](CCCF)Cc1nc(C(C)(C)C)no1 ZINC000887136005 592450436 /nfs/dbraw/zinc/45/04/36/592450436.db2.gz GDRWPECOUPGNLR-UHFFFAOYSA-N 1 2 229.299 2.159 20 0 BEADLO CC(C)n1ccnc1C[N@H+](C)CCCF ZINC000887138722 592453070 /nfs/dbraw/zinc/45/30/70/592453070.db2.gz JIIZHNCJGZOJKD-UHFFFAOYSA-N 1 2 213.300 2.255 20 0 BEADLO CC(C)n1ccnc1C[N@@H+](C)CCCF ZINC000887138722 592453074 /nfs/dbraw/zinc/45/30/74/592453074.db2.gz JIIZHNCJGZOJKD-UHFFFAOYSA-N 1 2 213.300 2.255 20 0 BEADLO C[N@H+](CCCF)Cc1ncnn1-c1ccccc1 ZINC000887142313 592459046 /nfs/dbraw/zinc/45/90/46/592459046.db2.gz FHFJDEVAFZEPRZ-UHFFFAOYSA-N 1 2 248.305 2.059 20 0 BEADLO C[N@@H+](CCCF)Cc1ncnn1-c1ccccc1 ZINC000887142313 592459049 /nfs/dbraw/zinc/45/90/49/592459049.db2.gz FHFJDEVAFZEPRZ-UHFFFAOYSA-N 1 2 248.305 2.059 20 0 BEADLO C[N@H+](CCCF)Cc1nnc(C2CC2)s1 ZINC000887142420 592459335 /nfs/dbraw/zinc/45/93/35/592459335.db2.gz JPVCEUZMEGVROG-UHFFFAOYSA-N 1 2 229.324 2.207 20 0 BEADLO C[N@@H+](CCCF)Cc1nnc(C2CC2)s1 ZINC000887142420 592459340 /nfs/dbraw/zinc/45/93/40/592459340.db2.gz JPVCEUZMEGVROG-UHFFFAOYSA-N 1 2 229.324 2.207 20 0 BEADLO CC[C@@H](NC(=O)/C=C/c1ccco1)c1[nH]cc[nH+]1 ZINC000140698714 592480100 /nfs/dbraw/zinc/48/01/00/592480100.db2.gz RNZQSYXRNUFDDB-MVIFTORASA-N 1 2 245.282 2.283 20 0 BEADLO CC[C@H](NC(=O)/C=C/c1ccco1)c1[nH]cc[nH+]1 ZINC000140698550 592480150 /nfs/dbraw/zinc/48/01/50/592480150.db2.gz RNZQSYXRNUFDDB-QRGHLMKCSA-N 1 2 245.282 2.283 20 0 BEADLO C[C@@H](CC(=O)NCC(C)(C)C1CC1)n1cc[nH+]c1 ZINC000887370524 592495119 /nfs/dbraw/zinc/49/51/19/592495119.db2.gz WEYCODBNHRMXKW-NSHDSACASA-N 1 2 249.358 2.387 20 0 BEADLO CO[C@@H]1CC[N@H+](Cc2cnc(Cl)s2)C1 ZINC000300037369 592500579 /nfs/dbraw/zinc/50/05/79/592500579.db2.gz CHPPGGOSKJXWSJ-SSDOTTSWSA-N 1 2 232.736 2.017 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC000300037369 592500580 /nfs/dbraw/zinc/50/05/80/592500580.db2.gz CHPPGGOSKJXWSJ-SSDOTTSWSA-N 1 2 232.736 2.017 20 0 BEADLO C/C=C/c1cn(CCc2cccc(C)[nH+]2)nn1 ZINC000887427891 592505070 /nfs/dbraw/zinc/50/50/70/592505070.db2.gz FZFANIXVFBCBNU-HWKANZROSA-N 1 2 228.299 2.257 20 0 BEADLO C[C@@H]1CN(C(=O)Nc2ccc3[nH+]ccn3c2)[C@@H]1C ZINC000887801672 592552894 /nfs/dbraw/zinc/55/28/94/592552894.db2.gz QJRHDSZUIHBQCL-NXEZZACHSA-N 1 2 244.298 2.206 20 0 BEADLO Cc1nocc1NC(=O)Nc1cc(C)[nH+]cc1C ZINC000887935704 592560771 /nfs/dbraw/zinc/56/07/71/592560771.db2.gz HGRYUENWHBDZMP-UHFFFAOYSA-N 1 2 246.270 2.061 20 0 BEADLO C[C@@H]1CN(C(=O)Nc2ccn3cc[nH+]c3c2)[C@H]1C ZINC000888071605 592574805 /nfs/dbraw/zinc/57/48/05/592574805.db2.gz SDJVFCZPYPSXIW-ZJUUUORDSA-N 1 2 244.298 2.206 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)NC[C@@H]1CCC=CCCC1 ZINC000890044716 592671248 /nfs/dbraw/zinc/67/12/48/592671248.db2.gz GQFZSOXDCGHJHG-GFCCVEGCSA-N 1 2 247.342 2.205 20 0 BEADLO CCC[C@H](C(=O)NCc1cn(C)c[nH+]1)C(C)C ZINC000890109299 592682577 /nfs/dbraw/zinc/68/25/77/592682577.db2.gz JTAKMGVECOFTQC-LBPRGKRZSA-N 1 2 237.347 2.109 20 0 BEADLO Cn1c[nH+]c(CNC(=O)[C@@H]2CCCCC2(C)C)c1 ZINC000890108276 592682846 /nfs/dbraw/zinc/68/28/46/592682846.db2.gz XPAOVDACEBGUEU-LBPRGKRZSA-N 1 2 249.358 2.253 20 0 BEADLO CC[C@@H](CC(=O)NCc1cn(C)c[nH+]1)C(C)C ZINC000890113428 592684428 /nfs/dbraw/zinc/68/44/28/592684428.db2.gz CPUBIFCZZAHVEX-NSHDSACASA-N 1 2 237.347 2.109 20 0 BEADLO COC(=O)c1cccc(-c2ccc[nH+]c2N)c1C ZINC001243472757 970763741 /nfs/dbraw/zinc/76/37/41/970763741.db2.gz PPUMBRXCWLSZPY-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO CNc1cc(N[C@H](C)C2CCC2)[nH+]cn1 ZINC000124428731 634423355 /nfs/dbraw/zinc/42/33/55/634423355.db2.gz NNEWVIXPMOCNDD-MRVPVSSYSA-N 1 2 206.293 2.119 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)[C@H]1CC12CC2 ZINC000335529835 634481853 /nfs/dbraw/zinc/48/18/53/634481853.db2.gz LXQZNPOQKUDCSV-SECBINFHSA-N 1 2 227.267 2.073 20 0 BEADLO Nc1[nH+]cccc1COC(=O)C[C@@H]1CC=CCC1 ZINC000924249132 635557242 /nfs/dbraw/zinc/55/72/42/635557242.db2.gz DZAQZXXDJXMFSM-LLVKDONJSA-N 1 2 246.310 2.453 20 0 BEADLO CC[C@@]1(C)C[N@H+](C/C=C\Cl)CCO1 ZINC000308240959 631216550 /nfs/dbraw/zinc/21/65/50/631216550.db2.gz STKLBFSYGTXXFN-LWTINBJPSA-N 1 2 203.713 2.240 20 0 BEADLO CC[C@@]1(C)C[N@@H+](C/C=C\Cl)CCO1 ZINC000308240959 631216551 /nfs/dbraw/zinc/21/65/51/631216551.db2.gz STKLBFSYGTXXFN-LWTINBJPSA-N 1 2 203.713 2.240 20 0 BEADLO C[C@@H]1COCCC[N@H+]1C/C(Cl)=C\Cl ZINC000308319658 631283945 /nfs/dbraw/zinc/28/39/45/631283945.db2.gz XTPCGTPDZOBLFZ-CBVZUMJXSA-N 1 2 224.131 2.416 20 0 BEADLO C[C@@H]1COCCC[N@@H+]1C/C(Cl)=C\Cl ZINC000308319658 631283943 /nfs/dbraw/zinc/28/39/43/631283943.db2.gz XTPCGTPDZOBLFZ-CBVZUMJXSA-N 1 2 224.131 2.416 20 0 BEADLO C[C@H]1COCCC[N@@H+]1C/C(Cl)=C\Cl ZINC000308319659 631284337 /nfs/dbraw/zinc/28/43/37/631284337.db2.gz XTPCGTPDZOBLFZ-MOIHINDBSA-N 1 2 224.131 2.416 20 0 BEADLO C[C@H]1COCCC[N@H+]1C/C(Cl)=C\Cl ZINC000308319659 631284343 /nfs/dbraw/zinc/28/43/43/631284343.db2.gz XTPCGTPDZOBLFZ-MOIHINDBSA-N 1 2 224.131 2.416 20 0 BEADLO C[C@@H]1Cc2cc(C[N@@H+]3CCOC[C@@H]3C)ccc2O1 ZINC000891696880 631452489 /nfs/dbraw/zinc/45/24/89/631452489.db2.gz ZCTGAOKSSZBGKM-NWDGAFQWSA-N 1 2 247.338 2.231 20 0 BEADLO C[C@@H]1Cc2cc(C[N@H+]3CCOC[C@@H]3C)ccc2O1 ZINC000891696880 631452491 /nfs/dbraw/zinc/45/24/91/631452491.db2.gz ZCTGAOKSSZBGKM-NWDGAFQWSA-N 1 2 247.338 2.231 20 0 BEADLO C[C@@H]([NH2+]C[C@@H]1CCCS1)C(=O)OC(C)(C)C ZINC000087473047 631480273 /nfs/dbraw/zinc/48/02/73/631480273.db2.gz QTJXTDYVEINUOZ-ZJUUUORDSA-N 1 2 245.388 2.202 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1C[C@@H]2C[C@@H]2C[C@@H]1C ZINC000933991212 631578548 /nfs/dbraw/zinc/57/85/48/631578548.db2.gz ZFTAUHMRLAJQQE-PDEGPIFNSA-N 1 2 247.342 2.017 20 0 BEADLO OC[C@@H]1CC[N@@H+]1Cc1cc(Cl)ccc1F ZINC000934013266 631592597 /nfs/dbraw/zinc/59/25/97/631592597.db2.gz GSYYQMSTSMGQBG-JTQLQIEISA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@@H]1CC[N@H+]1Cc1cc(Cl)ccc1F ZINC000934013266 631592602 /nfs/dbraw/zinc/59/26/02/631592602.db2.gz GSYYQMSTSMGQBG-JTQLQIEISA-N 1 2 229.682 2.046 20 0 BEADLO Cc1nonc1C[NH2+]Cc1cc(Cl)cs1 ZINC000308909977 631723064 /nfs/dbraw/zinc/72/30/64/631723064.db2.gz DLWDTIFJTRWPNE-UHFFFAOYSA-N 1 2 243.719 2.383 20 0 BEADLO CCCCC1(NC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)CC1 ZINC000889525264 631842330 /nfs/dbraw/zinc/84/23/30/631842330.db2.gz NDHQWUXSJJOLNO-GHMZBOCLSA-N 1 2 247.342 2.352 20 0 BEADLO CCCCC1(NC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)CC1 ZINC000889525264 631842334 /nfs/dbraw/zinc/84/23/34/631842334.db2.gz NDHQWUXSJJOLNO-GHMZBOCLSA-N 1 2 247.342 2.352 20 0 BEADLO O[C@@H]1CC[N@H+](Cc2cc3ccccc3o2)C[C@H]1F ZINC000934575559 631947083 /nfs/dbraw/zinc/94/70/83/631947083.db2.gz KEBFSZIDGDBAKB-CHWSQXEVSA-N 1 2 249.285 2.338 20 0 BEADLO O[C@@H]1CC[N@@H+](Cc2cc3ccccc3o2)C[C@H]1F ZINC000934575559 631947085 /nfs/dbraw/zinc/94/70/85/631947085.db2.gz KEBFSZIDGDBAKB-CHWSQXEVSA-N 1 2 249.285 2.338 20 0 BEADLO C[C@H](c1ccc(F)cc1)[N@@H+]1CC[C@H](O)[C@H](F)C1 ZINC000934582515 631953734 /nfs/dbraw/zinc/95/37/34/631953734.db2.gz QRNGULWDQBVLFG-WQAKAFBOSA-N 1 2 241.281 2.291 20 0 BEADLO C[C@H](c1ccc(F)cc1)[N@H+]1CC[C@H](O)[C@H](F)C1 ZINC000934582515 631953741 /nfs/dbraw/zinc/95/37/41/631953741.db2.gz QRNGULWDQBVLFG-WQAKAFBOSA-N 1 2 241.281 2.291 20 0 BEADLO CCn1ccnc1SCc1cc[nH+]c(N)c1 ZINC000309281028 631990852 /nfs/dbraw/zinc/99/08/52/631990852.db2.gz NGNXEILIMXSJPV-UHFFFAOYSA-N 1 2 234.328 2.173 20 0 BEADLO CC[C@@H](C)CC(=O)OCc1cc[nH+]c(N)c1 ZINC000309296468 631993582 /nfs/dbraw/zinc/99/35/82/631993582.db2.gz RQHXALWRCBBARS-SECBINFHSA-N 1 2 222.288 2.143 20 0 BEADLO C[C@@H]1OCC[C@]1(C)[NH2+]CC(F)(F)C(F)F ZINC000308867285 632007993 /nfs/dbraw/zinc/00/79/93/632007993.db2.gz LKXPZCWUMDNMAT-XPUUQOCRSA-N 1 2 229.217 2.044 20 0 BEADLO C[C@H]([NH2+][C@@H]1CC[C@H]1C)C(=O)OC(C)(C)C ZINC000308871067 632032586 /nfs/dbraw/zinc/03/25/86/632032586.db2.gz YZDVNJGAMRPDCC-KXUCPTDWSA-N 1 2 213.321 2.105 20 0 BEADLO C[C@H]([NH2+][C@H]1C[C@@H](O)C1)C(F)(F)c1ccccc1 ZINC000926552061 632488170 /nfs/dbraw/zinc/48/81/70/632488170.db2.gz SJKIFCIFJSXCQB-ZMLRMANQSA-N 1 2 241.281 2.280 20 0 BEADLO CC(C)[C@@H]1CCN1C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000935252082 632568913 /nfs/dbraw/zinc/56/89/13/632568913.db2.gz PGLARHSOEWMFOG-ZDUSSCGKSA-N 1 2 243.310 2.433 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2CO[C@@H](C)[C@H]2C)c1 ZINC000926664231 632790317 /nfs/dbraw/zinc/79/03/17/632790317.db2.gz XIEIDXZFRIARMO-JFGNBEQYSA-N 1 2 236.315 2.063 20 0 BEADLO C[C@H](O)[C@H]([NH2+][C@@H](C)c1ncco1)c1ccccc1 ZINC000926730598 632899596 /nfs/dbraw/zinc/89/95/96/632899596.db2.gz ACRQDFFJUMXEJU-GVXVVHGQSA-N 1 2 246.310 2.447 20 0 BEADLO CC(C)n1cc(OCc2ccc(N)[nH+]c2)cn1 ZINC000229675135 632987486 /nfs/dbraw/zinc/98/74/86/632987486.db2.gz BEOCSTZZYJWQSQ-UHFFFAOYSA-N 1 2 232.287 2.020 20 0 BEADLO O=Cc1c[nH]nc1C=Cc1cccc2[nH+]ccn21 ZINC000180312806 633010231 /nfs/dbraw/zinc/01/02/31/633010231.db2.gz FWAGVRREVRQVIO-SNAWJCMRSA-N 1 2 238.250 2.040 20 0 BEADLO Cc1ccc(NC(=O)N2CCCC2)c(N(C)C)[nH+]1 ZINC000162379471 633027775 /nfs/dbraw/zinc/02/77/75/633027775.db2.gz BKYZRSPZCRSTOQ-UHFFFAOYSA-N 1 2 248.330 2.084 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1F)c1cc(CO)on1 ZINC000926786270 633064831 /nfs/dbraw/zinc/06/48/31/633064831.db2.gz QDYKPAIYQHLWIR-INTQDDNPSA-N 1 2 242.294 2.098 20 0 BEADLO C[C@H](NC(=O)Cc1c[nH]c[nH+]1)[C@H]1CCC[C@H](C)C1 ZINC000909412332 635955952 /nfs/dbraw/zinc/95/59/52/635955952.db2.gz AZNGDBSQLCJHJI-SRVKXCTJSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1COCC[N@H+](C/C(Cl)=C/Cl)C1 ZINC000306260249 635961057 /nfs/dbraw/zinc/96/10/57/635961057.db2.gz UWOKPAQACLUFTO-ZKUGPGMGSA-N 1 2 224.131 2.274 20 0 BEADLO C[C@@H]1COCC[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000306260249 635961061 /nfs/dbraw/zinc/96/10/61/635961061.db2.gz UWOKPAQACLUFTO-ZKUGPGMGSA-N 1 2 224.131 2.274 20 0 BEADLO CC1(F)CCN(c2nccn3c[nH+]cc23)CC1 ZINC000894982324 636011191 /nfs/dbraw/zinc/01/11/91/636011191.db2.gz LTBNXMUTYNVXAU-UHFFFAOYSA-N 1 2 234.278 2.058 20 0 BEADLO C[N@@H+](C/C(Cl)=C\Cl)C[C@H](O)C1CC1 ZINC000308500078 633734313 /nfs/dbraw/zinc/73/43/13/633734313.db2.gz WHBGRCGZNXTSPX-SGDMMICCSA-N 1 2 224.131 2.008 20 0 BEADLO C[N@H+](C/C(Cl)=C\Cl)C[C@H](O)C1CC1 ZINC000308500078 633734317 /nfs/dbraw/zinc/73/43/17/633734317.db2.gz WHBGRCGZNXTSPX-SGDMMICCSA-N 1 2 224.131 2.008 20 0 BEADLO CC(C)=CCCO[NH+]=C(N)Cc1cccnc1 ZINC000853679412 633870007 /nfs/dbraw/zinc/87/00/07/633870007.db2.gz XKAVQICFZNZNNY-UHFFFAOYSA-N 1 2 233.315 2.479 20 0 BEADLO COCc1ccc(NCc2c[nH+]cn2C)cc1 ZINC000194600362 634327132 /nfs/dbraw/zinc/32/71/32/634327132.db2.gz NDTHDVDLJORJIG-UHFFFAOYSA-N 1 2 231.299 2.179 20 0 BEADLO CNc1cc(NCc2ccc(C)c(C)n2)nc[nH+]1 ZINC000314374410 635175057 /nfs/dbraw/zinc/17/50/57/635175057.db2.gz ADXZIRIOMICHTA-UHFFFAOYSA-N 1 2 243.314 2.142 20 0 BEADLO CNc1cc(NCc2ccc(C)c(C)n2)[nH+]cn1 ZINC000314374410 635175061 /nfs/dbraw/zinc/17/50/61/635175061.db2.gz ADXZIRIOMICHTA-UHFFFAOYSA-N 1 2 243.314 2.142 20 0 BEADLO CC1(C(=O)OCc2cc[nH+]c(N)c2)CC=CC1 ZINC000924202757 635275250 /nfs/dbraw/zinc/27/52/50/635275250.db2.gz XTWBYFJEOHOQID-UHFFFAOYSA-N 1 2 232.283 2.063 20 0 BEADLO Cc1[nH]c(CNC(=O)CC(C)(C)C2CC2)[nH+]c1C ZINC000896910767 636253286 /nfs/dbraw/zinc/25/32/86/636253286.db2.gz WRTZNCONGUMXDF-UHFFFAOYSA-N 1 2 249.358 2.469 20 0 BEADLO C[C@@H]1CCCC[C@@]1(C)NC(=O)Cc1c[nH]c[nH+]1 ZINC000909566636 636255381 /nfs/dbraw/zinc/25/53/81/636255381.db2.gz IZHIHPRAZHOSLQ-ZWNOBZJWSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H](CO)[NH2+][C@@H](C)C(F)(F)c1ccccc1 ZINC000925162863 636344682 /nfs/dbraw/zinc/34/46/82/636344682.db2.gz XFTHXICCRIYVKG-UWVGGRQHSA-N 1 2 229.270 2.137 20 0 BEADLO C[C@@H](c1nc(Cc2ccccc2)no1)[NH+](C)C ZINC000350594002 636432091 /nfs/dbraw/zinc/43/20/91/636432091.db2.gz KCYQCKDKZUUOJN-JTQLQIEISA-N 1 2 231.299 2.283 20 0 BEADLO C[C@H](c1nc(Cc2ccc(F)cc2)no1)[NH+](C)C ZINC000923750281 636514778 /nfs/dbraw/zinc/51/47/78/636514778.db2.gz GHIKMKSBEAELDF-SECBINFHSA-N 1 2 249.289 2.422 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)c1cccc([N+](=O)[O-])c1 ZINC000067647666 636757963 /nfs/dbraw/zinc/75/79/63/636757963.db2.gz PSHARDXDHLVQSH-SNAWJCMRSA-N 1 2 243.222 2.214 20 0 BEADLO CCC(F)(F)COC(=O)[C@H]1CCC[N@@H+]1C(C)C ZINC000923892313 637008945 /nfs/dbraw/zinc/00/89/45/637008945.db2.gz VXYPQZATPLTVBY-SNVBAGLBSA-N 1 2 249.301 2.448 20 0 BEADLO CCC(F)(F)COC(=O)[C@H]1CCC[N@H+]1C(C)C ZINC000923892313 637008949 /nfs/dbraw/zinc/00/89/49/637008949.db2.gz VXYPQZATPLTVBY-SNVBAGLBSA-N 1 2 249.301 2.448 20 0 BEADLO CC[C@@H](C)CC(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000898907563 637065092 /nfs/dbraw/zinc/06/50/92/637065092.db2.gz UNEYABNZGLXRTR-LLVKDONJSA-N 1 2 237.347 2.171 20 0 BEADLO CC1(C)C(NC(=O)CNc2cccc[nH+]2)C1(C)C ZINC000900948818 637209727 /nfs/dbraw/zinc/20/97/27/637209727.db2.gz UPNVYWBNJVNBMK-UHFFFAOYSA-N 1 2 247.342 2.044 20 0 BEADLO CC[C@@H](Nc1cc(NC)nc[nH+]1)C1CC1 ZINC000323675439 637279005 /nfs/dbraw/zinc/27/90/05/637279005.db2.gz CXOZGAXXZVVVNH-SECBINFHSA-N 1 2 206.293 2.119 20 0 BEADLO C[C@@H]([NH2+]C1(c2ccccc2)CC1)c1cn(C)nn1 ZINC000902912782 637338950 /nfs/dbraw/zinc/33/89/50/637338950.db2.gz VYHSTDOXYNCQAL-LLVKDONJSA-N 1 2 242.326 2.155 20 0 BEADLO CC[C@H](C)C(=O)N1CCC[C@@H](c2[nH+]ccn2C)C1 ZINC000347416140 637379454 /nfs/dbraw/zinc/37/94/54/637379454.db2.gz IYGUADNSJDDDOV-NWDGAFQWSA-N 1 2 249.358 2.172 20 0 BEADLO Cn1c[nH+]cc1-c1ccc([C@@H]2CCC(=O)N2)cc1 ZINC000905304922 637762595 /nfs/dbraw/zinc/76/25/95/637762595.db2.gz ORMBNSYZUISULS-LBPRGKRZSA-N 1 2 241.294 2.038 20 0 BEADLO CCCCCCc1nc(C[NH2+]CC)no1 ZINC000164196876 637885616 /nfs/dbraw/zinc/88/56/16/637885616.db2.gz MHVMWFKGMOJBEL-UHFFFAOYSA-N 1 2 211.309 2.302 20 0 BEADLO Cc1cc(C)c(C(=O)N(C)C(C)C)c(C)[nH+]1 ZINC000905935110 637979373 /nfs/dbraw/zinc/97/93/73/637979373.db2.gz JSKJJSOVPLCCRA-UHFFFAOYSA-N 1 2 220.316 2.487 20 0 BEADLO Cc1cnccc1-c1c[nH+]c2c(c1)CCCN2 ZINC000906156544 638066438 /nfs/dbraw/zinc/06/64/38/638066438.db2.gz LOUHBHCBAOQLPD-UHFFFAOYSA-N 1 2 225.295 2.453 20 0 BEADLO COc1ccc(-c2c[nH+]c3c(c2)CCCN3)cn1 ZINC000906152218 638078138 /nfs/dbraw/zinc/07/81/38/638078138.db2.gz GTAMJHVNGSQRMO-UHFFFAOYSA-N 1 2 241.294 2.153 20 0 BEADLO C[N@H+](Cc1cn(C2CC2)nn1)Cc1ccccc1 ZINC000906254378 638119537 /nfs/dbraw/zinc/11/95/37/638119537.db2.gz IMKIUBFFUHMSAK-UHFFFAOYSA-N 1 2 242.326 2.245 20 0 BEADLO C[N@@H+](Cc1cn(C2CC2)nn1)Cc1ccccc1 ZINC000906254378 638119540 /nfs/dbraw/zinc/11/95/40/638119540.db2.gz IMKIUBFFUHMSAK-UHFFFAOYSA-N 1 2 242.326 2.245 20 0 BEADLO CCCN(C)C(=O)c1c(C)cc(C)[nH+]c1C ZINC000906447486 638168300 /nfs/dbraw/zinc/16/83/00/638168300.db2.gz LEWNFFQIWSYFHY-UHFFFAOYSA-N 1 2 220.316 2.489 20 0 BEADLO Cc1cc(C)c(C(=O)NC2CCC2)c(C)[nH+]1 ZINC000906611189 638225146 /nfs/dbraw/zinc/22/51/46/638225146.db2.gz XIQOLQPMPFTMRA-UHFFFAOYSA-N 1 2 218.300 2.289 20 0 BEADLO Cc1cc(C)c(C(=O)NCc2ccc[nH]2)c(C)[nH+]1 ZINC000906836309 638254324 /nfs/dbraw/zinc/25/43/24/638254324.db2.gz HRKDABLNBGZCFN-UHFFFAOYSA-N 1 2 243.310 2.265 20 0 BEADLO Cc1cc(C)c(C(=O)NCC(F)F)c(C)[nH+]1 ZINC000906869569 638266237 /nfs/dbraw/zinc/26/62/37/638266237.db2.gz BNJQDZDSZFZYDY-UHFFFAOYSA-N 1 2 228.242 2.002 20 0 BEADLO CCN(CCC1CC1)C(=O)CNc1cccc[nH+]1 ZINC000907380157 638374235 /nfs/dbraw/zinc/37/42/35/638374235.db2.gz FFCFUQVNCSELSV-UHFFFAOYSA-N 1 2 247.342 2.142 20 0 BEADLO C[C@H](C1CCCCC1)N(C)C(=O)Cc1c[nH+]c[nH]1 ZINC000908046204 638560651 /nfs/dbraw/zinc/56/06/51/638560651.db2.gz GFRDJHRYGCYKJT-LLVKDONJSA-N 1 2 249.358 2.379 20 0 BEADLO CC(C)(C)C(C)(C)CNC(=O)Cc1c[nH]c[nH+]1 ZINC000908376189 638674130 /nfs/dbraw/zinc/67/41/30/638674130.db2.gz RBGBKTWYFACMSW-UHFFFAOYSA-N 1 2 237.347 2.141 20 0 BEADLO CC[C@H]1CC[C@H](NC(=O)Cc2c[nH]c[nH+]2)CC1 ZINC000908380581 638676442 /nfs/dbraw/zinc/67/64/42/638676442.db2.gz NOPNUYKEWPHBFT-XYPYZODXSA-N 1 2 235.331 2.037 20 0 BEADLO CCC1(NC(=O)CNc2cccc[nH+]2)CCCC1 ZINC000908557185 639014735 /nfs/dbraw/zinc/01/47/35/639014735.db2.gz PEJUDKJCOQGSDS-UHFFFAOYSA-N 1 2 247.342 2.333 20 0 BEADLO CN(C(=O)CNc1cccc[nH+]1)C1CC(C)(C)C1 ZINC000909914158 639257734 /nfs/dbraw/zinc/25/77/34/639257734.db2.gz WFDLDXDZMROAHU-UHFFFAOYSA-N 1 2 247.342 2.141 20 0 BEADLO Cn1c[nH+]cc1Cc1noc(C2(C)CC=CC2)n1 ZINC000923960763 639300227 /nfs/dbraw/zinc/30/02/27/639300227.db2.gz DXHBPGOTAOWCLK-UHFFFAOYSA-N 1 2 244.298 2.002 20 0 BEADLO CC1(CCC(=O)OCc2cc[nH+]c(N)c2)CC1 ZINC000910037846 639345882 /nfs/dbraw/zinc/34/58/82/639345882.db2.gz KOMCTJIBRGFIRF-UHFFFAOYSA-N 1 2 234.299 2.287 20 0 BEADLO CC1(CCC(=O)OCc2ccc(N)[nH+]c2)CC1 ZINC000910038535 639347144 /nfs/dbraw/zinc/34/71/44/639347144.db2.gz XVCLIMBZXCIRPS-UHFFFAOYSA-N 1 2 234.299 2.287 20 0 BEADLO CC[C@@H](CO)[N@@H+]1CCn2c(cc3ccccc32)C1 ZINC000930533859 639803549 /nfs/dbraw/zinc/80/35/49/639803549.db2.gz XYCRLWLBTMUZKM-ZDUSSCGKSA-N 1 2 244.338 2.228 20 0 BEADLO CC[C@@H](CO)[N@H+]1CCn2c(cc3ccccc32)C1 ZINC000930533859 639803550 /nfs/dbraw/zinc/80/35/50/639803550.db2.gz XYCRLWLBTMUZKM-ZDUSSCGKSA-N 1 2 244.338 2.228 20 0 BEADLO CCc1onc(C)c1C[N@H+](C(C)C)C1COC1 ZINC000930595193 639815426 /nfs/dbraw/zinc/81/54/26/639815426.db2.gz OZKOZQOHEUCOEB-UHFFFAOYSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1onc(C)c1C[N@@H+](C(C)C)C1COC1 ZINC000930595193 639815427 /nfs/dbraw/zinc/81/54/27/639815427.db2.gz OZKOZQOHEUCOEB-UHFFFAOYSA-N 1 2 238.331 2.155 20 0 BEADLO C[C@@H](c1ccc(F)nc1)[N@@H+]1CC[C@@H](F)C1 ZINC000930603026 639817128 /nfs/dbraw/zinc/81/71/28/639817128.db2.gz HAEXDHYIXUJQLA-WCBMZHEXSA-N 1 2 212.243 2.326 20 0 BEADLO C[C@@H](c1ccc(F)nc1)[N@H+]1CC[C@@H](F)C1 ZINC000930603026 639817129 /nfs/dbraw/zinc/81/71/29/639817129.db2.gz HAEXDHYIXUJQLA-WCBMZHEXSA-N 1 2 212.243 2.326 20 0 BEADLO C=C/C=C\CC[NH2+][C@]1(C)CC(C)(C)OC1=O ZINC000930876868 639966993 /nfs/dbraw/zinc/96/69/93/639966993.db2.gz ASRKINJWECOVTQ-FMFIFOJESA-N 1 2 223.316 2.193 20 0 BEADLO Cc1ncc(CSCCn2cc[nH+]c2)o1 ZINC000912430357 640058715 /nfs/dbraw/zinc/05/87/15/640058715.db2.gz QFKNYFYVCATLOK-UHFFFAOYSA-N 1 2 223.301 2.113 20 0 BEADLO C[C@@H](c1ncccn1)[N@H+](C)CC1=CCSC1 ZINC000931070611 640059023 /nfs/dbraw/zinc/05/90/23/640059023.db2.gz FSEURWOHBQDRAO-JTQLQIEISA-N 1 2 235.356 2.143 20 0 BEADLO C[C@@H](c1ncccn1)[N@@H+](C)CC1=CCSC1 ZINC000931070611 640059033 /nfs/dbraw/zinc/05/90/33/640059033.db2.gz FSEURWOHBQDRAO-JTQLQIEISA-N 1 2 235.356 2.143 20 0 BEADLO COC/C(C)=C/C[N@@H+]1Cc2ccc(O)cc2C1 ZINC000931164530 640083651 /nfs/dbraw/zinc/08/36/51/640083651.db2.gz AQPZKBWQBVLYGF-VZUCSPMQSA-N 1 2 233.311 2.301 20 0 BEADLO COC/C(C)=C/C[N@H+]1Cc2ccc(O)cc2C1 ZINC000931164530 640083653 /nfs/dbraw/zinc/08/36/53/640083653.db2.gz AQPZKBWQBVLYGF-VZUCSPMQSA-N 1 2 233.311 2.301 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)N1CC=CC12CCCCC2 ZINC000912475835 640091992 /nfs/dbraw/zinc/09/19/92/640091992.db2.gz ZGRTUFCTYAALMG-UHFFFAOYSA-N 1 2 245.326 2.054 20 0 BEADLO COC[C@H](C[N@@H+]1CC[C@H]1C(F)F)C(C)C ZINC000931426574 640195676 /nfs/dbraw/zinc/19/56/76/640195676.db2.gz NCCICTWLPYMHJW-UWVGGRQHSA-N 1 2 221.291 2.244 20 0 BEADLO COC[C@H](C[N@H+]1CC[C@H]1C(F)F)C(C)C ZINC000931426574 640195679 /nfs/dbraw/zinc/19/56/79/640195679.db2.gz NCCICTWLPYMHJW-UWVGGRQHSA-N 1 2 221.291 2.244 20 0 BEADLO C[C@@H]1CCN(C(=O)c2cc3c[nH+]ccc3[nH]2)C1 ZINC000931429486 640199431 /nfs/dbraw/zinc/19/94/31/640199431.db2.gz UFDFRNAVGGSIRU-SECBINFHSA-N 1 2 229.283 2.045 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)N1CCC[C@@H]2CCCC[C@@H]21 ZINC000912768258 640201816 /nfs/dbraw/zinc/20/18/16/640201816.db2.gz PBQXCJSBWGHCNK-AAEUAGOBSA-N 1 2 247.342 2.133 20 0 BEADLO CC1(C)CCC[C@H]1CCNC(=O)Cc1c[nH]c[nH+]1 ZINC000912971053 640268747 /nfs/dbraw/zinc/26/87/47/640268747.db2.gz CSSOCWCSYCHLAE-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO CCON(CC)Cc1cc(C)cc(C)[nH+]1 ZINC000931570098 640277108 /nfs/dbraw/zinc/27/71/08/640277108.db2.gz CPMMYRXWAOHSNE-UHFFFAOYSA-N 1 2 208.305 2.472 20 0 BEADLO CCc1ncc(C[NH2+][C@H](C)c2nccnc2C)o1 ZINC000931618929 640287909 /nfs/dbraw/zinc/28/79/09/640287909.db2.gz SVCKCOCMVZFOEW-SNVBAGLBSA-N 1 2 246.314 2.186 20 0 BEADLO Fc1cccc2c1CC[C@@H]2[NH2+]Cc1nncs1 ZINC000931755951 640352941 /nfs/dbraw/zinc/35/29/41/640352941.db2.gz XUMXARHSUZBBPL-NSHDSACASA-N 1 2 249.314 2.454 20 0 BEADLO CCC[N@@H+]1CCOC[C@@H]1c1ccc(COC)o1 ZINC000932322630 640475382 /nfs/dbraw/zinc/47/53/82/640475382.db2.gz HADPVRLRWSHEJU-GFCCVEGCSA-N 1 2 239.315 2.209 20 0 BEADLO CCC[N@H+]1CCOC[C@@H]1c1ccc(COC)o1 ZINC000932322630 640475388 /nfs/dbraw/zinc/47/53/88/640475388.db2.gz HADPVRLRWSHEJU-GFCCVEGCSA-N 1 2 239.315 2.209 20 0 BEADLO C[C@H]1CC[N@H+](Cc2cncc(Cl)c2)CCO1 ZINC000932337402 640475585 /nfs/dbraw/zinc/47/55/85/640475585.db2.gz YBEUINKUYJSEQJ-JTQLQIEISA-N 1 2 240.734 2.346 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2cncc(Cl)c2)CCO1 ZINC000932337402 640475589 /nfs/dbraw/zinc/47/55/89/640475589.db2.gz YBEUINKUYJSEQJ-JTQLQIEISA-N 1 2 240.734 2.346 20 0 BEADLO C[C@H]1CC[N@H+](Cc2coc(C3CC3)n2)CCO1 ZINC000932338087 640481690 /nfs/dbraw/zinc/48/16/90/640481690.db2.gz YKGKLYMNIRKXCX-JTQLQIEISA-N 1 2 236.315 2.163 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2coc(C3CC3)n2)CCO1 ZINC000932338087 640481694 /nfs/dbraw/zinc/48/16/94/640481694.db2.gz YKGKLYMNIRKXCX-JTQLQIEISA-N 1 2 236.315 2.163 20 0 BEADLO CC(C)n1ccnc1C[N@@H+]1CCO[C@H](C)CC1 ZINC000932339936 640484067 /nfs/dbraw/zinc/48/40/67/640484067.db2.gz FQWFXRAHWPELKH-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccnc1C[N@H+]1CCO[C@H](C)CC1 ZINC000932339936 640484068 /nfs/dbraw/zinc/48/40/68/640484068.db2.gz FQWFXRAHWPELKH-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO COC(C)(C)[C@H](C)[NH2+]Cc1noc(C(C)C)n1 ZINC000932370738 640500923 /nfs/dbraw/zinc/50/09/23/640500923.db2.gz UJTOTZPDYZLNCV-VIFPVBQESA-N 1 2 241.335 2.096 20 0 BEADLO CCCCOC(=O)[C@@H](C)[NH2+][C@H](C)C(C)(C)OC ZINC000932368591 640501146 /nfs/dbraw/zinc/50/11/46/640501146.db2.gz HWLDJASTPAKUCK-GHMZBOCLSA-N 1 2 245.363 2.121 20 0 BEADLO COC(C)(C)[C@@H](C)[NH2+]Cc1noc(C(C)C)n1 ZINC000932370737 640501524 /nfs/dbraw/zinc/50/15/24/640501524.db2.gz UJTOTZPDYZLNCV-SECBINFHSA-N 1 2 241.335 2.096 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2C[C@@H]3C[C@@H]3C[C@H]2C)cc[nH+]1 ZINC000932605797 640582251 /nfs/dbraw/zinc/58/22/51/640582251.db2.gz GLDWHGGOVIALNX-GASQSECBSA-N 1 2 244.338 2.433 20 0 BEADLO Cc1cc(NC(=O)C[C@@H]2CC=CCC2)cc[nH+]1 ZINC000932607815 640585605 /nfs/dbraw/zinc/58/56/05/640585605.db2.gz YGAQPEUJNVXWMH-GFCCVEGCSA-N 1 2 230.311 2.497 20 0 BEADLO FC1(C2CC2)CC[NH+](Cc2cnns2)CC1 ZINC000932624797 640588277 /nfs/dbraw/zinc/58/82/77/640588277.db2.gz PQWIIMIIRGMJMD-UHFFFAOYSA-N 1 2 241.335 2.252 20 0 BEADLO Cc1nnc(C[NH+]2CCC(F)(C3CC3)CC2)o1 ZINC000932627586 640588985 /nfs/dbraw/zinc/58/89/85/640588985.db2.gz VRDRCWNVBKUYDH-UHFFFAOYSA-N 1 2 239.294 2.092 20 0 BEADLO CC1(C)C[C@H]1CNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000932634082 640591548 /nfs/dbraw/zinc/59/15/48/640591548.db2.gz SZSIPVREWVKJKJ-JTQLQIEISA-N 1 2 243.310 2.339 20 0 BEADLO CNc1cc(N(C)[C@@H](C)CCSC)nc[nH+]1 ZINC000157229714 640641388 /nfs/dbraw/zinc/64/13/88/640641388.db2.gz KNOHJJIIHZPOAX-VIFPVBQESA-N 1 2 240.376 2.096 20 0 BEADLO CNc1cc(N(C)[C@@H](C)CCSC)[nH+]cn1 ZINC000157229714 640641392 /nfs/dbraw/zinc/64/13/92/640641392.db2.gz KNOHJJIIHZPOAX-VIFPVBQESA-N 1 2 240.376 2.096 20 0 BEADLO CCO[C@H]1CC[N@H+](Cc2ncc(C(C)C)o2)C1 ZINC000932968116 640653134 /nfs/dbraw/zinc/65/31/34/640653134.db2.gz AWIUUNOGYSSVPZ-NSHDSACASA-N 1 2 238.331 2.409 20 0 BEADLO CCO[C@H]1CC[N@@H+](Cc2ncc(C(C)C)o2)C1 ZINC000932968116 640653137 /nfs/dbraw/zinc/65/31/37/640653137.db2.gz AWIUUNOGYSSVPZ-NSHDSACASA-N 1 2 238.331 2.409 20 0 BEADLO COc1cc([NH2+]C[C@@H]2C[C@H]2C)ccc1N ZINC000166747760 640669794 /nfs/dbraw/zinc/66/97/94/640669794.db2.gz WMTXIQGARUQFGU-BDAKNGLRSA-N 1 2 206.289 2.345 20 0 BEADLO c1cc(C[N@H+]2CCOC[C@H]2CC2CC2)sn1 ZINC000933208171 640678744 /nfs/dbraw/zinc/67/87/44/640678744.db2.gz FEGJLJIHALCWGV-LLVKDONJSA-N 1 2 238.356 2.144 20 0 BEADLO c1cc(C[N@@H+]2CCOC[C@H]2CC2CC2)sn1 ZINC000933208171 640678749 /nfs/dbraw/zinc/67/87/49/640678749.db2.gz FEGJLJIHALCWGV-LLVKDONJSA-N 1 2 238.356 2.144 20 0 BEADLO CCC[C@@H]1C[C@H]1NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000933876086 640779611 /nfs/dbraw/zinc/77/96/11/640779611.db2.gz INWQTLIBYMKLAG-BXKDBHETSA-N 1 2 243.310 2.481 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1CC[C@@H]2C[C@@H]2CC1 ZINC000933994545 640801882 /nfs/dbraw/zinc/80/18/82/640801882.db2.gz ZGNDNURQKTWHJD-CNDDSTCGSA-N 1 2 247.342 2.161 20 0 BEADLO C[C@@]1(O)CCC[N@H+](C/C(Cl)=C\Cl)C1 ZINC000228223586 640866830 /nfs/dbraw/zinc/86/68/30/640866830.db2.gz IYMXPAOUGNLHDH-WHXYTISESA-N 1 2 224.131 2.152 20 0 BEADLO C[C@@]1(O)CCC[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000228223586 640866833 /nfs/dbraw/zinc/86/68/33/640866833.db2.gz IYMXPAOUGNLHDH-WHXYTISESA-N 1 2 224.131 2.152 20 0 BEADLO COc1cc([NH2+]C[C@@H]2CCSC2)ccc1N ZINC000228546870 640880408 /nfs/dbraw/zinc/88/04/08/640880408.db2.gz PVLAKVYCCPSOGR-VIFPVBQESA-N 1 2 238.356 2.442 20 0 BEADLO C[C@H]([NH2+]C[C@H]1CCCS1)C(=O)OC(C)(C)C ZINC000087473048 640897869 /nfs/dbraw/zinc/89/78/69/640897869.db2.gz QTJXTDYVEINUOZ-VHSXEESVSA-N 1 2 245.388 2.202 20 0 BEADLO CCC[C@H]1CCC[C@H]1C(=O)NC1C[NH+](CC)C1 ZINC001030568573 640920743 /nfs/dbraw/zinc/92/07/43/640920743.db2.gz FQUGRNFEQPXHAU-WCQYABFASA-N 1 2 238.375 2.023 20 0 BEADLO CCCNc1cc(N(C)CC2CC2)nc[nH+]1 ZINC000087820479 641055638 /nfs/dbraw/zinc/05/56/38/641055638.db2.gz FGJDPCRQYJEEGE-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO CCCNc1cc(N(C)CC2CC2)[nH+]cn1 ZINC000087820479 641055639 /nfs/dbraw/zinc/05/56/39/641055639.db2.gz FGJDPCRQYJEEGE-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO CO[C@H]1CC[C@H]1[N@H+](C)Cc1scnc1Cl ZINC000934107995 641061671 /nfs/dbraw/zinc/06/16/71/641061671.db2.gz YIEMEWUUDQQDCJ-SFYZADRCSA-N 1 2 246.763 2.406 20 0 BEADLO CO[C@H]1CC[C@H]1[N@@H+](C)Cc1scnc1Cl ZINC000934107995 641061673 /nfs/dbraw/zinc/06/16/73/641061673.db2.gz YIEMEWUUDQQDCJ-SFYZADRCSA-N 1 2 246.763 2.406 20 0 BEADLO CNc1cc(N2CCC[C@@H](C)CC2)nc[nH+]1 ZINC000087830131 641063318 /nfs/dbraw/zinc/06/33/18/641063318.db2.gz SQUJHZHOGCVISV-SNVBAGLBSA-N 1 2 220.320 2.145 20 0 BEADLO CNc1cc(N2CCC[C@@H](C)CC2)[nH+]cn1 ZINC000087830131 641063322 /nfs/dbraw/zinc/06/33/22/641063322.db2.gz SQUJHZHOGCVISV-SNVBAGLBSA-N 1 2 220.320 2.145 20 0 BEADLO C[C@H]1CCN(C(=O)c2cc3c[nH+]ccc3[nH]2)[C@H]1C ZINC000934096824 641063689 /nfs/dbraw/zinc/06/36/89/641063689.db2.gz AIBAAVYBAPRCPK-UWVGGRQHSA-N 1 2 243.310 2.433 20 0 BEADLO CNc1cc(N[C@H]2CCC[C@@H]2C)[nH+]cn1 ZINC000087829553 641063815 /nfs/dbraw/zinc/06/38/15/641063815.db2.gz MCXGOLVIJLLZMX-IUCAKERBSA-N 1 2 206.293 2.119 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@H+](C)C/C(Cl)=C/Cl ZINC000934113546 641076189 /nfs/dbraw/zinc/07/61/89/641076189.db2.gz BITAXJPEPUAQEA-XOPPAYCJSA-N 1 2 224.131 2.415 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@@H+](C)C/C(Cl)=C/Cl ZINC000934113546 641076195 /nfs/dbraw/zinc/07/61/95/641076195.db2.gz BITAXJPEPUAQEA-XOPPAYCJSA-N 1 2 224.131 2.415 20 0 BEADLO C[C@H]([NH2+]Cc1cc2n(n1)CCC2)c1cncs1 ZINC000934193710 641097325 /nfs/dbraw/zinc/09/73/25/641097325.db2.gz LUHOAIYHCSIFLK-VIFPVBQESA-N 1 2 248.355 2.137 20 0 BEADLO C[C@@]1(C2CC2)COCC[N@@H+]1Cc1ccns1 ZINC000934474465 641168426 /nfs/dbraw/zinc/16/84/26/641168426.db2.gz DNIUYRCRGSYGNC-LBPRGKRZSA-N 1 2 238.356 2.144 20 0 BEADLO C[C@@]1(C2CC2)COCC[N@H+]1Cc1ccns1 ZINC000934474465 641168429 /nfs/dbraw/zinc/16/84/29/641168429.db2.gz DNIUYRCRGSYGNC-LBPRGKRZSA-N 1 2 238.356 2.144 20 0 BEADLO CCO[C@H]1CC[N@H+](CC(F)(F)CC)C1 ZINC000932972410 641169030 /nfs/dbraw/zinc/16/90/30/641169030.db2.gz OHYQUHSFFSPISF-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CCO[C@H]1CC[N@@H+](CC(F)(F)CC)C1 ZINC000932972410 641169038 /nfs/dbraw/zinc/16/90/38/641169038.db2.gz OHYQUHSFFSPISF-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CCCNc1cc(N[C@H]2CCSC2)nc[nH+]1 ZINC000231445480 641172583 /nfs/dbraw/zinc/17/25/83/641172583.db2.gz POMBJUMBRAFKRY-VIFPVBQESA-N 1 2 238.360 2.216 20 0 BEADLO CCCNc1cc(N[C@H]2CCSC2)[nH+]cn1 ZINC000231445480 641172585 /nfs/dbraw/zinc/17/25/85/641172585.db2.gz POMBJUMBRAFKRY-VIFPVBQESA-N 1 2 238.360 2.216 20 0 BEADLO CSCC(C)(C)[NH2+]CC(=O)OC(C)(C)C ZINC000934673545 641241157 /nfs/dbraw/zinc/24/11/57/641241157.db2.gz HEYKGSRTIAPVDL-UHFFFAOYSA-N 1 2 233.377 2.059 20 0 BEADLO c1nc(C[NH2+][C@H](c2ccncc2)C2CC2)c[nH]1 ZINC000934695645 641247679 /nfs/dbraw/zinc/24/76/79/641247679.db2.gz CJDSPIZTWAJKDO-ZDUSSCGKSA-N 1 2 228.299 2.046 20 0 BEADLO c1nsnc1C[NH2+][C@@H](c1ccncc1)C1CC1 ZINC000934700281 641251982 /nfs/dbraw/zinc/25/19/82/641251982.db2.gz PLOMAQCIOPKGSM-GFCCVEGCSA-N 1 2 246.339 2.174 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccc(O)c(F)c2)CCO1 ZINC000232449608 641273235 /nfs/dbraw/zinc/27/32/35/641273235.db2.gz ZFSVHMOGYBFIKD-NSHDSACASA-N 1 2 239.290 2.142 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccc(O)c(F)c2)CCO1 ZINC000232449608 641273241 /nfs/dbraw/zinc/27/32/41/641273241.db2.gz ZFSVHMOGYBFIKD-NSHDSACASA-N 1 2 239.290 2.142 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1ccc(O)c(F)c1 ZINC000232449684 641274432 /nfs/dbraw/zinc/27/44/32/641274432.db2.gz NQXOKBIOUXWPBE-NSHDSACASA-N 1 2 239.290 2.142 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1ccc(O)c(F)c1 ZINC000232449684 641274436 /nfs/dbraw/zinc/27/44/36/641274436.db2.gz NQXOKBIOUXWPBE-NSHDSACASA-N 1 2 239.290 2.142 20 0 BEADLO CC(C)OC(=O)C(C)(C)[NH2+]CCSC(C)C ZINC000934818582 641278939 /nfs/dbraw/zinc/27/89/39/641278939.db2.gz GDCDFJXWSKHLLU-UHFFFAOYSA-N 1 2 247.404 2.448 20 0 BEADLO Cc1cc(NC(=O)[C@@]2(C)C=CCC2)c(C)c[nH+]1 ZINC000935015959 641318933 /nfs/dbraw/zinc/31/89/33/641318933.db2.gz MGWYSAOFPJBPOM-AWEZNQCLSA-N 1 2 230.311 2.415 20 0 BEADLO C[C@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)C1CCC1 ZINC000935085992 641334141 /nfs/dbraw/zinc/33/41/41/641334141.db2.gz DRJAVDDJROTZHQ-VIFPVBQESA-N 1 2 243.310 2.481 20 0 BEADLO C[C@@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)C1CCC1 ZINC000935085990 641335096 /nfs/dbraw/zinc/33/50/96/641335096.db2.gz DRJAVDDJROTZHQ-SECBINFHSA-N 1 2 243.310 2.481 20 0 BEADLO C[C@@H](c1nc(Cc2ccc(F)cc2)no1)[NH+](C)C ZINC000350591370 641364022 /nfs/dbraw/zinc/36/40/22/641364022.db2.gz GHIKMKSBEAELDF-VIFPVBQESA-N 1 2 249.289 2.422 20 0 BEADLO O=C(c1cc2c[nH+]ccc2[nH]1)N1CC(C2CC2)C1 ZINC000936068384 641529679 /nfs/dbraw/zinc/52/96/79/641529679.db2.gz VMKYKPPMQGVNAW-UHFFFAOYSA-N 1 2 241.294 2.045 20 0 BEADLO C[C@H](c1ccc(F)nc1)[N@H+](C)Cc1cnccn1 ZINC000929799479 641614696 /nfs/dbraw/zinc/61/46/96/641614696.db2.gz VTGBJAALJSSQKD-SNVBAGLBSA-N 1 2 246.289 2.204 20 0 BEADLO C[C@H](c1ccc(F)nc1)[N@@H+](C)Cc1cnccn1 ZINC000929799479 641614698 /nfs/dbraw/zinc/61/46/98/641614698.db2.gz VTGBJAALJSSQKD-SNVBAGLBSA-N 1 2 246.289 2.204 20 0 BEADLO COc1nnc(C[N@H+](C)[C@@H](C)C2(C)CC2)s1 ZINC000929817369 641671541 /nfs/dbraw/zinc/67/15/41/641671541.db2.gz NPXCTBZPOYQRLQ-QMMMGPOBSA-N 1 2 241.360 2.167 20 0 BEADLO COc1nnc(C[N@@H+](C)[C@@H](C)C2(C)CC2)s1 ZINC000929817369 641671543 /nfs/dbraw/zinc/67/15/43/641671543.db2.gz NPXCTBZPOYQRLQ-QMMMGPOBSA-N 1 2 241.360 2.167 20 0 BEADLO CCOC(C)(C)C[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000159329940 641676207 /nfs/dbraw/zinc/67/62/07/641676207.db2.gz AORDJIMAXBUKTN-SNVBAGLBSA-N 1 2 245.363 2.121 20 0 BEADLO C/C=C\C(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC000228123988 641745404 /nfs/dbraw/zinc/74/54/04/641745404.db2.gz QTWVTSAVRFHTDO-ARJAWSKDSA-N 1 2 215.256 2.386 20 0 BEADLO C[NH+](C)c1ccc(NC2CSC2)cc1 ZINC000075134471 641746019 /nfs/dbraw/zinc/74/60/19/641746019.db2.gz FIOPXDIWWXYKDW-UHFFFAOYSA-N 1 2 208.330 2.280 20 0 BEADLO Cc1csc(C[NH2+]Cc2ccc(F)nc2)n1 ZINC000188982128 641778124 /nfs/dbraw/zinc/77/81/24/641778124.db2.gz YXRCDYORYJKCKG-UHFFFAOYSA-N 1 2 237.303 2.275 20 0 BEADLO Cc1cc(NC(=O)C=C2CCCC2)cc[nH+]1 ZINC000732765866 641869762 /nfs/dbraw/zinc/86/97/62/641869762.db2.gz LWDHKIKQHVKVHO-UHFFFAOYSA-N 1 2 216.284 2.251 20 0 BEADLO CCCC[N@@H+](CC)Cn1ncn(C)c1=S ZINC000078710409 641946957 /nfs/dbraw/zinc/94/69/57/641946957.db2.gz BHQGBLHFPLHTKB-UHFFFAOYSA-N 1 2 228.365 2.031 20 0 BEADLO CCCC[N@H+](CC)Cn1ncn(C)c1=S ZINC000078710409 641946953 /nfs/dbraw/zinc/94/69/53/641946953.db2.gz BHQGBLHFPLHTKB-UHFFFAOYSA-N 1 2 228.365 2.031 20 0 BEADLO CCCCNc1ccc(N2CCOCC2)c[nH+]1 ZINC000916840881 641980696 /nfs/dbraw/zinc/98/06/96/641980696.db2.gz IZHQGRSMXFANFD-UHFFFAOYSA-N 1 2 235.331 2.130 20 0 BEADLO C[C@@H]1Cc2[nH+]cn(COC(=O)C3CC3)c2C[C@@H]1C ZINC000917788714 642123504 /nfs/dbraw/zinc/12/35/04/642123504.db2.gz FAXPYFPDFZQMGP-ZJUUUORDSA-N 1 2 248.326 2.165 20 0 BEADLO CC(C)(C)c1cn(Cc2nncs2)c[nH+]1 ZINC000918475357 642201892 /nfs/dbraw/zinc/20/18/92/642201892.db2.gz VKJDWQXJGCVGHF-UHFFFAOYSA-N 1 2 222.317 2.080 20 0 BEADLO COC(=O)/C=C(/C)Cn1c[nH+]c(C(C)(C)C)c1 ZINC000918473838 642203398 /nfs/dbraw/zinc/20/33/98/642203398.db2.gz FNSFDRNSCGPFIM-POHAHGRESA-N 1 2 236.315 2.300 20 0 BEADLO O=C(CCC1CC1)NNc1cc[nH+]cc1Cl ZINC000154718246 642312926 /nfs/dbraw/zinc/31/29/26/642312926.db2.gz BSFUQBGQUCVDOV-UHFFFAOYSA-N 1 2 239.706 2.368 20 0 BEADLO CC[C@@H]1C[N@H+](C/C=C\Cl)C[C@H](C)O1 ZINC000255265423 642321764 /nfs/dbraw/zinc/32/17/64/642321764.db2.gz FTYIRQAPPWSEQP-YVDHIRPGSA-N 1 2 203.713 2.238 20 0 BEADLO CC[C@@H]1C[N@@H+](C/C=C\Cl)C[C@H](C)O1 ZINC000255265423 642321767 /nfs/dbraw/zinc/32/17/67/642321767.db2.gz FTYIRQAPPWSEQP-YVDHIRPGSA-N 1 2 203.713 2.238 20 0 BEADLO FC(F)(F)c1nccn1CCCn1cc[nH+]c1 ZINC000919925082 642405905 /nfs/dbraw/zinc/40/59/05/642405905.db2.gz FEXGTMBDHRLKKU-UHFFFAOYSA-N 1 2 244.220 2.189 20 0 BEADLO C[C@@H](CC(=O)NCCNc1cccc[nH+]1)C1CC1 ZINC000920438781 642510061 /nfs/dbraw/zinc/51/00/61/642510061.db2.gz MRDZYRMTUDXVLZ-NSHDSACASA-N 1 2 247.342 2.046 20 0 BEADLO C/C=C/C(=O)NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000921149945 642578316 /nfs/dbraw/zinc/57/83/16/642578316.db2.gz AJILQPLBOGOIAW-NSCUHMNNSA-N 1 2 241.294 2.065 20 0 BEADLO C/C=C\C(=O)NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000921149944 642578905 /nfs/dbraw/zinc/57/89/05/642578905.db2.gz AJILQPLBOGOIAW-IHWYPQMZSA-N 1 2 241.294 2.065 20 0 BEADLO C[C@@H]1COCCC[N@@H+]1C/C(Cl)=C/Cl ZINC000306261997 642734258 /nfs/dbraw/zinc/73/42/58/642734258.db2.gz XTPCGTPDZOBLFZ-CPJBWDMUSA-N 1 2 224.131 2.416 20 0 BEADLO C[C@@H]1COCCC[N@H+]1C/C(Cl)=C/Cl ZINC000306261997 642734268 /nfs/dbraw/zinc/73/42/68/642734268.db2.gz XTPCGTPDZOBLFZ-CPJBWDMUSA-N 1 2 224.131 2.416 20 0 BEADLO CNc1cc(N[C@H](C)Cc2ccco2)[nH+]cn1 ZINC000130818345 642763564 /nfs/dbraw/zinc/76/35/64/642763564.db2.gz INSAKJDWFHFWDA-SECBINFHSA-N 1 2 232.287 2.154 20 0 BEADLO O[C@H](CNc1cccc[nH+]1)c1cccc(F)c1 ZINC000068998953 642819189 /nfs/dbraw/zinc/81/91/89/642819189.db2.gz CVOIVDNRKXCJLN-GFCCVEGCSA-N 1 2 232.258 2.366 20 0 BEADLO C=CCCOC(=O)[C@H](c1ccccc1)[NH+](C)C ZINC000181980645 642935384 /nfs/dbraw/zinc/93/53/84/642935384.db2.gz PKOINWFYHMGXBW-ZDUSSCGKSA-N 1 2 233.311 2.409 20 0 BEADLO C[C@H](c1nc(Cc2cccc(F)c2)no1)[NH+](C)C ZINC000923754717 642943815 /nfs/dbraw/zinc/94/38/15/642943815.db2.gz OETMTWQDSWZBCJ-SECBINFHSA-N 1 2 249.289 2.422 20 0 BEADLO CC(C)C(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000070266093 643011324 /nfs/dbraw/zinc/01/13/24/643011324.db2.gz AYBHAUPAGRQCOP-NSHDSACASA-N 1 2 237.347 2.070 20 0 BEADLO Cc1ccc(OCC[N@@H+](C)C[C@H](C)C#N)cc1 ZINC000070870035 643076479 /nfs/dbraw/zinc/07/64/79/643076479.db2.gz SVCJGJZKBFNEQU-CYBMUJFWSA-N 1 2 232.327 2.465 20 0 BEADLO Cc1ccc(OCC[N@H+](C)C[C@H](C)C#N)cc1 ZINC000070870035 643076485 /nfs/dbraw/zinc/07/64/85/643076485.db2.gz SVCJGJZKBFNEQU-CYBMUJFWSA-N 1 2 232.327 2.465 20 0 BEADLO C[NH+](C)c1ccc(NC2CCOCC2)cc1 ZINC000036335180 643177109 /nfs/dbraw/zinc/17/71/09/643177109.db2.gz JYASRBRSTBKZHH-UHFFFAOYSA-N 1 2 220.316 2.344 20 0 BEADLO CN(C)c1ccc([NH2+]C2CCOCC2)cc1 ZINC000036335180 643177120 /nfs/dbraw/zinc/17/71/20/643177120.db2.gz JYASRBRSTBKZHH-UHFFFAOYSA-N 1 2 220.316 2.344 20 0 BEADLO Cc1cc(C)cc([C@@H](O)C[N@@H+](C)C[C@@H](C)C#N)c1 ZINC000075682641 643254054 /nfs/dbraw/zinc/25/40/54/643254054.db2.gz HFFKBDRVPRDROJ-ZFWWWQNUSA-N 1 2 246.354 2.428 20 0 BEADLO Cc1cc(C)cc([C@@H](O)C[N@H+](C)C[C@@H](C)C#N)c1 ZINC000075682641 643254059 /nfs/dbraw/zinc/25/40/59/643254059.db2.gz HFFKBDRVPRDROJ-ZFWWWQNUSA-N 1 2 246.354 2.428 20 0 BEADLO C[N@H+](Cc1cn[nH]c1)Cc1ccnc(Cl)c1 ZINC000085824989 643311786 /nfs/dbraw/zinc/31/17/86/643311786.db2.gz NJZXKHMUZRZBSF-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO C[N@@H+](Cc1cn[nH]c1)Cc1ccnc(Cl)c1 ZINC000085824989 643311791 /nfs/dbraw/zinc/31/17/91/643311791.db2.gz NJZXKHMUZRZBSF-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)NCCc1[nH]cc[nH+]1 ZINC000185813866 643395441 /nfs/dbraw/zinc/39/54/41/643395441.db2.gz MGHMRKUHSIZBPL-MDZDMXLPSA-N 1 2 235.331 2.061 20 0 BEADLO CCC/C(C)=C\C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000733984415 643485620 /nfs/dbraw/zinc/48/56/20/643485620.db2.gz XEMTXXSQXNQRFP-XFFZJAGNSA-N 1 2 233.315 2.013 20 0 BEADLO CCc1onc(C)c1NCc1[nH]c(C)c(C)[nH+]1 ZINC000922130404 643867730 /nfs/dbraw/zinc/86/77/30/643867730.db2.gz AZTXZHRRAIGICC-UHFFFAOYSA-N 1 2 234.303 2.497 20 0 BEADLO CCc1onc(C)c1NCc1c[nH+]cn1CC ZINC000922131929 643869469 /nfs/dbraw/zinc/86/94/69/643869469.db2.gz RDMRETPEWITSQB-UHFFFAOYSA-N 1 2 234.303 2.374 20 0 BEADLO COc1ccc(C[NH2+]C(CF)CF)c(C)c1 ZINC000922154011 643875446 /nfs/dbraw/zinc/87/54/46/643875446.db2.gz IBEQAYSAHCWLRD-UHFFFAOYSA-N 1 2 229.270 2.401 20 0 BEADLO C[C@@H](C(=O)OCc1c[nH+]cn1C)C1CCCC1 ZINC000085988985 643882560 /nfs/dbraw/zinc/88/25/60/643882560.db2.gz IANAGLDMZGSZGL-SNVBAGLBSA-N 1 2 236.315 2.290 20 0 BEADLO Nc1ccc(COC(=O)C2CCCCC2)c[nH+]1 ZINC000922173801 643891282 /nfs/dbraw/zinc/89/12/82/643891282.db2.gz NIWXODZPNTYOKE-UHFFFAOYSA-N 1 2 234.299 2.287 20 0 BEADLO CCCC1(C(=O)OCc2ccc(N)[nH+]c2)CC1 ZINC000922529064 644017185 /nfs/dbraw/zinc/01/71/85/644017185.db2.gz KICMGONBBNDANE-UHFFFAOYSA-N 1 2 234.299 2.287 20 0 BEADLO Nc1ccc(COC(=O)C(C2CC2)C2CC2)c[nH+]1 ZINC000922555095 644023958 /nfs/dbraw/zinc/02/39/58/644023958.db2.gz POLSHHBCBOVVIG-UHFFFAOYSA-N 1 2 246.310 2.143 20 0 BEADLO CC/C(C)=C(\C)C(=O)OCc1ccc[nH+]c1N ZINC000922593552 644038062 /nfs/dbraw/zinc/03/80/62/644038062.db2.gz LHRDYYJEZFNCOV-MDZDMXLPSA-N 1 2 234.299 2.453 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)OCc1ccc(N)[nH+]c1 ZINC000922594134 644038273 /nfs/dbraw/zinc/03/82/73/644038273.db2.gz UCAXTJQKZJOWOJ-VHSXEESVSA-N 1 2 236.315 2.389 20 0 BEADLO Nc1[nH+]cccc1COC(=O)C12CCC(CC1)C2 ZINC000922603932 644041342 /nfs/dbraw/zinc/04/13/42/644041342.db2.gz RARGCHLOBMFISE-UHFFFAOYSA-N 1 2 246.310 2.287 20 0 BEADLO Nc1ccc(COC(=O)C2=CCCCC2)c[nH+]1 ZINC000922630329 644044858 /nfs/dbraw/zinc/04/48/58/644044858.db2.gz DOBRVRBBYXLUTC-UHFFFAOYSA-N 1 2 232.283 2.207 20 0 BEADLO C/C=C(\CC)C(=O)OCc1ccc(N)[nH+]c1 ZINC000922638847 644046108 /nfs/dbraw/zinc/04/61/08/644046108.db2.gz GCIGRXMAHPFTML-XCVCLJGOSA-N 1 2 220.272 2.063 20 0 BEADLO C[C@]1(C(=O)OCc2ccc[nH+]c2N)C[C@H]2C[C@H]2C1 ZINC000922763991 644089622 /nfs/dbraw/zinc/08/96/22/644089622.db2.gz JLRPODUEYMTEBA-YABSGUDNSA-N 1 2 246.310 2.143 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1C(=O)OCc1ccc[nH+]c1N ZINC000922774751 644091042 /nfs/dbraw/zinc/09/10/42/644091042.db2.gz DLKASCLJKDWFEM-VXGBXAGGSA-N 1 2 248.326 2.389 20 0 BEADLO Nc1[nH+]cccc1COC(=O)C[C@@H]1CC[C@H]2C[C@H]21 ZINC000922777751 644093654 /nfs/dbraw/zinc/09/36/54/644093654.db2.gz AGFBUENSQMCEEW-JBLDHEPKSA-N 1 2 246.310 2.143 20 0 BEADLO C[C@@]1(C(=O)OCc2ccc[nH+]c2N)CC=CCC1 ZINC000922780437 644094064 /nfs/dbraw/zinc/09/40/64/644094064.db2.gz BDYNGDVFNPVHKF-CQSZACIVSA-N 1 2 246.310 2.453 20 0 BEADLO Nc1[nH+]cccc1COC(=O)[C@@H]1C[C@H]1C1CCC1 ZINC000922835309 644113577 /nfs/dbraw/zinc/11/35/77/644113577.db2.gz DBPPBIMULWCPDX-NWDGAFQWSA-N 1 2 246.310 2.143 20 0 BEADLO CC1(C)CC[C@@H]1C(=O)OCc1ccc[nH+]c1N ZINC000922865868 644121076 /nfs/dbraw/zinc/12/10/76/644121076.db2.gz KRLRTTHFUDLLOE-SNVBAGLBSA-N 1 2 234.299 2.143 20 0 BEADLO Cc1ccc(C[NH2+]Cc2ccon2)cc1F ZINC000086452726 644138268 /nfs/dbraw/zinc/13/82/68/644138268.db2.gz WIJLSJFIZXAKJF-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO Cc1cc(NC(=O)c2cncc(Cl)n2)cc[nH+]1 ZINC000192329409 644145662 /nfs/dbraw/zinc/14/56/62/644145662.db2.gz RHHYRWGMPIBBKP-UHFFFAOYSA-N 1 2 248.673 2.086 20 0 BEADLO Cc1occc1C[NH2+]Cc1cc(C2CC2)n(C)n1 ZINC000922952915 644197807 /nfs/dbraw/zinc/19/78/07/644197807.db2.gz KHPNSLRHJUSJGW-UHFFFAOYSA-N 1 2 245.326 2.489 20 0 BEADLO C[C@@H]1CCCN(C(=O)c2cccc3[nH+]ccn32)C1 ZINC000082319527 644368282 /nfs/dbraw/zinc/36/82/82/644368282.db2.gz CGOBROQUTREIBS-LLVKDONJSA-N 1 2 243.310 2.206 20 0 BEADLO CCC[C@@H](C)C(=O)OCCCn1cc[nH+]c1 ZINC000782985600 644749302 /nfs/dbraw/zinc/74/93/02/644749302.db2.gz IZKAMGRFBJOHRM-LLVKDONJSA-N 1 2 224.304 2.253 20 0 BEADLO CCC(=CC(=O)OCCc1c[nH+]cn1C)CC ZINC000793241560 644801724 /nfs/dbraw/zinc/80/17/24/644801724.db2.gz JFJFPTHUPHJNHV-UHFFFAOYSA-N 1 2 236.315 2.252 20 0 BEADLO O=C1Cc2cc(-c3ccc4[nH+]ccn4c3)ccc2N1 ZINC000793368455 644803409 /nfs/dbraw/zinc/80/34/09/644803409.db2.gz ZYJDPESAKUHQHB-UHFFFAOYSA-N 1 2 249.273 2.496 20 0 BEADLO C[C@@H](CNc1[nH+]cnc2c1cnn2C)C(C)(C)C ZINC000096609869 644827286 /nfs/dbraw/zinc/82/72/86/644827286.db2.gz ZVOXGGBNLKYBPQ-VIFPVBQESA-N 1 2 247.346 2.457 20 0 BEADLO CC(C)(C)OCC[N@@H+]1Cc2ccncc2C1 ZINC000809564278 644890570 /nfs/dbraw/zinc/89/05/70/644890570.db2.gz XZJGMQJYABHJGN-UHFFFAOYSA-N 1 2 220.316 2.212 20 0 BEADLO CC(C)(C)OCC[N@H+]1Cc2ccncc2C1 ZINC000809564278 644890576 /nfs/dbraw/zinc/89/05/76/644890576.db2.gz XZJGMQJYABHJGN-UHFFFAOYSA-N 1 2 220.316 2.212 20 0 BEADLO CNc1cc(N2CC[C@H](C)[C@H](C)C2)nc[nH+]1 ZINC000253070370 644933738 /nfs/dbraw/zinc/93/37/38/644933738.db2.gz MHVJKHFUNYOTBE-VHSXEESVSA-N 1 2 220.320 2.001 20 0 BEADLO CNc1cc(N2CC[C@H](C)[C@H](C)C2)[nH+]cn1 ZINC000253070370 644933745 /nfs/dbraw/zinc/93/37/45/644933745.db2.gz MHVJKHFUNYOTBE-VHSXEESVSA-N 1 2 220.320 2.001 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NCCC[C@H]1C=CCC1 ZINC000834326060 645138219 /nfs/dbraw/zinc/13/82/19/645138219.db2.gz ABRRHRYYPGCWIW-LBPRGKRZSA-N 1 2 247.342 2.205 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NCCC[C@H]1C=CCC1 ZINC000834326060 645138223 /nfs/dbraw/zinc/13/82/23/645138223.db2.gz ABRRHRYYPGCWIW-LBPRGKRZSA-N 1 2 247.342 2.205 20 0 BEADLO Cc1nonc1[C@H](C)[NH2+][C@@H]1CCCC[C@H]1F ZINC000926587164 645302458 /nfs/dbraw/zinc/30/24/58/645302458.db2.gz JIDJNPLHTSPRAD-FXBDTBDDSA-N 1 2 227.283 2.309 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cnc(C)cn2)[C@@H](CC)CO1 ZINC000844386222 645326388 /nfs/dbraw/zinc/32/63/88/645326388.db2.gz HXIZJDVGVUETIA-KBPBESRZSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cnc(C)cn2)[C@@H](CC)CO1 ZINC000844386222 645326391 /nfs/dbraw/zinc/32/63/91/645326391.db2.gz HXIZJDVGVUETIA-KBPBESRZSA-N 1 2 249.358 2.174 20 0 BEADLO C[C@@H]([NH2+][C@@H]1C[C@H]1C(F)(F)F)c1ncco1 ZINC000926799258 645438208 /nfs/dbraw/zinc/43/82/08/645438208.db2.gz PSLLNLOWKGYJMF-FSDSQADBSA-N 1 2 220.194 2.276 20 0 BEADLO Cc1noc([C@H](C)[N@H+](C)C[C@@H]2CCC=CO2)n1 ZINC000848926575 645445612 /nfs/dbraw/zinc/44/56/12/645445612.db2.gz ZTNVGIKOAOFOIW-ONGXEEELSA-N 1 2 237.303 2.064 20 0 BEADLO Cc1noc([C@H](C)[N@@H+](C)C[C@@H]2CCC=CO2)n1 ZINC000848926575 645445619 /nfs/dbraw/zinc/44/56/19/645445619.db2.gz ZTNVGIKOAOFOIW-ONGXEEELSA-N 1 2 237.303 2.064 20 0 BEADLO Cc1cc(N[C@@H](C)C[C@@H]2CCC(=O)N2)c[nH+]c1C ZINC000926854661 645457821 /nfs/dbraw/zinc/45/78/21/645457821.db2.gz FJKRXFKZLAIWFR-JQWIXIFHSA-N 1 2 247.342 2.168 20 0 BEADLO Cc1cc(N[C@H](C)c2cnnn2C)c[nH+]c1C ZINC000926855592 645458135 /nfs/dbraw/zinc/45/81/35/645458135.db2.gz MDVQEZCZQXPDTB-SNVBAGLBSA-N 1 2 231.303 2.000 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cnn(CCF)c2)C[C@H]1F ZINC000930243555 645515405 /nfs/dbraw/zinc/51/54/05/645515405.db2.gz GGOAIOZPPMZWEX-ZYHUDNBSSA-N 1 2 243.301 2.033 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cnn(CCF)c2)C[C@H]1F ZINC000930243555 645515412 /nfs/dbraw/zinc/51/54/12/645515412.db2.gz GGOAIOZPPMZWEX-ZYHUDNBSSA-N 1 2 243.301 2.033 20 0 BEADLO CCc1onc(C)c1C[NH2+][C@H](C)c1ccn(C)n1 ZINC000927133368 645564280 /nfs/dbraw/zinc/56/42/80/645564280.db2.gz CGZKKXVQFCUMRI-SNVBAGLBSA-N 1 2 248.330 2.130 20 0 BEADLO CCC[C@H](C(=O)NCc1ccc(N)[nH+]c1)C(C)C ZINC000927778735 645655282 /nfs/dbraw/zinc/65/52/82/645655282.db2.gz ZGXIVGLSOHUQKN-LBPRGKRZSA-N 1 2 249.358 2.352 20 0 BEADLO C[C@]1(CO)CCC[N@@H+]1Cc1nc(Cl)cs1 ZINC000877458829 645796753 /nfs/dbraw/zinc/79/67/53/645796753.db2.gz ARBRQQWQNDNILT-SNVBAGLBSA-N 1 2 246.763 2.143 20 0 BEADLO C[C@]1(CO)CCC[N@H+]1Cc1nc(Cl)cs1 ZINC000877458829 645796755 /nfs/dbraw/zinc/79/67/55/645796755.db2.gz ARBRQQWQNDNILT-SNVBAGLBSA-N 1 2 246.763 2.143 20 0 BEADLO C[C@@]1(CO)CCC[N@@H+]1Cc1nc(Cl)cs1 ZINC000877458828 645797492 /nfs/dbraw/zinc/79/74/92/645797492.db2.gz ARBRQQWQNDNILT-JTQLQIEISA-N 1 2 246.763 2.143 20 0 BEADLO C[C@@]1(CO)CCC[N@H+]1Cc1nc(Cl)cs1 ZINC000877458828 645797496 /nfs/dbraw/zinc/79/74/96/645797496.db2.gz ARBRQQWQNDNILT-JTQLQIEISA-N 1 2 246.763 2.143 20 0 BEADLO C[C@@H]1CCCN(C(=O)c2cc3c[nH+]ccc3[nH]2)C1 ZINC000929138197 645965812 /nfs/dbraw/zinc/96/58/12/645965812.db2.gz RDAZIFOOUNITNY-SNVBAGLBSA-N 1 2 243.310 2.435 20 0 BEADLO O=C(C[C@H]1CC=CCC1)NCCCn1cc[nH+]c1 ZINC000929155689 645978128 /nfs/dbraw/zinc/97/81/28/645978128.db2.gz DVFQDRJGSHZMAD-ZDUSSCGKSA-N 1 2 247.342 2.136 20 0 BEADLO CC1(c2noc([C@@H]3C[C@H]3c3c[nH]c[nH+]3)n2)CC1 ZINC000924087095 645978300 /nfs/dbraw/zinc/97/83/00/645978300.db2.gz GQIBRXQOYHWCRP-HTQZYQBOSA-N 1 2 230.271 2.115 20 0 BEADLO CCC(C)(C)c1noc([C@@H](C)[NH+](C)C)n1 ZINC000924158045 646000888 /nfs/dbraw/zinc/00/08/88/646000888.db2.gz IOELTDAFEMDOOA-MRVPVSSYSA-N 1 2 211.309 2.380 20 0 BEADLO Cc1nonc1[C@@H](C)[NH2+][C@H](C)c1cccnc1 ZINC000924564390 646070608 /nfs/dbraw/zinc/07/06/08/646070608.db2.gz MWVITIYRXASOIK-RKDXNWHRSA-N 1 2 232.287 2.185 20 0 BEADLO COC/C(C)=C\C[N@@H+]1CCC[C@H](c2ccn[nH]2)C1 ZINC000929297102 646071656 /nfs/dbraw/zinc/07/16/56/646071656.db2.gz UCSWIHLPEXZBBB-TZQNSNDFSA-N 1 2 249.358 2.182 20 0 BEADLO COC/C(C)=C\C[N@H+]1CCC[C@H](c2ccn[nH]2)C1 ZINC000929297102 646071662 /nfs/dbraw/zinc/07/16/62/646071662.db2.gz UCSWIHLPEXZBBB-TZQNSNDFSA-N 1 2 249.358 2.182 20 0 BEADLO COc1nnc(C[N@@H+]2C[C@@H](C)CC[C@@H]2C)s1 ZINC000929756627 646288526 /nfs/dbraw/zinc/28/85/26/646288526.db2.gz IHKHEHDYBICYDS-IUCAKERBSA-N 1 2 241.360 2.167 20 0 BEADLO COc1nnc(C[N@H+]2C[C@@H](C)CC[C@@H]2C)s1 ZINC000929756627 646288536 /nfs/dbraw/zinc/28/85/36/646288536.db2.gz IHKHEHDYBICYDS-IUCAKERBSA-N 1 2 241.360 2.167 20 0 BEADLO COc1ccc[nH+]c1NC1CC2(C1)CO[C@H](C)C2 ZINC000925955984 646548889 /nfs/dbraw/zinc/54/88/89/646548889.db2.gz KTCFLVLCKFQAJP-CDWSIMAYSA-N 1 2 248.326 2.460 20 0 BEADLO C[C@H]([NH2+]C1CC(F)(F)C1)c1ncco1 ZINC000926285517 646611387 /nfs/dbraw/zinc/61/13/87/646611387.db2.gz QMMBPRLWVHXJOA-LURJTMIESA-N 1 2 202.204 2.123 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccsc1)c1cnn(C)n1 ZINC000926368925 646627878 /nfs/dbraw/zinc/62/78/78/646627878.db2.gz GRBBGOASFCBIAG-DTWKUNHWSA-N 1 2 236.344 2.288 20 0 BEADLO Cc1ccc(C)c(NC(=O)C[C@H]([NH3+])C(F)F)c1 ZINC000724758397 711610755 /nfs/dbraw/zinc/61/07/55/711610755.db2.gz CFGZYZOKVILYQI-VIFPVBQESA-N 1 2 242.269 2.224 20 0 BEADLO CC1(C)C[C@@H](Cn2cc[nH+]c2)C(C)(C)O1 ZINC000711375667 712295501 /nfs/dbraw/zinc/29/55/01/712295501.db2.gz DFLBSBYOQMXGCS-JTQLQIEISA-N 1 2 208.305 2.477 20 0 BEADLO Cc1nc(NCC[C@H]2CCCS2)cc[nH+]1 ZINC000715619176 712528307 /nfs/dbraw/zinc/52/83/07/712528307.db2.gz GRMBFXVPRVJGCE-SNVBAGLBSA-N 1 2 223.345 2.483 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ccns1)c1cn(C)cn1 ZINC000716034233 712547482 /nfs/dbraw/zinc/54/74/82/712547482.db2.gz QLKXUGVXSWVMGC-IUCAKERBSA-N 1 2 236.344 2.288 20 0 BEADLO Cc1nc(NC[C@H]2CC(C)(C)CO2)cc[nH+]1 ZINC000717568710 712660972 /nfs/dbraw/zinc/66/09/72/712660972.db2.gz PGEGVLVYVCWDQM-SNVBAGLBSA-N 1 2 221.304 2.012 20 0 BEADLO Cc1csc(C[NH2+]Cc2cccc(F)n2)n1 ZINC000381382903 710630387 /nfs/dbraw/zinc/63/03/87/710630387.db2.gz LTKMLIBUDDWGKK-UHFFFAOYSA-N 1 2 237.303 2.275 20 0 BEADLO CCC[C@H]([NH2+][C@H]1CC12CCC2)C(=O)OCC ZINC000721220458 712899233 /nfs/dbraw/zinc/89/92/33/712899233.db2.gz JJJFWYMSZOXLHP-QWRGUYRKSA-N 1 2 225.332 2.250 20 0 BEADLO CCC[C@]1([NH2+]CC(F)(F)C(F)F)CCOC1 ZINC000381575380 710656356 /nfs/dbraw/zinc/65/63/56/710656356.db2.gz ZNVIKOWDEGJRMX-VIFPVBQESA-N 1 2 243.244 2.436 20 0 BEADLO C[C@@H]1CCC[C@H](N(C)C(=O)C[C@H]([NH3+])C(F)F)C1 ZINC000724757047 710746532 /nfs/dbraw/zinc/74/65/32/710746532.db2.gz AMMKAMDIYFDTPR-UTLUCORTSA-N 1 2 248.317 2.006 20 0 BEADLO CC(C)(O)[C@H]1CCCN(c2cccc[nH+]2)C1 ZINC000382691959 710975021 /nfs/dbraw/zinc/97/50/21/710975021.db2.gz TUTSBMNUAWRWRO-NSHDSACASA-N 1 2 220.316 2.069 20 0 BEADLO CC(C)[C@H]1C[N@H+](C/C=C\Cl)CCO1 ZINC000388751072 711067094 /nfs/dbraw/zinc/06/70/94/711067094.db2.gz BSGQPIYZBWOUQI-UMBAGQNISA-N 1 2 203.713 2.096 20 0 BEADLO CC(C)[C@H]1C[N@@H+](C/C=C\Cl)CCO1 ZINC000388751072 711067098 /nfs/dbraw/zinc/06/70/98/711067098.db2.gz BSGQPIYZBWOUQI-UMBAGQNISA-N 1 2 203.713 2.096 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@H](C)CSC(C)(C)C ZINC000390425755 711116317 /nfs/dbraw/zinc/11/63/17/711116317.db2.gz MHAVXLGRTGFNJO-ZJUUUORDSA-N 1 2 247.404 2.448 20 0 BEADLO FC(F)(F)[C@H]1CCC[C@H]([NH2+]Cc2c[nH]nn2)C1 ZINC000398352368 711407967 /nfs/dbraw/zinc/40/79/67/711407967.db2.gz GDJDYFURTRJVMM-YUMQZZPRSA-N 1 2 248.252 2.015 20 0 BEADLO FC(F)(F)[C@H]1CCC[C@H]([NH2+]Cc2cn[nH]n2)C1 ZINC000398352368 711407971 /nfs/dbraw/zinc/40/79/71/711407971.db2.gz GDJDYFURTRJVMM-YUMQZZPRSA-N 1 2 248.252 2.015 20 0 BEADLO c1[nH]nnc1C[NH2+]C1CCCCCCC1 ZINC000398343366 711408427 /nfs/dbraw/zinc/40/84/27/711408427.db2.gz WDIQSELGMCVKRY-UHFFFAOYSA-N 1 2 208.309 2.007 20 0 BEADLO c1n[nH]nc1C[NH2+]C1CCCCCCC1 ZINC000398343366 711408430 /nfs/dbraw/zinc/40/84/30/711408430.db2.gz WDIQSELGMCVKRY-UHFFFAOYSA-N 1 2 208.309 2.007 20 0 BEADLO CCCNc1cc(NCc2occc2C)nc[nH+]1 ZINC000380926365 710595009 /nfs/dbraw/zinc/59/50/09/710595009.db2.gz FRZNPMOTCSRCHE-UHFFFAOYSA-N 1 2 246.314 2.234 20 0 BEADLO CCCNc1cc(NCc2occc2C)[nH+]cn1 ZINC000380926365 710595013 /nfs/dbraw/zinc/59/50/13/710595013.db2.gz FRZNPMOTCSRCHE-UHFFFAOYSA-N 1 2 246.314 2.234 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2cscn2)n(C)n1 ZINC000381031755 710597867 /nfs/dbraw/zinc/59/78/67/710597867.db2.gz ANFUAKZZUBLFNB-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO COCC1([NH2+]Cc2nc(C(C)(C)C)co2)CC1 ZINC000724433473 710740948 /nfs/dbraw/zinc/74/09/48/710740948.db2.gz IUSQIRXJGRZWAL-UHFFFAOYSA-N 1 2 238.331 2.241 20 0 BEADLO CC(C)=CC[NH+]1CC(N(C)C(=O)c2ccco2)C1 ZINC001042416447 710780670 /nfs/dbraw/zinc/78/06/70/710780670.db2.gz NJLSYXLIPFRLRF-UHFFFAOYSA-N 1 2 248.326 2.002 20 0 BEADLO CCn1ccnc1C[NH2+][C@H](C)c1cncs1 ZINC000385437450 711012352 /nfs/dbraw/zinc/01/23/52/711012352.db2.gz GORQNPBYXXKZLJ-SECBINFHSA-N 1 2 236.344 2.210 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccccc2F)[nH]1 ZINC000392471100 711148039 /nfs/dbraw/zinc/14/80/39/711148039.db2.gz UDOLSNUBLXYYNI-MRVPVSSYSA-N 1 2 234.278 2.103 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2ccsc2)[nH]1 ZINC000392476272 711149006 /nfs/dbraw/zinc/14/90/06/711149006.db2.gz SOUOHXBBENVTAA-ZETCQYMHSA-N 1 2 222.317 2.025 20 0 BEADLO CCCNC(=S)NCc1c[nH+]c(C)cc1C ZINC000397014810 711374961 /nfs/dbraw/zinc/37/49/61/711374961.db2.gz AICJIROYKUBKFB-UHFFFAOYSA-N 1 2 237.372 2.073 20 0 BEADLO CC[C@H](Nc1cc[nH+]cc1F)[C@H]1CCCOC1 ZINC000723843891 711538566 /nfs/dbraw/zinc/53/85/66/711538566.db2.gz VEBDQDMHESMOHK-JQWIXIFHSA-N 1 2 238.306 2.260 20 0 BEADLO Cc1cn(C)nc1C[NH2+][C@@H](C)c1ccns1 ZINC000723941429 711546229 /nfs/dbraw/zinc/54/62/29/711546229.db2.gz GXPLTRRIUHPNJQ-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO C[C@@H]1CC[C@@H](O)C[N@@H+]1C/C(Cl)=C\Cl ZINC000382221898 711614726 /nfs/dbraw/zinc/61/47/26/711614726.db2.gz NGPGVKMMEDBHPR-YEPVEMNMSA-N 1 2 224.131 2.151 20 0 BEADLO C[C@@H]1CC[C@@H](O)C[N@H+]1C/C(Cl)=C\Cl ZINC000382221898 711614728 /nfs/dbraw/zinc/61/47/28/711614728.db2.gz NGPGVKMMEDBHPR-YEPVEMNMSA-N 1 2 224.131 2.151 20 0 BEADLO CC(C)COC(=O)[C@H](C)[NH2+]C1CC(C)(C)C1 ZINC000393829954 711679165 /nfs/dbraw/zinc/67/91/65/711679165.db2.gz USWXNUPXYJDDSH-JTQLQIEISA-N 1 2 227.348 2.352 20 0 BEADLO CNc1cc(NC2CC(C)(C)C2)[nH+]cn1 ZINC000395392936 711694215 /nfs/dbraw/zinc/69/42/15/711694215.db2.gz CCHMZQJNLZTFKS-UHFFFAOYSA-N 1 2 206.293 2.119 20 0 BEADLO OC[C@H]([NH2+]CC(F)(F)C(F)F)C1CCCC1 ZINC000390749956 711710301 /nfs/dbraw/zinc/71/03/01/711710301.db2.gz CNQBFCJSZOJIIT-QMMMGPOBSA-N 1 2 243.244 2.028 20 0 BEADLO C[C@@H](CNC(=O)[C@@H]1CCC1(C)C)Cn1cc[nH+]c1 ZINC000669018891 711729723 /nfs/dbraw/zinc/72/97/23/711729723.db2.gz QVMLCYURILVESS-RYUDHWBXSA-N 1 2 249.358 2.072 20 0 BEADLO Cc1cscc1C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000896914892 711784003 /nfs/dbraw/zinc/78/40/03/711784003.db2.gz CMFBBFHGIQMIOY-UHFFFAOYSA-N 1 2 249.339 2.326 20 0 BEADLO CCCCOC(=O)C[N@@H+]1CCCC(F)(F)CC1 ZINC000702793770 712060939 /nfs/dbraw/zinc/06/09/39/712060939.db2.gz YZLWIYVRXXSVCD-UHFFFAOYSA-N 1 2 249.301 2.451 20 0 BEADLO CCCCOC(=O)C[N@H+]1CCCC(F)(F)CC1 ZINC000702793770 712060940 /nfs/dbraw/zinc/06/09/40/712060940.db2.gz YZLWIYVRXXSVCD-UHFFFAOYSA-N 1 2 249.301 2.451 20 0 BEADLO CC[NH2+]Cc1noc([C@H](C)Oc2ccccc2)n1 ZINC000704260553 712102135 /nfs/dbraw/zinc/10/21/35/712102135.db2.gz NXAGEQVVQLIHBA-JTQLQIEISA-N 1 2 247.298 2.319 20 0 BEADLO Clc1csc(N2CC(n3cc[nH+]c3)C2)n1 ZINC000707091874 712165041 /nfs/dbraw/zinc/16/50/41/712165041.db2.gz NXOMTWFCWTVBGN-UHFFFAOYSA-N 1 2 240.719 2.054 20 0 BEADLO FC(F)[C@H]1CC[N@H+](Cc2cnc(Cl)cn2)C1 ZINC000707166397 712165847 /nfs/dbraw/zinc/16/58/47/712165847.db2.gz DTYJLAPHHKJOGS-ZETCQYMHSA-N 1 2 247.676 2.217 20 0 BEADLO FC(F)[C@H]1CC[N@@H+](Cc2cnc(Cl)cn2)C1 ZINC000707166397 712165848 /nfs/dbraw/zinc/16/58/48/712165848.db2.gz DTYJLAPHHKJOGS-ZETCQYMHSA-N 1 2 247.676 2.217 20 0 BEADLO Cc1noc(C)c1[C@@H](C)[NH2+][C@@H](C)c1cn(C)cn1 ZINC000710022241 712241532 /nfs/dbraw/zinc/24/15/32/712241532.db2.gz BPCLZXRASSZCQM-DTWKUNHWSA-N 1 2 248.330 2.437 20 0 BEADLO Cc1noc(C)c1C[NH2+]Cc1nccn1C1CC1 ZINC000711738965 712321686 /nfs/dbraw/zinc/32/16/86/712321686.db2.gz OBJGPZRXTUWNTI-UHFFFAOYSA-N 1 2 246.314 2.113 20 0 BEADLO [NH3+][C@H](CC(=O)Nc1ccccc1Cl)C(F)F ZINC000724737404 712392513 /nfs/dbraw/zinc/39/25/13/712392513.db2.gz BTCQLAYOSOJLSZ-SSDOTTSWSA-N 1 2 248.660 2.261 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)[C@H]1CC12CCC2 ZINC000760125261 712409794 /nfs/dbraw/zinc/40/97/94/712409794.db2.gz NPXSMAWMGGPKHF-SNVBAGLBSA-N 1 2 241.294 2.463 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cnn(C)c2Cl)o1 ZINC000712453865 712430426 /nfs/dbraw/zinc/43/04/26/712430426.db2.gz XIRRLMPMJYWWOH-UHFFFAOYSA-N 1 2 239.706 2.265 20 0 BEADLO C[C@H]1CCC(C)(C)C[C@@H]1[NH2+]Cc1c[nH]nn1 ZINC000713097216 712452267 /nfs/dbraw/zinc/45/22/67/712452267.db2.gz PBPLFYCSSBBQPK-ONGXEEELSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@H]([NH2+][C@H]1CCCc2occc21)c1cn(C)nn1 ZINC000715849930 712535785 /nfs/dbraw/zinc/53/57/85/712535785.db2.gz HAEANUQELRURBC-ONGXEEELSA-N 1 2 246.314 2.136 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1cnccn1)c1ccns1 ZINC000716036232 712547788 /nfs/dbraw/zinc/54/77/88/712547788.db2.gz ZXYHEBNGTKPAMK-IUCAKERBSA-N 1 2 234.328 2.345 20 0 BEADLO Cc1[nH]nc(CNc2ccc(C)c[nH+]2)c1C ZINC000716448454 712561470 /nfs/dbraw/zinc/56/14/70/712561470.db2.gz VBXGXEJAKQFNBU-UHFFFAOYSA-N 1 2 216.288 2.342 20 0 BEADLO Cc1n[nH]c(C[NH2+][C@H]2C[C@@H](C)n3ccnc32)c1C ZINC000716465306 712563013 /nfs/dbraw/zinc/56/30/13/712563013.db2.gz LDNKAABLYZGDQV-KCJUWKMLSA-N 1 2 245.330 2.019 20 0 BEADLO CC(C)(O)[C@H]1CCCN(c2cc[nH+]cc2F)C1 ZINC000719650864 712820684 /nfs/dbraw/zinc/82/06/84/712820684.db2.gz DTWJLMGCFLVUJI-JTQLQIEISA-N 1 2 238.306 2.208 20 0 BEADLO Cc1cc(C[NH2+]Cc2cnc(C)cc2C)no1 ZINC000720353849 712833090 /nfs/dbraw/zinc/83/30/90/712833090.db2.gz WBNYJQNVAXWOTC-UHFFFAOYSA-N 1 2 231.299 2.285 20 0 BEADLO C[C@H]1CC[N@H+](Cc2cccnc2Cl)CCO1 ZINC000720492066 712846728 /nfs/dbraw/zinc/84/67/28/712846728.db2.gz BOCYBXUVXFANMS-JTQLQIEISA-N 1 2 240.734 2.346 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2cccnc2Cl)CCO1 ZINC000720492066 712846729 /nfs/dbraw/zinc/84/67/29/712846729.db2.gz BOCYBXUVXFANMS-JTQLQIEISA-N 1 2 240.734 2.346 20 0 BEADLO C[C@@H]1Cc2cc(C[NH2+]Cc3cocn3)ccc2O1 ZINC000720820414 712868898 /nfs/dbraw/zinc/86/88/98/712868898.db2.gz HLWIEJMBIZBVKI-SNVBAGLBSA-N 1 2 244.294 2.288 20 0 BEADLO Cc1nn(C)cc1C[N@@H+]1CC[C@@](C)(F)[C@@H](F)C1 ZINC001204576130 958535728 /nfs/dbraw/zinc/53/57/28/958535728.db2.gz FIBFABKYPYNAMM-NWDGAFQWSA-N 1 2 243.301 2.001 20 0 BEADLO Cc1nn(C)cc1C[N@H+]1CC[C@@](C)(F)[C@@H](F)C1 ZINC001204576130 958535733 /nfs/dbraw/zinc/53/57/33/958535733.db2.gz FIBFABKYPYNAMM-NWDGAFQWSA-N 1 2 243.301 2.001 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N(C(=O)C[C@@H]([NH3+])C(F)F)C1 ZINC000724728124 959310434 /nfs/dbraw/zinc/31/04/34/959310434.db2.gz SQZWCEITHFXMSR-OPRDCNLKSA-N 1 2 248.317 2.006 20 0 BEADLO CCC[C@H]1CCCN(C(=O)C[C@H]([NH3+])C(F)F)C1 ZINC000724737927 959322888 /nfs/dbraw/zinc/32/28/88/959322888.db2.gz DIDOBNPWQYBASD-UWVGGRQHSA-N 1 2 248.317 2.008 20 0 BEADLO CCC1CC[NH+](Cc2cc(C)[nH]n2)CC1 ZINC001203069764 960610829 /nfs/dbraw/zinc/61/08/29/960610829.db2.gz CQPMTFHSPJEYKF-UHFFFAOYSA-N 1 2 207.321 2.340 20 0 BEADLO Cn1cccc1-c1ccc(NC=[NH2+])nc1 ZINC001167865266 961338768 /nfs/dbraw/zinc/33/87/68/961338768.db2.gz MWTROUDCJPGAQY-UHFFFAOYSA-N 1 2 200.245 2.106 20 0 BEADLO Cc1nc(NC2CC(F)C2)c2c([nH+]1)CCC2 ZINC001154833955 962864045 /nfs/dbraw/zinc/86/40/45/962864045.db2.gz GMHHDLQOFJENSV-UHFFFAOYSA-N 1 2 221.279 2.186 20 0 BEADLO COc1cc(C)c[nH+]c1NC1CC(F)C1 ZINC001154834699 962864913 /nfs/dbraw/zinc/86/49/13/962864913.db2.gz ZGSIBLUHRVHCII-UHFFFAOYSA-N 1 2 210.252 2.311 20 0 BEADLO COC(=O)c1[nH+]ccc(NCC(C)(C)C)c1C ZINC001161641178 962943262 /nfs/dbraw/zinc/94/32/62/962943262.db2.gz ACUNUPYBXJMIJG-UHFFFAOYSA-N 1 2 236.315 2.057 20 0 BEADLO Nc1cc(N[C@@H](C2CCC2)C(F)(F)F)[nH+]cn1 ZINC001158400890 963859380 /nfs/dbraw/zinc/85/93/80/963859380.db2.gz HXSIMTLCXKUAKP-VIFPVBQESA-N 1 2 246.236 2.202 20 0 BEADLO C1=C[C@@H]([NH2+][C@H]2CCCc3[nH]ncc32)CC1 ZINC000698203046 965096817 /nfs/dbraw/zinc/09/68/17/965096817.db2.gz DNMWTPQOGANDPC-KOLCDFICSA-N 1 2 203.289 2.095 20 0 BEADLO CCn1c[nH+]cc1COC(=O)C(C)(C)C(F)F ZINC001123377446 966153811 /nfs/dbraw/zinc/15/38/11/966153811.db2.gz HWTWTGLJHFHDOK-UHFFFAOYSA-N 1 2 246.257 2.238 20 0 BEADLO C[C@@H]1CO[C@@H]2CN(c3cccc(C4CC4)[nH+]3)C[C@H]12 ZINC001167172262 1165832799 /nfs/dbraw/zinc/83/27/99/1165832799.db2.gz VQLDUOSCAFUFLS-MPKXVKKWSA-N 1 2 244.338 2.430 20 0 BEADLO CCOc1cc(C[N@@H+]2CC[C@@H](F)C2)ccn1 ZINC001250001886 967261060 /nfs/dbraw/zinc/26/10/60/967261060.db2.gz FWHKGWUSNQKGAB-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO CCOc1cc(C[N@H+]2CC[C@@H](F)C2)ccn1 ZINC001250001886 967261070 /nfs/dbraw/zinc/26/10/70/967261070.db2.gz FWHKGWUSNQKGAB-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO Cn1ccnc1C[N@@H+]1CCCC[C@@](C)(F)C1 ZINC001205111440 967358696 /nfs/dbraw/zinc/35/86/96/967358696.db2.gz AJQAMVQNHWHHKJ-GFCCVEGCSA-N 1 2 225.311 2.134 20 0 BEADLO Cn1ccnc1C[N@H+]1CCCC[C@@](C)(F)C1 ZINC001205111440 967358709 /nfs/dbraw/zinc/35/87/09/967358709.db2.gz AJQAMVQNHWHHKJ-GFCCVEGCSA-N 1 2 225.311 2.134 20 0 BEADLO Cc1c[nH+]cc(C[C@@H]2COC(C)(C)O2)c1C ZINC001250187111 967497143 /nfs/dbraw/zinc/49/71/43/967497143.db2.gz UMYQXIFCBGAVLA-GFCCVEGCSA-N 1 2 221.300 2.392 20 0 BEADLO COC(=O)c1occc1Nc1c[nH+]c(C)c(N)c1 ZINC001210286996 1165864098 /nfs/dbraw/zinc/86/40/98/1165864098.db2.gz IXVVZRVTFFPDFE-UHFFFAOYSA-N 1 2 247.254 2.095 20 0 BEADLO COc1c(C)cccc1CCn1cc[nH+]c1 ZINC001250320910 967700615 /nfs/dbraw/zinc/70/06/15/967700615.db2.gz SKSOBPNGABBQMV-UHFFFAOYSA-N 1 2 216.284 2.443 20 0 BEADLO c1c2c(cc3[nH+]c(C4CC4)[nH]c13)OCC2 ZINC001250427077 967843778 /nfs/dbraw/zinc/84/37/78/967843778.db2.gz PJLDUKIXPJTLDG-UHFFFAOYSA-N 1 2 200.241 2.375 20 0 BEADLO CCc1[nH+]ccc(C)c1NC[C@H](O)C(F)(F)F ZINC001250964256 968221405 /nfs/dbraw/zinc/22/14/05/968221405.db2.gz HRZLDKOBAAANAV-VIFPVBQESA-N 1 2 248.248 2.288 20 0 BEADLO C[C@@H]1C[NH+](Cc2c(N)cccc2F)C[C@@H](C)O1 ZINC000109426983 1166013643 /nfs/dbraw/zinc/01/36/43/1166013643.db2.gz DYXIBOKHKGGMCO-NXEZZACHSA-N 1 2 238.306 2.017 20 0 BEADLO CC[C@H](C)c1ccc(N2CCOCC2)[nH+]c1 ZINC000207429488 1166016993 /nfs/dbraw/zinc/01/69/93/1166016993.db2.gz OKVDHENRZTXQMZ-NSHDSACASA-N 1 2 220.316 2.432 20 0 BEADLO Fc1cnc(C[NH+]2CCC(F)CC2)c(F)c1 ZINC001207093030 968625510 /nfs/dbraw/zinc/62/55/10/968625510.db2.gz IISJKUVQUOBVCE-UHFFFAOYSA-N 1 2 230.233 2.294 20 0 BEADLO CC(=O)[C@H]1CCCC[N@@H+]1Cc1cccnc1 ZINC000082645020 1166068674 /nfs/dbraw/zinc/06/86/74/1166068674.db2.gz FJTNPPPKLYFFAW-CYBMUJFWSA-N 1 2 218.300 2.025 20 0 BEADLO CC(=O)[C@H]1CCCC[N@H+]1Cc1cccnc1 ZINC000082645020 1166068683 /nfs/dbraw/zinc/06/86/83/1166068683.db2.gz FJTNPPPKLYFFAW-CYBMUJFWSA-N 1 2 218.300 2.025 20 0 BEADLO Cc1cc(N2CCO[C@@H](C)C2)nc(C2CCC2)[nH+]1 ZINC000891650449 1166128852 /nfs/dbraw/zinc/12/88/52/1166128852.db2.gz FEMPRIFKZJJIBT-NSHDSACASA-N 1 2 247.342 2.278 20 0 BEADLO CCCn1nccc1-c1c[nH+]c(N)c(C)c1 ZINC000129734855 1166213923 /nfs/dbraw/zinc/21/39/23/1166213923.db2.gz VPKCZCTUVRGMEW-UHFFFAOYSA-N 1 2 216.288 2.246 20 0 BEADLO C[C@H]1C[C@@H]1c1nnc([C@@H]([NH3+])c2ccccc2)o1 ZINC000224321239 1166232315 /nfs/dbraw/zinc/23/23/15/1166232315.db2.gz TVSRZZWGFWMHLR-LSJOCFKGSA-N 1 2 229.283 2.241 20 0 BEADLO CCCOC1C[NH+](CCc2cccc(F)c2)C1 ZINC001208196801 969127221 /nfs/dbraw/zinc/12/72/21/969127221.db2.gz ATVMHSRWBDBSRO-UHFFFAOYSA-N 1 2 237.318 2.479 20 0 BEADLO Cc1cc(C[NH2+]Cc2nc(C#N)cs2)ccn1 ZINC000391195148 1166243179 /nfs/dbraw/zinc/24/31/79/1166243179.db2.gz KXOBBXKQHPOCRT-UHFFFAOYSA-N 1 2 244.323 2.008 20 0 BEADLO CC[C@@H](CCC(=O)OC)C[N@H+](C)CC(F)F ZINC001208788171 969239429 /nfs/dbraw/zinc/23/94/29/969239429.db2.gz JUOOTNFUMCFYHV-VIFPVBQESA-N 1 2 237.290 2.163 20 0 BEADLO CC[C@@H](CCC(=O)OC)C[N@@H+](C)CC(F)F ZINC001208788171 969239439 /nfs/dbraw/zinc/23/94/39/969239439.db2.gz JUOOTNFUMCFYHV-VIFPVBQESA-N 1 2 237.290 2.163 20 0 BEADLO C[C@@H](C[N@H+](C1CC1)C1COC1)C(F)(F)F ZINC000451125970 1166461296 /nfs/dbraw/zinc/46/12/96/1166461296.db2.gz PFDYKOOIXWAVKH-ZETCQYMHSA-N 1 2 223.238 2.048 20 0 BEADLO C[C@@H](C[N@@H+](C1CC1)C1COC1)C(F)(F)F ZINC000451125970 1166461298 /nfs/dbraw/zinc/46/12/98/1166461298.db2.gz PFDYKOOIXWAVKH-ZETCQYMHSA-N 1 2 223.238 2.048 20 0 BEADLO FC1(F)C[C@@H]1[NH2+]C1Cc2ccccc2C1 ZINC001255010964 969844810 /nfs/dbraw/zinc/84/48/10/969844810.db2.gz VGVSIAMTSULAEW-NSHDSACASA-N 1 2 209.239 2.151 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1c(N)cccc1F ZINC000109427293 1166602251 /nfs/dbraw/zinc/60/22/51/1166602251.db2.gz LACPXCJQJBQRFO-JTQLQIEISA-N 1 2 238.306 2.019 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1c(N)cccc1F ZINC000109427293 1166602256 /nfs/dbraw/zinc/60/22/56/1166602256.db2.gz LACPXCJQJBQRFO-JTQLQIEISA-N 1 2 238.306 2.019 20 0 BEADLO CCC[C@H](C)C(=O)OCc1cc[nH+]c(N)c1 ZINC000309278091 1166631218 /nfs/dbraw/zinc/63/12/18/1166631218.db2.gz MPGVRNIAYPHGLF-VIFPVBQESA-N 1 2 222.288 2.143 20 0 BEADLO Nc1ccc(-c2cccc(C3OCCO3)c2)c[nH+]1 ZINC000016948036 1166644832 /nfs/dbraw/zinc/64/48/32/1166644832.db2.gz HQNMKHASJORZMI-UHFFFAOYSA-N 1 2 242.278 2.376 20 0 BEADLO Brc1cnccc1Cn1cc[nH+]c1 ZINC000606290545 1166655637 /nfs/dbraw/zinc/65/56/37/1166655637.db2.gz XWDHQPZOQDVSJI-UHFFFAOYSA-N 1 2 238.088 2.089 20 0 BEADLO C[C@@H]([NH2+][C@H](C)C1(Cl)CC1)c1csnn1 ZINC000695665790 1166663622 /nfs/dbraw/zinc/66/36/22/1166663622.db2.gz DRRWMVIUXCGPAV-RNFRBKRXSA-N 1 2 231.752 2.349 20 0 BEADLO CC[C@@H]([NH2+]Cc1cnn[nH]1)c1ccc(F)cc1 ZINC000398272420 1166709177 /nfs/dbraw/zinc/70/91/77/1166709177.db2.gz AMMQXTLZCHQFSR-GFCCVEGCSA-N 1 2 234.278 2.185 20 0 BEADLO C[C@@H](CC(F)(F)F)[N@@H+]1CCOC[C@@H]1C ZINC001255647523 970403141 /nfs/dbraw/zinc/40/31/41/970403141.db2.gz VRKYIKFSQXYEGE-YUMQZZPRSA-N 1 2 211.227 2.048 20 0 BEADLO C[C@@H](CC(F)(F)F)[N@H+]1CCOC[C@@H]1C ZINC001255647523 970403149 /nfs/dbraw/zinc/40/31/49/970403149.db2.gz VRKYIKFSQXYEGE-YUMQZZPRSA-N 1 2 211.227 2.048 20 0 BEADLO CC[NH+]1CC(Oc2ccc3cccc(O)c3n2)C1 ZINC001225585523 1166988677 /nfs/dbraw/zinc/98/86/77/1166988677.db2.gz MFEORXLECFBTPW-UHFFFAOYSA-N 1 2 244.294 2.023 20 0 BEADLO Cn1cccc1C[N@@H+]1CC[C@@](C)(F)[C@H](F)C1 ZINC001203254259 975058225 /nfs/dbraw/zinc/05/82/25/975058225.db2.gz OKNSRZWYZIYXFQ-VXGBXAGGSA-N 1 2 228.286 2.297 20 0 BEADLO Cn1cccc1C[N@H+]1CC[C@@](C)(F)[C@H](F)C1 ZINC001203254259 975058231 /nfs/dbraw/zinc/05/82/31/975058231.db2.gz OKNSRZWYZIYXFQ-VXGBXAGGSA-N 1 2 228.286 2.297 20 0 BEADLO CC[C@@H]1CC[C@H]([NH+]2CC(O)(C(F)(F)F)C2)C1 ZINC001173271812 975144315 /nfs/dbraw/zinc/14/43/15/975144315.db2.gz GQANHZKVKODYNG-BDAKNGLRSA-N 1 2 237.265 2.174 20 0 BEADLO CC(C)c1nc(CNC[C@@H]2CC[N@@H+]2C)cs1 ZINC000712585295 1167052333 /nfs/dbraw/zinc/05/23/33/1167052333.db2.gz FGOFVCNXBSHYOJ-NSHDSACASA-N 1 2 239.388 2.060 20 0 BEADLO CC(C)c1nc(CNC[C@@H]2CC[N@H+]2C)cs1 ZINC000712585295 1167052344 /nfs/dbraw/zinc/05/23/44/1167052344.db2.gz FGOFVCNXBSHYOJ-NSHDSACASA-N 1 2 239.388 2.060 20 0 BEADLO CC[C@@H]1CC[C@@H]([N@@H+]2CC[C@H](O)C(F)(F)C2)C1 ZINC001173288972 975254574 /nfs/dbraw/zinc/25/45/74/975254574.db2.gz QACWHVMYUDEETP-MXWKQRLJSA-N 1 2 233.302 2.267 20 0 BEADLO CC[C@@H]1CC[C@@H]([N@H+]2CC[C@H](O)C(F)(F)C2)C1 ZINC001173288972 975254578 /nfs/dbraw/zinc/25/45/78/975254578.db2.gz QACWHVMYUDEETP-MXWKQRLJSA-N 1 2 233.302 2.267 20 0 BEADLO C[C@H](c1ncccn1)[N@H+]1CC[C@@H](C(F)(F)F)C1 ZINC001332698002 975255007 /nfs/dbraw/zinc/25/50/07/975255007.db2.gz HMZMCQKLEOTVQO-RKDXNWHRSA-N 1 2 245.248 2.422 20 0 BEADLO FC[C@@H]1CCC[N@H+](Cc2nnc(C3CC3)o2)C1 ZINC000880232256 1167075246 /nfs/dbraw/zinc/07/52/46/1167075246.db2.gz JSEZTDDIFBTOAM-VIFPVBQESA-N 1 2 239.294 2.129 20 0 BEADLO FC[C@@H]1CCC[N@@H+](Cc2nnc(C3CC3)o2)C1 ZINC000880232256 1167075253 /nfs/dbraw/zinc/07/52/53/1167075253.db2.gz JSEZTDDIFBTOAM-VIFPVBQESA-N 1 2 239.294 2.129 20 0 BEADLO CC[NH+]1CC(Oc2cc(Cl)ccc2OC)C1 ZINC001227143995 975294545 /nfs/dbraw/zinc/29/45/45/975294545.db2.gz LRJUIHQNBXKVNI-UHFFFAOYSA-N 1 2 241.718 2.432 20 0 BEADLO Cc1cc[nH+]c(C)c1O[C@@H]1CCCOC1 ZINC001227264610 975340122 /nfs/dbraw/zinc/34/01/22/975340122.db2.gz OYEBPSDYFZONFW-LLVKDONJSA-N 1 2 207.273 2.256 20 0 BEADLO CCCOC(=O)[C@H](C)Oc1c(C)cc[nH+]c1C ZINC001227263378 975340168 /nfs/dbraw/zinc/34/01/68/975340168.db2.gz GACCNFJERASZRJ-NSHDSACASA-N 1 2 237.299 2.419 20 0 BEADLO CCc1nn(C[N@H+](C)CCC2CC2)c(=S)o1 ZINC001333294648 975625254 /nfs/dbraw/zinc/62/52/54/975625254.db2.gz GGGFGMKUUFBPPU-UHFFFAOYSA-N 1 2 241.360 2.457 20 0 BEADLO CCc1nn(C[N@@H+](C)CCC2CC2)c(=S)o1 ZINC001333294648 975625262 /nfs/dbraw/zinc/62/52/62/975625262.db2.gz GGGFGMKUUFBPPU-UHFFFAOYSA-N 1 2 241.360 2.457 20 0 BEADLO Cc1nn(C)cc1Nc1ccc(C)[nH+]c1C ZINC001174333262 976549005 /nfs/dbraw/zinc/54/90/05/976549005.db2.gz JOLHNDQGTNZEDP-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO C=CNc1ccccc1C[NH+]1CCOCC1 ZINC001174783893 977003518 /nfs/dbraw/zinc/00/35/18/977003518.db2.gz VXCVLTMNBXEYTG-UHFFFAOYSA-N 1 2 218.300 2.074 20 0 BEADLO OC1C[NH+](Cc2ccc(-c3ccccc3)o2)C1 ZINC000291383976 1167492973 /nfs/dbraw/zinc/49/29/73/1167492973.db2.gz BNFOIXLMQYSFDZ-UHFFFAOYSA-N 1 2 229.279 2.123 20 0 BEADLO C[N@@H+]1CCC=C(Nc2cc(F)nc(F)c2F)C1 ZINC001175577757 977587428 /nfs/dbraw/zinc/58/74/28/977587428.db2.gz XPBFUSHHKUDMKI-UHFFFAOYSA-N 1 2 243.232 2.130 20 0 BEADLO C[N@H+]1CCC=C(Nc2cc(F)nc(F)c2F)C1 ZINC001175577757 977587436 /nfs/dbraw/zinc/58/74/36/977587436.db2.gz XPBFUSHHKUDMKI-UHFFFAOYSA-N 1 2 243.232 2.130 20 0 BEADLO COc1ncc(F)cc1C[NH+]1CCC(F)CC1 ZINC001231739749 977721367 /nfs/dbraw/zinc/72/13/67/977721367.db2.gz FGYYRIOMHPXYMZ-UHFFFAOYSA-N 1 2 242.269 2.163 20 0 BEADLO c1cn(CCCNc2ccccc2)c[nH+]1 ZINC000034439478 1167572802 /nfs/dbraw/zinc/57/28/02/1167572802.db2.gz NHAZRKHMMVLDHM-UHFFFAOYSA-N 1 2 201.273 2.385 20 0 BEADLO COc1ccnc(C[N@H+]2C[C@H](F)C[C@H]2C)c1 ZINC001231966976 977812628 /nfs/dbraw/zinc/81/26/28/977812628.db2.gz OZYPMRITGNJJDV-NXEZZACHSA-N 1 2 224.279 2.023 20 0 BEADLO CC1(C)CCC(C[NH2+]Cc2ncn[nH]2)CC1 ZINC000381399568 1167575445 /nfs/dbraw/zinc/57/54/45/1167575445.db2.gz PUAZTKIABOMPTM-UHFFFAOYSA-N 1 2 222.336 2.111 20 0 BEADLO Oc1cncc(C[N@@H+]2CCCC[C@H](F)C2)c1 ZINC001232038531 977861267 /nfs/dbraw/zinc/86/12/67/977861267.db2.gz GGGQCJWNAQFJIG-NSHDSACASA-N 1 2 224.279 2.111 20 0 BEADLO Oc1cncc(C[N@H+]2CCCC[C@H](F)C2)c1 ZINC001232038531 977861270 /nfs/dbraw/zinc/86/12/70/977861270.db2.gz GGGQCJWNAQFJIG-NSHDSACASA-N 1 2 224.279 2.111 20 0 BEADLO Cc1[nH]c(CN2CC[C@@H](C)C(F)(F)C2)c[nH+]1 ZINC001232460456 978096274 /nfs/dbraw/zinc/09/62/74/978096274.db2.gz QWSCURQQCCETGA-MRVPVSSYSA-N 1 2 229.274 2.195 20 0 BEADLO Cc1[nH]cc(CN2CC[C@@H](C)C(F)(F)C2)[nH+]1 ZINC001232460456 978096286 /nfs/dbraw/zinc/09/62/86/978096286.db2.gz QWSCURQQCCETGA-MRVPVSSYSA-N 1 2 229.274 2.195 20 0 BEADLO Cc1[nH]c(CN2CCC[C@@H](F)C(F)(F)C2)c[nH+]1 ZINC001232460468 978101635 /nfs/dbraw/zinc/10/16/35/978101635.db2.gz RMBGJWJLBOBHLU-SNVBAGLBSA-N 1 2 247.264 2.287 20 0 BEADLO Cc1[nH]cc(CN2CCC[C@@H](F)C(F)(F)C2)[nH+]1 ZINC001232460468 978101645 /nfs/dbraw/zinc/10/16/45/978101645.db2.gz RMBGJWJLBOBHLU-SNVBAGLBSA-N 1 2 247.264 2.287 20 0 BEADLO Fc1ccnc(C[NH+]2CC3(CCC3)C2)c1 ZINC001232491093 1167691102 /nfs/dbraw/zinc/69/11/02/1167691102.db2.gz UARAFNOZRXEUNV-UHFFFAOYSA-N 1 2 206.264 2.207 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cnccn2)cc1O ZINC001233233521 1167709963 /nfs/dbraw/zinc/70/99/63/1167709963.db2.gz JKLLNOXQJMIGRF-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cnccn2)cc1O ZINC001233233521 1167709974 /nfs/dbraw/zinc/70/99/74/1167709974.db2.gz JKLLNOXQJMIGRF-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO Cc1cnc(NCCCCn2cc[nH+]c2)o1 ZINC001331149434 978339772 /nfs/dbraw/zinc/33/97/72/978339772.db2.gz GACAJKAEDQELTH-UHFFFAOYSA-N 1 2 220.276 2.072 20 0 BEADLO CC1C[NH+](Cc2cc(O)c(F)c(F)c2)C1 ZINC001232971054 978372573 /nfs/dbraw/zinc/37/25/73/978372573.db2.gz SHKJWNNATUVLRK-UHFFFAOYSA-N 1 2 213.227 2.122 20 0 BEADLO Cc1cc(C[N@H+]2CCOC[C@H]2C(C)C)sn1 ZINC001233312252 978539097 /nfs/dbraw/zinc/53/90/97/978539097.db2.gz HJRSOZNOSSHAQL-LBPRGKRZSA-N 1 2 240.372 2.308 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC[C@H]2C(C)C)sn1 ZINC001233312252 978539105 /nfs/dbraw/zinc/53/91/05/978539105.db2.gz HJRSOZNOSSHAQL-LBPRGKRZSA-N 1 2 240.372 2.308 20 0 BEADLO Cc1cnsc1C[N@@H+]1CCCC(=O)[C@@H](C)C1 ZINC001233318037 978552121 /nfs/dbraw/zinc/55/21/21/978552121.db2.gz NJIIIOVXWABJJV-JTQLQIEISA-N 1 2 238.356 2.253 20 0 BEADLO Cc1cnsc1C[N@H+]1CCCC(=O)[C@@H](C)C1 ZINC001233318037 978552127 /nfs/dbraw/zinc/55/21/27/978552127.db2.gz NJIIIOVXWABJJV-JTQLQIEISA-N 1 2 238.356 2.253 20 0 BEADLO C[N@H+](Cc1cncc(Cl)n1)C1CC(F)(F)C1 ZINC001233446079 978601408 /nfs/dbraw/zinc/60/14/08/978601408.db2.gz HGQCBCRBCVHDRK-UHFFFAOYSA-N 1 2 247.676 2.360 20 0 BEADLO C[N@@H+](Cc1cncc(Cl)n1)C1CC(F)(F)C1 ZINC001233446079 978601417 /nfs/dbraw/zinc/60/14/17/978601417.db2.gz HGQCBCRBCVHDRK-UHFFFAOYSA-N 1 2 247.676 2.360 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1cc(C)c(C)s1 ZINC001233685417 978675040 /nfs/dbraw/zinc/67/50/40/978675040.db2.gz RBHXNKCNHOSMJZ-VIFPVBQESA-N 1 2 241.356 2.358 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1cc(C)c(C)s1 ZINC001233685417 978675043 /nfs/dbraw/zinc/67/50/43/978675043.db2.gz RBHXNKCNHOSMJZ-VIFPVBQESA-N 1 2 241.356 2.358 20 0 BEADLO CC[NH+]1CC(Oc2cnc(SC)c(C)c2)C1 ZINC001234288189 978812765 /nfs/dbraw/zinc/81/27/65/978812765.db2.gz SNTBZQMDLJJGGS-UHFFFAOYSA-N 1 2 238.356 2.195 20 0 BEADLO CC[NH+]1CC(Oc2cc(C)nc(Cl)c2)C1 ZINC001234615674 978874841 /nfs/dbraw/zinc/87/48/41/978874841.db2.gz PYZPRGKMTMBLQP-UHFFFAOYSA-N 1 2 226.707 2.126 20 0 BEADLO Cc1cnc(F)c(C[NH+]2CC(C)(C)C2)c1 ZINC001235331992 979025460 /nfs/dbraw/zinc/02/54/60/979025460.db2.gz KPMUGAXELGRBCY-UHFFFAOYSA-N 1 2 208.280 2.371 20 0 BEADLO CC1(C)CC[N@H+](Cc2ncc(Cl)cn2)C1 ZINC001235412700 979040501 /nfs/dbraw/zinc/04/05/01/979040501.db2.gz HRQXYMDOEKBRFO-UHFFFAOYSA-N 1 2 225.723 2.362 20 0 BEADLO CC1(C)CC[N@@H+](Cc2ncc(Cl)cn2)C1 ZINC001235412700 979040506 /nfs/dbraw/zinc/04/05/06/979040506.db2.gz HRQXYMDOEKBRFO-UHFFFAOYSA-N 1 2 225.723 2.362 20 0 BEADLO CC[C@@H]1CC[N@H+](Cc2ncc(Cl)cn2)C1 ZINC001235427232 979043020 /nfs/dbraw/zinc/04/30/20/979043020.db2.gz RSMJVYWXRVSONG-SECBINFHSA-N 1 2 225.723 2.362 20 0 BEADLO CC[C@@H]1CC[N@@H+](Cc2ncc(Cl)cn2)C1 ZINC001235427232 979043026 /nfs/dbraw/zinc/04/30/26/979043026.db2.gz RSMJVYWXRVSONG-SECBINFHSA-N 1 2 225.723 2.362 20 0 BEADLO Cc1[nH+]cn(C)c1CN1CCC[C@H]1C(F)(F)F ZINC001235536816 979069478 /nfs/dbraw/zinc/06/94/78/979069478.db2.gz FXQMHEUXYXEMKS-JTQLQIEISA-N 1 2 247.264 2.255 20 0 BEADLO C[N@@H+](Cc1ccccc1)CN1CCSC1=O ZINC000068128148 1168223681 /nfs/dbraw/zinc/22/36/81/1168223681.db2.gz ZEOLWNILUGSDBM-UHFFFAOYSA-N 1 2 236.340 2.245 20 0 BEADLO C[N@H+](Cc1ccccc1)CN1CCSC1=O ZINC000068128148 1168223691 /nfs/dbraw/zinc/22/36/91/1168223691.db2.gz ZEOLWNILUGSDBM-UHFFFAOYSA-N 1 2 236.340 2.245 20 0 BEADLO Cc1cnc([C@@H](C)C[NH2+]Cc2ccn[nH]2)s1 ZINC000134990063 1168254956 /nfs/dbraw/zinc/25/49/56/1168254956.db2.gz ZKMRDLQNVAVCJO-QMMMGPOBSA-N 1 2 236.344 2.068 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1ccc(F)c(O)c1 ZINC001236702798 979695617 /nfs/dbraw/zinc/69/56/17/979695617.db2.gz MGGLBYJELFSQQM-PSASIEDQSA-N 1 2 227.254 2.464 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1ccc(F)c(O)c1 ZINC001236702798 979695626 /nfs/dbraw/zinc/69/56/26/979695626.db2.gz MGGLBYJELFSQQM-PSASIEDQSA-N 1 2 227.254 2.464 20 0 BEADLO Cc1cc(F)cc(C)c1C[NH+]1CC(C)(O)C1 ZINC001237319672 979866071 /nfs/dbraw/zinc/86/60/71/979866071.db2.gz YKHUYWQSBQFEFW-UHFFFAOYSA-N 1 2 223.291 2.009 20 0 BEADLO C[N@H+](Cc1scnc1Cl)[C@@H]1CCCOC1 ZINC001137825797 1168373700 /nfs/dbraw/zinc/37/37/00/1168373700.db2.gz AUSKBOVTTKHNHB-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO C[N@@H+](Cc1scnc1Cl)[C@@H]1CCCOC1 ZINC001137825797 1168373704 /nfs/dbraw/zinc/37/37/04/1168373704.db2.gz AUSKBOVTTKHNHB-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@@H]2C)c(Cl)n1 ZINC001237791263 980050187 /nfs/dbraw/zinc/05/01/87/980050187.db2.gz FOYCMIIUHDPBSQ-QMMMGPOBSA-N 1 2 226.707 2.338 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@@H]2C)c(Cl)n1 ZINC001237791263 980050199 /nfs/dbraw/zinc/05/01/99/980050199.db2.gz FOYCMIIUHDPBSQ-QMMMGPOBSA-N 1 2 226.707 2.338 20 0 BEADLO C[N@H+](Cc1cnc(F)cc1Cl)[C@@H]1CCOC1 ZINC001238017202 980125152 /nfs/dbraw/zinc/12/51/52/980125152.db2.gz CTUHWCIGKNUHDZ-SECBINFHSA-N 1 2 244.697 2.095 20 0 BEADLO C[N@@H+](Cc1cnc(F)cc1Cl)[C@@H]1CCOC1 ZINC001238017202 980125155 /nfs/dbraw/zinc/12/51/55/980125155.db2.gz CTUHWCIGKNUHDZ-SECBINFHSA-N 1 2 244.697 2.095 20 0 BEADLO COc1ccc(C[NH+]2CC(C)(C)C2)c(F)c1O ZINC001238365831 980243640 /nfs/dbraw/zinc/24/36/40/980243640.db2.gz KWAKCLQDLOSKMV-UHFFFAOYSA-N 1 2 239.290 2.382 20 0 BEADLO CCOc1cc(C[N@@H+]2CC[C@@H]2C)c(F)cn1 ZINC001238728903 980317069 /nfs/dbraw/zinc/31/70/69/980317069.db2.gz KAOUQAODUXGOEG-VIFPVBQESA-N 1 2 224.279 2.214 20 0 BEADLO CCOc1cc(C[N@H+]2CC[C@@H]2C)c(F)cn1 ZINC001238728903 980317074 /nfs/dbraw/zinc/31/70/74/980317074.db2.gz KAOUQAODUXGOEG-VIFPVBQESA-N 1 2 224.279 2.214 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2cnn(C)c2)c1 ZINC001203654652 980479972 /nfs/dbraw/zinc/47/99/72/980479972.db2.gz OXOBNASVDAZGDN-UHFFFAOYSA-N 1 2 202.261 2.176 20 0 BEADLO CCC(CC)C[N@H+](CC)Cc1nnc[nH]1 ZINC001347092077 980960036 /nfs/dbraw/zinc/96/00/36/980960036.db2.gz VNFBORGJQWOITB-UHFFFAOYSA-N 1 2 210.325 2.063 20 0 BEADLO CCC(CC)C[N@@H+](CC)Cc1nnc[nH]1 ZINC001347092077 980960038 /nfs/dbraw/zinc/96/00/38/980960038.db2.gz VNFBORGJQWOITB-UHFFFAOYSA-N 1 2 210.325 2.063 20 0 BEADLO COCc1ccccc1-c1c[nH+]cn1C ZINC001239951852 981056795 /nfs/dbraw/zinc/05/67/95/981056795.db2.gz LGRZKQLZCRYYNR-UHFFFAOYSA-N 1 2 202.257 2.234 20 0 BEADLO O=C1CC[N@H+](Cc2ccccn2)[C@@H]2CCCC[C@@H]12 ZINC001204056241 1168632456 /nfs/dbraw/zinc/63/24/56/1168632456.db2.gz WVMCUNRWXCGYDR-ZIAGYGMSSA-N 1 2 244.338 2.415 20 0 BEADLO O=C1CC[N@@H+](Cc2ccccn2)[C@@H]2CCCC[C@@H]12 ZINC001204056241 1168632457 /nfs/dbraw/zinc/63/24/57/1168632457.db2.gz WVMCUNRWXCGYDR-ZIAGYGMSSA-N 1 2 244.338 2.415 20 0 BEADLO CO[C@H]1C[N@@H+](Cc2cc(C)ccc2F)C[C@@H]1F ZINC001205617451 981220849 /nfs/dbraw/zinc/22/08/49/981220849.db2.gz XQWMYZGMYLMIKD-STQMWFEESA-N 1 2 241.281 2.303 20 0 BEADLO C[C@H](C(=O)NC(C)(C)C1CCC1)n1cc[nH+]c1 ZINC001348011678 981243724 /nfs/dbraw/zinc/24/37/24/981243724.db2.gz PFOCPCAEJAJVOF-SNVBAGLBSA-N 1 2 235.331 2.139 20 0 BEADLO C[C@H](C(=O)NC[C@H]1CCCC[C@H]1C)n1cc[nH+]c1 ZINC001177927545 1168718844 /nfs/dbraw/zinc/71/88/44/1168718844.db2.gz ZWIWWHIBELRKPC-JHJVBQTASA-N 1 2 249.358 2.387 20 0 BEADLO C[N@H+](CCF)Cc1ccc(N2CCCC2)o1 ZINC001137072029 1168916261 /nfs/dbraw/zinc/91/62/61/1168916261.db2.gz OJPFWACNGUEFNE-UHFFFAOYSA-N 1 2 226.295 2.281 20 0 BEADLO C[N@@H+](CCF)Cc1ccc(N2CCCC2)o1 ZINC001137072029 1168916274 /nfs/dbraw/zinc/91/62/74/1168916274.db2.gz OJPFWACNGUEFNE-UHFFFAOYSA-N 1 2 226.295 2.281 20 0 BEADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2cc[nH]n2)cn1 ZINC001137131047 1168930002 /nfs/dbraw/zinc/93/00/02/1168930002.db2.gz SNWGCGDDNJABEI-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cc[nH]n2)cn1 ZINC001137131047 1168929994 /nfs/dbraw/zinc/92/99/94/1168929994.db2.gz SNWGCGDDNJABEI-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO CCN(C)c1ccc(Nc2cccc(=O)[nH]2)c[nH+]1 ZINC001212789923 1168940212 /nfs/dbraw/zinc/94/02/12/1168940212.db2.gz JQRUNDGBZODPSB-UHFFFAOYSA-N 1 2 244.298 2.382 20 0 BEADLO Cc1cc(Nc2ccc(N)[nH+]c2)sn1 ZINC001201276632 983175710 /nfs/dbraw/zinc/17/57/10/983175710.db2.gz YXSSVHRWJZZFNA-UHFFFAOYSA-N 1 2 206.274 2.172 20 0 BEADLO CCC[NH+]1CC(Oc2ccccc2F)C1 ZINC001201646264 983402320 /nfs/dbraw/zinc/40/23/20/983402320.db2.gz YDZIPRYHENKXGU-UHFFFAOYSA-N 1 2 209.264 2.299 20 0 BEADLO Cc1cccc(-c2ccc[nH+]c2N)c1O ZINC001242346061 983600712 /nfs/dbraw/zinc/60/07/12/983600712.db2.gz LOXCUNKAJGKHGM-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO FC(F)(F)CCC[NH+]1CC2(C1)CCCO2 ZINC001202378345 983648452 /nfs/dbraw/zinc/64/84/52/983648452.db2.gz WERNZDXPMKDWHB-UHFFFAOYSA-N 1 2 223.238 2.194 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc(CO)c(F)c1 ZINC001242533625 983855671 /nfs/dbraw/zinc/85/56/71/983855671.db2.gz NWZPDTNQSJSDKU-YGQDEOHPSA-N 1 2 207.248 2.194 20 0 BEADLO Cc1oncc1-c1c[nH+]c(N(C)C)cc1C ZINC001242601736 983945004 /nfs/dbraw/zinc/94/50/04/983945004.db2.gz PLSGNXLWEQWXQS-UHFFFAOYSA-N 1 2 217.272 2.419 20 0 BEADLO Cc1c(CN2CC(F)(F)C2)[nH+]c2ccccn12 ZINC001137266884 1169237558 /nfs/dbraw/zinc/23/75/58/1169237558.db2.gz DGZMOIQRMIBLIR-UHFFFAOYSA-N 1 2 237.253 2.094 20 0 BEADLO Cc1n[nH]c(C)c1C[NH+]1CC(C(F)(F)F)C1 ZINC001331547380 974758847 /nfs/dbraw/zinc/75/88/47/974758847.db2.gz IGQJPAMEMCUVAD-UHFFFAOYSA-N 1 2 233.237 2.021 20 0 BEADLO CC(C)COCC[C@@H](C)[NH+]1CC(C)(F)C1 ZINC001172474011 974770722 /nfs/dbraw/zinc/77/07/22/974770722.db2.gz NRCLDSOQWBWZOQ-LLVKDONJSA-N 1 2 217.328 2.481 20 0 BEADLO CCCC(=O)[C@@H](CCC)OCc1c[nH+]cn1C ZINC001222595283 972600193 /nfs/dbraw/zinc/60/01/93/972600193.db2.gz VUUMEFJCWDTCRS-CYBMUJFWSA-N 1 2 238.331 2.475 20 0 BEADLO C[NH+]1CC(NC(=O)CCCCCC(C)(C)C)C1 ZINC001144682642 972934644 /nfs/dbraw/zinc/93/46/44/972934644.db2.gz RYWKNLGWQTWCKI-UHFFFAOYSA-N 1 2 240.391 2.413 20 0 BEADLO COCC[N@@H+](C)Cc1c(F)ccc(F)c1OC ZINC001144744835 972979213 /nfs/dbraw/zinc/97/92/13/972979213.db2.gz HHGVXRWNYCXMHV-UHFFFAOYSA-N 1 2 245.269 2.052 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C)n[nH]2)[C@@H](CC)CO1 ZINC001328709254 973290047 /nfs/dbraw/zinc/29/00/47/973290047.db2.gz XRSXPSIAXTUCKJ-QWHCGFSZSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C)n[nH]2)[C@@H](CC)CO1 ZINC001328709254 973290058 /nfs/dbraw/zinc/29/00/58/973290058.db2.gz XRSXPSIAXTUCKJ-QWHCGFSZSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1nc(C[NH+]2CC3(C2)CCCC3)[nH]c1C ZINC001329159139 973525216 /nfs/dbraw/zinc/52/52/16/973525216.db2.gz YINDWDIWOVHYIR-UHFFFAOYSA-N 1 2 219.332 2.403 20 0 BEADLO Cc1[nH]c(CN2CC3(C2)CCCC3)[nH+]c1C ZINC001329159139 973525239 /nfs/dbraw/zinc/52/52/39/973525239.db2.gz YINDWDIWOVHYIR-UHFFFAOYSA-N 1 2 219.332 2.403 20 0 BEADLO CC(C)Cc1nnc([C@@H](C)n2cc[nH+]c2)o1 ZINC001256431808 970827721 /nfs/dbraw/zinc/82/77/21/970827721.db2.gz DKNHKEAKLPAIJF-SECBINFHSA-N 1 2 220.276 2.074 20 0 BEADLO CC(C)Cc1nnc(CN(C)c2cccc[nH+]2)o1 ZINC001256432120 970838036 /nfs/dbraw/zinc/83/80/36/970838036.db2.gz JTNRRWBVWUVOEQ-UHFFFAOYSA-N 1 2 246.314 2.300 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1cccc(=O)[nH]1 ZINC001243737175 970894726 /nfs/dbraw/zinc/89/47/26/970894726.db2.gz DQXWVOOZPVSJBX-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO c1cc2cc(C[NH+]3CC4(CCO4)C3)ccc2[nH]1 ZINC001205599162 1169485785 /nfs/dbraw/zinc/48/57/85/1169485785.db2.gz MXRHOEMELRFDAX-UHFFFAOYSA-N 1 2 228.295 2.143 20 0 BEADLO O=C1CC[N@@H+]([C@@H]2CCO[C@H](c3ccccc3)C2)C1 ZINC001256817250 970990366 /nfs/dbraw/zinc/99/03/66/970990366.db2.gz LDSRAKHVQAWOBR-HIFRSBDPSA-N 1 2 245.322 2.182 20 0 BEADLO O=C1CC[N@H+]([C@@H]2CCO[C@H](c3ccccc3)C2)C1 ZINC001256817250 970990372 /nfs/dbraw/zinc/99/03/72/970990372.db2.gz LDSRAKHVQAWOBR-HIFRSBDPSA-N 1 2 245.322 2.182 20 0 BEADLO CCC1CCC([NH2+]C2(C(=O)OC)CC2)CC1 ZINC001256865936 971001223 /nfs/dbraw/zinc/00/12/23/971001223.db2.gz ILXQPIIRHITKOF-UHFFFAOYSA-N 1 2 225.332 2.250 20 0 BEADLO COc1ccc(Nc2c[nH+]ccc2OC)cc1N ZINC001216255752 971005090 /nfs/dbraw/zinc/00/50/90/971005090.db2.gz KNOMOEVPVPTUMW-UHFFFAOYSA-N 1 2 245.282 2.425 20 0 BEADLO Cc1noc(-c2ccnc(C3=C[NH2+]CCC3)c2)n1 ZINC001243948591 971033283 /nfs/dbraw/zinc/03/32/83/971033283.db2.gz IZJUNBNVQGOGPE-UHFFFAOYSA-N 1 2 242.282 2.164 20 0 BEADLO Cc1cc(-c2ccc(O)cc2F)c[nH+]c1N ZINC001206064564 971074398 /nfs/dbraw/zinc/07/43/98/971074398.db2.gz HFOJAQIHLMMJKZ-UHFFFAOYSA-N 1 2 218.231 2.484 20 0 BEADLO Oc1ccc2c(c1)CC[N@@H+](Cc1cncs1)C2 ZINC001209548370 1169515058 /nfs/dbraw/zinc/51/50/58/1169515058.db2.gz VXFDLKUMBKWWNL-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO Oc1ccc2c(c1)CC[N@H+](Cc1cncs1)C2 ZINC001209548370 1169515061 /nfs/dbraw/zinc/51/50/61/1169515061.db2.gz VXFDLKUMBKWWNL-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO CNc1ccc(NCc2nccc(Cl)n2)c[nH+]1 ZINC001170547012 971150032 /nfs/dbraw/zinc/15/00/32/971150032.db2.gz VOLXHCQJPDEVCZ-UHFFFAOYSA-N 1 2 249.705 2.179 20 0 BEADLO CCC[C@H](C(=O)OCC)[NH+]1CCC(F)(F)CC1 ZINC000405049199 971189495 /nfs/dbraw/zinc/18/94/95/971189495.db2.gz GTYMSVXDFIFWPN-SNVBAGLBSA-N 1 2 249.301 2.449 20 0 BEADLO Cc1cc(CO)ccc1N(C)c1[nH+]cccc1N ZINC001214657411 1169536322 /nfs/dbraw/zinc/53/63/22/1169536322.db2.gz KAJROTNUPXBVDW-UHFFFAOYSA-N 1 2 243.310 2.232 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)C1CCC(C)(C)CC1 ZINC001329877368 973995760 /nfs/dbraw/zinc/99/57/60/973995760.db2.gz QWBXTMQMZPRNOY-UHFFFAOYSA-N 1 2 222.336 2.205 20 0 BEADLO CCCCCOC(=O)C[NH2+][C@H](C)CCC ZINC001257314121 971210348 /nfs/dbraw/zinc/21/03/48/971210348.db2.gz IFIPVJCHSMCLBF-LLVKDONJSA-N 1 2 215.337 2.498 20 0 BEADLO CCCCOC(=O)CC[C@H](C)[NH2+]CC(F)F ZINC001257377161 971293794 /nfs/dbraw/zinc/29/37/94/971293794.db2.gz XEOYKNCULFOAGR-VIFPVBQESA-N 1 2 237.290 2.353 20 0 BEADLO CCCC[C@H](CC)N1CC[NH2+]CC(F)(F)C1 ZINC001257419184 971317677 /nfs/dbraw/zinc/31/76/77/971317677.db2.gz SXZBKCFITDKRJV-NSHDSACASA-N 1 2 234.334 2.496 20 0 BEADLO CC(C)Cc1nnc([C@@H]([NH3+])COC(C)(C)C)o1 ZINC001217697954 971333685 /nfs/dbraw/zinc/33/36/85/971333685.db2.gz YQOOJKHFJRAWFZ-VIFPVBQESA-N 1 2 241.335 2.083 20 0 BEADLO C[C@@H](OC(C)(C)C)[C@@H]([NH3+])c1nnc(C2CC2)o1 ZINC001217702172 971345301 /nfs/dbraw/zinc/34/53/01/971345301.db2.gz XTHXMYDGDOIBFZ-VXNVDRBHSA-N 1 2 239.319 2.150 20 0 BEADLO CCc1nnc([C@H]2[NH2+]CCC[C@H]2C(F)(F)F)o1 ZINC001217705489 971345573 /nfs/dbraw/zinc/34/55/73/971345573.db2.gz HJXZRVORMNRBEM-SVRRBLITSA-N 1 2 249.236 2.235 20 0 BEADLO COC(=O)[C@H](C(C)C)[N@H+](C)Cc1ccsc1 ZINC001204042922 971422570 /nfs/dbraw/zinc/42/25/70/971422570.db2.gz OYLGNUDVINJTEF-NSHDSACASA-N 1 2 241.356 2.378 20 0 BEADLO COC(=O)[C@H](C(C)C)[N@@H+](C)Cc1ccsc1 ZINC001204042922 971422574 /nfs/dbraw/zinc/42/25/74/971422574.db2.gz OYLGNUDVINJTEF-NSHDSACASA-N 1 2 241.356 2.378 20 0 BEADLO C[Si](C)(C)CCO[C@@H]1C[NH2+]CC(F)(F)C1 ZINC001217855237 971444979 /nfs/dbraw/zinc/44/49/79/971444979.db2.gz LBPJMUWVSLRGKV-VIFPVBQESA-N 1 2 237.366 2.338 20 0 BEADLO CCCCCOC(=O)C[NH2+][C@@H]1CCCSC1 ZINC001257668320 971470368 /nfs/dbraw/zinc/47/03/68/971470368.db2.gz OTHADRHOUZEVGT-LLVKDONJSA-N 1 2 245.388 2.205 20 0 BEADLO CC(C)C[NH+]1CCC([NH2+]C2=CC=C[CH]2)CC1 ZINC001258005356 971555464 /nfs/dbraw/zinc/55/54/64/971555464.db2.gz PHKYJTFUDHFUJM-UHFFFAOYSA-N 1 2 219.352 2.354 20 0 BEADLO Fc1ccc(O[C@@H]2CC[NH2+]CC2(F)F)cc1 ZINC001218005984 971569297 /nfs/dbraw/zinc/56/92/97/971569297.db2.gz PIUYBOUUJXCSCP-SNVBAGLBSA-N 1 2 231.217 2.202 20 0 BEADLO CNc1cc(-c2ccc3nnc(C)n3c2)cc[nH+]1 ZINC001244975112 971581139 /nfs/dbraw/zinc/58/11/39/971581139.db2.gz ACIHGYYLDATMRX-UHFFFAOYSA-N 1 2 239.282 2.141 20 0 BEADLO Cc1cc(S)ccc1O[C@H]1[C@@H]2C[C@H]1C[NH2+]C2 ZINC001218148582 971606469 /nfs/dbraw/zinc/60/64/69/971606469.db2.gz ZUKKMPOMMWEIHC-IWIIMEHWSA-N 1 2 235.352 2.270 20 0 BEADLO Cc1nc(NCc2cccc3ccnn32)cc[nH+]1 ZINC001170710238 971612130 /nfs/dbraw/zinc/61/21/30/971612130.db2.gz UHTJEDZAWCLKEU-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO Sc1cccc(O[C@@H]2CCC[NH2+]C2)c1 ZINC001218280208 971672945 /nfs/dbraw/zinc/67/29/45/971672945.db2.gz YZUKCQXAPYTUQD-SNVBAGLBSA-N 1 2 209.314 2.106 20 0 BEADLO C[C@H](Oc1cc[nH+]cc1)c1ncccn1 ZINC001225290112 974361348 /nfs/dbraw/zinc/36/13/48/974361348.db2.gz UCYJYPRDMNCNSC-VIFPVBQESA-N 1 2 201.229 2.012 20 0 BEADLO C[C@@H](Oc1cc[nH+]cc1)C(=O)OC(C)(C)C ZINC001225290872 974362413 /nfs/dbraw/zinc/36/24/13/974362413.db2.gz KWZVTIZPZAIAFW-SECBINFHSA-N 1 2 223.272 2.191 20 0 BEADLO Cc1nc([C@H](C)[NH2+][C@@H](C)[C@@H]2CC2(F)F)no1 ZINC001330621598 974365184 /nfs/dbraw/zinc/36/51/84/974365184.db2.gz LMRQLQDHSVOUEC-HAFWLYHUSA-N 1 2 231.246 2.072 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@H]2C[C@@H]3[C@H](C2)C3(C)C)no1 ZINC001170747005 971711948 /nfs/dbraw/zinc/71/19/48/971711948.db2.gz QIJOGXNCOBAXCD-JGPRNRPPSA-N 1 2 235.331 2.244 20 0 BEADLO Cc1nc(C[N@H+](C)[C@H]2C[C@@H]3[C@H](C2)C3(C)C)no1 ZINC001170747005 971711959 /nfs/dbraw/zinc/71/19/59/971711959.db2.gz QIJOGXNCOBAXCD-JGPRNRPPSA-N 1 2 235.331 2.244 20 0 BEADLO CC1(C)[C@@H]2C[C@H]([NH+]3CC(O)(C(F)(F)F)C3)C[C@@H]21 ZINC001170747661 971716488 /nfs/dbraw/zinc/71/64/88/971716488.db2.gz UTXCPYSOKOKIHX-AYMMMOKOSA-N 1 2 249.276 2.030 20 0 BEADLO CC1(C)[C@@H]2C[C@@H]([N@@H+]3CC[C@@H](O)C(F)(F)C3)C[C@@H]21 ZINC001170761883 971742999 /nfs/dbraw/zinc/74/29/99/971742999.db2.gz PCRVGEVEJWHKQP-CHWFTXMASA-N 1 2 245.313 2.123 20 0 BEADLO CC1(C)[C@@H]2C[C@@H]([N@H+]3CC[C@@H](O)C(F)(F)C3)C[C@@H]21 ZINC001170761883 971743013 /nfs/dbraw/zinc/74/30/13/971743013.db2.gz PCRVGEVEJWHKQP-CHWFTXMASA-N 1 2 245.313 2.123 20 0 BEADLO C[NH+]1CC(Oc2cccc(C(F)F)c2)C1 ZINC001225538785 974545594 /nfs/dbraw/zinc/54/55/94/974545594.db2.gz UXFIOHBSVBIJSK-UHFFFAOYSA-N 1 2 213.227 2.317 20 0 BEADLO CSc1cccc(NC(=O)Cc2c[nH]c[nH+]2)c1 ZINC001135607841 971938703 /nfs/dbraw/zinc/93/87/03/971938703.db2.gz UFOHBUHPIBYEDK-UHFFFAOYSA-N 1 2 247.323 2.313 20 0 BEADLO CCC=CNc1[nH+]cnc2[nH]cc(C(=O)OC)c21 ZINC001159668437 972013908 /nfs/dbraw/zinc/01/39/08/972013908.db2.gz TYQCZUXHOGSOJH-SNAWJCMRSA-N 1 2 246.270 2.032 20 0 BEADLO c1n[nH]c(C[NH2+][C@@H]2CCCC23CCCCC3)n1 ZINC000313123424 972053888 /nfs/dbraw/zinc/05/38/88/972053888.db2.gz SPTIBNNOIALKIQ-LLVKDONJSA-N 1 2 234.347 2.397 20 0 BEADLO c1[nH+]cn(Cc2ccccc2)c1CN1CCCO1 ZINC000411506310 972102331 /nfs/dbraw/zinc/10/23/31/972102331.db2.gz UIAYIGQBPIBAKB-UHFFFAOYSA-N 1 2 243.310 2.069 20 0 BEADLO Cc1c2c[nH]nc2ccc1-c1c[nH+]cn1C ZINC001241475122 1169721122 /nfs/dbraw/zinc/72/11/22/1169721122.db2.gz UJUZFGHVANETJL-UHFFFAOYSA-N 1 2 212.256 2.272 20 0 BEADLO Fc1cccc2c1C[C@@H]([NH+]1CC3(CCO3)C1)CC2 ZINC001171001842 972230692 /nfs/dbraw/zinc/23/06/92/972230692.db2.gz SAJIUPYMRJEEQY-LBPRGKRZSA-N 1 2 247.313 2.158 20 0 BEADLO Cc1cc(-c2ccc3[nH]nc(N)c3c2)c[nH+]c1N ZINC001241727881 1169738700 /nfs/dbraw/zinc/73/87/00/1169738700.db2.gz GYMKRKCSEDFKSR-UHFFFAOYSA-N 1 2 239.282 2.098 20 0 BEADLO Cc1ccc([C@H](C)CC[NH+]2CCN(C#N)CC2)o1 ZINC001208166456 957051754 /nfs/dbraw/zinc/05/17/54/957051754.db2.gz XQZIHXREXPDBDZ-GFCCVEGCSA-N 1 2 247.342 2.180 20 0 BEADLO C[N@H+](Cc1ccnc(Cl)c1)Cc1ccncn1 ZINC000396720423 957199669 /nfs/dbraw/zinc/19/96/69/957199669.db2.gz SXUULTSQNOTFMH-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[N@@H+](Cc1ccnc(Cl)c1)Cc1ccncn1 ZINC000396720423 957199673 /nfs/dbraw/zinc/19/96/73/957199673.db2.gz SXUULTSQNOTFMH-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[C@@H](C[N@@H+]1CCC(=O)C(C)(C)C1)C(F)(F)F ZINC001208906208 957236529 /nfs/dbraw/zinc/23/65/29/957236529.db2.gz UJIUSMDDLJDCHP-QMMMGPOBSA-N 1 2 237.265 2.486 20 0 BEADLO C[C@@H](C[N@H+]1CCC(=O)C(C)(C)C1)C(F)(F)F ZINC001208906208 957236538 /nfs/dbraw/zinc/23/65/38/957236538.db2.gz UJIUSMDDLJDCHP-QMMMGPOBSA-N 1 2 237.265 2.486 20 0 BEADLO Cc1nc(N2C[C@H]3[C@H](CF)[C@H]3C2)c(C)c(C)[nH+]1 ZINC001167225652 957556361 /nfs/dbraw/zinc/55/63/61/957556361.db2.gz VRJXGYDYLPNMOE-CNDDSTCGSA-N 1 2 235.306 2.054 20 0 BEADLO Cc1cc(N)[nH+]cc1Nc1cnc2ccccn12 ZINC001209967166 957588418 /nfs/dbraw/zinc/58/84/18/957588418.db2.gz ILTMRSBKJADPJG-UHFFFAOYSA-N 1 2 239.282 2.364 20 0 BEADLO CCOc1ccc[nH+]c1N[C@@H](COC)C1CC1 ZINC000397329737 957597189 /nfs/dbraw/zinc/59/71/89/957597189.db2.gz QFYPFLMLPVSLPI-NSHDSACASA-N 1 2 236.315 2.317 20 0 BEADLO Cc1c[nH+]cc(NCc2cncnc2)c1C ZINC001167265982 957606330 /nfs/dbraw/zinc/60/63/30/957606330.db2.gz COEHLJVKBYYSEJ-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO Cc1cc(NCc2cncnc2)[nH+]c2cc[nH]c21 ZINC001167268321 957609759 /nfs/dbraw/zinc/60/97/59/957609759.db2.gz BVRKMRWROCLTCN-UHFFFAOYSA-N 1 2 239.282 2.273 20 0 BEADLO CC[C@H]1CCCC[C@@H]1OCC[NH+]1CCOCC1 ZINC001210207968 957670833 /nfs/dbraw/zinc/67/08/33/957670833.db2.gz QIDBXHFGDYTRBO-KBPBESRZSA-N 1 2 241.375 2.304 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1OCC[NH+]1CCOCC1 ZINC001210207970 957673172 /nfs/dbraw/zinc/67/31/72/957673172.db2.gz QIDBXHFGDYTRBO-KGLIPLIRSA-N 1 2 241.375 2.304 20 0 BEADLO Cc1nocc1Nc1c[nH+]c(C)c(N)c1 ZINC001210286745 957713563 /nfs/dbraw/zinc/71/35/63/957713563.db2.gz AWVQGQQWDITBKP-UHFFFAOYSA-N 1 2 204.233 2.012 20 0 BEADLO Cc1[nH+]cc(-n2ccc3cc(N)ccc32)cc1N ZINC001210287860 957716751 /nfs/dbraw/zinc/71/67/51/957716751.db2.gz DMGJTNPFRBQKCD-UHFFFAOYSA-N 1 2 238.294 2.498 20 0 BEADLO Cc1oncc1-n1c(C)[nH+]c2ccc(N)cc21 ZINC001210578684 957805823 /nfs/dbraw/zinc/80/58/23/957805823.db2.gz HMUXCXIOJFKXDD-UHFFFAOYSA-N 1 2 228.255 2.213 20 0 BEADLO Cc1oncc1Nc1cccn2cc[nH+]c12 ZINC001210584078 957807058 /nfs/dbraw/zinc/80/70/58/957807058.db2.gz SXSCYXQRIBSRGX-UHFFFAOYSA-N 1 2 214.228 2.374 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc(F)cn2)C[C@@H]1F ZINC001207037133 957811475 /nfs/dbraw/zinc/81/14/75/957811475.db2.gz QAUSNKRBNXJTQD-KCJUWKMLSA-N 1 2 212.243 2.011 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc(F)cn2)C[C@@H]1F ZINC001207037133 957811476 /nfs/dbraw/zinc/81/14/76/957811476.db2.gz QAUSNKRBNXJTQD-KCJUWKMLSA-N 1 2 212.243 2.011 20 0 BEADLO Cc1ccc(Nc2ccc(N)cc2CCO)[nH+]c1 ZINC001211012160 957988600 /nfs/dbraw/zinc/98/86/00/957988600.db2.gz YEXSJJLWUQBROV-UHFFFAOYSA-N 1 2 243.310 2.251 20 0 BEADLO CC[C@H]([NH2+]Cc1cnn[nH]1)c1ccc(F)cc1 ZINC000398272421 958173940 /nfs/dbraw/zinc/17/39/40/958173940.db2.gz AMMQXTLZCHQFSR-LBPRGKRZSA-N 1 2 234.278 2.185 20 0 BEADLO Cc1cc(O)cc(Nc2[nH+]cccc2N)c1 ZINC001215507234 958185911 /nfs/dbraw/zinc/18/59/11/958185911.db2.gz CFCBYVAEWFCHPF-UHFFFAOYSA-N 1 2 215.256 2.421 20 0 BEADLO Cc1c[nH+]cc(Nc2ccnn2C)c1C ZINC001213523678 958205368 /nfs/dbraw/zinc/20/53/68/958205368.db2.gz ZFDVDIAHEKPQPD-UHFFFAOYSA-N 1 2 202.261 2.176 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@H](C)C(C)(F)F ZINC001347971195 958226297 /nfs/dbraw/zinc/22/62/97/958226297.db2.gz IBAFKIJHBCCOKN-QMMMGPOBSA-N 1 2 246.257 2.238 20 0 BEADLO C[C@@H]1CC(=O)CC[N@@H+]1Cc1ccc2c(c1)COC2 ZINC001137022225 972329919 /nfs/dbraw/zinc/32/99/19/972329919.db2.gz XAINLZFYGZPWRO-LLVKDONJSA-N 1 2 245.322 2.270 20 0 BEADLO C[C@@H]1CC(=O)CC[N@H+]1Cc1ccc2c(c1)COC2 ZINC001137022225 972329924 /nfs/dbraw/zinc/32/99/24/972329924.db2.gz XAINLZFYGZPWRO-LLVKDONJSA-N 1 2 245.322 2.270 20 0 BEADLO CSCc1cc[nH+]c(N[C@H](C)CCO)c1 ZINC000091674949 958306023 /nfs/dbraw/zinc/30/60/23/958306023.db2.gz XOAMXVLZHPQSHA-SECBINFHSA-N 1 2 226.345 2.127 20 0 BEADLO CCn1ccnc1SCc1ccc(N)[nH+]c1 ZINC000689830015 958335277 /nfs/dbraw/zinc/33/52/77/958335277.db2.gz UESWVLAZDFGGRK-UHFFFAOYSA-N 1 2 234.328 2.173 20 0 BEADLO Cc1c(F)cc(F)cc1C[N@@H+](C)C1COC1 ZINC001143763938 972358124 /nfs/dbraw/zinc/35/81/24/972358124.db2.gz GIZGOSKARZZOAR-UHFFFAOYSA-N 1 2 227.254 2.104 20 0 BEADLO Cc1c(F)cc(F)cc1C[N@H+](C)C1COC1 ZINC001143763938 972358131 /nfs/dbraw/zinc/35/81/31/972358131.db2.gz GIZGOSKARZZOAR-UHFFFAOYSA-N 1 2 227.254 2.104 20 0 BEADLO Cc1cc(C)[nH+]c(Nc2cnn(C)c2)c1 ZINC000707893209 958792047 /nfs/dbraw/zinc/79/20/47/958792047.db2.gz ZZKFNONULLAPQJ-UHFFFAOYSA-N 1 2 202.261 2.176 20 0 BEADLO C[C@@H](OCCn1cc[nH+]c1)c1cccnc1 ZINC001222129627 972377172 /nfs/dbraw/zinc/37/71/72/972377172.db2.gz PSAHZKOUGWVUFK-LLVKDONJSA-N 1 2 217.272 2.056 20 0 BEADLO c1cn(CCO[C@@H]2CCCc3cccnc32)c[nH+]1 ZINC001222134222 972381392 /nfs/dbraw/zinc/38/13/92/972381392.db2.gz BYZYQJFIVPUEGZ-CYBMUJFWSA-N 1 2 243.310 2.372 20 0 BEADLO C/C(=C/C(C)(C)C)C(=O)NCCc1[nH]cc[nH+]1 ZINC000588501846 958854454 /nfs/dbraw/zinc/85/44/54/958854454.db2.gz MGHMRKUHSIZBPL-KTKRTIGZSA-N 1 2 235.331 2.061 20 0 BEADLO Cc1ccc([C@@H](C)OCCn2cc[nH+]c2)cn1 ZINC001222134868 972382583 /nfs/dbraw/zinc/38/25/83/972382583.db2.gz QVYKJRMXEGHMEO-GFCCVEGCSA-N 1 2 231.299 2.364 20 0 BEADLO c1cn(CCO[C@@H]2COCc3ccccc32)c[nH+]1 ZINC001222134542 972382656 /nfs/dbraw/zinc/38/26/56/972382656.db2.gz FXFIYQZCEMWJSR-CQSZACIVSA-N 1 2 244.294 2.171 20 0 BEADLO COc1ccc([C@@H](C)OCCn2cc[nH+]c2)cn1 ZINC001222134975 972384316 /nfs/dbraw/zinc/38/43/16/972384316.db2.gz UOHHNJZMJRMLTB-LLVKDONJSA-N 1 2 247.298 2.065 20 0 BEADLO CCC(CC)(CC)NC(=O)C[C@@H]([NH3+])C(F)F ZINC000724693467 959053536 /nfs/dbraw/zinc/05/35/36/959053536.db2.gz SUGDODGZWKRULV-MRVPVSSYSA-N 1 2 236.306 2.054 20 0 BEADLO CCC(CC)(CC)NC(=O)C[C@H]([NH3+])C(F)F ZINC000724693468 959056880 /nfs/dbraw/zinc/05/68/80/959056880.db2.gz SUGDODGZWKRULV-QMMMGPOBSA-N 1 2 236.306 2.054 20 0 BEADLO Cc1cc(F)ncc1NCc1cc[nH+]c(N)c1 ZINC001167617589 959083925 /nfs/dbraw/zinc/08/39/25/959083925.db2.gz QOXABXZVTIXNSK-UHFFFAOYSA-N 1 2 232.262 2.118 20 0 BEADLO CC(=O)CNc1cccc(-c2c[nH+]cn2C)c1 ZINC001167629992 959135055 /nfs/dbraw/zinc/13/50/55/959135055.db2.gz ULHCUHXEUWMCOB-UHFFFAOYSA-N 1 2 229.283 2.088 20 0 BEADLO Cc1c[nH+]c(Nc2cncc(F)c2)c(N)c1 ZINC000300892792 959206878 /nfs/dbraw/zinc/20/68/78/959206878.db2.gz BTMLELGLOFAVGL-UHFFFAOYSA-N 1 2 218.235 2.250 20 0 BEADLO CCC[C@H]1CCCN(C(=O)C[C@@H]([NH3+])C(F)F)C1 ZINC000724737930 959321355 /nfs/dbraw/zinc/32/13/55/959321355.db2.gz DIDOBNPWQYBASD-VHSXEESVSA-N 1 2 248.317 2.008 20 0 BEADLO COC(C)(C)[C@H](C)[NH2+]CC(F)(F)C(F)F ZINC000301007829 959589016 /nfs/dbraw/zinc/58/90/16/959589016.db2.gz NVEFFYIKCIIHCQ-LURJTMIESA-N 1 2 231.233 2.290 20 0 BEADLO Cc1cc(S)ccc1O[C@@H]1C[NH2+]C[C@H]1C ZINC001218034792 959842990 /nfs/dbraw/zinc/84/29/90/959842990.db2.gz XSTRQSXCAQENPF-BXKDBHETSA-N 1 2 223.341 2.270 20 0 BEADLO Cc1ccc(NC=CC(C)(C)O)c(C)[nH+]1 ZINC001203209034 960175526 /nfs/dbraw/zinc/17/55/26/960175526.db2.gz CWAVKFCPXBMREA-BQYQJAHWSA-N 1 2 206.289 2.395 20 0 BEADLO FC(F)[C@H]1CCC[N@H+](Cc2ncco2)C1 ZINC001141007218 960185588 /nfs/dbraw/zinc/18/55/88/960185588.db2.gz CATXZCDWOMFEPF-QMMMGPOBSA-N 1 2 216.231 2.152 20 0 BEADLO FC(F)[C@H]1CCC[N@@H+](Cc2ncco2)C1 ZINC001141007218 960185595 /nfs/dbraw/zinc/18/55/95/960185595.db2.gz CATXZCDWOMFEPF-QMMMGPOBSA-N 1 2 216.231 2.152 20 0 BEADLO Cc1cc[nH+]c(NC2CC3(CCC3)C2)c1C(N)=O ZINC001161445959 960186986 /nfs/dbraw/zinc/18/69/86/960186986.db2.gz ITEYRNRKWHQHRE-UHFFFAOYSA-N 1 2 245.326 2.234 20 0 BEADLO CC(C)(CNC(=O)c1cccs1)n1cc[nH+]c1 ZINC000692642311 960363127 /nfs/dbraw/zinc/36/31/27/960363127.db2.gz LANOPQDAOUJGHJ-UHFFFAOYSA-N 1 2 249.339 2.110 20 0 BEADLO CC(C)(CNC(=O)c1ccccc1)n1cc[nH+]c1 ZINC000692641588 960364230 /nfs/dbraw/zinc/36/42/30/960364230.db2.gz GPVARRRZGCDIHP-UHFFFAOYSA-N 1 2 243.310 2.048 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2ccc(CO)o2)C[C@@H]1F ZINC001140679025 960491629 /nfs/dbraw/zinc/49/16/29/960491629.db2.gz NXAMDKSEFOJERI-NWDGAFQWSA-N 1 2 245.269 2.044 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2ccc(CO)o2)C[C@@H]1F ZINC001140679025 960491638 /nfs/dbraw/zinc/49/16/38/960491638.db2.gz NXAMDKSEFOJERI-NWDGAFQWSA-N 1 2 245.269 2.044 20 0 BEADLO c1oc2ccccc2c1C[N@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001140786801 960568965 /nfs/dbraw/zinc/56/89/65/960568965.db2.gz LSRKIKZJUAEALK-TXEJJXNPSA-N 1 2 229.279 2.406 20 0 BEADLO c1oc2ccccc2c1C[N@@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001140786801 960568977 /nfs/dbraw/zinc/56/89/77/960568977.db2.gz LSRKIKZJUAEALK-TXEJJXNPSA-N 1 2 229.279 2.406 20 0 BEADLO N#CN1CC[NH+](Cc2coc3ccccc23)CC1 ZINC001140786751 960570991 /nfs/dbraw/zinc/57/09/91/960570991.db2.gz UNUHKTVTUVQWSY-UHFFFAOYSA-N 1 2 241.294 2.031 20 0 BEADLO Oc1cc(Cl)cc(C[NH+]2CC=CC2)c1 ZINC001140787980 960577602 /nfs/dbraw/zinc/57/76/02/960577602.db2.gz WEBGTBKZVOLADT-UHFFFAOYSA-N 1 2 209.676 2.417 20 0 BEADLO F[C@@H]1CCC[N@H+](Cc2c[nH]c3ccncc23)C1 ZINC001140802603 960592492 /nfs/dbraw/zinc/59/24/92/960592492.db2.gz AKOLKJFEBAWJPW-LLVKDONJSA-N 1 2 233.290 2.497 20 0 BEADLO F[C@@H]1CCC[N@@H+](Cc2c[nH]c3ccncc23)C1 ZINC001140802603 960592507 /nfs/dbraw/zinc/59/25/07/960592507.db2.gz AKOLKJFEBAWJPW-LLVKDONJSA-N 1 2 233.290 2.497 20 0 BEADLO Cc1cc(C[N@H+](C)CCc2ccccc2)n[nH]1 ZINC001203068075 960602682 /nfs/dbraw/zinc/60/26/82/960602682.db2.gz YKQNYGCTYPCYGX-UHFFFAOYSA-N 1 2 229.327 2.393 20 0 BEADLO Cc1cc(C[N@@H+](C)CCc2ccccc2)n[nH]1 ZINC001203068075 960602688 /nfs/dbraw/zinc/60/26/88/960602688.db2.gz YKQNYGCTYPCYGX-UHFFFAOYSA-N 1 2 229.327 2.393 20 0 BEADLO FC(F)C1C[NH+](Cc2c[nH]c3ccncc23)C1 ZINC001140806858 960605425 /nfs/dbraw/zinc/60/54/25/960605425.db2.gz UXJSJCMLNVBPJT-UHFFFAOYSA-N 1 2 237.253 2.260 20 0 BEADLO Nc1cccc(F)c1C[N@@H+]1C[C@@H]2C[C@@H]2[C@@H](F)C1 ZINC001140873011 960662139 /nfs/dbraw/zinc/66/21/39/960662139.db2.gz PTZWEDCWZBWPKB-AUTRQRHGSA-N 1 2 238.281 2.198 20 0 BEADLO Nc1cccc(F)c1C[N@H+]1C[C@@H]2C[C@@H]2[C@@H](F)C1 ZINC001140873011 960662143 /nfs/dbraw/zinc/66/21/43/960662143.db2.gz PTZWEDCWZBWPKB-AUTRQRHGSA-N 1 2 238.281 2.198 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3ccsc3C2)[nH]n1 ZINC001203076588 960679320 /nfs/dbraw/zinc/67/93/20/960679320.db2.gz FRMAOZOMQXUSIU-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1cc(C[N@H+]2CCc3ccsc3C2)[nH]n1 ZINC001203076588 960679326 /nfs/dbraw/zinc/67/93/26/960679326.db2.gz FRMAOZOMQXUSIU-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO COC(C)(C)C[C@@H](C)OCc1c[nH+]cn1C ZINC001222600627 960725593 /nfs/dbraw/zinc/72/55/93/960725593.db2.gz SQKNVVJMBWTACG-SNVBAGLBSA-N 1 2 226.320 2.140 20 0 BEADLO Cc1cc(C[N@@H+]2CCn3cccc3[C@H]2C)[nH]n1 ZINC001203082435 960774324 /nfs/dbraw/zinc/77/43/24/960774324.db2.gz RBQYPLBHFJSVGP-LLVKDONJSA-N 1 2 230.315 2.096 20 0 BEADLO Cc1cc(C[N@H+]2CCn3cccc3[C@H]2C)[nH]n1 ZINC001203082435 960774334 /nfs/dbraw/zinc/77/43/34/960774334.db2.gz RBQYPLBHFJSVGP-LLVKDONJSA-N 1 2 230.315 2.096 20 0 BEADLO c1coc(C[N@@H+]2CCC[C@@H]2c2ccncc2)n1 ZINC001141008896 960809924 /nfs/dbraw/zinc/80/99/24/960809924.db2.gz POSDUTZAMRXRPE-GFCCVEGCSA-N 1 2 229.283 2.407 20 0 BEADLO c1coc(C[N@H+]2CCC[C@@H]2c2ccncc2)n1 ZINC001141008896 960809928 /nfs/dbraw/zinc/80/99/28/960809928.db2.gz POSDUTZAMRXRPE-GFCCVEGCSA-N 1 2 229.283 2.407 20 0 BEADLO O=C1CCC2(CC1)CC[NH+](Cc1ncco1)CC2 ZINC001141010546 960813999 /nfs/dbraw/zinc/81/39/99/960813999.db2.gz WXTUZRKWVPHICW-UHFFFAOYSA-N 1 2 248.326 2.400 20 0 BEADLO FC1(C2CC2)CN(Cc2ccn3cc[nH+]c3c2)C1 ZINC001141047800 960833429 /nfs/dbraw/zinc/83/34/29/960833429.db2.gz UBLFMIZUAFMHEU-UHFFFAOYSA-N 1 2 245.301 2.268 20 0 BEADLO Cc1ncoc1C[N@@H+]1CCC(=O)[C@@H]2CCCC[C@@H]21 ZINC001141050602 960841700 /nfs/dbraw/zinc/84/17/00/960841700.db2.gz DXAICJQCSUHMFT-NEPJUHHUSA-N 1 2 248.326 2.317 20 0 BEADLO Cc1ncoc1C[N@H+]1CCC(=O)[C@@H]2CCCC[C@@H]21 ZINC001141050602 960841705 /nfs/dbraw/zinc/84/17/05/960841705.db2.gz DXAICJQCSUHMFT-NEPJUHHUSA-N 1 2 248.326 2.317 20 0 BEADLO CCCCc1[nH]c(CN(C)CC(F)F)c[nH+]1 ZINC001141074368 960858197 /nfs/dbraw/zinc/85/81/97/960858197.db2.gz GOHNIZXXIQLNSR-UHFFFAOYSA-N 1 2 231.290 2.449 20 0 BEADLO CCCCc1[nH]cc(CN(C)CC(F)F)[nH+]1 ZINC001141074368 960858201 /nfs/dbraw/zinc/85/82/01/960858201.db2.gz GOHNIZXXIQLNSR-UHFFFAOYSA-N 1 2 231.290 2.449 20 0 BEADLO CCCCc1[nH]c(CN2CC3(C2)CCCO3)c[nH+]1 ZINC001141067881 960859429 /nfs/dbraw/zinc/85/94/29/960859429.db2.gz QNJHLOMDTJSDKG-UHFFFAOYSA-N 1 2 249.358 2.117 20 0 BEADLO CCCCc1[nH]cc(CN2CC3(C2)CCCO3)[nH+]1 ZINC001141067881 960859436 /nfs/dbraw/zinc/85/94/36/960859436.db2.gz QNJHLOMDTJSDKG-UHFFFAOYSA-N 1 2 249.358 2.117 20 0 BEADLO CCCCc1[nH]cc(CN(C)Cc2ccno2)[nH+]1 ZINC001141074041 960861552 /nfs/dbraw/zinc/86/15/52/960861552.db2.gz UUNVTGIZRVGUPW-UHFFFAOYSA-N 1 2 248.330 2.372 20 0 BEADLO CCCCc1[nH]c(CN(C)Cc2ccno2)c[nH+]1 ZINC001141074041 960861559 /nfs/dbraw/zinc/86/15/59/960861559.db2.gz UUNVTGIZRVGUPW-UHFFFAOYSA-N 1 2 248.330 2.372 20 0 BEADLO CCCCc1[nH]cc(CN2CCCC23COC3)[nH+]1 ZINC001141072765 960862632 /nfs/dbraw/zinc/86/26/32/960862632.db2.gz YCIZSDMMSFRPGV-UHFFFAOYSA-N 1 2 249.358 2.117 20 0 BEADLO CCCCc1[nH]c(CN2CCCC23COC3)c[nH+]1 ZINC001141072765 960862636 /nfs/dbraw/zinc/86/26/36/960862636.db2.gz YCIZSDMMSFRPGV-UHFFFAOYSA-N 1 2 249.358 2.117 20 0 BEADLO CCCCc1[nH]c(CN2CCC(=O)[C@@H](C)C2)c[nH+]1 ZINC001141068005 960863646 /nfs/dbraw/zinc/86/36/46/960863646.db2.gz VJWBXMIVJKNIRK-NSHDSACASA-N 1 2 249.358 2.163 20 0 BEADLO CCCCc1[nH]cc(CN2CCC(=O)[C@@H](C)C2)[nH+]1 ZINC001141068005 960863649 /nfs/dbraw/zinc/86/36/49/960863649.db2.gz VJWBXMIVJKNIRK-NSHDSACASA-N 1 2 249.358 2.163 20 0 BEADLO Cc1ccc(N(C)c2[nH+]cccc2N)cc1O ZINC001211688847 960897440 /nfs/dbraw/zinc/89/74/40/960897440.db2.gz ZYJQXURQEDECOG-UHFFFAOYSA-N 1 2 229.283 2.446 20 0 BEADLO Cc1ccc(C[N@@H+](C)C2(C)COC2)c(F)c1 ZINC001141196200 960928240 /nfs/dbraw/zinc/92/82/40/960928240.db2.gz LWBGHFLVGFHQSZ-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ccc(C[N@H+](C)C2(C)COC2)c(F)c1 ZINC001141196200 960928252 /nfs/dbraw/zinc/92/82/52/960928252.db2.gz LWBGHFLVGFHQSZ-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO CN(C)c1cccc(C[NH+]2CC3(C2)CCCO3)c1 ZINC001141259272 961022125 /nfs/dbraw/zinc/02/21/25/961022125.db2.gz JLITWJRHTVCQMD-UHFFFAOYSA-N 1 2 246.354 2.117 20 0 BEADLO CCOc1cc[nH+]cc1NC=CC(C)(C)O ZINC001203210833 961073924 /nfs/dbraw/zinc/07/39/24/961073924.db2.gz IHZCKYAITADWTH-SOFGYWHQSA-N 1 2 222.288 2.177 20 0 BEADLO CCCC[C@@H](CC)C(=O)NC1C[NH+](CC)C1 ZINC001481546352 961160277 /nfs/dbraw/zinc/16/02/77/961160277.db2.gz VUJHHEDESMOKJG-LLVKDONJSA-N 1 2 226.364 2.023 20 0 BEADLO Clc1ccc(C[N@@H+]2CCC[C@@H]3C[C@@H]32)nn1 ZINC001142076421 961239322 /nfs/dbraw/zinc/23/93/22/961239322.db2.gz HMMXGZTXXGVQQU-SCZZXKLOSA-N 1 2 223.707 2.114 20 0 BEADLO Clc1ccc(C[N@H+]2CCC[C@@H]3C[C@@H]32)nn1 ZINC001142076421 961239338 /nfs/dbraw/zinc/23/93/38/961239338.db2.gz HMMXGZTXXGVQQU-SCZZXKLOSA-N 1 2 223.707 2.114 20 0 BEADLO [NH2+]=CNc1cccc(OCC(F)(F)F)n1 ZINC001167863799 961326410 /nfs/dbraw/zinc/32/64/10/961326410.db2.gz GGFJINQFTWBGDR-UHFFFAOYSA-N 1 2 219.166 2.042 20 0 BEADLO CC(=O)[C@@H]1CCC[N@@H+]1Cc1[nH]cnc1C(C)(C)C ZINC001142242269 961367711 /nfs/dbraw/zinc/36/77/11/961367711.db2.gz FPLICMVAPRVUEI-LBPRGKRZSA-N 1 2 249.358 2.261 20 0 BEADLO CC(=O)[C@@H]1CCC[N@H+]1Cc1[nH]cnc1C(C)(C)C ZINC001142242269 961367731 /nfs/dbraw/zinc/36/77/31/961367731.db2.gz FPLICMVAPRVUEI-LBPRGKRZSA-N 1 2 249.358 2.261 20 0 BEADLO [NH2+]=CNc1cc(OCC(F)(F)F)ccn1 ZINC001167870874 961377712 /nfs/dbraw/zinc/37/77/12/961377712.db2.gz FCNDACPYYFRWSF-UHFFFAOYSA-N 1 2 219.166 2.042 20 0 BEADLO COCOCCc1[nH]c2cc3c(cc2[nH+]1)CCC3 ZINC001250591332 1169788063 /nfs/dbraw/zinc/78/80/63/1169788063.db2.gz JUFZKIVGGHTQAI-UHFFFAOYSA-N 1 2 246.310 2.215 20 0 BEADLO O=C(C[NH2+][C@H]1C[C@H]2C[C@H]2C1)OCc1ccccc1 ZINC001167898587 961532639 /nfs/dbraw/zinc/53/26/39/961532639.db2.gz SQOGNWIZWGIDAF-WDNDVIMCSA-N 1 2 245.322 2.118 20 0 BEADLO Cc1nc(N2CCCC[C@@H]2CO)cc(C(C)C)[nH+]1 ZINC000709818411 961643899 /nfs/dbraw/zinc/64/38/99/961643899.db2.gz BUUYCDDAVONUHJ-GFCCVEGCSA-N 1 2 249.358 2.260 20 0 BEADLO Cc1nc(N2CC[C@@H](CO)[C@H]2C)cc(C(C)C)[nH+]1 ZINC000709836711 961681101 /nfs/dbraw/zinc/68/11/01/961681101.db2.gz QEIBEKVAZCRQOE-PWSUYJOCSA-N 1 2 249.358 2.116 20 0 BEADLO COc1cc(C)c(C[NH+]2CCC(=O)CC2)c(C)c1 ZINC001142933273 961834697 /nfs/dbraw/zinc/83/46/97/961834697.db2.gz MMPCVAGZDHGDMP-UHFFFAOYSA-N 1 2 247.338 2.477 20 0 BEADLO CN(Cc1ccc2[nH+]ccn2c1)CC(F)F ZINC001143032804 961871377 /nfs/dbraw/zinc/87/13/77/961871377.db2.gz ORDLURVUVYWZMW-UHFFFAOYSA-N 1 2 225.242 2.031 20 0 BEADLO O=C1CCC[N@H+](Cc2cc3cccnc3[nH]2)CC1 ZINC001143215189 961955921 /nfs/dbraw/zinc/95/59/21/961955921.db2.gz YFKHKLVXEYCBHO-UHFFFAOYSA-N 1 2 243.310 2.118 20 0 BEADLO O=C1CCC[N@@H+](Cc2cc3cccnc3[nH]2)CC1 ZINC001143215189 961955932 /nfs/dbraw/zinc/95/59/32/961955932.db2.gz YFKHKLVXEYCBHO-UHFFFAOYSA-N 1 2 243.310 2.118 20 0 BEADLO COc1c(F)ccc(C[NH+]2CC=CC2)c1F ZINC001143321153 962030523 /nfs/dbraw/zinc/03/05/23/962030523.db2.gz VUWPCHQMTAPYAY-UHFFFAOYSA-N 1 2 225.238 2.345 20 0 BEADLO Cc1cnc(Nc2ccn3cc[nH+]c3c2)o1 ZINC001204951289 962159764 /nfs/dbraw/zinc/15/97/64/962159764.db2.gz QPBTXQRMUQYRCC-UHFFFAOYSA-N 1 2 214.228 2.374 20 0 BEADLO COc1cc(NC=CC(C)(C)O)c(C)c[nH+]1 ZINC001203215905 962322619 /nfs/dbraw/zinc/32/26/19/962322619.db2.gz AGIHTFHJOUVXST-AATRIKPKSA-N 1 2 222.288 2.095 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1ccc2occc2c1 ZINC001151772668 962326870 /nfs/dbraw/zinc/32/68/70/962326870.db2.gz RKQXUIUDJGLQPU-GFCCVEGCSA-N 1 2 244.294 2.466 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1ccc2occc2c1 ZINC001151772668 962326889 /nfs/dbraw/zinc/32/68/89/962326889.db2.gz RKQXUIUDJGLQPU-GFCCVEGCSA-N 1 2 244.294 2.466 20 0 BEADLO CC[C@@H]1CCN(C(=O)C(C)(C)c2c[nH+]c[nH]2)[C@@H]1C ZINC001154802038 962849882 /nfs/dbraw/zinc/84/98/82/962849882.db2.gz OCTGTJWUSVUGNG-GHMZBOCLSA-N 1 2 249.358 2.334 20 0 BEADLO COc1c[nH+]c(NC[C@H](O)c2ccco2)c(C)c1 ZINC001154875186 962881058 /nfs/dbraw/zinc/88/10/58/962881058.db2.gz JYXUIDUHATVGMN-NSHDSACASA-N 1 2 248.282 2.137 20 0 BEADLO Cc1ccc(CN2CCC(F)(F)[C@@H]([NH3+])C2)cc1 ZINC001206654765 963037378 /nfs/dbraw/zinc/03/73/78/963037378.db2.gz DDKPDGAAWNKIGA-LBPRGKRZSA-N 1 2 240.297 2.163 20 0 BEADLO Cc1cc(F)cc(C[N@@H+]2C[C@@H](F)C[C@H]2CO)c1 ZINC001143580374 963156053 /nfs/dbraw/zinc/15/60/53/963156053.db2.gz HQCSYIFDBBAYEO-STQMWFEESA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cc(F)cc(C[N@H+]2C[C@@H](F)C[C@H]2CO)c1 ZINC001143580374 963156063 /nfs/dbraw/zinc/15/60/63/963156063.db2.gz HQCSYIFDBBAYEO-STQMWFEESA-N 1 2 241.281 2.039 20 0 BEADLO CC[C@@H](C)Nc1[nH+]c(C)nc2c1ccn2C ZINC001167998121 963198939 /nfs/dbraw/zinc/19/89/39/963198939.db2.gz GHTRHUCAGQQCQI-MRVPVSSYSA-N 1 2 218.304 2.487 20 0 BEADLO c1cn(CCCNc2cnc3c(c2)CCC3)c[nH+]1 ZINC001161684893 963202320 /nfs/dbraw/zinc/20/23/20/963202320.db2.gz WFKAOLCXQYKVCY-UHFFFAOYSA-N 1 2 242.326 2.269 20 0 BEADLO COc1cc(C)c[nH+]c1NCCn1cccc1 ZINC001156299452 963306058 /nfs/dbraw/zinc/30/60/58/963306058.db2.gz PCWDYYMNEMZILE-UHFFFAOYSA-N 1 2 231.299 2.312 20 0 BEADLO COc1cc(C)c[nH+]c1NCC(C)(C)OC ZINC001156439312 963351480 /nfs/dbraw/zinc/35/14/80/963351480.db2.gz QJQZFBSRYRENEV-UHFFFAOYSA-N 1 2 224.304 2.236 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@H](C)C2CCC2)[nH+]c1C ZINC000896910029 963521125 /nfs/dbraw/zinc/52/11/25/963521125.db2.gz KONILMSEYGKMLH-MRVPVSSYSA-N 1 2 235.331 2.079 20 0 BEADLO CCN(CCn1cc[nH+]c1)c1cc(C)c(F)cn1 ZINC001157460280 963619962 /nfs/dbraw/zinc/61/99/62/963619962.db2.gz UVZAFBFWWBVPEC-UHFFFAOYSA-N 1 2 248.305 2.252 20 0 BEADLO C[N@H+](Cc1ccc(Cl)nn1)C1CC(F)(F)C1 ZINC001142060165 963624520 /nfs/dbraw/zinc/62/45/20/963624520.db2.gz WQVZOLDXURDAPR-UHFFFAOYSA-N 1 2 247.676 2.360 20 0 BEADLO C[N@@H+](Cc1ccc(Cl)nn1)C1CC(F)(F)C1 ZINC001142060165 963624529 /nfs/dbraw/zinc/62/45/29/963624529.db2.gz WQVZOLDXURDAPR-UHFFFAOYSA-N 1 2 247.676 2.360 20 0 BEADLO CC(C)[NH+]1CC(Nc2nc(Cl)ccc2F)C1 ZINC001157525545 963637097 /nfs/dbraw/zinc/63/70/97/963637097.db2.gz FKAMZXCYBSXRHU-UHFFFAOYSA-N 1 2 243.713 2.379 20 0 BEADLO CCC1(Nc2[nH+]ccc(F)c2C)COC1 ZINC001157535967 963646552 /nfs/dbraw/zinc/64/65/52/963646552.db2.gz HQMGRKXMAFZDAC-UHFFFAOYSA-N 1 2 210.252 2.120 20 0 BEADLO Nc1cc(N[C@@H]2CCNc3ccccc32)[nH+]cn1 ZINC001157837099 963742728 /nfs/dbraw/zinc/74/27/28/963742728.db2.gz OGRVBBLZQQGDEI-LLVKDONJSA-N 1 2 241.298 2.028 20 0 BEADLO COc1cc(C)c[nH+]c1N[C@H]1CCC[C@@H](O)C1 ZINC001158370266 963857455 /nfs/dbraw/zinc/85/74/55/963857455.db2.gz BSMGTNCGRGRBGI-WDEREUQCSA-N 1 2 236.315 2.114 20 0 BEADLO COCc1cc[nH+]c(NCCc2cncs2)c1 ZINC001158882216 963950660 /nfs/dbraw/zinc/95/06/60/963950660.db2.gz DURCFHXXXBJQEH-UHFFFAOYSA-N 1 2 249.339 2.339 20 0 BEADLO CN(c1cc(N)nc[nH+]1)[C@@H]1CCc2ccccc21 ZINC001158920002 963957507 /nfs/dbraw/zinc/95/75/07/963957507.db2.gz FBJBSHWABCVCHK-GFCCVEGCSA-N 1 2 240.310 2.183 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC(C)(C)C1(C)C ZINC000093508289 964159232 /nfs/dbraw/zinc/15/92/32/964159232.db2.gz JXBNOPRWRSSCQN-UHFFFAOYSA-N 1 2 207.321 2.339 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC(C)(C)C1(C)C ZINC000093508289 964159245 /nfs/dbraw/zinc/15/92/45/964159245.db2.gz JXBNOPRWRSSCQN-UHFFFAOYSA-N 1 2 207.321 2.339 20 0 BEADLO Cc1c[nH]c(CCNC(=O)[C@@]2(C)CC=CCC2)[nH+]1 ZINC001142545989 964376852 /nfs/dbraw/zinc/37/68/52/964376852.db2.gz KJAMBAGLSBJZRC-AWEZNQCLSA-N 1 2 247.342 2.123 20 0 BEADLO COC(C[N@H+](C)Cc1cc(F)ccc1F)OC ZINC000714689984 964449617 /nfs/dbraw/zinc/44/96/17/964449617.db2.gz RMJFMIAHUJQYKT-UHFFFAOYSA-N 1 2 245.269 2.016 20 0 BEADLO COC(C[N@@H+](C)Cc1cc(F)ccc1F)OC ZINC000714689984 964449622 /nfs/dbraw/zinc/44/96/22/964449622.db2.gz RMJFMIAHUJQYKT-UHFFFAOYSA-N 1 2 245.269 2.016 20 0 BEADLO Nc1cncc(Nc2cccc3[nH+]c[nH]c32)c1 ZINC001213028044 964461925 /nfs/dbraw/zinc/46/19/25/964461925.db2.gz GOKKXMBGVARXAT-UHFFFAOYSA-N 1 2 225.255 2.284 20 0 BEADLO CC(C)(C)C[NH2+]c1c[nH]c2cc(=O)[nH]c-2c1 ZINC001161639508 964656431 /nfs/dbraw/zinc/65/64/31/964656431.db2.gz SFKXQIKVKHZECZ-UHFFFAOYSA-N 1 2 219.288 2.034 20 0 BEADLO CC(C)CNc1ccc2c([nH+]1)CCOC2 ZINC001161645285 964658680 /nfs/dbraw/zinc/65/86/80/964658680.db2.gz XTASNFIEEAXKNT-UHFFFAOYSA-N 1 2 206.289 2.222 20 0 BEADLO CCCc1cnc(NCCCn2cc[nH+]c2)nc1 ZINC001161681270 964684964 /nfs/dbraw/zinc/68/49/64/964684964.db2.gz NSMFZHIIBIZWON-UHFFFAOYSA-N 1 2 245.330 2.128 20 0 BEADLO Cc1c(F)cc[nH+]c1NCCc1cnoc1 ZINC001161699169 964694337 /nfs/dbraw/zinc/69/43/37/964694337.db2.gz PQYXOSASAKCILI-UHFFFAOYSA-N 1 2 221.235 2.172 20 0 BEADLO Cc1nc(N[C@@H](CO)C(C)C)c2c([nH+]1)CCCC2 ZINC001161735605 964724450 /nfs/dbraw/zinc/72/44/50/964724450.db2.gz ZSQQMVASNBKPFN-ZDUSSCGKSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1ccc(C[NH2+]c2ccc3[nH]c(=O)cc-3[nH]2)o1 ZINC001161769697 964744937 /nfs/dbraw/zinc/74/49/37/964744937.db2.gz VVQBPIFOCVMLHH-UHFFFAOYSA-N 1 2 243.266 2.090 20 0 BEADLO Cc1cc2cc(NCc3cnn(C)c3)[nH+]cc2[nH]1 ZINC001161849722 964790343 /nfs/dbraw/zinc/79/03/43/964790343.db2.gz XZRAMTLLUIYTHJ-UHFFFAOYSA-N 1 2 241.298 2.217 20 0 BEADLO CC(C)Oc1cc(NC2CCOCC2)cc[nH+]1 ZINC001161862519 964795808 /nfs/dbraw/zinc/79/58/08/964795808.db2.gz BTPLGUBVJNHMOJ-UHFFFAOYSA-N 1 2 236.315 2.460 20 0 BEADLO Cc1c[nH+]cc(NCc2nccn2C)c1C ZINC001161915137 964818863 /nfs/dbraw/zinc/81/88/63/964818863.db2.gz HYKJRULAVAZHDE-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO CCn1cc(Nc2cc(C)cc[nH+]2)ccc1=O ZINC001162170691 964860937 /nfs/dbraw/zinc/86/09/37/964860937.db2.gz JMOGYLJNQMPACH-UHFFFAOYSA-N 1 2 229.283 2.315 20 0 BEADLO C[C@@H]1C[NH+](Cc2ccsc2)C[C@@H](C)C1=O ZINC000696578693 964881468 /nfs/dbraw/zinc/88/14/68/964881468.db2.gz JEKXOCSRHQCFOX-NXEZZACHSA-N 1 2 223.341 2.405 20 0 BEADLO Cc1c[nH+]cc(NC[C@@H](O)c2ccco2)c1C ZINC001162260701 964894132 /nfs/dbraw/zinc/89/41/32/964894132.db2.gz HYWSUALEBZPBKA-GFCCVEGCSA-N 1 2 232.283 2.437 20 0 BEADLO O[C@H](CNc1ccn2cc[nH+]c2c1)c1ccco1 ZINC001162258913 964894777 /nfs/dbraw/zinc/89/47/77/964894777.db2.gz VEAATJARAHHETD-LLVKDONJSA-N 1 2 243.266 2.073 20 0 BEADLO COc1cc(C)c[nH+]c1N[C@@H]1C[C@]12CCCOC2 ZINC001162379613 964950119 /nfs/dbraw/zinc/95/01/19/964950119.db2.gz ZAQHVJVDGAPWBB-OCCSQVGLSA-N 1 2 248.326 2.380 20 0 BEADLO CCc1cccc(NCCN2CCCCO2)[nH+]1 ZINC001162425504 964972775 /nfs/dbraw/zinc/97/27/75/964972775.db2.gz YIEVYUKMBPXJHW-UHFFFAOYSA-N 1 2 235.331 2.083 20 0 BEADLO CCc1ccc[nH+]c1NCCN1CCCCO1 ZINC001162419826 964975033 /nfs/dbraw/zinc/97/50/33/964975033.db2.gz HESQGSBMWSDDAQ-UHFFFAOYSA-N 1 2 235.331 2.083 20 0 BEADLO Cc1c[nH+]c(Nc2cc(C)c(=O)n(C)c2)c(C)c1 ZINC001162509186 965001248 /nfs/dbraw/zinc/00/12/48/965001248.db2.gz NMQRRZUKCHVMTQ-UHFFFAOYSA-N 1 2 243.310 2.449 20 0 BEADLO Cc1cc(NCCC(=O)N(C)C2CC2)c[nH+]c1C ZINC001162627246 965081637 /nfs/dbraw/zinc/08/16/37/965081637.db2.gz HQLODLSAHLAWSA-UHFFFAOYSA-N 1 2 247.342 2.121 20 0 BEADLO Cc1cc(C)c(C(N)=O)c(NC(=[NH2+])C(C)(C)C)n1 ZINC001162656666 965093068 /nfs/dbraw/zinc/09/30/68/965093068.db2.gz ANBDGOYTMMNDCK-UHFFFAOYSA-N 1 2 248.330 2.233 20 0 BEADLO CC(C)(C)C(=[NH2+])Nc1cccc2nn[nH]c21 ZINC001162664509 965100146 /nfs/dbraw/zinc/10/01/46/965100146.db2.gz ISYPKECWXFYJLU-UHFFFAOYSA-N 1 2 217.276 2.393 20 0 BEADLO Cc1ccn2c(c1)nnc2CNc1cccc[nH+]1 ZINC001162695037 965121787 /nfs/dbraw/zinc/12/17/87/965121787.db2.gz XMNHOTWUIIZZJO-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO CC(C)Oc1ccc[nH+]c1NCC1CC(=O)C1 ZINC001168395537 965146621 /nfs/dbraw/zinc/14/66/21/965146621.db2.gz DATMCGIGCCDONL-UHFFFAOYSA-N 1 2 234.299 2.260 20 0 BEADLO COC1CC(CNc2[nH+]c(C)nc3[nH]ccc32)C1 ZINC001162986250 965217899 /nfs/dbraw/zinc/21/78/99/965217899.db2.gz NWCCEKVJMLILRQ-UHFFFAOYSA-N 1 2 246.314 2.103 20 0 BEADLO COC1CC(CNc2cc(C)[nH+]c(C3CC3)n2)C1 ZINC001162993742 965222953 /nfs/dbraw/zinc/22/29/53/965222953.db2.gz SLDRQNLCXYKDHM-UHFFFAOYSA-N 1 2 247.342 2.499 20 0 BEADLO CCSc1cc[nH+]c(N[C@@H](CC)CO)c1 ZINC001163051442 965245209 /nfs/dbraw/zinc/24/52/09/965245209.db2.gz YAGCKFZXTONXII-VIFPVBQESA-N 1 2 226.345 2.376 20 0 BEADLO CCSc1cc[nH+]c(N[C@H](CC)CO)c1 ZINC001163051441 965246401 /nfs/dbraw/zinc/24/64/01/965246401.db2.gz YAGCKFZXTONXII-SECBINFHSA-N 1 2 226.345 2.376 20 0 BEADLO Cc1nc(NCC2CCC3(CC3)CC2)nc(N)[nH+]1 ZINC000696147573 965257037 /nfs/dbraw/zinc/25/70/37/965257037.db2.gz CSKNNLLMZAEVOO-UHFFFAOYSA-N 1 2 247.346 2.145 20 0 BEADLO Cc1nc(N)nc(NCC2CCC3(CC3)CC2)[nH+]1 ZINC000696147573 965257045 /nfs/dbraw/zinc/25/70/45/965257045.db2.gz CSKNNLLMZAEVOO-UHFFFAOYSA-N 1 2 247.346 2.145 20 0 BEADLO COC(=O)[C@@H]1CC[N@@H+]1Cc1cc(C)c(C)cc1C ZINC001231482972 965264165 /nfs/dbraw/zinc/26/41/65/965264165.db2.gz VGLCLWWMNLQZFE-AWEZNQCLSA-N 1 2 247.338 2.359 20 0 BEADLO COC(=O)[C@@H]1CC[N@H+]1Cc1cc(C)c(C)cc1C ZINC001231482972 965264178 /nfs/dbraw/zinc/26/41/78/965264178.db2.gz VGLCLWWMNLQZFE-AWEZNQCLSA-N 1 2 247.338 2.359 20 0 BEADLO Cc1[nH]c(CN2CCC(=O)[C@H]3CCCC[C@@H]32)c[nH+]1 ZINC001232458663 965357799 /nfs/dbraw/zinc/35/77/99/965357799.db2.gz PTQDAMWKUVHQHN-STQMWFEESA-N 1 2 247.342 2.052 20 0 BEADLO Cc1[nH]cc(CN2CCC(=O)[C@H]3CCCC[C@@H]32)[nH+]1 ZINC001232458663 965357809 /nfs/dbraw/zinc/35/78/09/965357809.db2.gz PTQDAMWKUVHQHN-STQMWFEESA-N 1 2 247.342 2.052 20 0 BEADLO Cc1nc(N[C@@H](C)[C@@H]2CCCO2)c2c([nH+]1)CCC2 ZINC001163480467 965418268 /nfs/dbraw/zinc/41/82/68/965418268.db2.gz QXVRWIWRDGIDML-ZANVPECISA-N 1 2 247.342 2.253 20 0 BEADLO COc1c[nH+]c(N(C)C(C)C)nc1NC(C)C ZINC001163617655 965484087 /nfs/dbraw/zinc/48/40/87/965484087.db2.gz QFQATKQYXWXROI-UHFFFAOYSA-N 1 2 238.335 2.150 20 0 BEADLO CC(C)N(C)c1cc(N2CCCCC2)nc[nH+]1 ZINC001163622535 965485987 /nfs/dbraw/zinc/48/59/87/965485987.db2.gz NBNAXQYAGXHNMB-UHFFFAOYSA-N 1 2 234.347 2.312 20 0 BEADLO CC(C)N(C)c1cc(N2CCCCC2)[nH+]cn1 ZINC001163622535 965485995 /nfs/dbraw/zinc/48/59/95/965485995.db2.gz NBNAXQYAGXHNMB-UHFFFAOYSA-N 1 2 234.347 2.312 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)CC(C)C ZINC001121140416 965490278 /nfs/dbraw/zinc/49/02/78/965490278.db2.gz RIQGXZRAWYJTPK-UHFFFAOYSA-N 1 2 206.289 2.105 20 0 BEADLO Cc1nc(N(C)CC(F)(F)F)c(C)c(C)[nH+]1 ZINC001163710616 965528511 /nfs/dbraw/zinc/52/85/11/965528511.db2.gz MIOLPKAXIFBLRR-UHFFFAOYSA-N 1 2 233.237 2.400 20 0 BEADLO CCCOCCNc1cc(N)cc(Cl)[nH+]1 ZINC000714962517 965568890 /nfs/dbraw/zinc/56/88/90/965568890.db2.gz JSQWXKDITIEHQH-UHFFFAOYSA-N 1 2 229.711 2.156 20 0 BEADLO C[C@@H]([NH2+]Cc1ccc[nH]c1=O)c1cscn1 ZINC000714978995 965573718 /nfs/dbraw/zinc/57/37/18/965573718.db2.gz ZNTYUHRJUMMLHO-MRVPVSSYSA-N 1 2 235.312 2.095 20 0 BEADLO Nc1ccc(N2CCC(=O)[C@@H]3CCCC[C@H]32)[nH+]c1 ZINC001163789112 965589744 /nfs/dbraw/zinc/58/97/44/965589744.db2.gz AIZKOWOZKBZENV-VXGBXAGGSA-N 1 2 245.326 2.002 20 0 BEADLO Nc1ccc(N2CCC(=O)[C@H]3CCCC[C@H]32)[nH+]c1 ZINC001163789110 965590138 /nfs/dbraw/zinc/59/01/38/965590138.db2.gz AIZKOWOZKBZENV-NWDGAFQWSA-N 1 2 245.326 2.002 20 0 BEADLO COC(=O)[C@@H]([NH2+][C@H]1CCCSC1)C(C)(C)C ZINC001257658066 1169871862 /nfs/dbraw/zinc/87/18/62/1169871862.db2.gz NZONGKOISTXFCY-VHSXEESVSA-N 1 2 245.388 2.059 20 0 BEADLO COC(=O)[C@@H]([NH2+][C@@H]1CCCSC1)C(C)(C)C ZINC001257658064 1169872242 /nfs/dbraw/zinc/87/22/42/1169872242.db2.gz NZONGKOISTXFCY-NXEZZACHSA-N 1 2 245.388 2.059 20 0 BEADLO CCN(C)c1cc(NCCCSC)[nH+]cn1 ZINC001163871251 965613465 /nfs/dbraw/zinc/61/34/65/965613465.db2.gz LLDANOQTHNZTJE-UHFFFAOYSA-N 1 2 240.376 2.098 20 0 BEADLO CCN(C)c1cc(NCCCSC)nc[nH+]1 ZINC001163871251 965613470 /nfs/dbraw/zinc/61/34/70/965613470.db2.gz LLDANOQTHNZTJE-UHFFFAOYSA-N 1 2 240.376 2.098 20 0 BEADLO Cc1c(F)cc[nH+]c1N1CCCO[C@@H](C)C1 ZINC001163962590 965661713 /nfs/dbraw/zinc/66/17/13/965661713.db2.gz SASHHTQSOIZXTA-VIFPVBQESA-N 1 2 224.279 2.144 20 0 BEADLO O=C1CN(c2cc3[nH]ccc3c[nH+]2)CCC[C@@H]1F ZINC001164018031 965695206 /nfs/dbraw/zinc/69/52/06/965695206.db2.gz BTPINNZUKJSRSL-JTQLQIEISA-N 1 2 247.273 2.070 20 0 BEADLO Cc1nonc1CNc1ccc([NH+](C)C)c(C)c1 ZINC001164062310 965725931 /nfs/dbraw/zinc/72/59/31/965725931.db2.gz ZMRPWKCAAJDWBM-UHFFFAOYSA-N 1 2 246.314 2.365 20 0 BEADLO CC1(C)C[C@@H](CNc2ccc3c([nH+]2)CCOC3)O1 ZINC001168450855 965743553 /nfs/dbraw/zinc/74/35/53/965743553.db2.gz GZGPVDHFPPSIKO-NSHDSACASA-N 1 2 248.326 2.134 20 0 BEADLO CO[C@@H]1CN(c2cccc(C3CC3)[nH+]2)C[C@@H]1F ZINC001164130294 965751966 /nfs/dbraw/zinc/75/19/66/965751966.db2.gz CGIIVNFKMNGRGN-CMPLNLGQSA-N 1 2 236.290 2.132 20 0 BEADLO C[C@@H]1CCN(c2cc3ccccc3c[nH+]2)C[C@H]1O ZINC001164271775 965814272 /nfs/dbraw/zinc/81/42/72/965814272.db2.gz IENYCNXZTGPNIW-BXUZGUMPSA-N 1 2 242.322 2.442 20 0 BEADLO Cn1c[nH+]c2ccc(NCC3(CO)CCC3)cc21 ZINC001164363818 965859411 /nfs/dbraw/zinc/85/94/11/965859411.db2.gz NWULQWGPECIFSZ-UHFFFAOYSA-N 1 2 245.326 2.148 20 0 BEADLO COc1ccc(C)[nH+]c1N1CCC(=O)[C@@H](C)CC1 ZINC001164369676 965866372 /nfs/dbraw/zinc/86/63/72/965866372.db2.gz YKYLYBJEBAWHNJ-JTQLQIEISA-N 1 2 248.326 2.204 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@H](C)COc1ccccc1 ZINC000699426420 965868159 /nfs/dbraw/zinc/86/81/59/965868159.db2.gz NGGDZWPVPGASKG-LLVKDONJSA-N 1 2 245.326 2.275 20 0 BEADLO C[C@]1(CF)CC(F)(F)CN1c1ccc(N)c[nH+]1 ZINC001164557429 965913808 /nfs/dbraw/zinc/91/38/08/965913808.db2.gz GDCQUPPSEFUIKF-SNVBAGLBSA-N 1 2 245.248 2.237 20 0 BEADLO c1cn2ccc(NC[C@H]3CCCCO3)cc2[nH+]1 ZINC001165228474 965993381 /nfs/dbraw/zinc/99/33/81/965993381.db2.gz BYEFGDNSPRRFNW-GFCCVEGCSA-N 1 2 231.299 2.315 20 0 BEADLO COc1cc[nH+]cc1NC[C@H]1CCCCO1 ZINC001165229309 965994476 /nfs/dbraw/zinc/99/44/76/965994476.db2.gz GWOKXFUHPQODCM-SNVBAGLBSA-N 1 2 222.288 2.071 20 0 BEADLO CN(C)c1cc(N2CCC23CCCC3)nc[nH+]1 ZINC001165281326 966023952 /nfs/dbraw/zinc/02/39/52/966023952.db2.gz YNOOJEREAZQUGT-UHFFFAOYSA-N 1 2 232.331 2.066 20 0 BEADLO CN(C)c1cc(N2CCC23CCCC3)[nH+]cn1 ZINC001165281326 966023962 /nfs/dbraw/zinc/02/39/62/966023962.db2.gz YNOOJEREAZQUGT-UHFFFAOYSA-N 1 2 232.331 2.066 20 0 BEADLO OCCCC1CCN(c2cc[nH+]cc2F)CC1 ZINC000699669132 966030685 /nfs/dbraw/zinc/03/06/85/966030685.db2.gz IJFOKXAPAOYABW-UHFFFAOYSA-N 1 2 238.306 2.210 20 0 BEADLO CNc1ccc(Nc2cc(OC)ncc2F)c[nH+]1 ZINC001203452992 966051505 /nfs/dbraw/zinc/05/15/05/966051505.db2.gz VSNIMHQYLCSKEO-UHFFFAOYSA-N 1 2 248.261 2.410 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C ZINC001123472535 966183598 /nfs/dbraw/zinc/18/35/98/966183598.db2.gz IBPMABYUNRZXQP-OJAKKHQRSA-N 1 2 248.326 2.238 20 0 BEADLO Cc1cc(N[C@H](C)CCO)cc(OC(F)F)[nH+]1 ZINC001165965839 966217140 /nfs/dbraw/zinc/21/71/40/966217140.db2.gz FZSFQLZJYUTBNT-SSDOTTSWSA-N 1 2 246.257 2.174 20 0 BEADLO C[C@@H]1CCN(c2[nH+]ccc3ccccc32)C[C@H]1O ZINC000299984872 966237398 /nfs/dbraw/zinc/23/73/98/966237398.db2.gz ABSGEJPFNFXSQX-BXUZGUMPSA-N 1 2 242.322 2.442 20 0 BEADLO C[N@@H+](Cc1ccc([S-])cc1)C[C@@H]1CCC[NH2+]1 ZINC001236122269 966272908 /nfs/dbraw/zinc/27/29/08/966272908.db2.gz QMDINNYTJGITKZ-LBPRGKRZSA-N 1 2 236.384 2.159 20 0 BEADLO C[N@H+](Cc1ccc([S-])cc1)C[C@@H]1CCC[NH2+]1 ZINC001236122269 966272912 /nfs/dbraw/zinc/27/29/12/966272912.db2.gz QMDINNYTJGITKZ-LBPRGKRZSA-N 1 2 236.384 2.159 20 0 BEADLO CN(Cc1ccc(S)cc1)C[C@@H]1CCC[NH2+]1 ZINC001236122269 966272921 /nfs/dbraw/zinc/27/29/21/966272921.db2.gz QMDINNYTJGITKZ-LBPRGKRZSA-N 1 2 236.384 2.159 20 0 BEADLO C[C@H](CO)Cn1c[nH+]c(Cc2ccccc2)c1 ZINC000919150542 966294347 /nfs/dbraw/zinc/29/43/47/966294347.db2.gz LQXUBSWBAVRUOF-LBPRGKRZSA-N 1 2 230.311 2.102 20 0 BEADLO FCCn1c[nH+]c(Cc2ccccc2)c1 ZINC000919145008 966294830 /nfs/dbraw/zinc/29/48/30/966294830.db2.gz UWMNLNPRLZGITJ-UHFFFAOYSA-N 1 2 204.248 2.443 20 0 BEADLO CCc1cc(N2CCn3cccc3C2)nc(C)[nH+]1 ZINC001166602186 966320500 /nfs/dbraw/zinc/32/05/00/966320500.db2.gz LHHDZCMUEPRMOK-UHFFFAOYSA-N 1 2 242.326 2.169 20 0 BEADLO Nc1cc(Nc2[nH+]cccc2N)ccc1F ZINC001212330373 966491047 /nfs/dbraw/zinc/49/10/47/966491047.db2.gz NFUAYRWTOYNIKB-UHFFFAOYSA-N 1 2 218.235 2.129 20 0 BEADLO Cc1c(F)cc[nH+]c1N1CCOC[C@H]1C(C)C ZINC001166999349 966511503 /nfs/dbraw/zinc/51/15/03/966511503.db2.gz VVJGDECKOIFKPO-LBPRGKRZSA-N 1 2 238.306 2.390 20 0 BEADLO CC[NH+](CC)[C@H](C(=O)N(C)C#N)c1ccccc1 ZINC001523362282 966559568 /nfs/dbraw/zinc/55/95/68/966559568.db2.gz YDLAEQDKDQWINQ-ZDUSSCGKSA-N 1 2 245.326 2.009 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2ccco2)CCC1=O ZINC001203273143 966589562 /nfs/dbraw/zinc/58/95/62/966589562.db2.gz UDVPMJYBJJXUCY-SNVBAGLBSA-N 1 2 207.273 2.081 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2ccco2)CCC1=O ZINC001203273143 966589577 /nfs/dbraw/zinc/58/95/77/966589577.db2.gz UDVPMJYBJJXUCY-SNVBAGLBSA-N 1 2 207.273 2.081 20 0 BEADLO CNc1ccc(Nc2nocc2C)c[nH+]1 ZINC001203446934 966636436 /nfs/dbraw/zinc/63/64/36/966636436.db2.gz HHAAFJMBRJHDMZ-UHFFFAOYSA-N 1 2 204.233 2.163 20 0 BEADLO CNc1ccc(Nc2nccnc2Cl)c[nH+]1 ZINC001203448358 966648238 /nfs/dbraw/zinc/64/82/38/966648238.db2.gz YTIXPOQTNRQCKV-UHFFFAOYSA-N 1 2 235.678 2.310 20 0 BEADLO CNc1ccc(Nc2noc3cccnc32)c[nH+]1 ZINC001203446500 966649578 /nfs/dbraw/zinc/64/95/78/966649578.db2.gz BGZBNXIUCKUFCW-UHFFFAOYSA-N 1 2 241.254 2.403 20 0 BEADLO CNc1ccc(Nc2cc(C3CC3)nn2C)c[nH+]1 ZINC001203447741 966649918 /nfs/dbraw/zinc/64/99/18/966649918.db2.gz OIPRTGMKUDLXPQ-UHFFFAOYSA-N 1 2 243.314 2.478 20 0 BEADLO CNc1ccc(Nc2cnc(Cl)cc2N)c[nH+]1 ZINC001203448737 966650406 /nfs/dbraw/zinc/65/04/06/966650406.db2.gz HPFVIPCJFZOERH-UHFFFAOYSA-N 1 2 249.705 2.498 20 0 BEADLO CNc1ccc(-n2cc(N)c3ncccc32)c[nH+]1 ZINC001203449838 966652617 /nfs/dbraw/zinc/65/26/17/966652617.db2.gz MUTQKWRBUXELGZ-UHFFFAOYSA-N 1 2 239.282 2.044 20 0 BEADLO CCOc1cc(Nc2ccc(NC)[nH+]c2)no1 ZINC001203453275 966655220 /nfs/dbraw/zinc/65/52/20/966655220.db2.gz ZVTMUQWPDQYYGH-UHFFFAOYSA-N 1 2 234.259 2.254 20 0 BEADLO CNc1ccc(Nc2c(N)cccc2OC)c[nH+]1 ZINC001203460911 966655395 /nfs/dbraw/zinc/65/53/95/966655395.db2.gz YXXUNSFFEJYHGW-UHFFFAOYSA-N 1 2 244.298 2.458 20 0 BEADLO CNc1ccc(Nc2ccc(CO)cc2F)c[nH+]1 ZINC001203456565 966658852 /nfs/dbraw/zinc/65/88/52/966658852.db2.gz KCSVHOOJXJEERF-UHFFFAOYSA-N 1 2 247.273 2.498 20 0 BEADLO CCOc1ccccc1C[N@H+](C)CC(C)=O ZINC001203534855 966671960 /nfs/dbraw/zinc/67/19/60/966671960.db2.gz HBJSDLKFQJCJAS-UHFFFAOYSA-N 1 2 221.300 2.106 20 0 BEADLO CCOc1ccccc1C[N@@H+](C)CC(C)=O ZINC001203534855 966671963 /nfs/dbraw/zinc/67/19/63/966671963.db2.gz HBJSDLKFQJCJAS-UHFFFAOYSA-N 1 2 221.300 2.106 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2ccc(CO)nc2)c1 ZINC001203657112 966719557 /nfs/dbraw/zinc/71/95/57/966719557.db2.gz JKKOTKPIQYMEGT-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO COC(=O)[C@@H]1CC[N@@H+]1Cc1c(C)cc(C)cc1C ZINC001203741758 966755415 /nfs/dbraw/zinc/75/54/15/966755415.db2.gz CCIKKLLBJUCGGL-AWEZNQCLSA-N 1 2 247.338 2.359 20 0 BEADLO COC(=O)[C@@H]1CC[N@H+]1Cc1c(C)cc(C)cc1C ZINC001203741758 966755433 /nfs/dbraw/zinc/75/54/33/966755433.db2.gz CCIKKLLBJUCGGL-AWEZNQCLSA-N 1 2 247.338 2.359 20 0 BEADLO CC(=O)[C@H]1C[N@H+](Cc2ccc(C)cc2C)CCO1 ZINC001203744388 966761893 /nfs/dbraw/zinc/76/18/93/966761893.db2.gz BDXQORRUJVEAIW-OAHLLOKOSA-N 1 2 247.338 2.093 20 0 BEADLO CC(=O)[C@H]1C[N@@H+](Cc2ccc(C)cc2C)CCO1 ZINC001203744388 966761900 /nfs/dbraw/zinc/76/19/00/966761900.db2.gz BDXQORRUJVEAIW-OAHLLOKOSA-N 1 2 247.338 2.093 20 0 BEADLO COC(=O)[C@@H]1CC[N@@H+]1Cc1cc(C)ccc1C ZINC001203742303 966767626 /nfs/dbraw/zinc/76/76/26/966767626.db2.gz AECKHONEVJYUMF-ZDUSSCGKSA-N 1 2 233.311 2.051 20 0 BEADLO COC(=O)[C@@H]1CC[N@H+]1Cc1cc(C)ccc1C ZINC001203742303 966767632 /nfs/dbraw/zinc/76/76/32/966767632.db2.gz AECKHONEVJYUMF-ZDUSSCGKSA-N 1 2 233.311 2.051 20 0 BEADLO Clc1ccc(C[NH+]2CC3(COC3)C2)cc1 ZINC001203918299 966821047 /nfs/dbraw/zinc/82/10/47/966821047.db2.gz PPBGQBLBFRTKCI-UHFFFAOYSA-N 1 2 223.703 2.172 20 0 BEADLO c1ccc2c(C[NH+]3CC4(CCO4)C3)ccnc2c1 ZINC001204088554 966891399 /nfs/dbraw/zinc/89/13/99/966891399.db2.gz OWQHEPGUFOTWQT-UHFFFAOYSA-N 1 2 240.306 2.210 20 0 BEADLO Cc1cc2[nH+]ccn2cc1C1=CCOC1 ZINC001239482450 966901165 /nfs/dbraw/zinc/90/11/65/966901165.db2.gz WOOWSMUVJWPUIN-UHFFFAOYSA-N 1 2 200.241 2.056 20 0 BEADLO CCCOc1ccc(C[N@@H+]2CCC23COC3)cc1 ZINC001204308908 966968391 /nfs/dbraw/zinc/96/83/91/966968391.db2.gz LDCQLPHVFZUBRC-UHFFFAOYSA-N 1 2 247.338 2.450 20 0 BEADLO CCCOc1ccc(C[N@H+]2CCC23COC3)cc1 ZINC001204308908 966968397 /nfs/dbraw/zinc/96/83/97/966968397.db2.gz LDCQLPHVFZUBRC-UHFFFAOYSA-N 1 2 247.338 2.450 20 0 BEADLO Nc1[nH+]cccc1Nc1cc(Cl)[nH]c(=O)c1 ZINC001212395493 967023248 /nfs/dbraw/zinc/02/32/48/967023248.db2.gz QCLKUNRIWBXFBK-UHFFFAOYSA-N 1 2 236.662 2.161 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cnccn2)oc1C ZINC001204534138 967026641 /nfs/dbraw/zinc/02/66/41/967026641.db2.gz VPZLUOWUAMZUDU-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cnccn2)oc1C ZINC001204534138 967026657 /nfs/dbraw/zinc/02/66/57/967026657.db2.gz VPZLUOWUAMZUDU-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CO[C@@H]1C[N@@H+](Cc2cc(C)c(C)o2)C[C@@H]1F ZINC001204536213 967036704 /nfs/dbraw/zinc/03/67/04/967036704.db2.gz DKFSVMPSPPWQKL-NWDGAFQWSA-N 1 2 227.279 2.065 20 0 BEADLO CO[C@@H]1C[N@H+](Cc2cc(C)c(C)o2)C[C@@H]1F ZINC001204536213 967036696 /nfs/dbraw/zinc/03/66/96/967036696.db2.gz DKFSVMPSPPWQKL-NWDGAFQWSA-N 1 2 227.279 2.065 20 0 BEADLO CNc1ccc(N2CCc3cccc(N)c32)c[nH+]1 ZINC001203462432 967071059 /nfs/dbraw/zinc/07/10/59/967071059.db2.gz RFKLZFWGQAAARV-UHFFFAOYSA-N 1 2 240.310 2.400 20 0 BEADLO C[C@@H]1CC[N@@H+]1Cc1nc2ccccc2[nH]1 ZINC001204751656 967145727 /nfs/dbraw/zinc/14/57/27/967145727.db2.gz MFYWFRNWJJAVII-SECBINFHSA-N 1 2 201.273 2.157 20 0 BEADLO C[C@@H]1CC[N@H+]1Cc1nc2ccccc2[nH]1 ZINC001204751656 967145738 /nfs/dbraw/zinc/14/57/38/967145738.db2.gz MFYWFRNWJJAVII-SECBINFHSA-N 1 2 201.273 2.157 20 0 BEADLO COc1cc[nH+]cc1CC(=O)C(C)(C)C ZINC001249919250 967158413 /nfs/dbraw/zinc/15/84/13/967158413.db2.gz NEHNBKXCPQEBGP-UHFFFAOYSA-N 1 2 207.273 2.248 20 0 BEADLO CCOCCc1ccc(N2CCCC2)[nH+]c1 ZINC001249939788 967180653 /nfs/dbraw/zinc/18/06/53/967180653.db2.gz IQNTUYCMNLOXQF-UHFFFAOYSA-N 1 2 220.316 2.261 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc2nonc2c1 ZINC001204945724 967251095 /nfs/dbraw/zinc/25/10/95/967251095.db2.gz MYJUNAXIERPIKR-YALUOGEHSA-N 1 2 201.229 2.099 20 0 BEADLO Fc1cncc(F)c1Nc1ccn2cc[nH+]c2c1 ZINC001204951455 967251609 /nfs/dbraw/zinc/25/16/09/967251609.db2.gz SMSWKCHJUBTVBW-UHFFFAOYSA-N 1 2 246.220 2.173 20 0 BEADLO COc1cncc(-c2ccc3[nH+]ccn3c2)c1 ZINC001239929967 967258140 /nfs/dbraw/zinc/25/81/40/967258140.db2.gz BIFTYNIGHZCOLK-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO CNc1cc(-c2ccc3nonc3c2)cc[nH+]1 ZINC001204960421 967261086 /nfs/dbraw/zinc/26/10/86/967261086.db2.gz ZMBYINRLLXIFAP-UHFFFAOYSA-N 1 2 226.239 2.327 20 0 BEADLO CC(C)[C@H]1CC[N@@H+]1Cc1nn(C)cc1Cl ZINC001204975091 967269563 /nfs/dbraw/zinc/26/95/63/967269563.db2.gz FXDJJFIYWBMNBB-LLVKDONJSA-N 1 2 227.739 2.304 20 0 BEADLO CC(C)[C@H]1CC[N@H+]1Cc1nn(C)cc1Cl ZINC001204975091 967269566 /nfs/dbraw/zinc/26/95/66/967269566.db2.gz FXDJJFIYWBMNBB-LLVKDONJSA-N 1 2 227.739 2.304 20 0 BEADLO Nc1ccc2cn(-c3ccn4cc[nH+]c4c3)nc2c1 ZINC001204977759 967271421 /nfs/dbraw/zinc/27/14/21/967271421.db2.gz KVLOOOOQXLKCMM-UHFFFAOYSA-N 1 2 249.277 2.255 20 0 BEADLO c1cn2cc(-c3ccc4c(n3)COC4)ccc2[nH+]1 ZINC001240216835 967425358 /nfs/dbraw/zinc/42/53/58/967425358.db2.gz OQUXRDKXHHHYLW-UHFFFAOYSA-N 1 2 237.262 2.427 20 0 BEADLO COc1cc(-c2cccc3[nH+]ccn32)ccn1 ZINC001240257372 967475855 /nfs/dbraw/zinc/47/58/55/967475855.db2.gz VUCDJFNOBOVHDF-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO Cn1cc(-c2ccc(Cn3cc[nH+]c3)cc2)cn1 ZINC001240295904 967497273 /nfs/dbraw/zinc/49/72/73/967497273.db2.gz FYPOVVWANTVTFA-UHFFFAOYSA-N 1 2 238.294 2.332 20 0 BEADLO Cc1c[nH+]cc(C[C@H]2COC(C)(C)O2)c1C ZINC001250187114 967500686 /nfs/dbraw/zinc/50/06/86/967500686.db2.gz UMYQXIFCBGAVLA-LBPRGKRZSA-N 1 2 221.300 2.392 20 0 BEADLO CNc1ccc(Cc2csc(C)n2)c[nH+]1 ZINC001250196987 967515642 /nfs/dbraw/zinc/51/56/42/967515642.db2.gz QMBJJHVGYMBQJP-UHFFFAOYSA-N 1 2 219.313 2.479 20 0 BEADLO CCO[C@@H]1CC[N@H+](Cc2scnc2Cl)C1 ZINC001137825087 967544540 /nfs/dbraw/zinc/54/45/40/967544540.db2.gz WGSHQLDXXIYEGE-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO CCO[C@@H]1CC[N@@H+](Cc2scnc2Cl)C1 ZINC001137825087 967544574 /nfs/dbraw/zinc/54/45/74/967544574.db2.gz WGSHQLDXXIYEGE-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO Cc1ccc2n[nH]cc2c1CCn1cc[nH+]c1 ZINC001250316360 967676474 /nfs/dbraw/zinc/67/64/74/967676474.db2.gz LLOVZZDMBMNJAL-UHFFFAOYSA-N 1 2 226.283 2.311 20 0 BEADLO Cc1ccc(CCn2cc[nH+]c2)cc1N ZINC001250316126 967676832 /nfs/dbraw/zinc/67/68/32/967676832.db2.gz BNQDJXNIPNGDIE-UHFFFAOYSA-N 1 2 201.273 2.016 20 0 BEADLO Cc1cc(CCn2cc[nH+]c2)cc(C)c1N ZINC001250316227 967681763 /nfs/dbraw/zinc/68/17/63/967681763.db2.gz DSLVRDFWZYUBLV-UHFFFAOYSA-N 1 2 215.300 2.325 20 0 BEADLO Cn1cc2c(cccc2CCn2cc[nH+]c2)n1 ZINC001250316574 967686626 /nfs/dbraw/zinc/68/66/26/967686626.db2.gz NHVLVFCTRHYVLM-UHFFFAOYSA-N 1 2 226.283 2.013 20 0 BEADLO COc1ccc(CCn2cc[nH+]c2)c(F)c1F ZINC001250316687 967687633 /nfs/dbraw/zinc/68/76/33/967687633.db2.gz SQTUZPLWURAUEK-UHFFFAOYSA-N 1 2 238.237 2.413 20 0 BEADLO Cc1c2c[nH]nc2ccc1CCn1cc[nH+]c1 ZINC001250316544 967689108 /nfs/dbraw/zinc/68/91/08/967689108.db2.gz LYXNCTMVWQJATG-UHFFFAOYSA-N 1 2 226.283 2.311 20 0 BEADLO c1cn(CCc2cncc(N3CCCC3)c2)c[nH+]1 ZINC001250319563 967692905 /nfs/dbraw/zinc/69/29/05/967692905.db2.gz VIGDHKAAPVIEFC-UHFFFAOYSA-N 1 2 242.326 2.121 20 0 BEADLO CC(C)(C)n1cc(CCn2cc[nH+]c2)cn1 ZINC001250318939 967693184 /nfs/dbraw/zinc/69/31/84/967693184.db2.gz NJJBJDIVKFCYNM-UHFFFAOYSA-N 1 2 218.304 2.077 20 0 BEADLO COCCOc1ccccc1CCn1cc[nH+]c1 ZINC001250318937 967693299 /nfs/dbraw/zinc/69/32/99/967693299.db2.gz NILICVFSMILAJQ-UHFFFAOYSA-N 1 2 246.310 2.151 20 0 BEADLO Oc1c(Cl)cccc1CCn1cc[nH+]c1 ZINC001250319525 967693686 /nfs/dbraw/zinc/69/36/86/967693686.db2.gz TXGDOKUOLJBTGK-UHFFFAOYSA-N 1 2 222.675 2.485 20 0 BEADLO c1cn(CCc2ccnc(OCC3CC3)c2)c[nH+]1 ZINC001250318925 967695101 /nfs/dbraw/zinc/69/51/01/967695101.db2.gz MNWUGPXDIZWVAM-UHFFFAOYSA-N 1 2 243.310 2.310 20 0 BEADLO FC(F)Oc1ccc(CCn2cc[nH+]c2)cn1 ZINC001250318973 967695341 /nfs/dbraw/zinc/69/53/41/967695341.db2.gz ODJKZUSOZUTIFD-UHFFFAOYSA-N 1 2 239.225 2.122 20 0 BEADLO CCn1cc(C[N@@H+]2CCc3occc3C2)cn1 ZINC001205552876 967695749 /nfs/dbraw/zinc/69/57/49/967695749.db2.gz RXOZONSBYSHHSM-UHFFFAOYSA-N 1 2 231.299 2.054 20 0 BEADLO CCn1cc(C[N@H+]2CCc3occc3C2)cn1 ZINC001205552876 967695754 /nfs/dbraw/zinc/69/57/54/967695754.db2.gz RXOZONSBYSHHSM-UHFFFAOYSA-N 1 2 231.299 2.054 20 0 BEADLO Cc1ccc(CCn2cc[nH+]c2)cc1O ZINC001250320109 967696423 /nfs/dbraw/zinc/69/64/23/967696423.db2.gz YJRMLRWXQJWQFQ-UHFFFAOYSA-N 1 2 202.257 2.140 20 0 BEADLO Cc1ccc(F)c(CCn2cc[nH+]c2)c1O ZINC001250320195 967697146 /nfs/dbraw/zinc/69/71/46/967697146.db2.gz IZMUMLURAMHTEM-UHFFFAOYSA-N 1 2 220.247 2.279 20 0 BEADLO c1cn2ccc(Cc3ccccn3)cc2[nH+]1 ZINC001250320594 967697669 /nfs/dbraw/zinc/69/76/69/967697669.db2.gz VHLWEPPGQKGONF-UHFFFAOYSA-N 1 2 209.252 2.320 20 0 BEADLO Cc1cc(N)ccc1CCn1cc[nH+]c1 ZINC001250320919 967699983 /nfs/dbraw/zinc/69/99/83/967699983.db2.gz SRYUJGMKYQSCQG-UHFFFAOYSA-N 1 2 201.273 2.016 20 0 BEADLO Clc1cccc2c1C[C@@H]([N@H+]1C[C@H]3C[C@@H](C1)O3)C2 ZINC001168741204 967711525 /nfs/dbraw/zinc/71/15/25/967711525.db2.gz WVSRDXFIIATQNL-SDDRHHMPSA-N 1 2 249.741 2.280 20 0 BEADLO Clc1cccc2c1C[C@@H]([N@@H+]1C[C@H]3C[C@@H](C1)O3)C2 ZINC001168741204 967711540 /nfs/dbraw/zinc/71/15/40/967711540.db2.gz WVSRDXFIIATQNL-SDDRHHMPSA-N 1 2 249.741 2.280 20 0 BEADLO Cc1ccc(F)c(C[N@@H+]2CCCC23COC3)c1 ZINC001205648426 967742283 /nfs/dbraw/zinc/74/22/83/967742283.db2.gz RSOLOHPYZVMBDV-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1ccc(F)c(C[N@H+]2CCCC23COC3)c1 ZINC001205648426 967742291 /nfs/dbraw/zinc/74/22/91/967742291.db2.gz RSOLOHPYZVMBDV-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO COc1cccc2c1C[N@H+](Cc1cnoc1)CC2 ZINC001205670439 967753924 /nfs/dbraw/zinc/75/39/24/967753924.db2.gz ORTYSYUYYFQHFT-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1cccc2c1C[N@@H+](Cc1cnoc1)CC2 ZINC001205670439 967753935 /nfs/dbraw/zinc/75/39/35/967753935.db2.gz ORTYSYUYYFQHFT-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO CCOc1nccc(C[NH+](C)C)c1Cl ZINC001250361011 967764374 /nfs/dbraw/zinc/76/43/74/967764374.db2.gz KJAPWCJDXPYKQR-UHFFFAOYSA-N 1 2 214.696 2.195 20 0 BEADLO Fc1ccc(C2C[NH+](Cc3cc[nH]n3)C2)cc1 ZINC001117815054 967800765 /nfs/dbraw/zinc/80/07/65/967800765.db2.gz QOVPECUAKGQCCP-UHFFFAOYSA-N 1 2 231.274 2.148 20 0 BEADLO CC(C)c1[nH]c2cc3c(cc2[nH+]1)OCC(=O)N3 ZINC001250422787 967832861 /nfs/dbraw/zinc/83/28/61/967832861.db2.gz XMEWAFPCYJHEHM-UHFFFAOYSA-N 1 2 231.255 2.017 20 0 BEADLO c1cc2nccc(-c3ccn4cc[nH+]c4c3)n2n1 ZINC001250479114 967920000 /nfs/dbraw/zinc/92/00/00/967920000.db2.gz FKAAPPZDSCOAJE-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO Cc1cc(C[NH+]2CC(C)(CC(F)F)C2)n(C)n1 ZINC000843425261 967989209 /nfs/dbraw/zinc/98/92/09/967989209.db2.gz ZHTDFYHAWOVEIW-UHFFFAOYSA-N 1 2 243.301 2.206 20 0 BEADLO CCc1nc(C[N@H+](C)CCOC2CC2)cs1 ZINC000929342483 967992292 /nfs/dbraw/zinc/99/22/92/967992292.db2.gz FANPQXCUFCLGKG-UHFFFAOYSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nc(C[N@@H+](C)CCOC2CC2)cs1 ZINC000929342483 967992332 /nfs/dbraw/zinc/99/23/32/967992332.db2.gz FANPQXCUFCLGKG-UHFFFAOYSA-N 1 2 240.372 2.316 20 0 BEADLO CCCCOC(=O)C[NH2+]C1(C2CCC2)CC1 ZINC000697413582 967996839 /nfs/dbraw/zinc/99/68/39/967996839.db2.gz MUAZQPOZDCETFW-UHFFFAOYSA-N 1 2 225.332 2.252 20 0 BEADLO c1c2[nH]c([C@@H]3CCCOC3)[nH+]c2cc2c1OCO2 ZINC001250549665 968056510 /nfs/dbraw/zinc/05/65/10/968056510.db2.gz FRULDSMYICKNJJ-MRVPVSSYSA-N 1 2 246.266 2.186 20 0 BEADLO CCOC(=O)[C@H]([NH2+][C@H]1C=CCCC1)C1CC1 ZINC001118229196 968057196 /nfs/dbraw/zinc/05/71/96/968057196.db2.gz YJAPGWCLJFHVFF-NWDGAFQWSA-N 1 2 223.316 2.026 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCCC(=O)CC2)s1 ZINC001206151649 968092585 /nfs/dbraw/zinc/09/25/85/968092585.db2.gz YPNDCKVKLYWFJR-UHFFFAOYSA-N 1 2 238.356 2.315 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCCC(=O)CC2)s1 ZINC001206151649 968092598 /nfs/dbraw/zinc/09/25/98/968092598.db2.gz YPNDCKVKLYWFJR-UHFFFAOYSA-N 1 2 238.356 2.315 20 0 BEADLO CCOc1ccc2[nH]c(CCOC)[nH+]c2c1 ZINC001250596466 968131527 /nfs/dbraw/zinc/13/15/27/968131527.db2.gz WTJPYHXEIKOALJ-UHFFFAOYSA-N 1 2 220.272 2.151 20 0 BEADLO Cc1cc2[nH]c(CCC3OCCO3)[nH+]c2cc1C ZINC001250607985 968156345 /nfs/dbraw/zinc/15/63/45/968156345.db2.gz JLORGQHAQMGMDH-UHFFFAOYSA-N 1 2 246.310 2.485 20 0 BEADLO Cc1cc(C)c(NC[C@@H](O)C(F)(F)F)c[nH+]1 ZINC001250961597 968216374 /nfs/dbraw/zinc/21/63/74/968216374.db2.gz MMNJSVSXSVRMPC-SECBINFHSA-N 1 2 234.221 2.034 20 0 BEADLO COc1ccc(C)[nH+]c1N1CCC(=O)[C@H](C)CC1 ZINC001164369678 968230468 /nfs/dbraw/zinc/23/04/68/968230468.db2.gz YKYLYBJEBAWHNJ-SNVBAGLBSA-N 1 2 248.326 2.204 20 0 BEADLO COc1ncccc1C[N@H+](C)Cc1ccncc1 ZINC001206554150 968380968 /nfs/dbraw/zinc/38/09/68/968380968.db2.gz TYNSUIYUECWZSL-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1ncccc1C[N@@H+](C)Cc1ccncc1 ZINC001206554150 968380972 /nfs/dbraw/zinc/38/09/72/968380972.db2.gz TYNSUIYUECWZSL-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO CC[N@H+](C)Cc1nnc(Cc2ccc(F)cc2)o1 ZINC001251902047 968384326 /nfs/dbraw/zinc/38/43/26/968384326.db2.gz ZJGWNDRMVPHTES-UHFFFAOYSA-N 1 2 249.289 2.251 20 0 BEADLO CC[N@@H+](C)Cc1nnc(Cc2ccc(F)cc2)o1 ZINC001251902047 968384338 /nfs/dbraw/zinc/38/43/38/968384338.db2.gz ZJGWNDRMVPHTES-UHFFFAOYSA-N 1 2 249.289 2.251 20 0 BEADLO Nc1cc(-c2cc3n[nH]cc3c(F)c2)cc[nH+]1 ZINC001206579260 968401077 /nfs/dbraw/zinc/40/10/77/968401077.db2.gz GEVUWQOSWVDKFO-UHFFFAOYSA-N 1 2 228.230 2.346 20 0 BEADLO CC(C)c1ccc(N(C)CC2COC2)[nH+]c1 ZINC001166949608 968404965 /nfs/dbraw/zinc/40/49/65/968404965.db2.gz KRIVERURAMULPN-UHFFFAOYSA-N 1 2 220.316 2.288 20 0 BEADLO COc1cccnc1C[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC001206610484 968416872 /nfs/dbraw/zinc/41/68/72/968416872.db2.gz HUCFSBJJPBMYNM-GHMZBOCLSA-N 1 2 238.306 2.270 20 0 BEADLO COc1cccnc1C[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC001206610484 968416876 /nfs/dbraw/zinc/41/68/76/968416876.db2.gz HUCFSBJJPBMYNM-GHMZBOCLSA-N 1 2 238.306 2.270 20 0 BEADLO CCOc1nccnc1Nc1ccc(NC)[nH+]c1 ZINC001203449045 968440036 /nfs/dbraw/zinc/44/00/36/968440036.db2.gz XHQGIYNYIAVJRJ-UHFFFAOYSA-N 1 2 245.286 2.056 20 0 BEADLO Cc1ccc2ncc(OC3C[NH+](C)C3)cc2c1 ZINC001230524887 968466400 /nfs/dbraw/zinc/46/64/00/968466400.db2.gz WDMNSZFQWIYGAW-UHFFFAOYSA-N 1 2 228.295 2.236 20 0 BEADLO Cc1[nH+]cc(CN2CCCC[C@](C)(F)C2)n1C ZINC001206792325 968475762 /nfs/dbraw/zinc/47/57/62/968475762.db2.gz VNASEQZRGQHSBP-ZDUSSCGKSA-N 1 2 239.338 2.443 20 0 BEADLO CC(=O)[C@H]1CCCC[N@@H+]1Cc1cc(C)ccn1 ZINC001206853294 968500881 /nfs/dbraw/zinc/50/08/81/968500881.db2.gz PUOZMKXVJGYNKN-CQSZACIVSA-N 1 2 232.327 2.334 20 0 BEADLO CC(=O)[C@H]1CCCC[N@H+]1Cc1cc(C)ccn1 ZINC001206853294 968500885 /nfs/dbraw/zinc/50/08/85/968500885.db2.gz PUOZMKXVJGYNKN-CQSZACIVSA-N 1 2 232.327 2.334 20 0 BEADLO Cc1ncsc1C[N@@H+]1CCc2ncccc2C1 ZINC001206989832 968528790 /nfs/dbraw/zinc/52/87/90/968528790.db2.gz MZIFNUNVCKPDLM-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ncsc1C[N@H+]1CCc2ncccc2C1 ZINC001206989832 968528792 /nfs/dbraw/zinc/52/87/92/968528792.db2.gz MZIFNUNVCKPDLM-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000822576017 968528889 /nfs/dbraw/zinc/52/88/89/968528889.db2.gz YCGMLMRGAAGMIG-DTWKUNHWSA-N 1 2 237.347 2.325 20 0 BEADLO O=c1[nH]cccc1C[N@@H+]1Cc2cccc(F)c2C1 ZINC001207006095 968541173 /nfs/dbraw/zinc/54/11/73/968541173.db2.gz ZFDYAOYRDKHIEJ-UHFFFAOYSA-N 1 2 244.269 2.442 20 0 BEADLO O=c1[nH]cccc1C[N@H+]1Cc2cccc(F)c2C1 ZINC001207006095 968541181 /nfs/dbraw/zinc/54/11/81/968541181.db2.gz ZFDYAOYRDKHIEJ-UHFFFAOYSA-N 1 2 244.269 2.442 20 0 BEADLO C[N@@H+](Cc1ncccc1F)C[C@H]1CCCCO1 ZINC001207033569 968566298 /nfs/dbraw/zinc/56/62/98/968566298.db2.gz YWQAKBZPEMETGN-LLVKDONJSA-N 1 2 238.306 2.222 20 0 BEADLO C[N@H+](Cc1ncccc1F)C[C@H]1CCCCO1 ZINC001207033569 968566308 /nfs/dbraw/zinc/56/63/08/968566308.db2.gz YWQAKBZPEMETGN-LLVKDONJSA-N 1 2 238.306 2.222 20 0 BEADLO Cc1ncc(C[N@@H+]2CCC(=O)[C@H](C)CC2)s1 ZINC001207058178 968585020 /nfs/dbraw/zinc/58/50/20/968585020.db2.gz CKHIDPGSUAQKBC-SECBINFHSA-N 1 2 238.356 2.253 20 0 BEADLO Cc1ncc(C[N@H+]2CCC(=O)[C@H](C)CC2)s1 ZINC001207058178 968585026 /nfs/dbraw/zinc/58/50/26/968585026.db2.gz CKHIDPGSUAQKBC-SECBINFHSA-N 1 2 238.356 2.253 20 0 BEADLO Cc1ncc(C[N@@H+]2CCc3ccncc3C2)s1 ZINC001207061451 968590780 /nfs/dbraw/zinc/59/07/80/968590780.db2.gz WEGAMLJBDZUVRK-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ncc(C[N@H+]2CCc3ccncc3C2)s1 ZINC001207061451 968590785 /nfs/dbraw/zinc/59/07/85/968590785.db2.gz WEGAMLJBDZUVRK-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO CC(C)(O)CNc1ccc[nH+]c1N1CCCCC1 ZINC001252346651 968625139 /nfs/dbraw/zinc/62/51/39/968625139.db2.gz JJLKHVDUONMQAE-UHFFFAOYSA-N 1 2 249.358 2.255 20 0 BEADLO Fc1cnc(C[N@H+]2C[C@@H]3C[C@H]2C[C@H]3F)c(F)c1 ZINC001207098183 968630694 /nfs/dbraw/zinc/63/06/94/968630694.db2.gz JRCZIHYAARQNSH-UJNFCWOMSA-N 1 2 242.244 2.292 20 0 BEADLO Fc1cnc(C[N@@H+]2C[C@@H]3C[C@H]2C[C@H]3F)c(F)c1 ZINC001207098183 968630699 /nfs/dbraw/zinc/63/06/99/968630699.db2.gz JRCZIHYAARQNSH-UJNFCWOMSA-N 1 2 242.244 2.292 20 0 BEADLO Cc1cncc(C[N@H+](C)Cc2ccno2)c1 ZINC001207161841 968665651 /nfs/dbraw/zinc/66/56/51/968665651.db2.gz MJLXVKUNVFBDIM-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1cncc(C[N@@H+](C)Cc2ccno2)c1 ZINC001207161841 968665655 /nfs/dbraw/zinc/66/56/55/968665655.db2.gz MJLXVKUNVFBDIM-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO CCOc1ccc[nH+]c1NC[C@H](O)c1ccco1 ZINC001154881441 968702967 /nfs/dbraw/zinc/70/29/67/968702967.db2.gz XTQXAMOJQYHISB-JTQLQIEISA-N 1 2 248.282 2.219 20 0 BEADLO Cc1[nH]c(CNC(=O)C[C@H](C)C2CC2)[nH+]c1C ZINC000827793747 968704138 /nfs/dbraw/zinc/70/41/38/968704138.db2.gz TZWPPMCJOQIBKX-QMMMGPOBSA-N 1 2 235.331 2.079 20 0 BEADLO C[N@H+](CC(F)F)C[C@H]1CCOC(C)(C)C1 ZINC001207372520 968748396 /nfs/dbraw/zinc/74/83/96/968748396.db2.gz TTYZBJFUAKMERZ-VIFPVBQESA-N 1 2 221.291 2.389 20 0 BEADLO C[N@@H+](CC(F)F)C[C@H]1CCOC(C)(C)C1 ZINC001207372520 968748403 /nfs/dbraw/zinc/74/84/03/968748403.db2.gz TTYZBJFUAKMERZ-VIFPVBQESA-N 1 2 221.291 2.389 20 0 BEADLO Fc1ccccc1CCC[N@@H+]1CCC12COC2 ZINC001207493662 968802936 /nfs/dbraw/zinc/80/29/36/968802936.db2.gz OHZIJBCEUCOHRD-UHFFFAOYSA-N 1 2 235.302 2.233 20 0 BEADLO Fc1ccccc1CCC[N@H+]1CCC12COC2 ZINC001207493662 968802939 /nfs/dbraw/zinc/80/29/39/968802939.db2.gz OHZIJBCEUCOHRD-UHFFFAOYSA-N 1 2 235.302 2.233 20 0 BEADLO Fc1ccccc1CCC[NH+]1CC2(CCO2)C1 ZINC001207495464 968806137 /nfs/dbraw/zinc/80/61/37/968806137.db2.gz XZVDPPZNRLJIKE-UHFFFAOYSA-N 1 2 235.302 2.233 20 0 BEADLO Cn1cccc1CNc1ccc(Cl)c(N)[nH+]1 ZINC001155217487 968930930 /nfs/dbraw/zinc/93/09/30/968930930.db2.gz FYBZGYKPCKWJHC-UHFFFAOYSA-N 1 2 236.706 2.268 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1ccc[nH]c1=O ZINC001241118344 968933092 /nfs/dbraw/zinc/93/30/92/968933092.db2.gz AQDQAZQIIGTHTR-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO CC(C)Cn1ccc(-c2cc[nH+]c(N)c2)cc1=O ZINC001241170638 968943556 /nfs/dbraw/zinc/94/35/56/968943556.db2.gz TZDCZPRHGQVUAV-UHFFFAOYSA-N 1 2 243.310 2.149 20 0 BEADLO CCC[C@H](O)CNc1ccc[nH+]c1N1CCCC1 ZINC001252774866 968943729 /nfs/dbraw/zinc/94/37/29/968943729.db2.gz YZUNVZLZTLQRBD-LBPRGKRZSA-N 1 2 249.358 2.255 20 0 BEADLO CCOc1ccc(-c2cc[nH+]c(N)c2)c(C)n1 ZINC001241170108 968944602 /nfs/dbraw/zinc/94/46/02/968944602.db2.gz DTLCFPIAEGOJKK-UHFFFAOYSA-N 1 2 229.283 2.433 20 0 BEADLO Nc1cc(-c2cc(F)c3nccn3c2)cc[nH+]1 ZINC001241175862 968946445 /nfs/dbraw/zinc/94/64/45/968946445.db2.gz OQADNWHYWAWWNP-UHFFFAOYSA-N 1 2 228.230 2.118 20 0 BEADLO CCC[C@H](O)CNc1ccc(N(C)CC)[nH+]c1 ZINC001252778108 968952710 /nfs/dbraw/zinc/95/27/10/968952710.db2.gz LJXOBDINKIKEKF-LBPRGKRZSA-N 1 2 237.347 2.111 20 0 BEADLO FC1(F)CCC[N@H+](CCCn2cccn2)C1 ZINC001208082645 968984264 /nfs/dbraw/zinc/98/42/64/968984264.db2.gz OQHKCOACUZZUML-UHFFFAOYSA-N 1 2 229.274 2.004 20 0 BEADLO FC1(F)CCC[N@@H+](CCCn2cccn2)C1 ZINC001208082645 968984277 /nfs/dbraw/zinc/98/42/77/968984277.db2.gz OQHKCOACUZZUML-UHFFFAOYSA-N 1 2 229.274 2.004 20 0 BEADLO C[C@](O)(CNc1[nH+]cccc1O)c1ccccc1 ZINC001253091546 969082655 /nfs/dbraw/zinc/08/26/55/969082655.db2.gz UDHYHCCNAKOBAI-AWEZNQCLSA-N 1 2 244.294 2.107 20 0 BEADLO Fc1cccc(CC[NH+]2CC3(C2)CCCO3)c1 ZINC001208195933 969121304 /nfs/dbraw/zinc/12/13/04/969121304.db2.gz RAONFZHTAYKJAR-UHFFFAOYSA-N 1 2 235.302 2.233 20 0 BEADLO Cc1cccc(NC(=O)[C@H](C)n2cc[nH+]c2)c1O ZINC001323530551 1169933460 /nfs/dbraw/zinc/93/34/60/1169933460.db2.gz UFZQEMGHSAAHFR-JTQLQIEISA-N 1 2 245.282 2.097 20 0 BEADLO C[NH+](C)Cc1c(F)cc(-c2ncc[nH]2)cc1F ZINC001242018938 969170930 /nfs/dbraw/zinc/17/09/30/969170930.db2.gz GEUWCRIZSLBZAN-UHFFFAOYSA-N 1 2 237.253 2.417 20 0 BEADLO Cc1cc(-c2ccnnc2)cn2cc[nH+]c12 ZINC001242058341 969188393 /nfs/dbraw/zinc/18/83/93/969188393.db2.gz DLRIZHKOQPESAJ-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO F[C@H]1C[N@H+](C[C@@H]2CCC=CO2)CCC1(F)F ZINC001208876570 969266697 /nfs/dbraw/zinc/26/66/97/969266697.db2.gz KXCVWKQFLGFPIK-UWVGGRQHSA-N 1 2 235.249 2.358 20 0 BEADLO F[C@H]1C[N@@H+](C[C@@H]2CCC=CO2)CCC1(F)F ZINC001208876570 969266704 /nfs/dbraw/zinc/26/67/04/969266704.db2.gz KXCVWKQFLGFPIK-UWVGGRQHSA-N 1 2 235.249 2.358 20 0 BEADLO c1cc2c(cn1)C[N@H+](C[C@H]1CCC=CO1)C2 ZINC001208879319 969267078 /nfs/dbraw/zinc/26/70/78/969267078.db2.gz CTEBTGPZUVTQHH-CYBMUJFWSA-N 1 2 216.284 2.090 20 0 BEADLO c1cc2c(cn1)C[N@@H+](C[C@H]1CCC=CO1)C2 ZINC001208879319 969267085 /nfs/dbraw/zinc/26/70/85/969267085.db2.gz CTEBTGPZUVTQHH-CYBMUJFWSA-N 1 2 216.284 2.090 20 0 BEADLO C[N@@H+](CC(=O)c1ccccc1)C[C@H]1CCC=CO1 ZINC001208882082 969270540 /nfs/dbraw/zinc/27/05/40/969270540.db2.gz HMYIGFJMYMRUFU-CQSZACIVSA-N 1 2 245.322 2.494 20 0 BEADLO C[N@H+](CC(=O)c1ccccc1)C[C@H]1CCC=CO1 ZINC001208882082 969270548 /nfs/dbraw/zinc/27/05/48/969270548.db2.gz HMYIGFJMYMRUFU-CQSZACIVSA-N 1 2 245.322 2.494 20 0 BEADLO CC[NH+](CC)c1ccc(C)c(NCCC(N)=O)c1 ZINC001168961975 969311877 /nfs/dbraw/zinc/31/18/77/969311877.db2.gz COOOQPPIEITIDT-UHFFFAOYSA-N 1 2 249.358 2.129 20 0 BEADLO CCOc1cc(NC[C@@H](O)C(C)(C)C)cc[nH+]1 ZINC001253717430 969341442 /nfs/dbraw/zinc/34/14/42/969341442.db2.gz LBRQCKNOZXDXAF-LLVKDONJSA-N 1 2 238.331 2.299 20 0 BEADLO CCOc1cc[nH+]cc1NC[C@H](O)C(C)(C)C ZINC001253716657 969341590 /nfs/dbraw/zinc/34/15/90/969341590.db2.gz FOXCGUXXPLVFAS-LBPRGKRZSA-N 1 2 238.331 2.299 20 0 BEADLO Cn1c[nH+]c2ccc(NC[C@@H](O)C(C)(C)C)cc21 ZINC001253732950 969357327 /nfs/dbraw/zinc/35/73/27/969357327.db2.gz IOHOQYFAIPBPSY-CYBMUJFWSA-N 1 2 247.342 2.392 20 0 BEADLO Cc1[nH+]cc2n1CCN(CCc1cccs1)C2 ZINC001209222536 969408715 /nfs/dbraw/zinc/40/87/15/969408715.db2.gz JVLIKGFSVAATEH-UHFFFAOYSA-N 1 2 247.367 2.311 20 0 BEADLO COC1(C)C[NH+](CCc2ccc(F)c(F)c2)C1 ZINC001209240564 969414709 /nfs/dbraw/zinc/41/47/09/969414709.db2.gz ZXPGGSVNEVCLSB-UHFFFAOYSA-N 1 2 241.281 2.228 20 0 BEADLO C1CC1c1nnc([C@H]2CC3CC[NH+]2CC3)o1 ZINC001254037629 969454073 /nfs/dbraw/zinc/45/40/73/969454073.db2.gz MHUDJRKDQKAWOX-SNVBAGLBSA-N 1 2 219.288 2.104 20 0 BEADLO C[N@@H+]1CCCC[C@@H]1c1nnc(C2CC2)o1 ZINC001254073084 969477445 /nfs/dbraw/zinc/47/74/45/969477445.db2.gz RWLIHHBVFVVMCD-SECBINFHSA-N 1 2 207.277 2.104 20 0 BEADLO C[N@H+]1CCCC[C@@H]1c1nnc(C2CC2)o1 ZINC001254073084 969477448 /nfs/dbraw/zinc/47/74/48/969477448.db2.gz RWLIHHBVFVVMCD-SECBINFHSA-N 1 2 207.277 2.104 20 0 BEADLO c1cc2ccc(C[NH+]3CC4(CCO4)C3)cc2[nH]1 ZINC001209515366 969531502 /nfs/dbraw/zinc/53/15/02/969531502.db2.gz SWFOSPWQEBGAJL-UHFFFAOYSA-N 1 2 228.295 2.143 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CC2CCC(CC2)C1 ZINC001209558497 969542446 /nfs/dbraw/zinc/54/24/46/969542446.db2.gz KAEDVQPPHKZWOW-UHFFFAOYSA-N 1 2 219.332 2.340 20 0 BEADLO Cc1ccsc1C[N@@H+]1CCn2nccc2C1 ZINC001204023438 969556538 /nfs/dbraw/zinc/55/65/38/969556538.db2.gz GZIOYZLWQGWSGN-UHFFFAOYSA-N 1 2 233.340 2.269 20 0 BEADLO Cc1ccsc1C[N@H+]1CCn2nccc2C1 ZINC001204023438 969556546 /nfs/dbraw/zinc/55/65/46/969556546.db2.gz GZIOYZLWQGWSGN-UHFFFAOYSA-N 1 2 233.340 2.269 20 0 BEADLO Cc1[nH]c2ncccc2c1C[NH+]1CCC(=O)CC1 ZINC001209587547 969565066 /nfs/dbraw/zinc/56/50/66/969565066.db2.gz WYXSIKUHNLSQTB-UHFFFAOYSA-N 1 2 243.310 2.036 20 0 BEADLO COc1cc(C[N@@H+]2C[C@@H](F)C[C@H]2C)ccn1 ZINC001209637807 969571309 /nfs/dbraw/zinc/57/13/09/969571309.db2.gz SAMOYIGEANKNRN-KOLCDFICSA-N 1 2 224.279 2.023 20 0 BEADLO COc1cc(C[N@H+]2C[C@@H](F)C[C@H]2C)ccn1 ZINC001209637807 969571312 /nfs/dbraw/zinc/57/13/12/969571312.db2.gz SAMOYIGEANKNRN-KOLCDFICSA-N 1 2 224.279 2.023 20 0 BEADLO Fc1ccc2c(C[NH+]3CC4(CCO4)C3)c[nH]c2c1 ZINC001209691061 969575626 /nfs/dbraw/zinc/57/56/26/969575626.db2.gz BZSYSPARJRKUAH-UHFFFAOYSA-N 1 2 246.285 2.282 20 0 BEADLO CCCOC1C[NH+](Cc2ccccc2N(C)C)C1 ZINC001209778153 969610047 /nfs/dbraw/zinc/61/00/47/969610047.db2.gz SBFPJHQCXHFRGC-UHFFFAOYSA-N 1 2 248.370 2.363 20 0 BEADLO c1cc(Nc2ccc3[nH]c[nH+]c3c2)no1 ZINC001209841070 969647228 /nfs/dbraw/zinc/64/72/28/969647228.db2.gz COKLUQKIDIBXCJ-UHFFFAOYSA-N 1 2 200.201 2.295 20 0 BEADLO COc1nccc(Nc2ccc3[nH]c[nH+]c3c2)n1 ZINC001209841620 969652981 /nfs/dbraw/zinc/65/29/81/969652981.db2.gz YCXAHZVMCCCWLN-UHFFFAOYSA-N 1 2 241.254 2.105 20 0 BEADLO COc1ccc(CNc2c[nH+]cc(C)c2C)nn1 ZINC001169469475 969668149 /nfs/dbraw/zinc/66/81/49/969668149.db2.gz QTLDPICWIKLYPQ-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO COc1cc[nH+]cc1N[C@H](C)c1cnccn1 ZINC001169530068 969715332 /nfs/dbraw/zinc/71/53/32/969715332.db2.gz XFMAQSOMJKEOLY-SECBINFHSA-N 1 2 230.271 2.053 20 0 BEADLO C[C@H](Nc1ccc(N(C)C)c[nH+]1)c1cnccn1 ZINC001169533024 969723045 /nfs/dbraw/zinc/72/30/45/969723045.db2.gz KONNGDGCMQKBLO-JTQLQIEISA-N 1 2 243.314 2.111 20 0 BEADLO C[C@@H](C(=O)N1CC[C@H](C(C)(C)C)C1)n1cc[nH+]c1 ZINC001254630861 969751014 /nfs/dbraw/zinc/75/10/14/969751014.db2.gz QHJVEXJHSCHYND-RYUDHWBXSA-N 1 2 249.358 2.339 20 0 BEADLO C[C@H](C(=O)N1CC[C@@H](C(C)(C)C)C1)n1cc[nH+]c1 ZINC001254630862 969751223 /nfs/dbraw/zinc/75/12/23/969751223.db2.gz QHJVEXJHSCHYND-VXGBXAGGSA-N 1 2 249.358 2.339 20 0 BEADLO C/C(=C\C=C\[NH3+])NC(C)(C)C(=O)OC(C)(C)C ZINC001169584122 969786667 /nfs/dbraw/zinc/78/66/67/969786667.db2.gz SMDIVGDEGKHWLR-FIFLTTCUSA-N 1 2 240.347 2.073 20 0 BEADLO C[C@@H](OCC[NH+]1CCOCC1)c1cccs1 ZINC001210191744 969826052 /nfs/dbraw/zinc/82/60/52/969826052.db2.gz HTAAISQXOHATEH-LLVKDONJSA-N 1 2 241.356 2.158 20 0 BEADLO C[C@@H]1CC[C@@H](C)[C@H](OCC[NH+]2CCOCC2)C1 ZINC001210209034 969833432 /nfs/dbraw/zinc/83/34/32/969833432.db2.gz YAVJOHIJCGYRDB-MGPQQGTHSA-N 1 2 241.375 2.160 20 0 BEADLO Cc1cc(Nc2c[nH+]c(C)c(N)c2)no1 ZINC001210284161 969845293 /nfs/dbraw/zinc/84/52/93/969845293.db2.gz FSRBQFAKRLKWIW-UHFFFAOYSA-N 1 2 204.233 2.012 20 0 BEADLO Cc1[nH+]cc(Nc2ccnnc2Cl)cc1N ZINC001210287476 969847701 /nfs/dbraw/zinc/84/77/01/969847701.db2.gz VDCSWTRSRIRJLN-UHFFFAOYSA-N 1 2 235.678 2.159 20 0 BEADLO F[C@@H]1C[N@H+](C2Cc3ccccc3C2)C[C@@H]1F ZINC001255020629 969851672 /nfs/dbraw/zinc/85/16/72/969851672.db2.gz XDKXMVVZNOXMJM-BETUJISGSA-N 1 2 223.266 2.146 20 0 BEADLO F[C@@H]1C[N@@H+](C2Cc3ccccc3C2)C[C@@H]1F ZINC001255020629 969851675 /nfs/dbraw/zinc/85/16/75/969851675.db2.gz XDKXMVVZNOXMJM-BETUJISGSA-N 1 2 223.266 2.146 20 0 BEADLO Cc1[nH+]cc(-n2c(N)cc3ccccc32)cc1N ZINC001210287181 969853335 /nfs/dbraw/zinc/85/33/35/969853335.db2.gz NGZSBIMDNSVOJR-UHFFFAOYSA-N 1 2 238.294 2.498 20 0 BEADLO Cc1[nH+]cc(Nc2cnc(Cl)cc2N)cc1N ZINC001210287539 969855221 /nfs/dbraw/zinc/85/52/21/969855221.db2.gz WPRHGTYMESEZPW-UHFFFAOYSA-N 1 2 249.705 2.346 20 0 BEADLO Cc1[nH+]cc(Nc2nc(Cl)ccc2N)cc1N ZINC001210286935 969855307 /nfs/dbraw/zinc/85/53/07/969855307.db2.gz HILPVLOQJHPIGZ-UHFFFAOYSA-N 1 2 249.705 2.346 20 0 BEADLO Cc1[nH+]cc(Nc2cn3ccccc3n2)cc1N ZINC001210288415 969856833 /nfs/dbraw/zinc/85/68/33/969856833.db2.gz HUYADMINWQKDDX-UHFFFAOYSA-N 1 2 239.282 2.364 20 0 BEADLO Cc1[nH+]cc(Nc2ccccc2O)cc1N ZINC001210291233 969860194 /nfs/dbraw/zinc/86/01/94/969860194.db2.gz VSDACOOMOYJHAT-UHFFFAOYSA-N 1 2 215.256 2.421 20 0 BEADLO Cc1nc(NCc2cncnc2)cc(C(C)C)[nH+]1 ZINC001156570700 969923878 /nfs/dbraw/zinc/92/38/78/969923878.db2.gz VRNRKJYUHUDIIN-UHFFFAOYSA-N 1 2 243.314 2.311 20 0 BEADLO Cn1ccc(-c2ccc(F)c(-n3cc[nH+]c3)c2)n1 ZINC001242461134 969954381 /nfs/dbraw/zinc/95/43/81/969954381.db2.gz UBZFEZYRIYXHBA-UHFFFAOYSA-N 1 2 242.257 2.412 20 0 BEADLO CC(=O)c1cc(Nc2ccc(C)[nH+]c2C)ccn1 ZINC001210588892 969966286 /nfs/dbraw/zinc/96/62/86/969966286.db2.gz UBPPWJVRGWQYFM-UHFFFAOYSA-N 1 2 241.294 2.462 20 0 BEADLO C[C@@H]1CC[C@@H]([N@@H+]2CCOCC(F)(F)C2)C1 ZINC000339205767 970027842 /nfs/dbraw/zinc/02/78/42/970027842.db2.gz OYLPVKMVHLYWBH-NXEZZACHSA-N 1 2 219.275 2.143 20 0 BEADLO C[C@@H]1CC[C@@H]([N@H+]2CCOCC(F)(F)C2)C1 ZINC000339205767 970027849 /nfs/dbraw/zinc/02/78/49/970027849.db2.gz OYLPVKMVHLYWBH-NXEZZACHSA-N 1 2 219.275 2.143 20 0 BEADLO C[C@H]1CC[C@@H]([N@H+]2CCOCC(F)(F)C2)C1 ZINC000339205769 970028421 /nfs/dbraw/zinc/02/84/21/970028421.db2.gz OYLPVKMVHLYWBH-VHSXEESVSA-N 1 2 219.275 2.143 20 0 BEADLO C[C@H]1CC[C@@H]([N@@H+]2CCOCC(F)(F)C2)C1 ZINC000339205769 970028413 /nfs/dbraw/zinc/02/84/13/970028413.db2.gz OYLPVKMVHLYWBH-VHSXEESVSA-N 1 2 219.275 2.143 20 0 BEADLO Cc1[nH+]c2ccc(N)cc2n1-c1nccs1 ZINC001210992122 970106473 /nfs/dbraw/zinc/10/64/73/970106473.db2.gz VDXJMTHAQSITHR-UHFFFAOYSA-N 1 2 230.296 2.373 20 0 BEADLO FC(F)(F)c1c[nH+]ccc1Nc1ccncn1 ZINC001211022829 970118114 /nfs/dbraw/zinc/11/81/14/970118114.db2.gz KOOHPABFUGTRMF-UHFFFAOYSA-N 1 2 240.188 2.056 20 0 BEADLO CCOc1cc(Nc2ccncn2)cc(C)[nH+]1 ZINC001211025208 970118602 /nfs/dbraw/zinc/11/86/02/970118602.db2.gz JTRFGAZUMQHBKV-UHFFFAOYSA-N 1 2 230.271 2.322 20 0 BEADLO Cn1c[nH+]c2cc(Nc3ccncn3)ccc21 ZINC001211030185 970122956 /nfs/dbraw/zinc/12/29/56/970122956.db2.gz UIVKTGRNSPTNLS-UHFFFAOYSA-N 1 2 225.255 2.107 20 0 BEADLO CN1CCC[C@@H]([N@@H+]2Cc3cccc(F)c3C2)C1 ZINC001255489540 970240625 /nfs/dbraw/zinc/24/06/25/970240625.db2.gz PAAGYIDPYWHQSP-GFCCVEGCSA-N 1 2 234.318 2.236 20 0 BEADLO CN1CCC[C@@H]([N@H+]2Cc3cccc(F)c3C2)C1 ZINC001255489540 970240635 /nfs/dbraw/zinc/24/06/35/970240635.db2.gz PAAGYIDPYWHQSP-GFCCVEGCSA-N 1 2 234.318 2.236 20 0 BEADLO COc1cc[nH+]c(Nc2cccc(CO)c2F)c1 ZINC001211426478 970260238 /nfs/dbraw/zinc/26/02/38/970260238.db2.gz MGIOOWJCCMVESL-UHFFFAOYSA-N 1 2 248.257 2.465 20 0 BEADLO COCOc1ccc(-c2c[nH+]cn2C)cc1 ZINC001243071490 970277649 /nfs/dbraw/zinc/27/76/49/970277649.db2.gz UFGNQKCUEMFRFM-UHFFFAOYSA-N 1 2 218.256 2.070 20 0 BEADLO Cc1cc(C)c(Nc2cn(C)cn2)c[nH+]1 ZINC001213503424 970330496 /nfs/dbraw/zinc/33/04/96/970330496.db2.gz FIZUCVMAROHDRX-UHFFFAOYSA-N 1 2 202.261 2.176 20 0 BEADLO Cc1cc(C)c(Nc2ncccn2)c[nH+]1 ZINC001213503472 970330735 /nfs/dbraw/zinc/33/07/35/970330735.db2.gz IEFFFORMXILNIH-UHFFFAOYSA-N 1 2 200.245 2.232 20 0 BEADLO Cc1cc(C)c(Nc2cnns2)c[nH+]1 ZINC001213508399 970332971 /nfs/dbraw/zinc/33/29/71/970332971.db2.gz RSHRHZCCNAVLNF-UHFFFAOYSA-N 1 2 206.274 2.294 20 0 BEADLO Cc1cc(C)c(Nc2cnc3nccn3c2)c[nH+]1 ZINC001213513535 970339370 /nfs/dbraw/zinc/33/93/70/970339370.db2.gz TUJVZBOYNVGUJC-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cc1c[nH+]cc(Nc2cc(=O)[nH]c(=S)[nH]2)c1C ZINC001213525297 970344883 /nfs/dbraw/zinc/34/48/83/970344883.db2.gz QPXIEXIKUZTEGQ-UHFFFAOYSA-N 1 2 248.311 2.226 20 0 BEADLO Cc1c[nH+]cc(Nc2cncc(CO)c2)c1C ZINC001213527415 970346248 /nfs/dbraw/zinc/34/62/48/970346248.db2.gz KBAVUSHXBYTVTI-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO Cc1c[nH+]cc(Nc2cnc3cnccn32)c1C ZINC001213527646 970348613 /nfs/dbraw/zinc/34/86/13/970348613.db2.gz XDABQFLFQXFNIO-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cc1c[nH+]cc(Nc2ncccc2CO)c1C ZINC001213525487 970349755 /nfs/dbraw/zinc/34/97/55/970349755.db2.gz ZIUHVNSYPGSRGB-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO C[C@H](CC(F)(F)F)[N@@H+]1CCOC[C@@H]1C ZINC001255647522 970400574 /nfs/dbraw/zinc/40/05/74/970400574.db2.gz VRKYIKFSQXYEGE-SFYZADRCSA-N 1 2 211.227 2.048 20 0 BEADLO C[C@H](CC(F)(F)F)[N@H+]1CCOC[C@@H]1C ZINC001255647522 970400580 /nfs/dbraw/zinc/40/05/80/970400580.db2.gz VRKYIKFSQXYEGE-SFYZADRCSA-N 1 2 211.227 2.048 20 0 BEADLO CCC1(CNc2cc(COC)cc[nH+]2)COC1 ZINC001157541757 970422042 /nfs/dbraw/zinc/42/20/42/970422042.db2.gz CGMLTHXFHMFMGZ-UHFFFAOYSA-N 1 2 236.315 2.067 20 0 BEADLO C[C@@H](c1nnnn1C1CC1)[N@@H+]1CC(C)(C)C1(C)C ZINC001255733820 970465840 /nfs/dbraw/zinc/46/58/40/970465840.db2.gz PWAXHCCYZJIQPC-VIFPVBQESA-N 1 2 249.362 2.189 20 0 BEADLO C[C@@H](c1nnnn1C1CC1)[N@H+]1CC(C)(C)C1(C)C ZINC001255733820 970465847 /nfs/dbraw/zinc/46/58/47/970465847.db2.gz PWAXHCCYZJIQPC-VIFPVBQESA-N 1 2 249.362 2.189 20 0 BEADLO Cc1ccc(C[C@H](C)[NH2+]CC(=O)OC(C)C)cc1 ZINC001255772142 970474974 /nfs/dbraw/zinc/47/49/74/970474974.db2.gz FVTOAXUIAODOSY-ZDUSSCGKSA-N 1 2 249.354 2.467 20 0 BEADLO CC(C)NC(=O)[C@@H](Nc1cccc[nH+]1)C(C)C ZINC001170188554 970558479 /nfs/dbraw/zinc/55/84/79/970558479.db2.gz FVVXOJPGMAPUAL-LBPRGKRZSA-N 1 2 235.331 2.043 20 0 BEADLO CC/C=C\C[NH2+][C@H]1CCCc2[nH]ncc21 ZINC000401599151 970709408 /nfs/dbraw/zinc/70/94/08/970709408.db2.gz YYDNTAYCXFZATD-BYCRGOAPSA-N 1 2 205.305 2.343 20 0 BEADLO COc1ccc([C@@H](C)OCc2c[nH+]cn2C)cn1 ZINC001222595107 972590638 /nfs/dbraw/zinc/59/06/38/972590638.db2.gz OTYPVSMHYYMBGL-SNVBAGLBSA-N 1 2 247.298 2.102 20 0 BEADLO C[C@@H](OCc1c[nH+]cn1C)c1ccncc1 ZINC001222594975 972594112 /nfs/dbraw/zinc/59/41/12/972594112.db2.gz KLEHGZXLEUKBJR-SNVBAGLBSA-N 1 2 217.272 2.093 20 0 BEADLO CC(=O)[C@@H](OCc1c[nH+]cn1C)c1ccccc1 ZINC001222600415 972597244 /nfs/dbraw/zinc/59/72/44/972597244.db2.gz OPDNZUWRIMUUSU-CQSZACIVSA-N 1 2 244.294 2.267 20 0 BEADLO CCCC(=O)[C@H](CCC)OCc1c[nH+]cn1C ZINC001222595284 972599941 /nfs/dbraw/zinc/59/99/41/972599941.db2.gz VUUMEFJCWDTCRS-ZDUSSCGKSA-N 1 2 238.331 2.475 20 0 BEADLO C[C@@H](OCc1c[nH+]cn1C)c1ccco1 ZINC001222600115 972601405 /nfs/dbraw/zinc/60/14/05/972601405.db2.gz JVUUOYBDAZVFAO-SECBINFHSA-N 1 2 206.245 2.291 20 0 BEADLO C[C@H](OCc1c[nH+]cn1C)c1ccncc1F ZINC001222600911 972602010 /nfs/dbraw/zinc/60/20/10/972602010.db2.gz VAZQKGKDXDQURI-VIFPVBQESA-N 1 2 235.262 2.232 20 0 BEADLO Oc1ccc(C[NH+]2CC3(C2)CC(F)(F)C3)nc1 ZINC001144252876 972718775 /nfs/dbraw/zinc/71/87/75/972718775.db2.gz BCZQPRDBUJTPFZ-UHFFFAOYSA-N 1 2 240.253 2.018 20 0 BEADLO CC(C)C[C@@H](C)c1nnc(C[NH+](C)C)o1 ZINC001327935498 972819829 /nfs/dbraw/zinc/81/98/29/972819829.db2.gz QXPDZHXJAIZJGE-SECBINFHSA-N 1 2 211.309 2.281 20 0 BEADLO COc1ccc(C[N@@H+]2C[C@H](F)C[C@H]2C)nc1 ZINC001144420097 972815020 /nfs/dbraw/zinc/81/50/20/972815020.db2.gz VCMPMOUMRVAUHC-NXEZZACHSA-N 1 2 224.279 2.023 20 0 BEADLO COc1ccc(C[N@H+]2C[C@H](F)C[C@H]2C)nc1 ZINC001144420097 972815025 /nfs/dbraw/zinc/81/50/25/972815025.db2.gz VCMPMOUMRVAUHC-NXEZZACHSA-N 1 2 224.279 2.023 20 0 BEADLO O=C(Cc1cn2c([nH+]1)CCCC2)OCC1CCC1 ZINC000845475344 972824229 /nfs/dbraw/zinc/82/42/29/972824229.db2.gz DYXUDNYZBHBZOA-UHFFFAOYSA-N 1 2 248.326 2.105 20 0 BEADLO CC1(C)C[NH+](Cc2ncn3ccccc23)C1 ZINC001144611921 972892236 /nfs/dbraw/zinc/89/22/36/972892236.db2.gz XEXLEAMMKKRIOV-UHFFFAOYSA-N 1 2 215.300 2.176 20 0 BEADLO F[C@@H]1C[C@@H]2C[C@H]1CN2Cc1[nH+]cn2ccccc12 ZINC001144623436 972895287 /nfs/dbraw/zinc/89/52/87/972895287.db2.gz WKVKGLVIELBFRP-SDDRHHMPSA-N 1 2 245.301 2.267 20 0 BEADLO CCC[C@H]1CC[C@H](C(=O)NC2C[NH+](C)C2)CC1 ZINC001144642268 972917853 /nfs/dbraw/zinc/91/78/53/972917853.db2.gz CEMKWASNXLEXLD-HAQNSBGRSA-N 1 2 238.375 2.023 20 0 BEADLO c1nc2cc(C[N@@H+]3C[C@@H]4C[C@H]3CO4)ccc2s1 ZINC001144739265 972979039 /nfs/dbraw/zinc/97/90/39/972979039.db2.gz ZCKIEDSCBZLNPD-QWRGUYRKSA-N 1 2 246.335 2.269 20 0 BEADLO c1nc2cc(C[N@H+]3C[C@@H]4C[C@H]3CO4)ccc2s1 ZINC001144739265 972979051 /nfs/dbraw/zinc/97/90/51/972979051.db2.gz ZCKIEDSCBZLNPD-QWRGUYRKSA-N 1 2 246.335 2.269 20 0 BEADLO COCC[N@H+](C)Cc1c(F)ccc(F)c1OC ZINC001144744835 972979199 /nfs/dbraw/zinc/97/91/99/972979199.db2.gz HHGVXRWNYCXMHV-UHFFFAOYSA-N 1 2 245.269 2.052 20 0 BEADLO CC[NH+]1CC(OCc2ncc(C(C)(C)C)o2)C1 ZINC001223414481 973042738 /nfs/dbraw/zinc/04/27/38/973042738.db2.gz GVVYHTOQDQGXPO-UHFFFAOYSA-N 1 2 238.331 2.193 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnsn2)CC(C)(C)C1 ZINC000846851358 973047515 /nfs/dbraw/zinc/04/75/15/973047515.db2.gz QXMNKCWSGBDJFA-VIFPVBQESA-N 1 2 225.361 2.406 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnsn2)CC(C)(C)C1 ZINC000846851358 973047521 /nfs/dbraw/zinc/04/75/21/973047521.db2.gz QXMNKCWSGBDJFA-VIFPVBQESA-N 1 2 225.361 2.406 20 0 BEADLO C[C@H]1CC[C@@H](Cc2nnc(C[NH+](C)C)o2)C1 ZINC001328433441 973056251 /nfs/dbraw/zinc/05/62/51/973056251.db2.gz MNXDNSICQWMKDJ-VHSXEESVSA-N 1 2 223.320 2.110 20 0 BEADLO CCCN(CCC)C(=O)CN(C)c1cccc[nH+]1 ZINC001160855701 973084429 /nfs/dbraw/zinc/08/44/29/973084429.db2.gz AQFHPTUDACUJPZ-UHFFFAOYSA-N 1 2 249.358 2.166 20 0 BEADLO Cc1cccnc1C[NH2+]Cc1ncccc1F ZINC001328659785 973236928 /nfs/dbraw/zinc/23/69/28/973236928.db2.gz OEHYSQXPKFDFRP-UHFFFAOYSA-N 1 2 231.274 2.214 20 0 BEADLO C[C@H](C(=O)N1[C@@H]2CC[C@H]1CC(C)C2)n1cc[nH+]c1 ZINC001328844243 973372164 /nfs/dbraw/zinc/37/21/64/973372164.db2.gz PVROKKMNSLLKAF-HYWTVENDSA-N 1 2 247.342 2.234 20 0 BEADLO Cc1ccc2cc(COC3C[NH+](C)C3)ccc2n1 ZINC001223985808 973376505 /nfs/dbraw/zinc/37/65/05/973376505.db2.gz PAKCKDCNQQGOJI-UHFFFAOYSA-N 1 2 242.322 2.374 20 0 BEADLO C[C@H](C(=O)NCC[C@@H]1CC=CCC1)n1cc[nH+]c1 ZINC001329182989 973548267 /nfs/dbraw/zinc/54/82/67/973548267.db2.gz FUROLROQQUXEKA-CHWSQXEVSA-N 1 2 247.342 2.307 20 0 BEADLO COc1cc([NH2+]CC[C@@H]2CCOC2)ccc1N ZINC000234903637 973784580 /nfs/dbraw/zinc/78/45/80/973784580.db2.gz RLDLIKYLIYFQJR-SNVBAGLBSA-N 1 2 236.315 2.116 20 0 BEADLO Cc1cc(C[NH+]2CC(C)(CC(F)F)C2)[nH]n1 ZINC001329506088 973804726 /nfs/dbraw/zinc/80/47/26/973804726.db2.gz DUVPNSWMVHSIMY-UHFFFAOYSA-N 1 2 229.274 2.195 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)C1CCC(C)(C)CC1 ZINC001329877368 973995747 /nfs/dbraw/zinc/99/57/47/973995747.db2.gz QWBXTMQMZPRNOY-UHFFFAOYSA-N 1 2 222.336 2.205 20 0 BEADLO CC[C@H](C)[C@@H](C)[N@@H+]1CC[C@H](O)C(F)(F)C1 ZINC001171847474 974209904 /nfs/dbraw/zinc/20/99/04/974209904.db2.gz MFRUOJLVQLRPLN-AEJSXWLSSA-N 1 2 221.291 2.123 20 0 BEADLO CC[C@H](C)[C@@H](C)[N@H+]1CC[C@H](O)C(F)(F)C1 ZINC001171847474 974209921 /nfs/dbraw/zinc/20/99/21/974209921.db2.gz MFRUOJLVQLRPLN-AEJSXWLSSA-N 1 2 221.291 2.123 20 0 BEADLO C[NH+]1CC(Oc2ccccc2C(F)(F)F)C1 ZINC001225218161 974251253 /nfs/dbraw/zinc/25/12/53/974251253.db2.gz VGLJMBKTHTXPKK-UHFFFAOYSA-N 1 2 231.217 2.398 20 0 BEADLO CC[NH+]1CC(Oc2ccc(C)cc2OC)C1 ZINC001225260022 974321943 /nfs/dbraw/zinc/32/19/43/974321943.db2.gz IOJKMWMVCVRGRY-UHFFFAOYSA-N 1 2 221.300 2.087 20 0 BEADLO c1ccc2c(c1)OC[C@@H](COc1cc[nH+]cc1)O2 ZINC001225291240 974365426 /nfs/dbraw/zinc/36/54/26/974365426.db2.gz QNYGCGCZSSSHID-GFCCVEGCSA-N 1 2 243.262 2.300 20 0 BEADLO COC1(C[N@@H+]2CCCC(F)(F)C2)CCC1 ZINC001330638451 974378016 /nfs/dbraw/zinc/37/80/16/974378016.db2.gz GQGAWRCZLSJTTD-UHFFFAOYSA-N 1 2 219.275 2.287 20 0 BEADLO COC1(C[N@H+]2CCCC(F)(F)C2)CCC1 ZINC001330638451 974378027 /nfs/dbraw/zinc/37/80/27/974378027.db2.gz GQGAWRCZLSJTTD-UHFFFAOYSA-N 1 2 219.275 2.287 20 0 BEADLO CNc1cc(NC2CCC=CCC2)[nH+]cn1 ZINC001335072600 1169978383 /nfs/dbraw/zinc/97/83/83/1169978383.db2.gz DARAGTONRRGHMB-UHFFFAOYSA-N 1 2 218.304 2.429 20 0 BEADLO COC(=O)C1([NH2+][C@@H]2CC[C@H](C)[C@H](C)C2)CC1 ZINC001172361482 974632104 /nfs/dbraw/zinc/63/21/04/974632104.db2.gz XJZBPKHRPSJKST-HBNTYKKESA-N 1 2 225.332 2.106 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OCC[C@H]1CCOC1 ZINC001331257686 974664025 /nfs/dbraw/zinc/66/40/25/974664025.db2.gz JQTPSRRHQNHIMG-GFCCVEGCSA-N 1 2 248.326 2.268 20 0 BEADLO CC(C)OCC[C@H](C)[NH2+][C@@H](C)C(=O)OC(C)C ZINC001172434347 974723395 /nfs/dbraw/zinc/72/33/95/974723395.db2.gz OKYOCOXAQQAEKX-RYUDHWBXSA-N 1 2 245.363 2.120 20 0 BEADLO CC[C@@H](CC(C)C)[NH2+]C1(C(=O)OC)CC1 ZINC001172384301 974728489 /nfs/dbraw/zinc/72/84/89/974728489.db2.gz GTCVZOGPUCJVIU-JTQLQIEISA-N 1 2 213.321 2.106 20 0 BEADLO C[NH+]1CC(Oc2ccnc3c(F)cccc23)C1 ZINC001225928157 974733771 /nfs/dbraw/zinc/73/37/71/974733771.db2.gz MTEJEYPEYJVXCL-UHFFFAOYSA-N 1 2 232.258 2.067 20 0 BEADLO COC(=O)C[NH2+][C@@H]1CC[C@@H](c2ccccc2)C1 ZINC001172546234 974880055 /nfs/dbraw/zinc/88/00/55/974880055.db2.gz LBIJUQTZTJWPTJ-CHWSQXEVSA-N 1 2 233.311 2.085 20 0 BEADLO Cc1nc([C@@H](C)[NH2+]CC2=CCCC2)no1 ZINC001332126162 974964401 /nfs/dbraw/zinc/96/44/01/974964401.db2.gz XHJRBXBEIIVLIR-MRVPVSSYSA-N 1 2 207.277 2.139 20 0 BEADLO CO[C@@H]1CCC[C@@H]([N@H+](C)CC(F)F)C1 ZINC001172947789 975003647 /nfs/dbraw/zinc/00/36/47/975003647.db2.gz AUMIBKWEKRPGTF-RKDXNWHRSA-N 1 2 207.264 2.141 20 0 BEADLO CO[C@@H]1CCC[C@@H]([N@@H+](C)CC(F)F)C1 ZINC001172947789 975003653 /nfs/dbraw/zinc/00/36/53/975003653.db2.gz AUMIBKWEKRPGTF-RKDXNWHRSA-N 1 2 207.264 2.141 20 0 BEADLO Cc1ccc(N[C@@H](C)c2cc(CO)on2)c(C)[nH+]1 ZINC001332432949 975115962 /nfs/dbraw/zinc/11/59/62/975115962.db2.gz AIWYSOUHIUHXRG-JTQLQIEISA-N 1 2 247.298 2.352 20 0 BEADLO CC(=O)Cc1ccc(OC2C[NH+](C(C)C)C2)cc1 ZINC001226846892 975121172 /nfs/dbraw/zinc/12/11/72/975121172.db2.gz KONBAYPKMJZYTA-UHFFFAOYSA-N 1 2 247.338 2.290 20 0 BEADLO CC(C)[NH+]1CC(Oc2nc3ccccc3o2)C1 ZINC001226907602 975143784 /nfs/dbraw/zinc/14/37/84/975143784.db2.gz WDFKRAIGKYZWAM-UHFFFAOYSA-N 1 2 232.283 2.299 20 0 BEADLO Cc1cc(OC2C[NH+](C)C2)nc2ccccc12 ZINC001227049382 975235962 /nfs/dbraw/zinc/23/59/62/975235962.db2.gz QKHAHJDWKNWVTM-UHFFFAOYSA-N 1 2 228.295 2.236 20 0 BEADLO C[C@H](c1ncccn1)[N@@H+]1CC[C@@H](C(F)(F)F)C1 ZINC001332698002 975254999 /nfs/dbraw/zinc/25/49/99/975254999.db2.gz HMZMCQKLEOTVQO-RKDXNWHRSA-N 1 2 245.248 2.422 20 0 BEADLO CC[NH+]1CC(Oc2c(C)cccc2OC)C1 ZINC001227162383 975299546 /nfs/dbraw/zinc/29/95/46/975299546.db2.gz NGGBVPZZADTFGF-UHFFFAOYSA-N 1 2 221.300 2.087 20 0 BEADLO COC(=O)CCCC[C@@H](C)[N@H+](C)CC(F)F ZINC001173457827 975393756 /nfs/dbraw/zinc/39/37/56/975393756.db2.gz CHIVWXBDNOYATD-SECBINFHSA-N 1 2 237.290 2.305 20 0 BEADLO COC(=O)CCCC[C@@H](C)[N@@H+](C)CC(F)F ZINC001173457827 975393761 /nfs/dbraw/zinc/39/37/61/975393761.db2.gz CHIVWXBDNOYATD-SECBINFHSA-N 1 2 237.290 2.305 20 0 BEADLO CC[NH+]1CC(Oc2cnccc2C(F)(F)F)C1 ZINC001227708104 975627246 /nfs/dbraw/zinc/62/72/46/975627246.db2.gz VFABDPJRBCRKLX-UHFFFAOYSA-N 1 2 246.232 2.183 20 0 BEADLO CC[C@H](C)[C@H](C)[N@H+](Cc1nnc[nH]1)C1CC1 ZINC001333583190 975866234 /nfs/dbraw/zinc/86/62/34/975866234.db2.gz QCYKTEYFRJCAIN-UWVGGRQHSA-N 1 2 222.336 2.204 20 0 BEADLO CC[C@H](C)[C@H](C)[N@@H+](Cc1nnc[nH]1)C1CC1 ZINC001333583190 975866239 /nfs/dbraw/zinc/86/62/39/975866239.db2.gz QCYKTEYFRJCAIN-UWVGGRQHSA-N 1 2 222.336 2.204 20 0 BEADLO CC1(C)CCC[C@@H]1[C@@H]1CC[N@H+](Cc2nnc[nH]2)C1 ZINC001333607419 975887809 /nfs/dbraw/zinc/88/78/09/975887809.db2.gz VJJVVEDEBMLCCP-VXGBXAGGSA-N 1 2 248.374 2.453 20 0 BEADLO CC1(C)CCC[C@@H]1[C@@H]1CC[N@@H+](Cc2nnc[nH]2)C1 ZINC001333607419 975887813 /nfs/dbraw/zinc/88/78/13/975887813.db2.gz VJJVVEDEBMLCCP-VXGBXAGGSA-N 1 2 248.374 2.453 20 0 BEADLO CC[C@@H](CSC)Nc1cc(N(C)C)nc[nH+]1 ZINC001333739442 976051428 /nfs/dbraw/zinc/05/14/28/976051428.db2.gz IIJNJMHKYZKGHV-VIFPVBQESA-N 1 2 240.376 2.096 20 0 BEADLO CC[C@@H](CSC)Nc1cc(N(C)C)[nH+]cn1 ZINC001333739442 976051440 /nfs/dbraw/zinc/05/14/40/976051440.db2.gz IIJNJMHKYZKGHV-VIFPVBQESA-N 1 2 240.376 2.096 20 0 BEADLO Cc1cc(NC/C=C\CO)nc(C2CCC2)[nH+]1 ZINC001333823316 976108551 /nfs/dbraw/zinc/10/85/51/976108551.db2.gz RCWOXRSOPSOVNX-IHWYPQMZSA-N 1 2 233.315 2.013 20 0 BEADLO CNc1cc(N[C@@H](C)c2cncs2)nc[nH+]1 ZINC001333873843 976136382 /nfs/dbraw/zinc/13/63/82/976136382.db2.gz QYNICHNMZCGXIO-ZETCQYMHSA-N 1 2 235.316 2.148 20 0 BEADLO CNc1cc(N[C@@H](C)c2cncs2)[nH+]cn1 ZINC001333873843 976136389 /nfs/dbraw/zinc/13/63/89/976136389.db2.gz QYNICHNMZCGXIO-ZETCQYMHSA-N 1 2 235.316 2.148 20 0 BEADLO Cc1cnc(N[C@@H]2CCN(c3cccc[nH+]3)C2)o1 ZINC001333926304 976167230 /nfs/dbraw/zinc/16/72/30/976167230.db2.gz LGKKHCLHRQMUGL-LLVKDONJSA-N 1 2 244.298 2.069 20 0 BEADLO Cc1cc[nH+]c(Nc2cccc(C(N)=O)c2)c1 ZINC001174056588 976205556 /nfs/dbraw/zinc/20/55/56/976205556.db2.gz OWSNMZPNUNNGDY-UHFFFAOYSA-N 1 2 227.267 2.233 20 0 BEADLO Cc1ccc(Nc2cccc(C(N)=O)c2)[nH+]c1 ZINC001174056377 976206154 /nfs/dbraw/zinc/20/61/54/976206154.db2.gz JCWWCGNRDGWWAQ-UHFFFAOYSA-N 1 2 227.267 2.233 20 0 BEADLO COc1ncc(Nc2[nH+]c(C)ccc2C)cn1 ZINC001174033707 976236714 /nfs/dbraw/zinc/23/67/14/976236714.db2.gz SKKGSHWYBBCZOJ-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO Cc1cc(OC2C[NH+](C)C2)c2cccc(F)c2n1 ZINC001228491543 976261523 /nfs/dbraw/zinc/26/15/23/976261523.db2.gz QBDXMBXYJBVQGU-UHFFFAOYSA-N 1 2 246.285 2.375 20 0 BEADLO CC[NH+]1CC(Oc2cnc(Cl)cc2C)C1 ZINC001228531026 976291249 /nfs/dbraw/zinc/29/12/49/976291249.db2.gz RKQNCANFHHFEQF-UHFFFAOYSA-N 1 2 226.707 2.126 20 0 BEADLO CCN(Cc1ccoc1)c1cc(N(C)C)[nH+]cn1 ZINC001334140423 976331234 /nfs/dbraw/zinc/33/12/34/976331234.db2.gz JLJPOLSJYZXHTJ-UHFFFAOYSA-N 1 2 246.314 2.162 20 0 BEADLO CCN(Cc1ccoc1)c1cc(N(C)C)nc[nH+]1 ZINC001334140423 976331260 /nfs/dbraw/zinc/33/12/60/976331260.db2.gz JLJPOLSJYZXHTJ-UHFFFAOYSA-N 1 2 246.314 2.162 20 0 BEADLO COc1cc[nH+]cc1Nc1c(C)n[nH]c1C ZINC001174215855 976404846 /nfs/dbraw/zinc/40/48/46/976404846.db2.gz LXSVRFAZCJHFAS-UHFFFAOYSA-N 1 2 218.260 2.174 20 0 BEADLO CCc1cc(N[C@H](CC)[C@@H](C)O)nc(CC)[nH+]1 ZINC001334265153 976414884 /nfs/dbraw/zinc/41/48/84/976414884.db2.gz QFEJPBWOIMYQPW-MWLCHTKSSA-N 1 2 237.347 2.173 20 0 BEADLO Cc1nn(C)c(C)c1Nc1cccc2[nH+]ccn21 ZINC001174224430 976419341 /nfs/dbraw/zinc/41/93/41/976419341.db2.gz XRCDMYYDKRMPEK-UHFFFAOYSA-N 1 2 241.298 2.428 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1C=C[C@H]2C[C@@H]1CO2 ZINC001334322584 976447581 /nfs/dbraw/zinc/44/75/81/976447581.db2.gz XKXBBKNRGAZPQC-TUAOUCFPSA-N 1 2 246.310 2.093 20 0 BEADLO Cc1[nH+]c2ccc(N)cc2n1-c1cncc(F)c1 ZINC001174291234 976459742 /nfs/dbraw/zinc/45/97/42/976459742.db2.gz RZLSDSPFTVJHAA-UHFFFAOYSA-N 1 2 242.257 2.450 20 0 BEADLO CCc1[nH+]ccc(C)c1Nc1cn[nH]c1 ZINC001174295389 976477196 /nfs/dbraw/zinc/47/71/96/976477196.db2.gz ZENJILQXDSYEDI-UHFFFAOYSA-N 1 2 202.261 2.419 20 0 BEADLO Cc1cc(C)c(Nc2cnn(C)c2)c[nH+]1 ZINC001174328944 976531701 /nfs/dbraw/zinc/53/17/01/976531701.db2.gz UMPPVRWFPIMNFO-UHFFFAOYSA-N 1 2 202.261 2.176 20 0 BEADLO CCN(C)c1ccc(Nc2cnn(C)c2)c[nH+]1 ZINC001174331416 976541639 /nfs/dbraw/zinc/54/16/39/976541639.db2.gz RFHOAKDIGGXFAH-UHFFFAOYSA-N 1 2 231.303 2.015 20 0 BEADLO CCOc1cc[nH+]cc1Nc1cn(C)nc1C ZINC001174333276 976549418 /nfs/dbraw/zinc/54/94/18/976549418.db2.gz JQIAPIAQRUQGJM-UHFFFAOYSA-N 1 2 232.287 2.266 20 0 BEADLO CC[C@](C)(NC(=O)[C@H](C)n1cc[nH+]c1)C1CC1 ZINC001334566636 976555820 /nfs/dbraw/zinc/55/58/20/976555820.db2.gz RRRYWIWXEFIDBM-GWCFXTLKSA-N 1 2 235.331 2.139 20 0 BEADLO CC[NH+]1CC(Oc2cnc3ccsc3c2)C1 ZINC001228895983 976563562 /nfs/dbraw/zinc/56/35/62/976563562.db2.gz RCBFQRLHGKRLKB-UHFFFAOYSA-N 1 2 234.324 2.379 20 0 BEADLO CS[C@@H]1CC[C@H]([N@H+](C)Cc2nncs2)C1 ZINC001334603000 976566758 /nfs/dbraw/zinc/56/67/58/976566758.db2.gz JYNBQXOYEZXATO-DTWKUNHWSA-N 1 2 243.401 2.254 20 0 BEADLO CS[C@@H]1CC[C@H]([N@@H+](C)Cc2nncs2)C1 ZINC001334603000 976566763 /nfs/dbraw/zinc/56/67/63/976566763.db2.gz JYNBQXOYEZXATO-DTWKUNHWSA-N 1 2 243.401 2.254 20 0 BEADLO Cc1ccc(Nc2cncnc2)c(C)[nH+]1 ZINC001174385713 976628302 /nfs/dbraw/zinc/62/83/02/976628302.db2.gz VFCGJNYNHUCIRC-UHFFFAOYSA-N 1 2 200.245 2.232 20 0 BEADLO Cc1n[nH]cc1Nc1ccc[nH+]c1N1CCCC1 ZINC001174469692 976773006 /nfs/dbraw/zinc/77/30/06/976773006.db2.gz FWXWFEFBZAJKTJ-UHFFFAOYSA-N 1 2 243.314 2.457 20 0 BEADLO Cc1n[nH]cc1Nc1cccn2cc[nH+]c12 ZINC001174470165 976773062 /nfs/dbraw/zinc/77/30/62/976773062.db2.gz LTRYBPLYGMDNBQ-UHFFFAOYSA-N 1 2 213.244 2.109 20 0 BEADLO Cc1c[nH+]ccc1-n1[nH]c(=O)c2ccc(N)cc21 ZINC001174538872 976827240 /nfs/dbraw/zinc/82/72/40/976827240.db2.gz QKDNCKFSCMZXCU-UHFFFAOYSA-N 1 2 240.266 2.017 20 0 BEADLO CC(C)=CNc1ccc(N2CCC(O)CC2)[nH+]c1 ZINC001174554141 976855744 /nfs/dbraw/zinc/85/57/44/976855744.db2.gz IJNCKTIRGZPTNQ-UHFFFAOYSA-N 1 2 247.342 2.378 20 0 BEADLO CC(C)=CNc1ccc(N2CCOCC2)[nH+]c1 ZINC001174558093 976869329 /nfs/dbraw/zinc/86/93/29/976869329.db2.gz TURMEOOXNDSCES-UHFFFAOYSA-N 1 2 233.315 2.254 20 0 BEADLO CCn1cc(Nc2cc(OC)cc[nH+]2)cn1 ZINC001174566296 976881412 /nfs/dbraw/zinc/88/14/12/976881412.db2.gz MBYPHJDOWVFPBX-UHFFFAOYSA-N 1 2 218.260 2.050 20 0 BEADLO C[C@H](C(=O)NC(C)(C)/C=C\Cl)n1cc[nH+]c1 ZINC001335323988 976961954 /nfs/dbraw/zinc/96/19/54/976961954.db2.gz LUNFLYPCLBRSHH-XRVBUDJMSA-N 1 2 241.722 2.091 20 0 BEADLO COc1ccc(OC2C[NH+](C(C)C)C2)c(F)c1 ZINC001229996490 977053861 /nfs/dbraw/zinc/05/38/61/977053861.db2.gz KLLFNFPJTBRJAK-UHFFFAOYSA-N 1 2 239.290 2.306 20 0 BEADLO Cc1cc(Nc2ccn3cc[nH+]c3c2)n(C)n1 ZINC001174820604 977073588 /nfs/dbraw/zinc/07/35/88/977073588.db2.gz NNSPJXNAJRBSOD-UHFFFAOYSA-N 1 2 227.271 2.120 20 0 BEADLO Cc1cc(Nc2[nH+]cc(C)cc2C)n(C)n1 ZINC001174822002 977076949 /nfs/dbraw/zinc/07/69/49/977076949.db2.gz KKGRQSDOUASRDJ-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO C[C@H](Nc1cc(CO)cc[nH+]1)c1cncs1 ZINC001335566335 977144978 /nfs/dbraw/zinc/14/49/78/977144978.db2.gz UWSRTWARQLYFEO-QMMMGPOBSA-N 1 2 235.312 2.204 20 0 BEADLO C[C@@H](Nc1cc(CO)cc[nH+]1)c1cncs1 ZINC001335566334 977146883 /nfs/dbraw/zinc/14/68/83/977146883.db2.gz UWSRTWARQLYFEO-MRVPVSSYSA-N 1 2 235.312 2.204 20 0 BEADLO CC(C)[NH+]1CC(Oc2cc(F)ccc2O)C1 ZINC001230291789 977170045 /nfs/dbraw/zinc/17/00/45/977170045.db2.gz UZKVKMXLJVGTAJ-UHFFFAOYSA-N 1 2 225.263 2.003 20 0 BEADLO C[NH+]1CC(Oc2cnc3ccc(F)cc3c2)C1 ZINC001230590724 977260718 /nfs/dbraw/zinc/26/07/18/977260718.db2.gz HTRWNQQICPEREK-UHFFFAOYSA-N 1 2 232.258 2.067 20 0 BEADLO Cn1c[nH+]c2cc(Nc3ccncc3F)ccc21 ZINC001175197859 977299128 /nfs/dbraw/zinc/29/91/28/977299128.db2.gz AQXWYLHQFPKTRX-UHFFFAOYSA-N 1 2 242.257 2.273 20 0 BEADLO CCn1ncc(Nc2ccc(N(C)C)[nH+]c2)c1C ZINC001175339163 977387166 /nfs/dbraw/zinc/38/71/66/977387166.db2.gz ZPIVUNUOTDDVJD-UHFFFAOYSA-N 1 2 245.330 2.416 20 0 BEADLO CN(C)c1ccc(Nc2cnncc2Cl)c[nH+]1 ZINC001175341100 977388062 /nfs/dbraw/zinc/38/80/62/977388062.db2.gz PGIIPSGFFKJSME-UHFFFAOYSA-N 1 2 249.705 2.335 20 0 BEADLO COc1cc[nH+]cc1Nc1ccc(N(C)C)nc1 ZINC001175338837 977388588 /nfs/dbraw/zinc/38/85/88/977388588.db2.gz NEYPTKHAPKCNRR-UHFFFAOYSA-N 1 2 244.298 2.295 20 0 BEADLO CC(=O)[C@H](C)Oc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001231081873 977470629 /nfs/dbraw/zinc/47/06/29/977470629.db2.gz OWLYVTUHODMBQR-JTQLQIEISA-N 1 2 230.267 2.433 20 0 BEADLO CC[NH+]1CC(Oc2cnc3cccc(F)c3c2)C1 ZINC001231133765 977497157 /nfs/dbraw/zinc/49/71/57/977497157.db2.gz XSIWTAGFGDJMEM-UHFFFAOYSA-N 1 2 246.285 2.457 20 0 BEADLO CC[NH+]1CC(Oc2cnc3cc(F)ccc3c2)C1 ZINC001231135815 977503190 /nfs/dbraw/zinc/50/31/90/977503190.db2.gz QYQJLOIMDMWVFN-UHFFFAOYSA-N 1 2 246.285 2.457 20 0 BEADLO C[C@H](CC(=O)N[C@H](C)C1(C)CC1)n1cc[nH+]c1 ZINC001336207550 977570398 /nfs/dbraw/zinc/57/03/98/977570398.db2.gz SLWDYRBFOWAGIW-GHMZBOCLSA-N 1 2 235.331 2.139 20 0 BEADLO C[N@@H+]1CCCC(=Nc2cc(C(F)(F)F)no2)C1 ZINC001175574400 977571730 /nfs/dbraw/zinc/57/17/30/977571730.db2.gz VADXKQKOEBDFLK-UHFFFAOYSA-N 1 2 247.220 2.325 20 0 BEADLO C[N@H+]1CCCC(=Nc2cc(C(F)(F)F)no2)C1 ZINC001175574400 977571735 /nfs/dbraw/zinc/57/17/35/977571735.db2.gz VADXKQKOEBDFLK-UHFFFAOYSA-N 1 2 247.220 2.325 20 0 BEADLO Cc1ccc(F)c(N=C2CCC[N@@H+](C)C2)n1 ZINC001175577720 977587386 /nfs/dbraw/zinc/58/73/86/977587386.db2.gz VXTDJBPPNBLKBH-UHFFFAOYSA-N 1 2 221.279 2.160 20 0 BEADLO Cc1ccc(F)c(N=C2CCC[N@H+](C)C2)n1 ZINC001175577720 977587393 /nfs/dbraw/zinc/58/73/93/977587393.db2.gz VXTDJBPPNBLKBH-UHFFFAOYSA-N 1 2 221.279 2.160 20 0 BEADLO CC(C)Oc1ccc(C[N@H+](C)CCF)cn1 ZINC001231537224 977627101 /nfs/dbraw/zinc/62/71/01/977627101.db2.gz OOLJADUMVXQXGX-UHFFFAOYSA-N 1 2 226.295 2.270 20 0 BEADLO CC(C)Oc1ccc(C[N@@H+](C)CCF)cn1 ZINC001231537224 977627108 /nfs/dbraw/zinc/62/71/08/977627108.db2.gz OOLJADUMVXQXGX-UHFFFAOYSA-N 1 2 226.295 2.270 20 0 BEADLO C(c1nc2c(s1)CCCC2)[NH+]1CCC1 ZINC001231578753 977633885 /nfs/dbraw/zinc/63/38/85/977633885.db2.gz SPNVXUDRCUEJCK-UHFFFAOYSA-N 1 2 208.330 2.228 20 0 BEADLO Cc1ccc(Nc2cnc(N)nc2C)c(C)[nH+]1 ZINC001175664037 977641632 /nfs/dbraw/zinc/64/16/32/977641632.db2.gz TWCUBDHHCMIPJN-UHFFFAOYSA-N 1 2 229.287 2.123 20 0 BEADLO Nc1cc(C(F)(F)F)c(Nc2ccno2)c[nH+]1 ZINC001175709824 977692050 /nfs/dbraw/zinc/69/20/50/977692050.db2.gz LWJJBLFEKQGUAI-UHFFFAOYSA-N 1 2 244.176 2.414 20 0 BEADLO CCc1ccc(N2CC[C@H](COC)C2)[nH+]c1 ZINC001336517734 977744787 /nfs/dbraw/zinc/74/47/87/977744787.db2.gz AMDUUWDXIVEHKD-LBPRGKRZSA-N 1 2 220.316 2.117 20 0 BEADLO CSc1ccccc1C[NH+]1CC2(CCO2)C1 ZINC001231785589 977747745 /nfs/dbraw/zinc/74/77/45/977747745.db2.gz VREMIJXIVGPIFY-UHFFFAOYSA-N 1 2 235.352 2.383 20 0 BEADLO CCc1ccc(N2C[C@H]3CC[C@@H](C2)O3)[nH+]c1 ZINC001336527997 977751299 /nfs/dbraw/zinc/75/12/99/977751299.db2.gz VDAWXDVCJHVHNU-TXEJJXNPSA-N 1 2 218.300 2.012 20 0 BEADLO CCc1ccc(N2CC=C(COC)CC2)[nH+]c1 ZINC001336585107 977796007 /nfs/dbraw/zinc/79/60/07/977796007.db2.gz RCIXHBQWTKCNQR-UHFFFAOYSA-N 1 2 232.327 2.427 20 0 BEADLO COc1ccnc(C[N@@H+]2C[C@H](F)C[C@H]2C)c1 ZINC001231966976 977812627 /nfs/dbraw/zinc/81/26/27/977812627.db2.gz OZYPMRITGNJJDV-NXEZZACHSA-N 1 2 224.279 2.023 20 0 BEADLO Fc1ncc(Cl)cc1C[N@@H+]1C[C@@H]2C[C@@H]2C1 ZINC001231990945 977826071 /nfs/dbraw/zinc/82/60/71/977826071.db2.gz NLGDEOBEENEDSP-OCAPTIKFSA-N 1 2 226.682 2.326 20 0 BEADLO Fc1ncc(Cl)cc1C[N@H+]1C[C@@H]2C[C@@H]2C1 ZINC001231990945 977826076 /nfs/dbraw/zinc/82/60/76/977826076.db2.gz NLGDEOBEENEDSP-OCAPTIKFSA-N 1 2 226.682 2.326 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cncc(O)c2)cn1 ZINC001232047486 977873506 /nfs/dbraw/zinc/87/35/06/977873506.db2.gz YSSZQDKECTYOSG-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cncc(O)c2)cn1 ZINC001232047486 977873510 /nfs/dbraw/zinc/87/35/10/977873510.db2.gz YSSZQDKECTYOSG-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc3ncccc3[nH]2)C[C@H](C)O1 ZINC001232063864 977876487 /nfs/dbraw/zinc/87/64/87/977876487.db2.gz PKTWKQCDHTVGIR-PHIMTYICSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc3ncccc3[nH]2)C[C@H](C)O1 ZINC001232063864 977876492 /nfs/dbraw/zinc/87/64/92/977876492.db2.gz PKTWKQCDHTVGIR-PHIMTYICSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc3ncccc3[nH]2)[C@H](C)CO1 ZINC001232065987 977877292 /nfs/dbraw/zinc/87/72/92/977877292.db2.gz JVJPVXVGAKQJEV-GHMZBOCLSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc3ncccc3[nH]2)[C@H](C)CO1 ZINC001232065987 977877298 /nfs/dbraw/zinc/87/72/98/977877298.db2.gz JVJPVXVGAKQJEV-GHMZBOCLSA-N 1 2 245.326 2.172 20 0 BEADLO C[N@H+](Cc1cc2ncccc2[nH]1)Cc1ccno1 ZINC001232067109 977881811 /nfs/dbraw/zinc/88/18/11/977881811.db2.gz ISSUITLRQMTUAV-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO C[N@@H+](Cc1cc2ncccc2[nH]1)Cc1ccno1 ZINC001232067109 977881813 /nfs/dbraw/zinc/88/18/13/977881813.db2.gz ISSUITLRQMTUAV-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO FC(F)C1C[NH+](Cc2cc3ccncc3[nH]2)C1 ZINC001232098571 977892379 /nfs/dbraw/zinc/89/23/79/977892379.db2.gz LZQCSPYAWVYAGV-UHFFFAOYSA-N 1 2 237.253 2.260 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1cc2ccncc2[nH]1 ZINC001232095357 977892768 /nfs/dbraw/zinc/89/27/68/977892768.db2.gz FHMOIRJIEXAORJ-ZDUSSCGKSA-N 1 2 245.326 2.174 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1cc2ccncc2[nH]1 ZINC001232095357 977892775 /nfs/dbraw/zinc/89/27/75/977892775.db2.gz FHMOIRJIEXAORJ-ZDUSSCGKSA-N 1 2 245.326 2.174 20 0 BEADLO COc1nscc1CN(C)c1cccc[nH+]1 ZINC001336738210 977897040 /nfs/dbraw/zinc/89/70/40/977897040.db2.gz USSYMOMMRVVDTJ-UHFFFAOYSA-N 1 2 235.312 2.183 20 0 BEADLO C[N@H+](Cc1nc(Cl)ccc1F)[C@H]1CCOC1 ZINC001232158923 977897599 /nfs/dbraw/zinc/89/75/99/977897599.db2.gz AAPLJNPKVGXWPR-QMMMGPOBSA-N 1 2 244.697 2.095 20 0 BEADLO C[N@@H+](Cc1nc(Cl)ccc1F)[C@H]1CCOC1 ZINC001232158923 977897604 /nfs/dbraw/zinc/89/76/04/977897604.db2.gz AAPLJNPKVGXWPR-QMMMGPOBSA-N 1 2 244.697 2.095 20 0 BEADLO Cc1scnc1C[NH+]1CCSCC1 ZINC001232207415 977932422 /nfs/dbraw/zinc/93/24/22/977932422.db2.gz BNQWANDFLKGZBY-UHFFFAOYSA-N 1 2 214.359 2.000 20 0 BEADLO F[C@H]1CCCC[N@H+](Cc2ccns2)C1 ZINC001232189266 977910314 /nfs/dbraw/zinc/91/03/14/977910314.db2.gz YQQINWUOBYZYBU-VIFPVBQESA-N 1 2 214.309 2.467 20 0 BEADLO F[C@H]1CCCC[N@@H+](Cc2ccns2)C1 ZINC001232189266 977910320 /nfs/dbraw/zinc/91/03/20/977910320.db2.gz YQQINWUOBYZYBU-VIFPVBQESA-N 1 2 214.309 2.467 20 0 BEADLO Cc1c[nH+]c(NC2=CCOCC2)c(C)c1 ZINC001176140933 977923884 /nfs/dbraw/zinc/92/38/84/977923884.db2.gz NJKKAKQGXACZCY-UHFFFAOYSA-N 1 2 204.273 2.415 20 0 BEADLO Cc1scnc1C[NH+]1CC2(C1)CCCOC2 ZINC001232210643 977939748 /nfs/dbraw/zinc/93/97/48/977939748.db2.gz RJLMGYVNSXWGCO-UHFFFAOYSA-N 1 2 238.356 2.064 20 0 BEADLO COc1cc[nH+]cc1Nc1noc2cnccc12 ZINC001176117870 977943598 /nfs/dbraw/zinc/94/35/98/977943598.db2.gz AXSOIWQBCDTEIP-UHFFFAOYSA-N 1 2 242.238 2.370 20 0 BEADLO COc1cc[nH+]cc1Nc1ncccc1C(C)=O ZINC001176116362 977945686 /nfs/dbraw/zinc/94/56/86/977945686.db2.gz ARTLBBBTSIAAGX-UHFFFAOYSA-N 1 2 243.266 2.431 20 0 BEADLO COc1cc[nH+]cc1Nc1ccc(CCO)cc1 ZINC001176120710 977950484 /nfs/dbraw/zinc/95/04/84/977950484.db2.gz IQNKYUOXQIFYAR-UHFFFAOYSA-N 1 2 244.294 2.369 20 0 BEADLO COc1cc[nH+]cc1Nc1conc1C ZINC001176119075 977950548 /nfs/dbraw/zinc/95/05/48/977950548.db2.gz UTWCVRZBZMTGSU-UHFFFAOYSA-N 1 2 205.217 2.130 20 0 BEADLO Cc1cn2c(cccc2Nc2ccc(=O)[nH]c2)[nH+]1 ZINC001176124072 977955965 /nfs/dbraw/zinc/95/59/65/977955965.db2.gz HRLJOIXSUSGBTI-UHFFFAOYSA-N 1 2 240.266 2.487 20 0 BEADLO COc1cc[nH+]cc1Nc1cc(N)ccc1O ZINC001176123411 977958313 /nfs/dbraw/zinc/95/83/13/977958313.db2.gz SBDXQBULMDWVMM-UHFFFAOYSA-N 1 2 231.255 2.122 20 0 BEADLO COCc1cccc(C[N@@H+]2C[C@H](F)C[C@H]2C)n1 ZINC001232252399 977981672 /nfs/dbraw/zinc/98/16/72/977981672.db2.gz VEDVXMACXXBMGM-GHMZBOCLSA-N 1 2 238.306 2.160 20 0 BEADLO COCc1cccc(C[N@H+]2C[C@H](F)C[C@H]2C)n1 ZINC001232252399 977981688 /nfs/dbraw/zinc/98/16/88/977981688.db2.gz VEDVXMACXXBMGM-GHMZBOCLSA-N 1 2 238.306 2.160 20 0 BEADLO CC(C)OC(=O)C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC001336818746 977984706 /nfs/dbraw/zinc/98/47/06/977984706.db2.gz DQMGNEVGZGKPRO-ZDUSSCGKSA-N 1 2 248.326 2.170 20 0 BEADLO CC(C)OC(=O)C[N@H+]1CCC[C@H]1c1ccncc1 ZINC001336818746 977984713 /nfs/dbraw/zinc/98/47/13/977984713.db2.gz DQMGNEVGZGKPRO-ZDUSSCGKSA-N 1 2 248.326 2.170 20 0 BEADLO Cc1cccc(C[NH+]2CC(C)(O)C2)c1OC(C)C ZINC001232390067 978049799 /nfs/dbraw/zinc/04/97/99/978049799.db2.gz MRLBESZMWREURX-UHFFFAOYSA-N 1 2 249.354 2.349 20 0 BEADLO Cc1ncc(Nc2ccn3cc[nH+]c3c2)cn1 ZINC001176395278 978072207 /nfs/dbraw/zinc/07/22/07/978072207.db2.gz NBXNWSFJVUKGCV-UHFFFAOYSA-N 1 2 225.255 2.176 20 0 BEADLO C(c1n[nH]c2c1CCC2)[N@@H+]1CCCCC12CC2 ZINC001232429302 978074505 /nfs/dbraw/zinc/07/45/05/978074505.db2.gz KAPQMSYQWQAKBP-UHFFFAOYSA-N 1 2 231.343 2.417 20 0 BEADLO C(c1n[nH]c2c1CCC2)[N@H+]1CCCCC12CC2 ZINC001232429302 978074514 /nfs/dbraw/zinc/07/45/14/978074514.db2.gz KAPQMSYQWQAKBP-UHFFFAOYSA-N 1 2 231.343 2.417 20 0 BEADLO COc1cccc2c1CN(Cc1c[nH+]c(C)[nH]1)C2 ZINC001232465006 978105231 /nfs/dbraw/zinc/10/52/31/978105231.db2.gz QHCWWPVNRYXIPJ-UHFFFAOYSA-N 1 2 243.310 2.243 20 0 BEADLO COc1cccc2c1CN(Cc1c[nH]c(C)[nH+]1)C2 ZINC001232465006 978105237 /nfs/dbraw/zinc/10/52/37/978105237.db2.gz QHCWWPVNRYXIPJ-UHFFFAOYSA-N 1 2 243.310 2.243 20 0 BEADLO CC[N@H+](CCc1ccccn1)Cc1cc(C)[nH]n1 ZINC001337017877 978129580 /nfs/dbraw/zinc/12/95/80/978129580.db2.gz AWJWTWLCDRVTPC-UHFFFAOYSA-N 1 2 244.342 2.178 20 0 BEADLO CC[N@@H+](CCc1ccccn1)Cc1cc(C)[nH]n1 ZINC001337017877 978129587 /nfs/dbraw/zinc/12/95/87/978129587.db2.gz AWJWTWLCDRVTPC-UHFFFAOYSA-N 1 2 244.342 2.178 20 0 BEADLO Cc1cccc(F)c1C[N@@H+]1C[C@@H](F)C[C@H]1CO ZINC001232481896 978132376 /nfs/dbraw/zinc/13/23/76/978132376.db2.gz KCVMRBKIMRAOKN-QWRGUYRKSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cccc(F)c1C[N@H+]1C[C@@H](F)C[C@H]1CO ZINC001232481896 978132387 /nfs/dbraw/zinc/13/23/87/978132387.db2.gz KCVMRBKIMRAOKN-QWRGUYRKSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cccc(F)c1C[N@@H+]1CCOCC12CC2 ZINC001232484018 978134131 /nfs/dbraw/zinc/13/41/31/978134131.db2.gz SAGMUXREEWKZBY-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1cccc(F)c1C[N@H+]1CCOCC12CC2 ZINC001232484018 978134134 /nfs/dbraw/zinc/13/41/34/978134134.db2.gz SAGMUXREEWKZBY-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO CCc1cc(CNc2cc(F)cc(C)[nH+]2)n[nH]1 ZINC001337034570 978135526 /nfs/dbraw/zinc/13/55/26/978135526.db2.gz ZEDGDFWVCCQNBQ-UHFFFAOYSA-N 1 2 234.278 2.427 20 0 BEADLO Cc1cccc(F)c1C[N@@H+]1CCOC2(CC2)C1 ZINC001232486123 978139022 /nfs/dbraw/zinc/13/90/22/978139022.db2.gz JAROYQLTELVNDI-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1cccc(F)c1C[N@H+]1CCOC2(CC2)C1 ZINC001232486123 978139025 /nfs/dbraw/zinc/13/90/25/978139025.db2.gz JAROYQLTELVNDI-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO CO[C@@H]1C[N@H+](Cc2c(C)cccc2F)C[C@@H]1F ZINC001232490977 978143784 /nfs/dbraw/zinc/14/37/84/978143784.db2.gz UWBDIFPBIQSKOB-QWHCGFSZSA-N 1 2 241.281 2.303 20 0 BEADLO CO[C@@H]1C[N@@H+](Cc2c(C)cccc2F)C[C@@H]1F ZINC001232490977 978143786 /nfs/dbraw/zinc/14/37/86/978143786.db2.gz UWBDIFPBIQSKOB-QWHCGFSZSA-N 1 2 241.281 2.303 20 0 BEADLO FCc1cccc(C[N@@H+]2CC[C@@H](F)C2)n1 ZINC001232535153 978161906 /nfs/dbraw/zinc/16/19/06/978161906.db2.gz LYRJSFQOBGUXBE-SECBINFHSA-N 1 2 212.243 2.095 20 0 BEADLO FCc1cccc(C[N@H+]2CC[C@@H](F)C2)n1 ZINC001232535153 978161913 /nfs/dbraw/zinc/16/19/13/978161913.db2.gz LYRJSFQOBGUXBE-SECBINFHSA-N 1 2 212.243 2.095 20 0 BEADLO F[C@H]1CC[N@H+](Cc2cc3ccoc3cn2)C1 ZINC001232550548 978178466 /nfs/dbraw/zinc/17/84/66/978178466.db2.gz YQDIPDKWHWUBEO-JTQLQIEISA-N 1 2 220.247 2.372 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2cc3ccoc3cn2)C1 ZINC001232550548 978178473 /nfs/dbraw/zinc/17/84/73/978178473.db2.gz YQDIPDKWHWUBEO-JTQLQIEISA-N 1 2 220.247 2.372 20 0 BEADLO CCOc1ccnc(C[N@@H+]2C[C@@H](F)C[C@H]2C)c1 ZINC001232579282 978187708 /nfs/dbraw/zinc/18/77/08/978187708.db2.gz MCNVTLNLJKRNIX-MNOVXSKESA-N 1 2 238.306 2.413 20 0 BEADLO CCOc1ccnc(C[N@H+]2C[C@@H](F)C[C@H]2C)c1 ZINC001232579282 978187718 /nfs/dbraw/zinc/18/77/18/978187718.db2.gz MCNVTLNLJKRNIX-MNOVXSKESA-N 1 2 238.306 2.413 20 0 BEADLO Fc1nccc(Cl)c1C[N@@H+]1C[C@@H]2C[C@@H]2C1 ZINC001232613213 978193921 /nfs/dbraw/zinc/19/39/21/978193921.db2.gz RSDZLZXLJLFQRA-OCAPTIKFSA-N 1 2 226.682 2.326 20 0 BEADLO Fc1nccc(Cl)c1C[N@H+]1C[C@@H]2C[C@@H]2C1 ZINC001232613213 978193923 /nfs/dbraw/zinc/19/39/23/978193923.db2.gz RSDZLZXLJLFQRA-OCAPTIKFSA-N 1 2 226.682 2.326 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)Cc2c[nH]c[nH+]2)CC(C)(C)C1 ZINC001176836864 978204612 /nfs/dbraw/zinc/20/46/12/978204612.db2.gz RBWQWVOBGSFCIJ-MNOVXSKESA-N 1 2 249.358 2.283 20 0 BEADLO CNc1ccccc1C[NH+]1CC2(C1)CCCCO2 ZINC001232669892 978225391 /nfs/dbraw/zinc/22/53/91/978225391.db2.gz ZABKVCYPNCDELW-UHFFFAOYSA-N 1 2 246.354 2.483 20 0 BEADLO C[C@@H]1CCC(F)(F)C[N@@H+]1CC1(C)COC1 ZINC001176891851 978236641 /nfs/dbraw/zinc/23/66/41/978236641.db2.gz NNPRRRNGMCVVGM-SECBINFHSA-N 1 2 219.275 2.143 20 0 BEADLO C[C@@H]1CCC(F)(F)C[N@H+]1CC1(C)COC1 ZINC001176891851 978236661 /nfs/dbraw/zinc/23/66/61/978236661.db2.gz NNPRRRNGMCVVGM-SECBINFHSA-N 1 2 219.275 2.143 20 0 BEADLO Cc1cc(C)c(CNC(=O)c2ccns2)c[nH+]1 ZINC001337251294 978246593 /nfs/dbraw/zinc/24/65/93/978246593.db2.gz BLHRTUOWHSAXNU-UHFFFAOYSA-N 1 2 247.323 2.085 20 0 BEADLO O=C1CC[NH+](Cc2cccc3ncsc32)CC1 ZINC001232730432 978247343 /nfs/dbraw/zinc/24/73/43/978247343.db2.gz MVBGGKYSIOYLEG-UHFFFAOYSA-N 1 2 246.335 2.461 20 0 BEADLO CC(C)[C@H](O)C[N@@H+]1CC(F)(F)CC[C@H]1C ZINC001176897769 978251250 /nfs/dbraw/zinc/25/12/50/978251250.db2.gz OIPBCMUHACOLOJ-NXEZZACHSA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)[C@H](O)C[N@H+]1CC(F)(F)CC[C@H]1C ZINC001176897769 978251257 /nfs/dbraw/zinc/25/12/57/978251257.db2.gz OIPBCMUHACOLOJ-NXEZZACHSA-N 1 2 221.291 2.123 20 0 BEADLO Cc1cc(F)cc(N2CCO[C@@H](C)CC2)[nH+]1 ZINC001337267068 978252962 /nfs/dbraw/zinc/25/29/62/978252962.db2.gz OEPPUZFYUGAPGQ-JTQLQIEISA-N 1 2 224.279 2.144 20 0 BEADLO CCc1ccc(N2C[C@@H]3CSC[C@@H]3C2)[nH+]c1 ZINC001337267303 978254476 /nfs/dbraw/zinc/25/44/76/978254476.db2.gz HQRVEFBEUJZLII-TXEJJXNPSA-N 1 2 234.368 2.443 20 0 BEADLO CC(C)[C@@H](O)C[N@@H+]1CC(F)(F)CC[C@H]1C ZINC001176897778 978254916 /nfs/dbraw/zinc/25/49/16/978254916.db2.gz OIPBCMUHACOLOJ-ZJUUUORDSA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)[C@@H](O)C[N@H+]1CC(F)(F)CC[C@H]1C ZINC001176897778 978254923 /nfs/dbraw/zinc/25/49/23/978254923.db2.gz OIPBCMUHACOLOJ-ZJUUUORDSA-N 1 2 221.291 2.123 20 0 BEADLO CCCn1cnc(C[NH+]2CCC(C(C)=O)CC2)c1 ZINC001232802522 978289630 /nfs/dbraw/zinc/28/96/30/978289630.db2.gz DMXSVKWYJOWLBF-UHFFFAOYSA-N 1 2 249.358 2.094 20 0 BEADLO O=C(Nc1ccns1)c1cccc2[nH+]ccn21 ZINC001597072830 978292173 /nfs/dbraw/zinc/29/21/73/978292173.db2.gz PVHGDTRXOGMXAZ-UHFFFAOYSA-N 1 2 244.279 2.043 20 0 BEADLO Cc1cc(O)cc(C[N@@H+]2C[C@H]3CC[C@@H]2CO3)c1 ZINC001232883273 978326962 /nfs/dbraw/zinc/32/69/62/978326962.db2.gz JIONUCDBCVMRTJ-TZMCWYRMSA-N 1 2 233.311 2.064 20 0 BEADLO Cc1cc(O)cc(C[N@H+]2C[C@H]3CC[C@@H]2CO3)c1 ZINC001232883273 978326972 /nfs/dbraw/zinc/32/69/72/978326972.db2.gz JIONUCDBCVMRTJ-TZMCWYRMSA-N 1 2 233.311 2.064 20 0 BEADLO C[N@H+](Cc1ccc(F)c(O)c1F)C1CC1 ZINC001232930681 978343220 /nfs/dbraw/zinc/34/32/20/978343220.db2.gz DIROFXWJNSWPLF-UHFFFAOYSA-N 1 2 213.227 2.265 20 0 BEADLO C[N@@H+](Cc1ccc(F)c(O)c1F)C1CC1 ZINC001232930681 978343230 /nfs/dbraw/zinc/34/32/30/978343230.db2.gz DIROFXWJNSWPLF-UHFFFAOYSA-N 1 2 213.227 2.265 20 0 BEADLO CCn1cnc(Cl)c1C[NH2+]Cc1ccoc1 ZINC001177438032 978364628 /nfs/dbraw/zinc/36/46/28/978364628.db2.gz WETRVLOIISDBSK-UHFFFAOYSA-N 1 2 239.706 2.439 20 0 BEADLO CS[C@H](C)CC(=O)Nc1c(C)c[nH+]cc1C ZINC001337508416 978379852 /nfs/dbraw/zinc/37/98/52/978379852.db2.gz CEOGVOUATHDKNP-SNVBAGLBSA-N 1 2 238.356 2.200 20 0 BEADLO Oc1c(F)cc(C[NH+]2CCCC2)cc1F ZINC000149182777 978384939 /nfs/dbraw/zinc/38/49/39/978384939.db2.gz TUWHTFGJACONGG-UHFFFAOYSA-N 1 2 213.227 2.266 20 0 BEADLO C[C@@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)C1(C)CC1 ZINC001337522304 978388445 /nfs/dbraw/zinc/38/84/45/978388445.db2.gz NTBKWDLQVJKYMP-SECBINFHSA-N 1 2 243.310 2.481 20 0 BEADLO Cc1cc(C)c(C[N@H+](C)Cc2cncnc2)cn1 ZINC001233009257 978404735 /nfs/dbraw/zinc/40/47/35/978404735.db2.gz PDQQSUNAQQCEFF-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cc(C)c(C[N@@H+](C)Cc2cncnc2)cn1 ZINC001233009257 978404744 /nfs/dbraw/zinc/40/47/44/978404744.db2.gz PDQQSUNAQQCEFF-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO C[C@H]1C[N@H+](CCc2ccc(F)cc2F)CCO1 ZINC001337566258 978407658 /nfs/dbraw/zinc/40/76/58/978407658.db2.gz HLOGZMSFSWKYCN-JTQLQIEISA-N 1 2 241.281 2.228 20 0 BEADLO C[C@H]1C[N@@H+](CCc2ccc(F)cc2F)CCO1 ZINC001337566258 978407666 /nfs/dbraw/zinc/40/76/66/978407666.db2.gz HLOGZMSFSWKYCN-JTQLQIEISA-N 1 2 241.281 2.228 20 0 BEADLO CSCCCC(=O)Nc1c(C)c[nH+]cc1C ZINC001337639375 978437622 /nfs/dbraw/zinc/43/76/22/978437622.db2.gz JBMFWHBOVMUZNK-UHFFFAOYSA-N 1 2 238.356 2.202 20 0 BEADLO C[C@@H]1CCC[N@H+](Cc2nc3ccccn3n2)[C@@H]1C ZINC001233070193 978457284 /nfs/dbraw/zinc/45/72/84/978457284.db2.gz LTDBLIPCPDTFAU-VXGBXAGGSA-N 1 2 244.342 2.350 20 0 BEADLO C[C@@H]1CCC[N@@H+](Cc2nc3ccccn3n2)[C@@H]1C ZINC001233070193 978457295 /nfs/dbraw/zinc/45/72/95/978457295.db2.gz LTDBLIPCPDTFAU-VXGBXAGGSA-N 1 2 244.342 2.350 20 0 BEADLO CN(C)c1ccc(C[NH+]2CC3(CCC3)C2)c(F)n1 ZINC001233114312 978469891 /nfs/dbraw/zinc/46/98/91/978469891.db2.gz ICFAQEZETZOKSX-UHFFFAOYSA-N 1 2 249.333 2.273 20 0 BEADLO CCc1ccc(NC(=O)[C@@H](C)n2cc[nH+]c2)cn1 ZINC001177921997 978475169 /nfs/dbraw/zinc/47/51/69/978475169.db2.gz NXHSPQWANVOUIW-SNVBAGLBSA-N 1 2 244.298 2.040 20 0 BEADLO Cc1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)cc1O ZINC001233229880 978499096 /nfs/dbraw/zinc/49/90/96/978499096.db2.gz UEIKYMSIHOHXKD-BETUJISGSA-N 1 2 233.311 2.064 20 0 BEADLO Cc1ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)cc1O ZINC001233229880 978499103 /nfs/dbraw/zinc/49/91/03/978499103.db2.gz UEIKYMSIHOHXKD-BETUJISGSA-N 1 2 233.311 2.064 20 0 BEADLO CC(C)OC1C[NH+](Cc2cccc3c2CCO3)C1 ZINC001233277910 978531422 /nfs/dbraw/zinc/53/14/22/978531422.db2.gz WXWOKAZBZGKGMC-UHFFFAOYSA-N 1 2 247.338 2.231 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H](F)C[C@H]2C)sn1 ZINC001233309995 978537113 /nfs/dbraw/zinc/53/71/13/978537113.db2.gz MADKHZIMHRHDKS-BDAKNGLRSA-N 1 2 214.309 2.384 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H](F)C[C@H]2C)sn1 ZINC001233309995 978537124 /nfs/dbraw/zinc/53/71/24/978537124.db2.gz MADKHZIMHRHDKS-BDAKNGLRSA-N 1 2 214.309 2.384 20 0 BEADLO Cc1cc(C[N@@H+]2CCCCC23COC3)sn1 ZINC001233312260 978539388 /nfs/dbraw/zinc/53/93/88/978539388.db2.gz HZEMKFKJWKOHSY-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO Cc1cc(C[N@H+]2CCCCC23COC3)sn1 ZINC001233312260 978539400 /nfs/dbraw/zinc/53/94/00/978539400.db2.gz HZEMKFKJWKOHSY-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO CCc1ccc(N2CCC[C@@H](CO)CC2)[nH+]c1 ZINC001337894661 978554874 /nfs/dbraw/zinc/55/48/74/978554874.db2.gz LGDCFRPXBQMOOI-CYBMUJFWSA-N 1 2 234.343 2.243 20 0 BEADLO Cc1cc(F)cc(N2CCO[C@H](CCF)C2)[nH+]1 ZINC001337936113 978570538 /nfs/dbraw/zinc/57/05/38/978570538.db2.gz UUKXYCXVCYDGBK-LLVKDONJSA-N 1 2 242.269 2.094 20 0 BEADLO Cc1[nH]c(CNc2cc(C3CC3)ncn2)[nH+]c1C ZINC001337971428 978578973 /nfs/dbraw/zinc/57/89/73/978578973.db2.gz QRNHXOGIPDFUNO-UHFFFAOYSA-N 1 2 243.314 2.306 20 0 BEADLO Clc1cncc(C[N@@H+]2CCC[C@H]3C[C@H]32)n1 ZINC001233450809 978602079 /nfs/dbraw/zinc/60/20/79/978602079.db2.gz KOKJHHQRDKWROM-WCBMZHEXSA-N 1 2 223.707 2.114 20 0 BEADLO Clc1cncc(C[N@H+]2CCC[C@H]3C[C@H]32)n1 ZINC001233450809 978602085 /nfs/dbraw/zinc/60/20/85/978602085.db2.gz KOKJHHQRDKWROM-WCBMZHEXSA-N 1 2 223.707 2.114 20 0 BEADLO CCc1[nH]c(CNC(=O)C2CC3(CCC3)C2)c[nH+]1 ZINC001178670323 978605229 /nfs/dbraw/zinc/60/52/29/978605229.db2.gz VBTPNPDHHNPBTH-UHFFFAOYSA-N 1 2 247.342 2.169 20 0 BEADLO CCc1[nH]cc(CNC(=O)C2CC3(CCC3)C2)[nH+]1 ZINC001178670323 978605234 /nfs/dbraw/zinc/60/52/34/978605234.db2.gz VBTPNPDHHNPBTH-UHFFFAOYSA-N 1 2 247.342 2.169 20 0 BEADLO Cc1occc1C[NH2+]Cc1nnc(C(C)C)[nH]1 ZINC001178794634 978629519 /nfs/dbraw/zinc/62/95/19/978629519.db2.gz AQBHJXQCENJDJS-UHFFFAOYSA-N 1 2 234.303 2.119 20 0 BEADLO Cc1cc(O)c(Cl)cc1OC1C[NH+](C)C1 ZINC001233592486 978640019 /nfs/dbraw/zinc/64/00/19/978640019.db2.gz NRWNBIWODMTXDT-UHFFFAOYSA-N 1 2 227.691 2.047 20 0 BEADLO C[C@H](C(=O)N1CCCC(C)(C)C1)n1cc[nH+]c1 ZINC001338767640 978733314 /nfs/dbraw/zinc/73/33/14/978733314.db2.gz OOPYQGUTLPDFRK-LLVKDONJSA-N 1 2 235.331 2.093 20 0 BEADLO C[C@@H](C(=O)N1CCCC(C)(C)C1)n1cc[nH+]c1 ZINC001338767641 978733702 /nfs/dbraw/zinc/73/37/02/978733702.db2.gz OOPYQGUTLPDFRK-NSHDSACASA-N 1 2 235.331 2.093 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H](F)C(C)C ZINC001339101916 978792287 /nfs/dbraw/zinc/79/22/87/978792287.db2.gz FAHBWTUAOKKIRY-SNVBAGLBSA-N 1 2 224.279 2.053 20 0 BEADLO C[C@H]1CN(c2cc(N)nc[nH+]2)Cc2ccccc21 ZINC001339431955 978851344 /nfs/dbraw/zinc/85/13/44/978851344.db2.gz VYQNGDVCZKIFSA-JTQLQIEISA-N 1 2 240.310 2.183 20 0 BEADLO CCc1cccnc1OC1C[NH+](C(C)C)C1 ZINC001234576821 978862154 /nfs/dbraw/zinc/86/21/54/978862154.db2.gz FIOPQJCBZKAEBG-UHFFFAOYSA-N 1 2 220.316 2.115 20 0 BEADLO Cc1cc(F)cc(N2CCC(CCO)CC2)[nH+]1 ZINC001339573972 978873430 /nfs/dbraw/zinc/87/34/30/978873430.db2.gz FQKHDSRBBSLKRI-UHFFFAOYSA-N 1 2 238.306 2.128 20 0 BEADLO CCC[C@H](C)[C@@H]1CCCN1c1cc(N)nc[nH+]1 ZINC001339629164 978883437 /nfs/dbraw/zinc/88/34/37/978883437.db2.gz ONHBBXGFFFZFTN-QWRGUYRKSA-N 1 2 234.347 2.464 20 0 BEADLO CCc1ccc(N(C)[C@@H]2CCCC[C@H]2O)[nH+]c1 ZINC001339792278 978913799 /nfs/dbraw/zinc/91/37/99/978913799.db2.gz DUYKMWYVDMTXJG-CHWSQXEVSA-N 1 2 234.343 2.384 20 0 BEADLO Nc1cc(N2CCC[C@@H](C3CCC3)CC2)[nH+]cn1 ZINC001339793173 978915148 /nfs/dbraw/zinc/91/51/48/978915148.db2.gz KQCHSLBXBOPLFQ-GFCCVEGCSA-N 1 2 246.358 2.465 20 0 BEADLO CCc1nsc(NCc2[nH]c(C)c(C)[nH+]2)n1 ZINC001339815759 978918583 /nfs/dbraw/zinc/91/85/83/978918583.db2.gz WNGONEISGXQXCJ-UHFFFAOYSA-N 1 2 237.332 2.053 20 0 BEADLO Fc1cnc(C[N@@H+]2CCC23CCCC3)nc1 ZINC001235004557 978946814 /nfs/dbraw/zinc/94/68/14/978946814.db2.gz KROIDXSPSSKMIQ-UHFFFAOYSA-N 1 2 221.279 2.134 20 0 BEADLO Fc1cnc(C[N@H+]2CCC23CCCC3)nc1 ZINC001235004557 978946817 /nfs/dbraw/zinc/94/68/17/978946817.db2.gz KROIDXSPSSKMIQ-UHFFFAOYSA-N 1 2 221.279 2.134 20 0 BEADLO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1ncc(F)cn1 ZINC001235011788 978952247 /nfs/dbraw/zinc/95/22/47/978952247.db2.gz TVJSWZJZWLUZQW-VHSXEESVSA-N 1 2 223.295 2.236 20 0 BEADLO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1ncc(F)cn1 ZINC001235011788 978952250 /nfs/dbraw/zinc/95/22/50/978952250.db2.gz TVJSWZJZWLUZQW-VHSXEESVSA-N 1 2 223.295 2.236 20 0 BEADLO CC(C)C1CC[NH+](Cc2ncc(F)cn2)CC1 ZINC001235015839 978953763 /nfs/dbraw/zinc/95/37/63/978953763.db2.gz GRHUECYAWHWDLY-UHFFFAOYSA-N 1 2 237.322 2.484 20 0 BEADLO O=C(Nc1ccsc1)[C@@H]1[NH2+]CCc2occc21 ZINC001340080056 978967199 /nfs/dbraw/zinc/96/71/99/978967199.db2.gz TXVVVUHUZHKWPC-LLVKDONJSA-N 1 2 248.307 2.167 20 0 BEADLO Cc1csc(NC(=O)Cc2cc[nH+]c(N)c2)c1 ZINC001181239600 979015633 /nfs/dbraw/zinc/01/56/33/979015633.db2.gz BZHMMXXMBYPLND-UHFFFAOYSA-N 1 2 247.323 2.215 20 0 BEADLO Cc1cnc(F)c(C[NH+]2CCSCC2)c1 ZINC001235330492 979023881 /nfs/dbraw/zinc/02/38/81/979023881.db2.gz YUCSYPSOZQTHSD-UHFFFAOYSA-N 1 2 226.320 2.078 20 0 BEADLO CC(C)c1nn(C)cc1NCc1ccc[nH+]c1N ZINC001181284457 979033067 /nfs/dbraw/zinc/03/30/67/979033067.db2.gz AMCVYUVWNHIVQH-UHFFFAOYSA-N 1 2 245.330 2.133 20 0 BEADLO COc1cncc(C[N@H+](C)Cc2ccno2)c1C ZINC001235472389 979053176 /nfs/dbraw/zinc/05/31/76/979053176.db2.gz BRISUFJEPHOIKR-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1cncc(C[N@@H+](C)Cc2ccno2)c1C ZINC001235472389 979053179 /nfs/dbraw/zinc/05/31/79/979053179.db2.gz BRISUFJEPHOIKR-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO Cc1cncc(Br)c1C[NH+](C)C ZINC001235637962 979104960 /nfs/dbraw/zinc/10/49/60/979104960.db2.gz QBTUAXGKDROQQY-UHFFFAOYSA-N 1 2 229.121 2.214 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H]1CCC(C)(C)O1 ZINC001340809870 979116666 /nfs/dbraw/zinc/11/66/66/979116666.db2.gz GIBFNIQAHCXUHE-NSHDSACASA-N 1 2 248.326 2.016 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)C1CC(C)(C)C1 ZINC001340809888 979117439 /nfs/dbraw/zinc/11/74/39/979117439.db2.gz GLPFOXBTEOQCBZ-UHFFFAOYSA-N 1 2 232.327 2.495 20 0 BEADLO COc1nccc(C[N@H+](C)C2CC2)c1Cl ZINC001235831243 979164442 /nfs/dbraw/zinc/16/44/42/979164442.db2.gz YWKURJWPFGZMBS-UHFFFAOYSA-N 1 2 226.707 2.338 20 0 BEADLO COc1nccc(C[N@@H+](C)C2CC2)c1Cl ZINC001235831243 979164450 /nfs/dbraw/zinc/16/44/50/979164450.db2.gz YWKURJWPFGZMBS-UHFFFAOYSA-N 1 2 226.707 2.338 20 0 BEADLO Cc1ccc(Nc2cnn3cccnc23)c(C)[nH+]1 ZINC001203367702 979251839 /nfs/dbraw/zinc/25/18/39/979251839.db2.gz ODSNYSXGNZGSMI-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cn1cc(Cl)c(C[N@@H+]2CC[C@H]2C2CC2)n1 ZINC001181913741 979371340 /nfs/dbraw/zinc/37/13/40/979371340.db2.gz RGXJOQIWMBHDQP-NSHDSACASA-N 1 2 225.723 2.058 20 0 BEADLO Cn1cc(Cl)c(C[N@H+]2CC[C@H]2C2CC2)n1 ZINC001181913741 979371351 /nfs/dbraw/zinc/37/13/51/979371351.db2.gz RGXJOQIWMBHDQP-NSHDSACASA-N 1 2 225.723 2.058 20 0 BEADLO COCn1cc(Nc2ccc(C)[nH+]c2C)cn1 ZINC001203368989 979423924 /nfs/dbraw/zinc/42/39/24/979423924.db2.gz JKMDZNAIHSPUAV-UHFFFAOYSA-N 1 2 232.287 2.242 20 0 BEADLO Cn1cc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)c2ccccc21 ZINC001204319619 979456610 /nfs/dbraw/zinc/45/66/10/979456610.db2.gz YCJXIFSLBBXHPF-LSDHHAIUSA-N 1 2 242.322 2.151 20 0 BEADLO Cn1cc(C[N@H+]2CCO[C@@H]3C[C@@H]32)c2ccccc21 ZINC001204319619 979456614 /nfs/dbraw/zinc/45/66/14/979456614.db2.gz YCJXIFSLBBXHPF-LSDHHAIUSA-N 1 2 242.322 2.151 20 0 BEADLO Cc1ccc(Nc2cccc(CO)n2)c(C)[nH+]1 ZINC001203370635 979468705 /nfs/dbraw/zinc/46/87/05/979468705.db2.gz QPLCSASZIGBGQU-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO C[C@@H]1c2ccc(-c3ccc(N)[nH+]c3)cc2NC1=O ZINC001236312127 979518218 /nfs/dbraw/zinc/51/82/18/979518218.db2.gz JMLAMFVEZODMLM-MRVPVSSYSA-N 1 2 239.278 2.386 20 0 BEADLO Nc1ccc(-c2ccc3c(c2)[C@@H](O)CCO3)c[nH+]1 ZINC001236313803 979525766 /nfs/dbraw/zinc/52/57/66/979525766.db2.gz YUIXYBVYBHWGOT-LBPRGKRZSA-N 1 2 242.278 2.147 20 0 BEADLO Nc1ccc(-c2cc3[nH]cnc3c(F)c2)c[nH+]1 ZINC001236317318 979529533 /nfs/dbraw/zinc/52/95/33/979529533.db2.gz SXDOEMULDRZIAM-UHFFFAOYSA-N 1 2 228.230 2.346 20 0 BEADLO Cc1cc(N)c(F)cc1-c1ccc(N)[nH+]c1 ZINC001236318011 979531814 /nfs/dbraw/zinc/53/18/14/979531814.db2.gz VWPHMBWZPBLKNY-UHFFFAOYSA-N 1 2 217.247 2.361 20 0 BEADLO Nc1noc2cc(-c3ccc(N)[nH+]c3)ccc12 ZINC001236318413 979531899 /nfs/dbraw/zinc/53/18/99/979531899.db2.gz WYPVOUOVUOEYKO-UHFFFAOYSA-N 1 2 226.239 2.054 20 0 BEADLO COc1cncc(-c2cc[nH+]c3c2CCN3)c1C ZINC001236392683 979579420 /nfs/dbraw/zinc/57/94/20/979579420.db2.gz RBVOIBJBERHEDS-UHFFFAOYSA-N 1 2 241.294 2.429 20 0 BEADLO Cc1cc(C)c(CC(=O)OC(C)C)c[nH+]1 ZINC001250088430 979629337 /nfs/dbraw/zinc/62/93/37/979629337.db2.gz MNIVMTQGJOIGKK-UHFFFAOYSA-N 1 2 207.273 2.193 20 0 BEADLO COC(=[NH2+])c1cccc(-c2cncc(O)c2)c1 ZINC001236583226 979663515 /nfs/dbraw/zinc/66/35/15/979663515.db2.gz NGKLHMGOPUXQLM-UHFFFAOYSA-N 1 2 228.251 2.426 20 0 BEADLO CC[C@@]12C[C@@H](CO1)[N@H+](Cc1oc(C)nc1C)C2 ZINC001236593583 979671626 /nfs/dbraw/zinc/67/16/26/979671626.db2.gz HHALBCDAOLJIMF-AAEUAGOBSA-N 1 2 236.315 2.045 20 0 BEADLO CC[C@@]12C[C@@H](CO1)[N@@H+](Cc1oc(C)nc1C)C2 ZINC001236593583 979671628 /nfs/dbraw/zinc/67/16/28/979671628.db2.gz HHALBCDAOLJIMF-AAEUAGOBSA-N 1 2 236.315 2.045 20 0 BEADLO FC[C@@H]1CCC[N@H+](Cc2nccnc2Cl)C1 ZINC001236616340 979681229 /nfs/dbraw/zinc/68/12/29/979681229.db2.gz ZJQMOAYWCBYVGD-VIFPVBQESA-N 1 2 243.713 2.312 20 0 BEADLO FC[C@@H]1CCC[N@@H+](Cc2nccnc2Cl)C1 ZINC001236616340 979681234 /nfs/dbraw/zinc/68/12/34/979681234.db2.gz ZJQMOAYWCBYVGD-VIFPVBQESA-N 1 2 243.713 2.312 20 0 BEADLO Clc1nccnc1C[N@@H+]1CCC[C@H]2C[C@H]21 ZINC001236623708 979683200 /nfs/dbraw/zinc/68/32/00/979683200.db2.gz HFTLHFNZXCOIES-WCBMZHEXSA-N 1 2 223.707 2.114 20 0 BEADLO Clc1nccnc1C[N@H+]1CCC[C@H]2C[C@H]21 ZINC001236623708 979683206 /nfs/dbraw/zinc/68/32/06/979683206.db2.gz HFTLHFNZXCOIES-WCBMZHEXSA-N 1 2 223.707 2.114 20 0 BEADLO c1cc2c(cccc2C[N@@H+]2CCO[C@@H]3C[C@@H]32)o1 ZINC001236738966 979719467 /nfs/dbraw/zinc/71/94/67/979719467.db2.gz JVYFWKNWYXLOOX-GXTWGEPZSA-N 1 2 229.279 2.406 20 0 BEADLO c1cc2c(cccc2C[N@H+]2CCO[C@@H]3C[C@@H]32)o1 ZINC001236738966 979719475 /nfs/dbraw/zinc/71/94/75/979719475.db2.gz JVYFWKNWYXLOOX-GXTWGEPZSA-N 1 2 229.279 2.406 20 0 BEADLO COC(=O)c1cc(Cl)cc(C[NH+]2CCC2)c1 ZINC001236762676 979720968 /nfs/dbraw/zinc/72/09/68/979720968.db2.gz IHDOMZPWYGAQQM-UHFFFAOYSA-N 1 2 239.702 2.332 20 0 BEADLO c1c[nH+]c(N2CCCC2)c(C[C@H]2CCCO2)c1 ZINC001250102758 979735735 /nfs/dbraw/zinc/73/57/35/979735735.db2.gz KUKHABNLNNFNDQ-CYBMUJFWSA-N 1 2 232.327 2.403 20 0 BEADLO CCOc1cncc(C[N@@H+]2CCC[C@@H]2CF)c1 ZINC001236844395 979751931 /nfs/dbraw/zinc/75/19/31/979751931.db2.gz ZWSYJUANCCTIBO-GFCCVEGCSA-N 1 2 238.306 2.414 20 0 BEADLO CCOc1cncc(C[N@H+]2CCC[C@@H]2CF)c1 ZINC001236844395 979751936 /nfs/dbraw/zinc/75/19/36/979751936.db2.gz ZWSYJUANCCTIBO-GFCCVEGCSA-N 1 2 238.306 2.414 20 0 BEADLO CCOc1cc[nH+]cc1Nc1ccnn1CC ZINC001205274867 979842424 /nfs/dbraw/zinc/84/24/24/979842424.db2.gz STLDUMLETVADSP-UHFFFAOYSA-N 1 2 232.287 2.440 20 0 BEADLO Cc1cc2c(cn1)C[N@H+](Cc1cccc(N)c1)C2 ZINC001237222886 979857372 /nfs/dbraw/zinc/85/73/72/979857372.db2.gz WHEHPGQRZIDVFK-UHFFFAOYSA-N 1 2 239.322 2.488 20 0 BEADLO Cc1cc2c(cn1)C[N@@H+](Cc1cccc(N)c1)C2 ZINC001237222886 979857373 /nfs/dbraw/zinc/85/73/73/979857373.db2.gz WHEHPGQRZIDVFK-UHFFFAOYSA-N 1 2 239.322 2.488 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1cc(O)cc(F)c1 ZINC001237285538 979864192 /nfs/dbraw/zinc/86/41/92/979864192.db2.gz UVMLQSXNUPKEOV-LDYMZIIASA-N 1 2 227.254 2.464 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1cc(O)cc(F)c1 ZINC001237285538 979864197 /nfs/dbraw/zinc/86/41/97/979864197.db2.gz UVMLQSXNUPKEOV-LDYMZIIASA-N 1 2 227.254 2.464 20 0 BEADLO O=C(Cn1cc[nH+]c1)Nc1ccc2[nH]ccc2c1 ZINC000072859551 979878548 /nfs/dbraw/zinc/87/85/48/979878548.db2.gz OXDVZBIPRWUYQM-UHFFFAOYSA-N 1 2 240.266 2.003 20 0 BEADLO Nc1ccc(CCC(=O)Nc2ccsc2)c[nH+]1 ZINC001183929852 979909470 /nfs/dbraw/zinc/90/94/70/979909470.db2.gz UGHHTUKDVKNJML-UHFFFAOYSA-N 1 2 247.323 2.297 20 0 BEADLO COc1c(C)cccc1C[NH+]1CC(C)(OC)C1 ZINC001237501152 979921406 /nfs/dbraw/zinc/92/14/06/979921406.db2.gz QQRKWHMBMLISKP-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO FC(F)Oc1cc(C[N@@H+]2CC[C@@H](F)C2)ccn1 ZINC001237610387 979971366 /nfs/dbraw/zinc/97/13/66/979971366.db2.gz GARCNYFPGXOAOS-SECBINFHSA-N 1 2 246.232 2.227 20 0 BEADLO FC(F)Oc1cc(C[N@H+]2CC[C@@H](F)C2)ccn1 ZINC001237610387 979971371 /nfs/dbraw/zinc/97/13/71/979971371.db2.gz GARCNYFPGXOAOS-SECBINFHSA-N 1 2 246.232 2.227 20 0 BEADLO CCc1[nH]nc(Cl)c1C[N@H+]1CC=CCC1 ZINC001343022640 979979160 /nfs/dbraw/zinc/97/91/60/979979160.db2.gz XUEODFJFJUSTHF-UHFFFAOYSA-N 1 2 225.723 2.387 20 0 BEADLO CCc1[nH]nc(Cl)c1C[N@@H+]1CC=CCC1 ZINC001343022640 979979168 /nfs/dbraw/zinc/97/91/68/979979168.db2.gz XUEODFJFJUSTHF-UHFFFAOYSA-N 1 2 225.723 2.387 20 0 BEADLO CCc1[nH]ncc1C[NH+]1CCC(C(F)F)CC1 ZINC001237653074 980014865 /nfs/dbraw/zinc/01/48/65/980014865.db2.gz BDZQFMJWRBEZRI-UHFFFAOYSA-N 1 2 243.301 2.449 20 0 BEADLO CN(C)c1cc(N[C@H]2CCC[C@@H](F)C2)[nH+]cn1 ZINC001343153668 980024055 /nfs/dbraw/zinc/02/40/55/980024055.db2.gz JIOJBQRATASHPA-ZJUUUORDSA-N 1 2 238.310 2.235 20 0 BEADLO CN(C)c1cc(N[C@H]2CCC[C@@H](F)C2)nc[nH+]1 ZINC001343153668 980024065 /nfs/dbraw/zinc/02/40/65/980024065.db2.gz JIOJBQRATASHPA-ZJUUUORDSA-N 1 2 238.310 2.235 20 0 BEADLO COc1ccc(C)c(C[NH+]2CCC(=O)CC2)c1 ZINC001237708236 980032948 /nfs/dbraw/zinc/03/29/48/980032948.db2.gz NGRWDQKQZDVRQL-UHFFFAOYSA-N 1 2 233.311 2.169 20 0 BEADLO Cc1c[nH]c(CCNC(=O)[C@H]2CCC[C@@H](C)C2)[nH+]1 ZINC001184510398 980102642 /nfs/dbraw/zinc/10/26/42/980102642.db2.gz FUNTXABHQLGLID-PWSUYJOCSA-N 1 2 249.358 2.203 20 0 BEADLO Cc1c[nH]c(CCNC(=O)[C@@H]2CCC[C@@H](C)C2)[nH+]1 ZINC001184510399 980103600 /nfs/dbraw/zinc/10/36/00/980103600.db2.gz FUNTXABHQLGLID-ZYHUDNBSSA-N 1 2 249.358 2.203 20 0 BEADLO Cc1c[nH]c(CCNC(=O)[C@@H]2CCC[C@H](C)C2)[nH+]1 ZINC001184510394 980103973 /nfs/dbraw/zinc/10/39/73/980103973.db2.gz FUNTXABHQLGLID-CMPLNLGQSA-N 1 2 249.358 2.203 20 0 BEADLO C[NH+](C)Cc1cc(F)c(O)c(Cl)c1 ZINC001237988782 980121597 /nfs/dbraw/zinc/12/15/97/980121597.db2.gz GECWDMOVHJMBBB-UHFFFAOYSA-N 1 2 203.644 2.246 20 0 BEADLO C[N@H+](Cc1cnc(F)cc1Cl)[C@H]1CCOC1 ZINC001238017203 980126457 /nfs/dbraw/zinc/12/64/57/980126457.db2.gz CTUHWCIGKNUHDZ-VIFPVBQESA-N 1 2 244.697 2.095 20 0 BEADLO C[N@@H+](Cc1cnc(F)cc1Cl)[C@H]1CCOC1 ZINC001238017203 980126461 /nfs/dbraw/zinc/12/64/61/980126461.db2.gz CTUHWCIGKNUHDZ-VIFPVBQESA-N 1 2 244.697 2.095 20 0 BEADLO CC1(C(=O)OCCc2cn3c([nH+]2)CCCC3)CC1 ZINC001343601312 980162350 /nfs/dbraw/zinc/16/23/50/980162350.db2.gz HVWKJEDRRDAIJI-UHFFFAOYSA-N 1 2 248.326 2.105 20 0 BEADLO COCC1C[NH+](Cc2cc(C)c(Cl)cn2)C1 ZINC001238426756 980254712 /nfs/dbraw/zinc/25/47/12/980254712.db2.gz LDBHPTLRBVANPT-UHFFFAOYSA-N 1 2 240.734 2.122 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2cncnc2)c(C)c1 ZINC001238439210 980261424 /nfs/dbraw/zinc/26/14/24/980261424.db2.gz ZUVDQAVQHCUJTH-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2cncnc2)c(C)c1 ZINC001238439210 980261428 /nfs/dbraw/zinc/26/14/28/980261428.db2.gz ZUVDQAVQHCUJTH-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1c(Cl)ccc(C[NH+]2CC(CO)C2)c1F ZINC001238515482 980278779 /nfs/dbraw/zinc/27/87/79/980278779.db2.gz GKYFECMIHJZGGA-UHFFFAOYSA-N 1 2 243.709 2.212 20 0 BEADLO CC[N@H+](Cc1cnc(C2CC2)c(C)c1)C1COC1 ZINC001238619659 980302155 /nfs/dbraw/zinc/30/21/55/980302155.db2.gz AIHSAVOFEGJCBR-UHFFFAOYSA-N 1 2 246.354 2.488 20 0 BEADLO CC[N@@H+](Cc1cnc(C2CC2)c(C)c1)C1COC1 ZINC001238619659 980302160 /nfs/dbraw/zinc/30/21/60/980302160.db2.gz AIHSAVOFEGJCBR-UHFFFAOYSA-N 1 2 246.354 2.488 20 0 BEADLO CC(C)[C@@H]1N(C(=O)[C@H](C)n2cc[nH+]c2)CC1(C)C ZINC001343998056 980307127 /nfs/dbraw/zinc/30/71/27/980307127.db2.gz PWXICBKEUQRIPF-RYUDHWBXSA-N 1 2 249.358 2.337 20 0 BEADLO CCOc1cc(C[NH+]2CC(C)C2)c(F)cn1 ZINC001238726235 980312630 /nfs/dbraw/zinc/31/26/30/980312630.db2.gz CNBJOGPSHWMNSL-UHFFFAOYSA-N 1 2 224.279 2.071 20 0 BEADLO CSCCCNc1cc(N)cc(Cl)[nH+]1 ZINC000154743546 980358364 /nfs/dbraw/zinc/35/83/64/980358364.db2.gz BMZDNPFUQDPRBV-UHFFFAOYSA-N 1 2 231.752 2.482 20 0 BEADLO C[C@@H](C(=O)NCCC(C)(C)C1CC1)n1cc[nH+]c1 ZINC001344350653 980373352 /nfs/dbraw/zinc/37/33/52/980373352.db2.gz GLBQRPDPHQTLMU-NSHDSACASA-N 1 2 249.358 2.387 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cccc(CCO)c1 ZINC001239032919 980418170 /nfs/dbraw/zinc/41/81/70/980418170.db2.gz ZOWCFWACZOEKGF-BZKLWIKRSA-N 1 2 203.285 2.097 20 0 BEADLO CCCNc1cc(C)[nH+]c(/C=C/C(C)(C)O)n1 ZINC001239136552 980457409 /nfs/dbraw/zinc/45/74/09/980457409.db2.gz QZHYZWBNBGQQIO-VOTSOKGWSA-N 1 2 235.331 2.391 20 0 BEADLO Cc1c[nH+]c(C)c(N(C)c2ncccc2N)c1 ZINC001203654146 980478689 /nfs/dbraw/zinc/47/86/89/980478689.db2.gz DYUXFUOPGDTKOY-UHFFFAOYSA-N 1 2 228.299 2.444 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1cnoc1 ZINC001239176988 980486682 /nfs/dbraw/zinc/48/66/82/980486682.db2.gz DKGNTXDPFSSTPB-UHFFFAOYSA-N 1 2 203.245 2.111 20 0 BEADLO CC1=C(C(=O)OCCCc2c[nH+]cn2C)CCC1 ZINC001344929196 980500759 /nfs/dbraw/zinc/50/07/59/980500759.db2.gz HSUJDYBAACTHEK-UHFFFAOYSA-N 1 2 248.326 2.396 20 0 BEADLO CCC[N@@H+]1CCCC[C@H]1C(=O)OCC(C)(F)F ZINC001345066147 980538477 /nfs/dbraw/zinc/53/84/77/980538477.db2.gz HEKAVDUUFMXPSW-JTQLQIEISA-N 1 2 249.301 2.449 20 0 BEADLO CCC[N@H+]1CCCC[C@H]1C(=O)OCC(C)(F)F ZINC001345066147 980538485 /nfs/dbraw/zinc/53/84/85/980538485.db2.gz HEKAVDUUFMXPSW-JTQLQIEISA-N 1 2 249.301 2.449 20 0 BEADLO C[C@@H](C(=O)OCC(C)(C)n1cc[nH+]c1)C1CC1 ZINC001345250575 980591638 /nfs/dbraw/zinc/59/16/38/980591638.db2.gz DFRIBACQMHCCRR-SNVBAGLBSA-N 1 2 236.315 2.208 20 0 BEADLO CC[C@@H]1CCCCN1C(=O)CCc1[nH+]ccn1C ZINC001345480081 980618523 /nfs/dbraw/zinc/61/85/23/980618523.db2.gz ZSGQOXIGBJIVEO-GFCCVEGCSA-N 1 2 249.358 2.144 20 0 BEADLO Cn1cc[nH+]c1CCC(=O)N1CCCCCCC1 ZINC001345560623 980628643 /nfs/dbraw/zinc/62/86/43/980628643.db2.gz ICCRQLKEQKVBLJ-UHFFFAOYSA-N 1 2 249.358 2.145 20 0 BEADLO CCn1c[nH+]cc1COC(=O)CC1(C)CC1 ZINC001345609960 980645590 /nfs/dbraw/zinc/64/55/90/980645590.db2.gz LZVMUCYABRNSFU-UHFFFAOYSA-N 1 2 222.288 2.136 20 0 BEADLO Nc1ccc(CC(=O)c2cccs2)c[nH+]1 ZINC001250305064 980719832 /nfs/dbraw/zinc/71/98/32/980719832.db2.gz QTBZBSJNAOLIHL-UHFFFAOYSA-N 1 2 218.281 2.151 20 0 BEADLO CC(C)Oc1ccc(CCn2cc[nH+]c2)cn1 ZINC001250315580 980746049 /nfs/dbraw/zinc/74/60/49/980746049.db2.gz PWEKLODECQUGNO-UHFFFAOYSA-N 1 2 231.299 2.308 20 0 BEADLO COc1cc(F)cc(CCn2cc[nH+]c2)c1 ZINC001250316075 980746058 /nfs/dbraw/zinc/74/60/58/980746058.db2.gz AFYYSZZCLRBLHQ-UHFFFAOYSA-N 1 2 220.247 2.274 20 0 BEADLO Cc1c[nH]c2ncc(CCn3cc[nH+]c3)cc12 ZINC001250316312 980747630 /nfs/dbraw/zinc/74/76/30/980747630.db2.gz IFISWCKFRLENSS-UHFFFAOYSA-N 1 2 226.283 2.311 20 0 BEADLO c1cc2cc(CCn3cc[nH+]c3)cnc2[nH]1 ZINC001250315555 980754371 /nfs/dbraw/zinc/75/43/71/980754371.db2.gz OQLPUFITOVOSBL-UHFFFAOYSA-N 1 2 212.256 2.002 20 0 BEADLO CC(C)Oc1cc(CCn2cc[nH+]c2)c(F)cn1 ZINC001250316761 980757143 /nfs/dbraw/zinc/75/71/43/980757143.db2.gz WSBIVBQLUIEWHE-UHFFFAOYSA-N 1 2 249.289 2.447 20 0 BEADLO CC[C@H]1CCCN(C(=O)CCc2[nH+]ccn2C)C1 ZINC001346172799 980775596 /nfs/dbraw/zinc/77/55/96/980775596.db2.gz BJDMZVISKDHDDJ-LBPRGKRZSA-N 1 2 249.358 2.001 20 0 BEADLO CC[C@@]1(C)CCN(C(=O)CCc2[nH+]ccn2C)C1 ZINC001346408286 980829384 /nfs/dbraw/zinc/82/93/84/980829384.db2.gz DXIKDIKQWBSPSX-AWEZNQCLSA-N 1 2 249.358 2.001 20 0 BEADLO COC(C)(C)Cc1ccc2[nH+]ccn2c1 ZINC001250350843 980838570 /nfs/dbraw/zinc/83/85/70/980838570.db2.gz QRLPQGHMUIFFMN-UHFFFAOYSA-N 1 2 204.273 2.302 20 0 BEADLO CCN(CC)C(=O)c1ccccc1-n1cc[nH+]c1 ZINC001190075349 980847563 /nfs/dbraw/zinc/84/75/63/980847563.db2.gz PYINIAUHOZHJAB-UHFFFAOYSA-N 1 2 243.310 2.354 20 0 BEADLO CC(=O)Nc1ccccc1-c1cc[nH+]c(N)c1 ZINC001239779005 980911590 /nfs/dbraw/zinc/91/15/90/980911590.db2.gz HLSHPBCLOSHIIZ-UHFFFAOYSA-N 1 2 227.267 2.289 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1ccc(N)nc1F ZINC001239822311 980966776 /nfs/dbraw/zinc/96/67/76/980966776.db2.gz GNYJVAYVVSOOTJ-UHFFFAOYSA-N 1 2 246.289 2.239 20 0 BEADLO Fc1cccc([C@H]2CC[N@@H+]2CC2=NOCC2)c1 ZINC001191390806 981021840 /nfs/dbraw/zinc/02/18/40/981021840.db2.gz QEKSGJQSHPIMHQ-CYBMUJFWSA-N 1 2 234.274 2.349 20 0 BEADLO Fc1cccc([C@H]2CC[N@H+]2CC2=NOCC2)c1 ZINC001191390806 981021850 /nfs/dbraw/zinc/02/18/50/981021850.db2.gz QEKSGJQSHPIMHQ-CYBMUJFWSA-N 1 2 234.274 2.349 20 0 BEADLO Cc1nc([C@@H](C)[NH2+][C@@H](C)CSCCF)no1 ZINC001347393681 981066766 /nfs/dbraw/zinc/06/67/66/981066766.db2.gz BZZYQGOKVJQKGF-JGVFFNPUSA-N 1 2 247.339 2.120 20 0 BEADLO CCC[C@H]1CCCN1C(=O)CCc1c[nH+]cn1C ZINC001347412302 981073861 /nfs/dbraw/zinc/07/38/61/981073861.db2.gz AWCOBFPDPRWKTK-LBPRGKRZSA-N 1 2 249.358 2.144 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cnn(C2CCOCC2)c1 ZINC001240081541 981111992 /nfs/dbraw/zinc/11/19/92/981111992.db2.gz HZZKXSQTQLYPSI-OJTWMYIASA-N 1 2 233.315 2.110 20 0 BEADLO c1cn2cc(-c3ccc4nccnc4n3)ccc2[nH+]1 ZINC001240215383 981164001 /nfs/dbraw/zinc/16/40/01/981164001.db2.gz YKDHZCZMNUHAPG-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO Cc1ncnc(C)c1-c1ccc2[nH+]ccn2c1 ZINC001240219330 981168903 /nfs/dbraw/zinc/16/89/03/981168903.db2.gz GRMRTMDQXLLWIV-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO CCc1ncncc1-c1ccc2[nH+]ccn2c1 ZINC001240219050 981169652 /nfs/dbraw/zinc/16/96/52/981169652.db2.gz WMEYWDOJSHCXSV-UHFFFAOYSA-N 1 2 224.267 2.354 20 0 BEADLO CO[C@@H]1C[N@H+](Cc2cc(C)ccc2F)C[C@@H]1F ZINC001205617449 981219534 /nfs/dbraw/zinc/21/95/34/981219534.db2.gz XQWMYZGMYLMIKD-QWHCGFSZSA-N 1 2 241.281 2.303 20 0 BEADLO CO[C@@H]1C[N@@H+](Cc2cc(C)ccc2F)C[C@@H]1F ZINC001205617449 981219540 /nfs/dbraw/zinc/21/95/40/981219540.db2.gz XQWMYZGMYLMIKD-QWHCGFSZSA-N 1 2 241.281 2.303 20 0 BEADLO CO[C@H]1C[N@H+](Cc2cc(C)ccc2F)C[C@@H]1F ZINC001205617451 981220840 /nfs/dbraw/zinc/22/08/40/981220840.db2.gz XQWMYZGMYLMIKD-STQMWFEESA-N 1 2 241.281 2.303 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@@H](C)C(C)(F)F ZINC001347971193 981232066 /nfs/dbraw/zinc/23/20/66/981232066.db2.gz IBAFKIJHBCCOKN-MRVPVSSYSA-N 1 2 246.257 2.238 20 0 BEADLO c1[nH+]cn2ccnc(N3CCC[C@H]3C3CCC3)c12 ZINC001347980876 981233889 /nfs/dbraw/zinc/23/38/89/981233889.db2.gz HIRDLVHSMGUGKO-LBPRGKRZSA-N 1 2 242.326 2.498 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cc(C(F)(F)F)nn1C ZINC001240288730 981235568 /nfs/dbraw/zinc/23/55/68/981235568.db2.gz HXPVGTXUIKVCAN-HJIKTHEYSA-N 1 2 231.221 2.315 20 0 BEADLO Cn1ncc2ccc(-c3cc[nH+]c(N)c3)cc21 ZINC001240308067 981278901 /nfs/dbraw/zinc/27/89/01/981278901.db2.gz IPMCWVYXVJQIHK-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc2ncn(C)c2c1 ZINC001240320999 981293619 /nfs/dbraw/zinc/29/36/19/981293619.db2.gz FYJJPFWYCTYWHM-DROBUMMNSA-N 1 2 213.284 2.449 20 0 BEADLO Cc1cc(-c2ccc(=O)n(C)c2)c2[nH+]ccn2c1 ZINC001240333111 981303167 /nfs/dbraw/zinc/30/31/67/981303167.db2.gz XLWXEVHTSQKIJN-UHFFFAOYSA-N 1 2 239.278 2.008 20 0 BEADLO Cn1cc[nH+]c1CCC(=O)N[C@@H]1CCC(C)(C)C1 ZINC001348186927 981307268 /nfs/dbraw/zinc/30/72/68/981307268.db2.gz AWHHTIQWWBDFKT-LLVKDONJSA-N 1 2 249.358 2.048 20 0 BEADLO Cc1c[nH]c(CCNC(=O)c2ccsc2C)[nH+]1 ZINC001193385739 981311570 /nfs/dbraw/zinc/31/15/70/981311570.db2.gz ZCEDEWOCQZSIIF-UHFFFAOYSA-N 1 2 249.339 2.061 20 0 BEADLO CC(C)OC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001193458617 981334754 /nfs/dbraw/zinc/33/47/54/981334754.db2.gz FOHQMSSBXMTQCS-UHFFFAOYSA-N 1 2 219.244 2.291 20 0 BEADLO CCN(C(=O)OC1CCCCC1)C1C[NH+](C)C1 ZINC001193627144 981390746 /nfs/dbraw/zinc/39/07/46/981390746.db2.gz FQWSHNPGCAYDRV-UHFFFAOYSA-N 1 2 240.347 2.092 20 0 BEADLO CC[C@H](C)C(=O)N1CCC(Cc2c[nH]c[nH+]2)CC1 ZINC001348557757 981391494 /nfs/dbraw/zinc/39/14/94/981391494.db2.gz HDDUTECZLYMNFK-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO CCC(CC)C(=O)OCCCc1c[nH+]cn1C ZINC001348626745 981409992 /nfs/dbraw/zinc/40/99/92/981409992.db2.gz PUBMFJLMMFDZHC-UHFFFAOYSA-N 1 2 238.331 2.332 20 0 BEADLO c1cn2ccc(-c3ncnc4cnccc43)cc2[nH+]1 ZINC001240496110 981416221 /nfs/dbraw/zinc/41/62/21/981416221.db2.gz GOYIQPBRJSBHJY-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO c1cn2ccc(-c3ncc4c(n3)CCC4)cc2[nH+]1 ZINC001240496745 981417057 /nfs/dbraw/zinc/41/70/57/981417057.db2.gz RVVDIOJMHSEOFC-UHFFFAOYSA-N 1 2 236.278 2.280 20 0 BEADLO Cn1cnc2c1ccnc2-c1ccn2cc[nH+]c2c1 ZINC001240496218 981417932 /nfs/dbraw/zinc/41/79/32/981417932.db2.gz IJSJYIJENMFHSW-UHFFFAOYSA-N 1 2 249.277 2.283 20 0 BEADLO Cn1ccc2ncnc(-c3ccn4cc[nH+]c4c3)c21 ZINC001240496681 981418405 /nfs/dbraw/zinc/41/84/05/981418405.db2.gz PVSHYUOXDIEXPD-UHFFFAOYSA-N 1 2 249.277 2.283 20 0 BEADLO c1cn2ccc(-c3ccc4c(n3)COC4)cc2[nH+]1 ZINC001240497772 981418848 /nfs/dbraw/zinc/41/88/48/981418848.db2.gz ZFMLNDLGSKWSOX-UHFFFAOYSA-N 1 2 237.262 2.427 20 0 BEADLO C[C@H]1CCCN(C(=O)CCc2[nH+]ccn2C)CC1 ZINC001348713563 981424627 /nfs/dbraw/zinc/42/46/27/981424627.db2.gz ZFOVCGFZWQUTOL-LBPRGKRZSA-N 1 2 249.358 2.001 20 0 BEADLO c1cn2ccc(-c3cnc4nccnc4c3)cc2[nH+]1 ZINC001240503023 981430644 /nfs/dbraw/zinc/43/06/44/981430644.db2.gz GBJRQIZBYMVGNK-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO COc1cnc(C)nc1-c1ccn2cc[nH+]c2c1 ZINC001240503932 981431904 /nfs/dbraw/zinc/43/19/04/981431904.db2.gz IKNAXPKOHDPZOZ-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO FCc1cnc(-c2ccn3cc[nH+]c3c2)nc1 ZINC001240502921 981432024 /nfs/dbraw/zinc/43/20/24/981432024.db2.gz ALTAGLJKMQPRSB-UHFFFAOYSA-N 1 2 228.230 2.261 20 0 BEADLO Cn1cc[nH+]c1CCC(=O)N1CCC(C)(C)CC1 ZINC001348763262 981439362 /nfs/dbraw/zinc/43/93/62/981439362.db2.gz UACZTKOMGMHMJY-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO CC(C)COC(=O)NCc1ccc2[nH+]ccn2c1 ZINC001193873216 981488604 /nfs/dbraw/zinc/48/86/04/981488604.db2.gz XWFFCTZMIXNFJU-UHFFFAOYSA-N 1 2 247.298 2.217 20 0 BEADLO COC(=O)Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001193903300 981505798 /nfs/dbraw/zinc/50/57/98/981505798.db2.gz SIKNVWJXTWJYHF-UHFFFAOYSA-N 1 2 231.255 2.110 20 0 BEADLO CCCC[C@H](CC)COC(=O)NC1C[NH+](C)C1 ZINC001193974658 981523311 /nfs/dbraw/zinc/52/33/11/981523311.db2.gz DUURPMARDBZKER-NSHDSACASA-N 1 2 242.363 2.243 20 0 BEADLO CC[C@@H](F)C(=O)Nc1cccc2[nH+]ccn21 ZINC001349307616 981531568 /nfs/dbraw/zinc/53/15/68/981531568.db2.gz ORXKITZTCDGUCW-MRVPVSSYSA-N 1 2 221.235 2.021 20 0 BEADLO CCCCCCOC(=O)NCc1c[nH+]cn1C ZINC001194156702 981581285 /nfs/dbraw/zinc/58/12/85/981581285.db2.gz ZEQGQSNKPQHFHX-UHFFFAOYSA-N 1 2 239.319 2.227 20 0 BEADLO COCc1cc[nH+]c(N[C@H](COC)C(C)C)c1 ZINC001349581080 981583268 /nfs/dbraw/zinc/58/32/68/981583268.db2.gz KMLZFCZPRBSDQH-GFCCVEGCSA-N 1 2 238.331 2.311 20 0 BEADLO Cc1cc(-c2cc(F)ccc2O)c[nH+]c1N ZINC001240698570 981621339 /nfs/dbraw/zinc/62/13/39/981621339.db2.gz OLTXJWBVOWFSAT-UHFFFAOYSA-N 1 2 218.231 2.484 20 0 BEADLO Cn1c[nH+]cc1C1CCN(C(=O)C(C)(C)C)CC1 ZINC001349715186 981661629 /nfs/dbraw/zinc/66/16/29/981661629.db2.gz XREBYBUKZAVJFC-UHFFFAOYSA-N 1 2 249.358 2.172 20 0 BEADLO Cc1cc(-c2ccn3cc(N)[nH+]c3c2)ccn1 ZINC001240716364 981725042 /nfs/dbraw/zinc/72/50/42/981725042.db2.gz CXAMZXLPSISQLE-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO Nc1cc(COC(=O)[C@@H]2CCC[C@H]3C[C@H]32)cc[nH+]1 ZINC001350087650 981866299 /nfs/dbraw/zinc/86/62/99/981866299.db2.gz AMCFKLZQMDXTHC-QJPTWQEYSA-N 1 2 246.310 2.143 20 0 BEADLO CC[C@H](C)CC(=O)OCc1c[nH+]cn1CC ZINC001350345129 981935688 /nfs/dbraw/zinc/93/56/88/981935688.db2.gz RBRKXTBIZMAFPY-JTQLQIEISA-N 1 2 224.304 2.382 20 0 BEADLO CN(C)c1cccc(-c2c[nH+]cn2C)c1 ZINC001240984764 982066237 /nfs/dbraw/zinc/06/62/37/982066237.db2.gz ZQQBAOKEFZSSJA-UHFFFAOYSA-N 1 2 201.273 2.153 20 0 BEADLO CC[C@@H](C)OC(=O)NCc1c[nH+]cn1C(C)C ZINC001195150968 982136898 /nfs/dbraw/zinc/13/68/98/982136898.db2.gz OSSMQIYGEAFWOD-SNVBAGLBSA-N 1 2 239.319 2.489 20 0 BEADLO CC[C@H](C)OC(=O)NCc1ccc2[nH+]ccn2c1 ZINC001195162644 982146790 /nfs/dbraw/zinc/14/67/90/982146790.db2.gz SUYZXIIFLFTSPV-JTQLQIEISA-N 1 2 247.298 2.359 20 0 BEADLO Cc1ccc(-c2cc[nH+]c3c2CCN3)c(O)c1 ZINC001241051307 982154055 /nfs/dbraw/zinc/15/40/55/982154055.db2.gz PZNIXFODLSIYEU-UHFFFAOYSA-N 1 2 226.279 2.373 20 0 BEADLO CC[C@H](C)N(CC)C(=O)[C@H](C)n1cc[nH+]c1 ZINC001351044321 982184994 /nfs/dbraw/zinc/18/49/94/982184994.db2.gz LBCFPIOCQQDOTM-QWRGUYRKSA-N 1 2 223.320 2.091 20 0 BEADLO CC[C@H](C)N(CC)C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001351044322 982185720 /nfs/dbraw/zinc/18/57/20/982185720.db2.gz LBCFPIOCQQDOTM-WDEREUQCSA-N 1 2 223.320 2.091 20 0 BEADLO CCNC(=S)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001195300112 982186160 /nfs/dbraw/zinc/18/61/60/982186160.db2.gz IHURITDGBLTMBH-UHFFFAOYSA-N 1 2 246.339 2.179 20 0 BEADLO COc1cc(C)[nH+]cc1-c1ccc[nH]c1=O ZINC001241118867 982240140 /nfs/dbraw/zinc/24/01/40/982240140.db2.gz HJABBOPMZJNBBM-UHFFFAOYSA-N 1 2 216.240 2.166 20 0 BEADLO COC(=[NH2+])c1cccc(-c2ccc[nH]c2=O)c1 ZINC001241121112 982246020 /nfs/dbraw/zinc/24/60/20/982246020.db2.gz BJHHXOUFOHYKAH-UHFFFAOYSA-N 1 2 228.251 2.426 20 0 BEADLO CC(C)Oc1ccc[nH+]c1N[C@H](C)CCO ZINC000159484183 982246738 /nfs/dbraw/zinc/24/67/38/982246738.db2.gz ALSVJXBIVYUOEP-SNVBAGLBSA-N 1 2 224.304 2.052 20 0 BEADLO Cc1ncc(-c2cc[nH+]c(N)c2)cc1F ZINC001241161923 982298879 /nfs/dbraw/zinc/29/88/79/982298879.db2.gz BBUGAPCFNOQSNG-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO CC(=O)Nc1ccc(F)cc1-c1cc[nH+]c(N)c1 ZINC001241162800 982303622 /nfs/dbraw/zinc/30/36/22/982303622.db2.gz MJMZZBBBYPCTPB-UHFFFAOYSA-N 1 2 245.257 2.428 20 0 BEADLO COC(=O)c1cc(-c2cc[nH+]c(N)c2)ccc1F ZINC001241163803 982305789 /nfs/dbraw/zinc/30/57/89/982305789.db2.gz OPZZTWQYWZKPRT-UHFFFAOYSA-N 1 2 246.241 2.257 20 0 BEADLO Cc1c(F)cncc1-c1cc[nH+]c(N)c1 ZINC001241169950 982310220 /nfs/dbraw/zinc/31/02/20/982310220.db2.gz SCEMAYYWPNWODX-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO CC(C)n1cc(-c2cc[nH+]c(N)c2)ccc1=O ZINC001241169546 982311302 /nfs/dbraw/zinc/31/13/02/982311302.db2.gz DRQYPBNGGQUGJQ-UHFFFAOYSA-N 1 2 229.283 2.073 20 0 BEADLO CC(C)n1ccc(-c2cc[nH+]c(N)c2)cc1=O ZINC001241169560 982311843 /nfs/dbraw/zinc/31/18/43/982311843.db2.gz FFNNYOJZJLSVFU-UHFFFAOYSA-N 1 2 229.283 2.073 20 0 BEADLO Nc1cc(-c2cnc3ccncc3c2)cc[nH+]1 ZINC001241169671 982314139 /nfs/dbraw/zinc/31/41/39/982314139.db2.gz KFPDTTNJBQSFPS-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO COC(=O)c1cc(C)cc(-c2cc[nH+]c(N)c2)c1 ZINC001241170376 982317453 /nfs/dbraw/zinc/31/74/53/982317453.db2.gz JSKNSTLAAUHVKN-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO Nc1cc(-c2cccc(C3COC3)c2)cc[nH+]1 ZINC001241170300 982319992 /nfs/dbraw/zinc/31/99/92/982319992.db2.gz HAUQELOQCCYMCC-UHFFFAOYSA-N 1 2 226.279 2.445 20 0 BEADLO Cc1[nH]c(CN2CC3(CCC3)OC[C@@H]2C)[nH+]c1C ZINC001195885473 982369708 /nfs/dbraw/zinc/36/97/08/982369708.db2.gz XRKXMIIABOBJAL-JTQLQIEISA-N 1 2 249.358 2.170 20 0 BEADLO Cc1cnnc(-c2c[nH+]c(N(C)C)cc2C)c1 ZINC001241227691 982378025 /nfs/dbraw/zinc/37/80/25/982378025.db2.gz AQOIZTZLUUBTFZ-UHFFFAOYSA-N 1 2 228.299 2.221 20 0 BEADLO CCc1nccnc1-c1c[nH+]c(N(C)C)cc1C ZINC001241233752 982385871 /nfs/dbraw/zinc/38/58/71/982385871.db2.gz TXCFGUSZGLMCKE-UHFFFAOYSA-N 1 2 242.326 2.475 20 0 BEADLO CC(C)/C=C/C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000278778245 982592128 /nfs/dbraw/zinc/59/21/28/982592128.db2.gz UXHFDIMXVSCXPL-ONEGZZNKSA-N 1 2 247.342 2.259 20 0 BEADLO Nc1cccc(-c2ccc3c(c2)OCCN3)[nH+]1 ZINC001241445206 982600150 /nfs/dbraw/zinc/60/01/50/982600150.db2.gz ZGCFSRVHMKXBCH-UHFFFAOYSA-N 1 2 227.267 2.135 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc2c(c1)OCCN2 ZINC001241453461 982606980 /nfs/dbraw/zinc/60/69/80/982606980.db2.gz FPWJFGWYZPGXDW-ZRSOPRJESA-N 1 2 216.284 2.367 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cccc2cn(C)nc21 ZINC001241469179 982623427 /nfs/dbraw/zinc/62/34/27/982623427.db2.gz MUINQXATKUBNEB-DXNUHORPSA-N 1 2 213.284 2.449 20 0 BEADLO Nc1cn2ccc(-c3cncs3)cc2[nH+]1 ZINC001241497419 982656420 /nfs/dbraw/zinc/65/64/20/982656420.db2.gz ITNGKPRMLYTIFN-UHFFFAOYSA-N 1 2 216.269 2.040 20 0 BEADLO CO[C@@H](C)C[N@@H+]1CC(F)(F)CC[C@H]1C ZINC001198640269 982811668 /nfs/dbraw/zinc/81/16/68/982811668.db2.gz AYGRFMISCINFCT-BDAKNGLRSA-N 1 2 207.264 2.141 20 0 BEADLO CO[C@@H](C)C[N@H+]1CC(F)(F)CC[C@H]1C ZINC001198640269 982811670 /nfs/dbraw/zinc/81/16/70/982811670.db2.gz AYGRFMISCINFCT-BDAKNGLRSA-N 1 2 207.264 2.141 20 0 BEADLO CC(C)CC[C@@H](O)C[NH2+]CC(F)(F)C(F)F ZINC001353338100 982840285 /nfs/dbraw/zinc/84/02/85/982840285.db2.gz DHZHCBKOJHHREH-MRVPVSSYSA-N 1 2 245.260 2.274 20 0 BEADLO CCC1(CC)CCN(C(=O)Cc2[nH]c[nH+]c2C)C1 ZINC001353355573 982847904 /nfs/dbraw/zinc/84/79/04/982847904.db2.gz CUJHGYNUCLBAFU-UHFFFAOYSA-N 1 2 249.358 2.299 20 0 BEADLO Nc1[nH+]cccc1-c1cccc2c[nH]nc21 ZINC001241621671 982856207 /nfs/dbraw/zinc/85/62/07/982856207.db2.gz VSOYDTDYNDCJCG-UHFFFAOYSA-N 1 2 210.240 2.207 20 0 BEADLO O=C(CCCn1cc[nH+]c1)N1C[C@H]2CCCC[C@H]21 ZINC001300328123 982878090 /nfs/dbraw/zinc/87/80/90/982878090.db2.gz NTBBWOGGEUQXMF-CHWSQXEVSA-N 1 2 247.342 2.064 20 0 BEADLO Cn1c[nH+]cc1-c1ccnc(Br)c1 ZINC001241708826 982971788 /nfs/dbraw/zinc/97/17/88/982971788.db2.gz NGKTZYXUTVXQAN-UHFFFAOYSA-N 1 2 238.088 2.245 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cnn(C2CCC2)c1 ZINC001241722576 983007766 /nfs/dbraw/zinc/00/77/66/983007766.db2.gz IJRDXXFYDYXCJG-DROBUMMNSA-N 1 2 203.289 2.484 20 0 BEADLO COCCOc1ccc(-c2cccc(N)[nH+]2)cc1 ZINC001241744837 983029483 /nfs/dbraw/zinc/02/94/83/983029483.db2.gz HJPWMTUNRNJCGO-UHFFFAOYSA-N 1 2 244.294 2.356 20 0 BEADLO Cc1nnc(-c2cccc(-c3c[nH+]cn3C)c2)o1 ZINC001241934129 983145969 /nfs/dbraw/zinc/14/59/69/983145969.db2.gz AFDDIJYHXVEMDJ-UHFFFAOYSA-N 1 2 240.266 2.446 20 0 BEADLO CCOc1cncc(Nc2ccc(N)[nH+]c2)c1 ZINC001201279439 983156423 /nfs/dbraw/zinc/15/64/23/983156423.db2.gz WDIPRSFAGPMRQK-UHFFFAOYSA-N 1 2 230.271 2.201 20 0 BEADLO Cc1ccc(Nc2ccc(N)[nH+]c2)cc1O ZINC001201286031 983161301 /nfs/dbraw/zinc/16/13/01/983161301.db2.gz VCRYNDTYNVOITO-UHFFFAOYSA-N 1 2 215.256 2.421 20 0 BEADLO Nc1ccc(Nc2cc(F)c(F)cc2O)c[nH+]1 ZINC001201285879 983161951 /nfs/dbraw/zinc/16/19/51/983161951.db2.gz RLJFRVFQGHQQOB-UHFFFAOYSA-N 1 2 237.209 2.391 20 0 BEADLO Nc1ccc(Nc2ccc(F)c(CO)c2)c[nH+]1 ZINC001201287011 983164520 /nfs/dbraw/zinc/16/45/20/983164520.db2.gz NXVCZGONXPHABG-UHFFFAOYSA-N 1 2 233.246 2.039 20 0 BEADLO Nc1cc2c(ccn2-c2ccc(N)[nH+]c2)c(F)c1 ZINC001201292632 983171332 /nfs/dbraw/zinc/17/13/32/983171332.db2.gz QQCMKNQTZSENCO-UHFFFAOYSA-N 1 2 242.257 2.329 20 0 BEADLO Cc1ncccc1Nc1ccc(N)[nH+]c1 ZINC001201272374 983173149 /nfs/dbraw/zinc/17/31/49/983173149.db2.gz MCPXLFHRITYOAG-UHFFFAOYSA-N 1 2 200.245 2.111 20 0 BEADLO CC(C)(C)c1nnc(Nc2ccc(N)[nH+]c2)o1 ZINC001201272416 983173625 /nfs/dbraw/zinc/17/36/25/983173625.db2.gz NXOQHHYRGOUAIZ-UHFFFAOYSA-N 1 2 233.275 2.088 20 0 BEADLO Nc1ccc(Nc2nnc(-c3ccco3)o2)c[nH+]1 ZINC001201272228 983173689 /nfs/dbraw/zinc/17/36/89/983173689.db2.gz KRPKRQOYGAFLAQ-UHFFFAOYSA-N 1 2 243.226 2.050 20 0 BEADLO CC(C)n1cc(Nc2ccc(N)[nH+]c2)cn1 ZINC001201275862 983175058 /nfs/dbraw/zinc/17/50/58/983175058.db2.gz LKVIVOCJOYYJGS-UHFFFAOYSA-N 1 2 217.276 2.185 20 0 BEADLO Nc1ccc(Nc2csc3nccnc23)c[nH+]1 ZINC001201275752 983175471 /nfs/dbraw/zinc/17/54/71/983175471.db2.gz LGXASQOZDPFGLL-UHFFFAOYSA-N 1 2 243.295 2.412 20 0 BEADLO Nc1ccc(Nc2ccnc(Cl)c2O)c[nH+]1 ZINC001201278322 983178125 /nfs/dbraw/zinc/17/81/25/983178125.db2.gz AJVNEKBSCTUJQL-UHFFFAOYSA-N 1 2 236.662 2.161 20 0 BEADLO Cc1cc(CO)cc(Nc2ccc(N)[nH+]c2)c1 ZINC001201294909 983182382 /nfs/dbraw/zinc/18/23/82/983182382.db2.gz KOIGHQGHLVBBBQ-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO CCOC(=O)COc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001242018342 983221008 /nfs/dbraw/zinc/22/10/08/983221008.db2.gz JGTMGFDOLZAIIH-UHFFFAOYSA-N 1 2 246.266 2.019 20 0 BEADLO Cc1cccc(C)c1CN(C)c1cc(N)nc[nH+]1 ZINC001354278337 983245177 /nfs/dbraw/zinc/24/51/77/983245177.db2.gz KSQQCVHJEKMLKI-UHFFFAOYSA-N 1 2 242.326 2.312 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@H](C)C2(C)CC2)c1 ZINC001354289579 983258734 /nfs/dbraw/zinc/25/87/34/983258734.db2.gz HMQCMJIMIIGWAA-SNVBAGLBSA-N 1 2 248.326 2.398 20 0 BEADLO COc1ccncc1-c1cccc2[nH+]ccn21 ZINC001242057253 983264918 /nfs/dbraw/zinc/26/49/18/983264918.db2.gz NBLDIHXHBFQSAD-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO Cc1nc(N2CCO[C@H](C(C)(C)C)CC2)cc[nH+]1 ZINC001354372648 983294274 /nfs/dbraw/zinc/29/42/74/983294274.db2.gz NQISEPKBKBWITI-LBPRGKRZSA-N 1 2 249.358 2.426 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1ncnc2ccoc21 ZINC001242071230 983304553 /nfs/dbraw/zinc/30/45/53/983304553.db2.gz XIXVKILLWCMLHK-UHFFFAOYSA-N 1 2 226.239 2.175 20 0 BEADLO Cc1cnc(-c2c[nH+]c(N)cc2C)c(C)n1 ZINC001242070911 983304971 /nfs/dbraw/zinc/30/49/71/983304971.db2.gz PHXJYWZPFBLAQZ-UHFFFAOYSA-N 1 2 214.272 2.046 20 0 BEADLO CCCc1ccc(-c2c[nH+]c(N)cc2C)nn1 ZINC001242078045 983324848 /nfs/dbraw/zinc/32/48/48/983324848.db2.gz QEQABQPQHMQHCH-UHFFFAOYSA-N 1 2 228.299 2.382 20 0 BEADLO CSc1ccc(-c2c[nH+]c(N)cc2C)nn1 ZINC001242078930 983328476 /nfs/dbraw/zinc/32/84/76/983328476.db2.gz UBJQEGKICIKMKF-UHFFFAOYSA-N 1 2 232.312 2.151 20 0 BEADLO C[N@H+]1CCC[C@H]2C[NH+](CCc3ccccc3)C[C@H]21 ZINC001201606095 983374386 /nfs/dbraw/zinc/37/43/86/983374386.db2.gz IJZYYHDXBSEGEN-JKSUJKDBSA-N 1 2 244.382 2.255 20 0 BEADLO C[NH+]1CCC[C@H]2C[N@H+](CCc3ccccc3)C[C@H]21 ZINC001201606095 983374397 /nfs/dbraw/zinc/37/43/97/983374397.db2.gz IJZYYHDXBSEGEN-JKSUJKDBSA-N 1 2 244.382 2.255 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2c(c1)CCC2=O ZINC001242155044 983384425 /nfs/dbraw/zinc/38/44/25/983384425.db2.gz QAXUABPTBHVQNN-UHFFFAOYSA-N 1 2 224.263 2.460 20 0 BEADLO CSCCC[NH+]1CC(F)(C2CC2)C1 ZINC001201682072 983393270 /nfs/dbraw/zinc/39/32/70/983393270.db2.gz MYGKQBZZIGSKIX-UHFFFAOYSA-N 1 2 203.326 2.173 20 0 BEADLO CCCN1CC[C@H]([NH+]2CCCC2)C(F)(F)C1 ZINC001201652034 983404311 /nfs/dbraw/zinc/40/43/11/983404311.db2.gz FWWOPYRAPXIIGC-NSHDSACASA-N 1 2 232.318 2.202 20 0 BEADLO FC[C@H]1CC[N@H+](CC2CC2)CC1(F)F ZINC001201875779 983496334 /nfs/dbraw/zinc/49/63/34/983496334.db2.gz INIDFCZIFROJFN-SECBINFHSA-N 1 2 207.239 2.323 20 0 BEADLO FC[C@H]1CC[N@@H+](CC2CC2)CC1(F)F ZINC001201875779 983496342 /nfs/dbraw/zinc/49/63/42/983496342.db2.gz INIDFCZIFROJFN-SECBINFHSA-N 1 2 207.239 2.323 20 0 BEADLO FC1(F)CN(CC2CC2)CC[C@@H]1[NH+]1CCCC1 ZINC001201952285 983524289 /nfs/dbraw/zinc/52/42/89/983524289.db2.gz JZIZVIMOCZUIOO-LBPRGKRZSA-N 1 2 244.329 2.202 20 0 BEADLO Nc1cn2ccc(-c3cccc(F)c3O)cc2[nH+]1 ZINC001242350884 983623634 /nfs/dbraw/zinc/62/36/34/983623634.db2.gz ACJYOKORERMAPI-UHFFFAOYSA-N 1 2 243.241 2.428 20 0 BEADLO Oc1c(F)cccc1-c1cc[nH+]c2c1CCN2 ZINC001242354278 983635372 /nfs/dbraw/zinc/63/53/72/983635372.db2.gz WVXUEVUBYFWJRN-UHFFFAOYSA-N 1 2 230.242 2.204 20 0 BEADLO CCc1nc(C[NH2+]Cc2ccc(C)nc2)co1 ZINC001202436579 983659537 /nfs/dbraw/zinc/65/95/37/983659537.db2.gz VKFRLIDHTLNCKO-UHFFFAOYSA-N 1 2 231.299 2.230 20 0 BEADLO Nc1[nH+]cccc1-c1ccc(OC(F)F)nc1 ZINC001242419239 983728266 /nfs/dbraw/zinc/72/82/66/983728266.db2.gz IYKKYZJGQDSCMD-UHFFFAOYSA-N 1 2 237.209 2.327 20 0 BEADLO Cc1cn2c(cccc2-c2ccn(C)n2)[nH+]1 ZINC001242459025 983769475 /nfs/dbraw/zinc/76/94/75/983769475.db2.gz QERGWNIUYOGOSI-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO Nc1[nH+]cccc1-c1cnn(C(F)(F)F)c1 ZINC001242463339 983791019 /nfs/dbraw/zinc/79/10/19/983791019.db2.gz LRJJYNVGQNDLOM-UHFFFAOYSA-N 1 2 228.177 2.004 20 0 BEADLO C[C@@H](O)c1cccc(-c2ccc(N)[nH+]c2)c1 ZINC001242550176 983871047 /nfs/dbraw/zinc/87/10/47/983871047.db2.gz NMSPDSIUSPLHIZ-SECBINFHSA-N 1 2 214.268 2.384 20 0 BEADLO CC(C)n1nccc1-c1cc[nH+]c2c1CCN2 ZINC001242559469 983882550 /nfs/dbraw/zinc/88/25/50/983882550.db2.gz JWYUBMUBIHMANC-UHFFFAOYSA-N 1 2 228.299 2.494 20 0 BEADLO CC[C@@]12C[C@@H](CO1)[N@H+](Cc1cnn(C(C)C)c1)C2 ZINC001137080579 983917643 /nfs/dbraw/zinc/91/76/43/983917643.db2.gz NUQBAKPIBXSQJQ-KBPBESRZSA-N 1 2 249.358 2.217 20 0 BEADLO CC[C@@]12C[C@@H](CO1)[N@@H+](Cc1cnn(C(C)C)c1)C2 ZINC001137080579 983917650 /nfs/dbraw/zinc/91/76/50/983917650.db2.gz NUQBAKPIBXSQJQ-KBPBESRZSA-N 1 2 249.358 2.217 20 0 BEADLO CC(=O)[C@@H]1CCC[N@H+]1Cc1cnn(C(C)C)c1 ZINC001137083063 983932143 /nfs/dbraw/zinc/93/21/43/983932143.db2.gz ZRJNUZXAXYBMBL-ZDUSSCGKSA-N 1 2 235.331 2.017 20 0 BEADLO CC(=O)[C@@H]1CCC[N@@H+]1Cc1cnn(C(C)C)c1 ZINC001137083063 983932155 /nfs/dbraw/zinc/93/21/55/983932155.db2.gz ZRJNUZXAXYBMBL-ZDUSSCGKSA-N 1 2 235.331 2.017 20 0 BEADLO Cc1cccc2c(C[N@@H+](C)C3(C)COC3)[nH]nc21 ZINC001137149023 983975575 /nfs/dbraw/zinc/97/55/75/983975575.db2.gz AXBBUKQATACQMD-UHFFFAOYSA-N 1 2 245.326 2.092 20 0 BEADLO Cc1cccc2c(C[N@H+](C)C3(C)COC3)[nH]nc21 ZINC001137149023 983975592 /nfs/dbraw/zinc/97/55/92/983975592.db2.gz AXBBUKQATACQMD-UHFFFAOYSA-N 1 2 245.326 2.092 20 0 BEADLO Cc1cc[nH+]c(Nc2cccc(=O)[nH]2)c1 ZINC001212786077 984011435 /nfs/dbraw/zinc/01/14/35/984011435.db2.gz CHGODZBFEBCKFS-UHFFFAOYSA-N 1 2 201.229 2.234 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cc(CO)ccc1C ZINC001242667125 984034726 /nfs/dbraw/zinc/03/47/26/984034726.db2.gz AEYXLXYMOURKRB-DROBUMMNSA-N 1 2 203.285 2.363 20 0 BEADLO COc1cc(/C(C)=C/C=C/[NH3+])cc(C)n1 ZINC001242748562 984104786 /nfs/dbraw/zinc/10/47/86/984104786.db2.gz UGSOIDMIBVTFCS-REZHQCRGSA-N 1 2 204.273 2.274 20 0 BEADLO CC(=O)NCc1cc(/C(C)=C/C=C/[NH3+])ccc1F ZINC001242829566 984184311 /nfs/dbraw/zinc/18/43/11/984184311.db2.gz IMFSWRYJBDVMIE-DROBUMMNSA-N 1 2 248.301 2.338 20 0 BEADLO Nc1ccc(-c2cc(F)c(N)c(F)c2)c[nH+]1 ZINC001242840690 984189407 /nfs/dbraw/zinc/18/94/07/984189407.db2.gz WCOCZDLSTPMOEQ-UHFFFAOYSA-N 1 2 221.210 2.191 20 0 BEADLO Cc1cc(-c2cc(F)c(N)c(F)c2)c[nH+]c1N ZINC001242840810 984190269 /nfs/dbraw/zinc/19/02/69/984190269.db2.gz ZHKNVWDKILZNSD-UHFFFAOYSA-N 1 2 235.237 2.500 20 0 BEADLO c1ccc(C[NH+]2CC(OC[C@H]3CCCO3)C2)cc1 ZINC001205984467 984217497 /nfs/dbraw/zinc/21/74/97/984217497.db2.gz HQLKKZKRKRBVQB-CQSZACIVSA-N 1 2 247.338 2.066 20 0 BEADLO Cc1ccc(-c2ccc(F)c(O)c2)[nH+]c1N ZINC001243046696 984389237 /nfs/dbraw/zinc/38/92/37/984389237.db2.gz FVALKATUFQMDCA-UHFFFAOYSA-N 1 2 218.231 2.484 20 0 BEADLO Nc1cc(-c2ccc(F)c(O)c2)cc[nH+]1 ZINC001243049721 984399585 /nfs/dbraw/zinc/39/95/85/984399585.db2.gz SXCJFBBOMXMJHM-UHFFFAOYSA-N 1 2 204.204 2.176 20 0 BEADLO CS/C=C\C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001274961038 984421032 /nfs/dbraw/zinc/42/10/32/984421032.db2.gz GVPLOSYVJYSTLM-CLTKARDFSA-N 1 2 233.296 2.150 20 0 BEADLO COC(=O)c1cc(-c2c[nH+]cn2C)ccc1F ZINC001243066310 984476569 /nfs/dbraw/zinc/47/65/69/984476569.db2.gz AQFQBWOTCNISKN-UHFFFAOYSA-N 1 2 234.230 2.013 20 0 BEADLO Cc1ncc2ccc(-c3c[nH+]cn3C)cc2n1 ZINC001243067385 984484054 /nfs/dbraw/zinc/48/40/54/984484054.db2.gz LLPVMPYXCCMUSO-UHFFFAOYSA-N 1 2 224.267 2.339 20 0 BEADLO CCc1ccc(-c2c[nH+]cn2C)cc1C(=O)OC ZINC001243067580 984485008 /nfs/dbraw/zinc/48/50/08/984485008.db2.gz LSCCJSCVYNMEEP-UHFFFAOYSA-N 1 2 244.294 2.436 20 0 BEADLO COC(=O)c1ccc(-c2c[nH+]cn2C)c(C)c1C ZINC001243069820 984492106 /nfs/dbraw/zinc/49/21/06/984492106.db2.gz MDWJUUNIYZPQTR-UHFFFAOYSA-N 1 2 244.294 2.491 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2c(c1)C(=O)NC2(C)C ZINC001243070821 984492387 /nfs/dbraw/zinc/49/23/87/984492387.db2.gz ZIBQHFXNRGDYEM-UHFFFAOYSA-N 1 2 241.294 2.066 20 0 BEADLO Cn1c[nH+]cc1-c1cccc2c1COC2 ZINC001243071363 984498600 /nfs/dbraw/zinc/49/86/00/984498600.db2.gz QQMGESISQDVNIQ-UHFFFAOYSA-N 1 2 200.241 2.117 20 0 BEADLO Cc1cc(C)c(-c2cncn2C)c(C)[nH+]1 ZINC001243073074 984508097 /nfs/dbraw/zinc/50/80/97/984508097.db2.gz XYMZOKAUEBHUHK-UHFFFAOYSA-N 1 2 201.273 2.407 20 0 BEADLO C=C/C=C/CC(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC001443386651 984523499 /nfs/dbraw/zinc/52/34/99/984523499.db2.gz ITFPCNIQAQZUPG-OOPCZODUSA-N 1 2 245.326 2.179 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)N[C@H](C)c1cccs1 ZINC001447904840 984800081 /nfs/dbraw/zinc/80/00/81/984800081.db2.gz MTWHVRIBEJTKGK-ZJUUUORDSA-N 1 2 238.356 2.020 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)N[C@H](C)c1cccs1 ZINC001447904840 984800085 /nfs/dbraw/zinc/80/00/85/984800085.db2.gz MTWHVRIBEJTKGK-ZJUUUORDSA-N 1 2 238.356 2.020 20 0 BEADLO CC[NH2+][C@H](C)C(=O)OCc1sccc1Cl ZINC001577813912 984804482 /nfs/dbraw/zinc/80/44/82/984804482.db2.gz FQISUPZPYDMDLX-SSDOTTSWSA-N 1 2 247.747 2.443 20 0 BEADLO CC[NH2+][C@H](C)C(=O)OC[C@@H]1CC=CC[C@@H]1C ZINC001577814306 984805548 /nfs/dbraw/zinc/80/55/48/984805548.db2.gz VSLVBBAJLSOGOB-TUAOUCFPSA-N 1 2 225.332 2.130 20 0 BEADLO Cc1cc(-c2c[nH+]cn2C)cc(C)c1O ZINC001243304511 984818982 /nfs/dbraw/zinc/81/89/82/984818982.db2.gz DMRBWCBIQHDDDP-UHFFFAOYSA-N 1 2 202.257 2.410 20 0 BEADLO CCC[C@@H](CC)[N@@H+]1CC[C@@H](O)C(F)(F)C1 ZINC001257262645 984861177 /nfs/dbraw/zinc/86/11/77/984861177.db2.gz DNSGDMYSOPHJNF-NXEZZACHSA-N 1 2 221.291 2.267 20 0 BEADLO CCC[C@@H](CC)[N@H+]1CC[C@@H](O)C(F)(F)C1 ZINC001257262645 984861179 /nfs/dbraw/zinc/86/11/79/984861179.db2.gz DNSGDMYSOPHJNF-NXEZZACHSA-N 1 2 221.291 2.267 20 0 BEADLO CCC[C@H](CC)[N@@H+]1CC[C@H](O)C(F)(F)C1 ZINC001257262653 984861611 /nfs/dbraw/zinc/86/16/11/984861611.db2.gz DNSGDMYSOPHJNF-UWVGGRQHSA-N 1 2 221.291 2.267 20 0 BEADLO CCC[C@H](CC)[N@H+]1CC[C@H](O)C(F)(F)C1 ZINC001257262653 984861613 /nfs/dbraw/zinc/86/16/13/984861613.db2.gz DNSGDMYSOPHJNF-UWVGGRQHSA-N 1 2 221.291 2.267 20 0 BEADLO C=COc1ccc(NC(=O)Cc2[nH]cc[nH+]2)cc1 ZINC001451152847 984882262 /nfs/dbraw/zinc/88/22/62/984882262.db2.gz SXYSKXLLJNXGJO-UHFFFAOYSA-N 1 2 243.266 2.113 20 0 BEADLO COc1cc2[nH+]ccn2cc1-c1cc[nH]c(=O)c1 ZINC001243427930 984926877 /nfs/dbraw/zinc/92/68/77/984926877.db2.gz RNZOVPJJASZMGF-UHFFFAOYSA-N 1 2 241.250 2.111 20 0 BEADLO Cc1c(-c2cc[nH]c(=O)c2)ccc2[nH+]ccn21 ZINC001243429810 984932668 /nfs/dbraw/zinc/93/26/68/984932668.db2.gz JAWGNEUHNJNOQW-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO Cn1ccc2c[nH+]c(-c3ccc(F)c(N)c3)nc21 ZINC001243452256 984953725 /nfs/dbraw/zinc/95/37/25/984953725.db2.gz WANQBCMXUVOPIZ-UHFFFAOYSA-N 1 2 242.257 2.357 20 0 BEADLO Cc1cn2c(cccc2-c2ccc(CO)nc2)[nH+]1 ZINC001243465224 984985147 /nfs/dbraw/zinc/98/51/47/984985147.db2.gz HFRSXZRHRQSGRM-UHFFFAOYSA-N 1 2 239.278 2.197 20 0 BEADLO CC(=O)Nc1ccc(-c2ccc[nH+]c2N)cc1F ZINC001243474404 985020344 /nfs/dbraw/zinc/02/03/44/985020344.db2.gz LZCBHEOBTJILFG-UHFFFAOYSA-N 1 2 245.257 2.428 20 0 BEADLO COC(=O)c1cc(F)ccc1-c1ccc[nH+]c1N ZINC001243473949 985020464 /nfs/dbraw/zinc/02/04/64/985020464.db2.gz GCOQKGNRVBZOPA-UHFFFAOYSA-N 1 2 246.241 2.257 20 0 BEADLO CC(=O)Nc1ccc(-c2ccc[nH+]c2N)c(F)c1 ZINC001243475470 985030810 /nfs/dbraw/zinc/03/08/10/985030810.db2.gz IUUAWXVAVVTGAQ-UHFFFAOYSA-N 1 2 245.257 2.428 20 0 BEADLO CC(C)c1cnc(C[N@H+](CCCO)C2CC2)o1 ZINC000685995692 985031824 /nfs/dbraw/zinc/03/18/24/985031824.db2.gz WNLOGDJMXLHHNL-UHFFFAOYSA-N 1 2 238.331 2.145 20 0 BEADLO CC(C)c1cnc(C[N@@H+](CCCO)C2CC2)o1 ZINC000685995692 985031834 /nfs/dbraw/zinc/03/18/34/985031834.db2.gz WNLOGDJMXLHHNL-UHFFFAOYSA-N 1 2 238.331 2.145 20 0 BEADLO COc1cc(F)c(-c2ccc[nH+]c2N)cc1OC ZINC001243476469 985035911 /nfs/dbraw/zinc/03/59/11/985035911.db2.gz DOZWOSOMBYMXBT-UHFFFAOYSA-N 1 2 248.257 2.487 20 0 BEADLO Cc1cc(O)cc(NC(=O)[C@@H](C)n2cc[nH+]c2)c1 ZINC001454499984 985037496 /nfs/dbraw/zinc/03/74/96/985037496.db2.gz YIKJUOZPAQPEBJ-SNVBAGLBSA-N 1 2 245.282 2.097 20 0 BEADLO Nc1[nH+]cccc1-c1ccc(=O)n(C2CCC2)c1 ZINC001243476828 985038804 /nfs/dbraw/zinc/03/88/04/985038804.db2.gz DZGZNTBRABLZLC-UHFFFAOYSA-N 1 2 241.294 2.218 20 0 BEADLO COCc1cc(OC)ccc1-c1ccc[nH+]c1N ZINC001243477100 985039037 /nfs/dbraw/zinc/03/90/37/985039037.db2.gz IQJDBJLORPBNSD-UHFFFAOYSA-N 1 2 244.294 2.486 20 0 BEADLO CN1CCOc2ccc(-c3ccc[nH+]c3N)cc21 ZINC001243477926 985040688 /nfs/dbraw/zinc/04/06/88/985040688.db2.gz SGOAQEIBVYAPJN-UHFFFAOYSA-N 1 2 241.294 2.159 20 0 BEADLO Cn1cnc2cccc(-c3ccc[nH+]c3N)c21 ZINC001243478289 985044683 /nfs/dbraw/zinc/04/46/83/985044683.db2.gz VWINSKAASGEWPI-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO Cc1[nH]c([C@H]2CCCN2C(=O)C2CC2)[nH+]c1C ZINC001455768157 985088150 /nfs/dbraw/zinc/08/81/50/985088150.db2.gz YWLAHJCOBRNTIK-LLVKDONJSA-N 1 2 233.315 2.100 20 0 BEADLO CCc1[nH]c(CNC(=O)C2(CC)CCC2)c[nH+]1 ZINC001456144991 985113606 /nfs/dbraw/zinc/11/36/06/985113606.db2.gz YLUOEYJWWBHDCL-UHFFFAOYSA-N 1 2 235.331 2.169 20 0 BEADLO CCc1[nH]cc(CNC(=O)C2(CC)CCC2)[nH+]1 ZINC001456144991 985113612 /nfs/dbraw/zinc/11/36/12/985113612.db2.gz YLUOEYJWWBHDCL-UHFFFAOYSA-N 1 2 235.331 2.169 20 0 BEADLO O=C(NCC=CCl)c1cc2c[nH+]ccc2[nH]1 ZINC001456879099 985172544 /nfs/dbraw/zinc/17/25/44/985172544.db2.gz DLQUMFNNAYDERJ-IWQZZHSRSA-N 1 2 235.674 2.045 20 0 BEADLO Cc1cc(CO)cc(-c2ccc[nH+]c2N)c1 ZINC001243696728 985224406 /nfs/dbraw/zinc/22/44/06/985224406.db2.gz HODSXBFTMISEMP-UHFFFAOYSA-N 1 2 214.268 2.132 20 0 BEADLO Nc1[nH+]cccc1-c1c(Cl)cccc1CO ZINC001243710475 985239804 /nfs/dbraw/zinc/23/98/04/985239804.db2.gz MDFLZXPCQZFKBP-UHFFFAOYSA-N 1 2 234.686 2.477 20 0 BEADLO Nc1[nH+]cccc1-c1cccc(CO)c1Cl ZINC001243706213 985241256 /nfs/dbraw/zinc/24/12/56/985241256.db2.gz LHKYDMMSKOUQFE-UHFFFAOYSA-N 1 2 234.686 2.477 20 0 BEADLO Cc1c(F)nccc1-c1ccn2cc(N)[nH+]c2c1 ZINC001243779150 985318782 /nfs/dbraw/zinc/31/87/82/985318782.db2.gz PNVLCZGSLVEFFH-UHFFFAOYSA-N 1 2 242.257 2.426 20 0 BEADLO CC(C)c1cnc(C[N@@H+]2C[C@H](O)C(C)(C)C2)o1 ZINC000687766452 985378891 /nfs/dbraw/zinc/37/88/91/985378891.db2.gz RPYXSKCZNDSOPB-NSHDSACASA-N 1 2 238.331 2.001 20 0 BEADLO CC(C)c1cnc(C[N@H+]2C[C@H](O)C(C)(C)C2)o1 ZINC000687766452 985378904 /nfs/dbraw/zinc/37/89/04/985378904.db2.gz RPYXSKCZNDSOPB-NSHDSACASA-N 1 2 238.331 2.001 20 0 BEADLO CCOC(=O)CCC[C@H](C)[N@@H+]1CCC(F)(F)C1 ZINC001258115940 985423189 /nfs/dbraw/zinc/42/31/89/985423189.db2.gz AOIZUINBWCPOIM-JTQLQIEISA-N 1 2 249.301 2.449 20 0 BEADLO CCOC(=O)CCC[C@H](C)[N@H+]1CCC(F)(F)C1 ZINC001258115940 985423208 /nfs/dbraw/zinc/42/32/08/985423208.db2.gz AOIZUINBWCPOIM-JTQLQIEISA-N 1 2 249.301 2.449 20 0 BEADLO CCc1cn(Cc2cccc(C(=O)OC)c2)c[nH+]1 ZINC001459264253 985426231 /nfs/dbraw/zinc/42/62/31/985426231.db2.gz SPJPGDQANCFBTP-UHFFFAOYSA-N 1 2 244.294 2.280 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc(CCO)cc1 ZINC001243845850 985459587 /nfs/dbraw/zinc/45/95/87/985459587.db2.gz IBLBUVYRWQIGOX-BIPBHCDPSA-N 1 2 203.285 2.097 20 0 BEADLO Cc1ccc(-c2ccc(CCO)cc2)[nH+]c1N ZINC001243848720 985477856 /nfs/dbraw/zinc/47/78/56/985477856.db2.gz ZPQUFRNIKBUNHN-UHFFFAOYSA-N 1 2 228.295 2.174 20 0 BEADLO c1n[nH]c2c1[C@@H]([NH2+][C@H]1COC3(CCC3)C1)CCC2 ZINC000688285214 985607906 /nfs/dbraw/zinc/60/79/06/985607906.db2.gz XBVPEHUUSFJHMH-PWSUYJOCSA-N 1 2 247.342 2.088 20 0 BEADLO CCCCOC(=O)[C@H](C)[NH2+][C@H](C)CCSC ZINC001258202139 985612043 /nfs/dbraw/zinc/61/20/43/985612043.db2.gz ISMZVPUKXAKDOB-MNOVXSKESA-N 1 2 247.404 2.449 20 0 BEADLO CSc1cc(C2=C[NH2+]CCC2)nc(C)n1 ZINC001243947660 985622737 /nfs/dbraw/zinc/62/27/37/985622737.db2.gz NYUXIZIWXRRWIK-UHFFFAOYSA-N 1 2 221.329 2.231 20 0 BEADLO c1cc2c(ncnc2C2=C[NH2+]CCC2)s1 ZINC001243948188 985626866 /nfs/dbraw/zinc/62/68/66/985626866.db2.gz XWIUISMMBXKTJR-UHFFFAOYSA-N 1 2 217.297 2.416 20 0 BEADLO c1cc(-c2ccc(C3=C[NH2+]CCC3)nn2)ccn1 ZINC001243948570 985627311 /nfs/dbraw/zinc/62/73/11/985627311.db2.gz IFNUVANHILRLBR-UHFFFAOYSA-N 1 2 238.294 2.263 20 0 BEADLO Cc1noc(-c2ccc(C3=C[NH2+]CCC3)nc2)n1 ZINC001243948542 985627427 /nfs/dbraw/zinc/62/74/27/985627427.db2.gz GUDPCPIFRMOAQT-UHFFFAOYSA-N 1 2 242.282 2.164 20 0 BEADLO Fc1cccc2ncnc(C3=C[NH2+]CCC3)c12 ZINC001243949461 985633225 /nfs/dbraw/zinc/63/32/25/985633225.db2.gz MFGXJNBSGFBXJX-UHFFFAOYSA-N 1 2 229.258 2.493 20 0 BEADLO c1cncc(-c2cc(C3=C[NH2+]CCC3)ncn2)c1 ZINC001243949614 985636937 /nfs/dbraw/zinc/63/69/37/985636937.db2.gz VZTDSUFHVAFBNV-UHFFFAOYSA-N 1 2 238.294 2.263 20 0 BEADLO C[C@@H]([NH2+]Cc1csc(Cl)n1)c1cn[nH]c1 ZINC001459915979 985652581 /nfs/dbraw/zinc/65/25/81/985652581.db2.gz ZJJDWTJSWMNZIP-ZCFIWIBFSA-N 1 2 242.735 2.370 20 0 BEADLO CO[C@@H]1CC=C(Nc2[nH+]cc(C)cc2N)CC1 ZINC001212873961 985826587 /nfs/dbraw/zinc/82/65/87/985826587.db2.gz YRMIWSYSSKUFES-LLVKDONJSA-N 1 2 233.315 2.467 20 0 BEADLO COC(=O)Cc1cccc(/C(C)=C/C=C/[NH3+])c1 ZINC001244220568 985890765 /nfs/dbraw/zinc/89/07/65/985890765.db2.gz YJLGSZKYDICPJW-JNKBEKGTSA-N 1 2 231.295 2.278 20 0 BEADLO Nc1[nH+]cccc1-c1cc(F)c(CO)c(F)c1 ZINC001244342254 985986446 /nfs/dbraw/zinc/98/64/46/985986446.db2.gz LVFMVJUSYMGVAE-UHFFFAOYSA-N 1 2 236.221 2.101 20 0 BEADLO C/C(=C\C=C\[NH3+])c1c(F)cc(CO)cc1F ZINC001244362870 985988298 /nfs/dbraw/zinc/98/82/98/985988298.db2.gz YQONSSAGQNENLF-BVOBWIRXSA-N 1 2 225.238 2.333 20 0 BEADLO COC(=O)C1([NH2+][C@@H]2C[C@@H](C)CC(C)(C)C2)CC1 ZINC001258685420 986008848 /nfs/dbraw/zinc/00/88/48/986008848.db2.gz MKTUPXCYAXRQGR-GHMZBOCLSA-N 1 2 239.359 2.496 20 0 BEADLO C[C@@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc[nH]1 ZINC001461416184 986057448 /nfs/dbraw/zinc/05/74/48/986057448.db2.gz XPVXWRIKXWQBLE-MRVPVSSYSA-N 1 2 238.722 2.252 20 0 BEADLO Cc1ccc(O)c(-c2cc[nH+]c(N)c2)c1 ZINC001244405503 986077268 /nfs/dbraw/zinc/07/72/68/986077268.db2.gz MTXZJHQJQAQNDN-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO Cc1ccc(O)c(-c2ccc[nH+]c2N)c1 ZINC001244406604 986079737 /nfs/dbraw/zinc/07/97/37/986079737.db2.gz GPARWXNXZBUZAK-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO Cc1cc(-c2cc[nH+]c(N)c2)cc(O)c1F ZINC001244516205 986222422 /nfs/dbraw/zinc/22/24/22/986222422.db2.gz PHMVYINQEYPIEY-UHFFFAOYSA-N 1 2 218.231 2.484 20 0 BEADLO COc1cc(-c2c[nH+]c(N)c(C)c2)ccc1CO ZINC001244668519 986302932 /nfs/dbraw/zinc/30/29/32/986302932.db2.gz OYLWENLIWKJGTH-UHFFFAOYSA-N 1 2 244.294 2.140 20 0 BEADLO OCc1cc(-c2cccc3[nH+]ccn32)ccc1O ZINC001244776921 986336738 /nfs/dbraw/zinc/33/67/38/986336738.db2.gz NPMZRQJRPJTKDN-UHFFFAOYSA-N 1 2 240.262 2.199 20 0 BEADLO OCc1cc(-c2cccn3cc[nH+]c23)ccc1O ZINC001244776778 986337127 /nfs/dbraw/zinc/33/71/27/986337127.db2.gz ZLQIIHKDLNVYIN-UHFFFAOYSA-N 1 2 240.262 2.199 20 0 BEADLO Cn1ccc(CNc2ccc3c(c2)CC[NH2+]3)n1 ZINC001579972372 986374523 /nfs/dbraw/zinc/37/45/23/986374523.db2.gz DVGVEUVWRPIBEO-UHFFFAOYSA-N 1 2 228.299 2.000 20 0 BEADLO COc1cc(CO)cc(-c2c[nH+]c(N)c(C)c2)c1 ZINC001244840632 986385436 /nfs/dbraw/zinc/38/54/36/986385436.db2.gz FJQKVLNXFXBDAD-UHFFFAOYSA-N 1 2 244.294 2.140 20 0 BEADLO COc1ccc(-c2ccc(C)c(N)[nH+]2)cc1N ZINC001244891149 986418483 /nfs/dbraw/zinc/41/84/83/986418483.db2.gz FERSUPLZCGJOLF-UHFFFAOYSA-N 1 2 229.283 2.230 20 0 BEADLO COc1ccc(-c2nc3[nH]ccc3c[nH+]2)cc1N ZINC001244892680 986422338 /nfs/dbraw/zinc/42/23/38/986422338.db2.gz ZJDQCDAXDCXSFU-UHFFFAOYSA-N 1 2 240.266 2.167 20 0 BEADLO COc1ccc(/C(C)=C/C=C/[NH3+])cc1N ZINC001244898213 986427071 /nfs/dbraw/zinc/42/70/71/986427071.db2.gz UWHKEMJPPZOFEM-DDEWIXKASA-N 1 2 204.273 2.153 20 0 BEADLO c1[nH]c2c([nH+]1)[C@H](c1nnc(C3CC3)o1)CCC2 ZINC001254063766 986495769 /nfs/dbraw/zinc/49/57/69/986495769.db2.gz FAKSJFCHYKSXRC-MRVPVSSYSA-N 1 2 230.271 2.138 20 0 BEADLO CNc1cc(-c2cccc3c2COC3=O)cc[nH+]1 ZINC001244972099 986548258 /nfs/dbraw/zinc/54/82/58/986548258.db2.gz CDGVEWYAUIDAIW-UHFFFAOYSA-N 1 2 240.262 2.461 20 0 BEADLO CNc1cc(-c2cccc3c2CC(=O)N3)cc[nH+]1 ZINC001244973253 986550673 /nfs/dbraw/zinc/55/06/73/986550673.db2.gz KXGMUAJSEKLYHY-UHFFFAOYSA-N 1 2 239.278 2.285 20 0 BEADLO CNc1cc(-c2ccccc2NC(N)=O)cc[nH+]1 ZINC001244973838 986553624 /nfs/dbraw/zinc/55/36/24/986553624.db2.gz RRMNLVCEWSEAPO-UHFFFAOYSA-N 1 2 242.282 2.281 20 0 BEADLO CNc1cc(-c2ccnc(NC(C)=O)c2)cc[nH+]1 ZINC001244975537 986560837 /nfs/dbraw/zinc/56/08/37/986560837.db2.gz GOYUXQKBLNIGOC-UHFFFAOYSA-N 1 2 242.282 2.144 20 0 BEADLO C[C@H]1c2cccn2CC[N@H+]1Cc1cnc(N)s1 ZINC001139230650 986585629 /nfs/dbraw/zinc/58/56/29/986585629.db2.gz FNTSISPWLTZPHA-VIFPVBQESA-N 1 2 248.355 2.104 20 0 BEADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1cnc(N)s1 ZINC001139230650 986585643 /nfs/dbraw/zinc/58/56/43/986585643.db2.gz FNTSISPWLTZPHA-VIFPVBQESA-N 1 2 248.355 2.104 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1NC(=O)Cc1[nH]c[nH+]c1C ZINC001464080442 986604507 /nfs/dbraw/zinc/60/45/07/986604507.db2.gz YFXGXMMTYAEKSX-NEPJUHHUSA-N 1 2 249.358 2.346 20 0 BEADLO Cc1c(CN2CC[C@H](F)C2)[nH+]c2ccccn12 ZINC001137267673 986701550 /nfs/dbraw/zinc/70/15/50/986701550.db2.gz GJLHGDRIALGLMY-NSHDSACASA-N 1 2 233.290 2.187 20 0 BEADLO COCn1cc(-c2ccc3[nH+]c(C)cn3c2)cn1 ZINC001245221296 986744333 /nfs/dbraw/zinc/74/43/33/986744333.db2.gz SVHJOGQAWNOOOA-UHFFFAOYSA-N 1 2 242.282 2.110 20 0 BEADLO Nc1[nH+]cccc1-c1c[nH]c2ncc(F)cc12 ZINC001245430193 986848811 /nfs/dbraw/zinc/84/88/11/986848811.db2.gz IAYVCAXBABBCEE-UHFFFAOYSA-N 1 2 228.230 2.346 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(N)cc1Cl ZINC000606279582 986850065 /nfs/dbraw/zinc/85/00/65/986850065.db2.gz DVZHRJRPQUUNNG-UHFFFAOYSA-N 1 2 207.664 2.323 20 0 BEADLO Cn1ncc2cc(-c3ccc4[nH+]ccn4c3)cnc21 ZINC001245471307 986863018 /nfs/dbraw/zinc/86/30/18/986863018.db2.gz DUHBAEPXGYJEGV-UHFFFAOYSA-N 1 2 249.277 2.283 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cncs2)ccn1 ZINC001137417898 986889975 /nfs/dbraw/zinc/88/99/75/986889975.db2.gz AYNYWCAEIWMYPC-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cncs2)ccn1 ZINC001137417898 986889982 /nfs/dbraw/zinc/88/99/82/986889982.db2.gz AYNYWCAEIWMYPC-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CSc1ncc(C)c(-c2c[nH+]c(N)c(C)c2)n1 ZINC001245535972 986913987 /nfs/dbraw/zinc/91/39/87/986913987.db2.gz JEYWIRKJQKBJLI-UHFFFAOYSA-N 1 2 246.339 2.460 20 0 BEADLO COc1cc(OC)nc(-c2c[nH+]c(N)c(C)c2)c1 ZINC001245536691 986915114 /nfs/dbraw/zinc/91/51/14/986915114.db2.gz XZVMYXHJKDOWCB-UHFFFAOYSA-N 1 2 245.282 2.051 20 0 BEADLO Cc1nc(C)c(C)c(-c2c[nH+]c(N)c(C)c2)n1 ZINC001245537264 986921261 /nfs/dbraw/zinc/92/12/61/986921261.db2.gz HSSDUMNMDZOMPU-UHFFFAOYSA-N 1 2 228.299 2.354 20 0 BEADLO Cc1cc(-c2ccc(NC(N)=O)cc2)c[nH+]c1N ZINC001245537612 986922486 /nfs/dbraw/zinc/92/24/86/986922486.db2.gz SJTYKKDYULCNDY-UHFFFAOYSA-N 1 2 242.282 2.130 20 0 BEADLO CCCC[C@@H](C)[N@@H+]1CCNCC(F)(F)C1 ZINC001255323802 986922702 /nfs/dbraw/zinc/92/27/02/986922702.db2.gz VLBONJHRYIONML-SNVBAGLBSA-N 1 2 220.307 2.106 20 0 BEADLO CCCC[C@@H](C)[N@H+]1CCNCC(F)(F)C1 ZINC001255323802 986922710 /nfs/dbraw/zinc/92/27/10/986922710.db2.gz VLBONJHRYIONML-SNVBAGLBSA-N 1 2 220.307 2.106 20 0 BEADLO CCCC[C@@H](C)N1CC[NH2+]CC(F)(F)C1 ZINC001255323802 986922722 /nfs/dbraw/zinc/92/27/22/986922722.db2.gz VLBONJHRYIONML-SNVBAGLBSA-N 1 2 220.307 2.106 20 0 BEADLO Cc1nc2cncc(-c3c[nH+]c(N)c(C)c3)c2o1 ZINC001245539778 986927563 /nfs/dbraw/zinc/92/75/63/986927563.db2.gz PEZFLBMVJKQACF-UHFFFAOYSA-N 1 2 240.266 2.484 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc2c(c1)C(=O)N(C)C2 ZINC001245648205 987014814 /nfs/dbraw/zinc/01/48/14/987014814.db2.gz DGDSDMFHBRFRPD-DROBUMMNSA-N 1 2 228.295 2.148 20 0 BEADLO Cc1cn2c(cccc2-c2ccc3nncn3c2)[nH+]1 ZINC001245661224 987049865 /nfs/dbraw/zinc/04/98/65/987049865.db2.gz YHQYLATWPYUENK-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO CC[N@H+]([C@H](C)CC(F)(F)F)C1COC1 ZINC001255655955 987051988 /nfs/dbraw/zinc/05/19/88/987051988.db2.gz OATXDXIKBIWFRJ-SSDOTTSWSA-N 1 2 211.227 2.048 20 0 BEADLO CC[N@@H+]([C@H](C)CC(F)(F)F)C1COC1 ZINC001255655955 987052005 /nfs/dbraw/zinc/05/20/05/987052005.db2.gz OATXDXIKBIWFRJ-SSDOTTSWSA-N 1 2 211.227 2.048 20 0 BEADLO Cc1nc(Cl)ccc1-c1c[nH+]cn1C ZINC001245773761 987083341 /nfs/dbraw/zinc/08/33/41/987083341.db2.gz WZJNOCNBXKEFMK-UHFFFAOYSA-N 1 2 207.664 2.444 20 0 BEADLO C[C@@H]1C[C@H]1c1nnc([C@@H]2CCCc3[nH]c[nH+]c32)o1 ZINC001256661079 987263559 /nfs/dbraw/zinc/26/35/59/987263559.db2.gz YWNZMIWOQHGKPN-IWSPIJDZSA-N 1 2 244.298 2.384 20 0 BEADLO COC[C@H]([NH2+]Cc1cc(C)n[nH]1)c1ccc(C)o1 ZINC001116190721 987467354 /nfs/dbraw/zinc/46/73/54/987467354.db2.gz LXWKZUQSWDIZSH-LBPRGKRZSA-N 1 2 249.314 2.097 20 0 BEADLO Cc1cc(NC(=O)[C@H](C)n2cc[nH+]c2)ccc1O ZINC001116343775 987526046 /nfs/dbraw/zinc/52/60/46/987526046.db2.gz JXMSNCQBDAHWQM-JTQLQIEISA-N 1 2 245.282 2.097 20 0 BEADLO Cc1cc(C[N@H+](C)CCC(F)(F)F)[nH]n1 ZINC001116440877 987568936 /nfs/dbraw/zinc/56/89/36/987568936.db2.gz WMLNGZQFIUVVHC-UHFFFAOYSA-N 1 2 221.226 2.102 20 0 BEADLO Cc1cc(C[N@@H+](C)CCC(F)(F)F)[nH]n1 ZINC001116440877 987568942 /nfs/dbraw/zinc/56/89/42/987568942.db2.gz WMLNGZQFIUVVHC-UHFFFAOYSA-N 1 2 221.226 2.102 20 0 BEADLO CCc1ncc(C[NH2+]Cc2nc(C)cs2)cn1 ZINC001473924137 987619386 /nfs/dbraw/zinc/61/93/86/987619386.db2.gz KXTNOWMRYQDGRI-UHFFFAOYSA-N 1 2 248.355 2.094 20 0 BEADLO CCOc1ncccc1C[NH2+]Cc1cnsc1 ZINC001473926337 987619993 /nfs/dbraw/zinc/61/99/93/987619993.db2.gz FAVIZUUONJRGCK-UHFFFAOYSA-N 1 2 249.339 2.227 20 0 BEADLO CCC[C@@H]([NH2+]Cc1nccn1C)c1ccccn1 ZINC001473982537 987623471 /nfs/dbraw/zinc/62/34/71/987623471.db2.gz RYQTXCIUVVEBGG-GFCCVEGCSA-N 1 2 244.342 2.446 20 0 BEADLO COc1cc(NCc2cc(C)[nH+]c(C)c2)nn1C ZINC001474116896 987645827 /nfs/dbraw/zinc/64/58/27/987645827.db2.gz KEJQQEPPZZPLCY-UHFFFAOYSA-N 1 2 246.314 2.053 20 0 BEADLO CCCn1c[nH+]cc1CN(C)Cc1cc(C)on1 ZINC001474334263 987690768 /nfs/dbraw/zinc/69/07/68/987690768.db2.gz JXMAMTUESYWVKS-UHFFFAOYSA-N 1 2 248.330 2.222 20 0 BEADLO C[NH+](C)Cc1nnc(/C=C\C(C)(C)C)o1 ZINC001117228853 987796136 /nfs/dbraw/zinc/79/61/36/987796136.db2.gz GSSZVLJRFMFCJP-SREVYHEPSA-N 1 2 209.293 2.191 20 0 BEADLO CCCC[C@@H](CC)N[C@@H]1C[NH2+]CC1(F)F ZINC001246457053 987812594 /nfs/dbraw/zinc/81/25/94/987812594.db2.gz CBZBBHSOSQNLQN-NXEZZACHSA-N 1 2 220.307 2.152 20 0 BEADLO CCCC[C@@H](CC)[NH2+][C@@H]1CNCC1(F)F ZINC001246457053 987812599 /nfs/dbraw/zinc/81/25/99/987812599.db2.gz CBZBBHSOSQNLQN-NXEZZACHSA-N 1 2 220.307 2.152 20 0 BEADLO Cc1ccc(Cc2nnc(C[NH+](C)C)o2)cc1C ZINC001117260446 987813554 /nfs/dbraw/zinc/81/35/54/987813554.db2.gz LCJIYOICZRCVEV-UHFFFAOYSA-N 1 2 245.326 2.339 20 0 BEADLO CC(C)=CCC[C@H](C)[N@H+]1C[C@@H](F)[C@@H](N)C1 ZINC001246526118 987877624 /nfs/dbraw/zinc/87/76/24/987877624.db2.gz MBGNCVHCPDYAND-TUAOUCFPSA-N 1 2 214.328 2.102 20 0 BEADLO CC(C)=CCC[C@H](C)[N@@H+]1C[C@@H](F)[C@@H](N)C1 ZINC001246526118 987877628 /nfs/dbraw/zinc/87/76/28/987877628.db2.gz MBGNCVHCPDYAND-TUAOUCFPSA-N 1 2 214.328 2.102 20 0 BEADLO C[C@H](C(=O)N(C1CCC1)C1CCC1)n1cc[nH+]c1 ZINC001117726502 987877695 /nfs/dbraw/zinc/87/76/95/987877695.db2.gz DWZSDNQVQNNHTF-LLVKDONJSA-N 1 2 247.342 2.378 20 0 BEADLO CCC1(CC)CN(C(=O)[C@H](C)n2cc[nH+]c2)C1 ZINC001117771594 987900033 /nfs/dbraw/zinc/90/00/33/987900033.db2.gz MBULGCOZNMERFX-NSHDSACASA-N 1 2 235.331 2.093 20 0 BEADLO CCCCCC[NH+]1CC(NC(=O)C(C)(F)F)C1 ZINC001494333537 988127268 /nfs/dbraw/zinc/12/72/68/988127268.db2.gz MXXFGTKDAVEBQX-UHFFFAOYSA-N 1 2 248.317 2.022 20 0 BEADLO CCC1(C)CCN(C(=O)[C@@H](C)n2cc[nH+]c2)CC1 ZINC001322278733 988188280 /nfs/dbraw/zinc/18/82/80/988188280.db2.gz GEUBRABGPRAAJV-GFCCVEGCSA-N 1 2 249.358 2.483 20 0 BEADLO CCCC1(CNC(=O)[C@H](C)n2cc[nH+]c2)CC1 ZINC001322541632 988317984 /nfs/dbraw/zinc/31/79/84/988317984.db2.gz RFCNFONUVPILAV-NSHDSACASA-N 1 2 235.331 2.141 20 0 BEADLO C[C@H]([NH2+][C@H]1C[C@H](C)n2ncnc21)c1cncs1 ZINC001118489105 988380077 /nfs/dbraw/zinc/38/00/77/988380077.db2.gz DHLRYYNDFLMPJR-CIUDSAMLSA-N 1 2 249.343 2.091 20 0 BEADLO C[C@H]1CCC[C@H](c2nnc(C[NH+](C)C)o2)C1 ZINC001322984489 988424379 /nfs/dbraw/zinc/42/43/79/988424379.db2.gz VLELNKARCDMCDA-UWVGGRQHSA-N 1 2 223.320 2.425 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccc(C)o2)[nH]n1 ZINC001323283108 988487162 /nfs/dbraw/zinc/48/71/62/988487162.db2.gz WTPCGZHEYWURFJ-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccc(C)o2)[nH]n1 ZINC001323283108 988487165 /nfs/dbraw/zinc/48/71/65/988487165.db2.gz WTPCGZHEYWURFJ-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO CC[C@@H](CC(C)C)[N@@H+]1CC[C@H](N)C(F)(F)C1 ZINC001246839539 988540519 /nfs/dbraw/zinc/54/05/19/988540519.db2.gz XXDPANXSGUASSF-QWRGUYRKSA-N 1 2 234.334 2.479 20 0 BEADLO CC[C@@H](CC(C)C)[N@H+]1CC[C@H](N)C(F)(F)C1 ZINC001246839539 988540527 /nfs/dbraw/zinc/54/05/27/988540527.db2.gz XXDPANXSGUASSF-QWRGUYRKSA-N 1 2 234.334 2.479 20 0 BEADLO CC[C@H](CC(C)C)[N@@H+]1CC[C@@H](N)C(F)(F)C1 ZINC001246839537 988542361 /nfs/dbraw/zinc/54/23/61/988542361.db2.gz XXDPANXSGUASSF-GHMZBOCLSA-N 1 2 234.334 2.479 20 0 BEADLO CC[C@H](CC(C)C)[N@H+]1CC[C@@H](N)C(F)(F)C1 ZINC001246839537 988542378 /nfs/dbraw/zinc/54/23/78/988542378.db2.gz XXDPANXSGUASSF-GHMZBOCLSA-N 1 2 234.334 2.479 20 0 BEADLO C[C@@H]1CC[C@H]([N@@H+]2CC[C@@H](N)C(F)(F)C2)C[C@H]1C ZINC001246839884 988546345 /nfs/dbraw/zinc/54/63/45/988546345.db2.gz ZWSAGFYHCGDJNC-WISYIIOYSA-N 1 2 246.345 2.479 20 0 BEADLO C[C@@H]1CC[C@H]([N@H+]2CC[C@@H](N)C(F)(F)C2)C[C@H]1C ZINC001246839884 988546355 /nfs/dbraw/zinc/54/63/55/988546355.db2.gz ZWSAGFYHCGDJNC-WISYIIOYSA-N 1 2 246.345 2.479 20 0 BEADLO CC1(C)CCCCN(c2cc(N)nc[nH+]2)C1 ZINC001548514436 988679095 /nfs/dbraw/zinc/67/90/95/988679095.db2.gz DWKNFRYDZTZVQH-UHFFFAOYSA-N 1 2 220.320 2.075 20 0 BEADLO Cc1ncc(C[NH2+]Cc2cn(C3CC3)cn2)s1 ZINC001118927019 988706133 /nfs/dbraw/zinc/70/61/33/988706133.db2.gz GXQNOWSYJPHJGF-UHFFFAOYSA-N 1 2 248.355 2.273 20 0 BEADLO Cc1c2[nH+]c(CCCCO)[nH]c2ccc1F ZINC001247011068 988839519 /nfs/dbraw/zinc/83/95/19/988839519.db2.gz OMKDEHATKHIZLN-UHFFFAOYSA-N 1 2 222.263 2.325 20 0 BEADLO CO[C@@H]1C[C@H]([N@H+](C)Cc2cc(C)[nH]n2)C12CCC2 ZINC001324439372 988842440 /nfs/dbraw/zinc/84/24/40/988842440.db2.gz VWSAHNBHPDYWKE-QWHCGFSZSA-N 1 2 249.358 2.108 20 0 BEADLO CO[C@@H]1C[C@H]([N@@H+](C)Cc2cc(C)[nH]n2)C12CCC2 ZINC001324439372 988842444 /nfs/dbraw/zinc/84/24/44/988842444.db2.gz VWSAHNBHPDYWKE-QWHCGFSZSA-N 1 2 249.358 2.108 20 0 BEADLO Cn1c(CCCCO)[nH+]c2ccc(F)c(F)c21 ZINC001247041607 988849477 /nfs/dbraw/zinc/84/94/77/988849477.db2.gz MBJYXHSALZDHOS-UHFFFAOYSA-N 1 2 240.253 2.167 20 0 BEADLO c1[nH]cc(Cc2nc(-c3ccccc3)no2)[nH+]1 ZINC001247137258 988850477 /nfs/dbraw/zinc/85/04/77/988850477.db2.gz GQBAZCCRPNIWOL-UHFFFAOYSA-N 1 2 226.239 2.051 20 0 BEADLO CC[C@@H]1CCC[C@@H]1CNC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001324790656 988979791 /nfs/dbraw/zinc/97/97/91/988979791.db2.gz NWBJCYOIPSMKJZ-JHJVBQTASA-N 1 2 249.358 2.387 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@@H](c3nccs3)C2)n[nH]1 ZINC001119516251 989121461 /nfs/dbraw/zinc/12/14/61/989121461.db2.gz SJUALVXQWHYTKH-SNVBAGLBSA-N 1 2 248.355 2.164 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@@H](c3nccs3)C2)n[nH]1 ZINC001119516251 989121467 /nfs/dbraw/zinc/12/14/67/989121467.db2.gz SJUALVXQWHYTKH-SNVBAGLBSA-N 1 2 248.355 2.164 20 0 BEADLO CC(C)(COC(=O)[C@@H]1CC12CCC2)n1cc[nH+]c1 ZINC001515917524 989130658 /nfs/dbraw/zinc/13/06/58/989130658.db2.gz YGOPDISUWCPHHY-NSHDSACASA-N 1 2 248.326 2.352 20 0 BEADLO Cc1cccnc1[C@@H](C)Nc1cc(CO)cc[nH+]1 ZINC001516144057 989142579 /nfs/dbraw/zinc/14/25/79/989142579.db2.gz UYNQHYGGBXFOHG-LLVKDONJSA-N 1 2 243.310 2.450 20 0 BEADLO Cc1ncc(Br)cc1C[NH+]1CCC1 ZINC001248778008 989145662 /nfs/dbraw/zinc/14/56/62/989145662.db2.gz ILRNTEGRVWMMJM-UHFFFAOYSA-N 1 2 241.132 2.358 20 0 BEADLO Fc1ccc(C[NH+]2CC3(CCO3)C2)c2[nH]ccc21 ZINC001248818052 989173438 /nfs/dbraw/zinc/17/34/38/989173438.db2.gz WCSWRMMIGPKLCK-UHFFFAOYSA-N 1 2 246.285 2.282 20 0 BEADLO CO[C@H]1CC[N@H+](Cc2nc3ccc(C)cc3[nH]2)C1 ZINC001248839976 989191598 /nfs/dbraw/zinc/19/15/98/989191598.db2.gz DVJIFYBCPJUHTB-NSHDSACASA-N 1 2 245.326 2.092 20 0 BEADLO CO[C@H]1CC[N@@H+](Cc2nc3ccc(C)cc3[nH]2)C1 ZINC001248839976 989191613 /nfs/dbraw/zinc/19/16/13/989191613.db2.gz DVJIFYBCPJUHTB-NSHDSACASA-N 1 2 245.326 2.092 20 0 BEADLO C[C@H](C(=O)N[C@H]1[C@H](C)CCC[C@@H]1C)n1cc[nH+]c1 ZINC001325556115 989211780 /nfs/dbraw/zinc/21/17/80/989211780.db2.gz UBXKNKBWYHPTGY-XQHKEYJVSA-N 1 2 249.358 2.385 20 0 BEADLO Fc1cc2cc[nH]c2c(C[N@@H+]2CCC23COC3)c1 ZINC001249524966 989299753 /nfs/dbraw/zinc/29/97/53/989299753.db2.gz UHXQRIIDTOSOFO-UHFFFAOYSA-N 1 2 246.285 2.282 20 0 BEADLO Fc1cc2cc[nH]c2c(C[N@H+]2CCC23COC3)c1 ZINC001249524966 989299760 /nfs/dbraw/zinc/29/97/60/989299760.db2.gz UHXQRIIDTOSOFO-UHFFFAOYSA-N 1 2 246.285 2.282 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@]3(CCO3)C2)ns1 ZINC001249588659 989305355 /nfs/dbraw/zinc/30/53/55/989305355.db2.gz LCYZUSFUJPSTMR-LBPRGKRZSA-N 1 2 238.356 2.206 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@]3(CCO3)C2)ns1 ZINC001249588659 989305365 /nfs/dbraw/zinc/30/53/65/989305365.db2.gz LCYZUSFUJPSTMR-LBPRGKRZSA-N 1 2 238.356 2.206 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ncccn1)c1cccnc1 ZINC001119692622 989341310 /nfs/dbraw/zinc/34/13/10/989341310.db2.gz LFXVREPEXOUZSH-GHMZBOCLSA-N 1 2 228.299 2.283 20 0 BEADLO CC[C@H](C)[C@H](C)c1nnc(C[NH+](C)C)o1 ZINC001326084876 989349278 /nfs/dbraw/zinc/34/92/78/989349278.db2.gz UOAWBAYKNXASIR-IUCAKERBSA-N 1 2 211.309 2.281 20 0 BEADLO CC(C)(NC(=O)Cn1cc[nH+]c1)C1CCCCC1 ZINC001326058159 989350305 /nfs/dbraw/zinc/35/03/05/989350305.db2.gz LQHSJUHIABDXGJ-UHFFFAOYSA-N 1 2 249.358 2.358 20 0 BEADLO CC[C@@H](C)[C@@H](C)c1nnc(C[NH+](C)C)o1 ZINC001326085209 989353402 /nfs/dbraw/zinc/35/34/02/989353402.db2.gz UOAWBAYKNXASIR-RKDXNWHRSA-N 1 2 211.309 2.281 20 0 BEADLO CCc1ncc(C[N@@H+]2CCO[C@@H](C(C)C)C2)o1 ZINC001119773912 989397768 /nfs/dbraw/zinc/39/77/68/989397768.db2.gz AFFOHOGGKKBAAG-GFCCVEGCSA-N 1 2 238.331 2.094 20 0 BEADLO CCc1ncc(C[N@H+]2CCO[C@@H](C(C)C)C2)o1 ZINC001119773912 989397775 /nfs/dbraw/zinc/39/77/75/989397775.db2.gz AFFOHOGGKKBAAG-GFCCVEGCSA-N 1 2 238.331 2.094 20 0 BEADLO Cc1nc(NCCCC(F)F)cc[nH+]1 ZINC001119974341 989529627 /nfs/dbraw/zinc/52/96/27/989529627.db2.gz WWESDUWVOKEJCS-UHFFFAOYSA-N 1 2 201.220 2.242 20 0 BEADLO C[C@@H](C(=O)NC1(C)C(C)(C)C1(C)C)n1cc[nH+]c1 ZINC001119998930 989551741 /nfs/dbraw/zinc/55/17/41/989551741.db2.gz BDCUSZJNLBSJMC-JTQLQIEISA-N 1 2 249.358 2.385 20 0 BEADLO CCSCCCNc1cc(N(C)C)nc[nH+]1 ZINC001120040494 989574447 /nfs/dbraw/zinc/57/44/47/989574447.db2.gz ZBMODTVACYJQFJ-UHFFFAOYSA-N 1 2 240.376 2.098 20 0 BEADLO CCSCCCNc1cc(N(C)C)[nH+]cn1 ZINC001120040494 989574461 /nfs/dbraw/zinc/57/44/61/989574461.db2.gz ZBMODTVACYJQFJ-UHFFFAOYSA-N 1 2 240.376 2.098 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)Nc1cnoc1C(C)C ZINC001120691597 989834686 /nfs/dbraw/zinc/83/46/86/989834686.db2.gz XIXOICKVUMXPTQ-UHFFFAOYSA-N 1 2 248.286 2.011 20 0 BEADLO CCc1ccc(N2CCOC[C@@H](C)C2)[nH+]c1 ZINC001120829014 989907185 /nfs/dbraw/zinc/90/71/85/989907185.db2.gz XSCGXKWLYXMBBZ-NSHDSACASA-N 1 2 220.316 2.117 20 0 BEADLO CC[C@H]1CCN(C(=O)CCCn2cc[nH+]c2)[C@@H]1C ZINC001523409332 989908940 /nfs/dbraw/zinc/90/89/40/989908940.db2.gz DYEOXHHGUJOVAO-OLZOCXBDSA-N 1 2 249.358 2.310 20 0 BEADLO CCN(CCOC)c1cc(F)cc(C)[nH+]1 ZINC001120891128 989951547 /nfs/dbraw/zinc/95/15/47/989951547.db2.gz XEUKWYLVCKJZCK-UHFFFAOYSA-N 1 2 212.268 2.002 20 0 BEADLO CC(C)CC[C@@H]1CCCN1c1cc(N)nc[nH+]1 ZINC001120910372 989963572 /nfs/dbraw/zinc/96/35/72/989963572.db2.gz NSLJEFSVBDMHHU-NSHDSACASA-N 1 2 234.347 2.464 20 0 BEADLO Cc1nc(NC[C@@H]2OCc3ccccc32)cc[nH+]1 ZINC001120925061 989968387 /nfs/dbraw/zinc/96/83/87/989968387.db2.gz ZFFWWFDIILDAOR-ZDUSSCGKSA-N 1 2 241.294 2.468 20 0 BEADLO CCNc1ccc(Nc2nccc(OC)n2)c[nH+]1 ZINC001120950484 989983452 /nfs/dbraw/zinc/98/34/52/989983452.db2.gz GRECBPFBIFKGLZ-UHFFFAOYSA-N 1 2 245.286 2.056 20 0 BEADLO CO[C@H]1CC[C@@H]1N(C)c1cc(F)cc(C)[nH+]1 ZINC001120965215 989991050 /nfs/dbraw/zinc/99/10/50/989991050.db2.gz FMBDFJQIWAVRAU-QWRGUYRKSA-N 1 2 224.279 2.143 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)C1(CCF)CC1 ZINC001121232409 990054443 /nfs/dbraw/zinc/05/44/43/990054443.db2.gz ZKXLNBAKJREQJT-UHFFFAOYSA-N 1 2 236.290 2.199 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H]1CCC1(C)C ZINC001121231368 990055173 /nfs/dbraw/zinc/05/51/73/990055173.db2.gz KFIHPFVEUCACRR-NSHDSACASA-N 1 2 232.327 2.495 20 0 BEADLO CC[C@]1(C)CCCN(C(=O)C[C@@H]([NH3+])C(F)F)C1 ZINC001121880299 990106011 /nfs/dbraw/zinc/10/60/11/990106011.db2.gz JXGGBPMIBULPKS-BXKDBHETSA-N 1 2 248.317 2.008 20 0 BEADLO CC[C@]1(C)CCCN(C(=O)C[C@H]([NH3+])C(F)F)C1 ZINC001121880301 990107307 /nfs/dbraw/zinc/10/73/07/990107307.db2.gz JXGGBPMIBULPKS-JOYOIKCWSA-N 1 2 248.317 2.008 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@@H]1C[C@H]1C(C)C ZINC001527012040 990198181 /nfs/dbraw/zinc/19/81/81/990198181.db2.gz OXEKPFJLKMYJDT-NWDGAFQWSA-N 1 2 236.315 2.238 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@@H]1C[C@@H]1C(C)C ZINC001527012042 990201072 /nfs/dbraw/zinc/20/10/72/990201072.db2.gz OXEKPFJLKMYJDT-VXGBXAGGSA-N 1 2 236.315 2.238 20 0 BEADLO CCC/C=C/C(=O)OCCCc1c[nH+]cn1C ZINC001122973415 990477450 /nfs/dbraw/zinc/47/74/50/990477450.db2.gz FMFSHHJTRRSGDB-VMPITWQZSA-N 1 2 236.315 2.252 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)NC/C=C/Cl)ccn12 ZINC001539084698 990554902 /nfs/dbraw/zinc/55/49/02/990554902.db2.gz QJTAEOGJLXNGHJ-DUXPYHPUSA-N 1 2 249.701 2.125 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)NC/C=C\Cl)ccn12 ZINC001539084700 990556844 /nfs/dbraw/zinc/55/68/44/990556844.db2.gz QJTAEOGJLXNGHJ-RQOWECAXSA-N 1 2 249.701 2.125 20 0 BEADLO CCn1c[nH+]cc1COC(=O)C1=CCCCC1 ZINC001123474399 990590333 /nfs/dbraw/zinc/59/03/33/990590333.db2.gz ZCAKIGAFRGYIEU-UHFFFAOYSA-N 1 2 234.299 2.447 20 0 BEADLO Cn1cc[nH+]c1CCC(=O)NC(C)(C)C1CCC1 ZINC001123803385 990673214 /nfs/dbraw/zinc/67/32/14/990673214.db2.gz XTVYDVJWWMARGC-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CC[C@@H]1CCN(C(=O)C[C@H](C)n2cc[nH+]c2)[C@@H]1C ZINC001556272954 990757112 /nfs/dbraw/zinc/75/71/12/990757112.db2.gz JMMDUMQWHOCDHF-YNEHKIRRSA-N 1 2 249.358 2.481 20 0 BEADLO c1coc(C[N@H+](Cc2cncnc2)C2CC2)c1 ZINC001137670267 990837518 /nfs/dbraw/zinc/83/75/18/990837518.db2.gz HXWOSQQYNXUUID-UHFFFAOYSA-N 1 2 229.283 2.234 20 0 BEADLO c1coc(C[N@@H+](Cc2cncnc2)C2CC2)c1 ZINC001137670267 990837520 /nfs/dbraw/zinc/83/75/20/990837520.db2.gz HXWOSQQYNXUUID-UHFFFAOYSA-N 1 2 229.283 2.234 20 0 BEADLO FC[C@H]1CCC[N@@H+]1Cc1ccc(F)nc1 ZINC001137743893 990846379 /nfs/dbraw/zinc/84/63/79/990846379.db2.gz DTOUTKUNNSSTGG-SNVBAGLBSA-N 1 2 212.243 2.155 20 0 BEADLO FC[C@H]1CCC[N@H+]1Cc1ccc(F)nc1 ZINC001137743893 990846380 /nfs/dbraw/zinc/84/63/80/990846380.db2.gz DTOUTKUNNSSTGG-SNVBAGLBSA-N 1 2 212.243 2.155 20 0 BEADLO Cc1ccc2[nH]c(C[N@@H+]3C[C@@H]4C[C@H]3CO4)cc2c1 ZINC001138417251 990942786 /nfs/dbraw/zinc/94/27/86/990942786.db2.gz ASXNRFDJRSHODK-KBPBESRZSA-N 1 2 242.322 2.449 20 0 BEADLO Cc1ccc2[nH]c(C[N@H+]3C[C@@H]4C[C@H]3CO4)cc2c1 ZINC001138417251 990942793 /nfs/dbraw/zinc/94/27/93/990942793.db2.gz ASXNRFDJRSHODK-KBPBESRZSA-N 1 2 242.322 2.449 20 0 BEADLO Cc1ccc2[nH]c(C[N@@H+](C)C3COC3)cc2c1 ZINC001138417273 990944006 /nfs/dbraw/zinc/94/40/06/990944006.db2.gz AUSBDRFKVSZBGS-UHFFFAOYSA-N 1 2 230.311 2.307 20 0 BEADLO Cc1ccc2[nH]c(C[N@H+](C)C3COC3)cc2c1 ZINC001138417273 990944010 /nfs/dbraw/zinc/94/40/10/990944010.db2.gz AUSBDRFKVSZBGS-UHFFFAOYSA-N 1 2 230.311 2.307 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H]2CCC[C@H]2CC)c[nH+]1 ZINC001558497573 990954697 /nfs/dbraw/zinc/95/46/97/990954697.db2.gz UPCQXMBWDORVMU-ZYHUDNBSSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H]2CCC[C@H]2CC)[nH+]1 ZINC001558497573 990954707 /nfs/dbraw/zinc/95/47/07/990954707.db2.gz UPCQXMBWDORVMU-ZYHUDNBSSA-N 1 2 249.358 2.415 20 0 BEADLO COc1ccc(C[N@H+](C)C2COC2)cc1Cl ZINC001138475295 990954974 /nfs/dbraw/zinc/95/49/74/990954974.db2.gz WHKFEDFPSFTXOJ-UHFFFAOYSA-N 1 2 241.718 2.179 20 0 BEADLO COc1ccc(C[N@@H+](C)C2COC2)cc1Cl ZINC001138475295 990954984 /nfs/dbraw/zinc/95/49/84/990954984.db2.gz WHKFEDFPSFTXOJ-UHFFFAOYSA-N 1 2 241.718 2.179 20 0 BEADLO COc1ccc2[nH]cc(C[NH+]3CC(OC)C3)c2c1 ZINC001138504086 990963987 /nfs/dbraw/zinc/96/39/87/990963987.db2.gz RSGBIPFBKACWGW-UHFFFAOYSA-N 1 2 246.310 2.007 20 0 BEADLO C[C@@H]1C[C@H]([NH2+]Cc2ccc(F)nc2)c2nccn21 ZINC001308404567 990981770 /nfs/dbraw/zinc/98/17/70/990981770.db2.gz YYWVTQCVLCMTER-KOLCDFICSA-N 1 2 246.289 2.213 20 0 BEADLO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(F)nc2)c2nccn21 ZINC001308404571 990984554 /nfs/dbraw/zinc/98/45/54/990984554.db2.gz YYWVTQCVLCMTER-MWLCHTKSSA-N 1 2 246.289 2.213 20 0 BEADLO Clc1ccc(C[NH2+][C@H]2CCn3ccnc32)cn1 ZINC001308414107 990988977 /nfs/dbraw/zinc/98/89/77/990988977.db2.gz WKTMLVBLMLJISJ-JTQLQIEISA-N 1 2 248.717 2.166 20 0 BEADLO CCCn1ncc(C[NH+]2CC(C(F)F)C2)c1C ZINC001138641718 990990290 /nfs/dbraw/zinc/99/02/90/990990290.db2.gz OLWYKRKLINZCCG-UHFFFAOYSA-N 1 2 243.301 2.298 20 0 BEADLO CCCn1ncc(C[N@H+](C)Cc2ccno2)c1C ZINC001138642235 990991821 /nfs/dbraw/zinc/99/18/21/990991821.db2.gz QCPDVBYNWVLAPN-UHFFFAOYSA-N 1 2 248.330 2.222 20 0 BEADLO CCCn1ncc(C[N@@H+](C)Cc2ccno2)c1C ZINC001138642235 990991832 /nfs/dbraw/zinc/99/18/32/990991832.db2.gz QCPDVBYNWVLAPN-UHFFFAOYSA-N 1 2 248.330 2.222 20 0 BEADLO Cc1cc(NCc2cc[nH]c(=O)c2)c[nH+]c1C ZINC001308503729 991008368 /nfs/dbraw/zinc/00/83/68/991008368.db2.gz SDPUKIKTTJGYGY-UHFFFAOYSA-N 1 2 229.283 2.411 20 0 BEADLO C[C@H]1C[C@@H](CF)[N@H+](Cc2cccnc2F)C1 ZINC001138783022 991041862 /nfs/dbraw/zinc/04/18/62/991041862.db2.gz KNKWHPOGECSRQT-ONGXEEELSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@H]1C[C@@H](CF)[N@@H+](Cc2cccnc2F)C1 ZINC001138783022 991041867 /nfs/dbraw/zinc/04/18/67/991041867.db2.gz KNKWHPOGECSRQT-ONGXEEELSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1cccc2ccnn21 ZINC001138804594 991065535 /nfs/dbraw/zinc/06/55/35/991065535.db2.gz OOFCQJYUQPRDCQ-GHMZBOCLSA-N 1 2 233.290 2.267 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1cccc2ccnn21 ZINC001138804594 991065544 /nfs/dbraw/zinc/06/55/44/991065544.db2.gz OOFCQJYUQPRDCQ-GHMZBOCLSA-N 1 2 233.290 2.267 20 0 BEADLO CCc1cn(CC(=O)N2[C@@H](C)CCC[C@@H]2C)c[nH+]1 ZINC001559466440 991112910 /nfs/dbraw/zinc/11/29/10/991112910.db2.gz UXIRLXKYFMAELY-RYUDHWBXSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2n[nH]cc2Br)C1 ZINC001139020313 991124027 /nfs/dbraw/zinc/12/40/27/991124027.db2.gz ISPRDDXRLBYDCZ-SSDOTTSWSA-N 1 2 244.136 2.014 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2n[nH]cc2Br)C1 ZINC001139020313 991124034 /nfs/dbraw/zinc/12/40/34/991124034.db2.gz ISPRDDXRLBYDCZ-SSDOTTSWSA-N 1 2 244.136 2.014 20 0 BEADLO CCCn1cc(C[N@@H+]2CCCC(=O)[C@H](C)C2)cn1 ZINC001139037385 991128016 /nfs/dbraw/zinc/12/80/16/991128016.db2.gz MPWOPYKRWUUGPN-GFCCVEGCSA-N 1 2 249.358 2.094 20 0 BEADLO CCCn1cc(C[N@H+]2CCCC(=O)[C@H](C)C2)cn1 ZINC001139037385 991128024 /nfs/dbraw/zinc/12/80/24/991128024.db2.gz MPWOPYKRWUUGPN-GFCCVEGCSA-N 1 2 249.358 2.094 20 0 BEADLO OCc1cc[nH+]c(NCc2ccccc2F)c1 ZINC001202893457 991138156 /nfs/dbraw/zinc/13/81/56/991138156.db2.gz SJQXRWYFDPQERO-UHFFFAOYSA-N 1 2 232.258 2.325 20 0 BEADLO Cc1n[nH]c(C)c1C[N@H+](C)Cc1cncs1 ZINC001139099968 991146089 /nfs/dbraw/zinc/14/60/89/991146089.db2.gz BISPOFPTEJODNY-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1n[nH]c(C)c1C[N@@H+](C)Cc1cncs1 ZINC001139099968 991146099 /nfs/dbraw/zinc/14/60/99/991146099.db2.gz BISPOFPTEJODNY-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO c1cnc2cc(C[NH+]3CC4(CCO4)C3)ccc2c1 ZINC001139168158 991177134 /nfs/dbraw/zinc/17/71/34/991177134.db2.gz ISJIVCYUTDUBPH-UHFFFAOYSA-N 1 2 240.306 2.210 20 0 BEADLO CO[C@H](C)CNc1c[nH+]cc2c1CCCC2 ZINC001308858034 991186282 /nfs/dbraw/zinc/18/62/82/991186282.db2.gz AQJUSJGRIOHNRX-SNVBAGLBSA-N 1 2 220.316 2.407 20 0 BEADLO Cn1ccc2cc(C[NH+]3CCC(=O)CC3)ccc21 ZINC001139188953 991189622 /nfs/dbraw/zinc/18/96/22/991189622.db2.gz SXFXRWUYZNLJMJ-UHFFFAOYSA-N 1 2 242.322 2.343 20 0 BEADLO CCCCOCC[NH2+][C@H](CC)c1noc(C)n1 ZINC001559736566 991232640 /nfs/dbraw/zinc/23/26/40/991232640.db2.gz OIKCXZAHZQSQLH-LLVKDONJSA-N 1 2 241.335 2.235 20 0 BEADLO COc1ccncc1C[N@@H+]1CCCC[C@@H](F)C1 ZINC001139606194 991289387 /nfs/dbraw/zinc/28/93/87/991289387.db2.gz DIRJQDRTGMNLBK-GFCCVEGCSA-N 1 2 238.306 2.414 20 0 BEADLO COc1ccncc1C[N@H+]1CCCC[C@@H](F)C1 ZINC001139606194 991289405 /nfs/dbraw/zinc/28/94/05/991289405.db2.gz DIRJQDRTGMNLBK-GFCCVEGCSA-N 1 2 238.306 2.414 20 0 BEADLO Cc1ccccc1Cc1nnc(C[NH+](C)C)o1 ZINC001258367282 991311879 /nfs/dbraw/zinc/31/18/79/991311879.db2.gz FXSDQMOAUGMVJP-UHFFFAOYSA-N 1 2 231.299 2.030 20 0 BEADLO CC/C=C\CNC(=O)Nc1ccc2[nH+]ccn2c1 ZINC001311026361 991320971 /nfs/dbraw/zinc/32/09/71/991320971.db2.gz LHUNYPSUBBXUSH-ARJAWSKDSA-N 1 2 244.298 2.422 20 0 BEADLO CCCCC[C@@H](CC)[NH+]1CC(F)(CO)C1 ZINC001258440569 991382030 /nfs/dbraw/zinc/38/20/30/991382030.db2.gz TUMZJTKFNCCTDD-LLVKDONJSA-N 1 2 217.328 2.362 20 0 BEADLO FC[C@H]1CCC[N@@H+]1Cc1ccnc(F)c1 ZINC001139835259 991391555 /nfs/dbraw/zinc/39/15/55/991391555.db2.gz RHRZUWMYQKFHRF-SNVBAGLBSA-N 1 2 212.243 2.155 20 0 BEADLO FC[C@H]1CCC[N@H+]1Cc1ccnc(F)c1 ZINC001139835259 991391564 /nfs/dbraw/zinc/39/15/64/991391564.db2.gz RHRZUWMYQKFHRF-SNVBAGLBSA-N 1 2 212.243 2.155 20 0 BEADLO OC1C[NH+](Cc2ccc(F)c3ccccc23)C1 ZINC001139888012 991411263 /nfs/dbraw/zinc/41/12/63/991411263.db2.gz HMKKYSXCOUIIGM-UHFFFAOYSA-N 1 2 231.270 2.155 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[N@@H+]1CCC[C@@H](F)C1 ZINC001560205369 991417538 /nfs/dbraw/zinc/41/75/38/991417538.db2.gz UCXYFDGICBNNBF-NEPJUHHUSA-N 1 2 245.338 2.398 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[N@H+]1CCC[C@@H](F)C1 ZINC001560205369 991417541 /nfs/dbraw/zinc/41/75/41/991417541.db2.gz UCXYFDGICBNNBF-NEPJUHHUSA-N 1 2 245.338 2.398 20 0 BEADLO c1cc2c(s1)CC[N@@H+](Cc1ccnnc1)C2 ZINC001139981994 991455387 /nfs/dbraw/zinc/45/53/87/991455387.db2.gz XMXJMRTUFRFWRQ-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1cc2c(s1)CC[N@H+](Cc1ccnnc1)C2 ZINC001139981994 991455392 /nfs/dbraw/zinc/45/53/92/991455392.db2.gz XMXJMRTUFRFWRQ-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1cc(C[N@@H+]2CCOC3(CCCCC3)C2)cnn1 ZINC001139985345 991464706 /nfs/dbraw/zinc/46/47/06/991464706.db2.gz OYPUFZSGAOKXEI-UHFFFAOYSA-N 1 2 247.342 2.012 20 0 BEADLO c1cc(C[N@H+]2CCOC3(CCCCC3)C2)cnn1 ZINC001139985345 991464711 /nfs/dbraw/zinc/46/47/11/991464711.db2.gz OYPUFZSGAOKXEI-UHFFFAOYSA-N 1 2 247.342 2.012 20 0 BEADLO C[C@H]1C[N@H+](Cc2cc3ccccc3cn2)CCO1 ZINC001139994985 991474093 /nfs/dbraw/zinc/47/40/93/991474093.db2.gz GDXZPUHDUMANBA-LBPRGKRZSA-N 1 2 242.322 2.456 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cc3ccccc3cn2)CCO1 ZINC001139994985 991474099 /nfs/dbraw/zinc/47/40/99/991474099.db2.gz GDXZPUHDUMANBA-LBPRGKRZSA-N 1 2 242.322 2.456 20 0 BEADLO CCOC(=O)C1([NH2+][C@@H]2CCC(C)(C)C2)CC1 ZINC001258594536 991492671 /nfs/dbraw/zinc/49/26/71/991492671.db2.gz JKGRYQLDDQSCML-SNVBAGLBSA-N 1 2 225.332 2.250 20 0 BEADLO Cc1[nH]nc(NCc2cccc3[nH+]ccn32)c1C ZINC001560593074 991510025 /nfs/dbraw/zinc/51/00/25/991510025.db2.gz NCWKNBZXUMCAPB-UHFFFAOYSA-N 1 2 241.298 2.286 20 0 BEADLO C[C@@H](Cc1cccnc1)[NH2+][C@@H]1CC1(F)F ZINC001258608868 991526940 /nfs/dbraw/zinc/52/69/40/991526940.db2.gz GMFWSEFAHHMDHL-WCBMZHEXSA-N 1 2 212.243 2.010 20 0 BEADLO FC[C@H]1CCC[N@@H+]1Cc1cccc(F)n1 ZINC001140134916 991538047 /nfs/dbraw/zinc/53/80/47/991538047.db2.gz GVCAZCASRHPDET-SNVBAGLBSA-N 1 2 212.243 2.155 20 0 BEADLO FC[C@H]1CCC[N@H+]1Cc1cccc(F)n1 ZINC001140134916 991538060 /nfs/dbraw/zinc/53/80/60/991538060.db2.gz GVCAZCASRHPDET-SNVBAGLBSA-N 1 2 212.243 2.155 20 0 BEADLO C[C@@H](Cc1ccno1)[NH2+]C(C)(C)C(F)F ZINC001560800537 991606570 /nfs/dbraw/zinc/60/65/70/991606570.db2.gz MVVQXHAJDSANNB-ZETCQYMHSA-N 1 2 218.247 2.239 20 0 BEADLO Cc1c(F)nccc1C[NH2+]Cc1ncccc1F ZINC001560804918 991607684 /nfs/dbraw/zinc/60/76/84/991607684.db2.gz RHLQQDWIMXEUCP-UHFFFAOYSA-N 1 2 249.264 2.353 20 0 BEADLO CCn1cnc(Cl)c1C[NH+]1CC(C)C1 ZINC001560800333 991607788 /nfs/dbraw/zinc/60/77/88/991607788.db2.gz JWWIQQVAHUNHHU-UHFFFAOYSA-N 1 2 213.712 2.008 20 0 BEADLO C[C@H](C(=O)N(C)[C@@H](C)C(C)(C)C)n1cc[nH+]c1 ZINC001317998782 991608078 /nfs/dbraw/zinc/60/80/78/991608078.db2.gz OQHBWIUSZXDGPQ-MNOVXSKESA-N 1 2 237.347 2.337 20 0 BEADLO c1cc2c(s1)CC[N@@H+](Cc1ccncn1)C2 ZINC001140343477 991612933 /nfs/dbraw/zinc/61/29/33/991612933.db2.gz QXHUVNGVEYMQCN-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1cc2c(s1)CC[N@H+](Cc1ccncn1)C2 ZINC001140343477 991612938 /nfs/dbraw/zinc/61/29/38/991612938.db2.gz QXHUVNGVEYMQCN-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO COc1c(C)c[nH+]c(CNC(=O)CC2CC2)c1C ZINC001318073574 991616701 /nfs/dbraw/zinc/61/67/01/991616701.db2.gz KENSEYALQXTRLC-UHFFFAOYSA-N 1 2 248.326 2.123 20 0 BEADLO CCC[C@@H](CC(C)C)C(=O)NC1C[NH+](CC)C1 ZINC001318093376 991620533 /nfs/dbraw/zinc/62/05/33/991620533.db2.gz LMXMXQYSMMYFQO-LBPRGKRZSA-N 1 2 240.391 2.269 20 0 BEADLO Cc1cc(C[NH2+]C(CF)CF)cc(C)n1 ZINC001560848171 991622753 /nfs/dbraw/zinc/62/27/53/991622753.db2.gz GAZUKDHETGDWMH-UHFFFAOYSA-N 1 2 214.259 2.096 20 0 BEADLO C[C@]1(O)CC[N@H+](Cc2c(F)cc(F)cc2F)C1 ZINC001140529447 991661529 /nfs/dbraw/zinc/66/15/29/991661529.db2.gz CGGXFMYHZUQTTO-LBPRGKRZSA-N 1 2 245.244 2.061 20 0 BEADLO C[C@]1(O)CC[N@@H+](Cc2c(F)cc(F)cc2F)C1 ZINC001140529447 991661533 /nfs/dbraw/zinc/66/15/33/991661533.db2.gz CGGXFMYHZUQTTO-LBPRGKRZSA-N 1 2 245.244 2.061 20 0 BEADLO C[N@H+](Cc1cc(F)cc(Cl)c1)C1COC1 ZINC001140538829 991661980 /nfs/dbraw/zinc/66/19/80/991661980.db2.gz MUXMBCVZLHUCPW-UHFFFAOYSA-N 1 2 229.682 2.310 20 0 BEADLO C[N@@H+](Cc1cc(F)cc(Cl)c1)C1COC1 ZINC001140538829 991661985 /nfs/dbraw/zinc/66/19/85/991661985.db2.gz MUXMBCVZLHUCPW-UHFFFAOYSA-N 1 2 229.682 2.310 20 0 BEADLO C[C@H](C(=O)NCCCC(C)(C)C)n1cc[nH+]c1 ZINC001318648186 991692781 /nfs/dbraw/zinc/69/27/81/991692781.db2.gz BPNBPXSLKOSSBS-LLVKDONJSA-N 1 2 237.347 2.387 20 0 BEADLO CCCC[C@@H](CCC)[NH+]1CC(F)(CO)C1 ZINC001258760145 991714687 /nfs/dbraw/zinc/71/46/87/991714687.db2.gz JYMMUVNGHBWOSS-LLVKDONJSA-N 1 2 217.328 2.362 20 0 BEADLO CC1(C)CN(C(=O)CCCn2cc[nH+]c2)C1(C)C ZINC001318957552 991748446 /nfs/dbraw/zinc/74/84/46/991748446.db2.gz VVIDHNKEDZSZBX-UHFFFAOYSA-N 1 2 249.358 2.310 20 0 BEADLO C[C@H]1CCC[C@@H]([NH+]2CC(O)(C(F)(F)F)C2)C1 ZINC001258820210 991843156 /nfs/dbraw/zinc/84/31/56/991843156.db2.gz VRSQQKCHSHCKQR-DTWKUNHWSA-N 1 2 237.265 2.174 20 0 BEADLO CC[C@H](C)CN(CC)C(=O)[C@H](C)n1cc[nH+]c1 ZINC001319367676 991848946 /nfs/dbraw/zinc/84/89/46/991848946.db2.gz LAORMUCMUIWSSW-RYUDHWBXSA-N 1 2 237.347 2.339 20 0 BEADLO C[C@@H]1CCC[C@H]([N@@H+]2CC[C@@H](O)C(F)(F)C2)C1 ZINC001258826336 991849788 /nfs/dbraw/zinc/84/97/88/991849788.db2.gz JBFJSJDGUQLRTR-OUAUKWLOSA-N 1 2 233.302 2.267 20 0 BEADLO C[C@@H]1CCC[C@H]([N@H+]2CC[C@@H](O)C(F)(F)C2)C1 ZINC001258826336 991849790 /nfs/dbraw/zinc/84/97/90/991849790.db2.gz JBFJSJDGUQLRTR-OUAUKWLOSA-N 1 2 233.302 2.267 20 0 BEADLO Cc1cscc1NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001319384176 991854181 /nfs/dbraw/zinc/85/41/81/991854181.db2.gz XIJIOSNYDRAKGL-VIFPVBQESA-N 1 2 235.312 2.453 20 0 BEADLO CC(C)c1ocnc1C[NH2+][C@H](C)c1cnn(C)c1 ZINC001320088003 992101261 /nfs/dbraw/zinc/10/12/61/992101261.db2.gz GATUGKYQOSNFNQ-SNVBAGLBSA-N 1 2 248.330 2.382 20 0 BEADLO CC(C)(C)C[N@@H+]1CCN(c2ccccc2)C(=O)C1 ZINC000361269993 992174957 /nfs/dbraw/zinc/17/49/57/992174957.db2.gz BJISIKFYCNQBJS-UHFFFAOYSA-N 1 2 246.354 2.381 20 0 BEADLO CC(C)(C)C[N@H+]1CCN(c2ccccc2)C(=O)C1 ZINC000361269993 992174970 /nfs/dbraw/zinc/17/49/70/992174970.db2.gz BJISIKFYCNQBJS-UHFFFAOYSA-N 1 2 246.354 2.381 20 0 BEADLO CCC(CC)N(CC)C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001261221867 992202963 /nfs/dbraw/zinc/20/29/63/992202963.db2.gz MLVQOJYDOLVKGZ-LLVKDONJSA-N 1 2 237.347 2.481 20 0 BEADLO CC[C@@H]1[C@@H](C)CCN1C(=O)[C@H](C)n1cc[nH+]c1 ZINC001320521696 992229416 /nfs/dbraw/zinc/22/94/16/992229416.db2.gz RFCAQDCXJIVXQA-SDDRHHMPSA-N 1 2 235.331 2.091 20 0 BEADLO CC(=O)c1cc(C[N@@H+]2CC(C)(C)C2(C)C)on1 ZINC001261544274 992371884 /nfs/dbraw/zinc/37/18/84/992371884.db2.gz MQOXROXAPYYWFV-UHFFFAOYSA-N 1 2 236.315 2.498 20 0 BEADLO CC(=O)c1cc(C[N@H+]2CC(C)(C)C2(C)C)on1 ZINC001261544274 992371894 /nfs/dbraw/zinc/37/18/94/992371894.db2.gz MQOXROXAPYYWFV-UHFFFAOYSA-N 1 2 236.315 2.498 20 0 BEADLO CCCN(C(=O)[C@@H](C)n1cc[nH+]c1)C(C)C ZINC001261551454 992380397 /nfs/dbraw/zinc/38/03/97/992380397.db2.gz KVLITRYDRPFUQJ-LLVKDONJSA-N 1 2 223.320 2.091 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2cnon2)s1 ZINC001261638440 992427525 /nfs/dbraw/zinc/42/75/25/992427525.db2.gz BKCGTHUYRIWOTH-MRVPVSSYSA-N 1 2 223.301 2.290 20 0 BEADLO C[C@@H](C(=O)N(C)[C@H]1CCC(C)(C)C1)n1cc[nH+]c1 ZINC001321216971 992489251 /nfs/dbraw/zinc/48/92/51/992489251.db2.gz IVVXIPACMXMALZ-RYUDHWBXSA-N 1 2 249.358 2.481 20 0 BEADLO C[N@H+](CC(F)F)C[Si](C)(C)c1ccccc1 ZINC001321419211 992535752 /nfs/dbraw/zinc/53/57/52/992535752.db2.gz DAYBEDNDEDEXKF-UHFFFAOYSA-N 1 2 243.373 2.338 20 0 BEADLO C[N@@H+](CC(F)F)C[Si](C)(C)c1ccccc1 ZINC001321419211 992535764 /nfs/dbraw/zinc/53/57/64/992535764.db2.gz DAYBEDNDEDEXKF-UHFFFAOYSA-N 1 2 243.373 2.338 20 0 BEADLO CC(C)[C@]1(CO)CCN(c2cc[nH+]cc2F)C1 ZINC001262030168 992618606 /nfs/dbraw/zinc/61/86/06/992618606.db2.gz YWSMYLIOSBSGCF-CYBMUJFWSA-N 1 2 238.306 2.066 20 0 BEADLO CCc1cnccc1[C@@H](C)[NH2+]Cc1nncs1 ZINC001262255635 992820798 /nfs/dbraw/zinc/82/07/98/992820798.db2.gz SXFVZDYGZDRKKQ-SECBINFHSA-N 1 2 248.355 2.346 20 0 BEADLO C[C@@H](C(=O)N[C@@H]1CCCC2(CC2)C1)n1cc[nH+]c1 ZINC001262347577 992849618 /nfs/dbraw/zinc/84/96/18/992849618.db2.gz JBRAOFBCZCAWEY-NWDGAFQWSA-N 1 2 247.342 2.283 20 0 BEADLO C[C@H](C(=O)N[C@@H]1CCCC2(CC2)C1)n1cc[nH+]c1 ZINC001262347579 992850249 /nfs/dbraw/zinc/85/02/49/992850249.db2.gz JBRAOFBCZCAWEY-VXGBXAGGSA-N 1 2 247.342 2.283 20 0 BEADLO C[C@@H](C1CC1)N(C)c1nc(N)c2ccccc2[nH+]1 ZINC001262678055 993017643 /nfs/dbraw/zinc/01/76/43/993017643.db2.gz NTODXCONBNTIMR-VIFPVBQESA-N 1 2 242.326 2.447 20 0 BEADLO CN(C)c1cc(N2CCC[C@@H]2C2CCC2)nc[nH+]1 ZINC001262683071 993024145 /nfs/dbraw/zinc/02/41/45/993024145.db2.gz VJASYOPMTFJASB-GFCCVEGCSA-N 1 2 246.358 2.312 20 0 BEADLO CN(C)c1cc(N2CCC[C@@H]2C2CCC2)[nH+]cn1 ZINC001262683071 993024150 /nfs/dbraw/zinc/02/41/50/993024150.db2.gz VJASYOPMTFJASB-GFCCVEGCSA-N 1 2 246.358 2.312 20 0 BEADLO Cc1cc(C[C@@H](C)Nc2cccc[nH+]2)n[nH]1 ZINC001262687850 993029025 /nfs/dbraw/zinc/02/90/25/993029025.db2.gz ZFBHHENUFMDPIR-SECBINFHSA-N 1 2 216.288 2.156 20 0 BEADLO Cc1cc(C[C@@H](C)Nc2cccc[nH+]2)[nH]n1 ZINC001262687850 993029033 /nfs/dbraw/zinc/02/90/33/993029033.db2.gz ZFBHHENUFMDPIR-SECBINFHSA-N 1 2 216.288 2.156 20 0 BEADLO CCN(Cc1ccccc1C)c1cc(N)nc[nH+]1 ZINC001262687707 993030001 /nfs/dbraw/zinc/03/00/01/993030001.db2.gz UQJOSUDWJPPBJD-UHFFFAOYSA-N 1 2 242.326 2.394 20 0 BEADLO CCc1ccc(N2CC[C@H](O)C(C)(C)C2)[nH+]c1 ZINC001262692207 993033104 /nfs/dbraw/zinc/03/31/04/993033104.db2.gz BRAPETXCPVQYHM-LBPRGKRZSA-N 1 2 234.343 2.241 20 0 BEADLO CCc1ccc(N2C[C@H](C)C[C@@H](CO)C2)[nH+]c1 ZINC001262699971 993040756 /nfs/dbraw/zinc/04/07/56/993040756.db2.gz RDCQIEXRYKLSOT-DGCLKSJQSA-N 1 2 234.343 2.099 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)C1CCCC1 ZINC001262805385 993068508 /nfs/dbraw/zinc/06/85/08/993068508.db2.gz OUIVJDFRILCNDW-UHFFFAOYSA-N 1 2 218.300 2.249 20 0 BEADLO CCC(CC)N(C(=O)C[C@@H]([NH3+])C(F)F)C1CC1 ZINC001263076123 993100395 /nfs/dbraw/zinc/10/03/95/993100395.db2.gz MNFOWYVFZHMGET-SNVBAGLBSA-N 1 2 248.317 2.149 20 0 BEADLO CCC(CC)N(C(=O)C[C@H]([NH3+])C(F)F)C1CC1 ZINC001263076122 993101363 /nfs/dbraw/zinc/10/13/63/993101363.db2.gz MNFOWYVFZHMGET-JTQLQIEISA-N 1 2 248.317 2.149 20 0 BEADLO CC[C@H]([NH2+][C@@H]1C[C@@H]2CCCC[C@H]12)c1c[nH]nn1 ZINC001576290048 993256258 /nfs/dbraw/zinc/25/62/58/993256258.db2.gz KUJFFHNSEOJNEI-FIQHERPVSA-N 1 2 234.347 2.424 20 0 BEADLO CC[C@H]([NH2+][C@@H]1C[C@@H]2CCCC[C@H]12)c1cn[nH]n1 ZINC001576290048 993256268 /nfs/dbraw/zinc/25/62/68/993256268.db2.gz KUJFFHNSEOJNEI-FIQHERPVSA-N 1 2 234.347 2.424 20 0 BEADLO CC/C(C)=C\C(=O)OCCCc1c[nH+]cn1C ZINC001263510935 993353639 /nfs/dbraw/zinc/35/36/39/993353639.db2.gz UAOYSIUTXMWGFZ-FLIBITNWSA-N 1 2 236.315 2.252 20 0 BEADLO CCC1(C(=O)OCC(C)(C)n2cc[nH+]c2)CC1 ZINC001263544358 993377997 /nfs/dbraw/zinc/37/79/97/993377997.db2.gz WYXRRSYVBWXMQS-UHFFFAOYSA-N 1 2 236.315 2.352 20 0 BEADLO C[C@]1(CO)CCN(c2[nH+]ccc3ccccc32)C1 ZINC000381690612 993415021 /nfs/dbraw/zinc/41/50/21/993415021.db2.gz FKWASFUIXFKNJI-HNNXBMFYSA-N 1 2 242.322 2.444 20 0 BEADLO CCn1c[nH+]cc1COC(=O)c1c(C)coc1C ZINC001263663138 993454530 /nfs/dbraw/zinc/45/45/30/993454530.db2.gz VOOAVZBJRZVBTH-UHFFFAOYSA-N 1 2 248.282 2.470 20 0 BEADLO CCC[C@@H](CC)NC(=O)CCc1[nH+]ccn1C ZINC001263721042 993478826 /nfs/dbraw/zinc/47/88/26/993478826.db2.gz GMVIEDJVVJRTLT-LLVKDONJSA-N 1 2 237.347 2.048 20 0 BEADLO C[C@H](C[N@@H+]1CCCC(=O)C1)c1ccccc1 ZINC000384679650 993610616 /nfs/dbraw/zinc/61/06/16/993610616.db2.gz DJBBXNKJRDXFFI-GFCCVEGCSA-N 1 2 217.312 2.455 20 0 BEADLO C[C@H](C[N@H+]1CCCC(=O)C1)c1ccccc1 ZINC000384679650 993610629 /nfs/dbraw/zinc/61/06/29/993610629.db2.gz DJBBXNKJRDXFFI-GFCCVEGCSA-N 1 2 217.312 2.455 20 0 BEADLO CN(C)c1ccc(Nc2cc(C#N)ccn2)c[nH+]1 ZINC000387205618 993703635 /nfs/dbraw/zinc/70/36/35/993703635.db2.gz IJSUXLTXHNFEAR-UHFFFAOYSA-N 1 2 239.282 2.158 20 0 BEADLO COc1cc[nH+]cc1C1=CCC2(CC1)OCCO2 ZINC000700733684 993849176 /nfs/dbraw/zinc/84/91/76/993849176.db2.gz FMUNYLQUIYAPHR-UHFFFAOYSA-N 1 2 247.294 2.401 20 0 BEADLO Cc1cc(NC2CSC2)nc(C(C)C)[nH+]1 ZINC000702350305 993992028 /nfs/dbraw/zinc/99/20/28/993992028.db2.gz KKKKSANARPHHJK-UHFFFAOYSA-N 1 2 223.345 2.436 20 0 BEADLO CC(C)(C)[C@H](CO)Nc1cc(N)cc(Cl)[nH+]1 ZINC000393981154 994026403 /nfs/dbraw/zinc/02/64/03/994026403.db2.gz AUBHSWKKUPDMHJ-QMMMGPOBSA-N 1 2 243.738 2.136 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CCC[C@H]1CC(C)C ZINC001292677903 994622241 /nfs/dbraw/zinc/62/22/41/994622241.db2.gz WUQJUARFPIVYJK-LBPRGKRZSA-N 1 2 249.358 2.298 20 0 BEADLO Cc1cc(F)cc(NC(=O)Cc2c[nH]c[nH+]2)c1 ZINC001294735648 994711283 /nfs/dbraw/zinc/71/12/83/994711283.db2.gz MVLPKHSXHHXFKL-UHFFFAOYSA-N 1 2 233.246 2.038 20 0 BEADLO CCc1cc(NC[C@@H]2CCCOC2)nc(CC)[nH+]1 ZINC001336687437 995080518 /nfs/dbraw/zinc/08/05/18/995080518.db2.gz WJHZGZHTJWZEBW-NSHDSACASA-N 1 2 249.358 2.440 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)C2CCCC2)[nH+]1 ZINC001304103839 995189897 /nfs/dbraw/zinc/18/98/97/995189897.db2.gz FVFRSPMIGJRPBP-UHFFFAOYSA-N 1 2 235.331 2.340 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)C2CCCC2)c[nH+]1 ZINC001304103839 995189901 /nfs/dbraw/zinc/18/99/01/995189901.db2.gz FVFRSPMIGJRPBP-UHFFFAOYSA-N 1 2 235.331 2.340 20 0 BEADLO Cc1cc([C@@H](C)NC(=O)Cc2c[nH]c[nH+]2)c(C)o1 ZINC001339052607 995248677 /nfs/dbraw/zinc/24/86/77/995248677.db2.gz ABWIHFSTGBLXDS-SECBINFHSA-N 1 2 247.298 2.039 20 0 BEADLO Cc1cc([C@H](C)NC(=O)Cc2c[nH]c[nH+]2)c(C)o1 ZINC001339052608 995251176 /nfs/dbraw/zinc/25/11/76/995251176.db2.gz ABWIHFSTGBLXDS-VIFPVBQESA-N 1 2 247.298 2.039 20 0 BEADLO Cc1cncnc1Nc1ccc2c(c1)[nH+]cn2C ZINC001306983363 995278159 /nfs/dbraw/zinc/27/81/59/995278159.db2.gz AXGVFYKGUMUFLJ-UHFFFAOYSA-N 1 2 239.282 2.415 20 0 BEADLO CCNc1ccc(Nc2nccnc2F)c[nH+]1 ZINC001307233592 995307038 /nfs/dbraw/zinc/30/70/38/995307038.db2.gz FGXKCSRWSDVKRY-UHFFFAOYSA-N 1 2 233.250 2.186 20 0 BEADLO CCc1cn(CC(=O)N2CCCC[C@@H]2CC)c[nH+]1 ZINC001307397760 995345039 /nfs/dbraw/zinc/34/50/39/995345039.db2.gz UPRAIDFAGPIOQQ-ZDUSSCGKSA-N 1 2 249.358 2.237 20 0 BEADLO Cc1ccccc1[C@@H](CO)[NH2+]Cc1nccs1 ZINC001307678108 995431043 /nfs/dbraw/zinc/43/10/43/995431043.db2.gz FIJOUIUFTNQVPZ-GFCCVEGCSA-N 1 2 248.351 2.275 20 0 BEADLO Cc1cn[nH]c1C[NH2+][C@H](C)c1ncccc1C ZINC001308152640 995572803 /nfs/dbraw/zinc/57/28/03/995572803.db2.gz HYTCFVGMHUCUKT-LLVKDONJSA-N 1 2 230.315 2.272 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@H](C)c1ncccc1C ZINC001308152640 995572810 /nfs/dbraw/zinc/57/28/10/995572810.db2.gz HYTCFVGMHUCUKT-LLVKDONJSA-N 1 2 230.315 2.272 20 0 BEADLO C[C@H]1CCC(F)(F)C[N@@H+]1CCC1OCCCO1 ZINC001308153733 995574371 /nfs/dbraw/zinc/57/43/71/995574371.db2.gz KIEWBDPNMRNYRQ-JTQLQIEISA-N 1 2 249.301 2.259 20 0 BEADLO C[C@H]1CCC(F)(F)C[N@H+]1CCC1OCCCO1 ZINC001308153733 995574381 /nfs/dbraw/zinc/57/43/81/995574381.db2.gz KIEWBDPNMRNYRQ-JTQLQIEISA-N 1 2 249.301 2.259 20 0 BEADLO Cc1cc(F)cc(N2CCC([C@@H](C)O)CC2)[nH+]1 ZINC001515944697 1170060306 /nfs/dbraw/zinc/06/03/06/1170060306.db2.gz QRSPEIGJMCDIPQ-SNVBAGLBSA-N 1 2 238.306 2.126 20 0 BEADLO C[C@@H](CC1CCC1)NC(=O)CCc1[nH+]ccn1C ZINC001521768322 1170066594 /nfs/dbraw/zinc/06/65/94/1170066594.db2.gz VDDHRNFZMDQWEP-NSHDSACASA-N 1 2 249.358 2.048 20 0 BEADLO CC(C)Cc1nnc([C@H]([NH3+])c2ccccc2)o1 ZINC000011586802 1170083320 /nfs/dbraw/zinc/08/33/20/1170083320.db2.gz XOOKYMLSEPCGFN-GFCCVEGCSA-N 1 2 231.299 2.316 20 0 BEADLO CCc1nnc([C@@H](C)[NH2+]Cc2ccc(F)cc2)[nH]1 ZINC001620887871 1170165747 /nfs/dbraw/zinc/16/57/47/1170165747.db2.gz XGDLTQLHLOEOML-SECBINFHSA-N 1 2 248.305 2.357 20 0 BEADLO CC(C)Cc1nnc([C@@H]([NH3+])c2ccccc2)o1 ZINC000011586801 1170469832 /nfs/dbraw/zinc/46/98/32/1170469832.db2.gz XOOKYMLSEPCGFN-LBPRGKRZSA-N 1 2 231.299 2.316 20 0 BEADLO CCc1cn(Cc2nc(C)cs2)c[nH+]1 ZINC001614960311 1170500386 /nfs/dbraw/zinc/50/03/86/1170500386.db2.gz KXFWZJXGSVTBIN-UHFFFAOYSA-N 1 2 207.302 2.259 20 0 BEADLO Cc1cc(=O)[nH]c(C[N@H+]2CC(C)(C)C2(C)C)n1 ZINC001615772188 1170531089 /nfs/dbraw/zinc/53/10/89/1170531089.db2.gz FITSMCBCHFIAJZ-UHFFFAOYSA-N 1 2 235.331 2.111 20 0 BEADLO CC[C@@H]1CCN(C(=O)[C@H](C)Cc2c[nH]c[nH+]2)[C@@H]1C ZINC001616974292 1170574131 /nfs/dbraw/zinc/57/41/31/1170574131.db2.gz LCWLXNQAAQNFNE-IJLUTSLNSA-N 1 2 249.358 2.235 20 0 BEADLO CC[C@@H]1CCN(C(=O)[C@H](C)Cc2c[nH+]c[nH]2)[C@@H]1C ZINC001616974292 1170574137 /nfs/dbraw/zinc/57/41/37/1170574137.db2.gz LCWLXNQAAQNFNE-IJLUTSLNSA-N 1 2 249.358 2.235 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1cc(C)ccc1C ZINC001618377516 1170632282 /nfs/dbraw/zinc/63/22/82/1170632282.db2.gz GVHJDOMXASEGRU-ZDUSSCGKSA-N 1 2 232.327 2.336 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1cc(C)ccc1C ZINC001618377516 1170632288 /nfs/dbraw/zinc/63/22/88/1170632288.db2.gz GVHJDOMXASEGRU-ZDUSSCGKSA-N 1 2 232.327 2.336 20 0 BEADLO CC(=O)Nc1cccc(Nc2ccc(N)[nH+]c2)c1 ZINC000019952079 1170690932 /nfs/dbraw/zinc/69/09/32/1170690932.db2.gz XHVKODHJUGPOHW-UHFFFAOYSA-N 1 2 242.282 2.366 20 0 BEADLO O=C1CC[NH+](Cc2ccc3ncccc3c2)CC1 ZINC000020248370 1170705401 /nfs/dbraw/zinc/70/54/01/1170705401.db2.gz FBMUCJNYNRRQAO-UHFFFAOYSA-N 1 2 240.306 2.400 20 0 BEADLO C[C@@H]1C[C@@H]1c1[nH]c2cc3c(cc2[nH+]1)OCCO3 ZINC000037400491 1170942894 /nfs/dbraw/zinc/94/28/94/1170942894.db2.gz ADPKWYQMWRMXHC-SFYZADRCSA-N 1 2 230.267 2.458 20 0 BEADLO C[C@H](NC(=O)Cn1cc[nH+]c1)C1CCCCCC1 ZINC001624868491 1171059162 /nfs/dbraw/zinc/05/91/62/1171059162.db2.gz LXXCQCQRVUNACA-LBPRGKRZSA-N 1 2 249.358 2.358 20 0 BEADLO Cc1cc(NC(=O)c2ccc(Cl)[nH]2)cc[nH+]1 ZINC001627959946 1171194419 /nfs/dbraw/zinc/19/44/19/1171194419.db2.gz YDJZKVNKNUKYMS-UHFFFAOYSA-N 1 2 235.674 2.046 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1C[C@@H](C)CCC[C@@H]1C ZINC001628176237 1171213969 /nfs/dbraw/zinc/21/39/69/1171213969.db2.gz WYJDXLYWBAANCM-QWRGUYRKSA-N 1 2 249.358 2.298 20 0 BEADLO C[C@H]1CC(=O)CC[N@@H+]1CCOc1ccccc1 ZINC000042896790 1171262880 /nfs/dbraw/zinc/26/28/80/1171262880.db2.gz ILCRRIMEXLCMRR-LBPRGKRZSA-N 1 2 233.311 2.119 20 0 BEADLO C[C@H]1CC(=O)CC[N@H+]1CCOc1ccccc1 ZINC000042896790 1171262889 /nfs/dbraw/zinc/26/28/89/1171262889.db2.gz ILCRRIMEXLCMRR-LBPRGKRZSA-N 1 2 233.311 2.119 20 0 BEADLO C[C@H](C(=O)N(C)Cc1cccs1)n1cc[nH+]c1 ZINC000044888034 1171420615 /nfs/dbraw/zinc/42/06/15/1171420615.db2.gz NMNVXNSCBKNOON-SNVBAGLBSA-N 1 2 249.339 2.164 20 0 BEADLO CCCCCC(=O)NCc1c[nH+]c(CC)[nH]1 ZINC001635607446 1171741848 /nfs/dbraw/zinc/74/18/48/1171741848.db2.gz YFTATKSOYWSTHC-UHFFFAOYSA-N 1 2 223.320 2.169 20 0 BEADLO CCCCCC(=O)NCc1c[nH]c(CC)[nH+]1 ZINC001635607446 1171741853 /nfs/dbraw/zinc/74/18/53/1171741853.db2.gz YFTATKSOYWSTHC-UHFFFAOYSA-N 1 2 223.320 2.169 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1ccc(C)c(O)c1C ZINC001635820284 1171764037 /nfs/dbraw/zinc/76/40/37/1171764037.db2.gz AUZNTOJKSKSZGU-GFCCVEGCSA-N 1 2 248.326 2.042 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1ccc(C)c(O)c1C ZINC001635820284 1171764044 /nfs/dbraw/zinc/76/40/44/1171764044.db2.gz AUZNTOJKSKSZGU-GFCCVEGCSA-N 1 2 248.326 2.042 20 0 BEADLO C[C@@H]1C[C@H]1c1nnc([C@H]([NH3+])c2ccccc2)o1 ZINC000050283972 1171788353 /nfs/dbraw/zinc/78/83/53/1171788353.db2.gz TVSRZZWGFWMHLR-FBIMIBRVSA-N 1 2 229.283 2.241 20 0 BEADLO C[C@@H]1C[C@@H]1c1nnc([C@H]([NH3+])c2ccccc2)o1 ZINC000050283970 1171786987 /nfs/dbraw/zinc/78/69/87/1171786987.db2.gz TVSRZZWGFWMHLR-DVVUODLYSA-N 1 2 229.283 2.241 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1cc(C)c(C)c(O)c1 ZINC001636894832 1171888875 /nfs/dbraw/zinc/88/88/75/1171888875.db2.gz ANEIGMFYBHUHDG-LBPRGKRZSA-N 1 2 248.326 2.042 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1cc(C)c(C)c(O)c1 ZINC001636894832 1171888886 /nfs/dbraw/zinc/88/88/86/1171888886.db2.gz ANEIGMFYBHUHDG-LBPRGKRZSA-N 1 2 248.326 2.042 20 0 BEADLO CCO[C@@H]1CCC[N@@H+]([C@H](C)c2csnn2)C1 ZINC000649318227 398142798 /nfs/dbraw/zinc/14/27/98/398142798.db2.gz FOLDEVCPQCPIEF-NXEZZACHSA-N 1 2 241.360 2.100 20 0 BEADLO CCO[C@@H]1CCC[N@H+]([C@H](C)c2csnn2)C1 ZINC000649318227 398142799 /nfs/dbraw/zinc/14/27/99/398142799.db2.gz FOLDEVCPQCPIEF-NXEZZACHSA-N 1 2 241.360 2.100 20 0 BEADLO CC[C@H]1CCN1C(=O)Nc1cc[nH+]cc1C ZINC000297851393 398147428 /nfs/dbraw/zinc/14/74/28/398147428.db2.gz STMIEHAOTPDHQK-JTQLQIEISA-N 1 2 219.288 2.406 20 0 BEADLO CCC(CC)([NH2+]CC=C(C)C)C(=O)OC ZINC000336728798 168330688 /nfs/dbraw/zinc/33/06/88/168330688.db2.gz IMALJDDOAMEMGX-UHFFFAOYSA-N 1 2 213.321 2.274 20 0 BEADLO CCC(CC)([NH2+]CCSC(C)C)C(=O)OC ZINC000336723125 168331117 /nfs/dbraw/zinc/33/11/17/168331117.db2.gz DUKSPVJBWWKAOD-UHFFFAOYSA-N 1 2 247.404 2.449 20 0 BEADLO Cc1cc(N[C@@H]2CCC[C@H]2OC(F)F)nc[nH+]1 ZINC000336907562 187323041 /nfs/dbraw/zinc/32/30/41/187323041.db2.gz FYQYFRVPDHDALM-RKDXNWHRSA-N 1 2 243.257 2.357 20 0 BEADLO C[C@@H](NCc1cn2ccccc2[nH+]1)C(F)F ZINC000389904825 398148727 /nfs/dbraw/zinc/14/87/27/398148727.db2.gz GFDBRTRGAPWALY-MRVPVSSYSA-N 1 2 225.242 2.078 20 0 BEADLO COc1ccc(C[NH2+][C@@H](C)C(F)F)cc1O ZINC000389936637 398150814 /nfs/dbraw/zinc/15/08/14/398150814.db2.gz NDKSTLJMGZZSKT-ZETCQYMHSA-N 1 2 231.242 2.144 20 0 BEADLO Cc1cc(C[N@@H+]2CC[S@](=O)[C@@H](C)C2)cs1 ZINC000336224005 178003216 /nfs/dbraw/zinc/00/32/16/178003216.db2.gz AXVKVEWSEVJNMX-BONVTDFDSA-N 1 2 243.397 2.009 20 0 BEADLO Cc1cc(C[N@H+]2CC[S@](=O)[C@@H](C)C2)cs1 ZINC000336224005 178003217 /nfs/dbraw/zinc/00/32/17/178003217.db2.gz AXVKVEWSEVJNMX-BONVTDFDSA-N 1 2 243.397 2.009 20 0 BEADLO C[C@@H]([NH2+][C@H](C)C(F)F)c1cncs1 ZINC000389957678 398152012 /nfs/dbraw/zinc/15/20/12/398152012.db2.gz XULLECQLPDNSTE-PHDIDXHHSA-N 1 2 206.261 2.447 20 0 BEADLO CCc1cc(NCCCC(C)(F)F)nc[nH+]1 ZINC000390051050 398156541 /nfs/dbraw/zinc/15/65/41/398156541.db2.gz TXFVVYQVZOGRBN-UHFFFAOYSA-N 1 2 229.274 2.308 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccc3c(c2)OCO3)no1 ZINC000044293703 178027765 /nfs/dbraw/zinc/02/77/65/178027765.db2.gz XXFKKFQPAKOJLU-UHFFFAOYSA-N 1 2 246.266 2.002 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2nccs2)on1 ZINC000083143234 178031620 /nfs/dbraw/zinc/03/16/20/178031620.db2.gz CZMLIHFYRBSVED-QMMMGPOBSA-N 1 2 223.301 2.290 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2cncs2)on1 ZINC000125548594 178031664 /nfs/dbraw/zinc/03/16/64/178031664.db2.gz PPEKVGNQQJGIMV-QMMMGPOBSA-N 1 2 223.301 2.290 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2cncc(F)c2)nn1C ZINC000361134347 178032028 /nfs/dbraw/zinc/03/20/28/178032028.db2.gz DWXSCXROSREYOU-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO F[C@@]1(c2ccccc2)C[C@@H]1NCc1[nH]cc[nH+]1 ZINC000424204295 398174301 /nfs/dbraw/zinc/17/43/01/398174301.db2.gz VIGWXFKGHTUWLB-WCQYABFASA-N 1 2 231.274 2.137 20 0 BEADLO F[C@@]1(c2ccccc2)C[C@@H]1[NH2+]Cc1ncc[nH]1 ZINC000424204295 398174305 /nfs/dbraw/zinc/17/43/05/398174305.db2.gz VIGWXFKGHTUWLB-WCQYABFASA-N 1 2 231.274 2.137 20 0 BEADLO Cc1nnc(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)s1 ZINC000649907359 398179553 /nfs/dbraw/zinc/17/95/53/398179553.db2.gz PPVMFOXBQPYJGA-SECBINFHSA-N 1 2 245.298 2.078 20 0 BEADLO Cc1nnc(C[N@H+]2CC[C@@]3(CC3(F)F)C2)s1 ZINC000649907359 398179555 /nfs/dbraw/zinc/17/95/55/398179555.db2.gz PPVMFOXBQPYJGA-SECBINFHSA-N 1 2 245.298 2.078 20 0 BEADLO Cc1cnc(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)nc1 ZINC000649907460 398181018 /nfs/dbraw/zinc/18/10/18/398181018.db2.gz RWAHILNQLKMBFB-LLVKDONJSA-N 1 2 239.269 2.016 20 0 BEADLO Cc1cnc(C[N@H+]2CC[C@@]3(CC3(F)F)C2)nc1 ZINC000649907460 398181020 /nfs/dbraw/zinc/18/10/20/398181020.db2.gz RWAHILNQLKMBFB-LLVKDONJSA-N 1 2 239.269 2.016 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2CC[C@]3(CC3(F)F)C2)no1 ZINC000649908310 398183921 /nfs/dbraw/zinc/18/39/21/398183921.db2.gz LNIRGMJJHUKDPI-XCBNKYQSSA-N 1 2 243.257 2.170 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2CC[C@]3(CC3(F)F)C2)no1 ZINC000649908310 398183923 /nfs/dbraw/zinc/18/39/23/398183923.db2.gz LNIRGMJJHUKDPI-XCBNKYQSSA-N 1 2 243.257 2.170 20 0 BEADLO Cc1cc(N(C)CC2(O)CCCCCC2)nc[nH+]1 ZINC000302434210 178096370 /nfs/dbraw/zinc/09/63/70/178096370.db2.gz PFZXCFDWZUCNGO-UHFFFAOYSA-N 1 2 249.358 2.307 20 0 BEADLO Cc1cc(N(C)C[C@@H]2CCCO2)nc(C2CC2)[nH+]1 ZINC000185831504 178099304 /nfs/dbraw/zinc/09/93/04/178099304.db2.gz HWLXFPACVWSHJF-LBPRGKRZSA-N 1 2 247.342 2.278 20 0 BEADLO Cc1cc(N(C)CCC(F)(F)F)nc[nH+]1 ZINC000301277493 178099355 /nfs/dbraw/zinc/09/93/55/178099355.db2.gz PDKROYSLDJWXLF-UHFFFAOYSA-N 1 2 219.210 2.174 20 0 BEADLO Cc1cc(N(C)CC[C@H](C)O)nc(C(C)C)[nH+]1 ZINC000135260014 178099379 /nfs/dbraw/zinc/09/93/79/178099379.db2.gz WBDDNLXSCNHYDT-NSHDSACASA-N 1 2 237.347 2.116 20 0 BEADLO Cc1cc(N(C)[C@@H](C)c2cccnc2)nc[nH+]1 ZINC000301241883 178100605 /nfs/dbraw/zinc/10/06/05/178100605.db2.gz GKRYZLSLGGUXLV-NSHDSACASA-N 1 2 228.299 2.377 20 0 BEADLO Cc1cc(N(C)[C@H](C)c2cccnc2)nc[nH+]1 ZINC000301241882 178100803 /nfs/dbraw/zinc/10/08/03/178100803.db2.gz GKRYZLSLGGUXLV-LLVKDONJSA-N 1 2 228.299 2.377 20 0 BEADLO Cc1cc(N2CCCC[C@H](C)C2)nc[nH+]1 ZINC000302477908 178114121 /nfs/dbraw/zinc/11/41/21/178114121.db2.gz XNPARAJBOAVGKU-JTQLQIEISA-N 1 2 205.305 2.411 20 0 BEADLO Cc1cc(N2CCS[C@H](C)CC2)nc[nH+]1 ZINC000302736775 178118167 /nfs/dbraw/zinc/11/81/67/178118167.db2.gz PEFOMTKLLPWITK-SNVBAGLBSA-N 1 2 223.345 2.117 20 0 BEADLO Cc1nc(Nc2cnn(CCF)c2)c(C)c(C)[nH+]1 ZINC000624537492 398201608 /nfs/dbraw/zinc/20/16/08/398201608.db2.gz FHKSTAQVNFIYJH-UHFFFAOYSA-N 1 2 249.293 2.311 20 0 BEADLO Cc1cc(N2CC[C@H]([C@@H](C)O)C2)nc(C(C)C)[nH+]1 ZINC000162661193 178119818 /nfs/dbraw/zinc/11/98/18/178119818.db2.gz CXSJULJAMUMUHC-NEPJUHHUSA-N 1 2 249.358 2.116 20 0 BEADLO Cc1cc(NC(=O)CCc2nccs2)cc[nH+]1 ZINC000299067777 178127863 /nfs/dbraw/zinc/12/78/63/178127863.db2.gz CYLWTVGARXIREC-UHFFFAOYSA-N 1 2 247.323 2.418 20 0 BEADLO FCC1CC[NH+](Cc2noc(C3CC3)n2)CC1 ZINC000451387527 398204964 /nfs/dbraw/zinc/20/49/64/398204964.db2.gz DJOWPXIUUVCYHI-UHFFFAOYSA-N 1 2 239.294 2.129 20 0 BEADLO Cc1cc(NC(=O)C[C@H]2CCCCO2)cc[nH+]1 ZINC000074640944 178134338 /nfs/dbraw/zinc/13/43/38/178134338.db2.gz ICLBUIPRYQDWKF-GFCCVEGCSA-N 1 2 234.299 2.288 20 0 BEADLO CCc1cc(N2C[C@H](C)OC[C@H]2CC)nc(C)[nH+]1 ZINC000272811268 538926255 /nfs/dbraw/zinc/92/62/55/538926255.db2.gz COBBIAYFYPKFOH-GXFFZTMASA-N 1 2 249.358 2.351 20 0 BEADLO Cc1cc(NC(=O)NC2CCCC2)cc[nH+]1 ZINC000074921617 178139955 /nfs/dbraw/zinc/13/99/55/178139955.db2.gz KUQFVRVGLYEHOS-UHFFFAOYSA-N 1 2 219.288 2.454 20 0 BEADLO Cc1cc(NC(=O)NCc2ccn(C)c2)cc[nH+]1 ZINC000119924031 178140592 /nfs/dbraw/zinc/14/05/92/178140592.db2.gz KZQFTHCZWQKOMZ-UHFFFAOYSA-N 1 2 244.298 2.050 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2CCO[C@@H](C)C2)cc[nH+]1 ZINC000271550920 178142262 /nfs/dbraw/zinc/14/22/62/178142262.db2.gz ZYCDHBLZFBMESN-CMPLNLGQSA-N 1 2 249.314 2.079 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CCO[C@@H](C)C2)cc[nH+]1 ZINC000271837142 178145149 /nfs/dbraw/zinc/14/51/49/178145149.db2.gz AKHBDNTZRVQGOS-WDEREUQCSA-N 1 2 234.299 2.144 20 0 BEADLO Cc1cc(NC2CCSCC2)nc[nH+]1 ZINC000123142629 178154141 /nfs/dbraw/zinc/15/41/41/178154141.db2.gz NDNWYQSKQSCPAS-UHFFFAOYSA-N 1 2 209.318 2.093 20 0 BEADLO C[C@@H]([N@H+](C)Cc1csnn1)C(C)(C)C ZINC000576368444 365580085 /nfs/dbraw/zinc/58/00/85/365580085.db2.gz XOXLFYWRURRNCZ-MRVPVSSYSA-N 1 2 213.350 2.405 20 0 BEADLO C[C@@H]([N@@H+](C)Cc1csnn1)C(C)(C)C ZINC000576368444 365580091 /nfs/dbraw/zinc/58/00/91/365580091.db2.gz XOXLFYWRURRNCZ-MRVPVSSYSA-N 1 2 213.350 2.405 20 0 BEADLO Cc1cc(NCCC(C)(C)CO)nc(C2CC2)[nH+]1 ZINC000295003990 178157762 /nfs/dbraw/zinc/15/77/62/178157762.db2.gz RUMZSCXFRBVKEN-UHFFFAOYSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1cc(NCCC(C)(C)O)nc(C2CC2)[nH+]1 ZINC000274727866 178158164 /nfs/dbraw/zinc/15/81/64/178158164.db2.gz AZKLIYBEYBATTL-UHFFFAOYSA-N 1 2 235.331 2.235 20 0 BEADLO Cc1cc(NCCC[C@H](C)O)nc(C2CC2)[nH+]1 ZINC000278561883 178159722 /nfs/dbraw/zinc/15/97/22/178159722.db2.gz BCAKQOCRCZQPMJ-JTQLQIEISA-N 1 2 235.331 2.235 20 0 BEADLO CC(C)(C)n1cc(C[NH2+][C@H]2CCC[C@H]2F)nn1 ZINC000339583849 187329921 /nfs/dbraw/zinc/32/99/21/187329921.db2.gz JLRBZMHTNZCWSO-MNOVXSKESA-N 1 2 240.326 2.013 20 0 BEADLO Cc1cc(NCCc2ccncc2C)nc[nH+]1 ZINC000301825538 178163257 /nfs/dbraw/zinc/16/32/57/178163257.db2.gz IUPYUAJVVBQEDG-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO Cc1cc(NCC[C@H](C)CCO)nc(C2CC2)[nH+]1 ZINC000294918691 178163381 /nfs/dbraw/zinc/16/33/81/178163381.db2.gz JRSBAVVXSRPYLZ-JTQLQIEISA-N 1 2 249.358 2.483 20 0 BEADLO Cc1cc(NCCc2ccc(Cl)nc2)nc[nH+]1 ZINC000301674380 178163681 /nfs/dbraw/zinc/16/36/81/178163681.db2.gz RPWZJZXUZGPVNP-UHFFFAOYSA-N 1 2 248.717 2.488 20 0 BEADLO Cc1cc(NC[C@@H](O)c2ccc(F)cc2)nc[nH+]1 ZINC000301231699 178165909 /nfs/dbraw/zinc/16/59/09/178165909.db2.gz IBYKVJZCURNKSL-GFCCVEGCSA-N 1 2 247.273 2.070 20 0 BEADLO Cc1cc(NC[C@H](C)C(F)(F)F)nc[nH+]1 ZINC000308849926 178168875 /nfs/dbraw/zinc/16/88/75/178168875.db2.gz NVIGWBBOVOJGPR-LURJTMIESA-N 1 2 219.210 2.395 20 0 BEADLO Cc1cc(NC[C@H]2CC[C@H](O)C2)nc(C2CC2)[nH+]1 ZINC000191638630 178169959 /nfs/dbraw/zinc/16/99/59/178169959.db2.gz BAYXIRGSERGIFY-JQWIXIFHSA-N 1 2 247.342 2.235 20 0 BEADLO Cc1cc(NC[C@](C)(O)c2ccsc2)nc[nH+]1 ZINC000301324810 178170664 /nfs/dbraw/zinc/17/06/64/178170664.db2.gz AGBVYNAKQJGZHE-LBPRGKRZSA-N 1 2 249.339 2.166 20 0 BEADLO Cc1cc(NCc2ccc(O)c(F)c2)nc[nH+]1 ZINC000301371957 178173136 /nfs/dbraw/zinc/17/31/36/178173136.db2.gz QNFLKPVCCKUKDL-UHFFFAOYSA-N 1 2 233.246 2.242 20 0 BEADLO Cc1cc(NCc2ccnn2C)nc(C2CC2)[nH+]1 ZINC000265330266 178174667 /nfs/dbraw/zinc/17/46/67/178174667.db2.gz GHASQISRFBAOHJ-UHFFFAOYSA-N 1 2 243.314 2.008 20 0 BEADLO Cc1cc(NCc2cnn(C)c2)nc(C2CC2)[nH+]1 ZINC000265365632 178175180 /nfs/dbraw/zinc/17/51/80/178175180.db2.gz NGBZJGSNBLSZNX-UHFFFAOYSA-N 1 2 243.314 2.008 20 0 BEADLO Cc1cc(NCc2cnn(C)c2)nc(C(C)C)[nH+]1 ZINC000041160071 178175187 /nfs/dbraw/zinc/17/51/87/178175187.db2.gz DRSSDICSNILFFJ-UHFFFAOYSA-N 1 2 245.330 2.254 20 0 BEADLO CCc1nnc(C[NH2+][C@@H](C)c2ccccc2F)[nH]1 ZINC000274594141 538930305 /nfs/dbraw/zinc/93/03/05/538930305.db2.gz KUFFDTHGSLXLKP-VIFPVBQESA-N 1 2 248.305 2.357 20 0 BEADLO Cc1nc(CNc2cc(C)[nH+]cn2)sc1C ZINC000301450396 178176563 /nfs/dbraw/zinc/17/65/63/178176563.db2.gz PSUZTZYDNWTJCG-UHFFFAOYSA-N 1 2 234.328 2.470 20 0 BEADLO Cc1cc(N[C@@H](C)[C@H]2CCOC2)nc(C2CC2)[nH+]1 ZINC000266287723 178178605 /nfs/dbraw/zinc/17/86/05/178178605.db2.gz VVWPSNRPBUDVBO-JQWIXIFHSA-N 1 2 247.342 2.499 20 0 BEADLO Cc1cc(N[C@@H](C)[C@@H]2CCCCO2)nc[nH+]1 ZINC000309762504 178179343 /nfs/dbraw/zinc/17/93/43/178179343.db2.gz IZEPDTRYCQKQNL-QWRGUYRKSA-N 1 2 221.304 2.155 20 0 BEADLO Cc1cc(N[C@@H](C)[C@@H](C)CO)nc(C2CC2)[nH+]1 ZINC000265813907 178179409 /nfs/dbraw/zinc/17/94/09/178179409.db2.gz GGDQXWAWOCRWST-WPRPVWTQSA-N 1 2 235.331 2.091 20 0 BEADLO Cc1cc(N[C@@H](C)c2cc[nH]c(=O)c2)nc[nH+]1 ZINC000338735424 178179772 /nfs/dbraw/zinc/17/97/72/178179772.db2.gz XMDVRWXDZYXPEC-VIFPVBQESA-N 1 2 230.271 2.059 20 0 BEADLO Cc1nnc([C@H](C)Nc2cc(C)[nH+]cn2)s1 ZINC000309798221 178181364 /nfs/dbraw/zinc/18/13/64/178181364.db2.gz QRBVXGZICFBHIR-ZETCQYMHSA-N 1 2 235.316 2.118 20 0 BEADLO Cc1cc(N[C@@H]2CCOC[C@H]2C)nc(C2CC2)[nH+]1 ZINC000277612518 178183067 /nfs/dbraw/zinc/18/30/67/178183067.db2.gz LVTDMWMUIONZMQ-BXKDBHETSA-N 1 2 247.342 2.499 20 0 BEADLO Cc1cc(N[C@@H]2C[C@@H](C)n3ccnc32)nc[nH+]1 ZINC000333742322 178184093 /nfs/dbraw/zinc/18/40/93/178184093.db2.gz WCXQNHMJBCIWFK-NXEZZACHSA-N 1 2 229.287 2.099 20 0 BEADLO Cc1cc(N[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)nc[nH+]1 ZINC000301799247 178184520 /nfs/dbraw/zinc/18/45/20/178184520.db2.gz BLMFIHMEBFNTSE-RTXFEEFZSA-N 1 2 245.326 2.155 20 0 BEADLO Cc1cc(N[C@H](C)[C@@H](C)CO)nc(C(C)C)[nH+]1 ZINC000134959460 178185933 /nfs/dbraw/zinc/18/59/33/178185933.db2.gz WACDQXXAEXDXDX-GXSJLCMTSA-N 1 2 237.347 2.337 20 0 BEADLO Cc1cc(N[C@H](C)CCO)nc(C(C)C)[nH+]1 ZINC000096867085 178186188 /nfs/dbraw/zinc/18/61/88/178186188.db2.gz SFRMBIADFQJVLP-SECBINFHSA-N 1 2 223.320 2.091 20 0 BEADLO Cc1cc(N[C@H](CO)CC(C)C)nc(C2CC2)[nH+]1 ZINC000265404437 178187124 /nfs/dbraw/zinc/18/71/24/178187124.db2.gz ZDNZRUUYMKCBOG-LBPRGKRZSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1cc(N[C@H](C)c2nc[nH]n2)nc(C(C)C)[nH+]1 ZINC000226500386 178187538 /nfs/dbraw/zinc/18/75/38/178187538.db2.gz WYIQPHUHGMJPNU-SECBINFHSA-N 1 2 246.318 2.200 20 0 BEADLO Cc1cc(N[C@H](C)c2nnc[nH]2)nc(C(C)C)[nH+]1 ZINC000226500386 178187540 /nfs/dbraw/zinc/18/75/40/178187540.db2.gz WYIQPHUHGMJPNU-SECBINFHSA-N 1 2 246.318 2.200 20 0 BEADLO Cc1cc(N[C@H]2C[C@@H](O)C2(C)C)nc(C(C)C)[nH+]1 ZINC000129104815 178191546 /nfs/dbraw/zinc/19/15/46/178191546.db2.gz NMZRPRLOTUSPCI-WDEREUQCSA-N 1 2 249.358 2.480 20 0 BEADLO Cc1cc(Nc2cn[nH]c2)nc(C(C)C)[nH+]1 ZINC000301079639 178193922 /nfs/dbraw/zinc/19/39/22/178193922.db2.gz KLDCCGZDQFYUGL-UHFFFAOYSA-N 1 2 217.276 2.375 20 0 BEADLO CC[C@@H](C)[C@H](CNc1cc(CO)cc[nH+]1)OC ZINC000381155516 398228072 /nfs/dbraw/zinc/22/80/72/398228072.db2.gz MKUBOGBZFVDYJD-PWSUYJOCSA-N 1 2 238.331 2.047 20 0 BEADLO Cn1c[nH+]cc1CNc1cc(F)c(F)c(F)c1 ZINC000090167202 398228301 /nfs/dbraw/zinc/22/83/01/398228301.db2.gz QSFYMRZCGYVGFK-UHFFFAOYSA-N 1 2 241.216 2.450 20 0 BEADLO C[C@@H]1Oc2cc(F)ccc2[C@H]1[NH2+]Cc1cocn1 ZINC000342316639 136222943 /nfs/dbraw/zinc/22/29/43/136222943.db2.gz ZPXHSAVNAYJYNB-SDBXPKJASA-N 1 2 248.257 2.426 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2cnn(C)c2)no1 ZINC000282883054 178233416 /nfs/dbraw/zinc/23/34/16/178233416.db2.gz VTRAGZOCRLWXCV-NXEZZACHSA-N 1 2 234.303 2.128 20 0 BEADLO CC(C)CCCC(=O)N[C@@H]1CCc2c[nH+]cn2C1 ZINC000650078453 398232438 /nfs/dbraw/zinc/23/24/38/398232438.db2.gz CRCGAZPNAWHJEG-GFCCVEGCSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]CC(F)(F)CO)cs1 ZINC000294212958 178222652 /nfs/dbraw/zinc/22/26/52/178222652.db2.gz MSIQJDLCWGOFLY-MRVPVSSYSA-N 1 2 235.299 2.335 20 0 BEADLO CC(C)CC[C@@H](C)NC(=O)CCc1c[nH+]c[nH]1 ZINC000276672172 538933317 /nfs/dbraw/zinc/93/33/17/538933317.db2.gz UZJVAMNFCHURPX-LLVKDONJSA-N 1 2 237.347 2.283 20 0 BEADLO CC(C)CC[C@@H](C)NC(=O)CCc1c[nH]c[nH+]1 ZINC000276672172 538933318 /nfs/dbraw/zinc/93/33/18/538933318.db2.gz UZJVAMNFCHURPX-LLVKDONJSA-N 1 2 237.347 2.283 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2ccn(C)n2)oc1C ZINC000337462364 178228444 /nfs/dbraw/zinc/22/84/44/178228444.db2.gz KSJVICBLESCTJS-SNVBAGLBSA-N 1 2 233.315 2.481 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2ccn(C)n2)c(C)o1 ZINC000112344360 178229009 /nfs/dbraw/zinc/22/90/09/178229009.db2.gz AGQQSUUEIAJITC-SNVBAGLBSA-N 1 2 233.315 2.481 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2c(C)nn(C)c2C)no1 ZINC000282842165 178229088 /nfs/dbraw/zinc/22/90/88/178229088.db2.gz STGBADYGAAKJEJ-SNVBAGLBSA-N 1 2 248.330 2.184 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2ccc(F)cn2)nn1C ZINC000337447865 178229645 /nfs/dbraw/zinc/22/96/45/178229645.db2.gz HAOZPPMMSWVSTB-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2cn(C)nc2C)no1 ZINC000337568783 178232794 /nfs/dbraw/zinc/23/27/94/178232794.db2.gz ZSVNOTKVGHSNFF-MWLCHTKSSA-N 1 2 248.330 2.437 20 0 BEADLO CCC[C@@H]1CCCN(C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000280040802 538936769 /nfs/dbraw/zinc/93/67/69/538936769.db2.gz VNKZGRNVDYBMOR-GFCCVEGCSA-N 1 2 249.358 2.381 20 0 BEADLO CCC[C@@H]1CCCN(C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000280040802 538936770 /nfs/dbraw/zinc/93/67/70/538936770.db2.gz VNKZGRNVDYBMOR-GFCCVEGCSA-N 1 2 249.358 2.381 20 0 BEADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccnn2C)on1 ZINC000336604105 178241327 /nfs/dbraw/zinc/24/13/27/178241327.db2.gz NIZPYAVJYBCQNO-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccnn2C)on1 ZINC000336604105 178241329 /nfs/dbraw/zinc/24/13/29/178241329.db2.gz NIZPYAVJYBCQNO-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2c[nH]nc2C)no1 ZINC000371397054 178241708 /nfs/dbraw/zinc/24/17/08/178241708.db2.gz XHCSNMDHCRYCFK-ZDUSSCGKSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2c[nH]nc2C)no1 ZINC000371397054 178241711 /nfs/dbraw/zinc/24/17/11/178241711.db2.gz XHCSNMDHCRYCFK-ZDUSSCGKSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@@H](C)c2cn[nH]c2)no1 ZINC000309553357 178253287 /nfs/dbraw/zinc/25/32/87/178253287.db2.gz IXWPBUKVBUFOKI-IUCAKERBSA-N 1 2 220.276 2.118 20 0 BEADLO CC(C)(C)[C@H]1CCCN1C(=O)CCc1c[nH+]c[nH]1 ZINC000280650514 538937778 /nfs/dbraw/zinc/93/77/78/538937778.db2.gz ZHRHAFHLWNIOSQ-GFCCVEGCSA-N 1 2 249.358 2.379 20 0 BEADLO CC(C)(C)[C@H]1CCCN1C(=O)CCc1c[nH]c[nH+]1 ZINC000280650514 538937780 /nfs/dbraw/zinc/93/77/80/538937780.db2.gz ZHRHAFHLWNIOSQ-GFCCVEGCSA-N 1 2 249.358 2.379 20 0 BEADLO CCCC[C@@H]1CCC[C@@H]1[NH2+]Cc1c[nH]nn1 ZINC000649430970 398233560 /nfs/dbraw/zinc/23/35/60/398233560.db2.gz HTFVPPZFYCKSLY-PWSUYJOCSA-N 1 2 222.336 2.253 20 0 BEADLO CCCC[C@@H]1CCC[C@@H]1[NH2+]Cc1cn[nH]n1 ZINC000649430970 398233562 /nfs/dbraw/zinc/23/35/62/398233562.db2.gz HTFVPPZFYCKSLY-PWSUYJOCSA-N 1 2 222.336 2.253 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2nnc[nH]2)c(C)s1 ZINC000037919509 178252391 /nfs/dbraw/zinc/25/23/91/178252391.db2.gz AANACZHRIARKLG-QMMMGPOBSA-N 1 2 236.344 2.334 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@@H]2C[C@H](C)N(C3CC3)C2)no1 ZINC000337552961 178256629 /nfs/dbraw/zinc/25/66/29/178256629.db2.gz POSPELQJWMVTAH-ZMLRMANQSA-N 1 2 249.358 2.259 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@H](C)c2cnn(C)c2)no1 ZINC000282883059 178258103 /nfs/dbraw/zinc/25/81/03/178258103.db2.gz VTRAGZOCRLWXCV-ZJUUUORDSA-N 1 2 234.303 2.128 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@H](C)c2nncn2C)c(C)o1 ZINC000037017607 178258816 /nfs/dbraw/zinc/25/88/16/178258816.db2.gz HTIHKOKLNVCDGU-VHSXEESVSA-N 1 2 248.330 2.437 20 0 BEADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ccnn2C)on1 ZINC000336604103 178265345 /nfs/dbraw/zinc/26/53/45/178265345.db2.gz NIZPYAVJYBCQNO-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccnn2C)on1 ZINC000336604103 178265348 /nfs/dbraw/zinc/26/53/48/178265348.db2.gz NIZPYAVJYBCQNO-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1C(=O)CCc1c[nH+]c[nH]1 ZINC000281355082 538938578 /nfs/dbraw/zinc/93/85/78/538938578.db2.gz XAESVYTZFGWRPP-PWSUYJOCSA-N 1 2 235.331 2.132 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1C(=O)CCc1c[nH]c[nH+]1 ZINC000281355082 538938580 /nfs/dbraw/zinc/93/85/80/538938580.db2.gz XAESVYTZFGWRPP-PWSUYJOCSA-N 1 2 235.331 2.132 20 0 BEADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cncnc2)no1 ZINC000362379399 178266468 /nfs/dbraw/zinc/26/64/68/178266468.db2.gz IBJLITGKKXWOQI-CYBMUJFWSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cncnc2)no1 ZINC000362379399 178266470 /nfs/dbraw/zinc/26/64/70/178266470.db2.gz IBJLITGKKXWOQI-CYBMUJFWSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cnn(C)c2)no1 ZINC000368843883 178267354 /nfs/dbraw/zinc/26/73/54/178267354.db2.gz IELXYJRMXBVLPC-CYBMUJFWSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cnn(C)c2)no1 ZINC000368843883 178267356 /nfs/dbraw/zinc/26/73/56/178267356.db2.gz IELXYJRMXBVLPC-CYBMUJFWSA-N 1 2 246.314 2.054 20 0 BEADLO COc1ccc(NC[C@@](C)(OC)C2CC2)[nH+]c1 ZINC000379858078 398238988 /nfs/dbraw/zinc/23/89/88/398238988.db2.gz NECIDTYHOLHRGB-CYBMUJFWSA-N 1 2 236.315 2.317 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)C2CCCC2)[nH+]1 ZINC000576473446 365606570 /nfs/dbraw/zinc/60/65/70/365606570.db2.gz YOCPNLDBGWAPNC-UHFFFAOYSA-N 1 2 235.331 2.260 20 0 BEADLO Cc1cc2ccccc2[nH+]c1NCC(=O)N(C)C ZINC000063105690 178299367 /nfs/dbraw/zinc/29/93/67/178299367.db2.gz IPCCOLLNFISXKK-UHFFFAOYSA-N 1 2 243.310 2.043 20 0 BEADLO C[C@H](Nc1cnn(CC(F)F)c1)c1[nH]cc[nH+]1 ZINC000286218484 538943021 /nfs/dbraw/zinc/94/30/21/538943021.db2.gz SGHMIMKUEOMZFK-ZETCQYMHSA-N 1 2 241.245 2.044 20 0 BEADLO Cc1cscc1CNc1nc(C)[nH+]cc1C ZINC000576530784 365620128 /nfs/dbraw/zinc/62/01/28/365620128.db2.gz ZVWFLGMXRMYPEY-UHFFFAOYSA-N 1 2 233.340 2.497 20 0 BEADLO Cc1cc[nH+]c(NCCC[C@@H](C)O)c1Cl ZINC000336764150 178309325 /nfs/dbraw/zinc/30/93/25/178309325.db2.gz PRHCGXDRVMMYSH-SECBINFHSA-N 1 2 228.723 2.038 20 0 BEADLO Cc1ccsc1C[NH2+][C@@H](C)C(=O)OC(C)C ZINC000449667530 323004696 /nfs/dbraw/zinc/00/46/96/323004696.db2.gz VAFQIPOTOGZOBR-JTQLQIEISA-N 1 2 241.356 2.486 20 0 BEADLO CCC[C@](C)(CC)C(=O)NCc1c[nH+]cn1C ZINC000291328109 538947634 /nfs/dbraw/zinc/94/76/34/538947634.db2.gz VIIKPVSWCRAXNR-ZDUSSCGKSA-N 1 2 237.347 2.253 20 0 BEADLO COc1cccc(CNc2c[nH]c[nH+]2)c1 ZINC000379914539 365670516 /nfs/dbraw/zinc/67/05/16/365670516.db2.gz AYBLVCYPENTWQG-UHFFFAOYSA-N 1 2 203.245 2.030 20 0 BEADLO CCC[C@H](C(=O)NCc1c[nH+]cn1C)C(C)C ZINC000291410301 538947293 /nfs/dbraw/zinc/94/72/93/538947293.db2.gz JOHSPKWXVJEIEB-LBPRGKRZSA-N 1 2 237.347 2.109 20 0 BEADLO Cc1cccc(C(=O)NCc2[nH]cc[nH+]2)c1Cl ZINC000162024058 349551250 /nfs/dbraw/zinc/55/12/50/349551250.db2.gz RPTKYHSJRVNYGV-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)c2cccs2)c2[nH+]ccn21 ZINC000334745064 136232415 /nfs/dbraw/zinc/23/24/15/136232415.db2.gz WNBAJMISQPPDSH-RKDXNWHRSA-N 1 2 247.323 2.380 20 0 BEADLO CC(C)c1nc(NC2(CO)CCCC2)cc[nH+]1 ZINC000176710983 538950478 /nfs/dbraw/zinc/95/04/78/538950478.db2.gz WMUUZJBWYCSZOD-UHFFFAOYSA-N 1 2 235.331 2.317 20 0 BEADLO C[C@@H]1CCN(CC(F)F)C[C@@H]1n1cc[nH+]c1 ZINC000179483762 538955747 /nfs/dbraw/zinc/95/57/47/538955747.db2.gz SAPZTIYBBCIJIH-ZJUUUORDSA-N 1 2 229.274 2.031 20 0 BEADLO CCc1cc(N[C@H]2C[C@H](C)n3cc[nH+]c32)ncn1 ZINC000649471108 398271630 /nfs/dbraw/zinc/27/16/30/398271630.db2.gz NNIPWZLBNIFTEI-ONGXEEELSA-N 1 2 243.314 2.353 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)CC(C)(C)c1ccccc1 ZINC000180324573 538957814 /nfs/dbraw/zinc/95/78/14/538957814.db2.gz DLQBCBQITZXEBS-UHFFFAOYSA-N 1 2 244.342 2.214 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)CC(C)(C)c1ccccc1 ZINC000180324573 538957815 /nfs/dbraw/zinc/95/78/15/538957815.db2.gz DLQBCBQITZXEBS-UHFFFAOYSA-N 1 2 244.342 2.214 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]CCOC1CCCC1 ZINC000180317403 538957914 /nfs/dbraw/zinc/95/79/14/538957914.db2.gz OGKCQBBECRCINX-SNVBAGLBSA-N 1 2 237.347 2.328 20 0 BEADLO Cc1ncc(C[NH2+]CC(C)(F)F)s1 ZINC000378850601 346846788 /nfs/dbraw/zinc/84/67/88/346846788.db2.gz DYNYOEFCFFEAPQ-UHFFFAOYSA-N 1 2 206.261 2.196 20 0 BEADLO CC(C)C[C@@H](C)[N@@H+]1C[C@H](O)CC(F)(F)C1 ZINC000649473937 398272585 /nfs/dbraw/zinc/27/25/85/398272585.db2.gz URPYRWINXXBKCT-NXEZZACHSA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)C[C@@H](C)[N@H+]1C[C@H](O)CC(F)(F)C1 ZINC000649473937 398272586 /nfs/dbraw/zinc/27/25/86/398272586.db2.gz URPYRWINXXBKCT-NXEZZACHSA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)C[C@@H](C)[N@@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000649473942 398272684 /nfs/dbraw/zinc/27/26/84/398272684.db2.gz URPYRWINXXBKCT-ZJUUUORDSA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)C[C@@H](C)[N@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000649473942 398272687 /nfs/dbraw/zinc/27/26/87/398272687.db2.gz URPYRWINXXBKCT-ZJUUUORDSA-N 1 2 221.291 2.123 20 0 BEADLO Cc1nn(C)cc1[C@@H](C)[NH2+]CC(C)(F)F ZINC000378855528 346849674 /nfs/dbraw/zinc/84/96/74/346849674.db2.gz JXTPHMVVUGDFDU-SSDOTTSWSA-N 1 2 217.263 2.034 20 0 BEADLO Cc1cc([C@H](C)NC(=O)c2c[nH+]c(C)[nH]2)c(C)o1 ZINC000335065353 398276366 /nfs/dbraw/zinc/27/63/66/398276366.db2.gz PHNCMPYUUZREEZ-QMMMGPOBSA-N 1 2 247.298 2.419 20 0 BEADLO CO[C@@H](C[NH2+][C@H](C)c1cn[nH]c1C)C(C)(C)C ZINC000180690993 538959195 /nfs/dbraw/zinc/95/91/95/538959195.db2.gz VJWZVGHZZFJNNK-SKDRFNHKSA-N 1 2 239.363 2.430 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1ccc2cc[nH]c2c1 ZINC000600153900 342691857 /nfs/dbraw/zinc/69/18/57/342691857.db2.gz RQICDPPTPFGDHG-JTQLQIEISA-N 1 2 246.310 2.161 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1ccc2cc[nH]c2c1 ZINC000600153900 342691859 /nfs/dbraw/zinc/69/18/59/342691859.db2.gz RQICDPPTPFGDHG-JTQLQIEISA-N 1 2 246.310 2.161 20 0 BEADLO C[N@H+](Cc1cc2n(n1)CCC2)Cc1ccccc1 ZINC000649480468 398278446 /nfs/dbraw/zinc/27/84/46/398278446.db2.gz IVVSBPBSXVADCW-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO C[N@@H+](Cc1cc2n(n1)CCC2)Cc1ccccc1 ZINC000649480468 398278449 /nfs/dbraw/zinc/27/84/49/398278449.db2.gz IVVSBPBSXVADCW-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2ccc(C)nc2C)o1 ZINC000581761037 342713696 /nfs/dbraw/zinc/71/36/96/342713696.db2.gz QCWZWCWFJMSYSP-JTQLQIEISA-N 1 2 246.314 2.241 20 0 BEADLO C[C@H]1CCCC[C@@H]1C[N@H+](C)Cc1nnc[nH]1 ZINC000183085009 538966066 /nfs/dbraw/zinc/96/60/66/538966066.db2.gz MNIWHCLMBODDTF-WDEREUQCSA-N 1 2 222.336 2.063 20 0 BEADLO C[C@H]1CCCC[C@@H]1C[N@@H+](C)Cc1nnc[nH]1 ZINC000183085009 538966068 /nfs/dbraw/zinc/96/60/68/538966068.db2.gz MNIWHCLMBODDTF-WDEREUQCSA-N 1 2 222.336 2.063 20 0 BEADLO C[C@@H]1[C@H](C)CN(c2nc[nH+]c(N)c2Cl)[C@H]1C ZINC000399742148 342742173 /nfs/dbraw/zinc/74/21/73/342742173.db2.gz JJXLKACYPYJJIL-PRJMDXOYSA-N 1 2 240.738 2.193 20 0 BEADLO C[C@@H]1[C@H](C)CN(c2[nH+]cnc(N)c2Cl)[C@H]1C ZINC000399742148 342742175 /nfs/dbraw/zinc/74/21/75/342742175.db2.gz JJXLKACYPYJJIL-PRJMDXOYSA-N 1 2 240.738 2.193 20 0 BEADLO CCOCCC[N@@H+]1CCOC[C@@H]1c1ccco1 ZINC000607734918 342785868 /nfs/dbraw/zinc/78/58/68/342785868.db2.gz MBZVBTJLWUMDNK-GFCCVEGCSA-N 1 2 239.315 2.080 20 0 BEADLO CCOCCC[N@H+]1CCOC[C@@H]1c1ccco1 ZINC000607734918 342785869 /nfs/dbraw/zinc/78/58/69/342785869.db2.gz MBZVBTJLWUMDNK-GFCCVEGCSA-N 1 2 239.315 2.080 20 0 BEADLO CC[C@]1(C(C)C)C[C@H]1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493449181 529390506 /nfs/dbraw/zinc/39/05/06/529390506.db2.gz GDTWJHPKURYMDI-BYVUIAOWSA-N 1 2 247.342 2.364 20 0 BEADLO CC[C@@H]1C[C@H](C)CN1c1cc[nH+]c(C)n1 ZINC000075065970 342792633 /nfs/dbraw/zinc/79/26/33/342792633.db2.gz MGDHHWOABKCCEQ-GXSJLCMTSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1cnc([C@H](C)[NH2+][C@H]2CCCn3nccc32)o1 ZINC000634581947 342797670 /nfs/dbraw/zinc/79/76/70/342797670.db2.gz HVMAQJYECRFCGS-QWRGUYRKSA-N 1 2 246.314 2.365 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@H]1CCC(C)(C)O1 ZINC000187862199 538977284 /nfs/dbraw/zinc/97/72/84/538977284.db2.gz PJCNLSCTHJQXIV-GXSJLCMTSA-N 1 2 237.347 2.326 20 0 BEADLO Cc1nn(C)cc1-c1c[nH+]c(C(C)C)n1C ZINC000630050504 361913307 /nfs/dbraw/zinc/91/33/07/361913307.db2.gz BYLMIWSFJFDDHS-UHFFFAOYSA-N 1 2 218.304 2.252 20 0 BEADLO Cc1cc[nH+]c(NC[C@H]2C[C@@H](O)C2)c1Cl ZINC000624666991 342813825 /nfs/dbraw/zinc/81/38/25/342813825.db2.gz ZSIYYRUDKHNRTF-DTORHVGOSA-N 1 2 226.707 2.226 20 0 BEADLO C[C@@H]1[C@H](C(F)(F)F)OCCN1c1cccc[nH+]1 ZINC000624671484 342815084 /nfs/dbraw/zinc/81/50/84/342815084.db2.gz XGALXOKKPGURFE-PSASIEDQSA-N 1 2 246.232 2.238 20 0 BEADLO Cc1cc(N2CCc3c(O)cccc3C2)nc[nH+]1 ZINC000624678942 342818335 /nfs/dbraw/zinc/81/83/35/342818335.db2.gz RDBPHRJWIKDQBH-UHFFFAOYSA-N 1 2 241.294 2.053 20 0 BEADLO CC[C@]1(C)CCCN(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493346076 529392005 /nfs/dbraw/zinc/39/20/05/529392005.db2.gz AXAABXAUFHHXHQ-VBROQKIQSA-N 1 2 247.342 2.462 20 0 BEADLO Cc1cc(C(=O)NCc2[nH]c[nH+]c2C)c(C)s1 ZINC000380169027 538986614 /nfs/dbraw/zinc/98/66/14/538986614.db2.gz IMQPFPLLMPPYCA-UHFFFAOYSA-N 1 2 249.339 2.326 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2cscn2)[nH]n1 ZINC000380172863 538986794 /nfs/dbraw/zinc/98/67/94/538986794.db2.gz DXOTUDRXVBZBLZ-QMMMGPOBSA-N 1 2 222.317 2.025 20 0 BEADLO C[C@@H]1CCCC[C@@H]1NC(=O)CCc1c[nH+]c[nH]1 ZINC000188845976 538979631 /nfs/dbraw/zinc/97/96/31/538979631.db2.gz HLGFNCSTBOFFKC-PWSUYJOCSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H]1CCCC[C@@H]1NC(=O)CCc1c[nH]c[nH+]1 ZINC000188845976 538979633 /nfs/dbraw/zinc/97/96/33/538979633.db2.gz HLGFNCSTBOFFKC-PWSUYJOCSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H]1CCCC[C@@H]1NC(=O)CCc1c[nH+]c[nH]1 ZINC000188846003 538979822 /nfs/dbraw/zinc/97/98/22/538979822.db2.gz HLGFNCSTBOFFKC-JQWIXIFHSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H]1CCCC[C@@H]1NC(=O)CCc1c[nH]c[nH+]1 ZINC000188846003 538979823 /nfs/dbraw/zinc/97/98/23/538979823.db2.gz HLGFNCSTBOFFKC-JQWIXIFHSA-N 1 2 235.331 2.037 20 0 BEADLO COc1cc2c(cc1C[NH+]1CC3(CC3)C1)OCO2 ZINC000449369597 398291850 /nfs/dbraw/zinc/29/18/50/398291850.db2.gz FEKPINGTMFFDJV-UHFFFAOYSA-N 1 2 247.294 2.020 20 0 BEADLO Cc1cc(Nc2cnn(CC3CC3)c2)nc(C)[nH+]1 ZINC000189450153 538983454 /nfs/dbraw/zinc/98/34/54/538983454.db2.gz RFRQBKZUNOOFGC-UHFFFAOYSA-N 1 2 243.314 2.444 20 0 BEADLO FC(F)(F)Cn1cc[nH+]c1CN1CC2(CC2)C1 ZINC000449371718 398292070 /nfs/dbraw/zinc/29/20/70/398292070.db2.gz XZFCGXPYYUJTHL-UHFFFAOYSA-N 1 2 245.248 2.041 20 0 BEADLO COc1cnccc1[C@@H](C)[NH2+]Cc1nccs1 ZINC000189565306 538983914 /nfs/dbraw/zinc/98/39/14/538983914.db2.gz LWUJXDYCYORPKK-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO C[C@H]([NH2+]C1CSC1)c1nc(C(C)(C)C)no1 ZINC000381483036 539001614 /nfs/dbraw/zinc/00/16/14/539001614.db2.gz UCFBCUIOIJMKKV-ZETCQYMHSA-N 1 2 241.360 2.133 20 0 BEADLO CCC(CC)[C@@H](C)C(=O)NCc1c[nH+]c[nH]1 ZINC000330513540 168398546 /nfs/dbraw/zinc/39/85/46/168398546.db2.gz CJYKYHPWBJLIFW-SECBINFHSA-N 1 2 223.320 2.098 20 0 BEADLO CCC(CC)[C@@H](C)C(=O)NCc1c[nH]c[nH+]1 ZINC000330513540 168398549 /nfs/dbraw/zinc/39/85/49/168398549.db2.gz CJYKYHPWBJLIFW-SECBINFHSA-N 1 2 223.320 2.098 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NCC1(C2CC2)CCC1 ZINC000193659810 539007093 /nfs/dbraw/zinc/00/70/93/539007093.db2.gz LYFKGMYCMZIWDY-UHFFFAOYSA-N 1 2 247.342 2.039 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NCC1(C2CC2)CCC1 ZINC000193659810 539007096 /nfs/dbraw/zinc/00/70/96/539007096.db2.gz LYFKGMYCMZIWDY-UHFFFAOYSA-N 1 2 247.342 2.039 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N[C@H]1CC12CCCCC2 ZINC000193742515 539007747 /nfs/dbraw/zinc/00/77/47/539007747.db2.gz CBNWVNNLJXLHFK-LBPRGKRZSA-N 1 2 247.342 2.181 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N[C@H]1CC12CCCCC2 ZINC000193742515 539007748 /nfs/dbraw/zinc/00/77/48/539007748.db2.gz CBNWVNNLJXLHFK-LBPRGKRZSA-N 1 2 247.342 2.181 20 0 BEADLO CC(C)(C)c1nc(N[C@H]2COCC2(C)C)cc[nH+]1 ZINC000649498021 398295613 /nfs/dbraw/zinc/29/56/13/398295613.db2.gz AWLDWJSRBWAWFN-JTQLQIEISA-N 1 2 249.358 2.033 20 0 BEADLO C[C@@H]1CCC[C@H](N(C)C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000192604837 538995960 /nfs/dbraw/zinc/99/59/60/538995960.db2.gz WXYSKUCXMGXIFY-YPMHNXCESA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H]1CCC[C@H](N(C)C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000192604837 538995962 /nfs/dbraw/zinc/99/59/62/538995962.db2.gz WXYSKUCXMGXIFY-YPMHNXCESA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H]1CCC[C@H](N(C)C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000192604852 538996226 /nfs/dbraw/zinc/99/62/26/538996226.db2.gz WXYSKUCXMGXIFY-AAEUAGOBSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H]1CCC[C@H](N(C)C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000192604852 538996227 /nfs/dbraw/zinc/99/62/27/538996227.db2.gz WXYSKUCXMGXIFY-AAEUAGOBSA-N 1 2 249.358 2.379 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CCCOCC1 ZINC000381378375 538999200 /nfs/dbraw/zinc/99/92/00/538999200.db2.gz JRQCSVFVWHMREA-JTQLQIEISA-N 1 2 222.288 2.071 20 0 BEADLO CC[C@@]1(C)CCN(c2nc[nH+]c(N)c2Cl)C1 ZINC000390299505 539021165 /nfs/dbraw/zinc/02/11/65/539021165.db2.gz BZIJFGAOSCALON-NSHDSACASA-N 1 2 240.738 2.339 20 0 BEADLO CC[C@@]1(C)CCN(c2[nH+]cnc(N)c2Cl)C1 ZINC000390299505 539021166 /nfs/dbraw/zinc/02/11/66/539021166.db2.gz BZIJFGAOSCALON-NSHDSACASA-N 1 2 240.738 2.339 20 0 BEADLO CCc1cc(N[C@@H](C)c2nnc(C)s2)nc[nH+]1 ZINC000391969278 539027765 /nfs/dbraw/zinc/02/77/65/539027765.db2.gz WFQCBBFLTVUMBV-ZETCQYMHSA-N 1 2 249.343 2.372 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1CCO[C@H](C)C1 ZINC000388717920 539015248 /nfs/dbraw/zinc/01/52/48/539015248.db2.gz NBPKPLNLYZEOKA-MNOVXSKESA-N 1 2 236.315 2.317 20 0 BEADLO COc1ccc(N[C@@H](C)[C@@H]2CCCOC2)[nH+]c1 ZINC000389101824 539015385 /nfs/dbraw/zinc/01/53/85/539015385.db2.gz LIDULUPBPNLAOB-WDEREUQCSA-N 1 2 236.315 2.317 20 0 BEADLO CC[C@H](C)N(C)C(=O)[C@H]1CCn2cc(C)[nH+]c2C1 ZINC000624983750 342840542 /nfs/dbraw/zinc/84/05/42/342840542.db2.gz UKHBGQLNVOVDSW-RYUDHWBXSA-N 1 2 249.358 2.011 20 0 BEADLO CC=CC[NH2+][C@H](c1cccs1)c1nnc[nH]1 ZINC000624199035 342841263 /nfs/dbraw/zinc/84/12/63/342841263.db2.gz DXPXVKCEWZTYCE-MXQLGCADSA-N 1 2 234.328 2.121 20 0 BEADLO CCc1cc(N[C@@H]2CSC[C@H]2C)nc[nH+]1 ZINC000389979731 539019393 /nfs/dbraw/zinc/01/93/93/539019393.db2.gz HUQLYHNBZKNIOB-PSASIEDQSA-N 1 2 223.345 2.202 20 0 BEADLO CCC[C@H](C[N@H+](C)[C@@H](C)c1nc(C)no1)OC ZINC000639300292 398300629 /nfs/dbraw/zinc/30/06/29/398300629.db2.gz HRWNJMOCNULKPR-GXSJLCMTSA-N 1 2 241.335 2.186 20 0 BEADLO CCC[C@H](C[N@@H+](C)[C@@H](C)c1nc(C)no1)OC ZINC000639300292 398300631 /nfs/dbraw/zinc/30/06/31/398300631.db2.gz HRWNJMOCNULKPR-GXSJLCMTSA-N 1 2 241.335 2.186 20 0 BEADLO CCC[C@@H](C[N@H+](C)[C@H](C)c1nc(C)no1)OC ZINC000639300293 398300680 /nfs/dbraw/zinc/30/06/80/398300680.db2.gz HRWNJMOCNULKPR-KOLCDFICSA-N 1 2 241.335 2.186 20 0 BEADLO CCC[C@@H](C[N@@H+](C)[C@H](C)c1nc(C)no1)OC ZINC000639300293 398300682 /nfs/dbraw/zinc/30/06/82/398300682.db2.gz HRWNJMOCNULKPR-KOLCDFICSA-N 1 2 241.335 2.186 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)CC1(C)CCCC1 ZINC000348854074 136242464 /nfs/dbraw/zinc/24/24/64/136242464.db2.gz ULPQCAWNIYEWND-UHFFFAOYSA-N 1 2 235.331 2.305 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@@H]1COCc2ccccc21 ZINC000335637555 136242802 /nfs/dbraw/zinc/24/28/02/136242802.db2.gz PQLLPYUBVMRYLE-CQSZACIVSA-N 1 2 243.310 2.079 20 0 BEADLO C[C@@H](c1ccccc1)[N@@H+]1CCN(C2CC2)C(=O)C1 ZINC000335646358 136243988 /nfs/dbraw/zinc/24/39/88/136243988.db2.gz GUOJYNZDMMUGKU-LBPRGKRZSA-N 1 2 244.338 2.054 20 0 BEADLO C[C@@H](c1ccccc1)[N@H+]1CCN(C2CC2)C(=O)C1 ZINC000335646358 136243989 /nfs/dbraw/zinc/24/39/89/136243989.db2.gz GUOJYNZDMMUGKU-LBPRGKRZSA-N 1 2 244.338 2.054 20 0 BEADLO Clc1csc(NCCn2cc[nH+]c2)n1 ZINC000165000280 342864529 /nfs/dbraw/zinc/86/45/29/342864529.db2.gz JKGLCKIYOIDNIZ-UHFFFAOYSA-N 1 2 228.708 2.105 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)Nc1nc(Cl)cs1 ZINC000165006689 342866121 /nfs/dbraw/zinc/86/61/21/342866121.db2.gz XZLWCQPLPGMTAP-ZETCQYMHSA-N 1 2 242.735 2.494 20 0 BEADLO CCC(C)(C)CC(=O)N1CC(n2cc[nH+]c2)C1 ZINC000608587808 398307108 /nfs/dbraw/zinc/30/71/08/398307108.db2.gz QCUCMBDRGPVMTK-UHFFFAOYSA-N 1 2 235.331 2.093 20 0 BEADLO CCc1cc(NCc2ccc(OC)nc2)nc[nH+]1 ZINC000062055108 398308023 /nfs/dbraw/zinc/30/80/23/398308023.db2.gz HUPQOXSSRPPPQD-UHFFFAOYSA-N 1 2 244.298 2.055 20 0 BEADLO Cn1cc[nH+]c1CNc1nc(Cl)cs1 ZINC000165034093 342871239 /nfs/dbraw/zinc/87/12/39/342871239.db2.gz JOYTYMJPYFTCMM-UHFFFAOYSA-N 1 2 228.708 2.142 20 0 BEADLO CC(C)NC(=O)C[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000335646448 136243689 /nfs/dbraw/zinc/24/36/89/136243689.db2.gz IEAAZNWUTJUMGN-NSHDSACASA-N 1 2 232.327 2.088 20 0 BEADLO CC(C)NC(=O)C[N@H+]1Cc2ccccc2[C@@H]1C ZINC000335646448 136243690 /nfs/dbraw/zinc/24/36/90/136243690.db2.gz IEAAZNWUTJUMGN-NSHDSACASA-N 1 2 232.327 2.088 20 0 BEADLO CCO[C@H](C[N@H+](C)Cc1cscn1)C1CC1 ZINC000625103989 342857991 /nfs/dbraw/zinc/85/79/91/342857991.db2.gz NXOIRIHZWMXBFG-GFCCVEGCSA-N 1 2 240.372 2.390 20 0 BEADLO CCO[C@H](C[N@@H+](C)Cc1cscn1)C1CC1 ZINC000625103989 342857992 /nfs/dbraw/zinc/85/79/92/342857992.db2.gz NXOIRIHZWMXBFG-GFCCVEGCSA-N 1 2 240.372 2.390 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CC[C@H]3C[C@H]3C2)cc[nH+]1 ZINC000421496948 192345764 /nfs/dbraw/zinc/34/57/64/192345764.db2.gz OIGQEIGFDJSJJR-TUAOUCFPSA-N 1 2 230.311 2.187 20 0 BEADLO CC(C)C[N@H+](C)Cc1noc(C2CCC2)n1 ZINC000625108704 342859636 /nfs/dbraw/zinc/85/96/36/342859636.db2.gz IVCFTLYNGZNUMS-UHFFFAOYSA-N 1 2 223.320 2.425 20 0 BEADLO CC(C)C[N@@H+](C)Cc1noc(C2CCC2)n1 ZINC000625108704 342859637 /nfs/dbraw/zinc/85/96/37/342859637.db2.gz IVCFTLYNGZNUMS-UHFFFAOYSA-N 1 2 223.320 2.425 20 0 BEADLO COCC[C@@H](C)CNc1[nH+]cccc1OC ZINC000624276048 398316958 /nfs/dbraw/zinc/31/69/58/398316958.db2.gz AVXLOKYWGNLZDA-SNVBAGLBSA-N 1 2 224.304 2.175 20 0 BEADLO C[C@H]1CC[N@H+](Cc2noc(C3CCC3)n2)C1 ZINC000625127871 342881349 /nfs/dbraw/zinc/88/13/49/342881349.db2.gz SMJDIRGIRKRDSL-VIFPVBQESA-N 1 2 221.304 2.179 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2noc(C3CCC3)n2)C1 ZINC000625127871 342881352 /nfs/dbraw/zinc/88/13/52/342881352.db2.gz SMJDIRGIRKRDSL-VIFPVBQESA-N 1 2 221.304 2.179 20 0 BEADLO CC(C)CCCC(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627372878 398320122 /nfs/dbraw/zinc/32/01/22/398320122.db2.gz ZFHIKKBMECQPHB-UHFFFAOYSA-N 1 2 235.331 2.121 20 0 BEADLO CC(C)CCCC(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627372878 398320123 /nfs/dbraw/zinc/32/01/23/398320123.db2.gz ZFHIKKBMECQPHB-UHFFFAOYSA-N 1 2 235.331 2.121 20 0 BEADLO COC(=O)[C@H]([NH2+]CC(C)C)c1cccs1 ZINC000041672548 398320811 /nfs/dbraw/zinc/32/08/11/398320811.db2.gz KTOHLLLAOCVVSU-SNVBAGLBSA-N 1 2 227.329 2.208 20 0 BEADLO Cc1nocc1C[N@H+]1CCOC[C@@H]1CC(C)C ZINC000351569102 136247092 /nfs/dbraw/zinc/24/70/92/136247092.db2.gz RBZZJEKMFSESHB-ZDUSSCGKSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1nocc1C[N@@H+]1CCOC[C@@H]1CC(C)C ZINC000351569102 136247093 /nfs/dbraw/zinc/24/70/93/136247093.db2.gz RBZZJEKMFSESHB-ZDUSSCGKSA-N 1 2 238.331 2.230 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1ccccc1F ZINC000045784327 342922387 /nfs/dbraw/zinc/92/23/87/342922387.db2.gz AADZLNBJILBKLJ-MNOVXSKESA-N 1 2 223.291 2.435 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccccc1F ZINC000045784327 342922389 /nfs/dbraw/zinc/92/23/89/342922389.db2.gz AADZLNBJILBKLJ-MNOVXSKESA-N 1 2 223.291 2.435 20 0 BEADLO CC[N@H+](Cc1ccccn1)Cc1ccnc(C)n1 ZINC000351567779 136247202 /nfs/dbraw/zinc/24/72/02/136247202.db2.gz JGFMOJDOIAGHAC-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO CC[N@@H+](Cc1ccccn1)Cc1ccnc(C)n1 ZINC000351567779 136247203 /nfs/dbraw/zinc/24/72/03/136247203.db2.gz JGFMOJDOIAGHAC-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO C[C@@H]1CCCN1c1cc(N2CCCCC2)[nH+]cn1 ZINC000105784938 398324858 /nfs/dbraw/zinc/32/48/58/398324858.db2.gz OIHRLZBTSWLRNG-GFCCVEGCSA-N 1 2 246.358 2.456 20 0 BEADLO C[C@@H]1CCCN1c1cc(N2CCCCC2)nc[nH+]1 ZINC000105784938 398324859 /nfs/dbraw/zinc/32/48/59/398324859.db2.gz OIHRLZBTSWLRNG-GFCCVEGCSA-N 1 2 246.358 2.456 20 0 BEADLO C[C@@H]1C[C@@H](Nc2cnn(CCF)c2)c2[nH+]ccn21 ZINC000624127939 346875660 /nfs/dbraw/zinc/87/56/60/346875660.db2.gz VWCSFBXGHASIFL-MWLCHTKSSA-N 1 2 249.293 2.167 20 0 BEADLO C[C@@H](c1ccccc1F)[N@@H+]1CCc2nn[nH]c2C1 ZINC000351610435 136248336 /nfs/dbraw/zinc/24/83/36/136248336.db2.gz VWTJNXJGAZZGLM-VIFPVBQESA-N 1 2 246.289 2.063 20 0 BEADLO C[C@@H](c1ccccc1F)[N@H+]1CCc2nn[nH]c2C1 ZINC000351610435 136248337 /nfs/dbraw/zinc/24/83/37/136248337.db2.gz VWTJNXJGAZZGLM-VIFPVBQESA-N 1 2 246.289 2.063 20 0 BEADLO Cc1noc(C[N@@H+]2CC[C@@H](CC(F)(F)F)C2)n1 ZINC000351626545 136248947 /nfs/dbraw/zinc/24/89/47/136248947.db2.gz DDCGWPPDBHTAFB-QMMMGPOBSA-N 1 2 249.236 2.152 20 0 BEADLO Cc1noc(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)n1 ZINC000351626545 136248948 /nfs/dbraw/zinc/24/89/48/136248948.db2.gz DDCGWPPDBHTAFB-QMMMGPOBSA-N 1 2 249.236 2.152 20 0 BEADLO C[NH2+]Cc1noc([C@H]2CCCC[C@@H]2C2CC2)n1 ZINC000564958325 398331601 /nfs/dbraw/zinc/33/16/01/398331601.db2.gz ZXZMKJXPVZYGPL-MNOVXSKESA-N 1 2 235.331 2.473 20 0 BEADLO FC(F)C[NH2+]Cc1c[nH]nc1-c1ccccc1 ZINC000136573320 398342799 /nfs/dbraw/zinc/34/27/99/398342799.db2.gz USITWIOGIXDFBH-UHFFFAOYSA-N 1 2 237.253 2.431 20 0 BEADLO CC[C@@]1(C)CCN(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493542580 529524276 /nfs/dbraw/zinc/52/42/76/529524276.db2.gz AGVHHTYRHACVCG-IHVVCDCBSA-N 1 2 233.315 2.072 20 0 BEADLO C[N@H+](Cc1ncc(C2CC2)o1)[C@H]1CCCOC1 ZINC000351814409 136254577 /nfs/dbraw/zinc/25/45/77/136254577.db2.gz TVMGYSKORGIQMW-NSHDSACASA-N 1 2 236.315 2.163 20 0 BEADLO C[N@@H+](Cc1ncc(C2CC2)o1)[C@H]1CCCOC1 ZINC000351814409 136254578 /nfs/dbraw/zinc/25/45/78/136254578.db2.gz TVMGYSKORGIQMW-NSHDSACASA-N 1 2 236.315 2.163 20 0 BEADLO CCc1cc(C(=O)NCc2c[nH+]c[nH]2)oc1CC ZINC000488199243 529518541 /nfs/dbraw/zinc/51/85/41/529518541.db2.gz PINCMNXKYJYNTB-UHFFFAOYSA-N 1 2 247.298 2.058 20 0 BEADLO CCc1cc(C(=O)NCc2c[nH]c[nH+]2)oc1CC ZINC000488199243 529518542 /nfs/dbraw/zinc/51/85/42/529518542.db2.gz PINCMNXKYJYNTB-UHFFFAOYSA-N 1 2 247.298 2.058 20 0 BEADLO CCn1cc[nH+]c1CN(C)[C@@H](C)c1ccccn1 ZINC000162422816 349704042 /nfs/dbraw/zinc/70/40/42/349704042.db2.gz KZBWQLSOQSWSKK-LBPRGKRZSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N1CCC=C(C)C1 ZINC000493252169 529551221 /nfs/dbraw/zinc/55/12/21/529551221.db2.gz KITKECPZLVUMRR-VOTSOKGWSA-N 1 2 245.326 2.095 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N(C(C)C)C1CC1 ZINC000492450122 529556189 /nfs/dbraw/zinc/55/61/89/529556189.db2.gz QAIGHPLHJVPNAP-FPLPWBNLSA-N 1 2 247.342 2.316 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)NCC1(C)CCC1 ZINC000492462536 529558869 /nfs/dbraw/zinc/55/88/69/529558869.db2.gz UFZJCHIZAWFXKH-WAYWQWQTSA-N 1 2 247.342 2.223 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N[C@H](C)C(C)(C)C ZINC000493592168 529560309 /nfs/dbraw/zinc/56/03/09/529560309.db2.gz POYRSLWGHKHWEJ-SKVAFPRGSA-N 1 2 249.358 2.467 20 0 BEADLO c1coc(C[NH2+]Cc2cn3ccccc3n2)c1 ZINC000020056697 342967659 /nfs/dbraw/zinc/96/76/59/342967659.db2.gz MBWFXLPSZQWZQP-UHFFFAOYSA-N 1 2 227.267 2.217 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N(C)[C@@H](C)C(C)C ZINC000493199218 529549521 /nfs/dbraw/zinc/54/95/21/529549521.db2.gz CKYZNYUKLSBBDA-GUOLPTJISA-N 1 2 249.358 2.419 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N(C)[C@@H](C)C1CC1 ZINC000492450514 529549847 /nfs/dbraw/zinc/54/98/47/529549847.db2.gz RCWBGHITCXBCMM-AEZGRPFRSA-N 1 2 247.342 2.173 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N(C)[C@H](C)C(C)C ZINC000493199216 529550052 /nfs/dbraw/zinc/55/00/52/529550052.db2.gz CKYZNYUKLSBBDA-ABZNLYFFSA-N 1 2 249.358 2.419 20 0 BEADLO COC(=O)[C@@H](CC(C)C)[N@H+](C)Cc1ccoc1 ZINC000351858894 136258673 /nfs/dbraw/zinc/25/86/73/136258673.db2.gz NUNXNDNOHACKHO-GFCCVEGCSA-N 1 2 239.315 2.299 20 0 BEADLO COC(=O)[C@@H](CC(C)C)[N@@H+](C)Cc1ccoc1 ZINC000351858894 136258674 /nfs/dbraw/zinc/25/86/74/136258674.db2.gz NUNXNDNOHACKHO-GFCCVEGCSA-N 1 2 239.315 2.299 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)/C=C/C1CC1 ZINC000493066661 529593845 /nfs/dbraw/zinc/59/38/45/529593845.db2.gz UFPUJBOBOZIEGT-FGEFZZPRSA-N 1 2 233.315 2.046 20 0 BEADLO Fc1cccc(F)c1CN1CCn2cc[nH+]c2C1 ZINC000335902062 136259734 /nfs/dbraw/zinc/25/97/34/136259734.db2.gz UADREGDAIWBWMP-UHFFFAOYSA-N 1 2 249.264 2.177 20 0 BEADLO CCC(F)(F)C[NH+]1CCC(CC(=O)OC)CC1 ZINC000602762274 349733525 /nfs/dbraw/zinc/73/35/25/349733525.db2.gz FCVLFSCGIPUEKI-UHFFFAOYSA-N 1 2 249.301 2.307 20 0 BEADLO C[NH2+]Cc1noc(C2(C)CCCCCC2)n1 ZINC000335905609 136260646 /nfs/dbraw/zinc/26/06/46/136260646.db2.gz FFVAVHWDCCZTGS-UHFFFAOYSA-N 1 2 223.320 2.401 20 0 BEADLO Cc1ccsc1C[NH2+]Cc1cn[nH]c1C ZINC000037989229 343040005 /nfs/dbraw/zinc/04/00/05/343040005.db2.gz RJVJZLPYXQEWFN-UHFFFAOYSA-N 1 2 221.329 2.378 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCC[C@@](C)(C(=O)OC)C1 ZINC000602844505 349781625 /nfs/dbraw/zinc/78/16/25/349781625.db2.gz AHMLBHQOBOKTGE-LLVKDONJSA-N 1 2 249.301 2.307 20 0 BEADLO CCC(F)(F)C[N@H+]1CCC[C@@](C)(C(=O)OC)C1 ZINC000602844505 349781627 /nfs/dbraw/zinc/78/16/27/349781627.db2.gz AHMLBHQOBOKTGE-LLVKDONJSA-N 1 2 249.301 2.307 20 0 BEADLO CCCCc1cc(=O)n(CCCn2cc[nH+]c2)[nH]1 ZINC000634633250 343044944 /nfs/dbraw/zinc/04/49/44/343044944.db2.gz PIKHMVGSQSFQBY-UHFFFAOYSA-N 1 2 248.330 2.052 20 0 BEADLO C1CC1c1nc(N[C@H]2CC23CC3)c2c([nH+]1)CCC2 ZINC000576838948 365702595 /nfs/dbraw/zinc/70/25/95/365702595.db2.gz WXYVMPOGFYBCPN-LBPRGKRZSA-N 1 2 241.338 2.229 20 0 BEADLO CCc1csc(NC(=O)C=Cc2c[nH]c[nH+]2)n1 ZINC000492863406 529685254 /nfs/dbraw/zinc/68/52/54/529685254.db2.gz SHIRUXDYOGVVSH-ONEGZZNKSA-N 1 2 248.311 2.081 20 0 BEADLO Cc1cc(CNC(=O)CC(C)(F)F)cc(C)[nH+]1 ZINC000421579156 192355892 /nfs/dbraw/zinc/35/58/92/192355892.db2.gz SNWNZSYGKXZKAB-UHFFFAOYSA-N 1 2 242.269 2.360 20 0 BEADLO CC(C)(C)c1ccnc(NCCn2cc[nH+]c2)n1 ZINC000292907890 187241077 /nfs/dbraw/zinc/24/10/77/187241077.db2.gz YAUXOEWEHPZPJT-UHFFFAOYSA-N 1 2 245.330 2.083 20 0 BEADLO CCc1cc(NC[C@@](C)(CC)OC)nc[nH+]1 ZINC000323168782 488204999 /nfs/dbraw/zinc/20/49/99/488204999.db2.gz VQXGMSAPFXXJOB-GFCCVEGCSA-N 1 2 223.320 2.266 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC1(C)CCCCC1 ZINC000576955011 365730636 /nfs/dbraw/zinc/73/06/36/365730636.db2.gz VCZGXJBHTYFSGK-LLVKDONJSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC1(C)CCCCC1 ZINC000576955011 365730641 /nfs/dbraw/zinc/73/06/41/365730641.db2.gz VCZGXJBHTYFSGK-LLVKDONJSA-N 1 2 249.358 2.427 20 0 BEADLO Cc1[nH]c(CN(C(C)C)[C@H]2CCOC2)[nH+]c1C ZINC000628288902 346931167 /nfs/dbraw/zinc/93/11/67/346931167.db2.gz WIXTUZLMKSQWAU-LBPRGKRZSA-N 1 2 237.347 2.026 20 0 BEADLO CCO[C@H](C[N@@H+]1CCC(F)(F)C1)C1CC1 ZINC000625302093 343227540 /nfs/dbraw/zinc/22/75/40/343227540.db2.gz DIFZBVHNJXQBMC-SNVBAGLBSA-N 1 2 219.275 2.143 20 0 BEADLO CCO[C@H](C[N@H+]1CCC(F)(F)C1)C1CC1 ZINC000625302093 343227543 /nfs/dbraw/zinc/22/75/43/343227543.db2.gz DIFZBVHNJXQBMC-SNVBAGLBSA-N 1 2 219.275 2.143 20 0 BEADLO c1[nH]cc(Cn2cc(C3CCCCCC3)nn2)[nH+]1 ZINC000641035298 362146180 /nfs/dbraw/zinc/14/61/80/362146180.db2.gz IAZDSPVLUPNJKQ-UHFFFAOYSA-N 1 2 245.330 2.487 20 0 BEADLO COC(=O)[C@H](C)[NH2+]Cc1c(C)cc(C)cc1C ZINC000037073795 343332866 /nfs/dbraw/zinc/33/28/66/343332866.db2.gz WJWHHBSCZSGJDK-LBPRGKRZSA-N 1 2 235.327 2.263 20 0 BEADLO CC(C)[C@@H](C)CNC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000584056346 343308330 /nfs/dbraw/zinc/30/83/30/343308330.db2.gz NDGPZWUGJGOATD-NWDGAFQWSA-N 1 2 237.347 2.243 20 0 BEADLO CC(C)[C@H](C)CNC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000584056348 343308410 /nfs/dbraw/zinc/30/84/10/343308410.db2.gz NDGPZWUGJGOATD-VXGBXAGGSA-N 1 2 237.347 2.243 20 0 BEADLO COC(=O)C(C)(C)[NH2+]C[C@@H](C)c1ccccc1 ZINC000037085134 343333358 /nfs/dbraw/zinc/33/33/58/343333358.db2.gz FXRDJLVWZRESNV-LLVKDONJSA-N 1 2 235.327 2.331 20 0 BEADLO COC(=O)C(C)(C)[NH2+]Cc1ccc(C)cc1C ZINC000037085221 343333408 /nfs/dbraw/zinc/33/34/08/343333408.db2.gz LSZWMWPCTZLJLU-UHFFFAOYSA-N 1 2 235.327 2.345 20 0 BEADLO COc1ccc(F)c(C[NH2+]Cc2[nH]ncc2C)c1 ZINC000621375956 343378423 /nfs/dbraw/zinc/37/84/23/343378423.db2.gz LJQGARWTPFEHKP-UHFFFAOYSA-N 1 2 249.289 2.156 20 0 BEADLO COc1ccc(F)c(C[NH2+]Cc2n[nH]cc2C)c1 ZINC000621375956 343378425 /nfs/dbraw/zinc/37/84/25/343378425.db2.gz LJQGARWTPFEHKP-UHFFFAOYSA-N 1 2 249.289 2.156 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@H](C)C[C@@H]2C(N)=O)on1 ZINC000335673907 136317258 /nfs/dbraw/zinc/31/72/58/136317258.db2.gz BIQMWNACRYZBOR-GZMMTYOYSA-N 1 2 237.303 2.119 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@H](C)C[C@@H]2C(N)=O)on1 ZINC000335673907 136317259 /nfs/dbraw/zinc/31/72/59/136317259.db2.gz BIQMWNACRYZBOR-GZMMTYOYSA-N 1 2 237.303 2.119 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@H](C)C[C@H]2C(N)=O)on1 ZINC000335673909 136317418 /nfs/dbraw/zinc/31/74/18/136317418.db2.gz BIQMWNACRYZBOR-KWQFWETISA-N 1 2 237.303 2.119 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@H](C)C[C@H]2C(N)=O)on1 ZINC000335673909 136317419 /nfs/dbraw/zinc/31/74/19/136317419.db2.gz BIQMWNACRYZBOR-KWQFWETISA-N 1 2 237.303 2.119 20 0 BEADLO c1nc(C[N@@H+]2CCC[C@H]2c2ccncc2)co1 ZINC000348904745 136305771 /nfs/dbraw/zinc/30/57/71/136305771.db2.gz NLMVKDRPTAUYQL-ZDUSSCGKSA-N 1 2 229.283 2.407 20 0 BEADLO c1nc(C[N@H+]2CCC[C@H]2c2ccncc2)co1 ZINC000348904745 136305772 /nfs/dbraw/zinc/30/57/72/136305772.db2.gz NLMVKDRPTAUYQL-ZDUSSCGKSA-N 1 2 229.283 2.407 20 0 BEADLO c1ccc(C[N@@H+]2CCO[C@@H](C3CCC3)C2)nc1 ZINC000335664906 136316456 /nfs/dbraw/zinc/31/64/56/136316456.db2.gz XWBICTWNWBAUNU-CQSZACIVSA-N 1 2 232.327 2.083 20 0 BEADLO c1ccc(C[N@H+]2CCO[C@@H](C3CCC3)C2)nc1 ZINC000335664906 136316457 /nfs/dbraw/zinc/31/64/57/136316457.db2.gz XWBICTWNWBAUNU-CQSZACIVSA-N 1 2 232.327 2.083 20 0 BEADLO OC[C@@H]1CCC[N@H+](Cc2ncc(Cl)s2)C1 ZINC000335692550 136325843 /nfs/dbraw/zinc/32/58/43/136325843.db2.gz JPSLVLULYQUMLK-MRVPVSSYSA-N 1 2 246.763 2.001 20 0 BEADLO OC[C@@H]1CCC[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000335692550 136325844 /nfs/dbraw/zinc/32/58/44/136325844.db2.gz JPSLVLULYQUMLK-MRVPVSSYSA-N 1 2 246.763 2.001 20 0 BEADLO CCn1cc[nH+]c1CN1CC[C@@H](C)C(F)(F)C1 ZINC000335696212 136327122 /nfs/dbraw/zinc/32/71/22/136327122.db2.gz XPJFCNGCIUTJKB-SNVBAGLBSA-N 1 2 243.301 2.380 20 0 BEADLO CCCC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000421558293 192361191 /nfs/dbraw/zinc/36/11/91/192361191.db2.gz MQVFICKEOLJZJV-UHFFFAOYSA-N 1 2 206.289 2.115 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)c1ccc(Cl)cc1 ZINC000041538078 343421344 /nfs/dbraw/zinc/42/13/44/343421344.db2.gz NVKOSSUPUVKOIM-UHFFFAOYSA-N 1 2 249.701 2.004 20 0 BEADLO O=C(C1=CCCC1)N1CCC(n2cc[nH+]c2)CC1 ZINC000335724088 136346575 /nfs/dbraw/zinc/34/65/75/136346575.db2.gz GTFDOIOZDYJNJM-UHFFFAOYSA-N 1 2 245.326 2.157 20 0 BEADLO Cc1cn2cc(NC(=O)N(C)C3CC3)ccc2[nH+]1 ZINC000335739227 136351354 /nfs/dbraw/zinc/35/13/54/136351354.db2.gz BHAIWOGBEDLNLT-UHFFFAOYSA-N 1 2 244.298 2.269 20 0 BEADLO C[C@@H]1CC[N@H+](C[C@@H]2CCCO2)CC1(F)F ZINC000335681424 136329006 /nfs/dbraw/zinc/32/90/06/136329006.db2.gz AAWMWNROBUVPER-ZJUUUORDSA-N 1 2 219.275 2.143 20 0 BEADLO C[C@@H]1CC[N@@H+](C[C@@H]2CCCO2)CC1(F)F ZINC000335681424 136329007 /nfs/dbraw/zinc/32/90/07/136329007.db2.gz AAWMWNROBUVPER-ZJUUUORDSA-N 1 2 219.275 2.143 20 0 BEADLO CC(C)n1cc[nH+]c1CN[C@@H](C)c1ccon1 ZINC000349249394 136332997 /nfs/dbraw/zinc/33/29/97/136332997.db2.gz XGBSUTRJDGFMTN-JTQLQIEISA-N 1 2 234.303 2.303 20 0 BEADLO Cc1nc(C[NH+]2[C@H](C)COC[C@H]2C)c(C)s1 ZINC000335704370 136335153 /nfs/dbraw/zinc/33/51/53/136335153.db2.gz BRRQSUOSJZLCMP-RKDXNWHRSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1cc(NC(=O)c2sccc2F)cc[nH+]1 ZINC000335704547 136335377 /nfs/dbraw/zinc/33/53/77/136335377.db2.gz OEMSIIBEHLGYTF-UHFFFAOYSA-N 1 2 236.271 2.265 20 0 BEADLO Cc1noc(C[N@@H+](C)Cc2cccs2)n1 ZINC000042300026 343433918 /nfs/dbraw/zinc/43/39/18/343433918.db2.gz JLCLXXALVATVER-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO Cc1noc(C[N@H+](C)Cc2cccs2)n1 ZINC000042300026 343433919 /nfs/dbraw/zinc/43/39/19/343433919.db2.gz JLCLXXALVATVER-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO COC(=O)[C@@H](C)[NH2+]C1CC(c2ccc(C)cc2)C1 ZINC000042304501 343434468 /nfs/dbraw/zinc/43/44/68/343434468.db2.gz OKVPNVATNUMFOV-LMWSTFAQSA-N 1 2 247.338 2.392 20 0 BEADLO C[C@H]([NH+]=c1[nH]c2c(cccc2F)n1C)C1CC1 ZINC000350254057 136357030 /nfs/dbraw/zinc/35/70/30/136357030.db2.gz QNXKVYDSBLLSKA-QMMMGPOBSA-N 1 2 233.290 2.345 20 0 BEADLO CC1CC([NH2+]Cc2ccc3c(c2)OCO3)C1 ZINC000166612819 136361734 /nfs/dbraw/zinc/36/17/34/136361734.db2.gz PMRKMGLSXUSMGE-UHFFFAOYSA-N 1 2 219.284 2.303 20 0 BEADLO C[C@H](Cc1cnn(C)c1)[NH2+][C@H](C)c1cccnc1 ZINC000350518847 136361972 /nfs/dbraw/zinc/36/19/72/136361972.db2.gz WTXOLMJKOUPBSA-VXGBXAGGSA-N 1 2 244.342 2.097 20 0 BEADLO C/C=C/c1cn(Cc2ccc(C)[nH+]c2C)nn1 ZINC000641095545 362224277 /nfs/dbraw/zinc/22/42/77/362224277.db2.gz LSJZRCPTZASRLI-SNAWJCMRSA-N 1 2 228.299 2.371 20 0 BEADLO C[C@@H]1C[C@H]1CC(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000353991761 136363449 /nfs/dbraw/zinc/36/34/49/136363449.db2.gz DMKPGSZXTJJHAM-UTUOFQBUSA-N 1 2 247.342 2.162 20 0 BEADLO Cc1nnc(C[NH2+]C(C)(C)c2ccc(C)nc2)o1 ZINC000351607340 136369670 /nfs/dbraw/zinc/36/96/70/136369670.db2.gz WKECNTSPYMQNKZ-UHFFFAOYSA-N 1 2 246.314 2.106 20 0 BEADLO c1cn(CCn2cc(C3CCCCC3)nn2)c[nH+]1 ZINC000641124147 362232707 /nfs/dbraw/zinc/23/27/07/362232707.db2.gz WCGFXRLEOQSMIO-UHFFFAOYSA-N 1 2 245.330 2.223 20 0 BEADLO CCC[C@H]([NH2+][C@H]1CCC(F)(F)C1)C(=O)OCC ZINC000310556067 343535709 /nfs/dbraw/zinc/53/57/09/343535709.db2.gz IFWVJUQYXRGRLQ-UWVGGRQHSA-N 1 2 249.301 2.496 20 0 BEADLO c1c[nH]c(C[NH2+][C@@H]2CSCc3ccccc32)n1 ZINC000070939371 343574583 /nfs/dbraw/zinc/57/45/83/343574583.db2.gz WDFNYMWFTXJAJV-GFCCVEGCSA-N 1 2 245.351 2.487 20 0 BEADLO COc1ccc(C)cc1C[NH2+]Cc1ncc[nH]1 ZINC000070976827 343577697 /nfs/dbraw/zinc/57/76/97/343577697.db2.gz CMQIDWVALQULLM-UHFFFAOYSA-N 1 2 231.299 2.017 20 0 BEADLO C[C@H](CC(=O)NCc1[nH]cc[nH+]1)CC(C)(C)C ZINC000070991218 343582794 /nfs/dbraw/zinc/58/27/94/343582794.db2.gz NOTRDOPPJOZYIO-SNVBAGLBSA-N 1 2 237.347 2.488 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H](C)CCc1cccc(C)c1 ZINC000049352468 343595864 /nfs/dbraw/zinc/59/58/64/343595864.db2.gz BFNHBUSNALYJFE-QWHCGFSZSA-N 1 2 249.354 2.467 20 0 BEADLO CCc1ncsc1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492807491 529763321 /nfs/dbraw/zinc/76/33/21/529763321.db2.gz BIBXWWHNGNRCFI-ARJAWSKDSA-N 1 2 248.311 2.081 20 0 BEADLO CCc1ncsc1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492807492 529763323 /nfs/dbraw/zinc/76/33/23/529763323.db2.gz BIBXWWHNGNRCFI-ONEGZZNKSA-N 1 2 248.311 2.081 20 0 BEADLO CCCNC(=O)CCC[N@H+](CC(F)F)C1CC1 ZINC000580580178 365790738 /nfs/dbraw/zinc/79/07/38/365790738.db2.gz CPEZSVKBOSPKQM-UHFFFAOYSA-N 1 2 248.317 2.022 20 0 BEADLO CCCNC(=O)CCC[N@@H+](CC(F)F)C1CC1 ZINC000580580178 365790743 /nfs/dbraw/zinc/79/07/43/365790743.db2.gz CPEZSVKBOSPKQM-UHFFFAOYSA-N 1 2 248.317 2.022 20 0 BEADLO OCCC[N@H+](C/C=C\Cl)Cc1ccccn1 ZINC000284260608 187344136 /nfs/dbraw/zinc/34/41/36/187344136.db2.gz MCUCRLYPEIWYAP-UTCJRWHESA-N 1 2 240.734 2.019 20 0 BEADLO OCCC[N@@H+](C/C=C\Cl)Cc1ccccn1 ZINC000284260608 187344138 /nfs/dbraw/zinc/34/41/38/187344138.db2.gz MCUCRLYPEIWYAP-UTCJRWHESA-N 1 2 240.734 2.019 20 0 BEADLO CCc1cc(NCc2ncccc2C)nc[nH+]1 ZINC000071344365 343659601 /nfs/dbraw/zinc/65/96/01/343659601.db2.gz JNLHIEDNXFQCNV-UHFFFAOYSA-N 1 2 228.299 2.355 20 0 BEADLO CCNc1nc(NC)c2ccccc2[nH+]1 ZINC000087807363 343662216 /nfs/dbraw/zinc/66/22/16/343662216.db2.gz NHEZCEDEFZJGEI-UHFFFAOYSA-N 1 2 202.261 2.103 20 0 BEADLO Clc1ccc(CN2CCc3[nH+]c[nH]c3C2)nc1 ZINC000625434623 343735954 /nfs/dbraw/zinc/73/59/54/343735954.db2.gz CYIILNYRHRZTMN-UHFFFAOYSA-N 1 2 248.717 2.016 20 0 BEADLO Cc1nsc(C)c1CN1CCc2[nH+]c[nH]c2C1 ZINC000625435239 343736501 /nfs/dbraw/zinc/73/65/01/343736501.db2.gz OUUYTIIWGOCIRZ-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO COc1ccc[nH+]c1NCCC1CC(OC)C1 ZINC000624384577 343743259 /nfs/dbraw/zinc/74/32/59/343743259.db2.gz XQCNFYTZTDQGBX-UHFFFAOYSA-N 1 2 236.315 2.317 20 0 BEADLO CCSCC[N@@H+]1OC2CCC1CC2 ZINC000603034452 349860562 /nfs/dbraw/zinc/86/05/62/349860562.db2.gz WOFPNBMQXIKMIV-UHFFFAOYSA-N 1 2 201.335 2.298 20 0 BEADLO CCSCC[N@H+]1OC2CCC1CC2 ZINC000603034452 349860565 /nfs/dbraw/zinc/86/05/65/349860565.db2.gz WOFPNBMQXIKMIV-UHFFFAOYSA-N 1 2 201.335 2.298 20 0 BEADLO CC[C@@H](C)C(=O)CSc1nc(N)cc(C)[nH+]1 ZINC000089676463 343748420 /nfs/dbraw/zinc/74/84/20/343748420.db2.gz WATNKAWWEHIPEF-SSDOTTSWSA-N 1 2 239.344 2.075 20 0 BEADLO COC(=O)[C@@H](C1CC1)[N@H+](C)Cc1ccsc1 ZINC000084093475 343749277 /nfs/dbraw/zinc/74/92/77/343749277.db2.gz CKBBBOOGSCZXNN-LLVKDONJSA-N 1 2 239.340 2.132 20 0 BEADLO COC(=O)[C@@H](C1CC1)[N@@H+](C)Cc1ccsc1 ZINC000084093475 343749279 /nfs/dbraw/zinc/74/92/79/343749279.db2.gz CKBBBOOGSCZXNN-LLVKDONJSA-N 1 2 239.340 2.132 20 0 BEADLO CC(C)(CCNC(=O)CCc1[nH]cc[nH+]1)C1CC1 ZINC000294307582 187349995 /nfs/dbraw/zinc/34/99/95/187349995.db2.gz XHUYQMMJLHCXBX-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO CC(C)[C@@H]1N(C(=O)CCn2cc[nH+]c2)CC1(C)C ZINC000294089568 187350122 /nfs/dbraw/zinc/35/01/22/187350122.db2.gz XQDTYKDOZCOBFM-ZDUSSCGKSA-N 1 2 249.358 2.166 20 0 BEADLO c1cc2cc(C[N@@H+]3CCO[C@H]4C[C@H]43)ccc2[nH]1 ZINC000628291269 346986846 /nfs/dbraw/zinc/98/68/46/346986846.db2.gz VENCTABUIBQNFF-KGLIPLIRSA-N 1 2 228.295 2.141 20 0 BEADLO c1cc2cc(C[N@H+]3CCO[C@H]4C[C@H]43)ccc2[nH]1 ZINC000628291269 346986849 /nfs/dbraw/zinc/98/68/49/346986849.db2.gz VENCTABUIBQNFF-KGLIPLIRSA-N 1 2 228.295 2.141 20 0 BEADLO CC[N@@H+](Cc1c[nH]cn1)Cc1cccs1 ZINC000179720417 346994200 /nfs/dbraw/zinc/99/42/00/346994200.db2.gz BXYQGVBCHUUGII-UHFFFAOYSA-N 1 2 221.329 2.493 20 0 BEADLO CC[N@H+](Cc1c[nH]cn1)Cc1cccs1 ZINC000179720417 346994201 /nfs/dbraw/zinc/99/42/01/346994201.db2.gz BXYQGVBCHUUGII-UHFFFAOYSA-N 1 2 221.329 2.493 20 0 BEADLO CC[N@H+](Cc1cnc[nH]1)Cc1cccs1 ZINC000179720417 346994202 /nfs/dbraw/zinc/99/42/02/346994202.db2.gz BXYQGVBCHUUGII-UHFFFAOYSA-N 1 2 221.329 2.493 20 0 BEADLO CC[N@@H+](Cc1cnc[nH]1)Cc1cccs1 ZINC000179720417 346994203 /nfs/dbraw/zinc/99/42/03/346994203.db2.gz BXYQGVBCHUUGII-UHFFFAOYSA-N 1 2 221.329 2.493 20 0 BEADLO Cc1cc(C)c(NC(=O)COCC2CC2)c(C)[nH+]1 ZINC000120092787 187353708 /nfs/dbraw/zinc/35/37/08/187353708.db2.gz HUQJCJMOBNQGGS-UHFFFAOYSA-N 1 2 248.326 2.372 20 0 BEADLO CCC[C@H](C)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000603246570 349898255 /nfs/dbraw/zinc/89/82/55/349898255.db2.gz IPYRVCIRDLRXMM-STQMWFEESA-N 1 2 249.358 2.483 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)C12CC(C1)C2 ZINC000625515161 343914619 /nfs/dbraw/zinc/91/46/19/343914619.db2.gz WCEZPBPJIQRCSI-UHFFFAOYSA-N 1 2 227.267 2.073 20 0 BEADLO Cc1c[nH]c(CN(C)Cc2ccsc2)[nH+]1 ZINC000628122893 343975214 /nfs/dbraw/zinc/97/52/14/343975214.db2.gz QZADIJXTADFHDL-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1cc(N2CC3(C2)CC(F)(F)C3)nc[nH+]1 ZINC000672275277 488249494 /nfs/dbraw/zinc/24/94/94/488249494.db2.gz OHYRTLKKRWVKBA-UHFFFAOYSA-N 1 2 225.242 2.021 20 0 BEADLO c1csc(C[N@@H+]2CCOC3(CCCC3)C2)n1 ZINC000135158557 343954873 /nfs/dbraw/zinc/95/48/73/343954873.db2.gz RHYLQSNZLRQJAH-UHFFFAOYSA-N 1 2 238.356 2.288 20 0 BEADLO c1csc(C[N@H+]2CCOC3(CCCC3)C2)n1 ZINC000135158557 343954874 /nfs/dbraw/zinc/95/48/74/343954874.db2.gz RHYLQSNZLRQJAH-UHFFFAOYSA-N 1 2 238.356 2.288 20 0 BEADLO OCc1cc[nH+]c(NCCCc2ccccc2)c1 ZINC000641252010 362330550 /nfs/dbraw/zinc/33/05/50/362330550.db2.gz DNIINIQHELNMOY-UHFFFAOYSA-N 1 2 242.322 2.041 20 0 BEADLO Fc1c[nH+]ccc1NCCOC1CCCC1 ZINC000641302831 362352260 /nfs/dbraw/zinc/35/22/60/362352260.db2.gz VDFINSMDFSUPDR-UHFFFAOYSA-N 1 2 224.279 2.014 20 0 BEADLO CCCC[C@@H]([NH2+][C@@H](C)COC(C)C)C(=O)OC ZINC000337514747 344117389 /nfs/dbraw/zinc/11/73/89/344117389.db2.gz UKZNIUZMZNXTHD-NWDGAFQWSA-N 1 2 245.363 2.121 20 0 BEADLO CCc1cnc(CNc2cc[nH+]c(C)n2)s1 ZINC000078513619 344098531 /nfs/dbraw/zinc/09/85/31/344098531.db2.gz ZKSZFVJXAUWPNQ-UHFFFAOYSA-N 1 2 234.328 2.416 20 0 BEADLO OCc1cc[nH+]c(NC[C@H]2CC=CCC2)c1 ZINC000641312175 362358600 /nfs/dbraw/zinc/35/86/00/362358600.db2.gz CUOQSACWAMQKGC-NSHDSACASA-N 1 2 218.300 2.342 20 0 BEADLO CC(C)(C(=O)N1CC2(C1)CCCC2)c1c[nH+]c[nH]1 ZINC000621961263 344129920 /nfs/dbraw/zinc/12/99/20/344129920.db2.gz AAXAJIGWQJCNMK-UHFFFAOYSA-N 1 2 247.342 2.090 20 0 BEADLO CN(C[C@H]1CC=CCC1)C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493396020 529962235 /nfs/dbraw/zinc/96/22/35/529962235.db2.gz DUWWUWAROPNBGA-GUOLPTJISA-N 1 2 245.326 2.238 20 0 BEADLO Cc1ccncc1C[NH2+]CC(C)(F)F ZINC000381988878 347036083 /nfs/dbraw/zinc/03/60/83/347036083.db2.gz HEEVBYIURQRFLL-UHFFFAOYSA-N 1 2 200.232 2.135 20 0 BEADLO CC[N@H+](Cc1csc(NC(C)=O)n1)C1CC1 ZINC000056493079 344235518 /nfs/dbraw/zinc/23/55/18/344235518.db2.gz PKPRAZRTVYZPAF-UHFFFAOYSA-N 1 2 239.344 2.086 20 0 BEADLO CC[N@@H+](Cc1csc(NC(C)=O)n1)C1CC1 ZINC000056493079 344235519 /nfs/dbraw/zinc/23/55/19/344235519.db2.gz PKPRAZRTVYZPAF-UHFFFAOYSA-N 1 2 239.344 2.086 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H](C)OCC1CC1 ZINC000107288928 344238217 /nfs/dbraw/zinc/23/82/17/344238217.db2.gz JAQVSRWGUCUUIM-JTQLQIEISA-N 1 2 234.299 2.144 20 0 BEADLO C[C@@H](O)[C@H](C)SCc1ccc(N(C)C)[nH+]c1 ZINC000600524264 344256004 /nfs/dbraw/zinc/25/60/04/344256004.db2.gz GXFCUBJVPBCWDO-ZJUUUORDSA-N 1 2 240.372 2.150 20 0 BEADLO CC(=O)[C@@H](C)SCc1ccc(N(C)C)[nH+]c1 ZINC000600537612 344262866 /nfs/dbraw/zinc/26/28/66/344262866.db2.gz RKQNUNSVVTVHAN-SNVBAGLBSA-N 1 2 238.356 2.358 20 0 BEADLO CCCCN(CCOC)c1cc[nH+]cc1F ZINC000641366535 362378617 /nfs/dbraw/zinc/37/86/17/362378617.db2.gz AHRHWXDSPIOAIQ-UHFFFAOYSA-N 1 2 226.295 2.474 20 0 BEADLO Cn1cc[nH+]c1CS[C@@H]1COC(C)(C)C1 ZINC000600574680 344288396 /nfs/dbraw/zinc/28/83/96/344288396.db2.gz WQRXFTQCGLNSFW-VIFPVBQESA-N 1 2 226.345 2.221 20 0 BEADLO CCCC(CCC)c1nc(C[NH2+]C)no1 ZINC000133004384 344310580 /nfs/dbraw/zinc/31/05/80/344310580.db2.gz GKXNVCGYJZLNCL-UHFFFAOYSA-N 1 2 211.309 2.473 20 0 BEADLO C[C@H](NC(=O)CC1=CCCCC1)c1[nH+]ccn1C ZINC000620600783 344334135 /nfs/dbraw/zinc/33/41/35/344334135.db2.gz QLWQQHUKTBRBSC-NSHDSACASA-N 1 2 247.342 2.488 20 0 BEADLO C[C@@H](NC(=O)CC1=CCCCC1)c1[nH+]ccn1C ZINC000620600778 344334176 /nfs/dbraw/zinc/33/41/76/344334176.db2.gz QLWQQHUKTBRBSC-LLVKDONJSA-N 1 2 247.342 2.488 20 0 BEADLO CCCC[C@H](COC)Nc1cc[nH+]cc1F ZINC000641383515 362384400 /nfs/dbraw/zinc/38/44/00/362384400.db2.gz AMXXDZDVPUYZIW-SNVBAGLBSA-N 1 2 226.295 2.260 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CC[C@@H](C)C1)c1[nH+]ccn1C ZINC000620603057 344352762 /nfs/dbraw/zinc/35/27/62/344352762.db2.gz DTYZSWJMXLEDNX-MXWKQRLJSA-N 1 2 235.331 2.034 20 0 BEADLO C[C@H](NC(=O)[C@H]1CCCC1(C)C)c1[nH+]ccn1C ZINC000620603787 344354136 /nfs/dbraw/zinc/35/41/36/344354136.db2.gz LKLPIMQNGAHZMJ-WDEREUQCSA-N 1 2 249.358 2.424 20 0 BEADLO CCSCC[NH2+][C@@H](C[C@H](C)CC)C(=O)OC ZINC000584292362 344426567 /nfs/dbraw/zinc/42/65/67/344426567.db2.gz LCTLILJYLYGKMC-MNOVXSKESA-N 1 2 247.404 2.307 20 0 BEADLO CCSCC[NH2+][C@@H](C[C@@H](C)CC)C(=O)OC ZINC000584292363 344426826 /nfs/dbraw/zinc/42/68/26/344426826.db2.gz LCTLILJYLYGKMC-QWRGUYRKSA-N 1 2 247.404 2.307 20 0 BEADLO FC(F)(F)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000306700005 344401819 /nfs/dbraw/zinc/40/18/19/344401819.db2.gz YCQAUYAEALGKGN-LLVKDONJSA-N 1 2 245.244 2.450 20 0 BEADLO FC(F)(F)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000306700005 344401822 /nfs/dbraw/zinc/40/18/22/344401822.db2.gz YCQAUYAEALGKGN-LLVKDONJSA-N 1 2 245.244 2.450 20 0 BEADLO CCN(C(=O)CCc1c[nH+]c[nH]1)[C@@H](C)C(C)C ZINC000584301243 344437946 /nfs/dbraw/zinc/43/79/46/344437946.db2.gz OEPIDHXVQADJMG-NSHDSACASA-N 1 2 237.347 2.235 20 0 BEADLO CCN(C(=O)CCc1c[nH]c[nH+]1)[C@@H](C)C(C)C ZINC000584301243 344437948 /nfs/dbraw/zinc/43/79/48/344437948.db2.gz OEPIDHXVQADJMG-NSHDSACASA-N 1 2 237.347 2.235 20 0 BEADLO CC1(C)[C@@H]2CN(c3cc[nH+]cc3F)C[C@@H]21 ZINC000641399645 362393207 /nfs/dbraw/zinc/39/32/07/362393207.db2.gz QUVKQCMHDKUXDG-DTORHVGOSA-N 1 2 206.264 2.313 20 0 BEADLO CCc1nc([C@@H](C)[NH2+]Cc2cn[nH]c2)cs1 ZINC000381473575 344510331 /nfs/dbraw/zinc/51/03/31/344510331.db2.gz POVTZXIFSNWTKW-MRVPVSSYSA-N 1 2 236.344 2.279 20 0 BEADLO CCCC[C@H]([NH2+][C@@H]1CCS[C@@H]1C)C(=O)OC ZINC000381551195 344520097 /nfs/dbraw/zinc/52/00/97/344520097.db2.gz MUMXOGXWTQZLRJ-MXWKQRLJSA-N 1 2 245.388 2.202 20 0 BEADLO C[C@@H](CC(=O)NCC1CC(C)(C)C1)n1cc[nH+]c1 ZINC000577378315 344524955 /nfs/dbraw/zinc/52/49/55/344524955.db2.gz QNFFOVBUSMEVSY-NSHDSACASA-N 1 2 249.358 2.387 20 0 BEADLO CC(C)=CC[N@@H+](C)CC(=O)Nc1cc(C)ccn1 ZINC000069013213 344536075 /nfs/dbraw/zinc/53/60/75/344536075.db2.gz IBOVIKTWJFXZFU-UHFFFAOYSA-N 1 2 247.342 2.227 20 0 BEADLO CC(C)=CC[N@H+](C)CC(=O)Nc1cc(C)ccn1 ZINC000069013213 344536077 /nfs/dbraw/zinc/53/60/77/344536077.db2.gz IBOVIKTWJFXZFU-UHFFFAOYSA-N 1 2 247.342 2.227 20 0 BEADLO CC(C)C[C@@H](CCO)CNc1cc[nH+]cc1F ZINC000641407666 362400296 /nfs/dbraw/zinc/40/02/96/362400296.db2.gz ABRYNTXHGUEUMP-LLVKDONJSA-N 1 2 240.322 2.099 20 0 BEADLO Cc1nc(SCc2cn(C)c[nH+]2)oc1C ZINC000641439746 362420342 /nfs/dbraw/zinc/42/03/42/362420342.db2.gz QFWYOWHDXLGLGZ-UHFFFAOYSA-N 1 2 223.301 2.317 20 0 BEADLO Cc1ccc(SCc2cn(C)c[nH+]2)nc1 ZINC000641445123 362423761 /nfs/dbraw/zinc/42/37/61/362423761.db2.gz MJJOXUSSEZBXMH-UHFFFAOYSA-N 1 2 219.313 2.416 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1CCOC2(CCC2)C1 ZINC000641446738 362423795 /nfs/dbraw/zinc/42/37/95/362423795.db2.gz FJVXBZCKSXBUQJ-SNVBAGLBSA-N 1 2 236.290 2.156 20 0 BEADLO CC(C)[C@H]1C[C@H](Nc2cc[nH+]cc2F)CCO1 ZINC000641476748 362445293 /nfs/dbraw/zinc/44/52/93/362445293.db2.gz PWKMVHIZCOODPT-ZWNOBZJWSA-N 1 2 238.306 2.258 20 0 BEADLO C[C@@H](CO)SCCc1[nH]c2ccccc2[nH+]1 ZINC000603318411 349913895 /nfs/dbraw/zinc/91/38/95/349913895.db2.gz IFBVUGGUWCBWJY-VIFPVBQESA-N 1 2 236.340 2.219 20 0 BEADLO CC(C)[C@H](O)C(C)(C)CNc1cc[nH+]cc1F ZINC000641459924 362433683 /nfs/dbraw/zinc/43/36/83/362433683.db2.gz FHPLYRDYWWVCTG-LBPRGKRZSA-N 1 2 240.322 2.098 20 0 BEADLO Fc1c[nH+]ccc1N1CCO[C@@H](c2ccco2)C1 ZINC000641427168 362411645 /nfs/dbraw/zinc/41/16/45/362411645.db2.gz ZCBALOFDMLHKRW-CYBMUJFWSA-N 1 2 248.257 2.392 20 0 BEADLO COC(C)(C)CN(C)c1cc[nH+]cc1F ZINC000641434229 362415235 /nfs/dbraw/zinc/41/52/35/362415235.db2.gz JFPKMVCAKFEJBZ-UHFFFAOYSA-N 1 2 212.268 2.082 20 0 BEADLO C[C@@]1(CNc2cc(CO)cc[nH+]2)CCCS1 ZINC000641432732 362416120 /nfs/dbraw/zinc/41/61/20/362416120.db2.gz PUUMPUJPJBTNAN-LBPRGKRZSA-N 1 2 238.356 2.272 20 0 BEADLO CN(Cc1cccs1)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492761503 530008473 /nfs/dbraw/zinc/00/84/73/530008473.db2.gz GKVBNBHXQWTCDF-PLNGDYQASA-N 1 2 247.323 2.143 20 0 BEADLO C[C@H](CC(F)(F)F)Nc1cc[nH+]cc1F ZINC000641493631 362459744 /nfs/dbraw/zinc/45/97/44/362459744.db2.gz JLGCPYCSFFPSGF-ZCFIWIBFSA-N 1 2 222.185 2.395 20 0 BEADLO C[C@@H]1CCN(c2cc(CO)cc[nH+]2)CC1(C)C ZINC000641510602 362470002 /nfs/dbraw/zinc/47/00/02/362470002.db2.gz FHJXGDLZMJWPGM-LLVKDONJSA-N 1 2 234.343 2.446 20 0 BEADLO Cc1cnc(C[N@@H+]2CCOC3(CCCC3)C2)o1 ZINC000158335513 344600782 /nfs/dbraw/zinc/60/07/82/344600782.db2.gz AKTZIPOYIDMUSE-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO Cc1cnc(C[N@H+]2CCOC3(CCCC3)C2)o1 ZINC000158335513 344600783 /nfs/dbraw/zinc/60/07/83/344600783.db2.gz AKTZIPOYIDMUSE-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO OCc1cc[nH+]c(NCC2(C(F)F)CC2)c1 ZINC000641546862 362493692 /nfs/dbraw/zinc/49/36/92/362493692.db2.gz ZZZMJBZVFHMVMH-UHFFFAOYSA-N 1 2 228.242 2.031 20 0 BEADLO CC(=O)C[N@@H+]1CCc2sccc2[C@H]1C ZINC000050142402 344649738 /nfs/dbraw/zinc/64/97/38/344649738.db2.gz JCUWJGZRWRIDBG-SECBINFHSA-N 1 2 209.314 2.256 20 0 BEADLO CC(=O)C[N@H+]1CCc2sccc2[C@H]1C ZINC000050142402 344649740 /nfs/dbraw/zinc/64/97/40/344649740.db2.gz JCUWJGZRWRIDBG-SECBINFHSA-N 1 2 209.314 2.256 20 0 BEADLO C[C@H](c1cccnc1)[N@@H+]1CCO[C@H](CCF)C1 ZINC000626001970 344662352 /nfs/dbraw/zinc/66/23/52/344662352.db2.gz CIHNBVOGNMGKLT-DGCLKSJQSA-N 1 2 238.306 2.203 20 0 BEADLO C[C@H](c1cccnc1)[N@H+]1CCO[C@H](CCF)C1 ZINC000626001970 344662353 /nfs/dbraw/zinc/66/23/53/344662353.db2.gz CIHNBVOGNMGKLT-DGCLKSJQSA-N 1 2 238.306 2.203 20 0 BEADLO C[C@@H](c1ccccn1)[N@@H+]1CCO[C@H](CCF)C1 ZINC000626004261 344666207 /nfs/dbraw/zinc/66/62/07/344666207.db2.gz COGPRFVZLGOFCP-NWDGAFQWSA-N 1 2 238.306 2.203 20 0 BEADLO C[C@@H](c1ccccn1)[N@H+]1CCO[C@H](CCF)C1 ZINC000626004261 344666209 /nfs/dbraw/zinc/66/62/09/344666209.db2.gz COGPRFVZLGOFCP-NWDGAFQWSA-N 1 2 238.306 2.203 20 0 BEADLO C[C@@H](c1ccccn1)[N@@H+]1CCO[C@@H](CCF)C1 ZINC000626004262 344666252 /nfs/dbraw/zinc/66/62/52/344666252.db2.gz COGPRFVZLGOFCP-RYUDHWBXSA-N 1 2 238.306 2.203 20 0 BEADLO C[C@@H](c1ccccn1)[N@H+]1CCO[C@@H](CCF)C1 ZINC000626004262 344666254 /nfs/dbraw/zinc/66/62/54/344666254.db2.gz COGPRFVZLGOFCP-RYUDHWBXSA-N 1 2 238.306 2.203 20 0 BEADLO Cc1ncc(C[NH+]2C[C@@H](C)O[C@H](C)C2)s1 ZINC000128019920 344712713 /nfs/dbraw/zinc/71/27/13/344712713.db2.gz QTSKYPSGSHRFNB-RKDXNWHRSA-N 1 2 226.345 2.061 20 0 BEADLO CO[C@@]1(C)C[C@H](Nc2cc[nH+]c(C)n2)C1(C)C ZINC000075064686 344764360 /nfs/dbraw/zinc/76/43/60/344764360.db2.gz KFTYKMUJYGINRL-GWCFXTLKSA-N 1 2 235.331 2.401 20 0 BEADLO Cc1nc(N[C@H](CO)C2CCCCC2)cc[nH+]1 ZINC000075066301 344764892 /nfs/dbraw/zinc/76/48/92/344764892.db2.gz LOGWBYZNMFYRDV-GFCCVEGCSA-N 1 2 235.331 2.138 20 0 BEADLO CC(C)[C@H](C)CC(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000075630060 344781967 /nfs/dbraw/zinc/78/19/67/344781967.db2.gz CHMXYKRRRAYGJA-VXGBXAGGSA-N 1 2 237.347 2.070 20 0 BEADLO CNc1ccc(Nc2ncnc3c2CCC3)c[nH+]1 ZINC000076921675 344808160 /nfs/dbraw/zinc/80/81/60/344808160.db2.gz JDDCOMLBHOXZSW-UHFFFAOYSA-N 1 2 241.298 2.146 20 0 BEADLO CCCC[N@@H+]1CC(=O)N[C@H]1C1CCCCC1 ZINC000077474987 344820463 /nfs/dbraw/zinc/82/04/63/344820463.db2.gz XUFWGQQHNBTOCY-CYBMUJFWSA-N 1 2 224.348 2.125 20 0 BEADLO CCCC[N@H+]1CC(=O)N[C@H]1C1CCCCC1 ZINC000077474987 344820464 /nfs/dbraw/zinc/82/04/64/344820464.db2.gz XUFWGQQHNBTOCY-CYBMUJFWSA-N 1 2 224.348 2.125 20 0 BEADLO C[C@H](NC(=O)[C@H]1CCCC12CC2)c1[nH+]ccn1C ZINC000628148860 344835490 /nfs/dbraw/zinc/83/54/90/344835490.db2.gz CDIRXGOOGZDPDR-WDEREUQCSA-N 1 2 247.342 2.178 20 0 BEADLO Cc1c[nH]c(C[NH+]2CCC(OC(C)C)CC2)n1 ZINC000628152964 344841849 /nfs/dbraw/zinc/84/18/49/344841849.db2.gz UVPDMHCKZVSQHO-UHFFFAOYSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1nc(N2CCC[C@H](C)[C@@H]2C)cc[nH+]1 ZINC000078335294 344847929 /nfs/dbraw/zinc/84/79/29/344847929.db2.gz ANUIULGQHDYLFY-UWVGGRQHSA-N 1 2 205.305 2.410 20 0 BEADLO CCc1nnc(C[NH2+]Cc2ccc(C)cc2F)[nH]1 ZINC000631145617 344856198 /nfs/dbraw/zinc/85/61/98/344856198.db2.gz NRLCHWZRWGQWPK-UHFFFAOYSA-N 1 2 248.305 2.104 20 0 BEADLO CC[N@H+](Cc1ncc(C)o1)Cc1ccccn1 ZINC000119846797 344868338 /nfs/dbraw/zinc/86/83/38/344868338.db2.gz ODSWQWFGIMRRMS-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1ncc(C)o1)Cc1ccccn1 ZINC000119846797 344868339 /nfs/dbraw/zinc/86/83/39/344868339.db2.gz ODSWQWFGIMRRMS-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO Cc1ccc(CNC(=O)[C@@H](C)n2cc[nH+]c2)s1 ZINC000053776145 1172053417 /nfs/dbraw/zinc/05/34/17/1172053417.db2.gz DTAQDXPAOXMBSZ-SNVBAGLBSA-N 1 2 249.339 2.130 20 0 BEADLO Cc1nc(NCC[C@H](O)c2ccccc2)cc[nH+]1 ZINC000078519757 344878945 /nfs/dbraw/zinc/87/89/45/344878945.db2.gz SOYZLAPJUCUYCK-ZDUSSCGKSA-N 1 2 243.310 2.321 20 0 BEADLO CCc1cnc(CCNc2cc[nH+]c(C)n2)s1 ZINC000078513349 344880408 /nfs/dbraw/zinc/88/04/08/344880408.db2.gz JVRXPSQKNIQTLV-UHFFFAOYSA-N 1 2 248.355 2.459 20 0 BEADLO CC[C@@H]1CN(c2cc[nH+]c(C)n2)CCS1 ZINC000078590630 344887940 /nfs/dbraw/zinc/88/79/40/344887940.db2.gz XHFQMGRAFSGGKW-SNVBAGLBSA-N 1 2 223.345 2.117 20 0 BEADLO C[C@H](Nc1cccc[nH+]1)c1nnc2ccccn21 ZINC000078596393 344888880 /nfs/dbraw/zinc/88/88/80/344888880.db2.gz MFBUJLXXWKYOPS-JTQLQIEISA-N 1 2 239.282 2.297 20 0 BEADLO CCN(Cc1[nH]c(C)c(C)[nH+]1)Cc1ccccn1 ZINC000628172206 344890971 /nfs/dbraw/zinc/89/09/71/344890971.db2.gz ZFTOHINKQQSZAT-UHFFFAOYSA-N 1 2 244.342 2.444 20 0 BEADLO C[C@@H]1OCC[N@H+](Cc2cnc(C3CC3)o2)[C@H]1C ZINC000628175914 344900025 /nfs/dbraw/zinc/90/00/25/344900025.db2.gz NVOWFTFMNMYNDV-UWVGGRQHSA-N 1 2 236.315 2.161 20 0 BEADLO C[C@@H]1OCC[N@@H+](Cc2cnc(C3CC3)o2)[C@H]1C ZINC000628175914 344900026 /nfs/dbraw/zinc/90/00/26/344900026.db2.gz NVOWFTFMNMYNDV-UWVGGRQHSA-N 1 2 236.315 2.161 20 0 BEADLO Cc1c[nH]c(CN2CCOC3(CCCCC3)C2)[nH+]1 ZINC000628183972 344930307 /nfs/dbraw/zinc/93/03/07/344930307.db2.gz VFGMFAIGHDYDNG-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO c1nc(C2CC2)oc1C[N@@H+]1CCOC[C@H]1C1CC1 ZINC000628184045 344930712 /nfs/dbraw/zinc/93/07/12/344930712.db2.gz XTZKXZHIHYUQPA-ZDUSSCGKSA-N 1 2 248.326 2.163 20 0 BEADLO c1nc(C2CC2)oc1C[N@H+]1CCOC[C@H]1C1CC1 ZINC000628184045 344930714 /nfs/dbraw/zinc/93/07/14/344930714.db2.gz XTZKXZHIHYUQPA-ZDUSSCGKSA-N 1 2 248.326 2.163 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCS[C@H](C)[C@@H]2C)n1 ZINC000628178783 344913449 /nfs/dbraw/zinc/91/34/49/344913449.db2.gz BTSFMUKTRMHCSS-VHSXEESVSA-N 1 2 225.361 2.044 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCS[C@H](C)[C@@H]2C)n1 ZINC000628178783 344913450 /nfs/dbraw/zinc/91/34/50/344913450.db2.gz BTSFMUKTRMHCSS-VHSXEESVSA-N 1 2 225.361 2.044 20 0 BEADLO CC(C)[C@H]1C[C@H]1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000577071036 365803213 /nfs/dbraw/zinc/80/32/13/365803213.db2.gz IXALYUHEKREEKZ-NXEZZACHSA-N 1 2 235.331 2.053 20 0 BEADLO Cc1ccc([C@H](C)C[N@H+](C)Cc2nnc[nH]2)cc1 ZINC000628179445 344914888 /nfs/dbraw/zinc/91/48/88/344914888.db2.gz ADTVJWXFFDVAFL-GFCCVEGCSA-N 1 2 244.342 2.349 20 0 BEADLO Cc1ccc([C@H](C)C[N@@H+](C)Cc2nnc[nH]2)cc1 ZINC000628179445 344914890 /nfs/dbraw/zinc/91/48/90/344914890.db2.gz ADTVJWXFFDVAFL-GFCCVEGCSA-N 1 2 244.342 2.349 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccc(C)nc2)no1 ZINC000153760222 344967104 /nfs/dbraw/zinc/96/71/04/344967104.db2.gz IZPPSEDGADEUBT-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccc(C)nc2)no1 ZINC000153760222 344967110 /nfs/dbraw/zinc/96/71/10/344967110.db2.gz IZPPSEDGADEUBT-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1cncs1 ZINC000166612774 344943052 /nfs/dbraw/zinc/94/30/52/344943052.db2.gz BYFQAWVWWDMMCA-NSHDSACASA-N 1 2 224.329 2.087 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@H+]1Cc1cncs1 ZINC000166612774 344943054 /nfs/dbraw/zinc/94/30/54/344943054.db2.gz BYFQAWVWWDMMCA-NSHDSACASA-N 1 2 224.329 2.087 20 0 BEADLO Brc1ccc(C[NH+]2CCC2)nc1 ZINC000238001157 344948995 /nfs/dbraw/zinc/94/89/95/344948995.db2.gz JBPYNSNKDSSYSX-UHFFFAOYSA-N 1 2 227.105 2.050 20 0 BEADLO COc1ccc([C@@H](O)CNc2cccc[nH+]2)cc1 ZINC000079884470 345048441 /nfs/dbraw/zinc/04/84/41/345048441.db2.gz WCIJYDCMCBXTQY-ZDUSSCGKSA-N 1 2 244.294 2.236 20 0 BEADLO COC(=O)c1occc1CNc1ccc(C)[nH+]c1 ZINC000154236506 345021841 /nfs/dbraw/zinc/02/18/41/345021841.db2.gz FALGLOXYKDUKLU-UHFFFAOYSA-N 1 2 246.266 2.382 20 0 BEADLO CCO[C@@H]1CCC[C@H]1Nc1cc[nH+]cc1F ZINC000641623221 362554040 /nfs/dbraw/zinc/55/40/40/362554040.db2.gz GLGVSTIQSYRVFH-VXGBXAGGSA-N 1 2 224.279 2.012 20 0 BEADLO C[C@@H](NC(=O)C[C@H](C)n1cc[nH+]c1)C(C)(C)C ZINC000577068556 365804014 /nfs/dbraw/zinc/80/40/14/365804014.db2.gz VFFZCGUYXUQKRG-WDEREUQCSA-N 1 2 237.347 2.385 20 0 BEADLO OCc1cc[nH+]c(N2CCC[C@H](C3CC3)C2)c1 ZINC000641599732 362540564 /nfs/dbraw/zinc/54/05/64/362540564.db2.gz ZGAXDYKWQMYKAW-ZDUSSCGKSA-N 1 2 232.327 2.200 20 0 BEADLO Fc1c[nH+]ccc1NCC1CC(F)(F)C1 ZINC000641605906 362541193 /nfs/dbraw/zinc/54/11/93/362541193.db2.gz MIILYMQZLHHOJO-UHFFFAOYSA-N 1 2 216.206 2.100 20 0 BEADLO Fc1c[nH+]ccc1N1CCCC(F)(F)C1 ZINC000641649207 362576544 /nfs/dbraw/zinc/57/65/44/362576544.db2.gz COLLJCXIMXTURY-UHFFFAOYSA-N 1 2 216.206 2.456 20 0 BEADLO C[C@@H]1CCC[C@@H](CNc2cc[nH+]cc2F)O1 ZINC000641660297 362579838 /nfs/dbraw/zinc/57/98/38/362579838.db2.gz WNTUPLBMQXLCEM-ZJUUUORDSA-N 1 2 224.279 2.012 20 0 BEADLO Fc1c[nH+]ccc1NCCOCC1CCCC1 ZINC000641625996 362555236 /nfs/dbraw/zinc/55/52/36/362555236.db2.gz ZBJXTIJYPHWHAK-UHFFFAOYSA-N 1 2 238.306 2.261 20 0 BEADLO CO[C@@H]1C[C@@H](Nc2cc[nH+]cc2F)C12CCC2 ZINC000641630331 362560749 /nfs/dbraw/zinc/56/07/49/362560749.db2.gz UCPVLIVAYIZJFV-VXGBXAGGSA-N 1 2 236.290 2.012 20 0 BEADLO CO[C@@H](CNc1cc[nH+]cc1F)CC(C)C ZINC000641638803 362566876 /nfs/dbraw/zinc/56/68/76/362566876.db2.gz SZWOBVFFOWSIHE-SNVBAGLBSA-N 1 2 226.295 2.116 20 0 BEADLO C[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635077880 345242285 /nfs/dbraw/zinc/24/22/85/345242285.db2.gz JTAVVZDDTQJRPI-DDHJBXDOSA-N 1 2 247.342 2.208 20 0 BEADLO C[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635077880 345242286 /nfs/dbraw/zinc/24/22/86/345242286.db2.gz JTAVVZDDTQJRPI-DDHJBXDOSA-N 1 2 247.342 2.208 20 0 BEADLO COc1ccc[nH+]c1NCC1CCC(O)CC1 ZINC000227707323 345244734 /nfs/dbraw/zinc/24/47/34/345244734.db2.gz XSGSBDIDEOVAKM-UHFFFAOYSA-N 1 2 236.315 2.053 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2nonc2C)o1 ZINC000069794919 178844669 /nfs/dbraw/zinc/84/46/69/178844669.db2.gz BZPAISOBPWUUNH-SECBINFHSA-N 1 2 221.260 2.130 20 0 BEADLO CCN(C(=O)[C@H](CC(C)C)n1cc[nH+]c1)C1CC1 ZINC000635216773 345274439 /nfs/dbraw/zinc/27/44/39/345274439.db2.gz VIJJIHVTGICUKA-ZDUSSCGKSA-N 1 2 249.358 2.481 20 0 BEADLO O=C(NCCC1CCCC1)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635219284 345276104 /nfs/dbraw/zinc/27/61/04/345276104.db2.gz DUDPGBNTORDNGP-VXGBXAGGSA-N 1 2 247.342 2.210 20 0 BEADLO O=C(NCCC1CCCC1)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635219284 345276106 /nfs/dbraw/zinc/27/61/06/345276106.db2.gz DUDPGBNTORDNGP-VXGBXAGGSA-N 1 2 247.342 2.210 20 0 BEADLO CC(C)CCN(C)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635247890 345284226 /nfs/dbraw/zinc/28/42/26/345284226.db2.gz BHGSNHWVHQKKBH-GHMZBOCLSA-N 1 2 235.331 2.018 20 0 BEADLO CC(C)CCN(C)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635247890 345284227 /nfs/dbraw/zinc/28/42/27/345284227.db2.gz BHGSNHWVHQKKBH-GHMZBOCLSA-N 1 2 235.331 2.018 20 0 BEADLO CC(C)C[C@H](C(=O)NCC1CCC1)n1cc[nH+]c1 ZINC000635268027 345291002 /nfs/dbraw/zinc/29/10/02/345291002.db2.gz WTEUMBSVOQPBGW-CYBMUJFWSA-N 1 2 249.358 2.387 20 0 BEADLO Cc1ccncc1[C@H](C)[NH2+]Cc1ncccn1 ZINC000562318591 345341603 /nfs/dbraw/zinc/34/16/03/345341603.db2.gz BMWJJAZLKVPHTO-NSHDSACASA-N 1 2 228.299 2.031 20 0 BEADLO Cc1nnc(C[NH2+][C@@H](C)c2ccsc2)o1 ZINC000235514266 537895492 /nfs/dbraw/zinc/89/54/92/537895492.db2.gz FJHJHJFNDBCIMU-ZETCQYMHSA-N 1 2 223.301 2.290 20 0 BEADLO CC[C@@H](C)[C@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635420702 345360451 /nfs/dbraw/zinc/36/04/51/345360451.db2.gz SARFYEHIXRBPOS-LMLFDSFASA-N 1 2 235.331 2.064 20 0 BEADLO CC[C@@H](C)[C@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635420702 345360452 /nfs/dbraw/zinc/36/04/52/345360452.db2.gz SARFYEHIXRBPOS-LMLFDSFASA-N 1 2 235.331 2.064 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CCC[C@@H]2C(C)C)[nH+]1 ZINC000635426254 345362655 /nfs/dbraw/zinc/36/26/55/345362655.db2.gz YUQCVEFBLTUERM-GFCCVEGCSA-N 1 2 249.358 2.162 20 0 BEADLO C[C@@H](C(=O)Nc1ccccc1F)n1cc[nH+]c1 ZINC000053898536 1172060615 /nfs/dbraw/zinc/06/06/15/1172060615.db2.gz QTPWPKWYEUGQEM-VIFPVBQESA-N 1 2 233.246 2.222 20 0 BEADLO Cc1cc(NC(C)(C)[C@@H](C)O)nc(C(C)C)[nH+]1 ZINC000158790000 345377429 /nfs/dbraw/zinc/37/74/29/345377429.db2.gz MDCNDFQYMSESMO-SNVBAGLBSA-N 1 2 237.347 2.480 20 0 BEADLO CCCC(C)(C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635456633 345378461 /nfs/dbraw/zinc/37/84/61/345378461.db2.gz RZGKPBIOZGHHAL-NXEZZACHSA-N 1 2 235.331 2.208 20 0 BEADLO CCCC(C)(C)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635456633 345378462 /nfs/dbraw/zinc/37/84/62/345378462.db2.gz RZGKPBIOZGHHAL-NXEZZACHSA-N 1 2 235.331 2.208 20 0 BEADLO Cc1cccc(NC(=O)[C@H](C)n2cc[nH+]c2)c1 ZINC000053898553 1172060715 /nfs/dbraw/zinc/06/07/15/1172060715.db2.gz QIHIPIIURGHUTO-NSHDSACASA-N 1 2 229.283 2.391 20 0 BEADLO Cc1cn2ccc(C(=O)N(C)CC3CC3)cc2[nH+]1 ZINC000635378035 345333883 /nfs/dbraw/zinc/33/38/83/345333883.db2.gz RVQZGXZPSMUDFF-UHFFFAOYSA-N 1 2 243.310 2.125 20 0 BEADLO C[C@@H](C(=O)N(C)C1CCCCC1)n1cc[nH+]c1 ZINC000053898568 1172060503 /nfs/dbraw/zinc/06/05/03/1172060503.db2.gz KABXAUYHRHYGOP-NSHDSACASA-N 1 2 235.331 2.235 20 0 BEADLO CC(C)c1cnc(C[N@H+](CCO)C2CC2)s1 ZINC000134873345 345424325 /nfs/dbraw/zinc/42/43/25/345424325.db2.gz XSNHEHUHNAOSLE-UHFFFAOYSA-N 1 2 240.372 2.223 20 0 BEADLO CC(C)c1cnc(C[N@@H+](CCO)C2CC2)s1 ZINC000134873345 345424327 /nfs/dbraw/zinc/42/43/27/345424327.db2.gz XSNHEHUHNAOSLE-UHFFFAOYSA-N 1 2 240.372 2.223 20 0 BEADLO C[C@@H]1CN(c2cc(C(F)(F)F)cc[nH+]2)CCO1 ZINC000080766502 345449699 /nfs/dbraw/zinc/44/96/99/345449699.db2.gz NSLJMVQWTQDQMJ-MRVPVSSYSA-N 1 2 246.232 2.326 20 0 BEADLO CCn1cc[nH+]c1CN(C)Cc1cccc(O)c1 ZINC000080919642 345450986 /nfs/dbraw/zinc/45/09/86/345450986.db2.gz NYTMLEPRTYBPEA-UHFFFAOYSA-N 1 2 245.326 2.241 20 0 BEADLO CC(C)(C)c1nc(N[C@@H]2CCCC[C@@H]2O)cc[nH+]1 ZINC000080803703 345451342 /nfs/dbraw/zinc/45/13/42/345451342.db2.gz HOSBULQEVKFXAO-MNOVXSKESA-N 1 2 249.358 2.490 20 0 BEADLO CN(CC1=CCCOC1)c1cc[nH+]cc1F ZINC000641659248 362584384 /nfs/dbraw/zinc/58/43/84/362584384.db2.gz NQRZCHMYXHPRTR-UHFFFAOYSA-N 1 2 222.263 2.004 20 0 BEADLO OCc1cc[nH+]c(NC[C@@H]2CCC[C@H]3C[C@H]32)c1 ZINC000641659442 362584549 /nfs/dbraw/zinc/58/45/49/362584549.db2.gz PQLOQFZKRHCUDC-RWMBFGLXSA-N 1 2 232.327 2.422 20 0 BEADLO OCc1cc[nH+]c(NC[C@@H]2CCC[C@@H]3C[C@@H]32)c1 ZINC000641659439 362584662 /nfs/dbraw/zinc/58/46/62/362584662.db2.gz PQLOQFZKRHCUDC-AGIUHOORSA-N 1 2 232.327 2.422 20 0 BEADLO CC(C)(Nc1ccnc(C2CC2)n1)c1[nH]cc[nH+]1 ZINC000641663320 362587519 /nfs/dbraw/zinc/58/75/19/362587519.db2.gz VXFWVIOMLGVQAB-UHFFFAOYSA-N 1 2 243.314 2.424 20 0 BEADLO CCc1cc(NC(C)(C)c2[nH]cc[nH+]2)ncn1 ZINC000641665613 362587623 /nfs/dbraw/zinc/58/76/23/362587623.db2.gz WTJMWALZGMSCKN-UHFFFAOYSA-N 1 2 231.303 2.109 20 0 BEADLO CC(C)(Nc1ncncc1Cl)c1[nH]cc[nH+]1 ZINC000641664595 362589042 /nfs/dbraw/zinc/58/90/42/362589042.db2.gz JMDVFBJQZKAEJV-UHFFFAOYSA-N 1 2 237.694 2.200 20 0 BEADLO CC1(C)C[N@H+](Cc2ccon2)CCS1 ZINC000083417695 345506466 /nfs/dbraw/zinc/50/64/66/345506466.db2.gz GNTDLPXLROSBAL-UHFFFAOYSA-N 1 2 212.318 2.002 20 0 BEADLO CC1(C)C[N@@H+](Cc2ccon2)CCS1 ZINC000083417695 345506467 /nfs/dbraw/zinc/50/64/67/345506467.db2.gz GNTDLPXLROSBAL-UHFFFAOYSA-N 1 2 212.318 2.002 20 0 BEADLO COC(C)(C)CNc1[nH+]c(C)nc2[nH]ccc21 ZINC000081005596 345461176 /nfs/dbraw/zinc/46/11/76/345461176.db2.gz ZZMPWBFCLSDPTF-UHFFFAOYSA-N 1 2 234.303 2.103 20 0 BEADLO Cc1nc2[nH]ccc2c(NCC(C)(C)CCO)[nH+]1 ZINC000081019301 345461715 /nfs/dbraw/zinc/46/17/15/345461715.db2.gz ZOTQWXLLRPZNJF-UHFFFAOYSA-N 1 2 248.330 2.087 20 0 BEADLO C[C@@H](CNc1cc[nH+]c2ccncc12)C[C@H](C)O ZINC000085687902 345528901 /nfs/dbraw/zinc/52/89/01/345528901.db2.gz VXEGRXGYLCSOBS-MNOVXSKESA-N 1 2 245.326 2.449 20 0 BEADLO FC(F)C[NH2+]Cc1cccc(-n2cccn2)c1 ZINC000136598821 345529862 /nfs/dbraw/zinc/52/98/62/345529862.db2.gz WQOVTMWECLBPSV-UHFFFAOYSA-N 1 2 237.253 2.227 20 0 BEADLO Cc1cc2c(ncnc2-n2cc[nH+]c2)s1 ZINC000090067624 345564201 /nfs/dbraw/zinc/56/42/01/345564201.db2.gz JXWDATRGSPMLCW-UHFFFAOYSA-N 1 2 216.269 2.185 20 0 BEADLO CCC[C@@H](CNc1cc(CO)cc[nH+]1)OCC ZINC000641676109 362596927 /nfs/dbraw/zinc/59/69/27/362596927.db2.gz IYZWXCSWMVCKNJ-LBPRGKRZSA-N 1 2 238.331 2.191 20 0 BEADLO CC(C)[N@H+](Cc1ccon1)Cc1cccnc1 ZINC000093223934 345659059 /nfs/dbraw/zinc/65/90/59/345659059.db2.gz WBFBJLGUDRPVDK-UHFFFAOYSA-N 1 2 231.299 2.480 20 0 BEADLO CC(C)[N@@H+](Cc1ccon1)Cc1cccnc1 ZINC000093223934 345659062 /nfs/dbraw/zinc/65/90/62/345659062.db2.gz WBFBJLGUDRPVDK-UHFFFAOYSA-N 1 2 231.299 2.480 20 0 BEADLO COCc1cc(C[NH2+][C@H](C)c2cccnc2)no1 ZINC000641703640 362614690 /nfs/dbraw/zinc/61/46/90/362614690.db2.gz ZJQUOKIIJNZGRC-SNVBAGLBSA-N 1 2 247.298 2.067 20 0 BEADLO CCC[C@@H](C[NH2+][C@H](C)C(=O)OC(C)(C)C)OC ZINC000378829354 345640115 /nfs/dbraw/zinc/64/01/15/345640115.db2.gz QZSMCXIDLPMIAY-MNOVXSKESA-N 1 2 245.363 2.121 20 0 BEADLO CCc1ncc(C[N@H+](C)Cc2cnccn2)s1 ZINC000092590790 345640810 /nfs/dbraw/zinc/64/08/10/345640810.db2.gz QAOIFYMOODQJOA-UHFFFAOYSA-N 1 2 248.355 2.128 20 0 BEADLO CCc1ncc(C[N@@H+](C)Cc2cnccn2)s1 ZINC000092590790 345640813 /nfs/dbraw/zinc/64/08/13/345640813.db2.gz QAOIFYMOODQJOA-UHFFFAOYSA-N 1 2 248.355 2.128 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2ncn(-c3ccccc3)n2)C1 ZINC000092795535 345642814 /nfs/dbraw/zinc/64/28/14/345642814.db2.gz GVLYLTJQBFSUOS-GFCCVEGCSA-N 1 2 242.326 2.109 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2ncn(-c3ccccc3)n2)C1 ZINC000092795535 345642818 /nfs/dbraw/zinc/64/28/18/345642818.db2.gz GVLYLTJQBFSUOS-GFCCVEGCSA-N 1 2 242.326 2.109 20 0 BEADLO Fc1c[nH+]ccc1N1CCO[C@@H](C(F)F)CC1 ZINC000641681405 362602696 /nfs/dbraw/zinc/60/26/96/362602696.db2.gz GXVXAGGCZNUHST-SNVBAGLBSA-N 1 2 246.232 2.081 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)Cc1nc2ccccc2o1 ZINC000093339108 345653964 /nfs/dbraw/zinc/65/39/64/345653964.db2.gz VTGVCPZJRUHTFG-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)Cc1nc2ccccc2o1 ZINC000093339108 345653966 /nfs/dbraw/zinc/65/39/66/345653966.db2.gz VTGVCPZJRUHTFG-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO CSc1ccc(C[NH2+]Cc2cc[nH]n2)o1 ZINC000641719152 362634124 /nfs/dbraw/zinc/63/41/24/362634124.db2.gz FHBDLHRBYVYGMG-UHFFFAOYSA-N 1 2 223.301 2.014 20 0 BEADLO Cc1nc(NCC(C)C)nc(NCC(C)C)[nH+]1 ZINC000138066796 345693960 /nfs/dbraw/zinc/69/39/60/345693960.db2.gz NDZFVEJPBULNIJ-UHFFFAOYSA-N 1 2 237.351 2.316 20 0 BEADLO O[C@H](CNc1cccc[nH+]1)Cc1ccccc1 ZINC000144096835 345708182 /nfs/dbraw/zinc/70/81/82/345708182.db2.gz LLSVDYUMOIPLSZ-ZDUSSCGKSA-N 1 2 228.295 2.097 20 0 BEADLO Brc1cccc(Cn2cc[nH+]c2)n1 ZINC000307519568 345806725 /nfs/dbraw/zinc/80/67/25/345806725.db2.gz NLBPVALRMYDATD-UHFFFAOYSA-N 1 2 238.088 2.089 20 0 BEADLO Cc1ccc(F)cc1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000140787440 345823093 /nfs/dbraw/zinc/82/30/93/345823093.db2.gz SNBAHHOBZXRSRI-SECBINFHSA-N 1 2 247.273 2.348 20 0 BEADLO C[C@@H](NC(=O)CCc1ccccc1)c1[nH]cc[nH+]1 ZINC000140839325 345823836 /nfs/dbraw/zinc/82/38/36/345823836.db2.gz DTNPFHBFUOMYIV-LLVKDONJSA-N 1 2 243.310 2.220 20 0 BEADLO Cc1nc(NC[C@H]2CC23CC3)c2c([nH+]1)CCCC2 ZINC000418984386 192091013 /nfs/dbraw/zinc/09/10/13/192091013.db2.gz DCTXHGPHSWGRSE-LLVKDONJSA-N 1 2 243.354 2.298 20 0 BEADLO Cc1cc(C(=O)N[C@H](C)c2[nH]cc[nH+]2)ccc1F ZINC000139435578 345796843 /nfs/dbraw/zinc/79/68/43/345796843.db2.gz ULDBEOHNDSFTPT-SECBINFHSA-N 1 2 247.273 2.348 20 0 BEADLO Cc1cc(F)ccc1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000139442439 345796854 /nfs/dbraw/zinc/79/68/54/345796854.db2.gz MMELTCKULVQVJZ-SECBINFHSA-N 1 2 247.273 2.348 20 0 BEADLO CC[C@@H](Nc1ncnc2c1CCC2)c1[nH]cc[nH+]1 ZINC000139793425 345802155 /nfs/dbraw/zinc/80/21/55/345802155.db2.gz QCZIBQPLIIHZSM-SNVBAGLBSA-N 1 2 243.314 2.252 20 0 BEADLO CCCC[C@H](C)C(=O)NCCCn1cc[nH+]c1 ZINC000139874613 345803153 /nfs/dbraw/zinc/80/31/53/345803153.db2.gz ZJSHOYQGCGTHNZ-LBPRGKRZSA-N 1 2 237.347 2.216 20 0 BEADLO COC(=O)c1ccc(Nc2ccc(C)[nH+]c2)cn1 ZINC000140011773 345850445 /nfs/dbraw/zinc/85/04/45/345850445.db2.gz BSUKXMDAFYGGLS-UHFFFAOYSA-N 1 2 243.266 2.315 20 0 BEADLO Fc1ccc(COc2cc[nH+]cc2)nc1 ZINC000142049431 345855027 /nfs/dbraw/zinc/85/50/27/345855027.db2.gz AXLBIOMBHQVPHW-UHFFFAOYSA-N 1 2 204.204 2.195 20 0 BEADLO CC(C)C[C@@H](C(=O)NCCC1CC1)n1cc[nH+]c1 ZINC000635618458 345895274 /nfs/dbraw/zinc/89/52/74/345895274.db2.gz SZVPJTMIRUTXTO-ZDUSSCGKSA-N 1 2 249.358 2.387 20 0 BEADLO C[C@@H]1C[C@@H](Nc2cc[nH+]c3ccncc23)[C@H](C)O1 ZINC000631466434 345874329 /nfs/dbraw/zinc/87/43/29/345874329.db2.gz VXISTKQIGCSPLO-ISTVAULSSA-N 1 2 243.310 2.030 20 0 BEADLO Cc1nnc(C[N@H+]2Cc3ccccc3C[C@@H]2C)o1 ZINC000172907198 345880299 /nfs/dbraw/zinc/88/02/99/345880299.db2.gz MCPLXIZLSPNUSN-JTQLQIEISA-N 1 2 243.310 2.325 20 0 BEADLO Cc1nnc(C[N@@H+]2Cc3ccccc3C[C@@H]2C)o1 ZINC000172907198 345880302 /nfs/dbraw/zinc/88/03/02/345880302.db2.gz MCPLXIZLSPNUSN-JTQLQIEISA-N 1 2 243.310 2.325 20 0 BEADLO CC(C)N(C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C1CCC1 ZINC000635597448 345886395 /nfs/dbraw/zinc/88/63/95/345886395.db2.gz UCTVGODCTHJAHF-VXGBXAGGSA-N 1 2 247.342 2.303 20 0 BEADLO CC(C)N(C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C1CCC1 ZINC000635597448 345886400 /nfs/dbraw/zinc/88/64/00/345886400.db2.gz UCTVGODCTHJAHF-VXGBXAGGSA-N 1 2 247.342 2.303 20 0 BEADLO COc1cccc2c1CC[C@@H]2[NH2+]Cc1cocn1 ZINC000182078110 345933021 /nfs/dbraw/zinc/93/30/21/345933021.db2.gz REWWDDDOHUWKAN-ZDUSSCGKSA-N 1 2 244.294 2.460 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CC[C@@](C)(CC)C2)[nH+]1 ZINC000635683524 345976559 /nfs/dbraw/zinc/97/65/59/345976559.db2.gz ULQJPSBSMAFDHE-CQSZACIVSA-N 1 2 249.358 2.163 20 0 BEADLO Cc1nc(N2C[C@H](C)[C@@H](C)[C@H]2C)cc[nH+]1 ZINC000419022695 192094645 /nfs/dbraw/zinc/09/46/45/192094645.db2.gz VKAKRNXGDPFXHX-IVZWLZJFSA-N 1 2 205.305 2.266 20 0 BEADLO CCc1c[nH]c(CC(=O)NCCC2=CCCC2)[nH+]1 ZINC000635729701 346041667 /nfs/dbraw/zinc/04/16/67/346041667.db2.gz SMOOTKRXRJMLBL-UHFFFAOYSA-N 1 2 247.342 2.131 20 0 BEADLO CC[C@@H]1[C@@H](C)CCN1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635815436 346071490 /nfs/dbraw/zinc/07/14/90/346071490.db2.gz AYXMIFWIITTZNV-SBFPOUOMSA-N 1 2 247.342 2.160 20 0 BEADLO CC[C@@H]1[C@@H](C)CCN1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635815436 346071494 /nfs/dbraw/zinc/07/14/94/346071494.db2.gz AYXMIFWIITTZNV-SBFPOUOMSA-N 1 2 247.342 2.160 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CCCC[C@H](C)C2)[nH+]1 ZINC000635814927 346071566 /nfs/dbraw/zinc/07/15/66/346071566.db2.gz WMQLBEWBMXRLMS-NSHDSACASA-N 1 2 249.358 2.163 20 0 BEADLO CC[C@@H]1C[C@H]1NC(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC000635889137 346099076 /nfs/dbraw/zinc/09/90/76/346099076.db2.gz JHXHWNSWOFWSMJ-UPJWGTAASA-N 1 2 249.358 2.385 20 0 BEADLO C[C@@H]1CC[C@@H](CNC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635882261 346100973 /nfs/dbraw/zinc/10/09/73/346100973.db2.gz VRGSXBNRMUONFI-DDHJBXDOSA-N 1 2 247.342 2.066 20 0 BEADLO C[C@@H]1CC[C@@H](CNC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635882261 346100977 /nfs/dbraw/zinc/10/09/77/346100977.db2.gz VRGSXBNRMUONFI-DDHJBXDOSA-N 1 2 247.342 2.066 20 0 BEADLO CC(C)C[C@H](C(=O)N1C[C@@H](C)[C@H]1C)n1cc[nH+]c1 ZINC000635966531 346125865 /nfs/dbraw/zinc/12/58/65/346125865.db2.gz QYPICUVDMXHHSS-JHJVBQTASA-N 1 2 249.358 2.337 20 0 BEADLO CC[C@H]1CCN1C(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC000635958289 346132246 /nfs/dbraw/zinc/13/22/46/346132246.db2.gz WFAFDFCMZULVOS-QWHCGFSZSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)[C@@H](C)[C@H]1C ZINC000636033470 346169054 /nfs/dbraw/zinc/16/90/54/346169054.db2.gz BQXAAQPCEFRWLO-YBXAARCKSA-N 1 2 247.342 2.016 20 0 BEADLO C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)[C@@H](C)[C@H]1C ZINC000636033470 346169055 /nfs/dbraw/zinc/16/90/55/346169055.db2.gz BQXAAQPCEFRWLO-YBXAARCKSA-N 1 2 247.342 2.016 20 0 BEADLO CCCCc1cc(N[C@@](C)(CC)CO)nc[nH+]1 ZINC000631152162 346172661 /nfs/dbraw/zinc/17/26/61/346172661.db2.gz NEQXDHUQDIXEKQ-ZDUSSCGKSA-N 1 2 237.347 2.392 20 0 BEADLO CCc1c[nH]c(CC(=O)NC2(CC)CCCC2)[nH+]1 ZINC000635979832 346145486 /nfs/dbraw/zinc/14/54/86/346145486.db2.gz HGGVWACHPXMERU-UHFFFAOYSA-N 1 2 249.358 2.354 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636017128 346156505 /nfs/dbraw/zinc/15/65/05/346156505.db2.gz JGYACRYEJLKURX-DDHJBXDOSA-N 1 2 247.342 2.064 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636017128 346156509 /nfs/dbraw/zinc/15/65/09/346156509.db2.gz JGYACRYEJLKURX-DDHJBXDOSA-N 1 2 247.342 2.064 20 0 BEADLO CN(C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C1CC(C)(C)C1 ZINC000636018384 346157429 /nfs/dbraw/zinc/15/74/29/346157429.db2.gz AYOXMPFKMWMBMA-GHMZBOCLSA-N 1 2 247.342 2.160 20 0 BEADLO CN(C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C1CC(C)(C)C1 ZINC000636018384 346157431 /nfs/dbraw/zinc/15/74/31/346157431.db2.gz AYOXMPFKMWMBMA-GHMZBOCLSA-N 1 2 247.342 2.160 20 0 BEADLO COc1ccccc1COCc1[nH]cc[nH+]1 ZINC000679009979 488302868 /nfs/dbraw/zinc/30/28/68/488302868.db2.gz RUSRCFZMGJKYOA-UHFFFAOYSA-N 1 2 218.256 2.135 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC[C@@H](OCC3CC3)C2)n1 ZINC000628241117 346203833 /nfs/dbraw/zinc/20/38/33/346203833.db2.gz JCEHBPBOAOEZQI-CYBMUJFWSA-N 1 2 249.358 2.109 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC[C@@H](OCC3CC3)C2)n1 ZINC000628241117 346203834 /nfs/dbraw/zinc/20/38/34/346203834.db2.gz JCEHBPBOAOEZQI-CYBMUJFWSA-N 1 2 249.358 2.109 20 0 BEADLO Cc1cc(C(=O)NC[C@H]2C[C@@H]2C)c2[nH+]ccn2c1 ZINC000624108355 346207790 /nfs/dbraw/zinc/20/77/90/346207790.db2.gz RIJTWLGRYBELPQ-WDEREUQCSA-N 1 2 243.310 2.029 20 0 BEADLO CCCC[C@@H](CCC)NC(=O)Cn1cc[nH+]c1 ZINC000569777451 346215538 /nfs/dbraw/zinc/21/55/38/346215538.db2.gz HDJJNOIBZZCTJF-GFCCVEGCSA-N 1 2 237.347 2.358 20 0 BEADLO Cc1[nH]c(CN2CC[C@H](C)[C@@H](F)C2)[nH+]c1C ZINC000628234831 346188157 /nfs/dbraw/zinc/18/81/57/346188157.db2.gz OLHFTTZEXFQPAJ-KWQFWETISA-N 1 2 225.311 2.206 20 0 BEADLO Cc1c[nH]c(CN2CCOc3ccccc32)[nH+]1 ZINC000628235943 346189559 /nfs/dbraw/zinc/18/95/59/346189559.db2.gz JRCKJHKAVMRVLI-UHFFFAOYSA-N 1 2 229.283 2.117 20 0 BEADLO Cc1[nH]c(CN2CCOc3ccccc32)[nH+]c1C ZINC000628235811 346189745 /nfs/dbraw/zinc/18/97/45/346189745.db2.gz CLUYJVIQTOIHKT-UHFFFAOYSA-N 1 2 243.310 2.426 20 0 BEADLO Cc1c[nH]c(C[N@@H+](C)[C@@H](C)c2ccncc2)n1 ZINC000628237188 346193509 /nfs/dbraw/zinc/19/35/09/346193509.db2.gz DWXDZOXLDUBXPF-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO Cc1c[nH]c(C[N@H+](C)[C@@H](C)c2ccncc2)n1 ZINC000628237188 346193511 /nfs/dbraw/zinc/19/35/11/346193511.db2.gz DWXDZOXLDUBXPF-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO Cc1c[nH]c(CN(C)[C@@H](C)c2ccncc2)[nH+]1 ZINC000628237188 346193513 /nfs/dbraw/zinc/19/35/13/346193513.db2.gz DWXDZOXLDUBXPF-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO CCCCc1cc(N[C@H]2CO[C@H](C)C2)nc[nH+]1 ZINC000631331515 346261049 /nfs/dbraw/zinc/26/10/49/346261049.db2.gz WFZQVAQKSBVCOP-ZYHUDNBSSA-N 1 2 235.331 2.409 20 0 BEADLO CC(C)Cn1ncnc1C[N@@H+]1C[C@H]2CCCC[C@H]21 ZINC000368693973 187316808 /nfs/dbraw/zinc/31/68/08/187316808.db2.gz WCACESGBKGQWDY-CHWSQXEVSA-N 1 2 248.374 2.309 20 0 BEADLO CC(C)Cn1ncnc1C[N@H+]1C[C@H]2CCCC[C@H]21 ZINC000368693973 187316810 /nfs/dbraw/zinc/31/68/10/187316810.db2.gz WCACESGBKGQWDY-CHWSQXEVSA-N 1 2 248.374 2.309 20 0 BEADLO Cc1noc([C@H]2CCC[N@H+]2Cc2cnc(C)o2)n1 ZINC000628276015 346284421 /nfs/dbraw/zinc/28/44/21/346284421.db2.gz NSMIFMSJRQDQLB-LLVKDONJSA-N 1 2 248.286 2.012 20 0 BEADLO Cc1noc([C@H]2CCC[N@@H+]2Cc2cnc(C)o2)n1 ZINC000628276015 346284424 /nfs/dbraw/zinc/28/44/24/346284424.db2.gz NSMIFMSJRQDQLB-LLVKDONJSA-N 1 2 248.286 2.012 20 0 BEADLO Cc1c[nH]c(CN2CCc3cc(F)ccc32)[nH+]1 ZINC000628264241 346263571 /nfs/dbraw/zinc/26/35/71/346263571.db2.gz FVDSPBUGHMEOHI-UHFFFAOYSA-N 1 2 231.274 2.420 20 0 BEADLO C/C=C\C[C@@H]1CCC[N@H+](CCc2cnn[nH]2)C1 ZINC000626164609 346271195 /nfs/dbraw/zinc/27/11/95/346271195.db2.gz LTIWNTKHJUZUSF-ZZKXABKFSA-N 1 2 234.347 2.025 20 0 BEADLO C/C=C\C[C@@H]1CCC[N@@H+](CCc2cnn[nH]2)C1 ZINC000626164609 346271199 /nfs/dbraw/zinc/27/11/99/346271199.db2.gz LTIWNTKHJUZUSF-ZZKXABKFSA-N 1 2 234.347 2.025 20 0 BEADLO CCCCc1cc(NCC[C@H](C)OC)nc[nH+]1 ZINC000631094808 346286274 /nfs/dbraw/zinc/28/62/74/346286274.db2.gz MCHMAJATCRWFIN-NSHDSACASA-N 1 2 237.347 2.078 20 0 BEADLO Cc1c[nH]c(CN2CCc3cccc(F)c32)[nH+]1 ZINC000628281266 346292924 /nfs/dbraw/zinc/29/29/24/346292924.db2.gz LDFQJQATOOIQQR-UHFFFAOYSA-N 1 2 231.274 2.420 20 0 BEADLO CCc1ncc(CNc2cc(CO)cc[nH+]2)s1 ZINC000641762645 362694395 /nfs/dbraw/zinc/69/43/95/362694395.db2.gz QARRRLHBRWGTMC-UHFFFAOYSA-N 1 2 249.339 2.205 20 0 BEADLO Cc1ncc(C[NH2+]Cc2ccc3c(n2)CCC3)o1 ZINC000641761557 362685708 /nfs/dbraw/zinc/68/57/08/362685708.db2.gz WGOIYGORZBPBMN-UHFFFAOYSA-N 1 2 243.310 2.157 20 0 BEADLO CC[C@](C)(NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C1CC1 ZINC000636203787 346352324 /nfs/dbraw/zinc/35/23/24/346352324.db2.gz DDYUOPAYALCTQY-GYSYKLTISA-N 1 2 247.342 2.208 20 0 BEADLO CC[C@](C)(NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C1CC1 ZINC000636203787 346352327 /nfs/dbraw/zinc/35/23/27/346352327.db2.gz DDYUOPAYALCTQY-GYSYKLTISA-N 1 2 247.342 2.208 20 0 BEADLO Cc1ccc(C[NH2+]Cc2nccn2C(C)C)nc1 ZINC000641764722 362695580 /nfs/dbraw/zinc/69/55/80/362695580.db2.gz KZRWJFBUENDDPZ-UHFFFAOYSA-N 1 2 244.342 2.457 20 0 BEADLO O=C(NCCCC1CCC1)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636202551 346352917 /nfs/dbraw/zinc/35/29/17/346352917.db2.gz PRAQJTAZMMMJPR-VXGBXAGGSA-N 1 2 247.342 2.210 20 0 BEADLO O=C(NCCCC1CCC1)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636202551 346352918 /nfs/dbraw/zinc/35/29/18/346352918.db2.gz PRAQJTAZMMMJPR-VXGBXAGGSA-N 1 2 247.342 2.210 20 0 BEADLO CC(C)(C)C(F)(F)C[NH2+]Cc1ccncc1N ZINC000641771742 362710417 /nfs/dbraw/zinc/71/04/17/362710417.db2.gz CCYUCZXXSUGEET-UHFFFAOYSA-N 1 2 243.301 2.435 20 0 BEADLO Cc1cccc(CCC[N@@H+](C)Cc2nnc[nH]2)c1 ZINC000181141455 179054304 /nfs/dbraw/zinc/05/43/04/179054304.db2.gz JHEIEUQJEWJKDX-UHFFFAOYSA-N 1 2 244.342 2.178 20 0 BEADLO Cc1cccc(CCC[N@H+](C)Cc2nnc[nH]2)c1 ZINC000181141455 179054307 /nfs/dbraw/zinc/05/43/07/179054307.db2.gz JHEIEUQJEWJKDX-UHFFFAOYSA-N 1 2 244.342 2.178 20 0 BEADLO CC(C)CC1(NC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)CC1 ZINC000636242611 346366617 /nfs/dbraw/zinc/36/66/17/346366617.db2.gz RJVRGJMUOURUMQ-GHMZBOCLSA-N 1 2 247.342 2.208 20 0 BEADLO CC(C)CC1(NC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)CC1 ZINC000636242611 346366621 /nfs/dbraw/zinc/36/66/21/346366621.db2.gz RJVRGJMUOURUMQ-GHMZBOCLSA-N 1 2 247.342 2.208 20 0 BEADLO CC[C@@H](C)CCNC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636170897 346344223 /nfs/dbraw/zinc/34/42/23/346344223.db2.gz VEMHREGXBGPCNF-GMTAPVOTSA-N 1 2 235.331 2.066 20 0 BEADLO CC[C@@H](C)CCNC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636170897 346344226 /nfs/dbraw/zinc/34/42/26/346344226.db2.gz VEMHREGXBGPCNF-GMTAPVOTSA-N 1 2 235.331 2.066 20 0 BEADLO CCC[C@@H]([NH2+]CC[C@H](C)F)C(=O)OCC ZINC000419166031 192101482 /nfs/dbraw/zinc/10/14/82/192101482.db2.gz BBPCJWMIKACWME-VHSXEESVSA-N 1 2 219.300 2.056 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[NH2+]CC[C@@H](C)F ZINC000419172364 192101210 /nfs/dbraw/zinc/10/12/10/192101210.db2.gz JWUXZZGTXAAVKH-MNOVXSKESA-N 1 2 233.327 2.302 20 0 BEADLO C[C@@H]1CC[N@H+](CCOCC(F)(F)F)C[C@@H]1F ZINC000679217484 488317345 /nfs/dbraw/zinc/31/73/45/488317345.db2.gz GBIOBCNKBHBZAX-BDAKNGLRSA-N 1 2 243.244 2.245 20 0 BEADLO C[C@@H]1CC[N@@H+](CCOCC(F)(F)F)C[C@@H]1F ZINC000679217484 488317346 /nfs/dbraw/zinc/31/73/46/488317346.db2.gz GBIOBCNKBHBZAX-BDAKNGLRSA-N 1 2 243.244 2.245 20 0 BEADLO Cc1ccc2[nH]c(=[NH+]CC3(F)CC3)[nH]c2c1 ZINC000641793731 362737071 /nfs/dbraw/zinc/73/70/71/362737071.db2.gz FOQNKYXGYYDOEX-UHFFFAOYSA-N 1 2 219.263 2.207 20 0 BEADLO Cc1ccc2[nH]c(=[NH+]C[C@H]3CCSC3)[nH]c2c1 ZINC000641795290 362737110 /nfs/dbraw/zinc/73/71/10/362737110.db2.gz WMIBTKLULMEMIX-SNVBAGLBSA-N 1 2 247.367 2.458 20 0 BEADLO Cc1cccc(C[NH2+]Cc2csnn2)c1 ZINC000036902059 179095756 /nfs/dbraw/zinc/09/57/56/179095756.db2.gz VAYZREUVMMZSFY-UHFFFAOYSA-N 1 2 219.313 2.136 20 0 BEADLO CCOC(=O)C[N@@H+]1CCc2c(C)cc(C)cc2C1 ZINC000186703159 346528300 /nfs/dbraw/zinc/52/83/00/346528300.db2.gz MYSQQIUZOOHTGJ-UHFFFAOYSA-N 1 2 247.338 2.225 20 0 BEADLO CCOC(=O)C[N@H+]1CCc2c(C)cc(C)cc2C1 ZINC000186703159 346528305 /nfs/dbraw/zinc/52/83/05/346528305.db2.gz MYSQQIUZOOHTGJ-UHFFFAOYSA-N 1 2 247.338 2.225 20 0 BEADLO C[N@H+](Cc1nc(Cc2ccccc2)no1)C1CC1 ZINC000047921772 346533406 /nfs/dbraw/zinc/53/34/06/346533406.db2.gz WHWXUNNCWWDABW-UHFFFAOYSA-N 1 2 243.310 2.255 20 0 BEADLO C[N@@H+](Cc1nc(Cc2ccccc2)no1)C1CC1 ZINC000047921772 346533409 /nfs/dbraw/zinc/53/34/09/346533409.db2.gz WHWXUNNCWWDABW-UHFFFAOYSA-N 1 2 243.310 2.255 20 0 BEADLO CC(C)N(C)C(=O)C[N@@H+]1Cc2ccccc2[C@H]1C ZINC000336535241 187369787 /nfs/dbraw/zinc/36/97/87/187369787.db2.gz GMSDSGAGEUMQBG-GFCCVEGCSA-N 1 2 246.354 2.430 20 0 BEADLO CC(C)N(C)C(=O)C[N@H+]1Cc2ccccc2[C@H]1C ZINC000336535241 187369788 /nfs/dbraw/zinc/36/97/88/187369788.db2.gz GMSDSGAGEUMQBG-GFCCVEGCSA-N 1 2 246.354 2.430 20 0 BEADLO CCc1nc(CNc2cc[nH+]c(C)n2)cs1 ZINC000301395806 346583992 /nfs/dbraw/zinc/58/39/92/346583992.db2.gz MABHTWPEYQIGPG-UHFFFAOYSA-N 1 2 234.328 2.416 20 0 BEADLO CSC1CCN(c2cccc[nH+]2)CC1 ZINC000601207872 346673525 /nfs/dbraw/zinc/67/35/25/346673525.db2.gz RJAXONGKIGSLOB-UHFFFAOYSA-N 1 2 208.330 2.413 20 0 BEADLO CCCN(CC)c1nc(N)c2ccccc2[nH+]1 ZINC000577152422 365839781 /nfs/dbraw/zinc/83/97/81/365839781.db2.gz DJKTUSKFKAKEKH-UHFFFAOYSA-N 1 2 230.315 2.279 20 0 BEADLO Cc1cccc(C[N@@H+]2CCC(=O)CC23CCC3)n1 ZINC000518790780 259392377 /nfs/dbraw/zinc/39/23/77/259392377.db2.gz MZCMCCSFHJIWCK-UHFFFAOYSA-N 1 2 244.338 2.478 20 0 BEADLO Cc1cccc(C[N@H+]2CCC(=O)CC23CCC3)n1 ZINC000518790780 259392378 /nfs/dbraw/zinc/39/23/78/259392378.db2.gz MZCMCCSFHJIWCK-UHFFFAOYSA-N 1 2 244.338 2.478 20 0 BEADLO Cc1ccc(F)cc1NC(=O)Cc1c[nH+]cn1C ZINC000188046552 346711190 /nfs/dbraw/zinc/71/11/90/346711190.db2.gz LMEFHYDZQNJXMP-UHFFFAOYSA-N 1 2 247.273 2.049 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2nc(N)sc2c1 ZINC000167664412 346714665 /nfs/dbraw/zinc/71/46/65/346714665.db2.gz PMXNHGGNYYBBNZ-UHFFFAOYSA-N 1 2 230.296 2.279 20 0 BEADLO CC(C)CCC(=O)N1CC(Oc2cc[nH+]cc2)C1 ZINC000590006239 346763210 /nfs/dbraw/zinc/76/32/10/346763210.db2.gz CTAFNBMDVYSXDT-UHFFFAOYSA-N 1 2 248.326 2.107 20 0 BEADLO CCCNC(=O)CCn1c(C)[nH+]c2ccccc21 ZINC000163844970 535054295 /nfs/dbraw/zinc/05/42/95/535054295.db2.gz IJRRQWNUUNVEPY-UHFFFAOYSA-N 1 2 245.326 2.261 20 0 BEADLO C[C@H](CC(=O)Nc1cncc(F)c1)n1cc[nH+]c1 ZINC000577182398 365863532 /nfs/dbraw/zinc/86/35/32/365863532.db2.gz XBWZZMXRKKDSHI-SECBINFHSA-N 1 2 248.261 2.007 20 0 BEADLO Cc1[nH]c(CN[C@H](C)C(C)(F)F)[nH+]c1C ZINC000571106525 323135776 /nfs/dbraw/zinc/13/57/76/323135776.db2.gz JEYAHUAOLXESBX-MRVPVSSYSA-N 1 2 217.263 2.160 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](C)c2ccnn2C)s1 ZINC000192905212 365877357 /nfs/dbraw/zinc/87/73/57/365877357.db2.gz WQIQMZOJGNCYHU-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000387929509 347129837 /nfs/dbraw/zinc/12/98/37/347129837.db2.gz VYPFKIOBYQQMMJ-GHMZBOCLSA-N 1 2 235.331 2.050 20 0 BEADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1cnc[nH]1 ZINC000188240237 347275772 /nfs/dbraw/zinc/27/57/72/347275772.db2.gz ZLHVPTHCLABRJC-ZDUSSCGKSA-N 1 2 230.315 2.388 20 0 BEADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1cnc[nH]1 ZINC000188240237 347275773 /nfs/dbraw/zinc/27/57/73/347275773.db2.gz ZLHVPTHCLABRJC-ZDUSSCGKSA-N 1 2 230.315 2.388 20 0 BEADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1c[nH]cn1 ZINC000188240237 347275775 /nfs/dbraw/zinc/27/57/75/347275775.db2.gz ZLHVPTHCLABRJC-ZDUSSCGKSA-N 1 2 230.315 2.388 20 0 BEADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1c[nH]cn1 ZINC000188240237 347275776 /nfs/dbraw/zinc/27/57/76/347275776.db2.gz ZLHVPTHCLABRJC-ZDUSSCGKSA-N 1 2 230.315 2.388 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2cnc(C3CC3)o2)C1 ZINC000628298947 347340325 /nfs/dbraw/zinc/34/03/25/347340325.db2.gz XNMQJJGOUSMTNB-SECBINFHSA-N 1 2 210.252 2.096 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2cnc(C3CC3)o2)C1 ZINC000628298947 347340328 /nfs/dbraw/zinc/34/03/28/347340328.db2.gz XNMQJJGOUSMTNB-SECBINFHSA-N 1 2 210.252 2.096 20 0 BEADLO F[C@H]1CC[N@H+](Cc2cnc(C3CC3)o2)C1 ZINC000628298948 347340506 /nfs/dbraw/zinc/34/05/06/347340506.db2.gz XNMQJJGOUSMTNB-VIFPVBQESA-N 1 2 210.252 2.096 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2cnc(C3CC3)o2)C1 ZINC000628298948 347340510 /nfs/dbraw/zinc/34/05/10/347340510.db2.gz XNMQJJGOUSMTNB-VIFPVBQESA-N 1 2 210.252 2.096 20 0 BEADLO CCN(CCC1CC1)C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000581262420 347372267 /nfs/dbraw/zinc/37/22/67/347372267.db2.gz ONMHNBFOOOTBDI-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO CCN(CCC1CC1)C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000581262420 347372271 /nfs/dbraw/zinc/37/22/71/347372271.db2.gz ONMHNBFOOOTBDI-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO CC1(C)CCC[C@@H]1NC(=O)CCc1c[nH+]c[nH]1 ZINC000193458995 347397564 /nfs/dbraw/zinc/39/75/64/347397564.db2.gz ROTJRYYKUAKZRZ-NSHDSACASA-N 1 2 235.331 2.037 20 0 BEADLO CC1(C)CCC[C@@H]1NC(=O)CCc1c[nH]c[nH+]1 ZINC000193458995 347397567 /nfs/dbraw/zinc/39/75/67/347397567.db2.gz ROTJRYYKUAKZRZ-NSHDSACASA-N 1 2 235.331 2.037 20 0 BEADLO CC(=O)c1ccc(NCc2c[nH+]cn2C)cc1 ZINC000388428505 347399578 /nfs/dbraw/zinc/39/95/78/347399578.db2.gz LVBYRVZXPBKXNM-UHFFFAOYSA-N 1 2 229.283 2.235 20 0 BEADLO C[C@H]1CC=C(C(=O)N(C)Cc2c[nH+]c[nH]2)CC1 ZINC000616921783 347451446 /nfs/dbraw/zinc/45/14/46/347451446.db2.gz CCMKTHFVZNGKKM-JTQLQIEISA-N 1 2 233.315 2.115 20 0 BEADLO C[C@H]1CC=C(C(=O)N(C)Cc2c[nH]c[nH+]2)CC1 ZINC000616921783 347451448 /nfs/dbraw/zinc/45/14/48/347451448.db2.gz CCMKTHFVZNGKKM-JTQLQIEISA-N 1 2 233.315 2.115 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)CCc1ccccc1 ZINC000616921828 347451534 /nfs/dbraw/zinc/45/15/34/347451534.db2.gz DZJVTPVAADXGMO-UHFFFAOYSA-N 1 2 243.310 2.001 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)CCc1ccccc1 ZINC000616921828 347451537 /nfs/dbraw/zinc/45/15/37/347451537.db2.gz DZJVTPVAADXGMO-UHFFFAOYSA-N 1 2 243.310 2.001 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)[C@]1(C)CC=CCC1 ZINC000616922318 347452746 /nfs/dbraw/zinc/45/27/46/347452746.db2.gz XVPOYSAOGGHAHB-CYBMUJFWSA-N 1 2 233.315 2.115 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)[C@]1(C)CC=CCC1 ZINC000616922318 347452748 /nfs/dbraw/zinc/45/27/48/347452748.db2.gz XVPOYSAOGGHAHB-CYBMUJFWSA-N 1 2 233.315 2.115 20 0 BEADLO Cc1cccc2[nH+]c(CNC(=O)CC(C)C)cn21 ZINC000068570059 179229551 /nfs/dbraw/zinc/22/95/51/179229551.db2.gz PPFMZUBHZYMLPR-UHFFFAOYSA-N 1 2 245.326 2.305 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H]1CCCc2ccccc2C1 ZINC000590652341 347485466 /nfs/dbraw/zinc/48/54/66/347485466.db2.gz VFCDNQFHMRWVGR-SMDDNHRTSA-N 1 2 247.338 2.085 20 0 BEADLO C[C@@H]1CCC[C@]1(C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616928694 347495165 /nfs/dbraw/zinc/49/51/65/347495165.db2.gz JEQXZEAIIFMCNJ-MFKMUULPSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@@H]1CCC[C@]1(C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616928694 347495169 /nfs/dbraw/zinc/49/51/69/347495169.db2.gz JEQXZEAIIFMCNJ-MFKMUULPSA-N 1 2 235.331 2.194 20 0 BEADLO CCC(CC)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000590730357 347497560 /nfs/dbraw/zinc/49/75/60/347497560.db2.gz URZMXNYZHDTZNN-ZDUSSCGKSA-N 1 2 249.358 2.483 20 0 BEADLO C[C@H]1CCC[C@@H]1CC(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616927404 347459464 /nfs/dbraw/zinc/45/94/64/347459464.db2.gz IFFCTFKUGGATRA-WDEREUQCSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@H]1CCC[C@@H]1CC(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616927404 347459466 /nfs/dbraw/zinc/45/94/66/347459466.db2.gz IFFCTFKUGGATRA-WDEREUQCSA-N 1 2 235.331 2.194 20 0 BEADLO CCCCN(CCCC)c1nc(C)[nH+]c(N)n1 ZINC000149845259 347534256 /nfs/dbraw/zinc/53/42/56/347534256.db2.gz OAJYMHKCOKRPHW-UHFFFAOYSA-N 1 2 237.351 2.169 20 0 BEADLO CCCCN(CCCC)c1nc(N)nc(C)[nH+]1 ZINC000149845259 347534259 /nfs/dbraw/zinc/53/42/59/347534259.db2.gz OAJYMHKCOKRPHW-UHFFFAOYSA-N 1 2 237.351 2.169 20 0 BEADLO Cc1ccc(NC(=O)Nc2cn[nH]c2)c(C)[nH+]1 ZINC000176754880 365899609 /nfs/dbraw/zinc/89/96/09/365899609.db2.gz VYPLOFUGFOWLHX-UHFFFAOYSA-N 1 2 231.259 2.066 20 0 BEADLO CC(C)(C)CNC(=O)Cc1cn2ccccc2[nH+]1 ZINC000194272538 259396784 /nfs/dbraw/zinc/39/67/84/259396784.db2.gz WQTACNGQWZCUQB-UHFFFAOYSA-N 1 2 245.326 2.039 20 0 BEADLO Cc1nonc1C[N@@H+](C)Cc1ccccc1C ZINC000265022224 179269422 /nfs/dbraw/zinc/26/94/22/179269422.db2.gz JBQQRTIJUVUKRH-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1nonc1C[N@H+](C)Cc1ccccc1C ZINC000265022224 179269424 /nfs/dbraw/zinc/26/94/24/179269424.db2.gz JBQQRTIJUVUKRH-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO COCC1(CC[NH+]=c2[nH]c3ccccc3[nH]2)CC1 ZINC000577276723 365913445 /nfs/dbraw/zinc/91/34/45/365913445.db2.gz AICWAWMBPWEKES-UHFFFAOYSA-N 1 2 245.326 2.213 20 0 BEADLO Cc1ccccc1C[C@@H](C)[NH2+]CC(F)(F)CO ZINC000184696837 179288954 /nfs/dbraw/zinc/28/89/54/179288954.db2.gz KPMPQQCAZQMNFY-LLVKDONJSA-N 1 2 243.297 2.143 20 0 BEADLO CC[N@H+](CCSC)Cc1noc(C(C)C)n1 ZINC000592201215 347753173 /nfs/dbraw/zinc/75/31/73/347753173.db2.gz DHGKNUAKMOCUGL-UHFFFAOYSA-N 1 2 243.376 2.378 20 0 BEADLO CC[N@@H+](CCSC)Cc1noc(C(C)C)n1 ZINC000592201215 347753176 /nfs/dbraw/zinc/75/31/76/347753176.db2.gz DHGKNUAKMOCUGL-UHFFFAOYSA-N 1 2 243.376 2.378 20 0 BEADLO CC[C@H](C)C[C@H]([NH2+][C@H]1CCSC1)C(=O)OC ZINC000592517604 347794314 /nfs/dbraw/zinc/79/43/14/347794314.db2.gz WOVSNKWDSMWAOY-DCAQKATOSA-N 1 2 245.388 2.059 20 0 BEADLO Cc1ccccc1C[S@@](=O)Cc1[nH+]ccn1C ZINC000129256863 179291676 /nfs/dbraw/zinc/29/16/76/179291676.db2.gz NBAUJXJAFBBOBJ-KRWDZBQOSA-N 1 2 248.351 2.177 20 0 BEADLO Cc1ccccc1OCC[N@@H+](C)Cc1cnc[nH]1 ZINC000179771579 179311332 /nfs/dbraw/zinc/31/13/32/179311332.db2.gz QDCUEDXDQGKQSP-UHFFFAOYSA-N 1 2 245.326 2.229 20 0 BEADLO Cc1ccccc1OCC[N@H+](C)Cc1cnc[nH]1 ZINC000179771579 179311334 /nfs/dbraw/zinc/31/13/34/179311334.db2.gz QDCUEDXDQGKQSP-UHFFFAOYSA-N 1 2 245.326 2.229 20 0 BEADLO CCSCCNc1cc(COC)cc[nH+]1 ZINC000593697777 347929731 /nfs/dbraw/zinc/92/97/31/347929731.db2.gz MLYBLCUCTYWPEJ-UHFFFAOYSA-N 1 2 226.345 2.393 20 0 BEADLO Cc1ccccc1[C@@H](C)[N@@H+]1CCn2cnnc2C1 ZINC000137158118 179317329 /nfs/dbraw/zinc/31/73/29/179317329.db2.gz SYIRSMILFUDRAA-GFCCVEGCSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1ccccc1[C@@H](C)[N@H+]1CCn2cnnc2C1 ZINC000137158118 179317330 /nfs/dbraw/zinc/31/73/30/179317330.db2.gz SYIRSMILFUDRAA-GFCCVEGCSA-N 1 2 242.326 2.163 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1cccc2c1CCC2 ZINC000593621905 347916850 /nfs/dbraw/zinc/91/68/50/347916850.db2.gz NTTIRHHEJUCUST-NSHDSACASA-N 1 2 247.338 2.169 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1cccc2c1CCC2 ZINC000593621905 347916854 /nfs/dbraw/zinc/91/68/54/347916854.db2.gz NTTIRHHEJUCUST-NSHDSACASA-N 1 2 247.338 2.169 20 0 BEADLO CC[C@H]([NH2+][C@@H]1CC[C@@H]1c1ccccc1)C(=O)OC ZINC000594716640 348106281 /nfs/dbraw/zinc/10/62/81/348106281.db2.gz CYZQDDPEDZZRKS-HZSPNIEDSA-N 1 2 247.338 2.474 20 0 BEADLO CCC[C@H]([NH2+]CCc1ccoc1)C(=O)OCC ZINC000594724703 348108089 /nfs/dbraw/zinc/10/80/89/348108089.db2.gz GGRGBGTXGFNMFE-LBPRGKRZSA-N 1 2 239.315 2.144 20 0 BEADLO CC[C@H]([NH2+]CCc1ccc(C)c(C)c1)C(=O)OC ZINC000594725005 348108480 /nfs/dbraw/zinc/10/84/80/348108480.db2.gz HZSGTJGSSIPNNP-AWEZNQCLSA-N 1 2 249.354 2.387 20 0 BEADLO CCC[C@@H]([NH2+]C[C@]1(C)CC1(F)F)C(=O)OCC ZINC000594733251 348109217 /nfs/dbraw/zinc/10/92/17/348109217.db2.gz ZZONNCMNCWMODG-KOLCDFICSA-N 1 2 249.301 2.353 20 0 BEADLO Cc1cccn2cc(CNC(=O)C(C)(C)F)[nH+]c12 ZINC000156361521 179357429 /nfs/dbraw/zinc/35/74/29/179357429.db2.gz HLFBYUJQXYXIFB-UHFFFAOYSA-N 1 2 249.289 2.007 20 0 BEADLO CC(C)OC(=O)[C@H](C)[NH2+][C@@H]1CC[C@@H](C)SC1 ZINC000594609967 348082315 /nfs/dbraw/zinc/08/23/15/348082315.db2.gz PFUVDEOONJDVJJ-OUAUKWLOSA-N 1 2 245.388 2.200 20 0 BEADLO CCc1cc[nH+]cc1N[C@H](C)[C@H]1C[C@H]1C(=O)OC ZINC000594948052 348146779 /nfs/dbraw/zinc/14/67/79/348146779.db2.gz JZYFOCHOCITUQF-YUSALJHKSA-N 1 2 248.326 2.254 20 0 BEADLO COC(=O)[C@@H]1C[C@@H]1[C@@H](C)Nc1ccc(C)[nH+]c1C ZINC000594949461 348147348 /nfs/dbraw/zinc/14/73/48/348147348.db2.gz DUKSRQQTZMRXSD-YUSALJHKSA-N 1 2 248.326 2.308 20 0 BEADLO COC(=O)[C@@H]1C[C@H]1[C@@H](C)Nc1ccc(C)[nH+]c1C ZINC000594949459 348147430 /nfs/dbraw/zinc/14/74/30/348147430.db2.gz DUKSRQQTZMRXSD-ADEWGFFLSA-N 1 2 248.326 2.308 20 0 BEADLO CC[C@H](C[N@@H+]1CC[C@H](C)C(F)(F)C1)OC ZINC000419314902 192121504 /nfs/dbraw/zinc/12/15/04/192121504.db2.gz VAWIZIUJDXTSTE-VHSXEESVSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@H](C[N@H+]1CC[C@H](C)C(F)(F)C1)OC ZINC000419314902 192121506 /nfs/dbraw/zinc/12/15/06/192121506.db2.gz VAWIZIUJDXTSTE-VHSXEESVSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@H]([NH2+][C@@H]1Cc2ccccc2[C@@H]1C)C(=O)OC ZINC000595703858 348308097 /nfs/dbraw/zinc/30/80/97/348308097.db2.gz AQRVEIMGWJTLEW-LEWSCRJBSA-N 1 2 247.338 2.256 20 0 BEADLO CC/C=C\CC[NH2+][C@@](C)(CCF)C(=O)OC ZINC000595776570 348338570 /nfs/dbraw/zinc/33/85/70/348338570.db2.gz TZHJONAKRFBXPT-FJOGCWAESA-N 1 2 231.311 2.224 20 0 BEADLO CCc1[nH+]c(C)ccc1OCC1(C(=O)OC)CC1 ZINC000596273708 348493943 /nfs/dbraw/zinc/49/39/43/348493943.db2.gz JFLQKDXUDVEBAE-UHFFFAOYSA-N 1 2 249.310 2.284 20 0 BEADLO COC(=O)Cc1cc[nH+]c(NC[C@H](C)C2CC2)c1 ZINC000596088256 348443599 /nfs/dbraw/zinc/44/35/99/348443599.db2.gz NPWMXQHDHDKSIF-JTQLQIEISA-N 1 2 248.326 2.255 20 0 BEADLO CCc1cnc(C[N@@H+]2CC[C@@](C)(F)C2)o1 ZINC000535756656 323190519 /nfs/dbraw/zinc/19/05/19/323190519.db2.gz GXMITTXYTSAKPL-LLVKDONJSA-N 1 2 212.268 2.171 20 0 BEADLO CCc1cnc(C[N@H+]2CC[C@@](C)(F)C2)o1 ZINC000535756656 323190520 /nfs/dbraw/zinc/19/05/20/323190520.db2.gz GXMITTXYTSAKPL-LLVKDONJSA-N 1 2 212.268 2.171 20 0 BEADLO CO[C@H](CSCCn1cc[nH+]c1)C1CCC1 ZINC000596417148 348541218 /nfs/dbraw/zinc/54/12/18/348541218.db2.gz FNJJFHNBQJAOHI-GFCCVEGCSA-N 1 2 240.372 2.431 20 0 BEADLO CC(=O)c1ccc(C[N@H+]2CCOC[C@@H]2C)cc1 ZINC000205447464 348519076 /nfs/dbraw/zinc/51/90/76/348519076.db2.gz AUYXJBXCMXMRLL-NSHDSACASA-N 1 2 233.311 2.110 20 0 BEADLO CC(=O)c1ccc(C[N@@H+]2CCOC[C@@H]2C)cc1 ZINC000205447464 348519079 /nfs/dbraw/zinc/51/90/79/348519079.db2.gz AUYXJBXCMXMRLL-NSHDSACASA-N 1 2 233.311 2.110 20 0 BEADLO CC(C)OC(=O)[C@H](C)[NH2+]C1CC(CF)(CF)C1 ZINC000597143019 348662052 /nfs/dbraw/zinc/66/20/52/348662052.db2.gz XOZHLDXXXBTBOE-VIFPVBQESA-N 1 2 249.301 2.004 20 0 BEADLO CC(=O)c1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000207925444 348836385 /nfs/dbraw/zinc/83/63/85/348836385.db2.gz BPFAFWGYMQMABZ-VXGBXAGGSA-N 1 2 247.338 2.498 20 0 BEADLO CCc1cc(N[C@H]2CCO[C@H](C)C2)nc[nH+]1 ZINC000220082318 490224473 /nfs/dbraw/zinc/22/44/73/490224473.db2.gz OEVPXRUPRBGFEY-KOLCDFICSA-N 1 2 221.304 2.018 20 0 BEADLO C[C@H]1C[N@H+](Cc2nncn2C)[C@H]1c1ccccc1 ZINC000248343457 349123519 /nfs/dbraw/zinc/12/35/19/349123519.db2.gz KIFXWGMEUVXOSB-SMDDNHRTSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nncn2C)[C@H]1c1ccccc1 ZINC000248343457 349123521 /nfs/dbraw/zinc/12/35/21/349123521.db2.gz KIFXWGMEUVXOSB-SMDDNHRTSA-N 1 2 242.326 2.008 20 0 BEADLO COC[C@@H](C)C[NH2+][C@@H](C(C)C)C(F)(F)F ZINC000308951492 349181202 /nfs/dbraw/zinc/18/12/02/349181202.db2.gz PFKOSZJYKOXIEL-IUCAKERBSA-N 1 2 227.270 2.445 20 0 BEADLO Cc1csc([C@H](C)NCc2[nH]cc[nH+]2)n1 ZINC000066593728 179796243 /nfs/dbraw/zinc/79/62/43/179796243.db2.gz LTGYDNQOEUDVPG-QMMMGPOBSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1occc1CNc1cc[nH+]c(C2CC2)n1 ZINC000599542491 349214419 /nfs/dbraw/zinc/21/44/19/349214419.db2.gz NUFGZJJRGVUESW-UHFFFAOYSA-N 1 2 229.283 2.289 20 0 BEADLO C[C@@H](NC(=O)[C@H]1[C@@H]2CCCC[C@@H]21)c1[nH]cc[nH+]1 ZINC000252980856 349216209 /nfs/dbraw/zinc/21/62/09/349216209.db2.gz OKWOYYQOJGMPGE-ZNSHCXBVSA-N 1 2 233.315 2.023 20 0 BEADLO COC(=O)C[NH2+][C@H](c1cccc(C)c1)C(C)C ZINC000599626330 349231090 /nfs/dbraw/zinc/23/10/90/349231090.db2.gz DAMZEIQKIHJKLP-AWEZNQCLSA-N 1 2 235.327 2.455 20 0 BEADLO CC(C)(C)OC(=O)C(C)(C)[NH2+]CCCF ZINC000599662446 349236149 /nfs/dbraw/zinc/23/61/49/349236149.db2.gz WLLDQNSKVBBAGY-UHFFFAOYSA-N 1 2 219.300 2.056 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1nccn1C)c1nccs1 ZINC000070732296 490236785 /nfs/dbraw/zinc/23/67/85/490236785.db2.gz CFYQEMPSNRQLMA-DTWKUNHWSA-N 1 2 236.344 2.288 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)CSC(C)C ZINC000532313130 323218675 /nfs/dbraw/zinc/21/86/75/323218675.db2.gz VYAGAMOPVDDXJE-UHFFFAOYSA-N 1 2 238.356 2.146 20 0 BEADLO CC(C)[C@H]1C[C@@H]([NH2+]Cc2ccn[nH]2)CS1 ZINC000308998678 349268013 /nfs/dbraw/zinc/26/80/13/349268013.db2.gz NHSNAXNXSAKKFZ-GHMZBOCLSA-N 1 2 225.361 2.029 20 0 BEADLO CC(C)[C@@H]1C[C@H]([NH2+]Cc2ccn[nH]2)CS1 ZINC000308998680 349268035 /nfs/dbraw/zinc/26/80/35/349268035.db2.gz NHSNAXNXSAKKFZ-QWRGUYRKSA-N 1 2 225.361 2.029 20 0 BEADLO Cc1nc(C[NH+]2CCC(C3CC3)CC2)no1 ZINC000366407773 179951986 /nfs/dbraw/zinc/95/19/86/179951986.db2.gz SPYKIJASCOPPIV-UHFFFAOYSA-N 1 2 221.304 2.000 20 0 BEADLO O=C(CCC1CC1)Nc1ccc2[nH+]ccn2c1 ZINC000604331257 350103803 /nfs/dbraw/zinc/10/38/03/350103803.db2.gz AWDNCXZPHLRTRW-UHFFFAOYSA-N 1 2 229.283 2.463 20 0 BEADLO Cc1nc2[nH]ccc2c(NCC[C@H](C)F)[nH+]1 ZINC000338757671 180019319 /nfs/dbraw/zinc/01/93/19/180019319.db2.gz VPASHXFJAHNMTF-ZETCQYMHSA-N 1 2 222.267 2.378 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H]2CCO[C@@H](C)C2)[nH+]1 ZINC000354705697 180024440 /nfs/dbraw/zinc/02/44/40/180024440.db2.gz AQHYVXHGXFDKPP-WCBMZHEXSA-N 1 2 246.314 2.246 20 0 BEADLO Cc1[nH+]c2cc(OC(=O)C3CC3)ccc2n1C ZINC000296126707 180084176 /nfs/dbraw/zinc/08/41/76/180084176.db2.gz MOMDSAQGTXABGJ-UHFFFAOYSA-N 1 2 230.267 2.197 20 0 BEADLO Cc1[nH+]c2ccc(C(=O)NC3CCC3)cc2n1C ZINC000336626056 180088840 /nfs/dbraw/zinc/08/88/40/180088840.db2.gz YSEAZBOVPYKLBQ-UHFFFAOYSA-N 1 2 243.310 2.164 20 0 BEADLO Cc1[nH+]c2ccc(C(=O)N[C@@H]3C[C@H]3C)cc2n1C ZINC000336539981 180089348 /nfs/dbraw/zinc/08/93/48/180089348.db2.gz MOIBEWGOTFHVSU-PRHODGIISA-N 1 2 243.310 2.020 20 0 BEADLO Cc1nc(N(C)CC(F)F)c2c([nH+]1)CCCC2 ZINC000359732376 180068628 /nfs/dbraw/zinc/06/86/28/180068628.db2.gz VHUARZUEKMDHBG-UHFFFAOYSA-N 1 2 241.285 2.365 20 0 BEADLO CCCCC(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000374507001 168614223 /nfs/dbraw/zinc/61/42/23/168614223.db2.gz QXTGIOBYWADDGQ-JTQLQIEISA-N 1 2 221.304 2.263 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C1=CC[C@H](C)CC1 ZINC000336287238 180118944 /nfs/dbraw/zinc/11/89/44/180118944.db2.gz RAGBPZXJMQNJSQ-VIFPVBQESA-N 1 2 233.315 2.081 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)CC1CC(C)(C)C1 ZINC000341757370 180120037 /nfs/dbraw/zinc/12/00/37/180120037.db2.gz TTWMMMCDDVADDA-UHFFFAOYSA-N 1 2 235.331 2.161 20 0 BEADLO Cc1ncc(C[NH2+][C@H](C)c2ncc[nH]2)s1 ZINC000124659783 180158656 /nfs/dbraw/zinc/15/86/56/180158656.db2.gz OIWPLRJXWWIRJB-SSDOTTSWSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1ncc(CNc2c[nH+]ccc2C)cn1 ZINC000309713811 180159930 /nfs/dbraw/zinc/15/99/30/180159930.db2.gz RWUBVHAGQYAOOC-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO Cc1nnsc1CNc1ccc[nH+]c1C ZINC000394737311 350219965 /nfs/dbraw/zinc/21/99/65/350219965.db2.gz XLICZNZKGFRSHJ-UHFFFAOYSA-N 1 2 220.301 2.162 20 0 BEADLO Cc1nc(NCCCOC(C)C)cc[nH+]1 ZINC000266185951 180197330 /nfs/dbraw/zinc/19/73/30/180197330.db2.gz WZNHQILYHMGGLJ-UHFFFAOYSA-N 1 2 209.293 2.012 20 0 BEADLO Cc1nc(NCc2ccc(O)cc2)cc[nH+]1 ZINC000127162187 180200202 /nfs/dbraw/zinc/20/02/02/180200202.db2.gz HTYUUJLEBWUSGD-UHFFFAOYSA-N 1 2 215.256 2.103 20 0 BEADLO Cc1nc(N[C@@H]2CCO[C@@H](C3CC3)C2)cc[nH+]1 ZINC000185425506 180203214 /nfs/dbraw/zinc/20/32/14/180203214.db2.gz GCWXBCKMRLYABA-VXGBXAGGSA-N 1 2 233.315 2.155 20 0 BEADLO Cc1nc(N[C@@H](C)c2cccnc2)cc[nH+]1 ZINC000054935829 180203607 /nfs/dbraw/zinc/20/36/07/180203607.db2.gz IYBMTMNPNDFWDE-VIFPVBQESA-N 1 2 214.272 2.353 20 0 BEADLO Cc1nc(N[C@H]2CS[C@@H](C)C2)cc[nH+]1 ZINC000307171423 180207519 /nfs/dbraw/zinc/20/75/19/180207519.db2.gz OEKPEWUULYQPPD-IONNQARKSA-N 1 2 209.318 2.091 20 0 BEADLO Cc1nc(NCC2Cc3ccccc3C2)cc[nH+]1 ZINC000361020989 180180330 /nfs/dbraw/zinc/18/03/30/180180330.db2.gz BUQQSXZLNSBJEO-UHFFFAOYSA-N 1 2 239.322 2.034 20 0 BEADLO Cc1cc(CNc2cc[nH+]c(C)n2)ccc1F ZINC000361162045 180181890 /nfs/dbraw/zinc/18/18/90/180181890.db2.gz QGDYQNUQISCZDD-UHFFFAOYSA-N 1 2 231.274 2.267 20 0 BEADLO Cc1ncccc1C[N@@H+]1CCC=C(F)C1 ZINC000336618680 180218024 /nfs/dbraw/zinc/21/80/24/180218024.db2.gz CSENRTVRRSLVKP-UHFFFAOYSA-N 1 2 206.264 2.449 20 0 BEADLO Cc1ncccc1C[N@H+]1CCC=C(F)C1 ZINC000336618680 180218028 /nfs/dbraw/zinc/21/80/28/180218028.db2.gz CSENRTVRRSLVKP-UHFFFAOYSA-N 1 2 206.264 2.449 20 0 BEADLO Cc1[nH+]cccc1NCC1=CCCOC1 ZINC000125067652 180225582 /nfs/dbraw/zinc/22/55/82/180225582.db2.gz SRNGRIGTVRIWQA-UHFFFAOYSA-N 1 2 204.273 2.149 20 0 BEADLO Cc1[nH+]cccc1N[C@@H](C)[C@@H]1CCOC1 ZINC000162942728 180225736 /nfs/dbraw/zinc/22/57/36/180225736.db2.gz ZELGWWHZOVPTLK-GXSJLCMTSA-N 1 2 206.289 2.227 20 0 BEADLO Cc1[nH+]cccc1N[C@H](C)c1cnccn1 ZINC000085711773 180228050 /nfs/dbraw/zinc/22/80/50/180228050.db2.gz COZXQZJLWLQUMQ-SNVBAGLBSA-N 1 2 214.272 2.353 20 0 BEADLO C[C@@H](CF)Nc1[nH+]c(C2CC2)nc2[nH]ccc21 ZINC000631282950 350245656 /nfs/dbraw/zinc/24/56/56/350245656.db2.gz CRKGCMICOBQPMQ-ZETCQYMHSA-N 1 2 234.278 2.027 20 0 BEADLO CC(C)(C)CCC(=O)N1CC(n2cc[nH+]c2)C1 ZINC000606372688 350320747 /nfs/dbraw/zinc/32/07/47/350320747.db2.gz SNTDOANNJQYBGP-UHFFFAOYSA-N 1 2 235.331 2.093 20 0 BEADLO Cc1cnc(CN[C@H](C)c2[nH]cc[nH+]2)s1 ZINC000309124113 323318390 /nfs/dbraw/zinc/31/83/90/323318390.db2.gz OVQNQMMBWGNKGF-MRVPVSSYSA-N 1 2 222.317 2.025 20 0 BEADLO COC1CC(C(=O)Nc2c(C)cc[nH+]c2C)C1 ZINC000637241987 350339090 /nfs/dbraw/zinc/33/90/90/350339090.db2.gz FOYZGXJNIXHXKS-UHFFFAOYSA-N 1 2 234.299 2.062 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)C12CC(C1)C2 ZINC000637242938 350340853 /nfs/dbraw/zinc/34/08/53/350340853.db2.gz OCMMDWOWNFIIOM-UHFFFAOYSA-N 1 2 216.284 2.437 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1C[C@@H](C)O[C@H]1C ZINC000637243779 350342329 /nfs/dbraw/zinc/34/23/29/350342329.db2.gz WYWUFQKXORRAKR-ADEWGFFLSA-N 1 2 248.326 2.450 20 0 BEADLO Cc1cnc([C@H](C)[NH2+][C@H](C)c2ccon2)cn1 ZINC000427857147 191095906 /nfs/dbraw/zinc/09/59/06/191095906.db2.gz PQLRGAVDYATPDM-ZJUUUORDSA-N 1 2 232.287 2.185 20 0 BEADLO CCO[C@H]1CCC[N@H+](Cc2cscn2)C1 ZINC000606438594 350333735 /nfs/dbraw/zinc/33/37/35/350333735.db2.gz BLVLWNOEKSTGND-NSHDSACASA-N 1 2 226.345 2.144 20 0 BEADLO CCO[C@H]1CCC[N@@H+](Cc2cscn2)C1 ZINC000606438594 350333737 /nfs/dbraw/zinc/33/37/37/350333737.db2.gz BLVLWNOEKSTGND-NSHDSACASA-N 1 2 226.345 2.144 20 0 BEADLO Cc1ncsc1CNc1cccc[nH+]1 ZINC000070837177 180324463 /nfs/dbraw/zinc/32/44/63/180324463.db2.gz NXKCLMIMHVAWFB-UHFFFAOYSA-N 1 2 205.286 2.459 20 0 BEADLO CC[C@H](C)NC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606580360 350371157 /nfs/dbraw/zinc/37/11/57/350371157.db2.gz LHLLVWQHRWPFAI-VIFPVBQESA-N 1 2 232.287 2.254 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)NC1CCC1 ZINC000606583578 350373014 /nfs/dbraw/zinc/37/30/14/350373014.db2.gz HDVSWXZLEVNKQR-UHFFFAOYSA-N 1 2 230.271 2.008 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@H](C)c2cnc(C)cn2)C[C@H](C)O1 ZINC000428218441 191100637 /nfs/dbraw/zinc/10/06/37/191100637.db2.gz BMMVDYGKOGQTBJ-YNEHKIRRSA-N 1 2 249.358 2.345 20 0 BEADLO CC[C@@H]1C[N@H+]([C@H](C)c2cnc(C)cn2)C[C@H](C)O1 ZINC000428218441 191100640 /nfs/dbraw/zinc/10/06/40/191100640.db2.gz BMMVDYGKOGQTBJ-YNEHKIRRSA-N 1 2 249.358 2.345 20 0 BEADLO Cc1nn(C)c(C)c1N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000293898255 180345194 /nfs/dbraw/zinc/34/51/94/180345194.db2.gz GYXNDEDIXIACTH-GZMMTYOYSA-N 1 2 245.330 2.351 20 0 BEADLO Cc1nn(C)c(Cl)c1CNc1cccc[nH+]1 ZINC000121574966 180351204 /nfs/dbraw/zinc/35/12/04/180351204.db2.gz UURLTDZRAPJUSL-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO CCc1cc(N2[C@H](C)C[C@H]2C)nc(C)[nH+]1 ZINC000335206471 538092021 /nfs/dbraw/zinc/09/20/21/538092021.db2.gz IZRHQVKXXIEFSH-RKDXNWHRSA-N 1 2 205.305 2.335 20 0 BEADLO CCc1cc(N2[C@H](C)C[C@@H]2C)nc(C)[nH+]1 ZINC000335206469 538092034 /nfs/dbraw/zinc/09/20/34/538092034.db2.gz IZRHQVKXXIEFSH-DTORHVGOSA-N 1 2 205.305 2.335 20 0 BEADLO CC[C@@H](O)CNc1[nH+]ccc(C)c1Cl ZINC000336649603 350418394 /nfs/dbraw/zinc/41/83/94/350418394.db2.gz HUJWZJQJTPTRIB-MRVPVSSYSA-N 1 2 214.696 2.226 20 0 BEADLO CC[N@H+](Cc1ccncc1)Cc1nccc(C)n1 ZINC000336691183 350447332 /nfs/dbraw/zinc/44/73/32/350447332.db2.gz CFENSBFRLPWXDO-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO CC[N@@H+](Cc1ccncc1)Cc1nccc(C)n1 ZINC000336691183 350447335 /nfs/dbraw/zinc/44/73/35/350447335.db2.gz CFENSBFRLPWXDO-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCC1(C)C)C(=O)OC(C)(C)C ZINC000309304430 323341541 /nfs/dbraw/zinc/34/15/41/323341541.db2.gz MUCLJXACQWOCJU-ZJUUUORDSA-N 1 2 227.348 2.495 20 0 BEADLO CC[N@H+](Cc1nccn1C(C)C)[C@@H]1CCOC1 ZINC000336712494 350463845 /nfs/dbraw/zinc/46/38/45/350463845.db2.gz NVRRSEOCWNWKHU-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO CC[N@@H+](Cc1nccn1C(C)C)[C@@H]1CCOC1 ZINC000336712494 350463847 /nfs/dbraw/zinc/46/38/47/350463847.db2.gz NVRRSEOCWNWKHU-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO Cc1nn(C)cc1[C@@H]1CCC[N@@H+]1Cc1ccon1 ZINC000363928086 180381021 /nfs/dbraw/zinc/38/10/21/180381021.db2.gz YKACIOQPDLCBNE-ZDUSSCGKSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1nn(C)cc1[C@@H]1CCC[N@H+]1Cc1ccon1 ZINC000363928086 180381024 /nfs/dbraw/zinc/38/10/24/180381024.db2.gz YKACIOQPDLCBNE-ZDUSSCGKSA-N 1 2 246.314 2.054 20 0 BEADLO FC[C@H]([NH2+]Cc1cn[nH]c1)c1ccc(F)cc1 ZINC000631283377 350493072 /nfs/dbraw/zinc/49/30/72/350493072.db2.gz KNDHZUDFGYOOPV-LBPRGKRZSA-N 1 2 237.253 2.349 20 0 BEADLO CCC(CC)CC(=O)N[C@H]1CCn2cc[nH+]c2C1 ZINC000427998960 191105694 /nfs/dbraw/zinc/10/56/94/191105694.db2.gz XPPJKKDPIURMED-LBPRGKRZSA-N 1 2 249.358 2.140 20 0 BEADLO CC[N@H+](Cc1ccccn1)Cc1cnc(C)cn1 ZINC000336733898 350488134 /nfs/dbraw/zinc/48/81/34/350488134.db2.gz URBIKVYGYLGDSX-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO CC[N@@H+](Cc1ccccn1)Cc1cnc(C)cn1 ZINC000336733898 350488136 /nfs/dbraw/zinc/48/81/36/350488136.db2.gz URBIKVYGYLGDSX-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO CCC(C)(C)CC(=O)N[C@H]1CCn2cc[nH+]c2C1 ZINC000427999817 191105779 /nfs/dbraw/zinc/10/57/79/191105779.db2.gz FWZARQJEOMYAGY-NSHDSACASA-N 1 2 249.358 2.140 20 0 BEADLO Cc1nc(NCC(C)(C)C2CCC2)cc[nH+]1 ZINC000384835907 350592691 /nfs/dbraw/zinc/59/26/91/350592691.db2.gz GVUOPTPREQMUDJ-UHFFFAOYSA-N 1 2 219.332 2.445 20 0 BEADLO COc1ccc2[nH+]c(NC[C@@H](C)O)ccc2c1 ZINC000120425542 350600368 /nfs/dbraw/zinc/60/03/68/350600368.db2.gz KFVVUINLUIJBHQ-SECBINFHSA-N 1 2 232.283 2.036 20 0 BEADLO Cc1c[nH]c(CN2CC(C)(CC(F)(F)F)C2)[nH+]1 ZINC000628308098 350727318 /nfs/dbraw/zinc/72/73/18/350727318.db2.gz WNJVKGAWLLALIK-UHFFFAOYSA-N 1 2 247.264 2.492 20 0 BEADLO COc1ncc(C[NH2+][C@H]2CCCC2(F)F)s1 ZINC000397991120 362982179 /nfs/dbraw/zinc/98/21/79/362982179.db2.gz IMDCDRVMSKUGOC-QMMMGPOBSA-N 1 2 248.298 2.429 20 0 BEADLO CCc1nc(C[N@@H+]2CC[C@H](CC3CC3)C2)no1 ZINC000339688250 350773688 /nfs/dbraw/zinc/77/36/88/350773688.db2.gz UFISBYOGIKNTIA-LLVKDONJSA-N 1 2 235.331 2.254 20 0 BEADLO CCc1nc(C[N@H+]2CC[C@H](CC3CC3)C2)no1 ZINC000339688250 350773690 /nfs/dbraw/zinc/77/36/90/350773690.db2.gz UFISBYOGIKNTIA-LLVKDONJSA-N 1 2 235.331 2.254 20 0 BEADLO C[N@H+](Cc1csc(-c2ncccn2)n1)C1CC1 ZINC000051902573 350869668 /nfs/dbraw/zinc/86/96/68/350869668.db2.gz VUELSZLWROWUMK-UHFFFAOYSA-N 1 2 246.339 2.194 20 0 BEADLO C[N@@H+](Cc1csc(-c2ncccn2)n1)C1CC1 ZINC000051902573 350869671 /nfs/dbraw/zinc/86/96/71/350869671.db2.gz VUELSZLWROWUMK-UHFFFAOYSA-N 1 2 246.339 2.194 20 0 BEADLO CO[C@H]1CC[C@H](Nc2cc(NC3CC3)[nH+]cn2)C1 ZINC000577599752 366012027 /nfs/dbraw/zinc/01/20/27/366012027.db2.gz PUMVQVLAJMBILN-QWRGUYRKSA-N 1 2 248.330 2.030 20 0 BEADLO Cc1nonc1C[NH2+][C@@H](C)c1cccs1 ZINC000069794825 180513947 /nfs/dbraw/zinc/51/39/47/180513947.db2.gz RYSBGHLULGWQPK-QMMMGPOBSA-N 1 2 223.301 2.290 20 0 BEADLO CO[C@H]1CC[C@H](Nc2cc(NC3CC3)nc[nH+]2)C1 ZINC000577599752 366012031 /nfs/dbraw/zinc/01/20/31/366012031.db2.gz PUMVQVLAJMBILN-QWRGUYRKSA-N 1 2 248.330 2.030 20 0 BEADLO CO[C@@H]1CC[C@@H](Nc2cc(NC3CC3)[nH+]cn2)C1 ZINC000577599750 366012082 /nfs/dbraw/zinc/01/20/82/366012082.db2.gz PUMVQVLAJMBILN-GHMZBOCLSA-N 1 2 248.330 2.030 20 0 BEADLO CO[C@@H]1CC[C@@H](Nc2cc(NC3CC3)nc[nH+]2)C1 ZINC000577599750 366012086 /nfs/dbraw/zinc/01/20/86/366012086.db2.gz PUMVQVLAJMBILN-GHMZBOCLSA-N 1 2 248.330 2.030 20 0 BEADLO CC(C)C[C@@H](C)NC(=O)c1ccc2[nH+]ccn2c1 ZINC000178692842 191126392 /nfs/dbraw/zinc/12/63/92/191126392.db2.gz YREXEELZNLKLFY-LLVKDONJSA-N 1 2 245.326 2.499 20 0 BEADLO C[C@@H]([NH2+]Cc1cocn1)c1cccc(C#N)c1 ZINC000397877137 350983336 /nfs/dbraw/zinc/98/33/36/350983336.db2.gz WBIIBNLZDIYNSE-SNVBAGLBSA-N 1 2 227.267 2.397 20 0 BEADLO CC(C)CCN(C)c1cc(-n2cc[nH+]c2)ncn1 ZINC000607143822 350944488 /nfs/dbraw/zinc/94/44/88/350944488.db2.gz LEGGZBWCRBVZTB-UHFFFAOYSA-N 1 2 245.330 2.145 20 0 BEADLO CCc1cc(N(C)CCCOC(C)C)nc[nH+]1 ZINC000607147486 350947399 /nfs/dbraw/zinc/94/73/99/350947399.db2.gz SKLIGSWZLRLYMO-UHFFFAOYSA-N 1 2 237.347 2.290 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)Nc1ccc(N)[nH+]c1 ZINC000422794318 192471738 /nfs/dbraw/zinc/47/17/38/192471738.db2.gz UCZBSDOVSFPFPV-DTWKUNHWSA-N 1 2 221.304 2.115 20 0 BEADLO CC1(C)C[N@H+](Cc2ccon2)C(C)(C)CO1 ZINC000607153732 351030924 /nfs/dbraw/zinc/03/09/24/351030924.db2.gz SORPMFRPAZCWIT-UHFFFAOYSA-N 1 2 224.304 2.064 20 0 BEADLO CC1(C)C[N@@H+](Cc2ccon2)C(C)(C)CO1 ZINC000607153732 351030926 /nfs/dbraw/zinc/03/09/26/351030926.db2.gz SORPMFRPAZCWIT-UHFFFAOYSA-N 1 2 224.304 2.064 20 0 BEADLO CC1CC[NH+](Cc2ncc(Cl)n2C)CC1 ZINC000052873145 351075930 /nfs/dbraw/zinc/07/59/30/351075930.db2.gz GDLUPJRHKDEZBW-UHFFFAOYSA-N 1 2 227.739 2.305 20 0 BEADLO C[C@H]1C[C@@H]([NH2+]Cc2c[nH]nn2)CC(C)(C)C1 ZINC000398405297 351137837 /nfs/dbraw/zinc/13/78/37/351137837.db2.gz OSTIKRSZPIKDPV-VHSXEESVSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@H]1C[C@@H]([NH2+]Cc2cn[nH]n2)CC(C)(C)C1 ZINC000398405297 351137838 /nfs/dbraw/zinc/13/78/38/351137838.db2.gz OSTIKRSZPIKDPV-VHSXEESVSA-N 1 2 222.336 2.109 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)CCCCOC ZINC000265221438 351265225 /nfs/dbraw/zinc/26/52/25/351265225.db2.gz NQORQLFYIHCYPC-UHFFFAOYSA-N 1 2 236.315 2.399 20 0 BEADLO Cc1[nH]c(CN2C[C@H](C)OC3(CCC3)C2)[nH+]c1C ZINC000628322686 351211617 /nfs/dbraw/zinc/21/16/17/351211617.db2.gz INRQFAXPELMFAP-JTQLQIEISA-N 1 2 249.358 2.170 20 0 BEADLO CC[N@H+](Cc1cccs1)Cc1nonc1C ZINC000265061954 351262423 /nfs/dbraw/zinc/26/24/23/351262423.db2.gz SVHSQCJIPWVFTA-UHFFFAOYSA-N 1 2 237.328 2.462 20 0 BEADLO CC[N@@H+](Cc1cccs1)Cc1nonc1C ZINC000265061954 351262425 /nfs/dbraw/zinc/26/24/25/351262425.db2.gz SVHSQCJIPWVFTA-UHFFFAOYSA-N 1 2 237.328 2.462 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C(=O)C(C)(C)C ZINC000266832245 351294602 /nfs/dbraw/zinc/29/46/02/351294602.db2.gz LCSWLNAIWWABEY-UHFFFAOYSA-N 1 2 234.299 2.198 20 0 BEADLO Cc1noc([C@@H](C)SCCn2cc[nH+]c2)n1 ZINC000090200386 363023250 /nfs/dbraw/zinc/02/32/50/363023250.db2.gz CUHQQCONTOAOOQ-MRVPVSSYSA-N 1 2 238.316 2.069 20 0 BEADLO Cc1c[nH]c(CN(C)c2cccc(O)c2)[nH+]1 ZINC000628353432 351318904 /nfs/dbraw/zinc/31/89/04/351318904.db2.gz WOAUVUWZGWEGIK-UHFFFAOYSA-N 1 2 217.272 2.060 20 0 BEADLO CC[N@H+](Cc1cc(C)no1)Cc1ccccn1 ZINC000268149202 351328416 /nfs/dbraw/zinc/32/84/16/351328416.db2.gz HABDLZVUTNKSHV-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1cc(C)no1)Cc1ccccn1 ZINC000268149202 351328420 /nfs/dbraw/zinc/32/84/20/351328420.db2.gz HABDLZVUTNKSHV-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1ncoc1C ZINC000265259758 351265919 /nfs/dbraw/zinc/26/59/19/351265919.db2.gz VBPPASSKXBWNSS-UHFFFAOYSA-N 1 2 231.255 2.193 20 0 BEADLO CCn1ncnc1C[NH2+]Cc1ccc(C)cc1F ZINC000631125116 351270454 /nfs/dbraw/zinc/27/04/54/351270454.db2.gz HUMDHVUJPVTZPR-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO c1ccc2cc(N[C@H]3CCOC3)[nH+]cc2c1 ZINC000631178722 351380716 /nfs/dbraw/zinc/38/07/16/351380716.db2.gz KUCONZKALZMDQF-LBPRGKRZSA-N 1 2 214.268 2.436 20 0 BEADLO Clc1cc(-n2cc[nH+]c2)nc(C2CC2)n1 ZINC000087908686 351426903 /nfs/dbraw/zinc/42/69/03/351426903.db2.gz WYLKXSQWUUMTPN-UHFFFAOYSA-N 1 2 220.663 2.193 20 0 BEADLO CCc1cnc(C[NH2+][C@@H](C)c2cn[nH]c2)s1 ZINC000273043647 351508374 /nfs/dbraw/zinc/50/83/74/351508374.db2.gz IYGVNDJXSUAOGX-QMMMGPOBSA-N 1 2 236.344 2.279 20 0 BEADLO C[C@H]1CCCN(C(=O)CCCn2cc[nH+]c2)[C@H]1C ZINC000607525497 351574265 /nfs/dbraw/zinc/57/42/65/351574265.db2.gz MIBGNYORBUJRFJ-STQMWFEESA-N 1 2 249.358 2.310 20 0 BEADLO Clc1nc(C[N@@H+]2C[C@@H]3C[C@@H]3C2)cs1 ZINC000307212441 351613858 /nfs/dbraw/zinc/61/38/58/351613858.db2.gz PDJLGUSJHBUDHL-KNVOCYPGSA-N 1 2 214.721 2.248 20 0 BEADLO Clc1nc(C[N@H+]2C[C@@H]3C[C@@H]3C2)cs1 ZINC000307212441 351613864 /nfs/dbraw/zinc/61/38/64/351613864.db2.gz PDJLGUSJHBUDHL-KNVOCYPGSA-N 1 2 214.721 2.248 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N(C)[C@H]1CC[C@@H](C)C1 ZINC000577744110 366050453 /nfs/dbraw/zinc/05/04/53/366050453.db2.gz DRPRIJRSDJOZCV-MDZLAQPJSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N(C)[C@H]1CC[C@@H](C)C1 ZINC000577744110 366050455 /nfs/dbraw/zinc/05/04/55/366050455.db2.gz DRPRIJRSDJOZCV-MDZLAQPJSA-N 1 2 249.358 2.235 20 0 BEADLO CC[C@@H](NC(=O)C[C@H](C)n1cc[nH+]c1)C1CC1 ZINC000618861119 351747791 /nfs/dbraw/zinc/74/77/91/351747791.db2.gz UKXJATQQURHJAD-CMPLNLGQSA-N 1 2 235.331 2.139 20 0 BEADLO CC(C)CC[C@H](C)NC(=O)CCc1[nH]cc[nH+]1 ZINC000279186143 351800214 /nfs/dbraw/zinc/80/02/14/351800214.db2.gz KUUIXNKIHPYTGZ-NSHDSACASA-N 1 2 237.347 2.283 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1cc(C)ns1 ZINC000637947814 351823589 /nfs/dbraw/zinc/82/35/89/351823589.db2.gz FSSCUGFLLRDIGH-JTQLQIEISA-N 1 2 226.345 2.062 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1cc(C)ns1 ZINC000637947814 351823593 /nfs/dbraw/zinc/82/35/93/351823593.db2.gz FSSCUGFLLRDIGH-JTQLQIEISA-N 1 2 226.345 2.062 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1cc(C)ns1 ZINC000637947815 351824131 /nfs/dbraw/zinc/82/41/31/351824131.db2.gz FSSCUGFLLRDIGH-SNVBAGLBSA-N 1 2 226.345 2.062 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1cc(C)ns1 ZINC000637947815 351824134 /nfs/dbraw/zinc/82/41/34/351824134.db2.gz FSSCUGFLLRDIGH-SNVBAGLBSA-N 1 2 226.345 2.062 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H](C)c1ccco1 ZINC000607650303 351824163 /nfs/dbraw/zinc/82/41/63/351824163.db2.gz KEWWKKRUEDXQJE-SNVBAGLBSA-N 1 2 244.294 2.401 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)[C@@H]1CCCC(C)(C)C1 ZINC000335869804 538101353 /nfs/dbraw/zinc/10/13/53/538101353.db2.gz ZELWNUJLTIQRFJ-LLVKDONJSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H](C)OC[C@H]2C)sn1 ZINC000637930640 351807242 /nfs/dbraw/zinc/80/72/42/351807242.db2.gz QTTARANVTMIOAA-NXEZZACHSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H](C)OC[C@H]2C)sn1 ZINC000637930640 351807244 /nfs/dbraw/zinc/80/72/44/351807244.db2.gz QTTARANVTMIOAA-NXEZZACHSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H](C)c1ccco1 ZINC000607646596 351816656 /nfs/dbraw/zinc/81/66/56/351816656.db2.gz KVMBWOHGHYSSFI-SNVBAGLBSA-N 1 2 230.267 2.147 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccns2)C[C@@H](C)O1 ZINC000637973597 351848357 /nfs/dbraw/zinc/84/83/57/351848357.db2.gz XLPXLTGEFOTDLE-ZJUUUORDSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccns2)C[C@@H](C)O1 ZINC000637973597 351848361 /nfs/dbraw/zinc/84/83/61/351848361.db2.gz XLPXLTGEFOTDLE-ZJUUUORDSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccns2)C[C@@H](C)O1 ZINC000637973594 351848728 /nfs/dbraw/zinc/84/87/28/351848728.db2.gz XLPXLTGEFOTDLE-NXEZZACHSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccns2)C[C@@H](C)O1 ZINC000637973594 351848731 /nfs/dbraw/zinc/84/87/31/351848731.db2.gz XLPXLTGEFOTDLE-NXEZZACHSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@H](C)[C@@H](C[N@H+](C)CC(F)F)OC ZINC000637974489 351849989 /nfs/dbraw/zinc/84/99/89/351849989.db2.gz UZGXYTRIWBWYFS-DTWKUNHWSA-N 1 2 209.280 2.244 20 0 BEADLO CC[C@H](C)[C@@H](C[N@@H+](C)CC(F)F)OC ZINC000637974489 351849992 /nfs/dbraw/zinc/84/99/92/351849992.db2.gz UZGXYTRIWBWYFS-DTWKUNHWSA-N 1 2 209.280 2.244 20 0 BEADLO FC(F)C[N@H+](CCC[C@@H]1CCO1)C1CC1 ZINC000638057437 351933278 /nfs/dbraw/zinc/93/32/78/351933278.db2.gz VQSSYVOKSIUXMY-SNVBAGLBSA-N 1 2 219.275 2.285 20 0 BEADLO FC(F)C[N@@H+](CCC[C@@H]1CCO1)C1CC1 ZINC000638057437 351933280 /nfs/dbraw/zinc/93/32/80/351933280.db2.gz VQSSYVOKSIUXMY-SNVBAGLBSA-N 1 2 219.275 2.285 20 0 BEADLO CCCC[C@@H](C)C(=O)N(C)Cc1[nH+]ccn1C ZINC000282579218 351936088 /nfs/dbraw/zinc/93/60/88/351936088.db2.gz OYFMJGLHDRNJNI-LLVKDONJSA-N 1 2 237.347 2.205 20 0 BEADLO CCCC[C@@H](C)C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000281900631 351916001 /nfs/dbraw/zinc/91/60/01/351916001.db2.gz BLUGIWWKQQFBOI-VXGBXAGGSA-N 1 2 237.347 2.214 20 0 BEADLO Cc1ncc([C@H](C)[N@@H+]2CCO[C@@H](C)[C@H]2C)c(C)n1 ZINC000638085879 351963116 /nfs/dbraw/zinc/96/31/16/351963116.db2.gz UROIPPRTYMEZJL-WOPDTQHZSA-N 1 2 249.358 2.264 20 0 BEADLO Cc1ncc([C@H](C)[N@H+]2CCO[C@@H](C)[C@H]2C)c(C)n1 ZINC000638085879 351963118 /nfs/dbraw/zinc/96/31/18/351963118.db2.gz UROIPPRTYMEZJL-WOPDTQHZSA-N 1 2 249.358 2.264 20 0 BEADLO Cn1ccnc1[C@H](C1CC1)[N@H+](C)Cc1ccc[nH]1 ZINC000638150806 352011915 /nfs/dbraw/zinc/01/19/15/352011915.db2.gz YGLBLRLZBKBYJA-ZDUSSCGKSA-N 1 2 244.342 2.331 20 0 BEADLO Cn1ccnc1[C@H](C1CC1)[N@@H+](C)Cc1ccc[nH]1 ZINC000638150806 352011916 /nfs/dbraw/zinc/01/19/16/352011916.db2.gz YGLBLRLZBKBYJA-ZDUSSCGKSA-N 1 2 244.342 2.331 20 0 BEADLO CCc1nc(Nc2c[nH]nc2C)cc(C)[nH+]1 ZINC000283782543 351983807 /nfs/dbraw/zinc/98/38/07/351983807.db2.gz QQEGSBYBYTVBMK-UHFFFAOYSA-N 1 2 217.276 2.123 20 0 BEADLO CC[C@@H]1CCCC[C@H]1NC(=O)CCc1[nH]cc[nH+]1 ZINC000287472709 352127057 /nfs/dbraw/zinc/12/70/57/352127057.db2.gz YGCGJBPLMRSYMO-VXGBXAGGSA-N 1 2 249.358 2.427 20 0 BEADLO CC[N@H+](Cc1ccccc1)[C@@H](C)c1nncn1C ZINC000286721132 352102919 /nfs/dbraw/zinc/10/29/19/352102919.db2.gz DIZLVGPLINNCGT-LBPRGKRZSA-N 1 2 244.342 2.398 20 0 BEADLO CC[N@@H+](Cc1ccccc1)[C@@H](C)c1nncn1C ZINC000286721132 352102920 /nfs/dbraw/zinc/10/29/20/352102920.db2.gz DIZLVGPLINNCGT-LBPRGKRZSA-N 1 2 244.342 2.398 20 0 BEADLO CC[N@H+](Cc1cocn1)Cc1ccncc1 ZINC000289856107 352200684 /nfs/dbraw/zinc/20/06/84/352200684.db2.gz QGKBBLNROTYGNU-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO CC[N@@H+](Cc1cocn1)Cc1ccncc1 ZINC000289856107 352200685 /nfs/dbraw/zinc/20/06/85/352200685.db2.gz QGKBBLNROTYGNU-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO COC(=O)[C@@H]1CCC[N@@H+]1C/C=C\c1ccccc1 ZINC000212746629 363119368 /nfs/dbraw/zinc/11/93/68/363119368.db2.gz IOAVDOFCHUVINQ-UQYHUFHVSA-N 1 2 245.322 2.337 20 0 BEADLO COC(=O)[C@@H]1CCC[N@H+]1C/C=C\c1ccccc1 ZINC000212746629 363119373 /nfs/dbraw/zinc/11/93/73/363119373.db2.gz IOAVDOFCHUVINQ-UQYHUFHVSA-N 1 2 245.322 2.337 20 0 BEADLO Cc1ccccc1/C=C\C(=O)NC1=[NH+]CCS1 ZINC000212844514 363119860 /nfs/dbraw/zinc/11/98/60/363119860.db2.gz KGYFISFZRIISIM-SREVYHEPSA-N 1 2 246.335 2.227 20 0 BEADLO CC(C)[C@H]1CCCC[C@@H]1NC(=O)Cn1cc[nH+]c1 ZINC000073380017 352334751 /nfs/dbraw/zinc/33/47/51/352334751.db2.gz VCPGKKYPURJTNP-OLZOCXBDSA-N 1 2 249.358 2.214 20 0 BEADLO COc1ccc(OCc2c[nH+]cn2C)cc1OC ZINC000267726723 187680684 /nfs/dbraw/zinc/68/06/84/187680684.db2.gz CBPUVSQHQFAWID-UHFFFAOYSA-N 1 2 248.282 2.016 20 0 BEADLO Cc1[nH]c(CNCc2ccccc2F)[nH+]c1C ZINC000045205755 352588276 /nfs/dbraw/zinc/58/82/76/352588276.db2.gz UCXBSVNEHFTTSG-UHFFFAOYSA-N 1 2 233.290 2.455 20 0 BEADLO Cc1nc(C[NH2+]Cc2ccccc2F)[nH]c1C ZINC000045205755 352588280 /nfs/dbraw/zinc/58/82/80/352588280.db2.gz UCXBSVNEHFTTSG-UHFFFAOYSA-N 1 2 233.290 2.455 20 0 BEADLO CC(C)C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000030608399 352671834 /nfs/dbraw/zinc/67/18/34/352671834.db2.gz GDBYEMNHOWAEHI-UHFFFAOYSA-N 1 2 229.283 2.467 20 0 BEADLO C[C@@H](c1cnccn1)[N@@H+]1CCO[C@H](C2CCC2)C1 ZINC000411855376 191220592 /nfs/dbraw/zinc/22/05/92/191220592.db2.gz URGNADVTIMHHAH-FZMZJTMJSA-N 1 2 247.342 2.039 20 0 BEADLO C[C@@H](c1cnccn1)[N@H+]1CCO[C@H](C2CCC2)C1 ZINC000411855376 191220594 /nfs/dbraw/zinc/22/05/94/191220594.db2.gz URGNADVTIMHHAH-FZMZJTMJSA-N 1 2 247.342 2.039 20 0 BEADLO FC[C@H]1C[N@H+](C/C=C\c2ccccc2)CCO1 ZINC000411852471 191221316 /nfs/dbraw/zinc/22/13/16/191221316.db2.gz KHOGMYPXRUFWIB-ZBKLQPJUSA-N 1 2 235.302 2.370 20 0 BEADLO FC[C@H]1C[N@@H+](C/C=C\c2ccccc2)CCO1 ZINC000411852471 191221319 /nfs/dbraw/zinc/22/13/19/191221319.db2.gz KHOGMYPXRUFWIB-ZBKLQPJUSA-N 1 2 235.302 2.370 20 0 BEADLO CCOCC[N@@H+]1Cc2ccc(C(C)=O)cc2C1 ZINC000411927294 191232470 /nfs/dbraw/zinc/23/24/70/191232470.db2.gz RUWQFIZZJYZMPO-UHFFFAOYSA-N 1 2 233.311 2.241 20 0 BEADLO CCOCC[N@H+]1Cc2ccc(C(C)=O)cc2C1 ZINC000411927294 191232472 /nfs/dbraw/zinc/23/24/72/191232472.db2.gz RUWQFIZZJYZMPO-UHFFFAOYSA-N 1 2 233.311 2.241 20 0 BEADLO CC[C@](C)(CNc1ccc(N(C)C)c[nH+]1)OC ZINC000638760735 352695095 /nfs/dbraw/zinc/69/50/95/352695095.db2.gz UHRIILATZZFGHB-CYBMUJFWSA-N 1 2 237.347 2.375 20 0 BEADLO Cc1ccc(N[C@@H](C)C[C@@H]2CCCC(=O)N2)c[nH+]1 ZINC000638762756 352700967 /nfs/dbraw/zinc/70/09/67/352700967.db2.gz ZJVAYBONNKVSSB-RYUDHWBXSA-N 1 2 247.342 2.249 20 0 BEADLO Cc1ccc(N[C@H](C)C[C@@H]2CCCC(=O)N2)c[nH+]1 ZINC000638762754 352701095 /nfs/dbraw/zinc/70/10/95/352701095.db2.gz ZJVAYBONNKVSSB-NEPJUHHUSA-N 1 2 247.342 2.249 20 0 BEADLO CC[N@H+](Cc1cn(C)nn1)Cc1cccc(C)c1 ZINC000341645587 352719554 /nfs/dbraw/zinc/71/95/54/352719554.db2.gz ZGVPTHBWNUJHQA-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CC[N@@H+](Cc1cn(C)nn1)Cc1cccc(C)c1 ZINC000341645587 352719556 /nfs/dbraw/zinc/71/95/56/352719556.db2.gz ZGVPTHBWNUJHQA-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO C/C(=C/c1ccccc1)C[NH2+]CC(F)(F)CO ZINC000341548468 352713239 /nfs/dbraw/zinc/71/32/39/352713239.db2.gz JBRKTYFFYKTSQM-XFFZJAGNSA-N 1 2 241.281 2.307 20 0 BEADLO COC[C@@H](C)[N@@H+]1Cc2ccc(C(C)=O)cc2C1 ZINC000411953739 191231673 /nfs/dbraw/zinc/23/16/73/191231673.db2.gz WFJIYFAUKNJEOF-SNVBAGLBSA-N 1 2 233.311 2.240 20 0 BEADLO COC[C@@H](C)[N@H+]1Cc2ccc(C(C)=O)cc2C1 ZINC000411953739 191231675 /nfs/dbraw/zinc/23/16/75/191231675.db2.gz WFJIYFAUKNJEOF-SNVBAGLBSA-N 1 2 233.311 2.240 20 0 BEADLO COCCN(c1cc[nH+]c(C)n1)C1CCCC1 ZINC000608081713 352734757 /nfs/dbraw/zinc/73/47/57/352734757.db2.gz WGHZBTSJRYAZJR-UHFFFAOYSA-N 1 2 235.331 2.180 20 0 BEADLO Cc1[nH+]cccc1N[C@@H](C)C[C@H]1CCCC(=O)N1 ZINC000638787435 352742626 /nfs/dbraw/zinc/74/26/26/352742626.db2.gz ZNGPVWNMNKJZSR-CMPLNLGQSA-N 1 2 247.342 2.249 20 0 BEADLO Cc1c[nH+]cc(N[C@H](C)C[C@@H]2CCCC(=O)N2)c1 ZINC000638787526 352743604 /nfs/dbraw/zinc/74/36/04/352743604.db2.gz KIOAQOJAUKQZPL-NEPJUHHUSA-N 1 2 247.342 2.249 20 0 BEADLO OC[C@@H]1C[C@H](F)C[N@@H+]1Cc1sccc1Cl ZINC000334218918 352820355 /nfs/dbraw/zinc/82/03/55/352820355.db2.gz IRVJDELQAXECRB-YUMQZZPRSA-N 1 2 249.738 2.306 20 0 BEADLO OC[C@@H]1C[C@H](F)C[N@H+]1Cc1sccc1Cl ZINC000334218918 352820357 /nfs/dbraw/zinc/82/03/57/352820357.db2.gz IRVJDELQAXECRB-YUMQZZPRSA-N 1 2 249.738 2.306 20 0 BEADLO Cc1cnc(C[N@@H+]2CCc3ccc(O)cc3C2)o1 ZINC000334207016 352802639 /nfs/dbraw/zinc/80/26/39/352802639.db2.gz DPMYVSKTPBRWSN-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO Cc1cnc(C[N@H+]2CCc3ccc(O)cc3C2)o1 ZINC000334207016 352802641 /nfs/dbraw/zinc/80/26/41/352802641.db2.gz DPMYVSKTPBRWSN-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO Cc1c[nH+]c(CN2CCS[C@@H](C)[C@@H]2C)n1C ZINC000342804186 352859423 /nfs/dbraw/zinc/85/94/23/352859423.db2.gz AUAVXKBSLQDUGC-QWRGUYRKSA-N 1 2 239.388 2.054 20 0 BEADLO Cc1c[nH+]c(CN2CCS[C@H](C)[C@@H]2C)n1C ZINC000342804187 352859537 /nfs/dbraw/zinc/85/95/37/352859537.db2.gz AUAVXKBSLQDUGC-WDEREUQCSA-N 1 2 239.388 2.054 20 0 BEADLO CNC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000334245226 352834726 /nfs/dbraw/zinc/83/47/26/352834726.db2.gz RQVLAXWTFUESFE-UHFFFAOYSA-N 1 2 228.251 2.234 20 0 BEADLO Cc1c[nH+]c(CN2CC[C@@H](C)C(F)(F)C2)n1C ZINC000342853609 352876747 /nfs/dbraw/zinc/87/67/47/352876747.db2.gz OQOKLPLAWLBHRE-SECBINFHSA-N 1 2 243.301 2.206 20 0 BEADLO C[C@@H](C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1)C1CC1 ZINC000334249592 352842602 /nfs/dbraw/zinc/84/26/02/352842602.db2.gz WHBRBWVSGFUKEQ-MWLCHTKSSA-N 1 2 233.315 2.119 20 0 BEADLO C[C@H]1C[N@H+](Cc2cn(C)nn2)[C@@H]1c1ccccc1 ZINC000334249328 352842695 /nfs/dbraw/zinc/84/26/95/352842695.db2.gz VDNBWZRMFXPFRB-FZMZJTMJSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cn(C)nn2)[C@@H]1c1ccccc1 ZINC000334249328 352842697 /nfs/dbraw/zinc/84/26/97/352842697.db2.gz VDNBWZRMFXPFRB-FZMZJTMJSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@@H](C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1)C1CC1 ZINC000334249590 352842751 /nfs/dbraw/zinc/84/27/51/352842751.db2.gz WHBRBWVSGFUKEQ-KOLCDFICSA-N 1 2 233.315 2.119 20 0 BEADLO Cc1nocc1C[NH2+][C@@H]1COc2ccc(F)cc21 ZINC000334228545 352845290 /nfs/dbraw/zinc/84/52/90/352845290.db2.gz OOYAORNPSCTTME-GFCCVEGCSA-N 1 2 248.257 2.345 20 0 BEADLO Cc1nocc1C[NH2+][C@H]1COc2ccc(F)cc21 ZINC000334228546 352845331 /nfs/dbraw/zinc/84/53/31/352845331.db2.gz OOYAORNPSCTTME-LBPRGKRZSA-N 1 2 248.257 2.345 20 0 BEADLO CC(C)c1noc(C[N@@H+]2C[C@H](C)[C@H]2C)n1 ZINC000334229076 352846151 /nfs/dbraw/zinc/84/61/51/352846151.db2.gz HSDKLHJDBJWYHC-DTWKUNHWSA-N 1 2 209.293 2.033 20 0 BEADLO CC(C)c1noc(C[N@H+]2C[C@H](C)[C@H]2C)n1 ZINC000334229076 352846153 /nfs/dbraw/zinc/84/61/53/352846153.db2.gz HSDKLHJDBJWYHC-DTWKUNHWSA-N 1 2 209.293 2.033 20 0 BEADLO C(c1noc(C2CC2)n1)[N@@H+]1CC[C@@H]2CCC[C@H]21 ZINC000334272234 352909216 /nfs/dbraw/zinc/90/92/16/352909216.db2.gz WUXGWZKHOGPJQG-GXSJLCMTSA-N 1 2 233.315 2.321 20 0 BEADLO C(c1noc(C2CC2)n1)[N@H+]1CC[C@@H]2CCC[C@H]21 ZINC000334272234 352909217 /nfs/dbraw/zinc/90/92/17/352909217.db2.gz WUXGWZKHOGPJQG-GXSJLCMTSA-N 1 2 233.315 2.321 20 0 BEADLO Cc1c[nH+]c(CN2CCCC[C@H]2C(F)F)n1C ZINC000342861514 352879805 /nfs/dbraw/zinc/87/98/05/352879805.db2.gz QXCPHRUVVAVGDC-JTQLQIEISA-N 1 2 243.301 2.348 20 0 BEADLO Cc1cc(F)cc2c1C[N@H+]([C@@H](C)C(N)=O)CC2 ZINC000334339745 352975036 /nfs/dbraw/zinc/97/50/36/352975036.db2.gz BPHSLQOKLNWMGK-VIFPVBQESA-N 1 2 236.290 2.416 20 0 BEADLO Cc1cc(F)cc2c1C[N@@H+]([C@@H](C)C(N)=O)CC2 ZINC000334339745 352975038 /nfs/dbraw/zinc/97/50/38/352975038.db2.gz BPHSLQOKLNWMGK-VIFPVBQESA-N 1 2 236.290 2.416 20 0 BEADLO CC[C@@]1(C)COCC[N@@H+]1Cc1nc(C)c(C)o1 ZINC000334341428 352977483 /nfs/dbraw/zinc/97/74/83/352977483.db2.gz OJPCUFMSTPBIRL-ZDUSSCGKSA-N 1 2 238.331 2.292 20 0 BEADLO CC[C@@]1(C)COCC[N@H+]1Cc1nc(C)c(C)o1 ZINC000334341428 352977486 /nfs/dbraw/zinc/97/74/86/352977486.db2.gz OJPCUFMSTPBIRL-ZDUSSCGKSA-N 1 2 238.331 2.292 20 0 BEADLO Cc1cnc(C[N@@H+]2CCc3ccsc3C2)nc1 ZINC000334300734 352937704 /nfs/dbraw/zinc/93/77/04/352937704.db2.gz VIRUYXFTIXRICR-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cnc(C[N@H+]2CCc3ccsc3C2)nc1 ZINC000334300734 352937706 /nfs/dbraw/zinc/93/77/06/352937706.db2.gz VIRUYXFTIXRICR-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO O=C(c1ccccc1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000334322897 352960483 /nfs/dbraw/zinc/96/04/83/352960483.db2.gz IZFNLEQZTOHWGA-LBPRGKRZSA-N 1 2 241.294 2.387 20 0 BEADLO CO[C@@](C)(C[N@@H+]1CCC(F)(F)C1)C1CC1 ZINC000638842304 353018496 /nfs/dbraw/zinc/01/84/96/353018496.db2.gz OKXMZCYYPPPSBS-JTQLQIEISA-N 1 2 219.275 2.143 20 0 BEADLO CO[C@@](C)(C[N@H+]1CCC(F)(F)C1)C1CC1 ZINC000638842304 353018498 /nfs/dbraw/zinc/01/84/98/353018498.db2.gz OKXMZCYYPPPSBS-JTQLQIEISA-N 1 2 219.275 2.143 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+]C[C@@H](C)c1ccccc1 ZINC000049370156 187952462 /nfs/dbraw/zinc/95/24/62/187952462.db2.gz RZZQPQXCTVDMBT-VXGBXAGGSA-N 1 2 235.327 2.331 20 0 BEADLO Cc1nc(N(C)C2Cc3ccccc3C2)cc[nH+]1 ZINC000266380529 188022080 /nfs/dbraw/zinc/02/20/80/188022080.db2.gz MWFCQWKXZCQQEA-UHFFFAOYSA-N 1 2 239.322 2.389 20 0 BEADLO Cc1nc(N(C)[C@@H](C)c2cccnc2)cc[nH+]1 ZINC000266317054 188022748 /nfs/dbraw/zinc/02/27/48/188022748.db2.gz FEEJDAUMEUDKQP-JTQLQIEISA-N 1 2 228.299 2.377 20 0 BEADLO CC(C)N1CC[N@@H+]([C@H](C)c2ccccc2)CC1=O ZINC000272483802 188026081 /nfs/dbraw/zinc/02/60/81/188026081.db2.gz BLJIAGJVSIDAMA-CYBMUJFWSA-N 1 2 246.354 2.300 20 0 BEADLO CC(C)N1CC[N@H+]([C@H](C)c2ccccc2)CC1=O ZINC000272483802 188026082 /nfs/dbraw/zinc/02/60/82/188026082.db2.gz BLJIAGJVSIDAMA-CYBMUJFWSA-N 1 2 246.354 2.300 20 0 BEADLO Cn1cccc1C(=O)C[N@@H+]1CCC[C@@](C)(F)C1 ZINC000295571913 188039710 /nfs/dbraw/zinc/03/97/10/188039710.db2.gz YWRYQGICVFVWJU-CYBMUJFWSA-N 1 2 238.306 2.032 20 0 BEADLO Cn1cccc1C(=O)C[N@H+]1CCC[C@@](C)(F)C1 ZINC000295571913 188039712 /nfs/dbraw/zinc/03/97/12/188039712.db2.gz YWRYQGICVFVWJU-CYBMUJFWSA-N 1 2 238.306 2.032 20 0 BEADLO CC(C)[N@H+](Cc1cccc(Cl)n1)C1COC1 ZINC000295292743 188039872 /nfs/dbraw/zinc/03/98/72/188039872.db2.gz DTQHENRQMIPSEG-UHFFFAOYSA-N 1 2 240.734 2.344 20 0 BEADLO CC(C)[N@@H+](Cc1cccc(Cl)n1)C1COC1 ZINC000295292743 188039874 /nfs/dbraw/zinc/03/98/74/188039874.db2.gz DTQHENRQMIPSEG-UHFFFAOYSA-N 1 2 240.734 2.344 20 0 BEADLO CC(=O)c1ccc(C[N@@H+](C(C)C)C2COC2)cc1 ZINC000295425777 188039932 /nfs/dbraw/zinc/03/99/32/188039932.db2.gz NSDLDUYKASEVCT-UHFFFAOYSA-N 1 2 247.338 2.498 20 0 BEADLO CC(=O)c1ccc(C[N@H+](C(C)C)C2COC2)cc1 ZINC000295425777 188039935 /nfs/dbraw/zinc/03/99/35/188039935.db2.gz NSDLDUYKASEVCT-UHFFFAOYSA-N 1 2 247.338 2.498 20 0 BEADLO CC[C@@H](F)C[N@H+](C)Cc1ccnn1CC ZINC000352342183 188053988 /nfs/dbraw/zinc/05/39/88/188053988.db2.gz OZIWNYIZIPNKQE-SNVBAGLBSA-N 1 2 213.300 2.083 20 0 BEADLO CC[C@@H](F)C[N@@H+](C)Cc1ccnn1CC ZINC000352342183 188053989 /nfs/dbraw/zinc/05/39/89/188053989.db2.gz OZIWNYIZIPNKQE-SNVBAGLBSA-N 1 2 213.300 2.083 20 0 BEADLO Cc1csc(C[N@@H+](C)CC2=CCCOC2)n1 ZINC000093336458 538109894 /nfs/dbraw/zinc/10/98/94/538109894.db2.gz ZRGUBSLMYBXXED-UHFFFAOYSA-N 1 2 238.356 2.230 20 0 BEADLO Cc1csc(C[N@H+](C)CC2=CCCOC2)n1 ZINC000093336458 538109895 /nfs/dbraw/zinc/10/98/95/538109895.db2.gz ZRGUBSLMYBXXED-UHFFFAOYSA-N 1 2 238.356 2.230 20 0 BEADLO COc1ccc(C[NH2+]Cc2ccon2)cc1F ZINC000093305775 538109736 /nfs/dbraw/zinc/10/97/36/538109736.db2.gz CYSYBMORAZEEKL-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO Cc1cc(N[C@H](c2nccn2C)C2CC2)nc[nH+]1 ZINC000343266343 353279147 /nfs/dbraw/zinc/27/91/47/353279147.db2.gz REFKXVPTEIQRTR-LBPRGKRZSA-N 1 2 243.314 2.082 20 0 BEADLO Cc1cc(N[C@H](c2[nH+]ccn2C)C2CC2)ncn1 ZINC000343266343 353279148 /nfs/dbraw/zinc/27/91/48/353279148.db2.gz REFKXVPTEIQRTR-LBPRGKRZSA-N 1 2 243.314 2.082 20 0 BEADLO COc1ccc(CNc2cc(C)[nH+]cn2)cc1O ZINC000301275362 188232777 /nfs/dbraw/zinc/23/27/77/188232777.db2.gz RVYLAYPZBMPFCS-UHFFFAOYSA-N 1 2 245.282 2.111 20 0 BEADLO Cc1cc(N(C)[C@@H]2CCC[C@@H]2O)nc(C2CC2)[nH+]1 ZINC000343268736 353284927 /nfs/dbraw/zinc/28/49/27/353284927.db2.gz WTPUKVKBMGTGQX-NEPJUHHUSA-N 1 2 247.342 2.012 20 0 BEADLO CC(C)[N@H+](C)Cc1c(Br)cnn1C ZINC000279531728 188268517 /nfs/dbraw/zinc/26/85/17/188268517.db2.gz PEVVWDIWKVDENZ-UHFFFAOYSA-N 1 2 246.152 2.023 20 0 BEADLO CC(C)[N@@H+](C)Cc1c(Br)cnn1C ZINC000279531728 188268519 /nfs/dbraw/zinc/26/85/19/188268519.db2.gz PEVVWDIWKVDENZ-UHFFFAOYSA-N 1 2 246.152 2.023 20 0 BEADLO c1[nH]nnc1C[NH2+][C@@H]1CCCCC12CCCC2 ZINC000398300999 363214275 /nfs/dbraw/zinc/21/42/75/363214275.db2.gz RDHMEEHJVYGXMT-GFCCVEGCSA-N 1 2 234.347 2.397 20 0 BEADLO c1n[nH]nc1C[NH2+][C@@H]1CCCCC12CCCC2 ZINC000398300999 363214279 /nfs/dbraw/zinc/21/42/79/363214279.db2.gz RDHMEEHJVYGXMT-GFCCVEGCSA-N 1 2 234.347 2.397 20 0 BEADLO COc1ccc(NCc2cscn2)[nH+]c1 ZINC000225893862 538114570 /nfs/dbraw/zinc/11/45/70/538114570.db2.gz SDKFZRAMELYMQP-UHFFFAOYSA-N 1 2 221.285 2.159 20 0 BEADLO Cc1ccc(C[NH2+]Cc2ccno2)c(F)c1 ZINC000639040808 353318361 /nfs/dbraw/zinc/31/83/61/353318361.db2.gz BGZMFJBDGZGGEC-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO C[N@H+](Cc1ccns1)Cc1ccccn1 ZINC000639041215 353319271 /nfs/dbraw/zinc/31/92/71/353319271.db2.gz JGTRVRKTVRQBFW-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO C[N@@H+](Cc1ccns1)Cc1ccccn1 ZINC000639041215 353319273 /nfs/dbraw/zinc/31/92/73/353319273.db2.gz JGTRVRKTVRQBFW-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO FC1C[NH+](C[C@@H]2CCc3ccccc3C2)C1 ZINC000639039846 353320577 /nfs/dbraw/zinc/32/05/77/353320577.db2.gz XSJNOJGYGHFDMN-LLVKDONJSA-N 1 2 219.303 2.445 20 0 BEADLO CC[C@@]1(C)COCC[N@@H+]1Cc1cc(C)ns1 ZINC000639058417 353363909 /nfs/dbraw/zinc/36/39/09/353363909.db2.gz MCUAHRMCBLHKTA-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO CC[C@@]1(C)COCC[N@H+]1Cc1cc(C)ns1 ZINC000639058417 353363913 /nfs/dbraw/zinc/36/39/13/353363913.db2.gz MCUAHRMCBLHKTA-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO CC[N@H+](CC(F)F)C[C@@](C)(CC)OC ZINC000639059376 353363974 /nfs/dbraw/zinc/36/39/74/353363974.db2.gz JVLJCJDXCYKUNV-SNVBAGLBSA-N 1 2 209.280 2.389 20 0 BEADLO CC[N@@H+](CC(F)F)C[C@@](C)(CC)OC ZINC000639059376 353363976 /nfs/dbraw/zinc/36/39/76/353363976.db2.gz JVLJCJDXCYKUNV-SNVBAGLBSA-N 1 2 209.280 2.389 20 0 BEADLO CC(C)(C)c1cnc(C[NH2+]CCF)s1 ZINC000308524140 188340539 /nfs/dbraw/zinc/34/05/39/188340539.db2.gz QEYPPNIMIUUFCU-UHFFFAOYSA-N 1 2 216.325 2.500 20 0 BEADLO CC1(C)Cc2cc(C[NH+]3CCOCC3)ccc2O1 ZINC000154528190 188332555 /nfs/dbraw/zinc/33/25/55/188332555.db2.gz OQFZPXQRWCCNBL-UHFFFAOYSA-N 1 2 247.338 2.232 20 0 BEADLO Cc1ccc(NC(=O)NCC(C)C)c(C)[nH+]1 ZINC000152370030 188332948 /nfs/dbraw/zinc/33/29/48/188332948.db2.gz UMWLITGBMNMKCP-UHFFFAOYSA-N 1 2 221.304 2.476 20 0 BEADLO CC[N@H+](CC(F)F)C[C@](C)(OC)C1CC1 ZINC000639060570 353367566 /nfs/dbraw/zinc/36/75/66/353367566.db2.gz NGGJNTNCUCHZKO-NSHDSACASA-N 1 2 221.291 2.389 20 0 BEADLO CC[N@@H+](CC(F)F)C[C@](C)(OC)C1CC1 ZINC000639060570 353367568 /nfs/dbraw/zinc/36/75/68/353367568.db2.gz NGGJNTNCUCHZKO-NSHDSACASA-N 1 2 221.291 2.389 20 0 BEADLO C/C=C(\C)C(=O)NCc1cn2c(cccc2C)[nH+]1 ZINC000176284908 188341441 /nfs/dbraw/zinc/34/14/41/188341441.db2.gz QFPLKWAHLCZONH-ONNFQVAWSA-N 1 2 243.310 2.225 20 0 BEADLO CC[N@H+](CCC[C@@H]1CCO1)CC(F)F ZINC000639062869 353376676 /nfs/dbraw/zinc/37/66/76/353376676.db2.gz VPDAQZWKUISOKB-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CC[N@@H+](CCC[C@@H]1CCO1)CC(F)F ZINC000639062869 353376677 /nfs/dbraw/zinc/37/66/77/353376677.db2.gz VPDAQZWKUISOKB-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CC(=O)Nc1nc(C[N@@H+](C)C2CCC2)cs1 ZINC000266583628 188373239 /nfs/dbraw/zinc/37/32/39/188373239.db2.gz IXDMQORPDZWJJS-UHFFFAOYSA-N 1 2 239.344 2.086 20 0 BEADLO CC(=O)Nc1nc(C[N@H+](C)C2CCC2)cs1 ZINC000266583628 188373241 /nfs/dbraw/zinc/37/32/41/188373241.db2.gz IXDMQORPDZWJJS-UHFFFAOYSA-N 1 2 239.344 2.086 20 0 BEADLO Cc1cccc([S@](=O)Cc2c[nH+]cn2C)c1 ZINC000268249112 188373743 /nfs/dbraw/zinc/37/37/43/188373743.db2.gz ZBEGGNKYWMHDCT-MRXNPFEDSA-N 1 2 234.324 2.036 20 0 BEADLO Cc1csc(C[NH2+][C@@H]2CCCc3cn[nH]c32)n1 ZINC000268883763 188374045 /nfs/dbraw/zinc/37/40/45/188374045.db2.gz YJWDXIFFCVWDDO-SNVBAGLBSA-N 1 2 248.355 2.342 20 0 BEADLO Cc1csc(C[NH2+][C@@H]2CCCc3c[nH]nc32)n1 ZINC000268883763 188374047 /nfs/dbraw/zinc/37/40/47/188374047.db2.gz YJWDXIFFCVWDDO-SNVBAGLBSA-N 1 2 248.355 2.342 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)sn1 ZINC000639085528 353425570 /nfs/dbraw/zinc/42/55/70/353425570.db2.gz HJNAYYLPNXTAMD-AXFHLTTASA-N 1 2 240.372 2.449 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)sn1 ZINC000639085528 353425571 /nfs/dbraw/zinc/42/55/71/353425571.db2.gz HJNAYYLPNXTAMD-AXFHLTTASA-N 1 2 240.372 2.449 20 0 BEADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccn(C)n2)o1 ZINC000112341609 188363580 /nfs/dbraw/zinc/36/35/80/188363580.db2.gz QODNMBKDBMPAIU-GXFFZTMASA-N 1 2 245.326 2.426 20 0 BEADLO Cc1ccccc1C1CC([NH2+]Cc2c[nH]nn2)C1 ZINC000398358338 363224427 /nfs/dbraw/zinc/22/44/27/363224427.db2.gz WIQWLXARHVEFNC-UHFFFAOYSA-N 1 2 242.326 2.149 20 0 BEADLO COC1CC(N(C)c2cc[nH+]c3ccncc32)C1 ZINC000343296482 353408218 /nfs/dbraw/zinc/40/82/18/353408218.db2.gz ZBNVTGVBWUGBIU-UHFFFAOYSA-N 1 2 243.310 2.243 20 0 BEADLO Cc1ccccc1C1CC([NH2+]Cc2cn[nH]n2)C1 ZINC000398358338 363224436 /nfs/dbraw/zinc/22/44/36/363224436.db2.gz WIQWLXARHVEFNC-UHFFFAOYSA-N 1 2 242.326 2.149 20 0 BEADLO Cc1cnc([C@H](C)Nc2cc(C)[nH+]cn2)o1 ZINC000226547949 538116745 /nfs/dbraw/zinc/11/67/45/538116745.db2.gz IRAVYVCVXJMPGA-VIFPVBQESA-N 1 2 218.260 2.255 20 0 BEADLO Cc1[nH]ncc1C[NH2+]C1(c2ccccc2)CC1 ZINC000264567681 188370622 /nfs/dbraw/zinc/37/06/22/188370622.db2.gz VGDMIUPYYZFQSN-UHFFFAOYSA-N 1 2 227.311 2.497 20 0 BEADLO C=Cn1cc(C[N@@H+](C)Cc2conc2CC)cn1 ZINC000293753885 188391387 /nfs/dbraw/zinc/39/13/87/188391387.db2.gz XBYDEKUWGDCORA-UHFFFAOYSA-N 1 2 246.314 2.166 20 0 BEADLO C=Cn1cc(C[N@H+](C)Cc2conc2CC)cn1 ZINC000293753885 188391388 /nfs/dbraw/zinc/39/13/88/188391388.db2.gz XBYDEKUWGDCORA-UHFFFAOYSA-N 1 2 246.314 2.166 20 0 BEADLO Cc1nc(N(C)CC2(O)CCCCCC2)cc[nH+]1 ZINC000275063539 188378919 /nfs/dbraw/zinc/37/89/19/188378919.db2.gz WUELSQPUAPYTHQ-UHFFFAOYSA-N 1 2 249.358 2.307 20 0 BEADLO Cc1ccc(C[N@@H+]2C[C@H](F)C[C@H]2CO)c(F)c1 ZINC000639086817 353428562 /nfs/dbraw/zinc/42/85/62/353428562.db2.gz TZCUYTFKQPSATH-NEPJUHHUSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1ccc(C[N@H+]2C[C@H](F)C[C@H]2CO)c(F)c1 ZINC000639086817 353428565 /nfs/dbraw/zinc/42/85/65/353428565.db2.gz TZCUYTFKQPSATH-NEPJUHHUSA-N 1 2 241.281 2.039 20 0 BEADLO C/C=C(\CC)C(=O)OCc1c[nH+]ccc1OC ZINC000286805171 188387462 /nfs/dbraw/zinc/38/74/62/188387462.db2.gz KLYVAWZIEJMBKE-ONNFQVAWSA-N 1 2 235.283 2.490 20 0 BEADLO CC(C)N(C)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000290614401 188389629 /nfs/dbraw/zinc/38/96/29/188389629.db2.gz ICSUWEOEKPUOPW-UHFFFAOYSA-N 1 2 232.287 2.206 20 0 BEADLO CC(C)Cn1cc(N[C@H]2CCn3cc[nH+]c32)cn1 ZINC000296257617 188394846 /nfs/dbraw/zinc/39/48/46/188394846.db2.gz BKYBGXIWWXADQC-LBPRGKRZSA-N 1 2 245.330 2.293 20 0 BEADLO c1ccc(N[C@@H]2CCO[C@@H]2C2CC2)[nH+]c1 ZINC000230307482 353485360 /nfs/dbraw/zinc/48/53/60/353485360.db2.gz FGRGCCPYAKYMND-ZYHUDNBSSA-N 1 2 204.273 2.061 20 0 BEADLO CSc1ccc(NCc2[nH+]cc(C)n2C)nc1 ZINC000341292638 188397710 /nfs/dbraw/zinc/39/77/10/188397710.db2.gz DIAPTZNBWYGYTA-UHFFFAOYSA-N 1 2 248.355 2.458 20 0 BEADLO CC(C)C[C@H](C)OC(=O)NCc1c[nH+]cn1C ZINC000297203895 188394667 /nfs/dbraw/zinc/39/46/67/188394667.db2.gz UZDGQSOJFAUCHU-JTQLQIEISA-N 1 2 239.319 2.081 20 0 BEADLO Cc1cnc([C@H](C)[NH2+][C@H](C)c2cnn(C)c2)o1 ZINC000230639965 353519109 /nfs/dbraw/zinc/51/91/09/353519109.db2.gz RHZVGGOAWIGNAP-ZJUUUORDSA-N 1 2 234.303 2.128 20 0 BEADLO Cc1ccn(C)c1C(=O)Nc1cc[nH+]cc1C ZINC000189748403 353533433 /nfs/dbraw/zinc/53/34/33/353533433.db2.gz KIUZKFNZTACJBK-UHFFFAOYSA-N 1 2 229.283 2.289 20 0 BEADLO CCC[C@@H](CC)NC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000577862734 366089319 /nfs/dbraw/zinc/08/93/19/366089319.db2.gz HKLVEXZLXWLDAX-GHMZBOCLSA-N 1 2 237.347 2.283 20 0 BEADLO CCC[C@@H](CC)NC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000577862734 366089326 /nfs/dbraw/zinc/08/93/26/366089326.db2.gz HKLVEXZLXWLDAX-GHMZBOCLSA-N 1 2 237.347 2.283 20 0 BEADLO Cc1cc(C[N@H+]2CC(C)(C)OC[C@@H]2C)sn1 ZINC000639104677 353596225 /nfs/dbraw/zinc/59/62/25/353596225.db2.gz ZWFRFCRNFUZXJZ-JTQLQIEISA-N 1 2 240.372 2.451 20 0 BEADLO Cc1cc(C[N@@H+]2CC(C)(C)OC[C@@H]2C)sn1 ZINC000639104677 353596228 /nfs/dbraw/zinc/59/62/28/353596228.db2.gz ZWFRFCRNFUZXJZ-JTQLQIEISA-N 1 2 240.372 2.451 20 0 BEADLO Fc1ccccc1C1C[NH+](Cc2cnccn2)C1 ZINC000334516864 353622595 /nfs/dbraw/zinc/62/25/95/353622595.db2.gz SIANDFLGIYACIS-UHFFFAOYSA-N 1 2 243.285 2.215 20 0 BEADLO CCCNC(=O)C1([NH2+]CC(F)F)CCCCC1 ZINC000085863797 491054044 /nfs/dbraw/zinc/05/40/44/491054044.db2.gz MQOXNTYBFSVWRO-UHFFFAOYSA-N 1 2 248.317 2.070 20 0 BEADLO CC[C@@](C)([NH2+]CCCCCO)C(F)(F)F ZINC000308954754 353726207 /nfs/dbraw/zinc/72/62/07/353726207.db2.gz QDZJPMNGVJRWGL-SECBINFHSA-N 1 2 227.270 2.470 20 0 BEADLO Fc1ccccc1C[NH2+][C@H]1CCn2ccnc21 ZINC000294040675 181013266 /nfs/dbraw/zinc/01/32/66/181013266.db2.gz IPKGXPZAHZJKQE-LBPRGKRZSA-N 1 2 231.274 2.257 20 0 BEADLO CC(C)(C)[C@@H]1C[N@H+](Cc2ccns2)CCO1 ZINC000639120333 353767788 /nfs/dbraw/zinc/76/77/88/353767788.db2.gz VVAJYFHBJXSFER-NSHDSACASA-N 1 2 240.372 2.390 20 0 BEADLO CC(C)(C)[C@@H]1C[N@@H+](Cc2ccns2)CCO1 ZINC000639120333 353767790 /nfs/dbraw/zinc/76/77/90/353767790.db2.gz VVAJYFHBJXSFER-NSHDSACASA-N 1 2 240.372 2.390 20 0 BEADLO CC(C)([NH2+]Cc1ccc(CO)cc1)C(F)F ZINC000639120319 353767931 /nfs/dbraw/zinc/76/79/31/353767931.db2.gz QCEIHTZIQZPNGO-UHFFFAOYSA-N 1 2 229.270 2.312 20 0 BEADLO CC1C[NH+](Cc2ccncc2Br)C1 ZINC000639122667 353780507 /nfs/dbraw/zinc/78/05/07/353780507.db2.gz DQCVTKDCXKRSMS-UHFFFAOYSA-N 1 2 241.132 2.296 20 0 BEADLO Fc1ccccc1C1C[NH+](Cc2cncnc2)C1 ZINC000336339664 181010333 /nfs/dbraw/zinc/01/03/33/181010333.db2.gz OOGLOXFQIGXZOE-UHFFFAOYSA-N 1 2 243.285 2.215 20 0 BEADLO Fc1c[nH+]ccc1NCc1cscn1 ZINC000225406810 181021001 /nfs/dbraw/zinc/02/10/01/181021001.db2.gz YVMSKQITRQVSID-UHFFFAOYSA-N 1 2 209.249 2.289 20 0 BEADLO CC[C@H](C)[C@@H](C[NH2+]C1(C(F)F)CC1)OC ZINC000639139597 353856100 /nfs/dbraw/zinc/85/61/00/353856100.db2.gz MTYIWRKNRLAESC-DTWKUNHWSA-N 1 2 221.291 2.435 20 0 BEADLO CC[C@H](C)[C@@H](CN1CC[N@@H+](CC)C[C@@H]1C)OC ZINC000639161159 353942408 /nfs/dbraw/zinc/94/24/08/353942408.db2.gz WTMREEXTYHPEHN-MELADBBJSA-N 1 2 242.407 2.074 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1ccc2c(n1)CCC2 ZINC000334552463 353993434 /nfs/dbraw/zinc/99/34/34/353993434.db2.gz BKACNECVCFBXEB-CQSZACIVSA-N 1 2 246.354 2.181 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1ccc2c(n1)CCC2 ZINC000334552463 353993437 /nfs/dbraw/zinc/99/34/37/353993437.db2.gz BKACNECVCFBXEB-CQSZACIVSA-N 1 2 246.354 2.181 20 0 BEADLO CO[C@@H](C)CN(C)c1[nH+]c2ccccc2n1C ZINC000343816459 354012996 /nfs/dbraw/zinc/01/29/96/354012996.db2.gz SXIUANBUGSJHKW-JTQLQIEISA-N 1 2 233.315 2.044 20 0 BEADLO Fc1cccc([C@@H]2C[C@@H]2[NH+]2CCOCC2)c1 ZINC000334549883 354017689 /nfs/dbraw/zinc/01/76/89/354017689.db2.gz XNMSFJZPEHVFOI-STQMWFEESA-N 1 2 221.275 2.014 20 0 BEADLO C[C@@H]1CC[C@@H]1[NH+]=c1[nH]c2c(cccc2F)n1C ZINC000343842664 354020402 /nfs/dbraw/zinc/02/04/02/354020402.db2.gz HIBAIYCGASFOLF-SCZZXKLOSA-N 1 2 233.290 2.345 20 0 BEADLO c1ccc(N[C@@H]2CCO[C@H]2C2CC2)[nH+]c1 ZINC000230307488 363303673 /nfs/dbraw/zinc/30/36/73/363303673.db2.gz FGRGCCPYAKYMND-PWSUYJOCSA-N 1 2 204.273 2.061 20 0 BEADLO FC1C[NH+](C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000334565822 354086535 /nfs/dbraw/zinc/08/65/35/354086535.db2.gz XYKUUIIFOUSZRQ-AAEUAGOBSA-N 1 2 205.276 2.444 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1CCO[C@@H](C)C1 ZINC000334568958 354093796 /nfs/dbraw/zinc/09/37/96/354093796.db2.gz GTLMBVOZYLMINP-JQWIXIFHSA-N 1 2 248.326 2.452 20 0 BEADLO Cc1ccoc1CN(C)c1cc(C)[nH+]cn1 ZINC000334569341 354094736 /nfs/dbraw/zinc/09/47/36/354094736.db2.gz KBURXYJAHSTZFN-UHFFFAOYSA-N 1 2 217.272 2.323 20 0 BEADLO Cc1nc(N2CC(C(C)(C)C)C2)cc[nH+]1 ZINC000334574373 354105117 /nfs/dbraw/zinc/10/51/17/354105117.db2.gz BICHEJCCPIWMQB-UHFFFAOYSA-N 1 2 205.305 2.267 20 0 BEADLO CCC1CN(c2nc(C)[nH+]c(C)c2C)C1 ZINC000334576081 354108307 /nfs/dbraw/zinc/10/83/07/354108307.db2.gz INNALEYHMMGFAC-UHFFFAOYSA-N 1 2 205.305 2.248 20 0 BEADLO C[C@H](C(=O)NC[C@H]1CCC[C@@H](C)C1)n1cc[nH+]c1 ZINC000055487864 1172172126 /nfs/dbraw/zinc/17/21/26/1172172126.db2.gz ZVZLYEORKCBIGO-UPJWGTAASA-N 1 2 249.358 2.387 20 0 BEADLO C[N@H+](CC(F)F)C[C@H](O)CC1CCCC1 ZINC000232145550 363365269 /nfs/dbraw/zinc/36/52/69/363365269.db2.gz IRUFXYMOIAURHE-SNVBAGLBSA-N 1 2 221.291 2.125 20 0 BEADLO C[N@@H+](CC(F)F)C[C@H](O)CC1CCCC1 ZINC000232145550 363365274 /nfs/dbraw/zinc/36/52/74/363365274.db2.gz IRUFXYMOIAURHE-SNVBAGLBSA-N 1 2 221.291 2.125 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1CC(=O)Nc1ccccc1F ZINC000334607276 354314455 /nfs/dbraw/zinc/31/44/55/354314455.db2.gz DTNJIZOLJXPQQA-UWVGGRQHSA-N 1 2 236.290 2.247 20 0 BEADLO Cc1nc(C)c(C[NH2+]Cc2ccon2)s1 ZINC000086452650 491061787 /nfs/dbraw/zinc/06/17/87/491061787.db2.gz RPNVQERFMAOMSA-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO Fc1ccccc1C[NH2+]Cc1ccon1 ZINC000086452728 491061793 /nfs/dbraw/zinc/06/17/93/491061793.db2.gz SHGCWVDEPONUJX-UHFFFAOYSA-N 1 2 206.220 2.104 20 0 BEADLO C[C@H](CF)[NH2+][C@H](c1nnc[nH]1)C1CCCCC1 ZINC000639182944 354340127 /nfs/dbraw/zinc/34/01/27/354340127.db2.gz NEHSKYUDDPOYJI-KOLCDFICSA-N 1 2 240.326 2.374 20 0 BEADLO CC1(C)CCC[C@@H](C(=O)NCCc2[nH]cc[nH+]2)C1 ZINC000178902390 366178606 /nfs/dbraw/zinc/17/86/06/366178606.db2.gz NMWFOCCTDZPKNF-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO CC1(CO)C[NH+](Cc2ccc(Cl)s2)C1 ZINC000334645795 354434778 /nfs/dbraw/zinc/43/47/78/354434778.db2.gz JPSLPNYTGBYGOP-UHFFFAOYSA-N 1 2 231.748 2.216 20 0 BEADLO CC1(CO)C[NH+](Cc2cc(Cl)ccc2F)C1 ZINC000334646299 354436354 /nfs/dbraw/zinc/43/63/54/354436354.db2.gz MZIHSUIXISUERM-UHFFFAOYSA-N 1 2 243.709 2.293 20 0 BEADLO CC1(CO)C[NH+](Cc2sccc2Cl)C1 ZINC000334645092 354403875 /nfs/dbraw/zinc/40/38/75/354403875.db2.gz HBMUXWQEBDXNBI-UHFFFAOYSA-N 1 2 231.748 2.216 20 0 BEADLO O=C(Nc1c[nH+]c2n1CCCC2)c1ccccc1 ZINC000334694810 354485281 /nfs/dbraw/zinc/48/52/81/354485281.db2.gz FAOUQRFJZYTBMS-UHFFFAOYSA-N 1 2 241.294 2.472 20 0 BEADLO Cc1cc(NC(=O)N2CC[C@H]2C(C)C)cc[nH+]1 ZINC000334692785 354483143 /nfs/dbraw/zinc/48/31/43/354483143.db2.gz CVPDRUOTHQRPKE-LBPRGKRZSA-N 1 2 233.315 2.074 20 0 BEADLO CC(C)C1(C)CC[NH+](Cc2c[nH]nn2)CC1 ZINC000334650029 354441770 /nfs/dbraw/zinc/44/17/70/354441770.db2.gz BRVNNHFSFXFZMZ-UHFFFAOYSA-N 1 2 222.336 2.063 20 0 BEADLO CC(C)C1(C)CC[NH+](Cc2cn[nH]n2)CC1 ZINC000334650029 354441773 /nfs/dbraw/zinc/44/17/73/354441773.db2.gz BRVNNHFSFXFZMZ-UHFFFAOYSA-N 1 2 222.336 2.063 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C(C)(C)C(C)(F)F ZINC000334728193 354528736 /nfs/dbraw/zinc/52/87/36/354528736.db2.gz PLNMCNDUIGBUEB-UHFFFAOYSA-N 1 2 242.269 2.432 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)c2ccsc2)c2[nH+]ccn21 ZINC000334740178 354543597 /nfs/dbraw/zinc/54/35/97/354543597.db2.gz HWPFPBOZWQMZMI-PSASIEDQSA-N 1 2 247.323 2.380 20 0 BEADLO C[C@H]1CC[C@H](NC(=O)c2ccc3[nH+]ccn3c2)C1 ZINC000334699721 354492085 /nfs/dbraw/zinc/49/20/85/354492085.db2.gz RTBDDFMOFZUDOM-JQWIXIFHSA-N 1 2 243.310 2.253 20 0 BEADLO C[C@@H]1C[C@@H](NC2(C(F)F)CC2)c2[nH+]ccn21 ZINC000334704055 354497751 /nfs/dbraw/zinc/49/77/51/354497751.db2.gz XDDSQMQJDBCKJO-HTQZYQBOSA-N 1 2 227.258 2.276 20 0 BEADLO Cc1cc(N2CC(C)(C)C[C@@H]2C)nc[nH+]1 ZINC000334715605 354514212 /nfs/dbraw/zinc/51/42/12/354514212.db2.gz OQXXUDUDXXXTAY-JTQLQIEISA-N 1 2 205.305 2.410 20 0 BEADLO C[C@@H]1CC[N@H+](CCC2(O)CCC2)CC1(F)F ZINC000334813670 354571170 /nfs/dbraw/zinc/57/11/70/354571170.db2.gz YMLHDHDEQCQBOE-SNVBAGLBSA-N 1 2 233.302 2.269 20 0 BEADLO C[C@@H]1CC[N@@H+](CCC2(O)CCC2)CC1(F)F ZINC000334813670 354571173 /nfs/dbraw/zinc/57/11/73/354571173.db2.gz YMLHDHDEQCQBOE-SNVBAGLBSA-N 1 2 233.302 2.269 20 0 BEADLO C[C@H]1C[C@H](C(=O)N(C)Cc2[nH]cc[nH+]2)C[C@@H](C)C1 ZINC000334816017 354580691 /nfs/dbraw/zinc/58/06/91/354580691.db2.gz DFZJUPQAHJEFCZ-GDNZZTSVSA-N 1 2 249.358 2.440 20 0 BEADLO CCc1nc(C)c(C[N@@H+]2CCO[C@@H](C)[C@@H]2C)o1 ZINC000334762324 354582135 /nfs/dbraw/zinc/58/21/35/354582135.db2.gz KLIBOXNISWFPMX-QWRGUYRKSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1nc(C)c(C[N@H+]2CCO[C@@H](C)[C@@H]2C)o1 ZINC000334762324 354582136 /nfs/dbraw/zinc/58/21/36/354582136.db2.gz KLIBOXNISWFPMX-QWRGUYRKSA-N 1 2 238.331 2.155 20 0 BEADLO Cc1ccc(CN2CCn3c[nH+]cc3C2)c(F)c1 ZINC000639192884 354587796 /nfs/dbraw/zinc/58/77/96/354587796.db2.gz WNBPMWKMNXNCDV-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2ccncc2F)C1 ZINC000334767987 354589831 /nfs/dbraw/zinc/58/98/31/354589831.db2.gz ABUUCGUYLIFRSO-LLVKDONJSA-N 1 2 212.243 2.155 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2ccncc2F)C1 ZINC000334767987 354589835 /nfs/dbraw/zinc/58/98/35/354589835.db2.gz ABUUCGUYLIFRSO-LLVKDONJSA-N 1 2 212.243 2.155 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)c2ccccc2)c2[nH+]ccn21 ZINC000334743798 354547492 /nfs/dbraw/zinc/54/74/92/354547492.db2.gz NCORHMMVNKMWFP-ZYHUDNBSSA-N 1 2 241.294 2.319 20 0 BEADLO C[C@]1(C(=O)Nc2cccc3[nH+]ccn32)C[C@@H]1F ZINC000335094785 354633144 /nfs/dbraw/zinc/63/31/44/354633144.db2.gz KNBQAPABADCGSG-UFBFGSQYSA-N 1 2 233.246 2.021 20 0 BEADLO Cc1scc(C[N@@H+]2CCO[C@H]3C[C@H]32)c1C ZINC000639201522 354605880 /nfs/dbraw/zinc/60/58/80/354605880.db2.gz KGQYXTSJSBVQPR-NEPJUHHUSA-N 1 2 223.341 2.338 20 0 BEADLO Cc1scc(C[N@H+]2CCO[C@H]3C[C@H]32)c1C ZINC000639201522 354605883 /nfs/dbraw/zinc/60/58/83/354605883.db2.gz KGQYXTSJSBVQPR-NEPJUHHUSA-N 1 2 223.341 2.338 20 0 BEADLO CC(C)n1c[nH+]cc1CN1CCOCC12CCC2 ZINC000335083344 354616831 /nfs/dbraw/zinc/61/68/31/354616831.db2.gz HLPVKAZYFSJFBK-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO CC(C)n1cncc1C[N@@H+]1CCOCC12CCC2 ZINC000335083344 354616832 /nfs/dbraw/zinc/61/68/32/354616832.db2.gz HLPVKAZYFSJFBK-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO CC(C)n1cncc1C[N@H+]1CCOCC12CCC2 ZINC000335083344 354616835 /nfs/dbraw/zinc/61/68/35/354616835.db2.gz HLPVKAZYFSJFBK-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO Cc1cn2cc(NC(=O)[C@]3(C)C[C@@H]3F)ccc2[nH+]1 ZINC000335102400 354713675 /nfs/dbraw/zinc/71/36/75/354713675.db2.gz FYUDNFAYEMRBGH-GXFFZTMASA-N 1 2 247.273 2.329 20 0 BEADLO CCC(=O)N1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000335124493 354766240 /nfs/dbraw/zinc/76/62/40/354766240.db2.gz PZMPXGHXNMLPTN-LBPRGKRZSA-N 1 2 232.327 2.259 20 0 BEADLO CCC(=O)N1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000335124493 354766244 /nfs/dbraw/zinc/76/62/44/354766244.db2.gz PZMPXGHXNMLPTN-LBPRGKRZSA-N 1 2 232.327 2.259 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@]3(CCCO3)[C@@H]2C2CC2)on1 ZINC000639212431 354775831 /nfs/dbraw/zinc/77/58/31/354775831.db2.gz DOOUHAMJIODJOT-UONOGXRCSA-N 1 2 248.326 2.126 20 0 BEADLO Cc1cc(C[N@H+]2C[C@]3(CCCO3)[C@@H]2C2CC2)on1 ZINC000639212431 354775833 /nfs/dbraw/zinc/77/58/33/354775833.db2.gz DOOUHAMJIODJOT-UONOGXRCSA-N 1 2 248.326 2.126 20 0 BEADLO Cc1cccc(S(=O)(=O)Nc2cc[nH+]cc2)c1 ZINC000005863971 363400579 /nfs/dbraw/zinc/40/05/79/363400579.db2.gz DCVPPOBONIWIRH-UHFFFAOYSA-N 1 2 248.307 2.191 20 0 BEADLO Cc1ncc([C@@H](C)[N@H+](C2CC2)C2COC2)c(C)n1 ZINC000639215669 354821702 /nfs/dbraw/zinc/82/17/02/354821702.db2.gz FDWABQZWJJZPOM-SNVBAGLBSA-N 1 2 247.342 2.018 20 0 BEADLO Cc1ncc([C@@H](C)[N@@H+](C2CC2)C2COC2)c(C)n1 ZINC000639215669 354821705 /nfs/dbraw/zinc/82/17/05/354821705.db2.gz FDWABQZWJJZPOM-SNVBAGLBSA-N 1 2 247.342 2.018 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)CC2CCC2)c2[nH+]ccn21 ZINC000335141164 354845088 /nfs/dbraw/zinc/84/50/88/354845088.db2.gz OZLUBJGRRRDKJF-GXSJLCMTSA-N 1 2 233.315 2.195 20 0 BEADLO Cc1cc(F)c(C[N@@H+](C)[C@H]2CCOC2)c(F)c1 ZINC000335148727 354862656 /nfs/dbraw/zinc/86/26/56/354862656.db2.gz YDGHFVPBZFPFMZ-JTQLQIEISA-N 1 2 241.281 2.494 20 0 BEADLO Cc1cc(F)c(C[N@H+](C)[C@H]2CCOC2)c(F)c1 ZINC000335148727 354862657 /nfs/dbraw/zinc/86/26/57/354862657.db2.gz YDGHFVPBZFPFMZ-JTQLQIEISA-N 1 2 241.281 2.494 20 0 BEADLO CC[C@H](C)CN(C)C(=O)C(C)(C)c1c[nH+]c[nH]1 ZINC000346354345 354889197 /nfs/dbraw/zinc/88/91/97/354889197.db2.gz JGXKZLIQGFGMGT-JTQLQIEISA-N 1 2 237.347 2.192 20 0 BEADLO C[C@H]1c2ccccc2C[N@H+]1Cc1cc[nH]n1 ZINC000335167455 354926448 /nfs/dbraw/zinc/92/64/48/354926448.db2.gz VOZCGMDHSSVYJI-JTQLQIEISA-N 1 2 213.284 2.487 20 0 BEADLO C[C@H]1c2ccccc2C[N@@H+]1Cc1cc[nH]n1 ZINC000335167455 354926454 /nfs/dbraw/zinc/92/64/54/354926454.db2.gz VOZCGMDHSSVYJI-JTQLQIEISA-N 1 2 213.284 2.487 20 0 BEADLO CC(C)c1nc(N[C@@H](C)[C@H]2CCCCO2)cc[nH+]1 ZINC000346464864 354953405 /nfs/dbraw/zinc/95/34/05/354953405.db2.gz UKTHPNNEQFIJHG-NWDGAFQWSA-N 1 2 249.358 2.391 20 0 BEADLO COC(C)(C)CC[N@@H+]1CCC(F)(F)C1 ZINC000346527602 354976598 /nfs/dbraw/zinc/97/65/98/354976598.db2.gz BACPWUVTZPYSQY-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO COC(C)(C)CC[N@H+]1CCC(F)(F)C1 ZINC000346527602 354976602 /nfs/dbraw/zinc/97/66/02/354976602.db2.gz BACPWUVTZPYSQY-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO CC(C)c1nc(N2C[C@H](C)OC[C@H]2C)cc[nH+]1 ZINC000346591539 354986517 /nfs/dbraw/zinc/98/65/17/354986517.db2.gz JDRJNMJOFQAHLW-MNOVXSKESA-N 1 2 235.331 2.214 20 0 BEADLO COC1CCN(c2cc[nH+]c(C(C)C)n2)CC1 ZINC000346604424 354990321 /nfs/dbraw/zinc/99/03/21/354990321.db2.gz MMAMMXVWKFLKLF-UHFFFAOYSA-N 1 2 235.331 2.215 20 0 BEADLO CC[C@@](C)(O)C[N@@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000335201184 355034709 /nfs/dbraw/zinc/03/47/09/355034709.db2.gz HFOBLBDZOFKGNP-NXEZZACHSA-N 1 2 221.291 2.125 20 0 BEADLO CC[C@@](C)(O)C[N@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000335201184 355034714 /nfs/dbraw/zinc/03/47/14/355034714.db2.gz HFOBLBDZOFKGNP-NXEZZACHSA-N 1 2 221.291 2.125 20 0 BEADLO Fc1cccc2c1OCC[C@H]2[NH2+]Cc1ncc[nH]1 ZINC000335209378 355045896 /nfs/dbraw/zinc/04/58/96/355045896.db2.gz FCODNATWFOETEM-LLVKDONJSA-N 1 2 247.273 2.162 20 0 BEADLO Cc1cc(NCCc2ccco2)nc(C2CC2)[nH+]1 ZINC000346633701 355014704 /nfs/dbraw/zinc/01/47/04/355014704.db2.gz KPRQRMNZZVUIJW-UHFFFAOYSA-N 1 2 243.310 2.332 20 0 BEADLO Cc1c(Cl)c(C[NH2+][C@H]2CCC[C@H]2F)nn1C ZINC000335181432 355078668 /nfs/dbraw/zinc/07/86/68/355078668.db2.gz ZUZDYYDHPULITA-BDAKNGLRSA-N 1 2 245.729 2.362 20 0 BEADLO Cc1ncc([C@@H](C)[N@@H+]2CC[C@@H](F)C2)c(C)n1 ZINC000639228417 355105092 /nfs/dbraw/zinc/10/50/92/355105092.db2.gz OJVJRECQCDUFFT-MWLCHTKSSA-N 1 2 223.295 2.198 20 0 BEADLO Cc1ncc([C@@H](C)[N@H+]2CC[C@@H](F)C2)c(C)n1 ZINC000639228417 355105095 /nfs/dbraw/zinc/10/50/95/355105095.db2.gz OJVJRECQCDUFFT-MWLCHTKSSA-N 1 2 223.295 2.198 20 0 BEADLO C[C@H]1[C@H](CO)CCCN1c1[nH]c2ccccc2[nH+]1 ZINC000335233694 355094728 /nfs/dbraw/zinc/09/47/28/355094728.db2.gz RWLNQVPUMFCEMO-QWRGUYRKSA-N 1 2 245.326 2.160 20 0 BEADLO CO[C@@H]1CCC[N@H+](Cc2ncc(Cl)s2)C1 ZINC000335248991 355167140 /nfs/dbraw/zinc/16/71/40/355167140.db2.gz HJGPYSCDVRTOAT-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO CO[C@@H]1CCC[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000335248991 355167143 /nfs/dbraw/zinc/16/71/43/355167143.db2.gz HJGPYSCDVRTOAT-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO CC(C)c1nc(NC[C@@H]2CCCCO2)cc[nH+]1 ZINC000346939355 355158363 /nfs/dbraw/zinc/15/83/63/355158363.db2.gz IDOGISVNBVFIOA-NSHDSACASA-N 1 2 235.331 2.003 20 0 BEADLO Cn1cc[nH+]c1CNc1cnc2c(c1)CCCC2 ZINC000335242424 355178228 /nfs/dbraw/zinc/17/82/28/355178228.db2.gz SNIFQSNNNGXQGW-UHFFFAOYSA-N 1 2 242.326 2.306 20 0 BEADLO CC[C@H](C)CCc1nc(Cc2c[nH+]cn2C)no1 ZINC000346928895 355179127 /nfs/dbraw/zinc/17/91/27/355179127.db2.gz DXPQPZQGVXHHQD-JTQLQIEISA-N 1 2 248.330 2.373 20 0 BEADLO CC[C@@H](C)CCc1nc(Cc2c[nH+]cn2C)no1 ZINC000346928897 355179531 /nfs/dbraw/zinc/17/95/31/355179531.db2.gz DXPQPZQGVXHHQD-SNVBAGLBSA-N 1 2 248.330 2.373 20 0 BEADLO C[C@@H]1C[C@@H](C)N(c2cc(NC3CC3)[nH+]cn2)C1 ZINC000413157542 191356814 /nfs/dbraw/zinc/35/68/14/191356814.db2.gz UNHPRXMFLKZTNM-NXEZZACHSA-N 1 2 232.331 2.286 20 0 BEADLO C[C@@H]1C[C@@H](C)N(c2cc(NC3CC3)nc[nH+]2)C1 ZINC000413157542 191356816 /nfs/dbraw/zinc/35/68/16/191356816.db2.gz UNHPRXMFLKZTNM-NXEZZACHSA-N 1 2 232.331 2.286 20 0 BEADLO COC(=O)C(C)(C)[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000347630182 355240823 /nfs/dbraw/zinc/24/08/23/355240823.db2.gz IANOEQDQKVGQGJ-STQMWFEESA-N 1 2 247.338 2.331 20 0 BEADLO Cn1c2ccccc2[nH+]c1N1C[C@@H]2C[C@H]1CS2 ZINC000413460184 191382595 /nfs/dbraw/zinc/38/25/95/191382595.db2.gz SFVUKVIWWCJEST-UWVGGRQHSA-N 1 2 245.351 2.267 20 0 BEADLO CO[C@@H]1C[C@H](Nc2cc(C)[nH+]cn2)C12CCC2 ZINC000413446158 191384671 /nfs/dbraw/zinc/38/46/71/191384671.db2.gz PHORKNYGMOMJPU-WDEREUQCSA-N 1 2 233.315 2.155 20 0 BEADLO COCC[C@@H](C)CNc1cc(C)[nH+]c(C2CC2)n1 ZINC000413487719 191387434 /nfs/dbraw/zinc/38/74/34/191387434.db2.gz CQONEDSNGDXNDI-SNVBAGLBSA-N 1 2 249.358 2.169 20 0 BEADLO CO[C@@](C)([C@H](C)Nc1cc(C)[nH+]cn1)C1CC1 ZINC000413524977 191392782 /nfs/dbraw/zinc/39/27/82/191392782.db2.gz XKLTWNPHMJDCIA-GWCFXTLKSA-N 1 2 235.331 2.401 20 0 BEADLO CC(C)c1nc(NC[C@@H]2C[C@@H](C)O[C@@H]2C)cc[nH+]1 ZINC000413528450 191393073 /nfs/dbraw/zinc/39/30/73/191393073.db2.gz HBLRCFRQPUDDTQ-UTUOFQBUSA-N 1 2 249.358 2.247 20 0 BEADLO CC(C)c1nc(NC[C@H]2C[C@@H](C)O[C@H]2C)cc[nH+]1 ZINC000413528448 191393289 /nfs/dbraw/zinc/39/32/89/191393289.db2.gz HBLRCFRQPUDDTQ-GRYCIOLGSA-N 1 2 249.358 2.247 20 0 BEADLO COC1([C@@H](C)Nc2cc[nH+]c(C3CC3)n2)CCC1 ZINC000413554068 191395631 /nfs/dbraw/zinc/39/56/31/191395631.db2.gz BDQGIUQSSCHHCX-SNVBAGLBSA-N 1 2 247.342 2.145 20 0 BEADLO COC1([C@H](C)Nc2cc[nH+]c(C3CC3)n2)CCC1 ZINC000413554067 191395670 /nfs/dbraw/zinc/39/56/70/191395670.db2.gz BDQGIUQSSCHHCX-JTQLQIEISA-N 1 2 247.342 2.145 20 0 BEADLO CCCN(c1cc(NC2CC2)[nH+]cn1)C1CC1 ZINC000413239953 191363827 /nfs/dbraw/zinc/36/38/27/191363827.db2.gz ZJKZYZHXOUAOIB-UHFFFAOYSA-N 1 2 232.331 2.430 20 0 BEADLO CCCN(c1cc(NC2CC2)nc[nH+]1)C1CC1 ZINC000413239953 191363829 /nfs/dbraw/zinc/36/38/29/191363829.db2.gz ZJKZYZHXOUAOIB-UHFFFAOYSA-N 1 2 232.331 2.430 20 0 BEADLO FC(F)[C@H]1C[C@@H]1Nc1cc(NC2CC2)[nH+]cn1 ZINC000413289162 191369178 /nfs/dbraw/zinc/36/91/78/191369178.db2.gz GGBSSFCOIUMOTP-YUMQZZPRSA-N 1 2 240.257 2.116 20 0 BEADLO FC(F)[C@H]1C[C@@H]1Nc1cc(NC2CC2)nc[nH+]1 ZINC000413289162 191369181 /nfs/dbraw/zinc/36/91/81/191369181.db2.gz GGBSSFCOIUMOTP-YUMQZZPRSA-N 1 2 240.257 2.116 20 0 BEADLO C[C@@H]1CC[C@H](CNc2cc[nH+]c3ccncc23)O1 ZINC000413370848 191376707 /nfs/dbraw/zinc/37/67/07/191376707.db2.gz DGNHBBLETUFKBB-GHMZBOCLSA-N 1 2 243.310 2.031 20 0 BEADLO CC(C)c1nc(N[C@@H]2C[C@H]2C(C)C)cc[nH+]1 ZINC000413436303 191380581 /nfs/dbraw/zinc/38/05/81/191380581.db2.gz MQAHJRIHONJNRQ-WDEREUQCSA-N 1 2 219.332 2.478 20 0 BEADLO Cn1ccnc1[C@H](C1CC1)[NH+]1CC(C(F)F)C1 ZINC000639252879 355289403 /nfs/dbraw/zinc/28/94/03/355289403.db2.gz VIGGKNZRHRUDBJ-JTQLQIEISA-N 1 2 241.285 2.068 20 0 BEADLO Cc1csc2c1ncnc2-n1cc[nH+]c1 ZINC000191143019 355328714 /nfs/dbraw/zinc/32/87/14/355328714.db2.gz DLHCYEXGGQXOOK-UHFFFAOYSA-N 1 2 216.269 2.185 20 0 BEADLO CCc1cc(N[C@H](CC)C[C@@H](C)CO)nc[nH+]1 ZINC000608369419 355380683 /nfs/dbraw/zinc/38/06/83/355380683.db2.gz WSCYNLQFZSBPHD-ZYHUDNBSSA-N 1 2 237.347 2.248 20 0 BEADLO COc1ccsc1C[N@@H+]1CCc2n[nH]cc2C1 ZINC000623238692 355383487 /nfs/dbraw/zinc/38/34/87/355383487.db2.gz QFGJLRTZDKLYIY-UHFFFAOYSA-N 1 2 249.339 2.038 20 0 BEADLO COc1ccsc1C[N@H+]1CCc2n[nH]cc2C1 ZINC000623238692 355383491 /nfs/dbraw/zinc/38/34/91/355383491.db2.gz QFGJLRTZDKLYIY-UHFFFAOYSA-N 1 2 249.339 2.038 20 0 BEADLO O=C(CCCn1cc[nH+]c1)NCC1CCCCC1 ZINC000623238972 355384755 /nfs/dbraw/zinc/38/47/55/355384755.db2.gz CBTKOXJDFZRVGX-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](CC(=O)NC(C)(C)C)C2 ZINC000335788446 355439132 /nfs/dbraw/zinc/43/91/32/355439132.db2.gz XOXMUMPJVVLRHM-UHFFFAOYSA-N 1 2 246.354 2.225 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](CC(=O)NC(C)(C)C)C2 ZINC000335788446 355439134 /nfs/dbraw/zinc/43/91/34/355439134.db2.gz XOXMUMPJVVLRHM-UHFFFAOYSA-N 1 2 246.354 2.225 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)[C@H]1CCCCC1(C)C ZINC000335791007 355443144 /nfs/dbraw/zinc/44/31/44/355443144.db2.gz SRUFTWCKLOHLQO-LLVKDONJSA-N 1 2 249.358 2.253 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1cncc(C)c1 ZINC000335810986 355495397 /nfs/dbraw/zinc/49/53/97/355495397.db2.gz DGFSKXZIOBYUOB-UHFFFAOYSA-N 1 2 241.294 2.022 20 0 BEADLO FC1(F)Oc2ccc(Cn3cc[nH+]c3)cc2O1 ZINC000349816613 355468756 /nfs/dbraw/zinc/46/87/56/355468756.db2.gz OIUPDYVZXCKGQZ-UHFFFAOYSA-N 1 2 238.193 2.253 20 0 BEADLO CC(C)(C)n1cc(C[NH+]2CCCCC2)nn1 ZINC000335822548 355542574 /nfs/dbraw/zinc/54/25/74/355542574.db2.gz QOKXBGGBNMWFHB-UHFFFAOYSA-N 1 2 222.336 2.019 20 0 BEADLO FC1(F)CC12C[NH+](Cc1cc(C3CC3)no1)C2 ZINC000639293925 355548786 /nfs/dbraw/zinc/54/87/86/355548786.db2.gz BQASCXJWCPPGNZ-UHFFFAOYSA-N 1 2 240.253 2.393 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@H]1CC[C@@H](C)C1 ZINC000335827750 355553492 /nfs/dbraw/zinc/55/34/92/355553492.db2.gz MTMUMKDWBXMYIF-ZJUUUORDSA-N 1 2 234.299 2.465 20 0 BEADLO FC(F)(F)C1CN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000335830058 355556129 /nfs/dbraw/zinc/55/61/29/355556129.db2.gz MPISSCRPYHNCFW-UHFFFAOYSA-N 1 2 243.232 2.353 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1nccn1C(F)F ZINC000335818238 355509505 /nfs/dbraw/zinc/50/95/05/355509505.db2.gz NVBQOMNFHCKBOK-OCAPTIKFSA-N 1 2 215.247 2.261 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1nccn1C(F)F ZINC000335818238 355509508 /nfs/dbraw/zinc/50/95/08/355509508.db2.gz NVBQOMNFHCKBOK-OCAPTIKFSA-N 1 2 215.247 2.261 20 0 BEADLO CC(C)c1nc(N2CCO[C@@H](C(C)C)C2)cc[nH+]1 ZINC000349869226 355512792 /nfs/dbraw/zinc/51/27/92/355512792.db2.gz QMWWVLLKAZGOPD-GFCCVEGCSA-N 1 2 249.358 2.461 20 0 BEADLO c1csc(-c2noc(CCn3cc[nH+]c3)n2)c1 ZINC000349865909 355512879 /nfs/dbraw/zinc/51/28/79/355512879.db2.gz VBAPTRXCVLETQL-UHFFFAOYSA-N 1 2 246.295 2.237 20 0 BEADLO CC(C)[C@@H]1CN(c2[nH]c3ccccc3[nH+]2)CCO1 ZINC000349895503 355521227 /nfs/dbraw/zinc/52/12/27/355521227.db2.gz RHPSLUALQPIMMF-ZDUSSCGKSA-N 1 2 245.326 2.424 20 0 BEADLO c1ccc(N2CCC[C@H]2C2CCOCC2)[nH+]c1 ZINC000335847405 355591266 /nfs/dbraw/zinc/59/12/66/355591266.db2.gz JEOPBYNSLDSTNW-ZDUSSCGKSA-N 1 2 232.327 2.477 20 0 BEADLO Cc1cc(C[NH+]2CC3(CC3(F)F)C2)sn1 ZINC000639297267 355603113 /nfs/dbraw/zinc/60/31/13/355603113.db2.gz QRQJJYMJCPBYRB-UHFFFAOYSA-N 1 2 230.283 2.293 20 0 BEADLO CC(C)C[N@@H+]1CC(=O)N[C@@H]1[C@H]1CCC[C@@H](C)C1 ZINC000350129103 355610719 /nfs/dbraw/zinc/61/07/19/355610719.db2.gz YUUPCZMFRNTIAP-DYEKYZERSA-N 1 2 238.375 2.227 20 0 BEADLO CC(C)C[N@H+]1CC(=O)N[C@@H]1[C@H]1CCC[C@@H](C)C1 ZINC000350129103 355610723 /nfs/dbraw/zinc/61/07/23/355610723.db2.gz YUUPCZMFRNTIAP-DYEKYZERSA-N 1 2 238.375 2.227 20 0 BEADLO CCc1cc[nH+]cc1N[C@@H](C)[C@H](C)OC ZINC000639295109 355577616 /nfs/dbraw/zinc/57/76/16/355577616.db2.gz NDOLCUFVCROPGA-UWVGGRQHSA-N 1 2 208.305 2.479 20 0 BEADLO Cc1cnc(C[NH2+][C@H]2CCCN3CCCC[C@@H]23)o1 ZINC000639301522 355640683 /nfs/dbraw/zinc/64/06/83/355640683.db2.gz GERYXDSHMCHMGJ-STQMWFEESA-N 1 2 249.358 2.090 20 0 BEADLO F[C@@H]1CCC[N@H+](Cc2ccns2)C1 ZINC000639311747 355671885 /nfs/dbraw/zinc/67/18/85/355671885.db2.gz CSAGUIJQGQVJFX-MRVPVSSYSA-N 1 2 200.282 2.077 20 0 BEADLO F[C@@H]1CCC[N@@H+](Cc2ccns2)C1 ZINC000639311747 355671886 /nfs/dbraw/zinc/67/18/86/355671886.db2.gz CSAGUIJQGQVJFX-MRVPVSSYSA-N 1 2 200.282 2.077 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+]2CCO[C@@H](C(C)C)C2)o1 ZINC000335867673 355632922 /nfs/dbraw/zinc/63/29/22/355632922.db2.gz RJVCJUDYWQMUKC-VXGBXAGGSA-N 1 2 238.331 2.401 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+]2CCO[C@@H](C(C)C)C2)o1 ZINC000335867673 355632926 /nfs/dbraw/zinc/63/29/26/355632926.db2.gz RJVCJUDYWQMUKC-VXGBXAGGSA-N 1 2 238.331 2.401 20 0 BEADLO Cc1nnc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)o1 ZINC000336006769 134049231 /nfs/dbraw/zinc/04/92/31/134049231.db2.gz ZUMWTXWNWOOPQV-HTRCEHHLSA-N 1 2 249.236 2.151 20 0 BEADLO Cc1nnc(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)o1 ZINC000336006769 134049232 /nfs/dbraw/zinc/04/92/32/134049232.db2.gz ZUMWTXWNWOOPQV-HTRCEHHLSA-N 1 2 249.236 2.151 20 0 BEADLO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccon1 ZINC000336006453 134049582 /nfs/dbraw/zinc/04/95/82/134049582.db2.gz RHFNYNWTLDUYCE-IONNQARKSA-N 1 2 234.221 2.447 20 0 BEADLO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ccon1 ZINC000336006453 134049583 /nfs/dbraw/zinc/04/95/83/134049583.db2.gz RHFNYNWTLDUYCE-IONNQARKSA-N 1 2 234.221 2.447 20 0 BEADLO Cc1cnc(C[NH2+][C@H]2CCc3ccc(O)cc32)o1 ZINC000639319587 355719629 /nfs/dbraw/zinc/71/96/29/355719629.db2.gz ZAOIKPBKJKYBOS-ZDUSSCGKSA-N 1 2 244.294 2.466 20 0 BEADLO CC(C)CCC[N@@H+]1Cc2cnn(C)c2C1 ZINC000639321781 355723100 /nfs/dbraw/zinc/72/31/00/355723100.db2.gz ZEYHDKAHARDJBB-UHFFFAOYSA-N 1 2 207.321 2.172 20 0 BEADLO CC(C)CCC[N@H+]1Cc2cnn(C)c2C1 ZINC000639321781 355723103 /nfs/dbraw/zinc/72/31/03/355723103.db2.gz ZEYHDKAHARDJBB-UHFFFAOYSA-N 1 2 207.321 2.172 20 0 BEADLO COCc1cc[nH+]c(NCc2ncc(C)o2)c1 ZINC000639313095 355684482 /nfs/dbraw/zinc/68/44/82/355684482.db2.gz MPQYPFWGCZKELJ-UHFFFAOYSA-N 1 2 233.271 2.137 20 0 BEADLO COc1cncc(C[N@@H+]2CCC[C@H](F)C2)c1C ZINC000639313281 355685382 /nfs/dbraw/zinc/68/53/82/355685382.db2.gz PGKDOYGVBTZYDF-LBPRGKRZSA-N 1 2 238.306 2.333 20 0 BEADLO COc1cncc(C[N@H+]2CCC[C@H](F)C2)c1C ZINC000639313281 355685386 /nfs/dbraw/zinc/68/53/86/355685386.db2.gz PGKDOYGVBTZYDF-LBPRGKRZSA-N 1 2 238.306 2.333 20 0 BEADLO CCc1nc(C[N@H+](C)[C@H](C)C(C)C)no1 ZINC000350629037 355734749 /nfs/dbraw/zinc/73/47/49/355734749.db2.gz LBBYRMZCNQBYTN-SECBINFHSA-N 1 2 211.309 2.108 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@H](C)C(C)C)no1 ZINC000350629037 355734752 /nfs/dbraw/zinc/73/47/52/355734752.db2.gz LBBYRMZCNQBYTN-SECBINFHSA-N 1 2 211.309 2.108 20 0 BEADLO COCC[N@H+](Cc1ccncc1Cl)C1CC1 ZINC000350724854 355749393 /nfs/dbraw/zinc/74/93/93/355749393.db2.gz PLUAWTMCSCWQII-UHFFFAOYSA-N 1 2 240.734 2.346 20 0 BEADLO COCC[N@@H+](Cc1ccncc1Cl)C1CC1 ZINC000350724854 355749397 /nfs/dbraw/zinc/74/93/97/355749397.db2.gz PLUAWTMCSCWQII-UHFFFAOYSA-N 1 2 240.734 2.346 20 0 BEADLO CC(C)(C)C(C)(C)NC(=O)CCn1cc[nH+]c1 ZINC000350784157 355757830 /nfs/dbraw/zinc/75/78/30/355757830.db2.gz CVOUPDXQMDLJLQ-UHFFFAOYSA-N 1 2 237.347 2.214 20 0 BEADLO COc1cc(C[NH2+]Cc2ccc(Cl)o2)on1 ZINC000639326026 355726063 /nfs/dbraw/zinc/72/60/63/355726063.db2.gz VZZMOIBTFHVGHN-UHFFFAOYSA-N 1 2 242.662 2.219 20 0 BEADLO CN(C)c1c[nH+]cc(NC2CCSCC2)c1 ZINC000639363623 355824915 /nfs/dbraw/zinc/82/49/15/355824915.db2.gz DBSODVDNSZTOMR-UHFFFAOYSA-N 1 2 237.372 2.455 20 0 BEADLO Cc1nnsc1C[NH+]1CC(Cc2ccco2)C1 ZINC000639350214 355794965 /nfs/dbraw/zinc/79/49/65/355794965.db2.gz YQBDATQYGGFSDI-UHFFFAOYSA-N 1 2 249.339 2.114 20 0 BEADLO Cn1ccnc1C[NH+]1CC(c2ccccc2)C1 ZINC000639361839 355816270 /nfs/dbraw/zinc/81/62/70/355816270.db2.gz UQBMNFANXVOQMT-UHFFFAOYSA-N 1 2 227.311 2.020 20 0 BEADLO CO[C@](C)(CNc1c[nH+]cc(N(C)C)c1)C1CC1 ZINC000639364289 355834038 /nfs/dbraw/zinc/83/40/38/355834038.db2.gz HJDCXRZTLWYIQO-CQSZACIVSA-N 1 2 249.358 2.375 20 0 BEADLO CCC(C)(C)N(C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000632757296 355836427 /nfs/dbraw/zinc/83/64/27/355836427.db2.gz RXVCQNZESSPKAA-UHFFFAOYSA-N 1 2 238.335 2.082 20 0 BEADLO C[C@H]1CC[C@H](CC(=O)N2CC(n3cc[nH+]c3)C2)C1 ZINC000532092072 355852469 /nfs/dbraw/zinc/85/24/69/355852469.db2.gz DKQYNMQJIGCWEK-RYUDHWBXSA-N 1 2 247.342 2.093 20 0 BEADLO Cc1cc(F)c(CNCc2[nH]cc[nH+]2)c(F)c1 ZINC000639373401 355877961 /nfs/dbraw/zinc/87/79/61/355877961.db2.gz ZPWHQFZMQUFPFA-UHFFFAOYSA-N 1 2 237.253 2.286 20 0 BEADLO Cc1noc([C@H](C)[NH+]2C[C@H](C)S[C@@H](C)C2)n1 ZINC000608502150 355829483 /nfs/dbraw/zinc/82/94/83/355829483.db2.gz AWJXIDOXQPHVTA-CIUDSAMLSA-N 1 2 241.360 2.265 20 0 BEADLO C[C@@H]1C[C@H](Nc2c[nH+]cc(N(C)C)c2)CCO1 ZINC000639364055 355832366 /nfs/dbraw/zinc/83/23/66/355832366.db2.gz GMOMQIUXXZAXTD-GHMZBOCLSA-N 1 2 235.331 2.127 20 0 BEADLO COCC1(C2CC2)C[NH+](Cc2nccs2)C1 ZINC000639380207 355916387 /nfs/dbraw/zinc/91/63/87/355916387.db2.gz PUKLRBKUJVOCGC-UHFFFAOYSA-N 1 2 238.356 2.002 20 0 BEADLO CC(C)(C)c1cnc(C[NH2+]C2(C)COC2)s1 ZINC000639381253 355917968 /nfs/dbraw/zinc/91/79/68/355917968.db2.gz TYKAMMMZSUWFQR-UHFFFAOYSA-N 1 2 240.372 2.319 20 0 BEADLO COc1ccc(C[NH2+]C2(C)COC2)c(Cl)c1 ZINC000639382551 355929936 /nfs/dbraw/zinc/92/99/36/355929936.db2.gz RXEHBSLRMYKSJD-UHFFFAOYSA-N 1 2 241.718 2.227 20 0 BEADLO Cc1ncc([C@@H](C)[NH2+]Cc2csnn2)s1 ZINC000639383025 355935166 /nfs/dbraw/zinc/93/51/66/355935166.db2.gz OPGDCPFXFZYNJA-ZCFIWIBFSA-N 1 2 240.357 2.154 20 0 BEADLO CC(C)N(CC1CC1)C(=O)CCCn1cc[nH+]c1 ZINC000623256930 356001711 /nfs/dbraw/zinc/00/17/11/356001711.db2.gz GGSAPYCYDWRMOL-UHFFFAOYSA-N 1 2 249.358 2.310 20 0 BEADLO C[C@@H](c1cccc(F)c1)[N@@H+]1CCc2nn[nH]c2C1 ZINC000351638304 356039700 /nfs/dbraw/zinc/03/97/00/356039700.db2.gz BPJYYCNFZGPBFF-VIFPVBQESA-N 1 2 246.289 2.063 20 0 BEADLO C[C@@H](c1cccc(F)c1)[N@H+]1CCc2nn[nH]c2C1 ZINC000351638304 356039706 /nfs/dbraw/zinc/03/97/06/356039706.db2.gz BPJYYCNFZGPBFF-VIFPVBQESA-N 1 2 246.289 2.063 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CCC(C)(F)CC1 ZINC000639389136 356011482 /nfs/dbraw/zinc/01/14/82/356011482.db2.gz QEQUYRCLGQGIJO-UHFFFAOYSA-N 1 2 211.284 2.042 20 0 BEADLO CO[C@H](C)C[N@H+](C)Cc1cc(C(C)(C)C)on1 ZINC000352115535 134071786 /nfs/dbraw/zinc/07/17/86/134071786.db2.gz MARNQVDQHOKLHD-SNVBAGLBSA-N 1 2 240.347 2.439 20 0 BEADLO CO[C@H](C)C[N@@H+](C)Cc1cc(C(C)(C)C)on1 ZINC000352115535 134071787 /nfs/dbraw/zinc/07/17/87/134071787.db2.gz MARNQVDQHOKLHD-SNVBAGLBSA-N 1 2 240.347 2.439 20 0 BEADLO C[C@H]([NH2+]Cc1cnn(C(C)(C)C)c1)c1ccon1 ZINC000351591362 356024253 /nfs/dbraw/zinc/02/42/53/356024253.db2.gz DJJYVWMBFFECIB-JTQLQIEISA-N 1 2 248.330 2.477 20 0 BEADLO CC(C)n1cc(C[NH2+][C@@H](C)c2ccon2)cn1 ZINC000351591996 356024404 /nfs/dbraw/zinc/02/44/04/356024404.db2.gz IPPLYCUJNRHZNH-JTQLQIEISA-N 1 2 234.303 2.303 20 0 BEADLO C[C@@H](c1ccc(F)cc1)[N@@H+]1CCc2nn[nH]c2C1 ZINC000351610807 356027779 /nfs/dbraw/zinc/02/77/79/356027779.db2.gz XZSSZQNOISGHNW-VIFPVBQESA-N 1 2 246.289 2.063 20 0 BEADLO C[C@@H](c1ccc(F)cc1)[N@H+]1CCc2nn[nH]c2C1 ZINC000351610807 356027780 /nfs/dbraw/zinc/02/77/80/356027780.db2.gz XZSSZQNOISGHNW-VIFPVBQESA-N 1 2 246.289 2.063 20 0 BEADLO CCC(C)(C)[C@@H](C)NC(=O)Cc1[nH]c[nH+]c1C ZINC000617568521 356123416 /nfs/dbraw/zinc/12/34/16/356123416.db2.gz DYMYHGPXDNFECI-SNVBAGLBSA-N 1 2 237.347 2.202 20 0 BEADLO CCC(C)(C)[C@@H](C)NC(=O)Cc1[nH+]c[nH]c1C ZINC000617568521 356123418 /nfs/dbraw/zinc/12/34/18/356123418.db2.gz DYMYHGPXDNFECI-SNVBAGLBSA-N 1 2 237.347 2.202 20 0 BEADLO CCC(C)(C)[C@@H](C)NC(=O)CCc1c[nH+]c[nH]1 ZINC000617568405 356123447 /nfs/dbraw/zinc/12/34/47/356123447.db2.gz BURNGDHLSXPOPG-SNVBAGLBSA-N 1 2 237.347 2.283 20 0 BEADLO CCC(C)(C)[C@@H](C)NC(=O)CCc1c[nH]c[nH+]1 ZINC000617568405 356123450 /nfs/dbraw/zinc/12/34/50/356123450.db2.gz BURNGDHLSXPOPG-SNVBAGLBSA-N 1 2 237.347 2.283 20 0 BEADLO Cc1nc([C@@H](C)[N@H+](C)CCc2ccccn2)no1 ZINC000351714128 356067861 /nfs/dbraw/zinc/06/78/61/356067861.db2.gz ZICRUJKZUKZELG-SNVBAGLBSA-N 1 2 246.314 2.009 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+](C)CCc2ccccn2)no1 ZINC000351714128 356067866 /nfs/dbraw/zinc/06/78/66/356067866.db2.gz ZICRUJKZUKZELG-SNVBAGLBSA-N 1 2 246.314 2.009 20 0 BEADLO COC(=O)C[NH2+][C@]1(C)CCCc2ccccc21 ZINC000351716135 356068072 /nfs/dbraw/zinc/06/80/72/356068072.db2.gz BKDOZFXLLMGZLU-CQSZACIVSA-N 1 2 233.311 2.001 20 0 BEADLO OC[C@@H]1C[C@@H](F)C[N@@H+]1Cc1ccsc1Cl ZINC000336089748 134077713 /nfs/dbraw/zinc/07/77/13/134077713.db2.gz SQXMNBWKBZKXKD-BDAKNGLRSA-N 1 2 249.738 2.306 20 0 BEADLO OC[C@@H]1C[C@@H](F)C[N@H+]1Cc1ccsc1Cl ZINC000336089748 134077714 /nfs/dbraw/zinc/07/77/14/134077714.db2.gz SQXMNBWKBZKXKD-BDAKNGLRSA-N 1 2 249.738 2.306 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC(C)=C(C)C2)n1C1CC1 ZINC000336089201 134078246 /nfs/dbraw/zinc/07/82/46/134078246.db2.gz XYRMGFHQNDTBEW-UHFFFAOYSA-N 1 2 246.358 2.464 20 0 BEADLO Cc1nnc(C[N@H+]2CCC(C)=C(C)C2)n1C1CC1 ZINC000336089201 134078247 /nfs/dbraw/zinc/07/82/47/134078247.db2.gz XYRMGFHQNDTBEW-UHFFFAOYSA-N 1 2 246.358 2.464 20 0 BEADLO C[C@H](c1ccccc1)[N@@H+]1CC[S@@](=O)[C@@H](C)C1 ZINC000351898278 356170221 /nfs/dbraw/zinc/17/02/21/356170221.db2.gz PEQRKMGCQCDXAU-HWWQOWPSSA-N 1 2 237.368 2.200 20 0 BEADLO C[C@H](c1ccccc1)[N@H+]1CC[S@@](=O)[C@@H](C)C1 ZINC000351898278 356170225 /nfs/dbraw/zinc/17/02/25/356170225.db2.gz PEQRKMGCQCDXAU-HWWQOWPSSA-N 1 2 237.368 2.200 20 0 BEADLO CC[C@@H]1CCN1c1[nH+]c(C)nc2[nH]ccc21 ZINC000336093843 134079149 /nfs/dbraw/zinc/07/91/49/134079149.db2.gz JBSPYVNPTSYBBL-SECBINFHSA-N 1 2 216.288 2.255 20 0 BEADLO C[C@@H](F)CC[N@H+](C)CC(=O)OC(C)(C)C ZINC000352132117 134080656 /nfs/dbraw/zinc/08/06/56/134080656.db2.gz ZDHKFNZZVDSWTB-SECBINFHSA-N 1 2 219.300 2.008 20 0 BEADLO C[C@@H](F)CC[N@@H+](C)CC(=O)OC(C)(C)C ZINC000352132117 134080657 /nfs/dbraw/zinc/08/06/57/134080657.db2.gz ZDHKFNZZVDSWTB-SECBINFHSA-N 1 2 219.300 2.008 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@@H]1[C@@H]1CCC[C@H](C)C1 ZINC000639428940 356208988 /nfs/dbraw/zinc/20/89/88/356208988.db2.gz ZJDMZAPBADQWHG-TUAOUCFPSA-N 1 2 238.375 2.369 20 0 BEADLO CC(=O)C[N@@H+]1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000639474357 356267597 /nfs/dbraw/zinc/26/75/97/356267597.db2.gz SDYPODATHDOSFW-LBPRGKRZSA-N 1 2 247.294 2.141 20 0 BEADLO CC(=O)C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000639474357 356267599 /nfs/dbraw/zinc/26/75/99/356267599.db2.gz SDYPODATHDOSFW-LBPRGKRZSA-N 1 2 247.294 2.141 20 0 BEADLO C[C@@H]1CC(CNC(=O)Cn2cc[nH+]c2)C[C@@H](C)C1 ZINC000617667311 356268676 /nfs/dbraw/zinc/26/86/76/356268676.db2.gz ZWPDEHDHJRURHS-RYUDHWBXSA-N 1 2 249.358 2.072 20 0 BEADLO CC[C@H](C)CCNC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000617639432 356245776 /nfs/dbraw/zinc/24/57/76/356245776.db2.gz FWCFIBMUQMNMSF-JTQLQIEISA-N 1 2 237.347 2.240 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@H](C)c2noc(C)n2)CCS1 ZINC000336122188 134091468 /nfs/dbraw/zinc/09/14/68/134091468.db2.gz VRRJMRGSSLTQFP-PSASIEDQSA-N 1 2 241.360 2.266 20 0 BEADLO CC[C@@H]1C[N@H+]([C@H](C)c2noc(C)n2)CCS1 ZINC000336122188 134091469 /nfs/dbraw/zinc/09/14/69/134091469.db2.gz VRRJMRGSSLTQFP-PSASIEDQSA-N 1 2 241.360 2.266 20 0 BEADLO C[C@H]1OCC[C@@H]1C[N@H+](CC(F)F)C1CC1 ZINC000639483050 356297683 /nfs/dbraw/zinc/29/76/83/356297683.db2.gz PMPXJERCHJIOEU-RKDXNWHRSA-N 1 2 219.275 2.141 20 0 BEADLO C[C@H]1OCC[C@@H]1C[N@@H+](CC(F)F)C1CC1 ZINC000639483050 356297685 /nfs/dbraw/zinc/29/76/85/356297685.db2.gz PMPXJERCHJIOEU-RKDXNWHRSA-N 1 2 219.275 2.141 20 0 BEADLO CS[C@@H](C)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000609618975 356391558 /nfs/dbraw/zinc/39/15/58/356391558.db2.gz SEOSQCOXNQCTCL-QMMMGPOBSA-N 1 2 235.312 2.024 20 0 BEADLO CCC(F)(F)C[N@H+](C)[C@H](CO)C(C)(C)C ZINC000639542572 356396244 /nfs/dbraw/zinc/39/62/44/356396244.db2.gz YNPZFDFDFFFAHK-SECBINFHSA-N 1 2 223.307 2.371 20 0 BEADLO CCC(F)(F)C[N@@H+](C)[C@H](CO)C(C)(C)C ZINC000639542572 356396246 /nfs/dbraw/zinc/39/62/46/356396246.db2.gz YNPZFDFDFFFAHK-SECBINFHSA-N 1 2 223.307 2.371 20 0 BEADLO CCC(F)(F)C[N@H+](C)[C@H]1CCSC1 ZINC000639546450 356408395 /nfs/dbraw/zinc/40/83/95/356408395.db2.gz AHEPPAWUKVBEAQ-QMMMGPOBSA-N 1 2 209.305 2.469 20 0 BEADLO CCC(F)(F)C[N@@H+](C)[C@H]1CCSC1 ZINC000639546450 356408396 /nfs/dbraw/zinc/40/83/96/356408396.db2.gz AHEPPAWUKVBEAQ-QMMMGPOBSA-N 1 2 209.305 2.469 20 0 BEADLO C[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)Cn1cc[nH+]c1 ZINC000580378122 356437903 /nfs/dbraw/zinc/43/79/03/356437903.db2.gz GMQQWBWKJWZSRH-FRRDWIJNSA-N 1 2 247.342 2.063 20 0 BEADLO CC[C@@H]1C[C@H](Nc2cc(C)[nH+]cn2)CCO1 ZINC000420616760 192248877 /nfs/dbraw/zinc/24/88/77/192248877.db2.gz ICCNBFURPPXNCZ-GHMZBOCLSA-N 1 2 221.304 2.155 20 0 BEADLO CC[C@H]1C[C@H](Nc2cc[nH+]c(C)n2)CCO1 ZINC000420616022 192248904 /nfs/dbraw/zinc/24/89/04/192248904.db2.gz FZDYPHHGLSWYPH-MNOVXSKESA-N 1 2 221.304 2.155 20 0 BEADLO CCCCN(C(=O)CCCn1cc[nH+]c1)C1CC1 ZINC000623282721 356469393 /nfs/dbraw/zinc/46/93/93/356469393.db2.gz ZNPDRUYXVQTFEA-UHFFFAOYSA-N 1 2 249.358 2.454 20 0 BEADLO CCC(F)(F)C[N@H+](C)C[C@@H]1CCC[C@H]1O ZINC000639567893 356490810 /nfs/dbraw/zinc/49/08/10/356490810.db2.gz QLRHXHYVDNUZHL-VHSXEESVSA-N 1 2 221.291 2.125 20 0 BEADLO CCC(F)(F)C[N@@H+](C)C[C@@H]1CCC[C@H]1O ZINC000639567893 356490813 /nfs/dbraw/zinc/49/08/13/356490813.db2.gz QLRHXHYVDNUZHL-VHSXEESVSA-N 1 2 221.291 2.125 20 0 BEADLO CC[C@@H](C)CNc1cc[nH+]c(C2CC2)n1 ZINC000420653829 192255739 /nfs/dbraw/zinc/25/57/39/192255739.db2.gz PAMQTZSGKLDXJO-SECBINFHSA-N 1 2 205.305 2.234 20 0 BEADLO Cc1cc(CNC(=O)NCC(C)C)cc(C)[nH+]1 ZINC000420756265 192258129 /nfs/dbraw/zinc/25/81/29/192258129.db2.gz DCALMUNAMAVVIV-UHFFFAOYSA-N 1 2 235.331 2.154 20 0 BEADLO CCC(F)(F)C[N@H+](C)[C@@H](CO)CC(C)C ZINC000639594648 356513474 /nfs/dbraw/zinc/51/34/74/356513474.db2.gz VUTZAUXYTFXNFH-SNVBAGLBSA-N 1 2 223.307 2.371 20 0 BEADLO CCC(F)(F)C[N@@H+](C)[C@@H](CO)CC(C)C ZINC000639594648 356513477 /nfs/dbraw/zinc/51/34/77/356513477.db2.gz VUTZAUXYTFXNFH-SNVBAGLBSA-N 1 2 223.307 2.371 20 0 BEADLO CC(=O)C[NH2+][C@@H](c1ncc(C)s1)C1CC1 ZINC000639581582 356502199 /nfs/dbraw/zinc/50/21/99/356502199.db2.gz YNOKTIVVENIYPC-SNVBAGLBSA-N 1 2 224.329 2.081 20 0 BEADLO CC(C)[N@H+](Cc1nn(C)cc1Cl)C1CC1 ZINC000420902775 192268267 /nfs/dbraw/zinc/26/82/67/192268267.db2.gz NCQKZLASOHHGAO-UHFFFAOYSA-N 1 2 227.739 2.446 20 0 BEADLO CC(C)[N@@H+](Cc1nn(C)cc1Cl)C1CC1 ZINC000420902775 192268269 /nfs/dbraw/zinc/26/82/69/192268269.db2.gz NCQKZLASOHHGAO-UHFFFAOYSA-N 1 2 227.739 2.446 20 0 BEADLO CC[N@H+](Cc1nn(C)cc1Cl)C(C)C ZINC000420908350 192270135 /nfs/dbraw/zinc/27/01/35/192270135.db2.gz WTNXGRCZIADFFK-UHFFFAOYSA-N 1 2 215.728 2.304 20 0 BEADLO CC[N@@H+](Cc1nn(C)cc1Cl)C(C)C ZINC000420908350 192270138 /nfs/dbraw/zinc/27/01/38/192270138.db2.gz WTNXGRCZIADFFK-UHFFFAOYSA-N 1 2 215.728 2.304 20 0 BEADLO CC(=O)C[N@@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000639592375 356509063 /nfs/dbraw/zinc/50/90/63/356509063.db2.gz JRAOVSSCKPZBIK-HNNXBMFYSA-N 1 2 245.322 2.097 20 0 BEADLO CC(=O)C[N@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000639592375 356509065 /nfs/dbraw/zinc/50/90/65/356509065.db2.gz JRAOVSSCKPZBIK-HNNXBMFYSA-N 1 2 245.322 2.097 20 0 BEADLO Cc1cc(C)c(C[N@@H+]2CCC(=O)[C@@H](C)C2)c(C)n1 ZINC000639591973 356509290 /nfs/dbraw/zinc/50/92/90/356509290.db2.gz HLRAUTOORXRBKB-NSHDSACASA-N 1 2 246.354 2.418 20 0 BEADLO Cc1cc(C)c(C[N@H+]2CCC(=O)[C@@H](C)C2)c(C)n1 ZINC000639591973 356509294 /nfs/dbraw/zinc/50/92/94/356509294.db2.gz HLRAUTOORXRBKB-NSHDSACASA-N 1 2 246.354 2.418 20 0 BEADLO C[C@H](N(C)c1cc(CO)cc[nH+]1)C1(C)CC1 ZINC000385330740 491094290 /nfs/dbraw/zinc/09/42/90/491094290.db2.gz QJGLUWJHTFUWAS-JTQLQIEISA-N 1 2 220.316 2.199 20 0 BEADLO CCC(F)(F)C[N@@H+]1CC[C@H](C)[C@H](OC)C1 ZINC000639603946 356524984 /nfs/dbraw/zinc/52/49/84/356524984.db2.gz IOOPELUITKHNCA-VHSXEESVSA-N 1 2 221.291 2.389 20 0 BEADLO CCC(F)(F)C[N@H+]1CC[C@H](C)[C@H](OC)C1 ZINC000639603946 356524987 /nfs/dbraw/zinc/52/49/87/356524987.db2.gz IOOPELUITKHNCA-VHSXEESVSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@@H]1C[NH+](Cc2nccc(C)n2)C[C@@H](CC)O1 ZINC000420958435 192279347 /nfs/dbraw/zinc/27/93/47/192279347.db2.gz PELQMSSNQGPVFM-CHWSQXEVSA-N 1 2 249.358 2.174 20 0 BEADLO COC[C@H](C)[N@H+](C)Cc1csc(C2CC2)n1 ZINC000179480917 366263524 /nfs/dbraw/zinc/26/35/24/366263524.db2.gz CGDCDBHMJPUMFG-VIFPVBQESA-N 1 2 240.372 2.487 20 0 BEADLO COC[C@H](C)[N@@H+](C)Cc1csc(C2CC2)n1 ZINC000179480917 366263532 /nfs/dbraw/zinc/26/35/32/366263532.db2.gz CGDCDBHMJPUMFG-VIFPVBQESA-N 1 2 240.372 2.487 20 0 BEADLO O[C@H]1C[C@@H](C[NH2+][C@@H](c2ccccc2)C(F)F)C1 ZINC000420974460 192286009 /nfs/dbraw/zinc/28/60/09/192286009.db2.gz OIRIPKJJQOLMGC-WCQGTBRESA-N 1 2 241.281 2.353 20 0 BEADLO CC[C@H](C)[N@H+](C)Cc1nn(C)cc1Cl ZINC000420936323 192286622 /nfs/dbraw/zinc/28/66/22/192286622.db2.gz MOYZMZRJXWRFCP-QMMMGPOBSA-N 1 2 215.728 2.304 20 0 BEADLO CC[C@H](C)[N@@H+](C)Cc1nn(C)cc1Cl ZINC000420936323 192286624 /nfs/dbraw/zinc/28/66/24/192286624.db2.gz MOYZMZRJXWRFCP-QMMMGPOBSA-N 1 2 215.728 2.304 20 0 BEADLO Cn1cc(Cl)c(C[N@H+](C)CCC2CC2)n1 ZINC000420930870 192286831 /nfs/dbraw/zinc/28/68/31/192286831.db2.gz FIRDNIUOBYEMTL-UHFFFAOYSA-N 1 2 227.739 2.305 20 0 BEADLO Cn1cc(Cl)c(C[N@@H+](C)CCC2CC2)n1 ZINC000420930870 192286834 /nfs/dbraw/zinc/28/68/34/192286834.db2.gz FIRDNIUOBYEMTL-UHFFFAOYSA-N 1 2 227.739 2.305 20 0 BEADLO C[C@H]1c2cccn2CC[N@H+]1Cc1ccc(CO)o1 ZINC000179566912 366271219 /nfs/dbraw/zinc/27/12/19/366271219.db2.gz OYHACRUZTDVDIZ-NSHDSACASA-N 1 2 246.310 2.150 20 0 BEADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1ccc(CO)o1 ZINC000179566912 366271229 /nfs/dbraw/zinc/27/12/29/366271229.db2.gz OYHACRUZTDVDIZ-NSHDSACASA-N 1 2 246.310 2.150 20 0 BEADLO CC1(C)CO[C@H](C[N@@H+]2Cc3cccnc3C2)C1 ZINC000639622646 356541859 /nfs/dbraw/zinc/54/18/59/356541859.db2.gz FCHQZQYEIUNOFG-LBPRGKRZSA-N 1 2 232.327 2.212 20 0 BEADLO CC1(C)CO[C@H](C[N@H+]2Cc3cccnc3C2)C1 ZINC000639622646 356541863 /nfs/dbraw/zinc/54/18/63/356541863.db2.gz FCHQZQYEIUNOFG-LBPRGKRZSA-N 1 2 232.327 2.212 20 0 BEADLO Fc1cc(F)cc(C[N@@H+]2CC[C@]23CCOC3)c1 ZINC000421013185 192302607 /nfs/dbraw/zinc/30/26/07/192302607.db2.gz FXWRHPYOAKCFRS-CYBMUJFWSA-N 1 2 239.265 2.330 20 0 BEADLO Fc1cc(F)cc(C[N@H+]2CC[C@]23CCOC3)c1 ZINC000421013185 192302609 /nfs/dbraw/zinc/30/26/09/192302609.db2.gz FXWRHPYOAKCFRS-CYBMUJFWSA-N 1 2 239.265 2.330 20 0 BEADLO CC1(C)CC[NH+](Cc2csnn2)CC1 ZINC000335558354 535317024 /nfs/dbraw/zinc/31/70/24/535317024.db2.gz KFMYZXDDHWPVCC-UHFFFAOYSA-N 1 2 211.334 2.160 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1CC(=O)c1ccccc1F ZINC000639654700 356559561 /nfs/dbraw/zinc/55/95/61/356559561.db2.gz GDNCHPJRTRZFOZ-VHSXEESVSA-N 1 2 221.275 2.349 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1CC(=O)c1ccccc1F ZINC000639654700 356559563 /nfs/dbraw/zinc/55/95/63/356559563.db2.gz GDNCHPJRTRZFOZ-VHSXEESVSA-N 1 2 221.275 2.349 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1nnc(C2CC2)s1 ZINC000336204296 134131611 /nfs/dbraw/zinc/13/16/11/134131611.db2.gz ZYVZYQDQXAPZFS-OCAPTIKFSA-N 1 2 223.345 2.398 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1nnc(C2CC2)s1 ZINC000336204296 134131612 /nfs/dbraw/zinc/13/16/12/134131612.db2.gz ZYVZYQDQXAPZFS-OCAPTIKFSA-N 1 2 223.345 2.398 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1c[nH]cc1C1CC1 ZINC000639698033 356605859 /nfs/dbraw/zinc/60/58/59/356605859.db2.gz DQOYSHGONHSPNG-UHFFFAOYSA-N 1 2 241.294 2.270 20 0 BEADLO CC(C)(C)CCC(=O)N[C@H]1CCn2c[nH+]cc2C1 ZINC000623306885 356605885 /nfs/dbraw/zinc/60/58/85/356605885.db2.gz WHCPWOVCMYBLJZ-NSHDSACASA-N 1 2 249.358 2.140 20 0 BEADLO C[C@H]1CC(F)(F)CCN1c1cc(CO)cc[nH+]1 ZINC000630094063 363534523 /nfs/dbraw/zinc/53/45/23/363534523.db2.gz UWSYXMMOVRCPAT-VIFPVBQESA-N 1 2 242.269 2.198 20 0 BEADLO CC[C@H](NC(=O)Cc1occc1C)c1[nH]cc[nH+]1 ZINC000613578841 363521547 /nfs/dbraw/zinc/52/15/47/363521547.db2.gz DWDLORYHDGZHAH-JTQLQIEISA-N 1 2 247.298 2.121 20 0 BEADLO CCCC[N@H+](C)Cc1nc(C(=O)OC)cs1 ZINC000450216352 202097856 /nfs/dbraw/zinc/09/78/56/202097856.db2.gz PYGSONPJFADHKN-UHFFFAOYSA-N 1 2 242.344 2.162 20 0 BEADLO CCCC[N@@H+](C)Cc1nc(C(=O)OC)cs1 ZINC000450216352 202097860 /nfs/dbraw/zinc/09/78/60/202097860.db2.gz PYGSONPJFADHKN-UHFFFAOYSA-N 1 2 242.344 2.162 20 0 BEADLO CC(C)[C@@H](Nc1cc(CO)cc[nH+]1)C1CC1 ZINC000630095066 363544306 /nfs/dbraw/zinc/54/43/06/363544306.db2.gz QTGIUYPRHYAVEU-CYBMUJFWSA-N 1 2 220.316 2.420 20 0 BEADLO CC[N@H+](CCOC)Cc1nnc(C(C)C)s1 ZINC000450281954 202118877 /nfs/dbraw/zinc/11/88/77/202118877.db2.gz FSUHWFVSYBVGQB-UHFFFAOYSA-N 1 2 243.376 2.130 20 0 BEADLO CC[N@@H+](CCOC)Cc1nnc(C(C)C)s1 ZINC000450281954 202118881 /nfs/dbraw/zinc/11/88/81/202118881.db2.gz FSUHWFVSYBVGQB-UHFFFAOYSA-N 1 2 243.376 2.130 20 0 BEADLO CCC[N@H+](C)Cc1noc(-c2cncc(C)c2)n1 ZINC000450318215 202127577 /nfs/dbraw/zinc/12/75/77/202127577.db2.gz MZDQMFIPBUASMZ-UHFFFAOYSA-N 1 2 246.314 2.282 20 0 BEADLO CCC[N@@H+](C)Cc1noc(-c2cncc(C)c2)n1 ZINC000450318215 202127580 /nfs/dbraw/zinc/12/75/80/202127580.db2.gz MZDQMFIPBUASMZ-UHFFFAOYSA-N 1 2 246.314 2.282 20 0 BEADLO Cc1ccc(Cc2noc(-c3ccon3)n2)c[nH+]1 ZINC000350635321 366312770 /nfs/dbraw/zinc/31/27/70/366312770.db2.gz KBPQNEFPBWWOMU-UHFFFAOYSA-N 1 2 242.238 2.019 20 0 BEADLO CCOC1CCN(c2cc(C)[nH+]cc2C#N)CC1 ZINC000399394368 356657903 /nfs/dbraw/zinc/65/79/03/356657903.db2.gz AJVVJPOKFAWEAA-UHFFFAOYSA-N 1 2 245.326 2.267 20 0 BEADLO C[C@@H](N[C@@H](C)c1[nH+]ccn1C)C(C)(F)F ZINC000389458874 356678401 /nfs/dbraw/zinc/67/84/01/356678401.db2.gz DBIQZQRVFCZGFG-JGVFFNPUSA-N 1 2 217.263 2.114 20 0 BEADLO C[C@H]([NH2+][C@@H](C)C(C)(F)F)c1cn[nH]c1 ZINC000389464914 356679910 /nfs/dbraw/zinc/67/99/10/356679910.db2.gz JPAYFRSDKUJWAT-BQBZGAKWSA-N 1 2 203.236 2.104 20 0 BEADLO CCSCC[N@H+](C)Cc1nccn1C(F)F ZINC000130221143 325025162 /nfs/dbraw/zinc/02/51/62/325025162.db2.gz FKLGPSNGOJWQQX-UHFFFAOYSA-N 1 2 249.330 2.463 20 0 BEADLO CCSCC[N@@H+](C)Cc1nccn1C(F)F ZINC000130221143 325025165 /nfs/dbraw/zinc/02/51/65/325025165.db2.gz FKLGPSNGOJWQQX-UHFFFAOYSA-N 1 2 249.330 2.463 20 0 BEADLO Cc1nn(C)cc1[C@@H](C)[NH2+][C@@H](C)C(C)(F)F ZINC000389494190 356694457 /nfs/dbraw/zinc/69/44/57/356694457.db2.gz WODFLWPUHXDPLG-APPZFPTMSA-N 1 2 231.290 2.423 20 0 BEADLO CCn1c[nH+]cc1CN[C@H](C)C(C)(F)F ZINC000389462796 356681445 /nfs/dbraw/zinc/68/14/45/356681445.db2.gz HJGRDHSYKKRLRK-MRVPVSSYSA-N 1 2 217.263 2.036 20 0 BEADLO C[C@H]([NH2+][C@@H](C)C(C)(F)F)c1ccnn1C ZINC000389475685 356684502 /nfs/dbraw/zinc/68/45/02/356684502.db2.gz ZCDLKSFFEAGBRZ-YUMQZZPRSA-N 1 2 217.263 2.114 20 0 BEADLO c1cc(N[C@H]2CCCOC2)[nH+]cc1N1CCCC1 ZINC000346464176 538532455 /nfs/dbraw/zinc/53/24/55/538532455.db2.gz RGEDWMPKUZSZIA-LBPRGKRZSA-N 1 2 247.342 2.273 20 0 BEADLO c1csc(C[N@@H+]2CCC[C@H]2c2cn[nH]c2)n1 ZINC000639776498 356717774 /nfs/dbraw/zinc/71/77/74/356717774.db2.gz BFYDPQMRIWSXTI-JTQLQIEISA-N 1 2 234.328 2.203 20 0 BEADLO c1csc(C[N@H+]2CCC[C@H]2c2cn[nH]c2)n1 ZINC000639776498 356717777 /nfs/dbraw/zinc/71/77/77/356717777.db2.gz BFYDPQMRIWSXTI-JTQLQIEISA-N 1 2 234.328 2.203 20 0 BEADLO C[N@H+](Cc1nnc(C2CC2)s1)C1CCC1 ZINC000450444324 202168564 /nfs/dbraw/zinc/16/85/64/202168564.db2.gz YMERSYRVGRKNGN-UHFFFAOYSA-N 1 2 223.345 2.400 20 0 BEADLO C[N@@H+](Cc1nnc(C2CC2)s1)C1CCC1 ZINC000450444324 202168566 /nfs/dbraw/zinc/16/85/66/202168566.db2.gz YMERSYRVGRKNGN-UHFFFAOYSA-N 1 2 223.345 2.400 20 0 BEADLO CC1(C)C[N@H+](Cc2cocn2)[C@H]1[C@@H]1CCCO1 ZINC000356239348 356791541 /nfs/dbraw/zinc/79/15/41/356791541.db2.gz PQBXZFGMQWIXSN-RYUDHWBXSA-N 1 2 236.315 2.064 20 0 BEADLO CC1(C)C[N@@H+](Cc2cocn2)[C@H]1[C@@H]1CCCO1 ZINC000356239348 356791543 /nfs/dbraw/zinc/79/15/43/356791543.db2.gz PQBXZFGMQWIXSN-RYUDHWBXSA-N 1 2 236.315 2.064 20 0 BEADLO CCc1ccccc1Cc1noc(C[NH+](C)C)n1 ZINC000350911502 538693301 /nfs/dbraw/zinc/69/33/01/538693301.db2.gz ZFQFMUXFTKVKOU-UHFFFAOYSA-N 1 2 245.326 2.284 20 0 BEADLO CC1(C)CCC[C@H](NC(=O)CCc2c[nH+]c[nH]2)C1 ZINC000281821745 538709596 /nfs/dbraw/zinc/70/95/96/538709596.db2.gz LGVMHKRQFIMVIA-NSHDSACASA-N 1 2 249.358 2.427 20 0 BEADLO CC1(C)CCC[C@H](NC(=O)CCc2c[nH]c[nH+]2)C1 ZINC000281821745 538709608 /nfs/dbraw/zinc/70/96/08/538709608.db2.gz LGVMHKRQFIMVIA-NSHDSACASA-N 1 2 249.358 2.427 20 0 BEADLO CCC(CC)NC(=O)[C@H]1CCn2cc(C)[nH+]c2C1 ZINC000623383170 356907270 /nfs/dbraw/zinc/90/72/70/356907270.db2.gz HHZKMYGCPRTNGP-NSHDSACASA-N 1 2 249.358 2.059 20 0 BEADLO CCc1cnccc1[C@H](C)[NH2+]Cc1ncccn1 ZINC000361771137 356936752 /nfs/dbraw/zinc/93/67/52/356936752.db2.gz WGBWDCIKRFWVGO-NSHDSACASA-N 1 2 242.326 2.285 20 0 BEADLO Cc1nc2[nH]ccc2c(NCCC(C)(F)F)[nH+]1 ZINC000450551033 202195269 /nfs/dbraw/zinc/19/52/69/202195269.db2.gz CSQNCLKMLJUTNW-UHFFFAOYSA-N 1 2 240.257 2.145 20 0 BEADLO CCN(c1cc(C)[nH+]c(C2CC2)n1)[C@@H]1CCOC1 ZINC000359967941 356898744 /nfs/dbraw/zinc/89/87/44/356898744.db2.gz LPECKHWOXYMQEX-GFCCVEGCSA-N 1 2 247.342 2.278 20 0 BEADLO Cc1nocc1C[N@@H+]1CCC[C@H]1c1ncccn1 ZINC000639864544 356900820 /nfs/dbraw/zinc/90/08/20/356900820.db2.gz DZUMGUWUZYAKQT-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1nocc1C[N@H+]1CCC[C@H]1c1ncccn1 ZINC000639864544 356900823 /nfs/dbraw/zinc/90/08/23/356900823.db2.gz DZUMGUWUZYAKQT-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO COc1cnccc1[C@H](C)[NH2+][C@H](C)c1ncc[nH]1 ZINC000353668994 538754774 /nfs/dbraw/zinc/75/47/74/538754774.db2.gz HGWTXKQVASXEQV-VHSXEESVSA-N 1 2 246.314 2.225 20 0 BEADLO C[C@@H](c1csnn1)[N@H+](C)CCc1ccccn1 ZINC000450620426 202213238 /nfs/dbraw/zinc/21/32/38/202213238.db2.gz CQITWPIBVFZJBS-JTQLQIEISA-N 1 2 248.355 2.169 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+](C)CCc1ccccn1 ZINC000450620426 202213243 /nfs/dbraw/zinc/21/32/43/202213243.db2.gz CQITWPIBVFZJBS-JTQLQIEISA-N 1 2 248.355 2.169 20 0 BEADLO CC[C@H]([NH2+]Cc1csc(C)c1C)C(=O)OC ZINC000399760432 357041025 /nfs/dbraw/zinc/04/10/25/357041025.db2.gz BMBKJLKCWLGRNL-NSHDSACASA-N 1 2 241.356 2.406 20 0 BEADLO c1[nH]cc(N[C@H]2CCc3ccccc3C2)[nH+]1 ZINC000390340995 357090097 /nfs/dbraw/zinc/09/00/97/357090097.db2.gz MWERBKWKLDLNAY-LBPRGKRZSA-N 1 2 213.284 2.379 20 0 BEADLO CC[C@H](NCc1[nH+]ccn1CC)C(F)(F)F ZINC000390522931 357100892 /nfs/dbraw/zinc/10/08/92/357100892.db2.gz FXQLUKPYQHRBAV-QMMMGPOBSA-N 1 2 235.253 2.334 20 0 BEADLO Cc1cc(F)ccc1C[NH2+][C@@H](C)c1ncn(C)n1 ZINC000391877642 357135271 /nfs/dbraw/zinc/13/52/71/357135271.db2.gz RRSJYAUWXFVTSM-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO CN(C[C@@H]1CC=CCC1)C(=O)CCc1c[nH+]c[nH]1 ZINC000355928500 538804817 /nfs/dbraw/zinc/80/48/17/538804817.db2.gz YAUGQJRAUUNZAY-GFCCVEGCSA-N 1 2 247.342 2.157 20 0 BEADLO CN(C[C@@H]1CC=CCC1)C(=O)CCc1c[nH]c[nH+]1 ZINC000355928500 538804825 /nfs/dbraw/zinc/80/48/25/538804825.db2.gz YAUGQJRAUUNZAY-GFCCVEGCSA-N 1 2 247.342 2.157 20 0 BEADLO CCc1nc(C[N@@H+]2CCC3(CCC3)C2)no1 ZINC000123343242 357224288 /nfs/dbraw/zinc/22/42/88/357224288.db2.gz DKZLMBBKNMMQFT-UHFFFAOYSA-N 1 2 221.304 2.008 20 0 BEADLO CCc1nc(C[N@H+]2CCC3(CCC3)C2)no1 ZINC000123343242 357224292 /nfs/dbraw/zinc/22/42/92/357224292.db2.gz DKZLMBBKNMMQFT-UHFFFAOYSA-N 1 2 221.304 2.008 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2C[C@@H](C)C(F)(F)[C@@H](C)C2)n1 ZINC000628392698 357188974 /nfs/dbraw/zinc/18/89/74/357188974.db2.gz VEOLLVOCLIWGSO-DTORHVGOSA-N 1 2 243.301 2.441 20 0 BEADLO Cc1c[nH]c(C[N@H+]2C[C@@H](C)C(F)(F)[C@@H](C)C2)n1 ZINC000628392698 357188979 /nfs/dbraw/zinc/18/89/79/357188979.db2.gz VEOLLVOCLIWGSO-DTORHVGOSA-N 1 2 243.301 2.441 20 0 BEADLO COc1ccc[nH+]c1NCC(C)(C)C(C)(C)O ZINC000393572865 357287572 /nfs/dbraw/zinc/28/75/72/357287572.db2.gz PRTVTAJUQPBOMX-UHFFFAOYSA-N 1 2 238.331 2.299 20 0 BEADLO CC1=CCCN(C(=O)C[C@@H](C)n2cc[nH+]c2)C1 ZINC000583698414 357272710 /nfs/dbraw/zinc/27/27/10/357272710.db2.gz ZKGOGOLXPWKHDX-GFCCVEGCSA-N 1 2 233.315 2.013 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@]12C[C@H]1CCCC2 ZINC000639899022 357276708 /nfs/dbraw/zinc/27/67/08/357276708.db2.gz AVTAYEIDXYLWEX-BXUZGUMPSA-N 1 2 245.326 2.266 20 0 BEADLO Cn1c[nH+]cc1CNc1ccc2ccccc2n1 ZINC000357593723 538829604 /nfs/dbraw/zinc/82/96/04/538829604.db2.gz IHANQUUZARONBH-UHFFFAOYSA-N 1 2 238.294 2.002 20 0 BEADLO CS[C@H]1CCN(c2nc(C)[nH+]cc2C)C1 ZINC000582555576 357343356 /nfs/dbraw/zinc/34/33/56/357343356.db2.gz BCRCHDFZBLEZHL-JTQLQIEISA-N 1 2 223.345 2.035 20 0 BEADLO CC(C)SCC(=O)Nc1cccc2[nH+]ccn21 ZINC000610234721 357356963 /nfs/dbraw/zinc/35/69/63/357356963.db2.gz KLSUFVCESKMJEJ-UHFFFAOYSA-N 1 2 249.339 2.414 20 0 BEADLO CCC[C@H](C)[C@H]1CCCN1C(=O)Cn1cc[nH+]c1 ZINC000582937995 357440769 /nfs/dbraw/zinc/44/07/69/357440769.db2.gz YOQURHRSOBDMCX-QWHCGFSZSA-N 1 2 249.358 2.310 20 0 BEADLO Cc1c[nH+]c(C)nc1NCc1ccc(F)cc1 ZINC000582875989 357418238 /nfs/dbraw/zinc/41/82/38/357418238.db2.gz YDOJUVVHSUTEPE-UHFFFAOYSA-N 1 2 231.274 2.267 20 0 BEADLO Cc1nc(N2CCC[C@H]2[C@H]2CCCOC2)cc[nH+]1 ZINC000582902735 357426297 /nfs/dbraw/zinc/42/62/97/357426297.db2.gz KWDNRIPBQMULBE-STQMWFEESA-N 1 2 247.342 2.180 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CC12CCOCC2 ZINC000395662078 357445212 /nfs/dbraw/zinc/44/52/12/357445212.db2.gz ZDWFWYYNBGVDFL-LLVKDONJSA-N 1 2 234.299 2.071 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000583005204 357454769 /nfs/dbraw/zinc/45/47/69/357454769.db2.gz OWCFGPDOKODNTK-DGCLKSJQSA-N 1 2 247.342 2.093 20 0 BEADLO CC(C)N(C(=O)C[C@@H](C)n1cc[nH+]c1)C1CC1 ZINC000583087000 357469319 /nfs/dbraw/zinc/46/93/19/357469319.db2.gz DEJOYHRYGGYTSS-LLVKDONJSA-N 1 2 235.331 2.234 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCC[C@@H](F)C1 ZINC000583095150 357478950 /nfs/dbraw/zinc/47/89/50/357478950.db2.gz YUKHRCORVPENBY-SNVBAGLBSA-N 1 2 209.268 2.032 20 0 BEADLO Cc1cc(NCCC(F)(F)F)nc[nH+]1 ZINC000063100564 357526026 /nfs/dbraw/zinc/52/60/26/357526026.db2.gz MXMJJTAKBSPMDW-UHFFFAOYSA-N 1 2 205.183 2.149 20 0 BEADLO CS[C@@H]1CC[C@@H](Nc2cc(C)[nH+]cn2)C1 ZINC000230917322 357579887 /nfs/dbraw/zinc/57/98/87/357579887.db2.gz PFRGQYBKCWOZOL-NXEZZACHSA-N 1 2 223.345 2.481 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)C1(C)CCCCC1 ZINC000232210611 357653591 /nfs/dbraw/zinc/65/35/91/357653591.db2.gz AOPGFARSADXYNM-UHFFFAOYSA-N 1 2 235.331 2.339 20 0 BEADLO Cc1cc(NCc2ccncn2)nc(C(C)C)[nH+]1 ZINC000232764766 357680934 /nfs/dbraw/zinc/68/09/34/357680934.db2.gz SBSWGDXTSFENSX-UHFFFAOYSA-N 1 2 243.314 2.311 20 0 BEADLO C[C@@H](CC(=O)N1CCC[C@@H](C)[C@H]1C)n1cc[nH+]c1 ZINC000583266499 357765420 /nfs/dbraw/zinc/76/54/20/357765420.db2.gz LXLFIRYEEDLRBE-FRRDWIJNSA-N 1 2 249.358 2.481 20 0 BEADLO CC(C)(C)n1cc(C[N@@H+]2CCCC3(CC3)C2)nn1 ZINC000191504380 357777532 /nfs/dbraw/zinc/77/75/32/357777532.db2.gz VEYRODSQCIFMCT-UHFFFAOYSA-N 1 2 248.374 2.409 20 0 BEADLO CC(C)(C)n1cc(C[N@H+]2CCCC3(CC3)C2)nn1 ZINC000191504380 357777538 /nfs/dbraw/zinc/77/75/38/357777538.db2.gz VEYRODSQCIFMCT-UHFFFAOYSA-N 1 2 248.374 2.409 20 0 BEADLO Cc1ccc2[nH+]c(CSCCCO)cn2c1 ZINC000085163338 134224538 /nfs/dbraw/zinc/22/45/38/134224538.db2.gz YUTSRHNYSLCPNI-UHFFFAOYSA-N 1 2 236.340 2.258 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C[N@H+](CCO)CC(F)F ZINC000193024897 357864849 /nfs/dbraw/zinc/86/48/49/357864849.db2.gz FCFSPRBFKOCQDB-GHMZBOCLSA-N 1 2 235.318 2.372 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C[N@@H+](CCO)CC(F)F ZINC000193024897 357864851 /nfs/dbraw/zinc/86/48/51/357864851.db2.gz FCFSPRBFKOCQDB-GHMZBOCLSA-N 1 2 235.318 2.372 20 0 BEADLO Cc1cnccc1C[NH2+][C@@H](C)c1csnn1 ZINC000398291399 357882665 /nfs/dbraw/zinc/88/26/65/357882665.db2.gz IKPZWNMEJFXLOT-VIFPVBQESA-N 1 2 234.328 2.092 20 0 BEADLO OCCSCc1[nH+]ccn1Cc1ccccc1 ZINC000610395159 357910595 /nfs/dbraw/zinc/91/05/95/357910595.db2.gz GWFPEFOXYPWJAN-UHFFFAOYSA-N 1 2 248.351 2.157 20 0 BEADLO Cc1cc(C(=O)COc2cc[nH+]cc2)c(C)n1C ZINC000583730056 357919795 /nfs/dbraw/zinc/91/97/95/357919795.db2.gz IMBGDSSQUYGFEE-UHFFFAOYSA-N 1 2 244.294 2.299 20 0 BEADLO CC(C)C1(NC(=O)[C@H]2CCCc3[nH+]c[nH]c32)CC1 ZINC000584429518 357920061 /nfs/dbraw/zinc/92/00/61/357920061.db2.gz GJECITQVAXAKPK-JTQLQIEISA-N 1 2 247.342 2.134 20 0 BEADLO CC(C)C1(NC(=O)[C@H]2CCCc3[nH]c[nH+]c32)CC1 ZINC000584429518 357920064 /nfs/dbraw/zinc/92/00/64/357920064.db2.gz GJECITQVAXAKPK-JTQLQIEISA-N 1 2 247.342 2.134 20 0 BEADLO COC(=O)[C@@H]([NH2+]Cc1ccc(F)cc1)C(C)C ZINC000035084840 357962546 /nfs/dbraw/zinc/96/25/46/357962546.db2.gz IPEMWZNKZWNGCP-LBPRGKRZSA-N 1 2 239.290 2.113 20 0 BEADLO CCc1nc(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)no1 ZINC000660931107 491117976 /nfs/dbraw/zinc/11/79/76/491117976.db2.gz PNOQRCAWOWUOHF-UWVGGRQHSA-N 1 2 221.304 2.006 20 0 BEADLO CCc1nc(C[N@H+]2C[C@@H]3CCCC[C@@H]32)no1 ZINC000660931107 491117977 /nfs/dbraw/zinc/11/79/77/491117977.db2.gz PNOQRCAWOWUOHF-UWVGGRQHSA-N 1 2 221.304 2.006 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)C[C@@H]1CCC(C)(C)O1 ZINC000639970334 358023131 /nfs/dbraw/zinc/02/31/31/358023131.db2.gz DIOOSEJFLXFRGX-LBPRGKRZSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)C[C@@H]1CCC(C)(C)O1 ZINC000639970334 358023132 /nfs/dbraw/zinc/02/31/32/358023132.db2.gz DIOOSEJFLXFRGX-LBPRGKRZSA-N 1 2 237.347 2.108 20 0 BEADLO COC1(CC[N@H+](C)Cc2cn[nH]c2C)CCC1 ZINC000639970812 358024293 /nfs/dbraw/zinc/02/42/93/358024293.db2.gz LARGKOGRBGGTSP-UHFFFAOYSA-N 1 2 237.347 2.109 20 0 BEADLO COC1(CC[N@@H+](C)Cc2cn[nH]c2C)CCC1 ZINC000639970812 358024297 /nfs/dbraw/zinc/02/42/97/358024297.db2.gz LARGKOGRBGGTSP-UHFFFAOYSA-N 1 2 237.347 2.109 20 0 BEADLO CCc1noc(C[NH+]2CCC(CCF)CC2)n1 ZINC000639987816 358027140 /nfs/dbraw/zinc/02/71/40/358027140.db2.gz ROWRKYPIBQDCLS-UHFFFAOYSA-N 1 2 241.310 2.204 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)CC[C@H]1CCCCO1 ZINC000639971803 358031168 /nfs/dbraw/zinc/03/11/68/358031168.db2.gz XDGOAEKYPFHVQE-CYBMUJFWSA-N 1 2 237.347 2.109 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)CC[C@H]1CCCCO1 ZINC000639971803 358031172 /nfs/dbraw/zinc/03/11/72/358031172.db2.gz XDGOAEKYPFHVQE-CYBMUJFWSA-N 1 2 237.347 2.109 20 0 BEADLO CNC(=O)C[N@H+](C)[C@@H](C)c1ccccc1Cl ZINC000053148276 358106040 /nfs/dbraw/zinc/10/60/40/358106040.db2.gz WPFHSXUYHUOSNC-VIFPVBQESA-N 1 2 240.734 2.079 20 0 BEADLO CNC(=O)C[N@@H+](C)[C@@H](C)c1ccccc1Cl ZINC000053148276 358106043 /nfs/dbraw/zinc/10/60/43/358106043.db2.gz WPFHSXUYHUOSNC-VIFPVBQESA-N 1 2 240.734 2.079 20 0 BEADLO CCN(Cc1c[nH+]cn1C)[C@H](C)C(F)(F)F ZINC000640053859 358141838 /nfs/dbraw/zinc/14/18/38/358141838.db2.gz XQAYKDQRSCHKIO-MRVPVSSYSA-N 1 2 235.253 2.193 20 0 BEADLO Cc1nc([C@@H](C)[NH+]2C3CCC2CC3)no1 ZINC000584688660 358152082 /nfs/dbraw/zinc/15/20/82/358152082.db2.gz ATWORTUQCFMJAQ-CUUXFQNZSA-N 1 2 207.277 2.066 20 0 BEADLO C[C@H](CC(=O)N1CCCC[C@@H](C)C1)n1cc[nH+]c1 ZINC000584783328 358177220 /nfs/dbraw/zinc/17/72/20/358177220.db2.gz BCTZVAFTYXXPSJ-CHWSQXEVSA-N 1 2 249.358 2.483 20 0 BEADLO CC(C)c1nc(N[C@H]2CCOC2(C)C)cc[nH+]1 ZINC000450635357 202219049 /nfs/dbraw/zinc/21/90/49/202219049.db2.gz BEDDZRKXYMQBNI-JTQLQIEISA-N 1 2 235.331 2.001 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H](C)C(F)F ZINC000640129070 358207303 /nfs/dbraw/zinc/20/73/03/358207303.db2.gz SXURGQDCPFTGAK-MRVPVSSYSA-N 1 2 243.257 2.474 20 0 BEADLO CO[C@@H]1CCCN(c2cc[nH+]c(C(C)C)n2)C1 ZINC000171924826 134262916 /nfs/dbraw/zinc/26/29/16/134262916.db2.gz OJHHWUNFLMQYAJ-LLVKDONJSA-N 1 2 235.331 2.215 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2cnn[nH]2)ccc1F ZINC000450677149 202232397 /nfs/dbraw/zinc/23/23/97/202232397.db2.gz GBIZSTBINGORIR-SECBINFHSA-N 1 2 234.278 2.103 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2c[nH]nn2)ccc1F ZINC000450677149 202232400 /nfs/dbraw/zinc/23/24/00/202232400.db2.gz GBIZSTBINGORIR-SECBINFHSA-N 1 2 234.278 2.103 20 0 BEADLO CCCC[N@H+](CCCO)[C@H](C)c1csnn1 ZINC000450686688 202235020 /nfs/dbraw/zinc/23/50/20/202235020.db2.gz CYDQPOPZNRYPGV-SNVBAGLBSA-N 1 2 243.376 2.084 20 0 BEADLO CCCC[N@@H+](CCCO)[C@H](C)c1csnn1 ZINC000450686688 202235022 /nfs/dbraw/zinc/23/50/22/202235022.db2.gz CYDQPOPZNRYPGV-SNVBAGLBSA-N 1 2 243.376 2.084 20 0 BEADLO COc1ccc([C@@H](C)[NH2+]Cc2cc[nH]n2)c(F)c1 ZINC000041015407 358241494 /nfs/dbraw/zinc/24/14/94/358241494.db2.gz STRUQILZGKQAPX-SECBINFHSA-N 1 2 249.289 2.408 20 0 BEADLO CCc1ccc(C[NH2+]Cc2ncccn2)s1 ZINC000225264159 358247601 /nfs/dbraw/zinc/24/76/01/358247601.db2.gz NHDDFPBJDGXXBX-UHFFFAOYSA-N 1 2 233.340 2.390 20 0 BEADLO CCCC[C@@H]([NH2+]Cc1c[nH]nn1)C1CCC1 ZINC000450730295 202249764 /nfs/dbraw/zinc/24/97/64/202249764.db2.gz WAGCPBIVTGVUCF-GFCCVEGCSA-N 1 2 222.336 2.253 20 0 BEADLO CCCC[C@@H]([NH2+]Cc1cn[nH]n1)C1CCC1 ZINC000450730295 202249767 /nfs/dbraw/zinc/24/97/67/202249767.db2.gz WAGCPBIVTGVUCF-GFCCVEGCSA-N 1 2 222.336 2.253 20 0 BEADLO CC[C@@H]1C[C@H]1CNc1cc[nH+]c(C2CC2)n1 ZINC000450725991 202247156 /nfs/dbraw/zinc/24/71/56/202247156.db2.gz STVGHRHTTKENAX-KOLCDFICSA-N 1 2 217.316 2.234 20 0 BEADLO Cc1cccc(C)c1[C@H](C)[NH2+]Cc1c[nH]nn1 ZINC000450748057 202253677 /nfs/dbraw/zinc/25/36/77/202253677.db2.gz RIUUHJQEUZNNDL-NSHDSACASA-N 1 2 230.315 2.272 20 0 BEADLO Cc1cccc(C)c1[C@H](C)[NH2+]Cc1cn[nH]n1 ZINC000450748057 202253678 /nfs/dbraw/zinc/25/36/78/202253678.db2.gz RIUUHJQEUZNNDL-NSHDSACASA-N 1 2 230.315 2.272 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCCO[C@@H](C(C)C)C1 ZINC000578206470 366391201 /nfs/dbraw/zinc/39/12/01/366391201.db2.gz UAORWNNHEPZOHA-CYBMUJFWSA-N 1 2 249.358 2.345 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1CCSC1 ZINC000226386483 358338303 /nfs/dbraw/zinc/33/83/03/358338303.db2.gz YGYOSKXXVHRLSX-VIFPVBQESA-N 1 2 224.329 2.255 20 0 BEADLO CCC[C@H](OC)c1noc(C[NH+](CC)CC)n1 ZINC000351127766 366417545 /nfs/dbraw/zinc/41/75/45/366417545.db2.gz BWRMKTUBDDWKTR-JTQLQIEISA-N 1 2 241.335 2.399 20 0 BEADLO C[NH+](C)Cc1nc(C(C)(C)C2CCC2)no1 ZINC000351166898 366436465 /nfs/dbraw/zinc/43/64/65/366436465.db2.gz HWTSFZFKKOENMQ-UHFFFAOYSA-N 1 2 223.320 2.209 20 0 BEADLO CC[C@@H](SC)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000610961030 358399254 /nfs/dbraw/zinc/39/92/54/358399254.db2.gz DOZGWBZIWYGFLM-SNVBAGLBSA-N 1 2 249.339 2.414 20 0 BEADLO COC(C)(C)c1nc(Cc2ccc[nH+]c2C)no1 ZINC000351223091 366449015 /nfs/dbraw/zinc/44/90/15/366449015.db2.gz BNIRHTJJLKIGRO-UHFFFAOYSA-N 1 2 247.298 2.245 20 0 BEADLO CCC[C@H]1CCCN(C(=O)Cc2c[nH+]cn2C)C1 ZINC000580416365 358515779 /nfs/dbraw/zinc/51/57/79/358515779.db2.gz HDGAVNJTYWYHRP-LBPRGKRZSA-N 1 2 249.358 2.001 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H](C)c1cccc(C)c1 ZINC000042307556 358520504 /nfs/dbraw/zinc/52/05/04/358520504.db2.gz HXQWGGDBTSBVOT-WDEREUQCSA-N 1 2 221.300 2.207 20 0 BEADLO CCc1nc(C[N@@H+]2CCC3(CCCC3)C2)no1 ZINC000174265901 134279790 /nfs/dbraw/zinc/27/97/90/134279790.db2.gz ZXTWPDMQLGGJPV-UHFFFAOYSA-N 1 2 235.331 2.398 20 0 BEADLO CCc1nc(C[N@H+]2CCC3(CCCC3)C2)no1 ZINC000174265901 134279791 /nfs/dbraw/zinc/27/97/91/134279791.db2.gz ZXTWPDMQLGGJPV-UHFFFAOYSA-N 1 2 235.331 2.398 20 0 BEADLO CC[C@@H](O)CCNc1cc(C)[nH+]c(C(C)C)n1 ZINC000127260857 358561505 /nfs/dbraw/zinc/56/15/05/358561505.db2.gz DPZSZFWQMMTYMX-LLVKDONJSA-N 1 2 237.347 2.481 20 0 BEADLO CCN(Cc1[nH+]ccn1CC)Cc1ccccn1 ZINC000125392683 358538245 /nfs/dbraw/zinc/53/82/45/358538245.db2.gz LLSNIAGWXDQIDA-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO COc1cc(C)[nH+]c(CN(C)c2cc(C)[nH]n2)c1 ZINC000640192504 358601595 /nfs/dbraw/zinc/60/15/95/358601595.db2.gz YEGJUWGMHTXHDX-UHFFFAOYSA-N 1 2 246.314 2.067 20 0 BEADLO CCCCCCNC(=O)[C@H]1CCn2c[nH+]cc2C1 ZINC000130703534 358641386 /nfs/dbraw/zinc/64/13/86/358641386.db2.gz BONLCENIJPUEHC-LBPRGKRZSA-N 1 2 249.358 2.142 20 0 BEADLO COC(=O)c1coc(CNc2ccc[nH+]c2C)c1 ZINC000130808640 358647531 /nfs/dbraw/zinc/64/75/31/358647531.db2.gz KSSBVAZQBMNXFW-UHFFFAOYSA-N 1 2 246.266 2.382 20 0 BEADLO O=C(Nc1ccccc1-n1cc[nH+]c1)C1CC1 ZINC000048698135 358649172 /nfs/dbraw/zinc/64/91/72/358649172.db2.gz SOENAZOEYGSJFP-UHFFFAOYSA-N 1 2 227.267 2.221 20 0 BEADLO CCC(=O)NCc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000049043386 358668719 /nfs/dbraw/zinc/66/87/19/358668719.db2.gz XAPYLGNAMNGWJN-UHFFFAOYSA-N 1 2 247.273 2.038 20 0 BEADLO CC[C@@H](NC(=O)Cc1c[nH+]cn1C)C1CCCC1 ZINC000578220989 366460344 /nfs/dbraw/zinc/46/03/44/366460344.db2.gz UPEVKQPJXNQKEY-CYBMUJFWSA-N 1 2 249.358 2.048 20 0 BEADLO COCC[N@H+](C)Cc1csc(C(C)C)n1 ZINC000054361580 358859364 /nfs/dbraw/zinc/85/93/64/358859364.db2.gz HRPRMTDXVWXFOD-UHFFFAOYSA-N 1 2 228.361 2.345 20 0 BEADLO COCC[N@@H+](C)Cc1csc(C(C)C)n1 ZINC000054361580 358859365 /nfs/dbraw/zinc/85/93/65/358859365.db2.gz HRPRMTDXVWXFOD-UHFFFAOYSA-N 1 2 228.361 2.345 20 0 BEADLO CCCC1(c2noc(C[NH+](C)C)n2)CCC1 ZINC000351381237 366519976 /nfs/dbraw/zinc/51/99/76/366519976.db2.gz ONFLYJPUSMBLDE-UHFFFAOYSA-N 1 2 223.320 2.353 20 0 BEADLO C[C@@]1(C2CCCCC2)CC[N@@H+]1CCc1cnn[nH]1 ZINC000640220831 358889912 /nfs/dbraw/zinc/88/99/12/358889912.db2.gz YOIXWZSTVHZVER-AWEZNQCLSA-N 1 2 248.374 2.392 20 0 BEADLO C[C@@]1(C2CCCCC2)CC[N@H+]1CCc1cnn[nH]1 ZINC000640220831 358889918 /nfs/dbraw/zinc/88/99/18/358889918.db2.gz YOIXWZSTVHZVER-AWEZNQCLSA-N 1 2 248.374 2.392 20 0 BEADLO Cn1c[nH+]cc1Cc1noc(C(F)=C2CCC2)n1 ZINC000351328017 366507050 /nfs/dbraw/zinc/50/70/50/366507050.db2.gz QRPNNAJJGOACNJ-UHFFFAOYSA-N 1 2 248.261 2.258 20 0 BEADLO CC[C@H](NC(=O)c1cccc(F)c1)c1[nH]cc[nH+]1 ZINC000140503009 358922366 /nfs/dbraw/zinc/92/23/66/358922366.db2.gz QYSVTEKEHXVMES-NSHDSACASA-N 1 2 247.273 2.430 20 0 BEADLO CC[C@H](NC(=O)Cc1ccsc1)c1[nH]cc[nH+]1 ZINC000140475007 358922837 /nfs/dbraw/zinc/92/28/37/358922837.db2.gz FSWGEAPGHHURFA-JTQLQIEISA-N 1 2 249.339 2.281 20 0 BEADLO CC[C@@H](NC(=O)c1occc1C)c1[nH]cc[nH+]1 ZINC000140601232 358923632 /nfs/dbraw/zinc/92/36/32/358923632.db2.gz RDQIETAQTQHFNR-SECBINFHSA-N 1 2 233.271 2.192 20 0 BEADLO CC[C@H](NC(=O)Cc1cccs1)c1[nH]cc[nH+]1 ZINC000140676417 358925228 /nfs/dbraw/zinc/92/52/28/358925228.db2.gz BNEJAQMDYXVKDH-JTQLQIEISA-N 1 2 249.339 2.281 20 0 BEADLO CCOC1CC(C[N@@H+]2OC3CCC2CC3)C1 ZINC000640230101 358943555 /nfs/dbraw/zinc/94/35/55/358943555.db2.gz JXYGQGYYGVKLBA-UHFFFAOYSA-N 1 2 225.332 2.360 20 0 BEADLO CCOC1CC(C[N@H+]2OC3CCC2CC3)C1 ZINC000640230101 358943560 /nfs/dbraw/zinc/94/35/60/358943560.db2.gz JXYGQGYYGVKLBA-UHFFFAOYSA-N 1 2 225.332 2.360 20 0 BEADLO C[C@H]1C[C@H](C[N@@H+]2OC3CCC2CC3)CCO1 ZINC000640230937 358944279 /nfs/dbraw/zinc/94/42/79/358944279.db2.gz WYEGJGNVFHYJOT-ZFDZMSFRSA-N 1 2 225.332 2.360 20 0 BEADLO C[C@H]1C[C@H](C[N@H+]2OC3CCC2CC3)CCO1 ZINC000640230937 358944280 /nfs/dbraw/zinc/94/42/80/358944280.db2.gz WYEGJGNVFHYJOT-ZFDZMSFRSA-N 1 2 225.332 2.360 20 0 BEADLO CCC[C@H](CCO)CNc1cc(CC)[nH+]cn1 ZINC000231151731 359009043 /nfs/dbraw/zinc/00/90/43/359009043.db2.gz QFUVFHGMNACEHS-LLVKDONJSA-N 1 2 237.347 2.250 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)c1ccc(Cl)cc1 ZINC000070979198 359067568 /nfs/dbraw/zinc/06/75/68/359067568.db2.gz DWSHLLFLNKWCOM-UHFFFAOYSA-N 1 2 249.701 2.335 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)CC1CCCCC1 ZINC000070979000 359067577 /nfs/dbraw/zinc/06/75/77/359067577.db2.gz JLGVEVMHHVHEOW-UHFFFAOYSA-N 1 2 235.331 2.339 20 0 BEADLO OCc1cccc(CNc2cccc[nH+]2)c1 ZINC000071354560 359076990 /nfs/dbraw/zinc/07/69/90/359076990.db2.gz HQNVADWVXLAXAX-UHFFFAOYSA-N 1 2 214.268 2.186 20 0 BEADLO C[C@@H]([NH2+]Cc1ccccc1F)c1nccn1C ZINC000070443419 359053110 /nfs/dbraw/zinc/05/31/10/359053110.db2.gz YZHVHNZEXRVQSK-SNVBAGLBSA-N 1 2 233.290 2.410 20 0 BEADLO Cc1cnc(C[N@H+]2CCS[C@H](C)[C@H]2C)o1 ZINC000247476709 359223622 /nfs/dbraw/zinc/22/36/22/359223622.db2.gz JTTHPDBOZDSYHQ-NXEZZACHSA-N 1 2 226.345 2.309 20 0 BEADLO Cc1cnc(C[N@@H+]2CCS[C@H](C)[C@H]2C)o1 ZINC000247476709 359223627 /nfs/dbraw/zinc/22/36/27/359223627.db2.gz JTTHPDBOZDSYHQ-NXEZZACHSA-N 1 2 226.345 2.309 20 0 BEADLO Brc1ccoc1C[NH+]1CCC1 ZINC000306216274 359322973 /nfs/dbraw/zinc/32/29/73/359322973.db2.gz IUJCNHVIVFRTRI-UHFFFAOYSA-N 1 2 216.078 2.248 20 0 BEADLO CCC[C@H](C(=O)OCC)[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000611502512 359384768 /nfs/dbraw/zinc/38/47/68/359384768.db2.gz UVMKMIBCAAYLFJ-IJLUTSLNSA-N 1 2 245.338 2.398 20 0 BEADLO CCC[C@H](C(=O)OCC)[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000611502512 359384773 /nfs/dbraw/zinc/38/47/73/359384773.db2.gz UVMKMIBCAAYLFJ-IJLUTSLNSA-N 1 2 245.338 2.398 20 0 BEADLO CC[C@H]([NH2+]CC1=CCCCC1)C(=O)OC ZINC000379572825 359549095 /nfs/dbraw/zinc/54/90/95/359549095.db2.gz UCMXBEPEZLNLQQ-NSHDSACASA-N 1 2 211.305 2.028 20 0 BEADLO Cc1ncncc1[C@@H](C)[NH2+]Cc1nccs1 ZINC000580465498 359570214 /nfs/dbraw/zinc/57/02/14/359570214.db2.gz LBNHURGMERWUDR-MRVPVSSYSA-N 1 2 234.328 2.092 20 0 BEADLO CCc1cccnc1[C@H](C)[NH2+]Cc1ncccn1 ZINC000580466756 359571059 /nfs/dbraw/zinc/57/10/59/359571059.db2.gz LXAZSBSEVIWJOI-NSHDSACASA-N 1 2 242.326 2.285 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)C12CC(C1)C2 ZINC000626777081 359652006 /nfs/dbraw/zinc/65/20/06/359652006.db2.gz JCKLSIYHACPEHY-UHFFFAOYSA-N 1 2 227.267 2.073 20 0 BEADLO Clc1cnc(C[N@@H+]2CCCSCC2)cn1 ZINC000231277751 359665447 /nfs/dbraw/zinc/66/54/47/359665447.db2.gz LYKVRLOPKAKCMH-UHFFFAOYSA-N 1 2 243.763 2.069 20 0 BEADLO Clc1cnc(C[N@H+]2CCCSCC2)cn1 ZINC000231277751 359665451 /nfs/dbraw/zinc/66/54/51/359665451.db2.gz LYKVRLOPKAKCMH-UHFFFAOYSA-N 1 2 243.763 2.069 20 0 BEADLO CC[C@@H](Nc1nc(C)[nH+]c2c1CCCC2)[C@@H](C)O ZINC000450804272 202269692 /nfs/dbraw/zinc/26/96/92/202269692.db2.gz XYTZEOVEYGKCJN-BXKDBHETSA-N 1 2 249.358 2.235 20 0 BEADLO Cc1nc(N(C)[C@@H](CO)CC(C)(C)C)cc[nH+]1 ZINC000450838013 202284448 /nfs/dbraw/zinc/28/44/48/202284448.db2.gz WWTITEKIWPSIOP-LLVKDONJSA-N 1 2 237.347 2.018 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)/C=C/c1ccncc1 ZINC000107294110 359738215 /nfs/dbraw/zinc/73/82/15/359738215.db2.gz GMUOIVCGEMBASQ-NSCUHMNNSA-N 1 2 239.278 2.437 20 0 BEADLO Cc1cc(N[C@@H]2CCC(F)(F)C2)nc[nH+]1 ZINC000309076813 491144128 /nfs/dbraw/zinc/14/41/28/491144128.db2.gz LKTAPAQJZQOZIG-MRVPVSSYSA-N 1 2 213.231 2.385 20 0 BEADLO CO[C@]1(C)CCC[N@@H+]([C@@H](C)c2csnn2)C1 ZINC000450885388 202298912 /nfs/dbraw/zinc/29/89/12/202298912.db2.gz BOBWJZNNJVFIFT-GXSJLCMTSA-N 1 2 241.360 2.100 20 0 BEADLO CO[C@]1(C)CCC[N@H+]([C@@H](C)c2csnn2)C1 ZINC000450885388 202298914 /nfs/dbraw/zinc/29/89/14/202298914.db2.gz BOBWJZNNJVFIFT-GXSJLCMTSA-N 1 2 241.360 2.100 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@H](C)c2csnn2)CCCO1 ZINC000450902502 202303187 /nfs/dbraw/zinc/30/31/87/202303187.db2.gz KYBYQVVPYRHTAF-NXEZZACHSA-N 1 2 241.360 2.100 20 0 BEADLO CC[C@@H]1C[N@H+]([C@H](C)c2csnn2)CCCO1 ZINC000450902502 202303188 /nfs/dbraw/zinc/30/31/88/202303188.db2.gz KYBYQVVPYRHTAF-NXEZZACHSA-N 1 2 241.360 2.100 20 0 BEADLO COC[C@@H]1CCCCN1c1cc[nH+]c(C2CC2)n1 ZINC000450932310 202311913 /nfs/dbraw/zinc/31/19/13/202311913.db2.gz CKHCWJZRRFRZCZ-LBPRGKRZSA-N 1 2 247.342 2.359 20 0 BEADLO COC[C@H]1CCCCN1c1cc[nH+]c(C2CC2)n1 ZINC000450932308 202313237 /nfs/dbraw/zinc/31/32/37/202313237.db2.gz CKHCWJZRRFRZCZ-GFCCVEGCSA-N 1 2 247.342 2.359 20 0 BEADLO COc1ccnc(C[NH2+][C@@H](C)c2ccsc2)n1 ZINC000450942036 202316421 /nfs/dbraw/zinc/31/64/21/202316421.db2.gz QUFMMIPTWFIYNV-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO CC(C)C[C@H](C)[N@@H+]1CCOCC(F)(F)C1 ZINC000451045598 202336040 /nfs/dbraw/zinc/33/60/40/202336040.db2.gz YDGIQPNRYQMMFS-JTQLQIEISA-N 1 2 221.291 2.389 20 0 BEADLO CC(C)C[C@H](C)[N@H+]1CCOCC(F)(F)C1 ZINC000451045598 202336044 /nfs/dbraw/zinc/33/60/44/202336044.db2.gz YDGIQPNRYQMMFS-JTQLQIEISA-N 1 2 221.291 2.389 20 0 BEADLO COC(=O)[C@H](CC(C)C)[N@@H+]1CCC[C@@](C)(F)C1 ZINC000451115965 202353637 /nfs/dbraw/zinc/35/36/37/202353637.db2.gz QCYJQSOEJXBFQO-WCQYABFASA-N 1 2 245.338 2.398 20 0 BEADLO COC(=O)[C@H](CC(C)C)[N@H+]1CCC[C@@](C)(F)C1 ZINC000451115965 202353639 /nfs/dbraw/zinc/35/36/39/202353639.db2.gz QCYJQSOEJXBFQO-WCQYABFASA-N 1 2 245.338 2.398 20 0 BEADLO CC(=O)c1ccc(C[N@H+](C2CC2)C2COC2)cc1 ZINC000451124028 202359768 /nfs/dbraw/zinc/35/97/68/202359768.db2.gz GBUIJUWWYYMURF-UHFFFAOYSA-N 1 2 245.322 2.252 20 0 BEADLO CC(=O)c1ccc(C[N@@H+](C2CC2)C2COC2)cc1 ZINC000451124028 202359771 /nfs/dbraw/zinc/35/97/71/202359771.db2.gz GBUIJUWWYYMURF-UHFFFAOYSA-N 1 2 245.322 2.252 20 0 BEADLO Cc1cccc(C[NH2+]Cc2nccs2)n1 ZINC000082394324 491145671 /nfs/dbraw/zinc/14/56/71/491145671.db2.gz HVCPSZBXCMXUSN-UHFFFAOYSA-N 1 2 219.313 2.136 20 0 BEADLO Fc1ccccc1OCC[N@H+]1CC[C@@H](F)C1 ZINC000451191497 202377028 /nfs/dbraw/zinc/37/70/28/202377028.db2.gz RNZXZZYAPBNOSY-SNVBAGLBSA-N 1 2 227.254 2.248 20 0 BEADLO Fc1ccccc1OCC[N@@H+]1CC[C@@H](F)C1 ZINC000451191497 202377030 /nfs/dbraw/zinc/37/70/30/202377030.db2.gz RNZXZZYAPBNOSY-SNVBAGLBSA-N 1 2 227.254 2.248 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1CCCC(C)(C)C1 ZINC000578785626 366649179 /nfs/dbraw/zinc/64/91/79/366649179.db2.gz OOJDMYDAYSUEAX-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1CCCC(C)(C)C1 ZINC000578785626 366649181 /nfs/dbraw/zinc/64/91/81/366649181.db2.gz OOJDMYDAYSUEAX-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)NCC(C)(C)C)ccn12 ZINC000578903845 366672161 /nfs/dbraw/zinc/67/21/61/366672161.db2.gz CIHHSRZRTQYINU-UHFFFAOYSA-N 1 2 245.326 2.419 20 0 BEADLO CC[C@]1(C)CCN(C(=O)[C@@H](C)Cc2c[nH+]c[nH]2)C1 ZINC000578905801 366672492 /nfs/dbraw/zinc/67/24/92/366672492.db2.gz JNGCDLKDAVEXAB-SMDDNHRTSA-N 1 2 249.358 2.237 20 0 BEADLO CC[C@]1(C)CCN(C(=O)[C@@H](C)Cc2c[nH]c[nH+]2)C1 ZINC000578905801 366672499 /nfs/dbraw/zinc/67/24/99/366672499.db2.gz JNGCDLKDAVEXAB-SMDDNHRTSA-N 1 2 249.358 2.237 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CCC[C@@H]3C[C@@H]32)c(C)c[nH+]1 ZINC000612746488 360040047 /nfs/dbraw/zinc/04/00/47/360040047.db2.gz BKEDYORMOISTOW-UPJWGTAASA-N 1 2 244.338 2.495 20 0 BEADLO CN(C)c1ccc(NCc2ccn(C)c2)c[nH+]1 ZINC000091007762 360098328 /nfs/dbraw/zinc/09/83/28/360098328.db2.gz CHWOSIUFEXJXFS-UHFFFAOYSA-N 1 2 230.315 2.098 20 0 BEADLO COC(=O)c1ccc(CNc2ccc[nH+]c2C)o1 ZINC000091495665 360117038 /nfs/dbraw/zinc/11/70/38/360117038.db2.gz HPKMQDLWYRBVAD-UHFFFAOYSA-N 1 2 246.266 2.382 20 0 BEADLO CC[C@@H]([NH2+]Cc1cn(C)cn1)c1nccs1 ZINC000309385151 491147818 /nfs/dbraw/zinc/14/78/18/491147818.db2.gz BCMMWBNYLOWRHM-SNVBAGLBSA-N 1 2 236.344 2.118 20 0 BEADLO CC[C@@H](NCc1cn(C)c[nH+]1)c1nccs1 ZINC000309385151 491147819 /nfs/dbraw/zinc/14/78/19/491147819.db2.gz BCMMWBNYLOWRHM-SNVBAGLBSA-N 1 2 236.344 2.118 20 0 BEADLO Cn1cccc1C[N@H+](C)Cc1cncs1 ZINC000093584375 360257519 /nfs/dbraw/zinc/25/75/19/360257519.db2.gz ZFGDIGKROFJJCV-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO Cn1cccc1C[N@@H+](C)Cc1cncs1 ZINC000093584375 360257525 /nfs/dbraw/zinc/25/75/25/360257525.db2.gz ZFGDIGKROFJJCV-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2c[nH]cn2)n1 ZINC000093453371 360244787 /nfs/dbraw/zinc/24/47/87/360244787.db2.gz JFIACQVHXLBQDP-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2c[nH]cn2)n1 ZINC000093453371 360244792 /nfs/dbraw/zinc/24/47/92/360244792.db2.gz JFIACQVHXLBQDP-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cnc[nH]2)n1 ZINC000093453371 360244797 /nfs/dbraw/zinc/24/47/97/360244797.db2.gz JFIACQVHXLBQDP-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cnc[nH]2)n1 ZINC000093453371 360244799 /nfs/dbraw/zinc/24/47/99/360244799.db2.gz JFIACQVHXLBQDP-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO CCc1cc(NCC(F)(F)F)nc[nH+]1 ZINC000040765040 360301903 /nfs/dbraw/zinc/30/19/03/360301903.db2.gz IAKSQXLNJUXEBD-UHFFFAOYSA-N 1 2 205.183 2.013 20 0 BEADLO c1cc([C@H]2CN(Cc3c[nH+]c[nH]3)CCO2)cs1 ZINC000093768358 360274407 /nfs/dbraw/zinc/27/44/07/360274407.db2.gz JJYPNMANWGTCEP-GFCCVEGCSA-N 1 2 249.339 2.045 20 0 BEADLO c1cc([C@H]2CN(Cc3c[nH]c[nH+]3)CCO2)cs1 ZINC000093768358 360274408 /nfs/dbraw/zinc/27/44/08/360274408.db2.gz JJYPNMANWGTCEP-GFCCVEGCSA-N 1 2 249.339 2.045 20 0 BEADLO O=C(Nc1ccccc1)[C@@H]1CCn2c[nH+]cc2C1 ZINC000096642058 360351126 /nfs/dbraw/zinc/35/11/26/360351126.db2.gz SFBZJIGZDBKNSR-LLVKDONJSA-N 1 2 241.294 2.084 20 0 BEADLO CCC[C@H](C(=O)OCC)[N@H+](C)Cc1ccoc1 ZINC000098003093 360387348 /nfs/dbraw/zinc/38/73/48/360387348.db2.gz MTXSTPGOHZAREN-GFCCVEGCSA-N 1 2 239.315 2.443 20 0 BEADLO CCC[C@H](C(=O)OCC)[N@@H+](C)Cc1ccoc1 ZINC000098003093 360387353 /nfs/dbraw/zinc/38/73/53/360387353.db2.gz MTXSTPGOHZAREN-GFCCVEGCSA-N 1 2 239.315 2.443 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@@H]2CCCCO2)oc1C ZINC000098134112 360389585 /nfs/dbraw/zinc/38/95/85/360389585.db2.gz HBGQZRPFZCOMNH-LBPRGKRZSA-N 1 2 238.331 2.292 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@@H]2CCCCO2)oc1C ZINC000098134112 360389588 /nfs/dbraw/zinc/38/95/88/360389588.db2.gz HBGQZRPFZCOMNH-LBPRGKRZSA-N 1 2 238.331 2.292 20 0 BEADLO CCC(=O)c1ccc(NC(=O)[C@H](C)[NH+](C)C)cc1 ZINC000628692125 360610431 /nfs/dbraw/zinc/61/04/31/360610431.db2.gz MBTFIRUIIHVQBH-JTQLQIEISA-N 1 2 248.326 2.168 20 0 BEADLO CCC(C)(C)CCNC(=O)CCc1c[nH+]c[nH]1 ZINC000633968828 360663235 /nfs/dbraw/zinc/66/32/35/360663235.db2.gz WDWLREWFACITEW-UHFFFAOYSA-N 1 2 237.347 2.285 20 0 BEADLO CCC(C)(C)CCNC(=O)CCc1c[nH]c[nH+]1 ZINC000633968828 360663236 /nfs/dbraw/zinc/66/32/36/360663236.db2.gz WDWLREWFACITEW-UHFFFAOYSA-N 1 2 237.347 2.285 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NCC[C@H]1CC=CCC1 ZINC000628889062 360728995 /nfs/dbraw/zinc/72/89/95/360728995.db2.gz GLBFRZIIOIXSHZ-LBPRGKRZSA-N 1 2 247.342 2.205 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NCC[C@H]1CC=CCC1 ZINC000628889062 360728998 /nfs/dbraw/zinc/72/89/98/360728998.db2.gz GLBFRZIIOIXSHZ-LBPRGKRZSA-N 1 2 247.342 2.205 20 0 BEADLO Cn1cc([C@@H]([NH2+]CC(F)F)C(C)(C)C)cn1 ZINC000309559266 491151492 /nfs/dbraw/zinc/15/14/92/491151492.db2.gz IRNUXGACNOGPHY-SNVBAGLBSA-N 1 2 231.290 2.362 20 0 BEADLO CN(C)c1ccc(CSc2cnccn2)c[nH+]1 ZINC000629157848 360910676 /nfs/dbraw/zinc/91/06/76/360910676.db2.gz DQQVVSBITIUSQY-UHFFFAOYSA-N 1 2 246.339 2.230 20 0 BEADLO C[C@@H](Nc1c[nH+]cc(N(C)C)c1)C1CC1 ZINC000631203967 360915381 /nfs/dbraw/zinc/91/53/81/360915381.db2.gz VBCPUUQAVMJZNO-SECBINFHSA-N 1 2 205.305 2.358 20 0 BEADLO CN(C)c1ccc(CSc2ncco2)c[nH+]1 ZINC000629178384 360928037 /nfs/dbraw/zinc/92/80/37/360928037.db2.gz QEWQZOQIAPUMIB-UHFFFAOYSA-N 1 2 235.312 2.428 20 0 BEADLO CC1CN(c2[nH+]c(C3CC3)nc3[nH]ccc32)C1 ZINC000631205971 360986391 /nfs/dbraw/zinc/98/63/91/360986391.db2.gz IKXOAFBASCFKKG-UHFFFAOYSA-N 1 2 228.299 2.291 20 0 BEADLO CCCCc1cc(NCCOC(C)C)nc[nH+]1 ZINC000631206466 360988070 /nfs/dbraw/zinc/98/80/70/360988070.db2.gz MNYWEMAPYGVJKO-UHFFFAOYSA-N 1 2 237.347 2.078 20 0 BEADLO CCc1cc(NCC2(C(F)F)CC2)nc[nH+]1 ZINC000309652680 491153819 /nfs/dbraw/zinc/15/38/19/491153819.db2.gz ORWMZFHDANLBKU-UHFFFAOYSA-N 1 2 227.258 2.496 20 0 BEADLO C[NH2+]c1ccc(NCc2cnn(C)c2)cc1 ZINC000629389770 361037014 /nfs/dbraw/zinc/03/70/14/361037014.db2.gz VKUUDRBHNUVBEG-UHFFFAOYSA-N 1 2 216.288 2.074 20 0 BEADLO C[NH2+]c1ccc(NCc2nccn2C)cc1 ZINC000629389696 361037022 /nfs/dbraw/zinc/03/70/22/361037022.db2.gz RLTMOBBIZGJUBP-UHFFFAOYSA-N 1 2 216.288 2.074 20 0 BEADLO COC[C@@H](C)CNc1cc2cc[nH]c2c[nH+]1 ZINC000309677757 491153997 /nfs/dbraw/zinc/15/39/97/491153997.db2.gz YJNPBYCQDFKIEA-VIFPVBQESA-N 1 2 219.288 2.257 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2C[C@H]2c2ccc(C)cc2)n1 ZINC000424342055 200919265 /nfs/dbraw/zinc/91/92/65/200919265.db2.gz WSCCLWIBEJCMIU-NWDGAFQWSA-N 1 2 243.310 2.369 20 0 BEADLO CCC(CC)(CC)C(=O)N1CCn2c[nH+]cc2C1 ZINC000640421803 361212894 /nfs/dbraw/zinc/21/28/94/361212894.db2.gz OKOAZMITMUAFHN-UHFFFAOYSA-N 1 2 249.358 2.442 20 0 BEADLO CCC[C@H]1C[N@@H+]([C@@H](C)c2cnc(C)cn2)CCO1 ZINC000428296967 201006960 /nfs/dbraw/zinc/00/69/60/201006960.db2.gz ZDHAPUVJJNFAHT-STQMWFEESA-N 1 2 249.358 2.347 20 0 BEADLO CCC[C@H]1C[N@H+]([C@@H](C)c2cnc(C)cn2)CCO1 ZINC000428296967 201006961 /nfs/dbraw/zinc/00/69/61/201006961.db2.gz ZDHAPUVJJNFAHT-STQMWFEESA-N 1 2 249.358 2.347 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+]2CCOC3(CCC3)C2)cn1 ZINC000428285414 201004034 /nfs/dbraw/zinc/00/40/34/201004034.db2.gz IOZQSXDIXSOAOM-LBPRGKRZSA-N 1 2 247.342 2.101 20 0 BEADLO Cc1cnc([C@H](C)[N@H+]2CCOC3(CCC3)C2)cn1 ZINC000428285414 201004036 /nfs/dbraw/zinc/00/40/36/201004036.db2.gz IOZQSXDIXSOAOM-LBPRGKRZSA-N 1 2 247.342 2.101 20 0 BEADLO CC[C@]1(C)C[N@@H+]([C@H](C)c2cnc(C)cn2)CCO1 ZINC000428486425 201023759 /nfs/dbraw/zinc/02/37/59/201023759.db2.gz VXPSDHNQPCYCEZ-TZMCWYRMSA-N 1 2 249.358 2.347 20 0 BEADLO CC[C@]1(C)C[N@H+]([C@H](C)c2cnc(C)cn2)CCO1 ZINC000428486425 201023760 /nfs/dbraw/zinc/02/37/60/201023760.db2.gz VXPSDHNQPCYCEZ-TZMCWYRMSA-N 1 2 249.358 2.347 20 0 BEADLO c1nc(C[NH2+]Cc2ccc3c(n2)CCCC3)co1 ZINC000277679530 370692337 /nfs/dbraw/zinc/69/23/37/370692337.db2.gz JECSSDSGRIFDEU-UHFFFAOYSA-N 1 2 243.310 2.238 20 0 BEADLO CC[C@@H](F)C[N@H+](C)[C@@H](CC(C)C)C(=O)OC ZINC000429161846 201076157 /nfs/dbraw/zinc/07/61/57/201076157.db2.gz WNGXRCRQBYZTBU-MNOVXSKESA-N 1 2 233.327 2.254 20 0 BEADLO CC[C@@H](F)C[N@@H+](C)[C@@H](CC(C)C)C(=O)OC ZINC000429161846 201076159 /nfs/dbraw/zinc/07/61/59/201076159.db2.gz WNGXRCRQBYZTBU-MNOVXSKESA-N 1 2 233.327 2.254 20 0 BEADLO Cc1ccoc1C[N@@H+](C)Cc1cnc(C)nc1 ZINC000429365006 201105237 /nfs/dbraw/zinc/10/52/37/201105237.db2.gz HKRWDLPMEKZDTB-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ccoc1C[N@H+](C)Cc1cnc(C)nc1 ZINC000429365006 201105239 /nfs/dbraw/zinc/10/52/39/201105239.db2.gz HKRWDLPMEKZDTB-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CCc1nc(C[N@H+](C)[C@H]2CC[C@H](C)C2)no1 ZINC000429567662 201117706 /nfs/dbraw/zinc/11/77/06/201117706.db2.gz MLSPUFJGFIHEKO-UWVGGRQHSA-N 1 2 223.320 2.252 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@H]2CC[C@H](C)C2)no1 ZINC000429567662 201117707 /nfs/dbraw/zinc/11/77/07/201117707.db2.gz MLSPUFJGFIHEKO-UWVGGRQHSA-N 1 2 223.320 2.252 20 0 BEADLO CCc1nc(C[N@H+](C)[C@@H]2CC[C@@H](C)C2)no1 ZINC000429567660 201119706 /nfs/dbraw/zinc/11/97/06/201119706.db2.gz MLSPUFJGFIHEKO-NXEZZACHSA-N 1 2 223.320 2.252 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@@H]2CC[C@@H](C)C2)no1 ZINC000429567660 201119708 /nfs/dbraw/zinc/11/97/08/201119708.db2.gz MLSPUFJGFIHEKO-NXEZZACHSA-N 1 2 223.320 2.252 20 0 BEADLO CC[C@@H](F)C[NH2+][C@](C)(c1noc(C)n1)C1CC1 ZINC000433308385 201179082 /nfs/dbraw/zinc/17/90/82/201179082.db2.gz YAYNTILYFKIGNM-PWSUYJOCSA-N 1 2 241.310 2.341 20 0 BEADLO Cc1cc(N2CCc3ccc(O)cc3C2)nc[nH+]1 ZINC000433427926 201185724 /nfs/dbraw/zinc/18/57/24/201185724.db2.gz QRYZTQFJZSOKFM-UHFFFAOYSA-N 1 2 241.294 2.053 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1C[C@@H]2CCCC[C@@]21C ZINC000629618115 361513219 /nfs/dbraw/zinc/51/32/19/361513219.db2.gz IOMUTKFLUVHTKP-FZMZJTMJSA-N 1 2 247.342 2.052 20 0 BEADLO CCn1cc(C[NH2+][C@@H]2CCCC2(F)F)cn1 ZINC000309958559 491158946 /nfs/dbraw/zinc/15/89/46/491158946.db2.gz JXKQZSLUNNQWQL-SNVBAGLBSA-N 1 2 229.274 2.180 20 0 BEADLO C[C@@H]1CN(c2cc(N3CCCC3)[nH+]cn2)C[C@H]1C ZINC000433772596 201193068 /nfs/dbraw/zinc/19/30/68/201193068.db2.gz AXYDRWXKDVCZIX-VXGBXAGGSA-N 1 2 246.358 2.169 20 0 BEADLO C[C@@H]1CN(c2cc(N3CCCC3)nc[nH+]2)C[C@H]1C ZINC000433772596 201193069 /nfs/dbraw/zinc/19/30/69/201193069.db2.gz AXYDRWXKDVCZIX-VXGBXAGGSA-N 1 2 246.358 2.169 20 0 BEADLO Cc1nc2[nH]ccc2c(NC[C@@H]2CC2(C)C)[nH+]1 ZINC000433799612 201193505 /nfs/dbraw/zinc/19/35/05/201193505.db2.gz BOURPKNBUIRYRN-VIFPVBQESA-N 1 2 230.315 2.146 20 0 BEADLO CC[C@H](CO)Nc1ccc(-c2cccnc2)c[nH+]1 ZINC000629711742 361649014 /nfs/dbraw/zinc/64/90/14/361649014.db2.gz HPYLHZWWZPFDFX-CYBMUJFWSA-N 1 2 243.310 2.326 20 0 BEADLO CCCC[C@@H]([NH2+][C@@H]1CCCSC1)C(=O)OC ZINC000154597216 201285751 /nfs/dbraw/zinc/28/57/51/201285751.db2.gz ANSLKICNYMEQBS-GHMZBOCLSA-N 1 2 245.388 2.203 20 0 BEADLO Cc1[nH]cc(-c2ccc(C)cc2CO)[nH+]1 ZINC000629741514 361678395 /nfs/dbraw/zinc/67/83/95/361678395.db2.gz WXPONEUNCVTFAG-UHFFFAOYSA-N 1 2 202.257 2.186 20 0 BEADLO COc1cc(OC)cc(-c2c[nH]c(C)[nH+]2)c1 ZINC000629748643 361681912 /nfs/dbraw/zinc/68/19/12/361681912.db2.gz OGHLKBXLHUTELQ-UHFFFAOYSA-N 1 2 218.256 2.402 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@H]2CCCC23CC3)c[nH+]1 ZINC000629830598 361730108 /nfs/dbraw/zinc/73/01/08/361730108.db2.gz CJORNGZQFBAPEG-SNVBAGLBSA-N 1 2 233.315 2.028 20 0 BEADLO Cc1cc(C[NH2+][C@H](CO)c2ccccc2C)no1 ZINC000541985468 364056998 /nfs/dbraw/zinc/05/69/98/364056998.db2.gz YRSUTPHHLIOHTQ-CQSZACIVSA-N 1 2 246.310 2.115 20 0 BEADLO CC[C@@H](Nc1nc(C)cc(OC)n1)c1[nH]cc[nH+]1 ZINC000139844055 541345094 /nfs/dbraw/zinc/34/50/94/541345094.db2.gz SJQFBUBJMYRYDY-SECBINFHSA-N 1 2 247.302 2.080 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@H](CC(C)C)C2)no1 ZINC000074994823 364301932 /nfs/dbraw/zinc/30/19/32/364301932.db2.gz AWSYWEKGWIFUBE-NSHDSACASA-N 1 2 223.320 2.246 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@H](CC(C)C)C2)no1 ZINC000074994823 364301935 /nfs/dbraw/zinc/30/19/35/364301935.db2.gz AWSYWEKGWIFUBE-NSHDSACASA-N 1 2 223.320 2.246 20 0 BEADLO C[C@H]([NH2+]Cc1cocn1)c1ccc2c(c1)OCO2 ZINC000182068788 366864374 /nfs/dbraw/zinc/86/43/74/366864374.db2.gz GIKKKBKXEMINNF-VIFPVBQESA-N 1 2 246.266 2.254 20 0 BEADLO CC[C@H](C)N(C)C(=O)c1ccc2[nH+]ccn2c1 ZINC000170867054 364545874 /nfs/dbraw/zinc/54/58/74/364545874.db2.gz SRSMQYGHPGQJRV-JTQLQIEISA-N 1 2 231.299 2.205 20 0 BEADLO C[C@@H](NC(=O)[C@@H](C)Cc1ccco1)c1[nH]cc[nH+]1 ZINC000615157395 364546901 /nfs/dbraw/zinc/54/69/01/364546901.db2.gz DBNZAYXBXRHVJP-VHSXEESVSA-N 1 2 247.298 2.059 20 0 BEADLO C[C@@H](NC(=O)[C@@]1(C)CC=CCC1)c1[nH]cc[nH+]1 ZINC000615157289 364547917 /nfs/dbraw/zinc/54/79/17/364547917.db2.gz AXYVIVQSZFCFAO-MFKMUULPSA-N 1 2 233.315 2.333 20 0 BEADLO C[C@@H](NC(=O)[C@]1(C)CC=CCC1)c1[nH]cc[nH+]1 ZINC000615157290 364547924 /nfs/dbraw/zinc/54/79/24/364547924.db2.gz AXYVIVQSZFCFAO-ZWNOBZJWSA-N 1 2 233.315 2.333 20 0 BEADLO CC[C@H](COC)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000081019048 364512218 /nfs/dbraw/zinc/51/22/18/364512218.db2.gz NXNAZWFYMOGQFM-SECBINFHSA-N 1 2 234.303 2.103 20 0 BEADLO Cc1ncncc1[C@H](C)[NH2+][C@@H](C)c1ccon1 ZINC000566472792 364716353 /nfs/dbraw/zinc/71/63/53/364716353.db2.gz BLBNHYHXFRRERK-UWVGGRQHSA-N 1 2 232.287 2.185 20 0 BEADLO CCc1nnc(C[NH2+]Cc2ccsc2C)[nH]1 ZINC000296129619 364782424 /nfs/dbraw/zinc/78/24/24/364782424.db2.gz UIMFQUNYCMVKGZ-UHFFFAOYSA-N 1 2 236.344 2.027 20 0 BEADLO Cn1cc[nH+]c1[C@@H]1N(CC2(F)CC2)CC1(C)C ZINC000573654964 364883882 /nfs/dbraw/zinc/88/38/82/364883882.db2.gz PYGJIFKOFYKTGY-JTQLQIEISA-N 1 2 237.322 2.305 20 0 BEADLO c1cn(C2CCCC2)nc1C[N@@H+]1CCCOCC1 ZINC000335004185 541418967 /nfs/dbraw/zinc/41/89/67/541418967.db2.gz WJXXDEKFKGDQQB-UHFFFAOYSA-N 1 2 249.358 2.221 20 0 BEADLO c1cn(C2CCCC2)nc1C[N@H+]1CCCOCC1 ZINC000335004185 541418969 /nfs/dbraw/zinc/41/89/69/541418969.db2.gz WJXXDEKFKGDQQB-UHFFFAOYSA-N 1 2 249.358 2.221 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccoc1)c1ccn(C)n1 ZINC000573901466 364940566 /nfs/dbraw/zinc/94/05/66/364940566.db2.gz MRGLKNIGJGZRCB-VHSXEESVSA-N 1 2 219.288 2.425 20 0 BEADLO CCC[C@@H](NC(=O)CCc1c[nH+]c[nH]1)C1CCC1 ZINC000458343259 541431477 /nfs/dbraw/zinc/43/14/77/541431477.db2.gz VMZPSSBTCDWTSQ-CYBMUJFWSA-N 1 2 249.358 2.427 20 0 BEADLO CCC[C@@H](NC(=O)CCc1c[nH]c[nH+]1)C1CCC1 ZINC000458343259 541431482 /nfs/dbraw/zinc/43/14/82/541431482.db2.gz VMZPSSBTCDWTSQ-CYBMUJFWSA-N 1 2 249.358 2.427 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)C1(C)CCCCC1 ZINC000336017394 541424746 /nfs/dbraw/zinc/42/47/46/541424746.db2.gz YJDLNJPRDPKNAF-UHFFFAOYSA-N 1 2 235.331 2.007 20 0 BEADLO Cc1[nH]c(CN[C@@H](C)c2nccs2)[nH+]c1C ZINC000574100200 364988263 /nfs/dbraw/zinc/98/82/63/364988263.db2.gz USWKWCVSTPLOIB-VIFPVBQESA-N 1 2 236.344 2.334 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NCCC(C)(C)C ZINC000574216067 365012362 /nfs/dbraw/zinc/01/23/62/365012362.db2.gz ASFUCQWJYQJSQX-SNVBAGLBSA-N 1 2 237.347 2.141 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NCCC(C)(C)C ZINC000574216067 365012368 /nfs/dbraw/zinc/01/23/68/365012368.db2.gz ASFUCQWJYQJSQX-SNVBAGLBSA-N 1 2 237.347 2.141 20 0 BEADLO CC(C)C[C@H](C)NC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000574216938 365013055 /nfs/dbraw/zinc/01/30/55/365013055.db2.gz NCKGVVNIYLXSTJ-MNOVXSKESA-N 1 2 237.347 2.139 20 0 BEADLO CC(C)C[C@H](C)NC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000574216938 365013059 /nfs/dbraw/zinc/01/30/59/365013059.db2.gz NCKGVVNIYLXSTJ-MNOVXSKESA-N 1 2 237.347 2.139 20 0 BEADLO C[C@H](C[S@](C)=O)Nc1[nH+]ccc2ccccc21 ZINC000169068368 365067638 /nfs/dbraw/zinc/06/76/38/365067638.db2.gz BWSFCUKPECDVLV-BMLIUANNSA-N 1 2 248.351 2.414 20 0 BEADLO COCCOc1ccc(CNc2c[nH]c[nH+]2)cc1 ZINC000574592839 365099287 /nfs/dbraw/zinc/09/92/87/365099287.db2.gz CFTWCEYQVMEMSC-UHFFFAOYSA-N 1 2 247.298 2.047 20 0 BEADLO CC[C@H](NC(=O)[C@@H]1CC[C@H](C)C1)c1[nH]cc[nH+]1 ZINC000442809935 192992916 /nfs/dbraw/zinc/99/29/16/192992916.db2.gz LGRYJCZXIAJIDP-AXFHLTTASA-N 1 2 235.331 2.413 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2C[C@@]2(C)c2ccccc2)n1 ZINC000574858667 365160107 /nfs/dbraw/zinc/16/01/07/365160107.db2.gz VBXKSGCGFXOWMM-FZMZJTMJSA-N 1 2 243.310 2.234 20 0 BEADLO CCCCCOC1CN(c2cc(C)[nH+]cn2)C1 ZINC000444092049 193034745 /nfs/dbraw/zinc/03/47/45/193034745.db2.gz SDSXVLTXFJTQFP-UHFFFAOYSA-N 1 2 235.331 2.180 20 0 BEADLO Cc1nsc(C)c1C[N@@H+]1CCC(=O)[C@H](C)C1 ZINC000575326452 365291006 /nfs/dbraw/zinc/29/10/06/365291006.db2.gz WSJDRCGRZBMLJI-MRVPVSSYSA-N 1 2 238.356 2.171 20 0 BEADLO Cc1nsc(C)c1C[N@H+]1CCC(=O)[C@H](C)C1 ZINC000575326452 365291010 /nfs/dbraw/zinc/29/10/10/365291010.db2.gz WSJDRCGRZBMLJI-MRVPVSSYSA-N 1 2 238.356 2.171 20 0 BEADLO CCOc1ccccc1C[N@H+](C)Cc1cc[nH]n1 ZINC000172250781 365302692 /nfs/dbraw/zinc/30/26/92/365302692.db2.gz LAKVPDQWGXVKRJ-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO CCOc1ccccc1C[N@@H+](C)Cc1cc[nH]n1 ZINC000172250781 365302700 /nfs/dbraw/zinc/30/27/00/365302700.db2.gz LAKVPDQWGXVKRJ-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO CCC[C@@H](CC)NC(=O)[C@H]1CCc2c[nH+]cn2C1 ZINC000576111314 365491271 /nfs/dbraw/zinc/49/12/71/365491271.db2.gz UEGIWCOQFKCGFC-NWDGAFQWSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1c[nH+]c(C)nc1NCC[C@H]1CCO[C@@H](C)C1 ZINC000576172686 365510675 /nfs/dbraw/zinc/51/06/75/365510675.db2.gz UVYZSDLJACJCAQ-AAEUAGOBSA-N 1 2 249.358 2.132 20 0 BEADLO Cc1ccc(NC(=O)c2ccc(F)cn2)c(C)[nH+]1 ZINC000183078784 366973910 /nfs/dbraw/zinc/97/39/10/366973910.db2.gz IKBARPOFBWCXPV-UHFFFAOYSA-N 1 2 245.257 2.485 20 0 BEADLO CCC[C@H](C)N(C)C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000579850443 367050481 /nfs/dbraw/zinc/05/04/81/367050481.db2.gz XNCSKPGEHUEJNP-MNOVXSKESA-N 1 2 237.347 2.235 20 0 BEADLO CCC[C@H](C)N(C)C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000579850443 367050485 /nfs/dbraw/zinc/05/04/85/367050485.db2.gz XNCSKPGEHUEJNP-MNOVXSKESA-N 1 2 237.347 2.235 20 0 BEADLO FC1(F)[C@@H]2CC[N@H+](Cc3cscn3)C[C@@H]21 ZINC001642341655 1172344138 /nfs/dbraw/zinc/34/41/38/1172344138.db2.gz QAHYEDUXRPOVIU-BDAKNGLRSA-N 1 2 230.283 2.230 20 0 BEADLO FC1(F)[C@@H]2CC[N@@H+](Cc3cscn3)C[C@@H]21 ZINC001642341655 1172344149 /nfs/dbraw/zinc/34/41/49/1172344149.db2.gz QAHYEDUXRPOVIU-BDAKNGLRSA-N 1 2 230.283 2.230 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C1CC2(CCC2)C1 ZINC000580717303 367149292 /nfs/dbraw/zinc/14/92/92/367149292.db2.gz WEKLACDTDSDRAB-UHFFFAOYSA-N 1 2 247.342 2.100 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CCC(C)(C)C1)c1[nH]cc[nH+]1 ZINC000580784488 367166280 /nfs/dbraw/zinc/16/62/80/367166280.db2.gz WGSDGWPDWGRFRQ-NXEZZACHSA-N 1 2 235.331 2.413 20 0 BEADLO C=Cn1cc(C[NH2+]Cc2ncc(C)s2)cn1 ZINC000194341125 367279944 /nfs/dbraw/zinc/27/99/44/367279944.db2.gz GDGFQDAOLKRVOW-UHFFFAOYSA-N 1 2 234.328 2.038 20 0 BEADLO Cc1[nH]c(CNc2cccnc2)[nH+]c1C ZINC000581022967 367240275 /nfs/dbraw/zinc/24/02/75/367240275.db2.gz PPIWUQZIEROYMS-UHFFFAOYSA-N 1 2 202.261 2.034 20 0 BEADLO C[C@H](c1ccco1)[N@H+](C)CC(=O)c1cccn1C ZINC000194980749 367328169 /nfs/dbraw/zinc/32/81/69/367328169.db2.gz ZQUSXZUEWANIHY-LLVKDONJSA-N 1 2 246.310 2.494 20 0 BEADLO C[C@H](c1ccco1)[N@@H+](C)CC(=O)c1cccn1C ZINC000194980749 367328175 /nfs/dbraw/zinc/32/81/75/367328175.db2.gz ZQUSXZUEWANIHY-LLVKDONJSA-N 1 2 246.310 2.494 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@]12C[C@@H]1CCC2 ZINC000581184927 367285359 /nfs/dbraw/zinc/28/53/59/367285359.db2.gz YQLZEVJDSXKFSB-ZANVPECISA-N 1 2 232.283 2.219 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCC[C@H](F)C1 ZINC000581255963 367311009 /nfs/dbraw/zinc/31/10/09/367311009.db2.gz LCLQBPDJYFJIDM-NSHDSACASA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCC[C@H](F)C1 ZINC000581255963 367311012 /nfs/dbraw/zinc/31/10/12/367311012.db2.gz LCLQBPDJYFJIDM-NSHDSACASA-N 1 2 225.311 2.398 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+](C)Cc2cccc(O)c2)[nH]1 ZINC000581296719 367324479 /nfs/dbraw/zinc/32/44/79/367324479.db2.gz XFUCFOITAOCZOR-SECBINFHSA-N 1 2 246.314 2.012 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+](C)Cc2cccc(O)c2)[nH]1 ZINC000581296719 367324485 /nfs/dbraw/zinc/32/44/85/367324485.db2.gz XFUCFOITAOCZOR-SECBINFHSA-N 1 2 246.314 2.012 20 0 BEADLO C[C@H]([NH2+]Cc1ncccc1O)c1nccs1 ZINC000381455286 367407450 /nfs/dbraw/zinc/40/74/50/367407450.db2.gz IEBOTHMPWCHFLM-QMMMGPOBSA-N 1 2 235.312 2.095 20 0 BEADLO COC(=O)[C@](C)([NH2+]CCSC(C)C)C1CC1 ZINC000381460887 367410746 /nfs/dbraw/zinc/41/07/46/367410746.db2.gz LAPBAUYDMJNIJV-GFCCVEGCSA-N 1 2 245.388 2.059 20 0 BEADLO CCC[C@@H]([NH2+][C@@H]1C[C@H]1CC)C(=O)OCC ZINC000381978661 367475775 /nfs/dbraw/zinc/47/57/75/367475775.db2.gz DTIRMBCFMJCAEE-GMTAPVOTSA-N 1 2 213.321 2.106 20 0 BEADLO CC(F)(F)CNc1cc[nH+]c2ccncc12 ZINC000382295446 367505080 /nfs/dbraw/zinc/50/50/80/367505080.db2.gz MAXWOFWTOOWGGO-UHFFFAOYSA-N 1 2 223.226 2.119 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CCC[C@H](C)[C@@H]1C ZINC000581616754 367636118 /nfs/dbraw/zinc/63/61/18/367636118.db2.gz XHGPFHHRZGBKRC-TUAOUCFPSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CCC[C@H](C)[C@@H]1C ZINC000581616754 367636120 /nfs/dbraw/zinc/63/61/20/367636120.db2.gz XHGPFHHRZGBKRC-TUAOUCFPSA-N 1 2 249.358 2.235 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCC2(C1)CCOCC2 ZINC000581677156 367706395 /nfs/dbraw/zinc/70/63/95/367706395.db2.gz RYLVNXGHRYUBDT-UHFFFAOYSA-N 1 2 247.342 2.100 20 0 BEADLO CC[C@]1(C)CCN(c2cc(CO)cc[nH+]2)C1 ZINC000399268357 368061776 /nfs/dbraw/zinc/06/17/76/368061776.db2.gz GJEIEQIJEJHFBD-CYBMUJFWSA-N 1 2 220.316 2.200 20 0 BEADLO CC[C@@H](C)C(=O)Nc1ccc(-n2cc[nH+]c2)nc1 ZINC000024906050 368015753 /nfs/dbraw/zinc/01/57/53/368015753.db2.gz SYYIPFWOKYJLRU-SNVBAGLBSA-N 1 2 244.298 2.252 20 0 BEADLO Cc1n[nH]c(C)c1CNc1c[nH+]cc(N(C)C)c1 ZINC000630956729 368148252 /nfs/dbraw/zinc/14/82/52/368148252.db2.gz HOTVJVDCEXITOD-UHFFFAOYSA-N 1 2 245.330 2.100 20 0 BEADLO COCC(C)(C)CNc1c[nH+]cc(N(C)C)c1 ZINC000630956140 368149667 /nfs/dbraw/zinc/14/96/67/368149667.db2.gz MZWUUOXJJANLOD-UHFFFAOYSA-N 1 2 237.347 2.232 20 0 BEADLO C[C@H]1COCC[N@@H+]1Cc1cccc(F)c1 ZINC000046774807 368449500 /nfs/dbraw/zinc/44/95/00/368449500.db2.gz ZKWNCTZUQDUSMB-JTQLQIEISA-N 1 2 209.264 2.046 20 0 BEADLO C[C@H]1COCC[N@H+]1Cc1cccc(F)c1 ZINC000046774807 368449503 /nfs/dbraw/zinc/44/95/03/368449503.db2.gz ZKWNCTZUQDUSMB-JTQLQIEISA-N 1 2 209.264 2.046 20 0 BEADLO CCCCSc1[nH+]cnc2c1cnn2C ZINC000058529377 368514823 /nfs/dbraw/zinc/51/48/23/368514823.db2.gz URTBACRWZYOCKH-UHFFFAOYSA-N 1 2 222.317 2.256 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@@]1(C)CC=CCC1 ZINC000456091532 202907454 /nfs/dbraw/zinc/90/74/54/202907454.db2.gz FPSBJPNWFIPPJE-AWEZNQCLSA-N 1 2 247.342 2.266 20 0 BEADLO CN(Cc1cscn1)c1cccc[nH+]1 ZINC000063255303 368581536 /nfs/dbraw/zinc/58/15/36/368581536.db2.gz QGLOGDGGCAMFSV-UHFFFAOYSA-N 1 2 205.286 2.175 20 0 BEADLO CCC[C@H]1[C@H](C)CCCN1C(=O)Cn1cc[nH+]c1 ZINC000081473002 368602356 /nfs/dbraw/zinc/60/23/56/368602356.db2.gz UNEUSRYLMRZRFR-OLZOCXBDSA-N 1 2 249.358 2.310 20 0 BEADLO CN(CCC(C)(C)C)c1cc(CO)cc[nH+]1 ZINC000399861297 368645107 /nfs/dbraw/zinc/64/51/07/368645107.db2.gz WZQRROWEKKVMET-UHFFFAOYSA-N 1 2 222.332 2.446 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@]2(C)CCCC[C@H]2C)c[nH+]1 ZINC000457258162 203029483 /nfs/dbraw/zinc/02/94/83/203029483.db2.gz MEZVLDYXTJBZEI-RNCFNFMXSA-N 1 2 235.331 2.417 20 0 BEADLO CC(C)[C@@H]1CCC[C@@H](NC(=O)Cn2cc[nH+]c2)C1 ZINC000073387420 368804244 /nfs/dbraw/zinc/80/42/44/368804244.db2.gz LVUOJJRDPYZFOD-CHWSQXEVSA-N 1 2 249.358 2.214 20 0 BEADLO C[C@@H](CCC(C)(C)C)NC(=O)Cn1cc[nH+]c1 ZINC000073824120 368817924 /nfs/dbraw/zinc/81/79/24/368817924.db2.gz PWVRAGFOQQVFFC-NSHDSACASA-N 1 2 237.347 2.214 20 0 BEADLO C[C@H](CCC(C)(C)C)NC(=O)Cn1cc[nH+]c1 ZINC000073824124 368818283 /nfs/dbraw/zinc/81/82/83/368818283.db2.gz PWVRAGFOQQVFFC-LLVKDONJSA-N 1 2 237.347 2.214 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@H]1C[C@H]2C[C@H]2C1 ZINC000615961336 368796507 /nfs/dbraw/zinc/79/65/07/368796507.db2.gz QEQVRLFJWDSDRG-NNYUYHANSA-N 1 2 247.342 2.126 20 0 BEADLO C[C@H]1C[C@H](NC(=O)C2CC3(CC3)C2)c2[nH+]ccn21 ZINC000615962810 368797812 /nfs/dbraw/zinc/79/78/12/368797812.db2.gz IGJLFSCRROJKOT-ONGXEEELSA-N 1 2 245.326 2.195 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)C2CC3(CC3)C2)c2[nH+]ccn21 ZINC000615962807 368798214 /nfs/dbraw/zinc/79/82/14/368798214.db2.gz IGJLFSCRROJKOT-GXSJLCMTSA-N 1 2 245.326 2.195 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1[C@H](C)CCC1(C)C ZINC000616179040 369011927 /nfs/dbraw/zinc/01/19/27/369011927.db2.gz MIXAIYFGETYBTA-WDEREUQCSA-N 1 2 249.358 2.378 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1[C@H](C)CCC1(C)C ZINC000616179040 369011931 /nfs/dbraw/zinc/01/19/31/369011931.db2.gz MIXAIYFGETYBTA-WDEREUQCSA-N 1 2 249.358 2.378 20 0 BEADLO CC(C)CCCCC(=O)NCc1[nH+]ccn1C ZINC000457532822 203071835 /nfs/dbraw/zinc/07/18/35/203071835.db2.gz RXDBWKZIQLRCBQ-UHFFFAOYSA-N 1 2 237.347 2.253 20 0 BEADLO CC(C)(C)C1CC(C(=O)NCc2[nH]cc[nH+]2)C1 ZINC000457579910 203077630 /nfs/dbraw/zinc/07/76/30/203077630.db2.gz ZZNKGHALECAMEL-UHFFFAOYSA-N 1 2 235.331 2.098 20 0 BEADLO CC[C@@H](NC(=O)[C@H](C)C1CCC1)c1[nH]cc[nH+]1 ZINC000457724255 203094755 /nfs/dbraw/zinc/09/47/55/203094755.db2.gz DZFPIJHELHXZRO-MWLCHTKSSA-N 1 2 235.331 2.413 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NCCCC1CCC1 ZINC000618620757 369188084 /nfs/dbraw/zinc/18/80/84/369188084.db2.gz ZDRKWTPIQPSVNV-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NCCCC1CCC1 ZINC000618620757 369188086 /nfs/dbraw/zinc/18/80/86/369188086.db2.gz ZDRKWTPIQPSVNV-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO CCn1nncc1C[N@H+](C)Cc1ccccc1F ZINC000459298484 203250976 /nfs/dbraw/zinc/25/09/76/203250976.db2.gz OVBSSHHCMWUTEH-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO CCn1nncc1C[N@@H+](C)Cc1ccccc1F ZINC000459298484 203250978 /nfs/dbraw/zinc/25/09/78/203250978.db2.gz OVBSSHHCMWUTEH-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO CCn1nncc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000459352193 203263336 /nfs/dbraw/zinc/26/33/36/203263336.db2.gz HCVIOTAEHLMTJU-CQSZACIVSA-N 1 2 242.326 2.245 20 0 BEADLO CCn1nncc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000459352193 203263338 /nfs/dbraw/zinc/26/33/38/203263338.db2.gz HCVIOTAEHLMTJU-CQSZACIVSA-N 1 2 242.326 2.245 20 0 BEADLO CCOc1ncccc1C[NH2+]Cc1cc(C)on1 ZINC000459475232 203288165 /nfs/dbraw/zinc/28/81/65/203288165.db2.gz ZMDUMGJGXJKHAO-UHFFFAOYSA-N 1 2 247.298 2.067 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@H]1C[C@]1(C)C(C)C ZINC000459480267 203289979 /nfs/dbraw/zinc/28/99/79/203289979.db2.gz LGSKGEPABXUMSF-TZMCWYRMSA-N 1 2 247.342 2.368 20 0 BEADLO FC[C@@H]1CCC[N@@H+]1Cc1cnc(C2CC2)nc1 ZINC000459596342 203312319 /nfs/dbraw/zinc/31/23/19/203312319.db2.gz UFXZFTNXOMWBKW-LBPRGKRZSA-N 1 2 235.306 2.288 20 0 BEADLO FC[C@@H]1CCC[N@H+]1Cc1cnc(C2CC2)nc1 ZINC000459596342 203312320 /nfs/dbraw/zinc/31/23/20/203312320.db2.gz UFXZFTNXOMWBKW-LBPRGKRZSA-N 1 2 235.306 2.288 20 0 BEADLO CC(C)C[N@H+](Cc1cnn(C)c1)Cc1ccon1 ZINC000459600441 203312839 /nfs/dbraw/zinc/31/28/39/203312839.db2.gz SYTGWKMDEAMROP-UHFFFAOYSA-N 1 2 248.330 2.066 20 0 BEADLO CC(C)C[N@@H+](Cc1cnn(C)c1)Cc1ccon1 ZINC000459600441 203312842 /nfs/dbraw/zinc/31/28/42/203312842.db2.gz SYTGWKMDEAMROP-UHFFFAOYSA-N 1 2 248.330 2.066 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@@H+]1CC1CCCCC1 ZINC000619433613 369352293 /nfs/dbraw/zinc/35/22/93/369352293.db2.gz BTEILEFFXQWGOU-RYUDHWBXSA-N 1 2 243.322 2.152 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@H+]1CC1CCCCC1 ZINC000619433613 369352296 /nfs/dbraw/zinc/35/22/96/369352296.db2.gz BTEILEFFXQWGOU-RYUDHWBXSA-N 1 2 243.322 2.152 20 0 BEADLO FC(F)C[NH2+]Cc1c[nH]nc1-c1ccsc1 ZINC000459547910 203299267 /nfs/dbraw/zinc/29/92/67/203299267.db2.gz PLGUTUHHGIFNLI-UHFFFAOYSA-N 1 2 243.282 2.493 20 0 BEADLO Cc1nn(-c2cc(C)[nH+]c(C)n2)c(C)c1C ZINC000107892971 369367726 /nfs/dbraw/zinc/36/77/26/369367726.db2.gz MJIZVAZYRRRRRI-UHFFFAOYSA-N 1 2 216.288 2.204 20 0 BEADLO COC1C[NH+](Cc2ccccc2OCC2CC2)C1 ZINC000459572974 203302789 /nfs/dbraw/zinc/30/27/89/203302789.db2.gz BQONBLVGAWVFSD-UHFFFAOYSA-N 1 2 247.338 2.306 20 0 BEADLO CCOc1cc(C[NH2+]C(CF)CF)ccc1O ZINC000459570772 203303391 /nfs/dbraw/zinc/30/33/91/203303391.db2.gz NWBRIWGQAOBLIG-UHFFFAOYSA-N 1 2 245.269 2.188 20 0 BEADLO COc1ccccc1/C=C\C[NH+]1CC(OC)C1 ZINC000459572934 203304699 /nfs/dbraw/zinc/30/46/99/203304699.db2.gz BIMFMPKFWLVTIF-ALCCZGGFSA-N 1 2 233.311 2.039 20 0 BEADLO CCOC1(C)C[NH+](Cc2ccc(CC)nc2)C1 ZINC000459614503 203316010 /nfs/dbraw/zinc/31/60/10/203316010.db2.gz DFIPYNONWUVQCX-UHFFFAOYSA-N 1 2 234.343 2.255 20 0 BEADLO CCOC1(C)C[NH+](Cc2sc(C)nc2C)C1 ZINC000459616451 203317146 /nfs/dbraw/zinc/31/71/46/203317146.db2.gz GIJSSBAKYQAZFB-UHFFFAOYSA-N 1 2 240.372 2.371 20 0 BEADLO Cn1c[nH+]cc1CN1CC(C)(CC(F)(F)F)C1 ZINC000459644640 203328261 /nfs/dbraw/zinc/32/82/61/203328261.db2.gz WXKYDYDCHNBIRH-UHFFFAOYSA-N 1 2 247.264 2.194 20 0 BEADLO CCc1ccc(C[N@H+](C)[C@@H](C)C(=O)OC)s1 ZINC000619509514 369448315 /nfs/dbraw/zinc/44/83/15/369448315.db2.gz GLPKVUVRDOROMK-VIFPVBQESA-N 1 2 241.356 2.304 20 0 BEADLO CCc1ccc(C[N@@H+](C)[C@@H](C)C(=O)OC)s1 ZINC000619509514 369448317 /nfs/dbraw/zinc/44/83/17/369448317.db2.gz GLPKVUVRDOROMK-VIFPVBQESA-N 1 2 241.356 2.304 20 0 BEADLO Fc1cccc2c1C[N@H+](CCOCC(F)F)C2 ZINC000459724707 203342936 /nfs/dbraw/zinc/34/29/36/203342936.db2.gz BMNNXWRILMMVMV-UHFFFAOYSA-N 1 2 245.244 2.423 20 0 BEADLO Fc1cccc2c1C[N@@H+](CCOCC(F)F)C2 ZINC000459724707 203342939 /nfs/dbraw/zinc/34/29/39/203342939.db2.gz BMNNXWRILMMVMV-UHFFFAOYSA-N 1 2 245.244 2.423 20 0 BEADLO Cc1ccoc1C[NH2+][C@H](C)c1ccn(C)n1 ZINC000459755500 203356637 /nfs/dbraw/zinc/35/66/37/203356637.db2.gz OVEXZNMRXQRPEZ-SNVBAGLBSA-N 1 2 219.288 2.172 20 0 BEADLO CCCn1cc(C[NH2+]Cc2ccc(F)cc2)nn1 ZINC000631030388 370962110 /nfs/dbraw/zinc/96/21/10/370962110.db2.gz RSMATWNFGHALIR-UHFFFAOYSA-N 1 2 248.305 2.117 20 0 BEADLO Cc1ncccc1NC(=O)CCCn1cc[nH+]c1 ZINC000073357528 369588158 /nfs/dbraw/zinc/58/81/58/369588158.db2.gz WOSWVTHECOKKAB-UHFFFAOYSA-N 1 2 244.298 2.005 20 0 BEADLO CC(C)[C@@H](NC(=O)C[C@@H](C)n1cc[nH+]c1)C1CC1 ZINC000620032801 369677369 /nfs/dbraw/zinc/67/73/69/369677369.db2.gz FPPQXOGUAKMLIR-BXUZGUMPSA-N 1 2 249.358 2.385 20 0 BEADLO Cc1ccc(NC(=O)CCCn2cc[nH+]c2)nc1 ZINC000620499961 369896598 /nfs/dbraw/zinc/89/65/98/369896598.db2.gz XTKJVSYJYHRSGI-UHFFFAOYSA-N 1 2 244.298 2.005 20 0 BEADLO CCC(C)(C)CC(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620603754 369951311 /nfs/dbraw/zinc/95/13/11/369951311.db2.gz NDCGXGZMZIFADP-JTQLQIEISA-N 1 2 237.347 2.424 20 0 BEADLO C[C@@H](NC(=O)C[C@@H]1CC[C@@H](C)C1)c1[nH+]ccn1C ZINC000620603647 369951356 /nfs/dbraw/zinc/95/13/56/369951356.db2.gz MHDLTLZTUMVMBB-IJLUTSLNSA-N 1 2 249.358 2.424 20 0 BEADLO C[C@@H](NC(=O)C12CCC(CC1)C2)c1[nH+]ccn1C ZINC000620604146 369951732 /nfs/dbraw/zinc/95/17/32/369951732.db2.gz PCUSAXTYZUBAKA-CDWSIMAYSA-N 1 2 247.342 2.178 20 0 BEADLO CCC(C)(C)CC(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620603755 369951790 /nfs/dbraw/zinc/95/17/90/369951790.db2.gz NDCGXGZMZIFADP-SNVBAGLBSA-N 1 2 237.347 2.424 20 0 BEADLO C[C@H](NC(=O)C[C@H]1CC[C@@H](C)C1)c1[nH+]ccn1C ZINC000620603649 369951808 /nfs/dbraw/zinc/95/18/08/369951808.db2.gz MHDLTLZTUMVMBB-WOPDTQHZSA-N 1 2 249.358 2.424 20 0 BEADLO C[C@@H](NC(=O)CCC1CCC1)c1[nH+]ccn1C ZINC000620603879 369952079 /nfs/dbraw/zinc/95/20/79/369952079.db2.gz OFERYSUQFNEGSB-SNVBAGLBSA-N 1 2 235.331 2.178 20 0 BEADLO C[C@H](NC(=O)[C@@H](C)C1CCCC1)c1[nH+]ccn1C ZINC000620603638 369952148 /nfs/dbraw/zinc/95/21/48/369952148.db2.gz MEAYXXWZPSRZSE-QWRGUYRKSA-N 1 2 249.358 2.424 20 0 BEADLO CCC(C)(CC)C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620604992 369952981 /nfs/dbraw/zinc/95/29/81/369952981.db2.gz XYEDLWNLRZRDCS-SNVBAGLBSA-N 1 2 237.347 2.424 20 0 BEADLO CC[C@@H](C)CC(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620605750 369954032 /nfs/dbraw/zinc/95/40/32/369954032.db2.gz JSVLAOMJQMQBAQ-ZJUUUORDSA-N 1 2 223.320 2.034 20 0 BEADLO CCc1occc1C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620606575 369954359 /nfs/dbraw/zinc/95/43/59/369954359.db2.gz WTGKKVGZFODIGO-VIFPVBQESA-N 1 2 247.298 2.067 20 0 BEADLO CC[C@@H](C)CC(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620605747 369954796 /nfs/dbraw/zinc/95/47/96/369954796.db2.gz JSVLAOMJQMQBAQ-NXEZZACHSA-N 1 2 223.320 2.034 20 0 BEADLO Cc1coc(C)c1C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620607858 369955562 /nfs/dbraw/zinc/95/55/62/369955562.db2.gz JHXRDBKHCFDSKS-SECBINFHSA-N 1 2 247.298 2.121 20 0 BEADLO C[C@@H](NC(=O)[C@@]1(C)CC=CCC1)c1[nH+]ccn1C ZINC000620609016 369956609 /nfs/dbraw/zinc/95/66/09/369956609.db2.gz AKHQLZPQTTZRFC-RISCZKNCSA-N 1 2 247.342 2.344 20 0 BEADLO C[C@H](NC(=O)C(C)(C)C1CC1)c1[nH+]ccn1C ZINC000620608957 369957259 /nfs/dbraw/zinc/95/72/59/369957259.db2.gz QIEOOAFMFMCJAY-VIFPVBQESA-N 1 2 235.331 2.034 20 0 BEADLO C[C@@H](NC(=O)[C@]1(C)CC=CCC1)c1[nH+]ccn1C ZINC000620609014 369957404 /nfs/dbraw/zinc/95/74/04/369957404.db2.gz AKHQLZPQTTZRFC-BXUZGUMPSA-N 1 2 247.342 2.344 20 0 BEADLO C[C@H](NC(=O)C1=CC[C@@H](C)CC1)c1[nH+]ccn1C ZINC000620611906 369957887 /nfs/dbraw/zinc/95/78/87/369957887.db2.gz OXZRZYRMRXOWMO-MNOVXSKESA-N 1 2 247.342 2.344 20 0 BEADLO C[C@@H](NC(=O)C1=CC[C@@H](C)CC1)c1[nH+]ccn1C ZINC000620611905 369958030 /nfs/dbraw/zinc/95/80/30/369958030.db2.gz OXZRZYRMRXOWMO-GHMZBOCLSA-N 1 2 247.342 2.344 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620611093 369958055 /nfs/dbraw/zinc/95/80/55/369958055.db2.gz YGWMLQKRDHFJFI-QJPTWQEYSA-N 1 2 249.358 2.280 20 0 BEADLO Cc1[nH]c(C(=O)NCC(F)(F)C(C)(C)C)c[nH+]1 ZINC000620616154 369961164 /nfs/dbraw/zinc/96/11/64/369961164.db2.gz SXNFYMDGMPXIOZ-UHFFFAOYSA-N 1 2 245.273 2.129 20 0 BEADLO CCC[C@@H](C)CC(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620594310 369946203 /nfs/dbraw/zinc/94/62/03/369946203.db2.gz BXPQXERKYXPIDR-GHMZBOCLSA-N 1 2 237.347 2.424 20 0 BEADLO C[C@@H](NC(=O)CC(C)(C)C)c1[nH+]ccn1C ZINC000620595257 369947285 /nfs/dbraw/zinc/94/72/85/369947285.db2.gz FQEAVLKJWSRJGY-SECBINFHSA-N 1 2 223.320 2.034 20 0 BEADLO CCOCC[N@H+](CC)Cc1ncc(CC)o1 ZINC000075718770 370168820 /nfs/dbraw/zinc/16/88/20/370168820.db2.gz OPRWLXPFJGOZEK-UHFFFAOYSA-N 1 2 226.320 2.095 20 0 BEADLO CCOCC[N@@H+](CC)Cc1ncc(CC)o1 ZINC000075718770 370168828 /nfs/dbraw/zinc/16/88/28/370168828.db2.gz OPRWLXPFJGOZEK-UHFFFAOYSA-N 1 2 226.320 2.095 20 0 BEADLO Cc1ccc(CCNc2cc[nH+]c(C)n2)o1 ZINC000309708137 370246888 /nfs/dbraw/zinc/24/68/88/370246888.db2.gz PNEHWWJFGSHFLM-UHFFFAOYSA-N 1 2 217.272 2.341 20 0 BEADLO CCc1cc(N[C@@H](C)c2nccc(C)n2)nc[nH+]1 ZINC000621330078 370263244 /nfs/dbraw/zinc/26/32/44/370263244.db2.gz YLICXQSPVISGCS-JTQLQIEISA-N 1 2 243.314 2.311 20 0 BEADLO C[C@H]1CCN(c2[nH]c3ccccc3[nH+]2)C[C@@H]1CO ZINC000621347739 370282607 /nfs/dbraw/zinc/28/26/07/370282607.db2.gz KXOVISMBJMZJAJ-WDEREUQCSA-N 1 2 245.326 2.018 20 0 BEADLO CC1CC(CNc2cc[nH+]c(C3CC3)n2)C1 ZINC000621352950 370288575 /nfs/dbraw/zinc/28/85/75/370288575.db2.gz GKGAGTZDOYHNTO-UHFFFAOYSA-N 1 2 217.316 2.234 20 0 BEADLO Cc1nc2[nH]ccc2c(NCC2CC(C)C2)[nH+]1 ZINC000621354638 370289854 /nfs/dbraw/zinc/28/98/54/370289854.db2.gz QGHNEABNWMUASM-UHFFFAOYSA-N 1 2 230.315 2.146 20 0 BEADLO CCC[C@](C)(O)CNc1cc(CC)[nH+]cn1 ZINC000226530697 370351973 /nfs/dbraw/zinc/35/19/73/370351973.db2.gz TXXZOOLYWXZKLS-LBPRGKRZSA-N 1 2 223.320 2.002 20 0 BEADLO Cc1cc(NC(=O)NCC2CC(C)C2)c(C)c[nH+]1 ZINC000621448692 370356853 /nfs/dbraw/zinc/35/68/53/370356853.db2.gz QMKSRVQJPZMVPX-UHFFFAOYSA-N 1 2 247.342 2.288 20 0 BEADLO c1cn(-c2cc(Nc3ccccc3)ncn2)c[nH+]1 ZINC000077165006 370396598 /nfs/dbraw/zinc/39/65/98/370396598.db2.gz MPHOOUOIXZHCBE-UHFFFAOYSA-N 1 2 237.266 2.406 20 0 BEADLO Cc1occc1C[N@@H+](C)Cc1nccnc1C ZINC000621713200 370459547 /nfs/dbraw/zinc/45/95/47/370459547.db2.gz CBMFWCVTDBPDBH-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1occc1C[N@H+](C)Cc1nccnc1C ZINC000621713200 370459550 /nfs/dbraw/zinc/45/95/50/370459550.db2.gz CBMFWCVTDBPDBH-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2nccnc2C)s1 ZINC000621712911 370459699 /nfs/dbraw/zinc/45/96/99/370459699.db2.gz UIFBKABSZGPZLE-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2nccnc2C)s1 ZINC000621712911 370459700 /nfs/dbraw/zinc/45/97/00/370459700.db2.gz UIFBKABSZGPZLE-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO Cc1nccnc1C[N@@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000621725537 370477217 /nfs/dbraw/zinc/47/72/17/370477217.db2.gz RXVDNAXSFWNQOT-ZDUSSCGKSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1nccnc1C[N@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000621725537 370477221 /nfs/dbraw/zinc/47/72/21/370477221.db2.gz RXVDNAXSFWNQOT-ZDUSSCGKSA-N 1 2 249.358 2.032 20 0 BEADLO Cn1ccnc1C[NH+]1CC(Cc2ccsc2)C1 ZINC000621741321 370501274 /nfs/dbraw/zinc/50/12/74/370501274.db2.gz MOMBLQDGYLYUIS-UHFFFAOYSA-N 1 2 247.367 2.156 20 0 BEADLO Cc1ccoc1C[N@@H+](C)Cc1nccnc1C ZINC000621729450 370481396 /nfs/dbraw/zinc/48/13/96/370481396.db2.gz VIIGMCMWEVVRBD-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ccoc1C[N@H+](C)Cc1nccnc1C ZINC000621729450 370481402 /nfs/dbraw/zinc/48/14/02/370481402.db2.gz VIIGMCMWEVVRBD-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO COCc1cc(C[NH+]2CC(CC3CC3)C2)no1 ZINC000621740182 370498574 /nfs/dbraw/zinc/49/85/74/370498574.db2.gz CCQZULGZJXMGOO-UHFFFAOYSA-N 1 2 236.315 2.053 20 0 BEADLO CCCC[C@@H](C(=O)NCc1c[nH+]c[nH]1)C(C)C ZINC000621876887 370575645 /nfs/dbraw/zinc/57/56/45/370575645.db2.gz LUYRGDVYZWFSSK-GFCCVEGCSA-N 1 2 237.347 2.488 20 0 BEADLO CCCC[C@@H](C(=O)NCc1c[nH]c[nH+]1)C(C)C ZINC000621876887 370575647 /nfs/dbraw/zinc/57/56/47/370575647.db2.gz LUYRGDVYZWFSSK-GFCCVEGCSA-N 1 2 237.347 2.488 20 0 BEADLO C[C@@H]1CCCCN(C(=O)C(C)(C)c2c[nH+]c[nH]2)C1 ZINC000621958496 370621299 /nfs/dbraw/zinc/62/12/99/370621299.db2.gz LHSOKDWBVADUEM-LLVKDONJSA-N 1 2 249.358 2.336 20 0 BEADLO C[C@@H](Nc1[nH+]c(C2CC2)nc2[nH]ccc21)C1CC1 ZINC000631041780 371005586 /nfs/dbraw/zinc/00/55/86/371005586.db2.gz MSGQVSVFLDBPNG-MRVPVSSYSA-N 1 2 242.326 2.468 20 0 BEADLO CCc1cc(NCc2ccoc2)nc[nH+]1 ZINC000123463104 371072218 /nfs/dbraw/zinc/07/22/18/371072218.db2.gz OHPUAIFCTRTFDX-UHFFFAOYSA-N 1 2 203.245 2.244 20 0 BEADLO CCc1cc(NC[C@@H](C)C2CC2)nc[nH+]1 ZINC000123462667 371072502 /nfs/dbraw/zinc/07/25/02/371072502.db2.gz XCJLAQRTYCYFIZ-SECBINFHSA-N 1 2 205.305 2.497 20 0 BEADLO c1[nH+]cn2c1c(N1CCCC1)nc1ccccc12 ZINC000623788219 371094362 /nfs/dbraw/zinc/09/43/62/371094362.db2.gz SNVOIHIFLVQHAM-UHFFFAOYSA-N 1 2 238.294 2.483 20 0 BEADLO COc1ccc[nH+]c1NCCc1cccc(C)n1 ZINC000624169970 371361783 /nfs/dbraw/zinc/36/17/83/371361783.db2.gz CXCJTOQBXNSOCI-UHFFFAOYSA-N 1 2 243.310 2.448 20 0 BEADLO CCC(F)(F)C[NH2+][C@H](C)c1cncnc1C ZINC000624148549 371344380 /nfs/dbraw/zinc/34/43/80/371344380.db2.gz IGAKRLGAICDHKA-MRVPVSSYSA-N 1 2 229.274 2.481 20 0 BEADLO COc1ccc[nH+]c1N1CCC2(CC2)C1 ZINC000624183445 371373648 /nfs/dbraw/zinc/37/36/48/371373648.db2.gz QBNVMXIINZOOKP-UHFFFAOYSA-N 1 2 204.273 2.081 20 0 BEADLO COc1ccc[nH+]c1N1CC[C@@H](C(F)F)C1 ZINC000624183086 371373945 /nfs/dbraw/zinc/37/39/45/371373945.db2.gz BQEZPFGHPMAXCH-MRVPVSSYSA-N 1 2 228.242 2.182 20 0 BEADLO CC(C)c1nc(NC[C@H](C)C[C@H](C)O)cc[nH+]1 ZINC000156709187 371492951 /nfs/dbraw/zinc/49/29/51/371492951.db2.gz HHCOZSOVPWPIPP-MNOVXSKESA-N 1 2 237.347 2.419 20 0 BEADLO CC1(C)CCC[C@H]1C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627370987 371588180 /nfs/dbraw/zinc/58/81/80/371588180.db2.gz SDGIRZLVHVKFJU-JTQLQIEISA-N 1 2 247.342 2.121 20 0 BEADLO CC1(C)CCC[C@H]1C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627370987 371588185 /nfs/dbraw/zinc/58/81/85/371588185.db2.gz SDGIRZLVHVKFJU-JTQLQIEISA-N 1 2 247.342 2.121 20 0 BEADLO C[C@@H](CC(C)(C)C)C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627370588 371588972 /nfs/dbraw/zinc/58/89/72/371588972.db2.gz FLISUSVJZSKDTM-JTQLQIEISA-N 1 2 249.358 2.367 20 0 BEADLO C[C@@H](CC(C)(C)C)C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627370588 371588978 /nfs/dbraw/zinc/58/89/78/371588978.db2.gz FLISUSVJZSKDTM-JTQLQIEISA-N 1 2 249.358 2.367 20 0 BEADLO CC[C@H](C)CCC(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627371352 371589727 /nfs/dbraw/zinc/58/97/27/371589727.db2.gz BWVRNDQVJPLQBS-JTQLQIEISA-N 1 2 235.331 2.121 20 0 BEADLO CC[C@H](C)CCC(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627371352 371589731 /nfs/dbraw/zinc/58/97/31/371589731.db2.gz BWVRNDQVJPLQBS-JTQLQIEISA-N 1 2 235.331 2.121 20 0 BEADLO C[C@H]1C[C@H]([NH2+]Cc2ccns2)c2nccn21 ZINC000404338454 372082174 /nfs/dbraw/zinc/08/21/74/372082174.db2.gz DATXNFJQSWXAKU-WPRPVWTQSA-N 1 2 234.328 2.135 20 0 BEADLO CCCCc1cc(N[C@H](C)CCCO)nc[nH+]1 ZINC000631160987 372212209 /nfs/dbraw/zinc/21/22/09/372212209.db2.gz YRLOFTFOMJUQFF-LLVKDONJSA-N 1 2 237.347 2.392 20 0 BEADLO CCCCc1cc(NC(C)(C)[C@H](C)O)nc[nH+]1 ZINC000631185340 372221423 /nfs/dbraw/zinc/22/14/23/372221423.db2.gz WBQVITYYVCEPSO-JTQLQIEISA-N 1 2 237.347 2.391 20 0 BEADLO CCCCc1cc(N[C@@H](C)C[C@@H](C)O)nc[nH+]1 ZINC000631203343 372233734 /nfs/dbraw/zinc/23/37/34/372233734.db2.gz OVDQBNGRLRUCMG-WDEREUQCSA-N 1 2 237.347 2.391 20 0 BEADLO CN(C)c1c[nH+]cc(NC[C@H]2CCSC2)c1 ZINC000631202725 372233914 /nfs/dbraw/zinc/23/39/14/372233914.db2.gz BVNXYZUTQHWXHM-SNVBAGLBSA-N 1 2 237.372 2.313 20 0 BEADLO CCc1csc([C@@H](C)Nc2cc[nH+]c(C)n2)n1 ZINC000631321075 372295202 /nfs/dbraw/zinc/29/52/02/372295202.db2.gz ZYTKVGCLDPQQEC-MRVPVSSYSA-N 1 2 248.355 2.399 20 0 BEADLO C[C@@H](CCO)N(C)c1cc2ccccc2c[nH+]1 ZINC000631342196 372303393 /nfs/dbraw/zinc/30/33/93/372303393.db2.gz ULEYGJYQEOJBLI-NSHDSACASA-N 1 2 230.311 2.442 20 0 BEADLO Cc1ccc(NC(=O)CC2CSC2)c(C)[nH+]1 ZINC000631743191 372544135 /nfs/dbraw/zinc/54/41/35/372544135.db2.gz OXARKHYONGWTGB-UHFFFAOYSA-N 1 2 236.340 2.390 20 0 BEADLO CCC(=O)CSc1[nH+]cc2ccccn21 ZINC000171256228 372528575 /nfs/dbraw/zinc/52/85/75/372528575.db2.gz USCYXKUKJSWFDJ-UHFFFAOYSA-N 1 2 220.297 2.406 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H]1C[C@H]1C(F)(F)F ZINC000631755056 372558094 /nfs/dbraw/zinc/55/80/94/372558094.db2.gz XOOMRGTWTRLOIJ-LQQYEPNUSA-N 1 2 233.237 2.320 20 0 BEADLO Cc1conc1C(=O)Nc1ccc(C)[nH+]c1C ZINC000631743369 372544436 /nfs/dbraw/zinc/54/44/36/372544436.db2.gz SAYMNELFQPBFSS-UHFFFAOYSA-N 1 2 231.255 2.247 20 0 BEADLO CCOCC[N@H+](CC)Cc1nc(C(C)C)no1 ZINC000171635260 372715618 /nfs/dbraw/zinc/71/56/18/372715618.db2.gz UOBFIMFPVFNNAV-UHFFFAOYSA-N 1 2 241.335 2.051 20 0 BEADLO CCOCC[N@@H+](CC)Cc1nc(C(C)C)no1 ZINC000171635260 372715624 /nfs/dbraw/zinc/71/56/24/372715624.db2.gz UOBFIMFPVFNNAV-UHFFFAOYSA-N 1 2 241.335 2.051 20 0 BEADLO O=C(C[NH+]1Cc2ccccc2C1)NC1CCCC1 ZINC000106304494 181970640 /nfs/dbraw/zinc/97/06/40/181970640.db2.gz NUHZJRMVNFSPRN-UHFFFAOYSA-N 1 2 244.338 2.061 20 0 BEADLO CCC[C@](C)([NH2+][C@@H]1C=CCCC1)C(=O)OC ZINC000171935994 205521709 /nfs/dbraw/zinc/52/17/09/205521709.db2.gz XHVCHALBRJSTDO-YPMHNXCESA-N 1 2 225.332 2.417 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)NCCC1=CCCC1 ZINC000633134181 373300921 /nfs/dbraw/zinc/30/09/21/373300921.db2.gz FRQGZXFZKDDLQX-UHFFFAOYSA-N 1 2 248.330 2.052 20 0 BEADLO O=C(NC1CCC1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000264555914 182106561 /nfs/dbraw/zinc/10/65/61/182106561.db2.gz SSTHVWXFCACNCK-UHFFFAOYSA-N 1 2 241.294 2.155 20 0 BEADLO O=C(CCCn1cc[nH+]c1)N[C@@H]1CCCC12CC2 ZINC000633769368 373737290 /nfs/dbraw/zinc/73/72/90/373737290.db2.gz MKQXXGRCIORLCR-GFCCVEGCSA-N 1 2 247.342 2.112 20 0 BEADLO COc1cc[nH+]cc1NCc1cc[nH]c1 ZINC000178814574 206008256 /nfs/dbraw/zinc/00/82/56/206008256.db2.gz NUGXXXRLQIDHOV-UHFFFAOYSA-N 1 2 203.245 2.030 20 0 BEADLO Cn1ccnc1C[NH2+][C@@H]1C[C@@]1(F)c1ccccc1 ZINC000424192672 206036112 /nfs/dbraw/zinc/03/61/12/206036112.db2.gz JOIIRBUKCSZSOA-TZMCWYRMSA-N 1 2 245.301 2.147 20 0 BEADLO Cn1cc[nH+]c1CN[C@@H]1C[C@@]1(F)c1ccccc1 ZINC000424192672 206036117 /nfs/dbraw/zinc/03/61/17/206036117.db2.gz JOIIRBUKCSZSOA-TZMCWYRMSA-N 1 2 245.301 2.147 20 0 BEADLO CCc1cnc(CNc2cc[nH+]c(C(C)C)n2)o1 ZINC000439644286 206075305 /nfs/dbraw/zinc/07/53/05/206075305.db2.gz KOKCYFLUVAKQNT-UHFFFAOYSA-N 1 2 246.314 2.184 20 0 BEADLO CC[C@H](F)C[N@H+](CC(=O)OC)[C@@H](C)CC ZINC000440488019 206079663 /nfs/dbraw/zinc/07/96/63/206079663.db2.gz CMZSNELSFPXWNO-UWVGGRQHSA-N 1 2 219.300 2.008 20 0 BEADLO CC[C@H](F)C[N@@H+](CC(=O)OC)[C@@H](C)CC ZINC000440488019 206079665 /nfs/dbraw/zinc/07/96/65/206079665.db2.gz CMZSNELSFPXWNO-UWVGGRQHSA-N 1 2 219.300 2.008 20 0 BEADLO c1nc2c(s1)CN(c1cccc[nH+]1)CC2 ZINC000445669864 206085732 /nfs/dbraw/zinc/08/57/32/206085732.db2.gz IPNUMRBQERDBKM-UHFFFAOYSA-N 1 2 217.297 2.101 20 0 BEADLO C=Cn1cc(CNc2c[nH+]cc(C)c2)cn1 ZINC000194390308 206088716 /nfs/dbraw/zinc/08/87/16/206088716.db2.gz NUNJOKDBOWABRC-UHFFFAOYSA-N 1 2 214.272 2.299 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cc[nH]n2)cs1 ZINC000449030626 206095511 /nfs/dbraw/zinc/09/55/11/206095511.db2.gz UVGFBPDHEUSBOW-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cc[nH]n2)cs1 ZINC000449030626 206095514 /nfs/dbraw/zinc/09/55/14/206095514.db2.gz UVGFBPDHEUSBOW-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO CSc1cc(C[NH2+]Cc2cc(C)on2)ccn1 ZINC000459464465 206128522 /nfs/dbraw/zinc/12/85/22/206128522.db2.gz PATSVBISZZDQCL-UHFFFAOYSA-N 1 2 249.339 2.390 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)C1CCCC1 ZINC000266131685 182375119 /nfs/dbraw/zinc/37/51/19/182375119.db2.gz CFASJMANRYAONG-UHFFFAOYSA-N 1 2 229.283 2.463 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)C1CCCC1 ZINC000280724232 182385117 /nfs/dbraw/zinc/38/51/17/182385117.db2.gz HYWHTDTZSSYWAR-UHFFFAOYSA-N 1 2 229.283 2.463 20 0 BEADLO CCCC[C@@H](C)C(=O)N1CCn2c[nH+]cc2C1 ZINC000290915573 168938161 /nfs/dbraw/zinc/93/81/61/168938161.db2.gz JQPWHTFVNABGEM-LLVKDONJSA-N 1 2 235.331 2.052 20 0 BEADLO OC1(CCNc2cc[nH+]c3ccncc23)CCC1 ZINC000286762956 183016902 /nfs/dbraw/zinc/01/69/02/183016902.db2.gz PULFEMOEZZQIAV-UHFFFAOYSA-N 1 2 243.310 2.347 20 0 BEADLO OC1(c2ccc(F)cc2)C[NH+]([C@H]2C=CCCC2)C1 ZINC000375355179 183023210 /nfs/dbraw/zinc/02/32/10/183023210.db2.gz OCTYPKLHALJZHF-AWEZNQCLSA-N 1 2 247.313 2.438 20 0 BEADLO OC1(c2ccc(F)cc2)C[NH+]([C@@H]2C=CCCC2)C1 ZINC000375355182 183023402 /nfs/dbraw/zinc/02/34/02/183023402.db2.gz OCTYPKLHALJZHF-CQSZACIVSA-N 1 2 247.313 2.438 20 0 BEADLO OCCCCC[N@@H+]1CCCC[C@@H]1C(F)F ZINC000337430208 183045984 /nfs/dbraw/zinc/04/59/84/183045984.db2.gz YPYKNIBURKJNLN-SNVBAGLBSA-N 1 2 221.291 2.269 20 0 BEADLO OCCCCC[N@H+]1CCCC[C@@H]1C(F)F ZINC000337430208 183045985 /nfs/dbraw/zinc/04/59/85/183045985.db2.gz YPYKNIBURKJNLN-SNVBAGLBSA-N 1 2 221.291 2.269 20 0 BEADLO OCC(F)(F)C[NH2+]CCc1cccc(Cl)c1 ZINC000291421353 183033904 /nfs/dbraw/zinc/03/39/04/183033904.db2.gz HWTBLIORMGFIDG-UHFFFAOYSA-N 1 2 249.688 2.100 20 0 BEADLO OCCCCNc1cc(C(F)(F)F)cc[nH+]1 ZINC000236505125 183052430 /nfs/dbraw/zinc/05/24/30/183052430.db2.gz GSKNNGJMCQIYMV-UHFFFAOYSA-N 1 2 234.221 2.285 20 0 BEADLO OCCC[C@H]([NH2+]Cc1ccon1)c1ccccc1 ZINC000179746332 183062992 /nfs/dbraw/zinc/06/29/92/183062992.db2.gz DOMGQQLYYYABNZ-AWEZNQCLSA-N 1 2 246.310 2.278 20 0 BEADLO OCC[C@@H]1CCCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000051895312 183092708 /nfs/dbraw/zinc/09/27/08/183092708.db2.gz CCOKNSVFQHVAHW-NSHDSACASA-N 1 2 245.326 2.162 20 0 BEADLO CCCC[C@H]([NH2+][C@H]1CSC[C@H]1C)C(=O)OC ZINC000310002929 169013113 /nfs/dbraw/zinc/01/31/13/169013113.db2.gz FMSJELPPXCBLEO-VWYCJHECSA-N 1 2 245.388 2.059 20 0 BEADLO CCCC[C@H]([NH2+][C@H]1C[C@H]1C1CC1)C(=O)OC ZINC000310016234 169013232 /nfs/dbraw/zinc/01/32/32/169013232.db2.gz LAWAOYUOLRJIJL-SRVKXCTJSA-N 1 2 225.332 2.106 20 0 BEADLO CCCC[C@H]([NH2+][C@@H](C)COC(C)C)C(=O)OC ZINC000337514748 169013294 /nfs/dbraw/zinc/01/32/94/169013294.db2.gz UKZNIUZMZNXTHD-RYUDHWBXSA-N 1 2 245.363 2.121 20 0 BEADLO OC[C@H]([NH2+]Cc1cscn1)c1ccsc1 ZINC000336738916 183141408 /nfs/dbraw/zinc/14/14/08/183141408.db2.gz RWIDBKGTPISNSR-JTQLQIEISA-N 1 2 240.353 2.028 20 0 BEADLO OC[C@H](Nc1cccc[nH+]1)C1CCCC1 ZINC000290867671 183143203 /nfs/dbraw/zinc/14/32/03/183143203.db2.gz RFXXPGWPGLCQJH-NSHDSACASA-N 1 2 206.289 2.045 20 0 BEADLO OC[C@@H]1CCC[C@H](CNc2cccc[nH+]2)C1 ZINC000348230926 183121950 /nfs/dbraw/zinc/12/19/50/183121950.db2.gz RQYNQMMATMPTJJ-NWDGAFQWSA-N 1 2 220.316 2.292 20 0 BEADLO CCCCc1nc(COc2cc[nH+]cc2)no1 ZINC000276456570 169026648 /nfs/dbraw/zinc/02/66/48/169026648.db2.gz NBLPOSMELRYNPU-UHFFFAOYSA-N 1 2 233.271 2.386 20 0 BEADLO CCCCn1ncc(NCc2c[nH+]cn2C)c1C ZINC000341254010 169039648 /nfs/dbraw/zinc/03/96/48/169039648.db2.gz DQVFLTKJLUMELV-UHFFFAOYSA-N 1 2 247.346 2.337 20 0 BEADLO OCc1ccc(C[N@@H+]2CCC[C@H]2C(F)F)cc1 ZINC000353184485 183163655 /nfs/dbraw/zinc/16/36/55/183163655.db2.gz RVHZDKMKFHVUSU-LBPRGKRZSA-N 1 2 241.281 2.408 20 0 BEADLO OCc1ccc(C[N@H+]2CCC[C@H]2C(F)F)cc1 ZINC000353184485 183163657 /nfs/dbraw/zinc/16/36/57/183163657.db2.gz RVHZDKMKFHVUSU-LBPRGKRZSA-N 1 2 241.281 2.408 20 0 BEADLO OCc1ccc(NCc2ccccc2F)[nH+]c1 ZINC000340560351 183166446 /nfs/dbraw/zinc/16/64/46/183166446.db2.gz FLYDEGDZKLSRRG-UHFFFAOYSA-N 1 2 232.258 2.325 20 0 BEADLO CCCN(C)C(=O)Nc1cc[nH+]c(C)c1 ZINC000119248884 169056274 /nfs/dbraw/zinc/05/62/74/169056274.db2.gz SKIIOMRRZFVVAY-UHFFFAOYSA-N 1 2 207.277 2.264 20 0 BEADLO O[C@@H]1CC[C@H](CNc2cc[nH+]c3ccncc23)C1 ZINC000276866945 183203439 /nfs/dbraw/zinc/20/34/39/183203439.db2.gz JCAFZECJKNBWBS-WDEREUQCSA-N 1 2 243.310 2.203 20 0 BEADLO O[C@H](CCc1ccccc1)CNc1cccc[nH+]1 ZINC000273208008 183220382 /nfs/dbraw/zinc/22/03/82/183220382.db2.gz TXANYQVAPGDLJR-CQSZACIVSA-N 1 2 242.322 2.487 20 0 BEADLO CCC[N@H+](C)Cc1nc([C@H](C)OCC)no1 ZINC000120562016 169082338 /nfs/dbraw/zinc/08/23/38/169082338.db2.gz LHODBFSGDBKYNI-VIFPVBQESA-N 1 2 227.308 2.009 20 0 BEADLO CCC[N@@H+](C)Cc1nc([C@H](C)OCC)no1 ZINC000120562016 169082339 /nfs/dbraw/zinc/08/23/39/169082339.db2.gz LHODBFSGDBKYNI-VIFPVBQESA-N 1 2 227.308 2.009 20 0 BEADLO CCC[N@H+](C)[C@H](C(=O)OC)c1ccsc1 ZINC000280080524 169085584 /nfs/dbraw/zinc/08/55/84/169085584.db2.gz RGLAZRDZCJJWHB-JTQLQIEISA-N 1 2 227.329 2.304 20 0 BEADLO CCC[N@@H+](C)[C@H](C(=O)OC)c1ccsc1 ZINC000280080524 169085587 /nfs/dbraw/zinc/08/55/87/169085587.db2.gz RGLAZRDZCJJWHB-JTQLQIEISA-N 1 2 227.329 2.304 20 0 BEADLO CCC[N@H+](CC(=O)OC)Cc1ccc(C)s1 ZINC000178871650 169100930 /nfs/dbraw/zinc/10/09/30/169100930.db2.gz YWAXYOYIGMLVQB-UHFFFAOYSA-N 1 2 241.356 2.442 20 0 BEADLO CCC[N@@H+](CC(=O)OC)Cc1ccc(C)s1 ZINC000178871650 169100932 /nfs/dbraw/zinc/10/09/32/169100932.db2.gz YWAXYOYIGMLVQB-UHFFFAOYSA-N 1 2 241.356 2.442 20 0 BEADLO Oc1cccc(C[NH2+]CCF)c1Cl ZINC000294667839 183289558 /nfs/dbraw/zinc/28/95/58/183289558.db2.gz LZDJSCMSEQXUTK-UHFFFAOYSA-N 1 2 203.644 2.105 20 0 BEADLO CCC[N@H+](CCO)Cc1csc(Cl)n1 ZINC000295629286 169167399 /nfs/dbraw/zinc/16/73/99/169167399.db2.gz XFZDPGJGTHUBSB-UHFFFAOYSA-N 1 2 234.752 2.001 20 0 BEADLO CCC[N@@H+](CCO)Cc1csc(Cl)n1 ZINC000295629286 169167401 /nfs/dbraw/zinc/16/74/01/169167401.db2.gz XFZDPGJGTHUBSB-UHFFFAOYSA-N 1 2 234.752 2.001 20 0 BEADLO c1n[nH]c2c1[C@@H]([NH2+]CCOC1CCCC1)CCC2 ZINC000367740112 183320431 /nfs/dbraw/zinc/32/04/31/183320431.db2.gz NJZZQSBTGITEJB-ZDUSSCGKSA-N 1 2 249.358 2.336 20 0 BEADLO c1c[nH]c(-c2ccc(-c3[nH]cc[nH+]3)cc2)n1 ZINC000080163315 183323653 /nfs/dbraw/zinc/32/36/53/183323653.db2.gz TZNMAIVZYDKFRG-UHFFFAOYSA-N 1 2 210.240 2.467 20 0 BEADLO c1cc(C[N@H+]2CCOC[C@@H]2CC2CCC2)no1 ZINC000339775356 183344048 /nfs/dbraw/zinc/34/40/48/183344048.db2.gz DFAZTEQXXZWUPX-ZDUSSCGKSA-N 1 2 236.315 2.066 20 0 BEADLO c1cc(C[N@@H+]2CCOC[C@@H]2CC2CCC2)no1 ZINC000339775356 183344050 /nfs/dbraw/zinc/34/40/50/183344050.db2.gz DFAZTEQXXZWUPX-ZDUSSCGKSA-N 1 2 236.315 2.066 20 0 BEADLO c1cc(C[NH2+]Cc2nnc(C3CC3)[nH]2)cs1 ZINC000294897188 183352269 /nfs/dbraw/zinc/35/22/69/183352269.db2.gz WYVKSNVIEAJJII-UHFFFAOYSA-N 1 2 234.328 2.033 20 0 BEADLO c1nc(CCNc2cc[nH+]c(C3CC3)n2)cs1 ZINC000301403617 183356964 /nfs/dbraw/zinc/35/69/64/183356964.db2.gz SANOCYNWKVJTOH-UHFFFAOYSA-N 1 2 246.339 2.465 20 0 BEADLO c1cc2c(o1)CCC[N@@H+](Cc1cnns1)C2 ZINC000295205826 183372106 /nfs/dbraw/zinc/37/21/06/183372106.db2.gz OFKIUXOWWVZJCY-UHFFFAOYSA-N 1 2 235.312 2.080 20 0 BEADLO c1cc2c(o1)CCC[N@H+](Cc1cnns1)C2 ZINC000295205826 183372109 /nfs/dbraw/zinc/37/21/09/183372109.db2.gz OFKIUXOWWVZJCY-UHFFFAOYSA-N 1 2 235.312 2.080 20 0 BEADLO c1cc2[nH+]ccc(NC[C@H]3CCCO3)c2cn1 ZINC000295901749 183377270 /nfs/dbraw/zinc/37/72/70/183377270.db2.gz CQZGIQBWURSIGF-SNVBAGLBSA-N 1 2 229.283 2.221 20 0 BEADLO c1cn(CCCSc2ccncc2)c[nH+]1 ZINC000273515174 183360122 /nfs/dbraw/zinc/36/01/22/183360122.db2.gz XOAAADKTBCMRBY-UHFFFAOYSA-N 1 2 219.313 2.461 20 0 BEADLO c1c2ccccc2[nH]c1C[N@@H+]1CCO[C@@H]2C[C@@H]21 ZINC000366545146 183436007 /nfs/dbraw/zinc/43/60/07/183436007.db2.gz OFFOIBVDVZONSQ-UONOGXRCSA-N 1 2 228.295 2.141 20 0 BEADLO c1c2ccccc2[nH]c1C[N@H+]1CCO[C@@H]2C[C@@H]21 ZINC000366545146 183436008 /nfs/dbraw/zinc/43/60/08/183436008.db2.gz OFFOIBVDVZONSQ-UONOGXRCSA-N 1 2 228.295 2.141 20 0 BEADLO c1cn(CCSCCOCC2CC2)c[nH+]1 ZINC000122472353 183469568 /nfs/dbraw/zinc/46/95/68/183469568.db2.gz QEUARXVBBUNBMN-UHFFFAOYSA-N 1 2 226.345 2.043 20 0 BEADLO CCC[C@@H](C)C(=O)NCCCNc1cccc[nH+]1 ZINC000136206429 169350101 /nfs/dbraw/zinc/35/01/01/169350101.db2.gz YBPJEMZDKTZOPM-GFCCVEGCSA-N 1 2 249.358 2.436 20 0 BEADLO CCC[C@@H](C)C(=O)N[C@H](c1[nH+]ccn1C)C1CC1 ZINC000341714879 169352343 /nfs/dbraw/zinc/35/23/43/169352343.db2.gz RRWOVZXPRFPYTE-PWSUYJOCSA-N 1 2 249.358 2.424 20 0 BEADLO CCc1cn(CCOCC(F)(F)F)c[nH+]1 ZINC001644227087 1172535422 /nfs/dbraw/zinc/53/54/22/1172535422.db2.gz DLPJIRFAYYWICB-UHFFFAOYSA-N 1 2 222.210 2.024 20 0 BEADLO c1nc(NCC2CC2)cc(NCC2CC2)[nH+]1 ZINC000270302465 183533632 /nfs/dbraw/zinc/53/36/32/183533632.db2.gz POYKKYFKNKBCIY-UHFFFAOYSA-N 1 2 218.304 2.120 20 0 BEADLO Cc1nc(C[N@H+](C)CCC2CCCC2)no1 ZINC000181684946 134338574 /nfs/dbraw/zinc/33/85/74/134338574.db2.gz FKAOEJBYYDOVIA-UHFFFAOYSA-N 1 2 223.320 2.390 20 0 BEADLO Cc1nc(C[N@@H+](C)CCC2CCCC2)no1 ZINC000181684946 134338575 /nfs/dbraw/zinc/33/85/75/134338575.db2.gz FKAOEJBYYDOVIA-UHFFFAOYSA-N 1 2 223.320 2.390 20 0 BEADLO CCCC[C@H](CC)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000522251281 259622383 /nfs/dbraw/zinc/62/23/83/259622383.db2.gz RYMRZMLGPGBEFH-LBPRGKRZSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1csc(C(C)(C)[NH2+]CC2=NOCC2)n1 ZINC001644829993 1172613501 /nfs/dbraw/zinc/61/35/01/1172613501.db2.gz IYLRECVTKRIQHN-UHFFFAOYSA-N 1 2 239.344 2.053 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+]Cc2c(C)nn(C)c2C)o1 ZINC000220931769 383828231 /nfs/dbraw/zinc/82/82/31/383828231.db2.gz SYTXRDJIINMSGI-SNVBAGLBSA-N 1 2 248.330 2.184 20 0 BEADLO Cc1noc(C)c1CNc1cccc[nH+]1 ZINC000069831004 383847392 /nfs/dbraw/zinc/84/73/92/383847392.db2.gz SXWGCKUCDKYGBB-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO C[C@@H](Nc1nc[nH+]c(N)c1Cl)c1ccccn1 ZINC000235221320 383864733 /nfs/dbraw/zinc/86/47/33/383864733.db2.gz BUGZUUTVJUVGPD-SSDOTTSWSA-N 1 2 249.705 2.280 20 0 BEADLO C[C@@H](Nc1[nH+]cnc(N)c1Cl)c1ccccn1 ZINC000235221320 383864735 /nfs/dbraw/zinc/86/47/35/383864735.db2.gz BUGZUUTVJUVGPD-SSDOTTSWSA-N 1 2 249.705 2.280 20 0 BEADLO COC(=O)COc1ccc([NH2+]C(C)C)c(C)c1 ZINC000088524866 383907307 /nfs/dbraw/zinc/90/73/07/383907307.db2.gz TVQPKFIFYLDHDI-UHFFFAOYSA-N 1 2 237.299 2.367 20 0 BEADLO Cc1ccncc1C[N@H+](C)Cc1ccno1 ZINC000518461522 383914752 /nfs/dbraw/zinc/91/47/52/383914752.db2.gz BHXVIEGEJWWUFL-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ccncc1C[N@@H+](C)Cc1ccno1 ZINC000518461522 383914758 /nfs/dbraw/zinc/91/47/58/383914758.db2.gz BHXVIEGEJWWUFL-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2nncn2C)o1 ZINC000037017355 383932808 /nfs/dbraw/zinc/93/28/08/383932808.db2.gz BKUFSYRJQGBPKG-NXEZZACHSA-N 1 2 234.303 2.128 20 0 BEADLO CCCC[C@@H]([NH2+][C@@H](CC)CSC)C(=O)OC ZINC000091555067 383980559 /nfs/dbraw/zinc/98/05/59/383980559.db2.gz CXULWCUFNSVOEQ-WDEREUQCSA-N 1 2 247.404 2.449 20 0 BEADLO CC[C@H]([NH2+][C@@H]1C[C@@H](C)N(C2CC2)C1)C(F)F ZINC000449364813 383991536 /nfs/dbraw/zinc/99/15/36/383991536.db2.gz UJUBUVYZYQVSTE-KKZNHRDASA-N 1 2 232.318 2.245 20 0 BEADLO C[C@@H]1Cc2[nH+]cn(Cc3nccn3C)c2C[C@H]1C ZINC000296142640 383936672 /nfs/dbraw/zinc/93/66/72/383936672.db2.gz ZVNNMBFXJHRDDP-GHMZBOCLSA-N 1 2 244.342 2.036 20 0 BEADLO c1csc([C@@H]([NH2+]CCC2CC2)c2nnc[nH]2)c1 ZINC000294788183 383945745 /nfs/dbraw/zinc/94/57/45/383945745.db2.gz OEIXKUONWWVFBM-LLVKDONJSA-N 1 2 248.355 2.345 20 0 BEADLO C[C@H]([NH2+]Cc1csnn1)c1cccc(O)c1 ZINC000037151705 383948042 /nfs/dbraw/zinc/94/80/42/383948042.db2.gz OYFAXHXCLPSZTQ-QMMMGPOBSA-N 1 2 235.312 2.095 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCn2ccnc21)c1ccccn1 ZINC000345355665 383956385 /nfs/dbraw/zinc/95/63/85/383956385.db2.gz SVTDCUYMBSBRFE-ZYHUDNBSSA-N 1 2 228.299 2.074 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCn2ccnc21)c1ccccn1 ZINC000345355664 383956558 /nfs/dbraw/zinc/95/65/58/383956558.db2.gz SVTDCUYMBSBRFE-PWSUYJOCSA-N 1 2 228.299 2.074 20 0 BEADLO Cc1n[nH]cc1C[NH2+]Cc1c(F)cccc1F ZINC000037989180 384049276 /nfs/dbraw/zinc/04/92/76/384049276.db2.gz AGQAVGMSAKOBOW-UHFFFAOYSA-N 1 2 237.253 2.286 20 0 BEADLO COC(=O)[C@H]([NH2+]CC(C)C)c1ccccc1 ZINC000037853377 384027791 /nfs/dbraw/zinc/02/77/91/384027791.db2.gz OCODRJUJZGYQEW-GFCCVEGCSA-N 1 2 221.300 2.146 20 0 BEADLO c1cn(-c2ccccc2OCc2ccon2)c[nH+]1 ZINC000530955948 384032002 /nfs/dbraw/zinc/03/20/02/384032002.db2.gz WRGRQMWDESNNHS-UHFFFAOYSA-N 1 2 241.250 2.439 20 0 BEADLO Cc1ccc2[nH+]c(CNC(CF)CF)cn2c1 ZINC000449379757 384083680 /nfs/dbraw/zinc/08/36/80/384083680.db2.gz KGIKXHOVYFDYQB-UHFFFAOYSA-N 1 2 239.269 2.040 20 0 BEADLO CCc1ccc([C@@H](C)[NH2+]Cc2ncn(C)n2)cc1 ZINC000090969925 384087074 /nfs/dbraw/zinc/08/70/74/384087074.db2.gz ATDZYHUGGBNOEO-LLVKDONJSA-N 1 2 244.342 2.228 20 0 BEADLO c1cc(OCCC[C@H]2CCOC2)cc[nH+]1 ZINC000647158656 384087269 /nfs/dbraw/zinc/08/72/69/384087269.db2.gz YPRMCFBTAMTAAE-NSHDSACASA-N 1 2 207.273 2.277 20 0 BEADLO Cc1nc(C[N@@H+]2CCOC(C)(C)[C@H]2C)oc1C ZINC000336526094 384058707 /nfs/dbraw/zinc/05/87/07/384058707.db2.gz AOPTXMBOQSFGRQ-LLVKDONJSA-N 1 2 238.331 2.291 20 0 BEADLO Cc1nc(C[N@H+]2CCOC(C)(C)[C@H]2C)oc1C ZINC000336526094 384058709 /nfs/dbraw/zinc/05/87/09/384058709.db2.gz AOPTXMBOQSFGRQ-LLVKDONJSA-N 1 2 238.331 2.291 20 0 BEADLO Cc1ccnc(NC(=O)C[C@@H](C)n2cc[nH+]c2)c1 ZINC000560342395 384079801 /nfs/dbraw/zinc/07/98/01/384079801.db2.gz DDIRQBQUYZUEDY-LLVKDONJSA-N 1 2 244.298 2.176 20 0 BEADLO C[NH+](Cc1ccccn1)Cc1ccccn1 ZINC000091352018 384121521 /nfs/dbraw/zinc/12/15/21/384121521.db2.gz VRXALIIKPAZHHE-UHFFFAOYSA-N 1 2 213.284 2.109 20 0 BEADLO C(c1noc(C2CC2)n1)[N@@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000152991178 384124937 /nfs/dbraw/zinc/12/49/37/384124937.db2.gz KHKUQRCWZRZCKS-PHIMTYICSA-N 1 2 233.315 2.179 20 0 BEADLO C(c1noc(C2CC2)n1)[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000152991178 384124941 /nfs/dbraw/zinc/12/49/41/384124941.db2.gz KHKUQRCWZRZCKS-PHIMTYICSA-N 1 2 233.315 2.179 20 0 BEADLO Cn1cnc(C[NH2+][C@@H](c2ccccc2)C2CC2)n1 ZINC000091410007 384126673 /nfs/dbraw/zinc/12/66/73/384126673.db2.gz KVZLOSYYJOXWHW-AWEZNQCLSA-N 1 2 242.326 2.056 20 0 BEADLO Cc1cc(C(=O)NCc2[nH]cc[nH+]2)sc1C ZINC000070651575 384129602 /nfs/dbraw/zinc/12/96/02/384129602.db2.gz DISQHDBEXFBSSS-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1nc(C2CC2)no1)c1cn[nH]c1 ZINC000358802866 384170158 /nfs/dbraw/zinc/17/01/58/384170158.db2.gz FANUPWZXQMFHHW-SFYZADRCSA-N 1 2 247.302 2.082 20 0 BEADLO c1cc(C[N@@H+]2CCOC3(CCCCC3)C2)on1 ZINC000072716869 384230063 /nfs/dbraw/zinc/23/00/63/384230063.db2.gz KVPAFXYKVZKNSB-UHFFFAOYSA-N 1 2 236.315 2.210 20 0 BEADLO c1cc(C[N@H+]2CCOC3(CCCCC3)C2)on1 ZINC000072716869 384230069 /nfs/dbraw/zinc/23/00/69/384230069.db2.gz KVPAFXYKVZKNSB-UHFFFAOYSA-N 1 2 236.315 2.210 20 0 BEADLO C[C@@H]1OCC[N@H+](Cc2cccc3c2OCO3)[C@H]1C ZINC000093417972 384236174 /nfs/dbraw/zinc/23/61/74/384236174.db2.gz RQZBXNASQJACQK-QWRGUYRKSA-N 1 2 249.310 2.025 20 0 BEADLO C[C@@H]1OCC[N@@H+](Cc2cccc3c2OCO3)[C@H]1C ZINC000093417972 384236181 /nfs/dbraw/zinc/23/61/81/384236181.db2.gz RQZBXNASQJACQK-QWRGUYRKSA-N 1 2 249.310 2.025 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1ccc(C(C)C)nc1 ZINC001645131481 1172636008 /nfs/dbraw/zinc/63/60/08/1172636008.db2.gz GKJSWQSJNNARPH-ZDUSSCGKSA-N 1 2 247.342 2.238 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1ccc(C(C)C)nc1 ZINC001645131481 1172636010 /nfs/dbraw/zinc/63/60/10/1172636010.db2.gz GKJSWQSJNNARPH-ZDUSSCGKSA-N 1 2 247.342 2.238 20 0 BEADLO C/C(Cl)=C/C[NH2+][C@H](C)c1nc(C)no1 ZINC000528446538 384240903 /nfs/dbraw/zinc/24/09/03/384240903.db2.gz ATRISZOCLKTIBQ-FXXDRWHHSA-N 1 2 215.684 2.171 20 0 BEADLO CCCc1nc(Cn2cc[nH+]c2)cs1 ZINC000082615258 384250964 /nfs/dbraw/zinc/25/09/64/384250964.db2.gz ZOSNBNILQNXQMC-UHFFFAOYSA-N 1 2 207.302 2.340 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)c(C)[nH+]1 ZINC000119354726 384260135 /nfs/dbraw/zinc/26/01/35/384260135.db2.gz WBZLITRSUZYCIO-WZRBSPASSA-N 1 2 246.310 2.204 20 0 BEADLO Cn1cnnc1[C@H]1CCC[N@@H+]1Cc1cccs1 ZINC000093809774 384272834 /nfs/dbraw/zinc/27/28/34/384272834.db2.gz MONYVHZRGRSKFV-LLVKDONJSA-N 1 2 248.355 2.214 20 0 BEADLO Cn1cnnc1[C@H]1CCC[N@H+]1Cc1cccs1 ZINC000093809774 384272848 /nfs/dbraw/zinc/27/28/48/384272848.db2.gz MONYVHZRGRSKFV-LLVKDONJSA-N 1 2 248.355 2.214 20 0 BEADLO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1cnc[nH]1 ZINC000093845421 384276133 /nfs/dbraw/zinc/27/61/33/384276133.db2.gz SYIIGPYWRMHAME-CQSZACIVSA-N 1 2 244.342 2.475 20 0 BEADLO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1cnc[nH]1 ZINC000093845421 384276139 /nfs/dbraw/zinc/27/61/39/384276139.db2.gz SYIIGPYWRMHAME-CQSZACIVSA-N 1 2 244.342 2.475 20 0 BEADLO C[C@@H]1C[C@H](Nc2ccc3ccccc3[nH+]2)CO1 ZINC000335436830 384278505 /nfs/dbraw/zinc/27/85/05/384278505.db2.gz CVNXSPYNAOMRPO-PWSUYJOCSA-N 1 2 228.295 2.246 20 0 BEADLO CSC[C@@H]1CCCN1c1cc[nH+]c(C)n1 ZINC000133323093 384285938 /nfs/dbraw/zinc/28/59/38/384285938.db2.gz JBEKVMSRDIJVLW-JTQLQIEISA-N 1 2 223.345 2.117 20 0 BEADLO COc1cc([C@@H](C)[NH2+][C@H](C)c2ccon2)ccn1 ZINC000569589977 384290187 /nfs/dbraw/zinc/29/01/87/384290187.db2.gz DDADDJZVADTHAM-NXEZZACHSA-N 1 2 247.298 2.490 20 0 BEADLO CCCc1nc(C[N@H+](C)C2CCC2)no1 ZINC000075841120 384341956 /nfs/dbraw/zinc/34/19/56/384341956.db2.gz PNWKFSVRIJKFMD-UHFFFAOYSA-N 1 2 209.293 2.006 20 0 BEADLO CCCc1nc(C[N@@H+](C)C2CCC2)no1 ZINC000075841120 384341961 /nfs/dbraw/zinc/34/19/61/384341961.db2.gz PNWKFSVRIJKFMD-UHFFFAOYSA-N 1 2 209.293 2.006 20 0 BEADLO COCc1cnc(C[NH+]2CC(C3CC3)C2)s1 ZINC000643345222 384375032 /nfs/dbraw/zinc/37/50/32/384375032.db2.gz JMAIOMLOWKDNAF-UHFFFAOYSA-N 1 2 238.356 2.131 20 0 BEADLO CCC[C@H]([NH2+][C@@H]1C[C@H]1CC)C(=O)OCC ZINC000300376331 384359552 /nfs/dbraw/zinc/35/95/52/384359552.db2.gz DTIRMBCFMJCAEE-OUAUKWLOSA-N 1 2 213.321 2.106 20 0 BEADLO Cc1csc(C(=O)Nc2cc[nH+]c(C)c2)c1 ZINC000334165120 384371962 /nfs/dbraw/zinc/37/19/62/384371962.db2.gz AINIEZVTAQUHLN-UHFFFAOYSA-N 1 2 232.308 2.434 20 0 BEADLO CC[N@@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000143483746 384323536 /nfs/dbraw/zinc/32/35/36/384323536.db2.gz LYUVEEPASYTAOU-GFCCVEGCSA-N 1 2 227.254 2.358 20 0 BEADLO CC[N@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000143483746 384323543 /nfs/dbraw/zinc/32/35/43/384323543.db2.gz LYUVEEPASYTAOU-GFCCVEGCSA-N 1 2 227.254 2.358 20 0 BEADLO CC[C@@H]([NH2+]CCc1ccccc1C)C(=O)OC ZINC000134978100 384404422 /nfs/dbraw/zinc/40/44/22/384404422.db2.gz FYIKNTJJKJDPFY-CYBMUJFWSA-N 1 2 235.327 2.079 20 0 BEADLO CC[C@H]1C[N@H+](Cc2nccs2)CCS1 ZINC000135110812 384416164 /nfs/dbraw/zinc/41/61/64/384416164.db2.gz QQMZMFDOOFCMCM-VIFPVBQESA-N 1 2 228.386 2.471 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2nccs2)CCS1 ZINC000135110812 384416168 /nfs/dbraw/zinc/41/61/68/384416168.db2.gz QQMZMFDOOFCMCM-VIFPVBQESA-N 1 2 228.386 2.471 20 0 BEADLO CCCCc1cc(N[C@H]2CC[C@@H](CO)C2)nc[nH+]1 ZINC000631290371 384417239 /nfs/dbraw/zinc/41/72/39/384417239.db2.gz GNJVVDFLFUZNKF-YPMHNXCESA-N 1 2 249.358 2.392 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2ncn(C)n2)cc1C ZINC000275844127 384420368 /nfs/dbraw/zinc/42/03/68/384420368.db2.gz QLVJYPJRBDKMFP-GFCCVEGCSA-N 1 2 244.342 2.283 20 0 BEADLO CO[C@@H]1CCC[C@H]1Nc1cc(NC2CC2)[nH+]cn1 ZINC000560833612 384376326 /nfs/dbraw/zinc/37/63/26/384376326.db2.gz TZSMAMBYPJIOOJ-GHMZBOCLSA-N 1 2 248.330 2.030 20 0 BEADLO CO[C@@H]1CCC[C@H]1Nc1cc(NC2CC2)nc[nH+]1 ZINC000560833612 384376330 /nfs/dbraw/zinc/37/63/30/384376330.db2.gz TZSMAMBYPJIOOJ-GHMZBOCLSA-N 1 2 248.330 2.030 20 0 BEADLO Cc1cnc(C[NH2+][C@H]2C[C@@H](C)n3ccnc32)s1 ZINC000334200574 384384587 /nfs/dbraw/zinc/38/45/87/384384587.db2.gz NIEUWSDQKXURJH-SCZZXKLOSA-N 1 2 248.355 2.444 20 0 BEADLO Cc1cc(C)c(NC(=O)[C@@H]2CCCO2)c(C)[nH+]1 ZINC000097213751 384444834 /nfs/dbraw/zinc/44/48/34/384444834.db2.gz OQIVASZCKCQKLZ-NSHDSACASA-N 1 2 234.299 2.124 20 0 BEADLO CCOc1ccc(NCc2c[nH+]cn2C)cc1 ZINC000078469768 384447823 /nfs/dbraw/zinc/44/78/23/384447823.db2.gz CEDXCVBZKZJXSI-UHFFFAOYSA-N 1 2 231.299 2.431 20 0 BEADLO CC[C@H]([NH2+]Cc1ncccc1F)c1ccn(C)n1 ZINC000530524269 384450212 /nfs/dbraw/zinc/45/02/12/384450212.db2.gz GQOLFVCCNCPKJB-NSHDSACASA-N 1 2 248.305 2.195 20 0 BEADLO Cc1cc(C[NH+]2CCOCC2)ccc1Cl ZINC000147701763 384453904 /nfs/dbraw/zinc/45/39/04/384453904.db2.gz GNJRBLDZMCGXMY-UHFFFAOYSA-N 1 2 225.719 2.481 20 0 BEADLO Cc1cc(NC(=O)CCc2ccccn2)cc[nH+]1 ZINC000068844049 384457842 /nfs/dbraw/zinc/45/78/42/384457842.db2.gz WZQWNEZLOGWEEX-UHFFFAOYSA-N 1 2 241.294 2.356 20 0 BEADLO CC(C)(C)c1noc(C[NH+]2C3CCC2CC3)n1 ZINC000521382944 384434768 /nfs/dbraw/zinc/43/47/68/384434768.db2.gz VJODRHMJTAFRSV-UHFFFAOYSA-N 1 2 235.331 2.494 20 0 BEADLO C[C@H]([NH2+]Cc1ccn[nH]1)c1ccccc1 ZINC000036899942 384462426 /nfs/dbraw/zinc/46/24/26/384462426.db2.gz LIVPKLVKSZBITR-JTQLQIEISA-N 1 2 201.273 2.261 20 0 BEADLO O=C(CC1CCCCCC1)NCc1[nH]cc[nH+]1 ZINC000135811188 384463925 /nfs/dbraw/zinc/46/39/25/384463925.db2.gz ORGCQCQCNWUHGL-UHFFFAOYSA-N 1 2 235.331 2.386 20 0 BEADLO C[C@H](CCO)Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000122296487 384471517 /nfs/dbraw/zinc/47/15/17/384471517.db2.gz HOETXCFKGBPPFE-SSDOTTSWSA-N 1 2 234.221 2.283 20 0 BEADLO COc1ccccc1[C@H](C)[NH2+]Cc1ncccn1 ZINC000149216853 384477271 /nfs/dbraw/zinc/47/72/71/384477271.db2.gz VTSPMHGKIFIDBN-NSHDSACASA-N 1 2 243.310 2.336 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)NC2(C)CCC2)c2[nH+]ccn21 ZINC000556769591 384477629 /nfs/dbraw/zinc/47/76/29/384477629.db2.gz QFZIHORETQHKJW-VHSXEESVSA-N 1 2 248.330 2.131 20 0 BEADLO C[C@@H](CCO)Nc1ccc2ccccc2[nH+]1 ZINC000096867094 384482969 /nfs/dbraw/zinc/48/29/69/384482969.db2.gz RRGZUSITLAXEEX-JTQLQIEISA-N 1 2 216.284 2.418 20 0 BEADLO CC[C@@]1(C)C[N@H+](Cc2csc(C)n2)CCO1 ZINC000135656792 384458695 /nfs/dbraw/zinc/45/86/95/384458695.db2.gz UESFEGZEMFTUAN-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO CC[C@@]1(C)C[N@@H+](Cc2csc(C)n2)CCO1 ZINC000135656792 384458698 /nfs/dbraw/zinc/45/86/98/384458698.db2.gz UESFEGZEMFTUAN-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO C[C@H]1CC(C)(C)CC[C@@H]1NC(=O)Cn1cc[nH+]c1 ZINC000517793644 384509372 /nfs/dbraw/zinc/50/93/72/384509372.db2.gz JFNXMCPIFQMPMK-RYUDHWBXSA-N 1 2 249.358 2.214 20 0 BEADLO Cn1c(C[NH2+]Cc2ccoc2)nc2ccccc21 ZINC000066989030 384516179 /nfs/dbraw/zinc/51/61/79/384516179.db2.gz QBDNWALROVZGEU-UHFFFAOYSA-N 1 2 241.294 2.456 20 0 BEADLO COC(=O)[C@H]([NH2+][C@H](C)C1CC1)c1ccccc1 ZINC000049538325 384544050 /nfs/dbraw/zinc/54/40/50/384544050.db2.gz OXOLIYDJOFTEJX-ZWNOBZJWSA-N 1 2 233.311 2.289 20 0 BEADLO CCO[C@@H](C)c1nc(Cn2cc[nH+]c2)cs1 ZINC000076717741 384552739 /nfs/dbraw/zinc/55/27/39/384552739.db2.gz IDTRXKXRJBYCSG-VIFPVBQESA-N 1 2 237.328 2.485 20 0 BEADLO Cc1ccc(C[NH2+]Cc2ccc(F)cn2)o1 ZINC000309712707 384553345 /nfs/dbraw/zinc/55/33/45/384553345.db2.gz RHJWBPWAZDOQFM-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO CC[C@@H](CC(F)(F)F)[NH2+][C@@H](CC)C(=O)OC ZINC000309713875 384556968 /nfs/dbraw/zinc/55/69/68/384556968.db2.gz RXZANDMCPBAYPD-YUMQZZPRSA-N 1 2 241.253 2.259 20 0 BEADLO Cc1ccc(C[NH+]2CCC(=O)CC2)cc1C ZINC000049668758 384557027 /nfs/dbraw/zinc/55/70/27/384557027.db2.gz KXPWUAPXRYLINQ-UHFFFAOYSA-N 1 2 217.312 2.468 20 0 BEADLO CC[N@H+](Cc1nnc(C(C)C)o1)C1CC1 ZINC000171144241 384558373 /nfs/dbraw/zinc/55/83/73/384558373.db2.gz PGYZXDYDGWDJHW-UHFFFAOYSA-N 1 2 209.293 2.177 20 0 BEADLO CC[N@@H+](Cc1nnc(C(C)C)o1)C1CC1 ZINC000171144241 384558380 /nfs/dbraw/zinc/55/83/80/384558380.db2.gz PGYZXDYDGWDJHW-UHFFFAOYSA-N 1 2 209.293 2.177 20 0 BEADLO CCOc1cc(NCc2[nH]cc[nH+]2)ccc1OC ZINC000049715268 384561285 /nfs/dbraw/zinc/56/12/85/384561285.db2.gz BYBNEKIUMBVREY-UHFFFAOYSA-N 1 2 247.298 2.429 20 0 BEADLO COC[C@H]([NH2+]Cc1ccco1)c1ccco1 ZINC000080239039 384540065 /nfs/dbraw/zinc/54/00/65/384540065.db2.gz VUHJKGSMUUHLAY-NSHDSACASA-N 1 2 221.256 2.350 20 0 BEADLO CCC1(CNc2nc(C)[nH+]c(N)n2)CCCC1 ZINC000306065128 384568194 /nfs/dbraw/zinc/56/81/94/384568194.db2.gz AAESZXCZHBHNOU-UHFFFAOYSA-N 1 2 235.335 2.145 20 0 BEADLO CCC1(CNc2nc(N)nc(C)[nH+]2)CCCC1 ZINC000306065128 384568197 /nfs/dbraw/zinc/56/81/97/384568197.db2.gz AAESZXCZHBHNOU-UHFFFAOYSA-N 1 2 235.335 2.145 20 0 BEADLO CC[N@H+](CCC(=O)OC)C/C(Cl)=C/Cl ZINC000086001363 384586249 /nfs/dbraw/zinc/58/62/49/384586249.db2.gz CEMHSZJGASLYKN-VURMDHGXSA-N 1 2 240.130 2.190 20 0 BEADLO CC[N@@H+](CCC(=O)OC)C/C(Cl)=C/Cl ZINC000086001363 384586256 /nfs/dbraw/zinc/58/62/56/384586256.db2.gz CEMHSZJGASLYKN-VURMDHGXSA-N 1 2 240.130 2.190 20 0 BEADLO CCc1cc(N2CCC[C@H]2CF)nc(C)[nH+]1 ZINC000294275938 384587775 /nfs/dbraw/zinc/58/77/75/384587775.db2.gz XNAFVXXICBUNMW-NSHDSACASA-N 1 2 223.295 2.286 20 0 BEADLO Cc1c[nH+]c(CNc2ccc(Cl)cn2)n1C ZINC000309723680 384567357 /nfs/dbraw/zinc/56/73/57/384567357.db2.gz WZMZJXUBAAJUQT-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO Cc1ccncc1C[NH2+][C@H](C)c1ccon1 ZINC000309788623 384606331 /nfs/dbraw/zinc/60/63/31/384606331.db2.gz OQEVBOSJRIFJTK-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO Cc1nc(C[N@H+]2CCSC[C@H]2C)cs1 ZINC000172590778 384609165 /nfs/dbraw/zinc/60/91/65/384609165.db2.gz SDYHUAZMVOMRRA-MRVPVSSYSA-N 1 2 228.386 2.389 20 0 BEADLO Cc1nc(C[N@@H+]2CCSC[C@H]2C)cs1 ZINC000172590778 384609172 /nfs/dbraw/zinc/60/91/72/384609172.db2.gz SDYHUAZMVOMRRA-MRVPVSSYSA-N 1 2 228.386 2.389 20 0 BEADLO CC(C)C[C@@H](C)C(=O)NCCCn1cc[nH+]c1 ZINC000184641754 384631342 /nfs/dbraw/zinc/63/13/42/384631342.db2.gz BVLZYQFELNCMQL-GFCCVEGCSA-N 1 2 237.347 2.072 20 0 BEADLO C[C@H]1SCC[N@H+](Cc2cscn2)[C@H]1C ZINC000172451842 384591541 /nfs/dbraw/zinc/59/15/41/384591541.db2.gz NJCJAPUEERXHON-DTWKUNHWSA-N 1 2 228.386 2.469 20 0 BEADLO C[C@H]1SCC[N@@H+](Cc2cscn2)[C@H]1C ZINC000172451842 384591545 /nfs/dbraw/zinc/59/15/45/384591545.db2.gz NJCJAPUEERXHON-DTWKUNHWSA-N 1 2 228.386 2.469 20 0 BEADLO CCC[C@](C)([NH2+]CC=C(C)C)C(=O)OC ZINC000111247170 384594249 /nfs/dbraw/zinc/59/42/49/384594249.db2.gz XOSICARSQASFHO-LBPRGKRZSA-N 1 2 213.321 2.274 20 0 BEADLO COC(=O)[C@@H](c1ccc(F)cc1)[NH+]1CCCC1 ZINC000101543016 384677387 /nfs/dbraw/zinc/67/73/87/384677387.db2.gz GQHXTRDCXKZACJ-GFCCVEGCSA-N 1 2 237.274 2.136 20 0 BEADLO CC[C@@H](CNc1cc[nH+]c(C2CC2)n1)OC ZINC000290709825 384684395 /nfs/dbraw/zinc/68/43/95/384684395.db2.gz OFPATVTZPXDDBR-JTQLQIEISA-N 1 2 221.304 2.191 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1ccc(CC)cc1 ZINC000049801931 384689166 /nfs/dbraw/zinc/68/91/66/384689166.db2.gz YAVISWDZEPNVPW-UHFFFAOYSA-N 1 2 235.327 2.244 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1ccc(CC)cc1 ZINC000049801931 384689175 /nfs/dbraw/zinc/68/91/75/384689175.db2.gz YAVISWDZEPNVPW-UHFFFAOYSA-N 1 2 235.327 2.244 20 0 BEADLO Cc1[nH+]cccc1N[C@@H]1COC(C)(C)C1 ZINC000335359478 384693367 /nfs/dbraw/zinc/69/33/67/384693367.db2.gz QZDTULWLNHVUJB-JTQLQIEISA-N 1 2 206.289 2.369 20 0 BEADLO COc1ccccc1C1([NH2+]Cc2cocn2)CC1 ZINC000647233005 384705501 /nfs/dbraw/zinc/70/55/01/384705501.db2.gz NMTOJMNMLIDTJU-UHFFFAOYSA-N 1 2 244.294 2.462 20 0 BEADLO CC[C@H]([NH2+]Cc1ccoc1)c1ccn(C)n1 ZINC000310001500 384777991 /nfs/dbraw/zinc/77/79/91/384777991.db2.gz FBQDZUXWQSPRCW-NSHDSACASA-N 1 2 219.288 2.254 20 0 BEADLO CCS[C@H]1CCC[C@@H]1[NH2+]Cc1noc(C)n1 ZINC000300380093 384733794 /nfs/dbraw/zinc/73/37/94/384733794.db2.gz CRZIVBQCEUVDCM-UWVGGRQHSA-N 1 2 241.360 2.142 20 0 BEADLO Cc1csc([C@H](C)[NH2+][C@@H]2CCn3ccnc32)n1 ZINC000335953145 384736197 /nfs/dbraw/zinc/73/61/97/384736197.db2.gz WMLMSVJHBMPZJF-VHSXEESVSA-N 1 2 248.355 2.444 20 0 BEADLO Cc1csc([C@H](C)N[C@@H]2CCn3cc[nH+]c32)n1 ZINC000335953145 384736202 /nfs/dbraw/zinc/73/62/02/384736202.db2.gz WMLMSVJHBMPZJF-VHSXEESVSA-N 1 2 248.355 2.444 20 0 BEADLO Cc1ccc(NCc2cc[nH]n2)c(C)[nH+]1 ZINC000087151745 384742398 /nfs/dbraw/zinc/74/23/98/384742398.db2.gz KBYSICSOBHTBGI-UHFFFAOYSA-N 1 2 202.261 2.034 20 0 BEADLO CSc1ccc(N[C@@H]2CO[C@H](C)C2)[nH+]c1 ZINC000647193505 384755178 /nfs/dbraw/zinc/75/51/78/384755178.db2.gz CYAPURHCHYEPGM-BDAKNGLRSA-N 1 2 224.329 2.393 20 0 BEADLO Cc1ccsc1C[NH2+]Cc1csnn1 ZINC000087308525 384763948 /nfs/dbraw/zinc/76/39/48/384763948.db2.gz JYWIGFLEFOMOEL-UHFFFAOYSA-N 1 2 225.342 2.198 20 0 BEADLO CC(C)[C@H](C)C(=O)N(C)c1ccc[nH+]c1N(C)C ZINC000176785572 384770873 /nfs/dbraw/zinc/77/08/73/384770873.db2.gz BBBOGJQQKRCTER-NSHDSACASA-N 1 2 249.358 2.403 20 0 BEADLO Cn1c[nH+]cc1CSc1cccc(O)c1 ZINC000127007494 384829238 /nfs/dbraw/zinc/82/92/38/384829238.db2.gz PNCXOIJSLOIVDL-UHFFFAOYSA-N 1 2 220.297 2.418 20 0 BEADLO CCC(CC)NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000518192474 384782849 /nfs/dbraw/zinc/78/28/49/384782849.db2.gz KTDYJWLHQNOCLD-SNVBAGLBSA-N 1 2 223.320 2.139 20 0 BEADLO CC(C)C(=O)NCCCCNc1cccc[nH+]1 ZINC000104002678 384789891 /nfs/dbraw/zinc/78/98/91/384789891.db2.gz WEBADNZXVUNUDY-UHFFFAOYSA-N 1 2 235.331 2.046 20 0 BEADLO CCCCN(C)C(=O)[C@H]1CCn2cc(C)[nH+]c2C1 ZINC000623728055 384801603 /nfs/dbraw/zinc/80/16/03/384801603.db2.gz XHNWSSARPJESGN-LBPRGKRZSA-N 1 2 249.358 2.012 20 0 BEADLO Cc1csc([C@@H]([NH2+]Cc2ncc[nH]2)C2CC2)n1 ZINC000174541954 384806525 /nfs/dbraw/zinc/80/65/25/384806525.db2.gz UPMPJFDUAHYSKZ-NSHDSACASA-N 1 2 248.355 2.416 20 0 BEADLO Cc1csc([C@@H](NCc2[nH]cc[nH+]2)C2CC2)n1 ZINC000174541954 384806529 /nfs/dbraw/zinc/80/65/29/384806529.db2.gz UPMPJFDUAHYSKZ-NSHDSACASA-N 1 2 248.355 2.416 20 0 BEADLO C[C@H](CNc1cccc[nH+]1)Cn1cccn1 ZINC000301290880 384871545 /nfs/dbraw/zinc/87/15/45/384871545.db2.gz WOWZXZJMLAKIHJ-LLVKDONJSA-N 1 2 216.288 2.026 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ccncc1)c1csnn1 ZINC000398286493 384886626 /nfs/dbraw/zinc/88/66/26/384886626.db2.gz NMBGTUOLOJLHGI-IUCAKERBSA-N 1 2 234.328 2.345 20 0 BEADLO CC(C)n1cc(C[NH2+][C@@H](C)c2cccnc2)nn1 ZINC000289616452 384887285 /nfs/dbraw/zinc/88/72/85/384887285.db2.gz FKSIKMRHYBAOCA-NSHDSACASA-N 1 2 245.330 2.105 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1CCO[C@H]([C@@H]2CCCO2)C1 ZINC000528407735 384838545 /nfs/dbraw/zinc/83/85/45/384838545.db2.gz WZVPJTUECMZBHA-UWMOLUOFSA-N 1 2 245.750 2.009 20 0 BEADLO C/C(Cl)=C/C[N@H+]1CCO[C@H]([C@@H]2CCCO2)C1 ZINC000528407735 384838554 /nfs/dbraw/zinc/83/85/54/384838554.db2.gz WZVPJTUECMZBHA-UWMOLUOFSA-N 1 2 245.750 2.009 20 0 BEADLO COCc1ccc(C[NH+]2C[C@H](C)O[C@@H](C)C2)o1 ZINC000126967362 384850041 /nfs/dbraw/zinc/85/00/41/384850041.db2.gz ZGWGPJCCLIINCT-QWRGUYRKSA-N 1 2 239.315 2.035 20 0 BEADLO Cc1cnnn1-c1ccc([NH2+]CC2CC2)cc1 ZINC000647237663 384858554 /nfs/dbraw/zinc/85/85/54/384858554.db2.gz LSTLSLDYEXCADT-UHFFFAOYSA-N 1 2 228.299 2.398 20 0 BEADLO CCc1[nH]c(CNC(=O)C[C@H](C)C2CC2)c[nH+]1 ZINC001645212790 1172643008 /nfs/dbraw/zinc/64/30/08/1172643008.db2.gz LDIDYESZIIXIGY-VIFPVBQESA-N 1 2 235.331 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)C[C@H](C)C2CC2)[nH+]1 ZINC001645212790 1172643009 /nfs/dbraw/zinc/64/30/09/1172643009.db2.gz LDIDYESZIIXIGY-VIFPVBQESA-N 1 2 235.331 2.025 20 0 BEADLO Cc1nc(C[N@H+](C)CCc2ccc(F)cc2)no1 ZINC000055023855 384865252 /nfs/dbraw/zinc/86/52/52/384865252.db2.gz XVSKDRJDSYXBRF-UHFFFAOYSA-N 1 2 249.289 2.192 20 0 BEADLO Cc1nc(C[N@@H+](C)CCc2ccc(F)cc2)no1 ZINC000055023855 384865264 /nfs/dbraw/zinc/86/52/64/384865264.db2.gz XVSKDRJDSYXBRF-UHFFFAOYSA-N 1 2 249.289 2.192 20 0 BEADLO Cc1csc(C[NH2+][C@@H]2C[C@@H](C)n3ccnc32)n1 ZINC000294134562 384956156 /nfs/dbraw/zinc/95/61/56/384956156.db2.gz OWRJVXGCPQUGFP-NXEZZACHSA-N 1 2 248.355 2.444 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1cnc(C)s1 ZINC000115571748 384956790 /nfs/dbraw/zinc/95/67/90/384956790.db2.gz FTWSIPZGVMEOMB-JTQLQIEISA-N 1 2 226.345 2.062 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1cnc(C)s1 ZINC000115571748 384956794 /nfs/dbraw/zinc/95/67/94/384956794.db2.gz FTWSIPZGVMEOMB-JTQLQIEISA-N 1 2 226.345 2.062 20 0 BEADLO Nc1[nH+]cnc(N[C@@H]2CCC[C@@H]2F)c1Cl ZINC000338841903 384957453 /nfs/dbraw/zinc/95/74/53/384957453.db2.gz IJVMABAKBVQCBC-NTSWFWBYSA-N 1 2 230.674 2.015 20 0 BEADLO Nc1nc[nH+]c(N[C@@H]2CCC[C@@H]2F)c1Cl ZINC000338841903 384957462 /nfs/dbraw/zinc/95/74/62/384957462.db2.gz IJVMABAKBVQCBC-NTSWFWBYSA-N 1 2 230.674 2.015 20 0 BEADLO Cc1nc(C(C)(C)[NH2+]Cc2ccncc2C)no1 ZINC000528415361 384896259 /nfs/dbraw/zinc/89/62/59/384896259.db2.gz TVXAUDDHFXRDEY-UHFFFAOYSA-N 1 2 246.314 2.106 20 0 BEADLO CN(Cc1ccsc1)Cc1[nH+]ccn1C ZINC000057621906 384959059 /nfs/dbraw/zinc/95/90/59/384959059.db2.gz WBOWFOWVRUGKSS-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO Cc1nc(C)c(C[N@@H+](C)Cc2cnccn2)s1 ZINC000177235481 384923931 /nfs/dbraw/zinc/92/39/31/384923931.db2.gz BBOWVLIDRJCSJS-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO Cc1nc(C)c(C[N@H+](C)Cc2cnccn2)s1 ZINC000177235481 384923935 /nfs/dbraw/zinc/92/39/35/384923935.db2.gz BBOWVLIDRJCSJS-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2ccoc2)on1 ZINC000087290103 384935965 /nfs/dbraw/zinc/93/59/65/384935965.db2.gz MINPQZVMWRQNDX-SECBINFHSA-N 1 2 206.245 2.427 20 0 BEADLO COC(=O)[C@@H](c1cccnc1)[NH+]1CCC(C)CC1 ZINC000127709990 384938656 /nfs/dbraw/zinc/93/86/56/384938656.db2.gz SWGFXTGGBIHVRM-CYBMUJFWSA-N 1 2 248.326 2.028 20 0 BEADLO Cn1cc(C[NH2+]CC(F)F)c(C(C)(C)C)n1 ZINC000127938626 384968678 /nfs/dbraw/zinc/96/86/78/384968678.db2.gz OVDOHOPCCWPWIV-UHFFFAOYSA-N 1 2 231.290 2.072 20 0 BEADLO CC(C)n1ccc(C[NH2+]Cc2ccns2)n1 ZINC000404317510 384968598 /nfs/dbraw/zinc/96/85/98/384968598.db2.gz PFGHTZIPHHGFRB-UHFFFAOYSA-N 1 2 236.344 2.210 20 0 BEADLO CO[C@H]1CC[N@H+](Cc2cnc(Cl)s2)C1 ZINC000234904654 384970749 /nfs/dbraw/zinc/97/07/49/384970749.db2.gz CHPPGGOSKJXWSJ-ZETCQYMHSA-N 1 2 232.736 2.017 20 0 BEADLO CO[C@H]1CC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC000234904654 384970754 /nfs/dbraw/zinc/97/07/54/384970754.db2.gz CHPPGGOSKJXWSJ-ZETCQYMHSA-N 1 2 232.736 2.017 20 0 BEADLO Cc1cc(C[NH2+][C@H]2C[C@@H](C)n3ccnc32)sn1 ZINC000404342571 384974336 /nfs/dbraw/zinc/97/43/36/384974336.db2.gz FQSALBCXLYVJRR-KOLCDFICSA-N 1 2 248.355 2.444 20 0 BEADLO C[C@@H]1C[N@H+](C/C(Cl)=C/Cl)CC[C@@H]1O ZINC000164609307 384980430 /nfs/dbraw/zinc/98/04/30/384980430.db2.gz MTEACHRVVGCXFZ-KSVRDVHTSA-N 1 2 224.131 2.008 20 0 BEADLO C[C@@H]1C[N@@H+](C/C(Cl)=C/Cl)CC[C@@H]1O ZINC000164609307 384980435 /nfs/dbraw/zinc/98/04/35/384980435.db2.gz MTEACHRVVGCXFZ-KSVRDVHTSA-N 1 2 224.131 2.008 20 0 BEADLO Cc1ccccc1[C@@H](CO)Nc1cc[nH+]c(C)n1 ZINC000530618012 384989119 /nfs/dbraw/zinc/98/91/19/384989119.db2.gz SFGLZXBWHBYHNZ-CYBMUJFWSA-N 1 2 243.310 2.239 20 0 BEADLO Cc1nnc([C@H](C)[N@H+](C)Cc2cccc(O)c2)o1 ZINC000530662669 385007076 /nfs/dbraw/zinc/00/70/76/385007076.db2.gz CSUUZUBFRDUMBL-VIFPVBQESA-N 1 2 247.298 2.277 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+](C)Cc2cccc(O)c2)o1 ZINC000530662669 385007082 /nfs/dbraw/zinc/00/70/82/385007082.db2.gz CSUUZUBFRDUMBL-VIFPVBQESA-N 1 2 247.298 2.277 20 0 BEADLO c1sc([C@@H]2COCC[NH2+]2)nc1C1CCCC1 ZINC000226468541 385016179 /nfs/dbraw/zinc/01/61/79/385016179.db2.gz WDWYOQXJPMIAQF-JTQLQIEISA-N 1 2 238.356 2.462 20 0 BEADLO COc1cc(C[NH2+][C@@H](C)c2nccs2)ccn1 ZINC000086510392 385024941 /nfs/dbraw/zinc/02/49/41/385024941.db2.gz XAPRBXRBNSEGQF-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO O=C(C1=CCCC1)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000335679848 385032587 /nfs/dbraw/zinc/03/25/87/385032587.db2.gz SRQNUPNLWZSYDK-UHFFFAOYSA-N 1 2 245.326 2.226 20 0 BEADLO O=C(C1=CCCC1)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000335679848 385032594 /nfs/dbraw/zinc/03/25/94/385032594.db2.gz SRQNUPNLWZSYDK-UHFFFAOYSA-N 1 2 245.326 2.226 20 0 BEADLO Cc1ccc(NC(=O)CC[C@H]2CCOC2)c(C)[nH+]1 ZINC000176185102 385033249 /nfs/dbraw/zinc/03/32/49/385033249.db2.gz TZIUQEABBBZAGD-LBPRGKRZSA-N 1 2 248.326 2.454 20 0 BEADLO Cc1ccc(NC(=O)C2=COCCC2)c(C)[nH+]1 ZINC000176203054 385035822 /nfs/dbraw/zinc/03/58/22/385035822.db2.gz BFZAKZUZXMNEEK-UHFFFAOYSA-N 1 2 232.283 2.331 20 0 BEADLO Cn1cc(CNc2ccc([NH+](C)C)cc2)cn1 ZINC000058946933 385036830 /nfs/dbraw/zinc/03/68/30/385036830.db2.gz HDRASCAFRNDQCX-UHFFFAOYSA-N 1 2 230.315 2.098 20 0 BEADLO CCCC[N@H+](C)[C@@H](C(=O)OC)c1cccnc1 ZINC000151397349 385108411 /nfs/dbraw/zinc/10/84/11/385108411.db2.gz OVIFXJHIRAJKMR-GFCCVEGCSA-N 1 2 236.315 2.028 20 0 BEADLO CCCC[N@@H+](C)[C@@H](C(=O)OC)c1cccnc1 ZINC000151397349 385108416 /nfs/dbraw/zinc/10/84/16/385108416.db2.gz OVIFXJHIRAJKMR-GFCCVEGCSA-N 1 2 236.315 2.028 20 0 BEADLO O=C(C1CC=CC1)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000151438474 385110395 /nfs/dbraw/zinc/11/03/95/385110395.db2.gz PRDOQETUISDCAE-GFCCVEGCSA-N 1 2 245.326 2.430 20 0 BEADLO O=C(C1CC=CC1)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000151438408 385110756 /nfs/dbraw/zinc/11/07/56/385110756.db2.gz PRDOQETUISDCAE-LBPRGKRZSA-N 1 2 245.326 2.430 20 0 BEADLO COc1ccc2c(c1)[nH+]ccc2OCCCO ZINC000127411453 385116460 /nfs/dbraw/zinc/11/64/60/385116460.db2.gz ONKGWEOQJLJZNA-UHFFFAOYSA-N 1 2 233.267 2.005 20 0 BEADLO CCCC[C@H](CC)C(=O)NCc1c[nH+]cn1C ZINC000292037173 385141947 /nfs/dbraw/zinc/14/19/47/385141947.db2.gz QQICGJWLAITVEB-NSHDSACASA-N 1 2 237.347 2.253 20 0 BEADLO Cc1c[nH+]cc(NCc2cccn2C)c1 ZINC000119560535 385127150 /nfs/dbraw/zinc/12/71/50/385127150.db2.gz VDVAHSATKMOZPR-UHFFFAOYSA-N 1 2 201.273 2.341 20 0 BEADLO C[C@@H]([NH2+][C@H]1C=CCCCCC1)c1ncn(C)n1 ZINC000294711266 385133123 /nfs/dbraw/zinc/13/31/23/385133123.db2.gz VDKZOMHBZJFHBX-NEPJUHHUSA-N 1 2 234.347 2.355 20 0 BEADLO CS[C@@H](C)CCC(=O)Nc1cc[nH+]cc1C ZINC000358409327 385133359 /nfs/dbraw/zinc/13/33/59/385133359.db2.gz SKRNKOBONQLYJJ-JTQLQIEISA-N 1 2 238.356 2.282 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2CCCO[C@H]2C)c(C)[nH+]1 ZINC000189233002 385138213 /nfs/dbraw/zinc/13/82/13/385138213.db2.gz LNTIDJRRWXDZEN-RYUDHWBXSA-N 1 2 248.326 2.452 20 0 BEADLO CCCc1nc(C)c(C[N@H+](C)Cc2cn[nH]c2)o1 ZINC000644677032 385090312 /nfs/dbraw/zinc/09/03/12/385090312.db2.gz FFRXAUQPTKGLGX-UHFFFAOYSA-N 1 2 248.330 2.291 20 0 BEADLO CCCc1nc(C)c(C[N@@H+](C)Cc2cn[nH]c2)o1 ZINC000644677032 385090316 /nfs/dbraw/zinc/09/03/16/385090316.db2.gz FFRXAUQPTKGLGX-UHFFFAOYSA-N 1 2 248.330 2.291 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CC[C@@H](C(F)F)C2)[nH]1 ZINC000644680078 385094123 /nfs/dbraw/zinc/09/41/23/385094123.db2.gz YFLANIPUBZAQIZ-MRVPVSSYSA-N 1 2 244.289 2.015 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CC[C@@H](C(F)F)C2)[nH]1 ZINC000644680078 385094130 /nfs/dbraw/zinc/09/41/30/385094130.db2.gz YFLANIPUBZAQIZ-MRVPVSSYSA-N 1 2 244.289 2.015 20 0 BEADLO C[C@H](N[C@@H](C)C(F)(F)F)c1[nH]cc[nH+]1 ZINC000287224309 385098282 /nfs/dbraw/zinc/09/82/82/385098282.db2.gz GGVMYBZYRBZHEJ-WDSKDSINSA-N 1 2 207.199 2.011 20 0 BEADLO CCCC[N@H+](C)[C@H](C(=O)OC)c1cccnc1 ZINC000151397274 385107517 /nfs/dbraw/zinc/10/75/17/385107517.db2.gz OVIFXJHIRAJKMR-LBPRGKRZSA-N 1 2 236.315 2.028 20 0 BEADLO CCCC[N@@H+](C)[C@H](C(=O)OC)c1cccnc1 ZINC000151397274 385107523 /nfs/dbraw/zinc/10/75/23/385107523.db2.gz OVIFXJHIRAJKMR-LBPRGKRZSA-N 1 2 236.315 2.028 20 0 BEADLO CC(C)=CC[N@@H+](C)[C@@H](C)C(=O)OC(C)C ZINC000129774594 385188467 /nfs/dbraw/zinc/18/84/67/385188467.db2.gz BQIPRWUKERBQCT-NSHDSACASA-N 1 2 213.321 2.225 20 0 BEADLO CC(C)=CC[N@H+](C)[C@@H](C)C(=O)OC(C)C ZINC000129774594 385188471 /nfs/dbraw/zinc/18/84/71/385188471.db2.gz BQIPRWUKERBQCT-NSHDSACASA-N 1 2 213.321 2.225 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@H]1C[C@@H](OC(C)(C)C)C1 ZINC000647248175 385190723 /nfs/dbraw/zinc/19/07/23/385190723.db2.gz CXLUUFVOPJNNBT-TXEJJXNPSA-N 1 2 237.347 2.154 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2ncc[nH]2)cc1 ZINC000109825078 385194738 /nfs/dbraw/zinc/19/47/38/385194738.db2.gz SDDJBBHFDMZSES-UHFFFAOYSA-N 1 2 231.299 2.050 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2ncc[nH]2)cc1 ZINC000109825078 385194745 /nfs/dbraw/zinc/19/47/45/385194745.db2.gz SDDJBBHFDMZSES-UHFFFAOYSA-N 1 2 231.299 2.050 20 0 BEADLO COc1ccc(CN(C)Cc2[nH]cc[nH+]2)cc1 ZINC000109825078 385194754 /nfs/dbraw/zinc/19/47/54/385194754.db2.gz SDDJBBHFDMZSES-UHFFFAOYSA-N 1 2 231.299 2.050 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2cncs2)C1 ZINC000306796776 385195642 /nfs/dbraw/zinc/19/56/42/385195642.db2.gz JXMKZNZRCFBATP-SECBINFHSA-N 1 2 200.282 2.077 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2cncs2)C1 ZINC000306796776 385195649 /nfs/dbraw/zinc/19/56/49/385195649.db2.gz JXMKZNZRCFBATP-SECBINFHSA-N 1 2 200.282 2.077 20 0 BEADLO Cc1ccc(NC(=O)Cc2cncs2)c(C)[nH+]1 ZINC000189345686 385148109 /nfs/dbraw/zinc/14/81/09/385148109.db2.gz FSBAFIHKTXTENZ-UHFFFAOYSA-N 1 2 247.323 2.336 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000648313552 385172365 /nfs/dbraw/zinc/17/23/65/385172365.db2.gz BAEGKTTUOUTSRE-MWLCHTKSSA-N 1 2 229.283 2.319 20 0 BEADLO Cc1cc(N2CCC(C)(O)CC2)nc(C2CC2)[nH+]1 ZINC000177069733 385174143 /nfs/dbraw/zinc/17/41/43/385174143.db2.gz BZYOQGNVOJTHRK-UHFFFAOYSA-N 1 2 247.342 2.014 20 0 BEADLO C[C@@H](C[C@@H]1CCCO1)Nc1cccc[nH+]1 ZINC000308834065 385201426 /nfs/dbraw/zinc/20/14/26/385201426.db2.gz HKIOVOGTHDPPII-QWRGUYRKSA-N 1 2 206.289 2.451 20 0 BEADLO O=C1OCC[C@@]12CCC[N@@H+]2Cc1ccsc1 ZINC000190038906 385207140 /nfs/dbraw/zinc/20/71/40/385207140.db2.gz RCCYZDSVHQAMGI-LBPRGKRZSA-N 1 2 237.324 2.030 20 0 BEADLO O=C1OCC[C@@]12CCC[N@H+]2Cc1ccsc1 ZINC000190038906 385207142 /nfs/dbraw/zinc/20/71/42/385207142.db2.gz RCCYZDSVHQAMGI-LBPRGKRZSA-N 1 2 237.324 2.030 20 0 BEADLO CC[C@]1(C)C[N@@H+]([C@@H](C)c2cnccn2)CCO1 ZINC000190111593 385208943 /nfs/dbraw/zinc/20/89/43/385208943.db2.gz VYLOUJBCLOCHJX-WCQYABFASA-N 1 2 235.331 2.039 20 0 BEADLO CC[C@]1(C)C[N@H+]([C@@H](C)c2cnccn2)CCO1 ZINC000190111593 385208952 /nfs/dbraw/zinc/20/89/52/385208952.db2.gz VYLOUJBCLOCHJX-WCQYABFASA-N 1 2 235.331 2.039 20 0 BEADLO O=C(Cn1cc[nH+]c1)N1CCCC12CCCCC2 ZINC000559878113 385212982 /nfs/dbraw/zinc/21/29/82/385212982.db2.gz WNXWBZYFKJUDBC-UHFFFAOYSA-N 1 2 247.342 2.208 20 0 BEADLO CCc1ccc(C[NH2+]Cc2snnc2C)o1 ZINC000291690811 385225231 /nfs/dbraw/zinc/22/52/31/385225231.db2.gz IYXMRQQUYJIYTM-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO CC(C)CC1(C(=O)NCc2c[nH+]cn2C)CCC1 ZINC000292152625 385249752 /nfs/dbraw/zinc/24/97/52/385249752.db2.gz YXHDGKNMRHMYND-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1nc(C[NH2+][C@H](CO)c2ccccc2)cs1 ZINC000062999756 385203427 /nfs/dbraw/zinc/20/34/27/385203427.db2.gz QNROREVIKDJULC-CYBMUJFWSA-N 1 2 248.351 2.275 20 0 BEADLO CO[C@H]1CCC[C@@H]1CNc1cccc[nH+]1 ZINC000308966972 385317977 /nfs/dbraw/zinc/31/79/77/385317977.db2.gz WJVKWNJGVFLOHR-MNOVXSKESA-N 1 2 206.289 2.309 20 0 BEADLO CCCCc1nc(C[N@H+](C)C[C@H](C)O)cs1 ZINC000131268897 385322189 /nfs/dbraw/zinc/32/21/89/385322189.db2.gz ICJFEQUXYWCTLI-JTQLQIEISA-N 1 2 242.388 2.298 20 0 BEADLO CCCCc1nc(C[N@@H+](C)C[C@H](C)O)cs1 ZINC000131268897 385322191 /nfs/dbraw/zinc/32/21/91/385322191.db2.gz ICJFEQUXYWCTLI-JTQLQIEISA-N 1 2 242.388 2.298 20 0 BEADLO C[C@H](CNC(=O)c1ccsc1)Cn1cc[nH+]c1 ZINC000153557489 385264895 /nfs/dbraw/zinc/26/48/95/385264895.db2.gz OUSXDNZVKAGMMS-SNVBAGLBSA-N 1 2 249.339 2.011 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2nncn2C)cc1F ZINC000110975667 385273071 /nfs/dbraw/zinc/27/30/71/385273071.db2.gz AHYGPNSCQAIBCA-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO COC(=O)[C@H]1[C@H]2CCC[C@@H]2C[N@@H+]1C/C=C/Cl ZINC000191215169 385293781 /nfs/dbraw/zinc/29/37/81/385293781.db2.gz REYZKIKEAIZFSI-DCFOIBOISA-N 1 2 243.734 2.012 20 0 BEADLO COC(=O)[C@H]1[C@H]2CCC[C@@H]2C[N@H+]1C/C=C/Cl ZINC000191215169 385293784 /nfs/dbraw/zinc/29/37/84/385293784.db2.gz REYZKIKEAIZFSI-DCFOIBOISA-N 1 2 243.734 2.012 20 0 BEADLO COC(=O)C[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1 ZINC000191354292 385298897 /nfs/dbraw/zinc/29/88/97/385298897.db2.gz IUZKEDLDHDIWRM-KGLIPLIRSA-N 1 2 247.338 2.160 20 0 BEADLO C[C@@H]1C[C@H]1c1ccc(C[NH+]2CCOCC2)o1 ZINC000154508581 385331690 /nfs/dbraw/zinc/33/16/90/385331690.db2.gz SXUPWQQWIVCMKT-ZYHUDNBSSA-N 1 2 221.300 2.235 20 0 BEADLO c1nc(N2CCCC2)cc(NCC2CCC2)[nH+]1 ZINC000192276654 385350078 /nfs/dbraw/zinc/35/00/78/385350078.db2.gz AJRVJMZBMVMRBJ-UHFFFAOYSA-N 1 2 232.331 2.289 20 0 BEADLO c1nc(NCC2CCC2)cc(N2CCCC2)[nH+]1 ZINC000192276654 385350084 /nfs/dbraw/zinc/35/00/84/385350084.db2.gz AJRVJMZBMVMRBJ-UHFFFAOYSA-N 1 2 232.331 2.289 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NCCC1CCCC1 ZINC000192550819 385360487 /nfs/dbraw/zinc/36/04/87/385360487.db2.gz ZUGSWOQIVHGKMI-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NCCC1CCCC1 ZINC000192550819 385360493 /nfs/dbraw/zinc/36/04/93/385360493.db2.gz ZUGSWOQIVHGKMI-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO CC[C@H]([NH2+][C@H](C)[C@@H]1CCOC1)C(F)(F)F ZINC000309026340 385368666 /nfs/dbraw/zinc/36/86/66/385368666.db2.gz ATPHGFRAVARJAG-HLTSFMKQSA-N 1 2 225.254 2.342 20 0 BEADLO COC(=O)C[N@H+](C)Cc1ccc(F)c(Cl)c1 ZINC000179393994 385374537 /nfs/dbraw/zinc/37/45/37/385374537.db2.gz KAAYMSXORJDYGA-UHFFFAOYSA-N 1 2 245.681 2.084 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1ccc(F)c(Cl)c1 ZINC000179393994 385374542 /nfs/dbraw/zinc/37/45/42/385374542.db2.gz KAAYMSXORJDYGA-UHFFFAOYSA-N 1 2 245.681 2.084 20 0 BEADLO COC(=O)C1([NH2+][C@H]2C=CCCC2)CCCC1 ZINC000179527323 385377465 /nfs/dbraw/zinc/37/74/65/385377465.db2.gz NDSJEHNXXZNGGN-NSHDSACASA-N 1 2 223.316 2.171 20 0 BEADLO CSCC[NH2+][C@@H](C(=O)OC(C)(C)C)C(C)C ZINC000180048200 385382563 /nfs/dbraw/zinc/38/25/63/385382563.db2.gz FTLPCYGRGFZBNR-SNVBAGLBSA-N 1 2 247.404 2.305 20 0 BEADLO C[C@H](CF)[NH2+]Cc1ncc(Cl)s1 ZINC000308004578 385391057 /nfs/dbraw/zinc/39/10/57/385391057.db2.gz CRHAXQDRZXXJIS-RXMQYKEDSA-N 1 2 208.689 2.244 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N[C@@H]1CC=CCC1 ZINC000492529920 385394929 /nfs/dbraw/zinc/39/49/29/385394929.db2.gz HGIHJBGWUOECNU-IDVQTMNDSA-N 1 2 245.326 2.141 20 0 BEADLO Cn1c[nH+]cc1CCC(=O)N[C@H]1CCCC1(C)C ZINC000193459190 385398109 /nfs/dbraw/zinc/39/81/09/385398109.db2.gz HOTVTYRILTWKSQ-LBPRGKRZSA-N 1 2 249.358 2.048 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[NH2+][C@@H](C)CSC ZINC000180999567 385400292 /nfs/dbraw/zinc/40/02/92/385400292.db2.gz HNZWQJBYVINFBH-QWRGUYRKSA-N 1 2 247.404 2.305 20 0 BEADLO CC[N@@H+](Cc1nsc(N(C)C)n1)CC(C)C ZINC000156088420 385436339 /nfs/dbraw/zinc/43/63/39/385436339.db2.gz ZXHJZWYRODLFOJ-UHFFFAOYSA-N 1 2 242.392 2.082 20 0 BEADLO CC[N@H+](Cc1nsc(N(C)C)n1)CC(C)C ZINC000156088420 385436345 /nfs/dbraw/zinc/43/63/45/385436345.db2.gz ZXHJZWYRODLFOJ-UHFFFAOYSA-N 1 2 242.392 2.082 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CCO[C@H](C3CC3)C2)cn1 ZINC000364496430 385472955 /nfs/dbraw/zinc/47/29/55/385472955.db2.gz SPGYNWMWGRCNHN-AWEZNQCLSA-N 1 2 249.358 2.075 20 0 BEADLO CC(C)n1cc(C[N@H+]2CCO[C@H](C3CC3)C2)cn1 ZINC000364496430 385472960 /nfs/dbraw/zinc/47/29/60/385472960.db2.gz SPGYNWMWGRCNHN-AWEZNQCLSA-N 1 2 249.358 2.075 20 0 BEADLO CC[C@H](O)COc1ccc(-n2cc[nH+]c2)cc1 ZINC000156977470 385477501 /nfs/dbraw/zinc/47/75/01/385477501.db2.gz JXZRQOPFXVRCBH-LBPRGKRZSA-N 1 2 232.283 2.022 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@@H]1c1cccn1C ZINC000179710135 385486151 /nfs/dbraw/zinc/48/61/51/385486151.db2.gz NBYXPECUUBJOBT-CQSZACIVSA-N 1 2 244.342 2.394 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@@H]1c1cccn1C ZINC000179710135 385486155 /nfs/dbraw/zinc/48/61/55/385486155.db2.gz NBYXPECUUBJOBT-CQSZACIVSA-N 1 2 244.342 2.394 20 0 BEADLO COc1ccc(C[NH2+]CC(C)(F)F)cc1 ZINC000378672676 385461292 /nfs/dbraw/zinc/46/12/92/385461292.db2.gz LOOCCYATWLAREW-UHFFFAOYSA-N 1 2 215.243 2.440 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@H](C)C2)o1 ZINC000179863586 385495207 /nfs/dbraw/zinc/49/52/07/385495207.db2.gz ZRFDHELVCABOSO-SNVBAGLBSA-N 1 2 209.289 2.063 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@H](C)C2)o1 ZINC000179863586 385495209 /nfs/dbraw/zinc/49/52/09/385495209.db2.gz ZRFDHELVCABOSO-SNVBAGLBSA-N 1 2 209.289 2.063 20 0 BEADLO CC[C@H]1CN(C(=O)Nc2cc[nH+]cc2C)CCO1 ZINC000179874903 385495990 /nfs/dbraw/zinc/49/59/90/385495990.db2.gz QBSLCIOYGAANHD-NSHDSACASA-N 1 2 249.314 2.033 20 0 BEADLO Cn1nccc1C[N@@H+]1CCc2sccc2C1 ZINC000179887985 385498717 /nfs/dbraw/zinc/49/87/17/385498717.db2.gz NCPYKWWTDSRQIK-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO Cn1nccc1C[N@H+]1CCc2sccc2C1 ZINC000179887985 385498721 /nfs/dbraw/zinc/49/87/21/385498721.db2.gz NCPYKWWTDSRQIK-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO COCCC1CC[NH+](CC(F)F)CC1 ZINC000528574005 385498806 /nfs/dbraw/zinc/49/88/06/385498806.db2.gz NNSBMTPLPOBRQK-UHFFFAOYSA-N 1 2 207.264 2.000 20 0 BEADLO Cc1cc(N2CCC(C3CC3)CC2)nc[nH+]1 ZINC000644136253 385513798 /nfs/dbraw/zinc/51/37/98/385513798.db2.gz SDQONPANJKUAIP-UHFFFAOYSA-N 1 2 217.316 2.411 20 0 BEADLO CC(C)c1nc(C[NH2+][C@H]2CSC[C@@H]2C)no1 ZINC000309316969 385528905 /nfs/dbraw/zinc/52/89/05/385528905.db2.gz DHYBSBVENBZAJR-IUCAKERBSA-N 1 2 241.360 2.034 20 0 BEADLO C[N@H+](Cc1ncc(C(C)(C)C)o1)[C@H]1CCOC1 ZINC000106882448 385540579 /nfs/dbraw/zinc/54/05/79/385540579.db2.gz SWJZDGDWPMXBOU-JTQLQIEISA-N 1 2 238.331 2.193 20 0 BEADLO C[N@@H+](Cc1ncc(C(C)(C)C)o1)[C@H]1CCOC1 ZINC000106882448 385540581 /nfs/dbraw/zinc/54/05/81/385540581.db2.gz SWJZDGDWPMXBOU-JTQLQIEISA-N 1 2 238.331 2.193 20 0 BEADLO c1csc([C@@H]2CN(Cc3[nH]cc[nH+]3)CCO2)c1 ZINC000157746603 385520635 /nfs/dbraw/zinc/52/06/35/385520635.db2.gz QQIGDZGLTCZGJY-JTQLQIEISA-N 1 2 249.339 2.045 20 0 BEADLO c1cn(CCCSc2ccccn2)c[nH+]1 ZINC000180428665 385523202 /nfs/dbraw/zinc/52/32/02/385523202.db2.gz BHKYTMUENYANKG-UHFFFAOYSA-N 1 2 219.313 2.461 20 0 BEADLO CC(C)n1nccc1C[NH+]1[C@H](C)COC[C@H]1C ZINC000334239878 385523851 /nfs/dbraw/zinc/52/38/51/385523851.db2.gz LMPVBCLIJWTNJJ-VXGBXAGGSA-N 1 2 237.347 2.073 20 0 BEADLO COc1ccc(-c2c[nH]c(C)[nH+]2)cc1OC ZINC000259083195 385555893 /nfs/dbraw/zinc/55/58/93/385555893.db2.gz LZLDVLRUYWONQS-UHFFFAOYSA-N 1 2 218.256 2.402 20 0 BEADLO CC[C@H]1CCC[N@H+](Cc2noc(C)n2)CC1 ZINC000117342555 385577164 /nfs/dbraw/zinc/57/71/64/385577164.db2.gz WVIQXBFAJFGSDB-NSHDSACASA-N 1 2 223.320 2.390 20 0 BEADLO CC[C@H]1CCC[N@@H+](Cc2noc(C)n2)CC1 ZINC000117342555 385577165 /nfs/dbraw/zinc/57/71/65/385577165.db2.gz WVIQXBFAJFGSDB-NSHDSACASA-N 1 2 223.320 2.390 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCOC1=O)C(C)(C)c1ccccc1 ZINC000181770572 385602690 /nfs/dbraw/zinc/60/26/90/385602690.db2.gz LTEKMUJAVFRKIV-WCQYABFASA-N 1 2 247.338 2.258 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cnccc2C)no1 ZINC000269540012 385603095 /nfs/dbraw/zinc/60/30/95/385603095.db2.gz AOGHHCFGICXECT-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cnccc2C)no1 ZINC000269540012 385603102 /nfs/dbraw/zinc/60/31/02/385603102.db2.gz AOGHHCFGICXECT-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO FC(F)O[C@H]1CCCC[C@@H]1[NH2+]Cc1ccn[nH]1 ZINC000337306550 385592699 /nfs/dbraw/zinc/59/26/99/385592699.db2.gz RVXHQVGBGCWYJM-UWVGGRQHSA-N 1 2 245.273 2.050 20 0 BEADLO CC(C)(C)C1C[NH+](Cc2csnn2)C1 ZINC000334782690 385634359 /nfs/dbraw/zinc/63/43/59/385634359.db2.gz LKFDKWLEPYDMDA-UHFFFAOYSA-N 1 2 211.334 2.016 20 0 BEADLO CC1(C)C[C@H]1C(=O)Nc1cccc2[nH+]ccn21 ZINC000269830975 385639551 /nfs/dbraw/zinc/63/95/51/385639551.db2.gz JKNZIESKRZAXAF-VIFPVBQESA-N 1 2 229.283 2.319 20 0 BEADLO CC(C)(O)CC[N@@H+]1CCCC[C@@H]1C(F)F ZINC000337389871 385640592 /nfs/dbraw/zinc/64/05/92/385640592.db2.gz GVSNFNHLCMTTSF-SECBINFHSA-N 1 2 221.291 2.267 20 0 BEADLO CC(C)(O)CC[N@H+]1CCCC[C@@H]1C(F)F ZINC000337389871 385640598 /nfs/dbraw/zinc/64/05/98/385640598.db2.gz GVSNFNHLCMTTSF-SECBINFHSA-N 1 2 221.291 2.267 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1C(=O)CCc1c[nH+]cn1C ZINC000281283311 385653353 /nfs/dbraw/zinc/65/33/53/385653353.db2.gz SEAURSCXSRDNSU-NEPJUHHUSA-N 1 2 249.358 2.142 20 0 BEADLO CC(C)c1cc(N2CC[C@@H](O)C2)nc(C(C)C)[nH+]1 ZINC000269975267 385654652 /nfs/dbraw/zinc/65/46/52/385654652.db2.gz PJPWCQKHDIMYNZ-LLVKDONJSA-N 1 2 249.358 2.294 20 0 BEADLO CC(C)CCC[S@@](=O)Cc1[nH+]ccn1C ZINC000182297004 385655002 /nfs/dbraw/zinc/65/50/02/385655002.db2.gz BQIZKFNTJINTKP-OAHLLOKOSA-N 1 2 228.361 2.105 20 0 BEADLO FC(F)(F)[C@@H]([NH2+]C[C@H]1CCCOC1)C1CC1 ZINC000309531404 385665997 /nfs/dbraw/zinc/66/59/97/385665997.db2.gz DCIRCQLVFKEQDU-SCZZXKLOSA-N 1 2 237.265 2.344 20 0 BEADLO FC(F)(F)C1=CCN(Cc2[nH]cc[nH+]2)CC1 ZINC000270159877 385677958 /nfs/dbraw/zinc/67/79/58/385677958.db2.gz IDRMCLSOQJEGPN-UHFFFAOYSA-N 1 2 231.221 2.104 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nc3ccccc3c(=O)[nH]2)[C@H]1C ZINC000645218198 385678897 /nfs/dbraw/zinc/67/88/97/385678897.db2.gz VUUUPYGKVAPLFF-ZJUUUORDSA-N 1 2 243.310 2.176 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nc3ccccc3c(=O)[nH]2)[C@H]1C ZINC000645218198 385678903 /nfs/dbraw/zinc/67/89/03/385678903.db2.gz VUUUPYGKVAPLFF-ZJUUUORDSA-N 1 2 243.310 2.176 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)C(C)(C)C1CCCC1 ZINC000270178838 385680140 /nfs/dbraw/zinc/68/01/40/385680140.db2.gz IYLXJDUNSARGPS-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO C[C@H]([NH2+]CC(F)(F)CO)c1ccsc1 ZINC000184695330 385692184 /nfs/dbraw/zinc/69/21/84/385692184.db2.gz KFODJAMMWDZPRW-ZETCQYMHSA-N 1 2 221.272 2.026 20 0 BEADLO CS[C@H](C)CC(=O)Nc1cccc2[nH+]ccn21 ZINC000270320251 385695700 /nfs/dbraw/zinc/69/57/00/385695700.db2.gz KNMUYDMGRLISHH-SECBINFHSA-N 1 2 249.339 2.414 20 0 BEADLO C[C@@H](CO)CCCNc1cc[nH+]c(C2CC2)n1 ZINC000270341012 385699242 /nfs/dbraw/zinc/69/92/42/385699242.db2.gz ZNVYLCQGCLFLKS-SNVBAGLBSA-N 1 2 235.331 2.175 20 0 BEADLO COC(=O)CCC[N@@H+]1CCCC[C@@H]1C(F)F ZINC000337538038 385699858 /nfs/dbraw/zinc/69/98/58/385699858.db2.gz ZHKNMZFDDAPOKJ-SECBINFHSA-N 1 2 235.274 2.059 20 0 BEADLO COC(=O)CCC[N@H+]1CCCC[C@@H]1C(F)F ZINC000337538038 385699863 /nfs/dbraw/zinc/69/98/63/385699863.db2.gz ZHKNMZFDDAPOKJ-SECBINFHSA-N 1 2 235.274 2.059 20 0 BEADLO CC[N@H+](CCOC)Cc1csc(C2CC2)n1 ZINC000270360499 385700976 /nfs/dbraw/zinc/70/09/76/385700976.db2.gz YNULHBCYYGJVGY-UHFFFAOYSA-N 1 2 240.372 2.489 20 0 BEADLO CC[N@@H+](CCOC)Cc1csc(C2CC2)n1 ZINC000270360499 385700983 /nfs/dbraw/zinc/70/09/83/385700983.db2.gz YNULHBCYYGJVGY-UHFFFAOYSA-N 1 2 240.372 2.489 20 0 BEADLO Cc1nnc(C[N@H+]2CC=C(C(C)(C)C)CC2)n1C ZINC000270385548 385703997 /nfs/dbraw/zinc/70/39/97/385703997.db2.gz QYPAWLMBWNYPEP-UHFFFAOYSA-N 1 2 248.374 2.302 20 0 BEADLO Cc1nnc(C[N@@H+]2CC=C(C(C)(C)C)CC2)n1C ZINC000270385548 385704000 /nfs/dbraw/zinc/70/40/00/385704000.db2.gz QYPAWLMBWNYPEP-UHFFFAOYSA-N 1 2 248.374 2.302 20 0 BEADLO C[C@H]([NH2+][C@@H]1C[C@@H](C)[C@@H]1C)C(=O)OC(C)(C)C ZINC000309608895 385739329 /nfs/dbraw/zinc/73/93/29/385739329.db2.gz ZKKPEVNVFFDLOY-VPOLOUISSA-N 1 2 227.348 2.351 20 0 BEADLO COC[C@@H](C)[NH2+]CC(F)(F)c1ccccc1 ZINC000161166255 385744164 /nfs/dbraw/zinc/74/41/64/385744164.db2.gz UYPQCCVIKHYSQM-SNVBAGLBSA-N 1 2 229.270 2.403 20 0 BEADLO CCCn1c(C)nnc1C[N@H+]1CC=C(C)CC1 ZINC000270786414 385744511 /nfs/dbraw/zinc/74/45/11/385744511.db2.gz IQZZKFIDOGVIAQ-UHFFFAOYSA-N 1 2 234.347 2.149 20 0 BEADLO CCCn1c(C)nnc1C[N@@H+]1CC=C(C)CC1 ZINC000270786414 385744516 /nfs/dbraw/zinc/74/45/16/385744516.db2.gz IQZZKFIDOGVIAQ-UHFFFAOYSA-N 1 2 234.347 2.149 20 0 BEADLO Cc1nc(N2CCCOC(C)(C)C2)c(C)c(C)[nH+]1 ZINC000363862164 385767306 /nfs/dbraw/zinc/76/73/06/385767306.db2.gz SDSTWHBWNXOZPY-UHFFFAOYSA-N 1 2 249.358 2.407 20 0 BEADLO Cn1ccc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)n1 ZINC000270990097 385767600 /nfs/dbraw/zinc/76/76/00/385767600.db2.gz HERZJTVCRGZTES-VIFPVBQESA-N 1 2 247.264 2.194 20 0 BEADLO Cn1ccc(C[N@H+]2CCC[C@H](C(F)(F)F)C2)n1 ZINC000270990097 385767607 /nfs/dbraw/zinc/76/76/07/385767607.db2.gz HERZJTVCRGZTES-VIFPVBQESA-N 1 2 247.264 2.194 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@H]1CC1(C)C ZINC000271000122 385770402 /nfs/dbraw/zinc/77/04/02/385770402.db2.gz DHXSPDAIBRNHJK-SNVBAGLBSA-N 1 2 219.288 2.310 20 0 BEADLO Cn1ccc(C[N@H+](C)Cc2cccs2)n1 ZINC000271005030 385770762 /nfs/dbraw/zinc/77/07/62/385770762.db2.gz NEKSSRZICGFKNI-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO Cn1ccc(C[N@@H+](C)Cc2cccs2)n1 ZINC000271005030 385770766 /nfs/dbraw/zinc/77/07/66/385770766.db2.gz NEKSSRZICGFKNI-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO Cc1ccc(F)c(C[N@@H+]2CCO[C@H](C)C2)c1 ZINC000271026094 385772678 /nfs/dbraw/zinc/77/26/78/385772678.db2.gz DODIZRBYHCVSRN-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ccc(F)c(C[N@H+]2CCO[C@H](C)C2)c1 ZINC000271026094 385772681 /nfs/dbraw/zinc/77/26/81/385772681.db2.gz DODIZRBYHCVSRN-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO CN(C[C@H]1CCC[C@H]1O)c1[nH]c2ccccc2[nH+]1 ZINC000270595164 385721113 /nfs/dbraw/zinc/72/11/13/385721113.db2.gz UKNZJQRDLHSSRJ-ZWNOBZJWSA-N 1 2 245.326 2.160 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2O[C@@H](C)C[C@H]2C)c(C)[nH+]1 ZINC000282023032 385725156 /nfs/dbraw/zinc/72/51/56/385725156.db2.gz WBHLSUHRJMHEEI-DFAYQTQMSA-N 1 2 248.326 2.450 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1cscn1)c1cnn(C)c1 ZINC000271195481 385802414 /nfs/dbraw/zinc/80/24/14/385802414.db2.gz YIKHFRINQRJCCH-RKDXNWHRSA-N 1 2 236.344 2.288 20 0 BEADLO CC(C)[C@@H]([NH2+]Cc1c[nH]nn1)c1ccccc1 ZINC000283899324 385802768 /nfs/dbraw/zinc/80/27/68/385802768.db2.gz FMPDGERAGOENOZ-CYBMUJFWSA-N 1 2 230.315 2.292 20 0 BEADLO CC(C)[C@@H]([NH2+]Cc1cn[nH]n1)c1ccccc1 ZINC000283899324 385802774 /nfs/dbraw/zinc/80/27/74/385802774.db2.gz FMPDGERAGOENOZ-CYBMUJFWSA-N 1 2 230.315 2.292 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1cnn(C)c1 ZINC000271195476 385804617 /nfs/dbraw/zinc/80/46/17/385804617.db2.gz YIKHFRINQRJCCH-BDAKNGLRSA-N 1 2 236.344 2.288 20 0 BEADLO CC(C)c1nc(C[N@H+](C)C2CC(O)C2)cs1 ZINC000353468489 385806194 /nfs/dbraw/zinc/80/61/94/385806194.db2.gz OHQPHPCKLAFAAQ-UHFFFAOYSA-N 1 2 240.372 2.222 20 0 BEADLO CC(C)c1nc(C[N@@H+](C)C2CC(O)C2)cs1 ZINC000353468489 385806199 /nfs/dbraw/zinc/80/61/99/385806199.db2.gz OHQPHPCKLAFAAQ-UHFFFAOYSA-N 1 2 240.372 2.222 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H]1CC[C@H](c2ccccc2)C1 ZINC000271257308 385810582 /nfs/dbraw/zinc/81/05/82/385810582.db2.gz HKZUHFGFKZOVNM-FPMFFAJLSA-N 1 2 247.338 2.474 20 0 BEADLO Cc1nnc(C[N@H+](Cc2cccnc2)C(C)C)o1 ZINC000162377080 385813218 /nfs/dbraw/zinc/81/32/18/385813218.db2.gz HUCXNFQBNGUUFQ-UHFFFAOYSA-N 1 2 246.314 2.184 20 0 BEADLO Cc1nnc(C[N@@H+](Cc2cccnc2)C(C)C)o1 ZINC000162377080 385813221 /nfs/dbraw/zinc/81/32/21/385813221.db2.gz HUCXNFQBNGUUFQ-UHFFFAOYSA-N 1 2 246.314 2.184 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC[C@H]1CCCC1(C)C ZINC000294224088 385823297 /nfs/dbraw/zinc/82/32/97/385823297.db2.gz QZZLIVKKDIRRDX-LLVKDONJSA-N 1 2 249.358 2.203 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)NC[C@H]1CCCC1(C)C ZINC000294224088 385823299 /nfs/dbraw/zinc/82/32/99/385823299.db2.gz QZZLIVKKDIRRDX-LLVKDONJSA-N 1 2 249.358 2.203 20 0 BEADLO c1[nH]nnc1C[NH2+][C@H]1CCC[C@H]1c1ccccc1 ZINC000283969366 385842664 /nfs/dbraw/zinc/84/26/64/385842664.db2.gz LYJHSWNKRDNKMC-KBPBESRZSA-N 1 2 242.326 2.231 20 0 BEADLO c1n[nH]nc1C[NH2+][C@H]1CCC[C@H]1c1ccccc1 ZINC000283969366 385842667 /nfs/dbraw/zinc/84/26/67/385842667.db2.gz LYJHSWNKRDNKMC-KBPBESRZSA-N 1 2 242.326 2.231 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CCC[C@@H]1C1CCC1 ZINC000283969514 385843264 /nfs/dbraw/zinc/84/32/64/385843264.db2.gz MFKZQNLDAZTOLQ-KTRBRXNASA-N 1 2 245.326 2.214 20 0 BEADLO Cc1cc(CNC(=O)NC2CC=CC2)cc(C)[nH+]1 ZINC000643234473 385843896 /nfs/dbraw/zinc/84/38/96/385843896.db2.gz HGSBRIUYFSNCHW-UHFFFAOYSA-N 1 2 245.326 2.216 20 0 BEADLO CS[C@H]1CC[N@H+](Cc2ncc(Cl)n2C)C1 ZINC000294453470 385852011 /nfs/dbraw/zinc/85/20/11/385852011.db2.gz SKTMNNJWLMOUAK-QMMMGPOBSA-N 1 2 245.779 2.011 20 0 BEADLO CS[C@H]1CC[N@@H+](Cc2ncc(Cl)n2C)C1 ZINC000294453470 385852013 /nfs/dbraw/zinc/85/20/13/385852013.db2.gz SKTMNNJWLMOUAK-QMMMGPOBSA-N 1 2 245.779 2.011 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@H]1CCSC1 ZINC000271138711 385793948 /nfs/dbraw/zinc/79/39/48/385793948.db2.gz PMKSDJSSXLDWHO-VIFPVBQESA-N 1 2 237.328 2.017 20 0 BEADLO CC[N@H+](C)Cc1ncc(CSC)s1 ZINC000294783770 385896088 /nfs/dbraw/zinc/89/60/88/385896088.db2.gz BYDHUPSZDSBEIJ-UHFFFAOYSA-N 1 2 216.375 2.458 20 0 BEADLO CC[N@@H+](C)Cc1ncc(CSC)s1 ZINC000294783770 385896090 /nfs/dbraw/zinc/89/60/90/385896090.db2.gz BYDHUPSZDSBEIJ-UHFFFAOYSA-N 1 2 216.375 2.458 20 0 BEADLO CCN(C(=O)Cc1[nH]c[nH+]c1C)C1CC(C)(C)C1 ZINC000413981350 385929113 /nfs/dbraw/zinc/92/91/13/385929113.db2.gz DLZWWULFOAKTFI-UHFFFAOYSA-N 1 2 249.358 2.298 20 0 BEADLO Cc1cnccc1C[N@H+](C)Cc1ccon1 ZINC000294838386 385901892 /nfs/dbraw/zinc/90/18/92/385901892.db2.gz NZMUMGYLMLHHBU-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1cnccc1C[N@@H+](C)Cc1ccon1 ZINC000294838386 385901895 /nfs/dbraw/zinc/90/18/95/385901895.db2.gz NZMUMGYLMLHHBU-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO COC[C@]1(C)CCN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000294861728 385905660 /nfs/dbraw/zinc/90/56/60/385905660.db2.gz CEOLTSFSZMNASZ-CQSZACIVSA-N 1 2 247.342 2.217 20 0 BEADLO C[C@H](CCCO)CNc1cc[nH+]c(C2CC2)n1 ZINC000294855733 385905749 /nfs/dbraw/zinc/90/57/49/385905749.db2.gz BPMCHFHLRWUWSN-SNVBAGLBSA-N 1 2 235.331 2.175 20 0 BEADLO Cc1cc(C[N@@H+]2CCCC[C@H]2c2cc[nH]n2)on1 ZINC000285327855 385915794 /nfs/dbraw/zinc/91/57/94/385915794.db2.gz JLFZESPCAUHBQS-ZDUSSCGKSA-N 1 2 246.314 2.433 20 0 BEADLO Cc1cc(C[N@H+]2CCCC[C@H]2c2cc[nH]n2)on1 ZINC000285327855 385915799 /nfs/dbraw/zinc/91/57/99/385915799.db2.gz JLFZESPCAUHBQS-ZDUSSCGKSA-N 1 2 246.314 2.433 20 0 BEADLO CCC[C@@H](OC)C(=O)Nc1ccc(C)[nH+]c1C ZINC000294923825 385918928 /nfs/dbraw/zinc/91/89/28/385918928.db2.gz LBBHQSJIIBSYSZ-GFCCVEGCSA-N 1 2 236.315 2.452 20 0 BEADLO Cc1ccoc1C[NH2+][C@@H](c1nncn1C)C(C)C ZINC000285386417 385921483 /nfs/dbraw/zinc/92/14/83/385921483.db2.gz DEBOSJXUZHXTFY-GFCCVEGCSA-N 1 2 248.330 2.203 20 0 BEADLO C[N@H+](CCc1cscn1)Cc1nccs1 ZINC000294945622 385921476 /nfs/dbraw/zinc/92/14/76/385921476.db2.gz KAZOTUWMZAYXAL-UHFFFAOYSA-N 1 2 239.369 2.274 20 0 BEADLO C[N@@H+](CCc1cscn1)Cc1nccs1 ZINC000294945622 385921482 /nfs/dbraw/zinc/92/14/82/385921482.db2.gz KAZOTUWMZAYXAL-UHFFFAOYSA-N 1 2 239.369 2.274 20 0 BEADLO c1[nH]nnc1C[NH2+][C@@H](c1ccccc1)C1CCC1 ZINC000294949244 385925992 /nfs/dbraw/zinc/92/59/92/385925992.db2.gz MKIFZBTWODLIDV-AWEZNQCLSA-N 1 2 242.326 2.436 20 0 BEADLO c1n[nH]nc1C[NH2+][C@@H](c1ccccc1)C1CCC1 ZINC000294949244 385925997 /nfs/dbraw/zinc/92/59/97/385925997.db2.gz MKIFZBTWODLIDV-AWEZNQCLSA-N 1 2 242.326 2.436 20 0 BEADLO Cc1cn[nH]c1C[N@@H+](C)[C@H](C)c1cccnc1 ZINC000284268963 385860258 /nfs/dbraw/zinc/86/02/58/385860258.db2.gz SIMASUQTGIEVSV-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO Cc1cn[nH]c1C[N@H+](C)[C@H](C)c1cccnc1 ZINC000284268963 385860261 /nfs/dbraw/zinc/86/02/61/385860261.db2.gz SIMASUQTGIEVSV-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO Cc1c[nH]nc1C[N@@H+](C)[C@H](C)c1cccnc1 ZINC000284268963 385860265 /nfs/dbraw/zinc/86/02/65/385860265.db2.gz SIMASUQTGIEVSV-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO Cc1c[nH]nc1C[N@H+](C)[C@H](C)c1cccnc1 ZINC000284268963 385860269 /nfs/dbraw/zinc/86/02/69/385860269.db2.gz SIMASUQTGIEVSV-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO COC(=O)C(C)(C)CCNc1cccc[nH+]1 ZINC000336741355 385861543 /nfs/dbraw/zinc/86/15/43/385861543.db2.gz QXMKOXDUQJWNMS-UHFFFAOYSA-N 1 2 222.288 2.083 20 0 BEADLO C[C@@H](C[NH+]1CCOCC1)c1cc(F)cc(F)c1 ZINC000294556120 385866188 /nfs/dbraw/zinc/86/61/88/385866188.db2.gz LNRDWYYXZFBCGO-JTQLQIEISA-N 1 2 241.281 2.401 20 0 BEADLO CCC[C@](C)([NH2+]CCSC(C)C)C(=O)OC ZINC000336738439 385874551 /nfs/dbraw/zinc/87/45/51/385874551.db2.gz OGORWPFYDPIGLH-LBPRGKRZSA-N 1 2 247.404 2.449 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccncc1F)c1nccn1C ZINC000338017857 385875454 /nfs/dbraw/zinc/87/54/54/385875454.db2.gz WQILSANHBAHSMR-VHSXEESVSA-N 1 2 248.305 2.366 20 0 BEADLO CC[C@@H](C)[C@@H]([NH2+]CC=C(C)C)C(=O)OC ZINC000336747478 385978721 /nfs/dbraw/zinc/97/87/21/385978721.db2.gz BWJPSELYULBMDM-GHMZBOCLSA-N 1 2 213.321 2.130 20 0 BEADLO C[C@@H]([NH2+]Cc1nnc(C2CC2)[nH]1)c1ccco1 ZINC000273231832 385979234 /nfs/dbraw/zinc/97/92/34/385979234.db2.gz CPSMFIDZMHMSGZ-MRVPVSSYSA-N 1 2 232.287 2.126 20 0 BEADLO COCC[C@H]([NH2+]Cc1ccno1)c1ccco1 ZINC000273237382 385981789 /nfs/dbraw/zinc/98/17/89/385981789.db2.gz GWGFSTYBZPEZSB-NSHDSACASA-N 1 2 236.271 2.135 20 0 BEADLO CC(C)n1ccnc1C[NH2+][C@@H](C)c1cnn(C)c1 ZINC000273266180 385986151 /nfs/dbraw/zinc/98/61/51/385986151.db2.gz FOCHAJJQGMBNHV-NSHDSACASA-N 1 2 247.346 2.048 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2ccoc2)nc1 ZINC000338240572 385931918 /nfs/dbraw/zinc/93/19/18/385931918.db2.gz WFIYEDIEQMWLJF-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2ccoc2)nc1 ZINC000338240572 385931925 /nfs/dbraw/zinc/93/19/25/385931925.db2.gz WFIYEDIEQMWLJF-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO CCC[C@@H](OC)C(=O)Nc1cc[nH+]c(C)c1 ZINC000294980849 385932907 /nfs/dbraw/zinc/93/29/07/385932907.db2.gz RZCSNPNAVJJVQR-LLVKDONJSA-N 1 2 222.288 2.144 20 0 BEADLO C[C@H]([NH2+]Cc1ccco1)c1cc2n(n1)CCC2 ZINC000414058983 385935778 /nfs/dbraw/zinc/93/57/78/385935778.db2.gz VLDNHFSSNMZHNG-JTQLQIEISA-N 1 2 231.299 2.273 20 0 BEADLO CCC[C@H](O)CNc1nc(C)[nH+]c2c1CCCC2 ZINC000272803808 385938115 /nfs/dbraw/zinc/93/81/15/385938115.db2.gz BDFPKMOFYBIGFS-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO CSC(C)(C)CNc1cc[nH+]c(C)n1 ZINC000128009724 385941449 /nfs/dbraw/zinc/94/14/49/385941449.db2.gz ODUKGEFEPBXYLZ-UHFFFAOYSA-N 1 2 211.334 2.339 20 0 BEADLO COC(=O)[C@@H]([NH2+]Cc1ccc(C)cc1C)C1CC1 ZINC000272934111 385952058 /nfs/dbraw/zinc/95/20/58/385952058.db2.gz NCTAFIYHZYZWOG-AWEZNQCLSA-N 1 2 247.338 2.345 20 0 BEADLO C[C@H](CCO)CCNc1cc[nH+]c(C2CC2)n1 ZINC000295041484 385952193 /nfs/dbraw/zinc/95/21/93/385952193.db2.gz XBZMPLVDQIVJHN-JTQLQIEISA-N 1 2 235.331 2.175 20 0 BEADLO CO[C@@H](C)C[N@H+](C)Cc1ncc(C2CC2)o1 ZINC000272969017 385956852 /nfs/dbraw/zinc/95/68/52/385956852.db2.gz OQNZRJUEXPEHSL-VIFPVBQESA-N 1 2 224.304 2.019 20 0 BEADLO CO[C@@H](C)C[N@@H+](C)Cc1ncc(C2CC2)o1 ZINC000272969017 385956860 /nfs/dbraw/zinc/95/68/60/385956860.db2.gz OQNZRJUEXPEHSL-VIFPVBQESA-N 1 2 224.304 2.019 20 0 BEADLO CC(C)n1ccnc1SCCn1cc[nH+]c1 ZINC000342205592 385957032 /nfs/dbraw/zinc/95/70/32/385957032.db2.gz RCNSDCUKUOHNIO-UHFFFAOYSA-N 1 2 236.344 2.453 20 0 BEADLO CO[C@@H](C[N@H+](CC(F)F)C1CC1)C1CC1 ZINC000425401607 385962276 /nfs/dbraw/zinc/96/22/76/385962276.db2.gz HDUJHCZQOXXMTH-JTQLQIEISA-N 1 2 219.275 2.141 20 0 BEADLO CO[C@@H](C[N@@H+](CC(F)F)C1CC1)C1CC1 ZINC000425401607 385962279 /nfs/dbraw/zinc/96/22/79/385962279.db2.gz HDUJHCZQOXXMTH-JTQLQIEISA-N 1 2 219.275 2.141 20 0 BEADLO CC[C@H](F)C[N@@H+]1CCCC[C@H]1c1nnc(C)[nH]1 ZINC000338332703 385964199 /nfs/dbraw/zinc/96/41/99/385964199.db2.gz MHMAYPNWUBEKGX-QWRGUYRKSA-N 1 2 240.326 2.388 20 0 BEADLO CC[C@H](F)C[N@H+]1CCCC[C@H]1c1nnc(C)[nH]1 ZINC000338332703 385964205 /nfs/dbraw/zinc/96/42/05/385964205.db2.gz MHMAYPNWUBEKGX-QWRGUYRKSA-N 1 2 240.326 2.388 20 0 BEADLO CC(C)[N@H+](Cc1nc(C(F)F)no1)C1CC1 ZINC000425404811 385965553 /nfs/dbraw/zinc/96/55/53/385965553.db2.gz KMQAUCFXKDCAJJ-UHFFFAOYSA-N 1 2 231.246 2.380 20 0 BEADLO CC(C)[N@@H+](Cc1nc(C(F)F)no1)C1CC1 ZINC000425404811 385965560 /nfs/dbraw/zinc/96/55/60/385965560.db2.gz KMQAUCFXKDCAJJ-UHFFFAOYSA-N 1 2 231.246 2.380 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CCCO[C@H](C)C2)s1 ZINC000338318021 385965724 /nfs/dbraw/zinc/96/57/24/385965724.db2.gz UHJOKRZDSUFRQZ-BDAKNGLRSA-N 1 2 241.360 2.018 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CCCO[C@H](C)C2)s1 ZINC000338318021 385965731 /nfs/dbraw/zinc/96/57/31/385965731.db2.gz UHJOKRZDSUFRQZ-BDAKNGLRSA-N 1 2 241.360 2.018 20 0 BEADLO Cc1nc(C[NH2+][C@H]2CCCc3cn[nH]c32)cs1 ZINC000335016786 385973961 /nfs/dbraw/zinc/97/39/61/385973961.db2.gz SHFPZUNQJFEURS-NSHDSACASA-N 1 2 248.355 2.342 20 0 BEADLO Cc1nc(C[NH2+][C@H]2CCCc3c[nH]nc32)cs1 ZINC000335016786 385973964 /nfs/dbraw/zinc/97/39/64/385973964.db2.gz SHFPZUNQJFEURS-NSHDSACASA-N 1 2 248.355 2.342 20 0 BEADLO CCOC(=O)C[NH2+][C@@H]1CCCC[C@H]1SCC ZINC000189494848 386014198 /nfs/dbraw/zinc/01/41/98/386014198.db2.gz PCPCTRVVVGDUME-GHMZBOCLSA-N 1 2 245.388 2.203 20 0 BEADLO CO[C@H]1C[C@@H](N(C)c2cc(C)[nH+]c(C3CC3)n2)C1 ZINC000286264611 386017182 /nfs/dbraw/zinc/01/71/82/386017182.db2.gz GYASLNALIRWIGZ-TXEJJXNPSA-N 1 2 247.342 2.276 20 0 BEADLO CCCc1nc(Cc2cn3ccccc3[nH+]2)no1 ZINC000273662666 386021173 /nfs/dbraw/zinc/02/11/73/386021173.db2.gz FLWCLFFMYCSBAX-UHFFFAOYSA-N 1 2 242.282 2.261 20 0 BEADLO CCCC[C@@](C)(CO)Nc1cc(CC)[nH+]cn1 ZINC000645345115 386021125 /nfs/dbraw/zinc/02/11/25/386021125.db2.gz RHWLDZSSMFYPKK-ZDUSSCGKSA-N 1 2 237.347 2.392 20 0 BEADLO Cc1cc(CNC(=O)c2nccs2)cc(C)[nH+]1 ZINC000643274941 386022184 /nfs/dbraw/zinc/02/21/84/386022184.db2.gz PGRJQDXVSLKCQC-UHFFFAOYSA-N 1 2 247.323 2.085 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@H]2c2cc[nH]n2)on1 ZINC000286320000 386023073 /nfs/dbraw/zinc/02/30/73/386023073.db2.gz WNYFWPUXBXHPRE-LBPRGKRZSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@H]2c2cc[nH]n2)on1 ZINC000286320000 386023081 /nfs/dbraw/zinc/02/30/81/386023081.db2.gz WNYFWPUXBXHPRE-LBPRGKRZSA-N 1 2 232.287 2.043 20 0 BEADLO CC[C@H]1CCC[C@@]2(C1)NC(=O)C[N@@H+]2CC(C)C ZINC000414178810 386023700 /nfs/dbraw/zinc/02/37/00/386023700.db2.gz KHTWKASGGYZSOH-GXTWGEPZSA-N 1 2 238.375 2.371 20 0 BEADLO CC[C@H]1CCC[C@@]2(C1)NC(=O)C[N@H+]2CC(C)C ZINC000414178810 386023702 /nfs/dbraw/zinc/02/37/02/386023702.db2.gz KHTWKASGGYZSOH-GXTWGEPZSA-N 1 2 238.375 2.371 20 0 BEADLO COc1ncncc1C[N@H+](C)Cc1ccsc1 ZINC000647999938 386027631 /nfs/dbraw/zinc/02/76/31/386027631.db2.gz GYIAQFYLWGRCEX-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1ncncc1C[N@@H+](C)Cc1ccsc1 ZINC000647999938 386027635 /nfs/dbraw/zinc/02/76/35/386027635.db2.gz GYIAQFYLWGRCEX-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2cn3ccccc3n2)C1 ZINC000334422516 386027785 /nfs/dbraw/zinc/02/77/85/386027785.db2.gz UOSFHNBNOGQHQZ-ZDUSSCGKSA-N 1 2 233.290 2.268 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2cn3ccccc3n2)C1 ZINC000334422516 386027790 /nfs/dbraw/zinc/02/77/90/386027790.db2.gz UOSFHNBNOGQHQZ-ZDUSSCGKSA-N 1 2 233.290 2.268 20 0 BEADLO CON(CC(C)(C)C)c1[nH+]cnc2[nH]ccc21 ZINC000286386883 386031466 /nfs/dbraw/zinc/03/14/66/386031466.db2.gz NMLSCFFKTWQMLM-UHFFFAOYSA-N 1 2 234.303 2.372 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2nccn2C)cc1F ZINC000273773166 386034480 /nfs/dbraw/zinc/03/44/80/386034480.db2.gz REWVVANKOIKZQI-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2nccn2C)cc1F ZINC000273773166 386034487 /nfs/dbraw/zinc/03/44/87/386034487.db2.gz REWVVANKOIKZQI-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1ccc(CN(C)Cc2[nH+]ccn2C)cc1F ZINC000273773166 386034494 /nfs/dbraw/zinc/03/44/94/386034494.db2.gz REWVVANKOIKZQI-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@@H]1C1CCCCC1 ZINC000414200928 386038635 /nfs/dbraw/zinc/03/86/35/386038635.db2.gz SAKIHKJXTUBWBL-NSHDSACASA-N 1 2 224.348 2.123 20 0 BEADLO CCC[C@](C)(CC)c1nc(C[NH2+]C)no1 ZINC000414643259 386046337 /nfs/dbraw/zinc/04/63/37/386046337.db2.gz MLLUDLYPMGJYEZ-NSHDSACASA-N 1 2 211.309 2.257 20 0 BEADLO Cc1ccc(Cc2noc([C@@]3(C)C[C@@H]3F)n2)c[nH+]1 ZINC000335078652 386051373 /nfs/dbraw/zinc/05/13/73/386051373.db2.gz RILKLVBBSPABKF-GWCFXTLKSA-N 1 2 247.273 2.363 20 0 BEADLO Cc1cc(CNc2c[nH+]cc(C)c2)nn1C ZINC000414291100 386101684 /nfs/dbraw/zinc/10/16/84/386101684.db2.gz KEPRZKNMMOQIJO-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO CCc1ncc(CNc2c[nH+]ccc2OC)cn1 ZINC000414296073 386104312 /nfs/dbraw/zinc/10/43/12/386104312.db2.gz OIXOOGMBRCVCFL-UHFFFAOYSA-N 1 2 244.298 2.055 20 0 BEADLO Cc1c(Cl)c(CNc2cccc[nH+]2)nn1C ZINC000335162111 386105065 /nfs/dbraw/zinc/10/50/65/386105065.db2.gz NVTRWLLZQDVBIA-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C[C@H]1CCC[C@H]1C ZINC000274458680 386105450 /nfs/dbraw/zinc/10/54/50/386105450.db2.gz UPLAAXWWPRMOAP-MWLCHTKSSA-N 1 2 235.331 2.161 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C[C@H]1CCC[C@@H]1C ZINC000274458674 386106762 /nfs/dbraw/zinc/10/67/62/386106762.db2.gz UPLAAXWWPRMOAP-GXSJLCMTSA-N 1 2 235.331 2.161 20 0 BEADLO CC(C)CC(=O)N1CC(C)(C)[C@H]1c1[nH+]ccn1C ZINC000295945463 386110240 /nfs/dbraw/zinc/11/02/40/386110240.db2.gz QMPZIIPVXPVVPC-GFCCVEGCSA-N 1 2 249.358 2.376 20 0 BEADLO COc1ccc(C[N@@H+]2CCC[C@@](C)(F)C2)cn1 ZINC000296025753 386123992 /nfs/dbraw/zinc/12/39/92/386123992.db2.gz MTMAZCWVNSXHFJ-CYBMUJFWSA-N 1 2 238.306 2.414 20 0 BEADLO COc1ccc(C[N@H+]2CCC[C@@](C)(F)C2)cn1 ZINC000296025753 386124001 /nfs/dbraw/zinc/12/40/01/386124001.db2.gz MTMAZCWVNSXHFJ-CYBMUJFWSA-N 1 2 238.306 2.414 20 0 BEADLO C/C=C/C[C@H](CO)Nc1[nH+]c2ccccc2n1C ZINC000274522958 386114197 /nfs/dbraw/zinc/11/41/97/386114197.db2.gz XAACFMIUWXUJIU-PGLGOXFNSA-N 1 2 245.326 2.312 20 0 BEADLO CC[C@@H](C)C(=O)N1CC(C)(C)[C@H]1c1[nH+]ccn1C ZINC000295988034 386119355 /nfs/dbraw/zinc/11/93/55/386119355.db2.gz UMKMDNYQAWBIBJ-GHMZBOCLSA-N 1 2 249.358 2.376 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)[C@@H]1CCCC1(C)C ZINC000274574091 386120507 /nfs/dbraw/zinc/12/05/07/386120507.db2.gz FJOVHDOXRWRDEY-NSHDSACASA-N 1 2 249.358 2.205 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2cccc(C)n2)CCO1 ZINC000340234650 386057958 /nfs/dbraw/zinc/05/79/58/386057958.db2.gz BNAVWTQEGUSSGB-AWEZNQCLSA-N 1 2 234.343 2.391 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2cccc(C)n2)CCO1 ZINC000340234650 386057965 /nfs/dbraw/zinc/05/79/65/386057965.db2.gz BNAVWTQEGUSSGB-AWEZNQCLSA-N 1 2 234.343 2.391 20 0 BEADLO CCC[C@@H](c1nc(C[NH2+]C)no1)C(C)C ZINC000414647606 386061182 /nfs/dbraw/zinc/06/11/82/386061182.db2.gz UQCQHEXSPJJBOU-SECBINFHSA-N 1 2 211.309 2.329 20 0 BEADLO CC[C@H]1CCCC[C@@H]1c1nc(C[NH2+]C)no1 ZINC000414648028 386061385 /nfs/dbraw/zinc/06/13/85/386061385.db2.gz UWEPHNTZWIQORY-UWVGGRQHSA-N 1 2 223.320 2.473 20 0 BEADLO CC[C@@H]1CCCC[C@H]1c1nc(C[NH2+]C)no1 ZINC000414648027 386062074 /nfs/dbraw/zinc/06/20/74/386062074.db2.gz UWEPHNTZWIQORY-NXEZZACHSA-N 1 2 223.320 2.473 20 0 BEADLO C/C=C(/C=C/c1nc(C[NH2+]C)no1)CC ZINC000414647550 386062422 /nfs/dbraw/zinc/06/24/22/386062422.db2.gz UMCNBHVTPYVEBO-PIAAQLDDSA-N 1 2 207.277 2.159 20 0 BEADLO Cc1cc(CNC(=O)C2=CCC2)cc(C)[nH+]1 ZINC000335072745 386064161 /nfs/dbraw/zinc/06/41/61/386064161.db2.gz IAWJNZQZYYFHPL-UHFFFAOYSA-N 1 2 216.284 2.035 20 0 BEADLO Cc1nocc1C[N@H+]1CC[C@@H](C)C[C@@H]1C(N)=O ZINC000334444051 386065609 /nfs/dbraw/zinc/06/56/09/386065609.db2.gz MTOIEHMYEXCDMA-LDYMZIIASA-N 1 2 237.303 2.119 20 0 BEADLO Cc1nocc1C[N@@H+]1CC[C@@H](C)C[C@@H]1C(N)=O ZINC000334444051 386065615 /nfs/dbraw/zinc/06/56/15/386065615.db2.gz MTOIEHMYEXCDMA-LDYMZIIASA-N 1 2 237.303 2.119 20 0 BEADLO O=C(CC[N@@H+]1CCOCC12CC2)c1ccccc1 ZINC000338594363 386070147 /nfs/dbraw/zinc/07/01/47/386070147.db2.gz YHXCLGKRQGUMBA-UHFFFAOYSA-N 1 2 245.322 2.124 20 0 BEADLO O=C(CC[N@H+]1CCOCC12CC2)c1ccccc1 ZINC000338594363 386070155 /nfs/dbraw/zinc/07/01/55/386070155.db2.gz YHXCLGKRQGUMBA-UHFFFAOYSA-N 1 2 245.322 2.124 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000274583747 386122242 /nfs/dbraw/zinc/12/22/42/386122242.db2.gz FYVQLBQVMRNHRY-JATZPVMKSA-N 1 2 249.358 2.380 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)Nc1cnn(C)c1 ZINC000286982589 386089089 /nfs/dbraw/zinc/08/90/89/386089089.db2.gz CBDGAYKTEXCQFC-UHFFFAOYSA-N 1 2 245.286 2.076 20 0 BEADLO CCCC1(C(=O)NCCc2[nH]cc[nH+]2)CCC1 ZINC000345303819 386098248 /nfs/dbraw/zinc/09/82/48/386098248.db2.gz QVCDXSZZBBLDCD-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO C[C@H]1CC[C@H](C(=O)NCCNc2cccc[nH+]2)C1 ZINC000345307887 386099219 /nfs/dbraw/zinc/09/92/19/386099219.db2.gz FZFSQIKEEABVQW-RYUDHWBXSA-N 1 2 247.342 2.046 20 0 BEADLO COc1nccnc1C[N@H+](C)Cc1occc1C ZINC000296179775 386145073 /nfs/dbraw/zinc/14/50/73/386145073.db2.gz XSGRSDHMVLUHGT-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1nccnc1C[N@@H+](C)Cc1occc1C ZINC000296179775 386145078 /nfs/dbraw/zinc/14/50/78/386145078.db2.gz XSGRSDHMVLUHGT-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO CC(C)C(C)(C)C(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000335158862 386152098 /nfs/dbraw/zinc/15/20/98/386152098.db2.gz NBDPENAGGVACCT-JTQLQIEISA-N 1 2 249.358 2.065 20 0 BEADLO CC(C)C(C)(C)C(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000335158862 386152103 /nfs/dbraw/zinc/15/21/03/386152103.db2.gz NBDPENAGGVACCT-JTQLQIEISA-N 1 2 249.358 2.065 20 0 BEADLO CCc1nnc([C@H](C)[NH2+]Cc2ccoc2C)[nH]1 ZINC000414368848 386153925 /nfs/dbraw/zinc/15/39/25/386153925.db2.gz TVIWXFXSLVOALU-QMMMGPOBSA-N 1 2 234.303 2.119 20 0 BEADLO CC1(C)CCC[C@@H](C(=O)NCc2c[nH+]c[nH]2)C1 ZINC000334476693 386158769 /nfs/dbraw/zinc/15/87/69/386158769.db2.gz PAAVLYZWTUMUEH-SNVBAGLBSA-N 1 2 235.331 2.242 20 0 BEADLO CC1(C)CCC[C@@H](C(=O)NCc2c[nH]c[nH+]2)C1 ZINC000334476693 386158773 /nfs/dbraw/zinc/15/87/73/386158773.db2.gz PAAVLYZWTUMUEH-SNVBAGLBSA-N 1 2 235.331 2.242 20 0 BEADLO c1nnc([C@H]([NH2+]C2CCCC2)c2ccccc2)[nH]1 ZINC000274876537 386159560 /nfs/dbraw/zinc/15/95/60/386159560.db2.gz XUSCPVVRAVBMDH-CYBMUJFWSA-N 1 2 242.326 2.426 20 0 BEADLO COC1(C)CN(c2cc(C)[nH+]c(C(C)C)n2)C1 ZINC000346171954 386161507 /nfs/dbraw/zinc/16/15/07/386161507.db2.gz BZRWRSDRAHFMQE-UHFFFAOYSA-N 1 2 235.331 2.134 20 0 BEADLO CC[C@H]1CCC[C@@H](Nc2nc(C)[nH+]c(N)n2)C1 ZINC000310214256 386164645 /nfs/dbraw/zinc/16/46/45/386164645.db2.gz FMRPRCKCABCLEO-VHSXEESVSA-N 1 2 235.335 2.143 20 0 BEADLO CC[C@H]1CCC[C@@H](Nc2nc(N)nc(C)[nH+]2)C1 ZINC000310214256 386164651 /nfs/dbraw/zinc/16/46/51/386164651.db2.gz FMRPRCKCABCLEO-VHSXEESVSA-N 1 2 235.335 2.143 20 0 BEADLO C[C@@H](CCCCO)Nc1cc[nH+]c(C2CC2)n1 ZINC000296357996 386165859 /nfs/dbraw/zinc/16/58/59/386165859.db2.gz RRCDVAXRVCAHSH-JTQLQIEISA-N 1 2 235.331 2.317 20 0 BEADLO CC(C)[C@H](NCc1c[nH+]cn1C)C(F)(F)F ZINC000336742505 386181136 /nfs/dbraw/zinc/18/11/36/386181136.db2.gz OGICUFSAWMEBDG-VIFPVBQESA-N 1 2 235.253 2.097 20 0 BEADLO CCC=CC[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000296528914 386182117 /nfs/dbraw/zinc/18/21/17/386182117.db2.gz QHOXJJDUXOWBPZ-LPZVBRGNSA-N 1 2 242.326 2.450 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)C[C@@H]1C=CCCC1 ZINC000275169354 386187039 /nfs/dbraw/zinc/18/70/39/386187039.db2.gz UFDTXCDTFAOIKE-QWHCGFSZSA-N 1 2 247.342 2.134 20 0 BEADLO C[C@H]1C[C@H](C(=O)NCc2c[nH+]c[nH]2)C[C@@H](C)C1 ZINC000334466447 386125836 /nfs/dbraw/zinc/12/58/36/386125836.db2.gz DHOOVHJSVBBASY-URLYPYJESA-N 1 2 235.331 2.098 20 0 BEADLO C[C@H]1C[C@H](C(=O)NCc2c[nH]c[nH+]2)C[C@@H](C)C1 ZINC000334466447 386125843 /nfs/dbraw/zinc/12/58/43/386125843.db2.gz DHOOVHJSVBBASY-URLYPYJESA-N 1 2 235.331 2.098 20 0 BEADLO CO[C@@H](C[N@H+](C)Cc1ncc[nH]1)c1ccccc1 ZINC000647929832 386126063 /nfs/dbraw/zinc/12/60/63/386126063.db2.gz FVVJNJGLNPMBTP-ZDUSSCGKSA-N 1 2 245.326 2.229 20 0 BEADLO CO[C@@H](C[N@@H+](C)Cc1ncc[nH]1)c1ccccc1 ZINC000647929832 386126068 /nfs/dbraw/zinc/12/60/68/386126068.db2.gz FVVJNJGLNPMBTP-ZDUSSCGKSA-N 1 2 245.326 2.229 20 0 BEADLO C[C@H](F)CCNc1cc(N2CCCC2)nc[nH+]1 ZINC000338756058 386127111 /nfs/dbraw/zinc/12/71/11/386127111.db2.gz PSXKPRNLDWONNU-JTQLQIEISA-N 1 2 238.310 2.237 20 0 BEADLO C[C@H](F)CCNc1cc(N2CCCC2)[nH+]cn1 ZINC000338756058 386127120 /nfs/dbraw/zinc/12/71/20/386127120.db2.gz PSXKPRNLDWONNU-JTQLQIEISA-N 1 2 238.310 2.237 20 0 BEADLO CC[C@H]1CCC[C@H]1NC(=O)CCc1[nH]cc[nH+]1 ZINC000287528958 386131191 /nfs/dbraw/zinc/13/11/91/386131191.db2.gz BPOFHVMECAMHKD-WDEREUQCSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@H]1CCC[C@@H]1NC(=O)CCc1[nH]cc[nH+]1 ZINC000287528955 386131288 /nfs/dbraw/zinc/13/12/88/386131288.db2.gz BPOFHVMECAMHKD-QWRGUYRKSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@@H]1CCC[C@@H]1NC(=O)CCc1[nH]cc[nH+]1 ZINC000287528952 386131957 /nfs/dbraw/zinc/13/19/57/386131957.db2.gz BPOFHVMECAMHKD-MNOVXSKESA-N 1 2 235.331 2.037 20 0 BEADLO CCO[C@@H](C)c1noc(C[NH+]2CCCCC2)n1 ZINC000076715148 386138436 /nfs/dbraw/zinc/13/84/36/386138436.db2.gz FXXVNONDDZLEPW-JTQLQIEISA-N 1 2 239.319 2.153 20 0 BEADLO Cc1cc(NC(=O)[C@@]2(C)CC2(F)F)c(C)c[nH+]1 ZINC000643311704 386189471 /nfs/dbraw/zinc/18/94/71/386189471.db2.gz YNYNTPCULSKQTC-LLVKDONJSA-N 1 2 240.253 2.104 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@H](CO)c2ccccc2)no1 ZINC000264011141 386201476 /nfs/dbraw/zinc/20/14/76/386201476.db2.gz IUIZALIDYATHII-CQSZACIVSA-N 1 2 246.310 2.148 20 0 BEADLO Cc1cc(C[N@H+](C)[C@H](CO)c2ccccc2)no1 ZINC000264011141 386201483 /nfs/dbraw/zinc/20/14/83/386201483.db2.gz IUIZALIDYATHII-CQSZACIVSA-N 1 2 246.310 2.148 20 0 BEADLO CC[C@H](C)c1csc([C@@H]2COCC[NH2+]2)n1 ZINC000226468320 386208443 /nfs/dbraw/zinc/20/84/43/386208443.db2.gz MKLOQTVWJNKVDU-IUCAKERBSA-N 1 2 226.345 2.318 20 0 BEADLO C[C@H](C[N@H+](C)Cc1nnc[nH]1)C1CCCCC1 ZINC000339017994 386211793 /nfs/dbraw/zinc/21/17/93/386211793.db2.gz YJKDUZCHMUHNAC-LLVKDONJSA-N 1 2 236.363 2.453 20 0 BEADLO C[C@H](C[N@@H+](C)Cc1nnc[nH]1)C1CCCCC1 ZINC000339017994 386211795 /nfs/dbraw/zinc/21/17/95/386211795.db2.gz YJKDUZCHMUHNAC-LLVKDONJSA-N 1 2 236.363 2.453 20 0 BEADLO CC[C@@H](NC(=O)CCn1cc[nH+]c1)[C@@H]1CC1(C)C ZINC000416072958 386214713 /nfs/dbraw/zinc/21/47/13/386214713.db2.gz FVQBBQNCOQKXLE-NWDGAFQWSA-N 1 2 249.358 2.214 20 0 BEADLO CN(C)c1ccccc1C[N@H+](C)Cc1cnc[nH]1 ZINC000288569473 386217391 /nfs/dbraw/zinc/21/73/91/386217391.db2.gz BFSHSGYFPNIWLG-UHFFFAOYSA-N 1 2 244.342 2.108 20 0 BEADLO CN(C)c1ccccc1C[N@@H+](C)Cc1cnc[nH]1 ZINC000288569473 386217396 /nfs/dbraw/zinc/21/73/96/386217396.db2.gz BFSHSGYFPNIWLG-UHFFFAOYSA-N 1 2 244.342 2.108 20 0 BEADLO CN(C)c1ccccc1C[N@H+](C)Cc1c[nH]cn1 ZINC000288569473 386217401 /nfs/dbraw/zinc/21/74/01/386217401.db2.gz BFSHSGYFPNIWLG-UHFFFAOYSA-N 1 2 244.342 2.108 20 0 BEADLO CN(C)c1ccccc1C[N@@H+](C)Cc1c[nH]cn1 ZINC000288569473 386217410 /nfs/dbraw/zinc/21/74/10/386217410.db2.gz BFSHSGYFPNIWLG-UHFFFAOYSA-N 1 2 244.342 2.108 20 0 BEADLO CC[C@@H]1CCC[C@H]1CNC(=O)CCn1cc[nH+]c1 ZINC000452523544 386231620 /nfs/dbraw/zinc/23/16/20/386231620.db2.gz GGGLLQAQLURPSZ-OLZOCXBDSA-N 1 2 249.358 2.216 20 0 BEADLO CC(C)C(C)(C)CNC(=O)CCc1[nH]cc[nH+]1 ZINC000288821274 386235003 /nfs/dbraw/zinc/23/50/03/386235003.db2.gz COESXVYMNFXJAR-UHFFFAOYSA-N 1 2 237.347 2.141 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CCCc3occc3C2)o1 ZINC000288852412 386236289 /nfs/dbraw/zinc/23/62/89/386236289.db2.gz PHMAEUHQOSVNJF-VIFPVBQESA-N 1 2 247.298 2.480 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CCCc3occc3C2)o1 ZINC000288852412 386236292 /nfs/dbraw/zinc/23/62/92/386236292.db2.gz PHMAEUHQOSVNJF-VIFPVBQESA-N 1 2 247.298 2.480 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@H](C)C(F)(F)F ZINC000288984530 386248576 /nfs/dbraw/zinc/24/85/76/386248576.db2.gz ZJYIWFCZDHBDDA-ZETCQYMHSA-N 1 2 247.220 2.462 20 0 BEADLO c1cn2cc(-c3nc(C4CC4)no3)ccc2[nH+]1 ZINC000264608883 386253070 /nfs/dbraw/zinc/25/30/70/386253070.db2.gz NIAUETHSFCJSNG-UHFFFAOYSA-N 1 2 226.239 2.262 20 0 BEADLO Cc1c[nH]nc1NC(=O)Nc1ccc(C)[nH+]c1C ZINC000289052731 386255828 /nfs/dbraw/zinc/25/58/28/386255828.db2.gz LGSNKHMOOYOLDL-UHFFFAOYSA-N 1 2 245.286 2.374 20 0 BEADLO CC[C@@H](NC(=O)Cc1[nH]c[nH+]c1C)[C@H]1CC1(C)C ZINC000416279623 386256723 /nfs/dbraw/zinc/25/67/23/386256723.db2.gz URMHCOLBUNGUTA-GHMZBOCLSA-N 1 2 249.358 2.202 20 0 BEADLO CC[C@@H](NC(=O)Cc1[nH+]c[nH]c1C)[C@H]1CC1(C)C ZINC000416279623 386256729 /nfs/dbraw/zinc/25/67/29/386256729.db2.gz URMHCOLBUNGUTA-GHMZBOCLSA-N 1 2 249.358 2.202 20 0 BEADLO CCc1ncc(C[N@@H+]2CCOC(C)(C)[C@@H]2C)cn1 ZINC000414390689 386257091 /nfs/dbraw/zinc/25/70/91/386257091.db2.gz AROMIJUQASVLKN-NSHDSACASA-N 1 2 249.358 2.038 20 0 BEADLO CCc1ncc(C[N@H+]2CCOC(C)(C)[C@@H]2C)cn1 ZINC000414390689 386257095 /nfs/dbraw/zinc/25/70/95/386257095.db2.gz AROMIJUQASVLKN-NSHDSACASA-N 1 2 249.358 2.038 20 0 BEADLO COC1CC(Nc2ccc(N3CCCC3)c[nH+]2)C1 ZINC000347199455 386280960 /nfs/dbraw/zinc/28/09/60/386280960.db2.gz XTSXSJSZAGAIBO-UHFFFAOYSA-N 1 2 247.342 2.271 20 0 BEADLO Cn1ncc2c1CCC[C@@H]2Nc1cccc[nH+]1 ZINC000264914429 386284205 /nfs/dbraw/zinc/28/42/05/386284205.db2.gz KGOKEWIAXPJVCL-NSHDSACASA-N 1 2 228.299 2.305 20 0 BEADLO CC[C@@H](C)CONC(=O)Nc1cc[nH+]c(C)c1 ZINC000297897282 386284327 /nfs/dbraw/zinc/28/43/27/386284327.db2.gz XHJBABODGQNEDF-SECBINFHSA-N 1 2 237.303 2.489 20 0 BEADLO CC(C)(C)C[C@@H]1CC[N@H+](Cc2cn[nH]n2)C1 ZINC000452086371 386287241 /nfs/dbraw/zinc/28/72/41/386287241.db2.gz XMBNNGZQQFZJQZ-JTQLQIEISA-N 1 2 222.336 2.063 20 0 BEADLO Cc1cnc(C[N@H+](C)CCC(F)(F)F)nc1 ZINC000336667483 386295581 /nfs/dbraw/zinc/29/55/81/386295581.db2.gz GOUGCXHFSSIXSP-UHFFFAOYSA-N 1 2 233.237 2.169 20 0 BEADLO Cc1cnc(C[N@@H+](C)CCC(F)(F)F)nc1 ZINC000336667483 386295589 /nfs/dbraw/zinc/29/55/89/386295589.db2.gz GOUGCXHFSSIXSP-UHFFFAOYSA-N 1 2 233.237 2.169 20 0 BEADLO Cc1cnn(CC[N@H+](CC(F)F)C(C)C)c1 ZINC000336667878 386296691 /nfs/dbraw/zinc/29/66/91/386296691.db2.gz PMOYXQWDQSUZHY-UHFFFAOYSA-N 1 2 231.290 2.167 20 0 BEADLO Cc1cnn(CC[N@@H+](CC(F)F)C(C)C)c1 ZINC000336667878 386296694 /nfs/dbraw/zinc/29/66/94/386296694.db2.gz PMOYXQWDQSUZHY-UHFFFAOYSA-N 1 2 231.290 2.167 20 0 BEADLO Cc1ccc(N[C@@H](C)c2[nH+]ccn2C)cn1 ZINC000164790182 386298677 /nfs/dbraw/zinc/29/86/77/386298677.db2.gz OBLOKDHYDLUXFG-JTQLQIEISA-N 1 2 216.288 2.297 20 0 BEADLO Cc1oncc1C[N@H+](C)CCC(F)(F)F ZINC000347301574 386306070 /nfs/dbraw/zinc/30/60/70/386306070.db2.gz OVWGDIPVMPLDPR-UHFFFAOYSA-N 1 2 222.210 2.367 20 0 BEADLO Cc1oncc1C[N@@H+](C)CCC(F)(F)F ZINC000347301574 386306075 /nfs/dbraw/zinc/30/60/75/386306075.db2.gz OVWGDIPVMPLDPR-UHFFFAOYSA-N 1 2 222.210 2.367 20 0 BEADLO Cc1cn[nH]c1C[NH2+]Cc1cc(F)ccc1F ZINC000289467117 386309867 /nfs/dbraw/zinc/30/98/67/386309867.db2.gz IRVXLHPFDGGLDQ-UHFFFAOYSA-N 1 2 237.253 2.286 20 0 BEADLO Cc1c[nH]nc1C[NH2+]Cc1cc(F)ccc1F ZINC000289467117 386309872 /nfs/dbraw/zinc/30/98/72/386309872.db2.gz IRVXLHPFDGGLDQ-UHFFFAOYSA-N 1 2 237.253 2.286 20 0 BEADLO COC[C@@H]([NH2+]Cc1[nH]ncc1C)c1ccc(C)o1 ZINC000289470208 386311632 /nfs/dbraw/zinc/31/16/32/386311632.db2.gz JADOEFIASARVBH-GFCCVEGCSA-N 1 2 249.314 2.097 20 0 BEADLO COC[C@@H]([NH2+]Cc1n[nH]cc1C)c1ccc(C)o1 ZINC000289470208 386311637 /nfs/dbraw/zinc/31/16/37/386311637.db2.gz JADOEFIASARVBH-GFCCVEGCSA-N 1 2 249.314 2.097 20 0 BEADLO C[N@H+](Cc1noc(C2CC2)n1)CC(C)(C)C ZINC000336669913 386313821 /nfs/dbraw/zinc/31/38/21/386313821.db2.gz IDKNBIXTUNAJBU-UHFFFAOYSA-N 1 2 223.320 2.425 20 0 BEADLO C[N@@H+](Cc1noc(C2CC2)n1)CC(C)(C)C ZINC000336669913 386313826 /nfs/dbraw/zinc/31/38/26/386313826.db2.gz IDKNBIXTUNAJBU-UHFFFAOYSA-N 1 2 223.320 2.425 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@H](C)c2ccccc2)c[nH+]1 ZINC000264742716 386265472 /nfs/dbraw/zinc/26/54/72/386265472.db2.gz RNVOVKOZAQTQGH-JTQLQIEISA-N 1 2 243.310 2.252 20 0 BEADLO CCOc1nnc(C[N@@H+]2CC[C@@H](C)[C@H]2C)s1 ZINC000336659582 386276898 /nfs/dbraw/zinc/27/68/98/386276898.db2.gz ADAIPPBRZIWPSQ-RKDXNWHRSA-N 1 2 241.360 2.167 20 0 BEADLO CCOc1nnc(C[N@H+]2CC[C@@H](C)[C@H]2C)s1 ZINC000336659582 386276901 /nfs/dbraw/zinc/27/69/01/386276901.db2.gz ADAIPPBRZIWPSQ-RKDXNWHRSA-N 1 2 241.360 2.167 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccco2)C[C@H](C)[S@@]1=O ZINC000289254324 386277228 /nfs/dbraw/zinc/27/72/28/386277228.db2.gz FHNYPQURCVIEKR-IETSOEAISA-N 1 2 241.356 2.011 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccco2)C[C@H](C)[S@@]1=O ZINC000289254324 386277231 /nfs/dbraw/zinc/27/72/31/386277231.db2.gz FHNYPQURCVIEKR-IETSOEAISA-N 1 2 241.356 2.011 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CCCc3occc32)c[nH+]1 ZINC000264874031 386277398 /nfs/dbraw/zinc/27/73/98/386277398.db2.gz RSGGPLVHUZQCNE-SNVBAGLBSA-N 1 2 245.282 2.119 20 0 BEADLO C[N@H+](Cc1ccco1)Cc1ccc(F)cn1 ZINC000276139465 386277830 /nfs/dbraw/zinc/27/78/30/386277830.db2.gz CISNCUYDQILOIO-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO C[N@@H+](Cc1ccco1)Cc1ccc(F)cn1 ZINC000276139465 386277835 /nfs/dbraw/zinc/27/78/35/386277835.db2.gz CISNCUYDQILOIO-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO CCOc1nnc(C[N@H+](C)[C@H](C)CC)s1 ZINC000336644636 386279222 /nfs/dbraw/zinc/27/92/22/386279222.db2.gz GVDPTDKCDCYBHZ-MRVPVSSYSA-N 1 2 229.349 2.167 20 0 BEADLO CCOc1nnc(C[N@@H+](C)[C@H](C)CC)s1 ZINC000336644636 386279224 /nfs/dbraw/zinc/27/92/24/386279224.db2.gz GVDPTDKCDCYBHZ-MRVPVSSYSA-N 1 2 229.349 2.167 20 0 BEADLO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ncnn2C)o1 ZINC000276535121 386339976 /nfs/dbraw/zinc/33/99/76/386339976.db2.gz DABDLHLDDAXBGK-VHSXEESVSA-N 1 2 234.303 2.128 20 0 BEADLO CC(C)CC(=O)N[C@H](c1[nH]cc[nH+]1)C(C)C ZINC000276549424 386343297 /nfs/dbraw/zinc/34/32/97/386343297.db2.gz GAAYFUPYISXHON-NSHDSACASA-N 1 2 223.320 2.269 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1nc2ccccc2o1 ZINC000339289581 386343519 /nfs/dbraw/zinc/34/35/19/386343519.db2.gz FMBRSIQOZRMULP-SNVBAGLBSA-N 1 2 232.283 2.049 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1nc2ccccc2o1 ZINC000339289581 386343521 /nfs/dbraw/zinc/34/35/21/386343521.db2.gz FMBRSIQOZRMULP-SNVBAGLBSA-N 1 2 232.283 2.049 20 0 BEADLO Cc1ccc(C(=O)N[C@H](c2[nH]cc[nH+]2)C(C)C)o1 ZINC000276560245 386344159 /nfs/dbraw/zinc/34/41/59/386344159.db2.gz HJIMBJZBKPTUFW-NSHDSACASA-N 1 2 247.298 2.438 20 0 BEADLO CCOc1nnc(C[N@H+](CC)CC(C)C)s1 ZINC000336686908 386347995 /nfs/dbraw/zinc/34/79/95/386347995.db2.gz WXAKHVFXLMXXFR-UHFFFAOYSA-N 1 2 243.376 2.415 20 0 BEADLO CCOc1nnc(C[N@@H+](CC)CC(C)C)s1 ZINC000336686908 386347999 /nfs/dbraw/zinc/34/79/99/386347999.db2.gz WXAKHVFXLMXXFR-UHFFFAOYSA-N 1 2 243.376 2.415 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1c(F)cccc1F ZINC000339283845 386354016 /nfs/dbraw/zinc/35/40/16/386354016.db2.gz QGGIAIUMDDKLAK-SECBINFHSA-N 1 2 227.254 2.186 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1c(F)cccc1F ZINC000339283845 386354021 /nfs/dbraw/zinc/35/40/21/386354021.db2.gz QGGIAIUMDDKLAK-SECBINFHSA-N 1 2 227.254 2.186 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccoc2C)nn1C ZINC000336689502 386354597 /nfs/dbraw/zinc/35/45/97/386354597.db2.gz HREURZYGTSWZRE-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccoc2C)nn1C ZINC000336689502 386354599 /nfs/dbraw/zinc/35/45/99/386354599.db2.gz HREURZYGTSWZRE-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1cccc(F)c1)c1ncnn1C ZINC000276624735 386354666 /nfs/dbraw/zinc/35/46/66/386354666.db2.gz NFWCENJVCWHOHH-UWVGGRQHSA-N 1 2 248.305 2.366 20 0 BEADLO CC(C)[C@@H](NC(=O)C1CCCC1)c1[nH]cc[nH+]1 ZINC000276616726 386354678 /nfs/dbraw/zinc/35/46/78/386354678.db2.gz NLTBQXABDFHVIR-LLVKDONJSA-N 1 2 235.331 2.413 20 0 BEADLO CN(C)c1nc(C[N@H+](C)CC(C)(C)C)ns1 ZINC000336684811 386356968 /nfs/dbraw/zinc/35/69/68/386356968.db2.gz UXNRJUPHYOTTMR-UHFFFAOYSA-N 1 2 242.392 2.082 20 0 BEADLO CN(C)c1nc(C[N@@H+](C)CC(C)(C)C)ns1 ZINC000336684811 386356973 /nfs/dbraw/zinc/35/69/73/386356973.db2.gz UXNRJUPHYOTTMR-UHFFFAOYSA-N 1 2 242.392 2.082 20 0 BEADLO Cc1ccnc(C[N@H+]2CC[C@@H](OCC(C)C)C2)n1 ZINC000336690480 386357271 /nfs/dbraw/zinc/35/72/71/386357271.db2.gz BSIVRGWTMWZWEU-CYBMUJFWSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1ccnc(C[N@@H+]2CC[C@@H](OCC(C)C)C2)n1 ZINC000336690480 386357273 /nfs/dbraw/zinc/35/72/73/386357273.db2.gz BSIVRGWTMWZWEU-CYBMUJFWSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)Nc1ccc(F)cc1 ZINC000335272662 386363405 /nfs/dbraw/zinc/36/34/05/386363405.db2.gz SESYUAUHXICFHO-UHFFFAOYSA-N 1 2 233.246 2.038 20 0 BEADLO Cc1ccc(F)cc1C[NH2+][C@@H](C)c1ncnn1C ZINC000276707630 386367602 /nfs/dbraw/zinc/36/76/02/386367602.db2.gz OMJUHXLZVNSTSZ-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO CCN(C)C(=O)c1cccc(Cn2cc[nH+]c2)c1 ZINC000298685819 386370764 /nfs/dbraw/zinc/37/07/64/386370764.db2.gz XVSLSRRCZILLEW-UHFFFAOYSA-N 1 2 243.310 2.023 20 0 BEADLO CCCc1nc(C[N@@H+]2C[C@@H](C)C[C@H]2C)no1 ZINC000336690350 386371208 /nfs/dbraw/zinc/37/12/08/386371208.db2.gz AUHQGUKYCWSVRN-VHSXEESVSA-N 1 2 223.320 2.252 20 0 BEADLO CCCc1nc(C[N@H+]2C[C@@H](C)C[C@H]2C)no1 ZINC000336690350 386371215 /nfs/dbraw/zinc/37/12/15/386371215.db2.gz AUHQGUKYCWSVRN-VHSXEESVSA-N 1 2 223.320 2.252 20 0 BEADLO CCCN(CCC)C(=O)C[N@@H+]1CC[C@](C)(F)C1 ZINC000347380882 386373951 /nfs/dbraw/zinc/37/39/51/386373951.db2.gz NDSHKQGHSUPUOC-ZDUSSCGKSA-N 1 2 244.354 2.069 20 0 BEADLO CCCN(CCC)C(=O)C[N@H+]1CC[C@](C)(F)C1 ZINC000347380882 386373959 /nfs/dbraw/zinc/37/39/59/386373959.db2.gz NDSHKQGHSUPUOC-ZDUSSCGKSA-N 1 2 244.354 2.069 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)o1 ZINC000289934157 386374702 /nfs/dbraw/zinc/37/47/02/386374702.db2.gz UZHXJKOZLNBRJN-QMMMGPOBSA-N 1 2 230.258 2.460 20 0 BEADLO Cc1cnc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)o1 ZINC000289934157 386374707 /nfs/dbraw/zinc/37/47/07/386374707.db2.gz UZHXJKOZLNBRJN-QMMMGPOBSA-N 1 2 230.258 2.460 20 0 BEADLO C[N@H+](CCC(F)(F)F)Cc1ccon1 ZINC000265826543 386375406 /nfs/dbraw/zinc/37/54/06/386375406.db2.gz JNMNIGUIHHBQOI-UHFFFAOYSA-N 1 2 208.183 2.059 20 0 BEADLO C[N@@H+](CCC(F)(F)F)Cc1ccon1 ZINC000265826543 386375410 /nfs/dbraw/zinc/37/54/10/386375410.db2.gz JNMNIGUIHHBQOI-UHFFFAOYSA-N 1 2 208.183 2.059 20 0 BEADLO Fc1cccc(C[N@H+](C2CC2)C2COC2)c1 ZINC000289965901 386377622 /nfs/dbraw/zinc/37/76/22/386377622.db2.gz IUYWJZBLGUWRHH-UHFFFAOYSA-N 1 2 221.275 2.189 20 0 BEADLO Fc1cccc(C[N@@H+](C2CC2)C2COC2)c1 ZINC000289965901 386377629 /nfs/dbraw/zinc/37/76/29/386377629.db2.gz IUYWJZBLGUWRHH-UHFFFAOYSA-N 1 2 221.275 2.189 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@H]1[C@H](C)CCC[C@@H]1C ZINC000298736471 386378582 /nfs/dbraw/zinc/37/85/82/386378582.db2.gz XSRAQCGRYZMQSV-MSRIBSCDSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@H]1[C@H](C)CCC[C@@H]1C ZINC000298736471 386378588 /nfs/dbraw/zinc/37/85/88/386378588.db2.gz XSRAQCGRYZMQSV-MSRIBSCDSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1ccc(C[N@@H+]2CCOC[C@H]2CC(F)F)o1 ZINC000289972862 386380171 /nfs/dbraw/zinc/38/01/71/386380171.db2.gz ZMLIPPZDHNIXDQ-SNVBAGLBSA-N 1 2 245.269 2.444 20 0 BEADLO Cc1ccc(C[N@H+]2CCOC[C@H]2CC(F)F)o1 ZINC000289972862 386380175 /nfs/dbraw/zinc/38/01/75/386380175.db2.gz ZMLIPPZDHNIXDQ-SNVBAGLBSA-N 1 2 245.269 2.444 20 0 BEADLO CCCC[N@H+](Cc1csnn1)C1CC1 ZINC000336699542 386383592 /nfs/dbraw/zinc/38/35/92/386383592.db2.gz WNBBSOOOKXDMOM-UHFFFAOYSA-N 1 2 211.334 2.303 20 0 BEADLO CCCC[N@@H+](Cc1csnn1)C1CC1 ZINC000336699542 386383599 /nfs/dbraw/zinc/38/35/99/386383599.db2.gz WNBBSOOOKXDMOM-UHFFFAOYSA-N 1 2 211.334 2.303 20 0 BEADLO CC(C)[C@@H]1CC[N@H+](Cc2noc(C3CC3)n2)C1 ZINC000336683381 386331099 /nfs/dbraw/zinc/33/10/99/386331099.db2.gz DRZHQYYPAZPZQE-LLVKDONJSA-N 1 2 235.331 2.425 20 0 BEADLO CC(C)[C@@H]1CC[N@@H+](Cc2noc(C3CC3)n2)C1 ZINC000336683381 386331102 /nfs/dbraw/zinc/33/11/02/386331102.db2.gz DRZHQYYPAZPZQE-LLVKDONJSA-N 1 2 235.331 2.425 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1c[nH]nc1C1CC1 ZINC000276492126 386332657 /nfs/dbraw/zinc/33/26/57/386332657.db2.gz VHWPASOOTPAAFU-UHFFFAOYSA-N 1 2 242.282 2.243 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1cn[nH]c1C1CC1 ZINC000276492126 386332663 /nfs/dbraw/zinc/33/26/63/386332663.db2.gz VHWPASOOTPAAFU-UHFFFAOYSA-N 1 2 242.282 2.243 20 0 BEADLO CC[C@H]1CCCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000276495841 386335892 /nfs/dbraw/zinc/33/58/92/386335892.db2.gz HCCZJVJMCHTXJS-SYTKJHMZSA-N 1 2 233.315 2.214 20 0 BEADLO CCC1(CNC(=O)CCc2c[nH+]cn2C)CCC1 ZINC000276510853 386339249 /nfs/dbraw/zinc/33/92/49/386339249.db2.gz DVFBUDBXRDYAQP-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO C[C@H]1SCC[C@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000645402413 386437246 /nfs/dbraw/zinc/43/72/46/386437246.db2.gz RYYLEXIQFPSSEX-PSASIEDQSA-N 1 2 235.356 2.082 20 0 BEADLO CC[C@@H](C)[N@H+](CC(=O)OC)Cc1ccco1 ZINC000299356029 386443417 /nfs/dbraw/zinc/44/34/17/386443417.db2.gz CVVRQPYKGZEZLH-SNVBAGLBSA-N 1 2 225.288 2.053 20 0 BEADLO CC[C@@H](C)[N@@H+](CC(=O)OC)Cc1ccco1 ZINC000299356029 386443423 /nfs/dbraw/zinc/44/34/23/386443423.db2.gz CVVRQPYKGZEZLH-SNVBAGLBSA-N 1 2 225.288 2.053 20 0 BEADLO CC[N@H+](CCO)Cc1ccnc(Cl)c1Cl ZINC000290484269 386443924 /nfs/dbraw/zinc/44/39/24/386443924.db2.gz RCZLROZDTZNLQA-UHFFFAOYSA-N 1 2 249.141 2.203 20 0 BEADLO CC[N@@H+](CCO)Cc1ccnc(Cl)c1Cl ZINC000290484269 386443929 /nfs/dbraw/zinc/44/39/29/386443929.db2.gz RCZLROZDTZNLQA-UHFFFAOYSA-N 1 2 249.141 2.203 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000290543209 386448732 /nfs/dbraw/zinc/44/87/32/386448732.db2.gz WGMYFEPDWMDBTA-SECBINFHSA-N 1 2 247.264 2.492 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000290543209 386448736 /nfs/dbraw/zinc/44/87/36/386448736.db2.gz WGMYFEPDWMDBTA-SECBINFHSA-N 1 2 247.264 2.492 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000290543209 386448740 /nfs/dbraw/zinc/44/87/40/386448740.db2.gz WGMYFEPDWMDBTA-SECBINFHSA-N 1 2 247.264 2.492 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000290543209 386448745 /nfs/dbraw/zinc/44/87/45/386448745.db2.gz WGMYFEPDWMDBTA-SECBINFHSA-N 1 2 247.264 2.492 20 0 BEADLO CC1(C(=O)NCCc2[nH]cc[nH+]2)CCCCCC1 ZINC000181985772 386389648 /nfs/dbraw/zinc/38/96/48/386389648.db2.gz ZCCMHWFMTGQAKM-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO Cc1occc1C[N@@H+](C)Cc1cnc(C)cn1 ZINC000336703575 386390117 /nfs/dbraw/zinc/39/01/17/386390117.db2.gz MTMJUZRMOKGRQR-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1occc1C[N@H+](C)Cc1cnc(C)cn1 ZINC000336703575 386390124 /nfs/dbraw/zinc/39/01/24/386390124.db2.gz MTMJUZRMOKGRQR-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cc(C)c(CNC(=O)N[C@@H]2CC2(C)C)c[nH+]1 ZINC000334497718 386391764 /nfs/dbraw/zinc/39/17/64/386391764.db2.gz JHMJWEBIALBZMP-GFCCVEGCSA-N 1 2 247.342 2.296 20 0 BEADLO CSCCC(=O)Nc1cccc2[nH+]ccn21 ZINC000266053898 386393087 /nfs/dbraw/zinc/39/30/87/386393087.db2.gz HQSQKYDWBGDDAX-UHFFFAOYSA-N 1 2 235.312 2.026 20 0 BEADLO Cc1ccnc(C[N@H+]2CCOC[C@@H]2CC(C)C)n1 ZINC000336704191 386393543 /nfs/dbraw/zinc/39/35/43/386393543.db2.gz IVNUKURRDRZASW-ZDUSSCGKSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCOC[C@@H]2CC(C)C)n1 ZINC000336704191 386393547 /nfs/dbraw/zinc/39/35/47/386393547.db2.gz IVNUKURRDRZASW-ZDUSSCGKSA-N 1 2 249.358 2.032 20 0 BEADLO O=C(CC1CC1)Nc1cccc2[nH+]ccn21 ZINC000266078600 386396562 /nfs/dbraw/zinc/39/65/62/386396562.db2.gz KTNDQZRRCHCEJC-UHFFFAOYSA-N 1 2 215.256 2.073 20 0 BEADLO Cc1cc(N2CC[C@H](C(C)(C)C)[C@H](O)C2)nc[nH+]1 ZINC000347424501 386397473 /nfs/dbraw/zinc/39/74/73/386397473.db2.gz TUHOPKVMJXYMNT-NWDGAFQWSA-N 1 2 249.358 2.018 20 0 BEADLO CC[C@H]1COCCN1Cc1[nH+]ccn1C(C)C ZINC000336705702 386398630 /nfs/dbraw/zinc/39/86/30/386398630.db2.gz NVEZYDPYPFSRED-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO CCCc1nc(C[N@H+](CC)C2CCC2)no1 ZINC000336700755 386400070 /nfs/dbraw/zinc/40/00/70/386400070.db2.gz LGIOICWONILIFQ-UHFFFAOYSA-N 1 2 223.320 2.397 20 0 BEADLO CCCc1nc(C[N@@H+](CC)C2CCC2)no1 ZINC000336700755 386400076 /nfs/dbraw/zinc/40/00/76/386400076.db2.gz LGIOICWONILIFQ-UHFFFAOYSA-N 1 2 223.320 2.397 20 0 BEADLO CCCc1nc(C[NH+]2C[C@H](C)[C@@H](C)C2)no1 ZINC000336701935 386403577 /nfs/dbraw/zinc/40/35/77/386403577.db2.gz MIWQAIYFSQZFHA-UWVGGRQHSA-N 1 2 223.320 2.110 20 0 BEADLO Cc1nocc1C[NH2+][C@@H](C)c1ccncc1F ZINC000339397180 386409165 /nfs/dbraw/zinc/40/91/65/386409165.db2.gz QIJIGBGHZLFQGA-VIFPVBQESA-N 1 2 235.262 2.368 20 0 BEADLO Cc1ccc(N[C@H](C)Cn2cccn2)c(C)[nH+]1 ZINC000347412101 386417946 /nfs/dbraw/zinc/41/79/46/386417946.db2.gz NHWGQTXHLOQECS-LLVKDONJSA-N 1 2 230.315 2.396 20 0 BEADLO Cc1cnc(C[N@@H+](C)[C@H](C)c2ccccn2)nc1 ZINC000336709579 386421056 /nfs/dbraw/zinc/42/10/56/386421056.db2.gz MCTZIACMIRSUAS-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cnc(C[N@H+](C)[C@H](C)c2ccccn2)nc1 ZINC000336709579 386421060 /nfs/dbraw/zinc/42/10/60/386421060.db2.gz MCTZIACMIRSUAS-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H](C)C(C)(F)F ZINC000340338852 386424957 /nfs/dbraw/zinc/42/49/57/386424957.db2.gz IMRFZCDEEPPNGG-QMMMGPOBSA-N 1 2 242.269 2.296 20 0 BEADLO O=C(CC1CCC1)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000266316219 386425163 /nfs/dbraw/zinc/42/51/63/386425163.db2.gz VKFXLCCHWRDHBK-GFCCVEGCSA-N 1 2 247.342 2.306 20 0 BEADLO Cc1c[nH]nc1C[NH+]1CCC(C(F)(F)F)CC1 ZINC000290389400 386429768 /nfs/dbraw/zinc/42/97/68/386429768.db2.gz JFEWFHAKWMCXHB-UHFFFAOYSA-N 1 2 247.264 2.492 20 0 BEADLO Cc1cn[nH]c1C[NH+]1CCC(C(F)(F)F)CC1 ZINC000290389400 386429770 /nfs/dbraw/zinc/42/97/70/386429770.db2.gz JFEWFHAKWMCXHB-UHFFFAOYSA-N 1 2 247.264 2.492 20 0 BEADLO C[N@H+](Cc1cocn1)Cc1ccc(O)cc1 ZINC000290445532 386435540 /nfs/dbraw/zinc/43/55/40/386435540.db2.gz LZQKMEFJLOBKHS-UHFFFAOYSA-N 1 2 218.256 2.012 20 0 BEADLO C[N@@H+](Cc1cocn1)Cc1ccc(O)cc1 ZINC000290445532 386435544 /nfs/dbraw/zinc/43/55/44/386435544.db2.gz LZQKMEFJLOBKHS-UHFFFAOYSA-N 1 2 218.256 2.012 20 0 BEADLO CCC[C@H](C)C(=O)N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000339472420 386436425 /nfs/dbraw/zinc/43/64/25/386436425.db2.gz YMGDRPZMQPHWAM-NWDGAFQWSA-N 1 2 249.358 2.172 20 0 BEADLO CCc1ccccc1CC[N@H+](C)Cc1nnc[nH]1 ZINC000277796219 386467809 /nfs/dbraw/zinc/46/78/09/386467809.db2.gz TUCRJUUKKPTHHM-UHFFFAOYSA-N 1 2 244.342 2.042 20 0 BEADLO CCc1ccccc1CC[N@@H+](C)Cc1nnc[nH]1 ZINC000277796219 386467816 /nfs/dbraw/zinc/46/78/16/386467816.db2.gz TUCRJUUKKPTHHM-UHFFFAOYSA-N 1 2 244.342 2.042 20 0 BEADLO Cc1nc(C[NH+]2CCC(C)(C3CC3)CC2)no1 ZINC000335330311 386470238 /nfs/dbraw/zinc/47/02/38/386470238.db2.gz VMQOPTBPQOBNJN-UHFFFAOYSA-N 1 2 235.331 2.390 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nc(CC(F)(F)F)no2)[C@H]1C ZINC000339572620 386470804 /nfs/dbraw/zinc/47/08/04/386470804.db2.gz AQQCGXWFVYCIGK-RQJHMYQMSA-N 1 2 249.236 2.015 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nc(CC(F)(F)F)no2)[C@H]1C ZINC000339572620 386470815 /nfs/dbraw/zinc/47/08/15/386470815.db2.gz AQQCGXWFVYCIGK-RQJHMYQMSA-N 1 2 249.236 2.015 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C1(C)CCCCC1 ZINC000519522555 386471817 /nfs/dbraw/zinc/47/18/17/386471817.db2.gz GNDPUYZJPVTFKM-UHFFFAOYSA-N 1 2 249.358 2.490 20 0 BEADLO Cc1cccn2c(CNc3cccnn3)c[nH+]c12 ZINC000191839272 386475605 /nfs/dbraw/zinc/47/56/05/386475605.db2.gz GQDIZMGLQHVDIF-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO C[C@@H](CC[NH2+][C@@]1(C)CCOC1=O)c1ccccc1 ZINC000290779312 386475695 /nfs/dbraw/zinc/47/56/95/386475695.db2.gz CTTMCVBGAQZEPM-WFASDCNBSA-N 1 2 247.338 2.475 20 0 BEADLO C[C@H](C[NH2+][C@]1(C)CCOC1=O)Cc1ccccc1 ZINC000290864117 386482692 /nfs/dbraw/zinc/48/26/92/386482692.db2.gz JVRVBYHLXFREHF-SWLSCSKDSA-N 1 2 247.338 2.160 20 0 BEADLO CN(C(=O)c1ccc2[nH+]ccn2c1)C(C)(C)C ZINC000335430916 386487052 /nfs/dbraw/zinc/48/70/52/386487052.db2.gz PVKJFKQKORTELG-UHFFFAOYSA-N 1 2 231.299 2.205 20 0 BEADLO CC(C)[C@@H]([NH2+]C1CCOCC1)C(F)(F)F ZINC000336761216 386496665 /nfs/dbraw/zinc/49/66/65/386496665.db2.gz NCRKPUDPEFNYJP-SECBINFHSA-N 1 2 225.254 2.342 20 0 BEADLO c1cc(C[NH2+]Cc2cccc3c2CCCN3)[nH]n1 ZINC000415030161 386518771 /nfs/dbraw/zinc/51/87/71/386518771.db2.gz FWXMOIYDTKOVEN-UHFFFAOYSA-N 1 2 242.326 2.058 20 0 BEADLO O=C(CCn1cc[nH+]c1)N1CC[C@@H]2CCCC[C@@H]21 ZINC000335450520 386522949 /nfs/dbraw/zinc/52/29/49/386522949.db2.gz SBMJGMKVODOZQU-STQMWFEESA-N 1 2 247.342 2.064 20 0 BEADLO C[C@H](O)C[N@H+](C)Cc1nc(Cl)ccc1Cl ZINC000061631191 386524022 /nfs/dbraw/zinc/52/40/22/386524022.db2.gz VQUAAZMUDUQTLE-ZETCQYMHSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@H](O)C[N@@H+](C)Cc1nc(Cl)ccc1Cl ZINC000061631191 386524027 /nfs/dbraw/zinc/52/40/27/386524027.db2.gz VQUAAZMUDUQTLE-ZETCQYMHSA-N 1 2 249.141 2.201 20 0 BEADLO CC1(C)CC[N@H+](Cc2ccco2)CC[S@@]1=O ZINC000335451829 386525007 /nfs/dbraw/zinc/52/50/07/386525007.db2.gz VYEZJFOULDVGFK-INIZCTEOSA-N 1 2 241.356 2.013 20 0 BEADLO CC1(C)CC[N@@H+](Cc2ccco2)CC[S@@]1=O ZINC000335451829 386525016 /nfs/dbraw/zinc/52/50/16/386525016.db2.gz VYEZJFOULDVGFK-INIZCTEOSA-N 1 2 241.356 2.013 20 0 BEADLO Cc1nc(F)ccc1C[N@H+]1C[C@H](C)OC[C@H]1C ZINC000278442586 386525158 /nfs/dbraw/zinc/52/51/58/386525158.db2.gz LUCHLRPBXWAGTR-ZJUUUORDSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1nc(F)ccc1C[N@@H+]1C[C@H](C)OC[C@H]1C ZINC000278442586 386525167 /nfs/dbraw/zinc/52/51/67/386525167.db2.gz LUCHLRPBXWAGTR-ZJUUUORDSA-N 1 2 238.306 2.138 20 0 BEADLO CCOCC[C@@H](O)Cn1c(C)[nH+]c2ccccc21 ZINC000277604375 386453660 /nfs/dbraw/zinc/45/36/60/386453660.db2.gz XHCFXHINFLRJSA-GFCCVEGCSA-N 1 2 248.326 2.132 20 0 BEADLO COc1ncccc1C[N@@H+]1CC[C@@](C)(F)C1 ZINC000336302831 386456486 /nfs/dbraw/zinc/45/64/86/386456486.db2.gz GEIIMEFODJEJFF-GFCCVEGCSA-N 1 2 224.279 2.024 20 0 BEADLO COc1ncccc1C[N@H+]1CC[C@@](C)(F)C1 ZINC000336302831 386456491 /nfs/dbraw/zinc/45/64/91/386456491.db2.gz GEIIMEFODJEJFF-GFCCVEGCSA-N 1 2 224.279 2.024 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@H](C)O[C@H](C)[C@H]2C)cn1 ZINC000414437798 386462064 /nfs/dbraw/zinc/46/20/64/386462064.db2.gz QJVZXYZTRBPVPO-QJPTWQEYSA-N 1 2 249.358 2.037 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@H](C)O[C@H](C)[C@H]2C)cn1 ZINC000414437798 386462070 /nfs/dbraw/zinc/46/20/70/386462070.db2.gz QJVZXYZTRBPVPO-QJPTWQEYSA-N 1 2 249.358 2.037 20 0 BEADLO CCc1ncc(C[N@@H+]2CCOC[C@@]2(C)CC)cn1 ZINC000414439125 386463368 /nfs/dbraw/zinc/46/33/68/386463368.db2.gz WHJWZYFGBGHXOK-CQSZACIVSA-N 1 2 249.358 2.040 20 0 BEADLO CCc1ncc(C[N@H+]2CCOC[C@@]2(C)CC)cn1 ZINC000414439125 386463371 /nfs/dbraw/zinc/46/33/71/386463371.db2.gz WHJWZYFGBGHXOK-CQSZACIVSA-N 1 2 249.358 2.040 20 0 BEADLO C[C@]1(O)CCC[N@H+](Cc2cnc(Cl)s2)C1 ZINC000123937150 386574225 /nfs/dbraw/zinc/57/42/25/386574225.db2.gz XZBOYMBICJCZRV-JTQLQIEISA-N 1 2 246.763 2.143 20 0 BEADLO C[C@]1(O)CCC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC000123937150 386574231 /nfs/dbraw/zinc/57/42/31/386574231.db2.gz XZBOYMBICJCZRV-JTQLQIEISA-N 1 2 246.763 2.143 20 0 BEADLO C[C@@H](CC[NH2+]CC(F)(F)CN)c1ccccc1 ZINC000414921625 386579678 /nfs/dbraw/zinc/57/96/78/386579678.db2.gz AWXZIIRUZODAKN-NSHDSACASA-N 1 2 242.313 2.364 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@H](C)c1ccccc1 ZINC000278768211 386580705 /nfs/dbraw/zinc/58/07/05/386580705.db2.gz WVMILOARVFTZEH-SNVBAGLBSA-N 1 2 243.310 2.138 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@H](C)c1ccccc1 ZINC000278768211 386580708 /nfs/dbraw/zinc/58/07/08/386580708.db2.gz WVMILOARVFTZEH-SNVBAGLBSA-N 1 2 243.310 2.138 20 0 BEADLO COc1ccnc(C[NH2+][C@@H](C)c2ccccc2)n1 ZINC000450651361 386590131 /nfs/dbraw/zinc/59/01/31/386590131.db2.gz PFTYJAAXPSVGJG-NSHDSACASA-N 1 2 243.310 2.336 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C=C1CC[C@H](C)C1 ZINC000267875645 386595936 /nfs/dbraw/zinc/59/59/36/386595936.db2.gz MHQXWYPKRVYGJA-CAXXOGMASA-N 1 2 233.315 2.081 20 0 BEADLO CN(c1cc(C(F)(F)F)cc[nH+]1)[C@@H]1CCOC1 ZINC000267432404 386543278 /nfs/dbraw/zinc/54/32/78/386543278.db2.gz WXNKOGMLSMXJFN-SECBINFHSA-N 1 2 246.232 2.326 20 0 BEADLO CCC1(C(=O)NCCc2[nH]cc[nH+]2)CCCC1 ZINC000123231925 386547013 /nfs/dbraw/zinc/54/70/13/386547013.db2.gz ZREAMEYAALLTEB-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO O=C(CC1CCCCCC1)NCc1c[nH+]c[nH]1 ZINC000135829218 386549246 /nfs/dbraw/zinc/54/92/46/386549246.db2.gz CXKOGTDFIMPSRC-UHFFFAOYSA-N 1 2 235.331 2.386 20 0 BEADLO O=C(CC1CCCCCC1)NCc1c[nH]c[nH+]1 ZINC000135829218 386549254 /nfs/dbraw/zinc/54/92/54/386549254.db2.gz CXKOGTDFIMPSRC-UHFFFAOYSA-N 1 2 235.331 2.386 20 0 BEADLO C/C=C(\C)C(=O)NCc1cn2ccc(C)cc2[nH+]1 ZINC000267508893 386549284 /nfs/dbraw/zinc/54/92/84/386549284.db2.gz PDWYHEFSTGINNP-NYYWCZLTSA-N 1 2 243.310 2.225 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000278564122 386550146 /nfs/dbraw/zinc/55/01/46/386550146.db2.gz IPFNPPGLXYUOST-CYBMUJFWSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000278564122 386550150 /nfs/dbraw/zinc/55/01/50/386550150.db2.gz IPFNPPGLXYUOST-CYBMUJFWSA-N 1 2 246.314 2.352 20 0 BEADLO CNc1nc(NC2CC2)[nH+]c2ccccc21 ZINC000041146878 386551131 /nfs/dbraw/zinc/55/11/31/386551131.db2.gz DNFHCXFOTKBLJD-UHFFFAOYSA-N 1 2 214.272 2.246 20 0 BEADLO Cn1c2c(cccc2F)[nH]c1=[NH+][C@@H]1C[C@H]2C[C@H]2C1 ZINC000425311707 386555177 /nfs/dbraw/zinc/55/51/77/386555177.db2.gz YKCHHOAJZVEXEC-ILWJIGKKSA-N 1 2 245.301 2.345 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CCCc2occc2C1 ZINC000291526068 386555325 /nfs/dbraw/zinc/55/53/25/386555325.db2.gz JQPDOWDWKCHKJM-UHFFFAOYSA-N 1 2 231.299 2.260 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CCCc2occc2C1 ZINC000291526068 386555331 /nfs/dbraw/zinc/55/53/31/386555331.db2.gz JQPDOWDWKCHKJM-UHFFFAOYSA-N 1 2 231.299 2.260 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCCc2occc2C1 ZINC000291526068 386555334 /nfs/dbraw/zinc/55/53/34/386555334.db2.gz JQPDOWDWKCHKJM-UHFFFAOYSA-N 1 2 231.299 2.260 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCCc2occc2C1 ZINC000291526068 386555340 /nfs/dbraw/zinc/55/53/40/386555340.db2.gz JQPDOWDWKCHKJM-UHFFFAOYSA-N 1 2 231.299 2.260 20 0 BEADLO CC(=O)c1cccc(C[N@@H+]2CC[C@H](F)C2)c1 ZINC000335467209 386556803 /nfs/dbraw/zinc/55/68/03/386556803.db2.gz COEXJRWUZSJOTF-ZDUSSCGKSA-N 1 2 221.275 2.433 20 0 BEADLO CC(=O)c1cccc(C[N@H+]2CC[C@H](F)C2)c1 ZINC000335467209 386556806 /nfs/dbraw/zinc/55/68/06/386556806.db2.gz COEXJRWUZSJOTF-ZDUSSCGKSA-N 1 2 221.275 2.433 20 0 BEADLO CCc1ccc(C[N@@H+]2CC[C@H](F)C2)cn1 ZINC000335405543 386562367 /nfs/dbraw/zinc/56/23/67/386562367.db2.gz CKSWPPXPDOAOEP-NSHDSACASA-N 1 2 208.280 2.188 20 0 BEADLO CCc1ccc(C[N@H+]2CC[C@H](F)C2)cn1 ZINC000335405543 386562370 /nfs/dbraw/zinc/56/23/70/386562370.db2.gz CKSWPPXPDOAOEP-NSHDSACASA-N 1 2 208.280 2.188 20 0 BEADLO Cc1ccc(C)c(C[NH2+]Cc2ncccn2)c1 ZINC000519832403 386567716 /nfs/dbraw/zinc/56/77/16/386567716.db2.gz HYJUXWRIBUFAHS-UHFFFAOYSA-N 1 2 227.311 2.383 20 0 BEADLO CCC(=O)N1CC[N@@H+]([C@H]2CCc3ccccc32)C1 ZINC000644950816 386638909 /nfs/dbraw/zinc/63/89/09/386638909.db2.gz UNDXFCUVLCSBLW-AWEZNQCLSA-N 1 2 244.338 2.186 20 0 BEADLO CCC(=O)N1CC[N@H+]([C@H]2CCc3ccccc32)C1 ZINC000644950816 386638916 /nfs/dbraw/zinc/63/89/16/386638916.db2.gz UNDXFCUVLCSBLW-AWEZNQCLSA-N 1 2 244.338 2.186 20 0 BEADLO CC(C)n1ccc(CN[C@@H](C)c2[nH+]ccn2C)n1 ZINC000520267596 386641904 /nfs/dbraw/zinc/64/19/04/386641904.db2.gz RQGUAMRJRNKNSH-NSHDSACASA-N 1 2 247.346 2.048 20 0 BEADLO CC(C)n1ccc(C[NH2+][C@@H](C)c2nccn2C)n1 ZINC000520267596 386641910 /nfs/dbraw/zinc/64/19/10/386641910.db2.gz RQGUAMRJRNKNSH-NSHDSACASA-N 1 2 247.346 2.048 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1ccnn1C(C)C ZINC000337194886 386645050 /nfs/dbraw/zinc/64/50/50/386645050.db2.gz VPVAPYNYNAMCGK-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1ccnn1C(C)C ZINC000337194886 386645053 /nfs/dbraw/zinc/64/50/53/386645053.db2.gz VPVAPYNYNAMCGK-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO Cc1cc(C[NH+]2CC(O)(C(F)F)C2)c(C)s1 ZINC000335510496 386645570 /nfs/dbraw/zinc/64/55/70/386645570.db2.gz FIDKRODNCZUBFB-UHFFFAOYSA-N 1 2 247.310 2.177 20 0 BEADLO Cc1noc([C@@H](C)[NH2+]Cc2ccnn2C(C)C)n1 ZINC000337199925 386649946 /nfs/dbraw/zinc/64/99/46/386649946.db2.gz DXIZWEPOJAQBES-SECBINFHSA-N 1 2 249.318 2.006 20 0 BEADLO CC[C@@]1(C(C)C)C[C@@H]1NC(=O)CCn1cc[nH+]c1 ZINC000457279040 386613274 /nfs/dbraw/zinc/61/32/74/386613274.db2.gz LJHLHDDKAOIZIU-JSGCOSHPSA-N 1 2 249.358 2.214 20 0 BEADLO Cc1ccc(NC(=O)NC[C@@H]2C[C@H]2C)c(C)[nH+]1 ZINC000268038434 386614029 /nfs/dbraw/zinc/61/40/29/386614029.db2.gz RKQHWQZMGQNJHT-KCJUWKMLSA-N 1 2 233.315 2.476 20 0 BEADLO C[C@@H](NC(=O)CCc1[nH]cc[nH+]1)c1ccccc1 ZINC000279300612 386660342 /nfs/dbraw/zinc/66/03/42/386660342.db2.gz ZSLBPUFZTNJTJN-LLVKDONJSA-N 1 2 243.310 2.220 20 0 BEADLO Cc1cc(C[N@H+]2CCOC[C@H]2CC(C)C)ncn1 ZINC000292401777 386665107 /nfs/dbraw/zinc/66/51/07/386665107.db2.gz JNYBFFLAJIPEQU-CQSZACIVSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC[C@H]2CC(C)C)ncn1 ZINC000292401777 386665111 /nfs/dbraw/zinc/66/51/11/386665111.db2.gz JNYBFFLAJIPEQU-CQSZACIVSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@]1(C)CCCO1 ZINC000335526579 386670391 /nfs/dbraw/zinc/67/03/91/386670391.db2.gz DRQWIHRMLSNEJU-CYBMUJFWSA-N 1 2 234.299 2.206 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CC[C@H](C)[C@H](C)C1 ZINC000520426552 386671500 /nfs/dbraw/zinc/67/15/00/386671500.db2.gz LRXYUYZMSNQBDT-QJPTWQEYSA-N 1 2 249.358 2.093 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CC[C@H](C)[C@H](C)C1 ZINC000520426552 386671505 /nfs/dbraw/zinc/67/15/05/386671505.db2.gz LRXYUYZMSNQBDT-QJPTWQEYSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1ccoc1C[N@@H+](C)[C@@H](C)c1nnc(C)o1 ZINC000292453711 386674414 /nfs/dbraw/zinc/67/44/14/386674414.db2.gz YDFZIZVYJLSHJP-VIFPVBQESA-N 1 2 235.287 2.472 20 0 BEADLO Cc1ccoc1C[N@H+](C)[C@@H](C)c1nnc(C)o1 ZINC000292453711 386674421 /nfs/dbraw/zinc/67/44/21/386674421.db2.gz YDFZIZVYJLSHJP-VIFPVBQESA-N 1 2 235.287 2.472 20 0 BEADLO CC(C)c1noc(COc2cc[nH+]cc2)n1 ZINC000292496982 386679504 /nfs/dbraw/zinc/67/95/04/386679504.db2.gz SAWYGIXJEFZOIY-UHFFFAOYSA-N 1 2 219.244 2.167 20 0 BEADLO Cc1nnc(C[N@H+]2C[C@H](C)[C@@H]2c2ccccc2)[nH]1 ZINC000292514648 386683420 /nfs/dbraw/zinc/68/34/20/386683420.db2.gz NPYBTGXYXVWEBH-IINYFYTJSA-N 1 2 242.326 2.306 20 0 BEADLO Cc1nnc(C[N@@H+]2C[C@H](C)[C@@H]2c2ccccc2)[nH]1 ZINC000292514648 386683423 /nfs/dbraw/zinc/68/34/23/386683423.db2.gz NPYBTGXYXVWEBH-IINYFYTJSA-N 1 2 242.326 2.306 20 0 BEADLO CC[C@@H](NC(=O)[C@H](C)C(C)(F)F)c1[nH]cc[nH+]1 ZINC000328534672 386685015 /nfs/dbraw/zinc/68/50/15/386685015.db2.gz ZPMTVIIPFCSALV-JGVFFNPUSA-N 1 2 245.273 2.268 20 0 BEADLO CCOCCNc1cc(C)[nH+]c(C2CC2)n1 ZINC000265381889 386688887 /nfs/dbraw/zinc/68/88/87/386688887.db2.gz RIYBJOUTVFACJC-UHFFFAOYSA-N 1 2 221.304 2.111 20 0 BEADLO CCN(C)C(=O)CCn1c(C)[nH+]c2ccccc21 ZINC000337256189 386691184 /nfs/dbraw/zinc/69/11/84/386691184.db2.gz RWBYCMDFFBLJNL-UHFFFAOYSA-N 1 2 245.326 2.213 20 0 BEADLO C[C@H](C[NH2+]CC(F)(F)CN)c1ccc(F)cc1 ZINC000414927574 386692285 /nfs/dbraw/zinc/69/22/85/386692285.db2.gz LPCKNRKQCKTJQO-SECBINFHSA-N 1 2 246.276 2.113 20 0 BEADLO CO[C@@H](CNc1cc2cc[nH]c2c[nH+]1)C1CC1 ZINC000645054399 386695446 /nfs/dbraw/zinc/69/54/46/386695446.db2.gz TZDVFWPHQDCATD-LBPRGKRZSA-N 1 2 231.299 2.400 20 0 BEADLO Cc1c[nH+]ccc1CCN(C)CC(F)F ZINC000520572589 386700657 /nfs/dbraw/zinc/70/06/57/386700657.db2.gz ASHKAEIHOHAONQ-UHFFFAOYSA-N 1 2 214.259 2.129 20 0 BEADLO Cc1cccc(CC[N@@H+]2CCC=C(F)C2)n1 ZINC000335480318 386706300 /nfs/dbraw/zinc/70/63/00/386706300.db2.gz YPBMEYLHTHVYDO-UHFFFAOYSA-N 1 2 220.291 2.492 20 0 BEADLO Cc1cccc(CC[N@H+]2CCC=C(F)C2)n1 ZINC000335480318 386706303 /nfs/dbraw/zinc/70/63/03/386706303.db2.gz YPBMEYLHTHVYDO-UHFFFAOYSA-N 1 2 220.291 2.492 20 0 BEADLO Cn1c[nH+]cc1CC(=O)N[C@H]1CCCC(C)(C)C1 ZINC000526944789 386706252 /nfs/dbraw/zinc/70/62/52/386706252.db2.gz YTNAQWNSXISCAT-NSHDSACASA-N 1 2 249.358 2.048 20 0 BEADLO Cc1ccsc1C(=O)NCc1[nH]c[nH+]c1C ZINC000266952936 386730915 /nfs/dbraw/zinc/73/09/15/386730915.db2.gz FQBFEHLAAAPFTQ-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO COC(=O)C[N@@H+]1CCC[C@H]1c1ccc(OC)cc1 ZINC000247828746 386733649 /nfs/dbraw/zinc/73/36/49/386733649.db2.gz KKOZVYVDHZHHCW-ZDUSSCGKSA-N 1 2 249.310 2.005 20 0 BEADLO COC(=O)C[N@H+]1CCC[C@H]1c1ccc(OC)cc1 ZINC000247828746 386733663 /nfs/dbraw/zinc/73/36/63/386733663.db2.gz KKOZVYVDHZHHCW-ZDUSSCGKSA-N 1 2 249.310 2.005 20 0 BEADLO Cn1cc(C[N@@H+]2CCC[C@@H]2c2ccsc2)nn1 ZINC000334139479 386737700 /nfs/dbraw/zinc/73/77/00/386737700.db2.gz AGJLNCSUAYEBED-GFCCVEGCSA-N 1 2 248.355 2.214 20 0 BEADLO Cn1cc(C[N@H+]2CCC[C@@H]2c2ccsc2)nn1 ZINC000334139479 386737704 /nfs/dbraw/zinc/73/77/04/386737704.db2.gz AGJLNCSUAYEBED-GFCCVEGCSA-N 1 2 248.355 2.214 20 0 BEADLO Cc1ccoc1C[NH2+][C@@H]1CCCc2cn[nH]c21 ZINC000268883773 386713871 /nfs/dbraw/zinc/71/38/71/386713871.db2.gz YKSHMJMKPAMDIH-LLVKDONJSA-N 1 2 231.299 2.478 20 0 BEADLO Cc1ccoc1C[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000268883773 386713880 /nfs/dbraw/zinc/71/38/80/386713880.db2.gz YKSHMJMKPAMDIH-LLVKDONJSA-N 1 2 231.299 2.478 20 0 BEADLO C[N@H+](Cc1cocn1)Cc1ccc(F)cc1 ZINC000191921360 386717190 /nfs/dbraw/zinc/71/71/90/386717190.db2.gz GFHGEPWCIVYPMT-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO C[N@@H+](Cc1cocn1)Cc1ccc(F)cc1 ZINC000191921360 386717197 /nfs/dbraw/zinc/71/71/97/386717197.db2.gz GFHGEPWCIVYPMT-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO CCc1ccc([C@H](C)[NH2+]Cc2nccn2C)o1 ZINC000268925111 386719236 /nfs/dbraw/zinc/71/92/36/386719236.db2.gz RJWXNVRZLITPJL-JTQLQIEISA-N 1 2 233.315 2.426 20 0 BEADLO CCC[C@H](CC)NC(=O)CCc1c[nH+]cn1C ZINC000279678031 386719279 /nfs/dbraw/zinc/71/92/79/386719279.db2.gz OHXIFMKMQIYTMV-NSHDSACASA-N 1 2 237.347 2.048 20 0 BEADLO Cc1cccc2nc(C[NH2+]CC3(F)CC3)[nH]c21 ZINC000526983530 386720260 /nfs/dbraw/zinc/72/02/60/386720260.db2.gz MWTAHILFRFZDLB-UHFFFAOYSA-N 1 2 233.290 2.463 20 0 BEADLO c1nn[nH]c1CC[N@@H+]1CCC2(C1)CCCCC2 ZINC000647965075 386749684 /nfs/dbraw/zinc/74/96/84/386749684.db2.gz FSZBVCDCRLTHCW-UHFFFAOYSA-N 1 2 234.347 2.003 20 0 BEADLO c1nn[nH]c1CC[N@H+]1CCC2(C1)CCCCC2 ZINC000647965075 386749688 /nfs/dbraw/zinc/74/96/88/386749688.db2.gz FSZBVCDCRLTHCW-UHFFFAOYSA-N 1 2 234.347 2.003 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)C1(C)CCCC1 ZINC000269133072 386755082 /nfs/dbraw/zinc/75/50/82/386755082.db2.gz XAHOPHXQQGJAJZ-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2cccn2C)s1 ZINC000357310962 386755862 /nfs/dbraw/zinc/75/58/62/386755862.db2.gz YKDAWJRXVPZDER-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2cccn2C)s1 ZINC000357310962 386755866 /nfs/dbraw/zinc/75/58/66/386755866.db2.gz YKDAWJRXVPZDER-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO [NH3+]CC(F)(F)CNCC1CCCCCC1 ZINC000414931400 386760486 /nfs/dbraw/zinc/76/04/86/386760486.db2.gz QIDWDYLNWPMGRI-UHFFFAOYSA-N 1 2 220.307 2.140 20 0 BEADLO c1nc(C[N@@H+]2CCC[C@@H]2c2cccnc2)co1 ZINC000348921771 386767641 /nfs/dbraw/zinc/76/76/41/386767641.db2.gz OJRCXNFTXJHZML-CYBMUJFWSA-N 1 2 229.283 2.407 20 0 BEADLO c1nc(C[N@H+]2CCC[C@@H]2c2cccnc2)co1 ZINC000348921771 386767647 /nfs/dbraw/zinc/76/76/47/386767647.db2.gz OJRCXNFTXJHZML-CYBMUJFWSA-N 1 2 229.283 2.407 20 0 BEADLO CC(C)n1ccnc1C[N@@H+]1CCC[C@H]1CF ZINC000293037610 386768245 /nfs/dbraw/zinc/76/82/45/386768245.db2.gz LTXLZHCCDRGLSL-NSHDSACASA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1ccnc1C[N@H+]1CCC[C@H]1CF ZINC000293037610 386768251 /nfs/dbraw/zinc/76/82/51/386768251.db2.gz LTXLZHCCDRGLSL-NSHDSACASA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CCC[C@H]1CF ZINC000293037610 386768257 /nfs/dbraw/zinc/76/82/57/386768257.db2.gz LTXLZHCCDRGLSL-NSHDSACASA-N 1 2 225.311 2.398 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCO[C@H]2CCC[C@H]21 ZINC000334143181 386744159 /nfs/dbraw/zinc/74/41/59/386744159.db2.gz QDBBMLGYDIKLAI-OLZOCXBDSA-N 1 2 236.315 2.045 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCO[C@H]2CCC[C@H]21 ZINC000334143181 386744162 /nfs/dbraw/zinc/74/41/62/386744162.db2.gz QDBBMLGYDIKLAI-OLZOCXBDSA-N 1 2 236.315 2.045 20 0 BEADLO Cc1cnc(NCc2cn3ccccc3[nH+]2)nc1 ZINC000340048221 386790703 /nfs/dbraw/zinc/79/07/03/386790703.db2.gz JKLZEHAGVJJUCT-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO Cc1occc1C(=O)Nc1c[nH+]c2n1CCCC2 ZINC000334636413 386771990 /nfs/dbraw/zinc/77/19/90/386771990.db2.gz VSSITYXZDHYMGV-UHFFFAOYSA-N 1 2 245.282 2.373 20 0 BEADLO COC(=O)[C@@H](c1ccsc1)[NH+]1CCCCC1 ZINC000280147882 386783248 /nfs/dbraw/zinc/78/32/48/386783248.db2.gz WZHFYQGYYVFRGW-LLVKDONJSA-N 1 2 239.340 2.448 20 0 BEADLO Cc1ccc(NCc2cnc(C)nc2)c(C)[nH+]1 ZINC000344824804 386783514 /nfs/dbraw/zinc/78/35/14/386783514.db2.gz KGURPOCXQPQEKG-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO COc1ccc(F)c(C[NH2+]Cc2cocn2)c1 ZINC000645154800 386789020 /nfs/dbraw/zinc/78/90/20/386789020.db2.gz SYLSKULUSXEIHZ-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO CC(C)c1ccoc1C(=O)NCCc1[nH]cc[nH+]1 ZINC000339938460 386816516 /nfs/dbraw/zinc/81/65/16/386816516.db2.gz RHSWKNPFXAGDRB-UHFFFAOYSA-N 1 2 247.298 2.099 20 0 BEADLO CC(C)[C@H]1CCCC[C@H]1[NH2+]Cc1c[nH]nn1 ZINC000398367676 386816608 /nfs/dbraw/zinc/81/66/08/386816608.db2.gz BVBKXFBKLQYUPJ-VXGBXAGGSA-N 1 2 222.336 2.109 20 0 BEADLO CC(C)[C@H]1CCCC[C@H]1[NH2+]Cc1cn[nH]n1 ZINC000398367676 386816616 /nfs/dbraw/zinc/81/66/16/386816616.db2.gz BVBKXFBKLQYUPJ-VXGBXAGGSA-N 1 2 222.336 2.109 20 0 BEADLO Cc1ccnc(C[N@@H+](C)C2(C(N)=O)CCCC2)n1 ZINC000330628791 386823979 /nfs/dbraw/zinc/82/39/79/386823979.db2.gz MEBIXFPPUGCVIR-UHFFFAOYSA-N 1 2 248.330 2.065 20 0 BEADLO Cc1ccnc(C[N@H+](C)C2(C(N)=O)CCCC2)n1 ZINC000330628791 386823989 /nfs/dbraw/zinc/82/39/89/386823989.db2.gz MEBIXFPPUGCVIR-UHFFFAOYSA-N 1 2 248.330 2.065 20 0 BEADLO CC[C@H](NC(=O)C1CCCC1)c1[nH]cc[nH+]1 ZINC000125342053 386797825 /nfs/dbraw/zinc/79/78/25/386797825.db2.gz WRZRJRSEVPMRCD-JTQLQIEISA-N 1 2 221.304 2.167 20 0 BEADLO CC[C@@H](NC(=O)C1CCCC1)c1[nH]cc[nH+]1 ZINC000125342269 386797862 /nfs/dbraw/zinc/79/78/62/386797862.db2.gz WRZRJRSEVPMRCD-SNVBAGLBSA-N 1 2 221.304 2.167 20 0 BEADLO Cc1nocc1CNc1ccc(N(C)C)c[nH+]1 ZINC000293311613 386801016 /nfs/dbraw/zinc/80/10/16/386801016.db2.gz QIPFBYPYKQKFGP-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO Cc1ccncc1CNc1ccc(N(C)C)c[nH+]1 ZINC000280302199 386802049 /nfs/dbraw/zinc/80/20/49/386802049.db2.gz OEWCDWSGVXPLHX-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO CC/C=C/C[NH2+][C@@H](CCCC)C(=O)OC ZINC000395047534 386813480 /nfs/dbraw/zinc/81/34/80/386813480.db2.gz LIYQLURCWQODMF-IOCXFXADSA-N 1 2 213.321 2.274 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1csc(C2CC2)n1 ZINC000293427819 386816204 /nfs/dbraw/zinc/81/62/04/386816204.db2.gz AXVVUVLPIBXXOY-LLVKDONJSA-N 1 2 238.356 2.241 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1csc(C2CC2)n1 ZINC000293427819 386816208 /nfs/dbraw/zinc/81/62/08/386816208.db2.gz AXVVUVLPIBXXOY-LLVKDONJSA-N 1 2 238.356 2.241 20 0 BEADLO Cc1ccnc(NCc2cn3ccccc3[nH+]2)n1 ZINC000301264803 386828221 /nfs/dbraw/zinc/82/82/21/386828221.db2.gz HKIOVUIICLJKOP-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO CC(C)(C(=O)NC[C@H]1CC=CCC1)c1c[nH]c[nH+]1 ZINC000330679184 386828568 /nfs/dbraw/zinc/82/85/68/386828568.db2.gz CXILBZRLCYCJKA-NSHDSACASA-N 1 2 247.342 2.160 20 0 BEADLO Cc1nc(C(=O)Nc2cc[nH+]cc2C)c(C)o1 ZINC000293540315 386832697 /nfs/dbraw/zinc/83/26/97/386832697.db2.gz XUAIAZLHPLATJB-UHFFFAOYSA-N 1 2 231.255 2.247 20 0 BEADLO Cc1c[nH+]c(CNCc2ccccc2F)n1C ZINC000341078354 386834217 /nfs/dbraw/zinc/83/42/17/386834217.db2.gz NMIOQHGETJIBGP-UHFFFAOYSA-N 1 2 233.290 2.157 20 0 BEADLO Cc1cnc(C[NH2+]Cc2ccccc2F)n1C ZINC000341078354 386834222 /nfs/dbraw/zinc/83/42/22/386834222.db2.gz NMIOQHGETJIBGP-UHFFFAOYSA-N 1 2 233.290 2.157 20 0 BEADLO Cc1nocc1C[N@@H+](C)Cc1cccnc1 ZINC000293556880 386837609 /nfs/dbraw/zinc/83/76/09/386837609.db2.gz HSLDCOOOBVPJGL-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1nocc1C[N@H+](C)Cc1cccnc1 ZINC000293556880 386837617 /nfs/dbraw/zinc/83/76/17/386837617.db2.gz HSLDCOOOBVPJGL-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ccnc(C[N@H+]2CCS[C@@H](C)[C@@H]2C)n1 ZINC000336470798 386837654 /nfs/dbraw/zinc/83/76/54/386837654.db2.gz JPOQNRBJHMESHO-QWRGUYRKSA-N 1 2 237.372 2.111 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCS[C@@H](C)[C@@H]2C)n1 ZINC000336470798 386837663 /nfs/dbraw/zinc/83/76/63/386837663.db2.gz JPOQNRBJHMESHO-QWRGUYRKSA-N 1 2 237.372 2.111 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCC(=O)[C@@H](C)C2)s1 ZINC000283286688 386838305 /nfs/dbraw/zinc/83/83/05/386838305.db2.gz WNWPQGRPBOGTSO-QMMMGPOBSA-N 1 2 238.356 2.171 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCC(=O)[C@@H](C)C2)s1 ZINC000283286688 386838309 /nfs/dbraw/zinc/83/83/09/386838309.db2.gz WNWPQGRPBOGTSO-QMMMGPOBSA-N 1 2 238.356 2.171 20 0 BEADLO Cc1nsc(NCc2cn3ccccc3[nH+]2)n1 ZINC000301377844 386840185 /nfs/dbraw/zinc/84/01/85/386840185.db2.gz WZDNSRYNCWTDJT-UHFFFAOYSA-N 1 2 245.311 2.106 20 0 BEADLO CC(C)[C@@H]1C[N@H+](Cc2ccc(F)cn2)CCO1 ZINC000334784374 386843107 /nfs/dbraw/zinc/84/31/07/386843107.db2.gz KFUYSQRQOBBFIF-ZDUSSCGKSA-N 1 2 238.306 2.078 20 0 BEADLO CC(C)[C@@H]1C[N@@H+](Cc2ccc(F)cn2)CCO1 ZINC000334784374 386843112 /nfs/dbraw/zinc/84/31/12/386843112.db2.gz KFUYSQRQOBBFIF-ZDUSSCGKSA-N 1 2 238.306 2.078 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1cc(F)cc(F)c1 ZINC000293578357 386843969 /nfs/dbraw/zinc/84/39/69/386843969.db2.gz NMGBOQISMGLZBD-GFCCVEGCSA-N 1 2 227.254 2.186 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1cc(F)cc(F)c1 ZINC000293578357 386843974 /nfs/dbraw/zinc/84/39/74/386843974.db2.gz NMGBOQISMGLZBD-GFCCVEGCSA-N 1 2 227.254 2.186 20 0 BEADLO Cc1cc(F)c(C[N@H+](CCO)C2CC2)c(F)c1 ZINC000425332712 386845784 /nfs/dbraw/zinc/84/57/84/386845784.db2.gz ZLUINSNRQMLSHS-UHFFFAOYSA-N 1 2 241.281 2.230 20 0 BEADLO Cc1cc(F)c(C[N@@H+](CCO)C2CC2)c(F)c1 ZINC000425332712 386845790 /nfs/dbraw/zinc/84/57/90/386845790.db2.gz ZLUINSNRQMLSHS-UHFFFAOYSA-N 1 2 241.281 2.230 20 0 BEADLO COCCSc1[nH+]cnc2[nH]c(C)c(C)c21 ZINC000645181516 386846163 /nfs/dbraw/zinc/84/61/63/386846163.db2.gz ILXADECIFDFJHH-UHFFFAOYSA-N 1 2 237.328 2.313 20 0 BEADLO CC1(C(=O)N2CCC(c3c[nH+]c[nH]3)CC2)CCC1 ZINC000334788425 386850870 /nfs/dbraw/zinc/85/08/70/386850870.db2.gz FAPNQYBKPBGCBW-UHFFFAOYSA-N 1 2 247.342 2.306 20 0 BEADLO CC1(C(=O)N2CCC(c3c[nH]c[nH+]3)CC2)CCC1 ZINC000334788425 386850877 /nfs/dbraw/zinc/85/08/77/386850877.db2.gz FAPNQYBKPBGCBW-UHFFFAOYSA-N 1 2 247.342 2.306 20 0 BEADLO CN(CCC1CC1)c1nc(N)c2ccccc2[nH+]1 ZINC000301910980 386892210 /nfs/dbraw/zinc/89/22/10/386892210.db2.gz SIQAQNKCDXXFTR-UHFFFAOYSA-N 1 2 242.326 2.448 20 0 BEADLO c1csc([C@@H]([NH2+]CC2CCC2)c2nnc[nH]2)c1 ZINC000293875370 386893585 /nfs/dbraw/zinc/89/35/85/386893585.db2.gz VDPXRZYLFSAGPZ-LLVKDONJSA-N 1 2 248.355 2.345 20 0 BEADLO CS[C@@H]1CC[C@H]1[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000425344811 386855554 /nfs/dbraw/zinc/85/55/54/386855554.db2.gz UDKXHUNQBHEXND-OPRDCNLKSA-N 1 2 245.388 2.200 20 0 BEADLO CN(C[C@@H]1CCOC1)c1cc[nH+]c(C(C)(C)C)n1 ZINC000301562064 386856522 /nfs/dbraw/zinc/85/65/22/386856522.db2.gz ITGDFOMIBNGQOJ-NSHDSACASA-N 1 2 249.358 2.247 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccncc1)c1ccon1 ZINC000336744526 386858380 /nfs/dbraw/zinc/85/83/80/386858380.db2.gz QCVSNASAGCUTSK-VHSXEESVSA-N 1 2 217.272 2.481 20 0 BEADLO CCC[C@@H](O)CNc1cc[nH+]c(C(C)(C)C)n1 ZINC000301587307 386858597 /nfs/dbraw/zinc/85/85/97/386858597.db2.gz PJGXRKMBRPWRBX-SNVBAGLBSA-N 1 2 237.347 2.347 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ccncc1)c1ccon1 ZINC000336744524 386859107 /nfs/dbraw/zinc/85/91/07/386859107.db2.gz QCVSNASAGCUTSK-NXEZZACHSA-N 1 2 217.272 2.481 20 0 BEADLO Cc1nn(C)cc1C[N@@H+]1Cc2cccc(F)c2C1 ZINC000334793037 386859863 /nfs/dbraw/zinc/85/98/63/386859863.db2.gz QXIIGTASKOINHB-UHFFFAOYSA-N 1 2 245.301 2.383 20 0 BEADLO Cc1nn(C)cc1C[N@H+]1Cc2cccc(F)c2C1 ZINC000334793037 386859864 /nfs/dbraw/zinc/85/98/64/386859864.db2.gz QXIIGTASKOINHB-UHFFFAOYSA-N 1 2 245.301 2.383 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1cnc(Cl)s1 ZINC000293697535 386864087 /nfs/dbraw/zinc/86/40/87/386864087.db2.gz WWOOHPZOCWKQPF-SSDOTTSWSA-N 1 2 232.736 2.017 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1cnc(Cl)s1 ZINC000293697535 386864095 /nfs/dbraw/zinc/86/40/95/386864095.db2.gz WWOOHPZOCWKQPF-SSDOTTSWSA-N 1 2 232.736 2.017 20 0 BEADLO Cc1ccsc1C[N@H+](C)Cc1cc[nH]n1 ZINC000349543571 386865408 /nfs/dbraw/zinc/86/54/08/386865408.db2.gz HOJXWQZJHAIOAM-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1ccsc1C[N@@H+](C)Cc1cc[nH]n1 ZINC000349543571 386865413 /nfs/dbraw/zinc/86/54/13/386865413.db2.gz HOJXWQZJHAIOAM-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO CCc1nc(N2C[C@@H]3C[C@H]2CS3)cc(C)[nH+]1 ZINC000334827669 386865707 /nfs/dbraw/zinc/86/57/07/386865707.db2.gz MSFWTPGIUDONMH-UWVGGRQHSA-N 1 2 235.356 2.042 20 0 BEADLO CC[C@H](O)C[NH2+][C@H](Cc1ccccc1)C(F)F ZINC000293716578 386866250 /nfs/dbraw/zinc/86/62/50/386866250.db2.gz PGHPOSOTDIJGIC-NWDGAFQWSA-N 1 2 243.297 2.223 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+]2CCOCC3(CC3)C2)o1 ZINC000335745757 386867098 /nfs/dbraw/zinc/86/70/98/386867098.db2.gz IAIJAOCFMHDUET-LLVKDONJSA-N 1 2 236.315 2.156 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+]2CCOCC3(CC3)C2)o1 ZINC000335745757 386867100 /nfs/dbraw/zinc/86/71/00/386867100.db2.gz IAIJAOCFMHDUET-LLVKDONJSA-N 1 2 236.315 2.156 20 0 BEADLO CCC[C@H](C)c1nc(Cc2c[nH+]cn2C)no1 ZINC000357936861 386868652 /nfs/dbraw/zinc/86/86/52/386868652.db2.gz OHWLQSGDNMESHR-VIFPVBQESA-N 1 2 234.303 2.298 20 0 BEADLO CCC[C@H](C)Cc1nc(Cc2c[nH+]cn2C)no1 ZINC000357960080 386873281 /nfs/dbraw/zinc/87/32/81/386873281.db2.gz XYVABOUCBSZZFO-JTQLQIEISA-N 1 2 248.330 2.373 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@H](C)c2ccncc2)n(C)n1 ZINC000418009042 386883911 /nfs/dbraw/zinc/88/39/11/386883911.db2.gz RSIXMACKHBPUCY-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cc(C[N@H+](C)[C@H](C)c2ccncc2)n(C)n1 ZINC000418009042 386883919 /nfs/dbraw/zinc/88/39/19/386883919.db2.gz RSIXMACKHBPUCY-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO CC(C)C[C@H](C)CC(=O)Nc1cc[nH+]cc1O ZINC000330778518 386884566 /nfs/dbraw/zinc/88/45/66/386884566.db2.gz BMCMCVAACIMNBX-JTQLQIEISA-N 1 2 236.315 2.220 20 0 BEADLO CCCCNc1nc(N(C)C)nc(C(C)C)[nH+]1 ZINC000301913641 386890844 /nfs/dbraw/zinc/89/08/44/386890844.db2.gz HSXDBBXKMSXJGA-UHFFFAOYSA-N 1 2 237.351 2.273 20 0 BEADLO CCCCNc1nc(C(C)C)[nH+]c(N(C)C)n1 ZINC000301913641 386890849 /nfs/dbraw/zinc/89/08/49/386890849.db2.gz HSXDBBXKMSXJGA-UHFFFAOYSA-N 1 2 237.351 2.273 20 0 BEADLO C[C@H]1C[C@H](C)N1c1cc[nH+]c(C2CC2)n1 ZINC000335769122 386914130 /nfs/dbraw/zinc/91/41/30/386914130.db2.gz FBNSTHWQDOATTN-IUCAKERBSA-N 1 2 203.289 2.341 20 0 BEADLO CC(C)c1nc(N2CCC[C@@H]2C(C)(C)O)cc[nH+]1 ZINC000301983412 386896344 /nfs/dbraw/zinc/89/63/44/386896344.db2.gz RPOSHAVHCDQHIT-LLVKDONJSA-N 1 2 249.358 2.340 20 0 BEADLO CC1CCN(C(=O)[C@H]2CCCc3[nH+]c[nH]c32)CC1 ZINC000334851006 386900831 /nfs/dbraw/zinc/90/08/31/386900831.db2.gz ILAJGUAIZNESID-NSHDSACASA-N 1 2 247.342 2.088 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2cnn(C)c2C)o1 ZINC000330832076 386901972 /nfs/dbraw/zinc/90/19/72/386901972.db2.gz HIIDERZVYYTKKK-NXEZZACHSA-N 1 2 248.330 2.437 20 0 BEADLO CCC(CC)[C@H](C)C(=O)N1CCn2c[nH+]cc2C1 ZINC000358158580 386902542 /nfs/dbraw/zinc/90/25/42/386902542.db2.gz AWHAQSJJMRKYCH-NSHDSACASA-N 1 2 249.358 2.298 20 0 BEADLO CCc1cc(N2CCC[C@@H]2C(C)(C)O)nc(C)[nH+]1 ZINC000302109636 386903293 /nfs/dbraw/zinc/90/32/93/386903293.db2.gz TVQLHKVKUTWRRF-GFCCVEGCSA-N 1 2 249.358 2.087 20 0 BEADLO Cc1ccc(C[S@@](=O)C2CCC2)c(C)[nH+]1 ZINC000334854887 386907061 /nfs/dbraw/zinc/90/70/61/386907061.db2.gz HDAJTSGXEAHHRS-OAHLLOKOSA-N 1 2 223.341 2.500 20 0 BEADLO Cc1sccc1C[N@@H+]1CCO[C@@H](CF)C1 ZINC000334859015 386911313 /nfs/dbraw/zinc/91/13/13/386911313.db2.gz IFBAOEJENXJZSK-NSHDSACASA-N 1 2 229.320 2.227 20 0 BEADLO Cc1sccc1C[N@H+]1CCO[C@@H](CF)C1 ZINC000334859015 386911317 /nfs/dbraw/zinc/91/13/17/386911317.db2.gz IFBAOEJENXJZSK-NSHDSACASA-N 1 2 229.320 2.227 20 0 BEADLO CC[C@@H](C)[C@@H](C)NC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000330940860 386925373 /nfs/dbraw/zinc/92/53/73/386925373.db2.gz CQEORQFWNAJBSE-NXEZZACHSA-N 1 2 237.347 2.238 20 0 BEADLO CC[C@H]1[C@H](C)CCN1c1cc(C)[nH+]cn1 ZINC000302465127 386925517 /nfs/dbraw/zinc/92/55/17/386925517.db2.gz VTRCQWKSTWVEDB-KOLCDFICSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1ccc2c(c1)C[N@H+]([C@H](C)C(N)=O)C2 ZINC000334877899 386938393 /nfs/dbraw/zinc/93/83/93/386938393.db2.gz ZLCDJWQIZZEMQJ-SECBINFHSA-N 1 2 204.273 2.234 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+]([C@H](C)C(N)=O)C2 ZINC000334877899 386938400 /nfs/dbraw/zinc/93/84/00/386938400.db2.gz ZLCDJWQIZZEMQJ-SECBINFHSA-N 1 2 204.273 2.234 20 0 BEADLO CCC[C@@H]([NH2+]C[C@](C)(CC)OC)C(=O)OCC ZINC000322579014 386942862 /nfs/dbraw/zinc/94/28/62/386942862.db2.gz CFPJJWDSXBIDDA-YPMHNXCESA-N 1 2 245.363 2.123 20 0 BEADLO c1nc(N2CCCC2)cc(NCCC2CC2)[nH+]1 ZINC000302881879 386943540 /nfs/dbraw/zinc/94/35/40/386943540.db2.gz IJXFHCGVWRAURP-UHFFFAOYSA-N 1 2 232.331 2.289 20 0 BEADLO c1nc(NCCC2CC2)cc(N2CCCC2)[nH+]1 ZINC000302881879 386943544 /nfs/dbraw/zinc/94/35/44/386943544.db2.gz IJXFHCGVWRAURP-UHFFFAOYSA-N 1 2 232.331 2.289 20 0 BEADLO Cn1cc[nH+]c1[C@@H](NC(=O)CCC1CC1)C1CC1 ZINC000341697935 386953137 /nfs/dbraw/zinc/95/31/37/386953137.db2.gz XIRFRKCXBGBJAN-ZDUSSCGKSA-N 1 2 247.342 2.178 20 0 BEADLO CC[C@@H](C)CC(=O)N[C@H](c1[nH+]ccn1C)C1CC1 ZINC000341691367 386953421 /nfs/dbraw/zinc/95/34/21/386953421.db2.gz PKZDRHLXPQQOHT-MFKMUULPSA-N 1 2 249.358 2.424 20 0 BEADLO Cn1cc[nH+]c1[C@@H](NC(=O)C1=CCCC1)C1CC1 ZINC000341692395 386953472 /nfs/dbraw/zinc/95/34/72/386953472.db2.gz RCMJCULMGHBNHQ-LBPRGKRZSA-N 1 2 245.326 2.098 20 0 BEADLO Cc1ccc(C[NH2+][C@H](c2nncn2C)C(C)C)o1 ZINC000352903853 386957277 /nfs/dbraw/zinc/95/72/77/386957277.db2.gz SFETWPBDTAQSQT-LBPRGKRZSA-N 1 2 248.330 2.203 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@]12CC[C@H](C)[C@H](C)C2 ZINC000639426716 386961811 /nfs/dbraw/zinc/96/18/11/386961811.db2.gz HRVRSMOYNMRFOT-MISXGVKJSA-N 1 2 238.375 2.369 20 0 BEADLO CC[C@H](OC)C(=O)Nc1c(C)cc[nH+]c1C ZINC000331121443 386968201 /nfs/dbraw/zinc/96/82/01/386968201.db2.gz MJTMTMTVUMJUOT-JTQLQIEISA-N 1 2 222.288 2.062 20 0 BEADLO Cc1cc(NC(=O)N2CC(C)(C)C[C@H]2C)cc[nH+]1 ZINC000334897155 386971149 /nfs/dbraw/zinc/97/11/49/386971149.db2.gz IVPFMNZIPXZLEE-LLVKDONJSA-N 1 2 247.342 2.464 20 0 BEADLO CCN(C)c1ccc(/C=C\c2ccncn2)c[nH+]1 ZINC000358683837 386999439 /nfs/dbraw/zinc/99/94/39/386999439.db2.gz NHSHTTKZBFQRKZ-XQRVVYSFSA-N 1 2 240.310 2.498 20 0 BEADLO Cc1[nH+]c(C(C)C)ccc1Cn1ncccc1=O ZINC000334956430 387036327 /nfs/dbraw/zinc/03/63/27/387036327.db2.gz LZHZGAYUVZBCMX-UHFFFAOYSA-N 1 2 243.310 2.118 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1OCC[C@H]1C ZINC000333453181 387036976 /nfs/dbraw/zinc/03/69/76/387036976.db2.gz ZANBSKMQLLYQJK-SKDRFNHKSA-N 1 2 234.299 2.062 20 0 BEADLO Cc1cc(CNC(=O)N2CC[C@@H](C)C2)cc(C)[nH+]1 ZINC000334966724 387048310 /nfs/dbraw/zinc/04/83/10/387048310.db2.gz CECUFUBPZFJCJR-SNVBAGLBSA-N 1 2 247.342 2.250 20 0 BEADLO Cc1ccc(NC(=O)C2CCC(=O)CC2)c(C)[nH+]1 ZINC000333777284 387055410 /nfs/dbraw/zinc/05/54/10/387055410.db2.gz ZQEASYDVUBTUPV-UHFFFAOYSA-N 1 2 246.310 2.396 20 0 BEADLO Cc1ccc([C@H](O)CNc2cc(C)[nH+]cn2)cc1 ZINC000110203220 387060313 /nfs/dbraw/zinc/06/03/13/387060313.db2.gz JNLRCAXHURGMCB-CYBMUJFWSA-N 1 2 243.310 2.239 20 0 BEADLO F[C@H]1CC[N@H+](Cc2cnn(-c3ccccc3)c2)C1 ZINC000336222741 387061654 /nfs/dbraw/zinc/06/16/54/387061654.db2.gz HCCXSNCIHPZOHQ-ZDUSSCGKSA-N 1 2 245.301 2.416 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2cnn(-c3ccccc3)c2)C1 ZINC000336222741 387061659 /nfs/dbraw/zinc/06/16/59/387061659.db2.gz HCCXSNCIHPZOHQ-ZDUSSCGKSA-N 1 2 245.301 2.416 20 0 BEADLO COCCNc1cc(C(F)(F)F)cc[nH+]1 ZINC000085486105 387061850 /nfs/dbraw/zinc/06/18/50/387061850.db2.gz GBLHXNDFJNHPFH-UHFFFAOYSA-N 1 2 220.194 2.159 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2cnn(-c3ccccc3)c2)C1 ZINC000336222740 387062103 /nfs/dbraw/zinc/06/21/03/387062103.db2.gz HCCXSNCIHPZOHQ-CYBMUJFWSA-N 1 2 245.301 2.416 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2cnn(-c3ccccc3)c2)C1 ZINC000336222740 387062106 /nfs/dbraw/zinc/06/21/06/387062106.db2.gz HCCXSNCIHPZOHQ-CYBMUJFWSA-N 1 2 245.301 2.416 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCC[C@@H](CCC(N)=O)C1 ZINC000639470124 387013794 /nfs/dbraw/zinc/01/37/94/387013794.db2.gz KBXJELDRPCPZAG-JTQLQIEISA-N 1 2 248.317 2.009 20 0 BEADLO CCC(F)(F)C[N@H+]1CCC[C@@H](CCC(N)=O)C1 ZINC000639470124 387013796 /nfs/dbraw/zinc/01/37/96/387013796.db2.gz KBXJELDRPCPZAG-JTQLQIEISA-N 1 2 248.317 2.009 20 0 BEADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccn(C)n1 ZINC000336224743 387066076 /nfs/dbraw/zinc/06/60/76/387066076.db2.gz OMCYYCRGLSLBAF-SCZZXKLOSA-N 1 2 247.264 2.193 20 0 BEADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccn(C)n1 ZINC000336224743 387066085 /nfs/dbraw/zinc/06/60/85/387066085.db2.gz OMCYYCRGLSLBAF-SCZZXKLOSA-N 1 2 247.264 2.193 20 0 BEADLO CCc1ncc(C[NH+]2CC(CC(F)F)C2)cn1 ZINC000425366016 387024597 /nfs/dbraw/zinc/02/45/97/387024597.db2.gz NZLQATXILKFQKO-UHFFFAOYSA-N 1 2 241.285 2.126 20 0 BEADLO CC1(C)CC([NH2+]Cc2noc(C3CC3)n2)C1 ZINC000333314951 387026352 /nfs/dbraw/zinc/02/63/52/387026352.db2.gz OFKBCZHMTUKCRF-UHFFFAOYSA-N 1 2 221.304 2.225 20 0 BEADLO CCCN(CC)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000519163023 387026458 /nfs/dbraw/zinc/02/64/58/387026458.db2.gz NSRPNRVETSPVNC-LLVKDONJSA-N 1 2 223.320 2.093 20 0 BEADLO Cc1c(Cl)c(C[NH+]2[C@H](C)C[C@H]2C)nn1C ZINC000334982464 387069689 /nfs/dbraw/zinc/06/96/89/387069689.db2.gz ONSPOUHWRFMRPX-HTQZYQBOSA-N 1 2 227.739 2.365 20 0 BEADLO CC[N@H+](Cc1cc(C)nn1C)Cc1ccncc1 ZINC000418059457 387079572 /nfs/dbraw/zinc/07/95/72/387079572.db2.gz UFMMBWHXBMMDTM-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CC[N@@H+](Cc1cc(C)nn1C)Cc1ccncc1 ZINC000418059457 387079574 /nfs/dbraw/zinc/07/95/74/387079574.db2.gz UFMMBWHXBMMDTM-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)[C@@]1(C)CC=CCC1 ZINC000336245564 387080933 /nfs/dbraw/zinc/08/09/33/387080933.db2.gz PFNMSJOJMGHGLG-ZDUSSCGKSA-N 1 2 233.315 2.115 20 0 BEADLO COC[C@H](CCO)Nc1ccc2ccccc2[nH+]1 ZINC000228294983 387085209 /nfs/dbraw/zinc/08/52/09/387085209.db2.gz GCBUNJIIWOPERF-LBPRGKRZSA-N 1 2 246.310 2.044 20 0 BEADLO C[C@@H](C(=O)Nc1ccccc1)[N@@H+]1CC[C@H](F)C1 ZINC000336259615 387090493 /nfs/dbraw/zinc/09/04/93/387090493.db2.gz OSJPRSWSKOCETO-QWRGUYRKSA-N 1 2 236.290 2.057 20 0 BEADLO C[C@@H](C(=O)Nc1ccccc1)[N@H+]1CC[C@H](F)C1 ZINC000336259615 387090499 /nfs/dbraw/zinc/09/04/99/387090499.db2.gz OSJPRSWSKOCETO-QWRGUYRKSA-N 1 2 236.290 2.057 20 0 BEADLO Cc1[nH]ncc1C[NH2+]C[C@H](C)C(F)(F)F ZINC000336765431 387090952 /nfs/dbraw/zinc/09/09/52/387090952.db2.gz RDXBHGOPLQQBBE-LURJTMIESA-N 1 2 221.226 2.006 20 0 BEADLO Cc1cc(N2CC3(C[C@@H]2C)CCOCC3)nc[nH+]1 ZINC000645381709 387094833 /nfs/dbraw/zinc/09/48/33/387094833.db2.gz GUZHTGPBFVJVBH-LBPRGKRZSA-N 1 2 247.342 2.180 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2C[C@H]2c2ccccc2)c[nH+]1 ZINC000335002047 387095971 /nfs/dbraw/zinc/09/59/71/387095971.db2.gz BKTOWWMSZIFNIU-NWDGAFQWSA-N 1 2 241.294 2.004 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H]2C[C@H]2c2ccccc2)c[nH+]1 ZINC000335002048 387096306 /nfs/dbraw/zinc/09/63/06/387096306.db2.gz BKTOWWMSZIFNIU-RYUDHWBXSA-N 1 2 241.294 2.004 20 0 BEADLO O=C(/C=C/C1CC1)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000370245589 387100802 /nfs/dbraw/zinc/10/08/02/387100802.db2.gz ZEXHVSHYJNSZJX-ONEGZZNKSA-N 1 2 245.326 2.082 20 0 BEADLO O=C(/C=C/C1CC1)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000370245589 387100808 /nfs/dbraw/zinc/10/08/08/387100808.db2.gz ZEXHVSHYJNSZJX-ONEGZZNKSA-N 1 2 245.326 2.082 20 0 BEADLO OCC(F)(F)C[NH2+]Cc1ccc(C2CC2)cc1 ZINC000228648843 387101967 /nfs/dbraw/zinc/10/19/67/387101967.db2.gz QXOXANYLTPWLEO-UHFFFAOYSA-N 1 2 241.281 2.281 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CCC[C@@](C)(F)C2)o1 ZINC000336268645 387102302 /nfs/dbraw/zinc/10/23/02/387102302.db2.gz ATPJPDMUZRBRDJ-GZMMTYOYSA-N 1 2 227.283 2.263 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CCC[C@@](C)(F)C2)o1 ZINC000336268645 387102311 /nfs/dbraw/zinc/10/23/11/387102311.db2.gz ATPJPDMUZRBRDJ-GZMMTYOYSA-N 1 2 227.283 2.263 20 0 BEADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc[nH]n1 ZINC000336284539 387117892 /nfs/dbraw/zinc/11/78/92/387117892.db2.gz ZIXSULGYJOJFSA-VXNVDRBHSA-N 1 2 233.237 2.182 20 0 BEADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cc[nH]n1 ZINC000336284539 387117895 /nfs/dbraw/zinc/11/78/95/387117895.db2.gz ZIXSULGYJOJFSA-VXNVDRBHSA-N 1 2 233.237 2.182 20 0 BEADLO CCOC1(C)C[NH+](Cc2cccc(OC)c2)C1 ZINC000459623048 387141657 /nfs/dbraw/zinc/14/16/57/387141657.db2.gz YOWWHKFPXZPHSK-UHFFFAOYSA-N 1 2 235.327 2.306 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2C[C@@H](C)S[C@@H](C)C2)no1 ZINC000571690031 387142407 /nfs/dbraw/zinc/14/24/07/387142407.db2.gz UGAYVNIPBVUYBR-HRDYMLBCSA-N 1 2 241.360 2.265 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2C[C@@H](C)S[C@@H](C)C2)no1 ZINC000571690031 387142412 /nfs/dbraw/zinc/14/24/12/387142412.db2.gz UGAYVNIPBVUYBR-HRDYMLBCSA-N 1 2 241.360 2.265 20 0 BEADLO Cc1noc([C@@H](C)[NH2+]Cc2cnn(C(C)C)c2)n1 ZINC000352400269 387147898 /nfs/dbraw/zinc/14/78/98/387147898.db2.gz QWJDPMLTSQIJJE-SECBINFHSA-N 1 2 249.318 2.006 20 0 BEADLO C[C@@H](Cc1ccccc1)C[N@H+](C)Cc1nnc[nH]1 ZINC000187004206 387149833 /nfs/dbraw/zinc/14/98/33/387149833.db2.gz RNMOVEVRQGYWBW-LBPRGKRZSA-N 1 2 244.342 2.115 20 0 BEADLO C[C@@H](Cc1ccccc1)C[N@@H+](C)Cc1nnc[nH]1 ZINC000187004206 387149845 /nfs/dbraw/zinc/14/98/45/387149845.db2.gz RNMOVEVRQGYWBW-LBPRGKRZSA-N 1 2 244.342 2.115 20 0 BEADLO CC(C)c1[nH]c2c([nH+]1)CC[C@@H](C(N)=O)C2 ZINC000336328164 387156523 /nfs/dbraw/zinc/15/65/23/387156523.db2.gz GOKOIQQENHWWLR-SSDOTTSWSA-N 1 2 207.277 2.173 20 0 BEADLO CC(C)c1[nH]c2c([nH+]1)C[C@H](C(N)=O)CC2 ZINC000336328164 387156530 /nfs/dbraw/zinc/15/65/30/387156530.db2.gz GOKOIQQENHWWLR-SSDOTTSWSA-N 1 2 207.277 2.173 20 0 BEADLO Cn1cncc1C[NH+]1CC(c2ccccc2F)C1 ZINC000336339567 387165642 /nfs/dbraw/zinc/16/56/42/387165642.db2.gz KVFWIEBGSVYCSA-UHFFFAOYSA-N 1 2 245.301 2.159 20 0 BEADLO CC(C)c1nc(C[N@@H+]2CC[C@H](C)C2)no1 ZINC000336348617 387178696 /nfs/dbraw/zinc/17/86/96/387178696.db2.gz YTLDUNRSLYJUQY-VIFPVBQESA-N 1 2 209.293 2.035 20 0 BEADLO CC(C)c1nc(C[N@H+]2CC[C@H](C)C2)no1 ZINC000336348617 387178701 /nfs/dbraw/zinc/17/87/01/387178701.db2.gz YTLDUNRSLYJUQY-VIFPVBQESA-N 1 2 209.293 2.035 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ccon2)c(C)n1 ZINC000359889444 387183670 /nfs/dbraw/zinc/18/36/70/387183670.db2.gz YYLFXYANIKYUAD-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ccon2)c(C)n1 ZINC000359889444 387183677 /nfs/dbraw/zinc/18/36/77/387183677.db2.gz YYLFXYANIKYUAD-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO C[C@@H]1C[C@H]1CC(=O)Nc1c[nH+]c2n1CCCC2 ZINC000336304863 387133782 /nfs/dbraw/zinc/13/37/82/387133782.db2.gz MKMXVWSRTXLZGO-ZJUUUORDSA-N 1 2 233.315 2.204 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2C[C@H](C)[C@H]2C)o1 ZINC000336375560 387205352 /nfs/dbraw/zinc/20/53/52/387205352.db2.gz YHYLANSLBXZRAQ-DTWKUNHWSA-N 1 2 209.293 2.033 20 0 BEADLO CC(C)c1nnc(C[N@H+]2C[C@H](C)[C@H]2C)o1 ZINC000336375560 387205361 /nfs/dbraw/zinc/20/53/61/387205361.db2.gz YHYLANSLBXZRAQ-DTWKUNHWSA-N 1 2 209.293 2.033 20 0 BEADLO CCC[N@H+](CC(=O)OCC)Cc1occc1C ZINC000092380503 387211163 /nfs/dbraw/zinc/21/11/63/387211163.db2.gz IXADYKOJJGLWHD-UHFFFAOYSA-N 1 2 239.315 2.363 20 0 BEADLO CCC[N@@H+](CC(=O)OCC)Cc1occc1C ZINC000092380503 387211170 /nfs/dbraw/zinc/21/11/70/387211170.db2.gz IXADYKOJJGLWHD-UHFFFAOYSA-N 1 2 239.315 2.363 20 0 BEADLO CCN(CC1CCC1)c1cc[nH+]c(C)n1 ZINC000360064997 387222176 /nfs/dbraw/zinc/22/21/76/387222176.db2.gz XJLSVKALUHOIPW-UHFFFAOYSA-N 1 2 205.305 2.411 20 0 BEADLO CCn1c[nH+]cc1CNc1c(C)nn(CC)c1C ZINC000417963340 387230024 /nfs/dbraw/zinc/23/00/24/387230024.db2.gz DFIADHVUUAFZIT-UHFFFAOYSA-N 1 2 247.346 2.348 20 0 BEADLO FC(F)(F)c1cc(C[NH+]2CCCCC2)[nH]n1 ZINC000336405335 387233662 /nfs/dbraw/zinc/23/36/62/387233662.db2.gz UNBALIGUPWRTRX-UHFFFAOYSA-N 1 2 233.237 2.414 20 0 BEADLO Cc1cc(C)c(NC(=O)c2cnccn2)c(C)[nH+]1 ZINC000097039923 387234279 /nfs/dbraw/zinc/23/42/79/387234279.db2.gz OQYHZBBGXSKRES-UHFFFAOYSA-N 1 2 242.282 2.049 20 0 BEADLO Cc1nc(N2CCOCC3(CC3)C2)c(C)c(C)[nH+]1 ZINC000360173607 387237876 /nfs/dbraw/zinc/23/78/76/387237876.db2.gz AJJRMLUVKNUUSP-UHFFFAOYSA-N 1 2 247.342 2.019 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)CCC(C)(C)C ZINC000300742608 387242115 /nfs/dbraw/zinc/24/21/15/387242115.db2.gz BUXDIJYVWSZRMY-UHFFFAOYSA-N 1 2 223.320 2.194 20 0 BEADLO C[C@H]([NH2+][C@@H](C(N)=O)c1ccccc1)c1ccco1 ZINC000120492746 387249447 /nfs/dbraw/zinc/24/94/47/387249447.db2.gz RPMKUSOHPMQKNU-GXFFZTMASA-N 1 2 244.294 2.157 20 0 BEADLO COC1(CNc2cc(C)[nH+]cn2)CCC(C)CC1 ZINC000359939309 387195426 /nfs/dbraw/zinc/19/54/26/387195426.db2.gz BQJHNUSRRWHXSI-UHFFFAOYSA-N 1 2 249.358 2.214 20 0 BEADLO CC(C)(C)CCC(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000371365186 387198592 /nfs/dbraw/zinc/19/85/92/387198592.db2.gz RSXBCWBJLQACFK-JTQLQIEISA-N 1 2 249.358 2.210 20 0 BEADLO CC(C)(C)CCC(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000371365186 387198596 /nfs/dbraw/zinc/19/85/96/387198596.db2.gz RSXBCWBJLQACFK-JTQLQIEISA-N 1 2 249.358 2.210 20 0 BEADLO CCC[C@@H]([NH2+]CC1(SC)CC1)C(=O)OCC ZINC000193331142 387200507 /nfs/dbraw/zinc/20/05/07/387200507.db2.gz TYQPIJDLVYZHHK-SNVBAGLBSA-N 1 2 245.388 2.203 20 0 BEADLO CO[C@@](C)(CNc1cc[nH+]c(C(C)C)n1)C1CC1 ZINC000359967814 387201636 /nfs/dbraw/zinc/20/16/36/387201636.db2.gz KGSLAORCZQTFQE-AWEZNQCLSA-N 1 2 249.358 2.249 20 0 BEADLO CC[C@@H](NCC(F)(F)C[NH3+])C1CCCC1 ZINC000423348377 387201574 /nfs/dbraw/zinc/20/15/74/387201574.db2.gz SSRIKXCBVFSKSM-SNVBAGLBSA-N 1 2 220.307 2.139 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N(C)Cc1ccoc1 ZINC000336481197 387309596 /nfs/dbraw/zinc/30/95/96/387309596.db2.gz BFSFIVGFWJDRLV-UHFFFAOYSA-N 1 2 245.282 2.069 20 0 BEADLO Cc1ccc(F)c(C[N@@H+]2C[C@H](F)C[C@H]2CO)c1 ZINC000336424844 387254989 /nfs/dbraw/zinc/25/49/89/387254989.db2.gz QYPIFIPBXUXIAM-NEPJUHHUSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1ccc(F)c(C[N@H+]2C[C@H](F)C[C@H]2CO)c1 ZINC000336424844 387254994 /nfs/dbraw/zinc/25/49/94/387254994.db2.gz QYPIFIPBXUXIAM-NEPJUHHUSA-N 1 2 241.281 2.039 20 0 BEADLO CC[C@H](CC(C)C)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000514709944 387275779 /nfs/dbraw/zinc/27/57/79/387275779.db2.gz JFXAYHHYPPBWNV-GFCCVEGCSA-N 1 2 249.358 2.339 20 0 BEADLO C[C@@H]1c2ccccc2CN1Cc1[nH]cc[nH+]1 ZINC000353862639 387287153 /nfs/dbraw/zinc/28/71/53/387287153.db2.gz DRYJWEXDCPCSPY-SNVBAGLBSA-N 1 2 213.284 2.487 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1CCC[C@H](CO)C1 ZINC000572257139 387287494 /nfs/dbraw/zinc/28/74/94/387287494.db2.gz FCPXQPZOKVOEDW-NWDGAFQWSA-N 1 2 235.331 2.056 20 0 BEADLO CO[C@H]1CC[N@H+](Cc2csc(C(C)C)n2)C1 ZINC000353878481 387290633 /nfs/dbraw/zinc/29/06/33/387290633.db2.gz DFQMPPAUGXIHKQ-NSHDSACASA-N 1 2 240.372 2.487 20 0 BEADLO CO[C@H]1CC[N@@H+](Cc2csc(C(C)C)n2)C1 ZINC000353878481 387290638 /nfs/dbraw/zinc/29/06/38/387290638.db2.gz DFQMPPAUGXIHKQ-NSHDSACASA-N 1 2 240.372 2.487 20 0 BEADLO Cc1n[nH]cc1NC(=O)Nc1cc[nH+]cc1C ZINC000121045281 387291883 /nfs/dbraw/zinc/29/18/83/387291883.db2.gz UDAYPFXIZYXFNC-UHFFFAOYSA-N 1 2 231.259 2.066 20 0 BEADLO C[C@H]1CC[C@H](C(=O)N2CC(n3cc[nH+]c3)C2)CC1 ZINC000514865653 387295178 /nfs/dbraw/zinc/29/51/78/387295178.db2.gz KQAHSJHFLDUHOX-HAQNSBGRSA-N 1 2 247.342 2.093 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H]1CC[C@H](C)CC1 ZINC000514676799 387296722 /nfs/dbraw/zinc/29/67/22/387296722.db2.gz JBOBQWDHENOPHL-HOMQSWHASA-N 1 2 235.331 2.161 20 0 BEADLO Cc1ccnc(C[NH+]2CCC(C(F)F)CC2)n1 ZINC000336555643 387378073 /nfs/dbraw/zinc/37/80/73/387378073.db2.gz MXOXMCUWLHTQGS-UHFFFAOYSA-N 1 2 241.285 2.262 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1ccc(Cl)o1 ZINC000354058269 387321803 /nfs/dbraw/zinc/32/18/03/387321803.db2.gz FUBUWDPWXHIJTH-MRVPVSSYSA-N 1 2 215.680 2.154 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1ccc(Cl)o1 ZINC000354058269 387321809 /nfs/dbraw/zinc/32/18/09/387321809.db2.gz FUBUWDPWXHIJTH-MRVPVSSYSA-N 1 2 215.680 2.154 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC000336557982 387382497 /nfs/dbraw/zinc/38/24/97/387382497.db2.gz UBEPSQGQFGVSLV-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@H]1c1cccnc1 ZINC000336557982 387382501 /nfs/dbraw/zinc/38/25/01/387382501.db2.gz UBEPSQGQFGVSLV-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2CO[C@@H](C)C2)c(C)[nH+]1 ZINC000336502367 387327630 /nfs/dbraw/zinc/32/76/30/387327630.db2.gz BETSMAVZQSCZPF-GXSJLCMTSA-N 1 2 234.299 2.062 20 0 BEADLO C[C@@H](CC(=O)N(C)C1CCCC1)n1cc[nH+]c1 ZINC000515062242 387330263 /nfs/dbraw/zinc/33/02/63/387330263.db2.gz DJDSABCEHFEOFT-NSHDSACASA-N 1 2 235.331 2.235 20 0 BEADLO Cc1ccc(F)c(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)c1 ZINC000336507100 387331244 /nfs/dbraw/zinc/33/12/44/387331244.db2.gz DWCQPNKEVBMLEC-BETUJISGSA-N 1 2 235.302 2.497 20 0 BEADLO Cc1ccc(F)c(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c1 ZINC000336507100 387331246 /nfs/dbraw/zinc/33/12/46/387331246.db2.gz DWCQPNKEVBMLEC-BETUJISGSA-N 1 2 235.302 2.497 20 0 BEADLO c1nc(C[NH2+][C@H](c2cccnc2)C2CC2)co1 ZINC000515197623 387344939 /nfs/dbraw/zinc/34/49/39/387344939.db2.gz UKUCBMAWGAFHCN-ZDUSSCGKSA-N 1 2 229.283 2.311 20 0 BEADLO C[C@H]1CC[N@@H+]1Cc1cccc(Br)n1 ZINC000575599223 387351179 /nfs/dbraw/zinc/35/11/79/387351179.db2.gz BXKRCQWYTYSASB-QMMMGPOBSA-N 1 2 241.132 2.438 20 0 BEADLO C[C@H]1CC[N@H+]1Cc1cccc(Br)n1 ZINC000575599223 387351181 /nfs/dbraw/zinc/35/11/81/387351181.db2.gz BXKRCQWYTYSASB-QMMMGPOBSA-N 1 2 241.132 2.438 20 0 BEADLO c1coc([C@@H]2C[N@H+](Cc3cccnc3)CCO2)c1 ZINC000121440491 387351500 /nfs/dbraw/zinc/35/15/00/387351500.db2.gz VMKPEZGHJSCQBP-AWEZNQCLSA-N 1 2 244.294 2.248 20 0 BEADLO c1coc([C@@H]2C[N@@H+](Cc3cccnc3)CCO2)c1 ZINC000121440491 387351505 /nfs/dbraw/zinc/35/15/05/387351505.db2.gz VMKPEZGHJSCQBP-AWEZNQCLSA-N 1 2 244.294 2.248 20 0 BEADLO CS[C@H](C)CCC(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000572378046 387353199 /nfs/dbraw/zinc/35/31/99/387353199.db2.gz VUDWFMWDMXBFES-RKDXNWHRSA-N 1 2 241.360 2.119 20 0 BEADLO CC[C@@H](C)CCC(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000352725481 387462480 /nfs/dbraw/zinc/46/24/80/387462480.db2.gz QATACQFTWYOFRP-SNVBAGLBSA-N 1 2 223.320 2.194 20 0 BEADLO CC[C@@H](C)NC(=O)C[N@@H+]1Cc2ccccc2[C@H]1C ZINC000361072927 387399035 /nfs/dbraw/zinc/39/90/35/387399035.db2.gz HWTBRJPINPYEKX-VXGBXAGGSA-N 1 2 246.354 2.478 20 0 BEADLO CC[C@@H](C)NC(=O)C[N@H+]1Cc2ccccc2[C@H]1C ZINC000361072927 387399040 /nfs/dbraw/zinc/39/90/40/387399040.db2.gz HWTBRJPINPYEKX-VXGBXAGGSA-N 1 2 246.354 2.478 20 0 BEADLO Cc1[nH]nc2ncc(C[N@@H+]3CCC=C(F)C3)cc12 ZINC000336588618 387413640 /nfs/dbraw/zinc/41/36/40/387413640.db2.gz REMKDCGWYDBFFV-UHFFFAOYSA-N 1 2 246.289 2.325 20 0 BEADLO Cc1[nH]nc2ncc(C[N@H+]3CCC=C(F)C3)cc12 ZINC000336588618 387413642 /nfs/dbraw/zinc/41/36/42/387413642.db2.gz REMKDCGWYDBFFV-UHFFFAOYSA-N 1 2 246.289 2.325 20 0 BEADLO CC(C)n1ccc(C[NH2+][C@@H](C)c2cnn(C)c2)n1 ZINC000268972703 387418866 /nfs/dbraw/zinc/41/88/66/387418866.db2.gz AYEITWYHKCKHBQ-NSHDSACASA-N 1 2 247.346 2.048 20 0 BEADLO CC(C)n1ccc(C[N@@H+]2CC[C@@](C)(F)C2)n1 ZINC000336595137 387420397 /nfs/dbraw/zinc/42/03/97/387420397.db2.gz FNFMURIPQDZPEJ-GFCCVEGCSA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1ccc(C[N@H+]2CC[C@@](C)(F)C2)n1 ZINC000336595137 387420402 /nfs/dbraw/zinc/42/04/02/387420402.db2.gz FNFMURIPQDZPEJ-GFCCVEGCSA-N 1 2 225.311 2.398 20 0 BEADLO C[C@H](O)[C@@H]1CCN(c2[nH+]ccc3ccccc32)C1 ZINC000162697807 387495901 /nfs/dbraw/zinc/49/59/01/387495901.db2.gz PCPBOTXIAIVPJB-WCQYABFASA-N 1 2 242.322 2.442 20 0 BEADLO O=C(/C=C/C1CC1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000375067889 387508075 /nfs/dbraw/zinc/50/80/75/387508075.db2.gz ZWBKORUHHCTCSE-QRGHLMKCSA-N 1 2 231.299 2.039 20 0 BEADLO CCCCNC(=O)C[N@@H+]1Cc2ccc(C)cc2C1 ZINC000361601793 387508124 /nfs/dbraw/zinc/50/81/24/387508124.db2.gz HIFWCCJYFLZHQA-UHFFFAOYSA-N 1 2 246.354 2.227 20 0 BEADLO CCCCNC(=O)C[N@H+]1Cc2ccc(C)cc2C1 ZINC000361601793 387508127 /nfs/dbraw/zinc/50/81/27/387508127.db2.gz HIFWCCJYFLZHQA-UHFFFAOYSA-N 1 2 246.354 2.227 20 0 BEADLO C[C@@H](CC(C)(C)C)C(=O)NCc1[nH+]ccn1C ZINC000355294441 387513979 /nfs/dbraw/zinc/51/39/79/387513979.db2.gz QEVHQCDAKFIVHC-JTQLQIEISA-N 1 2 237.347 2.109 20 0 BEADLO c1ccc2[nH+]c(N3CCC4(CCO4)CC3)[nH]c2c1 ZINC000374544273 387465295 /nfs/dbraw/zinc/46/52/95/387465295.db2.gz QPHJGYJCEPODHI-UHFFFAOYSA-N 1 2 243.310 2.322 20 0 BEADLO CCO[C@H](C)c1nccn1CCCn1cc[nH+]c1 ZINC000122098030 387466539 /nfs/dbraw/zinc/46/65/39/387466539.db2.gz SSDVWMAMFPLZEC-GFCCVEGCSA-N 1 2 248.330 2.267 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N3C[C@H](C)[C@@H]3C)ccn12 ZINC000516193669 387473582 /nfs/dbraw/zinc/47/35/82/387473582.db2.gz WFOGKAQFMUUCMT-ONGXEEELSA-N 1 2 243.310 2.123 20 0 BEADLO Cc1cn2c(n1)C[N@H+]([C@@H](C)c1cccnc1)CC2 ZINC000374702589 387482689 /nfs/dbraw/zinc/48/26/89/387482689.db2.gz SBKOFNHVRGNKSC-LBPRGKRZSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1cn2c(n1)C[N@@H+]([C@@H](C)c1cccnc1)CC2 ZINC000374702589 387482696 /nfs/dbraw/zinc/48/26/96/387482696.db2.gz SBKOFNHVRGNKSC-LBPRGKRZSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1cn2c([nH+]1)CN(C(=O)/C=C/C(C)(C)C)CC2 ZINC000374692707 387483574 /nfs/dbraw/zinc/48/35/74/387483574.db2.gz IJUCQDYGALRTMC-AATRIKPKSA-N 1 2 247.342 2.136 20 0 BEADLO COC1(C[N@H+](C)CC(F)F)CCCC1 ZINC000361546248 387483899 /nfs/dbraw/zinc/48/38/99/387483899.db2.gz ASICILDESXDAMN-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO COC1(C[N@@H+](C)CC(F)F)CCCC1 ZINC000361546248 387483902 /nfs/dbraw/zinc/48/39/02/387483902.db2.gz ASICILDESXDAMN-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO CC[C@H](C[NH2+][C@@H](C)C(=O)OC)c1ccccc1 ZINC000355133310 387485287 /nfs/dbraw/zinc/48/52/87/387485287.db2.gz NXBLNBIDUIULIW-NWDGAFQWSA-N 1 2 235.327 2.331 20 0 BEADLO Cc1nnc(C[NH2+]C2(c3ccc(F)cc3)CC2)[nH]1 ZINC000428390835 387581519 /nfs/dbraw/zinc/58/15/19/387581519.db2.gz VFVMSMSUOQOFDM-UHFFFAOYSA-N 1 2 246.289 2.031 20 0 BEADLO COC1(C)C[NH+](Cc2ccccc2F)C1 ZINC000362309659 387595342 /nfs/dbraw/zinc/59/53/42/387595342.db2.gz SAGZBGMSXRXHIQ-UHFFFAOYSA-N 1 2 209.264 2.046 20 0 BEADLO CCCCOCC(=O)Nc1c(C)cc[nH+]c1C ZINC000362396879 387607605 /nfs/dbraw/zinc/60/76/05/387607605.db2.gz PMCUCXDJWJOHCI-UHFFFAOYSA-N 1 2 236.315 2.454 20 0 BEADLO CCc1noc(C)c1C[N@@H+]1CCOC(C)(C)C1 ZINC000162802635 387609224 /nfs/dbraw/zinc/60/92/24/387609224.db2.gz LFVAPJQSYZIZTR-UHFFFAOYSA-N 1 2 238.331 2.156 20 0 BEADLO CCc1noc(C)c1C[N@H+]1CCOC(C)(C)C1 ZINC000162802635 387609227 /nfs/dbraw/zinc/60/92/27/387609227.db2.gz LFVAPJQSYZIZTR-UHFFFAOYSA-N 1 2 238.331 2.156 20 0 BEADLO COC(=O)c1ccc(COc2cc[nH+]cc2)o1 ZINC000356095602 387616767 /nfs/dbraw/zinc/61/67/67/387616767.db2.gz NBMKAUBJGJRLRN-UHFFFAOYSA-N 1 2 233.223 2.040 20 0 BEADLO COCc1ccc(CNc2cccc[nH+]2)o1 ZINC000124523828 387619863 /nfs/dbraw/zinc/61/98/63/387619863.db2.gz GQNGBTLSIQSQCT-UHFFFAOYSA-N 1 2 218.256 2.433 20 0 BEADLO CCCc1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000356134655 387620778 /nfs/dbraw/zinc/62/07/78/387620778.db2.gz YWZRRMXWBWUEJT-UHFFFAOYSA-N 1 2 217.272 2.316 20 0 BEADLO C[C@H]([NH2+]Cc1cscn1)c1ccccn1 ZINC000040420954 387549563 /nfs/dbraw/zinc/54/95/63/387549563.db2.gz BBHPOWHFWVZSAQ-VIFPVBQESA-N 1 2 219.313 2.389 20 0 BEADLO CC[C@H]([NH2+]C1CC(c2ccccc2)C1)C(=O)OC ZINC000279716840 387568515 /nfs/dbraw/zinc/56/85/15/387568515.db2.gz INUQBADNRDJUJN-RUXDESIVSA-N 1 2 247.338 2.474 20 0 BEADLO CCn1c[nH+]cc1CNc1cc(C)n(C(C)C)n1 ZINC000422122910 387572242 /nfs/dbraw/zinc/57/22/42/387572242.db2.gz QVKCYYVXEASODC-UHFFFAOYSA-N 1 2 247.346 2.023 20 0 BEADLO Fc1ccc(C[NH2+][C@@H]2CCCc3cn[nH]c32)nc1 ZINC000527604714 387636873 /nfs/dbraw/zinc/63/68/73/387636873.db2.gz SGXCXEUYMOQPDP-GFCCVEGCSA-N 1 2 246.289 2.111 20 0 BEADLO Fc1ccc(C[NH2+][C@@H]2CCCc3c[nH]nc32)nc1 ZINC000527604714 387636881 /nfs/dbraw/zinc/63/68/81/387636881.db2.gz SGXCXEUYMOQPDP-GFCCVEGCSA-N 1 2 246.289 2.111 20 0 BEADLO CCn1cc[nH+]c1CN1CCC[C@H]1C(F)(F)F ZINC000527629372 387641787 /nfs/dbraw/zinc/64/17/87/387641787.db2.gz IOIDVPSYICUEHU-VIFPVBQESA-N 1 2 247.264 2.430 20 0 BEADLO C[C@@H](NC(=O)CCn1cc[nH+]c1)C1CCCCC1 ZINC000356317060 387642188 /nfs/dbraw/zinc/64/21/88/387642188.db2.gz JZIDFBDDECIAGY-GFCCVEGCSA-N 1 2 249.358 2.358 20 0 BEADLO FC(F)(F)CC[N@@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000376495655 387643340 /nfs/dbraw/zinc/64/33/40/387643340.db2.gz PTIYSDXCEYENCC-MRVPVSSYSA-N 1 2 233.237 2.499 20 0 BEADLO FC(F)(F)CC[N@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000376495655 387643343 /nfs/dbraw/zinc/64/33/43/387643343.db2.gz PTIYSDXCEYENCC-MRVPVSSYSA-N 1 2 233.237 2.499 20 0 BEADLO Cc1nc(C)c(CNc2ccc(CO)c[nH+]2)s1 ZINC000356335119 387646437 /nfs/dbraw/zinc/64/64/37/387646437.db2.gz JKYUMKUDJQFFHG-UHFFFAOYSA-N 1 2 249.339 2.259 20 0 BEADLO Cc1c[nH]nc1C[N@@H+](C)Cc1cnccc1C ZINC000356408731 387656133 /nfs/dbraw/zinc/65/61/33/387656133.db2.gz RTDBRZPNMFTQEF-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1c[nH]nc1C[N@H+](C)Cc1cnccc1C ZINC000356408731 387656136 /nfs/dbraw/zinc/65/61/36/387656136.db2.gz RTDBRZPNMFTQEF-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1cn[nH]c1C[N@@H+](C)Cc1cnccc1C ZINC000356408731 387656141 /nfs/dbraw/zinc/65/61/41/387656141.db2.gz RTDBRZPNMFTQEF-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1cn[nH]c1C[N@H+](C)Cc1cnccc1C ZINC000356408731 387656147 /nfs/dbraw/zinc/65/61/47/387656147.db2.gz RTDBRZPNMFTQEF-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO CCCc1nc(C[NH+]2[C@H](C)CC[C@H]2C)no1 ZINC000123245128 387671061 /nfs/dbraw/zinc/67/10/61/387671061.db2.gz GRUWYNYUSKOEHR-NXEZZACHSA-N 1 2 223.320 2.395 20 0 BEADLO CC[C@H](F)C[N@H+](C)CC(=O)Nc1ccccc1 ZINC000440710256 387677155 /nfs/dbraw/zinc/67/71/55/387677155.db2.gz LGPSKGMQBRXYDT-NSHDSACASA-N 1 2 238.306 2.305 20 0 BEADLO CC[C@H](F)C[N@@H+](C)CC(=O)Nc1ccccc1 ZINC000440710256 387677161 /nfs/dbraw/zinc/67/71/61/387677161.db2.gz LGPSKGMQBRXYDT-NSHDSACASA-N 1 2 238.306 2.305 20 0 BEADLO COC(=O)CC1(C[N@H+](CC(F)F)C2CC2)CC1 ZINC000440717870 387680385 /nfs/dbraw/zinc/68/03/85/387680385.db2.gz YKJYWUHAGQLCGO-UHFFFAOYSA-N 1 2 247.285 2.059 20 0 BEADLO COC(=O)CC1(C[N@@H+](CC(F)F)C2CC2)CC1 ZINC000440717870 387680388 /nfs/dbraw/zinc/68/03/88/387680388.db2.gz YKJYWUHAGQLCGO-UHFFFAOYSA-N 1 2 247.285 2.059 20 0 BEADLO CCn1ncc(C[NH2+]Cc2ccc(F)cc2C)n1 ZINC000527733047 387682529 /nfs/dbraw/zinc/68/25/29/387682529.db2.gz FBWISDBWCHUWSO-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO CCn1ncc(C[NH2+]Cc2cc(F)ccc2C)n1 ZINC000527733372 387682764 /nfs/dbraw/zinc/68/27/64/387682764.db2.gz DUOUUDNGGLYCEQ-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO CC(C)C(C)(C)[S@@](=O)Cc1c[nH+]cn1C ZINC000431187577 387686370 /nfs/dbraw/zinc/68/63/70/387686370.db2.gz PVCVJEAGDMTXGD-HNNXBMFYSA-N 1 2 228.361 2.103 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000440776303 387692746 /nfs/dbraw/zinc/69/27/46/387692746.db2.gz BZUPFDGQGCTMGA-ZJUUUORDSA-N 1 2 211.284 2.295 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000440776303 387692753 /nfs/dbraw/zinc/69/27/53/387692753.db2.gz BZUPFDGQGCTMGA-ZJUUUORDSA-N 1 2 211.284 2.295 20 0 BEADLO FC1(F)COCC[N@H+](C[C@H]2CC=CCC2)C1 ZINC000367682858 387745014 /nfs/dbraw/zinc/74/50/14/387745014.db2.gz HHJAFAHPANVWTE-NSHDSACASA-N 1 2 231.286 2.310 20 0 BEADLO FC1(F)COCC[N@@H+](C[C@H]2CC=CCC2)C1 ZINC000367682858 387745017 /nfs/dbraw/zinc/74/50/17/387745017.db2.gz HHJAFAHPANVWTE-NSHDSACASA-N 1 2 231.286 2.310 20 0 BEADLO CC[C@H](F)C[N@@H+]1CCO[C@@H](c2ccco2)C1 ZINC000440790531 387699160 /nfs/dbraw/zinc/69/91/60/387699160.db2.gz LDHARWLJZBEWMY-CMPLNLGQSA-N 1 2 227.279 2.401 20 0 BEADLO CC[C@H](F)C[N@H+]1CCO[C@@H](c2ccco2)C1 ZINC000440790531 387699164 /nfs/dbraw/zinc/69/91/64/387699164.db2.gz LDHARWLJZBEWMY-CMPLNLGQSA-N 1 2 227.279 2.401 20 0 BEADLO FC(F)(F)c1cc(CNc2cccc[nH+]2)[nH]n1 ZINC000440814486 387705571 /nfs/dbraw/zinc/70/55/71/387705571.db2.gz ZBSSBKMGGZSBLP-UHFFFAOYSA-N 1 2 242.204 2.436 20 0 BEADLO c1cc(OCCO[C@H]2CCCCO2)cc[nH+]1 ZINC000431481121 387709881 /nfs/dbraw/zinc/70/98/81/387709881.db2.gz GVXSDYMRBNXLGF-LBPRGKRZSA-N 1 2 223.272 2.004 20 0 BEADLO c1cc(OCCCO[C@H]2CCCCO2)cc[nH+]1 ZINC000431484288 387710350 /nfs/dbraw/zinc/71/03/50/387710350.db2.gz RHRLMIXFEQZUFN-ZDUSSCGKSA-N 1 2 237.299 2.394 20 0 BEADLO COC(=O)c1ccoc1COc1cc[nH+]cc1 ZINC000431507072 387712324 /nfs/dbraw/zinc/71/23/24/387712324.db2.gz KVOPBRIFJYDIFC-UHFFFAOYSA-N 1 2 233.223 2.040 20 0 BEADLO C[C@H]([NH2+]Cc1c[nH]nn1)[C@H]1CCC[C@@H](C)C1 ZINC000452055457 387716855 /nfs/dbraw/zinc/71/68/55/387716855.db2.gz BYUOVVZJAGVXST-VWYCJHECSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@H]([NH2+]Cc1cn[nH]n1)[C@H]1CCC[C@@H](C)C1 ZINC000452055457 387716860 /nfs/dbraw/zinc/71/68/60/387716860.db2.gz BYUOVVZJAGVXST-VWYCJHECSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@H]([NH2+]Cc1c[nH]nn1)[C@@H]1CCC[C@H](C)C1 ZINC000452055455 387717174 /nfs/dbraw/zinc/71/71/74/387717174.db2.gz BYUOVVZJAGVXST-GARJFASQSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@H]([NH2+]Cc1cn[nH]n1)[C@@H]1CCC[C@H](C)C1 ZINC000452055455 387717178 /nfs/dbraw/zinc/71/71/78/387717178.db2.gz BYUOVVZJAGVXST-GARJFASQSA-N 1 2 222.336 2.109 20 0 BEADLO O=C(CCC1CC1)N1CCC(n2cc[nH+]c2)CC1 ZINC000115352352 387718422 /nfs/dbraw/zinc/71/84/22/387718422.db2.gz OKCJRJQVEWLAAV-UHFFFAOYSA-N 1 2 247.342 2.237 20 0 BEADLO Cc1nc(N(C)[C@@H](C)C2CCC2)cc[nH+]1 ZINC000356772454 387720099 /nfs/dbraw/zinc/72/00/99/387720099.db2.gz BBJDJKMBGHTBBG-VIFPVBQESA-N 1 2 205.305 2.410 20 0 BEADLO C[C@H](CC(C)(C)C)C(=O)NCc1c[nH+]c[nH]1 ZINC000356835429 387730050 /nfs/dbraw/zinc/73/00/50/387730050.db2.gz UIQPJICFKUYUHA-SECBINFHSA-N 1 2 223.320 2.098 20 0 BEADLO C[C@H](CC(C)(C)C)C(=O)NCc1c[nH]c[nH+]1 ZINC000356835429 387730053 /nfs/dbraw/zinc/73/00/53/387730053.db2.gz UIQPJICFKUYUHA-SECBINFHSA-N 1 2 223.320 2.098 20 0 BEADLO Cc1noc([C@@H](C)[NH2+]Cc2ccc(F)cc2)n1 ZINC000356897919 387741828 /nfs/dbraw/zinc/74/18/28/387741828.db2.gz UPEMTHVKNJEDAU-MRVPVSSYSA-N 1 2 235.262 2.368 20 0 BEADLO COc1ccc[nH+]c1NC[C@@](C)(O)c1ccco1 ZINC000527905031 387761810 /nfs/dbraw/zinc/76/18/10/387761810.db2.gz GAIVQKLDFJKLRB-CYBMUJFWSA-N 1 2 248.282 2.003 20 0 BEADLO COc1ccc[nH+]c1N1C[C@@H](C)[C@H](C)C1 ZINC000527911544 387764807 /nfs/dbraw/zinc/76/48/07/387764807.db2.gz PVJYHHOFCZVFEV-NXEZZACHSA-N 1 2 206.289 2.182 20 0 BEADLO COc1ccc[nH+]c1N1CCC2(C1)CCOCC2 ZINC000527911267 387764923 /nfs/dbraw/zinc/76/49/23/387764923.db2.gz OBABJZAEVDZEST-UHFFFAOYSA-N 1 2 248.326 2.097 20 0 BEADLO CC[C@@H](C)CCC(=O)N1CCn2c[nH+]cc2C1 ZINC000378124245 387765929 /nfs/dbraw/zinc/76/59/29/387765929.db2.gz XFFCNAZKHKCWEQ-LLVKDONJSA-N 1 2 235.331 2.052 20 0 BEADLO COc1ccc[nH+]c1N(C)Cc1scnc1C ZINC000527884651 387770686 /nfs/dbraw/zinc/77/06/86/387770686.db2.gz JWLLCOBTVHFADC-UHFFFAOYSA-N 1 2 249.339 2.492 20 0 BEADLO Cc1ccc(CNc2cccc(CO)[nH+]2)cc1 ZINC000432735978 387812159 /nfs/dbraw/zinc/81/21/59/387812159.db2.gz AFWKHLRUBPGCCE-UHFFFAOYSA-N 1 2 228.295 2.494 20 0 BEADLO CC[C@H]1CN(c2[nH+]cccc2OC)C[C@H](C)O1 ZINC000527890162 387774820 /nfs/dbraw/zinc/77/48/20/387774820.db2.gz MZQGJWJNMMDFCB-QWRGUYRKSA-N 1 2 236.315 2.094 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1CCC[C@@H]1OC ZINC000527945388 387780897 /nfs/dbraw/zinc/78/08/97/387780897.db2.gz IOBGOUFOUJGREZ-QWRGUYRKSA-N 1 2 236.315 2.317 20 0 BEADLO CC(C)=CC(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000378407809 387783932 /nfs/dbraw/zinc/78/39/32/387783932.db2.gz IBKILCMYRDKNNL-JTQLQIEISA-N 1 2 219.288 2.039 20 0 BEADLO O=C(C=C1CCC1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000378514318 387787161 /nfs/dbraw/zinc/78/71/61/387787161.db2.gz AXIBFZCARVXKFM-NSHDSACASA-N 1 2 231.299 2.184 20 0 BEADLO c1c2cnccc2oc1C[NH+]1CC2(C1)CCCO2 ZINC000628427763 387793957 /nfs/dbraw/zinc/79/39/57/387793957.db2.gz XUGMAWGCETZUIE-UHFFFAOYSA-N 1 2 244.294 2.193 20 0 BEADLO CCCCC(=O)Nc1c[nH+]c2n1CCCC2 ZINC000452344085 387806778 /nfs/dbraw/zinc/80/67/78/387806778.db2.gz NXFTXLLGMBZPCP-UHFFFAOYSA-N 1 2 221.304 2.348 20 0 BEADLO C(c1noc(C2CCC2)n1)[NH+]1CCCCC1 ZINC000442603791 387807810 /nfs/dbraw/zinc/80/78/10/387807810.db2.gz VZKAXVKCDMFMNU-UHFFFAOYSA-N 1 2 221.304 2.323 20 0 BEADLO Cc1oncc1C[N@@H+]1CCO[C@@H](c2ccco2)C1 ZINC000128872594 387756819 /nfs/dbraw/zinc/75/68/19/387756819.db2.gz NSAABGNYTDVKIP-CYBMUJFWSA-N 1 2 248.282 2.150 20 0 BEADLO Cc1oncc1C[N@H+]1CCO[C@@H](c2ccco2)C1 ZINC000128872594 387756821 /nfs/dbraw/zinc/75/68/21/387756821.db2.gz NSAABGNYTDVKIP-CYBMUJFWSA-N 1 2 248.282 2.150 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C1(CC(C)C)CC1 ZINC000442687425 387823575 /nfs/dbraw/zinc/82/35/75/387823575.db2.gz MRQATPYVHGPFRD-UHFFFAOYSA-N 1 2 235.331 2.161 20 0 BEADLO CCCc1nc(C[NH+]2CCCCCC2)no1 ZINC000054982721 387830578 /nfs/dbraw/zinc/83/05/78/387830578.db2.gz IBMUHXMJLVICIY-UHFFFAOYSA-N 1 2 223.320 2.398 20 0 BEADLO CCO[C@H]1C[C@@H](Nc2[nH+]cccc2OC)C1 ZINC000528032837 387833367 /nfs/dbraw/zinc/83/33/67/387833367.db2.gz LPYFLSKBICHJFN-AOOOYVTPSA-N 1 2 222.288 2.070 20 0 BEADLO COc1ccc[nH+]c1NCC[C@H]1CCCOC1 ZINC000528075175 387836385 /nfs/dbraw/zinc/83/63/85/387836385.db2.gz QWCNUJHOVIPCNM-LLVKDONJSA-N 1 2 236.315 2.319 20 0 BEADLO c1ccc2c(c1)cc[nH+]c2N1CCC2(COC2)C1 ZINC000528060116 387838739 /nfs/dbraw/zinc/83/87/39/387838739.db2.gz XNGHIKIVGIPDGJ-UHFFFAOYSA-N 1 2 240.306 2.462 20 0 BEADLO c1cc(NCC[C@H]2CCCOC2)nc(C2CC2)[nH+]1 ZINC000528073852 387843062 /nfs/dbraw/zinc/84/30/62/387843062.db2.gz ODUSMTOTRCCJBM-LLVKDONJSA-N 1 2 247.342 2.005 20 0 BEADLO CC[N@H+](Cc1nnc(C(C)(C)C)[nH]1)C1CC1 ZINC000432927544 387844434 /nfs/dbraw/zinc/84/44/34/387844434.db2.gz IHGSXWMYOSQSJR-UHFFFAOYSA-N 1 2 222.336 2.087 20 0 BEADLO CC[N@@H+](Cc1nnc(C(C)(C)C)[nH]1)C1CC1 ZINC000432927544 387844438 /nfs/dbraw/zinc/84/44/38/387844438.db2.gz IHGSXWMYOSQSJR-UHFFFAOYSA-N 1 2 222.336 2.087 20 0 BEADLO CC[C@H](NC(=O)[C@@H]1CC[C@@H](C)C1)c1[nH]cc[nH+]1 ZINC000442809937 387845572 /nfs/dbraw/zinc/84/55/72/387845572.db2.gz LGRYJCZXIAJIDP-MXWKQRLJSA-N 1 2 235.331 2.413 20 0 BEADLO C1=CCC(CNc2cc[nH+]c(C3CC3)n2)C1 ZINC000528114029 387847777 /nfs/dbraw/zinc/84/77/77/387847777.db2.gz MKARDDSVPZPWEP-UHFFFAOYSA-N 1 2 215.300 2.154 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@H]1CC12CCCC2 ZINC000452570947 387859615 /nfs/dbraw/zinc/85/96/15/387859615.db2.gz MQKNRVOUTWYFHH-LLVKDONJSA-N 1 2 247.342 2.100 20 0 BEADLO CC[C@](C)([NH2+][C@H]1C=CCCC1)C(=O)OC ZINC000293134705 387864322 /nfs/dbraw/zinc/86/43/22/387864322.db2.gz LMLZFVXWYIGQJE-JQWIXIFHSA-N 1 2 211.305 2.026 20 0 BEADLO c1nc(C[NH+]2CCC(OCC3CC3)CC2)co1 ZINC000432753135 387813773 /nfs/dbraw/zinc/81/37/73/387813773.db2.gz AUTRSFQYLYHZCD-UHFFFAOYSA-N 1 2 236.315 2.066 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CCC[C@@H]1CCO ZINC000527970344 387814420 /nfs/dbraw/zinc/81/44/20/387814420.db2.gz YEKFKIRXEABCPE-GHMZBOCLSA-N 1 2 236.315 2.053 20 0 BEADLO C/C(Cl)=C\C[N@H+]1C[C@H](C)OC[C@H]1C ZINC000528339105 387894986 /nfs/dbraw/zinc/89/49/86/387894986.db2.gz IWTUYYPVJCXWBG-PIOFTHJTSA-N 1 2 203.713 2.238 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1C[C@H](C)OC[C@H]1C ZINC000528339105 387894991 /nfs/dbraw/zinc/89/49/91/387894991.db2.gz IWTUYYPVJCXWBG-PIOFTHJTSA-N 1 2 203.713 2.238 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1CCOC(C)(C)C1 ZINC000528338504 387895061 /nfs/dbraw/zinc/89/50/61/387895061.db2.gz NHVKKWAONRBQLR-RUDMXATFSA-N 1 2 203.713 2.240 20 0 BEADLO C/C(Cl)=C\C[N@H+]1CCOC(C)(C)C1 ZINC000528338504 387895066 /nfs/dbraw/zinc/89/50/66/387895066.db2.gz NHVKKWAONRBQLR-RUDMXATFSA-N 1 2 203.713 2.240 20 0 BEADLO CC(C)[N@H+](C)Cc1nc([C@H]2CC[C@H](C)O2)no1 ZINC000528248051 387877392 /nfs/dbraw/zinc/87/73/92/387877392.db2.gz GQHNTOXUOLKBAZ-VHSXEESVSA-N 1 2 239.319 2.150 20 0 BEADLO CC(C)[N@@H+](C)Cc1nc([C@H]2CC[C@H](C)O2)no1 ZINC000528248051 387877396 /nfs/dbraw/zinc/87/73/96/387877396.db2.gz GQHNTOXUOLKBAZ-VHSXEESVSA-N 1 2 239.319 2.150 20 0 BEADLO CC(C)n1cncc1C[NH2+][C@H](C)c1ccn(C)n1 ZINC000424177106 387887345 /nfs/dbraw/zinc/88/73/45/387887345.db2.gz UCDDPDBMVHQDFQ-LLVKDONJSA-N 1 2 247.346 2.048 20 0 BEADLO Cc1nc(NCCCC(C)(C)C)nc(N)[nH+]1 ZINC000313357547 387888263 /nfs/dbraw/zinc/88/82/63/387888263.db2.gz PLXMRQFTKUZRMV-UHFFFAOYSA-N 1 2 223.324 2.000 20 0 BEADLO Cc1nc(N)nc(NCCCC(C)(C)C)[nH+]1 ZINC000313357547 387888266 /nfs/dbraw/zinc/88/82/66/387888266.db2.gz PLXMRQFTKUZRMV-UHFFFAOYSA-N 1 2 223.324 2.000 20 0 BEADLO Cc1ccc(F)c(CN(C)Cc2c[nH+]cn2C)c1 ZINC000444742565 387919245 /nfs/dbraw/zinc/91/92/45/387919245.db2.gz JHCKCCNMQPSYMB-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1cccn2cc(CSc3nc[nH]n3)[nH+]c12 ZINC000006371262 322812384 /nfs/dbraw/zinc/81/23/84/322812384.db2.gz XFLPJMRUUPOJSX-UHFFFAOYSA-N 1 2 245.311 2.053 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)C(C)(C)C1CCC1 ZINC000448711387 387910329 /nfs/dbraw/zinc/91/03/29/387910329.db2.gz XYTBMVJTOXSZOJ-NSHDSACASA-N 1 2 249.358 2.214 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1CCOCC1(C)C ZINC000528361007 387911006 /nfs/dbraw/zinc/91/10/06/387911006.db2.gz XAQPPVKFWYDJFC-WTKPLQERSA-N 1 2 203.713 2.240 20 0 BEADLO C/C(Cl)=C/C[N@H+]1CCOCC1(C)C ZINC000528361007 387911010 /nfs/dbraw/zinc/91/10/10/387911010.db2.gz XAQPPVKFWYDJFC-WTKPLQERSA-N 1 2 203.713 2.240 20 0 BEADLO Cc1ccc(C[N@@H+]2CCc3ncsc3C2)nc1 ZINC000438353327 387929545 /nfs/dbraw/zinc/92/95/45/387929545.db2.gz NAIRGFPOBGAVFF-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ccc(C[N@H+]2CCc3ncsc3C2)nc1 ZINC000438353327 387929546 /nfs/dbraw/zinc/92/95/46/387929546.db2.gz NAIRGFPOBGAVFF-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1csc(C[N@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)n1 ZINC000438350096 387926567 /nfs/dbraw/zinc/92/65/67/387926567.db2.gz DIZQNGZWUFLTOY-AXFHLTTASA-N 1 2 240.372 2.449 20 0 BEADLO Cc1csc(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)n1 ZINC000438350096 387926573 /nfs/dbraw/zinc/92/65/73/387926573.db2.gz DIZQNGZWUFLTOY-AXFHLTTASA-N 1 2 240.372 2.449 20 0 BEADLO COC(=O)CC1CC(Nc2ccc[nH+]c2C)C1 ZINC000424285821 387953388 /nfs/dbraw/zinc/95/33/88/387953388.db2.gz VAYGXZKDIZLDRH-UHFFFAOYSA-N 1 2 234.299 2.144 20 0 BEADLO COC[C@@]1(C)CCN(c2cc[nH+]c(C(C)C)n2)C1 ZINC000450604725 387939812 /nfs/dbraw/zinc/93/98/12/387939812.db2.gz LZHINMJGARDPCZ-AWEZNQCLSA-N 1 2 249.358 2.463 20 0 BEADLO c1cn(Cc2c[nH+]cn2Cc2ccccc2)cn1 ZINC000445601073 387951719 /nfs/dbraw/zinc/95/17/19/387951719.db2.gz PRJQFFXVURUZCU-UHFFFAOYSA-N 1 2 238.294 2.176 20 0 BEADLO CCc1nnc(C[NH2+]Cc2ccc(F)c(C)c2)[nH]1 ZINC000392355279 387957974 /nfs/dbraw/zinc/95/79/74/387957974.db2.gz MDPFIFOUUHKRNE-UHFFFAOYSA-N 1 2 248.305 2.104 20 0 BEADLO Cc1ccc(F)c(C[NH2+][C@H](C)c2nncn2C)c1 ZINC000227286626 387958334 /nfs/dbraw/zinc/95/83/34/387958334.db2.gz KEPVMMPTNIQPMM-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO CC(C)c1nc(N(C)[C@H]2CC[C@H](O)CC2)cc[nH+]1 ZINC000438894880 387962738 /nfs/dbraw/zinc/96/27/38/387962738.db2.gz OMVLYBKHPJBPFX-HAQNSBGRSA-N 1 2 249.358 2.340 20 0 BEADLO Cc1cccc(C[N@@H+]2CCc3ncsc3C2)n1 ZINC000446080524 387997339 /nfs/dbraw/zinc/99/73/39/387997339.db2.gz MRNYHDOXSVVXCK-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cccc(C[N@H+]2CCc3ncsc3C2)n1 ZINC000446080524 387997343 /nfs/dbraw/zinc/99/73/43/387997343.db2.gz MRNYHDOXSVVXCK-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cc(C(=O)NCc2[nH+]ccn2C)sc1C ZINC000264368310 177796789 /nfs/dbraw/zinc/79/67/89/177796789.db2.gz ZZLRWAASFGFRRF-UHFFFAOYSA-N 1 2 249.339 2.028 20 0 BEADLO CC[C@H]([NH2+][C@H](C)c1cn[nH]c1)C(F)F ZINC000453227771 388016119 /nfs/dbraw/zinc/01/61/19/388016119.db2.gz BGDIRMPTCSRWNE-SVRRBLITSA-N 1 2 203.236 2.104 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)C2CC3(CC3)C2)[nH+]1 ZINC001645476150 1172670836 /nfs/dbraw/zinc/67/08/36/1172670836.db2.gz DSRBQBYZAAOQML-UHFFFAOYSA-N 1 2 247.342 2.340 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)C2CC3(CC3)C2)c[nH+]1 ZINC001645476150 1172670840 /nfs/dbraw/zinc/67/08/40/1172670840.db2.gz DSRBQBYZAAOQML-UHFFFAOYSA-N 1 2 247.342 2.340 20 0 BEADLO CSCCN(C)c1[nH+]c(C)nc2[nH]ccc21 ZINC000446841713 388042779 /nfs/dbraw/zinc/04/27/79/388042779.db2.gz ATXCFZIYTKWPBS-UHFFFAOYSA-N 1 2 236.344 2.066 20 0 BEADLO Cc1nc(C(C)(C)[NH2+]CC2=CCCC2)no1 ZINC000645827180 388030701 /nfs/dbraw/zinc/03/07/01/388030701.db2.gz GDXLGEGGSNZJCO-UHFFFAOYSA-N 1 2 221.304 2.313 20 0 BEADLO CC(C)c1nc(N2CCC[C@@H]([C@H](C)O)C2)cc[nH+]1 ZINC000533330389 388051747 /nfs/dbraw/zinc/05/17/47/388051747.db2.gz PKVROEUTVWEYKJ-NWDGAFQWSA-N 1 2 249.358 2.197 20 0 BEADLO CCOC(=O)[C@H]1CCCC[N@@H+]1C[C@@H](F)CC ZINC000440704073 388070724 /nfs/dbraw/zinc/07/07/24/388070724.db2.gz UQZXRAMLKONVMG-WDEREUQCSA-N 1 2 231.311 2.152 20 0 BEADLO CCOC(=O)[C@H]1CCCC[N@H+]1C[C@@H](F)CC ZINC000440704073 388070729 /nfs/dbraw/zinc/07/07/29/388070729.db2.gz UQZXRAMLKONVMG-WDEREUQCSA-N 1 2 231.311 2.152 20 0 BEADLO C=Cn1cc(CNc2cc[nH+]cc2F)cn1 ZINC000195010967 388083020 /nfs/dbraw/zinc/08/30/20/388083020.db2.gz VVNXUMYHVDNQFT-UHFFFAOYSA-N 1 2 218.235 2.130 20 0 BEADLO Cn1c[nH+]cc1CNc1ccc(F)c(F)c1 ZINC000085167692 388084310 /nfs/dbraw/zinc/08/43/10/388084310.db2.gz ADAMTEVWTSAGFZ-UHFFFAOYSA-N 1 2 223.226 2.310 20 0 BEADLO CCC1C[NH+](Cc2ncc(COC)s2)C1 ZINC000453607268 388090926 /nfs/dbraw/zinc/09/09/26/388090926.db2.gz RVRCAVFFMSZOFI-UHFFFAOYSA-N 1 2 226.345 2.131 20 0 BEADLO CC[C@H]([NH2+]Cc1cc2ccccc2[nH]1)C(=O)OC ZINC000447796760 388092581 /nfs/dbraw/zinc/09/25/81/388092581.db2.gz YPNSKAVWEQSAJU-LBPRGKRZSA-N 1 2 246.310 2.209 20 0 BEADLO C[C@H]1CCCC[C@@H]1C(=O)NCCCn1cc[nH+]c1 ZINC000424532693 388098076 /nfs/dbraw/zinc/09/80/76/388098076.db2.gz XOPSZRZEQWLPCS-STQMWFEESA-N 1 2 249.358 2.216 20 0 BEADLO Cn1c[nH+]c2cc(Nc3ncc(F)cn3)ccc21 ZINC000446984584 388045889 /nfs/dbraw/zinc/04/58/89/388045889.db2.gz JQCWYKRZZSMBHZ-UHFFFAOYSA-N 1 2 243.245 2.246 20 0 BEADLO CCc1nocc1C[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000646153346 388157444 /nfs/dbraw/zinc/15/74/44/388157444.db2.gz IRMSVPCHYQJJIP-MWLCHTKSSA-N 1 2 226.295 2.417 20 0 BEADLO CCc1nocc1C[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000646153346 388157446 /nfs/dbraw/zinc/15/74/46/388157446.db2.gz IRMSVPCHYQJJIP-MWLCHTKSSA-N 1 2 226.295 2.417 20 0 BEADLO Cn1cc(C[NH2+]C(CF)CF)c(C(C)(C)C)n1 ZINC000449378429 388187683 /nfs/dbraw/zinc/18/76/83/388187683.db2.gz DSOJKXZYIHGMRO-UHFFFAOYSA-N 1 2 245.317 2.115 20 0 BEADLO C[C@@H](c1cnn(C)c1)[N@H+](C)Cc1ccncc1F ZINC000449252720 388162309 /nfs/dbraw/zinc/16/23/09/388162309.db2.gz RQRNULBFGYVUBV-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO C[C@@H](c1cnn(C)c1)[N@@H+](C)Cc1ccncc1F ZINC000449252720 388162310 /nfs/dbraw/zinc/16/23/10/388162310.db2.gz RQRNULBFGYVUBV-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO Cc1cc(C)c(CNC(=O)N(C)CC2CC2)c[nH+]1 ZINC000455558120 388163472 /nfs/dbraw/zinc/16/34/72/388163472.db2.gz MLBCQPAZYSGKDD-UHFFFAOYSA-N 1 2 247.342 2.250 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccnn2C)cs1 ZINC000449294878 388168680 /nfs/dbraw/zinc/16/86/80/388168680.db2.gz NWIGMNVEXQLPGR-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccnn2C)cs1 ZINC000449294878 388168682 /nfs/dbraw/zinc/16/86/82/388168682.db2.gz NWIGMNVEXQLPGR-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO C[C@H]1C[N@H+](Cc2cc3ccccc3[nH]2)CCO1 ZINC000646256330 388171017 /nfs/dbraw/zinc/17/10/17/388171017.db2.gz OFLXCZCVFNOLAZ-NSHDSACASA-N 1 2 230.311 2.389 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cc3ccccc3[nH]2)CCO1 ZINC000646256330 388171018 /nfs/dbraw/zinc/17/10/18/388171018.db2.gz OFLXCZCVFNOLAZ-NSHDSACASA-N 1 2 230.311 2.389 20 0 BEADLO Clc1ccc(C[N@H+](C2CC2)C2COC2)o1 ZINC000449349756 388178416 /nfs/dbraw/zinc/17/84/16/388178416.db2.gz HCCWAEVONPQHBU-UHFFFAOYSA-N 1 2 227.691 2.296 20 0 BEADLO Clc1ccc(C[N@@H+](C2CC2)C2COC2)o1 ZINC000449349756 388178418 /nfs/dbraw/zinc/17/84/18/388178418.db2.gz HCCWAEVONPQHBU-UHFFFAOYSA-N 1 2 227.691 2.296 20 0 BEADLO Cc1c[nH+]c(CN2CCC[C@@](C)(F)C2)n1C ZINC000449348504 388179031 /nfs/dbraw/zinc/17/90/31/388179031.db2.gz GWSWMMUWDHXZEM-GFCCVEGCSA-N 1 2 225.311 2.053 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccncc1)C(F)F ZINC000449358117 388181285 /nfs/dbraw/zinc/18/12/85/388181285.db2.gz DWFQTZQSHQTSSM-SECBINFHSA-N 1 2 200.232 2.215 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccn(C)c1)C(F)F ZINC000449360974 388181302 /nfs/dbraw/zinc/18/13/02/388181302.db2.gz KDKOXNKAQZFHSP-SECBINFHSA-N 1 2 202.248 2.158 20 0 BEADLO CC(C)c1nc(NCC2CC(F)(F)C2)cc[nH+]1 ZINC000488478341 388182063 /nfs/dbraw/zinc/18/20/63/388182063.db2.gz LEJSWZLSBLQFSN-UHFFFAOYSA-N 1 2 241.285 2.479 20 0 BEADLO CC[C@H](NCc1cn2ccccc2[nH+]1)C(F)F ZINC000449364180 388182544 /nfs/dbraw/zinc/18/25/44/388182544.db2.gz RHFCGGVQOKQPHM-JTQLQIEISA-N 1 2 239.269 2.468 20 0 BEADLO Cc1cc(NC(=O)C[C@@H]2CC[C@@H]3C[C@@H]32)cc[nH+]1 ZINC000448962694 388123497 /nfs/dbraw/zinc/12/34/97/388123497.db2.gz SGEFDWAZSGZWGE-MDZLAQPJSA-N 1 2 230.311 2.187 20 0 BEADLO CCn1nnc(C)c1C[N@H+](C)[C@@H](C)c1ccco1 ZINC000449010453 388128708 /nfs/dbraw/zinc/12/87/08/388128708.db2.gz LFDMNTMFIHALPL-NSHDSACASA-N 1 2 248.330 2.392 20 0 BEADLO CCn1nnc(C)c1C[N@@H+](C)[C@@H](C)c1ccco1 ZINC000449010453 388128711 /nfs/dbraw/zinc/12/87/11/388128711.db2.gz LFDMNTMFIHALPL-NSHDSACASA-N 1 2 248.330 2.392 20 0 BEADLO COc1cc(F)cc(C[N@H+](C)Cc2cc[nH]n2)c1 ZINC000449027310 388131225 /nfs/dbraw/zinc/13/12/25/388131225.db2.gz LRSJIIVMQLZKMI-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO COc1cc(F)cc(C[N@@H+](C)Cc2cc[nH]n2)c1 ZINC000449027310 388131226 /nfs/dbraw/zinc/13/12/26/388131226.db2.gz LRSJIIVMQLZKMI-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2cc[nH]n2)c1F ZINC000449024822 388131644 /nfs/dbraw/zinc/13/16/44/388131644.db2.gz FCRXMHKGSXLFFK-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2cc[nH]n2)c1F ZINC000449024822 388131648 /nfs/dbraw/zinc/13/16/48/388131648.db2.gz FCRXMHKGSXLFFK-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO COc1cc(C)ccc1C[N@@H+]1CCN(C)C[C@H]1C ZINC000449034800 388132846 /nfs/dbraw/zinc/13/28/46/388132846.db2.gz KZMQNWUEGNOYSR-CYBMUJFWSA-N 1 2 248.370 2.140 20 0 BEADLO COc1cc(C)ccc1C[N@H+]1CCN(C)C[C@H]1C ZINC000449034800 388132848 /nfs/dbraw/zinc/13/28/48/388132848.db2.gz KZMQNWUEGNOYSR-CYBMUJFWSA-N 1 2 248.370 2.140 20 0 BEADLO CC[C@H]1CC[C@@H]1[NH2+][C@@H](C)C(=O)OC(C)C ZINC000449658387 388249772 /nfs/dbraw/zinc/24/97/72/388249772.db2.gz AUAUHBKNBQAZPC-DCAQKATOSA-N 1 2 213.321 2.105 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@H]2c2cccnc2)n[nH]1 ZINC000065288496 388255635 /nfs/dbraw/zinc/25/56/35/388255635.db2.gz MBFWEDYPTWGKCU-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@H]2c2cccnc2)n[nH]1 ZINC000065288496 388255637 /nfs/dbraw/zinc/25/56/37/388255637.db2.gz MBFWEDYPTWGKCU-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO C[C@@H]([NH2+]C(CF)CF)c1ccccn1 ZINC000449380458 388188964 /nfs/dbraw/zinc/18/89/64/388188964.db2.gz NDTNWDMLLXHJKC-MRVPVSSYSA-N 1 2 200.232 2.040 20 0 BEADLO FCC(CF)[NH2+]Cc1ccc(-c2cc[nH]n2)o1 ZINC000449382783 388190004 /nfs/dbraw/zinc/19/00/04/388190004.db2.gz YPQPHZQTYWGDLK-UHFFFAOYSA-N 1 2 241.241 2.067 20 0 BEADLO Cc1cc(N2CC[C@H](O)C[C@@H]2C)nc(C(C)C)[nH+]1 ZINC000488748951 388193851 /nfs/dbraw/zinc/19/38/51/388193851.db2.gz QMQGGFAQVYOIEE-RYUDHWBXSA-N 1 2 249.358 2.258 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)[C@H]1CC1(C)C ZINC000456361225 388196414 /nfs/dbraw/zinc/19/64/14/388196414.db2.gz RWDLRXHRUSXPLX-NXEZZACHSA-N 1 2 235.331 2.126 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)c1ccccc1 ZINC000456356782 388196475 /nfs/dbraw/zinc/19/64/75/388196475.db2.gz RYQWMZKTGIITAX-LLVKDONJSA-N 1 2 243.310 2.394 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)CCC1CC1 ZINC000456348782 388197056 /nfs/dbraw/zinc/19/70/56/388197056.db2.gz ILJAWTMQMBWCHH-JTQLQIEISA-N 1 2 235.331 2.270 20 0 BEADLO CCC[C@H](C)C(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456371497 388197827 /nfs/dbraw/zinc/19/78/27/388197827.db2.gz IKCDYLXBYCEMIB-AXFHLTTASA-N 1 2 235.331 2.441 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)c1c[nH]cc1C ZINC000456393875 388199491 /nfs/dbraw/zinc/19/94/91/388199491.db2.gz QXNKKCRCZDQKMH-SNVBAGLBSA-N 1 2 246.314 2.031 20 0 BEADLO CC[C@H](C)C(=O)N[C@@H](C)c1[nH+]ccn1CC ZINC000456404014 388199525 /nfs/dbraw/zinc/19/95/25/388199525.db2.gz WYOXHLWCOPASFL-UWVGGRQHSA-N 1 2 223.320 2.126 20 0 BEADLO CC[N@H+](Cc1ccc(F)c(F)c1)C1COC1 ZINC000449430439 388203382 /nfs/dbraw/zinc/20/33/82/388203382.db2.gz ZTLRDQBJHIPLLG-UHFFFAOYSA-N 1 2 227.254 2.186 20 0 BEADLO CC[N@@H+](Cc1ccc(F)c(F)c1)C1COC1 ZINC000449430439 388203384 /nfs/dbraw/zinc/20/33/84/388203384.db2.gz ZTLRDQBJHIPLLG-UHFFFAOYSA-N 1 2 227.254 2.186 20 0 BEADLO CCc1ccc(C[N@@H+](CC)C2COC2)o1 ZINC000449430365 388203591 /nfs/dbraw/zinc/20/35/91/388203591.db2.gz YZPGJSLADOFJER-UHFFFAOYSA-N 1 2 209.289 2.063 20 0 BEADLO CCc1ccc(C[N@H+](CC)C2COC2)o1 ZINC000449430365 388203594 /nfs/dbraw/zinc/20/35/94/388203594.db2.gz YZPGJSLADOFJER-UHFFFAOYSA-N 1 2 209.289 2.063 20 0 BEADLO Cn1c(C[N@H+](C)[C@@H]2CC2(C)C)nnc1C1CCC1 ZINC000489438842 388213497 /nfs/dbraw/zinc/21/34/97/388213497.db2.gz OSGJINGQTOTCTF-LLVKDONJSA-N 1 2 248.374 2.313 20 0 BEADLO Cn1c(C[N@@H+](C)[C@@H]2CC2(C)C)nnc1C1CCC1 ZINC000489438842 388213499 /nfs/dbraw/zinc/21/34/99/388213499.db2.gz OSGJINGQTOTCTF-LLVKDONJSA-N 1 2 248.374 2.313 20 0 BEADLO CC[C@H](NC(=O)CCc1[nH]cc[nH+]1)C1CCCC1 ZINC000456665163 388214278 /nfs/dbraw/zinc/21/42/78/388214278.db2.gz RUMFODGJFQMHLE-LBPRGKRZSA-N 1 2 249.358 2.427 20 0 BEADLO c1snnc1C[N@@H+]1C[C@H](C2CC2)[C@@H]1C1CC1 ZINC000449531368 388224821 /nfs/dbraw/zinc/22/48/21/388224821.db2.gz BPILDQAWKDHBNU-NEPJUHHUSA-N 1 2 235.356 2.159 20 0 BEADLO c1snnc1C[N@H+]1C[C@H](C2CC2)[C@@H]1C1CC1 ZINC000449531368 388224824 /nfs/dbraw/zinc/22/48/24/388224824.db2.gz BPILDQAWKDHBNU-NEPJUHHUSA-N 1 2 235.356 2.159 20 0 BEADLO CS[C@H](C)C(=O)NCc1c[nH+]c(C)cc1C ZINC000456838632 388226382 /nfs/dbraw/zinc/22/63/82/388226382.db2.gz CGJUMJJROYZSKS-SNVBAGLBSA-N 1 2 238.356 2.066 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2CC[C@@H]3C[C@@H]3C2)cc[nH+]1 ZINC000646328566 388233080 /nfs/dbraw/zinc/23/30/80/388233080.db2.gz MLONNAGUDOFJEF-IJLUTSLNSA-N 1 2 245.326 2.122 20 0 BEADLO COC1(C)C[NH+](C/C=C\c2ccccc2)C1 ZINC000459576515 388246623 /nfs/dbraw/zinc/24/66/23/388246623.db2.gz GIPWMKVGAMEZHM-TWGQIWQCSA-N 1 2 217.312 2.421 20 0 BEADLO C/C=C/C=C\C(=O)Nc1c[nH+]ccc1OC ZINC000491382802 388290365 /nfs/dbraw/zinc/29/03/65/388290365.db2.gz JMRHAKUYNHPOOA-ICWBMWKASA-N 1 2 218.256 2.161 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1ccn(C(F)F)n1 ZINC000491420914 388293112 /nfs/dbraw/zinc/29/31/12/388293112.db2.gz XYZFTZYOFSKWNW-UHFFFAOYSA-N 1 2 241.241 2.469 20 0 BEADLO C[C@H](O)C[N@H+](CCCCCF)CC(F)F ZINC000451831201 388299115 /nfs/dbraw/zinc/29/91/15/388299115.db2.gz KDWNPDKJNWOLRL-VIFPVBQESA-N 1 2 227.270 2.074 20 0 BEADLO C[C@H](O)C[N@@H+](CCCCCF)CC(F)F ZINC000451831201 388299117 /nfs/dbraw/zinc/29/91/17/388299117.db2.gz KDWNPDKJNWOLRL-VIFPVBQESA-N 1 2 227.270 2.074 20 0 BEADLO CC(C)SCC[N@@H+](CC(F)F)C[C@@H](C)O ZINC000451844834 388300243 /nfs/dbraw/zinc/30/02/43/388300243.db2.gz WKFVQAWFSNDBFQ-SECBINFHSA-N 1 2 241.347 2.076 20 0 BEADLO CC(C)SCC[N@H+](CC(F)F)C[C@@H](C)O ZINC000451844834 388300245 /nfs/dbraw/zinc/30/02/45/388300245.db2.gz WKFVQAWFSNDBFQ-SECBINFHSA-N 1 2 241.347 2.076 20 0 BEADLO O=C(/C=C\C1CC1)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000491910519 388327423 /nfs/dbraw/zinc/32/74/23/388327423.db2.gz BNIIUCUFMJWACG-ARJAWSKDSA-N 1 2 245.326 2.082 20 0 BEADLO O=C(/C=C\C1CC1)Nc1cccc2[nH+]ccn21 ZINC000491943871 388328786 /nfs/dbraw/zinc/32/87/86/388328786.db2.gz YFQZWDIADWRSJR-SREVYHEPSA-N 1 2 227.267 2.239 20 0 BEADLO COc1cc[nH+]cc1NC(=O)/C=C\c1ccc[nH]1 ZINC000491952741 388329284 /nfs/dbraw/zinc/32/92/84/388329284.db2.gz IFIDAVFUPHIYSK-PLNGDYQASA-N 1 2 243.266 2.070 20 0 BEADLO CC[C@H](NC(=O)/C=C\c1ccc[nH]1)c1[nH]cc[nH+]1 ZINC000491965183 388329797 /nfs/dbraw/zinc/32/97/97/388329797.db2.gz PNJAPXAQHWPTAG-GZTOBOFZSA-N 1 2 244.298 2.019 20 0 BEADLO COc1cc(C[N@H+](C)Cc2ccccn2)ccn1 ZINC000451366631 388266142 /nfs/dbraw/zinc/26/61/42/388266142.db2.gz JISVKYIGMAYQMP-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2ccccn2)ccn1 ZINC000451366631 388266143 /nfs/dbraw/zinc/26/61/43/388266143.db2.gz JISVKYIGMAYQMP-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO CC(C)c1noc(C[NH+]2CCC(CF)CC2)n1 ZINC000451380402 388267755 /nfs/dbraw/zinc/26/77/55/388267755.db2.gz BVZRGDKNXUGQNS-UHFFFAOYSA-N 1 2 241.310 2.375 20 0 BEADLO C/C=C(/C=C\C(=O)N(C)Cc1[nH+]ccn1C)CC ZINC000492301329 388340925 /nfs/dbraw/zinc/34/09/25/388340925.db2.gz LZAPKVAALHHYAP-KRMQVSRUSA-N 1 2 247.342 2.291 20 0 BEADLO CCCN(C(=O)/C=C/c1[nH+]ccn1CC)C1CC1 ZINC000492329675 388341712 /nfs/dbraw/zinc/34/17/12/388341712.db2.gz LLHROYWGDLXEOQ-BQYQJAHWSA-N 1 2 247.342 2.317 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N(C)CC1CCC1 ZINC000492413295 388343803 /nfs/dbraw/zinc/34/38/03/388343803.db2.gz XEXCNOYYTUJEBV-FPLPWBNLSA-N 1 2 247.342 2.175 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2ncn(C)n2)c(C)c1 ZINC000275829583 388346068 /nfs/dbraw/zinc/34/60/68/388346068.db2.gz OAPOBPLQGRGFNW-LBPRGKRZSA-N 1 2 244.342 2.283 20 0 BEADLO CC(C)(C)C[C@@H]1C[C@H]1C(=O)NCc1[nH]cc[nH+]1 ZINC000648780171 388347422 /nfs/dbraw/zinc/34/74/22/388347422.db2.gz WNHNDKMSLBKGKZ-VHSXEESVSA-N 1 2 235.331 2.098 20 0 BEADLO COc1cccc(C[N@@H+]2CC[C@@H](F)C2)c1F ZINC000648721604 388354715 /nfs/dbraw/zinc/35/47/15/388354715.db2.gz GPHLYKRAAXTSJZ-SNVBAGLBSA-N 1 2 227.254 2.378 20 0 BEADLO COc1cccc(C[N@H+]2CC[C@@H](F)C2)c1F ZINC000648721604 388354716 /nfs/dbraw/zinc/35/47/16/388354716.db2.gz GPHLYKRAAXTSJZ-SNVBAGLBSA-N 1 2 227.254 2.378 20 0 BEADLO Cc1nc(F)ccc1C[NH2+]Cc1nccs1 ZINC000278393426 388354746 /nfs/dbraw/zinc/35/47/46/388354746.db2.gz MSJNOGBDQPDOBZ-UHFFFAOYSA-N 1 2 237.303 2.275 20 0 BEADLO C[C@@H]1C[C@H]([NH2+]Cc2ncn(C)n2)c2ccccc21 ZINC000290234468 388366417 /nfs/dbraw/zinc/36/64/17/388366417.db2.gz IWASJAPDIFSPQX-MFKMUULPSA-N 1 2 242.326 2.153 20 0 BEADLO Cc1nc(N[C@H](C)c2cnn(C(C)C)c2)cc[nH+]1 ZINC000524686566 388374552 /nfs/dbraw/zinc/37/45/52/388374552.db2.gz WPLFXLBUORWDSK-SNVBAGLBSA-N 1 2 245.330 2.157 20 0 BEADLO Cc1ncc(C[NH2+][C@@H]2COCc3ccccc32)o1 ZINC000397955519 388376302 /nfs/dbraw/zinc/37/63/02/388376302.db2.gz RGJGPUUMAIJFBS-CQSZACIVSA-N 1 2 244.294 2.344 20 0 BEADLO c1c[nH+]c(COCc2nc(C3CC3)cs2)[nH]1 ZINC000519662551 256655939 /nfs/dbraw/zinc/65/59/39/256655939.db2.gz KBQDEQHQTMIUAR-UHFFFAOYSA-N 1 2 235.312 2.460 20 0 BEADLO CC[C@H]([NH3+])C(=O)N[C@H](C)[C@H](C)C1CCCCC1 ZINC000236938950 388386569 /nfs/dbraw/zinc/38/65/69/388386569.db2.gz YHAVTHQEUWUYHC-LOWVWBTDSA-N 1 2 240.391 2.445 20 0 BEADLO C[C@@H]1CCCC[C@@H]1NC(=O)C[NH+]1CC(C)(C)C1 ZINC000646574855 388386675 /nfs/dbraw/zinc/38/66/75/388386675.db2.gz GJQLXPLXXVJBDQ-NEPJUHHUSA-N 1 2 238.375 2.023 20 0 BEADLO Cc1cccc([C@@H](C)[N@@H+]2CCn3nncc3C2)c1 ZINC000572972220 388401721 /nfs/dbraw/zinc/40/17/21/388401721.db2.gz RWGOETORGCMOPQ-GFCCVEGCSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1cccc([C@@H](C)[N@H+]2CCn3nncc3C2)c1 ZINC000572972220 388401722 /nfs/dbraw/zinc/40/17/22/388401722.db2.gz RWGOETORGCMOPQ-GFCCVEGCSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)/C=C/C1CCCCC1 ZINC000492111494 388335352 /nfs/dbraw/zinc/33/53/52/388335352.db2.gz RHIUDIHDEOJJRU-BQYQJAHWSA-N 1 2 247.342 2.471 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)NC1CCCCC1 ZINC000492277515 388340122 /nfs/dbraw/zinc/34/01/22/388340122.db2.gz ODINFJOTYQMNKH-HJWRWDBZSA-N 1 2 247.342 2.365 20 0 BEADLO O=C(NCCCCn1cc[nH+]c1)C1CCCCC1 ZINC000041533547 388457832 /nfs/dbraw/zinc/45/78/32/388457832.db2.gz UROUVNPWMIVNCU-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO C[C@H]1CCCN(C(=O)c2ccc3[nH+]ccn3c2)C1 ZINC000068368568 388459543 /nfs/dbraw/zinc/45/95/43/388459543.db2.gz ADPPDYBVJTWMPG-NSHDSACASA-N 1 2 243.310 2.206 20 0 BEADLO CC[C@@H](C)[NH+]=c1[nH]c2c(cccc2F)n1C ZINC000336723170 388468851 /nfs/dbraw/zinc/46/88/51/388468851.db2.gz DXFFLWDPTNLAMG-MRVPVSSYSA-N 1 2 221.279 2.345 20 0 BEADLO CCCCNc1cc(NC2CC2)nc[nH+]1 ZINC000242954278 388475862 /nfs/dbraw/zinc/47/58/62/388475862.db2.gz HGTQSFHYMZCTLY-UHFFFAOYSA-N 1 2 206.293 2.263 20 0 BEADLO CCCCNc1cc(NC2CC2)[nH+]cn1 ZINC000242954278 388475864 /nfs/dbraw/zinc/47/58/64/388475864.db2.gz HGTQSFHYMZCTLY-UHFFFAOYSA-N 1 2 206.293 2.263 20 0 BEADLO Cc1cnc(C)c(NCCc2[nH+]cccc2C)n1 ZINC000295654178 388413268 /nfs/dbraw/zinc/41/32/68/388413268.db2.gz DGNXIOGSMFFCPZ-UHFFFAOYSA-N 1 2 242.326 2.451 20 0 BEADLO C[N@H+](CCCCO)Cc1csc(Cl)n1 ZINC000295861302 388414147 /nfs/dbraw/zinc/41/41/47/388414147.db2.gz BZKVGAIDBIUYDH-UHFFFAOYSA-N 1 2 234.752 2.001 20 0 BEADLO C[N@@H+](CCCCO)Cc1csc(Cl)n1 ZINC000295861302 388414149 /nfs/dbraw/zinc/41/41/49/388414149.db2.gz BZKVGAIDBIUYDH-UHFFFAOYSA-N 1 2 234.752 2.001 20 0 BEADLO CC[C@@H](CC(C)C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000308087578 388431524 /nfs/dbraw/zinc/43/15/24/388431524.db2.gz LGZBYFFXHYAQKA-NSHDSACASA-N 1 2 237.347 2.440 20 0 BEADLO CCC[C@H](CC(C)C)C(=O)NCc1c[nH+]c[nH]1 ZINC000308092093 388431742 /nfs/dbraw/zinc/43/17/42/388431742.db2.gz SWJZIJRKGBRSAW-LLVKDONJSA-N 1 2 237.347 2.488 20 0 BEADLO CCC[C@H](CC(C)C)C(=O)NCc1c[nH]c[nH+]1 ZINC000308092093 388431744 /nfs/dbraw/zinc/43/17/44/388431744.db2.gz SWJZIJRKGBRSAW-LLVKDONJSA-N 1 2 237.347 2.488 20 0 BEADLO C[C@@H]1CN(c2[nH+]ccc3ccccc32)CC[C@@H]1O ZINC000167116305 388438713 /nfs/dbraw/zinc/43/87/13/388438713.db2.gz AICDUZRHWPLHLW-RISCZKNCSA-N 1 2 242.322 2.442 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1CC[S@@](=O)C(C)(C)CC1 ZINC000528520205 388541177 /nfs/dbraw/zinc/54/11/77/388541177.db2.gz PKTGNRHAMNONKB-OZVSCIAHSA-N 1 2 249.807 2.362 20 0 BEADLO C/C(Cl)=C/C[N@H+]1CC[S@@](=O)C(C)(C)CC1 ZINC000528520205 388541179 /nfs/dbraw/zinc/54/11/79/388541179.db2.gz PKTGNRHAMNONKB-OZVSCIAHSA-N 1 2 249.807 2.362 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2ncccc2Cl)C1 ZINC000528518024 388541388 /nfs/dbraw/zinc/54/13/88/388541388.db2.gz QSBWLVJOFTXYNS-MRVPVSSYSA-N 1 2 214.671 2.279 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2ncccc2Cl)C1 ZINC000528518024 388541390 /nfs/dbraw/zinc/54/13/90/388541390.db2.gz QSBWLVJOFTXYNS-MRVPVSSYSA-N 1 2 214.671 2.279 20 0 BEADLO Cc1cc(NC(=O)c2conc2C(C)C)cc[nH+]1 ZINC000528533337 388543264 /nfs/dbraw/zinc/54/32/64/388543264.db2.gz JFTAJBBNQOWIDD-UHFFFAOYSA-N 1 2 245.282 2.176 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CCCC23CC3)cc[nH+]1 ZINC000528532957 388543709 /nfs/dbraw/zinc/54/37/09/388543709.db2.gz DGIYAFLMHCNONK-LBPRGKRZSA-N 1 2 230.311 2.331 20 0 BEADLO C[C@]1(CNc2ccc3ccccc3[nH+]2)CCOC1 ZINC000354092661 388544215 /nfs/dbraw/zinc/54/42/15/388544215.db2.gz OTUFFHQFYFLAMX-OAHLLOKOSA-N 1 2 242.322 2.495 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NC(C)(C)c2[nH]cc[nH+]2)C1 ZINC000517380659 388548854 /nfs/dbraw/zinc/54/88/54/388548854.db2.gz DBADIYLQVLAMGR-NXEZZACHSA-N 1 2 235.331 2.197 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C(C)(C)C(C)(F)F ZINC000405938257 388496410 /nfs/dbraw/zinc/49/64/10/388496410.db2.gz JYFMXHYDFNSTEI-UHFFFAOYSA-N 1 2 245.273 2.016 20 0 BEADLO Cc1cc(NCC2=CCOCC2)nc(C(C)C)[nH+]1 ZINC000397747721 388496747 /nfs/dbraw/zinc/49/67/47/388496747.db2.gz NXLYIKFVJBBXKN-UHFFFAOYSA-N 1 2 247.342 2.089 20 0 BEADLO Cc1cc(NC(=O)N2[C@H](C)C[C@H]2C)c(C)c[nH+]1 ZINC000548090025 388509842 /nfs/dbraw/zinc/50/98/42/388509842.db2.gz LNGSHUUPZLBORA-GHMZBOCLSA-N 1 2 233.315 2.135 20 0 BEADLO CCCc1noc(C[NH+]2[C@@H](C)C[C@@H]2C)n1 ZINC000548096662 388511198 /nfs/dbraw/zinc/51/11/98/388511198.db2.gz FSOMZXCODRXPTB-IUCAKERBSA-N 1 2 209.293 2.005 20 0 BEADLO COC(=O)c1occc1C[NH+]1[C@@H](C)C[C@@H]1C ZINC000548097737 388511647 /nfs/dbraw/zinc/51/16/47/388511647.db2.gz RARQXENACFNQQG-IUCAKERBSA-N 1 2 223.272 2.049 20 0 BEADLO C[C@@H]1C[C@H]([NH2+]Cc2cncs2)c2nccn21 ZINC000345365605 388513573 /nfs/dbraw/zinc/51/35/73/388513573.db2.gz YRVAAGPDAUSEAJ-SCZZXKLOSA-N 1 2 234.328 2.135 20 0 BEADLO C[C@@H](O)[C@@H](C)SCc1cn2ccccc2[nH+]1 ZINC000079039983 388522114 /nfs/dbraw/zinc/52/21/14/388522114.db2.gz SPWLZJXOCODYPQ-NXEZZACHSA-N 1 2 236.340 2.337 20 0 BEADLO CC(C)[C@@H]([NH2+]Cc1ncccn1)c1cccnc1 ZINC000516878832 388522841 /nfs/dbraw/zinc/52/28/41/388522841.db2.gz XUALBVYYWUBHJZ-CQSZACIVSA-N 1 2 242.326 2.359 20 0 BEADLO CCC[C@]1(C)C(=O)NCC[N@H+]1C/C=C(/C)Cl ZINC000528477449 388533012 /nfs/dbraw/zinc/53/30/12/388533012.db2.gz WBSIMKCJXKGOTJ-DUWGPSABSA-N 1 2 244.766 2.120 20 0 BEADLO CCC[C@]1(C)C(=O)NCC[N@@H+]1C/C=C(/C)Cl ZINC000528477449 388533014 /nfs/dbraw/zinc/53/30/14/388533014.db2.gz WBSIMKCJXKGOTJ-DUWGPSABSA-N 1 2 244.766 2.120 20 0 BEADLO CC[C@@H]1C[N@H+](C/C=C(\C)Cl)C[C@H](C)[S@@]1=O ZINC000528506888 388536795 /nfs/dbraw/zinc/53/67/95/388536795.db2.gz MSRGTVWXETZQIH-BZWDZPHISA-N 1 2 249.807 2.360 20 0 BEADLO CC[C@@H]1C[N@@H+](C/C=C(\C)Cl)C[C@H](C)[S@@]1=O ZINC000528506888 388536798 /nfs/dbraw/zinc/53/67/98/388536798.db2.gz MSRGTVWXETZQIH-BZWDZPHISA-N 1 2 249.807 2.360 20 0 BEADLO C[N@H+](Cc1cccc(O)c1Cl)[C@H]1CCOC1 ZINC000328195095 388586102 /nfs/dbraw/zinc/58/61/02/388586102.db2.gz DUCXSOLOBXHAAQ-JTQLQIEISA-N 1 2 241.718 2.266 20 0 BEADLO C[N@@H+](Cc1cccc(O)c1Cl)[C@H]1CCOC1 ZINC000328195095 388586103 /nfs/dbraw/zinc/58/61/03/388586103.db2.gz DUCXSOLOBXHAAQ-JTQLQIEISA-N 1 2 241.718 2.266 20 0 BEADLO COc1c(C)c[nH+]c(CSC[C@H](C)O)c1C ZINC000298395039 388607282 /nfs/dbraw/zinc/60/72/82/388607282.db2.gz VNDUUBVLCYVJSC-VIFPVBQESA-N 1 2 241.356 2.321 20 0 BEADLO COc1c(C)c[nH+]c(CSC[C@@H](C)O)c1C ZINC000298395029 388607292 /nfs/dbraw/zinc/60/72/92/388607292.db2.gz VNDUUBVLCYVJSC-SECBINFHSA-N 1 2 241.356 2.321 20 0 BEADLO C[C@@H]1OCC[N@H+](Cc2nc3ccccc3o2)[C@H]1C ZINC000156082699 388609577 /nfs/dbraw/zinc/60/95/77/388609577.db2.gz DBIGTKLFXGIYRR-QWRGUYRKSA-N 1 2 246.310 2.437 20 0 BEADLO C[C@@H]1OCC[N@@H+](Cc2nc3ccccc3o2)[C@H]1C ZINC000156082699 388609580 /nfs/dbraw/zinc/60/95/80/388609580.db2.gz DBIGTKLFXGIYRR-QWRGUYRKSA-N 1 2 246.310 2.437 20 0 BEADLO O[C@H](CC1CCCC1)C[N@@H+]1Cc2cccnc2C1 ZINC000550653401 388612086 /nfs/dbraw/zinc/61/20/86/388612086.db2.gz BOFFYTLYLJMFHI-CQSZACIVSA-N 1 2 246.354 2.338 20 0 BEADLO O[C@H](CC1CCCC1)C[N@H+]1Cc2cccnc2C1 ZINC000550653401 388612087 /nfs/dbraw/zinc/61/20/87/388612087.db2.gz BOFFYTLYLJMFHI-CQSZACIVSA-N 1 2 246.354 2.338 20 0 BEADLO CC[C@@H](C)CN(C)C(=O)/C=C/c1[nH+]ccn1CC ZINC000137027173 388555255 /nfs/dbraw/zinc/55/52/55/388555255.db2.gz UBBPRQRLVNKIQJ-ABZNLYFFSA-N 1 2 249.358 2.421 20 0 BEADLO COC(=O)[C@@](C)([NH2+]Cc1ccc(C)cc1)C1CC1 ZINC000517707379 388557409 /nfs/dbraw/zinc/55/74/09/388557409.db2.gz GYLDTXNZAAWLPM-HNNXBMFYSA-N 1 2 247.338 2.426 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC[C@H]1CCC[C@@H]1C ZINC000521067098 388561118 /nfs/dbraw/zinc/56/11/18/388561118.db2.gz YWUZQCHWAQEYJI-QJPTWQEYSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC[C@H]1CCC[C@@H]1C ZINC000521067098 388561120 /nfs/dbraw/zinc/56/11/20/388561120.db2.gz YWUZQCHWAQEYJI-QJPTWQEYSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1ccn(C)n1 ZINC000528767338 388570525 /nfs/dbraw/zinc/57/05/25/388570525.db2.gz HLJCRFNCORMABI-SECBINFHSA-N 1 2 229.274 2.040 20 0 BEADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1ccn(C)n1 ZINC000528767338 388570527 /nfs/dbraw/zinc/57/05/27/388570527.db2.gz HLJCRFNCORMABI-SECBINFHSA-N 1 2 229.274 2.040 20 0 BEADLO Cc1nc(N2CC[C@H](C)C2)c(C)c(C)[nH+]1 ZINC000301681161 388667958 /nfs/dbraw/zinc/66/79/58/388667958.db2.gz JRXVSQJSYAXESE-QMMMGPOBSA-N 1 2 205.305 2.248 20 0 BEADLO Cc1csc(C[NH2+][C@@H](C)c2cncnc2C)n1 ZINC000522013584 388673884 /nfs/dbraw/zinc/67/38/84/388673884.db2.gz GSWPODPYPNLYEH-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO CC[C@@H]1CC[N@H+](Cc2nnsc2Cl)C1 ZINC000125854223 388680167 /nfs/dbraw/zinc/68/01/67/388680167.db2.gz WKJRDBKWPRVTAL-SSDOTTSWSA-N 1 2 231.752 2.423 20 0 BEADLO CC[C@@H]1CC[N@@H+](Cc2nnsc2Cl)C1 ZINC000125854223 388680169 /nfs/dbraw/zinc/68/01/69/388680169.db2.gz WKJRDBKWPRVTAL-SSDOTTSWSA-N 1 2 231.752 2.423 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@H]3CCC[C@H]32)n[nH]1 ZINC000248547742 388683153 /nfs/dbraw/zinc/68/31/53/388683153.db2.gz FGMNRDGZAGCJEZ-GHMZBOCLSA-N 1 2 234.347 2.132 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@H]3CCC[C@H]32)n[nH]1 ZINC000248547742 388683155 /nfs/dbraw/zinc/68/31/55/388683155.db2.gz FGMNRDGZAGCJEZ-GHMZBOCLSA-N 1 2 234.347 2.132 20 0 BEADLO CC[C@H](NC(=O)CC(C)(F)F)c1[nH]cc[nH+]1 ZINC000328449769 388643708 /nfs/dbraw/zinc/64/37/08/388643708.db2.gz CTSXYCPZYVDPON-ZETCQYMHSA-N 1 2 231.246 2.022 20 0 BEADLO C[C@@H]1CCCC[C@@H]1NC(=O)CCCn1cc[nH+]c1 ZINC000620409500 388646680 /nfs/dbraw/zinc/64/66/80/388646680.db2.gz QHWWFEHFZIMNIM-OLZOCXBDSA-N 1 2 249.358 2.358 20 0 BEADLO CC1C[C@H]2CC[C@@H](C1)N2C(=O)CCn1cc[nH+]c1 ZINC000620432873 388647419 /nfs/dbraw/zinc/64/74/19/388647419.db2.gz FQBNESKZUXYKDG-YHWZYXNKSA-N 1 2 247.342 2.063 20 0 BEADLO CC1(C)CC(C(=O)NCCCCn2cc[nH+]c2)C1 ZINC000552014043 388658465 /nfs/dbraw/zinc/65/84/65/388658465.db2.gz BVNDWSAKQBAJTO-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ncc[nH]2)o1 ZINC000067670394 388737362 /nfs/dbraw/zinc/73/73/62/388737362.db2.gz WKPNPZFPLSTAOS-ONGXEEELSA-N 1 2 231.299 2.416 20 0 BEADLO C[C@H]1C[C@@H]1c1ccc(CNCc2[nH]cc[nH+]2)o1 ZINC000067670394 388737364 /nfs/dbraw/zinc/73/73/64/388737364.db2.gz WKPNPZFPLSTAOS-ONGXEEELSA-N 1 2 231.299 2.416 20 0 BEADLO COCc1cnc(C[N@@H+]2CCC2(C)C)s1 ZINC000539383236 388757346 /nfs/dbraw/zinc/75/73/46/388757346.db2.gz AOFNNNIPVGUJEE-UHFFFAOYSA-N 1 2 226.345 2.274 20 0 BEADLO COCc1cnc(C[N@H+]2CCC2(C)C)s1 ZINC000539383236 388757349 /nfs/dbraw/zinc/75/73/49/388757349.db2.gz AOFNNNIPVGUJEE-UHFFFAOYSA-N 1 2 226.345 2.274 20 0 BEADLO CCOC(=O)C[N@@H+](Cc1ccco1)CC(C)C ZINC000128228785 388740575 /nfs/dbraw/zinc/74/05/75/388740575.db2.gz FYIMBIMGBIQDHY-UHFFFAOYSA-N 1 2 239.315 2.301 20 0 BEADLO CCOC(=O)C[N@H+](Cc1ccco1)CC(C)C ZINC000128228785 388740578 /nfs/dbraw/zinc/74/05/78/388740578.db2.gz FYIMBIMGBIQDHY-UHFFFAOYSA-N 1 2 239.315 2.301 20 0 BEADLO CN(CCC(C)(C)C)C(=O)CCc1[nH]cc[nH+]1 ZINC000649028300 388740774 /nfs/dbraw/zinc/74/07/74/388740774.db2.gz VMBDKXFOEAZRLV-UHFFFAOYSA-N 1 2 237.347 2.237 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CC[C@@H](C)C2)c(C)c[nH+]1 ZINC000538442496 388691204 /nfs/dbraw/zinc/69/12/04/388691204.db2.gz WVQVIEINUMLXMV-BXKDBHETSA-N 1 2 232.327 2.495 20 0 BEADLO CC[C@H]1CN(C)CC[N@@H+]1Cc1ccc(F)cc1 ZINC000552406793 388703555 /nfs/dbraw/zinc/70/35/55/388703555.db2.gz PIUSBHVUPBRLIB-AWEZNQCLSA-N 1 2 236.334 2.352 20 0 BEADLO CC[C@H]1CN(C)CC[N@H+]1Cc1ccc(F)cc1 ZINC000552406793 388703557 /nfs/dbraw/zinc/70/35/57/388703557.db2.gz PIUSBHVUPBRLIB-AWEZNQCLSA-N 1 2 236.334 2.352 20 0 BEADLO CC(=O)NCCC[N@H+](CC1CC1)c1ccccc1 ZINC000127455629 388723880 /nfs/dbraw/zinc/72/38/80/388723880.db2.gz QHAXWIGNKRUQGU-UHFFFAOYSA-N 1 2 246.354 2.429 20 0 BEADLO CC(=O)NCCC[N@@H+](CC1CC1)c1ccccc1 ZINC000127455629 388723881 /nfs/dbraw/zinc/72/38/81/388723881.db2.gz QHAXWIGNKRUQGU-UHFFFAOYSA-N 1 2 246.354 2.429 20 0 BEADLO Cc1cc(NC2CCC2)nc(-c2cccnc2)[nH+]1 ZINC000337337701 177705927 /nfs/dbraw/zinc/70/59/27/177705927.db2.gz FCWSXDMJRQGCMV-UHFFFAOYSA-N 1 2 240.310 2.233 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N[C@@H]1CC2CCC1CC2 ZINC000554357243 388809830 /nfs/dbraw/zinc/80/98/30/388809830.db2.gz KWSNJTJTDXCWPI-GCZXYKMCSA-N 1 2 247.342 2.037 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N[C@@H]1CC2CCC1CC2 ZINC000554357243 388809833 /nfs/dbraw/zinc/80/98/33/388809833.db2.gz KWSNJTJTDXCWPI-GCZXYKMCSA-N 1 2 247.342 2.037 20 0 BEADLO FC(F)(F)C[NH2+][C@H]1CCCC12CCOCC2 ZINC000300989566 388766892 /nfs/dbraw/zinc/76/68/92/388766892.db2.gz VRENYBPFHVONAU-VIFPVBQESA-N 1 2 237.265 2.488 20 0 BEADLO Cc1cc(NCc2cscn2)nc(C2CC2)[nH+]1 ZINC000341455988 177707898 /nfs/dbraw/zinc/70/78/98/177707898.db2.gz KRYWEOUMYASXMF-UHFFFAOYSA-N 1 2 246.339 2.153 20 0 BEADLO CC[C@@H](C)[N@H+](C)Cc1noc(C2CC2)n1 ZINC000068451284 388787957 /nfs/dbraw/zinc/78/79/57/388787957.db2.gz GNFWWJANCRMRRS-MRVPVSSYSA-N 1 2 209.293 2.177 20 0 BEADLO CC[C@@H](C)[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000068451284 388787961 /nfs/dbraw/zinc/78/79/61/388787961.db2.gz GNFWWJANCRMRRS-MRVPVSSYSA-N 1 2 209.293 2.177 20 0 BEADLO c1cn(C[C@@H]2CCC3(CCCC3)O2)c[nH+]1 ZINC000229437108 388789137 /nfs/dbraw/zinc/78/91/37/388789137.db2.gz ATYPUMYUULSCCT-NSHDSACASA-N 1 2 206.289 2.375 20 0 BEADLO c1cn(C[C@H]2CCC3(CCCC3)O2)c[nH+]1 ZINC000229437117 388789276 /nfs/dbraw/zinc/78/92/76/388789276.db2.gz ATYPUMYUULSCCT-LLVKDONJSA-N 1 2 206.289 2.375 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)NCCCCn2cc[nH+]c2)C1 ZINC000540690024 388815166 /nfs/dbraw/zinc/81/51/66/388815166.db2.gz JNPOMDPEOAQKJB-OLZOCXBDSA-N 1 2 249.358 2.216 20 0 BEADLO CCCCc1nc(C[NH2+]C2(C3CC3)CC2)no1 ZINC000541594163 388860197 /nfs/dbraw/zinc/86/01/97/388860197.db2.gz SIFKQHHYJXXZQG-UHFFFAOYSA-N 1 2 235.331 2.444 20 0 BEADLO CCSCC[N@H+](C)[C@@H](C)C(=O)OC(C)C ZINC000129636014 388861514 /nfs/dbraw/zinc/86/15/14/388861514.db2.gz GDRPBTVEAWEOTR-JTQLQIEISA-N 1 2 233.377 2.011 20 0 BEADLO CCSCC[N@@H+](C)[C@@H](C)C(=O)OC(C)C ZINC000129636014 388861518 /nfs/dbraw/zinc/86/15/18/388861518.db2.gz GDRPBTVEAWEOTR-JTQLQIEISA-N 1 2 233.377 2.011 20 0 BEADLO CC[C@H](CC(F)F)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000565215741 388927003 /nfs/dbraw/zinc/92/70/03/388927003.db2.gz NTVVZNIYOLWFST-HTQZYQBOSA-N 1 2 245.273 2.268 20 0 BEADLO CSCCCCCNc1nc(C)[nH+]cc1C ZINC000565230839 388929490 /nfs/dbraw/zinc/92/94/90/388929490.db2.gz WWJINONIBMCZCN-UHFFFAOYSA-N 1 2 239.388 2.461 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1CCCSC1 ZINC000565610009 388959295 /nfs/dbraw/zinc/95/92/95/388959295.db2.gz TWPCVTALASGLGS-JTQLQIEISA-N 1 2 223.345 2.401 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+](C)Cc2cnn(C)c2C)o1 ZINC000565755633 388967695 /nfs/dbraw/zinc/96/76/95/388967695.db2.gz NSBGQUUGIKSMQS-LLVKDONJSA-N 1 2 248.330 2.218 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+](C)Cc2cnn(C)c2C)o1 ZINC000565755633 388967699 /nfs/dbraw/zinc/96/76/99/388967699.db2.gz NSBGQUUGIKSMQS-LLVKDONJSA-N 1 2 248.330 2.218 20 0 BEADLO Cc1nc(C2([NH2+]C/C=C/Cl)CCCC2)no1 ZINC000266217103 388995471 /nfs/dbraw/zinc/99/54/71/388995471.db2.gz RCKPYAJTNOWGDQ-QPJJXVBHSA-N 1 2 241.722 2.489 20 0 BEADLO CCC1(CNc2cc[nH+]c(C)n2)CCOCC1 ZINC000266748699 388996587 /nfs/dbraw/zinc/99/65/87/388996587.db2.gz RYXIYHXKLXLPIC-UHFFFAOYSA-N 1 2 235.331 2.404 20 0 BEADLO Cc1nnc(C[NH2+][C@H](C)c2cccc(O)c2)s1 ZINC000271766141 389024382 /nfs/dbraw/zinc/02/43/82/389024382.db2.gz FALAHUZXMAWKMT-MRVPVSSYSA-N 1 2 249.339 2.403 20 0 BEADLO CO[C@H]1CCC[C@@H]1Sc1nc(N)cc(C)[nH+]1 ZINC000273074400 389037440 /nfs/dbraw/zinc/03/74/40/389037440.db2.gz FNIHQUJGLASMME-IUCAKERBSA-N 1 2 239.344 2.027 20 0 BEADLO CCN(CCC1CC1)c1cc[nH+]c(C)n1 ZINC000354593983 169824801 /nfs/dbraw/zinc/82/48/01/169824801.db2.gz LAEFVIGPQKUVKU-UHFFFAOYSA-N 1 2 205.305 2.411 20 0 BEADLO Cc1c(NC(=O)Nc2cc[nH+]cc2C)cnn1C ZINC000179843541 322822081 /nfs/dbraw/zinc/82/20/81/322822081.db2.gz JNELCBYYMJCMGG-UHFFFAOYSA-N 1 2 245.286 2.076 20 0 BEADLO C(c1nnc(C2CC2)[nH]1)[N@@H+]1CCCC2(CCC2)C1 ZINC000348177723 533378179 /nfs/dbraw/zinc/37/81/79/533378179.db2.gz HCXJMVHEXVCAPR-UHFFFAOYSA-N 1 2 246.358 2.448 20 0 BEADLO C(c1nnc(C2CC2)[nH]1)[N@H+]1CCCC2(CCC2)C1 ZINC000348177723 533378184 /nfs/dbraw/zinc/37/81/84/533378184.db2.gz HCXJMVHEXVCAPR-UHFFFAOYSA-N 1 2 246.358 2.448 20 0 BEADLO C[C@@H](CCC1CC1)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493132197 533522563 /nfs/dbraw/zinc/52/25/63/533522563.db2.gz QPMHGFWRSQGVDO-FGEFZZPRSA-N 1 2 233.315 2.118 20 0 BEADLO COc1cccc(NC(=O)C=Cc2c[nH]c[nH+]2)c1 ZINC000493772427 533592269 /nfs/dbraw/zinc/59/22/69/533592269.db2.gz RBUPINIHCUMAIR-AATRIKPKSA-N 1 2 243.266 2.070 20 0 BEADLO C[C@@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)[C@H]1C ZINC000493227859 533636891 /nfs/dbraw/zinc/63/68/91/533636891.db2.gz RTNMJGXRWLKOOO-MXFLAHGMSA-N 1 2 233.315 2.070 20 0 BEADLO Cc1noc(C2CCN(c3cccc[nH+]3)CC2)n1 ZINC000264933870 132181140 /nfs/dbraw/zinc/18/11/40/132181140.db2.gz QFJMIUVIYKEJGP-UHFFFAOYSA-N 1 2 244.298 2.157 20 0 BEADLO Cc1nc(N2CCCC3(CCOCC3)C2)cc[nH+]1 ZINC000266207995 132185014 /nfs/dbraw/zinc/18/50/14/132185014.db2.gz FNGWETWZQXUHDH-UHFFFAOYSA-N 1 2 247.342 2.182 20 0 BEADLO Cc1cc(N2CCO[C@@H](C)[C@H]2C)nc(C2CC2)[nH+]1 ZINC000268820554 132193709 /nfs/dbraw/zinc/19/37/09/132193709.db2.gz PBUVGKSKBSGEHZ-MNOVXSKESA-N 1 2 247.342 2.276 20 0 BEADLO CC1(C2CCN(c3cccc[nH+]3)CC2)OCCO1 ZINC000269050347 132193903 /nfs/dbraw/zinc/19/39/03/132193903.db2.gz QBPRVGFFRHMEKS-UHFFFAOYSA-N 1 2 248.326 2.061 20 0 BEADLO Cc1cc(N2CCC[C@@](C)(O)C2)nc(C2CC2)[nH+]1 ZINC000271010624 132198550 /nfs/dbraw/zinc/19/85/50/132198550.db2.gz XVSBCDWGHQWGBE-CQSZACIVSA-N 1 2 247.342 2.014 20 0 BEADLO CCC[C@H]1CN(c2nc(C)[nH+]c(C)c2C)CCO1 ZINC000301826560 132224685 /nfs/dbraw/zinc/22/46/85/132224685.db2.gz FFEBIFBBXVXCDQ-ZDUSSCGKSA-N 1 2 249.358 2.407 20 0 BEADLO Cc1nc(N2CCC[C@@H](F)C2)c(C)c(C)[nH+]1 ZINC000336571394 132248849 /nfs/dbraw/zinc/24/88/49/132248849.db2.gz WKQPPXOTUHSSGU-LLVKDONJSA-N 1 2 223.295 2.340 20 0 BEADLO Cc1cc(N2CCS[C@@H](C)[C@H]2C)nc[nH+]1 ZINC000301307304 132252542 /nfs/dbraw/zinc/25/25/42/132252542.db2.gz ZSCGFKSOMRLGLT-ZJUUUORDSA-N 1 2 223.345 2.115 20 0 BEADLO Cc1cc(N2CCC[C@@H](C)[C@@H]2C)nc[nH+]1 ZINC000301437853 132253671 /nfs/dbraw/zinc/25/36/71/132253671.db2.gz SMUUHYRALKGFPN-KOLCDFICSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1cc(N2C[C@@H](C)S[C@@H](C)C2)nc[nH+]1 ZINC000301459436 132254192 /nfs/dbraw/zinc/25/41/92/132254192.db2.gz IQAGFWJPPZAACY-AOOOYVTPSA-N 1 2 223.345 2.115 20 0 BEADLO Cc1cc(N2C[C@H](C)S[C@@H](C)C2)nc[nH+]1 ZINC000301459439 132254213 /nfs/dbraw/zinc/25/42/13/132254213.db2.gz IQAGFWJPPZAACY-UWVGGRQHSA-N 1 2 223.345 2.115 20 0 BEADLO CC[C@@H]1CN(c2nc(C)[nH+]c(C)c2C)C[C@@H](C)O1 ZINC000301632148 132255332 /nfs/dbraw/zinc/25/53/32/132255332.db2.gz BVXOALRVCBMYOO-NOZJJQNGSA-N 1 2 249.358 2.406 20 0 BEADLO CO[C@@H]1CN(c2cc[nH+]c(C(C)C)n2)CC[C@H]1C ZINC000302587601 132264637 /nfs/dbraw/zinc/26/46/37/132264637.db2.gz VRGNBQNWRUPBBC-VXGBXAGGSA-N 1 2 249.358 2.461 20 0 BEADLO c1ccc(N2CCC([C@H]3CCOC3)CC2)[nH+]c1 ZINC000374649301 132287301 /nfs/dbraw/zinc/28/73/01/132287301.db2.gz ZEOVXIGHBRARDQ-ZDUSSCGKSA-N 1 2 232.327 2.335 20 0 BEADLO Cc1cn2c([nH+]1)CN(c1ccnc(Cl)c1)CC2 ZINC000359991409 132300347 /nfs/dbraw/zinc/30/03/47/132300347.db2.gz DOABJAZRFYDHCY-UHFFFAOYSA-N 1 2 248.717 2.260 20 0 BEADLO Nc1[nH+]cnc(N2CCCC3(CC3)C2)c1Cl ZINC000277273843 132306475 /nfs/dbraw/zinc/30/64/75/132306475.db2.gz ACQPKRPMLIVERV-UHFFFAOYSA-N 1 2 238.722 2.093 20 0 BEADLO Nc1nc[nH+]c(N2CCCC3(CC3)C2)c1Cl ZINC000277273843 132306477 /nfs/dbraw/zinc/30/64/77/132306477.db2.gz ACQPKRPMLIVERV-UHFFFAOYSA-N 1 2 238.722 2.093 20 0 BEADLO C[C@H]1CCCN(c2nc(N)c3ccccc3[nH+]2)C1 ZINC000041146389 132349573 /nfs/dbraw/zinc/34/95/73/132349573.db2.gz YVDMTWKCHGXCJH-JTQLQIEISA-N 1 2 242.326 2.448 20 0 BEADLO CC(C)(C)c1noc(C[N@@H+]2CCC23CCC3)n1 ZINC000334178247 133576556 /nfs/dbraw/zinc/57/65/56/133576556.db2.gz ABHRLOOWJKXVAR-UHFFFAOYSA-N 1 2 235.331 2.496 20 0 BEADLO CC(C)(C)c1noc(C[N@H+]2CCC23CCC3)n1 ZINC000334178247 133576557 /nfs/dbraw/zinc/57/65/57/133576557.db2.gz ABHRLOOWJKXVAR-UHFFFAOYSA-N 1 2 235.331 2.496 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CCO[C@@H]2CCC[C@H]21 ZINC000334798488 133747637 /nfs/dbraw/zinc/74/76/37/133747637.db2.gz PSJHXWMLUHXULA-CHWSQXEVSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@H]1CCCC[C@@H]1C(=O)N1CCn2cc[nH+]c2C1 ZINC000335089892 133761185 /nfs/dbraw/zinc/76/11/85/133761185.db2.gz GUZLHUHYUMJBHI-RYUDHWBXSA-N 1 2 247.342 2.052 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2CCCC[C@@H]2C)n1 ZINC000335080475 133765031 /nfs/dbraw/zinc/76/50/31/133765031.db2.gz WWVGJFQLSLDOQI-DTWKUNHWSA-N 1 2 209.293 2.083 20 0 BEADLO C[NH2+]Cc1noc(C[C@@H](C)c2ccc(F)cc2)n1 ZINC000349899617 133925014 /nfs/dbraw/zinc/92/50/14/133925014.db2.gz WILLCCFSCJUPBS-SECBINFHSA-N 1 2 249.289 2.274 20 0 BEADLO OC[C@]1(F)CC[N@H+](Cc2cccc(Cl)c2)C1 ZINC000335926017 134008465 /nfs/dbraw/zinc/00/84/65/134008465.db2.gz NIGHEUNFBYJEOV-LBPRGKRZSA-N 1 2 243.709 2.246 20 0 BEADLO OC[C@]1(F)CC[N@@H+](Cc2cccc(Cl)c2)C1 ZINC000335926017 134008466 /nfs/dbraw/zinc/00/84/66/134008466.db2.gz NIGHEUNFBYJEOV-LBPRGKRZSA-N 1 2 243.709 2.246 20 0 BEADLO O=C(NC1CCCCC1)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000335940379 134017132 /nfs/dbraw/zinc/01/71/32/134017132.db2.gz BGYQHRDDAMZZIO-NSHDSACASA-N 1 2 247.342 2.279 20 0 BEADLO O=C(NC1CCCCC1)[C@H]1CCCc2[nH]c[nH+]c21 ZINC000335940379 134017133 /nfs/dbraw/zinc/01/71/33/134017133.db2.gz BGYQHRDDAMZZIO-NSHDSACASA-N 1 2 247.342 2.279 20 0 BEADLO O=C(NC1CCCCC1)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000335940378 134017214 /nfs/dbraw/zinc/01/72/14/134017214.db2.gz BGYQHRDDAMZZIO-LLVKDONJSA-N 1 2 247.342 2.279 20 0 BEADLO O=C(NC1CCCCC1)[C@@H]1CCCc2[nH]c[nH+]c21 ZINC000335940378 134017215 /nfs/dbraw/zinc/01/72/15/134017215.db2.gz BGYQHRDDAMZZIO-LLVKDONJSA-N 1 2 247.342 2.279 20 0 BEADLO CO[C@@H]1CC[N@H+](Cc2cc(F)c(F)c(F)c2)C1 ZINC000335944773 134019211 /nfs/dbraw/zinc/01/92/11/134019211.db2.gz JKNUODCNKZQVLO-SECBINFHSA-N 1 2 245.244 2.325 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2cc(F)c(F)c(F)c2)C1 ZINC000335944773 134019212 /nfs/dbraw/zinc/01/92/12/134019212.db2.gz JKNUODCNKZQVLO-SECBINFHSA-N 1 2 245.244 2.325 20 0 BEADLO Fc1cc(F)cc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)c1 ZINC000335944911 134019674 /nfs/dbraw/zinc/01/96/74/134019674.db2.gz JILSLLKPMZEEMB-BETUJISGSA-N 1 2 239.265 2.328 20 0 BEADLO Fc1cc(F)cc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c1 ZINC000335944911 134019675 /nfs/dbraw/zinc/01/96/75/134019675.db2.gz JILSLLKPMZEEMB-BETUJISGSA-N 1 2 239.265 2.328 20 0 BEADLO C[N@@H+](Cc1ncc(Cl)s1)C[C@H]1CCCO1 ZINC000351983508 134025759 /nfs/dbraw/zinc/02/57/59/134025759.db2.gz TUHBBSKNMJSMTL-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO C[N@H+](Cc1ncc(Cl)s1)C[C@H]1CCCO1 ZINC000351983508 134025760 /nfs/dbraw/zinc/02/57/60/134025760.db2.gz TUHBBSKNMJSMTL-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1ccccc1 ZINC000335974303 134031094 /nfs/dbraw/zinc/03/10/94/134031094.db2.gz AXQRGBTYKMXCDF-UHFFFAOYSA-N 1 2 226.279 2.318 20 0 BEADLO C[C@H]1CCCCCN1C(=O)CCc1[nH]cc[nH+]1 ZINC000335977187 134031688 /nfs/dbraw/zinc/03/16/88/134031688.db2.gz MEGVRNZYACKVRH-NSHDSACASA-N 1 2 235.331 2.133 20 0 BEADLO CCCC[N@H+](CCO)Cc1ncc(Cl)s1 ZINC000352011187 134035185 /nfs/dbraw/zinc/03/51/85/134035185.db2.gz PTIHJKLKWQXUCR-UHFFFAOYSA-N 1 2 248.779 2.391 20 0 BEADLO CCCC[N@@H+](CCO)Cc1ncc(Cl)s1 ZINC000352011187 134035186 /nfs/dbraw/zinc/03/51/86/134035186.db2.gz PTIHJKLKWQXUCR-UHFFFAOYSA-N 1 2 248.779 2.391 20 0 BEADLO Cc1cc(C(=O)C[N@H+]2C[C@H](C)[C@H]2C)c(C)[nH]1 ZINC000335980132 134037093 /nfs/dbraw/zinc/03/70/93/134037093.db2.gz VSABTIZKBXWHII-GZMMTYOYSA-N 1 2 220.316 2.154 20 0 BEADLO Cc1cc(C(=O)C[N@@H+]2C[C@H](C)[C@H]2C)c(C)[nH]1 ZINC000335980132 134037094 /nfs/dbraw/zinc/03/70/94/134037094.db2.gz VSABTIZKBXWHII-GZMMTYOYSA-N 1 2 220.316 2.154 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@@H](C)[C@@H]2C)cn1 ZINC000335999413 134043738 /nfs/dbraw/zinc/04/37/38/134043738.db2.gz UFBWEUUNJKBENJ-RYUDHWBXSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@@H](C)[C@@H]2C)cn1 ZINC000335999413 134043739 /nfs/dbraw/zinc/04/37/39/134043739.db2.gz UFBWEUUNJKBENJ-RYUDHWBXSA-N 1 2 234.343 2.253 20 0 BEADLO Cc1nnc(C[N@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)o1 ZINC000336006772 134049255 /nfs/dbraw/zinc/04/92/55/134049255.db2.gz ZUMWTXWNWOOPQV-XPUUQOCRSA-N 1 2 249.236 2.151 20 0 BEADLO Cc1nnc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)o1 ZINC000336006772 134049256 /nfs/dbraw/zinc/04/92/56/134049256.db2.gz ZUMWTXWNWOOPQV-XPUUQOCRSA-N 1 2 249.236 2.151 20 0 BEADLO C[C@H]1CCCC[C@H]1CNC(=O)CCc1[nH]cc[nH+]1 ZINC000352059246 134054610 /nfs/dbraw/zinc/05/46/10/134054610.db2.gz HJZRFUOKNXPQSC-RYUDHWBXSA-N 1 2 249.358 2.285 20 0 BEADLO Cc1nc(N2CCC=C(F)C2)c(C)c(C)[nH+]1 ZINC000336027967 134057768 /nfs/dbraw/zinc/05/77/68/134057768.db2.gz HHCGUGYKCRPMEL-UHFFFAOYSA-N 1 2 221.279 2.465 20 0 BEADLO CCOC[C@H]([NH2+][C@H](C)c1noc(C)n1)C(C)C ZINC000352114711 134069638 /nfs/dbraw/zinc/06/96/38/134069638.db2.gz CCPPLMMJZSJNFB-KOLCDFICSA-N 1 2 241.335 2.090 20 0 BEADLO C[C@H]1C[C@@H](COc2cc[nH+]cc2)CCO1 ZINC000336134215 134095421 /nfs/dbraw/zinc/09/54/21/134095421.db2.gz XWVAVPHSAWKVFA-QWRGUYRKSA-N 1 2 207.273 2.276 20 0 BEADLO CCN(C)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000336144544 134101809 /nfs/dbraw/zinc/10/18/09/134101809.db2.gz BKBQYYSSRXUZGW-UHFFFAOYSA-N 1 2 221.304 2.490 20 0 BEADLO C[C@H]1CCC[C@H](c2noc(C[NH+](C)C)n2)C1 ZINC000336182558 134120202 /nfs/dbraw/zinc/12/02/02/134120202.db2.gz XXHZBCBCOGKHLI-UWVGGRQHSA-N 1 2 223.320 2.425 20 0 BEADLO C[C@@H]1C[C@H](C)CN1C(=O)c1ccc2[nH+]ccn2c1 ZINC000336183761 134120611 /nfs/dbraw/zinc/12/06/11/134120611.db2.gz ZICCGRXLAZXQEH-WDEREUQCSA-N 1 2 243.310 2.205 20 0 BEADLO Cc1cc(N2CCC[C@@](C)(F)C2)nc[nH+]1 ZINC000336185246 134120986 /nfs/dbraw/zinc/12/09/86/134120986.db2.gz ZJHXHCLFLWYKSL-LLVKDONJSA-N 1 2 209.268 2.113 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1nnc(C2CC2)s1 ZINC000336204297 134131358 /nfs/dbraw/zinc/13/13/58/134131358.db2.gz ZYVZYQDQXAPZFS-YUMQZZPRSA-N 1 2 223.345 2.398 20 0 BEADLO Fc1cc(F)cc(C[NH2+][C@@H]2CCn3ccnc32)c1 ZINC000336208370 134133094 /nfs/dbraw/zinc/13/30/94/134133094.db2.gz FWUTZEKXCIIYNS-GFCCVEGCSA-N 1 2 249.264 2.396 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1ccncc1F ZINC000336217617 134137771 /nfs/dbraw/zinc/13/77/71/134137771.db2.gz RQVSHFWQXMXTPS-JQWIXIFHSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1ccncc1F ZINC000336217617 134137772 /nfs/dbraw/zinc/13/77/72/134137772.db2.gz RQVSHFWQXMXTPS-JQWIXIFHSA-N 1 2 238.306 2.220 20 0 BEADLO COc1cc(C)ccc1C[N@@H+]1CCO[C@@H](C)C1 ZINC000336217738 134138131 /nfs/dbraw/zinc/13/81/31/134138131.db2.gz LIZXAXSUYUIIBM-LBPRGKRZSA-N 1 2 235.327 2.224 20 0 BEADLO COc1cc(C)ccc1C[N@H+]1CCO[C@@H](C)C1 ZINC000336217738 134138132 /nfs/dbraw/zinc/13/81/32/134138132.db2.gz LIZXAXSUYUIIBM-LBPRGKRZSA-N 1 2 235.327 2.224 20 0 BEADLO C[C@@H]([NH2+]Cc1ccn[nH]1)[C@H]1COc2ccccc21 ZINC000169170869 134249736 /nfs/dbraw/zinc/24/97/36/134249736.db2.gz PWSWMOVKRFJDGN-ZWNOBZJWSA-N 1 2 243.310 2.064 20 0 BEADLO CC(C)n1ccc(C[N@H+](C)C[C@H]2CCCO2)n1 ZINC000172013535 134264487 /nfs/dbraw/zinc/26/44/87/134264487.db2.gz GYHUAZQPBXSGEI-CYBMUJFWSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccc(C[N@@H+](C)C[C@H]2CCCO2)n1 ZINC000172013535 134264488 /nfs/dbraw/zinc/26/44/88/134264488.db2.gz GYHUAZQPBXSGEI-CYBMUJFWSA-N 1 2 237.347 2.075 20 0 BEADLO Cc1c(Cl)cccc1C(=O)NCc1c[nH+]c[nH]1 ZINC000219835620 134292295 /nfs/dbraw/zinc/29/22/95/134292295.db2.gz DFPKVPJZCOAXPT-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO Cc1c(Cl)cccc1C(=O)NCc1c[nH]c[nH+]1 ZINC000219835620 134292296 /nfs/dbraw/zinc/29/22/96/134292296.db2.gz DFPKVPJZCOAXPT-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO C[N@H+](Cc1cnccn1)Cc1cc(F)ccc1F ZINC000177239688 134296836 /nfs/dbraw/zinc/29/68/36/134296836.db2.gz VBGDUULQKOWOTN-UHFFFAOYSA-N 1 2 249.264 2.387 20 0 BEADLO C[N@@H+](Cc1cnccn1)Cc1cc(F)ccc1F ZINC000177239688 134296837 /nfs/dbraw/zinc/29/68/37/134296837.db2.gz VBGDUULQKOWOTN-UHFFFAOYSA-N 1 2 249.264 2.387 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2CC[C@@H](C)O2)c(C)[nH+]1 ZINC000177694314 134301261 /nfs/dbraw/zinc/30/12/61/134301261.db2.gz WNJGZXPFPNUXMZ-BXKDBHETSA-N 1 2 234.299 2.204 20 0 BEADLO CCCc1nc(C[N@@H+]2CC[C@H](C)[C@@H]2C)no1 ZINC000177887046 134303896 /nfs/dbraw/zinc/30/38/96/134303896.db2.gz DPFCDRJOFYYQGA-UWVGGRQHSA-N 1 2 223.320 2.252 20 0 BEADLO CCCc1nc(C[N@H+]2CC[C@H](C)[C@@H]2C)no1 ZINC000177887046 134303897 /nfs/dbraw/zinc/30/38/97/134303897.db2.gz DPFCDRJOFYYQGA-UWVGGRQHSA-N 1 2 223.320 2.252 20 0 BEADLO CC1(CC(=O)NCCc2[nH]cc[nH+]2)CCCCC1 ZINC000178797603 134311481 /nfs/dbraw/zinc/31/14/81/134311481.db2.gz CPVKTZZMSKTKHQ-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO CC(C)Cn1ncnc1C[NH+]1CCC(C)CC1 ZINC000182628876 134346219 /nfs/dbraw/zinc/34/62/19/134346219.db2.gz ZONSCZLBVXAELP-UHFFFAOYSA-N 1 2 236.363 2.166 20 0 BEADLO Fc1cccc(F)c1COCc1[nH]cc[nH+]1 ZINC000182859468 134349159 /nfs/dbraw/zinc/34/91/59/134349159.db2.gz WHYJAJOGTGEXTB-UHFFFAOYSA-N 1 2 224.210 2.405 20 0 BEADLO CCCC[C@H](CC)C[N@H+](C)Cc1nnc[nH]1 ZINC000183631405 134355275 /nfs/dbraw/zinc/35/52/75/134355275.db2.gz HYMDUCQHJNCXNI-NSHDSACASA-N 1 2 224.352 2.453 20 0 BEADLO CCCC[C@H](CC)C[N@@H+](C)Cc1nnc[nH]1 ZINC000183631405 134355276 /nfs/dbraw/zinc/35/52/76/134355276.db2.gz HYMDUCQHJNCXNI-NSHDSACASA-N 1 2 224.352 2.453 20 0 BEADLO C[C@@H]1C[NH+](Cc2cc(O)cc(F)c2)C[C@@H](C)O1 ZINC000184147794 134358870 /nfs/dbraw/zinc/35/88/70/134358870.db2.gz AQGHBPSSQFBACY-NXEZZACHSA-N 1 2 239.290 2.141 20 0 BEADLO CC(C)C[C@H]1OCCC[C@@H]1[NH2+]Cc1ccn[nH]1 ZINC000185197720 134372760 /nfs/dbraw/zinc/37/27/60/134372760.db2.gz DMLCWVVDWDAWLE-QWHCGFSZSA-N 1 2 237.347 2.093 20 0 BEADLO CO[C@@H]1C[C@@H](Nc2cc(C)[nH+]cn2)C1(C)C ZINC000227822014 134389348 /nfs/dbraw/zinc/38/93/48/134389348.db2.gz GAIPUMOONUHYPJ-NXEZZACHSA-N 1 2 221.304 2.010 20 0 BEADLO CO[C@@H]1C[C@@H](Nc2cccc[nH+]2)C1(C)C ZINC000227822571 134389465 /nfs/dbraw/zinc/38/94/65/134389465.db2.gz YPIWFZKNIILKMY-NXEZZACHSA-N 1 2 206.289 2.307 20 0 BEADLO COC(=O)[C@H]([NH2+][C@H]1C[C@@H]1c1ccccc1)C1CC1 ZINC000227769305 134393362 /nfs/dbraw/zinc/39/33/62/134393362.db2.gz RSRPHSOCWFUFIN-HZSPNIEDSA-N 1 2 245.322 2.084 20 0 BEADLO COC(=O)[C@H]([NH2+]Cc1cccc(C)c1)C1CC1 ZINC000227768277 134393374 /nfs/dbraw/zinc/39/33/74/134393374.db2.gz GIMUUDQXBKHHAJ-CYBMUJFWSA-N 1 2 233.311 2.036 20 0 BEADLO CC(C)c1nc(C[N@@H+]2CC[C@H](C)[C@@H]2C)no1 ZINC000248370910 135000881 /nfs/dbraw/zinc/00/08/81/135000881.db2.gz YBZCKQUNLGUXEN-UWVGGRQHSA-N 1 2 223.320 2.423 20 0 BEADLO CC(C)c1nc(C[N@H+]2CC[C@H](C)[C@@H]2C)no1 ZINC000248370910 135000883 /nfs/dbraw/zinc/00/08/83/135000883.db2.gz YBZCKQUNLGUXEN-UWVGGRQHSA-N 1 2 223.320 2.423 20 0 BEADLO Cc1csc([C@@H](C)NCc2[nH+]ccn2C)n1 ZINC000070650132 135004464 /nfs/dbraw/zinc/00/44/64/135004464.db2.gz HNPMFDYQBUSJKQ-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1csc([C@@H](C)[NH2+]Cc2nccn2C)n1 ZINC000070650132 135004465 /nfs/dbraw/zinc/00/44/65/135004465.db2.gz HNPMFDYQBUSJKQ-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO CO[C@H](C)CN1CC[N@H+](C)C[C@H]1c1ccccc1 ZINC000248417692 135007784 /nfs/dbraw/zinc/00/77/84/135007784.db2.gz JSWHLMCOWQJHQG-HIFRSBDPSA-N 1 2 248.370 2.010 20 0 BEADLO CO[C@H](C)CN1CC[N@@H+](C)C[C@H]1c1ccccc1 ZINC000248417692 135007786 /nfs/dbraw/zinc/00/77/86/135007786.db2.gz JSWHLMCOWQJHQG-HIFRSBDPSA-N 1 2 248.370 2.010 20 0 BEADLO OC[C@@H]1C[N@H+](CC(F)F)C[C@H]1c1ccsc1 ZINC000249591609 135041569 /nfs/dbraw/zinc/04/15/69/135041569.db2.gz VOAYIFTVRXJFJJ-UWVGGRQHSA-N 1 2 247.310 2.021 20 0 BEADLO OC[C@@H]1C[N@@H+](CC(F)F)C[C@H]1c1ccsc1 ZINC000249591609 135041570 /nfs/dbraw/zinc/04/15/70/135041570.db2.gz VOAYIFTVRXJFJJ-UWVGGRQHSA-N 1 2 247.310 2.021 20 0 BEADLO Cc1ccc(NC2CCOCC2)c(C)[nH+]1 ZINC000087151694 135107872 /nfs/dbraw/zinc/10/78/72/135107872.db2.gz JYACUBRRGSDFMP-UHFFFAOYSA-N 1 2 206.289 2.289 20 0 BEADLO C[C@H](c1ccccc1)N(C)C(=O)Cn1cc[nH+]c1 ZINC000078288540 135118923 /nfs/dbraw/zinc/11/89/23/135118923.db2.gz QATJDULVUIZEEA-GFCCVEGCSA-N 1 2 243.310 2.103 20 0 BEADLO CC[C@H](C)C(=O)NCCCCNc1cccc[nH+]1 ZINC000078493516 135128319 /nfs/dbraw/zinc/12/83/19/135128319.db2.gz KZHATMKZSUXUOB-LBPRGKRZSA-N 1 2 249.358 2.436 20 0 BEADLO CN(CC1CCOCC1)c1[nH]c2ccccc2[nH+]1 ZINC000258683235 135133502 /nfs/dbraw/zinc/13/35/02/135133502.db2.gz DAHJUOCRQYSVRW-UHFFFAOYSA-N 1 2 245.326 2.426 20 0 BEADLO C[NH2+]Cc1noc(C(C)(C)C(C)(C)C)n1 ZINC000261536537 135171948 /nfs/dbraw/zinc/17/19/48/135171948.db2.gz SAXRWZAMSNSWCV-UHFFFAOYSA-N 1 2 211.309 2.113 20 0 BEADLO Cc1cc(C[NH2+]Cc2scnc2C)no1 ZINC000084149353 135187150 /nfs/dbraw/zinc/18/71/50/135187150.db2.gz XEADRCJZDPZDFE-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO Cc1cc(N2C[C@H]3CC[C@@H](C2)O3)nc(C(C)C)[nH+]1 ZINC000342450946 135275599 /nfs/dbraw/zinc/27/55/99/135275599.db2.gz CCILIVJQPNBDOC-TXEJJXNPSA-N 1 2 247.342 2.276 20 0 BEADLO CC[N@H+](Cc1ncc(COC)s1)C1CC1 ZINC000342678927 135304458 /nfs/dbraw/zinc/30/44/58/135304458.db2.gz NDISGBQGPFYSBT-UHFFFAOYSA-N 1 2 226.345 2.274 20 0 BEADLO CC[N@@H+](Cc1ncc(COC)s1)C1CC1 ZINC000342678927 135304459 /nfs/dbraw/zinc/30/44/59/135304459.db2.gz NDISGBQGPFYSBT-UHFFFAOYSA-N 1 2 226.345 2.274 20 0 BEADLO Cc1ccc(CN(C)Cc2[nH+]cc(C)n2C)o1 ZINC000342789668 135318777 /nfs/dbraw/zinc/31/87/77/135318777.db2.gz LMFOCGVBCVWLTJ-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO CCc1nc(N2CCO[C@@H](C(C)C)C2)cc(C)[nH+]1 ZINC000342941745 135338043 /nfs/dbraw/zinc/33/80/43/135338043.db2.gz XMDKFPYYYKGJBS-GFCCVEGCSA-N 1 2 249.358 2.209 20 0 BEADLO CNC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000334294606 135341614 /nfs/dbraw/zinc/34/16/14/135341614.db2.gz UIHQHEJOTPXUPJ-UHFFFAOYSA-N 1 2 228.251 2.234 20 0 BEADLO Fc1ccc(CN2CCC[C@@H]2c2[nH]cc[nH+]2)nc1 ZINC000334305669 135348396 /nfs/dbraw/zinc/34/83/96/135348396.db2.gz GRJWITSHTPUKRH-GFCCVEGCSA-N 1 2 246.289 2.281 20 0 BEADLO C[C@H]1CCC[C@@H](NC(=O)C(C)(C)c2c[nH]c[nH+]2)C1 ZINC000334307308 135349540 /nfs/dbraw/zinc/34/95/40/135349540.db2.gz HQJPANRVURFXRF-WDEREUQCSA-N 1 2 249.358 2.382 20 0 BEADLO C[C@H](c1nncn1C)[N@@H+]1CC[C@H]1c1ccccc1 ZINC000334320711 135352450 /nfs/dbraw/zinc/35/24/50/135352450.db2.gz WAAVAMFWEDMDDA-YPMHNXCESA-N 1 2 242.326 2.323 20 0 BEADLO C[C@H](c1nncn1C)[N@H+]1CC[C@H]1c1ccccc1 ZINC000334320711 135352451 /nfs/dbraw/zinc/35/24/51/135352451.db2.gz WAAVAMFWEDMDDA-YPMHNXCESA-N 1 2 242.326 2.323 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000334324628 135353143 /nfs/dbraw/zinc/35/31/43/135353143.db2.gz AJBCQOFNSRSMMT-VIFPVBQESA-N 1 2 229.274 2.195 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000334324628 135353145 /nfs/dbraw/zinc/35/31/45/135353145.db2.gz AJBCQOFNSRSMMT-VIFPVBQESA-N 1 2 229.274 2.195 20 0 BEADLO COc1c(O)cccc1C[N@@H+]1CC[C@](C)(F)C1 ZINC000334330258 135354851 /nfs/dbraw/zinc/35/48/51/135354851.db2.gz OIVCQVOQRXUGRX-ZDUSSCGKSA-N 1 2 239.290 2.335 20 0 BEADLO COc1c(O)cccc1C[N@H+]1CC[C@](C)(F)C1 ZINC000334330258 135354853 /nfs/dbraw/zinc/35/48/53/135354853.db2.gz OIVCQVOQRXUGRX-ZDUSSCGKSA-N 1 2 239.290 2.335 20 0 BEADLO O=C1OCC[C@@H]1[NH2+][C@@H]1CCC[C@@H]1c1ccccc1 ZINC000275640788 135367469 /nfs/dbraw/zinc/36/74/69/135367469.db2.gz RXOBDHXPNJRYJJ-MCIONIFRSA-N 1 2 245.322 2.228 20 0 BEADLO CC[C@H]([NH2+]Cc1ccnc(C)n1)c1nccs1 ZINC000080263841 135367738 /nfs/dbraw/zinc/36/77/38/135367738.db2.gz AUBOEEIPOBFLJH-NSHDSACASA-N 1 2 248.355 2.482 20 0 BEADLO F[C@H]1CCC[C@H]1Nc1cc[nH+]c2ccncc12 ZINC000334356585 135369260 /nfs/dbraw/zinc/36/92/60/135369260.db2.gz NTUPZGPLMXAJMP-GXFFZTMASA-N 1 2 231.274 2.354 20 0 BEADLO Cn1ncnc1C[N@@H+]1CCC[C@@H]1c1ccsc1 ZINC000334366693 135373817 /nfs/dbraw/zinc/37/38/17/135373817.db2.gz QCFMTKIBCGLXDT-LLVKDONJSA-N 1 2 248.355 2.214 20 0 BEADLO Cn1ncnc1C[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000334366693 135373819 /nfs/dbraw/zinc/37/38/19/135373819.db2.gz QCFMTKIBCGLXDT-LLVKDONJSA-N 1 2 248.355 2.214 20 0 BEADLO CO[C@@H]1CC[N@H+](Cc2cc(F)c(F)cc2F)C1 ZINC000334381337 135379635 /nfs/dbraw/zinc/37/96/35/135379635.db2.gz FIPKIMZWTTWTOY-SECBINFHSA-N 1 2 245.244 2.325 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2cc(F)c(F)cc2F)C1 ZINC000334381337 135379637 /nfs/dbraw/zinc/37/96/37/135379637.db2.gz FIPKIMZWTTWTOY-SECBINFHSA-N 1 2 245.244 2.325 20 0 BEADLO CC[C@H](C)CC(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000164503072 135386309 /nfs/dbraw/zinc/38/63/09/135386309.db2.gz HHGLVIWKRZIQRW-UWVGGRQHSA-N 1 2 223.320 2.413 20 0 BEADLO CC[C@@H]1C[N@H+](CC(=O)OC(C)(C)C)CCS1 ZINC000076071935 135391447 /nfs/dbraw/zinc/39/14/47/135391447.db2.gz IAPYWKJOMXTWTB-SNVBAGLBSA-N 1 2 245.388 2.156 20 0 BEADLO CC[C@@H]1C[N@@H+](CC(=O)OC(C)(C)C)CCS1 ZINC000076071935 135391448 /nfs/dbraw/zinc/39/14/48/135391448.db2.gz IAPYWKJOMXTWTB-SNVBAGLBSA-N 1 2 245.388 2.156 20 0 BEADLO C[C@H]1C[C@H]([NH2+]Cc2ccccn2)c2nccn21 ZINC000345353388 135470313 /nfs/dbraw/zinc/47/03/13/135470313.db2.gz KJOVJJVHLFPLDJ-JQWIXIFHSA-N 1 2 228.299 2.074 20 0 BEADLO CC(C)Oc1ccc(NCc2[nH]cc[nH+]2)cn1 ZINC000344824764 135803927 /nfs/dbraw/zinc/80/39/27/135803927.db2.gz JKWFRESGJBEHCX-UHFFFAOYSA-N 1 2 232.287 2.204 20 0 BEADLO CC1(F)CC(Nc2cc[nH+]c(C3CC3)n2)C1 ZINC000334780254 135810626 /nfs/dbraw/zinc/81/06/26/135810626.db2.gz IRUGBOCXFOAQEQ-UHFFFAOYSA-N 1 2 221.279 2.078 20 0 BEADLO Cc1cc(N2CCC3(CCOCC3)[C@H]2C)nc[nH+]1 ZINC000347876469 136017122 /nfs/dbraw/zinc/01/71/22/136017122.db2.gz KPBPBFQVYWROPC-GFCCVEGCSA-N 1 2 247.342 2.180 20 0 BEADLO FC(F)[C@H]1CCC[N@@H+]1C[C@H]1CCCCO1 ZINC000335314569 136032012 /nfs/dbraw/zinc/03/20/12/136032012.db2.gz HBEJQOOHXBMYQC-NXEZZACHSA-N 1 2 219.275 2.285 20 0 BEADLO FC(F)[C@H]1CCC[N@H+]1C[C@H]1CCCCO1 ZINC000335314569 136032013 /nfs/dbraw/zinc/03/20/13/136032013.db2.gz HBEJQOOHXBMYQC-NXEZZACHSA-N 1 2 219.275 2.285 20 0 BEADLO Cc1ccnc(C(=O)Nc2ccc(C)[nH+]c2C)n1 ZINC000348329491 136071235 /nfs/dbraw/zinc/07/12/35/136071235.db2.gz XZBGCDZUECZXBX-UHFFFAOYSA-N 1 2 242.282 2.049 20 0 BEADLO CC(C)n1cc(C[N@H+](C)[C@H]2CC2(C)C)nn1 ZINC000348357961 136072492 /nfs/dbraw/zinc/07/24/92/136072492.db2.gz PTFZLXGJJXDFKT-NSHDSACASA-N 1 2 222.336 2.089 20 0 BEADLO CC(C)n1cc(C[N@@H+](C)[C@H]2CC2(C)C)nn1 ZINC000348357961 136072493 /nfs/dbraw/zinc/07/24/93/136072493.db2.gz PTFZLXGJJXDFKT-NSHDSACASA-N 1 2 222.336 2.089 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)C1(C)CCCC1 ZINC000348333813 136075292 /nfs/dbraw/zinc/07/52/92/136075292.db2.gz ZDLKZNIRLGVJAW-UHFFFAOYSA-N 1 2 248.326 2.287 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)NCc1c[nH+]ccc1OC ZINC000348414421 136077522 /nfs/dbraw/zinc/07/75/22/136077522.db2.gz ROKMTZCOFBHCOR-ZYHUDNBSSA-N 1 2 248.326 2.143 20 0 BEADLO COc1cc(F)cc(C[N@@H+]2CC[C@H](F)C2)c1 ZINC000335397901 136093209 /nfs/dbraw/zinc/09/32/09/136093209.db2.gz GJXIBCWGRJSAQR-JTQLQIEISA-N 1 2 227.254 2.378 20 0 BEADLO COc1cc(F)cc(C[N@H+]2CC[C@H](F)C2)c1 ZINC000335397901 136093210 /nfs/dbraw/zinc/09/32/10/136093210.db2.gz GJXIBCWGRJSAQR-JTQLQIEISA-N 1 2 227.254 2.378 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2CCC(=O)C2)c(C)[nH+]1 ZINC000335551140 136098121 /nfs/dbraw/zinc/09/81/21/136098121.db2.gz MTQSIYZQPDWAIJ-SNVBAGLBSA-N 1 2 232.283 2.006 20 0 BEADLO CC(C)n1cc(C[NH+]2CC(C3CCC3)C2)nn1 ZINC000348709367 136116983 /nfs/dbraw/zinc/11/69/83/136116983.db2.gz MJXONEYLXYXOFU-UHFFFAOYSA-N 1 2 234.347 2.091 20 0 BEADLO CCc1[nH]cc(CNC(=O)C(C2CC2)C2CC2)[nH+]1 ZINC001646325584 1172731214 /nfs/dbraw/zinc/73/12/14/1172731214.db2.gz ODERUKFHIWVZCF-UHFFFAOYSA-N 1 2 247.342 2.025 20 0 BEADLO CCc1[nH]c(CNC(=O)C(C2CC2)C2CC2)c[nH+]1 ZINC001646325584 1172731205 /nfs/dbraw/zinc/73/12/05/1172731205.db2.gz ODERUKFHIWVZCF-UHFFFAOYSA-N 1 2 247.342 2.025 20 0 BEADLO C[C@H]([C@H](C)O)[NH+]1Cc2cc(F)c(F)cc2C1 ZINC001646448030 1172742162 /nfs/dbraw/zinc/74/21/62/1172742162.db2.gz DPEGSCPIHSLVFM-SFYZADRCSA-N 1 2 227.254 2.050 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2ccccc2F)[C@H]1C ZINC000156323721 397757950 /nfs/dbraw/zinc/75/79/50/397757950.db2.gz JSAGUKYBDWHQNO-WDEREUQCSA-N 1 2 223.291 2.435 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2ccccc2F)[C@H]1C ZINC000156323721 397757953 /nfs/dbraw/zinc/75/79/53/397757953.db2.gz JSAGUKYBDWHQNO-WDEREUQCSA-N 1 2 223.291 2.435 20 0 BEADLO Cc1cc(C)c(NC(=O)[C@H]2CCCOC2)c(C)[nH+]1 ZINC000170790180 397770088 /nfs/dbraw/zinc/77/00/88/397770088.db2.gz QFGMGWIJAFFUSY-LBPRGKRZSA-N 1 2 248.326 2.372 20 0 BEADLO Cc1nnsc1C[N@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000649577997 397966320 /nfs/dbraw/zinc/96/63/20/397966320.db2.gz BFRQDENIGIJIDR-CBAPKCEASA-N 1 2 229.324 2.026 20 0 BEADLO Cc1nnsc1C[N@@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000649577997 397966325 /nfs/dbraw/zinc/96/63/25/397966325.db2.gz BFRQDENIGIJIDR-CBAPKCEASA-N 1 2 229.324 2.026 20 0 BEADLO C[C@H]1CC[N@H+](Cc2cc3n(n2)CCC3)C[C@@H]1F ZINC000649578049 397966426 /nfs/dbraw/zinc/96/64/26/397966426.db2.gz DNCPGUXZWNXQKO-GWCFXTLKSA-N 1 2 237.322 2.009 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2cc3n(n2)CCC3)C[C@@H]1F ZINC000649578049 397966428 /nfs/dbraw/zinc/96/64/28/397966428.db2.gz DNCPGUXZWNXQKO-GWCFXTLKSA-N 1 2 237.322 2.009 20 0 BEADLO CC[C@H](CC(=O)NCc1[nH]c[nH+]c1C)C(C)C ZINC000267241837 397943568 /nfs/dbraw/zinc/94/35/68/397943568.db2.gz QQJHMHVZEAFPNN-LLVKDONJSA-N 1 2 237.347 2.407 20 0 BEADLO CC(C)Oc1ccnc(Cn2cc[nH+]c2)c1 ZINC000649553382 397948026 /nfs/dbraw/zinc/94/80/26/397948026.db2.gz NLKVIDQVRKWIHY-UHFFFAOYSA-N 1 2 217.272 2.114 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cc3n(n2)CCC3)C[C@H]1F ZINC000649578052 397967049 /nfs/dbraw/zinc/96/70/49/397967049.db2.gz DNCPGUXZWNXQKO-ZWNOBZJWSA-N 1 2 237.322 2.009 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cc3n(n2)CCC3)C[C@H]1F ZINC000649578052 397967052 /nfs/dbraw/zinc/96/70/52/397967052.db2.gz DNCPGUXZWNXQKO-ZWNOBZJWSA-N 1 2 237.322 2.009 20 0 BEADLO CO[C@@H]1C[C@@H]([N@H+](C)CC(F)F)C12CCC2 ZINC000650184797 397961571 /nfs/dbraw/zinc/96/15/71/397961571.db2.gz QQMWJUQEMFUVEW-RKDXNWHRSA-N 1 2 219.275 2.141 20 0 BEADLO CO[C@@H]1C[C@@H]([N@@H+](C)CC(F)F)C12CCC2 ZINC000650184797 397961575 /nfs/dbraw/zinc/96/15/75/397961575.db2.gz QQMWJUQEMFUVEW-RKDXNWHRSA-N 1 2 219.275 2.141 20 0 BEADLO Cc1cc(N2CC[C@@H](c3ccco3)C2)nc[nH+]1 ZINC000599937644 398045480 /nfs/dbraw/zinc/04/54/80/398045480.db2.gz IBIVCMBPUXZMEO-LLVKDONJSA-N 1 2 229.283 2.372 20 0 BEADLO CC(C)Oc1ccnc(C[N@@H+]2CC[C@H](F)C2)c1 ZINC000649621664 398005476 /nfs/dbraw/zinc/00/54/76/398005476.db2.gz JJDFWDBCHAZCRH-NSHDSACASA-N 1 2 238.306 2.413 20 0 BEADLO CC(C)Oc1ccnc(C[N@H+]2CC[C@H](F)C2)c1 ZINC000649621664 398005480 /nfs/dbraw/zinc/00/54/80/398005480.db2.gz JJDFWDBCHAZCRH-NSHDSACASA-N 1 2 238.306 2.413 20 0 BEADLO CC(C)Oc1cc[nH+]c(CN2CC[C@H](F)C2)c1 ZINC000649621664 398005483 /nfs/dbraw/zinc/00/54/83/398005483.db2.gz JJDFWDBCHAZCRH-NSHDSACASA-N 1 2 238.306 2.413 20 0 BEADLO CCc1cc[nH+]cc1NCc1c(C)cnn1C ZINC000650243354 398006262 /nfs/dbraw/zinc/00/62/62/398006262.db2.gz VTGWBVATHNLJOJ-UHFFFAOYSA-N 1 2 230.315 2.298 20 0 BEADLO COCc1cc[nH+]c(NCc2nccs2)c1 ZINC000650243887 398006320 /nfs/dbraw/zinc/00/63/20/398006320.db2.gz SYPDZVPORACAMI-UHFFFAOYSA-N 1 2 235.312 2.297 20 0 BEADLO Clc1nc(C[N@@H+]2CC[C@H]3C[C@H]32)cs1 ZINC000575597794 398017364 /nfs/dbraw/zinc/01/73/64/398017364.db2.gz SKBSYCXKOQFBAK-POYBYMJQSA-N 1 2 214.721 2.391 20 0 BEADLO Clc1nc(C[N@H+]2CC[C@H]3C[C@H]32)cs1 ZINC000575597794 398017369 /nfs/dbraw/zinc/01/73/69/398017369.db2.gz SKBSYCXKOQFBAK-POYBYMJQSA-N 1 2 214.721 2.391 20 0 BEADLO COC(=O)[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1ccco1 ZINC000274969434 398017745 /nfs/dbraw/zinc/01/77/45/398017745.db2.gz VZEWQDPQOPOZLD-JQWIXIFHSA-N 1 2 237.299 2.053 20 0 BEADLO COC(=O)[C@@H]1C[C@@H](C)CC[N@H+]1Cc1ccco1 ZINC000274969434 398017749 /nfs/dbraw/zinc/01/77/49/398017749.db2.gz VZEWQDPQOPOZLD-JQWIXIFHSA-N 1 2 237.299 2.053 20 0 BEADLO Cn1c[nH+]c2c1CCN(Cc1cccs1)C2 ZINC000376203491 398025597 /nfs/dbraw/zinc/02/55/97/398025597.db2.gz OLUAUCSKDBWRGQ-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO Cn1cnc2c1CC[N@H+](Cc1cccs1)C2 ZINC000376203491 398025601 /nfs/dbraw/zinc/02/56/01/398025601.db2.gz OLUAUCSKDBWRGQ-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO Cn1cnc2c1CC[N@@H+](Cc1cccs1)C2 ZINC000376203491 398025607 /nfs/dbraw/zinc/02/56/07/398025607.db2.gz OLUAUCSKDBWRGQ-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO FC1(F)CCC[N@H+](CC[C@H]2CCCO2)C1 ZINC000649694988 398042813 /nfs/dbraw/zinc/04/28/13/398042813.db2.gz CROCRFCHMRGJFF-SNVBAGLBSA-N 1 2 219.275 2.287 20 0 BEADLO FC1(F)CCC[N@@H+](CC[C@H]2CCCO2)C1 ZINC000649694988 398042817 /nfs/dbraw/zinc/04/28/17/398042817.db2.gz CROCRFCHMRGJFF-SNVBAGLBSA-N 1 2 219.275 2.287 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C1C[C@@H](C)C[C@H](C)C1 ZINC000272670070 397983063 /nfs/dbraw/zinc/98/30/63/397983063.db2.gz KLRQTTYOGZMKLT-UWVGGRQHSA-N 1 2 249.358 2.407 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+](C)Cc1nccn1C ZINC000272723212 397984017 /nfs/dbraw/zinc/98/40/17/397984017.db2.gz FTCONPUANRPZIP-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1ccc(F)cc1C[N@H+](C)Cc1nccn1C ZINC000272723212 397984020 /nfs/dbraw/zinc/98/40/20/397984020.db2.gz FTCONPUANRPZIP-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1ccc(F)cc1CN(C)Cc1[nH+]ccn1C ZINC000272723212 397984023 /nfs/dbraw/zinc/98/40/23/397984023.db2.gz FTCONPUANRPZIP-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO CCCNC(=O)CCC[N@@H+]1CCCC(F)(F)C1 ZINC000649695724 398043696 /nfs/dbraw/zinc/04/36/96/398043696.db2.gz GMDOTZOTGQNGTG-UHFFFAOYSA-N 1 2 248.317 2.024 20 0 BEADLO CCCNC(=O)CCC[N@H+]1CCCC(F)(F)C1 ZINC000649695724 398043698 /nfs/dbraw/zinc/04/36/98/398043698.db2.gz GMDOTZOTGQNGTG-UHFFFAOYSA-N 1 2 248.317 2.024 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cnc(C)s2)[C@@H](C)CO1 ZINC000649731036 398069433 /nfs/dbraw/zinc/06/94/33/398069433.db2.gz BOPYDDSZFIZMIN-ONGXEEELSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cnc(C)s2)[C@@H](C)CO1 ZINC000649731036 398069434 /nfs/dbraw/zinc/06/94/34/398069434.db2.gz BOPYDDSZFIZMIN-ONGXEEELSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1C[N@H+](Cc2c(C)noc2C)[C@@H](C)CO1 ZINC000649731511 398070891 /nfs/dbraw/zinc/07/08/91/398070891.db2.gz INGGTLSKVQLRQB-CABZTGNLSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2c(C)noc2C)[C@@H](C)CO1 ZINC000649731511 398070895 /nfs/dbraw/zinc/07/08/95/398070895.db2.gz INGGTLSKVQLRQB-CABZTGNLSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nc(C)cs2)[C@@H](C)CO1 ZINC000649734453 398074702 /nfs/dbraw/zinc/07/47/02/398074702.db2.gz WWGOVWJFBPSQMR-WDEREUQCSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nc(C)cs2)[C@@H](C)CO1 ZINC000649734453 398074705 /nfs/dbraw/zinc/07/47/05/398074705.db2.gz WWGOVWJFBPSQMR-WDEREUQCSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccncc2F)[C@@H](C)CO1 ZINC000649737062 398079461 /nfs/dbraw/zinc/07/94/61/398079461.db2.gz QFSGCTNNKKLUNK-JQWIXIFHSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccncc2F)[C@@H](C)CO1 ZINC000649737062 398079463 /nfs/dbraw/zinc/07/94/63/398079463.db2.gz QFSGCTNNKKLUNK-JQWIXIFHSA-N 1 2 238.306 2.220 20 0 BEADLO CCN(C#N)CC[N@@H+]1CC[C@H]1c1ccc(F)cc1 ZINC000602883464 398082075 /nfs/dbraw/zinc/08/20/75/398082075.db2.gz IHYYWYNWBFUTSB-AWEZNQCLSA-N 1 2 247.317 2.375 20 0 BEADLO CCN(C#N)CC[N@H+]1CC[C@H]1c1ccc(F)cc1 ZINC000602883464 398082077 /nfs/dbraw/zinc/08/20/77/398082077.db2.gz IHYYWYNWBFUTSB-AWEZNQCLSA-N 1 2 247.317 2.375 20 0 BEADLO CCN(CC)C(=O)Nc1cc[nH+]cc1C ZINC000121323189 398086771 /nfs/dbraw/zinc/08/67/71/398086771.db2.gz LSYAVGBWKRIOCR-UHFFFAOYSA-N 1 2 207.277 2.264 20 0 BEADLO Cc1occc1CNC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000649715715 398056588 /nfs/dbraw/zinc/05/65/88/398056588.db2.gz KIJFBUWNOCDROQ-JTQLQIEISA-N 1 2 247.298 2.052 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@@H+]1Cc1ncc(C)o1 ZINC000649716210 398057713 /nfs/dbraw/zinc/05/77/13/398057713.db2.gz XAUVZITWNFLLKQ-NSHDSACASA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@H+]1Cc1ncc(C)o1 ZINC000649716210 398057717 /nfs/dbraw/zinc/05/77/17/398057717.db2.gz XAUVZITWNFLLKQ-NSHDSACASA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H](C)[N@H+](C/C=C/Cl)CC(=O)OC ZINC000281170039 398058077 /nfs/dbraw/zinc/05/80/77/398058077.db2.gz ADZNPOMGOUJWBC-VUHVRTRXSA-N 1 2 219.712 2.012 20 0 BEADLO CC[C@@H](C)[N@@H+](C/C=C/Cl)CC(=O)OC ZINC000281170039 398058082 /nfs/dbraw/zinc/05/80/82/398058082.db2.gz ADZNPOMGOUJWBC-VUHVRTRXSA-N 1 2 219.712 2.012 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccon2)[C@H](CC)CO1 ZINC000649717801 398058848 /nfs/dbraw/zinc/05/88/48/398058848.db2.gz MNANRGNGRNRBDB-VXGBXAGGSA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccon2)[C@H](CC)CO1 ZINC000649717801 398058853 /nfs/dbraw/zinc/05/88/53/398058853.db2.gz MNANRGNGRNRBDB-VXGBXAGGSA-N 1 2 224.304 2.064 20 0 BEADLO CO[C@](C)(C(=O)Nc1cc[nH+]cc1C)C1CC1 ZINC000291706702 398099325 /nfs/dbraw/zinc/09/93/25/398099325.db2.gz OCTOFQBWMVMZKK-ZDUSSCGKSA-N 1 2 234.299 2.144 20 0 BEADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1ncc[nH]1)CCO2 ZINC000068984873 398099372 /nfs/dbraw/zinc/09/93/72/398099372.db2.gz RKVOZXNTILAXBB-LLVKDONJSA-N 1 2 247.273 2.162 20 0 BEADLO CCCn1cc[nH+]c1CCCN(C)C(=O)C1CC1 ZINC000192258013 398108277 /nfs/dbraw/zinc/10/82/77/398108277.db2.gz SWZQKIPJBRQLGP-UHFFFAOYSA-N 1 2 249.358 2.094 20 0 BEADLO Nc1nc(NC2CCC2)[nH+]c2ccccc12 ZINC000309424839 398096814 /nfs/dbraw/zinc/09/68/14/398096814.db2.gz BLJLIAFKQUBNFN-UHFFFAOYSA-N 1 2 214.272 2.176 20 0 BEADLO C[N@H+](CCF)Cc1ccnn1-c1ccccc1 ZINC000293653840 398116509 /nfs/dbraw/zinc/11/65/09/398116509.db2.gz NHJJBSICPOCQND-UHFFFAOYSA-N 1 2 233.290 2.274 20 0 BEADLO C[N@@H+](CCF)Cc1ccnn1-c1ccccc1 ZINC000293653840 398116512 /nfs/dbraw/zinc/11/65/12/398116512.db2.gz NHJJBSICPOCQND-UHFFFAOYSA-N 1 2 233.290 2.274 20 0 BEADLO CCn1cc[nH+]c1CN1C[C@H](C)OCC12CCC2 ZINC000649822813 398125059 /nfs/dbraw/zinc/12/50/59/398125059.db2.gz QBVWDAWARRQCDR-LBPRGKRZSA-N 1 2 249.358 2.046 20 0 BEADLO Cc1cnc(C[N@H+]2C[C@@H](C)OCC23CCC3)o1 ZINC000649823901 398126303 /nfs/dbraw/zinc/12/63/03/398126303.db2.gz PWPGALQOTPGIIB-LLVKDONJSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1cnc(C[N@@H+]2C[C@@H](C)OCC23CCC3)o1 ZINC000649823901 398126306 /nfs/dbraw/zinc/12/63/06/398126306.db2.gz PWPGALQOTPGIIB-LLVKDONJSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H](C)OCC23CCC3)no1 ZINC000649825625 398128057 /nfs/dbraw/zinc/12/80/57/398128057.db2.gz CXNSPEXJYXAIPO-LLVKDONJSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H](C)OCC23CCC3)no1 ZINC000649825625 398128059 /nfs/dbraw/zinc/12/80/59/398128059.db2.gz CXNSPEXJYXAIPO-LLVKDONJSA-N 1 2 236.315 2.126 20 0 BEADLO Fc1ccc2oc(C[NH+]3CCOCC3)cc2c1 ZINC000154530117 322864294 /nfs/dbraw/zinc/86/42/94/322864294.db2.gz UFZDBKFWLRTHTL-UHFFFAOYSA-N 1 2 235.258 2.404 20 0 BEADLO CC[C@@H](O)CNc1ccc([NH+]2CCCC2)cc1 ZINC000062996043 1172794713 /nfs/dbraw/zinc/79/47/13/1172794713.db2.gz UDVIEEAYKGJJBC-CQSZACIVSA-N 1 2 234.343 2.470 20 0 BEADLO Cc1noc([C@H](C)[N@@H+]2CCC(F)(F)[C@@H](C)C2)n1 ZINC000685590962 487560834 /nfs/dbraw/zinc/56/08/34/487560834.db2.gz CXYBUCXDTYAGQX-YUMQZZPRSA-N 1 2 245.273 2.416 20 0 BEADLO Cc1noc([C@H](C)[N@H+]2CCC(F)(F)[C@@H](C)C2)n1 ZINC000685590962 487560839 /nfs/dbraw/zinc/56/08/39/487560839.db2.gz CXYBUCXDTYAGQX-YUMQZZPRSA-N 1 2 245.273 2.416 20 0 BEADLO Cc1nc(NCCC(C)(C)C2CC2)nc(N)[nH+]1 ZINC000328557454 487562545 /nfs/dbraw/zinc/56/25/45/487562545.db2.gz BOCKWOJWBNZDOK-UHFFFAOYSA-N 1 2 235.335 2.000 20 0 BEADLO Cc1nc(N)nc(NCCC(C)(C)C2CC2)[nH+]1 ZINC000328557454 487562548 /nfs/dbraw/zinc/56/25/48/487562548.db2.gz BOCKWOJWBNZDOK-UHFFFAOYSA-N 1 2 235.335 2.000 20 0 BEADLO CCc1nnc([C@H](C)[NH2+]Cc2cccc(F)c2)[nH]1 ZINC001650890774 1172906965 /nfs/dbraw/zinc/90/69/65/1172906965.db2.gz RRTBYJJSETWSGY-VIFPVBQESA-N 1 2 248.305 2.357 20 0 BEADLO CCc1nnc([C@@H](C)[NH2+]Cc2cccc(F)c2)[nH]1 ZINC001650890773 1172907115 /nfs/dbraw/zinc/90/71/15/1172907115.db2.gz RRTBYJJSETWSGY-SECBINFHSA-N 1 2 248.305 2.357 20 0 BEADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1c(C)noc1C ZINC001651073998 1172921209 /nfs/dbraw/zinc/92/12/09/1172921209.db2.gz UNAHQMFUWGZZKM-SNVBAGLBSA-N 1 2 248.330 2.359 20 0 BEADLO CC(C)OCC[N@H+](C)Cc1nccn1C(F)F ZINC000079867214 167228357 /nfs/dbraw/zinc/22/83/57/167228357.db2.gz HMWADAYGMKGZOZ-UHFFFAOYSA-N 1 2 247.289 2.135 20 0 BEADLO CC(C)OCC[N@@H+](C)Cc1nccn1C(F)F ZINC000079867214 167228362 /nfs/dbraw/zinc/22/83/62/167228362.db2.gz HMWADAYGMKGZOZ-UHFFFAOYSA-N 1 2 247.289 2.135 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC000685833869 487581724 /nfs/dbraw/zinc/58/17/24/487581724.db2.gz NOWMQCCUZRSOHU-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000685833869 487581729 /nfs/dbraw/zinc/58/17/29/487581729.db2.gz NOWMQCCUZRSOHU-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO CC(C)(C)c1cc(NCCn2cc[nH+]c2)ncn1 ZINC000310893574 487595235 /nfs/dbraw/zinc/59/52/35/487595235.db2.gz LGCOJRHRBKXVRO-UHFFFAOYSA-N 1 2 245.330 2.083 20 0 BEADLO CC(C)c1nc(N2CCC(CCO)CC2)cc[nH+]1 ZINC000521965584 487605987 /nfs/dbraw/zinc/60/59/87/487605987.db2.gz QZIJJZHQHTXJRS-UHFFFAOYSA-N 1 2 249.358 2.199 20 0 BEADLO Cc1cc(NC(=O)NC2(C3CCC3)CC2)cc[nH+]1 ZINC000650106177 409584854 /nfs/dbraw/zinc/58/48/54/409584854.db2.gz LZGBHYRNOUKZLM-UHFFFAOYSA-N 1 2 245.326 2.266 20 0 BEADLO C[N@@H+](Cc1n[nH]c(=O)o1)CC1CCCCCC1 ZINC000660845739 409849732 /nfs/dbraw/zinc/84/97/32/409849732.db2.gz TTYPJKXXVKWNME-UHFFFAOYSA-N 1 2 239.319 2.177 20 0 BEADLO C[N@H+](Cc1n[nH]c(=O)o1)CC1CCCCCC1 ZINC000660845739 409849742 /nfs/dbraw/zinc/84/97/42/409849742.db2.gz TTYPJKXXVKWNME-UHFFFAOYSA-N 1 2 239.319 2.177 20 0 BEADLO C[C@H](C[N@H+](C)Cc1n[nH]c(=O)o1)c1ccccc1 ZINC000660850791 409867073 /nfs/dbraw/zinc/86/70/73/409867073.db2.gz YFFLPWHZDUTSDX-SNVBAGLBSA-N 1 2 247.298 2.011 20 0 BEADLO C[C@H](C[N@@H+](C)Cc1n[nH]c(=O)o1)c1ccccc1 ZINC000660850791 409867080 /nfs/dbraw/zinc/86/70/80/409867080.db2.gz YFFLPWHZDUTSDX-SNVBAGLBSA-N 1 2 247.298 2.011 20 0 BEADLO CC[C@@H](c1ccccc1)[N@H+](C)Cc1n[nH]c(=O)o1 ZINC000660850749 409868137 /nfs/dbraw/zinc/86/81/37/409868137.db2.gz XIIFDLOWTKWVEL-NSHDSACASA-N 1 2 247.298 2.358 20 0 BEADLO CC[C@@H](c1ccccc1)[N@@H+](C)Cc1n[nH]c(=O)o1 ZINC000660850749 409868147 /nfs/dbraw/zinc/86/81/47/409868147.db2.gz XIIFDLOWTKWVEL-NSHDSACASA-N 1 2 247.298 2.358 20 0 BEADLO CCc1nocc1C[N@H+]1C[C@H](CC)OC[C@@H]1C ZINC000660912255 409960245 /nfs/dbraw/zinc/96/02/45/409960245.db2.gz IHDYZMIGJSSYOE-JQWIXIFHSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1nocc1C[N@@H+]1C[C@H](CC)OC[C@@H]1C ZINC000660912255 409960252 /nfs/dbraw/zinc/96/02/52/409960252.db2.gz IHDYZMIGJSSYOE-JQWIXIFHSA-N 1 2 238.331 2.236 20 0 BEADLO Cc1nocc1C[N@H+]1C[C@@H](C)OCC12CCC2 ZINC000651974534 409964140 /nfs/dbraw/zinc/96/41/40/409964140.db2.gz HGVVPIVZNZQHOZ-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1nocc1C[N@@H+]1C[C@@H](C)OCC12CCC2 ZINC000651974534 409964143 /nfs/dbraw/zinc/96/41/43/409964143.db2.gz HGVVPIVZNZQHOZ-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1noc(C[N@@H+](C)[C@@H]2C[C@@H]2c2ccccc2)n1 ZINC000660926771 409974787 /nfs/dbraw/zinc/97/47/87/409974787.db2.gz RVQCKAKXXRTOHW-CHWSQXEVSA-N 1 2 243.310 2.366 20 0 BEADLO Cc1noc(C[N@H+](C)[C@@H]2C[C@@H]2c2ccccc2)n1 ZINC000660926771 409974793 /nfs/dbraw/zinc/97/47/93/409974793.db2.gz RVQCKAKXXRTOHW-CHWSQXEVSA-N 1 2 243.310 2.366 20 0 BEADLO CSc1cccnc1NCc1[nH+]ccn1C ZINC000651970697 409940716 /nfs/dbraw/zinc/94/07/16/409940716.db2.gz HFMZCFMXGFXIHN-UHFFFAOYSA-N 1 2 234.328 2.149 20 0 BEADLO Cc1nn(C)cc1[C@H](C)[NH2+][C@@H](C)C(F)F ZINC000389902638 410019286 /nfs/dbraw/zinc/01/92/86/410019286.db2.gz DHNRFIGCELQNQB-XPUUQOCRSA-N 1 2 217.263 2.033 20 0 BEADLO Cc1nn(C)cc1[C@H](C)[NH2+][C@H](C)C(F)F ZINC000389902633 410019363 /nfs/dbraw/zinc/01/93/63/410019363.db2.gz DHNRFIGCELQNQB-POYBYMJQSA-N 1 2 217.263 2.033 20 0 BEADLO CCc1cc(NCc2ccc(C)nc2)nc[nH+]1 ZINC000062054862 410100986 /nfs/dbraw/zinc/10/09/86/410100986.db2.gz QZBKBXXGDSAALY-UHFFFAOYSA-N 1 2 228.299 2.355 20 0 BEADLO CCc1cc[nH+]cc1NCC1=CCCOC1 ZINC000651979327 410113175 /nfs/dbraw/zinc/11/31/75/410113175.db2.gz JJEQLVWREAPZAB-UHFFFAOYSA-N 1 2 218.300 2.403 20 0 BEADLO CCc1cc[nH+]cc1NC1CC(OC)C1 ZINC000651979395 410113276 /nfs/dbraw/zinc/11/32/76/410113276.db2.gz OERRKQSGDULQIM-UHFFFAOYSA-N 1 2 206.289 2.233 20 0 BEADLO CCc1cc[nH+]cc1NC1CCOCC1 ZINC000651979518 410114667 /nfs/dbraw/zinc/11/46/67/410114667.db2.gz XHRDWVXFQRMNQG-UHFFFAOYSA-N 1 2 206.289 2.235 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)Cc1cccc(F)c1F ZINC000661082476 410114724 /nfs/dbraw/zinc/11/47/24/410114724.db2.gz AABMGEIHDNZWFQ-UHFFFAOYSA-N 1 2 237.253 2.320 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)Cc1cccc(F)c1F ZINC000661082476 410114730 /nfs/dbraw/zinc/11/47/30/410114730.db2.gz AABMGEIHDNZWFQ-UHFFFAOYSA-N 1 2 237.253 2.320 20 0 BEADLO CCc1cc[nH+]cc1N[C@@H](C)[C@@H]1CCOC1 ZINC000651979789 410115055 /nfs/dbraw/zinc/11/50/55/410115055.db2.gz JQGDJQFCUHXALQ-CMPLNLGQSA-N 1 2 220.316 2.481 20 0 BEADLO C[C@@H](NC(=O)[C@@H](C)C1CCC1)c1[nH]cc[nH+]1 ZINC000655401949 410204805 /nfs/dbraw/zinc/20/48/05/410204805.db2.gz HBWXKEJJJWZICJ-DTWKUNHWSA-N 1 2 221.304 2.023 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CCC[C@@H](F)C1)c1[nH]cc[nH+]1 ZINC000655401979 410206000 /nfs/dbraw/zinc/20/60/00/410206000.db2.gz ONGPOUKKEWMJCN-OPRDCNLKSA-N 1 2 239.294 2.115 20 0 BEADLO CCCC(C)(C)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000655402392 410208571 /nfs/dbraw/zinc/20/85/71/410208571.db2.gz FHLTWDHMESOVSR-SECBINFHSA-N 1 2 223.320 2.413 20 0 BEADLO c1coc(C2CC[NH+](Cc3ncccn3)CC2)c1 ZINC000661161135 410313020 /nfs/dbraw/zinc/31/30/20/410313020.db2.gz LEZWRDIROHRFIS-UHFFFAOYSA-N 1 2 243.310 2.449 20 0 BEADLO Cc1cn2ccc(C(=O)NCC(C)C)cc2[nH+]1 ZINC000071540723 410417528 /nfs/dbraw/zinc/41/75/28/410417528.db2.gz ZFPVQDKWHJXKLN-UHFFFAOYSA-N 1 2 231.299 2.029 20 0 BEADLO CC[C@H](CO)N(C)c1[nH+]ccc2c(N)cccc21 ZINC000663948297 410398178 /nfs/dbraw/zinc/39/81/78/410398178.db2.gz WOEPKLNAOVTALX-SNVBAGLBSA-N 1 2 245.326 2.024 20 0 BEADLO COCC1(Nc2cc(C)[nH+]cn2)CCCC1 ZINC000664161031 410470284 /nfs/dbraw/zinc/47/02/84/410470284.db2.gz MMXDRMQFEFWEAM-UHFFFAOYSA-N 1 2 221.304 2.156 20 0 BEADLO Cc1cc(Nc2cnn3c2CCCC3)nc(C)[nH+]1 ZINC000631487611 410581148 /nfs/dbraw/zinc/58/11/48/410581148.db2.gz WXWWTUQMWCTRIZ-UHFFFAOYSA-N 1 2 243.314 2.370 20 0 BEADLO COc1cccc2c(N[C@H]3C[C@H](O)C3)cc[nH+]c12 ZINC000664642530 410612891 /nfs/dbraw/zinc/61/28/91/410612891.db2.gz UXNQJHHJXAPBGJ-MGCOHNPYSA-N 1 2 244.294 2.179 20 0 BEADLO CC(C)(C)C[C@H](O)CNc1cccc[nH+]1 ZINC000227357064 166603787 /nfs/dbraw/zinc/60/37/87/166603787.db2.gz LIDNBTHXLVYWMY-JTQLQIEISA-N 1 2 208.305 2.291 20 0 BEADLO C[C@H](C(N)=O)[N@@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000661437827 410658692 /nfs/dbraw/zinc/65/86/92/410658692.db2.gz PLQHDUZPRLFJGL-PWSUYJOCSA-N 1 2 248.326 2.071 20 0 BEADLO C[C@H](C(N)=O)[N@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000661437827 410658696 /nfs/dbraw/zinc/65/86/96/410658696.db2.gz PLQHDUZPRLFJGL-PWSUYJOCSA-N 1 2 248.326 2.071 20 0 BEADLO CCCN(CC)C(=O)Cc1cn2c([nH+]1)CCCC2 ZINC000651083379 410787202 /nfs/dbraw/zinc/78/72/02/410787202.db2.gz XZJZSSALMOTZFN-UHFFFAOYSA-N 1 2 249.358 2.020 20 0 BEADLO CN(Cc1cccs1)c1cc(CO)cc[nH+]1 ZINC000040877816 410894571 /nfs/dbraw/zinc/89/45/71/410894571.db2.gz VHAWRCVZXLFWDO-UHFFFAOYSA-N 1 2 234.324 2.272 20 0 BEADLO CC[C@@H]1CCCCN1c1cc(CO)cc[nH+]1 ZINC000040877256 410895731 /nfs/dbraw/zinc/89/57/31/410895731.db2.gz LUCBTHSSLQVIGE-GFCCVEGCSA-N 1 2 220.316 2.343 20 0 BEADLO C[C@@H]1C[C@H](C)CN(c2cc(CO)cc[nH+]2)C1 ZINC000040864689 410896974 /nfs/dbraw/zinc/89/69/74/410896974.db2.gz LVYNJVMDHQUFNT-PHIMTYICSA-N 1 2 220.316 2.056 20 0 BEADLO CC(C)C[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000273821371 167011991 /nfs/dbraw/zinc/01/19/91/167011991.db2.gz XOCBGLMDCZJXIU-LBPRGKRZSA-N 1 2 230.315 2.140 20 0 BEADLO CC(C)C[NH2+]c1ccc2c(c1)NC(=O)[C@@H](C)O2 ZINC000036969353 167016716 /nfs/dbraw/zinc/01/67/16/167016716.db2.gz DPHNVXHXFSSTRE-SECBINFHSA-N 1 2 234.299 2.474 20 0 BEADLO CC(C)C[NH2+]c1ccc(OCCC(N)=O)cc1 ZINC000036934206 167017626 /nfs/dbraw/zinc/01/76/26/167017626.db2.gz ZTVQAFLXKNLWTN-UHFFFAOYSA-N 1 2 236.315 2.009 20 0 BEADLO CC(C)OC(=O)CC[N@@H+]1CCC[C@H]1C(F)F ZINC000353170794 167153460 /nfs/dbraw/zinc/15/34/60/167153460.db2.gz LLPDRPMOHHJHSB-VIFPVBQESA-N 1 2 235.274 2.058 20 0 BEADLO CC(C)OC(=O)CC[N@H+]1CCC[C@H]1C(F)F ZINC000353170794 167153466 /nfs/dbraw/zinc/15/34/66/167153466.db2.gz LLPDRPMOHHJHSB-VIFPVBQESA-N 1 2 235.274 2.058 20 0 BEADLO CC(C)OC(=O)[C@@H](C)[N@H+](C)CCC(F)(F)F ZINC000355895555 167168080 /nfs/dbraw/zinc/16/80/80/167168080.db2.gz WAARDUFTGUXDBG-MRVPVSSYSA-N 1 2 241.253 2.211 20 0 BEADLO CC(C)OC(=O)[C@@H](C)[N@@H+](C)CCC(F)(F)F ZINC000355895555 167168084 /nfs/dbraw/zinc/16/80/84/167168084.db2.gz WAARDUFTGUXDBG-MRVPVSSYSA-N 1 2 241.253 2.211 20 0 BEADLO Cc1c[nH+]cc(N[C@@H](C)Cc2cnccn2)c1 ZINC000651300922 410908793 /nfs/dbraw/zinc/90/87/93/410908793.db2.gz LLUJIFKPEMMXHG-NSHDSACASA-N 1 2 228.299 2.223 20 0 BEADLO CCCCCNC(=O)Cc1cn2ccccc2[nH+]1 ZINC000041287768 410915716 /nfs/dbraw/zinc/91/57/16/410915716.db2.gz TZQGVBMAHBCSEK-UHFFFAOYSA-N 1 2 245.326 2.183 20 0 BEADLO CC(C)Oc1ccc(C[NH+]2CCOCC2)cc1 ZINC000171028774 167294194 /nfs/dbraw/zinc/29/41/94/167294194.db2.gz XQRJEYUDLFSVBV-UHFFFAOYSA-N 1 2 235.327 2.306 20 0 BEADLO CC(C)[C@@H](C)C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000171971674 167348478 /nfs/dbraw/zinc/34/84/78/167348478.db2.gz UOZGKGCWAYWTDC-GFCCVEGCSA-N 1 2 249.358 2.339 20 0 BEADLO CC(C)[C@@H](C)C(=O)N[C@@H](c1[nH+]ccn1C)C1CC1 ZINC000341717018 167352947 /nfs/dbraw/zinc/35/29/47/167352947.db2.gz IBMLUYOSRKKPQS-ZYHUDNBSSA-N 1 2 249.358 2.280 20 0 BEADLO CC(C)[C@@H](C)CC(=O)Nc1ccc(N)[nH+]c1 ZINC000236660306 167357380 /nfs/dbraw/zinc/35/73/80/167357380.db2.gz MWGJNVFIGKTOBV-VIFPVBQESA-N 1 2 221.304 2.285 20 0 BEADLO CC(C)[C@@H](C)[NH2+]c1ccc(OCC(N)=O)cc1 ZINC000037041308 167385715 /nfs/dbraw/zinc/38/57/15/167385715.db2.gz JAWHPNDVKRXEKO-SNVBAGLBSA-N 1 2 236.315 2.007 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H]1C[C@H]1C1CCCC1 ZINC000651427302 411015421 /nfs/dbraw/zinc/01/54/21/411015421.db2.gz SIRYVZARLGPJAM-RYUDHWBXSA-N 1 2 247.342 2.161 20 0 BEADLO CCC[C@@H](C[NH2+][C@H](C)c1cn[nH]c1C)OC ZINC000651374153 410960108 /nfs/dbraw/zinc/96/01/08/410960108.db2.gz IAOIZIUCSVYMCQ-KOLCDFICSA-N 1 2 225.336 2.184 20 0 BEADLO CC[C@H](C)[C@@H](C[NH2+][C@@H](C)c1cn[nH]c1C)OC ZINC000651387847 410971016 /nfs/dbraw/zinc/97/10/16/410971016.db2.gz AYNWCZVYIFCRLA-OUJBWJOFSA-N 1 2 239.363 2.430 20 0 BEADLO CC[C@H](C)[C@@H](C[NH2+][C@H](C)c1cn[nH]c1C)OC ZINC000651387846 410971165 /nfs/dbraw/zinc/97/11/65/410971165.db2.gz AYNWCZVYIFCRLA-OPQQBVKSSA-N 1 2 239.363 2.430 20 0 BEADLO CC[C@H](C)[C@H](C[NH2+][C@H](C)c1cn[nH]c1C)OC ZINC000651387844 410971351 /nfs/dbraw/zinc/97/13/51/410971351.db2.gz AYNWCZVYIFCRLA-CWSCBRNRSA-N 1 2 239.363 2.430 20 0 BEADLO CC[C@H]1CN(c2cc(C)[nH+]cn2)[C@@H](CC)CO1 ZINC000651396754 410978890 /nfs/dbraw/zinc/97/88/90/410978890.db2.gz CBIVLTKMNRAJKJ-RYUDHWBXSA-N 1 2 235.331 2.179 20 0 BEADLO CC(C)[C@H]1N(C(=O)C=Cc2c[nH]c[nH+]2)CC1(C)C ZINC000294021196 167506486 /nfs/dbraw/zinc/50/64/86/167506486.db2.gz UABINJFSERHZPY-URWSZGRFSA-N 1 2 247.342 2.316 20 0 BEADLO COc1cc[nH+]cc1COc1ccc(CO)cc1 ZINC000310912863 411045005 /nfs/dbraw/zinc/04/50/05/411045005.db2.gz PNBQVMMCQNJPAR-UHFFFAOYSA-N 1 2 245.278 2.162 20 0 BEADLO CO[C@@H]([C@H](C)[NH2+][C@@H](C)c1cn[nH]c1C)C1CC1 ZINC000651463719 411048012 /nfs/dbraw/zinc/04/80/12/411048012.db2.gz LSUVMHPZNMROCR-FWDPORAESA-N 1 2 237.347 2.182 20 0 BEADLO C[C@H](COCC1CC1)Nc1cc[nH+]c(C2CC2)n1 ZINC000651458578 411041236 /nfs/dbraw/zinc/04/12/36/411041236.db2.gz KJKGBNVCVYSDJJ-SNVBAGLBSA-N 1 2 247.342 2.003 20 0 BEADLO COC[C@@H](CC(C)(C)C)[NH2+]Cc1cn[nH]c1C ZINC000651716671 411138480 /nfs/dbraw/zinc/13/84/80/411138480.db2.gz DTHWXASZRBRCLE-GFCCVEGCSA-N 1 2 239.363 2.259 20 0 BEADLO C[C@H](CC(=O)N1CC[C@@H]2CCC[C@H]21)n1cc[nH+]c1 ZINC000651781277 411143350 /nfs/dbraw/zinc/14/33/50/411143350.db2.gz GHJHNGRAYPTDSU-FRRDWIJNSA-N 1 2 247.342 2.235 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@@H](F)C2)c(F)c1 ZINC000651821074 411145965 /nfs/dbraw/zinc/14/59/65/411145965.db2.gz BNMRCDHOBZDYMZ-SNVBAGLBSA-N 1 2 227.254 2.378 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@@H](F)C2)c(F)c1 ZINC000651821074 411145966 /nfs/dbraw/zinc/14/59/66/411145966.db2.gz BNMRCDHOBZDYMZ-SNVBAGLBSA-N 1 2 227.254 2.378 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2coc(C)n2)CCS1 ZINC000659972548 411152049 /nfs/dbraw/zinc/15/20/49/411152049.db2.gz ALJAUAWARVDKSA-LLVKDONJSA-N 1 2 226.345 2.310 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2coc(C)n2)CCS1 ZINC000659972548 411152052 /nfs/dbraw/zinc/15/20/52/411152052.db2.gz ALJAUAWARVDKSA-LLVKDONJSA-N 1 2 226.345 2.310 20 0 BEADLO C[C@@H]1C[C@H]1C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000046106039 411156472 /nfs/dbraw/zinc/15/64/72/411156472.db2.gz ROOJFGJKYFBLOA-ZWNOBZJWSA-N 1 2 241.294 2.467 20 0 BEADLO CCc1cc(NCC(C)(C)COC)nc[nH+]1 ZINC000309339767 411102033 /nfs/dbraw/zinc/10/20/33/411102033.db2.gz WOHDHAWDJUQUEQ-UHFFFAOYSA-N 1 2 223.320 2.124 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2C[C@@H](C)O[C@H]2C)c1 ZINC000652067705 411103025 /nfs/dbraw/zinc/10/30/25/411103025.db2.gz DHWBWRQVOWLFIJ-JFGNBEQYSA-N 1 2 236.315 2.206 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](C)[C@@H]2CCOC2)c1 ZINC000652067657 411103053 /nfs/dbraw/zinc/10/30/53/411103053.db2.gz BZSRCFQOWDIFLY-CMPLNLGQSA-N 1 2 236.315 2.065 20 0 BEADLO Fc1cccnc1C[NH2+][C@H]1CCCn2nccc21 ZINC000657929228 411169067 /nfs/dbraw/zinc/16/90/67/411169067.db2.gz DKQOYSWNWDDHHE-NSHDSACASA-N 1 2 246.289 2.042 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1ccccc1Cl ZINC000048014508 411174002 /nfs/dbraw/zinc/17/40/02/411174002.db2.gz YMRNHQDDBLZANV-UHFFFAOYSA-N 1 2 211.692 2.361 20 0 BEADLO CC(=O)C[N@H+](C)Cc1ccccc1Cl ZINC000048014508 411174004 /nfs/dbraw/zinc/17/40/04/411174004.db2.gz YMRNHQDDBLZANV-UHFFFAOYSA-N 1 2 211.692 2.361 20 0 BEADLO FC(F)C[N@@H+]1CC[C@H](c2ccncc2)C1 ZINC000653680067 411174353 /nfs/dbraw/zinc/17/43/53/411174353.db2.gz DFYFZHCXEXISGP-JTQLQIEISA-N 1 2 212.243 2.136 20 0 BEADLO FC(F)C[N@H+]1CC[C@H](c2ccncc2)C1 ZINC000653680067 411174355 /nfs/dbraw/zinc/17/43/55/411174355.db2.gz DFYFZHCXEXISGP-JTQLQIEISA-N 1 2 212.243 2.136 20 0 BEADLO CCCCC[C@H]1CCC[N@@H+]1CCc1cnn[nH]1 ZINC000660013001 411174515 /nfs/dbraw/zinc/17/45/15/411174515.db2.gz OSNUYOSCRQUMIX-ZDUSSCGKSA-N 1 2 236.363 2.392 20 0 BEADLO CCCCC[C@H]1CCC[N@H+]1CCc1cnn[nH]1 ZINC000660013001 411174519 /nfs/dbraw/zinc/17/45/19/411174519.db2.gz OSNUYOSCRQUMIX-ZDUSSCGKSA-N 1 2 236.363 2.392 20 0 BEADLO CCOCCCCNc1nc[nH+]c(C)c1OC ZINC000656110372 411180345 /nfs/dbraw/zinc/18/03/45/411180345.db2.gz MOJQWMLZMQTMLO-UHFFFAOYSA-N 1 2 239.319 2.022 20 0 BEADLO COCCCCCNc1nc(C)[nH+]cc1C ZINC000656113172 411181359 /nfs/dbraw/zinc/18/13/59/411181359.db2.gz JSFROAAZXYOQNR-UHFFFAOYSA-N 1 2 223.320 2.322 20 0 BEADLO COc1c(C)[nH+]cnc1N(C)Cc1ccoc1C ZINC000656111803 411181820 /nfs/dbraw/zinc/18/18/20/411181820.db2.gz BAESQEVLFMFEMS-UHFFFAOYSA-N 1 2 247.298 2.331 20 0 BEADLO COc1c(C)[nH+]cnc1NCCC(F)(F)F ZINC000656132241 411184830 /nfs/dbraw/zinc/18/48/30/411184830.db2.gz PWJDLGCBOAPACD-UHFFFAOYSA-N 1 2 235.209 2.158 20 0 BEADLO CC[C@@H]1CCN(c2nc[nH+]c(C)c2OC)C1 ZINC000656144997 411185209 /nfs/dbraw/zinc/18/52/09/411185209.db2.gz JRGRHJMLNCUWBT-SNVBAGLBSA-N 1 2 221.304 2.030 20 0 BEADLO COc1c(C)[nH+]cnc1N1CC[C@@H](C2CC2)C1 ZINC000656152015 411186605 /nfs/dbraw/zinc/18/66/05/411186605.db2.gz BOGCBTLYRYKAEN-LLVKDONJSA-N 1 2 233.315 2.030 20 0 BEADLO COc1c(C)[nH+]cnc1N1CC[C@@H](C)[C@H](C)C1 ZINC000656152039 411187036 /nfs/dbraw/zinc/18/70/36/411187036.db2.gz CYPLTCRLIOQUBW-NXEZZACHSA-N 1 2 235.331 2.276 20 0 BEADLO CC[C@H]([NH2+]Cc1ccon1)c1ccncc1 ZINC000310002828 411194270 /nfs/dbraw/zinc/19/42/70/411194270.db2.gz FLABLFDDAOBZHJ-LBPRGKRZSA-N 1 2 217.272 2.311 20 0 BEADLO COc1c(C)[nH+]cnc1N1C[C@@H]2CCCC[C@@H]2C1 ZINC000656196065 411200769 /nfs/dbraw/zinc/20/07/69/411200769.db2.gz XPXBRJMBLNUULN-TXEJJXNPSA-N 1 2 247.342 2.420 20 0 BEADLO CC[C@](C)(CNc1nc[nH+]c(C)c1OC)OC ZINC000656194571 411201438 /nfs/dbraw/zinc/20/14/38/411201438.db2.gz KSZIVBIHYQAMLA-GFCCVEGCSA-N 1 2 239.319 2.021 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@H]1CCS[C@@H]1C ZINC000656203590 411208053 /nfs/dbraw/zinc/20/80/53/411208053.db2.gz KNLIDEJXIWZEBX-BDAKNGLRSA-N 1 2 239.344 2.100 20 0 BEADLO COCC1(CNc2[nH+]c(C)nc3[nH]ccc32)CC1 ZINC000656213469 411211649 /nfs/dbraw/zinc/21/16/49/411211649.db2.gz CQZIPDUVPIYOQP-UHFFFAOYSA-N 1 2 246.314 2.105 20 0 BEADLO CC[C@@H]1C[C@@H](Nc2cc(COC)cc[nH+]2)CO1 ZINC000658043399 411216712 /nfs/dbraw/zinc/21/67/12/411216712.db2.gz HEUSCOCZLSKIHD-VXGBXAGGSA-N 1 2 236.315 2.207 20 0 BEADLO C[C@H]1C[N@H+](Cc2c[nH]cn2)CC2(CCCCC2)O1 ZINC000653904702 411220548 /nfs/dbraw/zinc/22/05/48/411220548.db2.gz LKWMLASGLPGKKE-LBPRGKRZSA-N 1 2 249.358 2.333 20 0 BEADLO C[C@H]1C[N@@H+](Cc2c[nH]cn2)CC2(CCCCC2)O1 ZINC000653904702 411220550 /nfs/dbraw/zinc/22/05/50/411220550.db2.gz LKWMLASGLPGKKE-LBPRGKRZSA-N 1 2 249.358 2.333 20 0 BEADLO C[C@H]1C[N@H+](Cc2cnc[nH]2)CC2(CCCCC2)O1 ZINC000653904702 411220552 /nfs/dbraw/zinc/22/05/52/411220552.db2.gz LKWMLASGLPGKKE-LBPRGKRZSA-N 1 2 249.358 2.333 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cnc[nH]2)CC2(CCCCC2)O1 ZINC000653904702 411220554 /nfs/dbraw/zinc/22/05/54/411220554.db2.gz LKWMLASGLPGKKE-LBPRGKRZSA-N 1 2 249.358 2.333 20 0 BEADLO C[C@@H]1C[N@H+](Cc2c[nH]cn2)CC2(CCCCC2)O1 ZINC000653903960 411220648 /nfs/dbraw/zinc/22/06/48/411220648.db2.gz LKWMLASGLPGKKE-GFCCVEGCSA-N 1 2 249.358 2.333 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2c[nH]cn2)CC2(CCCCC2)O1 ZINC000653903960 411220649 /nfs/dbraw/zinc/22/06/49/411220649.db2.gz LKWMLASGLPGKKE-GFCCVEGCSA-N 1 2 249.358 2.333 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnc[nH]2)CC2(CCCCC2)O1 ZINC000653903960 411220651 /nfs/dbraw/zinc/22/06/51/411220651.db2.gz LKWMLASGLPGKKE-GFCCVEGCSA-N 1 2 249.358 2.333 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnc[nH]2)CC2(CCCCC2)O1 ZINC000653903960 411220652 /nfs/dbraw/zinc/22/06/52/411220652.db2.gz LKWMLASGLPGKKE-GFCCVEGCSA-N 1 2 249.358 2.333 20 0 BEADLO Cc1ccsc1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000652409538 411232198 /nfs/dbraw/zinc/23/21/98/411232198.db2.gz KBTDGFUGOMJAOH-UHFFFAOYSA-N 1 2 249.339 2.445 20 0 BEADLO C[C@@H]1CC=CC[C@H]1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000652412736 411234223 /nfs/dbraw/zinc/23/42/23/411234223.db2.gz WRDFTWNSYUQWLI-GHMZBOCLSA-N 1 2 247.342 2.363 20 0 BEADLO Cc1ccc(C[NH2+][C@@H]2CCn3ccnc32)o1 ZINC000393874795 411234307 /nfs/dbraw/zinc/23/43/07/411234307.db2.gz PSMLEGGROFIOLT-LLVKDONJSA-N 1 2 217.272 2.019 20 0 BEADLO COCc1ccccc1-c1[nH+]ccn1C ZINC000656371544 411236577 /nfs/dbraw/zinc/23/65/77/411236577.db2.gz HNEDFJAHVFDYJL-UHFFFAOYSA-N 1 2 202.257 2.234 20 0 BEADLO Cc1ncc(CNc2c[nH+]ccc2C)o1 ZINC000653466435 411285867 /nfs/dbraw/zinc/28/58/67/411285867.db2.gz IJXQYJNFDBHPJJ-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO CO[C@H](CNc1c[nH+]cc(C)c1)C1CC1 ZINC000653468687 411288951 /nfs/dbraw/zinc/28/89/51/411288951.db2.gz CFYMMHWZZKSVIS-GFCCVEGCSA-N 1 2 206.289 2.227 20 0 BEADLO CO[C@@H](CNc1c[nH+]cc(C)c1)C1CC1 ZINC000653468688 411288954 /nfs/dbraw/zinc/28/89/54/411288954.db2.gz CFYMMHWZZKSVIS-LBPRGKRZSA-N 1 2 206.289 2.227 20 0 BEADLO Cc1nn(C(C)C)cc1C[NH+]1CC(C(F)F)C1 ZINC000656691547 411329822 /nfs/dbraw/zinc/32/98/22/411329822.db2.gz KNCQEMHENVVZJX-UHFFFAOYSA-N 1 2 243.301 2.469 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@@H]1CCC[C@@H](C)O1 ZINC000658219556 411298563 /nfs/dbraw/zinc/29/85/63/411298563.db2.gz NJLDVFLUERWZLB-SCVCMEIPSA-N 1 2 237.347 2.326 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@H]1CCC[C@@H](C)O1 ZINC000658219554 411298982 /nfs/dbraw/zinc/29/89/82/411298982.db2.gz NJLDVFLUERWZLB-JFGNBEQYSA-N 1 2 237.347 2.326 20 0 BEADLO COc1cc(C[N@@H+]2CCc3ccccc3C2)on1 ZINC000659813066 411299926 /nfs/dbraw/zinc/29/99/26/411299926.db2.gz FUQHRJUXQFGBOH-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1cc(C[N@H+]2CCc3ccccc3C2)on1 ZINC000659813066 411299927 /nfs/dbraw/zinc/29/99/27/411299927.db2.gz FUQHRJUXQFGBOH-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO CC[S@@](=O)Cc1c[nH+]cn1Cc1ccccc1 ZINC000445539329 411304472 /nfs/dbraw/zinc/30/44/72/411304472.db2.gz MDKXTMORLPQIMX-QGZVFWFLSA-N 1 2 248.351 2.200 20 0 BEADLO CC1(NC(=O)c2ccc3[nH+]ccn3c2)CC=CC1 ZINC000654008917 411311443 /nfs/dbraw/zinc/31/14/43/411311443.db2.gz DWCYKAMVOKIBBF-UHFFFAOYSA-N 1 2 241.294 2.173 20 0 BEADLO Clc1cccc(CC[N@@H+]2CCO[C@@H]3C[C@@H]32)c1 ZINC000656630583 411311886 /nfs/dbraw/zinc/31/18/86/411311886.db2.gz ZTEISLFEQCRIMD-QWHCGFSZSA-N 1 2 237.730 2.356 20 0 BEADLO Clc1cccc(CC[N@H+]2CCO[C@@H]3C[C@@H]32)c1 ZINC000656630583 411311887 /nfs/dbraw/zinc/31/18/87/411311887.db2.gz ZTEISLFEQCRIMD-QWHCGFSZSA-N 1 2 237.730 2.356 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)[C@@H]2CC23CCC3)c2[nH+]ccn21 ZINC000654012561 411314881 /nfs/dbraw/zinc/31/48/81/411314881.db2.gz FWVNPXILRQTDQN-OUAUKWLOSA-N 1 2 245.326 2.195 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)[C@H]2CC23CCC3)c2[nH+]ccn21 ZINC000654012560 411315273 /nfs/dbraw/zinc/31/52/73/411315273.db2.gz FWVNPXILRQTDQN-MXWKQRLJSA-N 1 2 245.326 2.195 20 0 BEADLO CCOC1C[NH+](Cc2ccc3cnccc3c2)C1 ZINC000656657072 411317377 /nfs/dbraw/zinc/31/73/77/411317377.db2.gz FWAUPQOBOCIGQY-UHFFFAOYSA-N 1 2 242.322 2.456 20 0 BEADLO CCCN(C(=O)CCCn1cc[nH+]c1)C(C)C ZINC000654041169 411322496 /nfs/dbraw/zinc/32/24/96/411322496.db2.gz RKEQSGNYDIHZQQ-UHFFFAOYSA-N 1 2 237.347 2.310 20 0 BEADLO CCCN(C(=O)C[C@H](C)n1cc[nH+]c1)C(C)C ZINC000654043166 411323573 /nfs/dbraw/zinc/32/35/73/411323573.db2.gz XUGTXQVSIUIJSC-LBPRGKRZSA-N 1 2 237.347 2.481 20 0 BEADLO FC1(F)CCC[C@@H]1N[C@@H]1CCCn2cc[nH+]c21 ZINC000655769299 411251223 /nfs/dbraw/zinc/25/12/23/411251223.db2.gz XIYIHTBYHRGFPL-ZJUUUORDSA-N 1 2 241.285 2.495 20 0 BEADLO FC1(F)CCC[C@@H]1N[C@H]1CCCn2cc[nH+]c21 ZINC000655769297 411251292 /nfs/dbraw/zinc/25/12/92/411251292.db2.gz XIYIHTBYHRGFPL-UWVGGRQHSA-N 1 2 241.285 2.495 20 0 BEADLO CC[C@H](N[C@H]1CCCn2cc[nH+]c21)C(F)F ZINC000655771452 411253668 /nfs/dbraw/zinc/25/36/68/411253668.db2.gz LGGVOSWHBHXLIQ-IUCAKERBSA-N 1 2 229.274 2.351 20 0 BEADLO C[N@@H+](Cc1ncc[nH]1)C[C@@H]1CCC2(CCCC2)O1 ZINC000660143028 411258025 /nfs/dbraw/zinc/25/80/25/411258025.db2.gz PRAAFLWPHPYKSJ-LBPRGKRZSA-N 1 2 249.358 2.333 20 0 BEADLO C[N@H+](Cc1ncc[nH]1)C[C@@H]1CCC2(CCCC2)O1 ZINC000660143028 411258031 /nfs/dbraw/zinc/25/80/31/411258031.db2.gz PRAAFLWPHPYKSJ-LBPRGKRZSA-N 1 2 249.358 2.333 20 0 BEADLO Cc1c[nH+]cc(NCc2cc3n(n2)CCC3)c1 ZINC000656772528 411354909 /nfs/dbraw/zinc/35/49/09/411354909.db2.gz SEWSSJAJPXKHHM-UHFFFAOYSA-N 1 2 228.299 2.145 20 0 BEADLO Cn1cc(CNc2c[nH+]cc3c2CCCC3)cn1 ZINC000656777050 411355954 /nfs/dbraw/zinc/35/59/54/411355954.db2.gz YVMKXPYUNIJSCA-UHFFFAOYSA-N 1 2 242.326 2.306 20 0 BEADLO CC1(C[NH2+]c2ccc(-n3cccn3)cc2)COC1 ZINC000227521578 168046965 /nfs/dbraw/zinc/04/69/65/168046965.db2.gz SZTBYEQXEPPKHW-UHFFFAOYSA-N 1 2 243.310 2.321 20 0 BEADLO c1c(CNc2cccc[nH+]2)nnn1C1CCC1 ZINC000656768504 411362949 /nfs/dbraw/zinc/36/29/49/411362949.db2.gz XPKGQUKXYNERNY-UHFFFAOYSA-N 1 2 229.287 2.010 20 0 BEADLO Cc1ccc(NCc2cc3n(n2)CCC3)c[nH+]1 ZINC000656769789 411363636 /nfs/dbraw/zinc/36/36/36/411363636.db2.gz JHQBOUBCBLXEPY-UHFFFAOYSA-N 1 2 228.299 2.145 20 0 BEADLO Cc1cc[nH+]cc1NCc1cn(C2CCC2)nn1 ZINC000656771256 411365151 /nfs/dbraw/zinc/36/51/51/411365151.db2.gz KMHMZAVTUZPQAV-UHFFFAOYSA-N 1 2 243.314 2.319 20 0 BEADLO C(c1nnc(C2CC2)s1)[N@@H+]1CC[C@@H]2C[C@@H]2C1 ZINC000661968297 411337170 /nfs/dbraw/zinc/33/71/70/411337170.db2.gz XDMBBUQYHLVDMF-NXEZZACHSA-N 1 2 235.356 2.257 20 0 BEADLO C(c1nnc(C2CC2)s1)[N@H+]1CC[C@@H]2C[C@@H]2C1 ZINC000661968297 411337172 /nfs/dbraw/zinc/33/71/72/411337172.db2.gz XDMBBUQYHLVDMF-NXEZZACHSA-N 1 2 235.356 2.257 20 0 BEADLO CCCCc1nc(C[N@@H+]2CC[C@@H]3C[C@@H]3C2)no1 ZINC000661969460 411338215 /nfs/dbraw/zinc/33/82/15/411338215.db2.gz CJMDBUHFJVPEFT-GHMZBOCLSA-N 1 2 235.331 2.254 20 0 BEADLO CCCCc1nc(C[N@H+]2CC[C@@H]3C[C@@H]3C2)no1 ZINC000661969460 411338218 /nfs/dbraw/zinc/33/82/18/411338218.db2.gz CJMDBUHFJVPEFT-GHMZBOCLSA-N 1 2 235.331 2.254 20 0 BEADLO COC(C)(C)c1noc(Cc2c[nH+]ccc2C)n1 ZINC000656750829 411344115 /nfs/dbraw/zinc/34/41/15/411344115.db2.gz BATKZKPAZNFSLZ-UHFFFAOYSA-N 1 2 247.298 2.245 20 0 BEADLO CC1(CCNc2cc(NCC3CC3)nc[nH+]2)CC1 ZINC000359827270 168021990 /nfs/dbraw/zinc/02/19/90/168021990.db2.gz BIEHZGPFFYGTFX-UHFFFAOYSA-N 1 2 246.358 2.323 20 0 BEADLO CC1(CCNc2cc(NCC3CC3)[nH+]cn2)CC1 ZINC000359827270 168021993 /nfs/dbraw/zinc/02/19/93/168021993.db2.gz BIEHZGPFFYGTFX-UHFFFAOYSA-N 1 2 246.358 2.323 20 0 BEADLO CC1(CNc2cc(NCC3(C)CC3)[nH+]cn2)CC1 ZINC000337211452 168027663 /nfs/dbraw/zinc/02/76/63/168027663.db2.gz DLWLXVPRMCMWSW-UHFFFAOYSA-N 1 2 246.358 2.323 20 0 BEADLO CC1(CNc2cc[nH+]c3ccncc23)COC1 ZINC000268015618 168048743 /nfs/dbraw/zinc/04/87/43/168048743.db2.gz XJTQJYDMVJIYAD-UHFFFAOYSA-N 1 2 229.283 2.078 20 0 BEADLO CC1=C(C)C[N@H+](Cc2nnc(C(C)C)[nH]2)CC1 ZINC000292657441 168084552 /nfs/dbraw/zinc/08/45/52/168084552.db2.gz BRGHWBIYSVZSIN-UHFFFAOYSA-N 1 2 234.347 2.470 20 0 BEADLO CC1=C(C)C[N@@H+](Cc2nnc(C(C)C)[nH]2)CC1 ZINC000292657441 168084554 /nfs/dbraw/zinc/08/45/54/168084554.db2.gz BRGHWBIYSVZSIN-UHFFFAOYSA-N 1 2 234.347 2.470 20 0 BEADLO CC1=C(C)C[N@H+](Cc2cn(C(C)C)nn2)CC1 ZINC000289739291 168084613 /nfs/dbraw/zinc/08/46/13/168084613.db2.gz PHGUNYAZDPFJCY-UHFFFAOYSA-N 1 2 234.347 2.401 20 0 BEADLO CC1=C(C)C[N@@H+](Cc2cn(C(C)C)nn2)CC1 ZINC000289739291 168084614 /nfs/dbraw/zinc/08/46/14/168084614.db2.gz PHGUNYAZDPFJCY-UHFFFAOYSA-N 1 2 234.347 2.401 20 0 BEADLO CC1=C(C)C[N@H+](Cc2ncnn2CC(C)C)CC1 ZINC000280849355 168085088 /nfs/dbraw/zinc/08/50/88/168085088.db2.gz XWWLJFRUSKOVSJ-UHFFFAOYSA-N 1 2 248.374 2.476 20 0 BEADLO CC1=C(C)C[N@@H+](Cc2ncnn2CC(C)C)CC1 ZINC000280849355 168085090 /nfs/dbraw/zinc/08/50/90/168085090.db2.gz XWWLJFRUSKOVSJ-UHFFFAOYSA-N 1 2 248.374 2.476 20 0 BEADLO CC1=C(C)C[N@H+]([C@H](C)c2nnnn2C2CC2)CC1 ZINC000361612995 168086372 /nfs/dbraw/zinc/08/63/72/168086372.db2.gz WJSIBSAVLRARLR-LLVKDONJSA-N 1 2 247.346 2.111 20 0 BEADLO CC1=C(C)C[N@@H+]([C@H](C)c2nnnn2C2CC2)CC1 ZINC000361612995 168086374 /nfs/dbraw/zinc/08/63/74/168086374.db2.gz WJSIBSAVLRARLR-LLVKDONJSA-N 1 2 247.346 2.111 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2CCC=C(C)C2)no1 ZINC000289457607 168099143 /nfs/dbraw/zinc/09/91/43/168099143.db2.gz VLSUHMWCWBMQNX-VIFPVBQESA-N 1 2 207.277 2.091 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2CCC=C(C)C2)no1 ZINC000289457607 168099145 /nfs/dbraw/zinc/09/91/45/168099145.db2.gz VLSUHMWCWBMQNX-VIFPVBQESA-N 1 2 207.277 2.091 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2CCC=C(C)C2)no1 ZINC000289457604 168100304 /nfs/dbraw/zinc/10/03/04/168100304.db2.gz VLSUHMWCWBMQNX-SECBINFHSA-N 1 2 207.277 2.091 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2CCC=C(C)C2)no1 ZINC000289457604 168100305 /nfs/dbraw/zinc/10/03/05/168100305.db2.gz VLSUHMWCWBMQNX-SECBINFHSA-N 1 2 207.277 2.091 20 0 BEADLO CC1=CC[N@H+](Cc2ncnn2C(C)(C)C)CC1 ZINC000283039877 168116157 /nfs/dbraw/zinc/11/61/57/168116157.db2.gz IHXSRMUTXWJKGG-UHFFFAOYSA-N 1 2 234.347 2.185 20 0 BEADLO CC1=CC[N@@H+](Cc2ncnn2C(C)(C)C)CC1 ZINC000283039877 168116159 /nfs/dbraw/zinc/11/61/59/168116159.db2.gz IHXSRMUTXWJKGG-UHFFFAOYSA-N 1 2 234.347 2.185 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2CC=C(C)CC2)no1 ZINC000289335852 168116638 /nfs/dbraw/zinc/11/66/38/168116638.db2.gz INCLBXDHULHRSD-VIFPVBQESA-N 1 2 207.277 2.091 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2CC=C(C)CC2)no1 ZINC000289335852 168116634 /nfs/dbraw/zinc/11/66/34/168116634.db2.gz INCLBXDHULHRSD-VIFPVBQESA-N 1 2 207.277 2.091 20 0 BEADLO Cc1nnc(C[N@@H+]2CC(C)=C[C@@H](C)C2)s1 ZINC000334247120 168123086 /nfs/dbraw/zinc/12/30/86/168123086.db2.gz JWVUSSBJWHLUDT-MRVPVSSYSA-N 1 2 223.345 2.245 20 0 BEADLO Cc1nnc(C[N@H+]2CC(C)=C[C@@H](C)C2)s1 ZINC000334247120 168123089 /nfs/dbraw/zinc/12/30/89/168123089.db2.gz JWVUSSBJWHLUDT-MRVPVSSYSA-N 1 2 223.345 2.245 20 0 BEADLO CC1=C[C@H](C)C[C@@H](C[N@H+](C)Cc2nnc[nH]2)C1 ZINC000290312036 168127935 /nfs/dbraw/zinc/12/79/35/168127935.db2.gz AQRQFTQLOINFNP-CMPLNLGQSA-N 1 2 234.347 2.229 20 0 BEADLO CC1=C[C@H](C)C[C@@H](C[N@@H+](C)Cc2nnc[nH]2)C1 ZINC000290312036 168127936 /nfs/dbraw/zinc/12/79/36/168127936.db2.gz AQRQFTQLOINFNP-CMPLNLGQSA-N 1 2 234.347 2.229 20 0 BEADLO CC1CCC(CNC(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000283486404 168153238 /nfs/dbraw/zinc/15/32/38/168153238.db2.gz NTXPTIUGWRAXRJ-VOTSOKGWSA-N 1 2 247.342 2.365 20 0 BEADLO CC(C)c1cccc(C[N@@H+]2CCN(C)C(=O)C2)c1 ZINC000659946156 411389166 /nfs/dbraw/zinc/38/91/66/411389166.db2.gz FRXQWMAEVPJNOQ-UHFFFAOYSA-N 1 2 246.354 2.084 20 0 BEADLO CC(C)c1cccc(C[N@H+]2CCN(C)C(=O)C2)c1 ZINC000659946156 411389169 /nfs/dbraw/zinc/38/91/69/411389169.db2.gz FRXQWMAEVPJNOQ-UHFFFAOYSA-N 1 2 246.354 2.084 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cc(C)nc(C)n2)C[C@@H](C)O1 ZINC000659918111 411382691 /nfs/dbraw/zinc/38/26/91/411382691.db2.gz JBZZNDQYVMDMAH-RISCZKNCSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cc(C)nc(C)n2)C[C@@H](C)O1 ZINC000659918111 411382693 /nfs/dbraw/zinc/38/26/93/411382693.db2.gz JBZZNDQYVMDMAH-RISCZKNCSA-N 1 2 249.358 2.093 20 0 BEADLO CCC(=O)OCc1c[nH+]ccc1OC(C)C ZINC000286900141 168249605 /nfs/dbraw/zinc/24/96/05/168249605.db2.gz JNQYOJKBAWGNKD-UHFFFAOYSA-N 1 2 223.272 2.322 20 0 BEADLO CCC(C)(C)CNc1[nH+]cnc2c1cnn2C ZINC000189997329 168282872 /nfs/dbraw/zinc/28/28/72/168282872.db2.gz OJYHLKNRWQQJJO-UHFFFAOYSA-N 1 2 233.319 2.211 20 0 BEADLO CCC(C)(C)N(C)C(=O)[C@@H]1CCn2cc[nH+]c2C1 ZINC000336543361 168285097 /nfs/dbraw/zinc/28/50/97/168285097.db2.gz QUXXUACFILDFLW-LLVKDONJSA-N 1 2 249.358 2.093 20 0 BEADLO CCC(C)(C)NC(=O)c1ccc2[nH+]ccn2c1 ZINC000057829090 168296082 /nfs/dbraw/zinc/29/60/82/168296082.db2.gz OLHODNOIGFYWBC-UHFFFAOYSA-N 1 2 231.299 2.253 20 0 BEADLO Cc1nc(N[C@H]2CCS[C@@H]2C)cc[nH+]1 ZINC000306676180 411456196 /nfs/dbraw/zinc/45/61/96/411456196.db2.gz VIUBBWXFVMYCQD-APPZFPTMSA-N 1 2 209.318 2.091 20 0 BEADLO CCOC[C@H]1CCCC[N@@H+]1CC(F)F ZINC000657140205 411409912 /nfs/dbraw/zinc/40/99/12/411409912.db2.gz DFWLUPZQBHCKSE-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CCOC[C@H]1CCCC[N@H+]1CC(F)F ZINC000657140205 411409916 /nfs/dbraw/zinc/40/99/16/411409916.db2.gz DFWLUPZQBHCKSE-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO FC1(CNc2cc3cc[nH]c3c[nH+]2)CC1 ZINC000653500093 411414227 /nfs/dbraw/zinc/41/42/27/411414227.db2.gz FECCSGODVYMWJD-UHFFFAOYSA-N 1 2 205.236 2.477 20 0 BEADLO Cn1ncc(C2CC2)c1C[NH2+]Cc1nccs1 ZINC000657318570 411462405 /nfs/dbraw/zinc/46/24/05/411462405.db2.gz RUYWMNYFHLIFBJ-UHFFFAOYSA-N 1 2 248.355 2.044 20 0 BEADLO COc1ccc(N[C@H](C)c2cncnc2C)[nH+]c1 ZINC000655743552 411447034 /nfs/dbraw/zinc/44/70/34/411447034.db2.gz GYBZLUJAJRWOEN-SNVBAGLBSA-N 1 2 244.298 2.362 20 0 BEADLO COc1ccc(N[C@@H](C)c2cncnc2C)[nH+]c1 ZINC000655743550 411447286 /nfs/dbraw/zinc/44/72/86/411447286.db2.gz GYBZLUJAJRWOEN-JTQLQIEISA-N 1 2 244.298 2.362 20 0 BEADLO CCc1nc(CNCc2[nH]cc(C)[nH+]2)cs1 ZINC000657354280 411473933 /nfs/dbraw/zinc/47/39/33/411473933.db2.gz RJCYZWPGBSKVQO-UHFFFAOYSA-N 1 2 236.344 2.027 20 0 BEADLO CCC[C@H]1CCC[C@H]1C(=O)NCCn1cc[nH+]c1 ZINC000294624007 411474184 /nfs/dbraw/zinc/47/41/84/411474184.db2.gz WQZCQDXQTJMDHQ-QWHCGFSZSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cn(C)cn2)on1 ZINC000659847593 411476463 /nfs/dbraw/zinc/47/64/63/411476463.db2.gz YMJXIROMKXMZLJ-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cn(C)cn2)on1 ZINC000659847593 411476465 /nfs/dbraw/zinc/47/64/65/411476465.db2.gz YMJXIROMKXMZLJ-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H](C)OC(C)(C)C2)c(C)o1 ZINC000659855885 411478647 /nfs/dbraw/zinc/47/86/47/411478647.db2.gz ODFZPXIDAJJDLE-VIFPVBQESA-N 1 2 238.331 2.291 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H](C)OC(C)(C)C2)c(C)o1 ZINC000659855885 411478649 /nfs/dbraw/zinc/47/86/49/411478649.db2.gz ODFZPXIDAJJDLE-VIFPVBQESA-N 1 2 238.331 2.291 20 0 BEADLO CCc1cc(CNCc2[nH+]ccn2C(C)C)on1 ZINC000657372518 411485192 /nfs/dbraw/zinc/48/51/92/411485192.db2.gz GWDKMRVHQPUNPP-UHFFFAOYSA-N 1 2 248.330 2.304 20 0 BEADLO CCc1cc(C[NH2+]Cc2nccn2C(C)C)on1 ZINC000657372518 411485193 /nfs/dbraw/zinc/48/51/93/411485193.db2.gz GWDKMRVHQPUNPP-UHFFFAOYSA-N 1 2 248.330 2.304 20 0 BEADLO CC(C)c1cccc(C[N@@H+]2CCOC[C@H]2CO)c1 ZINC000660419567 411492053 /nfs/dbraw/zinc/49/20/53/411492053.db2.gz JMOXRRADIKARCQ-OAHLLOKOSA-N 1 2 249.354 2.003 20 0 BEADLO CC(C)c1cccc(C[N@H+]2CCOC[C@H]2CO)c1 ZINC000660419567 411492054 /nfs/dbraw/zinc/49/20/54/411492054.db2.gz JMOXRRADIKARCQ-OAHLLOKOSA-N 1 2 249.354 2.003 20 0 BEADLO CC[C@@H]1C[C@H](Nc2ccc(OC)c[nH+]2)CO1 ZINC000657402064 411496702 /nfs/dbraw/zinc/49/67/02/411496702.db2.gz LARKIUZJCDZAFC-VHSXEESVSA-N 1 2 222.288 2.070 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)NCC[C@H](C)F)ccn12 ZINC000655112766 411497591 /nfs/dbraw/zinc/49/75/91/411497591.db2.gz ICHZOZVRTISHFG-VIFPVBQESA-N 1 2 249.289 2.121 20 0 BEADLO CCOc1ncccc1NCc1[nH]cc(C)[nH+]1 ZINC000657412364 411498890 /nfs/dbraw/zinc/49/88/90/411498890.db2.gz DJAKAPXGAXMRCQ-UHFFFAOYSA-N 1 2 232.287 2.124 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nc(C)oc2C)C[C@@H](C)O1 ZINC000659920947 411499121 /nfs/dbraw/zinc/49/91/21/411499121.db2.gz YCFFLJROJGXADB-BXKDBHETSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nc(C)oc2C)C[C@@H](C)O1 ZINC000659920947 411499123 /nfs/dbraw/zinc/49/91/23/411499123.db2.gz YCFFLJROJGXADB-BXKDBHETSA-N 1 2 238.331 2.291 20 0 BEADLO CSc1ccc(NCc2[nH]cc(C)[nH+]2)cn1 ZINC000657413801 411499652 /nfs/dbraw/zinc/49/96/52/411499652.db2.gz SOJMCTBPXKBXBK-UHFFFAOYSA-N 1 2 234.328 2.447 20 0 BEADLO CSc1cc(C[NH2+]Cc2nc(C)c[nH]2)ccn1 ZINC000657425254 411504660 /nfs/dbraw/zinc/50/46/60/411504660.db2.gz OBAQUBOZSHILBO-UHFFFAOYSA-N 1 2 248.355 2.125 20 0 BEADLO CCc1nn(C)cc1NCc1[nH+]ccn1C(C)C ZINC000657425303 411505141 /nfs/dbraw/zinc/50/51/41/411505141.db2.gz HAHBJCDHJYVUGR-UHFFFAOYSA-N 1 2 247.346 2.372 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1NC(=O)CCCn1cc[nH+]c1 ZINC000655176776 411511228 /nfs/dbraw/zinc/51/12/28/411511228.db2.gz CTAKRHQZHNFISN-CHWSQXEVSA-N 1 2 249.358 2.214 20 0 BEADLO Cc1c[nH]c(CNc2ccn(C(C)C)n2)[nH+]1 ZINC000657455149 411515596 /nfs/dbraw/zinc/51/55/96/411515596.db2.gz POAOZEFPTLVBRE-UHFFFAOYSA-N 1 2 219.292 2.108 20 0 BEADLO Cc1[nH]c(CNc2cc(C3CC3)n(C)n2)[nH+]c1C ZINC000657469915 411521912 /nfs/dbraw/zinc/52/19/12/411521912.db2.gz CGOMWJQHMJLMCZ-UHFFFAOYSA-N 1 2 245.330 2.250 20 0 BEADLO CCCn1nccc1C[NH2+][C@H](CC)C(F)F ZINC000657477583 411525745 /nfs/dbraw/zinc/52/57/45/411525745.db2.gz WHCRXMXAWFLWFX-SNVBAGLBSA-N 1 2 231.290 2.426 20 0 BEADLO CC[C@@](C)(NCc1cn(C)c[nH+]1)C(F)(F)F ZINC000660084720 411535155 /nfs/dbraw/zinc/53/51/55/411535155.db2.gz YGJCXFQQTHFJQE-SECBINFHSA-N 1 2 235.253 2.241 20 0 BEADLO COc1c(C)cccc1C[NH2+]Cc1[nH]ncc1C ZINC000655833573 411529839 /nfs/dbraw/zinc/52/98/39/411529839.db2.gz RXFDVUGDNAOMGI-UHFFFAOYSA-N 1 2 245.326 2.325 20 0 BEADLO COc1c(C)cccc1C[NH2+]Cc1n[nH]cc1C ZINC000655833573 411529841 /nfs/dbraw/zinc/52/98/41/411529841.db2.gz RXFDVUGDNAOMGI-UHFFFAOYSA-N 1 2 245.326 2.325 20 0 BEADLO CCn1cc([C@H](C)[NH2+]Cc2nc(C)c(C)[nH]2)cn1 ZINC000657485052 411530119 /nfs/dbraw/zinc/53/01/19/411530119.db2.gz JRHYIZCKUUHNCJ-NSHDSACASA-N 1 2 247.346 2.094 20 0 BEADLO CCn1cc([C@H](C)NCc2[nH]c(C)c(C)[nH+]2)cn1 ZINC000657485052 411530121 /nfs/dbraw/zinc/53/01/21/411530121.db2.gz JRHYIZCKUUHNCJ-NSHDSACASA-N 1 2 247.346 2.094 20 0 BEADLO CC[N@@H+]1CCO[C@H](c2cccc(F)c2)C1 ZINC000066847471 170006762 /nfs/dbraw/zinc/00/67/62/170006762.db2.gz VVZBHDXBIPJLFL-LBPRGKRZSA-N 1 2 209.264 2.219 20 0 BEADLO CC[N@H+]1CCO[C@H](c2cccc(F)c2)C1 ZINC000066847471 170006764 /nfs/dbraw/zinc/00/67/64/170006764.db2.gz VVZBHDXBIPJLFL-LBPRGKRZSA-N 1 2 209.264 2.219 20 0 BEADLO CCc1ccncc1NCc1[nH]cc(C)[nH+]1 ZINC000657502273 411539634 /nfs/dbraw/zinc/53/96/34/411539634.db2.gz KZECBEFROQARCS-UHFFFAOYSA-N 1 2 216.288 2.288 20 0 BEADLO CC[N@@H+]1C[C@H]([NH2+]CCCCCSC)[C@@H](C)C1 ZINC000336776054 170034529 /nfs/dbraw/zinc/03/45/29/170034529.db2.gz DOCLVNIPELEXCL-STQMWFEESA-N 1 2 244.448 2.450 20 0 BEADLO Cn1cnc(C[N@@H+]2CCC[C@H]2c2cccnc2)c1 ZINC000660136961 411543717 /nfs/dbraw/zinc/54/37/17/411543717.db2.gz DXOQKWZFMKVDTE-AWEZNQCLSA-N 1 2 242.326 2.152 20 0 BEADLO Cn1cnc(C[N@H+]2CCC[C@H]2c2cccnc2)c1 ZINC000660136961 411543719 /nfs/dbraw/zinc/54/37/19/411543719.db2.gz DXOQKWZFMKVDTE-AWEZNQCLSA-N 1 2 242.326 2.152 20 0 BEADLO Cc1cc(C[NH2+][C@@H]2C[C@@H](C)n3ncnc32)cs1 ZINC000657568416 411553032 /nfs/dbraw/zinc/55/30/32/411553032.db2.gz GFNIJYQKJBGIGX-LDYMZIIASA-N 1 2 248.355 2.444 20 0 BEADLO C[C@@H]1C[C@H]([NH2+]Cc2cccc(F)c2)c2ncnn21 ZINC000657567096 411553051 /nfs/dbraw/zinc/55/30/51/411553051.db2.gz JEGJOYNMQFLPMQ-SKDRFNHKSA-N 1 2 246.289 2.213 20 0 BEADLO C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2F)c2ncnn21 ZINC000657566957 411553079 /nfs/dbraw/zinc/55/30/79/411553079.db2.gz GFKIBMXLMOIVRZ-BXKDBHETSA-N 1 2 246.289 2.213 20 0 BEADLO COc1cc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)sn1 ZINC000660222625 411556380 /nfs/dbraw/zinc/55/63/80/411556380.db2.gz WTDFVZJIRQIVLY-SCZZXKLOSA-N 1 2 244.335 2.332 20 0 BEADLO COc1cc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)sn1 ZINC000660222625 411556381 /nfs/dbraw/zinc/55/63/81/411556381.db2.gz WTDFVZJIRQIVLY-SCZZXKLOSA-N 1 2 244.335 2.332 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)nc(C)n1 ZINC000660220430 411554846 /nfs/dbraw/zinc/55/48/46/411554846.db2.gz IKLMVONHSAFLAV-NOZJJQNGSA-N 1 2 237.322 2.273 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)nc(C)n1 ZINC000660220430 411554847 /nfs/dbraw/zinc/55/48/47/411554847.db2.gz IKLMVONHSAFLAV-NOZJJQNGSA-N 1 2 237.322 2.273 20 0 BEADLO COc1cc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)sn1 ZINC000660222626 411555822 /nfs/dbraw/zinc/55/58/22/411555822.db2.gz WTDFVZJIRQIVLY-WCBMZHEXSA-N 1 2 244.335 2.332 20 0 BEADLO COc1cc(C[N@H+]2CC[C@H](C)[C@H](F)C2)sn1 ZINC000660222626 411555823 /nfs/dbraw/zinc/55/58/23/411555823.db2.gz WTDFVZJIRQIVLY-WCBMZHEXSA-N 1 2 244.335 2.332 20 0 BEADLO CN(Cc1ncc(Cl)s1)Cc1[nH]cc[nH+]1 ZINC000660141495 411544709 /nfs/dbraw/zinc/54/47/09/411544709.db2.gz DJHKIAWZPHHEKW-UHFFFAOYSA-N 1 2 242.735 2.152 20 0 BEADLO Cc1nc(C[N@@H+]2CCOCC23CCCC3)co1 ZINC000660150817 411547328 /nfs/dbraw/zinc/54/73/28/411547328.db2.gz UOHAPHOLGJHLDI-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO Cc1nc(C[N@H+]2CCOCC23CCCC3)co1 ZINC000660150817 411547329 /nfs/dbraw/zinc/54/73/29/411547329.db2.gz UOHAPHOLGJHLDI-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO COc1cc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)sn1 ZINC000660222624 411556313 /nfs/dbraw/zinc/55/63/13/411556313.db2.gz WTDFVZJIRQIVLY-PSASIEDQSA-N 1 2 244.335 2.332 20 0 BEADLO COc1cc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)sn1 ZINC000660222624 411556314 /nfs/dbraw/zinc/55/63/14/411556314.db2.gz WTDFVZJIRQIVLY-PSASIEDQSA-N 1 2 244.335 2.332 20 0 BEADLO CCOC(=O)C[N@@H+]1CCC=C(c2ccccc2)C1 ZINC000284938800 170219617 /nfs/dbraw/zinc/21/96/17/170219617.db2.gz YRUFBOBZTOWTJJ-UHFFFAOYSA-N 1 2 245.322 2.339 20 0 BEADLO CCOC(=O)C[N@H+]1CCC=C(c2ccccc2)C1 ZINC000284938800 170219618 /nfs/dbraw/zinc/21/96/18/170219618.db2.gz YRUFBOBZTOWTJJ-UHFFFAOYSA-N 1 2 245.322 2.339 20 0 BEADLO CCOC(=O)C[NH2+][C@@H](Cc1ccccc1)C1CC1 ZINC000181548587 170226128 /nfs/dbraw/zinc/22/61/28/170226128.db2.gz TTZHRXFGEVJAMJ-AWEZNQCLSA-N 1 2 247.338 2.160 20 0 BEADLO CCOC(=O)C[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000041064382 170226297 /nfs/dbraw/zinc/22/62/97/170226297.db2.gz WIUZISCQNQLYQA-AWEZNQCLSA-N 1 2 233.311 2.290 20 0 BEADLO CCOC(=O)C[NH2+][C@@H](C)[C@H](C)c1ccccc1 ZINC000181524360 170226522 /nfs/dbraw/zinc/22/65/22/170226522.db2.gz CJCKNWFPYLUOGW-RYUDHWBXSA-N 1 2 235.327 2.331 20 0 BEADLO CCOC(=O)COc1ccc([NH2+]C(C)C)cc1 ZINC000187517165 170229228 /nfs/dbraw/zinc/22/92/28/170229228.db2.gz TUZFRBYMLVYMCL-UHFFFAOYSA-N 1 2 237.299 2.449 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+](C)Cc1cccc(C)c1 ZINC000043638666 170247316 /nfs/dbraw/zinc/24/73/16/170247316.db2.gz JBGVBUYBCKODRG-GFCCVEGCSA-N 1 2 235.327 2.378 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+](C)Cc1cccc(C)c1 ZINC000043638666 170247317 /nfs/dbraw/zinc/24/73/17/170247317.db2.gz JBGVBUYBCKODRG-GFCCVEGCSA-N 1 2 235.327 2.378 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+]1CCC=C(c2ccco2)C1 ZINC000285161646 170247790 /nfs/dbraw/zinc/24/77/90/170247790.db2.gz AODDWWOECSQRKB-LLVKDONJSA-N 1 2 249.310 2.320 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+]1CCC=C(c2ccco2)C1 ZINC000285161646 170247792 /nfs/dbraw/zinc/24/77/92/170247792.db2.gz AODDWWOECSQRKB-LLVKDONJSA-N 1 2 249.310 2.320 20 0 BEADLO CCOC(=O)[C@@H]1CC[C@H](Nc2cccc[nH+]2)C1 ZINC000280852463 170259397 /nfs/dbraw/zinc/25/93/97/170259397.db2.gz YMKIAOMFFUISHT-MNOVXSKESA-N 1 2 234.299 2.225 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@H]1CCC[C@H]1SCC ZINC000300389066 170268582 /nfs/dbraw/zinc/26/85/82/170268582.db2.gz PMIZLZJHJCDLEV-GARJFASQSA-N 1 2 245.388 2.202 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@H](CC)CC(F)(F)F ZINC000309978329 170268761 /nfs/dbraw/zinc/26/87/61/170268761.db2.gz UZKXPYMSIKSSNM-JGVFFNPUSA-N 1 2 241.253 2.259 20 0 BEADLO CCOC(=O)c1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000083263061 170294864 /nfs/dbraw/zinc/29/48/64/170294864.db2.gz CABDYBNRKFOAKP-UHFFFAOYSA-N 1 2 216.240 2.253 20 0 BEADLO OC[C@@H]1CC(F)(F)C[N@@H+]1CCCC1CCC1 ZINC000660371393 411574326 /nfs/dbraw/zinc/57/43/26/411574326.db2.gz ISYJRVUHTNVHNQ-NSHDSACASA-N 1 2 233.302 2.269 20 0 BEADLO OC[C@@H]1CC(F)(F)C[N@H+]1CCCC1CCC1 ZINC000660371393 411574328 /nfs/dbraw/zinc/57/43/28/411574328.db2.gz ISYJRVUHTNVHNQ-NSHDSACASA-N 1 2 233.302 2.269 20 0 BEADLO CCOC1C[NH+](C/C=C/c2ccccc2)C1 ZINC000297334977 170335842 /nfs/dbraw/zinc/33/58/42/170335842.db2.gz DQTHMKJZOBIBBN-RMKNXTFCSA-N 1 2 217.312 2.421 20 0 BEADLO CCOC1C[NH+](Cc2ccc(C)c(F)c2)C1 ZINC000297353489 170336665 /nfs/dbraw/zinc/33/66/65/170336665.db2.gz GDDDZLHQXVSKSM-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO CCOC1C[NH+](Cc2ccc(F)c(C)c2)C1 ZINC000297353693 170337268 /nfs/dbraw/zinc/33/72/68/170337268.db2.gz GFHMQJUIKLHKQE-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO CCOCCCCNc1cc(C)[nH+]cn1 ZINC000110242806 170370472 /nfs/dbraw/zinc/37/04/72/170370472.db2.gz DNJXZRKDDUETJU-UHFFFAOYSA-N 1 2 209.293 2.014 20 0 BEADLO CCC[N@H+](C)[C@H](c1nnc[nH]1)c1ccccc1 ZINC000660762924 411623077 /nfs/dbraw/zinc/62/30/77/411623077.db2.gz YYCJCSLUWCSVJX-LBPRGKRZSA-N 1 2 230.315 2.236 20 0 BEADLO CCC[N@@H+](C)[C@H](c1nnc[nH]1)c1ccccc1 ZINC000660762924 411623080 /nfs/dbraw/zinc/62/30/80/411623080.db2.gz YYCJCSLUWCSVJX-LBPRGKRZSA-N 1 2 230.315 2.236 20 0 BEADLO CCOCC[N@H+](C)[C@@H](C)c1ncc(C)o1 ZINC000357524690 170391938 /nfs/dbraw/zinc/39/19/38/170391938.db2.gz CDNLCWWWJDCLSG-JTQLQIEISA-N 1 2 212.293 2.012 20 0 BEADLO CCOCC[N@@H+](C)[C@@H](C)c1ncc(C)o1 ZINC000357524690 170391939 /nfs/dbraw/zinc/39/19/39/170391939.db2.gz CDNLCWWWJDCLSG-JTQLQIEISA-N 1 2 212.293 2.012 20 0 BEADLO O[C@@H]1C[N@H+](CCCC2CCC2)CC(F)(F)C1 ZINC000660392488 411578663 /nfs/dbraw/zinc/57/86/63/411578663.db2.gz PRYOPRSPYCOMOP-NSHDSACASA-N 1 2 233.302 2.269 20 0 BEADLO O[C@@H]1C[N@@H+](CCCC2CCC2)CC(F)(F)C1 ZINC000660392488 411578666 /nfs/dbraw/zinc/57/86/66/411578666.db2.gz PRYOPRSPYCOMOP-NSHDSACASA-N 1 2 233.302 2.269 20 0 BEADLO c1c[nH+]c(CNc2ccc3c(c2)CCOC3)[nH]1 ZINC000657680497 411580494 /nfs/dbraw/zinc/58/04/94/411580494.db2.gz PTDZSBCKJMSFDW-UHFFFAOYSA-N 1 2 229.283 2.095 20 0 BEADLO CCc1nocc1C[N@@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000660428317 411583396 /nfs/dbraw/zinc/58/33/96/411583396.db2.gz CJDICILTOMLQOU-CYBMUJFWSA-N 1 2 246.314 2.297 20 0 BEADLO CCc1nocc1C[N@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000660428317 411583397 /nfs/dbraw/zinc/58/33/97/411583397.db2.gz CJDICILTOMLQOU-CYBMUJFWSA-N 1 2 246.314 2.297 20 0 BEADLO Cc1[nH]ncc1C[NH2+]C[C@@H]1C(C)(C)C1(F)F ZINC000657736919 411588412 /nfs/dbraw/zinc/58/84/12/411588412.db2.gz GYHFVHLLOTXCFD-SECBINFHSA-N 1 2 229.274 2.099 20 0 BEADLO CCOc1ccc(NCc2cncn2C)[nH+]c1C ZINC000657793515 411598487 /nfs/dbraw/zinc/59/84/87/411598487.db2.gz XEFQQRYDMXRIQW-UHFFFAOYSA-N 1 2 246.314 2.134 20 0 BEADLO FC1(F)COCC[N@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)C1 ZINC000660561664 411600237 /nfs/dbraw/zinc/60/02/37/411600237.db2.gz ZDUKWDSEFJWIOH-GRYCIOLGSA-N 1 2 245.313 2.390 20 0 BEADLO FC1(F)COCC[N@@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)C1 ZINC000660561664 411600239 /nfs/dbraw/zinc/60/02/39/411600239.db2.gz ZDUKWDSEFJWIOH-GRYCIOLGSA-N 1 2 245.313 2.390 20 0 BEADLO COc1cc[nH+]c(CN2CC[C@H]2C(F)(F)F)c1 ZINC000660576908 411603132 /nfs/dbraw/zinc/60/31/32/411603132.db2.gz JRDIMKGURVRXTH-JTQLQIEISA-N 1 2 246.232 2.227 20 0 BEADLO C[C@H](O)[C@@H]([NH2+]Cc1cscn1)c1ccccc1 ZINC000657815030 411604334 /nfs/dbraw/zinc/60/43/34/411604334.db2.gz HBKKCOFQYGOJKS-GXFFZTMASA-N 1 2 248.351 2.355 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)c1cc(C(C)(C)C)ncn1 ZINC000663616661 411709960 /nfs/dbraw/zinc/70/99/60/411709960.db2.gz BWEVJOBEAGOOQE-UHFFFAOYSA-N 1 2 245.330 2.134 20 0 BEADLO Cc1ccc(NCc2[nH+]ccn2CC(C)C)nn1 ZINC000663658449 411716422 /nfs/dbraw/zinc/71/64/22/411716422.db2.gz UDLGKXVPUBRWPV-UHFFFAOYSA-N 1 2 245.330 2.250 20 0 BEADLO C[C@@H]1CCC[C@H](C[N@H+](C)Cc2n[nH]c(=O)o2)C1 ZINC000660843635 411652777 /nfs/dbraw/zinc/65/27/77/411652777.db2.gz BKKPLWCESVVJKC-ZJUUUORDSA-N 1 2 239.319 2.033 20 0 BEADLO C[C@@H]1CCC[C@H](C[N@@H+](C)Cc2n[nH]c(=O)o2)C1 ZINC000660843635 411652779 /nfs/dbraw/zinc/65/27/79/411652779.db2.gz BKKPLWCESVVJKC-ZJUUUORDSA-N 1 2 239.319 2.033 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](Cc1c[nH]cn1)CC2 ZINC000661371969 411756801 /nfs/dbraw/zinc/75/68/01/411756801.db2.gz VAFPJBMLDHGURP-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](Cc1c[nH]cn1)CC2 ZINC000661371969 411756804 /nfs/dbraw/zinc/75/68/04/411756804.db2.gz VAFPJBMLDHGURP-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](Cc1cnc[nH]1)CC2 ZINC000661371969 411756806 /nfs/dbraw/zinc/75/68/06/411756806.db2.gz VAFPJBMLDHGURP-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](Cc1cnc[nH]1)CC2 ZINC000661371969 411756811 /nfs/dbraw/zinc/75/68/11/411756811.db2.gz VAFPJBMLDHGURP-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1nc2[nH]ccc2c(N2C[C@@H](C)[C@H]2C)[nH+]1 ZINC000663947945 411787062 /nfs/dbraw/zinc/78/70/62/411787062.db2.gz SJRUYGIKUOAGMG-HTQZYQBOSA-N 1 2 216.288 2.111 20 0 BEADLO Cc1nnc(C[NH+]2CCC(c3ccco3)CC2)o1 ZINC000661161558 411724109 /nfs/dbraw/zinc/72/41/09/411724109.db2.gz UPNLXLWOGQECOX-UHFFFAOYSA-N 1 2 247.298 2.351 20 0 BEADLO C[C@@]1(C2CC2)C[N@H+](Cc2nccs2)CCO1 ZINC000661167822 411726313 /nfs/dbraw/zinc/72/63/13/411726313.db2.gz KIHLMMFLHJFEEV-LBPRGKRZSA-N 1 2 238.356 2.144 20 0 BEADLO C[C@@]1(C2CC2)C[N@@H+](Cc2nccs2)CCO1 ZINC000661167822 411726316 /nfs/dbraw/zinc/72/63/16/411726316.db2.gz KIHLMMFLHJFEEV-LBPRGKRZSA-N 1 2 238.356 2.144 20 0 BEADLO Cc1ccc(N[C@@H]2C[C@@H](C)n3cc[nH+]c32)nn1 ZINC000663973245 411796977 /nfs/dbraw/zinc/79/69/77/411796977.db2.gz DRYNQBFPTIAVCU-NXEZZACHSA-N 1 2 229.287 2.099 20 0 BEADLO Cc1ccc(N[C@H]2C[C@H](C)n3cc[nH+]c32)nn1 ZINC000663973246 411797032 /nfs/dbraw/zinc/79/70/32/411797032.db2.gz DRYNQBFPTIAVCU-UWVGGRQHSA-N 1 2 229.287 2.099 20 0 BEADLO CO[C@@H](COc1cc[nH+]cc1)C1CCC1 ZINC000664017244 411815563 /nfs/dbraw/zinc/81/55/63/411815563.db2.gz WTIZGLQLWSCJDR-LBPRGKRZSA-N 1 2 207.273 2.276 20 0 BEADLO Cc1[nH+]c2cc(OC[C@@H]3CCCO3)ccc2n1C ZINC000664046754 411826763 /nfs/dbraw/zinc/82/67/63/411826763.db2.gz ONZDPYIWXFWORU-LBPRGKRZSA-N 1 2 246.310 2.440 20 0 BEADLO CCn1ccc(C[N@H+](C)[C@@H](C)c2nnc(C)[nH]2)c1 ZINC000664091942 411850591 /nfs/dbraw/zinc/85/05/91/411850591.db2.gz FAJZGBCUFMYUKQ-JTQLQIEISA-N 1 2 247.346 2.128 20 0 BEADLO CCn1ccc(C[N@@H+](C)[C@@H](C)c2nnc(C)[nH]2)c1 ZINC000664091942 411850596 /nfs/dbraw/zinc/85/05/96/411850596.db2.gz FAJZGBCUFMYUKQ-JTQLQIEISA-N 1 2 247.346 2.128 20 0 BEADLO CC[C@@H](C)[NH2+]C1(C(=O)OC)Cc2ccccc2C1 ZINC000038067328 170749520 /nfs/dbraw/zinc/74/95/20/170749520.db2.gz FEWOVVOTIUCMNT-LLVKDONJSA-N 1 2 247.338 2.085 20 0 BEADLO COc1ccc2c(c1)CC[N@@H+](Cc1ccon1)C2 ZINC000661739360 411860754 /nfs/dbraw/zinc/86/07/54/411860754.db2.gz BFQPYOCWQSPFDC-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1ccc2c(c1)CC[N@H+](Cc1ccon1)C2 ZINC000661739360 411860757 /nfs/dbraw/zinc/86/07/57/411860757.db2.gz BFQPYOCWQSPFDC-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO Cc1nc(N(C)CC2=CCCOC2)c(C)c(C)[nH+]1 ZINC000664365351 411931472 /nfs/dbraw/zinc/93/14/72/411931472.db2.gz IKDZYEIUWIXAFS-UHFFFAOYSA-N 1 2 247.342 2.185 20 0 BEADLO C[C@@H]1CCC[C@H](CNc2cccc[nH+]2)O1 ZINC000664392840 411939421 /nfs/dbraw/zinc/93/94/21/411939421.db2.gz LDSANZMAKLZKNE-GHMZBOCLSA-N 1 2 206.289 2.451 20 0 BEADLO Cc1cc(NC[C@@H]2CCC[C@H](C)O2)nc[nH+]1 ZINC000664395839 411940525 /nfs/dbraw/zinc/94/05/25/411940525.db2.gz SSGKKQMTRBOZRV-QWRGUYRKSA-N 1 2 221.304 2.155 20 0 BEADLO Cc1nc(N(C)C)nc(NCCCC2CCC2)[nH+]1 ZINC000664394624 411940884 /nfs/dbraw/zinc/94/08/84/411940884.db2.gz FZIDNZDPUDTCQW-UHFFFAOYSA-N 1 2 249.362 2.238 20 0 BEADLO Cc1nc(NCCCC2CCC2)nc(N(C)C)[nH+]1 ZINC000664394624 411940891 /nfs/dbraw/zinc/94/08/91/411940891.db2.gz FZIDNZDPUDTCQW-UHFFFAOYSA-N 1 2 249.362 2.238 20 0 BEADLO COC1CC(CCNc2cccc[nH+]2)C1 ZINC000664143034 411869624 /nfs/dbraw/zinc/86/96/24/411869624.db2.gz MVFVLKAQNNBOLO-UHFFFAOYSA-N 1 2 206.289 2.309 20 0 BEADLO Cc1nc(NC[C@H](C)c2ccccn2)cc[nH+]1 ZINC000664148902 411872391 /nfs/dbraw/zinc/87/23/91/411872391.db2.gz PZTNAHIZJZWEOY-JTQLQIEISA-N 1 2 228.299 2.396 20 0 BEADLO CC1(C)C[C@@H](Nc2cc[nH+]c(C3CC3)n2)CO1 ZINC000664146240 411872558 /nfs/dbraw/zinc/87/25/58/411872558.db2.gz ZLARGJABIKCMGC-SNVBAGLBSA-N 1 2 233.315 2.333 20 0 BEADLO Cc1cc(NC[C@@H]2CCC[C@@H](C)O2)nc[nH+]1 ZINC000664395838 411941497 /nfs/dbraw/zinc/94/14/97/411941497.db2.gz SSGKKQMTRBOZRV-MNOVXSKESA-N 1 2 221.304 2.155 20 0 BEADLO CC(C)(C)c1nc(N[C@H](CO)C2CCC2)cc[nH+]1 ZINC000664170994 411877219 /nfs/dbraw/zinc/87/72/19/411877219.db2.gz KEMUVMXBNTWBSS-LLVKDONJSA-N 1 2 249.358 2.347 20 0 BEADLO Cn1c2ccccc2[nH+]c1N[C@H](CO)C1CCC1 ZINC000664172540 411879378 /nfs/dbraw/zinc/87/93/78/411879378.db2.gz WMFQLAPYZVJFEP-GFCCVEGCSA-N 1 2 245.326 2.146 20 0 BEADLO c1cc(N2CC[C@H]3C[C@H]3C2)nc(C2CC2)[nH+]1 ZINC000664521993 411975021 /nfs/dbraw/zinc/97/50/21/411975021.db2.gz CWNYRRGQGPOMAP-QWRGUYRKSA-N 1 2 215.300 2.200 20 0 BEADLO OC1CCC(CNc2cc[nH+]c(C3CC3)n2)CC1 ZINC000664527838 411979074 /nfs/dbraw/zinc/97/90/74/411979074.db2.gz JZMNNWFDJGGKBT-UHFFFAOYSA-N 1 2 247.342 2.317 20 0 BEADLO Cc1nc(N(C)C)nc(N[C@H](C(C)C)C2CC2)[nH+]1 ZINC000664547433 411982914 /nfs/dbraw/zinc/98/29/14/411982914.db2.gz WUFDEKYBTXAEJC-LLVKDONJSA-N 1 2 249.362 2.093 20 0 BEADLO Cc1nc(N[C@H](C(C)C)C2CC2)nc(N(C)C)[nH+]1 ZINC000664547433 411982917 /nfs/dbraw/zinc/98/29/17/411982917.db2.gz WUFDEKYBTXAEJC-LLVKDONJSA-N 1 2 249.362 2.093 20 0 BEADLO c1cc(C2CCN(c3cccc[nH+]3)CC2)no1 ZINC000664565579 411988249 /nfs/dbraw/zinc/98/82/49/411988249.db2.gz RFTBPBFCYLPGCR-UHFFFAOYSA-N 1 2 229.283 2.454 20 0 BEADLO Fc1ccc(C[N@@H+]2CCc3nccnc3C2)cc1 ZINC000662120970 411991842 /nfs/dbraw/zinc/99/18/42/411991842.db2.gz JYPGQYRFZJEFIE-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1ccc(C[N@H+]2CCc3nccnc3C2)cc1 ZINC000662120970 411991846 /nfs/dbraw/zinc/99/18/46/411991846.db2.gz JYPGQYRFZJEFIE-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO C[C@H]1CN(c2[nH]c3ccccc3[nH+]2)C[C@@]1(C)CO ZINC000664597400 411994048 /nfs/dbraw/zinc/99/40/48/411994048.db2.gz ZZPBWYAKNQFMSF-HZMBPMFUSA-N 1 2 245.326 2.018 20 0 BEADLO CO[C@@]1(C)C[C@H]1Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000664603535 411996340 /nfs/dbraw/zinc/99/63/40/411996340.db2.gz RJXYVIVCQJFAIY-RNCFNFMXSA-N 1 2 235.331 2.363 20 0 BEADLO CCc1cc(C)nc(N[C@@H](C)c2[nH+]ccn2C)n1 ZINC000664608953 411997890 /nfs/dbraw/zinc/99/78/90/411997890.db2.gz RAQZMVSKZKDVBL-JTQLQIEISA-N 1 2 245.330 2.254 20 0 BEADLO Cc1nc(N[C@@H](C)c2nccn2C)c(C)c(C)[nH+]1 ZINC000664608600 411998977 /nfs/dbraw/zinc/99/89/77/411998977.db2.gz IBLGGIVQMGHBTG-JTQLQIEISA-N 1 2 245.330 2.308 20 0 BEADLO Cc1cc(N[C@H](c2ccccc2)[C@H](C)O)nc[nH+]1 ZINC000664653741 412006089 /nfs/dbraw/zinc/00/60/89/412006089.db2.gz CAGHESHDQKFRLE-FZMZJTMJSA-N 1 2 243.310 2.319 20 0 BEADLO Cc1nc(N[C@H](c2ccccc2)[C@H](C)O)cc[nH+]1 ZINC000664658120 412006845 /nfs/dbraw/zinc/00/68/45/412006845.db2.gz QYMQTFULFVNMMM-HZMBPMFUSA-N 1 2 243.310 2.319 20 0 BEADLO CC12CC(C1)CN2c1cc(NC2CC2)[nH+]cn1 ZINC000664694525 412011899 /nfs/dbraw/zinc/01/18/99/412011899.db2.gz GKWJXPZPKORIET-UHFFFAOYSA-N 1 2 230.315 2.040 20 0 BEADLO CC12CC(C1)CN2c1cc(NC2CC2)nc[nH+]1 ZINC000664694525 412011900 /nfs/dbraw/zinc/01/19/00/412011900.db2.gz GKWJXPZPKORIET-UHFFFAOYSA-N 1 2 230.315 2.040 20 0 BEADLO Cc1nc(N2CCC[C@@H](CCF)C2)cc[nH+]1 ZINC000664412764 411945784 /nfs/dbraw/zinc/94/57/84/411945784.db2.gz HYFJAGRBSAVCAH-NSHDSACASA-N 1 2 223.295 2.361 20 0 BEADLO Cc1cc(N2CCC[C@@H](CCF)C2)nc[nH+]1 ZINC000664414872 411948612 /nfs/dbraw/zinc/94/86/12/411948612.db2.gz WJNYXGDFCOWVEL-NSHDSACASA-N 1 2 223.295 2.361 20 0 BEADLO COC(C)(C)c1nc(Cc2c[nH+]ccc2C)no1 ZINC000664982029 412055084 /nfs/dbraw/zinc/05/50/84/412055084.db2.gz GPNWROHKAQORPG-UHFFFAOYSA-N 1 2 247.298 2.245 20 0 BEADLO CC[C@@H]1CCN1C(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000333157701 171018943 /nfs/dbraw/zinc/01/89/43/171018943.db2.gz GRNQWLSLCTUSME-MXWKQRLJSA-N 1 2 248.330 2.083 20 0 BEADLO CC[C@@H]1CC[C@@H](C(=O)Nc2cc[nH+]cc2C)O1 ZINC000268095635 171032818 /nfs/dbraw/zinc/03/28/18/171032818.db2.gz HDZTVQWTKPFTGU-PWSUYJOCSA-N 1 2 234.299 2.286 20 0 BEADLO CC[C@@H]1CC[C@H](C(=O)Nc2cc[nH+]cc2C)O1 ZINC000268095637 171049168 /nfs/dbraw/zinc/04/91/68/171049168.db2.gz HDZTVQWTKPFTGU-ZYHUDNBSSA-N 1 2 234.299 2.286 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1C(=O)CCc1[nH]cc[nH+]1 ZINC000288608807 171051039 /nfs/dbraw/zinc/05/10/39/171051039.db2.gz UUWFSOFVRJXZJM-WDEREUQCSA-N 1 2 235.331 2.132 20 0 BEADLO CC[C@@H]1CN(C(=O)Nc2cc[nH+]cc2C)CCO1 ZINC000179874888 171067303 /nfs/dbraw/zinc/06/73/03/171067303.db2.gz QBSLCIOYGAANHD-LLVKDONJSA-N 1 2 249.314 2.033 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccc(C)o2)CCO1 ZINC000125531496 171087336 /nfs/dbraw/zinc/08/73/36/171087336.db2.gz WLEDXDCULLBEES-LLVKDONJSA-N 1 2 209.289 2.199 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccc(C)o2)CCO1 ZINC000125531496 171087340 /nfs/dbraw/zinc/08/73/40/171087340.db2.gz WLEDXDCULLBEES-LLVKDONJSA-N 1 2 209.289 2.199 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cncc(C)c2)CCO1 ZINC000189782691 171090480 /nfs/dbraw/zinc/09/04/80/171090480.db2.gz OUPZCZDAHYOCPD-CYBMUJFWSA-N 1 2 220.316 2.001 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cncc(C)c2)CCO1 ZINC000189782691 171090482 /nfs/dbraw/zinc/09/04/82/171090482.db2.gz OUPZCZDAHYOCPD-CYBMUJFWSA-N 1 2 220.316 2.001 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nc(C)cs2)C[C@H](C)O1 ZINC000268020114 171092775 /nfs/dbraw/zinc/09/27/75/171092775.db2.gz JBMJCKSIGNMADT-WDEREUQCSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nc(C)cs2)C[C@H](C)O1 ZINC000268020114 171092776 /nfs/dbraw/zinc/09/27/76/171092776.db2.gz JBMJCKSIGNMADT-WDEREUQCSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nnc(C)s2)CCS1 ZINC000336244812 171094461 /nfs/dbraw/zinc/09/44/61/171094461.db2.gz JCTLZJHMEJNVJG-SECBINFHSA-N 1 2 243.401 2.174 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nnc(C)s2)CCS1 ZINC000336244812 171094463 /nfs/dbraw/zinc/09/44/63/171094463.db2.gz JCTLZJHMEJNVJG-SECBINFHSA-N 1 2 243.401 2.174 20 0 BEADLO CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1cc[nH+]cc1C ZINC000336527720 171118538 /nfs/dbraw/zinc/11/85/38/171118538.db2.gz SRAQJXOIMKWJGD-ZYHUDNBSSA-N 1 2 247.342 2.464 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)Nc1cccc2[nH+]ccn21 ZINC000334666190 171131947 /nfs/dbraw/zinc/13/19/47/171131947.db2.gz QDNSITGGGHJCJJ-NXEZZACHSA-N 1 2 229.283 2.319 20 0 BEADLO CC[C@@]1(C)CCN(c2cc(C)[nH+]cn2)C1 ZINC000336575111 171203583 /nfs/dbraw/zinc/20/35/83/171203583.db2.gz LLNRMTNECCNNJA-LBPRGKRZSA-N 1 2 205.305 2.411 20 0 BEADLO CC[C@H](C)[N@H+](C/C=C/Cl)CC(=O)OC ZINC000281170037 171311083 /nfs/dbraw/zinc/31/10/83/171311083.db2.gz ADZNPOMGOUJWBC-CYNONHLPSA-N 1 2 219.712 2.012 20 0 BEADLO CC[C@H](C)[N@@H+](C/C=C/Cl)CC(=O)OC ZINC000281170037 171311086 /nfs/dbraw/zinc/31/10/86/171311086.db2.gz ADZNPOMGOUJWBC-CYNONHLPSA-N 1 2 219.712 2.012 20 0 BEADLO CC[C@H](C)NC(=O)C[N@@H+]1Cc2ccc(C)cc2C1 ZINC000361590412 171326234 /nfs/dbraw/zinc/32/62/34/171326234.db2.gz YVFFESMQHOGFHZ-LBPRGKRZSA-N 1 2 246.354 2.225 20 0 BEADLO CC[C@H](C)NC(=O)C[N@H+]1Cc2ccc(C)cc2C1 ZINC000361590412 171326236 /nfs/dbraw/zinc/32/62/36/171326236.db2.gz YVFFESMQHOGFHZ-LBPRGKRZSA-N 1 2 246.354 2.225 20 0 BEADLO CC[C@H](C)Nc1cc(N2CCCC2)nc[nH+]1 ZINC000244420924 171349612 /nfs/dbraw/zinc/34/96/12/171349612.db2.gz YTMWNUASVUHHFG-JTQLQIEISA-N 1 2 220.320 2.287 20 0 BEADLO CC[C@H](C)Nc1cc(N2CCCC2)[nH+]cn1 ZINC000244420924 171349614 /nfs/dbraw/zinc/34/96/14/171349614.db2.gz YTMWNUASVUHHFG-JTQLQIEISA-N 1 2 220.320 2.287 20 0 BEADLO CC(C)[C@H](Nc1[nH+]cnc2c1cnn2C)C1CC1 ZINC000324479680 487622016 /nfs/dbraw/zinc/62/20/16/487622016.db2.gz BQQGKSSAMAVEFP-NSHDSACASA-N 1 2 245.330 2.210 20 0 BEADLO C[C@H](c1csnn1)[N@@H+]1CC2CC1(C)C2 ZINC000662385957 412137930 /nfs/dbraw/zinc/13/79/30/412137930.db2.gz MOXNJOYBRYCUEI-ZNFPMYQNSA-N 1 2 209.318 2.083 20 0 BEADLO C[C@H](c1csnn1)[N@H+]1CC2CC1(C)C2 ZINC000662385957 412137933 /nfs/dbraw/zinc/13/79/33/412137933.db2.gz MOXNJOYBRYCUEI-ZNFPMYQNSA-N 1 2 209.318 2.083 20 0 BEADLO CC[C@H](C)[C@H]([NH2+]CC=C(C)C)C(=O)OC ZINC000183684481 171399398 /nfs/dbraw/zinc/39/93/98/171399398.db2.gz BWJPSELYULBMDM-QWRGUYRKSA-N 1 2 213.321 2.130 20 0 BEADLO C[N@@H+](Cc1csnn1)C[C@H]1CC1(C)C ZINC000662345058 412113172 /nfs/dbraw/zinc/11/31/72/412113172.db2.gz VGNRBEWADGCLHI-MRVPVSSYSA-N 1 2 211.334 2.016 20 0 BEADLO C[N@H+](Cc1csnn1)C[C@H]1CC1(C)C ZINC000662345058 412113176 /nfs/dbraw/zinc/11/31/76/412113176.db2.gz VGNRBEWADGCLHI-MRVPVSSYSA-N 1 2 211.334 2.016 20 0 BEADLO CCc1cc(-c2[nH+]ccn2C)cc2c1NC(=O)C2 ZINC000665181726 412121935 /nfs/dbraw/zinc/12/19/35/412121935.db2.gz XSXUMBDXIQQAHT-UHFFFAOYSA-N 1 2 241.294 2.144 20 0 BEADLO CCOc1cc(-c2[nH+]ccn2C)ccc1N ZINC000665181267 412122052 /nfs/dbraw/zinc/12/20/52/412122052.db2.gz NGMPSFJMJIIRQY-UHFFFAOYSA-N 1 2 217.272 2.068 20 0 BEADLO c1[nH]cc(-c2cccc3c2OCCCO3)[nH+]1 ZINC000665202429 412134877 /nfs/dbraw/zinc/13/48/77/412134877.db2.gz CQVZOALDSFAWOK-UHFFFAOYSA-N 1 2 216.240 2.238 20 0 BEADLO CC[C@H](NC(=O)[C@@H](C)C(C)C)c1[nH]cc[nH+]1 ZINC000125334751 171504776 /nfs/dbraw/zinc/50/47/76/171504776.db2.gz SBEDEXCHEDKIOQ-UWVGGRQHSA-N 1 2 223.320 2.269 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1nc2ccccc2o1 ZINC000115577806 171672576 /nfs/dbraw/zinc/67/25/76/171672576.db2.gz LLSIEUIJGWTJDD-NSHDSACASA-N 1 2 246.310 2.439 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1nc2ccccc2o1 ZINC000115577806 171672578 /nfs/dbraw/zinc/67/25/78/171672578.db2.gz LLSIEUIJGWTJDD-NSHDSACASA-N 1 2 246.310 2.439 20 0 BEADLO CCc1ccc([C@@H](COC)[NH2+]Cc2cc[nH]n2)o1 ZINC000174477902 171833603 /nfs/dbraw/zinc/83/36/03/171833603.db2.gz NWFNIBGXUUKLCC-GFCCVEGCSA-N 1 2 249.314 2.042 20 0 BEADLO CCc1nnc([C@H](C)[NH2+][C@H](C)c2ccccn2)[nH]1 ZINC000271569087 172006950 /nfs/dbraw/zinc/00/69/50/172006950.db2.gz VKJMHXXUZNENTF-ZJUUUORDSA-N 1 2 245.330 2.174 20 0 BEADLO CCc1[nH+]c2ccccc2n1CC(=O)NC(C)C ZINC000017300882 172013398 /nfs/dbraw/zinc/01/33/98/172013398.db2.gz UHHXRQHAVPQTNN-UHFFFAOYSA-N 1 2 245.326 2.123 20 0 BEADLO CCc1[nH+]c2ccccc2n1CC(=O)N(C)CC ZINC000075431854 172014313 /nfs/dbraw/zinc/01/43/13/172014313.db2.gz YTWRVCZSARMJTH-UHFFFAOYSA-N 1 2 245.326 2.077 20 0 BEADLO CCc1ncc(C[NH+]2C[C@H](C)O[C@@H](C)C2)s1 ZINC000269474442 172017115 /nfs/dbraw/zinc/01/71/15/172017115.db2.gz LQPQKPPZIJMZHP-UWVGGRQHSA-N 1 2 240.372 2.315 20 0 BEADLO CCc1ncc(C[N@@H+]2CCO[C@H](CC)C2)s1 ZINC000271024588 172017871 /nfs/dbraw/zinc/01/78/71/172017871.db2.gz CUIHDYOCFWWHQU-SNVBAGLBSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1ncc(C[N@H+]2CCO[C@H](CC)C2)s1 ZINC000271024588 172017873 /nfs/dbraw/zinc/01/78/73/172017873.db2.gz CUIHDYOCFWWHQU-SNVBAGLBSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1ncc(C[NH2+]Cc2nccs2)s1 ZINC000041012911 172019328 /nfs/dbraw/zinc/01/93/28/172019328.db2.gz MJOJIBDXZUMUMZ-UHFFFAOYSA-N 1 2 239.369 2.452 20 0 BEADLO CCc1nn(C)cc1C[NH2+][C@@H](C)c1cc(C)on1 ZINC000337304605 172041087 /nfs/dbraw/zinc/04/10/87/172041087.db2.gz SFRNJKUMGQVVPH-JTQLQIEISA-N 1 2 248.330 2.130 20 0 BEADLO CCc1nn(C)cc1N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000294242679 172044047 /nfs/dbraw/zinc/04/40/47/172044047.db2.gz WFENUMNLCZGKLG-GXSJLCMTSA-N 1 2 245.330 2.297 20 0 BEADLO CCc1nnc(C[N@H+](C)[C@H](C)c2ccncc2)o1 ZINC000162439271 172047489 /nfs/dbraw/zinc/04/74/89/172047489.db2.gz TUQYXMUDNRYQNB-SNVBAGLBSA-N 1 2 246.314 2.220 20 0 BEADLO CCc1nnc(C[N@@H+](C)[C@H](C)c2ccncc2)o1 ZINC000162439271 172047492 /nfs/dbraw/zinc/04/74/92/172047492.db2.gz TUQYXMUDNRYQNB-SNVBAGLBSA-N 1 2 246.314 2.220 20 0 BEADLO CCc1nnc([C@H](C)[NH2+][C@H](C)c2cccnc2)o1 ZINC000361099276 172065842 /nfs/dbraw/zinc/06/58/42/172065842.db2.gz ZMTRYUFOJKKXCV-ZJUUUORDSA-N 1 2 246.314 2.439 20 0 BEADLO CCc1nnc([C@H](C)[N@@H+]2C[C@@H](C)[C@@H]2C)o1 ZINC000339581756 172066466 /nfs/dbraw/zinc/06/64/66/172066466.db2.gz XGLFNCYVGYRSAB-VGMNWLOBSA-N 1 2 209.293 2.033 20 0 BEADLO CCc1nnc([C@H](C)[N@H+]2C[C@@H](C)[C@@H]2C)o1 ZINC000339581756 172066468 /nfs/dbraw/zinc/06/64/68/172066468.db2.gz XGLFNCYVGYRSAB-VGMNWLOBSA-N 1 2 209.293 2.033 20 0 BEADLO CCCCC[C@H]([NH2+][C@H](CC)COC)C(=O)OC ZINC001652223457 1173047171 /nfs/dbraw/zinc/04/71/71/1173047171.db2.gz JPCDABDRAFKNCE-NEPJUHHUSA-N 1 2 245.363 2.123 20 0 BEADLO CC(C)[C@@H]1CCN(C(=O)CCCn2cc[nH+]c2)C1 ZINC000674810347 487623925 /nfs/dbraw/zinc/62/39/25/487623925.db2.gz HOSZHCSZNCUVNU-CYBMUJFWSA-N 1 2 249.358 2.168 20 0 BEADLO CCc1nsc(N2CCC[C@H]2c2[nH]cc[nH+]2)n1 ZINC000371597852 172104511 /nfs/dbraw/zinc/10/45/11/172104511.db2.gz QYEUAFDONPSGSK-QMMMGPOBSA-N 1 2 249.343 2.165 20 0 BEADLO CCc1ocnc1C(=O)Nc1cc[nH+]cc1C ZINC000265781478 172123358 /nfs/dbraw/zinc/12/33/58/172123358.db2.gz KCCYNDJXCHRYCG-UHFFFAOYSA-N 1 2 231.255 2.193 20 0 BEADLO CCn1cc(C[N@H+](C)Cc2ccoc2)cn1 ZINC000352652697 172162514 /nfs/dbraw/zinc/16/25/14/172162514.db2.gz QOXRKWGLMNWUKA-UHFFFAOYSA-N 1 2 219.288 2.128 20 0 BEADLO CCn1cc(C[N@@H+](C)Cc2ccoc2)cn1 ZINC000352652697 172162517 /nfs/dbraw/zinc/16/25/17/172162517.db2.gz QOXRKWGLMNWUKA-UHFFFAOYSA-N 1 2 219.288 2.128 20 0 BEADLO CCn1cc(C[N@H+](C)Cc2cccc(C)n2)cn1 ZINC000353749967 172163376 /nfs/dbraw/zinc/16/33/76/172163376.db2.gz WTVVYTVVXGZHPL-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1cc(C[N@@H+](C)Cc2cccc(C)n2)cn1 ZINC000353749967 172163378 /nfs/dbraw/zinc/16/33/78/172163378.db2.gz WTVVYTVVXGZHPL-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1cc(N[C@@H](c2[nH+]ccn2C)C2CC2)cn1 ZINC000128789351 172187349 /nfs/dbraw/zinc/18/73/49/172187349.db2.gz YAYRVVULVUFJKA-GFCCVEGCSA-N 1 2 245.330 2.200 20 0 BEADLO CCn1cc(N[C@H]2C[C@H](C)n3cc[nH+]c32)cn1 ZINC000294165136 172188626 /nfs/dbraw/zinc/18/86/26/172188626.db2.gz RAEJNFSCJPSBGG-ONGXEEELSA-N 1 2 231.303 2.217 20 0 BEADLO CCn1cc[nH+]c1CN1CCC[C@@H]1C(F)F ZINC000353171677 172219137 /nfs/dbraw/zinc/21/91/37/172219137.db2.gz MJKMWFKSWQQITR-SECBINFHSA-N 1 2 229.274 2.133 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C1CCCCC1 ZINC000295715862 172222802 /nfs/dbraw/zinc/22/28/02/172222802.db2.gz KGEIFIWLWBQSTK-UHFFFAOYSA-N 1 2 235.331 2.100 20 0 BEADLO CCn1cnnc1C[NH2+][C@H](C)c1cccc(F)c1 ZINC000158467204 172236170 /nfs/dbraw/zinc/23/61/70/172236170.db2.gz BIOZBVJVOICRIO-SNVBAGLBSA-N 1 2 248.305 2.288 20 0 BEADLO CCn1nc(C)c(C[NH2+][C@@H](C)c2ccc(C)o2)n1 ZINC000294845536 172246754 /nfs/dbraw/zinc/24/67/54/172246754.db2.gz UKBSAFYFUFWXOW-NSHDSACASA-N 1 2 248.330 2.359 20 0 BEADLO CCn1nccc1CC[N@@H+]1CCC[C@@H]1C(F)F ZINC000353170389 172259532 /nfs/dbraw/zinc/25/95/32/172259532.db2.gz GXANEPHRDIGOQV-LLVKDONJSA-N 1 2 243.301 2.175 20 0 BEADLO CCn1nccc1CC[N@H+]1CCC[C@@H]1C(F)F ZINC000353170389 172259534 /nfs/dbraw/zinc/25/95/34/172259534.db2.gz GXANEPHRDIGOQV-LLVKDONJSA-N 1 2 243.301 2.175 20 0 BEADLO CCn1nccc1C[N@H+](C)Cc1cncc(F)c1 ZINC000352340769 172263874 /nfs/dbraw/zinc/26/38/74/172263874.db2.gz DDTVBOCMAWNQNV-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO CCn1nccc1C[N@@H+](C)Cc1cncc(F)c1 ZINC000352340769 172263877 /nfs/dbraw/zinc/26/38/77/172263877.db2.gz DDTVBOCMAWNQNV-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO CCn1nccc1C[NH+]1Cc2ccccc2C1 ZINC000119959139 172268789 /nfs/dbraw/zinc/26/87/89/172268789.db2.gz NLXBLBVRMFAOIF-UHFFFAOYSA-N 1 2 227.311 2.419 20 0 BEADLO CCn1ncnc1C[N@H+](C)Cc1ccc(C)cc1 ZINC000193300777 172279198 /nfs/dbraw/zinc/27/91/98/172279198.db2.gz QTVHZKBRHUVOPC-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1ncnc1C[N@@H+](C)Cc1ccc(C)cc1 ZINC000193300777 172279200 /nfs/dbraw/zinc/27/92/00/172279200.db2.gz QTVHZKBRHUVOPC-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1ncnc1C[NH2+]Cc1ccc(F)cc1C ZINC000355608255 172281686 /nfs/dbraw/zinc/28/16/86/172281686.db2.gz OEHIHOFTQTXKLB-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO CN(C(=O)C=Cc1c[nH]c[nH+]1)C1CCCCC1 ZINC000276513122 172294306 /nfs/dbraw/zinc/29/43/06/172294306.db2.gz JJLLFCPJDZGIJU-BQYQJAHWSA-N 1 2 233.315 2.214 20 0 BEADLO CN(C(=O)C(C)(C)c1c[nH+]c[nH]1)c1ccccc1 ZINC000334833728 172295943 /nfs/dbraw/zinc/29/59/43/172295943.db2.gz YDNJXNRATPQHAX-UHFFFAOYSA-N 1 2 243.310 2.350 20 0 BEADLO CN(C(=O)C(C)(C)c1c[nH]c[nH+]1)c1ccccc1 ZINC000334833728 172295945 /nfs/dbraw/zinc/29/59/45/172295945.db2.gz YDNJXNRATPQHAX-UHFFFAOYSA-N 1 2 243.310 2.350 20 0 BEADLO CN(C)C(=O)C[C@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000341196721 172374775 /nfs/dbraw/zinc/37/47/75/172374775.db2.gz QUVHNICHZUQPIU-LBPRGKRZSA-N 1 2 243.310 2.020 20 0 BEADLO C[N@@H+]1CCc2ncnc(N[C@@H]3CCC3(C)C)c2C1 ZINC000286448311 173173311 /nfs/dbraw/zinc/17/33/11/173173311.db2.gz OQLIVQBITMOKSY-GFCCVEGCSA-N 1 2 246.358 2.065 20 0 BEADLO C[N@H+]1CCc2ncnc(N[C@@H]3CCC3(C)C)c2C1 ZINC000286448311 173173312 /nfs/dbraw/zinc/17/33/12/173173312.db2.gz OQLIVQBITMOKSY-GFCCVEGCSA-N 1 2 246.358 2.065 20 0 BEADLO CNC(=O)c1ccc(C[N@@H+]2CCC=C(F)C2)cc1 ZINC000271667944 173310480 /nfs/dbraw/zinc/31/04/80/173310480.db2.gz WIQGUKUXKPABDJ-UHFFFAOYSA-N 1 2 248.301 2.105 20 0 BEADLO CNC(=O)c1ccc(C[N@H+]2CCC=C(F)C2)cc1 ZINC000271667944 173310481 /nfs/dbraw/zinc/31/04/81/173310481.db2.gz WIQGUKUXKPABDJ-UHFFFAOYSA-N 1 2 248.301 2.105 20 0 BEADLO COC(=O)[C@H](C)[NH2+]C1CC(C)(c2ccccc2)C1 ZINC000281322182 173785060 /nfs/dbraw/zinc/78/50/60/173785060.db2.gz VFYNMHFLYYVUNJ-ZOODHJKOSA-N 1 2 247.338 2.258 20 0 BEADLO COC1CC[NH+](Cc2ncc(Cl)s2)CC1 ZINC000336461810 174030024 /nfs/dbraw/zinc/03/00/24/174030024.db2.gz GYESMCXLHQYDFK-UHFFFAOYSA-N 1 2 246.763 2.407 20 0 BEADLO COCC(C)(C)CCCNc1cc(C)[nH+]cn1 ZINC000340905745 174068063 /nfs/dbraw/zinc/06/80/63/174068063.db2.gz CSLCEKIDBZOOIZ-UHFFFAOYSA-N 1 2 237.347 2.072 20 0 BEADLO COCC(C)(C)CNc1ccc(C)[nH+]c1 ZINC000308969476 174075812 /nfs/dbraw/zinc/07/58/12/174075812.db2.gz YEPJXZHFRJQLCH-UHFFFAOYSA-N 1 2 208.305 2.475 20 0 BEADLO COCC1(C[N@@H+]2CCC(F)(F)C2)CCC1 ZINC000361348276 174098504 /nfs/dbraw/zinc/09/85/04/174098504.db2.gz JCIMSIVCOWNVRB-UHFFFAOYSA-N 1 2 219.275 2.144 20 0 BEADLO COCC1(C[N@H+]2CCC(F)(F)C2)CCC1 ZINC000361348276 174098505 /nfs/dbraw/zinc/09/85/05/174098505.db2.gz JCIMSIVCOWNVRB-UHFFFAOYSA-N 1 2 219.275 2.144 20 0 BEADLO COCC1(CNc2cccc[nH+]2)CCC1 ZINC000282038339 174105888 /nfs/dbraw/zinc/10/58/88/174105888.db2.gz XBGDNUPFZZGAEC-UHFFFAOYSA-N 1 2 206.289 2.310 20 0 BEADLO COCC1CCN(c2[nH]c3ccccc3[nH+]2)CC1 ZINC000270589668 174120280 /nfs/dbraw/zinc/12/02/80/174120280.db2.gz SFIPAGQHDZFRJM-UHFFFAOYSA-N 1 2 245.326 2.426 20 0 BEADLO CCNc1ccc(Nc2ncc(F)cn2)c[nH+]1 ZINC001652336914 1173063809 /nfs/dbraw/zinc/06/38/09/1173063809.db2.gz OTZFUJLQOFNJBN-UHFFFAOYSA-N 1 2 233.250 2.186 20 0 BEADLO COCCCN(C)c1[nH+]c2ccccc2n1C ZINC000270602868 174221269 /nfs/dbraw/zinc/22/12/69/174221269.db2.gz WHVZKEIRUVCVHO-UHFFFAOYSA-N 1 2 233.315 2.046 20 0 BEADLO COCCCNc1[nH+]ccc(C)c1Cl ZINC000308628460 174252088 /nfs/dbraw/zinc/25/20/88/174252088.db2.gz XZFDRXYOJMRZMX-UHFFFAOYSA-N 1 2 214.696 2.492 20 0 BEADLO COCC[N@H+](C)Cc1c(F)cccc1F ZINC000127175058 174280584 /nfs/dbraw/zinc/28/05/84/174280584.db2.gz BHCZVIJSLDMXIQ-UHFFFAOYSA-N 1 2 215.243 2.043 20 0 BEADLO COCC[N@@H+](C)Cc1c(F)cccc1F ZINC000127175058 174280586 /nfs/dbraw/zinc/28/05/86/174280586.db2.gz BHCZVIJSLDMXIQ-UHFFFAOYSA-N 1 2 215.243 2.043 20 0 BEADLO COCC[N@H+](C)Cc1ccsc1Cl ZINC000336650457 174281727 /nfs/dbraw/zinc/28/17/27/174281727.db2.gz IDFFZXJYMQWVQW-UHFFFAOYSA-N 1 2 219.737 2.480 20 0 BEADLO COCC[N@@H+](C)Cc1ccsc1Cl ZINC000336650457 174281729 /nfs/dbraw/zinc/28/17/29/174281729.db2.gz IDFFZXJYMQWVQW-UHFFFAOYSA-N 1 2 219.737 2.480 20 0 BEADLO COCCN(C)c1cc[nH+]c2c(OC)cccc12 ZINC000275476647 174283394 /nfs/dbraw/zinc/28/33/94/174283394.db2.gz JJQMQMDRDZQBSZ-UHFFFAOYSA-N 1 2 246.310 2.326 20 0 BEADLO COCCN(Cc1ccccn1)c1cccc[nH+]1 ZINC000298725368 174299507 /nfs/dbraw/zinc/29/95/07/174299507.db2.gz LUJOKETZZCOHHK-UHFFFAOYSA-N 1 2 243.310 2.130 20 0 BEADLO COCCNc1[nH+]ccc2ccc(F)cc21 ZINC000336751264 174342990 /nfs/dbraw/zinc/34/29/90/174342990.db2.gz CUCUGIXEHBRBOQ-UHFFFAOYSA-N 1 2 220.247 2.432 20 0 BEADLO COCCSCc1cn2ccccc2[nH+]1 ZINC000173727458 174376337 /nfs/dbraw/zinc/37/63/37/174376337.db2.gz PBNFKMNNVOVSKK-UHFFFAOYSA-N 1 2 222.313 2.214 20 0 BEADLO COCC[C@@H]([NH2+]Cc1cc[nH]n1)c1ccc(C)o1 ZINC000272300748 174394575 /nfs/dbraw/zinc/39/45/75/174394575.db2.gz NNSOQGXIOMSGEE-GFCCVEGCSA-N 1 2 249.314 2.179 20 0 BEADLO COc1cc([NH2+]C[C@@H]2CCCOC2)ccc1N ZINC000104252281 175002584 /nfs/dbraw/zinc/00/25/84/175002584.db2.gz HNTOUPHQISQSTH-JTQLQIEISA-N 1 2 236.315 2.116 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2cnc[nH]2)cc1C ZINC000092787104 175095372 /nfs/dbraw/zinc/09/53/72/175095372.db2.gz VGDXJIJGFGABQG-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2cnc[nH]2)cc1C ZINC000092787104 175095375 /nfs/dbraw/zinc/09/53/75/175095375.db2.gz VGDXJIJGFGABQG-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2c[nH]cn2)cc1C ZINC000092787104 175095376 /nfs/dbraw/zinc/09/53/76/175095376.db2.gz VGDXJIJGFGABQG-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2c[nH]cn2)cc1C ZINC000092787104 175095378 /nfs/dbraw/zinc/09/53/78/175095378.db2.gz VGDXJIJGFGABQG-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1ccc(C[N@@H+]2CCC(=O)C[C@H]2C)cc1 ZINC000049707618 175098505 /nfs/dbraw/zinc/09/85/05/175098505.db2.gz BLFLEJAPQIIBBW-LLVKDONJSA-N 1 2 233.311 2.249 20 0 BEADLO COc1ccc(C[N@H+]2CCC(=O)C[C@H]2C)cc1 ZINC000049707618 175098507 /nfs/dbraw/zinc/09/85/07/175098507.db2.gz BLFLEJAPQIIBBW-LLVKDONJSA-N 1 2 233.311 2.249 20 0 BEADLO COc1ccc(C[NH+]2Cc3ccccc3C2)nn1 ZINC000283248822 175103377 /nfs/dbraw/zinc/10/33/77/175103377.db2.gz VELRNOMPTTXSQB-UHFFFAOYSA-N 1 2 241.294 2.001 20 0 BEADLO COc1ccc(COCc2[nH]cc[nH+]2)cc1F ZINC000123838207 175114243 /nfs/dbraw/zinc/11/42/43/175114243.db2.gz ICQURGZCJMXZPM-UHFFFAOYSA-N 1 2 236.246 2.274 20 0 BEADLO COc1ccc(F)c(C[N@@H+]2CCO[C@@H](C)C2)c1 ZINC000294968830 175124015 /nfs/dbraw/zinc/12/40/15/175124015.db2.gz RJCDIIIWEMCMTG-JTQLQIEISA-N 1 2 239.290 2.055 20 0 BEADLO COc1ccc(F)c(C[N@H+]2CCO[C@@H](C)C2)c1 ZINC000294968830 175124016 /nfs/dbraw/zinc/12/40/16/175124016.db2.gz RJCDIIIWEMCMTG-JTQLQIEISA-N 1 2 239.290 2.055 20 0 BEADLO COc1ccc(NCc2c[nH+]cn2C)c(C)c1 ZINC000090167207 175152538 /nfs/dbraw/zinc/15/25/38/175152538.db2.gz HNQUOWRQABBAIR-UHFFFAOYSA-N 1 2 231.299 2.349 20 0 BEADLO COc1ccc(N[C@H]2CCn3cc[nH+]c32)cc1 ZINC000294247604 175155255 /nfs/dbraw/zinc/15/52/55/175155255.db2.gz WMABWASWUHKQJR-LBPRGKRZSA-N 1 2 229.283 2.449 20 0 BEADLO COc1ccc(N[C@H]2C[C@@H](C)n3cc[nH+]c32)cn1 ZINC000294098688 175155809 /nfs/dbraw/zinc/15/58/09/175155809.db2.gz MMNJXWWJDDLCQS-KOLCDFICSA-N 1 2 244.298 2.405 20 0 BEADLO COc1ccc(Nc2ccc(N)[nH+]c2)cc1 ZINC000019952405 175156174 /nfs/dbraw/zinc/15/61/74/175156174.db2.gz UEXUNDRWEPVYMP-UHFFFAOYSA-N 1 2 215.256 2.416 20 0 BEADLO COc1ccc([C@H](C)[NH2+]Cc2nnc(C)o2)cc1 ZINC000223628326 175189105 /nfs/dbraw/zinc/18/91/05/175189105.db2.gz LLMFAECXFLGGQG-VIFPVBQESA-N 1 2 247.298 2.237 20 0 BEADLO COc1ccc2nc(C)nc(-n3cc[nH+]c3)c2c1 ZINC000301910482 175227896 /nfs/dbraw/zinc/22/78/96/175227896.db2.gz BIHYJOVMFFCRLR-UHFFFAOYSA-N 1 2 240.266 2.133 20 0 BEADLO COc1cccc(C(F)(F)C[NH2+]CC2CC2)n1 ZINC000353079655 175247289 /nfs/dbraw/zinc/24/72/89/175247289.db2.gz AQXWFBWCIHPUJR-UHFFFAOYSA-N 1 2 242.269 2.182 20 0 BEADLO COc1cccc(C[NH2+]Cc2cc(C)on2)c1 ZINC000044296015 175265336 /nfs/dbraw/zinc/26/53/36/175265336.db2.gz BUCBLQSLULQMKS-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO COc1cccc(CNCc2[nH+]cc(C)n2C)c1 ZINC000341080923 175266197 /nfs/dbraw/zinc/26/61/97/175266197.db2.gz RQWFKLKWYDCSFE-UHFFFAOYSA-N 1 2 245.326 2.027 20 0 BEADLO COc1cccc(CSCCn2cc[nH+]c2)n1 ZINC000180487249 175270872 /nfs/dbraw/zinc/27/08/72/175270872.db2.gz NWDMOASWCIKVMG-UHFFFAOYSA-N 1 2 249.339 2.220 20 0 BEADLO COc1cccc([C@H](O)CNc2cccc[nH+]2)c1 ZINC000301299519 175295049 /nfs/dbraw/zinc/29/50/49/175295049.db2.gz ZFYDTRZXTKMSPH-CYBMUJFWSA-N 1 2 244.294 2.236 20 0 BEADLO COc1cccc2c1CC[N@H+](Cc1ccno1)C2 ZINC000272972188 175301171 /nfs/dbraw/zinc/30/11/71/175301171.db2.gz PCMIQNKHRYRNEJ-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1cccc2c1CC[N@@H+](Cc1ccno1)C2 ZINC000272972188 175301173 /nfs/dbraw/zinc/30/11/73/175301173.db2.gz PCMIQNKHRYRNEJ-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1ccccc1C[NH2+][C@H](C)c1ccn(C)n1 ZINC000020349328 175331651 /nfs/dbraw/zinc/33/16/51/175331651.db2.gz WFUXYSBZUPKHMG-LLVKDONJSA-N 1 2 245.326 2.280 20 0 BEADLO COc1cc[nH+]c(CN2CCC=C(F)C2)c1 ZINC000273266993 175358777 /nfs/dbraw/zinc/35/87/77/175358777.db2.gz ZSNHMCMUBZEXJS-UHFFFAOYSA-N 1 2 222.263 2.149 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)CC(C)(C)C ZINC000293252742 175370357 /nfs/dbraw/zinc/37/03/57/175370357.db2.gz FDCVIBRDUKOVEC-UHFFFAOYSA-N 1 2 236.315 2.143 20 0 BEADLO COc1cc[nH+]cc1COc1ccc(C)cn1 ZINC000341387415 175373118 /nfs/dbraw/zinc/37/31/18/175373118.db2.gz IQJPZTRMXVFWCI-UHFFFAOYSA-N 1 2 230.267 2.373 20 0 BEADLO COc1cc[nH+]cc1COC(=O)[C@H]1CC=CCC1 ZINC000288780675 175373713 /nfs/dbraw/zinc/37/37/13/175373713.db2.gz RYMRYNNKGXRREA-NSHDSACASA-N 1 2 247.294 2.490 20 0 BEADLO COc1cc[nH+]cc1COC(=O)[C@@H]1C[C@@H]1C(C)C ZINC000287120435 175373885 /nfs/dbraw/zinc/37/38/85/175373885.db2.gz XCISLIODEVNAOK-VXGBXAGGSA-N 1 2 249.310 2.426 20 0 BEADLO COc1cc[nH+]cc1COC(=O)[C@H](C)C(C)C ZINC000286883122 175374197 /nfs/dbraw/zinc/37/41/97/175374197.db2.gz FLPJCWBAKXYXRO-SNVBAGLBSA-N 1 2 237.299 2.426 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C1(C)CCC1 ZINC000267317985 175374839 /nfs/dbraw/zinc/37/48/39/175374839.db2.gz DOUKYMRXRSFFAT-UHFFFAOYSA-N 1 2 220.272 2.219 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C[C@H]1C[C@@H]1C ZINC000355257995 175375199 /nfs/dbraw/zinc/37/51/99/175375199.db2.gz UTOZDXAYQSNJED-DTWKUNHWSA-N 1 2 220.272 2.075 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C[C@@H]1C[C@H]1C ZINC000355257993 175375244 /nfs/dbraw/zinc/37/52/44/175375244.db2.gz UTOZDXAYQSNJED-BDAKNGLRSA-N 1 2 220.272 2.075 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C(C)(Cl)Cl ZINC000180202819 175375677 /nfs/dbraw/zinc/37/56/77/175375677.db2.gz WGULPURZCOSVAV-UHFFFAOYSA-N 1 2 249.097 2.223 20 0 BEADLO COc1cncc(C[N@H+](C)Cc2cccnc2)c1 ZINC000289673859 175384722 /nfs/dbraw/zinc/38/47/22/175384722.db2.gz DGPQQSIPGRFERO-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1cncc(C[N@@H+](C)Cc2cccnc2)c1 ZINC000289673859 175384723 /nfs/dbraw/zinc/38/47/23/175384723.db2.gz DGPQQSIPGRFERO-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO C[C@@H](CNC(=O)C1=CCCCC1)Cn1cc[nH+]c1 ZINC000276256051 175722267 /nfs/dbraw/zinc/72/22/67/175722267.db2.gz PJCITPJVTQERIH-LBPRGKRZSA-N 1 2 247.342 2.136 20 0 BEADLO CC[N@H+](Cc1nccn1C)[C@@H](C)c1cccnc1 ZINC000270656679 487631602 /nfs/dbraw/zinc/63/16/02/487631602.db2.gz NIMFTIZJYSFUMY-LBPRGKRZSA-N 1 2 244.342 2.398 20 0 BEADLO CC[N@@H+](Cc1nccn1C)[C@@H](C)c1cccnc1 ZINC000270656679 487631607 /nfs/dbraw/zinc/63/16/07/487631607.db2.gz NIMFTIZJYSFUMY-LBPRGKRZSA-N 1 2 244.342 2.398 20 0 BEADLO CCN(Cc1[nH+]ccn1C)[C@@H](C)c1cccnc1 ZINC000270656679 487631611 /nfs/dbraw/zinc/63/16/11/487631611.db2.gz NIMFTIZJYSFUMY-LBPRGKRZSA-N 1 2 244.342 2.398 20 0 BEADLO C[C@@H]([NH2+]Cc1ccon1)c1ccncc1F ZINC000336778718 175905296 /nfs/dbraw/zinc/90/52/96/175905296.db2.gz MCMCLIBMECYXLY-MRVPVSSYSA-N 1 2 221.235 2.060 20 0 BEADLO C[C@@H](SCCn1cc[nH+]c1)c1cnccn1 ZINC000185710700 176007753 /nfs/dbraw/zinc/00/77/53/176007753.db2.gz AUGRKCIUZLHMRN-SNVBAGLBSA-N 1 2 234.328 2.168 20 0 BEADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1cc[nH]n1 ZINC000093316243 176019632 /nfs/dbraw/zinc/01/96/32/176019632.db2.gz GVGNCBPPOTXFBN-JTQLQIEISA-N 1 2 231.299 2.308 20 0 BEADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1cc[nH]n1 ZINC000093316243 176019634 /nfs/dbraw/zinc/01/96/34/176019634.db2.gz GVGNCBPPOTXFBN-JTQLQIEISA-N 1 2 231.299 2.308 20 0 BEADLO C[C@@H](c1cccnc1)N(C)Cc1[nH+]ccn1C ZINC000179260695 176028719 /nfs/dbraw/zinc/02/87/19/176028719.db2.gz VKGGYKRVFKXPGP-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1ccn(C)n1 ZINC000271996835 176029171 /nfs/dbraw/zinc/02/91/71/176029171.db2.gz HHVDIOPICSBJRH-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1ccn(C)n1 ZINC000271996835 176029173 /nfs/dbraw/zinc/02/91/73/176029173.db2.gz HHVDIOPICSBJRH-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1ccco1)[N@H+](CC(=O)N1CCC1)C1CC1 ZINC000267927927 176031148 /nfs/dbraw/zinc/03/11/48/176031148.db2.gz LFVHFXUTIWFELC-NSHDSACASA-N 1 2 248.326 2.037 20 0 BEADLO C[C@@H](c1ccco1)[N@@H+](CC(=O)N1CCC1)C1CC1 ZINC000267927927 176031150 /nfs/dbraw/zinc/03/11/50/176031150.db2.gz LFVHFXUTIWFELC-NSHDSACASA-N 1 2 248.326 2.037 20 0 BEADLO C[C@@H](c1cccs1)[N@H+](C)Cc1cn(C)nn1 ZINC000336671608 176033164 /nfs/dbraw/zinc/03/31/64/176033164.db2.gz ZOQOEJAAHHQNBN-VIFPVBQESA-N 1 2 236.344 2.070 20 0 BEADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1cn(C)nn1 ZINC000336671608 176033166 /nfs/dbraw/zinc/03/31/66/176033166.db2.gz ZOQOEJAAHHQNBN-VIFPVBQESA-N 1 2 236.344 2.070 20 0 BEADLO C[C@@H](c1cnccn1)[N@H+](C)Cc1cccnc1 ZINC000184690506 176036032 /nfs/dbraw/zinc/03/60/32/176036032.db2.gz NSCIVSQRUILBEX-NSHDSACASA-N 1 2 228.299 2.065 20 0 BEADLO C[C@@H](c1cnccn1)[N@@H+](C)Cc1cccnc1 ZINC000184690506 176036034 /nfs/dbraw/zinc/03/60/34/176036034.db2.gz NSCIVSQRUILBEX-NSHDSACASA-N 1 2 228.299 2.065 20 0 BEADLO C[C@@H](c1cnccn1)[N@H+](C)Cc1ccco1 ZINC000184400107 176036358 /nfs/dbraw/zinc/03/63/58/176036358.db2.gz ROPUFICZRDJECX-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@@H](c1cnccn1)[N@@H+](C)Cc1ccco1 ZINC000184400107 176036359 /nfs/dbraw/zinc/03/63/59/176036359.db2.gz ROPUFICZRDJECX-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@@H](c1nncn1C)[N@H+](C)Cc1cccs1 ZINC000287422291 176039195 /nfs/dbraw/zinc/03/91/95/176039195.db2.gz SZIBWRUOFSQRKP-VIFPVBQESA-N 1 2 236.344 2.070 20 0 BEADLO C[C@@H](c1nncn1C)[N@@H+](C)Cc1cccs1 ZINC000287422291 176039196 /nfs/dbraw/zinc/03/91/96/176039196.db2.gz SZIBWRUOFSQRKP-VIFPVBQESA-N 1 2 236.344 2.070 20 0 BEADLO C[C@@H]1CCCCN1C(=O)C(C)(C)c1c[nH+]c[nH]1 ZINC000336455629 176067284 /nfs/dbraw/zinc/06/72/84/176067284.db2.gz AOBVNWUBMJJIRI-SNVBAGLBSA-N 1 2 235.331 2.088 20 0 BEADLO C[C@@H]1CCCC[C@@H]1N(C)C(=O)CCn1cc[nH+]c1 ZINC000299619727 176077853 /nfs/dbraw/zinc/07/78/53/176077853.db2.gz QAXFRJWKCXQMFG-OLZOCXBDSA-N 1 2 249.358 2.310 20 0 BEADLO C[C@@H]1CCCC[C@@H]1NC(=O)CCc1c[nH+]cn1C ZINC000188422317 176079432 /nfs/dbraw/zinc/07/94/32/176079432.db2.gz SHYMUKBYTWFYJC-YPMHNXCESA-N 1 2 249.358 2.048 20 0 BEADLO C[C@@H]1CCCC[C@H]1N(C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000276445533 176085463 /nfs/dbraw/zinc/08/54/63/176085463.db2.gz AGGYOLFAXFJBAJ-KPYDUXRZSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@@H]1CCCC[C@H]1NC(=O)COc1cc[nH+]cc1 ZINC000276389743 176086506 /nfs/dbraw/zinc/08/65/06/176086506.db2.gz BNAMOQJELGHAIZ-DGCLKSJQSA-N 1 2 248.326 2.155 20 0 BEADLO C[C@@H]1CCC[C@H](CNc2ccc(CO)c[nH+]2)C1 ZINC000356311096 176138783 /nfs/dbraw/zinc/13/87/83/176138783.db2.gz WAEIDMRLLHFEBM-NEPJUHHUSA-N 1 2 234.343 2.234 20 0 BEADLO C[C@@H]1CCN(C(=O)Nc2ccn3cc[nH+]c3c2)C1 ZINC000280922011 176159449 /nfs/dbraw/zinc/15/94/49/176159449.db2.gz GKYSVJDJYQWBQQ-SNVBAGLBSA-N 1 2 244.298 2.208 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NCc2[nH+]ccn2C)C[C@H]1C ZINC000294487645 176195216 /nfs/dbraw/zinc/19/52/16/176195216.db2.gz GEINAWQNWVKDHB-IJLUTSLNSA-N 1 2 249.358 2.109 20 0 BEADLO C[C@@H]1CC[C@@H](NC(=O)CCc2[nH]cc[nH+]2)[C@H](C)C1 ZINC000287401911 176209934 /nfs/dbraw/zinc/20/99/34/176209934.db2.gz JFERTSZGIIFASP-IJLUTSLNSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H]1CC[C@H](NC(=O)CCc2[nH]cc[nH+]2)CC1 ZINC000287245055 176210253 /nfs/dbraw/zinc/21/02/53/176210253.db2.gz BESMQEYYBHDSJG-XYPYZODXSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H]1CC[C@@H]([NH2+]c2ccc(-n3cnnn3)cc2)C1 ZINC000080427167 176214407 /nfs/dbraw/zinc/21/44/07/176214407.db2.gz VJQAHMLQZAINEC-ZYHUDNBSSA-N 1 2 243.314 2.263 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)NCCn2cc[nH+]c2)C[C@H]1C ZINC000294559528 176220561 /nfs/dbraw/zinc/22/05/61/176220561.db2.gz ROLAOOQVISMKFG-UPJWGTAASA-N 1 2 249.358 2.072 20 0 BEADLO C[C@@H]1CC[C@H](CC(=O)N(C)Cc2[nH+]ccn2C)C1 ZINC000268299928 176221816 /nfs/dbraw/zinc/22/18/16/176221816.db2.gz XQGSXQNZPURHSB-NEPJUHHUSA-N 1 2 249.358 2.205 20 0 BEADLO C[C@@H]1C[N@H+](CCc2ccccc2F)CCC1=O ZINC000049693540 176293595 /nfs/dbraw/zinc/29/35/95/176293595.db2.gz CDDCWOVXOYTYHW-LLVKDONJSA-N 1 2 235.302 2.279 20 0 BEADLO C[C@@H]1C[N@@H+](CCc2ccccc2F)CCC1=O ZINC000049693540 176293596 /nfs/dbraw/zinc/29/35/96/176293596.db2.gz CDDCWOVXOYTYHW-LLVKDONJSA-N 1 2 235.302 2.279 20 0 BEADLO C[C@@H]1C[NH+](Cc2cc(F)ccc2N)C[C@@H](C)O1 ZINC000035308377 176301626 /nfs/dbraw/zinc/30/16/26/176301626.db2.gz HWDNYEQOKDIPSH-NXEZZACHSA-N 1 2 238.306 2.017 20 0 BEADLO C[C@@H]1C[NH+](Cc2cccc3c2OCO3)C[C@@H](C)O1 ZINC000126990235 176305796 /nfs/dbraw/zinc/30/57/96/176305796.db2.gz JDUPGMRNKDVTRU-GHMZBOCLSA-N 1 2 249.310 2.025 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nccs2)CC(C)(C)O1 ZINC000135005061 176311678 /nfs/dbraw/zinc/31/16/78/176311678.db2.gz MUBBIKYDUFGEIE-SECBINFHSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nccs2)CC(C)(C)O1 ZINC000135005061 176311681 /nfs/dbraw/zinc/31/16/81/176311681.db2.gz MUBBIKYDUFGEIE-SECBINFHSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nc(CC(F)(F)F)no2)[C@@H]1C ZINC000339572618 176311858 /nfs/dbraw/zinc/31/18/58/176311858.db2.gz AQQCGXWFVYCIGK-RNFRBKRXSA-N 1 2 249.236 2.015 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nc(CC(F)(F)F)no2)[C@@H]1C ZINC000339572618 176311860 /nfs/dbraw/zinc/31/18/60/176311860.db2.gz AQQCGXWFVYCIGK-RNFRBKRXSA-N 1 2 249.236 2.015 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nccs2)C[C@@H](C2CC2)O1 ZINC000279302064 176312699 /nfs/dbraw/zinc/31/26/99/176312699.db2.gz MHOHXINFZYTRPH-KOLCDFICSA-N 1 2 238.356 2.142 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nccs2)C[C@@H](C2CC2)O1 ZINC000279302064 176312701 /nfs/dbraw/zinc/31/27/01/176312701.db2.gz MHOHXINFZYTRPH-KOLCDFICSA-N 1 2 238.356 2.142 20 0 BEADLO C[C@H](c1ccccn1)[N@@H+]1CCC(=O)[C@H](C)C1 ZINC000251839544 176318308 /nfs/dbraw/zinc/31/83/08/176318308.db2.gz QHULROLQMGRQAQ-GHMZBOCLSA-N 1 2 218.300 2.054 20 0 BEADLO C[C@H](c1ccccn1)[N@H+]1CCC(=O)[C@H](C)C1 ZINC000251839544 176318310 /nfs/dbraw/zinc/31/83/10/176318310.db2.gz QHULROLQMGRQAQ-GHMZBOCLSA-N 1 2 218.300 2.054 20 0 BEADLO C[C@@H]1COCC[C@@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000277754722 176341935 /nfs/dbraw/zinc/34/19/35/176341935.db2.gz VDSKDRLTJNENMM-KOLCDFICSA-N 1 2 233.315 2.191 20 0 BEADLO C[C@@H]1COc2ccccc2C[N@@H+]1Cc1cc[nH]n1 ZINC000272993791 176348426 /nfs/dbraw/zinc/34/84/26/176348426.db2.gz XRGXJBKQDVFABC-LLVKDONJSA-N 1 2 243.310 2.193 20 0 BEADLO C[C@@H]1COc2ccccc2C[N@H+]1Cc1cc[nH]n1 ZINC000272993791 176348428 /nfs/dbraw/zinc/34/84/28/176348428.db2.gz XRGXJBKQDVFABC-LLVKDONJSA-N 1 2 243.310 2.193 20 0 BEADLO C[C@@H]1CSC(SCc2c[nH+]cn2C)=N1 ZINC000270881745 176349126 /nfs/dbraw/zinc/34/91/26/176349126.db2.gz PCDJHOLUQPMGQL-SSDOTTSWSA-N 1 2 227.358 2.145 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1nn(C)cc1Cl ZINC000335503524 176364394 /nfs/dbraw/zinc/36/43/94/176364394.db2.gz NKRNIVAKQFRBFG-HTQZYQBOSA-N 1 2 213.712 2.056 20 0 BEADLO C[C@@H]1C[C@@H]([NH2+][C@@H](C2CC2)C(F)(F)F)CCO1 ZINC000309805481 176377705 /nfs/dbraw/zinc/37/77/05/176377705.db2.gz SAUQQNCHNUGGTE-JEZHCXPESA-N 1 2 237.265 2.484 20 0 BEADLO C[C@H]([C@H](C)O)n1cc[nH+]c1-c1ccccc1 ZINC000044186922 177006695 /nfs/dbraw/zinc/00/66/95/177006695.db2.gz DWJCYQSLAZIJJS-MNOVXSKESA-N 1 2 216.284 2.492 20 0 BEADLO C[C@H](c1ccco1)[N@H+](C)Cc1ccon1 ZINC000077272434 177046917 /nfs/dbraw/zinc/04/69/17/177046917.db2.gz FQNCDWGLIWHHJC-SECBINFHSA-N 1 2 206.245 2.461 20 0 BEADLO C[C@H](c1ccco1)[N@@H+](C)Cc1ccon1 ZINC000077272434 177046920 /nfs/dbraw/zinc/04/69/20/177046920.db2.gz FQNCDWGLIWHHJC-SECBINFHSA-N 1 2 206.245 2.461 20 0 BEADLO C[C@H](c1ccco1)[N@H+](CC(=O)N1CCC1)C1CC1 ZINC000267927925 177047526 /nfs/dbraw/zinc/04/75/26/177047526.db2.gz LFVHFXUTIWFELC-LLVKDONJSA-N 1 2 248.326 2.037 20 0 BEADLO C[C@H](c1ccco1)[N@@H+](CC(=O)N1CCC1)C1CC1 ZINC000267927925 177047527 /nfs/dbraw/zinc/04/75/27/177047527.db2.gz LFVHFXUTIWFELC-LLVKDONJSA-N 1 2 248.326 2.037 20 0 BEADLO C[C@H](c1cnccn1)[N@@H+]1CCOC2(CCCC2)C1 ZINC000373361050 177051343 /nfs/dbraw/zinc/05/13/43/177051343.db2.gz JWONZOAJHKNNJP-GFCCVEGCSA-N 1 2 247.342 2.183 20 0 BEADLO C[C@H](c1cnccn1)[N@H+]1CCOC2(CCCC2)C1 ZINC000373361050 177051344 /nfs/dbraw/zinc/05/13/44/177051344.db2.gz JWONZOAJHKNNJP-GFCCVEGCSA-N 1 2 247.342 2.183 20 0 BEADLO C[C@H](c1cnccn1)[N@@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000279821155 177051378 /nfs/dbraw/zinc/05/13/78/177051378.db2.gz QMXBZTDYRPMWNJ-DGCLKSJQSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H](c1cnccn1)[N@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000279821155 177051380 /nfs/dbraw/zinc/05/13/80/177051380.db2.gz QMXBZTDYRPMWNJ-DGCLKSJQSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H](c1nncn1C)[N@H+](C)Cc1ccccc1 ZINC000287332998 177054234 /nfs/dbraw/zinc/05/42/34/177054234.db2.gz OEXQDGFCJWBANK-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1nncn1C)[N@@H+](C)Cc1ccccc1 ZINC000287332998 177054235 /nfs/dbraw/zinc/05/42/35/177054235.db2.gz OEXQDGFCJWBANK-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H]1CC(C(=O)NCc2[nH]cc[nH+]2)C[C@H](C)C1 ZINC000272564983 177063475 /nfs/dbraw/zinc/06/34/75/177063475.db2.gz RGJHWUNDIWVYDU-NXEZZACHSA-N 1 2 235.331 2.098 20 0 BEADLO C[C@H]1CCCC[C@@H]1CNC(=O)CCc1c[nH+]c[nH]1 ZINC000192903265 177079738 /nfs/dbraw/zinc/07/97/38/177079738.db2.gz VYLZGZGKAOUJOP-NWDGAFQWSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H]1CCCC[C@@H]1CNC(=O)CCc1c[nH]c[nH+]1 ZINC000192903265 177079739 /nfs/dbraw/zinc/07/97/39/177079739.db2.gz VYLZGZGKAOUJOP-NWDGAFQWSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H]1CCCC[C@@H]1CNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000283532763 177079842 /nfs/dbraw/zinc/07/98/42/177079842.db2.gz RMQXKEVXHSDSPR-FNSAGKMKSA-N 1 2 247.342 2.365 20 0 BEADLO C[C@H]1CCCC[C@@H]1N(C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000276445509 177080518 /nfs/dbraw/zinc/08/05/18/177080518.db2.gz AGGYOLFAXFJBAJ-DDOQPMFUSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@H]1CCCN1c1cc(NC2CC2)[nH+]cn1 ZINC000309426906 177111825 /nfs/dbraw/zinc/11/18/25/177111825.db2.gz KJVYFSQCKQTTPE-VIFPVBQESA-N 1 2 218.304 2.040 20 0 BEADLO C[C@H]1CCCN1c1cc(NC2CC2)nc[nH+]1 ZINC000309426906 177111826 /nfs/dbraw/zinc/11/18/26/177111826.db2.gz KJVYFSQCKQTTPE-VIFPVBQESA-N 1 2 218.304 2.040 20 0 BEADLO C[C@H]1CCCN1c1cc[nH+]c(C2CC2)n1 ZINC000172812441 177111954 /nfs/dbraw/zinc/11/19/54/177111954.db2.gz LCHYKGQDEFUHEF-VIFPVBQESA-N 1 2 203.289 2.343 20 0 BEADLO C[C@H]1CCC[C@@H](CNC(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000283503859 177119729 /nfs/dbraw/zinc/11/97/29/177119729.db2.gz PEYNALOHNGWIEJ-CYLBZQBVSA-N 1 2 247.342 2.365 20 0 BEADLO C[C@H]1CCC[C@@H]1[NH2+]c1ccc(OCC(N)=O)cc1 ZINC000086673350 177127131 /nfs/dbraw/zinc/12/71/31/177127131.db2.gz BCXGEBSNDASSLL-GWCFXTLKSA-N 1 2 248.326 2.151 20 0 BEADLO C[C@H]1CCC[C@H](C)N1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000283958583 177130116 /nfs/dbraw/zinc/13/01/16/177130116.db2.gz LRRMSHUDTDXJJW-JYLGIWJRSA-N 1 2 233.315 2.212 20 0 BEADLO C[C@H]1CCC[C@H](CNC(=O)CCc2[nH]cc[nH+]2)C1 ZINC000287363516 177133460 /nfs/dbraw/zinc/13/34/60/177133460.db2.gz YONSZYGBUFASNX-RYUDHWBXSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H]1CCN(C(=O)CCn2cc[nH+]c2)C[C@H](C)C1 ZINC000269792376 177147390 /nfs/dbraw/zinc/14/73/90/177147390.db2.gz HHWURTJPIPRCNH-QWHCGFSZSA-N 1 2 249.358 2.168 20 0 BEADLO C[C@H]1CC[N@H+](Cc2ccsc2)CC[S@@]1=O ZINC000277384331 177167232 /nfs/dbraw/zinc/16/72/32/177167232.db2.gz GAVUSARKWJKKTC-BONVTDFDSA-N 1 2 243.397 2.091 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2ccsc2)CC[S@@]1=O ZINC000277384331 177167234 /nfs/dbraw/zinc/16/72/34/177167234.db2.gz GAVUSARKWJKKTC-BONVTDFDSA-N 1 2 243.397 2.091 20 0 BEADLO C[C@H]1CCN(c2cc(N3CC[C@H](C)C3)[nH+]cn2)C1 ZINC000270002901 177170901 /nfs/dbraw/zinc/17/09/01/177170901.db2.gz YQGQGWNPPSMGMK-RYUDHWBXSA-N 1 2 246.358 2.169 20 0 BEADLO C[C@H]1CCN(c2[nH+]c3ccccc3n2C)C1 ZINC000270596548 177171753 /nfs/dbraw/zinc/17/17/53/177171753.db2.gz UQZPEBPDSNBQOS-JTQLQIEISA-N 1 2 215.300 2.420 20 0 BEADLO C[C@H]1CCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000270602755 177172166 /nfs/dbraw/zinc/17/21/66/177172166.db2.gz WFMVJQJPUHDIKR-VIFPVBQESA-N 1 2 201.273 2.409 20 0 BEADLO C[C@H]1CC[C@H](C)N(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000284156149 177197870 /nfs/dbraw/zinc/19/78/70/177197870.db2.gz WVJGQZXQIQYKLD-PZIAFJOJSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@H]1CC[C@H](Nc2nc[nH+]c(N)c2Cl)C1 ZINC000235662208 177205195 /nfs/dbraw/zinc/20/51/95/177205195.db2.gz JFPPLNDDPYQPQG-BQBZGAKWSA-N 1 2 226.711 2.313 20 0 BEADLO C[C@H]1CC[C@H](Nc2[nH+]cnc(N)c2Cl)C1 ZINC000235662208 177205196 /nfs/dbraw/zinc/20/51/96/177205196.db2.gz JFPPLNDDPYQPQG-BQBZGAKWSA-N 1 2 226.711 2.313 20 0 BEADLO C[C@H]1C[NH+](Cc2cccc3c2OCO3)C[C@H](C)O1 ZINC000126989998 177264122 /nfs/dbraw/zinc/26/41/22/177264122.db2.gz JDUPGMRNKDVTRU-QWRGUYRKSA-N 1 2 249.310 2.025 20 0 BEADLO C[C@H]1C[N@H+](Cc2cncs2)C[C@H](C2CC2)O1 ZINC000280646241 177269023 /nfs/dbraw/zinc/26/90/23/177269023.db2.gz RRQNGXDFCMGPDX-JOYOIKCWSA-N 1 2 238.356 2.142 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cncs2)C[C@H](C2CC2)O1 ZINC000280646241 177269024 /nfs/dbraw/zinc/26/90/24/177269024.db2.gz RRQNGXDFCMGPDX-JOYOIKCWSA-N 1 2 238.356 2.142 20 0 BEADLO C[C@H]1CN(Cc2[nH]cc[nH+]2)Cc2ccccc2O1 ZINC000292308797 177272418 /nfs/dbraw/zinc/27/24/18/177272418.db2.gz DPOITJHAYAZSGD-NSHDSACASA-N 1 2 243.310 2.193 20 0 BEADLO C[C@H]1COCC[C@H]1[NH2+]c1ccc2c(c1)CCO2 ZINC000192584207 177297020 /nfs/dbraw/zinc/29/70/20/177297020.db2.gz RNMJCAUNAPLDLB-GXFFZTMASA-N 1 2 233.311 2.458 20 0 BEADLO C[C@H]1CSC(SCCCn2cc[nH+]c2)=N1 ZINC000185637998 177302811 /nfs/dbraw/zinc/30/28/11/177302811.db2.gz SPLSYMZLPCKUTC-VIFPVBQESA-N 1 2 241.385 2.498 20 0 BEADLO C[C@H]1CSCCN(c2cccc[nH+]2)C1 ZINC000276759345 177304421 /nfs/dbraw/zinc/30/44/21/177304421.db2.gz AAAPSLCDLZDQAC-SNVBAGLBSA-N 1 2 208.330 2.271 20 0 BEADLO C[C@H]1CSCC[N@@H+]1Cc1cc(F)ncc1F ZINC000294864645 177304906 /nfs/dbraw/zinc/30/49/06/177304906.db2.gz PTOLFFXPVAUTPA-QMMMGPOBSA-N 1 2 244.310 2.297 20 0 BEADLO C[C@H]1CSCC[N@H+]1Cc1cc(F)ncc1F ZINC000294864645 177304908 /nfs/dbraw/zinc/30/49/08/177304908.db2.gz PTOLFFXPVAUTPA-QMMMGPOBSA-N 1 2 244.310 2.297 20 0 BEADLO C[C@@H]1C[C@H](C)[C@H](C)N(C(=O)CCn2cc[nH+]c2)C1 ZINC000354702851 177310240 /nfs/dbraw/zinc/31/02/40/177310240.db2.gz GKUSGJSXLJBYGG-AGIUHOORSA-N 1 2 249.358 2.166 20 0 BEADLO C[C@H]1C[C@@H](NCc2nccs2)c2[nH+]ccn21 ZINC000345362962 177332989 /nfs/dbraw/zinc/33/29/89/177332989.db2.gz VWHILRYBVNRVFA-DTWKUNHWSA-N 1 2 234.328 2.135 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1cnn(C)c1C(F)(F)F ZINC000336582563 177360699 /nfs/dbraw/zinc/36/06/99/177360699.db2.gz HOJGQHSQIGDZQH-YUMQZZPRSA-N 1 2 247.264 2.422 20 0 BEADLO C[C@@H]1CCCN1C(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000333227592 177366866 /nfs/dbraw/zinc/36/68/66/177366866.db2.gz XKCJOXFVAUJZFD-VWYCJHECSA-N 1 2 248.330 2.083 20 0 BEADLO C[C@H]1C[C@H]1CNc1cc[nH+]c(C2CC2)n1 ZINC000264901440 177382514 /nfs/dbraw/zinc/38/25/14/177382514.db2.gz VYKCNSSBSJPWIT-WPRPVWTQSA-N 1 2 203.289 2.422 20 0 BEADLO C[C@H]1C[C@H]1NC(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000117785156 177385084 /nfs/dbraw/zinc/38/50/84/177385084.db2.gz MJEHCYJLTPRQTJ-GXFFZTMASA-N 1 2 241.294 2.011 20 0 BEADLO Cc1ccc(Cc2noc([C@@H]3C[C@@H]3C)n2)c[nH+]1 ZINC000680712790 487638839 /nfs/dbraw/zinc/63/88/39/487638839.db2.gz MXTMXDGDMUODRO-GZMMTYOYSA-N 1 2 229.283 2.487 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H]2CC[C@H](C)C2)c[nH+]1 ZINC001652464226 1173086734 /nfs/dbraw/zinc/08/67/34/1173086734.db2.gz WRLFYKXNDJBIQS-VHSXEESVSA-N 1 2 235.331 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H]2CC[C@H](C)C2)[nH+]1 ZINC001652464226 1173086736 /nfs/dbraw/zinc/08/67/36/1173086736.db2.gz WRLFYKXNDJBIQS-VHSXEESVSA-N 1 2 235.331 2.025 20 0 BEADLO CCc1cc(N[C@@H]2CCOC2(C)C)nc[nH+]1 ZINC000328280207 487642160 /nfs/dbraw/zinc/64/21/60/487642160.db2.gz ZBYSYDOUQNOFRA-SNVBAGLBSA-N 1 2 221.304 2.018 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccc(F)c2)nn1C ZINC000487435990 225305193 /nfs/dbraw/zinc/30/51/93/225305193.db2.gz XEDPROMETXJHKO-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccc(F)c2)nn1C ZINC000487435990 225305197 /nfs/dbraw/zinc/30/51/97/225305197.db2.gz XEDPROMETXJHKO-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1cc(C)c(NC(=O)c2ccncn2)c(C)[nH+]1 ZINC000487784927 225325030 /nfs/dbraw/zinc/32/50/30/225325030.db2.gz OLKPIUXXEZPOPV-UHFFFAOYSA-N 1 2 242.282 2.049 20 0 BEADLO c1cn(CCCSc2nc3c([nH]2)CCC3)c[nH+]1 ZINC000487904459 225331542 /nfs/dbraw/zinc/33/15/42/225331542.db2.gz CBNVQVDRYIZDNZ-UHFFFAOYSA-N 1 2 248.355 2.277 20 0 BEADLO C[C@H]1C[C@H]1c1noc(CCCn2cc[nH+]c2)n1 ZINC000680773954 487646056 /nfs/dbraw/zinc/64/60/56/487646056.db2.gz PAVHUBYECCDAEZ-VHSXEESVSA-N 1 2 232.287 2.022 20 0 BEADLO CCn1nccc1C[NH2+][C@@H](C)c1cc(C)on1 ZINC000669686781 487647895 /nfs/dbraw/zinc/64/78/95/487647895.db2.gz MBHWZOCNUKUXNV-JTQLQIEISA-N 1 2 234.303 2.050 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)NCC1CCCCC1 ZINC000492760057 226047174 /nfs/dbraw/zinc/04/71/74/226047174.db2.gz DBCBVLSMBUUFDM-SREVYHEPSA-N 1 2 233.315 2.119 20 0 BEADLO C[C@H]1CC(NC(=O)C=Cc2c[nH]c[nH+]2)C[C@@H](C)C1 ZINC000492775473 226051085 /nfs/dbraw/zinc/05/10/85/226051085.db2.gz XVKDBZJRDJEBBY-HDDJBEPOSA-N 1 2 247.342 2.364 20 0 BEADLO Cc1cccc(NC(=O)C=Cc2c[nH]c[nH+]2)c1 ZINC000492861159 226069285 /nfs/dbraw/zinc/06/92/85/226069285.db2.gz JEVCMMWYAUALNE-WAYWQWQTSA-N 1 2 227.267 2.370 20 0 BEADLO Cc1ccc(NC(=O)C=Cc2c[nH]c[nH+]2)cc1O ZINC000492861870 226070038 /nfs/dbraw/zinc/07/00/38/226070038.db2.gz KABLMYAMGWEAIC-PLNGDYQASA-N 1 2 243.266 2.076 20 0 BEADLO O=C(/C=C\C1CCCC1)N1CC(n2cc[nH+]c2)C1 ZINC000493134774 226135959 /nfs/dbraw/zinc/13/59/59/226135959.db2.gz AQOUCTYPXGWMSO-WAYWQWQTSA-N 1 2 245.326 2.013 20 0 BEADLO c1ccc(N[C@@H]2CCOC3(CCOCC3)C2)[nH+]c1 ZINC000493525744 226239465 /nfs/dbraw/zinc/23/94/65/226239465.db2.gz MRHCAKVMPMSRIN-GFCCVEGCSA-N 1 2 248.326 2.222 20 0 BEADLO C[C@H](C1CC1)N(C(=O)/C=C/c1[nH]cc[nH+]1)C1CC1 ZINC000493582711 226244382 /nfs/dbraw/zinc/24/43/82/226244382.db2.gz LCUALPLFILTQOK-VQCYPWCPSA-N 1 2 245.326 2.212 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)N(C1CC1)C1CCCC1 ZINC000493613004 226246118 /nfs/dbraw/zinc/24/61/18/226246118.db2.gz FUOZFRTYMUJPDT-BQYQJAHWSA-N 1 2 245.326 2.357 20 0 BEADLO C[C@@H](NC(=O)/C=C\c1ccsc1)c1[nH]cc[nH+]1 ZINC000493690313 226249507 /nfs/dbraw/zinc/24/95/07/226249507.db2.gz RPDMGLVDSQYOFD-PKRMOACSSA-N 1 2 247.323 2.362 20 0 BEADLO C[C@H]1CCCCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493785534 226254029 /nfs/dbraw/zinc/25/40/29/226254029.db2.gz HXOOQBOJNYUXAE-ZADCQDASSA-N 1 2 233.315 2.214 20 0 BEADLO C[C@H]1C[C@H](NC(=O)OC(C)(C)C)c2[nH+]ccn21 ZINC000496625133 226309874 /nfs/dbraw/zinc/30/98/74/226309874.db2.gz NFFPXHZDZAJOTK-IUCAKERBSA-N 1 2 237.303 2.414 20 0 BEADLO Cc1cc(N2CCCCN2)[nH+]c(C(C)C)n1 ZINC000400210340 226337155 /nfs/dbraw/zinc/33/71/55/226337155.db2.gz PNGUYJBDMXJICI-UHFFFAOYSA-N 1 2 220.320 2.013 20 0 BEADLO Cc1ccccc1N(C)Cc1[nH+]ccn1C ZINC000653462977 487658040 /nfs/dbraw/zinc/65/80/40/487658040.db2.gz VQKJTZXWQFVDKB-UHFFFAOYSA-N 1 2 215.300 2.365 20 0 BEADLO Cc1cc(C(=O)N(C)Cc2[nH+]ccn2C)cs1 ZINC000671631852 487661827 /nfs/dbraw/zinc/66/18/27/487661827.db2.gz DARZZLNYHAFARX-UHFFFAOYSA-N 1 2 249.339 2.062 20 0 BEADLO CCc1cc(NCCOCC2CCC2)nc[nH+]1 ZINC000680898186 487668962 /nfs/dbraw/zinc/66/89/62/487668962.db2.gz FLJQKVZSOIVCSC-UHFFFAOYSA-N 1 2 235.331 2.268 20 0 BEADLO C[C@@H]1CC[C@@H](C)N1c1cc(-n2cc[nH+]c2)ncn1 ZINC000675121029 487671680 /nfs/dbraw/zinc/67/16/80/487671680.db2.gz XQXMGSNNGZKZMM-GHMZBOCLSA-N 1 2 243.314 2.040 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1CC12CCC2 ZINC000675335085 487672188 /nfs/dbraw/zinc/67/21/88/487672188.db2.gz HYCMWASHXHPVAU-NSHDSACASA-N 1 2 230.311 2.195 20 0 BEADLO C[C@H](CC(C)(C)C)NC(=O)CCc1c[nH+]c[nH]1 ZINC000457189067 487682858 /nfs/dbraw/zinc/68/28/58/487682858.db2.gz HETMJAZRFSRBCQ-SNVBAGLBSA-N 1 2 237.347 2.283 20 0 BEADLO C[C@H](CC(C)(C)C)NC(=O)CCc1c[nH]c[nH+]1 ZINC000457189067 487682859 /nfs/dbraw/zinc/68/28/59/487682859.db2.gz HETMJAZRFSRBCQ-SNVBAGLBSA-N 1 2 237.347 2.283 20 0 BEADLO Cn1ccnc1C[N@@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000176886029 487687550 /nfs/dbraw/zinc/68/75/50/487687550.db2.gz TXNMLQNDHXVHSL-VIFPVBQESA-N 1 2 247.264 2.194 20 0 BEADLO Cn1ccnc1C[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000176886029 487687559 /nfs/dbraw/zinc/68/75/59/487687559.db2.gz TXNMLQNDHXVHSL-VIFPVBQESA-N 1 2 247.264 2.194 20 0 BEADLO Cn1cc[nH+]c1CN1CCC[C@H](C(F)(F)F)C1 ZINC000176886029 487687566 /nfs/dbraw/zinc/68/75/66/487687566.db2.gz TXNMLQNDHXVHSL-VIFPVBQESA-N 1 2 247.264 2.194 20 0 BEADLO CC[N@H+](Cc1ccncc1)[C@@H](C)c1nc(C)no1 ZINC000678083309 487694138 /nfs/dbraw/zinc/69/41/38/487694138.db2.gz ADHBGPSFBBIBPF-JTQLQIEISA-N 1 2 246.314 2.356 20 0 BEADLO CC[N@@H+](Cc1ccncc1)[C@@H](C)c1nc(C)no1 ZINC000678083309 487694140 /nfs/dbraw/zinc/69/41/40/487694140.db2.gz ADHBGPSFBBIBPF-JTQLQIEISA-N 1 2 246.314 2.356 20 0 BEADLO CCn1ncc(C[NH2+]Cc2cc(C)ccc2F)n1 ZINC000527734482 262877857 /nfs/dbraw/zinc/87/78/57/262877857.db2.gz IVPDGBFSPNVQQA-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO CCc1cc(N)nc(SCCC2CC2)[nH+]1 ZINC000336713150 487702007 /nfs/dbraw/zinc/70/20/07/487702007.db2.gz VJZQNNOEZCDHSA-UHFFFAOYSA-N 1 2 223.345 2.344 20 0 BEADLO CC[C@@H]([NH2+]Cc1cn(C)cn1)c1c(C)noc1C ZINC000683900477 487711755 /nfs/dbraw/zinc/71/17/55/487711755.db2.gz WVHXIGCIIBDZTL-GFCCVEGCSA-N 1 2 248.330 2.266 20 0 BEADLO CCC(C)(CC)C(=O)NCCNc1cccc[nH+]1 ZINC000681090693 487717391 /nfs/dbraw/zinc/71/73/91/487717391.db2.gz OYGXTELKRDTBSP-UHFFFAOYSA-N 1 2 249.358 2.436 20 0 BEADLO CCc1cc(N2C[C@@H](CC)OC[C@@H]2C)nc(C)[nH+]1 ZINC000651405108 487727753 /nfs/dbraw/zinc/72/77/53/487727753.db2.gz JRHURKNQDFYOKE-GXFFZTMASA-N 1 2 249.358 2.351 20 0 BEADLO C1=CC[C@H](CNc2[nH+]cnc3c2OCCN3)CC1 ZINC000665695192 487733662 /nfs/dbraw/zinc/73/36/62/487733662.db2.gz XCZVWJXMCGQLSR-JTQLQIEISA-N 1 2 246.314 2.049 20 0 BEADLO C1=CC[C@H](CNc2nc[nH+]c3c2OCCN3)CC1 ZINC000665695192 487733666 /nfs/dbraw/zinc/73/36/66/487733666.db2.gz XCZVWJXMCGQLSR-JTQLQIEISA-N 1 2 246.314 2.049 20 0 BEADLO CCN(c1cc[nH+]c(C2CC2)n1)[C@H]1CCCOC1 ZINC000651415502 487735313 /nfs/dbraw/zinc/73/53/13/487735313.db2.gz GLVQJRYLOVCDMW-LBPRGKRZSA-N 1 2 247.342 2.359 20 0 BEADLO CC(C)(C)c1nc(NCc2ccncn2)cc[nH+]1 ZINC000665719782 487738494 /nfs/dbraw/zinc/73/84/94/487738494.db2.gz TYVKMDDBVMCNQJ-UHFFFAOYSA-N 1 2 243.314 2.176 20 0 BEADLO CCc1cc(N[C@H](CO)c2ccsc2)nc[nH+]1 ZINC000681153500 487739223 /nfs/dbraw/zinc/73/92/23/487739223.db2.gz XQRMJSUTCCXKNW-LLVKDONJSA-N 1 2 249.339 2.246 20 0 BEADLO CC1(C)OCC[C@@H]1Nc1cc(NC2CC2)[nH+]cn1 ZINC000665721368 487739784 /nfs/dbraw/zinc/73/97/84/487739784.db2.gz IJXIDMGGBYEXKO-JTQLQIEISA-N 1 2 248.330 2.030 20 0 BEADLO CC1(C)OCC[C@@H]1Nc1cc(NC2CC2)nc[nH+]1 ZINC000665721368 487739790 /nfs/dbraw/zinc/73/97/90/487739790.db2.gz IJXIDMGGBYEXKO-JTQLQIEISA-N 1 2 248.330 2.030 20 0 BEADLO Cc1nc(N2CCC[C@@H](CCO)C2)c(C)c(C)[nH+]1 ZINC000675548710 487746880 /nfs/dbraw/zinc/74/68/80/487746880.db2.gz ZCTRWRZSLDZWNQ-ZDUSSCGKSA-N 1 2 249.358 2.001 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+](Cn2ncsc2=S)C1 ZINC000740861312 585107345 /nfs/dbraw/zinc/10/73/45/585107345.db2.gz MWDCRJQHMLCLSC-SFYZADRCSA-N 1 2 229.374 2.362 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+](Cn2ncsc2=S)C1 ZINC000740861312 585107346 /nfs/dbraw/zinc/10/73/46/585107346.db2.gz MWDCRJQHMLCLSC-SFYZADRCSA-N 1 2 229.374 2.362 20 0 BEADLO C1=CCN(c2cc(N3CC=CCC3)[nH+]cn2)CC1 ZINC000681237651 487755940 /nfs/dbraw/zinc/75/59/40/487755940.db2.gz LXOPIACVYWNSPD-UHFFFAOYSA-N 1 2 242.326 2.009 20 0 BEADLO Cc1cc(CN2CCCC[C@H]2c2[nH]cc[nH+]2)on1 ZINC000675893210 487788327 /nfs/dbraw/zinc/78/83/27/487788327.db2.gz AUMYUWXKZMWRAJ-LBPRGKRZSA-N 1 2 246.314 2.433 20 0 BEADLO Cc1cnc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)o1 ZINC000679225718 487788861 /nfs/dbraw/zinc/78/88/61/487788861.db2.gz RCAWAHRDOSGHHS-PSASIEDQSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1cnc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)o1 ZINC000679225718 487788862 /nfs/dbraw/zinc/78/88/62/487788862.db2.gz RCAWAHRDOSGHHS-PSASIEDQSA-N 1 2 212.268 2.163 20 0 BEADLO CCc1ncc(CNc2ccc(OC)c[nH+]2)cn1 ZINC000666229719 487789601 /nfs/dbraw/zinc/78/96/01/487789601.db2.gz WNCWNCWCAZAZIP-UHFFFAOYSA-N 1 2 244.298 2.055 20 0 BEADLO CCc1ncc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)cn1 ZINC000666353541 487793514 /nfs/dbraw/zinc/79/35/14/487793514.db2.gz BAADCMFQOIQWLO-CMPLNLGQSA-N 1 2 237.322 2.219 20 0 BEADLO CCc1ncc(C[N@H+]2CC[C@H](C)[C@H](F)C2)cn1 ZINC000666353541 487793516 /nfs/dbraw/zinc/79/35/16/487793516.db2.gz BAADCMFQOIQWLO-CMPLNLGQSA-N 1 2 237.322 2.219 20 0 BEADLO CCc1ncc(C[NH2+][C@H]2CCCC2(F)F)cn1 ZINC000666375847 487795229 /nfs/dbraw/zinc/79/52/29/487795229.db2.gz HIOHRIHDONCUNU-JTQLQIEISA-N 1 2 241.285 2.316 20 0 BEADLO CCc1cc(NCC2(CCO)CCC2)nc[nH+]1 ZINC000676029584 487800992 /nfs/dbraw/zinc/80/09/92/487800992.db2.gz JJNZAXJYRJLCRA-UHFFFAOYSA-N 1 2 235.331 2.004 20 0 BEADLO CCc1cnc(C[N@H+](C)CCOC(C)(C)C)o1 ZINC000676043822 487804400 /nfs/dbraw/zinc/80/44/00/487804400.db2.gz UDUVHVPIRPHLGE-UHFFFAOYSA-N 1 2 240.347 2.484 20 0 BEADLO CCc1cnc(C[N@@H+](C)CCOC(C)(C)C)o1 ZINC000676043822 487804405 /nfs/dbraw/zinc/80/44/05/487804405.db2.gz UDUVHVPIRPHLGE-UHFFFAOYSA-N 1 2 240.347 2.484 20 0 BEADLO Cc1noc(C[N@@H+](C)[C@H]2C[C@H]2c2ccccc2)n1 ZINC000676043930 487804523 /nfs/dbraw/zinc/80/45/23/487804523.db2.gz RVQCKAKXXRTOHW-STQMWFEESA-N 1 2 243.310 2.366 20 0 BEADLO Cc1noc(C[N@H+](C)[C@H]2C[C@H]2c2ccccc2)n1 ZINC000676043930 487804526 /nfs/dbraw/zinc/80/45/26/487804526.db2.gz RVQCKAKXXRTOHW-STQMWFEESA-N 1 2 243.310 2.366 20 0 BEADLO CC/C=C\CC[N@@H+]1CCOC[C@@H]1c1ccnn1C ZINC000649884723 487813920 /nfs/dbraw/zinc/81/39/20/487813920.db2.gz ZBHBJGAGXKMGJO-ZRUQZJFASA-N 1 2 249.358 2.150 20 0 BEADLO CC/C=C\CC[N@H+]1CCOC[C@@H]1c1ccnn1C ZINC000649884723 487813925 /nfs/dbraw/zinc/81/39/25/487813925.db2.gz ZBHBJGAGXKMGJO-ZRUQZJFASA-N 1 2 249.358 2.150 20 0 BEADLO Cc1cc(NC(=O)NCCC(C)(C)F)cc[nH+]1 ZINC000666489454 487820832 /nfs/dbraw/zinc/82/08/32/487820832.db2.gz GBDKVRKDHVEZRQ-UHFFFAOYSA-N 1 2 239.294 2.072 20 0 BEADLO CC[C@H](C)CCNC(=O)Nc1cc[nH+]cc1C ZINC000666494894 487821839 /nfs/dbraw/zinc/82/18/39/487821839.db2.gz YLXRISWYWSMONY-JTQLQIEISA-N 1 2 235.331 2.370 20 0 BEADLO CC(C)c1ncc(C[N@@H+](C)CCF)cn1 ZINC000799335308 586171846 /nfs/dbraw/zinc/17/18/46/586171846.db2.gz XSDPBUBELUNSMZ-UHFFFAOYSA-N 1 2 211.284 2.001 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@H](C)c2cnc(C)nc2C)CCO1 ZINC000681658039 487832641 /nfs/dbraw/zinc/83/26/41/487832641.db2.gz VNPOBPCIDDUPHP-DGCLKSJQSA-N 1 2 249.358 2.265 20 0 BEADLO CC[C@@H]1C[N@H+]([C@H](C)c2cnc(C)nc2C)CCO1 ZINC000681658039 487832647 /nfs/dbraw/zinc/83/26/47/487832647.db2.gz VNPOBPCIDDUPHP-DGCLKSJQSA-N 1 2 249.358 2.265 20 0 BEADLO CC(C)(CC(F)(F)F)C(=O)NCc1c[nH+]c[nH]1 ZINC000668995636 487844023 /nfs/dbraw/zinc/84/40/23/487844023.db2.gz OWONALVJRKIMRO-UHFFFAOYSA-N 1 2 249.236 2.005 20 0 BEADLO CC(C)(CC(F)(F)F)C(=O)NCc1c[nH]c[nH+]1 ZINC000668995636 487844025 /nfs/dbraw/zinc/84/40/25/487844025.db2.gz OWONALVJRKIMRO-UHFFFAOYSA-N 1 2 249.236 2.005 20 0 BEADLO CCc1cc(NC(=O)Cn2cc[nH+]c2)ccc1C ZINC000558421216 322950013 /nfs/dbraw/zinc/95/00/13/322950013.db2.gz BGLZYLILDPJYIF-UHFFFAOYSA-N 1 2 243.310 2.393 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cncc(F)c2)C[C@@H]1F ZINC000681751023 487846543 /nfs/dbraw/zinc/84/65/43/487846543.db2.gz PVTLUAZDJIWGCI-SKDRFNHKSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cncc(F)c2)C[C@@H]1F ZINC000681751023 487846545 /nfs/dbraw/zinc/84/65/45/487846545.db2.gz PVTLUAZDJIWGCI-SKDRFNHKSA-N 1 2 226.270 2.401 20 0 BEADLO CCc1cc(NCCCc2ccccn2)nc[nH+]1 ZINC000676413909 487848846 /nfs/dbraw/zinc/84/88/46/487848846.db2.gz ULMNAWJCUKEOCD-UHFFFAOYSA-N 1 2 242.326 2.479 20 0 BEADLO O[C@@H]1CC[N@H+](C[C@H]2CC=CCC2)CC1(F)F ZINC000668500485 487857362 /nfs/dbraw/zinc/85/73/62/487857362.db2.gz ZTBWGUTVCMEJOE-WDEREUQCSA-N 1 2 231.286 2.045 20 0 BEADLO O[C@@H]1CC[N@@H+](C[C@H]2CC=CCC2)CC1(F)F ZINC000668500485 487857365 /nfs/dbraw/zinc/85/73/65/487857365.db2.gz ZTBWGUTVCMEJOE-WDEREUQCSA-N 1 2 231.286 2.045 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cncs2)[C@@H](C)CO1 ZINC000651930989 487869838 /nfs/dbraw/zinc/86/98/38/487869838.db2.gz IRMCUMMVBZWEFG-UWVGGRQHSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cncs2)[C@@H](C)CO1 ZINC000651930989 487869842 /nfs/dbraw/zinc/86/98/42/487869842.db2.gz IRMCUMMVBZWEFG-UWVGGRQHSA-N 1 2 226.345 2.142 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCCC(F)(F)F ZINC000518396468 322962967 /nfs/dbraw/zinc/96/29/67/322962967.db2.gz GCAXUPHIKLIUFX-UHFFFAOYSA-N 1 2 233.237 2.270 20 0 BEADLO Cn1ncnc1C[N@H+](C)C(C)(C)c1ccccc1 ZINC000671246835 487892807 /nfs/dbraw/zinc/89/28/07/487892807.db2.gz PAZMIVKEMXGGAI-UHFFFAOYSA-N 1 2 244.342 2.182 20 0 BEADLO Cn1ncnc1C[N@@H+](C)C(C)(C)c1ccccc1 ZINC000671246835 487892809 /nfs/dbraw/zinc/89/28/09/487892809.db2.gz PAZMIVKEMXGGAI-UHFFFAOYSA-N 1 2 244.342 2.182 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2cc(C)no2)cn1 ZINC000676721276 487905215 /nfs/dbraw/zinc/90/52/15/487905215.db2.gz LYFBCMABANFJDZ-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2cc(C)no2)cn1 ZINC000676721276 487905217 /nfs/dbraw/zinc/90/52/17/487905217.db2.gz LYFBCMABANFJDZ-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO CCC[C@@H]([NH2+]CCC(C)(F)F)C(=O)OCC ZINC000357696323 487917517 /nfs/dbraw/zinc/91/75/17/487917517.db2.gz GOORMBUHHZFCNG-SECBINFHSA-N 1 2 237.290 2.353 20 0 BEADLO CC=CC[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000682220726 487928312 /nfs/dbraw/zinc/92/83/12/487928312.db2.gz FZAUYFRHWYWNRZ-ZZKXABKFSA-N 1 2 228.299 2.060 20 0 BEADLO CCc1cc[nH+]cc1N[C@@H](CC)COC ZINC000651979499 487939161 /nfs/dbraw/zinc/93/91/61/487939161.db2.gz VQZWKQSIVYIHNP-NSHDSACASA-N 1 2 208.305 2.481 20 0 BEADLO CC[C@@H](C)CN(C)C(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000668564786 487940726 /nfs/dbraw/zinc/94/07/26/487940726.db2.gz ATDSROYPJSPPQD-IJLUTSLNSA-N 1 2 249.358 2.028 20 0 BEADLO CC[C@@H](C)OCC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000676882301 487940489 /nfs/dbraw/zinc/94/04/89/487940489.db2.gz KUCKDPZBMTXFSL-SNVBAGLBSA-N 1 2 247.298 2.088 20 0 BEADLO CCc1cc(NCc2ncccc2F)nc[nH+]1 ZINC000676879549 487940915 /nfs/dbraw/zinc/94/09/15/487940915.db2.gz YZHLPHFVMDYSFP-UHFFFAOYSA-N 1 2 232.262 2.185 20 0 BEADLO CC[C@@H](C)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000667142228 487946039 /nfs/dbraw/zinc/94/60/39/487946039.db2.gz OWGPJLORJPOPIA-DDHJBXDOSA-N 1 2 249.358 2.074 20 0 BEADLO Oc1ccc(C[N@@H+]2CCC[C@@H]2c2ncon2)cc1 ZINC000682405823 487949673 /nfs/dbraw/zinc/94/96/73/487949673.db2.gz XCNUPQCKNUJTIW-GFCCVEGCSA-N 1 2 245.282 2.112 20 0 BEADLO Oc1ccc(C[N@H+]2CCC[C@@H]2c2ncon2)cc1 ZINC000682405823 487949676 /nfs/dbraw/zinc/94/96/76/487949676.db2.gz XCNUPQCKNUJTIW-GFCCVEGCSA-N 1 2 245.282 2.112 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1CCC[C@H](O)C1 ZINC000227692818 322974046 /nfs/dbraw/zinc/97/40/46/322974046.db2.gz FSGGNIOCQPLCCD-QWRGUYRKSA-N 1 2 236.315 2.053 20 0 BEADLO FC1(CNc2ccc(Cn3cc[nH+]c3)cn2)CC1 ZINC000560459912 322987407 /nfs/dbraw/zinc/98/74/07/322987407.db2.gz HQKLWDIPRQRHKI-UHFFFAOYSA-N 1 2 246.289 2.240 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CC[C@@H]2C[C@@H]2C1)c1[nH]cc[nH+]1 ZINC000569624108 322999723 /nfs/dbraw/zinc/99/97/23/322999723.db2.gz RDZIZZSOOKLSCF-GWOFURMSSA-N 1 2 233.315 2.023 20 0 BEADLO CN(C)c1ccc(NCc2cccc(O)c2)[nH+]c1 ZINC000150897989 323002062 /nfs/dbraw/zinc/00/20/62/323002062.db2.gz LHKFEGPPYBYQNA-UHFFFAOYSA-N 1 2 243.310 2.465 20 0 BEADLO Cc1noc(C)c1CNc1ccc(N(C)C)c[nH+]1 ZINC000150903902 323002436 /nfs/dbraw/zinc/00/24/36/323002436.db2.gz KEVOEBQWKYKHOL-UHFFFAOYSA-N 1 2 246.314 2.365 20 0 BEADLO Cc1oncc1C[N@H+]1CCOC[C@H]1CC(C)C ZINC000128645969 323007511 /nfs/dbraw/zinc/00/75/11/323007511.db2.gz MSMNMNYQQFYVMX-CYBMUJFWSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1oncc1C[N@@H+]1CCOC[C@H]1CC(C)C ZINC000128645969 323007512 /nfs/dbraw/zinc/00/75/12/323007512.db2.gz MSMNMNYQQFYVMX-CYBMUJFWSA-N 1 2 238.331 2.230 20 0 BEADLO c1cc(-c2n[nH]cc2CNc2c[nH]c[nH+]2)cs1 ZINC000562211653 323013409 /nfs/dbraw/zinc/01/34/09/323013409.db2.gz OHEQNJKGAXQFLB-UHFFFAOYSA-N 1 2 245.311 2.473 20 0 BEADLO CC(C)N(C)c1ccc(CNc2c[nH]cn2)c[nH+]1 ZINC000562211689 323013472 /nfs/dbraw/zinc/01/34/72/323013472.db2.gz PHJNOJMYNSUWQZ-UHFFFAOYSA-N 1 2 245.330 2.261 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1CC12CCOCC2 ZINC000564739678 323016242 /nfs/dbraw/zinc/01/62/42/323016242.db2.gz FWVSYCZVNPEKGB-NSHDSACASA-N 1 2 233.315 2.074 20 0 BEADLO CCOC1(C)C[NH+](Cc2ccc3[nH]cnc3c2)C1 ZINC000562686711 323027650 /nfs/dbraw/zinc/02/76/50/323027650.db2.gz NIYLPGYFYYMRRQ-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO CCOC1(C)C[NH+](Cc2ccc3nc[nH]c3c2)C1 ZINC000562686711 323027651 /nfs/dbraw/zinc/02/76/51/323027651.db2.gz NIYLPGYFYYMRRQ-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO CC[C@]1(C(C)C)C[C@H]1NC(=O)CCc1c[nH+]c[nH]1 ZINC000562962526 323036497 /nfs/dbraw/zinc/03/64/97/323036497.db2.gz UNOCZVPKVGMABD-TZMCWYRMSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@]1(C(C)C)C[C@H]1NC(=O)CCc1c[nH]c[nH+]1 ZINC000562962526 323036498 /nfs/dbraw/zinc/03/64/98/323036498.db2.gz UNOCZVPKVGMABD-TZMCWYRMSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CCC[C@H](C)CC1 ZINC000569707244 323037869 /nfs/dbraw/zinc/03/78/69/323037869.db2.gz WRPMAAMQMRJQBJ-NWDGAFQWSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CCC[C@H](C)CC1 ZINC000569707244 323037870 /nfs/dbraw/zinc/03/78/70/323037870.db2.gz WRPMAAMQMRJQBJ-NWDGAFQWSA-N 1 2 249.358 2.237 20 0 BEADLO Cc1c[nH+]c(C)nc1NCC1(C2CC2)CC1 ZINC000569866923 323043217 /nfs/dbraw/zinc/04/32/17/323043217.db2.gz CTUHIELWZZOMGV-UHFFFAOYSA-N 1 2 217.316 2.117 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N(C)CC(C)C)ccn12 ZINC000570057136 323048770 /nfs/dbraw/zinc/04/87/70/323048770.db2.gz UFCXKOJGEBIHEO-UHFFFAOYSA-N 1 2 245.326 2.371 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000570051538 323048892 /nfs/dbraw/zinc/04/88/92/323048892.db2.gz ZOIBNECCFSNEGF-YRGRVCCFSA-N 1 2 249.358 2.385 20 0 BEADLO CCCCNc1nc(C2CC2)[nH+]c(C)c1OC ZINC000570324425 323056116 /nfs/dbraw/zinc/05/61/16/323056116.db2.gz YZSGJNUERIUFBD-UHFFFAOYSA-N 1 2 235.331 2.305 20 0 BEADLO CCN(C(=O)[C@H](C)Cc1c[nH+]c[nH]1)C1CCCC1 ZINC000570526483 323062192 /nfs/dbraw/zinc/06/21/92/323062192.db2.gz JICRJBJJQNUSLV-LLVKDONJSA-N 1 2 249.358 2.379 20 0 BEADLO CCN(C(=O)[C@H](C)Cc1c[nH]c[nH+]1)C1CCCC1 ZINC000570526483 323062193 /nfs/dbraw/zinc/06/21/93/323062193.db2.gz JICRJBJJQNUSLV-LLVKDONJSA-N 1 2 249.358 2.379 20 0 BEADLO CC[C@@H](F)C[NH+]1CCN(c2nccs2)CC1 ZINC000570632054 323065278 /nfs/dbraw/zinc/06/52/78/323065278.db2.gz SDGRBUSNMSJIQP-SNVBAGLBSA-N 1 2 243.351 2.013 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)[C@@H](C)C2CC2)[nH+]1 ZINC000570638673 323065783 /nfs/dbraw/zinc/06/57/83/323065783.db2.gz CCNLDWRFVQUSQA-VIFPVBQESA-N 1 2 235.331 2.116 20 0 BEADLO Cc1ncsc1C[NH2+]Cc1nc(C)c(C)[nH]1 ZINC000570868577 323073249 /nfs/dbraw/zinc/07/32/49/323073249.db2.gz SGSGSYVOFZGXIK-UHFFFAOYSA-N 1 2 236.344 2.081 20 0 BEADLO Cc1ncsc1CNCc1[nH]c(C)c(C)[nH+]1 ZINC000570868577 323073250 /nfs/dbraw/zinc/07/32/50/323073250.db2.gz SGSGSYVOFZGXIK-UHFFFAOYSA-N 1 2 236.344 2.081 20 0 BEADLO Cc1cc(N2CCC(OC(C)C)CC2)nc[nH+]1 ZINC000531153254 323079293 /nfs/dbraw/zinc/07/92/93/323079293.db2.gz SONYOXNDUOWKAL-UHFFFAOYSA-N 1 2 235.331 2.179 20 0 BEADLO CSc1ccc(NCc2[nH]cc[nH+]2)cn1 ZINC000119364783 323083932 /nfs/dbraw/zinc/08/39/32/323083932.db2.gz UOOSDNMNRSEHPV-UHFFFAOYSA-N 1 2 220.301 2.139 20 0 BEADLO CC(C)CC(C)(C)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000531234394 323086112 /nfs/dbraw/zinc/08/61/12/323086112.db2.gz CNDGDMJDNQERJU-UHFFFAOYSA-N 1 2 249.358 2.339 20 0 BEADLO Cc1c[nH+]c(CCSc2nncn2C)c(C)c1 ZINC000563112980 323093158 /nfs/dbraw/zinc/09/31/58/323093158.db2.gz LTUUGEDSSOILJL-UHFFFAOYSA-N 1 2 248.355 2.162 20 0 BEADLO CCOc1cc(CNc2c[nH]c[nH+]2)ccc1O ZINC000563119758 323094095 /nfs/dbraw/zinc/09/40/95/323094095.db2.gz CMNQVJWIBSNOSN-UHFFFAOYSA-N 1 2 233.271 2.126 20 0 BEADLO CCCC[C@H]([NH2+][C@H]1CS[C@@H](C)C1)C(=O)OC ZINC000397919702 323101162 /nfs/dbraw/zinc/10/11/62/323101162.db2.gz GRTHWKLMRFTCLZ-AXFHLTTASA-N 1 2 245.388 2.202 20 0 BEADLO C[C@H](CC(=O)N1C[C@H]2CCC[C@@H]2C1)n1cc[nH+]c1 ZINC000563216445 323103146 /nfs/dbraw/zinc/10/31/46/323103146.db2.gz GTZJFBOWVANDME-JHJVBQTASA-N 1 2 247.342 2.093 20 0 BEADLO c1cn(C2CN(c3nc4ccccc4o3)C2)c[nH+]1 ZINC000531578138 323109714 /nfs/dbraw/zinc/10/97/14/323109714.db2.gz LSGQCCRULWJTPW-UHFFFAOYSA-N 1 2 240.266 2.086 20 0 BEADLO CCCC1(C(=O)NCCCCn2cc[nH+]c2)CC1 ZINC000531611961 323110420 /nfs/dbraw/zinc/11/04/20/323110420.db2.gz DKWVKOANGDIDBA-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)C[C@@H]1C=CCC1 ZINC000047975903 323113032 /nfs/dbraw/zinc/11/30/32/323113032.db2.gz JEPCWEGSNYXSEZ-LLVKDONJSA-N 1 2 245.326 2.442 20 0 BEADLO C[C@H]([NH2+]Cc1ccccc1CO)c1cscn1 ZINC000534328501 323116948 /nfs/dbraw/zinc/11/69/48/323116948.db2.gz OQIWHUGRQYRTTI-JTQLQIEISA-N 1 2 248.351 2.486 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)Cc1nccs1 ZINC000563420080 323123953 /nfs/dbraw/zinc/12/39/53/323123953.db2.gz KOTBAWLIVUOYBF-UHFFFAOYSA-N 1 2 234.328 2.186 20 0 BEADLO CC[C@H](C)[NH2+]Cc1[nH]ncc1Br ZINC000307998781 323127837 /nfs/dbraw/zinc/12/78/37/323127837.db2.gz XYYDQLIRFPXPHN-LURJTMIESA-N 1 2 232.125 2.060 20 0 BEADLO Cc1nsc(C)c1C[N@@H+]1CCOCC12CC2 ZINC000565167412 323128008 /nfs/dbraw/zinc/12/80/08/323128008.db2.gz YWERPIXTFVQTNJ-UHFFFAOYSA-N 1 2 238.356 2.125 20 0 BEADLO Cc1nsc(C)c1C[N@H+]1CCOCC12CC2 ZINC000565167412 323128009 /nfs/dbraw/zinc/12/80/09/323128009.db2.gz YWERPIXTFVQTNJ-UHFFFAOYSA-N 1 2 238.356 2.125 20 0 BEADLO Cc1noc([C@@H](C)[N@H+](C)Cc2ccncc2C)n1 ZINC000563550040 323129879 /nfs/dbraw/zinc/12/98/79/323129879.db2.gz OWDWGXAKXLIYKM-SNVBAGLBSA-N 1 2 246.314 2.274 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+](C)Cc2ccncc2C)n1 ZINC000563550040 323129880 /nfs/dbraw/zinc/12/98/80/323129880.db2.gz OWDWGXAKXLIYKM-SNVBAGLBSA-N 1 2 246.314 2.274 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)Nc1ccsc1 ZINC000563636514 323133158 /nfs/dbraw/zinc/13/31/58/323133158.db2.gz MCUYEVMUOLTMFN-QMMMGPOBSA-N 1 2 235.312 2.289 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)Nc1ccsc1 ZINC000563636514 323133159 /nfs/dbraw/zinc/13/31/59/323133159.db2.gz MCUYEVMUOLTMFN-QMMMGPOBSA-N 1 2 235.312 2.289 20 0 BEADLO COC(=O)C1([NH2+]CC=C(C)C)CCCCC1 ZINC000111246150 323157753 /nfs/dbraw/zinc/15/77/53/323157753.db2.gz SSAVSIRCNNYDAP-UHFFFAOYSA-N 1 2 225.332 2.418 20 0 BEADLO Cc1cc(NC(=O)NCCCC2CC2)c(C)c[nH+]1 ZINC000535059387 323164825 /nfs/dbraw/zinc/16/48/25/323164825.db2.gz MBBDENYZGYOGQJ-UHFFFAOYSA-N 1 2 247.342 2.432 20 0 BEADLO CC[C@@H](C)N(C)C(=O)Nc1cc(C)[nH+]cc1C ZINC000535061472 323164888 /nfs/dbraw/zinc/16/48/88/323164888.db2.gz ZIBHLWXVYMSQHU-LLVKDONJSA-N 1 2 235.331 2.383 20 0 BEADLO CC[C@H]1CCN(C(=O)Nc2cc(C)[nH+]cc2C)C1 ZINC000535061338 323164899 /nfs/dbraw/zinc/16/48/99/323164899.db2.gz XDFVYUZDXOVDAM-LBPRGKRZSA-N 1 2 247.342 2.384 20 0 BEADLO CC[C@@H]1CCN(C(=O)Nc2cc(C)[nH+]cc2C)C1 ZINC000535061335 323164955 /nfs/dbraw/zinc/16/49/55/323164955.db2.gz XDFVYUZDXOVDAM-GFCCVEGCSA-N 1 2 247.342 2.384 20 0 BEADLO CC(C)c1nc(N(C)[C@@H]2CCCOC2)cc[nH+]1 ZINC000343265354 323174246 /nfs/dbraw/zinc/17/42/46/323174246.db2.gz BWRJWDLZNLLXCQ-LLVKDONJSA-N 1 2 235.331 2.215 20 0 BEADLO C[C@H](CCc1ccco1)Nc1c[nH]c[nH+]1 ZINC000308835821 323179926 /nfs/dbraw/zinc/17/99/26/323179926.db2.gz IAMFFMMESUUBMT-SECBINFHSA-N 1 2 205.261 2.436 20 0 BEADLO CC[C@H]1CCCC[C@H]1CNC(=O)Cn1cc[nH+]c1 ZINC000563861123 323181479 /nfs/dbraw/zinc/18/14/79/323181479.db2.gz LIFADLPDXDLQAR-STQMWFEESA-N 1 2 249.358 2.216 20 0 BEADLO CC1(C)CCC[C@H]1CCNC(=O)Cn1cc[nH+]c1 ZINC000529565736 323184276 /nfs/dbraw/zinc/18/42/76/323184276.db2.gz VRYPTNYWLDIWFN-LBPRGKRZSA-N 1 2 249.358 2.216 20 0 BEADLO CC1=CCN(c2nc(N)c3ccccc3[nH+]2)CC1 ZINC000535719684 323189101 /nfs/dbraw/zinc/18/91/01/323189101.db2.gz SBXKAQWMLKELDF-UHFFFAOYSA-N 1 2 240.310 2.199 20 0 BEADLO CCC1(C(=O)Nc2cc(C)[nH+]cc2C)CC1 ZINC000535749086 323190384 /nfs/dbraw/zinc/19/03/84/323190384.db2.gz FQNQBAYCTJRDKQ-UHFFFAOYSA-N 1 2 218.300 2.249 20 0 BEADLO Cc1cc(NC(=O)N2C[C@@H](C)[C@H](C)C2)c(C)c[nH+]1 ZINC000535773612 323190829 /nfs/dbraw/zinc/19/08/29/323190829.db2.gz XYSUFSLRADZNSE-GHMZBOCLSA-N 1 2 247.342 2.240 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NCC[C@@H]1CC=CCC1 ZINC000529869154 323193154 /nfs/dbraw/zinc/19/31/54/323193154.db2.gz RVTWYPMCWCHJBR-GFCCVEGCSA-N 1 2 247.342 2.123 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)NCC[C@@H]1CC=CCC1 ZINC000529869154 323193155 /nfs/dbraw/zinc/19/31/55/323193155.db2.gz RVTWYPMCWCHJBR-GFCCVEGCSA-N 1 2 247.342 2.123 20 0 BEADLO CCC1(C)CN(C(=O)C[C@H](C)n2cc[nH+]c2)C1 ZINC000563892670 323194749 /nfs/dbraw/zinc/19/47/49/323194749.db2.gz TYIQXPUOXNNVQM-NSHDSACASA-N 1 2 235.331 2.093 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2CCC[C@H]2C)c(C)c[nH+]1 ZINC000536619811 323198887 /nfs/dbraw/zinc/19/88/87/323198887.db2.gz CXLMLMSDYDMVRD-SKDRFNHKSA-N 1 2 247.342 2.430 20 0 BEADLO Cc1cc(NC(=O)N2CCC(C)CC2)c(C)c[nH+]1 ZINC000536620025 323198910 /nfs/dbraw/zinc/19/89/10/323198910.db2.gz OZYNNENSJUFCIY-UHFFFAOYSA-N 1 2 247.342 2.384 20 0 BEADLO Cc1cc(NC(=O)N2CC=C(C)CC2)c(C)c[nH+]1 ZINC000536619719 323198924 /nfs/dbraw/zinc/19/89/24/323198924.db2.gz YYXDKEWPMHOPGK-UHFFFAOYSA-N 1 2 245.326 2.304 20 0 BEADLO O=C(NCCc1[nH]cc[nH+]1)[C@@H]1CC12CCCCC2 ZINC000532167831 323208172 /nfs/dbraw/zinc/20/81/72/323208172.db2.gz XQYGREBPXIXQQT-NSHDSACASA-N 1 2 247.342 2.039 20 0 BEADLO CCOC(=O)C[N@H+](CC(C)C)CC1(F)CC1 ZINC000526969786 323309192 /nfs/dbraw/zinc/30/91/92/323309192.db2.gz UMSSTTWLKLBQOB-UHFFFAOYSA-N 1 2 231.311 2.010 20 0 BEADLO CCOC(=O)C[N@@H+](CC(C)C)CC1(F)CC1 ZINC000526969786 323309194 /nfs/dbraw/zinc/30/91/94/323309194.db2.gz UMSSTTWLKLBQOB-UHFFFAOYSA-N 1 2 231.311 2.010 20 0 BEADLO CCC[C@@H](C)CC(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000564006732 323348309 /nfs/dbraw/zinc/34/83/09/323348309.db2.gz QYKVRFZOAHGWNW-NXEZZACHSA-N 1 2 223.320 2.413 20 0 BEADLO CCc1nc(C[N@H+](C)[C@@H](C)C(C)(C)C)no1 ZINC000532928574 323397052 /nfs/dbraw/zinc/39/70/52/323397052.db2.gz QWWLKDHQBZCBRZ-VIFPVBQESA-N 1 2 225.336 2.498 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@@H](C)C(C)(C)C)no1 ZINC000532928574 323397054 /nfs/dbraw/zinc/39/70/54/323397054.db2.gz QWWLKDHQBZCBRZ-VIFPVBQESA-N 1 2 225.336 2.498 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000571701441 323466520 /nfs/dbraw/zinc/46/65/20/323466520.db2.gz XKMVMGGMDIVMHH-OPRDCNLKSA-N 1 2 221.304 2.023 20 0 BEADLO COc1ccc[nH+]c1N(C)C[C@H]1CCCCO1 ZINC000527858725 323711035 /nfs/dbraw/zinc/71/10/35/323711035.db2.gz VDBZWITWMQCSCI-LLVKDONJSA-N 1 2 236.315 2.096 20 0 BEADLO COc1ccc[nH+]c1NC1CC(F)(F)C1 ZINC000527977346 323740515 /nfs/dbraw/zinc/74/05/15/323740515.db2.gz IAPISJPVCPOGPA-UHFFFAOYSA-N 1 2 214.215 2.300 20 0 BEADLO OC[C@]1(F)CCN(c2[nH+]ccc3ccccc32)C1 ZINC000528010731 323749482 /nfs/dbraw/zinc/74/94/82/323749482.db2.gz RFCKKPRAYZBLGK-AWEZNQCLSA-N 1 2 246.285 2.146 20 0 BEADLO CC[N@H+](Cc1ccoc1)[C@@H](C)c1nccc(N)n1 ZINC000653536509 487960413 /nfs/dbraw/zinc/96/04/13/487960413.db2.gz YDIRYPIYAGPDPT-JTQLQIEISA-N 1 2 246.314 2.065 20 0 BEADLO CC[N@@H+](Cc1ccoc1)[C@@H](C)c1nccc(N)n1 ZINC000653536509 487960416 /nfs/dbraw/zinc/96/04/16/487960416.db2.gz YDIRYPIYAGPDPT-JTQLQIEISA-N 1 2 246.314 2.065 20 0 BEADLO Cc1cc(NCC2CC=CC2)nc(C2CC2)[nH+]1 ZINC000528117479 323768693 /nfs/dbraw/zinc/76/86/93/323768693.db2.gz XOFHYHYNWLEADJ-UHFFFAOYSA-N 1 2 229.327 2.462 20 0 BEADLO Fc1ccc2cc[nH+]c(NCC3COC3)c2c1 ZINC000528225740 323785021 /nfs/dbraw/zinc/78/50/21/323785021.db2.gz KGYNULZAGWMDLC-UHFFFAOYSA-N 1 2 232.258 2.432 20 0 BEADLO C[C@H]1CCCC[C@H]1C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000572595546 324136888 /nfs/dbraw/zinc/13/68/88/324136888.db2.gz LVVYYWOPMVNSIX-WCQYABFASA-N 1 2 247.342 2.093 20 0 BEADLO C[C@@H](CO)[N@H+](C)Cc1c(F)ccc(F)c1Cl ZINC000529566264 324342800 /nfs/dbraw/zinc/34/28/00/324342800.db2.gz DNOSCUXICVYVFV-ZETCQYMHSA-N 1 2 249.688 2.431 20 0 BEADLO C[C@@H](CO)[N@@H+](C)Cc1c(F)ccc(F)c1Cl ZINC000529566264 324342805 /nfs/dbraw/zinc/34/28/05/324342805.db2.gz DNOSCUXICVYVFV-ZETCQYMHSA-N 1 2 249.688 2.431 20 0 BEADLO Fc1ccc(C[NH+]2CC(CC(F)F)C2)nc1 ZINC000529611050 324363912 /nfs/dbraw/zinc/36/39/12/324363912.db2.gz JKDKDSXHGBNFJN-UHFFFAOYSA-N 1 2 230.233 2.308 20 0 BEADLO Cc1[nH]c(CN2CC(Cc3ccco3)C2)[nH+]c1C ZINC000529648411 324371441 /nfs/dbraw/zinc/37/14/41/324371441.db2.gz BWOBKKFTFLTVHS-UHFFFAOYSA-N 1 2 245.326 2.294 20 0 BEADLO CC1(C)C[C@@H]1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000677059445 487963142 /nfs/dbraw/zinc/96/31/42/487963142.db2.gz LOOCBFSFKNTYDK-SNVBAGLBSA-N 1 2 229.283 2.319 20 0 BEADLO CNc1[nH+]cnc2c1cnn2CC1CC(C)(C)C1 ZINC000530163545 324500506 /nfs/dbraw/zinc/50/05/06/324500506.db2.gz OUHKJWDDDNAWOV-UHFFFAOYSA-N 1 2 245.330 2.304 20 0 BEADLO COc1ccc[nH+]c1NCC1(O)CCCCC1 ZINC000128136094 324808356 /nfs/dbraw/zinc/80/83/56/324808356.db2.gz CQIPAHWBDWVROW-UHFFFAOYSA-N 1 2 236.315 2.197 20 0 BEADLO Cc1nc(C[NH+]2CC(C)(C)OC(C)(C)C2)co1 ZINC000660377427 487965615 /nfs/dbraw/zinc/96/56/15/487965615.db2.gz CYWDLBDLXGSTOK-UHFFFAOYSA-N 1 2 238.331 2.372 20 0 BEADLO Cc1cc(C[NH2+]Cc2cnn(CC(C)C)c2)no1 ZINC000542013664 325003837 /nfs/dbraw/zinc/00/38/37/325003837.db2.gz WEEUVJAOGYINCC-UHFFFAOYSA-N 1 2 248.330 2.125 20 0 BEADLO Cc1noc(C[NH2+][C@H](C)c2cnn(C(C)C)c2)n1 ZINC000542574811 325035157 /nfs/dbraw/zinc/03/51/57/325035157.db2.gz WLZTVSGZXWPOBT-SECBINFHSA-N 1 2 249.318 2.006 20 0 BEADLO CCC[C@H](C)C(=O)Nc1c[nH+]ccc1OC ZINC000131388423 325144199 /nfs/dbraw/zinc/14/41/99/325144199.db2.gz JDRGDNAHWFEBEW-VIFPVBQESA-N 1 2 222.288 2.465 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2cccc(F)c2)o1 ZINC000544513961 325144978 /nfs/dbraw/zinc/14/49/78/325144978.db2.gz VHRGFURNJXIFFJ-MRVPVSSYSA-N 1 2 235.262 2.368 20 0 BEADLO CC(=O)c1c[nH]c(C(=O)Nc2cc[nH+]c(C)c2)c1 ZINC000073069468 325187463 /nfs/dbraw/zinc/18/74/63/325187463.db2.gz ITYFIXCDFVSCRN-UHFFFAOYSA-N 1 2 243.266 2.173 20 0 BEADLO CC(C)c1nc(C[N@H+](C)C2CCC2)no1 ZINC000075841814 325316837 /nfs/dbraw/zinc/31/68/37/325316837.db2.gz OJGXJDDCWLTHEO-UHFFFAOYSA-N 1 2 209.293 2.177 20 0 BEADLO CC(C)c1nc(C[N@@H+](C)C2CCC2)no1 ZINC000075841814 325316839 /nfs/dbraw/zinc/31/68/39/325316839.db2.gz OJGXJDDCWLTHEO-UHFFFAOYSA-N 1 2 209.293 2.177 20 0 BEADLO COc1cc[nH+]cc1NC(=O)Nc1cccnc1 ZINC000133851425 325324295 /nfs/dbraw/zinc/32/42/95/325324295.db2.gz MVVAAIAOVFUZIX-UHFFFAOYSA-N 1 2 244.254 2.129 20 0 BEADLO C[C@H]1C[NH+](Cc2nnsc2Cl)C[C@@H]1C ZINC000076112065 325331919 /nfs/dbraw/zinc/33/19/19/325331919.db2.gz SMCDDKDBWKDGJC-BQBZGAKWSA-N 1 2 231.752 2.279 20 0 BEADLO C[C@H]1CC[C@H](c2nc(Cc3c[nH+]cn3C)no2)C1 ZINC000547257103 325334244 /nfs/dbraw/zinc/33/42/44/325334244.db2.gz KHVGBYPXCMTGJI-UWVGGRQHSA-N 1 2 246.314 2.298 20 0 BEADLO O=C(NCCc1[nH]cc[nH+]1)c1ccc(Cl)cc1 ZINC000134496674 325361547 /nfs/dbraw/zinc/36/15/47/325361547.db2.gz IVMMFHJSPMSFSH-UHFFFAOYSA-N 1 2 249.701 2.036 20 0 BEADLO CCCC[C@H]([NH2+][C@H](C)CSC)C(=O)OC ZINC000135225811 325400774 /nfs/dbraw/zinc/40/07/74/325400774.db2.gz UMBBKPGLWVWKBP-ZJUUUORDSA-N 1 2 233.377 2.059 20 0 BEADLO CCCC[C@@H]([NH2+]CCC(F)(F)F)C(=O)OC ZINC000135234980 325401825 /nfs/dbraw/zinc/40/18/25/325401825.db2.gz ZZMYGNYRGGGFRT-MRVPVSSYSA-N 1 2 241.253 2.260 20 0 BEADLO CCCCc1noc(C[NH+]2[C@@H](C)C[C@@H]2C)n1 ZINC000548097940 325427550 /nfs/dbraw/zinc/42/75/50/325427550.db2.gz STUFJLNMGPDYPH-UWVGGRQHSA-N 1 2 223.320 2.395 20 0 BEADLO CC(C)[C@H]1C[C@H]1C(=O)NCCCCn1cc[nH+]c1 ZINC000548121309 325432589 /nfs/dbraw/zinc/43/25/89/325432589.db2.gz GVNAAXDAYBJTKT-CHWSQXEVSA-N 1 2 249.358 2.072 20 0 BEADLO Cc1cccc(NC(=O)C[C@H](C)n2cc[nH+]c2)n1 ZINC000551918912 325574389 /nfs/dbraw/zinc/57/43/89/325574389.db2.gz VPWKMXNQRVGFFE-NSHDSACASA-N 1 2 244.298 2.176 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H]1CC12CC2 ZINC000564886879 325822739 /nfs/dbraw/zinc/82/27/39/325822739.db2.gz UTNQDEGOTORFGO-JTQLQIEISA-N 1 2 231.299 2.372 20 0 BEADLO CC[N@H+](Cc1snnc1C)Cc1ccncc1 ZINC000566300081 326030767 /nfs/dbraw/zinc/03/07/67/326030767.db2.gz JDEPFDUYKPQBCO-UHFFFAOYSA-N 1 2 248.355 2.264 20 0 BEADLO CC[N@@H+](Cc1snnc1C)Cc1ccncc1 ZINC000566300081 326030770 /nfs/dbraw/zinc/03/07/70/326030770.db2.gz JDEPFDUYKPQBCO-UHFFFAOYSA-N 1 2 248.355 2.264 20 0 BEADLO C[C@@H](CC(=O)N(C)[C@H]1CC1(C)C)n1cc[nH+]c1 ZINC000566302832 326031353 /nfs/dbraw/zinc/03/13/53/326031353.db2.gz AWQLOEHMJFGICS-QWRGUYRKSA-N 1 2 235.331 2.091 20 0 BEADLO Cc1nnsc1C[N@@H+]1CCCc2occc2C1 ZINC000566306052 326031493 /nfs/dbraw/zinc/03/14/93/326031493.db2.gz DWLZSHXYMOJPSL-UHFFFAOYSA-N 1 2 249.339 2.388 20 0 BEADLO Cc1nnsc1C[N@H+]1CCCc2occc2C1 ZINC000566306052 326031494 /nfs/dbraw/zinc/03/14/94/326031494.db2.gz DWLZSHXYMOJPSL-UHFFFAOYSA-N 1 2 249.339 2.388 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccccc1)c1nccc(N)n1 ZINC000566416077 326042760 /nfs/dbraw/zinc/04/27/60/326042760.db2.gz MJAJBHNLIJFSDE-WDEREUQCSA-N 1 2 242.326 2.301 20 0 BEADLO C[C@@H](C(=O)Nc1ccccc1F)[NH+]1CC(C)C1 ZINC000566431079 326046282 /nfs/dbraw/zinc/04/62/82/326046282.db2.gz DUUMOAWGBZQTPX-JTQLQIEISA-N 1 2 236.290 2.104 20 0 BEADLO Cc1c[nH+]c(C)nc1N1C[C@H](C)[C@@H](C)C1 ZINC000566478422 326055117 /nfs/dbraw/zinc/05/51/17/326055117.db2.gz GIFIUKNCGUFZHI-UWVGGRQHSA-N 1 2 205.305 2.186 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)CCc1ccccn1 ZINC000566478914 326055159 /nfs/dbraw/zinc/05/51/59/326055159.db2.gz NHHMNWHLVGCZLF-UHFFFAOYSA-N 1 2 242.326 2.167 20 0 BEADLO Cc1[nH]c(CNc2ccc(C)nc2)[nH+]c1C ZINC000566571698 326065246 /nfs/dbraw/zinc/06/52/46/326065246.db2.gz ANHJXCFIBOQEBR-UHFFFAOYSA-N 1 2 216.288 2.342 20 0 BEADLO CC[C@@]1(C)CCN(C(=O)C[C@H](C)n2cc[nH+]c2)C1 ZINC000566623215 326069412 /nfs/dbraw/zinc/06/94/12/326069412.db2.gz BKMRSAPRCMNVRB-JSGCOSHPSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC[C@H](F)C2)cn1 ZINC000566625406 326069434 /nfs/dbraw/zinc/06/94/34/326069434.db2.gz RJJORIGABAPOPZ-LBPRGKRZSA-N 1 2 208.280 2.324 20 0 BEADLO Cc1ccc(C[N@H+]2CCC[C@H](F)C2)cn1 ZINC000566625406 326069435 /nfs/dbraw/zinc/06/94/35/326069435.db2.gz RJJORIGABAPOPZ-LBPRGKRZSA-N 1 2 208.280 2.324 20 0 BEADLO CC(C)C(C)(C)NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000566688219 326074696 /nfs/dbraw/zinc/07/46/96/326074696.db2.gz XQDRMVVEUPEKBY-JTQLQIEISA-N 1 2 237.347 2.139 20 0 BEADLO CC(C)C(C)(C)NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000566688219 326074698 /nfs/dbraw/zinc/07/46/98/326074698.db2.gz XQDRMVVEUPEKBY-JTQLQIEISA-N 1 2 237.347 2.139 20 0 BEADLO C[C@H](CC(=O)N1CCC(C)(C)CC1)n1cc[nH+]c1 ZINC000566859659 326089164 /nfs/dbraw/zinc/08/91/64/326089164.db2.gz AYDHSOHNZXJOQC-GFCCVEGCSA-N 1 2 249.358 2.483 20 0 BEADLO Cn1c[nH+]cc1CC(=O)NCC1CCCCCC1 ZINC000566897136 326091790 /nfs/dbraw/zinc/09/17/90/326091790.db2.gz XSIFNQJCOPPLAL-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO F[C@@H]1CCC[C@@H](Nc2cc[nH+]c(C3CC3)n2)C1 ZINC000566971397 326097952 /nfs/dbraw/zinc/09/79/52/326097952.db2.gz KYMLESUONRDZIE-GHMZBOCLSA-N 1 2 235.306 2.469 20 0 BEADLO CC(C)n1cccc1C(=O)Nc1cc[nH+]cc1O ZINC000153828971 326114975 /nfs/dbraw/zinc/11/49/75/326114975.db2.gz ZDRPZHAEKPQVPQ-UHFFFAOYSA-N 1 2 245.282 2.422 20 0 BEADLO C[C@@H]([NH2+]Cc1ncccc1F)c1cccnc1 ZINC000154874948 326169164 /nfs/dbraw/zinc/16/91/64/326169164.db2.gz XNAXLQGXBALRAD-SNVBAGLBSA-N 1 2 231.274 2.467 20 0 BEADLO CC[C@]1(C)C[C@@H]1C(=O)N(C)CCCn1cc[nH+]c1 ZINC000154960756 326175112 /nfs/dbraw/zinc/17/51/12/326175112.db2.gz FONIDXSMKOLSNA-TZMCWYRMSA-N 1 2 249.358 2.168 20 0 BEADLO CC[C@@H]1CCCCN1C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000567403352 326183882 /nfs/dbraw/zinc/18/38/82/326183882.db2.gz MPAHAPKYTMFOTC-WCQYABFASA-N 1 2 249.358 2.379 20 0 BEADLO CC[C@@H]1CCCCN1C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000567403352 326183885 /nfs/dbraw/zinc/18/38/85/326183885.db2.gz MPAHAPKYTMFOTC-WCQYABFASA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@H]1CC[C@@H](C)CC1 ZINC000567625423 326231753 /nfs/dbraw/zinc/23/17/53/326231753.db2.gz OYJAZBYQPKPLDB-IJLUTSLNSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@H]1CC[C@@H](C)CC1 ZINC000567625423 326231755 /nfs/dbraw/zinc/23/17/55/326231755.db2.gz OYJAZBYQPKPLDB-IJLUTSLNSA-N 1 2 249.358 2.283 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N3[C@H](C)C[C@@H]3C)ccn12 ZINC000567751294 326255573 /nfs/dbraw/zinc/25/55/73/326255573.db2.gz XYCZSPSOYYTCMD-AOOOYVTPSA-N 1 2 243.310 2.266 20 0 BEADLO COCc1cnc(C[NH2+]C2(CF)CCC2)s1 ZINC000567853777 326267061 /nfs/dbraw/zinc/26/70/61/326267061.db2.gz NRJMQCKPVOPTPV-UHFFFAOYSA-N 1 2 244.335 2.271 20 0 BEADLO CC[N@H+](CCCNC(C)=O)c1ccccc1C ZINC000157748820 326294323 /nfs/dbraw/zinc/29/43/23/326294323.db2.gz VVMIUONTGLEMIO-UHFFFAOYSA-N 1 2 234.343 2.348 20 0 BEADLO CC[N@@H+](CCCNC(C)=O)c1ccccc1C ZINC000157748820 326294326 /nfs/dbraw/zinc/29/43/26/326294326.db2.gz VVMIUONTGLEMIO-UHFFFAOYSA-N 1 2 234.343 2.348 20 0 BEADLO C[C@H](CC(=O)N1CCCC2(CC2)C1)n1cc[nH+]c1 ZINC000568032460 326298418 /nfs/dbraw/zinc/29/84/18/326298418.db2.gz DRPGEDGKLAPLBI-GFCCVEGCSA-N 1 2 247.342 2.237 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N[C@@H]3CC[C@H]3C)ccn12 ZINC000568212125 326326963 /nfs/dbraw/zinc/32/69/63/326326963.db2.gz UJPPUGUYGKTWGE-BXKDBHETSA-N 1 2 243.310 2.171 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N[C@@H]3CC[C@@H]3C)ccn12 ZINC000568212127 326327177 /nfs/dbraw/zinc/32/71/77/326327177.db2.gz UJPPUGUYGKTWGE-JOYOIKCWSA-N 1 2 243.310 2.171 20 0 BEADLO CCc1ccc([C@H](C)[NH2+]Cc2ncccn2)o1 ZINC000568276218 326340143 /nfs/dbraw/zinc/34/01/43/326340143.db2.gz ICGMVLBVFFIFPE-JTQLQIEISA-N 1 2 231.299 2.483 20 0 BEADLO CCC[N@H+](Cc1nsc(N(C)C)n1)C(C)C ZINC000568289529 326341687 /nfs/dbraw/zinc/34/16/87/326341687.db2.gz IUKQDEOORRXZDN-UHFFFAOYSA-N 1 2 242.392 2.225 20 0 BEADLO CCC[N@@H+](Cc1nsc(N(C)C)n1)C(C)C ZINC000568289529 326341688 /nfs/dbraw/zinc/34/16/88/326341688.db2.gz IUKQDEOORRXZDN-UHFFFAOYSA-N 1 2 242.392 2.225 20 0 BEADLO Cc1noc([C@@H](C)[N@H+](C)Cc2cccc(N)c2)n1 ZINC000568294769 326342653 /nfs/dbraw/zinc/34/26/53/326342653.db2.gz BLCAHMHGSZLHPA-SECBINFHSA-N 1 2 246.314 2.153 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+](C)Cc2cccc(N)c2)n1 ZINC000568294769 326342654 /nfs/dbraw/zinc/34/26/54/326342654.db2.gz BLCAHMHGSZLHPA-SECBINFHSA-N 1 2 246.314 2.153 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)c2c[nH]cc2C)[nH+]1 ZINC000568521489 326362745 /nfs/dbraw/zinc/36/27/45/326362745.db2.gz JAGIILSDTDYWLB-UHFFFAOYSA-N 1 2 246.314 2.020 20 0 BEADLO Cc1ccoc1C[N@@H+](C)[C@@H](C)c1nc(C)no1 ZINC000568710604 326373086 /nfs/dbraw/zinc/37/30/86/326373086.db2.gz WHMZQCGIJXPCEG-VIFPVBQESA-N 1 2 235.287 2.472 20 0 BEADLO Cc1ccoc1C[N@H+](C)[C@@H](C)c1nc(C)no1 ZINC000568710604 326373088 /nfs/dbraw/zinc/37/30/88/326373088.db2.gz WHMZQCGIJXPCEG-VIFPVBQESA-N 1 2 235.287 2.472 20 0 BEADLO c1[nH]cc(N[C@@H]2CCC[C@@H]([C@H]3CCOC3)C2)[nH+]1 ZINC000569161459 326393186 /nfs/dbraw/zinc/39/31/86/326393186.db2.gz AGVDQWDLXUNRDE-GRYCIOLGSA-N 1 2 235.331 2.417 20 0 BEADLO COC(=O)c1ccc(C[NH2+]CC(C)(F)F)cc1 ZINC000569151604 326393238 /nfs/dbraw/zinc/39/32/38/326393238.db2.gz QHCOPRRMJBMAPT-UHFFFAOYSA-N 1 2 243.253 2.218 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@H]2CCC[C@H]2C2CC2)c[nH+]1 ZINC000572847303 326414757 /nfs/dbraw/zinc/41/47/57/326414757.db2.gz GTTKIAGBQIRJPI-NEPJUHHUSA-N 1 2 247.342 2.274 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1CCO[C@H](C2CC2)C1 ZINC000572900068 326418074 /nfs/dbraw/zinc/41/80/74/326418074.db2.gz UNTIUPDXJFIRQC-OLZOCXBDSA-N 1 2 247.342 2.463 20 0 BEADLO CC(C)[C@@H](C)N(C)C(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000666027478 487986161 /nfs/dbraw/zinc/98/61/61/487986161.db2.gz RZDGHVVWMYBBHK-MNOVXSKESA-N 1 2 249.358 2.018 20 0 BEADLO CC(C)[C@@H](C)N(C)C(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000666027478 487986164 /nfs/dbraw/zinc/98/61/64/487986164.db2.gz RZDGHVVWMYBBHK-MNOVXSKESA-N 1 2 249.358 2.018 20 0 BEADLO CC/C=C/CNC(=O)Nc1cc(C)[nH+]cc1C ZINC000652797763 487988125 /nfs/dbraw/zinc/98/81/25/487988125.db2.gz AWICXUAJXOGDIP-AATRIKPKSA-N 1 2 233.315 2.208 20 0 BEADLO CCN1CC[N@H+]([C@H](C)c2ccccn2)C[C@@H]1C ZINC000677191405 487995102 /nfs/dbraw/zinc/99/51/02/487995102.db2.gz BTUAPMJJHCQLBU-QWHCGFSZSA-N 1 2 233.359 2.169 20 0 BEADLO CCN1CC[N@H+]([C@@H](C)c2ccccn2)C[C@H]1C ZINC000677191403 487994908 /nfs/dbraw/zinc/99/49/08/487994908.db2.gz BTUAPMJJHCQLBU-OLZOCXBDSA-N 1 2 233.359 2.169 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)c1ccc(C2CC2)cc1 ZINC000668603369 487995740 /nfs/dbraw/zinc/99/57/40/487995740.db2.gz DEXTVKYVZFCXQQ-UHFFFAOYSA-N 1 2 241.294 2.217 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1cocn1 ZINC000682673297 488010973 /nfs/dbraw/zinc/01/09/73/488010973.db2.gz NTEXDNKQHZBADO-UHFFFAOYSA-N 1 2 206.245 2.290 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1cocn1 ZINC000682673297 488010981 /nfs/dbraw/zinc/01/09/81/488010981.db2.gz NTEXDNKQHZBADO-UHFFFAOYSA-N 1 2 206.245 2.290 20 0 BEADLO CSCCC(=O)Nc1c(C)cc[nH+]c1C ZINC000425590643 488014439 /nfs/dbraw/zinc/01/44/39/488014439.db2.gz WWFLAYXROAWARS-UHFFFAOYSA-N 1 2 224.329 2.390 20 0 BEADLO C[C@H]1CC[C@H](C)N1c1cc(-n2cc[nH+]c2)ncn1 ZINC000675121031 488025593 /nfs/dbraw/zinc/02/55/93/488025593.db2.gz XQXMGSNNGZKZMM-QWRGUYRKSA-N 1 2 243.314 2.040 20 0 BEADLO CC(C)(C)c1nc(NC[C@H]2CC[C@H](O)C2)cc[nH+]1 ZINC000682721542 488026045 /nfs/dbraw/zinc/02/60/45/488026045.db2.gz ZBKGXBQHUPXSLX-QWRGUYRKSA-N 1 2 249.358 2.347 20 0 BEADLO Cc1noc([C@H](C)[N@H+]2CC=C(C)CC2)n1 ZINC000677379735 488026369 /nfs/dbraw/zinc/02/63/69/488026369.db2.gz HHVGHJRNZDMPEZ-VIFPVBQESA-N 1 2 207.277 2.091 20 0 BEADLO Cc1noc([C@H](C)[N@@H+]2CC=C(C)CC2)n1 ZINC000677379735 488026373 /nfs/dbraw/zinc/02/63/73/488026373.db2.gz HHVGHJRNZDMPEZ-VIFPVBQESA-N 1 2 207.277 2.091 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cn(C(C)(C)C)nn2)o1 ZINC000235894034 488028306 /nfs/dbraw/zinc/02/83/06/488028306.db2.gz UCKPBFQRLAKHPZ-UHFFFAOYSA-N 1 2 248.330 2.224 20 0 BEADLO CCc1nc(C[NH2+]Cc2cc(C)ncn2)cs1 ZINC000677425398 488033988 /nfs/dbraw/zinc/03/39/88/488033988.db2.gz RVNPEMYPTZWYPM-UHFFFAOYSA-N 1 2 248.355 2.094 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CCC[C@@H]3C[C@@H]32)cc[nH+]1 ZINC000668636107 488034607 /nfs/dbraw/zinc/03/46/07/488034607.db2.gz QQRGOXUNQATCIF-RTXFEEFZSA-N 1 2 230.311 2.187 20 0 BEADLO CCn1ccc(C[N@H+](C)Cc2cc(C)on2)c1 ZINC000682777533 488038001 /nfs/dbraw/zinc/03/80/01/488038001.db2.gz BURDIFZVVCWOBF-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CCn1ccc(C[N@@H+](C)Cc2cc(C)on2)c1 ZINC000682777533 488038004 /nfs/dbraw/zinc/03/80/04/488038004.db2.gz BURDIFZVVCWOBF-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CC(C(F)F)C1 ZINC000677474157 488044594 /nfs/dbraw/zinc/04/45/94/488044594.db2.gz AUJRMYXCJZLRQU-UHFFFAOYSA-N 1 2 229.274 2.161 20 0 BEADLO CC(C)n1ccnc1C[NH+]1CC2(CC(F)C2)C1 ZINC000677474597 488045619 /nfs/dbraw/zinc/04/56/19/488045619.db2.gz WNQUAIDHTOBPBZ-UHFFFAOYSA-N 1 2 237.322 2.398 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CC2(CC(F)C2)C1 ZINC000677474597 488045626 /nfs/dbraw/zinc/04/56/26/488045626.db2.gz WNQUAIDHTOBPBZ-UHFFFAOYSA-N 1 2 237.322 2.398 20 0 BEADLO Fc1cccc([C@H]2CC[N@@H+]2Cc2cn[nH]c2)c1 ZINC000678284050 488067186 /nfs/dbraw/zinc/06/71/86/488067186.db2.gz UDCBCQURHYRAAH-CYBMUJFWSA-N 1 2 231.274 2.496 20 0 BEADLO Fc1cccc([C@H]2CC[N@H+]2Cc2cn[nH]c2)c1 ZINC000678284050 488067189 /nfs/dbraw/zinc/06/71/89/488067189.db2.gz UDCBCQURHYRAAH-CYBMUJFWSA-N 1 2 231.274 2.496 20 0 BEADLO CC[C@H](C)CNc1ccc(-n2cncn2)c[nH+]1 ZINC000682951579 488070768 /nfs/dbraw/zinc/07/07/68/488070768.db2.gz LLGMCTMUXMJOEC-JTQLQIEISA-N 1 2 231.303 2.120 20 0 BEADLO CCC[C@H](CNc1[nH+]cccc1OC)OC ZINC000393473598 488080450 /nfs/dbraw/zinc/08/04/50/488080450.db2.gz GPZDHOIFDGVHHP-SNVBAGLBSA-N 1 2 224.304 2.317 20 0 BEADLO CC(C)(NC(=O)CCc1c[nH+]c[nH]1)C1CCC1 ZINC000515602942 488084333 /nfs/dbraw/zinc/08/43/33/488084333.db2.gz GUVLNYZIBAIETL-UHFFFAOYSA-N 1 2 235.331 2.037 20 0 BEADLO CC(C)(NC(=O)CCc1c[nH]c[nH+]1)C1CCC1 ZINC000515602942 488084336 /nfs/dbraw/zinc/08/43/36/488084336.db2.gz GUVLNYZIBAIETL-UHFFFAOYSA-N 1 2 235.331 2.037 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H]1CCC1(C)C ZINC000667679494 488085442 /nfs/dbraw/zinc/08/54/42/488085442.db2.gz GNGVBIDSUTZCTQ-VIFPVBQESA-N 1 2 234.299 2.465 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2ccsc2)nc1 ZINC000677676219 488091163 /nfs/dbraw/zinc/09/11/63/488091163.db2.gz NVIOWWUZKDKTAY-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2ccsc2)nc1 ZINC000677676219 488091166 /nfs/dbraw/zinc/09/11/66/488091166.db2.gz NVIOWWUZKDKTAY-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CC[C@H]1CC[C@H](C)N1c1cc(CO)cc[nH+]1 ZINC000136427542 488101616 /nfs/dbraw/zinc/10/16/16/488101616.db2.gz KXIBBZGBDUUDAT-JQWIXIFHSA-N 1 2 220.316 2.341 20 0 BEADLO CCc1nnc(C[N@@H+](C)Cc2ccn(CC)c2)o1 ZINC000683031704 488101910 /nfs/dbraw/zinc/10/19/10/488101910.db2.gz ZRZAFALIJVOZCG-UHFFFAOYSA-N 1 2 248.330 2.085 20 0 BEADLO CCc1nnc(C[N@H+](C)Cc2ccn(CC)c2)o1 ZINC000683031704 488101913 /nfs/dbraw/zinc/10/19/13/488101913.db2.gz ZRZAFALIJVOZCG-UHFFFAOYSA-N 1 2 248.330 2.085 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1c1cc(CO)cc[nH+]1 ZINC000136427579 488102223 /nfs/dbraw/zinc/10/22/23/488102223.db2.gz KXIBBZGBDUUDAT-ZYHUDNBSSA-N 1 2 220.316 2.341 20 0 BEADLO CCC[C@@H]1CCC[C@H]1C(=O)NCc1c[nH+]cn1C ZINC000296147424 487536599 /nfs/dbraw/zinc/53/65/99/487536599.db2.gz SECBVVHMEDIOOG-DGCLKSJQSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1cnc(N2CCCC[C@H]2c2[nH]cc[nH+]2)nc1 ZINC000677508051 488115351 /nfs/dbraw/zinc/11/53/51/488115351.db2.gz RUQKXGDDUWNWOB-NSHDSACASA-N 1 2 243.314 2.240 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2CC[C@H](C(F)F)C2)no1 ZINC000685570161 487541897 /nfs/dbraw/zinc/54/18/97/487541897.db2.gz WRLXHGQKEBYBHI-XPUUQOCRSA-N 1 2 231.246 2.026 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2CC[C@H](C(F)F)C2)no1 ZINC000685570161 487541904 /nfs/dbraw/zinc/54/19/04/487541904.db2.gz WRLXHGQKEBYBHI-XPUUQOCRSA-N 1 2 231.246 2.026 20 0 BEADLO CCn1cc(C[N@H+](C)Cc2oc(C)nc2C)cn1 ZINC000685564289 487547370 /nfs/dbraw/zinc/54/73/70/487547370.db2.gz NGUZDZMGRQTILC-UHFFFAOYSA-N 1 2 248.330 2.140 20 0 BEADLO CCn1cc(C[N@@H+](C)Cc2oc(C)nc2C)cn1 ZINC000685564289 487547373 /nfs/dbraw/zinc/54/73/73/487547373.db2.gz NGUZDZMGRQTILC-UHFFFAOYSA-N 1 2 248.330 2.140 20 0 BEADLO Cc1ccncc1C[N@@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000336499590 487549003 /nfs/dbraw/zinc/54/90/03/487549003.db2.gz PGAVZKQXZDLUAQ-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccncc1C[N@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000336499590 487549010 /nfs/dbraw/zinc/54/90/10/487549010.db2.gz PGAVZKQXZDLUAQ-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCC=C(F)C2)o1 ZINC000685570520 487551225 /nfs/dbraw/zinc/55/12/25/487551225.db2.gz JGLLJFFDYCWKKL-UHFFFAOYSA-N 1 2 210.252 2.351 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCC=C(F)C2)o1 ZINC000685570520 487551230 /nfs/dbraw/zinc/55/12/30/487551230.db2.gz JGLLJFFDYCWKKL-UHFFFAOYSA-N 1 2 210.252 2.351 20 0 BEADLO CN(C)c1cc[nH+]c(NC(=O)CC(F)(F)F)c1 ZINC000680256454 487552035 /nfs/dbraw/zinc/55/20/35/487552035.db2.gz LNYTWQADIBIIIA-UHFFFAOYSA-N 1 2 247.220 2.039 20 0 BEADLO Cc1cc(N2CCC([C@H]3CCOC3)CC2)nc[nH+]1 ZINC000680066238 487530907 /nfs/dbraw/zinc/53/09/07/487530907.db2.gz NJZIXPVCCRTJDT-ZDUSSCGKSA-N 1 2 247.342 2.038 20 0 BEADLO CC[C@H](COCC1CC1)[NH2+]Cc1cn[nH]c1C ZINC000657561266 488136824 /nfs/dbraw/zinc/13/68/24/488136824.db2.gz NVZUNWHAVJOYIU-CYBMUJFWSA-N 1 2 237.347 2.013 20 0 BEADLO Cn1ncc2c1nc[nH+]c2SCC(F)(F)F ZINC000074251547 487533282 /nfs/dbraw/zinc/53/32/82/487533282.db2.gz FYHRRWDWDYVZQO-UHFFFAOYSA-N 1 2 248.233 2.018 20 0 BEADLO C[C@H](C(=O)N1CCC[C@H](n2cc[nH+]c2)C1)C1CC1 ZINC000673906242 487474674 /nfs/dbraw/zinc/47/46/74/487474674.db2.gz MXDYREGQAIYNBZ-AAEUAGOBSA-N 1 2 247.342 2.093 20 0 BEADLO Fc1cncc([C@H]([NH2+]Cc2cocn2)C2CC2)c1 ZINC000684960116 487475925 /nfs/dbraw/zinc/47/59/25/487475925.db2.gz FWCGKGGJOZIVNE-CYBMUJFWSA-N 1 2 247.273 2.450 20 0 BEADLO CC[C@@H](O)C[NH2+]CC(F)(F)c1ccccc1 ZINC000161177987 487483337 /nfs/dbraw/zinc/48/33/37/487483337.db2.gz ZVGRZWDUWLZUIW-LLVKDONJSA-N 1 2 229.270 2.139 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](Cc1nccn1C)CC2 ZINC000148966601 487478206 /nfs/dbraw/zinc/47/82/06/487478206.db2.gz UXSPWCCVDMJSCF-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](Cc1nccn1C)CC2 ZINC000148966601 487478209 /nfs/dbraw/zinc/47/82/09/487478209.db2.gz UXSPWCCVDMJSCF-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO c1cn2c(n1)[C@H]([NH2+]Cc1ccoc1)CCC2 ZINC000655696980 487494230 /nfs/dbraw/zinc/49/42/30/487494230.db2.gz GFMBXQYMINGIJH-LLVKDONJSA-N 1 2 217.272 2.101 20 0 BEADLO Cc1noc([C@H](C)[NH2+][C@H](C)c2ccncc2)n1 ZINC000679934418 487498152 /nfs/dbraw/zinc/49/81/52/487498152.db2.gz PRSFJRBHQVCZJJ-BDAKNGLRSA-N 1 2 232.287 2.185 20 0 BEADLO Cc1noc([C@@H](C)[NH2+][C@@H](C)c2cnccc2C)n1 ZINC000679941057 487499531 /nfs/dbraw/zinc/49/95/31/487499531.db2.gz BTTSVSUGQUNXBX-VHSXEESVSA-N 1 2 246.314 2.493 20 0 BEADLO FC1CC2(C1)C[NH+](Cc1ccnn1CC1CC1)C2 ZINC000668232058 487500502 /nfs/dbraw/zinc/50/05/02/487500502.db2.gz AFPDSASVSYYVFM-UHFFFAOYSA-N 1 2 249.333 2.227 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ncn(C)n2)cs1 ZINC000391925850 487505577 /nfs/dbraw/zinc/50/55/77/487505577.db2.gz DSXRXGSYIIWWQT-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO CN(CCO)c1ccc(N[C@H]2CCC2(C)C)[nH+]c1 ZINC000671299369 487511843 /nfs/dbraw/zinc/51/18/43/487511843.db2.gz JZYXMFQDQJNMHU-LBPRGKRZSA-N 1 2 249.358 2.111 20 0 BEADLO Cc1nnc(CNc2cc[nH+]c(C(C)(C)C)n2)o1 ZINC000674064891 487507223 /nfs/dbraw/zinc/50/72/23/487507223.db2.gz UUQKJPVQKXQMAZ-UHFFFAOYSA-N 1 2 247.302 2.078 20 0 BEADLO CCC(=O)CCC[N@@H+]1CCC[C@@H](c2ccn[nH]2)C1 ZINC000685417635 487518410 /nfs/dbraw/zinc/51/84/10/487518410.db2.gz BVVILLWWQHCRMB-GFCCVEGCSA-N 1 2 249.358 2.348 20 0 BEADLO CCC(=O)CCC[N@H+]1CCC[C@@H](c2ccn[nH]2)C1 ZINC000685417635 487518413 /nfs/dbraw/zinc/51/84/13/487518413.db2.gz BVVILLWWQHCRMB-GFCCVEGCSA-N 1 2 249.358 2.348 20 0 BEADLO CCc1nnc(C[NH+]2CCC(C)CC2)s1 ZINC000680045840 487526276 /nfs/dbraw/zinc/52/62/76/487526276.db2.gz OGGJZIQCCJVXMU-UHFFFAOYSA-N 1 2 225.361 2.332 20 0 BEADLO CCn1cc(C[NH2+][C@H](C)c2ccsc2)nn1 ZINC000404436180 488159723 /nfs/dbraw/zinc/15/97/23/488159723.db2.gz RMXOFAAQTHNPEM-SECBINFHSA-N 1 2 236.344 2.210 20 0 BEADLO CCN(C[C@H]1CCOC1)c1cc[nH+]c(C2CC2)n1 ZINC000676491756 487855677 /nfs/dbraw/zinc/85/56/77/487855677.db2.gz KRCILVVCCJHZEU-LLVKDONJSA-N 1 2 247.342 2.217 20 0 BEADLO CC[C@H](C)[N@@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000682074496 487895129 /nfs/dbraw/zinc/89/51/29/487895129.db2.gz UVKBFJIDFLHOBS-JGVFFNPUSA-N 1 2 211.227 2.048 20 0 BEADLO CC[C@H](C)[N@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000682074496 487895132 /nfs/dbraw/zinc/89/51/32/487895132.db2.gz UVKBFJIDFLHOBS-JGVFFNPUSA-N 1 2 211.227 2.048 20 0 BEADLO Oc1ccc2c(c1)CCN(c1cccc[nH+]1)CC2 ZINC000682460515 487967744 /nfs/dbraw/zinc/96/77/44/487967744.db2.gz ONGYTZUUSHMQIX-UHFFFAOYSA-N 1 2 240.306 2.392 20 0 BEADLO O=C(Nc1ccccc1)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000034385184 487968801 /nfs/dbraw/zinc/96/88/01/487968801.db2.gz WORGAZLRXIPDKZ-JTQLQIEISA-N 1 2 241.294 2.153 20 0 BEADLO O=C(Nc1ccccc1)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000034385184 487968805 /nfs/dbraw/zinc/96/88/05/487968805.db2.gz WORGAZLRXIPDKZ-JTQLQIEISA-N 1 2 241.294 2.153 20 0 BEADLO Cc1nc(N2CC(C(C)C)C2)c(C)c(C)[nH+]1 ZINC000677125212 487976153 /nfs/dbraw/zinc/97/61/53/487976153.db2.gz NWINONJOYKLIQF-UHFFFAOYSA-N 1 2 219.332 2.494 20 0 BEADLO Cc1cc2c(cc1-c1[nH+]ccn1C)OCO2 ZINC000656369613 488082160 /nfs/dbraw/zinc/08/21/60/488082160.db2.gz JUDWUNNJQWQWMW-UHFFFAOYSA-N 1 2 216.240 2.124 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1C[C@@H]2C=C[C@H]1CC2)c1[nH]cc[nH+]1 ZINC000402792485 488101802 /nfs/dbraw/zinc/10/18/02/488101802.db2.gz HOFVABMKKLUZFP-WISYIIOYSA-N 1 2 245.326 2.189 20 0 BEADLO Nc1nc(N2CCC3(CC3)C2)[nH+]c2ccccc12 ZINC000685918305 488148664 /nfs/dbraw/zinc/14/86/64/488148664.db2.gz IXLUMZNKBNOZSX-UHFFFAOYSA-N 1 2 240.310 2.202 20 0 BEADLO Cc1nn(C)cc1[C@@H]1CCC[N@@H+]1Cc1cocn1 ZINC000683352217 488151006 /nfs/dbraw/zinc/15/10/06/488151006.db2.gz DWAGLPTVYOQJMD-ZDUSSCGKSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1nn(C)cc1[C@@H]1CCC[N@H+]1Cc1cocn1 ZINC000683352217 488151011 /nfs/dbraw/zinc/15/10/11/488151011.db2.gz DWAGLPTVYOQJMD-ZDUSSCGKSA-N 1 2 246.314 2.054 20 0 BEADLO C[N@H+](Cc1ccsc1)Cc1cocn1 ZINC000683351345 488151331 /nfs/dbraw/zinc/15/13/31/488151331.db2.gz YOAYGKIJTREOCB-UHFFFAOYSA-N 1 2 208.286 2.368 20 0 BEADLO C[N@@H+](Cc1ccsc1)Cc1cocn1 ZINC000683351345 488151336 /nfs/dbraw/zinc/15/13/36/488151336.db2.gz YOAYGKIJTREOCB-UHFFFAOYSA-N 1 2 208.286 2.368 20 0 BEADLO COc1ccc(N[C@@H]2CO[C@H](C3CC3)C2)[nH+]c1 ZINC000667907505 488152491 /nfs/dbraw/zinc/15/24/91/488152491.db2.gz RTTQGUWMSZNWCO-JQWIXIFHSA-N 1 2 234.299 2.070 20 0 BEADLO c1nc(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)co1 ZINC000668718055 488160565 /nfs/dbraw/zinc/16/05/65/488160565.db2.gz DKXFUGJRIQRSTK-CQSZACIVSA-N 1 2 244.294 2.328 20 0 BEADLO c1nc(C[N@H+]2CC[C@@H](Oc3ccccc3)C2)co1 ZINC000668718055 488160567 /nfs/dbraw/zinc/16/05/67/488160567.db2.gz DKXFUGJRIQRSTK-CQSZACIVSA-N 1 2 244.294 2.328 20 0 BEADLO C[C@@H]1CCN(Cc2c[nH+]c3n2CCC3)C[C@H]1F ZINC000667943714 488163470 /nfs/dbraw/zinc/16/34/70/488163470.db2.gz YLVSAPRQEBMQET-ZYHUDNBSSA-N 1 2 237.322 2.009 20 0 BEADLO CCCn1nccc1C[N@H+](C)Cc1cccnc1 ZINC000667948065 488166160 /nfs/dbraw/zinc/16/61/60/488166160.db2.gz MSASEYHRIBQEOX-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CCCn1nccc1C[N@@H+](C)Cc1cccnc1 ZINC000667948065 488166167 /nfs/dbraw/zinc/16/61/67/488166167.db2.gz MSASEYHRIBQEOX-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CCn1cc(C[NH2+]Cc2ccc(C)c(F)c2)nn1 ZINC000404508829 488166172 /nfs/dbraw/zinc/16/61/72/488166172.db2.gz OKBJSNKTKZMGKI-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO CC[C@H]([NH2+]Cc1ccc(F)cn1)c1ccn(C)n1 ZINC000680464758 488184496 /nfs/dbraw/zinc/18/44/96/488184496.db2.gz KBFGGZLPLJINQF-LBPRGKRZSA-N 1 2 248.305 2.195 20 0 BEADLO CCn1c[nH+]cc1CN[C@@H]1CCCC1(F)F ZINC000398018006 488184913 /nfs/dbraw/zinc/18/49/13/488184913.db2.gz YAWSKPDLYJKFQK-SNVBAGLBSA-N 1 2 229.274 2.180 20 0 BEADLO C[C@H]1C[C@H](O)C[N@@H+]1Cc1ccc(F)c(F)c1F ZINC000668045227 488194067 /nfs/dbraw/zinc/19/40/67/488194067.db2.gz LNTYFJIKZSCVHU-CBAPKCEASA-N 1 2 245.244 2.059 20 0 BEADLO C[C@H]1C[C@H](O)C[N@H+]1Cc1ccc(F)c(F)c1F ZINC000668045227 488194073 /nfs/dbraw/zinc/19/40/73/488194073.db2.gz LNTYFJIKZSCVHU-CBAPKCEASA-N 1 2 245.244 2.059 20 0 BEADLO Cc1cc(NC(=O)N2CC(C(C)C)C2)c(C)c[nH+]1 ZINC000678097271 488197300 /nfs/dbraw/zinc/19/73/00/488197300.db2.gz WCOMEYQUKLYOEN-UHFFFAOYSA-N 1 2 247.342 2.240 20 0 BEADLO Cc1cn2ccc(NC(=O)N(C)C3CC3)cc2[nH+]1 ZINC000668154098 488210885 /nfs/dbraw/zinc/21/08/85/488210885.db2.gz FGUOOUVUWIPQFU-UHFFFAOYSA-N 1 2 244.298 2.269 20 0 BEADLO CCN(C)C(=O)Nc1ccn2cc(C)[nH+]c2c1 ZINC000668153101 488210939 /nfs/dbraw/zinc/21/09/39/488210939.db2.gz GOJQSQQAVZLSIO-UHFFFAOYSA-N 1 2 232.287 2.126 20 0 BEADLO Cc1cnc(C[NH2+][C@H]2COCc3ccccc32)o1 ZINC000231640137 488217964 /nfs/dbraw/zinc/21/79/64/488217964.db2.gz IXEPYIUVIQOLEX-ZDUSSCGKSA-N 1 2 244.294 2.344 20 0 BEADLO CC1(C[NH2+]c2ccc(-n3ccnn3)cc2)CC1 ZINC000683773073 488219343 /nfs/dbraw/zinc/21/93/43/488219343.db2.gz SBPBRGHBTYWMSJ-UHFFFAOYSA-N 1 2 228.299 2.479 20 0 BEADLO CC[N@H+](CCC(F)(F)F)Cc1ccn(C)n1 ZINC000678222022 488220228 /nfs/dbraw/zinc/22/02/28/488220228.db2.gz BCMCRBCVZPJTPG-UHFFFAOYSA-N 1 2 235.253 2.194 20 0 BEADLO CC[N@@H+](CCC(F)(F)F)Cc1ccn(C)n1 ZINC000678222022 488220233 /nfs/dbraw/zinc/22/02/33/488220233.db2.gz BCMCRBCVZPJTPG-UHFFFAOYSA-N 1 2 235.253 2.194 20 0 BEADLO c1snnc1C[NH+]1C2CCCC1CCC2 ZINC000678278757 488236033 /nfs/dbraw/zinc/23/60/33/488236033.db2.gz GFHKRTGLHZZCDY-UHFFFAOYSA-N 1 2 223.345 2.445 20 0 BEADLO Fc1cccc([C@H]2CC[N@@H+]2Cc2cc[nH]n2)c1 ZINC000678283266 488237124 /nfs/dbraw/zinc/23/71/24/488237124.db2.gz HEOCFVNKEMUWHH-CYBMUJFWSA-N 1 2 231.274 2.496 20 0 BEADLO Fc1cccc([C@H]2CC[N@H+]2Cc2cc[nH]n2)c1 ZINC000678283266 488237127 /nfs/dbraw/zinc/23/71/27/488237127.db2.gz HEOCFVNKEMUWHH-CYBMUJFWSA-N 1 2 231.274 2.496 20 0 BEADLO CC(C)(C)CCC(=O)N[C@@H]1CCc2c[nH+]cn2C1 ZINC000672145595 488241127 /nfs/dbraw/zinc/24/11/27/488241127.db2.gz MNJDFWKAFNYXKZ-LLVKDONJSA-N 1 2 249.358 2.140 20 0 BEADLO CCC(C)(C)CC(=O)N[C@@H]1CCc2c[nH+]cn2C1 ZINC000672153852 488242485 /nfs/dbraw/zinc/24/24/85/488242485.db2.gz CFFGNVAOOOQZEY-LLVKDONJSA-N 1 2 249.358 2.140 20 0 BEADLO c1nc(N2CCC[C@@H]3C[C@@H]32)cc(N2CCCC2)[nH+]1 ZINC000672324098 488251543 /nfs/dbraw/zinc/25/15/43/488251543.db2.gz IZOLOKQSPLYUIY-NEPJUHHUSA-N 1 2 244.342 2.066 20 0 BEADLO c1nc(N2CCCC2)cc(N2CCC[C@@H]3C[C@@H]32)[nH+]1 ZINC000672324098 488251544 /nfs/dbraw/zinc/25/15/44/488251544.db2.gz IZOLOKQSPLYUIY-NEPJUHHUSA-N 1 2 244.342 2.066 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1C(=O)CCCn1cc[nH+]c1 ZINC000678485447 488261034 /nfs/dbraw/zinc/26/10/34/488261034.db2.gz DYUQPUWRBVQKFJ-QWHCGFSZSA-N 1 2 249.358 2.453 20 0 BEADLO Cc1noc([C@H](C)[NH2+][C@@H](C)c2cccc(O)c2)n1 ZINC000678761685 488280878 /nfs/dbraw/zinc/28/08/78/488280878.db2.gz YYUUPDZZIOBZGC-IUCAKERBSA-N 1 2 247.298 2.495 20 0 BEADLO Fc1c[nH+]ccc1N1CCCSCC1 ZINC000678787237 488282678 /nfs/dbraw/zinc/28/26/78/488282678.db2.gz DMTUVNCMVGKMDK-UHFFFAOYSA-N 1 2 212.293 2.164 20 0 BEADLO CCO[C@H]1CCCN(c2cc[nH+]cc2F)C1 ZINC000678787342 488282737 /nfs/dbraw/zinc/28/27/37/488282737.db2.gz KASOVPKMENCCMF-JTQLQIEISA-N 1 2 224.279 2.226 20 0 BEADLO CN(C[C@H]1CCCCO1)c1cc[nH+]cc1F ZINC000678788591 488283249 /nfs/dbraw/zinc/28/32/49/488283249.db2.gz JYQHFEDCZXSUJK-SNVBAGLBSA-N 1 2 224.279 2.226 20 0 BEADLO CN(C[C@@H]1CCCCO1)c1cc[nH+]cc1F ZINC000678788589 488283599 /nfs/dbraw/zinc/28/35/99/488283599.db2.gz JYQHFEDCZXSUJK-JTQLQIEISA-N 1 2 224.279 2.226 20 0 BEADLO CCc1cc(NCC2([C@@H](O)C(C)C)CC2)nc[nH+]1 ZINC000678829446 488288794 /nfs/dbraw/zinc/28/87/94/488288794.db2.gz CVSAOLYGCVXLIT-ZDUSSCGKSA-N 1 2 249.358 2.248 20 0 BEADLO Cc1cc(NCC2([C@H](C)CCO)CCC2)nc[nH+]1 ZINC000678829945 488288928 /nfs/dbraw/zinc/28/89/28/488288928.db2.gz MOAJVQHVBBZKOF-LLVKDONJSA-N 1 2 249.358 2.386 20 0 BEADLO CC[C@@H](NC(=O)Cn1cc[nH+]c1)C1CCCCC1 ZINC000673653882 488301048 /nfs/dbraw/zinc/30/10/48/488301048.db2.gz FSEFLZUSQHHLQW-CYBMUJFWSA-N 1 2 249.358 2.358 20 0 BEADLO COc1ccc(N[C@H](C)c2cnccn2)[nH+]c1 ZINC000679068909 488304271 /nfs/dbraw/zinc/30/42/71/488304271.db2.gz SOKUJRPCDDNNLU-SECBINFHSA-N 1 2 230.271 2.053 20 0 BEADLO CC(C)C1C[NH+](Cc2cn(C(C)(C)C)nn2)C1 ZINC000684409492 488308472 /nfs/dbraw/zinc/30/84/72/488308472.db2.gz WOTBCABUPCUACY-UHFFFAOYSA-N 1 2 236.363 2.121 20 0 BEADLO CCc1cc(NCc2c[nH+]c3ccccn23)no1 ZINC000679122084 488310799 /nfs/dbraw/zinc/31/07/99/488310799.db2.gz KYNIUNBOXQQDRM-UHFFFAOYSA-N 1 2 242.282 2.497 20 0 BEADLO CCc1nnc(C[N@H+]2CC(C)=C[C@H](C)C2)s1 ZINC000684669405 488337458 /nfs/dbraw/zinc/33/74/58/488337458.db2.gz JNLFXUSWEKWFEC-VIFPVBQESA-N 1 2 237.372 2.499 20 0 BEADLO CCc1nnc(C[N@@H+]2CC(C)=C[C@H](C)C2)s1 ZINC000684669405 488337459 /nfs/dbraw/zinc/33/74/59/488337459.db2.gz JNLFXUSWEKWFEC-VIFPVBQESA-N 1 2 237.372 2.499 20 0 BEADLO CCc1nnc(C[N@H+]2CC(C)=C[C@@H](C)C2)s1 ZINC000684669404 488337467 /nfs/dbraw/zinc/33/74/67/488337467.db2.gz JNLFXUSWEKWFEC-SECBINFHSA-N 1 2 237.372 2.499 20 0 BEADLO CCc1nnc(C[N@@H+]2CC(C)=C[C@@H](C)C2)s1 ZINC000684669404 488337468 /nfs/dbraw/zinc/33/74/68/488337468.db2.gz JNLFXUSWEKWFEC-SECBINFHSA-N 1 2 237.372 2.499 20 0 BEADLO CCn1nccc1C[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000679359484 488345917 /nfs/dbraw/zinc/34/59/17/488345917.db2.gz QEWXFFPTRJWYIU-ZYHUDNBSSA-N 1 2 225.311 2.083 20 0 BEADLO CCn1nccc1C[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000679359484 488345919 /nfs/dbraw/zinc/34/59/19/488345919.db2.gz QEWXFFPTRJWYIU-ZYHUDNBSSA-N 1 2 225.311 2.083 20 0 BEADLO C[C@@H]1CCC[C@H]1CNC(=O)CCCn1cc[nH+]c1 ZINC000684945474 488354475 /nfs/dbraw/zinc/35/44/75/488354475.db2.gz FQNRLJJQWBBICJ-OLZOCXBDSA-N 1 2 249.358 2.216 20 0 BEADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1cocn1 ZINC000679577643 488359006 /nfs/dbraw/zinc/35/90/06/488359006.db2.gz UGFXFYUKBDQGEI-SNVBAGLBSA-N 1 2 231.299 2.483 20 0 BEADLO Cc1nc(C[N@H+]2CCOC(C)(C)[C@@H]2C)c(C)o1 ZINC000660007110 490132434 /nfs/dbraw/zinc/13/24/34/490132434.db2.gz ZIAVOCPFAOUZQQ-JTQLQIEISA-N 1 2 238.331 2.291 20 0 BEADLO Cc1nc(C[N@@H+]2CCOC(C)(C)[C@@H]2C)c(C)o1 ZINC000660007110 490132428 /nfs/dbraw/zinc/13/24/28/490132428.db2.gz ZIAVOCPFAOUZQQ-JTQLQIEISA-N 1 2 238.331 2.291 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@@H]2CCc3ccccc32)no1 ZINC000045943432 490157628 /nfs/dbraw/zinc/15/76/28/490157628.db2.gz GCFFCBQBYQWKPS-CYBMUJFWSA-N 1 2 243.310 2.497 20 0 BEADLO Cc1nc(C[N@H+](C)[C@@H]2CCc3ccccc32)no1 ZINC000045943432 490157636 /nfs/dbraw/zinc/15/76/36/490157636.db2.gz GCFFCBQBYQWKPS-CYBMUJFWSA-N 1 2 243.310 2.497 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N1CCCCCC1 ZINC000136019390 490185999 /nfs/dbraw/zinc/18/59/99/490185999.db2.gz RHDQHDJQCUTSSG-BQYQJAHWSA-N 1 2 247.342 2.319 20 0 BEADLO C[C@@H](N[C@@H](C)c1[nH+]ccn1C)c1nccs1 ZINC000070732296 490236782 /nfs/dbraw/zinc/23/67/82/490236782.db2.gz CFYQEMPSNRQLMA-DTWKUNHWSA-N 1 2 236.344 2.288 20 0 BEADLO c1ccc(NCc2cnc(C3CC3)nc2)[nH+]c1 ZINC000459367536 490270754 /nfs/dbraw/zinc/27/07/54/490270754.db2.gz FOGMLDVWMNWCQO-UHFFFAOYSA-N 1 2 226.283 2.361 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]Cc1ccccc1CO ZINC000305106536 490433656 /nfs/dbraw/zinc/43/36/56/490433656.db2.gz FDCNSSYIPVUUPM-JTQLQIEISA-N 1 2 245.326 2.061 20 0 BEADLO COc1ccc[nH+]c1NCc1ccc(C)cn1 ZINC000401000495 490573294 /nfs/dbraw/zinc/57/32/94/490573294.db2.gz VEYMLJXDJNJFFJ-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO Cc1ccncc1[C@H](C)[NH2+]Cc1ccon1 ZINC000129232296 490610007 /nfs/dbraw/zinc/61/00/07/490610007.db2.gz HBDPKMUCBJKMNT-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO O=C(NCc1c[nH+]c[nH]1)C(C1CCC1)C1CCC1 ZINC000306088070 490626626 /nfs/dbraw/zinc/62/66/26/490626626.db2.gz KRKLDHHLYPUKBW-UHFFFAOYSA-N 1 2 247.342 2.242 20 0 BEADLO O=C(NCc1c[nH]c[nH+]1)C(C1CCC1)C1CCC1 ZINC000306088070 490626632 /nfs/dbraw/zinc/62/66/32/490626632.db2.gz KRKLDHHLYPUKBW-UHFFFAOYSA-N 1 2 247.342 2.242 20 0 BEADLO Cc1cnc(C[NH2+]Cc2ccccc2)o1 ZINC000227084409 491054748 /nfs/dbraw/zinc/05/47/48/491054748.db2.gz SIXFKPJRMCQRHP-UHFFFAOYSA-N 1 2 202.257 2.273 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616927973 491069053 /nfs/dbraw/zinc/06/90/53/491069053.db2.gz VBKJHMKXWGGTEI-DGCLKSJQSA-N 1 2 235.331 2.050 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616927973 491069054 /nfs/dbraw/zinc/06/90/54/491069054.db2.gz VBKJHMKXWGGTEI-DGCLKSJQSA-N 1 2 235.331 2.050 20 0 BEADLO CCc1cnc(C[NH2+][C@H](C)c2cccnc2)o1 ZINC000228568842 491095532 /nfs/dbraw/zinc/09/55/32/491095532.db2.gz MGIGBPYUGDQKAB-SNVBAGLBSA-N 1 2 231.299 2.483 20 0 BEADLO Cc1nc(C[N@H+]2C[C@@H](C)OC(C)(C)C2)cs1 ZINC000076722684 491125484 /nfs/dbraw/zinc/12/54/84/491125484.db2.gz VVMYSXHIOUFJQL-SECBINFHSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@@H](C)OC(C)(C)C2)cs1 ZINC000076722684 491125485 /nfs/dbraw/zinc/12/54/85/491125485.db2.gz VVMYSXHIOUFJQL-SECBINFHSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1cc(N[C@@H](C)C[C@H]2CCOC2)nc[nH+]1 ZINC000309525015 491149914 /nfs/dbraw/zinc/14/99/14/491149914.db2.gz CLYLERLXVZGSOR-WDEREUQCSA-N 1 2 221.304 2.012 20 0 BEADLO Cc1ccc(F)cc1C[NH2+]Cc1cocn1 ZINC000309697648 491154678 /nfs/dbraw/zinc/15/46/78/491154678.db2.gz LLWCSRNIVOHHSR-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO Cc1ncc([C@@H](C)[NH2+]Cc2ccn(C)n2)s1 ZINC000309771774 491156196 /nfs/dbraw/zinc/15/61/96/491156196.db2.gz KPYZVWMLWIUDCD-MRVPVSSYSA-N 1 2 236.344 2.036 20 0 BEADLO C[C@H]1CC[C@H](NC(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000492763267 533753696 /nfs/dbraw/zinc/75/36/96/533753696.db2.gz IZMPQNJXJOEVPU-GQRYTUOZSA-N 1 2 233.315 2.118 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1ccn(C)n1 ZINC000487981998 533877121 /nfs/dbraw/zinc/87/71/21/533877121.db2.gz POLPKZKDHYPGAM-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1cc(F)ccc1C[N@H+](C)Cc1ccn(C)n1 ZINC000487981998 533877133 /nfs/dbraw/zinc/87/71/33/533877133.db2.gz POLPKZKDHYPGAM-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO C[C@@H]1CC[N@H+](CCOCC2CC2)CC1(F)F ZINC000494279737 534035381 /nfs/dbraw/zinc/03/53/81/534035381.db2.gz NOPUZZVUEKLGNB-SNVBAGLBSA-N 1 2 233.302 2.390 20 0 BEADLO C[C@@H]1CC[N@@H+](CCOCC2CC2)CC1(F)F ZINC000494279737 534035390 /nfs/dbraw/zinc/03/53/90/534035390.db2.gz NOPUZZVUEKLGNB-SNVBAGLBSA-N 1 2 233.302 2.390 20 0 BEADLO COc1ccccc1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493114684 534163821 /nfs/dbraw/zinc/16/38/21/534163821.db2.gz HRFWHQSBOHNBSI-SREVYHEPSA-N 1 2 243.266 2.070 20 0 BEADLO C[C@@H]1CC[C@H](N(C)C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493384242 534243839 /nfs/dbraw/zinc/24/38/39/534243839.db2.gz IVCVVOAFFXSXMV-PVTPVBHGSA-N 1 2 233.315 2.070 20 0 BEADLO CCCCOCCNc1cccc([C@@H](C)O)[nH+]1 ZINC000892075660 582786126 /nfs/dbraw/zinc/78/61/26/582786126.db2.gz LLZUNIAHIUFSPA-LLVKDONJSA-N 1 2 238.331 2.364 20 0 BEADLO C[C@H]1CC[N@H+](Cn2ccc(C(F)(F)F)n2)C1 ZINC000725778271 582848465 /nfs/dbraw/zinc/84/84/65/582848465.db2.gz LKAVDSQOURGDKY-QMMMGPOBSA-N 1 2 233.237 2.201 20 0 BEADLO C[C@H]1CC[N@@H+](Cn2ccc(C(F)(F)F)n2)C1 ZINC000725778271 582848468 /nfs/dbraw/zinc/84/84/68/582848468.db2.gz LKAVDSQOURGDKY-QMMMGPOBSA-N 1 2 233.237 2.201 20 0 BEADLO O=C(/C=C/C1CC1)Nc1ccn2cc[nH+]c2c1 ZINC000493274159 534769065 /nfs/dbraw/zinc/76/90/65/534769065.db2.gz RQGVWXOHYFFSQY-ONEGZZNKSA-N 1 2 227.267 2.239 20 0 BEADLO CC(C)c1nc(N2CCOC[C@@H]2C2CC2)cc[nH+]1 ZINC000302124535 534909047 /nfs/dbraw/zinc/90/90/47/534909047.db2.gz HUWYWIIGIUIFJR-GFCCVEGCSA-N 1 2 247.342 2.215 20 0 BEADLO CC(C)c1nc(N2CCC(C)(CO)CC2)cc[nH+]1 ZINC000302179275 534908254 /nfs/dbraw/zinc/90/82/54/534908254.db2.gz XUKDNJLMWBPSSR-UHFFFAOYSA-N 1 2 249.358 2.199 20 0 BEADLO CC(C)(C)[C@@H]1CCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492902082 526653799 /nfs/dbraw/zinc/65/37/99/526653799.db2.gz QLJNOFCCXOBPHO-DGMVEKRQSA-N 1 2 247.342 2.460 20 0 BEADLO CC(C)(C)[C@@H]1CCCN1C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493340976 526654865 /nfs/dbraw/zinc/65/48/65/526654865.db2.gz WACFISMTSNXVMI-MLRMMBSGSA-N 1 2 247.342 2.460 20 0 BEADLO C/C=C/C=C/C(=O)NCc1c[nH+]c(C)cc1C ZINC000493630827 527582994 /nfs/dbraw/zinc/58/29/94/527582994.db2.gz MXIPBPOCKUJLHF-YTXTXJHMSA-N 1 2 230.311 2.447 20 0 BEADLO C/C=C/C=C\C(=O)NCc1cn2ccccc2[nH+]1 ZINC000490761922 527606828 /nfs/dbraw/zinc/60/68/28/527606828.db2.gz FZYAQLOQOVNBTC-HOJFPOIOSA-N 1 2 241.294 2.083 20 0 BEADLO C/C=C/C=C\C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000493090145 527610072 /nfs/dbraw/zinc/61/00/72/527610072.db2.gz ULEZPLAEHICHGG-GJMAOWRXSA-N 1 2 231.299 2.137 20 0 BEADLO CCC[C@@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493613344 527743202 /nfs/dbraw/zinc/74/32/02/527743202.db2.gz OTVLDZVOARSDRI-ZHRWSRJISA-N 1 2 247.342 2.462 20 0 BEADLO CC(C)[C@H]1CCCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492815000 527758063 /nfs/dbraw/zinc/75/80/63/527758063.db2.gz WANXOHOECJZVMK-FMFIFOJESA-N 1 2 247.342 2.460 20 0 BEADLO CC(C)[C@H]1CCCCN1C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493716539 527758330 /nfs/dbraw/zinc/75/83/30/527758330.db2.gz CMIWLMGSTPEGLH-NNNHXZLVSA-N 1 2 247.342 2.460 20 0 BEADLO CCC[C@@H]1C[C@@H]1NC(=O)/C=C\c1[nH+]ccn1CC ZINC000493426660 527817922 /nfs/dbraw/zinc/81/79/22/527817922.db2.gz QHVCNVKVEXIXFR-PBWNMSGQSA-N 1 2 247.342 2.221 20 0 BEADLO CCN(CC(C)(C)C)C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493092887 527940432 /nfs/dbraw/zinc/94/04/32/527940432.db2.gz NWGLMXALKFZRSA-VOTSOKGWSA-N 1 2 235.331 2.318 20 0 BEADLO CC(C)OCC[N@@H+]1CC[C@H](C)C(F)(F)C1 ZINC000494209288 527962295 /nfs/dbraw/zinc/96/22/95/527962295.db2.gz QOAVLXQNWZTLFI-JTQLQIEISA-N 1 2 221.291 2.389 20 0 BEADLO CC(C)OCC[N@H+]1CC[C@H](C)C(F)(F)C1 ZINC000494209288 527962297 /nfs/dbraw/zinc/96/22/97/527962297.db2.gz QOAVLXQNWZTLFI-JTQLQIEISA-N 1 2 221.291 2.389 20 0 BEADLO CC1CCC(N(C)C(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000492810839 528187052 /nfs/dbraw/zinc/18/70/52/528187052.db2.gz JGAASGBDPYIUET-YVMONPNESA-N 1 2 247.342 2.460 20 0 BEADLO CC(C)C[C@H]1CCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492979823 528592184 /nfs/dbraw/zinc/59/21/84/528592184.db2.gz FZSAMCMQTMQCBE-VSQXVHSFSA-N 1 2 247.342 2.318 20 0 BEADLO CC(C)[C@@H]1N(C(=O)C=Cc2c[nH]c[nH+]2)CC1(C)C ZINC000492811407 528804142 /nfs/dbraw/zinc/80/41/42/528804142.db2.gz UABINJFSERHZPY-SZZPACECSA-N 1 2 247.342 2.316 20 0 BEADLO CC1(C)CC(C(=O)NCCNc2cccc[nH+]2)C1 ZINC000479422823 528881069 /nfs/dbraw/zinc/88/10/69/528881069.db2.gz KXDPGBDFXRQBOX-UHFFFAOYSA-N 1 2 247.342 2.046 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492807020 528883348 /nfs/dbraw/zinc/88/33/48/528883348.db2.gz ASYIAZDYACGXJO-JYESYGNLSA-N 1 2 221.304 2.070 20 0 BEADLO CC1(C)CC[C@@H](NC(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493805556 529026513 /nfs/dbraw/zinc/02/65/13/529026513.db2.gz VKHAOYIFWWDKBK-HMDXOVGESA-N 1 2 233.315 2.118 20 0 BEADLO CC[C@H](CC(C)C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000308087577 529306598 /nfs/dbraw/zinc/30/65/98/529306598.db2.gz LGZBYFFXHYAQKA-LLVKDONJSA-N 1 2 237.347 2.440 20 0 BEADLO CC[C@@H]1CC[C@H](C)N(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493434642 529340561 /nfs/dbraw/zinc/34/05/61/529340561.db2.gz QWQBTVIXKVJOBG-FNSAGKMKSA-N 1 2 247.342 2.460 20 0 BEADLO CCCC[C@H](C(=O)OC)[N@H+](C)Cc1ccoc1 ZINC000168805338 534959964 /nfs/dbraw/zinc/95/99/64/534959964.db2.gz SBEUSAKKBZJKGO-GFCCVEGCSA-N 1 2 239.315 2.443 20 0 BEADLO CCCC[C@H](C(=O)OC)[N@@H+](C)Cc1ccoc1 ZINC000168805338 534959971 /nfs/dbraw/zinc/95/99/71/534959971.db2.gz SBEUSAKKBZJKGO-GFCCVEGCSA-N 1 2 239.315 2.443 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CCO[C@@H]3CCC[C@@H]32)cn1 ZINC000334346763 535059137 /nfs/dbraw/zinc/05/91/37/535059137.db2.gz WJFPRNGQDWIMFE-UONOGXRCSA-N 1 2 249.358 2.217 20 0 BEADLO CC(C)n1cc(C[N@H+]2CCO[C@@H]3CCC[C@@H]32)cn1 ZINC000334346763 535059142 /nfs/dbraw/zinc/05/91/42/535059142.db2.gz WJFPRNGQDWIMFE-UONOGXRCSA-N 1 2 249.358 2.217 20 0 BEADLO CC(C)C[N@@H+]1CC(=O)N[C@]12CC[C@H](C)[C@H](C)C2 ZINC000342444546 535065816 /nfs/dbraw/zinc/06/58/16/535065816.db2.gz CLYLHERAHOUFEI-OUCADQQQSA-N 1 2 238.375 2.227 20 0 BEADLO CC(C)C[N@H+]1CC(=O)N[C@]12CC[C@H](C)[C@H](C)C2 ZINC000342444546 535065823 /nfs/dbraw/zinc/06/58/23/535065823.db2.gz CLYLHERAHOUFEI-OUCADQQQSA-N 1 2 238.375 2.227 20 0 BEADLO CC(C)(C)[C@H]1CCN(c2cccc[nH+]2)C[C@H]1O ZINC000273310867 535098084 /nfs/dbraw/zinc/09/80/84/535098084.db2.gz NKNLEPKECNSXLY-NWDGAFQWSA-N 1 2 234.343 2.315 20 0 BEADLO CCCCc1nc(C[NH+]2CCCC2)no1 ZINC000064931350 535098385 /nfs/dbraw/zinc/09/83/85/535098385.db2.gz BARCUPSPIPPDHB-UHFFFAOYSA-N 1 2 209.293 2.008 20 0 BEADLO CCCCc1noc([C@H](C)[N@H+](C)CCOC)n1 ZINC000077408603 535126860 /nfs/dbraw/zinc/12/68/60/535126860.db2.gz XKRBBTNYFUBSIE-JTQLQIEISA-N 1 2 241.335 2.051 20 0 BEADLO CCCCc1noc([C@H](C)[N@@H+](C)CCOC)n1 ZINC000077408603 535126863 /nfs/dbraw/zinc/12/68/63/535126863.db2.gz XKRBBTNYFUBSIE-JTQLQIEISA-N 1 2 241.335 2.051 20 0 BEADLO CC1(C(=O)NCCn2cc[nH+]c2)CCCCCC1 ZINC000180325859 535279067 /nfs/dbraw/zinc/27/90/67/535279067.db2.gz MLOSEEMPHBVZMA-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO CC(C)[C@@]1(CO)CCCN(c2cccc[nH+]2)C1 ZINC000294040046 535319155 /nfs/dbraw/zinc/31/91/55/535319155.db2.gz LRPIZICNIKJLKA-AWEZNQCLSA-N 1 2 234.343 2.317 20 0 BEADLO CC[N@H+](Cc1nnc(C2CC2)n1C1CC1)C1CC1 ZINC000181089174 535395591 /nfs/dbraw/zinc/39/55/91/535395591.db2.gz UOGVXRHWGLKYHT-UHFFFAOYSA-N 1 2 246.358 2.475 20 0 BEADLO CC[N@@H+](Cc1nnc(C2CC2)n1C1CC1)C1CC1 ZINC000181089174 535395593 /nfs/dbraw/zinc/39/55/93/535395593.db2.gz UOGVXRHWGLKYHT-UHFFFAOYSA-N 1 2 246.358 2.475 20 0 BEADLO CCOC(=O)[C@@H](CC)[N@H+](C)CCC(F)(F)F ZINC000083889925 535456807 /nfs/dbraw/zinc/45/68/07/535456807.db2.gz LFJDVBZVYSURSH-MRVPVSSYSA-N 1 2 241.253 2.212 20 0 BEADLO CCOC(=O)[C@@H](CC)[N@@H+](C)CCC(F)(F)F ZINC000083889925 535456812 /nfs/dbraw/zinc/45/68/12/535456812.db2.gz LFJDVBZVYSURSH-MRVPVSSYSA-N 1 2 241.253 2.212 20 0 BEADLO CC[NH+](CC)Cc1nc([C@@](C)(CC)OC)no1 ZINC000350453568 535613911 /nfs/dbraw/zinc/61/39/11/535613911.db2.gz PISRHQHHCGCYGZ-GFCCVEGCSA-N 1 2 241.335 2.183 20 0 BEADLO CCO[C@H]1CCN(c2cccc[nH+]2)C[C@H]1C ZINC000336261350 535634743 /nfs/dbraw/zinc/63/47/43/535634743.db2.gz FNJPMFBJRFHJLN-NEPJUHHUSA-N 1 2 220.316 2.333 20 0 BEADLO CC[C@]1(C)COCC[N@@H+]1Cc1cncs1 ZINC000336085876 535924594 /nfs/dbraw/zinc/92/45/94/535924594.db2.gz LHSZYHVDXSLKRV-LLVKDONJSA-N 1 2 226.345 2.144 20 0 BEADLO CC[C@]1(C)COCC[N@H+]1Cc1cncs1 ZINC000336085876 535924596 /nfs/dbraw/zinc/92/45/96/535924596.db2.gz LHSZYHVDXSLKRV-LLVKDONJSA-N 1 2 226.345 2.144 20 0 BEADLO CC[C@]1(C)C[C@H]1C(=O)NCc1c[nH+]ccc1OC ZINC000348266914 535939659 /nfs/dbraw/zinc/93/96/59/535939659.db2.gz CJOUBCUUCVWKND-SMDDNHRTSA-N 1 2 248.326 2.143 20 0 BEADLO CSCCCNc1cccc([C@@H](C)O)[nH+]1 ZINC000892600991 582925194 /nfs/dbraw/zinc/92/51/94/582925194.db2.gz QUOKMFXVWSBSHQ-SECBINFHSA-N 1 2 226.345 2.300 20 0 BEADLO CO[C@H](CNc1cc[nH+]c(C(C)C)n1)C(C)C ZINC000342436262 536578320 /nfs/dbraw/zinc/57/83/20/536578320.db2.gz KJIDOXXRRLBPJI-LLVKDONJSA-N 1 2 237.347 2.105 20 0 BEADLO CO[C@H]1CCCN(c2cc(C)[nH+]c(C3CC3)n2)C1 ZINC000354879205 536710803 /nfs/dbraw/zinc/71/08/03/536710803.db2.gz ARGJBKWEGFJGJM-LBPRGKRZSA-N 1 2 247.342 2.278 20 0 BEADLO COCc1ccc(C[NH2+][C@H](C)c2ccon2)o1 ZINC000351600127 536781796 /nfs/dbraw/zinc/78/17/96/536781796.db2.gz YXONKFCXQXKHTM-SECBINFHSA-N 1 2 236.271 2.265 20 0 BEADLO Cc1cnc(C[NH2+]Cc2cnc(C)s2)o1 ZINC000235957739 537908083 /nfs/dbraw/zinc/90/80/83/537908083.db2.gz UBEZWYBYHSCTDJ-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)[C@H]1CCCC(C)(C)C1 ZINC000335869805 538101611 /nfs/dbraw/zinc/10/16/11/538101611.db2.gz ZELWNUJLTIQRFJ-NSHDSACASA-N 1 2 249.358 2.253 20 0 BEADLO COC(=O)c1sccc1C[N@@H+]1C[C@@H](C)[C@H]1C ZINC000339582866 566373423 /nfs/dbraw/zinc/37/34/23/566373423.db2.gz RZDSGDIQQOUORC-RKDXNWHRSA-N 1 2 239.340 2.375 20 0 BEADLO COC(=O)c1sccc1C[N@H+]1C[C@@H](C)[C@H]1C ZINC000339582866 566373426 /nfs/dbraw/zinc/37/34/26/566373426.db2.gz RZDSGDIQQOUORC-RKDXNWHRSA-N 1 2 239.340 2.375 20 0 BEADLO Cc1cn2ccc(NC(=O)NC(C)C)cc2[nH+]1 ZINC000668149971 566392234 /nfs/dbraw/zinc/39/22/34/566392234.db2.gz IKQWNJBPGLRTHD-UHFFFAOYSA-N 1 2 232.287 2.173 20 0 BEADLO CC[C@]1(C)CCN(c2cc(N(C)C)[nH+]cn2)C1 ZINC000892900345 583007467 /nfs/dbraw/zinc/00/74/67/583007467.db2.gz LARPQIGZRVTQBI-CYBMUJFWSA-N 1 2 234.347 2.169 20 0 BEADLO CC[C@]1(C)CCN(c2cc(N(C)C)nc[nH+]2)C1 ZINC000892900345 583007471 /nfs/dbraw/zinc/00/74/71/583007471.db2.gz LARPQIGZRVTQBI-CYBMUJFWSA-N 1 2 234.347 2.169 20 0 BEADLO C[C@H](O)c1cccc(N[C@H]2CSC2(C)C)[nH+]1 ZINC000893728811 583215625 /nfs/dbraw/zinc/21/56/25/583215625.db2.gz WEIGOUZUXJXPAS-WPRPVWTQSA-N 1 2 238.356 2.441 20 0 BEADLO CSC1CC([NH2+][C@@H](C)C(=O)OCC(C)C)C1 ZINC000893955992 583261111 /nfs/dbraw/zinc/26/11/11/583261111.db2.gz MEGFESPRILDJRU-WHXUTIOJSA-N 1 2 245.388 2.058 20 0 BEADLO Cc1coc(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)c1 ZINC000893953839 583261985 /nfs/dbraw/zinc/26/19/85/583261985.db2.gz ZSMZHLPFCIOZPC-WDEREUQCSA-N 1 2 209.289 2.197 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2C[C@@H](C)C[C@H]2C)c1C ZINC000894046351 583287631 /nfs/dbraw/zinc/28/76/31/583287631.db2.gz WGFYIVZTWBBUQV-DTWKUNHWSA-N 1 2 207.321 2.257 20 0 BEADLO Cc1[nH]nc(C[N@H+]2C[C@@H](C)C[C@H]2C)c1C ZINC000894046351 583287634 /nfs/dbraw/zinc/28/76/34/583287634.db2.gz WGFYIVZTWBBUQV-DTWKUNHWSA-N 1 2 207.321 2.257 20 0 BEADLO COC(=O)Cc1cc[nH+]c(NCCC2CCC2)c1 ZINC000853438927 588742573 /nfs/dbraw/zinc/74/25/73/588742573.db2.gz UCMCPAPCTNGFGY-UHFFFAOYSA-N 1 2 248.326 2.399 20 0 BEADLO FC(F)(F)c1ccn(C[N@@H+]2CC[C@@H]3C[C@@H]3C2)n1 ZINC000853579112 588749642 /nfs/dbraw/zinc/74/96/42/588749642.db2.gz LOYRTLOTOJFHAO-RKDXNWHRSA-N 1 2 245.248 2.201 20 0 BEADLO FC(F)(F)c1ccn(C[N@H+]2CC[C@@H]3C[C@@H]3C2)n1 ZINC000853579112 588749643 /nfs/dbraw/zinc/74/96/43/588749643.db2.gz LOYRTLOTOJFHAO-RKDXNWHRSA-N 1 2 245.248 2.201 20 0 BEADLO CC(C)c1nc(N2C[C@H](C)[C@@H]2C)cc[nH+]1 ZINC000853650808 588752235 /nfs/dbraw/zinc/75/22/35/588752235.db2.gz WSRKHRVEPBDUAK-UWVGGRQHSA-N 1 2 205.305 2.445 20 0 BEADLO CCC(CC)CO[NH+]=C(N)COC(C)C ZINC000853659205 588753171 /nfs/dbraw/zinc/75/31/71/588753171.db2.gz UBUKLBZNIRQSBG-UHFFFAOYSA-N 1 2 216.325 2.346 20 0 BEADLO CC1=NO[C@@H](CNc2cc(C)[nH+]c(C3CC3)n2)C1 ZINC000853661300 588753671 /nfs/dbraw/zinc/75/36/71/588753671.db2.gz SUFQPQNEIFPYPT-LLVKDONJSA-N 1 2 246.314 2.239 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OCc1ccsc1Cl ZINC000853674048 588754828 /nfs/dbraw/zinc/75/48/28/588754828.db2.gz PTMWKCGDYGXPAN-LURJTMIESA-N 1 2 248.735 2.435 20 0 BEADLO NC(=[NH+]OCC12CCC(CC1)C2)[C@@H]1CCCO1 ZINC000853698401 588757590 /nfs/dbraw/zinc/75/75/90/588757590.db2.gz QLDWTOOKGYFJLM-AKJDGMEZSA-N 1 2 238.331 2.244 20 0 BEADLO C[C@@H]1CCCC[C@@H]1CO[NH+]=C(N)[C@H]1CCCO1 ZINC000853698884 588757613 /nfs/dbraw/zinc/75/76/13/588757613.db2.gz URQNCCAUYDVGBB-IJLUTSLNSA-N 1 2 240.347 2.490 20 0 BEADLO C[C@@H]1CCCC[C@@H]1CO[NH+]=C(N)[C@@H]1CCCO1 ZINC000853698885 588757639 /nfs/dbraw/zinc/75/76/39/588757639.db2.gz URQNCCAUYDVGBB-UTUOFQBUSA-N 1 2 240.347 2.490 20 0 BEADLO Cc1ncoc1CNc1[nH+]c(C)nc2[nH]ccc21 ZINC000853640866 588751694 /nfs/dbraw/zinc/75/16/94/588751694.db2.gz SEKFANOEACLHAZ-UHFFFAOYSA-N 1 2 243.270 2.175 20 0 BEADLO C[C@@H](O)CCSCc1cc[nH+]c(N(C)C)c1 ZINC000853772664 588762472 /nfs/dbraw/zinc/76/24/72/588762472.db2.gz WSHLKTNGEKOEIN-SNVBAGLBSA-N 1 2 240.372 2.152 20 0 BEADLO C1=C[C@H](Nc2cc[nH+]c(C3CC3)n2)CC1 ZINC000853800345 588764061 /nfs/dbraw/zinc/76/40/61/588764061.db2.gz CZZPVTJUOVFVAW-JTQLQIEISA-N 1 2 201.273 2.485 20 0 BEADLO CO[C@@]1(C)C[C@H]1Nc1cc[nH+]c(C(C)C)n1 ZINC000853967272 588770397 /nfs/dbraw/zinc/77/03/97/588770397.db2.gz HYSRFXIPGUWYFC-SKDRFNHKSA-N 1 2 221.304 2.189 20 0 BEADLO CC(C)(C)C(C)(C)CNC(=O)Cc1[nH]cc[nH+]1 ZINC000854632729 588798178 /nfs/dbraw/zinc/79/81/78/588798178.db2.gz FODITLMVHZBDNU-UHFFFAOYSA-N 1 2 237.347 2.141 20 0 BEADLO CC(C)C[C@]1(C)CCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC000854750783 588805310 /nfs/dbraw/zinc/80/53/10/588805310.db2.gz XMBKYGHFWJTMBI-AWEZNQCLSA-N 1 2 249.358 2.379 20 0 BEADLO CC1(C)CCC[C@@H](CNC(=O)Cc2[nH]cc[nH+]2)C1 ZINC000854890501 588815678 /nfs/dbraw/zinc/81/56/78/588815678.db2.gz ZWMFHWRFCIEVMI-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO CCc1ccc(C(=O)N(C)Cc2c[nH+]c[nH]2)s1 ZINC000855134742 588822833 /nfs/dbraw/zinc/82/28/33/588822833.db2.gz YRRSAXAGODFKRD-UHFFFAOYSA-N 1 2 249.339 2.306 20 0 BEADLO CCc1ccc(C(=O)N(C)Cc2c[nH]c[nH+]2)s1 ZINC000855134742 588822834 /nfs/dbraw/zinc/82/28/34/588822834.db2.gz YRRSAXAGODFKRD-UHFFFAOYSA-N 1 2 249.339 2.306 20 0 BEADLO C/C(=C\C(=O)N(C)Cc1c[nH+]c[nH]1)C(C)(C)C ZINC000855135734 588823079 /nfs/dbraw/zinc/82/30/79/588823079.db2.gz VBWYUCVCUCUOQV-UXBLZVDNSA-N 1 2 235.331 2.361 20 0 BEADLO C/C(=C\C(=O)N(C)Cc1c[nH]c[nH+]1)C(C)(C)C ZINC000855135734 588823080 /nfs/dbraw/zinc/82/30/80/588823080.db2.gz VBWYUCVCUCUOQV-UXBLZVDNSA-N 1 2 235.331 2.361 20 0 BEADLO C[C@H]1C[C@H](CNC(=O)Cc2[nH]cc[nH+]2)C[C@@H](C)C1 ZINC000855394910 588831062 /nfs/dbraw/zinc/83/10/62/588831062.db2.gz PDMYWQLODYSZFP-GDNZZTSVSA-N 1 2 249.358 2.141 20 0 BEADLO CC1(C)C(C)(C)C1(C)NC(=O)CCn1cc[nH+]c1 ZINC000891160747 582617031 /nfs/dbraw/zinc/61/70/31/582617031.db2.gz HDXBEYNDXQSGPY-UHFFFAOYSA-N 1 2 249.358 2.214 20 0 BEADLO O=C(Cn1cc[nH+]c1)NC1(C2CCCCC2)CC1 ZINC000891275290 582652025 /nfs/dbraw/zinc/65/20/25/582652025.db2.gz CLRGMXYHNVFNCK-UHFFFAOYSA-N 1 2 247.342 2.112 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)C1(C2CC2)CC1 ZINC000891330289 582665676 /nfs/dbraw/zinc/66/56/76/582665676.db2.gz IRZVDIGCQVDUQB-JTQLQIEISA-N 1 2 247.342 2.270 20 0 BEADLO C[C@@H](CCO)Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000779420621 582669948 /nfs/dbraw/zinc/66/99/48/582669948.db2.gz YONVADUSVMQOIM-LBPRGKRZSA-N 1 2 249.358 2.255 20 0 BEADLO COc1cccc2c[nH+]c(NCCCO)cc21 ZINC000891408824 582679434 /nfs/dbraw/zinc/67/94/34/582679434.db2.gz ACVWLBNVKLRARW-UHFFFAOYSA-N 1 2 232.283 2.038 20 0 BEADLO CC[C@@H](CO)Nc1cc(C2CC2)[nH+]c(C2CC2)n1 ZINC000891412994 582680742 /nfs/dbraw/zinc/68/07/42/582680742.db2.gz HMPXATMDLCFEGD-NSHDSACASA-N 1 2 247.342 2.414 20 0 BEADLO CCc1cc(N[C@@H](C)COC)nc(CC)[nH+]1 ZINC000891438272 582684936 /nfs/dbraw/zinc/68/49/36/582684936.db2.gz HQUIQRGIGCBLSF-VIFPVBQESA-N 1 2 223.320 2.048 20 0 BEADLO Cc1cc(F)ncc1C[N@H+]1C[C@@H](C)OC[C@H]1C ZINC000891672618 582708980 /nfs/dbraw/zinc/70/89/80/582708980.db2.gz WMVCGSCPBXHPTB-GHMZBOCLSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1cc(F)ncc1C[N@@H+]1C[C@@H](C)OC[C@H]1C ZINC000891672618 582708982 /nfs/dbraw/zinc/70/89/82/582708982.db2.gz WMVCGSCPBXHPTB-GHMZBOCLSA-N 1 2 238.306 2.138 20 0 BEADLO C[C@H](O)c1cccc(NCC[C@H]2CCCO2)[nH+]1 ZINC000891678735 582709158 /nfs/dbraw/zinc/70/91/58/582709158.db2.gz VNWLBWWHHZQQLY-WDEREUQCSA-N 1 2 236.315 2.116 20 0 BEADLO C[C@@H](CO)Nc1cc(C2CC2)[nH+]c(C2CC2)n1 ZINC000891683949 582709909 /nfs/dbraw/zinc/70/99/09/582709909.db2.gz CTIWEGDBGZGNHN-QMMMGPOBSA-N 1 2 233.315 2.024 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccc(OC)o2)C[C@@H](C)O1 ZINC000891805162 582724748 /nfs/dbraw/zinc/72/47/48/582724748.db2.gz FBONXBLEIPRMMB-GHMZBOCLSA-N 1 2 239.315 2.288 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccc(OC)o2)C[C@@H](C)O1 ZINC000891805162 582724749 /nfs/dbraw/zinc/72/47/49/582724749.db2.gz FBONXBLEIPRMMB-GHMZBOCLSA-N 1 2 239.315 2.288 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2C[C@@H]2[C@@H]2C[C@H]2C)c(C)c[nH+]1 ZINC000866860623 582766415 /nfs/dbraw/zinc/76/64/15/582766415.db2.gz ZGKAKYARTWEEEF-HUXSOILUSA-N 1 2 244.338 2.351 20 0 BEADLO C[N@H+](Cc1ccon1)Cc1cccc2c1OCC2 ZINC000892083393 582788281 /nfs/dbraw/zinc/78/82/81/582788281.db2.gz PWTYMXNZKOSOPK-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO C[N@@H+](Cc1ccon1)Cc1cccc2c1OCC2 ZINC000892083393 582788287 /nfs/dbraw/zinc/78/82/87/582788287.db2.gz PWTYMXNZKOSOPK-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO c1cn(Cc2cccc(Cn3cc[nH+]c3)c2)cn1 ZINC000113730800 588852745 /nfs/dbraw/zinc/85/27/45/588852745.db2.gz HGYFIFXDQPTNHU-UHFFFAOYSA-N 1 2 238.294 2.176 20 0 BEADLO CCCCC1(NC(=O)[C@H](C)Cc2c[nH+]c[nH]2)CC1 ZINC000889526818 582817970 /nfs/dbraw/zinc/81/79/70/582817970.db2.gz TYJPFECHPSEOSL-LLVKDONJSA-N 1 2 249.358 2.427 20 0 BEADLO CCCCC1(NC(=O)[C@H](C)Cc2c[nH]c[nH+]2)CC1 ZINC000889526818 582817971 /nfs/dbraw/zinc/81/79/71/582817971.db2.gz TYJPFECHPSEOSL-LLVKDONJSA-N 1 2 249.358 2.427 20 0 BEADLO CCc1cc(N(C)C[C@H]2CCCO2)nc(CC)[nH+]1 ZINC000892270455 582823682 /nfs/dbraw/zinc/82/36/82/582823682.db2.gz HEXQTCDJBCRYDU-GFCCVEGCSA-N 1 2 249.358 2.217 20 0 BEADLO CC(=O)OC[C@@H](C)Nc1ccc([NH+](C)C)cc1 ZINC000892312125 582836562 /nfs/dbraw/zinc/83/65/62/582836562.db2.gz APXQHVQHBRYNOY-SNVBAGLBSA-N 1 2 236.315 2.116 20 0 BEADLO c1cc2[nH+]ccc(NC[C@@H]3CCC=CO3)c2cn1 ZINC000780619400 582838425 /nfs/dbraw/zinc/83/84/25/582838425.db2.gz PTSGBCAAOYHVED-NSHDSACASA-N 1 2 241.294 2.156 20 0 BEADLO C[C@@H]1CC[N@H+](Cn2ncn(C3CC3)c2=S)C1 ZINC000725777689 582848361 /nfs/dbraw/zinc/84/83/61/582848361.db2.gz HMMFQHYYUVRDSJ-SECBINFHSA-N 1 2 238.360 2.048 20 0 BEADLO C[C@@H]1CC[N@@H+](Cn2ncn(C3CC3)c2=S)C1 ZINC000725777689 582848362 /nfs/dbraw/zinc/84/83/62/582848362.db2.gz HMMFQHYYUVRDSJ-SECBINFHSA-N 1 2 238.360 2.048 20 0 BEADLO Cc1noc(C)c1[C@H](C)[NH2+][C@H](C)c1nccn1C ZINC000092326939 582855503 /nfs/dbraw/zinc/85/55/03/582855503.db2.gz VHPZNLYAJWNWCF-WCBMZHEXSA-N 1 2 248.330 2.437 20 0 BEADLO Cc1cccnc1CNc1cccc([C@@H](C)O)[nH+]1 ZINC000892340361 582860776 /nfs/dbraw/zinc/86/07/76/582860776.db2.gz SCBBHVGXMGYQAN-LLVKDONJSA-N 1 2 243.310 2.450 20 0 BEADLO Cc1nnc(C[N@H+]2CC[C@H]2C(C)C)s1 ZINC000892403777 582877576 /nfs/dbraw/zinc/87/75/76/582877576.db2.gz RHLBBDYEARWTGN-VIFPVBQESA-N 1 2 211.334 2.077 20 0 BEADLO Cc1nnc(C[N@@H+]2CC[C@H]2C(C)C)s1 ZINC000892403777 582877577 /nfs/dbraw/zinc/87/75/77/582877577.db2.gz RHLBBDYEARWTGN-VIFPVBQESA-N 1 2 211.334 2.077 20 0 BEADLO CCc1cc(NCc2cocn2)nc(CC)[nH+]1 ZINC000892412099 582881900 /nfs/dbraw/zinc/88/19/00/582881900.db2.gz KUZXNEJWNLYWTL-UHFFFAOYSA-N 1 2 232.287 2.202 20 0 BEADLO CSCC[C@H](C)Nc1cc(N(C)C)nc[nH+]1 ZINC000892605696 582927009 /nfs/dbraw/zinc/92/70/09/582927009.db2.gz VFJVAVZCFZAPEF-VIFPVBQESA-N 1 2 240.376 2.096 20 0 BEADLO CSCC[C@H](C)Nc1cc(N(C)C)[nH+]cn1 ZINC000892605696 582927012 /nfs/dbraw/zinc/92/70/12/582927012.db2.gz VFJVAVZCFZAPEF-VIFPVBQESA-N 1 2 240.376 2.096 20 0 BEADLO COc1cccc2c[nH+]c(N[C@@H](C)CCO)cc21 ZINC000892615423 582930450 /nfs/dbraw/zinc/93/04/50/582930450.db2.gz CYAJWVRPXIMQLS-JTQLQIEISA-N 1 2 246.310 2.426 20 0 BEADLO COc1ccc2ccc(N[C@@H](C)CCO)[nH+]c2c1 ZINC000892615391 582930526 /nfs/dbraw/zinc/93/05/26/582930526.db2.gz CFKSDZJNCIEPHI-JTQLQIEISA-N 1 2 246.310 2.426 20 0 BEADLO Cn1cc(C[NH2+]Cc2nccs2)c(C2CC2)n1 ZINC000892640085 582935693 /nfs/dbraw/zinc/93/56/93/582935693.db2.gz FNRLQQCGIAYLMP-UHFFFAOYSA-N 1 2 248.355 2.044 20 0 BEADLO CCc1cc(N[C@@H](CCO)C2CC2)nc(CC)[nH+]1 ZINC000892656845 582941454 /nfs/dbraw/zinc/94/14/54/582941454.db2.gz GPPSTXDRWLJEHO-LBPRGKRZSA-N 1 2 249.358 2.174 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1ccnc(OC)n1 ZINC000648366508 582958561 /nfs/dbraw/zinc/95/85/61/582958561.db2.gz ISPHQJHONXVXBT-UHFFFAOYSA-N 1 2 247.298 2.100 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1ccnc(OC)n1 ZINC000648366508 582958563 /nfs/dbraw/zinc/95/85/63/582958563.db2.gz ISPHQJHONXVXBT-UHFFFAOYSA-N 1 2 247.298 2.100 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2cccc(F)n2)CCO1 ZINC000851871888 582974532 /nfs/dbraw/zinc/97/45/32/582974532.db2.gz XNMXIMAZERSVCX-LBPRGKRZSA-N 1 2 238.306 2.222 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2cccc(F)n2)CCO1 ZINC000851871888 582974534 /nfs/dbraw/zinc/97/45/34/582974534.db2.gz XNMXIMAZERSVCX-LBPRGKRZSA-N 1 2 238.306 2.222 20 0 BEADLO C[C@H](NC(=O)/C=C/C1CCCC1)c1[nH+]ccn1C ZINC000856280910 588867041 /nfs/dbraw/zinc/86/70/41/588867041.db2.gz ZRFVIRHRWAYVEM-AEZGRPFRSA-N 1 2 247.342 2.344 20 0 BEADLO C[C@@H]([NH2+]Cc1cnon1)c1cccc(F)c1F ZINC000851904839 582979492 /nfs/dbraw/zinc/97/94/92/582979492.db2.gz CYPYJFMDVOYWNO-SSDOTTSWSA-N 1 2 239.225 2.199 20 0 BEADLO COc1ccc2ccc(N[C@@H]3CCOC3)[nH+]c2c1 ZINC000892954458 583019450 /nfs/dbraw/zinc/01/94/50/583019450.db2.gz YYBCXBJJVZGEBI-LLVKDONJSA-N 1 2 244.294 2.444 20 0 BEADLO CCCSC[C@@H](C)[NH2+]Cc1cn[nH]c1C ZINC000892985780 583025775 /nfs/dbraw/zinc/02/57/75/583025775.db2.gz OCHKESHRXVZHSW-SECBINFHSA-N 1 2 227.377 2.339 20 0 BEADLO C[C@H](O)c1cccc(N[C@@H]2CCO[C@H](C)C2)[nH+]1 ZINC000893087589 583046906 /nfs/dbraw/zinc/04/69/06/583046906.db2.gz CXJIRMFIWIFKGU-OUAUKWLOSA-N 1 2 236.315 2.114 20 0 BEADLO c1csc(N2CCC[C@@H]2c2[nH]cc[nH+]2)n1 ZINC000893100343 583049589 /nfs/dbraw/zinc/04/95/89/583049589.db2.gz GPLZWTGQOYGBHA-MRVPVSSYSA-N 1 2 220.301 2.208 20 0 BEADLO CCc1cc(N[C@H](C)C[C@H](C)O)nc(CC)[nH+]1 ZINC000893127881 583053999 /nfs/dbraw/zinc/05/39/99/583053999.db2.gz QXAVHDNYGNBFOE-ZJUUUORDSA-N 1 2 237.347 2.173 20 0 BEADLO Cc1cc(N2CC(F)C2)nc(C2CCC2)[nH+]1 ZINC000893136561 583055963 /nfs/dbraw/zinc/05/59/63/583055963.db2.gz VJHZTLCOQLQEDT-UHFFFAOYSA-N 1 2 221.279 2.211 20 0 BEADLO CCn1cc(CNc2c[nH+]ccc2OC)c(C)n1 ZINC000893198331 583069055 /nfs/dbraw/zinc/06/90/55/583069055.db2.gz TZENXVKSTBFVBQ-UHFFFAOYSA-N 1 2 246.314 2.227 20 0 BEADLO Cc1nnc(CNc2ccc(C)[nH+]c2C)s1 ZINC000893199251 583069904 /nfs/dbraw/zinc/06/99/04/583069904.db2.gz UNZFRGRARVZMPI-UHFFFAOYSA-N 1 2 234.328 2.470 20 0 BEADLO COCC[N@H+](CCF)Cc1cncc(Cl)c1 ZINC000856757189 588875963 /nfs/dbraw/zinc/87/59/63/588875963.db2.gz LDNZJOSSMKZXLP-UHFFFAOYSA-N 1 2 246.713 2.153 20 0 BEADLO COCC[N@@H+](CCF)Cc1cncc(Cl)c1 ZINC000856757189 588875964 /nfs/dbraw/zinc/87/59/64/588875964.db2.gz LDNZJOSSMKZXLP-UHFFFAOYSA-N 1 2 246.713 2.153 20 0 BEADLO C/C=C/C[C@@H](CO)Nc1cc(CC)[nH+]c(CC)n1 ZINC000893239595 583076517 /nfs/dbraw/zinc/07/65/17/583076517.db2.gz SGJWAYMVYVIWOH-NTYUQYKDSA-N 1 2 249.358 2.340 20 0 BEADLO C[C@@H]1CCCCN(c2nccn3c[nH+]cc23)C1 ZINC000893245792 583077303 /nfs/dbraw/zinc/07/73/03/583077303.db2.gz SVFUYHJIZVABLH-LLVKDONJSA-N 1 2 230.315 2.356 20 0 BEADLO C/C(=C/C(=O)NCc1[nH]cc[nH+]1)c1ccccc1 ZINC000114123556 588868174 /nfs/dbraw/zinc/86/81/74/588868174.db2.gz FUWHPZSNEREPCL-LUAWRHEFSA-N 1 2 241.294 2.129 20 0 BEADLO c1nc(C[NH2+][C@@H]2CCCc3cccnc32)co1 ZINC000397875823 583110309 /nfs/dbraw/zinc/11/03/09/583110309.db2.gz VSOKGFWEOVSKCY-GFCCVEGCSA-N 1 2 229.283 2.237 20 0 BEADLO Cc1c[nH+]cc(NCc2cn(C)nc2Cl)c1 ZINC000856775365 588877047 /nfs/dbraw/zinc/87/70/47/588877047.db2.gz MHRDISCREBBEQH-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO C[C@@H]1CC[C@H](Nc2cc(N(C)C)nc[nH+]2)C1 ZINC000893369337 583128793 /nfs/dbraw/zinc/12/87/93/583128793.db2.gz RKMFBIKYKGLJMR-ZJUUUORDSA-N 1 2 220.320 2.143 20 0 BEADLO C[C@@H]1CC[C@H](Nc2cc(N(C)C)[nH+]cn2)C1 ZINC000893369337 583128796 /nfs/dbraw/zinc/12/87/96/583128796.db2.gz RKMFBIKYKGLJMR-ZJUUUORDSA-N 1 2 220.320 2.143 20 0 BEADLO COc1ccc(C[N@@H+]2CCO[C@H](C(C)C)C2)o1 ZINC000893400642 583137068 /nfs/dbraw/zinc/13/70/68/583137068.db2.gz GMQSDNOLUICMBY-LBPRGKRZSA-N 1 2 239.315 2.145 20 0 BEADLO COc1ccc(C[N@H+]2CCO[C@H](C(C)C)C2)o1 ZINC000893400642 583137069 /nfs/dbraw/zinc/13/70/69/583137069.db2.gz GMQSDNOLUICMBY-LBPRGKRZSA-N 1 2 239.315 2.145 20 0 BEADLO CCc1cc(NC[C@H]2CC[C@H](O)C2)nc(CC)[nH+]1 ZINC000893435050 583142585 /nfs/dbraw/zinc/14/25/85/583142585.db2.gz NWHGNCXBNYEKCJ-JQWIXIFHSA-N 1 2 249.358 2.174 20 0 BEADLO Cc1c[nH+]c2n1CC[C@@H]2OC(=O)c1ccccc1 ZINC000893515367 583155439 /nfs/dbraw/zinc/15/54/39/583155439.db2.gz FZZBRHJAOGSXEV-LBPRGKRZSA-N 1 2 242.278 2.493 20 0 BEADLO CS/C=C/C(=O)O[C@H]1CCn2c(C)c[nH+]c21 ZINC000893524753 583157326 /nfs/dbraw/zinc/15/73/26/583157326.db2.gz LHGLDIPCJBPSFL-DNQSNQRASA-N 1 2 238.312 2.056 20 0 BEADLO C[C@H]1CSCC[N@@H+]1Cc1cn(C)nc1Cl ZINC000857020452 588881790 /nfs/dbraw/zinc/88/17/90/588881790.db2.gz DGNXFKLGAAFRTK-QMMMGPOBSA-N 1 2 245.779 2.011 20 0 BEADLO C[C@H]1CSCC[N@H+]1Cc1cn(C)nc1Cl ZINC000857020452 588881791 /nfs/dbraw/zinc/88/17/91/588881791.db2.gz DGNXFKLGAAFRTK-QMMMGPOBSA-N 1 2 245.779 2.011 20 0 BEADLO Cc1coc(COC(=O)C[C@H](C)n2cc[nH+]c2)c1 ZINC000893746174 583217448 /nfs/dbraw/zinc/21/74/48/583217448.db2.gz XIIRDFUJLZKCAN-NSHDSACASA-N 1 2 248.282 2.479 20 0 BEADLO Cc1n[nH]c(C[N@@H+](C)Cc2cccc(O)c2)c1C ZINC000893863775 583234144 /nfs/dbraw/zinc/23/41/44/583234144.db2.gz NVFURGRXVZEPIC-UHFFFAOYSA-N 1 2 245.326 2.364 20 0 BEADLO Cc1n[nH]c(C[N@H+](C)Cc2cccc(O)c2)c1C ZINC000893863775 583234145 /nfs/dbraw/zinc/23/41/45/583234145.db2.gz NVFURGRXVZEPIC-UHFFFAOYSA-N 1 2 245.326 2.364 20 0 BEADLO C[C@@H](c1ccco1)c1noc([C@H](C)[NH+](C)C)n1 ZINC000857086737 588887113 /nfs/dbraw/zinc/88/71/13/588887113.db2.gz FSAMLUNOFQOPHX-IUCAKERBSA-N 1 2 235.287 2.437 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2CCn3cccc3[C@H]2C)c1C ZINC000893879134 583239548 /nfs/dbraw/zinc/23/95/48/583239548.db2.gz CPJRSFDDTLPGPO-GFCCVEGCSA-N 1 2 244.342 2.405 20 0 BEADLO Cc1n[nH]c(C[N@H+]2CCn3cccc3[C@H]2C)c1C ZINC000893879134 583239549 /nfs/dbraw/zinc/23/95/49/583239549.db2.gz CPJRSFDDTLPGPO-GFCCVEGCSA-N 1 2 244.342 2.405 20 0 BEADLO CCc1cc(N2CC(C3CC3)C2)nc(CC)[nH+]1 ZINC000893927850 583250351 /nfs/dbraw/zinc/25/03/51/583250351.db2.gz CFHAIDFJJBLNHX-UHFFFAOYSA-N 1 2 231.343 2.448 20 0 BEADLO CCc1cc(N[C@H](C)c2ncc[nH]2)nc(CC)[nH+]1 ZINC000893943937 583255874 /nfs/dbraw/zinc/25/58/74/583255874.db2.gz ITRAZAXWZVBTFL-SECBINFHSA-N 1 2 245.330 2.498 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+]C1CC2(C1)CCCC2 ZINC000893950971 583260209 /nfs/dbraw/zinc/26/02/09/583260209.db2.gz ORURAZOMAJOARR-JTQLQIEISA-N 1 2 225.332 2.250 20 0 BEADLO Cc1coc(C[N@H+]2C[C@@H](C)OC[C@@H]2C)c1 ZINC000893953839 583261982 /nfs/dbraw/zinc/26/19/82/583261982.db2.gz ZSMZHLPFCIOZPC-WDEREUQCSA-N 1 2 209.289 2.197 20 0 BEADLO Cc1ccnc(N)c1C[N@H+](C)Cc1ccoc1 ZINC000893972418 583265040 /nfs/dbraw/zinc/26/50/40/583265040.db2.gz ABUISQXRBUJRGJ-UHFFFAOYSA-N 1 2 231.299 2.197 20 0 BEADLO Cc1ccnc(N)c1C[N@@H+](C)Cc1ccoc1 ZINC000893972418 583265041 /nfs/dbraw/zinc/26/50/41/583265041.db2.gz ABUISQXRBUJRGJ-UHFFFAOYSA-N 1 2 231.299 2.197 20 0 BEADLO Cc1[nH]nc(C[NH+]2[C@@H](C)CC[C@@H]2C)c1C ZINC000894095259 583300891 /nfs/dbraw/zinc/30/08/91/583300891.db2.gz QJVCYNOORILBJK-IUCAKERBSA-N 1 2 207.321 2.399 20 0 BEADLO CCc1cc(NCCC2(CO)CC2)nc(CC)[nH+]1 ZINC000894096078 583301027 /nfs/dbraw/zinc/30/10/27/583301027.db2.gz VJVNMESQZQTDDJ-UHFFFAOYSA-N 1 2 249.358 2.176 20 0 BEADLO CCc1ncc(CNc2cccc([C@@H](C)O)[nH+]2)o1 ZINC000894100020 583304409 /nfs/dbraw/zinc/30/44/09/583304409.db2.gz UNFGHCKRUMKXNS-SECBINFHSA-N 1 2 247.298 2.297 20 0 BEADLO COc1ccc2ccc(N[C@H]3C[C@@H](O)C3)[nH+]c2c1 ZINC000894119351 583311093 /nfs/dbraw/zinc/31/10/93/583311093.db2.gz ODNNNOIZHNAQAD-PHIMTYICSA-N 1 2 244.294 2.179 20 0 BEADLO CCc1nnc(C[NH+]2CC(C(C)C)C2)s1 ZINC000894134183 583313416 /nfs/dbraw/zinc/31/34/16/583313416.db2.gz KZOQXQUZIHFFAN-UHFFFAOYSA-N 1 2 225.361 2.188 20 0 BEADLO C[C@H](O)c1cccc(NC[C@H]2CC[C@@H](C)O2)[nH+]1 ZINC000894152032 583319512 /nfs/dbraw/zinc/31/95/12/583319512.db2.gz HXUQVCDBKISYBP-OUAUKWLOSA-N 1 2 236.315 2.114 20 0 BEADLO CCn1cc(C[NH2+]C(C)(C)C(F)F)c(C)n1 ZINC000894148478 583320378 /nfs/dbraw/zinc/32/03/78/583320378.db2.gz PEJGZAKLENQGBD-UHFFFAOYSA-N 1 2 231.290 2.345 20 0 BEADLO Cc1csc(C[NH2+]Cc2c(C)ccnc2N)n1 ZINC000894164800 583323017 /nfs/dbraw/zinc/32/30/17/583323017.db2.gz HARGCGFOIYJXKU-UHFFFAOYSA-N 1 2 248.355 2.027 20 0 BEADLO C[C@@H](O)c1cccc(N[C@H](C)c2ccn(C)n2)[nH+]1 ZINC000894168027 583324606 /nfs/dbraw/zinc/32/46/06/583324606.db2.gz PSCJNLWKAKHVAS-NXEZZACHSA-N 1 2 246.314 2.042 20 0 BEADLO CCc1nocc1C[NH+]1CC(OC(C)(C)C)C1 ZINC000877770300 583346807 /nfs/dbraw/zinc/34/68/07/583346807.db2.gz RJIMLLSAEJPZGN-UHFFFAOYSA-N 1 2 238.331 2.236 20 0 BEADLO O[C@H]1CCC[N@H+](Cc2cc(C(F)(F)F)co2)C1 ZINC000877936428 583355392 /nfs/dbraw/zinc/35/53/92/583355392.db2.gz ZOCZFYMEBGEQFI-VIFPVBQESA-N 1 2 249.232 2.255 20 0 BEADLO O[C@H]1CCC[N@@H+](Cc2cc(C(F)(F)F)co2)C1 ZINC000877936428 583355394 /nfs/dbraw/zinc/35/53/94/583355394.db2.gz ZOCZFYMEBGEQFI-VIFPVBQESA-N 1 2 249.232 2.255 20 0 BEADLO CNc1cc(N2CC[C@@H](C3CCC3)C2)nc[nH+]1 ZINC000894227091 583383482 /nfs/dbraw/zinc/38/34/82/583383482.db2.gz PJEKOVJGZVXKGS-LLVKDONJSA-N 1 2 232.331 2.145 20 0 BEADLO CNc1cc(N2CC[C@@H](C3CCC3)C2)[nH+]cn1 ZINC000894227091 583383484 /nfs/dbraw/zinc/38/34/84/583383484.db2.gz PJEKOVJGZVXKGS-LLVKDONJSA-N 1 2 232.331 2.145 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1cnn(-c2ccccc2)n1 ZINC000791568250 583426642 /nfs/dbraw/zinc/42/66/42/583426642.db2.gz MXQVCQGEMJGHHJ-VXGBXAGGSA-N 1 2 242.326 2.250 20 0 BEADLO C/C(=C/c1ccccc1)C[N@H+](C)CN1CCC1=O ZINC000857234442 588898583 /nfs/dbraw/zinc/89/85/83/588898583.db2.gz KNLPEHAFIXXWIN-RAXLEYEMSA-N 1 2 244.338 2.212 20 0 BEADLO C/C(=C/c1ccccc1)C[N@@H+](C)CN1CCC1=O ZINC000857234442 588898584 /nfs/dbraw/zinc/89/85/84/588898584.db2.gz KNLPEHAFIXXWIN-RAXLEYEMSA-N 1 2 244.338 2.212 20 0 BEADLO CN(C)c1cc(N[C@@H]2CC[C@H]3C[C@H]3C2)[nH+]cn1 ZINC000894362834 583438020 /nfs/dbraw/zinc/43/80/20/583438020.db2.gz GNKZIBIEINHZPF-GARJFASQSA-N 1 2 232.331 2.143 20 0 BEADLO CN(C)c1cc(N[C@@H]2CC[C@H]3C[C@H]3C2)nc[nH+]1 ZINC000894362834 583438023 /nfs/dbraw/zinc/43/80/23/583438023.db2.gz GNKZIBIEINHZPF-GARJFASQSA-N 1 2 232.331 2.143 20 0 BEADLO Cc1ncoc1C[NH2+][C@H](C)c1nnc(C(C)C)[nH]1 ZINC000894365814 583438762 /nfs/dbraw/zinc/43/87/62/583438762.db2.gz AJLGDMCONHSUCV-SECBINFHSA-N 1 2 249.318 2.075 20 0 BEADLO Cc1ncoc1C[N@@H+](C)Cc1ccccn1 ZINC000894449856 583459907 /nfs/dbraw/zinc/45/99/07/583459907.db2.gz FCQFJDZBZKGODK-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ncoc1C[N@H+](C)Cc1ccccn1 ZINC000894449856 583459909 /nfs/dbraw/zinc/45/99/09/583459909.db2.gz FCQFJDZBZKGODK-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO CCOC(=O)[C@H]1CCC[N@@H+]1Cc1cc(C)co1 ZINC000894471691 583469150 /nfs/dbraw/zinc/46/91/50/583469150.db2.gz UZDSUVLRKCGKBZ-GFCCVEGCSA-N 1 2 237.299 2.116 20 0 BEADLO CCOC(=O)[C@H]1CCC[N@H+]1Cc1cc(C)co1 ZINC000894471691 583469152 /nfs/dbraw/zinc/46/91/52/583469152.db2.gz UZDSUVLRKCGKBZ-GFCCVEGCSA-N 1 2 237.299 2.116 20 0 BEADLO Cc1n[nH]c(C[N@H+]2C[C@H](C)O[C@H](C)[C@H]2C)c1C ZINC000894532709 583478392 /nfs/dbraw/zinc/47/83/92/583478392.db2.gz DVQZDDLCJOAQBG-XXILOJSOSA-N 1 2 237.347 2.024 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2C[C@H](C)O[C@H](C)[C@H]2C)c1C ZINC000894532709 583478395 /nfs/dbraw/zinc/47/83/95/583478395.db2.gz DVQZDDLCJOAQBG-XXILOJSOSA-N 1 2 237.347 2.024 20 0 BEADLO CC[C@@H](O)CNc1cc2c(cccc2OC)c[nH+]1 ZINC000894550306 583482790 /nfs/dbraw/zinc/48/27/90/583482790.db2.gz KAFPUPYLEYAQRL-LLVKDONJSA-N 1 2 246.310 2.426 20 0 BEADLO CN(C)c1cc(NCCC(C)(C)F)[nH+]cn1 ZINC000894553937 583483714 /nfs/dbraw/zinc/48/37/14/583483714.db2.gz UTUIQMDBGYXKDV-UHFFFAOYSA-N 1 2 226.299 2.093 20 0 BEADLO CN(C)c1cc(NCCC(C)(C)F)nc[nH+]1 ZINC000894553937 583483715 /nfs/dbraw/zinc/48/37/15/583483715.db2.gz UTUIQMDBGYXKDV-UHFFFAOYSA-N 1 2 226.299 2.093 20 0 BEADLO Cc1cc(NC2([C@H](C)O)CC2)nc(C2CCC2)[nH+]1 ZINC000894600179 583490408 /nfs/dbraw/zinc/49/04/08/583490408.db2.gz BDMUEHZXASRUAM-JTQLQIEISA-N 1 2 247.342 2.378 20 0 BEADLO COc1cc(C)ccc1CN(C)Cc1[nH]cc[nH+]1 ZINC000894587150 583490514 /nfs/dbraw/zinc/49/05/14/583490514.db2.gz RYOCBYUXRAJFRB-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO Cc1nn(C)c(C[N@H+]2C[C@H](C)[C@@H]2C)c1Cl ZINC000894629162 583496892 /nfs/dbraw/zinc/49/68/92/583496892.db2.gz UOFPRKCYTIKAGK-CBAPKCEASA-N 1 2 227.739 2.222 20 0 BEADLO Cc1nn(C)c(C[N@@H+]2C[C@H](C)[C@@H]2C)c1Cl ZINC000894629162 583496894 /nfs/dbraw/zinc/49/68/94/583496894.db2.gz UOFPRKCYTIKAGK-CBAPKCEASA-N 1 2 227.739 2.222 20 0 BEADLO COc1nccc(C[N@@H+]2C[C@H](C)[C@H]2C)c1F ZINC000894628637 583497583 /nfs/dbraw/zinc/49/75/83/583497583.db2.gz QBYQSUWZUMGSIP-DTWKUNHWSA-N 1 2 224.279 2.070 20 0 BEADLO COc1nccc(C[N@H+]2C[C@H](C)[C@H]2C)c1F ZINC000894628637 583497584 /nfs/dbraw/zinc/49/75/84/583497584.db2.gz QBYQSUWZUMGSIP-DTWKUNHWSA-N 1 2 224.279 2.070 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CCC[C@@H](CF)C2)[nH]1 ZINC000880237671 583506102 /nfs/dbraw/zinc/50/61/02/583506102.db2.gz FHPRPSHKVNBCGT-JTQLQIEISA-N 1 2 240.326 2.110 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CCC[C@@H](CF)C2)[nH]1 ZINC000880237671 583506104 /nfs/dbraw/zinc/50/61/04/583506104.db2.gz FHPRPSHKVNBCGT-JTQLQIEISA-N 1 2 240.326 2.110 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2CCC[C@H](CF)C2)no1 ZINC000880236962 583506471 /nfs/dbraw/zinc/50/64/71/583506471.db2.gz MXTFHZZRRHFVTO-WCBMZHEXSA-N 1 2 227.283 2.121 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2CCC[C@H](CF)C2)no1 ZINC000880236962 583506472 /nfs/dbraw/zinc/50/64/72/583506472.db2.gz MXTFHZZRRHFVTO-WCBMZHEXSA-N 1 2 227.283 2.121 20 0 BEADLO CCc1nc(C[NH2+]Cc2cn(CC)nc2C)co1 ZINC000894745037 583515449 /nfs/dbraw/zinc/51/54/49/583515449.db2.gz IQJDEEHLOIUPGP-UHFFFAOYSA-N 1 2 248.330 2.052 20 0 BEADLO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1cnc[nH]1 ZINC000894786376 583521811 /nfs/dbraw/zinc/52/18/11/583521811.db2.gz HDOREMZZZKJRDR-RNCFNFMXSA-N 1 2 229.283 2.022 20 0 BEADLO c1[nH+]cn2ccnc(N3CCCC4(CC4)CC3)c12 ZINC000894815915 583524323 /nfs/dbraw/zinc/52/43/23/583524323.db2.gz AWOMIKCRFYEZGG-UHFFFAOYSA-N 1 2 242.326 2.500 20 0 BEADLO COCCC1(C)C[NH+](Cc2nccn2C2CC2)C1 ZINC000894838596 583529277 /nfs/dbraw/zinc/52/92/77/583529277.db2.gz DSEDLGRUWCWVSW-UHFFFAOYSA-N 1 2 249.358 2.076 20 0 BEADLO Cc1coc(C[N@@H+](C)[C@H]2CC(C)(C)OC2=O)c1 ZINC000894851339 583531862 /nfs/dbraw/zinc/53/18/62/583531862.db2.gz MZNAVFOBVPHWTM-NSHDSACASA-N 1 2 237.299 2.114 20 0 BEADLO Cc1coc(C[N@H+](C)[C@H]2CC(C)(C)OC2=O)c1 ZINC000894851339 583531864 /nfs/dbraw/zinc/53/18/64/583531864.db2.gz MZNAVFOBVPHWTM-NSHDSACASA-N 1 2 237.299 2.114 20 0 BEADLO C[C@H]1C[N@H+](Cc2cc(F)ncc2F)[C@H]1C ZINC000894860158 583533957 /nfs/dbraw/zinc/53/39/57/583533957.db2.gz BUIDOABYGVLAFQ-YUMQZZPRSA-N 1 2 212.243 2.200 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cc(F)ncc2F)[C@H]1C ZINC000894860158 583533958 /nfs/dbraw/zinc/53/39/58/583533958.db2.gz BUIDOABYGVLAFQ-YUMQZZPRSA-N 1 2 212.243 2.200 20 0 BEADLO C[C@H]1C[N@H+](Cc2c(C(F)(F)F)cnn2C)[C@H]1C ZINC000894861468 583535940 /nfs/dbraw/zinc/53/59/40/583535940.db2.gz HTEMXIBJXXMUSE-YUMQZZPRSA-N 1 2 247.264 2.279 20 0 BEADLO C[C@H]1C[N@@H+](Cc2c(C(F)(F)F)cnn2C)[C@H]1C ZINC000894861468 583535941 /nfs/dbraw/zinc/53/59/41/583535941.db2.gz HTEMXIBJXXMUSE-YUMQZZPRSA-N 1 2 247.264 2.279 20 0 BEADLO Cc1ncoc1C[N@@H+]1C[C@]2(CCCO2)[C@@H]1C1CC1 ZINC000894866680 583537682 /nfs/dbraw/zinc/53/76/82/583537682.db2.gz XGOINPGDOLGUHE-UONOGXRCSA-N 1 2 248.326 2.126 20 0 BEADLO Cc1ncoc1C[N@H+]1C[C@]2(CCCO2)[C@@H]1C1CC1 ZINC000894866680 583537683 /nfs/dbraw/zinc/53/76/83/583537683.db2.gz XGOINPGDOLGUHE-UONOGXRCSA-N 1 2 248.326 2.126 20 0 BEADLO Cc1ncoc1C[N@@H+]1C[C@@]2(CCCO2)[C@@H]1C1CC1 ZINC000894866678 583538020 /nfs/dbraw/zinc/53/80/20/583538020.db2.gz XGOINPGDOLGUHE-KBPBESRZSA-N 1 2 248.326 2.126 20 0 BEADLO Cc1ncoc1C[N@H+]1C[C@@]2(CCCO2)[C@@H]1C1CC1 ZINC000894866678 583538021 /nfs/dbraw/zinc/53/80/21/583538021.db2.gz XGOINPGDOLGUHE-KBPBESRZSA-N 1 2 248.326 2.126 20 0 BEADLO Clc1ccc(C[NH+]2CC3(CC3)C2)nc1 ZINC000894871008 583539741 /nfs/dbraw/zinc/53/97/41/583539741.db2.gz RLQSNQNQGZKZIH-UHFFFAOYSA-N 1 2 208.692 2.331 20 0 BEADLO CCNc1cc(CNc2cc(C)ncn2)cc[nH+]1 ZINC000894872112 583540496 /nfs/dbraw/zinc/54/04/96/583540496.db2.gz YDKLOAMBXQGRKK-UHFFFAOYSA-N 1 2 243.314 2.224 20 0 BEADLO Cc1noc2ncc(C[N@@H+]3CC[C@@H](F)C3)cc12 ZINC000894875187 583541953 /nfs/dbraw/zinc/54/19/53/583541953.db2.gz XDGISHKBHCZZDH-SNVBAGLBSA-N 1 2 235.262 2.075 20 0 BEADLO Cc1noc2ncc(C[N@H+]3CC[C@@H](F)C3)cc12 ZINC000894875187 583541955 /nfs/dbraw/zinc/54/19/55/583541955.db2.gz XDGISHKBHCZZDH-SNVBAGLBSA-N 1 2 235.262 2.075 20 0 BEADLO CCc1onc(C)c1C[NH2+]Cc1ccn(CC)n1 ZINC000894895646 583549922 /nfs/dbraw/zinc/54/99/22/583549922.db2.gz UBRYYZOLBKWQMD-UHFFFAOYSA-N 1 2 248.330 2.052 20 0 BEADLO Cc1nnc(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)o1 ZINC000726956044 583550904 /nfs/dbraw/zinc/55/09/04/583550904.db2.gz ZTMFIROGZUNDQW-JTQLQIEISA-N 1 2 243.310 2.497 20 0 BEADLO Cc1nnc(C[N@H+]2Cc3ccccc3[C@@H](C)C2)o1 ZINC000726956044 583550906 /nfs/dbraw/zinc/55/09/06/583550906.db2.gz ZTMFIROGZUNDQW-JTQLQIEISA-N 1 2 243.310 2.497 20 0 BEADLO CCCc1ncc(C[NH2+][C@H](C)c2cnccn2)o1 ZINC000894917991 583555812 /nfs/dbraw/zinc/55/58/12/583555812.db2.gz RBABMQAYHKPDNG-SNVBAGLBSA-N 1 2 246.314 2.268 20 0 BEADLO Cc1cccc(CC2C[NH+](Cc3cnc[nH]3)C2)c1 ZINC000894970402 583560737 /nfs/dbraw/zinc/56/07/37/583560737.db2.gz YIQKDKBCLCLACJ-UHFFFAOYSA-N 1 2 241.338 2.393 20 0 BEADLO COC1C[NH+](Cc2cc3c(cccc3O)s2)C1 ZINC000894971417 583561438 /nfs/dbraw/zinc/56/14/38/583561438.db2.gz XRQWTLRHHQCTBM-UHFFFAOYSA-N 1 2 249.335 2.438 20 0 BEADLO CC(C)(C)c1ccncc1C[NH2+]Cc1c[nH]cn1 ZINC000894991737 583563886 /nfs/dbraw/zinc/56/38/86/583563886.db2.gz FIDOISOJKDBPEG-UHFFFAOYSA-N 1 2 244.342 2.392 20 0 BEADLO CCc1onc(C)c1CNc1cc(CO)cc[nH+]1 ZINC000894988509 583565305 /nfs/dbraw/zinc/56/53/05/583565305.db2.gz GELZRGDPNBZOIF-UHFFFAOYSA-N 1 2 247.298 2.045 20 0 BEADLO Cc1noc(C)c1C[NH2+][C@H]1CCCc2cn[nH]c21 ZINC000857850109 588912457 /nfs/dbraw/zinc/91/24/57/588912457.db2.gz OFJCSECZQIMASM-LBPRGKRZSA-N 1 2 246.314 2.182 20 0 BEADLO Cc1noc(C)c1C[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000857850109 588912459 /nfs/dbraw/zinc/91/24/59/588912459.db2.gz OFJCSECZQIMASM-LBPRGKRZSA-N 1 2 246.314 2.182 20 0 BEADLO C[C@H]([NH2+][C@@H]1C[C@H]1C1CCC1)C(=O)OC(C)(C)C ZINC000895008918 583569839 /nfs/dbraw/zinc/56/98/39/583569839.db2.gz IPZTXPLWOFMMKF-ZMLRMANQSA-N 1 2 239.359 2.495 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2CCOC[C@H]2C2CCC2)c1C ZINC000895085635 583583927 /nfs/dbraw/zinc/58/39/27/583583927.db2.gz NTSXWJFEKICUJV-AWEZNQCLSA-N 1 2 249.358 2.027 20 0 BEADLO Cc1n[nH]c(C[N@H+]2CCOC[C@H]2C2CCC2)c1C ZINC000895085635 583583929 /nfs/dbraw/zinc/58/39/29/583583929.db2.gz NTSXWJFEKICUJV-AWEZNQCLSA-N 1 2 249.358 2.027 20 0 BEADLO Fc1cccnc1C[NH2+][C@@H]1CCCc2cn[nH]c21 ZINC000857857587 588913931 /nfs/dbraw/zinc/91/39/31/588913931.db2.gz FVWOENKFGKHOMH-LLVKDONJSA-N 1 2 246.289 2.111 20 0 BEADLO Fc1cccnc1C[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000857857587 588913933 /nfs/dbraw/zinc/91/39/33/588913933.db2.gz FVWOENKFGKHOMH-LLVKDONJSA-N 1 2 246.289 2.111 20 0 BEADLO C[C@@H](O)c1cccc(N[C@H]2CC23CCC3)[nH+]1 ZINC000895090458 583586406 /nfs/dbraw/zinc/58/64/06/583586406.db2.gz MLSDJAQRRDCMFU-KOLCDFICSA-N 1 2 218.300 2.489 20 0 BEADLO Cc1[nH+]cnc(NC[C@H]2CCO[C@H](C)C2)c1C ZINC000882153332 583595348 /nfs/dbraw/zinc/59/53/48/583595348.db2.gz FKVBCGOLIIDUBY-SKDRFNHKSA-N 1 2 235.331 2.320 20 0 BEADLO CC[C@@H]1CN(Cc2[nH+]ccn2C2CC2)[C@H](C)CO1 ZINC000895148705 583605481 /nfs/dbraw/zinc/60/54/81/583605481.db2.gz XCAWQZIUFIBAQW-DGCLKSJQSA-N 1 2 249.358 2.217 20 0 BEADLO CCn1cc(C[NH+]2CC3(CC3(F)F)C2)c(C)n1 ZINC000895200126 583624493 /nfs/dbraw/zinc/62/44/93/583624493.db2.gz NMGXOKAQQZUPAU-UHFFFAOYSA-N 1 2 241.285 2.052 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2[C@H](C)O[C@H](C)[C@H]2C)c1C ZINC000882660425 583628924 /nfs/dbraw/zinc/62/89/24/583628924.db2.gz SCKGOMMCSZHCGE-YJQGPUDQSA-N 1 2 235.331 2.317 20 0 BEADLO O=C1OCC[C@@H]1[NH2+]Cc1cccc2ccccc21 ZINC000019876069 583631423 /nfs/dbraw/zinc/63/14/23/583631423.db2.gz NFTZKFOJSOCFEV-AWEZNQCLSA-N 1 2 241.290 2.245 20 0 BEADLO CCc1nccc(NCc2cc[nH+]c(NC)c2)n1 ZINC000895255602 583633500 /nfs/dbraw/zinc/63/35/00/583633500.db2.gz HQTWRJHNFVXQHL-UHFFFAOYSA-N 1 2 243.314 2.088 20 0 BEADLO CCc1nsc(NCc2cc[nH+]c(NC)c2)n1 ZINC000895255749 583633650 /nfs/dbraw/zinc/63/36/50/583633650.db2.gz NEKPVKZIHSHLRN-UHFFFAOYSA-N 1 2 249.343 2.149 20 0 BEADLO COc1c(C)c[nH+]c(CNCC(F)F)c1C ZINC000147590308 583634819 /nfs/dbraw/zinc/63/48/19/583634819.db2.gz IXJZVNRQQWCTTM-UHFFFAOYSA-N 1 2 230.258 2.062 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CC[C@@H](C)O[C@@H](C)C2)c1C ZINC000895279093 583636181 /nfs/dbraw/zinc/63/61/81/583636181.db2.gz FCRYKUUKTWXUJW-ZJUUUORDSA-N 1 2 237.347 2.026 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CC[C@@H](C)O[C@@H](C)C2)c1C ZINC000895279093 583636182 /nfs/dbraw/zinc/63/61/82/583636182.db2.gz FCRYKUUKTWXUJW-ZJUUUORDSA-N 1 2 237.347 2.026 20 0 BEADLO CCCCOCC[N@@H+]1Cc2ccncc2C1 ZINC000857875408 588918318 /nfs/dbraw/zinc/91/83/18/588918318.db2.gz NCZSRNLBHGRHCP-UHFFFAOYSA-N 1 2 220.316 2.214 20 0 BEADLO CCCCOCC[N@H+]1Cc2ccncc2C1 ZINC000857875408 588918319 /nfs/dbraw/zinc/91/83/19/588918319.db2.gz NCZSRNLBHGRHCP-UHFFFAOYSA-N 1 2 220.316 2.214 20 0 BEADLO C[C@@H](CC(=O)NC1(C2CC2)CCC1)n1cc[nH+]c1 ZINC000895352784 583656882 /nfs/dbraw/zinc/65/68/82/583656882.db2.gz AXIZLZRSWIDREY-NSHDSACASA-N 1 2 247.342 2.283 20 0 BEADLO C[C@@H]1C[C@H]1C(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000727496315 583661516 /nfs/dbraw/zinc/66/15/16/583661516.db2.gz MWMFPWSNFLFXFD-IJLUTSLNSA-N 1 2 249.358 2.070 20 0 BEADLO CCC(C)(C)OC1C[NH+](Cc2ocnc2C)C1 ZINC000895391526 583664052 /nfs/dbraw/zinc/66/40/52/583664052.db2.gz BYNKGLQVKQJTNK-UHFFFAOYSA-N 1 2 238.331 2.372 20 0 BEADLO C[C@@H]1C[C@H](C[N@@H+]2CC[C@H]2C(F)F)CCO1 ZINC000895432792 583671494 /nfs/dbraw/zinc/67/14/94/583671494.db2.gz PXPOPNLHHHVGFE-BBBLOLIVSA-N 1 2 219.275 2.141 20 0 BEADLO C[C@@H]1C[C@H](C[N@H+]2CC[C@H]2C(F)F)CCO1 ZINC000895432792 583671496 /nfs/dbraw/zinc/67/14/96/583671496.db2.gz PXPOPNLHHHVGFE-BBBLOLIVSA-N 1 2 219.275 2.141 20 0 BEADLO CCc1ncc(C[N@H+](C)Cc2ccns2)cn1 ZINC000895452421 583676373 /nfs/dbraw/zinc/67/63/73/583676373.db2.gz MCXRISUKDGGGRE-UHFFFAOYSA-N 1 2 248.355 2.128 20 0 BEADLO CCc1ncc(C[N@@H+](C)Cc2ccns2)cn1 ZINC000895452421 583676374 /nfs/dbraw/zinc/67/63/74/583676374.db2.gz MCXRISUKDGGGRE-UHFFFAOYSA-N 1 2 248.355 2.128 20 0 BEADLO CCc1nnc(C[NH+]2CC(CC3CC3)C2)s1 ZINC000895515977 583683087 /nfs/dbraw/zinc/68/30/87/583683087.db2.gz NEPKAEATQSWJNN-UHFFFAOYSA-N 1 2 237.372 2.332 20 0 BEADLO CC(C)=C(C)CC(=O)NCCNc1cccc[nH+]1 ZINC000895608486 583695416 /nfs/dbraw/zinc/69/54/16/583695416.db2.gz OJBMRFVATONWJL-UHFFFAOYSA-N 1 2 247.342 2.356 20 0 BEADLO COC1CC(Nc2c[nH+]c(C)c(C)c2)C1 ZINC000895646138 583701025 /nfs/dbraw/zinc/70/10/25/583701025.db2.gz VKKXFIIKNNIBDK-UHFFFAOYSA-N 1 2 206.289 2.288 20 0 BEADLO Cn1nccc1[C@H]1CCCN1c1cc[nH+]cc1F ZINC000895717070 583711667 /nfs/dbraw/zinc/71/16/67/583711667.db2.gz FNIYYNYNZUGALF-CYBMUJFWSA-N 1 2 246.289 2.296 20 0 BEADLO Fc1cc(C[NH2+]Cc2nccn2C2CC2)ccn1 ZINC000895769085 583724545 /nfs/dbraw/zinc/72/45/45/583724545.db2.gz NHBKCQTTYLGXSD-UHFFFAOYSA-N 1 2 246.289 2.042 20 0 BEADLO O=C(/C=C/C1CCCC1)N[C@@H]1CCn2c[nH+]cc21 ZINC000857976531 588926062 /nfs/dbraw/zinc/92/60/62/588926062.db2.gz GTKHJEXAUDXZKF-BTDICHCPSA-N 1 2 245.326 2.191 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857976568 588926206 /nfs/dbraw/zinc/92/62/06/588926206.db2.gz HGCHLQMUAOCCNL-WOPDTQHZSA-N 1 2 247.342 2.270 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857976502 588926224 /nfs/dbraw/zinc/92/62/24/588926224.db2.gz FWMSYXPWXUUCOB-UTUOFQBUSA-N 1 2 247.342 2.126 20 0 BEADLO COc1ccc(C[NH2+][C@H](C)c2nccnc2C)o1 ZINC000895942209 583750301 /nfs/dbraw/zinc/75/03/01/583750301.db2.gz GXAMJXUTOSKDOE-SNVBAGLBSA-N 1 2 247.298 2.237 20 0 BEADLO CO[C@@H]1C[N@H+](Cc2ccc3occc3c2)CCO1 ZINC000895961753 583751166 /nfs/dbraw/zinc/75/11/66/583751166.db2.gz DABOLWKDFHNPJT-AWEZNQCLSA-N 1 2 247.294 2.238 20 0 BEADLO CO[C@@H]1C[N@@H+](Cc2ccc3occc3c2)CCO1 ZINC000895961753 583751167 /nfs/dbraw/zinc/75/11/67/583751167.db2.gz DABOLWKDFHNPJT-AWEZNQCLSA-N 1 2 247.294 2.238 20 0 BEADLO CO[C@H]1C[N@H+](Cc2ccc3occc3c2)CCO1 ZINC000895961755 583751188 /nfs/dbraw/zinc/75/11/88/583751188.db2.gz DABOLWKDFHNPJT-CQSZACIVSA-N 1 2 247.294 2.238 20 0 BEADLO CO[C@H]1C[N@@H+](Cc2ccc3occc3c2)CCO1 ZINC000895961755 583751189 /nfs/dbraw/zinc/75/11/89/583751189.db2.gz DABOLWKDFHNPJT-CQSZACIVSA-N 1 2 247.294 2.238 20 0 BEADLO Cc1ccc(C[NH+]2CC(OC(C)C)C2)o1 ZINC000895951636 583751604 /nfs/dbraw/zinc/75/16/04/583751604.db2.gz GRKPWALDRMEISQ-UHFFFAOYSA-N 1 2 209.289 2.197 20 0 BEADLO CC(C)OC1CN(Cc2[nH+]ccn2C(C)C)C1 ZINC000895956927 583752413 /nfs/dbraw/zinc/75/24/13/583752413.db2.gz ZRLVTDCAVAXJCV-UHFFFAOYSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)OC1C[NH+](Cc2cccc(F)c2N)C1 ZINC000895956874 583752482 /nfs/dbraw/zinc/75/24/82/583752482.db2.gz XPOQZALRXOSCNV-UHFFFAOYSA-N 1 2 238.306 2.017 20 0 BEADLO Cc1ccoc1C[NH+]1CC(OC(C)C)C1 ZINC000895955094 583752540 /nfs/dbraw/zinc/75/25/40/583752540.db2.gz OQUPYUCCMQDFKI-UHFFFAOYSA-N 1 2 209.289 2.197 20 0 BEADLO C/C(=C\C(=O)N[C@@H]1CCn2c[nH+]cc21)C(C)(C)C ZINC000857977761 588926747 /nfs/dbraw/zinc/92/67/47/588926747.db2.gz ZIIYDYAKAIKKJO-PFEDMVJOSA-N 1 2 247.342 2.437 20 0 BEADLO COCC1C[NH+](Cc2ccc(F)c(F)c2F)C1 ZINC000895975307 583756909 /nfs/dbraw/zinc/75/69/09/583756909.db2.gz VIGFEQUBMVZFGG-UHFFFAOYSA-N 1 2 245.244 2.182 20 0 BEADLO CC(C)(CC(=O)N[C@@H]1CCn2c[nH+]cc21)C1CC1 ZINC000857979666 588927415 /nfs/dbraw/zinc/92/74/15/588927415.db2.gz YEOSLHGRHRAQIZ-LLVKDONJSA-N 1 2 247.342 2.270 20 0 BEADLO Cc1ccc(Cc2noc(COC3CC3)n2)c[nH+]1 ZINC000896041387 583766677 /nfs/dbraw/zinc/76/66/77/583766677.db2.gz YKQCGDYCEKBEJJ-UHFFFAOYSA-N 1 2 245.282 2.043 20 0 BEADLO O=C(N[C@H]1CCn2c[nH+]cc21)[C@@H]1CC12CCCC2 ZINC000857982420 588928072 /nfs/dbraw/zinc/92/80/72/588928072.db2.gz INJRNABTEHGKHY-QWRGUYRKSA-N 1 2 245.326 2.024 20 0 BEADLO CN(C)[C@@H](CCNc1cccc[nH+]1)C(F)(F)F ZINC000896109949 583772787 /nfs/dbraw/zinc/77/27/87/583772787.db2.gz PSVQVZXSPHSEHZ-VIFPVBQESA-N 1 2 247.264 2.376 20 0 BEADLO C[C@@H]1CC[C@H](CC(=O)N[C@H]2CCn3c[nH+]cc32)C1 ZINC000857984379 588928568 /nfs/dbraw/zinc/92/85/68/588928568.db2.gz ZGCXOTPUEQHKRQ-WOPDTQHZSA-N 1 2 247.342 2.270 20 0 BEADLO Cc1cc(NC[C@]2(C)CCCCO2)nc[nH+]1 ZINC000896179611 583779572 /nfs/dbraw/zinc/77/95/72/583779572.db2.gz VFGXYZVALRLBNA-LBPRGKRZSA-N 1 2 221.304 2.156 20 0 BEADLO Cc1[nH+]cnc(NC[C@]2(C)CCCCO2)c1C ZINC000896179936 583779795 /nfs/dbraw/zinc/77/97/95/583779795.db2.gz BGMMVCWAOCEFJG-ZDUSSCGKSA-N 1 2 235.331 2.465 20 0 BEADLO CCC[C@@H](O)CCNc1[nH+]cccc1OC ZINC000896184522 583780291 /nfs/dbraw/zinc/78/02/91/583780291.db2.gz XGBNPFMYHQNKPC-SNVBAGLBSA-N 1 2 224.304 2.053 20 0 BEADLO CCC1(C(=O)N[C@@H]2CCn3c[nH+]cc32)CCCC1 ZINC000857984501 588928823 /nfs/dbraw/zinc/92/88/23/588928823.db2.gz BPSWJQSATURMKD-LLVKDONJSA-N 1 2 247.342 2.415 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N[C@@H]2CCC[C@H]2C)c[nH+]1 ZINC000896187512 583780904 /nfs/dbraw/zinc/78/09/04/583780904.db2.gz PUOGSRMEIAGJQF-ZYHUDNBSSA-N 1 2 249.358 2.231 20 0 BEADLO CCC[C@H](O)CCNc1cc[nH+]c(C2CC2)n1 ZINC000896185792 583781113 /nfs/dbraw/zinc/78/11/13/583781113.db2.gz AOGBGLTVGCLBQB-NSHDSACASA-N 1 2 235.331 2.317 20 0 BEADLO C[C@@H]1CCC[C@H]1CC(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857983294 588928950 /nfs/dbraw/zinc/92/89/50/588928950.db2.gz ZPJNQBFYGWTROI-GRYCIOLGSA-N 1 2 247.342 2.270 20 0 BEADLO CNc1cc(N[C@@H]2CCS[C@@H](C)C2)[nH+]cn1 ZINC000896245975 583784781 /nfs/dbraw/zinc/78/47/81/583784781.db2.gz KBYJYEWWKWFZBV-DTWKUNHWSA-N 1 2 238.360 2.214 20 0 BEADLO CC(C(=O)N[C@@H]1CCn2c[nH+]cc21)=C1CCCC1 ZINC000857987307 588929223 /nfs/dbraw/zinc/92/92/23/588929223.db2.gz TXQGPNZWXCBMPS-GFCCVEGCSA-N 1 2 245.326 2.335 20 0 BEADLO O=C(N[C@H]1CCn2c[nH+]cc21)C1CCCCCC1 ZINC000857985943 588929489 /nfs/dbraw/zinc/92/94/89/588929489.db2.gz SDZHHPOGWFBOFS-LBPRGKRZSA-N 1 2 247.342 2.415 20 0 BEADLO C[NH+](C)C1(c2nc(CC3CCCC3)no2)CC1 ZINC000896329999 583794603 /nfs/dbraw/zinc/79/46/03/583794603.db2.gz FUASQGIHYYGGNH-UHFFFAOYSA-N 1 2 235.331 2.353 20 0 BEADLO CCC[C@@H](OC)c1noc(C2([NH+](C)C)CC2)n1 ZINC000896351413 583795598 /nfs/dbraw/zinc/79/55/98/583795598.db2.gz MJBPERHQJOZTCX-SECBINFHSA-N 1 2 239.319 2.108 20 0 BEADLO CC[C@H](C)C(=O)N1CCNc2[nH+]cc(C)cc21 ZINC000857995781 588930177 /nfs/dbraw/zinc/93/01/77/588930177.db2.gz GZJSFBNDUXJLMQ-JTQLQIEISA-N 1 2 233.315 2.195 20 0 BEADLO Cc1ccc(C(=O)N[C@H]2CCn3c[nH+]cc32)s1 ZINC000857989828 588930210 /nfs/dbraw/zinc/93/02/10/588930210.db2.gz LHKUWMNYZZHPPR-VIFPVBQESA-N 1 2 247.323 2.128 20 0 BEADLO Cc1c[nH+]c2c(c1)N(C(=O)[C@H](C)C1CC1)CCN2 ZINC000857997770 588930347 /nfs/dbraw/zinc/93/03/47/588930347.db2.gz UKGVHUYZFFAREZ-SNVBAGLBSA-N 1 2 245.326 2.195 20 0 BEADLO F[C@@H]1COc2ccccc2[C@@H]1[NH2+]C1CSC1 ZINC000896421913 583801579 /nfs/dbraw/zinc/80/15/79/583801579.db2.gz DVPUMNGVRZBENH-PWSUYJOCSA-N 1 2 239.315 2.163 20 0 BEADLO C/C=C(/C)C(=O)N1CCNc2[nH+]cc(C)cc21 ZINC000857997915 588930467 /nfs/dbraw/zinc/93/04/67/588930467.db2.gz XJKWOGOIRVZQKW-WMZJFQQLSA-N 1 2 231.299 2.115 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N[C@@H]2CC=CCC2)c[nH+]1 ZINC000896460418 583803645 /nfs/dbraw/zinc/80/36/45/583803645.db2.gz VDZYAXCRSVGJOI-GFCCVEGCSA-N 1 2 247.342 2.152 20 0 BEADLO Cc1cc(NCc2cc(C3CC3)nn2C)nc[nH+]1 ZINC000896503405 583807802 /nfs/dbraw/zinc/80/78/02/583807802.db2.gz NBPCATSODJOXMR-UHFFFAOYSA-N 1 2 243.314 2.008 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+]2CCO[C@@H](C)CC2)n1 ZINC000896579161 583814684 /nfs/dbraw/zinc/81/46/84/583814684.db2.gz NOJXDGNTAJVYLK-NSHDSACASA-N 1 2 237.347 2.144 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+]2CCO[C@@H](C)CC2)n1 ZINC000896579161 583814686 /nfs/dbraw/zinc/81/46/86/583814686.db2.gz NOJXDGNTAJVYLK-NSHDSACASA-N 1 2 237.347 2.144 20 0 BEADLO CCc1nc(N2CCOC[C@H]2CC2CC2)cc[nH+]1 ZINC000896637398 583819054 /nfs/dbraw/zinc/81/90/54/583819054.db2.gz NFHYZULWYCUYIU-GFCCVEGCSA-N 1 2 247.342 2.044 20 0 BEADLO Cc1cc[nH+]cc1Cc1nc(C2CSC2)no1 ZINC000896735814 583828687 /nfs/dbraw/zinc/82/86/87/583828687.db2.gz PGRZVEWWERVDJF-UHFFFAOYSA-N 1 2 247.323 2.194 20 0 BEADLO Cc1nnc(C[NH2+]C(C)(C)/C=C/Cl)s1 ZINC000896748511 583830080 /nfs/dbraw/zinc/83/00/80/583830080.db2.gz WPXQCEWMSJLIOF-SNAWJCMRSA-N 1 2 231.752 2.467 20 0 BEADLO Cc1occc1C[N@@H+]1CCn2cccc2C1 ZINC000896760692 583831032 /nfs/dbraw/zinc/83/10/32/583831032.db2.gz DKFILNGJTZMXMN-UHFFFAOYSA-N 1 2 216.284 2.405 20 0 BEADLO Cc1occc1C[N@H+]1CCn2cccc2C1 ZINC000896760692 583831033 /nfs/dbraw/zinc/83/10/33/583831033.db2.gz DKFILNGJTZMXMN-UHFFFAOYSA-N 1 2 216.284 2.405 20 0 BEADLO COc1ccc(C[N@@H+]2CCn3cccc3C2)o1 ZINC000896763155 583831560 /nfs/dbraw/zinc/83/15/60/583831560.db2.gz LIAKPCVJTKMEJT-UHFFFAOYSA-N 1 2 232.283 2.106 20 0 BEADLO COc1ccc(C[N@H+]2CCn3cccc3C2)o1 ZINC000896763155 583831562 /nfs/dbraw/zinc/83/15/62/583831562.db2.gz LIAKPCVJTKMEJT-UHFFFAOYSA-N 1 2 232.283 2.106 20 0 BEADLO CC(C)(CNc1cc(CO)cc[nH+]1)C1CC1 ZINC000896783983 583833253 /nfs/dbraw/zinc/83/32/53/583833253.db2.gz UPDXKAOBIHZZIP-UHFFFAOYSA-N 1 2 220.316 2.422 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2CC[C@H](C3CC3)O2)c1C ZINC000896801293 583835036 /nfs/dbraw/zinc/83/50/36/583835036.db2.gz MGOUCBRTVZTZOR-QWHCGFSZSA-N 1 2 247.342 2.463 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N2CC[C@@H](C)[C@@H]2C)c[nH+]1 ZINC000896837468 583838789 /nfs/dbraw/zinc/83/87/89/583838789.db2.gz DTAAZFNIBIEVRI-PWSUYJOCSA-N 1 2 249.358 2.184 20 0 BEADLO Cc1[nH]c(CNC(=O)C2=CCCCC2)[nH+]c1C ZINC000896911039 583852993 /nfs/dbraw/zinc/85/29/93/583852993.db2.gz YMOYGHYYIHTQBR-UHFFFAOYSA-N 1 2 233.315 2.143 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H](C)C2CCCC2)[nH+]c1C ZINC000896916089 583855099 /nfs/dbraw/zinc/85/50/99/583855099.db2.gz UJEVHENCRDVCDB-VIFPVBQESA-N 1 2 249.358 2.469 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@H](C)C(C)(C)C)[nH+]c1C ZINC000896918699 583856183 /nfs/dbraw/zinc/85/61/83/583856183.db2.gz FFCTXNUFYGNDMJ-QMMMGPOBSA-N 1 2 237.347 2.325 20 0 BEADLO CSCC1CC[NH+](Cc2cn[nH]c2C)CC1 ZINC000896937236 583862247 /nfs/dbraw/zinc/86/22/47/583862247.db2.gz MEXJKRQBYQUSIS-UHFFFAOYSA-N 1 2 239.388 2.293 20 0 BEADLO CC(C)c1nc(N[C@@H]2CCC[C@@H]2CO)cc[nH+]1 ZINC000896962209 583864841 /nfs/dbraw/zinc/86/48/41/583864841.db2.gz RRMKYUMZJIZXNA-GHMZBOCLSA-N 1 2 235.331 2.173 20 0 BEADLO Cc1cc(NC2CC3(C2)CO[C@H](C)C3)nc[nH+]1 ZINC000897043838 583873967 /nfs/dbraw/zinc/87/39/67/583873967.db2.gz MSGBMKIXWNDPPY-XSRFYTQQSA-N 1 2 233.315 2.155 20 0 BEADLO Cc1nc(NC2CC3(C2)CO[C@H](C)C3)cc[nH+]1 ZINC000897054247 583874446 /nfs/dbraw/zinc/87/44/46/583874446.db2.gz ZIVJYYRDDVSQID-CBZQXFMTSA-N 1 2 233.315 2.155 20 0 BEADLO CC(C)Cc1cc(N[C@@H]2CC23CC(O)C3)nc[nH+]1 ZINC000897086292 583878414 /nfs/dbraw/zinc/87/84/14/583878414.db2.gz CTGZPORCCQAEDQ-MBHSVXNSSA-N 1 2 247.342 2.000 20 0 BEADLO CO[C@@H]1CC[C@H]1N(C)c1cc(C)[nH+]c(C2CC2)n1 ZINC000897148561 583884419 /nfs/dbraw/zinc/88/44/19/583884419.db2.gz GMUXKXKMGUBSAG-VXGBXAGGSA-N 1 2 247.342 2.276 20 0 BEADLO CN(C)c1cc(N[C@@H]2C[C@@H]3CCC[C@H]23)[nH+]cn1 ZINC000897176624 583888841 /nfs/dbraw/zinc/88/88/41/583888841.db2.gz ASTYJCVRVDJBSB-GARJFASQSA-N 1 2 232.331 2.143 20 0 BEADLO CN(C)c1cc(N[C@@H]2C[C@@H]3CCC[C@H]23)nc[nH+]1 ZINC000897176624 583888843 /nfs/dbraw/zinc/88/88/43/583888843.db2.gz ASTYJCVRVDJBSB-GARJFASQSA-N 1 2 232.331 2.143 20 0 BEADLO COc1cccc(NCc2cn(C)c[nH+]2)c1C ZINC000858240969 588940294 /nfs/dbraw/zinc/94/02/94/588940294.db2.gz HUPKPXAEVCLRIU-UHFFFAOYSA-N 1 2 231.299 2.349 20 0 BEADLO CCC(F)(F)C[NH2+]Cc1ccnc(F)c1 ZINC000858258375 588941147 /nfs/dbraw/zinc/94/11/47/588941147.db2.gz GLFCWHHGDRLTSS-UHFFFAOYSA-N 1 2 218.222 2.356 20 0 BEADLO CNc1cc(N[C@H]2CCOC23CCCC3)nc[nH+]1 ZINC000897320049 583921115 /nfs/dbraw/zinc/92/11/15/583921115.db2.gz IWMBPOVJKPKUGG-JTQLQIEISA-N 1 2 248.330 2.032 20 0 BEADLO CNc1cc(N[C@H]2CCOC23CCCC3)[nH+]cn1 ZINC000897320049 583921116 /nfs/dbraw/zinc/92/11/16/583921116.db2.gz IWMBPOVJKPKUGG-JTQLQIEISA-N 1 2 248.330 2.032 20 0 BEADLO C[C@H]([NH2+]Cc1cc2n(n1)CCC2)c1ccns1 ZINC000858319004 588944884 /nfs/dbraw/zinc/94/48/84/588944884.db2.gz WHJYTKTUORGSOQ-VIFPVBQESA-N 1 2 248.355 2.137 20 0 BEADLO Cc1[nH+]cccc1CCNc1ccc(Cl)nn1 ZINC000897405748 583954820 /nfs/dbraw/zinc/95/48/20/583954820.db2.gz GAKJJEVFAZAJFP-UHFFFAOYSA-N 1 2 248.717 2.488 20 0 BEADLO c1ccc(NCCOC2CCSCC2)[nH+]c1 ZINC000897515361 583999524 /nfs/dbraw/zinc/99/95/24/583999524.db2.gz PHWQKRHTTBRNLL-UHFFFAOYSA-N 1 2 238.356 2.406 20 0 BEADLO C[Si](C)(C)COC(=O)c1ccc2[nH+]ccn2c1 ZINC000740959641 584002175 /nfs/dbraw/zinc/00/21/75/584002175.db2.gz GWRWQVIWLGCGDO-UHFFFAOYSA-N 1 2 248.358 2.369 20 0 BEADLO CC[C@@H](NC(=O)C=C1CCC1)c1[nH]cc[nH+]1 ZINC000785420953 584007187 /nfs/dbraw/zinc/00/71/87/584007187.db2.gz HGKDTSPTIVOWNY-SNVBAGLBSA-N 1 2 219.288 2.087 20 0 BEADLO CCC[C@@H]([NH2+][C@@H]1CC[C@@H](C)SC1)C(=O)OC ZINC000897834062 584052786 /nfs/dbraw/zinc/05/27/86/584052786.db2.gz GJOMBWQAFZTMCK-GMTAPVOTSA-N 1 2 245.388 2.202 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N[C@@H]2C[C@H]2C(C)C)c[nH+]1 ZINC000897961884 584068563 /nfs/dbraw/zinc/06/85/63/584068563.db2.gz UNXOVQMKUZANHQ-NWDGAFQWSA-N 1 2 249.358 2.087 20 0 BEADLO c1csc(C[NH+]2CC(Cc3ccoc3)C2)n1 ZINC000898160887 584088229 /nfs/dbraw/zinc/08/82/29/584088229.db2.gz YGAFCINVIYOWGY-UHFFFAOYSA-N 1 2 234.324 2.411 20 0 BEADLO c1nc(C[NH2+][C@@H](c2ccncc2)C2CC2)co1 ZINC000898322841 584107062 /nfs/dbraw/zinc/10/70/62/584107062.db2.gz SDJSPJWBCKMMCB-CYBMUJFWSA-N 1 2 229.283 2.311 20 0 BEADLO CCC[C@@H](CC)C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000898809544 584160271 /nfs/dbraw/zinc/16/02/71/584160271.db2.gz ATOGLDYMLJYQQM-GHMZBOCLSA-N 1 2 235.331 2.270 20 0 BEADLO CC(C)[C@H]1C[C@@H]1C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000898906240 584164989 /nfs/dbraw/zinc/16/49/89/584164989.db2.gz KKKZKRUVEVTUBB-NEPJUHHUSA-N 1 2 249.358 2.027 20 0 BEADLO CC(C)[C@H](C)C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000898902382 584165303 /nfs/dbraw/zinc/16/53/03/584165303.db2.gz NDRIQBROZHTJLT-NSHDSACASA-N 1 2 237.347 2.027 20 0 BEADLO CCC/C(C)=C/C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000898904529 584165317 /nfs/dbraw/zinc/16/53/17/584165317.db2.gz HAYPDMVOTYXJTQ-FMIVXFBMSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1cccc(CCCNc2nccnc2F)[nH+]1 ZINC000858542406 588964433 /nfs/dbraw/zinc/96/44/33/588964433.db2.gz VGCTXGKSERYINX-UHFFFAOYSA-N 1 2 246.289 2.364 20 0 BEADLO CCc1nc(CNc2[nH+]cccc2OC)co1 ZINC000858562037 588966409 /nfs/dbraw/zinc/96/64/09/588966409.db2.gz AXEMBQNXPYBVRD-UHFFFAOYSA-N 1 2 233.271 2.253 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccns1)c1ncc[nH]1 ZINC000858578035 588968465 /nfs/dbraw/zinc/96/84/65/588968465.db2.gz XAIPXHUJKMYHBB-JGVFFNPUSA-N 1 2 222.317 2.278 20 0 BEADLO Cc1ccc([C@H](O)C[NH+]2CC(OC(C)C)C2)cc1 ZINC000899901240 584250030 /nfs/dbraw/zinc/25/00/30/584250030.db2.gz GLQSQHBXDYFARZ-OAHLLOKOSA-N 1 2 249.354 2.138 20 0 BEADLO CCCCCCNC(=O)CNc1cccc[nH+]1 ZINC000900076116 584269787 /nfs/dbraw/zinc/26/97/87/584269787.db2.gz IVHZEHIOODBGTN-UHFFFAOYSA-N 1 2 235.331 2.190 20 0 BEADLO CN(C(=O)Cc1c[nH+]c[nH]1)C1CCCCCC1 ZINC000900098272 584273423 /nfs/dbraw/zinc/27/34/23/584273423.db2.gz XYXUVMGXVAAYKU-UHFFFAOYSA-N 1 2 235.331 2.133 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)NCCCC1CCCC1 ZINC000900106660 584276622 /nfs/dbraw/zinc/27/66/22/584276622.db2.gz QKAWFZLJBBCZHV-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)NCCCC1CCCC1 ZINC000900106660 584276625 /nfs/dbraw/zinc/27/66/25/584276625.db2.gz QKAWFZLJBBCZHV-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO C/C(Cl)=C\C(=O)Nc1ccc[nH+]c1N(C)C ZINC000900323413 584294762 /nfs/dbraw/zinc/29/47/62/584294762.db2.gz UKMPXVSEGMWRRF-BQYQJAHWSA-N 1 2 239.706 2.229 20 0 BEADLO CN(CC1CCCC1)C(=O)CNc1cccc[nH+]1 ZINC000900430133 584308415 /nfs/dbraw/zinc/30/84/15/584308415.db2.gz PNZTXMRUPNULGT-UHFFFAOYSA-N 1 2 247.342 2.142 20 0 BEADLO CCCC[C@@H]1CCC[C@@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000900543172 584324373 /nfs/dbraw/zinc/32/43/73/584324373.db2.gz LUSVLCZRNVCAQF-YPMHNXCESA-N 1 2 249.358 2.427 20 0 BEADLO CCCC[C@@H]1CCC[C@@H]1NC(=O)Cc1c[nH+]c[nH]1 ZINC000900543172 584324375 /nfs/dbraw/zinc/32/43/75/584324375.db2.gz LUSVLCZRNVCAQF-YPMHNXCESA-N 1 2 249.358 2.427 20 0 BEADLO CC(C)[C@@H]1CCCC[C@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000900566998 584326438 /nfs/dbraw/zinc/32/64/38/584326438.db2.gz TXVKEJCSBMYRFP-QWHCGFSZSA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)[C@@H]1CCCC[C@H]1NC(=O)Cc1c[nH+]c[nH]1 ZINC000900566998 584326439 /nfs/dbraw/zinc/32/64/39/584326439.db2.gz TXVKEJCSBMYRFP-QWHCGFSZSA-N 1 2 249.358 2.283 20 0 BEADLO C/C=C/c1cn(Cc2cc(C)cc(C)[nH+]2)nn1 ZINC000900622290 584332808 /nfs/dbraw/zinc/33/28/08/584332808.db2.gz PBOJNKJPTZHGDY-SNAWJCMRSA-N 1 2 228.299 2.371 20 0 BEADLO CC[C@H](C)[C@H]1CCCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC000900771789 584349186 /nfs/dbraw/zinc/34/91/86/584349186.db2.gz DFSCOIFZNFUKDV-WCQYABFASA-N 1 2 249.358 2.379 20 0 BEADLO CC(C)(C)CCCNC(=O)CNc1cccc[nH+]1 ZINC000900793028 584352814 /nfs/dbraw/zinc/35/28/14/584352814.db2.gz QGAVEIJYHUMSMP-UHFFFAOYSA-N 1 2 249.358 2.436 20 0 BEADLO CC(C)N(C(=O)CNc1cccc[nH+]1)C1CCC1 ZINC000900802947 584355674 /nfs/dbraw/zinc/35/56/74/584355674.db2.gz XGCQMQJFIYDLDU-UHFFFAOYSA-N 1 2 247.342 2.283 20 0 BEADLO CCC[C@H]1[C@H](C)CCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC000900870522 584363898 /nfs/dbraw/zinc/36/38/98/584363898.db2.gz UEONNFVSYXSHFM-YPMHNXCESA-N 1 2 249.358 2.379 20 0 BEADLO C=C/C(C)=C\CC(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000901001359 584372906 /nfs/dbraw/zinc/37/29/06/584372906.db2.gz VNSKYRFWVDADPB-TWGQIWQCSA-N 1 2 233.315 2.165 20 0 BEADLO CC[C@]1(C)CCN(C(=O)CNc2cccc[nH+]2)C1 ZINC000901032081 584375839 /nfs/dbraw/zinc/37/58/39/584375839.db2.gz PBPNNQHKOUALKC-CQSZACIVSA-N 1 2 247.342 2.142 20 0 BEADLO CCC1(CNC(=O)Cc2c[nH]c[nH+]2)CCCC1 ZINC000901057660 584379689 /nfs/dbraw/zinc/37/96/89/584379689.db2.gz LIDPKBHNSCMYSA-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO CCC1(CNC(=O)Cc2c[nH+]c[nH]2)CCCC1 ZINC000901057660 584379690 /nfs/dbraw/zinc/37/96/90/584379690.db2.gz LIDPKBHNSCMYSA-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO CC(C)C[C@@H](C)NC(=O)CNc1cccc[nH+]1 ZINC000901180900 584392064 /nfs/dbraw/zinc/39/20/64/584392064.db2.gz XVVREIDJZLTJKC-LLVKDONJSA-N 1 2 235.331 2.044 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1C(=O)CNc1cccc[nH+]1 ZINC000901299875 584418778 /nfs/dbraw/zinc/41/87/78/584418778.db2.gz CXLRCQXRFLDNOP-VXGBXAGGSA-N 1 2 247.342 2.283 20 0 BEADLO CC[C@H]1CC[C@H](C)N1C(=O)CNc1cccc[nH+]1 ZINC000901299873 584418859 /nfs/dbraw/zinc/41/88/59/584418859.db2.gz CXLRCQXRFLDNOP-RYUDHWBXSA-N 1 2 247.342 2.283 20 0 BEADLO Fc1ccc(-c2cc([C@@H]3COCC[NH2+]3)on2)cc1 ZINC000901387843 584436980 /nfs/dbraw/zinc/43/69/80/584436980.db2.gz QCIKJWKMKRHYEK-LBPRGKRZSA-N 1 2 248.257 2.142 20 0 BEADLO CC(C)n1c[nH+]cc1C=Cc1n[nH]cc1C=O ZINC000901463788 584451308 /nfs/dbraw/zinc/45/13/08/584451308.db2.gz BAQRCBBKPSWGQX-ARJAWSKDSA-N 1 2 230.271 2.170 20 0 BEADLO Cc1nc(NCc2ccnn2C(C)C)cc[nH+]1 ZINC000902124487 584528899 /nfs/dbraw/zinc/52/88/99/584528899.db2.gz GGVMMCVOGWYZEI-UHFFFAOYSA-N 1 2 231.303 2.175 20 0 BEADLO Cc1nc(NCc2cnn(C(C)C)c2)cc[nH+]1 ZINC000902125330 584529339 /nfs/dbraw/zinc/52/93/39/584529339.db2.gz QCLRBAUDYUGTQS-UHFFFAOYSA-N 1 2 231.303 2.175 20 0 BEADLO Clc1cncc(NCc2[nH+]ccn2C2CC2)n1 ZINC000902147807 584530325 /nfs/dbraw/zinc/53/03/25/584530325.db2.gz UCTNGZXHZGUQAC-UHFFFAOYSA-N 1 2 249.705 2.274 20 0 BEADLO Cc1[nH]c(CNc2nnc([C@@H]3C[C@@H]3C)o2)[nH+]c1C ZINC000902148433 584530571 /nfs/dbraw/zinc/53/05/71/584530571.db2.gz FKLRHMFVGJMNNG-IMTBSYHQSA-N 1 2 247.302 2.145 20 0 BEADLO Cc1[nH]c(CNc2nnc([C@H]3C[C@@H]3C)o2)[nH+]c1C ZINC000902148437 584530886 /nfs/dbraw/zinc/53/08/86/584530886.db2.gz FKLRHMFVGJMNNG-RCOVLWMOSA-N 1 2 247.302 2.145 20 0 BEADLO Cc1cnc(NCc2[nH+]ccn2C(C)C)cn1 ZINC000902211659 584535092 /nfs/dbraw/zinc/53/50/92/584535092.db2.gz RXBPRZSZSSLUDJ-UHFFFAOYSA-N 1 2 231.303 2.175 20 0 BEADLO COc1ccsc1CNc1cc(C)[nH+]cn1 ZINC000902196083 584536803 /nfs/dbraw/zinc/53/68/03/584536803.db2.gz PMBUDLJTOAOINR-UHFFFAOYSA-N 1 2 235.312 2.467 20 0 BEADLO CCOc1ccc(CNc2cc(C)[nH+]cn2)o1 ZINC000902196341 584537033 /nfs/dbraw/zinc/53/70/33/584537033.db2.gz SGQSHLZUQWFRIE-UHFFFAOYSA-N 1 2 233.271 2.389 20 0 BEADLO CC(C)OCC(N)=[NH+]OCc1ccsc1 ZINC000902220694 584540512 /nfs/dbraw/zinc/54/05/12/584540512.db2.gz IOLXDCZYOMQXTR-UHFFFAOYSA-N 1 2 228.317 2.172 20 0 BEADLO CC(C)OCC(N)=[NH+]OCC[C@@H]1C[C@H]1C1CC1 ZINC000902220185 584540717 /nfs/dbraw/zinc/54/07/17/584540717.db2.gz BKBRNXKBRWVHKU-NEPJUHHUSA-N 1 2 240.347 2.346 20 0 BEADLO Cc1cc(C)cc(C[N@H+](C)CN2CCOC2=O)c1 ZINC000902243080 584545588 /nfs/dbraw/zinc/54/55/88/584545588.db2.gz NCCMQLJDYGKNRD-UHFFFAOYSA-N 1 2 248.326 2.145 20 0 BEADLO Cc1cc(C)cc(C[N@@H+](C)CN2CCOC2=O)c1 ZINC000902243080 584545589 /nfs/dbraw/zinc/54/55/89/584545589.db2.gz NCCMQLJDYGKNRD-UHFFFAOYSA-N 1 2 248.326 2.145 20 0 BEADLO c1c[nH+]c(CNc2cccnc2C2CC2)[nH]1 ZINC000902291724 584548562 /nfs/dbraw/zinc/54/85/62/584548562.db2.gz UPOFOZBTLPKKGM-UHFFFAOYSA-N 1 2 214.272 2.294 20 0 BEADLO CNc1ccc(C)cc1C[NH2+]Cc1ccon1 ZINC000902300001 584553041 /nfs/dbraw/zinc/55/30/41/584553041.db2.gz HEFIEUXBNDJBDH-UHFFFAOYSA-N 1 2 231.299 2.315 20 0 BEADLO CCn1c[nH+]c(CNc2cncc(F)c2)c1 ZINC000902537143 584627966 /nfs/dbraw/zinc/62/79/66/584627966.db2.gz MDPXGZVRWCSDCO-UHFFFAOYSA-N 1 2 220.251 2.049 20 0 BEADLO CCn1c[nH+]c(CN[C@@H](C2CC2)C(F)(F)F)c1 ZINC000902560592 584634620 /nfs/dbraw/zinc/63/46/20/584634620.db2.gz BYHSSLNQSDARQG-JTQLQIEISA-N 1 2 247.264 2.334 20 0 BEADLO CCn1cnc(C[NH2+][C@H](C)c2ccns2)c1 ZINC000902627624 584646588 /nfs/dbraw/zinc/64/65/88/584646588.db2.gz YXCPVNKEOBWBKR-SECBINFHSA-N 1 2 236.344 2.210 20 0 BEADLO CC[C@H]1c2ccccc2C[N@H+]1CN1CCOC1=O ZINC000902665954 584653410 /nfs/dbraw/zinc/65/34/10/584653410.db2.gz HRDGPUUEOBFSFW-ZDUSSCGKSA-N 1 2 246.310 2.363 20 0 BEADLO CC[C@H]1c2ccccc2C[N@@H+]1CN1CCOC1=O ZINC000902665954 584653411 /nfs/dbraw/zinc/65/34/11/584653411.db2.gz HRDGPUUEOBFSFW-ZDUSSCGKSA-N 1 2 246.310 2.363 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]O[C@H](C)c1ccccc1 ZINC000902717198 584657915 /nfs/dbraw/zinc/65/79/15/584657915.db2.gz MMZMCRCJZYEURE-ZJUUUORDSA-N 1 2 222.288 2.281 20 0 BEADLO C[C@@H](O[NH+]=C(N)[C@H]1CCCO1)c1ccccc1 ZINC000902738717 584663205 /nfs/dbraw/zinc/66/32/05/584663205.db2.gz LRRKIKLNEXMGMG-ZYHUDNBSSA-N 1 2 234.299 2.425 20 0 BEADLO COc1ccc2[nH+]ccc(OCCCO)c2c1 ZINC000902899519 584692775 /nfs/dbraw/zinc/69/27/75/584692775.db2.gz AAZULKHPGPZKEY-UHFFFAOYSA-N 1 2 233.267 2.005 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@H](F)C2)c(C)nn1 ZINC000902991721 584709851 /nfs/dbraw/zinc/70/98/51/584709851.db2.gz ZPWIXBSEFIXLSF-LBPRGKRZSA-N 1 2 223.295 2.027 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@H](F)C2)c(C)nn1 ZINC000902991721 584709853 /nfs/dbraw/zinc/70/98/53/584709853.db2.gz ZPWIXBSEFIXLSF-LBPRGKRZSA-N 1 2 223.295 2.027 20 0 BEADLO CN(C)c1cc(C[N@@H+]2CCC[C@@H](F)C2)ccn1 ZINC000902994612 584712058 /nfs/dbraw/zinc/71/20/58/584712058.db2.gz GDTSWSBYVVNTOQ-GFCCVEGCSA-N 1 2 237.322 2.082 20 0 BEADLO CN(C)c1cc(C[N@H+]2CCC[C@@H](F)C2)ccn1 ZINC000902994612 584712061 /nfs/dbraw/zinc/71/20/61/584712061.db2.gz GDTSWSBYVVNTOQ-GFCCVEGCSA-N 1 2 237.322 2.082 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+]2CCC[C@@H](F)C2)o1 ZINC000902996736 584714108 /nfs/dbraw/zinc/71/41/08/584714108.db2.gz WIZXTMFOBGIDHQ-NXEZZACHSA-N 1 2 212.268 2.478 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+]2CCC[C@@H](F)C2)o1 ZINC000902996736 584714110 /nfs/dbraw/zinc/71/41/10/584714110.db2.gz WIZXTMFOBGIDHQ-NXEZZACHSA-N 1 2 212.268 2.478 20 0 BEADLO CCc1noc(C)c1C[N@@H+]1CCC[C@@H](F)C1 ZINC000902998030 584714539 /nfs/dbraw/zinc/71/45/39/584714539.db2.gz DZXMQESBOTUGIQ-SNVBAGLBSA-N 1 2 226.295 2.479 20 0 BEADLO CCc1noc(C)c1C[N@H+]1CCC[C@@H](F)C1 ZINC000902998030 584714541 /nfs/dbraw/zinc/71/45/41/584714541.db2.gz DZXMQESBOTUGIQ-SNVBAGLBSA-N 1 2 226.295 2.479 20 0 BEADLO CCC(CC)NC(=O)[C@H](C)[N@@H+]1CCC[C@H](F)C1 ZINC000903001362 584715773 /nfs/dbraw/zinc/71/57/73/584715773.db2.gz NMKYFCYUALRJAJ-QWRGUYRKSA-N 1 2 244.354 2.114 20 0 BEADLO CCC(CC)NC(=O)[C@H](C)[N@H+]1CCC[C@H](F)C1 ZINC000903001362 584715774 /nfs/dbraw/zinc/71/57/74/584715774.db2.gz NMKYFCYUALRJAJ-QWRGUYRKSA-N 1 2 244.354 2.114 20 0 BEADLO O[C@@H](C[N@@H+]1CCC[C@@H](F)C1)c1cccc(F)c1 ZINC000903002052 584716258 /nfs/dbraw/zinc/71/62/58/584716258.db2.gz VCQHRNGCKJHKPH-OLZOCXBDSA-N 1 2 241.281 2.293 20 0 BEADLO O[C@@H](C[N@H+]1CCC[C@@H](F)C1)c1cccc(F)c1 ZINC000903002052 584716259 /nfs/dbraw/zinc/71/62/59/584716259.db2.gz VCQHRNGCKJHKPH-OLZOCXBDSA-N 1 2 241.281 2.293 20 0 BEADLO CC(C)[C@H]([NH2+][C@H](C)c1ccco1)c1nncn1C ZINC000903061236 584722725 /nfs/dbraw/zinc/72/27/25/584722725.db2.gz LQCFGAVSMVAPRO-PWSUYJOCSA-N 1 2 248.330 2.456 20 0 BEADLO CCCn1cc([C@H](C)[NH2+]CC(C)(C)F)nn1 ZINC000903074335 584726779 /nfs/dbraw/zinc/72/67/79/584726779.db2.gz VCDJOIDXLCQBPA-VIFPVBQESA-N 1 2 228.315 2.087 20 0 BEADLO Cc1cc(N[C@H]2CCO[C@]23CCOC3)c[nH+]c1C ZINC000903220595 584737580 /nfs/dbraw/zinc/73/75/80/584737580.db2.gz NARYVDVTPFMZOA-KBPBESRZSA-N 1 2 248.326 2.058 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccnc(F)c2)C[C@@H](C)O1 ZINC000859134156 589007253 /nfs/dbraw/zinc/00/72/53/589007253.db2.gz DCKWOORYTOSOBY-ZYHUDNBSSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccnc(F)c2)C[C@@H](C)O1 ZINC000859134156 589007254 /nfs/dbraw/zinc/00/72/54/589007254.db2.gz DCKWOORYTOSOBY-ZYHUDNBSSA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H](N[C@H](c1ncccn1)C1CC1)c1[nH]cc[nH+]1 ZINC000903323090 584747170 /nfs/dbraw/zinc/74/71/70/584747170.db2.gz AKYBZPKUHVRTBP-KOLCDFICSA-N 1 2 243.314 2.002 20 0 BEADLO C[C@@H]([NH2+]Cc1cn(C)cn1)c1cc(O)cc(F)c1 ZINC000903352091 584755323 /nfs/dbraw/zinc/75/53/23/584755323.db2.gz QQPIUAOUPFHAKF-SECBINFHSA-N 1 2 249.289 2.116 20 0 BEADLO C[C@H]([NH2+]Cc1cn(C)cn1)c1cccc(O)c1F ZINC000903351356 584755558 /nfs/dbraw/zinc/75/55/58/584755558.db2.gz JZLSAYAATWNFOI-VIFPVBQESA-N 1 2 249.289 2.116 20 0 BEADLO Fc1cccc(F)c1CCCN1CC=CC[NH2+]1 ZINC000903489701 584780616 /nfs/dbraw/zinc/78/06/16/584780616.db2.gz XXNJDFXUSUZDHE-UHFFFAOYSA-N 1 2 238.281 2.274 20 0 BEADLO Cc1ccc(CN2CC=CC[NH2+]2)c(C)c1 ZINC000903490991 584781140 /nfs/dbraw/zinc/78/11/40/584781140.db2.gz QARIPMZSUYJANL-UHFFFAOYSA-N 1 2 202.301 2.180 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+]1CC[C@@H]2CC[C@@]21C[NH3+] ZINC000903856359 584808976 /nfs/dbraw/zinc/80/89/76/584808976.db2.gz QWYWNCLFZNXYFE-DZGCQCFKSA-N 1 2 248.345 2.447 20 0 BEADLO C/C=C(\C)c1nc(-c2ccc(N)[nH+]c2C)no1 ZINC000904261626 584859415 /nfs/dbraw/zinc/85/94/15/584859415.db2.gz IBHLNBMTACFVGG-QPJJXVBHSA-N 1 2 230.271 2.445 20 0 BEADLO CCCOC(=O)N[C@@H](C)c1[nH+]ccn1CC ZINC000859181167 589015152 /nfs/dbraw/zinc/01/51/52/589015152.db2.gz XLSCQXSWWKXRDC-VIFPVBQESA-N 1 2 225.292 2.100 20 0 BEADLO CC(C(=O)N1CC(n2cc[nH+]c2)C1)=C1CCCC1 ZINC000753618888 584897585 /nfs/dbraw/zinc/89/75/85/584897585.db2.gz TZINXBLISJWXPC-UHFFFAOYSA-N 1 2 245.326 2.157 20 0 BEADLO CC1(C)CCC[C@@H](NC(=O)Cc2[nH]cc[nH+]2)C1 ZINC000832754979 584912370 /nfs/dbraw/zinc/91/23/70/584912370.db2.gz XQMLROVBRCMEMP-SNVBAGLBSA-N 1 2 235.331 2.037 20 0 BEADLO CCCCOC(=O)c1ccc2[nH+]ccn2c1 ZINC000731907017 584931133 /nfs/dbraw/zinc/93/11/33/584931133.db2.gz DEXYJOCDGOQQCN-UHFFFAOYSA-N 1 2 218.256 2.291 20 0 BEADLO CCC/C(C)=C\C(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000764893730 584932630 /nfs/dbraw/zinc/93/26/30/584932630.db2.gz WWBHYEOSNLKZJW-ZJRUKIMVSA-N 1 2 247.342 2.130 20 0 BEADLO CCCC(C)=CC(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000764893730 584932631 /nfs/dbraw/zinc/93/26/31/584932631.db2.gz WWBHYEOSNLKZJW-ZJRUKIMVSA-N 1 2 247.342 2.130 20 0 BEADLO O[C@H](COc1cccc(-n2cc[nH+]c2)c1)C1CC1 ZINC000840759903 584946694 /nfs/dbraw/zinc/94/66/94/584946694.db2.gz LJQWDKWJCFMPIL-CQSZACIVSA-N 1 2 244.294 2.022 20 0 BEADLO CC(C)c1cnc(C[N@H+](C)[C@H]2CCOC2)o1 ZINC000733310119 584946834 /nfs/dbraw/zinc/94/68/34/584946834.db2.gz KWSCFXTTZBRLIO-JTQLQIEISA-N 1 2 224.304 2.019 20 0 BEADLO CC(C)c1cnc(C[N@@H+](C)[C@H]2CCOC2)o1 ZINC000733310119 584946835 /nfs/dbraw/zinc/94/68/35/584946835.db2.gz KWSCFXTTZBRLIO-JTQLQIEISA-N 1 2 224.304 2.019 20 0 BEADLO Cc1nonc1C[N@@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000734146515 584957212 /nfs/dbraw/zinc/95/72/12/584957212.db2.gz FVRLRPSLDYRVJN-MRVPVSSYSA-N 1 2 249.236 2.152 20 0 BEADLO Cc1nonc1C[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000734146515 584957213 /nfs/dbraw/zinc/95/72/13/584957213.db2.gz FVRLRPSLDYRVJN-MRVPVSSYSA-N 1 2 249.236 2.152 20 0 BEADLO Cc1nonc1C[N@@H+]1CCCc2sccc2C1 ZINC000734148888 584957901 /nfs/dbraw/zinc/95/79/01/584957901.db2.gz PMTIZGGSLYZUKY-UHFFFAOYSA-N 1 2 249.339 2.388 20 0 BEADLO Cc1nonc1C[N@H+]1CCCc2sccc2C1 ZINC000734148888 584957902 /nfs/dbraw/zinc/95/79/02/584957902.db2.gz PMTIZGGSLYZUKY-UHFFFAOYSA-N 1 2 249.339 2.388 20 0 BEADLO Clc1cc2c(nc[nH+]c2N2C[C@@H]3C[C@@H]3C2)[nH]1 ZINC000884589369 584959003 /nfs/dbraw/zinc/95/90/03/584959003.db2.gz ZEHBGZXLATUENS-KNVOCYPGSA-N 1 2 234.690 2.019 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+]C[C@H]1C[C@@H]1c1ccccc1 ZINC000734159476 584959109 /nfs/dbraw/zinc/95/91/09/584959109.db2.gz ONPUXXFJPHWUMS-IACUBPJLSA-N 1 2 247.338 2.331 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+]C[C@H]1CCc2ccccc21 ZINC000734158665 584959171 /nfs/dbraw/zinc/95/91/71/584959171.db2.gz KCWLLRNKAJNAGH-WCQYABFASA-N 1 2 247.338 2.258 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)C[C@H]2CCC[C@@H]2C)S1 ZINC000819775811 585006802 /nfs/dbraw/zinc/00/68/02/585006802.db2.gz JNOWCEHMULUONU-IVZWLZJFSA-N 1 2 240.372 2.420 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)C[C@H]2C=CCCC2)S1 ZINC000819781538 585007828 /nfs/dbraw/zinc/00/78/28/585007828.db2.gz KGJUGMHTRDVRBC-UWVGGRQHSA-N 1 2 238.356 2.340 20 0 BEADLO CC[N@H+](C[C@@H]1CCOC1)CC(F)(F)C(F)F ZINC000736620287 585008028 /nfs/dbraw/zinc/00/80/28/585008028.db2.gz BUAOCUGXDXFLOP-QMMMGPOBSA-N 1 2 243.244 2.245 20 0 BEADLO CC[N@@H+](C[C@@H]1CCOC1)CC(F)(F)C(F)F ZINC000736620287 585008029 /nfs/dbraw/zinc/00/80/29/585008029.db2.gz BUAOCUGXDXFLOP-QMMMGPOBSA-N 1 2 243.244 2.245 20 0 BEADLO COCC[N@H+](CC(C)C)CC(F)(F)C(F)F ZINC000736620944 585008290 /nfs/dbraw/zinc/00/82/90/585008290.db2.gz KLSVNCAYGWYGQF-UHFFFAOYSA-N 1 2 245.260 2.491 20 0 BEADLO COCC[N@@H+](CC(C)C)CC(F)(F)C(F)F ZINC000736620944 585008291 /nfs/dbraw/zinc/00/82/91/585008291.db2.gz KLSVNCAYGWYGQF-UHFFFAOYSA-N 1 2 245.260 2.491 20 0 BEADLO CCc1nnc(C[NH2+]Cc2ccc(C)nc2)s1 ZINC000353083358 585016774 /nfs/dbraw/zinc/01/67/74/585016774.db2.gz RFWAWHOHCRUJIK-UHFFFAOYSA-N 1 2 248.355 2.094 20 0 BEADLO NC(=[NH+]OCc1cccnc1)c1cccc(F)c1 ZINC000774819868 585036589 /nfs/dbraw/zinc/03/65/89/585036589.db2.gz AAJACHXBJRQSNQ-UHFFFAOYSA-N 1 2 245.257 2.267 20 0 BEADLO Cc1coc(C[NH2+][C@H](CCO)c2ccco2)c1 ZINC000886067921 585036910 /nfs/dbraw/zinc/03/69/10/585036910.db2.gz QPTCSOLYSIBNGT-GFCCVEGCSA-N 1 2 235.283 2.394 20 0 BEADLO CC(C)[C@@H]1C[C@H]1NC(=O)c1cccc2[nH+]ccn21 ZINC000838083512 585045447 /nfs/dbraw/zinc/04/54/47/585045447.db2.gz BZTMQOIJOGGKQP-WDEREUQCSA-N 1 2 243.310 2.109 20 0 BEADLO C[C@@]1(C(=O)OCc2cc[nH+]c(N)c2)CC=CCC1 ZINC000838184632 585049093 /nfs/dbraw/zinc/04/90/93/585049093.db2.gz SPSSAEBEIMXPPB-CQSZACIVSA-N 1 2 246.310 2.453 20 0 BEADLO CCn1ncc(C[N@H+]2CC=C(C(C)(C)C)CC2)n1 ZINC000838863760 585076074 /nfs/dbraw/zinc/07/60/74/585076074.db2.gz KIRFMTYVKZRCON-UHFFFAOYSA-N 1 2 248.374 2.476 20 0 BEADLO CCn1ncc(C[N@@H+]2CC=C(C(C)(C)C)CC2)n1 ZINC000838863760 585076075 /nfs/dbraw/zinc/07/60/75/585076075.db2.gz KIRFMTYVKZRCON-UHFFFAOYSA-N 1 2 248.374 2.476 20 0 BEADLO CCn1ncc(C[NH2+][C@H](C)c2cc(C)oc2C)n1 ZINC000838919596 585078279 /nfs/dbraw/zinc/07/82/79/585078279.db2.gz MZCYLRRTJUWQGJ-SNVBAGLBSA-N 1 2 248.330 2.359 20 0 BEADLO CCn1ncc(C[NH2+][C@@H](C)c2ccc(C)o2)n1 ZINC000838893043 585078864 /nfs/dbraw/zinc/07/88/64/585078864.db2.gz ZFRFWTCOLDKJMX-JTQLQIEISA-N 1 2 234.303 2.050 20 0 BEADLO CN(C)c1[nH+]cccc1COC(=O)CCC1CC1 ZINC000838951935 585080719 /nfs/dbraw/zinc/08/07/19/585080719.db2.gz CLODVWHUGPPZLN-UHFFFAOYSA-N 1 2 248.326 2.381 20 0 BEADLO O[C@@H](C[NH2+][C@@H](c1ccccc1)C(F)F)C1CC1 ZINC000839029212 585088465 /nfs/dbraw/zinc/08/84/65/585088465.db2.gz XOTSWXOFUDYGRX-RYUDHWBXSA-N 1 2 241.281 2.353 20 0 BEADLO CCn1ncc(C[NH2+][C@H](C)c2ccsc2)n1 ZINC000839075972 585090000 /nfs/dbraw/zinc/09/00/00/585090000.db2.gz OJGWJDMXTVFZMP-SECBINFHSA-N 1 2 236.344 2.210 20 0 BEADLO COCC1(C)C[NH+](Cc2cccnc2Cl)C1 ZINC000839145458 585092047 /nfs/dbraw/zinc/09/20/47/585092047.db2.gz LEGMFTFXQIYGCK-UHFFFAOYSA-N 1 2 240.734 2.203 20 0 BEADLO COc1cccc2cc(C[NH+]3CC(OC)C3)oc21 ZINC000839127936 585093524 /nfs/dbraw/zinc/09/35/24/585093524.db2.gz KJIKLTUGRZAASI-UHFFFAOYSA-N 1 2 247.294 2.272 20 0 BEADLO CCn1nc(C)c(C[NH+]2CC(CC)(CC)C2)n1 ZINC000839132908 585094093 /nfs/dbraw/zinc/09/40/93/585094093.db2.gz SNQYGDVWUBYBPY-UHFFFAOYSA-N 1 2 236.363 2.228 20 0 BEADLO Cc1ccc(C[NH+]2CC(C(F)F)C2)cn1 ZINC000839140238 585094332 /nfs/dbraw/zinc/09/43/32/585094332.db2.gz CZMJIFOIKOFQHP-UHFFFAOYSA-N 1 2 212.243 2.087 20 0 BEADLO COCC1(C)C[NH+](Cc2ccc(Cl)nc2)C1 ZINC000839142927 585094778 /nfs/dbraw/zinc/09/47/78/585094778.db2.gz HTQGDPODGRJLHN-UHFFFAOYSA-N 1 2 240.734 2.203 20 0 BEADLO CC(CCn1ccnc1)CCn1cc[nH+]c1 ZINC000839506738 585105899 /nfs/dbraw/zinc/10/58/99/585105899.db2.gz RBABTHNCABGRHX-UHFFFAOYSA-N 1 2 218.304 2.196 20 0 BEADLO C[C@H](CNC(=O)C[C@@H](C)C1CC1)Cn1cc[nH+]c1 ZINC000740727507 585105964 /nfs/dbraw/zinc/10/59/64/585105964.db2.gz RGQHPLBMHSOZLD-VXGBXAGGSA-N 1 2 249.358 2.072 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)C[C@H]1CC1(Cl)Cl ZINC000741806513 585119671 /nfs/dbraw/zinc/11/96/71/585119671.db2.gz SUQXOVQTTZRZGB-SSDOTTSWSA-N 1 2 234.130 2.035 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)C[C@H]1CC1(Cl)Cl ZINC000741806513 585119672 /nfs/dbraw/zinc/11/96/72/585119672.db2.gz SUQXOVQTTZRZGB-SSDOTTSWSA-N 1 2 234.130 2.035 20 0 BEADLO C[C@@H]1CCC[C@]2(C1)[NH2+]C1(CCCC1)C(=O)N2C ZINC000742438487 585126441 /nfs/dbraw/zinc/12/64/41/585126441.db2.gz DAFKDOPZQUFJKS-RISCZKNCSA-N 1 2 236.359 2.267 20 0 BEADLO O=C(/C=C/C1CC1)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000742633749 585129076 /nfs/dbraw/zinc/12/90/76/585129076.db2.gz HFEKGYFYXONLSA-URWSZGRFSA-N 1 2 245.326 2.013 20 0 BEADLO C[C@@H]1C[NH+](Cn2cc(Cl)cn2)C[C@@H](C)S1 ZINC000743377010 585136586 /nfs/dbraw/zinc/13/65/86/585136586.db2.gz WSVWSTUVSXQBFM-RKDXNWHRSA-N 1 2 245.779 2.320 20 0 BEADLO C[N@H+](CCCCCCCO)CC(F)F ZINC000743846637 585140880 /nfs/dbraw/zinc/14/08/80/585140880.db2.gz SLFWMPOIHHIXAN-UHFFFAOYSA-N 1 2 209.280 2.126 20 0 BEADLO C[N@@H+](CCCCCCCO)CC(F)F ZINC000743846637 585140881 /nfs/dbraw/zinc/14/08/81/585140881.db2.gz SLFWMPOIHHIXAN-UHFFFAOYSA-N 1 2 209.280 2.126 20 0 BEADLO C/C(=C/C(=O)NCCc1[nH]cc[nH+]1)C(C)(C)C ZINC000746242718 585166265 /nfs/dbraw/zinc/16/62/65/585166265.db2.gz LKRPVNLRLUPUNB-KTKRTIGZSA-N 1 2 235.331 2.061 20 0 BEADLO Cc1cccc(N2CC[NH+](CCF)CC2)c1C ZINC000746499201 585168854 /nfs/dbraw/zinc/16/88/54/585168854.db2.gz HEMGQSUZBWDECZ-UHFFFAOYSA-N 1 2 236.334 2.395 20 0 BEADLO CN(CCC1CC1)C(=O)c1cccc2[nH+]ccn21 ZINC000747479500 585179456 /nfs/dbraw/zinc/17/94/56/585179456.db2.gz MQQKXXKSVYLRIT-UHFFFAOYSA-N 1 2 243.310 2.206 20 0 BEADLO CC(C)=C(C)C(=O)Nc1cc(C)[nH+]cc1C ZINC000747525333 585180449 /nfs/dbraw/zinc/18/04/49/585180449.db2.gz JYUAXWQKDIOFFO-UHFFFAOYSA-N 1 2 218.300 2.415 20 0 BEADLO Cc1ccc(C(=O)OCc2c[nH+]cn2C)cc1F ZINC000747780027 585184129 /nfs/dbraw/zinc/18/41/29/585184129.db2.gz ARQRFIXUUXJKLA-UHFFFAOYSA-N 1 2 248.257 2.225 20 0 BEADLO C[C@@H]1CCC[C@H](C(=O)OCc2c[nH+]cn2C)C1 ZINC000747779910 585184284 /nfs/dbraw/zinc/18/42/84/585184284.db2.gz HGWZOWFTRGCHGS-MNOVXSKESA-N 1 2 236.315 2.290 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C[C@@H](C)C1CC1 ZINC000748207103 585189208 /nfs/dbraw/zinc/18/92/08/585189208.db2.gz DJSLYYPEQLFKRG-SECBINFHSA-N 1 2 234.299 2.465 20 0 BEADLO CCN(CCc1ccccn1)c1cc(C)[nH+]cn1 ZINC000748279649 585190221 /nfs/dbraw/zinc/19/02/21/585190221.db2.gz HDTXTHDTXGNGAK-UHFFFAOYSA-N 1 2 242.326 2.249 20 0 BEADLO O=C(CCCn1cc[nH+]c1)Oc1ccc(F)cc1 ZINC000748598056 585194457 /nfs/dbraw/zinc/19/44/57/585194457.db2.gz OWYXHKKHKZEXQP-UHFFFAOYSA-N 1 2 248.257 2.408 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)Cc1cnc(C)cn1 ZINC000749437135 585202555 /nfs/dbraw/zinc/20/25/55/585202555.db2.gz QMEDMGDPFFXZPR-UHFFFAOYSA-N 1 2 246.314 2.022 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)Cc1cnc(C)cn1 ZINC000749437135 585202556 /nfs/dbraw/zinc/20/25/56/585202556.db2.gz QMEDMGDPFFXZPR-UHFFFAOYSA-N 1 2 246.314 2.022 20 0 BEADLO Cc1nc2[nH]ccc2c(NC[C@H](O)CC(C)C)[nH+]1 ZINC000751218736 585226128 /nfs/dbraw/zinc/22/61/28/585226128.db2.gz HJCGCHVHTHDVMA-SNVBAGLBSA-N 1 2 248.330 2.085 20 0 BEADLO CC(C)=C(C)C(=O)NCCCCn1cc[nH+]c1 ZINC000751382448 585228696 /nfs/dbraw/zinc/22/86/96/585228696.db2.gz LJEKTUMNHZNNRC-UHFFFAOYSA-N 1 2 235.331 2.136 20 0 BEADLO CCOc1ccc(OC(=O)C[NH+]2CCCC2)cc1 ZINC000753886763 585271475 /nfs/dbraw/zinc/27/14/75/585271475.db2.gz SWZKMYNHFMIIRK-UHFFFAOYSA-N 1 2 249.310 2.087 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OC/C=C\c1ccccc1 ZINC000754296417 585282411 /nfs/dbraw/zinc/28/24/11/585282411.db2.gz QTHVOJNQNFPGIA-DHHDDZJSSA-N 1 2 234.299 2.233 20 0 BEADLO c1cc2[nH+]ccc(NCCOC3CCC3)c2cn1 ZINC000754489871 585285147 /nfs/dbraw/zinc/28/51/47/585285147.db2.gz YMLFKKVDHATMAG-UHFFFAOYSA-N 1 2 243.310 2.033 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@H]1CC12CCCC2 ZINC000754688151 585289380 /nfs/dbraw/zinc/28/93/80/585289380.db2.gz VRGAHKSXLAGYDD-LLVKDONJSA-N 1 2 234.299 2.044 20 0 BEADLO FCC[N@@H+]1CCO[C@@H](C2CCCCC2)C1 ZINC000755308423 585297379 /nfs/dbraw/zinc/29/73/79/585297379.db2.gz PPAIGVGIJLVSDY-GFCCVEGCSA-N 1 2 215.312 2.237 20 0 BEADLO FCC[N@H+]1CCO[C@@H](C2CCCCC2)C1 ZINC000755308423 585297380 /nfs/dbraw/zinc/29/73/80/585297380.db2.gz PPAIGVGIJLVSDY-GFCCVEGCSA-N 1 2 215.312 2.237 20 0 BEADLO CCC1(C(=O)Nc2ccc(C)[nH+]c2C)COC1 ZINC000755607447 585302176 /nfs/dbraw/zinc/30/21/76/585302176.db2.gz LAHLNXOFDMUWDX-UHFFFAOYSA-N 1 2 234.299 2.064 20 0 BEADLO C[C@H]([NH2+]Cc1coc(C2CC2)n1)c1cn[nH]c1 ZINC000756994812 585326195 /nfs/dbraw/zinc/32/61/95/585326195.db2.gz BOWXHGMUZLMUSG-QMMMGPOBSA-N 1 2 232.287 2.126 20 0 BEADLO CCC1(C(=O)OCc2c[nH+]cn2C)CCCC1 ZINC000757315342 585331641 /nfs/dbraw/zinc/33/16/41/585331641.db2.gz JMQQYQNGAZWQHU-UHFFFAOYSA-N 1 2 236.315 2.434 20 0 BEADLO COC1([C@@H](C)[NH2+]CC(F)(F)C(F)F)CCC1 ZINC000839659683 585333859 /nfs/dbraw/zinc/33/38/59/585333859.db2.gz GNTJEOVJHNKHJW-SSDOTTSWSA-N 1 2 243.244 2.434 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)/C=C/C2CC2)c1 ZINC000757714167 585344587 /nfs/dbraw/zinc/34/45/87/585344587.db2.gz MZGLOROZAQBCIL-AATRIKPKSA-N 1 2 247.294 2.408 20 0 BEADLO Cc1ccc2[nH+]c(COC(=O)C(C)C)cn2c1 ZINC000757929007 585347105 /nfs/dbraw/zinc/34/71/05/585347105.db2.gz RROLQCUUXIKQKV-UHFFFAOYSA-N 1 2 232.283 2.342 20 0 BEADLO NC(=[NH+]OCC[C@@H]1CCCCO1)c1ccccc1 ZINC000758768688 585359676 /nfs/dbraw/zinc/35/96/76/585359676.db2.gz LJRHLXOPINQHCF-ZDUSSCGKSA-N 1 2 248.326 2.492 20 0 BEADLO COCC[N@H+](CCF)Cc1ccc(F)cc1F ZINC000759330130 585368078 /nfs/dbraw/zinc/36/80/78/585368078.db2.gz DSGUFYNETVRPSX-UHFFFAOYSA-N 1 2 247.260 2.383 20 0 BEADLO COCC[N@@H+](CCF)Cc1ccc(F)cc1F ZINC000759330130 585368079 /nfs/dbraw/zinc/36/80/79/585368079.db2.gz DSGUFYNETVRPSX-UHFFFAOYSA-N 1 2 247.260 2.383 20 0 BEADLO Cc1nonc1C[NH2+]C(C)(C)c1ccc(C)nc1 ZINC000759908377 585382586 /nfs/dbraw/zinc/38/25/86/585382586.db2.gz ARRPRYUVGDQRTQ-UHFFFAOYSA-N 1 2 246.314 2.106 20 0 BEADLO Cc1nonc1C[NH2+]Cc1cccc2cc[nH]c21 ZINC000809743681 585383465 /nfs/dbraw/zinc/38/34/65/585383465.db2.gz AAWHGMJJDVTGSK-UHFFFAOYSA-N 1 2 242.282 2.149 20 0 BEADLO CCC[C@H]([NH2+][C@@H](C)c1ccc[nH]1)C(=O)OCC ZINC000760249067 585387513 /nfs/dbraw/zinc/38/75/13/585387513.db2.gz KYJSXITTXOGXGX-JQWIXIFHSA-N 1 2 238.331 2.397 20 0 BEADLO C/C=C\C(=O)N(C)CCCc1[nH+]ccn1CCC ZINC000760629747 585394888 /nfs/dbraw/zinc/39/48/88/585394888.db2.gz VGUJUNDXHZGHGX-DAXSKMNVSA-N 1 2 249.358 2.260 20 0 BEADLO Cc1ccnc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)n1 ZINC000761046583 585403964 /nfs/dbraw/zinc/40/39/64/585403964.db2.gz JOFSNDWESAQFLD-SECBINFHSA-N 1 2 245.248 2.169 20 0 BEADLO Cc1ccnc(C[N@H+]2CC[C@@H](C(F)(F)F)C2)n1 ZINC000761046583 585403965 /nfs/dbraw/zinc/40/39/65/585403965.db2.gz JOFSNDWESAQFLD-SECBINFHSA-N 1 2 245.248 2.169 20 0 BEADLO c1cc(-c2nc(C[N@@H+]3CC[C@@H]4C[C@@H]43)no2)cs1 ZINC000761095211 585408432 /nfs/dbraw/zinc/40/84/32/585408432.db2.gz PUESWVUIMYBAKW-SCZZXKLOSA-N 1 2 247.323 2.392 20 0 BEADLO c1cc(-c2nc(C[N@H+]3CC[C@@H]4C[C@@H]43)no2)cs1 ZINC000761095211 585408433 /nfs/dbraw/zinc/40/84/33/585408433.db2.gz PUESWVUIMYBAKW-SCZZXKLOSA-N 1 2 247.323 2.392 20 0 BEADLO C[C@@H](O)[C@H](C)SCc1cc[nH+]c(N(C)C)c1 ZINC000762478336 585432897 /nfs/dbraw/zinc/43/28/97/585432897.db2.gz FWTABWMTLYNEGE-ZJUUUORDSA-N 1 2 240.372 2.150 20 0 BEADLO CCC/C=C/C(=O)NCc1ccn2cc[nH+]c2c1 ZINC000762560337 585434004 /nfs/dbraw/zinc/43/40/04/585434004.db2.gz CPKJRSLAPKWBNS-SNAWJCMRSA-N 1 2 243.310 2.307 20 0 BEADLO Cc1ccc(C(=O)OCCn2cc[nH+]c2)cc1F ZINC000763111010 585443329 /nfs/dbraw/zinc/44/33/29/585443329.db2.gz CRROWNRSEAVTLO-UHFFFAOYSA-N 1 2 248.257 2.188 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+][C@@H](C)Cc1ccccc1C ZINC000763285758 585446018 /nfs/dbraw/zinc/44/60/18/585446018.db2.gz TVNQTBDGMMQCDT-QWHCGFSZSA-N 1 2 249.354 2.467 20 0 BEADLO Cc1ccc(C(=O)OCCCn2cc[nH+]c2)o1 ZINC000763289621 585446205 /nfs/dbraw/zinc/44/62/05/585446205.db2.gz WHCIQEHISJPXTF-UHFFFAOYSA-N 1 2 234.255 2.032 20 0 BEADLO S=c1scnn1C[N@@H+]1CC[C@H](C2CC2)C1 ZINC000763331805 585446509 /nfs/dbraw/zinc/44/65/09/585446509.db2.gz IXASPTJKWBYZPM-VIFPVBQESA-N 1 2 241.385 2.363 20 0 BEADLO S=c1scnn1C[N@H+]1CC[C@H](C2CC2)C1 ZINC000763331805 585446510 /nfs/dbraw/zinc/44/65/10/585446510.db2.gz IXASPTJKWBYZPM-VIFPVBQESA-N 1 2 241.385 2.363 20 0 BEADLO CCN(CC(C)C)C(=O)c1cccc2[nH+]ccn21 ZINC000763776815 585454124 /nfs/dbraw/zinc/45/41/24/585454124.db2.gz NIKMITSEXBMGFH-UHFFFAOYSA-N 1 2 245.326 2.452 20 0 BEADLO C[C@H](OC(=O)c1ccc2[nH+]ccn2c1)C1CC1 ZINC000764391542 585464717 /nfs/dbraw/zinc/46/47/17/585464717.db2.gz WKIANWUPOLDSEA-VIFPVBQESA-N 1 2 230.267 2.290 20 0 BEADLO Cn1ccc(CNc2cc[nH+]c(C(C)(C)C)n2)n1 ZINC000765626065 585491634 /nfs/dbraw/zinc/49/16/34/585491634.db2.gz XEYARSVJYAGMEY-UHFFFAOYSA-N 1 2 245.330 2.120 20 0 BEADLO C[N@H+](CC1CCOCC1)CC(F)(F)C(F)F ZINC000767712518 585525260 /nfs/dbraw/zinc/52/52/60/585525260.db2.gz SLEUJQRICJUAHY-UHFFFAOYSA-N 1 2 243.244 2.245 20 0 BEADLO C[N@@H+](CC1CCOCC1)CC(F)(F)C(F)F ZINC000767712518 585525261 /nfs/dbraw/zinc/52/52/61/585525261.db2.gz SLEUJQRICJUAHY-UHFFFAOYSA-N 1 2 243.244 2.245 20 0 BEADLO C/C=C(/C)C(=O)N1CCC[C@@H](c2[nH+]ccn2C)C1 ZINC000768132406 585532558 /nfs/dbraw/zinc/53/25/58/585532558.db2.gz HRGOLQQAILLITI-CSXHZRMWSA-N 1 2 247.342 2.092 20 0 BEADLO CC(C)(F)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000768401211 585538304 /nfs/dbraw/zinc/53/83/04/585538304.db2.gz DFWJGYYSBCHLMF-UHFFFAOYSA-N 1 2 221.235 2.021 20 0 BEADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cn[nH]c2)no1 ZINC000768429196 585538608 /nfs/dbraw/zinc/53/86/08/585538608.db2.gz MQBHJFJGVPUQTL-GFCCVEGCSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cn[nH]c2)no1 ZINC000768429196 585538609 /nfs/dbraw/zinc/53/86/09/585538609.db2.gz MQBHJFJGVPUQTL-GFCCVEGCSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1cccc2c1CC[N@H+](Cc1cc[nH]n1)C2 ZINC000769337019 585554205 /nfs/dbraw/zinc/55/42/05/585554205.db2.gz BIBICNOYGVPJGE-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1cccc2c1CC[N@@H+](Cc1cc[nH]n1)C2 ZINC000769337019 585554206 /nfs/dbraw/zinc/55/42/06/585554206.db2.gz BIBICNOYGVPJGE-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO CCc1noc(C)c1[C@H](C)[NH2+]Cc1cc[nH]n1 ZINC000769875805 585566011 /nfs/dbraw/zinc/56/60/11/585566011.db2.gz XDDNIOYJXHYRQX-QMMMGPOBSA-N 1 2 234.303 2.119 20 0 BEADLO C[C@H]1CCCCN1C(=O)c1cccc2[nH+]ccn21 ZINC000770053010 585570205 /nfs/dbraw/zinc/57/02/05/585570205.db2.gz MQIARQZGKUWSDY-NSHDSACASA-N 1 2 243.310 2.349 20 0 BEADLO C[C@H]1CCC[C@H]1NC(=O)c1cccc2[nH+]ccn21 ZINC000770417796 585573990 /nfs/dbraw/zinc/57/39/90/585573990.db2.gz NZEPYSUYWSZSHM-WDEREUQCSA-N 1 2 243.310 2.253 20 0 BEADLO C/C=C(\C)C(=O)Nc1cccc2[nH+]ccn21 ZINC000770565734 585576698 /nfs/dbraw/zinc/57/66/98/585576698.db2.gz BNBWYDYOAABQPD-YCRREMRBSA-N 1 2 215.256 2.239 20 0 BEADLO CCC[C@H](C)c1noc(Cn2cc[nH+]c2)n1 ZINC000770873764 585583189 /nfs/dbraw/zinc/58/31/89/585583189.db2.gz CMYUGPKSOYATBJ-VIFPVBQESA-N 1 2 220.276 2.218 20 0 BEADLO O=C(/C=C\c1ccsc1)OCCn1cc[nH+]c1 ZINC000771870690 585602971 /nfs/dbraw/zinc/60/29/71/585602971.db2.gz UQADPDYSRPMDRB-UPHRSURJSA-N 1 2 248.307 2.201 20 0 BEADLO C[C@H]1CCC[C@@H](C(=O)OCCn2cc[nH+]c2)C1 ZINC000771977728 585606138 /nfs/dbraw/zinc/60/61/38/585606138.db2.gz QAQMYLHZAAQXOP-NWDGAFQWSA-N 1 2 236.315 2.253 20 0 BEADLO C[C@@H]1CCC[C@@H](C(=O)OCCn2cc[nH+]c2)C1 ZINC000771977730 585606191 /nfs/dbraw/zinc/60/61/91/585606191.db2.gz QAQMYLHZAAQXOP-VXGBXAGGSA-N 1 2 236.315 2.253 20 0 BEADLO C[C@H]1CC/C(=C\C(=O)OCCn2cc[nH+]c2)C1 ZINC000771999729 585606741 /nfs/dbraw/zinc/60/67/41/585606741.db2.gz GWPYMGWSUUPZQQ-UTEVDWOZSA-N 1 2 234.299 2.173 20 0 BEADLO CCO[C@H]1C[C@@H]1C(=O)OCc1ccc(C)[nH+]c1C ZINC000772027378 585607203 /nfs/dbraw/zinc/60/72/03/585607203.db2.gz YXISTXOLQOMQTK-STQMWFEESA-N 1 2 249.310 2.167 20 0 BEADLO CCC(CC)[C@@H](C)C(=O)OCCn1cc[nH+]c1 ZINC000772030053 585607207 /nfs/dbraw/zinc/60/72/07/585607207.db2.gz NOSVKBWMCGHDJQ-LLVKDONJSA-N 1 2 238.331 2.499 20 0 BEADLO CCO[C@@H]1C[C@H]1C(=O)OCc1ccc(C)[nH+]c1C ZINC000772027375 585607298 /nfs/dbraw/zinc/60/72/98/585607298.db2.gz YXISTXOLQOMQTK-CHWSQXEVSA-N 1 2 249.310 2.167 20 0 BEADLO CC[C@@H](OC)C(=O)OCc1ccc(C)[nH+]c1C ZINC000772063575 585607861 /nfs/dbraw/zinc/60/78/61/585607861.db2.gz IENTWQNBUFAJDK-GFCCVEGCSA-N 1 2 237.299 2.167 20 0 BEADLO COCC1([N@H+](C)Cc2ncc(C)s2)CC1 ZINC000772273862 585611730 /nfs/dbraw/zinc/61/17/30/585611730.db2.gz YNFIRFRSXVNCJL-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO COCC1([N@@H+](C)Cc2ncc(C)s2)CC1 ZINC000772273862 585611731 /nfs/dbraw/zinc/61/17/31/585611731.db2.gz YNFIRFRSXVNCJL-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)OCCn1cc[nH+]c1 ZINC000772812939 585624687 /nfs/dbraw/zinc/62/46/87/585624687.db2.gz JZSZLJHZKZWKLN-PKNBQFBNSA-N 1 2 236.315 2.419 20 0 BEADLO COc1cc[nH+]cc1COC(=O)[C@H]1CC12CCC2 ZINC000805492252 585643273 /nfs/dbraw/zinc/64/32/73/585643273.db2.gz IGVRSWQJVAKWFP-LLVKDONJSA-N 1 2 247.294 2.324 20 0 BEADLO C/C(=C/C(C)(C)C)C(=O)NCCc1c[nH+]cn1C ZINC000773821814 585644491 /nfs/dbraw/zinc/64/44/91/585644491.db2.gz BOFPXKWHLLRHQT-FLIBITNWSA-N 1 2 249.358 2.071 20 0 BEADLO COc1cc[nH+]cc1COC(=O)[C@@H](F)C(C)C ZINC000805533885 585672523 /nfs/dbraw/zinc/67/25/23/585672523.db2.gz AJZVREDPCSEABI-NSHDSACASA-N 1 2 241.262 2.128 20 0 BEADLO CCOC(=O)C[NH2+][C@@](C)(CC)c1ccccc1 ZINC000775387354 585677174 /nfs/dbraw/zinc/67/71/74/585677174.db2.gz LRLTYKRWZMIPFT-AWEZNQCLSA-N 1 2 235.327 2.465 20 0 BEADLO Cn1c[nH+]cc1Cn1nc(Cl)c2ccccc21 ZINC000775679453 585682965 /nfs/dbraw/zinc/68/29/65/585682965.db2.gz CKWMNKISUGBIGV-UHFFFAOYSA-N 1 2 246.701 2.472 20 0 BEADLO CC(C)COC(=O)C[NH+]1C[C@H](C)S[C@@H](C)C1 ZINC000776587423 585701752 /nfs/dbraw/zinc/70/17/52/585701752.db2.gz GCCWKWFVCGOXAD-QWRGUYRKSA-N 1 2 245.388 2.011 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)c1cccc2[nH+]ccn21 ZINC000776851466 585706243 /nfs/dbraw/zinc/70/62/43/585706243.db2.gz CEXFHKDNBFBBQN-QWRGUYRKSA-N 1 2 245.326 2.499 20 0 BEADLO O=C(N[C@H]1CC=CCC1)c1cccc2[nH+]ccn21 ZINC000776937382 585706874 /nfs/dbraw/zinc/70/68/74/585706874.db2.gz JOPZOQVGBKTKMM-NSHDSACASA-N 1 2 241.294 2.173 20 0 BEADLO COc1ccc[nH+]c1N[C@@H](C)c1cnccn1 ZINC000777292357 585709756 /nfs/dbraw/zinc/70/97/56/585709756.db2.gz WRJPQCGZMORRKJ-VIFPVBQESA-N 1 2 230.271 2.053 20 0 BEADLO O=C(/C=C\C1CC1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000777454588 585712437 /nfs/dbraw/zinc/71/24/37/585712437.db2.gz ZWBKORUHHCTCSE-GZTOBOFZSA-N 1 2 231.299 2.039 20 0 BEADLO CC(C)=C(C)C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000777454685 585712526 /nfs/dbraw/zinc/71/25/26/585712526.db2.gz OZRXCOXFZDZJQZ-NSHDSACASA-N 1 2 233.315 2.430 20 0 BEADLO CCSCCO[NH+]=C(N)c1cccc(F)c1 ZINC000778028566 585725218 /nfs/dbraw/zinc/72/52/18/585725218.db2.gz MYAJOQKCZYQOAW-UHFFFAOYSA-N 1 2 242.319 2.425 20 0 BEADLO O=C1C[C@H](c2ccccc2)N1C[N@H+]1CC=CCC1 ZINC000778577707 585737781 /nfs/dbraw/zinc/73/77/81/585737781.db2.gz WPNOYOVSYFHHJJ-CQSZACIVSA-N 1 2 242.322 2.179 20 0 BEADLO O=C1C[C@H](c2ccccc2)N1C[N@@H+]1CC=CCC1 ZINC000778577707 585737782 /nfs/dbraw/zinc/73/77/82/585737782.db2.gz WPNOYOVSYFHHJJ-CQSZACIVSA-N 1 2 242.322 2.179 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]CCNc1ccccc1 ZINC000779079155 585744863 /nfs/dbraw/zinc/74/48/63/585744863.db2.gz RMSJQBAFINTENU-LLVKDONJSA-N 1 2 244.342 2.481 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1ccc(F)nc1 ZINC000779147779 585745368 /nfs/dbraw/zinc/74/53/68/585745368.db2.gz KYMHQQBTNSEEKS-ZYHUDNBSSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1ccc(F)nc1 ZINC000779147779 585745369 /nfs/dbraw/zinc/74/53/69/585745369.db2.gz KYMHQQBTNSEEKS-ZYHUDNBSSA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2ccc(F)nc2)C[C@H]1F ZINC000779166736 585746731 /nfs/dbraw/zinc/74/67/31/585746731.db2.gz UYUPTLQGWBVXGU-MWLCHTKSSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2ccc(F)nc2)C[C@H]1F ZINC000779166736 585746732 /nfs/dbraw/zinc/74/67/32/585746732.db2.gz UYUPTLQGWBVXGU-MWLCHTKSSA-N 1 2 226.270 2.401 20 0 BEADLO CCN(CC)c1ccc(N[C@@H](C)CCO)c[nH+]1 ZINC000779417694 585754494 /nfs/dbraw/zinc/75/44/94/585754494.db2.gz AZFFROCMROFLPD-NSHDSACASA-N 1 2 237.347 2.111 20 0 BEADLO C[NH+](C)[C@H](C(=O)OCCCF)c1ccccc1 ZINC000780094559 585772458 /nfs/dbraw/zinc/77/24/58/585772458.db2.gz OQKFNJITPQOXPY-LBPRGKRZSA-N 1 2 239.290 2.192 20 0 BEADLO CC/C(C)=C(/C)C(=O)NCc1[nH]c[nH+]c1C ZINC000780957094 585787336 /nfs/dbraw/zinc/78/73/36/585787336.db2.gz VZXYHBZIKFLTPY-HJWRWDBZSA-N 1 2 221.304 2.081 20 0 BEADLO CC[N@H+](C)Cc1cnn(-c2cc(C)cc(C)c2)n1 ZINC000781434353 585795914 /nfs/dbraw/zinc/79/59/14/585795914.db2.gz IJBOWRIVSWWUAC-UHFFFAOYSA-N 1 2 244.342 2.336 20 0 BEADLO CC[N@@H+](C)Cc1cnn(-c2cc(C)cc(C)c2)n1 ZINC000781434353 585795915 /nfs/dbraw/zinc/79/59/15/585795915.db2.gz IJBOWRIVSWWUAC-UHFFFAOYSA-N 1 2 244.342 2.336 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)c2cccc3[nH+]ccn32)C1 ZINC000781606299 585800435 /nfs/dbraw/zinc/80/04/35/585800435.db2.gz LKVSRIKWWGHPCU-MNOVXSKESA-N 1 2 243.310 2.253 20 0 BEADLO CC(C)OCC(N)=[NH+]OCC1CCCCC1 ZINC000781611849 585800447 /nfs/dbraw/zinc/80/04/47/585800447.db2.gz BULSQVZKIKJGNZ-UHFFFAOYSA-N 1 2 228.336 2.490 20 0 BEADLO O=C(CCc1ccco1)OCCCn1cc[nH+]c1 ZINC000781970182 585806033 /nfs/dbraw/zinc/80/60/33/585806033.db2.gz PLYVRVIVDJVVJN-UHFFFAOYSA-N 1 2 248.282 2.042 20 0 BEADLO CC[C@H](NC(=O)C[C@@H](C)C1CC1)c1[nH]cc[nH+]1 ZINC000781994127 585806499 /nfs/dbraw/zinc/80/64/99/585806499.db2.gz YAKZNQDKBXPCNR-KOLCDFICSA-N 1 2 235.331 2.413 20 0 BEADLO CC(C)CC(=O)OCc1cc[nH+]c(N(C)C)c1 ZINC000782147318 585808538 /nfs/dbraw/zinc/80/85/38/585808538.db2.gz RZACQYYVAIJHPB-UHFFFAOYSA-N 1 2 236.315 2.237 20 0 BEADLO C[C@H]1C[C@H](CO[NH+]=C(N)c2ccccc2)CCO1 ZINC000783001294 585826808 /nfs/dbraw/zinc/82/68/08/585826808.db2.gz MFHIUQUSLOJQQO-NWDGAFQWSA-N 1 2 248.326 2.348 20 0 BEADLO C/C(=C/C(=O)OCCCn1cc[nH+]c1)C1CC1 ZINC000783084979 585827663 /nfs/dbraw/zinc/82/76/63/585827663.db2.gz JWCXOZVVWSGSSP-LUAWRHEFSA-N 1 2 234.299 2.173 20 0 BEADLO CC(C)OCC(N)=[NH+]OCCC1CCCC1 ZINC000783555572 585836574 /nfs/dbraw/zinc/83/65/74/585836574.db2.gz ZVQPRIHNCAEDEI-UHFFFAOYSA-N 1 2 228.336 2.490 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)[C@H]1[C@@H]2CCCC[C@@H]21 ZINC000784040931 585847769 /nfs/dbraw/zinc/84/77/69/585847769.db2.gz SBFKWPNAEFASME-ITGUQSILSA-N 1 2 248.326 2.253 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@H](F)C(C)C ZINC000784079535 585848903 /nfs/dbraw/zinc/84/89/03/585848903.db2.gz PVZGBYLTVVYGLQ-SNVBAGLBSA-N 1 2 226.251 2.023 20 0 BEADLO CC(C)C(C)(C)C(=O)OCCn1cc[nH+]c1 ZINC000784329230 585855852 /nfs/dbraw/zinc/85/58/52/585855852.db2.gz ODJNGCCAHMVJPF-UHFFFAOYSA-N 1 2 224.304 2.109 20 0 BEADLO CC(C)[C@H](F)C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000784459519 585860872 /nfs/dbraw/zinc/86/08/72/585860872.db2.gz KBKYJGUDBIISDS-UWVGGRQHSA-N 1 2 239.294 2.067 20 0 BEADLO C[C@H]1CC[C@@H](C(=O)OCCCn2cc[nH+]c2)C1 ZINC000784568072 585863601 /nfs/dbraw/zinc/86/36/01/585863601.db2.gz PZMZBRVIBLZRHT-NWDGAFQWSA-N 1 2 236.315 2.253 20 0 BEADLO CC[C@@H](C)[C@H](C)C(=O)OCCCn1cc[nH+]c1 ZINC000784614450 585864699 /nfs/dbraw/zinc/86/46/99/585864699.db2.gz RMYMFRRPRWTSGG-NEPJUHHUSA-N 1 2 238.331 2.499 20 0 BEADLO Cc1nc(F)ccc1C[NH2+]Cc1ncccc1F ZINC000785501556 585874731 /nfs/dbraw/zinc/87/47/31/585874731.db2.gz AXICEUVTWOPEBP-UHFFFAOYSA-N 1 2 249.264 2.353 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)Cc1ccc(F)cn1 ZINC000787170064 585902511 /nfs/dbraw/zinc/90/25/11/585902511.db2.gz UQUTUQUDMPMNMM-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)Cc1ccc(F)cn1 ZINC000787170064 585902512 /nfs/dbraw/zinc/90/25/12/585902512.db2.gz UQUTUQUDMPMNMM-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO Nc1cc(COC(=O)/C=C\c2ccco2)cc[nH+]1 ZINC000787578546 585912173 /nfs/dbraw/zinc/91/21/73/585912173.db2.gz LINFBWHKBHNBQU-ARJAWSKDSA-N 1 2 244.250 2.013 20 0 BEADLO Cc1ccc(C(=O)OCc2cc[nH+]c(N)c2)cc1 ZINC000787579360 585912298 /nfs/dbraw/zinc/91/22/98/585912298.db2.gz UJNSTOVORDPDAS-UHFFFAOYSA-N 1 2 242.278 2.329 20 0 BEADLO Cc1cc(CN(C)Cc2[nH]cc[nH+]2)c(C)o1 ZINC000787770152 585915656 /nfs/dbraw/zinc/91/56/56/585915656.db2.gz NMSRYXIDSNGVLQ-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OCCCCOC(C)(C)C ZINC000788786642 585930443 /nfs/dbraw/zinc/93/04/43/585930443.db2.gz HNEMHGJZYWQEMT-JTQLQIEISA-N 1 2 246.351 2.115 20 0 BEADLO C/C=C(/CC)C(=O)N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000788933315 585932213 /nfs/dbraw/zinc/93/22/13/585932213.db2.gz SSJSGIKIRHSMOZ-MCWZUMHDSA-N 1 2 247.342 2.092 20 0 BEADLO NC(=[NH+]OCCCc1ccccc1)[C@H]1CCCO1 ZINC000789608830 585946315 /nfs/dbraw/zinc/94/63/15/585946315.db2.gz DQMGBLUAJNUSBS-CYBMUJFWSA-N 1 2 248.326 2.297 20 0 BEADLO CC(C)(C)CCCO[NH+]=C(N)[C@H]1CCCO1 ZINC000789610674 585946512 /nfs/dbraw/zinc/94/65/12/585946512.db2.gz KFPFKVYXJXUHTR-SNVBAGLBSA-N 1 2 228.336 2.490 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1cc2ccccc2[nH]1 ZINC000789733131 585949294 /nfs/dbraw/zinc/94/92/94/585949294.db2.gz XMCPFZDASPSIQC-UHFFFAOYSA-N 1 2 246.310 2.163 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1cc2ccccc2[nH]1 ZINC000789733131 585949295 /nfs/dbraw/zinc/94/92/95/585949295.db2.gz XMCPFZDASPSIQC-UHFFFAOYSA-N 1 2 246.310 2.163 20 0 BEADLO Cn1cc[nH+]c1CCCOC(=O)[C@@H]1CC=CCC1 ZINC000789786991 585950094 /nfs/dbraw/zinc/95/00/94/585950094.db2.gz FCCHNZJHTLKXLR-GFCCVEGCSA-N 1 2 248.326 2.252 20 0 BEADLO CC(C)CCC(=O)OCCCc1[nH+]ccn1C ZINC000789791226 585950262 /nfs/dbraw/zinc/95/02/62/585950262.db2.gz GUZFQAQUXGOEKE-UHFFFAOYSA-N 1 2 238.331 2.332 20 0 BEADLO Cc1ccnc(CO[NH+]=C(N)c2ccccc2)c1 ZINC000790487659 585965401 /nfs/dbraw/zinc/96/54/01/585965401.db2.gz XFWRAHAUBSCTAO-UHFFFAOYSA-N 1 2 241.294 2.437 20 0 BEADLO CC(C)(C(=O)O[C@H]1CC[N@H+](CCF)C1)C1CC1 ZINC000805937509 585970428 /nfs/dbraw/zinc/97/04/28/585970428.db2.gz DCEVBDABFFPBEE-NSHDSACASA-N 1 2 243.322 2.010 20 0 BEADLO CC(C)(C(=O)O[C@H]1CC[N@@H+](CCF)C1)C1CC1 ZINC000805937509 585970429 /nfs/dbraw/zinc/97/04/29/585970429.db2.gz DCEVBDABFFPBEE-NSHDSACASA-N 1 2 243.322 2.010 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1ncc(Cl)n1C ZINC000791567738 585984357 /nfs/dbraw/zinc/98/43/57/585984357.db2.gz KPVWWEUNXYBAGH-HTQZYQBOSA-N 1 2 213.712 2.056 20 0 BEADLO CCC1(C(=O)OCc2cc[nH+]c(N)c2)CCC1 ZINC000791994529 585992976 /nfs/dbraw/zinc/99/29/76/585992976.db2.gz MCYAMSLICIGFNN-UHFFFAOYSA-N 1 2 234.299 2.287 20 0 BEADLO CC1=C(C(=O)OCc2cc[nH+]c(N)c2)CCC1 ZINC000792055244 585995142 /nfs/dbraw/zinc/99/51/42/585995142.db2.gz RUHZGQDYOOJZMN-UHFFFAOYSA-N 1 2 232.283 2.207 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1C(=O)OCc1cc[nH+]c(N)c1 ZINC000792151124 585996608 /nfs/dbraw/zinc/99/66/08/585996608.db2.gz MGJOXABBUWSPDC-SMDDNHRTSA-N 1 2 248.326 2.389 20 0 BEADLO CON(C)Cc1ccc(-n2cc[nH+]c2)cc1C ZINC000792202090 585997746 /nfs/dbraw/zinc/99/77/46/585997746.db2.gz DZJSJOWZSCWJGH-UHFFFAOYSA-N 1 2 231.299 2.174 20 0 BEADLO CCC[C@](C)(CC)C(=O)NC1=[NH+]CCS1 ZINC000792857370 586005821 /nfs/dbraw/zinc/00/58/21/586005821.db2.gz YWKHWQAVLMBTEU-NSHDSACASA-N 1 2 228.361 2.422 20 0 BEADLO CC(C)c1ccoc1C(=O)OCc1c[nH+]cn1C ZINC000793159086 586012124 /nfs/dbraw/zinc/01/21/24/586012124.db2.gz BUQIMOYWAIOIDZ-UHFFFAOYSA-N 1 2 248.282 2.494 20 0 BEADLO CC(C)C[C@@H](C)C(=O)OCCc1c[nH+]cn1C ZINC000793251122 586015031 /nfs/dbraw/zinc/01/50/31/586015031.db2.gz PCWWIEOLXOXQMY-LLVKDONJSA-N 1 2 238.331 2.188 20 0 BEADLO CC(C(=O)OCCc1c[nH+]cn1C)=C1CCCC1 ZINC000793252924 586015124 /nfs/dbraw/zinc/01/51/24/586015124.db2.gz LNBAXZNGDHYHOK-UHFFFAOYSA-N 1 2 248.326 2.396 20 0 BEADLO CC[C@H]1CC[N@@H+]1Cn1nc(C)sc1=S ZINC000793821041 586027375 /nfs/dbraw/zinc/02/73/75/586027375.db2.gz OBIVHNDZBWIIMJ-QMMMGPOBSA-N 1 2 229.374 2.424 20 0 BEADLO CC[C@H]1CC[N@H+]1Cn1nc(C)sc1=S ZINC000793821041 586027376 /nfs/dbraw/zinc/02/73/76/586027376.db2.gz OBIVHNDZBWIIMJ-QMMMGPOBSA-N 1 2 229.374 2.424 20 0 BEADLO CC[C@@H]1CC[N@@H+]1Cn1ccc(C(F)(F)F)n1 ZINC000793821750 586027556 /nfs/dbraw/zinc/02/75/56/586027556.db2.gz SBAWRAHFCHMDDR-MRVPVSSYSA-N 1 2 233.237 2.344 20 0 BEADLO CC[C@@H]1CC[N@H+]1Cn1ccc(C(F)(F)F)n1 ZINC000793821750 586027557 /nfs/dbraw/zinc/02/75/57/586027557.db2.gz SBAWRAHFCHMDDR-MRVPVSSYSA-N 1 2 233.237 2.344 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)Cc1cc(C)ncn1 ZINC000794279114 586036687 /nfs/dbraw/zinc/03/66/87/586036687.db2.gz OYDYYIYWVPVSFI-UHFFFAOYSA-N 1 2 246.314 2.022 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)Cc1cc(C)ncn1 ZINC000794279114 586036688 /nfs/dbraw/zinc/03/66/88/586036688.db2.gz OYDYYIYWVPVSFI-UHFFFAOYSA-N 1 2 246.314 2.022 20 0 BEADLO Cc1nnc(C[NH+]2CCC(CC(C)C)CC2)[nH]1 ZINC000794398757 586039182 /nfs/dbraw/zinc/03/91/82/586039182.db2.gz OBXURYJWKISYBE-UHFFFAOYSA-N 1 2 236.363 2.371 20 0 BEADLO NC(=[NH+]OCc1cncc(F)c1)c1ccccc1 ZINC000794884392 586052902 /nfs/dbraw/zinc/05/29/02/586052902.db2.gz PUMVINIFMBVHQC-UHFFFAOYSA-N 1 2 245.257 2.267 20 0 BEADLO CC(C)c1nc(N2CC(C)(F)C2)cc[nH+]1 ZINC000795194689 586071404 /nfs/dbraw/zinc/07/14/04/586071404.db2.gz FTXYARMENPDNEC-UHFFFAOYSA-N 1 2 209.268 2.148 20 0 BEADLO Cc1nnc([C@H](C)[NH+]2CCC(F)(F)CC2)o1 ZINC000796548986 586106736 /nfs/dbraw/zinc/10/67/36/586106736.db2.gz FCAUAWKTJWHHOH-ZETCQYMHSA-N 1 2 231.246 2.170 20 0 BEADLO C[C@H]([NH2+]Cc1ncccn1)c1ccnc(Cl)c1 ZINC000796592236 586108153 /nfs/dbraw/zinc/10/81/53/586108153.db2.gz CQNTYXYJKARJII-VIFPVBQESA-N 1 2 248.717 2.376 20 0 BEADLO CC(C)[N@H+](CCF)CC(=O)N1CCCCCC1 ZINC000796602678 586108367 /nfs/dbraw/zinc/10/83/67/586108367.db2.gz TUIHETPMWNHFEC-UHFFFAOYSA-N 1 2 244.354 2.069 20 0 BEADLO CC(C)[N@@H+](CCF)CC(=O)N1CCCCCC1 ZINC000796602678 586108368 /nfs/dbraw/zinc/10/83/68/586108368.db2.gz TUIHETPMWNHFEC-UHFFFAOYSA-N 1 2 244.354 2.069 20 0 BEADLO CCc1occc1C(=O)OCCCn1cc[nH+]c1 ZINC000797488768 586127860 /nfs/dbraw/zinc/12/78/60/586127860.db2.gz MVZWYFSJRNUWKP-UHFFFAOYSA-N 1 2 248.282 2.286 20 0 BEADLO CC1=C[C@@H](C)C[N@H+](Cc2ncc(Cl)n2C)C1 ZINC000797525615 586128462 /nfs/dbraw/zinc/12/84/62/586128462.db2.gz BPGBVNTXRGKRFC-SECBINFHSA-N 1 2 239.750 2.472 20 0 BEADLO CC1=C[C@@H](C)C[N@@H+](Cc2ncc(Cl)n2C)C1 ZINC000797525615 586128463 /nfs/dbraw/zinc/12/84/63/586128463.db2.gz BPGBVNTXRGKRFC-SECBINFHSA-N 1 2 239.750 2.472 20 0 BEADLO C[N@H+](CC[S@](C)=O)Cc1ccccc1Cl ZINC000798194276 586139617 /nfs/dbraw/zinc/13/96/17/586139617.db2.gz YZSHMUAUCADOIU-HNNXBMFYSA-N 1 2 245.775 2.150 20 0 BEADLO C[N@@H+](CC[S@](C)=O)Cc1ccccc1Cl ZINC000798194276 586139618 /nfs/dbraw/zinc/13/96/18/586139618.db2.gz YZSHMUAUCADOIU-HNNXBMFYSA-N 1 2 245.775 2.150 20 0 BEADLO CCn1cnn(C[N@H+](C)C2CCCC2)c1=S ZINC000798197189 586140364 /nfs/dbraw/zinc/14/03/64/586140364.db2.gz PKRPFIDXBHSHOA-UHFFFAOYSA-N 1 2 240.376 2.266 20 0 BEADLO CCn1cnn(C[N@@H+](C)C2CCCC2)c1=S ZINC000798197189 586140365 /nfs/dbraw/zinc/14/03/65/586140365.db2.gz PKRPFIDXBHSHOA-UHFFFAOYSA-N 1 2 240.376 2.266 20 0 BEADLO CC[C@H](C)[N@H+](CC(=O)OC)Cc1ccoc1 ZINC000798955189 586154069 /nfs/dbraw/zinc/15/40/69/586154069.db2.gz MATSFQQEMTWJLY-JTQLQIEISA-N 1 2 225.288 2.053 20 0 BEADLO CC[C@H](C)[N@@H+](CC(=O)OC)Cc1ccoc1 ZINC000798955189 586154070 /nfs/dbraw/zinc/15/40/70/586154070.db2.gz MATSFQQEMTWJLY-JTQLQIEISA-N 1 2 225.288 2.053 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC[C@H](c2ccccn2)C1 ZINC000798962972 586154674 /nfs/dbraw/zinc/15/46/74/586154674.db2.gz UULNDHRFQKFIHL-LBPRGKRZSA-N 1 2 242.326 2.103 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000798962972 586154675 /nfs/dbraw/zinc/15/46/75/586154675.db2.gz UULNDHRFQKFIHL-LBPRGKRZSA-N 1 2 242.326 2.103 20 0 BEADLO CC1=CC[N@H+](Cc2cnc(Cl)cn2)CC1 ZINC000799145423 586161963 /nfs/dbraw/zinc/16/19/63/586161963.db2.gz WSQSAXFPRZOFLX-UHFFFAOYSA-N 1 2 223.707 2.282 20 0 BEADLO CC1=CC[N@@H+](Cc2cnc(Cl)cn2)CC1 ZINC000799145423 586161964 /nfs/dbraw/zinc/16/19/64/586161964.db2.gz WSQSAXFPRZOFLX-UHFFFAOYSA-N 1 2 223.707 2.282 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OC[C@H](C)CC(C)C ZINC000799175874 586164756 /nfs/dbraw/zinc/16/47/56/586164756.db2.gz UNXSWKBUDLTVSH-NXEZZACHSA-N 1 2 216.325 2.202 20 0 BEADLO CC(C)c1ncc(C[N@H+](C)CCF)cn1 ZINC000799335308 586171845 /nfs/dbraw/zinc/17/18/45/586171845.db2.gz XSDPBUBELUNSMZ-UHFFFAOYSA-N 1 2 211.284 2.001 20 0 BEADLO CC(C)[C@@H]1CC[N@@H+]1Cc1ncc(Cl)n1C ZINC000799734494 586195656 /nfs/dbraw/zinc/19/56/56/586195656.db2.gz ZTYOCLIBBYQUCX-VIFPVBQESA-N 1 2 227.739 2.304 20 0 BEADLO CC(C)[C@@H]1CC[N@H+]1Cc1ncc(Cl)n1C ZINC000799734494 586195658 /nfs/dbraw/zinc/19/56/58/586195658.db2.gz ZTYOCLIBBYQUCX-VIFPVBQESA-N 1 2 227.739 2.304 20 0 BEADLO CCCC[C@@H](C)C(=O)NC1=[NH+]CCS1 ZINC000799872230 586198765 /nfs/dbraw/zinc/19/87/65/586198765.db2.gz OIFSMKJUUUZMRP-MRVPVSSYSA-N 1 2 214.334 2.032 20 0 BEADLO O=C1OCC[C@@H]1CC[N@H+]1CCCC[C@@H]1C(F)F ZINC000800445773 586220063 /nfs/dbraw/zinc/22/00/63/586220063.db2.gz KXTSUYPBUCIKAK-VHSXEESVSA-N 1 2 247.285 2.059 20 0 BEADLO O=C1OCC[C@@H]1CC[N@@H+]1CCCC[C@@H]1C(F)F ZINC000800445773 586220066 /nfs/dbraw/zinc/22/00/66/586220066.db2.gz KXTSUYPBUCIKAK-VHSXEESVSA-N 1 2 247.285 2.059 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2nccnc2C)no1 ZINC000800502793 586223752 /nfs/dbraw/zinc/22/37/52/586223752.db2.gz GZSLVPASPLMGSS-KOLCDFICSA-N 1 2 246.314 2.493 20 0 BEADLO Cc1nonc1C[NH+]1C[C@H](C)C(F)(F)[C@@H](C)C1 ZINC000859414397 589036065 /nfs/dbraw/zinc/03/60/65/589036065.db2.gz WHEOXUIMZPSEAY-YUMQZZPRSA-N 1 2 245.273 2.101 20 0 BEADLO CC(C)(C)SCCOCc1[nH]cc[nH+]1 ZINC000801659030 586268733 /nfs/dbraw/zinc/26/87/33/586268733.db2.gz SFADXBIFXKDIKD-UHFFFAOYSA-N 1 2 214.334 2.458 20 0 BEADLO CCC(=O)CC[N@@H+]1Cc2ccc(O)cc2C1 ZINC000859477522 589040081 /nfs/dbraw/zinc/04/00/81/589040081.db2.gz UDHNPNNBYIJXSW-UHFFFAOYSA-N 1 2 219.284 2.077 20 0 BEADLO CCC(=O)CC[N@H+]1Cc2ccc(O)cc2C1 ZINC000859477522 589040082 /nfs/dbraw/zinc/04/00/82/589040082.db2.gz UDHNPNNBYIJXSW-UHFFFAOYSA-N 1 2 219.284 2.077 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+](C)CCSC(C)(C)C ZINC000801932660 586278306 /nfs/dbraw/zinc/27/83/06/586278306.db2.gz TZYBQUQXJMMDSW-JTQLQIEISA-N 1 2 247.404 2.402 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+](C)CCSC(C)(C)C ZINC000801932660 586278308 /nfs/dbraw/zinc/27/83/08/586278308.db2.gz TZYBQUQXJMMDSW-JTQLQIEISA-N 1 2 247.404 2.402 20 0 BEADLO CNc1[nH+]c(C)ccc1C(=O)OC[C@H]1C[C@@H]1C ZINC000859501291 589041236 /nfs/dbraw/zinc/04/12/36/589041236.db2.gz KIUWDYDQCJENNV-WCBMZHEXSA-N 1 2 234.299 2.245 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)O[C@@H]1CC[N@H+](CCF)C1 ZINC000802238973 586299062 /nfs/dbraw/zinc/29/90/62/586299062.db2.gz LUCXYMPITNUTAP-QJPTWQEYSA-N 1 2 245.338 2.256 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)O[C@@H]1CC[N@@H+](CCF)C1 ZINC000802238973 586299063 /nfs/dbraw/zinc/29/90/63/586299063.db2.gz LUCXYMPITNUTAP-QJPTWQEYSA-N 1 2 245.338 2.256 20 0 BEADLO CC[C@H](C)CCC(=O)OCCc1c[nH+]cn1C ZINC000802777709 586314151 /nfs/dbraw/zinc/31/41/51/586314151.db2.gz OPNYZMQUCYOSAQ-NSHDSACASA-N 1 2 238.331 2.332 20 0 BEADLO CCC1(C(=O)OCCCc2[nH+]ccn2C)CC1 ZINC000802784659 586314239 /nfs/dbraw/zinc/31/42/39/586314239.db2.gz QXSMCVMANQYSBL-UHFFFAOYSA-N 1 2 236.315 2.086 20 0 BEADLO CC[C@@H](C)CCC(=O)OCCn1cc[nH+]c1 ZINC000802815473 586316383 /nfs/dbraw/zinc/31/63/83/586316383.db2.gz ZUJQCVOLQPWUJN-LLVKDONJSA-N 1 2 224.304 2.253 20 0 BEADLO Cc1nnc(CNc2cc3cc[nH]c3c[nH+]2)s1 ZINC000804605979 586403100 /nfs/dbraw/zinc/40/31/00/586403100.db2.gz VIZWHXHOUWOVDI-UHFFFAOYSA-N 1 2 245.311 2.335 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)NOCC(F)F ZINC000806537916 586413824 /nfs/dbraw/zinc/41/38/24/586413824.db2.gz XZLUGOWBXOJPOW-UHFFFAOYSA-N 1 2 245.229 2.017 20 0 BEADLO CC[NH2+]Cc1noc(C[C@H](C)CC(C)C)n1 ZINC000843145419 586445337 /nfs/dbraw/zinc/44/53/37/586445337.db2.gz KMIOMSKVGOQDQG-SNVBAGLBSA-N 1 2 225.336 2.404 20 0 BEADLO CC[NH2+]Cc1noc(CCCC(F)(F)F)n1 ZINC000843145649 586445964 /nfs/dbraw/zinc/44/59/64/586445964.db2.gz QJUYWMJJJAKWAO-UHFFFAOYSA-N 1 2 237.225 2.064 20 0 BEADLO Cc1cc(N[C@H](C)[C@H](O)c2ccccc2)nc[nH+]1 ZINC000808130752 586464174 /nfs/dbraw/zinc/46/41/74/586464174.db2.gz QJDPZJOKNSDVRK-RISCZKNCSA-N 1 2 243.310 2.319 20 0 BEADLO Cc1cc(N[C@@H](C)[C@@H](O)c2ccccc2)nc[nH+]1 ZINC000808130753 586464322 /nfs/dbraw/zinc/46/43/22/586464322.db2.gz QJDPZJOKNSDVRK-SMDDNHRTSA-N 1 2 243.310 2.319 20 0 BEADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2cn(C)cn2)o1 ZINC000808381239 586470601 /nfs/dbraw/zinc/47/06/01/586470601.db2.gz NFJHCVOCADDTIZ-GXFFZTMASA-N 1 2 245.326 2.426 20 0 BEADLO Cn1c[nH+]c(CNc2cccc(OCCF)c2)c1 ZINC000808399571 586471207 /nfs/dbraw/zinc/47/12/07/586471207.db2.gz PNWMMZBTFCSMHF-UHFFFAOYSA-N 1 2 249.289 2.381 20 0 BEADLO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1cn(C)cn1 ZINC000808444767 586472802 /nfs/dbraw/zinc/47/28/02/586472802.db2.gz PQHHETLTHAMJHH-YGRLFVJLSA-N 1 2 243.310 2.032 20 0 BEADLO CCC[N@H+](Cc1cnn(C)n1)Cc1ccccc1 ZINC000809932316 586523865 /nfs/dbraw/zinc/52/38/65/586523865.db2.gz UWDFCGYREYKOJN-UHFFFAOYSA-N 1 2 244.342 2.227 20 0 BEADLO CCC[N@@H+](Cc1cnn(C)n1)Cc1ccccc1 ZINC000809932316 586523866 /nfs/dbraw/zinc/52/38/66/586523866.db2.gz UWDFCGYREYKOJN-UHFFFAOYSA-N 1 2 244.342 2.227 20 0 BEADLO Cc1cn[nH]c1CNc1ccc2c(c1)C[N@H+](C)C2 ZINC000810149171 586535257 /nfs/dbraw/zinc/53/52/57/586535257.db2.gz ACDWYRDWMRMXKK-UHFFFAOYSA-N 1 2 242.326 2.276 20 0 BEADLO Cc1cn[nH]c1CNc1ccc2c(c1)C[N@@H+](C)C2 ZINC000810149171 586535259 /nfs/dbraw/zinc/53/52/59/586535259.db2.gz ACDWYRDWMRMXKK-UHFFFAOYSA-N 1 2 242.326 2.276 20 0 BEADLO O=C(OCCn1cc[nH+]c1)C1(F)CCCCC1 ZINC000810719730 586545430 /nfs/dbraw/zinc/54/54/30/586545430.db2.gz WPYAAHVWPKGHQZ-UHFFFAOYSA-N 1 2 240.278 2.099 20 0 BEADLO OC1(c2ccc(F)cc2)C[NH+](Cc2ccoc2)C1 ZINC000811503259 586560016 /nfs/dbraw/zinc/56/00/16/586560016.db2.gz CDJCDFRLTVKGJE-UHFFFAOYSA-N 1 2 247.269 2.122 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OC[C@@H]1C[C@H]1c1ccccc1 ZINC000812304327 586573117 /nfs/dbraw/zinc/57/31/17/586573117.db2.gz MIGVWUKGNPFTBF-DRZSPHRISA-N 1 2 248.326 2.323 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OC[C@@H]1C[C@H]1c1ccccc1 ZINC000812304328 586573269 /nfs/dbraw/zinc/57/32/69/586573269.db2.gz MIGVWUKGNPFTBF-WXHSDQCUSA-N 1 2 248.326 2.323 20 0 BEADLO CC(C)OCC(N)=[NH+]OCC1=CCCC1 ZINC000842648702 586574694 /nfs/dbraw/zinc/57/46/94/586574694.db2.gz YPNRSJBDYSCUJZ-UHFFFAOYSA-N 1 2 212.293 2.020 20 0 BEADLO O=C(CCCC1CC1)OCCn1cc[nH+]c1 ZINC000812601555 586580211 /nfs/dbraw/zinc/58/02/11/586580211.db2.gz BNDWSHMMLDJHGC-UHFFFAOYSA-N 1 2 222.288 2.007 20 0 BEADLO CN(C)c1cc(NCc2cccc(F)c2)[nH+]cn1 ZINC000813355020 586600914 /nfs/dbraw/zinc/60/09/14/586600914.db2.gz UXXRDFVLLZVANU-UHFFFAOYSA-N 1 2 246.289 2.294 20 0 BEADLO CN(C)c1cc(NCc2cccc(F)c2)nc[nH+]1 ZINC000813355020 586600915 /nfs/dbraw/zinc/60/09/15/586600915.db2.gz UXXRDFVLLZVANU-UHFFFAOYSA-N 1 2 246.289 2.294 20 0 BEADLO Cc1cccc(CNc2cc(N(C)C)nc[nH+]2)c1 ZINC000813354905 586601024 /nfs/dbraw/zinc/60/10/24/586601024.db2.gz NBHNEDFORSQGCU-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO Cc1cccc(CNc2cc(N(C)C)[nH+]cn2)c1 ZINC000813354905 586601025 /nfs/dbraw/zinc/60/10/25/586601025.db2.gz NBHNEDFORSQGCU-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO Cc1ccccc1CNc1cc(N(C)C)nc[nH+]1 ZINC000813354993 586601122 /nfs/dbraw/zinc/60/11/22/586601122.db2.gz SENARTFVYSODEO-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO Cc1ccccc1CNc1cc(N(C)C)[nH+]cn1 ZINC000813354993 586601123 /nfs/dbraw/zinc/60/11/23/586601123.db2.gz SENARTFVYSODEO-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO Cc1ccoc1C[N@@H+](C)[C@H]1CC(C)(C)OC1=O ZINC000814179487 586615767 /nfs/dbraw/zinc/61/57/67/586615767.db2.gz DCTJGSBWSZLVQX-JTQLQIEISA-N 1 2 237.299 2.114 20 0 BEADLO Cc1ccoc1C[N@H+](C)[C@H]1CC(C)(C)OC1=O ZINC000814179487 586615768 /nfs/dbraw/zinc/61/57/68/586615768.db2.gz DCTJGSBWSZLVQX-JTQLQIEISA-N 1 2 237.299 2.114 20 0 BEADLO O=C(OCCn1cc[nH+]c1)[C@H]1CC2CCC1CC2 ZINC000814498911 586623161 /nfs/dbraw/zinc/62/31/61/586623161.db2.gz ZMZRTADYSQILSU-BPCQOVAHSA-N 1 2 248.326 2.253 20 0 BEADLO C[C@@H](CC(=O)OCCn1cc[nH+]c1)c1ccco1 ZINC000859813638 589063011 /nfs/dbraw/zinc/06/30/11/589063011.db2.gz NRRTVBLAMFFMDH-NSHDSACASA-N 1 2 248.282 2.213 20 0 BEADLO C[C@@H](NC(=O)/C=C1/CC[C@H](C)C1)c1[nH]cc[nH+]1 ZINC000816719177 586760038 /nfs/dbraw/zinc/76/00/38/586760038.db2.gz RNCUQQQGLZHNIJ-FVMLCQCVSA-N 1 2 233.315 2.333 20 0 BEADLO C[C@@H](NC(=O)C=C1CC[C@H](C)C1)c1[nH]cc[nH+]1 ZINC000816719177 586760040 /nfs/dbraw/zinc/76/00/40/586760040.db2.gz RNCUQQQGLZHNIJ-FVMLCQCVSA-N 1 2 233.315 2.333 20 0 BEADLO CCCCCC[C@H](C)NC(=O)Cc1[nH]cc[nH+]1 ZINC000816842710 586767815 /nfs/dbraw/zinc/76/78/15/586767815.db2.gz BZCUMZRALGAOEK-NSHDSACASA-N 1 2 237.347 2.427 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)Nc1ccc2[nH]ccc2c1 ZINC000816843473 586767956 /nfs/dbraw/zinc/76/79/56/586767956.db2.gz GLSSANWLHFLJOE-UHFFFAOYSA-N 1 2 240.266 2.072 20 0 BEADLO C[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)Cc1[nH]cc[nH+]1 ZINC000816926767 586772168 /nfs/dbraw/zinc/77/21/68/586772168.db2.gz GYUULNFJLNFCBC-GRYCIOLGSA-N 1 2 247.342 2.132 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000817204425 586785776 /nfs/dbraw/zinc/78/57/76/586785776.db2.gz YJSUENPUYVLACQ-XQQFMLRXSA-N 1 2 248.326 2.253 20 0 BEADLO CCCc1[nH]ccc1C(=O)OCCn1cc[nH+]c1 ZINC000817271246 586792694 /nfs/dbraw/zinc/79/26/94/586792694.db2.gz VXWYPZXCSKZBAJ-UHFFFAOYSA-N 1 2 247.298 2.021 20 0 BEADLO O=C(OCc1cccc2[nH+]ccn21)[C@H]1CC12CC2 ZINC000817721691 586820373 /nfs/dbraw/zinc/82/03/73/586820373.db2.gz MFEURGCBWJSXOW-LLVKDONJSA-N 1 2 242.278 2.178 20 0 BEADLO CCCc1[nH]ccc1C(=O)OCc1c[nH+]cn1C ZINC000817721216 586820565 /nfs/dbraw/zinc/82/05/65/586820565.db2.gz YPXRIERSAQJSHW-UHFFFAOYSA-N 1 2 247.298 2.058 20 0 BEADLO CCc1nc(CNCc2c[nH+]cn2C(C)C)co1 ZINC000818215217 586880258 /nfs/dbraw/zinc/88/02/58/586880258.db2.gz CNMKHNVHRZLSHJ-UHFFFAOYSA-N 1 2 248.330 2.304 20 0 BEADLO Cc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)c(C)[nH+]1 ZINC000819376182 586958597 /nfs/dbraw/zinc/95/85/97/586958597.db2.gz UWAABEPQNXDXRF-VFFGBVLKSA-N 1 2 246.310 2.372 20 0 BEADLO CC[C@H](C)Oc1ccc([NH2+]CCC(N)=O)cc1 ZINC000819424977 586963180 /nfs/dbraw/zinc/96/31/80/586963180.db2.gz OPWWFWUOJZWZIA-JTQLQIEISA-N 1 2 236.315 2.151 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)CSC(C)(C)C)S1 ZINC000819763327 586990999 /nfs/dbraw/zinc/99/09/99/586990999.db2.gz NQZZTEFYXXZJCY-ZETCQYMHSA-N 1 2 246.401 2.126 20 0 BEADLO C[C@H](CC(=O)NC1=[NH+]C[C@H](C)S1)C1CC1 ZINC000819766434 586991424 /nfs/dbraw/zinc/99/14/24/586991424.db2.gz OGJFVNHVXUFCAM-SFYZADRCSA-N 1 2 226.345 2.030 20 0 BEADLO CS[C@@H](C)CCC(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819775442 586992528 /nfs/dbraw/zinc/99/25/28/586992528.db2.gz GIRCJEQAMMJRCT-JGVFFNPUSA-N 1 2 246.401 2.126 20 0 BEADLO CC(C)C[C@@H](C)C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819778065 586993276 /nfs/dbraw/zinc/99/32/76/586993276.db2.gz XYWJIUALNNZCOO-RKDXNWHRSA-N 1 2 228.361 2.276 20 0 BEADLO CC[C@@H](C)CCC(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819777464 586993300 /nfs/dbraw/zinc/99/33/00/586993300.db2.gz JIBIOJOMHHUKKF-BDAKNGLRSA-N 1 2 228.361 2.420 20 0 BEADLO CC/C(C)=C(\C)C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819777913 586993468 /nfs/dbraw/zinc/99/34/68/586993468.db2.gz WHINDJJIBANVMH-KGOFQHAKSA-N 1 2 226.345 2.340 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)CC2CC(C)(C)C2)S1 ZINC000819779887 586993837 /nfs/dbraw/zinc/99/38/37/586993837.db2.gz CCGGYXYQUPRYQD-MRVPVSSYSA-N 1 2 240.372 2.420 20 0 BEADLO C=C/C(C)=C\CC(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819783963 586994744 /nfs/dbraw/zinc/99/47/44/586994744.db2.gz VKIAPYGVUXLLDV-BZJXQOFCSA-N 1 2 224.329 2.116 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)C(C)(C)C2CCC2)S1 ZINC000819782401 586994963 /nfs/dbraw/zinc/99/49/63/586994963.db2.gz UZKGSDZCPASUKV-QMMMGPOBSA-N 1 2 240.372 2.420 20 0 BEADLO COc1ccc2[nH+]c(N[C@@H]3CC[C@H]3O)ccc2c1 ZINC000819947421 587005158 /nfs/dbraw/zinc/00/51/58/587005158.db2.gz BUBYHXBYXRVUBY-CHWSQXEVSA-N 1 2 244.294 2.179 20 0 BEADLO C[C@@H](NC(=O)C=C(C1CC1)C1CC1)c1[nH]cc[nH+]1 ZINC000820267948 587039397 /nfs/dbraw/zinc/03/93/97/587039397.db2.gz MXIGVZKXMGEIJG-SECBINFHSA-N 1 2 245.326 2.333 20 0 BEADLO O=C(NOCCC1CC1)c1cc2c[nH+]ccc2[nH]1 ZINC000820484652 587051058 /nfs/dbraw/zinc/05/10/58/587051058.db2.gz MFDWGELCDPYINO-UHFFFAOYSA-N 1 2 245.282 2.024 20 0 BEADLO C[C@H]1CCN(c2nccs2)C[C@H]1n1cc[nH+]c1 ZINC000820674934 587065101 /nfs/dbraw/zinc/06/51/01/587065101.db2.gz CDEKKPBZBHHOBF-WDEREUQCSA-N 1 2 248.355 2.427 20 0 BEADLO CCC1(NC(=O)/C=C\c2cn(C)c[nH+]2)CCCC1 ZINC000821141855 587097969 /nfs/dbraw/zinc/09/79/69/587097969.db2.gz ANQRVOXYYUKFOP-SREVYHEPSA-N 1 2 247.342 2.272 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)C1(C)CC=CC1 ZINC000821306804 587106467 /nfs/dbraw/zinc/10/64/67/587106467.db2.gz BIUMXIZTAUGUDD-NSHDSACASA-N 1 2 247.342 2.437 20 0 BEADLO Nc1cc(COC(=O)[C@H]2CCCC23CC3)cc[nH+]1 ZINC000860174027 589086236 /nfs/dbraw/zinc/08/62/36/589086236.db2.gz LJYSNMMUIUZPEA-LLVKDONJSA-N 1 2 246.310 2.287 20 0 BEADLO CCN(C(=O)Cc1[nH]cc[nH+]1)c1cccc(C)c1 ZINC000821425542 587119044 /nfs/dbraw/zinc/11/90/44/587119044.db2.gz HFKZMPJUQNQUKG-UHFFFAOYSA-N 1 2 243.310 2.314 20 0 BEADLO CC[C@@H]1CCCC[C@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000821830656 587141477 /nfs/dbraw/zinc/14/14/77/587141477.db2.gz NWNGJPAAERFDLV-GHMZBOCLSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000821830657 587141517 /nfs/dbraw/zinc/14/15/17/587141517.db2.gz NWNGJPAAERFDLV-MNOVXSKESA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H](NC(=O)/C=C\c1cn(C)c[nH+]1)C1CCCC1 ZINC000822058861 587150597 /nfs/dbraw/zinc/15/05/97/587150597.db2.gz MAZDKCAPZKXQIK-TVRMLOFPSA-N 1 2 247.342 2.128 20 0 BEADLO C[C@H]1CCC(C)(C)N1C(=O)/C=C/c1cn(C)c[nH+]1 ZINC000822191445 587158530 /nfs/dbraw/zinc/15/85/30/587158530.db2.gz XISCOHHSROCVAW-QRGHLMKCSA-N 1 2 247.342 2.223 20 0 BEADLO C[C@H]1CCC[C@]1(C)C(=O)NC1=[NH+]CCS1 ZINC000822234477 587158883 /nfs/dbraw/zinc/15/88/83/587158883.db2.gz VSVBKUDAUSDUMV-KWQFWETISA-N 1 2 226.345 2.032 20 0 BEADLO CCC[C@@H]1CCC[C@H]1C(=O)NC1=[NH+]CCS1 ZINC000822234362 587158963 /nfs/dbraw/zinc/15/89/63/587158963.db2.gz PVQPDHMFTCYTAN-NXEZZACHSA-N 1 2 240.372 2.422 20 0 BEADLO CS[C@H]1CC[C@@H]1[NH2+][C@@H](C)C(=O)OCC(C)C ZINC000822475954 587170674 /nfs/dbraw/zinc/17/06/74/587170674.db2.gz DZIWOKCCRPAGPJ-DCAQKATOSA-N 1 2 245.388 2.058 20 0 BEADLO C[C@@H]1COCC[N@@H+]1CC[C@H]1CC1(Cl)Cl ZINC000822579796 587175889 /nfs/dbraw/zinc/17/58/89/587175889.db2.gz JALBLMNBHWLNCC-BDAKNGLRSA-N 1 2 238.158 2.291 20 0 BEADLO C[C@@H]1COCC[N@H+]1CC[C@H]1CC1(Cl)Cl ZINC000822579796 587175890 /nfs/dbraw/zinc/17/58/90/587175890.db2.gz JALBLMNBHWLNCC-BDAKNGLRSA-N 1 2 238.158 2.291 20 0 BEADLO CC1(C)C[C@@H]1NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000822635977 587178578 /nfs/dbraw/zinc/17/85/78/587178578.db2.gz JSCIGKBGFCETNP-NSHDSACASA-N 1 2 229.283 2.091 20 0 BEADLO CC/C(C)=C\C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000823088247 587202089 /nfs/dbraw/zinc/20/20/89/587202089.db2.gz KQHZYSWPXHQHLY-KIWPFMIBSA-N 1 2 247.342 2.403 20 0 BEADLO CC(C)C[C@H](C(=O)N1CC2(CC2)C1)n1cc[nH+]c1 ZINC000823242658 587210938 /nfs/dbraw/zinc/21/09/38/587210938.db2.gz OEAAJJFOVNRBRO-GFCCVEGCSA-N 1 2 247.342 2.093 20 0 BEADLO O=C(N[C@@H]1C[C@H]2C[C@H]2C1)c1cc2c[nH+]ccc2[nH]1 ZINC000823312912 587215786 /nfs/dbraw/zinc/21/57/86/587215786.db2.gz PHYHQZRNGKYMGN-DOFRTFSJSA-N 1 2 241.294 2.091 20 0 BEADLO Fc1c(C[NH+]2CCCC2)ccnc1Cl ZINC000823379492 587219081 /nfs/dbraw/zinc/21/90/81/587219081.db2.gz NFWSMNRYCFDSLR-UHFFFAOYSA-N 1 2 214.671 2.470 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)C2CCC=CCC2)S1 ZINC000823807168 587241143 /nfs/dbraw/zinc/24/11/43/587241143.db2.gz RYIUJBKPHIQICS-SECBINFHSA-N 1 2 238.356 2.340 20 0 BEADLO Fc1cc(C[N@H+]2CC=CCC2)c(F)cn1 ZINC000824119108 587256740 /nfs/dbraw/zinc/25/67/40/587256740.db2.gz CATHBADEVNXGCJ-UHFFFAOYSA-N 1 2 210.227 2.122 20 0 BEADLO Fc1cc(C[N@@H+]2CC=CCC2)c(F)cn1 ZINC000824119108 587256741 /nfs/dbraw/zinc/25/67/41/587256741.db2.gz CATHBADEVNXGCJ-UHFFFAOYSA-N 1 2 210.227 2.122 20 0 BEADLO Cc1cc(C[NH2+][C@H]2CCn3ccnc32)c(C)o1 ZINC000824528056 587273777 /nfs/dbraw/zinc/27/37/77/587273777.db2.gz ZXJCIFBWBICHJT-LBPRGKRZSA-N 1 2 231.299 2.328 20 0 BEADLO CCc1nn(C)c(Cl)c1C[NH+]1CC2(CC2)C1 ZINC000824533852 587274158 /nfs/dbraw/zinc/27/41/58/587274158.db2.gz QMZFJVWEGWYZHT-UHFFFAOYSA-N 1 2 239.750 2.232 20 0 BEADLO FCC(CF)[NH2+]Cc1ccc(Cl)nc1 ZINC000824554289 587276050 /nfs/dbraw/zinc/27/60/50/587276050.db2.gz DVJJTZNBADTNRQ-UHFFFAOYSA-N 1 2 220.650 2.132 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)/C=C\c1cn(C)c[nH+]1 ZINC000824652282 587281347 /nfs/dbraw/zinc/28/13/47/587281347.db2.gz YXRSUHMIFHSOOC-SKVAFPRGSA-N 1 2 235.331 2.080 20 0 BEADLO Cn1c(Cl)cnc1C[N@@H+]1CC[C@H]1C1CC1 ZINC000824655677 587281497 /nfs/dbraw/zinc/28/14/97/587281497.db2.gz YQVGLEIOIRKKDV-VIFPVBQESA-N 1 2 225.723 2.058 20 0 BEADLO Cn1c(Cl)cnc1C[N@H+]1CC[C@H]1C1CC1 ZINC000824655677 587281499 /nfs/dbraw/zinc/28/14/99/587281499.db2.gz YQVGLEIOIRKKDV-VIFPVBQESA-N 1 2 225.723 2.058 20 0 BEADLO CCC(C)(C)[C@H](C)NC(=O)/C=C\c1cn(C)c[nH+]1 ZINC000824840528 587289758 /nfs/dbraw/zinc/28/97/58/587289758.db2.gz AUNBIOFSWMOKCB-TVRMLOFPSA-N 1 2 249.358 2.374 20 0 BEADLO CC[C@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)C1CC1 ZINC000825375508 587317534 /nfs/dbraw/zinc/31/75/34/587317534.db2.gz HFJDNJUWGICXMN-NSHDSACASA-N 1 2 243.310 2.481 20 0 BEADLO CC[C@](C)(NC(=O)/C=C/c1cn(C)c[nH+]1)C1CC1 ZINC000825398354 587318257 /nfs/dbraw/zinc/31/82/57/587318257.db2.gz QFAMBDKEOFBBSX-NPQIQWPPSA-N 1 2 247.342 2.128 20 0 BEADLO CC(C)(CNC(=O)[C@@]1(C)C=CCC1)n1cc[nH+]c1 ZINC000825532569 587323823 /nfs/dbraw/zinc/32/38/23/587323823.db2.gz XXBIUCSSHPNWMQ-AWEZNQCLSA-N 1 2 247.342 2.091 20 0 BEADLO O=C(NCCCCC1CC1)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000825662065 587330043 /nfs/dbraw/zinc/33/00/43/587330043.db2.gz RFIBFUBNRKLOTB-VXGBXAGGSA-N 1 2 247.342 2.210 20 0 BEADLO O=C(NCCCCC1CC1)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000825662065 587330045 /nfs/dbraw/zinc/33/00/45/587330045.db2.gz RFIBFUBNRKLOTB-VXGBXAGGSA-N 1 2 247.342 2.210 20 0 BEADLO CC(C)n1ccnc1C[NH+]1CC2(CC2)C1 ZINC000826030109 587349047 /nfs/dbraw/zinc/34/90/47/587349047.db2.gz OTDQEGMTLSZWCC-UHFFFAOYSA-N 1 2 205.305 2.060 20 0 BEADLO CC(C)[C@H]1CCCC[C@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000826043943 587349377 /nfs/dbraw/zinc/34/93/77/587349377.db2.gz WMOJLSPLCPFXTK-VXGBXAGGSA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)[C@H]1CCC[C@H](NC(=O)Cc2[nH]cc[nH+]2)C1 ZINC000826131769 587351158 /nfs/dbraw/zinc/35/11/58/587351158.db2.gz ZWSKQAZKFYPBHG-RYUDHWBXSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@H](C)[C@@H](C)N(C(=O)Cc1[nH]cc[nH+]1)C1CC1 ZINC000826564072 587355020 /nfs/dbraw/zinc/35/50/20/587355020.db2.gz ARQYLYMGFXZKPF-WDEREUQCSA-N 1 2 249.358 2.378 20 0 BEADLO COCC[N@H+](CCF)Cc1ccccc1OC ZINC000827061773 587369363 /nfs/dbraw/zinc/36/93/63/587369363.db2.gz SPNXBYWSCDHXQC-UHFFFAOYSA-N 1 2 241.306 2.113 20 0 BEADLO COCC[N@@H+](CCF)Cc1ccccc1OC ZINC000827061773 587369364 /nfs/dbraw/zinc/36/93/64/587369364.db2.gz SPNXBYWSCDHXQC-UHFFFAOYSA-N 1 2 241.306 2.113 20 0 BEADLO COC/C=C/c1nc(Cc2c[nH+]ccc2C)no1 ZINC000867046338 587375495 /nfs/dbraw/zinc/37/54/95/587375495.db2.gz YDZBENSUBPGXFZ-ONEGZZNKSA-N 1 2 245.282 2.023 20 0 BEADLO Cc1cc(C[N@@H+](C)CCC(=O)CC(C)C)no1 ZINC000827782587 587401813 /nfs/dbraw/zinc/40/18/13/587401813.db2.gz HUKFYQXARCLSGQ-UHFFFAOYSA-N 1 2 238.331 2.420 20 0 BEADLO Cc1cc(C[N@H+](C)CCC(=O)CC(C)C)no1 ZINC000827782587 587401815 /nfs/dbraw/zinc/40/18/15/587401815.db2.gz HUKFYQXARCLSGQ-UHFFFAOYSA-N 1 2 238.331 2.420 20 0 BEADLO CC(C)(C)C1CCN(C(=O)Cc2[nH]cc[nH+]2)CC1 ZINC000827986910 587415474 /nfs/dbraw/zinc/41/54/74/587415474.db2.gz TWIYATJTWUWZDV-UHFFFAOYSA-N 1 2 249.358 2.237 20 0 BEADLO c1cn2c([nH+]1)[C@H](Nc1nc(C3CC3)ns1)CC2 ZINC000828357229 587438018 /nfs/dbraw/zinc/43/80/18/587438018.db2.gz AZBQMLHKRCAUNE-MRVPVSSYSA-N 1 2 247.327 2.169 20 0 BEADLO Cc1nc(Cl)cc(N[C@H]2CCn3cc[nH+]c32)n1 ZINC000828357600 587438175 /nfs/dbraw/zinc/43/81/75/587438175.db2.gz KOSRGEFLLSIMHE-QMMMGPOBSA-N 1 2 249.705 2.192 20 0 BEADLO FC(F)[C@@H]1C[N@H+](CC2=CCCC2)CCO1 ZINC000828469292 587444755 /nfs/dbraw/zinc/44/47/55/587444755.db2.gz FJCRJRVVIPREKD-JTQLQIEISA-N 1 2 217.259 2.063 20 0 BEADLO FC(F)[C@@H]1C[N@@H+](CC2=CCCC2)CCO1 ZINC000828469292 587444757 /nfs/dbraw/zinc/44/47/57/587444757.db2.gz FJCRJRVVIPREKD-JTQLQIEISA-N 1 2 217.259 2.063 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CC[C@H]3C[C@H]32)s1 ZINC000828533820 587448566 /nfs/dbraw/zinc/44/85/66/587448566.db2.gz MZQYWGFGPKKZKT-DTWKUNHWSA-N 1 2 223.345 2.256 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CC[C@H]3C[C@H]32)s1 ZINC000828533820 587448567 /nfs/dbraw/zinc/44/85/67/587448567.db2.gz MZQYWGFGPKKZKT-DTWKUNHWSA-N 1 2 223.345 2.256 20 0 BEADLO C[C@@H](NC(=O)Cc1[nH]cc[nH+]1)C1CCCCC1 ZINC000828607072 587453615 /nfs/dbraw/zinc/45/36/15/587453615.db2.gz PQYKVRLQBSELMK-SNVBAGLBSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H]1C[C@H](Nc2cncc(Cl)n2)c2[nH+]ccn21 ZINC000829126843 587483728 /nfs/dbraw/zinc/48/37/28/587483728.db2.gz OHNNGAKDCBLDQU-YUMQZZPRSA-N 1 2 249.705 2.444 20 0 BEADLO CCC1(CNC(=O)Cc2[nH]cc[nH+]2)CCCC1 ZINC000830167869 587539878 /nfs/dbraw/zinc/53/98/78/587539878.db2.gz CZDGPKSNHYTCTL-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO CCCCC[C@H](C)NC(=O)C[N@@H+]1CC[C@H](F)C1 ZINC000830461609 587551663 /nfs/dbraw/zinc/55/16/63/587551663.db2.gz BKISOUOKWAMZMT-RYUDHWBXSA-N 1 2 244.354 2.115 20 0 BEADLO CCCCC[C@H](C)NC(=O)C[N@H+]1CC[C@H](F)C1 ZINC000830461609 587551664 /nfs/dbraw/zinc/55/16/64/587551664.db2.gz BKISOUOKWAMZMT-RYUDHWBXSA-N 1 2 244.354 2.115 20 0 BEADLO CCCCC[C@H](C)NC(=O)C[N@@H+]1CC[C@@H](F)C1 ZINC000830461608 587551898 /nfs/dbraw/zinc/55/18/98/587551898.db2.gz BKISOUOKWAMZMT-NWDGAFQWSA-N 1 2 244.354 2.115 20 0 BEADLO CCCCC[C@H](C)NC(=O)C[N@H+]1CC[C@@H](F)C1 ZINC000830461608 587551899 /nfs/dbraw/zinc/55/18/99/587551899.db2.gz BKISOUOKWAMZMT-NWDGAFQWSA-N 1 2 244.354 2.115 20 0 BEADLO O=C(OCCn1cc[nH+]c1)C1CC2(CCC2)C1 ZINC000830625880 587560063 /nfs/dbraw/zinc/56/00/63/587560063.db2.gz MNZSULNWBVRTIX-UHFFFAOYSA-N 1 2 234.299 2.007 20 0 BEADLO CC(C)(C)C1=CCN(C(=O)Cc2[nH]cc[nH+]2)CC1 ZINC000831306764 587597500 /nfs/dbraw/zinc/59/75/00/587597500.db2.gz OJBSFUFWLLDUCN-UHFFFAOYSA-N 1 2 247.342 2.157 20 0 BEADLO Cc1ccc(C[N@@H+](C)[C@@H]2CCOC2=O)cc1C ZINC000832634899 587670976 /nfs/dbraw/zinc/67/09/76/587670976.db2.gz XGJUHYZDGSVMTL-CYBMUJFWSA-N 1 2 233.311 2.051 20 0 BEADLO Cc1ccc(C[N@H+](C)[C@@H]2CCOC2=O)cc1C ZINC000832634899 587670977 /nfs/dbraw/zinc/67/09/77/587670977.db2.gz XGJUHYZDGSVMTL-CYBMUJFWSA-N 1 2 233.311 2.051 20 0 BEADLO CCCC[C@H](C)C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833273088 587703822 /nfs/dbraw/zinc/70/38/22/587703822.db2.gz XLFIMOIKQYBVIM-QWRGUYRKSA-N 1 2 235.331 2.270 20 0 BEADLO CC1(C(=O)N[C@@H]2CCn3cc[nH+]c32)CCCCC1 ZINC000833277790 587704119 /nfs/dbraw/zinc/70/41/19/587704119.db2.gz HFKQFBGJSJSITG-LLVKDONJSA-N 1 2 247.342 2.415 20 0 BEADLO O=C(N[C@H]1CCn2cc[nH+]c21)C1CCCCCC1 ZINC000833292142 587704649 /nfs/dbraw/zinc/70/46/49/587704649.db2.gz CCMXOQBSGFAYPQ-LBPRGKRZSA-N 1 2 247.342 2.415 20 0 BEADLO CC1(C)C(C(=O)N[C@@H]2CCn3cc[nH+]c32)C1(C)C ZINC000833285776 587704708 /nfs/dbraw/zinc/70/47/08/587704708.db2.gz SRSFKNGFAJIEIC-SECBINFHSA-N 1 2 247.342 2.126 20 0 BEADLO O=C(N[C@H]1CCn2cc[nH+]c21)[C@@H]1CC12CCCC2 ZINC000833284492 587704844 /nfs/dbraw/zinc/70/48/44/587704844.db2.gz JKMRQYRIZIKBFE-QWRGUYRKSA-N 1 2 245.326 2.024 20 0 BEADLO CCCC1(C(=O)N[C@H]2CCn3cc[nH+]c32)CCC1 ZINC000833285843 587704925 /nfs/dbraw/zinc/70/49/25/587704925.db2.gz ULCJBWCZBWUFDH-NSHDSACASA-N 1 2 247.342 2.415 20 0 BEADLO CCCCCC(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833300265 587705085 /nfs/dbraw/zinc/70/50/85/587705085.db2.gz PAUFDTBJRQUWIW-JTQLQIEISA-N 1 2 221.304 2.024 20 0 BEADLO CCCCCCC(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833302002 587705205 /nfs/dbraw/zinc/70/52/05/587705205.db2.gz WQHCOESYZQNLJF-LLVKDONJSA-N 1 2 235.331 2.415 20 0 BEADLO CSC(C)(C)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000834837364 587768632 /nfs/dbraw/zinc/76/86/32/587768632.db2.gz UVMKBECSOQFJHM-UHFFFAOYSA-N 1 2 249.339 2.414 20 0 BEADLO CCC1C[NH+](Cc2cc(F)ncc2F)C1 ZINC000835075694 587780350 /nfs/dbraw/zinc/78/03/50/587780350.db2.gz YIQGUFRXFVLNEX-UHFFFAOYSA-N 1 2 212.243 2.202 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1C(=O)OCc1c[nH+]cn1C ZINC000835193650 587788401 /nfs/dbraw/zinc/78/84/01/587788401.db2.gz MSVOHJRUJHSZGJ-ZYHUDNBSSA-N 1 2 236.315 2.146 20 0 BEADLO C[C@@H]1CCC[C@]1(C)C(=O)OCc1c[nH+]cn1C ZINC000835195742 587788423 /nfs/dbraw/zinc/78/84/23/587788423.db2.gz ZWNMYYTYHGHQRI-MFKMUULPSA-N 1 2 236.315 2.290 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)OCc1cc(OC)cc(C)[nH+]1 ZINC000835259458 587792919 /nfs/dbraw/zinc/79/29/19/587792919.db2.gz ISQIFDDWESTISJ-ZWNOBZJWSA-N 1 2 249.310 2.488 20 0 BEADLO C[C@H]1CC=C(C(=O)OCCc2c[nH+]cn2C)CC1 ZINC000835323418 587796376 /nfs/dbraw/zinc/79/63/76/587796376.db2.gz MKXPJIZRLAWUFO-NSHDSACASA-N 1 2 248.326 2.252 20 0 BEADLO CC[C@H]1CCC[C@H]1C(=O)OCCn1cc[nH+]c1 ZINC000835348881 587797795 /nfs/dbraw/zinc/79/77/95/587797795.db2.gz DHWDGMVIFAEKJX-NWDGAFQWSA-N 1 2 236.315 2.253 20 0 BEADLO CC(C)CCCC(=O)OCCn1cc[nH+]c1 ZINC000835350263 587798040 /nfs/dbraw/zinc/79/80/40/587798040.db2.gz OMVCUUVPHUKXTI-UHFFFAOYSA-N 1 2 224.304 2.253 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C(C)=C1CCC1 ZINC000836806157 587838252 /nfs/dbraw/zinc/83/82/52/587838252.db2.gz BNIOIDVRCQYSPW-UHFFFAOYSA-N 1 2 233.315 2.020 20 0 BEADLO CCC/C=C/C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000836961651 587844123 /nfs/dbraw/zinc/84/41/23/587844123.db2.gz ZTSPEJKRUXPXEJ-PFDYWKIBSA-N 1 2 233.315 2.361 20 0 BEADLO CC/C(C)=C/C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000836961764 587844159 /nfs/dbraw/zinc/84/41/59/587844159.db2.gz WZQVYPQJKRSWGQ-RZABIFLQSA-N 1 2 233.315 2.361 20 0 BEADLO CC(C)=CC(=O)Nc1nc(C[NH+](C)C)cs1 ZINC000837264496 587862586 /nfs/dbraw/zinc/86/25/86/587862586.db2.gz ZIAMMPNGILOION-UHFFFAOYSA-N 1 2 239.344 2.109 20 0 BEADLO Cc1ccc([S@](=O)Cc2[nH+]ccn2C)s1 ZINC000840878828 587927644 /nfs/dbraw/zinc/92/76/44/587927644.db2.gz RGMIFRMAHDOHLW-OAHLLOKOSA-N 1 2 240.353 2.098 20 0 BEADLO C=COc1ccc([NH2+]C[C@H](C)CO)cc1 ZINC000841702094 587972493 /nfs/dbraw/zinc/97/24/93/587972493.db2.gz XEKRVRKVNMBFIT-JTQLQIEISA-N 1 2 207.273 2.249 20 0 BEADLO CCn1c[nH+]cc1CNc1cnn(C)c1C1CC1 ZINC000841871518 587979173 /nfs/dbraw/zinc/97/91/73/587979173.db2.gz CXXKPZVBTWBLDJ-UHFFFAOYSA-N 1 2 245.330 2.126 20 0 BEADLO O=C(OC1CCCCC1)N1CCn2c[nH+]cc2C1 ZINC000867282423 587986841 /nfs/dbraw/zinc/98/68/41/587986841.db2.gz NLVCNVJZSPPNOG-UHFFFAOYSA-N 1 2 249.314 2.168 20 0 BEADLO Cc1ccc(CONC(=O)C2CCC2)c(C)[nH+]1 ZINC000842116622 588002420 /nfs/dbraw/zinc/00/24/20/588002420.db2.gz QFSGGJPMDXFMGZ-UHFFFAOYSA-N 1 2 234.299 2.046 20 0 BEADLO Cn1cnn(C[N@H+](C)CCC(C)(C)C)c1=S ZINC000842630661 588046796 /nfs/dbraw/zinc/04/67/96/588046796.db2.gz HCLILBWQIJXIIF-UHFFFAOYSA-N 1 2 242.392 2.277 20 0 BEADLO Cn1cnn(C[N@@H+](C)CCC(C)(C)C)c1=S ZINC000842630661 588046799 /nfs/dbraw/zinc/04/67/99/588046799.db2.gz HCLILBWQIJXIIF-UHFFFAOYSA-N 1 2 242.392 2.277 20 0 BEADLO Cc1[nH+]c2cc(OC(=O)C3(F)CC3)ccc2n1C ZINC000842809972 588065938 /nfs/dbraw/zinc/06/59/38/588065938.db2.gz MUTABPCGYGZQEK-UHFFFAOYSA-N 1 2 248.257 2.289 20 0 BEADLO CC(C)=CC(=O)OCC1CN(c2cccc[nH+]2)C1 ZINC000842891837 588071230 /nfs/dbraw/zinc/07/12/30/588071230.db2.gz BMKVNMKJIZEGTB-UHFFFAOYSA-N 1 2 246.310 2.027 20 0 BEADLO CC[NH2+]Cc1noc([C@@H](C)C2CCCC2)n1 ZINC000843145222 588086780 /nfs/dbraw/zinc/08/67/80/588086780.db2.gz XUIDNHYHJWMPJQ-VIFPVBQESA-N 1 2 223.320 2.473 20 0 BEADLO CC[NH2+]Cc1noc(/C=C\c2cccs2)n1 ZINC000843145566 588086990 /nfs/dbraw/zinc/08/69/90/588086990.db2.gz KQSMBQYPLLOPAG-WAYWQWQTSA-N 1 2 235.312 2.411 20 0 BEADLO Cc1cc(C)c(NC(=O)C2(F)CC2)c(C)[nH+]1 ZINC000843524527 588119457 /nfs/dbraw/zinc/11/94/57/588119457.db2.gz GHEASQBOFPSWBY-UHFFFAOYSA-N 1 2 222.263 2.447 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C1(C(F)F)CC1 ZINC000843547830 588121686 /nfs/dbraw/zinc/12/16/86/588121686.db2.gz GTJUJRDFSCCGQV-UHFFFAOYSA-N 1 2 240.253 2.050 20 0 BEADLO C[C@@H]1Cc2cc(-c3c[nH+]cn3C)ccc2O1 ZINC000844227590 588174858 /nfs/dbraw/zinc/17/48/58/588174858.db2.gz PHNVTYCPQDXTNZ-SECBINFHSA-N 1 2 214.268 2.411 20 0 BEADLO C[C@H]1Cc2cc(-c3c[nH]c[nH+]3)ccc2O1 ZINC000844227234 588174895 /nfs/dbraw/zinc/17/48/95/588174895.db2.gz NAOPGKOGMJJSQE-QMMMGPOBSA-N 1 2 200.241 2.400 20 0 BEADLO C[C@@H]1Cc2cc(-c3c[nH]c[nH+]3)ccc2O1 ZINC000844227233 588174942 /nfs/dbraw/zinc/17/49/42/588174942.db2.gz NAOPGKOGMJJSQE-MRVPVSSYSA-N 1 2 200.241 2.400 20 0 BEADLO CC(C)(C)OC(=O)N1CCC=C(c2c[nH]c[nH+]2)C1 ZINC000844234216 588175878 /nfs/dbraw/zinc/17/58/78/588175878.db2.gz BWWKYLGCDJEAOI-UHFFFAOYSA-N 1 2 249.314 2.434 20 0 BEADLO C[C@@H](CC(=O)Nc1ccc(F)nc1)n1cc[nH+]c1 ZINC000844431500 588192606 /nfs/dbraw/zinc/19/26/06/588192606.db2.gz QXNMWEBQUZNGBD-VIFPVBQESA-N 1 2 248.261 2.007 20 0 BEADLO C[C@H](CCO)[N@H+](C)C/C(Cl)=C\Cl ZINC000844453052 588195763 /nfs/dbraw/zinc/19/57/63/588195763.db2.gz YTNBNUPZEVOSMY-KBUNYLKBSA-N 1 2 212.120 2.008 20 0 BEADLO C[C@H](CCO)[N@@H+](C)C/C(Cl)=C\Cl ZINC000844453052 588195764 /nfs/dbraw/zinc/19/57/64/588195764.db2.gz YTNBNUPZEVOSMY-KBUNYLKBSA-N 1 2 212.120 2.008 20 0 BEADLO CC[NH2+]Cc1noc(/C=C\C2CCCC2)n1 ZINC000844907210 588219023 /nfs/dbraw/zinc/21/90/23/588219023.db2.gz XMGASVHRAGUIAD-FPLPWBNLSA-N 1 2 221.304 2.383 20 0 BEADLO CCCC(C)(C)C(=O)OCCc1c[nH+]cn1C ZINC000845358051 588227974 /nfs/dbraw/zinc/22/79/74/588227974.db2.gz VMIZAMFQVAQOIZ-UHFFFAOYSA-N 1 2 238.331 2.332 20 0 BEADLO CC(C)[C@H](C)OC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000845497125 588230919 /nfs/dbraw/zinc/23/09/19/588230919.db2.gz YMXIZAVFTMYKEM-QWRGUYRKSA-N 1 2 224.304 2.422 20 0 BEADLO C[C@H](CC(=O)OCC(C)(C)F)n1cc[nH+]c1 ZINC000845524748 588232029 /nfs/dbraw/zinc/23/20/29/588232029.db2.gz BEJKCBHZSNMYKL-SECBINFHSA-N 1 2 228.267 2.126 20 0 BEADLO CC1(COC(=O)Cc2cn3c([nH+]2)CCCC3)CC1 ZINC000845546737 588233441 /nfs/dbraw/zinc/23/34/41/588233441.db2.gz BXXMPGNQTYNZLZ-UHFFFAOYSA-N 1 2 248.326 2.105 20 0 BEADLO C/C=C(/C)COC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000845612267 588236008 /nfs/dbraw/zinc/23/60/08/588236008.db2.gz KMKTYDKIRKUTKU-FGUAACIASA-N 1 2 222.288 2.344 20 0 BEADLO CCCCCCC(=O)NCCc1c[nH+]cn1C ZINC000121578944 588240560 /nfs/dbraw/zinc/24/05/60/588240560.db2.gz TYYGJJBJCKRGAR-UHFFFAOYSA-N 1 2 237.347 2.049 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccc(F)nc2)[C@H](C)CO1 ZINC000846043588 588254769 /nfs/dbraw/zinc/25/47/69/588254769.db2.gz LQZSBUKPTCYTTQ-PWSUYJOCSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccc(F)nc2)[C@H](C)CO1 ZINC000846043588 588254770 /nfs/dbraw/zinc/25/47/70/588254770.db2.gz LQZSBUKPTCYTTQ-PWSUYJOCSA-N 1 2 238.306 2.220 20 0 BEADLO FC1(F)C[C@]12CCC[N@H+](Cc1cocn1)C2 ZINC000846103927 588256557 /nfs/dbraw/zinc/25/65/57/588256557.db2.gz CBVIZOKJOYBYTC-JTQLQIEISA-N 1 2 228.242 2.296 20 0 BEADLO FC1(F)C[C@]12CCC[N@@H+](Cc1cocn1)C2 ZINC000846103927 588256558 /nfs/dbraw/zinc/25/65/58/588256558.db2.gz CBVIZOKJOYBYTC-JTQLQIEISA-N 1 2 228.242 2.296 20 0 BEADLO C[C@@H](COCC1CC1)[NH2+][C@@H]1CCCc2[nH]ncc21 ZINC000846204122 588259971 /nfs/dbraw/zinc/25/99/71/588259971.db2.gz DQEAKWBAIGAXEO-GXFFZTMASA-N 1 2 249.358 2.192 20 0 BEADLO CC/C(C)=C/C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000846245763 588262428 /nfs/dbraw/zinc/26/24/28/588262428.db2.gz CPSQMAMEOIDUES-CMDGGOBGSA-N 1 2 221.304 2.117 20 0 BEADLO CC/C=C(/C)C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000846245427 588262440 /nfs/dbraw/zinc/26/24/40/588262440.db2.gz GKESUUVVXKNFOY-TWGQIWQCSA-N 1 2 221.304 2.117 20 0 BEADLO C[C@@H]1C[N@H+](CC2(Br)CC2)[C@@H](C)CO1 ZINC000846766476 588286745 /nfs/dbraw/zinc/28/67/45/588286745.db2.gz SPWSDWSSLSOATQ-DTWKUNHWSA-N 1 2 248.164 2.023 20 0 BEADLO C[C@@H]1C[N@@H+](CC2(Br)CC2)[C@@H](C)CO1 ZINC000846766476 588286746 /nfs/dbraw/zinc/28/67/46/588286746.db2.gz SPWSDWSSLSOATQ-DTWKUNHWSA-N 1 2 248.164 2.023 20 0 BEADLO C[N@H+](Cc1ccon1)CC1(Br)CC1 ZINC000846807699 588289870 /nfs/dbraw/zinc/28/98/70/588289870.db2.gz UPXKOKYIXFSIOT-UHFFFAOYSA-N 1 2 245.120 2.034 20 0 BEADLO C[N@@H+](Cc1ccon1)CC1(Br)CC1 ZINC000846807699 588289871 /nfs/dbraw/zinc/28/98/71/588289871.db2.gz UPXKOKYIXFSIOT-UHFFFAOYSA-N 1 2 245.120 2.034 20 0 BEADLO C[C@H]([N@H+](C)Cc1cnsn1)C1(C)CC1 ZINC000846814872 588290967 /nfs/dbraw/zinc/29/09/67/588290967.db2.gz VEHRWAZWULXXRF-QMMMGPOBSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@H]([N@@H+](C)Cc1cnsn1)C1(C)CC1 ZINC000846814872 588290968 /nfs/dbraw/zinc/29/09/68/588290968.db2.gz VEHRWAZWULXXRF-QMMMGPOBSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@H]1OCC[N@H+](CC2(Br)CC2)[C@@H]1C ZINC000846817838 588291151 /nfs/dbraw/zinc/29/11/51/588291151.db2.gz OXRWJPJSVHQBOG-RKDXNWHRSA-N 1 2 248.164 2.023 20 0 BEADLO C[C@H]1OCC[N@@H+](CC2(Br)CC2)[C@@H]1C ZINC000846817838 588291152 /nfs/dbraw/zinc/29/11/52/588291152.db2.gz OXRWJPJSVHQBOG-RKDXNWHRSA-N 1 2 248.164 2.023 20 0 BEADLO C[C@H]1OCC[N@H+](CC2(Br)CC2)[C@H]1C ZINC000846817836 588291161 /nfs/dbraw/zinc/29/11/61/588291161.db2.gz OXRWJPJSVHQBOG-DTWKUNHWSA-N 1 2 248.164 2.023 20 0 BEADLO C[C@H]1OCC[N@@H+](CC2(Br)CC2)[C@H]1C ZINC000846817836 588291162 /nfs/dbraw/zinc/29/11/62/588291162.db2.gz OXRWJPJSVHQBOG-DTWKUNHWSA-N 1 2 248.164 2.023 20 0 BEADLO FC1=CCC[N@H+](CC2(Br)CC2)C1 ZINC000846839751 588292456 /nfs/dbraw/zinc/29/24/56/588292456.db2.gz DGVGPCKURNZVPW-UHFFFAOYSA-N 1 2 234.112 2.473 20 0 BEADLO FC1=CCC[N@@H+](CC2(Br)CC2)C1 ZINC000846839751 588292457 /nfs/dbraw/zinc/29/24/57/588292457.db2.gz DGVGPCKURNZVPW-UHFFFAOYSA-N 1 2 234.112 2.473 20 0 BEADLO Cc1ccncc1[C@@H](C)[NH2+]Cc1cnsn1 ZINC000846849841 588292920 /nfs/dbraw/zinc/29/29/20/588292920.db2.gz IHTFEFKPBTXRNV-SECBINFHSA-N 1 2 234.328 2.092 20 0 BEADLO CC(C)[N@H+](CC1(Br)CC1)C1COC1 ZINC000846929617 588297161 /nfs/dbraw/zinc/29/71/61/588297161.db2.gz XDAQEXGTWVDPNW-UHFFFAOYSA-N 1 2 248.164 2.023 20 0 BEADLO CC(C)[N@@H+](CC1(Br)CC1)C1COC1 ZINC000846929617 588297162 /nfs/dbraw/zinc/29/71/62/588297162.db2.gz XDAQEXGTWVDPNW-UHFFFAOYSA-N 1 2 248.164 2.023 20 0 BEADLO CC(=O)C1CC[NH+]([C@@H](C)c2ncc(C)o2)CC1 ZINC000846946186 588298201 /nfs/dbraw/zinc/29/82/01/588298201.db2.gz HQWDPKQPSWZADP-JTQLQIEISA-N 1 2 236.315 2.345 20 0 BEADLO C[N@H+](Cc1cnsn1)C1CC(C)(C)C1 ZINC000846995565 588300864 /nfs/dbraw/zinc/30/08/64/588300864.db2.gz YPSKQZOKQZFTKU-UHFFFAOYSA-N 1 2 211.334 2.159 20 0 BEADLO C[N@@H+](Cc1cnsn1)C1CC(C)(C)C1 ZINC000846995565 588300865 /nfs/dbraw/zinc/30/08/65/588300865.db2.gz YPSKQZOKQZFTKU-UHFFFAOYSA-N 1 2 211.334 2.159 20 0 BEADLO O=C1CC[N@@H+](C/C=C\Cl)C2(CCC2)C1 ZINC000846997307 588301034 /nfs/dbraw/zinc/30/10/34/588301034.db2.gz ZRUWKRCFEFRTSJ-KXFIGUGUSA-N 1 2 213.708 2.327 20 0 BEADLO O=C1CC[N@H+](C/C=C\Cl)C2(CCC2)C1 ZINC000846997307 588301035 /nfs/dbraw/zinc/30/10/35/588301035.db2.gz ZRUWKRCFEFRTSJ-KXFIGUGUSA-N 1 2 213.708 2.327 20 0 BEADLO C[N@H+](CCC(C)(C)C)Cc1cnsn1 ZINC000847014423 588301399 /nfs/dbraw/zinc/30/13/99/588301399.db2.gz XMMNQFKEDVISQV-UHFFFAOYSA-N 1 2 213.350 2.406 20 0 BEADLO C[N@@H+](CCC(C)(C)C)Cc1cnsn1 ZINC000847014423 588301400 /nfs/dbraw/zinc/30/14/00/588301400.db2.gz XMMNQFKEDVISQV-UHFFFAOYSA-N 1 2 213.350 2.406 20 0 BEADLO FC1(F)C[C@@]12CCC[N@H+](Cc1cnsn1)C2 ZINC000847015330 588301660 /nfs/dbraw/zinc/30/16/60/588301660.db2.gz VRESLAMJOHLEQW-SECBINFHSA-N 1 2 245.298 2.159 20 0 BEADLO FC1(F)C[C@@]12CCC[N@@H+](Cc1cnsn1)C2 ZINC000847015330 588301661 /nfs/dbraw/zinc/30/16/61/588301661.db2.gz VRESLAMJOHLEQW-SECBINFHSA-N 1 2 245.298 2.159 20 0 BEADLO Cc1noc(C[N@H+](C)CCSC(C)(C)C)n1 ZINC000847088816 588306177 /nfs/dbraw/zinc/30/61/77/588306177.db2.gz ZAEPYXUBPHJCTJ-UHFFFAOYSA-N 1 2 243.376 2.342 20 0 BEADLO Cc1noc(C[N@@H+](C)CCSC(C)(C)C)n1 ZINC000847088816 588306178 /nfs/dbraw/zinc/30/61/78/588306178.db2.gz ZAEPYXUBPHJCTJ-UHFFFAOYSA-N 1 2 243.376 2.342 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CCCCCCC1 ZINC000847308211 588310707 /nfs/dbraw/zinc/31/07/07/588310707.db2.gz FRYULSJJALGLAL-GFCCVEGCSA-N 1 2 249.358 2.381 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CCCCCCC1 ZINC000847308211 588310708 /nfs/dbraw/zinc/31/07/08/588310708.db2.gz FRYULSJJALGLAL-GFCCVEGCSA-N 1 2 249.358 2.381 20 0 BEADLO C[C@H](CC(=O)N[C@H](C)c1[nH]cc[nH+]1)C1CC1 ZINC000848387179 588376092 /nfs/dbraw/zinc/37/60/92/588376092.db2.gz MDMASACJULSCDR-RKDXNWHRSA-N 1 2 221.304 2.023 20 0 BEADLO C[C@@H](NC(=O)C=C1CCCC1)c1[nH]cc[nH+]1 ZINC000848387542 588376126 /nfs/dbraw/zinc/37/61/26/588376126.db2.gz VXPJPFWIIAOCCZ-SECBINFHSA-N 1 2 219.288 2.087 20 0 BEADLO CCc1nc(CN[C@@H]2CCCn3cc[nH+]c32)co1 ZINC000848553667 588396234 /nfs/dbraw/zinc/39/62/34/588396234.db2.gz NFFDJKUXIFDWOA-LLVKDONJSA-N 1 2 246.314 2.058 20 0 BEADLO CC(C)c1ccccc1C[N@@H+]1CCN(C)C(=O)C1 ZINC000848887284 588417316 /nfs/dbraw/zinc/41/73/16/588417316.db2.gz SCLLHEAPUWNIOL-UHFFFAOYSA-N 1 2 246.354 2.084 20 0 BEADLO CC(C)c1ccccc1C[N@H+]1CCN(C)C(=O)C1 ZINC000848887284 588417318 /nfs/dbraw/zinc/41/73/18/588417318.db2.gz SCLLHEAPUWNIOL-UHFFFAOYSA-N 1 2 246.354 2.084 20 0 BEADLO Cn1c(Cl)ncc1C[N@H+](C)Cc1ccc[nH]1 ZINC000848891065 588417638 /nfs/dbraw/zinc/41/76/38/588417638.db2.gz WWEFMYKHQVFIBM-UHFFFAOYSA-N 1 2 238.722 2.034 20 0 BEADLO Cn1c(Cl)ncc1C[N@@H+](C)Cc1ccc[nH]1 ZINC000848891065 588417639 /nfs/dbraw/zinc/41/76/39/588417639.db2.gz WWEFMYKHQVFIBM-UHFFFAOYSA-N 1 2 238.722 2.034 20 0 BEADLO Cn1c(C[NH+]2CC3(CC(F)C3)C2)cnc1Cl ZINC000848917432 588420712 /nfs/dbraw/zinc/42/07/12/588420712.db2.gz SXWKLMJFKCGDFX-UHFFFAOYSA-N 1 2 243.713 2.007 20 0 BEADLO Cc1nc(F)ccc1C[NH+]1CC2(CC2(F)F)C1 ZINC000848922721 588420738 /nfs/dbraw/zinc/42/07/38/588420738.db2.gz VHQTZOADPBZQIP-UHFFFAOYSA-N 1 2 242.244 2.370 20 0 BEADLO C=COc1ccc([NH2+]CC[C@@H](C)O)cc1 ZINC000849317377 588471999 /nfs/dbraw/zinc/47/19/99/588471999.db2.gz OPYSAFDMYDRJDZ-SNVBAGLBSA-N 1 2 207.273 2.392 20 0 BEADLO Cc1[nH]c(CNc2cccc3c2OCO3)[nH+]c1C ZINC000850242893 588531504 /nfs/dbraw/zinc/53/15/04/588531504.db2.gz KEMMKCODEPARIM-UHFFFAOYSA-N 1 2 245.282 2.367 20 0 BEADLO CCONC(=O)C[NH2+][C@H]1CCCC(C)(C)CC1 ZINC000850339418 588536170 /nfs/dbraw/zinc/53/61/70/588536170.db2.gz SGGRHSCAFMEICU-NSHDSACASA-N 1 2 242.363 2.003 20 0 BEADLO CCCn1nccc1C[NH2+]Cc1coc(CC)n1 ZINC000850316137 588536539 /nfs/dbraw/zinc/53/65/39/588536539.db2.gz BHPYVEYYZRPTJM-UHFFFAOYSA-N 1 2 248.330 2.133 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@H]1COC2(CCC2)C1 ZINC000850523905 588557032 /nfs/dbraw/zinc/55/70/32/588557032.db2.gz DQHYVDAYSGHCGX-GXSJLCMTSA-N 1 2 235.331 2.080 20 0 BEADLO C[C@@H]1c2cccn2CC[N@H+]1CCOC(F)F ZINC000851717352 588616143 /nfs/dbraw/zinc/61/61/43/588616143.db2.gz JUXMQDFTGKOZTE-SECBINFHSA-N 1 2 230.258 2.104 20 0 BEADLO C[C@@H]1c2cccn2CC[N@@H+]1CCOC(F)F ZINC000851717352 588616144 /nfs/dbraw/zinc/61/61/44/588616144.db2.gz JUXMQDFTGKOZTE-SECBINFHSA-N 1 2 230.258 2.104 20 0 BEADLO c1nonc1C[N@H+](Cc1ccccc1)C1CC1 ZINC000851716094 588616337 /nfs/dbraw/zinc/61/63/37/588616337.db2.gz GJOUPLYAUHIFJX-UHFFFAOYSA-N 1 2 229.283 2.234 20 0 BEADLO c1nonc1C[N@@H+](Cc1ccccc1)C1CC1 ZINC000851716094 588616338 /nfs/dbraw/zinc/61/63/38/588616338.db2.gz GJOUPLYAUHIFJX-UHFFFAOYSA-N 1 2 229.283 2.234 20 0 BEADLO CC[N@H+](Cc1cnon1)Cc1ccc(C)cc1 ZINC000851738581 588621013 /nfs/dbraw/zinc/62/10/13/588621013.db2.gz LKPPBQNHAKZVIK-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1cnon1)Cc1ccc(C)cc1 ZINC000851738581 588621014 /nfs/dbraw/zinc/62/10/14/588621014.db2.gz LKPPBQNHAKZVIK-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO C[C@H]1c2ccccc2CC[N@H+]1Cc1cnon1 ZINC000851762398 588624445 /nfs/dbraw/zinc/62/44/45/588624445.db2.gz PGZYWJLHEPIAOI-JTQLQIEISA-N 1 2 229.283 2.189 20 0 BEADLO C[C@H]1c2ccccc2CC[N@@H+]1Cc1cnon1 ZINC000851762398 588624446 /nfs/dbraw/zinc/62/44/46/588624446.db2.gz PGZYWJLHEPIAOI-JTQLQIEISA-N 1 2 229.283 2.189 20 0 BEADLO C[C@H]1C[N@H+](Cc2cnon2)[C@H]1c1ccccc1 ZINC000851799402 588630455 /nfs/dbraw/zinc/63/04/55/588630455.db2.gz AEHUBPCMJQDVNO-GXFFZTMASA-N 1 2 229.283 2.263 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cnon2)[C@H]1c1ccccc1 ZINC000851799402 588630456 /nfs/dbraw/zinc/63/04/56/588630456.db2.gz AEHUBPCMJQDVNO-GXFFZTMASA-N 1 2 229.283 2.263 20 0 BEADLO C[C@@H]1[N@H+](Cc2cccc(F)n2)CCOC1(C)C ZINC000851814509 588633029 /nfs/dbraw/zinc/63/30/29/588633029.db2.gz SJEVPVHUYVLUBE-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H]1[N@@H+](Cc2cccc(F)n2)CCOC1(C)C ZINC000851814509 588633030 /nfs/dbraw/zinc/63/30/30/588633030.db2.gz SJEVPVHUYVLUBE-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H](NC(=O)OC1CCCC1)c1[nH+]ccn1C ZINC000851855139 588635389 /nfs/dbraw/zinc/63/53/89/588635389.db2.gz BDIIEJHWYHELDF-SECBINFHSA-N 1 2 237.303 2.150 20 0 BEADLO Fc1cccc(CN2CCC[C@H]2c2[nH]cc[nH+]2)n1 ZINC000851886206 588640007 /nfs/dbraw/zinc/64/00/07/588640007.db2.gz DBCAURVPIWXHLO-NSHDSACASA-N 1 2 246.289 2.281 20 0 BEADLO C[C@H](C[S@](C)=O)[N@H+](C)CC=C(Cl)Cl ZINC000851923491 588644416 /nfs/dbraw/zinc/64/44/16/588644416.db2.gz RESVRPRIFYFEIK-UHLUBPPHSA-N 1 2 244.187 2.004 20 0 BEADLO C[C@H](C[S@](C)=O)[N@@H+](C)CC=C(Cl)Cl ZINC000851923491 588644417 /nfs/dbraw/zinc/64/44/17/588644417.db2.gz RESVRPRIFYFEIK-UHLUBPPHSA-N 1 2 244.187 2.004 20 0 BEADLO CCCCCCNC(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000851929987 588644939 /nfs/dbraw/zinc/64/49/39/588644939.db2.gz IRDOOVCYUGCQIO-UHFFFAOYSA-N 1 2 238.335 2.131 20 0 BEADLO CCCCCCNC(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000851929987 588644940 /nfs/dbraw/zinc/64/49/40/588644940.db2.gz IRDOOVCYUGCQIO-UHFFFAOYSA-N 1 2 238.335 2.131 20 0 BEADLO CC1(C)OC[C@H](C[N@@H+]2CCCC[C@H]2C(F)F)O1 ZINC000852016021 588655194 /nfs/dbraw/zinc/65/51/94/588655194.db2.gz SJNSRQMXUGGDJJ-UWVGGRQHSA-N 1 2 249.301 2.258 20 0 BEADLO CC1(C)OC[C@H](C[N@H+]2CCCC[C@H]2C(F)F)O1 ZINC000852016021 588655195 /nfs/dbraw/zinc/65/51/95/588655195.db2.gz SJNSRQMXUGGDJJ-UWVGGRQHSA-N 1 2 249.301 2.258 20 0 BEADLO COC(CC[N@@H+]1CCCC[C@H]1C(F)F)OC ZINC000852016071 588655397 /nfs/dbraw/zinc/65/53/97/588655397.db2.gz UCAWKMOLGUUJIM-VIFPVBQESA-N 1 2 237.290 2.115 20 0 BEADLO COC(CC[N@H+]1CCCC[C@H]1C(F)F)OC ZINC000852016071 588655398 /nfs/dbraw/zinc/65/53/98/588655398.db2.gz UCAWKMOLGUUJIM-VIFPVBQESA-N 1 2 237.290 2.115 20 0 BEADLO CC1=C(c2ccco2)C[N@H+](Cc2cnon2)CC1 ZINC000852019117 588655850 /nfs/dbraw/zinc/65/58/50/588655850.db2.gz VUOHBMFABXFZKG-UHFFFAOYSA-N 1 2 245.282 2.342 20 0 BEADLO CC1=C(c2ccco2)C[N@@H+](Cc2cnon2)CC1 ZINC000852019117 588655851 /nfs/dbraw/zinc/65/58/51/588655851.db2.gz VUOHBMFABXFZKG-UHFFFAOYSA-N 1 2 245.282 2.342 20 0 BEADLO Cl/C=C(\Cl)C[N@@H+]1CCn2cncc2C1 ZINC000852067215 588658782 /nfs/dbraw/zinc/65/87/82/588658782.db2.gz WSUQGXOQQNUCEO-BAQGIRSFSA-N 1 2 232.114 2.018 20 0 BEADLO Cl/C=C(\Cl)C[N@H+]1CCn2cncc2C1 ZINC000852067215 588658783 /nfs/dbraw/zinc/65/87/83/588658783.db2.gz WSUQGXOQQNUCEO-BAQGIRSFSA-N 1 2 232.114 2.018 20 0 BEADLO CCON(Cc1cn(C)c[nH+]1)Cc1ccccc1 ZINC000852149527 588667539 /nfs/dbraw/zinc/66/75/39/588667539.db2.gz RVABUXXIXPEWBN-UHFFFAOYSA-N 1 2 245.326 2.374 20 0 BEADLO CC1(C)OC[C@@H](CC[N@@H+]2CCCC(F)(F)C2)O1 ZINC000852211147 588672756 /nfs/dbraw/zinc/67/27/56/588672756.db2.gz PYWGKRUTEQGRRK-SNVBAGLBSA-N 1 2 249.301 2.259 20 0 BEADLO CC1(C)OC[C@@H](CC[N@H+]2CCCC(F)(F)C2)O1 ZINC000852211147 588672757 /nfs/dbraw/zinc/67/27/57/588672757.db2.gz PYWGKRUTEQGRRK-SNVBAGLBSA-N 1 2 249.301 2.259 20 0 BEADLO Cc1cc(CNC(=O)N[C@H]2C=CCC2)cc(C)[nH+]1 ZINC000852385978 588680701 /nfs/dbraw/zinc/68/07/01/588680701.db2.gz WGLARVDQAZVXED-ZDUSSCGKSA-N 1 2 245.326 2.216 20 0 BEADLO Cc1cc(CNC(=O)N[C@@H]2C=CCC2)cc(C)[nH+]1 ZINC000852385976 588680755 /nfs/dbraw/zinc/68/07/55/588680755.db2.gz WGLARVDQAZVXED-CYBMUJFWSA-N 1 2 245.326 2.216 20 0 BEADLO COCC[N@H+](CCF)Cc1ccc(C)nc1C ZINC000852480794 588684435 /nfs/dbraw/zinc/68/44/35/588684435.db2.gz CJLXISMKRWPINN-UHFFFAOYSA-N 1 2 240.322 2.116 20 0 BEADLO COCC[N@@H+](CCF)Cc1ccc(C)nc1C ZINC000852480794 588684436 /nfs/dbraw/zinc/68/44/36/588684436.db2.gz CJLXISMKRWPINN-UHFFFAOYSA-N 1 2 240.322 2.116 20 0 BEADLO FCC[C@H]1CCC[N@H+](Cc2cnsn2)C1 ZINC000852531542 588688437 /nfs/dbraw/zinc/68/84/37/588688437.db2.gz QCQXRRPOKVCYRU-SECBINFHSA-N 1 2 229.324 2.110 20 0 BEADLO FCC[C@H]1CCC[N@@H+](Cc2cnsn2)C1 ZINC000852531542 588688438 /nfs/dbraw/zinc/68/84/38/588688438.db2.gz QCQXRRPOKVCYRU-SECBINFHSA-N 1 2 229.324 2.110 20 0 BEADLO Cc1c[nH]c(CN2CCC[C@H]2c2cc(C)on2)[nH+]1 ZINC000862225717 589195799 /nfs/dbraw/zinc/19/57/99/589195799.db2.gz ZPINKRSFSVQZGB-LBPRGKRZSA-N 1 2 246.314 2.352 20 0 BEADLO CCc1cc(C[NH2+]Cc2cnc(C3CC3)o2)[nH]n1 ZINC000862278253 589198676 /nfs/dbraw/zinc/19/86/76/589198676.db2.gz BFKJLTXKPCYKGR-UHFFFAOYSA-N 1 2 246.314 2.127 20 0 BEADLO COCCN(Cc1[nH]cc(C)[nH+]1)c1ccccc1 ZINC000862388318 589207569 /nfs/dbraw/zinc/20/75/69/589207569.db2.gz YWZXCRNFRFYMPM-UHFFFAOYSA-N 1 2 245.326 2.371 20 0 BEADLO CCOC1(C)C[NH+](Cc2ccnc(F)c2C)C1 ZINC000862389813 589207964 /nfs/dbraw/zinc/20/79/64/589207964.db2.gz OXYKNLXEKIGGBD-UHFFFAOYSA-N 1 2 238.306 2.140 20 0 BEADLO CCn1ccc(C[NH2+]Cc2ccnc(F)c2C)n1 ZINC000862393337 589208507 /nfs/dbraw/zinc/20/85/07/589208507.db2.gz PHZMSOBDNNEMFW-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO O=C(c1cccc2[nH+]ccn21)N(C1CC1)C1CC1 ZINC000862852423 589243903 /nfs/dbraw/zinc/24/39/03/589243903.db2.gz JTBWSGQHVVVKDJ-UHFFFAOYSA-N 1 2 241.294 2.101 20 0 BEADLO CC(C)SCSC[C@@H]1C[N@H+](C)CCO1 ZINC000863349019 589281453 /nfs/dbraw/zinc/28/14/53/589281453.db2.gz XDHBANWHDLLAPA-JTQLQIEISA-N 1 2 235.418 2.149 20 0 BEADLO CC(C)SCSC[C@@H]1C[N@@H+](C)CCO1 ZINC000863349019 589281454 /nfs/dbraw/zinc/28/14/54/589281454.db2.gz XDHBANWHDLLAPA-JTQLQIEISA-N 1 2 235.418 2.149 20 0 BEADLO Cc1cnc(CSCCn2cc[nH+]c2)o1 ZINC000863400341 589287117 /nfs/dbraw/zinc/28/71/17/589287117.db2.gz FXHXLDAIWCBHMQ-UHFFFAOYSA-N 1 2 223.301 2.113 20 0 BEADLO CCO[C@@H](CO[NH+]=C(N)c1ccccc1)C1CC1 ZINC000863451606 589288718 /nfs/dbraw/zinc/28/87/18/589288718.db2.gz FJEZXZOYXZTFRO-ZDUSSCGKSA-N 1 2 248.326 2.348 20 0 BEADLO Cc1nc(CC(N)=[NH+]OC[C@H]2C[C@@H]2C)cs1 ZINC000863455543 589288888 /nfs/dbraw/zinc/28/88/88/589288888.db2.gz MFFLPDKZOPBDNY-IONNQARKSA-N 1 2 239.344 2.148 20 0 BEADLO C[C@H]1C[C@@H]1CO[NH+]=C(N)COc1ccccc1 ZINC000863453030 589289052 /nfs/dbraw/zinc/28/90/52/589289052.db2.gz AOWVERGEQWHNLU-WDEREUQCSA-N 1 2 234.299 2.220 20 0 BEADLO CC(C)OCC(N)=[NH+]OCC1CC(C)(C)C1 ZINC000863455331 589289207 /nfs/dbraw/zinc/28/92/07/589289207.db2.gz DWNUMMXPSPZMGW-UHFFFAOYSA-N 1 2 228.336 2.346 20 0 BEADLO C[C@@H]1C[C@H]1CO[NH+]=C(N)Cc1ccccc1 ZINC000863453670 589289230 /nfs/dbraw/zinc/28/92/30/589289230.db2.gz LUHNGJHKHJFDEI-PWSUYJOCSA-N 1 2 218.300 2.384 20 0 BEADLO COC1(C(N)=[NH+]OCCC2CC2)CCCC1 ZINC000863478431 589291932 /nfs/dbraw/zinc/29/19/32/589291932.db2.gz OPGOWSPNADJVOC-UHFFFAOYSA-N 1 2 226.320 2.244 20 0 BEADLO COC1(C(N)=[NH+]OCC2CCC2)CCCC1 ZINC000863477386 589292113 /nfs/dbraw/zinc/29/21/13/589292113.db2.gz JMBZGXIZLRJFPD-UHFFFAOYSA-N 1 2 226.320 2.244 20 0 BEADLO COC1(C(N)=[NH+]OCC2CC=CC2)CCCC1 ZINC000863477151 589292332 /nfs/dbraw/zinc/29/23/32/589292332.db2.gz HQSPVYVEKZSVGG-UHFFFAOYSA-N 1 2 238.331 2.410 20 0 BEADLO COc1cccc([C@H]([NH3+])c2nc(C3CC3)no2)c1 ZINC000863658948 589308513 /nfs/dbraw/zinc/30/85/13/589308513.db2.gz XXTCRFBZOODUNZ-NSHDSACASA-N 1 2 245.282 2.004 20 0 BEADLO COc1cccc([C@@H]([NH3+])c2nc(C(C)C)no2)c1 ZINC000863658078 589308787 /nfs/dbraw/zinc/30/87/87/589308787.db2.gz JXVOOCDNXVDWDU-LLVKDONJSA-N 1 2 247.298 2.250 20 0 BEADLO Cc1[nH]cc(-c2cn(C)nc2C(C)C)[nH+]1 ZINC000863692647 589310753 /nfs/dbraw/zinc/31/07/53/589310753.db2.gz YPOPFOULTFAMFL-UHFFFAOYSA-N 1 2 204.277 2.242 20 0 BEADLO C[C@H](O)c1ccc(N2CCC(C)(F)CC2)[nH+]c1 ZINC000864089107 589343053 /nfs/dbraw/zinc/34/30/53/589343053.db2.gz LSAWLDUMDWQLRG-JTQLQIEISA-N 1 2 238.306 2.463 20 0 BEADLO CCc1cnc(CNc2[nH+]cccc2CO)s1 ZINC000864094303 589344362 /nfs/dbraw/zinc/34/43/62/589344362.db2.gz PVAJGNFOWOOUFL-UHFFFAOYSA-N 1 2 249.339 2.205 20 0 BEADLO CCO[C@@]1(C)C[C@H]1Nc1ccc([C@@H](C)O)c[nH+]1 ZINC000864093199 589344389 /nfs/dbraw/zinc/34/43/89/589344389.db2.gz JQMWCPAPSSTYBS-XWIASGKRSA-N 1 2 236.315 2.114 20 0 BEADLO Cn1ncc2c1nc[nH+]c2N[C@@H]1CCCC[C@@H]1F ZINC000864354525 589354988 /nfs/dbraw/zinc/35/49/88/589354988.db2.gz GFAQXMDLJGUYIS-VHSXEESVSA-N 1 2 249.293 2.056 20 0 BEADLO CSCc1cn(-c2ccc([NH+](C)C)cc2)nn1 ZINC000864628378 589381477 /nfs/dbraw/zinc/38/14/77/589381477.db2.gz GMLSVNBFANGESK-UHFFFAOYSA-N 1 2 248.355 2.196 20 0 BEADLO CC/C=C(\F)C(=O)Nc1ccc[nH+]c1N(C)C ZINC000864971573 589402739 /nfs/dbraw/zinc/40/27/39/589402739.db2.gz ADQDUCLDNPBTHZ-TWGQIWQCSA-N 1 2 237.278 2.350 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C ZINC000865069446 589407539 /nfs/dbraw/zinc/40/75/39/589407539.db2.gz GVEWBXCYXMAQKE-LNFKQOIKSA-N 1 2 246.310 2.321 20 0 BEADLO CCCC(CCC)C(=O)NC1=[NH+]CCS1 ZINC000120400174 589409402 /nfs/dbraw/zinc/40/94/02/589409402.db2.gz PWAIOHAIJBUFPZ-UHFFFAOYSA-N 1 2 228.361 2.422 20 0 BEADLO CC(C)(C)c1cn(CC(=O)NCC2CCC2)c[nH+]1 ZINC000865376001 589428372 /nfs/dbraw/zinc/42/83/72/589428372.db2.gz UWAVHCFPRHVKNG-UHFFFAOYSA-N 1 2 249.358 2.097 20 0 BEADLO CC(C)COC(=O)Cn1c[nH+]c(C(C)(C)C)c1 ZINC000865376570 589429063 /nfs/dbraw/zinc/42/90/63/589429063.db2.gz UJSQUFACCQKICP-UHFFFAOYSA-N 1 2 238.331 2.380 20 0 BEADLO CC(C)Cc1cc(NCC2CC2)nc[nH+]1 ZINC000865428943 589435346 /nfs/dbraw/zinc/43/53/46/589435346.db2.gz CNKDQPJRWVFEHX-UHFFFAOYSA-N 1 2 205.305 2.497 20 0 BEADLO Cc1cc(CN(C)c2ccc([C@H](C)O)c[nH+]2)no1 ZINC000865436880 589436070 /nfs/dbraw/zinc/43/60/70/589436070.db2.gz SMEYKBGKWBHQCZ-JTQLQIEISA-N 1 2 247.298 2.068 20 0 BEADLO C[C@H]1C[C@@H]1CNc1nc(N)[nH+]c(C2CCCC2)n1 ZINC000865443039 589436469 /nfs/dbraw/zinc/43/64/69/589436469.db2.gz WKSTXEDNYMYLHC-WCBMZHEXSA-N 1 2 247.346 2.179 20 0 BEADLO C[C@H]1C[C@@H]1CNc1nc(N)nc(C2CCCC2)[nH+]1 ZINC000865443039 589436471 /nfs/dbraw/zinc/43/64/71/589436471.db2.gz WKSTXEDNYMYLHC-WCBMZHEXSA-N 1 2 247.346 2.179 20 0 BEADLO Cc1cnc(CNCc2cn(C3CC3)c[nH+]2)s1 ZINC000865477070 589439862 /nfs/dbraw/zinc/43/98/62/589439862.db2.gz XQDHFQFFHBHSGF-UHFFFAOYSA-N 1 2 248.355 2.273 20 0 BEADLO Cc1cnc(C[NH2+]Cc2cn(C3CC3)cn2)s1 ZINC000865477070 589439863 /nfs/dbraw/zinc/43/98/63/589439863.db2.gz XQDHFQFFHBHSGF-UHFFFAOYSA-N 1 2 248.355 2.273 20 0 BEADLO c1ccc(NC2CCC3(CC2)OCCO3)[nH+]c1 ZINC000120598897 589441209 /nfs/dbraw/zinc/44/12/09/589441209.db2.gz YCJCJVWZFFBSJW-UHFFFAOYSA-N 1 2 234.299 2.179 20 0 BEADLO COc1ccc(NCc2cn(C3CC3)c[nH+]2)cn1 ZINC000865493301 589441242 /nfs/dbraw/zinc/44/12/42/589441242.db2.gz GVCPFGKDODSWNN-UHFFFAOYSA-N 1 2 244.298 2.234 20 0 BEADLO CCC[C@@H](O)CNc1cc(CC(C)C)[nH+]cn1 ZINC000865536473 589444008 /nfs/dbraw/zinc/44/40/08/589444008.db2.gz ZWPLJWFOYIAWKO-GFCCVEGCSA-N 1 2 237.347 2.248 20 0 BEADLO CN(C)c1ccc(F)cc1C[NH2+]CC(F)F ZINC000865565375 589446799 /nfs/dbraw/zinc/44/67/99/589446799.db2.gz WORBPFUQKIIUPA-UHFFFAOYSA-N 1 2 232.249 2.246 20 0 BEADLO Nc1nc(NC2CC=CC2)nc(C2CCCC2)[nH+]1 ZINC000865611193 589450983 /nfs/dbraw/zinc/45/09/83/589450983.db2.gz BLWGRDHZQLRDSK-UHFFFAOYSA-N 1 2 245.330 2.242 20 0 BEADLO Nc1nc(NC2CC=CC2)[nH+]c(C2CCCC2)n1 ZINC000865611193 589450984 /nfs/dbraw/zinc/45/09/84/589450984.db2.gz BLWGRDHZQLRDSK-UHFFFAOYSA-N 1 2 245.330 2.242 20 0 BEADLO CC(C)n1ncnc1C[NH2+][C@@H]1CCCC[C@@H]1F ZINC000865696588 589456851 /nfs/dbraw/zinc/45/68/51/589456851.db2.gz GSPNECPSJOOKFJ-WDEREUQCSA-N 1 2 240.326 2.229 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1ccc(C)cn1 ZINC000120703501 589457776 /nfs/dbraw/zinc/45/77/76/589457776.db2.gz VHFICFWNESXVAQ-UHFFFAOYSA-N 1 2 243.266 2.046 20 0 BEADLO CC(C)n1ccnc1C[NH2+]Cc1ccnc(F)c1 ZINC000865722304 589458546 /nfs/dbraw/zinc/45/85/46/589458546.db2.gz GONVMXSSXGTEMG-UHFFFAOYSA-N 1 2 248.305 2.288 20 0 BEADLO Cc1cc(NC(=O)[C@]23C[C@H]2CCCC3)cc[nH+]1 ZINC000865741117 589460082 /nfs/dbraw/zinc/46/00/82/589460082.db2.gz MPFUJFXFAKYCCH-BXUZGUMPSA-N 1 2 230.311 2.331 20 0 BEADLO Clc1cc2c(nc[nH+]c2N2CC(C3CC3)C2)[nH]1 ZINC000865822026 589463173 /nfs/dbraw/zinc/46/31/73/589463173.db2.gz QVQDSEHPILIQSR-UHFFFAOYSA-N 1 2 248.717 2.409 20 0 BEADLO CCCNc1cc(N[C@H](C)[C@@H](C)OC)nc[nH+]1 ZINC000865819872 589463300 /nfs/dbraw/zinc/46/33/00/589463300.db2.gz YEQNLVQJGZULQY-NXEZZACHSA-N 1 2 238.335 2.134 20 0 BEADLO CCCNc1cc(N[C@H](C)[C@@H](C)OC)[nH+]cn1 ZINC000865819872 589463301 /nfs/dbraw/zinc/46/33/01/589463301.db2.gz YEQNLVQJGZULQY-NXEZZACHSA-N 1 2 238.335 2.134 20 0 BEADLO C[C@H]1CN(c2[nH+]cnc3[nH]c(Cl)cc32)[C@H]1C ZINC000865839213 589464429 /nfs/dbraw/zinc/46/44/29/589464429.db2.gz JRSFOMYUASFLOF-BQBZGAKWSA-N 1 2 236.706 2.408 20 0 BEADLO CN(C)c1ccc(NCc2c[nH+]cn2C)cc1F ZINC000865865381 589465806 /nfs/dbraw/zinc/46/58/06/589465806.db2.gz QKWXNANBPMMPFW-UHFFFAOYSA-N 1 2 248.305 2.237 20 0 BEADLO Cc1cc(C)c(CNc2ccc(F)nn2)c[nH+]1 ZINC000865862299 589465831 /nfs/dbraw/zinc/46/58/31/589465831.db2.gz IVUYTLQWEWNYMD-UHFFFAOYSA-N 1 2 232.262 2.240 20 0 BEADLO COCC[C@H](C)CNc1ccc([C@H](C)O)c[nH+]1 ZINC000865874329 589466728 /nfs/dbraw/zinc/46/67/28/589466728.db2.gz BPOJYQXYBIPDRD-QWRGUYRKSA-N 1 2 238.331 2.219 20 0 BEADLO Nc1nc(N[C@@H]2C=CCC2)nc(C2CCCC2)[nH+]1 ZINC000865938964 589469497 /nfs/dbraw/zinc/46/94/97/589469497.db2.gz MRQVAZPLFBWOMJ-SNVBAGLBSA-N 1 2 245.330 2.242 20 0 BEADLO Nc1nc(N[C@@H]2C=CCC2)[nH+]c(C2CCCC2)n1 ZINC000865938964 589469498 /nfs/dbraw/zinc/46/94/98/589469498.db2.gz MRQVAZPLFBWOMJ-SNVBAGLBSA-N 1 2 245.330 2.242 20 0 BEADLO C[C@H](O)c1ccc(NCC(C)(C)F)[nH+]c1 ZINC000865984873 589471318 /nfs/dbraw/zinc/47/13/18/589471318.db2.gz HQEHDTGASMWDEZ-QMMMGPOBSA-N 1 2 212.268 2.295 20 0 BEADLO Cc1nc(N[C@@H]2CC(C)(C)CC[C@H]2O)cc[nH+]1 ZINC000866050422 589474200 /nfs/dbraw/zinc/47/42/00/589474200.db2.gz VKAKWJZIRBCSPB-GHMZBOCLSA-N 1 2 235.331 2.137 20 0 BEADLO CO[C@@H]1CC[C@H](C)N(c2cc[nH+]c(C3CC3)n2)C1 ZINC000866069662 589474608 /nfs/dbraw/zinc/47/46/08/589474608.db2.gz FRJWSABXKHZELM-CMPLNLGQSA-N 1 2 247.342 2.358 20 0 BEADLO CO[C@@H]1CC[C@@H](C)N(c2cccc[nH+]2)C1 ZINC000866070644 589474976 /nfs/dbraw/zinc/47/49/76/589474976.db2.gz ZZWBOAYONXMERK-GHMZBOCLSA-N 1 2 206.289 2.085 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@H]1C[C@H](SC)C1 ZINC000866102382 589475105 /nfs/dbraw/zinc/47/51/05/589475105.db2.gz LENIZZWOILXISB-KYZUINATSA-N 1 2 239.344 2.100 20 0 BEADLO Cc1nc(NC[C@H]2CCC23CCOCC3)cc[nH+]1 ZINC000866175144 589478959 /nfs/dbraw/zinc/47/89/59/589478959.db2.gz OWBNAMSBHGYACI-GFCCVEGCSA-N 1 2 247.342 2.404 20 0 BEADLO CC[C@@H](C[C@H](C)O)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000866300949 589484774 /nfs/dbraw/zinc/48/47/74/589484774.db2.gz ZZERZMJRLFRGET-WPRPVWTQSA-N 1 2 248.330 2.228 20 0 BEADLO CC[C@@H](C[C@@H](C)O)Nc1cc[nH+]c2ccncc12 ZINC000866300854 589484951 /nfs/dbraw/zinc/48/49/51/589484951.db2.gz YGCBHMQWMFFGJU-MNOVXSKESA-N 1 2 245.326 2.013 20 0 BEADLO FCC[NH2+][C@H]1c2ccccc2OC[C@H]1F ZINC000866351593 589486667 /nfs/dbraw/zinc/48/66/67/589486667.db2.gz BYFHCPUALCYNKB-KOLCDFICSA-N 1 2 213.227 2.017 20 0 BEADLO CC(C)(C)[C@@H]1C[C@H]1C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000868620644 589568474 /nfs/dbraw/zinc/56/84/74/589568474.db2.gz DHUSEFFHWYEHEL-MXWKQRLJSA-N 1 2 247.342 2.126 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)C=C(C)C)c1 ZINC000122246785 589572642 /nfs/dbraw/zinc/57/26/42/589572642.db2.gz KYYDHGIPKOUSPK-UHFFFAOYSA-N 1 2 235.283 2.408 20 0 BEADLO C[C@H](NC(=O)[C@]12C[C@H]1CCCC2)c1[nH+]ccn1C ZINC000869301567 589596966 /nfs/dbraw/zinc/59/69/66/589596966.db2.gz HDQBCTCPAVFZGK-MISXGVKJSA-N 1 2 247.342 2.178 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)C2CCC2)c1 ZINC000122638536 589611603 /nfs/dbraw/zinc/61/16/03/589611603.db2.gz DVAUEUKSTIIVFP-UHFFFAOYSA-N 1 2 235.283 2.242 20 0 BEADLO CC1(C(=O)NC2=[NH+]CCS2)CCCCC1 ZINC000122930241 589644908 /nfs/dbraw/zinc/64/49/08/589644908.db2.gz RDGNKKULEOPMGO-UHFFFAOYSA-N 1 2 226.345 2.176 20 0 BEADLO NC(=[NH+]OCC1CC2(CCC2)C1)[C@@H]1CCCO1 ZINC000871748864 589804305 /nfs/dbraw/zinc/80/43/05/589804305.db2.gz OXOSOQCBKVWIPK-NSHDSACASA-N 1 2 238.331 2.244 20 0 BEADLO NC(COC1CCC1)=[NH+]OCC1CC=CC1 ZINC000871778310 589813918 /nfs/dbraw/zinc/81/39/18/589813918.db2.gz BYGVUGTUCVXLKE-UHFFFAOYSA-N 1 2 224.304 2.020 20 0 BEADLO CC(C)[C@@H]([NH2+][C@@H]1CCOC1=O)c1ccccc1 ZINC000123848846 589828463 /nfs/dbraw/zinc/82/84/63/589828463.db2.gz YENXMOKEMQETEE-CHWSQXEVSA-N 1 2 233.311 2.289 20 0 BEADLO CCC[C@H]([NH2+][C@H]1C[C@H](SC)C1)C(=O)OCC ZINC000871916459 589832114 /nfs/dbraw/zinc/83/21/14/589832114.db2.gz MCAAWFINODPVTF-DCAQKATOSA-N 1 2 245.388 2.202 20 0 BEADLO CCCC[C@H]([NH2+][C@H]1C[C@H](SC)C1)C(=O)OC ZINC000871916184 589832499 /nfs/dbraw/zinc/83/24/99/589832499.db2.gz JJDFKDDSIMEHOZ-DCAQKATOSA-N 1 2 245.388 2.202 20 0 BEADLO Cc1nonc1C[NH2+][C@@H]1CCc2c1cccc2F ZINC000871937168 589835237 /nfs/dbraw/zinc/83/52/37/589835237.db2.gz BSYCZPNWYPAMTJ-GFCCVEGCSA-N 1 2 247.273 2.294 20 0 BEADLO CC(C)(C)c1cn(CC2(O)CCCC2)c[nH+]1 ZINC000871990214 589854652 /nfs/dbraw/zinc/85/46/52/589854652.db2.gz YYWCMRBJSXCNHH-UHFFFAOYSA-N 1 2 222.332 2.486 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2cccc(O)c2F)[nH]n1 ZINC000872038744 589858909 /nfs/dbraw/zinc/85/89/09/589858909.db2.gz PPZBZYLGXBRUMI-VIFPVBQESA-N 1 2 249.289 2.414 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@@H]1C[C@@H]2CCC[C@@H]2O1 ZINC000872110054 589874244 /nfs/dbraw/zinc/87/42/44/589874244.db2.gz VLQKHDUGYGVYHT-HVTMNAMFSA-N 1 2 249.358 2.326 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1C[C@@H]2CCC[C@H]2O1 ZINC000872695654 589962467 /nfs/dbraw/zinc/96/24/67/589962467.db2.gz IQYNWSHDWMUVAU-SDDRHHMPSA-N 1 2 248.326 2.460 20 0 BEADLO Cc1cc(NC[C@@H]2C[C@H]3CCC[C@@H]3O2)nc[nH+]1 ZINC000872694764 589962538 /nfs/dbraw/zinc/96/25/38/589962538.db2.gz AZOXPCFENMZHPX-WOPDTQHZSA-N 1 2 233.315 2.155 20 0 BEADLO c1ccc(NC[C@@H]2C[C@@H]3CCC[C@@H]3O2)[nH+]c1 ZINC000872699878 589962807 /nfs/dbraw/zinc/96/28/07/589962807.db2.gz VJUYCHDSVDOBPM-SRVKXCTJSA-N 1 2 218.300 2.451 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@@H]2CC23CCC3)c1 ZINC000872774873 589967608 /nfs/dbraw/zinc/96/76/08/589967608.db2.gz JTZKKBSMCRKORV-LLVKDONJSA-N 1 2 246.310 2.152 20 0 BEADLO CCn1ncc(Nc2[nH+]cnc3[nH]ccc32)c1C ZINC000872778234 589969098 /nfs/dbraw/zinc/96/90/98/589969098.db2.gz DNHPMFYKYKAHCA-UHFFFAOYSA-N 1 2 242.286 2.226 20 0 BEADLO CCN(C)c1ccccc1C[NH2+]Cc1ccon1 ZINC000873048367 589981084 /nfs/dbraw/zinc/98/10/84/589981084.db2.gz YOPGYEWPIVVJNH-UHFFFAOYSA-N 1 2 245.326 2.421 20 0 BEADLO CCC[C@H](CC)C(=O)OCc1c[nH+]cn1C ZINC000873508730 590051172 /nfs/dbraw/zinc/05/11/72/590051172.db2.gz RUQAYSFTAIUWJB-JTQLQIEISA-N 1 2 224.304 2.290 20 0 BEADLO O=C([C@@H]1C[C@H]1c1c[nH+]c[nH]1)N1CCCCCCC1 ZINC000873886480 590077296 /nfs/dbraw/zinc/07/72/96/590077296.db2.gz AXXJEXCAIAOJMU-VXGBXAGGSA-N 1 2 247.342 2.306 20 0 BEADLO O=C([C@@H]1C[C@H]1c1c[nH]c[nH+]1)N1CCCCCCC1 ZINC000873886480 590077299 /nfs/dbraw/zinc/07/72/99/590077299.db2.gz AXXJEXCAIAOJMU-VXGBXAGGSA-N 1 2 247.342 2.306 20 0 BEADLO CCCCCCNC(=O)Cc1[nH]cc(CC)[nH+]1 ZINC000873913178 590078897 /nfs/dbraw/zinc/07/88/97/590078897.db2.gz ODNNHRWEKKHDPZ-UHFFFAOYSA-N 1 2 237.347 2.211 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C1(C)CC(F)(F)C1 ZINC000874443004 590110960 /nfs/dbraw/zinc/11/09/60/590110960.db2.gz YENCXVSCDKWRFO-UHFFFAOYSA-N 1 2 240.253 2.186 20 0 BEADLO CSC[C@H](C)[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000125236985 590157419 /nfs/dbraw/zinc/15/74/19/590157419.db2.gz YUFNAROYHHAZEY-DTWKUNHWSA-N 1 2 233.377 2.058 20 0 BEADLO c1ccc2c(c1)C[NH2+][C@@H](c1nc(C3CC3)no1)C2 ZINC000021512298 590191801 /nfs/dbraw/zinc/19/18/01/590191801.db2.gz UDNFXZYWIZFOGG-GFCCVEGCSA-N 1 2 241.294 2.334 20 0 BEADLO CCCn1cc(C[N@H+](C)[C@@H](C)c2ccco2)nn1 ZINC000876574253 590217789 /nfs/dbraw/zinc/21/77/89/590217789.db2.gz QHTFULTXGNJTIC-NSHDSACASA-N 1 2 248.330 2.474 20 0 BEADLO CCCn1cc(C[N@@H+](C)[C@@H](C)c2ccco2)nn1 ZINC000876574253 590217790 /nfs/dbraw/zinc/21/77/90/590217790.db2.gz QHTFULTXGNJTIC-NSHDSACASA-N 1 2 248.330 2.474 20 0 BEADLO COc1cnc(F)c(C[N@H+](C)Cc2ccc[nH]2)c1 ZINC000876790615 590241526 /nfs/dbraw/zinc/24/15/26/590241526.db2.gz RHRQJLSAJKYQDN-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO COc1cnc(F)c(C[N@@H+](C)Cc2ccc[nH]2)c1 ZINC000876790615 590241527 /nfs/dbraw/zinc/24/15/27/590241527.db2.gz RHRQJLSAJKYQDN-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO COC(=O)C(C)(C)[NH2+]CCc1cc(C)cc(C)c1 ZINC000877140451 590291803 /nfs/dbraw/zinc/29/18/03/590291803.db2.gz GFSWNPDFSKBWML-UHFFFAOYSA-N 1 2 249.354 2.387 20 0 BEADLO Cn1ncc2cc(C[N@@H+]3CCC=C(F)C3)cnc21 ZINC000877174321 590296637 /nfs/dbraw/zinc/29/66/37/590296637.db2.gz RZEAVHCXXBFWLJ-UHFFFAOYSA-N 1 2 246.289 2.027 20 0 BEADLO Cn1ncc2cc(C[N@H+]3CCC=C(F)C3)cnc21 ZINC000877174321 590296639 /nfs/dbraw/zinc/29/66/39/590296639.db2.gz RZEAVHCXXBFWLJ-UHFFFAOYSA-N 1 2 246.289 2.027 20 0 BEADLO c1cc(CN2CCC[C@H]2c2[nH]cc[nH+]2)sn1 ZINC000877344647 590318724 /nfs/dbraw/zinc/31/87/24/590318724.db2.gz LISVGLOQWLBZFK-JTQLQIEISA-N 1 2 234.328 2.203 20 0 BEADLO OCC[N@H+](Cc1nc(Cl)cs1)C1CCC1 ZINC000877464541 590333493 /nfs/dbraw/zinc/33/34/93/590333493.db2.gz PVDFEMIIMIGCPK-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO OCC[N@@H+](Cc1nc(Cl)cs1)C1CCC1 ZINC000877464541 590333496 /nfs/dbraw/zinc/33/34/96/590333496.db2.gz PVDFEMIIMIGCPK-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO O[C@@H]1CCC[N@H+](Cc2nc(Cl)cs2)CC1 ZINC000877554156 590356238 /nfs/dbraw/zinc/35/62/38/590356238.db2.gz FHTHZDBJHSQXFC-MRVPVSSYSA-N 1 2 246.763 2.143 20 0 BEADLO O[C@@H]1CCC[N@@H+](Cc2nc(Cl)cs2)CC1 ZINC000877554156 590356241 /nfs/dbraw/zinc/35/62/41/590356241.db2.gz FHTHZDBJHSQXFC-MRVPVSSYSA-N 1 2 246.763 2.143 20 0 BEADLO O=c1[nH]ccc2oc(C[N@H+]3CC[C@H](F)C3)cc21 ZINC000877558713 590358318 /nfs/dbraw/zinc/35/83/18/590358318.db2.gz LROFELGMHKXMOJ-QMMMGPOBSA-N 1 2 236.246 2.077 20 0 BEADLO O=c1[nH]ccc2oc(C[N@@H+]3CC[C@H](F)C3)cc21 ZINC000877558713 590358321 /nfs/dbraw/zinc/35/83/21/590358321.db2.gz LROFELGMHKXMOJ-QMMMGPOBSA-N 1 2 236.246 2.077 20 0 BEADLO CCCn1cc(C[NH+]2CC(CC)(CC)C2)nn1 ZINC000877579892 590364178 /nfs/dbraw/zinc/36/41/78/590364178.db2.gz HXLLJYBIWHQSKF-UHFFFAOYSA-N 1 2 236.363 2.310 20 0 BEADLO C[C@@H](C[C@@H]1CCOC1)Nc1c[nH+]cc(N(C)C)c1 ZINC000877668868 590389461 /nfs/dbraw/zinc/38/94/61/590389461.db2.gz VKXMCWLRPINXSV-RYUDHWBXSA-N 1 2 249.358 2.375 20 0 BEADLO Fc1cc(C[NH2+]Cc2cc(C3CC3)no2)ccn1 ZINC000877696886 590392650 /nfs/dbraw/zinc/39/26/50/590392650.db2.gz ADJOLHYXZJDUHW-UHFFFAOYSA-N 1 2 247.273 2.376 20 0 BEADLO C[C@@H]1CCC[C@H](C2C[NH+](Cc3cnn(C)n3)C2)C1 ZINC000877763950 590420104 /nfs/dbraw/zinc/42/01/04/590420104.db2.gz OOXWWXIYLZSKDA-NEPJUHHUSA-N 1 2 248.374 2.073 20 0 BEADLO Cc1nnc(CCn2c[nH+]c(C(C)(C)C)c2)o1 ZINC000877891648 590440989 /nfs/dbraw/zinc/44/09/89/590440989.db2.gz UGXUVYWIFDEUPV-UHFFFAOYSA-N 1 2 234.303 2.115 20 0 BEADLO CCOCCOCCn1c[nH+]c(C(C)(C)C)c1 ZINC000877891889 590441201 /nfs/dbraw/zinc/44/12/01/590441201.db2.gz ZKEZKISIAKZRPQ-UHFFFAOYSA-N 1 2 240.347 2.234 20 0 BEADLO CC[C@@H]1CCC[C@@]1(C)C(=O)NC1=[NH+]CCS1 ZINC000877963032 590459672 /nfs/dbraw/zinc/45/96/72/590459672.db2.gz FCUYUDCXGNALMQ-BXKDBHETSA-N 1 2 240.372 2.422 20 0 BEADLO Cc1conc1C[N@@H+]1CCOc2ccccc2C1 ZINC000877984137 590465721 /nfs/dbraw/zinc/46/57/21/590465721.db2.gz AVSNYHJEJSWUKR-UHFFFAOYSA-N 1 2 244.294 2.378 20 0 BEADLO Cc1conc1C[N@H+]1CCOc2ccccc2C1 ZINC000877984137 590465722 /nfs/dbraw/zinc/46/57/22/590465722.db2.gz AVSNYHJEJSWUKR-UHFFFAOYSA-N 1 2 244.294 2.378 20 0 BEADLO Clc1ncsc1C[N@@H+]1CCCOCC1 ZINC000878013586 590472103 /nfs/dbraw/zinc/47/21/03/590472103.db2.gz AKBZAEQOUQLGMA-UHFFFAOYSA-N 1 2 232.736 2.019 20 0 BEADLO Clc1ncsc1C[N@H+]1CCCOCC1 ZINC000878013586 590472107 /nfs/dbraw/zinc/47/21/07/590472107.db2.gz AKBZAEQOUQLGMA-UHFFFAOYSA-N 1 2 232.736 2.019 20 0 BEADLO C[C@@H]1C[N@H+](Cc2scnc2Cl)CCCO1 ZINC000878041978 590479231 /nfs/dbraw/zinc/47/92/31/590479231.db2.gz RDTJAIBPGQIVAV-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2scnc2Cl)CCCO1 ZINC000878041978 590479232 /nfs/dbraw/zinc/47/92/32/590479232.db2.gz RDTJAIBPGQIVAV-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO Cc1conc1C[N@@H+](C)[C@@H](CO)c1ccccc1 ZINC000878049302 590481888 /nfs/dbraw/zinc/48/18/88/590481888.db2.gz VZQLVRNCJNOYCQ-AWEZNQCLSA-N 1 2 246.310 2.148 20 0 BEADLO Cc1conc1C[N@H+](C)[C@@H](CO)c1ccccc1 ZINC000878049302 590481891 /nfs/dbraw/zinc/48/18/91/590481891.db2.gz VZQLVRNCJNOYCQ-AWEZNQCLSA-N 1 2 246.310 2.148 20 0 BEADLO C=C/C=C\CC[N@@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000878123318 590500565 /nfs/dbraw/zinc/50/05/65/590500565.db2.gz WRBDUXPOLIDHMD-XOULXFPDSA-N 1 2 235.249 2.382 20 0 BEADLO C=C/C=C\CC[N@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000878123318 590500567 /nfs/dbraw/zinc/50/05/67/590500567.db2.gz WRBDUXPOLIDHMD-XOULXFPDSA-N 1 2 235.249 2.382 20 0 BEADLO COCC1([N@H+](C)Cc2coc(C3CC3)n2)CC1 ZINC000878317092 590543288 /nfs/dbraw/zinc/54/32/88/590543288.db2.gz FOCLXTSJAGTEAG-UHFFFAOYSA-N 1 2 236.315 2.163 20 0 BEADLO COCC1([N@@H+](C)Cc2coc(C3CC3)n2)CC1 ZINC000878317092 590543290 /nfs/dbraw/zinc/54/32/90/590543290.db2.gz FOCLXTSJAGTEAG-UHFFFAOYSA-N 1 2 236.315 2.163 20 0 BEADLO C[C@@H]([NH2+]Cc1nc2c(o1)CCCC2)c1cn[nH]c1 ZINC000878426703 590564756 /nfs/dbraw/zinc/56/47/56/590564756.db2.gz NTDBUFYERXZNGR-SECBINFHSA-N 1 2 246.314 2.127 20 0 BEADLO CC(=O)C[N@@H+]1CC[C@@H](c2c(F)cccc2F)C1 ZINC000878443203 590568459 /nfs/dbraw/zinc/56/84/59/590568459.db2.gz WHBQSGRXTCNEAH-SNVBAGLBSA-N 1 2 239.265 2.343 20 0 BEADLO CC(=O)C[N@H+]1CC[C@@H](c2c(F)cccc2F)C1 ZINC000878443203 590568460 /nfs/dbraw/zinc/56/84/60/590568460.db2.gz WHBQSGRXTCNEAH-SNVBAGLBSA-N 1 2 239.265 2.343 20 0 BEADLO CC(=O)C[N@@H+]1CC[C@H](c2c(F)cccc2F)C1 ZINC000878443200 590568558 /nfs/dbraw/zinc/56/85/58/590568558.db2.gz WHBQSGRXTCNEAH-JTQLQIEISA-N 1 2 239.265 2.343 20 0 BEADLO CC(=O)C[N@H+]1CC[C@H](c2c(F)cccc2F)C1 ZINC000878443200 590568559 /nfs/dbraw/zinc/56/85/59/590568559.db2.gz WHBQSGRXTCNEAH-JTQLQIEISA-N 1 2 239.265 2.343 20 0 BEADLO c1cnc2c(c1)C[N@@H+](C[C@@H]1CC3(CCC3)CO1)C2 ZINC000878548267 590590334 /nfs/dbraw/zinc/59/03/34/590590334.db2.gz IHEUJXUYQPHAPI-ZDUSSCGKSA-N 1 2 244.338 2.356 20 0 BEADLO c1cnc2c(c1)C[N@H+](C[C@@H]1CC3(CCC3)CO1)C2 ZINC000878548267 590590335 /nfs/dbraw/zinc/59/03/35/590590335.db2.gz IHEUJXUYQPHAPI-ZDUSSCGKSA-N 1 2 244.338 2.356 20 0 BEADLO CON(Cc1[nH]c(C)c(C)[nH+]1)CC(C)(C)C ZINC000878609058 590595693 /nfs/dbraw/zinc/59/56/93/590595693.db2.gz MOMYZCCRAMSOJY-UHFFFAOYSA-N 1 2 225.336 2.436 20 0 BEADLO CC(C)(C)SCCC[NH2+][C@]1(C)CCOC1=O ZINC000878632689 590598219 /nfs/dbraw/zinc/59/82/19/590598219.db2.gz RXQMMWSRBHEXNB-GFCCVEGCSA-N 1 2 245.388 2.203 20 0 BEADLO Cc1conc1C[N@@H+]1CCC[C@@](C)(F)C1 ZINC000878660797 590604651 /nfs/dbraw/zinc/60/46/51/590604651.db2.gz ZCNVBMZZKVSNHC-LLVKDONJSA-N 1 2 212.268 2.307 20 0 BEADLO Cc1conc1C[N@H+]1CCC[C@@](C)(F)C1 ZINC000878660797 590604652 /nfs/dbraw/zinc/60/46/52/590604652.db2.gz ZCNVBMZZKVSNHC-LLVKDONJSA-N 1 2 212.268 2.307 20 0 BEADLO CC[C@@H]1C[NH+](Cc2nocc2C)C[C@@H](CC)O1 ZINC000878719477 590615628 /nfs/dbraw/zinc/61/56/28/590615628.db2.gz BYLRSTPNETVFCQ-VXGBXAGGSA-N 1 2 238.331 2.372 20 0 BEADLO C[C@@H](C[N@H+](C)Cc1n[nH]c(=O)o1)CC(C)(C)C ZINC000878726115 590616653 /nfs/dbraw/zinc/61/66/53/590616653.db2.gz JLPAYJHIRQRJLB-SECBINFHSA-N 1 2 241.335 2.279 20 0 BEADLO C[C@@H](C[N@@H+](C)Cc1n[nH]c(=O)o1)CC(C)(C)C ZINC000878726115 590616654 /nfs/dbraw/zinc/61/66/54/590616654.db2.gz JLPAYJHIRQRJLB-SECBINFHSA-N 1 2 241.335 2.279 20 0 BEADLO CC[C@@H]1CCC[C@@]1(C)C(=O)NCCc1[nH]cc[nH+]1 ZINC000878798791 590624950 /nfs/dbraw/zinc/62/49/50/590624950.db2.gz XBBOORPJNYCFJQ-BXUZGUMPSA-N 1 2 249.358 2.285 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@@H+]1Cc1nocc1C ZINC000878803074 590625104 /nfs/dbraw/zinc/62/51/04/590625104.db2.gz BIOWKDRXLGNFQX-NSHDSACASA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@H+]1Cc1nocc1C ZINC000878803074 590625106 /nfs/dbraw/zinc/62/51/06/590625106.db2.gz BIOWKDRXLGNFQX-NSHDSACASA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nocc2C)[C@@H](CC)CO1 ZINC000878803891 590625231 /nfs/dbraw/zinc/62/52/31/590625231.db2.gz NBINSCLRVGMSKJ-NWDGAFQWSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nocc2C)[C@@H](CC)CO1 ZINC000878803891 590625232 /nfs/dbraw/zinc/62/52/32/590625232.db2.gz NBINSCLRVGMSKJ-NWDGAFQWSA-N 1 2 238.331 2.372 20 0 BEADLO Fc1cccc(C[N@@H+]2CCC[C@H]2c2cn[nH]c2)n1 ZINC000878876923 590637545 /nfs/dbraw/zinc/63/75/45/590637545.db2.gz XQIFGFOCZWVXSC-LBPRGKRZSA-N 1 2 246.289 2.281 20 0 BEADLO Fc1cccc(C[N@H+]2CCC[C@H]2c2cn[nH]c2)n1 ZINC000878876923 590637547 /nfs/dbraw/zinc/63/75/47/590637547.db2.gz XQIFGFOCZWVXSC-LBPRGKRZSA-N 1 2 246.289 2.281 20 0 BEADLO CC[C@@H]1CCC[C@@]1(C)C(=O)NCc1c[nH+]c[nH]1 ZINC000878907884 590644982 /nfs/dbraw/zinc/64/49/82/590644982.db2.gz RJIWCVUNGJAZFI-ZWNOBZJWSA-N 1 2 235.331 2.242 20 0 BEADLO CC[C@@H]1CCC[C@@]1(C)C(=O)NCc1c[nH]c[nH+]1 ZINC000878907884 590644985 /nfs/dbraw/zinc/64/49/85/590644985.db2.gz RJIWCVUNGJAZFI-ZWNOBZJWSA-N 1 2 235.331 2.242 20 0 BEADLO COC(=O)[C@](C)(CCF)[NH2+]CCCC1CC1 ZINC000878950907 590659915 /nfs/dbraw/zinc/65/99/15/590659915.db2.gz CRACBYDKIRQMNZ-LBPRGKRZSA-N 1 2 231.311 2.058 20 0 BEADLO C=C/C=C/CC[N@@H+](C)Cc1nnc(C)s1 ZINC000878997567 590672184 /nfs/dbraw/zinc/67/21/84/590672184.db2.gz ACKJBZYNAXITFP-AATRIKPKSA-N 1 2 223.345 2.411 20 0 BEADLO C=C/C=C/CC[N@H+](C)Cc1nnc(C)s1 ZINC000878997567 590672189 /nfs/dbraw/zinc/67/21/89/590672189.db2.gz ACKJBZYNAXITFP-AATRIKPKSA-N 1 2 223.345 2.411 20 0 BEADLO FCCC1CC[NH+](Cc2cnsn2)CC1 ZINC000879210535 590716904 /nfs/dbraw/zinc/71/69/04/590716904.db2.gz DYQFASHVYRPKOM-UHFFFAOYSA-N 1 2 229.324 2.110 20 0 BEADLO Cc1ncc([C@H](C)[NH2+]Cc2cnsn2)s1 ZINC000879252547 590721645 /nfs/dbraw/zinc/72/16/45/590721645.db2.gz TWVFWXUJTSWSCY-LURJTMIESA-N 1 2 240.357 2.154 20 0 BEADLO C[C@H]([NH2+]C/C(Cl)=C/Cl)c1ccnn1C ZINC000879686100 590848792 /nfs/dbraw/zinc/84/87/92/590848792.db2.gz SOPGEAVOUKMHDR-BJMRUTCWSA-N 1 2 234.130 2.390 20 0 BEADLO Cc1cncc([C@H]2CCC[N@@H+]2Cc2cnon2)c1 ZINC000879751080 590861971 /nfs/dbraw/zinc/86/19/71/590861971.db2.gz DNUGRJRWGWOURS-CYBMUJFWSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1cncc([C@H]2CCC[N@H+]2Cc2cnon2)c1 ZINC000879751080 590861976 /nfs/dbraw/zinc/86/19/76/590861976.db2.gz DNUGRJRWGWOURS-CYBMUJFWSA-N 1 2 244.298 2.110 20 0 BEADLO FC(F)(F)[C@H]1CC[N@H+](C/C=C/Cl)CCO1 ZINC000880044908 590914167 /nfs/dbraw/zinc/91/41/67/590914167.db2.gz UUYZTEJJPUFJMQ-YUQHSTNDSA-N 1 2 243.656 2.392 20 0 BEADLO FC(F)(F)[C@H]1CC[N@@H+](C/C=C/Cl)CCO1 ZINC000880044908 590914171 /nfs/dbraw/zinc/91/41/71/590914171.db2.gz UUYZTEJJPUFJMQ-YUQHSTNDSA-N 1 2 243.656 2.392 20 0 BEADLO FC1CC[NH+](Cc2nc(C3CCC3)no2)CC1 ZINC000880238204 590970215 /nfs/dbraw/zinc/97/02/15/590970215.db2.gz AWAFYHJUFKEZEC-UHFFFAOYSA-N 1 2 239.294 2.271 20 0 BEADLO FC[C@H]1CC[N@H+](Cc2nnc(C3CC3)s2)C1 ZINC000880300411 590997141 /nfs/dbraw/zinc/99/71/41/590997141.db2.gz RWIVSLDWLDNORX-MRVPVSSYSA-N 1 2 241.335 2.207 20 0 BEADLO FC[C@H]1CC[N@@H+](Cc2nnc(C3CC3)s2)C1 ZINC000880300411 590997144 /nfs/dbraw/zinc/99/71/44/590997144.db2.gz RWIVSLDWLDNORX-MRVPVSSYSA-N 1 2 241.335 2.207 20 0 BEADLO c1cc(C[NH2+]C2(c3ncccn3)CCC2)sn1 ZINC000880368273 591011308 /nfs/dbraw/zinc/01/13/08/591011308.db2.gz VJWCOQZERIBGPU-UHFFFAOYSA-N 1 2 246.339 2.102 20 0 BEADLO CC[N@H+](Cc1ccon1)[C@H](CO)c1ccccc1 ZINC000880461435 591050874 /nfs/dbraw/zinc/05/08/74/591050874.db2.gz JETPPLHKCIJLHH-CQSZACIVSA-N 1 2 246.310 2.230 20 0 BEADLO CC[N@@H+](Cc1ccon1)[C@H](CO)c1ccccc1 ZINC000880461435 591050879 /nfs/dbraw/zinc/05/08/79/591050879.db2.gz JETPPLHKCIJLHH-CQSZACIVSA-N 1 2 246.310 2.230 20 0 BEADLO OC[C@H]1C=CC[N@@H+]1Cc1ccsc1Cl ZINC000880494969 591074273 /nfs/dbraw/zinc/07/42/73/591074273.db2.gz XEIPEOOLSWRRON-SECBINFHSA-N 1 2 229.732 2.134 20 0 BEADLO OC[C@H]1C=CC[N@H+]1Cc1ccsc1Cl ZINC000880494969 591074277 /nfs/dbraw/zinc/07/42/77/591074277.db2.gz XEIPEOOLSWRRON-SECBINFHSA-N 1 2 229.732 2.134 20 0 BEADLO CCCNc1cc(NCc2ccccn2)nc[nH+]1 ZINC000128609792 591141367 /nfs/dbraw/zinc/14/13/67/591141367.db2.gz YHQUDZFWQJQVSR-UHFFFAOYSA-N 1 2 243.314 2.306 20 0 BEADLO CCCNc1cc(NCc2ccccn2)[nH+]cn1 ZINC000128609792 591141369 /nfs/dbraw/zinc/14/13/69/591141369.db2.gz YHQUDZFWQJQVSR-UHFFFAOYSA-N 1 2 243.314 2.306 20 0 BEADLO CCCNc1cc(NCCCOCC)nc[nH+]1 ZINC000128649366 591145417 /nfs/dbraw/zinc/14/54/17/591145417.db2.gz NRVJBDPQDCHHIA-UHFFFAOYSA-N 1 2 238.335 2.137 20 0 BEADLO CCCNc1cc(NCCCOCC)[nH+]cn1 ZINC000128649366 591145420 /nfs/dbraw/zinc/14/54/20/591145420.db2.gz NRVJBDPQDCHHIA-UHFFFAOYSA-N 1 2 238.335 2.137 20 0 BEADLO CCCNc1cc(NCc2cccnc2)nc[nH+]1 ZINC000128690345 591151219 /nfs/dbraw/zinc/15/12/19/591151219.db2.gz QRNPRCIYQKTQRZ-UHFFFAOYSA-N 1 2 243.314 2.306 20 0 BEADLO CCCNc1cc(NCc2cccnc2)[nH+]cn1 ZINC000128690345 591151223 /nfs/dbraw/zinc/15/12/23/591151223.db2.gz QRNPRCIYQKTQRZ-UHFFFAOYSA-N 1 2 243.314 2.306 20 0 BEADLO OC[C@@H]1CCCC[N@@H+]1C/C(Cl)=C\Cl ZINC000211358098 591161926 /nfs/dbraw/zinc/16/19/26/591161926.db2.gz ZFTQGHTZWGNLIC-QRJSTWQJSA-N 1 2 224.131 2.152 20 0 BEADLO OC[C@@H]1CCCC[N@H+]1C/C(Cl)=C\Cl ZINC000211358098 591161929 /nfs/dbraw/zinc/16/19/29/591161929.db2.gz ZFTQGHTZWGNLIC-QRJSTWQJSA-N 1 2 224.131 2.152 20 0 BEADLO O=C(NC[C@@H]1C=CCC1)c1ccc2[nH+]ccn2c1 ZINC000881491852 591215246 /nfs/dbraw/zinc/21/52/46/591215246.db2.gz BGFJEAKGGBCMRU-LLVKDONJSA-N 1 2 241.294 2.030 20 0 BEADLO C[C@@H](CC(=O)NC[C@]1(C)CC1(C)C)n1cc[nH+]c1 ZINC000881544649 591237167 /nfs/dbraw/zinc/23/71/67/591237167.db2.gz CUPVZHPJWDHKBS-FZMZJTMJSA-N 1 2 249.358 2.387 20 0 BEADLO Cc1[nH+]cnc(NCCCOCC2CC2)c1C ZINC000881776071 591270572 /nfs/dbraw/zinc/27/05/72/591270572.db2.gz YSBOXXRLZBVPQL-UHFFFAOYSA-N 1 2 235.331 2.322 20 0 BEADLO C[C@H](Cc1ccco1)Nc1cc(CO)cc[nH+]1 ZINC000881796894 591271816 /nfs/dbraw/zinc/27/18/16/591271816.db2.gz CHXHQYXABIHPNM-SNVBAGLBSA-N 1 2 232.283 2.210 20 0 BEADLO Cc1[nH+]cnc(NCCOC2CCCC2)c1C ZINC000881822692 591273343 /nfs/dbraw/zinc/27/33/43/591273343.db2.gz UXSBCPMTBBLJPV-UHFFFAOYSA-N 1 2 235.331 2.465 20 0 BEADLO Cc1[nH+]cnc(NCCc2cccc(O)c2)c1C ZINC000881865343 591274951 /nfs/dbraw/zinc/27/49/51/591274951.db2.gz VIQOTBQRFVSAAU-UHFFFAOYSA-N 1 2 243.310 2.454 20 0 BEADLO COCCCCCNc1nc[nH+]c(C)c1C ZINC000881866318 591275222 /nfs/dbraw/zinc/27/52/22/591275222.db2.gz KTUXXKGZKWXVGD-UHFFFAOYSA-N 1 2 223.320 2.322 20 0 BEADLO Cc1[nH+]cnc(NC2CCSCC2)c1C ZINC000881878777 591275823 /nfs/dbraw/zinc/27/58/23/591275823.db2.gz OGCRQEVEEYQPNC-UHFFFAOYSA-N 1 2 223.345 2.401 20 0 BEADLO Cc1nn(C)c(C)c1CNc1nc[nH+]c(C)c1C ZINC000881879492 591275845 /nfs/dbraw/zinc/27/58/45/591275845.db2.gz OHZFQLATRKHSPM-UHFFFAOYSA-N 1 2 245.330 2.056 20 0 BEADLO Cc1[nH+]cnc(NC[C@H](O)C2CCCCC2)c1C ZINC000881913195 591278063 /nfs/dbraw/zinc/27/80/63/591278063.db2.gz ZHPZSHUZFSPDQT-ZDUSSCGKSA-N 1 2 249.358 2.447 20 0 BEADLO Cc1[nH+]cnc(NCc2cccc(CO)c2)c1C ZINC000881923891 591278826 /nfs/dbraw/zinc/27/88/26/591278826.db2.gz UEPKTNUZRGKGAC-UHFFFAOYSA-N 1 2 243.310 2.198 20 0 BEADLO CCCOC(=O)CCNc1cc(C2CC2)[nH+]cn1 ZINC000881951939 591283651 /nfs/dbraw/zinc/28/36/51/591283651.db2.gz CSLFLENOQFFQJU-UHFFFAOYSA-N 1 2 249.314 2.109 20 0 BEADLO Cc1[nH+]cnc(N2CC(C(F)(F)F)C2)c1C ZINC000882084394 591295458 /nfs/dbraw/zinc/29/54/58/591295458.db2.gz LRELVWAKHSNLEG-UHFFFAOYSA-N 1 2 231.221 2.092 20 0 BEADLO CS[C@@H](C)CNc1nc[nH+]c(C)c1C ZINC000882128208 591302543 /nfs/dbraw/zinc/30/25/43/591302543.db2.gz WBMZUKAOILHXSJ-ZETCQYMHSA-N 1 2 211.334 2.257 20 0 BEADLO Cc1[nH+]cnc(N2CC[C@H](C3CC3)C2)c1C ZINC000882144031 591305583 /nfs/dbraw/zinc/30/55/83/591305583.db2.gz AMTBHDIWIAWTLE-LBPRGKRZSA-N 1 2 217.316 2.330 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2CCO[C@@H](C)C2)c1C ZINC000882154338 591307895 /nfs/dbraw/zinc/30/78/95/591307895.db2.gz YKEDERMAPFIFBA-GZMMTYOYSA-N 1 2 221.304 2.073 20 0 BEADLO COCC1(C)CCN(c2nc[nH+]c(C)c2C)CC1 ZINC000882158375 591308189 /nfs/dbraw/zinc/30/81/89/591308189.db2.gz XQUJRGXJAYEKFQ-UHFFFAOYSA-N 1 2 249.358 2.346 20 0 BEADLO Cc1[nH+]cnc(NCC2([C@@H](O)C(C)C)CC2)c1C ZINC000882161577 591309162 /nfs/dbraw/zinc/30/91/62/591309162.db2.gz KLIYSMDUIQQSCB-LBPRGKRZSA-N 1 2 249.358 2.302 20 0 BEADLO COc1ccc(CNc2nc[nH+]c(C)c2C)nc1 ZINC000882268648 591322947 /nfs/dbraw/zinc/32/29/47/591322947.db2.gz DAYRMRNFGUUGDB-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO Cc1[nH+]cnc(NC[C@H]2CCOC[C@H]2C)c1C ZINC000882353752 591336339 /nfs/dbraw/zinc/33/63/39/591336339.db2.gz VGCBWQMFKBWXOK-BXKDBHETSA-N 1 2 235.331 2.178 20 0 BEADLO CC1(C)CC[C@@H]1Nc1cc(CO)cc[nH+]1 ZINC000882363683 591338289 /nfs/dbraw/zinc/33/82/89/591338289.db2.gz JAGGZILLMBCVBF-JTQLQIEISA-N 1 2 206.289 2.174 20 0 BEADLO CCc1nnc(CNc2nc[nH+]c(C)c2C)s1 ZINC000882385058 591340935 /nfs/dbraw/zinc/34/09/35/591340935.db2.gz ACVZUZNFFRRZCH-UHFFFAOYSA-N 1 2 249.343 2.119 20 0 BEADLO COc1cc[nH+]cc1CNc1ncnc(C)c1C ZINC000882398260 591342151 /nfs/dbraw/zinc/34/21/51/591342151.db2.gz ZOVZGKCAQZOVNB-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO Cc1[nH+]cnc(NC[C@]2(O)CCC[C@H]2C)c1C ZINC000882402985 591343417 /nfs/dbraw/zinc/34/34/17/591343417.db2.gz DDPNOBAFEBGDPS-NOZJJQNGSA-N 1 2 235.331 2.056 20 0 BEADLO COc1cccnc1CNc1nc[nH+]c(C)c1C ZINC000882432162 591347948 /nfs/dbraw/zinc/34/79/48/591347948.db2.gz CVYPOYRFBAYLMP-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2CC[C@@H](C)O2)c1C ZINC000882438459 591349093 /nfs/dbraw/zinc/34/90/93/591349093.db2.gz FRBQIANGCZWMHB-KCJUWKMLSA-N 1 2 221.304 2.073 20 0 BEADLO COC1CCC(Nc2nc[nH+]c(C)c2C)CC1 ZINC000882441611 591349440 /nfs/dbraw/zinc/34/94/40/591349440.db2.gz BWQXFQPYWLBPJL-UHFFFAOYSA-N 1 2 235.331 2.463 20 0 BEADLO CCN(CCSC)c1nc[nH+]c(C)c1C ZINC000882518480 591381360 /nfs/dbraw/zinc/38/13/60/591381360.db2.gz CLKZLFNMRVDZJI-UHFFFAOYSA-N 1 2 225.361 2.283 20 0 BEADLO Cc1[nH+]cnc(N[C@@H](C)c2cnccn2)c1C ZINC000882569411 591391534 /nfs/dbraw/zinc/39/15/34/591391534.db2.gz GZAPAVIFQYPNIE-JTQLQIEISA-N 1 2 229.287 2.057 20 0 BEADLO Cc1nc(NC2CSC2)c2c([nH+]1)CCCC2 ZINC000882626261 591402643 /nfs/dbraw/zinc/40/26/43/591402643.db2.gz WRHWKESZYDUSFV-UHFFFAOYSA-N 1 2 235.356 2.191 20 0 BEADLO CC(C)(Nc1ncnc2c1CCC2)c1[nH]cc[nH+]1 ZINC000882626781 591402768 /nfs/dbraw/zinc/40/27/68/591402768.db2.gz UPEZMALSZFZTBJ-UHFFFAOYSA-N 1 2 243.314 2.036 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2CO[C@H](C3CC3)C2)c1C ZINC000882662909 591407934 /nfs/dbraw/zinc/40/79/34/591407934.db2.gz HERWBTOBRMRZSI-RYUDHWBXSA-N 1 2 233.315 2.073 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2[C@H](C)O[C@@H](C)[C@H]2C)c1C ZINC000882660416 591408042 /nfs/dbraw/zinc/40/80/42/591408042.db2.gz SCKGOMMCSZHCGE-QTKMDUPCSA-N 1 2 235.331 2.317 20 0 BEADLO CSC1CCN(c2nc[nH+]c(C)c2C)CC1 ZINC000882674761 591408651 /nfs/dbraw/zinc/40/86/51/591408651.db2.gz FPXOUPOLYIZDJV-UHFFFAOYSA-N 1 2 237.372 2.425 20 0 BEADLO Cc1cnc(C)c(Nc2c[nH+]cc(N(C)C)c2)n1 ZINC000882679209 591410483 /nfs/dbraw/zinc/41/04/83/591410483.db2.gz SZMUCLBFJNKBRI-UHFFFAOYSA-N 1 2 243.314 2.298 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2C[C@H](C)O[C@@H]2C)c1C ZINC000882682126 591411380 /nfs/dbraw/zinc/41/13/80/591411380.db2.gz VSQHNKAVGUAJBX-WHGOUJPWSA-N 1 2 221.304 2.071 20 0 BEADLO Fc1c[nH+]ccc1N[C@H]1CCCC[C@H]1F ZINC000882681724 591411759 /nfs/dbraw/zinc/41/17/59/591411759.db2.gz QRTFYZUMPXNRSZ-SCZZXKLOSA-N 1 2 212.243 2.335 20 0 BEADLO Cc1[nH+]cnc(N2CCC(C(C)(C)O)CC2)c1C ZINC000882704365 591414589 /nfs/dbraw/zinc/41/45/89/591414589.db2.gz YDTAEHMCLPEKHL-UHFFFAOYSA-N 1 2 249.358 2.081 20 0 BEADLO COc1c(C)[nH+]cnc1NC[C@H]1C=CCC1 ZINC000882756363 591430631 /nfs/dbraw/zinc/43/06/31/591430631.db2.gz ZFADIMFDBNMQFC-JTQLQIEISA-N 1 2 219.288 2.172 20 0 BEADLO Cc1ccc(NC(=S)NC(C)C)c(C)[nH+]1 ZINC000130103929 591438027 /nfs/dbraw/zinc/43/80/27/591438027.db2.gz YJSHGBVCBZLDJD-UHFFFAOYSA-N 1 2 223.345 2.393 20 0 BEADLO Cc1ccc(NC(=S)NC2CC2)c(C)[nH+]1 ZINC000130102792 591438204 /nfs/dbraw/zinc/43/82/04/591438204.db2.gz KXHGAWFRQBKQNR-UHFFFAOYSA-N 1 2 221.329 2.147 20 0 BEADLO CC1(C)C[C@@]1(C)CNc1cc(CO)cc[nH+]1 ZINC000882784097 591439287 /nfs/dbraw/zinc/43/92/87/591439287.db2.gz STXMDIAEVGJILM-ZDUSSCGKSA-N 1 2 220.316 2.422 20 0 BEADLO FC[C@@H]1CCN(c2cc[nH+]c3ccncc32)C1 ZINC000882840771 591450734 /nfs/dbraw/zinc/45/07/34/591450734.db2.gz DSILMUKAEIDWFV-JTQLQIEISA-N 1 2 231.274 2.426 20 0 BEADLO FC[C@@H]1CCN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000882841742 591452111 /nfs/dbraw/zinc/45/21/11/591452111.db2.gz DKZMWJNWRARPCI-VIFPVBQESA-N 1 2 221.279 2.150 20 0 BEADLO CO[C@]1(C(F)(F)F)CCN(c2cccc[nH+]2)C1 ZINC000882847213 591454860 /nfs/dbraw/zinc/45/48/60/591454860.db2.gz DOIWAFGBUUKNPK-SNVBAGLBSA-N 1 2 246.232 2.239 20 0 BEADLO C=C/C=C\CCO[NH+]=C(N)COC(C)C ZINC000882960879 591487161 /nfs/dbraw/zinc/48/71/61/591487161.db2.gz YKESWYKLLLPLFO-WAYWQWQTSA-N 1 2 212.293 2.042 20 0 BEADLO Fc1c[nH+]ccc1NC1CCC2(COC2)CC1 ZINC000882994494 591499509 /nfs/dbraw/zinc/49/95/09/591499509.db2.gz IMCGUHFCTQCTTK-UHFFFAOYSA-N 1 2 236.290 2.014 20 0 BEADLO C[C@H](Nc1[nH+]cnc2[nH]c(Cl)cc21)C(F)F ZINC000883018848 591516687 /nfs/dbraw/zinc/51/66/87/591516687.db2.gz QXEBPMSDXWBHDZ-BYPYZUCNSA-N 1 2 246.648 2.099 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NCc1cc(C)on1 ZINC000883135567 591548640 /nfs/dbraw/zinc/54/86/40/591548640.db2.gz HNLNPOBZXPXGPZ-SNVBAGLBSA-N 1 2 234.303 2.050 20 0 BEADLO CCC[C@H](C)CNc1cc(CO)cc[nH+]1 ZINC000883147572 591552288 /nfs/dbraw/zinc/55/22/88/591552288.db2.gz ADGVVNLCHZFFEE-JTQLQIEISA-N 1 2 208.305 2.422 20 0 BEADLO CCOCCSCc1cc[nH+]c(N(C)C)c1 ZINC000131199939 591567650 /nfs/dbraw/zinc/56/76/50/591567650.db2.gz DMDVIBABERVOLM-UHFFFAOYSA-N 1 2 240.372 2.417 20 0 BEADLO Cc1cc(NC2CCOCC2)c[nH+]c1C ZINC000883340914 591617182 /nfs/dbraw/zinc/61/71/82/591617182.db2.gz CMMSAGCFDKXNNM-UHFFFAOYSA-N 1 2 206.289 2.289 20 0 BEADLO Cc1cc(N[C@@H]2CO[C@H](C)C2)c[nH+]c1C ZINC000883341142 591620043 /nfs/dbraw/zinc/62/00/43/591620043.db2.gz JGLGUARVEAVUQX-SKDRFNHKSA-N 1 2 206.289 2.288 20 0 BEADLO Cc1c[nH]nc1CNc1c[nH+]c(C)c(C)c1 ZINC000883341803 591620231 /nfs/dbraw/zinc/62/02/31/591620231.db2.gz ZSFJEALFGZQLTG-UHFFFAOYSA-N 1 2 216.288 2.342 20 0 BEADLO COC(=O)[C@@H]1C[C@H]1[C@H](C)Nc1c[nH+]c(C)c(C)c1 ZINC000883341453 591620302 /nfs/dbraw/zinc/62/03/02/591620302.db2.gz QGRYUXIFSIXMPH-WCFLWFBJSA-N 1 2 248.326 2.308 20 0 BEADLO CCn1nnc(C)c1CNc1c[nH+]c(C)c(C)c1 ZINC000883341804 591620330 /nfs/dbraw/zinc/62/03/30/591620330.db2.gz ZWBHDHGIAVRUDA-UHFFFAOYSA-N 1 2 245.330 2.230 20 0 BEADLO Cc1cc(N[C@@H](C)c2ccc(=O)[nH]n2)c[nH+]c1C ZINC000883342594 591622251 /nfs/dbraw/zinc/62/22/51/591622251.db2.gz FIQNPFVVVTVHPC-JTQLQIEISA-N 1 2 244.298 2.367 20 0 BEADLO C[C@@H]([NH2+]Cc1ccc(Cl)nc1)C(F)F ZINC000883407058 591650203 /nfs/dbraw/zinc/65/02/03/591650203.db2.gz JSRYFVKYKXFMMQ-ZCFIWIBFSA-N 1 2 220.650 2.478 20 0 BEADLO Cc1[nH]c(CNc2nn(C)cc2Cl)[nH+]c1C ZINC000883372698 591634916 /nfs/dbraw/zinc/63/49/16/591634916.db2.gz KORXSQSJILZJJM-UHFFFAOYSA-N 1 2 239.710 2.026 20 0 BEADLO C[C@@H]([NH2+]Cc1ccc2c[nH]nc2c1)C(F)F ZINC000883407320 591651869 /nfs/dbraw/zinc/65/18/69/591651869.db2.gz RRHSWPMQVQIUIM-SSDOTTSWSA-N 1 2 225.242 2.306 20 0 BEADLO C[C@H]1CCC[C@@H](C(=O)NC2=[NH+]CCS2)C1 ZINC000133416281 591789723 /nfs/dbraw/zinc/78/97/23/591789723.db2.gz IUBAGXSZVLNGTC-DTWKUNHWSA-N 1 2 226.345 2.032 20 0 BEADLO C[C@H]1CCC[C@H](C(=O)NC2=[NH+]CCS2)C1 ZINC000133415838 591790406 /nfs/dbraw/zinc/79/04/06/591790406.db2.gz IUBAGXSZVLNGTC-IUCAKERBSA-N 1 2 226.345 2.032 20 0 BEADLO CCn1cc(C[N@H+](C)[C@H](C)c2ccco2)nn1 ZINC000883999140 591790529 /nfs/dbraw/zinc/79/05/29/591790529.db2.gz HHWGMIDWBZHNGD-SNVBAGLBSA-N 1 2 234.303 2.084 20 0 BEADLO CCn1cc(C[N@@H+](C)[C@H](C)c2ccco2)nn1 ZINC000883999140 591790533 /nfs/dbraw/zinc/79/05/33/591790533.db2.gz HHWGMIDWBZHNGD-SNVBAGLBSA-N 1 2 234.303 2.084 20 0 BEADLO CCCNc1cc(N[C@H](CC)COC)nc[nH+]1 ZINC000134147137 591893885 /nfs/dbraw/zinc/89/38/85/591893885.db2.gz DTVMFXYQUAWECT-SNVBAGLBSA-N 1 2 238.335 2.135 20 0 BEADLO CCCNc1cc(N[C@H](CC)COC)[nH+]cn1 ZINC000134147137 591893887 /nfs/dbraw/zinc/89/38/87/591893887.db2.gz DTVMFXYQUAWECT-SNVBAGLBSA-N 1 2 238.335 2.135 20 0 BEADLO Cc1cc(C[NH2+]Cc2nnc(C)s2)c(C)o1 ZINC000134663558 591946582 /nfs/dbraw/zinc/94/65/82/591946582.db2.gz IGKQDZHEQPCWKH-UHFFFAOYSA-N 1 2 237.328 2.346 20 0 BEADLO CCc1nc(N2CCS[C@H](C)CC2)cc[nH+]1 ZINC000884485718 591954327 /nfs/dbraw/zinc/95/43/27/591954327.db2.gz FNMZRDKMKIXHCS-SNVBAGLBSA-N 1 2 237.372 2.371 20 0 BEADLO CCc1nc(NCC2(SC)CC2)cc[nH+]1 ZINC000884489988 591954731 /nfs/dbraw/zinc/95/47/31/591954731.db2.gz LKVQCSXCFUVSDC-UHFFFAOYSA-N 1 2 223.345 2.347 20 0 BEADLO CCc1nc(N2CCC[C@@H]2c2cc[nH]n2)cc[nH+]1 ZINC000884489373 591954801 /nfs/dbraw/zinc/95/48/01/591954801.db2.gz WTJZCKZRYMESFA-LLVKDONJSA-N 1 2 243.314 2.104 20 0 BEADLO CCc1nc(N2CCC[C@H]2c2cc[nH]n2)cc[nH+]1 ZINC000884489374 591955029 /nfs/dbraw/zinc/95/50/29/591955029.db2.gz WTJZCKZRYMESFA-NSHDSACASA-N 1 2 243.314 2.104 20 0 BEADLO CCc1nc(NC(C)(C)C(F)F)cc[nH+]1 ZINC000884492112 591956327 /nfs/dbraw/zinc/95/63/27/591956327.db2.gz NCRONBFKKWBRCR-UHFFFAOYSA-N 1 2 215.247 2.495 20 0 BEADLO CCc1nc(N2CC[C@H](C(F)F)C2)cc[nH+]1 ZINC000884497245 591957295 /nfs/dbraw/zinc/95/72/95/591957295.db2.gz SXFPNPHFGSAKOH-QMMMGPOBSA-N 1 2 227.258 2.130 20 0 BEADLO CCc1nc(N[C@H](CC)C(C)(C)O)cc[nH+]1 ZINC000884516602 591962734 /nfs/dbraw/zinc/96/27/34/591962734.db2.gz OMPXGTAEXHLSKT-SECBINFHSA-N 1 2 223.320 2.000 20 0 BEADLO CCc1nc(N2CC[C@H]2C2CC2)cc[nH+]1 ZINC000884518845 591964072 /nfs/dbraw/zinc/96/40/72/591964072.db2.gz BIZOXJWZMMTAJO-JTQLQIEISA-N 1 2 203.289 2.028 20 0 BEADLO CCc1nc(NCCc2scnc2C)cc[nH+]1 ZINC000884520094 591965013 /nfs/dbraw/zinc/96/50/13/591965013.db2.gz MGXJUWGSBKZQPZ-UHFFFAOYSA-N 1 2 248.355 2.459 20 0 BEADLO CCc1nc(NCc2ncccc2OC)cc[nH+]1 ZINC000884525615 591965823 /nfs/dbraw/zinc/96/58/23/591965823.db2.gz ZMFSVVPXNFRSRC-UHFFFAOYSA-N 1 2 244.298 2.055 20 0 BEADLO CCc1nc(N2CCC[C@@H](COC)CC2)cc[nH+]1 ZINC000884525587 591965952 /nfs/dbraw/zinc/96/59/52/591965952.db2.gz YXJIJPXWDGTEGZ-GFCCVEGCSA-N 1 2 249.358 2.292 20 0 BEADLO CCc1nc(N[C@H]2C[C@H](C)n3ccnc32)cc[nH+]1 ZINC000884522634 591965957 /nfs/dbraw/zinc/96/59/57/591965957.db2.gz DEOLGYVIXIWVLG-UWVGGRQHSA-N 1 2 243.314 2.353 20 0 BEADLO CCc1ncc(CNc2cc[nH+]c(CC)n2)o1 ZINC000884523514 591965991 /nfs/dbraw/zinc/96/59/91/591965991.db2.gz YXWXXHWCWXKWAM-UHFFFAOYSA-N 1 2 232.287 2.202 20 0 BEADLO CCc1nc(N[C@@H]2C[C@H](OC)C23CCC3)cc[nH+]1 ZINC000884528679 591967814 /nfs/dbraw/zinc/96/78/14/591967814.db2.gz WHLIYOGWWOKMHV-MNOVXSKESA-N 1 2 247.342 2.409 20 0 BEADLO CCc1nc(N[C@@H]2CS[C@@H](C)C2)cc[nH+]1 ZINC000884530749 591968833 /nfs/dbraw/zinc/96/88/33/591968833.db2.gz SKVRNFRTHIOAGP-IUCAKERBSA-N 1 2 223.345 2.345 20 0 BEADLO CCc1nc(N2Cc3ccc(O)cc3C2)cc[nH+]1 ZINC000884535074 591970468 /nfs/dbraw/zinc/97/04/68/591970468.db2.gz VPRSPUYFAAYMJR-UHFFFAOYSA-N 1 2 241.294 2.265 20 0 BEADLO CCc1nc(NCc2ccc(C)cn2)cc[nH+]1 ZINC000884542769 591973621 /nfs/dbraw/zinc/97/36/21/591973621.db2.gz MBEGJCPVZTZCNZ-UHFFFAOYSA-N 1 2 228.299 2.355 20 0 BEADLO CCc1nc(N[C@@H]2CCCC[C@H]2OC)cc[nH+]1 ZINC000884544773 591974260 /nfs/dbraw/zinc/97/42/60/591974260.db2.gz PCUDFPXBTOAHJP-GHMZBOCLSA-N 1 2 235.331 2.409 20 0 BEADLO CCc1nc(NCC[C@H]2CCCOC2)cc[nH+]1 ZINC000884562761 591981477 /nfs/dbraw/zinc/98/14/77/591981477.db2.gz JWRKEAFLJYCMOY-LLVKDONJSA-N 1 2 235.331 2.268 20 0 BEADLO CCc1nc(N[C@@H]2C[C@@H](C)O[C@@H]2C)cc[nH+]1 ZINC000884570713 591982737 /nfs/dbraw/zinc/98/27/37/591982737.db2.gz WQIOLNLCQUOGSL-OPRDCNLKSA-N 1 2 221.304 2.017 20 0 BEADLO CCc1nc(N(C)CC(O)(CC)CC)cc[nH+]1 ZINC000884567638 591983519 /nfs/dbraw/zinc/98/35/19/591983519.db2.gz OFTUCTXXMOHUJP-UHFFFAOYSA-N 1 2 237.347 2.026 20 0 BEADLO CCc1nc(N2CC[C@@H]3CSC[C@H]3C2)cc[nH+]1 ZINC000884573902 591984386 /nfs/dbraw/zinc/98/43/86/591984386.db2.gz XFDLALCOGFMQCZ-GHMZBOCLSA-N 1 2 249.383 2.228 20 0 BEADLO CCc1nc(N[C@H](CC)C[C@@H](C)O)cc[nH+]1 ZINC000884575926 591985029 /nfs/dbraw/zinc/98/50/29/591985029.db2.gz WDRALJXMHAESJL-NXEZZACHSA-N 1 2 223.320 2.000 20 0 BEADLO CCc1nc(N[C@H]2CCCn3nccc32)cc[nH+]1 ZINC000884576051 591985246 /nfs/dbraw/zinc/98/52/46/591985246.db2.gz YTAOMPHMYRDKAT-JTQLQIEISA-N 1 2 243.314 2.183 20 0 BEADLO CCc1nc(NC[C@@H]2C[C@@H]3CCC[C@H]3O2)cc[nH+]1 ZINC000884579213 591986512 /nfs/dbraw/zinc/98/65/12/591986512.db2.gz UIZOQZHDHHNBSU-SDDRHHMPSA-N 1 2 247.342 2.409 20 0 BEADLO Cc1cc(NCc2cc(C3CC3)no2)nc[nH+]1 ZINC000884637591 591999644 /nfs/dbraw/zinc/99/96/44/591999644.db2.gz TWKXHMNYDZIUJG-UHFFFAOYSA-N 1 2 230.271 2.263 20 0 BEADLO COc1ccc(N[C@H](C)c2ncco2)[nH+]c1 ZINC000884639804 592000379 /nfs/dbraw/zinc/00/03/79/592000379.db2.gz KUVSQBDBMDTCIT-MRVPVSSYSA-N 1 2 219.244 2.251 20 0 BEADLO CC(C)c1nc(N2C[C@@H]3CSC[C@@H]3C2)cc[nH+]1 ZINC000884645419 592001791 /nfs/dbraw/zinc/00/17/91/592001791.db2.gz GAQUUPMCDGVWBI-PHIMTYICSA-N 1 2 249.383 2.399 20 0 BEADLO CCc1cc(NC[C@H]2CC3(CCC3)CO2)nc[nH+]1 ZINC000884660248 592006091 /nfs/dbraw/zinc/00/60/91/592006091.db2.gz ODMLOCXPEUTSRX-GFCCVEGCSA-N 1 2 247.342 2.410 20 0 BEADLO C[C@@H]1C[C@]2(CC[C@@H](CNc3cccc[nH+]3)O2)CO1 ZINC000884698296 592012223 /nfs/dbraw/zinc/01/22/23/592012223.db2.gz LWGMUFXFUICLLF-MBNYWOFBSA-N 1 2 248.326 2.220 20 0 BEADLO C[C@@H]1C[C@]2(CC[C@H](CNc3cccc[nH+]3)O2)CO1 ZINC000884698297 592012956 /nfs/dbraw/zinc/01/29/56/592012956.db2.gz LWGMUFXFUICLLF-YRGRVCCFSA-N 1 2 248.326 2.220 20 0 BEADLO COC[C@@H]([NH2+]Cc1[nH]nc(C)c1C)c1ccco1 ZINC000886007940 592129068 /nfs/dbraw/zinc/12/90/68/592129068.db2.gz CDXLDKDREWKJDZ-GFCCVEGCSA-N 1 2 249.314 2.097 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NCC1CCC=CCC1 ZINC000886017611 592132192 /nfs/dbraw/zinc/13/21/92/592132192.db2.gz HYQJGSMNLZJYHT-UHFFFAOYSA-N 1 2 247.342 2.205 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NCC1CCC=CCC1 ZINC000886017611 592132195 /nfs/dbraw/zinc/13/21/95/592132195.db2.gz HYQJGSMNLZJYHT-UHFFFAOYSA-N 1 2 247.342 2.205 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccc(Cl)cn2)ncn1 ZINC000886046050 592140352 /nfs/dbraw/zinc/14/03/52/592140352.db2.gz AHDXHVVWPXWFKV-UHFFFAOYSA-N 1 2 248.717 2.123 20 0 BEADLO Cc1n[nH]c(C[NH2+]C(C)(C)C(F)F)c1C ZINC000886100519 592154233 /nfs/dbraw/zinc/15/42/33/592154233.db2.gz PDNVFNHBACYCAA-UHFFFAOYSA-N 1 2 217.263 2.160 20 0 BEADLO Cc1coc(C[NH2+][C@@H](c2nncn2C)C(C)C)c1 ZINC000886114141 592156639 /nfs/dbraw/zinc/15/66/39/592156639.db2.gz HVMZKKWKINVQDU-GFCCVEGCSA-N 1 2 248.330 2.203 20 0 BEADLO Cc1coc(CNc2ccc(CO)c[nH+]2)c1 ZINC000886118945 592158105 /nfs/dbraw/zinc/15/81/05/592158105.db2.gz UEVDFYGHDZGPMD-UHFFFAOYSA-N 1 2 218.256 2.087 20 0 BEADLO OC[C@@H]1CC(F)(F)C[N@@H+]1CC[C@@H]1C[C@H]1C1CC1 ZINC000886157646 592165422 /nfs/dbraw/zinc/16/54/22/592165422.db2.gz HMUQFGGIFQKGIL-WOPDTQHZSA-N 1 2 245.313 2.125 20 0 BEADLO OC[C@@H]1CC(F)(F)C[N@H+]1CC[C@@H]1C[C@H]1C1CC1 ZINC000886157646 592165424 /nfs/dbraw/zinc/16/54/24/592165424.db2.gz HMUQFGGIFQKGIL-WOPDTQHZSA-N 1 2 245.313 2.125 20 0 BEADLO c1cc2c(cn1)C[N@H+](C[C@H]1CC[C@@H](C3CC3)O1)C2 ZINC000886203524 592174963 /nfs/dbraw/zinc/17/49/63/592174963.db2.gz XEILHSZPURKDRN-CABCVRRESA-N 1 2 244.338 2.355 20 0 BEADLO c1cc2c(cn1)C[N@@H+](C[C@H]1CC[C@@H](C3CC3)O1)C2 ZINC000886203524 592174964 /nfs/dbraw/zinc/17/49/64/592174964.db2.gz XEILHSZPURKDRN-CABCVRRESA-N 1 2 244.338 2.355 20 0 BEADLO Cc1[nH]c(CNCc2cc(C3CC3)no2)[nH+]c1C ZINC000886268834 592190603 /nfs/dbraw/zinc/19/06/03/592190603.db2.gz CMHZCUCEIKQZSR-UHFFFAOYSA-N 1 2 246.314 2.182 20 0 BEADLO CCn1nc(C)c(C[NH2+][C@@H](C)c2ncco2)c1C ZINC000886273684 592193491 /nfs/dbraw/zinc/19/34/91/592193491.db2.gz DWLYEAOWSVABJI-JTQLQIEISA-N 1 2 248.330 2.359 20 0 BEADLO CCn1c[nH+]c2c1CCN(C(=O)C(C)(C)CC)C2 ZINC000886623060 592279272 /nfs/dbraw/zinc/27/92/72/592279272.db2.gz RDVFLHCVWGBUDS-UHFFFAOYSA-N 1 2 249.358 2.224 20 0 BEADLO CCC(CC)C(=O)N1CCc2c([nH+]cn2CC)C1 ZINC000886625846 592280685 /nfs/dbraw/zinc/28/06/85/592280685.db2.gz BXTASHYELVCPOW-UHFFFAOYSA-N 1 2 249.358 2.224 20 0 BEADLO COC(=O)[C@H]1CC[C@H](Nc2c[nH+]c(C)c(C)c2)C1 ZINC000886651770 592291026 /nfs/dbraw/zinc/29/10/26/592291026.db2.gz QOSNVBOFRAPQEO-RYUDHWBXSA-N 1 2 248.326 2.452 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cc(C)on2)CCS1 ZINC000076073602 592315090 /nfs/dbraw/zinc/31/50/90/592315090.db2.gz AHGSHZYBJJITRM-NSHDSACASA-N 1 2 226.345 2.310 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cc(C)on2)CCS1 ZINC000076073602 592315091 /nfs/dbraw/zinc/31/50/91/592315091.db2.gz AHGSHZYBJJITRM-NSHDSACASA-N 1 2 226.345 2.310 20 0 BEADLO CC[NH2+][C@H](Cc1cc2ccccc2o1)C(=O)OC ZINC000886938121 592399246 /nfs/dbraw/zinc/39/92/46/592399246.db2.gz FMHAMJNLHRKHES-GFCCVEGCSA-N 1 2 247.294 2.126 20 0 BEADLO FC(F)CN(CCn1cc[nH+]c1)C1CCC1 ZINC000887100600 592441297 /nfs/dbraw/zinc/44/12/97/592441297.db2.gz IZMVPOVRLQXIJV-UHFFFAOYSA-N 1 2 229.274 2.003 20 0 BEADLO CO[C@H](C)C[N@H+](CC(F)F)C1CCC1 ZINC000887102594 592442527 /nfs/dbraw/zinc/44/25/27/592442527.db2.gz WQTBYGJKQNYKCP-MRVPVSSYSA-N 1 2 207.264 2.141 20 0 BEADLO CO[C@H](C)C[N@@H+](CC(F)F)C1CCC1 ZINC000887102594 592442529 /nfs/dbraw/zinc/44/25/29/592442529.db2.gz WQTBYGJKQNYKCP-MRVPVSSYSA-N 1 2 207.264 2.141 20 0 BEADLO CO[C@@H](C)C[N@H+](CC(F)F)C1CCC1 ZINC000887102595 592442914 /nfs/dbraw/zinc/44/29/14/592442914.db2.gz WQTBYGJKQNYKCP-QMMMGPOBSA-N 1 2 207.264 2.141 20 0 BEADLO CO[C@@H](C)C[N@@H+](CC(F)F)C1CCC1 ZINC000887102595 592442917 /nfs/dbraw/zinc/44/29/17/592442917.db2.gz WQTBYGJKQNYKCP-QMMMGPOBSA-N 1 2 207.264 2.141 20 0 BEADLO CC1(C)OC[C@H](C[N@H+](CC(F)F)C2CCC2)O1 ZINC000887102307 592442923 /nfs/dbraw/zinc/44/29/23/592442923.db2.gz KXBFWQVCVHERAU-JTQLQIEISA-N 1 2 249.301 2.258 20 0 BEADLO CC1(C)OC[C@H](C[N@@H+](CC(F)F)C2CCC2)O1 ZINC000887102307 592442927 /nfs/dbraw/zinc/44/29/27/592442927.db2.gz KXBFWQVCVHERAU-JTQLQIEISA-N 1 2 249.301 2.258 20 0 BEADLO CC(C)[C@@H](O)C[N@H+](CC(F)F)C1CCC1 ZINC000887102450 592443538 /nfs/dbraw/zinc/44/35/38/592443538.db2.gz QFGAMIXBIXZQLJ-JTQLQIEISA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)[C@@H](O)C[N@@H+](CC(F)F)C1CCC1 ZINC000887102450 592443540 /nfs/dbraw/zinc/44/35/40/592443540.db2.gz QFGAMIXBIXZQLJ-JTQLQIEISA-N 1 2 221.291 2.123 20 0 BEADLO C[N@H+](CCCF)Cc1nnc(C(C)(C)C)o1 ZINC000887136340 592451309 /nfs/dbraw/zinc/45/13/09/592451309.db2.gz QKPCOKJBHYSXMV-UHFFFAOYSA-N 1 2 229.299 2.159 20 0 BEADLO C[N@@H+](CCCF)Cc1nnc(C(C)(C)C)o1 ZINC000887136340 592451310 /nfs/dbraw/zinc/45/13/10/592451310.db2.gz QKPCOKJBHYSXMV-UHFFFAOYSA-N 1 2 229.299 2.159 20 0 BEADLO C[N@H+](CCCF)Cc1nncn1-c1ccccc1 ZINC000887141248 592456423 /nfs/dbraw/zinc/45/64/23/592456423.db2.gz KXDNYAFTNBSFGE-UHFFFAOYSA-N 1 2 248.305 2.059 20 0 BEADLO C[N@@H+](CCCF)Cc1nncn1-c1ccccc1 ZINC000887141248 592456424 /nfs/dbraw/zinc/45/64/24/592456424.db2.gz KXDNYAFTNBSFGE-UHFFFAOYSA-N 1 2 248.305 2.059 20 0 BEADLO CC[NH2+]Cc1noc(CCC(C)(C)C)n1 ZINC000300779515 592519780 /nfs/dbraw/zinc/51/97/80/592519780.db2.gz PWGSLTOXHOVCKC-UHFFFAOYSA-N 1 2 211.309 2.158 20 0 BEADLO C[C@@H]1[C@@H](C)CN1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000887801674 592553362 /nfs/dbraw/zinc/55/33/62/592553362.db2.gz QJRHDSZUIHBQCL-VHSXEESVSA-N 1 2 244.298 2.206 20 0 BEADLO CC1=CC[C@](C)(C(=O)NCc2cn(C)c[nH+]2)CC1 ZINC000890103651 592679837 /nfs/dbraw/zinc/67/98/37/592679837.db2.gz OELRKKGTTRKLSF-AWEZNQCLSA-N 1 2 247.342 2.173 20 0 BEADLO CC(C)CCCCC(=O)NCc1cn(C)c[nH+]1 ZINC000890105072 592681276 /nfs/dbraw/zinc/68/12/76/592681276.db2.gz WBLYHFHJNUWTIX-UHFFFAOYSA-N 1 2 237.347 2.253 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1C[C@H](C)CO1 ZINC000890492713 592703187 /nfs/dbraw/zinc/70/31/87/592703187.db2.gz PSFDQPYPVRHXIX-GZMMTYOYSA-N 1 2 234.299 2.062 20 0 BEADLO N#CCC[N@@H+](Cc1ccoc1)CC1CC1 ZINC000093091538 634460266 /nfs/dbraw/zinc/46/02/66/634460266.db2.gz BOMJXGJUPOLNHX-UHFFFAOYSA-N 1 2 204.273 2.405 20 0 BEADLO N#CCC[N@H+](Cc1ccoc1)CC1CC1 ZINC000093091538 634460270 /nfs/dbraw/zinc/46/02/70/634460270.db2.gz BOMJXGJUPOLNHX-UHFFFAOYSA-N 1 2 204.273 2.405 20 0 BEADLO C/C(Cl)=C\C(=O)NCc1c[nH+]c(C)cc1C ZINC000909391050 634598352 /nfs/dbraw/zinc/59/83/52/634598352.db2.gz OPJANLVGWUZFOG-WEVVVXLNSA-N 1 2 238.718 2.457 20 0 BEADLO CC[NH2+]Cc1noc([C@@H](C)c2ccccc2)n1 ZINC000233548789 635536010 /nfs/dbraw/zinc/53/60/10/635536010.db2.gz ZHZHTRVRNXBSKM-JTQLQIEISA-N 1 2 231.299 2.331 20 0 BEADLO C[C@@H](NCc1cocn1)c1cn2c([nH+]1)CCCC2 ZINC000925869885 635580961 /nfs/dbraw/zinc/58/09/61/635580961.db2.gz RTPZTVQXGSMYEF-SNVBAGLBSA-N 1 2 246.314 2.058 20 0 BEADLO CCN(Cc1ccccc1)C(=O)Cc1c[nH+]c[nH]1 ZINC000074673229 631237038 /nfs/dbraw/zinc/23/70/38/631237038.db2.gz UEGXUOYCKOWUAS-UHFFFAOYSA-N 1 2 243.310 2.001 20 0 BEADLO CCCC[C@H](CC)C(=O)NCc1ccc(N)[nH+]c1 ZINC000308382880 631242647 /nfs/dbraw/zinc/24/26/47/631242647.db2.gz YFMLJKFMHUMYAR-LBPRGKRZSA-N 1 2 249.358 2.496 20 0 BEADLO CCCC[C@@H](C)C(=O)NCc1ccc(N)[nH+]c1 ZINC000308393468 631310762 /nfs/dbraw/zinc/31/07/62/631310762.db2.gz RQELIFJNOICFFB-SNVBAGLBSA-N 1 2 235.331 2.106 20 0 BEADLO C[C@]1([NH2+]Cc2ccon2)CCOc2ccccc21 ZINC000933368877 631328455 /nfs/dbraw/zinc/32/84/55/631328455.db2.gz MHPCPMXSXZDFOO-AWEZNQCLSA-N 1 2 244.294 2.462 20 0 BEADLO C[C@@H]1C[C@H](C)N(C(=O)c2cc3c[nH+]ccc3[nH]2)C1 ZINC000933368940 631329673 /nfs/dbraw/zinc/32/96/73/631329673.db2.gz NFUZXQZTCBVIEC-ZJUUUORDSA-N 1 2 243.310 2.433 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc(OC)o1 ZINC000891476983 631372950 /nfs/dbraw/zinc/37/29/50/631372950.db2.gz WPOKTJDWUZZMAS-WDEREUQCSA-N 1 2 239.315 2.288 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(OC)o1 ZINC000891476983 631372955 /nfs/dbraw/zinc/37/29/55/631372955.db2.gz WPOKTJDWUZZMAS-WDEREUQCSA-N 1 2 239.315 2.288 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc(OC)o1 ZINC000891476981 631374072 /nfs/dbraw/zinc/37/40/72/631374072.db2.gz WPOKTJDWUZZMAS-QWRGUYRKSA-N 1 2 239.315 2.288 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(OC)o1 ZINC000891476981 631374077 /nfs/dbraw/zinc/37/40/77/631374077.db2.gz WPOKTJDWUZZMAS-QWRGUYRKSA-N 1 2 239.315 2.288 20 0 BEADLO COCC[N@H+](C)Cc1nc(C(C)(C)C)co1 ZINC000891573800 631395719 /nfs/dbraw/zinc/39/57/19/631395719.db2.gz JZUFWYMFUCQYKT-UHFFFAOYSA-N 1 2 226.320 2.050 20 0 BEADLO COCC[N@@H+](C)Cc1nc(C(C)(C)C)co1 ZINC000891573800 631395721 /nfs/dbraw/zinc/39/57/21/631395721.db2.gz JZUFWYMFUCQYKT-UHFFFAOYSA-N 1 2 226.320 2.050 20 0 BEADLO COC1CC[NH+](C/C(Cl)=C\Cl)CC1 ZINC000308502087 631412054 /nfs/dbraw/zinc/41/20/54/631412054.db2.gz XLJWLCKPTIOFBX-SOFGYWHQSA-N 1 2 224.131 2.416 20 0 BEADLO C[C@H]([NH2+]C[C@@H]1CCCS1)C(=O)OC(C)(C)C ZINC000087473046 631480895 /nfs/dbraw/zinc/48/08/95/631480895.db2.gz QTJXTDYVEINUOZ-UWVGGRQHSA-N 1 2 245.388 2.202 20 0 BEADLO C[C@H]1CN(C(=O)c2cc3c[nH+]ccc3[nH]2)C[C@H]1C ZINC000933818663 631515265 /nfs/dbraw/zinc/51/52/65/631515265.db2.gz XHVRKXNSPALPJD-AOOOYVTPSA-N 1 2 243.310 2.291 20 0 BEADLO CNc1cc(N[C@H](C)CC(F)(F)F)[nH+]cn1 ZINC000234515551 631560839 /nfs/dbraw/zinc/56/08/39/631560839.db2.gz WZWVXUUGOJGBMY-ZCFIWIBFSA-N 1 2 234.225 2.271 20 0 BEADLO Fc1cccc(/C=C/C[NH+]2CCOCC2)c1 ZINC000893867853 635633553 /nfs/dbraw/zinc/63/35/53/635633553.db2.gz VTPVSHIVKYBJQF-DUXPYHPUSA-N 1 2 221.275 2.171 20 0 BEADLO OC[C@H]1CC[N@@H+]1Cc1ccc(F)c(Cl)c1 ZINC000934010475 631584446 /nfs/dbraw/zinc/58/44/46/631584446.db2.gz DGRWLPGPVWXVHR-SECBINFHSA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@H]1CC[N@H+]1Cc1ccc(F)c(Cl)c1 ZINC000934010475 631584447 /nfs/dbraw/zinc/58/44/47/631584447.db2.gz DGRWLPGPVWXVHR-SECBINFHSA-N 1 2 229.682 2.046 20 0 BEADLO C[C@H]([NH2+][C@H]1CC[C@@H]1C)C(=O)OC(C)(C)C ZINC000308871065 631698983 /nfs/dbraw/zinc/69/89/83/631698983.db2.gz YZDVNJGAMRPDCC-GUBZILKMSA-N 1 2 213.321 2.105 20 0 BEADLO Cc1[nH]c(CNC(=O)C[C@@H]2CC=CCC2)[nH+]c1C ZINC000934426421 631835097 /nfs/dbraw/zinc/83/50/97/631835097.db2.gz VCGHSEOSYWQOKE-GFCCVEGCSA-N 1 2 247.342 2.389 20 0 BEADLO Cc1ccc(C[N@@H+]2CC[C@H](O)[C@@H](F)C2)cc1F ZINC000934569440 631939775 /nfs/dbraw/zinc/93/97/75/631939775.db2.gz YEEKVLLYJRNLEZ-STQMWFEESA-N 1 2 241.281 2.039 20 0 BEADLO Cc1ccc(C[N@H+]2CC[C@H](O)[C@@H](F)C2)cc1F ZINC000934569440 631939778 /nfs/dbraw/zinc/93/97/78/631939778.db2.gz YEEKVLLYJRNLEZ-STQMWFEESA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+]1CC[C@H](O)[C@H](F)C1 ZINC000934570622 631945129 /nfs/dbraw/zinc/94/51/29/631945129.db2.gz GAXDPVRTGGUGCE-OLZOCXBDSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cc(F)ccc1C[N@H+]1CC[C@H](O)[C@H](F)C1 ZINC000934570622 631945134 /nfs/dbraw/zinc/94/51/34/631945134.db2.gz GAXDPVRTGGUGCE-OLZOCXBDSA-N 1 2 241.281 2.039 20 0 BEADLO C[C@H](c1ccccc1F)[N@@H+]1CC[C@H](O)[C@H](F)C1 ZINC000934584894 631956275 /nfs/dbraw/zinc/95/62/75/631956275.db2.gz ZUTGULGWGFLYFA-WQAKAFBOSA-N 1 2 241.281 2.291 20 0 BEADLO C[C@H](c1ccccc1F)[N@H+]1CC[C@H](O)[C@H](F)C1 ZINC000934584894 631956280 /nfs/dbraw/zinc/95/62/80/631956280.db2.gz ZUTGULGWGFLYFA-WQAKAFBOSA-N 1 2 241.281 2.291 20 0 BEADLO C/C=C(\CC)C(=O)OCc1cc[nH+]c(N)c1 ZINC000309344868 632005084 /nfs/dbraw/zinc/00/50/84/632005084.db2.gz LXOABFSQPZRTKU-XCVCLJGOSA-N 1 2 220.272 2.063 20 0 BEADLO CC[NH2+]Cc1noc(CCc2ccccc2C)n1 ZINC000051986485 632039519 /nfs/dbraw/zinc/03/95/19/632039519.db2.gz LHILWLBGIWSELP-UHFFFAOYSA-N 1 2 245.326 2.273 20 0 BEADLO CCCNc1cc(NCCOC(C)C)nc[nH+]1 ZINC000161520748 632069191 /nfs/dbraw/zinc/06/91/91/632069191.db2.gz RXENBVVMVCTNET-UHFFFAOYSA-N 1 2 238.335 2.135 20 0 BEADLO CCCNc1cc(NCCOC(C)C)[nH+]cn1 ZINC000161520748 632069199 /nfs/dbraw/zinc/06/91/99/632069199.db2.gz RXENBVVMVCTNET-UHFFFAOYSA-N 1 2 238.335 2.135 20 0 BEADLO CCOC(=O)C[NH2+]C1(C2CCCCC2)CC1 ZINC000934787461 632074284 /nfs/dbraw/zinc/07/42/84/632074284.db2.gz AOVKKVNNXCZKRT-UHFFFAOYSA-N 1 2 225.332 2.252 20 0 BEADLO CN(C)c1cc(NCc2ccsc2)[nH+]cn1 ZINC000309447716 632100315 /nfs/dbraw/zinc/10/03/15/632100315.db2.gz KFFUVCJBNSRXKK-UHFFFAOYSA-N 1 2 234.328 2.216 20 0 BEADLO CN(C)c1cc(NCc2ccsc2)nc[nH+]1 ZINC000309447716 632100319 /nfs/dbraw/zinc/10/03/19/632100319.db2.gz KFFUVCJBNSRXKK-UHFFFAOYSA-N 1 2 234.328 2.216 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCS[C@@H]1C)C(=O)OC(C)(C)C ZINC000309588168 632549961 /nfs/dbraw/zinc/54/99/61/632549961.db2.gz SUIWISXQZSXMKL-IVZWLZJFSA-N 1 2 245.388 2.200 20 0 BEADLO C[C@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@H]2F)c2ncnn21 ZINC000926586552 632594945 /nfs/dbraw/zinc/59/49/45/632594945.db2.gz CHSAKCCRMSAKNH-LNFKQOIKSA-N 1 2 238.310 2.154 20 0 BEADLO CCc1noc([C@H](CC(C)C)n2cc[nH+]c2)n1 ZINC000923778269 632804773 /nfs/dbraw/zinc/80/47/73/632804773.db2.gz XRELVAUCJRQLPS-JTQLQIEISA-N 1 2 234.303 2.464 20 0 BEADLO CNc1cc(N2CC[C@@H](C(C)(C)C)C2)nc[nH+]1 ZINC000163693459 633061617 /nfs/dbraw/zinc/06/16/17/633061617.db2.gz LXCSXSHDWFAPMV-SNVBAGLBSA-N 1 2 234.347 2.391 20 0 BEADLO CNc1cc(N2CC[C@@H](C(C)(C)C)C2)[nH+]cn1 ZINC000163693459 633061628 /nfs/dbraw/zinc/06/16/28/633061628.db2.gz LXCSXSHDWFAPMV-SNVBAGLBSA-N 1 2 234.347 2.391 20 0 BEADLO CCCCC[C@H](C)Nc1nc(C)[nH+]c(N)n1 ZINC000304407080 635940318 /nfs/dbraw/zinc/94/03/18/635940318.db2.gz BQYJRFXEOXBLEU-QMMMGPOBSA-N 1 2 223.324 2.143 20 0 BEADLO CCCCC[C@H](C)Nc1nc(N)nc(C)[nH+]1 ZINC000304407080 635940321 /nfs/dbraw/zinc/94/03/21/635940321.db2.gz BQYJRFXEOXBLEU-QMMMGPOBSA-N 1 2 223.324 2.143 20 0 BEADLO CC1(C)C[N@H+](C/C(Cl)=C/Cl)CC[C@@H]1O ZINC000307303994 635985671 /nfs/dbraw/zinc/98/56/71/635985671.db2.gz GWYLTTDOXNDZGW-RDOCRHDPSA-N 1 2 238.158 2.398 20 0 BEADLO CC1(C)C[N@@H+](C/C(Cl)=C/Cl)CC[C@@H]1O ZINC000307303994 635985674 /nfs/dbraw/zinc/98/56/74/635985674.db2.gz GWYLTTDOXNDZGW-RDOCRHDPSA-N 1 2 238.158 2.398 20 0 BEADLO Cn1ccc(C[NH+]2CC(C(F)(F)F)C2)c1 ZINC000894891672 635999860 /nfs/dbraw/zinc/99/98/60/635999860.db2.gz BRFWTAPJHOHQBF-UHFFFAOYSA-N 1 2 218.222 2.019 20 0 BEADLO Cc1nc(N2CCC[C@H](CO)CC2)c(C)c(C)[nH+]1 ZINC000338827705 636055590 /nfs/dbraw/zinc/05/55/90/636055590.db2.gz JDNUHWBRRLOXEU-ZDUSSCGKSA-N 1 2 249.358 2.001 20 0 BEADLO CC(C)COC(=O)C[N@@H+]1CCS[C@H](C)[C@H]1C ZINC000181461228 633916683 /nfs/dbraw/zinc/91/66/83/633916683.db2.gz YEQPWAJMOSKYJX-GHMZBOCLSA-N 1 2 245.388 2.011 20 0 BEADLO CC(C)COC(=O)C[N@H+]1CCS[C@H](C)[C@H]1C ZINC000181461228 633916686 /nfs/dbraw/zinc/91/66/86/633916686.db2.gz YEQPWAJMOSKYJX-GHMZBOCLSA-N 1 2 245.388 2.011 20 0 BEADLO CC[C@H]1C[N@H+](CC(=O)OCC(C)C)CCS1 ZINC000181467276 633917338 /nfs/dbraw/zinc/91/73/38/633917338.db2.gz SWBFXWKTJGYNCT-NSHDSACASA-N 1 2 245.388 2.013 20 0 BEADLO CC[C@H]1C[N@@H+](CC(=O)OCC(C)C)CCS1 ZINC000181467276 633917342 /nfs/dbraw/zinc/91/73/42/633917342.db2.gz SWBFXWKTJGYNCT-NSHDSACASA-N 1 2 245.388 2.013 20 0 BEADLO CC[C@@H]1C[N@H+](CC(=O)OCC(C)C)CCS1 ZINC000181467257 633917543 /nfs/dbraw/zinc/91/75/43/633917543.db2.gz SWBFXWKTJGYNCT-LLVKDONJSA-N 1 2 245.388 2.013 20 0 BEADLO CC[C@@H]1C[N@@H+](CC(=O)OCC(C)C)CCS1 ZINC000181467257 633917547 /nfs/dbraw/zinc/91/75/47/633917547.db2.gz SWBFXWKTJGYNCT-LLVKDONJSA-N 1 2 245.388 2.013 20 0 BEADLO CCn1cc(CNc2[nH+]cccc2OC)c(C)n1 ZINC000893267818 634016384 /nfs/dbraw/zinc/01/63/84/634016384.db2.gz XFAMLIUZFBGGPX-UHFFFAOYSA-N 1 2 246.314 2.227 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC[C@H](c2nccs2)C1 ZINC000895581423 636163148 /nfs/dbraw/zinc/16/31/48/636163148.db2.gz AELGELVEYMOPKA-JTQLQIEISA-N 1 2 248.355 2.164 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC[C@H](c2nccs2)C1 ZINC000895581423 636163153 /nfs/dbraw/zinc/16/31/53/636163153.db2.gz AELGELVEYMOPKA-JTQLQIEISA-N 1 2 248.355 2.164 20 0 BEADLO CN(C)c1ccc(NCc2ccc(F)nc2)[nH+]c1 ZINC000189149755 634167663 /nfs/dbraw/zinc/16/76/63/634167663.db2.gz ONJWAPRQSVCFFS-UHFFFAOYSA-N 1 2 246.289 2.294 20 0 BEADLO CNc1cc(N[C@@H](C)c2ncc(C)s2)nc[nH+]1 ZINC000126163442 635664002 /nfs/dbraw/zinc/66/40/02/635664002.db2.gz VNYSWUKZQXXAFP-QMMMGPOBSA-N 1 2 249.343 2.456 20 0 BEADLO CNc1cc(N[C@@H](C)c2ncc(C)s2)[nH+]cn1 ZINC000126163442 635664006 /nfs/dbraw/zinc/66/40/06/635664006.db2.gz VNYSWUKZQXXAFP-QMMMGPOBSA-N 1 2 249.343 2.456 20 0 BEADLO CNc1cc(N[C@H](C)c2ncc(C)s2)nc[nH+]1 ZINC000126163208 635664381 /nfs/dbraw/zinc/66/43/81/635664381.db2.gz VNYSWUKZQXXAFP-MRVPVSSYSA-N 1 2 249.343 2.456 20 0 BEADLO CNc1cc(N[C@H](C)c2ncc(C)s2)[nH+]cn1 ZINC000126163208 635664389 /nfs/dbraw/zinc/66/43/89/635664389.db2.gz VNYSWUKZQXXAFP-MRVPVSSYSA-N 1 2 249.343 2.456 20 0 BEADLO Cc1[nH]c(CNC(=O)C[C@@H]2CC[C@H]3C[C@H]32)[nH+]c1C ZINC000896910747 636252951 /nfs/dbraw/zinc/25/29/51/636252951.db2.gz WBFJNMRGYGZRRK-SDDRHHMPSA-N 1 2 247.342 2.079 20 0 BEADLO Cc1cc([NH+](C)C)ccc1NCc1cn(C)cn1 ZINC000310802668 636452161 /nfs/dbraw/zinc/45/21/61/636452161.db2.gz XSFPRQCXWOVFOZ-UHFFFAOYSA-N 1 2 244.342 2.407 20 0 BEADLO Cc1ccc(C(=O)/C=C/c2[nH]cc[nH+]2)o1 ZINC000067647881 636758697 /nfs/dbraw/zinc/75/86/97/636758697.db2.gz FLLSRCWUCMDUGU-HWKANZROSA-N 1 2 202.213 2.207 20 0 BEADLO c1[nH]cc([C@@H]2C[C@H]2c2nc(CC3CC3)no2)[nH+]1 ZINC000923821637 636767994 /nfs/dbraw/zinc/76/79/94/636767994.db2.gz OANJRICAEZZNPW-RKDXNWHRSA-N 1 2 230.271 2.016 20 0 BEADLO Cc1nonc1[C@@H](C)[NH2+][C@H](C)c1cnccc1C ZINC000925295501 636782366 /nfs/dbraw/zinc/78/23/66/636782366.db2.gz XSVJWPHQGPJYSQ-NXEZZACHSA-N 1 2 246.314 2.493 20 0 BEADLO CCCCCNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000929104873 636804444 /nfs/dbraw/zinc/80/44/44/636804444.db2.gz JWPIXBVKAJSNBH-UHFFFAOYSA-N 1 2 231.299 2.483 20 0 BEADLO CC(C)(C)c1cn(CC[C@@H]2CCOC2=O)c[nH+]1 ZINC000865376195 636812885 /nfs/dbraw/zinc/81/28/85/636812885.db2.gz DFGUQPCJSQTWCN-SNVBAGLBSA-N 1 2 236.315 2.134 20 0 BEADLO C[C@@H](C(=O)NCC(C)(C)n1cc[nH+]c1)C1CCC1 ZINC000898909484 637063239 /nfs/dbraw/zinc/06/32/39/637063239.db2.gz QOZBDAGJWJFEAX-LLVKDONJSA-N 1 2 249.358 2.171 20 0 BEADLO CC/C=C(/C)C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000898906912 637065147 /nfs/dbraw/zinc/06/51/47/637065147.db2.gz JZDCWVTXGQBABT-WDZFZDKYSA-N 1 2 235.331 2.091 20 0 BEADLO C[C@H](c1nc([C@@H]2CC2(C)C)no1)[NH+](C)C ZINC000923812541 637079191 /nfs/dbraw/zinc/07/91/91/637079191.db2.gz CFDSIQXEYNQYID-SFYZADRCSA-N 1 2 209.293 2.206 20 0 BEADLO C[C@@H](c1ccccc1)N(C)C(=O)Cc1c[nH+]c[nH]1 ZINC000900023934 637168347 /nfs/dbraw/zinc/16/83/47/637168347.db2.gz AKJDJEVDQIAWQM-NSHDSACASA-N 1 2 243.310 2.172 20 0 BEADLO CC[C@H]1C[C@H](C)CN1C(=O)CNc1cccc[nH+]1 ZINC000900908477 637203281 /nfs/dbraw/zinc/20/32/81/637203281.db2.gz HYPRIXFTHRKYKL-RYUDHWBXSA-N 1 2 247.342 2.141 20 0 BEADLO Cc1[nH+]c(N)ccc1-c1noc(C23CC(C2)C3)n1 ZINC000904263395 637395629 /nfs/dbraw/zinc/39/56/29/637395629.db2.gz WYAYTPVDKXXENI-UHFFFAOYSA-N 1 2 242.282 2.074 20 0 BEADLO Cc1[nH+]cc(-c2cnn(C(F)(F)F)c2)n1C ZINC000904866659 637515402 /nfs/dbraw/zinc/51/54/02/637515402.db2.gz JADZQGDBNRQRAF-UHFFFAOYSA-N 1 2 230.193 2.068 20 0 BEADLO Cn1c[nH+]cc1-c1cccc2c1CCO2 ZINC000904899929 637527582 /nfs/dbraw/zinc/52/75/82/637527582.db2.gz DHBPOZMMZBJDFB-UHFFFAOYSA-N 1 2 200.241 2.022 20 0 BEADLO CCOc1ccc(-c2c[nH+]cn2C)cc1 ZINC000905304183 637762862 /nfs/dbraw/zinc/76/28/62/637762862.db2.gz CLTFKBPJYPGZBH-UHFFFAOYSA-N 1 2 202.257 2.486 20 0 BEADLO CC[C@H](C)[C@H]([NH2+][C@H]1C[C@H](SC)C1)C(=O)OC ZINC000905776592 637906939 /nfs/dbraw/zinc/90/69/39/637906939.db2.gz GPNWUMVIMAXSLP-NAKRPEOUSA-N 1 2 245.388 2.058 20 0 BEADLO CC[C@@H](C)[C@H]([NH2+][C@H]1C[C@H](SC)C1)C(=O)OC ZINC000905776588 637907361 /nfs/dbraw/zinc/90/73/61/637907361.db2.gz GPNWUMVIMAXSLP-DBIOUOCHSA-N 1 2 245.388 2.058 20 0 BEADLO CC[C@H](C)[C@H]([NH2+][C@@H]1CSC1(C)C)C(=O)OC ZINC000905767247 637922783 /nfs/dbraw/zinc/92/27/83/637922783.db2.gz JQUOOPJGTDNAGY-AEJSXWLSSA-N 1 2 245.388 2.058 20 0 BEADLO Cc1ccc(-c2c[nH+]c3c(c2)CCCN3)cn1 ZINC000906167173 638079765 /nfs/dbraw/zinc/07/97/65/638079765.db2.gz DVCOPLNJIATCJZ-UHFFFAOYSA-N 1 2 225.295 2.453 20 0 BEADLO Cc1cc(C)c(C(=O)N(C)CC(F)F)c(C)[nH+]1 ZINC000906565015 638215157 /nfs/dbraw/zinc/21/51/57/638215157.db2.gz CCNJRDZQCKPDRH-UHFFFAOYSA-N 1 2 242.269 2.344 20 0 BEADLO CCC1(CNC(=O)Cc2c[nH]c[nH+]2)CCCCC1 ZINC000907391824 638370623 /nfs/dbraw/zinc/37/06/23/638370623.db2.gz QFPGIJZPDMEDAJ-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO C[C@@H](CCC1CC1)NC(=O)CNc1cccc[nH+]1 ZINC000907438602 638376050 /nfs/dbraw/zinc/37/60/50/638376050.db2.gz WKJNDYVEQQXXEZ-NSHDSACASA-N 1 2 247.342 2.188 20 0 BEADLO C[C@H](CCC1CC1)NC(=O)CNc1cccc[nH+]1 ZINC000907438601 638376491 /nfs/dbraw/zinc/37/64/91/638376491.db2.gz WKJNDYVEQQXXEZ-LLVKDONJSA-N 1 2 247.342 2.188 20 0 BEADLO CC1(C)CN(C(=O)Cc2c[nH+]c[nH]2)CC(C)(C)C1 ZINC000907426084 638380053 /nfs/dbraw/zinc/38/00/53/638380053.db2.gz DZPZUUZRKNLGSH-UHFFFAOYSA-N 1 2 249.358 2.237 20 0 BEADLO CC[C@H]1[C@@H](C)CCN1C(=O)CNc1cccc[nH+]1 ZINC000907488242 638390051 /nfs/dbraw/zinc/39/00/51/638390051.db2.gz OYFCNBYDQISYLQ-RYUDHWBXSA-N 1 2 247.342 2.141 20 0 BEADLO CC1(C)CCC[C@H](NC(=O)Cc2c[nH]c[nH+]2)C1 ZINC000907629130 638424604 /nfs/dbraw/zinc/42/46/04/638424604.db2.gz SGIIPCUTKDCDBA-JTQLQIEISA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H]1CCC[C@@H](CNC(=O)Cc2c[nH]c[nH+]2)[C@@H]1C ZINC000907924208 638514684 /nfs/dbraw/zinc/51/46/84/638514684.db2.gz IFQZJLKBUGDAFS-UTUOFQBUSA-N 1 2 249.358 2.141 20 0 BEADLO CCN(CC(C)(C)C)C(=O)CNc1cccc[nH+]1 ZINC000908323496 638663776 /nfs/dbraw/zinc/66/37/76/638663776.db2.gz MYZHXMACENJORB-UHFFFAOYSA-N 1 2 249.358 2.388 20 0 BEADLO CNc1cc(N[C@@H](C)c2cccnc2)nc[nH+]1 ZINC000129266380 639180643 /nfs/dbraw/zinc/18/06/43/639180643.db2.gz VVUOXQACACJUNR-VIFPVBQESA-N 1 2 229.287 2.086 20 0 BEADLO CNc1cc(N[C@@H](C)c2cccnc2)[nH+]cn1 ZINC000129266380 639180647 /nfs/dbraw/zinc/18/06/47/639180647.db2.gz VVUOXQACACJUNR-VIFPVBQESA-N 1 2 229.287 2.086 20 0 BEADLO CC1(CCC(=O)OCCCn2cc[nH+]c2)CC1 ZINC000910038656 639347780 /nfs/dbraw/zinc/34/77/80/639347780.db2.gz VKIZNTAWPRIMRC-UHFFFAOYSA-N 1 2 236.315 2.397 20 0 BEADLO O=C(OCCn1cc[nH+]c1)[C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000910216033 639386147 /nfs/dbraw/zinc/38/61/47/639386147.db2.gz MVHUPTGWVZEGFY-RWMBFGLXSA-N 1 2 248.326 2.253 20 0 BEADLO C[C@@H]1CC(C)(C)CN1C(=O)CNc1cccc[nH+]1 ZINC000910466937 639462503 /nfs/dbraw/zinc/46/25/03/639462503.db2.gz UBXKEIFXKVRIBY-LLVKDONJSA-N 1 2 247.342 2.141 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1ccccc1CF ZINC000930304242 639693152 /nfs/dbraw/zinc/69/31/52/639693152.db2.gz VUTKFOFFASUHTN-JTQLQIEISA-N 1 2 239.290 2.149 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1ccccc1CF ZINC000930304242 639693157 /nfs/dbraw/zinc/69/31/57/639693157.db2.gz VUTKFOFFASUHTN-JTQLQIEISA-N 1 2 239.290 2.149 20 0 BEADLO c1cc(CC[N@@H+]2Cc3ccncc3C2)sn1 ZINC000930461840 639766088 /nfs/dbraw/zinc/76/60/88/639766088.db2.gz ANOOWUHJDDWMJS-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1cc(CC[N@H+]2Cc3ccncc3C2)sn1 ZINC000930461840 639766096 /nfs/dbraw/zinc/76/60/96/639766096.db2.gz ANOOWUHJDDWMJS-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO CO[C@@H](C)C[N@H+](C)Cc1coc(C(C)(C)C)n1 ZINC000930475975 639773060 /nfs/dbraw/zinc/77/30/60/639773060.db2.gz KRGAORIVKJXXTB-JTQLQIEISA-N 1 2 240.347 2.439 20 0 BEADLO CO[C@@H](C)C[N@@H+](C)Cc1coc(C(C)(C)C)n1 ZINC000930475975 639773067 /nfs/dbraw/zinc/77/30/67/639773067.db2.gz KRGAORIVKJXXTB-JTQLQIEISA-N 1 2 240.347 2.439 20 0 BEADLO CC[N@H+](Cc1nnc(OC)s1)CC(C)(C)C ZINC000930536247 639803173 /nfs/dbraw/zinc/80/31/73/639803173.db2.gz TWOLYGYXRKOBQS-UHFFFAOYSA-N 1 2 243.376 2.415 20 0 BEADLO CC[N@@H+](Cc1nnc(OC)s1)CC(C)(C)C ZINC000930536247 639803174 /nfs/dbraw/zinc/80/31/74/639803174.db2.gz TWOLYGYXRKOBQS-UHFFFAOYSA-N 1 2 243.376 2.415 20 0 BEADLO F[C@@H]1CC[N@H+](C[C@@H]2CC[C@@H](C(F)(F)F)O2)C1 ZINC000930604340 639817814 /nfs/dbraw/zinc/81/78/14/639817814.db2.gz XDKHSOAJTYRLHX-VGMNWLOBSA-N 1 2 241.228 2.140 20 0 BEADLO F[C@@H]1CC[N@@H+](C[C@@H]2CC[C@@H](C(F)(F)F)O2)C1 ZINC000930604340 639817815 /nfs/dbraw/zinc/81/78/15/639817815.db2.gz XDKHSOAJTYRLHX-VGMNWLOBSA-N 1 2 241.228 2.140 20 0 BEADLO Cc1cc(C[N@@H+]2CCC=C(Cl)C2)c(C)nn1 ZINC000930837797 639937456 /nfs/dbraw/zinc/93/74/56/639937456.db2.gz HLYAETAQNMUTJO-UHFFFAOYSA-N 1 2 237.734 2.422 20 0 BEADLO Cc1cc(C[N@H+]2CCC=C(Cl)C2)c(C)nn1 ZINC000930837797 639937463 /nfs/dbraw/zinc/93/74/63/639937463.db2.gz HLYAETAQNMUTJO-UHFFFAOYSA-N 1 2 237.734 2.422 20 0 BEADLO CC(C)=CCC[NH2+][C@@]1(C)CC(C)(C)OC1=O ZINC000930872171 639961635 /nfs/dbraw/zinc/96/16/35/639961635.db2.gz WEBCLJSZPUOPLL-ZDUSSCGKSA-N 1 2 225.332 2.417 20 0 BEADLO CC/C=C/CC[NH2+][C@]1(C)CC(C)(C)OC1=O ZINC000930873694 639965104 /nfs/dbraw/zinc/96/51/04/639965104.db2.gz AUHQHYLTDRDQJY-KTRBRXNASA-N 1 2 225.332 2.417 20 0 BEADLO C=C/C=C/CC[NH2+][C@]1(C)CC(C)(C)OC1=O ZINC000930876874 639968715 /nfs/dbraw/zinc/96/87/15/639968715.db2.gz ASRKINJWECOVTQ-KTRBRXNASA-N 1 2 223.316 2.193 20 0 BEADLO Cc1[nH]c(CN(C)CC2=CCSC2)c(C)[nH+]1 ZINC000931071691 640058828 /nfs/dbraw/zinc/05/88/28/640058828.db2.gz NIBPGESMKOVQNE-UHFFFAOYSA-N 1 2 237.372 2.132 20 0 BEADLO C[N@@H+](Cc1nncs1)C[C@@H]1CC1(C)C ZINC000931080565 640062605 /nfs/dbraw/zinc/06/26/05/640062605.db2.gz CMFYEBKHGBKGTJ-QMMMGPOBSA-N 1 2 211.334 2.016 20 0 BEADLO C[N@H+](Cc1nncs1)C[C@@H]1CC1(C)C ZINC000931080565 640062612 /nfs/dbraw/zinc/06/26/12/640062612.db2.gz CMFYEBKHGBKGTJ-QMMMGPOBSA-N 1 2 211.334 2.016 20 0 BEADLO COc1nnc(C[N@H+](C)C[C@@H]2CC2(C)C)s1 ZINC000931082320 640065457 /nfs/dbraw/zinc/06/54/57/640065457.db2.gz QUXBOLFFMYWMEJ-QMMMGPOBSA-N 1 2 241.360 2.025 20 0 BEADLO COc1nnc(C[N@@H+](C)C[C@@H]2CC2(C)C)s1 ZINC000931082320 640065461 /nfs/dbraw/zinc/06/54/61/640065461.db2.gz QUXBOLFFMYWMEJ-QMMMGPOBSA-N 1 2 241.360 2.025 20 0 BEADLO CC(C)(C)CC[N@@H+]1CCC[C@H]1c1nc[nH]n1 ZINC000931134324 640071581 /nfs/dbraw/zinc/07/15/81/640071581.db2.gz MBPXVNQFDCJLDV-JTQLQIEISA-N 1 2 222.336 2.378 20 0 BEADLO CC(C)(C)CC[N@H+]1CCC[C@H]1c1nc[nH]n1 ZINC000931134324 640071587 /nfs/dbraw/zinc/07/15/87/640071587.db2.gz MBPXVNQFDCJLDV-JTQLQIEISA-N 1 2 222.336 2.378 20 0 BEADLO c1nnc([C@@H]2CCC[N@@H+]2[C@H]2C=CCCC2)[nH]1 ZINC000931137240 640071756 /nfs/dbraw/zinc/07/17/56/640071756.db2.gz XSIBBDWCTYGEEE-QWRGUYRKSA-N 1 2 218.304 2.050 20 0 BEADLO c1nnc([C@@H]2CCC[N@H+]2[C@H]2C=CCCC2)[nH]1 ZINC000931137240 640071760 /nfs/dbraw/zinc/07/17/60/640071760.db2.gz XSIBBDWCTYGEEE-QWRGUYRKSA-N 1 2 218.304 2.050 20 0 BEADLO CC(C)N(C(=O)C[C@@H]([NH3+])C(F)F)C1CCCC1 ZINC000912466890 640071896 /nfs/dbraw/zinc/07/18/96/640071896.db2.gz TZJWFLUJFLLQGY-SNVBAGLBSA-N 1 2 248.317 2.149 20 0 BEADLO CCCCC[N@@H+]1CCC[C@H]1c1nnc[nH]1 ZINC000931135182 640072205 /nfs/dbraw/zinc/07/22/05/640072205.db2.gz UMYYWQRUYVVYII-JTQLQIEISA-N 1 2 208.309 2.132 20 0 BEADLO CCCCC[N@H+]1CCC[C@H]1c1nnc[nH]1 ZINC000931135182 640072212 /nfs/dbraw/zinc/07/22/12/640072212.db2.gz UMYYWQRUYVVYII-JTQLQIEISA-N 1 2 208.309 2.132 20 0 BEADLO c1nnc([C@@H]2CCC[N@H+]2CC[C@@H]2C[C@H]2C2CC2)[nH]1 ZINC000931144478 640078944 /nfs/dbraw/zinc/07/89/44/640078944.db2.gz SYLUALAAFIISRL-AGIUHOORSA-N 1 2 246.358 2.378 20 0 BEADLO c1nnc([C@@H]2CCC[N@@H+]2CC[C@@H]2C[C@H]2C2CC2)[nH]1 ZINC000931144478 640078951 /nfs/dbraw/zinc/07/89/51/640078951.db2.gz SYLUALAAFIISRL-AGIUHOORSA-N 1 2 246.358 2.378 20 0 BEADLO CC(C)(CNC(=O)C1(C)CCCC1)n1cc[nH+]c1 ZINC000912616356 640124434 /nfs/dbraw/zinc/12/44/34/640124434.db2.gz CYXOGKFFGVYAPL-UHFFFAOYSA-N 1 2 249.358 2.315 20 0 BEADLO C=C/C(C)=C\CC(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000912615280 640140290 /nfs/dbraw/zinc/14/02/90/640140290.db2.gz KGYFQCZTTVFXMV-SDQBBNPISA-N 1 2 247.342 2.257 20 0 BEADLO Cc1cc(C)c(C(=O)N2CC[C@@H]3C[C@@H]3C2)c(C)[nH+]1 ZINC000912679317 640163526 /nfs/dbraw/zinc/16/35/26/640163526.db2.gz VKTKHEWNLJFKHU-CHWSQXEVSA-N 1 2 244.338 2.489 20 0 BEADLO CC(C)[C@H](NC(=O)CNc1cccc[nH+]1)C1CC1 ZINC000912692393 640167438 /nfs/dbraw/zinc/16/74/38/640167438.db2.gz FCDBDEAKVIMSEF-AWEZNQCLSA-N 1 2 247.342 2.044 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1Cc2c[nH]nc2[C@@H](C)C1 ZINC000931451517 640213060 /nfs/dbraw/zinc/21/30/60/640213060.db2.gz CBNOKJCRMXYWFA-QMMMGPOBSA-N 1 2 246.314 2.134 20 0 BEADLO Cc1noc(C)c1C[N@H+]1Cc2c[nH]nc2[C@@H](C)C1 ZINC000931451517 640213067 /nfs/dbraw/zinc/21/30/67/640213067.db2.gz CBNOKJCRMXYWFA-QMMMGPOBSA-N 1 2 246.314 2.134 20 0 BEADLO CCc1ncc(C[NH2+][C@@H](C)c2nccnc2C)o1 ZINC000931618926 640290134 /nfs/dbraw/zinc/29/01/34/640290134.db2.gz SVCKCOCMVZFOEW-JTQLQIEISA-N 1 2 246.314 2.186 20 0 BEADLO CCc1cc(C[NH2+]Cc2ccoc2)on1 ZINC000164379069 640474725 /nfs/dbraw/zinc/47/47/25/640474725.db2.gz ACWAHFKHYGWVIM-UHFFFAOYSA-N 1 2 206.245 2.120 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CCO[C@@H](C)CC2)s1 ZINC000932346482 640488593 /nfs/dbraw/zinc/48/85/93/640488593.db2.gz IPIPNVBRLXKLLA-IUCAKERBSA-N 1 2 241.360 2.018 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CCO[C@@H](C)CC2)s1 ZINC000932346482 640488598 /nfs/dbraw/zinc/48/85/98/640488598.db2.gz IPIPNVBRLXKLLA-IUCAKERBSA-N 1 2 241.360 2.018 20 0 BEADLO COC(C)(C)[C@@H](C)[NH2+]Cc1nnsc1Cl ZINC000932368772 640500515 /nfs/dbraw/zinc/50/05/15/640500515.db2.gz XWUYTMLGBWZPCB-ZCFIWIBFSA-N 1 2 249.767 2.095 20 0 BEADLO Cn1c[nH+]cc1Cn1ccc(-c2ccsc2)n1 ZINC000439558418 640522331 /nfs/dbraw/zinc/52/23/31/640522331.db2.gz SSNZFKUAPFFAPX-UHFFFAOYSA-N 1 2 244.323 2.393 20 0 BEADLO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1cnn[nH]1 ZINC000932560124 640575838 /nfs/dbraw/zinc/57/58/38/640575838.db2.gz RCBKTWMCTOAUSM-SECBINFHSA-N 1 2 234.278 2.103 20 0 BEADLO Cc1cc(NC(=O)CCC2(C)CC2)cc[nH+]1 ZINC000932606530 640579353 /nfs/dbraw/zinc/57/93/53/640579353.db2.gz KNVYFGRBJAJLPH-UHFFFAOYSA-N 1 2 218.300 2.331 20 0 BEADLO Cc1cc(NC(=O)[C@]2(C)C=CCC2)cc[nH+]1 ZINC000932605707 640583067 /nfs/dbraw/zinc/58/30/67/640583067.db2.gz DTJWEAMXLSPMQD-CYBMUJFWSA-N 1 2 216.284 2.107 20 0 BEADLO FC1(C2CC2)CC[NH+](Cc2ncccn2)CC1 ZINC000932625103 640588932 /nfs/dbraw/zinc/58/89/32/640588932.db2.gz VQEBZNBICRQXII-UHFFFAOYSA-N 1 2 235.306 2.191 20 0 BEADLO C[C@H]1CCC(=O)C[N@@H+]1CCCCCF ZINC000932876531 640636861 /nfs/dbraw/zinc/63/68/61/640636861.db2.gz MHFZMGBJJFCNLJ-JTQLQIEISA-N 1 2 201.285 2.180 20 0 BEADLO C[C@H]1CCC(=O)C[N@H+]1CCCCCF ZINC000932876531 640636862 /nfs/dbraw/zinc/63/68/62/640636862.db2.gz MHFZMGBJJFCNLJ-JTQLQIEISA-N 1 2 201.285 2.180 20 0 BEADLO C[C@@H](CSC(C)(C)C)[NH2+]Cc1ccn[nH]1 ZINC000167434673 640722974 /nfs/dbraw/zinc/72/29/74/640722974.db2.gz VYDQGSGNIQULSN-VIFPVBQESA-N 1 2 227.377 2.420 20 0 BEADLO C[C@H]([NH2+][C@@H]1COCc2ccccc21)c1ncc[nH]1 ZINC000226011282 640723362 /nfs/dbraw/zinc/72/33/62/640723362.db2.gz IVVPZYUGWZHOKB-GXFFZTMASA-N 1 2 243.310 2.332 20 0 BEADLO CN(C(=O)c1cc2c[nH+]ccc2[nH]1)C1CCC1 ZINC000933614348 640735800 /nfs/dbraw/zinc/73/58/00/640735800.db2.gz NWNKPXVSIQLXNN-UHFFFAOYSA-N 1 2 229.283 2.187 20 0 BEADLO c1cc(C[N@@H+](Cc2cn[nH]c2)C2CC2)co1 ZINC000934002787 640803989 /nfs/dbraw/zinc/80/39/89/640803989.db2.gz BHUGLSLWXMJSIR-UHFFFAOYSA-N 1 2 217.272 2.167 20 0 BEADLO c1cc(C[N@H+](Cc2cn[nH]c2)C2CC2)co1 ZINC000934002787 640803992 /nfs/dbraw/zinc/80/39/92/640803992.db2.gz BHUGLSLWXMJSIR-UHFFFAOYSA-N 1 2 217.272 2.167 20 0 BEADLO COC(=O)[C@H](CC(C)C)[NH2+][C@H]1CCCSC1 ZINC000061575805 640974660 /nfs/dbraw/zinc/97/46/60/640974660.db2.gz WCLHNDNUJQBDNH-QWRGUYRKSA-N 1 2 245.388 2.059 20 0 BEADLO CNc1cc(N2CCCCCCC2)nc[nH+]1 ZINC000087806315 641051539 /nfs/dbraw/zinc/05/15/39/641051539.db2.gz CUVRZJZKVCVPAR-UHFFFAOYSA-N 1 2 220.320 2.289 20 0 BEADLO CNc1cc(N2CCCCCCC2)[nH+]cn1 ZINC000087806315 641051542 /nfs/dbraw/zinc/05/15/42/641051542.db2.gz CUVRZJZKVCVPAR-UHFFFAOYSA-N 1 2 220.320 2.289 20 0 BEADLO CNc1cc(N(C)C2CCCCC2)nc[nH+]1 ZINC000087805610 641051644 /nfs/dbraw/zinc/05/16/44/641051644.db2.gz MPBOXCMUQRNTQF-UHFFFAOYSA-N 1 2 220.320 2.287 20 0 BEADLO CNc1cc(N(C)C2CCCCC2)[nH+]cn1 ZINC000087805610 641051646 /nfs/dbraw/zinc/05/16/46/641051646.db2.gz MPBOXCMUQRNTQF-UHFFFAOYSA-N 1 2 220.320 2.287 20 0 BEADLO CNc1cc(N(C)CC(C)(C)C)nc[nH+]1 ZINC000087825373 641058192 /nfs/dbraw/zinc/05/81/92/641058192.db2.gz WUPSQLXWJKIOJN-UHFFFAOYSA-N 1 2 208.309 2.001 20 0 BEADLO CNc1cc(N(C)CC(C)(C)C)[nH+]cn1 ZINC000087825373 641058197 /nfs/dbraw/zinc/05/81/97/641058197.db2.gz WUPSQLXWJKIOJN-UHFFFAOYSA-N 1 2 208.309 2.001 20 0 BEADLO C[C@H]1CSCC[N@@H+]1Cn1cccnc1=S ZINC000172514683 641069659 /nfs/dbraw/zinc/06/96/59/641069659.db2.gz HLCNXSKFDYPLRC-VIFPVBQESA-N 1 2 241.385 2.007 20 0 BEADLO C[C@H]1CSCC[N@H+]1Cn1cccnc1=S ZINC000172514683 641069662 /nfs/dbraw/zinc/06/96/62/641069662.db2.gz HLCNXSKFDYPLRC-VIFPVBQESA-N 1 2 241.385 2.007 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@H+](C)Cc1coc(C2CC2)n1 ZINC000934108200 641070801 /nfs/dbraw/zinc/07/08/01/641070801.db2.gz ZNHPYLOTRRRCIR-NWDGAFQWSA-N 1 2 236.315 2.161 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@@H+](C)Cc1coc(C2CC2)n1 ZINC000934108200 641070809 /nfs/dbraw/zinc/07/08/09/641070809.db2.gz ZNHPYLOTRRRCIR-NWDGAFQWSA-N 1 2 236.315 2.161 20 0 BEADLO CO[C@H]1CC[C@H]1[N@H+](C)Cc1ncccc1Cl ZINC000934107611 641071811 /nfs/dbraw/zinc/07/18/11/641071811.db2.gz XKNOFLRIUWCJOM-NEPJUHHUSA-N 1 2 240.734 2.344 20 0 BEADLO CO[C@H]1CC[C@H]1[N@@H+](C)Cc1ncccc1Cl ZINC000934107611 641071815 /nfs/dbraw/zinc/07/18/15/641071815.db2.gz XKNOFLRIUWCJOM-NEPJUHHUSA-N 1 2 240.734 2.344 20 0 BEADLO CO[C@H]1CC[C@@H]1[N@H+](C)Cc1ncc(Cl)s1 ZINC000934114294 641080849 /nfs/dbraw/zinc/08/08/49/641080849.db2.gz SAHSUMUKOULBKK-YUMQZZPRSA-N 1 2 246.763 2.406 20 0 BEADLO CO[C@H]1CC[C@@H]1[N@@H+](C)Cc1ncc(Cl)s1 ZINC000934114294 641080857 /nfs/dbraw/zinc/08/08/57/641080857.db2.gz SAHSUMUKOULBKK-YUMQZZPRSA-N 1 2 246.763 2.406 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@H+](C)Cc1csc(C)n1 ZINC000934120130 641082575 /nfs/dbraw/zinc/08/25/75/641082575.db2.gz ZZXCHRIJNHWYSD-GHMZBOCLSA-N 1 2 226.345 2.061 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@@H+](C)Cc1csc(C)n1 ZINC000934120130 641082578 /nfs/dbraw/zinc/08/25/78/641082578.db2.gz ZZXCHRIJNHWYSD-GHMZBOCLSA-N 1 2 226.345 2.061 20 0 BEADLO C[C@@H]([NH2+]Cc1cc2n(n1)CCC2)c1cncs1 ZINC000934193708 641097808 /nfs/dbraw/zinc/09/78/08/641097808.db2.gz LUHOAIYHCSIFLK-SECBINFHSA-N 1 2 248.355 2.137 20 0 BEADLO COc1ccc([C@@H]2CCC[N@@H+]2CCF)nc1 ZINC000934343427 641128324 /nfs/dbraw/zinc/12/83/24/641128324.db2.gz KSZCQCWLWCSBLR-LBPRGKRZSA-N 1 2 224.279 2.197 20 0 BEADLO COc1ccc([C@@H]2CCC[N@H+]2CCF)nc1 ZINC000934343427 641128329 /nfs/dbraw/zinc/12/83/29/641128329.db2.gz KSZCQCWLWCSBLR-LBPRGKRZSA-N 1 2 224.279 2.197 20 0 BEADLO CC(C)(O)C1CCN(c2cccc[nH+]2)CC1 ZINC000231287340 641154122 /nfs/dbraw/zinc/15/41/22/641154122.db2.gz DDDKRYKRIDQLJV-UHFFFAOYSA-N 1 2 220.316 2.069 20 0 BEADLO C[C@]1(C2CC2)COCC[N@@H+]1Cc1cncs1 ZINC000934474778 641168637 /nfs/dbraw/zinc/16/86/37/641168637.db2.gz HNTDFMCTEMXMTF-GFCCVEGCSA-N 1 2 238.356 2.144 20 0 BEADLO C[C@]1(C2CC2)COCC[N@H+]1Cc1cncs1 ZINC000934474778 641168643 /nfs/dbraw/zinc/16/86/43/641168643.db2.gz HNTDFMCTEMXMTF-GFCCVEGCSA-N 1 2 238.356 2.144 20 0 BEADLO C[C@@H]1SCC[N@H+](Cn2cc[nH]c2=S)[C@H]1C ZINC000173351535 641172859 /nfs/dbraw/zinc/17/28/59/641172859.db2.gz ZJWIGUAVCRLCCL-IUCAKERBSA-N 1 2 243.401 2.329 20 0 BEADLO C[C@@H]1SCC[N@@H+](Cn2cc[nH]c2=S)[C@H]1C ZINC000173351535 641172866 /nfs/dbraw/zinc/17/28/66/641172866.db2.gz ZJWIGUAVCRLCCL-IUCAKERBSA-N 1 2 243.401 2.329 20 0 BEADLO CCC[N@H+](C)Cn1sc2ccccc2c1=O ZINC000063730679 641220758 /nfs/dbraw/zinc/22/07/58/641220758.db2.gz GHVYIDAWNGLULF-UHFFFAOYSA-N 1 2 236.340 2.362 20 0 BEADLO CCC[N@@H+](C)Cn1sc2ccccc2c1=O ZINC000063730679 641220768 /nfs/dbraw/zinc/22/07/68/641220768.db2.gz GHVYIDAWNGLULF-UHFFFAOYSA-N 1 2 236.340 2.362 20 0 BEADLO C[C@@H](CC(=O)NCCCCn1cc[nH+]c1)C1CC1 ZINC000063802064 641238498 /nfs/dbraw/zinc/23/84/98/641238498.db2.gz YSZWXBFEIYETJP-LBPRGKRZSA-N 1 2 249.358 2.216 20 0 BEADLO CCCOC(=O)[C@H](C)[NH2+]C(C)(C)CSC ZINC000934673347 641241675 /nfs/dbraw/zinc/24/16/75/641241675.db2.gz BWWNSYCLPLMJCI-VIFPVBQESA-N 1 2 233.377 2.059 20 0 BEADLO Cc1nonc1C[NH2+][C@@H](c1ccncc1)C1CC1 ZINC000934695027 641249267 /nfs/dbraw/zinc/24/92/67/641249267.db2.gz KTXXSJSFESEQAB-CYBMUJFWSA-N 1 2 244.298 2.014 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccc(O)c(F)c2)CCO1 ZINC000232449607 641274022 /nfs/dbraw/zinc/27/40/22/641274022.db2.gz ZFSVHMOGYBFIKD-LLVKDONJSA-N 1 2 239.290 2.142 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccc(O)c(F)c2)CCO1 ZINC000232449607 641274027 /nfs/dbraw/zinc/27/40/27/641274027.db2.gz ZFSVHMOGYBFIKD-LLVKDONJSA-N 1 2 239.290 2.142 20 0 BEADLO CCCc1ccc(C(=O)NC2C[NH+](CC)C2)cc1 ZINC001030873126 641394122 /nfs/dbraw/zinc/39/41/22/641394122.db2.gz ZBIIDKPRRLVLDC-UHFFFAOYSA-N 1 2 246.354 2.073 20 0 BEADLO CC(C)C1CC[NH+](Cc2nncs2)CC1 ZINC000929719349 641418542 /nfs/dbraw/zinc/41/85/42/641418542.db2.gz OCTCGDKRWBVCPH-UHFFFAOYSA-N 1 2 225.361 2.406 20 0 BEADLO O=C(CNc1cccc[nH+]1)NC1CCC=CCC1 ZINC000925390575 641418907 /nfs/dbraw/zinc/41/89/07/641418907.db2.gz XNTOAUAMCSARTG-UHFFFAOYSA-N 1 2 245.326 2.109 20 0 BEADLO CCC1(CC)CCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC000913807019 641482780 /nfs/dbraw/zinc/48/27/80/641482780.db2.gz PSIZWTHJDBJUSF-UHFFFAOYSA-N 1 2 235.331 2.133 20 0 BEADLO CC1=CCCN(C(=O)c2cc3c[nH+]ccc3[nH]2)C1 ZINC000935791037 641482827 /nfs/dbraw/zinc/48/28/27/641482827.db2.gz FMKLQCDIMXGPSB-UHFFFAOYSA-N 1 2 241.294 2.355 20 0 BEADLO c1nnc(C[N@@H+]2CC[C@H]2Cc2ccccc2)s1 ZINC000929813632 641650747 /nfs/dbraw/zinc/65/07/47/641650747.db2.gz GKYNMZLRLGYRKT-LBPRGKRZSA-N 1 2 245.351 2.355 20 0 BEADLO c1nnc(C[N@H+]2CC[C@H]2Cc2ccccc2)s1 ZINC000929813632 641650751 /nfs/dbraw/zinc/65/07/51/641650751.db2.gz GKYNMZLRLGYRKT-LBPRGKRZSA-N 1 2 245.351 2.355 20 0 BEADLO c1coc(-c2noc([C@H]3C[C@@H]3c3c[nH]c[nH+]3)n2)c1 ZINC000924002511 641719885 /nfs/dbraw/zinc/71/98/85/641719885.db2.gz AYWYTFHOCPSDSM-YUMQZZPRSA-N 1 2 242.238 2.324 20 0 BEADLO C[C@H]([N@H+](C)Cn1ncn(C)c1=S)C(C)(C)C ZINC000914569205 641736428 /nfs/dbraw/zinc/73/64/28/641736428.db2.gz UUXPWCBTJUGODH-VIFPVBQESA-N 1 2 242.392 2.275 20 0 BEADLO C[C@H]([N@@H+](C)Cn1ncn(C)c1=S)C(C)(C)C ZINC000914569205 641736437 /nfs/dbraw/zinc/73/64/37/641736437.db2.gz UUXPWCBTJUGODH-VIFPVBQESA-N 1 2 242.392 2.275 20 0 BEADLO CC[NH+]1CC(NC(=O)c2cccc(C(C)C)c2)C1 ZINC001031199617 641802689 /nfs/dbraw/zinc/80/26/89/641802689.db2.gz FPVPOBXTVJRSQF-UHFFFAOYSA-N 1 2 246.354 2.244 20 0 BEADLO CCn1cnn(C[N@H+](CC)CC2CC2)c1=S ZINC000732665445 641864064 /nfs/dbraw/zinc/86/40/64/641864064.db2.gz BTWVKCSWKCQZAS-UHFFFAOYSA-N 1 2 240.376 2.123 20 0 BEADLO CCn1cnn(C[N@@H+](CC)CC2CC2)c1=S ZINC000732665445 641864070 /nfs/dbraw/zinc/86/40/70/641864070.db2.gz BTWVKCSWKCQZAS-UHFFFAOYSA-N 1 2 240.376 2.123 20 0 BEADLO C=CC[N@@H+](CCOC)Cc1cnc(Cl)s1 ZINC000191087552 641899536 /nfs/dbraw/zinc/89/95/36/641899536.db2.gz GKESBHONZVBMLM-UHFFFAOYSA-N 1 2 246.763 2.431 20 0 BEADLO C=CC[N@H+](CCOC)Cc1cnc(Cl)s1 ZINC000191087552 641899539 /nfs/dbraw/zinc/89/95/39/641899539.db2.gz GKESBHONZVBMLM-UHFFFAOYSA-N 1 2 246.763 2.431 20 0 BEADLO Cc1nc(NCCNc2ccccc2)cc[nH+]1 ZINC000078292436 641910679 /nfs/dbraw/zinc/91/06/79/641910679.db2.gz RSQDCFPHELJVEV-UHFFFAOYSA-N 1 2 228.299 2.309 20 0 BEADLO CC(C)CC(=O)OCn1c[nH+]c2c1CCCC2 ZINC000917777416 642121921 /nfs/dbraw/zinc/12/19/21/642121921.db2.gz HISFOHOGHOOVEI-UHFFFAOYSA-N 1 2 236.315 2.309 20 0 BEADLO CC1(C(=O)NNc2cc[nH+]cc2Cl)CCC1 ZINC000154671283 642179498 /nfs/dbraw/zinc/17/94/98/642179498.db2.gz SOLUSZQZZDBQGB-UHFFFAOYSA-N 1 2 239.706 2.368 20 0 BEADLO O=C(N[C@H]1CC=CCC1)c1cc2c[nH+]ccc2[nH]1 ZINC000933179000 642377242 /nfs/dbraw/zinc/37/72/42/642377242.db2.gz GNFMXRTXUJPDJG-NSHDSACASA-N 1 2 241.294 2.401 20 0 BEADLO C[N@H+](CC1CC1)Cn1sc2ccccc2c1=O ZINC000919942235 642410567 /nfs/dbraw/zinc/41/05/67/642410567.db2.gz MMFDJEPSSHRLGU-UHFFFAOYSA-N 1 2 248.351 2.362 20 0 BEADLO C[N@@H+](CC1CC1)Cn1sc2ccccc2c1=O ZINC000919942235 642410573 /nfs/dbraw/zinc/41/05/73/642410573.db2.gz MMFDJEPSSHRLGU-UHFFFAOYSA-N 1 2 248.351 2.362 20 0 BEADLO CC[C@@H]1CCCC[N@@H+]1Cc1nnc(OC)s1 ZINC000920257390 642460461 /nfs/dbraw/zinc/46/04/61/642460461.db2.gz SKSHCVDCPOJVAH-SECBINFHSA-N 1 2 241.360 2.311 20 0 BEADLO CC[C@@H]1CCCC[N@H+]1Cc1nnc(OC)s1 ZINC000920257390 642460467 /nfs/dbraw/zinc/46/04/67/642460467.db2.gz SKSHCVDCPOJVAH-SECBINFHSA-N 1 2 241.360 2.311 20 0 BEADLO CC[C@H]1CCCC[N@@H+]1Cc1nnc(OC)s1 ZINC000920257391 642461747 /nfs/dbraw/zinc/46/17/47/642461747.db2.gz SKSHCVDCPOJVAH-VIFPVBQESA-N 1 2 241.360 2.311 20 0 BEADLO CC[C@H]1CCCC[N@H+]1Cc1nnc(OC)s1 ZINC000920257391 642461750 /nfs/dbraw/zinc/46/17/50/642461750.db2.gz SKSHCVDCPOJVAH-VIFPVBQESA-N 1 2 241.360 2.311 20 0 BEADLO C[N@H+](Cc1cc2ccccc2o1)[C@H]1CCOC1=O ZINC000175191816 642655644 /nfs/dbraw/zinc/65/56/44/642655644.db2.gz AAJJSEYQXHOGKY-LBPRGKRZSA-N 1 2 245.278 2.180 20 0 BEADLO C[N@@H+](Cc1cc2ccccc2o1)[C@H]1CCOC1=O ZINC000175191816 642655650 /nfs/dbraw/zinc/65/56/50/642655650.db2.gz AAJJSEYQXHOGKY-LBPRGKRZSA-N 1 2 245.278 2.180 20 0 BEADLO C[NH+](C)[C@@H](C(=O)OCCCC#N)c1ccccc1 ZINC000181982990 642937847 /nfs/dbraw/zinc/93/78/47/642937847.db2.gz FWKCEACJGHEKFT-CYBMUJFWSA-N 1 2 246.310 2.136 20 0 BEADLO Cc1nonc1C[NH2+][C@H](C)c1ccc(F)cc1 ZINC000070261742 643007551 /nfs/dbraw/zinc/00/75/51/643007551.db2.gz YCLRLXXFJVVXET-MRVPVSSYSA-N 1 2 235.262 2.368 20 0 BEADLO C[C@H]([NH2+]Cc1ccc(Cl)nc1)c1ncc[nH]1 ZINC000285978804 643089945 /nfs/dbraw/zinc/08/99/45/643089945.db2.gz HNEYTJWGMGJYTG-QMMMGPOBSA-N 1 2 236.706 2.309 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)[C@H](C)c1cnccn1 ZINC000184439210 643212207 /nfs/dbraw/zinc/21/22/07/643212207.db2.gz OUXUUERDRXFLAI-SNVBAGLBSA-N 1 2 246.314 2.274 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)[C@H](C)c1cnccn1 ZINC000184439210 643212213 /nfs/dbraw/zinc/21/22/13/643212213.db2.gz OUXUUERDRXFLAI-SNVBAGLBSA-N 1 2 246.314 2.274 20 0 BEADLO C[C@@H]1CC[C@H](O)C[N@@H+]1C/C(Cl)=C/Cl ZINC000306777436 643242464 /nfs/dbraw/zinc/24/24/64/643242464.db2.gz NGPGVKMMEDBHPR-KSVRDVHTSA-N 1 2 224.131 2.151 20 0 BEADLO C[C@@H]1CC[C@H](O)C[N@H+]1C/C(Cl)=C/Cl ZINC000306777436 643242467 /nfs/dbraw/zinc/24/24/67/643242467.db2.gz NGPGVKMMEDBHPR-KSVRDVHTSA-N 1 2 224.131 2.151 20 0 BEADLO C=CCCCO[NH+]=C(N)c1ccc(F)cc1 ZINC000077238720 643266285 /nfs/dbraw/zinc/26/62/85/643266285.db2.gz POCOOANPVONRSU-UHFFFAOYSA-N 1 2 222.263 2.429 20 0 BEADLO CC=C(C)C(=O)NNc1cc[nH+]cc1Cl ZINC000185258043 643280843 /nfs/dbraw/zinc/28/08/43/643280843.db2.gz WHPDXPVSOQIFND-XVNBXDOJSA-N 1 2 225.679 2.144 20 0 BEADLO CC(=O)C1CC[NH+](Cc2csc(C)n2)CC1 ZINC000082644815 643361339 /nfs/dbraw/zinc/36/13/39/643361339.db2.gz QSCUMLQEFIMAQS-UHFFFAOYSA-N 1 2 238.356 2.253 20 0 BEADLO Cc1cc(C)c(C(=O)NC/C=C\Cl)c(C)[nH+]1 ZINC000891195652 643546179 /nfs/dbraw/zinc/54/61/79/643546179.db2.gz JZALRQCUXOTZEE-PLNGDYQASA-N 1 2 238.718 2.489 20 0 BEADLO CC[NH2+]Cc1noc(C2(C)CCCC2)n1 ZINC000087318896 643655116 /nfs/dbraw/zinc/65/51/16/643655116.db2.gz IMPHKEXIYKTDDU-UHFFFAOYSA-N 1 2 209.293 2.011 20 0 BEADLO C=C(C)C[C@@H](C)C(=O)NNc1cc(C)[nH+]c(C)n1 ZINC000186427418 643732974 /nfs/dbraw/zinc/73/29/74/643732974.db2.gz WQFRWZOXLFHWNP-SECBINFHSA-N 1 2 248.330 2.139 20 0 BEADLO CCc1onc(C)c1C[N@@H+]1CCO[C@@H](CC)C1 ZINC000929257465 643831238 /nfs/dbraw/zinc/83/12/38/643831238.db2.gz MWFYLSWWQZFADO-NSHDSACASA-N 1 2 238.331 2.156 20 0 BEADLO CCc1onc(C)c1C[N@H+]1CCO[C@@H](CC)C1 ZINC000929257465 643831243 /nfs/dbraw/zinc/83/12/43/643831243.db2.gz MWFYLSWWQZFADO-NSHDSACASA-N 1 2 238.331 2.156 20 0 BEADLO C[C@H](c1nc(Cc2ccccc2F)no1)[NH+](C)C ZINC000923755035 643854693 /nfs/dbraw/zinc/85/46/93/643854693.db2.gz UHZGYOZJLUCAAC-SECBINFHSA-N 1 2 249.289 2.422 20 0 BEADLO CCC[N@H+](CCO)C/C(Cl)=C/Cl ZINC000086001421 643882779 /nfs/dbraw/zinc/88/27/79/643882779.db2.gz DDDXLIKDCPSXOL-VURMDHGXSA-N 1 2 212.120 2.010 20 0 BEADLO CCC[N@@H+](CCO)C/C(Cl)=C/Cl ZINC000086001421 643882781 /nfs/dbraw/zinc/88/27/81/643882781.db2.gz DDDXLIKDCPSXOL-VURMDHGXSA-N 1 2 212.120 2.010 20 0 BEADLO CC(F)(F)CCC(=O)OCc1ccc[nH+]c1N ZINC000922356074 643979944 /nfs/dbraw/zinc/97/99/44/643979944.db2.gz RDGNITBNQKUXQH-UHFFFAOYSA-N 1 2 244.241 2.142 20 0 BEADLO Nc1[nH+]cccc1COC(=O)C=C1CCCC1 ZINC000922373037 643981636 /nfs/dbraw/zinc/98/16/36/643981636.db2.gz GBHYSSQLISWDRU-UHFFFAOYSA-N 1 2 232.283 2.207 20 0 BEADLO CC(C)(C)/C=C\C(=O)OCc1ccc[nH+]c1N ZINC000922437299 643993494 /nfs/dbraw/zinc/99/34/94/643993494.db2.gz JFZABCPYHAVZMA-SREVYHEPSA-N 1 2 234.299 2.309 20 0 BEADLO CC(C)(C)/C=C/C(=O)OCc1ccc(N)[nH+]c1 ZINC000922438405 643993931 /nfs/dbraw/zinc/99/39/31/643993931.db2.gz MYFCNFIQSOFLSM-VOTSOKGWSA-N 1 2 234.299 2.309 20 0 BEADLO Nc1[nH+]cccc1COC(=O)[C@H]1[C@@H]2CCCC[C@@H]21 ZINC000922512714 644011057 /nfs/dbraw/zinc/01/10/57/644011057.db2.gz SMUANTUJBDWLBL-GDNZZTSVSA-N 1 2 246.310 2.143 20 0 BEADLO CC(C)=C(C)C(=O)OCc1ccc(N)[nH+]c1 ZINC000922513248 644011379 /nfs/dbraw/zinc/01/13/79/644011379.db2.gz WXLXKORDYCZBGP-UHFFFAOYSA-N 1 2 220.272 2.063 20 0 BEADLO c1c[nH]c(C[NH2+][C@H](c2ccccn2)C2CC2)n1 ZINC000922586867 644035622 /nfs/dbraw/zinc/03/56/22/644035622.db2.gz SBOWCLMOAXCMEV-ZDUSSCGKSA-N 1 2 228.299 2.046 20 0 BEADLO C[C@@H]1CCC[C@@H]1C(=O)OCc1ccc(N)[nH+]c1 ZINC000922606068 644040865 /nfs/dbraw/zinc/04/08/65/644040865.db2.gz VDTSCBGGGRUPIV-KOLCDFICSA-N 1 2 234.299 2.143 20 0 BEADLO COc1nccnc1C[NH2+]C(C)(C)/C=C/Cl ZINC000922645172 644051544 /nfs/dbraw/zinc/05/15/44/644051544.db2.gz NQPBDNFEJNKMNG-SNAWJCMRSA-N 1 2 241.722 2.106 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1C(=O)OCc1ccc(N)[nH+]c1 ZINC000922775051 644090668 /nfs/dbraw/zinc/09/06/68/644090668.db2.gz HWTPATCFTFYLQH-VXGBXAGGSA-N 1 2 248.326 2.389 20 0 BEADLO Nc1ccc(COC(=O)C[C@@H]2CC[C@H]3C[C@H]32)c[nH+]1 ZINC000922779412 644093764 /nfs/dbraw/zinc/09/37/64/644093764.db2.gz WIKRETLJHBEMPE-SDDRHHMPSA-N 1 2 246.310 2.143 20 0 BEADLO Nc1[nH+]cccc1COC(=O)C[C@@H]1CC[C@@H]2C[C@@H]21 ZINC000922777754 644094607 /nfs/dbraw/zinc/09/46/07/644094607.db2.gz AGFBUENSQMCEEW-SCVCMEIPSA-N 1 2 246.310 2.143 20 0 BEADLO C[C@]1(C(=O)OCc2ccc(N)[nH+]c2)CC=CCC1 ZINC000922782216 644095339 /nfs/dbraw/zinc/09/53/39/644095339.db2.gz PKPTUOIFVXGOOU-AWEZNQCLSA-N 1 2 246.310 2.453 20 0 BEADLO Nc1ccc(COC(=O)/C=C\C2CCCC2)c[nH+]1 ZINC000922840151 644117084 /nfs/dbraw/zinc/11/70/84/644117084.db2.gz UYNQMZFZSOFHLX-VURMDHGXSA-N 1 2 246.310 2.453 20 0 BEADLO Nc1[nH+]cccc1COC(=O)C[C@@H]1C[C@H]1C1CC1 ZINC000922933350 644192326 /nfs/dbraw/zinc/19/23/26/644192326.db2.gz KYLOGYOPAODSMG-RYUDHWBXSA-N 1 2 246.310 2.143 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1cc(C2CC2)n(C)n1 ZINC000922957119 644200527 /nfs/dbraw/zinc/20/05/27/644200527.db2.gz MWHZMCNXGCBPJZ-UHFFFAOYSA-N 1 2 245.326 2.489 20 0 BEADLO CCc1onc(C)c1C[NH2+]Cc1oc(C)nc1C ZINC000922984395 644211148 /nfs/dbraw/zinc/21/11/48/644211148.db2.gz QGRIMOFNAIIFSI-UHFFFAOYSA-N 1 2 249.314 2.440 20 0 BEADLO Nc1cc(COC(=O)C2(C3CC3)CCC2)cc[nH+]1 ZINC000923337132 644357146 /nfs/dbraw/zinc/35/71/46/644357146.db2.gz JWYSNJVAUIMYNG-UHFFFAOYSA-N 1 2 246.310 2.287 20 0 BEADLO O=C(NC1CCCCC1)c1cccc2[nH+]ccn21 ZINC000082301536 644366311 /nfs/dbraw/zinc/36/63/11/644366311.db2.gz GMCNGRKWQARFSF-UHFFFAOYSA-N 1 2 243.310 2.397 20 0 BEADLO Cc1noc(C)c1CCCNc1cc[nH+]c(C)n1 ZINC000084928262 644436325 /nfs/dbraw/zinc/43/63/25/644436325.db2.gz XAMAPUSVQPCALU-UHFFFAOYSA-N 1 2 246.314 2.435 20 0 BEADLO CC[C@@H](C)[C@H](C)C(=O)OCc1c[nH+]cn1C ZINC000780400779 644730245 /nfs/dbraw/zinc/73/02/45/644730245.db2.gz LTZYNZMVDYEORE-ZJUUUORDSA-N 1 2 224.304 2.146 20 0 BEADLO C[C@@H]1CC[C@H]1[NH2+]c1ccc(N(C)CCO)cc1 ZINC000783280319 644752353 /nfs/dbraw/zinc/75/23/53/644752353.db2.gz JLPKFTASLXWXPF-BXUZGUMPSA-N 1 2 234.343 2.326 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)CCC(C)(C)C ZINC000793243439 644802023 /nfs/dbraw/zinc/80/20/23/644802023.db2.gz URTSNMPTKHUEKV-UHFFFAOYSA-N 1 2 238.331 2.332 20 0 BEADLO CC[C@H](C)[C@H]([NH2+][C@H]1CS[C@H](C)C1)C(=O)OC ZINC000251934301 644831549 /nfs/dbraw/zinc/83/15/49/644831549.db2.gz RRJPEPMQXZPOFS-ZDCRXTMVSA-N 1 2 245.388 2.058 20 0 BEADLO CO[C@H]1C[C@@H]([NH2+]CC(F)(F)C(F)F)C1(C)C ZINC000304541591 644914811 /nfs/dbraw/zinc/91/48/11/644914811.db2.gz NMWSWUYKLPVDSY-RQJHMYQMSA-N 1 2 243.244 2.290 20 0 BEADLO O=C(OC1CCC1)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000830382909 645123551 /nfs/dbraw/zinc/12/35/51/645123551.db2.gz BZFDIZNDABDMIG-LLVKDONJSA-N 1 2 249.314 2.209 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NCCC[C@@H]1C=CCC1 ZINC000834326059 645138491 /nfs/dbraw/zinc/13/84/91/645138491.db2.gz ABRRHRYYPGCWIW-GFCCVEGCSA-N 1 2 247.342 2.205 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NCCC[C@@H]1C=CCC1 ZINC000834326059 645138499 /nfs/dbraw/zinc/13/84/99/645138499.db2.gz ABRRHRYYPGCWIW-GFCCVEGCSA-N 1 2 247.342 2.205 20 0 BEADLO CC/C=C/COC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000845448896 645361575 /nfs/dbraw/zinc/36/15/75/645361575.db2.gz MLRZHJVJILVMRX-ZWNMCFTASA-N 1 2 222.288 2.344 20 0 BEADLO C[C@@H](CC(=O)OC[C@@H]1C[C@H]1C)n1cc[nH+]c1 ZINC000845453827 645363421 /nfs/dbraw/zinc/36/34/21/645363421.db2.gz VZDKLQHGKOZFIN-VWYCJHECSA-N 1 2 222.288 2.033 20 0 BEADLO CCn1nc(C)c([C@@H](C)[NH2+]CC(C)(C)F)n1 ZINC000926780711 645428119 /nfs/dbraw/zinc/42/81/19/645428119.db2.gz RMAJAOAQVOVYQA-MRVPVSSYSA-N 1 2 228.315 2.005 20 0 BEADLO C[C@H]([N@@H+]1CCO[C@@H](C(F)F)C1)C1(Cl)CC1 ZINC000926824834 645442978 /nfs/dbraw/zinc/44/29/78/645442978.db2.gz ZZIZMXJFBOIKRX-JGVFFNPUSA-N 1 2 239.693 2.112 20 0 BEADLO C[C@H]([N@H+]1CCO[C@@H](C(F)F)C1)C1(Cl)CC1 ZINC000926824834 645442983 /nfs/dbraw/zinc/44/29/83/645442983.db2.gz ZZIZMXJFBOIKRX-JGVFFNPUSA-N 1 2 239.693 2.112 20 0 BEADLO Cc1cc(N[C@H](C)C[C@@H]2CCC(=O)N2)c[nH+]c1C ZINC000926854662 645457209 /nfs/dbraw/zinc/45/72/09/645457209.db2.gz FJKRXFKZLAIWFR-PWSUYJOCSA-N 1 2 247.342 2.168 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cc[nH]c(=O)c1)C(F)F ZINC000926864049 645464323 /nfs/dbraw/zinc/46/43/23/645464323.db2.gz FUSBKMXILXHFMA-NKWVEPMBSA-N 1 2 216.231 2.091 20 0 BEADLO C1=C[C@@H](Nc2cc(NCC3CC3)[nH+]cn2)CC1 ZINC000853799094 645498636 /nfs/dbraw/zinc/49/86/36/645498636.db2.gz ADPYVJOILGSVHM-LLVKDONJSA-N 1 2 230.315 2.429 20 0 BEADLO C1=C[C@@H](Nc2cc(NCC3CC3)nc[nH+]2)CC1 ZINC000853799094 645498642 /nfs/dbraw/zinc/49/86/42/645498642.db2.gz ADPYVJOILGSVHM-LLVKDONJSA-N 1 2 230.315 2.429 20 0 BEADLO Cc1noc(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)n1 ZINC000857200121 645539789 /nfs/dbraw/zinc/53/97/89/645539789.db2.gz GPLXMZSTXBMBAX-JTQLQIEISA-N 1 2 243.310 2.497 20 0 BEADLO Cc1noc(C[N@H+]2Cc3ccccc3[C@@H](C)C2)n1 ZINC000857200121 645539793 /nfs/dbraw/zinc/53/97/93/645539793.db2.gz GPLXMZSTXBMBAX-JTQLQIEISA-N 1 2 243.310 2.497 20 0 BEADLO Cc1ccc(F)cc1NC(=O)Cc1[nH]cc[nH+]1 ZINC000857430755 645553864 /nfs/dbraw/zinc/55/38/64/645553864.db2.gz WUTXKHXKRCGVHH-UHFFFAOYSA-N 1 2 233.246 2.038 20 0 BEADLO Cc1ccc(NC(=O)Cc2[nH]cc[nH+]2)c(F)c1 ZINC000857434179 645556536 /nfs/dbraw/zinc/55/65/36/645556536.db2.gz ZBUUQUSSZMWKLW-UHFFFAOYSA-N 1 2 233.246 2.038 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C1([C@H]2CCCCO2)CC1 ZINC000927165135 645581052 /nfs/dbraw/zinc/58/10/52/645581052.db2.gz ZSWNCIWJKGXURZ-GXFFZTMASA-N 1 2 249.358 2.470 20 0 BEADLO CSC(C)(C)C(=O)Nc1cccc2[nH+]ccn21 ZINC000857589448 645620747 /nfs/dbraw/zinc/62/07/47/645620747.db2.gz GFQJGUABNFFGAT-UHFFFAOYSA-N 1 2 249.339 2.414 20 0 BEADLO CCC[C@@H](CC)C(=O)NCc1ccc(N)[nH+]c1 ZINC000927778139 645655305 /nfs/dbraw/zinc/65/53/05/645655305.db2.gz TWGCXAKRDRIBRJ-LLVKDONJSA-N 1 2 235.331 2.106 20 0 BEADLO CC(C)C[C@@H](C)CC(=O)NCc1ccc(N)[nH+]c1 ZINC000927780849 645658728 /nfs/dbraw/zinc/65/87/28/645658728.db2.gz PAERFVQZANHKHY-LLVKDONJSA-N 1 2 249.358 2.352 20 0 BEADLO Nc1ccc(CNC(=O)C[C@H]2CC=CCC2)c[nH+]1 ZINC000927778744 645659582 /nfs/dbraw/zinc/65/95/82/645659582.db2.gz ZNVMUUYIRMHGNJ-NSHDSACASA-N 1 2 245.326 2.026 20 0 BEADLO CC(C)(F)C[NH2+]Cc1cnn(-c2ccccc2)n1 ZINC000865653418 645722073 /nfs/dbraw/zinc/72/20/73/645722073.db2.gz FYYGDKHFQYSKKW-UHFFFAOYSA-N 1 2 248.305 2.105 20 0 BEADLO C[C@@H]([NH2+]Cc1ccc2nonc2c1)c1ncco1 ZINC000886538107 645887902 /nfs/dbraw/zinc/88/79/02/645887902.db2.gz BNWQVMVVOLOUIG-MRVPVSSYSA-N 1 2 244.254 2.062 20 0 BEADLO C[C@H]1CCCN(C(=O)c2cc3c[nH+]ccc3[nH]2)C1 ZINC000929138196 645967150 /nfs/dbraw/zinc/96/71/50/645967150.db2.gz RDAZIFOOUNITNY-JTQLQIEISA-N 1 2 243.310 2.435 20 0 BEADLO Cc1cn(C)nc1C[N@H+](C)Cc1ccsc1 ZINC000929180956 645991598 /nfs/dbraw/zinc/99/15/98/645991598.db2.gz VJNFONOVWXZKND-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1cn(C)nc1C[N@@H+](C)Cc1ccsc1 ZINC000929180956 645991610 /nfs/dbraw/zinc/99/16/10/645991610.db2.gz VJNFONOVWXZKND-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO CC(C)c1nsc(C[NH+]2CCCC2)n1 ZINC000929213297 646010677 /nfs/dbraw/zinc/01/06/77/646010677.db2.gz XUCKFQAZQUEFJO-UHFFFAOYSA-N 1 2 211.334 2.257 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)C[C@@H]1CC=CCC1 ZINC000924252580 646014843 /nfs/dbraw/zinc/01/48/43/646014843.db2.gz YFMIHXOPEMEUHJ-GFCCVEGCSA-N 1 2 248.326 2.252 20 0 BEADLO Cc1nonc1[C@H](C)[NH2+]Cc1ccc(F)cc1 ZINC000924525325 646045798 /nfs/dbraw/zinc/04/57/98/646045798.db2.gz NBPGGVWULXRJQL-QMMMGPOBSA-N 1 2 235.262 2.368 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCCc2occc21)c1cnn(C)n1 ZINC000924645013 646083867 /nfs/dbraw/zinc/08/38/67/646083867.db2.gz UJPJABYVEDTJHG-KOLCDFICSA-N 1 2 246.314 2.136 20 0 BEADLO COc1cc([C@@H](C)[NH2+]Cc2cccc(C)n2)on1 ZINC000924723938 646095056 /nfs/dbraw/zinc/09/50/56/646095056.db2.gz PMJYKYDFGBDTQU-SNVBAGLBSA-N 1 2 247.298 2.237 20 0 BEADLO COc1cc([C@H](C)[NH2+]Cc2ccoc2)on1 ZINC000924751405 646101325 /nfs/dbraw/zinc/10/13/25/646101325.db2.gz WSMQCUZZTYUNGP-QMMMGPOBSA-N 1 2 222.244 2.127 20 0 BEADLO CC[C@@H]1C[C@H]1C[N@H+](CCOC)CC(F)F ZINC000929516950 646164819 /nfs/dbraw/zinc/16/48/19/646164819.db2.gz VSMCDFOTESVGEJ-ZJUUUORDSA-N 1 2 221.291 2.246 20 0 BEADLO CC[C@@H]1C[C@H]1C[N@@H+](CCOC)CC(F)F ZINC000929516950 646164821 /nfs/dbraw/zinc/16/48/21/646164821.db2.gz VSMCDFOTESVGEJ-ZJUUUORDSA-N 1 2 221.291 2.246 20 0 BEADLO COc1nnc(C[NH+]2[C@H](C)CCC[C@H]2C)s1 ZINC000929604933 646195488 /nfs/dbraw/zinc/19/54/88/646195488.db2.gz NYFXOMYBUNOQOY-RKDXNWHRSA-N 1 2 241.360 2.310 20 0 BEADLO COc1nnc(C[N@@H+]2CCC[C@@H](C)[C@H]2C)s1 ZINC000929703374 646258533 /nfs/dbraw/zinc/25/85/33/646258533.db2.gz MEIXGXWYONVYCK-RKDXNWHRSA-N 1 2 241.360 2.167 20 0 BEADLO COc1nnc(C[N@H+]2CCC[C@@H](C)[C@H]2C)s1 ZINC000929703374 646258535 /nfs/dbraw/zinc/25/85/35/646258535.db2.gz MEIXGXWYONVYCK-RKDXNWHRSA-N 1 2 241.360 2.167 20 0 BEADLO COc1nnc(C[N@@H+]2C[C@H](C)CC[C@@H]2C)s1 ZINC000929756625 646288317 /nfs/dbraw/zinc/28/83/17/646288317.db2.gz IHKHEHDYBICYDS-BDAKNGLRSA-N 1 2 241.360 2.167 20 0 BEADLO COc1nnc(C[N@H+]2C[C@H](C)CC[C@@H]2C)s1 ZINC000929756625 646288322 /nfs/dbraw/zinc/28/83/22/646288322.db2.gz IHKHEHDYBICYDS-BDAKNGLRSA-N 1 2 241.360 2.167 20 0 BEADLO CCc1onc(C)c1C[N@@H+]1CCO[C@H](C)[C@H]1C ZINC000929848131 646357883 /nfs/dbraw/zinc/35/78/83/646357883.db2.gz QTLGGVJQLMSOSL-GHMZBOCLSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1onc(C)c1C[N@H+]1CCO[C@H](C)[C@H]1C ZINC000929848131 646357891 /nfs/dbraw/zinc/35/78/91/646357891.db2.gz QTLGGVJQLMSOSL-GHMZBOCLSA-N 1 2 238.331 2.155 20 0 BEADLO Cc1cc(C)nc(C[N@H+]2CCO[C@H](C)[C@@H]2C)c1 ZINC000929848087 646358256 /nfs/dbraw/zinc/35/82/56/646358256.db2.gz QBUAOPXMWZGAQN-QWHCGFSZSA-N 1 2 234.343 2.308 20 0 BEADLO Cc1cc(C)nc(C[N@@H+]2CCO[C@H](C)[C@@H]2C)c1 ZINC000929848087 646358261 /nfs/dbraw/zinc/35/82/61/646358261.db2.gz QBUAOPXMWZGAQN-QWHCGFSZSA-N 1 2 234.343 2.308 20 0 BEADLO CCc1onc(C)c1C[N@@H+]1CCO[C@@H](C)[C@H]1C ZINC000929848133 646359106 /nfs/dbraw/zinc/35/91/06/646359106.db2.gz QTLGGVJQLMSOSL-MNOVXSKESA-N 1 2 238.331 2.155 20 0 BEADLO CCc1onc(C)c1C[N@H+]1CCO[C@@H](C)[C@H]1C ZINC000929848133 646359110 /nfs/dbraw/zinc/35/91/10/646359110.db2.gz QTLGGVJQLMSOSL-MNOVXSKESA-N 1 2 238.331 2.155 20 0 BEADLO Cc1nonc1[C@@H](C)[NH2+][C@H](C)c1ccc[nH]1 ZINC000925644971 646387735 /nfs/dbraw/zinc/38/77/35/646387735.db2.gz NSPDSWSFIPQGMJ-HTQZYQBOSA-N 1 2 220.276 2.118 20 0 BEADLO COc1nnc(C[N@H+](C(C)C)C2CCC2)s1 ZINC000929995003 646388613 /nfs/dbraw/zinc/38/86/13/646388613.db2.gz WIAXPXSWNCBNFW-UHFFFAOYSA-N 1 2 241.360 2.310 20 0 BEADLO COc1nnc(C[N@@H+](C(C)C)C2CCC2)s1 ZINC000929995003 646388620 /nfs/dbraw/zinc/38/86/20/646388620.db2.gz WIAXPXSWNCBNFW-UHFFFAOYSA-N 1 2 241.360 2.310 20 0 BEADLO C[N@H+](Cc1c(F)cncc1F)[C@H]1CCSC1 ZINC000930094789 646431880 /nfs/dbraw/zinc/43/18/80/646431880.db2.gz UKVIHCWURXXJGF-QMMMGPOBSA-N 1 2 244.310 2.297 20 0 BEADLO C[N@@H+](Cc1c(F)cncc1F)[C@H]1CCSC1 ZINC000930094789 646431888 /nfs/dbraw/zinc/43/18/88/646431888.db2.gz UKVIHCWURXXJGF-QMMMGPOBSA-N 1 2 244.310 2.297 20 0 BEADLO Cc1cn(C)nc1C[N@@H+](C)[C@H](C)c1cccnc1 ZINC000930120204 646441289 /nfs/dbraw/zinc/44/12/89/646441289.db2.gz ZAAMRUVPFCPPJN-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cn(C)nc1C[N@H+](C)[C@H](C)c1cccnc1 ZINC000930120204 646441297 /nfs/dbraw/zinc/44/12/97/646441297.db2.gz ZAAMRUVPFCPPJN-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1cnn(C)n1)c1ccsc1 ZINC000926368928 646628249 /nfs/dbraw/zinc/62/82/49/646628249.db2.gz GRBBGOASFCBIAG-RKDXNWHRSA-N 1 2 236.344 2.288 20 0 BEADLO Cc1cc(NC(=O)C[C@@H]([NH3+])C(F)F)ccc1F ZINC000724738657 711609844 /nfs/dbraw/zinc/60/98/44/711609844.db2.gz IODDBXYGQMSKAV-SECBINFHSA-N 1 2 246.232 2.055 20 0 BEADLO [NH3+][C@@H](CC(=O)Nc1cccc(Cl)c1)C(F)F ZINC000724741770 711610140 /nfs/dbraw/zinc/61/01/40/711610140.db2.gz YXTHOKJBSQRCPS-QMMMGPOBSA-N 1 2 248.660 2.261 20 0 BEADLO CC1(O)CC[NH+](Cc2scnc2Cl)CC1 ZINC000721930210 711939427 /nfs/dbraw/zinc/93/94/27/711939427.db2.gz VVBDKZLMDGCONO-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO C[C@H](O)C[N@H+](Cc1scnc1Cl)C1CC1 ZINC000721954694 711947738 /nfs/dbraw/zinc/94/77/38/711947738.db2.gz JZKNANQLIUHXTH-ZETCQYMHSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@H](O)C[N@@H+](Cc1scnc1Cl)C1CC1 ZINC000721954694 711947742 /nfs/dbraw/zinc/94/77/42/711947742.db2.gz JZKNANQLIUHXTH-ZETCQYMHSA-N 1 2 246.763 2.142 20 0 BEADLO COC(C)(C)[C@@H](C)[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000707230262 712167225 /nfs/dbraw/zinc/16/72/25/712167225.db2.gz ORMZQVLWDLBQNH-VHSXEESVSA-N 1 2 245.363 2.120 20 0 BEADLO C[C@H]1CCC(C)(C)C[C@@H]1[NH2+]Cc1cn[nH]n1 ZINC000713097216 712452268 /nfs/dbraw/zinc/45/22/68/712452268.db2.gz PBPLFYCSSBBQPK-ONGXEEELSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@H](C[N@H+](C1CC1)C1COC1)C(F)(F)F ZINC000451125968 1166460863 /nfs/dbraw/zinc/46/08/63/1166460863.db2.gz PFDYKOOIXWAVKH-SSDOTTSWSA-N 1 2 223.238 2.048 20 0 BEADLO C[C@H](C[N@@H+](C1CC1)C1COC1)C(F)(F)F ZINC000451125968 1166460871 /nfs/dbraw/zinc/46/08/71/1166460871.db2.gz PFDYKOOIXWAVKH-SSDOTTSWSA-N 1 2 223.238 2.048 20 0 BEADLO CC1(C(=O)NCc2[nH]c3c([nH+]2)CCCC3)CCC1 ZINC001156891552 1169428685 /nfs/dbraw/zinc/42/86/85/1169428685.db2.gz IZDZMGADLFSDSD-UHFFFAOYSA-N 1 2 247.342 2.095 20 0 BEADLO CC[C@@H]1CC[C@H]1[NH2+][C@@H](C)C(=O)OCC(C)C ZINC000381407765 710634463 /nfs/dbraw/zinc/63/44/63/710634463.db2.gz SVZJWMGCRWBGFO-QJPTWQEYSA-N 1 2 227.348 2.352 20 0 BEADLO Cc1cncc([C@@H](C)[NH2+]Cc2ccon2)c1 ZINC000381526076 710652085 /nfs/dbraw/zinc/65/20/85/710652085.db2.gz WSFKGOALOQPFLK-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO C[C@@H]1CCC[C@H](N(C)C(=O)C[C@@H]([NH3+])C(F)F)C1 ZINC000724757045 710746391 /nfs/dbraw/zinc/74/63/91/710746391.db2.gz AMMKAMDIYFDTPR-KXUCPTDWSA-N 1 2 248.317 2.006 20 0 BEADLO CCc1ccccc1NC(=O)C[C@H]([NH3+])C(F)F ZINC000724763282 710746766 /nfs/dbraw/zinc/74/67/66/710746766.db2.gz WSZTWXKXNCJBTN-VIFPVBQESA-N 1 2 242.269 2.170 20 0 BEADLO CC[NH2+]Cc1noc([C@H]2CC[C@@H](C)C2)n1 ZINC000390781468 711134381 /nfs/dbraw/zinc/13/43/81/711134381.db2.gz KFZJVTIPXIAWMO-BDAKNGLRSA-N 1 2 209.293 2.083 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2CC[C@H](C)C2)n1 ZINC000390781469 711134521 /nfs/dbraw/zinc/13/45/21/711134521.db2.gz KFZJVTIPXIAWMO-DTWKUNHWSA-N 1 2 209.293 2.083 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2cccc(F)c2)[nH]1 ZINC000392442899 711147072 /nfs/dbraw/zinc/14/70/72/711147072.db2.gz BWWXDOBWDBCEMJ-QMMMGPOBSA-N 1 2 234.278 2.103 20 0 BEADLO CCn1c(C)nn(C[N@H+](C)CC(C)C)c1=S ZINC000726589881 711439209 /nfs/dbraw/zinc/43/92/09/711439209.db2.gz ZDJIVZQPZJCQTD-UHFFFAOYSA-N 1 2 242.392 2.288 20 0 BEADLO CCn1c(C)nn(C[N@@H+](C)CC(C)C)c1=S ZINC000726589881 711439210 /nfs/dbraw/zinc/43/92/10/711439210.db2.gz ZDJIVZQPZJCQTD-UHFFFAOYSA-N 1 2 242.392 2.288 20 0 BEADLO CCCC[N@H+](C)Cn1c2ccccc2n(C)c1=O ZINC000074172749 711463229 /nfs/dbraw/zinc/46/32/29/711463229.db2.gz SSBQTSIFGFSZQU-UHFFFAOYSA-N 1 2 247.342 2.029 20 0 BEADLO CCCC[N@@H+](C)Cn1c2ccccc2n(C)c1=O ZINC000074172749 711463231 /nfs/dbraw/zinc/46/32/31/711463231.db2.gz SSBQTSIFGFSZQU-UHFFFAOYSA-N 1 2 247.342 2.029 20 0 BEADLO CC[C@@H](Nc1cc[nH+]cc1F)[C@H]1CCCOC1 ZINC000723843889 711538697 /nfs/dbraw/zinc/53/86/97/711538697.db2.gz VEBDQDMHESMOHK-CMPLNLGQSA-N 1 2 238.306 2.260 20 0 BEADLO Cc1ccc(F)cc1NC(=O)C[C@H]([NH3+])C(F)F ZINC000724738194 711610297 /nfs/dbraw/zinc/61/02/97/711610297.db2.gz FAVMXXKQFYSGAN-QMMMGPOBSA-N 1 2 246.232 2.055 20 0 BEADLO CC(C)CCN(C(=O)C[C@@H]([NH3+])C(F)F)C1CC1 ZINC000724760538 711610470 /nfs/dbraw/zinc/61/04/70/711610470.db2.gz YIUKKHKYYWZHTA-SNVBAGLBSA-N 1 2 248.317 2.006 20 0 BEADLO COc1cccnc1C[NH2+][C@@H](C)c1ccns1 ZINC000926549419 711637172 /nfs/dbraw/zinc/63/71/72/711637172.db2.gz HSXJFMYBHGZOON-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO Cc1nc(NCc2ccc(Cl)nc2)cc[nH+]1 ZINC000309716947 711700486 /nfs/dbraw/zinc/70/04/86/711700486.db2.gz UFZSAAWVRUIRAT-UHFFFAOYSA-N 1 2 234.690 2.446 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1CC[C@@H](C2CC2)O1 ZINC000722326658 711737830 /nfs/dbraw/zinc/73/78/30/711737830.db2.gz WKVOSMMINGEYMS-RYUDHWBXSA-N 1 2 248.326 2.460 20 0 BEADLO CC(C)O[C@]1(CNc2cccc[nH+]2)CCOC1 ZINC000722361646 711748961 /nfs/dbraw/zinc/74/89/61/711748961.db2.gz OMRQPNFKQZISMU-ZDUSSCGKSA-N 1 2 236.315 2.078 20 0 BEADLO CC(=O)C1CC[NH+](Cc2cncc(F)c2)CC1 ZINC000232455799 711760669 /nfs/dbraw/zinc/76/06/69/711760669.db2.gz WTPSANDDFVOUKR-UHFFFAOYSA-N 1 2 236.290 2.022 20 0 BEADLO C[C@@H]1[C@H](C)CN(c2cc(N(C)C)[nH+]cn2)[C@H]1C ZINC000894235689 711765594 /nfs/dbraw/zinc/76/55/94/711765594.db2.gz OXIOWVXDTXYFRK-MXWKQRLJSA-N 1 2 234.347 2.023 20 0 BEADLO C[C@@H]1[C@H](C)CN(c2cc(N(C)C)nc[nH+]2)[C@H]1C ZINC000894235689 711765595 /nfs/dbraw/zinc/76/55/95/711765595.db2.gz OXIOWVXDTXYFRK-MXWKQRLJSA-N 1 2 234.347 2.023 20 0 BEADLO CC[C@@H]([NH2+]Cc1cc[nH]n1)c1cccc(OC)n1 ZINC000924989609 711767801 /nfs/dbraw/zinc/76/78/01/711767801.db2.gz GGIPXRSCMHNROG-LLVKDONJSA-N 1 2 246.314 2.054 20 0 BEADLO CCn1cc(C[N@@H+]2CCC[C@H](F)C2)c(C)n1 ZINC000895191358 711779905 /nfs/dbraw/zinc/77/99/05/711779905.db2.gz OKEUIYUBLVKCBY-LBPRGKRZSA-N 1 2 225.311 2.145 20 0 BEADLO CCn1cc(C[N@H+]2CCC[C@H](F)C2)c(C)n1 ZINC000895191358 711779906 /nfs/dbraw/zinc/77/99/06/711779906.db2.gz OKEUIYUBLVKCBY-LBPRGKRZSA-N 1 2 225.311 2.145 20 0 BEADLO Cc1nc(NCc2cc(C3CC3)n(C)n2)cc[nH+]1 ZINC000896536982 711782170 /nfs/dbraw/zinc/78/21/70/711782170.db2.gz SKZAUDNYBZLYBP-UHFFFAOYSA-N 1 2 243.314 2.008 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)NCC1(C2CCC2)CCC1 ZINC000909549379 711782960 /nfs/dbraw/zinc/78/29/60/711782960.db2.gz NDTHVWHNKLFADM-UHFFFAOYSA-N 1 2 247.342 2.039 20 0 BEADLO CC(C)=C(C)C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000751365300 711785291 /nfs/dbraw/zinc/78/52/91/711785291.db2.gz CLGKNVIGZMFHLZ-UHFFFAOYSA-N 1 2 247.342 2.403 20 0 BEADLO CNc1cc(N[C@@H](C)CCSC)[nH+]cn1 ZINC000229055267 711837156 /nfs/dbraw/zinc/83/71/56/711837156.db2.gz MAJNKURDSZTEJJ-QMMMGPOBSA-N 1 2 226.349 2.072 20 0 BEADLO Fc1c[nH+]ccc1NCC[C@H]1CCSC1 ZINC000704911851 712121483 /nfs/dbraw/zinc/12/14/83/712121483.db2.gz MUKFPJDEZQFMFN-VIFPVBQESA-N 1 2 226.320 2.198 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ccccn1)c1cn(C)cn1 ZINC000710004720 712239286 /nfs/dbraw/zinc/23/92/86/712239286.db2.gz BMLGPVMOFDXWDV-QWRGUYRKSA-N 1 2 230.315 2.227 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccccn1)c1cn(C)cn1 ZINC000710004721 712239510 /nfs/dbraw/zinc/23/95/10/712239510.db2.gz BMLGPVMOFDXWDV-WDEREUQCSA-N 1 2 230.315 2.227 20 0 BEADLO C[C@H]([NH2+]Cc1ccccc1F)c1cn(C)cn1 ZINC000710010772 712239794 /nfs/dbraw/zinc/23/97/94/712239794.db2.gz IMBZKSUNICDSPG-JTQLQIEISA-N 1 2 233.290 2.410 20 0 BEADLO Cc1occc1C[NH2+][C@H](C)c1cn(C)cn1 ZINC000710045307 712243679 /nfs/dbraw/zinc/24/36/79/712243679.db2.gz DTFVUMYGCJXOLU-SECBINFHSA-N 1 2 219.288 2.172 20 0 BEADLO O=C(C[N@H+]1CC[C@H](CF)C1)c1ccccc1F ZINC000711454151 712304095 /nfs/dbraw/zinc/30/40/95/712304095.db2.gz WIFVUCLRAGERSA-SNVBAGLBSA-N 1 2 239.265 2.300 20 0 BEADLO O=C(C[N@@H+]1CC[C@H](CF)C1)c1ccccc1F ZINC000711454151 712304099 /nfs/dbraw/zinc/30/40/99/712304099.db2.gz WIFVUCLRAGERSA-SNVBAGLBSA-N 1 2 239.265 2.300 20 0 BEADLO COC(=O)C(C)(C)[NH2+]CCSC(C)(C)C ZINC000389868234 712398046 /nfs/dbraw/zinc/39/80/46/712398046.db2.gz HYEXWVYATYYWOH-UHFFFAOYSA-N 1 2 233.377 2.059 20 0 BEADLO C=C/C=C\CC[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000713661801 712468878 /nfs/dbraw/zinc/46/88/78/712468878.db2.gz RTNYDLMQTQGBGO-SKVAFPRGSA-N 1 2 225.332 2.439 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2CCCC[C@@H]2C)n1 ZINC000714453090 712490245 /nfs/dbraw/zinc/49/02/45/712490245.db2.gz YJTQPUBRYYKZRX-VHSXEESVSA-N 1 2 223.320 2.473 20 0 BEADLO CCCn1cc(CNc2ccc(C)[nH+]c2C)nn1 ZINC000714492262 712492223 /nfs/dbraw/zinc/49/22/23/712492223.db2.gz LEUDJJLMPSRJPZ-UHFFFAOYSA-N 1 2 245.330 2.312 20 0 BEADLO FC1(F)[C@H]2C[N@H+](Cc3ccnc(Cl)c3)C[C@H]21 ZINC000715419616 712518402 /nfs/dbraw/zinc/51/84/02/712518402.db2.gz YNHXFXLTNSKTCS-DTORHVGOSA-N 1 2 244.672 2.432 20 0 BEADLO FC1(F)[C@H]2C[N@@H+](Cc3ccnc(Cl)c3)C[C@H]21 ZINC000715419616 712518403 /nfs/dbraw/zinc/51/84/03/712518403.db2.gz YNHXFXLTNSKTCS-DTORHVGOSA-N 1 2 244.672 2.432 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCCc2occc21)c1cn(C)nn1 ZINC000715849927 712536209 /nfs/dbraw/zinc/53/62/09/712536209.db2.gz HAEANUQELRURBC-KOLCDFICSA-N 1 2 246.314 2.136 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@@H](C)c1cncs1 ZINC000716459979 712562275 /nfs/dbraw/zinc/56/22/75/712562275.db2.gz CCXZXBYYKAQPBM-QMMMGPOBSA-N 1 2 222.317 2.025 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1CC(C)(C)CO1 ZINC000717590370 712661363 /nfs/dbraw/zinc/66/13/63/712661363.db2.gz VFDWXOUVSRFSCJ-SNVBAGLBSA-N 1 2 236.315 2.317 20 0 BEADLO Cc1nnc(C[NH2+][C@H]2CCc3c2cccc3F)o1 ZINC000718884128 712787365 /nfs/dbraw/zinc/78/73/65/712787365.db2.gz WBEFLFOCUSCDSD-LBPRGKRZSA-N 1 2 247.273 2.294 20 0 BEADLO O=C(NCCc1[nH]cc[nH+]1)[C@@H]1CCC=CCCC1 ZINC000719029097 712794243 /nfs/dbraw/zinc/79/42/43/712794243.db2.gz GPPQHUDCIANBDI-GFCCVEGCSA-N 1 2 247.342 2.205 20 0 BEADLO C[C@@H]1Cc2cc(C[NH2+]Cc3ccon3)ccc2O1 ZINC000720789541 712866059 /nfs/dbraw/zinc/86/60/59/712866059.db2.gz FUJZVLNHNRVDKH-SNVBAGLBSA-N 1 2 244.294 2.288 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CC12CCC2 ZINC000721185560 712895210 /nfs/dbraw/zinc/89/52/10/712895210.db2.gz BRUONBAPJAQJEJ-SNVBAGLBSA-N 1 2 204.273 2.445 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@H](C)C2)oc1C ZINC001204535965 958002348 /nfs/dbraw/zinc/00/23/48/958002348.db2.gz BGCQCKPHJKSWNP-SNVBAGLBSA-N 1 2 209.289 2.117 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@H](C)C2)oc1C ZINC001204535965 958002361 /nfs/dbraw/zinc/00/23/61/958002361.db2.gz BGCQCKPHJKSWNP-SNVBAGLBSA-N 1 2 209.289 2.117 20 0 BEADLO CCC[C@@H]1CCCN(C(=O)C[C@@H]([NH3+])C(F)F)C1 ZINC000724737923 959320911 /nfs/dbraw/zinc/32/09/11/959320911.db2.gz DIDOBNPWQYBASD-NXEZZACHSA-N 1 2 248.317 2.008 20 0 BEADLO COC(C)(C)CNc1cc2cc[nH]c2c[nH+]1 ZINC000309676612 960010859 /nfs/dbraw/zinc/01/08/59/960010859.db2.gz YACBLEQTGWRIFI-UHFFFAOYSA-N 1 2 219.288 2.400 20 0 BEADLO C[C@H]1CC[N@@H+]1Cc1ccc(O)c(F)c1F ZINC001140889783 960672163 /nfs/dbraw/zinc/67/21/63/960672163.db2.gz KSNIPLHJLXXULH-ZETCQYMHSA-N 1 2 213.227 2.265 20 0 BEADLO C[C@H]1CC[N@H+]1Cc1ccc(O)c(F)c1F ZINC001140889783 960672175 /nfs/dbraw/zinc/67/21/75/960672175.db2.gz KSNIPLHJLXXULH-ZETCQYMHSA-N 1 2 213.227 2.265 20 0 BEADLO COCC(C)(C)Nc1cc(C)[nH+]c(SC)n1 ZINC001156455087 963360077 /nfs/dbraw/zinc/36/00/77/963360077.db2.gz IFDXWTTUMSHVJX-UHFFFAOYSA-N 1 2 241.360 2.344 20 0 BEADLO CC(C)[NH+]1CC(Nc2ncc(F)cc2Cl)C1 ZINC001157525903 963642491 /nfs/dbraw/zinc/64/24/91/963642491.db2.gz JHUUKLJWXHCLCM-UHFFFAOYSA-N 1 2 243.713 2.379 20 0 BEADLO CCCNc1[nH+]c(C)nc2c1ccn2C ZINC001168131149 963815850 /nfs/dbraw/zinc/81/58/50/963815850.db2.gz ZTWYOUFKIFGYAE-UHFFFAOYSA-N 1 2 204.277 2.099 20 0 BEADLO FC(F)CNc1ccc(N2CCCC2)[nH+]c1 ZINC001161813758 964767410 /nfs/dbraw/zinc/76/74/10/964767410.db2.gz YVGPCUHVYWTUFV-UHFFFAOYSA-N 1 2 227.258 2.359 20 0 BEADLO COc1ccc(C)[nH+]c1N(C)CC(F)(F)F ZINC001163710535 965527209 /nfs/dbraw/zinc/52/72/09/965527209.db2.gz ZHAOHGQSFDRXSO-UHFFFAOYSA-N 1 2 234.221 2.397 20 0 BEADLO Cc1nc(N(C)CC(F)(F)F)c2c([nH+]1)CCC2 ZINC001163709403 965529482 /nfs/dbraw/zinc/52/94/82/965529482.db2.gz FYUYPIHGGLLAJX-UHFFFAOYSA-N 1 2 245.248 2.272 20 0 BEADLO CCCCOC1C[NH+](Cc2ccc(O)cc2)C1 ZINC001204093849 966890726 /nfs/dbraw/zinc/89/07/26/966890726.db2.gz PUBYYBOWDUPWKZ-UHFFFAOYSA-N 1 2 235.327 2.393 20 0 BEADLO CC(C)Oc1ccc[nH+]c1NC1CCOCC1 ZINC000169137404 1165835993 /nfs/dbraw/zinc/83/59/93/1165835993.db2.gz ZTNIPBLLRCKWEP-UHFFFAOYSA-N 1 2 236.315 2.460 20 0 BEADLO C(C[NH+]1CCOCC1)OC1CCCCCCC1 ZINC001210224928 1165853292 /nfs/dbraw/zinc/85/32/92/1165853292.db2.gz KQAHICAIOSKYKJ-UHFFFAOYSA-N 1 2 241.375 2.448 20 0 BEADLO CNc1ccc(Nc2ncc(C)o2)c[nH+]1 ZINC001203448325 967447407 /nfs/dbraw/zinc/44/74/07/967447407.db2.gz WXNDSDWCMIHWMN-UHFFFAOYSA-N 1 2 204.233 2.163 20 0 BEADLO Cc1nn(C)c(C)c1Nc1c[nH+]c(C)c(N)c1 ZINC001210287003 1165864616 /nfs/dbraw/zinc/86/46/16/1165864616.db2.gz JCWFZEBTCGIDJF-UHFFFAOYSA-N 1 2 231.303 2.066 20 0 BEADLO Cc1[nH+]cc(Nc2cccnc2F)cc1N ZINC001210287016 1165864650 /nfs/dbraw/zinc/86/46/50/1165864650.db2.gz JOUKWNBFKKDTSW-UHFFFAOYSA-N 1 2 218.235 2.250 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1ccc2ccccc2n1 ZINC001204499247 1165866092 /nfs/dbraw/zinc/86/60/92/1165866092.db2.gz FORFGAQPLAHIHC-UHFFFAOYSA-N 1 2 228.295 2.256 20 0 BEADLO CC(=O)C[N@H+](C)Cc1ccc2ccccc2n1 ZINC001204499247 1165866097 /nfs/dbraw/zinc/86/60/97/1165866097.db2.gz FORFGAQPLAHIHC-UHFFFAOYSA-N 1 2 228.295 2.256 20 0 BEADLO CC(C)CC[C@H](C)[NH2+]CC(=O)OC(C)C ZINC000068944681 1165893169 /nfs/dbraw/zinc/89/31/69/1165893169.db2.gz AXHORBPIUNGBFS-NSHDSACASA-N 1 2 215.337 2.352 20 0 BEADLO Cc1cc(C)c(Cc2ccnn2C)c[nH+]1 ZINC001250436113 967855772 /nfs/dbraw/zinc/85/57/72/967855772.db2.gz IIPDYGRGXOQSIA-UHFFFAOYSA-N 1 2 201.273 2.023 20 0 BEADLO Cn1ccc(C[N@@H+]2CCCC[C@@](C)(F)C2)n1 ZINC001206265033 968181936 /nfs/dbraw/zinc/18/19/36/968181936.db2.gz XVGCBXIHBWXEIM-GFCCVEGCSA-N 1 2 225.311 2.134 20 0 BEADLO Cn1ccc(C[N@H+]2CCCC[C@@](C)(F)C2)n1 ZINC001206265033 968181939 /nfs/dbraw/zinc/18/19/39/968181939.db2.gz XVGCBXIHBWXEIM-GFCCVEGCSA-N 1 2 225.311 2.134 20 0 BEADLO COc1cccnc1C[NH+]1CCC(F)(F)CC1 ZINC001206610339 968419539 /nfs/dbraw/zinc/41/95/39/968419539.db2.gz FDDMJHGCAVRFQW-UHFFFAOYSA-N 1 2 242.269 2.321 20 0 BEADLO COCC[N@H+](Cc1c(F)cncc1F)C(C)C ZINC001206860372 968504098 /nfs/dbraw/zinc/50/40/98/968504098.db2.gz BOPZOLMNXOJPEP-UHFFFAOYSA-N 1 2 244.285 2.217 20 0 BEADLO COCC[N@@H+](Cc1c(F)cncc1F)C(C)C ZINC001206860372 968504105 /nfs/dbraw/zinc/50/41/05/968504105.db2.gz BOPZOLMNXOJPEP-UHFFFAOYSA-N 1 2 244.285 2.217 20 0 BEADLO CCCCOc1cc(NCC(C)(C)O)cc[nH+]1 ZINC001252351722 968631460 /nfs/dbraw/zinc/63/14/60/968631460.db2.gz YLFQDGGOUYWVGG-UHFFFAOYSA-N 1 2 238.331 2.443 20 0 BEADLO CCn1nccc1-c1c[nH+]c(C)cc1OC ZINC001240707241 968654106 /nfs/dbraw/zinc/65/41/06/968654106.db2.gz QZABAOMOMQKVDN-UHFFFAOYSA-N 1 2 217.272 2.282 20 0 BEADLO CCSC[C@@H](C)[N@H+](C)CC(=O)OC(C)(C)C ZINC000706991932 1166065179 /nfs/dbraw/zinc/06/51/79/1166065179.db2.gz NEFJUEJBSSVAIX-SNVBAGLBSA-N 1 2 247.404 2.402 20 0 BEADLO CCSC[C@@H](C)[N@@H+](C)CC(=O)OC(C)(C)C ZINC000706991932 1166065185 /nfs/dbraw/zinc/06/51/85/1166065185.db2.gz NEFJUEJBSSVAIX-SNVBAGLBSA-N 1 2 247.404 2.402 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1cccnc1 ZINC000082645016 1166067987 /nfs/dbraw/zinc/06/79/87/1166067987.db2.gz FJTNPPPKLYFFAW-ZDUSSCGKSA-N 1 2 218.300 2.025 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@H+]1Cc1cccnc1 ZINC000082645016 1166067991 /nfs/dbraw/zinc/06/79/91/1166067991.db2.gz FJTNPPPKLYFFAW-ZDUSSCGKSA-N 1 2 218.300 2.025 20 0 BEADLO Cc1[nH]c(CNC(=O)C[C@@H](C)C2CC2)[nH+]c1C ZINC000827793746 968701425 /nfs/dbraw/zinc/70/14/25/968701425.db2.gz TZWPPMCJOQIBKX-MRVPVSSYSA-N 1 2 235.331 2.079 20 0 BEADLO CCCCCOC(=O)C[NH2+][C@@H](C)CC ZINC000040954392 1166234106 /nfs/dbraw/zinc/23/41/06/1166234106.db2.gz HCEFWCLIILXESA-JTQLQIEISA-N 1 2 201.310 2.108 20 0 BEADLO CO[C@H](C)CNc1[nH+]cccc1OC(C)C ZINC000224352475 1166239268 /nfs/dbraw/zinc/23/92/68/1166239268.db2.gz XGHMRIBGHQUHHL-SNVBAGLBSA-N 1 2 224.304 2.316 20 0 BEADLO C[C@H](C[NH+]1CC2(C1)CCCO2)C(F)(F)F ZINC001208895829 969288325 /nfs/dbraw/zinc/28/83/25/969288325.db2.gz MUJVNBCAHAKHMW-MRVPVSSYSA-N 1 2 223.238 2.050 20 0 BEADLO CCC(=O)C(C)(C)C[N@@H+]1C[C@@H](F)C[C@H]1CF ZINC001208918540 969305389 /nfs/dbraw/zinc/30/53/89/969305389.db2.gz PIYNQSLCCRXNFR-UWVGGRQHSA-N 1 2 233.302 2.374 20 0 BEADLO CCC(=O)C(C)(C)C[N@H+]1C[C@@H](F)C[C@H]1CF ZINC001208918540 969305397 /nfs/dbraw/zinc/30/53/97/969305397.db2.gz PIYNQSLCCRXNFR-UWVGGRQHSA-N 1 2 233.302 2.374 20 0 BEADLO Cc1cccc(NC(=O)C[C@@H]([NH3+])C(F)F)c1C ZINC000724761994 1166362119 /nfs/dbraw/zinc/36/21/19/1166362119.db2.gz LQVOEZAFGCVIDP-SECBINFHSA-N 1 2 242.269 2.224 20 0 BEADLO Cn1cc(Cl)c(C[NH2+]CCC(F)(F)F)n1 ZINC000393331879 1166411530 /nfs/dbraw/zinc/41/15/30/1166411530.db2.gz MCZDTBAQEPEVNI-UHFFFAOYSA-N 1 2 241.644 2.116 20 0 BEADLO CC[NH+]1CC(NC(=O)C(CC)(CC)CC)C1 ZINC001267663681 1166606022 /nfs/dbraw/zinc/60/60/22/1166606022.db2.gz SQKLOPAMFKMZEP-UHFFFAOYSA-N 1 2 226.364 2.023 20 0 BEADLO CCOC(=O)Cc1cc[nH+]c(N[C@H](C)CC)c1 ZINC001157236996 970161390 /nfs/dbraw/zinc/16/13/90/970161390.db2.gz CDVVCTKQRXHOPP-SNVBAGLBSA-N 1 2 236.315 2.398 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)C1(Cl)CC1)c1csnn1 ZINC000695665797 1166663242 /nfs/dbraw/zinc/66/32/42/1166663242.db2.gz DRRWMVIUXCGPAV-RQJHMYQMSA-N 1 2 231.752 2.349 20 0 BEADLO Nc1cc(N2CC[C@H]3CCCC[C@@H]3C2)[nH+]cn1 ZINC000129832135 1166826575 /nfs/dbraw/zinc/82/65/75/1166826575.db2.gz CMVNGQPULPVDHR-GHMZBOCLSA-N 1 2 232.331 2.075 20 0 BEADLO Cc1cc(CO[C@H]2CCOC[C@@H]2F)cc(C)[nH+]1 ZINC001223425985 1166862877 /nfs/dbraw/zinc/86/28/77/1166862877.db2.gz WIVJHRFTKQAWIP-STQMWFEESA-N 1 2 239.290 2.342 20 0 BEADLO COc1ccc(-c2c[nH+]c(N)c(C)c2)nc1 ZINC000304452209 1166918592 /nfs/dbraw/zinc/91/85/92/1166918592.db2.gz XXKCETFVIVJZCS-UHFFFAOYSA-N 1 2 215.256 2.043 20 0 BEADLO CCSC[C@@H](C)[N@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001173301721 975199311 /nfs/dbraw/zinc/19/93/11/975199311.db2.gz YVPGBVXPLZFZPL-HLTSFMKQSA-N 1 2 209.305 2.120 20 0 BEADLO CCSC[C@@H](C)[N@@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001173301721 975199313 /nfs/dbraw/zinc/19/93/13/975199313.db2.gz YVPGBVXPLZFZPL-HLTSFMKQSA-N 1 2 209.305 2.120 20 0 BEADLO CCSC[C@H](C)[NH+]1C[C@@H](F)[C@H](F)C1 ZINC001173301720 975203182 /nfs/dbraw/zinc/20/31/82/975203182.db2.gz YVPGBVXPLZFZPL-DJLDLDEBSA-N 1 2 209.305 2.120 20 0 BEADLO CC(C)c1ccc(O)cc1OC1C[NH+](C)C1 ZINC001227019114 975222475 /nfs/dbraw/zinc/22/24/75/975222475.db2.gz SFKZJIHMLCVGPM-UHFFFAOYSA-N 1 2 221.300 2.208 20 0 BEADLO Cc1cc(C[NH2+]Cc2csnn2)cc(C)c1O ZINC000398499904 1167069518 /nfs/dbraw/zinc/06/95/18/1167069518.db2.gz YZOKBRRQLBVNLP-UHFFFAOYSA-N 1 2 249.339 2.150 20 0 BEADLO C[C@H](c1ncccn1)[N@@H+]1CC[C@H](C(F)(F)F)C1 ZINC001332697996 975255923 /nfs/dbraw/zinc/25/59/23/975255923.db2.gz HMZMCQKLEOTVQO-BDAKNGLRSA-N 1 2 245.248 2.422 20 0 BEADLO C[C@H](c1ncccn1)[N@H+]1CC[C@H](C(F)(F)F)C1 ZINC001332697996 975255932 /nfs/dbraw/zinc/25/59/32/975255932.db2.gz HMZMCQKLEOTVQO-BDAKNGLRSA-N 1 2 245.248 2.422 20 0 BEADLO Cc1noc2ncc(C[N@@H+]3CC[C@H](F)C3)cc12 ZINC000894875186 1167106233 /nfs/dbraw/zinc/10/62/33/1167106233.db2.gz XDGISHKBHCZZDH-JTQLQIEISA-N 1 2 235.262 2.075 20 0 BEADLO Cc1noc2ncc(C[N@H+]3CC[C@H](F)C3)cc12 ZINC000894875186 1167106240 /nfs/dbraw/zinc/10/62/40/1167106240.db2.gz XDGISHKBHCZZDH-JTQLQIEISA-N 1 2 235.262 2.075 20 0 BEADLO Cc1cc[nH+]c(C)c1OC[C@H]1CCCO1 ZINC001227264661 975337813 /nfs/dbraw/zinc/33/78/13/975337813.db2.gz PMHAVRXYTLHIDT-LLVKDONJSA-N 1 2 207.273 2.256 20 0 BEADLO CCOC(=O)C[C@H]1CC[C@H]([NH+]2CC(C)(F)C2)C1 ZINC001173643670 975510438 /nfs/dbraw/zinc/51/04/38/975510438.db2.gz XGMQWKMQBFNVLC-QWRGUYRKSA-N 1 2 243.322 2.152 20 0 BEADLO Cc1cc(C[NH+]2CCC(CCF)CC2)n[nH]1 ZINC001333368906 975713003 /nfs/dbraw/zinc/71/30/03/975713003.db2.gz OHCLZWMTQQPBHA-UHFFFAOYSA-N 1 2 225.311 2.290 20 0 BEADLO Cc1cc(N2CCCC[C@H]2CO)nc(C(C)C)[nH+]1 ZINC000040433438 1167281744 /nfs/dbraw/zinc/28/17/44/1167281744.db2.gz LNCDNIFKRZFEJZ-LBPRGKRZSA-N 1 2 249.358 2.260 20 0 BEADLO CCCN(Cc1ccccc1)c1cc(N)nc[nH+]1 ZINC000384327481 1167295376 /nfs/dbraw/zinc/29/53/76/1167295376.db2.gz OIUGFYSIXLMILW-UHFFFAOYSA-N 1 2 242.326 2.475 20 0 BEADLO CCCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ncn[nH]1 ZINC000309451777 1167305993 /nfs/dbraw/zinc/30/59/93/1167305993.db2.gz LIRJNBITABMUJK-MNOVXSKESA-N 1 2 222.336 2.253 20 0 BEADLO Cc1ccc(Nc2cnn(C)c2)c(C)[nH+]1 ZINC001174328062 976525299 /nfs/dbraw/zinc/52/52/99/976525299.db2.gz JSLVUFIMKCSTSS-UHFFFAOYSA-N 1 2 202.261 2.176 20 0 BEADLO CC[N@H+](Cc1ccc(Cl)c(O)c1)C1COC1 ZINC001231733638 977718734 /nfs/dbraw/zinc/71/87/34/977718734.db2.gz BKCURVCAALALTO-UHFFFAOYSA-N 1 2 241.718 2.266 20 0 BEADLO CC[N@@H+](Cc1ccc(Cl)c(O)c1)C1COC1 ZINC001231733638 977718753 /nfs/dbraw/zinc/71/87/53/977718753.db2.gz BKCURVCAALALTO-UHFFFAOYSA-N 1 2 241.718 2.266 20 0 BEADLO FC(F)(F)c1cc(C[NH+]2CCC2)ccn1 ZINC001232235144 977971620 /nfs/dbraw/zinc/97/16/20/977971620.db2.gz KPNGVQOVLUBSEM-UHFFFAOYSA-N 1 2 216.206 2.306 20 0 BEADLO OC1CC2(C1)C[NH+](Cc1cc(Cl)cs1)C2 ZINC001232276691 977988932 /nfs/dbraw/zinc/98/89/32/977988932.db2.gz FZDBGBGDOWHUSH-UHFFFAOYSA-N 1 2 243.759 2.358 20 0 BEADLO Cc1[nH+]c(N)ccc1CN1CCCC(F)(F)C1 ZINC001232336828 978012538 /nfs/dbraw/zinc/01/25/38/978012538.db2.gz IWHJAGKWBIEFLO-UHFFFAOYSA-N 1 2 241.285 2.203 20 0 BEADLO Cc1[nH]c(CN2CCCC(F)(F)[C@@H](F)C2)c[nH+]1 ZINC001232461182 978097737 /nfs/dbraw/zinc/09/77/37/978097737.db2.gz YICQBIVUSLSTKI-JTQLQIEISA-N 1 2 247.264 2.287 20 0 BEADLO Cc1[nH]cc(CN2CCCC(F)(F)[C@@H](F)C2)[nH+]1 ZINC001232461182 978097745 /nfs/dbraw/zinc/09/77/45/978097745.db2.gz YICQBIVUSLSTKI-JTQLQIEISA-N 1 2 247.264 2.287 20 0 BEADLO Cc1cccc(F)c1C[N@@H+]1CC[C@@H](O)[C@@H](F)C1 ZINC001232485647 1167688238 /nfs/dbraw/zinc/68/82/38/1167688238.db2.gz BIXZGJVMOQJZHS-QWHCGFSZSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cccc(F)c1C[N@H+]1CC[C@@H](O)[C@@H](F)C1 ZINC001232485647 1167688241 /nfs/dbraw/zinc/68/82/41/1167688241.db2.gz BIXZGJVMOQJZHS-QWHCGFSZSA-N 1 2 241.281 2.039 20 0 BEADLO C[C@H]1CCC[N@@H+]1Cn1ncn(C2CC2)c1=S ZINC000173522914 1167696136 /nfs/dbraw/zinc/69/61/36/1167696136.db2.gz FPHIIVPNMGPWLR-VIFPVBQESA-N 1 2 238.360 2.191 20 0 BEADLO C[C@H]1CCC[N@H+]1Cn1ncn(C2CC2)c1=S ZINC000173522914 1167696138 /nfs/dbraw/zinc/69/61/38/1167696138.db2.gz FPHIIVPNMGPWLR-VIFPVBQESA-N 1 2 238.360 2.191 20 0 BEADLO Cc1csc(NC(=O)CCn2cc[nH+]c2)c1 ZINC001176873548 978225670 /nfs/dbraw/zinc/22/56/70/978225670.db2.gz UHSPZNAHSFDBIL-UHFFFAOYSA-N 1 2 235.312 2.282 20 0 BEADLO CCC[C@H]1CCCN1C(=O)Cc1[nH]c[nH+]c1C ZINC001337421736 978332528 /nfs/dbraw/zinc/33/25/28/978332528.db2.gz XJUOCICZSURRGY-NSHDSACASA-N 1 2 235.331 2.052 20 0 BEADLO CC[C@H](C)[C@H](C(=O)OC)[N@@H+]1CC[C@H](C)[C@H](F)C1 ZINC001168466337 1167759077 /nfs/dbraw/zinc/75/90/77/1167759077.db2.gz NEHRWNPWTSCIPL-NNYUYHANSA-N 1 2 245.338 2.254 20 0 BEADLO CC[C@H](C)[C@H](C(=O)OC)[N@H+]1CC[C@H](C)[C@H](F)C1 ZINC001168466337 1167759084 /nfs/dbraw/zinc/75/90/84/1167759084.db2.gz NEHRWNPWTSCIPL-NNYUYHANSA-N 1 2 245.338 2.254 20 0 BEADLO O[C@H]1C[N@H+](Cc2ccsc2Cl)CC[C@@H]1F ZINC001233053393 978449042 /nfs/dbraw/zinc/44/90/42/978449042.db2.gz ILRFLOJGJKBHOU-IUCAKERBSA-N 1 2 249.738 2.306 20 0 BEADLO O[C@H]1C[N@@H+](Cc2ccsc2Cl)CC[C@@H]1F ZINC001233053393 978449049 /nfs/dbraw/zinc/44/90/49/978449049.db2.gz ILRFLOJGJKBHOU-IUCAKERBSA-N 1 2 249.738 2.306 20 0 BEADLO Cc1cc(C[N@@H+]2CCCC(=O)[C@@H](C)C2)sn1 ZINC001233309926 978533991 /nfs/dbraw/zinc/53/39/91/978533991.db2.gz IRDNHVRMEYWOOV-VIFPVBQESA-N 1 2 238.356 2.253 20 0 BEADLO Cc1cc(C[N@H+]2CCCC(=O)[C@@H](C)C2)sn1 ZINC001233309926 978534006 /nfs/dbraw/zinc/53/40/06/978534006.db2.gz IRDNHVRMEYWOOV-VIFPVBQESA-N 1 2 238.356 2.253 20 0 BEADLO Cc1cnsc1C[N@@H+]1CCCCC12COC2 ZINC001233320771 978559288 /nfs/dbraw/zinc/55/92/88/978559288.db2.gz MZIWMTMDOHHQKI-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO Cc1cnsc1C[N@H+]1CCCCC12COC2 ZINC001233320771 978559294 /nfs/dbraw/zinc/55/92/94/978559294.db2.gz MZIWMTMDOHHQKI-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO CCNc1ccc(Nc2nc(C)ns2)c[nH+]1 ZINC001338425743 978679427 /nfs/dbraw/zinc/67/94/27/978679427.db2.gz WUJLVOLJBWVMDC-UHFFFAOYSA-N 1 2 235.316 2.417 20 0 BEADLO Fc1cncc(C[N@@H+]2C[C@@H]3C[C@@H]3C2)c1Cl ZINC001235489968 979055009 /nfs/dbraw/zinc/05/50/09/979055009.db2.gz WKTFQZOFTWYSGS-OCAPTIKFSA-N 1 2 226.682 2.326 20 0 BEADLO Fc1cncc(C[N@H+]2C[C@@H]3C[C@@H]3C2)c1Cl ZINC001235489968 979055015 /nfs/dbraw/zinc/05/50/15/979055015.db2.gz WKTFQZOFTWYSGS-OCAPTIKFSA-N 1 2 226.682 2.326 20 0 BEADLO Cc1[nH+]cn(C)c1CN1CCCCC(F)(F)C1 ZINC001235539845 979080257 /nfs/dbraw/zinc/08/02/57/979080257.db2.gz DDVPUPLIWAHZCM-UHFFFAOYSA-N 1 2 243.301 2.350 20 0 BEADLO C[C@@H]1CN(Cc2ccc(S)cc2)C[C@H](C)[NH2+]1 ZINC001235903454 979197657 /nfs/dbraw/zinc/19/76/57/979197657.db2.gz ZYNBDBRWBWMPRS-PHIMTYICSA-N 1 2 236.384 2.158 20 0 BEADLO Cc1cc(Cl)cc(C[NH+]2CC=CC2)n1 ZINC001236640438 979685648 /nfs/dbraw/zinc/68/56/48/979685648.db2.gz QGIMCFPNGAHRDO-UHFFFAOYSA-N 1 2 208.692 2.415 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@@H](C(F)F)C2)nc1 ZINC001237806537 980052131 /nfs/dbraw/zinc/05/21/31/980052131.db2.gz PXWNHHYADIXUGS-SNVBAGLBSA-N 1 2 241.285 2.262 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@@H](C(F)F)C2)nc1 ZINC001237806537 980052143 /nfs/dbraw/zinc/05/21/43/980052143.db2.gz PXWNHHYADIXUGS-SNVBAGLBSA-N 1 2 241.285 2.262 20 0 BEADLO CCOc1cc(C[N@H+]2CC[C@H]2C)c(F)cn1 ZINC001238728897 980317051 /nfs/dbraw/zinc/31/70/51/980317051.db2.gz KAOUQAODUXGOEG-SECBINFHSA-N 1 2 224.279 2.214 20 0 BEADLO COc1cc(C)c(C)cc1C[N@H+](C)C1COC1 ZINC001238763137 980319695 /nfs/dbraw/zinc/31/96/95/980319695.db2.gz ITNSAKPRVFXHGX-UHFFFAOYSA-N 1 2 235.327 2.143 20 0 BEADLO COc1cc(C)c(C)cc1C[N@@H+](C)C1COC1 ZINC001238763137 980319703 /nfs/dbraw/zinc/31/97/03/980319703.db2.gz ITNSAKPRVFXHGX-UHFFFAOYSA-N 1 2 235.327 2.143 20 0 BEADLO CCC(C)(C)C(=O)OCCCc1c[nH+]cn1C ZINC001344916268 980500299 /nfs/dbraw/zinc/50/02/99/980500299.db2.gz FGQLYVLVVSIDGJ-UHFFFAOYSA-N 1 2 238.331 2.332 20 0 BEADLO Cc1ccc(-c2c[nH+]c(N)c(C)c2)cc1CO ZINC001242385537 1168503659 /nfs/dbraw/zinc/50/36/59/1168503659.db2.gz YXZBRPDPAMZGPS-UHFFFAOYSA-N 1 2 228.295 2.440 20 0 BEADLO O=C1CC[N@H+](Cc2ccccn2)[C@@H]2CCCC[C@H]12 ZINC001204056239 1168632461 /nfs/dbraw/zinc/63/24/61/1168632461.db2.gz WVMCUNRWXCGYDR-UONOGXRCSA-N 1 2 244.338 2.415 20 0 BEADLO O=C1CC[N@@H+](Cc2ccccn2)[C@@H]2CCCC[C@H]12 ZINC001204056239 1168632463 /nfs/dbraw/zinc/63/24/63/1168632463.db2.gz WVMCUNRWXCGYDR-UONOGXRCSA-N 1 2 244.338 2.415 20 0 BEADLO C[C@@H]1C[C@@H]([N@H+](C)CC(F)F)C[C@H](C)O1 ZINC000338965390 1168712023 /nfs/dbraw/zinc/71/20/23/1168712023.db2.gz WCAFCUWCZSJNJE-AYMMMOKOSA-N 1 2 207.264 2.139 20 0 BEADLO C[C@@H]1C[C@@H]([N@@H+](C)CC(F)F)C[C@H](C)O1 ZINC000338965390 1168712031 /nfs/dbraw/zinc/71/20/31/1168712031.db2.gz WCAFCUWCZSJNJE-AYMMMOKOSA-N 1 2 207.264 2.139 20 0 BEADLO c1cn2c(cccc2-c2cncs2)[nH+]1 ZINC001241498704 982657856 /nfs/dbraw/zinc/65/78/56/982657856.db2.gz UTZHMGPKCLILKU-UHFFFAOYSA-N 1 2 201.254 2.458 20 0 BEADLO OCc1cc[nH+]c(N[C@H]2CCC[C@H](F)C2)c1 ZINC001353017755 982668833 /nfs/dbraw/zinc/66/88/33/982668833.db2.gz PSAIPGLELKQDGI-QWRGUYRKSA-N 1 2 224.279 2.267 20 0 BEADLO OC1C[NH+](Cc2csc3ccccc23)C1 ZINC000082584640 983101312 /nfs/dbraw/zinc/10/13/12/983101312.db2.gz SGRNHJPCEGEFHV-UHFFFAOYSA-N 1 2 219.309 2.078 20 0 BEADLO Cc1cc(C)c(C(=O)N2CC(F)(F)C2)c(C)[nH+]1 ZINC001354003880 983113978 /nfs/dbraw/zinc/11/39/78/983113978.db2.gz VYIZHAUGONGAAO-UHFFFAOYSA-N 1 2 240.253 2.098 20 0 BEADLO CC(C)(C)C[N@@H+]1CCCC(=O)[C@@H](F)C1 ZINC001201433161 983229526 /nfs/dbraw/zinc/22/95/26/983229526.db2.gz UAVOFHAMYCDDRK-VIFPVBQESA-N 1 2 201.285 2.036 20 0 BEADLO CC(C)(C)C[N@H+]1CCCC(=O)[C@@H](F)C1 ZINC001201433161 983229532 /nfs/dbraw/zinc/22/95/32/983229532.db2.gz UAVOFHAMYCDDRK-VIFPVBQESA-N 1 2 201.285 2.036 20 0 BEADLO C[C@@H](c1nc(-c2ccoc2)no1)n1cc[nH+]c1 ZINC000350836182 1169164598 /nfs/dbraw/zinc/16/45/98/1169164598.db2.gz FWQSCISBDQWFHC-QMMMGPOBSA-N 1 2 230.227 2.135 20 0 BEADLO Cc1csc(C[NH+]2CC3(C2)CCCO3)c1 ZINC001137153356 983988698 /nfs/dbraw/zinc/98/86/98/983988698.db2.gz UPBHWUCYZRSFKC-UHFFFAOYSA-N 1 2 223.341 2.421 20 0 BEADLO CC(C)OCC[C@H](C)[NH2+][C@H]1CC1(F)F ZINC001172431891 974716855 /nfs/dbraw/zinc/71/68/55/974716855.db2.gz SBXHCLCGKMLZKT-IUCAKERBSA-N 1 2 207.264 2.187 20 0 BEADLO CCOC(=O)C1([NH2+][C@@H](CC)CC(C)C)CC1 ZINC001172389932 974737946 /nfs/dbraw/zinc/73/79/46/974737946.db2.gz QROFJAQAZOLRON-NSHDSACASA-N 1 2 227.348 2.496 20 0 BEADLO FCC(CF)[NH2+]Cc1cccn1C1CC1 ZINC001117747247 1169307458 /nfs/dbraw/zinc/30/74/58/1169307458.db2.gz DAUMKAWYEXLZHQ-UHFFFAOYSA-N 1 2 214.259 2.220 20 0 BEADLO CCOC1C[NH+](Cc2cccn2C2CC2)C1 ZINC001117867804 1169308478 /nfs/dbraw/zinc/30/84/78/1169308478.db2.gz HQIBFRXNLUKCAZ-UHFFFAOYSA-N 1 2 220.316 2.044 20 0 BEADLO Cn1c[nH+]cc1CO[C@H]1CCCC[C@H]1F ZINC001222600178 972600475 /nfs/dbraw/zinc/60/04/75/972600475.db2.gz MTVZCPHQBSIWAB-MNOVXSKESA-N 1 2 212.268 2.217 20 0 BEADLO c1nc(C[N@@H+]2CCCC23CCCCC3)n[nH]1 ZINC001327521127 972612910 /nfs/dbraw/zinc/61/29/10/972612910.db2.gz XWLSGGRNUXXRDB-UHFFFAOYSA-N 1 2 220.320 2.103 20 0 BEADLO c1nc(C[N@H+]2CCCC23CCCCC3)n[nH]1 ZINC001327521127 972612918 /nfs/dbraw/zinc/61/29/18/972612918.db2.gz XWLSGGRNUXXRDB-UHFFFAOYSA-N 1 2 220.320 2.103 20 0 BEADLO CCC[C@@H](C)[C@@H]1CCC[N@@H+]1Cc1nc[nH]n1 ZINC001327545934 972623398 /nfs/dbraw/zinc/62/33/98/972623398.db2.gz HONXKUUCNNOUSH-MNOVXSKESA-N 1 2 222.336 2.205 20 0 BEADLO CCC[C@@H](C)[C@@H]1CCC[N@H+]1Cc1nc[nH]n1 ZINC001327545934 972623405 /nfs/dbraw/zinc/62/34/05/972623405.db2.gz HONXKUUCNNOUSH-MNOVXSKESA-N 1 2 222.336 2.205 20 0 BEADLO Nc1[nH+]cccc1-c1ccc(=S)[nH]c1 ZINC001243474613 970767474 /nfs/dbraw/zinc/76/74/74/970767474.db2.gz OIHUDOVBHSVZTA-UHFFFAOYSA-N 1 2 203.270 2.015 20 0 BEADLO CCOc1cc(-c2ccc[nH+]c2N)cnc1F ZINC001243476910 970768638 /nfs/dbraw/zinc/76/86/38/970768638.db2.gz FRDZKSHCDFJWHX-UHFFFAOYSA-N 1 2 233.246 2.264 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2c(c1)[C@H](O)CCO2 ZINC001243476918 970773063 /nfs/dbraw/zinc/77/30/63/970773063.db2.gz WISNAWLYVOVOOT-GFCCVEGCSA-N 1 2 242.278 2.147 20 0 BEADLO Cc1c(F)cc[nH+]c1N[C@@H](CO)C(C)(C)C ZINC001157757297 970785112 /nfs/dbraw/zinc/78/51/12/970785112.db2.gz ISYROWVGAUCYSR-JTQLQIEISA-N 1 2 226.295 2.348 20 0 BEADLO C[C@@H](Cc1ccccn1)[N@@H+]1C[C@@H](F)C[C@H]1CF ZINC001256410756 970820128 /nfs/dbraw/zinc/82/01/28/970820128.db2.gz OAVAKJVGQZUTLJ-GVXVVHGQSA-N 1 2 240.297 2.395 20 0 BEADLO C[C@@H](Cc1ccccn1)[N@H+]1C[C@@H](F)C[C@H]1CF ZINC001256410756 970820132 /nfs/dbraw/zinc/82/01/32/970820132.db2.gz OAVAKJVGQZUTLJ-GVXVVHGQSA-N 1 2 240.297 2.395 20 0 BEADLO COC(C)(CNc1cc(C)c2[nH]ccc2[nH+]1)OC ZINC001170443176 970831195 /nfs/dbraw/zinc/83/11/95/970831195.db2.gz NYIWJFYMLGWULF-UHFFFAOYSA-N 1 2 249.314 2.292 20 0 BEADLO O=C(C=C1CCC1)Nc1ccn2cc[nH+]c2c1 ZINC001129481712 970844633 /nfs/dbraw/zinc/84/46/33/970844633.db2.gz PZGXXTHHKYHKSH-UHFFFAOYSA-N 1 2 227.267 2.383 20 0 BEADLO CC(C)[N@@H+]1CC[C@H]1c1nnc([C@H]2C[C@@H]2C)o1 ZINC001256702085 970929839 /nfs/dbraw/zinc/92/98/39/970929839.db2.gz XOWSEXSYCBGMOP-GUBZILKMSA-N 1 2 221.304 2.348 20 0 BEADLO CC(C)[N@H+]1CC[C@H]1c1nnc([C@H]2C[C@@H]2C)o1 ZINC001256702085 970929844 /nfs/dbraw/zinc/92/98/44/970929844.db2.gz XOWSEXSYCBGMOP-GUBZILKMSA-N 1 2 221.304 2.348 20 0 BEADLO COc1cc[nH+]cc1Nc1ccc(O)c(CO)c1 ZINC001216138081 970955897 /nfs/dbraw/zinc/95/58/97/970955897.db2.gz XXWYKVJGJBGWFU-UHFFFAOYSA-N 1 2 246.266 2.032 20 0 BEADLO CC(C)c1ccc(C2=C[NH2+]CCC2)nn1 ZINC001243947864 971035280 /nfs/dbraw/zinc/03/52/80/971035280.db2.gz QASCJZYWGBJTLL-UHFFFAOYSA-N 1 2 203.289 2.324 20 0 BEADLO CN(CC1CC1)c1cncc(C2=C[NH2+]CCC2)n1 ZINC001243950047 971041325 /nfs/dbraw/zinc/04/13/25/971041325.db2.gz UQWHZJACSKTIKZ-UHFFFAOYSA-N 1 2 244.342 2.047 20 0 BEADLO c1cncc(-c2ccc(C3=C[NH2+]CCC3)nn2)c1 ZINC001243949420 971041446 /nfs/dbraw/zinc/04/14/46/971041446.db2.gz KJKLQSIGAXBXCP-UHFFFAOYSA-N 1 2 238.294 2.263 20 0 BEADLO c1nnc(-c2ccc(C3=C[NH2+]CCC3)cc2)[nH]1 ZINC001243950371 971042259 /nfs/dbraw/zinc/04/22/59/971042259.db2.gz QHUPAFRIFNABIW-UHFFFAOYSA-N 1 2 226.283 2.196 20 0 BEADLO CC[C@H](CCC(=O)OC)C[NH+]1CC(C)(F)C1 ZINC001208776357 1169507293 /nfs/dbraw/zinc/50/72/93/1169507293.db2.gz DJRYLIHVTYJTRA-SNVBAGLBSA-N 1 2 231.311 2.010 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1cncs1 ZINC001209546180 1169514895 /nfs/dbraw/zinc/51/48/95/1169514895.db2.gz QNHLIUQMGILEPY-HTQZYQBOSA-N 1 2 200.282 2.075 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1cncs1 ZINC001209546180 1169514900 /nfs/dbraw/zinc/51/49/00/1169514900.db2.gz QNHLIUQMGILEPY-HTQZYQBOSA-N 1 2 200.282 2.075 20 0 BEADLO COCn1cc(Nc2cc(C)cc(C)[nH+]2)cn1 ZINC001216571431 971127107 /nfs/dbraw/zinc/12/71/07/971127107.db2.gz BHGVZROQAWFUEE-UHFFFAOYSA-N 1 2 232.287 2.242 20 0 BEADLO COc1cc(Nc2cncc(N)c2)cc(C)[nH+]1 ZINC001210438016 1169526481 /nfs/dbraw/zinc/52/64/81/1169526481.db2.gz SUISOXVCERVFHA-UHFFFAOYSA-N 1 2 230.271 2.119 20 0 BEADLO CCC[C@@H](CC)[N@@H+]1CCC(=O)[C@@H](F)C1 ZINC001257264684 971164562 /nfs/dbraw/zinc/16/45/62/971164562.db2.gz QSQVAPYBCCZIMA-ZJUUUORDSA-N 1 2 201.285 2.178 20 0 BEADLO CCC[C@@H](CC)[N@H+]1CCC(=O)[C@@H](F)C1 ZINC001257264684 971164575 /nfs/dbraw/zinc/16/45/75/971164575.db2.gz QSQVAPYBCCZIMA-ZJUUUORDSA-N 1 2 201.285 2.178 20 0 BEADLO Cc1cc(CO)ccc1Nc1[nH+]cccc1N ZINC001214657887 1169535771 /nfs/dbraw/zinc/53/57/71/1169535771.db2.gz WVBYZRQJHQLYGY-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO COc1cc(Nc2[nH+]cc(C)cc2N)cnc1F ZINC001216419049 1169543607 /nfs/dbraw/zinc/54/36/07/1169543607.db2.gz DWUSWHVDCGLJNU-UHFFFAOYSA-N 1 2 248.261 2.259 20 0 BEADLO Cc1cc([NH2+]CCN2CCCCC2=O)ccc1N ZINC000405415612 971254721 /nfs/dbraw/zinc/25/47/21/971254721.db2.gz ZSSZTLHHLSRXHG-UHFFFAOYSA-N 1 2 247.342 2.002 20 0 BEADLO CCCCCC[C@@H](C)[N@@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001257374052 971292297 /nfs/dbraw/zinc/29/22/97/971292297.db2.gz YPCAQHWPSAOGSN-WOPDTQHZSA-N 1 2 225.332 2.345 20 0 BEADLO CCCCCC[C@@H](C)[N@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001257374052 971292306 /nfs/dbraw/zinc/29/23/06/971292306.db2.gz YPCAQHWPSAOGSN-WOPDTQHZSA-N 1 2 225.332 2.345 20 0 BEADLO Cc1cc(N)nc(SCCCC2CC2)[nH+]1 ZINC000406014250 971324404 /nfs/dbraw/zinc/32/44/04/971324404.db2.gz VKJWXKSCHAHDPW-UHFFFAOYSA-N 1 2 223.345 2.480 20 0 BEADLO Cn1cnc2c1C[N@H+](Cc1ccsc1)CC2 ZINC001204046061 971470617 /nfs/dbraw/zinc/47/06/17/971470617.db2.gz VGROFJZKEWDSMQ-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO Cn1cnc2c1C[N@@H+](Cc1ccsc1)CC2 ZINC001204046061 971470627 /nfs/dbraw/zinc/47/06/27/971470627.db2.gz VGROFJZKEWDSMQ-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO FC1(C2CC2)C[NH+]([C@@H]2CCCSC2)C1 ZINC001257668965 971474532 /nfs/dbraw/zinc/47/45/32/971474532.db2.gz XRMCFVOJPRUSAO-SNVBAGLBSA-N 1 2 215.337 2.316 20 0 BEADLO Cc1cc(C)nc(O[C@@H]2CC[NH2+]CC2(F)F)c1 ZINC001218007987 971567413 /nfs/dbraw/zinc/56/74/13/971567413.db2.gz TVAXKWFDZVVODO-SNVBAGLBSA-N 1 2 242.269 2.074 20 0 BEADLO Cc1cc(C)nc(O[C@H]2CC[NH2+]CC2(F)F)c1 ZINC001218007986 971569977 /nfs/dbraw/zinc/56/99/77/971569977.db2.gz TVAXKWFDZVVODO-JTQLQIEISA-N 1 2 242.269 2.074 20 0 BEADLO Cc1cccc(O[C@H]2CC[NH2+]CC2(F)F)c1 ZINC001218006677 971571110 /nfs/dbraw/zinc/57/11/10/971571110.db2.gz RFVRLRAXYMLSMK-NSHDSACASA-N 1 2 227.254 2.371 20 0 BEADLO Fc1ccc(O[C@@H]2CC[NH2+]CC2(F)F)c(F)c1 ZINC001218004092 971571218 /nfs/dbraw/zinc/57/12/18/971571218.db2.gz AMVFOXZUQQCAQN-SNVBAGLBSA-N 1 2 249.207 2.341 20 0 BEADLO C[C@@H]1CC[NH2+]C[C@H]1Oc1ccc(S)cc1 ZINC001218047109 971586044 /nfs/dbraw/zinc/58/60/44/971586044.db2.gz CRDNVEGWAUVFIS-BXKDBHETSA-N 1 2 223.341 2.352 20 0 BEADLO CC(C)c1cccc(O[C@H]2C[NH2+]CC2(F)F)n1 ZINC001218232543 971643971 /nfs/dbraw/zinc/64/39/71/971643971.db2.gz CYRJPBHGPWXDIZ-JTQLQIEISA-N 1 2 242.269 2.191 20 0 BEADLO Cc1cc(S)ccc1O[C@H]1CCC[NH2+]C1 ZINC001218283778 971675260 /nfs/dbraw/zinc/67/52/60/971675260.db2.gz NKFKDJJBHUXASC-JTQLQIEISA-N 1 2 223.341 2.415 20 0 BEADLO CC(=O)Nc1c(C)cc[nH+]c1N1C2CCC1CC2 ZINC001159083042 971672846 /nfs/dbraw/zinc/67/28/46/971672846.db2.gz WOUCHVFZERSMQP-UHFFFAOYSA-N 1 2 245.326 2.480 20 0 BEADLO c1cc(-c2ccccc2Cn2cc[nH+]c2)n[nH]1 ZINC001245314509 971780633 /nfs/dbraw/zinc/78/06/33/971780633.db2.gz OFHTZACAYMEZPY-UHFFFAOYSA-N 1 2 224.267 2.322 20 0 BEADLO O[C@H]1C[C@H](COc2ccc(-c3[nH]cc[nH+]3)cc2)C1 ZINC001218431512 971809854 /nfs/dbraw/zinc/80/98/54/971809854.db2.gz UZQWSRRZKNSGSL-UMSPYCQHSA-N 1 2 244.294 2.226 20 0 BEADLO CC[C@@H](C)OCC[C@@H](C)[NH2+]C(C)(C)C(=O)OC ZINC001172322477 974534251 /nfs/dbraw/zinc/53/42/51/974534251.db2.gz VAGFXLAKJODQDS-GHMZBOCLSA-N 1 2 245.363 2.121 20 0 BEADLO CCOc1ccc(-c2c[nH+]c(N)c(C)c2)nc1 ZINC001245536570 971848573 /nfs/dbraw/zinc/84/85/73/971848573.db2.gz SDOYQOGNRSFCSN-UHFFFAOYSA-N 1 2 229.283 2.433 20 0 BEADLO Cc1cc(-c2ccc(C(N)=O)c(C)c2)c[nH+]c1N ZINC001245538452 971852298 /nfs/dbraw/zinc/85/22/98/971852298.db2.gz GGIPSBOHGCFGMM-UHFFFAOYSA-N 1 2 241.294 2.047 20 0 BEADLO CCc1nn(C[N@@H+]2C[C@@H](C)C[C@H]2C)c(=S)o1 ZINC001331008389 974556834 /nfs/dbraw/zinc/55/68/34/974556834.db2.gz PJPMIUJXKQFCFS-DTWKUNHWSA-N 1 2 241.360 2.456 20 0 BEADLO CCc1nn(C[N@H+]2C[C@@H](C)C[C@H]2C)c(=S)o1 ZINC001331008389 974556840 /nfs/dbraw/zinc/55/68/40/974556840.db2.gz PJPMIUJXKQFCFS-DTWKUNHWSA-N 1 2 241.360 2.456 20 0 BEADLO C[C@H]1COCC[C@H]1Nc1cc2cc[nH]c2c[nH+]1 ZINC001170814866 971889870 /nfs/dbraw/zinc/88/98/70/971889870.db2.gz WPCZBPHPZRYHSK-GXSJLCMTSA-N 1 2 231.299 2.400 20 0 BEADLO Cc1ccc(F)c(C[NH+]2CC(CO)C2)c1Cl ZINC001138027961 971972068 /nfs/dbraw/zinc/97/20/68/971972068.db2.gz QOGBOPNBPHPBEO-UHFFFAOYSA-N 1 2 243.709 2.212 20 0 BEADLO C[N@@H+]1CCC=C(c2cc3nc[nH]c3cc2F)C1 ZINC001241571977 1169734422 /nfs/dbraw/zinc/73/44/22/1169734422.db2.gz MFIUVRATBRQFJM-UHFFFAOYSA-N 1 2 231.274 2.421 20 0 BEADLO C[N@H+]1CCC=C(c2cc3nc[nH]c3cc2F)C1 ZINC001241571977 1169734429 /nfs/dbraw/zinc/73/44/29/1169734429.db2.gz MFIUVRATBRQFJM-UHFFFAOYSA-N 1 2 231.274 2.421 20 0 BEADLO CCC(CC)N(C(=O)Cc1c[nH+]cn1C)C1CC1 ZINC001136557248 972202833 /nfs/dbraw/zinc/20/28/33/972202833.db2.gz XKSRPKOPUQFDKP-UHFFFAOYSA-N 1 2 249.358 2.142 20 0 BEADLO F[C@@H]1C[N@H+](C[C@@H]2CCCCO2)CCC1(F)F ZINC001207954761 956891374 /nfs/dbraw/zinc/89/13/74/956891374.db2.gz UEQYRCJFLSKAMG-VHSXEESVSA-N 1 2 237.265 2.235 20 0 BEADLO F[C@@H]1C[N@@H+](C[C@@H]2CCCCO2)CCC1(F)F ZINC001207954761 956891375 /nfs/dbraw/zinc/89/13/75/956891375.db2.gz UEQYRCJFLSKAMG-VHSXEESVSA-N 1 2 237.265 2.235 20 0 BEADLO COc1nccnc1Nc1c[nH+]c(C)cc1C ZINC001213505249 956980658 /nfs/dbraw/zinc/98/06/58/956980658.db2.gz ACTWHQJEXJQKNW-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO COCn1cc(Nc2c[nH+]c(C)cc2C)cn1 ZINC001213510665 957060330 /nfs/dbraw/zinc/06/03/30/957060330.db2.gz GYXXRPUKVOYWEJ-UHFFFAOYSA-N 1 2 232.287 2.242 20 0 BEADLO C[C@@H]1C[C@@H](O)CC[N@@H+]1Cc1cnc(Cl)s1 ZINC000705349283 957162899 /nfs/dbraw/zinc/16/28/99/957162899.db2.gz VVPMYMSDMRJGCY-SFYZADRCSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H]1C[C@@H](O)CC[N@H+]1Cc1cnc(Cl)s1 ZINC000705349283 957162907 /nfs/dbraw/zinc/16/29/07/957162907.db2.gz VVPMYMSDMRJGCY-SFYZADRCSA-N 1 2 246.763 2.142 20 0 BEADLO Cc1c(F)cc[nH+]c1N1C[C@H]2OC[C@@H](C)[C@H]2C1 ZINC001167169641 957516661 /nfs/dbraw/zinc/51/66/61/957516661.db2.gz GCOQNJWLWAWPMT-HLUHBDAQSA-N 1 2 236.290 2.000 20 0 BEADLO COc1cc(C)c[nH+]c1N1CC[C@H]2OCC[C@@H]2C1 ZINC001167211807 957546136 /nfs/dbraw/zinc/54/61/36/957546136.db2.gz BFZKXORSHQLRJT-VXGBXAGGSA-N 1 2 248.326 2.014 20 0 BEADLO COC[C@@H](Nc1cc(N)cc(Cl)[nH+]1)C1CC1 ZINC000397258925 957558500 /nfs/dbraw/zinc/55/85/00/957558500.db2.gz JHVLIGASLCUWAP-SECBINFHSA-N 1 2 241.722 2.154 20 0 BEADLO Cc1cc(Nc2[nH+]cccc2N)ccc1O ZINC001209974383 957594409 /nfs/dbraw/zinc/59/44/09/957594409.db2.gz GNWFQBCEXQQVLB-UHFFFAOYSA-N 1 2 215.256 2.421 20 0 BEADLO CC[C@H](OCC[NH+]1CCOCC1)C(C)(C)C ZINC001210207182 957670711 /nfs/dbraw/zinc/67/07/11/957670711.db2.gz MIDLHOKHLUSHHF-LBPRGKRZSA-N 1 2 229.364 2.160 20 0 BEADLO Cc1c[nH+]c(Nc2cncc(N(C)C)c2)c(N)c1 ZINC001210471372 957759806 /nfs/dbraw/zinc/75/98/06/957759806.db2.gz PEEVBCFZDVBJJQ-UHFFFAOYSA-N 1 2 243.314 2.177 20 0 BEADLO Cc1ccn2c(C[N@H+](C)CCF)cnc2c1 ZINC001136894488 972297909 /nfs/dbraw/zinc/29/79/09/972297909.db2.gz TVAVTAVHIHAYNI-UHFFFAOYSA-N 1 2 221.279 2.044 20 0 BEADLO Cc1ccn2c(C[N@@H+](C)CCF)cnc2c1 ZINC001136894488 972297913 /nfs/dbraw/zinc/29/79/13/972297913.db2.gz TVAVTAVHIHAYNI-UHFFFAOYSA-N 1 2 221.279 2.044 20 0 BEADLO COc1cc(Nc2ncncc2C)cc(C)[nH+]1 ZINC001210780244 957874411 /nfs/dbraw/zinc/87/44/11/957874411.db2.gz LCVPGXWWJUFSDO-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO CCc1[nH+]ccc(C)c1Nc1ccncn1 ZINC001211029205 957997401 /nfs/dbraw/zinc/99/74/01/957997401.db2.gz QHDFZFIUWUCLEO-UHFFFAOYSA-N 1 2 214.272 2.486 20 0 BEADLO CNc1cc(N[C@H]2CCC[C@H]2C)[nH+]cn1 ZINC000087829550 958050683 /nfs/dbraw/zinc/05/06/83/958050683.db2.gz MCXGOLVIJLLZMX-BDAKNGLRSA-N 1 2 206.293 2.119 20 0 BEADLO Cc1cc(C)c(Nc2cc(N)c(O)cc2O)c[nH+]1 ZINC001213518417 958191380 /nfs/dbraw/zinc/19/13/80/958191380.db2.gz NCVDLOVOFRISRW-UHFFFAOYSA-N 1 2 245.282 2.435 20 0 BEADLO Cc1c[nH+]cc(Nc2cnn3c2OCCC3)c1C ZINC001213528631 958227632 /nfs/dbraw/zinc/22/76/32/958227632.db2.gz IWZLTLUUYALSOR-UHFFFAOYSA-N 1 2 244.298 2.421 20 0 BEADLO C[C@@H]1C[C@@H](N[C@@H]2C[NH2+]CC2(F)F)CC(C)(C)C1 ZINC001246462161 972334625 /nfs/dbraw/zinc/33/46/25/972334625.db2.gz QXAQMHDSLXEQIX-GMTAPVOTSA-N 1 2 246.345 2.398 20 0 BEADLO CC1(C)CCC[C@@H](N[C@H]2C[NH2+]CC2(F)F)C1 ZINC001246461261 972337143 /nfs/dbraw/zinc/33/71/43/972337143.db2.gz OHFWEWUVBSONMV-ZJUUUORDSA-N 1 2 232.318 2.152 20 0 BEADLO C[C@@H]1CC[C@H](N[C@H]2C[NH2+]CC2(F)F)C[C@@H]1C ZINC001246464565 972340814 /nfs/dbraw/zinc/34/08/14/972340814.db2.gz RXBYGJUWDLVYRA-RCWTZXSCSA-N 1 2 232.318 2.008 20 0 BEADLO C[C@@H]1CC[C@H]([NH2+][C@H]2CNCC2(F)F)C[C@@H]1C ZINC001246464565 972340817 /nfs/dbraw/zinc/34/08/17/972340817.db2.gz RXBYGJUWDLVYRA-RCWTZXSCSA-N 1 2 232.318 2.008 20 0 BEADLO Cc1c(F)cc(F)cc1C[NH+]1CC2(COC2)C1 ZINC001143758044 972363998 /nfs/dbraw/zinc/36/39/98/972363998.db2.gz VIDCQRBBYDMDCC-UHFFFAOYSA-N 1 2 239.265 2.105 20 0 BEADLO Cc1cc(C)c(NC(=O)C(F)F)c(C)[nH+]1 ZINC000844311163 972373905 /nfs/dbraw/zinc/37/39/05/972373905.db2.gz RRAGLZNZYGFLEV-UHFFFAOYSA-N 1 2 214.215 2.210 20 0 BEADLO C[C@H](COC(C)(C)C)OCCn1cc[nH+]c1 ZINC001222129310 972377189 /nfs/dbraw/zinc/37/71/89/972377189.db2.gz NFFLGLJQNALUCW-LLVKDONJSA-N 1 2 226.320 2.103 20 0 BEADLO c1cn(CCO[C@@H]2CCOc3ccccc32)c[nH+]1 ZINC001222134798 972382166 /nfs/dbraw/zinc/38/21/66/972382166.db2.gz OMWDPHKENGXNEA-CQSZACIVSA-N 1 2 244.294 2.424 20 0 BEADLO c1cn(CCO[C@H]2CC3CCC2CC3)c[nH+]1 ZINC001222135328 972382248 /nfs/dbraw/zinc/38/22/48/972382248.db2.gz YAALVTPNBJBXMC-BPCQOVAHSA-N 1 2 220.316 2.478 20 0 BEADLO C[C@H]1CCC[C@H](OCCn2cc[nH+]c2)C1 ZINC001222135065 972383684 /nfs/dbraw/zinc/38/36/84/972383684.db2.gz VDOLRWLUOWKOAQ-RYUDHWBXSA-N 1 2 208.305 2.478 20 0 BEADLO Cc1[nH+]c[nH]c1CN1CC(F)(F)C[C@@]1(C)CF ZINC001204587440 958877581 /nfs/dbraw/zinc/87/75/81/958877581.db2.gz DIPKIJVREWYTNV-JTQLQIEISA-N 1 2 247.264 2.287 20 0 BEADLO C[C@@H]1CCC[C@H](OCCn2cc[nH+]c2)C1 ZINC001222135062 972384970 /nfs/dbraw/zinc/38/49/70/972384970.db2.gz VDOLRWLUOWKOAQ-NEPJUHHUSA-N 1 2 208.305 2.478 20 0 BEADLO C[C@@H](OCCn1cc[nH+]c1)c1ccco1 ZINC001222138543 972385982 /nfs/dbraw/zinc/38/59/82/972385982.db2.gz GSGIWXQQVJAWEH-SNVBAGLBSA-N 1 2 206.245 2.254 20 0 BEADLO F[C@@H]1CCCC[C@@H]1OCCn1cc[nH+]c1 ZINC001222138522 972389732 /nfs/dbraw/zinc/38/97/32/972389732.db2.gz GCAIQIGLQMMTAD-MNOVXSKESA-N 1 2 212.268 2.180 20 0 BEADLO C[C@H]1CC[C@@H](OCCn2cc[nH+]c2)CC1 ZINC001222138902 972390279 /nfs/dbraw/zinc/39/02/79/972390279.db2.gz LTMTVWAHOLIMAX-TXEJJXNPSA-N 1 2 208.305 2.478 20 0 BEADLO CCc1[nH+]ccc(C)c1Nc1cnn(COC)c1 ZINC001216575266 959058660 /nfs/dbraw/zinc/05/86/60/959058660.db2.gz SLJUJBXFUMUNCG-UHFFFAOYSA-N 1 2 246.314 2.496 20 0 BEADLO CCOc1ccc(F)c(C[NH+](C)C)c1F ZINC001143929427 972398617 /nfs/dbraw/zinc/39/86/17/972398617.db2.gz KQCJFTJIIUCORN-UHFFFAOYSA-N 1 2 215.243 2.425 20 0 BEADLO Nc1cc(CNc2ccc3c(c2)OCO3)cc[nH+]1 ZINC001167616276 959085283 /nfs/dbraw/zinc/08/52/83/959085283.db2.gz CZWIDQGSPXZZIC-UHFFFAOYSA-N 1 2 243.266 2.005 20 0 BEADLO FCC[NH2+][C@H]1COCc2cccc(Cl)c21 ZINC000308899637 959286421 /nfs/dbraw/zinc/28/64/21/959286421.db2.gz BKNDWGNCAAMXEA-JTQLQIEISA-N 1 2 229.682 2.470 20 0 BEADLO Cc1cc(F)cc(NC(=O)C[C@H]([NH3+])C(F)F)c1 ZINC000724739330 959326253 /nfs/dbraw/zinc/32/62/53/959326253.db2.gz MIVRJERHCIGPJU-VIFPVBQESA-N 1 2 246.232 2.055 20 0 BEADLO CC[C@@H](CSC)[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000162113317 959495633 /nfs/dbraw/zinc/49/56/33/959495633.db2.gz ZLUSYXKACHVPAI-ZJUUUORDSA-N 1 2 247.404 2.448 20 0 BEADLO Cc1nnc(C[NH2+][C@H](c2ccncc2)C2CC2)o1 ZINC001351757436 959660312 /nfs/dbraw/zinc/66/03/12/959660312.db2.gz XMCSDUPXHLLYEI-ZDUSSCGKSA-N 1 2 244.298 2.014 20 0 BEADLO CO[C@@H]1CCN(c2[nH+]ccc3c(N)cccc32)C1 ZINC000694634294 959942647 /nfs/dbraw/zinc/94/26/47/959942647.db2.gz NPMLVOASPAPBTP-SNVBAGLBSA-N 1 2 243.310 2.042 20 0 BEADLO c1cn(Cc2ccc3cnccc3c2)c[nH+]1 ZINC001167727591 960253080 /nfs/dbraw/zinc/25/30/80/960253080.db2.gz DFBKXRXNGANUOF-UHFFFAOYSA-N 1 2 209.252 2.480 20 0 BEADLO COc1c[nH+]c(NC(C)(C)CCO)c2[nH]ccc21 ZINC001167741667 960394179 /nfs/dbraw/zinc/39/41/79/960394179.db2.gz VTXQAUWGMBQHOW-UHFFFAOYSA-N 1 2 249.314 2.144 20 0 BEADLO c1cc2ccncc2c(C[N@@H+]2CCO[C@H]3C[C@H]32)c1 ZINC001140648734 960475553 /nfs/dbraw/zinc/47/55/53/960475553.db2.gz LXKJKOJJPOIXTH-CABCVRRESA-N 1 2 240.306 2.208 20 0 BEADLO c1cc2ccncc2c(C[N@H+]2CCO[C@H]3C[C@H]32)c1 ZINC001140648734 960475558 /nfs/dbraw/zinc/47/55/58/960475558.db2.gz LXKJKOJJPOIXTH-CABCVRRESA-N 1 2 240.306 2.208 20 0 BEADLO CC[C@@H](C)NC(=S)Nc1cc[nH+]c2c1CCC2 ZINC001200468441 960511643 /nfs/dbraw/zinc/51/16/43/960511643.db2.gz HFPPZWBQTBOYIA-SECBINFHSA-N 1 2 249.383 2.077 20 0 BEADLO CC1(C)C[N@H+](Cc2c[nH]c3ccncc23)CCO1 ZINC001140799763 960578868 /nfs/dbraw/zinc/57/88/68/960578868.db2.gz LFPQQIIQGTVDRQ-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO CC1(C)C[N@@H+](Cc2c[nH]c3ccncc23)CCO1 ZINC001140799763 960578891 /nfs/dbraw/zinc/57/88/91/960578891.db2.gz LFPQQIIQGTVDRQ-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO C[C@@H](COc1ccccc1)OCc1c[nH+]cn1C ZINC001222595044 960722119 /nfs/dbraw/zinc/72/21/19/960722119.db2.gz MJNNJDRGJJUFIA-LBPRGKRZSA-N 1 2 246.310 2.404 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccnc2C)[nH]n1 ZINC001203081614 960744051 /nfs/dbraw/zinc/74/40/51/960744051.db2.gz XVULCMBCKJCFAB-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccnc2C)[nH]n1 ZINC001203081614 960744068 /nfs/dbraw/zinc/74/40/68/960744068.db2.gz XVULCMBCKJCFAB-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO c1coc(C[N@@H+]2CCC[C@H]2c2ccccn2)n1 ZINC001141008958 960804430 /nfs/dbraw/zinc/80/44/30/960804430.db2.gz QUMVZQMMZFNVIQ-LBPRGKRZSA-N 1 2 229.283 2.407 20 0 BEADLO c1coc(C[N@H+]2CCC[C@H]2c2ccccn2)n1 ZINC001141008958 960804431 /nfs/dbraw/zinc/80/44/31/960804431.db2.gz QUMVZQMMZFNVIQ-LBPRGKRZSA-N 1 2 229.283 2.407 20 0 BEADLO c1coc(C[N@@H+]2CCC[C@H]2c2cccnc2)n1 ZINC001141005668 960805667 /nfs/dbraw/zinc/80/56/67/960805667.db2.gz PQEHCZMRTMUGQB-LBPRGKRZSA-N 1 2 229.283 2.407 20 0 BEADLO c1coc(C[N@H+]2CCC[C@H]2c2cccnc2)n1 ZINC001141005668 960805678 /nfs/dbraw/zinc/80/56/78/960805678.db2.gz PQEHCZMRTMUGQB-LBPRGKRZSA-N 1 2 229.283 2.407 20 0 BEADLO C[N@@H+](Cc1ncco1)C[C@@H]1Cc2ccccc2O1 ZINC001141011845 960817435 /nfs/dbraw/zinc/81/74/35/960817435.db2.gz CGQLJDYCVOCFOU-LBPRGKRZSA-N 1 2 244.294 2.110 20 0 BEADLO C[N@H+](Cc1ncco1)C[C@@H]1Cc2ccccc2O1 ZINC001141011845 960817437 /nfs/dbraw/zinc/81/74/37/960817437.db2.gz CGQLJDYCVOCFOU-LBPRGKRZSA-N 1 2 244.294 2.110 20 0 BEADLO Cc1ncoc1C[N@@H+]1CCC[C@@H]1c1cnccn1 ZINC001141052898 960846527 /nfs/dbraw/zinc/84/65/27/960846527.db2.gz QAUPWQJGFIYFEP-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1ncoc1C[N@H+]1CCC[C@@H]1c1cnccn1 ZINC001141052898 960846532 /nfs/dbraw/zinc/84/65/32/960846532.db2.gz QAUPWQJGFIYFEP-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1ncoc1C[N@@H+]1CCC[C@H]1c1cnccn1 ZINC001141052899 960848862 /nfs/dbraw/zinc/84/88/62/960848862.db2.gz QAUPWQJGFIYFEP-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1ncoc1C[N@H+]1CCC[C@H]1c1cnccn1 ZINC001141052899 960848866 /nfs/dbraw/zinc/84/88/66/960848866.db2.gz QAUPWQJGFIYFEP-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO CCCCc1[nH]c(CN2C[C@H]3CC[C@@H]2CO3)c[nH+]1 ZINC001141074265 960858167 /nfs/dbraw/zinc/85/81/67/960858167.db2.gz DLDHSYAISXWOAG-CHWSQXEVSA-N 1 2 249.358 2.116 20 0 BEADLO CCCCc1[nH]cc(CN2C[C@H]3CC[C@@H]2CO3)[nH+]1 ZINC001141074265 960858172 /nfs/dbraw/zinc/85/81/72/960858172.db2.gz DLDHSYAISXWOAG-CHWSQXEVSA-N 1 2 249.358 2.116 20 0 BEADLO CCCCc1[nH]c(CN(C)Cc2ccon2)c[nH+]1 ZINC001141071765 960861724 /nfs/dbraw/zinc/86/17/24/960861724.db2.gz DGDMUDBMLJOVNW-UHFFFAOYSA-N 1 2 248.330 2.372 20 0 BEADLO CCCCc1[nH]cc(CN(C)Cc2ccon2)[nH+]1 ZINC001141071765 960861743 /nfs/dbraw/zinc/86/17/43/960861743.db2.gz DGDMUDBMLJOVNW-UHFFFAOYSA-N 1 2 248.330 2.372 20 0 BEADLO C[C@@]1(F)CCCC[N@H+](Cc2cocn2)C1 ZINC001141126341 960871701 /nfs/dbraw/zinc/87/17/01/960871701.db2.gz ILJSBMFCENSYNZ-LLVKDONJSA-N 1 2 212.268 2.389 20 0 BEADLO C[C@@]1(F)CCCC[N@@H+](Cc2cocn2)C1 ZINC001141126341 960871704 /nfs/dbraw/zinc/87/17/04/960871704.db2.gz ILJSBMFCENSYNZ-LLVKDONJSA-N 1 2 212.268 2.389 20 0 BEADLO Cc1ccc(Nc2[nH+]cccc2N)cc1O ZINC001211691161 961002676 /nfs/dbraw/zinc/00/26/76/961002676.db2.gz ZWXUUKPYUCHWOE-UHFFFAOYSA-N 1 2 215.256 2.421 20 0 BEADLO FC1(F)CN(Cc2cccc(-n3cc[nH+]c3)c2)C1 ZINC001141238331 961018426 /nfs/dbraw/zinc/01/84/26/961018426.db2.gz JTASNXRJZCSXSN-UHFFFAOYSA-N 1 2 249.264 2.323 20 0 BEADLO C[N@H+](Cc1ccno1)Cc1cccc2c1OCO2 ZINC001141960587 961195787 /nfs/dbraw/zinc/19/57/87/961195787.db2.gz XAWOMPGJJWGGHL-UHFFFAOYSA-N 1 2 246.266 2.035 20 0 BEADLO C[N@@H+](Cc1ccno1)Cc1cccc2c1OCO2 ZINC001141960587 961195798 /nfs/dbraw/zinc/19/57/98/961195798.db2.gz XAWOMPGJJWGGHL-UHFFFAOYSA-N 1 2 246.266 2.035 20 0 BEADLO CCc1cc(C[N@H+](C)Cc2ccncc2)on1 ZINC001203211457 961304381 /nfs/dbraw/zinc/30/43/81/961304381.db2.gz DRDJINQUSOAEFO-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1cc(C[N@@H+](C)Cc2ccncc2)on1 ZINC001203211457 961304405 /nfs/dbraw/zinc/30/44/05/961304405.db2.gz DRDJINQUSOAEFO-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1cc(C[N@@H+]2C[C@@H](C)[C@@H](F)C2)on1 ZINC001203211396 961310317 /nfs/dbraw/zinc/31/03/17/961310317.db2.gz BOGSGXFWQWAWFU-KCJUWKMLSA-N 1 2 212.268 2.027 20 0 BEADLO CCc1cc(C[N@H+]2C[C@@H](C)[C@@H](F)C2)on1 ZINC001203211396 961310321 /nfs/dbraw/zinc/31/03/21/961310321.db2.gz BOGSGXFWQWAWFU-KCJUWKMLSA-N 1 2 212.268 2.027 20 0 BEADLO Cc1c(NC(=O)C(C)(C)C)ccnc1NC=[NH2+] ZINC001167865019 961335270 /nfs/dbraw/zinc/33/52/70/961335270.db2.gz QVKFWFOQUUMSCA-UHFFFAOYSA-N 1 2 234.303 2.394 20 0 BEADLO COCOCCc1[nH]c2cc(C)c(C)cc2[nH+]1 ZINC001250591146 1169788167 /nfs/dbraw/zinc/78/81/67/1169788167.db2.gz BVTVRPXTWILXFG-UHFFFAOYSA-N 1 2 234.299 2.343 20 0 BEADLO Oc1ccc2c(c1)C1(CC1)C[N@@H+](CCF)C2 ZINC001343648575 961428892 /nfs/dbraw/zinc/42/88/92/961428892.db2.gz ZFMZBVGWRWWONH-UHFFFAOYSA-N 1 2 221.275 2.209 20 0 BEADLO Oc1ccc2c(c1)C1(CC1)C[N@H+](CCF)C2 ZINC001343648575 961428916 /nfs/dbraw/zinc/42/89/16/961428916.db2.gz ZFMZBVGWRWWONH-UHFFFAOYSA-N 1 2 221.275 2.209 20 0 BEADLO CNc1nc(Cl)ncc1C[NH+]1CCCCC1 ZINC001142473901 961445562 /nfs/dbraw/zinc/44/55/62/961445562.db2.gz YQLAONADXDUYJX-UHFFFAOYSA-N 1 2 240.738 2.158 20 0 BEADLO Cc1nc(N[C@H]2CCCOC2)cc(C(C)C)[nH+]1 ZINC000709767305 961488405 /nfs/dbraw/zinc/48/84/05/961488405.db2.gz LIZSWHXSYVHCPB-NSHDSACASA-N 1 2 235.331 2.499 20 0 BEADLO C[N@H+](Cc1ccon1)Cc1cccc2[nH]cnc21 ZINC001142690005 961620316 /nfs/dbraw/zinc/62/03/16/961620316.db2.gz PPAWAADZJYINBN-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO C[N@@H+](Cc1ccon1)Cc1cccc2[nH]cnc21 ZINC001142690005 961620327 /nfs/dbraw/zinc/62/03/27/961620327.db2.gz PPAWAADZJYINBN-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO Cc1nc(N2CCCC[C@H]2CO)cc(C(C)C)[nH+]1 ZINC000709818412 961645169 /nfs/dbraw/zinc/64/51/69/961645169.db2.gz BUUYCDDAVONUHJ-LBPRGKRZSA-N 1 2 249.358 2.260 20 0 BEADLO CCC(=O)Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001142719446 961680334 /nfs/dbraw/zinc/68/03/34/961680334.db2.gz PKYRCDJBSBCNBT-UHFFFAOYSA-N 1 2 229.283 2.280 20 0 BEADLO CC(C)CN(CC(C)C)c1cc(N)nc[nH+]1 ZINC000087821150 961746018 /nfs/dbraw/zinc/74/60/18/961746018.db2.gz ZBYSHRDYVYWLHR-UHFFFAOYSA-N 1 2 222.336 2.177 20 0 BEADLO COc1c(F)cc(F)cc1C[NH+]1CCC1 ZINC001143549898 961819121 /nfs/dbraw/zinc/81/91/21/961819121.db2.gz CSODTYZVZVHZCV-UHFFFAOYSA-N 1 2 213.227 2.179 20 0 BEADLO N#Cc1ccccc1C[N@H+]1CCC[C@@H]1CF ZINC000292906286 961855862 /nfs/dbraw/zinc/85/58/62/961855862.db2.gz ARIAIOKYLRBRCO-CYBMUJFWSA-N 1 2 218.275 2.492 20 0 BEADLO N#Cc1ccccc1C[N@@H+]1CCC[C@@H]1CF ZINC000292906286 961855864 /nfs/dbraw/zinc/85/58/64/961855864.db2.gz ARIAIOKYLRBRCO-CYBMUJFWSA-N 1 2 218.275 2.492 20 0 BEADLO CCC/C=C/C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000729372094 962187640 /nfs/dbraw/zinc/18/76/40/962187640.db2.gz NODOZTQVKLRJBR-WXJAXGNASA-N 1 2 247.342 2.403 20 0 BEADLO CN(C(=O)c1c[nH]c2cc[nH+]cc21)C(C)(C)C ZINC001152976284 962507830 /nfs/dbraw/zinc/50/78/30/962507830.db2.gz INOROGZIDXFIRU-UHFFFAOYSA-N 1 2 231.299 2.433 20 0 BEADLO CC(C)[NH+]1CC(Oc2ccnc(Cl)c2)C1 ZINC001225778478 962823681 /nfs/dbraw/zinc/82/36/81/962823681.db2.gz GODZJGHRCNFOQJ-UHFFFAOYSA-N 1 2 226.707 2.206 20 0 BEADLO CC[C@@H](C)Nc1ccc(-n2c[nH+]c(C)c2C)nn1 ZINC001168000251 963221105 /nfs/dbraw/zinc/22/11/05/963221105.db2.gz SGIPKCARJIJVEA-SECBINFHSA-N 1 2 245.330 2.490 20 0 BEADLO Cc1nc(NCCn2cccc2)c2c([nH+]1)CCC2 ZINC001156299862 963304384 /nfs/dbraw/zinc/30/43/84/963304384.db2.gz UVEWKZBAVVGNQN-UHFFFAOYSA-N 1 2 242.326 2.187 20 0 BEADLO Cc1ccc(Nc2cc(N)c(O)cc2O)c(C)[nH+]1 ZINC001203376739 963320976 /nfs/dbraw/zinc/32/09/76/963320976.db2.gz QXCLAKVGCOLYQL-UHFFFAOYSA-N 1 2 245.282 2.435 20 0 BEADLO O=C1CC(Nc2cccc(C3CC3)[nH+]2)C1 ZINC001156618808 963413305 /nfs/dbraw/zinc/41/33/05/963413305.db2.gz TZEYLUNTTOUHGX-UHFFFAOYSA-N 1 2 202.257 2.102 20 0 BEADLO COc1cc(F)cc(C[NH2+]Cc2cocn2)c1 ZINC000192340499 963481163 /nfs/dbraw/zinc/48/11/63/963481163.db2.gz RWENOBBMBLLJCG-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO CSc1cc[nH+]c(NCc2cc(C)n(C)n2)c1 ZINC001156954297 963498448 /nfs/dbraw/zinc/49/84/48/963498448.db2.gz PYONOXDWQZSTHC-UHFFFAOYSA-N 1 2 248.355 2.458 20 0 BEADLO Nc1[nH+]c(NC2(CO)CCCC2)ccc1Cl ZINC001157008350 963513739 /nfs/dbraw/zinc/51/37/39/963513739.db2.gz UHSZZEIFHAOEAA-UHFFFAOYSA-N 1 2 241.722 2.034 20 0 BEADLO [NH2+]=CNc1cc(-c2nc(C3CC3)no2)ccn1 ZINC001157079969 963526481 /nfs/dbraw/zinc/52/64/81/963526481.db2.gz KVIQBEQDGMNRDU-UHFFFAOYSA-N 1 2 229.243 2.028 20 0 BEADLO Cc1c[nH+]c(N2CCC[C@@H]3C[C@@H]32)nc1NC1CC1 ZINC001157131359 963538644 /nfs/dbraw/zinc/53/86/44/963538644.db2.gz BZIUWPXNDXTMTP-PWSUYJOCSA-N 1 2 244.342 2.348 20 0 BEADLO Nc1[nH+]c(N2CCC[C@@H]3C[C@@H]32)ccc1Cl ZINC001157151181 963549441 /nfs/dbraw/zinc/54/94/41/963549441.db2.gz IJAARPWMNHRBRD-APPZFPTMSA-N 1 2 223.707 2.306 20 0 BEADLO CCOC(=O)Cc1ccc(N[C@H](C)CC)[nH+]c1 ZINC001157239300 963563352 /nfs/dbraw/zinc/56/33/52/963563352.db2.gz ZRUCBWWNUBIDPE-SNVBAGLBSA-N 1 2 236.315 2.398 20 0 BEADLO CSc1cc[nH+]c(N(C)Cc2ccno2)c1 ZINC001157354420 963581136 /nfs/dbraw/zinc/58/11/36/963581136.db2.gz XCDOPYZZWHWWNL-UHFFFAOYSA-N 1 2 235.312 2.428 20 0 BEADLO CCCNc1[nH+]cccc1CC(=O)OCC ZINC001157358108 963581054 /nfs/dbraw/zinc/58/10/54/963581054.db2.gz JQBMTZOQNFKNCV-UHFFFAOYSA-N 1 2 222.288 2.009 20 0 BEADLO CCN(c1ncc(C)cc1Cl)C1C[NH+](C)C1 ZINC001157455361 963605499 /nfs/dbraw/zinc/60/54/99/963605499.db2.gz IBVUNGNRGXHXER-UHFFFAOYSA-N 1 2 239.750 2.184 20 0 BEADLO CC[NH+]1CC(Oc2cc(Cl)cc(OC)c2)C1 ZINC001227898294 963621610 /nfs/dbraw/zinc/62/16/10/963621610.db2.gz AYTZGWAMTCQLBU-UHFFFAOYSA-N 1 2 241.718 2.432 20 0 BEADLO Cc1cc(NCC2CC(=O)C2)nc(C(C)(C)C)[nH+]1 ZINC001157611439 963680236 /nfs/dbraw/zinc/68/02/36/963680236.db2.gz WMNNACSEYMZBPU-UHFFFAOYSA-N 1 2 247.342 2.474 20 0 BEADLO CCCNc1[nH+]cccc1CCC(=O)OCC ZINC001168132593 963822663 /nfs/dbraw/zinc/82/26/63/963822663.db2.gz SXLJZLWCVRZCAE-UHFFFAOYSA-N 1 2 236.315 2.399 20 0 BEADLO COc1c[nH+]c(N[C@H](C)c2cnccn2)c(C)c1 ZINC001158597569 963893813 /nfs/dbraw/zinc/89/38/13/963893813.db2.gz XZOCPWOCTUVGCN-SNVBAGLBSA-N 1 2 244.298 2.362 20 0 BEADLO CCC[C@@](C)(CC)C(=O)N1CC2(CC[N@@H+]2C)C1 ZINC001272056498 963950997 /nfs/dbraw/zinc/95/09/97/963950997.db2.gz HMCPXOQHYHWGSR-CYBMUJFWSA-N 1 2 238.375 2.119 20 0 BEADLO CCC[C@@](C)(CC)C(=O)N1CC2(CC[N@H+]2C)C1 ZINC001272056498 963951004 /nfs/dbraw/zinc/95/10/04/963951004.db2.gz HMCPXOQHYHWGSR-CYBMUJFWSA-N 1 2 238.375 2.119 20 0 BEADLO CC1CCC([N@@H+]2CC[C@@H](O)C(F)(F)C2)CC1 ZINC001168219798 963995071 /nfs/dbraw/zinc/99/50/71/963995071.db2.gz OOIARCRYVOGAIE-VQXHTEKXSA-N 1 2 233.302 2.267 20 0 BEADLO CC1CCC([N@H+]2CC[C@@H](O)C(F)(F)C2)CC1 ZINC001168219798 963995081 /nfs/dbraw/zinc/99/50/81/963995081.db2.gz OOIARCRYVOGAIE-VQXHTEKXSA-N 1 2 233.302 2.267 20 0 BEADLO COc1ccc2c(c1)C[C@@H]([NH2+][C@@H]1CC1(F)F)C2 ZINC001168228710 964009528 /nfs/dbraw/zinc/00/95/28/964009528.db2.gz ISDRJQAOMPZEKK-CMPLNLGQSA-N 1 2 239.265 2.160 20 0 BEADLO Cc1cc(N[C@H]2C[C@@H](CO)C2)ccc1[NH+](C)C ZINC001168246532 964056848 /nfs/dbraw/zinc/05/68/48/964056848.db2.gz MLBHAVDPGZYNDY-BJHJDKERSA-N 1 2 234.343 2.244 20 0 BEADLO Cc1cc([NH2+][C@H]2C[C@@H](CO)C2)ccc1N(C)C ZINC001168246532 964056861 /nfs/dbraw/zinc/05/68/61/964056861.db2.gz MLBHAVDPGZYNDY-BJHJDKERSA-N 1 2 234.343 2.244 20 0 BEADLO Cc1c(F)cc[nH+]c1N[C@H]1CCOC[C@H]1C ZINC001159711874 964161051 /nfs/dbraw/zinc/16/10/51/964161051.db2.gz URGFZQMNQNHODH-KCJUWKMLSA-N 1 2 224.279 2.366 20 0 BEADLO COc1c[nH+]c(N[C@@H]2CCOC[C@@H]2C)c(C)c1 ZINC001159710925 964161169 /nfs/dbraw/zinc/16/11/69/964161169.db2.gz KPYVWLUZKFDNIX-CMPLNLGQSA-N 1 2 236.315 2.236 20 0 BEADLO COc1c[nH+]c(N[C@H]2CCOC[C@H]2C)c(C)c1 ZINC001159710928 964161580 /nfs/dbraw/zinc/16/15/80/964161580.db2.gz KPYVWLUZKFDNIX-PWSUYJOCSA-N 1 2 236.315 2.236 20 0 BEADLO Cc1cccc(-c2noc(C[NH+]3CCC3)n2)c1 ZINC001212095437 964253291 /nfs/dbraw/zinc/25/32/91/964253291.db2.gz HWNUVAURHHEOBL-UHFFFAOYSA-N 1 2 229.283 2.251 20 0 BEADLO COC(C[N@H+](C)Cc1sccc1Cl)OC ZINC000714669547 964298909 /nfs/dbraw/zinc/29/89/09/964298909.db2.gz LRZBWMWRLOWDCZ-UHFFFAOYSA-N 1 2 249.763 2.452 20 0 BEADLO COC(C[N@@H+](C)Cc1sccc1Cl)OC ZINC000714669547 964298916 /nfs/dbraw/zinc/29/89/16/964298916.db2.gz LRZBWMWRLOWDCZ-UHFFFAOYSA-N 1 2 249.763 2.452 20 0 BEADLO CCC(F)(F)C[NH2+]C[C@H](O)c1ccccc1 ZINC000697628740 964361089 /nfs/dbraw/zinc/36/10/89/964361089.db2.gz DXYZBXZKUIVPTK-NSHDSACASA-N 1 2 229.270 2.355 20 0 BEADLO O=c1ccc(CNc2ccn3cc[nH+]c3c2)c[nH]1 ZINC001168300463 964398366 /nfs/dbraw/zinc/39/83/66/964398366.db2.gz XCUJWKQYNIJDDI-UHFFFAOYSA-N 1 2 240.266 2.047 20 0 BEADLO COC(C[N@H+](C)Cc1cccc(F)c1F)OC ZINC000714688983 964439871 /nfs/dbraw/zinc/43/98/71/964439871.db2.gz KNAWICRWRDLRSX-UHFFFAOYSA-N 1 2 245.269 2.016 20 0 BEADLO COC(C[N@@H+](C)Cc1cccc(F)c1F)OC ZINC000714688983 964439874 /nfs/dbraw/zinc/43/98/74/964439874.db2.gz KNAWICRWRDLRSX-UHFFFAOYSA-N 1 2 245.269 2.016 20 0 BEADLO CCC1(Nc2c(C)cc[nH+]c2C)COC1 ZINC001168321501 964441772 /nfs/dbraw/zinc/44/17/72/964441772.db2.gz HOLGMGSHCRYYEM-UHFFFAOYSA-N 1 2 206.289 2.289 20 0 BEADLO FCCn1nccc1Nc1cccc2[nH+]c[nH]c21 ZINC001213029742 964528799 /nfs/dbraw/zinc/52/87/99/964528799.db2.gz UZBALIXTCWGJEE-UHFFFAOYSA-N 1 2 245.261 2.473 20 0 BEADLO O[C@H](Cn1cc[nH+]c1)c1cc2ccccc2o1 ZINC000034521456 964529867 /nfs/dbraw/zinc/52/98/67/964529867.db2.gz PVTQJIUXINAPEU-LLVKDONJSA-N 1 2 228.251 2.363 20 0 BEADLO OCc1ncccc1Nc1cccc2[nH+]c[nH]c21 ZINC001213029863 964535941 /nfs/dbraw/zinc/53/59/41/964535941.db2.gz VXVCSSWPHBSSOD-UHFFFAOYSA-N 1 2 240.266 2.194 20 0 BEADLO COc1c[nH+]c(NC2CSC2)c2[nH]ccc21 ZINC001168362007 964624559 /nfs/dbraw/zinc/62/45/59/964624559.db2.gz HYZMRHZYNFQIOE-UHFFFAOYSA-N 1 2 235.312 2.099 20 0 BEADLO CCN(C)c1cc(NCC(C)C)[nH+]cn1 ZINC001161644709 964659564 /nfs/dbraw/zinc/65/95/64/964659564.db2.gz HBEGUQOLWWBHKJ-UHFFFAOYSA-N 1 2 208.309 2.001 20 0 BEADLO CCN(C)c1cc(NCC(C)C)nc[nH+]1 ZINC001161644709 964659569 /nfs/dbraw/zinc/65/95/69/964659569.db2.gz HBEGUQOLWWBHKJ-UHFFFAOYSA-N 1 2 208.309 2.001 20 0 BEADLO c1cn2ccc(NCCCn3cc[nH+]c3)cc2n1 ZINC001161682238 964684836 /nfs/dbraw/zinc/68/48/36/964684836.db2.gz MYDKXPBAVBTZBN-UHFFFAOYSA-N 1 2 241.298 2.033 20 0 BEADLO c1cn(CCCNc2cccc3c2CCN3)c[nH+]1 ZINC001161688320 964686464 /nfs/dbraw/zinc/68/64/64/964686464.db2.gz OUZBOHJPUBWELF-UHFFFAOYSA-N 1 2 242.326 2.353 20 0 BEADLO c1cn(CCCNc2cccc3c2OCC3)c[nH+]1 ZINC001161688474 964687170 /nfs/dbraw/zinc/68/71/70/964687170.db2.gz UBDOWFVHSOSFPM-UHFFFAOYSA-N 1 2 243.310 2.320 20 0 BEADLO Oc1cccc(NCCCn2cc[nH+]c2)c1 ZINC001161689133 964687414 /nfs/dbraw/zinc/68/74/14/964687414.db2.gz IUNQMNPWYLJYCT-UHFFFAOYSA-N 1 2 217.272 2.091 20 0 BEADLO c1cn(Cc2ccc(NC3CSC3)cc2)c[nH+]1 ZINC001168365051 964697271 /nfs/dbraw/zinc/69/72/71/964697271.db2.gz ZSYXSSHDDRGOSV-UHFFFAOYSA-N 1 2 245.351 2.459 20 0 BEADLO CC(C)[C@H](CO)Nc1ccc(-n2cccc2)c[nH+]1 ZINC001161735426 964722905 /nfs/dbraw/zinc/72/29/05/964722905.db2.gz PFAWARKUAPVABR-ZDUSSCGKSA-N 1 2 245.326 2.301 20 0 BEADLO CC(C)[C@H](CO)Nc1[nH+]cccc1-n1cccc1 ZINC001161737692 964723826 /nfs/dbraw/zinc/72/38/26/964723826.db2.gz SQVSTNJDVHNGFF-LBPRGKRZSA-N 1 2 245.326 2.301 20 0 BEADLO COC(=[NH2+])c1cccc(NCc2ccnn2C)c1 ZINC001161876050 964805156 /nfs/dbraw/zinc/80/51/56/964805156.db2.gz PDCWVKDIDXOWST-UHFFFAOYSA-N 1 2 244.298 2.004 20 0 BEADLO CNc1ccc(NCc2ncccc2C)c[nH+]1 ZINC001161883282 964808503 /nfs/dbraw/zinc/80/85/03/964808503.db2.gz FKRZNXKAOZPWIM-UHFFFAOYSA-N 1 2 228.299 2.439 20 0 BEADLO Cc1cc(NC2CSC2)[nH+]c2cc[nH]c21 ZINC001168367173 964810548 /nfs/dbraw/zinc/81/05/48/964810548.db2.gz HZIDHUSZAYMUNE-UHFFFAOYSA-N 1 2 219.313 2.399 20 0 BEADLO c1cc(-c2cc[nH+]c(NCC3COC3)c2)ccn1 ZINC001161943378 964827397 /nfs/dbraw/zinc/82/73/97/964827397.db2.gz NVYXYTXJWKBOLJ-UHFFFAOYSA-N 1 2 241.294 2.202 20 0 BEADLO CC(C)COc1cc(NCC2COC2)cc[nH+]1 ZINC001161951576 964835872 /nfs/dbraw/zinc/83/58/72/964835872.db2.gz WOCITYZDNYDDEW-UHFFFAOYSA-N 1 2 236.315 2.175 20 0 BEADLO Cc1oncc1CNc1cc2cc[nH]c2c[nH+]1 ZINC001162266911 964896348 /nfs/dbraw/zinc/89/63/48/964896348.db2.gz SSHUQDKGYNLJKK-UHFFFAOYSA-N 1 2 228.255 2.471 20 0 BEADLO c1cc2cc[nH+]c(NCCN3CCCCO3)c2[nH]1 ZINC001162425166 964972401 /nfs/dbraw/zinc/97/24/01/964972401.db2.gz PWUZGGGVEWHUCU-UHFFFAOYSA-N 1 2 246.314 2.002 20 0 BEADLO O=c1cc(Nc2cc[nH+]cc2Cl)cc[nH]1 ZINC001212146312 965075426 /nfs/dbraw/zinc/07/54/26/965075426.db2.gz DQDXRMINMXZTIP-UHFFFAOYSA-N 1 2 221.647 2.001 20 0 BEADLO Cc1cc([NH2+]CCC(=O)N(C)C2CC2)ccc1N ZINC001162627589 965078894 /nfs/dbraw/zinc/07/88/94/965078894.db2.gz NSZPEBOUVUJBQU-UHFFFAOYSA-N 1 2 247.342 2.000 20 0 BEADLO CN(C)C(=O)c1cccnc1NC(=[NH2+])C(C)(C)C ZINC001162657187 965091343 /nfs/dbraw/zinc/09/13/43/965091343.db2.gz IKSHWNBUOSIXIP-UHFFFAOYSA-N 1 2 248.330 2.219 20 0 BEADLO COc1cccc(CCNc2c[nH+]ccc2C)n1 ZINC001162742726 965151430 /nfs/dbraw/zinc/15/14/30/965151430.db2.gz VRVBICXJXXXPED-UHFFFAOYSA-N 1 2 243.310 2.448 20 0 BEADLO Cc1cc([NH2+]CC2CC(=O)C2)ccc1N(C)C ZINC001168397668 965162126 /nfs/dbraw/zinc/16/21/26/965162126.db2.gz BWXPPMURSMXUHK-UHFFFAOYSA-N 1 2 232.327 2.452 20 0 BEADLO Cc1cc(NCC2CC(=O)C2)ccc1[NH+](C)C ZINC001168397668 965162134 /nfs/dbraw/zinc/16/21/34/965162134.db2.gz BWXPPMURSMXUHK-UHFFFAOYSA-N 1 2 232.327 2.452 20 0 BEADLO C[C@@H](Nc1ccc(Cl)c(N)[nH+]1)c1ccno1 ZINC001163214380 965307727 /nfs/dbraw/zinc/30/77/27/965307727.db2.gz BOVLKGPJVUSXCV-ZCFIWIBFSA-N 1 2 238.678 2.478 20 0 BEADLO COc1cc2ccc(N3CCC3)[nH+]c2cc1OC ZINC001163537885 965434322 /nfs/dbraw/zinc/43/43/22/965434322.db2.gz UYRXPORTOSBKNK-UHFFFAOYSA-N 1 2 244.294 2.462 20 0 BEADLO O=C1CCC[N@@H+]([C@H]2CCc3cc(F)ccc3C2)C1 ZINC001168440867 965618447 /nfs/dbraw/zinc/61/84/47/965618447.db2.gz NCVBGGZEANMDKI-AWEZNQCLSA-N 1 2 247.313 2.348 20 0 BEADLO O=C1CCC[N@H+]([C@H]2CCc3cc(F)ccc3C2)C1 ZINC001168440867 965618461 /nfs/dbraw/zinc/61/84/61/965618461.db2.gz NCVBGGZEANMDKI-AWEZNQCLSA-N 1 2 247.313 2.348 20 0 BEADLO CN(Cc1ncccn1)c1cccc(C2CC2)[nH+]1 ZINC001163926788 965637868 /nfs/dbraw/zinc/63/78/68/965637868.db2.gz JHBQLXCVLJVNPS-UHFFFAOYSA-N 1 2 240.310 2.385 20 0 BEADLO COc1ccc(C)[nH+]c1N1CCCO[C@H](C)C1 ZINC001163962031 965662303 /nfs/dbraw/zinc/66/23/03/965662303.db2.gz LRDOJMXUQPCHLT-LLVKDONJSA-N 1 2 236.315 2.014 20 0 BEADLO CCCc1cc(N2CCCO[C@@H](C)C2)nc(C)[nH+]1 ZINC001163961884 965662715 /nfs/dbraw/zinc/66/27/15/965662715.db2.gz BFFMFWPAWALBDW-NSHDSACASA-N 1 2 249.358 2.353 20 0 BEADLO O=C1CN(c2cc3[nH]ccc3c[nH+]2)CCC[C@H]1F ZINC001164018033 965694828 /nfs/dbraw/zinc/69/48/28/965694828.db2.gz BTPINNZUKJSRSL-SNVBAGLBSA-N 1 2 247.273 2.070 20 0 BEADLO COCCOc1cc(NC2(C)CCC2)cc[nH+]1 ZINC001164032060 965706357 /nfs/dbraw/zinc/70/63/57/965706357.db2.gz NTXBFEBOWMZGHY-UHFFFAOYSA-N 1 2 236.315 2.461 20 0 BEADLO Cc1nc(N2C[C@@H](F)[C@H](F)C2)cc(C(C)C)[nH+]1 ZINC001164209465 965795593 /nfs/dbraw/zinc/79/55/93/965795593.db2.gz BRUWDYGJHHUCOP-NXEZZACHSA-N 1 2 241.285 2.405 20 0 BEADLO Cc1c(F)cc[nH+]c1N1C[C@@H](F)[C@H](F)C1 ZINC001164210929 965796513 /nfs/dbraw/zinc/79/65/13/965796513.db2.gz NMAJXYDFUWBKTG-RKDXNWHRSA-N 1 2 216.206 2.025 20 0 BEADLO Cc1cc(N2C[C@@H](F)[C@H](F)C2)nc(C2CC2)[nH+]1 ZINC001164215281 965801167 /nfs/dbraw/zinc/80/11/67/965801167.db2.gz RGJAHSHOJFMTSC-NXEZZACHSA-N 1 2 239.269 2.159 20 0 BEADLO CSc1cc[nH+]c(N2[C@@H](C)CC[C@H]2CO)c1 ZINC001164309569 965838486 /nfs/dbraw/zinc/83/84/86/965838486.db2.gz NRIDLMUGDVLVJV-UWVGGRQHSA-N 1 2 238.356 2.153 20 0 BEADLO COc1cc(C)c[nH+]c1N1CCC(=O)[C@@H](C)CC1 ZINC001164368860 965866046 /nfs/dbraw/zinc/86/60/46/965866046.db2.gz SEBBABHFSZPCDT-NSHDSACASA-N 1 2 248.326 2.204 20 0 BEADLO Cc1nc(N(C)[C@H]2CC[C@H](O)CC2)c(C)c(C)[nH+]1 ZINC001165226736 965988847 /nfs/dbraw/zinc/98/88/47/965988847.db2.gz QSGMXHODMGZBEH-JOCQHMNTSA-N 1 2 249.358 2.142 20 0 BEADLO c1cc(C2CC2)[nH+]c(N2CC[C@@H]3COC[C@@H]3C2)c1 ZINC001165269142 966019835 /nfs/dbraw/zinc/01/98/35/966019835.db2.gz QMOOZFMOHUCRDF-OLZOCXBDSA-N 1 2 244.338 2.432 20 0 BEADLO CNc1ccc(Nc2cccnc2C(C)=O)c[nH+]1 ZINC001203453193 966055579 /nfs/dbraw/zinc/05/55/79/966055579.db2.gz YDHUHJOUCQZWQL-UHFFFAOYSA-N 1 2 242.282 2.465 20 0 BEADLO Cc1nc(N2C[C@@H]3C[C@@H]3[C@H](F)C2)c(C)c(C)[nH+]1 ZINC001165366732 966064854 /nfs/dbraw/zinc/06/48/54/966064854.db2.gz WDLRXGQLKDEFOL-SDDRHHMPSA-N 1 2 235.306 2.196 20 0 BEADLO C[C@@H]1COC[C@@H]1[NH2+]CC(F)(F)c1ccccc1 ZINC000699759952 966069620 /nfs/dbraw/zinc/06/96/20/966069620.db2.gz OHTGXLLKEXRBRW-PWSUYJOCSA-N 1 2 241.281 2.403 20 0 BEADLO COCC[N@H+](C)Cc1nccc(C)c1Cl ZINC001235573495 966084169 /nfs/dbraw/zinc/08/41/69/966084169.db2.gz CAVFJOUCNNJGPX-UHFFFAOYSA-N 1 2 228.723 2.122 20 0 BEADLO COCC[N@@H+](C)Cc1nccc(C)c1Cl ZINC001235573495 966084188 /nfs/dbraw/zinc/08/41/88/966084188.db2.gz CAVFJOUCNNJGPX-UHFFFAOYSA-N 1 2 228.723 2.122 20 0 BEADLO CNc1ccc(Nc2cccc(C(C)=O)n2)c[nH+]1 ZINC001203454452 966221969 /nfs/dbraw/zinc/22/19/69/966221969.db2.gz DTUXDXUHDDXSGM-UHFFFAOYSA-N 1 2 242.282 2.465 20 0 BEADLO COCC(C)(C)Nc1ccn2cc[nH+]c2c1 ZINC001166002214 966226163 /nfs/dbraw/zinc/22/61/63/966226163.db2.gz GDTVLFYGTHHLOJ-UHFFFAOYSA-N 1 2 219.288 2.171 20 0 BEADLO C[C@@H](CO)Cn1c[nH+]c(Cc2ccccc2)c1 ZINC000919150541 966292881 /nfs/dbraw/zinc/29/28/81/966292881.db2.gz LQXUBSWBAVRUOF-GFCCVEGCSA-N 1 2 230.311 2.102 20 0 BEADLO Nc1ccc(-c2ccc(-c3nnco3)cc2)c[nH+]1 ZINC001236313306 966360335 /nfs/dbraw/zinc/36/03/35/966360335.db2.gz MWTTYLDRVJSXTF-UHFFFAOYSA-N 1 2 238.250 2.381 20 0 BEADLO COc1cc(C)c[nH+]c1N1CCCCC12COC2 ZINC001166692496 966368171 /nfs/dbraw/zinc/36/81/71/966368171.db2.gz SUICNPLODWUYIO-UHFFFAOYSA-N 1 2 248.326 2.158 20 0 BEADLO O=c1cc(Nc2cccc3[nH+]ccn32)cc[nH]1 ZINC001212265237 966374972 /nfs/dbraw/zinc/37/49/72/966374972.db2.gz DCBRMXXIAAABJN-UHFFFAOYSA-N 1 2 226.239 2.179 20 0 BEADLO CCc1cn(Cc2ncc(C)s2)c[nH+]1 ZINC001166822017 966422477 /nfs/dbraw/zinc/42/24/77/966422477.db2.gz HOWWMWCQGAQAQV-UHFFFAOYSA-N 1 2 207.302 2.259 20 0 BEADLO Cc1cc(N2CC3(CCO3)C2)nc(C(C)(C)C)[nH+]1 ZINC001166942256 966464956 /nfs/dbraw/zinc/46/49/56/966464956.db2.gz FTVNTUQOVRBHCS-UHFFFAOYSA-N 1 2 247.342 2.062 20 0 BEADLO CC[C@@H](c1ccccc1)[N@H+](C)Cc1cnn[nH]1 ZINC001203206612 966556450 /nfs/dbraw/zinc/55/64/50/966556450.db2.gz CJXQYLCSGYEOFO-ZDUSSCGKSA-N 1 2 230.315 2.388 20 0 BEADLO CC[C@@H](c1ccccc1)[N@@H+](C)Cc1cnn[nH]1 ZINC001203206612 966556464 /nfs/dbraw/zinc/55/64/64/966556464.db2.gz CJXQYLCSGYEOFO-ZDUSSCGKSA-N 1 2 230.315 2.388 20 0 BEADLO CCc1cc(C[N@H+](C)Cc2cccnc2)on1 ZINC001203212021 966558213 /nfs/dbraw/zinc/55/82/13/966558213.db2.gz BTXYVWRPWKRNNC-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1cc(C[N@@H+](C)Cc2cccnc2)on1 ZINC001203212021 966558231 /nfs/dbraw/zinc/55/82/31/966558231.db2.gz BTXYVWRPWKRNNC-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO O=C1CCC[N@@H+](Cc2ccccc2F)CC1 ZINC001203347901 966610544 /nfs/dbraw/zinc/61/05/44/966610544.db2.gz IFNWHTBQASJAAG-UHFFFAOYSA-N 1 2 221.275 2.381 20 0 BEADLO O=C1CCC[N@H+](Cc2ccccc2F)CC1 ZINC001203347901 966610551 /nfs/dbraw/zinc/61/05/51/966610551.db2.gz IFNWHTBQASJAAG-UHFFFAOYSA-N 1 2 221.275 2.381 20 0 BEADLO COc1nn(C)cc1Nc1ccc(C)[nH+]c1C ZINC001203363742 966614731 /nfs/dbraw/zinc/61/47/31/966614731.db2.gz WSXJTXSACRBGIC-UHFFFAOYSA-N 1 2 232.287 2.184 20 0 BEADLO COc1cnc(Nc2ccc(C)[nH+]c2C)cn1 ZINC001203367197 966616819 /nfs/dbraw/zinc/61/68/19/966616819.db2.gz JIKKHECNWXNJPE-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO Cc1ccc(Nc2nc(Cl)cnc2N)c(C)[nH+]1 ZINC001203370853 966621755 /nfs/dbraw/zinc/62/17/55/966621755.db2.gz XKBYWJSKCXIVRG-UHFFFAOYSA-N 1 2 249.705 2.468 20 0 BEADLO Cc1ccc(Nc2ncccc2CO)c(C)[nH+]1 ZINC001203370700 966621819 /nfs/dbraw/zinc/62/18/19/966621819.db2.gz SNTWLACNMYHIPT-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO CNc1ccc(Nc2c[nH+]ccc2OC)cn1 ZINC001203448689 966647809 /nfs/dbraw/zinc/64/78/09/966647809.db2.gz FYOVMSJMXHDKKV-UHFFFAOYSA-N 1 2 230.271 2.271 20 0 BEADLO CNc1ccc(Nc2ncc(C)c(C)n2)c[nH+]1 ZINC001203447078 966650027 /nfs/dbraw/zinc/65/00/27/966650027.db2.gz JHGRPJURNHCHCL-UHFFFAOYSA-N 1 2 229.287 2.274 20 0 BEADLO CNc1ccc(N2CCc3c2cccc3N)c[nH+]1 ZINC001203462658 966662722 /nfs/dbraw/zinc/66/27/22/966662722.db2.gz XYRZDRUOTMOUIW-UHFFFAOYSA-N 1 2 240.310 2.400 20 0 BEADLO COc1ncc(Nc2cccc(C)[nH+]2)cc1N ZINC001203498034 966668155 /nfs/dbraw/zinc/66/81/55/966668155.db2.gz XRSHLHIIXLRZIR-UHFFFAOYSA-N 1 2 230.271 2.119 20 0 BEADLO c1nnc(C[N@@H+]2CC[C@H](C3CCCCC3)C2)[nH]1 ZINC001237601473 966670812 /nfs/dbraw/zinc/67/08/12/966670812.db2.gz IVYJCPPMIBCUEI-LBPRGKRZSA-N 1 2 234.347 2.207 20 0 BEADLO c1nnc(C[N@H+]2CC[C@H](C3CCCCC3)C2)[nH]1 ZINC001237601473 966670824 /nfs/dbraw/zinc/67/08/24/966670824.db2.gz IVYJCPPMIBCUEI-LBPRGKRZSA-N 1 2 234.347 2.207 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2cnns2)c1 ZINC001203655811 966720449 /nfs/dbraw/zinc/72/04/49/966720449.db2.gz BLLDEVORCBGLSA-UHFFFAOYSA-N 1 2 206.274 2.294 20 0 BEADLO Nc1cnn(-c2ccc([NH+]3CCCCC3)cc2)c1 ZINC001203712766 966744708 /nfs/dbraw/zinc/74/47/08/966744708.db2.gz OCELCBVUAJIDFH-UHFFFAOYSA-N 1 2 242.326 2.445 20 0 BEADLO C[C@@]1(O)CC[N@H+](Cc2cccc(F)c2)C[C@@H]1F ZINC001203784261 966778605 /nfs/dbraw/zinc/77/86/05/966778605.db2.gz QNJBWKPJLMUSJD-QWHCGFSZSA-N 1 2 241.281 2.121 20 0 BEADLO C[C@@]1(O)CC[N@@H+](Cc2cccc(F)c2)C[C@@H]1F ZINC001203784261 966778616 /nfs/dbraw/zinc/77/86/16/966778616.db2.gz QNJBWKPJLMUSJD-QWHCGFSZSA-N 1 2 241.281 2.121 20 0 BEADLO COc1ccc(C[NH+]2CC3(C2)CCCCO3)cc1 ZINC001203953182 966826754 /nfs/dbraw/zinc/82/67/54/966826754.db2.gz IKJUAOBTSKSRNL-UHFFFAOYSA-N 1 2 247.338 2.450 20 0 BEADLO CCCCOc1ccc(C[NH+]2CC(C)(O)C2)cc1 ZINC001203972809 966830619 /nfs/dbraw/zinc/83/06/19/966830619.db2.gz SCJKPCHEZDEGBU-UHFFFAOYSA-N 1 2 249.354 2.432 20 0 BEADLO CCn1ccnc1C[NH2+][C@H]1CCc2cccnc21 ZINC000385328522 966831341 /nfs/dbraw/zinc/83/13/41/966831341.db2.gz KCLIJGJRMLDWPK-LBPRGKRZSA-N 1 2 242.326 2.075 20 0 BEADLO c1c[nH]c(C[NH+]2CC3(C2)CCCCC3)n1 ZINC001203981007 966840024 /nfs/dbraw/zinc/84/00/24/966840024.db2.gz YWOQGLCKNZXNFT-UHFFFAOYSA-N 1 2 205.305 2.176 20 0 BEADLO c1c[nH]c(C[N@@H+]2CCc3ncsc3C2)c1 ZINC001204006934 966843993 /nfs/dbraw/zinc/84/39/93/966843993.db2.gz DXXVKXYWQGTVGN-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO c1c[nH]c(C[N@H+]2CCc3ncsc3C2)c1 ZINC001204006934 966843997 /nfs/dbraw/zinc/84/39/97/966843997.db2.gz DXXVKXYWQGTVGN-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO Cc1ccsc1C[NH+]1CC2(CCO2)C1 ZINC001204022610 966857650 /nfs/dbraw/zinc/85/76/50/966857650.db2.gz YTKOFAWFVYALST-UHFFFAOYSA-N 1 2 209.314 2.031 20 0 BEADLO CC[N@H+](Cc1ccsc1)[C@@H](C)C(=O)OC ZINC001204043985 966869783 /nfs/dbraw/zinc/86/97/83/966869783.db2.gz CJLXQNSIAQXWIF-VIFPVBQESA-N 1 2 227.329 2.132 20 0 BEADLO CC[N@@H+](Cc1ccsc1)[C@@H](C)C(=O)OC ZINC001204043985 966869789 /nfs/dbraw/zinc/86/97/89/966869789.db2.gz CJLXQNSIAQXWIF-VIFPVBQESA-N 1 2 227.329 2.132 20 0 BEADLO c1cc2c(o1)CC[N@@H+](Cc1cccnc1)C2 ZINC001204075828 966882921 /nfs/dbraw/zinc/88/29/21/966882921.db2.gz KQSVRVKDGAXFRL-UHFFFAOYSA-N 1 2 214.268 2.233 20 0 BEADLO c1cc2c(o1)CC[N@H+](Cc1cccnc1)C2 ZINC001204075828 966882925 /nfs/dbraw/zinc/88/29/25/966882925.db2.gz KQSVRVKDGAXFRL-UHFFFAOYSA-N 1 2 214.268 2.233 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2ccncc2)C[C@@H]1F ZINC001204080019 966885854 /nfs/dbraw/zinc/88/58/54/966885854.db2.gz DLLVUMOPDBULQT-NWDGAFQWSA-N 1 2 226.270 2.354 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2ccncc2)C[C@@H]1F ZINC001204080019 966885858 /nfs/dbraw/zinc/88/58/58/966885858.db2.gz DLLVUMOPDBULQT-NWDGAFQWSA-N 1 2 226.270 2.354 20 0 BEADLO Cc1nc2c(s1)C[N@H+](Cc1ccncc1)CC2 ZINC001204080361 966887273 /nfs/dbraw/zinc/88/72/73/966887273.db2.gz HYBGYNVKFMMZAT-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1nc2c(s1)C[N@@H+](Cc1ccncc1)CC2 ZINC001204080361 966887277 /nfs/dbraw/zinc/88/72/77/966887277.db2.gz HYBGYNVKFMMZAT-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO c1csc(N2CC[NH+](Cc3ccoc3)CC2)n1 ZINC001204240935 966934571 /nfs/dbraw/zinc/93/45/71/966934571.db2.gz MENPNGWFKLYGKY-UHFFFAOYSA-N 1 2 249.339 2.058 20 0 BEADLO CC(=O)[C@@H]1C[N@H+](Cc2ccc(C)c(C)c2)CCO1 ZINC001204357561 966981018 /nfs/dbraw/zinc/98/10/18/966981018.db2.gz WIOGHQLDYJSWCF-HNNXBMFYSA-N 1 2 247.338 2.093 20 0 BEADLO CC(=O)[C@@H]1C[N@@H+](Cc2ccc(C)c(C)c2)CCO1 ZINC001204357561 966981022 /nfs/dbraw/zinc/98/10/22/966981022.db2.gz WIOGHQLDYJSWCF-HNNXBMFYSA-N 1 2 247.338 2.093 20 0 BEADLO CCc1ccc(C[N@H+](C)C2(C)COC2)o1 ZINC001204393086 966983790 /nfs/dbraw/zinc/98/37/90/966983790.db2.gz OYTJXXRQCDGPKM-UHFFFAOYSA-N 1 2 209.289 2.063 20 0 BEADLO CCc1ccc(C[N@@H+](C)C2(C)COC2)o1 ZINC001204393086 966983792 /nfs/dbraw/zinc/98/37/92/966983792.db2.gz OYTJXXRQCDGPKM-UHFFFAOYSA-N 1 2 209.289 2.063 20 0 BEADLO Cn1c[nH+]cc1CN1CCCC[C@@H]1C(F)(F)F ZINC001204383229 966984831 /nfs/dbraw/zinc/98/48/31/966984831.db2.gz CAAUBAFLFHYVDF-SNVBAGLBSA-N 1 2 247.264 2.337 20 0 BEADLO CCCOC1C[NH+](Cc2ccc3c(c2)CCO3)C1 ZINC001204493832 967007707 /nfs/dbraw/zinc/00/77/07/967007707.db2.gz YXGVWBTVYUJYSZ-UHFFFAOYSA-N 1 2 247.338 2.232 20 0 BEADLO Cc1c(F)cccc1C[N@@H+](C)CCN(C)C ZINC001204507160 967009784 /nfs/dbraw/zinc/00/97/84/967009784.db2.gz UIUQRIHKVPBTLA-UHFFFAOYSA-N 1 2 224.323 2.128 20 0 BEADLO Cc1c(F)cccc1C[N@H+](C)CCN(C)C ZINC001204507160 967009792 /nfs/dbraw/zinc/00/97/92/967009792.db2.gz UIUQRIHKVPBTLA-UHFFFAOYSA-N 1 2 224.323 2.128 20 0 BEADLO COC1(C)C[NH+](Cc2cccc(F)c2C)C1 ZINC001204507258 967010724 /nfs/dbraw/zinc/01/07/24/967010724.db2.gz VKLYDCDVCXHHJG-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3ncncc3C2)oc1C ZINC001204534562 967036445 /nfs/dbraw/zinc/03/64/45/967036445.db2.gz IUKKCQDDHCSUOW-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1cc(C[N@H+]2CCc3ncncc3C2)oc1C ZINC001204534562 967036449 /nfs/dbraw/zinc/03/64/49/967036449.db2.gz IUKKCQDDHCSUOW-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO CCN1C[C@@H]2C[C@H]1C[N@@H+]2Cc1cc(C)c(C)o1 ZINC001204541334 967038905 /nfs/dbraw/zinc/03/89/05/967038905.db2.gz JLAZVJXASMAKKT-STQMWFEESA-N 1 2 234.343 2.175 20 0 BEADLO CCN1C[C@@H]2C[C@H]1C[N@H+]2Cc1cc(C)c(C)o1 ZINC001204541334 967038917 /nfs/dbraw/zinc/03/89/17/967038917.db2.gz JLAZVJXASMAKKT-STQMWFEESA-N 1 2 234.343 2.175 20 0 BEADLO Nc1[nH+]cccc1Nc1cc(O)c(F)c(F)c1 ZINC001212404075 967065211 /nfs/dbraw/zinc/06/52/11/967065211.db2.gz KSEMFVIYMGPMMJ-UHFFFAOYSA-N 1 2 237.209 2.391 20 0 BEADLO Cc1cccc(Nc2cnc3c(c2)NCCO3)[nH+]1 ZINC001249801665 967078540 /nfs/dbraw/zinc/07/85/40/967078540.db2.gz MATLOMNYCVFCII-UHFFFAOYSA-N 1 2 242.282 2.333 20 0 BEADLO Cc1[nH+]c[nH]c1CN(C)Cc1ccccc1F ZINC001204588593 967079590 /nfs/dbraw/zinc/07/95/90/967079590.db2.gz LRQLWAOSDQJLQF-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1nc2c(s1)CN(Cc1[nH]c[nH+]c1C)CC2 ZINC001204588687 967080668 /nfs/dbraw/zinc/08/06/68/967080668.db2.gz DBTJVXHEYAHPKY-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO COc1ccc(C[N@@H+]2C[C@@H](C)[C@@H](F)C2)nc1C ZINC001249892149 967132018 /nfs/dbraw/zinc/13/20/18/967132018.db2.gz LXVGSHNIIUHDON-SKDRFNHKSA-N 1 2 238.306 2.188 20 0 BEADLO COc1ccc(C[N@H+]2C[C@@H](C)[C@@H](F)C2)nc1C ZINC001249892149 967132024 /nfs/dbraw/zinc/13/20/24/967132024.db2.gz LXVGSHNIIUHDON-SKDRFNHKSA-N 1 2 238.306 2.188 20 0 BEADLO COc1ccc(C[N@@H+]2C[C@H](F)C[C@H]2C)nc1C ZINC001249892199 967133954 /nfs/dbraw/zinc/13/39/54/967133954.db2.gz NJPYBXKLOWIQSV-MWLCHTKSSA-N 1 2 238.306 2.331 20 0 BEADLO COc1ccc(C[N@H+]2C[C@H](F)C[C@H]2C)nc1C ZINC001249892199 967133961 /nfs/dbraw/zinc/13/39/61/967133961.db2.gz NJPYBXKLOWIQSV-MWLCHTKSSA-N 1 2 238.306 2.331 20 0 BEADLO c1cn2ccc(Nc3ccccn3)cc2[nH+]1 ZINC001204943958 967243635 /nfs/dbraw/zinc/24/36/35/967243635.db2.gz PWJUQZQMSCBGFE-UHFFFAOYSA-N 1 2 210.240 2.473 20 0 BEADLO Cc1cnc(C)c(Nc2ccn3cc[nH+]c3c2)n1 ZINC001204950979 967248612 /nfs/dbraw/zinc/24/86/12/967248612.db2.gz KRIHRAUIYPNEIH-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO CCOc1cc(C[N@@H+]2C[C@@H](C)[C@@H](F)C2)ccn1 ZINC001249998165 967249333 /nfs/dbraw/zinc/24/93/33/967249333.db2.gz NFKMLZKLQCXMTL-PWSUYJOCSA-N 1 2 238.306 2.270 20 0 BEADLO CCOc1cc(C[N@H+]2C[C@@H](C)[C@@H](F)C2)ccn1 ZINC001249998165 967249344 /nfs/dbraw/zinc/24/93/44/967249344.db2.gz NFKMLZKLQCXMTL-PWSUYJOCSA-N 1 2 238.306 2.270 20 0 BEADLO c1coc(Nc2ccn3cc[nH+]c3c2)n1 ZINC001204951443 967249739 /nfs/dbraw/zinc/24/97/39/967249739.db2.gz RXOJIIIADBEJMP-UHFFFAOYSA-N 1 2 200.201 2.066 20 0 BEADLO Cc1nccnc1Nc1ccn2cc[nH+]c2c1 ZINC001204950622 967253236 /nfs/dbraw/zinc/25/32/36/967253236.db2.gz BHKRJGGJGQHISR-UHFFFAOYSA-N 1 2 225.255 2.176 20 0 BEADLO Cc1ccc(Nc2ccc3nncn3c2)c(C)[nH+]1 ZINC001249999388 967253972 /nfs/dbraw/zinc/25/39/72/967253972.db2.gz IQUMDLKLDJANHV-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cc1c[nH+]c(Nc2ccc3nncn3c2)c(C)c1 ZINC001250001270 967258173 /nfs/dbraw/zinc/25/81/73/967258173.db2.gz ZFIBNPFEHUOBTL-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Nc1cn(-c2ccn3cc[nH+]c3c2)c2ncccc12 ZINC001204959385 967259353 /nfs/dbraw/zinc/25/93/53/967259353.db2.gz LVQZEYMHKYRCGE-UHFFFAOYSA-N 1 2 249.277 2.255 20 0 BEADLO Cc1cnc(Nc2ccn3cc[nH+]c3c2)c(N)c1 ZINC001204959637 967262747 /nfs/dbraw/zinc/26/27/47/967262747.db2.gz RQGVXDFONFKBIE-UHFFFAOYSA-N 1 2 239.282 2.364 20 0 BEADLO Cc1c[nH]c(=O)cc1Nc1ccn2cc[nH+]c2c1 ZINC001204966192 967265487 /nfs/dbraw/zinc/26/54/87/967265487.db2.gz QMEGDHGIZRQOKA-UHFFFAOYSA-N 1 2 240.266 2.487 20 0 BEADLO Cc1c(C)c(-c2ccc(N)[nH+]c2)ccc1CO ZINC001204970065 967265864 /nfs/dbraw/zinc/26/58/64/967265864.db2.gz UQKVTRLKTOOLAR-UHFFFAOYSA-N 1 2 228.295 2.440 20 0 BEADLO Cc1cc(Nc2ccn3cc[nH+]c3c2)cc(=O)o1 ZINC001204965429 967268197 /nfs/dbraw/zinc/26/81/97/967268197.db2.gz BDPSZBROEBVFAI-UHFFFAOYSA-N 1 2 241.250 2.340 20 0 BEADLO CCn1cnc(Nc2ccn3cc[nH+]c3c2)c1 ZINC001204971003 967270087 /nfs/dbraw/zinc/27/00/87/967270087.db2.gz GHERDIVFGZKJJM-UHFFFAOYSA-N 1 2 227.271 2.294 20 0 BEADLO Nc1cc(C(F)(F)F)c(C[C@@H]2CCCO2)c[nH+]1 ZINC001250103757 967378445 /nfs/dbraw/zinc/37/84/45/967378445.db2.gz OUJYWMPXRWAXFA-QMMMGPOBSA-N 1 2 246.232 2.404 20 0 BEADLO Cc1[nH+]cc(Cc2ccc3c(c2)OCO3)cc1N ZINC001250155769 967445198 /nfs/dbraw/zinc/44/51/98/967445198.db2.gz XOIHNQLBNXVDOA-UHFFFAOYSA-N 1 2 242.278 2.292 20 0 BEADLO CCOc1cc(C)ccc1C[N@H+](C)C1COC1 ZINC001250182521 967480503 /nfs/dbraw/zinc/48/05/03/967480503.db2.gz YAEBBDHSXDDWQB-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO CCOc1cc(C)ccc1C[N@@H+](C)C1COC1 ZINC001250182521 967480521 /nfs/dbraw/zinc/48/05/21/967480521.db2.gz YAEBBDHSXDDWQB-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO Cc1c[nH+]c(C)c(C[C@H]2COC(C)(C)O2)c1 ZINC001250186237 967494189 /nfs/dbraw/zinc/49/41/89/967494189.db2.gz PKJBEIHZJRJEMB-LBPRGKRZSA-N 1 2 221.300 2.392 20 0 BEADLO CNc1cc(CC(=O)Oc2ccccc2)cc[nH+]1 ZINC001250259905 967571696 /nfs/dbraw/zinc/57/16/96/967571696.db2.gz CDADPERFKGMPHG-UHFFFAOYSA-N 1 2 242.278 2.271 20 0 BEADLO Cc1ccc(F)c(CC[NH+]2CCOCC2)c1 ZINC001250275150 967598209 /nfs/dbraw/zinc/59/82/09/967598209.db2.gz YQAQGALFBZWNAT-UHFFFAOYSA-N 1 2 223.291 2.009 20 0 BEADLO Clc1cccc2c1C[C@@H]([NH+]1CCOCC1)C2 ZINC001168718776 967623959 /nfs/dbraw/zinc/62/39/59/967623959.db2.gz RVLRCPVRKNZVLX-NSHDSACASA-N 1 2 237.730 2.139 20 0 BEADLO c1cn(CCC2=CCC3(CC2)OCCO3)c[nH+]1 ZINC001250315591 967677097 /nfs/dbraw/zinc/67/70/97/967677097.db2.gz QLASSFGGSSUBKF-UHFFFAOYSA-N 1 2 234.299 2.127 20 0 BEADLO c1cn(CCc2ccc3nccnc3c2)c[nH+]1 ZINC001250316112 967680365 /nfs/dbraw/zinc/68/03/65/967680365.db2.gz BBSVHBXMBOPVDB-UHFFFAOYSA-N 1 2 224.267 2.069 20 0 BEADLO COc1c(F)ccc(F)c1CCn1cc[nH+]c1 ZINC001250315797 967682082 /nfs/dbraw/zinc/68/20/82/967682082.db2.gz RGLODHXHZIEVTG-UHFFFAOYSA-N 1 2 238.237 2.413 20 0 BEADLO CCCn1nc(C)cc1CCn1cc[nH+]c1 ZINC001250316781 967690391 /nfs/dbraw/zinc/69/03/91/967690391.db2.gz XNXHMIQQNQGHLN-UHFFFAOYSA-N 1 2 218.304 2.041 20 0 BEADLO Cc1cc(C)c(N)c(CCn2cc[nH+]c2)c1 ZINC001250319464 967692895 /nfs/dbraw/zinc/69/28/95/967692895.db2.gz DULGYENWRCQMBP-UHFFFAOYSA-N 1 2 215.300 2.325 20 0 BEADLO Nc1c(Cl)cccc1CCn1cc[nH+]c1 ZINC001250320549 967697100 /nfs/dbraw/zinc/69/71/00/967697100.db2.gz OQHKDHXFCFKCQC-UHFFFAOYSA-N 1 2 221.691 2.361 20 0 BEADLO Oc1cc(CCn2cc[nH+]c2)c(F)c(F)c1F ZINC001250321107 967700607 /nfs/dbraw/zinc/70/06/07/967700607.db2.gz WTXRAJGUDLXXOI-UHFFFAOYSA-N 1 2 242.200 2.249 20 0 BEADLO CCOc1nccc(C[NH+]2CCC2)c1Cl ZINC001250360959 967764520 /nfs/dbraw/zinc/76/45/20/967764520.db2.gz IXGQZRYOQULZND-UHFFFAOYSA-N 1 2 226.707 2.339 20 0 BEADLO c1nocc1C[N@@H+]1CCOC2(CCCCC2)C1 ZINC001205724148 967802162 /nfs/dbraw/zinc/80/21/62/967802162.db2.gz GULCKKFDFISUGA-UHFFFAOYSA-N 1 2 236.315 2.210 20 0 BEADLO c1nocc1C[N@H+]1CCOC2(CCCCC2)C1 ZINC001205724148 967802163 /nfs/dbraw/zinc/80/21/63/967802163.db2.gz GULCKKFDFISUGA-UHFFFAOYSA-N 1 2 236.315 2.210 20 0 BEADLO CC(C)(C)c1[nH]c2cc3c(cc2[nH+]1)OCC(=O)N3 ZINC001250416482 967822237 /nfs/dbraw/zinc/82/22/37/967822237.db2.gz UMCRYKWXOLATIN-UHFFFAOYSA-N 1 2 245.282 2.191 20 0 BEADLO Cc1[nH]c2cc(-n3cccn3)c(F)cc2[nH+]1 ZINC001250424625 967838673 /nfs/dbraw/zinc/83/86/73/967838673.db2.gz MODAEYJMFNTULV-UHFFFAOYSA-N 1 2 216.219 2.196 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2ccc([S-])cc2)C[C@@H]1[NH3+] ZINC001205880494 967870073 /nfs/dbraw/zinc/87/00/73/967870073.db2.gz JUROGBJGQKAEFM-MFKMUULPSA-N 1 2 236.384 2.144 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2ccc([S-])cc2)C[C@@H]1[NH3+] ZINC001205880494 967870074 /nfs/dbraw/zinc/87/00/74/967870074.db2.gz JUROGBJGQKAEFM-MFKMUULPSA-N 1 2 236.384 2.144 20 0 BEADLO Cc1cc(C[N@H+](Cc2ccco2)C2CC2)n(C)n1 ZINC001205928113 967889585 /nfs/dbraw/zinc/88/95/85/967889585.db2.gz NEDHEWLFZUIOKA-UHFFFAOYSA-N 1 2 245.326 2.486 20 0 BEADLO Cc1cc(C[N@@H+](Cc2ccco2)C2CC2)n(C)n1 ZINC001205928113 967889587 /nfs/dbraw/zinc/88/95/87/967889587.db2.gz NEDHEWLFZUIOKA-UHFFFAOYSA-N 1 2 245.326 2.486 20 0 BEADLO Nc1[nH+]cccc1-c1ccc(O)cc1F ZINC001206051624 968016998 /nfs/dbraw/zinc/01/69/98/968016998.db2.gz MSGSLJQVYMDCAK-UHFFFAOYSA-N 1 2 204.204 2.176 20 0 BEADLO Cc1cc(C)c(Nc2ccn(C)c(=O)c2)c[nH+]1 ZINC001206076458 968043021 /nfs/dbraw/zinc/04/30/21/968043021.db2.gz BIAUUIIUMVHHTR-UHFFFAOYSA-N 1 2 229.283 2.141 20 0 BEADLO Cc1nc(C)c(C[N@@H+](C)Cc2ccncn2)s1 ZINC001206192202 968118251 /nfs/dbraw/zinc/11/82/51/968118251.db2.gz MHWCECXKBZVTOK-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO Cc1nc(C)c(C[N@H+](C)Cc2ccncn2)s1 ZINC001206192202 968118263 /nfs/dbraw/zinc/11/82/63/968118263.db2.gz MHWCECXKBZVTOK-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO COCCc1[nH]c2cc(Cl)c(OC)cc2[nH+]1 ZINC001250596278 968130321 /nfs/dbraw/zinc/13/03/21/968130321.db2.gz TUJOWRYOQZWPMK-UHFFFAOYSA-N 1 2 240.690 2.414 20 0 BEADLO CN(c1ccccc1N)c1[nH+]cccc1N ZINC001206309148 968213748 /nfs/dbraw/zinc/21/37/48/968213748.db2.gz RLOVAZGRILGNQE-UHFFFAOYSA-N 1 2 214.272 2.014 20 0 BEADLO Cc1nc(N2[C@@H](C)CC[C@H]2CO)cc(C(C)C)[nH+]1 ZINC001164304711 968216646 /nfs/dbraw/zinc/21/66/46/968216646.db2.gz NDRZEXLHVMZKHB-JQWIXIFHSA-N 1 2 249.358 2.258 20 0 BEADLO CC[N@H+](CCC(F)(F)F)Cc1cc(C)n[nH]1 ZINC001320494246 1169917300 /nfs/dbraw/zinc/91/73/00/1169917300.db2.gz OFNYBAMVINEMNL-UHFFFAOYSA-N 1 2 235.253 2.492 20 0 BEADLO CC[N@@H+](CCC(F)(F)F)Cc1cc(C)n[nH]1 ZINC001320494246 1169917305 /nfs/dbraw/zinc/91/73/05/1169917305.db2.gz OFNYBAMVINEMNL-UHFFFAOYSA-N 1 2 235.253 2.492 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cnn(Cc2cccnc2)c1 ZINC001206422769 968295248 /nfs/dbraw/zinc/29/52/48/968295248.db2.gz GJXLBSQFEWSPPZ-ODTJTBHOSA-N 1 2 240.310 2.202 20 0 BEADLO C[C@@H](CCO)Nc1cccc(-c2c[nH+]cn2C)c1 ZINC001165938660 968303838 /nfs/dbraw/zinc/30/38/38/968303838.db2.gz PIWYLGMDPYLFRR-NSHDSACASA-N 1 2 245.326 2.270 20 0 BEADLO COc1cnccc1C[N@@H+]1CCCC[C@H](F)C1 ZINC001206438384 968307052 /nfs/dbraw/zinc/30/70/52/968307052.db2.gz RHNFPYSSEXSWOT-LBPRGKRZSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cnccc1C[N@H+]1CCCC[C@H](F)C1 ZINC001206438384 968307062 /nfs/dbraw/zinc/30/70/62/968307062.db2.gz RHNFPYSSEXSWOT-LBPRGKRZSA-N 1 2 238.306 2.414 20 0 BEADLO CCCCOc1cc(NC[C@H](O)CC)cc[nH+]1 ZINC001251759181 968315158 /nfs/dbraw/zinc/31/51/58/968315158.db2.gz HMZROXUBWRNGQF-GFCCVEGCSA-N 1 2 238.331 2.443 20 0 BEADLO COc1ncccc1C[N@@H+]1C[C@@H](F)C[C@H]1C ZINC001206554164 968379466 /nfs/dbraw/zinc/37/94/66/968379466.db2.gz UKMDGBDWIXHORD-KOLCDFICSA-N 1 2 224.279 2.023 20 0 BEADLO COc1ncccc1C[N@H+]1C[C@@H](F)C[C@H]1C ZINC001206554164 968379471 /nfs/dbraw/zinc/37/94/71/968379471.db2.gz UKMDGBDWIXHORD-KOLCDFICSA-N 1 2 224.279 2.023 20 0 BEADLO CCSc1cc[nH+]c(N2CC3(CCO3)C2)c1 ZINC001166942643 968401528 /nfs/dbraw/zinc/40/15/28/968401528.db2.gz JFCYEOXWIADDBA-UHFFFAOYSA-N 1 2 236.340 2.173 20 0 BEADLO COc1cccnc1C[N@H+](C)C1CC(F)(F)C1 ZINC001206611379 968406416 /nfs/dbraw/zinc/40/64/16/968406416.db2.gz UVMWRROMPSYACT-UHFFFAOYSA-N 1 2 242.269 2.320 20 0 BEADLO COc1cccnc1C[N@@H+](C)C1CC(F)(F)C1 ZINC001206611379 968406420 /nfs/dbraw/zinc/40/64/20/968406420.db2.gz UVMWRROMPSYACT-UHFFFAOYSA-N 1 2 242.269 2.320 20 0 BEADLO Cc1ccnc(C[N@H+](C)Cc2ccno2)c1 ZINC001206853756 968498253 /nfs/dbraw/zinc/49/82/53/968498253.db2.gz CWLDGOBNXXPDQT-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ccnc(C[N@@H+](C)Cc2ccno2)c1 ZINC001206853756 968498257 /nfs/dbraw/zinc/49/82/57/968498257.db2.gz CWLDGOBNXXPDQT-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO CCCC[C@@H](O)CNc1c[nH+]ccc1OCC ZINC001252080313 968498584 /nfs/dbraw/zinc/49/85/84/968498584.db2.gz VVBQESWOHHLETC-LLVKDONJSA-N 1 2 238.331 2.443 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCC(=O)C(C)(C)C2)c1 ZINC001206852617 968499167 /nfs/dbraw/zinc/49/91/67/968499167.db2.gz CLYBTVRSKZIRPE-UHFFFAOYSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1ccnc(C[N@H+]2CCC(=O)C(C)(C)C2)c1 ZINC001206852617 968499173 /nfs/dbraw/zinc/49/91/73/968499173.db2.gz CLYBTVRSKZIRPE-UHFFFAOYSA-N 1 2 232.327 2.191 20 0 BEADLO Fc1cncc(F)c1C[N@H+]1C[C@@H]2C[C@H]1C[C@@H]2F ZINC001206862304 968502579 /nfs/dbraw/zinc/50/25/79/968502579.db2.gz LCZVTBUQYJCNKX-NRPADANISA-N 1 2 242.244 2.292 20 0 BEADLO Fc1cncc(F)c1C[N@@H+]1C[C@@H]2C[C@H]1C[C@@H]2F ZINC001206862304 968502584 /nfs/dbraw/zinc/50/25/84/968502584.db2.gz LCZVTBUQYJCNKX-NRPADANISA-N 1 2 242.244 2.292 20 0 BEADLO CC1(C)C[N@H+](Cc2ncccn2)CCC1(F)F ZINC001207010554 968546239 /nfs/dbraw/zinc/54/62/39/968546239.db2.gz UXHVZEWPGWUWCH-UHFFFAOYSA-N 1 2 241.285 2.344 20 0 BEADLO CC1(C)C[N@@H+](Cc2ncccn2)CCC1(F)F ZINC001207010554 968546248 /nfs/dbraw/zinc/54/62/48/968546248.db2.gz UXHVZEWPGWUWCH-UHFFFAOYSA-N 1 2 241.285 2.344 20 0 BEADLO Fc1cncc(C[NH+]2CC3(CCC3)C2)c1 ZINC001207018512 968555967 /nfs/dbraw/zinc/55/59/67/968555967.db2.gz NBOOBDOLVAISCV-UHFFFAOYSA-N 1 2 206.264 2.207 20 0 BEADLO Fc1cccnc1C[NH+]1CC(c2cccnc2)C1 ZINC001207033668 968564428 /nfs/dbraw/zinc/56/44/28/968564428.db2.gz CZFQAPVCOCSNBJ-UHFFFAOYSA-N 1 2 243.285 2.215 20 0 BEADLO Cc1ncc(C[N@@H+]2CCC(=O)[C@@H](C)CC2)s1 ZINC001207058179 968588035 /nfs/dbraw/zinc/58/80/35/968588035.db2.gz CKHIDPGSUAQKBC-VIFPVBQESA-N 1 2 238.356 2.253 20 0 BEADLO Cc1ncc(C[N@H+]2CCC(=O)[C@@H](C)CC2)s1 ZINC001207058179 968588042 /nfs/dbraw/zinc/58/80/42/968588042.db2.gz CKHIDPGSUAQKBC-VIFPVBQESA-N 1 2 238.356 2.253 20 0 BEADLO Cc1ncc(C[N@@H+]2CCCC(=O)[C@@H](C)C2)s1 ZINC001207059168 968589075 /nfs/dbraw/zinc/58/90/75/968589075.db2.gz UVLOGLPZXDSWKC-VIFPVBQESA-N 1 2 238.356 2.253 20 0 BEADLO Cc1ncc(C[N@H+]2CCCC(=O)[C@@H](C)C2)s1 ZINC001207059168 968589077 /nfs/dbraw/zinc/58/90/77/968589077.db2.gz UVLOGLPZXDSWKC-VIFPVBQESA-N 1 2 238.356 2.253 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@H]2CC[C@H](C)CC2)[nH+]c1C ZINC000825011869 968631398 /nfs/dbraw/zinc/63/13/98/968631398.db2.gz JMBGCJHDWZYZRC-OTCDBFHCSA-N 1 2 249.358 2.469 20 0 BEADLO CC(C)(O)CNc1ccc2ccc[nH+]c2c1 ZINC001252358856 968637230 /nfs/dbraw/zinc/63/72/30/968637230.db2.gz FOHRMAVDZADVDD-UHFFFAOYSA-N 1 2 216.284 2.418 20 0 BEADLO O=c1cc(C[N@H+]2CCCCC(F)(F)C2)cc[nH]1 ZINC001207116322 968638631 /nfs/dbraw/zinc/63/86/31/968638631.db2.gz OSPCLCXPHAIURC-UHFFFAOYSA-N 1 2 242.269 2.408 20 0 BEADLO O=c1cc(C[N@@H+]2CCCCC(F)(F)C2)cc[nH]1 ZINC001207116322 968638635 /nfs/dbraw/zinc/63/86/35/968638635.db2.gz OSPCLCXPHAIURC-UHFFFAOYSA-N 1 2 242.269 2.408 20 0 BEADLO Cc1cc2c(cn1)C[N@H+](Cc1cc[nH]c(=O)c1)C2 ZINC001207123378 968642359 /nfs/dbraw/zinc/64/23/59/968642359.db2.gz KPKNAJCXLYXMNZ-UHFFFAOYSA-N 1 2 241.294 2.006 20 0 BEADLO Cc1cc2c(cn1)C[N@@H+](Cc1cc[nH]c(=O)c1)C2 ZINC001207123378 968642364 /nfs/dbraw/zinc/64/23/64/968642364.db2.gz KPKNAJCXLYXMNZ-UHFFFAOYSA-N 1 2 241.294 2.006 20 0 BEADLO Cc1ncccc1C[N@@H+]1CCC(=O)C(C)(C)C1 ZINC001207155453 968667662 /nfs/dbraw/zinc/66/76/62/968667662.db2.gz UMMOEDRFORNBBL-UHFFFAOYSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1ncccc1C[N@H+]1CCC(=O)C(C)(C)C1 ZINC001207155453 968667668 /nfs/dbraw/zinc/66/76/68/968667668.db2.gz UMMOEDRFORNBBL-UHFFFAOYSA-N 1 2 232.327 2.191 20 0 BEADLO CCCCNc1cc(OC)c(C(=O)OC)c[nH+]1 ZINC001154827363 968681457 /nfs/dbraw/zinc/68/14/57/968681457.db2.gz GSNVLDDSOPOVHK-UHFFFAOYSA-N 1 2 238.287 2.089 20 0 BEADLO CCCCNc1ccc(CC(=O)OCC)c[nH+]1 ZINC001154827673 968683261 /nfs/dbraw/zinc/68/32/61/968683261.db2.gz GLSAYIGNMCTCHQ-UHFFFAOYSA-N 1 2 236.315 2.399 20 0 BEADLO Cc1cncc(-c2ccn3cc(N)[nH+]c3c2)c1 ZINC001240805561 968699121 /nfs/dbraw/zinc/69/91/21/968699121.db2.gz MRRVNWLSGJFKKB-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO C=Cc1[nH+]cc(C(=O)OC)c2c1ccn2C ZINC001240827409 968701583 /nfs/dbraw/zinc/70/15/83/968701583.db2.gz IBVSKZWRYIBLEY-UHFFFAOYSA-N 1 2 216.240 2.003 20 0 BEADLO C1=C[C@@H]2C[C@H]1C[C@@H]2CN1CC[NH+](CC2CC2)CC1 ZINC001207627172 968841777 /nfs/dbraw/zinc/84/17/77/968841777.db2.gz TUJXTIZBDIUIRD-ARFHVFGLSA-N 1 2 246.398 2.226 20 0 BEADLO C[C@@](O)(C[N@@H+]1CCC=C(Cl)C1)C(F)(F)F ZINC000404408850 968887431 /nfs/dbraw/zinc/88/74/31/968887431.db2.gz YQYPFFCHTCPCNF-MRVPVSSYSA-N 1 2 243.656 2.128 20 0 BEADLO C[C@@](O)(C[N@H+]1CCC=C(Cl)C1)C(F)(F)F ZINC000404408850 968887438 /nfs/dbraw/zinc/88/74/38/968887438.db2.gz YQYPFFCHTCPCNF-MRVPVSSYSA-N 1 2 243.656 2.128 20 0 BEADLO CC(C)(C)C(=[NH2+])Nc1ncnc2cnccc21 ZINC001155175978 968916669 /nfs/dbraw/zinc/91/66/69/968916669.db2.gz MTYFZBSWHKJKJI-UHFFFAOYSA-N 1 2 229.287 2.460 20 0 BEADLO COc1ncc(-c2cc[nH+]c(N)c2)c2cc[nH]c21 ZINC001241161974 968942781 /nfs/dbraw/zinc/94/27/81/968942781.db2.gz DAPHWKBTEUUQJH-UHFFFAOYSA-N 1 2 240.266 2.216 20 0 BEADLO CC/C=C\CCC[N@@H+]1CC(F)(F)C[C@H]1CO ZINC001208128347 969027153 /nfs/dbraw/zinc/02/71/53/969027153.db2.gz COVROZNSBHLLAD-BYCRGOAPSA-N 1 2 233.302 2.435 20 0 BEADLO CC/C=C\CCC[N@H+]1CC(F)(F)C[C@H]1CO ZINC001208128347 969027164 /nfs/dbraw/zinc/02/71/64/969027164.db2.gz COVROZNSBHLLAD-BYCRGOAPSA-N 1 2 233.302 2.435 20 0 BEADLO Cc1cc(-c2ccc(CO)cc2)c[nH+]c1N ZINC001241559326 969044228 /nfs/dbraw/zinc/04/42/28/969044228.db2.gz MLFRLSRENMMPTP-UHFFFAOYSA-N 1 2 214.268 2.132 20 0 BEADLO c1[nH]cc(CCc2nnc(-c3ccccc3)o2)[nH+]1 ZINC001253065620 969073371 /nfs/dbraw/zinc/07/33/71/969073371.db2.gz BAUVWCSLAZTPIH-UHFFFAOYSA-N 1 2 240.266 2.245 20 0 BEADLO Cc1cccc(NC(=O)[C@@H](C)n2cc[nH+]c2)c1O ZINC001323530552 1169933797 /nfs/dbraw/zinc/93/37/97/1169933797.db2.gz UFZQEMGHSAAHFR-SNVBAGLBSA-N 1 2 245.282 2.097 20 0 BEADLO c1nn(C2CC2)cc1-c1c[nH+]c2c(c1)CCCN2 ZINC001241911369 969142635 /nfs/dbraw/zinc/14/26/35/969142635.db2.gz HRKPPQKMPXUAMF-UHFFFAOYSA-N 1 2 240.310 2.281 20 0 BEADLO CC(=O)Nc1ccc(-c2[nH]cc[nH+]2)c(C)c1 ZINC001242018110 969169979 /nfs/dbraw/zinc/16/99/79/969169979.db2.gz DHASILXNWHWMSP-UHFFFAOYSA-N 1 2 215.256 2.344 20 0 BEADLO Cc1nnc(-c2ccccc2-n2cc[nH+]c2)o1 ZINC001253463577 969185611 /nfs/dbraw/zinc/18/56/11/969185611.db2.gz WNJDJGLMJFLVJI-UHFFFAOYSA-N 1 2 226.239 2.231 20 0 BEADLO CCc1ncnc(-c2c[nH+]c(N)cc2C)c1F ZINC001242070878 969196835 /nfs/dbraw/zinc/19/68/35/969196835.db2.gz NXIZTPCLUSNJJE-UHFFFAOYSA-N 1 2 232.262 2.131 20 0 BEADLO C[C@@H](c1nnc(Cc2ccccc2)o1)[NH+](C)C ZINC001253525617 969201824 /nfs/dbraw/zinc/20/18/24/969201824.db2.gz VFNLACOXKOZOIT-JTQLQIEISA-N 1 2 231.299 2.283 20 0 BEADLO CC/C=C\CC[N@@H+]1CCC[C@H](F)C(=O)C1 ZINC001208726169 969211837 /nfs/dbraw/zinc/21/18/37/969211837.db2.gz XQHJZXPAWCXFRX-BYCRGOAPSA-N 1 2 213.296 2.346 20 0 BEADLO CC/C=C\CC[N@H+]1CCC[C@H](F)C(=O)C1 ZINC001208726169 969211844 /nfs/dbraw/zinc/21/18/44/969211844.db2.gz XQHJZXPAWCXFRX-BYCRGOAPSA-N 1 2 213.296 2.346 20 0 BEADLO CC/C=C\CC[N@@H+]1Cc2cncnc2C1 ZINC001208725985 969214971 /nfs/dbraw/zinc/21/49/71/969214971.db2.gz WRDCXBIQGSHXRX-ARJAWSKDSA-N 1 2 203.289 2.149 20 0 BEADLO CC/C=C\CC[N@H+]1Cc2cncnc2C1 ZINC001208725985 969214979 /nfs/dbraw/zinc/21/49/79/969214979.db2.gz WRDCXBIQGSHXRX-ARJAWSKDSA-N 1 2 203.289 2.149 20 0 BEADLO CC/C=C\CC[NH+]1CC2(C1)CC(F)(F)CO2 ZINC001208730500 969217204 /nfs/dbraw/zinc/21/72/04/969217204.db2.gz XMJCZCGBBQPOHJ-ARJAWSKDSA-N 1 2 231.286 2.453 20 0 BEADLO c1cnc2c(c1)C[N@@H+](C[C@@H]1CCC=CO1)C2 ZINC001208873553 969261966 /nfs/dbraw/zinc/26/19/66/969261966.db2.gz GWEKAQWPCHEWJR-LBPRGKRZSA-N 1 2 216.284 2.090 20 0 BEADLO c1cnc2c(c1)C[N@H+](C[C@@H]1CCC=CO1)C2 ZINC001208873553 969261974 /nfs/dbraw/zinc/26/19/74/969261974.db2.gz GWEKAQWPCHEWJR-LBPRGKRZSA-N 1 2 216.284 2.090 20 0 BEADLO COCCC[N@@H+]1CCC[C@@H](F)C(F)(F)C1 ZINC001209048732 969334619 /nfs/dbraw/zinc/33/46/19/969334619.db2.gz PRYUPOCVKFLSGL-SECBINFHSA-N 1 2 225.254 2.092 20 0 BEADLO COCCC[N@H+]1CCC[C@@H](F)C(F)(F)C1 ZINC001209048732 969334623 /nfs/dbraw/zinc/33/46/23/969334623.db2.gz PRYUPOCVKFLSGL-SECBINFHSA-N 1 2 225.254 2.092 20 0 BEADLO CC(C)[C@H](O)CNc1ccc2[nH+]cn(C)c2c1 ZINC001253771101 969392687 /nfs/dbraw/zinc/39/26/87/969392687.db2.gz FUMLTQWNLNAZBL-CYBMUJFWSA-N 1 2 233.315 2.002 20 0 BEADLO CCCc1nnc([C@@H]2CC3CC[NH+]2CC3)o1 ZINC001253929997 969423141 /nfs/dbraw/zinc/42/31/41/969423141.db2.gz RGXDWVWBTWLPBI-JTQLQIEISA-N 1 2 221.304 2.179 20 0 BEADLO c1cn2c(cccc2-c2nnc(C3CC3)o2)[nH+]1 ZINC001254059689 969465122 /nfs/dbraw/zinc/46/51/22/969465122.db2.gz NZJMUMQIYHIJEN-UHFFFAOYSA-N 1 2 226.239 2.262 20 0 BEADLO CC[NH+]1CCC([NH2+]C2(c3ccncc3)CC2)CC1 ZINC001169224182 969492016 /nfs/dbraw/zinc/49/20/16/969492016.db2.gz BQDHXMZBHMQIRW-UHFFFAOYSA-N 1 2 245.370 2.145 20 0 BEADLO O[C@@H]1CCC[C@H](Nc2cc3cc[nH]c3c[nH+]2)C1 ZINC001169244952 969528948 /nfs/dbraw/zinc/52/89/48/969528948.db2.gz MATIMZYCBOBFRI-WDEREUQCSA-N 1 2 231.299 2.278 20 0 BEADLO FC(F)[C@H]1CCC[N@H+](Cc2ccon2)C1 ZINC001209564802 969534807 /nfs/dbraw/zinc/53/48/07/969534807.db2.gz FDBDOANVTFARNN-QMMMGPOBSA-N 1 2 216.231 2.152 20 0 BEADLO FC(F)[C@H]1CCC[N@@H+](Cc2ccon2)C1 ZINC001209564802 969534812 /nfs/dbraw/zinc/53/48/12/969534812.db2.gz FDBDOANVTFARNN-QMMMGPOBSA-N 1 2 216.231 2.152 20 0 BEADLO Cc1ccnc(CCNc2cc[nH+]cc2F)c1 ZINC001169318183 969565362 /nfs/dbraw/zinc/56/53/62/969565362.db2.gz MWFFLCULKAHFSC-UHFFFAOYSA-N 1 2 231.274 2.001 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1cnc(Cl)cc1C ZINC001209638154 969571036 /nfs/dbraw/zinc/57/10/36/969571036.db2.gz RSSCYIROPCQOGY-NSHDSACASA-N 1 2 240.734 2.264 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1cnc(Cl)cc1C ZINC001209638154 969571041 /nfs/dbraw/zinc/57/10/41/969571041.db2.gz RSSCYIROPCQOGY-NSHDSACASA-N 1 2 240.734 2.264 20 0 BEADLO Cc1[nH+]c2ccc(N)cc2n1-c1ncccc1F ZINC001209809660 969634981 /nfs/dbraw/zinc/63/49/81/969634981.db2.gz PKWPUQCQOHQHES-UHFFFAOYSA-N 1 2 242.257 2.450 20 0 BEADLO Cc1nccc(Nc2ccc3[nH]c[nH+]c3c2)n1 ZINC001209841578 969651775 /nfs/dbraw/zinc/65/17/75/969651775.db2.gz WFWLZRRHWRNZQD-UHFFFAOYSA-N 1 2 225.255 2.405 20 0 BEADLO c1nnsc1Nc1ccc2[nH]c[nH+]c2c1 ZINC001209844447 969654319 /nfs/dbraw/zinc/65/43/19/969654319.db2.gz NIMBPFAGLORYOI-UHFFFAOYSA-N 1 2 217.257 2.158 20 0 BEADLO Cc1cc([N@H+]2C(=N)C=C(Cl)C=C2N)ccc1O ZINC001209974112 969741351 /nfs/dbraw/zinc/74/13/51/969741351.db2.gz PMJNLBWUOBYQEM-UHFFFAOYSA-N 1 2 249.701 2.206 20 0 BEADLO Cc1cc([N@@H+]2C(=N)C=C(Cl)C=C2N)ccc1O ZINC001209974112 969741355 /nfs/dbraw/zinc/74/13/55/969741355.db2.gz PMJNLBWUOBYQEM-UHFFFAOYSA-N 1 2 249.701 2.206 20 0 BEADLO Cn1ncc(Nc2ccc3c[nH+]ccc3c2)n1 ZINC001210046064 969775290 /nfs/dbraw/zinc/77/52/90/969775290.db2.gz RCQBPSFRRVJMQV-UHFFFAOYSA-N 1 2 225.255 2.107 20 0 BEADLO C[C@@H](C(=O)N1CC[C@H](C)C(C)(C)C1)n1cc[nH+]c1 ZINC001254785271 969789882 /nfs/dbraw/zinc/78/98/82/969789882.db2.gz QXFALUWCTJQTPF-RYUDHWBXSA-N 1 2 249.358 2.339 20 0 BEADLO Cc1cccc(C)c1NC[C@@H]1COCC[N@H+]1C ZINC001169654473 969801174 /nfs/dbraw/zinc/80/11/74/969801174.db2.gz SQCRACVTPJKCCH-CYBMUJFWSA-N 1 2 234.343 2.046 20 0 BEADLO Cc1cccc(C)c1NC[C@@H]1COCC[N@@H+]1C ZINC001169654473 969801178 /nfs/dbraw/zinc/80/11/78/969801178.db2.gz SQCRACVTPJKCCH-CYBMUJFWSA-N 1 2 234.343 2.046 20 0 BEADLO c1ccc2c(c1)CC[C@@H]2OCC[NH+]1CCOCC1 ZINC001210191195 969824720 /nfs/dbraw/zinc/82/47/20/969824720.db2.gz CQZXQSDNLXQGMB-HNNXBMFYSA-N 1 2 247.338 2.023 20 0 BEADLO CCCC(CCC)OCC[NH+]1CCOCC1 ZINC001210208899 969832135 /nfs/dbraw/zinc/83/21/35/969832135.db2.gz WJERVQWHXUDDSK-UHFFFAOYSA-N 1 2 229.364 2.304 20 0 BEADLO O=C1C[C@H]2C[C@H]([NH+]3CC(F)(C4CC4)C3)C[C@H]2C1 ZINC001254946774 969834820 /nfs/dbraw/zinc/83/48/20/969834820.db2.gz UDRWQZWXJIAMQO-IAZYJMLFSA-N 1 2 237.318 2.178 20 0 BEADLO Cc1cc[nH+]c(C)c1NCc1ncccc1O ZINC001169733325 969837234 /nfs/dbraw/zinc/83/72/34/969837234.db2.gz UFIASDWTHDFZLO-UHFFFAOYSA-N 1 2 229.283 2.411 20 0 BEADLO O=c1[nH]nccc1Nc1cccc2cc[nH+]cc21 ZINC001210224661 969837852 /nfs/dbraw/zinc/83/78/52/969837852.db2.gz UVPKUIIJBJFZIV-UHFFFAOYSA-N 1 2 238.250 2.474 20 0 BEADLO Oc1cccnc1CNc1cccn2cc[nH+]c12 ZINC001169731953 969838446 /nfs/dbraw/zinc/83/84/46/969838446.db2.gz UOGKNDRTZUAIPP-UHFFFAOYSA-N 1 2 240.266 2.047 20 0 BEADLO O=C1C[C@H]2CC([N@H+]3Cc4ncsc4C3)C[C@@H]2C1 ZINC001254960430 969840656 /nfs/dbraw/zinc/84/06/56/969840656.db2.gz IWTHMUNNTDSWFY-RKDXNWHRSA-N 1 2 248.351 2.216 20 0 BEADLO O=C1C[C@H]2CC([N@@H+]3Cc4ncsc4C3)C[C@@H]2C1 ZINC001254960430 969840660 /nfs/dbraw/zinc/84/06/60/969840660.db2.gz IWTHMUNNTDSWFY-RKDXNWHRSA-N 1 2 248.351 2.216 20 0 BEADLO Cc1ccc(N(C)c2[nH+]cccc2N)cc1CO ZINC001210245611 969840898 /nfs/dbraw/zinc/84/08/98/969840898.db2.gz PAOWHWJKMHTUNV-UHFFFAOYSA-N 1 2 243.310 2.232 20 0 BEADLO CCOC(=O)C(C)(C)[NH2+]C1Cc2ccccc2C1 ZINC001255013887 969844590 /nfs/dbraw/zinc/84/45/90/969844590.db2.gz MQVULKQGPQNWLQ-UHFFFAOYSA-N 1 2 247.338 2.085 20 0 BEADLO CO[C@@H](C)CNc1[nH+]cccc1-n1cccc1 ZINC001169772492 969846729 /nfs/dbraw/zinc/84/67/29/969846729.db2.gz KOTFORSIXFVIBD-NSHDSACASA-N 1 2 231.299 2.319 20 0 BEADLO CO[C@@H](C)CNc1cc(N(C)C)cc(Cl)[nH+]1 ZINC001169772713 969848047 /nfs/dbraw/zinc/84/80/47/969848047.db2.gz LVZJDIRXATTWNO-QMMMGPOBSA-N 1 2 243.738 2.248 20 0 BEADLO Cc1ccnc(Nc2c[nH+]c(C)c(N)c2)c1 ZINC001210285736 969851050 /nfs/dbraw/zinc/85/10/50/969851050.db2.gz QNEOPTUUODZSQL-UHFFFAOYSA-N 1 2 214.272 2.419 20 0 BEADLO Cc1cc(O)cnc1Nc1c[nH+]c(C)c(N)c1 ZINC001210286216 969853771 /nfs/dbraw/zinc/85/37/71/969853771.db2.gz YAYPUNFCKOPYQL-UHFFFAOYSA-N 1 2 230.271 2.125 20 0 BEADLO COc1ncccc1Nc1c[nH+]c(C)c(N)c1 ZINC001210285794 969853787 /nfs/dbraw/zinc/85/37/87/969853787.db2.gz RTKDDQAZRHUGOY-UHFFFAOYSA-N 1 2 230.271 2.119 20 0 BEADLO Cc1ncc(Nc2c[nH+]c(C)c(N)c2)nc1C ZINC001210287532 969853928 /nfs/dbraw/zinc/85/39/28/969853928.db2.gz WQTTULZVPJYDAH-UHFFFAOYSA-N 1 2 229.287 2.123 20 0 BEADLO COc1cncc(Nc2c[nH+]c(C)c(N)c2)c1C ZINC001210287154 969854114 /nfs/dbraw/zinc/85/41/14/969854114.db2.gz MMGLOSAGMXGOQA-UHFFFAOYSA-N 1 2 244.298 2.428 20 0 BEADLO COc1ncc(F)cc1Nc1c[nH+]c(C)c(N)c1 ZINC001210287419 969854365 /nfs/dbraw/zinc/85/43/65/969854365.db2.gz UHAQCMZYSCHUIZ-UHFFFAOYSA-N 1 2 248.261 2.259 20 0 BEADLO Cc1[nH+]cc(Nc2ncc(Cl)cc2N)cc1N ZINC001210287070 969854921 /nfs/dbraw/zinc/85/49/21/969854921.db2.gz KECFCXIHLYSCFT-UHFFFAOYSA-N 1 2 249.705 2.346 20 0 BEADLO Cc1[nH+]cc(-n2ccc3ccc(N)cc32)cc1N ZINC001210288704 969855959 /nfs/dbraw/zinc/85/59/59/969855959.db2.gz SOHDATBYQHTTFZ-UHFFFAOYSA-N 1 2 238.294 2.498 20 0 BEADLO Cc1[nH+]cc(Nc2ncccc2N(C)C)cc1N ZINC001210288471 969856948 /nfs/dbraw/zinc/85/69/48/969856948.db2.gz JWNPGJUYYCZMJC-UHFFFAOYSA-N 1 2 243.314 2.177 20 0 BEADLO Cn1cc[nH+]c1-c1ccc(-n2cccc2N)cc1 ZINC001210432000 969886738 /nfs/dbraw/zinc/88/67/38/969886738.db2.gz XWEKHKICOQSNAV-UHFFFAOYSA-N 1 2 238.294 2.460 20 0 BEADLO Cc1cn2c(cccc2Nc2cncc(N)c2)[nH+]1 ZINC001210436170 969887745 /nfs/dbraw/zinc/88/77/45/969887745.db2.gz XPIQRNPVNOCZNQ-UHFFFAOYSA-N 1 2 239.282 2.364 20 0 BEADLO COCC(C)(C)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC001156459114 969898423 /nfs/dbraw/zinc/89/84/23/969898423.db2.gz DDYCPYHWMLRIIF-UHFFFAOYSA-N 1 2 234.303 2.103 20 0 BEADLO CSCc1cc[nH+]c(NCc2cncnc2)c1 ZINC001156576287 969926058 /nfs/dbraw/zinc/92/60/58/969926058.db2.gz UAFZKKFBAPZDIH-UHFFFAOYSA-N 1 2 246.339 2.347 20 0 BEADLO CCc1nnc(-c2ccccc2-n2cc[nH+]c2)o1 ZINC001255138265 969951582 /nfs/dbraw/zinc/95/15/82/969951582.db2.gz RTTGBAVYYIENDR-UHFFFAOYSA-N 1 2 240.266 2.485 20 0 BEADLO O=c1[nH]cc(-c2ccn3cc[nH+]c3c2)cc1F ZINC001242615195 970017528 /nfs/dbraw/zinc/01/75/28/970017528.db2.gz YYCBBAHKJMVDCM-UHFFFAOYSA-N 1 2 229.214 2.241 20 0 BEADLO CCCN(C)c1[nH+]ccc(C)c1NC(C)=O ZINC001156877743 970020551 /nfs/dbraw/zinc/02/05/51/970020551.db2.gz IIUPSHINLOKQCJ-UHFFFAOYSA-N 1 2 221.304 2.195 20 0 BEADLO COc1cc(Nc2cncnc2C)cc(C)[nH+]1 ZINC001210774204 970023575 /nfs/dbraw/zinc/02/35/75/970023575.db2.gz LHVVAXPKMFKRNP-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO Nc1cc(Cl)[nH+]c(N2CC3CC(C3)C2)c1 ZINC001156892651 970026405 /nfs/dbraw/zinc/02/64/05/970026405.db2.gz OLRCLZPGFOUUCC-UHFFFAOYSA-N 1 2 223.707 2.163 20 0 BEADLO CCc1nccnc1Nc1cc(C)[nH+]c(OC)c1 ZINC001210779042 970028147 /nfs/dbraw/zinc/02/81/47/970028147.db2.gz CYKYGYLIALSLCX-UHFFFAOYSA-N 1 2 244.298 2.495 20 0 BEADLO CCCn1nccc1Nc1cc(OC)cc[nH+]1 ZINC001210912350 970069151 /nfs/dbraw/zinc/06/91/51/970069151.db2.gz JANSLDUAAWRNFB-UHFFFAOYSA-N 1 2 232.287 2.440 20 0 BEADLO C=C(Nc1c[nH+]ncc1N)c1ccccc1 ZINC001210984080 970091861 /nfs/dbraw/zinc/09/18/61/970091861.db2.gz ZUWNVBFKYHWODI-UHFFFAOYSA-N 1 2 212.256 2.142 20 0 BEADLO CCN(CC)c1cc(N2CCC[C@H]3C[C@H]32)nc[nH+]1 ZINC001157142683 970113594 /nfs/dbraw/zinc/11/35/94/970113594.db2.gz DRIPTBZMHITMAL-NWDGAFQWSA-N 1 2 246.358 2.312 20 0 BEADLO CCN(CC)c1cc(N2CCC[C@H]3C[C@H]32)[nH+]cn1 ZINC001157142683 970113599 /nfs/dbraw/zinc/11/35/99/970113599.db2.gz DRIPTBZMHITMAL-NWDGAFQWSA-N 1 2 246.358 2.312 20 0 BEADLO CCCC[C@H](C)[N@@H+]1CC[C@@H](O)C(F)(F)C1 ZINC001255330632 970113509 /nfs/dbraw/zinc/11/35/09/970113509.db2.gz VNRASGOUIHTNNZ-VHSXEESVSA-N 1 2 221.291 2.267 20 0 BEADLO CCCC[C@H](C)[N@H+]1CC[C@@H](O)C(F)(F)C1 ZINC001255330632 970113514 /nfs/dbraw/zinc/11/35/14/970113514.db2.gz VNRASGOUIHTNNZ-VHSXEESVSA-N 1 2 221.291 2.267 20 0 BEADLO Cn1c[nH+]cc1-c1cccc2c1COCC2 ZINC001243068982 970261801 /nfs/dbraw/zinc/26/18/01/970261801.db2.gz LQMAFJBNGLMWTJ-UHFFFAOYSA-N 1 2 214.268 2.160 20 0 BEADLO C=CCOc1ccccc1C[N@H+]1CCOC[C@H]1C ZINC000091814854 970267268 /nfs/dbraw/zinc/26/72/68/970267268.db2.gz LNGYTMBGMMVDNL-CYBMUJFWSA-N 1 2 247.338 2.472 20 0 BEADLO C=CCOc1ccccc1C[N@@H+]1CCOC[C@H]1C ZINC000091814854 970267277 /nfs/dbraw/zinc/26/72/77/970267277.db2.gz LNGYTMBGMMVDNL-CYBMUJFWSA-N 1 2 247.338 2.472 20 0 BEADLO Nc1ccc[nH+]c1Nc1ccc2c(c1)NCC2 ZINC001213145984 970277677 /nfs/dbraw/zinc/27/76/77/970277677.db2.gz DUTIZBXUKWQZQN-UHFFFAOYSA-N 1 2 226.283 2.375 20 0 BEADLO Nc1cc(Cl)[nH+]c(NC[C@H]2C[C@H](F)C2)c1 ZINC001157452446 970311962 /nfs/dbraw/zinc/31/19/62/970311962.db2.gz ADRMODLYPRPOTG-LJGSYFOKSA-N 1 2 229.686 2.477 20 0 BEADLO CCN(c1nccc(C)c1Cl)C1C[NH+](C)C1 ZINC001157455445 970315712 /nfs/dbraw/zinc/31/57/12/970315712.db2.gz KDRRRSPCUFWHKL-UHFFFAOYSA-N 1 2 239.750 2.184 20 0 BEADLO Cc1c[nH+]cc(Nc2c(N)ncnc2Cl)c1C ZINC001213522589 970342696 /nfs/dbraw/zinc/34/26/96/970342696.db2.gz CYFHRNFQUPHTDE-UHFFFAOYSA-N 1 2 249.705 2.468 20 0 BEADLO Cc1nonc1Nc1c[nH+]cc(C)c1C ZINC001213523323 970349400 /nfs/dbraw/zinc/34/94/00/970349400.db2.gz PZMODTQKKDNIDM-UHFFFAOYSA-N 1 2 204.233 2.133 20 0 BEADLO FC1(F)CC[N@@H+](C2CCC3(CC2)OCCO3)C1 ZINC001255620618 970403040 /nfs/dbraw/zinc/40/30/40/970403040.db2.gz KPAWHVPJOWXUES-UHFFFAOYSA-N 1 2 247.285 2.013 20 0 BEADLO FC1(F)CC[N@H+](C2CCC3(CC2)OCCO3)C1 ZINC001255620618 970403044 /nfs/dbraw/zinc/40/30/44/970403044.db2.gz KPAWHVPJOWXUES-UHFFFAOYSA-N 1 2 247.285 2.013 20 0 BEADLO COC(=O)C(C)(C)[NH2+][C@@H](C)Cc1ccc(C)cc1 ZINC001255772446 970476594 /nfs/dbraw/zinc/47/65/94/970476594.db2.gz HNKBOSLIJQRNIT-LBPRGKRZSA-N 1 2 249.354 2.467 20 0 BEADLO Cc1ccc(C[C@@H](C)[NH2+]CC(F)(F)CO)cc1 ZINC001255781248 970487330 /nfs/dbraw/zinc/48/73/30/970487330.db2.gz YNLZOWOTPNPRLS-LLVKDONJSA-N 1 2 243.297 2.143 20 0 BEADLO Cc1ccc(C[C@H](C)[N@@H+]2CCC(=O)C2)cc1 ZINC001255791914 970497639 /nfs/dbraw/zinc/49/76/39/970497639.db2.gz HDDUVIYBFYURFL-LBPRGKRZSA-N 1 2 217.312 2.201 20 0 BEADLO Cc1ccc(C[C@H](C)[N@H+]2CCC(=O)C2)cc1 ZINC001255791914 970497643 /nfs/dbraw/zinc/49/76/43/970497643.db2.gz HDDUVIYBFYURFL-LBPRGKRZSA-N 1 2 217.312 2.201 20 0 BEADLO OC1(C(F)(F)F)C[NH+](C2CCCCCC2)C1 ZINC001255888110 970551900 /nfs/dbraw/zinc/55/19/00/970551900.db2.gz SKWUNWUIJXPXTR-UHFFFAOYSA-N 1 2 237.265 2.318 20 0 BEADLO C[NH+](C)Cc1nnc([C@@H]2CCC[C@H]3C[C@H]32)o1 ZINC001327351783 972557687 /nfs/dbraw/zinc/55/76/87/972557687.db2.gz CDDPDFVTTJMZGO-IVZWLZJFSA-N 1 2 221.304 2.035 20 0 BEADLO C[C@H](COc1ccccc1)OCc1c[nH+]cn1C ZINC001222595043 972593127 /nfs/dbraw/zinc/59/31/27/972593127.db2.gz MJNNJDRGJJUFIA-GFCCVEGCSA-N 1 2 246.310 2.404 20 0 BEADLO CC(=O)[C@H](OCc1c[nH+]cn1C)c1ccccc1 ZINC001222600413 972600106 /nfs/dbraw/zinc/60/01/06/972600106.db2.gz OPDNZUWRIMUUSU-AWEZNQCLSA-N 1 2 244.294 2.267 20 0 BEADLO CC[C@@](C)([NH2+]Cc1nnc[nH]1)c1ccccc1 ZINC001327555046 972632825 /nfs/dbraw/zinc/63/28/25/972632825.db2.gz QJKFVLPUQQQKKA-CYBMUJFWSA-N 1 2 230.315 2.220 20 0 BEADLO CC(C)c1cnc(CN2CCn3c[nH+]cc3C2)o1 ZINC001327561372 972634418 /nfs/dbraw/zinc/63/44/18/972634418.db2.gz DHKKFFUUJCJBMO-UHFFFAOYSA-N 1 2 246.314 2.010 20 0 BEADLO CC(C)OC1C[NH+](Cc2ccc3cc[nH]c3n2)C1 ZINC001144187164 972675382 /nfs/dbraw/zinc/67/53/82/972675382.db2.gz CBUPITZMOSDFOU-UHFFFAOYSA-N 1 2 245.326 2.172 20 0 BEADLO CC(C)C(C)(C)c1nnc(C[NH+](C)C)o1 ZINC001327864343 972765426 /nfs/dbraw/zinc/76/54/26/972765426.db2.gz IQUPCDVRRBVBSP-UHFFFAOYSA-N 1 2 211.309 2.065 20 0 BEADLO C[N@H+](Cc1c(F)cc(O)cc1F)C1CC1 ZINC001144541254 972860883 /nfs/dbraw/zinc/86/08/83/972860883.db2.gz DTRPCYWOEBWIGT-UHFFFAOYSA-N 1 2 213.227 2.265 20 0 BEADLO C[N@@H+](Cc1c(F)cc(O)cc1F)C1CC1 ZINC001144541254 972860890 /nfs/dbraw/zinc/86/08/90/972860890.db2.gz DTRPCYWOEBWIGT-UHFFFAOYSA-N 1 2 213.227 2.265 20 0 BEADLO C[C@@H](C(=O)N[C@H]1CC[C@@H](C)C[C@@H]1C)n1cc[nH+]c1 ZINC001328074862 972866564 /nfs/dbraw/zinc/86/65/64/972866564.db2.gz FHFDMTZPFAXPAT-VOAKCMCISA-N 1 2 249.358 2.385 20 0 BEADLO CCc1nnc(Cc2cn3cccc(C)c3[nH+]2)o1 ZINC001328119909 972873088 /nfs/dbraw/zinc/87/30/88/972873088.db2.gz NFLXFQOIVHCKTG-UHFFFAOYSA-N 1 2 242.282 2.179 20 0 BEADLO c1nc(C[NH+]2CC3(CCC3)C2)c2ccccn12 ZINC001144616480 972893952 /nfs/dbraw/zinc/89/39/52/972893952.db2.gz PLEDBNMLXNGEQZ-UHFFFAOYSA-N 1 2 227.311 2.320 20 0 BEADLO c1nsnc1C[N@@H+]1CCC[C@@H](C2CC2)C1 ZINC000846907344 973058791 /nfs/dbraw/zinc/05/87/91/973058791.db2.gz XCOYWGSIHKIGQS-SNVBAGLBSA-N 1 2 223.345 2.160 20 0 BEADLO c1nsnc1C[N@H+]1CCC[C@@H](C2CC2)C1 ZINC000846907344 973058805 /nfs/dbraw/zinc/05/88/05/973058805.db2.gz XCOYWGSIHKIGQS-SNVBAGLBSA-N 1 2 223.345 2.160 20 0 BEADLO c1nsnc1C[NH+]1CCC2(CCC2)CC1 ZINC000846905228 973060544 /nfs/dbraw/zinc/06/05/44/973060544.db2.gz ZDKQUGRWSPDDIC-UHFFFAOYSA-N 1 2 223.345 2.304 20 0 BEADLO CC(C)c1ocnc1C[N@@H+]1C[C@H]2[C@@H](C1)C2(F)F ZINC001328620109 973203194 /nfs/dbraw/zinc/20/31/94/973203194.db2.gz QHLTZSZMSOOXBX-DTORHVGOSA-N 1 2 242.269 2.495 20 0 BEADLO CC(C)c1ocnc1C[N@H+]1C[C@H]2[C@@H](C1)C2(F)F ZINC001328620109 973203216 /nfs/dbraw/zinc/20/32/16/973203216.db2.gz QHLTZSZMSOOXBX-DTORHVGOSA-N 1 2 242.269 2.495 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cc(C)n[nH]2)[C@@H](CC)CO1 ZINC001328709255 973287931 /nfs/dbraw/zinc/28/79/31/973287931.db2.gz XRSXPSIAXTUCKJ-STQMWFEESA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cc(C)n[nH]2)[C@@H](CC)CO1 ZINC001328709255 973287947 /nfs/dbraw/zinc/28/79/47/973287947.db2.gz XRSXPSIAXTUCKJ-STQMWFEESA-N 1 2 237.347 2.108 20 0 BEADLO COc1cc(C)[nH+]c(CS[C@@H]2CCOC2)c1 ZINC001328746540 973326462 /nfs/dbraw/zinc/32/64/62/973326462.db2.gz PMOHVNWKMQDWKM-GFCCVEGCSA-N 1 2 239.340 2.421 20 0 BEADLO CCc1ccccc1COC1C[NH+](C)C1 ZINC001224214933 973482696 /nfs/dbraw/zinc/48/26/96/973482696.db2.gz IYWHBAWQIDZGER-UHFFFAOYSA-N 1 2 205.301 2.080 20 0 BEADLO Cc1ccc([C@@H](C)c2nnc(C[NH+](C)C)o2)o1 ZINC001329269675 973624994 /nfs/dbraw/zinc/62/49/94/973624994.db2.gz HDTJTXUCOIENKW-SECBINFHSA-N 1 2 235.287 2.184 20 0 BEADLO COc1ncc(-c2c[nH+]c(C(C)C)n2C)cn1 ZINC001329656007 973871842 /nfs/dbraw/zinc/87/18/42/973871842.db2.gz IYQLVXNMFHRHDD-UHFFFAOYSA-N 1 2 232.287 2.009 20 0 BEADLO CN(C)c1cc(NCc2ccccc2F)[nH+]cn1 ZINC000585414905 973912305 /nfs/dbraw/zinc/91/23/05/973912305.db2.gz BZEVFGNCVFLLNE-UHFFFAOYSA-N 1 2 246.289 2.294 20 0 BEADLO CN(C)c1cc(NCc2ccccc2F)nc[nH+]1 ZINC000585414905 973912315 /nfs/dbraw/zinc/91/23/15/973912315.db2.gz BZEVFGNCVFLLNE-UHFFFAOYSA-N 1 2 246.289 2.294 20 0 BEADLO c1nnc(C[N@@H+]2CCC[C@]3(CC=CCC3)C2)[nH]1 ZINC001329878300 973996806 /nfs/dbraw/zinc/99/68/06/973996806.db2.gz RJFBWIXGFIBKGR-CYBMUJFWSA-N 1 2 232.331 2.127 20 0 BEADLO c1nnc(C[N@H+]2CCC[C@]3(CC=CCC3)C2)[nH]1 ZINC001329878300 973996821 /nfs/dbraw/zinc/99/68/21/973996821.db2.gz RJFBWIXGFIBKGR-CYBMUJFWSA-N 1 2 232.331 2.127 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](CC(=O)OC(C)C)CC2 ZINC001329911681 974020559 /nfs/dbraw/zinc/02/05/59/974020559.db2.gz MMHXUQBUIDBFRP-UHFFFAOYSA-N 1 2 247.338 2.305 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](CC(=O)OC(C)C)CC2 ZINC001329911681 974020576 /nfs/dbraw/zinc/02/05/76/974020576.db2.gz MMHXUQBUIDBFRP-UHFFFAOYSA-N 1 2 247.338 2.305 20 0 BEADLO CC(C)(CC(=O)N1CCCC1)Nc1cccc[nH+]1 ZINC001171484864 974077789 /nfs/dbraw/zinc/07/77/89/974077789.db2.gz UMRNYZFYCSXCPH-UHFFFAOYSA-N 1 2 247.342 2.285 20 0 BEADLO C[C@H](c1nnc(C[NH+](C)C)o1)C1CCC1 ZINC001330098955 974105532 /nfs/dbraw/zinc/10/55/32/974105532.db2.gz IXKKPFKCDUBGMG-QMMMGPOBSA-N 1 2 209.293 2.035 20 0 BEADLO CCOC(=[NH2+])CCCCO[C@H]1CCOC[C@H]1F ZINC001224964720 974106939 /nfs/dbraw/zinc/10/69/39/974106939.db2.gz CBQOVJSKQUOLFV-MNOVXSKESA-N 1 2 247.310 2.314 20 0 BEADLO CCOC(=[NH2+])CCCCO[C@H](CC)C(=O)OC ZINC001224965530 974107702 /nfs/dbraw/zinc/10/77/02/974107702.db2.gz KAJUFIFKAGZYQT-SNVBAGLBSA-N 1 2 245.319 2.139 20 0 BEADLO CCOC(=O)C[NH2+][C@@H](C)CCc1ccc(C)cc1 ZINC001171660639 974126270 /nfs/dbraw/zinc/12/62/70/974126270.db2.gz NIFRQQUNHROMGM-ZDUSSCGKSA-N 1 2 249.354 2.469 20 0 BEADLO Fc1cccc2c1C[C@H]([NH2+]CC(F)F)C2 ZINC001171768967 974153618 /nfs/dbraw/zinc/15/36/18/974153618.db2.gz MBXMLGLTVDDUFM-MRVPVSSYSA-N 1 2 215.218 2.148 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)Oc1cc[nH+]cc1 ZINC001225290636 974363112 /nfs/dbraw/zinc/36/31/12/974363112.db2.gz DGGYHNVDMMZMHC-LBPRGKRZSA-N 1 2 237.299 2.438 20 0 BEADLO CC1(C)C[N@H+](CC(=O)Nc2ccccn2)C1(C)C ZINC001330658911 974390068 /nfs/dbraw/zinc/39/00/68/974390068.db2.gz VCMIEYLONNJMHE-UHFFFAOYSA-N 1 2 247.342 2.141 20 0 BEADLO CC1(C)C[N@@H+](CC(=O)Nc2ccccn2)C1(C)C ZINC001330658911 974390081 /nfs/dbraw/zinc/39/00/81/974390081.db2.gz VCMIEYLONNJMHE-UHFFFAOYSA-N 1 2 247.342 2.141 20 0 BEADLO Cc1csc(CNC(=O)[C@H](C)n2cc[nH+]c2)c1 ZINC001330679287 974407301 /nfs/dbraw/zinc/40/73/01/974407301.db2.gz FMIWKBPRVAABEB-JTQLQIEISA-N 1 2 249.339 2.130 20 0 BEADLO Cc1c[nH]c2cccc(OC3C[NH+](C)C3)c12 ZINC001225390321 974461260 /nfs/dbraw/zinc/46/12/60/974461260.db2.gz QWHVBBWEFVUUHW-UHFFFAOYSA-N 1 2 216.284 2.169 20 0 BEADLO c1ccc2c(c1)C[C@H]([N@@H+]1CCC13COC3)CS2 ZINC001172201238 974481920 /nfs/dbraw/zinc/48/19/20/974481920.db2.gz GDYNUKKYYXCKSR-LBPRGKRZSA-N 1 2 247.363 2.178 20 0 BEADLO c1ccc2c(c1)C[C@H]([N@H+]1CCC13COC3)CS2 ZINC001172201238 974481925 /nfs/dbraw/zinc/48/19/25/974481925.db2.gz GDYNUKKYYXCKSR-LBPRGKRZSA-N 1 2 247.363 2.178 20 0 BEADLO Cc1ccc2cccc(OC3C[NH+](C)C3)c2n1 ZINC001225477780 974514737 /nfs/dbraw/zinc/51/47/37/974514737.db2.gz ONDXRNRXYPFGED-UHFFFAOYSA-N 1 2 228.295 2.236 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@@H](C)CCO[C@@H](C)CC ZINC001172319392 974527081 /nfs/dbraw/zinc/52/70/81/974527081.db2.gz QKPIVYCMXJBOFH-SRVKXCTJSA-N 1 2 245.363 2.121 20 0 BEADLO CC1(C)C[C@@H]([N@@H+]2CCC(F)(F)[C@H](F)C2)CO1 ZINC001172283296 974541627 /nfs/dbraw/zinc/54/16/27/974541627.db2.gz JKLGDJHLSSKIDA-RKDXNWHRSA-N 1 2 237.265 2.233 20 0 BEADLO CC1(C)C[C@@H]([N@H+]2CCC(F)(F)[C@H](F)C2)CO1 ZINC001172283296 974541635 /nfs/dbraw/zinc/54/16/35/974541635.db2.gz JKLGDJHLSSKIDA-RKDXNWHRSA-N 1 2 237.265 2.233 20 0 BEADLO CC(C)(C(=O)N1CC(C)(C)C1(C)C)c1c[nH+]c[nH]1 ZINC001331120106 974611642 /nfs/dbraw/zinc/61/16/42/974611642.db2.gz JPLAKFZDGVZKME-UHFFFAOYSA-N 1 2 249.358 2.334 20 0 BEADLO COc1ccc(F)cc1OC1C[NH+](C(C)C)C1 ZINC001225644319 974616746 /nfs/dbraw/zinc/61/67/46/974616746.db2.gz LDYZOSQOTVMCFS-UHFFFAOYSA-N 1 2 239.290 2.306 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OCC[C@@H]1CCOC1 ZINC001331257687 974663517 /nfs/dbraw/zinc/66/35/17/974663517.db2.gz JQTPSRRHQNHIMG-LBPRGKRZSA-N 1 2 248.326 2.268 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3nc[nH]c3C2)cs1 ZINC001331380013 974700700 /nfs/dbraw/zinc/70/07/00/974700700.db2.gz LLHCYGKHLOKDLE-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1cc(C[N@H+]2CCc3nc[nH]c3C2)cs1 ZINC001331380013 974700705 /nfs/dbraw/zinc/70/07/05/974700705.db2.gz LLHCYGKHLOKDLE-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO CC(C)OCC[C@@H](C)[NH2+]CC(=O)OC(C)(C)C ZINC001172432890 974719979 /nfs/dbraw/zinc/71/99/79/974719979.db2.gz DPGCEQIFBXFSBW-LLVKDONJSA-N 1 2 245.363 2.121 20 0 BEADLO CC[NH+]1CC(Oc2c(C)cc(O)cc2C)C1 ZINC001225965945 974746817 /nfs/dbraw/zinc/74/68/17/974746817.db2.gz HSWNUBCHKYBLHL-UHFFFAOYSA-N 1 2 221.300 2.092 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N[C@H]2CC[C@@H](C)C2)c[nH+]1 ZINC001331728088 974805835 /nfs/dbraw/zinc/80/58/35/974805835.db2.gz CYKRWWKLYLBEIQ-PWSUYJOCSA-N 1 2 249.358 2.231 20 0 BEADLO CC(C)OCC[C@H](C)N1C[C@H](C)[N@H+](C)C[C@H]1C ZINC001172446369 974808488 /nfs/dbraw/zinc/80/84/88/974808488.db2.gz KPINIBLMXGJDDP-MELADBBJSA-N 1 2 242.407 2.214 20 0 BEADLO CC(C)OCC[C@H](C)N1C[C@H](C)[N@@H+](C)C[C@H]1C ZINC001172446369 974808491 /nfs/dbraw/zinc/80/84/91/974808491.db2.gz KPINIBLMXGJDDP-MELADBBJSA-N 1 2 242.407 2.214 20 0 BEADLO CC[NH+]1CC(Oc2nc3ccc(F)cc3o2)C1 ZINC001226450956 974900941 /nfs/dbraw/zinc/90/09/41/974900941.db2.gz KHBNIIKSNUJWGI-UHFFFAOYSA-N 1 2 236.246 2.050 20 0 BEADLO COC1C[NH+]([C@@H]2Cc3ccc(Cl)cc3C2)C1 ZINC001172719702 974904904 /nfs/dbraw/zinc/90/49/04/974904904.db2.gz SKBFNPDPNLNQEK-GFCCVEGCSA-N 1 2 237.730 2.138 20 0 BEADLO C=C/C=C\CCOC(=O)CCc1ccc(N)[nH+]c1 ZINC001332216188 975009757 /nfs/dbraw/zinc/00/97/57/975009757.db2.gz MZMBHSIHGJZPPW-ARJAWSKDSA-N 1 2 246.310 2.272 20 0 BEADLO CCCOC1CCC([NH+]2CC(F)C2)CC1 ZINC001173096556 975020150 /nfs/dbraw/zinc/02/01/50/975020150.db2.gz XICFNUXJWCFCJF-UHFFFAOYSA-N 1 2 215.312 2.378 20 0 BEADLO Cc1nc(C)c(C[N@@H+](C)Cc2cncnc2)s1 ZINC001206192457 975058122 /nfs/dbraw/zinc/05/81/22/975058122.db2.gz SIYLKWPUYUIGEH-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO Cc1nc(C)c(C[N@H+](C)Cc2cncnc2)s1 ZINC001206192457 975058127 /nfs/dbraw/zinc/05/81/27/975058127.db2.gz SIYLKWPUYUIGEH-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO CC[C@@H]1CC[C@H]([N@H+](C)Cc2noc(C)n2)C1 ZINC001173273766 975157053 /nfs/dbraw/zinc/15/70/53/975157053.db2.gz OPLRBNXSVLCQEY-MNOVXSKESA-N 1 2 223.320 2.389 20 0 BEADLO CC[C@@H]1CC[C@H]([N@@H+](C)Cc2noc(C)n2)C1 ZINC001173273766 975157072 /nfs/dbraw/zinc/15/70/72/975157072.db2.gz OPLRBNXSVLCQEY-MNOVXSKESA-N 1 2 223.320 2.389 20 0 BEADLO Cc1sc2ncnc(OC3C[NH+](C)C3)c2c1C ZINC001227080501 975257113 /nfs/dbraw/zinc/25/71/13/975257113.db2.gz YVJNNYYWBSLUOI-UHFFFAOYSA-N 1 2 249.339 2.001 20 0 BEADLO CC(=O)N1CCC[C@H](Oc2c(C)cc[nH+]c2C)C1 ZINC001227264496 975338276 /nfs/dbraw/zinc/33/82/76/975338276.db2.gz MWFDUWZTZZBQMY-ZDUSSCGKSA-N 1 2 248.326 2.088 20 0 BEADLO CC[C@@H](Oc1c(C)cc[nH+]c1C)C(=O)OC ZINC001227266138 975342688 /nfs/dbraw/zinc/34/26/88/975342688.db2.gz WZRIWVKRBSDQNK-SNVBAGLBSA-N 1 2 223.272 2.029 20 0 BEADLO NC1=C[N@@H+](C2Cc3cc(F)c(F)cc3C2)CC=C1 ZINC001173476431 975382428 /nfs/dbraw/zinc/38/24/28/975382428.db2.gz NAYRGQCCOZHBAD-UHFFFAOYSA-N 1 2 248.276 2.104 20 0 BEADLO NC1=C[N@H+](C2Cc3cc(F)c(F)cc3C2)CC=C1 ZINC001173476431 975382437 /nfs/dbraw/zinc/38/24/37/975382437.db2.gz NAYRGQCCOZHBAD-UHFFFAOYSA-N 1 2 248.276 2.104 20 0 BEADLO OCc1cc[nH+]c(NC2CC3(CC3(F)F)C2)c1 ZINC001333145760 975493335 /nfs/dbraw/zinc/49/33/35/975493335.db2.gz YJRHJWHJPICOMI-UHFFFAOYSA-N 1 2 240.253 2.174 20 0 BEADLO CCOC(=O)C[C@H]1CC[C@@H]([NH+]2CC(C)(F)C2)C1 ZINC001173643671 975515076 /nfs/dbraw/zinc/51/50/76/975515076.db2.gz XGMQWKMQBFNVLC-WDEREUQCSA-N 1 2 243.322 2.152 20 0 BEADLO c1cn2c(cccc2Nc2cccnc2)[nH+]1 ZINC001173854144 975762617 /nfs/dbraw/zinc/76/26/17/975762617.db2.gz XDJVMJHBRNIXRC-UHFFFAOYSA-N 1 2 210.240 2.473 20 0 BEADLO C[NH+]1CC(Oc2cccnc2-c2ccccc2)C1 ZINC001227973515 975819105 /nfs/dbraw/zinc/81/91/05/975819105.db2.gz UCWJQDTWSCXVCB-UHFFFAOYSA-N 1 2 240.306 2.441 20 0 BEADLO Cc1cc(Cl)cc(OC2C[NH+](C)C2)c1 ZINC001227983371 975829661 /nfs/dbraw/zinc/82/96/61/975829661.db2.gz CTXAUUIXZWRJHD-UHFFFAOYSA-N 1 2 211.692 2.341 20 0 BEADLO CC1(C)CCC[C@@H]1[C@H]1CC[N@H+](Cc2nnc[nH]2)C1 ZINC001333607415 975889652 /nfs/dbraw/zinc/88/96/52/975889652.db2.gz VJJVVEDEBMLCCP-NWDGAFQWSA-N 1 2 248.374 2.453 20 0 BEADLO CC1(C)CCC[C@@H]1[C@H]1CC[N@@H+](Cc2nnc[nH]2)C1 ZINC001333607415 975889657 /nfs/dbraw/zinc/88/96/57/975889657.db2.gz VJJVVEDEBMLCCP-NWDGAFQWSA-N 1 2 248.374 2.453 20 0 BEADLO COC[C@H](C)Oc1cc2c(cc1OC)CC[NH+]=C2 ZINC001228087700 975896797 /nfs/dbraw/zinc/89/67/97/975896797.db2.gz PWCRTXOICLLCII-JTQLQIEISA-N 1 2 249.310 2.084 20 0 BEADLO CN(C)c1cc(N2CCCC(C)(C)C2)nc[nH+]1 ZINC001333658623 975939271 /nfs/dbraw/zinc/93/92/71/975939271.db2.gz VOWXRGKMABZMEY-UHFFFAOYSA-N 1 2 234.347 2.169 20 0 BEADLO CN(C)c1cc(N2CCCC(C)(C)C2)[nH+]cn1 ZINC001333658623 975939287 /nfs/dbraw/zinc/93/92/87/975939287.db2.gz VOWXRGKMABZMEY-UHFFFAOYSA-N 1 2 234.347 2.169 20 0 BEADLO COc1ccc(Nc2cccn3cc[nH+]c23)cn1 ZINC001173958748 976000371 /nfs/dbraw/zinc/00/03/71/976000371.db2.gz POCFXPQCSLUULE-UHFFFAOYSA-N 1 2 240.266 2.482 20 0 BEADLO COc1ccc(Nc2c[nH+]ccc2OC)cn1 ZINC001173958190 976000788 /nfs/dbraw/zinc/00/07/88/976000788.db2.gz BFTMNCQJWDEWCZ-UHFFFAOYSA-N 1 2 231.255 2.237 20 0 BEADLO CC[C@H](C)[N@H+](CC(=O)OC)Cc1cc(C)co1 ZINC001333712822 976022737 /nfs/dbraw/zinc/02/27/37/976022737.db2.gz CFMAKDZSHSHKLU-NSHDSACASA-N 1 2 239.315 2.362 20 0 BEADLO CC[C@H](C)[N@@H+](CC(=O)OC)Cc1cc(C)co1 ZINC001333712822 976022751 /nfs/dbraw/zinc/02/27/51/976022751.db2.gz CFMAKDZSHSHKLU-NSHDSACASA-N 1 2 239.315 2.362 20 0 BEADLO C[NH+]1CC(Oc2ccc3cc(O)ccc3c2)C1 ZINC001228274710 976041199 /nfs/dbraw/zinc/04/11/99/976041199.db2.gz HAXAAWBNVQUMHX-UHFFFAOYSA-N 1 2 229.279 2.238 20 0 BEADLO Cc1cnc(N[C@H]2CCN(c3cccc[nH+]3)C2)o1 ZINC001333926305 976165135 /nfs/dbraw/zinc/16/51/35/976165135.db2.gz LGKKHCLHRQMUGL-NSHDSACASA-N 1 2 244.298 2.069 20 0 BEADLO COc1ncc(Nc2ccc(C)[nH+]c2C)cn1 ZINC001174032355 976232457 /nfs/dbraw/zinc/23/24/57/976232457.db2.gz KQLHPHJGUCRYME-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO COc1ncccc1Nc1ccn2cc[nH+]c2c1 ZINC001174042243 976258542 /nfs/dbraw/zinc/25/85/42/976258542.db2.gz UTWJGIIJGZQXDR-UHFFFAOYSA-N 1 2 240.266 2.482 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)C[C@@H]1CC=CCC1 ZINC001334112635 976310009 /nfs/dbraw/zinc/31/00/09/976310009.db2.gz ZRJWZMBQZXHNHC-QWHCGFSZSA-N 1 2 247.342 2.134 20 0 BEADLO CC[NH+]1CC(Oc2cc(C)c3cccnc3n2)C1 ZINC001228618506 976385115 /nfs/dbraw/zinc/38/51/15/976385115.db2.gz YBVLTHMLKGSRBN-UHFFFAOYSA-N 1 2 243.310 2.021 20 0 BEADLO C[NH+]1CC(Oc2ccc(F)c3cccnc23)C1 ZINC001228743780 976476797 /nfs/dbraw/zinc/47/67/97/976476797.db2.gz OSMCFFNTVCIYTL-UHFFFAOYSA-N 1 2 232.258 2.067 20 0 BEADLO C[NH+]1CC(Oc2ccc3cccc(F)c3n2)C1 ZINC001228745138 976479127 /nfs/dbraw/zinc/47/91/27/976479127.db2.gz BSTYXLSPGMDPOD-UHFFFAOYSA-N 1 2 232.258 2.067 20 0 BEADLO Nc1ccc[nH+]c1Nc1ccc2n[nH]cc2c1 ZINC001174273043 976497171 /nfs/dbraw/zinc/49/71/71/976497171.db2.gz RHZYATBAACQKMO-UHFFFAOYSA-N 1 2 225.255 2.284 20 0 BEADLO Cn1cc(Nc2ccc[nH+]c2N2CCCC2)cn1 ZINC001174327862 976527771 /nfs/dbraw/zinc/52/77/71/976527771.db2.gz DXJIZKCOWISXGX-UHFFFAOYSA-N 1 2 243.314 2.159 20 0 BEADLO CC[C@](C)(NC(=O)[C@@H](C)n1cc[nH+]c1)C1CC1 ZINC001334566640 976557422 /nfs/dbraw/zinc/55/74/22/976557422.db2.gz RRRYWIWXEFIDBM-MFKMUULPSA-N 1 2 235.331 2.139 20 0 BEADLO C[C@H](C(=O)N(CC1CC1)CC1CC1)n1cc[nH+]c1 ZINC001334557929 976557439 /nfs/dbraw/zinc/55/74/39/976557439.db2.gz MWHJJNFEKZMYGB-LLVKDONJSA-N 1 2 247.342 2.093 20 0 BEADLO Cn1cnc2ccc(Nc3[nH+]cccc3N)cc21 ZINC001174345924 976577296 /nfs/dbraw/zinc/57/72/96/976577296.db2.gz BJRMWHNFHFYXNX-UHFFFAOYSA-N 1 2 239.282 2.294 20 0 BEADLO O=C(N[C@H]1C=CCCC1)c1cc2c[nH+]ccc2[nH]1 ZINC001334693918 976590703 /nfs/dbraw/zinc/59/07/03/976590703.db2.gz ZRGCNKXZSLFBPK-NSHDSACASA-N 1 2 241.294 2.401 20 0 BEADLO Cc1cc(OC2C[NH+](C)C2)cc2scnc21 ZINC001228943254 976593857 /nfs/dbraw/zinc/59/38/57/976593857.db2.gz YXAPITPGENRQAS-UHFFFAOYSA-N 1 2 234.324 2.298 20 0 BEADLO Cc1cc(C)c(Nc2ccc3ncnn3c2)c[nH+]1 ZINC001174373099 976613103 /nfs/dbraw/zinc/61/31/03/976613103.db2.gz ZWMOAPQLAJQCFQ-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cc1c(Nc2[nH+]c(C)ccc2C)cnn1C ZINC001174388453 976642941 /nfs/dbraw/zinc/64/29/41/976642941.db2.gz PMCCVNBGTSIRER-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO CC(=O)c1ccc(OC2C[NH+](C(C)(C)C)C2)cn1 ZINC001229009576 976648773 /nfs/dbraw/zinc/64/87/73/976648773.db2.gz JNJSLEAYOHKBEU-UHFFFAOYSA-N 1 2 248.326 2.146 20 0 BEADLO Nc1ccc[nH+]c1Nc1ccc2cn[nH]c2c1 ZINC001174499547 976725700 /nfs/dbraw/zinc/72/57/00/976725700.db2.gz SYITVBDMBZHOCI-UHFFFAOYSA-N 1 2 225.255 2.284 20 0 BEADLO CCn1ccc(C[N@H+](C)Cc2nn(C)cc2C)c1 ZINC001334870981 976756452 /nfs/dbraw/zinc/75/64/52/976756452.db2.gz MZERTQUGTIFXEA-UHFFFAOYSA-N 1 2 246.358 2.182 20 0 BEADLO CCn1ccc(C[N@@H+](C)Cc2nn(C)cc2C)c1 ZINC001334870981 976756470 /nfs/dbraw/zinc/75/64/70/976756470.db2.gz MZERTQUGTIFXEA-UHFFFAOYSA-N 1 2 246.358 2.182 20 0 BEADLO Cc1n[nH]cc1Nc1cccc2[nH+]ccn21 ZINC001174472097 976780559 /nfs/dbraw/zinc/78/05/59/976780559.db2.gz ZELBVXPZYLHUQJ-UHFFFAOYSA-N 1 2 213.244 2.109 20 0 BEADLO Cc1c[nH+]ccc1Nc1nnc(C(C)C)o1 ZINC001174536493 976816877 /nfs/dbraw/zinc/81/68/77/976816877.db2.gz WJQJMRLFRZFAEK-UHFFFAOYSA-N 1 2 218.260 2.062 20 0 BEADLO Cc1c[nH+]ccc1NC1=CC=NC(Cl)C1=O ZINC001174537591 976822156 /nfs/dbraw/zinc/82/21/56/976822156.db2.gz MCPMXVRRPUBZCW-UHFFFAOYSA-N 1 2 235.674 2.310 20 0 BEADLO CC[NH+]1CC(Oc2ncnc3cccc(C)c32)C1 ZINC001229394232 976854246 /nfs/dbraw/zinc/85/42/46/976854246.db2.gz NISDHSMNDFMUAF-UHFFFAOYSA-N 1 2 243.310 2.021 20 0 BEADLO Cc1ccc2ccnc(OC3C[NH+](C)C3)c2c1 ZINC001229513477 976889194 /nfs/dbraw/zinc/88/91/94/976889194.db2.gz YFCSACAIHLRZPZ-UHFFFAOYSA-N 1 2 228.295 2.236 20 0 BEADLO Cc1cc(Nc2cccc3[nH+]c(C)cn32)n(C)n1 ZINC001174820724 977071545 /nfs/dbraw/zinc/07/15/45/977071545.db2.gz BGBSEDCEJIPHNS-UHFFFAOYSA-N 1 2 241.298 2.428 20 0 BEADLO CC[NH+]1CC(Oc2cnc3ccc(F)cc3c2)C1 ZINC001230591403 977262033 /nfs/dbraw/zinc/26/20/33/977262033.db2.gz WCTPYBHZPKDRBI-UHFFFAOYSA-N 1 2 246.285 2.457 20 0 BEADLO Cc1cn2c(cccc2Nc2ccncc2F)[nH+]1 ZINC001175197258 977294271 /nfs/dbraw/zinc/29/42/71/977294271.db2.gz QWMCVIVSRTVMPK-UHFFFAOYSA-N 1 2 242.257 2.342 20 0 BEADLO COc1cc(Nc2ccncc2F)[nH+]cc1C ZINC001175197778 977296246 /nfs/dbraw/zinc/29/62/46/977296246.db2.gz DPQWADHPPFQIFZ-UHFFFAOYSA-N 1 2 233.246 2.098 20 0 BEADLO CCCCCC(=O)N(C)C[C@H]1CC[N@@H+]1CCF ZINC001230775497 977329580 /nfs/dbraw/zinc/32/95/80/977329580.db2.gz IKVHNLORUZJNTN-GFCCVEGCSA-N 1 2 244.354 2.069 20 0 BEADLO CCCCCC(=O)N(C)C[C@H]1CC[N@H+]1CCF ZINC001230775497 977329593 /nfs/dbraw/zinc/32/95/93/977329593.db2.gz IKVHNLORUZJNTN-GFCCVEGCSA-N 1 2 244.354 2.069 20 0 BEADLO CN(C)c1ccc(Nc2ccnnc2Cl)c[nH+]1 ZINC001175341569 977364843 /nfs/dbraw/zinc/36/48/43/977364843.db2.gz UYPLAYDVYZPRDD-UHFFFAOYSA-N 1 2 249.705 2.335 20 0 BEADLO CO[C@@H](C)CCOc1cc2c(cc1O)C=[NH+]CC2 ZINC001230918910 977380570 /nfs/dbraw/zinc/38/05/70/977380570.db2.gz BDJLBRBAHSIVRP-JTQLQIEISA-N 1 2 249.310 2.171 20 0 BEADLO CC(C)OCCOc1cc2c(cc1O)C=[NH+]CC2 ZINC001230920353 977382793 /nfs/dbraw/zinc/38/27/93/977382793.db2.gz MQUTUHFIFNNJRE-UHFFFAOYSA-N 1 2 249.310 2.171 20 0 BEADLO CCn1nccc1Nc1ccc(N(C)C)[nH+]c1 ZINC001175337318 977383864 /nfs/dbraw/zinc/38/38/64/977383864.db2.gz DRUZKVLAAGQZOD-UHFFFAOYSA-N 1 2 231.303 2.108 20 0 BEADLO CN(C)c1ccc(Nc2ncc(F)s2)c[nH+]1 ZINC001175339067 977386268 /nfs/dbraw/zinc/38/62/68/977386268.db2.gz VQDKUWFBLIHCBB-UHFFFAOYSA-N 1 2 238.291 2.487 20 0 BEADLO CN(C)c1ccc(Nc2ccc(F)nc2)c[nH+]1 ZINC001175338504 977388747 /nfs/dbraw/zinc/38/87/47/977388747.db2.gz GLQFQSZINXOBFW-UHFFFAOYSA-N 1 2 232.262 2.425 20 0 BEADLO CC(=O)[C@H](C)Oc1ccc(-c2c[nH+]cn2C)cc1 ZINC001231078855 977461461 /nfs/dbraw/zinc/46/14/61/977461461.db2.gz FSDRHGMRMHBDIK-NSHDSACASA-N 1 2 244.294 2.443 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(OC[C@H]2CCO2)cc1 ZINC001231079121 977461943 /nfs/dbraw/zinc/46/19/43/977461943.db2.gz HAWOICJNIKKYFG-CYBMUJFWSA-N 1 2 244.294 2.255 20 0 BEADLO COc1cc[nH+]cc1Nc1cccc(CO)c1 ZINC001175509200 977487204 /nfs/dbraw/zinc/48/72/04/977487204.db2.gz BUOQEUSEBHRYNC-UHFFFAOYSA-N 1 2 230.267 2.326 20 0 BEADLO CCOc1ncc(Nc2cc(OC)cc[nH+]2)cn1 ZINC001175553982 977535803 /nfs/dbraw/zinc/53/58/03/977535803.db2.gz QJYVOJAFYWYZOT-UHFFFAOYSA-N 1 2 246.270 2.023 20 0 BEADLO CCC[C@@H]1CCCN1C(=O)CCCn1cc[nH+]c1 ZINC001336162598 977550785 /nfs/dbraw/zinc/55/07/85/977550785.db2.gz IXHHRNMEQKDQLL-CYBMUJFWSA-N 1 2 249.358 2.454 20 0 BEADLO CC[NH+]1CC(Oc2ccc(N=O)cc2)C1 ZINC001231291031 977557514 /nfs/dbraw/zinc/55/75/14/977557514.db2.gz DVEDXNJXPZOEOD-UHFFFAOYSA-N 1 2 206.245 2.167 20 0 BEADLO CCOc1ccc(C[N@@H+]2CC[C@H](F)C2)cn1 ZINC001231649746 977664207 /nfs/dbraw/zinc/66/42/07/977664207.db2.gz SDKCHXOJPPHROX-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO CCOc1ccc(C[N@H+]2CC[C@H](F)C2)cn1 ZINC001231649746 977664220 /nfs/dbraw/zinc/66/42/20/977664220.db2.gz SDKCHXOJPPHROX-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO CCc1ccc(N2CCC[C@](C)(CO)C2)[nH+]c1 ZINC001336574739 977788844 /nfs/dbraw/zinc/78/88/44/977788844.db2.gz KYDJOASBYSVYTN-AWEZNQCLSA-N 1 2 234.343 2.243 20 0 BEADLO Cc1cc(F)ncc1C[N@H+]1C[C@H](F)C[C@H]1C ZINC001231980128 977822830 /nfs/dbraw/zinc/82/28/30/977822830.db2.gz REZZBEHBHHWOKD-MWLCHTKSSA-N 1 2 226.270 2.461 20 0 BEADLO Cc1cc(F)ncc1C[N@@H+]1C[C@H](F)C[C@H]1C ZINC001231980128 977822836 /nfs/dbraw/zinc/82/28/36/977822836.db2.gz REZZBEHBHHWOKD-MWLCHTKSSA-N 1 2 226.270 2.461 20 0 BEADLO Cc1cc(F)cc(N2CC[C@H](n3cccn3)C2)[nH+]1 ZINC001336635609 977824527 /nfs/dbraw/zinc/82/45/27/977824527.db2.gz AWYFVCAETBRDAV-LBPRGKRZSA-N 1 2 246.289 2.177 20 0 BEADLO CC[C@]1(O)CCCN(c2cc(F)cc(C)[nH+]2)C1 ZINC001336705328 977869038 /nfs/dbraw/zinc/86/90/38/977869038.db2.gz GZNXICHSXXGQAY-ZDUSSCGKSA-N 1 2 238.306 2.270 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC(=O)C(C)(C)C2)c(C)n1 ZINC001232085370 977884357 /nfs/dbraw/zinc/88/43/57/977884357.db2.gz SZDFFJFEDCQVHX-UHFFFAOYSA-N 1 2 246.354 2.499 20 0 BEADLO Cc1ccc(C[N@H+]2CCC(=O)C(C)(C)C2)c(C)n1 ZINC001232085370 977884360 /nfs/dbraw/zinc/88/43/60/977884360.db2.gz SZDFFJFEDCQVHX-UHFFFAOYSA-N 1 2 246.354 2.499 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ccncn2)c(C)n1 ZINC001232082766 977884975 /nfs/dbraw/zinc/88/49/75/977884975.db2.gz IGQIBKVZCBBNDS-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ccncn2)c(C)n1 ZINC001232082766 977884979 /nfs/dbraw/zinc/88/49/79/977884979.db2.gz IGQIBKVZCBBNDS-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccc(C[N@@H+]2CCCC(=O)CC2)c(C)n1 ZINC001232080371 977886819 /nfs/dbraw/zinc/88/68/19/977886819.db2.gz BUPMLSBJNYUCSR-UHFFFAOYSA-N 1 2 232.327 2.253 20 0 BEADLO Cc1ccc(C[N@H+]2CCCC(=O)CC2)c(C)n1 ZINC001232080371 977886820 /nfs/dbraw/zinc/88/68/20/977886820.db2.gz BUPMLSBJNYUCSR-UHFFFAOYSA-N 1 2 232.327 2.253 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc3ccncc3[nH]2)C[C@H](C)O1 ZINC001232089106 977890008 /nfs/dbraw/zinc/89/00/08/977890008.db2.gz QIJRKUMTSJTTJB-PHIMTYICSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc3ccncc3[nH]2)C[C@H](C)O1 ZINC001232089106 977890011 /nfs/dbraw/zinc/89/00/11/977890011.db2.gz QIJRKUMTSJTTJB-PHIMTYICSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1CC[N@@H+]1Cc1cn(C)nc1C(F)(F)F ZINC001232086433 977890867 /nfs/dbraw/zinc/89/08/67/977890867.db2.gz QOTMPTPGKHWUGQ-SSDOTTSWSA-N 1 2 233.237 2.033 20 0 BEADLO C[C@@H]1CC[N@H+]1Cc1cn(C)nc1C(F)(F)F ZINC001232086433 977890870 /nfs/dbraw/zinc/89/08/70/977890870.db2.gz QOTMPTPGKHWUGQ-SSDOTTSWSA-N 1 2 233.237 2.033 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1cc2ccncc2[nH]1 ZINC001232095356 977894136 /nfs/dbraw/zinc/89/41/36/977894136.db2.gz FHMOIRJIEXAORJ-CYBMUJFWSA-N 1 2 245.326 2.174 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1cc2ccncc2[nH]1 ZINC001232095356 977894138 /nfs/dbraw/zinc/89/41/38/977894138.db2.gz FHMOIRJIEXAORJ-CYBMUJFWSA-N 1 2 245.326 2.174 20 0 BEADLO Cc1scnc1C[NH+]1CC2(C1)CCOCC2 ZINC001232204160 977928000 /nfs/dbraw/zinc/92/80/00/977928000.db2.gz UHMIVRYTHWJBQS-UHFFFAOYSA-N 1 2 238.356 2.064 20 0 BEADLO CC(=O)[C@H]1CCC[N@H+](Cc2ncsc2C)C1 ZINC001232207245 977932074 /nfs/dbraw/zinc/93/20/74/977932074.db2.gz VZRYOOKEZHKXAK-NSHDSACASA-N 1 2 238.356 2.253 20 0 BEADLO CC(=O)[C@H]1CCC[N@@H+](Cc2ncsc2C)C1 ZINC001232207245 977932091 /nfs/dbraw/zinc/93/20/91/977932091.db2.gz VZRYOOKEZHKXAK-NSHDSACASA-N 1 2 238.356 2.253 20 0 BEADLO CCn1nccc1Nc1c[nH+]ccc1OC ZINC001176118752 977943837 /nfs/dbraw/zinc/94/38/37/977943837.db2.gz GLKSITKKEJJPGH-UHFFFAOYSA-N 1 2 218.260 2.050 20 0 BEADLO CCOc1nccnc1Nc1c[nH+]ccc1OC ZINC001176116343 977945906 /nfs/dbraw/zinc/94/59/06/977945906.db2.gz AHKJJDINOWVGSG-UHFFFAOYSA-N 1 2 246.270 2.023 20 0 BEADLO COc1cc[nH+]cc1Nc1ncc(C)nc1C ZINC001176118351 977945942 /nfs/dbraw/zinc/94/59/42/977945942.db2.gz JBUPBZNQASRMLZ-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO COc1cc[nH+]cc1Nc1cccnc1F ZINC001176116340 977947327 /nfs/dbraw/zinc/94/73/27/977947327.db2.gz AFQKHEQLCDGZBR-UHFFFAOYSA-N 1 2 219.219 2.368 20 0 BEADLO CCOc1cnc(Nc2c[nH+]ccc2OC)cn1 ZINC001176118680 977948841 /nfs/dbraw/zinc/94/88/41/977948841.db2.gz PAZXOECXQYCLAT-UHFFFAOYSA-N 1 2 246.270 2.023 20 0 BEADLO COc1cc[nH+]cc1Nc1cccc(C(C)=O)n1 ZINC001176121000 977951856 /nfs/dbraw/zinc/95/18/56/977951856.db2.gz DHXLWDAKIIPHAZ-UHFFFAOYSA-N 1 2 243.266 2.431 20 0 BEADLO COc1cc[nH+]cc1Nc1cc(N)ccc1OC ZINC001176123226 977959243 /nfs/dbraw/zinc/95/92/43/977959243.db2.gz RABKHBQPGVSGJF-UHFFFAOYSA-N 1 2 245.282 2.425 20 0 BEADLO C[C@@H]1CN(c2cccc[nH+]2)[C@H](C)CCO1 ZINC001336822344 977987955 /nfs/dbraw/zinc/98/79/55/977987955.db2.gz AUHKWJVQHHHXHA-GHMZBOCLSA-N 1 2 206.289 2.085 20 0 BEADLO CSc1ccc(C[N@H+](C)Cc2ccno2)cn1 ZINC001232329669 978005417 /nfs/dbraw/zinc/00/54/17/978005417.db2.gz AOQSURFRWAFNSN-UHFFFAOYSA-N 1 2 249.339 2.424 20 0 BEADLO CSc1ccc(C[N@@H+](C)Cc2ccno2)cn1 ZINC001232329669 978005426 /nfs/dbraw/zinc/00/54/26/978005426.db2.gz AOQSURFRWAFNSN-UHFFFAOYSA-N 1 2 249.339 2.424 20 0 BEADLO COc1cc(C)c(C[NH+]2CC(C(F)F)C2)cn1 ZINC001232355311 978035230 /nfs/dbraw/zinc/03/52/30/978035230.db2.gz NHPMRDRBNARSKJ-UHFFFAOYSA-N 1 2 242.269 2.096 20 0 BEADLO COc1cc[nH+]cc1Nc1ccc2nonc2c1 ZINC001176320352 978036069 /nfs/dbraw/zinc/03/60/69/978036069.db2.gz CDQPHDPFBRXPRM-UHFFFAOYSA-N 1 2 242.238 2.370 20 0 BEADLO COc1cc(Nc2cnc(C)nc2)cc(C)[nH+]1 ZINC001176392868 978044699 /nfs/dbraw/zinc/04/46/99/978044699.db2.gz AXZIYDPFOUAXSQ-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO CC[N@H+](Cc1cc(F)c(C)c(F)c1)C1COC1 ZINC001232424450 978060357 /nfs/dbraw/zinc/06/03/57/978060357.db2.gz MUBADEQQSLCACH-UHFFFAOYSA-N 1 2 241.281 2.494 20 0 BEADLO CC[N@@H+](Cc1cc(F)c(C)c(F)c1)C1COC1 ZINC001232424450 978060365 /nfs/dbraw/zinc/06/03/65/978060365.db2.gz MUBADEQQSLCACH-UHFFFAOYSA-N 1 2 241.281 2.494 20 0 BEADLO CCOc1cc[nH+]cc1Nc1cnc(C)nc1 ZINC001176394368 978069339 /nfs/dbraw/zinc/06/93/39/978069339.db2.gz UXLTXVLTPFOLNT-UHFFFAOYSA-N 1 2 230.271 2.322 20 0 BEADLO Cc1[nH]c(CNc2nc(C3CC3)ns2)[nH+]c1C ZINC001336933988 978071239 /nfs/dbraw/zinc/07/12/39/978071239.db2.gz MSVVZKXCWJPKJO-UHFFFAOYSA-N 1 2 249.343 2.368 20 0 BEADLO COc1ccccc1CN(C)Cc1c[nH+]c(C)[nH]1 ZINC001232462050 978092525 /nfs/dbraw/zinc/09/25/25/978092525.db2.gz IMKUVKKFKRXYEA-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO Cc1[nH]c(CN(C)Cc2ccccc2F)c[nH+]1 ZINC001232462806 978098267 /nfs/dbraw/zinc/09/82/67/978098267.db2.gz UDKXWBYLYCFODH-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1[nH]cc(CN(C)Cc2ccccc2F)[nH+]1 ZINC001232462806 978098273 /nfs/dbraw/zinc/09/82/73/978098273.db2.gz UDKXWBYLYCFODH-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1[nH]c(CN2Cc3ccc(F)cc3C2)c[nH+]1 ZINC001232463243 978106416 /nfs/dbraw/zinc/10/64/16/978106416.db2.gz FPYIUFIQBBHTEL-UHFFFAOYSA-N 1 2 231.274 2.373 20 0 BEADLO Cc1[nH]cc(CN2Cc3ccc(F)cc3C2)[nH+]1 ZINC001232463243 978106424 /nfs/dbraw/zinc/10/64/24/978106424.db2.gz FPYIUFIQBBHTEL-UHFFFAOYSA-N 1 2 231.274 2.373 20 0 BEADLO C[C@H]1C[C@@H](CF)[N@H+](Cc2cc(F)ccn2)C1 ZINC001232489978 978139637 /nfs/dbraw/zinc/13/96/37/978139637.db2.gz DLVBTHTYWVPFPQ-CABZTGNLSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@H]1C[C@@H](CF)[N@@H+](Cc2cc(F)ccn2)C1 ZINC001232489978 978139641 /nfs/dbraw/zinc/13/96/41/978139641.db2.gz DLVBTHTYWVPFPQ-CABZTGNLSA-N 1 2 226.270 2.401 20 0 BEADLO Cc1cccc(F)c1C[N@@H+]1CCN(C)[C@H](C)C1 ZINC001232485314 978141002 /nfs/dbraw/zinc/14/10/02/978141002.db2.gz UFXZRIJVKPJALM-GFCCVEGCSA-N 1 2 236.334 2.270 20 0 BEADLO Cc1cccc(F)c1C[N@H+]1CCN(C)[C@H](C)C1 ZINC001232485314 978141010 /nfs/dbraw/zinc/14/10/10/978141010.db2.gz UFXZRIJVKPJALM-GFCCVEGCSA-N 1 2 236.334 2.270 20 0 BEADLO Cc1cc(F)cc(N2CCOC3(CCC3)C2)[nH+]1 ZINC001337092972 978160142 /nfs/dbraw/zinc/16/01/42/978160142.db2.gz VVOHIQWGCBJVAA-UHFFFAOYSA-N 1 2 236.290 2.288 20 0 BEADLO c1nocc1Nc1ccc[nH+]c1N1CCCC1 ZINC001176750359 978169054 /nfs/dbraw/zinc/16/90/54/978169054.db2.gz QBCDIWSEUAYXGN-UHFFFAOYSA-N 1 2 230.271 2.413 20 0 BEADLO c1cnc(Nc2ccc[nH+]c2N2CCCC2)nc1 ZINC001176743568 978170627 /nfs/dbraw/zinc/17/06/27/978170627.db2.gz QBWKDASFLHMCGK-UHFFFAOYSA-N 1 2 241.298 2.215 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@H](C(C)=O)C2)cc1 ZINC001204179110 978230275 /nfs/dbraw/zinc/23/02/75/978230275.db2.gz IZKUILPHJHGLNA-HNNXBMFYSA-N 1 2 247.338 2.039 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@H](C(C)=O)C2)cc1 ZINC001204179110 978230283 /nfs/dbraw/zinc/23/02/83/978230283.db2.gz IZKUILPHJHGLNA-HNNXBMFYSA-N 1 2 247.338 2.039 20 0 BEADLO Cc1cc(F)cc(N2CCS[C@H](C)C2)[nH+]1 ZINC001337239146 978234441 /nfs/dbraw/zinc/23/44/41/978234441.db2.gz IEEDWBMUPJAALI-SECBINFHSA-N 1 2 226.320 2.471 20 0 BEADLO C[C@H]1CCC(F)(F)C[N@@H+]1CC1(C)COC1 ZINC001176891852 978234320 /nfs/dbraw/zinc/23/43/20/978234320.db2.gz NNPRRRNGMCVVGM-VIFPVBQESA-N 1 2 219.275 2.143 20 0 BEADLO C[C@H]1CCC(F)(F)C[N@H+]1CC1(C)COC1 ZINC001176891852 978234332 /nfs/dbraw/zinc/23/43/32/978234332.db2.gz NNPRRRNGMCVVGM-VIFPVBQESA-N 1 2 219.275 2.143 20 0 BEADLO CC(C)[C@H](O)C[N@@H+]1CC(F)(F)CC[C@@H]1C ZINC001176897777 978251665 /nfs/dbraw/zinc/25/16/65/978251665.db2.gz OIPBCMUHACOLOJ-VHSXEESVSA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)[C@H](O)C[N@H+]1CC(F)(F)CC[C@@H]1C ZINC001176897777 978251677 /nfs/dbraw/zinc/25/16/77/978251677.db2.gz OIPBCMUHACOLOJ-VHSXEESVSA-N 1 2 221.291 2.123 20 0 BEADLO COc1cc(O)cc(C[N@@H+]2CCC[C@H](F)C2)c1 ZINC001232804360 978300435 /nfs/dbraw/zinc/30/04/35/978300435.db2.gz XQQBELZEJIICMN-NSHDSACASA-N 1 2 239.290 2.335 20 0 BEADLO COc1cc(O)cc(C[N@H+]2CCC[C@H](F)C2)c1 ZINC001232804360 978300445 /nfs/dbraw/zinc/30/04/45/978300445.db2.gz XQQBELZEJIICMN-NSHDSACASA-N 1 2 239.290 2.335 20 0 BEADLO Cc1cc(O)cc(C[N@@H+]2CCCC(=O)CC2)c1 ZINC001232877845 978316305 /nfs/dbraw/zinc/31/63/05/978316305.db2.gz CPQWASPTJUDMOH-UHFFFAOYSA-N 1 2 233.311 2.256 20 0 BEADLO Cc1cc(O)cc(C[N@H+]2CCCC(=O)CC2)c1 ZINC001232877845 978316313 /nfs/dbraw/zinc/31/63/13/978316313.db2.gz CPQWASPTJUDMOH-UHFFFAOYSA-N 1 2 233.311 2.256 20 0 BEADLO Cc1cc(O)cc(C[N@@H+]2CCC(=O)[C@@H](C)C2)c1 ZINC001232880753 978320576 /nfs/dbraw/zinc/32/05/76/978320576.db2.gz RXFPUSOIEQXNOF-NSHDSACASA-N 1 2 233.311 2.112 20 0 BEADLO Cc1cc(O)cc(C[N@H+]2CCC(=O)[C@@H](C)C2)c1 ZINC001232880753 978320579 /nfs/dbraw/zinc/32/05/79/978320579.db2.gz RXFPUSOIEQXNOF-NSHDSACASA-N 1 2 233.311 2.112 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC[C@@H]1CCC[C@H](C)C1 ZINC001597575090 978344466 /nfs/dbraw/zinc/34/44/66/978344466.db2.gz QBARJWPQZUCEAN-CMPLNLGQSA-N 1 2 249.358 2.203 20 0 BEADLO C[C@@H]1CCCN(C(=O)CCNc2cccc[nH+]2)C1 ZINC001337474615 978358469 /nfs/dbraw/zinc/35/84/69/978358469.db2.gz HKTXKOCIDIWLQG-GFCCVEGCSA-N 1 2 247.342 2.142 20 0 BEADLO CC(C)OC1C[NH+](Cc2ccc3ncoc3c2)C1 ZINC001232944640 978358246 /nfs/dbraw/zinc/35/82/46/978358246.db2.gz WYSNHBXPOSDOHH-UHFFFAOYSA-N 1 2 246.310 2.437 20 0 BEADLO Oc1cc(C[N@@H+]2C[C@@H]3C[C@@H]3C2)cc(F)c1F ZINC001232970104 978376282 /nfs/dbraw/zinc/37/62/82/978376282.db2.gz HIZGEGPTQZZMBH-DTORHVGOSA-N 1 2 225.238 2.122 20 0 BEADLO Oc1cc(C[N@H+]2C[C@@H]3C[C@@H]3C2)cc(F)c1F ZINC001232970104 978376292 /nfs/dbraw/zinc/37/62/92/978376292.db2.gz HIZGEGPTQZZMBH-DTORHVGOSA-N 1 2 225.238 2.122 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H]1CC=CCC1 ZINC001337639384 978439096 /nfs/dbraw/zinc/43/90/96/978439096.db2.gz JEXZXAQBRDJWAP-LBPRGKRZSA-N 1 2 230.311 2.415 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1cccc(O)c1F ZINC001233050210 978441080 /nfs/dbraw/zinc/44/10/80/978441080.db2.gz MOQXPXRJAWYMFH-SCZZXKLOSA-N 1 2 227.254 2.464 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1cccc(O)c1F ZINC001233050210 978441087 /nfs/dbraw/zinc/44/10/87/978441087.db2.gz MOQXPXRJAWYMFH-SCZZXKLOSA-N 1 2 227.254 2.464 20 0 BEADLO C[C@H]1CCC[C@H](C)[NH+]1Cc1nc2ccccn2n1 ZINC001233068493 978453159 /nfs/dbraw/zinc/45/31/59/978453159.db2.gz WTHNUPRTRPGDIS-RYUDHWBXSA-N 1 2 244.342 2.492 20 0 BEADLO CCCCC[N@H+](C)Cc1nc2ccccn2n1 ZINC001233067960 978453354 /nfs/dbraw/zinc/45/33/54/978453354.db2.gz IAHHUIBDHKGSHE-UHFFFAOYSA-N 1 2 232.331 2.351 20 0 BEADLO CCCCC[N@@H+](C)Cc1nc2ccccn2n1 ZINC001233067960 978453362 /nfs/dbraw/zinc/45/33/62/978453362.db2.gz IAHHUIBDHKGSHE-UHFFFAOYSA-N 1 2 232.331 2.351 20 0 BEADLO CC[C@H]1CCCC[N@@H+]1Cc1nc2ccccn2n1 ZINC001233072983 978457369 /nfs/dbraw/zinc/45/73/69/978457369.db2.gz MBDQEQVJXAGMED-LBPRGKRZSA-N 1 2 244.342 2.494 20 0 BEADLO CC[C@H]1CCCC[N@H+]1Cc1nc2ccccn2n1 ZINC001233072983 978457381 /nfs/dbraw/zinc/45/73/81/978457381.db2.gz MBDQEQVJXAGMED-LBPRGKRZSA-N 1 2 244.342 2.494 20 0 BEADLO CC[C@H]1CCC[N@H+](Cc2nc3ccccn3n2)C1 ZINC001233073325 978457972 /nfs/dbraw/zinc/45/79/72/978457972.db2.gz SAXFRQRPEMDXEO-LBPRGKRZSA-N 1 2 244.342 2.351 20 0 BEADLO CC[C@H]1CCC[N@@H+](Cc2nc3ccccn3n2)C1 ZINC001233073325 978457979 /nfs/dbraw/zinc/45/79/79/978457979.db2.gz SAXFRQRPEMDXEO-LBPRGKRZSA-N 1 2 244.342 2.351 20 0 BEADLO C[C@H]1C[N@H+](Cc2nc3ccccn3n2)C2(CC2)C1 ZINC001233075148 978458705 /nfs/dbraw/zinc/45/87/05/978458705.db2.gz WKZNPFATPTZNFB-LLVKDONJSA-N 1 2 242.326 2.104 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nc3ccccn3n2)C2(CC2)C1 ZINC001233075148 978458716 /nfs/dbraw/zinc/45/87/16/978458716.db2.gz WKZNPFATPTZNFB-LLVKDONJSA-N 1 2 242.326 2.104 20 0 BEADLO C[N@H+](Cc1nc2ccccn2n1)CC(C)(C)C ZINC001233070415 978458783 /nfs/dbraw/zinc/45/87/83/978458783.db2.gz NZJWLHLZDRMBGT-UHFFFAOYSA-N 1 2 232.331 2.207 20 0 BEADLO C[N@@H+](Cc1nc2ccccn2n1)CC(C)(C)C ZINC001233070415 978458789 /nfs/dbraw/zinc/45/87/89/978458789.db2.gz NZJWLHLZDRMBGT-UHFFFAOYSA-N 1 2 232.331 2.207 20 0 BEADLO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1nc2ccccn2n1 ZINC001233070191 978461552 /nfs/dbraw/zinc/46/15/52/978461552.db2.gz LTDBLIPCPDTFAU-NWDGAFQWSA-N 1 2 244.342 2.350 20 0 BEADLO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1nc2ccccn2n1 ZINC001233070191 978461559 /nfs/dbraw/zinc/46/15/59/978461559.db2.gz LTDBLIPCPDTFAU-NWDGAFQWSA-N 1 2 244.342 2.350 20 0 BEADLO CC(C)n1cc([C@@H](C)Nc2cc(N)nc[nH+]2)cn1 ZINC001337772543 978489948 /nfs/dbraw/zinc/48/99/48/978489948.db2.gz ZBLKCWIWFHLOAN-SECBINFHSA-N 1 2 246.318 2.009 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3cccnc3C2)sn1 ZINC001233312681 978539835 /nfs/dbraw/zinc/53/98/35/978539835.db2.gz FKNVYMWSMOVNNS-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cc(C[N@H+]2CCc3cccnc3C2)sn1 ZINC001233312681 978539841 /nfs/dbraw/zinc/53/98/41/978539841.db2.gz FKNVYMWSMOVNNS-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO CS[C@@H]1CCN(c2cc(F)cc(C)[nH+]2)C1 ZINC001337896649 978554179 /nfs/dbraw/zinc/55/41/79/978554179.db2.gz ZCWMXBUPQITDFK-SNVBAGLBSA-N 1 2 226.320 2.471 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@@H](CO)[C@@H]2C)[nH+]1 ZINC001337909543 978558571 /nfs/dbraw/zinc/55/85/71/978558571.db2.gz IIHUIOLGTDSXLT-QWRGUYRKSA-N 1 2 238.306 2.126 20 0 BEADLO CC(=O)[C@@H]1CCC[N@@H+]1Cc1sncc1C ZINC001233323506 978563917 /nfs/dbraw/zinc/56/39/17/978563917.db2.gz WZZCKXCBEZBIAV-JTQLQIEISA-N 1 2 224.329 2.005 20 0 BEADLO CC(=O)[C@@H]1CCC[N@H+]1Cc1sncc1C ZINC001233323506 978563927 /nfs/dbraw/zinc/56/39/27/978563927.db2.gz WZZCKXCBEZBIAV-JTQLQIEISA-N 1 2 224.329 2.005 20 0 BEADLO COc1cc(F)c(C[NH+]2CCC2)cc1F ZINC001233340748 978569128 /nfs/dbraw/zinc/56/91/28/978569128.db2.gz PRMQQDYPZPXXLE-UHFFFAOYSA-N 1 2 213.227 2.179 20 0 BEADLO CC1(C)C[NH+](Cc2cc(F)c(F)cc2N)C1 ZINC001233378420 978591819 /nfs/dbraw/zinc/59/18/19/978591819.db2.gz RTNRFBJCLOYZME-UHFFFAOYSA-N 1 2 226.270 2.389 20 0 BEADLO OC1C[NH+](Cc2ccc3nc(Cl)ccc3c2)C1 ZINC001233442476 978602139 /nfs/dbraw/zinc/60/21/39/978602139.db2.gz VAPBYZYYEGNGLS-UHFFFAOYSA-N 1 2 248.713 2.065 20 0 BEADLO CCc1ccc(N2C[C@H](O)CC(C)(C)C2)[nH+]c1 ZINC001338063723 978602653 /nfs/dbraw/zinc/60/26/53/978602653.db2.gz LSIPKMBJHVHQIV-GFCCVEGCSA-N 1 2 234.343 2.241 20 0 BEADLO CN1CCOc2cc(CC(C)(C)C)c[nH+]c21 ZINC001249926795 978686880 /nfs/dbraw/zinc/68/68/80/978686880.db2.gz FISNTFBPDQRJME-UHFFFAOYSA-N 1 2 220.316 2.499 20 0 BEADLO C[NH+]1CC(Oc2ccc(F)cc2-c2ccno2)C1 ZINC001233808128 978701443 /nfs/dbraw/zinc/70/14/43/978701443.db2.gz RMAHZEXTJSATSK-UHFFFAOYSA-N 1 2 248.257 2.174 20 0 BEADLO Cc1c(F)ccc(OC2C[NH+](C)C2)c1C ZINC001233863062 978717152 /nfs/dbraw/zinc/71/71/52/978717152.db2.gz ILLHIWWCYWMCBZ-UHFFFAOYSA-N 1 2 209.264 2.135 20 0 BEADLO COc1cc(C)c(OC2C[NH+](C)C2)c(C)c1 ZINC001234276022 978809347 /nfs/dbraw/zinc/80/93/47/978809347.db2.gz YPMCREQYTGEFPI-UHFFFAOYSA-N 1 2 221.300 2.005 20 0 BEADLO CC(C)[C@H]1CCCCN1C(=O)[C@H](C)n1cc[nH+]c1 ZINC001339187446 978814036 /nfs/dbraw/zinc/81/40/36/978814036.db2.gz DYWPFKBMEZMAAR-QWHCGFSZSA-N 1 2 249.358 2.481 20 0 BEADLO CCOC(=[NH2+])c1ccc(OC2CC(=O)C2)cc1 ZINC001234588285 978864194 /nfs/dbraw/zinc/86/41/94/978864194.db2.gz KLYVVLHUIGIUPB-UHFFFAOYSA-N 1 2 233.267 2.159 20 0 BEADLO CCOC(=[NH2+])c1ccc(O[C@@H]2CCOC2)cc1 ZINC001234586500 978865627 /nfs/dbraw/zinc/86/56/27/978865627.db2.gz WBUPHRQNNLXFPD-GFCCVEGCSA-N 1 2 235.283 2.216 20 0 BEADLO Cc1[nH]c(CN2CC3(CCC3)C2)c(C)[nH+]1 ZINC001234601608 978870230 /nfs/dbraw/zinc/87/02/30/978870230.db2.gz ROWMOCYTCIUFEX-UHFFFAOYSA-N 1 2 205.305 2.012 20 0 BEADLO c1nc(N2CCC[C@H]2C2CC2)cc(NC2CC2)[nH+]1 ZINC001339573665 978874254 /nfs/dbraw/zinc/87/42/54/978874254.db2.gz CFLKEKJBSYOUEY-LBPRGKRZSA-N 1 2 244.342 2.430 20 0 BEADLO c1nc(NC2CC2)cc(N2CCC[C@H]2C2CC2)[nH+]1 ZINC001339573665 978874257 /nfs/dbraw/zinc/87/42/57/978874257.db2.gz CFLKEKJBSYOUEY-LBPRGKRZSA-N 1 2 244.342 2.430 20 0 BEADLO CCc1ccc(N(C)[C@@H](CO)CC(C)C)[nH+]c1 ZINC001339667863 978891497 /nfs/dbraw/zinc/89/14/97/978891497.db2.gz TZXOIPGDCFBBSU-CYBMUJFWSA-N 1 2 236.359 2.487 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@H](CO)CC2)[nH+]1 ZINC001339731263 978901410 /nfs/dbraw/zinc/90/14/10/978901410.db2.gz XLKSLMKFHUSUDU-NSHDSACASA-N 1 2 238.306 2.128 20 0 BEADLO CC1(C)CC[NH+](Cc2ncc(F)cn2)CC1 ZINC001235003986 978949111 /nfs/dbraw/zinc/94/91/11/978949111.db2.gz LNILPKMFMJGXPB-UHFFFAOYSA-N 1 2 223.295 2.238 20 0 BEADLO CC1CCC(C)(NC(=O)C[C@H]([NH3+])C(F)F)CC1 ZINC001340029664 978959009 /nfs/dbraw/zinc/95/90/09/978959009.db2.gz MZVVQURYUJLHJT-XEVUQIKYSA-N 1 2 248.317 2.054 20 0 BEADLO CCc1cccc(C[N@H+]2CCC(=O)[C@H](C)CC2)n1 ZINC001235252713 979007904 /nfs/dbraw/zinc/00/79/04/979007904.db2.gz FZZBTKRDHHTCSQ-GFCCVEGCSA-N 1 2 246.354 2.445 20 0 BEADLO CCc1cccc(C[N@@H+]2CCC(=O)[C@H](C)CC2)n1 ZINC001235252713 979007913 /nfs/dbraw/zinc/00/79/13/979007913.db2.gz FZZBTKRDHHTCSQ-GFCCVEGCSA-N 1 2 246.354 2.445 20 0 BEADLO CCc1cccc(C[N@@H+]2CCCC23COC3)n1 ZINC001235257049 979011623 /nfs/dbraw/zinc/01/16/23/979011623.db2.gz INERRVRLWBLICD-UHFFFAOYSA-N 1 2 232.327 2.009 20 0 BEADLO CCc1cccc(C[N@H+]2CCCC23COC3)n1 ZINC001235257049 979011627 /nfs/dbraw/zinc/01/16/27/979011627.db2.gz INERRVRLWBLICD-UHFFFAOYSA-N 1 2 232.327 2.009 20 0 BEADLO CC[C@H](C)C[C@H](C)NC(=O)Cc1cc[nH+]c(N)c1 ZINC001181265713 979029099 /nfs/dbraw/zinc/02/90/99/979029099.db2.gz RQPLUXJFEZDHMS-QWRGUYRKSA-N 1 2 249.358 2.147 20 0 BEADLO Cc1nscc1C(=O)Nc1c(C)c[nH+]cc1C ZINC001340810421 979116773 /nfs/dbraw/zinc/11/67/73/979116773.db2.gz JNFPIPXZIOXIRL-UHFFFAOYSA-N 1 2 247.323 2.138 20 0 BEADLO CS[C@@H]1CC[C@H]([N@H+](C)Cc2csnn2)C1 ZINC001341570438 979460342 /nfs/dbraw/zinc/46/03/42/979460342.db2.gz WQYFTEKRSDANBT-VHSXEESVSA-N 1 2 243.401 2.254 20 0 BEADLO CS[C@@H]1CC[C@H]([N@@H+](C)Cc2csnn2)C1 ZINC001341570438 979460346 /nfs/dbraw/zinc/46/03/46/979460346.db2.gz WQYFTEKRSDANBT-VHSXEESVSA-N 1 2 243.401 2.254 20 0 BEADLO Cc1cc(Cl)nc(Cl)c1C[N@H+](C)CCO ZINC001236257218 979477482 /nfs/dbraw/zinc/47/74/82/979477482.db2.gz WYNFWKIMIDEINL-UHFFFAOYSA-N 1 2 249.141 2.121 20 0 BEADLO Cc1cc(Cl)nc(Cl)c1C[N@@H+](C)CCO ZINC001236257218 979477486 /nfs/dbraw/zinc/47/74/86/979477486.db2.gz WYNFWKIMIDEINL-UHFFFAOYSA-N 1 2 249.141 2.121 20 0 BEADLO C[C@@H](c1nnc(C[NH+](C)C)o1)c1cccc(F)c1 ZINC001341627816 979497482 /nfs/dbraw/zinc/49/74/82/979497482.db2.gz PATIXIPSPHOKBG-SECBINFHSA-N 1 2 249.289 2.422 20 0 BEADLO COC(=O)c1ccc(-c2ccc(N)[nH+]c2)cc1C ZINC001236311643 979516522 /nfs/dbraw/zinc/51/65/22/979516522.db2.gz FKIKMMZYNGETAU-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO Nc1ccc(-c2cccc3c2CCN3)c[nH+]1 ZINC001236312810 979516749 /nfs/dbraw/zinc/51/67/49/979516749.db2.gz XQNPUBNXYVQTAZ-UHFFFAOYSA-N 1 2 211.268 2.299 20 0 BEADLO COC(=O)c1cc(-c2ccc(N)[nH+]c2)ccc1C ZINC001236312296 979518264 /nfs/dbraw/zinc/51/82/64/979518264.db2.gz LYJYNIXYYDJIGE-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO CC(=O)Oc1cccc(-c2ccc(N)[nH+]c2)c1 ZINC001236313289 979519642 /nfs/dbraw/zinc/51/96/42/979519642.db2.gz LLSDBQHPAJNGNZ-UHFFFAOYSA-N 1 2 228.251 2.256 20 0 BEADLO COc1ccc(C(C)=CC=C[NH3+])c2c[nH]nc21 ZINC001236463843 979604719 /nfs/dbraw/zinc/60/47/19/979604719.db2.gz OJDICDPQJPHMLK-DDEWIXKASA-N 1 2 229.283 2.447 20 0 BEADLO COc1ccc(-c2cc[nH+]c(N)c2)c2c[nH]nc21 ZINC001236463522 979604887 /nfs/dbraw/zinc/60/48/87/979604887.db2.gz GKWFLZSGJRQTCJ-UHFFFAOYSA-N 1 2 240.266 2.216 20 0 BEADLO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1nnc[nH]1 ZINC001342014050 979622914 /nfs/dbraw/zinc/62/29/14/979622914.db2.gz KKLJDHODKXKFOM-SECBINFHSA-N 1 2 234.278 2.103 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCc3ncccc3C2)o1 ZINC001236591327 979672251 /nfs/dbraw/zinc/67/22/51/979672251.db2.gz OFWQVEXTALTAIJ-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCc3ncccc3C2)o1 ZINC001236591327 979672254 /nfs/dbraw/zinc/67/22/54/979672254.db2.gz OFWQVEXTALTAIJ-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO COc1ncccc1C[N@H+](C)C1CC(F)(F)C1 ZINC001206554089 979713284 /nfs/dbraw/zinc/71/32/84/979713284.db2.gz QWNYINJQUDJNBB-UHFFFAOYSA-N 1 2 242.269 2.320 20 0 BEADLO COc1ncccc1C[N@@H+](C)C1CC(F)(F)C1 ZINC001206554089 979713295 /nfs/dbraw/zinc/71/32/95/979713295.db2.gz QWNYINJQUDJNBB-UHFFFAOYSA-N 1 2 242.269 2.320 20 0 BEADLO c1c[nH+]c(N2CCCC2)c(C[C@@H]2CCCO2)c1 ZINC001250102759 979733358 /nfs/dbraw/zinc/73/33/58/979733358.db2.gz KUKHABNLNNFNDQ-ZDUSSCGKSA-N 1 2 232.327 2.403 20 0 BEADLO CCOc1cncc(C[N@@H+]2C[C@@H](C)[C@@H](F)C2)c1 ZINC001236838540 979750672 /nfs/dbraw/zinc/75/06/72/979750672.db2.gz SDMIFIDWLYOQFB-MFKMUULPSA-N 1 2 238.306 2.270 20 0 BEADLO CCOc1cncc(C[N@H+]2C[C@@H](C)[C@@H](F)C2)c1 ZINC001236838540 979750676 /nfs/dbraw/zinc/75/06/76/979750676.db2.gz SDMIFIDWLYOQFB-MFKMUULPSA-N 1 2 238.306 2.270 20 0 BEADLO Nc1cccc(C[N@@H+]2CCC(F)(F)[C@@H](F)C2)c1 ZINC001237216614 979847963 /nfs/dbraw/zinc/84/79/63/979847963.db2.gz FXRAEXBPLZZXCJ-NSHDSACASA-N 1 2 244.260 2.448 20 0 BEADLO Nc1cccc(C[N@H+]2CCC(F)(F)[C@@H](F)C2)c1 ZINC001237216614 979847964 /nfs/dbraw/zinc/84/79/64/979847964.db2.gz FXRAEXBPLZZXCJ-NSHDSACASA-N 1 2 244.260 2.448 20 0 BEADLO COc1ccc2c(c1)n[nH]c2C[NH+]1CC(C)(C)C1 ZINC001237385662 979880655 /nfs/dbraw/zinc/88/06/55/979880655.db2.gz OHTNKBDTOLYVKU-UHFFFAOYSA-N 1 2 245.326 2.413 20 0 BEADLO C[C@@H]1C[C@@H]2C[C@@H]2C[C@@H]1C(=O)OCc1c[nH+]cn1C ZINC001342801874 979898191 /nfs/dbraw/zinc/89/81/91/979898191.db2.gz DJHAIORXLYKPLW-UZWSLXQKSA-N 1 2 248.326 2.146 20 0 BEADLO COc1c(C)cccc1C[N@@H+]1CCOC[C@@H]1C ZINC001237499819 979917265 /nfs/dbraw/zinc/91/72/65/979917265.db2.gz FXJFKQKSKUCNAW-LBPRGKRZSA-N 1 2 235.327 2.224 20 0 BEADLO COc1c(C)cccc1C[N@H+]1CCOC[C@@H]1C ZINC001237499819 979917274 /nfs/dbraw/zinc/91/72/74/979917274.db2.gz FXJFKQKSKUCNAW-LBPRGKRZSA-N 1 2 235.327 2.224 20 0 BEADLO COc1c(C)cccc1C[N@H+](C1CC1)C1COC1 ZINC001237513010 979925696 /nfs/dbraw/zinc/92/56/96/979925696.db2.gz LFZAUFXSJZZYSY-UHFFFAOYSA-N 1 2 247.338 2.367 20 0 BEADLO COc1c(C)cccc1C[N@@H+](C1CC1)C1COC1 ZINC001237513010 979925709 /nfs/dbraw/zinc/92/57/09/979925709.db2.gz LFZAUFXSJZZYSY-UHFFFAOYSA-N 1 2 247.338 2.367 20 0 BEADLO CCn1c[nH+]cc1CN1CC[C@](C)(F)[C@H](F)C1 ZINC001237587700 979942908 /nfs/dbraw/zinc/94/29/08/979942908.db2.gz HWISBLPRUYOJDX-NEPJUHHUSA-N 1 2 243.301 2.175 20 0 BEADLO CCn1cncc1C[N@H+](C)C1CC(F)(F)C1 ZINC001237588728 979951004 /nfs/dbraw/zinc/95/10/04/979951004.db2.gz UFTUREFYYVMFGA-UHFFFAOYSA-N 1 2 229.274 2.133 20 0 BEADLO CCn1cncc1C[N@@H+](C)C1CC(F)(F)C1 ZINC001237588728 979951010 /nfs/dbraw/zinc/95/10/10/979951010.db2.gz UFTUREFYYVMFGA-UHFFFAOYSA-N 1 2 229.274 2.133 20 0 BEADLO c1nnc(C[N@@H+]2CC[C@@H](C3CCCCC3)C2)[nH]1 ZINC001237601467 979959676 /nfs/dbraw/zinc/95/96/76/979959676.db2.gz IVYJCPPMIBCUEI-GFCCVEGCSA-N 1 2 234.347 2.207 20 0 BEADLO c1nnc(C[N@H+]2CC[C@@H](C3CCCCC3)C2)[nH]1 ZINC001237601467 979959678 /nfs/dbraw/zinc/95/96/78/979959678.db2.gz IVYJCPPMIBCUEI-GFCCVEGCSA-N 1 2 234.347 2.207 20 0 BEADLO Cc1coc(C[N@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)n1 ZINC001237639043 979987348 /nfs/dbraw/zinc/98/73/48/979987348.db2.gz OHNRKIMBIFOABN-AOOOYVTPSA-N 1 2 242.269 2.460 20 0 BEADLO Cc1coc(C[N@@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)n1 ZINC001237639043 979987355 /nfs/dbraw/zinc/98/73/55/979987355.db2.gz OHNRKIMBIFOABN-AOOOYVTPSA-N 1 2 242.269 2.460 20 0 BEADLO CCc1n[nH]cc1C[N@@H+]1CC[C@@](C)(F)[C@H](F)C1 ZINC001237651335 980006101 /nfs/dbraw/zinc/00/61/01/980006101.db2.gz JOFPPAIEUJXSQW-VXGBXAGGSA-N 1 2 243.301 2.244 20 0 BEADLO CCc1n[nH]cc1C[N@H+]1CC[C@@](C)(F)[C@H](F)C1 ZINC001237651335 980006108 /nfs/dbraw/zinc/00/61/08/980006108.db2.gz JOFPPAIEUJXSQW-VXGBXAGGSA-N 1 2 243.301 2.244 20 0 BEADLO COC1(C)C[NH+](Cc2nccc3c2CCCC3)C1 ZINC001343169811 980029962 /nfs/dbraw/zinc/02/99/62/980029962.db2.gz HZNRFCNINNTAET-UHFFFAOYSA-N 1 2 246.354 2.181 20 0 BEADLO Cc1cc(C[NH+]2CC(C)(O)C2)ccc1OC(C)C ZINC001237712653 980034272 /nfs/dbraw/zinc/03/42/72/980034272.db2.gz DFEUTKOFORFROO-UHFFFAOYSA-N 1 2 249.354 2.349 20 0 BEADLO CCCOC1CC[NH+](Cc2ncc(C)cn2)CC1 ZINC001237806154 980056489 /nfs/dbraw/zinc/05/64/89/980056489.db2.gz PAIKHDCLHXPIIR-UHFFFAOYSA-N 1 2 249.358 2.176 20 0 BEADLO Cc1[nH+]cc(CCC(F)(F)F)cc1N ZINC001250148595 980061243 /nfs/dbraw/zinc/06/12/43/980061243.db2.gz BKJSZKZWLONCOA-UHFFFAOYSA-N 1 2 204.195 2.467 20 0 BEADLO COc1ccoc1C[N@@H+]1C[C@H](F)C[C@H]1C ZINC001237863065 980069227 /nfs/dbraw/zinc/06/92/27/980069227.db2.gz JLHBKLLBRQKJFI-RKDXNWHRSA-N 1 2 213.252 2.221 20 0 BEADLO COc1ccoc1C[N@H+]1C[C@H](F)C[C@H]1C ZINC001237863065 980069236 /nfs/dbraw/zinc/06/92/36/980069236.db2.gz JLHBKLLBRQKJFI-RKDXNWHRSA-N 1 2 213.252 2.221 20 0 BEADLO Cc1nc(C[NH+]2CC3(CSC3)C2)ccc1F ZINC001237821900 980070280 /nfs/dbraw/zinc/07/02/80/980070280.db2.gz GPRDOELYMRYDGT-UHFFFAOYSA-N 1 2 238.331 2.078 20 0 BEADLO Nc1cc(Cl)[nH+]c(NC[C@H]2CCCCO2)c1 ZINC000153940437 980166746 /nfs/dbraw/zinc/16/67/46/980166746.db2.gz PPQNPJPDKGDFQI-SECBINFHSA-N 1 2 241.722 2.298 20 0 BEADLO Cc1c[nH]c(CCNC(=O)[C@@H]2CCC(C)(C)C2)[nH+]1 ZINC001185172378 980185307 /nfs/dbraw/zinc/18/53/07/980185307.db2.gz HQXQZRLEOYJKDJ-LLVKDONJSA-N 1 2 249.358 2.203 20 0 BEADLO Cc1ncncc1C[N@@H+]1CCc2sccc2C1 ZINC001238167695 980200577 /nfs/dbraw/zinc/20/05/77/980200577.db2.gz PAAWAVDDBUPAIG-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ncncc1C[N@H+]1CCc2sccc2C1 ZINC001238167695 980200585 /nfs/dbraw/zinc/20/05/85/980200585.db2.gz PAAWAVDDBUPAIG-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO CC[C@H](C)CCC(=O)N1CCc2[nH+]ccn2CC1 ZINC001185569498 980248551 /nfs/dbraw/zinc/24/85/51/980248551.db2.gz MVBRPUAHLNVAQS-LBPRGKRZSA-N 1 2 249.358 2.094 20 0 BEADLO CC[C@@H](C)CCC(=O)N1CCc2[nH+]ccn2CC1 ZINC001185569496 980248623 /nfs/dbraw/zinc/24/86/23/980248623.db2.gz MVBRPUAHLNVAQS-GFCCVEGCSA-N 1 2 249.358 2.094 20 0 BEADLO Cc1cc(C[N@@H+](C)C2(C)COC2)ncc1Cl ZINC001238422652 980251055 /nfs/dbraw/zinc/25/10/55/980251055.db2.gz OYBADUYGYDDWMO-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO Cc1cc(C[N@H+](C)C2(C)COC2)ncc1Cl ZINC001238422652 980251067 /nfs/dbraw/zinc/25/10/67/980251067.db2.gz OYBADUYGYDDWMO-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC(=O)C(C)(C)C2)c(C)c1 ZINC001238442924 980265444 /nfs/dbraw/zinc/26/54/44/980265444.db2.gz WHVGZEVKBHBRTI-UHFFFAOYSA-N 1 2 246.354 2.499 20 0 BEADLO Cc1cnc(C[N@H+]2CCC(=O)C(C)(C)C2)c(C)c1 ZINC001238442924 980265459 /nfs/dbraw/zinc/26/54/59/980265459.db2.gz WHVGZEVKBHBRTI-UHFFFAOYSA-N 1 2 246.354 2.499 20 0 BEADLO CC(C)Oc1cc(C[NH+]2CC(C)C2)cnc1F ZINC001238607310 980292992 /nfs/dbraw/zinc/29/29/92/980292992.db2.gz SAIZJKHIQVEBPJ-UHFFFAOYSA-N 1 2 238.306 2.460 20 0 BEADLO O=C(Nc1cc[nH+]c2c1CCC2)NC1CCCC1 ZINC001185868975 980296033 /nfs/dbraw/zinc/29/60/33/980296033.db2.gz MJDJISKIPNIZSZ-UHFFFAOYSA-N 1 2 245.326 2.056 20 0 BEADLO COc1cc(C)c(C)cc1C[N@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001238761094 980315901 /nfs/dbraw/zinc/31/59/01/980315901.db2.gz ALOMNANWGVHALV-OKILXGFUSA-N 1 2 247.338 2.285 20 0 BEADLO COc1cc(C)c(C)cc1C[N@@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001238761094 980315906 /nfs/dbraw/zinc/31/59/06/980315906.db2.gz ALOMNANWGVHALV-OKILXGFUSA-N 1 2 247.338 2.285 20 0 BEADLO CCOc1cc(C[N@@H+]2CC[C@H]2C)c(F)cn1 ZINC001238728897 980317042 /nfs/dbraw/zinc/31/70/42/980317042.db2.gz KAOUQAODUXGOEG-SECBINFHSA-N 1 2 224.279 2.214 20 0 BEADLO CC(C)(C)C(=O)OCC(C)(C)n1cc[nH+]c1 ZINC001344106406 980349815 /nfs/dbraw/zinc/34/98/15/980349815.db2.gz GIZQGXCOSWUMFL-UHFFFAOYSA-N 1 2 224.304 2.208 20 0 BEADLO OCCc1cccc(-c2nc3[nH]ccc3c[nH+]2)c1 ZINC001239023508 980414555 /nfs/dbraw/zinc/41/45/55/980414555.db2.gz KDBZYSGHGUASHT-UHFFFAOYSA-N 1 2 239.278 2.111 20 0 BEADLO CNc1cc(-c2cccc(CCO)c2)cc[nH+]1 ZINC001239035304 980421639 /nfs/dbraw/zinc/42/16/39/980421639.db2.gz PXRXLFFEXTXFTO-UHFFFAOYSA-N 1 2 228.295 2.325 20 0 BEADLO CN1CCOc2cc(CCCCF)c[nH+]c21 ZINC001250261646 980437849 /nfs/dbraw/zinc/43/78/49/980437849.db2.gz JVAPYJSRORKTJR-UHFFFAOYSA-N 1 2 224.279 2.202 20 0 BEADLO CCOc1cc[nH+]cc1Nc1cnoc1 ZINC001203233175 980459868 /nfs/dbraw/zinc/45/98/68/980459868.db2.gz RPFZIHCATJSPLH-UHFFFAOYSA-N 1 2 205.217 2.212 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2cn(C)cn2)c1 ZINC001203655170 980486119 /nfs/dbraw/zinc/48/61/19/980486119.db2.gz XHEAAUXZEWVTQH-UHFFFAOYSA-N 1 2 202.261 2.176 20 0 BEADLO CC(=O)c1nn(C)cc1Nc1cc(C)c[nH+]c1C ZINC001203656904 980492259 /nfs/dbraw/zinc/49/22/59/980492259.db2.gz CEZYQARSWVEUPT-UHFFFAOYSA-N 1 2 244.298 2.378 20 0 BEADLO Cn1c[nH+]cc1CCCOC(=O)C1(C2CC2)CC1 ZINC001345060744 980537537 /nfs/dbraw/zinc/53/75/37/980537537.db2.gz SGZHBWHRGPGWFO-UHFFFAOYSA-N 1 2 248.326 2.086 20 0 BEADLO C[NH+](C)Cc1c(F)cc(C2=CCOC2)cc1F ZINC001239494917 980654510 /nfs/dbraw/zinc/65/45/10/980654510.db2.gz NXWLUNFRZGIQIA-UHFFFAOYSA-N 1 2 239.265 2.440 20 0 BEADLO COc1ncc(-c2cc[nH+]c3c2CCN3)cc1F ZINC001239517923 980689205 /nfs/dbraw/zinc/68/92/05/980689205.db2.gz BTNJZSFKIGGGCX-UHFFFAOYSA-N 1 2 245.257 2.259 20 0 BEADLO CN(CC1CCCC1)C(=O)CCc1[nH+]ccn1C ZINC001345824702 980693964 /nfs/dbraw/zinc/69/39/64/980693964.db2.gz VQPAUVOQXNXIHX-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO CC(C)CC(C)(C)c1nnc(C[NH+](C)C)o1 ZINC001345940492 980712923 /nfs/dbraw/zinc/71/29/23/980712923.db2.gz DGNQEHGMUOFDBB-UHFFFAOYSA-N 1 2 225.336 2.455 20 0 BEADLO CCOCc1cncc(CCn2cc[nH+]c2)c1 ZINC001250320435 980761007 /nfs/dbraw/zinc/76/10/07/980761007.db2.gz LHMUXIVWSKHGJK-UHFFFAOYSA-N 1 2 231.299 2.057 20 0 BEADLO c1cncc(-c2c[nH+]c3c(c2)CCCN3)c1 ZINC001239572145 980761318 /nfs/dbraw/zinc/76/13/18/980761318.db2.gz YJPCRAAEDLIUJF-UHFFFAOYSA-N 1 2 211.268 2.144 20 0 BEADLO C[C@H](CC(=O)N1CC2CCC1CC2)n1cc[nH+]c1 ZINC001346165830 980772755 /nfs/dbraw/zinc/77/27/55/980772755.db2.gz NEVNFJLFMQMFMR-PNESKVBLSA-N 1 2 247.342 2.235 20 0 BEADLO C/C(=C/C(=O)OCCCc1c[nH+]cn1C)C1CC1 ZINC001346225959 980791810 /nfs/dbraw/zinc/79/18/10/980791810.db2.gz FXQHRQAZRUUXID-FLIBITNWSA-N 1 2 248.326 2.252 20 0 BEADLO C[C@H](C(=O)N(C)[C@@H](C)c1ccco1)n1cc[nH+]c1 ZINC000076901991 980804652 /nfs/dbraw/zinc/80/46/52/980804652.db2.gz GIDMUYBYBMOIQQ-WDEREUQCSA-N 1 2 247.298 2.257 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1ccc2occc2c1 ZINC001151772669 980804921 /nfs/dbraw/zinc/80/49/21/980804921.db2.gz RKQXUIUDJGLQPU-LBPRGKRZSA-N 1 2 244.294 2.466 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1ccc2occc2c1 ZINC001151772669 980804924 /nfs/dbraw/zinc/80/49/24/980804924.db2.gz RKQXUIUDJGLQPU-LBPRGKRZSA-N 1 2 244.294 2.466 20 0 BEADLO CCc1cn(C[C@H]2CC(C)(C)CO2)c[nH+]1 ZINC001190103053 980845302 /nfs/dbraw/zinc/84/53/02/980845302.db2.gz FLZFVAOGPPVCCT-LLVKDONJSA-N 1 2 208.305 2.261 20 0 BEADLO C[C@@H]1CCN1C(=O)c1ccccc1-n1cc[nH+]c1 ZINC001190086224 980847574 /nfs/dbraw/zinc/84/75/74/980847574.db2.gz SDTQSJSPOBPAGG-LLVKDONJSA-N 1 2 241.294 2.107 20 0 BEADLO c1c[nH+]c(-c2ccc(Cc3cnccn3)cc2)[nH]1 ZINC001250374151 980867952 /nfs/dbraw/zinc/86/79/52/980867952.db2.gz BENXECWBMUPZDO-UHFFFAOYSA-N 1 2 236.278 2.458 20 0 BEADLO COc1ccc(-c2cccc3[nH+]ccn32)cn1 ZINC001239725858 980879160 /nfs/dbraw/zinc/87/91/60/980879160.db2.gz VYKNKLDTHOYVGY-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO COc1ccc(-c2ccn3cc[nH+]c3c2)cn1 ZINC001239727201 980880317 /nfs/dbraw/zinc/88/03/17/980880317.db2.gz VYJGKXFQOLOCOO-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO COc1ccc(C[N@@H+]2CCO[C@H]3C[C@H]32)c(C)c1C ZINC001203724025 980881363 /nfs/dbraw/zinc/88/13/63/980881363.db2.gz XHJHSAJQGFPMNJ-HIFRSBDPSA-N 1 2 247.338 2.285 20 0 BEADLO COc1ccc(C[N@H+]2CCO[C@H]3C[C@H]32)c(C)c1C ZINC001203724025 980881366 /nfs/dbraw/zinc/88/13/66/980881366.db2.gz XHJHSAJQGFPMNJ-HIFRSBDPSA-N 1 2 247.338 2.285 20 0 BEADLO CCC/C=C\C(=O)OCc1c[nH+]cn1CC ZINC001346746900 980898991 /nfs/dbraw/zinc/89/89/91/980898991.db2.gz HVNKEKCHHBIOIV-SREVYHEPSA-N 1 2 222.288 2.303 20 0 BEADLO CCCCNC(=O)NCc1c[nH+]cn1C(C)C ZINC001190641784 980903612 /nfs/dbraw/zinc/90/36/12/980903612.db2.gz FJOTVOBWNUZOMA-UHFFFAOYSA-N 1 2 238.335 2.063 20 0 BEADLO C[C@H]([NH2+]Cc1ncn[nH]1)[C@H]1CCC[C@H](C)C1 ZINC001347122096 980982059 /nfs/dbraw/zinc/98/20/59/980982059.db2.gz VXGHEVCKOKRGFR-DCAQKATOSA-N 1 2 222.336 2.109 20 0 BEADLO CN(C)C(=O)c1cccc(-c2cc[nH+]c(N)c2)c1 ZINC001239924640 981033018 /nfs/dbraw/zinc/03/30/18/981033018.db2.gz OUGMIQFSQYJWDZ-UHFFFAOYSA-N 1 2 241.294 2.033 20 0 BEADLO COc1cncc(-c2cc[nH+]c3c2CCN3)c1 ZINC001239932164 981042844 /nfs/dbraw/zinc/04/28/44/981042844.db2.gz CXRYCHQFKJEFDA-UHFFFAOYSA-N 1 2 227.267 2.120 20 0 BEADLO CC(C)NC(=O)c1ccc(-c2c[nH+]cn2C)cc1 ZINC001240024040 981105074 /nfs/dbraw/zinc/10/50/74/981105074.db2.gz WLGHCRVFUXNPBH-UHFFFAOYSA-N 1 2 243.310 2.225 20 0 BEADLO C[C@@H](C(=O)N1CC(C)(C)[C@@H]1C1CC1)n1cc[nH+]c1 ZINC001347526344 981107257 /nfs/dbraw/zinc/10/72/57/981107257.db2.gz HVJIXYRYRWSLTI-JQWIXIFHSA-N 1 2 247.342 2.091 20 0 BEADLO Cc1ccc(C[N@@H+]2CCCC(=O)CC2)o1 ZINC001203290597 981113694 /nfs/dbraw/zinc/11/36/94/981113694.db2.gz MNKCPKFOFCEPHN-UHFFFAOYSA-N 1 2 207.273 2.143 20 0 BEADLO Cc1ccc(C[N@H+]2CCCC(=O)CC2)o1 ZINC001203290597 981113699 /nfs/dbraw/zinc/11/36/99/981113699.db2.gz MNKCPKFOFCEPHN-UHFFFAOYSA-N 1 2 207.273 2.143 20 0 BEADLO Cc1n[nH]c(C)c1-c1ccn2cc[nH+]c2c1 ZINC001240124527 981119504 /nfs/dbraw/zinc/11/95/04/981119504.db2.gz GZYLCLPBQDGDNL-UHFFFAOYSA-N 1 2 212.256 2.341 20 0 BEADLO Cc1n[nH]c(C)c1-c1c[nH+]c(N(C)C)cc1C ZINC001240126409 981125979 /nfs/dbraw/zinc/12/59/79/981125979.db2.gz XBKJAXRHKMWTNS-UHFFFAOYSA-N 1 2 230.315 2.463 20 0 BEADLO C[C@H](C[N@@H+]1CCOCC12CC2)C(F)(F)F ZINC000335926567 981152132 /nfs/dbraw/zinc/15/21/32/981152132.db2.gz LWBQMOQDHGJCSN-MRVPVSSYSA-N 1 2 223.238 2.050 20 0 BEADLO C[C@H](C[N@H+]1CCOCC12CC2)C(F)(F)F ZINC000335926567 981152136 /nfs/dbraw/zinc/15/21/36/981152136.db2.gz LWBQMOQDHGJCSN-MRVPVSSYSA-N 1 2 223.238 2.050 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@H]3[C@@H](C2)C3(F)F)no1 ZINC001192391338 981154691 /nfs/dbraw/zinc/15/46/91/981154691.db2.gz RXPNFGFIGOQLMP-VHSXEESVSA-N 1 2 228.242 2.070 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@H]3[C@@H](C2)C3(F)F)no1 ZINC001192391338 981154695 /nfs/dbraw/zinc/15/46/95/981154695.db2.gz RXPNFGFIGOQLMP-VHSXEESVSA-N 1 2 228.242 2.070 20 0 BEADLO c1cn2cc(-c3cc4nccnc4cn3)ccc2[nH+]1 ZINC001240214283 981162067 /nfs/dbraw/zinc/16/20/67/981162067.db2.gz NKNXTBTVILYUKM-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO Cc1cnc(-c2ccc3[nH+]ccn3c2)cn1 ZINC001240215575 981164284 /nfs/dbraw/zinc/16/42/84/981164284.db2.gz UXZBKTCAQIHBLC-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO c1cn2cc(-c3ccc4n[nH]nc4c3)ccc2[nH+]1 ZINC001240217418 981165849 /nfs/dbraw/zinc/16/58/49/981165849.db2.gz CBWZDDFBBUFGJH-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO Cn1cnc2cc(-c3ccc4[nH+]ccn4c3)cnc21 ZINC001240217367 981166646 /nfs/dbraw/zinc/16/66/46/981166646.db2.gz APEDAEXXSNISDA-UHFFFAOYSA-N 1 2 249.277 2.283 20 0 BEADLO O=C1Cc2c(cccc2-c2ccc3[nH+]ccn3c2)N1 ZINC001240217995 981166895 /nfs/dbraw/zinc/16/68/95/981166895.db2.gz VJIPWAHYBYHHOI-UHFFFAOYSA-N 1 2 249.273 2.496 20 0 BEADLO Cc1cc(N[C@H]2C[C@@H](O)C2)[nH+]c2ccccc12 ZINC001347839457 981191952 /nfs/dbraw/zinc/19/19/52/981191952.db2.gz UKKQNTOMKYFJDG-PHIMTYICSA-N 1 2 228.295 2.478 20 0 BEADLO c1cn(Cc2ccccc2-c2cn[nH]c2)c[nH+]1 ZINC001240240907 981211660 /nfs/dbraw/zinc/21/16/60/981211660.db2.gz ARZSVQKVLYTFAR-UHFFFAOYSA-N 1 2 224.267 2.322 20 0 BEADLO c1cn(-c2ccc(-c3cn[nH]c3)cc2)c[nH+]1 ZINC001240241779 981215294 /nfs/dbraw/zinc/21/52/94/981215294.db2.gz YLTJDVGRBCSVDO-UHFFFAOYSA-N 1 2 210.240 2.262 20 0 BEADLO C[C@H](C(=O)N[C@@H](C1CC1)C1CCC1)n1cc[nH+]c1 ZINC001348023569 981251937 /nfs/dbraw/zinc/25/19/37/981251937.db2.gz JUTIOKIHHNPSCT-ZWNOBZJWSA-N 1 2 247.342 2.139 20 0 BEADLO C[C@@H](C(=O)N[C@H](C1CC1)C1CCC1)n1cc[nH+]c1 ZINC001348023564 981252741 /nfs/dbraw/zinc/25/27/41/981252741.db2.gz JUTIOKIHHNPSCT-GWCFXTLKSA-N 1 2 247.342 2.139 20 0 BEADLO Cn1cc(-c2ccc(F)c(-n3cc[nH+]c3)c2)cn1 ZINC001240297850 981253920 /nfs/dbraw/zinc/25/39/20/981253920.db2.gz VRRYSFZNYHDCGK-UHFFFAOYSA-N 1 2 242.257 2.412 20 0 BEADLO Cc1cc(F)cc(N2CCC(F)(F)C2)[nH+]1 ZINC001348073860 981271246 /nfs/dbraw/zinc/27/12/46/981271246.db2.gz PWTLXJNHIBZJFG-UHFFFAOYSA-N 1 2 216.206 2.375 20 0 BEADLO COCc1cc(C[N@@H+]2CC(C)(C)C2(C)C)no1 ZINC001348071357 981274415 /nfs/dbraw/zinc/27/44/15/981274415.db2.gz SIAAHXMHFMRPRA-UHFFFAOYSA-N 1 2 238.331 2.441 20 0 BEADLO COCc1cc(C[N@H+]2CC(C)(C)C2(C)C)no1 ZINC001348071357 981274423 /nfs/dbraw/zinc/27/44/23/981274423.db2.gz SIAAHXMHFMRPRA-UHFFFAOYSA-N 1 2 238.331 2.441 20 0 BEADLO Cc1cn2cc(-c3ccc(=O)n(C)c3)ccc2[nH+]1 ZINC001240331765 981299453 /nfs/dbraw/zinc/29/94/53/981299453.db2.gz KIQDAIDTGHKFDG-UHFFFAOYSA-N 1 2 239.278 2.008 20 0 BEADLO CCc1ccc(N2CC[C@](CO)(C(C)C)C2)[nH+]c1 ZINC001348183646 981303653 /nfs/dbraw/zinc/30/36/53/981303653.db2.gz MHIZBXGTXZPIOL-HNNXBMFYSA-N 1 2 248.370 2.489 20 0 BEADLO CCc1ccc(N2CC[C@@](CO)(C(C)C)C2)[nH+]c1 ZINC001348183648 981303728 /nfs/dbraw/zinc/30/37/28/981303728.db2.gz MHIZBXGTXZPIOL-OAHLLOKOSA-N 1 2 248.370 2.489 20 0 BEADLO CC(=O)NCc1cccc(/C(C)=C/C=C/[NH3+])c1 ZINC001240350273 981309173 /nfs/dbraw/zinc/30/91/73/981309173.db2.gz FAAKEAYSZDUKGP-JNKBEKGTSA-N 1 2 230.311 2.198 20 0 BEADLO CCc1ccc(N2CCC[C@@H](CO)[C@H]2C)[nH+]c1 ZINC001348215019 981310756 /nfs/dbraw/zinc/31/07/56/981310756.db2.gz PJHXKYPNYZXXAI-YPMHNXCESA-N 1 2 234.343 2.241 20 0 BEADLO c1cn2ccc(-c3ccc4ncnn4c3)cc2[nH+]1 ZINC001240355637 981311536 /nfs/dbraw/zinc/31/15/36/981311536.db2.gz UPNMLBXBUGACQB-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO Cc1cn2cc(-c3cncnc3)ccc2[nH+]1 ZINC001240375207 981324399 /nfs/dbraw/zinc/32/43/99/981324399.db2.gz FEWFUJJBVXAFJW-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO Cn1c[nH+]cc1-c1cccc(C(C)(C)O)c1 ZINC001240406411 981358155 /nfs/dbraw/zinc/35/81/55/981358155.db2.gz JCGPVBUUVDBFOC-UHFFFAOYSA-N 1 2 216.284 2.315 20 0 BEADLO Cc1nc(NC[C@H]2C[C@H]2C2CCCC2)nc(N)[nH+]1 ZINC001348541957 981388781 /nfs/dbraw/zinc/38/87/81/981388781.db2.gz CUAVYCWCTJWHTM-MNOVXSKESA-N 1 2 247.346 2.000 20 0 BEADLO Cc1nc(N)nc(NC[C@H]2C[C@H]2C2CCCC2)[nH+]1 ZINC001348541957 981388789 /nfs/dbraw/zinc/38/87/89/981388789.db2.gz CUAVYCWCTJWHTM-MNOVXSKESA-N 1 2 247.346 2.000 20 0 BEADLO Cc1nccc(-c2ccn3cc[nH+]c3c2)n1 ZINC001240496098 981414882 /nfs/dbraw/zinc/41/48/82/981414882.db2.gz GCXPBKUGWGEXBG-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO CCc1ncnc(-c2ccn3cc[nH+]c3c2)c1F ZINC001240496789 981417825 /nfs/dbraw/zinc/41/78/25/981417825.db2.gz TUMGSWBLSRNLFA-UHFFFAOYSA-N 1 2 242.257 2.493 20 0 BEADLO Nc1cnc(-c2ccn3cc[nH+]c3c2)c(F)c1 ZINC001240497570 981417888 /nfs/dbraw/zinc/41/78/88/981417888.db2.gz UMPNYFRWWQLYAM-UHFFFAOYSA-N 1 2 228.230 2.118 20 0 BEADLO CCOc1nccc(-c2ccn3cc[nH+]c3c2)n1 ZINC001240496755 981417910 /nfs/dbraw/zinc/41/79/10/981417910.db2.gz HRHPYIOBYHCOMJ-UHFFFAOYSA-N 1 2 240.266 2.190 20 0 BEADLO c1cn2ccc(-c3cnc4ncccc4n3)cc2[nH+]1 ZINC001240496449 981418742 /nfs/dbraw/zinc/41/87/42/981418742.db2.gz OHDAVYVYFKKFEY-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO CCc1ncc(F)c(-c2ccn3cc[nH+]c3c2)n1 ZINC001240504485 981431721 /nfs/dbraw/zinc/43/17/21/981431721.db2.gz PVFCXRIYZVQWQA-UHFFFAOYSA-N 1 2 242.257 2.493 20 0 BEADLO c1cn2ccc(-c3ccn4cnnc4c3)cc2[nH+]1 ZINC001240504100 981431732 /nfs/dbraw/zinc/43/17/32/981431732.db2.gz YLMXOLYEPFGQPC-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO c1cn2c(cncc2-c2ccn3cc[nH+]c3c2)n1 ZINC001240509184 981433402 /nfs/dbraw/zinc/43/34/02/981433402.db2.gz UKANMACABCAOLF-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO CCn1cccc(-c2ccn3cc[nH+]c3c2)c1=O ZINC001240511030 981435831 /nfs/dbraw/zinc/43/58/31/981435831.db2.gz ZJDQIFLBUTWZIA-UHFFFAOYSA-N 1 2 239.278 2.183 20 0 BEADLO Cc1cc(-c2ccn3ccnc3c2)c[nH+]c1N ZINC001240511022 981436674 /nfs/dbraw/zinc/43/66/74/981436674.db2.gz YWEYUKHVZXYGNC-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO Cc1cc(NC(=O)[C@H](C)n2cc[nH+]c2)cs1 ZINC001348789927 981444278 /nfs/dbraw/zinc/44/42/78/981444278.db2.gz YDVMFVBBKNZSDD-VIFPVBQESA-N 1 2 235.312 2.453 20 0 BEADLO Cc1n[nH]cc1-c1c[nH+]c(N(C)C)cc1C ZINC001240518553 981447272 /nfs/dbraw/zinc/44/72/72/981447272.db2.gz QARITBPERSCZQJ-UHFFFAOYSA-N 1 2 216.288 2.155 20 0 BEADLO Cc1ccc(C(=O)Nc2ccn3cc[nH+]c3c2)[nH]1 ZINC001193900741 981504434 /nfs/dbraw/zinc/50/44/34/981504434.db2.gz XMOAQRSUWIWSTH-UHFFFAOYSA-N 1 2 240.266 2.223 20 0 BEADLO CCn1cc(-c2c[nH+]c(N(C)C)cc2C)cn1 ZINC001240649728 981551149 /nfs/dbraw/zinc/55/11/49/981551149.db2.gz DUJBWADARVJZNN-UHFFFAOYSA-N 1 2 230.315 2.339 20 0 BEADLO CS[C@H]1CC[C@@H]([N@H+](C)Cc2cnsn2)C1 ZINC001349761266 981712263 /nfs/dbraw/zinc/71/22/63/981712263.db2.gz WFVAJJDAKQIHKW-ZJUUUORDSA-N 1 2 243.401 2.254 20 0 BEADLO CS[C@H]1CC[C@@H]([N@@H+](C)Cc2cnsn2)C1 ZINC001349761266 981712272 /nfs/dbraw/zinc/71/22/72/981712272.db2.gz WFVAJJDAKQIHKW-ZJUUUORDSA-N 1 2 243.401 2.254 20 0 BEADLO CC/C(C)=C(/C)c1nnc(C[NH+](C)C)o1 ZINC001349948409 981824781 /nfs/dbraw/zinc/82/47/81/981824781.db2.gz XUEUPPLNTUTPAZ-HJWRWDBZSA-N 1 2 209.293 2.335 20 0 BEADLO C=C/C=C/CC(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC001583786648 981838947 /nfs/dbraw/zinc/83/89/47/981838947.db2.gz DNGSXSZZEFABCT-ONEGZZNKSA-N 1 2 245.326 2.248 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cnc2c(ccn2C)c1 ZINC001240836200 981879862 /nfs/dbraw/zinc/87/98/62/981879862.db2.gz VRTJPYKNKOBRRL-GOKWTUSKSA-N 1 2 213.284 2.449 20 0 BEADLO C/C(Cl)=C\C(=O)Nc1ccc2[nH+]ccn2c1 ZINC001585377035 981923913 /nfs/dbraw/zinc/92/39/13/981923913.db2.gz YRIBVDUNFQHNFB-SOFGYWHQSA-N 1 2 235.674 2.415 20 0 BEADLO CC(C)[C@H]1CCCCN1C(=O)CCc1[nH]cc[nH+]1 ZINC001586091410 981968659 /nfs/dbraw/zinc/96/86/59/981968659.db2.gz PHJZHGIIIOMQQQ-GFCCVEGCSA-N 1 2 249.358 2.379 20 0 BEADLO CCN(C)C(=O)c1cccc(-c2c[nH+]cn2C)c1 ZINC001194887245 981969804 /nfs/dbraw/zinc/96/98/04/981969804.db2.gz MNBAYONDUOCXTJ-UHFFFAOYSA-N 1 2 243.310 2.179 20 0 BEADLO C[C@H](O)[C@H](C)[NH2+]CC(F)(F)c1ccc(F)cc1 ZINC001350434903 981975991 /nfs/dbraw/zinc/97/59/91/981975991.db2.gz ZORYPNOILYDGOX-IUCAKERBSA-N 1 2 247.260 2.276 20 0 BEADLO Cn1cc[nH+]c1CCC(=O)Nc1ccccc1F ZINC001586984998 982040704 /nfs/dbraw/zinc/04/07/04/982040704.db2.gz DTIZUQOZJAWKDU-UHFFFAOYSA-N 1 2 247.273 2.131 20 0 BEADLO CC[C@H](C)OC(=O)NCc1c[nH+]cn1C(C)C ZINC001195150967 982138179 /nfs/dbraw/zinc/13/81/79/982138179.db2.gz OSSMQIYGEAFWOD-JTQLQIEISA-N 1 2 239.319 2.489 20 0 BEADLO Cc1cc(N(C)C)nc(-c2ccc(O)cc2)[nH+]1 ZINC001241062254 982167864 /nfs/dbraw/zinc/16/78/64/982167864.db2.gz WZRDHWBFWGTEJB-UHFFFAOYSA-N 1 2 229.283 2.224 20 0 BEADLO Nc1cc[nH+]c(-c2c(F)cc(O)cc2F)c1 ZINC001241117696 982233670 /nfs/dbraw/zinc/23/36/70/982233670.db2.gz VVTRWXDCZKKUSV-UHFFFAOYSA-N 1 2 222.194 2.315 20 0 BEADLO Cc1cc(-c2cc(CO)ccc2F)c[nH+]c1N ZINC001241153694 982288222 /nfs/dbraw/zinc/28/82/22/982288222.db2.gz QTLQOZICAOGMFE-UHFFFAOYSA-N 1 2 232.258 2.271 20 0 BEADLO C[S@](=N)(=O)c1ccc(-c2cc[nH+]c(N)c2)cc1 ZINC001241169910 982314245 /nfs/dbraw/zinc/31/42/45/982314245.db2.gz QXQRINGEXYEXQV-KRWDZBQOSA-N 1 2 247.323 2.366 20 0 BEADLO Cc1cc(-c2ccnc(N)c2)cn2cc[nH+]c12 ZINC001241170089 982319764 /nfs/dbraw/zinc/31/97/64/982319764.db2.gz DHIVKTZYEVVVGH-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO Nc1cc(-c2cnc3ncccc3c2)cc[nH+]1 ZINC001241171143 982322848 /nfs/dbraw/zinc/32/28/48/982322848.db2.gz VSASASIYGKFNHP-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO Nc1cc(-c2cnc3c(c2)CN=N3)cc[nH+]1 ZINC001241175461 982324058 /nfs/dbraw/zinc/32/40/58/982324058.db2.gz CGAUJXVRLKEMCM-UHFFFAOYSA-N 1 2 211.228 2.323 20 0 BEADLO Nc1cc(-c2cncc(-c3ncco3)c2)cc[nH+]1 ZINC001241175495 982324732 /nfs/dbraw/zinc/32/47/32/982324732.db2.gz DJQJSQOGNIMNDR-UHFFFAOYSA-N 1 2 238.250 2.381 20 0 BEADLO Cc1c(-c2cc[nH+]c(N)c2)ccc2nccn21 ZINC001241176277 982327332 /nfs/dbraw/zinc/32/73/32/982327332.db2.gz YFAFCBXQXIYIBW-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO Cc1c(-c2ccnc(N)c2)ccc2[nH+]ccn21 ZINC001241176277 982327339 /nfs/dbraw/zinc/32/73/39/982327339.db2.gz YFAFCBXQXIYIBW-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO Cc1nc2cc(-c3cc[nH+]c(N)c3)cnc2o1 ZINC001241175889 982328642 /nfs/dbraw/zinc/32/86/42/982328642.db2.gz PTYHNQKSJWQCST-UHFFFAOYSA-N 1 2 226.239 2.175 20 0 BEADLO C[C@@H](C(=O)N1CCCC2(CC2)CC1)n1cc[nH+]c1 ZINC001351679943 982359783 /nfs/dbraw/zinc/35/97/83/982359783.db2.gz RJABGDZRPKIGMI-LBPRGKRZSA-N 1 2 247.342 2.237 20 0 BEADLO Cc1cc(-c2c[nH+]c(N(C)C)cc2C)ncn1 ZINC001241228795 982379780 /nfs/dbraw/zinc/37/97/80/982379780.db2.gz QJUZORTUXZNSGF-UHFFFAOYSA-N 1 2 228.299 2.221 20 0 BEADLO Cc1cncc(-c2c[nH+]c(N(C)C)cc2C)n1 ZINC001241229060 982380421 /nfs/dbraw/zinc/38/04/21/982380421.db2.gz VRYMJIMNLGVDHN-UHFFFAOYSA-N 1 2 228.299 2.221 20 0 BEADLO CCc1cc(-c2c[nH+]c(N(C)C)cc2C)ncn1 ZINC001241240621 982385517 /nfs/dbraw/zinc/38/55/17/982385517.db2.gz PSMDTMVAPUPPIT-UHFFFAOYSA-N 1 2 242.326 2.475 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1ccnc(F)n1 ZINC001241235946 982387139 /nfs/dbraw/zinc/38/71/39/982387139.db2.gz WPZDPBIJFQZOSX-UHFFFAOYSA-N 1 2 232.262 2.052 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1ncnc(C)c1F ZINC001241232977 982387219 /nfs/dbraw/zinc/38/72/19/982387219.db2.gz CBRWONJZXJMQMN-UHFFFAOYSA-N 1 2 246.289 2.361 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1cncc(N)c1 ZINC001241244245 982390277 /nfs/dbraw/zinc/39/02/77/982390277.db2.gz YYCQJRHISQOIKX-UHFFFAOYSA-N 1 2 228.299 2.100 20 0 BEADLO CCC1(O)CN(c2cc(C)[nH+]c(C3CCC3)n2)C1 ZINC001352010902 982433667 /nfs/dbraw/zinc/43/36/67/982433667.db2.gz DCQYITJCZFZJOO-UHFFFAOYSA-N 1 2 247.342 2.014 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc(N(C)C)nc1 ZINC001241370471 982532036 /nfs/dbraw/zinc/53/20/36/982532036.db2.gz NQRXSUARHQGRGG-DXNUHORPSA-N 1 2 203.289 2.023 20 0 BEADLO CN(C)c1ccc(-c2cc[nH+]c(N(C)C)c2)cn1 ZINC001241371212 982533146 /nfs/dbraw/zinc/53/31/46/982533146.db2.gz YCTMSZYJIYBZAO-UHFFFAOYSA-N 1 2 242.326 2.276 20 0 BEADLO Nc1cn2ccc(-c3cccc(CO)c3)cc2[nH+]1 ZINC001241508220 982663400 /nfs/dbraw/zinc/66/34/00/982663400.db2.gz CLXQACTUPRHWJN-UHFFFAOYSA-N 1 2 239.278 2.076 20 0 BEADLO OCc1cccc(-c2nc3[nH]ccc3c[nH+]2)c1 ZINC001241506204 982664096 /nfs/dbraw/zinc/66/40/96/982664096.db2.gz QUCYHFHXHCZVNV-UHFFFAOYSA-N 1 2 225.251 2.069 20 0 BEADLO OCc1cc[nH+]c(N[C@@H]2CCC[C@@H](F)C2)c1 ZINC001353017751 982668599 /nfs/dbraw/zinc/66/85/99/982668599.db2.gz PSAIPGLELKQDGI-GHMZBOCLSA-N 1 2 224.279 2.267 20 0 BEADLO Cc1cc(NC(=S)NC2CCCC2)cc[nH+]1 ZINC001198510258 982747665 /nfs/dbraw/zinc/74/76/65/982747665.db2.gz OFGBYLXYVQUQBR-UHFFFAOYSA-N 1 2 235.356 2.041 20 0 BEADLO Nc1cn2ccc(-c3ccc(CO)cc3)cc2[nH+]1 ZINC001241557923 982779804 /nfs/dbraw/zinc/77/98/04/982779804.db2.gz ZXKIDXAYEBSASE-UHFFFAOYSA-N 1 2 239.278 2.076 20 0 BEADLO Cc1n[nH]c2ccc(-c3c[nH+]cn3C)cc12 ZINC001241669656 982911863 /nfs/dbraw/zinc/91/18/63/982911863.db2.gz VBTPJQVCMRZRDJ-UHFFFAOYSA-N 1 2 212.256 2.272 20 0 BEADLO Nc1cn2ccc(-c3ccc4[nH]cnc4c3)cc2[nH+]1 ZINC001241692137 982943787 /nfs/dbraw/zinc/94/37/87/982943787.db2.gz YSMDLKVSPAICCI-UHFFFAOYSA-N 1 2 249.277 2.460 20 0 BEADLO Nc1cn2ccc(-c3ccc4nc[nH]c4c3)cc2[nH+]1 ZINC001241692137 982943796 /nfs/dbraw/zinc/94/37/96/982943796.db2.gz YSMDLKVSPAICCI-UHFFFAOYSA-N 1 2 249.277 2.460 20 0 BEADLO O=C(C1=CC=CC1)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC001199694387 982998457 /nfs/dbraw/zinc/99/84/57/982998457.db2.gz ZLXYDHAYQPJQLP-LBPRGKRZSA-N 1 2 243.310 2.002 20 0 BEADLO CC[C@H](C)NC(=S)Nc1ccn2cc[nH+]c2c1 ZINC001200472410 983035221 /nfs/dbraw/zinc/03/52/21/983035221.db2.gz YVHAWHKTVIGYQT-VIFPVBQESA-N 1 2 248.355 2.419 20 0 BEADLO CC(C)(CNC(=O)C[C@@H]1C=CCC1)n1cc[nH+]c1 ZINC001353867013 983035673 /nfs/dbraw/zinc/03/56/73/983035673.db2.gz XJHVFRAUUSZDDC-GFCCVEGCSA-N 1 2 247.342 2.091 20 0 BEADLO c1nn(C2CC2)cc1-c1cc[nH+]c2c1CCN2 ZINC001241912403 983128724 /nfs/dbraw/zinc/12/87/24/983128724.db2.gz ZTDVBDBAIAOVCH-UHFFFAOYSA-N 1 2 226.283 2.248 20 0 BEADLO Nc1ccc(Nc2cccc3nsnc32)c[nH+]1 ZINC001201284196 983156734 /nfs/dbraw/zinc/15/67/34/983156734.db2.gz MUOOTRRDFYSPFV-UHFFFAOYSA-N 1 2 243.295 2.412 20 0 BEADLO Nc1ccc(Nc2cn(C3CCC3)cn2)c[nH+]1 ZINC001201279551 983157632 /nfs/dbraw/zinc/15/76/32/983157632.db2.gz QQBOMICAUIOWRT-UHFFFAOYSA-N 1 2 229.287 2.329 20 0 BEADLO Cc1cnc(Cl)c(Nc2ccc(N)[nH+]c2)c1N ZINC001201280021 983158708 /nfs/dbraw/zinc/15/87/08/983158708.db2.gz XLWDCRSPNKDTCS-UHFFFAOYSA-N 1 2 249.705 2.346 20 0 BEADLO Nc1ccc(Nc2ccc(O)cc2F)c[nH+]1 ZINC001201283668 983159100 /nfs/dbraw/zinc/15/91/00/983159100.db2.gz CLISERVCPFZZRQ-UHFFFAOYSA-N 1 2 219.219 2.252 20 0 BEADLO COc1cc(C)[nH+]cc1-c1ccc2n[nH]nc2c1 ZINC001241941762 983161675 /nfs/dbraw/zinc/16/16/75/983161675.db2.gz MLDBKNNXDLOCJL-UHFFFAOYSA-N 1 2 240.266 2.337 20 0 BEADLO Cc1cc(N)ccc1Nc1ccc(N)[nH+]c1 ZINC001201285712 983161985 /nfs/dbraw/zinc/16/19/85/983161985.db2.gz NFFYSNWUVFXJEO-UHFFFAOYSA-N 1 2 214.272 2.298 20 0 BEADLO Cn1ncc2c1cccc2Nc1ccc(N)[nH+]c1 ZINC001201286816 983163922 /nfs/dbraw/zinc/16/39/22/983163922.db2.gz BMBZACWJYXVHQI-UHFFFAOYSA-N 1 2 239.282 2.294 20 0 BEADLO Nc1ccc(Nc2ccc3cncnc3c2)c[nH+]1 ZINC001201292077 983167947 /nfs/dbraw/zinc/16/79/47/983167947.db2.gz IVGZXEBDYAYEMW-UHFFFAOYSA-N 1 2 237.266 2.351 20 0 BEADLO Nc1ccc(Nc2cccc3snnc32)c[nH+]1 ZINC001201291199 983168016 /nfs/dbraw/zinc/16/80/16/983168016.db2.gz FRKMDSVGRQUZLJ-UHFFFAOYSA-N 1 2 243.295 2.412 20 0 BEADLO Cc1ccc(Nc2ccc(N)[nH+]c2)cc1CO ZINC001201292326 983169105 /nfs/dbraw/zinc/16/91/05/983169105.db2.gz VLVIWUADLNKBAL-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO Nc1ccc(Nc2cccnc2Cl)c[nH+]1 ZINC001201271366 983171459 /nfs/dbraw/zinc/17/14/59/983171459.db2.gz HLNYXKLQFJUUFS-UHFFFAOYSA-N 1 2 220.663 2.456 20 0 BEADLO Cc1nc(Cl)cc(Nc2ccc(N)[nH+]c2)n1 ZINC001201271748 983171709 /nfs/dbraw/zinc/17/17/09/983171709.db2.gz AFRRRMRTDPWDJW-UHFFFAOYSA-N 1 2 235.678 2.159 20 0 BEADLO Cc1ccc(Nc2ccc(N)[nH+]c2)c(F)n1 ZINC001201272977 983177251 /nfs/dbraw/zinc/17/72/51/983177251.db2.gz XRUYAEMIBYKENF-UHFFFAOYSA-N 1 2 218.235 2.250 20 0 BEADLO Nc1ccc(Nc2nccc3cnccc32)c[nH+]1 ZINC001201278819 983178377 /nfs/dbraw/zinc/17/83/77/983178377.db2.gz OKNYIOOPKFSYRB-UHFFFAOYSA-N 1 2 237.266 2.351 20 0 BEADLO Nc1ccc(Nc2nsc3ncccc23)c[nH+]1 ZINC001201278190 983178388 /nfs/dbraw/zinc/17/83/88/983178388.db2.gz DZLVWOJZENCYCP-UHFFFAOYSA-N 1 2 243.295 2.412 20 0 BEADLO Nc1ccc(Nc2nc(F)ccc2F)c[nH+]1 ZINC001201278869 983178605 /nfs/dbraw/zinc/17/86/05/983178605.db2.gz IKMIMAJQJMGCHO-UHFFFAOYSA-N 1 2 222.198 2.081 20 0 BEADLO CC(C)Cn1cnc(Nc2ccc(N)[nH+]c2)c1 ZINC001201278368 983179271 /nfs/dbraw/zinc/17/92/71/983179271.db2.gz APSJIIUVZRUQMF-UHFFFAOYSA-N 1 2 231.303 2.260 20 0 BEADLO Nc1ccc(Nc2ccc3c(c2)CC(=O)C3)c[nH+]1 ZINC001201299147 983181625 /nfs/dbraw/zinc/18/16/25/983181625.db2.gz CZKOJIMSYHVVNK-UHFFFAOYSA-N 1 2 239.278 2.075 20 0 BEADLO CN1CCc2ccc(Nc3ccc(N)[nH+]c3)cc21 ZINC001201299159 983181984 /nfs/dbraw/zinc/18/19/84/983181984.db2.gz DIQIWIIALDUXAL-UHFFFAOYSA-N 1 2 240.310 2.400 20 0 BEADLO Cc1cc(-c2c[nH]c3cc(=O)[nH]c-3c2)cc(C)[nH+]1 ZINC001241992689 983187677 /nfs/dbraw/zinc/18/76/77/983187677.db2.gz WJMZNNOLUVXBCS-UHFFFAOYSA-N 1 2 239.278 2.255 20 0 BEADLO COC(=O)[C@@H]1C[C@@H](F)C[N@@H+]1CC1CCCCC1 ZINC001201390121 983211841 /nfs/dbraw/zinc/21/18/41/983211841.db2.gz BTEILEFFXQWGOU-NEPJUHHUSA-N 1 2 243.322 2.152 20 0 BEADLO COC(=O)[C@@H]1C[C@@H](F)C[N@H+]1CC1CCCCC1 ZINC001201390121 983211849 /nfs/dbraw/zinc/21/18/49/983211849.db2.gz BTEILEFFXQWGOU-NEPJUHHUSA-N 1 2 243.322 2.152 20 0 BEADLO CCc1ccc(N(C)Cc2ccn(C)n2)[nH+]c1 ZINC001354258789 983232062 /nfs/dbraw/zinc/23/20/62/983232062.db2.gz YKQLPQXSCXPQHK-UHFFFAOYSA-N 1 2 230.315 2.014 20 0 BEADLO CC(C)(C)C[N@@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC001201443850 983251421 /nfs/dbraw/zinc/25/14/21/983251421.db2.gz WADCVXVAIVZSAN-MRVPVSSYSA-N 1 2 225.254 2.296 20 0 BEADLO CC(C)(C)C[N@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC001201443850 983251434 /nfs/dbraw/zinc/25/14/34/983251434.db2.gz WADCVXVAIVZSAN-MRVPVSSYSA-N 1 2 225.254 2.296 20 0 BEADLO O=c1ccc(-c2ccn3cc[nH+]c3c2)c[nH]1 ZINC001242063303 983281909 /nfs/dbraw/zinc/28/19/09/983281909.db2.gz LNGLLICBJRIBOH-UHFFFAOYSA-N 1 2 211.224 2.102 20 0 BEADLO CC(C)CN1CC[C@H]([NH+]2CCCC2)C(F)(F)C1 ZINC001201482094 983284150 /nfs/dbraw/zinc/28/41/50/983284150.db2.gz DKDFIODLEQIIJR-LBPRGKRZSA-N 1 2 246.345 2.448 20 0 BEADLO CCC[C@H](C)C[NH+]1CC(O)(C(F)(F)F)C1 ZINC001201539062 983294279 /nfs/dbraw/zinc/29/42/79/983294279.db2.gz OPKUAUPIXZWOEJ-QMMMGPOBSA-N 1 2 225.254 2.032 20 0 BEADLO Cc1cnc(C)c(-c2c[nH+]c(N)cc2C)n1 ZINC001242070535 983301592 /nfs/dbraw/zinc/30/15/92/983301592.db2.gz BEVBWOSQCFGKOW-UHFFFAOYSA-N 1 2 214.272 2.046 20 0 BEADLO Cc1cnc(-c2c[nH+]c(N)cc2C)c(F)c1 ZINC001242070549 983305061 /nfs/dbraw/zinc/30/50/61/983305061.db2.gz BVBDBPRBPCHVBE-UHFFFAOYSA-N 1 2 217.247 2.482 20 0 BEADLO c1cn2cc(C3=CCOCC3)ccc2[nH+]1 ZINC001242076154 983320512 /nfs/dbraw/zinc/32/05/12/983320512.db2.gz DGVVZUBKTWZLOD-UHFFFAOYSA-N 1 2 200.241 2.138 20 0 BEADLO CCC(CC)C[N@@H+]1CCC(=O)[C@@H](F)C1 ZINC001201531910 983326694 /nfs/dbraw/zinc/32/66/94/983326694.db2.gz XOEMQIVZHLUHTB-JTQLQIEISA-N 1 2 201.285 2.036 20 0 BEADLO CCC(CC)C[N@H+]1CCC(=O)[C@@H](F)C1 ZINC001201531910 983326696 /nfs/dbraw/zinc/32/66/96/983326696.db2.gz XOEMQIVZHLUHTB-JTQLQIEISA-N 1 2 201.285 2.036 20 0 BEADLO CCCC[C@H](O)CNc1cccc2[nH+]ccn21 ZINC001252078761 983329060 /nfs/dbraw/zinc/32/90/60/983329060.db2.gz YWKHUHDZOPPFPV-NSHDSACASA-N 1 2 233.315 2.297 20 0 BEADLO Fc1ccc(NCc2cccc3[nH+]ccn32)cn1 ZINC001201566504 983334044 /nfs/dbraw/zinc/33/40/44/983334044.db2.gz IBLSEPGLPKUHCE-UHFFFAOYSA-N 1 2 242.257 2.481 20 0 BEADLO CC(C)NC(=S)Nc1ccc2[nH+]ccn2c1 ZINC001200776047 983357516 /nfs/dbraw/zinc/35/75/16/983357516.db2.gz BDPIJAYTDYDXJY-UHFFFAOYSA-N 1 2 234.328 2.029 20 0 BEADLO Cc1cc(-c2ccc(N)[nH+]c2)ccc1O ZINC001242114116 983360214 /nfs/dbraw/zinc/36/02/14/983360214.db2.gz PIPDCXPZXZICAQ-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO CSC[C@@H](C)C(=O)Nc1c(C)c[nH+]cc1C ZINC001355037434 983400615 /nfs/dbraw/zinc/40/06/15/983400615.db2.gz WPBPGCSTBYYZIZ-SNVBAGLBSA-N 1 2 238.356 2.058 20 0 BEADLO c1ccc(CCC[N@@H+]2Cc3cncnc3C2)cc1 ZINC001201652856 983405092 /nfs/dbraw/zinc/40/50/92/983405092.db2.gz LHPIUPPBDUPGQS-UHFFFAOYSA-N 1 2 239.322 2.425 20 0 BEADLO c1ccc(CCC[N@H+]2Cc3cncnc3C2)cc1 ZINC001201652856 983405094 /nfs/dbraw/zinc/40/50/94/983405094.db2.gz LHPIUPPBDUPGQS-UHFFFAOYSA-N 1 2 239.322 2.425 20 0 BEADLO Cc1cc(C)c(NC(=O)[C@H]2C[C@@H](C)CO2)c(C)[nH+]1 ZINC001355891385 983547145 /nfs/dbraw/zinc/54/71/45/983547145.db2.gz LGLYDQROJWTLQU-PRHODGIISA-N 1 2 248.326 2.370 20 0 BEADLO Cc1cc(C)c(NC(=O)COC2CC2)c(C)[nH+]1 ZINC001356376772 983599888 /nfs/dbraw/zinc/59/98/88/983599888.db2.gz LMJVHMMRIUFCJL-UHFFFAOYSA-N 1 2 234.299 2.124 20 0 BEADLO CC(C)OC1C[NH+](Cc2ccc3[nH]cnc3c2)C1 ZINC001137049077 983704895 /nfs/dbraw/zinc/70/48/95/983704895.db2.gz XLJXQEPLCJCVLK-UHFFFAOYSA-N 1 2 245.326 2.172 20 0 BEADLO Cc1[nH+]c(N)ccc1-c1ccn(C(C)C)n1 ZINC001242455236 983756778 /nfs/dbraw/zinc/75/67/78/983756778.db2.gz KSIYTMADZFEYMQ-UHFFFAOYSA-N 1 2 216.288 2.417 20 0 BEADLO Cc1c(-c2cncc(N)c2)ccc2[nH+]ccn21 ZINC001242501266 983824852 /nfs/dbraw/zinc/82/48/52/983824852.db2.gz MOZUGAPDVNKZQM-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO C[C@H](O)c1cccc(-c2ccc[nH+]c2N)c1 ZINC001242551396 983870975 /nfs/dbraw/zinc/87/09/75/983870975.db2.gz XRYIYASLMWECAS-VIFPVBQESA-N 1 2 214.268 2.384 20 0 BEADLO Cc1cc(-c2cccc3c2OCO3)c[nH+]c1N ZINC001242588422 983904711 /nfs/dbraw/zinc/90/47/11/983904711.db2.gz YHTLBEAFLMUIPD-UHFFFAOYSA-N 1 2 228.251 2.368 20 0 BEADLO CC(C)n1cc(C[N@@H+]2C[C@@H](C)[C@@H](F)C2)cn1 ZINC001137073270 983905728 /nfs/dbraw/zinc/90/57/28/983905728.db2.gz XYEOWLBCMKNVNB-PWSUYJOCSA-N 1 2 225.311 2.254 20 0 BEADLO CC(C)n1cc(C[N@H+]2C[C@@H](C)[C@@H](F)C2)cn1 ZINC001137073270 983905740 /nfs/dbraw/zinc/90/57/40/983905740.db2.gz XYEOWLBCMKNVNB-PWSUYJOCSA-N 1 2 225.311 2.254 20 0 BEADLO CC(=O)c1cc(-c2cc[nH+]c(N(C)C)c2)ccn1 ZINC001242610408 983974015 /nfs/dbraw/zinc/97/40/15/983974015.db2.gz LPSLEUFZEFTKTL-UHFFFAOYSA-N 1 2 241.294 2.412 20 0 BEADLO CC[N@H+](Cc1[nH]nc2c1cccc2C)C1COC1 ZINC001137148146 983974474 /nfs/dbraw/zinc/97/44/74/983974474.db2.gz TVPHXTXEAINLKY-UHFFFAOYSA-N 1 2 245.326 2.092 20 0 BEADLO CC[N@@H+](Cc1[nH]nc2c1cccc2C)C1COC1 ZINC001137148146 983974486 /nfs/dbraw/zinc/97/44/86/983974486.db2.gz TVPHXTXEAINLKY-UHFFFAOYSA-N 1 2 245.326 2.092 20 0 BEADLO CCOc1cncc(/C(C)=C/C=C/[NH3+])c1 ZINC001242657158 984026336 /nfs/dbraw/zinc/02/63/36/984026336.db2.gz IPXOTUHNZCQXHE-GQYICFGZSA-N 1 2 204.273 2.356 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(OC(F)(F)F)nc1 ZINC001242778391 984163270 /nfs/dbraw/zinc/16/32/70/984163270.db2.gz DMXYTKKDEASOLH-UHFFFAOYSA-N 1 2 243.188 2.381 20 0 BEADLO Nc1[nH+]cccc1-c1cc(F)c(N)c(F)c1 ZINC001242839382 984187358 /nfs/dbraw/zinc/18/73/58/984187358.db2.gz RVCYLXYVBIIGMA-UHFFFAOYSA-N 1 2 221.210 2.191 20 0 BEADLO Cc1cc[nH+]c(N(C)CCN(C)CC(F)F)c1 ZINC000337934712 984271667 /nfs/dbraw/zinc/27/16/67/984271667.db2.gz IMXGWQSKJQDFQG-UHFFFAOYSA-N 1 2 243.301 2.023 20 0 BEADLO Cc1ccc(-c2ccn3cc(N)[nH+]c3c2)nc1 ZINC001242905706 984275224 /nfs/dbraw/zinc/27/52/24/984275224.db2.gz MBMVMZBAIFYBSM-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO COC(=[NH2+])c1cccc(-c2ccncn2)c1 ZINC001242917619 984290070 /nfs/dbraw/zinc/29/00/70/984290070.db2.gz FJSSRNVOVRGESX-UHFFFAOYSA-N 1 2 213.240 2.115 20 0 BEADLO Cc1cc(-c2ccncn2)cn2cc[nH+]c12 ZINC001242918687 984292366 /nfs/dbraw/zinc/29/23/66/984292366.db2.gz DUJBSKIWAFHAFQ-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO CN(C)c1ccc(-c2ccn3cc[nH+]c3c2)nc1 ZINC001240497708 984305863 /nfs/dbraw/zinc/30/58/63/984305863.db2.gz WSWFAAMEQAPNOV-UHFFFAOYSA-N 1 2 238.294 2.462 20 0 BEADLO COCc1cncc(/C(C)=C/C=C/[NH3+])c1 ZINC001242956058 984319273 /nfs/dbraw/zinc/31/92/73/984319273.db2.gz XAQDMHULMULQRK-OXWOXFIQSA-N 1 2 204.273 2.104 20 0 BEADLO Nc1cn2ccc(-c3cnn4ccccc34)cc2[nH+]1 ZINC001242962674 984326160 /nfs/dbraw/zinc/32/61/60/984326160.db2.gz XOVJAMMIHZAGQV-UHFFFAOYSA-N 1 2 249.277 2.231 20 0 BEADLO Nc1[nH+]cccc1-c1cnccc1Cl ZINC001243042447 984381209 /nfs/dbraw/zinc/38/12/09/984381209.db2.gz CHAURERISDAODM-UHFFFAOYSA-N 1 2 205.648 2.379 20 0 BEADLO Cc1cnccc1C(=O)Nc1c(C)c[nH+]cc1C ZINC001439226581 984384909 /nfs/dbraw/zinc/38/49/09/984384909.db2.gz UAUVXDNPOVJTJG-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO Nc1[nH+]cccc1-c1ccc(F)c(O)c1 ZINC001243050211 984403041 /nfs/dbraw/zinc/40/30/41/984403041.db2.gz SPLPWGQYBGNZND-UHFFFAOYSA-N 1 2 204.204 2.176 20 0 BEADLO CC(=O)Nc1ccc(C)cc1-c1c[nH+]cn1C ZINC001243068450 984487244 /nfs/dbraw/zinc/48/72/44/984487244.db2.gz XSJPNHCXWJCCRH-UHFFFAOYSA-N 1 2 229.283 2.354 20 0 BEADLO Cn1c[nH+]cc1-c1cccc2c1C(C)(C)C(=O)N2 ZINC001243070798 984492661 /nfs/dbraw/zinc/49/26/61/984492661.db2.gz YQLOEUSPYHZJCH-UHFFFAOYSA-N 1 2 241.294 2.317 20 0 BEADLO COC(=O)/C=C/c1ccc(-c2c[nH+]cn2C)cc1 ZINC001243070982 984499793 /nfs/dbraw/zinc/49/97/93/984499793.db2.gz DOFNSXZAIAREHF-VMPITWQZSA-N 1 2 242.278 2.273 20 0 BEADLO CCn1nnc2c1ccc(-c1c[nH+]cn1C)c2C ZINC001243072557 984504831 /nfs/dbraw/zinc/50/48/31/984504831.db2.gz RFPBDJSDCVBQSE-UHFFFAOYSA-N 1 2 241.298 2.160 20 0 BEADLO COc1cnccc1-c1cccc2[nH+]ccn21 ZINC001243072984 984506302 /nfs/dbraw/zinc/50/63/02/984506302.db2.gz LXBGQDPIXSZCIA-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO CC(C)(C)[C@@H]1CCCN1C(=O)CCc1[nH]cc[nH+]1 ZINC001445040190 984584044 /nfs/dbraw/zinc/58/40/44/984584044.db2.gz VHCNWZARPMICRF-NSHDSACASA-N 1 2 249.358 2.379 20 0 BEADLO Cc1cc(-c2ccc[nH+]c2N)ccc1CO ZINC001243199140 984680476 /nfs/dbraw/zinc/68/04/76/984680476.db2.gz BYCGISPHIGIWKX-UHFFFAOYSA-N 1 2 214.268 2.132 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)N[C@@H](C)c1cccs1 ZINC001447759599 984781651 /nfs/dbraw/zinc/78/16/51/984781651.db2.gz MTWHVRIBEJTKGK-VHSXEESVSA-N 1 2 238.356 2.020 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)N[C@@H](C)c1cccs1 ZINC001447759599 984781663 /nfs/dbraw/zinc/78/16/63/984781663.db2.gz MTWHVRIBEJTKGK-VHSXEESVSA-N 1 2 238.356 2.020 20 0 BEADLO CC[NH2+][C@H](C)C(=O)OC[C@H]1CC=CC[C@@H]1C ZINC001577814305 984804840 /nfs/dbraw/zinc/80/48/40/984804840.db2.gz VSLVBBAJLSOGOB-QJPTWQEYSA-N 1 2 225.332 2.130 20 0 BEADLO Nc1ccc(F)c(-c2cc[nH+]c3c2CCN3)c1 ZINC001243286902 984816778 /nfs/dbraw/zinc/81/67/78/984816778.db2.gz HEKHHJQHNKSOGD-UHFFFAOYSA-N 1 2 229.258 2.438 20 0 BEADLO Cc1cc(-c2ccn3cc(N)[nH+]c3c2)cnc1F ZINC001243396478 984886599 /nfs/dbraw/zinc/88/65/99/984886599.db2.gz KDWVCCXIZJAJPM-UHFFFAOYSA-N 1 2 242.257 2.426 20 0 BEADLO Nc1[nH+]cccc1-c1cccc2[nH]cnc21 ZINC001243472283 985017359 /nfs/dbraw/zinc/01/73/59/985017359.db2.gz HCYVRGLOECJNPY-UHFFFAOYSA-N 1 2 210.240 2.207 20 0 BEADLO Nc1[nH+]cccc1-c1cccc2ccc(=O)oc21 ZINC001243475412 985028645 /nfs/dbraw/zinc/02/86/45/985028645.db2.gz YOEDVQDMDRUWDT-UHFFFAOYSA-N 1 2 238.246 2.437 20 0 BEADLO COc1nc(OC)c(-c2ccc[nH+]c2N)cc1C ZINC001243476336 985029872 /nfs/dbraw/zinc/02/98/72/985029872.db2.gz CJNCAOPWRHMTOE-UHFFFAOYSA-N 1 2 245.282 2.051 20 0 BEADLO COC(=O)c1ccc(-c2ccc[nH+]c2N)c(C)c1 ZINC001243474967 985030057 /nfs/dbraw/zinc/03/00/57/985030057.db2.gz UWPMZVOFERMULH-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO Nc1[nH+]cccc1-c1cncc(-c2ncco2)c1 ZINC001243477833 985036321 /nfs/dbraw/zinc/03/63/21/985036321.db2.gz PLGPZTXZSXGJCE-UHFFFAOYSA-N 1 2 238.250 2.381 20 0 BEADLO Nc1[nH+]cccc1-c1cnc(OC2CCC2)nc1 ZINC001243476950 985036399 /nfs/dbraw/zinc/03/63/99/985036399.db2.gz FUAHENDFNQCBNO-UHFFFAOYSA-N 1 2 242.282 2.052 20 0 BEADLO Nc1[nH+]cccc1-c1ccn(C2CCC2)c(=O)c1 ZINC001243477444 985039244 /nfs/dbraw/zinc/03/92/44/985039244.db2.gz OXJSUYPCKVEFSY-UHFFFAOYSA-N 1 2 241.294 2.218 20 0 BEADLO Cc1cc(-c2cccnc2N)c2[nH+]ccn2c1 ZINC001243476605 985039703 /nfs/dbraw/zinc/03/97/03/985039703.db2.gz UFOKNYLDODCWDD-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO Cc1nc2cc(-c3ccc[nH+]c3N)cnc2o1 ZINC001243476919 985039960 /nfs/dbraw/zinc/03/99/60/985039960.db2.gz FYRKRLZHQKVHBI-UHFFFAOYSA-N 1 2 226.239 2.175 20 0 BEADLO Nc1cn2ccc(-c3cccc(O)c3F)cc2[nH+]1 ZINC001243545116 985083324 /nfs/dbraw/zinc/08/33/24/985083324.db2.gz SCRUDECUPMSGQO-UHFFFAOYSA-N 1 2 243.241 2.428 20 0 BEADLO Cc1[nH]c([C@@H]2CCCN2C(=O)C2CC2)[nH+]c1C ZINC001455768160 985092670 /nfs/dbraw/zinc/09/26/70/985092670.db2.gz YWLAHJCOBRNTIK-NSHDSACASA-N 1 2 233.315 2.100 20 0 BEADLO Cc1cc(-c2cccc(O)c2F)c[nH+]c1N ZINC001243547206 985100244 /nfs/dbraw/zinc/10/02/44/985100244.db2.gz MYLXLEXUGNHTRB-UHFFFAOYSA-N 1 2 218.231 2.484 20 0 BEADLO CCc1[nH]c(CNC(=O)CCC(C)(F)F)c[nH+]1 ZINC001456140443 985117995 /nfs/dbraw/zinc/11/79/95/985117995.db2.gz BVUSMUWJQFHCKT-UHFFFAOYSA-N 1 2 245.273 2.024 20 0 BEADLO CCc1[nH]cc(CNC(=O)CCC(C)(F)F)[nH+]1 ZINC001456140443 985118003 /nfs/dbraw/zinc/11/80/03/985118003.db2.gz BVUSMUWJQFHCKT-UHFFFAOYSA-N 1 2 245.273 2.024 20 0 BEADLO Cc1ccc(C[NH2+]Cc2ccn(C)n2)c(F)c1 ZINC000686498316 985123814 /nfs/dbraw/zinc/12/38/14/985123814.db2.gz KNHHCLKMOYJQCJ-UHFFFAOYSA-N 1 2 233.290 2.157 20 0 BEADLO Cn1cnc(-c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001243657991 985156366 /nfs/dbraw/zinc/15/63/66/985156366.db2.gz DXLIIBIQYRORLN-UHFFFAOYSA-N 1 2 238.294 2.332 20 0 BEADLO Cc1nocc1-c1c[nH+]c(N(C)C)cc1C ZINC001243674797 985168377 /nfs/dbraw/zinc/16/83/77/985168377.db2.gz BLWYFHFWNUHSSG-UHFFFAOYSA-N 1 2 217.272 2.419 20 0 BEADLO Cc1cc(CO)cc(-c2cc[nH+]c(N)c2)c1 ZINC001243699344 985231329 /nfs/dbraw/zinc/23/13/29/985231329.db2.gz XWEMSSRHCJNLEG-UHFFFAOYSA-N 1 2 214.268 2.132 20 0 BEADLO Cc1cc(CO)cc(-c2ccc(C)c(N)[nH+]2)c1 ZINC001243701872 985235674 /nfs/dbraw/zinc/23/56/74/985235674.db2.gz UHLJFJJZEHVLDB-UHFFFAOYSA-N 1 2 228.295 2.440 20 0 BEADLO O=c1cccc(-c2ccn3cc[nH+]c3c2)[nH]1 ZINC001243736707 985269576 /nfs/dbraw/zinc/26/95/76/985269576.db2.gz FWORRFRZBLPCNS-UHFFFAOYSA-N 1 2 211.224 2.102 20 0 BEADLO CO[C@H]1CC=C(c2cccc(N)[nH+]2)CC1 ZINC001243805464 985379292 /nfs/dbraw/zinc/37/92/92/985379292.db2.gz GZQMJQPFCCTKFF-JTQLQIEISA-N 1 2 204.273 2.246 20 0 BEADLO CO[C@H]1CC=C(c2nc3[nH]ccc3c[nH+]2)CC1 ZINC001243810041 985399995 /nfs/dbraw/zinc/39/99/95/985399995.db2.gz UPAMRVCFMSUPQL-NSHDSACASA-N 1 2 229.283 2.492 20 0 BEADLO CCc1cn(CC(=O)N[C@H]2CCCC[C@@H]2C)c[nH+]1 ZINC001459257924 985418667 /nfs/dbraw/zinc/41/86/67/985418667.db2.gz DOBUIDXIASHGIJ-AAEUAGOBSA-N 1 2 249.358 2.140 20 0 BEADLO CCc1cn(CN(C)C(=O)OCC(C)C)c[nH+]1 ZINC001459259699 985421849 /nfs/dbraw/zinc/42/18/49/985421849.db2.gz JBLJUSBFYZBUSX-UHFFFAOYSA-N 1 2 239.319 2.127 20 0 BEADLO CCc1cn(Cc2cccc(NC(C)=O)c2)c[nH+]1 ZINC001459263031 985430722 /nfs/dbraw/zinc/43/07/22/985430722.db2.gz QXOKTHMACQRZTE-UHFFFAOYSA-N 1 2 243.310 2.452 20 0 BEADLO C[C@@H]1COC[C@H]1Nc1ccc(N2CCCC2)[nH+]c1 ZINC000687997214 985452692 /nfs/dbraw/zinc/45/26/92/985452692.db2.gz PAFRQLYYKZJERW-DGCLKSJQSA-N 1 2 247.342 2.129 20 0 BEADLO CNc1cc(-c2ccc(CCO)cc2)cc[nH+]1 ZINC001243849753 985474108 /nfs/dbraw/zinc/47/41/08/985474108.db2.gz TUIVVPHWHNWMOP-UHFFFAOYSA-N 1 2 228.295 2.325 20 0 BEADLO FC(F)(F)c1cc(C2=C[NH2+]CCC2)ncn1 ZINC001243947510 985620075 /nfs/dbraw/zinc/62/00/75/985620075.db2.gz KDQOCTCVVUIVEM-UHFFFAOYSA-N 1 2 229.205 2.220 20 0 BEADLO Cc1nnc(C2=C[NH2+]CCC2)c(C)c1C ZINC001243949142 985634402 /nfs/dbraw/zinc/63/44/02/985634402.db2.gz JFDWSSCGWKSPSU-UHFFFAOYSA-N 1 2 203.289 2.126 20 0 BEADLO CC(C)(C)c1cc(C2=C[NH2+]CCC2)ncn1 ZINC001243949593 985638753 /nfs/dbraw/zinc/63/87/53/985638753.db2.gz VDDTUUSPEWKEJY-UHFFFAOYSA-N 1 2 217.316 2.498 20 0 BEADLO C[C@H]1CCc2nnc(C3=C[NH2+]CCC3)cc2C1 ZINC001243949945 985641084 /nfs/dbraw/zinc/64/10/84/985641084.db2.gz PPXHTTKYYPTMLU-JTQLQIEISA-N 1 2 229.327 2.326 20 0 BEADLO CCCn1ncc(C[N@@H+]2CC[C@H](F)C2)c1C ZINC001138638053 985653575 /nfs/dbraw/zinc/65/35/75/985653575.db2.gz YWMRTOOFZUEYPN-LBPRGKRZSA-N 1 2 225.311 2.145 20 0 BEADLO CCCn1ncc(C[N@H+]2CC[C@H](F)C2)c1C ZINC001138638053 985653588 /nfs/dbraw/zinc/65/35/88/985653588.db2.gz YWMRTOOFZUEYPN-LBPRGKRZSA-N 1 2 225.311 2.145 20 0 BEADLO Cc1ccc(C[N@@H+]2CCCOCC2)c(Cl)n1 ZINC000688550282 985676995 /nfs/dbraw/zinc/67/69/95/985676995.db2.gz GYDJGTNVNAOQMO-UHFFFAOYSA-N 1 2 240.734 2.266 20 0 BEADLO Cc1ccc(C[N@H+]2CCCOCC2)c(Cl)n1 ZINC000688550282 985677016 /nfs/dbraw/zinc/67/70/16/985677016.db2.gz GYDJGTNVNAOQMO-UHFFFAOYSA-N 1 2 240.734 2.266 20 0 BEADLO c1nnc(C[N@H+](C2CC2)C2CCCCC2)[nH]1 ZINC001327547288 985687859 /nfs/dbraw/zinc/68/78/59/985687859.db2.gz UIQUTUMPHVMPOH-UHFFFAOYSA-N 1 2 220.320 2.102 20 0 BEADLO c1nnc(C[N@@H+](C2CC2)C2CCCCC2)[nH]1 ZINC001327547288 985687866 /nfs/dbraw/zinc/68/78/66/985687866.db2.gz UIQUTUMPHVMPOH-UHFFFAOYSA-N 1 2 220.320 2.102 20 0 BEADLO COc1cc(O)ccc1-c1ccc[nH+]c1N ZINC001243977919 985704723 /nfs/dbraw/zinc/70/47/23/985704723.db2.gz CLAASDIDTIDSDX-UHFFFAOYSA-N 1 2 216.240 2.045 20 0 BEADLO Cc1nn(C)c2cc(-c3c[nH+]cn3C)ccc12 ZINC001244227330 985896818 /nfs/dbraw/zinc/89/68/18/985896818.db2.gz BTRKGIRJFBKMAN-UHFFFAOYSA-N 1 2 226.283 2.282 20 0 BEADLO CCc1cc(-c2ccc[nH+]c2N)ccc1N ZINC001244293701 985933591 /nfs/dbraw/zinc/93/35/91/985933591.db2.gz MMIRFDKCFMUBST-UHFFFAOYSA-N 1 2 213.284 2.475 20 0 BEADLO CCc1[nH+]ccc(C)c1Nc1cnc(N)nc1 ZINC001212962319 985969315 /nfs/dbraw/zinc/96/93/15/985969315.db2.gz MFLMMPZKPCMLKQ-UHFFFAOYSA-N 1 2 229.287 2.068 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCCC[C@](C)(F)C2)n1 ZINC001138935040 986031106 /nfs/dbraw/zinc/03/11/06/986031106.db2.gz ALEKXXCMVHZSLP-LBPRGKRZSA-N 1 2 225.311 2.432 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCCC[C@](C)(F)C2)n1 ZINC001138935040 986031123 /nfs/dbraw/zinc/03/11/23/986031123.db2.gz ALEKXXCMVHZSLP-LBPRGKRZSA-N 1 2 225.311 2.432 20 0 BEADLO CC[N@H+](C)c1ccc(Nc2cnc(N)nc2)cc1 ZINC001212968313 986085084 /nfs/dbraw/zinc/08/50/84/986085084.db2.gz VRNKNLJTESQFTJ-UHFFFAOYSA-N 1 2 243.314 2.259 20 0 BEADLO CC[N@@H+](C)c1ccc(Nc2cnc(N)nc2)cc1 ZINC001212968313 986085092 /nfs/dbraw/zinc/08/50/92/986085092.db2.gz VRNKNLJTESQFTJ-UHFFFAOYSA-N 1 2 243.314 2.259 20 0 BEADLO Cc1ccc(-c2c[nH+]c(N)c(C)c2)c(CO)c1 ZINC001244490577 986199545 /nfs/dbraw/zinc/19/95/45/986199545.db2.gz PISBINYVQFPCNX-UHFFFAOYSA-N 1 2 228.295 2.440 20 0 BEADLO C[C@@H]1CCC[C@H]([N@@H+]2CCC(=O)[C@@H](F)C2)C1 ZINC001258826548 986289603 /nfs/dbraw/zinc/28/96/03/986289603.db2.gz KGRIBISIFFDBSB-VWYCJHECSA-N 1 2 213.296 2.178 20 0 BEADLO C[C@@H]1CCC[C@H]([N@H+]2CCC(=O)[C@@H](F)C2)C1 ZINC001258826548 986289612 /nfs/dbraw/zinc/28/96/12/986289612.db2.gz KGRIBISIFFDBSB-VWYCJHECSA-N 1 2 213.296 2.178 20 0 BEADLO COC1(C)C[NH+](Cc2ccc3c(c2)C[C@H](C)O3)C1 ZINC001462211154 986313071 /nfs/dbraw/zinc/31/30/71/986313071.db2.gz VMRDSAZRLZWJEY-NSHDSACASA-N 1 2 247.338 2.231 20 0 BEADLO COc1ncc(-c2ccn3cc[nH+]c3c2)cc1O ZINC001244845644 986393331 /nfs/dbraw/zinc/39/33/31/986393331.db2.gz XBUIXPMWJLACIO-UHFFFAOYSA-N 1 2 241.250 2.111 20 0 BEADLO COc1ccc(-c2c[nH+]c(N)c(C)c2)cc1N ZINC001244894909 986423215 /nfs/dbraw/zinc/42/32/15/986423215.db2.gz HFELEVGXSPWQHB-UHFFFAOYSA-N 1 2 229.283 2.230 20 0 BEADLO C[C@H]([NH2+]C[C@]1(C)CC1(F)F)C(=O)OC(C)(C)C ZINC000689354737 986539251 /nfs/dbraw/zinc/53/92/51/986539251.db2.gz HLWKLHGUIVTFTH-KWQFWETISA-N 1 2 249.301 2.352 20 0 BEADLO CNc1cc(-c2cnc3c(c2)ncn3C)cc[nH+]1 ZINC001244973967 986552090 /nfs/dbraw/zinc/55/20/90/986552090.db2.gz TZVQOXMPWNTPSD-UHFFFAOYSA-N 1 2 239.282 2.072 20 0 BEADLO CNc1cc(-c2cccc3[nH+]ccn32)ccn1 ZINC001244974011 986555242 /nfs/dbraw/zinc/55/52/42/986555242.db2.gz UKSWPIILISHXKV-UHFFFAOYSA-N 1 2 224.267 2.438 20 0 BEADLO CNc1cc(-c2cc[nH+]c(NC)c2)ccn1 ZINC001244977090 986566904 /nfs/dbraw/zinc/56/69/04/986566904.db2.gz QYJXHYMLWCANOS-UHFFFAOYSA-N 1 2 214.272 2.227 20 0 BEADLO CNc1cc(-c2cc[nH+]c3c2CCN3)ccn1 ZINC001244978577 986567817 /nfs/dbraw/zinc/56/78/17/986567817.db2.gz UVEMEZULTKUGJS-UHFFFAOYSA-N 1 2 226.283 2.153 20 0 BEADLO C[C@H]1CCN(c2cc(N)nc[nH+]2)CC12CCC2 ZINC001262689332 986598790 /nfs/dbraw/zinc/59/87/90/986598790.db2.gz WPSONQZRJNOWNV-JTQLQIEISA-N 1 2 232.331 2.075 20 0 BEADLO c1cn2ccc(C3=CCCOC3)cc2[nH+]1 ZINC001245157859 986690045 /nfs/dbraw/zinc/69/00/45/986690045.db2.gz JKQLPVGWWDMPPZ-UHFFFAOYSA-N 1 2 200.241 2.138 20 0 BEADLO COc1cc2[nH+]c[nH]c2cc1C1=CCCOC1 ZINC001245160481 986709008 /nfs/dbraw/zinc/70/90/08/986709008.db2.gz KVZSMTJVDNRVQX-UHFFFAOYSA-N 1 2 230.267 2.375 20 0 BEADLO CC(C)CNC(=S)Nc1cccc2[nH+]ccn21 ZINC001245202967 986725039 /nfs/dbraw/zinc/72/50/39/986725039.db2.gz QLQUOILTEKSESG-UHFFFAOYSA-N 1 2 248.355 2.277 20 0 BEADLO CC[N@H+](Cc1[nH]c(C)cc1C)[C@@H](C)C(=O)OC ZINC001137333787 986797988 /nfs/dbraw/zinc/79/79/88/986797988.db2.gz SGCKGHOHHCLHNA-NSHDSACASA-N 1 2 238.331 2.015 20 0 BEADLO CC[N@@H+](Cc1[nH]c(C)cc1C)[C@@H](C)C(=O)OC ZINC001137333787 986797997 /nfs/dbraw/zinc/79/79/97/986797997.db2.gz SGCKGHOHHCLHNA-NSHDSACASA-N 1 2 238.331 2.015 20 0 BEADLO Nc1cn2ccc(-c3c[nH]c4cnccc43)cc2[nH+]1 ZINC001245395082 986832145 /nfs/dbraw/zinc/83/21/45/986832145.db2.gz UQZYJNFRZINVPP-UHFFFAOYSA-N 1 2 249.277 2.460 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1ccc(C(C)(C)C)[nH]1 ZINC001137372238 986834911 /nfs/dbraw/zinc/83/49/11/986834911.db2.gz NRVRGSNAMSFWOO-UHFFFAOYSA-N 1 2 222.332 2.333 20 0 BEADLO CC(=O)C[N@H+](C)Cc1ccc(C(C)(C)C)[nH]1 ZINC001137372238 986834915 /nfs/dbraw/zinc/83/49/15/986834915.db2.gz NRVRGSNAMSFWOO-UHFFFAOYSA-N 1 2 222.332 2.333 20 0 BEADLO Cc1c(N)c(F)ccc1-c1ccc(N)[nH+]c1 ZINC001245461283 986857540 /nfs/dbraw/zinc/85/75/40/986857540.db2.gz BZBKIIKAIAPADY-UHFFFAOYSA-N 1 2 217.247 2.361 20 0 BEADLO C[C@H]1CC[N@@H+]([C@@H]2CCSC2)CC1(F)F ZINC001255282966 986889200 /nfs/dbraw/zinc/88/92/00/986889200.db2.gz XULWRCLHNWUXAC-DTWKUNHWSA-N 1 2 221.316 2.469 20 0 BEADLO C[C@H]1CC[N@H+]([C@@H]2CCSC2)CC1(F)F ZINC001255282966 986889206 /nfs/dbraw/zinc/88/92/06/986889206.db2.gz XULWRCLHNWUXAC-DTWKUNHWSA-N 1 2 221.316 2.469 20 0 BEADLO Nc1ncc(-c2ccc3[nH+]ccn3c2)cc1F ZINC001245521512 986900237 /nfs/dbraw/zinc/90/02/37/986900237.db2.gz ZIXCCHYAMUDQTP-UHFFFAOYSA-N 1 2 228.230 2.118 20 0 BEADLO Cc1cc(-c2ccc3c(c2)NC(=O)C3)c[nH+]c1N ZINC001245535795 986910267 /nfs/dbraw/zinc/91/02/67/986910267.db2.gz ABMQYQBDWDMMDB-UHFFFAOYSA-N 1 2 239.278 2.134 20 0 BEADLO Cc1nc2[nH]ccc2c(-c2c[nH+]c(N)c(C)c2)n1 ZINC001245536259 986914382 /nfs/dbraw/zinc/91/43/82/986914382.db2.gz NOBPEWUFPBTNFR-UHFFFAOYSA-N 1 2 239.282 2.171 20 0 BEADLO Cc1cc(-c2cncnc2C2CC2)c[nH+]c1N ZINC001245538481 986918390 /nfs/dbraw/zinc/91/83/90/986918390.db2.gz KZWSAXGIBJJSIX-UHFFFAOYSA-N 1 2 226.283 2.307 20 0 BEADLO CCCC[C@@H](C)[N@@H+]1C[C@H](F)C[C@H]1C(=O)OC ZINC001255324064 986919015 /nfs/dbraw/zinc/91/90/15/986919015.db2.gz YZPMTWKXZZURSA-MXWKQRLJSA-N 1 2 231.311 2.151 20 0 BEADLO CCCC[C@@H](C)[N@H+]1C[C@H](F)C[C@H]1C(=O)OC ZINC001255324064 986919024 /nfs/dbraw/zinc/91/90/24/986919024.db2.gz YZPMTWKXZZURSA-MXWKQRLJSA-N 1 2 231.311 2.151 20 0 BEADLO Cc1cc(-c2cccc3c2NC(=O)C3)c[nH+]c1N ZINC001245537512 986921066 /nfs/dbraw/zinc/92/10/66/986921066.db2.gz QUJMBFPVWYMWIP-UHFFFAOYSA-N 1 2 239.278 2.134 20 0 BEADLO Cc1cc(-c2ccc(C(N)=O)cc2C)c[nH+]c1N ZINC001245539081 986923734 /nfs/dbraw/zinc/92/37/34/986923734.db2.gz FPMXRHSCLMTAHL-UHFFFAOYSA-N 1 2 241.294 2.047 20 0 BEADLO Cc1cc(-c2cnccc2F)c[nH+]c1N ZINC001245539739 986927212 /nfs/dbraw/zinc/92/72/12/986927212.db2.gz XZMYDXUUOVVWBC-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO Cc1cc(-c2cc3n[nH]nc3cc2F)c[nH+]c1N ZINC001245539595 986928395 /nfs/dbraw/zinc/92/83/95/986928395.db2.gz WNSQDVRFOMSGMT-UHFFFAOYSA-N 1 2 243.245 2.050 20 0 BEADLO CSc1ncc(-c2c[nH+]c(N)c(C)c2)c(C)n1 ZINC001245541072 986929059 /nfs/dbraw/zinc/92/90/59/986929059.db2.gz KMEFNRRQFRPTHI-UHFFFAOYSA-N 1 2 246.339 2.460 20 0 BEADLO COc1ccnc(F)c1-c1c[nH+]c(N)c(C)c1 ZINC001245541129 986929198 /nfs/dbraw/zinc/92/91/98/986929198.db2.gz LVDHURPAKIUOJK-UHFFFAOYSA-N 1 2 233.246 2.182 20 0 BEADLO O=C1Cc2ccc(-c3cccn4cc[nH+]c34)cc2N1 ZINC001245895106 987114708 /nfs/dbraw/zinc/11/47/08/987114708.db2.gz ZQXBSQGYAFMYST-UHFFFAOYSA-N 1 2 249.273 2.496 20 0 BEADLO CCCC(=O)N1CCC[C@@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001471860490 987139210 /nfs/dbraw/zinc/13/92/10/987139210.db2.gz ZQKCYMSLXILUJA-LLVKDONJSA-N 1 2 235.331 2.490 20 0 BEADLO Cc1ccccc1C1=NN(CC[NH+](C)C)C(=O)C1 ZINC001245935605 987200238 /nfs/dbraw/zinc/20/02/38/987200238.db2.gz HLVZUXLXGKJETC-UHFFFAOYSA-N 1 2 245.326 2.126 20 0 BEADLO Cc1ccccc1-c1cc(=O)n(CC[NH+](C)C)[nH]1 ZINC001245935605 987200250 /nfs/dbraw/zinc/20/02/50/987200250.db2.gz HLVZUXLXGKJETC-UHFFFAOYSA-N 1 2 245.326 2.126 20 0 BEADLO C[C@@H]1C[C@@H]1c1nnc([C@@H]2CC3CC[NH+]2CC3)o1 ZINC001256611687 987248017 /nfs/dbraw/zinc/24/80/17/987248017.db2.gz YDUNHLCBVYBDHM-MIMYLULJSA-N 1 2 233.315 2.350 20 0 BEADLO C[C@@H]1C[C@H]1c1nnc([C@H]2CCCC[N@@H+]2C)o1 ZINC001256657960 987264174 /nfs/dbraw/zinc/26/41/74/987264174.db2.gz NIMNEKRHECVWNP-OPRDCNLKSA-N 1 2 221.304 2.350 20 0 BEADLO C[C@@H]1C[C@H]1c1nnc([C@H]2CCCC[N@H+]2C)o1 ZINC001256657960 987264191 /nfs/dbraw/zinc/26/41/91/987264191.db2.gz NIMNEKRHECVWNP-OPRDCNLKSA-N 1 2 221.304 2.350 20 0 BEADLO Nc1[nH+]cccc1CNc1nc(Cl)cs1 ZINC001472785468 987281197 /nfs/dbraw/zinc/28/11/97/987281197.db2.gz FAOREMYUQNMFDC-UHFFFAOYSA-N 1 2 240.719 2.386 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@H]2CCCc3cccnc32)n1 ZINC000693488093 987309242 /nfs/dbraw/zinc/30/92/42/987309242.db2.gz WBQCOAXAMPFEDL-LBPRGKRZSA-N 1 2 242.326 2.280 20 0 BEADLO CS[C@@H]1CC[C@@H](Nc2cc[nH+]cc2F)C1 ZINC000699602467 987377558 /nfs/dbraw/zinc/37/75/58/987377558.db2.gz VLHLAHFQDNZGAW-RKDXNWHRSA-N 1 2 226.320 2.339 20 0 BEADLO C[C@@H](C(=O)N1C2CCCC1CCC2)n1cc[nH+]c1 ZINC001116127684 987451659 /nfs/dbraw/zinc/45/16/59/987451659.db2.gz JYPZSXXEYUEGNW-HIFPTAJRSA-N 1 2 247.342 2.378 20 0 BEADLO CC[C@@H]1CCC[C@@H]1NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001116252936 987495467 /nfs/dbraw/zinc/49/54/67/987495467.db2.gz QXTHZJKYVPNNCQ-UTUOFQBUSA-N 1 2 235.331 2.139 20 0 BEADLO Cc1cc(NC(=O)[C@@H](C)n2cc[nH+]c2)ccc1O ZINC001116343776 987527529 /nfs/dbraw/zinc/52/75/29/987527529.db2.gz JXMSNCQBDAHWQM-SNVBAGLBSA-N 1 2 245.282 2.097 20 0 BEADLO COCCC[N@@H+]1CC(F)(F)CC[C@H]1C ZINC001473880387 987603552 /nfs/dbraw/zinc/60/35/52/987603552.db2.gz YIHQRRMYMLOMCE-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO COCCC[N@H+]1CC(F)(F)CC[C@H]1C ZINC001473880387 987603556 /nfs/dbraw/zinc/60/35/56/987603556.db2.gz YIHQRRMYMLOMCE-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO Cc1cc(C[NH2+]Cc2cc3cnccc3o2)no1 ZINC001473955012 987623569 /nfs/dbraw/zinc/62/35/69/987623569.db2.gz LWDZUIUFQBXUNQ-UHFFFAOYSA-N 1 2 243.266 2.414 20 0 BEADLO CC(C)c1nnc([C@@H](C)[NH2+]Cc2cccnc2)[nH]1 ZINC001474100002 987642948 /nfs/dbraw/zinc/64/29/48/987642948.db2.gz NUQJULQJVXZBMQ-SNVBAGLBSA-N 1 2 245.330 2.174 20 0 BEADLO Nc1c(F)cccc1C[NH2+]Cc1ncccc1F ZINC001474135446 987647045 /nfs/dbraw/zinc/64/70/45/987647045.db2.gz VFSSMKBAEYSLFS-UHFFFAOYSA-N 1 2 249.264 2.232 20 0 BEADLO CCCc1ncc(C[NH2+]Cc2cnsc2)o1 ZINC001474145698 987650284 /nfs/dbraw/zinc/65/02/84/987650284.db2.gz VXEJRCCKQXOKQH-UHFFFAOYSA-N 1 2 237.328 2.373 20 0 BEADLO CC[C@@H](NCc1[nH]c(C)c(C)[nH+]1)C(F)(F)F ZINC001474306448 987682355 /nfs/dbraw/zinc/68/23/55/987682355.db2.gz LZOVCHZCYWNDMN-MRVPVSSYSA-N 1 2 235.253 2.457 20 0 BEADLO Nc1[nH+]cccc1CNc1cccc2c1OCO2 ZINC001474437803 987722429 /nfs/dbraw/zinc/72/24/29/987722429.db2.gz QJAANRIXDKGIGK-UHFFFAOYSA-N 1 2 243.266 2.005 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H](C)Cc1ccc(C)cc1 ZINC001116866498 987739414 /nfs/dbraw/zinc/73/94/14/987739414.db2.gz ZTHUPMBTONSMIK-NWDGAFQWSA-N 1 2 235.327 2.077 20 0 BEADLO CCCC1CCN(C(=O)CCc2c[nH]c[nH+]2)CC1 ZINC001116879340 987746430 /nfs/dbraw/zinc/74/64/30/987746430.db2.gz XHUQBUYXLAEEBB-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO CCCC1CCN(C(=O)CCc2c[nH+]c[nH]2)CC1 ZINC001116879340 987746437 /nfs/dbraw/zinc/74/64/37/987746437.db2.gz XHUQBUYXLAEEBB-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO CCC1CCC(N[C@H]2C[NH2+]CC2(F)F)CC1 ZINC001246457825 987816420 /nfs/dbraw/zinc/81/64/20/987816420.db2.gz FCGDLJXMUHPIOT-ILDUYXDCSA-N 1 2 232.318 2.152 20 0 BEADLO CCC1CCC([NH2+][C@H]2CNCC2(F)F)CC1 ZINC001246457825 987816423 /nfs/dbraw/zinc/81/64/23/987816423.db2.gz FCGDLJXMUHPIOT-ILDUYXDCSA-N 1 2 232.318 2.152 20 0 BEADLO CCc1nc(C[N@@H+](CC)C(C)(C)C)no1 ZINC001117752407 987890217 /nfs/dbraw/zinc/89/02/17/987890217.db2.gz ZYDDZCUYGUIIAL-UHFFFAOYSA-N 1 2 211.309 2.252 20 0 BEADLO CCc1nc(C[N@H+](CC)C(C)(C)C)no1 ZINC001117752407 987890224 /nfs/dbraw/zinc/89/02/24/987890224.db2.gz ZYDDZCUYGUIIAL-UHFFFAOYSA-N 1 2 211.309 2.252 20 0 BEADLO O=C(NC/C=C\C1CC1)c1cccc2[nH+]ccn21 ZINC001117771762 987900254 /nfs/dbraw/zinc/90/02/54/987900254.db2.gz PIJQXXNHDJPQGI-IHWYPQMZSA-N 1 2 241.294 2.030 20 0 BEADLO CC(=O)c1ccc(C[N@H+](C)Cc2cn[nH]c2)cc1 ZINC001117798998 987924049 /nfs/dbraw/zinc/92/40/49/987924049.db2.gz LBOIDFCEYIQDMB-UHFFFAOYSA-N 1 2 243.310 2.244 20 0 BEADLO CC(=O)c1ccc(C[N@@H+](C)Cc2cn[nH]c2)cc1 ZINC001117798998 987924056 /nfs/dbraw/zinc/92/40/56/987924056.db2.gz LBOIDFCEYIQDMB-UHFFFAOYSA-N 1 2 243.310 2.244 20 0 BEADLO C[NH+](C)Cc1nnc(/C=C\c2ccccc2F)o1 ZINC001322338332 988213166 /nfs/dbraw/zinc/21/31/66/988213166.db2.gz BHRGMEHMLYRKAE-FPLPWBNLSA-N 1 2 247.273 2.441 20 0 BEADLO Cc1ccc(CCc2nnc(C[NH+](C)C)o2)cc1 ZINC001322582461 988336777 /nfs/dbraw/zinc/33/67/77/988336777.db2.gz KHKPQKNIMGJVSD-UHFFFAOYSA-N 1 2 245.326 2.225 20 0 BEADLO C[C@H]1CCCC[C@@H]1c1nnc(C[NH+](C)C)o1 ZINC001118433569 988344791 /nfs/dbraw/zinc/34/47/91/988344791.db2.gz VWYHBWWKJFTSGA-UWVGGRQHSA-N 1 2 223.320 2.425 20 0 BEADLO C[C@H]([NH2+][C@@H]1C[C@@H](C)n2ncnc21)c1cncs1 ZINC001118489106 988379080 /nfs/dbraw/zinc/37/90/80/988379080.db2.gz DHLRYYNDFLMPJR-HRDYMLBCSA-N 1 2 249.343 2.091 20 0 BEADLO C[C@H]1CCC[C@@H](c2nnc(C[NH+](C)C)o2)C1 ZINC001322984491 988422541 /nfs/dbraw/zinc/42/25/41/988422541.db2.gz VLELNKARCDMCDA-VHSXEESVSA-N 1 2 223.320 2.425 20 0 BEADLO CC(C)OC(=O)C[N@@H+]1Cc2ccccc2C[C@H]1C ZINC001323150894 988456979 /nfs/dbraw/zinc/45/69/79/988456979.db2.gz BTOSVNOAIXKZTJ-GFCCVEGCSA-N 1 2 247.338 2.385 20 0 BEADLO CC(C)OC(=O)C[N@H+]1Cc2ccccc2C[C@H]1C ZINC001323150894 988456987 /nfs/dbraw/zinc/45/69/87/988456987.db2.gz BTOSVNOAIXKZTJ-GFCCVEGCSA-N 1 2 247.338 2.385 20 0 BEADLO C[C@H](C(=O)N1CCC[C@@H](C)[C@@H]1C)n1cc[nH+]c1 ZINC001323146507 988459763 /nfs/dbraw/zinc/45/97/63/988459763.db2.gz QDDPVDAGJGGBAZ-GRYCIOLGSA-N 1 2 235.331 2.091 20 0 BEADLO CCCCCC[C@@H](CC)N1CC[NH2+][C@@H](CO)C1 ZINC001246800119 988478590 /nfs/dbraw/zinc/47/85/90/988478590.db2.gz YLAYHSVTUCILMK-ZIAGYGMSSA-N 1 2 242.407 2.002 20 0 BEADLO CCC(C)(C)[C@H](C)NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001118727367 988527155 /nfs/dbraw/zinc/52/71/55/988527155.db2.gz YOEVFLSCOYUVMQ-QWRGUYRKSA-N 1 2 237.347 2.385 20 0 BEADLO Cc1ccc(C)c(CN(C)c2cc(N)nc[nH+]2)c1 ZINC001548515825 988677308 /nfs/dbraw/zinc/67/73/08/988677308.db2.gz KVKDPFSBFPWUKM-UHFFFAOYSA-N 1 2 242.326 2.312 20 0 BEADLO COC[C@H](CC(C)C)[NH2+][C@H](C)c1noc(C)n1 ZINC001324047802 988681050 /nfs/dbraw/zinc/68/10/50/988681050.db2.gz SWYXWBZDXSTEDY-KOLCDFICSA-N 1 2 241.335 2.090 20 0 BEADLO Cc1cc(C[NH+]2CCC(C3CC3)CC2)n[nH]1 ZINC001324158171 988731145 /nfs/dbraw/zinc/73/11/45/988731145.db2.gz GZGPTTGPENCMGU-UHFFFAOYSA-N 1 2 219.332 2.340 20 0 BEADLO CCC1(NC(=O)[C@H](C)n2cc[nH+]c2)CCCC1 ZINC001324542456 988868745 /nfs/dbraw/zinc/86/87/45/988868745.db2.gz LYCDDGWDGLTWAD-NSHDSACASA-N 1 2 235.331 2.283 20 0 BEADLO Cc1nnc(C[NH2+]Cc2cccn2C2CC2)s1 ZINC001119289270 988887267 /nfs/dbraw/zinc/88/72/67/988887267.db2.gz NEXXEXAALVPTAF-UHFFFAOYSA-N 1 2 248.355 2.273 20 0 BEADLO CC1(C)CCC[C@@H](C[N@@H+]2CCn3cncc3C2)O1 ZINC001119311852 988931362 /nfs/dbraw/zinc/93/13/62/988931362.db2.gz FUEFUZNPCZZHDT-ZDUSSCGKSA-N 1 2 249.358 2.046 20 0 BEADLO CC1(C)CCC[C@@H](C[N@H+]2CCn3cncc3C2)O1 ZINC001119311852 988931382 /nfs/dbraw/zinc/93/13/82/988931382.db2.gz FUEFUZNPCZZHDT-ZDUSSCGKSA-N 1 2 249.358 2.046 20 0 BEADLO Cc1[nH+]cc(NC(=S)NCC(C)(C)C)n1C ZINC001247943495 989042778 /nfs/dbraw/zinc/04/27/78/989042778.db2.gz GZNOCHKDAWOTGE-UHFFFAOYSA-N 1 2 240.376 2.061 20 0 BEADLO CO[C@H](C)[C@H]([NH3+])c1nc(-c2ccccc2C)no1 ZINC001247960868 989050062 /nfs/dbraw/zinc/05/00/62/989050062.db2.gz GFTPSGRHZMNFBU-KOLCDFICSA-N 1 2 247.298 2.080 20 0 BEADLO c1cc(C[N@H+](C2CC2)C2COC2)n(C2CC2)c1 ZINC001325129086 989092998 /nfs/dbraw/zinc/09/29/98/989092998.db2.gz UGFSPHIRPPORLY-UHFFFAOYSA-N 1 2 232.327 2.186 20 0 BEADLO c1cc(C[N@@H+](C2CC2)C2COC2)n(C2CC2)c1 ZINC001325129086 989093010 /nfs/dbraw/zinc/09/30/10/989093010.db2.gz UGFSPHIRPPORLY-UHFFFAOYSA-N 1 2 232.327 2.186 20 0 BEADLO Cc1noc2ccc(C[N@@H+]3CCO[C@@H](C)C3)cc12 ZINC001248690178 989125623 /nfs/dbraw/zinc/12/56/23/989125623.db2.gz JBTMYPIVQKHMFT-JTQLQIEISA-N 1 2 246.310 2.357 20 0 BEADLO Cc1noc2ccc(C[N@H+]3CCO[C@@H](C)C3)cc12 ZINC001248690178 989125628 /nfs/dbraw/zinc/12/56/28/989125628.db2.gz JBTMYPIVQKHMFT-JTQLQIEISA-N 1 2 246.310 2.357 20 0 BEADLO CC[C@H](C)[C@H]([NH2+]C/C=C\C1CC1)C(=O)OC ZINC001119560397 989163386 /nfs/dbraw/zinc/16/33/86/989163386.db2.gz QSNWMURMAMKWBP-DZGUGMOBSA-N 1 2 225.332 2.130 20 0 BEADLO Cc1ccc2[nH]c(C[N@@H+]3CCCOCC3)nc2c1 ZINC001248839663 989193974 /nfs/dbraw/zinc/19/39/74/989193974.db2.gz SHVFCVJPBUYIOQ-UHFFFAOYSA-N 1 2 245.326 2.094 20 0 BEADLO Cc1ccc2[nH]c(C[N@H+]3CCCOCC3)nc2c1 ZINC001248839663 989193980 /nfs/dbraw/zinc/19/39/80/989193980.db2.gz SHVFCVJPBUYIOQ-UHFFFAOYSA-N 1 2 245.326 2.094 20 0 BEADLO CC1(C)C[N@H+](Cc2cn(C3CC3)nn2)C1(C)C ZINC001119621689 989251313 /nfs/dbraw/zinc/25/13/13/989251313.db2.gz PYIUCCSETZRRHV-UHFFFAOYSA-N 1 2 234.347 2.233 20 0 BEADLO CC1(C)C[N@@H+](Cc2cn(C3CC3)nn2)C1(C)C ZINC001119621689 989251318 /nfs/dbraw/zinc/25/13/18/989251318.db2.gz PYIUCCSETZRRHV-UHFFFAOYSA-N 1 2 234.347 2.233 20 0 BEADLO CC(C)c1ocnc1C[N@@H+]1CC[C@]12CCOC2 ZINC001325759507 989254707 /nfs/dbraw/zinc/25/47/07/989254707.db2.gz CUZGUWFIJLUUDZ-CYBMUJFWSA-N 1 2 236.315 2.163 20 0 BEADLO CC(C)c1ocnc1C[N@H+]1CC[C@]12CCOC2 ZINC001325759507 989254721 /nfs/dbraw/zinc/25/47/21/989254721.db2.gz CUZGUWFIJLUUDZ-CYBMUJFWSA-N 1 2 236.315 2.163 20 0 BEADLO c1sc(-c2ccncc2)nc1C[NH+]1CCC1 ZINC001249263628 989270030 /nfs/dbraw/zinc/27/00/30/989270030.db2.gz QHSAQDZFZNEMHV-UHFFFAOYSA-N 1 2 231.324 2.411 20 0 BEADLO CC[C@H]1CC[C@H](C(=O)Nc2c(C)c[nH+]cc2C)O1 ZINC001518385930 989300762 /nfs/dbraw/zinc/30/07/62/989300762.db2.gz YERPCFKCGVXDDJ-NWDGAFQWSA-N 1 2 248.326 2.016 20 0 BEADLO Fc1cc2cc[nH]c2c(C[NH+]2CCOCC2)c1 ZINC001249522187 989301255 /nfs/dbraw/zinc/30/12/55/989301255.db2.gz QYOGZRBEEKGSSS-UHFFFAOYSA-N 1 2 234.274 2.139 20 0 BEADLO Cc1ccc[nH+]c1Nc1ccccc1CC(N)=O ZINC001249597893 989323739 /nfs/dbraw/zinc/32/37/39/989323739.db2.gz QDEACXRXRIQDJW-UHFFFAOYSA-N 1 2 241.294 2.161 20 0 BEADLO Cc1c(N)c(F)ccc1Nc1[nH+]cccc1N ZINC001249628845 989325998 /nfs/dbraw/zinc/32/59/98/989325998.db2.gz BIJNFLGASHIXMS-UHFFFAOYSA-N 1 2 232.262 2.437 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ncccn1)c1cccnc1 ZINC001119692623 989337640 /nfs/dbraw/zinc/33/76/40/989337640.db2.gz LFXVREPEXOUZSH-MNOVXSKESA-N 1 2 228.299 2.283 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2cc(C)nnc2C)CCO1 ZINC001119690739 989339553 /nfs/dbraw/zinc/33/95/53/989339553.db2.gz BNVDVEPXDWOPPO-AWEZNQCLSA-N 1 2 249.358 2.094 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2cc(C)nnc2C)CCO1 ZINC001119690739 989339565 /nfs/dbraw/zinc/33/95/65/989339565.db2.gz BNVDVEPXDWOPPO-AWEZNQCLSA-N 1 2 249.358 2.094 20 0 BEADLO CC(C)(COC(=O)CCC(F)F)n1cc[nH+]c1 ZINC001519583186 989435932 /nfs/dbraw/zinc/43/59/32/989435932.db2.gz DWWVYWAXNIHQPP-UHFFFAOYSA-N 1 2 246.257 2.207 20 0 BEADLO C[NH+](C)Cc1nnc(C2C(C)(C)C2(C)C)o1 ZINC001326293204 989471511 /nfs/dbraw/zinc/47/15/11/989471511.db2.gz XIUFOZVEFZEEPQ-UHFFFAOYSA-N 1 2 223.320 2.281 20 0 BEADLO Cc1nn(C)c(C[NH2+]C(C)(C)CF)c1Cl ZINC001119954674 989506763 /nfs/dbraw/zinc/50/67/63/989506763.db2.gz PCSNSJLUXDNXDG-UHFFFAOYSA-N 1 2 233.718 2.220 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@@H](C)c1ccco1 ZINC001520442837 989562754 /nfs/dbraw/zinc/56/27/54/989562754.db2.gz UBKJEYKRKYCMHC-JTQLQIEISA-N 1 2 248.282 2.343 20 0 BEADLO Cc1cscc1CNC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001326672348 989650734 /nfs/dbraw/zinc/65/07/34/989650734.db2.gz VSKJJJLPBNYKLI-SNVBAGLBSA-N 1 2 249.339 2.130 20 0 BEADLO O[C@@H](C[NH2+]CC(F)F)Cc1cccc(Cl)c1 ZINC001120581539 989751326 /nfs/dbraw/zinc/75/13/26/989751326.db2.gz LMYAEKRQBZRQFS-SNVBAGLBSA-N 1 2 249.688 2.098 20 0 BEADLO CCc1ccc(N2CC[C@H](C)[C@@H](CO)C2)[nH+]c1 ZINC001120867318 989934938 /nfs/dbraw/zinc/93/49/38/989934938.db2.gz GHRBPVUMKQRPOH-WCQYABFASA-N 1 2 234.343 2.099 20 0 BEADLO CCc1ccc(N2CCC[C@@](O)(C3CC3)C2)[nH+]c1 ZINC001120947065 989983231 /nfs/dbraw/zinc/98/32/31/989983231.db2.gz WHTRDKHQFPWKOI-HNNXBMFYSA-N 1 2 246.354 2.385 20 0 BEADLO Cc1cc(CNC(=O)c2ccccn2)cc(C)[nH+]1 ZINC001525866502 990081633 /nfs/dbraw/zinc/08/16/33/990081633.db2.gz VZHMLCUJNHWQRO-UHFFFAOYSA-N 1 2 241.294 2.023 20 0 BEADLO C[C@H]1CC[C@H](NC(=O)CCc2[nH+]ccn2C)CC1 ZINC001527680249 990234112 /nfs/dbraw/zinc/23/41/12/990234112.db2.gz OAONPUWEEWJOLO-HAQNSBGRSA-N 1 2 249.358 2.048 20 0 BEADLO CCN(C(=O)CCc1[nH+]ccn1C)C1CCCC1 ZINC001528246216 990278751 /nfs/dbraw/zinc/27/87/51/990278751.db2.gz JQJAAKVLSMYPOD-UHFFFAOYSA-N 1 2 249.358 2.144 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)c1cccs1 ZINC001537885749 990517559 /nfs/dbraw/zinc/51/75/59/990517559.db2.gz ILNPTCCEEAMBTB-UHFFFAOYSA-N 1 2 232.308 2.434 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)Nc1ccccc1F ZINC001540393034 990615119 /nfs/dbraw/zinc/61/51/19/990615119.db2.gz USZDPQAIEKTPSK-VIFPVBQESA-N 1 2 247.273 2.366 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)Nc1ccccc1F ZINC001540393034 990615125 /nfs/dbraw/zinc/61/51/25/990615125.db2.gz USZDPQAIEKTPSK-VIFPVBQESA-N 1 2 247.273 2.366 20 0 BEADLO CCN(C(=O)c1cccc2[nH+]ccn21)C(C)C ZINC001542171575 990659202 /nfs/dbraw/zinc/65/92/02/990659202.db2.gz RSIYUCHATJMZEY-UHFFFAOYSA-N 1 2 231.299 2.205 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1cccc(F)c1C ZINC001544584076 990730661 /nfs/dbraw/zinc/73/06/61/990730661.db2.gz UVZFQBNXEVUIDU-GFCCVEGCSA-N 1 2 236.290 2.167 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1cccc(F)c1C ZINC001544584076 990730666 /nfs/dbraw/zinc/73/06/66/990730666.db2.gz UVZFQBNXEVUIDU-GFCCVEGCSA-N 1 2 236.290 2.167 20 0 BEADLO CC[C@@H]1CCN(C(=O)C[C@@H](C)n2cc[nH+]c2)[C@H]1C ZINC001556272951 990758832 /nfs/dbraw/zinc/75/88/32/990758832.db2.gz JMMDUMQWHOCDHF-FRRDWIJNSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1cccc(C[N@@H+]2C[C@H]3CC[C@@H]2CO3)c1F ZINC001137680137 990840301 /nfs/dbraw/zinc/84/03/01/990840301.db2.gz NZSYLWLPXJHLJG-CHWSQXEVSA-N 1 2 235.302 2.497 20 0 BEADLO Cc1cccc(C[N@H+]2C[C@H]3CC[C@@H]2CO3)c1F ZINC001137680137 990840302 /nfs/dbraw/zinc/84/03/02/990840302.db2.gz NZSYLWLPXJHLJG-CHWSQXEVSA-N 1 2 235.302 2.497 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CC[C@@H](C(C)(C)C)C1 ZINC001137779527 990850053 /nfs/dbraw/zinc/85/00/53/990850053.db2.gz JNWVHGJTUXJTLX-LLVKDONJSA-N 1 2 249.358 2.155 20 0 BEADLO CC(=O)[C@@H]1CC[N@H+](Cc2scnc2Cl)C1 ZINC001137824718 990853789 /nfs/dbraw/zinc/85/37/89/990853789.db2.gz DFPDRHJTKAFSQE-MRVPVSSYSA-N 1 2 244.747 2.207 20 0 BEADLO CC(=O)[C@@H]1CC[N@@H+](Cc2scnc2Cl)C1 ZINC001137824718 990853792 /nfs/dbraw/zinc/85/37/92/990853792.db2.gz DFPDRHJTKAFSQE-MRVPVSSYSA-N 1 2 244.747 2.207 20 0 BEADLO O[C@@H]1CCC[N@H+](Cc2cc(F)cc(F)c2F)C1 ZINC001137867518 990861953 /nfs/dbraw/zinc/86/19/53/990861953.db2.gz ZLJPFKKQCTYAGP-SNVBAGLBSA-N 1 2 245.244 2.061 20 0 BEADLO O[C@@H]1CCC[N@@H+](Cc2cc(F)cc(F)c2F)C1 ZINC001137867518 990861954 /nfs/dbraw/zinc/86/19/54/990861954.db2.gz ZLJPFKKQCTYAGP-SNVBAGLBSA-N 1 2 245.244 2.061 20 0 BEADLO C[N@H+](Cc1cc(F)cc(F)c1F)[C@H]1CCOC1 ZINC001137872433 990865537 /nfs/dbraw/zinc/86/55/37/990865537.db2.gz PORSDWRLVKJPBW-JTQLQIEISA-N 1 2 245.244 2.325 20 0 BEADLO C[N@@H+](Cc1cc(F)cc(F)c1F)[C@H]1CCOC1 ZINC001137872433 990865540 /nfs/dbraw/zinc/86/55/40/990865540.db2.gz PORSDWRLVKJPBW-JTQLQIEISA-N 1 2 245.244 2.325 20 0 BEADLO C[C@]1(O)CC[N@H+](Cc2c(F)ccc(F)c2F)C1 ZINC001137927268 990869469 /nfs/dbraw/zinc/86/94/69/990869469.db2.gz UTEHCRLGIFCSHZ-LBPRGKRZSA-N 1 2 245.244 2.061 20 0 BEADLO C[C@]1(O)CC[N@@H+](Cc2c(F)ccc(F)c2F)C1 ZINC001137927268 990869472 /nfs/dbraw/zinc/86/94/72/990869472.db2.gz UTEHCRLGIFCSHZ-LBPRGKRZSA-N 1 2 245.244 2.061 20 0 BEADLO CO[C@@H]1CC[N@H+](Cc2c(F)ccc(F)c2F)C1 ZINC001137927303 990870753 /nfs/dbraw/zinc/87/07/53/990870753.db2.gz VTOMZUHJCHPIPG-MRVPVSSYSA-N 1 2 245.244 2.325 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2c(F)ccc(F)c2F)C1 ZINC001137927303 990870754 /nfs/dbraw/zinc/87/07/54/990870754.db2.gz VTOMZUHJCHPIPG-MRVPVSSYSA-N 1 2 245.244 2.325 20 0 BEADLO C[C@H](C(=O)NCCCC1CCC1)n1cc[nH+]c1 ZINC001557540426 990895256 /nfs/dbraw/zinc/89/52/56/990895256.db2.gz ULFWBDUCLKXLPX-LLVKDONJSA-N 1 2 235.331 2.141 20 0 BEADLO C[N@H+](Cc1cc(O)cc(O)c1)Cc1ccccn1 ZINC001138323438 990915564 /nfs/dbraw/zinc/91/55/64/990915564.db2.gz VQMKMGNEFVJBFA-UHFFFAOYSA-N 1 2 244.294 2.125 20 0 BEADLO C[N@@H+](Cc1cc(O)cc(O)c1)Cc1ccccn1 ZINC001138323438 990915569 /nfs/dbraw/zinc/91/55/69/990915569.db2.gz VQMKMGNEFVJBFA-UHFFFAOYSA-N 1 2 244.294 2.125 20 0 BEADLO CC[C@H](C)C(=O)NCCCN(C)c1cccc[nH+]1 ZINC001558087725 990921650 /nfs/dbraw/zinc/92/16/50/990921650.db2.gz HRPAKAPKOKMTIE-LBPRGKRZSA-N 1 2 249.358 2.070 20 0 BEADLO Cc1c2ccccc2[nH]c1C[NH+]1CCOCC1 ZINC001138397610 990939724 /nfs/dbraw/zinc/93/97/24/990939724.db2.gz XHCHKOPLHYYCPU-UHFFFAOYSA-N 1 2 230.311 2.309 20 0 BEADLO Cc1cn(C)nc1CNc1ccc(C)[nH+]c1C ZINC001308340408 990970310 /nfs/dbraw/zinc/97/03/10/990970310.db2.gz OBOJVOZREPSURA-UHFFFAOYSA-N 1 2 230.315 2.352 20 0 BEADLO CC(C)C[C@H](C)C[C@H](C)[N@@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001258075095 990971777 /nfs/dbraw/zinc/97/17/77/990971777.db2.gz RCTMZUPEDLDRRA-CYDGBPFRSA-N 1 2 239.359 2.447 20 0 BEADLO CC(C)C[C@H](C)C[C@H](C)[N@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001258075095 990971783 /nfs/dbraw/zinc/97/17/83/990971783.db2.gz RCTMZUPEDLDRRA-CYDGBPFRSA-N 1 2 239.359 2.447 20 0 BEADLO Cc1cc(C[NH+]2CC3(CCO3)C2)c(C)s1 ZINC001138570260 990976239 /nfs/dbraw/zinc/97/62/39/990976239.db2.gz ASPDWJCEGLVAHB-UHFFFAOYSA-N 1 2 223.341 2.340 20 0 BEADLO COC(=O)C1([NH2+][C@H](C)CCC=C(C)C)CC1 ZINC001258077892 990977597 /nfs/dbraw/zinc/97/75/97/990977597.db2.gz FRSKDKVSHDRLGB-LLVKDONJSA-N 1 2 225.332 2.417 20 0 BEADLO Clc1ccc(C[NH2+][C@@H]2CCn3ccnc32)cn1 ZINC001308414109 990989189 /nfs/dbraw/zinc/98/91/89/990989189.db2.gz WKTMLVBLMLJISJ-SNVBAGLBSA-N 1 2 248.717 2.166 20 0 BEADLO Cc1ncc(C[NH2+]Cc2cccnc2Cl)o1 ZINC001308434127 990991165 /nfs/dbraw/zinc/99/11/65/990991165.db2.gz QLRGZWSVSCSSFJ-UHFFFAOYSA-N 1 2 237.690 2.321 20 0 BEADLO CNc1ncccc1C[N@@H+]1CCc2occc2C1 ZINC001138696533 991010344 /nfs/dbraw/zinc/01/03/44/991010344.db2.gz SLMOWRVJECFZPM-UHFFFAOYSA-N 1 2 243.310 2.275 20 0 BEADLO CNc1ncccc1C[N@H+]1CCc2occc2C1 ZINC001138696533 991010356 /nfs/dbraw/zinc/01/03/56/991010356.db2.gz SLMOWRVJECFZPM-UHFFFAOYSA-N 1 2 243.310 2.275 20 0 BEADLO CC1C[NH+](Cc2ccnc(Br)c2)C1 ZINC001138731227 991023042 /nfs/dbraw/zinc/02/30/42/991023042.db2.gz HBGVDYFBOADVRB-UHFFFAOYSA-N 1 2 241.132 2.296 20 0 BEADLO COC1(C)C[NH+](Cc2ccc3c(c2)CCCO3)C1 ZINC001138712961 991015921 /nfs/dbraw/zinc/01/59/21/991015921.db2.gz RFSXBFKCCKWNFJ-UHFFFAOYSA-N 1 2 247.338 2.232 20 0 BEADLO CCOC(=O)CCC[C@H](C)[NH+]1C[C@@H](F)[C@H](F)C1 ZINC001258118038 991020329 /nfs/dbraw/zinc/02/03/29/991020329.db2.gz UTEOKLZKEACOKK-HBNTYKKESA-N 1 2 249.301 2.100 20 0 BEADLO C[C@H]1CC[N@@H+]1Cc1ccnc(Br)c1 ZINC001138731148 991022419 /nfs/dbraw/zinc/02/24/19/991022419.db2.gz BKJVFQRXTZMBTO-QMMMGPOBSA-N 1 2 241.132 2.438 20 0 BEADLO C[C@H]1CC[N@H+]1Cc1ccnc(Br)c1 ZINC001138731148 991022428 /nfs/dbraw/zinc/02/24/28/991022428.db2.gz BKJVFQRXTZMBTO-QMMMGPOBSA-N 1 2 241.132 2.438 20 0 BEADLO COC(=O)C1([NH2+]C2C[C@H](C)C[C@@H](C)C2)CC1 ZINC001258151122 991032964 /nfs/dbraw/zinc/03/29/64/991032964.db2.gz DSXQZYAMQLPYPF-NXEZZACHSA-N 1 2 225.332 2.106 20 0 BEADLO COC(=O)C1([NH2+]C2C[C@@H](C)C[C@H](C)C2)CC1 ZINC001258151125 991033515 /nfs/dbraw/zinc/03/35/15/991033515.db2.gz DSXQZYAMQLPYPF-UWVGGRQHSA-N 1 2 225.332 2.106 20 0 BEADLO CC1(C)C[NH+](Cc2ccnn2[C@H]2CCCCO2)C1 ZINC001138773629 991041308 /nfs/dbraw/zinc/04/13/08/991041308.db2.gz JBVMKPAUDOUWNM-CYBMUJFWSA-N 1 2 249.358 2.424 20 0 BEADLO Fc1ncccc1C[NH+]1CC2(CCC2)C1 ZINC001138783128 991042415 /nfs/dbraw/zinc/04/24/15/991042415.db2.gz LRIBXSZWSMQVIO-UHFFFAOYSA-N 1 2 206.264 2.207 20 0 BEADLO c1cc2cc(C[N@H+]3C[C@H]4C[C@@H](C3)O4)ccc2o1 ZINC001138824591 991077140 /nfs/dbraw/zinc/07/71/40/991077140.db2.gz FNDRKLNXBCWDTH-BETUJISGSA-N 1 2 229.279 2.406 20 0 BEADLO c1cc2cc(C[N@@H+]3C[C@H]4C[C@@H](C3)O4)ccc2o1 ZINC001138824591 991077158 /nfs/dbraw/zinc/07/71/58/991077158.db2.gz FNDRKLNXBCWDTH-BETUJISGSA-N 1 2 229.279 2.406 20 0 BEADLO Fc1cnc(Cl)c(C[NH+]2CCCC2)c1 ZINC001138888590 991096081 /nfs/dbraw/zinc/09/60/81/991096081.db2.gz KUFUFJFWPIQZEI-UHFFFAOYSA-N 1 2 214.671 2.470 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC[C@@H](C(F)F)C2)n1 ZINC001138940584 991107731 /nfs/dbraw/zinc/10/77/31/991107731.db2.gz PKHXIVGKPBNVSY-SECBINFHSA-N 1 2 229.274 2.195 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC[C@@H](C(F)F)C2)n1 ZINC001138940584 991107742 /nfs/dbraw/zinc/10/77/42/991107742.db2.gz PKHXIVGKPBNVSY-SECBINFHSA-N 1 2 229.274 2.195 20 0 BEADLO CCc1cn(CCOCC2CCC2)c[nH+]1 ZINC001559465868 991113397 /nfs/dbraw/zinc/11/33/97/991113397.db2.gz DLRHTJVIFIWTIY-UHFFFAOYSA-N 1 2 208.305 2.262 20 0 BEADLO C[C@H]1[C@@H](O)CC[N@@H+]1Cc1ccc(F)c(F)c1F ZINC001308767427 991123884 /nfs/dbraw/zinc/12/38/84/991123884.db2.gz WWRXJARUTJJILQ-XVKPBYJWSA-N 1 2 245.244 2.059 20 0 BEADLO C[C@H]1[C@@H](O)CC[N@H+]1Cc1ccc(F)c(F)c1F ZINC001308767427 991123891 /nfs/dbraw/zinc/12/38/91/991123891.db2.gz WWRXJARUTJJILQ-XVKPBYJWSA-N 1 2 245.244 2.059 20 0 BEADLO C[C@H]1CC[N@H+](Cc2n[nH]cc2Br)C1 ZINC001139020314 991124713 /nfs/dbraw/zinc/12/47/13/991124713.db2.gz ISPRDDXRLBYDCZ-ZETCQYMHSA-N 1 2 244.136 2.014 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2n[nH]cc2Br)C1 ZINC001139020314 991124719 /nfs/dbraw/zinc/12/47/19/991124719.db2.gz ISPRDDXRLBYDCZ-ZETCQYMHSA-N 1 2 244.136 2.014 20 0 BEADLO CCCCCOC(=O)C[NH2+][C@@H](C)CCSC ZINC001258212905 991132809 /nfs/dbraw/zinc/13/28/09/991132809.db2.gz WCZBPSJIZAHHSF-NSHDSACASA-N 1 2 247.404 2.451 20 0 BEADLO CCCn1cc(C[N@@H+]2CCc3occc3C2)cn1 ZINC001139041505 991132904 /nfs/dbraw/zinc/13/29/04/991132904.db2.gz ICGHUTUHVJHMAH-UHFFFAOYSA-N 1 2 245.326 2.444 20 0 BEADLO CCCn1cc(C[N@H+]2CCc3occc3C2)cn1 ZINC001139041505 991132912 /nfs/dbraw/zinc/13/29/12/991132912.db2.gz ICGHUTUHVJHMAH-UHFFFAOYSA-N 1 2 245.326 2.444 20 0 BEADLO COc1cc(O)ccc1C[NH+]1CC(C(F)F)C1 ZINC001139144184 991165406 /nfs/dbraw/zinc/16/54/06/991165406.db2.gz MNZNGORTYRXGLX-UHFFFAOYSA-N 1 2 243.253 2.098 20 0 BEADLO O=C1CC[NH+](Cc2ccc3cccnc3c2)CC1 ZINC001139165495 991179696 /nfs/dbraw/zinc/17/96/96/991179696.db2.gz CRLPXNDCKZRRRP-UHFFFAOYSA-N 1 2 240.306 2.400 20 0 BEADLO CCc1cnc(C[N@@H+]2CC[C@H]3[C@@H](C2)C3(F)F)o1 ZINC001559665742 991207375 /nfs/dbraw/zinc/20/73/75/991207375.db2.gz QFYPSVPTCYACTN-VHSXEESVSA-N 1 2 242.269 2.324 20 0 BEADLO CCc1cnc(C[N@H+]2CC[C@H]3[C@@H](C2)C3(F)F)o1 ZINC001559665742 991207387 /nfs/dbraw/zinc/20/73/87/991207387.db2.gz QFYPSVPTCYACTN-VHSXEESVSA-N 1 2 242.269 2.324 20 0 BEADLO CC(C)CCc1nnc(CCc2c[nH]c[nH+]2)o1 ZINC001258283515 991215971 /nfs/dbraw/zinc/21/59/71/991215971.db2.gz YRBBVJPRNVPNET-UHFFFAOYSA-N 1 2 234.303 2.167 20 0 BEADLO CCC1(C[N@@H+]2CCCC(F)(F)C2)COC1 ZINC001202911107 991218152 /nfs/dbraw/zinc/21/81/52/991218152.db2.gz BXQPRZNICKQIHB-UHFFFAOYSA-N 1 2 219.275 2.144 20 0 BEADLO CCC1(C[N@H+]2CCCC(F)(F)C2)COC1 ZINC001202911107 991218157 /nfs/dbraw/zinc/21/81/57/991218157.db2.gz BXQPRZNICKQIHB-UHFFFAOYSA-N 1 2 219.275 2.144 20 0 BEADLO CC1(F)CN(Cc2ccc(-n3cc[nH+]c3)cc2)C1 ZINC001139357023 991227808 /nfs/dbraw/zinc/22/78/08/991227808.db2.gz WVNHFFMJZVLLCD-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO CCC1(C[N@@H+]2CC[C@H](C)C(F)(F)C2)COC1 ZINC001202927081 991235276 /nfs/dbraw/zinc/23/52/76/991235276.db2.gz PDCLQGOGOMAUHV-JTQLQIEISA-N 1 2 233.302 2.390 20 0 BEADLO CCC1(C[N@H+]2CC[C@H](C)C(F)(F)C2)COC1 ZINC001202927081 991235285 /nfs/dbraw/zinc/23/52/85/991235285.db2.gz PDCLQGOGOMAUHV-JTQLQIEISA-N 1 2 233.302 2.390 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@H](C)CC(C)(C)SC ZINC001258321851 991247170 /nfs/dbraw/zinc/24/71/70/991247170.db2.gz SCAASVMREKLFIA-BDAKNGLRSA-N 1 2 233.377 2.058 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@H](C)CC(C)(C)SC ZINC001258321503 991248114 /nfs/dbraw/zinc/24/81/14/991248114.db2.gz MYNQCRDQYCXHTB-ZJUUUORDSA-N 1 2 247.404 2.448 20 0 BEADLO O=c1ccc(C[N@H+]2Cc3ccc(F)cc3C2)c[nH]1 ZINC001139468720 991254712 /nfs/dbraw/zinc/25/47/12/991254712.db2.gz PUQDWFDZSMVSRA-UHFFFAOYSA-N 1 2 244.269 2.442 20 0 BEADLO O=c1ccc(C[N@@H+]2Cc3ccc(F)cc3C2)c[nH]1 ZINC001139468720 991254722 /nfs/dbraw/zinc/25/47/22/991254722.db2.gz PUQDWFDZSMVSRA-UHFFFAOYSA-N 1 2 244.269 2.442 20 0 BEADLO COc1ccc(CC[C@@H](C)[N@@H+]2CCC(=O)C2)cc1 ZINC001258408685 991351179 /nfs/dbraw/zinc/35/11/79/991351179.db2.gz LAMNJPRBQOABFS-GFCCVEGCSA-N 1 2 247.338 2.291 20 0 BEADLO COc1ccc(CC[C@@H](C)[N@H+]2CCC(=O)C2)cc1 ZINC001258408685 991351183 /nfs/dbraw/zinc/35/11/83/991351183.db2.gz LAMNJPRBQOABFS-GFCCVEGCSA-N 1 2 247.338 2.291 20 0 BEADLO CCCCC[C@H](CC)[N@@H+]1CCOC(=O)C1 ZINC001258444233 991384964 /nfs/dbraw/zinc/38/49/64/991384964.db2.gz UXZZOOQBBRDQGY-NSHDSACASA-N 1 2 213.321 2.204 20 0 BEADLO CCCCC[C@H](CC)[N@H+]1CCOC(=O)C1 ZINC001258444233 991384969 /nfs/dbraw/zinc/38/49/69/991384969.db2.gz UXZZOOQBBRDQGY-NSHDSACASA-N 1 2 213.321 2.204 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1ccnc(F)c1 ZINC001139830489 991385101 /nfs/dbraw/zinc/38/51/01/991385101.db2.gz BVZFOGKBTZAKKU-PSASIEDQSA-N 1 2 212.243 2.153 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1ccnc(F)c1 ZINC001139830489 991385106 /nfs/dbraw/zinc/38/51/06/991385106.db2.gz BVZFOGKBTZAKKU-PSASIEDQSA-N 1 2 212.243 2.153 20 0 BEADLO CCCCC[C@H](CC)[NH+]1CC(S(C)(=O)=O)C1 ZINC001258445026 991387845 /nfs/dbraw/zinc/38/78/45/991387845.db2.gz DXLXVVDAHAVNDR-NSHDSACASA-N 1 2 247.404 2.074 20 0 BEADLO C[C@@H](C(=O)N1[C@@H](C)CCC1(C)C)n1cc[nH+]c1 ZINC001328408155 991390588 /nfs/dbraw/zinc/39/05/88/991390588.db2.gz WTGAGFGPDJXZKI-QWRGUYRKSA-N 1 2 235.331 2.234 20 0 BEADLO COC(=O)C1(C[N@@H+]2CC(F)(F)CC[C@H]2C)CC1 ZINC001560219107 991420480 /nfs/dbraw/zinc/42/04/80/991420480.db2.gz FZKLMHZYIHSHPD-SECBINFHSA-N 1 2 247.285 2.059 20 0 BEADLO COC(=O)C1(C[N@H+]2CC(F)(F)CC[C@H]2C)CC1 ZINC001560219107 991420482 /nfs/dbraw/zinc/42/04/82/991420482.db2.gz FZKLMHZYIHSHPD-SECBINFHSA-N 1 2 247.285 2.059 20 0 BEADLO COc1cc(C[NH2+][C@H](C)c2ncccc2C)on1 ZINC001560221305 991427450 /nfs/dbraw/zinc/42/74/50/991427450.db2.gz RGXCIZWGNRTJTG-SNVBAGLBSA-N 1 2 247.298 2.237 20 0 BEADLO Fc1ccc2c(c1)C[N@@H+](Cc1ccnnc1)CC2 ZINC001139983929 991460990 /nfs/dbraw/zinc/46/09/90/991460990.db2.gz QMPGCNDGCXIJFS-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1ccc2c(c1)C[N@H+](Cc1ccnnc1)CC2 ZINC001139983929 991460994 /nfs/dbraw/zinc/46/09/94/991460994.db2.gz QMPGCNDGCXIJFS-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO C[N@H+](Cc1cc2ccccc2cn1)C1(C)COC1 ZINC001139998868 991473705 /nfs/dbraw/zinc/47/37/05/991473705.db2.gz IWXVYUPINNUYMG-UHFFFAOYSA-N 1 2 242.322 2.456 20 0 BEADLO C[N@@H+](Cc1cc2ccccc2cn1)C1(C)COC1 ZINC001139998868 991473712 /nfs/dbraw/zinc/47/37/12/991473712.db2.gz IWXVYUPINNUYMG-UHFFFAOYSA-N 1 2 242.322 2.456 20 0 BEADLO CC[N@H+](C)Cc1nnc(Cc2cccc(F)c2)o1 ZINC001258514043 991474409 /nfs/dbraw/zinc/47/44/09/991474409.db2.gz MVLFFCKEWADRMW-UHFFFAOYSA-N 1 2 249.289 2.251 20 0 BEADLO CC[N@@H+](C)Cc1nnc(Cc2cccc(F)c2)o1 ZINC001258514043 991474416 /nfs/dbraw/zinc/47/44/16/991474416.db2.gz MVLFFCKEWADRMW-UHFFFAOYSA-N 1 2 249.289 2.251 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc(O)cc2F)C[C@@H]1F ZINC001140124200 991522813 /nfs/dbraw/zinc/52/28/13/991522813.db2.gz FBNAGLPZASMEST-PELKAZGASA-N 1 2 227.254 2.321 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc(O)cc2F)C[C@@H]1F ZINC001140124200 991522825 /nfs/dbraw/zinc/52/28/25/991522825.db2.gz FBNAGLPZASMEST-PELKAZGASA-N 1 2 227.254 2.321 20 0 BEADLO Cc1[nH]ncc1C[NH2+]C[C@H]1OCc2ccccc21 ZINC001560620507 991523827 /nfs/dbraw/zinc/52/38/27/991523827.db2.gz ZYOYNDWDBZPQEY-CQSZACIVSA-N 1 2 243.310 2.079 20 0 BEADLO C[C@H](CCc1ccccc1)C[NH2+]Cc1ncn[nH]1 ZINC001560626753 991529488 /nfs/dbraw/zinc/52/94/88/991529488.db2.gz ZPJBICCXVRIWDV-GFCCVEGCSA-N 1 2 244.342 2.163 20 0 BEADLO C[N@H+](Cc1ccncc1)Cc1cccc(F)n1 ZINC001140131605 991534402 /nfs/dbraw/zinc/53/44/02/991534402.db2.gz PCFYXTBQEYSOHK-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[N@@H+](Cc1ccncc1)Cc1cccc(F)n1 ZINC001140131605 991534412 /nfs/dbraw/zinc/53/44/12/991534412.db2.gz PCFYXTBQEYSOHK-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO COc1nsc(C[NH+]2CCCC2)c1Cl ZINC001560714353 991566876 /nfs/dbraw/zinc/56/68/76/991566876.db2.gz HDGLOEVIYMNAPP-UHFFFAOYSA-N 1 2 232.736 2.401 20 0 BEADLO Cc1ccc2n[nH]c(C[N@H+](C)CCF)c2c1 ZINC001140331823 991610508 /nfs/dbraw/zinc/61/05/08/991610508.db2.gz NUZHSKSJHUPPPB-UHFFFAOYSA-N 1 2 221.279 2.273 20 0 BEADLO Cc1ccc2n[nH]c(C[N@@H+](C)CCF)c2c1 ZINC001140331823 991610515 /nfs/dbraw/zinc/61/05/15/991610515.db2.gz NUZHSKSJHUPPPB-UHFFFAOYSA-N 1 2 221.279 2.273 20 0 BEADLO COc1ccccc1C[N@H+](C)Cc1ccncn1 ZINC001140346872 991613804 /nfs/dbraw/zinc/61/38/04/991613804.db2.gz XFLNNQNEQUHYJC-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1ccccc1C[N@@H+](C)Cc1ccncn1 ZINC001140346872 991613810 /nfs/dbraw/zinc/61/38/10/991613810.db2.gz XFLNNQNEQUHYJC-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1ccccc1OC(=O)[C@H](C)n1cc[nH+]c1 ZINC001318095795 991621051 /nfs/dbraw/zinc/62/10/51/991621051.db2.gz AVSOFSAVBJGFFW-JTQLQIEISA-N 1 2 246.266 2.058 20 0 BEADLO Fc1cccc2c1CC[N@H+](Cc1ccncn1)C2 ZINC001140350712 991625452 /nfs/dbraw/zinc/62/54/52/991625452.db2.gz PAFNZSADYNPJSL-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1cccc2c1CC[N@@H+](Cc1ccncn1)C2 ZINC001140350712 991625458 /nfs/dbraw/zinc/62/54/58/991625458.db2.gz PAFNZSADYNPJSL-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO COCCC1(C)C[NH+](Cc2cn(C3CC3)cn2)C1 ZINC001560876216 991635913 /nfs/dbraw/zinc/63/59/13/991635913.db2.gz AZPBBHUVVBRLRC-UHFFFAOYSA-N 1 2 249.358 2.076 20 0 BEADLO Cc1ccc(Cl)nc1C[N@@H+](C)C1(C)COC1 ZINC001140443937 991641365 /nfs/dbraw/zinc/64/13/65/991641365.db2.gz FVIUINVXZHONJM-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO Cc1ccc(Cl)nc1C[N@H+](C)C1(C)COC1 ZINC001140443937 991641368 /nfs/dbraw/zinc/64/13/68/991641368.db2.gz FVIUINVXZHONJM-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO Cc1ccc2c(c1)CC[C@@H]2Nc1cc(N)nc[nH+]1 ZINC001318278183 991642108 /nfs/dbraw/zinc/64/21/08/991642108.db2.gz ZTYORJAHVMISPU-LBPRGKRZSA-N 1 2 240.310 2.467 20 0 BEADLO CC(C)CCCC[NH2+]C1(c2ncon2)CC1 ZINC001561022304 991690773 /nfs/dbraw/zinc/69/07/73/991690773.db2.gz MGMGQIRQVHLHED-UHFFFAOYSA-N 1 2 223.320 2.475 20 0 BEADLO CS[C@@H]1CC[C@H]([N@H+](C)Cc2noc(C)n2)C1 ZINC001318784537 991716127 /nfs/dbraw/zinc/71/61/27/991716127.db2.gz LXEDGSRCHLCHET-VHSXEESVSA-N 1 2 241.360 2.094 20 0 BEADLO CS[C@@H]1CC[C@H]([N@@H+](C)Cc2noc(C)n2)C1 ZINC001318784537 991716138 /nfs/dbraw/zinc/71/61/38/991716138.db2.gz LXEDGSRCHLCHET-VHSXEESVSA-N 1 2 241.360 2.094 20 0 BEADLO CC[C@@H]1C[C@H](C)CN1C(=O)[C@H](C)n1cc[nH+]c1 ZINC001318941922 991746226 /nfs/dbraw/zinc/74/62/26/991746226.db2.gz QJSHPXLIEUXLQA-SDDRHHMPSA-N 1 2 235.331 2.091 20 0 BEADLO CC[C@@H](C)C[C@H](CC)[NH2+]C1(C(=O)OC)CC1 ZINC001258779138 991746537 /nfs/dbraw/zinc/74/65/37/991746537.db2.gz UMYAGQWAFXJSAH-MNOVXSKESA-N 1 2 227.348 2.496 20 0 BEADLO CC[C@@H](C)C[C@@H](CC)[NH+]1CC(F)(CO)C1 ZINC001258790138 991773806 /nfs/dbraw/zinc/77/38/06/991773806.db2.gz IXIODSFKDSJRDI-GHMZBOCLSA-N 1 2 217.328 2.217 20 0 BEADLO CC[C@@H](C)C[C@H](CC)[NH+]1CC(F)(CO)C1 ZINC001258790139 991777570 /nfs/dbraw/zinc/77/75/70/991777570.db2.gz IXIODSFKDSJRDI-MNOVXSKESA-N 1 2 217.328 2.217 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C(C)C)C1CCC1 ZINC001565902483 991816672 /nfs/dbraw/zinc/81/66/72/991816672.db2.gz SHXBWBJZKDGAQF-UHFFFAOYSA-N 1 2 235.331 2.050 20 0 BEADLO C[C@H]1CCC[C@H]([NH+]2CC(O)(C(F)(F)F)C2)C1 ZINC001258820211 991840874 /nfs/dbraw/zinc/84/08/74/991840874.db2.gz VRSQQKCHSHCKQR-IUCAKERBSA-N 1 2 237.265 2.174 20 0 BEADLO CCOC=CC(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC001566328974 991842253 /nfs/dbraw/zinc/84/22/53/991842253.db2.gz KDXPBCBPPSGDCA-SREVYHEPSA-N 1 2 245.282 2.360 20 0 BEADLO C[C@@H]1CCC[C@@H]([N@@H+]2CCC(=O)[C@@H](F)C2)C1 ZINC001258826543 991849489 /nfs/dbraw/zinc/84/94/89/991849489.db2.gz KGRIBISIFFDBSB-MXWKQRLJSA-N 1 2 213.296 2.178 20 0 BEADLO C[C@@H]1CCC[C@@H]([N@H+]2CCC(=O)[C@@H](F)C2)C1 ZINC001258826543 991849494 /nfs/dbraw/zinc/84/94/94/991849494.db2.gz KGRIBISIFFDBSB-MXWKQRLJSA-N 1 2 213.296 2.178 20 0 BEADLO CC(C)c1ocnc1C[N@H+](C)CC1(CO)CC1 ZINC001320858034 992383326 /nfs/dbraw/zinc/38/33/26/992383326.db2.gz VWZDJFJXZLIOIJ-UHFFFAOYSA-N 1 2 238.331 2.002 20 0 BEADLO CC(C)c1ocnc1C[N@@H+](C)CC1(CO)CC1 ZINC001320858034 992383335 /nfs/dbraw/zinc/38/33/35/992383335.db2.gz VWZDJFJXZLIOIJ-UHFFFAOYSA-N 1 2 238.331 2.002 20 0 BEADLO CCC(C)(C)Cc1nnc(C[NH+](C)C)o1 ZINC001261570158 992387754 /nfs/dbraw/zinc/38/77/54/992387754.db2.gz HIMJPDGBVADAOH-UHFFFAOYSA-N 1 2 211.309 2.110 20 0 BEADLO Cn1c[nH+]cc1CCCSC1=NCCS1 ZINC001261591251 992413164 /nfs/dbraw/zinc/41/31/64/992413164.db2.gz BEORDCFXZHXQIL-UHFFFAOYSA-N 1 2 241.385 2.189 20 0 BEADLO CCC[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1nc[nH]n1 ZINC001261637798 992428866 /nfs/dbraw/zinc/42/88/66/992428866.db2.gz GRCMRNQNWXVMHL-WDEREUQCSA-N 1 2 222.336 2.205 20 0 BEADLO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cc1nc[nH]n1 ZINC001261637798 992428874 /nfs/dbraw/zinc/42/88/74/992428874.db2.gz GRCMRNQNWXVMHL-WDEREUQCSA-N 1 2 222.336 2.205 20 0 BEADLO C[C@@H](C(=O)N(C)[C@@H]1CCC(C)(C)C1)n1cc[nH+]c1 ZINC001321216970 992490821 /nfs/dbraw/zinc/49/08/21/992490821.db2.gz IVVXIPACMXMALZ-NWDGAFQWSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@@H](CNC(=O)[C@H](C)n1cc[nH+]c1)C(C)(C)C ZINC001262126369 992689699 /nfs/dbraw/zinc/68/96/99/992689699.db2.gz CYULJRIWOJJNHG-QWRGUYRKSA-N 1 2 237.347 2.243 20 0 BEADLO C[C@H](C(=O)NC[C@@H](C)C(C)(C)C)n1cc[nH+]c1 ZINC001262126367 992690682 /nfs/dbraw/zinc/69/06/82/992690682.db2.gz CYULJRIWOJJNHG-GHMZBOCLSA-N 1 2 237.347 2.243 20 0 BEADLO O=C(CC[NH2+]CC(F)F)Nc1ccccc1F ZINC001262565666 992919488 /nfs/dbraw/zinc/91/94/88/992919488.db2.gz TUIJIFWZMITKRZ-UHFFFAOYSA-N 1 2 246.232 2.009 20 0 BEADLO CCC[C@@H]1CCCN1C(=O)CCc1c[nH]c[nH+]1 ZINC001262646500 992995677 /nfs/dbraw/zinc/99/56/77/992995677.db2.gz DYHXGTINEKOJNQ-GFCCVEGCSA-N 1 2 235.331 2.133 20 0 BEADLO CCC[C@@H]1CCCN1C(=O)CCc1c[nH+]c[nH]1 ZINC001262646500 992995686 /nfs/dbraw/zinc/99/56/86/992995686.db2.gz DYHXGTINEKOJNQ-GFCCVEGCSA-N 1 2 235.331 2.133 20 0 BEADLO CCc1ccc(N2CCC(OC)CC2)[nH+]c1 ZINC001262677069 993019137 /nfs/dbraw/zinc/01/91/37/993019137.db2.gz BENFOIMFRVIYRB-UHFFFAOYSA-N 1 2 220.316 2.259 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@H]([C@@H](C)O)C2)[nH+]1 ZINC001262688400 993030645 /nfs/dbraw/zinc/03/06/45/993030645.db2.gz PNKIEYFRYHZEGD-MNOVXSKESA-N 1 2 238.306 2.126 20 0 BEADLO CC(C)=CCC[C@@H](C)NC(=O)C[C@H]([NH3+])C(F)F ZINC001575390019 993034565 /nfs/dbraw/zinc/03/45/65/993034565.db2.gz NUXIHBDPLFCIBD-ZJUUUORDSA-N 1 2 248.317 2.220 20 0 BEADLO CC[C@@H]([NH2+][C@H]1C[C@@H]2CCCC[C@@H]21)c1c[nH]nn1 ZINC001576290050 993258975 /nfs/dbraw/zinc/25/89/75/993258975.db2.gz KUJFFHNSEOJNEI-YFKTTZPYSA-N 1 2 234.347 2.424 20 0 BEADLO CC[C@@H]([NH2+][C@H]1C[C@@H]2CCCC[C@@H]21)c1cn[nH]n1 ZINC001576290050 993258985 /nfs/dbraw/zinc/25/89/85/993258985.db2.gz KUJFFHNSEOJNEI-YFKTTZPYSA-N 1 2 234.347 2.424 20 0 BEADLO CC[C@@H]([NH2+][C@@H]1C[C@@H]2CCCC[C@H]12)c1c[nH]nn1 ZINC001576290049 993259211 /nfs/dbraw/zinc/25/92/11/993259211.db2.gz KUJFFHNSEOJNEI-NNYUYHANSA-N 1 2 234.347 2.424 20 0 BEADLO CC[C@@H]([NH2+][C@@H]1C[C@@H]2CCCC[C@H]12)c1cn[nH]n1 ZINC001576290049 993259215 /nfs/dbraw/zinc/25/92/15/993259215.db2.gz KUJFFHNSEOJNEI-NNYUYHANSA-N 1 2 234.347 2.424 20 0 BEADLO CC[C@@H](F)C(=O)OCc1cccc2[nH+]ccn21 ZINC001263416195 993295013 /nfs/dbraw/zinc/29/50/13/993295013.db2.gz ZKYJEGSFSOWXID-SNVBAGLBSA-N 1 2 236.246 2.126 20 0 BEADLO CCn1c[nH+]cc1COC(=O)c1occ(C)c1C ZINC001263662923 993455223 /nfs/dbraw/zinc/45/52/23/993455223.db2.gz OWWVAOASTRQHRM-UHFFFAOYSA-N 1 2 248.282 2.470 20 0 BEADLO C/C(=C/C(C)(C)C)C(=O)NCCc1[nH+]ccn1C ZINC001263920546 993601747 /nfs/dbraw/zinc/60/17/47/993601747.db2.gz KXUXLGLRSAWYAC-KHPPLWFESA-N 1 2 249.358 2.071 20 0 BEADLO CN(C)c1ccc(Nc2cccc(N)c2)c[nH+]1 ZINC000387219093 993706479 /nfs/dbraw/zinc/70/64/79/993706479.db2.gz SBUOEDBESSHVMG-UHFFFAOYSA-N 1 2 228.299 2.473 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1ccc(Cl)cc1 ZINC001290165989 994530256 /nfs/dbraw/zinc/53/02/56/994530256.db2.gz RBYOOIHAMMDVJI-NSHDSACASA-N 1 2 238.718 2.373 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1ccc(Cl)cc1 ZINC001290165989 994530262 /nfs/dbraw/zinc/53/02/62/994530262.db2.gz RBYOOIHAMMDVJI-NSHDSACASA-N 1 2 238.718 2.373 20 0 BEADLO CC[C@@H]1CCC[C@H](NC(=O)Cc2[nH]c[nH+]c2C)C1 ZINC001293702018 994660429 /nfs/dbraw/zinc/66/04/29/994660429.db2.gz GRKYTGVGVSRADO-NEPJUHHUSA-N 1 2 249.358 2.346 20 0 BEADLO CCC[C@H]1CCCN(C(=O)Cc2[nH]c[nH+]c2C)C1 ZINC001294686845 994711697 /nfs/dbraw/zinc/71/16/97/994711697.db2.gz LDVIPXOVFRUKHZ-LBPRGKRZSA-N 1 2 249.358 2.299 20 0 BEADLO CC[C@@H]1CC[C@H](C)N(C(=O)[C@H](C)n2cc[nH+]c2)C1 ZINC001297836025 994885345 /nfs/dbraw/zinc/88/53/45/994885345.db2.gz LZHPDEYDDADXMJ-RWMBFGLXSA-N 1 2 249.358 2.481 20 0 BEADLO C=C/C=C/CCNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001303176439 995139989 /nfs/dbraw/zinc/13/99/89/995139989.db2.gz LQVCAIIWWTUUSN-ONEGZZNKSA-N 1 2 241.294 2.425 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)[C@@H]2C[C@@H]2C(C)C)[nH+]1 ZINC001304108354 995188427 /nfs/dbraw/zinc/18/84/27/995188427.db2.gz UGRYTYBKDYBLAN-VXGBXAGGSA-N 1 2 249.358 2.441 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)[C@@H]2C[C@@H]2C(C)C)c[nH+]1 ZINC001304108354 995188433 /nfs/dbraw/zinc/18/84/33/995188433.db2.gz UGRYTYBKDYBLAN-VXGBXAGGSA-N 1 2 249.358 2.441 20 0 BEADLO Cc1nc(Cl)cc(NCc2ccc[nH+]c2N)n1 ZINC001307123372 995289928 /nfs/dbraw/zinc/28/99/28/995289928.db2.gz JZPQJTQCISZELH-UHFFFAOYSA-N 1 2 249.705 2.028 20 0 BEADLO CCc1cn(CC(=O)Nc2ccc(C)cc2)c[nH+]1 ZINC001307397505 995342938 /nfs/dbraw/zinc/34/29/38/995342938.db2.gz QSOUTZCLRYJCKI-UHFFFAOYSA-N 1 2 243.310 2.393 20 0 BEADLO C[C@H](O)C[N@H+](C)Cc1nccc(Cl)c1Cl ZINC001307480962 995374529 /nfs/dbraw/zinc/37/45/29/995374529.db2.gz WUOVQJBACQERSL-ZETCQYMHSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@H](O)C[N@@H+](C)Cc1nccc(Cl)c1Cl ZINC001307480962 995374537 /nfs/dbraw/zinc/37/45/37/995374537.db2.gz WUOVQJBACQERSL-ZETCQYMHSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@H](c1ncccn1)[N@@H+]1CC[C@H]2[C@@H](C1)C2(F)F ZINC001307596195 995412403 /nfs/dbraw/zinc/41/24/03/995412403.db2.gz HMPSEPBCOPHQCF-KXUCPTDWSA-N 1 2 239.269 2.125 20 0 BEADLO C[C@H](c1ncccn1)[N@H+]1CC[C@H]2[C@@H](C1)C2(F)F ZINC001307596195 995412409 /nfs/dbraw/zinc/41/24/09/995412409.db2.gz HMPSEPBCOPHQCF-KXUCPTDWSA-N 1 2 239.269 2.125 20 0 BEADLO CCn1ccnc1[C@H](C)[NH2+]Cc1ccc(F)nc1 ZINC001620936012 1170171103 /nfs/dbraw/zinc/17/11/03/1170171103.db2.gz NZHKZPLENCBXMD-JTQLQIEISA-N 1 2 248.305 2.288 20 0 BEADLO C=C/C=C\CC(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC001626175161 1170193316 /nfs/dbraw/zinc/19/33/16/1170193316.db2.gz ROVSJUQHNVXJCV-ARJAWSKDSA-N 1 2 245.326 2.179 20 0 BEADLO CCCCc1noc(Cn2c[nH+]c(CC)c2)n1 ZINC001614960486 1170501978 /nfs/dbraw/zinc/50/19/78/1170501978.db2.gz MUOTUMYPOONKQL-UHFFFAOYSA-N 1 2 234.303 2.219 20 0 BEADLO CCn1ccc(C[NH2+][C@@H](C)c2ccccn2)n1 ZINC001620695585 1170706431 /nfs/dbraw/zinc/70/64/31/1170706431.db2.gz ZVKXMAOAFUAHLD-NSHDSACASA-N 1 2 230.315 2.149 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)[C@H]1CCC[C@H](C)C1 ZINC001623929410 1170986045 /nfs/dbraw/zinc/98/60/45/1170986045.db2.gz FXIFJFLBJVQBKW-JQWIXIFHSA-N 1 2 249.358 2.298 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)[C@H]1CCC(C)(C)C1 ZINC001626777743 1171135203 /nfs/dbraw/zinc/13/52/03/1171135203.db2.gz CLKWRHIFXMQCHS-NSHDSACASA-N 1 2 249.358 2.298 20 0 BEADLO CC(C)c1coc(NC(=O)[C@@H](C)n2cc[nH+]c2)n1 ZINC001627978697 1171196261 /nfs/dbraw/zinc/19/62/61/1171196261.db2.gz LRPBDPDFBGZUNJ-SECBINFHSA-N 1 2 248.286 2.194 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1ccc(C)cc1C ZINC001628533470 1171246853 /nfs/dbraw/zinc/24/68/53/1171246853.db2.gz QEGSWMOPFQUYID-CYBMUJFWSA-N 1 2 232.327 2.336 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1ccc(C)cc1C ZINC001628533470 1171246857 /nfs/dbraw/zinc/24/68/57/1171246857.db2.gz QEGSWMOPFQUYID-CYBMUJFWSA-N 1 2 232.327 2.336 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1cc(C)cc(F)c1 ZINC001630048225 1171366515 /nfs/dbraw/zinc/36/65/15/1171366515.db2.gz HHUBFURZQGRBFI-GFCCVEGCSA-N 1 2 236.290 2.167 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1cc(C)cc(F)c1 ZINC001630048225 1171366520 /nfs/dbraw/zinc/36/65/20/1171366520.db2.gz HHUBFURZQGRBFI-GFCCVEGCSA-N 1 2 236.290 2.167 20 0 BEADLO CCOc1cccc(NC(=O)[C@H]2CC[N@@H+]2CC)c1 ZINC001630609574 1171406827 /nfs/dbraw/zinc/40/68/27/1171406827.db2.gz AOWNKLNBACTDRE-CYBMUJFWSA-N 1 2 248.326 2.118 20 0 BEADLO CCOc1cccc(NC(=O)[C@H]2CC[N@H+]2CC)c1 ZINC001630609574 1171406831 /nfs/dbraw/zinc/40/68/31/1171406831.db2.gz AOWNKLNBACTDRE-CYBMUJFWSA-N 1 2 248.326 2.118 20 0 BEADLO C[C@H](NC(=O)[C@H](C)n1cc[nH+]c1)c1cccs1 ZINC000044817668 1171414782 /nfs/dbraw/zinc/41/47/82/1171414782.db2.gz XCUJASHLSHFQDP-UWVGGRQHSA-N 1 2 249.339 2.383 20 0 BEADLO C[C@H](C(=O)N(C)Cc1ccsc1)n1cc[nH+]c1 ZINC000044946230 1171427672 /nfs/dbraw/zinc/42/76/72/1171427672.db2.gz VTMVLJPUMXCBSY-SNVBAGLBSA-N 1 2 249.339 2.164 20 0 BEADLO CC(C)CC[C@@H](C)NC(=O)[C@H](C)n1cc[nH+]c1 ZINC000045879003 1171467235 /nfs/dbraw/zinc/46/72/35/1171467235.db2.gz CJYUHUPCWVXQFO-NEPJUHHUSA-N 1 2 237.347 2.385 20 0 BEADLO Cc1cccc(CNC(=O)[C@H](C)n2cc[nH+]c2)c1 ZINC000048560966 1171624751 /nfs/dbraw/zinc/62/47/51/1171624751.db2.gz RGQNVNCTFDQHQY-LBPRGKRZSA-N 1 2 243.310 2.069 20 0 BEADLO CC[C@@H](C)[NH2+]CC(=O)OCc1ccccc1 ZINC000048632365 1171631868 /nfs/dbraw/zinc/63/18/68/1171631868.db2.gz NWSNZLMIRABHAG-LLVKDONJSA-N 1 2 221.300 2.118 20 0 BEADLO C[C@@H](NC(=O)[C@@H](C)n1cc[nH+]c1)c1ccccc1 ZINC000049215271 1171681819 /nfs/dbraw/zinc/68/18/19/1171681819.db2.gz XCGSALJTLKMEAL-VXGBXAGGSA-N 1 2 243.310 2.322 20 0 BEADLO C[C@@H](C(=O)Nc1ccccc1)n1cc[nH+]c1 ZINC000049247770 1171682020 /nfs/dbraw/zinc/68/20/20/1171682020.db2.gz PPPLNHWNQSBRCL-JTQLQIEISA-N 1 2 215.256 2.083 20 0 BEADLO COc1ccccc1NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC000049215289 1171683529 /nfs/dbraw/zinc/68/35/29/1171683529.db2.gz RZESMHXXFVELLM-SNVBAGLBSA-N 1 2 245.282 2.091 20 0 BEADLO C[C@@H]1CC(=O)CC[N@@H+]1CCc1ccccc1F ZINC000049708308 1171720837 /nfs/dbraw/zinc/72/08/37/1171720837.db2.gz QFFJOTQEWXDABB-LLVKDONJSA-N 1 2 235.302 2.422 20 0 BEADLO C[C@@H]1CC(=O)CC[N@H+]1CCc1ccccc1F ZINC000049708308 1171720843 /nfs/dbraw/zinc/72/08/43/1171720843.db2.gz QFFJOTQEWXDABB-LLVKDONJSA-N 1 2 235.302 2.422 20 0 BEADLO C[C@H]1CC(=O)CC[N@@H+]1CCc1cccc(F)c1 ZINC000049711358 1171721253 /nfs/dbraw/zinc/72/12/53/1171721253.db2.gz CPWDMVOILWQOKK-NSHDSACASA-N 1 2 235.302 2.422 20 0 BEADLO C[C@H]1CC(=O)CC[N@H+]1CCc1cccc(F)c1 ZINC000049711358 1171721263 /nfs/dbraw/zinc/72/12/63/1171721263.db2.gz CPWDMVOILWQOKK-NSHDSACASA-N 1 2 235.302 2.422 20 0 BEADLO CCCC[C@H](C)C(=O)NCc1c[nH+]c(CC)[nH]1 ZINC001635610649 1171741058 /nfs/dbraw/zinc/74/10/58/1171741058.db2.gz QBCJWTXTNXNXLS-JTQLQIEISA-N 1 2 237.347 2.415 20 0 BEADLO CCCC[C@H](C)C(=O)NCc1c[nH]c(CC)[nH+]1 ZINC001635610649 1171741065 /nfs/dbraw/zinc/74/10/65/1171741065.db2.gz QBCJWTXTNXNXLS-JTQLQIEISA-N 1 2 237.347 2.415 20 0 BEADLO C[C@H](C(=O)N(C)C(C1CC1)C1CC1)n1cc[nH+]c1 ZINC000050681712 1171827769 /nfs/dbraw/zinc/82/77/69/1171827769.db2.gz FBOFAAGGYYTTBM-SNVBAGLBSA-N 1 2 247.342 2.091 20 0 BEADLO CCC(C)(CC)NC(=O)[C@H]1CCc2[nH+]ccn2C1 ZINC000364398435 168309705 /nfs/dbraw/zinc/30/97/05/168309705.db2.gz SLQSWCJTRYWACZ-NSHDSACASA-N 1 2 249.358 2.140 20 0 BEADLO Cc1c[nH]c(C[NH+]2CCC(OC3CCC3)CC2)n1 ZINC000628314146 349443823 /nfs/dbraw/zinc/44/38/23/349443823.db2.gz NYGZCEJCTWOWHN-UHFFFAOYSA-N 1 2 249.358 2.252 20 0 BEADLO CCC(CC)(CO)CNc1cccc[nH+]1 ZINC000157599856 168328034 /nfs/dbraw/zinc/32/80/34/168328034.db2.gz YFERDTUXMISPTQ-UHFFFAOYSA-N 1 2 208.305 2.292 20 0 BEADLO C[C@H]1CC[C@H](CNC(=O)C(C)(C)c2c[nH]c[nH+]2)C1 ZINC000621987459 370645106 /nfs/dbraw/zinc/64/51/06/370645106.db2.gz WDJOPDRWIZRKOD-QWRGUYRKSA-N 1 2 249.358 2.240 20 0 BEADLO CCC(CC)(CO)Nc1cc[nH+]c(C2CC2)n1 ZINC000267354857 168329855 /nfs/dbraw/zinc/32/98/55/168329855.db2.gz GZWUPSBIZRODAJ-UHFFFAOYSA-N 1 2 235.331 2.317 20 0 BEADLO C[C@H](N[C@@H]1C[C@H](C)n2cc[nH+]c21)C(F)F ZINC000389922560 398149524 /nfs/dbraw/zinc/14/95/24/398149524.db2.gz SMGOEBVAINIDGO-BIIVOSGPSA-N 1 2 215.247 2.132 20 0 BEADLO COc1cc(C[NH2+][C@@H](C)C(F)F)cc(OC)c1 ZINC000389928255 398150329 /nfs/dbraw/zinc/15/03/29/398150329.db2.gz YCIUGCGCYTXURE-QMMMGPOBSA-N 1 2 245.269 2.447 20 0 BEADLO CC/C=C(\C)C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000299672825 398150733 /nfs/dbraw/zinc/15/07/33/398150733.db2.gz PRLKBDUSBQYWOV-NYYWCZLTSA-N 1 2 247.342 2.472 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3sccc3C2)ncn1 ZINC000292116544 178004122 /nfs/dbraw/zinc/00/41/22/178004122.db2.gz DVIFVLNHTXRCIO-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cc(C[N@H+]2CCc3sccc3C2)ncn1 ZINC000292116544 178004124 /nfs/dbraw/zinc/00/41/24/178004124.db2.gz DVIFVLNHTXRCIO-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cc(C[N@@H+]2CCn3cccc3[C@H]2C)ncn1 ZINC000292229838 178006171 /nfs/dbraw/zinc/00/61/71/178006171.db2.gz ROHGHBGREXRDCF-GFCCVEGCSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1cc(C[N@H+]2CCn3cccc3[C@H]2C)ncn1 ZINC000292229838 178006175 /nfs/dbraw/zinc/00/61/75/178006175.db2.gz ROHGHBGREXRDCF-GFCCVEGCSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1cc(C[N@@H+]2CCn3cccc3[C@H]2C)on1 ZINC000052723243 178006608 /nfs/dbraw/zinc/00/66/08/178006608.db2.gz LBXSPHYOKJKJJJ-LLVKDONJSA-N 1 2 231.299 2.361 20 0 BEADLO Cc1cc(C[N@H+]2CCn3cccc3[C@H]2C)on1 ZINC000052723243 178006610 /nfs/dbraw/zinc/00/66/10/178006610.db2.gz LBXSPHYOKJKJJJ-LLVKDONJSA-N 1 2 231.299 2.361 20 0 BEADLO Cc1ccnc(C[N@H+](C)Cc2ccccn2)c1 ZINC000649892604 398167604 /nfs/dbraw/zinc/16/76/04/398167604.db2.gz RGXHIZLPGGZLTE-UHFFFAOYSA-N 1 2 227.311 2.417 20 0 BEADLO Cc1ccnc(C[N@@H+](C)Cc2ccccn2)c1 ZINC000649892604 398167609 /nfs/dbraw/zinc/16/76/09/398167609.db2.gz RGXHIZLPGGZLTE-UHFFFAOYSA-N 1 2 227.311 2.417 20 0 BEADLO Cc1nc(NC[C@H](C)CC(F)(F)F)cc[nH+]1 ZINC000397009556 398167805 /nfs/dbraw/zinc/16/78/05/398167805.db2.gz NWLCEGJVBCULCY-SSDOTTSWSA-N 1 2 233.237 2.207 20 0 BEADLO Cc1cc(C[NH2+]Cc2cccc3c2OCO3)no1 ZINC000044692732 178026231 /nfs/dbraw/zinc/02/62/31/178026231.db2.gz LHPJKDUZALVMQP-UHFFFAOYSA-N 1 2 246.266 2.002 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2cc(C)nc(C)n2)no1 ZINC000340533982 178037915 /nfs/dbraw/zinc/03/79/15/178037915.db2.gz KPNAGPKCGYSVMZ-SNVBAGLBSA-N 1 2 246.314 2.241 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2ccncc2F)on1 ZINC000338341314 178038634 /nfs/dbraw/zinc/03/86/34/178038634.db2.gz GKRRMBIIYSATMY-SECBINFHSA-N 1 2 235.262 2.368 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2cccc(C)n2)nn1C ZINC000558623912 398177708 /nfs/dbraw/zinc/17/77/08/398177708.db2.gz CFDIFUXYKMIAIM-LBPRGKRZSA-N 1 2 244.342 2.283 20 0 BEADLO C[C@H]1SCC[C@@H]1Nc1nc[nH+]c(N)c1Cl ZINC000379982541 398179806 /nfs/dbraw/zinc/17/98/06/398179806.db2.gz IGMOJZUIIOLEAC-RITPCOANSA-N 1 2 244.751 2.018 20 0 BEADLO C[C@H]1SCC[C@@H]1Nc1[nH+]cnc(N)c1Cl ZINC000379982541 398179808 /nfs/dbraw/zinc/17/98/08/398179808.db2.gz IGMOJZUIIOLEAC-RITPCOANSA-N 1 2 244.751 2.018 20 0 BEADLO Cc1cc(F)ccc1NC(=O)NCc1[nH]cc[nH+]1 ZINC000119580072 178088191 /nfs/dbraw/zinc/08/81/91/178088191.db2.gz VJDCMKGKVIAATJ-UHFFFAOYSA-N 1 2 248.261 2.179 20 0 BEADLO Cc1nc(C)c(C[NH2+][C@H]2C[C@H](C)n3ccnc32)o1 ZINC000385926199 398191509 /nfs/dbraw/zinc/19/15/09/398191509.db2.gz AXOGGUODIUZZQN-KWQFWETISA-N 1 2 246.314 2.284 20 0 BEADLO Cc1nc(C)c(C[NH2+][C@@H]2C[C@H](C)n3ccnc32)o1 ZINC000385926181 398191745 /nfs/dbraw/zinc/19/17/45/398191745.db2.gz AXOGGUODIUZZQN-GZMMTYOYSA-N 1 2 246.314 2.284 20 0 BEADLO Cc1cc(N(C)C[C@@H](C)O)c2cccc(F)c2[nH+]1 ZINC000292327229 178099072 /nfs/dbraw/zinc/09/90/72/178099072.db2.gz MTEFRUUALOZNOI-SNVBAGLBSA-N 1 2 248.301 2.499 20 0 BEADLO Cc1cc(N(C)C[C@@H](C)c2nccs2)nc[nH+]1 ZINC000302189449 178099126 /nfs/dbraw/zinc/09/91/26/178099126.db2.gz VFOCQBWUKSEEJB-SECBINFHSA-N 1 2 248.355 2.481 20 0 BEADLO CCC[C@@H](CNc1cc2cc[nH]c2c[nH+]1)OC ZINC000649387623 398194500 /nfs/dbraw/zinc/19/45/00/398194500.db2.gz WNYKXDBVNMWIMR-NSHDSACASA-N 1 2 233.315 2.212 20 0 BEADLO CCC[C@H](CNc1cc2cc[nH]c2c[nH+]1)OC ZINC000649387622 398194545 /nfs/dbraw/zinc/19/45/45/398194545.db2.gz WNYKXDBVNMWIMR-LLVKDONJSA-N 1 2 233.315 2.212 20 0 BEADLO Cc1cc(N(CCO)C2CCC2)nc(C2CC2)[nH+]1 ZINC000275997328 178102390 /nfs/dbraw/zinc/10/23/90/178102390.db2.gz KLHAKOTXISYNAC-UHFFFAOYSA-N 1 2 247.342 2.014 20 0 BEADLO Cc1cc(N)nc(SCCCCCCO)[nH+]1 ZINC000175547774 178109620 /nfs/dbraw/zinc/10/96/20/178109620.db2.gz OCBBPACXTODCQT-UHFFFAOYSA-N 1 2 241.360 2.012 20 0 BEADLO Cc1cc(N2CCOC[C@@H](C)C2)nc(C2CC2)[nH+]1 ZINC000371098595 178115958 /nfs/dbraw/zinc/11/59/58/178115958.db2.gz HRDBZMXVQMBPCU-JTQLQIEISA-N 1 2 247.342 2.135 20 0 BEADLO Cc1cc(N2CCC[C@H](O)CC2)nc(C2CC2)[nH+]1 ZINC000294045678 178116830 /nfs/dbraw/zinc/11/68/30/178116830.db2.gz LWVMXFPEKKKDPP-LBPRGKRZSA-N 1 2 247.342 2.014 20 0 BEADLO CC[C@H]([NH2+]Cc1ccn[nH]1)c1ccncc1 ZINC000164689491 398202729 /nfs/dbraw/zinc/20/27/29/398202729.db2.gz MODQDDYEJPBETA-LBPRGKRZSA-N 1 2 216.288 2.046 20 0 BEADLO Cc1cc(NC(=O)NCCC2CC2)cc[nH+]1 ZINC000119345624 178139354 /nfs/dbraw/zinc/13/93/54/178139354.db2.gz XVZAPRRZSXRUQS-UHFFFAOYSA-N 1 2 219.288 2.312 20 0 BEADLO Cc1cc(NC(=O)N(C)CC(F)(F)F)cc[nH+]1 ZINC000186630890 178136219 /nfs/dbraw/zinc/13/62/19/178136219.db2.gz BPWGARVMOCVGQB-UHFFFAOYSA-N 1 2 247.220 2.416 20 0 BEADLO Cc1cc(NC(=O)N(C)C[C@H]2CCCO2)cc[nH+]1 ZINC000119648964 178136442 /nfs/dbraw/zinc/13/64/42/178136442.db2.gz HOZDAZINFYFHRC-GFCCVEGCSA-N 1 2 249.314 2.033 20 0 BEADLO Cc1cc(NC(=O)N[C@@H](C)C(F)(F)F)cc[nH+]1 ZINC000288982491 178140111 /nfs/dbraw/zinc/14/01/11/178140111.db2.gz ZIIIWFSKENMWQG-ZETCQYMHSA-N 1 2 247.220 2.462 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2CCCOCC2)cc[nH+]1 ZINC000180609195 178141246 /nfs/dbraw/zinc/14/12/46/178141246.db2.gz WUTPUITYFNKNCY-LLVKDONJSA-N 1 2 249.314 2.081 20 0 BEADLO Cc1cc(CNC(=O)Nc2cc[nH+]c(C)c2)on1 ZINC000119529348 178141299 /nfs/dbraw/zinc/14/12/99/178141299.db2.gz HSVRIQYBZZRCTK-UHFFFAOYSA-N 1 2 246.270 2.008 20 0 BEADLO CCC(F)(F)CNc1[nH+]c2ccccc2n1C ZINC000624560516 398215462 /nfs/dbraw/zinc/21/54/62/398215462.db2.gz INAIHEPPKRNXCQ-UHFFFAOYSA-N 1 2 239.269 2.452 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CCC(=O)C[C@H]2C)cc[nH+]1 ZINC000126056564 178148328 /nfs/dbraw/zinc/14/83/28/178148328.db2.gz UMKJFUOQDRRGKU-RNCFNFMXSA-N 1 2 246.310 2.334 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCS[C@H](C)CC1 ZINC000576359912 365577159 /nfs/dbraw/zinc/57/71/59/365577159.db2.gz MPWZJBDYLPDEPM-SNVBAGLBSA-N 1 2 237.372 2.425 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]CC(F)(F)CO)s1 ZINC000184699708 192027656 /nfs/dbraw/zinc/02/76/56/192027656.db2.gz XYKUZEQVJCSPQS-MRVPVSSYSA-N 1 2 235.299 2.335 20 0 BEADLO Cc1cc(NC[C@@H](O)c2ccccc2C)nc[nH+]1 ZINC000301251874 178165763 /nfs/dbraw/zinc/16/57/63/178165763.db2.gz RZWASFQZSQKOQC-CYBMUJFWSA-N 1 2 243.310 2.239 20 0 BEADLO Cc1cc(NCC2(C)COC2)nc(C2CC2)[nH+]1 ZINC000116261971 178156587 /nfs/dbraw/zinc/15/65/87/178156587.db2.gz XOOQHCUUELAVKQ-UHFFFAOYSA-N 1 2 233.315 2.111 20 0 BEADLO Cc1cc(NCCC[C@@H](C)O)nc(C2CC2)[nH+]1 ZINC000278561887 178159440 /nfs/dbraw/zinc/15/94/40/178159440.db2.gz BCAKQOCRCZQPMJ-SNVBAGLBSA-N 1 2 235.331 2.235 20 0 BEADLO Cc1cc(NCCCOCC(F)(F)F)nc[nH+]1 ZINC000301231644 178160041 /nfs/dbraw/zinc/16/00/41/178160041.db2.gz HYNRPQKZCLTUNN-UHFFFAOYSA-N 1 2 249.236 2.166 20 0 BEADLO Cc1cc(NCCC[C@@H](C)CO)nc(C2CC2)[nH+]1 ZINC000270278251 178160229 /nfs/dbraw/zinc/16/02/29/178160229.db2.gz LMRPWBNULWZPSJ-SNVBAGLBSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1cc(NCCOCc2ccccc2)nc[nH+]1 ZINC000301465330 178161038 /nfs/dbraw/zinc/16/10/38/178161038.db2.gz HGUOEROWNWUZTJ-UHFFFAOYSA-N 1 2 243.310 2.414 20 0 BEADLO Cc1cc(NCCO)c2cccc(F)c2[nH+]1 ZINC000152874678 178161159 /nfs/dbraw/zinc/16/11/59/178161159.db2.gz XXYYCRXSNHPGSX-UHFFFAOYSA-N 1 2 220.247 2.087 20 0 BEADLO Cc1cc(NCc2ccnn2C)nc(C(C)C)[nH+]1 ZINC000070141074 178175650 /nfs/dbraw/zinc/17/56/50/178175650.db2.gz CXSOHWKOJRZACC-UHFFFAOYSA-N 1 2 245.330 2.254 20 0 BEADLO Cc1cc(N[C@@H](C)[C@H]2CCCOC2)nc[nH+]1 ZINC000336777810 178179207 /nfs/dbraw/zinc/17/92/07/178179207.db2.gz JPKXEWDCKUCORF-QWRGUYRKSA-N 1 2 221.304 2.012 20 0 BEADLO Cc1cc(N[C@@H](C)c2cncc(F)c2)nc[nH+]1 ZINC000359099094 178179647 /nfs/dbraw/zinc/17/96/47/178179647.db2.gz NVIWKUWPWDPMSJ-VIFPVBQESA-N 1 2 232.262 2.492 20 0 BEADLO Cc1cc(N[C@@H]2CCC(=O)N[C@@H]2C2CC2)nc[nH+]1 ZINC000329185948 178180521 /nfs/dbraw/zinc/18/05/21/178180521.db2.gz GHIJYIHFJYBMDN-ZWNOBZJWSA-N 1 2 246.314 2.094 20 0 BEADLO Cc1cc(N[C@@H]2CSC2(C)C)nc[nH+]1 ZINC000306633509 178183071 /nfs/dbraw/zinc/18/30/71/178183071.db2.gz RQMSIQFSLDDABY-MRVPVSSYSA-N 1 2 209.318 2.091 20 0 BEADLO Cc1cc(N[C@@H]2C[C@H](O)C2(C)C)nc(C(C)C)[nH+]1 ZINC000129104175 178184286 /nfs/dbraw/zinc/18/42/86/178184286.db2.gz NMZRPRLOTUSPCI-MNOVXSKESA-N 1 2 249.358 2.480 20 0 BEADLO Cc1cc(N[C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)nc[nH+]1 ZINC000361136162 178184594 /nfs/dbraw/zinc/18/45/94/178184594.db2.gz MTFFMWCVSCXDCT-CYZMBNFOSA-N 1 2 247.342 2.401 20 0 BEADLO O=C1CCC(C[N@H+]2CCCC(F)(F)C2)CC1 ZINC000259428177 488172436 /nfs/dbraw/zinc/17/24/36/488172436.db2.gz JBJVVUIAQYPGGU-UHFFFAOYSA-N 1 2 231.286 2.477 20 0 BEADLO O=C1CCC(C[N@@H+]2CCCC(F)(F)C2)CC1 ZINC000259428177 488172439 /nfs/dbraw/zinc/17/24/39/488172439.db2.gz JBJVVUIAQYPGGU-UHFFFAOYSA-N 1 2 231.286 2.477 20 0 BEADLO Cc1cc(N[C@H](CO)c2ccc(F)cc2)nc[nH+]1 ZINC000341468457 178187009 /nfs/dbraw/zinc/18/70/09/178187009.db2.gz FPVYIRPXIMQMBT-GFCCVEGCSA-N 1 2 247.273 2.070 20 0 BEADLO Cc1cc(N[C@H](C)c2cncs2)nc[nH+]1 ZINC000336736099 178187976 /nfs/dbraw/zinc/18/79/76/178187976.db2.gz OZTGQNXMAFSACK-MRVPVSSYSA-N 1 2 220.301 2.415 20 0 BEADLO Cc1cc(N[C@H]2CCOC[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000277612522 178190370 /nfs/dbraw/zinc/19/03/70/178190370.db2.gz LVTDMWMUIONZMQ-CABZTGNLSA-N 1 2 247.342 2.499 20 0 BEADLO Cc1cc(Nc2cccc(CO)c2)nc(C)[nH+]1 ZINC000032908935 178191557 /nfs/dbraw/zinc/19/15/57/178191557.db2.gz WASXYEJEVUJELA-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO Nc1[nH+]cnc(N[C@@H]2CCC[C@@H](F)C2)c1Cl ZINC000521037911 259302404 /nfs/dbraw/zinc/30/24/04/259302404.db2.gz VZCUKASTOZJNMA-RNFRBKRXSA-N 1 2 244.701 2.405 20 0 BEADLO Nc1nc[nH+]c(N[C@@H]2CCC[C@@H](F)C2)c1Cl ZINC000521037911 259302406 /nfs/dbraw/zinc/30/24/06/259302406.db2.gz VZCUKASTOZJNMA-RNFRBKRXSA-N 1 2 244.701 2.405 20 0 BEADLO Cc1cc(=O)[nH]c([C@H](C)[N@H+](C)Cc2ccco2)n1 ZINC000192526118 178202703 /nfs/dbraw/zinc/20/27/03/178202703.db2.gz PGXZPSKUXQDILI-JTQLQIEISA-N 1 2 247.298 2.277 20 0 BEADLO Cc1cc(=O)[nH]c([C@H](C)[N@@H+](C)Cc2ccco2)n1 ZINC000192526118 178202705 /nfs/dbraw/zinc/20/27/05/178202705.db2.gz PGXZPSKUXQDILI-JTQLQIEISA-N 1 2 247.298 2.277 20 0 BEADLO C[C@@H]1Oc2cc(F)ccc2[C@@H]1[NH2+]Cc1cocn1 ZINC000342316636 136222906 /nfs/dbraw/zinc/22/29/06/136222906.db2.gz ZPXHSAVNAYJYNB-ISVAXAHUSA-N 1 2 248.257 2.426 20 0 BEADLO COCc1cc(-c2c[nH+]cn2C)ccc1OC ZINC000649428971 398230165 /nfs/dbraw/zinc/23/01/65/398230165.db2.gz IRFCFLOQZOTMAM-UHFFFAOYSA-N 1 2 232.283 2.242 20 0 BEADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cncnc2)no1 ZINC000362379400 178241107 /nfs/dbraw/zinc/24/11/07/178241107.db2.gz IBJLITGKKXWOQI-ZDUSSCGKSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cncnc2)no1 ZINC000362379400 178241109 /nfs/dbraw/zinc/24/11/09/178241109.db2.gz IBJLITGKKXWOQI-ZDUSSCGKSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1cc([C@@H]2CCCN2Cc2[nH+]ccn2C)on1 ZINC000336348946 178241574 /nfs/dbraw/zinc/24/15/74/178241574.db2.gz JCMVEHFREGNPQQ-NSHDSACASA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2nccn2C)on1 ZINC000336348946 178241577 /nfs/dbraw/zinc/24/15/77/178241577.db2.gz JCMVEHFREGNPQQ-NSHDSACASA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2nccn2C)on1 ZINC000336348946 178241579 /nfs/dbraw/zinc/24/15/79/178241579.db2.gz JCMVEHFREGNPQQ-NSHDSACASA-N 1 2 246.314 2.054 20 0 BEADLO CCCC[C@@H]1CCC[C@H]1[NH2+]Cc1c[nH]nn1 ZINC000649430971 398233674 /nfs/dbraw/zinc/23/36/74/398233674.db2.gz HTFVPPZFYCKSLY-ZYHUDNBSSA-N 1 2 222.336 2.253 20 0 BEADLO CCCC[C@@H]1CCC[C@H]1[NH2+]Cc1cn[nH]n1 ZINC000649430971 398233675 /nfs/dbraw/zinc/23/36/75/398233675.db2.gz HTFVPPZFYCKSLY-ZYHUDNBSSA-N 1 2 222.336 2.253 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@@H](C)c2cnn(C)c2)no1 ZINC000282883056 178253987 /nfs/dbraw/zinc/25/39/87/178253987.db2.gz VTRAGZOCRLWXCV-UWVGGRQHSA-N 1 2 234.303 2.128 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2ccc(F)cn2)nn1C ZINC000337447862 178252166 /nfs/dbraw/zinc/25/21/66/178252166.db2.gz HAOZPPMMSWVSTB-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@@H](CO)c2ccccc2)no1 ZINC000290587204 178254627 /nfs/dbraw/zinc/25/46/27/178254627.db2.gz GHJWENRRYBWTNT-FZMZJTMJSA-N 1 2 246.310 2.367 20 0 BEADLO C[C@@H]1C[NH+](Cc2ncccn2)C[C@@H](C)C1(F)F ZINC000625654833 398237107 /nfs/dbraw/zinc/23/71/07/398237107.db2.gz RAJJXOOIJUTPCX-NXEZZACHSA-N 1 2 241.285 2.200 20 0 BEADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ccn(C)n2)on1 ZINC000334149012 178266558 /nfs/dbraw/zinc/26/65/58/178266558.db2.gz DOABLHXZKOKFLF-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccn(C)n2)on1 ZINC000334149012 178266561 /nfs/dbraw/zinc/26/65/61/178266561.db2.gz DOABLHXZKOKFLF-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc(C(=O)N[C@H](C)c2[nH]cc[nH+]2)cs1 ZINC000381236940 398238969 /nfs/dbraw/zinc/23/89/69/398238969.db2.gz UMDCHYOYBFFSDT-MRVPVSSYSA-N 1 2 235.312 2.271 20 0 BEADLO CCc1cc(N[C@@H]2CCS[C@H]2C)nc[nH+]1 ZINC000379916093 398242597 /nfs/dbraw/zinc/24/25/97/398242597.db2.gz CGVLMKUKEFTYRM-WCBMZHEXSA-N 1 2 223.345 2.345 20 0 BEADLO COCC[C@H]([NH2+][C@@H](C)c1ncc[nH]1)c1ccco1 ZINC000285496666 538941011 /nfs/dbraw/zinc/94/10/11/538941011.db2.gz APXPHUGUCGLFSG-QWRGUYRKSA-N 1 2 249.314 2.431 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2c(c1)CCO2 ZINC000649443135 398249230 /nfs/dbraw/zinc/24/92/30/398249230.db2.gz PMZWDJPEGGPGNV-UHFFFAOYSA-N 1 2 200.241 2.022 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CC(C(F)(F)F)C1 ZINC000576598792 365636571 /nfs/dbraw/zinc/63/65/71/365636571.db2.gz ZZDDEHYAQRHUJV-UHFFFAOYSA-N 1 2 231.221 2.092 20 0 BEADLO Nc1ccc(-c2ccc3c(c2)OCCCO3)c[nH+]1 ZINC000052886385 1171999538 /nfs/dbraw/zinc/99/95/38/1171999538.db2.gz FSFYAFIULUGJLY-UHFFFAOYSA-N 1 2 242.278 2.492 20 0 BEADLO Cc1cc2[nH+]cn(CC3OCCO3)c2cc1C ZINC000191990999 178304729 /nfs/dbraw/zinc/30/47/29/178304729.db2.gz YUMKIAXLTFPVLH-UHFFFAOYSA-N 1 2 232.283 2.026 20 0 BEADLO Cn1ccnc1C[NH2+]C1(c2ccccc2F)CC1 ZINC000076766864 398246758 /nfs/dbraw/zinc/24/67/58/398246758.db2.gz BDSIIFWGOTXTFL-UHFFFAOYSA-N 1 2 245.301 2.338 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCC[C@H]1CCCCO1 ZINC000576648629 365650532 /nfs/dbraw/zinc/65/05/32/365650532.db2.gz RBGMWKWLFVVGBM-CYBMUJFWSA-N 1 2 249.358 2.277 20 0 BEADLO C[C@@H](NC(=O)C[C@@H]1CCC[C@@H]1C)c1[nH]cc[nH+]1 ZINC000580901873 398250886 /nfs/dbraw/zinc/25/08/86/398250886.db2.gz DDGGURZPKHQMHP-AXFHLTTASA-N 1 2 235.331 2.413 20 0 BEADLO CC(C)c1nnc([C@H](C)N[C@H](C)c2[nH]cc[nH+]2)[nH]1 ZINC000286356764 538943636 /nfs/dbraw/zinc/94/36/36/538943636.db2.gz ZNIHYROCPWNVQN-BDAKNGLRSA-N 1 2 248.334 2.063 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)C1CC=CC1 ZINC000077736505 398256756 /nfs/dbraw/zinc/25/67/56/398256756.db2.gz PIINVZLYNUBZCT-UHFFFAOYSA-N 1 2 231.299 2.052 20 0 BEADLO CCc1cc(N[C@H](CO)CCC(C)C)nc[nH+]1 ZINC000624530622 343996524 /nfs/dbraw/zinc/99/65/24/343996524.db2.gz PMMDEHQYYKFXFV-LBPRGKRZSA-N 1 2 237.347 2.248 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)CC1CCCCCC1 ZINC000291507870 538948031 /nfs/dbraw/zinc/94/80/31/538948031.db2.gz SVIXOSJMDWYQFE-UHFFFAOYSA-N 1 2 249.358 2.397 20 0 BEADLO C[N@H+](Cc1csc(Cl)n1)C1CC1 ZINC000294789902 398263846 /nfs/dbraw/zinc/26/38/46/398263846.db2.gz BETNKCURMGLUNJ-UHFFFAOYSA-N 1 2 202.710 2.391 20 0 BEADLO C[N@@H+](Cc1csc(Cl)n1)C1CC1 ZINC000294789902 398263849 /nfs/dbraw/zinc/26/38/49/398263849.db2.gz BETNKCURMGLUNJ-UHFFFAOYSA-N 1 2 202.710 2.391 20 0 BEADLO CCC(CC)[N@H+](CCOC)Cc1csnn1 ZINC000124244301 168373624 /nfs/dbraw/zinc/37/36/24/168373624.db2.gz VGBUTECCWMFPPG-UHFFFAOYSA-N 1 2 243.376 2.175 20 0 BEADLO CCC(CC)[N@@H+](CCOC)Cc1csnn1 ZINC000124244301 168373625 /nfs/dbraw/zinc/37/36/25/168373625.db2.gz VGBUTECCWMFPPG-UHFFFAOYSA-N 1 2 243.376 2.175 20 0 BEADLO CCC[C@](C)([NH2+]C[C@@](C)(CC)OC)C(=O)OC ZINC000602508034 349583470 /nfs/dbraw/zinc/58/34/70/349583470.db2.gz YWJLRHMLCAAKRH-OLZOCXBDSA-N 1 2 245.363 2.123 20 0 BEADLO CCCC[C@@H]([NH2+][C@@H]1C[C@H]1CC)C(=O)OC ZINC000378799811 346836855 /nfs/dbraw/zinc/83/68/55/346836855.db2.gz SUSKKCCMRBHPJF-GMTAPVOTSA-N 1 2 213.321 2.106 20 0 BEADLO CC(C)Cn1cc(C[NH2+]CC(C)(F)F)cn1 ZINC000378805742 346838708 /nfs/dbraw/zinc/83/87/08/346838708.db2.gz XUNQXUSJENXUIH-UHFFFAOYSA-N 1 2 231.290 2.284 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@H](O)CC(C)(C)C ZINC000180566607 538958318 /nfs/dbraw/zinc/95/83/18/538958318.db2.gz QDJASVHGCIQNCO-GXSJLCMTSA-N 1 2 239.363 2.166 20 0 BEADLO Cc1noc(C)c1CC[NH2+][C@H](C)c1cn[nH]c1C ZINC000180500622 538958625 /nfs/dbraw/zinc/95/86/25/538958625.db2.gz FXXJRCGCDIIWMG-MRVPVSSYSA-N 1 2 248.330 2.216 20 0 BEADLO CCSCC[NH2+][C@H](CC)C(=O)OC(C)(C)C ZINC000381782236 346858410 /nfs/dbraw/zinc/85/84/10/346858410.db2.gz YDIPFQVTGURTAK-SNVBAGLBSA-N 1 2 247.404 2.449 20 0 BEADLO COC(=O)[C@@H](C)[NH2+]C[C@@H](C)c1ccc(C)cc1 ZINC000600153360 342691853 /nfs/dbraw/zinc/69/18/53/342691853.db2.gz JSAYYUYQIPSVPZ-VXGBXAGGSA-N 1 2 235.327 2.250 20 0 BEADLO COC(=O)[C@@H](C)[NH2+]C[C@H](C)c1ccc(C)cc1 ZINC000600153358 342692111 /nfs/dbraw/zinc/69/21/11/342692111.db2.gz JSAYYUYQIPSVPZ-NWDGAFQWSA-N 1 2 235.327 2.250 20 0 BEADLO Cc1ccc(CN2CCCc3n[nH]cc32)c(C)[nH+]1 ZINC000335603817 136235904 /nfs/dbraw/zinc/23/59/04/136235904.db2.gz KDAYLALNNICLLL-UHFFFAOYSA-N 1 2 242.326 2.374 20 0 BEADLO Cc1cc(Nc2cnn(CCF)c2)nc(C)[nH+]1 ZINC000624537319 344001448 /nfs/dbraw/zinc/00/14/48/344001448.db2.gz BIVZOLZVLWIOPO-UHFFFAOYSA-N 1 2 235.266 2.003 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CCCc2n[nH]cc21 ZINC000335606919 136236247 /nfs/dbraw/zinc/23/62/47/136236247.db2.gz ZFNMCCJNFXUYKQ-UHFFFAOYSA-N 1 2 245.330 2.140 20 0 BEADLO CCC(CC)NC(=O)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000377103619 168382685 /nfs/dbraw/zinc/38/26/85/168382685.db2.gz NZRNJMQCGQBENG-SNVBAGLBSA-N 1 2 235.331 2.134 20 0 BEADLO CCC(CC)NC(=O)[C@@H]1CCCc2[nH]c[nH+]c21 ZINC000377103619 168382687 /nfs/dbraw/zinc/38/26/87/168382687.db2.gz NZRNJMQCGQBENG-SNVBAGLBSA-N 1 2 235.331 2.134 20 0 BEADLO CCC[C@@H](C)NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000649488485 398283763 /nfs/dbraw/zinc/28/37/63/398283763.db2.gz PEYNSWRRCJDWSD-GHMZBOCLSA-N 1 2 223.320 2.139 20 0 BEADLO CCn1cc[nH+]c1CNCC(F)(F)CC ZINC000623679730 398290330 /nfs/dbraw/zinc/29/03/30/398290330.db2.gz HFWNVCOQSFQFDL-UHFFFAOYSA-N 1 2 217.263 2.038 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1CC1(F)F ZINC000335517269 398290358 /nfs/dbraw/zinc/29/03/58/398290358.db2.gz VFTVZRWXTQEAKJ-MRVPVSSYSA-N 1 2 226.226 2.292 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1CC1(F)F ZINC000335517270 398290399 /nfs/dbraw/zinc/29/03/99/398290399.db2.gz VFTVZRWXTQEAKJ-QMMMGPOBSA-N 1 2 226.226 2.292 20 0 BEADLO Cc1cc(NC[C@]2(C)C[C@H]3C[C@H]3C2)nc[nH+]1 ZINC000624657771 342811323 /nfs/dbraw/zinc/81/13/23/342811323.db2.gz ZDVBGOUUZSSPHY-PTEHBNRSSA-N 1 2 217.316 2.055 20 0 BEADLO O[C@H]1C[C@@H](CNc2cc(C(F)(F)F)cc[nH+]2)C1 ZINC000624666965 342813851 /nfs/dbraw/zinc/81/38/51/342813851.db2.gz YVCQTFOLPAVSNM-OTSSQURYSA-N 1 2 246.232 2.283 20 0 BEADLO Cc1nc(N2CCc3c(O)cccc3C2)cc[nH+]1 ZINC000624677579 342818069 /nfs/dbraw/zinc/81/80/69/342818069.db2.gz DDYQDEMAEICHII-UHFFFAOYSA-N 1 2 241.294 2.053 20 0 BEADLO CN(C)c1ncc(-c2[nH+]ccn2C)cc1Cl ZINC000630051506 361917779 /nfs/dbraw/zinc/91/77/79/361917779.db2.gz BVXFLDVSIZUIMO-UHFFFAOYSA-N 1 2 236.706 2.202 20 0 BEADLO COC(=O)[C@@H]([NH2+]C/C=C\c1ccccc1)C(C)C ZINC000210601362 342823263 /nfs/dbraw/zinc/82/32/63/342823263.db2.gz WZVAHTHYFHJSIE-YHAOYDPOSA-N 1 2 247.338 2.487 20 0 BEADLO Cc1[nH+]cc(-c2cccc3c2OCO3)n1C ZINC000630053628 361923888 /nfs/dbraw/zinc/92/38/88/361923888.db2.gz RUHZJZKBEZJGIG-UHFFFAOYSA-N 1 2 216.240 2.124 20 0 BEADLO C[C@@H]1CC[S@](=O)CC[N@@H+]1Cc1cccs1 ZINC000335464478 398289526 /nfs/dbraw/zinc/28/95/26/398289526.db2.gz LFZJMARYXLBYBF-BMIGLBTASA-N 1 2 243.397 2.091 20 0 BEADLO C[C@@H]1CC[S@](=O)CC[N@H+]1Cc1cccs1 ZINC000335464478 398289527 /nfs/dbraw/zinc/28/95/27/398289527.db2.gz LFZJMARYXLBYBF-BMIGLBTASA-N 1 2 243.397 2.091 20 0 BEADLO COc1cnccc1[C@H](C)[NH2+]Cc1ncc(C)o1 ZINC000187064551 538975709 /nfs/dbraw/zinc/97/57/09/538975709.db2.gz LUZFAZTTXCLGNR-JTQLQIEISA-N 1 2 247.298 2.237 20 0 BEADLO COc1ccc(N[C@@H](C)[C@@H]2CCCCO2)[nH+]c1 ZINC000379206734 538976452 /nfs/dbraw/zinc/97/64/52/538976452.db2.gz BRENKFIDGSWBSL-JQWIXIFHSA-N 1 2 236.315 2.460 20 0 BEADLO Cc1cc(C(=O)NCc2[nH]c[nH+]c2C)cs1 ZINC000380168285 538986525 /nfs/dbraw/zinc/98/65/25/538986525.db2.gz HZZMKKOMQGEHLL-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO COc1ccc(N[C@H]2CSC[C@@H]2C)[nH+]c1 ZINC000380322652 538988951 /nfs/dbraw/zinc/98/89/51/538988951.db2.gz KXGWLDXNQXACQD-WPRPVWTQSA-N 1 2 224.329 2.254 20 0 BEADLO CC[C@]1(C)CCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492869659 529396257 /nfs/dbraw/zinc/39/62/57/529396257.db2.gz VBSALCMZYBZSKD-MUBLQREKSA-N 1 2 233.315 2.072 20 0 BEADLO Cc1occc1C[N@H+](C)Cc1cc2n(n1)CCC2 ZINC000649495409 398293268 /nfs/dbraw/zinc/29/32/68/398293268.db2.gz PTOQFORQXHPIDN-UHFFFAOYSA-N 1 2 245.326 2.363 20 0 BEADLO Cc1occc1C[N@@H+](C)Cc1cc2n(n1)CCC2 ZINC000649495409 398293269 /nfs/dbraw/zinc/29/32/69/398293269.db2.gz PTOQFORQXHPIDN-UHFFFAOYSA-N 1 2 245.326 2.363 20 0 BEADLO Cc1ccc(F)c(NC(=O)CCc2c[nH+]c[nH]2)c1 ZINC000188979199 538980358 /nfs/dbraw/zinc/98/03/58/538980358.db2.gz DFCTXPIGTITBRP-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO Cc1ccc(F)c(NC(=O)CCc2c[nH]c[nH+]2)c1 ZINC000188979199 538980360 /nfs/dbraw/zinc/98/03/60/538980360.db2.gz DFCTXPIGTITBRP-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO Cc1nc([C@@H](C)NCC[NH+]2CCC2)c(C)s1 ZINC000381451322 539000745 /nfs/dbraw/zinc/00/07/45/539000745.db2.gz HJSXUKFGFOPAIE-SECBINFHSA-N 1 2 239.388 2.116 20 0 BEADLO CCCC1(CNC(=O)CCc2c[nH+]c[nH]2)CC1 ZINC000193531491 539006460 /nfs/dbraw/zinc/00/64/60/539006460.db2.gz DIWMLCSAFWVVQR-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO CCCC1(CNC(=O)CCc2c[nH]c[nH+]2)CC1 ZINC000193531491 539006461 /nfs/dbraw/zinc/00/64/61/539006461.db2.gz DIWMLCSAFWVVQR-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO CCn1ccnc1C[NH2+][C@@H](C)c1ccoc1 ZINC000381746457 539006538 /nfs/dbraw/zinc/00/65/38/539006538.db2.gz QCKLNOUUDRHSSS-JTQLQIEISA-N 1 2 219.288 2.347 20 0 BEADLO CC(C)[C@H](NC(=O)C12CC(C1)C2)c1[nH]cc[nH+]1 ZINC000640724688 361963008 /nfs/dbraw/zinc/96/30/08/361963008.db2.gz RVXSUJHNFYFXSB-QUNCOHTASA-N 1 2 233.315 2.023 20 0 BEADLO Cc1cocc1C(=O)N[C@H](c1[nH]cc[nH+]1)C(C)C ZINC000640724867 361963043 /nfs/dbraw/zinc/96/30/43/361963043.db2.gz WYLWSJCLDIQYDD-NSHDSACASA-N 1 2 247.298 2.438 20 0 BEADLO CCc1cc(N[C@@H](CO)C2CCCC2)nc[nH+]1 ZINC000386344866 539013570 /nfs/dbraw/zinc/01/35/70/539013570.db2.gz MDBBSXKALAZYHP-LBPRGKRZSA-N 1 2 235.331 2.002 20 0 BEADLO COCC(C)(C)CNc1ccc(OC)c[nH+]1 ZINC000381066133 538994633 /nfs/dbraw/zinc/99/46/33/538994633.db2.gz MRUBCTSGKSNVSV-UHFFFAOYSA-N 1 2 224.304 2.175 20 0 BEADLO c1csc(C[NH2+][C@@H]2CCCc3cn[nH]c32)n1 ZINC000381153487 538995013 /nfs/dbraw/zinc/99/50/13/538995013.db2.gz PNMSXFNZOPISCS-SECBINFHSA-N 1 2 234.328 2.033 20 0 BEADLO c1csc(C[NH2+][C@@H]2CCCc3c[nH]nc32)n1 ZINC000381153487 538995014 /nfs/dbraw/zinc/99/50/14/538995014.db2.gz PNMSXFNZOPISCS-SECBINFHSA-N 1 2 234.328 2.033 20 0 BEADLO CN(C(=O)CCc1c[nH+]c[nH]1)c1ccc(F)cc1 ZINC000192800457 538997541 /nfs/dbraw/zinc/99/75/41/538997541.db2.gz YDJXDWBJPPHORF-UHFFFAOYSA-N 1 2 247.273 2.144 20 0 BEADLO CN(C(=O)CCc1c[nH]c[nH+]1)c1ccc(F)cc1 ZINC000192800457 538997543 /nfs/dbraw/zinc/99/75/43/538997543.db2.gz YDJXDWBJPPHORF-UHFFFAOYSA-N 1 2 247.273 2.144 20 0 BEADLO CC(=O)CSCc1cn2c(cccc2C)[nH+]1 ZINC000176746103 344005577 /nfs/dbraw/zinc/00/55/77/344005577.db2.gz JCQOYOWCOCWYNQ-UHFFFAOYSA-N 1 2 234.324 2.465 20 0 BEADLO C[C@H]1CC[C@H]1Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000390455543 539022083 /nfs/dbraw/zinc/02/20/83/539022083.db2.gz CPINFRDLXWOGAN-VHSXEESVSA-N 1 2 219.332 2.406 20 0 BEADLO C[C@H](N[C@H]1CCCC1(F)F)c1[nH+]ccn1C ZINC000390645501 539026659 /nfs/dbraw/zinc/02/66/59/539026659.db2.gz NTMABPJNYTZTER-IUCAKERBSA-N 1 2 229.274 2.259 20 0 BEADLO COCCC[C@H](C)Nc1ccc(OC)c[nH+]1 ZINC000390660293 539027040 /nfs/dbraw/zinc/02/70/40/539027040.db2.gz RZGVFHZQHBYIGC-JTQLQIEISA-N 1 2 224.304 2.317 20 0 BEADLO C[C@H]1CCCC[C@@H]1C(=O)N(C)Cc1[nH+]ccn1C ZINC000335633608 136241515 /nfs/dbraw/zinc/24/15/15/136241515.db2.gz LBWONQYOHUCNEE-RYUDHWBXSA-N 1 2 249.358 2.205 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC1C(C)(C)C1(C)C ZINC000348858725 136242681 /nfs/dbraw/zinc/24/26/81/136242681.db2.gz GREQURBMNSFLIQ-UHFFFAOYSA-N 1 2 247.342 2.368 20 0 BEADLO CC(C)[C@@H](C)[N@H+](C)Cc1nsc(N(C)C)n1 ZINC000533462126 342861117 /nfs/dbraw/zinc/86/11/17/342861117.db2.gz RJIMSUYWFORVQL-SECBINFHSA-N 1 2 242.392 2.080 20 0 BEADLO CC(C)[C@@H](C)[N@@H+](C)Cc1nsc(N(C)C)n1 ZINC000533462126 342861118 /nfs/dbraw/zinc/86/11/18/342861118.db2.gz RJIMSUYWFORVQL-SECBINFHSA-N 1 2 242.392 2.080 20 0 BEADLO CCc1cc(N[C@H](C)c2cnn(CC)c2)nc[nH+]1 ZINC000649514494 398305283 /nfs/dbraw/zinc/30/52/83/398305283.db2.gz HZZXFXQZQAKJHG-SNVBAGLBSA-N 1 2 245.330 2.429 20 0 BEADLO CCC[N@H+](C)Cc1noc(C2CCC2)n1 ZINC000625115431 342873057 /nfs/dbraw/zinc/87/30/57/342873057.db2.gz AANJHXOPIGBLFB-UHFFFAOYSA-N 1 2 209.293 2.179 20 0 BEADLO CCC[N@@H+](C)Cc1noc(C2CCC2)n1 ZINC000625115431 342873058 /nfs/dbraw/zinc/87/30/58/342873058.db2.gz AANJHXOPIGBLFB-UHFFFAOYSA-N 1 2 209.293 2.179 20 0 BEADLO CC(C)NC(=O)C[N@@H+]1Cc2ccccc2[C@H]1C ZINC000335646446 136243857 /nfs/dbraw/zinc/24/38/57/136243857.db2.gz IEAAZNWUTJUMGN-LLVKDONJSA-N 1 2 232.327 2.088 20 0 BEADLO CC(C)NC(=O)C[N@H+]1Cc2ccccc2[C@H]1C ZINC000335646446 136243858 /nfs/dbraw/zinc/24/38/58/136243858.db2.gz IEAAZNWUTJUMGN-LLVKDONJSA-N 1 2 232.327 2.088 20 0 BEADLO CC[N@H+](CC(=O)c1ccccc1F)C1CC1 ZINC000037334131 398316103 /nfs/dbraw/zinc/31/61/03/398316103.db2.gz XUXZIARVTOAIKB-UHFFFAOYSA-N 1 2 221.275 2.493 20 0 BEADLO CC[N@@H+](CC(=O)c1ccccc1F)C1CC1 ZINC000037334131 398316105 /nfs/dbraw/zinc/31/61/05/398316105.db2.gz XUXZIARVTOAIKB-UHFFFAOYSA-N 1 2 221.275 2.493 20 0 BEADLO CC[N@H+](C)Cc1ccncc1Br ZINC000625138227 342888144 /nfs/dbraw/zinc/88/81/44/342888144.db2.gz RFBKQVDCSNMWGJ-UHFFFAOYSA-N 1 2 229.121 2.296 20 0 BEADLO CC[N@@H+](C)Cc1ccncc1Br ZINC000625138227 342888146 /nfs/dbraw/zinc/88/81/46/342888146.db2.gz RFBKQVDCSNMWGJ-UHFFFAOYSA-N 1 2 229.121 2.296 20 0 BEADLO CCCCc1cc(N[C@H](C)C2(CO)CC2)nc[nH+]1 ZINC000631367671 342890654 /nfs/dbraw/zinc/89/06/54/342890654.db2.gz VAGBMMVNRVUJFP-LLVKDONJSA-N 1 2 249.358 2.392 20 0 BEADLO Cc1cc(N2CCC[C@@H]2C2CC2)nc[nH+]1 ZINC000602601129 349647714 /nfs/dbraw/zinc/64/77/14/349647714.db2.gz XYKYJGXTPDSVRI-LLVKDONJSA-N 1 2 203.289 2.164 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1csc(C)c1C ZINC000602637950 349652203 /nfs/dbraw/zinc/65/22/03/349652203.db2.gz LBSSAGBNNUPMCU-SECBINFHSA-N 1 2 241.356 2.358 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1csc(C)c1C ZINC000602637950 349652207 /nfs/dbraw/zinc/65/22/07/349652207.db2.gz LBSSAGBNNUPMCU-SECBINFHSA-N 1 2 241.356 2.358 20 0 BEADLO CCOC(=O)C1(C)CC([NH2+]C(C)(C)C(F)F)C1 ZINC000602649760 349658766 /nfs/dbraw/zinc/65/87/66/349658766.db2.gz PYPBGBVRAIHZMO-UHFFFAOYSA-N 1 2 249.301 2.352 20 0 BEADLO Cc1cccc(C[NH2+][C@H]2C[C@@H](C)n3ccnc32)n1 ZINC000379013716 346885266 /nfs/dbraw/zinc/88/52/66/346885266.db2.gz PMZRHDDNPBGRLP-YPMHNXCESA-N 1 2 242.326 2.382 20 0 BEADLO CC[C@@H](C)CCC(=O)N[C@H]1CCn2cc[nH+]c2C1 ZINC000354852984 398330651 /nfs/dbraw/zinc/33/06/51/398330651.db2.gz RUSHEQNLIGTSAZ-NEPJUHHUSA-N 1 2 249.358 2.140 20 0 BEADLO COC(=O)CCC[N@H+](C)c1ccc(C)cc1 ZINC000050005147 398333588 /nfs/dbraw/zinc/33/35/88/398333588.db2.gz ISVNLBQIEDNRGG-UHFFFAOYSA-N 1 2 221.300 2.384 20 0 BEADLO COC(=O)CCC[N@@H+](C)c1ccc(C)cc1 ZINC000050005147 398333589 /nfs/dbraw/zinc/33/35/89/398333589.db2.gz ISVNLBQIEDNRGG-UHFFFAOYSA-N 1 2 221.300 2.384 20 0 BEADLO COC(=O)c1csc(C[N@@H+]2CC[C@H](F)C2)c1 ZINC000602673384 349667412 /nfs/dbraw/zinc/66/74/12/349667412.db2.gz AWFYVSIGODIMBS-VIFPVBQESA-N 1 2 243.303 2.079 20 0 BEADLO COC(=O)c1csc(C[N@H+]2CC[C@H](F)C2)c1 ZINC000602673384 349667414 /nfs/dbraw/zinc/66/74/14/349667414.db2.gz AWFYVSIGODIMBS-VIFPVBQESA-N 1 2 243.303 2.079 20 0 BEADLO Cc1noc(C)c1C[NH2+][C@H]1C[C@@H](C)n2ccnc21 ZINC000379025150 346888789 /nfs/dbraw/zinc/88/87/89/346888789.db2.gz URMKPGBTCIISNI-PELKAZGASA-N 1 2 246.314 2.284 20 0 BEADLO COC[C@H](Nc1cc(C)[nH+]c(C2CC2)n1)C1CC1 ZINC000129545585 398340411 /nfs/dbraw/zinc/34/04/11/398340411.db2.gz HQCXVTACNNWJJE-LBPRGKRZSA-N 1 2 247.342 2.499 20 0 BEADLO CC[C@@H]1[C@@H](C)CCN1C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493532885 529475593 /nfs/dbraw/zinc/47/55/93/529475593.db2.gz WINUMAURHDTCMU-BXXZLRJFSA-N 1 2 233.315 2.070 20 0 BEADLO Cc1ccc(CC[NH2+][C@@H](C)C(=O)OC(C)C)cc1 ZINC000602680809 349673338 /nfs/dbraw/zinc/67/33/38/349673338.db2.gz LEDNMQAQXLGBAX-ZDUSSCGKSA-N 1 2 249.354 2.467 20 0 BEADLO Cc1nc([C@@H]2CCC[N@H+]2CC[C@@H](C)F)no1 ZINC000351759872 136252207 /nfs/dbraw/zinc/25/22/07/136252207.db2.gz MSHVZOUPPZMKJF-SCZZXKLOSA-N 1 2 227.283 2.263 20 0 BEADLO Cc1nc([C@@H]2CCC[N@@H+]2CC[C@@H](C)F)no1 ZINC000351759872 136252208 /nfs/dbraw/zinc/25/22/08/136252208.db2.gz MSHVZOUPPZMKJF-SCZZXKLOSA-N 1 2 227.283 2.263 20 0 BEADLO Cc1noc(C[N@H+](Cc2cccnc2)C(C)C)n1 ZINC000162380935 349680183 /nfs/dbraw/zinc/68/01/83/349680183.db2.gz ZKRYRKIXILHPHA-UHFFFAOYSA-N 1 2 246.314 2.184 20 0 BEADLO Cc1noc(C[N@@H+](Cc2cccnc2)C(C)C)n1 ZINC000162380935 349680186 /nfs/dbraw/zinc/68/01/86/349680186.db2.gz ZKRYRKIXILHPHA-UHFFFAOYSA-N 1 2 246.314 2.184 20 0 BEADLO COc1ccc2[nH+]c(NC[C@H](C)O)ccc2c1 ZINC000120185029 346903119 /nfs/dbraw/zinc/90/31/19/346903119.db2.gz KFVVUINLUIJBHQ-VIFPVBQESA-N 1 2 232.283 2.036 20 0 BEADLO CC[C@@]1(C)CCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492869660 529524466 /nfs/dbraw/zinc/52/44/66/529524466.db2.gz VBSALCMZYBZSKD-ZFDPJTLLSA-N 1 2 233.315 2.072 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)NC[C@@H](C)C(C)C ZINC000492465785 529553660 /nfs/dbraw/zinc/55/36/60/529553660.db2.gz ZDJVPJLEEGVPCU-NNNHXZLVSA-N 1 2 249.358 2.325 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N[C@@H]1CCC1(C)C ZINC000492917414 529555154 /nfs/dbraw/zinc/55/51/54/529555154.db2.gz CFYPBJWNVYPNTL-MVIFTORASA-N 1 2 247.342 2.221 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N[C@@H]1CCC1(C)C ZINC000492917413 529560277 /nfs/dbraw/zinc/56/02/77/529560277.db2.gz CFYPBJWNVYPNTL-ISALQUGTSA-N 1 2 247.342 2.221 20 0 BEADLO CC[NH+](CC)Cc1noc(C(C)(C)C)n1 ZINC000045914308 342979913 /nfs/dbraw/zinc/97/99/13/342979913.db2.gz AEIYLCQPJOALLD-UHFFFAOYSA-N 1 2 211.309 2.209 20 0 BEADLO CSC1(C[N@@H+]2Cc3cnn(C)c3C2)CCC1 ZINC000602720116 349712296 /nfs/dbraw/zinc/71/22/96/349712296.db2.gz YHCGVZHFZMBDDM-UHFFFAOYSA-N 1 2 237.372 2.021 20 0 BEADLO CSC1(C[N@H+]2Cc3cnn(C)c3C2)CCC1 ZINC000602720116 349712298 /nfs/dbraw/zinc/71/22/98/349712298.db2.gz YHCGVZHFZMBDDM-UHFFFAOYSA-N 1 2 237.372 2.021 20 0 BEADLO CCN(C#N)CC[N@@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000602775804 349728519 /nfs/dbraw/zinc/72/85/19/349728519.db2.gz AWQMDPTZWCCQCP-CQSZACIVSA-N 1 2 247.317 2.375 20 0 BEADLO CCN(C#N)CC[N@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000602775804 349728522 /nfs/dbraw/zinc/72/85/22/349728522.db2.gz AWQMDPTZWCCQCP-CQSZACIVSA-N 1 2 247.317 2.375 20 0 BEADLO CCOC(=O)c1cccc(C[NH+]2CC(C)(C)C2)n1 ZINC000602752304 349731186 /nfs/dbraw/zinc/73/11/86/349731186.db2.gz RQBQWQXGKXUMAA-UHFFFAOYSA-N 1 2 248.326 2.100 20 0 BEADLO CCC[C@H]([NH2+]Cc1cccs1)C(=O)OC ZINC000037966925 343021604 /nfs/dbraw/zinc/02/16/04/343021604.db2.gz DJFCBAYMUOSMRK-JTQLQIEISA-N 1 2 227.329 2.179 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cn[nH]c2C)s1 ZINC000037989248 343040001 /nfs/dbraw/zinc/04/00/01/343040001.db2.gz DMVOZWYXGJDWGY-UHFFFAOYSA-N 1 2 221.329 2.378 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)[C@@]12C[C@@H]1CCC2 ZINC000421537056 192348846 /nfs/dbraw/zinc/34/88/46/192348846.db2.gz ACIZEAPCENKZBR-HZMBPMFUSA-N 1 2 241.294 2.463 20 0 BEADLO CC(C)(C)OC(=O)[C@H](C1CC1)[N@@H+]1CC[C@H](F)C1 ZINC000602841587 349779517 /nfs/dbraw/zinc/77/95/17/349779517.db2.gz OLCPFERDQDZZJI-QWRGUYRKSA-N 1 2 243.322 2.151 20 0 BEADLO CC(C)(C)OC(=O)[C@H](C1CC1)[N@H+]1CC[C@H](F)C1 ZINC000602841587 349779520 /nfs/dbraw/zinc/77/95/20/349779520.db2.gz OLCPFERDQDZZJI-QWRGUYRKSA-N 1 2 243.322 2.151 20 0 BEADLO CC[C@H](C)CN(CC)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492807252 529651631 /nfs/dbraw/zinc/65/16/31/529651631.db2.gz AYNUPDUVHHWVQV-ZADCQDASSA-N 1 2 235.331 2.318 20 0 BEADLO CCCC[C@@H]([NH2+]CCSCC)C(=O)OC ZINC000308832071 346924217 /nfs/dbraw/zinc/92/42/17/346924217.db2.gz URDWMJHTLSQORX-SNVBAGLBSA-N 1 2 233.377 2.061 20 0 BEADLO CCCc1csc(C[NH2+]Cc2cc[nH]n2)n1 ZINC000309977245 343124584 /nfs/dbraw/zinc/12/45/84/343124584.db2.gz UFIGNMKTQCBOFE-UHFFFAOYSA-N 1 2 236.344 2.109 20 0 BEADLO COC(=O)[C@H]([NH2+]Cc1cc(C)cs1)C1CC1 ZINC000344728113 365721212 /nfs/dbraw/zinc/72/12/12/365721212.db2.gz VCSVATOYYIGTCN-LLVKDONJSA-N 1 2 239.340 2.098 20 0 BEADLO CC[C@@H](Cc1cccs1)[NH2+][C@@H](C)C(=O)OC ZINC000310019407 343180398 /nfs/dbraw/zinc/18/03/98/343180398.db2.gz MKFSHYJAFAMAON-UWVGGRQHSA-N 1 2 241.356 2.220 20 0 BEADLO CCCCCC(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000125371729 343173059 /nfs/dbraw/zinc/17/30/59/343173059.db2.gz GLEKJEWAODDOJK-SECBINFHSA-N 1 2 209.293 2.167 20 0 BEADLO CC[C@@H](NC(=O)CSC(C)C)c1[nH]cc[nH+]1 ZINC000125332408 343173132 /nfs/dbraw/zinc/17/31/32/343173132.db2.gz JZZVCFYZIRYDCC-SECBINFHSA-N 1 2 241.360 2.119 20 0 BEADLO COc1c(N)[nH+]cnc1N[C@@H]1CCC[C@@H](C)C1 ZINC000134822241 343195450 /nfs/dbraw/zinc/19/54/50/343195450.db2.gz GSRCCJHCMFWTER-RKDXNWHRSA-N 1 2 236.319 2.058 20 0 BEADLO COc1c(N)nc[nH+]c1N[C@@H]1CCC[C@@H](C)C1 ZINC000134822241 343195451 /nfs/dbraw/zinc/19/54/51/343195451.db2.gz GSRCCJHCMFWTER-RKDXNWHRSA-N 1 2 236.319 2.058 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@H](C)c2nnc(C)o2)CCS1 ZINC000247236097 343245901 /nfs/dbraw/zinc/24/59/01/343245901.db2.gz DIKCICNFKQMFDC-PSASIEDQSA-N 1 2 241.360 2.266 20 0 BEADLO CC[C@@H]1C[N@H+]([C@H](C)c2nnc(C)o2)CCS1 ZINC000247236097 343245903 /nfs/dbraw/zinc/24/59/03/343245903.db2.gz DIKCICNFKQMFDC-PSASIEDQSA-N 1 2 241.360 2.266 20 0 BEADLO CC[C@H]1C[N@@H+]([C@H](C)c2nnc(C)o2)CCS1 ZINC000247236105 343246117 /nfs/dbraw/zinc/24/61/17/343246117.db2.gz DIKCICNFKQMFDC-SCZZXKLOSA-N 1 2 241.360 2.266 20 0 BEADLO CC[C@H]1C[N@H+]([C@H](C)c2nnc(C)o2)CCS1 ZINC000247236105 343246119 /nfs/dbraw/zinc/24/61/19/343246119.db2.gz DIKCICNFKQMFDC-SCZZXKLOSA-N 1 2 241.360 2.266 20 0 BEADLO CN(CCC[NH2+]Cc1ccn[nH]1)c1ccccc1 ZINC000036900000 343326850 /nfs/dbraw/zinc/32/68/50/343326850.db2.gz YJFBUZCYAIIISD-UHFFFAOYSA-N 1 2 244.342 2.026 20 0 BEADLO CCc1oc(C(=O)N(C)Cc2[nH]cc[nH+]2)cc1C ZINC000348770065 136298260 /nfs/dbraw/zinc/29/82/60/136298260.db2.gz NSDDVMMOQOYPPC-UHFFFAOYSA-N 1 2 247.298 2.146 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@H](C)c1ccc(C)cc1 ZINC000037074006 343332872 /nfs/dbraw/zinc/33/28/72/343332872.db2.gz IGWZMYYHGGWSQY-MNOVXSKESA-N 1 2 221.300 2.207 20 0 BEADLO CC(C)[C@@H](C)CNC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000584056347 343308500 /nfs/dbraw/zinc/30/85/00/343308500.db2.gz NDGPZWUGJGOATD-RYUDHWBXSA-N 1 2 237.347 2.243 20 0 BEADLO C[C@H]1C[C@H](C)[N@H+](Cc2nc(C(F)F)no2)C1 ZINC000335613034 136295774 /nfs/dbraw/zinc/29/57/74/136295774.db2.gz RMEPQXQXRSTXOP-BQBZGAKWSA-N 1 2 231.246 2.238 20 0 BEADLO C[C@H]1C[C@H](C)[N@@H+](Cc2nc(C(F)F)no2)C1 ZINC000335613034 136295775 /nfs/dbraw/zinc/29/57/75/136295775.db2.gz RMEPQXQXRSTXOP-BQBZGAKWSA-N 1 2 231.246 2.238 20 0 BEADLO Cc1[nH]c(CNc2cncc(F)c2)[nH+]c1C ZINC000584064571 343312101 /nfs/dbraw/zinc/31/21/01/343312101.db2.gz HGKLQKRMJJCCAP-UHFFFAOYSA-N 1 2 220.251 2.173 20 0 BEADLO O=C(CCCn1cc[nH+]c1)NCCCC1CCC1 ZINC000618616904 343374329 /nfs/dbraw/zinc/37/43/29/343374329.db2.gz OFCQKUKIUYVCKR-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO CC[N@H+](CC(F)F)C[C@@H]1CCCOC1 ZINC000348832526 136303678 /nfs/dbraw/zinc/30/36/78/136303678.db2.gz IRZNQABIUPISGR-VIFPVBQESA-N 1 2 207.264 2.000 20 0 BEADLO CC[N@@H+](CC(F)F)C[C@@H]1CCCOC1 ZINC000348832526 136303679 /nfs/dbraw/zinc/30/36/79/136303679.db2.gz IRZNQABIUPISGR-VIFPVBQESA-N 1 2 207.264 2.000 20 0 BEADLO CCOc1cccc(C[NH2+]Cc2ccn[nH]2)c1 ZINC000037679536 343351173 /nfs/dbraw/zinc/35/11/73/343351173.db2.gz CKAHZTNDXYMJQT-UHFFFAOYSA-N 1 2 231.299 2.098 20 0 BEADLO C[C@@H](O)CN(C)c1[nH+]ccc2ccc(F)cc21 ZINC000335678102 136319296 /nfs/dbraw/zinc/31/92/96/136319296.db2.gz BXVOXGVVLCXXFA-SECBINFHSA-N 1 2 234.274 2.191 20 0 BEADLO CCc1noc([C@@H](c2ccccc2)[NH+](C)C)n1 ZINC000348885529 136308398 /nfs/dbraw/zinc/30/83/98/136308398.db2.gz IIIGTZUXTAEFNP-GFCCVEGCSA-N 1 2 231.299 2.283 20 0 BEADLO FC1(F)C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccon1 ZINC000625676764 344030628 /nfs/dbraw/zinc/03/06/28/344030628.db2.gz BJNJJOUSFGSLDQ-AOOOYVTPSA-N 1 2 228.242 2.437 20 0 BEADLO FC1(F)C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccon1 ZINC000625676764 344030631 /nfs/dbraw/zinc/03/06/31/344030631.db2.gz BJNJJOUSFGSLDQ-AOOOYVTPSA-N 1 2 228.242 2.437 20 0 BEADLO CCC(=O)NCc1ccc(N2CCCCC2)[nH+]c1 ZINC000047417479 343396934 /nfs/dbraw/zinc/39/69/34/343396934.db2.gz XPMJKZHJQAIBMR-UHFFFAOYSA-N 1 2 247.342 2.098 20 0 BEADLO CC[C@@H](O)Cn1cc[nH+]c1-c1ccccc1 ZINC000040228501 343398579 /nfs/dbraw/zinc/39/85/79/343398579.db2.gz OZZNYUVQRGPPTJ-GFCCVEGCSA-N 1 2 216.284 2.321 20 0 BEADLO Cc1cc(CNC(=O)CC(C)C)cc(C)[nH+]1 ZINC000421558781 192361252 /nfs/dbraw/zinc/36/12/52/192361252.db2.gz NJXCAEMQECQDIA-UHFFFAOYSA-N 1 2 220.316 2.361 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1cc(C(F)(F)F)n[nH]1 ZINC000335702699 136334606 /nfs/dbraw/zinc/33/46/06/136334606.db2.gz ATFKDQDXRTYLIA-BQBZGAKWSA-N 1 2 233.237 2.411 20 0 BEADLO CC[N@H+](Cc1nc(C)no1)Cc1ccccc1 ZINC000042286649 343433390 /nfs/dbraw/zinc/43/33/90/343433390.db2.gz YUXDBBOLTQIXJE-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1nc(C)no1)Cc1ccccc1 ZINC000042286649 343433391 /nfs/dbraw/zinc/43/33/91/343433391.db2.gz YUXDBBOLTQIXJE-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CCc1cnc(CN(C)Cc2[nH]cc[nH+]2)s1 ZINC000177777423 346939303 /nfs/dbraw/zinc/93/93/03/346939303.db2.gz VVGKKZIOBRNITE-UHFFFAOYSA-N 1 2 236.344 2.061 20 0 BEADLO CC(C)=C(F)c1nc(Cc2c[nH+]cn2C)no1 ZINC000335719409 136340433 /nfs/dbraw/zinc/34/04/33/136340433.db2.gz JMNADCHOFAXNRH-UHFFFAOYSA-N 1 2 236.250 2.114 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2CCC[C@H](C)C2)no1 ZINC000335857320 136356056 /nfs/dbraw/zinc/35/60/56/136356056.db2.gz SMOUKDNMFKPWJA-IUCAKERBSA-N 1 2 209.293 2.171 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2CCC[C@H](C)C2)no1 ZINC000335857320 136356057 /nfs/dbraw/zinc/35/60/57/136356057.db2.gz SMOUKDNMFKPWJA-IUCAKERBSA-N 1 2 209.293 2.171 20 0 BEADLO C[C@@H]1CCC[N@@H+]1Cc1cc(C(F)(F)F)n[nH]1 ZINC000335879809 136356949 /nfs/dbraw/zinc/35/69/49/136356949.db2.gz VQGDPEFBYHDEPD-SSDOTTSWSA-N 1 2 233.237 2.413 20 0 BEADLO C[C@@H]1CCC[N@H+]1Cc1cc(C(F)(F)F)n[nH]1 ZINC000335879809 136356950 /nfs/dbraw/zinc/35/69/50/136356950.db2.gz VQGDPEFBYHDEPD-SSDOTTSWSA-N 1 2 233.237 2.413 20 0 BEADLO C[C@@H](Cc1cnn(C)c1)[NH2+][C@@H](C)c1cccnc1 ZINC000350518846 136361969 /nfs/dbraw/zinc/36/19/69/136361969.db2.gz WTXOLMJKOUPBSA-RYUDHWBXSA-N 1 2 244.342 2.097 20 0 BEADLO C/C=C\c1cn(Cc2ccc(C)[nH+]c2C)nn1 ZINC000641095542 362224403 /nfs/dbraw/zinc/22/44/03/362224403.db2.gz LSJZRCPTZASRLI-PLNGDYQASA-N 1 2 228.299 2.371 20 0 BEADLO CCC[N@H+](Cc1nnc(OCC)s1)C1CC1 ZINC000350781289 136363290 /nfs/dbraw/zinc/36/32/90/136363290.db2.gz NOHPQWDSFLLBOX-UHFFFAOYSA-N 1 2 241.360 2.311 20 0 BEADLO CCC[N@@H+](Cc1nnc(OCC)s1)C1CC1 ZINC000350781289 136363291 /nfs/dbraw/zinc/36/32/91/136363291.db2.gz NOHPQWDSFLLBOX-UHFFFAOYSA-N 1 2 241.360 2.311 20 0 BEADLO C[C@@H]([NH2+]Cc1cccc2c1OCO2)c1ccon1 ZINC000351573377 136369362 /nfs/dbraw/zinc/36/93/62/136369362.db2.gz JNJGUMQDFSTRPQ-SECBINFHSA-N 1 2 246.266 2.254 20 0 BEADLO COC(=O)[C@H](C)[NH2+]CC[C@@H](C)c1ccccc1 ZINC000043533707 343477086 /nfs/dbraw/zinc/47/70/86/343477086.db2.gz QBKJMUSSIKUHBP-NEPJUHHUSA-N 1 2 235.327 2.331 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)[C@H]1CC=CCC1 ZINC000047975869 343569050 /nfs/dbraw/zinc/56/90/50/343569050.db2.gz VESCQGBZDDBCEX-NSHDSACASA-N 1 2 245.326 2.442 20 0 BEADLO CC(C)[C@H](NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1)C1CC1 ZINC000620033000 343586986 /nfs/dbraw/zinc/58/69/86/343586986.db2.gz HMJITIRHAVZWTI-GWCFXTLKSA-N 1 2 249.358 2.139 20 0 BEADLO CC(C)[C@H](NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1)C1CC1 ZINC000620033000 343586987 /nfs/dbraw/zinc/58/69/87/343586987.db2.gz HMJITIRHAVZWTI-GWCFXTLKSA-N 1 2 249.358 2.139 20 0 BEADLO Cc1ccsc1C(=O)N(C)Cc1[nH+]ccn1C ZINC000049087029 343592839 /nfs/dbraw/zinc/59/28/39/343592839.db2.gz ZDAOJGIKOPQYJW-UHFFFAOYSA-N 1 2 249.339 2.062 20 0 BEADLO Cc1ccc(CN(C)Cc2[nH+]ccn2C)c(C)n1 ZINC000360138171 178551863 /nfs/dbraw/zinc/55/18/63/178551863.db2.gz AYCXVWMCZRAFCG-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO COC(=O)C[N@H+](Cc1cccc(F)c1)C(C)C ZINC000049573138 343603331 /nfs/dbraw/zinc/60/33/31/343603331.db2.gz JFZNWMVFAVLFED-UHFFFAOYSA-N 1 2 239.290 2.209 20 0 BEADLO COC(=O)C[N@@H+](Cc1cccc(F)c1)C(C)C ZINC000049573138 343603332 /nfs/dbraw/zinc/60/33/32/343603332.db2.gz JFZNWMVFAVLFED-UHFFFAOYSA-N 1 2 239.290 2.209 20 0 BEADLO COC(=O)C[N@H+](C)[C@H](C)c1ccc(C)cc1 ZINC000047960155 343675353 /nfs/dbraw/zinc/67/53/53/343675353.db2.gz NOPTUBKSOJSRMD-LLVKDONJSA-N 1 2 221.300 2.161 20 0 BEADLO COC(=O)C[N@@H+](C)[C@H](C)c1ccc(C)cc1 ZINC000047960155 343675355 /nfs/dbraw/zinc/67/53/55/343675355.db2.gz NOPTUBKSOJSRMD-LLVKDONJSA-N 1 2 221.300 2.161 20 0 BEADLO Cc1nc(NCC(F)(F)C(F)F)cc[nH+]1 ZINC000230715096 346956075 /nfs/dbraw/zinc/95/60/75/346956075.db2.gz XMKSDVCECTXAIF-UHFFFAOYSA-N 1 2 223.173 2.097 20 0 BEADLO Cc1nc(N2CC=CC2)c2c([nH+]1)CCCC2 ZINC000570337195 323056964 /nfs/dbraw/zinc/05/69/64/323056964.db2.gz QQRAOFGXOLTWJL-UHFFFAOYSA-N 1 2 215.300 2.040 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+]1CCc2nc[nH]c2C1 ZINC000625436879 343734342 /nfs/dbraw/zinc/73/43/42/343734342.db2.gz MCMDUIGNMBQMNS-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1cc(F)ccc1C[N@H+]1CCc2nc[nH]c2C1 ZINC000625436879 343734343 /nfs/dbraw/zinc/73/43/43/343734343.db2.gz MCMDUIGNMBQMNS-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO COc1ccc[nH+]c1NCCC1(CO)CCC1 ZINC000624353301 343730315 /nfs/dbraw/zinc/73/03/15/343730315.db2.gz MAYDPSAGGSLUNV-UHFFFAOYSA-N 1 2 236.315 2.055 20 0 BEADLO CC[C@H](C)C(=O)CSc1nc(N)cc(C)[nH+]1 ZINC000089676465 343748366 /nfs/dbraw/zinc/74/83/66/343748366.db2.gz WATNKAWWEHIPEF-ZETCQYMHSA-N 1 2 239.344 2.075 20 0 BEADLO COc1cncc(C[N@H+](C)Cc2occc2C)n1 ZINC000625445567 343767267 /nfs/dbraw/zinc/76/72/67/343767267.db2.gz OOKFISZJNLAGSU-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1cncc(C[N@@H+](C)Cc2occc2C)n1 ZINC000625445567 343767270 /nfs/dbraw/zinc/76/72/70/343767270.db2.gz OOKFISZJNLAGSU-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO CC(C)N(C(=O)[C@H]1CCCc2[nH+]c[nH]c21)C1CC1 ZINC000336051766 534953439 /nfs/dbraw/zinc/95/34/39/534953439.db2.gz SVEVFQFTFVHXJM-NSHDSACASA-N 1 2 247.342 2.229 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cocn2)[C@H](CC)CO1 ZINC000651913018 537827768 /nfs/dbraw/zinc/82/77/68/537827768.db2.gz KOPXMUAGJDLVDU-VXGBXAGGSA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cocn2)[C@H](CC)CO1 ZINC000651913018 537827775 /nfs/dbraw/zinc/82/77/75/537827775.db2.gz KOPXMUAGJDLVDU-VXGBXAGGSA-N 1 2 224.304 2.064 20 0 BEADLO CSCc1cn(Cc2ccc(C)[nH+]c2C)nn1 ZINC000603234030 349892430 /nfs/dbraw/zinc/89/24/30/349892430.db2.gz NTJKOSJBXMGCMF-UHFFFAOYSA-N 1 2 248.355 2.201 20 0 BEADLO CC[N@@H+]1CCOC[C@@H]1c1ccc(F)cc1 ZINC000334635971 343896077 /nfs/dbraw/zinc/89/60/77/343896077.db2.gz QZMNWASLFYKUNT-GFCCVEGCSA-N 1 2 209.264 2.219 20 0 BEADLO CC[N@H+]1CCOC[C@@H]1c1ccc(F)cc1 ZINC000334635971 343896079 /nfs/dbraw/zinc/89/60/79/343896079.db2.gz QZMNWASLFYKUNT-GFCCVEGCSA-N 1 2 209.264 2.219 20 0 BEADLO CCC[C@@H](C)C(=O)N1CC(Oc2cc[nH+]cc2)C1 ZINC000603246505 349898277 /nfs/dbraw/zinc/89/82/77/349898277.db2.gz WKUHWVVLFVEOGL-LLVKDONJSA-N 1 2 248.326 2.107 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC[C@@H]2c2cccn2C)n1 ZINC000628120764 343971321 /nfs/dbraw/zinc/97/13/21/343971321.db2.gz CRHKXVIEUCMFOX-CYBMUJFWSA-N 1 2 244.342 2.394 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC[C@@H]2c2cccn2C)n1 ZINC000628120764 343971322 /nfs/dbraw/zinc/97/13/22/343971322.db2.gz CRHKXVIEUCMFOX-CYBMUJFWSA-N 1 2 244.342 2.394 20 0 BEADLO Cc1nc(N2CC3(C2)CC(F)(F)C3)cc[nH+]1 ZINC000672275797 488249054 /nfs/dbraw/zinc/24/90/54/488249054.db2.gz OLEOBHHUAOPCIN-UHFFFAOYSA-N 1 2 225.242 2.021 20 0 BEADLO CC(C)[C@H](C)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000603246597 349899206 /nfs/dbraw/zinc/89/92/06/349899206.db2.gz NFPILSJQFOSSEY-QWHCGFSZSA-N 1 2 249.358 2.339 20 0 BEADLO CC(C)[C@H](C)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000603246598 349899295 /nfs/dbraw/zinc/89/92/95/349899295.db2.gz NFPILSJQFOSSEY-STQMWFEESA-N 1 2 249.358 2.339 20 0 BEADLO Cc1ccc(CCNc2cc[nH+]cc2F)o1 ZINC000641290477 362346694 /nfs/dbraw/zinc/34/66/94/362346694.db2.gz QLGWKLHGLYYJQA-UHFFFAOYSA-N 1 2 220.247 2.199 20 0 BEADLO CC(C)(C)CCNc1cc(CO)cc[nH+]1 ZINC000641290731 362347159 /nfs/dbraw/zinc/34/71/59/362347159.db2.gz NDYMEHKYDWVHFZ-UHFFFAOYSA-N 1 2 208.305 2.422 20 0 BEADLO CC(=O)c1cc(C[NH+](C2CC2)C2CC2)on1 ZINC000625842099 344093432 /nfs/dbraw/zinc/09/34/32/344093432.db2.gz VQYOJMFACZKFDF-UHFFFAOYSA-N 1 2 220.272 2.004 20 0 BEADLO C(c1nnc2n1CCCCC2)[NH+](C1CC1)C1CC1 ZINC000625843547 344094392 /nfs/dbraw/zinc/09/43/92/344094392.db2.gz XYGPLMVWEVSKOT-UHFFFAOYSA-N 1 2 246.358 2.131 20 0 BEADLO CCc1cccc(NC(=O)CCn2cc[nH+]c2)c1 ZINC000078344102 344096496 /nfs/dbraw/zinc/09/64/96/344096496.db2.gz XKKHOHCVISQDNC-UHFFFAOYSA-N 1 2 243.310 2.474 20 0 BEADLO CCC(C)(C)C(=O)NCCCCn1cc[nH+]c1 ZINC000588697550 344173907 /nfs/dbraw/zinc/17/39/07/344173907.db2.gz QHFVXDBGBDXQSX-UHFFFAOYSA-N 1 2 237.347 2.216 20 0 BEADLO C[C@H]1CN(c2cc[nH+]cc2F)CC(C)(C)O1 ZINC000641312376 362358456 /nfs/dbraw/zinc/35/84/56/362358456.db2.gz WYBOWXHJKMNTQN-VIFPVBQESA-N 1 2 224.279 2.224 20 0 BEADLO CO[C@@H](CNc1cc[nH+]c(C)n1)C(C)(C)C ZINC000080697647 344132699 /nfs/dbraw/zinc/13/26/99/344132699.db2.gz PXSVIDJRNVRPQC-JTQLQIEISA-N 1 2 223.320 2.258 20 0 BEADLO CC[C@@H](O)CNc1cc2ccccc2c[nH+]1 ZINC000631308343 344153727 /nfs/dbraw/zinc/15/37/27/344153727.db2.gz CFKRUZCZUOEKEQ-GFCCVEGCSA-N 1 2 216.284 2.418 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@H](C)CC(F)(F)F ZINC000130138451 344218997 /nfs/dbraw/zinc/21/89/97/344218997.db2.gz AXKJVCHHNZHXJY-ZCFIWIBFSA-N 1 2 221.226 2.149 20 0 BEADLO CC(=O)[C@H](C)SCc1ccc(N(C)C)[nH+]c1 ZINC000600537611 344262926 /nfs/dbraw/zinc/26/29/26/344262926.db2.gz RKQNUNSVVTVHAN-JTQLQIEISA-N 1 2 238.356 2.358 20 0 BEADLO Cn1c[nH+]cc1CS[C@H]1COC(C)(C)C1 ZINC000600571983 344286548 /nfs/dbraw/zinc/28/65/48/344286548.db2.gz NXJMTCKIVUQCAX-SNVBAGLBSA-N 1 2 226.345 2.221 20 0 BEADLO CC1(C)C[C@@H](SCCn2cc[nH+]c2)CO1 ZINC000600574458 344288135 /nfs/dbraw/zinc/28/81/35/344288135.db2.gz VYCHSMQVRRYMRH-SNVBAGLBSA-N 1 2 226.345 2.184 20 0 BEADLO CC(C)n1ccc(CNc2cc[nH+]cc2F)n1 ZINC000641384137 362384346 /nfs/dbraw/zinc/38/43/46/362384346.db2.gz FSOYKDBBYVVQKP-UHFFFAOYSA-N 1 2 234.278 2.032 20 0 BEADLO Cc1ccsc1C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620592093 344324889 /nfs/dbraw/zinc/32/48/89/344324889.db2.gz KAJJKHNWRMRWJZ-VIFPVBQESA-N 1 2 249.339 2.281 20 0 BEADLO C[C@@H](NC(=O)CCC(C)(F)F)c1[nH+]ccn1C ZINC000620594959 344330479 /nfs/dbraw/zinc/33/04/79/344330479.db2.gz FPEWOGPCCBVVOG-MRVPVSSYSA-N 1 2 245.273 2.033 20 0 BEADLO Cc1noc(C)c1[C@H](C)Nc1cc[nH+]cc1F ZINC000641377735 362383023 /nfs/dbraw/zinc/38/30/23/362383023.db2.gz YRYSNROUHVIYKH-ZETCQYMHSA-N 1 2 235.262 2.421 20 0 BEADLO C/C=C\C[NH2+][C@H](CC(C)C)C(=O)OCC ZINC000600615435 344337006 /nfs/dbraw/zinc/33/70/06/344337006.db2.gz VXEUKQGXOYBFAA-JPVGGKMYSA-N 1 2 213.321 2.130 20 0 BEADLO CCO[C@@H](CSCCn1cc[nH+]c1)C1CC1 ZINC000600636578 344348286 /nfs/dbraw/zinc/34/82/86/344348286.db2.gz HYEVDQBLDDNCJM-LBPRGKRZSA-N 1 2 240.372 2.431 20 0 BEADLO C[C@H](NC(=O)[C@@H]1CC[C@@H](C)C1)c1[nH+]ccn1C ZINC000620603059 344352733 /nfs/dbraw/zinc/35/27/33/344352733.db2.gz DTYZSWJMXLEDNX-OUAUKWLOSA-N 1 2 235.331 2.034 20 0 BEADLO CC(C)C[C@H](C)C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620603469 344353570 /nfs/dbraw/zinc/35/35/70/344353570.db2.gz IOPWQEMYJLGZES-QWRGUYRKSA-N 1 2 237.347 2.280 20 0 BEADLO CCC1(C(=O)N[C@H](C)c2[nH+]ccn2C)CCC1 ZINC000620603803 344354646 /nfs/dbraw/zinc/35/46/46/344354646.db2.gz NMSSCLPXBULPKN-SNVBAGLBSA-N 1 2 235.331 2.178 20 0 BEADLO CCCC[C@H](COC)Nc1cc(CO)cc[nH+]1 ZINC000641384659 362385862 /nfs/dbraw/zinc/38/58/62/362385862.db2.gz HPOCQGWBSOFBGX-GFCCVEGCSA-N 1 2 238.331 2.191 20 0 BEADLO OCc1cc[nH+]c(N[C@@H]2CC=CCC2)c1 ZINC000641385311 362385952 /nfs/dbraw/zinc/38/59/52/362385952.db2.gz NBUGVYIMLYIRPM-LLVKDONJSA-N 1 2 204.273 2.095 20 0 BEADLO Cc1ccsc1C[NH2+]Cc1ccn[nH]1 ZINC000041013965 344412030 /nfs/dbraw/zinc/41/20/30/344412030.db2.gz JZPGHBANSDZXOB-UHFFFAOYSA-N 1 2 207.302 2.069 20 0 BEADLO O=C([C@@H]1CC12CC2)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000622337959 344506630 /nfs/dbraw/zinc/50/66/30/344506630.db2.gz RBCMUOCGYLZEPV-WDEREUQCSA-N 1 2 245.326 2.263 20 0 BEADLO CC[C@H](Nc1cc[nH+]cc1F)C1CCOCC1 ZINC000641409280 362401019 /nfs/dbraw/zinc/40/10/19/362401019.db2.gz QFIXJIAEEKVYAM-LBPRGKRZSA-N 1 2 238.306 2.260 20 0 BEADLO CC1(CNc2cc(CO)cc[nH+]2)CCC1 ZINC000641422589 362407133 /nfs/dbraw/zinc/40/71/33/362407133.db2.gz YYXRYNBQRABJQE-UHFFFAOYSA-N 1 2 206.289 2.176 20 0 BEADLO CCC(CC)(CCO)CNc1cc[nH+]cc1F ZINC000641411693 362399033 /nfs/dbraw/zinc/39/90/33/362399033.db2.gz UFMRSVVIUIQIAR-UHFFFAOYSA-N 1 2 240.322 2.243 20 0 BEADLO OCc1cc[nH+]c(N[C@@H]2CCC(F)(F)C2)c1 ZINC000641439666 362420370 /nfs/dbraw/zinc/42/03/70/362420370.db2.gz KUOQOXCQNDEUMB-SECBINFHSA-N 1 2 228.242 2.174 20 0 BEADLO CN(Cc1ccccc1)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492863724 529996977 /nfs/dbraw/zinc/99/69/77/529996977.db2.gz MUVHRBPVKCICKC-BQYQJAHWSA-N 1 2 241.294 2.082 20 0 BEADLO C[C@H](CO)SCCc1[nH]c2ccccc2[nH+]1 ZINC000603318410 349913853 /nfs/dbraw/zinc/91/38/53/349913853.db2.gz IFBVUGGUWCBWJY-SECBINFHSA-N 1 2 236.340 2.219 20 0 BEADLO CC1(C)C[C@H](Nc2cc[nH+]cc2F)CCO1 ZINC000641461550 362435552 /nfs/dbraw/zinc/43/55/52/362435552.db2.gz WKSRUAHOVYMTTH-SECBINFHSA-N 1 2 224.279 2.012 20 0 BEADLO CCc1c[nH]c(SCc2ccc[nH+]c2N)n1 ZINC000641466383 362440147 /nfs/dbraw/zinc/44/01/47/362440147.db2.gz QODSFSCUOHEFNG-UHFFFAOYSA-N 1 2 234.328 2.242 20 0 BEADLO CCC(F)(F)CSc1nc(N)cc(C)[nH+]1 ZINC000641425228 362410122 /nfs/dbraw/zinc/41/01/22/362410122.db2.gz HNCLKLFVNQEFGV-UHFFFAOYSA-N 1 2 233.287 2.335 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1CCC[C@@H]2OCC[C@@H]21 ZINC000641441596 362418582 /nfs/dbraw/zinc/41/85/82/362418582.db2.gz NHUUJIYNQJQLKM-XWIASGKRSA-N 1 2 236.290 2.012 20 0 BEADLO CN(Cc1cccs1)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492761504 530008281 /nfs/dbraw/zinc/00/82/81/530008281.db2.gz GKVBNBHXQWTCDF-SNAWJCMRSA-N 1 2 247.323 2.143 20 0 BEADLO C[C@H]1CN(c2cc[nH+]cc2F)C[C@H](C2CC2)O1 ZINC000641546576 362493290 /nfs/dbraw/zinc/49/32/90/362493290.db2.gz XVYAABYAHFELIJ-TVQRCGJNSA-N 1 2 236.290 2.224 20 0 BEADLO CO[C@@H]1CN(c2cc[nH+]cc2F)CC[C@@H]1C ZINC000641523007 362479807 /nfs/dbraw/zinc/47/98/07/362479807.db2.gz XLGJVZTVRDAYEC-JOYOIKCWSA-N 1 2 224.279 2.082 20 0 BEADLO CC(=O)C[N@@H+]1CCc2sccc2[C@@H]1C ZINC000050142405 344649671 /nfs/dbraw/zinc/64/96/71/344649671.db2.gz JCUWJGZRWRIDBG-VIFPVBQESA-N 1 2 209.314 2.256 20 0 BEADLO CC(=O)C[N@H+]1CCc2sccc2[C@@H]1C ZINC000050142405 344649675 /nfs/dbraw/zinc/64/96/75/344649675.db2.gz JCUWJGZRWRIDBG-VIFPVBQESA-N 1 2 209.314 2.256 20 0 BEADLO CO[C@]1(C)C[C@H](Nc2cc[nH+]c(C)n2)C1(C)C ZINC000075064684 344764504 /nfs/dbraw/zinc/76/45/04/344764504.db2.gz KFTYKMUJYGINRL-GXFFZTMASA-N 1 2 235.331 2.401 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)/C=C\C1CCCC1 ZINC000493743757 530026137 /nfs/dbraw/zinc/02/61/37/530026137.db2.gz DSJMVYYBQMMOLW-SREVYHEPSA-N 1 2 233.315 2.115 20 0 BEADLO CC(C)CCc1nnc(NCc2c[nH+]cn2C)o1 ZINC000181783712 347072952 /nfs/dbraw/zinc/07/29/52/347072952.db2.gz VNSNKVFZUPNTKR-UHFFFAOYSA-N 1 2 249.318 2.004 20 0 BEADLO C[N@H+](CCc1ccc2c(c1)CCO2)CC(F)F ZINC000075715016 344777470 /nfs/dbraw/zinc/77/74/70/344777470.db2.gz IYURKYMRYHPWIH-UHFFFAOYSA-N 1 2 241.281 2.361 20 0 BEADLO C[N@@H+](CCc1ccc2c(c1)CCO2)CC(F)F ZINC000075715016 344777473 /nfs/dbraw/zinc/77/74/73/344777473.db2.gz IYURKYMRYHPWIH-UHFFFAOYSA-N 1 2 241.281 2.361 20 0 BEADLO CCc1cnc(C[N@H+](CC)C[C@@H]2CCCO2)o1 ZINC000075676156 344784049 /nfs/dbraw/zinc/78/40/49/344784049.db2.gz MUDYRASCCBJXGM-LBPRGKRZSA-N 1 2 238.331 2.238 20 0 BEADLO CCc1cnc(C[N@@H+](CC)C[C@@H]2CCCO2)o1 ZINC000075676156 344784051 /nfs/dbraw/zinc/78/40/51/344784051.db2.gz MUDYRASCCBJXGM-LBPRGKRZSA-N 1 2 238.331 2.238 20 0 BEADLO FC(F)(F)C1CC[NH+](Cc2ccon2)CC1 ZINC000075996651 344790061 /nfs/dbraw/zinc/79/00/61/344790061.db2.gz ACZRJJRUKWXCPV-UHFFFAOYSA-N 1 2 234.221 2.449 20 0 BEADLO CC1=CCC[N@H+](Cc2nnc(C3CC3)o2)C1 ZINC000583359974 344790851 /nfs/dbraw/zinc/79/08/51/344790851.db2.gz RSVOQDCEHOZVSN-UHFFFAOYSA-N 1 2 219.288 2.099 20 0 BEADLO CC1=CCC[N@@H+](Cc2nnc(C3CC3)o2)C1 ZINC000583359974 344790852 /nfs/dbraw/zinc/79/08/52/344790852.db2.gz RSVOQDCEHOZVSN-UHFFFAOYSA-N 1 2 219.288 2.099 20 0 BEADLO CCOC1CCN(Cc2[nH]c(C)c(C)[nH+]2)CC1 ZINC000628140848 344803444 /nfs/dbraw/zinc/80/34/44/344803444.db2.gz ZXWGUWCJINHDSU-UHFFFAOYSA-N 1 2 237.347 2.027 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1cnc(C2CC2)o1 ZINC000628146069 344824928 /nfs/dbraw/zinc/82/49/28/344824928.db2.gz DBINUHGWJJGAOF-NSHDSACASA-N 1 2 236.315 2.163 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1cnc(C2CC2)o1 ZINC000628146069 344824930 /nfs/dbraw/zinc/82/49/30/344824930.db2.gz DBINUHGWJJGAOF-NSHDSACASA-N 1 2 236.315 2.163 20 0 BEADLO Cc1cc([C@H]2CCCN2Cc2[nH]cc(C)[nH+]2)on1 ZINC000628146450 344825735 /nfs/dbraw/zinc/82/57/35/344825735.db2.gz OBJVZKILEIQDON-LLVKDONJSA-N 1 2 246.314 2.352 20 0 BEADLO COCCc1[nH]c2cc(C)c(C)cc2[nH+]1 ZINC000053731535 1172049179 /nfs/dbraw/zinc/04/91/79/1172049179.db2.gz BOIHYKOPIADYMI-UHFFFAOYSA-N 1 2 204.273 2.369 20 0 BEADLO CCc1cnc(CNc2cc(CC)[nH+]cn2)o1 ZINC000234168328 537863995 /nfs/dbraw/zinc/86/39/95/537863995.db2.gz PVJQBAOPFRBVEH-UHFFFAOYSA-N 1 2 232.287 2.202 20 0 BEADLO C[N@@H+](Cc1cccc2n[nH]cc21)CC(F)F ZINC000628155849 344846069 /nfs/dbraw/zinc/84/60/69/344846069.db2.gz PPIUDDCNALZCOO-UHFFFAOYSA-N 1 2 225.242 2.260 20 0 BEADLO C[N@H+](Cc1cccc2n[nH]cc21)CC(F)F ZINC000628155849 344846071 /nfs/dbraw/zinc/84/60/71/344846071.db2.gz PPIUDDCNALZCOO-UHFFFAOYSA-N 1 2 225.242 2.260 20 0 BEADLO Cc1nc(N2CCC[C@@H](C)[C@@H]2C)cc[nH+]1 ZINC000078335296 344848051 /nfs/dbraw/zinc/84/80/51/344848051.db2.gz ANUIULGQHDYLFY-ZJUUUORDSA-N 1 2 205.305 2.410 20 0 BEADLO COC(C)(C)C[C@@H](C)Nc1cc[nH+]c(C)n1 ZINC000078402189 344860320 /nfs/dbraw/zinc/86/03/20/344860320.db2.gz CDFZBDBZCYUOJR-SECBINFHSA-N 1 2 223.320 2.401 20 0 BEADLO Cc1nc(N2C[C@@H](C)S[C@@H](C)C2)cc[nH+]1 ZINC000078495266 344876315 /nfs/dbraw/zinc/87/63/15/344876315.db2.gz WXUMFOCDECHGHG-DTORHVGOSA-N 1 2 223.345 2.115 20 0 BEADLO Cc1nc(N2C[C@@H](C)S[C@H](C)C2)cc[nH+]1 ZINC000078495272 344876342 /nfs/dbraw/zinc/87/63/42/344876342.db2.gz WXUMFOCDECHGHG-RKDXNWHRSA-N 1 2 223.345 2.115 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ccnn1C)c1cscn1 ZINC000583392760 344879326 /nfs/dbraw/zinc/87/93/26/344879326.db2.gz PCGGOIABZDHXQX-IUCAKERBSA-N 1 2 236.344 2.288 20 0 BEADLO Cc1[nH]c(CN(CC(F)F)C2CC2)[nH+]c1C ZINC000628167983 344880729 /nfs/dbraw/zinc/88/07/29/344880729.db2.gz HGPOEHRFEMIGLG-UHFFFAOYSA-N 1 2 229.274 2.256 20 0 BEADLO CC1(C)C[C@@H]1C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000120337548 344887368 /nfs/dbraw/zinc/88/73/68/344887368.db2.gz UFZSDHSHVLZOCL-GFCCVEGCSA-N 1 2 247.342 2.093 20 0 BEADLO CCc1ccc(C[NH+]2CCOCC2)s1 ZINC000142137473 537870922 /nfs/dbraw/zinc/87/09/22/537870922.db2.gz RONDLXYNCDNNAS-UHFFFAOYSA-N 1 2 211.330 2.143 20 0 BEADLO CCN(Cc1[nH]cc(C)[nH+]1)Cc1ccccn1 ZINC000628171848 344891512 /nfs/dbraw/zinc/89/15/12/344891512.db2.gz ONEQNOAOGNPKFF-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CCCN1C(=O)C2(CCCCC2)[NH2+][C@@H]1C1CC1 ZINC000078762801 344903831 /nfs/dbraw/zinc/90/38/31/344903831.db2.gz OLVZXTNRFCSVAF-LBPRGKRZSA-N 1 2 236.359 2.267 20 0 BEADLO Cc1[nH]c(CN2CCOCC23CCCC3)[nH+]c1C ZINC000628187380 344938191 /nfs/dbraw/zinc/93/81/91/344938191.db2.gz ONUUHRYSWYLNMM-UHFFFAOYSA-N 1 2 249.358 2.172 20 0 BEADLO CCC[C@H]1CN(Cc2[nH]c(C)c(C)[nH+]2)CCO1 ZINC000628178797 344913511 /nfs/dbraw/zinc/91/35/11/344913511.db2.gz CLBIBSGZIPQJPS-LBPRGKRZSA-N 1 2 237.347 2.027 20 0 BEADLO CCc1nc(C[N@@H+]2C[C@@H]3CCCC[C@@]32C)no1 ZINC000626105227 344970229 /nfs/dbraw/zinc/97/02/29/344970229.db2.gz XYPCIUWDXYNZIH-GWCFXTLKSA-N 1 2 235.331 2.397 20 0 BEADLO CCc1nc(C[N@H+]2C[C@@H]3CCCC[C@@]32C)no1 ZINC000626105227 344970231 /nfs/dbraw/zinc/97/02/31/344970231.db2.gz XYPCIUWDXYNZIH-GWCFXTLKSA-N 1 2 235.331 2.397 20 0 BEADLO Cc1nc(C2([NH2+]CCF)CCCCCC2)no1 ZINC000408268497 344990389 /nfs/dbraw/zinc/99/03/89/344990389.db2.gz AQQXQYAXQXHTTM-UHFFFAOYSA-N 1 2 241.310 2.487 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CC[C@H](C2CC2)C1 ZINC000583451249 344998516 /nfs/dbraw/zinc/99/85/16/344998516.db2.gz PISBPARHVPFAOP-LBPRGKRZSA-N 1 2 217.316 2.330 20 0 BEADLO CC[C@@H]1CN(c2cc[nH+]cc2F)CCCO1 ZINC000641553245 362497950 /nfs/dbraw/zinc/49/79/50/362497950.db2.gz UZPOYORQICWLPS-SNVBAGLBSA-N 1 2 224.279 2.226 20 0 BEADLO CC(F)(F)C[NH+]=c1[nH]c2ccccc2[nH]1 ZINC000393413415 345039590 /nfs/dbraw/zinc/03/95/90/345039590.db2.gz BNPWITNNDYOOIY-UHFFFAOYSA-N 1 2 211.215 2.052 20 0 BEADLO CCO[C@@H]1CCN(c2cc[nH+]cc2F)C[C@@H]1C ZINC000641618606 362551863 /nfs/dbraw/zinc/55/18/63/362551863.db2.gz INRNZQUWZMWXDZ-GXFFZTMASA-N 1 2 238.306 2.472 20 0 BEADLO CO[C@@H]1[C@H]2C[C@H]3CN(c4cc[nH+]cc4F)[C@H]1[C@H]3C2 ZINC000641593422 362536064 /nfs/dbraw/zinc/53/60/64/362536064.db2.gz QUCBGSHHTKKMGX-ZGAQPHEGSA-N 1 2 248.301 2.080 20 0 BEADLO CCC[C@@]1(CO)CCN(c2cc[nH+]cc2F)C1 ZINC000641601524 362539629 /nfs/dbraw/zinc/53/96/29/362539629.db2.gz FCIQXYMZVZTCBP-CYBMUJFWSA-N 1 2 238.306 2.210 20 0 BEADLO OCc1cc[nH+]c(N2CCCc3occc3C2)c1 ZINC000641602683 362540275 /nfs/dbraw/zinc/54/02/75/362540275.db2.gz ZSINHWCCEOSNSB-UHFFFAOYSA-N 1 2 244.294 2.120 20 0 BEADLO Cc1nnc(C[NH2+][C@H](C)c2ccsc2)o1 ZINC000235209285 537886148 /nfs/dbraw/zinc/88/61/48/537886148.db2.gz FJHJHJFNDBCIMU-SSDOTTSWSA-N 1 2 223.301 2.290 20 0 BEADLO C[C@]1(C2CC2)CN(c2cc[nH+]cc2F)CCO1 ZINC000641657843 362582687 /nfs/dbraw/zinc/58/26/87/362582687.db2.gz XXAAHQMDWLCXHE-CYBMUJFWSA-N 1 2 236.290 2.226 20 0 BEADLO CCCN(CCC)C(=O)[C@@H]1CCn2cc[nH+]c2C1 ZINC000155955858 345116265 /nfs/dbraw/zinc/11/62/65/345116265.db2.gz UTIVNJARLAFPQJ-GFCCVEGCSA-N 1 2 249.358 2.094 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CCCCC[C@H]1C ZINC001638956802 1172058349 /nfs/dbraw/zinc/05/83/49/1172058349.db2.gz JEWOZTJJWKWPCN-SNVBAGLBSA-N 1 2 235.331 2.052 20 0 BEADLO CCCCN(CC)C(=O)[C@H]1CCn2cc[nH+]c2C1 ZINC000155869857 345109825 /nfs/dbraw/zinc/10/98/25/345109825.db2.gz ZZUQODIAWQKFFD-LBPRGKRZSA-N 1 2 249.358 2.094 20 0 BEADLO CO[C@H]1C[C@H](Nc2cc[nH+]cc2F)C12CCC2 ZINC000641630330 362560601 /nfs/dbraw/zinc/56/06/01/362560601.db2.gz UCPVLIVAYIZJFV-RYUDHWBXSA-N 1 2 236.290 2.012 20 0 BEADLO F[C@@]1(c2ccccc2)C[C@@H]1[NH2+]Cc1ccon1 ZINC000634983968 345166848 /nfs/dbraw/zinc/16/68/48/345166848.db2.gz DBIZXFLQCMZFGY-QWHCGFSZSA-N 1 2 232.258 2.402 20 0 BEADLO c1cc(C[NH2+]Cc2cccc3c2CCOC3)no1 ZINC000634988682 345171893 /nfs/dbraw/zinc/17/18/93/345171893.db2.gz DZHVFESLKAXZCU-UHFFFAOYSA-N 1 2 244.294 2.037 20 0 BEADLO CC[C@@H](C)Nc1ccc(N2CCOCC2)c[nH+]1 ZINC000182874645 345129379 /nfs/dbraw/zinc/12/93/79/345129379.db2.gz JNMIHEBMNCIBPI-LLVKDONJSA-N 1 2 235.331 2.129 20 0 BEADLO COc1cc(C)ccc1[NH2+][C@@H]1CCNC(=O)CC1 ZINC000634970438 345145565 /nfs/dbraw/zinc/14/55/65/345145565.db2.gz QTIRFKZMKBJZIT-NSHDSACASA-N 1 2 248.326 2.084 20 0 BEADLO CC(C)C[C@H](C(=O)N1CCCCC1)n1cc[nH+]c1 ZINC000635053409 345228245 /nfs/dbraw/zinc/22/82/45/345228245.db2.gz GVGZZQOGINBIKQ-CYBMUJFWSA-N 1 2 249.358 2.483 20 0 BEADLO CC[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635058371 345232164 /nfs/dbraw/zinc/23/21/64/345232164.db2.gz LAFMLUZIJRCLQR-QJPTWQEYSA-N 1 2 247.342 2.304 20 0 BEADLO CC[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635058371 345232166 /nfs/dbraw/zinc/23/21/66/345232166.db2.gz LAFMLUZIJRCLQR-QJPTWQEYSA-N 1 2 247.342 2.304 20 0 BEADLO CCc1c[nH]c(CC(=O)Nc2ccccc2C)[nH+]1 ZINC000635061517 345233433 /nfs/dbraw/zinc/23/34/33/345233433.db2.gz JITLVAZPUCWGME-UHFFFAOYSA-N 1 2 243.310 2.462 20 0 BEADLO CCc1c[nH]c(CC(=O)N2C[C@H](C)C[C@@H](C)C2)[nH+]1 ZINC000635066245 345237817 /nfs/dbraw/zinc/23/78/17/345237817.db2.gz ZPWKETHZBGDFBS-GHMZBOCLSA-N 1 2 249.358 2.019 20 0 BEADLO CC(C)C[C@@H](C(=O)N[C@@H](C)C1CC1)n1cc[nH+]c1 ZINC000635126283 345252277 /nfs/dbraw/zinc/25/22/77/345252277.db2.gz ZBYFGHAFJFDVSN-AAEUAGOBSA-N 1 2 249.358 2.385 20 0 BEADLO CC(C)=C(C)CC(=O)N(C)Cc1[nH+]ccn1C ZINC000635127878 345253689 /nfs/dbraw/zinc/25/36/89/345253689.db2.gz WFRZDGDJMZVMQI-UHFFFAOYSA-N 1 2 235.331 2.125 20 0 BEADLO CCc1nc(C[N@@H+]2CCCC3(CC3)CC2)n[nH]1 ZINC000626114376 345316075 /nfs/dbraw/zinc/31/60/75/345316075.db2.gz DMURHAFHUVBHLV-UHFFFAOYSA-N 1 2 234.347 2.133 20 0 BEADLO CCc1nc(C[N@H+]2CCCC3(CC3)CC2)n[nH]1 ZINC000626114376 345316079 /nfs/dbraw/zinc/31/60/79/345316079.db2.gz DMURHAFHUVBHLV-UHFFFAOYSA-N 1 2 234.347 2.133 20 0 BEADLO CN(C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C1CCCCC1 ZINC000635182733 345266398 /nfs/dbraw/zinc/26/63/98/345266398.db2.gz GPXLKLVXJRXENW-VXGBXAGGSA-N 1 2 247.342 2.304 20 0 BEADLO CN(C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C1CCCCC1 ZINC000635182733 345266400 /nfs/dbraw/zinc/26/64/00/345266400.db2.gz GPXLKLVXJRXENW-VXGBXAGGSA-N 1 2 247.342 2.304 20 0 BEADLO CCc1c[nH]c(CC(=O)NCCC2CCCC2)[nH+]1 ZINC000635220927 345276796 /nfs/dbraw/zinc/27/67/96/345276796.db2.gz UBEZOLSZQAXXAJ-UHFFFAOYSA-N 1 2 249.358 2.211 20 0 BEADLO CC(C)C[C@@H](C(=O)N(C)C(C)C)n1cc[nH+]c1 ZINC000635225709 345278779 /nfs/dbraw/zinc/27/87/79/345278779.db2.gz LPFIEHUXHUUDOR-LBPRGKRZSA-N 1 2 237.347 2.337 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635229353 345279449 /nfs/dbraw/zinc/27/94/49/345279449.db2.gz NKQOYEMXJWFAMT-WRWGMCAJSA-N 1 2 247.342 2.208 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635229353 345279451 /nfs/dbraw/zinc/27/94/51/345279451.db2.gz NKQOYEMXJWFAMT-WRWGMCAJSA-N 1 2 247.342 2.208 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)C1CCC=CCC1 ZINC000635327133 345308944 /nfs/dbraw/zinc/30/89/44/345308944.db2.gz RTNXRGKKHMTWFY-GFCCVEGCSA-N 1 2 247.342 2.134 20 0 BEADLO CN(CC(C)(C)C)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635478051 345388453 /nfs/dbraw/zinc/38/84/53/345388453.db2.gz MBMMWKHMXWCVIL-NXEZZACHSA-N 1 2 235.331 2.018 20 0 BEADLO CN(CC(C)(C)C)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635478051 345388456 /nfs/dbraw/zinc/38/84/56/345388456.db2.gz MBMMWKHMXWCVIL-NXEZZACHSA-N 1 2 235.331 2.018 20 0 BEADLO CC(C)[C@@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635425589 345362749 /nfs/dbraw/zinc/36/27/49/345362749.db2.gz PBRJBHWLXBMBER-WZRBSPASSA-N 1 2 247.342 2.160 20 0 BEADLO CC(C)[C@@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635425589 345362751 /nfs/dbraw/zinc/36/27/51/345362751.db2.gz PBRJBHWLXBMBER-WZRBSPASSA-N 1 2 247.342 2.160 20 0 BEADLO CC(C)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635425587 345362926 /nfs/dbraw/zinc/36/29/26/345362926.db2.gz PBRJBHWLXBMBER-NQBHXWOUSA-N 1 2 247.342 2.160 20 0 BEADLO CC(C)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635425587 345362927 /nfs/dbraw/zinc/36/29/27/345362927.db2.gz PBRJBHWLXBMBER-NQBHXWOUSA-N 1 2 247.342 2.160 20 0 BEADLO CN(CC1CCCC1)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635450338 345376656 /nfs/dbraw/zinc/37/66/56/345376656.db2.gz RVSUUXSJOIAUCF-VXGBXAGGSA-N 1 2 247.342 2.162 20 0 BEADLO CN(CC1CCCC1)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635450338 345376658 /nfs/dbraw/zinc/37/66/58/345376658.db2.gz RVSUUXSJOIAUCF-VXGBXAGGSA-N 1 2 247.342 2.162 20 0 BEADLO Cc1cn2ccc(C(=O)N3CC[C@@H](C)C3)cc2[nH+]1 ZINC000635468191 345385313 /nfs/dbraw/zinc/38/53/13/345385313.db2.gz ZDTIKIZPTCCEPD-SNVBAGLBSA-N 1 2 243.310 2.125 20 0 BEADLO CCOCCCNc1[nH+]c(C)nc2[nH]ccc21 ZINC000080944722 345454105 /nfs/dbraw/zinc/45/41/05/345454105.db2.gz ZSTCFYWKTXLZPB-UHFFFAOYSA-N 1 2 234.303 2.105 20 0 BEADLO c1ccc(N2CCC[C@]3(CCCOC3)C2)[nH+]c1 ZINC000080688420 345434342 /nfs/dbraw/zinc/43/43/42/345434342.db2.gz NHTHVZHKRIWGNH-AWEZNQCLSA-N 1 2 232.327 2.479 20 0 BEADLO Cc1nc(N2CCC[C@@]3(CCCOC3)C2)cc[nH+]1 ZINC000080689287 345435976 /nfs/dbraw/zinc/43/59/76/345435976.db2.gz CQIGMIOQJAVPDI-CQSZACIVSA-N 1 2 247.342 2.182 20 0 BEADLO Cc1cc(CNc2[nH+]c(C)nc3[nH]ccc32)no1 ZINC000080970098 345456491 /nfs/dbraw/zinc/45/64/91/345456491.db2.gz KRRLADWZEISXBE-UHFFFAOYSA-N 1 2 243.270 2.175 20 0 BEADLO CCC[C@H]([NH2+]C1(C2CC2)CC1)C(=O)OCC ZINC000381354552 345459727 /nfs/dbraw/zinc/45/97/27/345459727.db2.gz CSUDMDJVOQEDBR-NSHDSACASA-N 1 2 225.332 2.250 20 0 BEADLO Cc1nc2[nH]ccc2c(NCC[C@H](O)C(C)C)[nH+]1 ZINC000081004908 345460756 /nfs/dbraw/zinc/46/07/56/345460756.db2.gz HKARQKPDZISDJU-NSHDSACASA-N 1 2 248.330 2.085 20 0 BEADLO C[C@H]1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)CC1 ZINC000635540891 345521914 /nfs/dbraw/zinc/52/19/14/345521914.db2.gz QIRGIZFFENNGTO-DDHJBXDOSA-N 1 2 247.342 2.208 20 0 BEADLO C[C@H]1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)CC1 ZINC000635540891 345521916 /nfs/dbraw/zinc/52/19/16/345521916.db2.gz QIRGIZFFENNGTO-DDHJBXDOSA-N 1 2 247.342 2.208 20 0 BEADLO C[C@H](CO)[C@H](C)Nc1cc[nH+]c2ccncc12 ZINC000085687884 345528536 /nfs/dbraw/zinc/52/85/36/345528536.db2.gz PVOZCMDEKXEQFT-ZJUUUORDSA-N 1 2 231.299 2.059 20 0 BEADLO COC[C@H]1CCN(c2cc[nH+]c3ccncc32)C1 ZINC000085687828 345528628 /nfs/dbraw/zinc/52/86/28/345528628.db2.gz OKTFFKLCYRTCCV-NSHDSACASA-N 1 2 243.310 2.103 20 0 BEADLO C[C@@H](Nc1cc[nH+]c2ccncc12)[C@H](C)CO ZINC000085687882 345529073 /nfs/dbraw/zinc/52/90/73/345529073.db2.gz PVOZCMDEKXEQFT-NXEZZACHSA-N 1 2 231.299 2.059 20 0 BEADLO c1cn(CCSC[C@@H]2CCCCO2)c[nH+]1 ZINC000090199853 345567370 /nfs/dbraw/zinc/56/73/70/345567370.db2.gz HJWKNPRNTCIOCF-NSHDSACASA-N 1 2 226.345 2.185 20 0 BEADLO CCc1c[nH]c(CC(=O)N(C)C[C@@H](C)CC)[nH+]1 ZINC000635545502 345569530 /nfs/dbraw/zinc/56/95/30/345569530.db2.gz DDQULXJNSCQKHO-JTQLQIEISA-N 1 2 237.347 2.019 20 0 BEADLO FC(F)(F)COCCCNc1cccc[nH+]1 ZINC000091453127 345592877 /nfs/dbraw/zinc/59/28/77/345592877.db2.gz IOIMZWNYGMIEKO-UHFFFAOYSA-N 1 2 234.221 2.463 20 0 BEADLO O[C@@H]1Cc2ccccc2[C@@H]1Nc1cccc[nH+]1 ZINC000091431380 345592887 /nfs/dbraw/zinc/59/28/87/345592887.db2.gz KCPGJYPLGNYKTA-OCCSQVGLSA-N 1 2 226.279 2.152 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2ncnn2C)c1C ZINC000093810755 345664556 /nfs/dbraw/zinc/66/45/56/345664556.db2.gz RALNXROGJDQEAN-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2ncnn2C)c1C ZINC000093810755 345664561 /nfs/dbraw/zinc/66/45/61/345664561.db2.gz RALNXROGJDQEAN-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ncnn2C)cc1C ZINC000093810893 345664838 /nfs/dbraw/zinc/66/48/38/345664838.db2.gz OQAFXJIEWXWHAH-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ncnn2C)cc1C ZINC000093810893 345664839 /nfs/dbraw/zinc/66/48/39/345664839.db2.gz OQAFXJIEWXWHAH-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Fc1cc(F)c2c(c1)CN(Cc1c[nH+]c[nH]1)CC2 ZINC000093838335 345665365 /nfs/dbraw/zinc/66/53/65/345665365.db2.gz ZQFSSMYLJAOBOV-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO Fc1cc(F)c2c(c1)CN(Cc1c[nH]c[nH+]1)CC2 ZINC000093838335 345665366 /nfs/dbraw/zinc/66/53/66/345665366.db2.gz ZQFSSMYLJAOBOV-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO CC(C)C[N@H+](C)Cc1ncn(-c2ccccc2)n1 ZINC000092795017 345643155 /nfs/dbraw/zinc/64/31/55/345643155.db2.gz YAPYACAHFIPRJO-UHFFFAOYSA-N 1 2 244.342 2.355 20 0 BEADLO CC(C)C[N@@H+](C)Cc1ncn(-c2ccccc2)n1 ZINC000092795017 345643158 /nfs/dbraw/zinc/64/31/58/345643158.db2.gz YAPYACAHFIPRJO-UHFFFAOYSA-N 1 2 244.342 2.355 20 0 BEADLO Cc1nc(N[C@@H](C)C(F)F)c2c([nH+]1)CCCC2 ZINC000641729549 362644380 /nfs/dbraw/zinc/64/43/80/362644380.db2.gz GOTPUPBYTQCMQM-ZETCQYMHSA-N 1 2 241.285 2.151 20 0 BEADLO Fc1cccc2c1CN(Cc1c[nH+]c[nH]1)CC2 ZINC000093454262 345670458 /nfs/dbraw/zinc/67/04/58/345670458.db2.gz OCJUODGDWJATRX-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO CC(=O)c1ccc(C[NH+]2[C@H](C)COC[C@H]2C)cc1 ZINC000115161840 345676652 /nfs/dbraw/zinc/67/66/52/345676652.db2.gz FVMODMJEVQWWBO-VXGBXAGGSA-N 1 2 247.338 2.498 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3sccc3C2)n(C)n1 ZINC000143997766 345707276 /nfs/dbraw/zinc/70/72/76/345707276.db2.gz JEKQZUNYYDZDJY-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1cc(C[N@H+]2CCc3sccc3C2)n(C)n1 ZINC000143997766 345707279 /nfs/dbraw/zinc/70/72/79/345707279.db2.gz JEKQZUNYYDZDJY-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1ccc(Cl)c(NC(=O)Cn2cc[nH+]c2)c1 ZINC000162243557 345708246 /nfs/dbraw/zinc/70/82/46/345708246.db2.gz RHRSELDSSGGPCK-UHFFFAOYSA-N 1 2 249.701 2.484 20 0 BEADLO C[C@H](NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C1CCCC1 ZINC000635565180 345789984 /nfs/dbraw/zinc/78/99/84/345789984.db2.gz BAJOGWAFEWMJHJ-MVWJERBFSA-N 1 2 247.342 2.208 20 0 BEADLO C[C@H](NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C1CCCC1 ZINC000635565180 345789988 /nfs/dbraw/zinc/78/99/88/345789988.db2.gz BAJOGWAFEWMJHJ-MVWJERBFSA-N 1 2 247.342 2.208 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1CC[C@H](c2n[nH]c(C)n2)C1 ZINC000528529318 323096626 /nfs/dbraw/zinc/09/66/26/323096626.db2.gz ZUSAXQQZYUWKKN-ANRVEHPFSA-N 1 2 240.738 2.045 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1CC[C@H](c2n[nH]c(C)n2)C1 ZINC000528529328 323096691 /nfs/dbraw/zinc/09/66/91/323096691.db2.gz ZUSAXQQZYUWKKN-GJQXAKHRSA-N 1 2 240.738 2.045 20 0 BEADLO C[C@H]1CCCCCN1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635570369 345826448 /nfs/dbraw/zinc/82/64/48/345826448.db2.gz YESVFFZJIRTUIS-QJPTWQEYSA-N 1 2 247.342 2.304 20 0 BEADLO C[C@H]1CCCCCN1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635570369 345826449 /nfs/dbraw/zinc/82/64/49/345826449.db2.gz YESVFFZJIRTUIS-QJPTWQEYSA-N 1 2 247.342 2.304 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CCC[C@H](C)[C@@H]2C)[nH+]1 ZINC000635602618 345887938 /nfs/dbraw/zinc/88/79/38/345887938.db2.gz JGFSCIKWUGAZTR-QWRGUYRKSA-N 1 2 249.358 2.162 20 0 BEADLO C[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)[C@H]1C ZINC000635604720 345888908 /nfs/dbraw/zinc/88/89/08/345888908.db2.gz WJBSBLZKGIKJGR-NNYUYHANSA-N 1 2 247.342 2.160 20 0 BEADLO C[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)[C@H]1C ZINC000635604720 345888910 /nfs/dbraw/zinc/88/89/10/345888910.db2.gz WJBSBLZKGIKJGR-NNYUYHANSA-N 1 2 247.342 2.160 20 0 BEADLO C[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)[C@@H]1C ZINC000635604718 345888935 /nfs/dbraw/zinc/88/89/35/345888935.db2.gz WJBSBLZKGIKJGR-DDHJBXDOSA-N 1 2 247.342 2.160 20 0 BEADLO C[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)[C@@H]1C ZINC000635604718 345888937 /nfs/dbraw/zinc/88/89/37/345888937.db2.gz WJBSBLZKGIKJGR-DDHJBXDOSA-N 1 2 247.342 2.160 20 0 BEADLO CC(C)C[C@H](C(=O)NCCC1CC1)n1cc[nH+]c1 ZINC000635618457 345895629 /nfs/dbraw/zinc/89/56/29/345895629.db2.gz SZVPJTMIRUTXTO-CYBMUJFWSA-N 1 2 249.358 2.387 20 0 BEADLO CC[C@@H]1C[C@H](C)CN1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635634320 345908287 /nfs/dbraw/zinc/90/82/87/345908287.db2.gz DGZFBVAFPGPYJJ-IRCOFANPSA-N 1 2 247.342 2.160 20 0 BEADLO CC[C@@H]1C[C@H](C)CN1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635634320 345908290 /nfs/dbraw/zinc/90/82/90/345908290.db2.gz DGZFBVAFPGPYJJ-IRCOFANPSA-N 1 2 247.342 2.160 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C1CCC=CCC1 ZINC000635637007 345911259 /nfs/dbraw/zinc/91/12/59/345911259.db2.gz FTXAOYFUBUOUHX-UHFFFAOYSA-N 1 2 233.315 2.081 20 0 BEADLO CC(C)=C(C)CC(=O)NCc1[nH]c[nH+]c1C ZINC000635638984 345913027 /nfs/dbraw/zinc/91/30/27/345913027.db2.gz XAWVUFYPYLLORG-UHFFFAOYSA-N 1 2 221.304 2.081 20 0 BEADLO CCc1[nH]c(CNC(=O)CC(C)(C)C)c[nH+]1 ZINC001639094238 1172071941 /nfs/dbraw/zinc/07/19/41/1172071941.db2.gz XTJGTZZBBCPRDJ-UHFFFAOYSA-N 1 2 223.320 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)CC(C)(C)C)[nH+]1 ZINC001639094238 1172071946 /nfs/dbraw/zinc/07/19/46/1172071946.db2.gz XTJGTZZBBCPRDJ-UHFFFAOYSA-N 1 2 223.320 2.025 20 0 BEADLO C[C@H](CC(=O)N1CCCC1(C)C)n1cc[nH+]c1 ZINC000563215849 323102952 /nfs/dbraw/zinc/10/29/52/323102952.db2.gz CZAMKCZYCJXRTP-LLVKDONJSA-N 1 2 235.331 2.235 20 0 BEADLO CCc1[nH]c(CNC(=O)C(C)(C)CC)c[nH+]1 ZINC001639093627 1172072524 /nfs/dbraw/zinc/07/25/24/1172072524.db2.gz LTAQDFRFQHYDSB-UHFFFAOYSA-N 1 2 223.320 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)C(C)(C)CC)[nH+]1 ZINC001639093627 1172072534 /nfs/dbraw/zinc/07/25/34/1172072534.db2.gz LTAQDFRFQHYDSB-UHFFFAOYSA-N 1 2 223.320 2.025 20 0 BEADLO CC(C)=C(C)CC(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000635714210 346026044 /nfs/dbraw/zinc/02/60/44/346026044.db2.gz AZDPIEZKMLEFPJ-NSHDSACASA-N 1 2 247.342 2.130 20 0 BEADLO CC(C)=C(C)CC(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000635714210 346026047 /nfs/dbraw/zinc/02/60/47/346026047.db2.gz AZDPIEZKMLEFPJ-NSHDSACASA-N 1 2 247.342 2.130 20 0 BEADLO CC(C)c1nc(C[NH2+]C2(C3CC3)CC2)no1 ZINC000381489713 346040195 /nfs/dbraw/zinc/04/01/95/346040195.db2.gz WWCIXLDVIHFAED-UHFFFAOYSA-N 1 2 221.304 2.225 20 0 BEADLO CC(C)CCCNC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000563223236 323104767 /nfs/dbraw/zinc/10/47/67/323104767.db2.gz WZQKPZFWVUHHCK-LBPRGKRZSA-N 1 2 237.347 2.387 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@@H](C)CCC2CC2)[nH+]1 ZINC000635809516 346073685 /nfs/dbraw/zinc/07/36/85/346073685.db2.gz JXNPDXMZVQDKJC-JTQLQIEISA-N 1 2 249.358 2.210 20 0 BEADLO CCc1c[nH]c(CC(=O)NC[C@H]2CC[C@@H](C)C2)[nH+]1 ZINC000635882151 346100992 /nfs/dbraw/zinc/10/09/92/346100992.db2.gz SYAGQEQXKXTJNV-MNOVXSKESA-N 1 2 249.358 2.067 20 0 BEADLO CCc1c[nH]c(CC(=O)NC[C@@H]2CCC[C@@H]2C)[nH+]1 ZINC000635893203 346103789 /nfs/dbraw/zinc/10/37/89/346103789.db2.gz MNKFBACTUAPSOI-QWRGUYRKSA-N 1 2 249.358 2.067 20 0 BEADLO C[C@H]1CCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635892858 346104038 /nfs/dbraw/zinc/10/40/38/346104038.db2.gz DMEAZWMIQCALAB-NNYUYHANSA-N 1 2 247.342 2.066 20 0 BEADLO C[C@H]1CCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635892858 346104042 /nfs/dbraw/zinc/10/40/42/346104042.db2.gz DMEAZWMIQCALAB-NNYUYHANSA-N 1 2 247.342 2.066 20 0 BEADLO CC(C)(NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C1CCC1 ZINC000635991609 346142104 /nfs/dbraw/zinc/14/21/04/346142104.db2.gz LUAPQHXRFWWTAL-GHMZBOCLSA-N 1 2 247.342 2.208 20 0 BEADLO CC(C)(NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C1CCC1 ZINC000635991609 346142106 /nfs/dbraw/zinc/14/21/06/346142106.db2.gz LUAPQHXRFWWTAL-GHMZBOCLSA-N 1 2 247.342 2.208 20 0 BEADLO Cc1cn2ccc(C(=O)N[C@@H]3CC[C@H]3C)cc2[nH+]1 ZINC000635924914 346116069 /nfs/dbraw/zinc/11/60/69/346116069.db2.gz FNEGRSDGRNDTBT-BXKDBHETSA-N 1 2 243.310 2.171 20 0 BEADLO CC(C)C[C@H](C(=O)N[C@@H]1CC[C@H]1C)n1cc[nH+]c1 ZINC000635926473 346116629 /nfs/dbraw/zinc/11/66/29/346116629.db2.gz SYSDKVRHQGRKKK-JHJVBQTASA-N 1 2 249.358 2.385 20 0 BEADLO Cc1cnc(CNc2cccc[nH+]2)s1 ZINC000235933674 346171831 /nfs/dbraw/zinc/17/18/31/346171831.db2.gz CUHAFIHHYLXBCN-UHFFFAOYSA-N 1 2 205.286 2.459 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636018974 346157838 /nfs/dbraw/zinc/15/78/38/346157838.db2.gz QIDMJTBPQWXKEU-KOXOONSLSA-N 1 2 247.342 2.064 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636018974 346157840 /nfs/dbraw/zinc/15/78/40/346157840.db2.gz QIDMJTBPQWXKEU-KOXOONSLSA-N 1 2 247.342 2.064 20 0 BEADLO Cc1[nH]c(CN2CCc3ncsc3C2)[nH+]c1C ZINC000628244634 346209251 /nfs/dbraw/zinc/20/92/51/346209251.db2.gz PJZKJJJRTDXJAT-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2ccccn2)o1 ZINC000628238304 346195492 /nfs/dbraw/zinc/19/54/92/346195492.db2.gz SVZTUKBIQAGEMM-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2ccccn2)o1 ZINC000628238304 346195497 /nfs/dbraw/zinc/19/54/97/346195497.db2.gz SVZTUKBIQAGEMM-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO CCc1cc(N[C@@H](C)c2cn(C)nc2C)nc[nH+]1 ZINC000603390812 349943877 /nfs/dbraw/zinc/94/38/77/349943877.db2.gz OMNYRBDTCONWDV-VIFPVBQESA-N 1 2 245.330 2.254 20 0 BEADLO CCn1ccc(C[N@H+](C)Cc2nc(C)c[nH]2)c1 ZINC000628250832 346220607 /nfs/dbraw/zinc/22/06/07/346220607.db2.gz HPDPMKDIHOJHSV-UHFFFAOYSA-N 1 2 232.331 2.172 20 0 BEADLO CCn1ccc(C[N@@H+](C)Cc2nc(C)c[nH]2)c1 ZINC000628250832 346220612 /nfs/dbraw/zinc/22/06/12/346220612.db2.gz HPDPMKDIHOJHSV-UHFFFAOYSA-N 1 2 232.331 2.172 20 0 BEADLO Cc1ncc(C[N@@H+]2CCO[C@@H](C(C)(C)C)C2)o1 ZINC000628254577 346238844 /nfs/dbraw/zinc/23/88/44/346238844.db2.gz HQQAELQQWWPVAA-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1ncc(C[N@H+]2CCO[C@@H](C(C)(C)C)C2)o1 ZINC000628254577 346238846 /nfs/dbraw/zinc/23/88/46/346238846.db2.gz HQQAELQQWWPVAA-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO CCCCc1cc(N[C@H]2CO[C@@H](C)C2)nc[nH+]1 ZINC000631331512 346261057 /nfs/dbraw/zinc/26/10/57/346261057.db2.gz WFZQVAQKSBVCOP-CMPLNLGQSA-N 1 2 235.331 2.409 20 0 BEADLO C[C@H]1CSCC[N@@H+]1Cc1ccc(Cl)nn1 ZINC000167407631 346244388 /nfs/dbraw/zinc/24/43/88/346244388.db2.gz WBXWQCDXYQEOPC-QMMMGPOBSA-N 1 2 243.763 2.067 20 0 BEADLO C[C@H]1CSCC[N@H+]1Cc1ccc(Cl)nn1 ZINC000167407631 346244389 /nfs/dbraw/zinc/24/43/89/346244389.db2.gz WBXWQCDXYQEOPC-QMMMGPOBSA-N 1 2 243.763 2.067 20 0 BEADLO Cc1c[nH]c(CN2CCCC[C@H]2C(F)F)[nH+]1 ZINC000628262652 346261712 /nfs/dbraw/zinc/26/17/12/346261712.db2.gz SQLCLWKSKIWHHI-VIFPVBQESA-N 1 2 229.274 2.338 20 0 BEADLO FC(F)C[N@@H+]1CCC[C@]2(CCCOC2)C1 ZINC000673857210 488310339 /nfs/dbraw/zinc/31/03/39/488310339.db2.gz KORAWHBKLMPFTP-NSHDSACASA-N 1 2 219.275 2.144 20 0 BEADLO FC(F)C[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000673857210 488310343 /nfs/dbraw/zinc/31/03/43/488310343.db2.gz KORAWHBKLMPFTP-NSHDSACASA-N 1 2 219.275 2.144 20 0 BEADLO Cc1cccc(C)c1C[N@@H+](C)Cc1nncn1C ZINC000286947602 179033926 /nfs/dbraw/zinc/03/39/26/179033926.db2.gz MJUAYRGSYMASPQ-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cccc(C)c1C[N@H+](C)Cc1nncn1C ZINC000286947602 179033929 /nfs/dbraw/zinc/03/39/29/179033929.db2.gz MJUAYRGSYMASPQ-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Nc1cnccc1C[NH2+]C1(C(F)F)CCCC1 ZINC000641754019 362680184 /nfs/dbraw/zinc/68/01/84/362680184.db2.gz KIISFCISBMRLMX-UHFFFAOYSA-N 1 2 241.285 2.331 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)C1CCC=CCC1 ZINC000636169334 346345032 /nfs/dbraw/zinc/34/50/32/346345032.db2.gz PPDYAIVQNJMLMK-UHFFFAOYSA-N 1 2 233.315 2.115 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)C1CCC=CCC1 ZINC000636169334 346345033 /nfs/dbraw/zinc/34/50/33/346345033.db2.gz PPDYAIVQNJMLMK-UHFFFAOYSA-N 1 2 233.315 2.115 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@@](C)(CC)C2CC2)[nH+]1 ZINC000636205440 346354079 /nfs/dbraw/zinc/35/40/79/346354079.db2.gz YWSDJORLMVHJQI-AWEZNQCLSA-N 1 2 249.358 2.210 20 0 BEADLO Cc1cccc(CCCNc2ncccn2)[nH+]1 ZINC000286712121 179056315 /nfs/dbraw/zinc/05/63/15/179056315.db2.gz ZHCLHWMEEQZWQR-UHFFFAOYSA-N 1 2 228.299 2.225 20 0 BEADLO CC[C@H](C)N(CC)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636156493 346338268 /nfs/dbraw/zinc/33/82/68/346338268.db2.gz SSJZQRWMQMIUNF-HBNTYKKESA-N 1 2 235.331 2.160 20 0 BEADLO CC[C@H](C)N(CC)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636156493 346338269 /nfs/dbraw/zinc/33/82/69/346338269.db2.gz SSJZQRWMQMIUNF-HBNTYKKESA-N 1 2 235.331 2.160 20 0 BEADLO CCC(=O)c1ccc(NC(=O)[C@@H](C)[NH+](C)C)cc1 ZINC000636271939 346374570 /nfs/dbraw/zinc/37/45/70/346374570.db2.gz MBTFIRUIIHVQBH-SNVBAGLBSA-N 1 2 248.326 2.168 20 0 BEADLO CC(C)C(NC(=O)CCc1c[nH+]c[nH]1)C(C)C ZINC000684463761 488316696 /nfs/dbraw/zinc/31/66/96/488316696.db2.gz JSBIRGXSSBSOFS-UHFFFAOYSA-N 1 2 237.347 2.139 20 0 BEADLO CC(C)C(NC(=O)CCc1c[nH]c[nH+]1)C(C)C ZINC000684463761 488316698 /nfs/dbraw/zinc/31/66/98/488316698.db2.gz JSBIRGXSSBSOFS-UHFFFAOYSA-N 1 2 237.347 2.139 20 0 BEADLO CCC(C)(C)CCNC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636310930 346388145 /nfs/dbraw/zinc/38/81/45/346388145.db2.gz QVOSDOHSLCYFEU-GHMZBOCLSA-N 1 2 249.358 2.456 20 0 BEADLO CCC(C)(C)CCNC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636310930 346388148 /nfs/dbraw/zinc/38/81/48/346388148.db2.gz QVOSDOHSLCYFEU-GHMZBOCLSA-N 1 2 249.358 2.456 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2cccc(C)c2)n1C ZINC000080070544 179069078 /nfs/dbraw/zinc/06/90/78/179069078.db2.gz HAPOSNBGHOYLDE-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2cccc(C)c2)n1C ZINC000080070544 179069079 /nfs/dbraw/zinc/06/90/79/179069079.db2.gz HAPOSNBGHOYLDE-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cccc(C[N@@H+](C)[C@H](C)c2cnccn2)n1 ZINC000341317805 179069553 /nfs/dbraw/zinc/06/95/53/179069553.db2.gz LTADHLKOEIXECE-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cccc(C[N@H+](C)[C@H](C)c2cnccn2)n1 ZINC000341317805 179069556 /nfs/dbraw/zinc/06/95/56/179069556.db2.gz LTADHLKOEIXECE-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2cnn[nH]2)c1C ZINC000295161009 179066767 /nfs/dbraw/zinc/06/67/67/179066767.db2.gz DMQMLFACQDEZIZ-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2cnn[nH]2)c1C ZINC000295161009 179066768 /nfs/dbraw/zinc/06/67/68/179066768.db2.gz DMQMLFACQDEZIZ-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2c[nH]nn2)c1C ZINC000295161009 179066770 /nfs/dbraw/zinc/06/67/70/179066770.db2.gz DMQMLFACQDEZIZ-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2c[nH]nn2)c1C ZINC000295161009 179066772 /nfs/dbraw/zinc/06/67/72/179066772.db2.gz DMQMLFACQDEZIZ-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO CCSC1(CNc2cc[nH+]cc2F)CC1 ZINC000603408969 349959019 /nfs/dbraw/zinc/95/90/19/349959019.db2.gz IDFBPSNOYVVKKG-UHFFFAOYSA-N 1 2 226.320 2.340 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2cnc[nH]2)c1 ZINC000280336804 179067754 /nfs/dbraw/zinc/06/77/54/179067754.db2.gz AZSNYLAHJNWQRD-UHFFFAOYSA-N 1 2 215.300 2.350 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2cnc[nH]2)c1 ZINC000280336804 179067757 /nfs/dbraw/zinc/06/77/57/179067757.db2.gz AZSNYLAHJNWQRD-UHFFFAOYSA-N 1 2 215.300 2.350 20 0 BEADLO Cc1cccc(C[N@@H+]2CCO[C@@H](C)C2)c1F ZINC000294595905 179079545 /nfs/dbraw/zinc/07/95/45/179079545.db2.gz SSWKSOBRLHXELI-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cccc(C[N@H+]2CCO[C@@H](C)C2)c1F ZINC000294595905 179079548 /nfs/dbraw/zinc/07/95/48/179079548.db2.gz SSWKSOBRLHXELI-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ncncc1[C@@H](C)[NH2+][C@H](C)C(F)F ZINC000641792568 362728149 /nfs/dbraw/zinc/72/81/49/362728149.db2.gz XJZWVEVPIWSEJQ-HTQZYQBOSA-N 1 2 215.247 2.089 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CC[C@@H](C)[C@H](F)C2)o1 ZINC000679219241 488318610 /nfs/dbraw/zinc/31/86/10/488318610.db2.gz FMQIKBQNHNWOPQ-KHQFGBGNSA-N 1 2 227.283 2.119 20 0 BEADLO CC(C)OC1CC[NH+](CC(F)F)CC1 ZINC000603412786 349961199 /nfs/dbraw/zinc/96/11/99/349961199.db2.gz NGPAANFDVLITLU-UHFFFAOYSA-N 1 2 207.264 2.141 20 0 BEADLO C[C@@H]([NH2+]Cc1c2c(nn1C)CCCC2)C(F)F ZINC000641795165 362738268 /nfs/dbraw/zinc/73/82/68/362738268.db2.gz VFOIKIYUMPJGIF-MRVPVSSYSA-N 1 2 243.301 2.042 20 0 BEADLO Cc1cccc(CN2CCn3c[nH+]cc3C2)c1F ZINC000295942686 179082604 /nfs/dbraw/zinc/08/26/04/179082604.db2.gz GKHIHQQBTBVLMT-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO Cc1cccc2[nH+]cc(CN[C@H](C)C(F)F)n21 ZINC000641793621 362735634 /nfs/dbraw/zinc/73/56/34/362735634.db2.gz MBTFGIXMPBHQPV-SECBINFHSA-N 1 2 239.269 2.386 20 0 BEADLO Cn1c[nH+]cc1[C@@H]1CCCCN1CC(F)F ZINC000603413979 349962979 /nfs/dbraw/zinc/96/29/79/349962979.db2.gz UUYRBWBVZLPREU-VIFPVBQESA-N 1 2 229.274 2.212 20 0 BEADLO Cn1c[nH+]cc1[C@H]1CCCCN1CC(F)F ZINC000603413978 349962987 /nfs/dbraw/zinc/96/29/87/349962987.db2.gz UUYRBWBVZLPREU-SECBINFHSA-N 1 2 229.274 2.212 20 0 BEADLO FC1(C[NH2+]Cc2noc3c2CCCC3)CC1 ZINC000381629732 346483595 /nfs/dbraw/zinc/48/35/95/346483595.db2.gz OQOMVOGHYDQBBT-UHFFFAOYSA-N 1 2 224.279 2.145 20 0 BEADLO CC[C@@H](C[N@H+](CC(F)F)C1CC1)OC ZINC000419207539 192103571 /nfs/dbraw/zinc/10/35/71/192103571.db2.gz PCPUJDRTWAVASU-VIFPVBQESA-N 1 2 207.264 2.141 20 0 BEADLO CC[C@@H](C[N@@H+](CC(F)F)C1CC1)OC ZINC000419207539 192103573 /nfs/dbraw/zinc/10/35/73/192103573.db2.gz PCPUJDRTWAVASU-VIFPVBQESA-N 1 2 207.264 2.141 20 0 BEADLO Cc1nnc(C[N@@H+]2CCc3ccccc3[C@H]2C)o1 ZINC000170955919 346488999 /nfs/dbraw/zinc/48/89/99/346488999.db2.gz NFXRSEHJLJHJGU-SNVBAGLBSA-N 1 2 243.310 2.497 20 0 BEADLO Cc1nnc(C[N@H+]2CCc3ccccc3[C@H]2C)o1 ZINC000170955919 346489002 /nfs/dbraw/zinc/48/90/02/346489002.db2.gz NFXRSEHJLJHJGU-SNVBAGLBSA-N 1 2 243.310 2.497 20 0 BEADLO CCn1nccc1C[NH2+][C@H](C)c1cscn1 ZINC000580097035 346522710 /nfs/dbraw/zinc/52/27/10/346522710.db2.gz YBSBEJXSNHGIHJ-SECBINFHSA-N 1 2 236.344 2.210 20 0 BEADLO CC[C@@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)C(=O)OC ZINC000419204935 192104109 /nfs/dbraw/zinc/10/41/09/192104109.db2.gz PDUFFQNDGXFHSZ-MELADBBJSA-N 1 2 247.338 2.331 20 0 BEADLO Cc1cnccc1C[N@@H+]1[C@@H](C)[C@@H](C)CC[C@H]1C[NH3+] ZINC000641806384 362764267 /nfs/dbraw/zinc/76/42/67/362764267.db2.gz RIPAHFCEZSMLRI-WHOFXGATSA-N 1 2 247.386 2.338 20 0 BEADLO Cc1cnccc1C[N@H+]1[C@@H](C)[C@@H](C)CC[C@H]1C[NH3+] ZINC000641806384 362764273 /nfs/dbraw/zinc/76/42/73/362764273.db2.gz RIPAHFCEZSMLRI-WHOFXGATSA-N 1 2 247.386 2.338 20 0 BEADLO C[C@H](CN(C)C(=O)Cn1cc[nH+]c1)C(C)(C)C ZINC000636429777 346529245 /nfs/dbraw/zinc/52/92/45/346529245.db2.gz OGHOTPGANSWVLD-LLVKDONJSA-N 1 2 237.347 2.024 20 0 BEADLO Cc1ccc(NC(=O)Cc2c[nH+]cn2C)cc1F ZINC000186778435 346536860 /nfs/dbraw/zinc/53/68/60/346536860.db2.gz HODDEWYBXGLQIE-UHFFFAOYSA-N 1 2 247.273 2.049 20 0 BEADLO Cc1cc(C)c(CNC(=O)N[C@H]2CC23CC3)c[nH+]1 ZINC000580710586 346537031 /nfs/dbraw/zinc/53/70/31/346537031.db2.gz JMEKDGMFKCZTPJ-LBPRGKRZSA-N 1 2 245.326 2.050 20 0 BEADLO C[N@@H+]1CCC[C@H]1C(=O)Nc1cscc1Cl ZINC000636438960 346547066 /nfs/dbraw/zinc/54/70/66/346547066.db2.gz QOSPDUDHBCZFFP-VIFPVBQESA-N 1 2 244.747 2.434 20 0 BEADLO C[N@H+]1CCC[C@H]1C(=O)Nc1cscc1Cl ZINC000636438960 346547068 /nfs/dbraw/zinc/54/70/68/346547068.db2.gz QOSPDUDHBCZFFP-VIFPVBQESA-N 1 2 244.747 2.434 20 0 BEADLO CC[C@@H](C)NC(=O)C[N@H+](CC)Cc1ccoc1 ZINC000588169225 346645028 /nfs/dbraw/zinc/64/50/28/346645028.db2.gz IHLUINHBGGMWIO-LLVKDONJSA-N 1 2 238.331 2.016 20 0 BEADLO CC[C@@H](C)NC(=O)C[N@@H+](CC)Cc1ccoc1 ZINC000588169225 346645029 /nfs/dbraw/zinc/64/50/29/346645029.db2.gz IHLUINHBGGMWIO-LLVKDONJSA-N 1 2 238.331 2.016 20 0 BEADLO CO[C@H](Cn1cc[nH+]c1)c1ccccc1 ZINC000203458119 346633788 /nfs/dbraw/zinc/63/37/88/346633788.db2.gz DLZHOBRHZICOPF-GFCCVEGCSA-N 1 2 202.257 2.271 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1CCC(C)(C)CC1 ZINC000580213994 346693904 /nfs/dbraw/zinc/69/39/04/346693904.db2.gz ZYJPEZPZVIRNEJ-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1CCC(C)(C)CC1 ZINC000580213994 346693907 /nfs/dbraw/zinc/69/39/07/346693907.db2.gz ZYJPEZPZVIRNEJ-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H]1CC[C@@H](C)N(C(=O)CCCn2cc[nH+]c2)C1 ZINC000075277355 346743085 /nfs/dbraw/zinc/74/30/85/346743085.db2.gz UTCSEFVMULSAEJ-CHWSQXEVSA-N 1 2 249.358 2.310 20 0 BEADLO C[C@@H]1CC[C@H](C)CN1C(=O)CCCn1cc[nH+]c1 ZINC000075277356 346743214 /nfs/dbraw/zinc/74/32/14/346743214.db2.gz UTCSEFVMULSAEJ-QWHCGFSZSA-N 1 2 249.358 2.310 20 0 BEADLO CC1CCC(C)(NC(=O)Cc2c[nH+]cn2C)CC1 ZINC000188341550 346803973 /nfs/dbraw/zinc/80/39/73/346803973.db2.gz HEYFZVAEQYJTBT-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CCOC(=O)C1(C)CC([NH2+][C@H](CC)C(F)F)C1 ZINC000601278997 347142177 /nfs/dbraw/zinc/14/21/77/347142177.db2.gz NJXMCGMTMPRBPR-NBBOBHDQSA-N 1 2 249.301 2.352 20 0 BEADLO Cc1cccc([C@@H](O)CNc2cc[nH+]c(C)n2)c1 ZINC000132569240 179187779 /nfs/dbraw/zinc/18/77/79/179187779.db2.gz KRUUGGNJGCCJOW-ZDUSSCGKSA-N 1 2 243.310 2.239 20 0 BEADLO CCCCS[C@@H](C)c1nc(C[NH2+]C)no1 ZINC000309850044 347186394 /nfs/dbraw/zinc/18/63/94/347186394.db2.gz XCRFTSOCZOBCQK-QMMMGPOBSA-N 1 2 229.349 2.383 20 0 BEADLO CCCC[C@@H]([NH2+][C@@H]1CSC1(C)C)C(=O)OC ZINC000310038176 347221339 /nfs/dbraw/zinc/22/13/39/347221339.db2.gz VVSGGUDIACYOGI-NXEZZACHSA-N 1 2 245.388 2.202 20 0 BEADLO Cc1ncc(C[N@@H+]2C[C@@]3(CCCO3)[C@@H]2C2CC2)o1 ZINC000628297118 347244079 /nfs/dbraw/zinc/24/40/79/347244079.db2.gz KMXQKJQYNOLDCR-KBPBESRZSA-N 1 2 248.326 2.126 20 0 BEADLO Cc1ncc(C[N@H+]2C[C@@]3(CCCO3)[C@@H]2C2CC2)o1 ZINC000628297118 347244082 /nfs/dbraw/zinc/24/40/82/347244082.db2.gz KMXQKJQYNOLDCR-KBPBESRZSA-N 1 2 248.326 2.126 20 0 BEADLO Cc1cccc([C@H](C)[NH2+][C@@H]2CCOC2=O)c1C ZINC000115603293 179196681 /nfs/dbraw/zinc/19/66/81/179196681.db2.gz RLELPJIYXOYHKM-WCQYABFASA-N 1 2 233.311 2.270 20 0 BEADLO CCCC[C@H](C)C(=O)Nc1ccc(N)[nH+]c1 ZINC000300946739 347286543 /nfs/dbraw/zinc/28/65/43/347286543.db2.gz OLSCDTMEXPCREE-VIFPVBQESA-N 1 2 221.304 2.429 20 0 BEADLO CCc1[nH+]c(C)ccc1OCCC1OCCO1 ZINC000190775937 347336029 /nfs/dbraw/zinc/33/60/29/347336029.db2.gz XLZZKEXSLSAQKR-UHFFFAOYSA-N 1 2 237.299 2.094 20 0 BEADLO Cc1ccccc1N(C)C(=O)CCc1[nH]cc[nH+]1 ZINC000623047835 347304574 /nfs/dbraw/zinc/30/45/74/347304574.db2.gz XSYGFKWEBJJCSZ-UHFFFAOYSA-N 1 2 243.310 2.314 20 0 BEADLO CC[N@@H+]1CCOC[C@H]1c1ccc(F)cc1 ZINC000334635972 136740904 /nfs/dbraw/zinc/74/09/04/136740904.db2.gz QZMNWASLFYKUNT-LBPRGKRZSA-N 1 2 209.264 2.219 20 0 BEADLO CC[N@H+]1CCOC[C@H]1c1ccc(F)cc1 ZINC000334635972 136740905 /nfs/dbraw/zinc/74/09/05/136740905.db2.gz QZMNWASLFYKUNT-LBPRGKRZSA-N 1 2 209.264 2.219 20 0 BEADLO CC[N@H+](Cc1c(Cl)cnn1C)C1CC1 ZINC000189656291 347307326 /nfs/dbraw/zinc/30/73/26/347307326.db2.gz ZVOMMALYUPQGSG-UHFFFAOYSA-N 1 2 213.712 2.058 20 0 BEADLO CC[N@@H+](Cc1c(Cl)cnn1C)C1CC1 ZINC000189656291 347307329 /nfs/dbraw/zinc/30/73/29/347307329.db2.gz ZVOMMALYUPQGSG-UHFFFAOYSA-N 1 2 213.712 2.058 20 0 BEADLO CC(C)(C)[C@H]1CCN(c2cc(CO)cc[nH+]2)C1 ZINC000161561240 362820899 /nfs/dbraw/zinc/82/08/99/362820899.db2.gz GIXKYPHWJAATHD-LBPRGKRZSA-N 1 2 234.343 2.446 20 0 BEADLO CC1(C)CCC[C@H]1NC(=O)CCc1c[nH+]c[nH]1 ZINC000193459010 347397431 /nfs/dbraw/zinc/39/74/31/347397431.db2.gz ROTJRYYKUAKZRZ-LLVKDONJSA-N 1 2 235.331 2.037 20 0 BEADLO CC1(C)CCC[C@H]1NC(=O)CCc1c[nH]c[nH+]1 ZINC000193459010 347397433 /nfs/dbraw/zinc/39/74/33/347397433.db2.gz ROTJRYYKUAKZRZ-LLVKDONJSA-N 1 2 235.331 2.037 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)C1CC(C(C)(C)C)C1 ZINC000616921682 347450892 /nfs/dbraw/zinc/45/08/92/347450892.db2.gz ZEKCABIGXZJXGK-UHFFFAOYSA-N 1 2 249.358 2.440 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)C1CC(C(C)(C)C)C1 ZINC000616921682 347450898 /nfs/dbraw/zinc/45/08/98/347450898.db2.gz ZEKCABIGXZJXGK-UHFFFAOYSA-N 1 2 249.358 2.440 20 0 BEADLO Cc1cccc2[nH+]c(CNc3cnccn3)cn21 ZINC000301212101 179230426 /nfs/dbraw/zinc/23/04/26/179230426.db2.gz WBSMZCDWJJSJHQ-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)[C@@]1(C)CC=CCC1 ZINC000616922319 347452717 /nfs/dbraw/zinc/45/27/17/347452717.db2.gz XVPOYSAOGGHAHB-ZDUSSCGKSA-N 1 2 233.315 2.115 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)[C@@]1(C)CC=CCC1 ZINC000616922319 347452718 /nfs/dbraw/zinc/45/27/18/347452718.db2.gz XVPOYSAOGGHAHB-ZDUSSCGKSA-N 1 2 233.315 2.115 20 0 BEADLO CCC(C)(C)CC(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616925819 347457166 /nfs/dbraw/zinc/45/71/66/347457166.db2.gz RALUAZZMJQKJCR-UHFFFAOYSA-N 1 2 223.320 2.194 20 0 BEADLO CCC(C)(C)CC(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616925819 347457168 /nfs/dbraw/zinc/45/71/68/347457168.db2.gz RALUAZZMJQKJCR-UHFFFAOYSA-N 1 2 223.320 2.194 20 0 BEADLO Cc1csc(C(=O)N(C)Cc2c[nH+]c[nH]2)c1 ZINC000616928510 347494572 /nfs/dbraw/zinc/49/45/72/347494572.db2.gz CEZHPBINUAIUHT-UHFFFAOYSA-N 1 2 235.312 2.052 20 0 BEADLO Cc1csc(C(=O)N(C)Cc2c[nH]c[nH+]2)c1 ZINC000616928510 347494573 /nfs/dbraw/zinc/49/45/73/347494573.db2.gz CEZHPBINUAIUHT-UHFFFAOYSA-N 1 2 235.312 2.052 20 0 BEADLO CC(C)c1[nH]ccc1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616928714 347494636 /nfs/dbraw/zinc/49/46/36/347494636.db2.gz JNMOOSWBXOBSDU-UHFFFAOYSA-N 1 2 246.314 2.133 20 0 BEADLO CC(C)c1[nH]ccc1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616928714 347494638 /nfs/dbraw/zinc/49/46/38/347494638.db2.gz JNMOOSWBXOBSDU-UHFFFAOYSA-N 1 2 246.314 2.133 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)CC1CC(C)(C)C1 ZINC000616928465 347494824 /nfs/dbraw/zinc/49/48/24/347494824.db2.gz AHNAQUBFTZFKQD-UHFFFAOYSA-N 1 2 235.331 2.194 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)CC1CC(C)(C)C1 ZINC000616928465 347494827 /nfs/dbraw/zinc/49/48/27/347494827.db2.gz AHNAQUBFTZFKQD-UHFFFAOYSA-N 1 2 235.331 2.194 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616929026 347495736 /nfs/dbraw/zinc/49/57/36/347495736.db2.gz RGCZGFMGAZNRAM-ZYHUDNBSSA-N 1 2 235.331 2.194 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616929026 347495740 /nfs/dbraw/zinc/49/57/40/347495740.db2.gz RGCZGFMGAZNRAM-ZYHUDNBSSA-N 1 2 235.331 2.194 20 0 BEADLO Cc1nnc(C[NH2+][C@@H](C)c2cncs2)s1 ZINC000380105938 365882457 /nfs/dbraw/zinc/88/24/57/365882457.db2.gz NDBWHGMIAGSXGN-LURJTMIESA-N 1 2 240.357 2.154 20 0 BEADLO CC[C@H](C)N(CC)C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000616973860 347544908 /nfs/dbraw/zinc/54/49/08/347544908.db2.gz FCANZJBJJQZNSR-QWRGUYRKSA-N 1 2 237.347 2.235 20 0 BEADLO CC[C@H](C)N(CC)C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000616973860 347544912 /nfs/dbraw/zinc/54/49/12/347544912.db2.gz FCANZJBJJQZNSR-QWRGUYRKSA-N 1 2 237.347 2.235 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)[C@@H]1CCn2cc[nH+]c2C1 ZINC000616974550 347545849 /nfs/dbraw/zinc/54/58/49/347545849.db2.gz NQFMOHGWBIICBS-VXGBXAGGSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@H](C)N(CC)C(=O)[C@@H]1CCc2c[nH+]cn2C1 ZINC000616976848 347556980 /nfs/dbraw/zinc/55/69/80/347556980.db2.gz YCNRBIVFXUGYHI-NWDGAFQWSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)[C@H]1CCc2c[nH+]cn2C1 ZINC000616976847 347557057 /nfs/dbraw/zinc/55/70/57/347557057.db2.gz YCNRBIVFXUGYHI-NEPJUHHUSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1ccccc1CC(=O)Nc1cc[nH+]cc1O ZINC000109889973 179260518 /nfs/dbraw/zinc/26/05/18/179260518.db2.gz QHDJFYVMJYKERR-UHFFFAOYSA-N 1 2 242.278 2.277 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000616975356 347546601 /nfs/dbraw/zinc/54/66/01/347546601.db2.gz BOCXQGUHVJGTDN-GHMZBOCLSA-N 1 2 249.358 2.162 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000616975356 347546604 /nfs/dbraw/zinc/54/66/04/347546604.db2.gz BOCXQGUHVJGTDN-GHMZBOCLSA-N 1 2 249.358 2.162 20 0 BEADLO CC[C@H](C)N(CC)C(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000616975359 347546860 /nfs/dbraw/zinc/54/68/60/347546860.db2.gz BOCXQGUHVJGTDN-WDEREUQCSA-N 1 2 249.358 2.162 20 0 BEADLO CC[C@H](C)N(CC)C(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000616975359 347546864 /nfs/dbraw/zinc/54/68/64/347546864.db2.gz BOCXQGUHVJGTDN-WDEREUQCSA-N 1 2 249.358 2.162 20 0 BEADLO CC[C@H](C)N(CC)C(=O)[C@@H]1CCc2[nH+]ccn2C1 ZINC000616976612 347547375 /nfs/dbraw/zinc/54/73/75/347547375.db2.gz TXWCUCARHSQLEK-NWDGAFQWSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1ccccc1C[N@@H+](C)[C@@H](C)c1nncn1C ZINC000286674690 179270439 /nfs/dbraw/zinc/27/04/39/179270439.db2.gz ARESFOSSKUHMGO-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1ccccc1C[N@H+](C)[C@@H](C)c1nncn1C ZINC000286674690 179270442 /nfs/dbraw/zinc/27/04/42/179270442.db2.gz ARESFOSSKUHMGO-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO O=C(CCCn1cc[nH+]c1)N1CCC[C@H]1C1CC1 ZINC000591202714 347630234 /nfs/dbraw/zinc/63/02/34/347630234.db2.gz VUYJPTMGUBTCCQ-ZDUSSCGKSA-N 1 2 247.342 2.064 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)C(=O)OC(C)(C)C)[C@@H]1CC1(F)F ZINC000591377425 347651401 /nfs/dbraw/zinc/65/14/01/347651401.db2.gz STFMTYROAOFJJK-VGMNWLOBSA-N 1 2 249.301 2.350 20 0 BEADLO CCOC[C@@H](C)[NH2+][C@@H](CC)C(=O)OC(C)(C)C ZINC000592399319 347777164 /nfs/dbraw/zinc/77/71/64/347777164.db2.gz GJZOCKZYDZXSFF-MNOVXSKESA-N 1 2 245.363 2.121 20 0 BEADLO CCOC(=O)C(C)(C)[NH2+]CC1=CCCC1 ZINC000592067248 347726643 /nfs/dbraw/zinc/72/66/43/347726643.db2.gz VZGFUKGDNXFKMM-UHFFFAOYSA-N 1 2 211.305 2.028 20 0 BEADLO CCC(CC)([NH2+]CC1=CCCC1)C(=O)OC ZINC000592103318 347734004 /nfs/dbraw/zinc/73/40/04/347734004.db2.gz GQFBICIIIWOYEZ-UHFFFAOYSA-N 1 2 225.332 2.418 20 0 BEADLO Cc1ccccc1C[S@](=O)Cc1[nH+]ccn1C ZINC000129257016 179293278 /nfs/dbraw/zinc/29/32/78/179293278.db2.gz NBAUJXJAFBBOBJ-QGZVFWFLSA-N 1 2 248.351 2.177 20 0 BEADLO Cc1ccccc1NCc1[nH+]ccn1C ZINC000036804435 179305671 /nfs/dbraw/zinc/30/56/71/179305671.db2.gz ADCDRWXVHPJVJZ-UHFFFAOYSA-N 1 2 201.273 2.341 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@H](OC(F)F)C2)no1 ZINC000679682820 488364239 /nfs/dbraw/zinc/36/42/39/488364239.db2.gz JUMJFLZJWMFOBF-SNVBAGLBSA-N 1 2 246.257 2.187 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@H](OC(F)F)C2)no1 ZINC000679682820 488364241 /nfs/dbraw/zinc/36/42/41/488364241.db2.gz JUMJFLZJWMFOBF-SNVBAGLBSA-N 1 2 246.257 2.187 20 0 BEADLO Cc1ccccc1NCc1c[nH+]cn1C ZINC000085167763 179306293 /nfs/dbraw/zinc/30/62/93/179306293.db2.gz KRNNIQQAJGWVDA-UHFFFAOYSA-N 1 2 201.273 2.341 20 0 BEADLO Cc1ccccc1OCc1c[nH+]cn1C ZINC000090233666 179312402 /nfs/dbraw/zinc/31/24/02/179312402.db2.gz RTHHYRWTNPXSHG-UHFFFAOYSA-N 1 2 202.257 2.308 20 0 BEADLO Cc1ccccc1[C@@H](C)[N@H+](C)Cc1ncnn1C ZINC000267445310 179318215 /nfs/dbraw/zinc/31/82/15/179318215.db2.gz ZPEORBMKTPCYCZ-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1ccccc1[C@@H](C)[N@@H+](C)Cc1ncnn1C ZINC000267445310 179318216 /nfs/dbraw/zinc/31/82/16/179318216.db2.gz ZPEORBMKTPCYCZ-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CC[C@@H](CC2CC2)C1 ZINC000493600207 347925023 /nfs/dbraw/zinc/92/50/23/347925023.db2.gz WUOSLCDBZYOJHY-PCAWENJQSA-N 1 2 245.326 2.072 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1CC[C@@H](F)C1 ZINC000577411875 365950473 /nfs/dbraw/zinc/95/04/73/365950473.db2.gz LDXQDJKAPXSSBV-NXEZZACHSA-N 1 2 209.268 2.396 20 0 BEADLO C[C@@H](CNc1cccc[nH+]1)C(=O)OC(C)(C)C ZINC000594595074 348079827 /nfs/dbraw/zinc/07/98/27/348079827.db2.gz FGOXLUKZNMIXSP-JTQLQIEISA-N 1 2 236.315 2.471 20 0 BEADLO Cc1cccn2cc(CNC(=O)CC(C)C)[nH+]c12 ZINC000071435396 179356072 /nfs/dbraw/zinc/35/60/72/179356072.db2.gz QVDMAZDGCDGJDV-UHFFFAOYSA-N 1 2 245.326 2.305 20 0 BEADLO COc1ccc(COCCn2cc[nH+]c2)cc1 ZINC000594717307 348107013 /nfs/dbraw/zinc/10/70/13/348107013.db2.gz AOKYAKDBMBSALN-UHFFFAOYSA-N 1 2 232.283 2.109 20 0 BEADLO CCCC[C@H]([NH2+]CCC(C)(C)F)C(=O)OC ZINC000594725065 348108538 /nfs/dbraw/zinc/10/85/38/348108538.db2.gz JCPQMHBQWCCWBO-JTQLQIEISA-N 1 2 233.327 2.446 20 0 BEADLO Cc1cccn2cc(CS[C@H](C)CO)[nH+]c12 ZINC000079092720 179356817 /nfs/dbraw/zinc/35/68/17/179356817.db2.gz OIXGCGJQEHUXEY-SNVBAGLBSA-N 1 2 236.340 2.257 20 0 BEADLO CCCC[C@H]([NH2+]C[C@]1(C)CC1(F)F)C(=O)OC ZINC000594732707 348108920 /nfs/dbraw/zinc/10/89/20/348108920.db2.gz XDQDDWPJOAIECY-ONGXEEELSA-N 1 2 249.301 2.353 20 0 BEADLO CCC[C@@H]([NH2+]CCC(C)(C)F)C(=O)OCC ZINC000594731335 348113554 /nfs/dbraw/zinc/11/35/54/348113554.db2.gz RBVUAAPKPCBXQB-SNVBAGLBSA-N 1 2 233.327 2.446 20 0 BEADLO CC1CC([NH2+]Cc2[nH]ncc2Br)C1 ZINC000307262125 323176736 /nfs/dbraw/zinc/17/67/36/323176736.db2.gz RHSMQZFBDLSCGC-UHFFFAOYSA-N 1 2 244.136 2.060 20 0 BEADLO Cc1c(F)cccc1NC(=O)NCc1[nH]cc[nH+]1 ZINC000120779316 187387193 /nfs/dbraw/zinc/38/71/93/187387193.db2.gz IGWKENZXMDGJMG-UHFFFAOYSA-N 1 2 248.261 2.179 20 0 BEADLO C/C=C/C=C/C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000378521262 187390371 /nfs/dbraw/zinc/39/03/71/187390371.db2.gz UTKSTDKCNLEJSZ-VLIWCEOLSA-N 1 2 231.299 2.206 20 0 BEADLO Cc1nc(NCCOC2CCCC2)cc[nH+]1 ZINC000082627686 348189764 /nfs/dbraw/zinc/18/97/64/348189764.db2.gz AKWZQKLPMYCQMZ-UHFFFAOYSA-N 1 2 221.304 2.156 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)Nc1ccc(F)cc1F ZINC000493806892 348208443 /nfs/dbraw/zinc/20/84/43/348208443.db2.gz CWRFECKTEPFARS-RQOWECAXSA-N 1 2 249.220 2.340 20 0 BEADLO CO[C@H](CC(C)C)C[N@@H+]1CCC(F)(F)C1 ZINC000419256451 192115368 /nfs/dbraw/zinc/11/53/68/192115368.db2.gz XJQSWHKYOQJXGM-SNVBAGLBSA-N 1 2 221.291 2.389 20 0 BEADLO CO[C@H](CC(C)C)C[N@H+]1CCC(F)(F)C1 ZINC000419256451 192115369 /nfs/dbraw/zinc/11/53/69/192115369.db2.gz XJQSWHKYOQJXGM-SNVBAGLBSA-N 1 2 221.291 2.389 20 0 BEADLO CCOC(=O)C(CC)(CC)[NH2+]C[C@H](CC)OC ZINC000419297297 192119433 /nfs/dbraw/zinc/11/94/33/192119433.db2.gz YSABQVHGLNATAG-NSHDSACASA-N 1 2 245.363 2.123 20 0 BEADLO CCc1nnc([C@@H](C)[N@H+](CC)CCSC)[nH]1 ZINC000595570907 348284407 /nfs/dbraw/zinc/28/44/07/348284407.db2.gz ZWTGZSPLFCHRQS-SECBINFHSA-N 1 2 242.392 2.113 20 0 BEADLO CCc1nnc([C@@H](C)[N@@H+](CC)CCSC)[nH]1 ZINC000595570907 348284409 /nfs/dbraw/zinc/28/44/09/348284409.db2.gz ZWTGZSPLFCHRQS-SECBINFHSA-N 1 2 242.392 2.113 20 0 BEADLO COC(=O)[C@@H](C)[NH+]1CCC(c2ccco2)CC1 ZINC000595618367 348290579 /nfs/dbraw/zinc/29/05/79/348290579.db2.gz OGKKJCKUGOFAQP-SNVBAGLBSA-N 1 2 237.299 2.021 20 0 BEADLO COC(=O)[C@@]1([NH2+]CCSC)CC[C@@H](C)CC1 ZINC000595707343 348319993 /nfs/dbraw/zinc/31/99/93/348319993.db2.gz NPOUSGUAQOPPOJ-UMSPYCQHSA-N 1 2 245.388 2.061 20 0 BEADLO Cc1ccoc1C(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001639423938 1172104837 /nfs/dbraw/zinc/10/48/37/1172104837.db2.gz XXCMKGKICFIJEU-UHFFFAOYSA-N 1 2 247.298 2.365 20 0 BEADLO Cc1ccoc1C(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001639423938 1172104839 /nfs/dbraw/zinc/10/48/39/1172104839.db2.gz XXCMKGKICFIJEU-UHFFFAOYSA-N 1 2 247.298 2.365 20 0 BEADLO COC(=O)C[NH2+]C(C)(C)Cc1ccc(C)cc1 ZINC000419339845 192125726 /nfs/dbraw/zinc/12/57/26/192125726.db2.gz VHYLWTAQOQFLJX-UHFFFAOYSA-N 1 2 235.327 2.079 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@@H]2CC2(C)C)c1 ZINC000596087013 348443085 /nfs/dbraw/zinc/44/30/85/348443085.db2.gz HEFKTVBWQXWFCA-SNVBAGLBSA-N 1 2 234.299 2.008 20 0 BEADLO Cc1noc([C@H](C)[N@H+]2C[C@@H](C)S[C@@H](C)C2)n1 ZINC000075892758 349992620 /nfs/dbraw/zinc/99/26/20/349992620.db2.gz AWJXIDOXQPHVTA-YIZRAAEISA-N 1 2 241.360 2.265 20 0 BEADLO Cc1noc([C@H](C)[N@@H+]2C[C@@H](C)S[C@@H](C)C2)n1 ZINC000075892758 349992623 /nfs/dbraw/zinc/99/26/23/349992623.db2.gz AWJXIDOXQPHVTA-YIZRAAEISA-N 1 2 241.360 2.265 20 0 BEADLO Cc1cc[nH+]cc1CCCNc1cnn(C)c1 ZINC000289252019 179478272 /nfs/dbraw/zinc/47/82/72/179478272.db2.gz LZOSRHLWSPYIHH-UHFFFAOYSA-N 1 2 230.315 2.168 20 0 BEADLO C[N@@H+](Cc1cscn1)C[C@@H]1CCCCO1 ZINC000052460361 323193297 /nfs/dbraw/zinc/19/32/97/323193297.db2.gz MVCGYIIYMYQWOI-NSHDSACASA-N 1 2 226.345 2.144 20 0 BEADLO C[N@H+](Cc1cscn1)C[C@@H]1CCCCO1 ZINC000052460361 323193298 /nfs/dbraw/zinc/19/32/98/323193298.db2.gz MVCGYIIYMYQWOI-NSHDSACASA-N 1 2 226.345 2.144 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCOCC23CCCCC3)n1 ZINC000628300829 348623680 /nfs/dbraw/zinc/62/36/80/348623680.db2.gz YMVOSTCPJOWNCE-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCOCC23CCCCC3)n1 ZINC000628300829 348623682 /nfs/dbraw/zinc/62/36/82/348623682.db2.gz YMVOSTCPJOWNCE-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2cnn(C)c2C)o1 ZINC000330832078 179647952 /nfs/dbraw/zinc/64/79/52/179647952.db2.gz HIIDERZVYYTKKK-VHSXEESVSA-N 1 2 248.330 2.437 20 0 BEADLO CCCCOCCNc1cc[nH+]c(C)n1 ZINC000054936077 348846072 /nfs/dbraw/zinc/84/60/72/348846072.db2.gz KNCVUTVEAYSAIH-UHFFFAOYSA-N 1 2 209.293 2.014 20 0 BEADLO CC(=O)c1ccc(C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000207925407 348836274 /nfs/dbraw/zinc/83/62/74/348836274.db2.gz BPFAFWGYMQMABZ-RYUDHWBXSA-N 1 2 247.338 2.498 20 0 BEADLO Cc1c[nH+]cc(N[C@H]2CCO[C@@H](C)C2)c1 ZINC000225853054 179684470 /nfs/dbraw/zinc/68/44/70/179684470.db2.gz LNBHGBBUENJJBE-QWRGUYRKSA-N 1 2 206.289 2.369 20 0 BEADLO CS[C@@H](C)C(=O)Nc1ccn2cc(C)[nH+]c2c1 ZINC000598468863 348979598 /nfs/dbraw/zinc/97/95/98/348979598.db2.gz MOFXQOAXGZYZQF-VIFPVBQESA-N 1 2 249.339 2.333 20 0 BEADLO CC(C)(C)OC(=O)C[N@@H+]1CCCC(F)(F)CC1 ZINC000599551534 349215201 /nfs/dbraw/zinc/21/52/01/349215201.db2.gz OZTZUROTLHLXJH-UHFFFAOYSA-N 1 2 249.301 2.449 20 0 BEADLO CC(C)(C)OC(=O)C[N@H+]1CCCC(F)(F)CC1 ZINC000599551534 349215204 /nfs/dbraw/zinc/21/52/04/349215204.db2.gz OZTZUROTLHLXJH-UHFFFAOYSA-N 1 2 249.301 2.449 20 0 BEADLO Cc1n[nH]cc1C[N@@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000289623834 179845984 /nfs/dbraw/zinc/84/59/84/179845984.db2.gz WMTORHAWBVICKW-CYBMUJFWSA-N 1 2 245.330 2.168 20 0 BEADLO Cc1n[nH]cc1C[N@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000289623834 179845987 /nfs/dbraw/zinc/84/59/87/179845987.db2.gz WMTORHAWBVICKW-CYBMUJFWSA-N 1 2 245.330 2.168 20 0 BEADLO CCCC[C@H](C)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000300917863 349429643 /nfs/dbraw/zinc/42/96/43/349429643.db2.gz KUVXLHBRCLWYAC-VHSXEESVSA-N 1 2 223.320 2.413 20 0 BEADLO CC(C)(C)c1csc([C@@H]2COCC[NH2+]2)n1 ZINC000076136775 190991527 /nfs/dbraw/zinc/99/15/27/190991527.db2.gz ABFUBRAGJUZGLH-QMMMGPOBSA-N 1 2 226.345 2.102 20 0 BEADLO Cc1nc2[nH]ccc2c(NCCCCF)[nH+]1 ZINC000336682899 180018076 /nfs/dbraw/zinc/01/80/76/180018076.db2.gz DGVDUAACZOMQDL-UHFFFAOYSA-N 1 2 222.267 2.380 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@H](C)C2CC2)[nH+]1 ZINC000309812367 180024223 /nfs/dbraw/zinc/02/42/23/180024223.db2.gz UNVHATBHNFCZNB-SSDOTTSWSA-N 1 2 216.288 2.477 20 0 BEADLO CCC[C@H]([NH2+][C@H]1CCS[C@H]1C)C(=O)OCC ZINC000390748161 362949644 /nfs/dbraw/zinc/94/96/44/362949644.db2.gz BHAZSWAWRMCPGH-DCAQKATOSA-N 1 2 245.388 2.202 20 0 BEADLO Cc1nc([C@H](C)[NH2+]Cc2cc[nH]n2)c(C)s1 ZINC000041014829 180049593 /nfs/dbraw/zinc/04/95/93/180049593.db2.gz PQKXIVAQBNTUOU-ZETCQYMHSA-N 1 2 236.344 2.334 20 0 BEADLO Cc1cc(C[N@@H+]2CC(C)(C)OCC2(C)C)no1 ZINC000604386861 350122519 /nfs/dbraw/zinc/12/25/19/350122519.db2.gz UTLVPCKWIPHAMH-UHFFFAOYSA-N 1 2 238.331 2.372 20 0 BEADLO Cc1cc(C[N@H+]2CC(C)(C)OCC2(C)C)no1 ZINC000604386861 350122523 /nfs/dbraw/zinc/12/25/23/350122523.db2.gz UTLVPCKWIPHAMH-UHFFFAOYSA-N 1 2 238.331 2.372 20 0 BEADLO Cc1nc(SCc2c[nH+]cn2C)oc1C ZINC000336412750 180030820 /nfs/dbraw/zinc/03/08/20/180030820.db2.gz ACLGOEYZOXQFIS-UHFFFAOYSA-N 1 2 223.301 2.317 20 0 BEADLO Cc1nc2ccc(C[NH+]3CCOCC3)cc2s1 ZINC000336343218 180092042 /nfs/dbraw/zinc/09/20/42/180092042.db2.gz XCJNTAWHZJLKJP-UHFFFAOYSA-N 1 2 248.351 2.437 20 0 BEADLO Cc1nc(NC[C@H]2CCOC2)c2c([nH+]1)CCCC2 ZINC000272926105 180070745 /nfs/dbraw/zinc/07/07/45/180070745.db2.gz UPSUBFQCGNKTGU-LLVKDONJSA-N 1 2 247.342 2.112 20 0 BEADLO Cc1[nH+]c2ccccc2n1[C@H](C)[C@@H](C)O ZINC000044184401 180103602 /nfs/dbraw/zinc/10/36/02/180103602.db2.gz ZMTRFGWKMYMZKD-RKDXNWHRSA-N 1 2 204.273 2.287 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H](C)C2CCCCC2)c[nH+]1 ZINC000339223554 180132687 /nfs/dbraw/zinc/13/26/87/180132687.db2.gz BSWKCJMNGODQAU-VIFPVBQESA-N 1 2 235.331 2.417 20 0 BEADLO Cc1ncc(C[N@@H+]2CCO[C@H]3CCC[C@H]32)s1 ZINC000299197900 180144036 /nfs/dbraw/zinc/14/40/36/180144036.db2.gz KQTOZLPYAAZHBZ-NEPJUHHUSA-N 1 2 238.356 2.205 20 0 BEADLO Cc1ncc(C[N@H+]2CCO[C@H]3CCC[C@H]32)s1 ZINC000299197900 180144037 /nfs/dbraw/zinc/14/40/37/180144037.db2.gz KQTOZLPYAAZHBZ-NEPJUHHUSA-N 1 2 238.356 2.205 20 0 BEADLO Cc1ncc(C[NH2+][C@@H](C)c2ccon2)s1 ZINC000336770329 180155315 /nfs/dbraw/zinc/15/53/15/180155315.db2.gz WMTMQWAGTQUTLT-ZETCQYMHSA-N 1 2 223.301 2.290 20 0 BEADLO Cc1ncc(C[NH2+][C@H]2C[C@H](C)n3ccnc32)s1 ZINC000294133894 180158638 /nfs/dbraw/zinc/15/86/38/180158638.db2.gz OSHQIOAGMVNYGG-KWQFWETISA-N 1 2 248.355 2.444 20 0 BEADLO Cc1ncc(COc2cc[nH+]cc2)s1 ZINC000335811985 180162925 /nfs/dbraw/zinc/16/29/25/180162925.db2.gz JOLZMJFWFZJVRD-UHFFFAOYSA-N 1 2 206.270 2.426 20 0 BEADLO Cc1nc(N2CCOC[C@H](C3CCC3)C2)cc[nH+]1 ZINC000292149624 180194282 /nfs/dbraw/zinc/19/42/82/180194282.db2.gz CDCPOVIIKSEQIS-CYBMUJFWSA-N 1 2 247.342 2.038 20 0 BEADLO Cc1nc(N2C[C@H]3CCC[C@@H]3C2)cc[nH+]1 ZINC000129088275 180194752 /nfs/dbraw/zinc/19/47/52/180194752.db2.gz KEKABRWHWKVDMK-GHMZBOCLSA-N 1 2 203.289 2.021 20 0 BEADLO Cc1nc(NC2CCSCC2)cc[nH+]1 ZINC000127177658 180197601 /nfs/dbraw/zinc/19/76/01/180197601.db2.gz OZQONWRBABDJBL-UHFFFAOYSA-N 1 2 209.318 2.093 20 0 BEADLO Cc1nc(NCCCc2ccccn2)cc[nH+]1 ZINC000178840628 180198617 /nfs/dbraw/zinc/19/86/17/180198617.db2.gz YBXFLKCLVRSBSJ-UHFFFAOYSA-N 1 2 228.299 2.225 20 0 BEADLO Cc1nc(NCCc2ccc(Cl)nc2)cc[nH+]1 ZINC000151891996 180199955 /nfs/dbraw/zinc/19/99/55/180199955.db2.gz IZBAHKIYZLMGEH-UHFFFAOYSA-N 1 2 248.717 2.488 20 0 BEADLO Cc1ccc(CNc2cc[nH+]c(C)n2)o1 ZINC000054936570 180200919 /nfs/dbraw/zinc/20/09/19/180200919.db2.gz PITYWLSKDDKOKK-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO Cc1nc(NC[C@]2(C)CCCC[C@@H]2O)cc[nH+]1 ZINC000175060124 180200923 /nfs/dbraw/zinc/20/09/23/180200923.db2.gz ZUZAMDRLRRTMGK-AAEUAGOBSA-N 1 2 235.331 2.138 20 0 BEADLO Cc1nc(NC[C@H](C)c2nccs2)cc[nH+]1 ZINC000182669988 180201018 /nfs/dbraw/zinc/20/10/18/180201018.db2.gz GYQHNJUGDHOKCR-QMMMGPOBSA-N 1 2 234.328 2.457 20 0 BEADLO Cc1nc(NC[C@H]2CCO[C@H](C)C2)cc[nH+]1 ZINC000271289124 180201133 /nfs/dbraw/zinc/20/11/33/180201133.db2.gz DQVIAQAFVXWGHI-KOLCDFICSA-N 1 2 221.304 2.012 20 0 BEADLO Cc1nc(CNc2cc[nH+]c(C)n2)sc1C ZINC000309711794 180202122 /nfs/dbraw/zinc/20/21/22/180202122.db2.gz QWQJAPCPHIFDLU-UHFFFAOYSA-N 1 2 234.328 2.470 20 0 BEADLO Cc1c([C@H](C)Nc2cc[nH+]c(C)n2)cnn1C ZINC000266443981 180202653 /nfs/dbraw/zinc/20/26/53/180202653.db2.gz WMZYLYKEDOTQNQ-QMMMGPOBSA-N 1 2 231.303 2.000 20 0 BEADLO Cc1nc(N[C@@H]2CCO[C@H](C(C)C)C2)cc[nH+]1 ZINC000271485275 180202795 /nfs/dbraw/zinc/20/27/95/180202795.db2.gz VCLQJBYKXCYLRS-NEPJUHHUSA-N 1 2 235.331 2.401 20 0 BEADLO Cc1nc(N[C@@H](c2ncc[nH]2)C(C)C)cc[nH+]1 ZINC000285786409 180203128 /nfs/dbraw/zinc/20/31/28/180203128.db2.gz XEMIUNKIBPVPQA-LLVKDONJSA-N 1 2 231.303 2.317 20 0 BEADLO Cc1nc(NCc2cccs2)cc[nH+]1 ZINC000054935785 180203594 /nfs/dbraw/zinc/20/35/94/180203594.db2.gz ZBWVWCJLVBYMNH-UHFFFAOYSA-N 1 2 205.286 2.459 20 0 BEADLO Cc1nc(N[C@@H]2CCC[C@@H]2OC(F)F)cc[nH+]1 ZINC000336919284 180203689 /nfs/dbraw/zinc/20/36/89/180203689.db2.gz PXCLJMGNZHPWTK-BDAKNGLRSA-N 1 2 243.257 2.357 20 0 BEADLO Cc1nc(N[C@@H]2CCC[C@H]3OCC[C@@H]32)cc[nH+]1 ZINC000153261395 180203693 /nfs/dbraw/zinc/20/36/93/180203693.db2.gz NSSODHIHQWXLHR-IJLUTSLNSA-N 1 2 233.315 2.155 20 0 BEADLO Cc1nc(N[C@@H]2COc3ccc(F)cc32)cc[nH+]1 ZINC000341669925 180205335 /nfs/dbraw/zinc/20/53/35/180205335.db2.gz WMURBLWNUZPSCX-LLVKDONJSA-N 1 2 245.257 2.470 20 0 BEADLO Cc1nc(N[C@H](C)Cc2ccco2)cc[nH+]1 ZINC000054936042 180206047 /nfs/dbraw/zinc/20/60/47/180206047.db2.gz ZZTBGAJFSVVXAX-SECBINFHSA-N 1 2 217.272 2.421 20 0 BEADLO Cc1nc(N[C@H]2CCO[C@H](C(C)C)C2)cc[nH+]1 ZINC000271485277 180207417 /nfs/dbraw/zinc/20/74/17/180207417.db2.gz VCLQJBYKXCYLRS-RYUDHWBXSA-N 1 2 235.331 2.401 20 0 BEADLO Cc1nc(N[C@@H](C)Cc2ccccc2F)cc[nH+]1 ZINC000360954418 180181800 /nfs/dbraw/zinc/18/18/00/180181800.db2.gz NHPYKYJFOIQZDI-JTQLQIEISA-N 1 2 245.301 2.389 20 0 BEADLO Cc1nc(N[C@H](C)Cc2ccccc2F)cc[nH+]1 ZINC000360954419 180181964 /nfs/dbraw/zinc/18/19/64/180181964.db2.gz NHPYKYJFOIQZDI-SNVBAGLBSA-N 1 2 245.301 2.389 20 0 BEADLO CCc1ccc([C@@H](CO)[NH2+]Cc2cocn2)cc1 ZINC000428878314 191080520 /nfs/dbraw/zinc/08/05/20/191080520.db2.gz CAKAUVXNZZMQNH-CQSZACIVSA-N 1 2 246.310 2.060 20 0 BEADLO Cc1[nH+]cccc1NC[C@@H]1CCC=CO1 ZINC000085711498 180226382 /nfs/dbraw/zinc/22/63/82/180226382.db2.gz JBTDOFHXANUSBJ-NSHDSACASA-N 1 2 204.273 2.495 20 0 BEADLO Cc1[nH+]cccc1N[C@@H](C)[C@H]1CCOC1 ZINC000162942930 180226896 /nfs/dbraw/zinc/22/68/96/180226896.db2.gz ZELGWWHZOVPTLK-ONGXEEELSA-N 1 2 206.289 2.227 20 0 BEADLO CC(F)(F)C[NH2+]Cc1cccc2n[nH]cc21 ZINC000623532807 362952251 /nfs/dbraw/zinc/95/22/51/362952251.db2.gz IAOKVARSCAQSDW-UHFFFAOYSA-N 1 2 225.242 2.308 20 0 BEADLO CC(C)Cn1nccc1C[N@@H+]1CC[C@@H](F)C1 ZINC000648040099 490407368 /nfs/dbraw/zinc/40/73/68/490407368.db2.gz BURIBASZRIXSBM-LLVKDONJSA-N 1 2 225.311 2.083 20 0 BEADLO CC(C)Cn1nccc1C[N@H+]1CC[C@@H](F)C1 ZINC000648040099 490407372 /nfs/dbraw/zinc/40/73/72/490407372.db2.gz BURIBASZRIXSBM-LLVKDONJSA-N 1 2 225.311 2.083 20 0 BEADLO CCOc1nnc(C[N@@H+]2CCCC[C@@H]2C)s1 ZINC000049982651 350273391 /nfs/dbraw/zinc/27/33/91/350273391.db2.gz YKGRZINNTHHOIH-VIFPVBQESA-N 1 2 241.360 2.311 20 0 BEADLO CCOc1nnc(C[N@H+]2CCCC[C@@H]2C)s1 ZINC000049982651 350273393 /nfs/dbraw/zinc/27/33/93/350273393.db2.gz YKGRZINNTHHOIH-VIFPVBQESA-N 1 2 241.360 2.311 20 0 BEADLO CCO[C@@H](C(=O)Nc1c(C)cc[nH+]c1C)C1CC1 ZINC000637241760 350339265 /nfs/dbraw/zinc/33/92/65/350339265.db2.gz AOKSLXPYTLTJGX-CYBMUJFWSA-N 1 2 248.326 2.452 20 0 BEADLO Cc1nocc1C(=O)Nc1c(C)cc[nH+]c1C ZINC000637242443 350340061 /nfs/dbraw/zinc/34/00/61/350340061.db2.gz KAMLCVJXNMSIJG-UHFFFAOYSA-N 1 2 231.255 2.247 20 0 BEADLO CCC[NH2+][C@H](c1ncn[nH]1)C1CCCCC1 ZINC000083746913 350354475 /nfs/dbraw/zinc/35/44/75/350354475.db2.gz ZENWPEGQRIFWHD-NSHDSACASA-N 1 2 222.336 2.426 20 0 BEADLO CCN(C(=O)Nc1ccc2[nH+]ccn2c1)C1CC1 ZINC000606582182 350372978 /nfs/dbraw/zinc/37/29/78/350372978.db2.gz GFWUJIDZMSXUKA-UHFFFAOYSA-N 1 2 244.298 2.351 20 0 BEADLO C[C@@H]1C[C@@H]1CNC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606581122 350374618 /nfs/dbraw/zinc/37/46/18/350374618.db2.gz RCLJKWHTEDMKEO-NXEZZACHSA-N 1 2 244.298 2.112 20 0 BEADLO CCc1cc(NCCc2ccco2)nc[nH+]1 ZINC000040765206 350395334 /nfs/dbraw/zinc/39/53/34/350395334.db2.gz KWQZWQBDBJDKBA-UHFFFAOYSA-N 1 2 217.272 2.287 20 0 BEADLO CO[C@H](C)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000162713382 350420721 /nfs/dbraw/zinc/42/07/21/350420721.db2.gz MYAZJLQVFLJFLF-SECBINFHSA-N 1 2 245.282 2.050 20 0 BEADLO Cc1ncc(C[NH+]2CC(CC(F)(F)F)C2)o1 ZINC000628307013 350442142 /nfs/dbraw/zinc/44/21/42/350442142.db2.gz IYSNRRJTMXVUJR-UHFFFAOYSA-N 1 2 234.221 2.367 20 0 BEADLO Cc1nn(C)cc1CNc1cc[nH+]c(C2CC2)n1 ZINC000273354183 180375235 /nfs/dbraw/zinc/37/52/35/180375235.db2.gz CNJQYGMKSQBERQ-UHFFFAOYSA-N 1 2 243.314 2.008 20 0 BEADLO CC(C)(C)CCC(=O)N[C@H]1CCn2cc[nH+]c2C1 ZINC000427995996 191105629 /nfs/dbraw/zinc/10/56/29/191105629.db2.gz MPRUMTCLYCJPCV-NSHDSACASA-N 1 2 249.358 2.140 20 0 BEADLO CCn1ccc(C[NH2+][C@@H](C)c2ccoc2)n1 ZINC000577470317 365962455 /nfs/dbraw/zinc/96/24/55/365962455.db2.gz SIYGGXHWLREVOT-JTQLQIEISA-N 1 2 219.288 2.347 20 0 BEADLO COc1c(C)[nH+]c(C2CC2)nc1N[C@@H]1CC[C@H]1C ZINC000580784282 350532871 /nfs/dbraw/zinc/53/28/71/350532871.db2.gz RZEHOYJAHKVSJL-LDYMZIIASA-N 1 2 247.342 2.303 20 0 BEADLO CC[C@@H]1[C@@H](C)CCN1C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000577498159 365970792 /nfs/dbraw/zinc/97/07/92/365970792.db2.gz LZXOHJRVSPLSGL-YNEHKIRRSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1nnc(C[NH2+]C2(c3ccc(F)cc3)CC2)o1 ZINC000341692016 180411711 /nfs/dbraw/zinc/41/17/11/180411711.db2.gz HHZXIFMBZWFMFU-UHFFFAOYSA-N 1 2 247.273 2.296 20 0 BEADLO Cn1c2c(cccc2F)[nH]c1=[NH+]CC1(C)CC1 ZINC000443512941 191109115 /nfs/dbraw/zinc/10/91/15/191109115.db2.gz USHBDZURAGRVGZ-UHFFFAOYSA-N 1 2 233.290 2.346 20 0 BEADLO CC(C)[C@@H](C)C(=O)NCc1ccc[nH+]c1N(C)C ZINC000171965886 535142853 /nfs/dbraw/zinc/14/28/53/535142853.db2.gz YSYINLNWYGSENG-LLVKDONJSA-N 1 2 249.358 2.056 20 0 BEADLO COC(=O)[C@H](c1cccnc1)[N@@H+]1CCC(C)(C)C1 ZINC000154139201 191115132 /nfs/dbraw/zinc/11/51/32/191115132.db2.gz RLNLEBQMQMCEAH-LBPRGKRZSA-N 1 2 248.326 2.028 20 0 BEADLO COC(=O)[C@H](c1cccnc1)[N@H+]1CCC(C)(C)C1 ZINC000154139201 191115134 /nfs/dbraw/zinc/11/51/34/191115134.db2.gz RLNLEBQMQMCEAH-LBPRGKRZSA-N 1 2 248.326 2.028 20 0 BEADLO COCC1(C)C[NH+](Cc2cnc(C3CC3)o2)C1 ZINC000628307956 350703838 /nfs/dbraw/zinc/70/38/38/350703838.db2.gz MMIKPXAGECRTKS-UHFFFAOYSA-N 1 2 236.315 2.020 20 0 BEADLO COCc1ccc(C[NH2+]Cc2conc2C)o1 ZINC000397986671 362981182 /nfs/dbraw/zinc/98/11/82/362981182.db2.gz KMJTXCPUJDXTTC-UHFFFAOYSA-N 1 2 236.271 2.012 20 0 BEADLO CC1(C)CCC[C@H](C(=O)Nc2cc[nH+]cc2O)C1 ZINC000339600464 350767264 /nfs/dbraw/zinc/76/72/64/350767264.db2.gz VSHQXUYORVCLDE-JTQLQIEISA-N 1 2 248.326 2.364 20 0 BEADLO Cc1c[nH]c(CN2CC3CC2(C(F)(F)F)C3)[nH+]1 ZINC000628309652 350785911 /nfs/dbraw/zinc/78/59/11/350785911.db2.gz KGPSUVGKGYIHCQ-UHFFFAOYSA-N 1 2 245.248 2.245 20 0 BEADLO CCC[C@@](C)(O)CNc1[nH+]cccc1OC ZINC000230684274 323433836 /nfs/dbraw/zinc/43/38/36/323433836.db2.gz APNGTNKNNURGQT-GFCCVEGCSA-N 1 2 224.304 2.053 20 0 BEADLO O=C(C1CC=CC1)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000607111640 350924935 /nfs/dbraw/zinc/92/49/35/350924935.db2.gz ZNVDOOWCFSQFLT-ZDUSSCGKSA-N 1 2 245.326 2.013 20 0 BEADLO O=C(C1CC=CC1)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000607111638 350925024 /nfs/dbraw/zinc/92/50/24/350925024.db2.gz ZNVDOOWCFSQFLT-CYBMUJFWSA-N 1 2 245.326 2.013 20 0 BEADLO CCc1nc(C)c(C[NH2+]Cc2ccccn2)o1 ZINC000291798487 350975371 /nfs/dbraw/zinc/97/53/71/350975371.db2.gz WYZSAVAYIMUIDU-UHFFFAOYSA-N 1 2 231.299 2.230 20 0 BEADLO C[C@H]([NH2+]Cc1cocn1)c1ccc([N+](=O)[O-])cc1 ZINC000397923404 350984181 /nfs/dbraw/zinc/98/41/81/350984181.db2.gz MQXGZKALHREMBA-VIFPVBQESA-N 1 2 247.254 2.434 20 0 BEADLO CN(c1cc(-n2cc[nH+]c2)ncn1)C1CCCC1 ZINC000607142623 350943263 /nfs/dbraw/zinc/94/32/63/350943263.db2.gz BSRHBMAAGKDALV-UHFFFAOYSA-N 1 2 243.314 2.041 20 0 BEADLO CCN(CC(C)C)c1cc(-n2cc[nH+]c2)ncn1 ZINC000607142922 350943472 /nfs/dbraw/zinc/94/34/72/350943472.db2.gz PCQXEJBGXHZAAB-UHFFFAOYSA-N 1 2 245.330 2.145 20 0 BEADLO CCc1nc(C)c(C[NH2+]Cc2cscn2)o1 ZINC000291848378 351017651 /nfs/dbraw/zinc/01/76/51/351017651.db2.gz URNDGINNGVVIDA-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO Cc1ncc(C[NH2+][C@H](C)c2ccccn2)o1 ZINC000398109720 363008870 /nfs/dbraw/zinc/00/88/70/363008870.db2.gz QSVZUOCRKWELCQ-SECBINFHSA-N 1 2 217.272 2.229 20 0 BEADLO CC1CCC(N(C)C(=O)CCn2cc[nH+]c2)CC1 ZINC000070891856 351079502 /nfs/dbraw/zinc/07/95/02/351079502.db2.gz DYYFEFJYGZXYGR-UHFFFAOYSA-N 1 2 249.358 2.310 20 0 BEADLO FC(F)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000616644058 351160810 /nfs/dbraw/zinc/16/08/10/351160810.db2.gz FGZIEFCCNZBPIB-LLVKDONJSA-N 1 2 227.254 2.153 20 0 BEADLO FC(F)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000616644058 351160813 /nfs/dbraw/zinc/16/08/13/351160813.db2.gz FGZIEFCCNZBPIB-LLVKDONJSA-N 1 2 227.254 2.153 20 0 BEADLO CC[C@@H]1CN(Cc2[nH]cc(C)[nH+]2)[C@@H](CC)CO1 ZINC000628324304 351236577 /nfs/dbraw/zinc/23/65/77/351236577.db2.gz NICODYCMCDLYBW-NWDGAFQWSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H]1CN(Cc2[nH]c(C)c(C)[nH+]2)[C@@H](C)CO1 ZINC000628324470 351236766 /nfs/dbraw/zinc/23/67/66/351236766.db2.gz VFQANFPPFNRAAH-JOYOIKCWSA-N 1 2 237.347 2.026 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC[C@H](OC3CCC3)C2)n1 ZINC000628327588 351265239 /nfs/dbraw/zinc/26/52/39/351265239.db2.gz HJJHUOSLSCWKTF-ZDUSSCGKSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC[C@H](OC3CCC3)C2)n1 ZINC000628327588 351265243 /nfs/dbraw/zinc/26/52/43/351265243.db2.gz HJJHUOSLSCWKTF-ZDUSSCGKSA-N 1 2 249.358 2.252 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H]1CCCOC1 ZINC000265180235 351265332 /nfs/dbraw/zinc/26/53/32/351265332.db2.gz GODRCHAIXYCFDJ-NSHDSACASA-N 1 2 234.299 2.009 20 0 BEADLO CC(C)CN(C)C(=O)c1ccc2[nH+]ccn2c1 ZINC000264022495 351211648 /nfs/dbraw/zinc/21/16/48/351211648.db2.gz SBXCPILUJCXRQS-UHFFFAOYSA-N 1 2 231.299 2.062 20 0 BEADLO Cc1c[nH]c(C[NH+]2CCC(c3ccon3)CC2)n1 ZINC000628351651 351313615 /nfs/dbraw/zinc/31/36/15/351313615.db2.gz LIIKMTLJTWWGNL-UHFFFAOYSA-N 1 2 246.314 2.086 20 0 BEADLO CC[N@H+](Cc1ccno1)Cc1ccncc1 ZINC000267880721 351322807 /nfs/dbraw/zinc/32/28/07/351322807.db2.gz GIXDSXVLWOJUBW-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO CC[N@@H+](Cc1ccno1)Cc1ccncc1 ZINC000267880721 351322809 /nfs/dbraw/zinc/32/28/09/351322809.db2.gz GIXDSXVLWOJUBW-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO CCCCc1cc(N[C@@H](C)[C@@H](C)CO)nc[nH+]1 ZINC000631126372 351336222 /nfs/dbraw/zinc/33/62/22/351336222.db2.gz MGHXWXBGGCOHMU-QWRGUYRKSA-N 1 2 237.347 2.248 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@]1(C)CCCO1 ZINC000268063879 351327194 /nfs/dbraw/zinc/32/71/94/351327194.db2.gz YZLDNESYIOABHH-ZDUSSCGKSA-N 1 2 234.299 2.152 20 0 BEADLO CCCCc1cc(N[C@@H](C)[C@H](C)CO)nc[nH+]1 ZINC000631126371 351336624 /nfs/dbraw/zinc/33/66/24/351336624.db2.gz MGHXWXBGGCOHMU-MNOVXSKESA-N 1 2 237.347 2.248 20 0 BEADLO CC1(C)C[C@@H]1C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000269744761 351366734 /nfs/dbraw/zinc/36/67/34/351366734.db2.gz MXLVKWAZMYBVJZ-GHMZBOCLSA-N 1 2 247.342 2.162 20 0 BEADLO CC[N@H+](Cc1ncc(C)o1)Cc1ccncc1 ZINC000270982732 351392635 /nfs/dbraw/zinc/39/26/35/351392635.db2.gz GPMNYMVXMNNXIC-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1ncc(C)o1)Cc1ccncc1 ZINC000270982732 351392641 /nfs/dbraw/zinc/39/26/41/351392641.db2.gz GPMNYMVXMNNXIC-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO FC(F)n1ccnc1C[NH2+]Cc1ccns1 ZINC000404410834 351431298 /nfs/dbraw/zinc/43/12/98/351431298.db2.gz CHIZFDMRBFPPNQ-UHFFFAOYSA-N 1 2 244.270 2.025 20 0 BEADLO CC[C@@H](O)CCNc1nc(C)[nH+]c2c1CCCC2 ZINC000272890310 351500669 /nfs/dbraw/zinc/50/06/69/351500669.db2.gz NSMYEAXPAYPMPT-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H](O)[C@H](C)[NH2+]CC(F)(F)c1ccccc1 ZINC000386876249 363055145 /nfs/dbraw/zinc/05/51/45/363055145.db2.gz HRXWNRFPTAIMDS-VHSXEESVSA-N 1 2 229.270 2.137 20 0 BEADLO CC1(C)CCC[C@@H]1C(=O)NCCCn1cc[nH+]c1 ZINC000274564845 351572371 /nfs/dbraw/zinc/57/23/71/351572371.db2.gz ARWVQYRCGVDMLT-GFCCVEGCSA-N 1 2 249.358 2.216 20 0 BEADLO OCc1ccc(C[NH2+][C@H]2CCCC2(F)F)cc1 ZINC000398183744 363075758 /nfs/dbraw/zinc/07/57/58/363075758.db2.gz IFNCNWQPNJCFLU-LBPRGKRZSA-N 1 2 241.281 2.456 20 0 BEADLO Cc1c[nH+]c(C)nc1NC1C[C@@H](C)O[C@H](C)C1 ZINC000577626373 366024596 /nfs/dbraw/zinc/02/45/96/366024596.db2.gz CAQVUABFOSIRNT-NXEZZACHSA-N 1 2 235.331 2.461 20 0 BEADLO CC1(C)CCC[C@@H](NC(=O)CCn2cc[nH+]c2)C1 ZINC000275976013 351607640 /nfs/dbraw/zinc/60/76/40/351607640.db2.gz KNBPUYZJPBEFIW-GFCCVEGCSA-N 1 2 249.358 2.358 20 0 BEADLO Cc1ccoc1CNCc1[nH]c(C)c(C)[nH+]1 ZINC000577769210 366058678 /nfs/dbraw/zinc/05/86/78/366058678.db2.gz DARUQPIVQBUFJN-UHFFFAOYSA-N 1 2 219.288 2.218 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1nc(C)c(C)[nH]1 ZINC000577769210 366058681 /nfs/dbraw/zinc/05/86/81/366058681.db2.gz DARUQPIVQBUFJN-UHFFFAOYSA-N 1 2 219.288 2.218 20 0 BEADLO CC[C@H](NC(=O)C[C@@H](C)n1cc[nH+]c1)C1CC1 ZINC000618861121 351748794 /nfs/dbraw/zinc/74/87/94/351748794.db2.gz UKXJATQQURHJAD-PWSUYJOCSA-N 1 2 235.331 2.139 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc(C(F)F)nc2)CCO1 ZINC000637884413 351749777 /nfs/dbraw/zinc/74/97/77/351749777.db2.gz XEPJHMMYAOSXOS-SECBINFHSA-N 1 2 242.269 2.240 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc(C(F)F)nc2)CCO1 ZINC000637884413 351749783 /nfs/dbraw/zinc/74/97/83/351749783.db2.gz XEPJHMMYAOSXOS-SECBINFHSA-N 1 2 242.269 2.240 20 0 BEADLO Cc1nc(N2CCC[C@@H]2C)c(C)c(C)[nH+]1 ZINC000177832933 366067575 /nfs/dbraw/zinc/06/75/75/366067575.db2.gz TZXPYBCVAFOTFK-QMMMGPOBSA-N 1 2 205.305 2.391 20 0 BEADLO Cc1ncc([C@H](C)[N@@H+]2C[C@@H](C)OC[C@@H]2C)c(C)n1 ZINC000637930700 351806836 /nfs/dbraw/zinc/80/68/36/351806836.db2.gz SEGHHGQKCWDMQJ-UMNHJUIQSA-N 1 2 249.358 2.264 20 0 BEADLO Cc1ncc([C@H](C)[N@H+]2C[C@@H](C)OC[C@@H]2C)c(C)n1 ZINC000637930700 351806838 /nfs/dbraw/zinc/80/68/38/351806838.db2.gz SEGHHGQKCWDMQJ-UMNHJUIQSA-N 1 2 249.358 2.264 20 0 BEADLO CC(C)CN(C(=O)CCc1[nH]cc[nH+]1)C(C)C ZINC000279520787 351815273 /nfs/dbraw/zinc/81/52/73/351815273.db2.gz VBOUWSXOVKOSSK-UHFFFAOYSA-N 1 2 237.347 2.235 20 0 BEADLO CC1(C)CCC[C@@H]1NC(=O)CCc1[nH]cc[nH+]1 ZINC000280999840 351870034 /nfs/dbraw/zinc/87/00/34/351870034.db2.gz MNTLCAJTYNSEQM-JTQLQIEISA-N 1 2 235.331 2.037 20 0 BEADLO CCC[C@@H](C[N@@H+]1CCC[C@@H]1c1ncon1)OC ZINC000637997324 351874801 /nfs/dbraw/zinc/87/48/01/351874801.db2.gz ATGRFLFJIYLSNY-WDEREUQCSA-N 1 2 239.319 2.022 20 0 BEADLO CCC[C@@H](C[N@H+]1CCC[C@@H]1c1ncon1)OC ZINC000637997324 351874803 /nfs/dbraw/zinc/87/48/03/351874803.db2.gz ATGRFLFJIYLSNY-WDEREUQCSA-N 1 2 239.319 2.022 20 0 BEADLO COc1ncc(C[N@@H+]2CCS[C@H](C)C2)s1 ZINC000638026857 351905024 /nfs/dbraw/zinc/90/50/24/351905024.db2.gz QUSFRGOFXQROTO-MRVPVSSYSA-N 1 2 244.385 2.089 20 0 BEADLO COc1ncc(C[N@H+]2CCS[C@H](C)C2)s1 ZINC000638026857 351905027 /nfs/dbraw/zinc/90/50/27/351905027.db2.gz QUSFRGOFXQROTO-MRVPVSSYSA-N 1 2 244.385 2.089 20 0 BEADLO CCc1nc(N(CC)CC(F)F)cc(C)[nH+]1 ZINC000286791902 352105249 /nfs/dbraw/zinc/10/52/49/352105249.db2.gz JUAHJEBWESZJTM-UHFFFAOYSA-N 1 2 229.274 2.439 20 0 BEADLO CO[C@](C)(CNc1ccc(N(C)C)[nH+]c1)C1CC1 ZINC000638272660 352108768 /nfs/dbraw/zinc/10/87/68/352108768.db2.gz BPKJZZLFGPRTAY-CQSZACIVSA-N 1 2 249.358 2.375 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+](C)Cc2ccccc2)[nH]1 ZINC000411146426 191162830 /nfs/dbraw/zinc/16/28/30/191162830.db2.gz FRWMSIZNBQMRSV-SNVBAGLBSA-N 1 2 230.315 2.306 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+](C)Cc2ccccc2)[nH]1 ZINC000411146426 191162834 /nfs/dbraw/zinc/16/28/34/191162834.db2.gz FRWMSIZNBQMRSV-SNVBAGLBSA-N 1 2 230.315 2.306 20 0 BEADLO C[C@H]1C[N@@H+]([C@@H]2C[C@H]2c2cccc(F)c2)CCO1 ZINC000411126916 191161398 /nfs/dbraw/zinc/16/13/98/191161398.db2.gz QJECXBIHOVIFMF-LEWSCRJBSA-N 1 2 235.302 2.402 20 0 BEADLO C[C@H]1C[N@H+]([C@@H]2C[C@H]2c2cccc(F)c2)CCO1 ZINC000411126916 191161400 /nfs/dbraw/zinc/16/14/00/191161400.db2.gz QJECXBIHOVIFMF-LEWSCRJBSA-N 1 2 235.302 2.402 20 0 BEADLO C[C@H](C(=O)NCCNc1cccc[nH+]1)C1CCC1 ZINC000411298491 191176268 /nfs/dbraw/zinc/17/62/68/191176268.db2.gz VIRBLJPYHUZLHW-NSHDSACASA-N 1 2 247.342 2.046 20 0 BEADLO CC(C)[C@@H]1CCCC[C@H]1NC(=O)Cn1cc[nH+]c1 ZINC000073380019 352334726 /nfs/dbraw/zinc/33/47/26/352334726.db2.gz VCPGKKYPURJTNP-QWHCGFSZSA-N 1 2 249.358 2.214 20 0 BEADLO O=C(CCn1cc[nH+]c1)N1C2CCCC1CCC2 ZINC000607866602 352346902 /nfs/dbraw/zinc/34/69/02/352346902.db2.gz DGBPMNRDGHKSSO-UHFFFAOYSA-N 1 2 247.342 2.207 20 0 BEADLO CC1(C)CCC[C@@H]1CNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000294118178 352369614 /nfs/dbraw/zinc/36/96/14/352369614.db2.gz KHCWMRVURVJSAG-MVIFTORASA-N 1 2 247.342 2.365 20 0 BEADLO CC1(C)CCC[C@@H]1CNC(=O)CCc1[nH]cc[nH+]1 ZINC000294199330 352371923 /nfs/dbraw/zinc/37/19/23/352371923.db2.gz PIZHMLPHRZTVAT-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO Cc1ccc(N[C@@H](C)Cn2cccn2)c[nH+]1 ZINC000138844841 191182582 /nfs/dbraw/zinc/18/25/82/191182582.db2.gz XJWUVQNITURNGA-NSHDSACASA-N 1 2 216.288 2.087 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)NCc1[nH+]ccn1CC ZINC000295739218 352422870 /nfs/dbraw/zinc/42/28/70/352422870.db2.gz SMLFOEFJPFBKIR-NEPJUHHUSA-N 1 2 249.358 2.346 20 0 BEADLO Cn1cc[nH+]c1[C@@H](NC(=O)CC1(C)CC1)C1CC1 ZINC000341723961 180755506 /nfs/dbraw/zinc/75/55/06/180755506.db2.gz YJYVSOCJQDCNBN-LBPRGKRZSA-N 1 2 247.342 2.178 20 0 BEADLO CC[C@@H](O)CSc1[nH+]cc2ccccn21 ZINC000298149236 352494945 /nfs/dbraw/zinc/49/49/45/352494945.db2.gz BLCDTPGFRDGXKE-SNVBAGLBSA-N 1 2 222.313 2.197 20 0 BEADLO CC[C@H](NC(=O)[C@H]1[C@@H]2CCCC[C@@H]21)c1[nH]cc[nH+]1 ZINC000252982435 538103998 /nfs/dbraw/zinc/10/39/98/538103998.db2.gz WIOXDMLKHUNPRI-WHOHXGKFSA-N 1 2 247.342 2.413 20 0 BEADLO C[N@H+](CC(=O)Nc1ccccc1)Cc1ccco1 ZINC000030276045 352671592 /nfs/dbraw/zinc/67/15/92/352671592.db2.gz XAHCYHQTADOIOC-UHFFFAOYSA-N 1 2 244.294 2.350 20 0 BEADLO C[N@@H+](CC(=O)Nc1ccccc1)Cc1ccco1 ZINC000030276045 352671595 /nfs/dbraw/zinc/67/15/95/352671595.db2.gz XAHCYHQTADOIOC-UHFFFAOYSA-N 1 2 244.294 2.350 20 0 BEADLO C[C@@H](c1cnccn1)[N@@H+]1CCO[C@@H](C2CCC2)C1 ZINC000411855386 191220252 /nfs/dbraw/zinc/22/02/52/191220252.db2.gz URGNADVTIMHHAH-SMDDNHRTSA-N 1 2 247.342 2.039 20 0 BEADLO C[C@@H](c1cnccn1)[N@H+]1CCO[C@@H](C2CCC2)C1 ZINC000411855386 191220253 /nfs/dbraw/zinc/22/02/53/191220253.db2.gz URGNADVTIMHHAH-SMDDNHRTSA-N 1 2 247.342 2.039 20 0 BEADLO CSc1ccc(NCCC[C@H]2CCO2)[nH+]c1 ZINC000638760455 352695149 /nfs/dbraw/zinc/69/51/49/352695149.db2.gz RYMKDKMKGVAKKG-JTQLQIEISA-N 1 2 238.356 2.206 20 0 BEADLO CO[C@@](C)(CNc1ccc(N(C)C)c[nH+]1)C1CC1 ZINC000638759892 352697173 /nfs/dbraw/zinc/69/71/73/352697173.db2.gz MWDSMLSTJPFZFD-AWEZNQCLSA-N 1 2 249.358 2.375 20 0 BEADLO CC[N@H+](Cc1cnns1)Cc1occc1C ZINC000412028704 191242187 /nfs/dbraw/zinc/24/21/87/191242187.db2.gz SDWIALWXJUPABQ-UHFFFAOYSA-N 1 2 237.328 2.462 20 0 BEADLO CC[N@@H+](Cc1cnns1)Cc1occc1C ZINC000412028704 191242190 /nfs/dbraw/zinc/24/21/90/191242190.db2.gz SDWIALWXJUPABQ-UHFFFAOYSA-N 1 2 237.328 2.462 20 0 BEADLO C/C=C/C[S@](=O)Cc1cn2cccc(C)c2[nH+]1 ZINC000083952904 187797521 /nfs/dbraw/zinc/79/75/21/187797521.db2.gz WAFPWHGBUZEUJH-REMYHPOOSA-N 1 2 248.351 2.468 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H](C)CC(F)F ZINC000412058679 191245553 /nfs/dbraw/zinc/24/55/53/191245553.db2.gz VKVYPBGYKLSAPS-ZETCQYMHSA-N 1 2 228.242 2.042 20 0 BEADLO Cc1[nH+]cccc1NCCC[C@@H]1CCO1 ZINC000638787208 352744704 /nfs/dbraw/zinc/74/47/04/352744704.db2.gz WONKAUMXILMGKL-LLVKDONJSA-N 1 2 206.289 2.371 20 0 BEADLO Cn1c[nH+]cc1Cc1noc(-c2cccs2)n1 ZINC000357936073 180790102 /nfs/dbraw/zinc/79/01/02/180790102.db2.gz MXFRHQVEKDUMFH-UHFFFAOYSA-N 1 2 246.295 2.122 20 0 BEADLO OC[C@@H]1C[C@H](F)C[N@@H+]1Cc1ccccc1Cl ZINC000334176319 352761222 /nfs/dbraw/zinc/76/12/22/352761222.db2.gz CRYJVKBDTMLYKN-QWRGUYRKSA-N 1 2 243.709 2.245 20 0 BEADLO OC[C@@H]1C[C@H](F)C[N@H+]1Cc1ccccc1Cl ZINC000334176319 352761223 /nfs/dbraw/zinc/76/12/23/352761223.db2.gz CRYJVKBDTMLYKN-QWRGUYRKSA-N 1 2 243.709 2.245 20 0 BEADLO CSC[C@@H](C)C(=O)Nc1cccc2[nH+]ccn21 ZINC000266143312 187843733 /nfs/dbraw/zinc/84/37/33/187843733.db2.gz UNPIJTPOVSGVRJ-SECBINFHSA-N 1 2 249.339 2.272 20 0 BEADLO Cc1nc(N(C)C(C2CC2)C2CC2)cc[nH+]1 ZINC000266197667 187843788 /nfs/dbraw/zinc/84/37/88/187843788.db2.gz CQWBPMPOBFBPOK-UHFFFAOYSA-N 1 2 217.316 2.410 20 0 BEADLO Cc1ccc(F)c(CN2CCn3cc[nH+]c3C2)c1 ZINC000334214401 352813369 /nfs/dbraw/zinc/81/33/69/352813369.db2.gz IZMULSJXCSMRAP-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO CC(C)C[C@@H]1CCN(C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000279318806 187853342 /nfs/dbraw/zinc/85/33/42/187853342.db2.gz BOSSHKOCIBFMOM-LBPRGKRZSA-N 1 2 249.358 2.237 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CC[C@@H](C(C)C)C1 ZINC000334193243 352785279 /nfs/dbraw/zinc/78/52/79/352785279.db2.gz JAYHEBPRTLZJJT-GFCCVEGCSA-N 1 2 247.342 2.322 20 0 BEADLO Cc1cc(NC(=O)c2ccc(Cl)cn2)cc[nH+]1 ZINC000334193668 352785397 /nfs/dbraw/zinc/78/53/97/352785397.db2.gz IPIRCICOSUMIEM-UHFFFAOYSA-N 1 2 247.685 2.113 20 0 BEADLO C[C@@H]1COCCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000334200024 352793248 /nfs/dbraw/zinc/79/32/48/352793248.db2.gz NYAOAJKBZSXYNJ-JTQLQIEISA-N 1 2 231.299 2.036 20 0 BEADLO Cc1ccc(CN2CCn3cc[nH+]c3C2)cc1 ZINC000334204289 352798579 /nfs/dbraw/zinc/79/85/79/352798579.db2.gz VSEWMJQVGXGXFW-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO Cc1nocc1C[N@@H+]1C[C@]2(CCCO2)[C@H]1C1CC1 ZINC000334205432 352800223 /nfs/dbraw/zinc/80/02/23/352800223.db2.gz XTVNYGAYCDBRII-ZIAGYGMSSA-N 1 2 248.326 2.126 20 0 BEADLO Cc1nocc1C[N@H+]1C[C@]2(CCCO2)[C@H]1C1CC1 ZINC000334205432 352800226 /nfs/dbraw/zinc/80/02/26/352800226.db2.gz XTVNYGAYCDBRII-ZIAGYGMSSA-N 1 2 248.326 2.126 20 0 BEADLO C[N@H+](Cc1noc(C2CC2)n1)[C@H]1C=CCCC1 ZINC000412076507 191254251 /nfs/dbraw/zinc/25/42/51/191254251.db2.gz PRLBWPIRKRRMGL-NSHDSACASA-N 1 2 233.315 2.488 20 0 BEADLO C[N@@H+](Cc1noc(C2CC2)n1)[C@H]1C=CCCC1 ZINC000412076507 191254252 /nfs/dbraw/zinc/25/42/52/191254252.db2.gz PRLBWPIRKRRMGL-NSHDSACASA-N 1 2 233.315 2.488 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ncc(C)n2C)CCS1 ZINC000342806534 352860145 /nfs/dbraw/zinc/86/01/45/352860145.db2.gz JVNRSGCREKLNMR-NSHDSACASA-N 1 2 239.388 2.056 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ncc(C)n2C)CCS1 ZINC000342806534 352860146 /nfs/dbraw/zinc/86/01/46/352860146.db2.gz JVNRSGCREKLNMR-NSHDSACASA-N 1 2 239.388 2.056 20 0 BEADLO CC[C@H]1CN(Cc2[nH+]cc(C)n2C)CCS1 ZINC000342806534 352860148 /nfs/dbraw/zinc/86/01/48/352860148.db2.gz JVNRSGCREKLNMR-NSHDSACASA-N 1 2 239.388 2.056 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2nccs2)nc(C)n1 ZINC000342813785 352863025 /nfs/dbraw/zinc/86/30/25/352863025.db2.gz UDLGDXMJYGDILV-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ncc(C3CC3)o2)CCCO1 ZINC000334229102 352846060 /nfs/dbraw/zinc/84/60/60/352846060.db2.gz PNDMFWTVVZDDRQ-SNVBAGLBSA-N 1 2 236.315 2.163 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ncc(C3CC3)o2)CCCO1 ZINC000334229102 352846063 /nfs/dbraw/zinc/84/60/63/352846063.db2.gz PNDMFWTVVZDDRQ-SNVBAGLBSA-N 1 2 236.315 2.163 20 0 BEADLO Fc1cccc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)c1 ZINC000334326991 352963289 /nfs/dbraw/zinc/96/32/89/352963289.db2.gz HCYJIZDJQQFWFH-BETUJISGSA-N 1 2 221.275 2.189 20 0 BEADLO Fc1cccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c1 ZINC000334326991 352963290 /nfs/dbraw/zinc/96/32/90/352963290.db2.gz HCYJIZDJQQFWFH-BETUJISGSA-N 1 2 221.275 2.189 20 0 BEADLO CCC[C@@H](C[N@@H+]1CCC(F)(F)C1)OC ZINC000638841959 353017951 /nfs/dbraw/zinc/01/79/51/353017951.db2.gz HPXFECUWULAPFU-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CCC[C@@H](C[N@H+]1CCC(F)(F)C1)OC ZINC000638841959 353017954 /nfs/dbraw/zinc/01/79/54/353017954.db2.gz HPXFECUWULAPFU-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO FC1(F)CC[N@H+](CC2CCSCC2)C1 ZINC000638842710 353019215 /nfs/dbraw/zinc/01/92/15/353019215.db2.gz ZBNBPIMATBIRIW-UHFFFAOYSA-N 1 2 221.316 2.471 20 0 BEADLO FC1(F)CC[N@@H+](CC2CCSCC2)C1 ZINC000638842710 353019216 /nfs/dbraw/zinc/01/92/16/353019216.db2.gz ZBNBPIMATBIRIW-UHFFFAOYSA-N 1 2 221.316 2.471 20 0 BEADLO CCc1nn(C)cc1CNc1ccc[nH+]c1C ZINC000092414486 538107031 /nfs/dbraw/zinc/10/70/31/538107031.db2.gz FRSMJNTWLQZLOG-UHFFFAOYSA-N 1 2 230.315 2.298 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2Cc3ccccc32)cc[nH+]1 ZINC000334425344 353103861 /nfs/dbraw/zinc/10/38/61/353103861.db2.gz UPBRBKRADHNWOG-CQSZACIVSA-N 1 2 238.290 2.090 20 0 BEADLO CCN(C(=O)Nc1cc[nH+]cc1C)C1CCC1 ZINC000334429559 353104645 /nfs/dbraw/zinc/10/46/45/353104645.db2.gz ZCKRQJKSJVVHEL-UHFFFAOYSA-N 1 2 233.315 2.218 20 0 BEADLO CC(C)(C)n1ncc2c1nc[nH+]c2N1CCCC1 ZINC000301833709 188059909 /nfs/dbraw/zinc/05/99/09/188059909.db2.gz JUVMQYXEUXWYFP-UHFFFAOYSA-N 1 2 245.330 2.182 20 0 BEADLO Cc1ncc(CN(C)c2cc[nH+]c(C)n2)s1 ZINC000360967518 188070667 /nfs/dbraw/zinc/07/06/67/188070667.db2.gz ZYAZEODTEFZQFE-UHFFFAOYSA-N 1 2 234.328 2.186 20 0 BEADLO CCC(=O)Nc1ccc(NCc2[nH]cc[nH+]2)cc1 ZINC000049715186 188086492 /nfs/dbraw/zinc/08/64/92/188086492.db2.gz CIHWDTVXTQFVLX-UHFFFAOYSA-N 1 2 244.298 2.370 20 0 BEADLO CC[C@@H]1CCCN(C(=O)C[C@H](C)n2cc[nH+]c2)C1 ZINC000577854275 366085926 /nfs/dbraw/zinc/08/59/26/366085926.db2.gz HZNIPQUBZMJFRO-QWHCGFSZSA-N 1 2 249.358 2.483 20 0 BEADLO CC(C)(O)Cn1c[nH+]c2cc(F)c(F)cc21 ZINC000103168478 188159612 /nfs/dbraw/zinc/15/96/12/188159612.db2.gz JADGKRHLQTYGBG-UHFFFAOYSA-N 1 2 226.226 2.085 20 0 BEADLO CC(C)[C@H](C)C(=O)Nc1ccc[nH+]c1N(C)C ZINC000171921959 188162061 /nfs/dbraw/zinc/16/20/61/188162061.db2.gz ULRRHVDCCUFREB-JTQLQIEISA-N 1 2 235.331 2.378 20 0 BEADLO CC(C)[C@H](C)NC(=O)C[NH+]1Cc2ccccc2C1 ZINC000106306127 188167680 /nfs/dbraw/zinc/16/76/80/188167680.db2.gz FFGNYQLFVDNCCY-LBPRGKRZSA-N 1 2 246.354 2.163 20 0 BEADLO C/C=C/C[C@@H]([NH2+]CCSCC)C(=O)OCC ZINC000336781081 188177708 /nfs/dbraw/zinc/17/77/08/188177708.db2.gz TWLYNVSMFXTQNQ-TZOMUSMUSA-N 1 2 245.388 2.227 20 0 BEADLO CC(C)c1nc(N2CCC[C@@H](CO)CC2)cc[nH+]1 ZINC000338826969 188189910 /nfs/dbraw/zinc/18/99/10/188189910.db2.gz DORJQNUIYFWXDU-GFCCVEGCSA-N 1 2 249.358 2.199 20 0 BEADLO CC(C)(CCNC(=O)CCn1cc[nH+]c1)C1CC1 ZINC000294234290 188213170 /nfs/dbraw/zinc/21/31/70/188213170.db2.gz RRIZBEZDLFDPKK-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2ccco2)nc1 ZINC000343262965 353273103 /nfs/dbraw/zinc/27/31/03/353273103.db2.gz WVLFPTWORIRNQJ-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2ccco2)nc1 ZINC000343262965 353273106 /nfs/dbraw/zinc/27/31/06/353273106.db2.gz WVLFPTWORIRNQJ-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO CC(C)Cc1noc(COc2cc[nH+]cc2)n1 ZINC000276492111 188201846 /nfs/dbraw/zinc/20/18/46/188201846.db2.gz VGWYFBLHPVUVLK-UHFFFAOYSA-N 1 2 233.271 2.242 20 0 BEADLO Cn1c[nH+]cc1CCC(=O)NCC1CCCCC1 ZINC000279572961 188204894 /nfs/dbraw/zinc/20/48/94/188204894.db2.gz GDSHIHWEHIZQIO-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO Cc1nc(F)ccc1C[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000279624478 188205315 /nfs/dbraw/zinc/20/53/15/188205315.db2.gz YNNXLMKZIKJBHB-NXEZZACHSA-N 1 2 238.306 2.138 20 0 BEADLO CC(C)(C)[C@@H]1CCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000284051050 188206940 /nfs/dbraw/zinc/20/69/40/188206940.db2.gz QLJNOFCCXOBPHO-SYTKJHMZSA-N 1 2 247.342 2.460 20 0 BEADLO Cc1cc(N[C@@H](c2nccn2C)C2CC2)nc[nH+]1 ZINC000343266342 353279138 /nfs/dbraw/zinc/27/91/38/353279138.db2.gz REFKXVPTEIQRTR-GFCCVEGCSA-N 1 2 243.314 2.082 20 0 BEADLO Cc1cc(N[C@@H](c2[nH+]ccn2C)C2CC2)ncn1 ZINC000343266342 353279139 /nfs/dbraw/zinc/27/91/39/353279139.db2.gz REFKXVPTEIQRTR-GFCCVEGCSA-N 1 2 243.314 2.082 20 0 BEADLO OC[C@@H]1C[C@@H](F)C[N@@H+]1Cc1ccc(Cl)s1 ZINC000336405682 188229766 /nfs/dbraw/zinc/22/97/66/188229766.db2.gz BBGIWLSCLHWMPT-SFYZADRCSA-N 1 2 249.738 2.306 20 0 BEADLO OC[C@@H]1C[C@@H](F)C[N@H+]1Cc1ccc(Cl)s1 ZINC000336405682 188229767 /nfs/dbraw/zinc/22/97/67/188229767.db2.gz BBGIWLSCLHWMPT-SFYZADRCSA-N 1 2 249.738 2.306 20 0 BEADLO COc1ccc(N[C@H](C)C2CCOCC2)[nH+]c1 ZINC000225835489 538114223 /nfs/dbraw/zinc/11/42/23/538114223.db2.gz GXGTVSLJXURZNU-SNVBAGLBSA-N 1 2 236.315 2.317 20 0 BEADLO FC1C[NH+](C[C@H]2CCN(c3ccccc3)C2)C1 ZINC000639039128 353314831 /nfs/dbraw/zinc/31/48/31/353314831.db2.gz QCSMSXHTKGOMDX-GFCCVEGCSA-N 1 2 234.318 2.167 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccncc2)on1 ZINC000639041555 353319353 /nfs/dbraw/zinc/31/93/53/353319353.db2.gz WOPJNZPABKMOTQ-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccncc2)on1 ZINC000639041555 353319356 /nfs/dbraw/zinc/31/93/56/353319356.db2.gz WOPJNZPABKMOTQ-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO CCC[C@H](C[N@H+](CC)CC(F)F)OC ZINC000639058819 353365304 /nfs/dbraw/zinc/36/53/04/353365304.db2.gz IPBWBLUVQDSPIO-SECBINFHSA-N 1 2 209.280 2.389 20 0 BEADLO CCC[C@H](C[N@@H+](CC)CC(F)F)OC ZINC000639058819 353365306 /nfs/dbraw/zinc/36/53/06/353365306.db2.gz IPBWBLUVQDSPIO-SECBINFHSA-N 1 2 209.280 2.389 20 0 BEADLO FC1(F)CCC[C@@H]1[NH2+]Cc1ccccn1 ZINC000308889480 491049499 /nfs/dbraw/zinc/04/94/99/491049499.db2.gz VZOJDKKPGDGOQI-JTQLQIEISA-N 1 2 212.243 2.359 20 0 BEADLO CC(C)CC(CC(C)C)[NH2+]Cc1c[nH]nn1 ZINC000398388116 363229403 /nfs/dbraw/zinc/22/94/03/363229403.db2.gz JNRCKGFJNYAWIY-UHFFFAOYSA-N 1 2 224.352 2.355 20 0 BEADLO CC(C)CC(CC(C)C)[NH2+]Cc1cn[nH]n1 ZINC000398388116 363229405 /nfs/dbraw/zinc/22/94/05/363229405.db2.gz JNRCKGFJNYAWIY-UHFFFAOYSA-N 1 2 224.352 2.355 20 0 BEADLO CCn1nccc1C[NH2+]C(C)(C)C(F)F ZINC000309039346 491051855 /nfs/dbraw/zinc/05/18/55/491051855.db2.gz KGDBCHGYZLLCCO-UHFFFAOYSA-N 1 2 217.263 2.036 20 0 BEADLO Cc1noc([C@@H](C)[NH2+]Cc2ccccc2)n1 ZINC000074071556 353742008 /nfs/dbraw/zinc/74/20/08/353742008.db2.gz HYVWDSLBKNSLBU-SECBINFHSA-N 1 2 217.272 2.229 20 0 BEADLO OCc1ccc(NC[C@@H]2C[C@H]3C[C@H]3C2)[nH+]c1 ZINC000639132084 353841194 /nfs/dbraw/zinc/84/11/94/353841194.db2.gz DRPYRKDQNRAGOB-ZSBIGDGJSA-N 1 2 218.300 2.032 20 0 BEADLO C[C@@H]1COCCC[N@@H+]1Cc1cc(F)ccc1C#N ZINC000399071306 353826139 /nfs/dbraw/zinc/82/61/39/353826139.db2.gz IAIKGJJNFQLARC-LLVKDONJSA-N 1 2 248.301 2.308 20 0 BEADLO C[C@@H]1COCCC[N@H+]1Cc1cc(F)ccc1C#N ZINC000399071306 353826141 /nfs/dbraw/zinc/82/61/41/353826141.db2.gz IAIKGJJNFQLARC-LLVKDONJSA-N 1 2 248.301 2.308 20 0 BEADLO CC1(C)COCC[N@@H+]1Cc1cc(O)cc(F)c1 ZINC000228750024 363264954 /nfs/dbraw/zinc/26/49/54/363264954.db2.gz XHHUOIGVSPCKKI-UHFFFAOYSA-N 1 2 239.290 2.142 20 0 BEADLO CC1(C)COCC[N@H+]1Cc1cc(O)cc(F)c1 ZINC000228750024 363264961 /nfs/dbraw/zinc/26/49/61/363264961.db2.gz XHHUOIGVSPCKKI-UHFFFAOYSA-N 1 2 239.290 2.142 20 0 BEADLO Fc1cncc(CN2CCC[C@H]2c2[nH]cc[nH+]2)c1 ZINC000336385393 181019597 /nfs/dbraw/zinc/01/95/97/181019597.db2.gz XRYWIVOCATWHDJ-LBPRGKRZSA-N 1 2 246.289 2.281 20 0 BEADLO Fc1cncc(CN2CCC[C@@H]2c2[nH]cc[nH+]2)c1 ZINC000336385392 181019957 /nfs/dbraw/zinc/01/99/57/181019957.db2.gz XRYWIVOCATWHDJ-GFCCVEGCSA-N 1 2 246.289 2.281 20 0 BEADLO Fc1cncc(NCc2cccc3[nH+]ccn32)c1 ZINC000341433345 181020404 /nfs/dbraw/zinc/02/04/04/181020404.db2.gz XXWBFLYELVPNFK-UHFFFAOYSA-N 1 2 242.257 2.481 20 0 BEADLO CCCC(=O)Nc1ccc(Cn2cc[nH+]c2)cn1 ZINC000343348276 353853150 /nfs/dbraw/zinc/85/31/50/353853150.db2.gz WYWQIUXWWLPYCF-UHFFFAOYSA-N 1 2 244.298 2.065 20 0 BEADLO CC[C@]1(C)C[C@@H]1C(=O)NCCNc1cccc[nH+]1 ZINC000343599097 353930408 /nfs/dbraw/zinc/93/04/08/353930408.db2.gz HFICLUXVOFOCHW-BXUZGUMPSA-N 1 2 247.342 2.046 20 0 BEADLO C[C@@]1(F)CCC[N@H+](CCn2cc(Cl)cn2)C1 ZINC000334549444 353976175 /nfs/dbraw/zinc/97/61/75/353976175.db2.gz DQWCVCWWBIROGW-LLVKDONJSA-N 1 2 245.729 2.361 20 0 BEADLO C[C@@]1(F)CCC[N@@H+](CCn2cc(Cl)cn2)C1 ZINC000334549444 353976177 /nfs/dbraw/zinc/97/61/77/353976177.db2.gz DQWCVCWWBIROGW-LLVKDONJSA-N 1 2 245.729 2.361 20 0 BEADLO Cc1ccc2ncc(C[NH+]3CCOCC3)cc2c1 ZINC000334549299 353988905 /nfs/dbraw/zinc/98/89/05/353988905.db2.gz BZMMWZSHKLDDIH-UHFFFAOYSA-N 1 2 242.322 2.375 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CCc3ccsc3C2)[nH]1 ZINC000334553675 353996612 /nfs/dbraw/zinc/99/66/12/353996612.db2.gz JFUUJDSWNNLWKZ-MRVPVSSYSA-N 1 2 248.355 2.294 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CCc3ccsc3C2)[nH]1 ZINC000334553675 353996615 /nfs/dbraw/zinc/99/66/15/353996615.db2.gz JFUUJDSWNNLWKZ-MRVPVSSYSA-N 1 2 248.355 2.294 20 0 BEADLO FC1=CCC[N@H+](CCc2ccccn2)C1 ZINC000334558341 354006928 /nfs/dbraw/zinc/00/69/28/354006928.db2.gz JTQNMQARSQRNOX-UHFFFAOYSA-N 1 2 206.264 2.183 20 0 BEADLO FC1=CCC[N@@H+](CCc2ccccn2)C1 ZINC000334558341 354006931 /nfs/dbraw/zinc/00/69/31/354006931.db2.gz JTQNMQARSQRNOX-UHFFFAOYSA-N 1 2 206.264 2.183 20 0 BEADLO CC(C)=CC[N@H+]1CCN(CC(C)C)C(=O)[C@H]1C ZINC000343818555 354013567 /nfs/dbraw/zinc/01/35/67/354013567.db2.gz NFQLEAPHOVZZRB-CYBMUJFWSA-N 1 2 238.375 2.141 20 0 BEADLO CC(C)=CC[N@@H+]1CCN(CC(C)C)C(=O)[C@H]1C ZINC000343818555 354013569 /nfs/dbraw/zinc/01/35/69/354013569.db2.gz NFQLEAPHOVZZRB-CYBMUJFWSA-N 1 2 238.375 2.141 20 0 BEADLO Cc1cc(N[C@H]2C[C@H]2C(F)F)nc(C2CC2)[nH+]1 ZINC000343822969 354015023 /nfs/dbraw/zinc/01/50/23/354015023.db2.gz AFAXHYOGDRELIW-BDAKNGLRSA-N 1 2 239.269 2.150 20 0 BEADLO Cc1cc(N[C@H]2C[C@@H]2C(F)F)nc(C2CC2)[nH+]1 ZINC000343822976 354015101 /nfs/dbraw/zinc/01/51/01/354015101.db2.gz AFAXHYOGDRELIW-IUCAKERBSA-N 1 2 239.269 2.150 20 0 BEADLO O=S1CC[NH+](Cc2ccc(C3CC3)cc2)CC1 ZINC000334549751 354016565 /nfs/dbraw/zinc/01/65/65/354016565.db2.gz RDHKIAHVHDJJLJ-UHFFFAOYSA-N 1 2 249.379 2.128 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2ccc3c(n2)CCC3)[C@@H]1C ZINC000334565836 354086694 /nfs/dbraw/zinc/08/66/94/354086694.db2.gz YNLMYLAFXQOMMD-VXGBXAGGSA-N 1 2 246.354 2.180 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2ccc3c(n2)CCC3)[C@@H]1C ZINC000334565836 354086697 /nfs/dbraw/zinc/08/66/97/354086697.db2.gz YNLMYLAFXQOMMD-VXGBXAGGSA-N 1 2 246.354 2.180 20 0 BEADLO C[C@H](Nc1cccc[nH+]1)C1CCOCC1 ZINC000230217865 363299428 /nfs/dbraw/zinc/29/94/28/363299428.db2.gz OFOHZNXDKIHFPP-JTQLQIEISA-N 1 2 206.289 2.309 20 0 BEADLO CC(C)[C@@H]1C[N@H+](Cc2ccco2)CCN1C ZINC000334569744 354096091 /nfs/dbraw/zinc/09/60/91/354096091.db2.gz AEWZZAOIGUSBHC-ZDUSSCGKSA-N 1 2 222.332 2.052 20 0 BEADLO CC(C)[C@@H]1C[N@@H+](Cc2ccco2)CCN1C ZINC000334569744 354096092 /nfs/dbraw/zinc/09/60/92/354096092.db2.gz AEWZZAOIGUSBHC-ZDUSSCGKSA-N 1 2 222.332 2.052 20 0 BEADLO CS[C@@H]1CC[C@H](Nc2cc(C)[nH+]cn2)C1 ZINC000230917328 363328618 /nfs/dbraw/zinc/32/86/18/363328618.db2.gz PFRGQYBKCWOZOL-VHSXEESVSA-N 1 2 223.345 2.481 20 0 BEADLO CC(C)[C@@H](C)CC(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000344256092 354191534 /nfs/dbraw/zinc/19/15/34/354191534.db2.gz VSFARCCRDQQRDO-WDEREUQCSA-N 1 2 249.358 2.065 20 0 BEADLO CC(C)[C@@H](C)CC(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000344256092 354191535 /nfs/dbraw/zinc/19/15/35/354191535.db2.gz VSFARCCRDQQRDO-WDEREUQCSA-N 1 2 249.358 2.065 20 0 BEADLO CC(C)(C[NH2+]Cc1ccn[nH]1)Oc1ccccc1 ZINC000344456011 354263326 /nfs/dbraw/zinc/26/33/26/354263326.db2.gz ZUNIQKJJIKAJHH-UHFFFAOYSA-N 1 2 245.326 2.357 20 0 BEADLO Cc1ccsc1[C@@H](C)[NH2+]CC(F)(F)CO ZINC000231792662 363354250 /nfs/dbraw/zinc/35/42/50/363354250.db2.gz KMJZGTKCFKXOCQ-MRVPVSSYSA-N 1 2 235.299 2.335 20 0 BEADLO Cn1cc[nH+]c1[C@H]1CCN(C(=O)CC(C)(C)C)C1 ZINC000334597092 354231308 /nfs/dbraw/zinc/23/13/08/354231308.db2.gz YHFMEUPEYMUGCX-NSHDSACASA-N 1 2 249.358 2.172 20 0 BEADLO CC(C)n1ncnc1C[NH+]1CC2(C1)CCCC2 ZINC000639180422 354278661 /nfs/dbraw/zinc/27/86/61/354278661.db2.gz IDLMCOZWMPEVEE-UHFFFAOYSA-N 1 2 234.347 2.235 20 0 BEADLO CC(C)(C)Cc1csc([C@@H]2COCC[NH2+]2)n1 ZINC000334601479 354280375 /nfs/dbraw/zinc/28/03/75/354280375.db2.gz IJVXTNPLVMCVOI-JTQLQIEISA-N 1 2 240.372 2.393 20 0 BEADLO C[C@H]1c2ccccc2C[N@H+]1Cc1cncn1C ZINC000334607534 354315006 /nfs/dbraw/zinc/31/50/06/354315006.db2.gz AWKYXRPZRAUYHD-NSHDSACASA-N 1 2 227.311 2.497 20 0 BEADLO C[C@H]1c2ccccc2C[N@@H+]1Cc1cncn1C ZINC000334607534 354315008 /nfs/dbraw/zinc/31/50/08/354315008.db2.gz AWKYXRPZRAUYHD-NSHDSACASA-N 1 2 227.311 2.497 20 0 BEADLO CC1(C)CCC[C@H](C(=O)NCCc2[nH]cc[nH+]2)C1 ZINC000178902379 366178315 /nfs/dbraw/zinc/17/83/15/366178315.db2.gz NMWFOCCTDZPKNF-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO CCc1occc1C(=O)Nc1cc[nH+]cc1C ZINC000334669141 354409223 /nfs/dbraw/zinc/40/92/23/354409223.db2.gz JOWIOHZALUAFCN-UHFFFAOYSA-N 1 2 230.267 2.220 20 0 BEADLO C[C@@H](C(=O)Nc1c[nH+]c2n1CCCC2)C1CC1 ZINC000334650941 354443226 /nfs/dbraw/zinc/44/32/26/354443226.db2.gz CHLSWVHVMRIAFI-SECBINFHSA-N 1 2 233.315 2.204 20 0 BEADLO O=C(Nc1c[nH+]c2n1CCCC2)[C@H]1C[C@H]1C1CC1 ZINC000334655612 354449458 /nfs/dbraw/zinc/44/94/58/354449458.db2.gz VASOAIYTXHTTKL-QWRGUYRKSA-N 1 2 245.326 2.204 20 0 BEADLO FC(F)(F)[C@H]([NH2+]CCC[C@@H]1CCO1)C1CC1 ZINC000639189366 354452072 /nfs/dbraw/zinc/45/20/72/354452072.db2.gz XVBRGMZYNSKNFW-NXEZZACHSA-N 1 2 237.265 2.486 20 0 BEADLO C[C@@H]1C[N@H+](C)CCN1C[C@H]1CCC(F)(F)C1 ZINC000334664601 354466080 /nfs/dbraw/zinc/46/60/80/354466080.db2.gz VDNBHWVVYVCODQ-MNOVXSKESA-N 1 2 232.318 2.058 20 0 BEADLO CC(C)n1cc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cn1 ZINC000179192069 366220906 /nfs/dbraw/zinc/22/09/06/366220906.db2.gz DSBDQGLDJZAQMS-TXEJJXNPSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)n1cc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cn1 ZINC000179192069 366220908 /nfs/dbraw/zinc/22/09/08/366220908.db2.gz DSBDQGLDJZAQMS-TXEJJXNPSA-N 1 2 237.347 2.073 20 0 BEADLO Cc1nnc(C[N@H+]2CCS[C@@H](C)[C@@H]2C)s1 ZINC000334750374 354475179 /nfs/dbraw/zinc/47/51/79/354475179.db2.gz VOZTWJCYGDGBCN-YUMQZZPRSA-N 1 2 243.401 2.172 20 0 BEADLO Cc1nnc(C[N@@H+]2CCS[C@@H](C)[C@@H]2C)s1 ZINC000334750374 354475184 /nfs/dbraw/zinc/47/51/84/354475184.db2.gz VOZTWJCYGDGBCN-YUMQZZPRSA-N 1 2 243.401 2.172 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)C2(C)CCC2)c2[nH+]ccn21 ZINC000334752011 354483172 /nfs/dbraw/zinc/48/31/72/354483172.db2.gz OAPZMQTXAWEOPZ-NXEZZACHSA-N 1 2 233.315 2.195 20 0 BEADLO C[C@@H]1C[C@H](NC2(C(F)F)CC2)c2[nH+]ccn21 ZINC000334704057 354498058 /nfs/dbraw/zinc/49/80/58/354498058.db2.gz XDDSQMQJDBCKJO-SFYZADRCSA-N 1 2 227.258 2.276 20 0 BEADLO CC[C@@H]1CCN1C(=O)NCc1c[nH+]c(C)cc1C ZINC000334716818 354515283 /nfs/dbraw/zinc/51/52/83/354515283.db2.gz XVIZXEFYGADAJW-CYBMUJFWSA-N 1 2 247.342 2.392 20 0 BEADLO CC[C@]1(C)COCC[N@@H+]1Cc1ccc(F)cn1 ZINC000334720521 354520450 /nfs/dbraw/zinc/52/04/50/354520450.db2.gz BCRNVDFMCYXRFU-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO CC[C@]1(C)COCC[N@H+]1Cc1ccc(F)cn1 ZINC000334720521 354520454 /nfs/dbraw/zinc/52/04/54/354520454.db2.gz BCRNVDFMCYXRFU-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@H](F)C2)sc1C ZINC000334812416 354569942 /nfs/dbraw/zinc/56/99/42/354569942.db2.gz OVHQQGYQPSMNDK-VIFPVBQESA-N 1 2 214.309 2.304 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@H](F)C2)sc1C ZINC000334812416 354569944 /nfs/dbraw/zinc/56/99/44/354569944.db2.gz OVHQQGYQPSMNDK-VIFPVBQESA-N 1 2 214.309 2.304 20 0 BEADLO OC[C@]1(F)CC[N@H+](Cc2ccc(Cl)cc2)C1 ZINC000334814199 354571499 /nfs/dbraw/zinc/57/14/99/354571499.db2.gz KSDDAVARCLGKFN-LBPRGKRZSA-N 1 2 243.709 2.246 20 0 BEADLO OC[C@]1(F)CC[N@@H+](Cc2ccc(Cl)cc2)C1 ZINC000334814199 354571505 /nfs/dbraw/zinc/57/15/05/354571505.db2.gz KSDDAVARCLGKFN-LBPRGKRZSA-N 1 2 243.709 2.246 20 0 BEADLO Cc1ccnc(C[NH+]2C[C@H](C)S[C@@H](C)C2)n1 ZINC000334754371 354575687 /nfs/dbraw/zinc/57/56/87/354575687.db2.gz HGNOQTROQQZACG-QWRGUYRKSA-N 1 2 237.372 2.111 20 0 BEADLO C[C@H]1C[C@H](NC(=O)CC(C)(C)C)c2[nH+]ccn21 ZINC000334756068 354577929 /nfs/dbraw/zinc/57/79/29/354577929.db2.gz SEVFCYVDAPJMOW-UWVGGRQHSA-N 1 2 235.331 2.441 20 0 BEADLO CN(c1[nH+]c2ccccc2n1C)[C@@H]1CCCOC1 ZINC000334797357 354551700 /nfs/dbraw/zinc/55/17/00/354551700.db2.gz XULQUDDSYHMJRD-LLVKDONJSA-N 1 2 245.326 2.189 20 0 BEADLO CC(C)(C)C1CN(C(=O)C(C)(C)c2c[nH+]c[nH]2)C1 ZINC000335099430 354640325 /nfs/dbraw/zinc/64/03/25/354640325.db2.gz JFJBACMNYIMDSE-UHFFFAOYSA-N 1 2 249.358 2.192 20 0 BEADLO CC(C)n1cncc1C[N@@H+]1CCO[C@@H]2CCC[C@H]21 ZINC000335112153 354698728 /nfs/dbraw/zinc/69/87/28/354698728.db2.gz UHIJHEQAUFGTMT-ZIAGYGMSSA-N 1 2 249.358 2.217 20 0 BEADLO CC(C)n1cncc1C[N@H+]1CCO[C@@H]2CCC[C@H]21 ZINC000335112153 354698732 /nfs/dbraw/zinc/69/87/32/354698732.db2.gz UHIJHEQAUFGTMT-ZIAGYGMSSA-N 1 2 249.358 2.217 20 0 BEADLO CC(C)n1c[nH+]cc1CN1CCO[C@@H]2CCC[C@H]21 ZINC000335112153 354698735 /nfs/dbraw/zinc/69/87/35/354698735.db2.gz UHIJHEQAUFGTMT-ZIAGYGMSSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@@H]1CCCC[C@H]1C(=O)N1CCn2c[nH+]cc2C1 ZINC000335111985 354699053 /nfs/dbraw/zinc/69/90/53/354699053.db2.gz AYEQNBIFERDTNK-DGCLKSJQSA-N 1 2 247.342 2.052 20 0 BEADLO C[C@@H]1CC[C@H](CC(=O)N(C)Cc2[nH]cc[nH+]2)C1 ZINC000345659557 354739476 /nfs/dbraw/zinc/73/94/76/354739476.db2.gz YPFRLPHXFSYCFH-MNOVXSKESA-N 1 2 235.331 2.194 20 0 BEADLO CCCc1[nH+]c2ccccc2n1C[C@@H](C)O ZINC000040389194 358489952 /nfs/dbraw/zinc/48/99/52/358489952.db2.gz OOMQPYXREBXXBT-SNVBAGLBSA-N 1 2 218.300 2.370 20 0 BEADLO CCCCC(=O)N1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000346011550 354838411 /nfs/dbraw/zinc/83/84/11/354838411.db2.gz MKEYNEYJBBVNDG-CYBMUJFWSA-N 1 2 248.326 2.252 20 0 BEADLO OC[C@]1(F)CCC[N@H+](Cc2ccc(Cl)o2)C1 ZINC000335147624 354861851 /nfs/dbraw/zinc/86/18/51/354861851.db2.gz KRPMQEMHHTZMJZ-NSHDSACASA-N 1 2 247.697 2.229 20 0 BEADLO OC[C@]1(F)CCC[N@@H+](Cc2ccc(Cl)o2)C1 ZINC000335147624 354861853 /nfs/dbraw/zinc/86/18/53/354861853.db2.gz KRPMQEMHHTZMJZ-NSHDSACASA-N 1 2 247.697 2.229 20 0 BEADLO CN(CC1CCCC1)C(=O)C(C)(C)c1c[nH+]c[nH]1 ZINC000346316028 354893760 /nfs/dbraw/zinc/89/37/60/354893760.db2.gz VSJXYEMWBMOWNY-UHFFFAOYSA-N 1 2 249.358 2.336 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CC[C@@H](CC(C)C)C1 ZINC000346388520 354907540 /nfs/dbraw/zinc/90/75/40/354907540.db2.gz QOWKFRLXCHCREU-LBPRGKRZSA-N 1 2 249.358 2.155 20 0 BEADLO Cc1nc(N2CCC[C@H]2C2CCOCC2)cc[nH+]1 ZINC000346258576 354882373 /nfs/dbraw/zinc/88/23/73/354882373.db2.gz ICANRMMXGGOXLJ-ZDUSSCGKSA-N 1 2 247.342 2.180 20 0 BEADLO CC(C)c1nc(N[C@@H](C)[C@@H]2CCCCO2)cc[nH+]1 ZINC000346464867 354953479 /nfs/dbraw/zinc/95/34/79/354953479.db2.gz UKTHPNNEQFIJHG-RYUDHWBXSA-N 1 2 249.358 2.391 20 0 BEADLO c1coc(-c2cc(Cn3cc[nH+]c3)no2)c1 ZINC000346621072 354995890 /nfs/dbraw/zinc/99/58/90/354995890.db2.gz PDSSMHRERNOCCI-UHFFFAOYSA-N 1 2 215.212 2.179 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1scnc1C ZINC000346725498 355105964 /nfs/dbraw/zinc/10/59/64/355105964.db2.gz YJQLCPJIWIIRQI-UHFFFAOYSA-N 1 2 249.295 2.107 20 0 BEADLO C[C@H](N[C@@H]1CCC[N@H+](C)[C@@H]1C)c1ccccn1 ZINC000346785802 355116593 /nfs/dbraw/zinc/11/65/93/355116593.db2.gz AGSUZNQUJLCDJJ-OUCADQQQSA-N 1 2 233.359 2.215 20 0 BEADLO C[C@H](N[C@@H]1CCC[N@@H+](C)[C@@H]1C)c1ccccn1 ZINC000346785802 355116596 /nfs/dbraw/zinc/11/65/96/355116596.db2.gz AGSUZNQUJLCDJJ-OUCADQQQSA-N 1 2 233.359 2.215 20 0 BEADLO Cc1ccc(CCC(=O)Nc2cc[nH+]c(C)c2)o1 ZINC000346816765 355122812 /nfs/dbraw/zinc/12/28/12/355122812.db2.gz NQBSMGSODUMNOZ-UHFFFAOYSA-N 1 2 244.294 2.285 20 0 BEADLO C[C@@H]1[C@H](CO)CCCN1c1[nH]c2ccccc2[nH+]1 ZINC000335233693 355094548 /nfs/dbraw/zinc/09/45/48/355094548.db2.gz RWLNQVPUMFCEMO-MNOVXSKESA-N 1 2 245.326 2.160 20 0 BEADLO CC[C@@H]([NH2+]Cc1cocn1)c1c(C)nn(C)c1C ZINC000346852847 355139237 /nfs/dbraw/zinc/13/92/37/355139237.db2.gz JTJRGHKLCSRADY-GFCCVEGCSA-N 1 2 248.330 2.266 20 0 BEADLO Cc1[nH+]cccc1Cc1noc(C2CC2)n1 ZINC000335259186 355198911 /nfs/dbraw/zinc/19/89/11/355198911.db2.gz SIXUNJHXPWSXJO-UHFFFAOYSA-N 1 2 215.256 2.241 20 0 BEADLO CSCCCNc1cc(NC2CC2)nc[nH+]1 ZINC000413154113 191357010 /nfs/dbraw/zinc/35/70/10/191357010.db2.gz IXGCUDGSOVSIKF-UHFFFAOYSA-N 1 2 238.360 2.216 20 0 BEADLO CSCCCNc1cc(NC2CC2)[nH+]cn1 ZINC000413154113 191357012 /nfs/dbraw/zinc/35/70/12/191357012.db2.gz IXGCUDGSOVSIKF-UHFFFAOYSA-N 1 2 238.360 2.216 20 0 BEADLO C[C@@H]1[C@@H](C)CCN1c1cc(NC2CC2)[nH+]cn1 ZINC000413163306 191360126 /nfs/dbraw/zinc/36/01/26/191360126.db2.gz AVNPDRJHPCQJSJ-VHSXEESVSA-N 1 2 232.331 2.286 20 0 BEADLO C[C@@H]1[C@@H](C)CCN1c1cc(NC2CC2)nc[nH+]1 ZINC000413163306 191360129 /nfs/dbraw/zinc/36/01/29/191360129.db2.gz AVNPDRJHPCQJSJ-VHSXEESVSA-N 1 2 232.331 2.286 20 0 BEADLO c1nc(N2C[C@@H]3CCC[C@@H]3C2)cc(NC2CC2)[nH+]1 ZINC000413177518 191361242 /nfs/dbraw/zinc/36/12/42/191361242.db2.gz AXNRWFUBNIUQBW-PHIMTYICSA-N 1 2 244.342 2.287 20 0 BEADLO c1nc(NC2CC2)cc(N2C[C@@H]3CCC[C@@H]3C2)[nH+]1 ZINC000413177518 191361244 /nfs/dbraw/zinc/36/12/44/191361244.db2.gz AXNRWFUBNIUQBW-PHIMTYICSA-N 1 2 244.342 2.287 20 0 BEADLO c1cc(CNc2cc(NC3CC3)[nH+]cn2)co1 ZINC000413076153 191354752 /nfs/dbraw/zinc/35/47/52/191354752.db2.gz QTAQFYXNNWVRSL-UHFFFAOYSA-N 1 2 230.271 2.256 20 0 BEADLO c1cc(CNc2cc(NC3CC3)nc[nH+]2)co1 ZINC000413076153 191354754 /nfs/dbraw/zinc/35/47/54/191354754.db2.gz QTAQFYXNNWVRSL-UHFFFAOYSA-N 1 2 230.271 2.256 20 0 BEADLO CC1=CC[N@H+](Cc2ccn(C(F)F)n2)CC1 ZINC000347672086 355260828 /nfs/dbraw/zinc/26/08/28/355260828.db2.gz AMJJHBWNUBBNAJ-UHFFFAOYSA-N 1 2 227.258 2.430 20 0 BEADLO CC1=CC[N@@H+](Cc2ccn(C(F)F)n2)CC1 ZINC000347672086 355260830 /nfs/dbraw/zinc/26/08/30/355260830.db2.gz AMJJHBWNUBBNAJ-UHFFFAOYSA-N 1 2 227.258 2.430 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H](C)CC(F)F ZINC000413452363 191385335 /nfs/dbraw/zinc/38/53/35/191385335.db2.gz HBXJMHSFYNRDLF-MRVPVSSYSA-N 1 2 242.269 2.296 20 0 BEADLO CC[C@@H]1CCN(c2cc(NC3CC3)[nH+]cn2)C1 ZINC000413185256 191362371 /nfs/dbraw/zinc/36/23/71/191362371.db2.gz LVJRGCILSJBPCW-SNVBAGLBSA-N 1 2 232.331 2.287 20 0 BEADLO CC[C@@H]1CCN(c2cc(NC3CC3)nc[nH+]2)C1 ZINC000413185256 191362373 /nfs/dbraw/zinc/36/23/73/191362373.db2.gz LVJRGCILSJBPCW-SNVBAGLBSA-N 1 2 232.331 2.287 20 0 BEADLO CC(C)=CCNc1cc(NC2CC2)[nH+]cn1 ZINC000413262020 191366811 /nfs/dbraw/zinc/36/68/11/191366811.db2.gz LDAFXPJOJVSRLY-UHFFFAOYSA-N 1 2 218.304 2.429 20 0 BEADLO CC(C)=CCNc1cc(NC2CC2)nc[nH+]1 ZINC000413262020 191366814 /nfs/dbraw/zinc/36/68/14/191366814.db2.gz LDAFXPJOJVSRLY-UHFFFAOYSA-N 1 2 218.304 2.429 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H](C)CC(F)F ZINC000413275869 191368413 /nfs/dbraw/zinc/36/84/13/191368413.db2.gz BUKHQCJWTKJISX-ZETCQYMHSA-N 1 2 244.241 2.320 20 0 BEADLO C[C@@H]1CC[C@H]1Nc1cc(NC2CC2)[nH+]cn1 ZINC000413300005 191370156 /nfs/dbraw/zinc/37/01/56/191370156.db2.gz VMLAGISTFNMUGA-PSASIEDQSA-N 1 2 218.304 2.261 20 0 BEADLO C[C@@H]1CC[C@H]1Nc1cc(NC2CC2)nc[nH+]1 ZINC000413300005 191370159 /nfs/dbraw/zinc/37/01/59/191370159.db2.gz VMLAGISTFNMUGA-PSASIEDQSA-N 1 2 218.304 2.261 20 0 BEADLO Cc1ccc(CCNc2nc(C)cnc2C)[nH+]c1 ZINC000413357746 191374603 /nfs/dbraw/zinc/37/46/03/191374603.db2.gz VUPGFIBWUPRSEE-UHFFFAOYSA-N 1 2 242.326 2.451 20 0 BEADLO CC(C)c1nc(NC[C@@H]2CC[C@H](C)O2)cc[nH+]1 ZINC000413379420 191376893 /nfs/dbraw/zinc/37/68/93/191376893.db2.gz RMHMJENGRPGKEM-QWRGUYRKSA-N 1 2 235.331 2.001 20 0 BEADLO Cc1cc(NC[C@H]2CC[C@@H](C)O2)nc(C2CC2)[nH+]1 ZINC000413377060 191377101 /nfs/dbraw/zinc/37/71/01/191377101.db2.gz NVNACOMCUJBZCN-ZYHUDNBSSA-N 1 2 247.342 2.064 20 0 BEADLO CC(C)O[C@H]1C[C@@H](Nc2cc[nH+]c(C(C)C)n2)C1 ZINC000413383066 191377916 /nfs/dbraw/zinc/37/79/16/191377916.db2.gz AXOMBRXRVMUKNA-TXEJJXNPSA-N 1 2 249.358 2.390 20 0 BEADLO CCO[C@H]1C[C@@H](Nc2cc[nH+]c(C(C)C)n2)C1 ZINC000413384037 191378392 /nfs/dbraw/zinc/37/83/92/191378392.db2.gz DFFBHTNHPUPGJW-PHIMTYICSA-N 1 2 235.331 2.001 20 0 BEADLO Cc1cccc(NCc2n[nH]c(C(C)(C)C)n2)[nH+]1 ZINC000413408549 191379893 /nfs/dbraw/zinc/37/98/93/191379893.db2.gz IFJYENVIFMKRKY-UHFFFAOYSA-N 1 2 245.330 2.418 20 0 BEADLO COC1CCC(Nc2cc[nH+]c(C(C)C)n2)CC1 ZINC000413408059 191379933 /nfs/dbraw/zinc/37/99/33/191379933.db2.gz ACFADILXCDAWHX-UHFFFAOYSA-N 1 2 249.358 2.391 20 0 BEADLO COC1CCC(Nc2cc[nH+]c(C3CC3)n2)CC1 ZINC000413419614 191381469 /nfs/dbraw/zinc/38/14/69/191381469.db2.gz NMHOIDSNXSBPTI-UHFFFAOYSA-N 1 2 247.342 2.145 20 0 BEADLO Cn1ccnc1[C@@H](C1CC1)[NH+]1CC(C(F)F)C1 ZINC000639252880 355289314 /nfs/dbraw/zinc/28/93/14/355289314.db2.gz VIGGKNZRHRUDBJ-SNVBAGLBSA-N 1 2 241.285 2.068 20 0 BEADLO C[C@H](C[NH+]1CC(C)(O)C1)c1cc(F)cc(F)c1 ZINC000639253310 355290084 /nfs/dbraw/zinc/29/00/84/355290084.db2.gz DLEVZZMWEZSAMJ-SECBINFHSA-N 1 2 241.281 2.135 20 0 BEADLO Cc1ccc(C[NH+]2CC(C)(O)C2)cc1Cl ZINC000639253303 355290630 /nfs/dbraw/zinc/29/06/30/355290630.db2.gz DFYIFGBHLZWAJC-UHFFFAOYSA-N 1 2 225.719 2.215 20 0 BEADLO CC1(O)C[NH+](Cc2cc3cc(F)ccc3o2)C1 ZINC000639254551 355295518 /nfs/dbraw/zinc/29/55/18/355295518.db2.gz ZJCYWOGIEGPZKQ-UHFFFAOYSA-N 1 2 235.258 2.139 20 0 BEADLO CCC1(C)C[NH+](Cc2cnc(OC)s2)C1 ZINC000639255204 355297794 /nfs/dbraw/zinc/29/77/94/355297794.db2.gz OMFMAUPDBBLOPW-UHFFFAOYSA-N 1 2 226.345 2.384 20 0 BEADLO CCOC1(C)C[NH+]([C@@H](C)c2cnc(C)nc2C)C1 ZINC000639269051 355330445 /nfs/dbraw/zinc/33/04/45/355330445.db2.gz ZVOSUEGNPCFDCI-NSHDSACASA-N 1 2 249.358 2.265 20 0 BEADLO CCOC1C[NH+](Cc2ccc(C)cc2F)C1 ZINC000639250595 355280312 /nfs/dbraw/zinc/28/03/12/355280312.db2.gz ULGWDDPFGKTVEJ-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ccc(C[N@@H+]2CCc3n[nH]cc3C2)cc1F ZINC000623236863 355371564 /nfs/dbraw/zinc/37/15/64/355371564.db2.gz IHUVGHPWOINVHX-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1ccc(C[N@H+]2CCc3n[nH]cc3C2)cc1F ZINC000623236863 355371565 /nfs/dbraw/zinc/37/15/65/355371565.db2.gz IHUVGHPWOINVHX-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO C[C@@H]([NH2+]Cc1cnc2ccccn12)c1ccon1 ZINC000349232440 355372188 /nfs/dbraw/zinc/37/21/88/355372188.db2.gz CCACKBVOCKVQTF-SNVBAGLBSA-N 1 2 242.282 2.173 20 0 BEADLO CCc1noc(C)c1C[NH2+][C@H](C)c1ccon1 ZINC000349240759 355374089 /nfs/dbraw/zinc/37/40/89/355374089.db2.gz JVLNRIDKHRYIOL-MRVPVSSYSA-N 1 2 235.287 2.384 20 0 BEADLO CC(C)[C@H](C)N(C)C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000583508977 355346259 /nfs/dbraw/zinc/34/62/59/355346259.db2.gz ZPLFPPMOOCPQMM-MNOVXSKESA-N 1 2 237.347 2.091 20 0 BEADLO CC(C)[C@H](C)N(C)C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000583508977 355346262 /nfs/dbraw/zinc/34/62/62/355346262.db2.gz ZPLFPPMOOCPQMM-MNOVXSKESA-N 1 2 237.347 2.091 20 0 BEADLO Cc1nc(N2CCc3sccc3C2)cc[nH+]1 ZINC000335740851 355390803 /nfs/dbraw/zinc/39/08/03/355390803.db2.gz PMWFUXIEVPOJSJ-UHFFFAOYSA-N 1 2 231.324 2.409 20 0 BEADLO COc1cc(C[NH+]2CC(CC(F)F)C2)sn1 ZINC000639278228 355361630 /nfs/dbraw/zinc/36/16/30/355361630.db2.gz BSSXFDIPWHUUJZ-UHFFFAOYSA-N 1 2 248.298 2.239 20 0 BEADLO Cc1cnc(C[NH+]2CC(CC(F)F)C2)o1 ZINC000639278393 355362330 /nfs/dbraw/zinc/36/23/30/355362330.db2.gz JLUPAQBUUSCQCG-UHFFFAOYSA-N 1 2 216.231 2.070 20 0 BEADLO CC1(C[N@@H+]2CCOCC(F)(F)C2)CCC1 ZINC000583532803 355396272 /nfs/dbraw/zinc/39/62/72/355396272.db2.gz SKUPVEKZLNAUIL-UHFFFAOYSA-N 1 2 219.275 2.144 20 0 BEADLO CC1(C[N@H+]2CCOCC(F)(F)C2)CCC1 ZINC000583532803 355396275 /nfs/dbraw/zinc/39/62/75/355396275.db2.gz SKUPVEKZLNAUIL-UHFFFAOYSA-N 1 2 219.275 2.144 20 0 BEADLO FC1(F)CCC[N@H+](CCC[C@@H]2CCO2)C1 ZINC000639287913 355398959 /nfs/dbraw/zinc/39/89/59/355398959.db2.gz GESUKJXLSQSOHL-SNVBAGLBSA-N 1 2 219.275 2.287 20 0 BEADLO FC1(F)CCC[N@@H+](CCC[C@@H]2CCO2)C1 ZINC000639287913 355398962 /nfs/dbraw/zinc/39/89/62/355398962.db2.gz GESUKJXLSQSOHL-SNVBAGLBSA-N 1 2 219.275 2.287 20 0 BEADLO CCn1ncnc1CNc1[nH+]cccc1SC ZINC000639292396 355499290 /nfs/dbraw/zinc/49/92/90/355499290.db2.gz DNIZFKRMYGWGHB-UHFFFAOYSA-N 1 2 249.343 2.027 20 0 BEADLO Cc1ncc([C@@H](C)[NH2+][C@H](C)c2ccon2)c(C)n1 ZINC000349833922 355488966 /nfs/dbraw/zinc/48/89/66/355488966.db2.gz MIULMHJNJNETOG-PSASIEDQSA-N 1 2 246.314 2.493 20 0 BEADLO CC[C@H]([NH2+][C@@H](C)c1ccon1)c1ccn(C)n1 ZINC000349836345 355489818 /nfs/dbraw/zinc/48/98/18/355489818.db2.gz RXBHYDYWZOAALB-UWVGGRQHSA-N 1 2 234.303 2.210 20 0 BEADLO CCc1oc(C(=O)NCc2[nH]c[nH+]c2C)cc1C ZINC000349936299 355531566 /nfs/dbraw/zinc/53/15/66/355531566.db2.gz PSBVXNPMDWIYCG-UHFFFAOYSA-N 1 2 247.298 2.112 20 0 BEADLO C[C@H]1Oc2cc(F)ccc2[C@@H]1[NH2+]Cc1cc[nH]n1 ZINC000335826742 355551799 /nfs/dbraw/zinc/55/17/99/355551799.db2.gz HIVUFWRKPAXJAD-AMIZOPFISA-N 1 2 247.273 2.161 20 0 BEADLO C[C@@H]1[N@H+](Cc2nccs2)CCOC1(C)C ZINC000335835488 355562226 /nfs/dbraw/zinc/56/22/26/355562226.db2.gz ULXHGAXFPZIWFX-VIFPVBQESA-N 1 2 226.345 2.142 20 0 BEADLO C[C@@H]1[N@@H+](Cc2nccs2)CCOC1(C)C ZINC000335835488 355562229 /nfs/dbraw/zinc/56/22/29/355562229.db2.gz ULXHGAXFPZIWFX-VIFPVBQESA-N 1 2 226.345 2.142 20 0 BEADLO C[NH2+]Cc1noc(CC2CCC(C)CC2)n1 ZINC000349888117 355519442 /nfs/dbraw/zinc/51/94/42/355519442.db2.gz IEESIUMXMVWPFN-UHFFFAOYSA-N 1 2 223.320 2.158 20 0 BEADLO C[NH2+]Cc1noc(C[C@@H]2CCC[C@@H](C)C2)n1 ZINC000349893672 355521493 /nfs/dbraw/zinc/52/14/93/355521493.db2.gz NXVOJHYZWZSJHS-NXEZZACHSA-N 1 2 223.320 2.158 20 0 BEADLO C[NH2+]Cc1noc(/C=C\C2CCCCC2)n1 ZINC000349898491 355522223 /nfs/dbraw/zinc/52/22/23/355522223.db2.gz UEHWPZUJHDMHAC-FPLPWBNLSA-N 1 2 221.304 2.383 20 0 BEADLO C[NH2+]Cc1noc([C@H](C)Oc2ccc(C)cc2)n1 ZINC000349905063 355523270 /nfs/dbraw/zinc/52/32/70/355523270.db2.gz DNEKDBWLQZYTJZ-JTQLQIEISA-N 1 2 247.298 2.237 20 0 BEADLO C[NH2+]Cc1noc(CCc2ccc(C)cc2C)n1 ZINC000349914642 355525727 /nfs/dbraw/zinc/52/57/27/355525727.db2.gz UGFHDYFKUPUTEJ-UHFFFAOYSA-N 1 2 245.326 2.191 20 0 BEADLO C[NH2+]Cc1noc([C@H](F)Cc2ccccc2)n1 ZINC000349914549 355525819 /nfs/dbraw/zinc/52/58/19/355525819.db2.gz SYVPGIOIEGTZDC-SNVBAGLBSA-N 1 2 235.262 2.042 20 0 BEADLO C[NH2+]Cc1noc([C@H](C)Cc2ccccc2F)n1 ZINC000349918742 355526483 /nfs/dbraw/zinc/52/64/83/355526483.db2.gz FQUKQLPWDJUSFE-SECBINFHSA-N 1 2 249.289 2.274 20 0 BEADLO C[NH2+]Cc1noc(CCc2cc(C)cc(C)c2)n1 ZINC000349922273 355528896 /nfs/dbraw/zinc/52/88/96/355528896.db2.gz QHLPXLRBDDTBLH-UHFFFAOYSA-N 1 2 245.326 2.191 20 0 BEADLO CCCC[N@@H+]1CC(=O)N[C@@H]1[C@@H]1CCC[C@H](C)C1 ZINC000350126924 355609933 /nfs/dbraw/zinc/60/99/33/355609933.db2.gz NWUPCIZKYKKRPU-SCRDCRAPSA-N 1 2 238.375 2.371 20 0 BEADLO CCCC[N@H+]1CC(=O)N[C@@H]1[C@@H]1CCC[C@H](C)C1 ZINC000350126924 355609934 /nfs/dbraw/zinc/60/99/34/355609934.db2.gz NWUPCIZKYKKRPU-SCRDCRAPSA-N 1 2 238.375 2.371 20 0 BEADLO Cn1c(N2CCCC2)[nH+]c2cccc(F)c21 ZINC000335863057 355626916 /nfs/dbraw/zinc/62/69/16/355626916.db2.gz JCSOSKUBPVOJHN-UHFFFAOYSA-N 1 2 219.263 2.313 20 0 BEADLO CC[C@@]1(C)CC[N@H+](Cc2csnn2)C1 ZINC000335866495 355630883 /nfs/dbraw/zinc/63/08/83/355630883.db2.gz DRSANLHJTYKTDJ-JTQLQIEISA-N 1 2 211.334 2.160 20 0 BEADLO CC[C@@]1(C)CC[N@@H+](Cc2csnn2)C1 ZINC000335866495 355630886 /nfs/dbraw/zinc/63/08/86/355630886.db2.gz DRSANLHJTYKTDJ-JTQLQIEISA-N 1 2 211.334 2.160 20 0 BEADLO Cc1cnc([C@H](C)[N@H+]2CCO[C@H](C(C)C)C2)o1 ZINC000335867672 355632756 /nfs/dbraw/zinc/63/27/56/355632756.db2.gz RJVCJUDYWQMUKC-RYUDHWBXSA-N 1 2 238.331 2.401 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+]2CCO[C@H](C(C)C)C2)o1 ZINC000335867672 355632759 /nfs/dbraw/zinc/63/27/59/355632759.db2.gz RJVCJUDYWQMUKC-RYUDHWBXSA-N 1 2 238.331 2.401 20 0 BEADLO Cc1cnc(C[NH2+][C@@H]2CCCN3CCCC[C@@H]23)o1 ZINC000639301520 355639424 /nfs/dbraw/zinc/63/94/24/355639424.db2.gz GERYXDSHMCHMGJ-OLZOCXBDSA-N 1 2 249.358 2.090 20 0 BEADLO Cn1ccnc1[C@H](C1CC1)[N@@H+]1CCC[C@H](F)C1 ZINC000639313834 355693505 /nfs/dbraw/zinc/69/35/05/355693505.db2.gz ZGQCTHURFAWDFJ-RYUDHWBXSA-N 1 2 237.322 2.305 20 0 BEADLO Cn1ccnc1[C@H](C1CC1)[N@H+]1CCC[C@H](F)C1 ZINC000639313834 355693507 /nfs/dbraw/zinc/69/35/07/355693507.db2.gz ZGQCTHURFAWDFJ-RYUDHWBXSA-N 1 2 237.322 2.305 20 0 BEADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccon1 ZINC000336006455 134049238 /nfs/dbraw/zinc/04/92/38/134049238.db2.gz RHFNYNWTLDUYCE-VXNVDRBHSA-N 1 2 234.221 2.447 20 0 BEADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ccon1 ZINC000336006455 134049239 /nfs/dbraw/zinc/04/92/39/134049239.db2.gz RHFNYNWTLDUYCE-VXNVDRBHSA-N 1 2 234.221 2.447 20 0 BEADLO CCCn1cc(C[N@H+](C)Cc2ccccn2)cn1 ZINC000350467237 355708986 /nfs/dbraw/zinc/70/89/86/355708986.db2.gz ZYLOGKRFDSBBLJ-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CCCn1cc(C[N@@H+](C)Cc2ccccn2)cn1 ZINC000350467237 355708989 /nfs/dbraw/zinc/70/89/89/355708989.db2.gz ZYLOGKRFDSBBLJ-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO FC1(F)CCC12C[NH+](Cc1cncs1)C2 ZINC000336017972 134053866 /nfs/dbraw/zinc/05/38/66/134053866.db2.gz MWNFDMXLSZTGHO-UHFFFAOYSA-N 1 2 230.283 2.374 20 0 BEADLO Cc1scc(C[N@@H+]2CCc3nn[nH]c3C2)c1C ZINC000639332568 355759742 /nfs/dbraw/zinc/75/97/42/355759742.db2.gz NFWSQKMJTPIZRP-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO Cc1scc(C[N@H+]2CCc3nn[nH]c3C2)c1C ZINC000639332568 355759744 /nfs/dbraw/zinc/75/97/44/355759744.db2.gz NFWSQKMJTPIZRP-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO CCc1cnc(C[N@H+]2C[C@@H](C)OC[C@@H]2CC)o1 ZINC000608492515 355808987 /nfs/dbraw/zinc/80/89/87/355808987.db2.gz ITVVOQNANVLJSP-MNOVXSKESA-N 1 2 238.331 2.236 20 0 BEADLO CCc1cnc(C[N@@H+]2C[C@@H](C)OC[C@@H]2CC)o1 ZINC000608492515 355808991 /nfs/dbraw/zinc/80/89/91/355808991.db2.gz ITVVOQNANVLJSP-MNOVXSKESA-N 1 2 238.331 2.236 20 0 BEADLO c1csc(CC2C[NH+](Cc3ccon3)C2)c1 ZINC000639355910 355809806 /nfs/dbraw/zinc/80/98/06/355809806.db2.gz BRZIZBQGFYYZBQ-UHFFFAOYSA-N 1 2 234.324 2.411 20 0 BEADLO CCc1cnc(C[N@@H+]2C[C@H](C)OC(C)(C)C2)o1 ZINC000608493465 355819557 /nfs/dbraw/zinc/81/95/57/355819557.db2.gz QMRQIDLYQXRVMT-JTQLQIEISA-N 1 2 238.331 2.236 20 0 BEADLO CCc1cnc(C[N@H+]2C[C@H](C)OC(C)(C)C2)o1 ZINC000608493465 355819560 /nfs/dbraw/zinc/81/95/60/355819560.db2.gz QMRQIDLYQXRVMT-JTQLQIEISA-N 1 2 238.331 2.236 20 0 BEADLO CO[C@@](C)(CNc1c[nH+]cc(N(C)C)c1)C1CC1 ZINC000639364288 355834253 /nfs/dbraw/zinc/83/42/53/355834253.db2.gz HJDCXRZTLWYIQO-AWEZNQCLSA-N 1 2 249.358 2.375 20 0 BEADLO O=C(CCCn1cc[nH+]c1)NCCC1CCCC1 ZINC000623252265 355835544 /nfs/dbraw/zinc/83/55/44/355835544.db2.gz CDVJJCLZAGPQEX-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO C[C@@H]1CSC[C@@H]1Nc1c[nH+]cc(N(C)C)c1 ZINC000639365878 355840891 /nfs/dbraw/zinc/84/08/91/355840891.db2.gz SJUYESWYSYLHDA-SKDRFNHKSA-N 1 2 237.372 2.311 20 0 BEADLO CN(C)c1c[nH+]cc(NCCC[C@@H]2CCO2)c1 ZINC000639366495 355843256 /nfs/dbraw/zinc/84/32/56/355843256.db2.gz WSMMTGDNFYPDBW-CYBMUJFWSA-N 1 2 235.331 2.129 20 0 BEADLO C[C@@H](Nc1c[nH+]cc(N(C)C)c1)[C@H]1CCCOC1 ZINC000639366500 355843892 /nfs/dbraw/zinc/84/38/92/355843892.db2.gz WTGSBPLWELUXQW-NEPJUHHUSA-N 1 2 249.358 2.375 20 0 BEADLO CCCC[C@H](C)[C@H](C)[NH2+]Cc1c[nH]nn1 ZINC000628363806 355850120 /nfs/dbraw/zinc/85/01/20/355850120.db2.gz YHPWVTXHJFDCLW-UWVGGRQHSA-N 1 2 210.325 2.109 20 0 BEADLO CCCC[C@H](C)[C@H](C)[NH2+]Cc1cn[nH]n1 ZINC000628363806 355850124 /nfs/dbraw/zinc/85/01/24/355850124.db2.gz YHPWVTXHJFDCLW-UWVGGRQHSA-N 1 2 210.325 2.109 20 0 BEADLO CC[C@H](NC(=O)[C@@H]1CC[C@@H]2C[C@@H]2C1)c1[nH]cc[nH+]1 ZINC000403781190 355868495 /nfs/dbraw/zinc/86/84/95/355868495.db2.gz XWNBXGIKUGLVIX-KKOKHZNYSA-N 1 2 247.342 2.413 20 0 BEADLO CN(C)c1c[nH+]cc(N[C@H]2COC(C)(C)C2)c1 ZINC000639364226 355832311 /nfs/dbraw/zinc/83/23/11/355832311.db2.gz GTRDRIHQKIQKOR-LLVKDONJSA-N 1 2 235.331 2.127 20 0 BEADLO OCCSCc1cn2cc(Cl)ccc2[nH+]1 ZINC000035117032 355832433 /nfs/dbraw/zinc/83/24/33/355832433.db2.gz INEOZELMVBCOQW-UHFFFAOYSA-N 1 2 242.731 2.213 20 0 BEADLO CC(=O)Nc1nc(C[N@H+]2[C@H](C)C[C@@H]2C)cs1 ZINC000336055760 134066374 /nfs/dbraw/zinc/06/63/74/134066374.db2.gz WZHJRSNDMDVGCI-OCAPTIKFSA-N 1 2 239.344 2.084 20 0 BEADLO CC(=O)Nc1nc(C[N@@H+]2[C@H](C)C[C@@H]2C)cs1 ZINC000336055760 134066375 /nfs/dbraw/zinc/06/63/75/134066375.db2.gz WZHJRSNDMDVGCI-OCAPTIKFSA-N 1 2 239.344 2.084 20 0 BEADLO CCn1c[nH+]cc1CN[C@@H](C1CC1)C(F)(F)F ZINC000418064869 191961098 /nfs/dbraw/zinc/96/10/98/191961098.db2.gz KKROPEZIWFFSHR-JTQLQIEISA-N 1 2 247.264 2.334 20 0 BEADLO C/C=C\C[C@@H](CO)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000351585076 356021735 /nfs/dbraw/zinc/02/17/35/356021735.db2.gz KPWLHWNJUNDWGU-XOULXFPDSA-N 1 2 246.314 2.005 20 0 BEADLO CCC(C)(C)[C@H](C)NC(=O)CCn1cc[nH+]c1 ZINC000617571409 356134754 /nfs/dbraw/zinc/13/47/54/356134754.db2.gz MGTTUAHSARHZGE-NSHDSACASA-N 1 2 237.347 2.214 20 0 BEADLO Cc1csc(C[N@@H+]2CCO[C@H](C3CC3)C2)n1 ZINC000336088586 134077435 /nfs/dbraw/zinc/07/74/35/134077435.db2.gz ZRJXCGCVYUPXAX-NSHDSACASA-N 1 2 238.356 2.062 20 0 BEADLO Cc1csc(C[N@H+]2CCO[C@H](C3CC3)C2)n1 ZINC000336088586 134077436 /nfs/dbraw/zinc/07/74/36/134077436.db2.gz ZRJXCGCVYUPXAX-NSHDSACASA-N 1 2 238.356 2.062 20 0 BEADLO CC(=O)C[NH+]1CCC(C(=O)c2ccccc2)CC1 ZINC000639439949 356216853 /nfs/dbraw/zinc/21/68/53/356216853.db2.gz RATYGPILPAGPHC-UHFFFAOYSA-N 1 2 245.322 2.170 20 0 BEADLO CC[C@H](C)CCNC(=O)CCCn1cc[nH+]c1 ZINC000617635085 356223018 /nfs/dbraw/zinc/22/30/18/356223018.db2.gz IRPGFRYHWHRCEJ-LBPRGKRZSA-N 1 2 237.347 2.216 20 0 BEADLO C(c1nc(C2CCC2)no1)[NH+]1CCCCC1 ZINC000639448260 356228412 /nfs/dbraw/zinc/22/84/12/356228412.db2.gz YIAPUTHBOMMYMS-UHFFFAOYSA-N 1 2 221.304 2.323 20 0 BEADLO CC[C@@H](C)CCNC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000617643030 356254962 /nfs/dbraw/zinc/25/49/62/356254962.db2.gz NGZAABZPFWHYNG-NEPJUHHUSA-N 1 2 237.347 2.387 20 0 BEADLO CCCC[N@H+](CCO)CC(F)(F)CC ZINC000639474046 356267768 /nfs/dbraw/zinc/26/77/68/356267768.db2.gz KIQCPPNKQNUPGS-UHFFFAOYSA-N 1 2 209.280 2.126 20 0 BEADLO CCCC[N@@H+](CCO)CC(F)(F)CC ZINC000639474046 356267771 /nfs/dbraw/zinc/26/77/71/356267771.db2.gz KIQCPPNKQNUPGS-UHFFFAOYSA-N 1 2 209.280 2.126 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCC[C@H](CCO)C1 ZINC000639476834 356271768 /nfs/dbraw/zinc/27/17/68/356271768.db2.gz LYNDGXWTGHUUHF-SNVBAGLBSA-N 1 2 221.291 2.126 20 0 BEADLO CCC(F)(F)C[N@H+]1CCC[C@H](CCO)C1 ZINC000639476834 356271770 /nfs/dbraw/zinc/27/17/70/356271770.db2.gz LYNDGXWTGHUUHF-SNVBAGLBSA-N 1 2 221.291 2.126 20 0 BEADLO CCC(F)(F)C[N@H+](C)C[C@@H]1CCCO1 ZINC000639455090 356240710 /nfs/dbraw/zinc/24/07/10/356240710.db2.gz XGYCGKNLQOWLPZ-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CCC(F)(F)C[N@@H+](C)C[C@@H]1CCCO1 ZINC000639455090 356240713 /nfs/dbraw/zinc/24/07/13/356240713.db2.gz XGYCGKNLQOWLPZ-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CC(=O)C[N@@H+]1CCc2cc(F)ccc2[C@@H]1C ZINC000639495989 356322569 /nfs/dbraw/zinc/32/25/69/356322569.db2.gz LJVHMURNMYNKLO-JTQLQIEISA-N 1 2 221.275 2.334 20 0 BEADLO CC(=O)C[N@H+]1CCc2cc(F)ccc2[C@@H]1C ZINC000639495989 356322571 /nfs/dbraw/zinc/32/25/71/356322571.db2.gz LJVHMURNMYNKLO-JTQLQIEISA-N 1 2 221.275 2.334 20 0 BEADLO CC1=C[C@H](C)C[N@@H+](Cc2nnc(C(C)C)[nH]2)C1 ZINC000336124909 134092508 /nfs/dbraw/zinc/09/25/08/134092508.db2.gz JXZKVFSRRMCNAP-JTQLQIEISA-N 1 2 234.347 2.326 20 0 BEADLO CC1=C[C@H](C)C[N@H+](Cc2nnc(C(C)C)[nH]2)C1 ZINC000336124909 134092509 /nfs/dbraw/zinc/09/25/09/134092509.db2.gz JXZKVFSRRMCNAP-JTQLQIEISA-N 1 2 234.347 2.326 20 0 BEADLO CC(=O)C[N@@H+]1CCS[C@H](c2ccccc2)C1 ZINC000639492619 356318387 /nfs/dbraw/zinc/31/83/87/356318387.db2.gz DPXIGHKNHCNEMK-ZDUSSCGKSA-N 1 2 235.352 2.366 20 0 BEADLO CC(=O)C[N@H+]1CCS[C@H](c2ccccc2)C1 ZINC000639492619 356318391 /nfs/dbraw/zinc/31/83/91/356318391.db2.gz DPXIGHKNHCNEMK-ZDUSSCGKSA-N 1 2 235.352 2.366 20 0 BEADLO C[C@@H]1C[C@@H](COc2cc[nH+]cc2)CCO1 ZINC000336134214 134095385 /nfs/dbraw/zinc/09/53/85/134095385.db2.gz XWVAVPHSAWKVFA-MNOVXSKESA-N 1 2 207.273 2.276 20 0 BEADLO CCCC[C@@H](C)[N@H+](C)Cc1noc(COC)n1 ZINC000352408159 356340755 /nfs/dbraw/zinc/34/07/55/356340755.db2.gz HFTAESMPDBNVAK-SNVBAGLBSA-N 1 2 241.335 2.227 20 0 BEADLO CCCC[C@@H](C)[N@@H+](C)Cc1noc(COC)n1 ZINC000352408159 356340759 /nfs/dbraw/zinc/34/07/59/356340759.db2.gz HFTAESMPDBNVAK-SNVBAGLBSA-N 1 2 241.335 2.227 20 0 BEADLO CCCC[C@H](C)[N@H+](C)Cc1noc(C)n1 ZINC000352413556 356341249 /nfs/dbraw/zinc/34/12/49/356341249.db2.gz AISUPEXACIXZIL-VIFPVBQESA-N 1 2 211.309 2.389 20 0 BEADLO CCCC[C@H](C)[N@@H+](C)Cc1noc(C)n1 ZINC000352413556 356341252 /nfs/dbraw/zinc/34/12/52/356341252.db2.gz AISUPEXACIXZIL-VIFPVBQESA-N 1 2 211.309 2.389 20 0 BEADLO CC(=O)C[NH2+]C1(c2nccs2)CCCC1 ZINC000639537352 356389239 /nfs/dbraw/zinc/38/92/39/356389239.db2.gz VKDKKKBKGSCVEW-UHFFFAOYSA-N 1 2 224.329 2.091 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCC[C@@H]([C@H](C)O)C1 ZINC000639543731 356402904 /nfs/dbraw/zinc/40/29/04/356402904.db2.gz OCMSLYHMDJVXFQ-VHSXEESVSA-N 1 2 221.291 2.125 20 0 BEADLO CCC(F)(F)C[N@H+]1CCC[C@@H]([C@H](C)O)C1 ZINC000639543731 356402908 /nfs/dbraw/zinc/40/29/08/356402908.db2.gz OCMSLYHMDJVXFQ-VHSXEESVSA-N 1 2 221.291 2.125 20 0 BEADLO Cc1nccnc1C[NH+]1CC2(C1)CC(F)(F)C2 ZINC000639552912 356453055 /nfs/dbraw/zinc/45/30/55/356453055.db2.gz ABRQYKVOLLOFQP-UHFFFAOYSA-N 1 2 239.269 2.016 20 0 BEADLO CC[C@H]1C[C@@H](Nc2cc[nH+]c(C3CC3)n2)CCO1 ZINC000420623532 192250002 /nfs/dbraw/zinc/25/00/02/192250002.db2.gz VGBWUKMAWWPCCN-RYUDHWBXSA-N 1 2 247.342 2.145 20 0 BEADLO CC[C@@H](C)CNc1cc[nH+]c(C(C)C)n1 ZINC000420650496 192255379 /nfs/dbraw/zinc/25/53/79/192255379.db2.gz HZNHBADRZATODE-SNVBAGLBSA-N 1 2 207.321 2.480 20 0 BEADLO CCC(F)(F)C[NH2+][C@H](CO)c1ccsc1 ZINC000639588904 356511763 /nfs/dbraw/zinc/51/17/63/356511763.db2.gz HNSCZOKUIQTWMC-SECBINFHSA-N 1 2 235.299 2.416 20 0 BEADLO CC(=O)C[NH2+][C@H](C)c1cccc(F)c1F ZINC000639568192 356493331 /nfs/dbraw/zinc/49/33/31/356493331.db2.gz JFDHSJLDSCJCMZ-MRVPVSSYSA-N 1 2 213.227 2.204 20 0 BEADLO CC(=O)C[NH2+][C@H](COCC(C)C)c1ccco1 ZINC000639577084 356498077 /nfs/dbraw/zinc/49/80/77/356498077.db2.gz BVMKUWOGQAWYJD-GFCCVEGCSA-N 1 2 239.315 2.172 20 0 BEADLO CCC(F)(F)CN1CCn2cc(C)[nH+]c2C1 ZINC000639576708 356498265 /nfs/dbraw/zinc/49/82/65/356498265.db2.gz WLGSPBVYOGFETK-UHFFFAOYSA-N 1 2 229.274 2.052 20 0 BEADLO CC(=O)C[NH2+]C1(c2nc(C)cs2)CCC1 ZINC000639579820 356500751 /nfs/dbraw/zinc/50/07/51/356500751.db2.gz GXKROIIVWAJDHJ-UHFFFAOYSA-N 1 2 224.329 2.009 20 0 BEADLO CC[N@@H+](Cc1nn(C)cc1Cl)CC1CC1 ZINC000420903616 192269061 /nfs/dbraw/zinc/26/90/61/192269061.db2.gz BGPRVVACICYJPB-UHFFFAOYSA-N 1 2 227.739 2.305 20 0 BEADLO CC[N@H+](Cc1nn(C)cc1Cl)CC1CC1 ZINC000420903616 192269063 /nfs/dbraw/zinc/26/90/63/192269063.db2.gz BGPRVVACICYJPB-UHFFFAOYSA-N 1 2 227.739 2.305 20 0 BEADLO CC[C@@H]1C[N@H+]([C@@H](C)c2cnccn2)C[C@H](CC)O1 ZINC000420953267 192277200 /nfs/dbraw/zinc/27/72/00/192277200.db2.gz IYVBBIQCXFXXRV-RWMBFGLXSA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@@H](C)c2cnccn2)C[C@H](CC)O1 ZINC000420953267 192277202 /nfs/dbraw/zinc/27/72/02/192277202.db2.gz IYVBBIQCXFXXRV-RWMBFGLXSA-N 1 2 249.358 2.427 20 0 BEADLO CC(=O)C[NH+]1CCC(c2ncc(C)s2)CC1 ZINC000639611886 356530257 /nfs/dbraw/zinc/53/02/57/356530257.db2.gz GKCMDTQQNMFXGX-UHFFFAOYSA-N 1 2 238.356 2.220 20 0 BEADLO CC[C@H]1C[NH+](Cc2ncc(C)o2)C[C@H](CC)O1 ZINC000420962442 192284181 /nfs/dbraw/zinc/28/41/81/192284181.db2.gz UHNBNYWGFJRLHM-RYUDHWBXSA-N 1 2 238.331 2.372 20 0 BEADLO CSCCC[N@H+](C)Cc1nn(C)cc1Cl ZINC000420968946 192284581 /nfs/dbraw/zinc/28/45/81/192284581.db2.gz XOZXTGUKGQVCAT-UHFFFAOYSA-N 1 2 247.795 2.258 20 0 BEADLO CSCCC[N@@H+](C)Cc1nn(C)cc1Cl ZINC000420968946 192284584 /nfs/dbraw/zinc/28/45/84/192284584.db2.gz XOZXTGUKGQVCAT-UHFFFAOYSA-N 1 2 247.795 2.258 20 0 BEADLO CCC(CC)c1noc(Cc2c[nH+]cn2C)n1 ZINC000350402482 366276330 /nfs/dbraw/zinc/27/63/30/366276330.db2.gz FYSHZTLAIXHEMU-UHFFFAOYSA-N 1 2 234.303 2.298 20 0 BEADLO C[C@@H]1CC[C@@H](O)C[N@@H+]1Cc1ncc(Cl)s1 ZINC000421009304 192300830 /nfs/dbraw/zinc/30/08/30/192300830.db2.gz IIIZMOCAZGBHOC-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H]1CC[C@@H](O)C[N@H+]1Cc1ncc(Cl)s1 ZINC000421009304 192300831 /nfs/dbraw/zinc/30/08/31/192300831.db2.gz IIIZMOCAZGBHOC-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CCO[C@H](C)[C@H]2C)cn1 ZINC000179678278 366284690 /nfs/dbraw/zinc/28/46/90/366284690.db2.gz HZCYXLAFECLTEV-VXGBXAGGSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)n1cc(C[N@H+]2CCO[C@H](C)[C@H]2C)cn1 ZINC000179678278 366284693 /nfs/dbraw/zinc/28/46/93/366284693.db2.gz HZCYXLAFECLTEV-VXGBXAGGSA-N 1 2 237.347 2.073 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@]23CCOC3)sc1C ZINC000421012781 192302895 /nfs/dbraw/zinc/30/28/95/192302895.db2.gz FSXRRIKWFGPNGQ-GFCCVEGCSA-N 1 2 238.356 2.125 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@]23CCOC3)sc1C ZINC000421012781 192302897 /nfs/dbraw/zinc/30/28/97/192302897.db2.gz FSXRRIKWFGPNGQ-GFCCVEGCSA-N 1 2 238.356 2.125 20 0 BEADLO CSCc1cccc(C[NH+]2CCOCC2)c1 ZINC000421204401 192312901 /nfs/dbraw/zinc/31/29/01/192312901.db2.gz FMKXDUGJMAQASO-UHFFFAOYSA-N 1 2 237.368 2.382 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@]23CCOC3)c(C)s1 ZINC000421023156 192307049 /nfs/dbraw/zinc/30/70/49/192307049.db2.gz QVCKYJQGMYHNGR-LBPRGKRZSA-N 1 2 238.356 2.125 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@]23CCOC3)c(C)s1 ZINC000421023156 192307051 /nfs/dbraw/zinc/30/70/51/192307051.db2.gz QVCKYJQGMYHNGR-LBPRGKRZSA-N 1 2 238.356 2.125 20 0 BEADLO CC[C@H](C)CCC(=O)N[C@@H]1CCn2c[nH+]cc2C1 ZINC000623299829 356559463 /nfs/dbraw/zinc/55/94/63/356559463.db2.gz DISBQNLPTOQKLB-NWDGAFQWSA-N 1 2 249.358 2.140 20 0 BEADLO CCC(F)(F)C[N@H+](C)C(C)(C)COC ZINC000639654861 356560195 /nfs/dbraw/zinc/56/01/95/356560195.db2.gz PGLQVIKQJIKQPQ-UHFFFAOYSA-N 1 2 209.280 2.389 20 0 BEADLO CCC(F)(F)C[N@@H+](C)C(C)(C)COC ZINC000639654861 356560199 /nfs/dbraw/zinc/56/01/99/356560199.db2.gz PGLQVIKQJIKQPQ-UHFFFAOYSA-N 1 2 209.280 2.389 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nc(C3CCC3)no2)[C@@H]1C ZINC000639657461 356572500 /nfs/dbraw/zinc/57/25/00/356572500.db2.gz ZFNPBKCNOJXZRY-RKDXNWHRSA-N 1 2 221.304 2.177 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nc(C3CCC3)no2)[C@@H]1C ZINC000639657461 356572502 /nfs/dbraw/zinc/57/25/02/356572502.db2.gz ZFNPBKCNOJXZRY-RKDXNWHRSA-N 1 2 221.304 2.177 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NCc2c[nH+]c[nH]2)C[C@H]1C ZINC000449908393 202050758 /nfs/dbraw/zinc/05/07/58/202050758.db2.gz UKZDRIIRTDGVJX-GMTAPVOTSA-N 1 2 235.331 2.098 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NCc2c[nH]c[nH+]2)C[C@H]1C ZINC000449908393 202050762 /nfs/dbraw/zinc/05/07/62/202050762.db2.gz UKZDRIIRTDGVJX-GMTAPVOTSA-N 1 2 235.331 2.098 20 0 BEADLO CCc1noc(C)c1C[N@@H+]1CCO[C@H](CC)C1 ZINC000162732431 202051598 /nfs/dbraw/zinc/05/15/98/202051598.db2.gz MGRHXUZRSZBTSA-LLVKDONJSA-N 1 2 238.331 2.156 20 0 BEADLO CCc1noc(C)c1C[N@H+]1CCO[C@H](CC)C1 ZINC000162732431 202051602 /nfs/dbraw/zinc/05/16/02/202051602.db2.gz MGRHXUZRSZBTSA-LLVKDONJSA-N 1 2 238.331 2.156 20 0 BEADLO Cc1cccnc1NC(=O)CCCn1cc[nH+]c1 ZINC000122678259 363490597 /nfs/dbraw/zinc/49/05/97/363490597.db2.gz HWKQTVLWFFLSJU-UHFFFAOYSA-N 1 2 244.298 2.005 20 0 BEADLO CC(C)CN(C)c1cc(NCC2CC2)[nH+]cn1 ZINC000301829775 356581421 /nfs/dbraw/zinc/58/14/21/356581421.db2.gz PIEHPHRZJRZFJE-UHFFFAOYSA-N 1 2 234.347 2.391 20 0 BEADLO CC(C)CN(C)c1cc(NCC2CC2)nc[nH+]1 ZINC000301829775 356581423 /nfs/dbraw/zinc/58/14/23/356581423.db2.gz PIEHPHRZJRZFJE-UHFFFAOYSA-N 1 2 234.347 2.391 20 0 BEADLO CCC[C@H](C)CC(=O)N[C@H]1CCn2c[nH+]cc2C1 ZINC000623304029 356594548 /nfs/dbraw/zinc/59/45/48/356594548.db2.gz PMWCMDTZLMMZSJ-RYUDHWBXSA-N 1 2 249.358 2.140 20 0 BEADLO CCC(C)(C)CC(=O)N[C@@H]1CCn2c[nH+]cc2C1 ZINC000623306707 356607660 /nfs/dbraw/zinc/60/76/60/356607660.db2.gz STUWPBYGBDASFD-LLVKDONJSA-N 1 2 249.358 2.140 20 0 BEADLO CC(C)CCCC(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000450177390 202091306 /nfs/dbraw/zinc/09/13/06/202091306.db2.gz WUGZSENAQGYFED-NSHDSACASA-N 1 2 249.358 2.210 20 0 BEADLO CC(C)CCCC(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000450177390 202091310 /nfs/dbraw/zinc/09/13/10/202091310.db2.gz WUGZSENAQGYFED-NSHDSACASA-N 1 2 249.358 2.210 20 0 BEADLO C[C@@H]([NH2+]C1CC(C(F)F)C1)C(=O)OC(C)(C)C ZINC000613620655 363543025 /nfs/dbraw/zinc/54/30/25/363543025.db2.gz GILKGSGLSPXGPS-AFPNSQJFSA-N 1 2 249.301 2.350 20 0 BEADLO C[N@H+](Cc1nnc(C2CC2)s1)C1CC1 ZINC000450263984 202113969 /nfs/dbraw/zinc/11/39/69/202113969.db2.gz RXCNNYQDEYRCIK-UHFFFAOYSA-N 1 2 209.318 2.010 20 0 BEADLO C[N@@H+](Cc1nnc(C2CC2)s1)C1CC1 ZINC000450263984 202113972 /nfs/dbraw/zinc/11/39/72/202113972.db2.gz RXCNNYQDEYRCIK-UHFFFAOYSA-N 1 2 209.318 2.010 20 0 BEADLO CC[N@H+](C[C@@H]1CCCO1)[C@@H](C)c1csnn1 ZINC000450322768 202127513 /nfs/dbraw/zinc/12/75/13/202127513.db2.gz BLRNTJPUWYPUBR-UWVGGRQHSA-N 1 2 241.360 2.100 20 0 BEADLO CC[N@@H+](C[C@@H]1CCCO1)[C@@H](C)c1csnn1 ZINC000450322768 202127516 /nfs/dbraw/zinc/12/75/16/202127516.db2.gz BLRNTJPUWYPUBR-UWVGGRQHSA-N 1 2 241.360 2.100 20 0 BEADLO CC[N@H+](C[C@H]1CCCO1)[C@H](C)c1csnn1 ZINC000450322767 202128801 /nfs/dbraw/zinc/12/88/01/202128801.db2.gz BLRNTJPUWYPUBR-NXEZZACHSA-N 1 2 241.360 2.100 20 0 BEADLO CC[N@@H+](C[C@H]1CCCO1)[C@H](C)c1csnn1 ZINC000450322767 202128805 /nfs/dbraw/zinc/12/88/05/202128805.db2.gz BLRNTJPUWYPUBR-NXEZZACHSA-N 1 2 241.360 2.100 20 0 BEADLO CCC(=O)CCC[N@H+](C)CC(=O)OC(C)(C)C ZINC000450328539 202129634 /nfs/dbraw/zinc/12/96/34/202129634.db2.gz CJVLKGODYCLESO-UHFFFAOYSA-N 1 2 243.347 2.019 20 0 BEADLO CCC(=O)CCC[N@@H+](C)CC(=O)OC(C)(C)C ZINC000450328539 202129635 /nfs/dbraw/zinc/12/96/35/202129635.db2.gz CJVLKGODYCLESO-UHFFFAOYSA-N 1 2 243.347 2.019 20 0 BEADLO CCc1cc(CCC[N@H+](C)CC(F)F)on1 ZINC000450355574 202141942 /nfs/dbraw/zinc/14/19/42/202141942.db2.gz RLVQJLUEVBGZAW-UHFFFAOYSA-N 1 2 232.274 2.367 20 0 BEADLO CCc1cc(CCC[N@@H+](C)CC(F)F)on1 ZINC000450355574 202141946 /nfs/dbraw/zinc/14/19/46/202141946.db2.gz RLVQJLUEVBGZAW-UHFFFAOYSA-N 1 2 232.274 2.367 20 0 BEADLO C[C@H](NCc1cn2ccccc2[nH+]1)C(C)(F)F ZINC000389465448 356679685 /nfs/dbraw/zinc/67/96/85/356679685.db2.gz IEYBSSPGYBPVPX-VIFPVBQESA-N 1 2 239.269 2.468 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCC[C@H]1CF ZINC000578143326 366322690 /nfs/dbraw/zinc/32/26/90/366322690.db2.gz KXJYYHXOAYNZJK-JTQLQIEISA-N 1 2 209.268 2.032 20 0 BEADLO C[C@H]([NH2+]Cc1cncs1)C(C)(F)F ZINC000389482064 356688972 /nfs/dbraw/zinc/68/89/72/356688972.db2.gz WIAAGKJTOKKXNG-LURJTMIESA-N 1 2 206.261 2.276 20 0 BEADLO COc1ccc(C[NH2+][C@H](C)C(C)(F)F)cn1 ZINC000389463276 356680911 /nfs/dbraw/zinc/68/09/11/356680911.db2.gz HYJQQTKAAJWGTF-MRVPVSSYSA-N 1 2 230.258 2.224 20 0 BEADLO C[C@@H]([NH2+]Cc1ccncc1)C(C)(F)F ZINC000389474245 356682343 /nfs/dbraw/zinc/68/23/43/356682343.db2.gz WNESVULSIMOSDV-MRVPVSSYSA-N 1 2 200.232 2.215 20 0 BEADLO CCN(C(=O)CCc1[nH]cc[nH+]1)[C@H](C)C(C)C ZINC000582251110 356683063 /nfs/dbraw/zinc/68/30/63/356683063.db2.gz LOPWYBNUBYVLMK-LLVKDONJSA-N 1 2 237.347 2.235 20 0 BEADLO C[C@H]([NH2+]Cc1cnn2ccccc12)C(C)(F)F ZINC000389469798 356684229 /nfs/dbraw/zinc/68/42/29/356684229.db2.gz NETJWJIFXRCOLO-VIFPVBQESA-N 1 2 239.269 2.468 20 0 BEADLO Fc1cnccc1C[N@@H+]1CCC[C@@H]1c1cn[nH]c1 ZINC000639777079 356720755 /nfs/dbraw/zinc/72/07/55/356720755.db2.gz RQKYHMFABKKHSU-CYBMUJFWSA-N 1 2 246.289 2.281 20 0 BEADLO Fc1cnccc1C[N@H+]1CCC[C@@H]1c1cn[nH]c1 ZINC000639777079 356720758 /nfs/dbraw/zinc/72/07/58/356720758.db2.gz RQKYHMFABKKHSU-CYBMUJFWSA-N 1 2 246.289 2.281 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@H]2c2cn[nH]c2)co1 ZINC000639778545 356723383 /nfs/dbraw/zinc/72/33/83/356723383.db2.gz RIZHOFSQEJQSNB-LBPRGKRZSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@H]2c2cn[nH]c2)co1 ZINC000639778545 356723387 /nfs/dbraw/zinc/72/33/87/356723387.db2.gz RIZHOFSQEJQSNB-LBPRGKRZSA-N 1 2 232.287 2.043 20 0 BEADLO CCc1nc(C[N@@H+]2CCCC[C@@H]2C)no1 ZINC000054316317 363564861 /nfs/dbraw/zinc/56/48/61/363564861.db2.gz UZGKSCCNQJJZDX-VIFPVBQESA-N 1 2 209.293 2.006 20 0 BEADLO CCc1nc(C[N@H+]2CCCC[C@@H]2C)no1 ZINC000054316317 363564867 /nfs/dbraw/zinc/56/48/67/363564867.db2.gz UZGKSCCNQJJZDX-VIFPVBQESA-N 1 2 209.293 2.006 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+](C)Cc2ccns2)cn1 ZINC000639807755 356777651 /nfs/dbraw/zinc/77/76/51/356777651.db2.gz LBSUUHGGLPDKRH-SNVBAGLBSA-N 1 2 248.355 2.435 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+](C)Cc2ccns2)cn1 ZINC000639807755 356777653 /nfs/dbraw/zinc/77/76/53/356777653.db2.gz LBSUUHGGLPDKRH-SNVBAGLBSA-N 1 2 248.355 2.435 20 0 BEADLO Cc1ccc(NC(=O)N[C@H](C)C(F)F)c(C)[nH+]1 ZINC000639796509 356752800 /nfs/dbraw/zinc/75/28/00/356752800.db2.gz UGIDOVZEWCHOKP-MRVPVSSYSA-N 1 2 243.257 2.474 20 0 BEADLO Cc1cccnc1C[N@H+](C)Cc1ccns1 ZINC000639805417 356775294 /nfs/dbraw/zinc/77/52/94/356775294.db2.gz DFWBTBXDSBEFBH-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cccnc1C[N@@H+](C)Cc1ccns1 ZINC000639805417 356775297 /nfs/dbraw/zinc/77/52/97/356775297.db2.gz DFWBTBXDSBEFBH-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CO[C@@H]1C[N@H+](Cc2cc3ccccc3o2)CCO1 ZINC000639835005 356824539 /nfs/dbraw/zinc/82/45/39/356824539.db2.gz ALZUNXYZPIHHSM-AWEZNQCLSA-N 1 2 247.294 2.238 20 0 BEADLO CO[C@@H]1C[N@@H+](Cc2cc3ccccc3o2)CCO1 ZINC000639835005 356824541 /nfs/dbraw/zinc/82/45/41/356824541.db2.gz ALZUNXYZPIHHSM-AWEZNQCLSA-N 1 2 247.294 2.238 20 0 BEADLO Cc1cn[nH]c1C[N@@H+](C)Cc1ccc(F)cc1 ZINC000356061951 356787070 /nfs/dbraw/zinc/78/70/70/356787070.db2.gz UQHYRXBMYWTSLY-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1cn[nH]c1C[N@H+](C)Cc1ccc(F)cc1 ZINC000356061951 356787074 /nfs/dbraw/zinc/78/70/74/356787074.db2.gz UQHYRXBMYWTSLY-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1c[nH]nc1C[N@@H+](C)Cc1ccc(F)cc1 ZINC000356061951 356787076 /nfs/dbraw/zinc/78/70/76/356787076.db2.gz UQHYRXBMYWTSLY-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1c[nH]nc1C[N@H+](C)Cc1ccc(F)cc1 ZINC000356061951 356787081 /nfs/dbraw/zinc/78/70/81/356787081.db2.gz UQHYRXBMYWTSLY-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO CCC(=O)CCC[N@H+](C)[C@@H](C)C(=O)OC(C)C ZINC000450488018 202183369 /nfs/dbraw/zinc/18/33/69/202183369.db2.gz FSLOADAIEFKATM-NSHDSACASA-N 1 2 243.347 2.018 20 0 BEADLO CCC(=O)CCC[N@@H+](C)[C@@H](C)C(=O)OC(C)C ZINC000450488018 202183373 /nfs/dbraw/zinc/18/33/73/202183373.db2.gz FSLOADAIEFKATM-NSHDSACASA-N 1 2 243.347 2.018 20 0 BEADLO c1cnc([C@@H]2CCC[N@H+]2Cc2ccncc2)nc1 ZINC000639843288 356839344 /nfs/dbraw/zinc/83/93/44/356839344.db2.gz PAKCKRIFYHQHOP-ZDUSSCGKSA-N 1 2 240.310 2.209 20 0 BEADLO c1cnc([C@@H]2CCC[N@@H+]2Cc2ccncc2)nc1 ZINC000639843288 356839349 /nfs/dbraw/zinc/83/93/49/356839349.db2.gz PAKCKRIFYHQHOP-ZDUSSCGKSA-N 1 2 240.310 2.209 20 0 BEADLO c1ccc(C[N@@H+]2CCC[C@H]2c2ncccn2)nc1 ZINC000639843617 356840393 /nfs/dbraw/zinc/84/03/93/356840393.db2.gz STVBYYDLJFOWNJ-ZDUSSCGKSA-N 1 2 240.310 2.209 20 0 BEADLO c1ccc(C[N@H+]2CCC[C@H]2c2ncccn2)nc1 ZINC000639843617 356840397 /nfs/dbraw/zinc/84/03/97/356840397.db2.gz STVBYYDLJFOWNJ-ZDUSSCGKSA-N 1 2 240.310 2.209 20 0 BEADLO CN(C)c1nc(NC2CC2)[nH+]c2ccccc21 ZINC000041147280 356859335 /nfs/dbraw/zinc/85/93/35/356859335.db2.gz GIRFAWOLNFEYLI-UHFFFAOYSA-N 1 2 228.299 2.270 20 0 BEADLO CCc1cc(CCCn2cc[nH+]c2)on1 ZINC000450508600 202188961 /nfs/dbraw/zinc/18/89/61/202188961.db2.gz CPBKTJJYSKJPTN-UHFFFAOYSA-N 1 2 205.261 2.066 20 0 BEADLO C[C@@H](c1ccccc1)[C@H](O)Cn1cc[nH+]c1 ZINC000450512916 202189573 /nfs/dbraw/zinc/18/95/73/202189573.db2.gz VLSJAQWJEJWZGN-WCQYABFASA-N 1 2 216.284 2.048 20 0 BEADLO Cc1nc2[nH]ccc2c(NCC[C@@H](C)CCO)[nH+]1 ZINC000450564228 202199565 /nfs/dbraw/zinc/19/95/65/202199565.db2.gz MIOKZGDYUATFTD-SECBINFHSA-N 1 2 248.330 2.038 20 0 BEADLO CC[C@@H](Nc1cc[nH+]c(C)n1)C(F)F ZINC000450564217 202199746 /nfs/dbraw/zinc/19/97/46/202199746.db2.gz MGYXLANFCARLCV-SSDOTTSWSA-N 1 2 201.220 2.241 20 0 BEADLO CC[N@@H+](Cc1noc(C(C)C)n1)C[C@H](C)OC ZINC000361576443 356933359 /nfs/dbraw/zinc/93/33/59/356933359.db2.gz HRJSHPNIRUMLKM-JTQLQIEISA-N 1 2 241.335 2.050 20 0 BEADLO CC[N@H+](Cc1noc(C(C)C)n1)C[C@H](C)OC ZINC000361576443 356933363 /nfs/dbraw/zinc/93/33/63/356933363.db2.gz HRJSHPNIRUMLKM-JTQLQIEISA-N 1 2 241.335 2.050 20 0 BEADLO CCc1cnccc1[C@@H](C)[NH2+]Cc1ncccn1 ZINC000361771136 356937070 /nfs/dbraw/zinc/93/70/70/356937070.db2.gz WGBWDCIKRFWVGO-LLVKDONJSA-N 1 2 242.326 2.285 20 0 BEADLO C[C@H](C(=O)NC(C)(C)C)[N@H+](C)Cc1ccco1 ZINC000016381250 356955370 /nfs/dbraw/zinc/95/53/70/356955370.db2.gz BQRBGXZQTLEUIF-SNVBAGLBSA-N 1 2 238.331 2.015 20 0 BEADLO C[C@H](C(=O)NC(C)(C)C)[N@@H+](C)Cc1ccco1 ZINC000016381250 356955373 /nfs/dbraw/zinc/95/53/73/356955373.db2.gz BQRBGXZQTLEUIF-SNVBAGLBSA-N 1 2 238.331 2.015 20 0 BEADLO C[C@H](c1csnn1)[N@H+](C)CCC1CC1 ZINC000450600469 202208687 /nfs/dbraw/zinc/20/86/87/202208687.db2.gz NUCHUVPYAZPQJN-MRVPVSSYSA-N 1 2 211.334 2.331 20 0 BEADLO C[C@H](c1csnn1)[N@@H+](C)CCC1CC1 ZINC000450600469 202208689 /nfs/dbraw/zinc/20/86/89/202208689.db2.gz NUCHUVPYAZPQJN-MRVPVSSYSA-N 1 2 211.334 2.331 20 0 BEADLO Cc1cc(N2CCCOC(C)(C)C2)c(C#N)c[nH+]1 ZINC000399506741 356960534 /nfs/dbraw/zinc/96/05/34/356960534.db2.gz KFJXDJIWSANKQX-UHFFFAOYSA-N 1 2 245.326 2.267 20 0 BEADLO CCO[C@@H]1CCCN(c2cc(C)[nH+]cc2C#N)C1 ZINC000399498790 356960659 /nfs/dbraw/zinc/96/06/59/356960659.db2.gz IEOWXURYTUZNJZ-CYBMUJFWSA-N 1 2 245.326 2.267 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccno1)c1nccs1 ZINC000389879967 357059053 /nfs/dbraw/zinc/05/90/53/357059053.db2.gz NRAPMJWKJAROLT-SECBINFHSA-N 1 2 223.301 2.372 20 0 BEADLO CC[C@@H]([NH2+]Cc1cc[nH]n1)c1c(C)noc1C ZINC000121193961 357079811 /nfs/dbraw/zinc/07/98/11/357079811.db2.gz UFTNEIKNAAHSCK-LLVKDONJSA-N 1 2 234.303 2.255 20 0 BEADLO COc1ccsc1C[NH2+]Cc1cc(C)on1 ZINC000390493564 357096912 /nfs/dbraw/zinc/09/69/12/357096912.db2.gz RCYDQCIAIWAFJV-UHFFFAOYSA-N 1 2 238.312 2.343 20 0 BEADLO CCc1nc(C[N@@H+]2CC[C@H](c3ccco3)C2)no1 ZINC000374003349 357152481 /nfs/dbraw/zinc/15/24/81/357152481.db2.gz PKTPJIFNGOKGOL-JTQLQIEISA-N 1 2 247.298 2.215 20 0 BEADLO CCc1nc(C[N@H+]2CC[C@H](c3ccco3)C2)no1 ZINC000374003349 357152485 /nfs/dbraw/zinc/15/24/85/357152485.db2.gz PKTPJIFNGOKGOL-JTQLQIEISA-N 1 2 247.298 2.215 20 0 BEADLO CC(C)(C)[C@@H]1CCN(C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000356031202 538804894 /nfs/dbraw/zinc/80/48/94/538804894.db2.gz DUDZMQUGSGTJRW-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO CC(C)(C)[C@@H]1CCN(C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000356031202 538804902 /nfs/dbraw/zinc/80/49/02/538804902.db2.gz DUDZMQUGSGTJRW-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO CCCCc1cc(N[C@H](CO)CC2CC2)nc[nH+]1 ZINC000631181549 357170009 /nfs/dbraw/zinc/17/00/09/357170009.db2.gz QZVSPAMFGITQDA-ZDUSSCGKSA-N 1 2 249.358 2.392 20 0 BEADLO CC12CC(C1)C[N@@H+]2CC(=O)c1ccccc1F ZINC000639880477 357117550 /nfs/dbraw/zinc/11/75/50/357117550.db2.gz WBKCTHTYWVHURH-UHFFFAOYSA-N 1 2 233.286 2.493 20 0 BEADLO CC12CC(C1)C[N@H+]2CC(=O)c1ccccc1F ZINC000639880477 357117554 /nfs/dbraw/zinc/11/75/54/357117554.db2.gz WBKCTHTYWVHURH-UHFFFAOYSA-N 1 2 233.286 2.493 20 0 BEADLO Cc1n[nH]c(C)c1C[N@@H+]1Cc2ccc(O)cc2C1 ZINC000628418830 357238785 /nfs/dbraw/zinc/23/87/85/357238785.db2.gz ARABGJOPKMPQSZ-UHFFFAOYSA-N 1 2 243.310 2.248 20 0 BEADLO Cc1n[nH]c(C)c1C[N@H+]1Cc2ccc(O)cc2C1 ZINC000628418830 357238787 /nfs/dbraw/zinc/23/87/87/357238787.db2.gz ARABGJOPKMPQSZ-UHFFFAOYSA-N 1 2 243.310 2.248 20 0 BEADLO CN(C(=O)CCc1c[nH+]c[nH]1)C1(C)CCCC1 ZINC000357104950 538825774 /nfs/dbraw/zinc/82/57/74/538825774.db2.gz GLXJVRGKHVYKSF-UHFFFAOYSA-N 1 2 235.331 2.133 20 0 BEADLO CN(C(=O)CCc1c[nH]c[nH+]1)C1(C)CCCC1 ZINC000357104950 538825776 /nfs/dbraw/zinc/82/57/76/538825776.db2.gz GLXJVRGKHVYKSF-UHFFFAOYSA-N 1 2 235.331 2.133 20 0 BEADLO CCC(C)(C)OC1CN(Cc2[nH]cc(C)[nH+]2)C1 ZINC000628422396 357245336 /nfs/dbraw/zinc/24/53/36/357245336.db2.gz CIGKWOCHWLKSCH-UHFFFAOYSA-N 1 2 237.347 2.108 20 0 BEADLO COc1ccsc1C[NH+]1CC2(C1)CCCO2 ZINC000628427303 357257077 /nfs/dbraw/zinc/25/70/77/357257077.db2.gz SMLAYTNBUFDLNF-UHFFFAOYSA-N 1 2 239.340 2.122 20 0 BEADLO Fc1ccccc1C[NH+]1CC2(C1)CCCO2 ZINC000628426904 357257885 /nfs/dbraw/zinc/25/78/85/357257885.db2.gz TZTFESRPTALOSO-UHFFFAOYSA-N 1 2 221.275 2.191 20 0 BEADLO C[C@@H]1C[C@@H](C)[C@@H](C)N(C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000357146620 538826474 /nfs/dbraw/zinc/82/64/74/538826474.db2.gz ZBZQUQNLBWYAID-IJLUTSLNSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H]1C[C@@H](C)[C@@H](C)N(C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000357146620 538826478 /nfs/dbraw/zinc/82/64/78/538826478.db2.gz ZBZQUQNLBWYAID-IJLUTSLNSA-N 1 2 249.358 2.235 20 0 BEADLO Cn1c[nH+]cc1CNc1nccc2occc21 ZINC000357605188 538832095 /nfs/dbraw/zinc/83/20/95/538832095.db2.gz VQHWVLCYFMOROG-UHFFFAOYSA-N 1 2 228.255 2.173 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccnn2C(C)C)no1 ZINC000394643235 357365744 /nfs/dbraw/zinc/36/57/44/357365744.db2.gz OXXRABWDRVWPOO-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO CC(C)[C@@H]1CCN(C(=O)C[C@H](C)n2cc[nH+]c2)C1 ZINC000583207409 357520310 /nfs/dbraw/zinc/52/03/10/357520310.db2.gz QIIFCRGNKXWOIS-QWHCGFSZSA-N 1 2 249.358 2.339 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CCC([C@@H]2CCCO2)CC1 ZINC000188243888 357536922 /nfs/dbraw/zinc/53/69/22/357536922.db2.gz JVZPKWJAGYUUBF-AWEZNQCLSA-N 1 2 249.358 2.109 20 0 BEADLO Cn1c[nH+]cc1CN[C@H](C(C)(C)C)C(F)(F)F ZINC000545215128 325194109 /nfs/dbraw/zinc/19/41/09/325194109.db2.gz OIOXSHZPOUPBFO-SECBINFHSA-N 1 2 249.280 2.487 20 0 BEADLO COc1ccc(CNc2c[nH+]cc(C)c2)cn1 ZINC000232084732 357648647 /nfs/dbraw/zinc/64/86/47/357648647.db2.gz IZDPTGAZHYUEFQ-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO Cc1cc(C[NH+]2CC(C)(C)OC(C)(C)C2)no1 ZINC000189655375 357655999 /nfs/dbraw/zinc/65/59/99/357655999.db2.gz GQEKMZSMXHJXHM-UHFFFAOYSA-N 1 2 238.331 2.372 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CC[C@H](OC)C1 ZINC000234802990 325233362 /nfs/dbraw/zinc/23/33/62/325233362.db2.gz JPNLMNVCKQPZPL-ZJUUUORDSA-N 1 2 222.288 2.070 20 0 BEADLO CC[C@@H](O)CNc1[nH+]ccc2c(OC)cccc21 ZINC000233907435 357762406 /nfs/dbraw/zinc/76/24/06/357762406.db2.gz GPILQDJKEUXPHO-SNVBAGLBSA-N 1 2 246.310 2.426 20 0 BEADLO CCc1occc1C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000234037337 357768402 /nfs/dbraw/zinc/76/84/02/357768402.db2.gz FIGRZTFKGYYVBQ-JTQLQIEISA-N 1 2 247.298 2.446 20 0 BEADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1ncccn1 ZINC000192136359 357824075 /nfs/dbraw/zinc/82/40/75/357824075.db2.gz WGBGRDDKGHJCIK-CYBMUJFWSA-N 1 2 242.326 2.455 20 0 BEADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ncccn1 ZINC000192136359 357824079 /nfs/dbraw/zinc/82/40/79/357824079.db2.gz WGBGRDDKGHJCIK-CYBMUJFWSA-N 1 2 242.326 2.455 20 0 BEADLO C[N@H+](Cc1ccccc1)Cc1ncccn1 ZINC000191907200 357804278 /nfs/dbraw/zinc/80/42/78/357804278.db2.gz OWYITACRXNXEBI-UHFFFAOYSA-N 1 2 213.284 2.109 20 0 BEADLO C[N@@H+](Cc1ccccc1)Cc1ncccn1 ZINC000191907200 357804279 /nfs/dbraw/zinc/80/42/79/357804279.db2.gz OWYITACRXNXEBI-UHFFFAOYSA-N 1 2 213.284 2.109 20 0 BEADLO CCn1c[nH+]cc1CNc1cnccc1C ZINC000085184002 134225012 /nfs/dbraw/zinc/22/50/12/134225012.db2.gz RKDNJCNTVFJRMG-UHFFFAOYSA-N 1 2 216.288 2.219 20 0 BEADLO COc1cccc2c1cc[nH+]c2NC[C@H](C)CO ZINC000234913905 357836676 /nfs/dbraw/zinc/83/66/76/357836676.db2.gz DQLISKUONMZJQY-JTQLQIEISA-N 1 2 246.310 2.284 20 0 BEADLO COc1cccc2c1cc[nH+]c2N[C@H](C)CO ZINC000234919096 357836892 /nfs/dbraw/zinc/83/68/92/357836892.db2.gz DHSPLZIRYXWNLM-SECBINFHSA-N 1 2 232.283 2.036 20 0 BEADLO CCCc1nc(C[N@H+](C)C(C)(C)C)no1 ZINC000583733249 357930058 /nfs/dbraw/zinc/93/00/58/357930058.db2.gz FKSYBEBNQOXQED-UHFFFAOYSA-N 1 2 211.309 2.252 20 0 BEADLO CCCc1nc(C[N@@H+](C)C(C)(C)C)no1 ZINC000583733249 357930062 /nfs/dbraw/zinc/93/00/62/357930062.db2.gz FKSYBEBNQOXQED-UHFFFAOYSA-N 1 2 211.309 2.252 20 0 BEADLO COc1c(C)[nH+]c(C2CC2)nc1NC[C@H]1C[C@@H]1C ZINC000583763430 357938229 /nfs/dbraw/zinc/93/82/29/357938229.db2.gz YRWROOZAKGVQIS-GZMMTYOYSA-N 1 2 247.342 2.161 20 0 BEADLO COc1c(C)[nH+]c(C2CC2)nc1NC[C@H]1C[C@H]1C ZINC000583763433 357938283 /nfs/dbraw/zinc/93/82/83/357938283.db2.gz YRWROOZAKGVQIS-LDYMZIIASA-N 1 2 247.342 2.161 20 0 BEADLO c1ccc([C@H]2CCC[N@H+]2Cc2ncccn2)nc1 ZINC000583787825 357942611 /nfs/dbraw/zinc/94/26/11/357942611.db2.gz XGAFYJGFVPTRGV-CYBMUJFWSA-N 1 2 240.310 2.209 20 0 BEADLO c1ccc([C@H]2CCC[N@@H+]2Cc2ncccn2)nc1 ZINC000583787825 357942615 /nfs/dbraw/zinc/94/26/15/357942615.db2.gz XGAFYJGFVPTRGV-CYBMUJFWSA-N 1 2 240.310 2.209 20 0 BEADLO Cc1n[nH]cc1C[N@@H+](C)[C@H](C)c1cnc(C)cn1 ZINC000639970993 358023864 /nfs/dbraw/zinc/02/38/64/358023864.db2.gz MKNJORNUGQFMRQ-LLVKDONJSA-N 1 2 245.330 2.010 20 0 BEADLO Cc1n[nH]cc1C[N@H+](C)[C@H](C)c1cnc(C)cn1 ZINC000639970993 358023866 /nfs/dbraw/zinc/02/38/66/358023866.db2.gz MKNJORNUGQFMRQ-LLVKDONJSA-N 1 2 245.330 2.010 20 0 BEADLO CC[C@H]1c2ccsc2CC[N@H+]1CC(=O)OC ZINC000053139673 358104365 /nfs/dbraw/zinc/10/43/65/358104365.db2.gz DQTAQXYPPAGPTH-JTQLQIEISA-N 1 2 239.340 2.230 20 0 BEADLO CC[C@H]1c2ccsc2CC[N@@H+]1CC(=O)OC ZINC000053139673 358104369 /nfs/dbraw/zinc/10/43/69/358104369.db2.gz DQTAQXYPPAGPTH-JTQLQIEISA-N 1 2 239.340 2.230 20 0 BEADLO CC(C)n1ccnc1C[N@H+](C)C[C@@H]1CCCO1 ZINC000171145203 134257031 /nfs/dbraw/zinc/25/70/31/134257031.db2.gz YGOSKIHTQHCQOP-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccnc1C[N@@H+](C)C[C@@H]1CCCO1 ZINC000171145203 134257032 /nfs/dbraw/zinc/25/70/32/134257032.db2.gz YGOSKIHTQHCQOP-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO CCOc1cccc(Cl)c1C[N@H+](C)CCO ZINC000584728887 358167202 /nfs/dbraw/zinc/16/72/02/358167202.db2.gz ZWWJGMTUPRFWIH-UHFFFAOYSA-N 1 2 243.734 2.163 20 0 BEADLO CCOc1cccc(Cl)c1C[N@@H+](C)CCO ZINC000584728887 358167204 /nfs/dbraw/zinc/16/72/04/358167204.db2.gz ZWWJGMTUPRFWIH-UHFFFAOYSA-N 1 2 243.734 2.163 20 0 BEADLO COc1cc2cc[nH+]cc2cc1OC[C@H](C)O ZINC000584767469 358171356 /nfs/dbraw/zinc/17/13/56/358171356.db2.gz YGSDPAXFLTUMHS-VIFPVBQESA-N 1 2 233.267 2.003 20 0 BEADLO CC1(F)CC[NH+](Cc2nc(C(F)F)no2)CC1 ZINC000640073480 358171796 /nfs/dbraw/zinc/17/17/96/358171796.db2.gz NTUPWXDXOFAEQA-UHFFFAOYSA-N 1 2 249.236 2.331 20 0 BEADLO Cc1ncc(C[N@@H+]2CCc3c(O)cccc3C2)o1 ZINC000628464428 358180001 /nfs/dbraw/zinc/18/00/01/358180001.db2.gz VXUXGUONUHGONN-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO Cc1ncc(C[N@H+]2CCc3c(O)cccc3C2)o1 ZINC000628464428 358180005 /nfs/dbraw/zinc/18/00/05/358180005.db2.gz VXUXGUONUHGONN-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO Cn1ccnc1C[N@H+](C)CC1=CCCCC1 ZINC000450629151 202218336 /nfs/dbraw/zinc/21/83/36/202218336.db2.gz PDGIIQSQTGLFSX-UHFFFAOYSA-N 1 2 219.332 2.352 20 0 BEADLO Cn1ccnc1C[N@@H+](C)CC1=CCCCC1 ZINC000450629151 202218338 /nfs/dbraw/zinc/21/83/38/202218338.db2.gz PDGIIQSQTGLFSX-UHFFFAOYSA-N 1 2 219.332 2.352 20 0 BEADLO C[C@@H](CC(=O)N1CC[C@@H](C)[C@H]1C)n1cc[nH+]c1 ZINC000584842643 358199703 /nfs/dbraw/zinc/19/97/03/358199703.db2.gz BKFHGWOMZFEMQP-GRYCIOLGSA-N 1 2 235.331 2.091 20 0 BEADLO Cc1c[nH+]ccc1CCN1CCCCCO1 ZINC000640123991 358203508 /nfs/dbraw/zinc/20/35/08/358203508.db2.gz IDQIQGPSLQUHLN-UHFFFAOYSA-N 1 2 220.316 2.350 20 0 BEADLO Cc1cc(C)nc(Nc2ccc(N(C)C)[nH+]c2)n1 ZINC000040060560 358232567 /nfs/dbraw/zinc/23/25/67/358232567.db2.gz HFFBEFZQOZJTPO-UHFFFAOYSA-N 1 2 243.314 2.298 20 0 BEADLO Cc1cc(NCc2cc[nH]n2)nc(C(C)C)[nH+]1 ZINC000040444285 358236704 /nfs/dbraw/zinc/23/67/04/358236704.db2.gz LTDNIRZVHUBXIN-UHFFFAOYSA-N 1 2 231.303 2.244 20 0 BEADLO Cc1nc(NC[C@H]2CCO[C@H](C(C)C)C2)cc[nH+]1 ZINC000450733837 202248534 /nfs/dbraw/zinc/24/85/34/202248534.db2.gz ANLFJWBCXMLOMR-STQMWFEESA-N 1 2 249.358 2.070 20 0 BEADLO CCO[C@H]1CCN(c2cc(C)[nH+]cn2)C[C@@H]1C ZINC000450744261 202252634 /nfs/dbraw/zinc/25/26/34/202252634.db2.gz LROKVGXZCQJKNS-JQWIXIFHSA-N 1 2 235.331 2.036 20 0 BEADLO CCO[C@@H]1CCN(c2cc(C)[nH+]cn2)C[C@H]1C ZINC000450744263 202254054 /nfs/dbraw/zinc/25/40/54/202254054.db2.gz LROKVGXZCQJKNS-ZYHUDNBSSA-N 1 2 235.331 2.036 20 0 BEADLO CO[C@H]1CCN(c2nc(C)[nH+]c(C)c2C)C[C@@H]1C ZINC000450756599 202256180 /nfs/dbraw/zinc/25/61/80/202256180.db2.gz KKJUMTHABCNFBY-ZANVPECISA-N 1 2 249.358 2.263 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CCCC1(C)C)c1[nH]cc[nH+]1 ZINC000226628535 358342462 /nfs/dbraw/zinc/34/24/62/358342462.db2.gz JBVMRTAAVCVKCC-ZJUUUORDSA-N 1 2 235.331 2.413 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CCCC1(C)C)c1[nH]cc[nH+]1 ZINC000226628548 358342705 /nfs/dbraw/zinc/34/27/05/358342705.db2.gz JBVMRTAAVCVKCC-NXEZZACHSA-N 1 2 235.331 2.413 20 0 BEADLO C[C@H]([NH2+]Cc1ccncc1)c1cscn1 ZINC000229111443 358345234 /nfs/dbraw/zinc/34/52/34/358345234.db2.gz SETJCDNURDNGNL-VIFPVBQESA-N 1 2 219.313 2.389 20 0 BEADLO CCc1ncc(C[NH2+]Cc2cc(C)on2)s1 ZINC000044693281 358392417 /nfs/dbraw/zinc/39/24/17/358392417.db2.gz LBDVXLDBRLBTNY-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO C[C@H]([NH2+]Cc1cc(C#N)cs1)C(F)F ZINC000389923497 358431242 /nfs/dbraw/zinc/43/12/42/358431242.db2.gz ACZGRZZNYUVDNH-LURJTMIESA-N 1 2 216.256 2.363 20 0 BEADLO Cc1nc(C[NH2+]CC2(F)CC2)cs1 ZINC000308302726 491135562 /nfs/dbraw/zinc/13/55/62/491135562.db2.gz LVECYZPSASTOBW-UHFFFAOYSA-N 1 2 200.282 2.043 20 0 BEADLO C[N@H+](CCO)Cc1csc(-c2ccccc2)n1 ZINC000049634171 358696755 /nfs/dbraw/zinc/69/67/55/358696755.db2.gz YZTLLZLCPIIGLO-UHFFFAOYSA-N 1 2 248.351 2.234 20 0 BEADLO C[N@@H+](CCO)Cc1csc(-c2ccccc2)n1 ZINC000049634171 358696758 /nfs/dbraw/zinc/69/67/58/358696758.db2.gz YZTLLZLCPIIGLO-UHFFFAOYSA-N 1 2 248.351 2.234 20 0 BEADLO Cc1cccc(F)c1NC(=O)NCc1[nH]cc[nH+]1 ZINC000133664420 358762284 /nfs/dbraw/zinc/76/22/84/358762284.db2.gz SZRVEAJLJQJKDW-UHFFFAOYSA-N 1 2 248.261 2.179 20 0 BEADLO CC(C)c1nc(N2CCO[C@H](C)[C@@H]2C)cc[nH+]1 ZINC000132251170 358714188 /nfs/dbraw/zinc/71/41/88/358714188.db2.gz VXMFFCPLJBKRKH-WDEREUQCSA-N 1 2 235.331 2.214 20 0 BEADLO CC(=O)c1ccc(OCc2c[nH+]cn2C)c(F)c1 ZINC000134956384 358812375 /nfs/dbraw/zinc/81/23/75/358812375.db2.gz QVIKEIXRSFVBKB-UHFFFAOYSA-N 1 2 248.257 2.341 20 0 BEADLO CC(C)[N@H+](Cc1nc(C2CC2)nn1C)C1CC1 ZINC000578234896 366465781 /nfs/dbraw/zinc/46/57/81/366465781.db2.gz ZPRXNDSEJNBMAN-UHFFFAOYSA-N 1 2 234.347 2.065 20 0 BEADLO CC(C)[N@@H+](Cc1nc(C2CC2)nn1C)C1CC1 ZINC000578234896 366465785 /nfs/dbraw/zinc/46/57/85/366465785.db2.gz ZPRXNDSEJNBMAN-UHFFFAOYSA-N 1 2 234.347 2.065 20 0 BEADLO CCc1nc(C[N@H+]2CCCC[C@@H]2CC)no1 ZINC000054316294 358858290 /nfs/dbraw/zinc/85/82/90/358858290.db2.gz HFBVSOHWVLROBW-JTQLQIEISA-N 1 2 223.320 2.397 20 0 BEADLO CCc1nc(C[N@@H+]2CCCC[C@@H]2CC)no1 ZINC000054316294 358858293 /nfs/dbraw/zinc/85/82/93/358858293.db2.gz HFBVSOHWVLROBW-JTQLQIEISA-N 1 2 223.320 2.397 20 0 BEADLO CC[C@@]1(C)C[C@@H]1C(=O)Nc1cc[nH+]cc1O ZINC000136791159 358885355 /nfs/dbraw/zinc/88/53/55/358885355.db2.gz KJLNRUJCHPGYQT-PELKAZGASA-N 1 2 220.272 2.162 20 0 BEADLO CC[C@@]1(C)C[C@H]1C(=O)Nc1cc[nH+]cc1O ZINC000136791255 358886046 /nfs/dbraw/zinc/88/60/46/358886046.db2.gz KJLNRUJCHPGYQT-UFBFGSQYSA-N 1 2 220.272 2.162 20 0 BEADLO C[C@H](Cc1nc([C@@H]2C[C@H]2C)no1)n1cc[nH+]c1 ZINC000351425886 366526466 /nfs/dbraw/zinc/52/64/66/366526466.db2.gz PGLQJEXHSPQWHN-OPRDCNLKSA-N 1 2 232.287 2.193 20 0 BEADLO CC[C@H]1CN(c2nc(C)[nH+]c(C)c2C)CCO1 ZINC000177809701 134300291 /nfs/dbraw/zinc/30/02/91/134300291.db2.gz XUHACKGLKWWDCA-LBPRGKRZSA-N 1 2 235.331 2.017 20 0 BEADLO C(C[C@H]1CCOC1)C[N@@H+]1OC2CCC1CC2 ZINC000640232893 358957504 /nfs/dbraw/zinc/95/75/04/358957504.db2.gz ZKOIDAJECRHUTQ-HIFPTAJRSA-N 1 2 225.332 2.362 20 0 BEADLO C(C[C@H]1CCOC1)C[N@H+]1OC2CCC1CC2 ZINC000640232893 358957507 /nfs/dbraw/zinc/95/75/07/358957507.db2.gz ZKOIDAJECRHUTQ-HIFPTAJRSA-N 1 2 225.332 2.362 20 0 BEADLO C[C@H](C[C@H]1CCOC1)Nc1cccc[nH+]1 ZINC000308844344 491138769 /nfs/dbraw/zinc/13/87/69/491138769.db2.gz LMLXGKGLOHSKBH-GHMZBOCLSA-N 1 2 206.289 2.309 20 0 BEADLO Cc1[nH]ncc1C[NH2+]Cc1cccc2[nH]ccc21 ZINC000070939416 359065943 /nfs/dbraw/zinc/06/59/43/359065943.db2.gz MFYIFTXODRDKHG-UHFFFAOYSA-N 1 2 240.310 2.489 20 0 BEADLO Cc1cc[nH+]cc1NCc1cscn1 ZINC000070958605 359067529 /nfs/dbraw/zinc/06/75/29/359067529.db2.gz AOUBMRFPIRZFGF-UHFFFAOYSA-N 1 2 205.286 2.459 20 0 BEADLO C[C@@H](CC(=O)N(C)Cc1[nH]cc[nH+]1)C(C)(C)C ZINC000070980372 359068585 /nfs/dbraw/zinc/06/85/85/359068585.db2.gz LOQHCJHYSWUDDL-JTQLQIEISA-N 1 2 237.347 2.440 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)C1CCCCCC1 ZINC000070980594 359069007 /nfs/dbraw/zinc/06/90/07/359069007.db2.gz RKGCSYDGWFLLAF-UHFFFAOYSA-N 1 2 235.331 2.339 20 0 BEADLO Cc1cc(NC[C@H](O)C2CC2)nc(C(C)C)[nH+]1 ZINC000071306127 359077025 /nfs/dbraw/zinc/07/70/25/359077025.db2.gz HLCJWZIWZNRFID-NSHDSACASA-N 1 2 235.331 2.091 20 0 BEADLO Cc1cc(C[N@H+]2CCOC[C@H]2CC(C)C)no1 ZINC000072979002 359093805 /nfs/dbraw/zinc/09/38/05/359093805.db2.gz PZJFFMKUGXBXJD-CYBMUJFWSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC[C@H]2CC(C)C)no1 ZINC000072979002 359093809 /nfs/dbraw/zinc/09/38/09/359093809.db2.gz PZJFFMKUGXBXJD-CYBMUJFWSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cc(C[N@H+]2CCOC[C@@H]2CC(C)C)no1 ZINC000072979000 359094339 /nfs/dbraw/zinc/09/43/39/359094339.db2.gz PZJFFMKUGXBXJD-ZDUSSCGKSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC[C@@H]2CC(C)C)no1 ZINC000072979000 359094342 /nfs/dbraw/zinc/09/43/42/359094342.db2.gz PZJFFMKUGXBXJD-ZDUSSCGKSA-N 1 2 238.331 2.230 20 0 BEADLO CCN(C(=O)Cn1cc[nH+]c1)C1CCCCC1 ZINC000073180366 359098092 /nfs/dbraw/zinc/09/80/92/359098092.db2.gz WHQLOUIIPXESIF-UHFFFAOYSA-N 1 2 235.331 2.064 20 0 BEADLO Oc1ccc(Br)c(C[NH+]2CCC2)c1 ZINC000306202538 359292640 /nfs/dbraw/zinc/29/26/40/359292640.db2.gz WMBHUJVGLOJLFW-UHFFFAOYSA-N 1 2 242.116 2.360 20 0 BEADLO COC(=O)C(C)(C)[C@H]1CCC[N@H+](CC(F)F)C1 ZINC000611321179 359312454 /nfs/dbraw/zinc/31/24/54/359312454.db2.gz IGNBQBURGYVCJP-VIFPVBQESA-N 1 2 249.301 2.163 20 0 BEADLO COC(=O)C(C)(C)[C@H]1CCC[N@@H+](CC(F)F)C1 ZINC000611321179 359312456 /nfs/dbraw/zinc/31/24/56/359312456.db2.gz IGNBQBURGYVCJP-VIFPVBQESA-N 1 2 249.301 2.163 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CC(Cc2cccs2)C1 ZINC000628478977 359313572 /nfs/dbraw/zinc/31/35/72/359313572.db2.gz VVKTYTBLWZCGTO-UHFFFAOYSA-N 1 2 247.367 2.454 20 0 BEADLO CCCC[C@H](C(=O)OC)[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000611501614 359384048 /nfs/dbraw/zinc/38/40/48/359384048.db2.gz FUDQYADZTHFAME-IJLUTSLNSA-N 1 2 245.338 2.398 20 0 BEADLO CCCC[C@H](C(=O)OC)[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000611501614 359384052 /nfs/dbraw/zinc/38/40/52/359384052.db2.gz FUDQYADZTHFAME-IJLUTSLNSA-N 1 2 245.338 2.398 20 0 BEADLO CCC[C@H](C(=O)OCC)[N@@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000611502514 359385051 /nfs/dbraw/zinc/38/50/51/359385051.db2.gz UVMKMIBCAAYLFJ-SDDRHHMPSA-N 1 2 245.338 2.398 20 0 BEADLO CCC[C@H](C(=O)OCC)[N@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000611502514 359385053 /nfs/dbraw/zinc/38/50/53/359385053.db2.gz UVMKMIBCAAYLFJ-SDDRHHMPSA-N 1 2 245.338 2.398 20 0 BEADLO CCC[C@H](C(=O)OCC)[N@@H+]1CC[C@H](C)[C@H](F)C1 ZINC000611502513 359385426 /nfs/dbraw/zinc/38/54/26/359385426.db2.gz UVMKMIBCAAYLFJ-QJPTWQEYSA-N 1 2 245.338 2.398 20 0 BEADLO CCC[C@H](C(=O)OCC)[N@H+]1CC[C@H](C)[C@H](F)C1 ZINC000611502513 359385427 /nfs/dbraw/zinc/38/54/27/359385427.db2.gz UVMKMIBCAAYLFJ-QJPTWQEYSA-N 1 2 245.338 2.398 20 0 BEADLO CC(C)Cc1noc(C[NH+]2[C@@H](C)C[C@@H]2C)n1 ZINC000548754313 325479341 /nfs/dbraw/zinc/47/93/41/325479341.db2.gz TVRNLKUAXKOQHB-UWVGGRQHSA-N 1 2 223.320 2.251 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)Nc1ncc(Cl)s1 ZINC000308984210 491141861 /nfs/dbraw/zinc/14/18/61/491141861.db2.gz JDRGGJQELRIWIC-SSDOTTSWSA-N 1 2 242.735 2.494 20 0 BEADLO Nc1[nH+]cnc(N[C@H]2CC[C@@H](F)C2)c1Cl ZINC000308997159 491142103 /nfs/dbraw/zinc/14/21/03/491142103.db2.gz MXEIQOBTCRFODX-RITPCOANSA-N 1 2 230.674 2.015 20 0 BEADLO Nc1nc[nH+]c(N[C@H]2CC[C@@H](F)C2)c1Cl ZINC000308997159 491142104 /nfs/dbraw/zinc/14/21/04/491142104.db2.gz MXEIQOBTCRFODX-RITPCOANSA-N 1 2 230.674 2.015 20 0 BEADLO Cc1c[nH+]cc(N[C@H](C)[C@@H]2CCCO2)c1 ZINC000309036266 491143020 /nfs/dbraw/zinc/14/30/20/491143020.db2.gz GFYYGDACCRSVQS-PWSUYJOCSA-N 1 2 206.289 2.369 20 0 BEADLO CC(C)[C@@H]1C[C@H]1CNc1cc[nH+]c(C2CC2)n1 ZINC000450809110 202272675 /nfs/dbraw/zinc/27/26/75/202272675.db2.gz JISWSJAGDLSAHO-RYUDHWBXSA-N 1 2 231.343 2.480 20 0 BEADLO CC(C)[C@@H]1C[C@H]1CNc1[nH+]cnc2c1cnn2C ZINC000450806749 202272749 /nfs/dbraw/zinc/27/27/49/202272749.db2.gz FSPKXJZPZYAVGA-UWVGGRQHSA-N 1 2 245.330 2.067 20 0 BEADLO C[C@@H]1C[C@@H](Nc2ncncc2Cl)c2[nH+]ccn21 ZINC000450833882 202281967 /nfs/dbraw/zinc/28/19/67/202281967.db2.gz UFNSMQORIBRMFP-VXNVDRBHSA-N 1 2 249.705 2.444 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)Nc1nccc(C)n1 ZINC000450835173 202284066 /nfs/dbraw/zinc/28/40/66/202284066.db2.gz WMJZQIMQQCGFGA-SNVBAGLBSA-N 1 2 231.303 2.175 20 0 BEADLO Cc1nnc(C(=O)Nc2ccc(C)[nH+]c2C)s1 ZINC000612225711 359740677 /nfs/dbraw/zinc/74/06/77/359740677.db2.gz BGFSYAWTLAXULU-UHFFFAOYSA-N 1 2 248.311 2.111 20 0 BEADLO CCc1ccc(C[NH2+]Cc2cocn2)o1 ZINC000309062897 491143859 /nfs/dbraw/zinc/14/38/59/491143859.db2.gz XSMMXSWYGWLNRF-UHFFFAOYSA-N 1 2 206.245 2.120 20 0 BEADLO CO[C@@]1(C)CCC[N@@H+]([C@@H](C)c2csnn2)C1 ZINC000450885391 202297799 /nfs/dbraw/zinc/29/77/99/202297799.db2.gz BOBWJZNNJVFIFT-ONGXEEELSA-N 1 2 241.360 2.100 20 0 BEADLO CO[C@@]1(C)CCC[N@H+]([C@@H](C)c2csnn2)C1 ZINC000450885391 202297803 /nfs/dbraw/zinc/29/78/03/202297803.db2.gz BOBWJZNNJVFIFT-ONGXEEELSA-N 1 2 241.360 2.100 20 0 BEADLO CSc1ccccc1[C@H](C)[NH2+]Cc1cnn[nH]1 ZINC000450913057 202308158 /nfs/dbraw/zinc/30/81/58/202308158.db2.gz UKLWLXLWTVDROB-VIFPVBQESA-N 1 2 248.355 2.377 20 0 BEADLO CC[C@H]1C[N@@H+]([C@H](C)c2csnn2)CCCO1 ZINC000450902506 202302978 /nfs/dbraw/zinc/30/29/78/202302978.db2.gz KYBYQVVPYRHTAF-ZJUUUORDSA-N 1 2 241.360 2.100 20 0 BEADLO CC[C@H]1C[N@H+]([C@H](C)c2csnn2)CCCO1 ZINC000450902506 202302981 /nfs/dbraw/zinc/30/29/81/202302981.db2.gz KYBYQVVPYRHTAF-ZJUUUORDSA-N 1 2 241.360 2.100 20 0 BEADLO CC(C)[NH+](CCSCc1cnn[nH]1)C(C)C ZINC000450902790 202303331 /nfs/dbraw/zinc/30/33/31/202303331.db2.gz KYCLXHZEPFNJNR-UHFFFAOYSA-N 1 2 242.392 2.157 20 0 BEADLO CO[C@H]1C[C@@H](N(C)c2cc(C)[nH+]cn2)C12CCC2 ZINC000450861316 202292873 /nfs/dbraw/zinc/29/28/73/202292873.db2.gz PMULZQNXCCNUGS-NEPJUHHUSA-N 1 2 247.342 2.179 20 0 BEADLO Cc1[nH+]cccc1N[C@H](C)[C@@H]1CCCO1 ZINC000309091973 491144707 /nfs/dbraw/zinc/14/47/07/491144707.db2.gz FBIJIUMROZIPPX-PWSUYJOCSA-N 1 2 206.289 2.369 20 0 BEADLO COc1ccnc(C[NH2+][C@H](C)c2ccsc2)n1 ZINC000450942035 202317730 /nfs/dbraw/zinc/31/77/30/202317730.db2.gz QUFMMIPTWFIYNV-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO C[C@@H](NC(=O)[C@@H](C)c1ccsc1)c1[nH]cc[nH+]1 ZINC000578452595 366573556 /nfs/dbraw/zinc/57/35/56/366573556.db2.gz OHJKFDVXBKWQEG-DTWKUNHWSA-N 1 2 249.339 2.452 20 0 BEADLO CC(C)(C)C(C)(C)NC(=O)C[NH+]1CC(C)(C)C1 ZINC000578521398 366589266 /nfs/dbraw/zinc/58/92/66/366589266.db2.gz UNLVXXSECPXUIN-UHFFFAOYSA-N 1 2 240.391 2.269 20 0 BEADLO CC[C@@H]1CC[N@@H+]1Cc1nnc(C2CC2)s1 ZINC000451066562 202342223 /nfs/dbraw/zinc/34/22/23/202342223.db2.gz NFYVTNMZPUBVDZ-SECBINFHSA-N 1 2 223.345 2.400 20 0 BEADLO CC[C@@H]1CC[N@H+]1Cc1nnc(C2CC2)s1 ZINC000451066562 202342226 /nfs/dbraw/zinc/34/22/26/202342226.db2.gz NFYVTNMZPUBVDZ-SECBINFHSA-N 1 2 223.345 2.400 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[N@@H+]1CC[C@@H](F)C1 ZINC000451194920 202375841 /nfs/dbraw/zinc/37/58/41/202375841.db2.gz LAQGZIAXMYRWIH-GHMZBOCLSA-N 1 2 231.311 2.008 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[N@H+]1CC[C@@H](F)C1 ZINC000451194920 202375845 /nfs/dbraw/zinc/37/58/45/202375845.db2.gz LAQGZIAXMYRWIH-GHMZBOCLSA-N 1 2 231.311 2.008 20 0 BEADLO COC(=O)c1ccc([C@H](C)[N@@H+]2CC[C@H](F)C2)o1 ZINC000451192886 202376372 /nfs/dbraw/zinc/37/63/72/202376372.db2.gz UGCDPXULJZNGAC-IUCAKERBSA-N 1 2 241.262 2.171 20 0 BEADLO COC(=O)c1ccc([C@H](C)[N@H+]2CC[C@H](F)C2)o1 ZINC000451192886 202376373 /nfs/dbraw/zinc/37/63/73/202376373.db2.gz UGCDPXULJZNGAC-IUCAKERBSA-N 1 2 241.262 2.171 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)[C@@H]1CCC1(C)C ZINC000612583237 359896211 /nfs/dbraw/zinc/89/62/11/359896211.db2.gz ZCXAYQOUSNVAPS-LBPRGKRZSA-N 1 2 249.358 2.168 20 0 BEADLO CC[N@H+](Cc1cccc(C(C)=O)c1)C1COC1 ZINC000451289074 202397867 /nfs/dbraw/zinc/39/78/67/202397867.db2.gz IWQRAEADMMCRCV-UHFFFAOYSA-N 1 2 233.311 2.110 20 0 BEADLO CC[N@@H+](Cc1cccc(C(C)=O)c1)C1COC1 ZINC000451289074 202397870 /nfs/dbraw/zinc/39/78/70/202397870.db2.gz IWQRAEADMMCRCV-UHFFFAOYSA-N 1 2 233.311 2.110 20 0 BEADLO CCn1cc[nH+]c1CNc1cn(C)nc1C1CC1 ZINC000578569395 366600456 /nfs/dbraw/zinc/60/04/56/366600456.db2.gz KLUUYLYUVIUHIF-UHFFFAOYSA-N 1 2 245.330 2.126 20 0 BEADLO c1csc([C@@H]([NH2+][C@@H]2CC23CC3)c2nnc[nH]2)c1 ZINC000578878852 366664744 /nfs/dbraw/zinc/66/47/44/366664744.db2.gz JCJWWEIMRMDQAH-NXEZZACHSA-N 1 2 246.339 2.098 20 0 BEADLO c1csc([C@H]([NH2+][C@@H]2CC23CC3)c2nnc[nH]2)c1 ZINC000578878855 366664858 /nfs/dbraw/zinc/66/48/58/366664858.db2.gz JCJWWEIMRMDQAH-ZJUUUORDSA-N 1 2 246.339 2.098 20 0 BEADLO CCn1ncnc1C[NH2+][C@@H](C)c1ccc(F)cc1 ZINC000088590510 359969387 /nfs/dbraw/zinc/96/93/87/359969387.db2.gz UVJHLICPLXYDFM-JTQLQIEISA-N 1 2 248.305 2.288 20 0 BEADLO CCn1ncnc1C[NH2+][C@@H](C)c1cccc(F)c1 ZINC000088590637 359969462 /nfs/dbraw/zinc/96/94/62/359969462.db2.gz YKGRYVSZXFVVMY-JTQLQIEISA-N 1 2 248.305 2.288 20 0 BEADLO Cc1cc(NC[C@@H]2CCC[C@@H]2O)nc(C(C)C)[nH+]1 ZINC000089166507 359996858 /nfs/dbraw/zinc/99/68/58/359996858.db2.gz MVSXXVDTURAOBN-RYUDHWBXSA-N 1 2 249.358 2.481 20 0 BEADLO CC(C)C[C@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000612840662 360102336 /nfs/dbraw/zinc/10/23/36/360102336.db2.gz REDJPCQWFXXNQZ-QJPTWQEYSA-N 1 2 249.358 2.074 20 0 BEADLO Cc1noc(C)c1CSCCn1cc[nH+]c1 ZINC000090199273 360063324 /nfs/dbraw/zinc/06/33/24/360063324.db2.gz PBWCNZZGJZWPND-UHFFFAOYSA-N 1 2 237.328 2.421 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)N[C@@H](c1[nH+]ccn1C)C1CC1 ZINC000451679073 202458870 /nfs/dbraw/zinc/45/88/70/202458870.db2.gz GHYRXRWRDSGBLQ-YUSALJHKSA-N 1 2 247.342 2.034 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1ccc(COC)o1 ZINC000091980186 360139348 /nfs/dbraw/zinc/13/93/48/360139348.db2.gz COKCQOMKRAGQAM-NSHDSACASA-N 1 2 239.315 2.037 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1ccc(COC)o1 ZINC000091980186 360139352 /nfs/dbraw/zinc/13/93/52/360139352.db2.gz COKCQOMKRAGQAM-NSHDSACASA-N 1 2 239.315 2.037 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1cccc2c1OCO2 ZINC000091980573 360140238 /nfs/dbraw/zinc/14/02/38/360140238.db2.gz OAGBJPJHOPHCKI-LBPRGKRZSA-N 1 2 249.310 2.026 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1cccc2c1OCO2 ZINC000091980573 360140242 /nfs/dbraw/zinc/14/02/42/360140242.db2.gz OAGBJPJHOPHCKI-LBPRGKRZSA-N 1 2 249.310 2.026 20 0 BEADLO CCc1ccc(C[N@@H+]2CCOC(C)(C)C2)o1 ZINC000091917555 360136590 /nfs/dbraw/zinc/13/65/90/360136590.db2.gz HGLZBOFWPRJAFH-UHFFFAOYSA-N 1 2 223.316 2.453 20 0 BEADLO CCc1ccc(C[N@H+]2CCOC(C)(C)C2)o1 ZINC000091917555 360136592 /nfs/dbraw/zinc/13/65/92/360136592.db2.gz HGLZBOFWPRJAFH-UHFFFAOYSA-N 1 2 223.316 2.453 20 0 BEADLO CC(C)(C)OC1CC[NH+](Cc2cnc[nH]2)CC1 ZINC000092454190 360173402 /nfs/dbraw/zinc/17/34/02/360173402.db2.gz RUSOHADEVUHBEQ-UHFFFAOYSA-N 1 2 237.347 2.189 20 0 BEADLO Cc1[nH]ncc1C[NH+]1C[C@H](C)S[C@@H](C)C1 ZINC000092541420 360179057 /nfs/dbraw/zinc/17/90/57/360179057.db2.gz CCOJYJCGXUCQEU-IUCAKERBSA-N 1 2 225.361 2.044 20 0 BEADLO c1c[nH+]c(CNc2ccc3c(c2)COC3)[nH]1 ZINC000092855019 360204275 /nfs/dbraw/zinc/20/42/75/360204275.db2.gz IAHKTBOVBNNMOG-UHFFFAOYSA-N 1 2 215.256 2.052 20 0 BEADLO Cc1[nH+]c2ccccc2n1CCC(=O)NC(C)C ZINC000094165873 360297428 /nfs/dbraw/zinc/29/74/28/360297428.db2.gz WODMKVYAXCKGID-UHFFFAOYSA-N 1 2 245.326 2.259 20 0 BEADLO c1cc(C[N@@H+]2CCOC3(C2)CCCCCC3)n[nH]1 ZINC000093769265 360274676 /nfs/dbraw/zinc/27/46/76/360274676.db2.gz HGQKRIVGJBNZAP-UHFFFAOYSA-N 1 2 249.358 2.335 20 0 BEADLO c1cc(C[N@H+]2CCOC3(C2)CCCCCC3)n[nH]1 ZINC000093769265 360274679 /nfs/dbraw/zinc/27/46/79/360274679.db2.gz HGQKRIVGJBNZAP-UHFFFAOYSA-N 1 2 249.358 2.335 20 0 BEADLO Cc1[nH+]cccc1NCc1ncnn1C(C)C ZINC000631098473 360338078 /nfs/dbraw/zinc/33/80/78/360338078.db2.gz PSUAGNPLOGTJOB-UHFFFAOYSA-N 1 2 231.303 2.175 20 0 BEADLO CC(=O)N1CCC(Nc2ccc(C)[nH+]c2C)CC1 ZINC000094664087 360314103 /nfs/dbraw/zinc/31/41/03/360314103.db2.gz IWGDRMRYJTVJTB-UHFFFAOYSA-N 1 2 247.342 2.121 20 0 BEADLO FC1(F)CC[N@@H+]([C@@H]2CCCSC2)C1 ZINC000306533554 360394405 /nfs/dbraw/zinc/39/44/05/360394405.db2.gz KHOKPSOYBLKGAU-MRVPVSSYSA-N 1 2 207.289 2.223 20 0 BEADLO FC1(F)CC[N@H+]([C@@H]2CCCSC2)C1 ZINC000306533554 360394408 /nfs/dbraw/zinc/39/44/08/360394408.db2.gz KHOKPSOYBLKGAU-MRVPVSSYSA-N 1 2 207.289 2.223 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCO[C@H]2CCC[C@@H]21 ZINC000054343988 360502180 /nfs/dbraw/zinc/50/21/80/360502180.db2.gz QDBBMLGYDIKLAI-STQMWFEESA-N 1 2 236.315 2.045 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCO[C@H]2CCC[C@@H]21 ZINC000054343988 360502185 /nfs/dbraw/zinc/50/21/85/360502185.db2.gz QDBBMLGYDIKLAI-STQMWFEESA-N 1 2 236.315 2.045 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCO[C@@H]2CCC[C@@H]21 ZINC000054343991 360502218 /nfs/dbraw/zinc/50/22/18/360502218.db2.gz QDBBMLGYDIKLAI-QWHCGFSZSA-N 1 2 236.315 2.045 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCO[C@@H]2CCC[C@@H]21 ZINC000054343991 360502223 /nfs/dbraw/zinc/50/22/23/360502223.db2.gz QDBBMLGYDIKLAI-QWHCGFSZSA-N 1 2 236.315 2.045 20 0 BEADLO Cc1nc(C[NH2+]CC(C)(C)F)cs1 ZINC000631191458 360556680 /nfs/dbraw/zinc/55/66/80/360556680.db2.gz QCLKSNSTAZTIME-UHFFFAOYSA-N 1 2 202.298 2.289 20 0 BEADLO O=C(c1ccc2[nH+]ccn2c1)N(C1CC1)C1CC1 ZINC000628815995 360669072 /nfs/dbraw/zinc/66/90/72/360669072.db2.gz LEBGBAFQVURFGU-UHFFFAOYSA-N 1 2 241.294 2.101 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2ncnn2C)c(F)c1 ZINC000631120330 360741163 /nfs/dbraw/zinc/74/11/63/360741163.db2.gz ITVRGQZIFZLEEI-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO C[C@H](O)[C@@H]1CCN(c2cc3ccccc3c[nH+]2)C1 ZINC000631200447 360789367 /nfs/dbraw/zinc/78/93/67/360789367.db2.gz HERNHJIYGPAXGJ-SMDDNHRTSA-N 1 2 242.322 2.442 20 0 BEADLO C/C=C\CNC(=O)Cn1c(C)[nH+]c2ccccc21 ZINC000629038632 360828088 /nfs/dbraw/zinc/82/80/88/360828088.db2.gz QDRWYNCCKGZSIU-ARJAWSKDSA-N 1 2 243.310 2.037 20 0 BEADLO CC[C@H]1C[C@H](Nc2c[nH+]cc(N(C)C)c2)CO1 ZINC000631203728 360910736 /nfs/dbraw/zinc/91/07/36/360910736.db2.gz TUFVMMIMDIJRKI-AAEUAGOBSA-N 1 2 235.331 2.127 20 0 BEADLO CO[C@@H]1C[C@H](N(C)c2cc(C)[nH+]cn2)C12CCC2 ZINC000450861317 219878487 /nfs/dbraw/zinc/87/84/87/219878487.db2.gz PMULZQNXCCNUGS-NWDGAFQWSA-N 1 2 247.342 2.179 20 0 BEADLO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1ccno1 ZINC000309659515 491153878 /nfs/dbraw/zinc/15/38/78/491153878.db2.gz APDUTHKSHXGBTO-SSDOTTSWSA-N 1 2 221.260 2.130 20 0 BEADLO CCCCCn1ncc2c1nc[nH+]c2NC ZINC000194419424 361238899 /nfs/dbraw/zinc/23/88/99/361238899.db2.gz AFTUPIMASOOFLT-UHFFFAOYSA-N 1 2 219.292 2.058 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+](C)Cc2cccnc2)cn1 ZINC000428288786 201004943 /nfs/dbraw/zinc/00/49/43/201004943.db2.gz SQRNJBPLMZXWLE-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+](C)Cc2cccnc2)cn1 ZINC000428288786 201004945 /nfs/dbraw/zinc/00/49/45/201004945.db2.gz SQRNJBPLMZXWLE-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO c1nc(C[NH2+]Cc2cc3ccccc3[nH]2)co1 ZINC000428874208 201048262 /nfs/dbraw/zinc/04/82/62/201048262.db2.gz MEAUKYOKHRRHOL-UHFFFAOYSA-N 1 2 227.267 2.446 20 0 BEADLO Cc1nc(N[C@@H]2Cc3cccc(O)c3C2)cc[nH+]1 ZINC000428675628 201035172 /nfs/dbraw/zinc/03/51/72/201035172.db2.gz MKGBTPTZQWFQHS-LLVKDONJSA-N 1 2 241.294 2.070 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)[C@H]1C[C@H]2C[C@H]2C1 ZINC000614277832 363768659 /nfs/dbraw/zinc/76/86/59/363768659.db2.gz XSYWJJLVFIPNRL-URLYPYJESA-N 1 2 241.294 2.319 20 0 BEADLO CCc1nnc(C[NH2+][C@@H](C)c2cc(C)oc2C)[nH]1 ZINC000162463421 361352405 /nfs/dbraw/zinc/35/24/05/361352405.db2.gz NYAMPQQCGXYWCZ-VIFPVBQESA-N 1 2 248.330 2.428 20 0 BEADLO CC(C)n1cnnc1C[N@@H+](C)CC[C@H](C)F ZINC000429271377 201085925 /nfs/dbraw/zinc/08/59/25/201085925.db2.gz AKTISYNGMPDJDW-JTQLQIEISA-N 1 2 228.315 2.039 20 0 BEADLO CC(C)n1cnnc1C[N@H+](C)CC[C@H](C)F ZINC000429271377 201085927 /nfs/dbraw/zinc/08/59/27/201085927.db2.gz AKTISYNGMPDJDW-JTQLQIEISA-N 1 2 228.315 2.039 20 0 BEADLO CC[C@H](F)C[N@H+](C)[C@@H](CC(C)C)C(=O)OC ZINC000429161849 201076164 /nfs/dbraw/zinc/07/61/64/201076164.db2.gz WNGXRCRQBYZTBU-QWRGUYRKSA-N 1 2 233.327 2.254 20 0 BEADLO CC[C@H](F)C[N@@H+](C)[C@@H](CC(C)C)C(=O)OC ZINC000429161849 201076166 /nfs/dbraw/zinc/07/61/66/201076166.db2.gz WNGXRCRQBYZTBU-QWRGUYRKSA-N 1 2 233.327 2.254 20 0 BEADLO CC(C)n1cnnc1C[N@@H+](C)CC[C@@H](C)F ZINC000429271379 201085748 /nfs/dbraw/zinc/08/57/48/201085748.db2.gz AKTISYNGMPDJDW-SNVBAGLBSA-N 1 2 228.315 2.039 20 0 BEADLO CC(C)n1cnnc1C[N@H+](C)CC[C@@H](C)F ZINC000429271379 201085752 /nfs/dbraw/zinc/08/57/52/201085752.db2.gz AKTISYNGMPDJDW-SNVBAGLBSA-N 1 2 228.315 2.039 20 0 BEADLO Cc1cc(C)c(C(=O)NC(C)(C)c2[nH]cc[nH+]2)o1 ZINC000579364746 366771106 /nfs/dbraw/zinc/77/11/06/366771106.db2.gz WISZEQASLLAEKJ-UHFFFAOYSA-N 1 2 247.298 2.285 20 0 BEADLO Cc1nsc(C)c1C[N@H+]1C[C@@H](C)OC[C@@H]1C ZINC000579430715 366782653 /nfs/dbraw/zinc/78/26/53/366782653.db2.gz YLCCDDJLEIXQTQ-DTWKUNHWSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nsc(C)c1C[N@@H+]1C[C@@H](C)OC[C@@H]1C ZINC000579430715 366782661 /nfs/dbraw/zinc/78/26/61/366782661.db2.gz YLCCDDJLEIXQTQ-DTWKUNHWSA-N 1 2 240.372 2.369 20 0 BEADLO CC(C)OC(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000181085905 366783779 /nfs/dbraw/zinc/78/37/79/366783779.db2.gz VNOLIBIKSSDMBV-UHFFFAOYSA-N 1 2 230.267 2.438 20 0 BEADLO Cn1c[nH+]cc1CNc1nc2ccccc2o1 ZINC000181503481 366816837 /nfs/dbraw/zinc/81/68/37/366816837.db2.gz VTSASVFXHNHMPT-UHFFFAOYSA-N 1 2 228.255 2.173 20 0 BEADLO CC(C)[C@@H](O)C[N@@H+]1CCCC[C@@H]1C(F)F ZINC000433189899 201166247 /nfs/dbraw/zinc/16/62/47/201166247.db2.gz TXLDWYMAPAYOHY-ZJUUUORDSA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)[C@@H](O)C[N@H+]1CCCC[C@@H]1C(F)F ZINC000433189899 201166251 /nfs/dbraw/zinc/16/62/51/201166251.db2.gz TXLDWYMAPAYOHY-ZJUUUORDSA-N 1 2 221.291 2.123 20 0 BEADLO CC[C@@H]1CC[N@@H+]1Cc1ncc(COC)s1 ZINC000430197602 201152148 /nfs/dbraw/zinc/15/21/48/201152148.db2.gz VPHFFLQRZOJSEV-SECBINFHSA-N 1 2 226.345 2.274 20 0 BEADLO CC[C@@H]1CC[N@H+]1Cc1ncc(COC)s1 ZINC000430197602 201152150 /nfs/dbraw/zinc/15/21/50/201152150.db2.gz VPHFFLQRZOJSEV-SECBINFHSA-N 1 2 226.345 2.274 20 0 BEADLO C[C@]12CCCC[C@H]1CN2C(=O)CCc1c[nH+]c[nH]1 ZINC000629619978 361510475 /nfs/dbraw/zinc/51/04/75/361510475.db2.gz XTMKTYSQSHXZGU-FZMZJTMJSA-N 1 2 247.342 2.133 20 0 BEADLO C[C@]12CCCC[C@H]1CN2C(=O)CCc1c[nH]c[nH+]1 ZINC000629619978 361510480 /nfs/dbraw/zinc/51/04/80/361510480.db2.gz XTMKTYSQSHXZGU-FZMZJTMJSA-N 1 2 247.342 2.133 20 0 BEADLO COCC[N@H+](C)Cc1nc(C)c2ccccc2n1 ZINC000614370692 363796063 /nfs/dbraw/zinc/79/60/63/363796063.db2.gz ZXTGATRUVNIURD-UHFFFAOYSA-N 1 2 245.326 2.016 20 0 BEADLO COCC[N@@H+](C)Cc1nc(C)c2ccccc2n1 ZINC000614370692 363796066 /nfs/dbraw/zinc/79/60/66/363796066.db2.gz ZXTGATRUVNIURD-UHFFFAOYSA-N 1 2 245.326 2.016 20 0 BEADLO CC[C@H](F)C[NH2+][C@@](C)(c1noc(C)n1)C1CC1 ZINC000433308383 201177978 /nfs/dbraw/zinc/17/79/78/201177978.db2.gz YAYNTILYFKIGNM-CMPLNLGQSA-N 1 2 241.310 2.341 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H](CO)CC(C)C)[nH+]1 ZINC000433795611 201194335 /nfs/dbraw/zinc/19/43/35/201194335.db2.gz YZYNFVSLADHYCV-SNVBAGLBSA-N 1 2 248.330 2.085 20 0 BEADLO Cc1nc2[nH]ccc2c(N(C)Cc2ccoc2)[nH+]1 ZINC000433773718 201194420 /nfs/dbraw/zinc/19/44/20/201194420.db2.gz KLIKBLGORCNYRO-UHFFFAOYSA-N 1 2 242.282 2.496 20 0 BEADLO CO[C@@H](C)CCNc1[nH+]c(C)nc2[nH]ccc21 ZINC000433792843 201194748 /nfs/dbraw/zinc/19/47/48/201194748.db2.gz KARNOKYUHQTJKC-QMMMGPOBSA-N 1 2 234.303 2.055 20 0 BEADLO CC(C)n1ncnc1C[N@H+](C)[C@H]1CC1(C)C ZINC000434507098 201223365 /nfs/dbraw/zinc/22/33/65/201223365.db2.gz GIYHCYBTFWTWFW-JTQLQIEISA-N 1 2 222.336 2.089 20 0 BEADLO CC(C)n1ncnc1C[N@@H+](C)[C@H]1CC1(C)C ZINC000434507098 201223366 /nfs/dbraw/zinc/22/33/66/201223366.db2.gz GIYHCYBTFWTWFW-JTQLQIEISA-N 1 2 222.336 2.089 20 0 BEADLO CNc1ccc(-c2ccc(OC)c(OC)c2)c[nH+]1 ZINC000629694307 361629185 /nfs/dbraw/zinc/62/91/85/361629185.db2.gz UDKRLXNJARQJEV-UHFFFAOYSA-N 1 2 244.294 2.229 20 0 BEADLO c1cn(-c2ccccc2)c(Cn2cc[nH+]c2)n1 ZINC000434646469 201230821 /nfs/dbraw/zinc/23/08/21/201230821.db2.gz QLRHOBUUUAHGOX-UHFFFAOYSA-N 1 2 224.267 2.117 20 0 BEADLO CC(C)c1cc(N2CCC(=O)[C@@H](C)C2)nc[nH+]1 ZINC000436350376 201321948 /nfs/dbraw/zinc/32/19/48/201321948.db2.gz VFNLAXVTTFWMHZ-JTQLQIEISA-N 1 2 233.315 2.015 20 0 BEADLO CC1=CCC[N@H+](Cc2ccn(C(F)F)n2)C1 ZINC000437340031 201351771 /nfs/dbraw/zinc/35/17/71/201351771.db2.gz DCPGWLNDICYOEA-UHFFFAOYSA-N 1 2 227.258 2.430 20 0 BEADLO CC1=CCC[N@@H+](Cc2ccn(C(F)F)n2)C1 ZINC000437340031 201351774 /nfs/dbraw/zinc/35/17/74/201351774.db2.gz DCPGWLNDICYOEA-UHFFFAOYSA-N 1 2 227.258 2.430 20 0 BEADLO FC(F)C[N@H+](CC[C@@H]1CCOC1)C1CC1 ZINC000438109446 201389831 /nfs/dbraw/zinc/38/98/31/201389831.db2.gz OGJUCXKGURGTLI-SECBINFHSA-N 1 2 219.275 2.143 20 0 BEADLO FC(F)C[N@@H+](CC[C@@H]1CCOC1)C1CC1 ZINC000438109446 201389832 /nfs/dbraw/zinc/38/98/32/201389832.db2.gz OGJUCXKGURGTLI-SECBINFHSA-N 1 2 219.275 2.143 20 0 BEADLO FC(F)C[N@H+](CC[C@H]1CCOC1)C1CC1 ZINC000438109457 201390995 /nfs/dbraw/zinc/39/09/95/201390995.db2.gz OGJUCXKGURGTLI-VIFPVBQESA-N 1 2 219.275 2.143 20 0 BEADLO FC(F)C[N@@H+](CC[C@H]1CCOC1)C1CC1 ZINC000438109457 201390999 /nfs/dbraw/zinc/39/09/99/201390999.db2.gz OGJUCXKGURGTLI-VIFPVBQESA-N 1 2 219.275 2.143 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)CC(F)(F)F ZINC000622081669 370697975 /nfs/dbraw/zinc/69/79/75/370697975.db2.gz AKNMOJHKZAJKQJ-SSDOTTSWSA-N 1 2 249.236 2.033 20 0 BEADLO COCCCCNc1[nH+]c(C)nc2[nH]ccc21 ZINC000080948020 363925988 /nfs/dbraw/zinc/92/59/88/363925988.db2.gz VJODUEQPGZRDTK-UHFFFAOYSA-N 1 2 234.303 2.105 20 0 BEADLO Cc1ncc([C@H](C)[NH2+][C@H]2CCn3ccnc32)s1 ZINC000631708762 364024045 /nfs/dbraw/zinc/02/40/45/364024045.db2.gz PUAMZCZPWBZACJ-WPRPVWTQSA-N 1 2 248.355 2.444 20 0 BEADLO Cc1ncc([C@@H](C)[NH2+][C@@H]2CCn3ccnc32)s1 ZINC000631708745 364024208 /nfs/dbraw/zinc/02/42/08/364024208.db2.gz PUAMZCZPWBZACJ-PSASIEDQSA-N 1 2 248.355 2.444 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CCC1(C)C)c1[nH]cc[nH+]1 ZINC000615157750 364547884 /nfs/dbraw/zinc/54/78/84/364547884.db2.gz GMDOFHCEFTZGEG-BDAKNGLRSA-N 1 2 221.304 2.023 20 0 BEADLO C=C/C(C)=C\CC(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000615158999 364551397 /nfs/dbraw/zinc/55/13/97/364551397.db2.gz XCNGCCHXWFJKPQ-HYHWUIIZSA-N 1 2 219.288 2.109 20 0 BEADLO CCc1cc(N[C@H]2C[C@@H](OC)C2(C)C)nc[nH+]1 ZINC000227820240 541371913 /nfs/dbraw/zinc/37/19/13/541371913.db2.gz HAWIXIBNIMRWIC-WDEREUQCSA-N 1 2 235.331 2.264 20 0 BEADLO Cc1ncncc1[C@H](C)[NH2+][C@H](C)c1ccon1 ZINC000566472793 364716623 /nfs/dbraw/zinc/71/66/23/364716623.db2.gz BLBNHYHXFRRERK-VHSXEESVSA-N 1 2 232.287 2.185 20 0 BEADLO CCc1nnc(C[NH2+]Cc2cc(C)ccc2F)[nH]1 ZINC000295934392 364781790 /nfs/dbraw/zinc/78/17/90/364781790.db2.gz FWBWWNFKIAEJSP-UHFFFAOYSA-N 1 2 248.305 2.104 20 0 BEADLO O=S(=O)(Nc1ccc2c[nH+]ccc2c1)C1CC1 ZINC000573085557 364782993 /nfs/dbraw/zinc/78/29/93/364782993.db2.gz KZNMGNKHWIJNSY-UHFFFAOYSA-N 1 2 248.307 2.139 20 0 BEADLO CCc1ccc([C@H](C)[NH2+]Cc2cc[nH]n2)o1 ZINC000167437715 364793000 /nfs/dbraw/zinc/79/30/00/364793000.db2.gz GCKUAYSNLLZQCV-VIFPVBQESA-N 1 2 219.288 2.416 20 0 BEADLO CN(CCC1CCCCC1)C(=O)Cn1cc[nH+]c1 ZINC000573772059 364911755 /nfs/dbraw/zinc/91/17/55/364911755.db2.gz OBHTYCFQJLZXKG-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO CC1(C)C[NH+](CC(=O)N[C@H]2CCCC2(C)C)C1 ZINC000553497942 325694108 /nfs/dbraw/zinc/69/41/08/325694108.db2.gz IUSMLDYIQVDCPJ-NSHDSACASA-N 1 2 238.375 2.023 20 0 BEADLO Cc1nc(N2CC[C@H](c3cccnc3)C2)cc[nH+]1 ZINC000574152889 364996428 /nfs/dbraw/zinc/99/64/28/364996428.db2.gz CIJQNCPCTYVHNV-ZDUSSCGKSA-N 1 2 240.310 2.174 20 0 BEADLO Cc1cc(C)c(CNC(=O)N2CCC2(C)C)c[nH+]1 ZINC000574415791 365059529 /nfs/dbraw/zinc/05/95/29/365059529.db2.gz WSXCLEJYJLQQNK-UHFFFAOYSA-N 1 2 247.342 2.392 20 0 BEADLO CO[C@H]1C[C@H]2C[C@H](Nc3c[nH]c[nH+]3)C[C@H]2C1 ZINC000574447947 365064034 /nfs/dbraw/zinc/06/40/34/365064034.db2.gz UCFWHNFFGVSZHQ-FAUIJHMISA-N 1 2 221.304 2.025 20 0 BEADLO CO[C@H]1C[C@H]2C[C@@H](Nc3c[nH]c[nH+]3)C[C@H]2C1 ZINC000574447944 365064128 /nfs/dbraw/zinc/06/41/28/365064128.db2.gz UCFWHNFFGVSZHQ-DTIDVZRVSA-N 1 2 221.304 2.025 20 0 BEADLO COCC1(CNc2nc(C)[nH+]cc2C)CCCC1 ZINC000574530459 365085282 /nfs/dbraw/zinc/08/52/82/365085282.db2.gz AFYAFCMMCNOLLT-UHFFFAOYSA-N 1 2 249.358 2.134 20 0 BEADLO Cc1occc1C[NH2+]Cc1ncccc1F ZINC000574662775 365117223 /nfs/dbraw/zinc/11/72/23/365117223.db2.gz YOAPDMSRGDXXFW-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO c1ncc(CC[N@@H+]2Cc3cccnc3C2)s1 ZINC000574686641 365119704 /nfs/dbraw/zinc/11/97/04/365119704.db2.gz JVXLMOYTOKXQGW-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1ncc(CC[N@H+]2Cc3cccnc3C2)s1 ZINC000574686641 365119709 /nfs/dbraw/zinc/11/97/09/365119709.db2.gz JVXLMOYTOKXQGW-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO Cc1[nH+]c(C(C)C)ccc1COn1cccn1 ZINC000574742781 365133064 /nfs/dbraw/zinc/13/30/64/365133064.db2.gz ZZRDFEUNWBZIKR-UHFFFAOYSA-N 1 2 231.299 2.339 20 0 BEADLO CC[C@@H](C)[C@H](C)C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000574817727 365152125 /nfs/dbraw/zinc/15/21/25/365152125.db2.gz QLVHHWRVUGAOIP-ZJUUUORDSA-N 1 2 237.347 2.443 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000574817724 365152158 /nfs/dbraw/zinc/15/21/58/365152158.db2.gz QLVHHWRVUGAOIP-UWVGGRQHSA-N 1 2 237.347 2.443 20 0 BEADLO CC(C)[C@@H]1C[N@H+](Cc2ncccn2)CCS1 ZINC000192049110 365271835 /nfs/dbraw/zinc/27/18/35/365271835.db2.gz NBINHMWAOMJBMK-NSHDSACASA-N 1 2 237.372 2.050 20 0 BEADLO CC(C)[C@@H]1C[N@@H+](Cc2ncccn2)CCS1 ZINC000192049110 365271839 /nfs/dbraw/zinc/27/18/39/365271839.db2.gz NBINHMWAOMJBMK-NSHDSACASA-N 1 2 237.372 2.050 20 0 BEADLO C[C@H](C(=O)Nc1ccsc1)[NH+]1CC(C)C1 ZINC000575328734 365292544 /nfs/dbraw/zinc/29/25/44/365292544.db2.gz YOAORSQXFMOKPR-SECBINFHSA-N 1 2 224.329 2.027 20 0 BEADLO Fc1ccc2c(c1)CC[C@@H]2[NH2+]Cc1ncccn1 ZINC000575430539 365320817 /nfs/dbraw/zinc/32/08/17/365320817.db2.gz BVHKKSDWPLYLLG-ZDUSSCGKSA-N 1 2 243.285 2.393 20 0 BEADLO CCNC(=O)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000172413981 365323299 /nfs/dbraw/zinc/32/32/99/365323299.db2.gz VHIGGWROOXALMO-UHFFFAOYSA-N 1 2 244.298 2.229 20 0 BEADLO CC[C@@H]([NH2+][C@H](C)[C@H](C)OC)C(=O)OC(C)(C)C ZINC000575969098 365428650 /nfs/dbraw/zinc/42/86/50/365428650.db2.gz WQPHOYBWVAQVDH-OUAUKWLOSA-N 1 2 245.363 2.120 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000576164287 365506463 /nfs/dbraw/zinc/50/64/63/365506463.db2.gz SIVDXJUWDRQRRI-TUAOUCFPSA-N 1 2 237.347 2.385 20 0 BEADLO CCC(C)(CC)C(=O)N(C)Cc1[nH+]ccn1C ZINC000158662948 541490933 /nfs/dbraw/zinc/49/09/33/541490933.db2.gz QFNPNBNCSXTIJX-UHFFFAOYSA-N 1 2 237.347 2.205 20 0 BEADLO CCc1cc(N[C@H](C)[C@H]2CCCCO2)nc[nH+]1 ZINC000383123692 541513810 /nfs/dbraw/zinc/51/38/10/541513810.db2.gz UBQNQBARBKBAGK-ZYHUDNBSSA-N 1 2 235.331 2.409 20 0 BEADLO CC[C@H](C)CN(C)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000579718406 366990710 /nfs/dbraw/zinc/99/07/10/366990710.db2.gz HSFUDNODANJIRV-NWDGAFQWSA-N 1 2 237.347 2.339 20 0 BEADLO CC[C@@H](C)CN(C)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000579718408 366991129 /nfs/dbraw/zinc/99/11/29/366991129.db2.gz HSFUDNODANJIRV-VXGBXAGGSA-N 1 2 237.347 2.339 20 0 BEADLO COc1cc(Cn2cc[nH+]c2)ccc1C ZINC000579728976 366994898 /nfs/dbraw/zinc/99/48/98/366994898.db2.gz PUBIJKHWODKLRJ-UHFFFAOYSA-N 1 2 202.257 2.248 20 0 BEADLO CC[N@@H+](Cc1ccc(CO)cc1)CC(F)F ZINC000386054770 541516573 /nfs/dbraw/zinc/51/65/73/541516573.db2.gz GCUTUFKDCHPPGD-UHFFFAOYSA-N 1 2 229.270 2.266 20 0 BEADLO CC[N@H+](Cc1ccc(CO)cc1)CC(F)F ZINC000386054770 541516576 /nfs/dbraw/zinc/51/65/76/541516576.db2.gz GCUTUFKDCHPPGD-UHFFFAOYSA-N 1 2 229.270 2.266 20 0 BEADLO CCC1CC[NH+](Cc2nc(C3CC3)nn2C)CC1 ZINC000579828020 367035162 /nfs/dbraw/zinc/03/51/62/367035162.db2.gz ZHIUZUDKWMLFEP-UHFFFAOYSA-N 1 2 248.374 2.315 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000579850442 367050207 /nfs/dbraw/zinc/05/02/07/367050207.db2.gz XNCSKPGEHUEJNP-GHMZBOCLSA-N 1 2 237.347 2.235 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000579850442 367050210 /nfs/dbraw/zinc/05/02/10/367050210.db2.gz XNCSKPGEHUEJNP-GHMZBOCLSA-N 1 2 237.347 2.235 20 0 BEADLO Cc1cc(OCc2ccc(C)[nH+]c2C)nn1C ZINC000185374995 367128589 /nfs/dbraw/zinc/12/85/89/367128589.db2.gz PDKXXAZRHHRZRX-UHFFFAOYSA-N 1 2 231.299 2.319 20 0 BEADLO OCc1ccc(C[N@@H+]2Cc3cccnc3C2)cc1 ZINC000579950380 367098825 /nfs/dbraw/zinc/09/88/25/367098825.db2.gz RZBJDEYIECZOLO-UHFFFAOYSA-N 1 2 240.306 2.090 20 0 BEADLO OCc1ccc(C[N@H+]2Cc3cccnc3C2)cc1 ZINC000579950380 367098828 /nfs/dbraw/zinc/09/88/28/367098828.db2.gz RZBJDEYIECZOLO-UHFFFAOYSA-N 1 2 240.306 2.090 20 0 BEADLO C[C@@H]([NH2+]Cc1nnc2n1CCCC2)c1ccoc1 ZINC000184915920 367109853 /nfs/dbraw/zinc/10/98/53/367109853.db2.gz IGIVSDPADKOXPW-SNVBAGLBSA-N 1 2 246.314 2.058 20 0 BEADLO C=Cn1cc(C[NH+]2Cc3ccccc3C2)cn1 ZINC000193889475 367223648 /nfs/dbraw/zinc/22/36/48/367223648.db2.gz MOTHISNMCAYQMX-UHFFFAOYSA-N 1 2 225.295 2.499 20 0 BEADLO CC(C)(C)[C@@H]1CCC[C@@H]1NC(=O)Cn1cc[nH+]c1 ZINC000581178434 367283806 /nfs/dbraw/zinc/28/38/06/367283806.db2.gz WBJCIDWTEGETCG-NEPJUHHUSA-N 1 2 249.358 2.214 20 0 BEADLO CNc1[nH+]cnc2c1cnn2CCC1CCCC1 ZINC000194427720 367288933 /nfs/dbraw/zinc/28/89/33/367288933.db2.gz OJSIHERHVNKJLH-UHFFFAOYSA-N 1 2 245.330 2.448 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2CCOC[C@@H]2C)c(C)[nH+]1 ZINC000194658484 367315887 /nfs/dbraw/zinc/31/58/87/367315887.db2.gz WMTGBJBAAFUUCY-CABZTGNLSA-N 1 2 248.326 2.310 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CCOCC1(C)C ZINC000195515113 367366200 /nfs/dbraw/zinc/36/62/00/367366200.db2.gz RBRFXUMQIXWHKY-UHFFFAOYSA-N 1 2 237.347 2.075 20 0 BEADLO CN(C)c1ccccc1C[NH2+]CC(C)(F)F ZINC000382023453 367480086 /nfs/dbraw/zinc/48/00/86/367480086.db2.gz RDQUKQLVFXWTNJ-UHFFFAOYSA-N 1 2 228.286 2.497 20 0 BEADLO COCc1cccc(CNc2c[nH]c[nH+]2)c1 ZINC000381593191 367434823 /nfs/dbraw/zinc/43/48/23/367434823.db2.gz KJDUPVMZOBCREW-UHFFFAOYSA-N 1 2 217.272 2.168 20 0 BEADLO Cc1ncccc1C[NH2+]CC(C)(F)F ZINC000382393318 367514492 /nfs/dbraw/zinc/51/44/92/367514492.db2.gz NCLCHYYNMRBZCL-UHFFFAOYSA-N 1 2 200.232 2.135 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CCC[C@@H](C)C1)c1[nH]cc[nH+]1 ZINC000383273206 367610687 /nfs/dbraw/zinc/61/06/87/367610687.db2.gz ZJRMDSYDDKMOCQ-GMTAPVOTSA-N 1 2 235.331 2.413 20 0 BEADLO Cc1cccc(C[NH2+]Cc2ccno2)c1F ZINC000384591476 367705659 /nfs/dbraw/zinc/70/56/59/367705659.db2.gz ZOMVFBIVFDWQRN-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO Cc1nc(N[C@@H](C)CC(C)(C)C)cc[nH+]1 ZINC000384398359 367688964 /nfs/dbraw/zinc/68/89/64/367688964.db2.gz BZJHYQBPYJBIHJ-VIFPVBQESA-N 1 2 207.321 2.444 20 0 BEADLO CCC(=O)CCC[NH+]1CC(C(F)(F)F)C1 ZINC000581707278 367740015 /nfs/dbraw/zinc/74/00/15/367740015.db2.gz CULNWGZWNLPVOV-UHFFFAOYSA-N 1 2 223.238 2.240 20 0 BEADLO CN(CCCCO)c1[nH+]ccc2ccccc21 ZINC000384977611 367768763 /nfs/dbraw/zinc/76/87/63/367768763.db2.gz YLKRWMGESRUINL-UHFFFAOYSA-N 1 2 230.311 2.444 20 0 BEADLO Cc1ccc(N[C@@H]2C[C@@H](C)O[C@@H]2C)c[nH+]1 ZINC000384650971 367712385 /nfs/dbraw/zinc/71/23/85/367712385.db2.gz UNQPYYKGBGQIOZ-CKYFFXLPSA-N 1 2 206.289 2.368 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1Nc1[nH+]cnc2c1cnn2C ZINC000385118534 367795535 /nfs/dbraw/zinc/79/55/35/367795535.db2.gz DTTFGWVCTVOYIE-MWLCHTKSSA-N 1 2 245.330 2.210 20 0 BEADLO C[C@H](CC(=O)N1CC[C@@H](C)[C@@H](C)C1)n1cc[nH+]c1 ZINC000581888949 367878158 /nfs/dbraw/zinc/87/81/58/367878158.db2.gz ZXWIGIOXQYZLGN-FRRDWIJNSA-N 1 2 249.358 2.339 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1NC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000581834616 367838786 /nfs/dbraw/zinc/83/87/86/367838786.db2.gz UTEHFKZPPVJFOX-QKCSRTOESA-N 1 2 249.358 2.139 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1NC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000581834616 367838792 /nfs/dbraw/zinc/83/87/92/367838792.db2.gz UTEHFKZPPVJFOX-QKCSRTOESA-N 1 2 249.358 2.139 20 0 BEADLO C[C@H](CC(=O)N1CC[C@@H](C)[C@H](C)C1)n1cc[nH+]c1 ZINC000581888950 367877824 /nfs/dbraw/zinc/87/78/24/367877824.db2.gz ZXWIGIOXQYZLGN-JHJVBQTASA-N 1 2 249.358 2.339 20 0 BEADLO C[C@@H]1C[C@H]1NC(=O)c1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000630913221 367920267 /nfs/dbraw/zinc/92/02/67/367920267.db2.gz XWQWNFHIKFKUTC-BXKDBHETSA-N 1 2 241.294 2.215 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)CC(C)C)[nH+]1 ZINC000581949174 367975579 /nfs/dbraw/zinc/97/55/79/367975579.db2.gz QYXUDBAEMYEQRU-UHFFFAOYSA-N 1 2 223.320 2.116 20 0 BEADLO CC[C@H](C)N(C)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000566307566 326032234 /nfs/dbraw/zinc/03/22/34/326032234.db2.gz KYOBALMWWKROGP-QWRGUYRKSA-N 1 2 223.320 2.091 20 0 BEADLO FC(F)n1ccnc1C[NH+]1C2CCC1CC2 ZINC000642525620 368175088 /nfs/dbraw/zinc/17/50/88/368175088.db2.gz XUVKAYZFLLRCGH-UHFFFAOYSA-N 1 2 227.258 2.405 20 0 BEADLO CCCSc1cccc(NCc2[nH]cc[nH+]2)n1 ZINC000630957616 368150469 /nfs/dbraw/zinc/15/04/69/368150469.db2.gz YKYPWCPMQYVNAE-UHFFFAOYSA-N 1 2 248.355 2.341 20 0 BEADLO CN(C)c1c[nH+]cc(NCc2cc[nH]c2)c1 ZINC000630957062 368153619 /nfs/dbraw/zinc/15/36/19/368153619.db2.gz ZKOPQCVAVHVQBH-UHFFFAOYSA-N 1 2 216.288 2.088 20 0 BEADLO Cc1noc(C)c1CNc1c[nH+]cc(N(C)C)c1 ZINC000630957094 368153684 /nfs/dbraw/zinc/15/36/84/368153684.db2.gz MCKGENLRRSDFRK-UHFFFAOYSA-N 1 2 246.314 2.365 20 0 BEADLO CCCC(=O)NCc1cc[nH+]c(N2CCCC2)c1 ZINC000042636151 368315338 /nfs/dbraw/zinc/31/53/38/368315338.db2.gz IVZDDVAUUUGKNB-UHFFFAOYSA-N 1 2 247.342 2.098 20 0 BEADLO Cc1noc(C[N@@H+](C)Cc2ccccc2C)n1 ZINC000042299611 368302380 /nfs/dbraw/zinc/30/23/80/368302380.db2.gz UKGFYGWRCBEXLT-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1noc(C[N@H+](C)Cc2ccccc2C)n1 ZINC000042299611 368302385 /nfs/dbraw/zinc/30/23/85/368302385.db2.gz UKGFYGWRCBEXLT-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO COc1cc(C[NH2+]CC(C)(F)F)cc(OC)c1 ZINC000566516385 326061326 /nfs/dbraw/zinc/06/13/26/326061326.db2.gz QWPOTKSFLGZKLH-UHFFFAOYSA-N 1 2 245.269 2.449 20 0 BEADLO CCCCCC(=O)NCCCCn1cc[nH+]c1 ZINC000060408352 368542488 /nfs/dbraw/zinc/54/24/88/368542488.db2.gz GWRTXJAWADDKRZ-UHFFFAOYSA-N 1 2 237.347 2.360 20 0 BEADLO CCCCc1nc(C[N@H+](CC)CCO)cs1 ZINC000067964043 368708220 /nfs/dbraw/zinc/70/82/20/368708220.db2.gz NDJGWSHJWXOBMH-UHFFFAOYSA-N 1 2 242.388 2.300 20 0 BEADLO CCCCc1nc(C[N@@H+](CC)CCO)cs1 ZINC000067964043 368708225 /nfs/dbraw/zinc/70/82/25/368708225.db2.gz NDJGWSHJWXOBMH-UHFFFAOYSA-N 1 2 242.388 2.300 20 0 BEADLO C[C@@H]1CCCC[C@]1(C)NC(=O)CCc1[nH]cc[nH+]1 ZINC000457237415 203024583 /nfs/dbraw/zinc/02/45/83/203024583.db2.gz CMKFOWOZUSVZPB-RISCZKNCSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@@H](CC(C)(C)C)NC(=O)CCn1cc[nH+]c1 ZINC000457237936 203026769 /nfs/dbraw/zinc/02/67/69/203026769.db2.gz VNGLWNCAEQDNDU-NSHDSACASA-N 1 2 237.347 2.214 20 0 BEADLO Cc1[nH]c(C(=O)N[C@]2(C)CCCC[C@@H]2C)c[nH+]1 ZINC000457258163 203029062 /nfs/dbraw/zinc/02/90/62/203029062.db2.gz MEZVLDYXTJBZEI-TVQRCGJNSA-N 1 2 235.331 2.417 20 0 BEADLO C[C@@H](CC(C)(C)C)NC(=O)CCc1[nH]cc[nH+]1 ZINC000457195424 203017166 /nfs/dbraw/zinc/01/71/66/203017166.db2.gz QFAWGOUJCUTVKH-JTQLQIEISA-N 1 2 237.347 2.283 20 0 BEADLO CC[NH+](CC)[C@@H](C(=O)OC)c1ccc(F)cc1 ZINC000072557610 368773721 /nfs/dbraw/zinc/77/37/21/368773721.db2.gz MWDPXZPHWUBDCB-GFCCVEGCSA-N 1 2 239.290 2.382 20 0 BEADLO C[C@H]1C[C@H](NC(=O)[C@H]2C[C@H]3C[C@H]3C2)c2[nH+]ccn21 ZINC000615963987 368801072 /nfs/dbraw/zinc/80/10/72/368801072.db2.gz UVVSBCINGJJOQO-HGCLJGPKSA-N 1 2 245.326 2.051 20 0 BEADLO CCC[C@@H]1CCCC[C@H]1NC(=O)Cn1cc[nH+]c1 ZINC000073361548 368803355 /nfs/dbraw/zinc/80/33/55/368803355.db2.gz BAJULYXGBUMUAY-CHWSQXEVSA-N 1 2 249.358 2.358 20 0 BEADLO CCC[C@H]1CCCC[C@H]1NC(=O)Cn1cc[nH+]c1 ZINC000073361551 368803379 /nfs/dbraw/zinc/80/33/79/368803379.db2.gz BAJULYXGBUMUAY-QWHCGFSZSA-N 1 2 249.358 2.358 20 0 BEADLO CCc1ccc(C[N@H+](C)[C@@H](C)C(=O)OC)cc1 ZINC000073261446 368799834 /nfs/dbraw/zinc/79/98/34/368799834.db2.gz WWCKLDCVAGAUDI-NSHDSACASA-N 1 2 235.327 2.242 20 0 BEADLO CCc1ccc(C[N@@H+](C)[C@@H](C)C(=O)OC)cc1 ZINC000073261446 368799839 /nfs/dbraw/zinc/79/98/39/368799839.db2.gz WWCKLDCVAGAUDI-NSHDSACASA-N 1 2 235.327 2.242 20 0 BEADLO Cc1noc(C)c1C[NH2+]Cc1ccn(C(C)C)n1 ZINC000084225481 368851934 /nfs/dbraw/zinc/85/19/34/368851934.db2.gz LHBZNDIQCZDYFC-UHFFFAOYSA-N 1 2 248.330 2.359 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1[C@H](C)CCC1(C)C ZINC000616179037 369011515 /nfs/dbraw/zinc/01/15/15/369011515.db2.gz MIXAIYFGETYBTA-GHMZBOCLSA-N 1 2 249.358 2.378 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1[C@H](C)CCC1(C)C ZINC000616179037 369011519 /nfs/dbraw/zinc/01/15/19/369011519.db2.gz MIXAIYFGETYBTA-GHMZBOCLSA-N 1 2 249.358 2.378 20 0 BEADLO CC[C@@](C)(NCCn1cc[nH+]c1)C(F)(F)F ZINC000310024991 326180161 /nfs/dbraw/zinc/18/01/61/326180161.db2.gz OTMIVJKKSJMAKE-SECBINFHSA-N 1 2 235.253 2.204 20 0 BEADLO CC(C)CCCCC(=O)N1CCn2c[nH+]cc2C1 ZINC000457812535 203105711 /nfs/dbraw/zinc/10/57/11/203105711.db2.gz BRDJGRUFWDRYNP-UHFFFAOYSA-N 1 2 249.358 2.442 20 0 BEADLO CCC1(C(=O)NCCc2cn(C)c[nH+]2)CCCC1 ZINC000457865355 203115911 /nfs/dbraw/zinc/11/59/11/203115911.db2.gz UYNNAYXVOJHRJT-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO Cn1c[nH+]c(CCNC(=O)CC2(C)CCCC2)c1 ZINC000457878951 203117108 /nfs/dbraw/zinc/11/71/08/203117108.db2.gz XKYVOGQTDLEAOC-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO CCC[C@H](NC(=O)c1c[nH+]c(C)[nH]1)C1CCC1 ZINC000458330798 203161063 /nfs/dbraw/zinc/16/10/63/203161063.db2.gz MLGJHUJGLIYVIR-NSHDSACASA-N 1 2 235.331 2.417 20 0 BEADLO CCC[C@H](NC(=O)CCn1cc[nH+]c1)C1CCC1 ZINC000458336782 203163533 /nfs/dbraw/zinc/16/35/33/203163533.db2.gz QTDLGUXEMJBSDU-ZDUSSCGKSA-N 1 2 249.358 2.358 20 0 BEADLO CC[C@H](NC(=O)c1ccc2[nH+]ccn2c1)C1CC1 ZINC000618866596 369229481 /nfs/dbraw/zinc/22/94/81/369229481.db2.gz QWXLBSZBSFZBPE-LBPRGKRZSA-N 1 2 243.310 2.253 20 0 BEADLO CC[C@@](C)(NC(=O)[C@H](C)Cc1c[nH+]c[nH]1)C1CC1 ZINC000618950910 369244196 /nfs/dbraw/zinc/24/41/96/369244196.db2.gz GCBIEDUEBARKCA-QMTHXVAHSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@@](C)(NC(=O)[C@H](C)Cc1c[nH]c[nH+]1)C1CC1 ZINC000618950910 369244197 /nfs/dbraw/zinc/24/41/97/369244197.db2.gz GCBIEDUEBARKCA-QMTHXVAHSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@](C)(NC(=O)[C@H](C)Cc1c[nH+]c[nH]1)C1CC1 ZINC000618950912 369244490 /nfs/dbraw/zinc/24/44/90/369244490.db2.gz GCBIEDUEBARKCA-YGRLFVJLSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@](C)(NC(=O)[C@H](C)Cc1c[nH]c[nH+]1)C1CC1 ZINC000618950912 369244493 /nfs/dbraw/zinc/24/44/93/369244493.db2.gz GCBIEDUEBARKCA-YGRLFVJLSA-N 1 2 249.358 2.283 20 0 BEADLO Cc1cccn2c(NC(=O)[C@@H]3C[C@H]3C)c[nH+]c12 ZINC000619011121 369257392 /nfs/dbraw/zinc/25/73/92/369257392.db2.gz PYNNQQILRPFYOK-NXEZZACHSA-N 1 2 229.283 2.237 20 0 BEADLO Cc1cccn2c(NC(=O)[C@H]3CC34CC4)c[nH+]c12 ZINC000619016203 369258298 /nfs/dbraw/zinc/25/82/98/369258298.db2.gz XJQNVEFHNPFJGZ-SNVBAGLBSA-N 1 2 241.294 2.381 20 0 BEADLO Cc1cc(F)c(C[N@H+](C)CCO)c(Cl)c1 ZINC000459292182 203247113 /nfs/dbraw/zinc/24/71/13/203247113.db2.gz JGYDRIILAJUTJM-UHFFFAOYSA-N 1 2 231.698 2.212 20 0 BEADLO Cc1cc(F)c(C[N@@H+](C)CCO)c(Cl)c1 ZINC000459292182 203247115 /nfs/dbraw/zinc/24/71/15/203247115.db2.gz JGYDRIILAJUTJM-UHFFFAOYSA-N 1 2 231.698 2.212 20 0 BEADLO CCn1nncc1C[N@H+](C)Cc1ccc(F)cc1 ZINC000459298390 203250878 /nfs/dbraw/zinc/25/08/78/203250878.db2.gz ONRQCICQYPSQHG-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO CCn1nncc1C[N@@H+](C)Cc1ccc(F)cc1 ZINC000459298390 203250879 /nfs/dbraw/zinc/25/08/79/203250879.db2.gz ONRQCICQYPSQHG-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO CCn1nncc1C[N@H+](C)[C@H](C)c1ccco1 ZINC000459322522 203258270 /nfs/dbraw/zinc/25/82/70/203258270.db2.gz HKAHGMGBXIMYJM-SNVBAGLBSA-N 1 2 234.303 2.084 20 0 BEADLO CCn1nncc1C[N@@H+](C)[C@H](C)c1ccco1 ZINC000459322522 203258273 /nfs/dbraw/zinc/25/82/73/203258273.db2.gz HKAHGMGBXIMYJM-SNVBAGLBSA-N 1 2 234.303 2.084 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)CC1CCC(F)(F)CC1 ZINC000459353030 203264535 /nfs/dbraw/zinc/26/45/35/203264535.db2.gz YUCDYSZQKDUCGI-UHFFFAOYSA-N 1 2 244.289 2.062 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)CC1CCC(F)(F)CC1 ZINC000459353030 203264539 /nfs/dbraw/zinc/26/45/39/203264539.db2.gz YUCDYSZQKDUCGI-UHFFFAOYSA-N 1 2 244.289 2.062 20 0 BEADLO COCc1cc(C[N@H+](C)[C@H]2CC2(C)C)no1 ZINC000459515989 203295715 /nfs/dbraw/zinc/29/57/15/203295715.db2.gz MQVIBWHTRXVEDF-NSHDSACASA-N 1 2 224.304 2.051 20 0 BEADLO COCc1cc(C[N@@H+](C)[C@H]2CC2(C)C)no1 ZINC000459515989 203295717 /nfs/dbraw/zinc/29/57/17/203295717.db2.gz MQVIBWHTRXVEDF-NSHDSACASA-N 1 2 224.304 2.051 20 0 BEADLO Cc1cccc(C[NH+]2CC(OCC(F)F)C2)c1 ZINC000459595295 203311357 /nfs/dbraw/zinc/31/13/57/203311357.db2.gz RUMQLJVHIAYSPV-UHFFFAOYSA-N 1 2 241.281 2.461 20 0 BEADLO CCCCCOC1C[NH+](Cc2ccn(C)c2)C1 ZINC000459598959 203312857 /nfs/dbraw/zinc/31/28/57/203312857.db2.gz XKRPYKOYPQECGD-UHFFFAOYSA-N 1 2 236.359 2.416 20 0 BEADLO COCc1cc(C[NH+]2CC3(C2)CCCC3)no1 ZINC000459555439 203301524 /nfs/dbraw/zinc/30/15/24/203301524.db2.gz CJXUMUFDFDVYNM-UHFFFAOYSA-N 1 2 236.315 2.197 20 0 BEADLO Cc1cnc(C[NH+]2CC3(C2)CCCC3)n1C ZINC000459560947 203301858 /nfs/dbraw/zinc/30/18/58/203301858.db2.gz MOKBTDMVPYETNR-UHFFFAOYSA-N 1 2 219.332 2.105 20 0 BEADLO Cc1c[nH+]c(CN2CC3(C2)CCCC3)n1C ZINC000459560947 203301861 /nfs/dbraw/zinc/30/18/61/203301861.db2.gz MOKBTDMVPYETNR-UHFFFAOYSA-N 1 2 219.332 2.105 20 0 BEADLO COC1(C)C[NH+](Cc2csc(C)c2)C1 ZINC000459571287 203304140 /nfs/dbraw/zinc/30/41/40/203304140.db2.gz CIFQQWJPBJNQFD-UHFFFAOYSA-N 1 2 211.330 2.277 20 0 BEADLO COc1ccccc1/C=C/C[NH+]1CC(OC)C1 ZINC000459572935 203304285 /nfs/dbraw/zinc/30/42/85/203304285.db2.gz BIMFMPKFWLVTIF-FNORWQNLSA-N 1 2 233.311 2.039 20 0 BEADLO CCOC1(C)C[NH+](Cc2cccc3c2OCO3)C1 ZINC000459612111 203316557 /nfs/dbraw/zinc/31/65/57/203316557.db2.gz MFUCOQUWGCWDNT-UHFFFAOYSA-N 1 2 249.310 2.026 20 0 BEADLO CCOC1(C)C[NH+](Cc2occc2C)C1 ZINC000459612482 203317588 /nfs/dbraw/zinc/31/75/88/203317588.db2.gz BLDVFUQUKHKETF-UHFFFAOYSA-N 1 2 209.289 2.199 20 0 BEADLO CCC[C@H](C)NC(=O)[C@@H]1CCn2cc(C)[nH+]c2C1 ZINC000623685904 369405056 /nfs/dbraw/zinc/40/50/56/369405056.db2.gz YDBFMSAAFGXZEG-CMPLNLGQSA-N 1 2 249.358 2.059 20 0 BEADLO CC(C)c1cnc(C[NH+]2CC(C)(CO)C2)s1 ZINC000459620034 203318853 /nfs/dbraw/zinc/31/88/53/203318853.db2.gz KFRCFSKXRBKZID-UHFFFAOYSA-N 1 2 240.372 2.081 20 0 BEADLO Cc1cccc(C[NH+]2CC(OC(F)F)C2)c1 ZINC000459638515 203325406 /nfs/dbraw/zinc/32/54/06/203325406.db2.gz OAOJZIFTFMUDSZ-UHFFFAOYSA-N 1 2 227.254 2.418 20 0 BEADLO Cc1sccc1C[NH+]1CC(OC(F)F)C1 ZINC000459633880 203327140 /nfs/dbraw/zinc/32/71/40/203327140.db2.gz VSRDYLLFYLIMHH-UHFFFAOYSA-N 1 2 233.283 2.480 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@@H+]1CCC1CCCC1 ZINC000619513950 369455770 /nfs/dbraw/zinc/45/57/70/369455770.db2.gz BIQLKSKCOFQTGX-RYUDHWBXSA-N 1 2 243.322 2.152 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@H+]1CCC1CCCC1 ZINC000619513950 369455774 /nfs/dbraw/zinc/45/57/74/369455774.db2.gz BIQLKSKCOFQTGX-RYUDHWBXSA-N 1 2 243.322 2.152 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1nnc(C(C)(C)C)[nH]1 ZINC000459684913 203337277 /nfs/dbraw/zinc/33/72/77/203337277.db2.gz VOTNOTUYGNSZNA-UHFFFAOYSA-N 1 2 248.330 2.293 20 0 BEADLO C[C@@H](NC(=O)CC(C)(C)C1CC1)c1[nH]cc[nH+]1 ZINC000405785996 369474345 /nfs/dbraw/zinc/47/43/45/369474345.db2.gz FSFSCQAORVDICG-SECBINFHSA-N 1 2 235.331 2.413 20 0 BEADLO CCCCc1cc(NCc2ccco2)nc[nH+]1 ZINC000631029867 370956044 /nfs/dbraw/zinc/95/60/44/370956044.db2.gz JIVPPPLGZRKURS-UHFFFAOYSA-N 1 2 231.299 2.446 20 0 BEADLO COCCCNc1[nH+]c(C(C)C)nc2[nH]ccc21 ZINC000631032100 370969830 /nfs/dbraw/zinc/96/98/30/370969830.db2.gz SYZCGVMKCOPHRY-UHFFFAOYSA-N 1 2 248.330 2.481 20 0 BEADLO c1ccc2[nH]c(C[N@@H+]3C[C@@H]4C[C@H]3CS4)nc2c1 ZINC000459765636 203361052 /nfs/dbraw/zinc/36/10/52/203361052.db2.gz ODBLGENXMIPDRN-UWVGGRQHSA-N 1 2 245.351 2.253 20 0 BEADLO c1ccc2[nH]c(C[N@H+]3C[C@@H]4C[C@H]3CS4)nc2c1 ZINC000459765636 203361054 /nfs/dbraw/zinc/36/10/54/203361054.db2.gz ODBLGENXMIPDRN-UWVGGRQHSA-N 1 2 245.351 2.253 20 0 BEADLO C[C@H](CC(=O)NC(C)(C)C1CC1)n1cc[nH+]c1 ZINC000567993850 326293441 /nfs/dbraw/zinc/29/34/41/326293441.db2.gz XQSXMYINFZCOPV-SNVBAGLBSA-N 1 2 235.331 2.139 20 0 BEADLO CCCC1(C(=O)N[C@@H](C)c2[nH+]ccn2C)CC1 ZINC000620605103 369953312 /nfs/dbraw/zinc/95/33/12/369953312.db2.gz ZDTJIHOPIGCFQX-JTQLQIEISA-N 1 2 235.331 2.178 20 0 BEADLO C[C@H](NC(=O)C[C@@H]1C=CCCC1)c1[nH+]ccn1C ZINC000620604571 369953401 /nfs/dbraw/zinc/95/34/01/369953401.db2.gz SQIDQDPBXYDDDL-NWDGAFQWSA-N 1 2 247.342 2.344 20 0 BEADLO CC[C@H](C)CC(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620605749 369954260 /nfs/dbraw/zinc/95/42/60/369954260.db2.gz JSVLAOMJQMQBAQ-VHSXEESVSA-N 1 2 223.320 2.034 20 0 BEADLO C=C/C(C)=C\CC(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620605893 369954437 /nfs/dbraw/zinc/95/44/37/369954437.db2.gz MFWSZRJCAIHSRO-YAEJEKNGSA-N 1 2 233.315 2.120 20 0 BEADLO CC[C@H](C)CCC(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620607562 369955695 /nfs/dbraw/zinc/95/56/95/369955695.db2.gz IHZPSSYDJXRJEE-QWRGUYRKSA-N 1 2 237.347 2.424 20 0 BEADLO Cc1sccc1C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620607574 369955824 /nfs/dbraw/zinc/95/58/24/369955824.db2.gz INWQKFNCCZETHO-MRVPVSSYSA-N 1 2 249.339 2.281 20 0 BEADLO C[C@H](NC(=O)CC1CC(C)(C)C1)c1[nH+]ccn1C ZINC000620608298 369956690 /nfs/dbraw/zinc/95/66/90/369956690.db2.gz NJXSTOPMFQUACR-JTQLQIEISA-N 1 2 249.358 2.424 20 0 BEADLO C[C@@H](NC(=O)C1CC2(CCC2)C1)c1[nH+]ccn1C ZINC000620612227 369958285 /nfs/dbraw/zinc/95/82/85/369958285.db2.gz SAIMIANJTOPDDI-SNVBAGLBSA-N 1 2 247.342 2.178 20 0 BEADLO Cc1cn2ccc(NC(=O)CC3CC3)cc2[nH+]1 ZINC000620648609 369972437 /nfs/dbraw/zinc/97/24/37/369972437.db2.gz GCGWVVYZQHLXDO-UHFFFAOYSA-N 1 2 229.283 2.381 20 0 BEADLO CC[C@@H]1CCC[C@H](C)N1C(=O)Cn1cc[nH+]c1 ZINC000620577375 369935652 /nfs/dbraw/zinc/93/56/52/369935652.db2.gz ZRBYCMFAOYOXKV-NWDGAFQWSA-N 1 2 235.331 2.063 20 0 BEADLO C[C@H](NC(=O)C1(C)CCCC1)c1[nH+]ccn1C ZINC000620595120 369947607 /nfs/dbraw/zinc/94/76/07/369947607.db2.gz IQEAXHIFMGBWPK-JTQLQIEISA-N 1 2 235.331 2.178 20 0 BEADLO CCc1cc(NCC2(CCO)CCCC2)nc[nH+]1 ZINC000075064144 370073489 /nfs/dbraw/zinc/07/34/89/370073489.db2.gz RMEXJZOGAAHNJD-UHFFFAOYSA-N 1 2 249.358 2.394 20 0 BEADLO COc1ccc(CN(C)Cc2[nH]cc[nH+]2)cc1F ZINC000111194579 370104931 /nfs/dbraw/zinc/10/49/31/370104931.db2.gz HPZMXRJIAXGNPC-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO CSC[C@H]1CCC[N@H+](CC(F)F)C1 ZINC000308180021 370108647 /nfs/dbraw/zinc/10/86/47/370108647.db2.gz XXCYGDJTUNNGPX-QMMMGPOBSA-N 1 2 209.305 2.327 20 0 BEADLO CSC[C@H]1CCC[N@@H+](CC(F)F)C1 ZINC000308180021 370108652 /nfs/dbraw/zinc/10/86/52/370108652.db2.gz XXCYGDJTUNNGPX-QMMMGPOBSA-N 1 2 209.305 2.327 20 0 BEADLO OCc1ccccc1CNc1cccc[nH+]1 ZINC000112075728 370214319 /nfs/dbraw/zinc/21/43/19/370214319.db2.gz IVGYMMCCDFLCNB-UHFFFAOYSA-N 1 2 214.268 2.186 20 0 BEADLO F[C@H]1CC[N@H+](Cc2cncc(Cl)c2)C1 ZINC000621298790 370227810 /nfs/dbraw/zinc/22/78/10/370227810.db2.gz JRYFUWNJYGGAOV-JTQLQIEISA-N 1 2 214.671 2.279 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2cncc(Cl)c2)C1 ZINC000621298790 370227814 /nfs/dbraw/zinc/22/78/14/370227814.db2.gz JRYFUWNJYGGAOV-JTQLQIEISA-N 1 2 214.671 2.279 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)Cc1cncc(Cl)c1 ZINC000621270559 370201480 /nfs/dbraw/zinc/20/14/80/370201480.db2.gz CHDGOVUMGOFFRR-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO Cc1csc([C@H](C)[NH2+]Cc2cc(C)n[nH]2)n1 ZINC000309798218 370262139 /nfs/dbraw/zinc/26/21/39/370262139.db2.gz QQTLMCLVCNIBKL-VIFPVBQESA-N 1 2 236.344 2.334 20 0 BEADLO C[C@H](c1ccccc1F)[NH+]1CCN(C)CC1 ZINC000076574621 370321725 /nfs/dbraw/zinc/32/17/25/370321725.db2.gz XITJQXHSIYBIMP-LLVKDONJSA-N 1 2 222.307 2.134 20 0 BEADLO Cc1ncc(CN(C)c2cccc[nH+]2)s1 ZINC000076845077 370359533 /nfs/dbraw/zinc/35/95/33/370359533.db2.gz GWSNLHQJCSIYCK-UHFFFAOYSA-N 1 2 219.313 2.483 20 0 BEADLO CCc1cc(NC[C@H]2CCCC[C@@H]2O)nc[nH+]1 ZINC000077208387 370399523 /nfs/dbraw/zinc/39/95/23/370399523.db2.gz OTRAHNYFALYSBI-PWSUYJOCSA-N 1 2 235.331 2.002 20 0 BEADLO C[C@H]1CC[C@H](NC(=O)C(C)(C)c2c[nH]c[nH+]2)CC1 ZINC000621861737 370570938 /nfs/dbraw/zinc/57/09/38/370570938.db2.gz MPAZQSCMHCZAEH-XYPYZODXSA-N 1 2 249.358 2.382 20 0 BEADLO CCCC[C@@H](C(=O)NCc1[nH]cc[nH+]1)C(C)C ZINC000621865851 370572142 /nfs/dbraw/zinc/57/21/42/370572142.db2.gz ZJEDLBBBHMLELG-LLVKDONJSA-N 1 2 237.347 2.488 20 0 BEADLO CC(C)(C(=O)N1CCCC2(CC2)C1)c1c[nH+]c[nH]1 ZINC000621957863 370621786 /nfs/dbraw/zinc/62/17/86/370621786.db2.gz JLSLNATYIJVFLX-UHFFFAOYSA-N 1 2 247.342 2.090 20 0 BEADLO CCNC(=O)[C@@H](C)Nc1cc2ccccc2c[nH+]1 ZINC000631040071 370997129 /nfs/dbraw/zinc/99/71/29/370997129.db2.gz APKAHANZZSOFSV-SNVBAGLBSA-N 1 2 243.310 2.171 20 0 BEADLO CCCCc1cc(-n2cc[nH+]c2)ncn1 ZINC000631039602 370997742 /nfs/dbraw/zinc/99/77/42/370997742.db2.gz AGCLFGFWVAHXSZ-UHFFFAOYSA-N 1 2 202.261 2.005 20 0 BEADLO CCC[C@@H]1CN(c2nc(C)[nH+]cc2C)CCO1 ZINC000568664650 326372036 /nfs/dbraw/zinc/37/20/36/326372036.db2.gz XNQQCMGCMVVPTL-GFCCVEGCSA-N 1 2 235.331 2.099 20 0 BEADLO C[C@H](Nc1[nH+]c(C2CC2)nc2[nH]ccc21)C1CC1 ZINC000631041782 371005255 /nfs/dbraw/zinc/00/52/55/371005255.db2.gz MSGQVSVFLDBPNG-QMMMGPOBSA-N 1 2 242.326 2.468 20 0 BEADLO OC1CCN(c2cc3ccccc3c[nH+]2)CC1 ZINC000631043540 371009376 /nfs/dbraw/zinc/00/93/76/371009376.db2.gz RQPGYLZEFAXGKW-UHFFFAOYSA-N 1 2 228.295 2.196 20 0 BEADLO CC(C)(CO)Nc1[nH+]c(C2CC2)nc2[nH]ccc21 ZINC000631045477 371038168 /nfs/dbraw/zinc/03/81/68/371038168.db2.gz AGLVPFBVYMFMCJ-UHFFFAOYSA-N 1 2 246.314 2.018 20 0 BEADLO Cc1cc([NH2+][C@@H](C)[C@@H](C)O)cc(C)c1O ZINC000569096353 326389509 /nfs/dbraw/zinc/38/95/09/326389509.db2.gz ZRORLTALUAOKEU-VHSXEESVSA-N 1 2 209.289 2.190 20 0 BEADLO Cc1cc(F)ccc1C[NH2+]Cc1cocn1 ZINC000390509828 371210288 /nfs/dbraw/zinc/21/02/88/371210288.db2.gz YYWMNFPMWACFEH-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO COC(=O)[C@H]([NH2+][C@H]1C=CCCC1)C(C)(C)C ZINC000390649787 371224783 /nfs/dbraw/zinc/22/47/83/371224783.db2.gz OWZSPBKQXDFOSN-QWRGUYRKSA-N 1 2 225.332 2.272 20 0 BEADLO FC(F)c1ccc(C[NH2+]Cc2cc[nH]n2)cn1 ZINC000631067411 371276141 /nfs/dbraw/zinc/27/61/41/371276141.db2.gz KVQVXNKAUHABML-UHFFFAOYSA-N 1 2 238.241 2.032 20 0 BEADLO CCC(F)(F)C[NH2+][C@@H](C)c1cnn(C)c1 ZINC000624147835 371341393 /nfs/dbraw/zinc/34/13/93/371341393.db2.gz LZZWJHGBMHNNOJ-QMMMGPOBSA-N 1 2 217.263 2.116 20 0 BEADLO COc1ccc[nH+]c1NCCc1ccoc1 ZINC000624398889 371499467 /nfs/dbraw/zinc/49/94/67/371499467.db2.gz WPWYMYPBZYLVGB-UHFFFAOYSA-N 1 2 218.256 2.338 20 0 BEADLO CCC(C)(C)CC(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627369102 371587837 /nfs/dbraw/zinc/58/78/37/371587837.db2.gz KMJHITULKLXKQK-UHFFFAOYSA-N 1 2 235.331 2.121 20 0 BEADLO CCC(C)(C)CC(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627369102 371587845 /nfs/dbraw/zinc/58/78/45/371587845.db2.gz KMJHITULKLXKQK-UHFFFAOYSA-N 1 2 235.331 2.121 20 0 BEADLO CC[C@@H](CC(C)C)C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627372946 371591575 /nfs/dbraw/zinc/59/15/75/371591575.db2.gz AYHKSZIRLNCPCD-NSHDSACASA-N 1 2 249.358 2.367 20 0 BEADLO CC[C@@H](CC(C)C)C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627372946 371591584 /nfs/dbraw/zinc/59/15/84/371591584.db2.gz AYHKSZIRLNCPCD-NSHDSACASA-N 1 2 249.358 2.367 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CCC[C@@H]2CCC[C@H]21 ZINC000276639145 181835809 /nfs/dbraw/zinc/83/58/09/181835809.db2.gz UPHKWSRSTCMZCO-YRDGOHCCSA-N 1 2 245.326 2.214 20 0 BEADLO COC(=O)[C@@H]([NH2+][C@H]1CCc2ccccc21)C1CC1 ZINC000227768052 371933135 /nfs/dbraw/zinc/93/31/35/371933135.db2.gz RAAAGDAEZDQPCU-KBPBESRZSA-N 1 2 245.322 2.215 20 0 BEADLO Cc1ccccc1C[N@@H+]1CCCC(=O)C1 ZINC000134164709 372172855 /nfs/dbraw/zinc/17/28/55/372172855.db2.gz FKEMEQBTMQODGR-UHFFFAOYSA-N 1 2 203.285 2.160 20 0 BEADLO Cc1ccccc1C[N@H+]1CCCC(=O)C1 ZINC000134164709 372172857 /nfs/dbraw/zinc/17/28/57/372172857.db2.gz FKEMEQBTMQODGR-UHFFFAOYSA-N 1 2 203.285 2.160 20 0 BEADLO COC[C@@](C)(O)CNc1cc2ccccc2c[nH+]1 ZINC000631116155 372202859 /nfs/dbraw/zinc/20/28/59/372202859.db2.gz GZOJPPUQKMXNQD-AWEZNQCLSA-N 1 2 246.310 2.044 20 0 BEADLO Cc1scc(C[NH2+]CC(F)(F)CO)c1C ZINC000631114473 372202956 /nfs/dbraw/zinc/20/29/56/372202956.db2.gz ZZICPDVBDNJLKA-UHFFFAOYSA-N 1 2 235.299 2.082 20 0 BEADLO CCc1csc([C@H](C)Nc2cc[nH+]c(C)n2)n1 ZINC000631321076 372294967 /nfs/dbraw/zinc/29/49/67/372294967.db2.gz ZYTKVGCLDPQQEC-QMMMGPOBSA-N 1 2 248.355 2.399 20 0 BEADLO C[C@H](Nc1cc2ccccc2c[nH+]1)C(=O)N(C)C ZINC000631242146 372255061 /nfs/dbraw/zinc/25/50/61/372255061.db2.gz DODDJBBWUBVNIS-JTQLQIEISA-N 1 2 243.310 2.123 20 0 BEADLO CCCCc1cc(NC[C@H](OC)C2CC2)nc[nH+]1 ZINC000631283248 372276498 /nfs/dbraw/zinc/27/64/98/372276498.db2.gz ANISNSDMKIBKEE-ZDUSSCGKSA-N 1 2 249.358 2.078 20 0 BEADLO CCc1cc(N2CC[C@@H]2C(F)(F)F)nc(C)[nH+]1 ZINC000631343781 372304618 /nfs/dbraw/zinc/30/46/18/372304618.db2.gz PIAMVJAANNNOEK-SECBINFHSA-N 1 2 245.248 2.488 20 0 BEADLO CCC[C@H](CCO)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000631427094 372357582 /nfs/dbraw/zinc/35/75/82/372357582.db2.gz MFMDTHQXQOVHES-GFCCVEGCSA-N 1 2 249.358 2.047 20 0 BEADLO CC[C@@]1(O)CCCN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000631486796 372390212 /nfs/dbraw/zinc/39/02/12/372390212.db2.gz XMJLAEQFCCZGPT-CQSZACIVSA-N 1 2 247.342 2.095 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2C[C@@H](C)O[C@@H]2C)c(C)[nH+]1 ZINC000631743434 372544418 /nfs/dbraw/zinc/54/44/18/372544418.db2.gz UQTKDMFYNOKKTI-YUSALJHKSA-N 1 2 248.326 2.450 20 0 BEADLO O=C(COc1cc[nH+]cc1)Nc1ccc(F)cc1 ZINC000356086244 182004559 /nfs/dbraw/zinc/00/45/59/182004559.db2.gz BVOGOHGBXPJBGT-UHFFFAOYSA-N 1 2 246.241 2.238 20 0 BEADLO O=C(C[C@H]1C=CCCC1)NCCCn1cc[nH+]c1 ZINC000187293275 182025979 /nfs/dbraw/zinc/02/59/79/182025979.db2.gz LKQNBRQBJKAFOZ-ZDUSSCGKSA-N 1 2 247.342 2.136 20 0 BEADLO CC(C)c1nc(NCC(C)(C)CCO)cc[nH+]1 ZINC000172813515 373084644 /nfs/dbraw/zinc/08/46/44/373084644.db2.gz VYVKNKUHXPFZKK-UHFFFAOYSA-N 1 2 237.347 2.421 20 0 BEADLO O=C(NC1=[NH+]CCS1)C1=CCCCCC1 ZINC000127150578 182093058 /nfs/dbraw/zinc/09/30/58/182093058.db2.gz AYTNUHMPSGKZPP-UHFFFAOYSA-N 1 2 224.329 2.096 20 0 BEADLO CCC[C@@H](CC)NC(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000632950605 373230832 /nfs/dbraw/zinc/23/08/32/373230832.db2.gz NKDCUFYAHOAUJJ-SNVBAGLBSA-N 1 2 238.335 2.130 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)NCC1=CCCCC1 ZINC000633285154 373448987 /nfs/dbraw/zinc/44/89/87/373448987.db2.gz JPRBSUCFPJCAOW-UHFFFAOYSA-N 1 2 248.330 2.052 20 0 BEADLO O=C(NCC1CC1)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000171707474 182137375 /nfs/dbraw/zinc/13/73/75/182137375.db2.gz SPPQAVNRSQHOMH-LLVKDONJSA-N 1 2 248.330 2.056 20 0 BEADLO O=C(NCCCOc1cc[nH+]cc1)C1CCCC1 ZINC000274672873 182174042 /nfs/dbraw/zinc/17/40/42/182174042.db2.gz YFNBPUJLIVZVIA-UHFFFAOYSA-N 1 2 248.326 2.157 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@H]1CCCC12CC2 ZINC000633780738 373754237 /nfs/dbraw/zinc/75/42/37/373754237.db2.gz VAYPRJCSUNPBOI-CMPLNLGQSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@H]1CCCC12CC2 ZINC000633780738 373754243 /nfs/dbraw/zinc/75/42/43/373754243.db2.gz VAYPRJCSUNPBOI-CMPLNLGQSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H](CC(=O)N[C@H]1CCCC12CC2)n1cc[nH+]c1 ZINC000633781571 373756839 /nfs/dbraw/zinc/75/68/39/373756839.db2.gz XXLNGENCSGWCIY-NEPJUHHUSA-N 1 2 247.342 2.283 20 0 BEADLO CNc1cc(CNc2nccs2)cc[nH+]1 ZINC001643214485 1172449762 /nfs/dbraw/zinc/44/97/62/1172449762.db2.gz ZWASDBPWEQYSMI-UHFFFAOYSA-N 1 2 220.301 2.192 20 0 BEADLO O=C(NCCNc1cccc[nH+]1)OC1CCCC1 ZINC000289259441 182189572 /nfs/dbraw/zinc/18/95/72/182189572.db2.gz YEYIVRKVYFVPLB-UHFFFAOYSA-N 1 2 249.314 2.162 20 0 BEADLO CCC(C)(C)CCNC(=O)c1c[nH+]c(C)[nH]1 ZINC000633966291 373863340 /nfs/dbraw/zinc/86/33/40/373863340.db2.gz AKAYACIEDUOQHJ-UHFFFAOYSA-N 1 2 223.320 2.274 20 0 BEADLO O=C(NCCc1[nH]cc[nH+]1)C1CCCCCC1 ZINC000135488254 182211570 /nfs/dbraw/zinc/21/15/70/182211570.db2.gz WHBXIFZOOACVHL-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)Nc1ccsc1C ZINC000634218632 374039514 /nfs/dbraw/zinc/03/95/14/374039514.db2.gz ZMHKNKWBZDXFKA-UHFFFAOYSA-N 1 2 235.312 2.269 20 0 BEADLO Cc1sccc1NC(=O)CCc1[nH]cc[nH+]1 ZINC000634218336 374039554 /nfs/dbraw/zinc/03/95/54/374039554.db2.gz SJBJVANHQZEJPU-UHFFFAOYSA-N 1 2 235.312 2.351 20 0 BEADLO CCCCNC(=O)[C@H](C)[NH+]1Cc2ccccc2C1 ZINC000155466185 168858152 /nfs/dbraw/zinc/85/81/52/168858152.db2.gz WHZVNUIUFKUBQP-LBPRGKRZSA-N 1 2 246.354 2.307 20 0 BEADLO CC(C)(CCCO)CNc1cccc[nH+]1 ZINC000221182664 206008365 /nfs/dbraw/zinc/00/83/65/206008365.db2.gz KRSMTFAHKIMENJ-UHFFFAOYSA-N 1 2 208.305 2.292 20 0 BEADLO Cn1ccnc1C[NH2+][C@H]1C[C@]1(F)c1ccccc1 ZINC000424192670 206034112 /nfs/dbraw/zinc/03/41/12/206034112.db2.gz JOIIRBUKCSZSOA-JSGCOSHPSA-N 1 2 245.301 2.147 20 0 BEADLO Cn1cc[nH+]c1CN[C@H]1C[C@]1(F)c1ccccc1 ZINC000424192670 206034115 /nfs/dbraw/zinc/03/41/15/206034115.db2.gz JOIIRBUKCSZSOA-JSGCOSHPSA-N 1 2 245.301 2.147 20 0 BEADLO CC[C@H](O)CCNc1cc[nH+]c(C(C)C)n1 ZINC000154683467 206066295 /nfs/dbraw/zinc/06/62/95/206066295.db2.gz AEULCYSQIUBDAT-JTQLQIEISA-N 1 2 223.320 2.173 20 0 BEADLO CSCC[N@H+](C)Cc1csc(C)n1 ZINC000194411633 206091743 /nfs/dbraw/zinc/09/17/43/206091743.db2.gz YOMAVJYWBNLLLF-UHFFFAOYSA-N 1 2 216.375 2.246 20 0 BEADLO CSCC[N@@H+](C)Cc1csc(C)n1 ZINC000194411633 206091745 /nfs/dbraw/zinc/09/17/45/206091745.db2.gz YOMAVJYWBNLLLF-UHFFFAOYSA-N 1 2 216.375 2.246 20 0 BEADLO CC[C@H](F)C[NH2+][C@H](CO)c1c(F)cccc1F ZINC000440482852 206078293 /nfs/dbraw/zinc/07/82/93/206078293.db2.gz DRUSTEDNRTVSOP-GZMMTYOYSA-N 1 2 247.260 2.336 20 0 BEADLO C[C@@H]1CN(c2cc[nH+]c(C3CC3)n2)[C@H](C)[C@H](C)O1 ZINC000445677470 206085053 /nfs/dbraw/zinc/08/50/53/206085053.db2.gz XLBCBGRXFNILOS-MXWKQRLJSA-N 1 2 247.342 2.356 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)c1ccco1 ZINC000355323161 182384606 /nfs/dbraw/zinc/38/46/06/182384606.db2.gz WLVWLDMVTABCBQ-UHFFFAOYSA-N 1 2 227.223 2.180 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)[C@@H]1CCCS1 ZINC000294775364 182385656 /nfs/dbraw/zinc/38/56/56/182385656.db2.gz BGUSEQQRCVEDMQ-JTQLQIEISA-N 1 2 247.323 2.168 20 0 BEADLO CCOC(=O)C(C)(C)[N@H+](C)CCC(F)(F)F ZINC000339787247 170186001 /nfs/dbraw/zinc/18/60/01/170186001.db2.gz XSLIFALHZNYMSX-UHFFFAOYSA-N 1 2 241.253 2.212 20 0 BEADLO CCOC(=O)C(C)(C)[N@@H+](C)CCC(F)(F)F ZINC000339787247 170186003 /nfs/dbraw/zinc/18/60/03/170186003.db2.gz XSLIFALHZNYMSX-UHFFFAOYSA-N 1 2 241.253 2.212 20 0 BEADLO OCC(F)(F)C[NH2+]CCc1ccc(Cl)cc1 ZINC000336663127 183033443 /nfs/dbraw/zinc/03/34/43/183033443.db2.gz CQSMLLBJFNWBJW-UHFFFAOYSA-N 1 2 249.688 2.100 20 0 BEADLO OCC1(CNc2cc[nH+]c(C3CC3)n2)CCCC1 ZINC000302272186 183036693 /nfs/dbraw/zinc/03/66/93/183036693.db2.gz SESJGCUQZXPBRY-UHFFFAOYSA-N 1 2 247.342 2.319 20 0 BEADLO OCCNc1[nH+]cccc1OCc1ccccc1 ZINC000354529496 183080936 /nfs/dbraw/zinc/08/09/36/183080936.db2.gz TZIGPHVRNAOQIS-UHFFFAOYSA-N 1 2 244.294 2.065 20 0 BEADLO OCC[C@@H]1CCC[C@@H]1Nc1cccc[nH+]1 ZINC000275024818 183092471 /nfs/dbraw/zinc/09/24/71/183092471.db2.gz MZKBWYOIKVJQDR-QWRGUYRKSA-N 1 2 206.289 2.045 20 0 BEADLO OCC[C@@H]1CCC[C@@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000275016981 183093029 /nfs/dbraw/zinc/09/30/29/183093029.db2.gz LCBJHMZSHRZOHI-JQWIXIFHSA-N 1 2 247.342 2.317 20 0 BEADLO OCC[C@@H]1CCC[C@H]1Nc1cccc[nH+]1 ZINC000275024821 183094580 /nfs/dbraw/zinc/09/45/80/183094580.db2.gz MZKBWYOIKVJQDR-WDEREUQCSA-N 1 2 206.289 2.045 20 0 BEADLO OC[C@@H]1CCC[N@H+](Cc2csc(Cl)n2)C1 ZINC000290165396 183117826 /nfs/dbraw/zinc/11/78/26/183117826.db2.gz XWXRTLFYYKNHNO-MRVPVSSYSA-N 1 2 246.763 2.001 20 0 BEADLO OC[C@@H]1CCC[N@@H+](Cc2csc(Cl)n2)C1 ZINC000290165396 183117828 /nfs/dbraw/zinc/11/78/28/183117828.db2.gz XWXRTLFYYKNHNO-MRVPVSSYSA-N 1 2 246.763 2.001 20 0 BEADLO OC[C@@H](CC1CCC1)Nc1cccc[nH+]1 ZINC000280267927 183104019 /nfs/dbraw/zinc/10/40/19/183104019.db2.gz OMMINHDJGJWOBQ-LLVKDONJSA-N 1 2 206.289 2.045 20 0 BEADLO CCCC[S@](=O)Cc1cn2ccccc2[nH+]1 ZINC000086969546 169017119 /nfs/dbraw/zinc/01/71/19/169017119.db2.gz SRZBQDRVFSYUFF-MRXNPFEDSA-N 1 2 236.340 2.383 20 0 BEADLO OC[C@@]1(F)CCC[N@H+](Cc2cccc(F)c2)C1 ZINC000286821533 183134127 /nfs/dbraw/zinc/13/41/27/183134127.db2.gz KLKOCDYIMKEXGE-CYBMUJFWSA-N 1 2 241.281 2.122 20 0 BEADLO OC[C@@]1(F)CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000286821533 183134128 /nfs/dbraw/zinc/13/41/28/183134128.db2.gz KLKOCDYIMKEXGE-CYBMUJFWSA-N 1 2 241.281 2.122 20 0 BEADLO OC[C@H]1CCC[C@H](CNc2cccc[nH+]2)C1 ZINC000348230929 183151797 /nfs/dbraw/zinc/15/17/97/183151797.db2.gz RQYNQMMATMPTJJ-RYUDHWBXSA-N 1 2 220.316 2.292 20 0 BEADLO OC[C@]1(F)CCC[N@H+](Cc2ccccc2F)C1 ZINC000286766417 183157863 /nfs/dbraw/zinc/15/78/63/183157863.db2.gz GFXXBQSNNNUOLZ-ZDUSSCGKSA-N 1 2 241.281 2.122 20 0 BEADLO OC[C@]1(F)CCC[N@@H+](Cc2ccccc2F)C1 ZINC000286766417 183157864 /nfs/dbraw/zinc/15/78/64/183157864.db2.gz GFXXBQSNNNUOLZ-ZDUSSCGKSA-N 1 2 241.281 2.122 20 0 BEADLO OCc1ccc(C[N@@H+]2CCC[C@@H]2C(F)F)cc1 ZINC000353184484 183163608 /nfs/dbraw/zinc/16/36/08/183163608.db2.gz RVHZDKMKFHVUSU-GFCCVEGCSA-N 1 2 241.281 2.408 20 0 BEADLO OCc1ccc(C[N@H+]2CCC[C@@H]2C(F)F)cc1 ZINC000353184484 183163609 /nfs/dbraw/zinc/16/36/09/183163609.db2.gz RVHZDKMKFHVUSU-GFCCVEGCSA-N 1 2 241.281 2.408 20 0 BEADLO O[C@@H](Cc1cccc(Cl)c1)Cn1cc[nH+]c1 ZINC000287563830 183182943 /nfs/dbraw/zinc/18/29/43/183182943.db2.gz BIBSZETUXYFMKW-LBPRGKRZSA-N 1 2 236.702 2.140 20 0 BEADLO O[C@@H]1CCCC[C@H]1CNc1cccc[nH+]1 ZINC000077208288 183190349 /nfs/dbraw/zinc/19/03/49/183190349.db2.gz XYUQNZIYORXHSP-WDEREUQCSA-N 1 2 206.289 2.045 20 0 BEADLO CCC[N@H+](CC(=O)OC)Cc1ccc(F)cc1 ZINC000050065662 169100343 /nfs/dbraw/zinc/10/03/43/169100343.db2.gz SCYSORZXWISCGG-UHFFFAOYSA-N 1 2 239.290 2.211 20 0 BEADLO CCC[N@@H+](CC(=O)OC)Cc1ccc(F)cc1 ZINC000050065662 169100345 /nfs/dbraw/zinc/10/03/45/169100345.db2.gz SCYSORZXWISCGG-UHFFFAOYSA-N 1 2 239.290 2.211 20 0 BEADLO O[C@H](CNc1cccc[nH+]1)C1CCCCC1 ZINC000006119005 183226422 /nfs/dbraw/zinc/22/64/22/183226422.db2.gz AWBDNFNPUYFLNI-GFCCVEGCSA-N 1 2 220.316 2.435 20 0 BEADLO CCC[N@H+](CC(=O)OCC)Cc1ccco1 ZINC000050052192 169101593 /nfs/dbraw/zinc/10/15/93/169101593.db2.gz KRYZNDAZGABYAM-UHFFFAOYSA-N 1 2 225.288 2.055 20 0 BEADLO CCC[N@@H+](CC(=O)OCC)Cc1ccco1 ZINC000050052192 169101594 /nfs/dbraw/zinc/10/15/94/169101594.db2.gz KRYZNDAZGABYAM-UHFFFAOYSA-N 1 2 225.288 2.055 20 0 BEADLO CCC[N@H+](C)[C@@H](C(=O)OC)c1ccsc1 ZINC000280080532 169086996 /nfs/dbraw/zinc/08/69/96/169086996.db2.gz RGLAZRDZCJJWHB-SNVBAGLBSA-N 1 2 227.329 2.304 20 0 BEADLO CCC[N@@H+](C)[C@@H](C(=O)OC)c1ccsc1 ZINC000280080532 169086997 /nfs/dbraw/zinc/08/69/97/169086997.db2.gz RGLAZRDZCJJWHB-SNVBAGLBSA-N 1 2 227.329 2.304 20 0 BEADLO CCCN(C)c1nc(N)c2ccccc2[nH+]1 ZINC000301858160 169090385 /nfs/dbraw/zinc/09/03/85/169090385.db2.gz DROTXFDCOZWGPT-UHFFFAOYSA-N 1 2 216.288 2.058 20 0 BEADLO CCC[N@H+](CC(=O)OC)Cc1ccsc1C ZINC000294845364 169101890 /nfs/dbraw/zinc/10/18/90/169101890.db2.gz IHKPRIXEUSKXBM-UHFFFAOYSA-N 1 2 241.356 2.442 20 0 BEADLO CCC[N@@H+](CC(=O)OC)Cc1ccsc1C ZINC000294845364 169101891 /nfs/dbraw/zinc/10/18/91/169101891.db2.gz IHKPRIXEUSKXBM-UHFFFAOYSA-N 1 2 241.356 2.442 20 0 BEADLO O[C@H]1CCCC[C@@H]1CNc1cc[nH+]c(C2CC2)n1 ZINC000156858616 183231934 /nfs/dbraw/zinc/23/19/34/183231934.db2.gz SUOZBZORQZQEIM-NEPJUHHUSA-N 1 2 247.342 2.317 20 0 BEADLO CCCN(CC(F)F)c1cc[nH+]c(C)n1 ZINC000266382776 169108911 /nfs/dbraw/zinc/10/89/11/169108911.db2.gz NDCFIBQSKMBKCK-UHFFFAOYSA-N 1 2 215.247 2.267 20 0 BEADLO CCCN(CC)C(=O)Cc1cn2ccccc2[nH+]1 ZINC000298290093 169112309 /nfs/dbraw/zinc/11/23/09/169112309.db2.gz GXVIKRHZAHIHFK-UHFFFAOYSA-N 1 2 245.326 2.135 20 0 BEADLO O[C@H]1CC[C@H](CNc2cc[nH+]c3ccncc23)C1 ZINC000276866939 183242306 /nfs/dbraw/zinc/24/23/06/183242306.db2.gz JCAFZECJKNBWBS-QWRGUYRKSA-N 1 2 243.310 2.203 20 0 BEADLO CCCN(CC)C(=O)c1ccc2[nH+]ccn2c1 ZINC000263991734 169118559 /nfs/dbraw/zinc/11/85/59/169118559.db2.gz HJRFLEOIXGGMFD-UHFFFAOYSA-N 1 2 231.299 2.206 20 0 BEADLO O[C@H]1CCC[N@H+](Cc2ncc(Cl)s2)CC1 ZINC000336365109 183235302 /nfs/dbraw/zinc/23/53/02/183235302.db2.gz QAWWQDANGKKROE-QMMMGPOBSA-N 1 2 246.763 2.143 20 0 BEADLO O[C@H]1CCC[N@@H+](Cc2ncc(Cl)s2)CC1 ZINC000336365109 183235303 /nfs/dbraw/zinc/23/53/03/183235303.db2.gz QAWWQDANGKKROE-QMMMGPOBSA-N 1 2 246.763 2.143 20 0 BEADLO CCCN(CC1CC1)C(=O)CCc1c[nH+]cn1C ZINC000276745902 169135314 /nfs/dbraw/zinc/13/53/14/169135314.db2.gz VIVNKSRGDHDLBA-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO CCCN(CC1CC1)c1cc(C)[nH+]cn1 ZINC000301775454 169138707 /nfs/dbraw/zinc/13/87/07/169138707.db2.gz LCFPNLVVOMKBQI-UHFFFAOYSA-N 1 2 205.305 2.411 20 0 BEADLO CCCN(CCC)C(=O)CCc1c[nH+]cn1C ZINC000276679137 169141562 /nfs/dbraw/zinc/14/15/62/169141562.db2.gz OOADMMXMMXGAHI-UHFFFAOYSA-N 1 2 237.347 2.001 20 0 BEADLO Oc1cccc2c1CC[C@@H]2[NH2+]Cc1cocn1 ZINC000277068594 183295382 /nfs/dbraw/zinc/29/53/82/183295382.db2.gz SDJNLPDGMRPICL-LBPRGKRZSA-N 1 2 230.267 2.157 20 0 BEADLO c1c[nH]c(C[NH2+][C@H]2CCCc3occc32)n1 ZINC000049714780 183324735 /nfs/dbraw/zinc/32/47/35/183324735.db2.gz BKSDOAFDPAVMQY-JTQLQIEISA-N 1 2 217.272 2.170 20 0 BEADLO c1c[nH+]c(CN2CCO[C@@H](C3CCCCC3)C2)[nH]1 ZINC000336526641 183324833 /nfs/dbraw/zinc/32/48/33/183324833.db2.gz IZYFXFCFHKZBRJ-CYBMUJFWSA-N 1 2 249.358 2.191 20 0 BEADLO c1c[nH]c([C@@H]2CCC[N@H+]2Cc2ccon2)c1 ZINC000077266748 183327500 /nfs/dbraw/zinc/32/75/00/183327500.db2.gz CHAJOABVWVCNGF-LBPRGKRZSA-N 1 2 217.272 2.340 20 0 BEADLO c1c[nH]c([C@@H]2CCC[N@@H+]2Cc2ccon2)c1 ZINC000077266748 183327503 /nfs/dbraw/zinc/32/75/03/183327503.db2.gz CHAJOABVWVCNGF-LBPRGKRZSA-N 1 2 217.272 2.340 20 0 BEADLO c1c[nH]c([C@H]2CCC[N@H+]2Cc2ccon2)c1 ZINC000077266756 183328657 /nfs/dbraw/zinc/32/86/57/183328657.db2.gz CHAJOABVWVCNGF-GFCCVEGCSA-N 1 2 217.272 2.340 20 0 BEADLO c1c[nH]c([C@H]2CCC[N@@H+]2Cc2ccon2)c1 ZINC000077266756 183328661 /nfs/dbraw/zinc/32/86/61/183328661.db2.gz CHAJOABVWVCNGF-GFCCVEGCSA-N 1 2 217.272 2.340 20 0 BEADLO c1cn(-c2cccc(NC3CCOCC3)c2)c[nH+]1 ZINC000036939810 183356935 /nfs/dbraw/zinc/35/69/35/183356935.db2.gz PSUUTVXEXCDFSI-UHFFFAOYSA-N 1 2 243.310 2.463 20 0 BEADLO c1cc(NCCOCC2CC2)nc(C2CC2)[nH+]1 ZINC000264701495 183357375 /nfs/dbraw/zinc/35/73/75/183357375.db2.gz FCWHWMDOGJIHKI-UHFFFAOYSA-N 1 2 233.315 2.193 20 0 BEADLO c1ccc(-c2noc([C@H]3CSCC[NH2+]3)n2)cc1 ZINC000096881133 183385549 /nfs/dbraw/zinc/38/55/49/183385549.db2.gz QFLDFTGRWDYWMQ-SNVBAGLBSA-N 1 2 247.323 2.114 20 0 BEADLO c1cc2c(o1)CCC[C@H]2[NH2+]Cc1csnn1 ZINC000036902151 183373713 /nfs/dbraw/zinc/37/37/13/183373713.db2.gz TXZMAGFQSYQJQS-SNVBAGLBSA-N 1 2 235.312 2.298 20 0 BEADLO c1c[nH]c(-c2ccccc2-c2[nH]cc[nH+]2)n1 ZINC000089202467 183383213 /nfs/dbraw/zinc/38/32/13/183383213.db2.gz QXMZYQGRCGIDGJ-UHFFFAOYSA-N 1 2 210.240 2.467 20 0 BEADLO c1cc([C@@H]2CCC[N@@H+](CCOC3CCC3)C2)[nH]n1 ZINC000376511268 183361322 /nfs/dbraw/zinc/36/13/22/183361322.db2.gz LEBIEQGGXSXUFL-GFCCVEGCSA-N 1 2 249.358 2.158 20 0 BEADLO c1cc([C@@H]2CCC[N@H+](CCOC3CCC3)C2)[nH]n1 ZINC000376511268 183361323 /nfs/dbraw/zinc/36/13/23/183361323.db2.gz LEBIEQGGXSXUFL-GFCCVEGCSA-N 1 2 249.358 2.158 20 0 BEADLO CCC[NH2+][C@@H](c1nnc[nH]1)c1ccc(F)cc1 ZINC000087880433 169289851 /nfs/dbraw/zinc/28/98/51/169289851.db2.gz SPERVBFXKHOJDT-LLVKDONJSA-N 1 2 234.278 2.033 20 0 BEADLO c1cc(C[NH2+]C2(Cc3ccccc3)CC2)[nH]n1 ZINC000187493782 183390705 /nfs/dbraw/zinc/39/07/05/183390705.db2.gz HMRXWEUATAPMIK-UHFFFAOYSA-N 1 2 227.311 2.275 20 0 BEADLO c1cc(C[N@H+](Cc2ccccn2)C2CC2)on1 ZINC000272497943 183396992 /nfs/dbraw/zinc/39/69/92/183396992.db2.gz GEFFDHACGISHTO-UHFFFAOYSA-N 1 2 229.283 2.234 20 0 BEADLO c1cc(C[N@@H+](Cc2ccccn2)C2CC2)on1 ZINC000272497943 183396995 /nfs/dbraw/zinc/39/69/95/183396995.db2.gz GEFFDHACGISHTO-UHFFFAOYSA-N 1 2 229.283 2.234 20 0 BEADLO CCCOCC(=O)Nc1ccc(C)[nH+]c1C ZINC000119232116 169307456 /nfs/dbraw/zinc/30/74/56/169307456.db2.gz JFTRYJFSEJRQGQ-UHFFFAOYSA-N 1 2 222.288 2.064 20 0 BEADLO CCCOCc1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000273999324 169311349 /nfs/dbraw/zinc/31/13/49/169311349.db2.gz USEXXBVVSOKAKJ-UHFFFAOYSA-N 1 2 247.298 2.290 20 0 BEADLO CCCSCC(=O)Nc1cc[nH+]cc1C ZINC000107294770 169338883 /nfs/dbraw/zinc/33/88/83/169338883.db2.gz GFJJENHKGBZJIE-UHFFFAOYSA-N 1 2 224.329 2.472 20 0 BEADLO CCC[C@@H](C)CC(=O)NCc1[nH]c[nH+]c1C ZINC000266990637 169356112 /nfs/dbraw/zinc/35/61/12/169356112.db2.gz UYDVXOVQWYBBQE-SECBINFHSA-N 1 2 223.320 2.161 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@H](C)C2)ccc1F ZINC000179863401 134324545 /nfs/dbraw/zinc/32/45/45/134324545.db2.gz HYNVUOTVHOYBNX-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@H](C)C2)ccc1F ZINC000179863401 134324546 /nfs/dbraw/zinc/32/45/46/134324546.db2.gz HYNVUOTVHOYBNX-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO CCC[C@@H]([NH2+]CC(=O)OC)c1ccccc1 ZINC000019885739 169399545 /nfs/dbraw/zinc/39/95/45/169399545.db2.gz ABGMJLGFKRJDEG-GFCCVEGCSA-N 1 2 221.300 2.290 20 0 BEADLO CCc1cn(Cc2c(C)noc2CC)c[nH+]1 ZINC001644229459 1172534964 /nfs/dbraw/zinc/53/49/64/1172534964.db2.gz DONQFVFBCSYMBE-UHFFFAOYSA-N 1 2 219.288 2.353 20 0 BEADLO CCC[C@H](OC)C(=O)Nc1cc[nH+]cc1CC ZINC000295856164 169521779 /nfs/dbraw/zinc/52/17/79/169521779.db2.gz OBRIORAKBQLXHA-LBPRGKRZSA-N 1 2 236.315 2.398 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+]Cc2c(C)noc2C)o1 ZINC000220920852 383825798 /nfs/dbraw/zinc/82/57/98/383825798.db2.gz CWBIQGUXTFBSKW-SECBINFHSA-N 1 2 235.287 2.439 20 0 BEADLO Cc1c[nH+]cc(N[C@@H]2C[C@H](C)O[C@@H]2C)c1 ZINC000295863668 383866404 /nfs/dbraw/zinc/86/64/04/383866404.db2.gz WYORFOFJIGZRDH-HOSYDEDBSA-N 1 2 206.289 2.368 20 0 BEADLO CC[C@H]([NH2+]Cc1c[nH]nn1)c1ccccc1 ZINC000295884806 383874346 /nfs/dbraw/zinc/87/43/46/383874346.db2.gz AYYIBKLNFQRSSD-LBPRGKRZSA-N 1 2 216.288 2.046 20 0 BEADLO CC[C@H]([NH2+]Cc1cn[nH]n1)c1ccccc1 ZINC000295884806 383874353 /nfs/dbraw/zinc/87/43/53/383874353.db2.gz AYYIBKLNFQRSSD-LBPRGKRZSA-N 1 2 216.288 2.046 20 0 BEADLO c1snnc1C[NH2+][C@@H]1CCc2ccccc21 ZINC000036902050 383921467 /nfs/dbraw/zinc/92/14/67/383921467.db2.gz YRBOUKVFKZQHKN-GFCCVEGCSA-N 1 2 231.324 2.315 20 0 BEADLO CC[C@H]([NH2+]Cc1cncc(F)c1)C(F)F ZINC000449361905 383979146 /nfs/dbraw/zinc/97/91/46/383979146.db2.gz LRVYKVXADURWED-VIFPVBQESA-N 1 2 218.222 2.354 20 0 BEADLO CC[C@H]([NH2+]Cc1cnn2ccccc12)C(F)F ZINC000449361532 383979457 /nfs/dbraw/zinc/97/94/57/383979457.db2.gz KWWPZICFZMAHDQ-JTQLQIEISA-N 1 2 239.269 2.468 20 0 BEADLO CCc1ccc(C[NH2+]C(C)(C)C(=O)OC)cc1 ZINC000037085259 383939147 /nfs/dbraw/zinc/93/91/47/383939147.db2.gz SPRCDEPISBVDEQ-UHFFFAOYSA-N 1 2 235.327 2.290 20 0 BEADLO CC[C@@H](C)[C@H](C)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000569412181 384000152 /nfs/dbraw/zinc/00/01/52/384000152.db2.gz OYRDPUPBZVFEMB-KXUCPTDWSA-N 1 2 223.320 2.269 20 0 BEADLO Cc1csc(C[N@@H+]2CCO[C@@H]3CCC[C@@H]32)n1 ZINC000268000109 383951636 /nfs/dbraw/zinc/95/16/36/383951636.db2.gz CQILQUYEOOJKSH-WDEREUQCSA-N 1 2 238.356 2.205 20 0 BEADLO Cc1csc(C[N@H+]2CCO[C@@H]3CCC[C@@H]32)n1 ZINC000268000109 383951644 /nfs/dbraw/zinc/95/16/44/383951644.db2.gz CQILQUYEOOJKSH-WDEREUQCSA-N 1 2 238.356 2.205 20 0 BEADLO C[C@@H]1C[C@@H]([NH2+]Cc2ccccn2)c2nccn21 ZINC000345353412 383952461 /nfs/dbraw/zinc/95/24/61/383952461.db2.gz KJOVJJVHLFPLDJ-ZYHUDNBSSA-N 1 2 228.299 2.074 20 0 BEADLO FC1(F)CC[C@@H](CN2CC[NH+](C3CC3)CC2)C1 ZINC000336471268 383963796 /nfs/dbraw/zinc/96/37/96/383963796.db2.gz IXNLQMIFIJQHJI-LLVKDONJSA-N 1 2 244.329 2.202 20 0 BEADLO Cc1csc(C[N@@H+]2CCOC[C@H]2C2CC2)n1 ZINC000090009964 384020982 /nfs/dbraw/zinc/02/09/82/384020982.db2.gz GEMUZRBXUOQFKI-NSHDSACASA-N 1 2 238.356 2.062 20 0 BEADLO Cc1csc(C[N@H+]2CCOC[C@H]2C2CC2)n1 ZINC000090009964 384020988 /nfs/dbraw/zinc/02/09/88/384020988.db2.gz GEMUZRBXUOQFKI-NSHDSACASA-N 1 2 238.356 2.062 20 0 BEADLO Cc1ccc(F)c(OCc2c[nH+]cn2C)c1 ZINC000090233701 384039854 /nfs/dbraw/zinc/03/98/54/384039854.db2.gz CGWNGAOJSYKTGX-UHFFFAOYSA-N 1 2 220.247 2.447 20 0 BEADLO CC[C@H](C[N@@H+]1CCOC[C@@H]1c1ccco1)OC ZINC000642687309 384067532 /nfs/dbraw/zinc/06/75/32/384067532.db2.gz GIFMUKZTALCGQS-VXGBXAGGSA-N 1 2 239.315 2.078 20 0 BEADLO CC[C@H](C[N@H+]1CCOC[C@@H]1c1ccco1)OC ZINC000642687309 384067537 /nfs/dbraw/zinc/06/75/37/384067537.db2.gz GIFMUKZTALCGQS-VXGBXAGGSA-N 1 2 239.315 2.078 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@H](CC)CSC)no1 ZINC000091099270 384102745 /nfs/dbraw/zinc/10/27/45/384102745.db2.gz VLHBSLQHVCGYLV-SECBINFHSA-N 1 2 243.376 2.205 20 0 BEADLO CCc1nc(C[N@H+](C)[C@H](CC)CSC)no1 ZINC000091099270 384102752 /nfs/dbraw/zinc/10/27/52/384102752.db2.gz VLHBSLQHVCGYLV-SECBINFHSA-N 1 2 243.376 2.205 20 0 BEADLO COC(=O)[C@@H]([NH2+][C@H](C)c1ccccc1)C1CC1 ZINC000115996476 384112479 /nfs/dbraw/zinc/11/24/79/384112479.db2.gz KEQVOAWPFMVSML-MFKMUULPSA-N 1 2 233.311 2.289 20 0 BEADLO Fc1ccc2c(c1F)C[N@H+]([C@H]1CCOC1)CC2 ZINC000336553831 384125363 /nfs/dbraw/zinc/12/53/63/384125363.db2.gz MUTOIJRQLSORBI-JTQLQIEISA-N 1 2 239.265 2.112 20 0 BEADLO Fc1ccc2c(c1F)C[N@@H+]([C@H]1CCOC1)CC2 ZINC000336553831 384125368 /nfs/dbraw/zinc/12/53/68/384125368.db2.gz MUTOIJRQLSORBI-JTQLQIEISA-N 1 2 239.265 2.112 20 0 BEADLO CCOC(=O)c1coc(C[N@@H+]2CC[C@H](F)C2)c1 ZINC000449390304 384147175 /nfs/dbraw/zinc/14/71/75/384147175.db2.gz GFNGYKHGZGGJJA-JTQLQIEISA-N 1 2 241.262 2.000 20 0 BEADLO CCOC(=O)c1coc(C[N@H+]2CC[C@H](F)C2)c1 ZINC000449390304 384147177 /nfs/dbraw/zinc/14/71/77/384147177.db2.gz GFNGYKHGZGGJJA-JTQLQIEISA-N 1 2 241.262 2.000 20 0 BEADLO CC(C)c1ccc(C(=O)NCc2[nH]cc[nH+]2)cc1 ZINC000070990176 384146003 /nfs/dbraw/zinc/14/60/03/384146003.db2.gz RGNOPIAOSKTJMZ-UHFFFAOYSA-N 1 2 243.310 2.463 20 0 BEADLO CC(C)[C@@H](CO)Nc1[nH+]c2ccccc2n1C ZINC000092401607 384178440 /nfs/dbraw/zinc/17/84/40/384178440.db2.gz JBNSCPIWKOMSNF-LLVKDONJSA-N 1 2 233.315 2.002 20 0 BEADLO C[N@H+](Cc1ccsc1)Cc1cnccn1 ZINC000092591734 384185775 /nfs/dbraw/zinc/18/57/75/384185775.db2.gz SQHYIZGEVHRGNB-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO C[N@@H+](Cc1ccsc1)Cc1cnccn1 ZINC000092591734 384185777 /nfs/dbraw/zinc/18/57/77/384185777.db2.gz SQHYIZGEVHRGNB-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO c1[nH]cc(NCCCc2ccc3c(c2)CCO3)[nH+]1 ZINC000558575627 384187803 /nfs/dbraw/zinc/18/78/03/384187803.db2.gz RVHANRZGAPYIQV-UHFFFAOYSA-N 1 2 243.310 2.389 20 0 BEADLO Cc1n[nH]cc1C[N@@H+]1CCCC[C@H]1c1ncc[nH]1 ZINC000092730038 384192096 /nfs/dbraw/zinc/19/20/96/384192096.db2.gz VBXPTFGLBBHDOE-LBPRGKRZSA-N 1 2 245.330 2.168 20 0 BEADLO Cc1n[nH]cc1C[N@H+]1CCCC[C@H]1c1ncc[nH]1 ZINC000092730038 384192100 /nfs/dbraw/zinc/19/21/00/384192100.db2.gz VBXPTFGLBBHDOE-LBPRGKRZSA-N 1 2 245.330 2.168 20 0 BEADLO COc1ccc[nH+]c1NCc1csc(C)n1 ZINC000159448478 384192217 /nfs/dbraw/zinc/19/22/17/384192217.db2.gz ICLATHOWLCWAKF-UHFFFAOYSA-N 1 2 235.312 2.467 20 0 BEADLO C/C(=C/c1ccccc1)C[NH2+]Cc1ncn(C)n1 ZINC000092851632 384197679 /nfs/dbraw/zinc/19/76/79/384197679.db2.gz KSJMFTUPRFCRCE-WQLSENKSSA-N 1 2 242.326 2.008 20 0 BEADLO CCCCOCC(=O)Nc1cc[nH+]c(C)c1 ZINC000118340254 384197878 /nfs/dbraw/zinc/19/78/78/384197878.db2.gz MDHREIHOJKMAGG-UHFFFAOYSA-N 1 2 222.288 2.145 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)Nc1cccc(Cl)n1 ZINC000082461279 384226031 /nfs/dbraw/zinc/22/60/31/384226031.db2.gz KUHIMOGNYUDALB-SECBINFHSA-N 1 2 236.706 2.432 20 0 BEADLO CC(C)C[C@@H]1COCC[N@@H+]1Cc1cncs1 ZINC000093340052 384228730 /nfs/dbraw/zinc/22/87/30/384228730.db2.gz NPQNGUPWRXVSNT-LLVKDONJSA-N 1 2 240.372 2.390 20 0 BEADLO CC(C)C[C@@H]1COCC[N@H+]1Cc1cncs1 ZINC000093340052 384228735 /nfs/dbraw/zinc/22/87/35/384228735.db2.gz NPQNGUPWRXVSNT-LLVKDONJSA-N 1 2 240.372 2.390 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCS[C@H](C)[C@@H]1C ZINC000093501709 384245649 /nfs/dbraw/zinc/24/56/49/384245649.db2.gz RFPVCHKRLZJQPS-VHSXEESVSA-N 1 2 225.361 2.044 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCS[C@H](C)[C@@H]1C ZINC000093501709 384245652 /nfs/dbraw/zinc/24/56/52/384245652.db2.gz RFPVCHKRLZJQPS-VHSXEESVSA-N 1 2 225.361 2.044 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCSC(C)(C)C1 ZINC000093504736 384246150 /nfs/dbraw/zinc/24/61/50/384246150.db2.gz HDLRVOWITXECBQ-UHFFFAOYSA-N 1 2 225.361 2.046 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCSC(C)(C)C1 ZINC000093504736 384246154 /nfs/dbraw/zinc/24/61/54/384246154.db2.gz HDLRVOWITXECBQ-UHFFFAOYSA-N 1 2 225.361 2.046 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCS[C@@H](C)[C@@H]1C ZINC000093501712 384246411 /nfs/dbraw/zinc/24/64/11/384246411.db2.gz RFPVCHKRLZJQPS-UWVGGRQHSA-N 1 2 225.361 2.044 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCS[C@@H](C)[C@@H]1C ZINC000093501712 384246414 /nfs/dbraw/zinc/24/64/14/384246414.db2.gz RFPVCHKRLZJQPS-UWVGGRQHSA-N 1 2 225.361 2.044 20 0 BEADLO Cc1nn(C)cc1CNc1c[nH+]cc(C)c1 ZINC000119239173 384249937 /nfs/dbraw/zinc/24/99/37/384249937.db2.gz DDCSRJNYCPTCRO-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO CSCC[C@H](C)[N@H+](C)Cc1cn[nH]c1C ZINC000093558998 384250502 /nfs/dbraw/zinc/25/05/02/384250502.db2.gz ZEDLHGMXCNVFFH-VIFPVBQESA-N 1 2 227.377 2.292 20 0 BEADLO CSCC[C@H](C)[N@@H+](C)Cc1cn[nH]c1C ZINC000093558998 384250505 /nfs/dbraw/zinc/25/05/05/384250505.db2.gz ZEDLHGMXCNVFFH-VIFPVBQESA-N 1 2 227.377 2.292 20 0 BEADLO Cc1nn(C)cc1CNc1ccc(C)[nH+]c1C ZINC000119235348 384250629 /nfs/dbraw/zinc/25/06/29/384250629.db2.gz OOMUWKKAZDODAG-UHFFFAOYSA-N 1 2 230.315 2.352 20 0 BEADLO Cc1cc(N(C)CC2(C)COC2)nc(C2CC2)[nH+]1 ZINC000624528385 384253414 /nfs/dbraw/zinc/25/34/14/384253414.db2.gz SHEDOQGYLYLSHI-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO CS[C@H](C)CC(=O)Nc1cc[nH+]cc1C ZINC000119275521 384254296 /nfs/dbraw/zinc/25/42/96/384254296.db2.gz IBECCFCQRBIJOQ-SECBINFHSA-N 1 2 224.329 2.470 20 0 BEADLO CCCn1cc(Nc2cc(C)[nH+]c(C)n2)cn1 ZINC000132962695 384263000 /nfs/dbraw/zinc/26/30/00/384263000.db2.gz AWHKWDWBTVCMER-UHFFFAOYSA-N 1 2 231.303 2.444 20 0 BEADLO CC(C)[NH2+]c1ccc(N2CCC(O)CC2)cc1 ZINC000132992041 384267139 /nfs/dbraw/zinc/26/71/39/384267139.db2.gz LKWZIXJBIOZGQW-UHFFFAOYSA-N 1 2 234.343 2.468 20 0 BEADLO CC(C)Nc1ccc([NH+]2CCC(O)CC2)cc1 ZINC000132992041 384267145 /nfs/dbraw/zinc/26/71/45/384267145.db2.gz LKWZIXJBIOZGQW-UHFFFAOYSA-N 1 2 234.343 2.468 20 0 BEADLO COc1cccc(CNc2[nH+]cccc2OC)n1 ZINC000558756911 384273896 /nfs/dbraw/zinc/27/38/96/384273896.db2.gz AHOHLNIHKZLAHL-UHFFFAOYSA-N 1 2 245.282 2.106 20 0 BEADLO Cn1c(Cl)cnc1C[N@H+](C)[C@@H]1CCSC1 ZINC000119848678 384308384 /nfs/dbraw/zinc/30/83/84/384308384.db2.gz SLKLBYGZPCISTB-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO Cn1c(Cl)cnc1C[N@@H+](C)[C@@H]1CCSC1 ZINC000119848678 384308391 /nfs/dbraw/zinc/30/83/91/384308391.db2.gz SLKLBYGZPCISTB-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO Cn1c(Cl)cnc1C[N@H+](C)[C@H]1CCSC1 ZINC000119848824 384309024 /nfs/dbraw/zinc/30/90/24/384309024.db2.gz SLKLBYGZPCISTB-QMMMGPOBSA-N 1 2 245.779 2.011 20 0 BEADLO Cn1c(Cl)cnc1C[N@@H+](C)[C@H]1CCSC1 ZINC000119848824 384309027 /nfs/dbraw/zinc/30/90/27/384309027.db2.gz SLKLBYGZPCISTB-QMMMGPOBSA-N 1 2 245.779 2.011 20 0 BEADLO O=C1OCC[C@H]1[NH2+][C@H]1CCC[C@@H]1c1ccccc1 ZINC000133840771 384314768 /nfs/dbraw/zinc/31/47/68/384314768.db2.gz RXOBDHXPNJRYJJ-HZSPNIEDSA-N 1 2 245.322 2.228 20 0 BEADLO CC[S@](=O)Cc1cn2cc(Cl)ccc2[nH+]1 ZINC000133301300 384281079 /nfs/dbraw/zinc/28/10/79/384281079.db2.gz LYUADPBDQQXICC-OAHLLOKOSA-N 1 2 242.731 2.256 20 0 BEADLO CC[S@@](=O)Cc1cn2cc(Cl)ccc2[nH+]1 ZINC000133301082 384281855 /nfs/dbraw/zinc/28/18/55/384281855.db2.gz LYUADPBDQQXICC-HNNXBMFYSA-N 1 2 242.731 2.256 20 0 BEADLO COC(=O)C[N@H+](C)Cc1coc2ccccc12 ZINC000179393755 384286227 /nfs/dbraw/zinc/28/62/27/384286227.db2.gz VIENSOQSMHHXOP-UHFFFAOYSA-N 1 2 233.267 2.038 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1coc2ccccc12 ZINC000179393755 384286233 /nfs/dbraw/zinc/28/62/33/384286233.db2.gz VIENSOQSMHHXOP-UHFFFAOYSA-N 1 2 233.267 2.038 20 0 BEADLO COCc1ccc(C[NH2+]CC(F)F)cc1 ZINC000147380435 384292205 /nfs/dbraw/zinc/29/22/05/384292205.db2.gz LIFAAHAWDMLRBE-UHFFFAOYSA-N 1 2 215.243 2.188 20 0 BEADLO CCC[C@@H]([NH2+]Cc1ccc(C)s1)C(=O)OC ZINC000083369725 384292224 /nfs/dbraw/zinc/29/22/24/384292224.db2.gz YVKSHEZITFBZGP-LLVKDONJSA-N 1 2 241.356 2.488 20 0 BEADLO Cc1cc[nH+]c(NCC2(C)COC2)c1Cl ZINC000335599787 384369877 /nfs/dbraw/zinc/36/98/77/384369877.db2.gz UXMPNJXKBCEHRZ-UHFFFAOYSA-N 1 2 226.707 2.492 20 0 BEADLO C[C@@H]1C[C@H]1NC(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000075514472 384327994 /nfs/dbraw/zinc/32/79/94/384327994.db2.gz IUNJXJYEQYUWLB-ZWNOBZJWSA-N 1 2 241.294 2.011 20 0 BEADLO C[C@@H]1C[C@H](CO)CN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000335571258 384333113 /nfs/dbraw/zinc/33/31/13/384333113.db2.gz ZBQDPLXWWWRZKP-MNOVXSKESA-N 1 2 245.326 2.018 20 0 BEADLO C[C@H]1OCC[C@@H]1Nc1ccc(N2CCCC2)[nH+]c1 ZINC000134117015 384334649 /nfs/dbraw/zinc/33/46/49/384334649.db2.gz YQQCDSHMAXGTRP-YPMHNXCESA-N 1 2 247.342 2.271 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NCC(C)(F)F ZINC000556455251 384394825 /nfs/dbraw/zinc/39/48/25/384394825.db2.gz FTFSMFFESUMQCL-QMMMGPOBSA-N 1 2 217.263 2.209 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1C[C@@H](C)O[C@@H](C)C1 ZINC000121180439 384401330 /nfs/dbraw/zinc/40/13/30/384401330.db2.gz UCAUFXSSUZSSDB-PHIMTYICSA-N 1 2 249.314 2.031 20 0 BEADLO C[C@H]1SCC[N@H+](Cc2ccon2)[C@@H]1C ZINC000077317998 384402999 /nfs/dbraw/zinc/40/29/99/384402999.db2.gz SNTWSEGQJTZTGX-RKDXNWHRSA-N 1 2 212.318 2.000 20 0 BEADLO C[C@H]1SCC[N@@H+](Cc2ccon2)[C@@H]1C ZINC000077317998 384403001 /nfs/dbraw/zinc/40/30/01/384403001.db2.gz SNTWSEGQJTZTGX-RKDXNWHRSA-N 1 2 212.318 2.000 20 0 BEADLO CN(C[C@H]1CCCOC1)c1[nH]c2ccccc2[nH+]1 ZINC000134967638 384404043 /nfs/dbraw/zinc/40/40/43/384404043.db2.gz GOFSPWKBTJKZBC-LLVKDONJSA-N 1 2 245.326 2.426 20 0 BEADLO CCc1ccc(C[N@@H+]2CCC(=O)[C@@H](C)C2)nc1 ZINC000334186522 384377783 /nfs/dbraw/zinc/37/77/83/384377783.db2.gz CHNFLNLALZIURH-NSHDSACASA-N 1 2 232.327 2.055 20 0 BEADLO CCc1ccc(C[N@H+]2CCC(=O)[C@@H](C)C2)nc1 ZINC000334186522 384377787 /nfs/dbraw/zinc/37/77/87/384377787.db2.gz CHNFLNLALZIURH-NSHDSACASA-N 1 2 232.327 2.055 20 0 BEADLO CO[C@H](C)CNc1cc(C)[nH+]c(C(C)C)n1 ZINC000224347111 384380847 /nfs/dbraw/zinc/38/08/47/384380847.db2.gz CKNLFKKHNVDJOD-SNVBAGLBSA-N 1 2 223.320 2.355 20 0 BEADLO CO[C@@H](C)CNc1cc(C)[nH+]c(C(C)C)n1 ZINC000224347063 384381277 /nfs/dbraw/zinc/38/12/77/384381277.db2.gz CKNLFKKHNVDJOD-JTQLQIEISA-N 1 2 223.320 2.355 20 0 BEADLO Cc1nc(C[N@@H+]2CCS[C@H](C)C2)cs1 ZINC000076727387 384383331 /nfs/dbraw/zinc/38/33/31/384383331.db2.gz OQHDRLMQTQVJGR-MRVPVSSYSA-N 1 2 228.386 2.389 20 0 BEADLO Cc1nc(C[N@H+]2CCS[C@H](C)C2)cs1 ZINC000076727387 384383335 /nfs/dbraw/zinc/38/33/35/384383335.db2.gz OQHDRLMQTQVJGR-MRVPVSSYSA-N 1 2 228.386 2.389 20 0 BEADLO FC(F)(F)c1cc(C[N@@H+]2CC[C@@H]2C2CC2)[nH]n1 ZINC000449430084 384390925 /nfs/dbraw/zinc/39/09/25/384390925.db2.gz WDRRPKKYUSQHSP-SECBINFHSA-N 1 2 245.248 2.413 20 0 BEADLO FC(F)(F)c1cc(C[N@H+]2CC[C@@H]2C2CC2)[nH]n1 ZINC000449430084 384390932 /nfs/dbraw/zinc/39/09/32/384390932.db2.gz WDRRPKKYUSQHSP-SECBINFHSA-N 1 2 245.248 2.413 20 0 BEADLO Cc1csc(C[N@H+](C)CCOCC2CC2)n1 ZINC000121674507 384432762 /nfs/dbraw/zinc/43/27/62/384432762.db2.gz TVXDUNMJHABAPJ-UHFFFAOYSA-N 1 2 240.372 2.310 20 0 BEADLO Cc1csc(C[N@@H+](C)CCOCC2CC2)n1 ZINC000121674507 384432766 /nfs/dbraw/zinc/43/27/66/384432766.db2.gz TVXDUNMJHABAPJ-UHFFFAOYSA-N 1 2 240.372 2.310 20 0 BEADLO C[C@@H]1C[C@@H](Nc2ccc(N3CCCC3)c[nH+]2)CO1 ZINC000647173693 384434089 /nfs/dbraw/zinc/43/40/89/384434089.db2.gz VOSDRHCMGQHNJX-VXGBXAGGSA-N 1 2 247.342 2.271 20 0 BEADLO C[N@@H+](Cc1ccccc1Cl)CC1OCCO1 ZINC000122133508 384459799 /nfs/dbraw/zinc/45/97/99/384459799.db2.gz ZUXRPXPZVRSHJX-UHFFFAOYSA-N 1 2 241.718 2.145 20 0 BEADLO C[N@H+](Cc1ccccc1Cl)CC1OCCO1 ZINC000122133508 384459806 /nfs/dbraw/zinc/45/98/06/384459806.db2.gz ZUXRPXPZVRSHJX-UHFFFAOYSA-N 1 2 241.718 2.145 20 0 BEADLO C[C@@H]([NH2+][C@@H]1C[C@@H](C)[C@@H]1C)C(=O)OC(C)(C)C ZINC000309888498 384462159 /nfs/dbraw/zinc/46/21/59/384462159.db2.gz ZKKPEVNVFFDLOY-LMLFDSFASA-N 1 2 227.348 2.351 20 0 BEADLO Nc1[nH+]cnc(N[C@@H]2CC[C@H]3C[C@H]3C2)c1Cl ZINC000403071326 384479356 /nfs/dbraw/zinc/47/93/56/384479356.db2.gz GKLGLIPSBCBBQD-BIIVOSGPSA-N 1 2 238.722 2.313 20 0 BEADLO Nc1nc[nH+]c(N[C@@H]2CC[C@H]3C[C@H]3C2)c1Cl ZINC000403071326 384479360 /nfs/dbraw/zinc/47/93/60/384479360.db2.gz GKLGLIPSBCBBQD-BIIVOSGPSA-N 1 2 238.722 2.313 20 0 BEADLO CC(C)[N@H+](Cc1cc[nH]n1)Cc1ccccn1 ZINC000556813888 384502519 /nfs/dbraw/zinc/50/25/19/384502519.db2.gz VVNPDCLPGCDFIG-UHFFFAOYSA-N 1 2 230.315 2.215 20 0 BEADLO CC(C)[N@@H+](Cc1cc[nH]n1)Cc1ccccn1 ZINC000556813888 384502525 /nfs/dbraw/zinc/50/25/25/384502525.db2.gz VVNPDCLPGCDFIG-UHFFFAOYSA-N 1 2 230.315 2.215 20 0 BEADLO CC(C)c1nc(NC[C@@H]2CCO[C@H](C)C2)cc[nH+]1 ZINC000356802196 384487306 /nfs/dbraw/zinc/48/73/06/384487306.db2.gz YUEJGRORCDQOKP-VXGBXAGGSA-N 1 2 249.358 2.249 20 0 BEADLO CC(C)c1nc(NC[C@H]2CCO[C@@H](C)C2)cc[nH+]1 ZINC000356802192 384487410 /nfs/dbraw/zinc/48/74/10/384487410.db2.gz YUEJGRORCDQOKP-RYUDHWBXSA-N 1 2 249.358 2.249 20 0 BEADLO Cc1cc(N)nc(SC[C@@H]2CCCCO2)[nH+]1 ZINC000048397715 384490010 /nfs/dbraw/zinc/49/00/10/384490010.db2.gz QHRYPWNMHLALSG-VIFPVBQESA-N 1 2 239.344 2.028 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)/C=C\C(C)(C)C ZINC000492801636 533073036 /nfs/dbraw/zinc/07/30/36/533073036.db2.gz RARKANBMRQBBFT-ALCCZGGFSA-N 1 2 248.326 2.309 20 0 BEADLO Cc1cc(N2CC[C@H](O)[C@@H](C)C2)nc(C(C)C)[nH+]1 ZINC000229432042 384525198 /nfs/dbraw/zinc/52/51/98/384525198.db2.gz BMGACAWZFPIHOB-JQWIXIFHSA-N 1 2 249.358 2.116 20 0 BEADLO CCO[C@H](C)c1nc(Cn2cc[nH+]c2)cs1 ZINC000076717744 384552557 /nfs/dbraw/zinc/55/25/57/384552557.db2.gz IDTRXKXRJBYCSG-SECBINFHSA-N 1 2 237.328 2.485 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)CCc2c[nH+]c[nH]2)[C@H]1C ZINC000248816224 384553126 /nfs/dbraw/zinc/55/31/26/384553126.db2.gz CZRNERWZZRERPQ-NTZNESFSSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)CCc2c[nH]c[nH+]2)[C@H]1C ZINC000248816224 384553136 /nfs/dbraw/zinc/55/31/36/384553136.db2.gz CZRNERWZZRERPQ-NTZNESFSSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@@H](NC(=O)CCCSC)c1[nH]cc[nH+]1 ZINC000354145383 384555967 /nfs/dbraw/zinc/55/59/67/384555967.db2.gz BOVMAOWWICEEAP-SECBINFHSA-N 1 2 241.360 2.120 20 0 BEADLO CCOc1ccc(NCc2[nH]cc[nH+]2)cc1 ZINC000049714474 384556268 /nfs/dbraw/zinc/55/62/68/384556268.db2.gz SRYBMWFPCSEHHE-UHFFFAOYSA-N 1 2 217.272 2.421 20 0 BEADLO C[C@@H]1[C@H](C)SCC[N@@H+]1Cc1cscn1 ZINC000172451827 384590461 /nfs/dbraw/zinc/59/04/61/384590461.db2.gz NJCJAPUEERXHON-BDAKNGLRSA-N 1 2 228.386 2.469 20 0 BEADLO C[C@@H]1[C@H](C)SCC[N@H+]1Cc1cscn1 ZINC000172451827 384590471 /nfs/dbraw/zinc/59/04/71/384590471.db2.gz NJCJAPUEERXHON-BDAKNGLRSA-N 1 2 228.386 2.469 20 0 BEADLO C[N@H+](CCOc1ccccc1)Cc1ccon1 ZINC000172382949 384577029 /nfs/dbraw/zinc/57/70/29/384577029.db2.gz PWYXVQMSHKWYSP-UHFFFAOYSA-N 1 2 232.283 2.185 20 0 BEADLO C[N@@H+](CCOc1ccccc1)Cc1ccon1 ZINC000172382949 384577034 /nfs/dbraw/zinc/57/70/34/384577034.db2.gz PWYXVQMSHKWYSP-UHFFFAOYSA-N 1 2 232.283 2.185 20 0 BEADLO C[C@H]([NH2+]Cc1ccc(F)cn1)c1ccon1 ZINC000309784925 384607990 /nfs/dbraw/zinc/60/79/90/384607990.db2.gz NVANAPLZWQXRLA-QMMMGPOBSA-N 1 2 221.235 2.060 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+]2C[C@H](C)OC(C)(C)C2)cn1 ZINC000428460143 384616500 /nfs/dbraw/zinc/61/65/00/384616500.db2.gz GGWJOAUYVCAXNI-NWDGAFQWSA-N 1 2 249.358 2.345 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+]2C[C@H](C)OC(C)(C)C2)cn1 ZINC000428460143 384616504 /nfs/dbraw/zinc/61/65/04/384616504.db2.gz GGWJOAUYVCAXNI-NWDGAFQWSA-N 1 2 249.358 2.345 20 0 BEADLO CC(C)(C)CCNc1ccc(CO)c[nH+]1 ZINC000291702453 384620025 /nfs/dbraw/zinc/62/00/25/384620025.db2.gz ZCNNMJXTVKDVSW-UHFFFAOYSA-N 1 2 208.305 2.422 20 0 BEADLO COC(=O)[C@H](C)[N@@H+]1C[C@H](C)[C@H]1c1ccccc1 ZINC000081573391 384622456 /nfs/dbraw/zinc/62/24/56/384622456.db2.gz NYMYSHKKOFDPQR-GVXVVHGQSA-N 1 2 233.311 2.241 20 0 BEADLO COC(=O)[C@H](C)[N@H+]1C[C@H](C)[C@H]1c1ccccc1 ZINC000081573391 384622461 /nfs/dbraw/zinc/62/24/61/384622461.db2.gz NYMYSHKKOFDPQR-GVXVVHGQSA-N 1 2 233.311 2.241 20 0 BEADLO C[C@H]([NH2+]Cc1nccs1)c1ccccn1 ZINC000041011692 384633631 /nfs/dbraw/zinc/63/36/31/384633631.db2.gz HMZOEXLVEQAOBE-VIFPVBQESA-N 1 2 219.313 2.389 20 0 BEADLO Cc1c[nH+]c(C)nc1N1C[C@H]2CCC[C@H]21 ZINC000517960319 384594009 /nfs/dbraw/zinc/59/40/09/384594009.db2.gz HJHHQPRKIPJKRT-GHMZBOCLSA-N 1 2 203.289 2.082 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1C[C@@H](C)CC1(C)C ZINC000517962056 384596517 /nfs/dbraw/zinc/59/65/17/384596517.db2.gz YJPDIKPOIRDSLA-WDEREUQCSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1C[C@@H](C)CC1(C)C ZINC000517962056 384596526 /nfs/dbraw/zinc/59/65/26/384596526.db2.gz YJPDIKPOIRDSLA-WDEREUQCSA-N 1 2 249.358 2.235 20 0 BEADLO Cc1cccc2c1N(Cc1ccc(N)[nH+]c1)CC2 ZINC000647538621 384665948 /nfs/dbraw/zinc/66/59/48/384665948.db2.gz ZSGYVRGFQDEFFJ-UHFFFAOYSA-N 1 2 239.322 2.365 20 0 BEADLO CS[C@H](C)CNc1[nH+]c(C)nc2[nH]ccc21 ZINC000309848485 384667023 /nfs/dbraw/zinc/66/70/23/384667023.db2.gz HWLKBOIZTXBELT-SSDOTTSWSA-N 1 2 236.344 2.430 20 0 BEADLO CS[C@@H](C)CNc1[nH+]c(C)nc2[nH]ccc21 ZINC000309848486 384668155 /nfs/dbraw/zinc/66/81/55/384668155.db2.gz HWLKBOIZTXBELT-ZETCQYMHSA-N 1 2 236.344 2.430 20 0 BEADLO Cc1c[nH]nc1CNc1ccc[nH+]c1C ZINC000289534999 384670946 /nfs/dbraw/zinc/67/09/46/384670946.db2.gz OVMATEYFKYFIQJ-UHFFFAOYSA-N 1 2 202.261 2.034 20 0 BEADLO CC[C@@H]([NH2+]CC(F)(F)CO)c1ccc(F)cc1 ZINC000184690658 384636592 /nfs/dbraw/zinc/63/65/92/384636592.db2.gz GUWGZSQPUAKVNK-LLVKDONJSA-N 1 2 247.260 2.494 20 0 BEADLO Cc1cc(NCCCCF)nc(C(C)C)[nH+]1 ZINC000336654172 384638323 /nfs/dbraw/zinc/63/83/23/384638323.db2.gz KAPZYUZHZDXLRQ-UHFFFAOYSA-N 1 2 225.311 2.492 20 0 BEADLO Cc1c[nH+]cc(NC[C@@H]2CCCOC2)c1 ZINC000224917002 384639158 /nfs/dbraw/zinc/63/91/58/384639158.db2.gz LHUJLQMMZPLHHX-NSHDSACASA-N 1 2 206.289 2.229 20 0 BEADLO Cc1c[nH+]cc(NC[C@H]2CCCOC2)c1 ZINC000224917038 384639380 /nfs/dbraw/zinc/63/93/80/384639380.db2.gz LHUJLQMMZPLHHX-LLVKDONJSA-N 1 2 206.289 2.229 20 0 BEADLO CCCC1(CNC(=O)Cc2c[nH+]cn2C)CCC1 ZINC000530543867 384641463 /nfs/dbraw/zinc/64/14/63/384641463.db2.gz SEYRXVPEAYVYJL-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1nnc(C)o1 ZINC000162538650 384642967 /nfs/dbraw/zinc/64/29/67/384642967.db2.gz HYNHHXZUJNKPSY-GFCCVEGCSA-N 1 2 246.314 2.356 20 0 BEADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1nnc(C)o1 ZINC000162538650 384642974 /nfs/dbraw/zinc/64/29/74/384642974.db2.gz HYNHHXZUJNKPSY-GFCCVEGCSA-N 1 2 246.314 2.356 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2ccco2)on1 ZINC000044315383 384654174 /nfs/dbraw/zinc/65/41/74/384654174.db2.gz CIMPHHSADGDLRC-SECBINFHSA-N 1 2 206.245 2.427 20 0 BEADLO Cc1[nH]c(C(=O)NC2(c3ccccc3)CC2)c[nH+]1 ZINC000082268229 384655707 /nfs/dbraw/zinc/65/57/07/384655707.db2.gz SFALJYVOGNYUIV-UHFFFAOYSA-N 1 2 241.294 2.137 20 0 BEADLO CC(C)C(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000082275822 384657848 /nfs/dbraw/zinc/65/78/48/384657848.db2.gz RECKNJYGDGJIJY-JTQLQIEISA-N 1 2 221.304 2.119 20 0 BEADLO O=C(C1CCCC1)N1CCC(n2cc[nH+]c2)CC1 ZINC000082278160 384660515 /nfs/dbraw/zinc/66/05/15/384660515.db2.gz JNWQKXZSLCJNSD-UHFFFAOYSA-N 1 2 247.342 2.237 20 0 BEADLO CCCCCOC1CN(c2nc(C)[nH+]cc2C)C1 ZINC000569624344 384661235 /nfs/dbraw/zinc/66/12/35/384661235.db2.gz YCXNFCXDJADPAQ-UHFFFAOYSA-N 1 2 249.358 2.489 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC[C@H]2c2ccncc2)o1 ZINC000162747040 384678351 /nfs/dbraw/zinc/67/83/51/384678351.db2.gz UFGRBMVROJMMON-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1nnc(C[N@H+]2CCC[C@H]2c2ccncc2)o1 ZINC000162747040 384678356 /nfs/dbraw/zinc/67/83/56/384678356.db2.gz UFGRBMVROJMMON-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO C[C@H](O)C[N@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000051837660 384691842 /nfs/dbraw/zinc/69/18/42/384691842.db2.gz MXPOJZMIRDLZQG-VIFPVBQESA-N 1 2 242.388 2.253 20 0 BEADLO C[C@H](O)C[N@@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000051837660 384691846 /nfs/dbraw/zinc/69/18/46/384691846.db2.gz MXPOJZMIRDLZQG-VIFPVBQESA-N 1 2 242.388 2.253 20 0 BEADLO Cc1cnc([C@H](C)[NH2+]Cc2cnn(C)c2)s1 ZINC000125188690 384702316 /nfs/dbraw/zinc/70/23/16/384702316.db2.gz MDNQQOUSQBWEQS-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO Cc1nc(C[N@H+](C)CCc2ccccc2)no1 ZINC000052000052 384707155 /nfs/dbraw/zinc/70/71/55/384707155.db2.gz HRGJLVSQOJYCJG-UHFFFAOYSA-N 1 2 231.299 2.053 20 0 BEADLO Cc1nc(C[N@@H+](C)CCc2ccccc2)no1 ZINC000052000052 384707158 /nfs/dbraw/zinc/70/71/58/384707158.db2.gz HRGJLVSQOJYCJG-UHFFFAOYSA-N 1 2 231.299 2.053 20 0 BEADLO C[C@H](CC(=O)NCCn1cc[nH+]c1)C(C)(C)C ZINC000108678072 384723009 /nfs/dbraw/zinc/72/30/09/384723009.db2.gz BCZUIOORAQTNLG-LLVKDONJSA-N 1 2 237.347 2.072 20 0 BEADLO CSc1ccc(N[C@@H]2CO[C@@H](C)C2)[nH+]c1 ZINC000647193507 384755506 /nfs/dbraw/zinc/75/55/06/384755506.db2.gz CYAPURHCHYEPGM-IUCAKERBSA-N 1 2 224.329 2.393 20 0 BEADLO CCc1cc(N)nc(SCCCC(C)=O)[nH+]1 ZINC000279043611 384757287 /nfs/dbraw/zinc/75/72/87/384757287.db2.gz GHJKSHLDKPMFMU-UHFFFAOYSA-N 1 2 239.344 2.083 20 0 BEADLO COC(=O)[C@@H](CC(F)F)[NH2+]CCC(C)(C)C ZINC000309986117 384765548 /nfs/dbraw/zinc/76/55/48/384765548.db2.gz YIENYSYDQAMWQE-MRVPVSSYSA-N 1 2 237.290 2.209 20 0 BEADLO COC[C@@H](C)Nc1ccc(N2CCCC2)[nH+]c1 ZINC000053173424 384770528 /nfs/dbraw/zinc/77/05/28/384770528.db2.gz ZZWFCAKFFFTGMV-LLVKDONJSA-N 1 2 235.331 2.129 20 0 BEADLO C/C=C/C[S@@](=O)Cc1cn2cccc(C)c2[nH+]1 ZINC000083952903 384821287 /nfs/dbraw/zinc/82/12/87/384821287.db2.gz WAFPWHGBUZEUJH-IDOMTICXSA-N 1 2 248.351 2.468 20 0 BEADLO CC[C@H]1[C@@H](C)CCN1c1cc[nH+]c(C)n1 ZINC000185929234 384789020 /nfs/dbraw/zinc/78/90/20/384789020.db2.gz KRPYEIDGSGLRSF-ONGXEEELSA-N 1 2 205.305 2.410 20 0 BEADLO CC[C@H]1[C@H](C)CCN1c1cc[nH+]c(C)n1 ZINC000185929197 384790422 /nfs/dbraw/zinc/79/04/22/384790422.db2.gz KRPYEIDGSGLRSF-KOLCDFICSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1csc(C[NH2+][C@@H](CO)c2ccccc2)n1 ZINC000083704928 384794638 /nfs/dbraw/zinc/79/46/38/384794638.db2.gz PNCHTFDNCYDJIG-LBPRGKRZSA-N 1 2 248.351 2.275 20 0 BEADLO CCCC1(CNC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)CC1 ZINC000635686514 384798682 /nfs/dbraw/zinc/79/86/82/384798682.db2.gz WDYZNUAXPCOWFP-GHMZBOCLSA-N 1 2 247.342 2.210 20 0 BEADLO CCCC1(CNC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)CC1 ZINC000635686514 384798688 /nfs/dbraw/zinc/79/86/88/384798688.db2.gz WDYZNUAXPCOWFP-GHMZBOCLSA-N 1 2 247.342 2.210 20 0 BEADLO CSCC[N@@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000306305991 384872295 /nfs/dbraw/zinc/87/22/95/384872295.db2.gz FAFNCRVMTKAGJH-MRVPVSSYSA-N 1 2 209.305 2.327 20 0 BEADLO CSCC[N@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000306305991 384872300 /nfs/dbraw/zinc/87/23/00/384872300.db2.gz FAFNCRVMTKAGJH-MRVPVSSYSA-N 1 2 209.305 2.327 20 0 BEADLO CC[C@H]([NH2+]Cc1cnc[nH]1)c1nc(C)cs1 ZINC000163908731 384874869 /nfs/dbraw/zinc/87/48/69/384874869.db2.gz CQXHAXKMLORLLH-JTQLQIEISA-N 1 2 236.344 2.416 20 0 BEADLO C[C@@H](C(=O)N1CCC(n2cc[nH+]c2)CC1)C1CC1 ZINC000175287568 384889827 /nfs/dbraw/zinc/88/98/27/384889827.db2.gz NAGLPIDBEPPONU-LLVKDONJSA-N 1 2 247.342 2.093 20 0 BEADLO C[C@@H](CCc1ccccc1)[N@H+](C)Cc1nnc[nH]1 ZINC000177140276 384882961 /nfs/dbraw/zinc/88/29/61/384882961.db2.gz OUICKWDZZOJMEI-LBPRGKRZSA-N 1 2 244.342 2.258 20 0 BEADLO C[C@@H](CCc1ccccc1)[N@@H+](C)Cc1nnc[nH]1 ZINC000177140276 384882970 /nfs/dbraw/zinc/88/29/70/384882970.db2.gz OUICKWDZZOJMEI-LBPRGKRZSA-N 1 2 244.342 2.258 20 0 BEADLO Cc1cc[nH+]c(NC[C@@H](C)CO)c1Cl ZINC000306333544 384887070 /nfs/dbraw/zinc/88/70/70/384887070.db2.gz RDTNFWJIKBQUTF-SSDOTTSWSA-N 1 2 214.696 2.084 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1CCO[C@H]([C@H]2CCCO2)C1 ZINC000528407730 384838578 /nfs/dbraw/zinc/83/85/78/384838578.db2.gz WZVPJTUECMZBHA-JUTKWBCOSA-N 1 2 245.750 2.009 20 0 BEADLO C/C(Cl)=C/C[N@H+]1CCO[C@H]([C@H]2CCCO2)C1 ZINC000528407730 384838582 /nfs/dbraw/zinc/83/85/82/384838582.db2.gz WZVPJTUECMZBHA-JUTKWBCOSA-N 1 2 245.750 2.009 20 0 BEADLO CCc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)o1 ZINC000126965681 384848090 /nfs/dbraw/zinc/84/80/90/384848090.db2.gz ZYPUGZXODPDWBO-PHIMTYICSA-N 1 2 223.316 2.451 20 0 BEADLO CCc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)o1 ZINC000126965681 384848095 /nfs/dbraw/zinc/84/80/95/384848095.db2.gz ZYPUGZXODPDWBO-PHIMTYICSA-N 1 2 223.316 2.451 20 0 BEADLO CC(C)n1cc(C[NH2+][C@H](C)c2cccnc2)nn1 ZINC000289616445 384888568 /nfs/dbraw/zinc/88/85/68/384888568.db2.gz FKSIKMRHYBAOCA-LLVKDONJSA-N 1 2 245.330 2.105 20 0 BEADLO CCc1cc(N)nc(SCCOC(C)C)[nH+]1 ZINC000279121305 384852005 /nfs/dbraw/zinc/85/20/05/384852005.db2.gz UMWZURIBMQUDHX-UHFFFAOYSA-N 1 2 241.360 2.138 20 0 BEADLO FC(F)[C@@H](Cc1ccccc1)[NH2+][C@@H]1CCOC1 ZINC000358246433 384856158 /nfs/dbraw/zinc/85/61/58/384856158.db2.gz DMNHZNHODLFMQL-VXGBXAGGSA-N 1 2 241.281 2.241 20 0 BEADLO CCCCn1cc(C[NH2+]Cc2ccon2)c(C)n1 ZINC000634974871 384857025 /nfs/dbraw/zinc/85/70/25/384857025.db2.gz MJQCBPUUOHCKHJ-UHFFFAOYSA-N 1 2 248.330 2.269 20 0 BEADLO C[C@@H]([NH2+]CCOC(C)(C)C)c1csnn1 ZINC000398227733 384857548 /nfs/dbraw/zinc/85/75/48/384857548.db2.gz HNSXBKQKBNJIQR-MRVPVSSYSA-N 1 2 229.349 2.004 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)OC(C)(C)C ZINC000497198170 384859187 /nfs/dbraw/zinc/85/91/87/384859187.db2.gz VZXKPBCRIUCMTA-VIFPVBQESA-N 1 2 239.319 2.489 20 0 BEADLO CC(C)c1nc(N[C@@H]2CCCOC2)cc[nH+]1 ZINC000301247891 384864192 /nfs/dbraw/zinc/86/41/92/384864192.db2.gz LUMIEFSVZKECET-SNVBAGLBSA-N 1 2 221.304 2.191 20 0 BEADLO O=C1OCC[C@]12CCC[N@H+]2Cc1ccc(F)cc1 ZINC000186657562 384865445 /nfs/dbraw/zinc/86/54/45/384865445.db2.gz HBQISSQISPXCKS-CQSZACIVSA-N 1 2 249.285 2.107 20 0 BEADLO O=C1OCC[C@]12CCC[N@@H+]2Cc1ccc(F)cc1 ZINC000186657562 384865452 /nfs/dbraw/zinc/86/54/52/384865452.db2.gz HBQISSQISPXCKS-CQSZACIVSA-N 1 2 249.285 2.107 20 0 BEADLO CCSCC[N@H+](C)Cc1nccs1 ZINC000175083589 384866434 /nfs/dbraw/zinc/86/64/34/384866434.db2.gz GEYMYDUMDMXADI-UHFFFAOYSA-N 1 2 216.375 2.328 20 0 BEADLO CCSCC[N@@H+](C)Cc1nccs1 ZINC000175083589 384866442 /nfs/dbraw/zinc/86/64/42/384866442.db2.gz GEYMYDUMDMXADI-UHFFFAOYSA-N 1 2 216.375 2.328 20 0 BEADLO CC[C@@H](CO)Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000085486151 384952940 /nfs/dbraw/zinc/95/29/40/384952940.db2.gz KXDUICMXVFMDAA-QMMMGPOBSA-N 1 2 234.221 2.283 20 0 BEADLO CC(C)[C@H](NC(=O)OC1CCC1)c1[nH]cc[nH+]1 ZINC000497243793 384910372 /nfs/dbraw/zinc/91/03/72/384910372.db2.gz NFTULQHXBVPPRZ-JTQLQIEISA-N 1 2 237.303 2.386 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]21 ZINC000448933446 384920703 /nfs/dbraw/zinc/92/07/03/384920703.db2.gz QEXYELIOZZESJL-WOPDTQHZSA-N 1 2 230.311 2.187 20 0 BEADLO CC[C@@H](C)Nc1nc(N)c2ccccc2[nH+]1 ZINC000301898151 384940097 /nfs/dbraw/zinc/94/00/97/384940097.db2.gz WNHPGPCTJAQZBF-MRVPVSSYSA-N 1 2 216.288 2.422 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2nccn2C)sn1 ZINC000404389490 384974865 /nfs/dbraw/zinc/97/48/65/384974865.db2.gz XNHVSPYJJWSWIM-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1n[nH]c(C)c1CNc1ccc(C)[nH+]c1 ZINC000128038911 384982145 /nfs/dbraw/zinc/98/21/45/384982145.db2.gz IJGXNNHSEDYGJX-UHFFFAOYSA-N 1 2 216.288 2.342 20 0 BEADLO Cc1ccc(NCc2ccc(CO)o2)c[nH+]1 ZINC000128037915 384982386 /nfs/dbraw/zinc/98/23/86/384982386.db2.gz YVRZPCZAEGIQPO-UHFFFAOYSA-N 1 2 218.256 2.087 20 0 BEADLO Cc1csc(C(=O)N[C@H](C)Cn2cc[nH+]c2)c1 ZINC000293822029 384983804 /nfs/dbraw/zinc/98/38/04/384983804.db2.gz ZOABRPVVLJMUKA-SNVBAGLBSA-N 1 2 249.339 2.072 20 0 BEADLO Cc1ccccc1[C@H](CO)Nc1cc[nH+]c(C)n1 ZINC000530618013 384989374 /nfs/dbraw/zinc/98/93/74/384989374.db2.gz SFGLZXBWHBYHNZ-ZDUSSCGKSA-N 1 2 243.310 2.239 20 0 BEADLO CN(C)c1ccc(NCc2ccns2)c[nH+]1 ZINC000404444106 385005769 /nfs/dbraw/zinc/00/57/69/385005769.db2.gz BDWZBKFYRBQDOY-UHFFFAOYSA-N 1 2 234.328 2.216 20 0 BEADLO CCc1nc(C)c(C[NH2+]Cc2ccns2)o1 ZINC000404488598 385019504 /nfs/dbraw/zinc/01/95/04/385019504.db2.gz OUAJXFUSQKLPGN-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO CC[C@@H]1CCN(C(=O)C[C@@H](C)n2cc[nH+]c2)C1 ZINC000564662395 384962154 /nfs/dbraw/zinc/96/21/54/384962154.db2.gz YTBMSQZYDKWLKF-VXGBXAGGSA-N 1 2 235.331 2.093 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1cccc(CC)c1 ZINC000188965579 385050533 /nfs/dbraw/zinc/05/05/33/385050533.db2.gz LZSFWSYSXWVGHI-UHFFFAOYSA-N 1 2 235.327 2.244 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1cccc(CC)c1 ZINC000188965579 385050537 /nfs/dbraw/zinc/05/05/37/385050537.db2.gz LZSFWSYSXWVGHI-UHFFFAOYSA-N 1 2 235.327 2.244 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCO[C@@H](C(C)(C)C)C1 ZINC000518396724 385057862 /nfs/dbraw/zinc/05/78/62/385057862.db2.gz KHJOSNHMEJNVBG-GFCCVEGCSA-N 1 2 249.358 2.345 20 0 BEADLO Cc1ccc(NC(=O)CC[C@@H]2CCOC2)c(C)[nH+]1 ZINC000176185087 385033168 /nfs/dbraw/zinc/03/31/68/385033168.db2.gz TZIUQEABBBZAGD-GFCCVEGCSA-N 1 2 248.326 2.454 20 0 BEADLO C[C@@H](O)CCCn1c[nH+]c2cc(F)c(F)cc21 ZINC000310559339 385116680 /nfs/dbraw/zinc/11/66/80/385116680.db2.gz ZRHFIYBWAWRYPA-MRVPVSSYSA-N 1 2 240.253 2.476 20 0 BEADLO CC(C)c1nc(C[N@H+](C)[C@@H](C)C2CC2)no1 ZINC000064931742 385127960 /nfs/dbraw/zinc/12/79/60/385127960.db2.gz YEFXRYNPHQGFED-VIFPVBQESA-N 1 2 223.320 2.423 20 0 BEADLO CC(C)c1nc(C[N@@H+](C)[C@@H](C)C2CC2)no1 ZINC000064931742 385127968 /nfs/dbraw/zinc/12/79/68/385127968.db2.gz YEFXRYNPHQGFED-VIFPVBQESA-N 1 2 223.320 2.423 20 0 BEADLO CCCN(C(=O)[C@@H]1CCCc2[nH+]c[nH]c21)C(C)C ZINC000564666936 385128144 /nfs/dbraw/zinc/12/81/44/385128144.db2.gz LIUJEBMQRPTZDI-LLVKDONJSA-N 1 2 249.358 2.477 20 0 BEADLO CC[C@@H](CCO)CNc1cc(C)[nH+]c(C2CC2)n1 ZINC000152401617 385181447 /nfs/dbraw/zinc/18/14/47/385181447.db2.gz IXYJOWFUBHJEJC-NSHDSACASA-N 1 2 249.358 2.483 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCSCC(C)C ZINC000516663453 385152131 /nfs/dbraw/zinc/15/21/31/385152131.db2.gz PNXQMJQHVNPPBS-UHFFFAOYSA-N 1 2 239.388 2.316 20 0 BEADLO CC[C@@H](CCO)CNc1cc[nH+]c(C2CC2)n1 ZINC000152367458 385177775 /nfs/dbraw/zinc/17/77/75/385177775.db2.gz RUCDHTWAKFMHCB-JTQLQIEISA-N 1 2 235.331 2.175 20 0 BEADLO CC[C@H]([NH2+]Cc1c[nH]nn1)c1cccs1 ZINC000398347169 385256457 /nfs/dbraw/zinc/25/64/57/385256457.db2.gz QCHRRAQBTZYTPF-VIFPVBQESA-N 1 2 222.317 2.107 20 0 BEADLO CC[C@H]([NH2+]Cc1cn[nH]n1)c1cccs1 ZINC000398347169 385256463 /nfs/dbraw/zinc/25/64/63/385256463.db2.gz QCHRRAQBTZYTPF-VIFPVBQESA-N 1 2 222.317 2.107 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccncc2)no1 ZINC000130218995 385231178 /nfs/dbraw/zinc/23/11/78/385231178.db2.gz JZOPATPRLZSJME-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccncc2)no1 ZINC000130218995 385231187 /nfs/dbraw/zinc/23/11/87/385231187.db2.gz JZOPATPRLZSJME-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCOC1=O)[C@@H](C)c1ccccc1 ZINC000177482593 385249966 /nfs/dbraw/zinc/24/99/66/385249966.db2.gz BLBCZHDKRBIHSU-NTZNESFSSA-N 1 2 233.311 2.084 20 0 BEADLO CC(C)(C)n1cc(CNc2cccc[nH+]2)nn1 ZINC000191516362 385306311 /nfs/dbraw/zinc/30/63/11/385306311.db2.gz OZVVDMFWZLJTSS-UHFFFAOYSA-N 1 2 231.303 2.040 20 0 BEADLO c1csc([C@@H]([NH2+]C2CCC2)c2nnc[nH]2)c1 ZINC000294926278 385317178 /nfs/dbraw/zinc/31/71/78/385317178.db2.gz XGVCICDOWOBNDT-SNVBAGLBSA-N 1 2 234.328 2.098 20 0 BEADLO C[C@@H](CNC(=O)c1cccs1)Cn1cc[nH+]c1 ZINC000153460672 385258957 /nfs/dbraw/zinc/25/89/57/385258957.db2.gz OMHFMYQVMPYLQE-JTQLQIEISA-N 1 2 249.339 2.011 20 0 BEADLO CCOC[C@H](O)CNc1ccc2ccccc2[nH+]1 ZINC000310994236 385265454 /nfs/dbraw/zinc/26/54/54/385265454.db2.gz WGRDAYBONRKSHI-GFCCVEGCSA-N 1 2 246.310 2.044 20 0 BEADLO CN(c1cc[nH+]c(C2CC2)n1)[C@H]1CCSC1 ZINC000153776871 385278986 /nfs/dbraw/zinc/27/89/86/385278986.db2.gz ZJVPESGRBQYXLV-JTQLQIEISA-N 1 2 235.356 2.296 20 0 BEADLO Cc1cc(C[N@H+](C)C[C@@H]2CCC=CO2)no1 ZINC000191066499 385280979 /nfs/dbraw/zinc/28/09/79/385280979.db2.gz VFMXKHVNSRVRCB-LBPRGKRZSA-N 1 2 222.288 2.108 20 0 BEADLO Cc1cc(C[N@@H+](C)C[C@@H]2CCC=CO2)no1 ZINC000191066499 385280988 /nfs/dbraw/zinc/28/09/88/385280988.db2.gz VFMXKHVNSRVRCB-LBPRGKRZSA-N 1 2 222.288 2.108 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)[C@H]1CC2CCC1CC2 ZINC000311130649 385331893 /nfs/dbraw/zinc/33/18/93/385331893.db2.gz CENFMCLGBXSUSE-MCIGGMRASA-N 1 2 247.342 2.194 20 0 BEADLO C[C@@H]1C[C@@H]1c1ccc(C[NH+]2CCOCC2)o1 ZINC000154508388 385333122 /nfs/dbraw/zinc/33/31/22/385333122.db2.gz SXUPWQQWIVCMKT-PWSUYJOCSA-N 1 2 221.300 2.235 20 0 BEADLO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1cocn1 ZINC000191922472 385335023 /nfs/dbraw/zinc/33/50/23/385335023.db2.gz MBHFPJFMCGERIS-ZDUSSCGKSA-N 1 2 231.299 2.350 20 0 BEADLO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1cocn1 ZINC000191922472 385335025 /nfs/dbraw/zinc/33/50/25/385335025.db2.gz MBHFPJFMCGERIS-ZDUSSCGKSA-N 1 2 231.299 2.350 20 0 BEADLO CN(C)c1cccc(C[N@H+](C)Cc2cocn2)c1 ZINC000191948839 385336578 /nfs/dbraw/zinc/33/65/78/385336578.db2.gz AGODILBXSIKBDK-UHFFFAOYSA-N 1 2 245.326 2.373 20 0 BEADLO CN(C)c1cccc(C[N@@H+](C)Cc2cocn2)c1 ZINC000191948839 385336580 /nfs/dbraw/zinc/33/65/80/385336580.db2.gz AGODILBXSIKBDK-UHFFFAOYSA-N 1 2 245.326 2.373 20 0 BEADLO CC(C)(C)CNc1nc[nH+]c(N)c1Cl ZINC000192284869 385350661 /nfs/dbraw/zinc/35/06/61/385350661.db2.gz TUPWYXSBAVJXBU-UHFFFAOYSA-N 1 2 214.700 2.170 20 0 BEADLO CC(C)(C)CNc1[nH+]cnc(N)c1Cl ZINC000192284869 385350664 /nfs/dbraw/zinc/35/06/64/385350664.db2.gz TUPWYXSBAVJXBU-UHFFFAOYSA-N 1 2 214.700 2.170 20 0 BEADLO COc1cc(C)cc(C[NH2+]Cc2cocn2)c1 ZINC000192335605 385353062 /nfs/dbraw/zinc/35/30/62/385353062.db2.gz SCOCAYQMHCMECO-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO CCC[C@H](C)C(=O)N(C)CCCn1cc[nH+]c1 ZINC000154848141 385359337 /nfs/dbraw/zinc/35/93/37/385359337.db2.gz QSRMYKHOIGOOIG-LBPRGKRZSA-N 1 2 237.347 2.168 20 0 BEADLO CCCCC(=O)NCc1ccn2cc[nH+]c2c1 ZINC000178364080 385361629 /nfs/dbraw/zinc/36/16/29/385361629.db2.gz JHQFCPGCIUJJLT-UHFFFAOYSA-N 1 2 231.299 2.141 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)C(F)(F)F)C1CCOCC1 ZINC000309022741 385365447 /nfs/dbraw/zinc/36/54/47/385365447.db2.gz YFOUXBAYOMWWOL-SFYZADRCSA-N 1 2 225.254 2.342 20 0 BEADLO Cc1c[nH+]cc(N[C@H]2CCOC[C@H]2C)c1 ZINC000192645242 385366396 /nfs/dbraw/zinc/36/63/96/385366396.db2.gz UFVQMUOVDJYWFY-PWSUYJOCSA-N 1 2 206.289 2.227 20 0 BEADLO C=Cn1cc(C[N@@H+]2CCn3cccc3[C@@H]2C)cn1 ZINC000193605287 385403972 /nfs/dbraw/zinc/40/39/72/385403972.db2.gz XKUPSWOPBPWQCE-LBPRGKRZSA-N 1 2 242.326 2.362 20 0 BEADLO C=Cn1cc(C[N@H+]2CCn3cccc3[C@@H]2C)cn1 ZINC000193605287 385403977 /nfs/dbraw/zinc/40/39/77/385403977.db2.gz XKUPSWOPBPWQCE-LBPRGKRZSA-N 1 2 242.326 2.362 20 0 BEADLO C[N@@H+](Cc1cscn1)C[C@@H]1CCC=CO1 ZINC000193803537 385412944 /nfs/dbraw/zinc/41/29/44/385412944.db2.gz SJEMXIXAEVIQSJ-NSHDSACASA-N 1 2 224.329 2.268 20 0 BEADLO C[N@H+](Cc1cscn1)C[C@@H]1CCC=CO1 ZINC000193803537 385412947 /nfs/dbraw/zinc/41/29/47/385412947.db2.gz SJEMXIXAEVIQSJ-NSHDSACASA-N 1 2 224.329 2.268 20 0 BEADLO Cc1cnc(C[NH2+][C@H](C)c2ccccn2)o1 ZINC000181794941 385417445 /nfs/dbraw/zinc/41/74/45/385417445.db2.gz JOGXPHUTKYAGCE-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO C[N@H+](CCc1nccs1)Cc1cscn1 ZINC000179068822 385438370 /nfs/dbraw/zinc/43/83/70/385438370.db2.gz UHLXKLBWYRRERI-UHFFFAOYSA-N 1 2 239.369 2.274 20 0 BEADLO C[N@@H+](CCc1nccs1)Cc1cscn1 ZINC000179068822 385438373 /nfs/dbraw/zinc/43/83/73/385438373.db2.gz UHLXKLBWYRRERI-UHFFFAOYSA-N 1 2 239.369 2.274 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C=Cc1ccsc1 ZINC000492825904 385443740 /nfs/dbraw/zinc/44/37/40/385443740.db2.gz UCDOFXYMQGARNG-NSCUHMNNSA-N 1 2 247.323 2.109 20 0 BEADLO CC[C@H](C[C@@H](C)CO)Nc1cccc[nH+]1 ZINC000309164755 385444467 /nfs/dbraw/zinc/44/44/67/385444467.db2.gz IMSVGXNGKPKPKR-GHMZBOCLSA-N 1 2 208.305 2.291 20 0 BEADLO CN(C[C@@H]1CCCO1)c1[nH+]c2ccccc2n1C ZINC000179289197 385457889 /nfs/dbraw/zinc/45/78/89/385457889.db2.gz YOYJZQRXRMHNNI-NSHDSACASA-N 1 2 245.326 2.189 20 0 BEADLO Cc1nnc([C@H](C)[N@H+](C)Cc2ccoc2C)o1 ZINC000170820234 385449044 /nfs/dbraw/zinc/44/90/44/385449044.db2.gz XEUHPTXMAAKLTF-QMMMGPOBSA-N 1 2 235.287 2.472 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+](C)Cc2ccoc2C)o1 ZINC000170820234 385449048 /nfs/dbraw/zinc/44/90/48/385449048.db2.gz XEUHPTXMAAKLTF-QMMMGPOBSA-N 1 2 235.287 2.472 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)NCC12CCC(CC1)C2 ZINC000492769344 385427621 /nfs/dbraw/zinc/42/76/21/385427621.db2.gz PQQRNCLWOSPIDE-OWOJBTEDSA-N 1 2 245.326 2.119 20 0 BEADLO C[C@H](Nc1cccc[nH+]1)[C@@H]1CCCOC1 ZINC000309125813 385429368 /nfs/dbraw/zinc/42/93/68/385429368.db2.gz PMWXGZMNNKQNJJ-WDEREUQCSA-N 1 2 206.289 2.309 20 0 BEADLO CC[C@@H](C)[C@@H](C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616927886 385487991 /nfs/dbraw/zinc/48/79/91/385487991.db2.gz SGWYIFWZTMRTSM-NXEZZACHSA-N 1 2 223.320 2.050 20 0 BEADLO CC[C@@H](C)[C@@H](C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616927886 385487994 /nfs/dbraw/zinc/48/79/94/385487994.db2.gz SGWYIFWZTMRTSM-NXEZZACHSA-N 1 2 223.320 2.050 20 0 BEADLO C[C@H](CC(C)(C)C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616927929 385488338 /nfs/dbraw/zinc/48/83/38/385488338.db2.gz UMXKTPFJWPWTEC-SNVBAGLBSA-N 1 2 237.347 2.440 20 0 BEADLO C[C@H](CC(C)(C)C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616927929 385488343 /nfs/dbraw/zinc/48/83/43/385488343.db2.gz UMXKTPFJWPWTEC-SNVBAGLBSA-N 1 2 237.347 2.440 20 0 BEADLO Cc1n[nH]cc1C[N@@H+](C)Cc1ccccc1F ZINC000179607876 385477367 /nfs/dbraw/zinc/47/73/67/385477367.db2.gz GLVQJXJKCFFKJV-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1n[nH]cc1C[N@H+](C)Cc1ccccc1F ZINC000179607876 385477372 /nfs/dbraw/zinc/47/73/72/385477372.db2.gz GLVQJXJKCFFKJV-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO CC/C=C/CC[N@@H+]1CC(F)(F)C[C@H]1CO ZINC000364590953 385479383 /nfs/dbraw/zinc/47/93/83/385479383.db2.gz KPWQWWHMKWZMIG-FSIBCCDJSA-N 1 2 219.275 2.045 20 0 BEADLO CC/C=C/CC[N@H+]1CC(F)(F)C[C@H]1CO ZINC000364590953 385479389 /nfs/dbraw/zinc/47/93/89/385479389.db2.gz KPWQWWHMKWZMIG-FSIBCCDJSA-N 1 2 219.275 2.045 20 0 BEADLO COC[C@@H]([NH2+][C@H](C)c1cnccn1)c1ccco1 ZINC000156621191 385463048 /nfs/dbraw/zinc/46/30/48/385463048.db2.gz TVSSMJSLDPWZRX-ZYHUDNBSSA-N 1 2 247.298 2.108 20 0 BEADLO Cc1ccsc1C(=O)Nc1cc[nH+]cc1O ZINC000109889573 385490546 /nfs/dbraw/zinc/49/05/46/385490546.db2.gz KAAAMNMDVNXBEC-UHFFFAOYSA-N 1 2 234.280 2.409 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NCC1CCC1 ZINC000179864824 385496787 /nfs/dbraw/zinc/49/67/87/385496787.db2.gz PYBGLFMNULBVPH-UHFFFAOYSA-N 1 2 219.288 2.312 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@@H](C)C2)o1 ZINC000179863603 385496797 /nfs/dbraw/zinc/49/67/97/385496797.db2.gz ZRFDHELVCABOSO-JTQLQIEISA-N 1 2 209.289 2.063 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@@H](C)C2)o1 ZINC000179863603 385496802 /nfs/dbraw/zinc/49/68/02/385496802.db2.gz ZRFDHELVCABOSO-JTQLQIEISA-N 1 2 209.289 2.063 20 0 BEADLO CC(C)CCCNC(=O)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000364746332 385508564 /nfs/dbraw/zinc/50/85/64/385508564.db2.gz NKWKSGRDWOTUCE-NSHDSACASA-N 1 2 249.358 2.382 20 0 BEADLO CC(C)CCCNC(=O)[C@H]1CCCc2[nH]c[nH+]c21 ZINC000364746332 385508567 /nfs/dbraw/zinc/50/85/67/385508567.db2.gz NKWKSGRDWOTUCE-NSHDSACASA-N 1 2 249.358 2.382 20 0 BEADLO Cn1c(Cl)cnc1C[NH+]1CCCCCC1 ZINC000052856420 385510218 /nfs/dbraw/zinc/51/02/18/385510218.db2.gz LIRZCYFYDLYDPP-UHFFFAOYSA-N 1 2 227.739 2.450 20 0 BEADLO C[C@@]1(O)CC[N@H+](Cc2cc(F)c(F)cc2F)C1 ZINC000180199031 385512411 /nfs/dbraw/zinc/51/24/11/385512411.db2.gz XZTRWMFDNOQCBZ-GFCCVEGCSA-N 1 2 245.244 2.061 20 0 BEADLO C[C@@]1(O)CC[N@@H+](Cc2cc(F)c(F)cc2F)C1 ZINC000180199031 385512417 /nfs/dbraw/zinc/51/24/17/385512417.db2.gz XZTRWMFDNOQCBZ-GFCCVEGCSA-N 1 2 245.244 2.061 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)sc1C ZINC000334381457 385542224 /nfs/dbraw/zinc/54/22/24/385542224.db2.gz JLFTYWLACVVKMU-PHIMTYICSA-N 1 2 238.356 2.123 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)sc1C ZINC000334381457 385542230 /nfs/dbraw/zinc/54/22/30/385542230.db2.gz JLFTYWLACVVKMU-PHIMTYICSA-N 1 2 238.356 2.123 20 0 BEADLO Cc1nnc(SCCCn2cc[nH+]c2)s1 ZINC000180430929 385523280 /nfs/dbraw/zinc/52/32/80/385523280.db2.gz GQWSSZOOEBAORD-UHFFFAOYSA-N 1 2 240.357 2.225 20 0 BEADLO CC[C@@H](C)CN(C)C(=O)c1ccc2[nH+]ccn2c1 ZINC000171875310 385527657 /nfs/dbraw/zinc/52/76/57/385527657.db2.gz HKPMIBOUEDFMJJ-LLVKDONJSA-N 1 2 245.326 2.452 20 0 BEADLO Cn1c(C[NH+]2CCOCC2)cc2ccccc21 ZINC000258196624 385553722 /nfs/dbraw/zinc/55/37/22/385553722.db2.gz ZVYNYTLBLIRLIS-UHFFFAOYSA-N 1 2 230.311 2.011 20 0 BEADLO C[C@@H]1CC(C)(C)CN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493195489 385554216 /nfs/dbraw/zinc/55/42/16/385554216.db2.gz IISCPMCBOXMPQI-UMCURTJPSA-N 1 2 233.315 2.070 20 0 BEADLO CCCCN(CCCO)c1cc[nH+]c(C2CC2)n1 ZINC000180905354 385555498 /nfs/dbraw/zinc/55/54/98/385555498.db2.gz CAXAIUUTAURNDN-UHFFFAOYSA-N 1 2 249.358 2.343 20 0 BEADLO Cc1cccc(C(=O)Nc2cc[nH+]cc2C)n1 ZINC000107288373 385560054 /nfs/dbraw/zinc/56/00/54/385560054.db2.gz MWAVVUQEAQTWLL-UHFFFAOYSA-N 1 2 227.267 2.346 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1ccco1 ZINC000107291075 385560994 /nfs/dbraw/zinc/56/09/94/385560994.db2.gz JGTSVTWKHAMLMI-UHFFFAOYSA-N 1 2 202.213 2.235 20 0 BEADLO C1=C(Cc2ccccc2)N2CC[NH+]=C2S1 ZINC000181308260 385570631 /nfs/dbraw/zinc/57/06/31/385570631.db2.gz KILIXFVXFAGOON-UHFFFAOYSA-N 1 2 216.309 2.489 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1ccc2c(c1)CCC2 ZINC000280758882 385600775 /nfs/dbraw/zinc/60/07/75/385600775.db2.gz FFZXPYCJDMONJZ-LLVKDONJSA-N 1 2 247.338 2.169 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1ccc2c(c1)CCC2 ZINC000280758882 385600777 /nfs/dbraw/zinc/60/07/77/385600777.db2.gz FFZXPYCJDMONJZ-LLVKDONJSA-N 1 2 247.338 2.169 20 0 BEADLO CC[C@@H](C)C(=O)NC[C@@H]1CCCn2cc(C)[nH+]c21 ZINC000337289431 385586528 /nfs/dbraw/zinc/58/65/28/385586528.db2.gz BUCVUBBEFPKTEI-PWSUYJOCSA-N 1 2 249.358 2.231 20 0 BEADLO CC[C@@H](F)C[NH2+][C@@H](C)c1nnc(C)s1 ZINC000336649066 385587071 /nfs/dbraw/zinc/58/70/71/385587071.db2.gz HIQVOWZAMVZQDI-POYBYMJQSA-N 1 2 217.313 2.245 20 0 BEADLO COC[C@@H](C)Nc1cc[nH+]c2ccncc12 ZINC000309455815 385588109 /nfs/dbraw/zinc/58/81/09/385588109.db2.gz MILRSQPPEUTOLF-SECBINFHSA-N 1 2 217.272 2.077 20 0 BEADLO FC(F)C1(NCc2cccc3[nH+]ccn32)CC1 ZINC000337300244 385588954 /nfs/dbraw/zinc/58/89/54/385588954.db2.gz PJEJZWKITJZIIX-UHFFFAOYSA-N 1 2 237.253 2.222 20 0 BEADLO CC(C)c1noc(C[NH2+][C@H](C)c2cccnc2)n1 ZINC000181632442 385589521 /nfs/dbraw/zinc/58/95/21/385589521.db2.gz WSRKPCKBPYQPNN-SNVBAGLBSA-N 1 2 246.314 2.439 20 0 BEADLO FCCN[C@@H](c1[nH]cc[nH+]1)c1ccc(F)cc1 ZINC000280878957 385615431 /nfs/dbraw/zinc/61/54/31/385615431.db2.gz AVOPQEVKNVJSOT-LLVKDONJSA-N 1 2 237.253 2.197 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)C/C=C/c1ccccc1 ZINC000280948740 385620006 /nfs/dbraw/zinc/62/00/06/385620006.db2.gz TWBGSDMWOHBARQ-OFFHKIPUSA-N 1 2 233.311 2.193 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)C/C=C/c1ccccc1 ZINC000280948740 385620012 /nfs/dbraw/zinc/62/00/12/385620012.db2.gz TWBGSDMWOHBARQ-OFFHKIPUSA-N 1 2 233.311 2.193 20 0 BEADLO C/C=C(\CC)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000365126081 385607988 /nfs/dbraw/zinc/60/79/88/385607988.db2.gz PQOWDIZHCRXEGG-ACDNVWSCSA-N 1 2 247.342 2.403 20 0 BEADLO CSCCC[N@H+](C)Cc1c(Cl)cnn1C ZINC000281136961 385637948 /nfs/dbraw/zinc/63/79/48/385637948.db2.gz DLMJTOUXXDBFMD-UHFFFAOYSA-N 1 2 247.795 2.258 20 0 BEADLO CCc1cc(NCc2cc(C)[nH+]c(C)c2)ncn1 ZINC000643191199 385637977 /nfs/dbraw/zinc/63/79/77/385637977.db2.gz HMOSAOMKDRCUQR-UHFFFAOYSA-N 1 2 242.326 2.085 20 0 BEADLO CSCCC[N@@H+](C)Cc1c(Cl)cnn1C ZINC000281136961 385637953 /nfs/dbraw/zinc/63/79/53/385637953.db2.gz DLMJTOUXXDBFMD-UHFFFAOYSA-N 1 2 247.795 2.258 20 0 BEADLO C[C@@H]1CN(c2[nH+]ccc3cc(F)ccc32)C[C@@H]1O ZINC000645203960 385639476 /nfs/dbraw/zinc/63/94/76/385639476.db2.gz HCGFGXDBLHOGLI-RNCFNFMXSA-N 1 2 246.285 2.191 20 0 BEADLO C[C@@H](O)CCC[N@@H+]1CCCC[C@@H]1C(F)F ZINC000337411800 385642590 /nfs/dbraw/zinc/64/25/90/385642590.db2.gz PGNOYKXGQCVWEE-NXEZZACHSA-N 1 2 221.291 2.267 20 0 BEADLO C[C@@H](O)CCC[N@H+]1CCCC[C@@H]1C(F)F ZINC000337411800 385642595 /nfs/dbraw/zinc/64/25/95/385642595.db2.gz PGNOYKXGQCVWEE-NXEZZACHSA-N 1 2 221.291 2.267 20 0 BEADLO Cc1nocc1C[NH2+]C(C)(C)c1nccs1 ZINC000293571159 385645884 /nfs/dbraw/zinc/64/58/84/385645884.db2.gz MZKGJDOVKYXKBQ-UHFFFAOYSA-N 1 2 237.328 2.464 20 0 BEADLO Cc1ccc(C[NH2+]Cc2oc(C)nc2C)o1 ZINC000311766007 385665505 /nfs/dbraw/zinc/66/55/05/385665505.db2.gz LSRBXJCPEUSEHN-UHFFFAOYSA-N 1 2 220.272 2.483 20 0 BEADLO Fc1cccc(C2([NH2+]Cc3csnn3)CC2)c1 ZINC000182359473 385660901 /nfs/dbraw/zinc/66/09/01/385660901.db2.gz FFIHDSIIRPGCNR-UHFFFAOYSA-N 1 2 249.314 2.456 20 0 BEADLO Cn1c[nH+]c2c1CCN(Cc1ccccc1F)C2 ZINC000363814606 385661346 /nfs/dbraw/zinc/66/13/46/385661346.db2.gz HQKHTYMUWSTDCD-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO CC1(C)CCC[C@@H](C(=O)NCc2[nH]cc[nH+]2)C1 ZINC000270037842 385661739 /nfs/dbraw/zinc/66/17/39/385661739.db2.gz INBGJXBCBLDTJH-SNVBAGLBSA-N 1 2 235.331 2.242 20 0 BEADLO COc1cc(C)[nH+]c(CSc2ncccn2)c1 ZINC000270122955 385673248 /nfs/dbraw/zinc/67/32/48/385673248.db2.gz KOBSHAUWDJFHOV-UHFFFAOYSA-N 1 2 247.323 2.481 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cccnc1)c1ccon1 ZINC000309544283 385679176 /nfs/dbraw/zinc/67/91/76/385679176.db2.gz GNHXSWZTJHENQT-VHSXEESVSA-N 1 2 217.272 2.481 20 0 BEADLO Cc1nnsc1C[NH2+][C@@H](C)c1ccco1 ZINC000293607065 385681915 /nfs/dbraw/zinc/68/19/15/385681915.db2.gz JCGGQMYXNKAIAE-ZETCQYMHSA-N 1 2 223.301 2.290 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2nnc(C3CC3)[nH]2)o1 ZINC000182576246 385683491 /nfs/dbraw/zinc/68/34/91/385683491.db2.gz GRKIQIBVDFDWJJ-VIFPVBQESA-N 1 2 246.314 2.434 20 0 BEADLO Cc1cnc(NCCc2cc[nH+]cc2C)s1 ZINC000336735738 385717650 /nfs/dbraw/zinc/71/76/50/385717650.db2.gz LZSLOPLQFIUTAU-UHFFFAOYSA-N 1 2 233.340 2.231 20 0 BEADLO C[C@@H]([NH2+]Cc1nnc2n1CCCC2)c1ccco1 ZINC000182620371 385688809 /nfs/dbraw/zinc/68/88/09/385688809.db2.gz LZXBTUAWYORQJY-SNVBAGLBSA-N 1 2 246.314 2.058 20 0 BEADLO CC(C)C[C@H]1CCCN1C(=O)CCn1cc[nH+]c1 ZINC000337535217 385697951 /nfs/dbraw/zinc/69/79/51/385697951.db2.gz HDEFPEAZADPMAD-CYBMUJFWSA-N 1 2 249.358 2.310 20 0 BEADLO CCN(CC)C(=O)C[C@@H](C)[NH2+]C1(C(F)F)CC1 ZINC000337528561 385698285 /nfs/dbraw/zinc/69/82/85/385698285.db2.gz BVYDHBGFXPAASG-SECBINFHSA-N 1 2 248.317 2.021 20 0 BEADLO CC(C)c1nc(NCCC[C@@H](C)O)cc[nH+]1 ZINC000309562763 385698844 /nfs/dbraw/zinc/69/88/44/385698844.db2.gz LNJDFFJXDJARAT-SNVBAGLBSA-N 1 2 223.320 2.173 20 0 BEADLO CO[C@H](C)C[N@@H+]1CCCC[C@@H]1C(F)F ZINC000337515294 385699720 /nfs/dbraw/zinc/69/97/20/385699720.db2.gz LLHSKDQHQMOGJV-RKDXNWHRSA-N 1 2 207.264 2.141 20 0 BEADLO CO[C@H](C)C[N@H+]1CCCC[C@@H]1C(F)F ZINC000337515294 385699726 /nfs/dbraw/zinc/69/97/26/385699726.db2.gz LLHSKDQHQMOGJV-RKDXNWHRSA-N 1 2 207.264 2.141 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)NC1CCC2(CC2)CC1 ZINC000282756069 385785682 /nfs/dbraw/zinc/78/56/82/385785682.db2.gz KOCDGSGSHXPUOH-OWOJBTEDSA-N 1 2 245.326 2.262 20 0 BEADLO CCSCCSCc1[nH+]ccn1C ZINC000185568582 385734484 /nfs/dbraw/zinc/73/44/84/385734484.db2.gz YUDODEOMAOQTKK-UHFFFAOYSA-N 1 2 216.375 2.406 20 0 BEADLO CC[C@@H](C)[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000282185946 385739330 /nfs/dbraw/zinc/73/93/30/385739330.db2.gz WFGYZMBPOZERNE-ZYHUDNBSSA-N 1 2 230.315 2.282 20 0 BEADLO FC(F)C1([NH2+]C/C=C/c2ccncc2)CC1 ZINC000309609907 385741546 /nfs/dbraw/zinc/74/15/46/385741546.db2.gz ZDWJLVQNWKAADI-OWOJBTEDSA-N 1 2 224.254 2.482 20 0 BEADLO FC(F)(C[NH2+][C@@H]1CCOC1)c1ccccc1 ZINC000161173412 385744591 /nfs/dbraw/zinc/74/45/91/385744591.db2.gz ZZQAKAZRPAUGPU-LLVKDONJSA-N 1 2 227.254 2.157 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1cncs1 ZINC000270988335 385767251 /nfs/dbraw/zinc/76/72/51/385767251.db2.gz GSEJNWGLYDQRDE-UWVGGRQHSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1cncs1 ZINC000270988335 385767257 /nfs/dbraw/zinc/76/72/57/385767257.db2.gz GSEJNWGLYDQRDE-UWVGGRQHSA-N 1 2 226.345 2.142 20 0 BEADLO CC(C)CCN(C(=O)C=Cc1c[nH]c[nH+]1)C1CC1 ZINC000282571365 385770310 /nfs/dbraw/zinc/77/03/10/385770310.db2.gz AKQPHRXVHMQTTR-ZZXKWVIFSA-N 1 2 247.342 2.460 20 0 BEADLO CCC1CCN(C(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000282575438 385772827 /nfs/dbraw/zinc/77/28/27/385772827.db2.gz ASKAABVEFOZZBS-ONEGZZNKSA-N 1 2 233.315 2.072 20 0 BEADLO Cc1cn2cc(NC(=O)C(C)(C)F)ccc2[nH+]1 ZINC000271052003 385778683 /nfs/dbraw/zinc/77/86/83/385778683.db2.gz AXCDBVRRCGMVRU-UHFFFAOYSA-N 1 2 235.262 2.329 20 0 BEADLO Cn1cc(Cl)c(C[NH+]2CCCCC2)n1 ZINC000335541780 385783813 /nfs/dbraw/zinc/78/38/13/385783813.db2.gz CYGVXKSSYFQLAX-UHFFFAOYSA-N 1 2 213.712 2.059 20 0 BEADLO C[C@@H]([NH2+]Cc1c[nH]cn1)c1ccc2n[nH]cc2c1 ZINC000353103862 385719317 /nfs/dbraw/zinc/71/93/17/385719317.db2.gz UDKRENHAKCRWFU-SECBINFHSA-N 1 2 241.298 2.137 20 0 BEADLO C[C@H]([NH2+]c1ccc(N(C)CCO)cc1)C1CC1 ZINC000182952330 385724386 /nfs/dbraw/zinc/72/43/86/385724386.db2.gz MOHPQFAUPYQFMD-NSHDSACASA-N 1 2 234.343 2.326 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2O[C@H](C)C[C@H]2C)c(C)[nH+]1 ZINC000282023038 385725635 /nfs/dbraw/zinc/72/56/35/385725635.db2.gz WBHLSUHRJMHEEI-ZDSQKVDBSA-N 1 2 248.326 2.450 20 0 BEADLO CN(C)c1ccccc1N(C)Cc1c[nH+]cn1C ZINC000270642281 385726986 /nfs/dbraw/zinc/72/69/86/385726986.db2.gz NINZKMGNGPBEMT-UHFFFAOYSA-N 1 2 244.342 2.123 20 0 BEADLO CC[C@H]1[C@@H](C)CCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000283016523 385806443 /nfs/dbraw/zinc/80/64/43/385806443.db2.gz HNIKPECGYBQFLY-XVHVLHHCSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@@H]1[C@H](C)[S@@](=O)CC[N@@H+]1Cc1ccsc1 ZINC000271221395 385806546 /nfs/dbraw/zinc/80/65/46/385806546.db2.gz ZGYRQLZBAVTJEP-FTGAXOIBSA-N 1 2 243.397 2.089 20 0 BEADLO C[C@@H]1[C@H](C)[S@@](=O)CC[N@H+]1Cc1ccsc1 ZINC000271221395 385806549 /nfs/dbraw/zinc/80/65/49/385806549.db2.gz ZGYRQLZBAVTJEP-FTGAXOIBSA-N 1 2 243.397 2.089 20 0 BEADLO COc1cc(C)[nH+]c(COc2cc(C)n(C)n2)c1 ZINC000271238927 385808114 /nfs/dbraw/zinc/80/81/14/385808114.db2.gz XNKKESSNKYVLDC-UHFFFAOYSA-N 1 2 247.298 2.020 20 0 BEADLO Cc1cc[nH+]c(NCCc2cn[nH]c2)c1Cl ZINC000336714430 385810266 /nfs/dbraw/zinc/81/02/66/385810266.db2.gz VBFZDRVWLGRSDX-UHFFFAOYSA-N 1 2 236.706 2.421 20 0 BEADLO COCc1cccc(C[N@@H+]2CCC(=O)[C@H](C)C2)c1 ZINC000283300121 385816008 /nfs/dbraw/zinc/81/60/08/385816008.db2.gz XLTLXLKGOCYJIH-GFCCVEGCSA-N 1 2 247.338 2.244 20 0 BEADLO COCc1cccc(C[N@H+]2CCC(=O)[C@H](C)C2)c1 ZINC000283300121 385816009 /nfs/dbraw/zinc/81/60/09/385816009.db2.gz XLTLXLKGOCYJIH-GFCCVEGCSA-N 1 2 247.338 2.244 20 0 BEADLO CC[C@@H](CSC)N(C)c1cc[nH+]c(C)n1 ZINC000271362203 385820625 /nfs/dbraw/zinc/82/06/25/385820625.db2.gz JBXYJQIJARJTGA-JTQLQIEISA-N 1 2 225.361 2.363 20 0 BEADLO O=C(OC1CCC1)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000496018025 385827815 /nfs/dbraw/zinc/82/78/15/385827815.db2.gz AQFGFZFCSJCLFN-UHFFFAOYSA-N 1 2 249.314 2.278 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2ccoc2C)nn1 ZINC000283701793 385829321 /nfs/dbraw/zinc/82/93/21/385829321.db2.gz YKESIFFAJCUWOO-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2ccoc2C)nn1 ZINC000283701793 385829327 /nfs/dbraw/zinc/82/93/27/385829327.db2.gz YKESIFFAJCUWOO-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO CC1(C)CN(Cc2[nH]cc[nH+]2)[C@@H]1c1cccnc1 ZINC000644835432 385830621 /nfs/dbraw/zinc/83/06/21/385830621.db2.gz ZKXMKCIVOORYQX-CYBMUJFWSA-N 1 2 242.326 2.388 20 0 BEADLO CC1(C)CCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000283894196 385838204 /nfs/dbraw/zinc/83/82/04/385838204.db2.gz IWDNQNRKRGDTEX-SNAWJCMRSA-N 1 2 233.315 2.072 20 0 BEADLO CN(Cc1cn2ccccc2[nH+]1)CC(F)(F)F ZINC000112346338 385838619 /nfs/dbraw/zinc/83/86/19/385838619.db2.gz BEOHUSSVLTXGDT-UHFFFAOYSA-N 1 2 243.232 2.328 20 0 BEADLO CCCC[C@@](C)(CO)Nc1cc[nH+]c(C)n1 ZINC000645343389 385840487 /nfs/dbraw/zinc/84/04/87/385840487.db2.gz BTFXSVFUXQQHQW-LBPRGKRZSA-N 1 2 223.320 2.138 20 0 BEADLO Cc1nc(C(C)C)oc1C[N@@H+]1CCO[C@H](C)C1 ZINC000335703088 385841659 /nfs/dbraw/zinc/84/16/59/385841659.db2.gz UECCJHFSEXCVBF-SNVBAGLBSA-N 1 2 238.331 2.327 20 0 BEADLO Cc1nc(C(C)C)oc1C[N@H+]1CCO[C@H](C)C1 ZINC000335703088 385841662 /nfs/dbraw/zinc/84/16/62/385841662.db2.gz UECCJHFSEXCVBF-SNVBAGLBSA-N 1 2 238.331 2.327 20 0 BEADLO c1[nH]nnc1C[NH2+][C@H]1CCC[C@@H]1c1ccccc1 ZINC000283969371 385843864 /nfs/dbraw/zinc/84/38/64/385843864.db2.gz LYJHSWNKRDNKMC-KGLIPLIRSA-N 1 2 242.326 2.231 20 0 BEADLO c1n[nH]nc1C[NH2+][C@H]1CCC[C@@H]1c1ccccc1 ZINC000283969371 385843867 /nfs/dbraw/zinc/84/38/67/385843867.db2.gz LYJHSWNKRDNKMC-KGLIPLIRSA-N 1 2 242.326 2.231 20 0 BEADLO CC(C)c1nc(NCC2(C)COC2)cc[nH+]1 ZINC000112695992 385844240 /nfs/dbraw/zinc/84/42/40/385844240.db2.gz UGPHIIWTNZOUEI-UHFFFAOYSA-N 1 2 221.304 2.048 20 0 BEADLO Cc1noc(C(C)(C)[NH2+]Cc2ccccc2)n1 ZINC000284092958 385851791 /nfs/dbraw/zinc/85/17/91/385851791.db2.gz RRCLWAQHEPMXQI-UHFFFAOYSA-N 1 2 231.299 2.403 20 0 BEADLO CS[C@H]1CCN(c2cc[nH+]cc2F)C1 ZINC000603387357 385852775 /nfs/dbraw/zinc/85/27/75/385852775.db2.gz CNEGLBCPJVFOQC-QMMMGPOBSA-N 1 2 212.293 2.162 20 0 BEADLO CC(C)C1CCN(C(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000284180738 385855808 /nfs/dbraw/zinc/85/58/08/385855808.db2.gz YIDUEIPNAVWJOE-ONEGZZNKSA-N 1 2 247.342 2.318 20 0 BEADLO c1snnc1C[NH2+][C@H]1CSc2ccccc21 ZINC000309688736 385792904 /nfs/dbraw/zinc/79/29/04/385792904.db2.gz OWWZNABFJUORFR-JTQLQIEISA-N 1 2 249.364 2.475 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1ccc(C)s1 ZINC000271176007 385797263 /nfs/dbraw/zinc/79/72/63/385797263.db2.gz WPSQBIDKXIXWPT-UHFFFAOYSA-N 1 2 227.329 2.051 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1ccc(C)s1 ZINC000271176007 385797269 /nfs/dbraw/zinc/79/72/69/385797269.db2.gz WPSQBIDKXIXWPT-UHFFFAOYSA-N 1 2 227.329 2.051 20 0 BEADLO O=C1OCC[C@H]1[N@@H+]1CCC=C(c2ccccc2)C1 ZINC000284746639 385883653 /nfs/dbraw/zinc/88/36/53/385883653.db2.gz LEQKQFGLLFPJJG-CQSZACIVSA-N 1 2 243.306 2.091 20 0 BEADLO O=C1OCC[C@H]1[N@H+]1CCC=C(c2ccccc2)C1 ZINC000284746639 385883655 /nfs/dbraw/zinc/88/36/55/385883655.db2.gz LEQKQFGLLFPJJG-CQSZACIVSA-N 1 2 243.306 2.091 20 0 BEADLO CC1(C)C[C@@H]1[NH2+][C@@H](c1cccs1)c1nnc[nH]1 ZINC000294697067 385883987 /nfs/dbraw/zinc/88/39/87/385883987.db2.gz IVIQRBJKLDKJPQ-UWVGGRQHSA-N 1 2 248.355 2.344 20 0 BEADLO Fc1cc(C[NH+]2CCCCC2)c(F)cn1 ZINC000294737323 385890551 /nfs/dbraw/zinc/89/05/51/385890551.db2.gz HDKHOTHFXWBIRC-UHFFFAOYSA-N 1 2 212.243 2.346 20 0 BEADLO COc1nccc(C[N@H+](C)Cc2ccoc2C)n1 ZINC000294808954 385897672 /nfs/dbraw/zinc/89/76/72/385897672.db2.gz LWNBBIYEPBMBDJ-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1nccc(C[N@@H+](C)Cc2ccoc2C)n1 ZINC000294808954 385897675 /nfs/dbraw/zinc/89/76/75/385897675.db2.gz LWNBBIYEPBMBDJ-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO C[N@H+](Cc1cscn1)Cc1ccc(O)cc1 ZINC000272405929 385900570 /nfs/dbraw/zinc/90/05/70/385900570.db2.gz KEBQAQOTYYYBFS-UHFFFAOYSA-N 1 2 234.324 2.481 20 0 BEADLO C[N@@H+](Cc1cscn1)Cc1ccc(O)cc1 ZINC000272405929 385900574 /nfs/dbraw/zinc/90/05/74/385900574.db2.gz KEBQAQOTYYYBFS-UHFFFAOYSA-N 1 2 234.324 2.481 20 0 BEADLO CCC1CCN(c2nc[nH+]c(N)c2Cl)CC1 ZINC000232927803 385903349 /nfs/dbraw/zinc/90/33/49/385903349.db2.gz URTQWRQTFGWIIC-UHFFFAOYSA-N 1 2 240.738 2.339 20 0 BEADLO CCC1CCN(c2[nH+]cnc(N)c2Cl)CC1 ZINC000232927803 385903353 /nfs/dbraw/zinc/90/33/53/385903353.db2.gz URTQWRQTFGWIIC-UHFFFAOYSA-N 1 2 240.738 2.339 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC=C(c3ccco3)C2)o1 ZINC000285316857 385915517 /nfs/dbraw/zinc/91/55/17/385915517.db2.gz MPBUFDFKHIBDHK-UHFFFAOYSA-N 1 2 245.282 2.260 20 0 BEADLO Cc1nnc(C[N@H+]2CCC=C(c3ccco3)C2)o1 ZINC000285316857 385915519 /nfs/dbraw/zinc/91/55/19/385915519.db2.gz MPBUFDFKHIBDHK-UHFFFAOYSA-N 1 2 245.282 2.260 20 0 BEADLO c1coc(C2=CCC[N@@H+](Cc3cnc[nH]3)C2)c1 ZINC000285410170 385925200 /nfs/dbraw/zinc/92/52/00/385925200.db2.gz USBFFJGSMHVVPF-UHFFFAOYSA-N 1 2 229.283 2.292 20 0 BEADLO c1coc(C2=CCC[N@H+](Cc3cnc[nH]3)C2)c1 ZINC000285410170 385925207 /nfs/dbraw/zinc/92/52/07/385925207.db2.gz USBFFJGSMHVVPF-UHFFFAOYSA-N 1 2 229.283 2.292 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2CCO[C@@H](C)C2)c(C)[nH+]1 ZINC000271961949 385864580 /nfs/dbraw/zinc/86/45/80/385864580.db2.gz GUWHSUXCCAXMSN-JQWIXIFHSA-N 1 2 248.326 2.452 20 0 BEADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1cocn1)CCO2 ZINC000271994034 385866312 /nfs/dbraw/zinc/86/63/12/385866312.db2.gz HJLGGNLLGYYNSS-LBPRGKRZSA-N 1 2 248.257 2.427 20 0 BEADLO c1csc([C@@H]2CCC[N@H+]2Cc2cnn[nH]2)c1 ZINC000284410086 385869181 /nfs/dbraw/zinc/86/91/81/385869181.db2.gz XCBBJEPRGWWMHI-JTQLQIEISA-N 1 2 234.328 2.203 20 0 BEADLO c1csc([C@@H]2CCC[N@@H+]2Cc2cnn[nH]2)c1 ZINC000284410086 385869184 /nfs/dbraw/zinc/86/91/84/385869184.db2.gz XCBBJEPRGWWMHI-JTQLQIEISA-N 1 2 234.328 2.203 20 0 BEADLO c1csc([C@@H]2CCC[N@H+]2Cc2c[nH]nn2)c1 ZINC000284410086 385869188 /nfs/dbraw/zinc/86/91/88/385869188.db2.gz XCBBJEPRGWWMHI-JTQLQIEISA-N 1 2 234.328 2.203 20 0 BEADLO c1csc([C@@H]2CCC[N@@H+]2Cc2c[nH]nn2)c1 ZINC000284410086 385869191 /nfs/dbraw/zinc/86/91/91/385869191.db2.gz XCBBJEPRGWWMHI-JTQLQIEISA-N 1 2 234.328 2.203 20 0 BEADLO c1csc([C@@H]2CCC[N@H+]2Cc2cn[nH]n2)c1 ZINC000284410086 385869195 /nfs/dbraw/zinc/86/91/95/385869195.db2.gz XCBBJEPRGWWMHI-JTQLQIEISA-N 1 2 234.328 2.203 20 0 BEADLO c1csc([C@@H]2CCC[N@@H+]2Cc2cn[nH]n2)c1 ZINC000284410086 385869197 /nfs/dbraw/zinc/86/91/97/385869197.db2.gz XCBBJEPRGWWMHI-JTQLQIEISA-N 1 2 234.328 2.203 20 0 BEADLO CC[N@H+](CC(F)F)CC1(COC)CCC1 ZINC000643376835 385873701 /nfs/dbraw/zinc/87/37/01/385873701.db2.gz QBMVIUTWEURPAZ-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO CC[NH2+]Cc1ccccc1NCc1cn[nH]c1C ZINC000414873085 385873761 /nfs/dbraw/zinc/87/37/61/385873761.db2.gz WYIDLNKOFJSVEM-UHFFFAOYSA-N 1 2 244.342 2.440 20 0 BEADLO CC[N@@H+](CC(F)F)CC1(COC)CCC1 ZINC000643376835 385873703 /nfs/dbraw/zinc/87/37/03/385873703.db2.gz QBMVIUTWEURPAZ-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO CC/C(C)=C/C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000294669778 385881065 /nfs/dbraw/zinc/88/10/65/385881065.db2.gz SLWALBBHIBNZER-ZKQHCESOSA-N 1 2 247.342 2.472 20 0 BEADLO CCN(c1[nH+]cnc2c1cnn2C)C1CCCC1 ZINC000194024162 385883165 /nfs/dbraw/zinc/88/31/65/385883165.db2.gz WFYSMORUALLGBL-UHFFFAOYSA-N 1 2 245.330 2.132 20 0 BEADLO Cl/C=C/C[N@@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000285968782 385984212 /nfs/dbraw/zinc/98/42/12/385984212.db2.gz DOOARKVLAREOQT-JYBNPQIESA-N 1 2 211.696 2.299 20 0 BEADLO Cl/C=C/C[N@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000285968782 385984218 /nfs/dbraw/zinc/98/42/18/385984218.db2.gz DOOARKVLAREOQT-JYBNPQIESA-N 1 2 211.696 2.299 20 0 BEADLO CC[C@@H]1CC[N@H+](Cc2nc(C(F)F)no2)C1 ZINC000425411973 385990877 /nfs/dbraw/zinc/99/08/77/385990877.db2.gz BJEHJYJUBJPOTO-SSDOTTSWSA-N 1 2 231.246 2.239 20 0 BEADLO CC[C@@H]1CC[N@@H+](Cc2nc(C(F)F)no2)C1 ZINC000425411973 385990879 /nfs/dbraw/zinc/99/08/79/385990879.db2.gz BJEHJYJUBJPOTO-SSDOTTSWSA-N 1 2 231.246 2.239 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccco1)c1ccn(C)n1 ZINC000414063779 385940055 /nfs/dbraw/zinc/94/00/55/385940055.db2.gz MUQVEJAHXPIZDM-ZJUUUORDSA-N 1 2 219.288 2.425 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+](C)C[C@H]2CCCO2)s1 ZINC000338292302 385943975 /nfs/dbraw/zinc/94/39/75/385943975.db2.gz ASDUASJCAMRRDL-PSASIEDQSA-N 1 2 241.360 2.018 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+](C)C[C@H]2CCCO2)s1 ZINC000338292302 385943979 /nfs/dbraw/zinc/94/39/79/385943979.db2.gz ASDUASJCAMRRDL-PSASIEDQSA-N 1 2 241.360 2.018 20 0 BEADLO C[C@@H]1COCC[C@@H]1[NH2+]c1ccc2c(c1)CCN2 ZINC000335051671 385949729 /nfs/dbraw/zinc/94/97/29/385949729.db2.gz CDOXZVLVWJLHSI-MFKMUULPSA-N 1 2 232.327 2.492 20 0 BEADLO C[C@@H]1COCC[C@@H]1Nc1ccc2c(c1)CC[NH2+]2 ZINC000335051671 385949734 /nfs/dbraw/zinc/94/97/34/385949734.db2.gz CDOXZVLVWJLHSI-MFKMUULPSA-N 1 2 232.327 2.492 20 0 BEADLO OC1CCC([NH2+]c2ccc3c(c2)CCN3)CC1 ZINC000335053529 385951061 /nfs/dbraw/zinc/95/10/61/385951061.db2.gz HVAHDNJFTVJSAD-UHFFFAOYSA-N 1 2 232.327 2.370 20 0 BEADLO COC(=O)[C@H]([NH2+]C/C=C/c1ccccc1)C1CC1 ZINC000272963978 385955104 /nfs/dbraw/zinc/95/51/04/385955104.db2.gz PSRPDVQWIQLUDR-LHRNQBEKSA-N 1 2 245.322 2.241 20 0 BEADLO COC(=O)[C@@H]([NH2+]C/C=C/c1ccccc1)C1CC1 ZINC000272963973 385955704 /nfs/dbraw/zinc/95/57/04/385955704.db2.gz PSRPDVQWIQLUDR-GPAKFWEMSA-N 1 2 245.322 2.241 20 0 BEADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1ccon1 ZINC000285719746 385956925 /nfs/dbraw/zinc/95/69/25/385956925.db2.gz QBRCHKQLOFVHGB-UHFFFAOYSA-N 1 2 235.287 2.304 20 0 BEADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1ccno1 ZINC000285809199 385965223 /nfs/dbraw/zinc/96/52/23/385965223.db2.gz VTHDZPLXWMUVJS-UHFFFAOYSA-N 1 2 235.287 2.304 20 0 BEADLO Cc1noc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)n1 ZINC000335014846 385971291 /nfs/dbraw/zinc/97/12/91/385971291.db2.gz MMTVMFQYBZIUOR-NSHDSACASA-N 1 2 232.287 2.043 20 0 BEADLO Cc1noc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)n1 ZINC000335014846 385971298 /nfs/dbraw/zinc/97/12/98/385971298.db2.gz MMTVMFQYBZIUOR-NSHDSACASA-N 1 2 232.287 2.043 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1cccc(F)c1 ZINC000335016863 385973446 /nfs/dbraw/zinc/97/34/46/385973446.db2.gz XROBPZORBAHDJY-UHFFFAOYSA-N 1 2 246.241 2.482 20 0 BEADLO CCC[C@H](OC)C(=O)Nc1cccc2[nH+]ccn21 ZINC000295120502 385973617 /nfs/dbraw/zinc/97/36/17/385973617.db2.gz ZLAKIUPEGBRASC-JTQLQIEISA-N 1 2 247.298 2.088 20 0 BEADLO CC[C@@H]1CCC[C@@H]1CNC(=O)Cc1[nH]c[nH+]c1C ZINC000452992929 385998090 /nfs/dbraw/zinc/99/80/90/385998090.db2.gz CWHJCSZPMNASSP-VXGBXAGGSA-N 1 2 249.358 2.203 20 0 BEADLO CC[C@@H]1CCC[C@@H]1CNC(=O)Cc1[nH+]c[nH]c1C ZINC000452992929 385998099 /nfs/dbraw/zinc/99/80/99/385998099.db2.gz CWHJCSZPMNASSP-VXGBXAGGSA-N 1 2 249.358 2.203 20 0 BEADLO Cc1cc(N[C@@H]2CC[C@H]2C)nc(C2CC2)[nH+]1 ZINC000336749933 386001574 /nfs/dbraw/zinc/00/15/74/386001574.db2.gz UKDACWKQJDMYJH-LDYMZIIASA-N 1 2 217.316 2.295 20 0 BEADLO C[N@H+](Cc1ccccc1Cl)C(C)(C)C(N)=O ZINC000295292964 386008112 /nfs/dbraw/zinc/00/81/12/386008112.db2.gz DWCFRPBZIYXPTM-UHFFFAOYSA-N 1 2 240.734 2.036 20 0 BEADLO C[N@@H+](Cc1ccccc1Cl)C(C)(C)C(N)=O ZINC000295292964 386008115 /nfs/dbraw/zinc/00/81/15/386008115.db2.gz DWCFRPBZIYXPTM-UHFFFAOYSA-N 1 2 240.734 2.036 20 0 BEADLO CCOC(=O)C[NH2+][C@H]1CCCC[C@H]1SCC ZINC000189494865 386013451 /nfs/dbraw/zinc/01/34/51/386013451.db2.gz PCPCTRVVVGDUME-WDEREUQCSA-N 1 2 245.388 2.203 20 0 BEADLO Cc1noc([C@H](C)[NH2+]C/C=C\c2ccncc2)n1 ZINC000425997474 386016035 /nfs/dbraw/zinc/01/60/35/386016035.db2.gz BWUXLYBSPJKSDD-XOULXFPDSA-N 1 2 244.298 2.137 20 0 BEADLO c1c(Cc2noc(C3CC3)n2)[nH+]c2ccccn12 ZINC000273646907 386020427 /nfs/dbraw/zinc/02/04/27/386020427.db2.gz CMXKSRUNQGNYJD-UHFFFAOYSA-N 1 2 240.266 2.186 20 0 BEADLO C[NH2+]Cc1noc([C@H](C)CC(C)(C)C)n1 ZINC000414638330 386027065 /nfs/dbraw/zinc/02/70/65/386027065.db2.gz DUDQMYGOIFRCDI-MRVPVSSYSA-N 1 2 211.309 2.329 20 0 BEADLO CC[C@@H](C)CCC(=O)NCc1[nH+]ccn1CC ZINC000295448555 386033555 /nfs/dbraw/zinc/03/35/55/386033555.db2.gz ATPULSJZXUIMHG-LLVKDONJSA-N 1 2 237.347 2.346 20 0 BEADLO CSCc1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000356132653 386042026 /nfs/dbraw/zinc/04/20/26/386042026.db2.gz VEABEWNBLXYCQJ-UHFFFAOYSA-N 1 2 235.312 2.227 20 0 BEADLO C[C@H]1CCCC[C@H]1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000335076257 386045245 /nfs/dbraw/zinc/04/52/45/386045245.db2.gz KIBDZYSDENGWIW-WDEREUQCSA-N 1 2 235.331 2.194 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2C[C@]2(F)c2ccccc2)n1 ZINC000414645980 386053476 /nfs/dbraw/zinc/05/34/76/386053476.db2.gz RETBPNNXAWLGIZ-GWCFXTLKSA-N 1 2 247.273 2.141 20 0 BEADLO Cc1noc(C[NH2+][C@H](C)c2cccs2)n1 ZINC000037980755 386108842 /nfs/dbraw/zinc/10/88/42/386108842.db2.gz ZSXXEIVQXUKNKY-SSDOTTSWSA-N 1 2 223.301 2.290 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2nccn2C)o1 ZINC000037979148 386112303 /nfs/dbraw/zinc/11/23/03/386112303.db2.gz ZGHASULMXZISEM-JTQLQIEISA-N 1 2 219.288 2.172 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)Cc1cccn1C ZINC000156958177 386114101 /nfs/dbraw/zinc/11/41/01/386114101.db2.gz CJCAXQDBPZNVJS-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)Cc1cccn1C ZINC000156958177 386114104 /nfs/dbraw/zinc/11/41/04/386114104.db2.gz CJCAXQDBPZNVJS-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO CCC1(NC(=O)CCn2cc[nH+]c2)CCCC1 ZINC000295959540 386114238 /nfs/dbraw/zinc/11/42/38/386114238.db2.gz JBYXQEPEOLFQNH-UHFFFAOYSA-N 1 2 235.331 2.112 20 0 BEADLO CC[C@@H](C)[NH2+][C@H](c1cccs1)c1nnc[nH]1 ZINC000295964886 386114870 /nfs/dbraw/zinc/11/48/70/386114870.db2.gz MKCKCFHSCSRFDC-PSASIEDQSA-N 1 2 236.344 2.344 20 0 BEADLO FC(F)[C@H]1CCC[N@@H+]1CCCn1ccnc1 ZINC000353181465 386117483 /nfs/dbraw/zinc/11/74/83/386117483.db2.gz MEEITFTVBRYIIM-SNVBAGLBSA-N 1 2 229.274 2.003 20 0 BEADLO FC(F)[C@H]1CCC[N@H+]1CCCn1ccnc1 ZINC000353181465 386117491 /nfs/dbraw/zinc/11/74/91/386117491.db2.gz MEEITFTVBRYIIM-SNVBAGLBSA-N 1 2 229.274 2.003 20 0 BEADLO FC(F)[C@H]1CCCN1CCCn1cc[nH+]c1 ZINC000353181465 386117498 /nfs/dbraw/zinc/11/74/98/386117498.db2.gz MEEITFTVBRYIIM-SNVBAGLBSA-N 1 2 229.274 2.003 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)C1CC1 ZINC000287396754 386119205 /nfs/dbraw/zinc/11/92/05/386119205.db2.gz DHLXDYDDZNIEAF-UHFFFAOYSA-N 1 2 219.288 2.325 20 0 BEADLO COc1nccnc1CNc1ccc(C)[nH+]c1C ZINC000295592013 386057995 /nfs/dbraw/zinc/05/79/95/386057995.db2.gz FFKZGIWCXIVFHH-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO CCCCCC(=O)NCc1[nH+]ccn1CC ZINC000295590259 386059072 /nfs/dbraw/zinc/05/90/72/386059072.db2.gz HRZGWVBQXMNOML-UHFFFAOYSA-N 1 2 223.320 2.100 20 0 BEADLO CC(C)C[C@@H](C)C(=O)N(C)Cc1[nH+]ccn1C ZINC000274030037 386061569 /nfs/dbraw/zinc/06/15/69/386061569.db2.gz AUWJOOACAQJDFA-LLVKDONJSA-N 1 2 237.347 2.061 20 0 BEADLO Cc1c(Cl)c(C[N@H+]2CC=CCC2)nn1C ZINC000643292128 386073809 /nfs/dbraw/zinc/07/38/09/386073809.db2.gz BYBDVMNJQVUKHY-UHFFFAOYSA-N 1 2 225.723 2.144 20 0 BEADLO Cc1c(Cl)c(C[N@@H+]2CC=CCC2)nn1C ZINC000643292128 386073814 /nfs/dbraw/zinc/07/38/14/386073814.db2.gz BYBDVMNJQVUKHY-UHFFFAOYSA-N 1 2 225.723 2.144 20 0 BEADLO CC(C)c1noc([C@H](C)[NH2+][C@H](C)c2cn[nH]c2)n1 ZINC000274152781 386077417 /nfs/dbraw/zinc/07/74/17/386077417.db2.gz YLYCWUYHODSYTJ-BDAKNGLRSA-N 1 2 249.318 2.328 20 0 BEADLO CC(C)n1cncc1C[N@@H+]1CC[C@](C)(F)C1 ZINC000335085770 386080633 /nfs/dbraw/zinc/08/06/33/386080633.db2.gz NKHXKJCOWRSICY-LBPRGKRZSA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1cncc1C[N@H+]1CC[C@](C)(F)C1 ZINC000335085770 386080637 /nfs/dbraw/zinc/08/06/37/386080637.db2.gz NKHXKJCOWRSICY-LBPRGKRZSA-N 1 2 225.311 2.398 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)NC[C@@H]1C[C@H]1C ZINC000287445144 386122591 /nfs/dbraw/zinc/12/25/91/386122591.db2.gz HRPVACGWLXRSPB-KOLCDFICSA-N 1 2 233.315 2.476 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nc(C(F)F)no2)[C@H]1C ZINC000335100387 386082909 /nfs/dbraw/zinc/08/29/09/386082909.db2.gz SLVWBUFCTZFBSW-RQJHMYQMSA-N 1 2 231.246 2.238 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nc(C(F)F)no2)[C@H]1C ZINC000335100387 386082913 /nfs/dbraw/zinc/08/29/13/386082913.db2.gz SLVWBUFCTZFBSW-RQJHMYQMSA-N 1 2 231.246 2.238 20 0 BEADLO Cc1nc(NC[C@H]2CCCC[C@@H]2C)nc(N)[nH+]1 ZINC000310086288 386083155 /nfs/dbraw/zinc/08/31/55/386083155.db2.gz ATZFEFKYGCRKBR-WCBMZHEXSA-N 1 2 235.335 2.000 20 0 BEADLO Cc1nc(N)nc(NC[C@H]2CCCC[C@@H]2C)[nH+]1 ZINC000310086288 386083158 /nfs/dbraw/zinc/08/31/58/386083158.db2.gz ATZFEFKYGCRKBR-WCBMZHEXSA-N 1 2 235.335 2.000 20 0 BEADLO Cc1nc(NC[C@@H]2CCCC[C@@H]2C)nc(N)[nH+]1 ZINC000310086289 386083628 /nfs/dbraw/zinc/08/36/28/386083628.db2.gz ATZFEFKYGCRKBR-WPRPVWTQSA-N 1 2 235.335 2.000 20 0 BEADLO Cc1nc(N)nc(NC[C@@H]2CCCC[C@@H]2C)[nH+]1 ZINC000310086289 386083635 /nfs/dbraw/zinc/08/36/35/386083635.db2.gz ATZFEFKYGCRKBR-WPRPVWTQSA-N 1 2 235.335 2.000 20 0 BEADLO COc1cc(C[NH2+][C@@H](C)c2cscn2)ccn1 ZINC000162350228 386084563 /nfs/dbraw/zinc/08/45/63/386084563.db2.gz VUHNFBXJVWXSBV-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO Cc1ccc([C@@H](O)CNc2cccc[nH+]2)o1 ZINC000265960341 386087589 /nfs/dbraw/zinc/08/75/89/386087589.db2.gz IWTMASWCTPEXPX-JTQLQIEISA-N 1 2 218.256 2.129 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccccc2F)nn1C ZINC000414278881 386092125 /nfs/dbraw/zinc/09/21/25/386092125.db2.gz ZBMGPGATYBKHKP-UHFFFAOYSA-N 1 2 233.290 2.157 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)C[C@H]1CCC[C@H]1C ZINC000274388960 386096150 /nfs/dbraw/zinc/09/61/50/386096150.db2.gz BRMRZTLWWNPHHL-JHJVBQTASA-N 1 2 249.358 2.214 20 0 BEADLO Cn1c2ccccc2[nH+]c1N[C@@H]1CCC[C@H]1F ZINC000338824400 386147125 /nfs/dbraw/zinc/14/71/25/386147125.db2.gz NSDQNEMIBGLITL-NXEZZACHSA-N 1 2 233.290 2.298 20 0 BEADLO C[N@H+](Cc1nc(C(F)F)no1)[C@@H]1CC1(C)C ZINC000425473564 386147486 /nfs/dbraw/zinc/14/74/86/386147486.db2.gz JFAAGAIXLUAZFP-ZCFIWIBFSA-N 1 2 231.246 2.238 20 0 BEADLO C[N@@H+](Cc1nc(C(F)F)no1)[C@@H]1CC1(C)C ZINC000425473564 386147493 /nfs/dbraw/zinc/14/74/93/386147493.db2.gz JFAAGAIXLUAZFP-ZCFIWIBFSA-N 1 2 231.246 2.238 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCOCC1(C)C ZINC000336587803 386150150 /nfs/dbraw/zinc/15/01/50/386150150.db2.gz UKHAQNZVMAAEBD-UHFFFAOYSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCOCC1(C)C ZINC000336587803 386150157 /nfs/dbraw/zinc/15/01/57/386150157.db2.gz UKHAQNZVMAAEBD-UHFFFAOYSA-N 1 2 237.347 2.075 20 0 BEADLO CO[C@@H](C[N@@H+]1CC[C@@H](C)C(F)(F)C1)C1CC1 ZINC000425482274 386152334 /nfs/dbraw/zinc/15/23/34/386152334.db2.gz QKBOZROPHJIUBD-KOLCDFICSA-N 1 2 233.302 2.389 20 0 BEADLO CO[C@@H](C[N@H+]1CC[C@@H](C)C(F)(F)C1)C1CC1 ZINC000425482274 386152339 /nfs/dbraw/zinc/15/23/39/386152339.db2.gz QKBOZROPHJIUBD-KOLCDFICSA-N 1 2 233.302 2.389 20 0 BEADLO COC(=O)[C@H]1C[C@H](C)CC[N@@H+]1C/C=C/Cl ZINC000274823270 386154814 /nfs/dbraw/zinc/15/48/14/386154814.db2.gz BPXJJQIIJGDVJV-OTIHIVFHSA-N 1 2 231.723 2.012 20 0 BEADLO COC(=O)[C@H]1C[C@H](C)CC[N@H+]1C/C=C/Cl ZINC000274823270 386154819 /nfs/dbraw/zinc/15/48/19/386154819.db2.gz BPXJJQIIJGDVJV-OTIHIVFHSA-N 1 2 231.723 2.012 20 0 BEADLO COC(=O)[C@@H]1C[C@H](C)CC[N@@H+]1C/C=C/Cl ZINC000274823267 386155478 /nfs/dbraw/zinc/15/54/78/386155478.db2.gz BPXJJQIIJGDVJV-AEJJFCSLSA-N 1 2 231.723 2.012 20 0 BEADLO COC(=O)[C@@H]1C[C@H](C)CC[N@H+]1C/C=C/Cl ZINC000274823267 386155487 /nfs/dbraw/zinc/15/54/87/386155487.db2.gz BPXJJQIIJGDVJV-AEJJFCSLSA-N 1 2 231.723 2.012 20 0 BEADLO Cc1nc(N2CCOC[C@H]2CC2CCC2)cc[nH+]1 ZINC000338831958 386156293 /nfs/dbraw/zinc/15/62/93/386156293.db2.gz TVXQAJDOYKYBLW-CYBMUJFWSA-N 1 2 247.342 2.180 20 0 BEADLO FC1CN(Cc2c[nH+]c3ccc(Cl)cn23)C1 ZINC000335148217 386158682 /nfs/dbraw/zinc/15/86/82/386158682.db2.gz FOSBSPAQGUKPRY-UHFFFAOYSA-N 1 2 239.681 2.141 20 0 BEADLO CC[C@H](NC(=O)C1CC(F)(F)C1)c1[nH]cc[nH+]1 ZINC000394741114 386159187 /nfs/dbraw/zinc/15/91/87/386159187.db2.gz QXJPNNZELGMYFR-QMMMGPOBSA-N 1 2 243.257 2.022 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H]1C[C@]1(C)C(C)C ZINC000274884186 386160677 /nfs/dbraw/zinc/16/06/77/386160677.db2.gz HKYJCCUKAALPLR-ZWNOBZJWSA-N 1 2 235.331 2.017 20 0 BEADLO CC(C)[C@@H]1[N@H+](Cc2csnn2)CC1(C)C ZINC000334477049 386161733 /nfs/dbraw/zinc/16/17/33/386161733.db2.gz ONKRCQQNSBWRSF-JTQLQIEISA-N 1 2 225.361 2.405 20 0 BEADLO CC(C)[C@@H]1[N@@H+](Cc2csnn2)CC1(C)C ZINC000334477049 386161741 /nfs/dbraw/zinc/16/17/41/386161741.db2.gz ONKRCQQNSBWRSF-JTQLQIEISA-N 1 2 225.361 2.405 20 0 BEADLO CCC1(C)CCN(C(=O)CCn2cc[nH+]c2)CC1 ZINC000263663851 386164228 /nfs/dbraw/zinc/16/42/28/386164228.db2.gz DJCUZNNDOOIIBH-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO CCc1cccc(C[N@H+](CC)CC(=O)OC)c1 ZINC000346233991 386177997 /nfs/dbraw/zinc/17/79/97/386177997.db2.gz DEVKALDUUUEWMJ-UHFFFAOYSA-N 1 2 235.327 2.244 20 0 BEADLO CCc1cccc(C[N@@H+](CC)CC(=O)OC)c1 ZINC000346233991 386177998 /nfs/dbraw/zinc/17/79/98/386177998.db2.gz DEVKALDUUUEWMJ-UHFFFAOYSA-N 1 2 235.327 2.244 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N[C@H]1CC12CCCCC2 ZINC000288247239 386178188 /nfs/dbraw/zinc/17/81/88/386178188.db2.gz BIQCEVNQCNLWOU-NSHDSACASA-N 1 2 247.342 2.181 20 0 BEADLO C[C@H]1CN(c2nc[nH+]c(N)c2Cl)CC[C@@H]1C ZINC000235635642 386180467 /nfs/dbraw/zinc/18/04/67/386180467.db2.gz NXZCTWWDEYLYOR-YUMQZZPRSA-N 1 2 240.738 2.195 20 0 BEADLO C[C@H]1CN(c2[nH+]cnc(N)c2Cl)CC[C@@H]1C ZINC000235635642 386180474 /nfs/dbraw/zinc/18/04/74/386180474.db2.gz NXZCTWWDEYLYOR-YUMQZZPRSA-N 1 2 240.738 2.195 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2cncc(F)c2)CCO1 ZINC000275174979 386188205 /nfs/dbraw/zinc/18/82/05/386188205.db2.gz YSEYMCJAOKTTOG-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2cncc(F)c2)CCO1 ZINC000275174979 386188208 /nfs/dbraw/zinc/18/82/08/386188208.db2.gz YSEYMCJAOKTTOG-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@@H]2CCC(F)(F)C2)no1 ZINC000340280011 386188376 /nfs/dbraw/zinc/18/83/76/386188376.db2.gz SKSNRSVRMBOMJJ-SECBINFHSA-N 1 2 245.273 2.245 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@@H]2CCC(F)(F)C2)no1 ZINC000340280011 386188382 /nfs/dbraw/zinc/18/83/82/386188382.db2.gz SKSNRSVRMBOMJJ-SECBINFHSA-N 1 2 245.273 2.245 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@@H](C)c1cncc(C)c1 ZINC000274606337 386125651 /nfs/dbraw/zinc/12/56/51/386125651.db2.gz MLOMATXEIAIALO-JTQLQIEISA-N 1 2 230.315 2.272 20 0 BEADLO CO[C@@H](C)CNc1cc(C)[nH+]c(C2CC2)n1 ZINC000189926850 386129975 /nfs/dbraw/zinc/12/99/75/386129975.db2.gz WEPCPVYWCLTUMK-VIFPVBQESA-N 1 2 221.304 2.109 20 0 BEADLO C[C@@H](F)CC[NH+]=c1[nH]c2ccc(F)cc2n1C ZINC000338759520 386132881 /nfs/dbraw/zinc/13/28/81/386132881.db2.gz ZBGSLKAEMRNDQR-MRVPVSSYSA-N 1 2 239.269 2.294 20 0 BEADLO Cc1cnc(C[N@@H+]2CCO[C@@H](C(C)C)C2)s1 ZINC000334464957 386137429 /nfs/dbraw/zinc/13/74/29/386137429.db2.gz CAVQRVJEWJCTJP-LLVKDONJSA-N 1 2 240.372 2.308 20 0 BEADLO Cc1cnc(C[N@H+]2CCO[C@@H](C(C)C)C2)s1 ZINC000334464957 386137433 /nfs/dbraw/zinc/13/74/33/386137433.db2.gz CAVQRVJEWJCTJP-LLVKDONJSA-N 1 2 240.372 2.308 20 0 BEADLO CC1=CC[N@H+](Cc2nnc(C3CCC3)n2C)CC1 ZINC000334470806 386143549 /nfs/dbraw/zinc/14/35/49/386143549.db2.gz GEUXMNPKSMDFHE-UHFFFAOYSA-N 1 2 246.358 2.235 20 0 BEADLO CC1=CC[N@@H+](Cc2nnc(C3CCC3)n2C)CC1 ZINC000334470806 386143553 /nfs/dbraw/zinc/14/35/53/386143553.db2.gz GEUXMNPKSMDFHE-UHFFFAOYSA-N 1 2 246.358 2.235 20 0 BEADLO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1ncc[nH]1 ZINC000288470329 386203136 /nfs/dbraw/zinc/20/31/36/386203136.db2.gz FRYXJBYILFTCNU-RNCFNFMXSA-N 1 2 229.283 2.022 20 0 BEADLO C[C@@H](C1CC1)N(C)C(=O)c1ccc2[nH+]ccn2c1 ZINC000264023604 386205075 /nfs/dbraw/zinc/20/50/75/386205075.db2.gz SETYHFGMBDXTNM-JTQLQIEISA-N 1 2 243.310 2.205 20 0 BEADLO C[C@H]1CC(C)(C)CC[C@@H]1[NH2+]Cc1c[nH]nn1 ZINC000334622626 386206321 /nfs/dbraw/zinc/20/63/21/386206321.db2.gz BVNDQCIDFHXBLS-ONGXEEELSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@H]1CC(C)(C)CC[C@@H]1[NH2+]Cc1cn[nH]n1 ZINC000334622626 386206326 /nfs/dbraw/zinc/20/63/26/386206326.db2.gz BVNDQCIDFHXBLS-ONGXEEELSA-N 1 2 222.336 2.109 20 0 BEADLO CC(C)c1nc(N[C@@H](C)[C@H]2CCCOC2)cc[nH+]1 ZINC000355572114 386212235 /nfs/dbraw/zinc/21/22/35/386212235.db2.gz ZRAVWRYVKTZINL-RYUDHWBXSA-N 1 2 249.358 2.249 20 0 BEADLO CC(=O)Nc1cccc([C@@H](C)[NH+]2CCOCC2)c1 ZINC000264152058 386212418 /nfs/dbraw/zinc/21/24/18/386212418.db2.gz AKFVICKKBMXEGI-LLVKDONJSA-N 1 2 248.326 2.038 20 0 BEADLO CC(C)=CC(=O)NCCCCNc1cccc[nH+]1 ZINC000264164202 386212603 /nfs/dbraw/zinc/21/26/03/386212603.db2.gz KTTMSLACTQGMIU-UHFFFAOYSA-N 1 2 247.342 2.356 20 0 BEADLO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1cocn1 ZINC000288555646 386213886 /nfs/dbraw/zinc/21/38/86/386213886.db2.gz LXTQSENDIJMBEL-ZANVPECISA-N 1 2 230.267 2.286 20 0 BEADLO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1cocn1 ZINC000288555643 386214321 /nfs/dbraw/zinc/21/43/21/386214321.db2.gz LXTQSENDIJMBEL-TVQRCGJNSA-N 1 2 230.267 2.286 20 0 BEADLO C[C@@H](NCc1cccc2[nH+]ccn21)C(F)(F)F ZINC000288560988 386215876 /nfs/dbraw/zinc/21/58/76/386215876.db2.gz YPIAOMHAULRHGM-MRVPVSSYSA-N 1 2 243.232 2.375 20 0 BEADLO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1nccn1C ZINC000288625738 386222471 /nfs/dbraw/zinc/22/24/71/386222471.db2.gz SEJQCGMLZCYDGI-HZMBPMFUSA-N 1 2 243.310 2.032 20 0 BEADLO Cc1cnc([C@H](C)[NH2+]Cc2cc[nH]n2)s1 ZINC000125176468 386231865 /nfs/dbraw/zinc/23/18/65/386231865.db2.gz ONXCGEPTKAJWIY-QMMMGPOBSA-N 1 2 222.317 2.025 20 0 BEADLO FC(F)(F)[C@@H](N[C@@H]1CCn2cc[nH+]c21)C1CC1 ZINC000297239831 386235759 /nfs/dbraw/zinc/23/57/59/386235759.db2.gz ILVWAKZIRCCXTL-BDAKNGLRSA-N 1 2 245.248 2.258 20 0 BEADLO COCc1cc(CNc2c[nH+]ccc2C)no1 ZINC000297305681 386240254 /nfs/dbraw/zinc/24/02/54/386240254.db2.gz BIMOLMCONCGPCU-UHFFFAOYSA-N 1 2 233.271 2.137 20 0 BEADLO Cc1occc1C[N@@H+](C)Cc1ccc(C)nn1 ZINC000414387215 386241434 /nfs/dbraw/zinc/24/14/34/386241434.db2.gz YTGAGSQSFVJARA-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1occc1C[N@H+](C)Cc1ccc(C)nn1 ZINC000414387215 386241440 /nfs/dbraw/zinc/24/14/40/386241440.db2.gz YTGAGSQSFVJARA-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CO[C@H]1CN(c2[nH]c3ccccc3[nH+]2)CC[C@@H]1C ZINC000275821662 386242869 /nfs/dbraw/zinc/24/28/69/386242869.db2.gz FQHSEYQLLYGBHF-GWCFXTLKSA-N 1 2 245.326 2.424 20 0 BEADLO c1nnc([C@H]([NH2+]CC2CCC2)c2ccccc2)[nH]1 ZINC000275822889 386244693 /nfs/dbraw/zinc/24/46/93/386244693.db2.gz KFXXXYFVCPHOQZ-CYBMUJFWSA-N 1 2 242.326 2.284 20 0 BEADLO C/C=C(\C=C\C(=O)NCc1[nH+]ccn1CC)CC ZINC000297317312 386245102 /nfs/dbraw/zinc/24/51/02/386245102.db2.gz VWJIMDLHIFLLHY-JVKQVXOYSA-N 1 2 247.342 2.432 20 0 BEADLO CC[C@@H](C)C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000125339580 386246491 /nfs/dbraw/zinc/24/64/91/386246491.db2.gz QXMLJJMLUYPPRE-RKDXNWHRSA-N 1 2 209.293 2.023 20 0 BEADLO CC(C)=CC[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000275901393 386248429 /nfs/dbraw/zinc/24/84/29/386248429.db2.gz VDNKPGIEXAKNLU-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO CC[C@H](NC(=O)Cc1[nH]c[nH+]c1C)[C@@H]1CC1(C)C ZINC000416279625 386256559 /nfs/dbraw/zinc/25/65/59/386256559.db2.gz URMHCOLBUNGUTA-QWRGUYRKSA-N 1 2 249.358 2.202 20 0 BEADLO CC[C@H](NC(=O)Cc1[nH+]c[nH]c1C)[C@@H]1CC1(C)C ZINC000416279625 386256563 /nfs/dbraw/zinc/25/65/63/386256563.db2.gz URMHCOLBUNGUTA-QWRGUYRKSA-N 1 2 249.358 2.202 20 0 BEADLO C[C@@H]1[C@@H](C)[C@H](C)CN1C(=O)C(C)(C)c1c[nH+]c[nH]1 ZINC000416325341 386257988 /nfs/dbraw/zinc/25/79/88/386257988.db2.gz SNAXPRCHLSLOJR-OUAUKWLOSA-N 1 2 249.358 2.190 20 0 BEADLO COC1(CC[N@H+](C)CC(F)F)CCC1 ZINC000338964747 386192443 /nfs/dbraw/zinc/19/24/43/386192443.db2.gz SRRCUMDMIRGGCT-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO COC1(CC[N@@H+](C)CC(F)F)CCC1 ZINC000338964747 386192447 /nfs/dbraw/zinc/19/24/47/386192447.db2.gz SRRCUMDMIRGGCT-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@H]2CC[C@@H](C)O2)cs1 ZINC000336667646 386296573 /nfs/dbraw/zinc/29/65/73/386296573.db2.gz MPCMMISPRXNHOX-BXKDBHETSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@H]2CC[C@@H](C)O2)cs1 ZINC000336667646 386296579 /nfs/dbraw/zinc/29/65/79/386296579.db2.gz MPCMMISPRXNHOX-BXKDBHETSA-N 1 2 240.372 2.451 20 0 BEADLO CCn1c[nH+]cc1CNc1ccc(OC)nc1C ZINC000416425835 386300121 /nfs/dbraw/zinc/30/01/21/386300121.db2.gz JVLYLSXWFUCGQJ-UHFFFAOYSA-N 1 2 246.314 2.227 20 0 BEADLO Cc1cc(C)nc(NCCNc2cccc[nH+]2)n1 ZINC000298156027 386302759 /nfs/dbraw/zinc/30/27/59/386302759.db2.gz MAAMWMPTFPOTPT-UHFFFAOYSA-N 1 2 243.314 2.012 20 0 BEADLO C[C@H](Nc1cccc[nH+]1)C(=O)N1CCCC[C@@H]1C ZINC000265105756 386308037 /nfs/dbraw/zinc/30/80/37/386308037.db2.gz GIWSXGNRZJJXFR-RYUDHWBXSA-N 1 2 247.342 2.283 20 0 BEADLO Cc1nonc1C[N@@H+](C)[C@H](C)c1cccc(O)c1 ZINC000265132401 386309730 /nfs/dbraw/zinc/30/97/30/386309730.db2.gz NMSIDPXTVUVBDA-SNVBAGLBSA-N 1 2 247.298 2.277 20 0 BEADLO Cc1nonc1C[N@H+](C)[C@H](C)c1cccc(O)c1 ZINC000265132401 386309736 /nfs/dbraw/zinc/30/97/36/386309736.db2.gz NMSIDPXTVUVBDA-SNVBAGLBSA-N 1 2 247.298 2.277 20 0 BEADLO CC[N@H+](C)[C@H](c1nc(C)no1)c1ccccc1 ZINC000276366435 386311517 /nfs/dbraw/zinc/31/15/17/386311517.db2.gz NFLGYZKFMSXDOO-LBPRGKRZSA-N 1 2 231.299 2.419 20 0 BEADLO CC[N@@H+](C)[C@H](c1nc(C)no1)c1ccccc1 ZINC000276366435 386311520 /nfs/dbraw/zinc/31/15/20/386311520.db2.gz NFLGYZKFMSXDOO-LBPRGKRZSA-N 1 2 231.299 2.419 20 0 BEADLO C[C@@H](C(=O)NCCCn1cc[nH+]c1)C(C)(C)C ZINC000265192334 386316556 /nfs/dbraw/zinc/31/65/56/386316556.db2.gz AZWFVQIXUMPIPY-NSHDSACASA-N 1 2 237.347 2.072 20 0 BEADLO CSCCC[N@H+](C)Cc1noc(C(C)C)n1 ZINC000336670727 386316619 /nfs/dbraw/zinc/31/66/19/386316619.db2.gz ZGHOJWHLBQJGAK-UHFFFAOYSA-N 1 2 243.376 2.378 20 0 BEADLO CSCCC[N@@H+](C)Cc1noc(C(C)C)n1 ZINC000336670727 386316623 /nfs/dbraw/zinc/31/66/23/386316623.db2.gz ZGHOJWHLBQJGAK-UHFFFAOYSA-N 1 2 243.376 2.378 20 0 BEADLO Cc1nocc1C[NH2+][C@@H]1CCN(C2CCCC2)C1 ZINC000339244033 386317220 /nfs/dbraw/zinc/31/72/20/386317220.db2.gz UOYHSXYCIDIFCW-CYBMUJFWSA-N 1 2 249.358 2.090 20 0 BEADLO COC(=O)[C@@H]([NH2+]Cc1cccc(C)c1C)C1CC1 ZINC000276407089 386317558 /nfs/dbraw/zinc/31/75/58/386317558.db2.gz DXJWOKOAGVVYAO-AWEZNQCLSA-N 1 2 247.338 2.345 20 0 BEADLO Cc1cnccc1C[N@@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000336212806 386320266 /nfs/dbraw/zinc/32/02/66/386320266.db2.gz OKIKQUWDEGIWGD-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cnccc1C[N@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000336212806 386320269 /nfs/dbraw/zinc/32/02/69/386320269.db2.gz OKIKQUWDEGIWGD-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO CO[C@H](C)CNc1nc(C)[nH+]c2c1CCCC2 ZINC000276038087 386265664 /nfs/dbraw/zinc/26/56/64/386265664.db2.gz MXWQAGGQYAIKQO-SECBINFHSA-N 1 2 235.331 2.111 20 0 BEADLO Cc1noc([C@H]2CCC[N@@H+]2Cc2ccco2)n1 ZINC000289140254 386266023 /nfs/dbraw/zinc/26/60/23/386266023.db2.gz AGJMXADHKKPKMO-LLVKDONJSA-N 1 2 233.271 2.308 20 0 BEADLO Cc1noc([C@H]2CCC[N@H+]2Cc2ccco2)n1 ZINC000289140254 386266030 /nfs/dbraw/zinc/26/60/30/386266030.db2.gz AGJMXADHKKPKMO-LLVKDONJSA-N 1 2 233.271 2.308 20 0 BEADLO CCOc1nnc(C[N@H+](CC)C(C)C)s1 ZINC000336652019 386266279 /nfs/dbraw/zinc/26/62/79/386266279.db2.gz VZDRQIWKJCMBIL-UHFFFAOYSA-N 1 2 229.349 2.167 20 0 BEADLO CCOc1nnc(C[N@@H+](CC)C(C)C)s1 ZINC000336652019 386266283 /nfs/dbraw/zinc/26/62/83/386266283.db2.gz VZDRQIWKJCMBIL-UHFFFAOYSA-N 1 2 229.349 2.167 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC000289142005 386266500 /nfs/dbraw/zinc/26/65/00/386266500.db2.gz AKABPOALYDZJAQ-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000289142005 386266506 /nfs/dbraw/zinc/26/65/06/386266506.db2.gz AKABPOALYDZJAQ-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1[nH]c(C(=O)NCC2CCCCC2)c[nH+]1 ZINC000264793936 386271491 /nfs/dbraw/zinc/27/14/91/386271491.db2.gz XYDPVVAFPINYGM-UHFFFAOYSA-N 1 2 221.304 2.028 20 0 BEADLO Cc1ccc2oc(N3CCCC[NH2+]3)nc2c1 ZINC000289198696 386271890 /nfs/dbraw/zinc/27/18/90/386271890.db2.gz ULWDPYPRNUOVCQ-UHFFFAOYSA-N 1 2 217.272 2.241 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CCC[C@H]1CF ZINC000297687041 386272484 /nfs/dbraw/zinc/27/24/84/386272484.db2.gz HFDSRCNYAKYJMB-JTQLQIEISA-N 1 2 237.278 2.356 20 0 BEADLO Cc1cnc(C[N@H+](C)CCC(F)(F)F)cn1 ZINC000336659645 386276389 /nfs/dbraw/zinc/27/63/89/386276389.db2.gz AEVKVXYFSNXCLN-UHFFFAOYSA-N 1 2 233.237 2.169 20 0 BEADLO Cc1cnc(C[N@@H+](C)CCC(F)(F)F)cn1 ZINC000336659645 386276394 /nfs/dbraw/zinc/27/63/94/386276394.db2.gz AEVKVXYFSNXCLN-UHFFFAOYSA-N 1 2 233.237 2.169 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H]2CCC[C@@H](C)C2)c[nH+]1 ZINC000264849987 386276512 /nfs/dbraw/zinc/27/65/12/386276512.db2.gz MUEHZHKNGZQJHN-SCZZXKLOSA-N 1 2 221.304 2.027 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccco2)C[C@H](C)[S@]1=O ZINC000289254320 386277678 /nfs/dbraw/zinc/27/76/78/386277678.db2.gz FHNYPQURCVIEKR-KANYHAFZSA-N 1 2 241.356 2.011 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccco2)C[C@H](C)[S@]1=O ZINC000289254320 386277683 /nfs/dbraw/zinc/27/76/83/386277683.db2.gz FHNYPQURCVIEKR-KANYHAFZSA-N 1 2 241.356 2.011 20 0 BEADLO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ncnn2C)o1 ZINC000276535118 386341728 /nfs/dbraw/zinc/34/17/28/386341728.db2.gz DABDLHLDDAXBGK-UWVGGRQHSA-N 1 2 234.303 2.128 20 0 BEADLO FC(F)C[C@@H]1COCC[N@@H+]1Cc1ccco1 ZINC000289691706 386343288 /nfs/dbraw/zinc/34/32/88/386343288.db2.gz OGXPKCOWOGEISW-SECBINFHSA-N 1 2 231.242 2.136 20 0 BEADLO FC(F)C[C@@H]1COCC[N@H+]1Cc1ccco1 ZINC000289691706 386343295 /nfs/dbraw/zinc/34/32/95/386343295.db2.gz OGXPKCOWOGEISW-SECBINFHSA-N 1 2 231.242 2.136 20 0 BEADLO CC[C@@H](C)CC(=O)NC[C@H](C)Cn1cc[nH+]c1 ZINC000276563415 386344713 /nfs/dbraw/zinc/34/47/13/386344713.db2.gz AEAFHZIRTZPGBB-NEPJUHHUSA-N 1 2 237.347 2.072 20 0 BEADLO CC[C@@H](C)CC(=O)NCc1ccc(N(C)C)[nH+]c1 ZINC000276578180 386346497 /nfs/dbraw/zinc/34/64/97/386346497.db2.gz MVDBNGAXLVEKQQ-LLVKDONJSA-N 1 2 249.358 2.200 20 0 BEADLO CCCCCCC(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000298497757 386351435 /nfs/dbraw/zinc/35/14/35/386351435.db2.gz YEGCCUXXRBPMSF-GFCCVEGCSA-N 1 2 237.347 2.358 20 0 BEADLO CC(C)=CCn1c2ccccc2[nH+]c1NCCO ZINC000298502776 386354141 /nfs/dbraw/zinc/35/41/41/386354141.db2.gz JPZVBBXDNOBQQN-UHFFFAOYSA-N 1 2 245.326 2.407 20 0 BEADLO Cn1ncc(C[N@@H+]2CCC[C@H]2c2ccsc2)n1 ZINC000289778782 386354633 /nfs/dbraw/zinc/35/46/33/386354633.db2.gz KUWPXGSNUKVIOZ-LBPRGKRZSA-N 1 2 248.355 2.214 20 0 BEADLO Cn1ncc(C[N@H+]2CCC[C@H]2c2ccsc2)n1 ZINC000289778782 386354638 /nfs/dbraw/zinc/35/46/38/386354638.db2.gz KUWPXGSNUKVIOZ-LBPRGKRZSA-N 1 2 248.355 2.214 20 0 BEADLO CC(C)[C@H](NC(=O)CC1CCC1)c1[nH]cc[nH+]1 ZINC000276659795 386360672 /nfs/dbraw/zinc/36/06/72/386360672.db2.gz MKJWDWMHFPOEHR-LBPRGKRZSA-N 1 2 235.331 2.413 20 0 BEADLO C[C@@H]([NH2+][C@H](c1nnc[nH]1)c1ccccc1)C1CC1 ZINC000276702619 386366145 /nfs/dbraw/zinc/36/61/45/386366145.db2.gz BPJTYKBPZILBKZ-MFKMUULPSA-N 1 2 242.326 2.282 20 0 BEADLO CC(C)[C@@H](NC(=O)[C@@H]1CC1(C)C)c1[nH]cc[nH+]1 ZINC000276716382 386367220 /nfs/dbraw/zinc/36/72/20/386367220.db2.gz RRDAKJFACNPOLJ-VHSXEESVSA-N 1 2 235.331 2.269 20 0 BEADLO COC(=O)c1ccc(C[N@@H+]2CC[C@](C)(F)C2)o1 ZINC000347366710 386367460 /nfs/dbraw/zinc/36/74/60/386367460.db2.gz HUMBYERJLURKDJ-LBPRGKRZSA-N 1 2 241.262 2.000 20 0 BEADLO COC(=O)c1ccc(C[N@H+]2CC[C@](C)(F)C2)o1 ZINC000347366710 386367467 /nfs/dbraw/zinc/36/74/67/386367467.db2.gz HUMBYERJLURKDJ-LBPRGKRZSA-N 1 2 241.262 2.000 20 0 BEADLO Cc1noc([C@H]2CCC[N@H+]2Cc2ccn(C)c2)n1 ZINC000289875136 386369314 /nfs/dbraw/zinc/36/93/14/386369314.db2.gz RQPXQFIQMQKNEO-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1noc([C@H]2CCC[N@@H+]2Cc2ccn(C)c2)n1 ZINC000289875136 386369318 /nfs/dbraw/zinc/36/93/18/386369318.db2.gz RQPXQFIQMQKNEO-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO CC(C)CCC(=O)NC[C@@H](C)Cn1cc[nH+]c1 ZINC000265820779 386375034 /nfs/dbraw/zinc/37/50/34/386375034.db2.gz OIBKXNZVWXFNSG-GFCCVEGCSA-N 1 2 237.347 2.072 20 0 BEADLO CC(C)=CCNC(=O)Nc1cc[nH+]c(C)c1 ZINC000276788945 386375138 /nfs/dbraw/zinc/37/51/38/386375138.db2.gz KNCSNAXDAHADPQ-UHFFFAOYSA-N 1 2 219.288 2.478 20 0 BEADLO C[C@H](CNC(=O)C1(C)CCCC1)Cn1cc[nH+]c1 ZINC000265822256 386376193 /nfs/dbraw/zinc/37/61/93/386376193.db2.gz OQQKELWVZKJRKV-GFCCVEGCSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@H](CNC(=O)CC(C)(C)C)Cn1cc[nH+]c1 ZINC000265863806 386378900 /nfs/dbraw/zinc/37/89/00/386378900.db2.gz XFGYMAWQHOISEW-LLVKDONJSA-N 1 2 237.347 2.072 20 0 BEADLO CCC(CC)NC(=O)[C@@H](C)[N@@H+]1CC[C@@](C)(F)C1 ZINC000347392798 386380147 /nfs/dbraw/zinc/38/01/47/386380147.db2.gz UUHHNLKCTGZUGK-ZWNOBZJWSA-N 1 2 244.354 2.114 20 0 BEADLO CCC(CC)NC(=O)[C@@H](C)[N@H+]1CC[C@@](C)(F)C1 ZINC000347392798 386380149 /nfs/dbraw/zinc/38/01/49/386380149.db2.gz UUHHNLKCTGZUGK-ZWNOBZJWSA-N 1 2 244.354 2.114 20 0 BEADLO CC(C)=CCNC(=O)Nc1cc[nH+]cc1C ZINC000276824704 386380768 /nfs/dbraw/zinc/38/07/68/386380768.db2.gz PSXYKXYKJMUIAD-UHFFFAOYSA-N 1 2 219.288 2.478 20 0 BEADLO C[N@H+](CC[C@H]1CCCCO1)CC(F)F ZINC000347393915 386382799 /nfs/dbraw/zinc/38/27/99/386382799.db2.gz AUZLIKSDOYHTMJ-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO C[N@@H+](CC[C@H]1CCCCO1)CC(F)F ZINC000347393915 386382802 /nfs/dbraw/zinc/38/28/02/386382802.db2.gz AUZLIKSDOYHTMJ-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO C[C@H](C1CC1)n1nccc1NCc1c[nH+]cn1C ZINC000237484171 386383690 /nfs/dbraw/zinc/38/36/90/386383690.db2.gz DWDAJJLLQQUTNX-SNVBAGLBSA-N 1 2 245.330 2.200 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)C1CCCCCCC1 ZINC000265936451 386384958 /nfs/dbraw/zinc/38/49/58/386384958.db2.gz HJYHGWDELVKHLL-UHFFFAOYSA-N 1 2 249.358 2.397 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)NCCC1=CCCCC1 ZINC000276470299 386329349 /nfs/dbraw/zinc/32/93/49/386329349.db2.gz CREFACOPAAZKBF-VOTSOKGWSA-N 1 2 245.326 2.430 20 0 BEADLO C/C=C(\CC)C(=O)NCc1ccc(N(C)C)[nH+]c1 ZINC000276525534 386339281 /nfs/dbraw/zinc/33/92/81/386339281.db2.gz IRXNELCYJJPWBT-LFYBBSHMSA-N 1 2 247.342 2.120 20 0 BEADLO CCN(C(=O)CCc1c[nH+]cn1C)C1CCCC1 ZINC000276513203 386339316 /nfs/dbraw/zinc/33/93/16/386339316.db2.gz BMWIEVMESALEGZ-UHFFFAOYSA-N 1 2 249.358 2.144 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CCn2cccc2[C@@H]1C ZINC000290438914 386437086 /nfs/dbraw/zinc/43/70/86/386437086.db2.gz NQOWGKQZUZVBCT-NSHDSACASA-N 1 2 230.315 2.096 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CCn2cccc2[C@@H]1C ZINC000290438914 386437092 /nfs/dbraw/zinc/43/70/92/386437092.db2.gz NQOWGKQZUZVBCT-NSHDSACASA-N 1 2 230.315 2.096 20 0 BEADLO COC(=O)[C@@H](C)[NH2+]C[C@@H](C)c1ccc(F)cc1 ZINC000266502809 386442111 /nfs/dbraw/zinc/44/21/11/386442111.db2.gz VVPNQQWOXPHYHZ-NXEZZACHSA-N 1 2 239.290 2.080 20 0 BEADLO COC(=O)[C@H](C)[NH2+]C[C@@H](C)c1ccc(F)cc1 ZINC000266502818 386442253 /nfs/dbraw/zinc/44/22/53/386442253.db2.gz VVPNQQWOXPHYHZ-ZJUUUORDSA-N 1 2 239.290 2.080 20 0 BEADLO Cc1cnc(C[N@@H+](C)[C@@H](CO)c2ccccc2)o1 ZINC000266547875 386448610 /nfs/dbraw/zinc/44/86/10/386448610.db2.gz SLUSWHJLACTIGT-ZDUSSCGKSA-N 1 2 246.310 2.148 20 0 BEADLO Cc1cnc(C[N@H+](C)[C@@H](CO)c2ccccc2)o1 ZINC000266547875 386448614 /nfs/dbraw/zinc/44/86/14/386448614.db2.gz SLUSWHJLACTIGT-ZDUSSCGKSA-N 1 2 246.310 2.148 20 0 BEADLO Cc1cnc(C[N@@H+](C)[C@H](CO)c2ccccc2)o1 ZINC000266547873 386449463 /nfs/dbraw/zinc/44/94/63/386449463.db2.gz SLUSWHJLACTIGT-CYBMUJFWSA-N 1 2 246.310 2.148 20 0 BEADLO Cc1cnc(C[N@H+](C)[C@H](CO)c2ccccc2)o1 ZINC000266547873 386449468 /nfs/dbraw/zinc/44/94/68/386449468.db2.gz SLUSWHJLACTIGT-CYBMUJFWSA-N 1 2 246.310 2.148 20 0 BEADLO Cc1cc(N2CC[C@@H](C(C)(C)C)[C@H](O)C2)nc[nH+]1 ZINC000347424508 386397369 /nfs/dbraw/zinc/39/73/69/386397369.db2.gz TUHOPKVMJXYMNT-VXGBXAGGSA-N 1 2 249.358 2.018 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CCC[C@@H](C)CC2)c[nH+]1 ZINC000276969495 386397601 /nfs/dbraw/zinc/39/76/01/386397601.db2.gz TWIQVTHFKKCTNH-MWLCHTKSSA-N 1 2 235.331 2.417 20 0 BEADLO Cn1cc[nH+]c1CNc1nccc(C(C)(C)C)n1 ZINC000292737541 386452997 /nfs/dbraw/zinc/45/29/97/386452997.db2.gz JGHNLSKXLQTOPO-UHFFFAOYSA-N 1 2 245.330 2.120 20 0 BEADLO CC1(C)CCCN(C(=O)CCn2cc[nH+]c2)CC1 ZINC000266107585 386398993 /nfs/dbraw/zinc/39/89/93/386398993.db2.gz VAOGLCXWWMKTEH-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO O=C(CCn1cc[nH+]c1)N1CCC[C@@H]2CCC[C@H]21 ZINC000266121153 386400281 /nfs/dbraw/zinc/40/02/81/386400281.db2.gz UJZZJSZOPVECJQ-QWHCGFSZSA-N 1 2 247.342 2.064 20 0 BEADLO CCCc1nc(C[NH+]2C[C@@H](C)[C@H](C)C2)no1 ZINC000336701934 386405546 /nfs/dbraw/zinc/40/55/46/386405546.db2.gz MIWQAIYFSQZFHA-NXEZZACHSA-N 1 2 223.320 2.110 20 0 BEADLO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1csnn1 ZINC000290200843 386406130 /nfs/dbraw/zinc/40/61/30/386406130.db2.gz PPCBFLVAZZKXSM-PELKAZGASA-N 1 2 247.323 2.150 20 0 BEADLO Cc1ccnc(C[N@@H+](C)[C@H](C)c2cccnc2)n1 ZINC000336706549 386411381 /nfs/dbraw/zinc/41/13/81/386411381.db2.gz KAHOKSCVWVRZMB-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1ccnc(C[N@H+](C)[C@H](C)c2cccnc2)n1 ZINC000336706549 386411390 /nfs/dbraw/zinc/41/13/90/386411390.db2.gz KAHOKSCVWVRZMB-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cc(C[N@@H+](C)CCC(=O)C(C)C)no1 ZINC000290277588 386417133 /nfs/dbraw/zinc/41/71/33/386417133.db2.gz LZCKNYAYWMRYEX-UHFFFAOYSA-N 1 2 224.304 2.030 20 0 BEADLO Cc1cc(C[N@H+](C)CCC(=O)C(C)C)no1 ZINC000290277588 386417139 /nfs/dbraw/zinc/41/71/39/386417139.db2.gz LZCKNYAYWMRYEX-UHFFFAOYSA-N 1 2 224.304 2.030 20 0 BEADLO CCC=CC[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000453323913 386417159 /nfs/dbraw/zinc/41/71/59/386417159.db2.gz QHOXJJDUXOWBPZ-RBWDJNPFSA-N 1 2 242.326 2.450 20 0 BEADLO O=C(CC1CCC1)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000266262403 386418492 /nfs/dbraw/zinc/41/84/92/386418492.db2.gz DZJYUYIBBKHNHY-UHFFFAOYSA-N 1 2 247.342 2.306 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2[nH]ncc2C)cc1 ZINC000290321593 386418657 /nfs/dbraw/zinc/41/86/57/386418657.db2.gz BRXPBZBHACZFHY-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2[nH]ncc2C)cc1 ZINC000290321593 386418666 /nfs/dbraw/zinc/41/86/66/386418666.db2.gz BRXPBZBHACZFHY-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2n[nH]cc2C)cc1 ZINC000290321593 386418673 /nfs/dbraw/zinc/41/86/73/386418673.db2.gz BRXPBZBHACZFHY-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2n[nH]cc2C)cc1 ZINC000290321593 386418678 /nfs/dbraw/zinc/41/86/78/386418678.db2.gz BRXPBZBHACZFHY-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO Cc1ccoc1C[N@@H+](C)Cc1cc(C)n(C)n1 ZINC000336709440 386422959 /nfs/dbraw/zinc/42/29/59/386422959.db2.gz MQCBPPMWDNZCFR-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO Cc1ccoc1C[N@H+](C)Cc1cc(C)n(C)n1 ZINC000336709440 386422966 /nfs/dbraw/zinc/42/29/66/386422966.db2.gz MQCBPPMWDNZCFR-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO CCC[C@@H](C)CC(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000347491788 386423023 /nfs/dbraw/zinc/42/30/23/386423023.db2.gz GPEDOZFANZDHJD-SNVBAGLBSA-N 1 2 223.320 2.194 20 0 BEADLO CC[C@@H](CC(=O)N(C)Cc1[nH]cc[nH+]1)C(C)C ZINC000347515948 386427076 /nfs/dbraw/zinc/42/70/76/386427076.db2.gz KXDJXKGMRKACDJ-NSHDSACASA-N 1 2 237.347 2.440 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1C[C@H](C)[C@H](C)[C@@H]1C ZINC000416963167 386429459 /nfs/dbraw/zinc/42/94/59/386429459.db2.gz VHMIAVDEIXFKJL-SRVKXCTJSA-N 1 2 247.342 2.320 20 0 BEADLO Cc1cc(N[C@H]2CCS[C@H]2C)nc(C2CC2)[nH+]1 ZINC000645402080 386431113 /nfs/dbraw/zinc/43/11/13/386431113.db2.gz NPDOOGXEOWCPRS-ONGXEEELSA-N 1 2 249.383 2.390 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000290424511 386433555 /nfs/dbraw/zinc/43/35/55/386433555.db2.gz MNIMZGDPQJLBML-CYBMUJFWSA-N 1 2 230.315 2.383 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000290424511 386433560 /nfs/dbraw/zinc/43/35/60/386433560.db2.gz MNIMZGDPQJLBML-CYBMUJFWSA-N 1 2 230.315 2.383 20 0 BEADLO CC[C@H](CNc1cc[nH+]c2ccncc12)OC ZINC000290697714 386466704 /nfs/dbraw/zinc/46/67/04/386466704.db2.gz NCFKIGIQBZOCJA-SNVBAGLBSA-N 1 2 231.299 2.467 20 0 BEADLO CC[C@@H](C)C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000299573133 386467553 /nfs/dbraw/zinc/46/75/53/386467553.db2.gz UHBDEFNEEYQJLS-SNVBAGLBSA-N 1 2 235.331 2.162 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H]1CCC[C@H]1c1ccccc1 ZINC000277856330 386469265 /nfs/dbraw/zinc/46/92/65/386469265.db2.gz TXFCNABDHJUTLC-FPMFFAJLSA-N 1 2 247.338 2.474 20 0 BEADLO CN(CCC1CC1)c1cc(N2CCCC2)nc[nH+]1 ZINC000277828996 386469670 /nfs/dbraw/zinc/46/96/70/386469670.db2.gz PKKXLTSFZKUOAI-UHFFFAOYSA-N 1 2 246.358 2.313 20 0 BEADLO CN(CCC1CC1)c1cc(N2CCCC2)[nH+]cn1 ZINC000277828996 386469674 /nfs/dbraw/zinc/46/96/74/386469674.db2.gz PKKXLTSFZKUOAI-UHFFFAOYSA-N 1 2 246.358 2.313 20 0 BEADLO Cc1cc(N2C[C@H](O)CC[C@H]2C)nc(C(C)C)[nH+]1 ZINC000399268024 386473026 /nfs/dbraw/zinc/47/30/26/386473026.db2.gz SMRFCNWIWROLCO-VXGBXAGGSA-N 1 2 249.358 2.258 20 0 BEADLO CCO[C@H](C)c1noc(C[N@@H+]2C[C@@H](C)[C@@H]2C)n1 ZINC000339578650 386473710 /nfs/dbraw/zinc/47/37/10/386473710.db2.gz CLGXUAXPMUQEDI-KXUCPTDWSA-N 1 2 239.319 2.007 20 0 BEADLO CCO[C@H](C)c1noc(C[N@H+]2C[C@@H](C)[C@@H]2C)n1 ZINC000339578650 386473715 /nfs/dbraw/zinc/47/37/15/386473715.db2.gz CLGXUAXPMUQEDI-KXUCPTDWSA-N 1 2 239.319 2.007 20 0 BEADLO c1coc(SCCCn2cc[nH+]c2)n1 ZINC000277876446 386474093 /nfs/dbraw/zinc/47/40/93/386474093.db2.gz CDQBMMIVWSFUAY-UHFFFAOYSA-N 1 2 209.274 2.054 20 0 BEADLO C[C@@H](CC[NH2+][C@]1(C)CCOC1=O)c1ccccc1 ZINC000290779302 386475589 /nfs/dbraw/zinc/47/55/89/386475589.db2.gz CTTMCVBGAQZEPM-SWLSCSKDSA-N 1 2 247.338 2.475 20 0 BEADLO CC[C@H](C)[N@H+](CC(=O)OC)Cc1ccoc1C ZINC000414443081 386483733 /nfs/dbraw/zinc/48/37/33/386483733.db2.gz ICOZWWRDYFHBBH-JTQLQIEISA-N 1 2 239.315 2.362 20 0 BEADLO CC[C@H](C)[N@@H+](CC(=O)OC)Cc1ccoc1C ZINC000414443081 386483738 /nfs/dbraw/zinc/48/37/38/386483738.db2.gz ICOZWWRDYFHBBH-JTQLQIEISA-N 1 2 239.315 2.362 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)N1CCn2c[nH+]cc2C1 ZINC000290884329 386484131 /nfs/dbraw/zinc/48/41/31/386484131.db2.gz FARVLKDXNRUOAN-YRNVUSSQSA-N 1 2 247.342 2.218 20 0 BEADLO CCOC[C@@H]1CCN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000267045229 386489807 /nfs/dbraw/zinc/48/98/07/386489807.db2.gz DEORCORYHIDGKD-LLVKDONJSA-N 1 2 247.342 2.217 20 0 BEADLO C[C@@H]1Cc2ccccc2N1Cc1c[nH+]cn1C ZINC000267093077 386495032 /nfs/dbraw/zinc/49/50/32/386495032.db2.gz VFZVYLZWLCJDFQ-LLVKDONJSA-N 1 2 227.311 2.371 20 0 BEADLO COC(C)(C)CC(=O)Nc1cc[nH+]c(C)c1 ZINC000278283782 386508653 /nfs/dbraw/zinc/50/86/53/386508653.db2.gz BWBUKHUMVDHEPU-UHFFFAOYSA-N 1 2 222.288 2.144 20 0 BEADLO CCc1ccc(C[NH2+][C@H](C(=O)OC)C2CC2)cc1 ZINC000227769597 386514581 /nfs/dbraw/zinc/51/45/81/386514581.db2.gz PQSAVANCVQGJST-AWEZNQCLSA-N 1 2 247.338 2.290 20 0 BEADLO CCOc1ccc([NH2+]C2CCN(C=O)CC2)cc1 ZINC000278375116 386518494 /nfs/dbraw/zinc/51/84/94/386518494.db2.gz CMXDQNQROUGBCX-UHFFFAOYSA-N 1 2 248.326 2.118 20 0 BEADLO Cc1nc(Cl)ccc1NCc1[nH+]ccn1C ZINC000227937014 386524202 /nfs/dbraw/zinc/52/42/02/386524202.db2.gz HDQTUDSTKLYXGU-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO COC(=O)C[N@H+](Cc1ccccc1C)C1CC1 ZINC000299416466 386453157 /nfs/dbraw/zinc/45/31/57/386453157.db2.gz MHPXQQJAZIUYJU-UHFFFAOYSA-N 1 2 233.311 2.132 20 0 BEADLO COC(=O)C[N@@H+](Cc1ccccc1C)C1CC1 ZINC000299416466 386453168 /nfs/dbraw/zinc/45/31/68/386453168.db2.gz MHPXQQJAZIUYJU-UHFFFAOYSA-N 1 2 233.311 2.132 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)cn1 ZINC000414437800 386462285 /nfs/dbraw/zinc/46/22/85/386462285.db2.gz QJVZXYZTRBPVPO-SRVKXCTJSA-N 1 2 249.358 2.037 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)cn1 ZINC000414437800 386462291 /nfs/dbraw/zinc/46/22/91/386462291.db2.gz QJVZXYZTRBPVPO-SRVKXCTJSA-N 1 2 249.358 2.037 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)cn1 ZINC000414437799 386462642 /nfs/dbraw/zinc/46/26/42/386462642.db2.gz QJVZXYZTRBPVPO-SDDRHHMPSA-N 1 2 249.358 2.037 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)cn1 ZINC000414437799 386462648 /nfs/dbraw/zinc/46/26/48/386462648.db2.gz QJVZXYZTRBPVPO-SDDRHHMPSA-N 1 2 249.358 2.037 20 0 BEADLO Cc1nc(NCC(C)(C)C2=CCCC2)nc(N)[nH+]1 ZINC000312289820 386462647 /nfs/dbraw/zinc/46/26/47/386462647.db2.gz VMRXUYCEADRRPN-UHFFFAOYSA-N 1 2 247.346 2.311 20 0 BEADLO Cc1nc(N)nc(NCC(C)(C)C2=CCCC2)[nH+]1 ZINC000312289820 386462653 /nfs/dbraw/zinc/46/26/53/386462653.db2.gz VMRXUYCEADRRPN-UHFFFAOYSA-N 1 2 247.346 2.311 20 0 BEADLO CC1CCN(c2cc(N3CCCC3)[nH+]cn2)CC1 ZINC000244325834 386582521 /nfs/dbraw/zinc/58/25/21/386582521.db2.gz XLBCZDWNVDPPMA-UHFFFAOYSA-N 1 2 246.358 2.313 20 0 BEADLO CC1CCN(c2cc(N3CCCC3)nc[nH+]2)CC1 ZINC000244325834 386582523 /nfs/dbraw/zinc/58/25/23/386582523.db2.gz XLBCZDWNVDPPMA-UHFFFAOYSA-N 1 2 246.358 2.313 20 0 BEADLO CCc1ncc(C[NH2+][C@@H](CC)C(F)F)cn1 ZINC000414459746 386588920 /nfs/dbraw/zinc/58/89/20/386588920.db2.gz OUVCXYXUSXQVSG-VIFPVBQESA-N 1 2 229.274 2.172 20 0 BEADLO C[C@@H](CCc1ccccc1)[NH2+]CC(F)(F)CN ZINC000414922082 386589794 /nfs/dbraw/zinc/58/97/94/386589794.db2.gz BUWHRMHZHWJSGX-NSHDSACASA-N 1 2 242.313 2.191 20 0 BEADLO CCCCCC(=O)Nc1ccc(N)[nH+]c1 ZINC000061680383 386532191 /nfs/dbraw/zinc/53/21/91/386532191.db2.gz GEDHXCNHYYFRQY-UHFFFAOYSA-N 1 2 207.277 2.183 20 0 BEADLO CC(C)(C)CC(=O)Nc1ccc(N)[nH+]c1 ZINC000061680527 386532644 /nfs/dbraw/zinc/53/26/44/386532644.db2.gz OGLVDEBMBPPUQD-UHFFFAOYSA-N 1 2 207.277 2.039 20 0 BEADLO CC(C)CCC(=O)Nc1ccc(N)[nH+]c1 ZINC000061680560 386532765 /nfs/dbraw/zinc/53/27/65/386532765.db2.gz HHBNWKYUOSXEQW-UHFFFAOYSA-N 1 2 207.277 2.039 20 0 BEADLO Cc1noc(C(C)(C)[NH2+]Cc2ccoc2C)n1 ZINC000414451721 386534783 /nfs/dbraw/zinc/53/47/83/386534783.db2.gz OENGDVAYRZNVLK-UHFFFAOYSA-N 1 2 235.287 2.304 20 0 BEADLO C[C@H](CC(=O)NC1(C)CCCC1)n1cc[nH+]c1 ZINC000519710188 386539248 /nfs/dbraw/zinc/53/92/48/386539248.db2.gz VUASMTFIXOMUJY-LLVKDONJSA-N 1 2 235.331 2.283 20 0 BEADLO CN(c1cc(C(F)(F)F)cc[nH+]1)[C@H]1CCOC1 ZINC000267432406 386543260 /nfs/dbraw/zinc/54/32/60/386543260.db2.gz WXNKOGMLSMXJFN-VIFPVBQESA-N 1 2 246.232 2.326 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)[C@H](C)c1ccco1 ZINC000278563205 386550292 /nfs/dbraw/zinc/55/02/92/386550292.db2.gz IATBCINWBVHJQX-SNVBAGLBSA-N 1 2 247.298 2.073 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000291616453 386560199 /nfs/dbraw/zinc/56/01/99/386560199.db2.gz RJDNBDLXNOFAIP-CYBMUJFWSA-N 1 2 245.330 2.168 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000291616453 386560206 /nfs/dbraw/zinc/56/02/06/386560206.db2.gz RJDNBDLXNOFAIP-CYBMUJFWSA-N 1 2 245.330 2.168 20 0 BEADLO COC(C)(C)C(=O)Nc1ccc(C)[nH+]c1C ZINC000228308358 386560585 /nfs/dbraw/zinc/56/05/85/386560585.db2.gz YXPCQJDQFMHJML-UHFFFAOYSA-N 1 2 222.288 2.062 20 0 BEADLO Cc1nn(C(C)C)cc1C[N@@H+]1CC[C@H](F)C1 ZINC000335406102 386562488 /nfs/dbraw/zinc/56/24/88/386562488.db2.gz GONZDTALOIBDHZ-LBPRGKRZSA-N 1 2 225.311 2.316 20 0 BEADLO Cc1nn(C(C)C)cc1C[N@H+]1CC[C@H](F)C1 ZINC000335406102 386562490 /nfs/dbraw/zinc/56/24/90/386562490.db2.gz GONZDTALOIBDHZ-LBPRGKRZSA-N 1 2 225.311 2.316 20 0 BEADLO Cc1cc(NCC2CCC(F)(F)CC2)nc[nH+]1 ZINC000336989826 386565562 /nfs/dbraw/zinc/56/55/62/386565562.db2.gz JZYROWBSUZQPQK-UHFFFAOYSA-N 1 2 241.285 2.444 20 0 BEADLO CCc1ccc(CNc2ccc(CO)c[nH+]2)o1 ZINC000291682486 386568949 /nfs/dbraw/zinc/56/89/49/386568949.db2.gz XIWHLRIUNJXSBA-UHFFFAOYSA-N 1 2 232.283 2.341 20 0 BEADLO CCC[C@@H]1C[C@H]1NC(=O)c1ccc2[nH+]ccn2c1 ZINC000267650913 386569828 /nfs/dbraw/zinc/56/98/28/386569828.db2.gz LEANSEDTTWZHHD-ZYHUDNBSSA-N 1 2 243.310 2.253 20 0 BEADLO Cn1ccnc1C[N@@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000278703501 386569724 /nfs/dbraw/zinc/56/97/24/386569724.db2.gz JTHICPPYNRKYII-SECBINFHSA-N 1 2 247.264 2.194 20 0 BEADLO Cn1ccnc1C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000278703501 386569728 /nfs/dbraw/zinc/56/97/28/386569728.db2.gz JTHICPPYNRKYII-SECBINFHSA-N 1 2 247.264 2.194 20 0 BEADLO Cn1ccnc1C[N@@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000278703520 386571001 /nfs/dbraw/zinc/57/10/01/386571001.db2.gz JTHICPPYNRKYII-VIFPVBQESA-N 1 2 247.264 2.194 20 0 BEADLO Cn1ccnc1C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000278703520 386571004 /nfs/dbraw/zinc/57/10/04/386571004.db2.gz JTHICPPYNRKYII-VIFPVBQESA-N 1 2 247.264 2.194 20 0 BEADLO Cc1ccn2c(C[N@@H+]3CC[C@H](F)C3)cnc2c1 ZINC000335410519 386573841 /nfs/dbraw/zinc/57/38/41/386573841.db2.gz UTIDKZGRJPUAGG-NSHDSACASA-N 1 2 233.290 2.187 20 0 BEADLO Cc1ccn2c(C[N@H+]3CC[C@H](F)C3)cnc2c1 ZINC000335410519 386573847 /nfs/dbraw/zinc/57/38/47/386573847.db2.gz UTIDKZGRJPUAGG-NSHDSACASA-N 1 2 233.290 2.187 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CCC[C@@H](C2CC2)C1 ZINC000292130705 386622573 /nfs/dbraw/zinc/62/25/73/386622573.db2.gz RLRPIGLMXDOBLN-BTDICHCPSA-N 1 2 245.326 2.072 20 0 BEADLO c1nc(CC[N@@H+]2Cc3cccnc3C2)cs1 ZINC000644932842 386629767 /nfs/dbraw/zinc/62/97/67/386629767.db2.gz PYIZBZAEKACOLO-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1nc(CC[N@H+]2Cc3cccnc3C2)cs1 ZINC000644932842 386629770 /nfs/dbraw/zinc/62/97/70/386629770.db2.gz PYIZBZAEKACOLO-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO CCCC1(CNC(=O)CCn2cc[nH+]c2)CCC1 ZINC000268253582 386634006 /nfs/dbraw/zinc/63/40/06/386634006.db2.gz BGVGHZQBNCZFAK-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccco2)ncn1 ZINC000292201697 386634351 /nfs/dbraw/zinc/63/43/51/386634351.db2.gz OVIXECODCPMSES-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccco2)ncn1 ZINC000292201697 386634356 /nfs/dbraw/zinc/63/43/56/386634356.db2.gz OVIXECODCPMSES-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO CCN(C[C@@H](C)OC)c1cc[nH+]c(C2CC2)n1 ZINC000292238470 386637856 /nfs/dbraw/zinc/63/78/56/386637856.db2.gz GGDYHUYLICREEQ-SNVBAGLBSA-N 1 2 235.331 2.215 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C[C@H]1CC[C@H](C)C1 ZINC000268301473 386639349 /nfs/dbraw/zinc/63/93/49/386639349.db2.gz YFCXYLDKHORQSN-ONGXEEELSA-N 1 2 235.331 2.161 20 0 BEADLO O[C@H]1C[C@@H](Cn2c[nH+]c3cc(F)c(F)cc32)C1 ZINC000335509038 386643136 /nfs/dbraw/zinc/64/31/36/386643136.db2.gz GWKFWWPJVKUUGS-OCAPTIKFSA-N 1 2 238.237 2.085 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccc(C)o2)n(C)n1 ZINC000417748834 386647309 /nfs/dbraw/zinc/64/73/09/386647309.db2.gz UAJTYUKOOCVMNZ-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccc(C)o2)n(C)n1 ZINC000417748834 386647319 /nfs/dbraw/zinc/64/73/19/386647319.db2.gz UAJTYUKOOCVMNZ-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO CN(C(=O)[C@@H]1CCCc2[nH+]c[nH]c21)C(C)(C)C ZINC000335513618 386650262 /nfs/dbraw/zinc/65/02/62/386650262.db2.gz PHHFYOQMEQXLPT-SECBINFHSA-N 1 2 235.331 2.087 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)[C@@H]1CCCC[C@@H]1C ZINC000279237064 386653993 /nfs/dbraw/zinc/65/39/93/386653993.db2.gz PTBNOEVVXHCEKB-GXFFZTMASA-N 1 2 249.358 2.298 20 0 BEADLO CCN(CCOC)c1cc[nH+]c2ccncc21 ZINC000267992795 386608348 /nfs/dbraw/zinc/60/83/48/386608348.db2.gz RUGXCSOXCVAVJH-UHFFFAOYSA-N 1 2 231.299 2.103 20 0 BEADLO [NH3+]CC(F)(F)CN[C@@H]1CCCC[C@H]1C1CC1 ZINC000414923997 386613882 /nfs/dbraw/zinc/61/38/82/386613882.db2.gz FYPLNXIEQBIOIR-WDEREUQCSA-N 1 2 232.318 2.139 20 0 BEADLO Cn1cc(Cl)c(C[N@H+](C)[C@H]2CCSC2)n1 ZINC000335495160 386615630 /nfs/dbraw/zinc/61/56/30/386615630.db2.gz LRXFRIZWGMNXOS-QMMMGPOBSA-N 1 2 245.779 2.011 20 0 BEADLO Cn1cc(Cl)c(C[N@@H+](C)[C@H]2CCSC2)n1 ZINC000335495160 386615638 /nfs/dbraw/zinc/61/56/38/386615638.db2.gz LRXFRIZWGMNXOS-QMMMGPOBSA-N 1 2 245.779 2.011 20 0 BEADLO Cc1noc([C@@H](C)NCc2c[nH+]cn2C(C)C)n1 ZINC000425330465 386660696 /nfs/dbraw/zinc/66/06/96/386660696.db2.gz ASOUVJWAMUWKQQ-SECBINFHSA-N 1 2 249.318 2.006 20 0 BEADLO CC[C@@H](C)[N@H+](CCC(F)(F)F)CC(=O)OC ZINC000337223343 386664146 /nfs/dbraw/zinc/66/41/46/386664146.db2.gz DBQRENXBQGTINI-MRVPVSSYSA-N 1 2 241.253 2.212 20 0 BEADLO CC[C@@H](C)[N@@H+](CCC(F)(F)F)CC(=O)OC ZINC000337223343 386664152 /nfs/dbraw/zinc/66/41/52/386664152.db2.gz DBQRENXBQGTINI-MRVPVSSYSA-N 1 2 241.253 2.212 20 0 BEADLO Cc1cnc(C[N@@H+]2CCO[C@@H](C3CC3)C2)s1 ZINC000336420494 386667471 /nfs/dbraw/zinc/66/74/71/386667471.db2.gz VGZNKIBOQWPDDB-LLVKDONJSA-N 1 2 238.356 2.062 20 0 BEADLO Cc1cnc(C[N@H+]2CCO[C@@H](C3CC3)C2)s1 ZINC000336420494 386667480 /nfs/dbraw/zinc/66/74/80/386667480.db2.gz VGZNKIBOQWPDDB-LLVKDONJSA-N 1 2 238.356 2.062 20 0 BEADLO CC(C)(C)CCNC(=O)COc1cc[nH+]cc1 ZINC000292442276 386669459 /nfs/dbraw/zinc/66/94/59/386669459.db2.gz MRYWYPPUNCBIBS-UHFFFAOYSA-N 1 2 236.315 2.013 20 0 BEADLO Cc1ocnc1C(=O)Nc1c(C)cc[nH+]c1C ZINC000335529567 386676153 /nfs/dbraw/zinc/67/61/53/386676153.db2.gz LKGJWMRJMMGKCC-UHFFFAOYSA-N 1 2 231.255 2.247 20 0 BEADLO CC(C)=CC[N@@H+](C)Cc1nncn1C(C)C ZINC000292475994 386676916 /nfs/dbraw/zinc/67/69/16/386676916.db2.gz RTRYSGAKKPUHHJ-UHFFFAOYSA-N 1 2 222.336 2.257 20 0 BEADLO CC(C)=CC[N@H+](C)Cc1nncn1C(C)C ZINC000292475994 386676920 /nfs/dbraw/zinc/67/69/20/386676920.db2.gz RTRYSGAKKPUHHJ-UHFFFAOYSA-N 1 2 222.336 2.257 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)C1=CCC1 ZINC000335529799 386677458 /nfs/dbraw/zinc/67/74/58/386677458.db2.gz SNYAXHRKOACRFO-UHFFFAOYSA-N 1 2 202.257 2.357 20 0 BEADLO CCCC(=O)Nc1ccc2[nH]c(N(C)C)[nH+]c2c1 ZINC000279273850 386656742 /nfs/dbraw/zinc/65/67/42/386656742.db2.gz WPIGRLUOPKSEFF-UHFFFAOYSA-N 1 2 246.314 2.368 20 0 BEADLO COCCCC(=O)Nc1c(C)cc[nH+]c1C ZINC000425587828 386656943 /nfs/dbraw/zinc/65/69/43/386656943.db2.gz OPUWLYRCGJPXQB-UHFFFAOYSA-N 1 2 222.288 2.064 20 0 BEADLO COc1cc(C)nc(C[N@H+](C)Cc2ccc[nH]2)c1 ZINC000339816107 386657465 /nfs/dbraw/zinc/65/74/65/386657465.db2.gz DOLPWMJQMXZNEF-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1cc(C)nc(C[N@@H+](C)Cc2ccc[nH]2)c1 ZINC000339816107 386657470 /nfs/dbraw/zinc/65/74/70/386657470.db2.gz DOLPWMJQMXZNEF-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COC(=O)C(C)(C)CC[N@@H+]1CCC[C@@H]1C(F)F ZINC000353194511 386711318 /nfs/dbraw/zinc/71/13/18/386711318.db2.gz PHRXAPSHAVDEQJ-SECBINFHSA-N 1 2 249.301 2.305 20 0 BEADLO COC(=O)C(C)(C)CC[N@H+]1CCC[C@@H]1C(F)F ZINC000353194511 386711321 /nfs/dbraw/zinc/71/13/21/386711321.db2.gz PHRXAPSHAVDEQJ-SECBINFHSA-N 1 2 249.301 2.305 20 0 BEADLO CC[C@H](NC(=O)[C@H](C)C(C)(F)F)c1[nH]cc[nH+]1 ZINC000328534674 386686311 /nfs/dbraw/zinc/68/63/11/386686311.db2.gz ZPMTVIIPFCSALV-YUMQZZPRSA-N 1 2 245.273 2.268 20 0 BEADLO FC(F)c1cccc(C[NH+]2CCOCC2)c1 ZINC000279483498 386688524 /nfs/dbraw/zinc/68/85/24/386688524.db2.gz OLVBDRJHNNWDLL-UHFFFAOYSA-N 1 2 227.254 2.456 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCOCC12CCCCC2 ZINC000335470232 386689495 /nfs/dbraw/zinc/68/94/95/386689495.db2.gz HWSKYIMYESEXLQ-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCOCC12CCCCC2 ZINC000335470232 386689500 /nfs/dbraw/zinc/68/95/00/386689500.db2.gz HWSKYIMYESEXLQ-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CCOCC12CCCCC2 ZINC000335470232 386689506 /nfs/dbraw/zinc/68/95/06/386689506.db2.gz HWSKYIMYESEXLQ-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CCOCC12CCCCC2 ZINC000335470232 386689513 /nfs/dbraw/zinc/68/95/13/386689513.db2.gz HWSKYIMYESEXLQ-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO FCCOc1ccccc1NCc1[nH]cc[nH+]1 ZINC000295143394 386692833 /nfs/dbraw/zinc/69/28/33/386692833.db2.gz QFMCSBGIYABVOY-UHFFFAOYSA-N 1 2 235.262 2.370 20 0 BEADLO CC[C@@H]([NH2+][C@@H]1CC12CCCCC2)C(=O)OC ZINC000192862234 386693657 /nfs/dbraw/zinc/69/36/57/386693657.db2.gz VSHHZPFGRQJBSX-GHMZBOCLSA-N 1 2 225.332 2.250 20 0 BEADLO COC[C@H](CNc1[nH+]ccc(C)c1Cl)OC ZINC000336759882 386693948 /nfs/dbraw/zinc/69/39/48/386693948.db2.gz JIATZWDMBOCWDO-VIFPVBQESA-N 1 2 244.722 2.117 20 0 BEADLO Cn1c[nH+]cc1Cc1noc(C2CCCCC2)n1 ZINC000329543450 386702845 /nfs/dbraw/zinc/70/28/45/386702845.db2.gz FLKNVHAJUGKPMF-UHFFFAOYSA-N 1 2 246.314 2.442 20 0 BEADLO CC[C@@H]1C[C@@H](C)CN1C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000520606849 386703581 /nfs/dbraw/zinc/70/35/81/386703581.db2.gz WDSNXNSKTIXXMF-NQBHXWOUSA-N 1 2 249.358 2.235 20 0 BEADLO CC[C@@H]1C[C@@H](C)CN1C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000520606849 386703589 /nfs/dbraw/zinc/70/35/89/386703589.db2.gz WDSNXNSKTIXXMF-NQBHXWOUSA-N 1 2 249.358 2.235 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@@H](C)c1cncc(F)c1 ZINC000352844370 386705894 /nfs/dbraw/zinc/70/58/94/386705894.db2.gz XWAOVGFPPILGGG-VIFPVBQESA-N 1 2 234.278 2.103 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)CCc1cccs1 ZINC000266939121 386708305 /nfs/dbraw/zinc/70/83/05/386708305.db2.gz ASPUYCUIVHDSAG-UHFFFAOYSA-N 1 2 249.339 2.029 20 0 BEADLO Cn1cc(C[N@@H+]2CCC[C@H]2c2ccsc2)nn1 ZINC000334139480 386736923 /nfs/dbraw/zinc/73/69/23/386736923.db2.gz AGJLNCSUAYEBED-LBPRGKRZSA-N 1 2 248.355 2.214 20 0 BEADLO Cn1cc(C[N@H+]2CCC[C@H]2c2ccsc2)nn1 ZINC000334139480 386736928 /nfs/dbraw/zinc/73/69/28/386736928.db2.gz AGJLNCSUAYEBED-LBPRGKRZSA-N 1 2 248.355 2.214 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)[C@@H]1C=CCCCCC1 ZINC000292774389 386724610 /nfs/dbraw/zinc/72/46/10/386724610.db2.gz JYCWYVNPGHJUGO-LLVKDONJSA-N 1 2 220.320 2.125 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)[C@@H]1C=CCCCCC1 ZINC000292774389 386724614 /nfs/dbraw/zinc/72/46/14/386724614.db2.gz JYCWYVNPGHJUGO-LLVKDONJSA-N 1 2 220.320 2.125 20 0 BEADLO COC(=O)[C@H](c1ccccc1)[N@H+](C)CCCF ZINC000268957356 386726820 /nfs/dbraw/zinc/72/68/20/386726820.db2.gz VZIKBGKSFVGTBJ-LBPRGKRZSA-N 1 2 239.290 2.192 20 0 BEADLO COC(=O)[C@H](c1ccccc1)[N@@H+](C)CCCF ZINC000268957356 386726824 /nfs/dbraw/zinc/72/68/24/386726824.db2.gz VZIKBGKSFVGTBJ-LBPRGKRZSA-N 1 2 239.290 2.192 20 0 BEADLO CC1=C(C)C[C@@H](C(=O)NCc2c[nH+]c[nH]2)CC1 ZINC000335545632 386729306 /nfs/dbraw/zinc/72/93/06/386729306.db2.gz NSECAQDFMYDUNA-NSHDSACASA-N 1 2 233.315 2.162 20 0 BEADLO CC1=C(C)C[C@@H](C(=O)NCc2c[nH]c[nH+]2)CC1 ZINC000335545632 386729311 /nfs/dbraw/zinc/72/93/11/386729311.db2.gz NSECAQDFMYDUNA-NSHDSACASA-N 1 2 233.315 2.162 20 0 BEADLO CC[C@H]([NH2+]Cc1ccn(C)n1)c1c(C)noc1C ZINC000330494215 386748879 /nfs/dbraw/zinc/74/88/79/386748879.db2.gz UQQGPWKMSQPUJE-LBPRGKRZSA-N 1 2 248.330 2.266 20 0 BEADLO CC(C)(C)[C@@H]1CCCN(C(=O)Cn2cc[nH+]c2)C1 ZINC000279887816 386751909 /nfs/dbraw/zinc/75/19/09/386751909.db2.gz AHJNNVSEPYAOGK-GFCCVEGCSA-N 1 2 249.358 2.168 20 0 BEADLO C[C@@H](C(=O)N(C)Cc1[nH]cc[nH+]1)c1ccsc1 ZINC000348533499 386752843 /nfs/dbraw/zinc/75/28/43/386752843.db2.gz KXKRQEQDKIGLFD-SECBINFHSA-N 1 2 249.339 2.233 20 0 BEADLO FC[C@@H]1CCC[N@@H+]1Cc1cncc(F)c1 ZINC000292957356 386754446 /nfs/dbraw/zinc/75/44/46/386754446.db2.gz FLQCJTYYJVGRKN-NSHDSACASA-N 1 2 212.243 2.155 20 0 BEADLO FC[C@@H]1CCC[N@H+]1Cc1cncc(F)c1 ZINC000292957356 386754452 /nfs/dbraw/zinc/75/44/52/386754452.db2.gz FLQCJTYYJVGRKN-NSHDSACASA-N 1 2 212.243 2.155 20 0 BEADLO C[N@H+](Cc1ccn(C2CCCC2)n1)[C@@H]1CCOC1 ZINC000357304066 386756332 /nfs/dbraw/zinc/75/63/32/386756332.db2.gz KQOHIADTTJFSFD-CQSZACIVSA-N 1 2 249.358 2.219 20 0 BEADLO C[N@@H+](Cc1ccn(C2CCCC2)n1)[C@@H]1CCOC1 ZINC000357304066 386756335 /nfs/dbraw/zinc/75/63/35/386756335.db2.gz KQOHIADTTJFSFD-CQSZACIVSA-N 1 2 249.358 2.219 20 0 BEADLO CC(C)n1nccc1C[N@H+](C)Cc1ccncc1 ZINC000279968419 386763308 /nfs/dbraw/zinc/76/33/08/386763308.db2.gz PZLYBNREUTURSX-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO CC(C)n1nccc1C[N@@H+](C)Cc1ccncc1 ZINC000279968419 386763310 /nfs/dbraw/zinc/76/33/10/386763310.db2.gz PZLYBNREUTURSX-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO CCC[C@H](CC)[S@@](=O)Cc1c[nH+]cn1C ZINC000280004380 386766035 /nfs/dbraw/zinc/76/60/35/386766035.db2.gz NDERJSDAVWCKLN-NHYWBVRUSA-N 1 2 228.361 2.248 20 0 BEADLO Cc1ccc(Cc2nc(-c3ccon3)no2)c[nH+]1 ZINC000357358046 386766118 /nfs/dbraw/zinc/76/61/18/386766118.db2.gz OCYQNYNKSIRIGC-UHFFFAOYSA-N 1 2 242.238 2.019 20 0 BEADLO FC(F)(F)C[C@@H]1CC[N@H+](Cc2cnc[nH]2)C1 ZINC000280210086 386791080 /nfs/dbraw/zinc/79/10/80/386791080.db2.gz JXLRHVACZYEGMR-QMMMGPOBSA-N 1 2 233.237 2.184 20 0 BEADLO FC(F)(F)C[C@@H]1CC[N@@H+](Cc2cnc[nH]2)C1 ZINC000280210086 386791085 /nfs/dbraw/zinc/79/10/85/386791085.db2.gz JXLRHVACZYEGMR-QMMMGPOBSA-N 1 2 233.237 2.184 20 0 BEADLO CCC[C@H](C)C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000125323202 386793055 /nfs/dbraw/zinc/79/30/55/386793055.db2.gz JBHDKPFVQPWFBG-VHSXEESVSA-N 1 2 223.320 2.413 20 0 BEADLO CCC(CC)C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000125342496 386795591 /nfs/dbraw/zinc/79/55/91/386795591.db2.gz ROTDLRZDZAUGAE-JTQLQIEISA-N 1 2 223.320 2.413 20 0 BEADLO c1cn(CCc2nc(CC3CCCC3)no2)c[nH+]1 ZINC000293068096 386773701 /nfs/dbraw/zinc/77/37/01/386773701.db2.gz ATOXPTUIBAWMHC-UHFFFAOYSA-N 1 2 246.314 2.242 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@H]2CF)s1 ZINC000293090455 386776664 /nfs/dbraw/zinc/77/66/64/386776664.db2.gz PMMDEQVCJRSGLR-VIFPVBQESA-N 1 2 214.309 2.385 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@H]2CF)s1 ZINC000293090455 386776667 /nfs/dbraw/zinc/77/66/67/386776667.db2.gz PMMDEQVCJRSGLR-VIFPVBQESA-N 1 2 214.309 2.385 20 0 BEADLO CC(C)n1ncnc1C[N@H+](C)Cc1ccccc1 ZINC000280150934 386784931 /nfs/dbraw/zinc/78/49/31/386784931.db2.gz XGFQPXULJSSQPA-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO CC(C)n1ncnc1C[N@@H+](C)Cc1ccccc1 ZINC000280150934 386784940 /nfs/dbraw/zinc/78/49/40/386784940.db2.gz XGFQPXULJSSQPA-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO Cc1cc(C)c(NC(=O)COC(C)C)c(C)[nH+]1 ZINC000330662499 386816879 /nfs/dbraw/zinc/81/68/79/386816879.db2.gz WGAQEQKGILTWFZ-UHFFFAOYSA-N 1 2 236.315 2.370 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)Cc1ccc(F)cc1F ZINC000280566135 386821877 /nfs/dbraw/zinc/82/18/77/386821877.db2.gz VQQWEIHLAZYOOA-UHFFFAOYSA-N 1 2 237.253 2.320 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)Cc1ccc(F)cc1F ZINC000280566135 386821886 /nfs/dbraw/zinc/82/18/86/386821886.db2.gz VQQWEIHLAZYOOA-UHFFFAOYSA-N 1 2 237.253 2.320 20 0 BEADLO CCCCC[C@H]1CCC[N@@H+]1Cc1n[nH]c(=O)[nH]1 ZINC000340938406 386801653 /nfs/dbraw/zinc/80/16/53/386801653.db2.gz ZLLNBSYTYPDLCX-JTQLQIEISA-N 1 2 238.335 2.055 20 0 BEADLO CCCCC[C@H]1CCC[N@H+]1Cc1n[nH]c(=O)[nH]1 ZINC000340938406 386801660 /nfs/dbraw/zinc/80/16/60/386801660.db2.gz ZLLNBSYTYPDLCX-JTQLQIEISA-N 1 2 238.335 2.055 20 0 BEADLO CCC[C@H](C)C[NH2+][C@H](CC(F)F)C(=O)OC ZINC000336670214 386803964 /nfs/dbraw/zinc/80/39/64/386803964.db2.gz ABNUUWBJQXHXAU-DTWKUNHWSA-N 1 2 237.290 2.209 20 0 BEADLO COc1ncncc1C[N@H+](C)Cc1ccoc1C ZINC000648004130 386814394 /nfs/dbraw/zinc/81/43/94/386814394.db2.gz RMBBDGPXGMHCMK-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1ncncc1C[N@@H+](C)Cc1ccoc1C ZINC000648004130 386814398 /nfs/dbraw/zinc/81/43/98/386814398.db2.gz RMBBDGPXGMHCMK-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO Cc1cc(NCCc2ccc(C)[nH+]c2)ncn1 ZINC000301226915 386825253 /nfs/dbraw/zinc/82/52/53/386825253.db2.gz GMKAFFNSHJNNJX-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO CC[C@H]([NH2+][C@H]1C[C@H](c2ccccc2)C1)C(=O)OC ZINC000280592296 386825214 /nfs/dbraw/zinc/82/52/14/386825214.db2.gz INUQBADNRDJUJN-IHRRRGAJSA-N 1 2 247.338 2.474 20 0 BEADLO CC(C)[C@@](C)(O)CNc1cc[nH+]c(C2CC2)n1 ZINC000301228941 386825464 /nfs/dbraw/zinc/82/54/64/386825464.db2.gz HSQBWSNNSCDDHM-ZDUSSCGKSA-N 1 2 235.331 2.173 20 0 BEADLO CN(C(=O)CCc1[nH]cc[nH+]1)[C@H]1CCC(C)(C)C1 ZINC000357675819 386825541 /nfs/dbraw/zinc/82/55/41/386825541.db2.gz NVJWDSSPRPGVJA-NSHDSACASA-N 1 2 249.358 2.379 20 0 BEADLO Cc1occc1CN(C)c1cc(C)[nH+]cn1 ZINC000301226378 386825775 /nfs/dbraw/zinc/82/57/75/386825775.db2.gz DYHXQPSTCPBGJA-UHFFFAOYSA-N 1 2 217.272 2.323 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)CC(C)(C)C1CC1 ZINC000293491459 386827011 /nfs/dbraw/zinc/82/70/11/386827011.db2.gz NDEDZZNRXBHVMR-LLVKDONJSA-N 1 2 249.358 2.214 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)ccc1F ZINC000366555168 386830740 /nfs/dbraw/zinc/83/07/40/386830740.db2.gz CTYFIGBDZJNPHU-QWHCGFSZSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@@H]3C[C@@H]32)ccc1F ZINC000366555168 386830744 /nfs/dbraw/zinc/83/07/44/386830744.db2.gz CTYFIGBDZJNPHU-QWHCGFSZSA-N 1 2 221.275 2.107 20 0 BEADLO CC[C@@H](C)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000280674395 386833683 /nfs/dbraw/zinc/83/36/83/386833683.db2.gz BSLYQAGUEHRGJB-SECBINFHSA-N 1 2 217.272 2.319 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1cc(F)c(F)cc1F ZINC000293555178 386837260 /nfs/dbraw/zinc/83/72/60/386837260.db2.gz FJTNILPVMONNPL-VIFPVBQESA-N 1 2 245.244 2.325 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1cc(F)c(F)cc1F ZINC000293555178 386837265 /nfs/dbraw/zinc/83/72/65/386837265.db2.gz FJTNILPVMONNPL-VIFPVBQESA-N 1 2 245.244 2.325 20 0 BEADLO CO[C@]1(C)C[C@H](Nc2cc(C)[nH+]cn2)C1(C)C ZINC000301427525 386841957 /nfs/dbraw/zinc/84/19/57/386841957.db2.gz MOFKIAYSUXSSKR-GXFFZTMASA-N 1 2 235.331 2.401 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1cccc(F)c1F ZINC000293588875 386843224 /nfs/dbraw/zinc/84/32/24/386843224.db2.gz OEKMJTJDVCUYRY-SNVBAGLBSA-N 1 2 227.254 2.186 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1cccc(F)c1F ZINC000293588875 386843232 /nfs/dbraw/zinc/84/32/32/386843232.db2.gz OEKMJTJDVCUYRY-SNVBAGLBSA-N 1 2 227.254 2.186 20 0 BEADLO CC(C)[C@@H](O)CCNc1cc[nH+]c(C2CC2)n1 ZINC000301430555 386843918 /nfs/dbraw/zinc/84/39/18/386843918.db2.gz QGYJVGMLLLETOL-NSHDSACASA-N 1 2 235.331 2.173 20 0 BEADLO Cc1[nH]c2nc[nH+]c(S[C@H](C)CO)c2c1C ZINC000645181567 386845406 /nfs/dbraw/zinc/84/54/06/386845406.db2.gz LCSVZLAWQHLRGT-ZCFIWIBFSA-N 1 2 237.328 2.048 20 0 BEADLO COC[C@@H](Nc1cc(C)[nH+]cn1)c1ccc(C)o1 ZINC000301529057 386854264 /nfs/dbraw/zinc/85/42/64/386854264.db2.gz GZSIICYUHHRBRW-LLVKDONJSA-N 1 2 247.298 2.486 20 0 BEADLO COC(=O)[C@H](CC(C)C)[NH2+][C@H]1CC[C@H]1SC ZINC000425343498 386855636 /nfs/dbraw/zinc/85/56/36/386855636.db2.gz RSXFETVJYMUQBI-GARJFASQSA-N 1 2 245.388 2.058 20 0 BEADLO C[C@@H](CO)[C@H](C)Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000301556913 386856144 /nfs/dbraw/zinc/85/61/44/386856144.db2.gz HMVPZKMPTURRBG-UWVGGRQHSA-N 1 2 237.347 2.203 20 0 BEADLO COC(=O)c1cccc(CNc2cccc[nH+]2)c1 ZINC000301608916 386857819 /nfs/dbraw/zinc/85/78/19/386857819.db2.gz AKAXPPBDGLFIQP-UHFFFAOYSA-N 1 2 242.278 2.480 20 0 BEADLO CC[C@H](CCO)Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000301586676 386858765 /nfs/dbraw/zinc/85/87/65/386858765.db2.gz PCSBVSKAGPJWED-SNVBAGLBSA-N 1 2 237.347 2.347 20 0 BEADLO Cc1cc(N[C@@H]2CCC[C@@H]3OCC[C@@H]32)nc[nH+]1 ZINC000301658747 386862395 /nfs/dbraw/zinc/86/23/95/386862395.db2.gz LXBOLWBXHUACPZ-UTUOFQBUSA-N 1 2 233.315 2.155 20 0 BEADLO CCC(=O)N1CC[N@H+](Cc2c(C)cccc2C)C1 ZINC000425348209 386863614 /nfs/dbraw/zinc/86/36/14/386863614.db2.gz NIHPRISNXLMJQK-UHFFFAOYSA-N 1 2 246.354 2.315 20 0 BEADLO CCC(=O)N1CC[N@@H+](Cc2c(C)cccc2C)C1 ZINC000425348209 386863620 /nfs/dbraw/zinc/86/36/20/386863620.db2.gz NIHPRISNXLMJQK-UHFFFAOYSA-N 1 2 246.354 2.315 20 0 BEADLO Cn1cc([C@H]([NH2+]Cc2ccon2)C(C)(C)C)cn1 ZINC000330713713 386864114 /nfs/dbraw/zinc/86/41/14/386864114.db2.gz XBVCFVNSNIYBRC-LBPRGKRZSA-N 1 2 248.330 2.285 20 0 BEADLO Cc1ccc(F)c(C[N@@H+](C)Cc2cnn(C)c2)c1 ZINC000349543461 386864451 /nfs/dbraw/zinc/86/44/51/386864451.db2.gz GICWAQNPIQLFEK-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1ccc(F)c(C[N@H+](C)Cc2cnn(C)c2)c1 ZINC000349543461 386864452 /nfs/dbraw/zinc/86/44/52/386864452.db2.gz GICWAQNPIQLFEK-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+]1CCO[C@H](CF)C1 ZINC000334831060 386866339 /nfs/dbraw/zinc/86/63/39/386866339.db2.gz XMDVGTSXUCFEOJ-CYBMUJFWSA-N 1 2 241.281 2.304 20 0 BEADLO Cc1ccc(F)cc1C[N@H+]1CCO[C@H](CF)C1 ZINC000334831060 386866344 /nfs/dbraw/zinc/86/63/44/386866344.db2.gz XMDVGTSXUCFEOJ-CYBMUJFWSA-N 1 2 241.281 2.304 20 0 BEADLO CC/C=C(\C)c1nc(Cc2c[nH+]cn2C)no1 ZINC000357954682 386871634 /nfs/dbraw/zinc/87/16/34/386871634.db2.gz WDDBAKADCTZFDY-WEVVVXLNSA-N 1 2 232.287 2.207 20 0 BEADLO COC1CC(N(C)c2cc(C)[nH+]c(C3CC3)n2)C1 ZINC000343251090 386875829 /nfs/dbraw/zinc/87/58/29/386875829.db2.gz GYASLNALIRWIGZ-UHFFFAOYSA-N 1 2 247.342 2.276 20 0 BEADLO CCc1ncc(C[N@@H+]2CCC[C@@](C)(F)C2)cn1 ZINC000334835182 386877027 /nfs/dbraw/zinc/87/70/27/386877027.db2.gz GVOYYKJUBWWKIZ-CYBMUJFWSA-N 1 2 237.322 2.363 20 0 BEADLO CCc1ncc(C[N@H+]2CCC[C@@](C)(F)C2)cn1 ZINC000334835182 386877029 /nfs/dbraw/zinc/87/70/29/386877029.db2.gz GVOYYKJUBWWKIZ-CYBMUJFWSA-N 1 2 237.322 2.363 20 0 BEADLO CCCC(=O)NCc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000349551357 386879594 /nfs/dbraw/zinc/87/95/94/386879594.db2.gz MIDCCPVYTJZXDX-UHFFFAOYSA-N 1 2 243.310 2.493 20 0 BEADLO Cc1c[nH+]c(CN[C@H](C(C)C)C(F)(F)F)n1C ZINC000341335730 386882764 /nfs/dbraw/zinc/88/27/64/386882764.db2.gz AXEJLZGBELVGII-SNVBAGLBSA-N 1 2 249.280 2.405 20 0 BEADLO CCCC[NH2+][C@@H](c1nnc[nH]1)c1ccc(F)cc1 ZINC000293826346 386887257 /nfs/dbraw/zinc/88/72/57/386887257.db2.gz SGOZRNRSGRXCGA-GFCCVEGCSA-N 1 2 248.305 2.423 20 0 BEADLO Cc1c[nH+]c(CNc2cccc3c2CCO3)n1C ZINC000341346903 386887561 /nfs/dbraw/zinc/88/75/61/386887561.db2.gz GNSWBXIGLVUFTF-UHFFFAOYSA-N 1 2 243.310 2.276 20 0 BEADLO CCn1c[nH+]cc1CN(C)[C@@H](C)c1ccncc1 ZINC000418010647 386889469 /nfs/dbraw/zinc/88/94/69/386889469.db2.gz TXUXKBFKVQRGHH-LBPRGKRZSA-N 1 2 244.342 2.491 20 0 BEADLO C[C@]1(CO)CCCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000301895615 386889714 /nfs/dbraw/zinc/88/97/14/386889714.db2.gz UDVKGLPXWASPKU-AWEZNQCLSA-N 1 2 245.326 2.162 20 0 BEADLO CC(C)c1nc(N[C@H](CO)C(C)(C)C)cc[nH+]1 ZINC000302048100 386898663 /nfs/dbraw/zinc/89/86/63/386898663.db2.gz MBPQEVJTRJGYMU-SNVBAGLBSA-N 1 2 237.347 2.419 20 0 BEADLO CC[C@@H](CCO)Nc1nc(C)[nH+]c2c1CCCC2 ZINC000302038445 386899515 /nfs/dbraw/zinc/89/95/15/386899515.db2.gz GUIOUIOLMAHDLR-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H]1CC[C@H]([N@H+](C)Cc2csnn2)C1 ZINC000334863662 386919746 /nfs/dbraw/zinc/91/97/46/386919746.db2.gz JNQFGQRKHACMFH-SCZZXKLOSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]1CC[C@H]([N@@H+](C)Cc2csnn2)C1 ZINC000334863662 386919751 /nfs/dbraw/zinc/91/97/51/386919751.db2.gz JNQFGQRKHACMFH-SCZZXKLOSA-N 1 2 211.334 2.159 20 0 BEADLO CC(C)C[C@@H](C)C(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000358174723 386907544 /nfs/dbraw/zinc/90/75/44/386907544.db2.gz YWCBOARJHPDARY-GHMZBOCLSA-N 1 2 249.358 2.065 20 0 BEADLO CC(C)C[C@@H](C)C(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000358174723 386907546 /nfs/dbraw/zinc/90/75/46/386907546.db2.gz YWCBOARJHPDARY-GHMZBOCLSA-N 1 2 249.358 2.065 20 0 BEADLO Nc1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1ccn[nH]1 ZINC000334856361 386909195 /nfs/dbraw/zinc/90/91/95/386909195.db2.gz PZQIDCRDWVFLEA-AWEZNQCLSA-N 1 2 242.326 2.159 20 0 BEADLO Cc1occc1C[N@@H+]1CCc2nc(C)ncc2C1 ZINC000334856569 386909624 /nfs/dbraw/zinc/90/96/24/386909624.db2.gz QHXBDWSDRNFBGV-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1occc1C[N@H+]1CCc2nc(C)ncc2C1 ZINC000334856569 386909626 /nfs/dbraw/zinc/90/96/26/386909626.db2.gz QHXBDWSDRNFBGV-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)cc1C ZINC000367842515 386912109 /nfs/dbraw/zinc/91/21/09/386912109.db2.gz XOQSFRZXXYQLTK-UONOGXRCSA-N 1 2 217.312 2.277 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@@H]3C[C@@H]32)cc1C ZINC000367842515 386912112 /nfs/dbraw/zinc/91/21/12/386912112.db2.gz XOQSFRZXXYQLTK-UONOGXRCSA-N 1 2 217.312 2.277 20 0 BEADLO CC(C)c1nc(NCCOCC(F)F)cc[nH+]1 ZINC000302783990 386936525 /nfs/dbraw/zinc/93/65/25/386936525.db2.gz UINOCEIBKIYYOM-UHFFFAOYSA-N 1 2 245.273 2.294 20 0 BEADLO Cc1cn[nH]c1C[NH2+][C@H]1COc2ccc(C)cc21 ZINC000368073068 386937133 /nfs/dbraw/zinc/93/71/33/386937133.db2.gz QQVDHJUWGIVMGU-ZDUSSCGKSA-N 1 2 243.310 2.250 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@H]1COc2ccc(C)cc21 ZINC000368073068 386937139 /nfs/dbraw/zinc/93/71/39/386937139.db2.gz QQVDHJUWGIVMGU-ZDUSSCGKSA-N 1 2 243.310 2.250 20 0 BEADLO C[C@H](C(=O)N[C@H](c1[nH+]ccn1C)C1CC1)C1CC1 ZINC000341702568 386953599 /nfs/dbraw/zinc/95/35/99/386953599.db2.gz DQMBBMUMBRGUSR-CABZTGNLSA-N 1 2 247.342 2.034 20 0 BEADLO CS[C@@H](C)CCC(=O)Nc1cc[nH+]c(C)c1 ZINC000358419543 386953973 /nfs/dbraw/zinc/95/39/73/386953973.db2.gz WPIPLNJXYBYWSL-JTQLQIEISA-N 1 2 238.356 2.282 20 0 BEADLO Cc1ccc(N[C@H](C)c2ccn(C)n2)c[nH+]1 ZINC000334825635 386957006 /nfs/dbraw/zinc/95/70/06/386957006.db2.gz SCIYWRRQOJBXCC-SNVBAGLBSA-N 1 2 216.288 2.297 20 0 BEADLO CC[C@@H](NC(=O)[C@H](CC)SC)c1[nH]cc[nH+]1 ZINC000331031910 386958739 /nfs/dbraw/zinc/95/87/39/386958739.db2.gz GYAXHJJXRBTMTJ-BDAKNGLRSA-N 1 2 241.360 2.119 20 0 BEADLO c1ccc(CSCC[N@@H+]2CCO[C@H]3C[C@H]32)cc1 ZINC000368326496 386960119 /nfs/dbraw/zinc/96/01/19/386960119.db2.gz ADGIRTYCXBWVCC-KGLIPLIRSA-N 1 2 249.379 2.393 20 0 BEADLO c1ccc(CSCC[N@H+]2CCO[C@H]3C[C@H]32)cc1 ZINC000368326496 386960121 /nfs/dbraw/zinc/96/01/21/386960121.db2.gz ADGIRTYCXBWVCC-KGLIPLIRSA-N 1 2 249.379 2.393 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+]2CC[C@@](C)(F)C2)o1 ZINC000334891203 386964544 /nfs/dbraw/zinc/96/45/44/386964544.db2.gz SRRLDNAKOTVEGU-GXSJLCMTSA-N 1 2 212.268 2.478 20 0 BEADLO Cc1cnc([C@H](C)[N@H+]2CC[C@@](C)(F)C2)o1 ZINC000334891203 386964547 /nfs/dbraw/zinc/96/45/47/386964547.db2.gz SRRLDNAKOTVEGU-GXSJLCMTSA-N 1 2 212.268 2.478 20 0 BEADLO CC[C@@H](F)C[NH2+]C1(c2noc(C)n2)CCCC1 ZINC000332370950 386973737 /nfs/dbraw/zinc/97/37/37/386973737.db2.gz LXZJYVGEUKZUPJ-SNVBAGLBSA-N 1 2 241.310 2.485 20 0 BEADLO CCO[C@@H](C)C(=O)Nc1c(C)cc[nH+]c1C ZINC000331156636 386977826 /nfs/dbraw/zinc/97/78/26/386977826.db2.gz VUCCFTZNDVBUFV-JTQLQIEISA-N 1 2 222.288 2.062 20 0 BEADLO CCOc1nnc(C[N@H+](C)[C@@H](C)C(C)C)s1 ZINC000341848526 386978440 /nfs/dbraw/zinc/97/84/40/386978440.db2.gz ZGXWJDDJRQQLRV-VIFPVBQESA-N 1 2 243.376 2.413 20 0 BEADLO CCOc1nnc(C[N@@H+](C)[C@@H](C)C(C)C)s1 ZINC000341848526 386978447 /nfs/dbraw/zinc/97/84/47/386978447.db2.gz ZGXWJDDJRQQLRV-VIFPVBQESA-N 1 2 243.376 2.413 20 0 BEADLO Cc1nc(C[N@@H+]2CCSC(C)(C)C2)co1 ZINC000647966429 387003807 /nfs/dbraw/zinc/00/38/07/387003807.db2.gz SJWHXNFXDVSWLQ-UHFFFAOYSA-N 1 2 226.345 2.310 20 0 BEADLO Cc1nc(C[N@H+]2CCSC(C)(C)C2)co1 ZINC000647966429 387003812 /nfs/dbraw/zinc/00/38/12/387003812.db2.gz SJWHXNFXDVSWLQ-UHFFFAOYSA-N 1 2 226.345 2.310 20 0 BEADLO CC[C@@H](NC(=O)C[C@H](C)SC)c1[nH]cc[nH+]1 ZINC000331291782 387008856 /nfs/dbraw/zinc/00/88/56/387008856.db2.gz WTYFZJRAKQPPHW-DTWKUNHWSA-N 1 2 241.360 2.119 20 0 BEADLO CC[C@H](CSC)[N@H+](C)Cc1nnc(C)s1 ZINC000358743055 387004980 /nfs/dbraw/zinc/00/49/80/387004980.db2.gz JXBOXGOSLWPECU-SECBINFHSA-N 1 2 245.417 2.420 20 0 BEADLO CC[C@H](CSC)[N@@H+](C)Cc1nnc(C)s1 ZINC000358743055 387004987 /nfs/dbraw/zinc/00/49/87/387004987.db2.gz JXBOXGOSLWPECU-SECBINFHSA-N 1 2 245.417 2.420 20 0 BEADLO Cn1cc[nH+]c1[C@@H](NC(=O)[C@H]1CC1(C)C)C1CC1 ZINC000341686746 386951153 /nfs/dbraw/zinc/95/11/53/386951153.db2.gz GFKKMOVBXNGTNG-MNOVXSKESA-N 1 2 247.342 2.034 20 0 BEADLO O=C(CCn1cc[nH+]c1)N(CC1CC1)C1CCC1 ZINC000358411155 386951841 /nfs/dbraw/zinc/95/18/41/386951841.db2.gz KKZQCURWTAGYOC-UHFFFAOYSA-N 1 2 247.342 2.064 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1C[C@]12CCOC2 ZINC000333361283 387030216 /nfs/dbraw/zinc/03/02/16/387030216.db2.gz HHPZSGGRYGWVSY-FZMZJTMJSA-N 1 2 246.310 2.064 20 0 BEADLO CC[C@@H](C)CC(=O)NCCCCn1cc[nH+]c1 ZINC000519261018 387044722 /nfs/dbraw/zinc/04/47/22/387044722.db2.gz WKEJNOYVFQSDSR-GFCCVEGCSA-N 1 2 237.347 2.216 20 0 BEADLO Cc1cc(CNC(=O)N[C@H]2CC2(C)C)cc(C)[nH+]1 ZINC000334966343 387049346 /nfs/dbraw/zinc/04/93/46/387049346.db2.gz IHEGGCDWLBXYCC-LBPRGKRZSA-N 1 2 247.342 2.296 20 0 BEADLO CCc1cc(C[NH2+][C@@H](C)c2nccnc2C)on1 ZINC000527348327 387050738 /nfs/dbraw/zinc/05/07/38/387050738.db2.gz VQOGMIPZTGDEJK-JTQLQIEISA-N 1 2 246.314 2.186 20 0 BEADLO C[C@@H](CO)CNc1cc(C(F)(F)F)cc[nH+]1 ZINC000085486181 387062679 /nfs/dbraw/zinc/06/26/79/387062679.db2.gz WASAHILQHVCRJL-SSDOTTSWSA-N 1 2 234.221 2.141 20 0 BEADLO COC(=O)[C@H]([NH2+]C/C=C\c1ccccc1)C1CC1 ZINC000358817621 387017958 /nfs/dbraw/zinc/01/79/58/387017958.db2.gz PSRPDVQWIQLUDR-BMWLXYDHSA-N 1 2 245.322 2.241 20 0 BEADLO CC/C=C(\C)C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000368930013 387019467 /nfs/dbraw/zinc/01/94/67/387019467.db2.gz GIYNZTASIIHPIH-JXDHDYMSSA-N 1 2 247.342 2.472 20 0 BEADLO CC/C=C(\C)C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000368930011 387019585 /nfs/dbraw/zinc/01/95/85/387019585.db2.gz GIYNZTASIIHPIH-JVOXIWMLSA-N 1 2 247.342 2.472 20 0 BEADLO CSCC[N@@H+]1CCCC[C@H]1c1noc(C)n1 ZINC000368998188 387023937 /nfs/dbraw/zinc/02/39/37/387023937.db2.gz DEDYMTDXQWMNTI-JTQLQIEISA-N 1 2 241.360 2.268 20 0 BEADLO CSCC[N@H+]1CCCC[C@H]1c1noc(C)n1 ZINC000368998188 387023938 /nfs/dbraw/zinc/02/39/38/387023938.db2.gz DEDYMTDXQWMNTI-JTQLQIEISA-N 1 2 241.360 2.268 20 0 BEADLO CCN(CC)C(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000117562171 387024382 /nfs/dbraw/zinc/02/43/82/387024382.db2.gz PECMVAPLOPYLFZ-UHFFFAOYSA-N 1 2 243.310 2.354 20 0 BEADLO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccn(C)n1 ZINC000336224744 387066173 /nfs/dbraw/zinc/06/61/73/387066173.db2.gz OMCYYCRGLSLBAF-WCBMZHEXSA-N 1 2 247.264 2.193 20 0 BEADLO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ccn(C)n1 ZINC000336224744 387066177 /nfs/dbraw/zinc/06/61/77/387066177.db2.gz OMCYYCRGLSLBAF-WCBMZHEXSA-N 1 2 247.264 2.193 20 0 BEADLO C[C@@H](F)CC[N@@H+]1Cc2ccccc2NC(=O)C1 ZINC000519177008 387028503 /nfs/dbraw/zinc/02/85/03/387028503.db2.gz QJMIVRRQLUHUIH-SNVBAGLBSA-N 1 2 236.290 2.189 20 0 BEADLO C[C@@H](F)CC[N@H+]1Cc2ccccc2NC(=O)C1 ZINC000519177008 387028508 /nfs/dbraw/zinc/02/85/08/387028508.db2.gz QJMIVRRQLUHUIH-SNVBAGLBSA-N 1 2 236.290 2.189 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)Cc1ccncc1 ZINC000118888507 387077027 /nfs/dbraw/zinc/07/70/27/387077027.db2.gz WHOWMKUZITYXRX-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)Cc1ccncc1 ZINC000118888507 387077037 /nfs/dbraw/zinc/07/70/37/387077037.db2.gz WHOWMKUZITYXRX-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CN(C)c1ccc(CNc2ncccc2F)c[nH+]1 ZINC000359294334 387080511 /nfs/dbraw/zinc/08/05/11/387080511.db2.gz BQWRCFRCNGODMI-UHFFFAOYSA-N 1 2 246.289 2.294 20 0 BEADLO Cc1c(Cl)c(C[N@@H+]2C[C@@H]3CCC[C@H]32)nn1C ZINC000334996432 387088015 /nfs/dbraw/zinc/08/80/15/387088015.db2.gz ZEZORBLNBQPGRS-GXSJLCMTSA-N 1 2 239.750 2.366 20 0 BEADLO Cc1c(Cl)c(C[N@H+]2C[C@@H]3CCC[C@H]32)nn1C ZINC000334996432 387088019 /nfs/dbraw/zinc/08/80/19/387088019.db2.gz ZEZORBLNBQPGRS-GXSJLCMTSA-N 1 2 239.750 2.366 20 0 BEADLO COC[C@@H](C)Nc1cc(C)[nH+]c(C(C)C)n1 ZINC000035121332 387130976 /nfs/dbraw/zinc/13/09/76/387130976.db2.gz ZTIONQXJTFLUQE-SNVBAGLBSA-N 1 2 223.320 2.355 20 0 BEADLO CC[C@H](NCc1c[nH+]cn1CC)C(F)F ZINC000418078321 387089076 /nfs/dbraw/zinc/08/90/76/387089076.db2.gz NZVBBVPMIPQYLM-VIFPVBQESA-N 1 2 217.263 2.036 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2nc3cccnc3s2)C1 ZINC000336262919 387098165 /nfs/dbraw/zinc/09/81/65/387098165.db2.gz ZPIURCHVTZYZKB-MRVPVSSYSA-N 1 2 237.303 2.235 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2nc3cccnc3s2)C1 ZINC000336262919 387098169 /nfs/dbraw/zinc/09/81/69/387098169.db2.gz ZPIURCHVTZYZKB-MRVPVSSYSA-N 1 2 237.303 2.235 20 0 BEADLO CO[C@H]1CCN(c2[nH]c3ccccc3[nH+]2)C[C@@H]1C ZINC000336271244 387103695 /nfs/dbraw/zinc/10/36/95/387103695.db2.gz MBXHKDCPVMYIBK-GWCFXTLKSA-N 1 2 245.326 2.424 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@H](C3CC3)C2)cn1 ZINC000336273647 387106376 /nfs/dbraw/zinc/10/63/76/387106376.db2.gz DVYLSKAALQSWIJ-AWEZNQCLSA-N 1 2 232.327 2.001 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@H](C3CC3)C2)cn1 ZINC000336273647 387106379 /nfs/dbraw/zinc/10/63/79/387106379.db2.gz DVYLSKAALQSWIJ-AWEZNQCLSA-N 1 2 232.327 2.001 20 0 BEADLO CCCCNC(=O)C[N@H+](C)[C@H](C)c1ccco1 ZINC000069069590 387112932 /nfs/dbraw/zinc/11/29/32/387112932.db2.gz QSPDJMAYHKVFCH-LLVKDONJSA-N 1 2 238.331 2.189 20 0 BEADLO CCCCNC(=O)C[N@@H+](C)[C@H](C)c1ccco1 ZINC000069069590 387112937 /nfs/dbraw/zinc/11/29/37/387112937.db2.gz QSPDJMAYHKVFCH-LLVKDONJSA-N 1 2 238.331 2.189 20 0 BEADLO O=C1OCC[C@@]12CCC[N@H+]2Cc1cccc(F)c1 ZINC000186632247 387117778 /nfs/dbraw/zinc/11/77/78/387117778.db2.gz NWYNWZBMIALHDU-AWEZNQCLSA-N 1 2 249.285 2.107 20 0 BEADLO O=C1OCC[C@@]12CCC[N@@H+]2Cc1cccc(F)c1 ZINC000186632247 387117780 /nfs/dbraw/zinc/11/77/80/387117780.db2.gz NWYNWZBMIALHDU-AWEZNQCLSA-N 1 2 249.285 2.107 20 0 BEADLO Cc1ccc(NC(=O)c2ccc[nH]2)c(C)[nH+]1 ZINC000119386504 387125322 /nfs/dbraw/zinc/12/53/22/387125322.db2.gz FLUXQDKQCSCMGR-UHFFFAOYSA-N 1 2 215.256 2.279 20 0 BEADLO CCC1(NC(=O)c2ccc3[nH+]ccn3c2)CC1 ZINC000336295440 387125838 /nfs/dbraw/zinc/12/58/38/387125838.db2.gz XKGAFTVPWQXXCP-UHFFFAOYSA-N 1 2 229.283 2.007 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2C[C@@H](C)S[C@@H](C)C2)no1 ZINC000571690032 387142320 /nfs/dbraw/zinc/14/23/20/387142320.db2.gz UGAYVNIPBVUYBR-YIZRAAEISA-N 1 2 241.360 2.265 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2C[C@@H](C)S[C@@H](C)C2)no1 ZINC000571690032 387142325 /nfs/dbraw/zinc/14/23/25/387142325.db2.gz UGAYVNIPBVUYBR-YIZRAAEISA-N 1 2 241.360 2.265 20 0 BEADLO CC(C)[C@H]([NH2+]Cc1ccn[nH]1)c1cccnc1 ZINC000536999574 387142326 /nfs/dbraw/zinc/14/23/26/387142326.db2.gz UGLWRHDJGFVPGB-ZDUSSCGKSA-N 1 2 230.315 2.292 20 0 BEADLO COC(=O)C(C)(C)[N@H+](C)Cc1ccsc1 ZINC000353150348 387144809 /nfs/dbraw/zinc/14/48/09/387144809.db2.gz BVNIUWGHYXENNJ-UHFFFAOYSA-N 1 2 227.329 2.132 20 0 BEADLO COC(=O)C(C)(C)[N@@H+](C)Cc1ccsc1 ZINC000353150348 387144816 /nfs/dbraw/zinc/14/48/16/387144816.db2.gz BVNIUWGHYXENNJ-UHFFFAOYSA-N 1 2 227.329 2.132 20 0 BEADLO Cc1cc(C)n(CC[N@@H+]2CCC[C@H]2C(F)F)n1 ZINC000353172273 387150104 /nfs/dbraw/zinc/15/01/04/387150104.db2.gz NHYZLPUNWLGCMJ-NSHDSACASA-N 1 2 243.301 2.229 20 0 BEADLO Cc1cc(C)n(CC[N@H+]2CCC[C@H]2C(F)F)n1 ZINC000353172273 387150105 /nfs/dbraw/zinc/15/01/05/387150105.db2.gz NHYZLPUNWLGCMJ-NSHDSACASA-N 1 2 243.301 2.229 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CCC(OCC2CC2)CC1 ZINC000371332601 387192849 /nfs/dbraw/zinc/19/28/49/387192849.db2.gz ABKJZJRNCZIVBZ-UHFFFAOYSA-N 1 2 249.358 2.109 20 0 BEADLO CCc1nc(C[N@@H+]2CCCC3(CC3)C2)no1 ZINC000186976602 387159354 /nfs/dbraw/zinc/15/93/54/387159354.db2.gz BJBOCVCQPUMTSO-UHFFFAOYSA-N 1 2 221.304 2.008 20 0 BEADLO CCc1nc(C[N@H+]2CCCC3(CC3)C2)no1 ZINC000186976602 387159359 /nfs/dbraw/zinc/15/93/59/387159359.db2.gz BJBOCVCQPUMTSO-UHFFFAOYSA-N 1 2 221.304 2.008 20 0 BEADLO CC[C@H](F)C[N@@H+]1CCOC[C@@H]1CC(F)F ZINC000353289344 387174505 /nfs/dbraw/zinc/17/45/05/387174505.db2.gz UCACLARGKDWXCB-IUCAKERBSA-N 1 2 225.254 2.091 20 0 BEADLO CC[C@H](F)C[N@H+]1CCOC[C@@H]1CC(F)F ZINC000353289344 387174510 /nfs/dbraw/zinc/17/45/10/387174510.db2.gz UCACLARGKDWXCB-IUCAKERBSA-N 1 2 225.254 2.091 20 0 BEADLO CCc1ccc(C[N@@H+]2C[C@H](C)OC[C@@H]2C)cn1 ZINC000336346832 387176474 /nfs/dbraw/zinc/17/64/74/387176474.db2.gz YLLGXNOHGQLVJZ-RYUDHWBXSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1ccc(C[N@H+]2C[C@H](C)OC[C@@H]2C)cn1 ZINC000336346832 387176478 /nfs/dbraw/zinc/17/64/78/387176478.db2.gz YLLGXNOHGQLVJZ-RYUDHWBXSA-N 1 2 234.343 2.253 20 0 BEADLO CCN(C(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21)C1CC1 ZINC000334074424 387180887 /nfs/dbraw/zinc/18/08/87/387180887.db2.gz JFUIOKVDBAXAQF-ONGXEEELSA-N 1 2 248.330 2.083 20 0 BEADLO CO[C@@H](C)C[N@H+](C)[C@H](C)c1nc(C(C)C)no1 ZINC000353318712 387181507 /nfs/dbraw/zinc/18/15/07/387181507.db2.gz UDJWISYURDWPRJ-VHSXEESVSA-N 1 2 241.335 2.221 20 0 BEADLO CO[C@@H](C)C[N@@H+](C)[C@H](C)c1nc(C(C)C)no1 ZINC000353318712 387181510 /nfs/dbraw/zinc/18/15/10/387181510.db2.gz UDJWISYURDWPRJ-VHSXEESVSA-N 1 2 241.335 2.221 20 0 BEADLO CN(CCC(C)(C)C)C(=O)CCn1cc[nH+]c1 ZINC000648542996 387183496 /nfs/dbraw/zinc/18/34/96/387183496.db2.gz VHUQZYYGHOAOHE-UHFFFAOYSA-N 1 2 237.347 2.168 20 0 BEADLO CCc1cccc(NC(=O)NCc2[nH]cc[nH+]2)c1 ZINC000119455327 387135131 /nfs/dbraw/zinc/13/51/31/387135131.db2.gz LTFKJJOBABCMGK-UHFFFAOYSA-N 1 2 244.298 2.294 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCO[C@@H]2CCC[C@@H]21 ZINC000336378397 387208945 /nfs/dbraw/zinc/20/89/45/387208945.db2.gz CNLIFWGEEYGLRL-UONOGXRCSA-N 1 2 249.358 2.217 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCO[C@@H]2CCC[C@@H]21 ZINC000336378397 387208949 /nfs/dbraw/zinc/20/89/49/387208949.db2.gz CNLIFWGEEYGLRL-UONOGXRCSA-N 1 2 249.358 2.217 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cc[nH]n2)ccc1F ZINC000353514642 387220196 /nfs/dbraw/zinc/22/01/96/387220196.db2.gz COXPNUCZYAUNDM-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cc[nH]n2)ccc1F ZINC000353514642 387220202 /nfs/dbraw/zinc/22/02/02/387220202.db2.gz COXPNUCZYAUNDM-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO COCc1cccc(C[N@H+](C)Cc2cc[nH]n2)c1 ZINC000353532590 387224236 /nfs/dbraw/zinc/22/42/36/387224236.db2.gz PZKVANQKYOGYMX-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO COCc1cccc(C[N@@H+](C)Cc2cc[nH]n2)c1 ZINC000353532590 387224242 /nfs/dbraw/zinc/22/42/42/387224242.db2.gz PZKVANQKYOGYMX-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO c1cc(C[N@@H+]2Cc3ccccc3C3(CC3)C2)n[nH]1 ZINC000187677160 387224332 /nfs/dbraw/zinc/22/43/32/387224332.db2.gz WMAYYBNGZNCTDL-UHFFFAOYSA-N 1 2 239.322 2.457 20 0 BEADLO c1cc(C[N@H+]2Cc3ccccc3C3(CC3)C2)n[nH]1 ZINC000187677160 387224336 /nfs/dbraw/zinc/22/43/36/387224336.db2.gz WMAYYBNGZNCTDL-UHFFFAOYSA-N 1 2 239.322 2.457 20 0 BEADLO CC(=O)c1cccc(NCc2[nH+]ccn2C)c1 ZINC000096969780 387233489 /nfs/dbraw/zinc/23/34/89/387233489.db2.gz GXFRCOZNJXMIJK-UHFFFAOYSA-N 1 2 229.283 2.235 20 0 BEADLO C[C@H]1CCCC[C@@]1(C)NC(=O)Cc1c[nH+]cn1C ZINC000572095630 387234162 /nfs/dbraw/zinc/23/41/62/387234162.db2.gz KSKPVUMLTIUOFR-SMDDNHRTSA-N 1 2 249.358 2.048 20 0 BEADLO Cc1ccc(NC(=O)C(C)(C)c2c[nH+]c[nH]2)nc1 ZINC000336405021 387234567 /nfs/dbraw/zinc/23/45/67/387234567.db2.gz GUBNGWXDMBESGF-UHFFFAOYSA-N 1 2 244.298 2.029 20 0 BEADLO Cc1ccc(NC(=O)C(C)(C)c2c[nH]c[nH+]2)nc1 ZINC000336405021 387234573 /nfs/dbraw/zinc/23/45/73/387234573.db2.gz GUBNGWXDMBESGF-UHFFFAOYSA-N 1 2 244.298 2.029 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC=C(F)C2)nc1 ZINC000336420911 387251215 /nfs/dbraw/zinc/25/12/15/387251215.db2.gz BJHUVMHNTPCXNE-UHFFFAOYSA-N 1 2 206.264 2.449 20 0 BEADLO Cc1ccc(C[N@H+]2CCC=C(F)C2)nc1 ZINC000336420911 387251218 /nfs/dbraw/zinc/25/12/18/387251218.db2.gz BJHUVMHNTPCXNE-UHFFFAOYSA-N 1 2 206.264 2.449 20 0 BEADLO COC(=O)c1ccc(C[N@H+](C)Cc2ccc[nH]2)o1 ZINC000354033220 387317568 /nfs/dbraw/zinc/31/75/68/387317568.db2.gz JIYYPSUIKPPAOO-UHFFFAOYSA-N 1 2 248.282 2.026 20 0 BEADLO COC(=O)c1ccc(C[N@@H+](C)Cc2ccc[nH]2)o1 ZINC000354033220 387317571 /nfs/dbraw/zinc/31/75/71/387317571.db2.gz JIYYPSUIKPPAOO-UHFFFAOYSA-N 1 2 248.282 2.026 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C[C@@H](C)SC ZINC000161821567 387271404 /nfs/dbraw/zinc/27/14/04/387271404.db2.gz OIJWPISVQVAWLT-MRVPVSSYSA-N 1 2 240.328 2.170 20 0 BEADLO CCC[C@H]1C[C@H]1C(=O)N(C)CCCn1cc[nH+]c1 ZINC000360375497 387272535 /nfs/dbraw/zinc/27/25/35/387272535.db2.gz KIALSBCOLSEZFK-QWHCGFSZSA-N 1 2 249.358 2.168 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)nc1 ZINC000336445834 387272545 /nfs/dbraw/zinc/27/25/45/387272545.db2.gz MFBCHSISDHIWIV-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)nc1 ZINC000336445834 387272547 /nfs/dbraw/zinc/27/25/47/387272547.db2.gz MFBCHSISDHIWIV-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO CCC[C@H]1C[C@@H]1C(=O)N(C)CCCn1cc[nH+]c1 ZINC000360375498 387273665 /nfs/dbraw/zinc/27/36/65/387273665.db2.gz KIALSBCOLSEZFK-STQMWFEESA-N 1 2 249.358 2.168 20 0 BEADLO CC[C@@H]([NH2+][C@@H]1C[C@H]1c1ccc(C)cc1)C(=O)OC ZINC000572243737 387276688 /nfs/dbraw/zinc/27/66/88/387276688.db2.gz IAHZWIVXVRXNRL-BFHYXJOUSA-N 1 2 247.338 2.392 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2ccc(C)c(C)c2)[nH]1 ZINC000353805985 387277163 /nfs/dbraw/zinc/27/71/63/387277163.db2.gz PBRLIKUGAJVPER-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2ccc(C)c(C)c2)[nH]1 ZINC000353805985 387277168 /nfs/dbraw/zinc/27/71/68/387277168.db2.gz PBRLIKUGAJVPER-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO COC(=O)[C@@H]([NH2+]CCCCF)c1ccccc1 ZINC000285774813 387286039 /nfs/dbraw/zinc/28/60/39/387286039.db2.gz WZIFADUBQFOBTI-LBPRGKRZSA-N 1 2 239.290 2.240 20 0 BEADLO Cc1nc(N2CCOCC3(CCCC3)C2)cc[nH+]1 ZINC000372328755 387290580 /nfs/dbraw/zinc/29/05/80/387290580.db2.gz CTJBCXCVOPSPOA-UHFFFAOYSA-N 1 2 247.342 2.182 20 0 BEADLO Cc1ncncc1[C@@H](C)[NH2+]CC(C)(F)F ZINC000514798852 387294499 /nfs/dbraw/zinc/29/44/99/387294499.db2.gz PXHVSZXDBYLRLW-SSDOTTSWSA-N 1 2 215.247 2.091 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)[C@H]2C[C@@H]2C2CC2)[nH+]1 ZINC000572296228 387318530 /nfs/dbraw/zinc/31/85/30/387318530.db2.gz UQSUWJFDRYOQBK-MNOVXSKESA-N 1 2 247.342 2.116 20 0 BEADLO Cc1ccnc(C[N@H+]2CCS[C@H](C)[C@@H]2C)n1 ZINC000336470799 387299816 /nfs/dbraw/zinc/29/98/16/387299816.db2.gz JPOQNRBJHMESHO-WDEREUQCSA-N 1 2 237.372 2.111 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCS[C@H](C)[C@@H]2C)n1 ZINC000336470799 387299821 /nfs/dbraw/zinc/29/98/21/387299821.db2.gz JPOQNRBJHMESHO-WDEREUQCSA-N 1 2 237.372 2.111 20 0 BEADLO CC1(C)CCC[N@H+](Cc2csnn2)C1 ZINC000121146562 387304116 /nfs/dbraw/zinc/30/41/16/387304116.db2.gz MERXYDQAYRPHAW-UHFFFAOYSA-N 1 2 211.334 2.160 20 0 BEADLO CC1(C)CCC[N@@H+](Cc2csnn2)C1 ZINC000121146562 387304122 /nfs/dbraw/zinc/30/41/22/387304122.db2.gz MERXYDQAYRPHAW-UHFFFAOYSA-N 1 2 211.334 2.160 20 0 BEADLO CCc1nc(C[N@@H+]2CCCCC[C@H]2C)no1 ZINC000336550363 387370361 /nfs/dbraw/zinc/37/03/61/387370361.db2.gz QWXLZRILUGAEBY-SNVBAGLBSA-N 1 2 223.320 2.397 20 0 BEADLO CCc1nc(C[N@H+]2CCCCC[C@H]2C)no1 ZINC000336550363 387370366 /nfs/dbraw/zinc/37/03/66/387370366.db2.gz QWXLZRILUGAEBY-SNVBAGLBSA-N 1 2 223.320 2.397 20 0 BEADLO CCc1nc(C[N@@H+]2CCCCC[C@@H]2C)no1 ZINC000336550362 387370943 /nfs/dbraw/zinc/37/09/43/387370943.db2.gz QWXLZRILUGAEBY-JTQLQIEISA-N 1 2 223.320 2.397 20 0 BEADLO CCc1nc(C[N@H+]2CCCCC[C@@H]2C)no1 ZINC000336550362 387370949 /nfs/dbraw/zinc/37/09/49/387370949.db2.gz QWXLZRILUGAEBY-JTQLQIEISA-N 1 2 223.320 2.397 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H]1C[C@@H](c2ccccc2)[C@H]1C ZINC000373491668 387375857 /nfs/dbraw/zinc/37/58/57/387375857.db2.gz XBLAYPWFCOLABJ-HBJVGIJOSA-N 1 2 247.338 2.330 20 0 BEADLO Cc1cc(NC[C@H](O)C2CCC2)nc(C(C)C)[nH+]1 ZINC000315476727 387376163 /nfs/dbraw/zinc/37/61/63/387376163.db2.gz DBKXPKLKWKZGJA-LBPRGKRZSA-N 1 2 249.358 2.481 20 0 BEADLO c1snnc1C[N@@H+]1CCCC2(CCC2)C1 ZINC000373497545 387376552 /nfs/dbraw/zinc/37/65/52/387376552.db2.gz UKZYHSLQWSKEFZ-UHFFFAOYSA-N 1 2 223.345 2.304 20 0 BEADLO c1snnc1C[N@H+]1CCCC2(CCC2)C1 ZINC000373497545 387376558 /nfs/dbraw/zinc/37/65/58/387376558.db2.gz UKZYHSLQWSKEFZ-UHFFFAOYSA-N 1 2 223.345 2.304 20 0 BEADLO CC(C)[N@H+](Cc1[nH]nc2ccccc21)C1COC1 ZINC000648606324 387380342 /nfs/dbraw/zinc/38/03/42/387380342.db2.gz UPTRKXJRKIIEGC-UHFFFAOYSA-N 1 2 245.326 2.172 20 0 BEADLO CC(C)[N@@H+](Cc1[nH]nc2ccccc21)C1COC1 ZINC000648606324 387380345 /nfs/dbraw/zinc/38/03/45/387380345.db2.gz UPTRKXJRKIIEGC-UHFFFAOYSA-N 1 2 245.326 2.172 20 0 BEADLO CC(C)[N@H+](Cc1n[nH]c2ccccc21)C1COC1 ZINC000648606324 387380348 /nfs/dbraw/zinc/38/03/48/387380348.db2.gz UPTRKXJRKIIEGC-UHFFFAOYSA-N 1 2 245.326 2.172 20 0 BEADLO CC(C)[N@@H+](Cc1n[nH]c2ccccc21)C1COC1 ZINC000648606324 387380352 /nfs/dbraw/zinc/38/03/52/387380352.db2.gz UPTRKXJRKIIEGC-UHFFFAOYSA-N 1 2 245.326 2.172 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCS[C@H](C)C1 ZINC000515021680 387324126 /nfs/dbraw/zinc/32/41/26/387324126.db2.gz IJMCVMTXVTYWJJ-SECBINFHSA-N 1 2 223.345 2.035 20 0 BEADLO Cc1cc(C)c(NC(=O)c2cncnc2)c(C)[nH+]1 ZINC000354480777 387383096 /nfs/dbraw/zinc/38/30/96/387383096.db2.gz XBXLADVPJJHTMK-UHFFFAOYSA-N 1 2 242.282 2.049 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CCOC[C@H]1CC1CCC1 ZINC000354734600 387424126 /nfs/dbraw/zinc/42/41/26/387424126.db2.gz QYYJAYDAKJBRDW-CYBMUJFWSA-N 1 2 249.358 2.109 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CCOC[C@H]1CC1CCC1 ZINC000354734600 387424131 /nfs/dbraw/zinc/42/41/31/387424131.db2.gz QYYJAYDAKJBRDW-CYBMUJFWSA-N 1 2 249.358 2.109 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCOC[C@H]1CC1CCC1 ZINC000354734600 387424135 /nfs/dbraw/zinc/42/41/35/387424135.db2.gz QYYJAYDAKJBRDW-CYBMUJFWSA-N 1 2 249.358 2.109 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCOC[C@H]1CC1CCC1 ZINC000354734600 387424140 /nfs/dbraw/zinc/42/41/40/387424140.db2.gz QYYJAYDAKJBRDW-CYBMUJFWSA-N 1 2 249.358 2.109 20 0 BEADLO CCC[C@H]1C[C@@H]1c1nc(Cc2c[nH+]cn2C)no1 ZINC000361260860 387426255 /nfs/dbraw/zinc/42/62/55/387426255.db2.gz HTEJIKGBASUNOL-ONGXEEELSA-N 1 2 246.314 2.298 20 0 BEADLO c1ncc(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)[nH]1 ZINC000374259118 387435194 /nfs/dbraw/zinc/43/51/94/387435194.db2.gz NOEOVISMDCLATQ-AWEZNQCLSA-N 1 2 243.310 2.063 20 0 BEADLO c1ncc(C[N@H+]2CC[C@H](Oc3ccccc3)C2)[nH]1 ZINC000374259118 387435195 /nfs/dbraw/zinc/43/51/95/387435195.db2.gz NOEOVISMDCLATQ-AWEZNQCLSA-N 1 2 243.310 2.063 20 0 BEADLO Fc1ccc(F)c2c1CC[C@@H]2[NH2+]Cc1cc[nH]n1 ZINC000336603053 387447528 /nfs/dbraw/zinc/44/75/28/387447528.db2.gz PLSVGBKIVGIDAK-LBPRGKRZSA-N 1 2 249.264 2.465 20 0 BEADLO CCc1cccc(CN2CCn3cc[nH+]c3C2)c1 ZINC000336569320 387392910 /nfs/dbraw/zinc/39/29/10/387392910.db2.gz NXFXNEWQQXWWBS-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@@H](C3CC3)C2)nc1 ZINC000336571758 387395407 /nfs/dbraw/zinc/39/54/07/387395407.db2.gz XRCSVZKIQMLKQB-CQSZACIVSA-N 1 2 232.327 2.001 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@@H](C3CC3)C2)nc1 ZINC000336571758 387395410 /nfs/dbraw/zinc/39/54/10/387395410.db2.gz XRCSVZKIQMLKQB-CQSZACIVSA-N 1 2 232.327 2.001 20 0 BEADLO CN(Cc1cn2c([nH+]1)CCCC2)Cc1ccco1 ZINC000373881642 387401539 /nfs/dbraw/zinc/40/15/39/387401539.db2.gz LHXXBIHXURAVPQ-UHFFFAOYSA-N 1 2 245.326 2.444 20 0 BEADLO Cc1ccnc(C[NH2+][C@@H](C)c2ccccn2)n1 ZINC000361147588 387405990 /nfs/dbraw/zinc/40/59/90/387405990.db2.gz ZIRKPTCNTAYTEO-NSHDSACASA-N 1 2 228.299 2.031 20 0 BEADLO Cc1cc(NC(=O)N2CC[C@@H](C(C)C)C2)cc[nH+]1 ZINC000336587359 387411720 /nfs/dbraw/zinc/41/17/20/387411720.db2.gz AHESRZVEEMKEGD-GFCCVEGCSA-N 1 2 247.342 2.322 20 0 BEADLO Cc1ccc(NC(=O)NCc2[nH+]ccn2C)cc1 ZINC000336588258 387414988 /nfs/dbraw/zinc/41/49/88/387414988.db2.gz QSZLRHSDPDUWLP-UHFFFAOYSA-N 1 2 244.298 2.050 20 0 BEADLO FCCC[N@@H+]1CCOC[C@@H]1c1ccco1 ZINC000361247054 387421404 /nfs/dbraw/zinc/42/14/04/387421404.db2.gz UNNRWJWOGSNOGW-SNVBAGLBSA-N 1 2 213.252 2.013 20 0 BEADLO FCCC[N@H+]1CCOC[C@@H]1c1ccco1 ZINC000361247054 387421409 /nfs/dbraw/zinc/42/14/09/387421409.db2.gz UNNRWJWOGSNOGW-SNVBAGLBSA-N 1 2 213.252 2.013 20 0 BEADLO Nc1cc(COCc2ccccc2)cc[nH+]1 ZINC000052734192 387493983 /nfs/dbraw/zinc/49/39/83/387493983.db2.gz RQXMSUQXAANUAV-UHFFFAOYSA-N 1 2 214.268 2.381 20 0 BEADLO CC(C)c1nc(N2CC[C@@H]3OCC[C@@H]3C2)cc[nH+]1 ZINC000516460394 387512826 /nfs/dbraw/zinc/51/28/26/387512826.db2.gz OKXJPJBSUYNSLJ-NEPJUHHUSA-N 1 2 247.342 2.215 20 0 BEADLO COC[C@H]1CCCCN(c2cc[nH+]c(C)n2)C1 ZINC000375142469 387513863 /nfs/dbraw/zinc/51/38/63/387513863.db2.gz OAFIGVZKOMPILX-LBPRGKRZSA-N 1 2 235.331 2.038 20 0 BEADLO CCOc1cccc(C[N@@H+]2CC[C@@](C)(F)C2)n1 ZINC000355351496 387523635 /nfs/dbraw/zinc/52/36/35/387523635.db2.gz FKUDLKZPHGVUPE-CYBMUJFWSA-N 1 2 238.306 2.414 20 0 BEADLO CCOc1cccc(C[N@H+]2CC[C@@](C)(F)C2)n1 ZINC000355351496 387523640 /nfs/dbraw/zinc/52/36/40/387523640.db2.gz FKUDLKZPHGVUPE-CYBMUJFWSA-N 1 2 238.306 2.414 20 0 BEADLO Cc1ccc(C(C)(C)[NH2+]Cc2ncccn2)cn1 ZINC000361763205 387531155 /nfs/dbraw/zinc/53/11/55/387531155.db2.gz DIZBROJMIDGDPX-UHFFFAOYSA-N 1 2 242.326 2.205 20 0 BEADLO CCC[C@H]([NH2+]Cc1cccc(C)c1)C(=O)OC ZINC000361798960 387535102 /nfs/dbraw/zinc/53/51/02/387535102.db2.gz NYPVCUIWRNKEON-ZDUSSCGKSA-N 1 2 235.327 2.426 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H](C)C(F)(F)F ZINC000361795892 387536073 /nfs/dbraw/zinc/53/60/73/387536073.db2.gz MJBIMBDSYQVMRM-SSDOTTSWSA-N 1 2 246.232 2.203 20 0 BEADLO Cc1ncc(C[N@@H+](C)CC2(F)CC2)s1 ZINC000527218753 387539324 /nfs/dbraw/zinc/53/93/24/387539324.db2.gz KLCNJYRQLXIKST-UHFFFAOYSA-N 1 2 214.309 2.385 20 0 BEADLO Cc1ncc(C[N@H+](C)CC2(F)CC2)s1 ZINC000527218753 387539329 /nfs/dbraw/zinc/53/93/29/387539329.db2.gz KLCNJYRQLXIKST-UHFFFAOYSA-N 1 2 214.309 2.385 20 0 BEADLO CCc1ccc(C[NH2+][C@@H](C)c2ccon2)cn1 ZINC000352736344 387464172 /nfs/dbraw/zinc/46/41/72/387464172.db2.gz GZAXEEBPELCJGT-JTQLQIEISA-N 1 2 231.299 2.483 20 0 BEADLO Cn1ncc2c1nc[nH+]c2NC12CCC(CC1)C2 ZINC000374597217 387472310 /nfs/dbraw/zinc/47/23/10/387472310.db2.gz TWHRELKRMOILKQ-UHFFFAOYSA-N 1 2 243.314 2.108 20 0 BEADLO Cc1cn2c([nH+]1)CN(C(=O)C1(C)CCCC1)CC2 ZINC000374648072 387476355 /nfs/dbraw/zinc/47/63/55/387476355.db2.gz PHCPGGGJMGYTLS-UHFFFAOYSA-N 1 2 247.342 2.114 20 0 BEADLO CCc1ccc(C[N@@H+]2CCOCC23CC3)o1 ZINC000336629640 387483187 /nfs/dbraw/zinc/48/31/87/387483187.db2.gz ORJJRHBUMYKBAZ-UHFFFAOYSA-N 1 2 221.300 2.207 20 0 BEADLO CCc1ccc(C[N@H+]2CCOCC23CC3)o1 ZINC000336629640 387483190 /nfs/dbraw/zinc/48/31/90/387483190.db2.gz ORJJRHBUMYKBAZ-UHFFFAOYSA-N 1 2 221.300 2.207 20 0 BEADLO COC(=O)C[N@H+](Cc1sccc1C)C1CC1 ZINC000355138973 387485239 /nfs/dbraw/zinc/48/52/39/387485239.db2.gz TWNCHZQXAODJRX-UHFFFAOYSA-N 1 2 239.340 2.194 20 0 BEADLO COC(=O)C[N@@H+](Cc1sccc1C)C1CC1 ZINC000355138973 387485244 /nfs/dbraw/zinc/48/52/44/387485244.db2.gz TWNCHZQXAODJRX-UHFFFAOYSA-N 1 2 239.340 2.194 20 0 BEADLO CC(C)CCCNc1ccc(CO)c[nH+]1 ZINC000291596626 387581571 /nfs/dbraw/zinc/58/15/71/387581571.db2.gz QDLFZOMPDJVBSL-UHFFFAOYSA-N 1 2 208.305 2.422 20 0 BEADLO CCc1nn(C)cc1C[NH2+][C@H](CC)C(F)F ZINC000648619225 387583311 /nfs/dbraw/zinc/58/33/11/387583311.db2.gz FKBCRFUPEPIBIY-SNVBAGLBSA-N 1 2 231.290 2.116 20 0 BEADLO Cc1cc(NC(=O)N2CCC[C@@H]2C2CC2)cc[nH+]1 ZINC000367216223 387592677 /nfs/dbraw/zinc/59/26/77/387592677.db2.gz SWPOEICRBKTVPD-CYBMUJFWSA-N 1 2 245.326 2.218 20 0 BEADLO CCCc1nc(C[N@H+]2CC(C)=C[C@H](C)C2)no1 ZINC000430267116 387603074 /nfs/dbraw/zinc/60/30/74/387603074.db2.gz JAUNMXKKFJINGJ-JTQLQIEISA-N 1 2 235.331 2.420 20 0 BEADLO CCCc1nc(C[N@@H+]2CC(C)=C[C@H](C)C2)no1 ZINC000430267116 387603079 /nfs/dbraw/zinc/60/30/79/387603079.db2.gz JAUNMXKKFJINGJ-JTQLQIEISA-N 1 2 235.331 2.420 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2ccnc(C)c2)s1 ZINC000527540424 387610363 /nfs/dbraw/zinc/61/03/63/387610363.db2.gz YILARFOZUPTQMW-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO CCOc1cccc(COc2cc[nH+]cc2)n1 ZINC000356097444 387615638 /nfs/dbraw/zinc/61/56/38/387615638.db2.gz OTWICEHHCFVEOP-UHFFFAOYSA-N 1 2 230.267 2.454 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@@H](C3CC3)C2)o1 ZINC000362516832 387622536 /nfs/dbraw/zinc/62/25/36/387622536.db2.gz SZZBHTCKQJODAW-CQSZACIVSA-N 1 2 235.327 2.453 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@@H](C3CC3)C2)o1 ZINC000362516832 387622542 /nfs/dbraw/zinc/62/25/42/387622542.db2.gz SZZBHTCKQJODAW-CQSZACIVSA-N 1 2 235.327 2.453 20 0 BEADLO Fc1ccc(C2([NH2+]Cc3ncccn3)CC2)cc1 ZINC000361860963 387546816 /nfs/dbraw/zinc/54/68/16/387546816.db2.gz SSSWVNFZBOTYEE-UHFFFAOYSA-N 1 2 243.285 2.395 20 0 BEADLO CC[C@H](NC(=O)C[C@@H]1C[C@H]1C)c1[nH]cc[nH+]1 ZINC000355759698 387577083 /nfs/dbraw/zinc/57/70/83/387577083.db2.gz WEQPKJBZMCVXFG-UTLUCORTSA-N 1 2 221.304 2.023 20 0 BEADLO C[C@H](CCC1CC1)NC(=O)CCc1[nH]cc[nH+]1 ZINC000356238400 387631384 /nfs/dbraw/zinc/63/13/84/387631384.db2.gz ZVOIRAJBIIRMAR-SNVBAGLBSA-N 1 2 235.331 2.037 20 0 BEADLO Fc1ccc(C[NH2+][C@H]2CCCc3cn[nH]c32)nc1 ZINC000527604715 387637261 /nfs/dbraw/zinc/63/72/61/387637261.db2.gz SGXCXEUYMOQPDP-LBPRGKRZSA-N 1 2 246.289 2.111 20 0 BEADLO Fc1ccc(C[NH2+][C@H]2CCCc3c[nH]nc32)nc1 ZINC000527604715 387637262 /nfs/dbraw/zinc/63/72/62/387637262.db2.gz SGXCXEUYMOQPDP-LBPRGKRZSA-N 1 2 246.289 2.111 20 0 BEADLO Clc1cncc(N2CCC[C@H]2c2[nH]cc[nH+]2)n1 ZINC000377144916 387695267 /nfs/dbraw/zinc/69/52/67/387695267.db2.gz MKLSVDHOAOJOED-QMMMGPOBSA-N 1 2 249.705 2.195 20 0 BEADLO Cc1nc(N2CCCCC[C@H]2C)nc(N(C)C)[nH+]1 ZINC000362697680 387649983 /nfs/dbraw/zinc/64/99/83/387649983.db2.gz LFGAGYOFFJXFTI-SNVBAGLBSA-N 1 2 249.362 2.015 20 0 BEADLO Cc1nc(N(C)C)nc(N2CCCCC[C@H]2C)[nH+]1 ZINC000362697680 387649987 /nfs/dbraw/zinc/64/99/87/387649987.db2.gz LFGAGYOFFJXFTI-SNVBAGLBSA-N 1 2 249.362 2.015 20 0 BEADLO CCOC(=O)C[N@H+](CC(C)C)C[C@@H](F)CC ZINC000440705166 387676014 /nfs/dbraw/zinc/67/60/14/387676014.db2.gz OYCOJDLTBLIXJJ-NSHDSACASA-N 1 2 233.327 2.256 20 0 BEADLO CCOC(=O)C[N@@H+](CC(C)C)C[C@@H](F)CC ZINC000440705166 387676017 /nfs/dbraw/zinc/67/60/17/387676017.db2.gz OYCOJDLTBLIXJJ-NSHDSACASA-N 1 2 233.327 2.256 20 0 BEADLO CC[C@@H](Cc1cccs1)[NH2+]CC(F)(F)CN ZINC000643519959 387676291 /nfs/dbraw/zinc/67/62/91/387676291.db2.gz NUYXXVSOZOAHDJ-VIFPVBQESA-N 1 2 248.342 2.253 20 0 BEADLO CC[N@H+](C)Cc1ncc(Br)s1 ZINC000306173762 387676539 /nfs/dbraw/zinc/67/65/39/387676539.db2.gz BSDCAKOHMQKNII-UHFFFAOYSA-N 1 2 235.150 2.357 20 0 BEADLO CC[N@@H+](C)Cc1ncc(Br)s1 ZINC000306173762 387676542 /nfs/dbraw/zinc/67/65/42/387676542.db2.gz BSDCAKOHMQKNII-UHFFFAOYSA-N 1 2 235.150 2.357 20 0 BEADLO CC(C)c1nc(N[C@H]2CCO[C@@H]2C2CC2)cc[nH+]1 ZINC000363163206 387692735 /nfs/dbraw/zinc/69/27/35/387692735.db2.gz UJXCVMWNNPICLM-WCQYABFASA-N 1 2 247.342 2.001 20 0 BEADLO CC[C@H](F)C[N@@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000440776300 387694090 /nfs/dbraw/zinc/69/40/90/387694090.db2.gz BZUPFDGQGCTMGA-VHSXEESVSA-N 1 2 211.284 2.295 20 0 BEADLO CC[C@H](F)C[N@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000440776300 387694094 /nfs/dbraw/zinc/69/40/94/387694094.db2.gz BZUPFDGQGCTMGA-VHSXEESVSA-N 1 2 211.284 2.295 20 0 BEADLO CC[C@@H]([NH2+]C[C@H]1C[C@@H]1c1ccccc1)C(=O)OC ZINC000192848254 387747335 /nfs/dbraw/zinc/74/73/35/387747335.db2.gz PDUFFQNDGXFHSZ-MGPQQGTHSA-N 1 2 247.338 2.331 20 0 BEADLO CC[C@H](F)C[N@@H+]1C[C@@H](C)N(CC)C[C@@H]1C ZINC000440790286 387697994 /nfs/dbraw/zinc/69/79/94/387697994.db2.gz KKWDGQLPJRDZAQ-WOPDTQHZSA-N 1 2 216.344 2.149 20 0 BEADLO CC[C@H](F)C[N@H+]1C[C@@H](C)N(CC)C[C@@H]1C ZINC000440790286 387697997 /nfs/dbraw/zinc/69/79/97/387697997.db2.gz KKWDGQLPJRDZAQ-WOPDTQHZSA-N 1 2 216.344 2.149 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCO[C@@H](c2ccco2)C1 ZINC000440790534 387700198 /nfs/dbraw/zinc/70/01/98/387700198.db2.gz LDHARWLJZBEWMY-ZYHUDNBSSA-N 1 2 227.279 2.401 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCO[C@@H](c2ccco2)C1 ZINC000440790534 387700201 /nfs/dbraw/zinc/70/02/01/387700201.db2.gz LDHARWLJZBEWMY-ZYHUDNBSSA-N 1 2 227.279 2.401 20 0 BEADLO COCC[C@H]1CCCCN(c2cc[nH+]c(C)n2)C1 ZINC000377258532 387705346 /nfs/dbraw/zinc/70/53/46/387705346.db2.gz SFKRFIGSKMAISY-CYBMUJFWSA-N 1 2 249.358 2.428 20 0 BEADLO Cn1c2cc(F)ccc2[nH]c1=[NH+]CCCCF ZINC000431400943 387706898 /nfs/dbraw/zinc/70/68/98/387706898.db2.gz FIIMLEROMKOAGP-UHFFFAOYSA-N 1 2 239.269 2.296 20 0 BEADLO Cc1cnc(C[N@H+]2CCC(F)(F)C[C@H]2C)nc1 ZINC000528772880 387707543 /nfs/dbraw/zinc/70/75/43/387707543.db2.gz NKQWRCMVCWFUGB-SNVBAGLBSA-N 1 2 241.285 2.405 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC(F)(F)C[C@H]2C)nc1 ZINC000528772880 387707545 /nfs/dbraw/zinc/70/75/45/387707545.db2.gz NKQWRCMVCWFUGB-SNVBAGLBSA-N 1 2 241.285 2.405 20 0 BEADLO Cn1c(COc2cc[nH+]cc2)nnc1C1CCC1 ZINC000431479229 387709465 /nfs/dbraw/zinc/70/94/65/387709465.db2.gz VGVZHDQHDBJMPP-UHFFFAOYSA-N 1 2 244.298 2.057 20 0 BEADLO c1cc(OCCO[C@@H]2CCCCO2)cc[nH+]1 ZINC000431481120 387710118 /nfs/dbraw/zinc/71/01/18/387710118.db2.gz GVXSDYMRBNXLGF-GFCCVEGCSA-N 1 2 223.272 2.004 20 0 BEADLO OCc1ccc(COc2cc[nH+]cc2)cc1 ZINC000431481887 387710809 /nfs/dbraw/zinc/71/08/09/387710809.db2.gz JECXYBFGPGRRTR-UHFFFAOYSA-N 1 2 215.252 2.153 20 0 BEADLO c1cc(OCCCO[C@@H]2CCCCO2)cc[nH+]1 ZINC000431484286 387711023 /nfs/dbraw/zinc/71/10/23/387711023.db2.gz RHRLMIXFEQZUFN-CYBMUJFWSA-N 1 2 237.299 2.394 20 0 BEADLO COc1ccncc1COc1cc[nH+]cc1 ZINC000431506925 387714192 /nfs/dbraw/zinc/71/41/92/387714192.db2.gz QFBDLMXSESJMLO-UHFFFAOYSA-N 1 2 216.240 2.064 20 0 BEADLO O=C(OCC1CC1)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000377534353 387722796 /nfs/dbraw/zinc/72/27/96/387722796.db2.gz RXRORKJSDQQVBX-NSHDSACASA-N 1 2 249.314 2.136 20 0 BEADLO C[C@@H](CC(C)(C)C)C(=O)NCc1c[nH+]c[nH]1 ZINC000356835431 387730438 /nfs/dbraw/zinc/73/04/38/387730438.db2.gz UIQPJICFKUYUHA-VIFPVBQESA-N 1 2 223.320 2.098 20 0 BEADLO C[C@@H](CC(C)(C)C)C(=O)NCc1c[nH]c[nH+]1 ZINC000356835431 387730458 /nfs/dbraw/zinc/73/04/58/387730458.db2.gz UIQPJICFKUYUHA-VIFPVBQESA-N 1 2 223.320 2.098 20 0 BEADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1nccn1C ZINC000356882804 387738634 /nfs/dbraw/zinc/73/86/34/387738634.db2.gz VKRPSTHVOUKULP-LLVKDONJSA-N 1 2 244.342 2.228 20 0 BEADLO COc1ccc[nH+]c1N1C[C@@H](C)OC(C)(C)C1 ZINC000527867232 387739651 /nfs/dbraw/zinc/73/96/51/387739651.db2.gz RVJPKJRUUMMZOA-SNVBAGLBSA-N 1 2 236.315 2.094 20 0 BEADLO c1coc([C@@H]2CC[N@@H+](Cc3csnn3)C2)c1 ZINC000378345237 387779426 /nfs/dbraw/zinc/77/94/26/387779426.db2.gz IHPAUCKJMSORLE-SECBINFHSA-N 1 2 235.312 2.121 20 0 BEADLO c1coc([C@@H]2CC[N@H+](Cc3csnn3)C2)c1 ZINC000378345237 387779428 /nfs/dbraw/zinc/77/94/28/387779428.db2.gz IHPAUCKJMSORLE-SECBINFHSA-N 1 2 235.312 2.121 20 0 BEADLO COc1ccc[nH+]c1N1CC=C(C)CC1 ZINC000527937662 387779859 /nfs/dbraw/zinc/77/98/59/387779859.db2.gz COEWRZYNJKPBLE-UHFFFAOYSA-N 1 2 204.273 2.247 20 0 BEADLO CO[C@H]1CCN(c2[nH+]ccc3ccccc32)C1 ZINC000527917192 387788364 /nfs/dbraw/zinc/78/83/64/387788364.db2.gz WXXFVMWIKGAHEH-LBPRGKRZSA-N 1 2 228.295 2.460 20 0 BEADLO CCc1ccc([C@@H](C)[NH2+]Cc2cnn(CC)n2)o1 ZINC000527922024 387790490 /nfs/dbraw/zinc/79/04/90/387790490.db2.gz RNNGDNCVTRXIAX-SNVBAGLBSA-N 1 2 248.330 2.304 20 0 BEADLO COc1ccc[nH+]c1N(C)Cc1cnccc1C ZINC000527993855 387806449 /nfs/dbraw/zinc/80/64/49/387806449.db2.gz OXIORNSXQHDTKX-UHFFFAOYSA-N 1 2 243.310 2.430 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1CCOC[C@H]1C ZINC000528018737 387824881 /nfs/dbraw/zinc/82/48/81/387824881.db2.gz KJWGVVOXCMOTOB-MNOVXSKESA-N 1 2 236.315 2.175 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2ncccn2)o1 ZINC000054459370 387827001 /nfs/dbraw/zinc/82/70/01/387827001.db2.gz ORTGXDRDPWHVFF-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO COc1ccc[nH+]c1N1CCC[C@@]2(CCOC2)C1 ZINC000528030387 387833709 /nfs/dbraw/zinc/83/37/09/387833709.db2.gz MZNCSGQJDSXUCP-CQSZACIVSA-N 1 2 248.326 2.097 20 0 BEADLO c1ccc(NCC[C@H]2CCCOC2)[nH+]c1 ZINC000528071433 387843072 /nfs/dbraw/zinc/84/30/72/387843072.db2.gz JUILLRZZWHDIIK-LLVKDONJSA-N 1 2 206.289 2.310 20 0 BEADLO CC[C@H]1CCC[C@@H]1CNC(=O)CCc1[nH]cc[nH+]1 ZINC000452513077 387845309 /nfs/dbraw/zinc/84/53/09/387845309.db2.gz AAMOCHCYNYIBAP-NWDGAFQWSA-N 1 2 249.358 2.285 20 0 BEADLO CC[C@H](NC(=O)[C@H]1C[C@]1(C)CC)c1[nH]cc[nH+]1 ZINC000442814515 387846925 /nfs/dbraw/zinc/84/69/25/387846925.db2.gz VAEYBUFQMCZHEV-NRUUGDAUSA-N 1 2 235.331 2.413 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@@H]1CCC(C)(C)C1 ZINC000452569308 387859705 /nfs/dbraw/zinc/85/97/05/387859705.db2.gz FRXLYXYCMUHZJH-LLVKDONJSA-N 1 2 249.358 2.346 20 0 BEADLO COc1ccnc(C[NH2+]Cc2ccc(C)s2)n1 ZINC000424170210 387861717 /nfs/dbraw/zinc/86/17/17/387861717.db2.gz JPABOLSTACWNAH-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1C[C@@H](C)O[C@@H]1C ZINC000528034136 387817349 /nfs/dbraw/zinc/81/73/49/387817349.db2.gz GNZSPLCSUCCVMO-MXWKQRLJSA-N 1 2 236.315 2.316 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1C[C@@H](OC(C)C)C1 ZINC000528033296 387818041 /nfs/dbraw/zinc/81/80/41/387818041.db2.gz ZIJMMMAHSFOYTA-PHIMTYICSA-N 1 2 236.315 2.458 20 0 BEADLO C[C@@H]1CCC[C@H](C(=O)Nc2ccc(N)[nH+]c2)C1 ZINC000151669531 387875888 /nfs/dbraw/zinc/87/58/88/387875888.db2.gz WUSSOXLFDHCXPT-ZJUUUORDSA-N 1 2 233.315 2.429 20 0 BEADLO O=C(CCC1CCCC1)N1CCc2[nH]c[nH+]c2C1 ZINC000065164078 387876469 /nfs/dbraw/zinc/87/64/69/387876469.db2.gz IVLQATOPAFCDGH-UHFFFAOYSA-N 1 2 247.342 2.265 20 0 BEADLO O=C(CCC1CCCC1)N1CCc2[nH+]c[nH]c2C1 ZINC000065164078 387876481 /nfs/dbraw/zinc/87/64/81/387876481.db2.gz IVLQATOPAFCDGH-UHFFFAOYSA-N 1 2 247.342 2.265 20 0 BEADLO C[C@H]1CC[C@H](Nc2ncnc3c2C[N@H+](C)CC3)C1 ZINC000443989614 387880983 /nfs/dbraw/zinc/88/09/83/387880983.db2.gz PCVBFBUXUSFGRO-QWRGUYRKSA-N 1 2 246.358 2.065 20 0 BEADLO C[C@H]1CC[C@H](Nc2ncnc3c2C[N@@H+](C)CC3)C1 ZINC000443989614 387880987 /nfs/dbraw/zinc/88/09/87/387880987.db2.gz PCVBFBUXUSFGRO-QWRGUYRKSA-N 1 2 246.358 2.065 20 0 BEADLO C[C@@H]1CC[C@@H](Nc2ncnc3c2C[N@H+](C)CC3)C1 ZINC000443989612 387882112 /nfs/dbraw/zinc/88/21/12/387882112.db2.gz PCVBFBUXUSFGRO-GHMZBOCLSA-N 1 2 246.358 2.065 20 0 BEADLO C[C@@H]1CC[C@@H](Nc2ncnc3c2C[N@@H+](C)CC3)C1 ZINC000443989612 387882116 /nfs/dbraw/zinc/88/21/16/387882116.db2.gz PCVBFBUXUSFGRO-GHMZBOCLSA-N 1 2 246.358 2.065 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)C(C)(C)C1CCC1 ZINC000448711386 387911414 /nfs/dbraw/zinc/91/14/14/387911414.db2.gz XYTBMVJTOXSZOJ-LLVKDONJSA-N 1 2 249.358 2.214 20 0 BEADLO Cc1cn[nH]c1C[NH2+][C@@H]1C[C@]1(F)c1ccccc1 ZINC000424189455 387911995 /nfs/dbraw/zinc/91/19/95/387911995.db2.gz DQFXZSQAQMZLIN-KGLIPLIRSA-N 1 2 245.301 2.445 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@@H]1C[C@]1(F)c1ccccc1 ZINC000424189455 387911997 /nfs/dbraw/zinc/91/19/97/387911997.db2.gz DQFXZSQAQMZLIN-KGLIPLIRSA-N 1 2 245.301 2.445 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccn(C)n2)ccc1F ZINC000444727825 387916971 /nfs/dbraw/zinc/91/69/71/387916971.db2.gz DFBIBDYPXWBKDH-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccn(C)n2)ccc1F ZINC000444727825 387916973 /nfs/dbraw/zinc/91/69/73/387916973.db2.gz DFBIBDYPXWBKDH-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO c1nc2c(s1)C[N@H+](Cc1ccccn1)CC2 ZINC000438375052 387930899 /nfs/dbraw/zinc/93/08/99/387930899.db2.gz SPDQENUULDXRJA-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1nc2c(s1)C[N@@H+](Cc1ccccn1)CC2 ZINC000438375052 387930903 /nfs/dbraw/zinc/93/09/03/387930903.db2.gz SPDQENUULDXRJA-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO Cc1cc(C(=O)Nc2cccc3[nH+]ccn32)co1 ZINC000444742835 387920421 /nfs/dbraw/zinc/92/04/21/387920421.db2.gz GRJZJJBTDJZJTK-UHFFFAOYSA-N 1 2 241.250 2.488 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H](C)O[C@H](C)[C@H]2C)cs1 ZINC000438353052 387925201 /nfs/dbraw/zinc/92/52/01/387925201.db2.gz JEMVKWNHVXQHAP-IVZWLZJFSA-N 1 2 240.372 2.449 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H](C)O[C@H](C)[C@H]2C)cs1 ZINC000438353052 387925205 /nfs/dbraw/zinc/92/52/05/387925205.db2.gz JEMVKWNHVXQHAP-IVZWLZJFSA-N 1 2 240.372 2.449 20 0 BEADLO CCC[C@H](C)N(C)C(=O)[C@H]1CCn2cc[nH+]c2C1 ZINC000438578413 387945063 /nfs/dbraw/zinc/94/50/63/387945063.db2.gz WLZDZJAMRHMQSX-RYUDHWBXSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@H](COC)Nc1[nH+]c2ccccc2n1C ZINC000079745183 387959549 /nfs/dbraw/zinc/95/95/49/387959549.db2.gz BAZIKBRZVBDZQO-SNVBAGLBSA-N 1 2 233.315 2.410 20 0 BEADLO C[C@H](N[C@@H]1C[C@H](C)n2cc[nH+]c21)C(F)(F)F ZINC000424324605 387971714 /nfs/dbraw/zinc/97/17/14/387971714.db2.gz NDSFRHZLKQQPOE-BIIVOSGPSA-N 1 2 233.237 2.429 20 0 BEADLO C[C@@H](N[C@@H]1C[C@H](C)n2cc[nH+]c21)C(F)(F)F ZINC000424324611 387971947 /nfs/dbraw/zinc/97/19/47/387971947.db2.gz NDSFRHZLKQQPOE-XLPZGREQSA-N 1 2 233.237 2.429 20 0 BEADLO CC[C@H](C)[NH2+][C@@H](c1cn[nH]n1)c1ccc(F)cc1 ZINC000453056855 387974770 /nfs/dbraw/zinc/97/47/70/387974770.db2.gz LVRXTHCLZXFWMW-TVQRCGJNSA-N 1 2 248.305 2.421 20 0 BEADLO CC[C@H](C)[NH2+][C@@H](c1c[nH]nn1)c1ccc(F)cc1 ZINC000453056855 387974772 /nfs/dbraw/zinc/97/47/72/387974772.db2.gz LVRXTHCLZXFWMW-TVQRCGJNSA-N 1 2 248.305 2.421 20 0 BEADLO CC[N@H+](Cc1nc(CC(C)C)no1)C1CC1 ZINC000045771052 387993824 /nfs/dbraw/zinc/99/38/24/387993824.db2.gz USYJGOQUZCZOOS-UHFFFAOYSA-N 1 2 223.320 2.252 20 0 BEADLO CC[N@@H+](Cc1nc(CC(C)C)no1)C1CC1 ZINC000045771052 387993827 /nfs/dbraw/zinc/99/38/27/387993827.db2.gz USYJGOQUZCZOOS-UHFFFAOYSA-N 1 2 223.320 2.252 20 0 BEADLO CC[C@H](COC)Nc1ccc2c(c1)CC[NH2+]2 ZINC000423220817 388001922 /nfs/dbraw/zinc/00/19/22/388001922.db2.gz VVSLZYXIONNMQF-LLVKDONJSA-N 1 2 220.316 2.492 20 0 BEADLO CC[N@H+](Cc1noc(C(C)(C)C)n1)C1CC1 ZINC000046058631 388006802 /nfs/dbraw/zinc/00/68/02/388006802.db2.gz DEQGFBBFLZSTAU-UHFFFAOYSA-N 1 2 223.320 2.351 20 0 BEADLO CC[N@@H+](Cc1noc(C(C)(C)C)n1)C1CC1 ZINC000046058631 388006806 /nfs/dbraw/zinc/00/68/06/388006806.db2.gz DEQGFBBFLZSTAU-UHFFFAOYSA-N 1 2 223.320 2.351 20 0 BEADLO Cn1c[nH+]cc1Cn1ccc(-c2ccccc2)n1 ZINC000439553508 388008719 /nfs/dbraw/zinc/00/87/19/388008719.db2.gz UOWQUAOOXMLNNA-UHFFFAOYSA-N 1 2 238.294 2.332 20 0 BEADLO CC[C@H]([NH2+][C@H](C)c1ccnn1C)C(F)F ZINC000453243636 388013233 /nfs/dbraw/zinc/01/32/33/388013233.db2.gz JAKRNFNHDXCZCQ-SFYZADRCSA-N 1 2 217.263 2.114 20 0 BEADLO CCCC(CCC)C(=O)NCCc1[nH]cc[nH+]1 ZINC000159528838 388019924 /nfs/dbraw/zinc/01/99/24/388019924.db2.gz MONVFDLUDRFFMO-UHFFFAOYSA-N 1 2 237.347 2.285 20 0 BEADLO CC(C)c1nc(NC[C@H](O)C(C)C)cc[nH+]1 ZINC000156669088 388020037 /nfs/dbraw/zinc/02/00/37/388020037.db2.gz QWSVHJXSNNQPEU-JTQLQIEISA-N 1 2 223.320 2.029 20 0 BEADLO CO[C@@H]1C[C@@H](Nc2cc[nH+]c(C3CC3)n2)C1(C)C ZINC000440190213 388035964 /nfs/dbraw/zinc/03/59/64/388035964.db2.gz IYTWFYKVJIRPHH-GHMZBOCLSA-N 1 2 247.342 2.001 20 0 BEADLO CO[C@H]1C[C@H](Nc2cc[nH+]c(C(C)C)n2)C1(C)C ZINC000440190585 388036219 /nfs/dbraw/zinc/03/62/19/388036219.db2.gz SKVFJYLGCMZEPN-QWRGUYRKSA-N 1 2 249.358 2.247 20 0 BEADLO C[C@@H]1COCC[N@@H+]1CCc1c(F)cccc1F ZINC000645892892 388029628 /nfs/dbraw/zinc/02/96/28/388029628.db2.gz CNPURMGECDEXKU-SNVBAGLBSA-N 1 2 241.281 2.228 20 0 BEADLO C[C@@H]1COCC[N@H+]1CCc1c(F)cccc1F ZINC000645892892 388029630 /nfs/dbraw/zinc/02/96/30/388029630.db2.gz CNPURMGECDEXKU-SNVBAGLBSA-N 1 2 241.281 2.228 20 0 BEADLO O=C1N=NC([C@H]2CCC[N@H+](CC3=CCCC3)C2)O1 ZINC000645897193 388056286 /nfs/dbraw/zinc/05/62/86/388056286.db2.gz ZATRNIAMPOPMJH-NSHDSACASA-N 1 2 249.314 2.065 20 0 BEADLO O=C1N=NC([C@H]2CCC[N@@H+](CC3=CCCC3)C2)O1 ZINC000645897193 388056289 /nfs/dbraw/zinc/05/62/89/388056289.db2.gz ZATRNIAMPOPMJH-NSHDSACASA-N 1 2 249.314 2.065 20 0 BEADLO O=c1[nH]nc([C@H]2CCC[N@H+](CC3=CCCC3)C2)o1 ZINC000645897193 388056290 /nfs/dbraw/zinc/05/62/90/388056290.db2.gz ZATRNIAMPOPMJH-NSHDSACASA-N 1 2 249.314 2.065 20 0 BEADLO O=c1[nH]nc([C@H]2CCC[N@@H+](CC3=CCCC3)C2)o1 ZINC000645897193 388056295 /nfs/dbraw/zinc/05/62/95/388056295.db2.gz ZATRNIAMPOPMJH-NSHDSACASA-N 1 2 249.314 2.065 20 0 BEADLO CCSCC[N@@H+]1CCC[C@@H]1C(F)F ZINC000336660593 388093955 /nfs/dbraw/zinc/09/39/55/388093955.db2.gz VAYUZPXDXNBHBK-MRVPVSSYSA-N 1 2 209.305 2.469 20 0 BEADLO CCSCC[N@H+]1CCC[C@@H]1C(F)F ZINC000336660593 388093956 /nfs/dbraw/zinc/09/39/56/388093956.db2.gz VAYUZPXDXNBHBK-MRVPVSSYSA-N 1 2 209.305 2.469 20 0 BEADLO C[C@H]1CC=C(C(=O)NCCCn2cc[nH+]c2)CC1 ZINC000454170049 388103644 /nfs/dbraw/zinc/10/36/44/388103644.db2.gz XIEXWGMDBXXTNC-LBPRGKRZSA-N 1 2 247.342 2.136 20 0 BEADLO CC/C=C\C[NH2+][C@H](c1ncc[nH]1)c1cccnc1 ZINC000453322444 388046440 /nfs/dbraw/zinc/04/64/40/388046440.db2.gz PIWLHQODTZBDEU-SCOBNMCVSA-N 1 2 242.326 2.450 20 0 BEADLO CC(C)n1cc(C[N@H+](C(C)C)C2COC2)cn1 ZINC000449348045 388177509 /nfs/dbraw/zinc/17/75/09/388177509.db2.gz AMWZKXAVAQXMJL-UHFFFAOYSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)n1cc(C[N@@H+](C(C)C)C2COC2)cn1 ZINC000449348045 388177510 /nfs/dbraw/zinc/17/75/10/388177510.db2.gz AMWZKXAVAQXMJL-UHFFFAOYSA-N 1 2 237.347 2.073 20 0 BEADLO CC[C@H]([NH2+]Cc1ccncc1)C(F)F ZINC000449358118 388181752 /nfs/dbraw/zinc/18/17/52/388181752.db2.gz DWFQTZQSHQTSSM-VIFPVBQESA-N 1 2 200.232 2.215 20 0 BEADLO CC[C@@H]([NH2+]Cc1cnn(CC)c1)C(F)F ZINC000449364757 388183098 /nfs/dbraw/zinc/18/30/98/388183098.db2.gz SYPSXOVLNWUELA-SECBINFHSA-N 1 2 217.263 2.036 20 0 BEADLO COc1cccc(C[NH2+]C(CF)CF)c1 ZINC000449372086 388184753 /nfs/dbraw/zinc/18/47/53/388184753.db2.gz CEIDOJOJHDVJEX-UHFFFAOYSA-N 1 2 215.243 2.092 20 0 BEADLO CC(C)CCCC(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000448935442 388121375 /nfs/dbraw/zinc/12/13/75/388121375.db2.gz IIBLLXUWYGKLRG-UHFFFAOYSA-N 1 2 223.320 2.194 20 0 BEADLO CCOc1ccc(C[NH2+]C(CF)CF)cc1 ZINC000449374200 388186101 /nfs/dbraw/zinc/18/61/01/388186101.db2.gz XZSNNSSIAJBLLM-UHFFFAOYSA-N 1 2 229.270 2.483 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)C1=CC[C@@H](C)CC1 ZINC000454747765 388132435 /nfs/dbraw/zinc/13/24/35/388132435.db2.gz CJJCZFRWDYVHOR-NEPJUHHUSA-N 1 2 247.342 2.134 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2ccncc2F)CCO1 ZINC000449032398 388133475 /nfs/dbraw/zinc/13/34/75/388133475.db2.gz YHQXSMZFVPYNDI-LBPRGKRZSA-N 1 2 238.306 2.222 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2ccncc2F)CCO1 ZINC000449032398 388133477 /nfs/dbraw/zinc/13/34/77/388133477.db2.gz YHQXSMZFVPYNDI-LBPRGKRZSA-N 1 2 238.306 2.222 20 0 BEADLO C[N@H+](CCOCC1CC1)Cc1ccncc1F ZINC000449037063 388134290 /nfs/dbraw/zinc/13/42/90/388134290.db2.gz LYNHDZHSNFTTJB-UHFFFAOYSA-N 1 2 238.306 2.079 20 0 BEADLO C[N@@H+](CCOCC1CC1)Cc1ccncc1F ZINC000449037063 388134291 /nfs/dbraw/zinc/13/42/91/388134291.db2.gz LYNHDZHSNFTTJB-UHFFFAOYSA-N 1 2 238.306 2.079 20 0 BEADLO Cc1nocc1C[N@@H+]1CCOc2ccccc2C1 ZINC000646064456 388134889 /nfs/dbraw/zinc/13/48/89/388134889.db2.gz MXTBJYOHGPRGBO-UHFFFAOYSA-N 1 2 244.294 2.378 20 0 BEADLO Cc1nocc1C[N@H+]1CCOc2ccccc2C1 ZINC000646064456 388134891 /nfs/dbraw/zinc/13/48/91/388134891.db2.gz MXTBJYOHGPRGBO-UHFFFAOYSA-N 1 2 244.294 2.378 20 0 BEADLO CC(C)=CCNC(=O)NCc1c[nH+]c(C)cc1C ZINC000454857498 388136624 /nfs/dbraw/zinc/13/66/24/388136624.db2.gz PIHUDYRBKHSUGO-UHFFFAOYSA-N 1 2 247.342 2.464 20 0 BEADLO CCCC(C)(C)NC(=O)[C@H]1CCn2cc[nH+]c2C1 ZINC000455228280 388152972 /nfs/dbraw/zinc/15/29/72/388152972.db2.gz JEXRQYVJXWBWAF-NSHDSACASA-N 1 2 249.358 2.140 20 0 BEADLO Cn1c[nH+]cc1CNc1ccccc1OCCF ZINC000449384613 388189647 /nfs/dbraw/zinc/18/96/47/388189647.db2.gz CEHUXNCSJUIFRL-UHFFFAOYSA-N 1 2 249.289 2.381 20 0 BEADLO Cc1ccoc1CNc1cc[nH+]c(C2CC2)n1 ZINC000488685484 388191799 /nfs/dbraw/zinc/19/17/99/388191799.db2.gz LWGUJBCSUIMIAR-UHFFFAOYSA-N 1 2 229.283 2.289 20 0 BEADLO Cc1cc(N2CCOC[C@@H](C3CCC3)C2)nc[nH+]1 ZINC000488734126 388192731 /nfs/dbraw/zinc/19/27/31/388192731.db2.gz LGCPPJKVONVJKK-ZDUSSCGKSA-N 1 2 247.342 2.038 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@H](C)C1CC1 ZINC000456340648 388195471 /nfs/dbraw/zinc/19/54/71/388195471.db2.gz CRIFZCAYVYYOMK-ZJUUUORDSA-N 1 2 235.331 2.126 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)N[C@H](C)c1[nH+]ccn1CC ZINC000456351217 388196670 /nfs/dbraw/zinc/19/66/70/388196670.db2.gz MDAMQGMNOGVZRZ-GMTAPVOTSA-N 1 2 235.331 2.126 20 0 BEADLO CCC(CC)C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456362319 388197306 /nfs/dbraw/zinc/19/73/06/388197306.db2.gz DXBJPEAJODJZCT-MWLCHTKSSA-N 1 2 235.331 2.441 20 0 BEADLO C[C@H]([NH2+]Cc1c[nH]c2nccnc12)C(C)(F)F ZINC000449416081 388199208 /nfs/dbraw/zinc/19/92/08/388199208.db2.gz RSOUXADJZHVAGS-ZETCQYMHSA-N 1 2 240.257 2.043 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)[C@H]2CC=CCC2)c2[nH+]ccn21 ZINC000456408596 388199423 /nfs/dbraw/zinc/19/94/23/388199423.db2.gz ZEPBFELIRXKVRA-WOPDTQHZSA-N 1 2 245.326 2.361 20 0 BEADLO C[C@@H](NCc1cccc2[nH+]ccn21)C(C)(F)F ZINC000449417750 388199879 /nfs/dbraw/zinc/19/98/79/388199879.db2.gz ZGTOYUFNDXILSS-SECBINFHSA-N 1 2 239.269 2.468 20 0 BEADLO CC(C)[C@@H]1C[C@@H]1C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456423720 388200356 /nfs/dbraw/zinc/20/03/56/388200356.db2.gz OXOADPHCNLGVQG-FIQHERPVSA-N 1 2 247.342 2.297 20 0 BEADLO C[C@@H]1C[C@@H]1CC(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456431514 388201378 /nfs/dbraw/zinc/20/13/78/388201378.db2.gz SOAXCVLHSMQMPP-YTWAJWBKSA-N 1 2 233.315 2.051 20 0 BEADLO Cc1nnc(C[N@@H+](C)[C@H]2CC2(C)C)n1C1CC1 ZINC000489395779 388209849 /nfs/dbraw/zinc/20/98/49/388209849.db2.gz DABHCGJXAYVOCV-NSHDSACASA-N 1 2 234.347 2.152 20 0 BEADLO Cc1nnc(C[N@H+](C)[C@H]2CC2(C)C)n1C1CC1 ZINC000489395779 388209851 /nfs/dbraw/zinc/20/98/51/388209851.db2.gz DABHCGJXAYVOCV-NSHDSACASA-N 1 2 234.347 2.152 20 0 BEADLO CC(C)c1nnc(C[N@H+](C)[C@@H]2CC2(C)C)n1C ZINC000489447826 388215472 /nfs/dbraw/zinc/21/54/72/388215472.db2.gz KYLGEZOMWAZRBX-SNVBAGLBSA-N 1 2 236.363 2.169 20 0 BEADLO CC(C)c1nnc(C[N@@H+](C)[C@@H]2CC2(C)C)n1C ZINC000489447826 388215474 /nfs/dbraw/zinc/21/54/74/388215474.db2.gz KYLGEZOMWAZRBX-SNVBAGLBSA-N 1 2 236.363 2.169 20 0 BEADLO C[N@H+](Cc1nc(C2CC2)no1)[C@@H]1CC1(C)C ZINC000489504053 388219654 /nfs/dbraw/zinc/21/96/54/388219654.db2.gz WRTLOFRVRNIMNJ-SECBINFHSA-N 1 2 221.304 2.177 20 0 BEADLO C[N@@H+](Cc1nc(C2CC2)no1)[C@@H]1CC1(C)C ZINC000489504053 388219657 /nfs/dbraw/zinc/21/96/57/388219657.db2.gz WRTLOFRVRNIMNJ-SECBINFHSA-N 1 2 221.304 2.177 20 0 BEADLO COC(=O)C[N@H+](C)[C@H](C)c1ccc2c(c1)CCC2 ZINC000489560254 388220464 /nfs/dbraw/zinc/22/04/64/388220464.db2.gz MDCLEHCKATXECP-LLVKDONJSA-N 1 2 247.338 2.341 20 0 BEADLO COC(=O)C[N@@H+](C)[C@H](C)c1ccc2c(c1)CCC2 ZINC000489560254 388220467 /nfs/dbraw/zinc/22/04/67/388220467.db2.gz MDCLEHCKATXECP-LLVKDONJSA-N 1 2 247.338 2.341 20 0 BEADLO CC(C)c1ccc(C[N@H+]2CC(=O)N[C@@H](C)C2)cc1 ZINC000449525336 388224152 /nfs/dbraw/zinc/22/41/52/388224152.db2.gz RIJKPKAYCYUKGU-LBPRGKRZSA-N 1 2 246.354 2.130 20 0 BEADLO CC(C)c1ccc(C[N@@H+]2CC(=O)N[C@@H](C)C2)cc1 ZINC000449525336 388224153 /nfs/dbraw/zinc/22/41/53/388224153.db2.gz RIJKPKAYCYUKGU-LBPRGKRZSA-N 1 2 246.354 2.130 20 0 BEADLO CSc1ccc(NCc2cncc(F)c2)[nH+]c1 ZINC000489763895 388224564 /nfs/dbraw/zinc/22/45/64/388224564.db2.gz VPSITRAEQRFTJA-UHFFFAOYSA-N 1 2 249.314 2.372 20 0 BEADLO CC[C@]1(O)CCN(c2cc(C)[nH+]c(C3CC3)n2)C1 ZINC000490051062 388231927 /nfs/dbraw/zinc/23/19/27/388231927.db2.gz UEYSYKZKQXNYSY-AWEZNQCLSA-N 1 2 247.342 2.014 20 0 BEADLO O=C(/C=C\C1CCCCC1)NCc1[nH]cc[nH+]1 ZINC000491860093 388325099 /nfs/dbraw/zinc/32/50/99/388325099.db2.gz QPUNBJAZRTVBBR-SREVYHEPSA-N 1 2 233.315 2.162 20 0 BEADLO O=C(C=CC1CCCCC1)NCc1[nH]cc[nH+]1 ZINC000491860093 388325100 /nfs/dbraw/zinc/32/51/00/388325100.db2.gz QPUNBJAZRTVBBR-SREVYHEPSA-N 1 2 233.315 2.162 20 0 BEADLO CS[C@@H](CNc1cc[nH+]c(C)n1)C(C)(C)C ZINC000336663657 388262894 /nfs/dbraw/zinc/26/28/94/388262894.db2.gz DKGMIBZQNHOLDU-JTQLQIEISA-N 1 2 239.388 2.397 20 0 BEADLO CCCc1noc(C[NH+]2CCC(CF)CC2)n1 ZINC000451383952 388267766 /nfs/dbraw/zinc/26/77/66/388267766.db2.gz LSTOCVNTMYLHDG-UHFFFAOYSA-N 1 2 241.310 2.204 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N1CCC(C)(C)C1 ZINC000492322897 388341329 /nfs/dbraw/zinc/34/13/29/388341329.db2.gz XWNJPHWEDSEIDM-AATRIKPKSA-N 1 2 247.342 2.175 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1)c1ncn(C)n1 ZINC000275617975 388345255 /nfs/dbraw/zinc/34/52/55/388345255.db2.gz KRURIWUTXXBYKB-VHSXEESVSA-N 1 2 248.305 2.366 20 0 BEADLO Cc1ccsc1C[NH2+][C@@H](C)c1ncn(C)n1 ZINC000275746910 388345899 /nfs/dbraw/zinc/34/58/99/388345899.db2.gz COOKHZWIEACWRI-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO CC[C@H](CSC)Nc1nc[nH+]c(N)c1Cl ZINC000234023063 388351831 /nfs/dbraw/zinc/35/18/31/388351831.db2.gz XXPWQEBMUXVIEK-ZCFIWIBFSA-N 1 2 246.767 2.266 20 0 BEADLO CC[C@H](CSC)Nc1[nH+]cnc(N)c1Cl ZINC000234023063 388351832 /nfs/dbraw/zinc/35/18/32/388351832.db2.gz XXPWQEBMUXVIEK-ZCFIWIBFSA-N 1 2 246.767 2.266 20 0 BEADLO CC(C)(O)c1ccc(C[NH2+]Cc2cocn2)cc1 ZINC000277043636 388352799 /nfs/dbraw/zinc/35/27/99/388352799.db2.gz PJDJYXWOSNWMNV-UHFFFAOYSA-N 1 2 246.310 2.192 20 0 BEADLO O=C(NCc1c[nH+]c[nH]1)[C@H]1CCCC[C@H]1C1CC1 ZINC000648791598 388360165 /nfs/dbraw/zinc/36/01/65/388360165.db2.gz FNSLPOVWGNGOPR-STQMWFEESA-N 1 2 247.342 2.242 20 0 BEADLO O=C(NCc1c[nH]c[nH+]1)[C@H]1CCCC[C@H]1C1CC1 ZINC000648791598 388360168 /nfs/dbraw/zinc/36/01/68/388360168.db2.gz FNSLPOVWGNGOPR-STQMWFEESA-N 1 2 247.342 2.242 20 0 BEADLO COc1cccc2c1cc[nH+]c2N(C)C[C@H](C)O ZINC000234905011 388363144 /nfs/dbraw/zinc/36/31/44/388363144.db2.gz SHORGMWHIWRIKJ-JTQLQIEISA-N 1 2 246.310 2.060 20 0 BEADLO COCCNc1ccc2cc(OC)ccc2[nH+]1 ZINC000193508076 388364197 /nfs/dbraw/zinc/36/41/97/388364197.db2.gz FOCWAUOFNJAQRK-UHFFFAOYSA-N 1 2 232.283 2.302 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CCCSC1 ZINC000164002501 388372547 /nfs/dbraw/zinc/37/25/47/388372547.db2.gz CYKKBVAVAZVFFJ-SECBINFHSA-N 1 2 224.329 2.398 20 0 BEADLO C[C@@H](CF)[NH2+]Cc1c(F)cccc1F ZINC000288381384 388375413 /nfs/dbraw/zinc/37/54/13/388375413.db2.gz GADRIDKXGACVCD-ZETCQYMHSA-N 1 2 203.207 2.412 20 0 BEADLO Nc1[nH+]cnc(N[C@H]2CCCSC2)c1Cl ZINC000236393849 388379420 /nfs/dbraw/zinc/37/94/20/388379420.db2.gz RLDPVSBITKRPTB-LURJTMIESA-N 1 2 244.751 2.020 20 0 BEADLO Nc1nc[nH+]c(N[C@H]2CCCSC2)c1Cl ZINC000236393849 388379422 /nfs/dbraw/zinc/37/94/22/388379422.db2.gz RLDPVSBITKRPTB-LURJTMIESA-N 1 2 244.751 2.020 20 0 BEADLO Nc1[nH+]cnc(NC[C@H]2CCCS2)c1Cl ZINC000236392496 388379479 /nfs/dbraw/zinc/37/94/79/388379479.db2.gz AMUARVOGAKNMDT-ZCFIWIBFSA-N 1 2 244.751 2.020 20 0 BEADLO Nc1nc[nH+]c(NC[C@H]2CCCS2)c1Cl ZINC000236392496 388379481 /nfs/dbraw/zinc/37/94/81/388379481.db2.gz AMUARVOGAKNMDT-ZCFIWIBFSA-N 1 2 244.751 2.020 20 0 BEADLO CC[C@H]([NH3+])C(=O)N[C@H]1CC[C@@H](C)c2ccccc21 ZINC000236946849 388386679 /nfs/dbraw/zinc/38/66/79/388386679.db2.gz JUIGJEMQCWCTCF-SWHYSGLUSA-N 1 2 246.354 2.479 20 0 BEADLO C[C@H](C[NH2+]Cc1cccc(O)c1Cl)N(C)C ZINC000293449191 388389151 /nfs/dbraw/zinc/38/91/51/388389151.db2.gz CJRSWNFZBHDPGE-SECBINFHSA-N 1 2 242.750 2.085 20 0 BEADLO CC[N@@H+]1CCO[C@H](c2ccccc2F)C1 ZINC000066845520 388403581 /nfs/dbraw/zinc/40/35/81/388403581.db2.gz GMJJAPJCESLIBT-LBPRGKRZSA-N 1 2 209.264 2.219 20 0 BEADLO CC[N@H+]1CCO[C@H](c2ccccc2F)C1 ZINC000066845520 388403584 /nfs/dbraw/zinc/40/35/84/388403584.db2.gz GMJJAPJCESLIBT-LBPRGKRZSA-N 1 2 209.264 2.219 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N1CCC(C)CC1 ZINC000492257103 388339306 /nfs/dbraw/zinc/33/93/06/388339306.db2.gz CZAHOZTVNPGRSJ-SNAWJCMRSA-N 1 2 247.342 2.175 20 0 BEADLO CCOC(=O)[C@@]1(C(C)C)CC[N@H+](CC(F)F)C1 ZINC000194874434 388453374 /nfs/dbraw/zinc/45/33/74/388453374.db2.gz HWSQPDGKVYXIOH-LBPRGKRZSA-N 1 2 249.301 2.163 20 0 BEADLO CCOC(=O)[C@@]1(C(C)C)CC[N@@H+](CC(F)F)C1 ZINC000194874434 388453376 /nfs/dbraw/zinc/45/33/76/388453376.db2.gz HWSQPDGKVYXIOH-LBPRGKRZSA-N 1 2 249.301 2.163 20 0 BEADLO O=C(Cn1cc[nH+]c1)N1CCCC[C@H]1C1CCC1 ZINC000649197520 388455391 /nfs/dbraw/zinc/45/53/91/388455391.db2.gz OLRMKIHCJMDSLR-ZDUSSCGKSA-N 1 2 247.342 2.064 20 0 BEADLO CCCCNc1cc(N2CCCC2)nc[nH+]1 ZINC000243535052 388481109 /nfs/dbraw/zinc/48/11/09/388481109.db2.gz OFPNCTSKLGEREA-UHFFFAOYSA-N 1 2 220.320 2.289 20 0 BEADLO CCCCNc1cc(N2CCCC2)[nH+]cn1 ZINC000243535052 388481111 /nfs/dbraw/zinc/48/11/11/388481111.db2.gz OFPNCTSKLGEREA-UHFFFAOYSA-N 1 2 220.320 2.289 20 0 BEADLO CCCC[NH+]=c1[nH]c2ccc(F)cc2n1C ZINC000336693769 388463763 /nfs/dbraw/zinc/46/37/63/388463763.db2.gz XXVBURHPUXVNSH-UHFFFAOYSA-N 1 2 221.279 2.346 20 0 BEADLO C[C@H]([NH2+][C@@H]1CSC[C@H]1C)C(=O)OC(C)(C)C ZINC000336706010 388464922 /nfs/dbraw/zinc/46/49/22/388464922.db2.gz PSOZXBFVFMZCNU-KXUCPTDWSA-N 1 2 245.388 2.058 20 0 BEADLO Cn1cc(CSc2[nH+]cc3ccccn32)cn1 ZINC000193834470 388465631 /nfs/dbraw/zinc/46/56/31/388465631.db2.gz KAZJKGYHHQFOSO-UHFFFAOYSA-N 1 2 244.323 2.360 20 0 BEADLO Cc1cc(NCC2(C)CC2)nc(C2CC2)[nH+]1 ZINC000336722174 388469369 /nfs/dbraw/zinc/46/93/69/388469369.db2.gz DRTWFFZPLQLIFD-UHFFFAOYSA-N 1 2 217.316 2.296 20 0 BEADLO Cc1nsc(NCCc2[nH+]cccc2C)n1 ZINC000295711849 388413201 /nfs/dbraw/zinc/41/32/01/388413201.db2.gz KGDKUBJUAXPWPV-UHFFFAOYSA-N 1 2 234.328 2.205 20 0 BEADLO CCc1csc(NCCc2[nH+]cccc2C)n1 ZINC000404678667 388428489 /nfs/dbraw/zinc/42/84/89/388428489.db2.gz FTHCRIUPQYSLMX-UHFFFAOYSA-N 1 2 247.367 2.485 20 0 BEADLO Cc1nc(N2CC[C@@H](C)[C@@H](C)C2)cc[nH+]1 ZINC000245756298 388431023 /nfs/dbraw/zinc/43/10/23/388431023.db2.gz PBAJDWJZESXJLI-ZJUUUORDSA-N 1 2 205.305 2.267 20 0 BEADLO CC[C@@H](CC(C)C)C(=O)NCc1[nH]c[nH+]c1C ZINC000308086341 388431453 /nfs/dbraw/zinc/43/14/53/388431453.db2.gz ILNBXDBBNRFMQU-NSHDSACASA-N 1 2 237.347 2.407 20 0 BEADLO CC(C)(O)C(C)(C)C[NH+]=c1[nH]c2ccccc2[nH]1 ZINC000393546838 388433435 /nfs/dbraw/zinc/43/34/35/388433435.db2.gz KMZCMBSDFAOGHB-UHFFFAOYSA-N 1 2 247.342 2.194 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)NCCCF ZINC000573233620 388434126 /nfs/dbraw/zinc/43/41/26/388434126.db2.gz NPGPOPRPHFVMHS-UHFFFAOYSA-N 1 2 225.267 2.180 20 0 BEADLO CCC(CC)C[N@@H+]1CCOCC(F)(F)C1 ZINC000573249635 388435823 /nfs/dbraw/zinc/43/58/23/388435823.db2.gz SDZRQKNXZMRZEO-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO CCC(CC)C[N@H+]1CCOCC(F)(F)C1 ZINC000573249635 388435825 /nfs/dbraw/zinc/43/58/25/388435825.db2.gz SDZRQKNXZMRZEO-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO CC(C)N(CC1CC1)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000573254902 388436120 /nfs/dbraw/zinc/43/61/20/388436120.db2.gz CEKDGGDIKVBOGU-LBPRGKRZSA-N 1 2 249.358 2.481 20 0 BEADLO COc1c(O)cccc1C[N@@H+]1CCC[C@@H](F)C1 ZINC000573258283 388436171 /nfs/dbraw/zinc/43/61/71/388436171.db2.gz WYNULBYNMINACW-LLVKDONJSA-N 1 2 239.290 2.335 20 0 BEADLO COc1c(O)cccc1C[N@H+]1CCC[C@@H](F)C1 ZINC000573258283 388436173 /nfs/dbraw/zinc/43/61/73/388436173.db2.gz WYNULBYNMINACW-LLVKDONJSA-N 1 2 239.290 2.335 20 0 BEADLO CC1(C)CC(C[N@@H+]2CCOCC(F)(F)C2)C1 ZINC000528504207 388537159 /nfs/dbraw/zinc/53/71/59/388537159.db2.gz MYWDDLOGIQZRRV-UHFFFAOYSA-N 1 2 233.302 2.390 20 0 BEADLO CC1(C)CC(C[N@H+]2CCOCC(F)(F)C2)C1 ZINC000528504207 388537161 /nfs/dbraw/zinc/53/71/61/388537161.db2.gz MYWDDLOGIQZRRV-UHFFFAOYSA-N 1 2 233.302 2.390 20 0 BEADLO CN(C)c1[nH+]cccc1N(C)C(=O)C1CC=CC1 ZINC000079722193 388545268 /nfs/dbraw/zinc/54/52/68/388545268.db2.gz VRQNFURFMMZISU-UHFFFAOYSA-N 1 2 245.326 2.077 20 0 BEADLO CCOC1C[NH+](Cc2ccc(OC)c(C)c2)C1 ZINC000459577237 256784356 /nfs/dbraw/zinc/78/43/56/256784356.db2.gz BEGKXMFGPWSZRZ-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO C[N@H+](CCC1CC1)Cc1noc(C2CC2)n1 ZINC000135300595 388489979 /nfs/dbraw/zinc/48/99/79/388489979.db2.gz ZGDFMKRUCZDSPP-UHFFFAOYSA-N 1 2 221.304 2.179 20 0 BEADLO C[N@@H+](CCC1CC1)Cc1noc(C2CC2)n1 ZINC000135300595 388489982 /nfs/dbraw/zinc/48/99/82/388489982.db2.gz ZGDFMKRUCZDSPP-UHFFFAOYSA-N 1 2 221.304 2.179 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+]2CC[C@H](OC(F)F)C2)o1 ZINC000517397639 388549769 /nfs/dbraw/zinc/54/97/69/388549769.db2.gz SZAMNTPBPPFPAU-BDAKNGLRSA-N 1 2 246.257 2.358 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+]2CC[C@H](OC(F)F)C2)o1 ZINC000517397639 388549771 /nfs/dbraw/zinc/54/97/71/388549771.db2.gz SZAMNTPBPPFPAU-BDAKNGLRSA-N 1 2 246.257 2.358 20 0 BEADLO CCC[C@@H](NC(=O)Cn1cc[nH+]c1)C1CCCC1 ZINC000516852061 388521233 /nfs/dbraw/zinc/52/12/33/388521233.db2.gz YBHSLBHWUGJILC-CYBMUJFWSA-N 1 2 249.358 2.358 20 0 BEADLO Cc1noc([C@H](C)[N@H+](C)CCOC(C)(C)C)n1 ZINC000516902505 388523745 /nfs/dbraw/zinc/52/37/45/388523745.db2.gz CPYPTGVMXOFUAJ-VIFPVBQESA-N 1 2 241.335 2.186 20 0 BEADLO Cc1noc([C@H](C)[N@@H+](C)CCOC(C)(C)C)n1 ZINC000516902505 388523748 /nfs/dbraw/zinc/52/37/48/388523748.db2.gz CPYPTGVMXOFUAJ-VIFPVBQESA-N 1 2 241.335 2.186 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)Cc1ncccc1Cl ZINC000528434411 388525018 /nfs/dbraw/zinc/52/50/18/388525018.db2.gz TWOOVFNUYGKENS-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO CCC1(NC(=O)[C@H](C)Cc2c[nH+]c[nH]2)CCC1 ZINC000520836206 388525287 /nfs/dbraw/zinc/52/52/87/388525287.db2.gz JACXSZDBWXWOTN-SNVBAGLBSA-N 1 2 235.331 2.037 20 0 BEADLO CCC1(NC(=O)[C@H](C)Cc2c[nH]c[nH+]2)CCC1 ZINC000520836206 388525290 /nfs/dbraw/zinc/52/52/90/388525290.db2.gz JACXSZDBWXWOTN-SNVBAGLBSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@]1(C(C)C)C[C@@H]1NC(=O)Cc1[nH]c[nH+]c1C ZINC000516954550 388527348 /nfs/dbraw/zinc/52/73/48/388527348.db2.gz ULJBHHHALLUVGY-GXTWGEPZSA-N 1 2 249.358 2.202 20 0 BEADLO CC[C@]1(C(C)C)C[C@@H]1NC(=O)Cc1[nH+]c[nH]c1C ZINC000516954550 388527349 /nfs/dbraw/zinc/52/73/49/388527349.db2.gz ULJBHHHALLUVGY-GXTWGEPZSA-N 1 2 249.358 2.202 20 0 BEADLO CCCN1CCC[N@H+](C/C=C(/C)Cl)CC1=O ZINC000528472247 388531281 /nfs/dbraw/zinc/53/12/81/388531281.db2.gz KSTWKWZLNGXODS-WZUFQYTHSA-N 1 2 244.766 2.073 20 0 BEADLO CCCN1CCC[N@@H+](C/C=C(/C)Cl)CC1=O ZINC000528472247 388531283 /nfs/dbraw/zinc/53/12/83/388531283.db2.gz KSTWKWZLNGXODS-WZUFQYTHSA-N 1 2 244.766 2.073 20 0 BEADLO CC[C@@H]([NH2+]Cc1ncccn1)c1ccncc1 ZINC000517041978 388536166 /nfs/dbraw/zinc/53/61/66/388536166.db2.gz HSLKJGIVWJXMLS-GFCCVEGCSA-N 1 2 228.299 2.113 20 0 BEADLO CC[C@H]1CC[N@@H+]([C@@H](C(=O)OC)c2cccnc2)C1 ZINC000245941563 388611229 /nfs/dbraw/zinc/61/12/29/388611229.db2.gz MLVYJQSPTYQPRT-WCQYABFASA-N 1 2 248.326 2.028 20 0 BEADLO CC[C@H]1CC[N@H+]([C@@H](C(=O)OC)c2cccnc2)C1 ZINC000245941563 388611232 /nfs/dbraw/zinc/61/12/32/388611232.db2.gz MLVYJQSPTYQPRT-WCQYABFASA-N 1 2 248.326 2.028 20 0 BEADLO CC(C)(C)c1nnc(Cn2cc[nH+]c2C2CC2)[nH]1 ZINC000530131078 388615103 /nfs/dbraw/zinc/61/51/03/388615103.db2.gz WYMWKMABOAGBJW-UHFFFAOYSA-N 1 2 245.330 2.224 20 0 BEADLO Cc1cc(NC(=O)N(C)[C@H]2CC2(C)C)c(C)c[nH+]1 ZINC000520930545 388559000 /nfs/dbraw/zinc/55/90/00/388559000.db2.gz SUGVNORGNHXLLB-LBPRGKRZSA-N 1 2 247.342 2.383 20 0 BEADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1cnns1 ZINC000528772987 388571520 /nfs/dbraw/zinc/57/15/20/388571520.db2.gz NRAQNAXCQHHIPC-SSDOTTSWSA-N 1 2 233.287 2.158 20 0 BEADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1cnns1 ZINC000528772987 388571524 /nfs/dbraw/zinc/57/15/24/388571524.db2.gz NRAQNAXCQHHIPC-SSDOTTSWSA-N 1 2 233.287 2.158 20 0 BEADLO CC[C@@H]1CC[N@H+](Cc2noc(C3CC3)n2)C1 ZINC000125792081 388677594 /nfs/dbraw/zinc/67/75/94/388677594.db2.gz NSUPPPOIIGOXEY-SECBINFHSA-N 1 2 221.304 2.179 20 0 BEADLO CC[C@@H]1CC[N@@H+](Cc2noc(C3CC3)n2)C1 ZINC000125792081 388677597 /nfs/dbraw/zinc/67/75/97/388677597.db2.gz NSUPPPOIIGOXEY-SECBINFHSA-N 1 2 221.304 2.179 20 0 BEADLO CC1(C[NH2+][C@H](c2cccs2)c2nnc[nH]2)CC1 ZINC000551086900 388621122 /nfs/dbraw/zinc/62/11/22/388621122.db2.gz ZVTOJEQDFPQJER-SNVBAGLBSA-N 1 2 248.355 2.345 20 0 BEADLO Cc1cc(NC(=O)[C@H](C)C(C)(F)F)c(C)c[nH+]1 ZINC000551897983 388645166 /nfs/dbraw/zinc/64/51/66/388645166.db2.gz GKHGZBXMCMLASQ-VIFPVBQESA-N 1 2 242.269 2.350 20 0 BEADLO CCN(Cc1ccoc1)Cc1[nH]cc[nH+]1 ZINC000111215668 388658698 /nfs/dbraw/zinc/65/86/98/388658698.db2.gz AUXPIHBVJXJQEL-UHFFFAOYSA-N 1 2 205.261 2.025 20 0 BEADLO CCCC[C@@H](CC)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000522251280 388734784 /nfs/dbraw/zinc/73/47/84/388734784.db2.gz RYMRZMLGPGBEFH-GFCCVEGCSA-N 1 2 249.358 2.483 20 0 BEADLO CCC[C@H]([NH2+][C@H](C)CSC)C(=O)OCC ZINC000128047633 388735753 /nfs/dbraw/zinc/73/57/53/388735753.db2.gz YPAJEHPQQSIEJP-ZJUUUORDSA-N 1 2 233.377 2.059 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CCOC(C)(C)C1 ZINC000128238696 388740792 /nfs/dbraw/zinc/74/07/92/388740792.db2.gz URGITEOHZHTNJY-SNVBAGLBSA-N 1 2 236.315 2.460 20 0 BEADLO c1ccc2[nH+]c(N3CC[C@@]4(CCOC4)C3)[nH]c2c1 ZINC000301898934 388699112 /nfs/dbraw/zinc/69/91/12/388699112.db2.gz XKNKOGPQWGLNMF-CQSZACIVSA-N 1 2 243.310 2.180 20 0 BEADLO CC(C)[C@H](C)C(=O)NCCCCn1cc[nH+]c1 ZINC000522214487 388722529 /nfs/dbraw/zinc/72/25/29/388722529.db2.gz CRVDWDLQEAWSNZ-LBPRGKRZSA-N 1 2 237.347 2.072 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1nc(C)cs1 ZINC000088600060 388732477 /nfs/dbraw/zinc/73/24/77/388732477.db2.gz HUXINRAHNHRISP-SNVBAGLBSA-N 1 2 226.345 2.062 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1nc(C)cs1 ZINC000088600060 388732478 /nfs/dbraw/zinc/73/24/78/388732478.db2.gz HUXINRAHNHRISP-SNVBAGLBSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCC[C@@H](CCO)CC1 ZINC000572541723 388801679 /nfs/dbraw/zinc/80/16/79/388801679.db2.gz HVQJRUBNIOMMFQ-CYBMUJFWSA-N 1 2 249.358 2.082 20 0 BEADLO Cc1ccc(CCNc2ccc(F)cn2)c[nH+]1 ZINC000553389964 388768955 /nfs/dbraw/zinc/76/89/55/388768955.db2.gz MLSQDQXIUIBQAO-UHFFFAOYSA-N 1 2 231.274 2.001 20 0 BEADLO O=C(NCCCC1CC1)c1ccc2[nH+]ccn2c1 ZINC000522885226 388776884 /nfs/dbraw/zinc/77/68/84/388776884.db2.gz QBGYGAOVOZKBMV-UHFFFAOYSA-N 1 2 243.310 2.254 20 0 BEADLO CCC1(CNC(=O)C[NH+]2CC(C)(C)C2)CCC1 ZINC000553499020 388777794 /nfs/dbraw/zinc/77/77/94/388777794.db2.gz XCXINUNUKHGRLD-UHFFFAOYSA-N 1 2 238.375 2.025 20 0 BEADLO Cc1cc(N[C@H]2CC[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000336749932 177709766 /nfs/dbraw/zinc/70/97/66/177709766.db2.gz UKDACWKQJDMYJH-KWQFWETISA-N 1 2 217.316 2.295 20 0 BEADLO COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccn[nH]1)CC2 ZINC000092836712 388818580 /nfs/dbraw/zinc/81/85/80/388818580.db2.gz UZJXBEDYKPFYGT-AWEZNQCLSA-N 1 2 243.310 2.195 20 0 BEADLO CCC1(CNc2nc[nH+]c(N)c2OC)CCC1 ZINC000233016832 388861364 /nfs/dbraw/zinc/86/13/64/388861364.db2.gz FUECNJWHYZCGDQ-UHFFFAOYSA-N 1 2 236.319 2.060 20 0 BEADLO CCC1(CNc2[nH+]cnc(N)c2OC)CCC1 ZINC000233016832 388861365 /nfs/dbraw/zinc/86/13/65/388861365.db2.gz FUECNJWHYZCGDQ-UHFFFAOYSA-N 1 2 236.319 2.060 20 0 BEADLO Cc1cc(C(=O)C[N@@H+]2CCC=C(C)C2)c(C)n1C ZINC000555865296 388862864 /nfs/dbraw/zinc/86/28/64/388862864.db2.gz FNBCKAAWXCPUNP-UHFFFAOYSA-N 1 2 246.354 2.477 20 0 BEADLO Cc1cc(C(=O)C[N@H+]2CCC=C(C)C2)c(C)n1C ZINC000555865296 388862868 /nfs/dbraw/zinc/86/28/68/388862868.db2.gz FNBCKAAWXCPUNP-UHFFFAOYSA-N 1 2 246.354 2.477 20 0 BEADLO COc1ccc[nH+]c1NCc1oc(C)nc1C ZINC000311653747 388864916 /nfs/dbraw/zinc/86/49/16/388864916.db2.gz DEYZHFKGJLFXBX-UHFFFAOYSA-N 1 2 233.271 2.307 20 0 BEADLO CCC[C@H]([NH2+]Cc1ccn[nH]1)c1cccnc1 ZINC000541744226 388866088 /nfs/dbraw/zinc/86/60/88/388866088.db2.gz GUWKRRDDKNDCAZ-ZDUSSCGKSA-N 1 2 230.315 2.436 20 0 BEADLO CO[C@H]1C[C@@H](N(C)c2cc[nH+]c(C(C)C)n2)C1 ZINC000565113744 388916228 /nfs/dbraw/zinc/91/62/28/388916228.db2.gz ADAJOZZYBHBYFN-PHIMTYICSA-N 1 2 235.331 2.214 20 0 BEADLO CCCN(CC1CC1)C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000565168998 388920738 /nfs/dbraw/zinc/92/07/38/388920738.db2.gz CLCQRWWAMKNXHD-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO CCCN(CC1CC1)C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000565168998 388920740 /nfs/dbraw/zinc/92/07/40/388920740.db2.gz CLCQRWWAMKNXHD-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@H]1CC12CCCC2 ZINC000565190024 388923619 /nfs/dbraw/zinc/92/36/19/388923619.db2.gz JTVLLTWJJYMQSL-CMPLNLGQSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@H]1CC12CCCC2 ZINC000565190024 388923622 /nfs/dbraw/zinc/92/36/22/388923622.db2.gz JTVLLTWJJYMQSL-CMPLNLGQSA-N 1 2 247.342 2.037 20 0 BEADLO CC[C@H]([NH2+][C@H](C)c1cncnc1C)C(F)F ZINC000565219660 388927994 /nfs/dbraw/zinc/92/79/94/388927994.db2.gz XLRKMMZVOXKLDV-SCZZXKLOSA-N 1 2 229.274 2.479 20 0 BEADLO c1cc(C[N@@H+]2CCC=C(c3ccccn3)C2)n[nH]1 ZINC000565489423 388948305 /nfs/dbraw/zinc/94/83/05/388948305.db2.gz WHTSTFKFZQMWNS-UHFFFAOYSA-N 1 2 240.310 2.094 20 0 BEADLO c1cc(C[N@H+]2CCC=C(c3ccccn3)C2)n[nH]1 ZINC000565489423 388948308 /nfs/dbraw/zinc/94/83/08/388948308.db2.gz WHTSTFKFZQMWNS-UHFFFAOYSA-N 1 2 240.310 2.094 20 0 BEADLO CC(C)CC[C@@H]1CCCN1C(=O)Cn1cc[nH+]c1 ZINC000565513919 388950270 /nfs/dbraw/zinc/95/02/70/388950270.db2.gz SQDONSWAYPBQMT-ZDUSSCGKSA-N 1 2 249.358 2.310 20 0 BEADLO Cn1ccc(C[NH2+][C@@H]2C[C@@]2(F)c2ccccc2)n1 ZINC000566062732 388985716 /nfs/dbraw/zinc/98/57/16/388985716.db2.gz KGFLIXAGWGYUBL-ZIAGYGMSSA-N 1 2 245.301 2.147 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C1CCCCCC1 ZINC000267099188 388998107 /nfs/dbraw/zinc/99/81/07/388998107.db2.gz OEJTVEHHDRZJJO-UHFFFAOYSA-N 1 2 235.331 2.305 20 0 BEADLO Cc1cc(C(=O)NCc2[nH]c[nH+]c2C)sc1C ZINC000266946890 388998648 /nfs/dbraw/zinc/99/86/48/388998648.db2.gz DAEMYSFAHCVTLH-UHFFFAOYSA-N 1 2 249.339 2.326 20 0 BEADLO C[C@H](Nc1cccc[nH+]1)[C@H]1CCCCO1 ZINC000272014595 389027557 /nfs/dbraw/zinc/02/75/57/389027557.db2.gz NXDPNXUKRBNCGQ-WDEREUQCSA-N 1 2 206.289 2.451 20 0 BEADLO Cc1nnc(NCCc2cc[nH+]cc2C)s1 ZINC000269991531 389011652 /nfs/dbraw/zinc/01/16/52/389011652.db2.gz PFNHNUAAONEMKG-UHFFFAOYSA-N 1 2 234.328 2.205 20 0 BEADLO CO[C@@H]1CCC[C@@H]1Sc1nc(N)cc(C)[nH+]1 ZINC000273074395 389037190 /nfs/dbraw/zinc/03/71/90/389037190.db2.gz FNIHQUJGLASMME-BDAKNGLRSA-N 1 2 239.344 2.027 20 0 BEADLO C[C@@H](CC(C)(C)C)NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493449861 533466146 /nfs/dbraw/zinc/46/61/46/533466146.db2.gz IRVFLZLGGCHJNR-PORFMDCZSA-N 1 2 235.331 2.364 20 0 BEADLO Cc1nc(N2CCS[C@H](C)[C@H]2C)cc[nH+]1 ZINC000266206688 132185283 /nfs/dbraw/zinc/18/52/83/132185283.db2.gz FGYCNNNLXZIFIA-RKDXNWHRSA-N 1 2 223.345 2.115 20 0 BEADLO CCOC[C@@H]1CCCN(c2cccc[nH+]2)C1 ZINC000265061122 132181275 /nfs/dbraw/zinc/18/12/75/132181275.db2.gz NFHCGADXOBRQPG-GFCCVEGCSA-N 1 2 220.316 2.335 20 0 BEADLO Cc1nc(N2CCC[C@@H](C)[C@H]2C)cc[nH+]1 ZINC000266185468 132184239 /nfs/dbraw/zinc/18/42/39/132184239.db2.gz ANUIULGQHDYLFY-NXEZZACHSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1nc(N2CC[C@@H](C)C[C@H]2C)cc[nH+]1 ZINC000266211891 132185414 /nfs/dbraw/zinc/18/54/14/132185414.db2.gz GGNSWWIONQYCPC-NXEZZACHSA-N 1 2 205.305 2.410 20 0 BEADLO C[C@@H]1[C@H](C)OCCN1c1cc[nH+]c2ccncc21 ZINC000268782812 132193152 /nfs/dbraw/zinc/19/31/52/132193152.db2.gz CQHKCARZCPKMEF-MNOVXSKESA-N 1 2 243.310 2.243 20 0 BEADLO Cc1nc(N2CC[C@H](C(C)(C)C)[C@@H](O)C2)cc[nH+]1 ZINC000273353983 132201667 /nfs/dbraw/zinc/20/16/67/132201667.db2.gz VQSZIJMNOAPXDW-RYUDHWBXSA-N 1 2 249.358 2.018 20 0 BEADLO CC(C)(C)[C@@H]1CCN(c2cccc[nH+]2)C[C@H]1O ZINC000273310870 132201840 /nfs/dbraw/zinc/20/18/40/132201840.db2.gz NKNLEPKECNSXLY-VXGBXAGGSA-N 1 2 234.343 2.315 20 0 BEADLO Cc1nc(N2CCC([C@H]3CCCO3)CC2)cc[nH+]1 ZINC000276099114 132206287 /nfs/dbraw/zinc/20/62/87/132206287.db2.gz WFNKCKDJWUJRLY-CYBMUJFWSA-N 1 2 247.342 2.180 20 0 BEADLO C[C@H]1CCN(c2[nH+]cnc(N)c2Cl)C[C@H]1C ZINC000277807019 132207394 /nfs/dbraw/zinc/20/73/94/132207394.db2.gz NXZCTWWDEYLYOR-JGVFFNPUSA-N 1 2 240.738 2.195 20 0 BEADLO C[C@H]1CCN(c2nc[nH+]c(N)c2Cl)C[C@H]1C ZINC000277807019 132207393 /nfs/dbraw/zinc/20/73/93/132207393.db2.gz NXZCTWWDEYLYOR-JGVFFNPUSA-N 1 2 240.738 2.195 20 0 BEADLO Cc1nc(N2CCO[C@@H](C(C)(C)C)C2)cc[nH+]1 ZINC000279329987 132208818 /nfs/dbraw/zinc/20/88/18/132208818.db2.gz DEMUZYKSBLIJPM-LLVKDONJSA-N 1 2 235.331 2.036 20 0 BEADLO CO[C@@]1(C)CCCN(c2cccc[nH+]2)C1 ZINC000280602727 132210913 /nfs/dbraw/zinc/21/09/13/132210913.db2.gz XUPUSZBTJIIPEP-LBPRGKRZSA-N 1 2 206.289 2.087 20 0 BEADLO Cn1nccc1C1=CCN(c2cccc[nH+]2)CC1 ZINC000286121289 132214317 /nfs/dbraw/zinc/21/43/17/132214317.db2.gz AJRNUOFXMKZJJF-UHFFFAOYSA-N 1 2 240.310 2.109 20 0 BEADLO Cc1nc(N2CCC3(CCOCC3)CC2)cc[nH+]1 ZINC000286652484 132215380 /nfs/dbraw/zinc/21/53/80/132215380.db2.gz GLLCQINGXRKFIS-UHFFFAOYSA-N 1 2 247.342 2.182 20 0 BEADLO Cc1cc(N2CCC[C@H](O)[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000295068552 132220401 /nfs/dbraw/zinc/22/04/01/132220401.db2.gz WCDCRAWTFPYYKJ-JQWIXIFHSA-N 1 2 247.342 2.012 20 0 BEADLO Cc1cc(N2CCC(CO)CC2)nc(C(C)C)[nH+]1 ZINC000040444388 132223435 /nfs/dbraw/zinc/22/34/35/132223435.db2.gz NNZBIKASOZOWQU-UHFFFAOYSA-N 1 2 249.358 2.117 20 0 BEADLO Cc1cc(N2CCc3ccc(F)cc3C2)nc[nH+]1 ZINC000135554859 132240517 /nfs/dbraw/zinc/24/05/17/132240517.db2.gz LWXOJZOTHSPMLR-UHFFFAOYSA-N 1 2 243.285 2.487 20 0 BEADLO c1cnn([C@H]2CCCN(c3cccc[nH+]3)C2)c1 ZINC000301206544 132251832 /nfs/dbraw/zinc/25/18/32/132251832.db2.gz ZLGYTTPHNZHSCF-LBPRGKRZSA-N 1 2 228.299 2.120 20 0 BEADLO COCC1CCN(c2nc(C)[nH+]c(C)c2C)CC1 ZINC000301445274 132253581 /nfs/dbraw/zinc/25/35/81/132253581.db2.gz PJXKLBQWACOSHY-UHFFFAOYSA-N 1 2 249.358 2.265 20 0 BEADLO Cc1cc(N2CCS[C@H](C(C)C)C2)nc[nH+]1 ZINC000301476953 132253920 /nfs/dbraw/zinc/25/39/20/132253920.db2.gz TWOPPTGTQZEIPO-NSHDSACASA-N 1 2 237.372 2.363 20 0 BEADLO Cc1cc(N2C[C@@H](C)S[C@H](C)C2)nc[nH+]1 ZINC000301459438 132254144 /nfs/dbraw/zinc/25/41/44/132254144.db2.gz IQAGFWJPPZAACY-NXEZZACHSA-N 1 2 223.345 2.115 20 0 BEADLO COCC1=CCN(c2cc[nH+]c(C(C)C)n2)CC1 ZINC000302400242 132263351 /nfs/dbraw/zinc/26/33/51/132263351.db2.gz KUQWINHXZUQTQK-UHFFFAOYSA-N 1 2 247.342 2.383 20 0 BEADLO c1cc2c(ccnc2N2CCn3c[nH+]cc3C2)o1 ZINC000357562226 132273952 /nfs/dbraw/zinc/27/39/52/132273952.db2.gz YVMAHWXUQHXGEE-UHFFFAOYSA-N 1 2 240.266 2.045 20 0 BEADLO CCC1(O)CCN(c2cc[nH+]c(C(C)C)n2)CC1 ZINC000361279906 132279703 /nfs/dbraw/zinc/27/97/03/132279703.db2.gz DRMYKGBDFWKRBH-UHFFFAOYSA-N 1 2 249.358 2.341 20 0 BEADLO c1n[nH]cc1C1CCN(c2cccc[nH+]2)CC1 ZINC000371067038 132284985 /nfs/dbraw/zinc/28/49/85/132284985.db2.gz BWFZPQYMNZABDI-UHFFFAOYSA-N 1 2 228.299 2.189 20 0 BEADLO C[C@H](Nc1ccc(N2CCOCC2)[nH+]c1)C1CC1 ZINC000037076083 132295606 /nfs/dbraw/zinc/29/56/06/132295606.db2.gz IBMGXVKNFQFFDG-NSHDSACASA-N 1 2 247.342 2.129 20 0 BEADLO CC1=C[C@@H](C)CN(c2nc[nH+]c(N)c2Cl)C1 ZINC000309296487 132365593 /nfs/dbraw/zinc/36/55/93/132365593.db2.gz RRKBUWOSTWNQOB-SSDOTTSWSA-N 1 2 238.722 2.115 20 0 BEADLO Cn1cc[nH+]c1CN1CCCc2ccccc21 ZINC000070921508 132391135 /nfs/dbraw/zinc/39/11/35/132391135.db2.gz HRHLIFNXKBEFGO-UHFFFAOYSA-N 1 2 227.311 2.373 20 0 BEADLO COC1C[NH+](Cc2ccc3nc(C)ccc3c2)C1 ZINC000334740574 133745653 /nfs/dbraw/zinc/74/56/53/133745653.db2.gz NTFOTQPVZNWLLP-UHFFFAOYSA-N 1 2 242.322 2.374 20 0 BEADLO CCn1ccc(C(=O)Nc2c(C)cc[nH+]c2C)n1 ZINC000335464684 133855019 /nfs/dbraw/zinc/85/50/19/133855019.db2.gz FVMTULKRSCKBQS-UHFFFAOYSA-N 1 2 244.298 2.167 20 0 BEADLO C[NH2+]Cc1noc([C@@H](C)c2cccc(C)c2)n1 ZINC000349900660 133925362 /nfs/dbraw/zinc/92/53/62/133925362.db2.gz ZSXVITVHQBAARW-JTQLQIEISA-N 1 2 231.299 2.249 20 0 BEADLO O=C(Cc1ccoc1)Nc1ccn2cc[nH+]c2c1 ZINC000350145037 133941326 /nfs/dbraw/zinc/94/13/26/133941326.db2.gz GUQOVIYXYHUJAU-UHFFFAOYSA-N 1 2 241.250 2.109 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CCC[C@@H]2CF)[nH+]1 ZINC000335927934 134009470 /nfs/dbraw/zinc/00/94/70/134009470.db2.gz IHCUUDUAHNXJCQ-SECBINFHSA-N 1 2 234.278 2.205 20 0 BEADLO CC[C@H](O)C[N@@H+]1CCn2c(cc3ccccc32)C1 ZINC000335930129 134010247 /nfs/dbraw/zinc/01/02/47/134010247.db2.gz ILEVTBONWDESDQ-AWEZNQCLSA-N 1 2 244.338 2.228 20 0 BEADLO CC[C@H](O)C[N@H+]1CCn2c(cc3ccccc32)C1 ZINC000335930129 134010248 /nfs/dbraw/zinc/01/02/48/134010248.db2.gz ILEVTBONWDESDQ-AWEZNQCLSA-N 1 2 244.338 2.228 20 0 BEADLO C[C@H]1C[N@H+](Cc2nc(C(C)(C)C)no2)[C@H]1C ZINC000335931176 134010833 /nfs/dbraw/zinc/01/08/33/134010833.db2.gz NCPXEICCFHFELP-IUCAKERBSA-N 1 2 223.320 2.207 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nc(C(C)(C)C)no2)[C@H]1C ZINC000335931176 134010834 /nfs/dbraw/zinc/01/08/34/134010834.db2.gz NCPXEICCFHFELP-IUCAKERBSA-N 1 2 223.320 2.207 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@H](C)[C@H]2C)cn1 ZINC000335999414 134043547 /nfs/dbraw/zinc/04/35/47/134043547.db2.gz UFBWEUUNJKBENJ-VXGBXAGGSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@H](C)[C@H]2C)cn1 ZINC000335999414 134043548 /nfs/dbraw/zinc/04/35/48/134043548.db2.gz UFBWEUUNJKBENJ-VXGBXAGGSA-N 1 2 234.343 2.253 20 0 BEADLO c1cc(C[N@@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)no1 ZINC000336007680 134050006 /nfs/dbraw/zinc/05/00/06/134050006.db2.gz ULZYUABJSVGFPA-OLZOCXBDSA-N 1 2 248.326 2.208 20 0 BEADLO c1cc(C[N@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)no1 ZINC000336007680 134050007 /nfs/dbraw/zinc/05/00/07/134050007.db2.gz ULZYUABJSVGFPA-OLZOCXBDSA-N 1 2 248.326 2.208 20 0 BEADLO C[C@@H]1C[C@@H]1C[NH+]=c1[nH]c2c(cccc2F)n1C ZINC000352075234 134055631 /nfs/dbraw/zinc/05/56/31/134055631.db2.gz CATFDTYGANZYRL-RKDXNWHRSA-N 1 2 233.290 2.202 20 0 BEADLO CC(=O)Nc1nc(C[NH+]2[C@H](C)C[C@H]2C)cs1 ZINC000336055759 134066436 /nfs/dbraw/zinc/06/64/36/134066436.db2.gz WZHJRSNDMDVGCI-HTQZYQBOSA-N 1 2 239.344 2.084 20 0 BEADLO Cc1ccc(NC(=O)c2csc(=O)[nH]2)c(C)[nH+]1 ZINC000336059704 134067612 /nfs/dbraw/zinc/06/76/12/134067612.db2.gz RUBBUSYUJHGEAF-UHFFFAOYSA-N 1 2 249.295 2.113 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2cc(O)cc(F)c2)C1 ZINC000336068191 134071080 /nfs/dbraw/zinc/07/10/80/134071080.db2.gz FATTWUFHNUPOIB-LBPRGKRZSA-N 1 2 227.254 2.465 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2cc(O)cc(F)c2)C1 ZINC000336068191 134071081 /nfs/dbraw/zinc/07/10/81/134071081.db2.gz FATTWUFHNUPOIB-LBPRGKRZSA-N 1 2 227.254 2.465 20 0 BEADLO Fc1ccccc1C[N@@H+]1CCO[C@@H](C2CC2)C1 ZINC000336088343 134077584 /nfs/dbraw/zinc/07/75/84/134077584.db2.gz JJCSHRQFTIQKBO-CQSZACIVSA-N 1 2 235.302 2.437 20 0 BEADLO Fc1ccccc1C[N@H+]1CCO[C@@H](C2CC2)C1 ZINC000336088343 134077585 /nfs/dbraw/zinc/07/75/85/134077585.db2.gz JJCSHRQFTIQKBO-CQSZACIVSA-N 1 2 235.302 2.437 20 0 BEADLO c1cc(CSc2[nH+]cc3ccccn32)n[nH]1 ZINC000352165325 134090198 /nfs/dbraw/zinc/09/01/98/134090198.db2.gz DELVWXGMPIGBAK-UHFFFAOYSA-N 1 2 230.296 2.350 20 0 BEADLO O=C([C@H]1CC=CCC1)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000336168398 134114113 /nfs/dbraw/zinc/11/41/13/134114113.db2.gz OQQNQMOEHRPSQD-NWDGAFQWSA-N 1 2 245.326 2.430 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1nnc(C2CC2)s1 ZINC000336204295 134131410 /nfs/dbraw/zinc/13/14/10/134131410.db2.gz ZYVZYQDQXAPZFS-HTQZYQBOSA-N 1 2 223.345 2.398 20 0 BEADLO Cc1cccc(C[N@@H+]2C[C@@H](F)C[C@H]2CO)c1F ZINC000336213136 134135888 /nfs/dbraw/zinc/13/58/88/134135888.db2.gz FSTXNBMFEGZBAT-RYUDHWBXSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cccc(C[N@H+]2C[C@@H](F)C[C@H]2CO)c1F ZINC000336213136 134135889 /nfs/dbraw/zinc/13/58/89/134135889.db2.gz FSTXNBMFEGZBAT-RYUDHWBXSA-N 1 2 241.281 2.039 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1ccccc1F ZINC000172012753 134264496 /nfs/dbraw/zinc/26/44/96/134264496.db2.gz BRVQUQOTQPPIRH-LBPRGKRZSA-N 1 2 223.291 2.437 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1ccccc1F ZINC000172012753 134264497 /nfs/dbraw/zinc/26/44/97/134264497.db2.gz BRVQUQOTQPPIRH-LBPRGKRZSA-N 1 2 223.291 2.437 20 0 BEADLO CCCC[C@@H](CC)C[N@H+](C)Cc1nnc[nH]1 ZINC000183631386 134355395 /nfs/dbraw/zinc/35/53/95/134355395.db2.gz HYMDUCQHJNCXNI-LLVKDONJSA-N 1 2 224.352 2.453 20 0 BEADLO CCCC[C@@H](CC)C[N@@H+](C)Cc1nnc[nH]1 ZINC000183631386 134355396 /nfs/dbraw/zinc/35/53/96/134355396.db2.gz HYMDUCQHJNCXNI-LLVKDONJSA-N 1 2 224.352 2.453 20 0 BEADLO CC(C)C[C@H]1OCCC[C@H]1[NH2+]Cc1ccn[nH]1 ZINC000185197685 134372597 /nfs/dbraw/zinc/37/25/97/134372597.db2.gz DMLCWVVDWDAWLE-CHWSQXEVSA-N 1 2 237.347 2.093 20 0 BEADLO Cc1cc(N2CC[C@@H](C)[C@@H]2CO)nc(C(C)C)[nH+]1 ZINC000227168233 134374645 /nfs/dbraw/zinc/37/46/45/134374645.db2.gz KXKQZSBDAKTQRB-PWSUYJOCSA-N 1 2 249.358 2.116 20 0 BEADLO CO[C@@H]1C[C@H](Nc2cccc[nH+]2)C1(C)C ZINC000227822579 134389372 /nfs/dbraw/zinc/38/93/72/134389372.db2.gz YPIWFZKNIILKMY-VHSXEESVSA-N 1 2 206.289 2.307 20 0 BEADLO COC1CCC(Nc2cccc[nH+]2)CC1 ZINC000134876266 134438188 /nfs/dbraw/zinc/43/81/88/134438188.db2.gz SHRKRBWJJXNHEC-UHFFFAOYSA-N 1 2 206.289 2.451 20 0 BEADLO COC[C@H]([NH2+]Cc1ccc(C)nc1)c1ccco1 ZINC000156131610 134707080 /nfs/dbraw/zinc/70/70/80/134707080.db2.gz NVLUTPLNUMMKOB-ZDUSSCGKSA-N 1 2 246.310 2.460 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCOCC12CCC2 ZINC000135515476 134748167 /nfs/dbraw/zinc/74/81/67/134748167.db2.gz JDKKQPAXSODAGJ-UHFFFAOYSA-N 1 2 236.315 2.046 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCOCC12CCC2 ZINC000135515476 134748170 /nfs/dbraw/zinc/74/81/70/134748170.db2.gz JDKKQPAXSODAGJ-UHFFFAOYSA-N 1 2 236.315 2.046 20 0 BEADLO CCc1nc(C[N@H+]([C@@H](C)C2CC2)C2CC2)no1 ZINC000054317067 134760776 /nfs/dbraw/zinc/76/07/76/134760776.db2.gz LBNOQMOQLTVJFP-VIFPVBQESA-N 1 2 235.331 2.395 20 0 BEADLO CCc1nc(C[N@@H+]([C@@H](C)C2CC2)C2CC2)no1 ZINC000054317067 134760779 /nfs/dbraw/zinc/76/07/79/134760779.db2.gz LBNOQMOQLTVJFP-VIFPVBQESA-N 1 2 235.331 2.395 20 0 BEADLO CC(C)c1nc(C[N@@H+]2CCC[C@H]2C)no1 ZINC000076116529 135010882 /nfs/dbraw/zinc/01/08/82/135010882.db2.gz KIWIEOUYKCARKJ-SECBINFHSA-N 1 2 209.293 2.177 20 0 BEADLO CC(C)c1nc(C[N@H+]2CCC[C@H]2C)no1 ZINC000076116529 135010884 /nfs/dbraw/zinc/01/08/84/135010884.db2.gz KIWIEOUYKCARKJ-SECBINFHSA-N 1 2 209.293 2.177 20 0 BEADLO COc1cccc(Cl)c1C[NH2+]CCF ZINC000234910610 135045059 /nfs/dbraw/zinc/04/50/59/135045059.db2.gz LUIQPEKTBWSWSR-UHFFFAOYSA-N 1 2 217.671 2.408 20 0 BEADLO c1sc([C@@H]2COCC[NH2+]2)nc1C1CCC1 ZINC000258251018 135132072 /nfs/dbraw/zinc/13/20/72/135132072.db2.gz NUIAYQUYPFKFLP-VIFPVBQESA-N 1 2 224.329 2.072 20 0 BEADLO Cc1ccsc1C[N@@H+](C)Cc1nccc(N)n1 ZINC000258762078 135133984 /nfs/dbraw/zinc/13/39/84/135133984.db2.gz POJCJAFSZGNGQX-UHFFFAOYSA-N 1 2 248.355 2.061 20 0 BEADLO Cc1ccsc1C[N@H+](C)Cc1nccc(N)n1 ZINC000258762078 135133985 /nfs/dbraw/zinc/13/39/85/135133985.db2.gz POJCJAFSZGNGQX-UHFFFAOYSA-N 1 2 248.355 2.061 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2CCC(C)(C)C2)n1 ZINC000261543729 135184670 /nfs/dbraw/zinc/18/46/70/135184670.db2.gz IAOLTHVCJMFINS-MRVPVSSYSA-N 1 2 209.293 2.083 20 0 BEADLO C[NH2+]Cc1noc(C(C)(C)CC(C)C)n1 ZINC000261557019 135196827 /nfs/dbraw/zinc/19/68/27/135196827.db2.gz WREJBQLKPKHGCW-UHFFFAOYSA-N 1 2 211.309 2.113 20 0 BEADLO Cc1c[nH+]c(CN[C@H](C2CC2)C(F)(F)F)n1C ZINC000342322594 135264150 /nfs/dbraw/zinc/26/41/50/135264150.db2.gz MZKXBMQMIAWZRJ-SNVBAGLBSA-N 1 2 247.264 2.159 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)c1ncnc2ccsc21 ZINC000342415252 135267054 /nfs/dbraw/zinc/26/70/54/135267054.db2.gz OHHCHRHCWBOPOD-UHFFFAOYSA-N 1 2 245.311 2.051 20 0 BEADLO COc1cc(C)ccc1C[NH2+]Cc1ccn(C)n1 ZINC000342388682 135269785 /nfs/dbraw/zinc/26/97/85/135269785.db2.gz TVMYHSNVTLIHQD-UHFFFAOYSA-N 1 2 245.326 2.027 20 0 BEADLO CC(C)C(C[N@H+](C)Cc1nnc[nH]1)C(C)C ZINC000342789089 135318205 /nfs/dbraw/zinc/31/82/05/135318205.db2.gz XFEHIFVOXWRNLR-UHFFFAOYSA-N 1 2 224.352 2.165 20 0 BEADLO CC(C)C(C[N@@H+](C)Cc1nnc[nH]1)C(C)C ZINC000342789089 135318208 /nfs/dbraw/zinc/31/82/08/135318208.db2.gz XFEHIFVOXWRNLR-UHFFFAOYSA-N 1 2 224.352 2.165 20 0 BEADLO Cc1c[nH+]c(CN(C)Cc2ccc(F)cc2)n1C ZINC000342794655 135319735 /nfs/dbraw/zinc/31/97/35/135319735.db2.gz VAUJLUQJLGDJOZ-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO CCOCCC(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC000342795108 135320008 /nfs/dbraw/zinc/32/00/08/135320008.db2.gz YBDLBYIBFJXEFC-UHFFFAOYSA-N 1 2 247.298 2.236 20 0 BEADLO Cn1cnnc1C[N@H+](C)[C@@H]1/C=C/CCCCC1 ZINC000334147083 135322088 /nfs/dbraw/zinc/32/20/88/135322088.db2.gz SFTPCLBMWBPNJW-WAFBPQNNSA-N 1 2 234.347 2.136 20 0 BEADLO Cn1cnnc1C[N@@H+](C)[C@@H]1/C=C/CCCCC1 ZINC000334147083 135322089 /nfs/dbraw/zinc/32/20/89/135322089.db2.gz SFTPCLBMWBPNJW-WAFBPQNNSA-N 1 2 234.347 2.136 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@@H](C)[C@H]2C)nc1 ZINC000334167287 135324762 /nfs/dbraw/zinc/32/47/62/135324762.db2.gz AMHKVRNULKCXKJ-NEPJUHHUSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@@H](C)[C@H]2C)nc1 ZINC000334167287 135324764 /nfs/dbraw/zinc/32/47/64/135324764.db2.gz AMHKVRNULKCXKJ-NEPJUHHUSA-N 1 2 234.343 2.253 20 0 BEADLO [NH3+]CC[N@H+]1CCC[C@@]2(CCCc3ccccc32)C1 ZINC000262990136 135325437 /nfs/dbraw/zinc/32/54/37/135325437.db2.gz NOUSLCSHYOBKIR-INIZCTEOSA-N 1 2 244.382 2.315 20 0 BEADLO COC(=O)[C@H](C)[N@@H+]1Cc2ccccc2[C@H]1C ZINC000334278289 135333610 /nfs/dbraw/zinc/33/36/10/135333610.db2.gz DVSSENGBJWNDQB-ZJUUUORDSA-N 1 2 219.284 2.125 20 0 BEADLO COC(=O)[C@H](C)[N@H+]1Cc2ccccc2[C@H]1C ZINC000334278289 135333612 /nfs/dbraw/zinc/33/36/12/135333612.db2.gz DVSSENGBJWNDQB-ZJUUUORDSA-N 1 2 219.284 2.125 20 0 BEADLO CCC1CC([NH2+][C@@H]2CCO[C@@]3(CCOC3)C2)C1 ZINC000334354040 135370174 /nfs/dbraw/zinc/37/01/74/135370174.db2.gz YWCRPMRNSSIYHM-HHTDUIENSA-N 1 2 239.359 2.103 20 0 BEADLO CCC1CC([NH2+][C@H]2CCO[C@@]3(CCOC3)C2)C1 ZINC000334354041 135370460 /nfs/dbraw/zinc/37/04/60/135370460.db2.gz YWCRPMRNSSIYHM-YIOUJQMASA-N 1 2 239.359 2.103 20 0 BEADLO CC[C@H](C)CC(=O)Nc1ccc(N)[nH+]c1 ZINC000164513084 135388386 /nfs/dbraw/zinc/38/83/86/135388386.db2.gz WPOLLFUHPWKJLX-QMMMGPOBSA-N 1 2 207.277 2.039 20 0 BEADLO Cc1ccc(C[N@@H+]2CCOCC23CC3)cc1F ZINC000334401629 135390286 /nfs/dbraw/zinc/39/02/86/135390286.db2.gz GPNDLNGVNOLIIO-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1ccc(C[N@H+]2CCOCC23CC3)cc1F ZINC000334401629 135390287 /nfs/dbraw/zinc/39/02/87/135390287.db2.gz GPNDLNGVNOLIIO-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1sccc1CN1CCn2cc[nH+]c2C1 ZINC000334482453 135441203 /nfs/dbraw/zinc/44/12/03/135441203.db2.gz WVCRBDBGHZKHDH-UHFFFAOYSA-N 1 2 233.340 2.269 20 0 BEADLO CCCC(C)(C)CC(=O)NCc1[nH+]ccn1C ZINC000345885663 135901320 /nfs/dbraw/zinc/90/13/20/135901320.db2.gz MZIDYDCPMGQKDD-UHFFFAOYSA-N 1 2 237.347 2.253 20 0 BEADLO Fc1ccc(CCOCc2[nH]cc[nH+]2)cc1F ZINC000346623372 135943631 /nfs/dbraw/zinc/94/36/31/135943631.db2.gz WOCVLBUQQXKMIY-UHFFFAOYSA-N 1 2 238.237 2.447 20 0 BEADLO CN(Cc1[nH+]ccn1C)c1nccc2occc21 ZINC000347892356 136015232 /nfs/dbraw/zinc/01/52/32/136015232.db2.gz BINVTWVIDLORMN-UHFFFAOYSA-N 1 2 242.282 2.198 20 0 BEADLO Cc1nc(N2CC[C@@H](C3CC3)C2)cc[nH+]1 ZINC000335315665 136024562 /nfs/dbraw/zinc/02/45/62/136024562.db2.gz IKSNDRAKGZVIIU-LLVKDONJSA-N 1 2 203.289 2.021 20 0 BEADLO C[C@@H]1CCC[C@H](C)N(C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000335316062 136024719 /nfs/dbraw/zinc/02/47/19/136024719.db2.gz ORFSIJFHJDPIFM-NEPJUHHUSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H]1CCCCCN1C(=O)CCn1cc[nH+]c1 ZINC000335317009 136025081 /nfs/dbraw/zinc/02/50/81/136025081.db2.gz UZXROZXJFHGLLS-LBPRGKRZSA-N 1 2 235.331 2.064 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[NH2+][C@H]1C[C@@H]1CC ZINC000348155950 136040748 /nfs/dbraw/zinc/04/07/48/136040748.db2.gz ZWIHJYOUZVVMLW-SRVKXCTJSA-N 1 2 227.348 2.352 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)c1ccsc1 ZINC000348381398 136074102 /nfs/dbraw/zinc/07/41/02/136074102.db2.gz CUNMVMLZQAGEQF-UHFFFAOYSA-N 1 2 248.307 2.082 20 0 BEADLO Cc1c[nH+]cc(N[C@H]2COC(C)(C)C2)c1 ZINC000335358388 136075146 /nfs/dbraw/zinc/07/51/46/136075146.db2.gz OTPCWWPUQRLPTA-LLVKDONJSA-N 1 2 206.289 2.369 20 0 BEADLO CCC[C@H]1C[C@@H]1C(=O)NCc1c[nH+]ccc1OC ZINC000348414416 136077717 /nfs/dbraw/zinc/07/77/17/136077717.db2.gz ROKMTZCOFBHCOR-JQWIXIFHSA-N 1 2 248.326 2.143 20 0 BEADLO CC1(C(N)=O)C[NH+](Cc2c(F)cccc2F)C1 ZINC000335396846 136093110 /nfs/dbraw/zinc/09/31/10/136093110.db2.gz USXICPGAXBJPAW-UHFFFAOYSA-N 1 2 240.253 2.322 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H]1CCC(C)=C(C)C1 ZINC000335549586 136097762 /nfs/dbraw/zinc/09/77/62/136097762.db2.gz WSJFKMGQWRZKIO-LBPRGKRZSA-N 1 2 247.342 2.471 20 0 BEADLO Cn1cc(Cl)c(C[N@@H+]2CCC(C)(C)C2)n1 ZINC000335551097 136098155 /nfs/dbraw/zinc/09/81/55/136098155.db2.gz PTXXOGZRCNRXME-UHFFFAOYSA-N 1 2 227.739 2.305 20 0 BEADLO Cn1cc(Cl)c(C[N@H+]2CCC(C)(C)C2)n1 ZINC000335551097 136098156 /nfs/dbraw/zinc/09/81/56/136098156.db2.gz PTXXOGZRCNRXME-UHFFFAOYSA-N 1 2 227.739 2.305 20 0 BEADLO CCC[C@@H](CC)Nc1[nH+]cnc2c1cnn2C ZINC000050164903 322849618 /nfs/dbraw/zinc/84/96/18/322849618.db2.gz XHCIZJYJFDFUMX-SECBINFHSA-N 1 2 233.319 2.354 20 0 BEADLO CC[C@H](F)C[N@@H+]1CCc2ncsc2C1 ZINC000440529043 397931138 /nfs/dbraw/zinc/93/11/38/397931138.db2.gz GKEGKRDJMXPHDL-QMMMGPOBSA-N 1 2 214.309 2.249 20 0 BEADLO CC[C@H](F)C[N@H+]1CCc2ncsc2C1 ZINC000440529043 397931139 /nfs/dbraw/zinc/93/11/39/397931139.db2.gz GKEGKRDJMXPHDL-QMMMGPOBSA-N 1 2 214.309 2.249 20 0 BEADLO COC(=O)[C@@H]([NH2+]CC1(C)CC1)c1ccccc1 ZINC000358965224 397945445 /nfs/dbraw/zinc/94/54/45/397945445.db2.gz MMTUNIFVKVZJBS-LBPRGKRZSA-N 1 2 233.311 2.290 20 0 BEADLO FC1(F)CC[C@H](COCc2[nH]cc[nH+]2)C1 ZINC000649528075 397919778 /nfs/dbraw/zinc/91/97/78/397919778.db2.gz FTTCJJKMRHPERO-QMMMGPOBSA-N 1 2 216.231 2.362 20 0 BEADLO C[C@H](CNc1cc[nH+]c(C2CC2)n1)C(F)(F)F ZINC000355784060 397922761 /nfs/dbraw/zinc/92/27/61/397922761.db2.gz NXCATUMFHJGYHP-SSDOTTSWSA-N 1 2 245.248 2.386 20 0 BEADLO CCCC[N@@H+]1CC(=O)NC12C[C@H](C)C[C@@H](C)C2 ZINC000439142895 397923306 /nfs/dbraw/zinc/92/33/06/397923306.db2.gz QONGPTRRBVMPST-VXGBXAGGSA-N 1 2 238.375 2.371 20 0 BEADLO CCCC[N@H+]1CC(=O)NC12C[C@H](C)C[C@@H](C)C2 ZINC000439142895 397923309 /nfs/dbraw/zinc/92/33/09/397923309.db2.gz QONGPTRRBVMPST-VXGBXAGGSA-N 1 2 238.375 2.371 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@H](OC(C)C)C2)nc1 ZINC000649702651 398050134 /nfs/dbraw/zinc/05/01/34/398050134.db2.gz JTNZIDXPSDUXNM-ZDUSSCGKSA-N 1 2 249.358 2.174 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@H](OC(C)C)C2)nc1 ZINC000649702651 398050136 /nfs/dbraw/zinc/05/01/36/398050136.db2.gz JTNZIDXPSDUXNM-ZDUSSCGKSA-N 1 2 249.358 2.174 20 0 BEADLO CCCn1cc(C[NH2+][C@H](C)C(F)F)cn1 ZINC000389913508 397998175 /nfs/dbraw/zinc/99/81/75/397998175.db2.gz LMDJFWHYCMVKGT-MRVPVSSYSA-N 1 2 217.263 2.036 20 0 BEADLO CCC[C@@H]1CCC[C@H]1c1nc(C[NH2+]C)no1 ZINC000414648104 398001285 /nfs/dbraw/zinc/00/12/85/398001285.db2.gz VECLUDGCDSAGTD-NXEZZACHSA-N 1 2 223.320 2.473 20 0 BEADLO CCc1cc[nH+]cc1NCc1ccnn1CC ZINC000650243088 398005184 /nfs/dbraw/zinc/00/51/84/398005184.db2.gz JYZMBPIOVQXGLT-UHFFFAOYSA-N 1 2 230.315 2.473 20 0 BEADLO CC(C)Oc1ccnc(C[N@@H+]2CC[C@@H](F)C2)c1 ZINC000649621663 398005191 /nfs/dbraw/zinc/00/51/91/398005191.db2.gz JJDFWDBCHAZCRH-LLVKDONJSA-N 1 2 238.306 2.413 20 0 BEADLO CC(C)Oc1ccnc(C[N@H+]2CC[C@@H](F)C2)c1 ZINC000649621663 398005197 /nfs/dbraw/zinc/00/51/97/398005197.db2.gz JJDFWDBCHAZCRH-LLVKDONJSA-N 1 2 238.306 2.413 20 0 BEADLO CC(C)Oc1cc[nH+]c(CN2CC[C@@H](F)C2)c1 ZINC000649621663 398005201 /nfs/dbraw/zinc/00/52/01/398005201.db2.gz JJDFWDBCHAZCRH-LLVKDONJSA-N 1 2 238.306 2.413 20 0 BEADLO COCc1cc[nH+]c(NCc2c(C)noc2C)c1 ZINC000650244481 398005573 /nfs/dbraw/zinc/00/55/73/398005573.db2.gz AVRYJOOIRUTVTC-UHFFFAOYSA-N 1 2 247.298 2.445 20 0 BEADLO COCc1cc[nH+]c(NCC2(C)CC2)c1 ZINC000650243481 398006556 /nfs/dbraw/zinc/00/65/56/398006556.db2.gz ANYRQQOJFUCHCU-UHFFFAOYSA-N 1 2 206.289 2.440 20 0 BEADLO CC(C)O[C@@H]1CCC[N@H+](CC(F)F)C1 ZINC000649701092 398049271 /nfs/dbraw/zinc/04/92/71/398049271.db2.gz UWZPCADXUVEZLK-SECBINFHSA-N 1 2 207.264 2.141 20 0 BEADLO CC(C)O[C@@H]1CCC[N@@H+](CC(F)F)C1 ZINC000649701092 398049274 /nfs/dbraw/zinc/04/92/74/398049274.db2.gz UWZPCADXUVEZLK-SECBINFHSA-N 1 2 207.264 2.141 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1)c1ncn(C)n1 ZINC000275598723 398040971 /nfs/dbraw/zinc/04/09/71/398040971.db2.gz IYESIOPREACWSR-VHSXEESVSA-N 1 2 248.305 2.366 20 0 BEADLO CCO[C@H]1C[C@@H](N(C)c2cc[nH+]c(C)n2)C1(C)C ZINC000361042717 397971558 /nfs/dbraw/zinc/97/15/58/397971558.db2.gz CEWUYSRFQCMRMY-NEPJUHHUSA-N 1 2 249.358 2.425 20 0 BEADLO C[C@H]1CC[C@H](C[N@@H+]2CCCC(F)(F)C2)O1 ZINC000649695284 398042798 /nfs/dbraw/zinc/04/27/98/398042798.db2.gz PQQWJEYSARXHOS-VHSXEESVSA-N 1 2 219.275 2.285 20 0 BEADLO C[C@H]1CC[C@H](C[N@H+]2CCCC(F)(F)C2)O1 ZINC000649695284 398042802 /nfs/dbraw/zinc/04/28/02/398042802.db2.gz PQQWJEYSARXHOS-VHSXEESVSA-N 1 2 219.275 2.285 20 0 BEADLO CCc1nc(C[N@@H+]2CCOCC[C@H]2C)cs1 ZINC000362047089 397980385 /nfs/dbraw/zinc/98/03/85/397980385.db2.gz QCARSBRVNQTZPK-SNVBAGLBSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nc(C[N@H+]2CCOCC[C@H]2C)cs1 ZINC000362047089 397980391 /nfs/dbraw/zinc/98/03/91/397980391.db2.gz QCARSBRVNQTZPK-SNVBAGLBSA-N 1 2 240.372 2.316 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C1C[C@H](C)C[C@@H](C)C1 ZINC000272670069 397982891 /nfs/dbraw/zinc/98/28/91/397982891.db2.gz KLRQTTYOGZMKLT-NXEZZACHSA-N 1 2 249.358 2.407 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ncc(C)s2)[C@H](C)CO1 ZINC000649735308 398077094 /nfs/dbraw/zinc/07/70/94/398077094.db2.gz JFDVWAGVRKDWKQ-MWLCHTKSSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ncc(C)s2)[C@H](C)CO1 ZINC000649735308 398077095 /nfs/dbraw/zinc/07/70/95/398077095.db2.gz JFDVWAGVRKDWKQ-MWLCHTKSSA-N 1 2 240.372 2.451 20 0 BEADLO CC1(C)C[C@@H](SCc2ccc[nH+]c2N)CO1 ZINC000603359377 398090506 /nfs/dbraw/zinc/09/05/06/398090506.db2.gz OBQDTICQSAFYIK-SNVBAGLBSA-N 1 2 238.356 2.465 20 0 BEADLO CCC[N@H+](CC(F)F)C[C@H](O)CC(F)(F)F ZINC000189028475 398096603 /nfs/dbraw/zinc/09/66/03/398096603.db2.gz AWRVFBOHEIUASI-SSDOTTSWSA-N 1 2 249.223 2.277 20 0 BEADLO CCC[N@@H+](CC(F)F)C[C@H](O)CC(F)(F)F ZINC000189028475 398096607 /nfs/dbraw/zinc/09/66/07/398096607.db2.gz AWRVFBOHEIUASI-SSDOTTSWSA-N 1 2 249.223 2.277 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1cc(Cl)cs1 ZINC000280195386 398054243 /nfs/dbraw/zinc/05/42/43/398054243.db2.gz BBZJBEKEGOVRMU-SSDOTTSWSA-N 1 2 247.747 2.395 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1cc(Cl)cs1 ZINC000280195386 398054246 /nfs/dbraw/zinc/05/42/46/398054246.db2.gz BBZJBEKEGOVRMU-SSDOTTSWSA-N 1 2 247.747 2.395 20 0 BEADLO CC(C)n1nccc1C[N@H+](C)Cc1cccnc1 ZINC000280196047 398054440 /nfs/dbraw/zinc/05/44/40/398054440.db2.gz HMRTWROHRUCKAL-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO CC(C)n1nccc1C[N@@H+](C)Cc1cccnc1 ZINC000280196047 398054442 /nfs/dbraw/zinc/05/44/42/398054442.db2.gz HMRTWROHRUCKAL-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@@H+]1Cc1ccon1 ZINC000649715849 398057959 /nfs/dbraw/zinc/05/79/59/398057959.db2.gz NRODFKWLJMHSPU-NSHDSACASA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@H+]1Cc1ccon1 ZINC000649715849 398057964 /nfs/dbraw/zinc/05/79/64/398057964.db2.gz NRODFKWLJMHSPU-NSHDSACASA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@@H+]1Cc1ncc(C)o1 ZINC000649716209 398058118 /nfs/dbraw/zinc/05/81/18/398058118.db2.gz XAUVZITWNFLLKQ-LLVKDONJSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@H+]1Cc1ncc(C)o1 ZINC000649716209 398058123 /nfs/dbraw/zinc/05/81/23/398058123.db2.gz XAUVZITWNFLLKQ-LLVKDONJSA-N 1 2 238.331 2.372 20 0 BEADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1ncc[nH]1)CCO2 ZINC000068984876 398099389 /nfs/dbraw/zinc/09/93/89/398099389.db2.gz RKVOZXNTILAXBB-NSHDSACASA-N 1 2 247.273 2.162 20 0 BEADLO C[C@@H](O)CCCOc1cccc(-n2cc[nH+]c2)c1 ZINC000418887529 398106161 /nfs/dbraw/zinc/10/61/61/398106161.db2.gz SCWQHSKHZXKNKE-GFCCVEGCSA-N 1 2 246.310 2.412 20 0 BEADLO Cc1cc(NC(=O)Nc2cc[nH+]c(C)c2)n[nH]1 ZINC000192288467 398108257 /nfs/dbraw/zinc/10/82/57/398108257.db2.gz WDIKKVHYLCJAGO-UHFFFAOYSA-N 1 2 231.259 2.066 20 0 BEADLO C[C@H]1CC[N@H+](Cc2noc(C3CC3)n2)C[C@H]1C ZINC000245905521 398118999 /nfs/dbraw/zinc/11/89/99/398118999.db2.gz LRWVULBAIMGASU-VHSXEESVSA-N 1 2 235.331 2.425 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2noc(C3CC3)n2)C[C@H]1C ZINC000245905521 398119001 /nfs/dbraw/zinc/11/90/01/398119001.db2.gz LRWVULBAIMGASU-VHSXEESVSA-N 1 2 235.331 2.425 20 0 BEADLO Cc1nc(N[C@@H]2[C@@H]3CCO[C@H]3C23CCC3)cc[nH+]1 ZINC000246227136 398121087 /nfs/dbraw/zinc/12/10/87/398121087.db2.gz WFPODJAIOWQGJC-CYZMBNFOSA-N 1 2 245.326 2.155 20 0 BEADLO Cc1ccoc1C[NH2+][C@H](C)c1cc(C)n(C)n1 ZINC000294339580 398126488 /nfs/dbraw/zinc/12/64/88/398126488.db2.gz PHUBDEFWSCRXMU-LLVKDONJSA-N 1 2 233.315 2.481 20 0 BEADLO C[C@H](O)CNc1ccc([NH+]2CCCC2)cc1 ZINC000062996034 1172794673 /nfs/dbraw/zinc/79/46/73/1172794673.db2.gz CYCYFEZDBIJEHQ-NSHDSACASA-N 1 2 220.316 2.080 20 0 BEADLO CCc1noc(C[N@@H+]2CCC(F)(F)[C@H](C)C2)n1 ZINC000685591169 487561058 /nfs/dbraw/zinc/56/10/58/487561058.db2.gz SEZSLIKGUZRFFF-MRVPVSSYSA-N 1 2 245.273 2.109 20 0 BEADLO CCc1noc(C[N@H+]2CCC(F)(F)[C@H](C)C2)n1 ZINC000685591169 487561063 /nfs/dbraw/zinc/56/10/63/487561063.db2.gz SEZSLIKGUZRFFF-MRVPVSSYSA-N 1 2 245.273 2.109 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cc(C(C)C)no2)nn1 ZINC001649415595 1172872473 /nfs/dbraw/zinc/87/24/73/1172872473.db2.gz UZGPJMGWWBEBRR-UHFFFAOYSA-N 1 2 246.314 2.186 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+]Cc2ccc(C)nn2)s1 ZINC001650659609 1172887674 /nfs/dbraw/zinc/88/76/74/1172887674.db2.gz DALPMGSWAPMNTD-SNVBAGLBSA-N 1 2 248.355 2.401 20 0 BEADLO Cc1cc(CNc2cnccc2CO)cc(C)[nH+]1 ZINC001650816624 1172903206 /nfs/dbraw/zinc/90/32/06/1172903206.db2.gz KGBIWJDCQMXYLX-UHFFFAOYSA-N 1 2 243.310 2.198 20 0 BEADLO c1cn(-c2ccccc2OC[C@H]2CCOC2)c[nH+]1 ZINC000530955677 322902690 /nfs/dbraw/zinc/90/26/90/322902690.db2.gz AKVBEYFOGZTACX-LBPRGKRZSA-N 1 2 244.294 2.288 20 0 BEADLO Cc1cc(NC(=O)c2cc(C3CC3)[nH]n2)cc[nH+]1 ZINC000079113773 487582710 /nfs/dbraw/zinc/58/27/10/487582710.db2.gz WNYSKBBYZZCMJD-UHFFFAOYSA-N 1 2 242.282 2.243 20 0 BEADLO CC(C)OCCSCCn1cc[nH+]c1 ZINC000090201162 167250720 /nfs/dbraw/zinc/25/07/20/167250720.db2.gz XWJCYWDABFKBIU-UHFFFAOYSA-N 1 2 214.334 2.041 20 0 BEADLO CC[C@H](C)CCC(=O)N[C@@H]1CCc2c[nH+]cn2C1 ZINC000672156777 487589605 /nfs/dbraw/zinc/58/96/05/487589605.db2.gz UNKGRKLIYQPZFB-NWDGAFQWSA-N 1 2 249.358 2.140 20 0 BEADLO O[C@@H]1CC[N@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1(F)F ZINC000661411868 487597427 /nfs/dbraw/zinc/59/74/27/487597427.db2.gz BRGQGFRCMXANPO-WRWGMCAJSA-N 1 2 245.313 2.125 20 0 BEADLO O[C@@H]1CC[N@@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC1(F)F ZINC000661411868 487597433 /nfs/dbraw/zinc/59/74/33/487597433.db2.gz BRGQGFRCMXANPO-WRWGMCAJSA-N 1 2 245.313 2.125 20 0 BEADLO Cc1[nH]c(CNc2cncc(C)c2)[nH+]c1C ZINC000517588446 322920007 /nfs/dbraw/zinc/92/00/07/322920007.db2.gz LLKBSJBVYZDKQR-UHFFFAOYSA-N 1 2 216.288 2.342 20 0 BEADLO COc1cc(C)nc(C[NH2+]Cc2ccccn2)c1 ZINC000214108199 487601753 /nfs/dbraw/zinc/60/17/53/487601753.db2.gz KTSFGUMXUWVNRV-UHFFFAOYSA-N 1 2 243.310 2.083 20 0 BEADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cncnc2)on1 ZINC000535787459 487605800 /nfs/dbraw/zinc/60/58/00/487605800.db2.gz WCJWNKYNKQFUQY-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cncnc2)on1 ZINC000535787459 487605801 /nfs/dbraw/zinc/60/58/01/487605801.db2.gz WCJWNKYNKQFUQY-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO CC(C)SCC[N@H+]1CCC[C@H]1c1ncon1 ZINC000374798288 167326184 /nfs/dbraw/zinc/32/61/84/167326184.db2.gz ZYYLXOHUVUOGFC-JTQLQIEISA-N 1 2 241.360 2.348 20 0 BEADLO CC(C)SCC[N@@H+]1CCC[C@H]1c1ncon1 ZINC000374798288 167326182 /nfs/dbraw/zinc/32/61/82/167326182.db2.gz ZYYLXOHUVUOGFC-JTQLQIEISA-N 1 2 241.360 2.348 20 0 BEADLO Cc1nc(C[N@H+](C)CC2=CCSC2)co1 ZINC000662266543 409567050 /nfs/dbraw/zinc/56/70/50/409567050.db2.gz IHSPQIBXXRTRSQ-UHFFFAOYSA-N 1 2 224.329 2.088 20 0 BEADLO Cc1nc(C[N@@H+](C)CC2=CCSC2)co1 ZINC000662266543 409567051 /nfs/dbraw/zinc/56/70/51/409567051.db2.gz IHSPQIBXXRTRSQ-UHFFFAOYSA-N 1 2 224.329 2.088 20 0 BEADLO C[N@@H+](Cc1noc(C2CC2)n1)C[C@@H]1CC1(C)C ZINC000662348152 409668377 /nfs/dbraw/zinc/66/83/77/409668377.db2.gz QTFABCUXJRGVGK-JTQLQIEISA-N 1 2 235.331 2.425 20 0 BEADLO C[N@H+](Cc1noc(C2CC2)n1)C[C@@H]1CC1(C)C ZINC000662348152 409668380 /nfs/dbraw/zinc/66/83/80/409668380.db2.gz QTFABCUXJRGVGK-JTQLQIEISA-N 1 2 235.331 2.425 20 0 BEADLO CCCN(C(=O)[C@@H]1CCc2[nH+]ccn2C1)C(C)C ZINC000655238701 409684203 /nfs/dbraw/zinc/68/42/03/409684203.db2.gz IIHRFNQCLQCCMV-GFCCVEGCSA-N 1 2 249.358 2.093 20 0 BEADLO CC[N@H+](Cc1cn(C)cn1)Cc1occc1C ZINC000660805647 409769658 /nfs/dbraw/zinc/76/96/58/409769658.db2.gz FAZGWFMUDGRPBK-UHFFFAOYSA-N 1 2 233.315 2.344 20 0 BEADLO CC[N@@H+](Cc1cn(C)cn1)Cc1occc1C ZINC000660805647 409769666 /nfs/dbraw/zinc/76/96/66/409769666.db2.gz FAZGWFMUDGRPBK-UHFFFAOYSA-N 1 2 233.315 2.344 20 0 BEADLO CCC(C)(C)CC[N@H+](C)Cc1n[nH]c(=O)o1 ZINC000660843917 409838254 /nfs/dbraw/zinc/83/82/54/409838254.db2.gz JDJBJQVOHJKEEQ-UHFFFAOYSA-N 1 2 227.308 2.033 20 0 BEADLO CCC(C)(C)CC[N@@H+](C)Cc1n[nH]c(=O)o1 ZINC000660843917 409838264 /nfs/dbraw/zinc/83/82/64/409838264.db2.gz JDJBJQVOHJKEEQ-UHFFFAOYSA-N 1 2 227.308 2.033 20 0 BEADLO CCn1cncc1C[N@@H+]1C[C@H](C)OCC12CCC2 ZINC000651974941 409964341 /nfs/dbraw/zinc/96/43/41/409964341.db2.gz VDADMWBMBWJPGE-LBPRGKRZSA-N 1 2 249.358 2.046 20 0 BEADLO CCn1cncc1C[N@H+]1C[C@H](C)OCC12CCC2 ZINC000651974941 409964349 /nfs/dbraw/zinc/96/43/49/409964349.db2.gz VDADMWBMBWJPGE-LBPRGKRZSA-N 1 2 249.358 2.046 20 0 BEADLO CSc1ccc[nH+]c1N[C@@H]1CCCOC1 ZINC000651971435 409943003 /nfs/dbraw/zinc/94/30/03/409943003.db2.gz FNTJTWVQNCYVIU-SECBINFHSA-N 1 2 224.329 2.394 20 0 BEADLO CSc1ccc[nH+]c1N[C@H]1CCOC1 ZINC000651971743 409944308 /nfs/dbraw/zinc/94/43/08/409944308.db2.gz SNXDXBBDCLIWCE-QMMMGPOBSA-N 1 2 210.302 2.004 20 0 BEADLO CCO[C@@]1(C)C[C@H]1Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000624556063 410041896 /nfs/dbraw/zinc/04/18/96/410041896.db2.gz QLZZIIHIOJCCNV-YGRLFVJLSA-N 1 2 249.358 2.175 20 0 BEADLO FC(F)(F)Cn1ccnc1C[NH+]1CCCCC1 ZINC000075638701 410052844 /nfs/dbraw/zinc/05/28/44/410052844.db2.gz RGHOXBVRVMDBMZ-UHFFFAOYSA-N 1 2 247.264 2.431 20 0 BEADLO FC(F)(F)Cn1cc[nH+]c1CN1CCCCC1 ZINC000075638701 410052851 /nfs/dbraw/zinc/05/28/51/410052851.db2.gz RGHOXBVRVMDBMZ-UHFFFAOYSA-N 1 2 247.264 2.431 20 0 BEADLO Clc1cccc(C[NH+]2CCSCC2)n1 ZINC000075638578 410053438 /nfs/dbraw/zinc/05/34/38/410053438.db2.gz NRGUXLJTMHBEMN-UHFFFAOYSA-N 1 2 228.748 2.284 20 0 BEADLO CCc1cc[nH+]cc1N[C@@H](C)CCOC ZINC000651979342 410112881 /nfs/dbraw/zinc/11/28/81/410112881.db2.gz KCQDWBFISUPYBP-JTQLQIEISA-N 1 2 208.305 2.481 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CCC[C@H](F)C1)c1[nH]cc[nH+]1 ZINC000655401980 410206511 /nfs/dbraw/zinc/20/65/11/410206511.db2.gz ONGPOUKKEWMJCN-UTLUCORTSA-N 1 2 239.294 2.115 20 0 BEADLO CCOc1ccc([C@H](C)[NH2+]Cc2cnn[nH]2)cc1 ZINC000398330071 410323395 /nfs/dbraw/zinc/32/33/95/410323395.db2.gz HLFLBQIJUKORDI-JTQLQIEISA-N 1 2 246.314 2.054 20 0 BEADLO CCOc1ccc([C@H](C)[NH2+]Cc2c[nH]nn2)cc1 ZINC000398330071 410323403 /nfs/dbraw/zinc/32/34/03/410323403.db2.gz HLFLBQIJUKORDI-JTQLQIEISA-N 1 2 246.314 2.054 20 0 BEADLO CCOc1ccc([C@H](C)[NH2+]Cc2cn[nH]n2)cc1 ZINC000398330071 410323411 /nfs/dbraw/zinc/32/34/11/410323411.db2.gz HLFLBQIJUKORDI-JTQLQIEISA-N 1 2 246.314 2.054 20 0 BEADLO C[C@@H]1COCCN1c1[nH+]ccc2c(N)cccc21 ZINC000663845749 410357792 /nfs/dbraw/zinc/35/77/92/410357792.db2.gz ADXBYERLHJNWIH-SNVBAGLBSA-N 1 2 243.310 2.042 20 0 BEADLO C[C@H](CC(=O)N1CCC[C@H](C)C1)n1cc[nH+]c1 ZINC000650985525 410674670 /nfs/dbraw/zinc/67/46/70/410674670.db2.gz SSCNGPSGRXQJKQ-NWDGAFQWSA-N 1 2 235.331 2.093 20 0 BEADLO CC(C)CCC[N@@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000661407133 410620293 /nfs/dbraw/zinc/62/02/93/410620293.db2.gz MIWNEODMPHCVMT-SNVBAGLBSA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)CCC[N@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000661407133 410620298 /nfs/dbraw/zinc/62/02/98/410620298.db2.gz MIWNEODMPHCVMT-SNVBAGLBSA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)c1nc(C[N@H+](C)CCCO)cs1 ZINC000300877874 410636653 /nfs/dbraw/zinc/63/66/53/410636653.db2.gz YOKBLEUSWCTAJL-UHFFFAOYSA-N 1 2 228.361 2.081 20 0 BEADLO CC(C)c1nc(C[N@@H+](C)CCCO)cs1 ZINC000300877874 410636661 /nfs/dbraw/zinc/63/66/61/410636661.db2.gz YOKBLEUSWCTAJL-UHFFFAOYSA-N 1 2 228.361 2.081 20 0 BEADLO COc1ccc[nH+]c1N[C@H](C)[C@H]1CCCCO1 ZINC000393625024 410751109 /nfs/dbraw/zinc/75/11/09/410751109.db2.gz VRRCATJEFWKZKG-GHMZBOCLSA-N 1 2 236.315 2.460 20 0 BEADLO C[C@H]1CC[N@H+](CC(=O)c2ccccc2F)C1 ZINC000040719197 410885307 /nfs/dbraw/zinc/88/53/07/410885307.db2.gz CJDOTFNTDYIXOS-JTQLQIEISA-N 1 2 221.275 2.350 20 0 BEADLO C[C@H]1CC[N@@H+](CC(=O)c2ccccc2F)C1 ZINC000040719197 410885313 /nfs/dbraw/zinc/88/53/13/410885313.db2.gz CJDOTFNTDYIXOS-JTQLQIEISA-N 1 2 221.275 2.350 20 0 BEADLO CCC[C@@H](C)N(C)c1cc(CO)cc[nH+]1 ZINC000040878619 410893973 /nfs/dbraw/zinc/89/39/73/410893973.db2.gz KWSJGEYAWIVLHA-SNVBAGLBSA-N 1 2 208.305 2.199 20 0 BEADLO CC(C)[NH2+]c1ccc(OCCCO)cc1 ZINC000289258391 167146675 /nfs/dbraw/zinc/14/66/75/167146675.db2.gz FOQSCUVIGZQXGJ-UHFFFAOYSA-N 1 2 209.289 2.268 20 0 BEADLO CC(C)OC(=O)[C@@H](C)[N@@H+]1CCc2ccccc2C1 ZINC000340726888 167168470 /nfs/dbraw/zinc/16/84/70/167168470.db2.gz OSEDZTKAJQDCPG-GFCCVEGCSA-N 1 2 247.338 2.385 20 0 BEADLO CC(C)OC(=O)[C@@H](C)[N@H+]1CCc2ccccc2C1 ZINC000340726888 167168474 /nfs/dbraw/zinc/16/84/74/167168474.db2.gz OSEDZTKAJQDCPG-GFCCVEGCSA-N 1 2 247.338 2.385 20 0 BEADLO CC(C)CN(C(=O)[C@@H](C)n1cc[nH+]c1)C(C)C ZINC000066645642 1173035571 /nfs/dbraw/zinc/03/55/71/1173035571.db2.gz KBEKEZJPCHPIFF-GFCCVEGCSA-N 1 2 237.347 2.337 20 0 BEADLO CC(C)OCCNc1cc[nH+]c2ccncc12 ZINC000273384005 167247301 /nfs/dbraw/zinc/24/73/01/167247301.db2.gz ZFRLDJVRUBCCRI-UHFFFAOYSA-N 1 2 231.299 2.467 20 0 BEADLO CC(C)OCCNc1cc[nH+]c(C2CC2)n1 ZINC000273197730 167247546 /nfs/dbraw/zinc/24/75/46/167247546.db2.gz DQESIBXRVCEYRO-UHFFFAOYSA-N 1 2 221.304 2.191 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1C[C@@H](OC)C12CCC2 ZINC000651302509 410911578 /nfs/dbraw/zinc/91/15/78/410911578.db2.gz XGHADMAKMDUJHX-NWDGAFQWSA-N 1 2 248.326 2.460 20 0 BEADLO CC(C)[C@@H](C)C(=O)NCc1ccc(N(C)C)[nH+]c1 ZINC000353745045 167352655 /nfs/dbraw/zinc/35/26/55/167352655.db2.gz JKPYGIDVEDHWQQ-LLVKDONJSA-N 1 2 249.358 2.056 20 0 BEADLO FC1(F)CCC[C@@H]1N[C@H]1CCn2cc[nH+]c21 ZINC000398068931 410940770 /nfs/dbraw/zinc/94/07/70/410940770.db2.gz DCHXUSZJONNXSS-IUCAKERBSA-N 1 2 227.258 2.105 20 0 BEADLO CC(C)[C@@H]([NH2+]CCF)c1nc(C2CC2)no1 ZINC000309539604 167429920 /nfs/dbraw/zinc/42/99/20/167429920.db2.gz DNUMEVIFXLSJCH-SECBINFHSA-N 1 2 227.283 2.203 20 0 BEADLO CCOc1ccc([C@@H](C)[NH2+]Cc2cnn[nH]2)cc1 ZINC000398330072 410957675 /nfs/dbraw/zinc/95/76/75/410957675.db2.gz HLFLBQIJUKORDI-SNVBAGLBSA-N 1 2 246.314 2.054 20 0 BEADLO CCOc1ccc([C@@H](C)[NH2+]Cc2c[nH]nn2)cc1 ZINC000398330072 410957683 /nfs/dbraw/zinc/95/76/83/410957683.db2.gz HLFLBQIJUKORDI-SNVBAGLBSA-N 1 2 246.314 2.054 20 0 BEADLO CCOc1ccc([C@@H](C)[NH2+]Cc2cn[nH]n2)cc1 ZINC000398330072 410957687 /nfs/dbraw/zinc/95/76/87/410957687.db2.gz HLFLBQIJUKORDI-SNVBAGLBSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1nc(N2CCC23CCCC3)cc[nH+]1 ZINC000651373602 410959417 /nfs/dbraw/zinc/95/94/17/410959417.db2.gz NIPPGSQFYPRIFF-UHFFFAOYSA-N 1 2 203.289 2.308 20 0 BEADLO CCc1cc(N[C@@H](C)CCCCO)nc[nH+]1 ZINC000398415424 410964915 /nfs/dbraw/zinc/96/49/15/410964915.db2.gz FYAQTQLNZJNIDM-JTQLQIEISA-N 1 2 223.320 2.002 20 0 BEADLO CC[C@H]1CN(c2cc[nH+]c(C)n2)[C@@H](CC)CO1 ZINC000651397597 410980323 /nfs/dbraw/zinc/98/03/23/410980323.db2.gz TVDTUIRPWXKZMK-RYUDHWBXSA-N 1 2 235.331 2.179 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]CCC(C)(F)F ZINC000651360413 410947574 /nfs/dbraw/zinc/94/75/74/410947574.db2.gz XKZOSVFKIMGSDV-ZETCQYMHSA-N 1 2 217.263 2.414 20 0 BEADLO CO[C@@H]([C@@H](C)[NH2+][C@@H](C)c1cn[nH]c1C)C1CC1 ZINC000651463721 411048254 /nfs/dbraw/zinc/04/82/54/411048254.db2.gz LSUVMHPZNMROCR-PLMOITTCSA-N 1 2 237.347 2.182 20 0 BEADLO C[C@H](CCO)N(C)c1cc(C(F)(F)F)cc[nH+]1 ZINC000651471371 411052682 /nfs/dbraw/zinc/05/26/82/411052682.db2.gz RQFXEEXKCGRIJC-MRVPVSSYSA-N 1 2 248.248 2.308 20 0 BEADLO CCc1cc(N[C@@H](C)COCC2CC2)nc[nH+]1 ZINC000651457815 411040067 /nfs/dbraw/zinc/04/00/67/411040067.db2.gz MEMZFNLSMROYFI-JTQLQIEISA-N 1 2 235.331 2.266 20 0 BEADLO CC[C@H](NC(=O)[C@@H]1C[C@H]1C1CCC1)c1[nH]cc[nH+]1 ZINC000651752923 411141710 /nfs/dbraw/zinc/14/17/10/411141710.db2.gz ZKRRUBYZXCNKSM-TUAOUCFPSA-N 1 2 247.342 2.413 20 0 BEADLO CCOC1(C)C[NH+](Cc2cc3cnccc3o2)C1 ZINC000651828319 411146435 /nfs/dbraw/zinc/14/64/35/411146435.db2.gz BSFJDZBBODZLBY-UHFFFAOYSA-N 1 2 246.310 2.439 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2nc(C)no2)c(C)o1 ZINC000038034228 411146939 /nfs/dbraw/zinc/14/69/39/411146939.db2.gz AVGJISTUHVKIQA-QMMMGPOBSA-N 1 2 235.287 2.439 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@@H](CC)OC[C@H]2C)cn1 ZINC000651932183 411150745 /nfs/dbraw/zinc/15/07/45/411150745.db2.gz NKBPJSUWYNRQLL-DGCLKSJQSA-N 1 2 249.358 2.038 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@@H](CC)OC[C@H]2C)cn1 ZINC000651932183 411150746 /nfs/dbraw/zinc/15/07/46/411150746.db2.gz NKBPJSUWYNRQLL-DGCLKSJQSA-N 1 2 249.358 2.038 20 0 BEADLO CCn1cc(N[C@H]2CCCn3cc[nH+]c32)cn1 ZINC000655748695 411161685 /nfs/dbraw/zinc/16/16/85/411161685.db2.gz GTFCQSNASQDRFB-NSHDSACASA-N 1 2 231.303 2.047 20 0 BEADLO F[C@@H]1CCC[N@H+](Cc2[nH]nc3ccccc32)C1 ZINC000652077771 411109590 /nfs/dbraw/zinc/10/95/90/411109590.db2.gz QHBHGRWBBYVCGQ-SNVBAGLBSA-N 1 2 233.290 2.497 20 0 BEADLO F[C@@H]1CCC[N@@H+](Cc2[nH]nc3ccccc32)C1 ZINC000652077771 411109592 /nfs/dbraw/zinc/10/95/92/411109592.db2.gz QHBHGRWBBYVCGQ-SNVBAGLBSA-N 1 2 233.290 2.497 20 0 BEADLO F[C@@H]1CCC[N@H+](Cc2n[nH]c3ccccc32)C1 ZINC000652077771 411109593 /nfs/dbraw/zinc/10/95/93/411109593.db2.gz QHBHGRWBBYVCGQ-SNVBAGLBSA-N 1 2 233.290 2.497 20 0 BEADLO F[C@@H]1CCC[N@@H+](Cc2n[nH]c3ccccc32)C1 ZINC000652077771 411109594 /nfs/dbraw/zinc/10/95/94/411109594.db2.gz QHBHGRWBBYVCGQ-SNVBAGLBSA-N 1 2 233.290 2.497 20 0 BEADLO CCCCN(C)c1nc[nH+]c(C)c1OC ZINC000656103959 411178968 /nfs/dbraw/zinc/17/89/68/411178968.db2.gz VEBYUQTZVYLXEC-UHFFFAOYSA-N 1 2 209.293 2.030 20 0 BEADLO COCCCCCNc1nc[nH+]c(C)c1OC ZINC000656113079 411181969 /nfs/dbraw/zinc/18/19/69/411181969.db2.gz AUFZBVDKEILLGD-UHFFFAOYSA-N 1 2 239.319 2.022 20 0 BEADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1c[nH]cn1 ZINC000528773800 411243494 /nfs/dbraw/zinc/24/34/94/411243494.db2.gz RJMCRRQGHNIWBE-MRVPVSSYSA-N 1 2 215.247 2.029 20 0 BEADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1c[nH]cn1 ZINC000528773800 411243496 /nfs/dbraw/zinc/24/34/96/411243496.db2.gz RJMCRRQGHNIWBE-MRVPVSSYSA-N 1 2 215.247 2.029 20 0 BEADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1cnc[nH]1 ZINC000528773800 411243500 /nfs/dbraw/zinc/24/35/00/411243500.db2.gz RJMCRRQGHNIWBE-MRVPVSSYSA-N 1 2 215.247 2.029 20 0 BEADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1cnc[nH]1 ZINC000528773800 411243501 /nfs/dbraw/zinc/24/35/01/411243501.db2.gz RJMCRRQGHNIWBE-MRVPVSSYSA-N 1 2 215.247 2.029 20 0 BEADLO CC[C@@H]1CN(c2nc(C)[nH+]cc2C)CCS1 ZINC000656133111 411183981 /nfs/dbraw/zinc/18/39/81/411183981.db2.gz ZMBYHVJQELUKAP-LLVKDONJSA-N 1 2 237.372 2.425 20 0 BEADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1c[nH]cn1 ZINC000528773801 411243701 /nfs/dbraw/zinc/24/37/01/411243701.db2.gz RJMCRRQGHNIWBE-QMMMGPOBSA-N 1 2 215.247 2.029 20 0 BEADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1c[nH]cn1 ZINC000528773801 411243704 /nfs/dbraw/zinc/24/37/04/411243704.db2.gz RJMCRRQGHNIWBE-QMMMGPOBSA-N 1 2 215.247 2.029 20 0 BEADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1cnc[nH]1 ZINC000528773801 411243706 /nfs/dbraw/zinc/24/37/06/411243706.db2.gz RJMCRRQGHNIWBE-QMMMGPOBSA-N 1 2 215.247 2.029 20 0 BEADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1cnc[nH]1 ZINC000528773801 411243707 /nfs/dbraw/zinc/24/37/07/411243707.db2.gz RJMCRRQGHNIWBE-QMMMGPOBSA-N 1 2 215.247 2.029 20 0 BEADLO CO[C@H]1C[C@H](Nc2nc(C)[nH+]cc2C)C1(C)C ZINC000656142221 411185077 /nfs/dbraw/zinc/18/50/77/411185077.db2.gz SQNZLNWWJYBMOI-QWRGUYRKSA-N 1 2 235.331 2.319 20 0 BEADLO CCC1(CNc2nc[nH+]c(C)c2OC)CC1 ZINC000656139557 411185178 /nfs/dbraw/zinc/18/51/78/411185178.db2.gz DWHKZHFOGXYWJP-UHFFFAOYSA-N 1 2 221.304 2.396 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@H]1CCC(F)(F)C1 ZINC000656147215 411186275 /nfs/dbraw/zinc/18/62/75/411186275.db2.gz DPABBUAUCWOKJD-QMMMGPOBSA-N 1 2 243.257 2.393 20 0 BEADLO FC(F)C1([NH2+][C@@H]2COC3(CCC3)C2)CC1 ZINC000658003028 411194971 /nfs/dbraw/zinc/19/49/71/411194971.db2.gz HKFFWZOYHJLUCC-QMMMGPOBSA-N 1 2 217.259 2.085 20 0 BEADLO COc1c(C)[nH+]cnc1N1CC(C)=C[C@H](C)C1 ZINC000656182712 411195464 /nfs/dbraw/zinc/19/54/64/411195464.db2.gz LAGJBALNJNSXFE-VIFPVBQESA-N 1 2 233.315 2.196 20 0 BEADLO Cn1cc[nH+]c1CN1Cc2cc(F)c(F)cc2C1 ZINC000653831151 411195986 /nfs/dbraw/zinc/19/59/86/411195986.db2.gz WYFITUGSOPFEQQ-UHFFFAOYSA-N 1 2 249.264 2.214 20 0 BEADLO Cc1noc([C@@H](C)[N@H+](C)CC2=CCCC2)n1 ZINC000653847308 411199051 /nfs/dbraw/zinc/19/90/51/411199051.db2.gz ZXWWJWJTLRIQEQ-SECBINFHSA-N 1 2 221.304 2.481 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+](C)CC2=CCCC2)n1 ZINC000653847308 411199053 /nfs/dbraw/zinc/19/90/53/411199053.db2.gz ZXWWJWJTLRIQEQ-SECBINFHSA-N 1 2 221.304 2.481 20 0 BEADLO COCC[C@@H](C)CNc1nc(C)[nH+]cc1C ZINC000656202014 411206496 /nfs/dbraw/zinc/20/64/96/411206496.db2.gz NFOCXOKHTUCOLH-SECBINFHSA-N 1 2 223.320 2.178 20 0 BEADLO COc1c(C)[nH+]cnc1NC[C@H](C)CC(F)F ZINC000656203081 411207455 /nfs/dbraw/zinc/20/74/55/411207455.db2.gz AMDAPIPSJOXERD-SSDOTTSWSA-N 1 2 245.273 2.497 20 0 BEADLO C[C@H]1C[C@@H]1C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000048698143 411208876 /nfs/dbraw/zinc/20/88/76/411208876.db2.gz MOPBISHXAQHSDD-QWRGUYRKSA-N 1 2 241.294 2.467 20 0 BEADLO Cc1ccn2cc(CNC(=O)CC(C)C)[nH+]c2c1 ZINC000048750335 411212946 /nfs/dbraw/zinc/21/29/46/411212946.db2.gz QWYLBBOEUDMDQY-UHFFFAOYSA-N 1 2 245.326 2.305 20 0 BEADLO C[C@H]1C[N@H+](Cc2cc[nH]n2)CC2(CCCCC2)O1 ZINC000653903633 411218950 /nfs/dbraw/zinc/21/89/50/411218950.db2.gz KBAAYNIZTMGOPK-LBPRGKRZSA-N 1 2 249.358 2.333 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cc[nH]n2)CC2(CCCCC2)O1 ZINC000653903633 411218951 /nfs/dbraw/zinc/21/89/51/411218951.db2.gz KBAAYNIZTMGOPK-LBPRGKRZSA-N 1 2 249.358 2.333 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc[nH]n2)CC2(CCCCC2)O1 ZINC000653903632 411219704 /nfs/dbraw/zinc/21/97/04/411219704.db2.gz KBAAYNIZTMGOPK-GFCCVEGCSA-N 1 2 249.358 2.333 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc[nH]n2)CC2(CCCCC2)O1 ZINC000653903632 411219707 /nfs/dbraw/zinc/21/97/07/411219707.db2.gz KBAAYNIZTMGOPK-GFCCVEGCSA-N 1 2 249.358 2.333 20 0 BEADLO CON(Cc1cc[nH+]c(N)c1)CC(C)(C)C ZINC000285393500 411220989 /nfs/dbraw/zinc/22/09/89/411220989.db2.gz DQDDFKDMYZPDMI-UHFFFAOYSA-N 1 2 223.320 2.073 20 0 BEADLO Cc1cnc(C[NH+]2CC3(CC3(F)F)C2)s1 ZINC000656265555 411221684 /nfs/dbraw/zinc/22/16/84/411221684.db2.gz RYLGJGFFMQGHCK-UHFFFAOYSA-N 1 2 230.283 2.293 20 0 BEADLO Cc1csc(C[NH2+][C@@H]2CCCn3ccnc32)n1 ZINC000655685518 411227747 /nfs/dbraw/zinc/22/77/47/411227747.db2.gz GKMJGEOWHNFRTO-SNVBAGLBSA-N 1 2 248.355 2.273 20 0 BEADLO Cc1cccc(C[NH2+][C@@H]2CCCn3ccnc32)n1 ZINC000655698187 411247350 /nfs/dbraw/zinc/24/73/50/411247350.db2.gz ZGUVBHQIAVRGBJ-CYBMUJFWSA-N 1 2 242.326 2.211 20 0 BEADLO CCc1cnn(Cc2ccc(C)[nH+]c2)c1 ZINC000655690103 411234448 /nfs/dbraw/zinc/23/44/48/411234448.db2.gz VNQWIEPUKRGUNE-UHFFFAOYSA-N 1 2 201.273 2.197 20 0 BEADLO CC/C(C)=C/C(=O)NCCCNc1cccc[nH+]1 ZINC000294918046 167822360 /nfs/dbraw/zinc/82/23/60/167822360.db2.gz KHCOBHNFWIGFON-VAWYXSNFSA-N 1 2 247.342 2.356 20 0 BEADLO COC[C@H]1CCCN(c2cccc[nH+]2)CC1 ZINC000336254321 411248022 /nfs/dbraw/zinc/24/80/22/411248022.db2.gz WWJCMPSNOKCFAO-LBPRGKRZSA-N 1 2 220.316 2.335 20 0 BEADLO CC/C=C(\C)C(=O)Nc1c[nH+]ccc1OC ZINC000299527411 167839155 /nfs/dbraw/zinc/83/91/55/167839155.db2.gz YIZIJODYBORUMB-WEVVVXLNSA-N 1 2 220.272 2.385 20 0 BEADLO C[C@@H]1CC[N@H+](CCn2cc(Cl)cn2)C[C@@H]1F ZINC000656494605 411284349 /nfs/dbraw/zinc/28/43/49/411284349.db2.gz VYBHCSBFRGIAIH-KOLCDFICSA-N 1 2 245.729 2.216 20 0 BEADLO C[C@@H]1CC[N@@H+](CCn2cc(Cl)cn2)C[C@@H]1F ZINC000656494605 411284350 /nfs/dbraw/zinc/28/43/50/411284350.db2.gz VYBHCSBFRGIAIH-KOLCDFICSA-N 1 2 245.729 2.216 20 0 BEADLO CCc1ncc(C[NH+]2CC(C(F)F)C2)s1 ZINC000656690023 411329853 /nfs/dbraw/zinc/32/98/53/411329853.db2.gz FTTNHUKULNLMQE-UHFFFAOYSA-N 1 2 232.299 2.402 20 0 BEADLO Fc1ccc(C[NH2+][C@@H]2CCCn3ccnc32)nc1 ZINC000655723712 411297435 /nfs/dbraw/zinc/29/74/35/411297435.db2.gz OGSQVCAJAUXMIJ-GFCCVEGCSA-N 1 2 246.289 2.042 20 0 BEADLO OCCC1C[NH+](Cc2cscc2Cl)C1 ZINC000656674870 411321842 /nfs/dbraw/zinc/32/18/42/411321842.db2.gz WXTSKQPCUWYVPK-UHFFFAOYSA-N 1 2 231.748 2.216 20 0 BEADLO C[C@@H](N[C@H]1CCCn2cc[nH+]c21)C(F)(F)F ZINC000655767499 411249817 /nfs/dbraw/zinc/24/98/17/411249817.db2.gz GMASQPCKJZLBNG-SFYZADRCSA-N 1 2 233.237 2.258 20 0 BEADLO COc1cc(C[N@H+](C)[C@@H](C)c2cccnc2)on1 ZINC000660140320 411255860 /nfs/dbraw/zinc/25/58/60/411255860.db2.gz LDYYNUPCLUYJPO-JTQLQIEISA-N 1 2 247.298 2.271 20 0 BEADLO COc1cc(C[N@@H+](C)[C@@H](C)c2cccnc2)on1 ZINC000660140320 411255864 /nfs/dbraw/zinc/25/58/64/411255864.db2.gz LDYYNUPCLUYJPO-JTQLQIEISA-N 1 2 247.298 2.271 20 0 BEADLO CO[C@@H](C[N@H+](C)Cc1cscn1)C1CCC1 ZINC000659858886 411350415 /nfs/dbraw/zinc/35/04/15/411350415.db2.gz UQLRJJMXWRLKAK-LBPRGKRZSA-N 1 2 240.372 2.390 20 0 BEADLO CO[C@@H](C[N@@H+](C)Cc1cscn1)C1CCC1 ZINC000659858886 411350418 /nfs/dbraw/zinc/35/04/18/411350418.db2.gz UQLRJJMXWRLKAK-LBPRGKRZSA-N 1 2 240.372 2.390 20 0 BEADLO CC(C)n1cc[nH+]c1CNCC(F)(F)F ZINC000656774363 411356796 /nfs/dbraw/zinc/35/67/96/411356796.db2.gz IFXQDWLIBRPTPV-UHFFFAOYSA-N 1 2 221.226 2.116 20 0 BEADLO Fc1cccc(F)c1CCC[NH+]1CCOCC1 ZINC000653479151 411338675 /nfs/dbraw/zinc/33/86/75/411338675.db2.gz FBBIZKNUIIWAOV-UHFFFAOYSA-N 1 2 241.281 2.230 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1nccn1C)c1cncs1 ZINC000658337663 411344263 /nfs/dbraw/zinc/34/42/63/411344263.db2.gz VNLFIQNVAGCFFZ-BDAKNGLRSA-N 1 2 236.344 2.288 20 0 BEADLO CC1(CO)C[NH+](Cc2ccc(Cl)c(F)c2)C1 ZINC000334647809 168050956 /nfs/dbraw/zinc/05/09/56/168050956.db2.gz QXFPTZXKNDGBTN-UHFFFAOYSA-N 1 2 243.709 2.293 20 0 BEADLO CC1=C(C)C[N@H+](Cc2nc(C3CC3)no2)CC1 ZINC000280751881 168084211 /nfs/dbraw/zinc/08/42/11/168084211.db2.gz NJRHGCAZJPVRDV-UHFFFAOYSA-N 1 2 233.315 2.489 20 0 BEADLO CC1=C(C)C[N@@H+](Cc2nc(C3CC3)no2)CC1 ZINC000280751881 168084212 /nfs/dbraw/zinc/08/42/12/168084212.db2.gz NJRHGCAZJPVRDV-UHFFFAOYSA-N 1 2 233.315 2.489 20 0 BEADLO CC1=C(C)C[N@H+](Cc2nnc(C3CC3)[nH]2)CC1 ZINC000336484626 168084327 /nfs/dbraw/zinc/08/43/27/168084327.db2.gz JGOCKIIKJGURTR-UHFFFAOYSA-N 1 2 232.331 2.224 20 0 BEADLO CC1=C(C)C[N@@H+](Cc2nnc(C3CC3)[nH]2)CC1 ZINC000336484626 168084330 /nfs/dbraw/zinc/08/43/30/168084330.db2.gz JGOCKIIKJGURTR-UHFFFAOYSA-N 1 2 232.331 2.224 20 0 BEADLO CC1=CC[N@H+](Cc2ncnn2C(C)C)CC1 ZINC000279753691 168114281 /nfs/dbraw/zinc/11/42/81/168114281.db2.gz QJVDBTYMRUVJLJ-UHFFFAOYSA-N 1 2 220.320 2.011 20 0 BEADLO CC1=CC[N@@H+](Cc2ncnn2C(C)C)CC1 ZINC000279753691 168114284 /nfs/dbraw/zinc/11/42/84/168114284.db2.gz QJVDBTYMRUVJLJ-UHFFFAOYSA-N 1 2 220.320 2.011 20 0 BEADLO CC1=CC[N@H+](Cc2nnc(C(C)C)[nH]2)CC1 ZINC000292674202 168116391 /nfs/dbraw/zinc/11/63/91/168116391.db2.gz BQGOKVRZJMLEPN-UHFFFAOYSA-N 1 2 220.320 2.080 20 0 BEADLO CC1=CC[N@@H+](Cc2nnc(C(C)C)[nH]2)CC1 ZINC000292674202 168116392 /nfs/dbraw/zinc/11/63/92/168116392.db2.gz BQGOKVRZJMLEPN-UHFFFAOYSA-N 1 2 220.320 2.080 20 0 BEADLO CC1=C[C@@H](C)C[C@H](C[N@H+]2CC(=O)N(C3CC3)C2)C1 ZINC000356415024 168125379 /nfs/dbraw/zinc/12/53/79/168125379.db2.gz CPRZZWHIWFPOCU-YPMHNXCESA-N 1 2 248.370 2.243 20 0 BEADLO CC1=C[C@@H](C)C[C@H](C[N@@H+]2CC(=O)N(C3CC3)C2)C1 ZINC000356415024 168125382 /nfs/dbraw/zinc/12/53/82/168125382.db2.gz CPRZZWHIWFPOCU-YPMHNXCESA-N 1 2 248.370 2.243 20 0 BEADLO CC1CCC(CC(=O)Nc2cc[nH+]cc2O)CC1 ZINC000358364753 168151712 /nfs/dbraw/zinc/15/17/12/168151712.db2.gz ZGZZVJJOPFRMGN-UHFFFAOYSA-N 1 2 248.326 2.364 20 0 BEADLO CC1CCC(CNC(=O)CCn2cc[nH+]c2)CC1 ZINC000299699257 168154928 /nfs/dbraw/zinc/15/49/28/168154928.db2.gz ZPKCQHIKDDFEBS-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO CC1CCC(CNC(=O)CCc2[nH]cc[nH+]2)CC1 ZINC000279254590 168154948 /nfs/dbraw/zinc/15/49/48/168154948.db2.gz SGPFPQUSWCMDAE-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO CCC(=O)CC[N@@H+]1CCOC[C@H]1c1ccccc1 ZINC000375425541 168201723 /nfs/dbraw/zinc/20/17/23/168201723.db2.gz KRHROLRKIVZWMW-HNNXBMFYSA-N 1 2 247.338 2.429 20 0 BEADLO CCC(=O)CC[N@H+]1CCOC[C@H]1c1ccccc1 ZINC000375425541 168201725 /nfs/dbraw/zinc/20/17/25/168201725.db2.gz KRHROLRKIVZWMW-HNNXBMFYSA-N 1 2 247.338 2.429 20 0 BEADLO Cc1cc(C)c(CNC(=O)CCC(F)F)c[nH+]1 ZINC000654380139 411383287 /nfs/dbraw/zinc/38/32/87/411383287.db2.gz GDSSWJDKJABDDA-UHFFFAOYSA-N 1 2 242.269 2.360 20 0 BEADLO CCC(C)(C)C(=O)NC[C@@H](C)Cn1cc[nH+]c1 ZINC000265846153 168265058 /nfs/dbraw/zinc/26/50/58/168265058.db2.gz TUHJJCIFHLLSFJ-LLVKDONJSA-N 1 2 237.347 2.072 20 0 BEADLO Cc1nn(C)cc1CNc1cc(C)c[nH+]c1C ZINC000404676746 411404011 /nfs/dbraw/zinc/40/40/11/411404011.db2.gz YGMZUCOTLXHYKL-UHFFFAOYSA-N 1 2 230.315 2.352 20 0 BEADLO Cc1cc(N[C@@H]2CCS[C@H]2C)nc[nH+]1 ZINC000306925666 411462257 /nfs/dbraw/zinc/46/22/57/411462257.db2.gz NEAJNFCAYWGZRU-DTWKUNHWSA-N 1 2 209.318 2.091 20 0 BEADLO CC(=O)[C@@H](C)CCSc1nc(N)cc(C)[nH+]1 ZINC000657236301 411423560 /nfs/dbraw/zinc/42/35/60/411423560.db2.gz IRTXWAYRMVSOHL-ZETCQYMHSA-N 1 2 239.344 2.075 20 0 BEADLO C[N@H+](CCC(C)(C)C1CC1)Cc1nnc[nH]1 ZINC000653566778 411424105 /nfs/dbraw/zinc/42/41/05/411424105.db2.gz JQKLUKHICNWLOI-UHFFFAOYSA-N 1 2 222.336 2.063 20 0 BEADLO C[N@@H+](CCC(C)(C)C1CC1)Cc1nnc[nH]1 ZINC000653566778 411424109 /nfs/dbraw/zinc/42/41/09/411424109.db2.gz JQKLUKHICNWLOI-UHFFFAOYSA-N 1 2 222.336 2.063 20 0 BEADLO CC(C)(F)C(=O)Nc1cccc2[nH+]ccn21 ZINC000271158219 411429156 /nfs/dbraw/zinc/42/91/56/411429156.db2.gz OGPODDUPBKWOJB-UHFFFAOYSA-N 1 2 221.235 2.021 20 0 BEADLO CCc1nnc(SCCn2cc[nH+]c2)s1 ZINC000657270862 411438181 /nfs/dbraw/zinc/43/81/81/411438181.db2.gz CUVQMVNQRUSBNG-UHFFFAOYSA-N 1 2 240.357 2.089 20 0 BEADLO Cc1nn(Cc2ccc(C(C)C)[nH+]c2C)c(=O)o1 ZINC000657279639 411439964 /nfs/dbraw/zinc/43/99/64/411439964.db2.gz RRYKHIBIJVMEHA-UHFFFAOYSA-N 1 2 247.298 2.020 20 0 BEADLO Fc1cccnc1C[NH2+][C@@H]1CCCn2ccnc21 ZINC000655737386 411445035 /nfs/dbraw/zinc/44/50/35/411445035.db2.gz MZBQJWPBBLLXOX-LLVKDONJSA-N 1 2 246.289 2.042 20 0 BEADLO Fc1cccnc1CN[C@@H]1CCCn2cc[nH+]c21 ZINC000655737386 411445036 /nfs/dbraw/zinc/44/50/36/411445036.db2.gz MZBQJWPBBLLXOX-LLVKDONJSA-N 1 2 246.289 2.042 20 0 BEADLO CC(C)(CC[N@H+](CCO)CC(F)F)C1CC1 ZINC000405995785 411448247 /nfs/dbraw/zinc/44/82/47/411448247.db2.gz CNSUIHBYHHNEQX-UHFFFAOYSA-N 1 2 235.318 2.372 20 0 BEADLO CC(C)(CC[N@@H+](CCO)CC(F)F)C1CC1 ZINC000405995785 411448251 /nfs/dbraw/zinc/44/82/51/411448251.db2.gz CNSUIHBYHHNEQX-UHFFFAOYSA-N 1 2 235.318 2.372 20 0 BEADLO COc1ccc(C)cc1C[NH2+]Cc1nc(C)c[nH]1 ZINC000657297034 411454417 /nfs/dbraw/zinc/45/44/17/411454417.db2.gz GWWOBDYBDSAPMA-UHFFFAOYSA-N 1 2 245.326 2.325 20 0 BEADLO CCC[C@H]1CCC[C@@H]1C(=O)NCCn1cc[nH+]c1 ZINC000294624010 411474174 /nfs/dbraw/zinc/47/41/74/411474174.db2.gz WQZCQDXQTJMDHQ-STQMWFEESA-N 1 2 249.358 2.216 20 0 BEADLO COc1cc(C[N@H+](C)Cc2ccoc2)sn1 ZINC000659853338 411478636 /nfs/dbraw/zinc/47/86/36/411478636.db2.gz SXAKCEGEVGLFQD-UHFFFAOYSA-N 1 2 238.312 2.377 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2ccoc2)sn1 ZINC000659853338 411478637 /nfs/dbraw/zinc/47/86/37/411478637.db2.gz SXAKCEGEVGLFQD-UHFFFAOYSA-N 1 2 238.312 2.377 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H](C)OC(C)(C)C2)nc(C)n1 ZINC000659855227 411479005 /nfs/dbraw/zinc/47/90/05/411479005.db2.gz AWEYOFDRDMZGCO-LLVKDONJSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H](C)OC(C)(C)C2)nc(C)n1 ZINC000659855227 411479008 /nfs/dbraw/zinc/47/90/08/411479008.db2.gz AWEYOFDRDMZGCO-LLVKDONJSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@@H](NCc1[nH]cc(C)[nH+]1)c1nccs1 ZINC000657371825 411484360 /nfs/dbraw/zinc/48/43/60/411484360.db2.gz WXHAWGDORYFDOC-SECBINFHSA-N 1 2 236.344 2.416 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@H]2COCc3ccccc32)n1 ZINC000657493566 411533792 /nfs/dbraw/zinc/53/37/92/411533792.db2.gz FFIFMSUXEDDCLM-ZDUSSCGKSA-N 1 2 243.310 2.079 20 0 BEADLO c1csc([C@@H]2CCC[N@H+]2CCc2cnn[nH]2)c1 ZINC000647955547 411495846 /nfs/dbraw/zinc/49/58/46/411495846.db2.gz JDDWKDIBKMLVTA-NSHDSACASA-N 1 2 248.355 2.246 20 0 BEADLO c1csc([C@@H]2CCC[N@@H+]2CCc2cnn[nH]2)c1 ZINC000647955547 411495849 /nfs/dbraw/zinc/49/58/49/411495849.db2.gz JDDWKDIBKMLVTA-NSHDSACASA-N 1 2 248.355 2.246 20 0 BEADLO Cc1nc(C[N@H+]2CCOC[C@@H]2CC(C)C)co1 ZINC000659927678 411500335 /nfs/dbraw/zinc/50/03/35/411500335.db2.gz HBBRWVMHIBJDDU-ZDUSSCGKSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1nc(C[N@@H+]2CCOC[C@@H]2CC(C)C)co1 ZINC000659927678 411500337 /nfs/dbraw/zinc/50/03/37/411500337.db2.gz HBBRWVMHIBJDDU-ZDUSSCGKSA-N 1 2 238.331 2.230 20 0 BEADLO COc1cc(C[N@@H+]2CCSC[C@H]2C)sn1 ZINC000659945215 411505334 /nfs/dbraw/zinc/50/53/34/411505334.db2.gz UFCVHFVSLVTROC-MRVPVSSYSA-N 1 2 244.385 2.089 20 0 BEADLO COc1cc(C[N@H+]2CCSC[C@H]2C)sn1 ZINC000659945215 411505335 /nfs/dbraw/zinc/50/53/35/411505335.db2.gz UFCVHFVSLVTROC-MRVPVSSYSA-N 1 2 244.385 2.089 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1C[C@H](C)[C@@H](C)[C@@H]1C ZINC000655150394 411505434 /nfs/dbraw/zinc/50/54/34/411505434.db2.gz MCIXTSAOBWENEX-KXNHARMFSA-N 1 2 249.358 2.091 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1C[C@H](C)[C@@H](C)[C@@H]1C ZINC000655150394 411505437 /nfs/dbraw/zinc/50/54/37/411505437.db2.gz MCIXTSAOBWENEX-KXNHARMFSA-N 1 2 249.358 2.091 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1CCC12CCCC2 ZINC000655162112 411509488 /nfs/dbraw/zinc/50/94/88/411509488.db2.gz IXLVZKGOPWZHMS-NSHDSACASA-N 1 2 247.342 2.133 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1CCC12CCCC2 ZINC000655162112 411509492 /nfs/dbraw/zinc/50/94/92/411509492.db2.gz IXLVZKGOPWZHMS-NSHDSACASA-N 1 2 247.342 2.133 20 0 BEADLO Cc1nc(C[NH+]2C[C@H](C)S[C@@H](C)C2)co1 ZINC000659961523 411512747 /nfs/dbraw/zinc/51/27/47/411512747.db2.gz RMFHHXDRGIVNDP-IUCAKERBSA-N 1 2 226.345 2.309 20 0 BEADLO CCCn1nccc1C[NH2+]C(C)(C)C(F)F ZINC000657453442 411514889 /nfs/dbraw/zinc/51/48/89/411514889.db2.gz YLZPFMLNPWXPLK-UHFFFAOYSA-N 1 2 231.290 2.426 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@H]2c3ccccc3O[C@@H]2C)n1 ZINC000657469911 411522088 /nfs/dbraw/zinc/52/20/88/411522088.db2.gz XYWXQDUDNFDPKD-QMTHXVAHSA-N 1 2 243.310 2.330 20 0 BEADLO C[C@@H]1OCC[N@H+](Cc2cc(C3CC3)no2)[C@H]1C ZINC000660009929 411527290 /nfs/dbraw/zinc/52/72/90/411527290.db2.gz DBZCYOVXEYHFGX-UWVGGRQHSA-N 1 2 236.315 2.161 20 0 BEADLO C[C@@H]1OCC[N@@H+](Cc2cc(C3CC3)no2)[C@H]1C ZINC000660009929 411527292 /nfs/dbraw/zinc/52/72/92/411527292.db2.gz DBZCYOVXEYHFGX-UWVGGRQHSA-N 1 2 236.315 2.161 20 0 BEADLO CC(C)n1ccnc1C[NH2+]Cc1ccoc1 ZINC000657325650 411464973 /nfs/dbraw/zinc/46/49/73/411464973.db2.gz OWTVDZLFNOWMBX-UHFFFAOYSA-N 1 2 219.288 2.347 20 0 BEADLO Cc1occc1C[NH2+]Cc1cc2n(n1)CCC2 ZINC000657327138 411465974 /nfs/dbraw/zinc/46/59/74/411465974.db2.gz SDALKCJKSMHFHP-UHFFFAOYSA-N 1 2 231.299 2.021 20 0 BEADLO CC[N@@H+]1CCO[C@@H](c2cccc(F)c2)C1 ZINC000066847472 170004603 /nfs/dbraw/zinc/00/46/03/170004603.db2.gz VVZBHDXBIPJLFL-GFCCVEGCSA-N 1 2 209.264 2.219 20 0 BEADLO CC[N@H+]1CCO[C@@H](c2cccc(F)c2)C1 ZINC000066847472 170004604 /nfs/dbraw/zinc/00/46/04/170004604.db2.gz VVZBHDXBIPJLFL-GFCCVEGCSA-N 1 2 209.264 2.219 20 0 BEADLO COc1c(C)cccc1C[NH2+]Cc1nc(C)c[nH]1 ZINC000657504850 411539534 /nfs/dbraw/zinc/53/95/34/411539534.db2.gz PLPVIVKUPXGJQP-UHFFFAOYSA-N 1 2 245.326 2.325 20 0 BEADLO CC[N@@H+]1C[C@H]([NH2+]CCc2ccccc2C)[C@@H](C)C1 ZINC000358284355 170034820 /nfs/dbraw/zinc/03/48/20/170034820.db2.gz HMSNOXYURLHBPW-HOCLYGCPSA-N 1 2 246.398 2.467 20 0 BEADLO CCNC(=O)COc1ccc([NH2+]C(C)C)cc1 ZINC000132990502 170067584 /nfs/dbraw/zinc/06/75/84/170067584.db2.gz OLMHMCGMLBWUNO-UHFFFAOYSA-N 1 2 236.315 2.022 20 0 BEADLO Cc1nc(C[NH2+]C2(CF)CCC2)[nH]c1C ZINC000657500792 411538187 /nfs/dbraw/zinc/53/81/87/411538187.db2.gz SKQKFYUBJHTADZ-UHFFFAOYSA-N 1 2 211.284 2.008 20 0 BEADLO Cc1[nH]c(CNC2(CF)CCC2)[nH+]c1C ZINC000657500792 411538189 /nfs/dbraw/zinc/53/81/89/411538189.db2.gz SKQKFYUBJHTADZ-UHFFFAOYSA-N 1 2 211.284 2.008 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@@H]2CC[C@H]3C[C@H]3C2)no1 ZINC000660217227 411554304 /nfs/dbraw/zinc/55/43/04/411554304.db2.gz OJCWNIXFGLPBLG-GRYCIOLGSA-N 1 2 235.331 2.246 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@@H]2CC[C@H]3C[C@H]3C2)no1 ZINC000660217227 411554306 /nfs/dbraw/zinc/55/43/06/411554306.db2.gz OJCWNIXFGLPBLG-GRYCIOLGSA-N 1 2 235.331 2.246 20 0 BEADLO COc1cc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)sn1 ZINC000660222627 411556097 /nfs/dbraw/zinc/55/60/97/411556097.db2.gz WTDFVZJIRQIVLY-WPRPVWTQSA-N 1 2 244.335 2.332 20 0 BEADLO COc1cc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)sn1 ZINC000660222627 411556098 /nfs/dbraw/zinc/55/60/98/411556098.db2.gz WTDFVZJIRQIVLY-WPRPVWTQSA-N 1 2 244.335 2.332 20 0 BEADLO CC[NH2+][C@](CC)(C(=O)OC)c1ccccc1 ZINC000037446770 170170334 /nfs/dbraw/zinc/17/03/34/170170334.db2.gz QHNNSASCBYEBGL-ZDUSSCGKSA-N 1 2 221.300 2.074 20 0 BEADLO CCOC(=O)C[N@H+](C)[C@@H](CC)c1ccncc1 ZINC000130300254 170216014 /nfs/dbraw/zinc/21/60/14/170216014.db2.gz WCYGCTSQOSOQNH-LBPRGKRZSA-N 1 2 236.315 2.028 20 0 BEADLO CCOC(=O)C[N@@H+](C)[C@@H](CC)c1ccncc1 ZINC000130300254 170216015 /nfs/dbraw/zinc/21/60/15/170216015.db2.gz WCYGCTSQOSOQNH-LBPRGKRZSA-N 1 2 236.315 2.028 20 0 BEADLO CCOC(=O)C[N@H+](Cc1ccc(C)o1)C(C)C ZINC000048336395 170217600 /nfs/dbraw/zinc/21/76/00/170217600.db2.gz SGAHGXZXSIXHHP-UHFFFAOYSA-N 1 2 239.315 2.362 20 0 BEADLO CCOC(=O)C[N@@H+](Cc1ccc(C)o1)C(C)C ZINC000048336395 170217601 /nfs/dbraw/zinc/21/76/01/170217601.db2.gz SGAHGXZXSIXHHP-UHFFFAOYSA-N 1 2 239.315 2.362 20 0 BEADLO CCOC(=O)C[NH2+][C@]1(C)CCCc2ccccc21 ZINC000341882323 170226913 /nfs/dbraw/zinc/22/69/13/170226913.db2.gz KTXQAJOHWIUACX-OAHLLOKOSA-N 1 2 247.338 2.391 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[NH2+][C@@H]1CCSC1 ZINC000336776659 170249462 /nfs/dbraw/zinc/24/94/62/170249462.db2.gz GGGQDQHFYFLDMR-GHMZBOCLSA-N 1 2 245.388 2.059 20 0 BEADLO CCOC(=O)[C@@H](CC)[N@H+](C)Cc1occc1C ZINC000271172541 170250082 /nfs/dbraw/zinc/25/00/82/170250082.db2.gz FMBXLPMONHIHMV-LLVKDONJSA-N 1 2 239.315 2.362 20 0 BEADLO CCOC(=O)[C@@H](CC)[N@@H+](C)Cc1occc1C ZINC000271172541 170250083 /nfs/dbraw/zinc/25/00/83/170250083.db2.gz FMBXLPMONHIHMV-LLVKDONJSA-N 1 2 239.315 2.362 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+]1CCC=C(c2ccco2)C1 ZINC000285161650 170266419 /nfs/dbraw/zinc/26/64/19/170266419.db2.gz AODDWWOECSQRKB-NSHDSACASA-N 1 2 249.310 2.320 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+]1CCC=C(c2ccco2)C1 ZINC000285161650 170266420 /nfs/dbraw/zinc/26/64/20/170266420.db2.gz AODDWWOECSQRKB-NSHDSACASA-N 1 2 249.310 2.320 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+]1CC[C@H]1c1ccccc1 ZINC000362186409 170267505 /nfs/dbraw/zinc/26/75/05/170267505.db2.gz YRMNBKFBHICABT-AAEUAGOBSA-N 1 2 233.311 2.385 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+]1CC[C@H]1c1ccccc1 ZINC000362186409 170267506 /nfs/dbraw/zinc/26/75/06/170267506.db2.gz YRMNBKFBHICABT-AAEUAGOBSA-N 1 2 233.311 2.385 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+]C[C@H](C)c1ccccc1 ZINC000049370168 170267514 /nfs/dbraw/zinc/26/75/14/170267514.db2.gz RZZQPQXCTVDMBT-RYUDHWBXSA-N 1 2 235.327 2.331 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+]1CCc2sccc2C1 ZINC000043638464 170267822 /nfs/dbraw/zinc/26/78/22/170267822.db2.gz FBYWTBCDQQVJTN-VIFPVBQESA-N 1 2 239.340 2.058 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+]1CCc2sccc2C1 ZINC000043638464 170267824 /nfs/dbraw/zinc/26/78/24/170267824.db2.gz FBYWTBCDQQVJTN-VIFPVBQESA-N 1 2 239.340 2.058 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[N@@H+]1CC[C@@](C)(F)C1 ZINC000360206570 170270739 /nfs/dbraw/zinc/27/07/39/170270739.db2.gz BERISQMKOXHONE-WCQYABFASA-N 1 2 245.338 2.398 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[N@H+]1CC[C@@](C)(F)C1 ZINC000360206570 170270740 /nfs/dbraw/zinc/27/07/40/170270740.db2.gz BERISQMKOXHONE-WCQYABFASA-N 1 2 245.338 2.398 20 0 BEADLO CCOC(=O)[C@H]1CCC[N@@H+]1[C@H](C)c1ccccn1 ZINC000191178540 170281569 /nfs/dbraw/zinc/28/15/69/170281569.db2.gz YDUPXZDSBGZBEI-DGCLKSJQSA-N 1 2 248.326 2.170 20 0 BEADLO CCOC(=O)[C@H]1CCC[N@H+]1[C@H](C)c1ccccn1 ZINC000191178540 170281570 /nfs/dbraw/zinc/28/15/70/170281570.db2.gz YDUPXZDSBGZBEI-DGCLKSJQSA-N 1 2 248.326 2.170 20 0 BEADLO CCOC1CC(C(=O)Nc2ccc(C)[nH+]c2C)C1 ZINC000287246341 170322266 /nfs/dbraw/zinc/32/22/66/170322266.db2.gz XBEGWQRCHIBYEI-UHFFFAOYSA-N 1 2 248.326 2.452 20 0 BEADLO CCOC1CC(C(=O)Nc2cc[nH+]cc2C)C1 ZINC000287250992 170322544 /nfs/dbraw/zinc/32/25/44/170322544.db2.gz BMWGMEAIUZMTHD-UHFFFAOYSA-N 1 2 234.299 2.144 20 0 BEADLO CCOC1C[NH+](CC2=Cc3ccccc3OC2)C1 ZINC000297373500 170336150 /nfs/dbraw/zinc/33/61/50/170336150.db2.gz HWQJINWOGMFKMV-UHFFFAOYSA-N 1 2 245.322 2.183 20 0 BEADLO CCOCCCC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000280809722 170366578 /nfs/dbraw/zinc/36/65/78/170366578.db2.gz REAOGURSQRKDMT-UHFFFAOYSA-N 1 2 247.298 2.090 20 0 BEADLO CCOCC[N@H+](CC)Cc1nc(C)c(C)o1 ZINC000107678925 170396097 /nfs/dbraw/zinc/39/60/97/170396097.db2.gz RDZWXCSYABAMGI-UHFFFAOYSA-N 1 2 226.320 2.150 20 0 BEADLO CCOCC[N@@H+](CC)Cc1nc(C)c(C)o1 ZINC000107678925 170396098 /nfs/dbraw/zinc/39/60/98/170396098.db2.gz RDZWXCSYABAMGI-UHFFFAOYSA-N 1 2 226.320 2.150 20 0 BEADLO CCOCC[N@@H+]1CCCC[C@H]1C(F)F ZINC000337519885 170397617 /nfs/dbraw/zinc/39/76/17/170397617.db2.gz OLRGSPDBVIAOLS-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CCOCC[N@H+]1CCCC[C@H]1C(F)F ZINC000337519885 170397618 /nfs/dbraw/zinc/39/76/18/170397618.db2.gz OLRGSPDBVIAOLS-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CC(C)c1cccc(C[NH2+]Cc2ncn(C)n2)c1 ZINC000663319708 411623743 /nfs/dbraw/zinc/62/37/43/411623743.db2.gz DBPGJYGQTQROSF-UHFFFAOYSA-N 1 2 244.342 2.228 20 0 BEADLO CCn1ccc(C[N@H+](C)Cc2coc(C)n2)c1 ZINC000660396686 411579542 /nfs/dbraw/zinc/57/95/42/411579542.db2.gz NMOXOACITKGKEY-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CCn1ccc(C[N@@H+](C)Cc2coc(C)n2)c1 ZINC000660396686 411579544 /nfs/dbraw/zinc/57/95/44/411579544.db2.gz NMOXOACITKGKEY-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CO[C@H](C[NH2+]Cc1ccn[nH]1)C1CCCCC1 ZINC000657782172 411598051 /nfs/dbraw/zinc/59/80/51/411598051.db2.gz KXGMHEVFHLYKLA-CYBMUJFWSA-N 1 2 237.347 2.095 20 0 BEADLO CC(C)n1cc(C[NH2+][C@H](C)c2nccn2C)cn1 ZINC000657794786 411599646 /nfs/dbraw/zinc/59/96/46/411599646.db2.gz WMUXITXXMTZHDZ-LLVKDONJSA-N 1 2 247.346 2.048 20 0 BEADLO Cc1nc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)co1 ZINC000660565843 411601128 /nfs/dbraw/zinc/60/11/28/411601128.db2.gz HPPBEDGJFRMUHY-QMMMGPOBSA-N 1 2 230.258 2.460 20 0 BEADLO Cc1nc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)co1 ZINC000660565843 411601130 /nfs/dbraw/zinc/60/11/30/411601130.db2.gz HPPBEDGJFRMUHY-QMMMGPOBSA-N 1 2 230.258 2.460 20 0 BEADLO C[N@H+](CCCC(C)(C)C)Cc1n[nH]c(=O)o1 ZINC000660843068 411654203 /nfs/dbraw/zinc/65/42/03/411654203.db2.gz TWYNSYWGJXMSSS-UHFFFAOYSA-N 1 2 227.308 2.033 20 0 BEADLO C[N@@H+](CCCC(C)(C)C)Cc1n[nH]c(=O)o1 ZINC000660843068 411654206 /nfs/dbraw/zinc/65/42/06/411654206.db2.gz TWYNSYWGJXMSSS-UHFFFAOYSA-N 1 2 227.308 2.033 20 0 BEADLO Cc1cccc([C@H](C)[N@H+](C)Cc2n[nH]c(=O)o2)c1 ZINC000660849677 411657856 /nfs/dbraw/zinc/65/78/56/411657856.db2.gz PREFIJTUSMMFKZ-JTQLQIEISA-N 1 2 247.298 2.277 20 0 BEADLO Cc1cccc([C@H](C)[N@@H+](C)Cc2n[nH]c(=O)o2)c1 ZINC000660849677 411657860 /nfs/dbraw/zinc/65/78/60/411657860.db2.gz PREFIJTUSMMFKZ-JTQLQIEISA-N 1 2 247.298 2.277 20 0 BEADLO CCc1noc(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)n1 ZINC000660925857 411678000 /nfs/dbraw/zinc/67/80/00/411678000.db2.gz IGTJMJCGXVAMHW-UWVGGRQHSA-N 1 2 221.304 2.006 20 0 BEADLO CCc1noc(C[N@H+]2C[C@@H]3CCCC[C@@H]32)n1 ZINC000660925857 411678006 /nfs/dbraw/zinc/67/80/06/411678006.db2.gz IGTJMJCGXVAMHW-UWVGGRQHSA-N 1 2 221.304 2.006 20 0 BEADLO C(c1noc(C2CC2)n1)[N@@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660930567 411682052 /nfs/dbraw/zinc/68/20/52/411682052.db2.gz NABSOXQNKTYVPT-QWRGUYRKSA-N 1 2 233.315 2.321 20 0 BEADLO C(c1noc(C2CC2)n1)[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660930567 411682057 /nfs/dbraw/zinc/68/20/57/411682057.db2.gz NABSOXQNKTYVPT-QWRGUYRKSA-N 1 2 233.315 2.321 20 0 BEADLO Cc1ncc2c(n1)CC[C@H](Nc1cccc[nH+]1)C2 ZINC000663500784 411682811 /nfs/dbraw/zinc/68/28/11/411682811.db2.gz VUCOTDCFKDBZME-LBPRGKRZSA-N 1 2 240.310 2.149 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660933328 411684194 /nfs/dbraw/zinc/68/41/94/411684194.db2.gz AGJRLCPKUOQOME-QXEWZRGKSA-N 1 2 223.345 2.474 20 0 BEADLO C[C@@H](c1csnn1)[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660933328 411684198 /nfs/dbraw/zinc/68/41/98/411684198.db2.gz AGJRLCPKUOQOME-QXEWZRGKSA-N 1 2 223.345 2.474 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)[C@H]1CC12CCC2 ZINC000660955423 411687000 /nfs/dbraw/zinc/68/70/00/411687000.db2.gz VQLCLZRNQLTEQK-LLVKDONJSA-N 1 2 241.294 2.463 20 0 BEADLO CC(C)c1noc([C@@H](C)N(C)Cc2c[nH+]c[nH]2)n1 ZINC000661086838 411699868 /nfs/dbraw/zinc/69/98/68/411699868.db2.gz JNVSYOINKSQTQV-SECBINFHSA-N 1 2 249.318 2.109 20 0 BEADLO CC(C)c1noc([C@@H](C)N(C)Cc2c[nH]c[nH+]2)n1 ZINC000661086838 411699873 /nfs/dbraw/zinc/69/98/73/411699873.db2.gz JNVSYOINKSQTQV-SECBINFHSA-N 1 2 249.318 2.109 20 0 BEADLO CC(C)C[C@@H](C)C[N@@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000661406157 411768445 /nfs/dbraw/zinc/76/84/45/411768445.db2.gz INPAQYKNHWWMLC-GHMZBOCLSA-N 1 2 235.318 2.371 20 0 BEADLO CC(C)C[C@@H](C)C[N@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000661406157 411768447 /nfs/dbraw/zinc/76/84/47/411768447.db2.gz INPAQYKNHWWMLC-GHMZBOCLSA-N 1 2 235.318 2.371 20 0 BEADLO CC(C)C[C@H](C)C[N@@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000661406160 411769273 /nfs/dbraw/zinc/76/92/73/411769273.db2.gz INPAQYKNHWWMLC-WDEREUQCSA-N 1 2 235.318 2.371 20 0 BEADLO CC(C)C[C@H](C)C[N@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000661406160 411769277 /nfs/dbraw/zinc/76/92/77/411769277.db2.gz INPAQYKNHWWMLC-WDEREUQCSA-N 1 2 235.318 2.371 20 0 BEADLO Cc1cc(C[N@H+]2CC3(CCC3)OC[C@@H]2C)no1 ZINC000661462815 411779711 /nfs/dbraw/zinc/77/97/11/411779711.db2.gz KOHUIMWBGOJKLH-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO Cc1cc(C[N@@H+]2CC3(CCC3)OC[C@@H]2C)no1 ZINC000661462815 411779716 /nfs/dbraw/zinc/77/97/16/411779716.db2.gz KOHUIMWBGOJKLH-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO Cc1ccc(N[C@@H]2C[C@H](C)n3cc[nH+]c32)nn1 ZINC000663973247 411796488 /nfs/dbraw/zinc/79/64/88/411796488.db2.gz DRYNQBFPTIAVCU-VHSXEESVSA-N 1 2 229.287 2.099 20 0 BEADLO C[C@@H]1C[NH+](CCC(F)(F)F)C[C@@H](C)C1=O ZINC000661545474 411799792 /nfs/dbraw/zinc/79/97/92/411799792.db2.gz ZINGZGNBZIIFMJ-HTQZYQBOSA-N 1 2 223.238 2.096 20 0 BEADLO CO[C@@H](C)COc1ccc2c(c1)[nH+]c(C)n2C ZINC000664046530 411827471 /nfs/dbraw/zinc/82/74/71/411827471.db2.gz FWVNHFPKFBVSEY-VIFPVBQESA-N 1 2 234.299 2.295 20 0 BEADLO CC[C@@H](C)NC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000281077150 170744561 /nfs/dbraw/zinc/74/45/61/170744561.db2.gz UCWDBYQLUHARGL-SECBINFHSA-N 1 2 232.287 2.254 20 0 BEADLO Cc1nc(N[C@H](C)c2cscn2)cc[nH+]1 ZINC000664264845 411903974 /nfs/dbraw/zinc/90/39/74/411903974.db2.gz PJGUDJMKGZODFC-SSDOTTSWSA-N 1 2 220.301 2.415 20 0 BEADLO C[C@@H]1COC2(CCC2)CN1c1cccc[nH+]1 ZINC000664277860 411910672 /nfs/dbraw/zinc/91/06/72/411910672.db2.gz IIIXQKUWFDDCET-LLVKDONJSA-N 1 2 218.300 2.229 20 0 BEADLO CN(CC1=CCCOC1)c1cc[nH+]c(C2CC2)n1 ZINC000664365896 411931309 /nfs/dbraw/zinc/93/13/09/411931309.db2.gz RKLUDMSDFKRBHG-UHFFFAOYSA-N 1 2 245.326 2.137 20 0 BEADLO C[C@@H]1COC2(CCCC2)C[N@@H+]1Cc1ncccn1 ZINC000661978082 411932255 /nfs/dbraw/zinc/93/22/55/411932255.db2.gz GEUYBQAHPZINTJ-GFCCVEGCSA-N 1 2 247.342 2.010 20 0 BEADLO C[C@@H]1COC2(CCCC2)C[N@H+]1Cc1ncccn1 ZINC000661978082 411932258 /nfs/dbraw/zinc/93/22/58/411932258.db2.gz GEUYBQAHPZINTJ-GFCCVEGCSA-N 1 2 247.342 2.010 20 0 BEADLO COc1c(C)[nH+]cnc1NCCC(C)(C)F ZINC000664371307 411932403 /nfs/dbraw/zinc/93/24/03/411932403.db2.gz LKZQPTWGVRURRS-UHFFFAOYSA-N 1 2 227.283 2.344 20 0 BEADLO COc1c(C)[nH+]cnc1NC[C@]1(C)CC1(F)F ZINC000664394888 411940853 /nfs/dbraw/zinc/94/08/53/411940853.db2.gz CNRAVTFNXWAOIZ-JTQLQIEISA-N 1 2 243.257 2.251 20 0 BEADLO COC1CC(CCNc2cc[nH+]c(C)n2)C1 ZINC000664140793 411869717 /nfs/dbraw/zinc/86/97/17/411869717.db2.gz GMLYEZUQASBAAY-UHFFFAOYSA-N 1 2 221.304 2.012 20 0 BEADLO CC1(C)C[C@@H](Nc2cc(NC3CC3)[nH+]cn2)CO1 ZINC000664145380 411870980 /nfs/dbraw/zinc/87/09/80/411870980.db2.gz PIVLKAZSRNYVTR-SNVBAGLBSA-N 1 2 248.330 2.030 20 0 BEADLO CC1(C)C[C@@H](Nc2cc(NC3CC3)nc[nH+]2)CO1 ZINC000664145380 411870986 /nfs/dbraw/zinc/87/09/86/411870986.db2.gz PIVLKAZSRNYVTR-SNVBAGLBSA-N 1 2 248.330 2.030 20 0 BEADLO CC1(C)C[C@@H](Nc2cc[nH+]c3ccncc23)CO1 ZINC000664144035 411871583 /nfs/dbraw/zinc/87/15/83/411871583.db2.gz GDBJTMFYOZNYDO-SNVBAGLBSA-N 1 2 243.310 2.031 20 0 BEADLO COc1c(C)[nH+]cnc1NC[C@@]1(C)CC1(F)F ZINC000664394890 411941554 /nfs/dbraw/zinc/94/15/54/411941554.db2.gz CNRAVTFNXWAOIZ-SNVBAGLBSA-N 1 2 243.257 2.251 20 0 BEADLO Clc1cnc(C[N@@H+]2CCC3(COC3)C2)s1 ZINC000662073105 411974423 /nfs/dbraw/zinc/97/44/23/411974423.db2.gz SHOSQBAGJJUMKQ-UHFFFAOYSA-N 1 2 244.747 2.019 20 0 BEADLO Clc1cnc(C[N@H+]2CCC3(COC3)C2)s1 ZINC000662073105 411974427 /nfs/dbraw/zinc/97/44/27/411974427.db2.gz SHOSQBAGJJUMKQ-UHFFFAOYSA-N 1 2 244.747 2.019 20 0 BEADLO c1nc(N2CC[C@H]3C[C@H]3C2)cc(NCC2CC2)[nH+]1 ZINC000664526412 411977876 /nfs/dbraw/zinc/97/78/76/411977876.db2.gz VELNRYCZXWAUMH-RYUDHWBXSA-N 1 2 244.342 2.145 20 0 BEADLO c1nc(NCC2CC2)cc(N2CC[C@H]3C[C@H]3C2)[nH+]1 ZINC000664526412 411977878 /nfs/dbraw/zinc/97/78/78/411977878.db2.gz VELNRYCZXWAUMH-RYUDHWBXSA-N 1 2 244.342 2.145 20 0 BEADLO CC(C)[C@H](Nc1nc[nH+]c2c1OCCN2)C1CC1 ZINC000664545297 411982315 /nfs/dbraw/zinc/98/23/15/411982315.db2.gz GDZZJCCIOVPXJW-JTQLQIEISA-N 1 2 248.330 2.127 20 0 BEADLO CC(C)[C@H](Nc1[nH+]cnc2c1OCCN2)C1CC1 ZINC000664545297 411982318 /nfs/dbraw/zinc/98/23/18/411982318.db2.gz GDZZJCCIOVPXJW-JTQLQIEISA-N 1 2 248.330 2.127 20 0 BEADLO c1ccc2[nH+]c(N3CC[C@@H]4COC[C@H]4C3)[nH]c2c1 ZINC000664557146 411986771 /nfs/dbraw/zinc/98/67/71/411986771.db2.gz PSSFLDSHCHSRIU-GHMZBOCLSA-N 1 2 243.310 2.036 20 0 BEADLO CO[C@H](CNc1cc(C)[nH+]cn1)C1CCCC1 ZINC000664559567 411987234 /nfs/dbraw/zinc/98/72/34/411987234.db2.gz DCLOWSXQZLTCOD-GFCCVEGCSA-N 1 2 235.331 2.402 20 0 BEADLO c1csc(C[N@@H+]2CCc3nccnc3C2)c1 ZINC000662123079 411993767 /nfs/dbraw/zinc/99/37/67/411993767.db2.gz VYGPXJDWWJBOCZ-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1csc(C[N@H+]2CCc3nccnc3C2)c1 ZINC000662123079 411993770 /nfs/dbraw/zinc/99/37/70/411993770.db2.gz VYGPXJDWWJBOCZ-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO Cc1cc(NC[C@@H]2CCOC2(C)C)nc[nH+]1 ZINC000664601973 411995328 /nfs/dbraw/zinc/99/53/28/411995328.db2.gz DREOOCNKYZKCBB-JTQLQIEISA-N 1 2 221.304 2.012 20 0 BEADLO Cc1nc(N[C@H](C)c2nccn2C)c(C)c(C)[nH+]1 ZINC000664608601 411997835 /nfs/dbraw/zinc/99/78/35/411997835.db2.gz IBLGGIVQMGHBTG-SNVBAGLBSA-N 1 2 245.330 2.308 20 0 BEADLO CN(C[C@H]1CC1(C)C)c1nc[nH+]c(N)c1Cl ZINC000664669428 412006207 /nfs/dbraw/zinc/00/62/07/412006207.db2.gz ADYHNNHJDIZNPI-SSDOTTSWSA-N 1 2 240.738 2.195 20 0 BEADLO CN(C[C@H]1CC1(C)C)c1[nH+]cnc(N)c1Cl ZINC000664669428 412006213 /nfs/dbraw/zinc/00/62/13/412006213.db2.gz ADYHNNHJDIZNPI-SSDOTTSWSA-N 1 2 240.738 2.195 20 0 BEADLO Cn1c[nH+]cc1Cc1noc(C2CC3(CC3)C2)n1 ZINC000664826108 412026485 /nfs/dbraw/zinc/02/64/85/412026485.db2.gz ZSNGMIGWUCMBNL-UHFFFAOYSA-N 1 2 244.298 2.052 20 0 BEADLO c1n[nH]c2c1C[N@H+](Cc1ccccc1)CCC2 ZINC000664864375 412035067 /nfs/dbraw/zinc/03/50/67/412035067.db2.gz NFXXGAXUAZYTRA-UHFFFAOYSA-N 1 2 227.311 2.358 20 0 BEADLO c1n[nH]c2c1C[N@@H+](Cc1ccccc1)CCC2 ZINC000664864375 412035068 /nfs/dbraw/zinc/03/50/68/412035068.db2.gz NFXXGAXUAZYTRA-UHFFFAOYSA-N 1 2 227.311 2.358 20 0 BEADLO Cc1nnc(C[N@H+](C)CCCCF)s1 ZINC000662255614 412050811 /nfs/dbraw/zinc/05/08/11/412050811.db2.gz GHMXMKOQIVOAGH-UHFFFAOYSA-N 1 2 217.313 2.028 20 0 BEADLO Cc1nnc(C[N@@H+](C)CCCCF)s1 ZINC000662255614 412050812 /nfs/dbraw/zinc/05/08/12/412050812.db2.gz GHMXMKOQIVOAGH-UHFFFAOYSA-N 1 2 217.313 2.028 20 0 BEADLO Cc1nnc(C[N@H+](C)CC2=CCCC2)s1 ZINC000662255804 412051365 /nfs/dbraw/zinc/05/13/65/412051365.db2.gz RQEBXNOEECBWQF-UHFFFAOYSA-N 1 2 223.345 2.389 20 0 BEADLO Cc1nnc(C[N@@H+](C)CC2=CCCC2)s1 ZINC000662255804 412051366 /nfs/dbraw/zinc/05/13/66/412051366.db2.gz RQEBXNOEECBWQF-UHFFFAOYSA-N 1 2 223.345 2.389 20 0 BEADLO Cc1cc[nH+]cc1Cc1noc(COC(C)C)n1 ZINC000664981984 412055975 /nfs/dbraw/zinc/05/59/75/412055975.db2.gz PIPBEDPKULEQFR-UHFFFAOYSA-N 1 2 247.298 2.289 20 0 BEADLO Cc1cc[nH+]cc1Cc1noc(CCCF)n1 ZINC000664983572 412056749 /nfs/dbraw/zinc/05/67/49/412056749.db2.gz FYYAWPCYPHAPOZ-UHFFFAOYSA-N 1 2 235.262 2.266 20 0 BEADLO CC[C@@H]1CCN1Cc1[nH+]ccn1CC(F)(F)F ZINC000292275191 171023837 /nfs/dbraw/zinc/02/38/37/171023837.db2.gz BJQJOJJECZLNGA-SECBINFHSA-N 1 2 247.264 2.430 20 0 BEADLO CC[C@@H]1CC[C@@H](C(=O)Nc2cc[nH+]c(C)c2)O1 ZINC000268137829 171033208 /nfs/dbraw/zinc/03/32/08/171033208.db2.gz NDVBCQRVGWGPFB-NEPJUHHUSA-N 1 2 234.299 2.286 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1c1[nH+]cnc2c1cnn2C ZINC000337784968 171038808 /nfs/dbraw/zinc/03/88/08/171038808.db2.gz AQQLPRAAYDKPNR-NXEZZACHSA-N 1 2 245.330 2.131 20 0 BEADLO O[C@@H]1C[C@@H](c2ccccc2)[N@H+](CC(F)F)C1 ZINC000665029833 412061005 /nfs/dbraw/zinc/06/10/05/412061005.db2.gz ZTUNNUUEXOKJQG-MNOVXSKESA-N 1 2 227.254 2.059 20 0 BEADLO O[C@@H]1C[C@@H](c2ccccc2)[N@@H+](CC(F)F)C1 ZINC000665029833 412061009 /nfs/dbraw/zinc/06/10/09/412061009.db2.gz ZTUNNUUEXOKJQG-MNOVXSKESA-N 1 2 227.254 2.059 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nccs2)CCS1 ZINC000135110789 171090609 /nfs/dbraw/zinc/09/06/09/171090609.db2.gz QQMZMFDOOFCMCM-SECBINFHSA-N 1 2 228.386 2.471 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nccs2)CCS1 ZINC000135110789 171090611 /nfs/dbraw/zinc/09/06/11/171090611.db2.gz QQMZMFDOOFCMCM-SECBINFHSA-N 1 2 228.386 2.471 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1cnc(C)s1 ZINC000115571744 171105912 /nfs/dbraw/zinc/10/59/12/171105912.db2.gz FTWSIPZGVMEOMB-SNVBAGLBSA-N 1 2 226.345 2.062 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1cnc(C)s1 ZINC000115571744 171105915 /nfs/dbraw/zinc/10/59/15/171105915.db2.gz FTWSIPZGVMEOMB-SNVBAGLBSA-N 1 2 226.345 2.062 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1csc(C)n1 ZINC000268814614 171110616 /nfs/dbraw/zinc/11/06/16/171110616.db2.gz HEWOZQBXETWWRZ-JOYOIKCWSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1csc(C)n1 ZINC000268814614 171110618 /nfs/dbraw/zinc/11/06/18/171110618.db2.gz HEWOZQBXETWWRZ-JOYOIKCWSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc(F)cn1 ZINC000276198801 171111082 /nfs/dbraw/zinc/11/10/82/171111082.db2.gz DYVSPBPIMLUREQ-GXFFZTMASA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(F)cn1 ZINC000276198801 171111086 /nfs/dbraw/zinc/11/10/86/171111086.db2.gz DYVSPBPIMLUREQ-GXFFZTMASA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1ncc(C)s1 ZINC000271501846 171114848 /nfs/dbraw/zinc/11/48/48/171114848.db2.gz KRWHDGWKZNKSBA-MWLCHTKSSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1ncc(C)s1 ZINC000271501846 171114850 /nfs/dbraw/zinc/11/48/50/171114850.db2.gz KRWHDGWKZNKSBA-MWLCHTKSSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000336247181 171131958 /nfs/dbraw/zinc/13/19/58/171131958.db2.gz LQAGZWLABLSXFU-ZYHUDNBSSA-N 1 2 247.342 2.162 20 0 BEADLO CC[C@@H]1C[C@H]1Nc1nc(N(C)C)nc(C(C)C)[nH+]1 ZINC000302005107 171141724 /nfs/dbraw/zinc/14/17/24/171141724.db2.gz SJKDDFZHUMAEDS-NXEZZACHSA-N 1 2 249.362 2.271 20 0 BEADLO CC[C@@H]1C[C@H]1Nc1nc(C(C)C)[nH+]c(N(C)C)n1 ZINC000302005107 171141727 /nfs/dbraw/zinc/14/17/27/171141727.db2.gz SJKDDFZHUMAEDS-NXEZZACHSA-N 1 2 249.362 2.271 20 0 BEADLO CC[C@@](C)([NH2+][C@@H]1C=CCCC1)C(=O)OC ZINC000293134713 171175616 /nfs/dbraw/zinc/17/56/16/171175616.db2.gz LMLZFVXWYIGQJE-ZYHUDNBSSA-N 1 2 211.305 2.026 20 0 BEADLO CC[C@@](C)(O)CNc1nc(C)[nH+]c2c1CCCC2 ZINC000180432609 171185560 /nfs/dbraw/zinc/18/55/60/171185560.db2.gz KJKXNIJYAVYMCC-CQSZACIVSA-N 1 2 249.358 2.237 20 0 BEADLO CC[C@@]1(C)CCN(c2cc[nH+]c(C)n2)C1 ZINC000336603988 171202131 /nfs/dbraw/zinc/20/21/31/171202131.db2.gz BSLISDQBZIBALV-LBPRGKRZSA-N 1 2 205.305 2.411 20 0 BEADLO CC[C@@]1(C)C[C@H]1C(=O)Nc1c[nH+]ccc1OC ZINC000126014908 171207875 /nfs/dbraw/zinc/20/78/75/171207875.db2.gz BHDKICMLOHXSIF-ZANVPECISA-N 1 2 234.299 2.465 20 0 BEADLO CC[C@H](C)C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000299534306 171247626 /nfs/dbraw/zinc/24/76/26/171247626.db2.gz NSHWRNQRZXEWSM-NSHDSACASA-N 1 2 235.331 2.093 20 0 BEADLO CC[C@H](C)C(=O)Nc1cccc2[nH+]ccn21 ZINC000266181919 171255949 /nfs/dbraw/zinc/25/59/49/171255949.db2.gz YIYNMHRRWAIBRX-VIFPVBQESA-N 1 2 217.272 2.319 20 0 BEADLO CC[C@H](C)CC(=O)N(C)CCCn1cc[nH+]c1 ZINC000189526530 171257223 /nfs/dbraw/zinc/25/72/23/171257223.db2.gz FMCPMMMEVXNSFL-LBPRGKRZSA-N 1 2 237.347 2.168 20 0 BEADLO CC[C@H](C)CC(=O)NCc1c[nH+]ccc1OC ZINC000293154512 171260608 /nfs/dbraw/zinc/26/06/08/171260608.db2.gz BKYHGSAQAODXMB-JTQLQIEISA-N 1 2 236.315 2.143 20 0 BEADLO CC[C@H](C)CC(=O)NCc1ccn2cc[nH+]c2c1 ZINC000189443589 171261404 /nfs/dbraw/zinc/26/14/04/171261404.db2.gz RSMOCEJSEXEGLB-NSHDSACASA-N 1 2 245.326 2.387 20 0 BEADLO CC[C@H](C)CONC(=O)c1ccc2[nH+]ccn2c1 ZINC000293658273 171289987 /nfs/dbraw/zinc/28/99/87/171289987.db2.gz HLGNWSZAWWPPLT-JTQLQIEISA-N 1 2 247.298 2.042 20 0 BEADLO CC[C@H](C)CONC(=O)Nc1cc[nH+]cc1C ZINC000297901677 171290447 /nfs/dbraw/zinc/29/04/47/171290447.db2.gz XOIGXRCVYQTYBX-VIFPVBQESA-N 1 2 237.303 2.489 20 0 BEADLO CC[C@H](C)NC(=O)[C@@H](C)[NH+]1Cc2ccccc2C1 ZINC000178646275 171332656 /nfs/dbraw/zinc/33/26/56/171332656.db2.gz GCABMSSHHXZILG-NWDGAFQWSA-N 1 2 246.354 2.305 20 0 BEADLO CC[C@H](C)[NH2+][C@@H](C(=O)OC)c1ccccc1 ZINC000037976077 171345480 /nfs/dbraw/zinc/34/54/80/171345480.db2.gz ZWGFTAZHZOLJCS-CMPLNLGQSA-N 1 2 221.300 2.289 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000356556781 171358376 /nfs/dbraw/zinc/35/83/76/171358376.db2.gz YVUBSDZUMAZHNX-VHSXEESVSA-N 1 2 223.320 2.050 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)N1CCn2cc(C)[nH+]c2C1 ZINC000374673420 171358817 /nfs/dbraw/zinc/35/88/17/171358817.db2.gz AMPRRKSDWOIAFY-CMPLNLGQSA-N 1 2 249.358 2.216 20 0 BEADLO CC[C@H](C)[C@@H]([NH2+]Cc1ccccc1)C(=O)OC ZINC000035042628 171374429 /nfs/dbraw/zinc/37/44/29/171374429.db2.gz PTFWBRJIWLYMTF-WCQYABFASA-N 1 2 235.327 2.364 20 0 BEADLO CC[C@H](C)[C@@H]([NH2+]Cc1ccsc1)C(=O)OC ZINC000037102727 171374485 /nfs/dbraw/zinc/37/44/85/171374485.db2.gz ILVDZUSDPCWOLX-GXSJLCMTSA-N 1 2 241.356 2.425 20 0 BEADLO Cc1nc([C@@H](C)[N@H+](C)C[C@H]2CC2(C)C)no1 ZINC000662346003 412117057 /nfs/dbraw/zinc/11/70/57/412117057.db2.gz PUZLUYDDSSCBFX-PSASIEDQSA-N 1 2 223.320 2.417 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+](C)C[C@H]2CC2(C)C)no1 ZINC000662346003 412117062 /nfs/dbraw/zinc/11/70/62/412117062.db2.gz PUZLUYDDSSCBFX-PSASIEDQSA-N 1 2 223.320 2.417 20 0 BEADLO Cn1cc[nH+]c1-c1ccc2c(c1)CCOC2 ZINC000665181306 412121986 /nfs/dbraw/zinc/12/19/86/412121986.db2.gz OCPNPBYQGPPMSZ-UHFFFAOYSA-N 1 2 214.268 2.160 20 0 BEADLO CC(C)Oc1ccc(-c2[nH+]ccn2C)cc1N ZINC000665181631 412122593 /nfs/dbraw/zinc/12/25/93/412122593.db2.gz UOLNQMKCSFDNHT-UHFFFAOYSA-N 1 2 231.299 2.457 20 0 BEADLO C[C@]1(C(F)F)C[N@H+](CCC(F)(F)F)CCO1 ZINC000662369823 412128484 /nfs/dbraw/zinc/12/84/84/412128484.db2.gz XDOBZNYKRMZSHG-MRVPVSSYSA-N 1 2 247.207 2.295 20 0 BEADLO C[C@]1(C(F)F)C[N@@H+](CCC(F)(F)F)CCO1 ZINC000662369823 412128488 /nfs/dbraw/zinc/12/84/88/412128488.db2.gz XDOBZNYKRMZSHG-MRVPVSSYSA-N 1 2 247.207 2.295 20 0 BEADLO CC(C)(C)c1nc(C[N@@H+]2CC3CC2(C)C3)no1 ZINC000662381723 412133366 /nfs/dbraw/zinc/13/33/66/412133366.db2.gz CKNLQUHKCKXCEA-UHFFFAOYSA-N 1 2 235.331 2.351 20 0 BEADLO CC(C)(C)c1nc(C[N@H+]2CC3CC2(C)C3)no1 ZINC000662381723 412133367 /nfs/dbraw/zinc/13/33/67/412133367.db2.gz CKNLQUHKCKXCEA-UHFFFAOYSA-N 1 2 235.331 2.351 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]Cc1cccc(N)c1 ZINC000665234111 412172755 /nfs/dbraw/zinc/17/27/55/412172755.db2.gz XKVIAXNURFDHPU-VIFPVBQESA-N 1 2 230.315 2.151 20 0 BEADLO CC[C@H]1CCCN(C(=O)CCc2[nH]cc[nH+]2)CC1 ZINC000287838844 171613869 /nfs/dbraw/zinc/61/38/69/171613869.db2.gz DHBUZQSXOMUXFU-LBPRGKRZSA-N 1 2 249.358 2.381 20 0 BEADLO CCc1ccc(C(=O)NCc2[nH]c[nH+]c2C)cc1 ZINC000266937892 171787087 /nfs/dbraw/zinc/78/70/87/171787087.db2.gz AHUIIRFOJRNHAU-UHFFFAOYSA-N 1 2 243.310 2.211 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@H](C)[C@@H]2C)nc1 ZINC000334167301 171799733 /nfs/dbraw/zinc/79/97/33/171799733.db2.gz AMHKVRNULKCXKJ-NWDGAFQWSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@H](C)[C@@H]2C)nc1 ZINC000334167301 171799734 /nfs/dbraw/zinc/79/97/34/171799734.db2.gz AMHKVRNULKCXKJ-NWDGAFQWSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1ccc(C[N@@H+]2CCC[C@]23CCOC3=O)o1 ZINC000190030648 171799822 /nfs/dbraw/zinc/79/98/22/171799822.db2.gz BQOBCLDKWNZXPF-CQSZACIVSA-N 1 2 249.310 2.124 20 0 BEADLO CCc1ccc(C[N@H+]2CCC[C@]23CCOC3=O)o1 ZINC000190030648 171799824 /nfs/dbraw/zinc/79/98/24/171799824.db2.gz BQOBCLDKWNZXPF-CQSZACIVSA-N 1 2 249.310 2.124 20 0 BEADLO CCc1[nH]c2ccc(NC(C)=O)cc2[nH+]1 ZINC000026440377 172012718 /nfs/dbraw/zinc/01/27/18/172012718.db2.gz RZRQZSZKFAIXDD-UHFFFAOYSA-N 1 2 203.245 2.084 20 0 BEADLO CCc1nn(C)cc1N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000294242682 172043652 /nfs/dbraw/zinc/04/36/52/172043652.db2.gz WFENUMNLCZGKLG-KOLCDFICSA-N 1 2 245.330 2.297 20 0 BEADLO CCc1nnc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)o1 ZINC000104674697 172051131 /nfs/dbraw/zinc/05/11/31/172051131.db2.gz JKWZWYLMHZRGLB-NSHDSACASA-N 1 2 246.314 2.297 20 0 BEADLO CCc1nnc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)o1 ZINC000104674697 172051134 /nfs/dbraw/zinc/05/11/34/172051134.db2.gz JKWZWYLMHZRGLB-NSHDSACASA-N 1 2 246.314 2.297 20 0 BEADLO CCc1nnc(C[NH2+]Cc2ccc(C)cn2)s1 ZINC000353127929 172052517 /nfs/dbraw/zinc/05/25/17/172052517.db2.gz SDCWEHUHYWBIMR-UHFFFAOYSA-N 1 2 248.355 2.094 20 0 BEADLO CCc1nnc(C[NH2+][C@@H](C)c2ccccc2)o1 ZINC000182028416 172053296 /nfs/dbraw/zinc/05/32/96/172053296.db2.gz AROWQFUEANACOD-JTQLQIEISA-N 1 2 231.299 2.483 20 0 BEADLO CCc1nnc(C[NH2+][C@H](C)c2ccccn2)s1 ZINC000273133827 172054240 /nfs/dbraw/zinc/05/42/40/172054240.db2.gz JAZHCVNNFLSVQI-SECBINFHSA-N 1 2 248.355 2.346 20 0 BEADLO CCc1nnc(COc2ccc(C)[nH+]c2CC)o1 ZINC000190767801 172055015 /nfs/dbraw/zinc/05/50/15/172055015.db2.gz GXACYQYWYKZEFV-UHFFFAOYSA-N 1 2 247.298 2.477 20 0 BEADLO CCc1noc(CCc2c[nH+]cc(C)c2)n1 ZINC000291935237 172083186 /nfs/dbraw/zinc/08/31/86/172083186.db2.gz PFGFQLIXHMVWOM-UHFFFAOYSA-N 1 2 217.272 2.121 20 0 BEADLO CCc1nocc1C[N@@H+](C)C[C@@H](F)CC ZINC000339608239 172095294 /nfs/dbraw/zinc/09/52/94/172095294.db2.gz PVBZNRATCVBBKK-JTQLQIEISA-N 1 2 214.284 2.417 20 0 BEADLO CCc1nocc1C[N@H+](C)C[C@@H](F)CC ZINC000339608239 172095298 /nfs/dbraw/zinc/09/52/98/172095298.db2.gz PVBZNRATCVBBKK-JTQLQIEISA-N 1 2 214.284 2.417 20 0 BEADLO CCc1nocc1C[N@@H+]1CCO[C@@H](C(C)C)C1 ZINC000352816375 172098874 /nfs/dbraw/zinc/09/88/74/172098874.db2.gz OZCPAZOGKLJZEF-CYBMUJFWSA-N 1 2 238.331 2.094 20 0 BEADLO CCc1nocc1C[N@H+]1CCO[C@@H](C(C)C)C1 ZINC000352816375 172098877 /nfs/dbraw/zinc/09/88/77/172098877.db2.gz OZCPAZOGKLJZEF-CYBMUJFWSA-N 1 2 238.331 2.094 20 0 BEADLO CCc1nocc1CNc1cccc[nH+]1 ZINC000339189374 172103458 /nfs/dbraw/zinc/10/34/58/172103458.db2.gz QNYKNPNAUKCESJ-UHFFFAOYSA-N 1 2 203.245 2.244 20 0 BEADLO CCn1cc(C[NH+]2Cc3ccccc3C2)cn1 ZINC000119949159 172167069 /nfs/dbraw/zinc/16/70/69/172167069.db2.gz ZSWUHQOBWPRJJR-UHFFFAOYSA-N 1 2 227.311 2.419 20 0 BEADLO CCn1cc(N[C@@H]2C[C@H](C)n3cc[nH+]c32)cn1 ZINC000294165131 172186341 /nfs/dbraw/zinc/18/63/41/172186341.db2.gz RAEJNFSCJPSBGG-GXSJLCMTSA-N 1 2 231.303 2.217 20 0 BEADLO CCn1cc(N[C@H](C)c2[nH+]ccn2CC)cn1 ZINC000297031600 172188764 /nfs/dbraw/zinc/18/87/64/172188764.db2.gz UTRRGKPSUYLSIH-SNVBAGLBSA-N 1 2 233.319 2.293 20 0 BEADLO CCn1cc([C@H](C)[NH2+]Cc2cscn2)cn1 ZINC000082625981 172197015 /nfs/dbraw/zinc/19/70/15/172197015.db2.gz IJABZPINANBTSF-VIFPVBQESA-N 1 2 236.344 2.210 20 0 BEADLO CCn1cccc1C[N@H+](C)Cc1cc(C)on1 ZINC000267346971 172203126 /nfs/dbraw/zinc/20/31/26/172203126.db2.gz ALKGAJUYFUXHTR-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CCn1cccc1C[N@@H+](C)Cc1cc(C)on1 ZINC000267346971 172203128 /nfs/dbraw/zinc/20/31/28/172203128.db2.gz ALKGAJUYFUXHTR-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)c1ccsc1C ZINC000295701165 172221687 /nfs/dbraw/zinc/22/16/87/172221687.db2.gz OGKVQTFTESHIHP-UHFFFAOYSA-N 1 2 249.339 2.203 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C1=CCCCC1 ZINC000295454078 172222069 /nfs/dbraw/zinc/22/20/69/172222069.db2.gz BHIIOVPASFBFNN-UHFFFAOYSA-N 1 2 233.315 2.020 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C1(CC)CCCC1 ZINC000296819298 172222377 /nfs/dbraw/zinc/22/23/77/172222377.db2.gz GCCXNHYZWRBPNT-UHFFFAOYSA-N 1 2 249.358 2.490 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@@H](C)C(C)(C)C ZINC000295813757 172222540 /nfs/dbraw/zinc/22/25/40/172222540.db2.gz SVPSCCKMRFMKCM-SNVBAGLBSA-N 1 2 237.347 2.201 20 0 BEADLO CCn1cc[nH+]c1CNc1cccc(F)n1 ZINC000162443971 172226691 /nfs/dbraw/zinc/22/66/91/172226691.db2.gz MDVJABYKOABSAX-UHFFFAOYSA-N 1 2 220.251 2.049 20 0 BEADLO CCn1nc(C)c(C[NH2+]Cc2ccc(F)cc2)n1 ZINC000294768668 172247475 /nfs/dbraw/zinc/24/74/75/172247475.db2.gz MMGLIJNSRVUMSL-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO CCn1nccc1C[N@H+](C)Cc1ccoc1 ZINC000352647180 172264823 /nfs/dbraw/zinc/26/48/23/172264823.db2.gz YAAWKLVIFSTHMQ-UHFFFAOYSA-N 1 2 219.288 2.128 20 0 BEADLO CCn1nccc1C[N@@H+](C)Cc1ccoc1 ZINC000352647180 172264826 /nfs/dbraw/zinc/26/48/26/172264826.db2.gz YAAWKLVIFSTHMQ-UHFFFAOYSA-N 1 2 219.288 2.128 20 0 BEADLO CCn1ncnc1C[N@H+](C)[C@H](C)c1ccccc1 ZINC000193297841 172278812 /nfs/dbraw/zinc/27/88/12/172278812.db2.gz ASDDTWRIWCEQHQ-GFCCVEGCSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1ncnc1C[N@@H+](C)[C@H](C)c1ccccc1 ZINC000193297841 172278815 /nfs/dbraw/zinc/27/88/15/172278815.db2.gz ASDDTWRIWCEQHQ-GFCCVEGCSA-N 1 2 244.342 2.491 20 0 BEADLO CN(C)C(=O)[C@H]1CCC[C@@H](Nc2cccc[nH+]2)C1 ZINC000265138683 172386119 /nfs/dbraw/zinc/38/61/19/172386119.db2.gz PQIOEEWMFQENKK-NWDGAFQWSA-N 1 2 247.342 2.141 20 0 BEADLO C[N@@H+]1CCc2ncnc(N[C@H]3CCC3(C)C)c2C1 ZINC000286448315 173173133 /nfs/dbraw/zinc/17/31/33/173173133.db2.gz OQLIVQBITMOKSY-LBPRGKRZSA-N 1 2 246.358 2.065 20 0 BEADLO C[N@H+]1CCc2ncnc(N[C@H]3CCC3(C)C)c2C1 ZINC000286448315 173173136 /nfs/dbraw/zinc/17/31/36/173173136.db2.gz OQLIVQBITMOKSY-LBPRGKRZSA-N 1 2 246.358 2.065 20 0 BEADLO C[NH2+]Cc1noc(C2(Cc3ccccc3)CC2)n1 ZINC000556902257 322930701 /nfs/dbraw/zinc/93/07/01/322930701.db2.gz RYFMVSMAVCXCAB-UHFFFAOYSA-N 1 2 243.310 2.063 20 0 BEADLO COCC(C)(C)CNc1cc[nH+]cc1F ZINC000308939878 174076694 /nfs/dbraw/zinc/07/66/94/174076694.db2.gz LVXHZWIJRDSZQQ-UHFFFAOYSA-N 1 2 212.268 2.305 20 0 BEADLO COCC(C)(C)CNc1c[nH+]ccc1C ZINC000336746026 174076758 /nfs/dbraw/zinc/07/67/58/174076758.db2.gz BAJSJSRPIBJHLU-UHFFFAOYSA-N 1 2 208.305 2.475 20 0 BEADLO COCC1=CC[N@H+](Cc2csc(C)n2)CC1 ZINC000187689428 174115876 /nfs/dbraw/zinc/11/58/76/174115876.db2.gz DNLFQXVARONUQO-UHFFFAOYSA-N 1 2 238.356 2.230 20 0 BEADLO COCC1=CC[N@@H+](Cc2csc(C)n2)CC1 ZINC000187689428 174115878 /nfs/dbraw/zinc/11/58/78/174115878.db2.gz DNLFQXVARONUQO-UHFFFAOYSA-N 1 2 238.356 2.230 20 0 BEADLO COCC1=CC[N@H+](Cc2ccn(C(C)C)n2)CC1 ZINC000187694245 174116942 /nfs/dbraw/zinc/11/69/42/174116942.db2.gz WBTLQDXDOGWTNN-UHFFFAOYSA-N 1 2 249.358 2.243 20 0 BEADLO COCC1=CC[N@@H+](Cc2ccn(C(C)C)n2)CC1 ZINC000187694245 174116944 /nfs/dbraw/zinc/11/69/44/174116944.db2.gz WBTLQDXDOGWTNN-UHFFFAOYSA-N 1 2 249.358 2.243 20 0 BEADLO COCCC1(C)CN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000289059143 174154052 /nfs/dbraw/zinc/15/40/52/174154052.db2.gz MTGYAGGRENRRTC-UHFFFAOYSA-N 1 2 247.342 2.217 20 0 BEADLO COCCCC[N@@H+]1CC[C@H](C)C(F)(F)C1 ZINC000352403787 174193804 /nfs/dbraw/zinc/19/38/04/174193804.db2.gz YCJDGWMCZMPFQS-JTQLQIEISA-N 1 2 221.291 2.390 20 0 BEADLO COCCCC[N@H+]1CC[C@H](C)C(F)(F)C1 ZINC000352403787 174193807 /nfs/dbraw/zinc/19/38/07/174193807.db2.gz YCJDGWMCZMPFQS-JTQLQIEISA-N 1 2 221.291 2.390 20 0 BEADLO COCCCN(C)c1cc[nH+]c(C(C)C)n1 ZINC000110308207 174220959 /nfs/dbraw/zinc/22/09/59/174220959.db2.gz IYZWGLVTUBUFLQ-UHFFFAOYSA-N 1 2 223.320 2.073 20 0 BEADLO COCCCN(C)c1[nH]c2ccccc2[nH+]1 ZINC000270548829 174221053 /nfs/dbraw/zinc/22/10/53/174221053.db2.gz FRCMGDIVYLCFEV-UHFFFAOYSA-N 1 2 219.288 2.036 20 0 BEADLO Cc1cccc(OC[C@@H](C)[NH2+]Cc2ccn[nH]2)c1 ZINC000066989186 1173063452 /nfs/dbraw/zinc/06/34/52/1173063452.db2.gz OPIFXSAPODRXQP-GFCCVEGCSA-N 1 2 245.326 2.275 20 0 BEADLO COCCCNc1cc(C)[nH+]c(C2CC2)n1 ZINC000264656435 174251315 /nfs/dbraw/zinc/25/13/15/174251315.db2.gz PUCOZYYLJKAZJE-UHFFFAOYSA-N 1 2 221.304 2.111 20 0 BEADLO COCCN(CC(C)C)c1cccc[nH+]1 ZINC000277012240 174288413 /nfs/dbraw/zinc/28/84/13/174288413.db2.gz BFYHYXYXYHOBPX-UHFFFAOYSA-N 1 2 208.305 2.190 20 0 BEADLO COCC[N@H+](CCC(C)C)CC(F)F ZINC000103485714 174289065 /nfs/dbraw/zinc/28/90/65/174289065.db2.gz DDIKYIKQNBRELD-UHFFFAOYSA-N 1 2 209.280 2.246 20 0 BEADLO COCC[N@@H+](CCC(C)C)CC(F)F ZINC000103485714 174289066 /nfs/dbraw/zinc/28/90/66/174289066.db2.gz DDIKYIKQNBRELD-UHFFFAOYSA-N 1 2 209.280 2.246 20 0 BEADLO COCCN(c1cc(C)[nH+]cn1)[C@@H]1CC[C@H](C)C1 ZINC000302731826 174302086 /nfs/dbraw/zinc/30/20/86/174302086.db2.gz TUPSTPPBPJNNOS-WCQYABFASA-N 1 2 249.358 2.426 20 0 BEADLO COCCN(c1cc[nH+]c(C)n1)[C@@H]1CC[C@@H](C)C1 ZINC000357647194 174302844 /nfs/dbraw/zinc/30/28/44/174302844.db2.gz QGXMEGDASZVHLD-DGCLKSJQSA-N 1 2 249.358 2.426 20 0 BEADLO COCC[C@@H]([NH2+]Cc1ccon1)c1ccco1 ZINC000273294935 174394467 /nfs/dbraw/zinc/39/44/67/174394467.db2.gz QHKDLGSPQKRXOK-LLVKDONJSA-N 1 2 236.271 2.135 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1ncc(C(C)C)s1 ZINC000354058539 174514772 /nfs/dbraw/zinc/51/47/72/174514772.db2.gz IMOPPBAVSIHYEG-JTQLQIEISA-N 1 2 240.372 2.487 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1ncc(C(C)C)s1 ZINC000354058539 174514773 /nfs/dbraw/zinc/51/47/73/174514773.db2.gz IMOPPBAVSIHYEG-JTQLQIEISA-N 1 2 240.372 2.487 20 0 BEADLO COC[C@H](C)N(C)c1cc(C)[nH+]c(C2CC2)n1 ZINC000172014538 174538562 /nfs/dbraw/zinc/53/85/62/174538562.db2.gz IUSMAGYAJCDLEA-JTQLQIEISA-N 1 2 235.331 2.134 20 0 BEADLO CO[C@H](CNc1cc(C)[nH+]c(C2CC2)n1)C1CC1 ZINC000292686098 174870338 /nfs/dbraw/zinc/87/03/38/174870338.db2.gz FBUASJXAPQLZQZ-GFCCVEGCSA-N 1 2 247.342 2.499 20 0 BEADLO COc1cc(NCc2[nH+]ccn2C)ccc1F ZINC000160099921 175003406 /nfs/dbraw/zinc/00/34/06/175003406.db2.gz FNZQZTWYBKTFGZ-UHFFFAOYSA-N 1 2 235.262 2.180 20 0 BEADLO COc1ccc(C)cc1NCc1[nH+]ccn1C ZINC000036804555 175078411 /nfs/dbraw/zinc/07/84/11/175078411.db2.gz POTQUCJHMXGWRC-UHFFFAOYSA-N 1 2 231.299 2.349 20 0 BEADLO COc1ccc(C[N@@H+]2CCC[C@](C)(F)C2)cn1 ZINC000296025764 175099559 /nfs/dbraw/zinc/09/95/59/175099559.db2.gz MTMAZCWVNSXHFJ-ZDUSSCGKSA-N 1 2 238.306 2.414 20 0 BEADLO COc1ccc(C[N@H+]2CCC[C@](C)(F)C2)cn1 ZINC000296025764 175099560 /nfs/dbraw/zinc/09/95/60/175099560.db2.gz MTMAZCWVNSXHFJ-ZDUSSCGKSA-N 1 2 238.306 2.414 20 0 BEADLO COc1ccc(C[NH2+]Cc2cocn2)cc1F ZINC000237252147 175108480 /nfs/dbraw/zinc/10/84/80/175108480.db2.gz XLYLLTSQWFAMPU-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1ncc[nH]1 ZINC000049715259 175133452 /nfs/dbraw/zinc/13/34/52/175133452.db2.gz UKOGNOIDLOAULZ-VIFPVBQESA-N 1 2 249.289 2.408 20 0 BEADLO COc1ccc(NCc2c[nH+]cn2C)cc1OC ZINC000090153447 175152673 /nfs/dbraw/zinc/15/26/73/175152673.db2.gz YGHVUZXVZLZINQ-UHFFFAOYSA-N 1 2 247.298 2.049 20 0 BEADLO COc1ccc(OC)c(-c2ccc(N)[nH+]c2)c1 ZINC000052886396 175163899 /nfs/dbraw/zinc/16/38/99/175163899.db2.gz ZSHGNECFKRRPHL-UHFFFAOYSA-N 1 2 230.267 2.348 20 0 BEADLO COc1ccc([C@H](C)[NH2+]Cc2c[nH]cn2)cc1 ZINC000112344496 175189039 /nfs/dbraw/zinc/18/90/39/175189039.db2.gz CLYSIKVNQZOINU-JTQLQIEISA-N 1 2 231.299 2.269 20 0 BEADLO COc1cccc(C[N@H+](C)CCF)c1OC ZINC000268287987 175255340 /nfs/dbraw/zinc/25/53/40/175255340.db2.gz IFVICLNFMHVTPD-UHFFFAOYSA-N 1 2 227.279 2.105 20 0 BEADLO COc1cccc(C[N@@H+](C)CCF)c1OC ZINC000268287987 175255341 /nfs/dbraw/zinc/25/53/41/175255341.db2.gz IFVICLNFMHVTPD-UHFFFAOYSA-N 1 2 227.279 2.105 20 0 BEADLO COc1cccc(C[NH2+]Cc2nc(C)cs2)n1 ZINC000070093352 175265218 /nfs/dbraw/zinc/26/52/18/175265218.db2.gz TYQMIUKXGPRRAU-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO COc1cccc(C[NH2+][C@@H](C)c2nc(C)no2)c1 ZINC000356900290 175266496 /nfs/dbraw/zinc/26/64/96/175266496.db2.gz YGDNXPPGXWREAW-VIFPVBQESA-N 1 2 247.298 2.237 20 0 BEADLO COc1cccc(N[C@@H]2CCn3cc[nH+]c32)c1 ZINC000293884616 175280157 /nfs/dbraw/zinc/28/01/57/175280157.db2.gz FXUGLSGHPAZLCH-GFCCVEGCSA-N 1 2 229.283 2.449 20 0 BEADLO COc1cccc2c(N[C@H]3CCOC3)cc[nH+]c12 ZINC000302497401 175299921 /nfs/dbraw/zinc/29/99/21/175299921.db2.gz BVGHDFFTHBOZDU-JTQLQIEISA-N 1 2 244.294 2.444 20 0 BEADLO COc1cccc2c(NCC[C@@H](C)O)cc[nH+]c12 ZINC000275632840 175300369 /nfs/dbraw/zinc/30/03/69/175300369.db2.gz UGIFVNZROOGMMC-SNVBAGLBSA-N 1 2 246.310 2.426 20 0 BEADLO COc1cccc2c1[nH]c(=[NH+]CC(C)(C)C)n2C ZINC000358381507 175305518 /nfs/dbraw/zinc/30/55/18/175305518.db2.gz JTBRIBYDIBRHPH-UHFFFAOYSA-N 1 2 247.342 2.462 20 0 BEADLO COc1ccccc1[C@@H](C)[NH2+]Cc1ccn(C)n1 ZINC000112338602 175344426 /nfs/dbraw/zinc/34/44/26/175344426.db2.gz VMVUISHTUNGEBM-LLVKDONJSA-N 1 2 245.326 2.280 20 0 BEADLO COc1ccccc1[C@H](C)[NH2+]Cc1nccn1C ZINC000049856599 175351511 /nfs/dbraw/zinc/35/15/11/175351511.db2.gz XZUQIWDIDKWFMR-NSHDSACASA-N 1 2 245.326 2.280 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)[C@@H]1CC=CCC1 ZINC000293278938 175371536 /nfs/dbraw/zinc/37/15/36/175371536.db2.gz GYGBTYOQYQXERI-LLVKDONJSA-N 1 2 246.310 2.063 20 0 BEADLO COc1ccncc1C[NH2+][C@@H](C)c1cscn1 ZINC000294097541 175372353 /nfs/dbraw/zinc/37/23/53/175372353.db2.gz JDYJPQXIXMRMBQ-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO COc1cc[nH+]cc1COC(=O)C(C)(C)C ZINC000288623683 175373124 /nfs/dbraw/zinc/37/31/24/175373124.db2.gz JPZZPXYQIUXPDK-UHFFFAOYSA-N 1 2 223.272 2.180 20 0 BEADLO COc1cc[nH+]cc1COC(=O)/C=C/C1CC1 ZINC000287258509 175373402 /nfs/dbraw/zinc/37/34/02/175373402.db2.gz RNTHXLLNDCUOQD-SNAWJCMRSA-N 1 2 233.267 2.100 20 0 BEADLO COc1cc[nH+]cc1COc1nc(C(C)C)no1 ZINC000286532230 175373485 /nfs/dbraw/zinc/37/34/85/175373485.db2.gz KEPKRCZSSJWDMU-UHFFFAOYSA-N 1 2 249.270 2.176 20 0 BEADLO COc1cc[nH+]cc1CSc1ncc(C)cn1 ZINC000286488253 175374160 /nfs/dbraw/zinc/37/41/60/175374160.db2.gz HVVMYTWHVIKPTJ-UHFFFAOYSA-N 1 2 247.323 2.481 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@H](C)C1CC1 ZINC000178461503 175375073 /nfs/dbraw/zinc/37/50/73/175375073.db2.gz YITABRHSTXZTFH-MRVPVSSYSA-N 1 2 220.272 2.075 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@H](C)CSC ZINC000066768946 175375137 /nfs/dbraw/zinc/37/51/37/175375137.db2.gz IVDNLJBOEIJVGT-MRVPVSSYSA-N 1 2 240.328 2.028 20 0 BEADLO COc1cncc(C[N@@H+]2CCC[C@@](C)(F)C2)c1 ZINC000295405368 175386004 /nfs/dbraw/zinc/38/60/04/175386004.db2.gz MJEQHVPJOFEUIT-CYBMUJFWSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cncc(C[N@H+]2CCC[C@@](C)(F)C2)c1 ZINC000295405368 175386005 /nfs/dbraw/zinc/38/60/05/175386005.db2.gz MJEQHVPJOFEUIT-CYBMUJFWSA-N 1 2 238.306 2.414 20 0 BEADLO C[C@@H](c1ccco1)[N@H+](C)Cc1cocn1 ZINC000191926708 176031895 /nfs/dbraw/zinc/03/18/95/176031895.db2.gz LJQIAODBVDWCJR-VIFPVBQESA-N 1 2 206.245 2.461 20 0 BEADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1cocn1 ZINC000191926708 176031897 /nfs/dbraw/zinc/03/18/97/176031897.db2.gz LJQIAODBVDWCJR-VIFPVBQESA-N 1 2 206.245 2.461 20 0 BEADLO C[C@@H](c1cnccn1)[N@H+](C)CCC(F)(F)F ZINC000342186448 176036045 /nfs/dbraw/zinc/03/60/45/176036045.db2.gz JBSCHWKGNCRZKH-QMMMGPOBSA-N 1 2 233.237 2.422 20 0 BEADLO C[C@@H](c1cnccn1)[N@@H+](C)CCC(F)(F)F ZINC000342186448 176036048 /nfs/dbraw/zinc/03/60/48/176036048.db2.gz JBSCHWKGNCRZKH-QMMMGPOBSA-N 1 2 233.237 2.422 20 0 BEADLO C[C@H](c1cccs1)c1noc(C[NH+](C)C)n1 ZINC000277921248 176041825 /nfs/dbraw/zinc/04/18/25/176041825.db2.gz MXEANBVAJBDRIF-MRVPVSSYSA-N 1 2 237.328 2.345 20 0 BEADLO C[C@@H]1CC/C(=C\C(=O)N(C)Cc2[nH+]ccn2C)C1 ZINC000267835848 176055821 /nfs/dbraw/zinc/05/58/21/176055821.db2.gz FXNFDKQFZHWINO-LWMMSDEHSA-N 1 2 247.342 2.125 20 0 BEADLO C[C@@H]1CCCN1c1cc[nH+]c(C2CC2)n1 ZINC000172812437 176111148 /nfs/dbraw/zinc/11/11/48/176111148.db2.gz LCHYKGQDEFUHEF-SECBINFHSA-N 1 2 203.289 2.343 20 0 BEADLO C[C@@H]1CCC[C@@H]1CC(=O)N1CCn2c[nH+]cc2C1 ZINC000290955798 176126822 /nfs/dbraw/zinc/12/68/22/176126822.db2.gz QUUYQMXPVJMAOC-VXGBXAGGSA-N 1 2 247.342 2.052 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cccs2)CC[S@@]1=O ZINC000277101226 176176190 /nfs/dbraw/zinc/17/61/90/176176190.db2.gz GLXMJHIOFODTAB-BMIGLBTASA-N 1 2 243.397 2.091 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cccs2)CC[S@@]1=O ZINC000277101226 176176191 /nfs/dbraw/zinc/17/61/91/176176191.db2.gz GLXMJHIOFODTAB-BMIGLBTASA-N 1 2 243.397 2.091 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2csnn2)CC1(C)C ZINC000336320732 176178373 /nfs/dbraw/zinc/17/83/73/176178373.db2.gz HLMUROYJGYAXIB-SECBINFHSA-N 1 2 225.361 2.406 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2csnn2)CC1(C)C ZINC000336320732 176178375 /nfs/dbraw/zinc/17/83/75/176178375.db2.gz HLMUROYJGYAXIB-SECBINFHSA-N 1 2 225.361 2.406 20 0 BEADLO C[C@@H]1CCOCC[N@@H+]1Cc1cnc(Cl)s1 ZINC000362232195 176189756 /nfs/dbraw/zinc/18/97/56/176189756.db2.gz BDTFDPZLTYIKAU-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@@H]1CCOCC[N@H+]1Cc1cnc(Cl)s1 ZINC000362232195 176189758 /nfs/dbraw/zinc/18/97/58/176189758.db2.gz BDTFDPZLTYIKAU-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@@H]1CC[C@H]([NH2+]c2ccc(-n3cnnn3)cc2)C1 ZINC000080427162 176235066 /nfs/dbraw/zinc/23/50/66/176235066.db2.gz VJQAHMLQZAINEC-PWSUYJOCSA-N 1 2 243.314 2.263 20 0 BEADLO C[C@@H]1CC[C@H](Nc2nc[nH+]c(N)c2Cl)C1 ZINC000235335061 176235176 /nfs/dbraw/zinc/23/51/76/176235176.db2.gz JFPPLNDDPYQPQG-RQJHMYQMSA-N 1 2 226.711 2.313 20 0 BEADLO C[C@@H]1CC[C@H](Nc2[nH+]cnc(N)c2Cl)C1 ZINC000235335061 176235178 /nfs/dbraw/zinc/23/51/78/176235178.db2.gz JFPPLNDDPYQPQG-RQJHMYQMSA-N 1 2 226.711 2.313 20 0 BEADLO C[C@@H]1C[N@H+](C/C=C/c2ccccc2)CC[S@@]1=O ZINC000336413375 176280667 /nfs/dbraw/zinc/28/06/67/176280667.db2.gz VLTUBPJDDGOVAV-GBFFFSQQSA-N 1 2 249.379 2.153 20 0 BEADLO C[C@@H]1C[N@@H+](C/C=C/c2ccccc2)CC[S@@]1=O ZINC000336413375 176280669 /nfs/dbraw/zinc/28/06/69/176280669.db2.gz VLTUBPJDDGOVAV-GBFFFSQQSA-N 1 2 249.379 2.153 20 0 BEADLO C[C@@H]1C[N@H+](CC(=O)OCc2ccccc2)[C@@H]1C ZINC000293025237 176285200 /nfs/dbraw/zinc/28/52/00/176285200.db2.gz PHMBYMGYMMUENQ-VXGBXAGGSA-N 1 2 233.311 2.070 20 0 BEADLO C[C@@H]1C[N@@H+](CC(=O)OCc2ccccc2)[C@@H]1C ZINC000293025237 176285202 /nfs/dbraw/zinc/28/52/02/176285202.db2.gz PHMBYMGYMMUENQ-VXGBXAGGSA-N 1 2 233.311 2.070 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc[nH]n2)Cc2ccccc2O1 ZINC000292848480 176303578 /nfs/dbraw/zinc/30/35/78/176303578.db2.gz SYNQOCVSWVFZAS-LLVKDONJSA-N 1 2 243.310 2.193 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2O1 ZINC000292848480 176303580 /nfs/dbraw/zinc/30/35/80/176303580.db2.gz SYNQOCVSWVFZAS-LLVKDONJSA-N 1 2 243.310 2.193 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cccc3c2OCO3)[C@H](C)CO1 ZINC000092017504 176306099 /nfs/dbraw/zinc/30/60/99/176306099.db2.gz HEEXHXMBZBWCNJ-GHMZBOCLSA-N 1 2 249.310 2.025 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cccc3c2OCO3)[C@H](C)CO1 ZINC000092017504 176306100 /nfs/dbraw/zinc/30/61/00/176306100.db2.gz HEEXHXMBZBWCNJ-GHMZBOCLSA-N 1 2 249.310 2.025 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccno2)Cc2ccccc2O1 ZINC000292407927 176308709 /nfs/dbraw/zinc/30/87/09/176308709.db2.gz LWOPVQHIBVINFN-LLVKDONJSA-N 1 2 244.294 2.458 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccno2)Cc2ccccc2O1 ZINC000292407927 176308712 /nfs/dbraw/zinc/30/87/12/176308712.db2.gz LWOPVQHIBVINFN-LLVKDONJSA-N 1 2 244.294 2.458 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cncs2)CC(C)(C)O1 ZINC000119504022 176310389 /nfs/dbraw/zinc/31/03/89/176310389.db2.gz KTIPOJKRONKVHB-SECBINFHSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cncs2)CC(C)(C)O1 ZINC000119504022 176310390 /nfs/dbraw/zinc/31/03/90/176310390.db2.gz KTIPOJKRONKVHB-SECBINFHSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ncnn2-c2ccccc2)[C@@H]1C ZINC000293401606 176311774 /nfs/dbraw/zinc/31/17/74/176311774.db2.gz LODXULCKYHAZNN-VXGBXAGGSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ncnn2-c2ccccc2)[C@@H]1C ZINC000293401606 176311775 /nfs/dbraw/zinc/31/17/75/176311775.db2.gz LODXULCKYHAZNN-VXGBXAGGSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@@H]1COCC[N@@H+]1Cc1ccc(N)cc1Cl ZINC000049963023 176337259 /nfs/dbraw/zinc/33/72/59/176337259.db2.gz JMSMMYWJYGCDQM-SECBINFHSA-N 1 2 240.734 2.143 20 0 BEADLO C[C@@H]1COCC[N@H+]1Cc1ccc(N)cc1Cl ZINC000049963023 176337261 /nfs/dbraw/zinc/33/72/61/176337261.db2.gz JMSMMYWJYGCDQM-SECBINFHSA-N 1 2 240.734 2.143 20 0 BEADLO C[C@@H]1COCC[C@@H]1Nc1cc[nH+]c2ccncc12 ZINC000277390929 176342357 /nfs/dbraw/zinc/34/23/57/176342357.db2.gz GISMNONSXQPIIE-PWSUYJOCSA-N 1 2 243.310 2.467 20 0 BEADLO C[C@@H]1C[C@@H]1C[NH+]=c1[nH]c2cccc(F)c2n1C ZINC000357319032 176391767 /nfs/dbraw/zinc/39/17/67/176391767.db2.gz UDUHHMCKDGFUTH-RKDXNWHRSA-N 1 2 233.290 2.202 20 0 BEADLO CNc1ccccc1C[NH2+][C@@H](C)c1nnc(C)[nH]1 ZINC001652387531 1173071540 /nfs/dbraw/zinc/07/15/40/1173071540.db2.gz BPKJUHOOGXGLGZ-VIFPVBQESA-N 1 2 245.330 2.006 20 0 BEADLO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1cc[nH]n1 ZINC000288649051 176487493 /nfs/dbraw/zinc/48/74/93/176487493.db2.gz UYYOFSIJSZCDQH-TVQRCGJNSA-N 1 2 229.283 2.022 20 0 BEADLO C[C@H]([NH2+]Cc1nccs1)c1cccnc1 ZINC000041011702 176884192 /nfs/dbraw/zinc/88/41/92/176884192.db2.gz ZGNNPBMJBZRIMP-VIFPVBQESA-N 1 2 219.313 2.389 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccon1)c1ccccn1 ZINC000309428205 176914464 /nfs/dbraw/zinc/91/44/64/176914464.db2.gz AZSXSNQRBFMWTK-ZJUUUORDSA-N 1 2 217.272 2.481 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ncnn1C)c1ccccc1F ZINC000352900512 176914534 /nfs/dbraw/zinc/91/45/34/176914534.db2.gz JLYZANGILBGZOB-ZJUUUORDSA-N 1 2 248.305 2.366 20 0 BEADLO C[C@H](c1ccccc1)[S@@](=O)Cc1c[nH+]cn1C ZINC000268201193 177040929 /nfs/dbraw/zinc/04/09/29/177040929.db2.gz YSJMPQLTZKLPDC-DIFFPNOSSA-N 1 2 248.351 2.430 20 0 BEADLO C[C@H](c1ccccc1)[S@](=O)Cc1c[nH+]cn1C ZINC000268201197 177040968 /nfs/dbraw/zinc/04/09/68/177040968.db2.gz YSJMPQLTZKLPDC-PIGZYNQJSA-N 1 2 248.351 2.430 20 0 BEADLO C[C@H](c1ccccn1)N(C)Cc1[nH+]ccn1C ZINC000179259333 177042999 /nfs/dbraw/zinc/04/29/99/177042999.db2.gz ANSAEIKQPYMDSY-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1cccnc1)[N@H+](C)Cc1ccnn1C ZINC000091079575 177044702 /nfs/dbraw/zinc/04/47/02/177044702.db2.gz UVDLCOQUHIIILN-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1ccnn1C ZINC000091079575 177044703 /nfs/dbraw/zinc/04/47/03/177044703.db2.gz UVDLCOQUHIIILN-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1ccco1)N(C)C(=O)CCn1cc[nH+]c1 ZINC000299595713 177046390 /nfs/dbraw/zinc/04/63/90/177046390.db2.gz LWXJQQFVNFEZGR-LLVKDONJSA-N 1 2 247.298 2.086 20 0 BEADLO C[C@H](c1ccco1)[N@H+](C)Cc1cncn1C ZINC000177026425 177047005 /nfs/dbraw/zinc/04/70/05/177047005.db2.gz BDUBJOUNQSUCGH-SNVBAGLBSA-N 1 2 219.288 2.206 20 0 BEADLO C[C@H](c1ccco1)[N@@H+](C)Cc1cncn1C ZINC000177026425 177047007 /nfs/dbraw/zinc/04/70/07/177047007.db2.gz BDUBJOUNQSUCGH-SNVBAGLBSA-N 1 2 219.288 2.206 20 0 BEADLO C[C@H]1CCCC[C@H]1NC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000336624394 177088027 /nfs/dbraw/zinc/08/80/27/177088027.db2.gz IIRDOTLNVGNBEE-WDEREUQCSA-N 1 2 249.358 2.382 20 0 BEADLO C[C@H]1CCCN1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000290807920 177107275 /nfs/dbraw/zinc/10/72/75/177107275.db2.gz VYRQXCMYNMXWJL-JTQLQIEISA-N 1 2 244.298 2.351 20 0 BEADLO C[C@@H]1CCC[C@H](C)[C@H]1NC(=O)CCc1[nH]cc[nH+]1 ZINC000289338462 177116621 /nfs/dbraw/zinc/11/66/21/177116621.db2.gz ZFMFNFHFQAWQAU-YABSGUDNSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H]1CCC[C@@H](CNC(=O)CCc2[nH]cc[nH+]2)C1 ZINC000287363513 177119257 /nfs/dbraw/zinc/11/92/57/177119257.db2.gz YONSZYGBUFASNX-NWDGAFQWSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H]1CCC[C@@H]1CC(=O)N(C)Cc1[nH+]ccn1C ZINC000274382233 177123813 /nfs/dbraw/zinc/12/38/13/177123813.db2.gz AJMRYJMLTJVPFU-NWDGAFQWSA-N 1 2 249.358 2.205 20 0 BEADLO C[C@H]1CCC[C@@H]1Nc1nc[nH+]c(N)c1Cl ZINC000235570602 177127149 /nfs/dbraw/zinc/12/71/49/177127149.db2.gz RIHYDDFAFVJAFV-BQBZGAKWSA-N 1 2 226.711 2.313 20 0 BEADLO C[C@H]1CCC[C@@H]1Nc1[nH+]cnc(N)c1Cl ZINC000235570602 177127150 /nfs/dbraw/zinc/12/71/50/177127150.db2.gz RIHYDDFAFVJAFV-BQBZGAKWSA-N 1 2 226.711 2.313 20 0 BEADLO C[C@H]1CCC[C@H](C)C1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000283965704 177129485 /nfs/dbraw/zinc/12/94/85/177129485.db2.gz MBAQQRWNEHEALJ-JYLGIWJRSA-N 1 2 247.342 2.364 20 0 BEADLO C[C@H]1CCC[C@H](NC(=O)CCc2c[nH+]c[nH]2)CC1 ZINC000281936437 177135304 /nfs/dbraw/zinc/13/53/04/177135304.db2.gz RVWMRHCRUQYFNE-RYUDHWBXSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@H]1CCC[C@H](NC(=O)CCc2c[nH]c[nH+]2)CC1 ZINC000281936437 177135305 /nfs/dbraw/zinc/13/53/05/177135305.db2.gz RVWMRHCRUQYFNE-RYUDHWBXSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@H]1CC[N@H+](Cc2cccs2)CC[S@]1=O ZINC000277101223 177164860 /nfs/dbraw/zinc/16/48/60/177164860.db2.gz GLXMJHIOFODTAB-ZUZCIYMTSA-N 1 2 243.397 2.091 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2cccs2)CC[S@]1=O ZINC000277101223 177164863 /nfs/dbraw/zinc/16/48/63/177164863.db2.gz GLXMJHIOFODTAB-ZUZCIYMTSA-N 1 2 243.397 2.091 20 0 BEADLO C[C@@H]1[C@@H](C)CCN1c1cc(N2CCCC2)[nH+]cn1 ZINC000277908365 177171278 /nfs/dbraw/zinc/17/12/78/177171278.db2.gz UVWSRDJMNMOXNY-NWDGAFQWSA-N 1 2 246.358 2.312 20 0 BEADLO C[C@@H]1[C@@H](C)CCN1c1cc(N2CCCC2)nc[nH+]1 ZINC000277908365 177171279 /nfs/dbraw/zinc/17/12/79/177171279.db2.gz UVWSRDJMNMOXNY-NWDGAFQWSA-N 1 2 246.358 2.312 20 0 BEADLO C[C@H]1CCN(c2nc(N)c3ccccc3[nH+]2)C1 ZINC000301816877 177171710 /nfs/dbraw/zinc/17/17/10/177171710.db2.gz JTSWFQCIZBDJLP-VIFPVBQESA-N 1 2 228.299 2.058 20 0 BEADLO C[C@@H]1CC[C@H](C)N(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000284156148 177181702 /nfs/dbraw/zinc/18/17/02/177181702.db2.gz WVJGQZXQIQYKLD-PVTPVBHGSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@H]1CC[C@@H](CC(=O)N2CCn3c[nH+]cc3C2)C1 ZINC000290950691 177188029 /nfs/dbraw/zinc/18/80/29/177188029.db2.gz PXAHUJAPSVGQHS-NWDGAFQWSA-N 1 2 247.342 2.052 20 0 BEADLO C[C@H]1CN(C(=O)c2ccc3[nH+]ccn3c2)C[C@@H]1C ZINC000267613744 177227099 /nfs/dbraw/zinc/22/70/99/177227099.db2.gz HANNCXUSUPHYKM-QWRGUYRKSA-N 1 2 243.310 2.062 20 0 BEADLO C[C@H]1C[N@H+](Cc2cc(O)cc(F)c2)[C@@H](C)CO1 ZINC000223753492 177261022 /nfs/dbraw/zinc/26/10/22/177261022.db2.gz NHJXGDTVTDTMBL-UWVGGRQHSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cc(O)cc(F)c2)[C@@H](C)CO1 ZINC000223753492 177261024 /nfs/dbraw/zinc/26/10/24/177261024.db2.gz NHJXGDTVTDTMBL-UWVGGRQHSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@H]1C[N@H+](Cc2cn(-c3ccccc3)nn2)[C@H]1C ZINC000336468800 177270014 /nfs/dbraw/zinc/27/00/14/177270014.db2.gz XOLHQVJNHHVQAX-RYUDHWBXSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cn(-c3ccccc3)nn2)[C@H]1C ZINC000336468800 177270017 /nfs/dbraw/zinc/27/00/17/177270017.db2.gz XOLHQVJNHHVQAX-RYUDHWBXSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@H]1COCC[C@H]1CNc1cc[nH+]c(C2CC2)n1 ZINC000286326769 177295754 /nfs/dbraw/zinc/29/57/54/177295754.db2.gz KBPSKSRTYVKJEF-JQWIXIFHSA-N 1 2 247.342 2.439 20 0 BEADLO C[C@H]1CSC[C@@H]1Nc1cc[nH+]c2ccncc12 ZINC000336617585 177304803 /nfs/dbraw/zinc/30/48/03/177304803.db2.gz VWLOAPYPNOFDIM-ZANVPECISA-N 1 2 245.351 2.215 20 0 BEADLO C[C@H]1C[C@H](C(=O)Nc2cc[nH+]cc2O)C[C@@H](C)C1 ZINC000356556750 177317002 /nfs/dbraw/zinc/31/70/02/177317002.db2.gz YNJGKMKBLKQWOK-URLYPYJESA-N 1 2 248.326 2.220 20 0 BEADLO C[C@H]1C[C@@H]([NH2+]Cc2ncn(C)n2)c2ccccc21 ZINC000290234467 177333495 /nfs/dbraw/zinc/33/34/95/177333495.db2.gz IWASJAPDIFSPQX-GXFFZTMASA-N 1 2 242.326 2.153 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)CCc2c[nH+]c[nH]2)[C@@H](C)C1 ZINC000249152002 177355501 /nfs/dbraw/zinc/35/55/01/177355501.db2.gz VAJRNFSZXOTYIM-MDZLAQPJSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)CCc2c[nH]c[nH+]2)[C@@H](C)C1 ZINC000249152002 177355504 /nfs/dbraw/zinc/35/55/04/177355504.db2.gz VAJRNFSZXOTYIM-MDZLAQPJSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H]1C[C@H](Nc2cc[nH+]c(C3CC3)n2)CCO1 ZINC000271377038 177372545 /nfs/dbraw/zinc/37/25/45/177372545.db2.gz JMJAXEQXMYQLRF-GXSJLCMTSA-N 1 2 233.315 2.333 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2ccccc2F)[C@@H]1C ZINC000156323604 177399596 /nfs/dbraw/zinc/39/95/96/177399596.db2.gz JSAGUKYBDWHQNO-GHMZBOCLSA-N 1 2 223.291 2.435 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2ccccc2F)[C@@H]1C ZINC000156323604 177399598 /nfs/dbraw/zinc/39/95/98/177399598.db2.gz JSAGUKYBDWHQNO-GHMZBOCLSA-N 1 2 223.291 2.435 20 0 BEADLO CN(C(=O)C=Cc1c[nH]c[nH+]1)C1CCCCC1 ZINC000492910593 226081919 /nfs/dbraw/zinc/08/19/19/226081919.db2.gz JJLLFCPJDZGIJU-FPLPWBNLSA-N 1 2 233.315 2.214 20 0 BEADLO Cc1cc(NC(=O)C=CC2CCCC2)cc[nH+]1 ZINC000493296842 226178545 /nfs/dbraw/zinc/17/85/45/226178545.db2.gz WITCQUVWZNZGRX-VOTSOKGWSA-N 1 2 230.311 2.497 20 0 BEADLO CCc1oc(C(=O)N[C@H](C)c2[nH]cc[nH+]2)cc1C ZINC000557048352 322933694 /nfs/dbraw/zinc/93/36/94/322933694.db2.gz XKASJTMTXFKLJK-SECBINFHSA-N 1 2 247.298 2.365 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)N[C@H]1CC12CCCCC2 ZINC000493147699 226139143 /nfs/dbraw/zinc/13/91/43/226139143.db2.gz GXHAVWMIRLABBK-ZWNMCFTASA-N 1 2 245.326 2.262 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CC[C@@H]2CCCC[C@@H]21 ZINC000493172814 226144924 /nfs/dbraw/zinc/14/49/24/226144924.db2.gz SHZRXLGVCASAJE-ILBNWAPMSA-N 1 2 245.326 2.214 20 0 BEADLO C[C@H](NC(=O)C=Cc1c[nH]c[nH+]1)C1CCCC1 ZINC000493184570 226147732 /nfs/dbraw/zinc/14/77/32/226147732.db2.gz GPGSSSBZTUDKAB-GFVADAIESA-N 1 2 233.315 2.118 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)/C=C/C(C)(C)C)S1 ZINC000493240373 226163967 /nfs/dbraw/zinc/16/39/67/226163967.db2.gz OYOKMWQLQNVXHQ-HQZHTGGTSA-N 1 2 226.345 2.196 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)N1CCC[C@@H]2CCC[C@H]21 ZINC000493273849 226173044 /nfs/dbraw/zinc/17/30/44/226173044.db2.gz ZAMDXAZERLRGFK-FNSAGKMKSA-N 1 2 245.326 2.214 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)NC12CCC(CC1)CC2 ZINC000493574533 226244268 /nfs/dbraw/zinc/24/42/68/226244268.db2.gz BALNZZHVLZSVDH-OWOJBTEDSA-N 1 2 245.326 2.262 20 0 BEADLO C[C@]1(NC(=O)C=Cc2c[nH]c[nH+]2)CC=CCC1 ZINC000493699265 226249882 /nfs/dbraw/zinc/24/98/82/226249882.db2.gz YBRZRNOWDJTGSD-SZZPACECSA-N 1 2 231.299 2.038 20 0 BEADLO C[C@H]1CCN(CCCn2cc[nH+]c2)CC1(F)F ZINC000494278474 226263293 /nfs/dbraw/zinc/26/32/93/226263293.db2.gz ADCXHFQSYZYLNO-NSHDSACASA-N 1 2 243.301 2.250 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCC[C@H]2c2cc[nH]n2)c1 ZINC000671628583 487656664 /nfs/dbraw/zinc/65/66/64/487656664.db2.gz UQRBSOVTGMBTHZ-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccnc(C[N@H+]2CCC[C@H]2c2cc[nH]n2)c1 ZINC000671628583 487656667 /nfs/dbraw/zinc/65/66/67/487656667.db2.gz UQRBSOVTGMBTHZ-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO CC[C@@]1(Nc2cc[nH+]c(C3CC3)n2)CCOC1 ZINC000672276087 487657303 /nfs/dbraw/zinc/65/73/03/487657303.db2.gz QBJGJTZRHSCHJC-CYBMUJFWSA-N 1 2 233.315 2.335 20 0 BEADLO Clc1cnc(N2CC(n3cc[nH+]c3)C2)s1 ZINC000680896694 487662431 /nfs/dbraw/zinc/66/24/31/487662431.db2.gz MOJJOTPYKKDYLN-UHFFFAOYSA-N 1 2 240.719 2.054 20 0 BEADLO CCc1nnc(C[NH2+]C2(c3ccccc3)CC2)[nH]1 ZINC000274689655 487664513 /nfs/dbraw/zinc/66/45/13/487664513.db2.gz ZPVYJBMQKJDIKC-UHFFFAOYSA-N 1 2 242.326 2.146 20 0 BEADLO CC[C@H]1CCCCCN1C(=O)Cc1c[nH+]cn1C ZINC000557712581 322941322 /nfs/dbraw/zinc/94/13/22/322941322.db2.gz CZWHPSGIJSCGGK-LBPRGKRZSA-N 1 2 249.358 2.144 20 0 BEADLO CC[C@@]1(C)CCN(C(=O)CCCn2cc[nH+]c2)C1 ZINC000675179923 487677996 /nfs/dbraw/zinc/67/79/96/487677996.db2.gz MZQGUFDYQHNVKU-AWEZNQCLSA-N 1 2 249.358 2.312 20 0 BEADLO C[C@H]1COCC[N@@H+]1Cc1scnc1C1CC1 ZINC000336213358 487691265 /nfs/dbraw/zinc/69/12/65/487691265.db2.gz OBQMHVPSFHLJMJ-VIFPVBQESA-N 1 2 238.356 2.241 20 0 BEADLO C[C@H]1COCC[N@H+]1Cc1scnc1C1CC1 ZINC000336213358 487691272 /nfs/dbraw/zinc/69/12/72/487691272.db2.gz OBQMHVPSFHLJMJ-VIFPVBQESA-N 1 2 238.356 2.241 20 0 BEADLO CCCC(C)(C)NC(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000667645359 487691283 /nfs/dbraw/zinc/69/12/83/487691283.db2.gz NFRXASKVJHMCPV-JTQLQIEISA-N 1 2 249.358 2.210 20 0 BEADLO CCCC(C)(C)NC(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000667645359 487691288 /nfs/dbraw/zinc/69/12/88/487691288.db2.gz NFRXASKVJHMCPV-JTQLQIEISA-N 1 2 249.358 2.210 20 0 BEADLO Cc1cc(NC(=O)[C@@H](C)c2ccco2)c(C)c[nH+]1 ZINC000676587978 487697339 /nfs/dbraw/zinc/69/73/39/487697339.db2.gz MLKDAAVVISCRDI-NSHDSACASA-N 1 2 244.294 2.456 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)[C@H]1CC12CCC2 ZINC000675304341 487697922 /nfs/dbraw/zinc/69/79/22/487697922.db2.gz SXSMKPVSHNZGSX-SNVBAGLBSA-N 1 2 245.326 2.276 20 0 BEADLO FC1(C[NH+]2CCN(c3cccs3)CC2)CC1 ZINC000526971134 262799548 /nfs/dbraw/zinc/79/95/48/262799548.db2.gz KBGUNPYLBUPXRI-UHFFFAOYSA-N 1 2 240.347 2.372 20 0 BEADLO COc1ccc[nH+]c1NCC[C@@H]1CCCOC1 ZINC000528075177 262904523 /nfs/dbraw/zinc/90/45/23/262904523.db2.gz QWCNUJHOVIPCNM-NSHDSACASA-N 1 2 236.315 2.319 20 0 BEADLO C/C(Cl)=C/C[N@H+]1C[C@H](C)OC[C@@H]1C ZINC000528339097 262911321 /nfs/dbraw/zinc/91/13/21/262911321.db2.gz IWTUYYPVJCXWBG-BBYBGLFNSA-N 1 2 203.713 2.238 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1C[C@H](C)OC[C@@H]1C ZINC000528339097 262911322 /nfs/dbraw/zinc/91/13/22/262911322.db2.gz IWTUYYPVJCXWBG-BBYBGLFNSA-N 1 2 203.713 2.238 20 0 BEADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1cn(C)cn1 ZINC000683900378 487710824 /nfs/dbraw/zinc/71/08/24/487710824.db2.gz VCBYIAQNKRVUAF-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1cn(C)cn1 ZINC000683900378 487710826 /nfs/dbraw/zinc/71/08/26/487710826.db2.gz VCBYIAQNKRVUAF-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO COc1ccc(F)c(CN(C)Cc2c[nH+]c[nH]2)c1 ZINC000668422220 487727075 /nfs/dbraw/zinc/72/70/75/487727075.db2.gz UIJDUEWLTCXHDD-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO COc1ccc(F)c(CN(C)Cc2c[nH]c[nH+]2)c1 ZINC000668422220 487727082 /nfs/dbraw/zinc/72/70/82/487727082.db2.gz UIJDUEWLTCXHDD-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO C[C@H]1C[C@@H]1C(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000681119056 487731790 /nfs/dbraw/zinc/73/17/90/487731790.db2.gz QBGCEAOAHJSXAP-DCAQKATOSA-N 1 2 233.315 2.119 20 0 BEADLO CCC(C)(C)N(C)C(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000668900102 487739229 /nfs/dbraw/zinc/73/92/29/487739229.db2.gz MPMMPZMNBDXFKK-GHMZBOCLSA-N 1 2 249.358 2.171 20 0 BEADLO Cc1cnn([C@@H]2CC[N@H+](Cc3nccs3)C2)c1 ZINC000290035761 487749772 /nfs/dbraw/zinc/74/97/72/487749772.db2.gz WDZDIAMZYSUGGL-LLVKDONJSA-N 1 2 248.355 2.095 20 0 BEADLO Cc1cnn([C@@H]2CC[N@@H+](Cc3nccs3)C2)c1 ZINC000290035761 487749775 /nfs/dbraw/zinc/74/97/75/487749775.db2.gz WDZDIAMZYSUGGL-LLVKDONJSA-N 1 2 248.355 2.095 20 0 BEADLO c1csc([C@H]2C[N@H+](Cc3cn[nH]c3)CCO2)c1 ZINC000678217880 487760417 /nfs/dbraw/zinc/76/04/17/487760417.db2.gz UFWKEVRVQHQCIU-LLVKDONJSA-N 1 2 249.339 2.045 20 0 BEADLO c1csc([C@H]2C[N@@H+](Cc3cn[nH]c3)CCO2)c1 ZINC000678217880 487760421 /nfs/dbraw/zinc/76/04/21/487760421.db2.gz UFWKEVRVQHQCIU-LLVKDONJSA-N 1 2 249.339 2.045 20 0 BEADLO CCOC1(C)CN(c2cc[nH+]c3ccncc32)C1 ZINC000450581958 487764256 /nfs/dbraw/zinc/76/42/56/487764256.db2.gz RDCSAKXTUYLLBC-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1cc(NCC(F)(F)c2ccccc2)nc[nH+]1 ZINC000357631286 487771724 /nfs/dbraw/zinc/77/17/24/487771724.db2.gz SBBVULSAYDNSHP-UHFFFAOYSA-N 1 2 249.264 2.411 20 0 BEADLO Cc1noc([C@H](C)[NH+]2CCC(C(F)F)CC2)n1 ZINC000675904178 487790512 /nfs/dbraw/zinc/79/05/12/487790512.db2.gz SBANGGOXHDUGFH-ZETCQYMHSA-N 1 2 245.273 2.416 20 0 BEADLO CCn1cc[nH+]c1CN1CC[C@@H](C)[C@@H](F)C1 ZINC000679228450 487790147 /nfs/dbraw/zinc/79/01/47/487790147.db2.gz XOGCEBRZHICYRJ-MNOVXSKESA-N 1 2 225.311 2.083 20 0 BEADLO Cc1ccc(NC(=O)N(C)CCF)c(C)[nH+]1 ZINC000296671101 487791626 /nfs/dbraw/zinc/79/16/26/487791626.db2.gz RICFUFFDVMUTDP-UHFFFAOYSA-N 1 2 225.267 2.132 20 0 BEADLO FC(F)C[N@@H+]1CCOCC2(CCCC2)C1 ZINC000681477301 487802398 /nfs/dbraw/zinc/80/23/98/487802398.db2.gz OPRFHGMPGOAKNO-UHFFFAOYSA-N 1 2 219.275 2.144 20 0 BEADLO FC(F)C[N@H+]1CCOCC2(CCCC2)C1 ZINC000681477301 487802402 /nfs/dbraw/zinc/80/24/02/487802402.db2.gz OPRFHGMPGOAKNO-UHFFFAOYSA-N 1 2 219.275 2.144 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+](C)CCOC(C)(C)C)o1 ZINC000676042641 487804349 /nfs/dbraw/zinc/80/43/49/487804349.db2.gz AKKGAHDJXHQUQD-SECBINFHSA-N 1 2 241.335 2.186 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+](C)CCOC(C)(C)C)o1 ZINC000676042641 487804352 /nfs/dbraw/zinc/80/43/52/487804352.db2.gz AKKGAHDJXHQUQD-SECBINFHSA-N 1 2 241.335 2.186 20 0 BEADLO Cc1nnc(C[N@@H+](C)[C@H]2C[C@@H]2c2ccccc2)o1 ZINC000676043711 487804764 /nfs/dbraw/zinc/80/47/64/487804764.db2.gz LWKDRBPDCOXGQX-OLZOCXBDSA-N 1 2 243.310 2.366 20 0 BEADLO Cc1nnc(C[N@H+](C)[C@H]2C[C@@H]2c2ccccc2)o1 ZINC000676043711 487804771 /nfs/dbraw/zinc/80/47/71/487804771.db2.gz LWKDRBPDCOXGQX-OLZOCXBDSA-N 1 2 243.310 2.366 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3c[nH]nc3C2)ccc1F ZINC000678275969 487817475 /nfs/dbraw/zinc/81/74/75/487817475.db2.gz NOLIYTIUXNDVTC-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1cc(C[N@H+]2CCc3c[nH]nc3C2)ccc1F ZINC000678275969 487817485 /nfs/dbraw/zinc/81/74/85/487817485.db2.gz NOLIYTIUXNDVTC-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1cc(NC(=O)N[C@]23C[C@H]2CCC3)c(C)c[nH+]1 ZINC000666496932 487822309 /nfs/dbraw/zinc/82/23/09/487822309.db2.gz XCTCRVSRKBSLDO-BXUZGUMPSA-N 1 2 245.326 2.184 20 0 BEADLO CC(C)CC(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000074828212 487822415 /nfs/dbraw/zinc/82/24/15/487822415.db2.gz RTRVVYFYCYSIAY-UHFFFAOYSA-N 1 2 235.331 2.162 20 0 BEADLO CCC(CC)C(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819763934 586990681 /nfs/dbraw/zinc/99/06/81/586990681.db2.gz IUFBPTGLQZGEEU-ZETCQYMHSA-N 1 2 214.334 2.030 20 0 BEADLO CCC[C@H](C)N(C)C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493074669 528039329 /nfs/dbraw/zinc/03/93/29/528039329.db2.gz VFYBGGXLYXFROB-FGEFZZPRSA-N 1 2 221.304 2.070 20 0 BEADLO CC(C)C[C@H](C)OC(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000496374532 528477094 /nfs/dbraw/zinc/47/70/94/528477094.db2.gz LLNYJJWDBDUXPG-JTQLQIEISA-N 1 2 239.319 2.413 20 0 BEADLO CC(C)C[C@H](C)OC(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000496374532 528477101 /nfs/dbraw/zinc/47/71/01/528477101.db2.gz LLNYJJWDBDUXPG-JTQLQIEISA-N 1 2 239.319 2.413 20 0 BEADLO CC(C)C(NC(=O)CCn1cc[nH+]c1)C(C)C ZINC000676328975 487837526 /nfs/dbraw/zinc/83/75/26/487837526.db2.gz LZHZCUHMGNVWMN-UHFFFAOYSA-N 1 2 237.347 2.070 20 0 BEADLO Cc1ncc([C@@H](C)[N@@H+]2CCOC(C)(C)C2)c(C)n1 ZINC000681672987 487837072 /nfs/dbraw/zinc/83/70/72/487837072.db2.gz SHMLLZZSOVCMKZ-LLVKDONJSA-N 1 2 249.358 2.265 20 0 BEADLO Cc1ncc([C@@H](C)[N@H+]2CCOC(C)(C)C2)c(C)n1 ZINC000681672987 487837075 /nfs/dbraw/zinc/83/70/75/487837075.db2.gz SHMLLZZSOVCMKZ-LLVKDONJSA-N 1 2 249.358 2.265 20 0 BEADLO CCc1cc(N[C@H]2CCC[C@H]2CCO)nc[nH+]1 ZINC000681674671 487838326 /nfs/dbraw/zinc/83/83/26/487838326.db2.gz CMXMFFCGTHUMJT-JQWIXIFHSA-N 1 2 235.331 2.002 20 0 BEADLO CC(C)[N@H+](Cc1cnsn1)CC1CC1 ZINC000846817161 588290750 /nfs/dbraw/zinc/29/07/50/588290750.db2.gz LURMMOXRNVYBNB-UHFFFAOYSA-N 1 2 211.334 2.159 20 0 BEADLO O=C(NCc1c[nH+]c[nH]1)c1ccc(C2CC2)cc1 ZINC000668994993 487843344 /nfs/dbraw/zinc/84/33/44/487843344.db2.gz DFXRWTCTCZNWAK-UHFFFAOYSA-N 1 2 241.294 2.217 20 0 BEADLO O=C(NCc1c[nH]c[nH+]1)c1ccc(C2CC2)cc1 ZINC000668994993 487843348 /nfs/dbraw/zinc/84/33/48/487843348.db2.gz DFXRWTCTCZNWAK-UHFFFAOYSA-N 1 2 241.294 2.217 20 0 BEADLO COc1cncc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)c1 ZINC000676437031 487851540 /nfs/dbraw/zinc/85/15/40/487851540.db2.gz YCQMUQZVYAFQCL-ZWNOBZJWSA-N 1 2 238.306 2.270 20 0 BEADLO COc1cncc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)c1 ZINC000676437031 487851543 /nfs/dbraw/zinc/85/15/43/487851543.db2.gz YCQMUQZVYAFQCL-ZWNOBZJWSA-N 1 2 238.306 2.270 20 0 BEADLO Cn1c2ccccc2[nH+]c1N1CC=CCC1 ZINC000679279584 487859959 /nfs/dbraw/zinc/85/99/59/487859959.db2.gz CTTZWNIXSFUZIT-UHFFFAOYSA-N 1 2 213.284 2.340 20 0 BEADLO CC1(C)CC(CNC(=O)CCCn2cc[nH+]c2)C1 ZINC000682025841 487881048 /nfs/dbraw/zinc/88/10/48/487881048.db2.gz TVQFTAMVJAODEZ-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO CC[C@H](NC(=O)CCC(C)(F)F)c1[nH]cc[nH+]1 ZINC000682040519 487888587 /nfs/dbraw/zinc/88/85/87/487888587.db2.gz GNFIPKQDWLHUPY-QMMMGPOBSA-N 1 2 245.273 2.412 20 0 BEADLO CC=CC[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000682220721 487928674 /nfs/dbraw/zinc/92/86/74/487928674.db2.gz FZAUYFRHWYWNRZ-DLGQBQFBSA-N 1 2 228.299 2.060 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CC[C@@H](C(F)F)C2)s1 ZINC000669932267 487935366 /nfs/dbraw/zinc/93/53/66/487935366.db2.gz DDDMRRLXPOZBQJ-HTRCEHHLSA-N 1 2 247.314 2.495 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CC[C@@H](C(F)F)C2)s1 ZINC000669932267 487935371 /nfs/dbraw/zinc/93/53/71/487935371.db2.gz DDDMRRLXPOZBQJ-HTRCEHHLSA-N 1 2 247.314 2.495 20 0 BEADLO C[C@@H](O)C[C@H](C)Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000679934148 487945129 /nfs/dbraw/zinc/94/51/29/487945129.db2.gz YXFXIUYEEYQXQD-VHSXEESVSA-N 1 2 237.347 2.345 20 0 BEADLO CC(C)(C)C1CN(C(=O)CCCn2cc[nH+]c2)C1 ZINC000654724164 487954174 /nfs/dbraw/zinc/95/41/74/487954174.db2.gz DGQHOVLDXVNSDC-UHFFFAOYSA-N 1 2 249.358 2.168 20 0 BEADLO Cc1nc(NC(CF)CF)c2c([nH+]1)CCCC2 ZINC000560217578 322983925 /nfs/dbraw/zinc/98/39/25/322983925.db2.gz RFSZRANBKFPEAI-UHFFFAOYSA-N 1 2 241.285 2.383 20 0 BEADLO Cc1nnc(C[NH2+][C@@H](C)c2cc(C)ccn2)s1 ZINC000560550004 322989413 /nfs/dbraw/zinc/98/94/13/322989413.db2.gz SNQVIQPJYPXNIB-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO Cc1c[nH+]c(C)nc1NC[C@@H]1C[C@H]1C1CCC1 ZINC000566483703 323001334 /nfs/dbraw/zinc/00/13/34/323001334.db2.gz WSJHKZAAIKJMTA-STQMWFEESA-N 1 2 231.343 2.363 20 0 BEADLO CN(C)c1ccc(NCc2cccnc2)[nH+]c1 ZINC000150915562 323002811 /nfs/dbraw/zinc/00/28/11/323002811.db2.gz RNODYDNAQXMRLQ-UHFFFAOYSA-N 1 2 228.299 2.155 20 0 BEADLO CC[C@]1(C(C)C)C[C@H]1NC(=O)Cc1[nH]c[nH+]c1C ZINC000516954553 323005282 /nfs/dbraw/zinc/00/52/82/323005282.db2.gz ULJBHHHALLUVGY-TZMCWYRMSA-N 1 2 249.358 2.202 20 0 BEADLO CC[C@]1(C(C)C)C[C@H]1NC(=O)Cc1[nH+]c[nH]c1C ZINC000516954553 323005283 /nfs/dbraw/zinc/00/52/83/323005283.db2.gz ULJBHHHALLUVGY-TZMCWYRMSA-N 1 2 249.358 2.202 20 0 BEADLO C[C@@H](CC(=O)N1CC[C@H](C2CC2)C1)n1cc[nH+]c1 ZINC000565046007 323005939 /nfs/dbraw/zinc/00/59/39/323005939.db2.gz HRMHSDAPEHNZEX-AAEUAGOBSA-N 1 2 247.342 2.093 20 0 BEADLO CC(C)n1cc([C@H](C)[NH2+]Cc2cocn2)cn1 ZINC000561851116 323007773 /nfs/dbraw/zinc/00/77/73/323007773.db2.gz WFDFMMFLCTXYMS-JTQLQIEISA-N 1 2 234.303 2.303 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2ncccc2O)s1 ZINC000561947592 323009055 /nfs/dbraw/zinc/00/90/55/323009055.db2.gz XWRKMNHMUMDGLB-UHFFFAOYSA-N 1 2 249.339 2.184 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2ncccc2O)s1 ZINC000561947592 323009056 /nfs/dbraw/zinc/00/90/56/323009056.db2.gz XWRKMNHMUMDGLB-UHFFFAOYSA-N 1 2 249.339 2.184 20 0 BEADLO CC[N@H+](Cc1cccc(F)c1)[C@H](C)C(=O)OC ZINC000130204153 323010461 /nfs/dbraw/zinc/01/04/61/323010461.db2.gz QHNNBAUSWZHCJZ-SNVBAGLBSA-N 1 2 239.290 2.209 20 0 BEADLO CC[N@@H+](Cc1cccc(F)c1)[C@H](C)C(=O)OC ZINC000130204153 323010462 /nfs/dbraw/zinc/01/04/62/323010462.db2.gz QHNNBAUSWZHCJZ-SNVBAGLBSA-N 1 2 239.290 2.209 20 0 BEADLO CCC[C@@H](C)CC(=O)NCCCn1cc[nH+]c1 ZINC000132287373 323014689 /nfs/dbraw/zinc/01/46/89/323014689.db2.gz QKEAVMCQIBLMAU-GFCCVEGCSA-N 1 2 237.347 2.216 20 0 BEADLO CCc1cccc(C[N@@H+]2CCn3cncc3C2)c1 ZINC000562445067 323020438 /nfs/dbraw/zinc/02/04/38/323020438.db2.gz ZDPVVMOWZYLIJP-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO CCc1cccc(C[N@H+]2CCn3cncc3C2)c1 ZINC000562445067 323020439 /nfs/dbraw/zinc/02/04/39/323020439.db2.gz ZDPVVMOWZYLIJP-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO CCc1cccc(CN2CCn3c[nH+]cc3C2)c1 ZINC000562445067 323020440 /nfs/dbraw/zinc/02/04/40/323020440.db2.gz ZDPVVMOWZYLIJP-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO C[C@H](c1csnn1)[N@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000562533382 323023245 /nfs/dbraw/zinc/02/32/45/323023245.db2.gz PSNKLLICJBYGDS-HRDYMLBCSA-N 1 2 243.401 2.425 20 0 BEADLO C[C@H](c1csnn1)[N@@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000562533382 323023246 /nfs/dbraw/zinc/02/32/46/323023246.db2.gz PSNKLLICJBYGDS-HRDYMLBCSA-N 1 2 243.401 2.425 20 0 BEADLO CCC[C@@H](NC(=O)Cc1c[nH+]cn1C)C1CCC1 ZINC000562660872 323026718 /nfs/dbraw/zinc/02/67/18/323026718.db2.gz XWBSLGNXXZBMNJ-CYBMUJFWSA-N 1 2 249.358 2.048 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC[C@@H]1CC=CCC1 ZINC000572973379 323037672 /nfs/dbraw/zinc/03/76/72/323037672.db2.gz VVMZNYUQQUKTEE-VXGBXAGGSA-N 1 2 247.342 2.061 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC[C@@H]1CC=CCC1 ZINC000572973379 323037673 /nfs/dbraw/zinc/03/76/73/323037673.db2.gz VVMZNYUQQUKTEE-VXGBXAGGSA-N 1 2 247.342 2.061 20 0 BEADLO Cn1c[nH+]cc1CC(=O)NCC1(C)CCCCC1 ZINC000569723200 323038726 /nfs/dbraw/zinc/03/87/26/323038726.db2.gz UUOCAQHLZYJFRH-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)NC[C@H]3C[C@@H]3C)ccn12 ZINC000569739848 323039485 /nfs/dbraw/zinc/03/94/85/323039485.db2.gz KOQMIZCNWFVBMN-JOYOIKCWSA-N 1 2 243.310 2.029 20 0 BEADLO c1nc(C[N@@H+]2CCC[C@@H]2c2ccccn2)c[nH]1 ZINC000569780495 323040427 /nfs/dbraw/zinc/04/04/27/323040427.db2.gz RVYWZJLUNSNCNN-CYBMUJFWSA-N 1 2 228.299 2.142 20 0 BEADLO c1nc(C[N@H+]2CCC[C@@H]2c2ccccn2)c[nH]1 ZINC000569780495 323040428 /nfs/dbraw/zinc/04/04/28/323040428.db2.gz RVYWZJLUNSNCNN-CYBMUJFWSA-N 1 2 228.299 2.142 20 0 BEADLO c1ncc(C[N@@H+]2CCC[C@@H]2c2ccccn2)[nH]1 ZINC000569780495 323040429 /nfs/dbraw/zinc/04/04/29/323040429.db2.gz RVYWZJLUNSNCNN-CYBMUJFWSA-N 1 2 228.299 2.142 20 0 BEADLO c1ncc(C[N@H+]2CCC[C@@H]2c2ccccn2)[nH]1 ZINC000569780495 323040430 /nfs/dbraw/zinc/04/04/30/323040430.db2.gz RVYWZJLUNSNCNN-CYBMUJFWSA-N 1 2 228.299 2.142 20 0 BEADLO FCC1CN(c2nc(C3CC3)[nH+]c3c2CCC3)C1 ZINC000569812232 323041357 /nfs/dbraw/zinc/04/13/57/323041357.db2.gz RYOCCTLIYVRLIW-UHFFFAOYSA-N 1 2 247.317 2.248 20 0 BEADLO CC(C)[C@H](C)N(C)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000569814436 323041392 /nfs/dbraw/zinc/04/13/92/323041392.db2.gz XEWYYMDDFKINCK-RYUDHWBXSA-N 1 2 237.347 2.337 20 0 BEADLO CCc1nc(CN(C)Cc2c[nH+]c[nH]2)cs1 ZINC000570106218 323050096 /nfs/dbraw/zinc/05/00/96/323050096.db2.gz RBZNNBUXAJTHKG-UHFFFAOYSA-N 1 2 236.344 2.061 20 0 BEADLO CCc1nc(CN(C)Cc2c[nH]c[nH+]2)cs1 ZINC000570106218 323050097 /nfs/dbraw/zinc/05/00/97/323050097.db2.gz RBZNNBUXAJTHKG-UHFFFAOYSA-N 1 2 236.344 2.061 20 0 BEADLO CCOC[C@@H]1CCCN(c2nc(C)[nH+]cc2C)C1 ZINC000570107392 323050300 /nfs/dbraw/zinc/05/03/00/323050300.db2.gz VAUULENYZIICBQ-CYBMUJFWSA-N 1 2 249.358 2.346 20 0 BEADLO CC[C@H]1CN(c2nc(C)[nH+]cc2C)C[C@H](C)O1 ZINC000570408947 323058753 /nfs/dbraw/zinc/05/87/53/323058753.db2.gz CMAFAGGRGQYNOD-JQWIXIFHSA-N 1 2 235.331 2.097 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CC[C@H](C)C1)c1[nH]cc[nH+]1 ZINC000570409660 323058835 /nfs/dbraw/zinc/05/88/35/323058835.db2.gz CJHMATYIJNCDHX-AEJSXWLSSA-N 1 2 221.304 2.023 20 0 BEADLO C[C@H]1CC[C@H](CNc2cc(NC3CC3)nc[nH+]2)O1 ZINC000570421037 323059124 /nfs/dbraw/zinc/05/91/24/323059124.db2.gz DTPSAJJFTHWJEM-GXSJLCMTSA-N 1 2 248.330 2.030 20 0 BEADLO C[C@H]1CC[C@H](CNc2cc(NC3CC3)[nH+]cn2)O1 ZINC000570421037 323059125 /nfs/dbraw/zinc/05/91/25/323059125.db2.gz DTPSAJJFTHWJEM-GXSJLCMTSA-N 1 2 248.330 2.030 20 0 BEADLO Cc1cc(N[C@@H](CO)CC2CCCC2)nc[nH+]1 ZINC000570542869 323062816 /nfs/dbraw/zinc/06/28/16/323062816.db2.gz FHOUHPTVJXFIOO-GFCCVEGCSA-N 1 2 235.331 2.138 20 0 BEADLO CCC1(NC(=O)C[C@@H](C)n2cc[nH+]c2)CCC1 ZINC000570846679 323072595 /nfs/dbraw/zinc/07/25/95/323072595.db2.gz CHORYXGCYFPKFL-LLVKDONJSA-N 1 2 235.331 2.283 20 0 BEADLO Cc1nnsc1C[N@@H+]1CCc2ccccc2C1 ZINC000570890891 323073502 /nfs/dbraw/zinc/07/35/02/323073502.db2.gz SREVBWCVYVMBHQ-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1nnsc1C[N@H+]1CCc2ccccc2C1 ZINC000570890891 323073503 /nfs/dbraw/zinc/07/35/03/323073503.db2.gz SREVBWCVYVMBHQ-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)N1CC2(C1)CCCCC2 ZINC000493720398 323087385 /nfs/dbraw/zinc/08/73/85/323087385.db2.gz IMVWJULLFXGOLN-SNAWJCMRSA-N 1 2 245.326 2.216 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1Nc1[nH+]cnc2c1cnn2C ZINC000397383638 323090515 /nfs/dbraw/zinc/09/05/15/323090515.db2.gz OGKYGAXGTRZFTB-GWCFXTLKSA-N 1 2 245.330 2.210 20 0 BEADLO C[C@H](CC(=O)N1C[C@@H]2CCC[C@@H]2C1)n1cc[nH+]c1 ZINC000563216447 323103066 /nfs/dbraw/zinc/10/30/66/323103066.db2.gz GTZJFBOWVANDME-UPJWGTAASA-N 1 2 247.342 2.093 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)NCC(C)(F)F ZINC000571039395 323104430 /nfs/dbraw/zinc/10/44/30/323104430.db2.gz QEEHRQWWZUNJDF-UHFFFAOYSA-N 1 2 243.257 2.475 20 0 BEADLO C[C@@H](CC(=O)N[C@H]1CCC1(C)C)n1cc[nH+]c1 ZINC000563220186 323104600 /nfs/dbraw/zinc/10/46/00/323104600.db2.gz GYFBEGPYYGBKNE-QWRGUYRKSA-N 1 2 235.331 2.139 20 0 BEADLO C[C@@H](CC(=O)N(C)C1CC(C)(C)C1)n1cc[nH+]c1 ZINC000563221881 323104808 /nfs/dbraw/zinc/10/48/08/323104808.db2.gz PDIBRWDKFGZPDH-NSHDSACASA-N 1 2 249.358 2.481 20 0 BEADLO CCC(CC)[C@H](C)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000534180634 323114488 /nfs/dbraw/zinc/11/44/88/323114488.db2.gz VINFHHNCJZLUGG-NSHDSACASA-N 1 2 249.358 2.339 20 0 BEADLO Cc1cncc(C(=O)Nc2cc(C)[nH+]cc2C)c1 ZINC000534299772 323115793 /nfs/dbraw/zinc/11/57/93/323115793.db2.gz JTELBNNYDKJVPL-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO CC[C@H](SC)C(=O)Nc1cc(C)[nH+]cc1C ZINC000534299624 323115859 /nfs/dbraw/zinc/11/58/59/323115859.db2.gz WDMBNNJNHZVTMK-NSHDSACASA-N 1 2 238.356 2.200 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2C=CCCC2)c(C)c[nH+]1 ZINC000534323994 323116475 /nfs/dbraw/zinc/11/64/75/323116475.db2.gz DBZCQZMXAGJHRR-LBPRGKRZSA-N 1 2 245.326 2.351 20 0 BEADLO CCc1oncc1NCc1[nH+]ccn1CC ZINC000309959383 323122453 /nfs/dbraw/zinc/12/24/53/323122453.db2.gz KFCGJMSKCKRAMP-UHFFFAOYSA-N 1 2 220.276 2.066 20 0 BEADLO Cc1csc(CNc2nc(C)[nH+]cc2C)c1 ZINC000563422842 323124326 /nfs/dbraw/zinc/12/43/26/323124326.db2.gz CDQOATKKWFIAMB-UHFFFAOYSA-N 1 2 233.340 2.497 20 0 BEADLO CC[C@H]([NH2+]CCCc1cccs1)C(=O)OC ZINC000310012565 323126361 /nfs/dbraw/zinc/12/63/61/323126361.db2.gz JFFJNAJKPBCTOK-NSHDSACASA-N 1 2 241.356 2.222 20 0 BEADLO CC[C@@H]1C[C@H]1CNC(=O)Nc1cc(C)[nH+]cc1C ZINC000563511304 323128513 /nfs/dbraw/zinc/12/85/13/323128513.db2.gz GVAUBTIHADMMOS-NEPJUHHUSA-N 1 2 247.342 2.288 20 0 BEADLO CC1(C)C[NH+](CC(=O)Nc2ccccc2F)C1 ZINC000565170260 323130383 /nfs/dbraw/zinc/13/03/83/323130383.db2.gz HKWSWQZIKRPECO-UHFFFAOYSA-N 1 2 236.290 2.106 20 0 BEADLO Cn1cc(C[N@@H+]2CCC[C@@H](F)C2)c(C(F)F)n1 ZINC000571172178 323137517 /nfs/dbraw/zinc/13/75/17/323137517.db2.gz PFXKRKBHGGKJEJ-SECBINFHSA-N 1 2 247.264 2.292 20 0 BEADLO Cn1cc(C[N@H+]2CCC[C@@H](F)C2)c(C(F)F)n1 ZINC000571172178 323137518 /nfs/dbraw/zinc/13/75/18/323137518.db2.gz PFXKRKBHGGKJEJ-SECBINFHSA-N 1 2 247.264 2.292 20 0 BEADLO CC[C@H](C)CC(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000571291812 323140450 /nfs/dbraw/zinc/14/04/50/323140450.db2.gz VSIVWMBYSRFKPB-VIFPVBQESA-N 1 2 223.320 2.197 20 0 BEADLO CCSCCCNc1nc(C)[nH+]cc1C ZINC000571580981 323148569 /nfs/dbraw/zinc/14/85/69/323148569.db2.gz FYWHWPDJXDKRPJ-UHFFFAOYSA-N 1 2 225.361 2.070 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1C[C@H](OC)C1(C)C ZINC000300624108 323152957 /nfs/dbraw/zinc/15/29/57/323152957.db2.gz DQVAFXRGJBCMLV-QWRGUYRKSA-N 1 2 236.315 2.316 20 0 BEADLO CCc1cnc(C[N@@H+]2CCOC(C)(C)[C@@H]2C)o1 ZINC000531910467 323153636 /nfs/dbraw/zinc/15/36/36/323153636.db2.gz MIPNGQGGHMJLHG-JTQLQIEISA-N 1 2 238.331 2.236 20 0 BEADLO CCc1cnc(C[N@H+]2CCOC(C)(C)[C@@H]2C)o1 ZINC000531910467 323153637 /nfs/dbraw/zinc/15/36/37/323153637.db2.gz MIPNGQGGHMJLHG-JTQLQIEISA-N 1 2 238.331 2.236 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[NH+]1[C@@H](C)C[C@@H]1C ZINC000532064175 323170682 /nfs/dbraw/zinc/17/06/82/323170682.db2.gz QYAWXCKLROMKNV-QXEWZRGKSA-N 1 2 239.340 2.445 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nnsc2Cl)[C@@H]1C ZINC000306159329 323172529 /nfs/dbraw/zinc/17/25/29/323172529.db2.gz NOQIMBTXNZPWPQ-RNFRBKRXSA-N 1 2 231.752 2.422 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nnsc2Cl)[C@@H]1C ZINC000306159329 323172530 /nfs/dbraw/zinc/17/25/30/323172530.db2.gz NOQIMBTXNZPWPQ-RNFRBKRXSA-N 1 2 231.752 2.422 20 0 BEADLO C[C@H](C(=O)NC(C)(C)c1[nH]cc[nH+]1)C1CCC1 ZINC000563721520 323175806 /nfs/dbraw/zinc/17/58/06/323175806.db2.gz GZWHDJDWHQRNKP-VIFPVBQESA-N 1 2 235.331 2.197 20 0 BEADLO Cc1cc(NC(=O)N2CC[C@@H](C)[C@H]2C)c(C)c[nH+]1 ZINC000535773056 323190781 /nfs/dbraw/zinc/19/07/81/323190781.db2.gz DAVZSKPJAWECOY-BXKDBHETSA-N 1 2 247.342 2.383 20 0 BEADLO Cc1cc(NC(=O)NCc2ccoc2)c(C)c[nH+]1 ZINC000535772857 323190847 /nfs/dbraw/zinc/19/08/47/323190847.db2.gz WHNCPEDKCHBKPY-UHFFFAOYSA-N 1 2 245.282 2.035 20 0 BEADLO Cc1cc(NC(=O)NCC2CCCC2)c(C)c[nH+]1 ZINC000535773147 323190863 /nfs/dbraw/zinc/19/08/63/323190863.db2.gz VICYXTIANWOHCQ-UHFFFAOYSA-N 1 2 247.342 2.432 20 0 BEADLO Cc1cc(NC(=O)N2C[C@H](C)[C@H](C)C2)c(C)c[nH+]1 ZINC000535773613 323190883 /nfs/dbraw/zinc/19/08/83/323190883.db2.gz XYSUFSLRADZNSE-PHIMTYICSA-N 1 2 247.342 2.240 20 0 BEADLO CCCCN(C)C(=O)Nc1cc(C)[nH+]cc1C ZINC000535772337 323190927 /nfs/dbraw/zinc/19/09/27/323190927.db2.gz CRBOXBBBHHCJSO-UHFFFAOYSA-N 1 2 235.331 2.384 20 0 BEADLO Cc1nc(C[N@H+](C)CCCc2ccccc2)no1 ZINC000051852706 323191800 /nfs/dbraw/zinc/19/18/00/323191800.db2.gz QIWQFYNCMQSXPE-UHFFFAOYSA-N 1 2 245.326 2.443 20 0 BEADLO Cc1nc(C[N@@H+](C)CCCc2ccccc2)no1 ZINC000051852706 323191801 /nfs/dbraw/zinc/19/18/01/323191801.db2.gz QIWQFYNCMQSXPE-UHFFFAOYSA-N 1 2 245.326 2.443 20 0 BEADLO COc1cc(C)[nH+]c(CSc2cnccn2)c1 ZINC000536011360 323195140 /nfs/dbraw/zinc/19/51/40/323195140.db2.gz SZVFARUAAQEQKB-UHFFFAOYSA-N 1 2 247.323 2.481 20 0 BEADLO Cc1cc(NC(=O)C2(C)CCC2)c(C)c[nH+]1 ZINC000536575505 323198120 /nfs/dbraw/zinc/19/81/20/323198120.db2.gz QERYSUICTFGGKR-UHFFFAOYSA-N 1 2 218.300 2.249 20 0 BEADLO COC(C)(C)CN(C)c1[nH+]c(C)nc2[nH]ccc21 ZINC000532327977 323251349 /nfs/dbraw/zinc/25/13/49/323251349.db2.gz IROLGRMCPZGJSY-UHFFFAOYSA-N 1 2 248.330 2.128 20 0 BEADLO C[C@H]([NH2+]Cc1ccn[nH]1)c1ccc2c(c1)COC2 ZINC000532513109 323272558 /nfs/dbraw/zinc/27/25/58/323272558.db2.gz PVKUITKXVULSAI-JTQLQIEISA-N 1 2 243.310 2.291 20 0 BEADLO C[C@H](CC(=O)N[C@@H]1C=CCCC1)n1cc[nH+]c1 ZINC000571686606 323458301 /nfs/dbraw/zinc/45/83/01/323458301.db2.gz DIEGKNMUTBBXRZ-VXGBXAGGSA-N 1 2 233.315 2.059 20 0 BEADLO CC[C@@H]([NH2+]Cc1cc[nH]n1)c1ccc(F)cn1 ZINC000161324835 323497654 /nfs/dbraw/zinc/49/76/54/323497654.db2.gz CWVHKWWTDFDNTP-LLVKDONJSA-N 1 2 234.278 2.185 20 0 BEADLO COc1ccc[nH+]c1N1C[C@H](C)[C@@H](C)C1 ZINC000527911546 323720280 /nfs/dbraw/zinc/72/02/80/323720280.db2.gz PVJYHHOFCZVFEV-UWVGGRQHSA-N 1 2 206.289 2.182 20 0 BEADLO COc1ccc[nH+]c1NCCCC1(O)CCC1 ZINC000528037273 323744598 /nfs/dbraw/zinc/74/45/98/323744598.db2.gz HDUKMVCJUNIURY-UHFFFAOYSA-N 1 2 236.315 2.197 20 0 BEADLO CCO[C@@H](CC)C(=O)Nc1ccc(C)[nH+]c1C ZINC000119147504 323914584 /nfs/dbraw/zinc/91/45/84/323914584.db2.gz TVDJIHUBVMXSOB-LBPRGKRZSA-N 1 2 236.315 2.452 20 0 BEADLO c1snnc1C[NH2+][C@@H](c1cccnc1)C1CC1 ZINC000537317823 324064768 /nfs/dbraw/zinc/06/47/68/324064768.db2.gz LCIPLSVEVHMXPB-GFCCVEGCSA-N 1 2 246.339 2.174 20 0 BEADLO C[C@@H]1CCCC[C@H]1C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000572595545 324136729 /nfs/dbraw/zinc/13/67/29/324136729.db2.gz LVVYYWOPMVNSIX-DGCLKSJQSA-N 1 2 247.342 2.093 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)/C=C\c1[nH+]ccn1CC ZINC000492452895 324163821 /nfs/dbraw/zinc/16/38/21/324163821.db2.gz FIEZGRJPKZRZBY-FUMJMOHISA-N 1 2 249.358 2.467 20 0 BEADLO CCOc1nnc(C[NH+]2C3CCC2CC3)s1 ZINC000521195015 324178547 /nfs/dbraw/zinc/17/85/47/324178547.db2.gz OGIDNYKKYMBUTB-UHFFFAOYSA-N 1 2 239.344 2.064 20 0 BEADLO CC[C@H](NC(=O)c1cocc1C)c1[nH]cc[nH+]1 ZINC000529055842 324238823 /nfs/dbraw/zinc/23/88/23/324238823.db2.gz NNNOVUHRYUWRJF-JTQLQIEISA-N 1 2 233.271 2.192 20 0 BEADLO C[C@@H](NC(=O)C[C@H](C)c1ccco1)c1[nH]cc[nH+]1 ZINC000529411717 324289888 /nfs/dbraw/zinc/28/98/88/324289888.db2.gz GDALRXPQVMBRMF-VHSXEESVSA-N 1 2 247.298 2.374 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)c2cocc2C)[nH+]1 ZINC000529457341 324304707 /nfs/dbraw/zinc/30/47/07/324304707.db2.gz HTXKPZPSAGQQLK-UHFFFAOYSA-N 1 2 247.298 2.285 20 0 BEADLO C[C@@H]1[C@H](C(=O)NC(C)(C)c2[nH]cc[nH+]2)[C@H]1C1CC1 ZINC000529461380 324305680 /nfs/dbraw/zinc/30/56/80/324305680.db2.gz ZHGGDJKMILCJJT-GDPRMGEGSA-N 1 2 247.342 2.053 20 0 BEADLO CCc1cc(C[NH2+]Cc2ccc(F)cn2)on1 ZINC000529535465 324328729 /nfs/dbraw/zinc/32/87/29/324328729.db2.gz HDOLSQOKKJQTGK-UHFFFAOYSA-N 1 2 235.262 2.061 20 0 BEADLO C[N@H+](CCCO)Cc1c(F)ccc(F)c1Cl ZINC000529559755 324342956 /nfs/dbraw/zinc/34/29/56/324342956.db2.gz YLOWXROPYQCOGA-UHFFFAOYSA-N 1 2 249.688 2.432 20 0 BEADLO C[N@@H+](CCCO)Cc1c(F)ccc(F)c1Cl ZINC000529559755 324342962 /nfs/dbraw/zinc/34/29/62/324342962.db2.gz YLOWXROPYQCOGA-UHFFFAOYSA-N 1 2 249.688 2.432 20 0 BEADLO Cc1ncc([C@H](C)[N@H+]2C[C@H]3CC[C@@H](C2)O3)c(C)n1 ZINC000682439019 487965337 /nfs/dbraw/zinc/96/53/37/487965337.db2.gz VXDNLCSTXFBITH-WCFLWFBJSA-N 1 2 247.342 2.018 20 0 BEADLO Cc1ncc([C@H](C)[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c(C)n1 ZINC000682439019 487965342 /nfs/dbraw/zinc/96/53/42/487965342.db2.gz VXDNLCSTXFBITH-WCFLWFBJSA-N 1 2 247.342 2.018 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1CCCC[C@H]1O ZINC000128126789 324808679 /nfs/dbraw/zinc/80/86/79/324808679.db2.gz CYHZLSDIVVZIGC-WDEREUQCSA-N 1 2 236.315 2.053 20 0 BEADLO CCC(CC)CC(=O)N(C)Cc1[nH+]ccn1C ZINC000128342596 324828221 /nfs/dbraw/zinc/82/82/21/324828221.db2.gz CQKHLMKWIQPGMT-UHFFFAOYSA-N 1 2 237.347 2.205 20 0 BEADLO CCC(CC)(CO)CNc1[nH+]cccc1OC ZINC000230246270 325013632 /nfs/dbraw/zinc/01/36/32/325013632.db2.gz XGXOBNOYGLSEBC-UHFFFAOYSA-N 1 2 238.331 2.301 20 0 BEADLO Cc1nscc1C(=O)Nc1cc(C)[nH+]cc1C ZINC000543076762 325070564 /nfs/dbraw/zinc/07/05/64/325070564.db2.gz FWESBAFZULYGDP-UHFFFAOYSA-N 1 2 247.323 2.138 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2c(C)noc2C)CCO1 ZINC000131595586 325167289 /nfs/dbraw/zinc/16/72/89/325167289.db2.gz LGFGQQBSPCODIE-GFCCVEGCSA-N 1 2 238.331 2.292 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2c(C)noc2C)CCO1 ZINC000131595586 325167296 /nfs/dbraw/zinc/16/72/96/325167296.db2.gz LGFGQQBSPCODIE-GFCCVEGCSA-N 1 2 238.331 2.292 20 0 BEADLO Cc1nc(C[NH2+]C(C)(C)c2cnn(C)c2)oc1C ZINC000545292215 325208385 /nfs/dbraw/zinc/20/83/85/325208385.db2.gz BWKSWXSWQFPURO-UHFFFAOYSA-N 1 2 248.330 2.050 20 0 BEADLO CCC[C@H](C)CC(=O)NCCCn1cc[nH+]c1 ZINC000132287506 325209281 /nfs/dbraw/zinc/20/92/81/325209281.db2.gz QKEAVMCQIBLMAU-LBPRGKRZSA-N 1 2 237.347 2.216 20 0 BEADLO C(c1nnc(C2CC2)o1)[N@@H+]1CCCC2(CC2)C1 ZINC000545327176 325213831 /nfs/dbraw/zinc/21/38/31/325213831.db2.gz MASUQAGECJCXLU-UHFFFAOYSA-N 1 2 233.315 2.323 20 0 BEADLO C(c1nnc(C2CC2)o1)[N@H+]1CCCC2(CC2)C1 ZINC000545327176 325213833 /nfs/dbraw/zinc/21/38/33/325213833.db2.gz MASUQAGECJCXLU-UHFFFAOYSA-N 1 2 233.315 2.323 20 0 BEADLO Cn1ccnc1C[N@@H+]1CCc2ccsc2C1 ZINC000132629970 325231625 /nfs/dbraw/zinc/23/16/25/325231625.db2.gz ARQKKHYFQWZFLE-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO Cn1ccnc1C[N@H+]1CCc2ccsc2C1 ZINC000132629970 325231628 /nfs/dbraw/zinc/23/16/28/325231628.db2.gz ARQKKHYFQWZFLE-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC1(C2CCC2)CCC1 ZINC000564297594 325252940 /nfs/dbraw/zinc/25/29/40/325252940.db2.gz JZBWHARYNSBBSY-UHFFFAOYSA-N 1 2 247.342 2.100 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)NC1(C2CCC2)CCC1 ZINC000564297594 325252944 /nfs/dbraw/zinc/25/29/44/325252944.db2.gz JZBWHARYNSBBSY-UHFFFAOYSA-N 1 2 247.342 2.100 20 0 BEADLO CC[S@](=O)CCNc1[nH+]ccc2ccccc21 ZINC000133229047 325279184 /nfs/dbraw/zinc/27/91/84/325279184.db2.gz OORXSWLGGHDLNN-QGZVFWFLSA-N 1 2 248.351 2.415 20 0 BEADLO Cc1ccc(NC(=O)c2cncc(F)c2)c(C)[nH+]1 ZINC000134165728 325346505 /nfs/dbraw/zinc/34/65/05/325346505.db2.gz DHPYAINFQNHGDI-UHFFFAOYSA-N 1 2 245.257 2.485 20 0 BEADLO Cc1ccncc1N1CC[NH+](CC2(F)CC2)CC1 ZINC000547399038 325350626 /nfs/dbraw/zinc/35/06/26/325350626.db2.gz DXVOZLOBSIQSIG-UHFFFAOYSA-N 1 2 249.333 2.014 20 0 BEADLO Cc1c[nH+]cc(N[C@H](C)[C@@H]2CCOC2)c1 ZINC000134342670 325354491 /nfs/dbraw/zinc/35/44/91/325354491.db2.gz IXYGSTPDKSFWPZ-GHMZBOCLSA-N 1 2 206.289 2.227 20 0 BEADLO Cc1nnc(C[NH2+][C@@H](C)c2ccco2)s1 ZINC000134719756 325373280 /nfs/dbraw/zinc/37/32/80/325373280.db2.gz YATBMPOSELBCIK-ZETCQYMHSA-N 1 2 223.301 2.290 20 0 BEADLO CCCC[C@@H]([NH2+][C@@H](C)CSC)C(=O)OC ZINC000135225793 325400880 /nfs/dbraw/zinc/40/08/80/325400880.db2.gz UMBBKPGLWVWKBP-VHSXEESVSA-N 1 2 233.377 2.059 20 0 BEADLO C/C=C/C=C/C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000135388808 325410357 /nfs/dbraw/zinc/41/03/57/325410357.db2.gz JZQUDTGHBWLTMH-JFSDTOOCSA-N 1 2 219.288 2.109 20 0 BEADLO COc1cc(NCc2ccc(C)[nH+]c2C)nn1C ZINC000548467944 325461251 /nfs/dbraw/zinc/46/12/51/325461251.db2.gz MQQHZABJKFTCPQ-UHFFFAOYSA-N 1 2 246.314 2.053 20 0 BEADLO CCc1cc(C[NH2+][C@@H](C)c2cc(C)n(C)n2)on1 ZINC000548792298 325484981 /nfs/dbraw/zinc/48/49/81/325484981.db2.gz YBBGPASFORGRNU-JTQLQIEISA-N 1 2 248.330 2.130 20 0 BEADLO Cc1ccc(/C=C/C(=O)N[C@H](C)c2[nH]cc[nH+]2)o1 ZINC000141087294 325598807 /nfs/dbraw/zinc/59/88/07/325598807.db2.gz JTQKAGNAMKSZBM-BRAIEQGRSA-N 1 2 245.282 2.202 20 0 BEADLO CCC(=O)N[C@H]1CC[C@H](Nc2cccc[nH+]2)CC1 ZINC000552228589 325612003 /nfs/dbraw/zinc/61/20/03/325612003.db2.gz GEQDVVQFFBOLND-HAQNSBGRSA-N 1 2 247.342 2.331 20 0 BEADLO Cc1ccc(NC(=O)C[NH+]2CC(C)(C)C2)cc1 ZINC000553178946 325679964 /nfs/dbraw/zinc/67/99/64/325679964.db2.gz JFBYISMPFDRIJC-UHFFFAOYSA-N 1 2 232.327 2.275 20 0 BEADLO Clc1ccc(COCc2[nH]cc[nH+]2)nc1 ZINC000554176474 325708899 /nfs/dbraw/zinc/70/88/99/325708899.db2.gz FBXBNMPOCXFYLP-UHFFFAOYSA-N 1 2 223.663 2.175 20 0 BEADLO CCCN(CC1CC1)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000564660184 325802029 /nfs/dbraw/zinc/80/20/29/325802029.db2.gz GIVKLCXFWAXZRL-GFCCVEGCSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1ccn(-c2ccc([NH2+]C[C@H](C)CO)cc2)n1 ZINC000671148119 487970397 /nfs/dbraw/zinc/97/03/97/487970397.db2.gz PBCWINGSMQQFOU-NSHDSACASA-N 1 2 245.326 2.221 20 0 BEADLO CSCCN(C)c1cc[nH+]c(C(C)C)n1 ZINC000153467377 325969160 /nfs/dbraw/zinc/96/91/60/325969160.db2.gz LCONHUUWTGOJMV-UHFFFAOYSA-N 1 2 225.361 2.399 20 0 BEADLO C[C@@H](CC(=O)N(C)[C@@H]1CC1(C)C)n1cc[nH+]c1 ZINC000566302833 326031378 /nfs/dbraw/zinc/03/13/78/326031378.db2.gz AWQLOEHMJFGICS-WDEREUQCSA-N 1 2 235.331 2.091 20 0 BEADLO C[C@@H](CC(=O)N1C[C@H](C)C[C@H]1C)n1cc[nH+]c1 ZINC000566328551 326033626 /nfs/dbraw/zinc/03/36/26/326033626.db2.gz PQLGFVSZUQMQIT-GRYCIOLGSA-N 1 2 235.331 2.091 20 0 BEADLO C[C@@H](CC(=O)N1C[C@H](C)C[C@@H]1C)n1cc[nH+]c1 ZINC000566328556 326034003 /nfs/dbraw/zinc/03/40/03/326034003.db2.gz PQLGFVSZUQMQIT-WOPDTQHZSA-N 1 2 235.331 2.091 20 0 BEADLO C[C@@H](CC(=O)N1CC(C(C)(C)C)C1)n1cc[nH+]c1 ZINC000566364325 326037608 /nfs/dbraw/zinc/03/76/08/326037608.db2.gz MTKCRXQOZHCVAM-NSHDSACASA-N 1 2 249.358 2.339 20 0 BEADLO COCCC1(CNc2nc(C)[nH+]cc2C)CCC1 ZINC000566485340 326056987 /nfs/dbraw/zinc/05/69/87/326056987.db2.gz GOKJCNCEIIKRIP-UHFFFAOYSA-N 1 2 249.358 2.134 20 0 BEADLO Cc1cscc1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000566567397 326064606 /nfs/dbraw/zinc/06/46/06/326064606.db2.gz OKDBGFPNFFQTFR-UHFFFAOYSA-N 1 2 249.339 2.445 20 0 BEADLO c1nnc([C@@H]([NH2+][C@@H]2CC23CC3)c2ccccc2)[nH]1 ZINC000566614718 326067735 /nfs/dbraw/zinc/06/77/35/326067735.db2.gz KTDFIDALVMHCEA-NEPJUHHUSA-N 1 2 240.310 2.036 20 0 BEADLO CCC(C)(C)CNC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000566858092 326089004 /nfs/dbraw/zinc/08/90/04/326089004.db2.gz KIUTVXVKBXQYMU-LLVKDONJSA-N 1 2 237.347 2.387 20 0 BEADLO Cc1cc([NH2+]C[C@H]2C[C@H]2C)ccc1-n1cnnn1 ZINC000567302528 326159071 /nfs/dbraw/zinc/15/90/71/326159071.db2.gz ODGDXJQYRDRJBU-MWLCHTKSSA-N 1 2 243.314 2.039 20 0 BEADLO COC(=O)[C@H]([NH2+]CCSC)C1CCCCC1 ZINC000309585729 326161860 /nfs/dbraw/zinc/16/18/60/326161860.db2.gz RTGKOFRMOTZDJA-LLVKDONJSA-N 1 2 245.388 2.061 20 0 BEADLO C[C@H]([NH2+]Cc1ncccc1F)c1cccnc1 ZINC000154874851 326168991 /nfs/dbraw/zinc/16/89/91/326168991.db2.gz XNAXLQGXBALRAD-JTQLQIEISA-N 1 2 231.274 2.467 20 0 BEADLO CC[C@@H](O)C[NH2+][C@H](c1ccccc1)C(F)F ZINC000309841943 326171556 /nfs/dbraw/zinc/17/15/56/326171556.db2.gz QANGGJHWANCJNB-GHMZBOCLSA-N 1 2 229.270 2.353 20 0 BEADLO C[C@@H](C(=O)NC(C)(C)C)[NH+]1Cc2ccccc2C1 ZINC000155450565 326196325 /nfs/dbraw/zinc/19/63/25/326196325.db2.gz PGRYFQPFJYYMAP-NSHDSACASA-N 1 2 246.354 2.305 20 0 BEADLO CC(=O)Nc1nc(C[N@@H+](C)C(C)(C)C)cs1 ZINC000567499008 326204949 /nfs/dbraw/zinc/20/49/49/326204949.db2.gz ARUSLVLUMRLAFG-UHFFFAOYSA-N 1 2 241.360 2.332 20 0 BEADLO CC(=O)Nc1nc(C[N@H+](C)C(C)(C)C)cs1 ZINC000567499008 326204952 /nfs/dbraw/zinc/20/49/52/326204952.db2.gz ARUSLVLUMRLAFG-UHFFFAOYSA-N 1 2 241.360 2.332 20 0 BEADLO Cc1ccc(C[N@@H+]2CCOCC2(C)C)nc1 ZINC000156348538 326228402 /nfs/dbraw/zinc/22/84/02/326228402.db2.gz HENNDYKKGIFNIH-UHFFFAOYSA-N 1 2 220.316 2.001 20 0 BEADLO Cc1ccc(C[N@H+]2CCOCC2(C)C)nc1 ZINC000156348538 326228403 /nfs/dbraw/zinc/22/84/03/326228403.db2.gz HENNDYKKGIFNIH-UHFFFAOYSA-N 1 2 220.316 2.001 20 0 BEADLO Cc1cnc(C[NH2+]C2(CF)CCC2)s1 ZINC000567612483 326229029 /nfs/dbraw/zinc/22/90/29/326229029.db2.gz QWPZBADTKQIVDK-UHFFFAOYSA-N 1 2 214.309 2.433 20 0 BEADLO CCc1noc(C)c1C[N@@H+]1CCO[C@H](C)[C@@H]1C ZINC000156369595 326230004 /nfs/dbraw/zinc/23/00/04/326230004.db2.gz KEOUOBOXAWGPEU-VHSXEESVSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1noc(C)c1C[N@H+]1CCO[C@H](C)[C@@H]1C ZINC000156369595 326230006 /nfs/dbraw/zinc/23/00/06/326230006.db2.gz KEOUOBOXAWGPEU-VHSXEESVSA-N 1 2 238.331 2.155 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@H]1CC[C@@H](C)CC1 ZINC000567625424 326231530 /nfs/dbraw/zinc/23/15/30/326231530.db2.gz OYJAZBYQPKPLDB-SRVKXCTJSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@H]1CC[C@@H](C)CC1 ZINC000567625424 326231533 /nfs/dbraw/zinc/23/15/33/326231533.db2.gz OYJAZBYQPKPLDB-SRVKXCTJSA-N 1 2 249.358 2.283 20 0 BEADLO CCc1nc(C(=O)Nc2cc[nH+]c(C)c2)co1 ZINC000156837110 326243825 /nfs/dbraw/zinc/24/38/25/326243825.db2.gz SWQZFAMREDZXBR-UHFFFAOYSA-N 1 2 231.255 2.193 20 0 BEADLO CC(C)[C@H]1CCCN1C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000568014604 326296308 /nfs/dbraw/zinc/29/63/08/326296308.db2.gz GSZNZAYZEQRDIX-QWHCGFSZSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@@H](CC(=O)N1C[C@@H](C)CC1(C)C)n1cc[nH+]c1 ZINC000568021438 326296998 /nfs/dbraw/zinc/29/69/98/326296998.db2.gz UHCMTHMSQXNRNG-RYUDHWBXSA-N 1 2 249.358 2.481 20 0 BEADLO Cn1c[nH+]cc1CN1CCc2cccc(F)c2C1 ZINC000157914256 326300394 /nfs/dbraw/zinc/30/03/94/326300394.db2.gz NNLFBFPSYJCMBD-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO C[C@H](CC(=O)N[C@@H]1C[C@H]1C1CCC1)n1cc[nH+]c1 ZINC000568057613 326301729 /nfs/dbraw/zinc/30/17/29/326301729.db2.gz IEVUSMBHYYFVAT-KGYLQXTDSA-N 1 2 247.342 2.139 20 0 BEADLO Cc1ccccc1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000568070634 326304029 /nfs/dbraw/zinc/30/40/29/326304029.db2.gz YRMOALQKHCGDPA-UHFFFAOYSA-N 1 2 243.310 2.383 20 0 BEADLO C[C@H]1CC[C@H](C(=O)Nc2ccc(N)[nH+]c2)CC1 ZINC000568149195 326313245 /nfs/dbraw/zinc/31/32/45/326313245.db2.gz CYTJFKQECCJHFK-MGCOHNPYSA-N 1 2 233.315 2.259 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N3CCCCC3)ccn12 ZINC000568184849 326322658 /nfs/dbraw/zinc/32/26/58/326322658.db2.gz KZLMPUMSCGSLOX-UHFFFAOYSA-N 1 2 243.310 2.269 20 0 BEADLO O=C(NCc1cn2ccccc2[nH+]1)C1=CCCC1 ZINC000158462275 326323497 /nfs/dbraw/zinc/32/34/97/326323497.db2.gz OUFQAOANTSFQAP-UHFFFAOYSA-N 1 2 241.294 2.061 20 0 BEADLO CCC(C)(C)CNC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000568205154 326325659 /nfs/dbraw/zinc/32/56/59/326325659.db2.gz FWXOMUSIAJPEGE-SNVBAGLBSA-N 1 2 237.347 2.141 20 0 BEADLO CCC(C)(C)CNC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000568205154 326325662 /nfs/dbraw/zinc/32/56/62/326325662.db2.gz FWXOMUSIAJPEGE-SNVBAGLBSA-N 1 2 237.347 2.141 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000568249926 326335244 /nfs/dbraw/zinc/33/52/44/326335244.db2.gz ZZAGBLFEXUFIOU-GMTAPVOTSA-N 1 2 246.310 2.465 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)NCCCC(C)C ZINC000158707679 326338799 /nfs/dbraw/zinc/33/87/99/326338799.db2.gz BFFKIWYGSZMMIN-BQYQJAHWSA-N 1 2 249.358 2.469 20 0 BEADLO CC(C)CC1(CNC(=O)Cn2cc[nH+]c2)CCC1 ZINC000568459938 326357630 /nfs/dbraw/zinc/35/76/30/326357630.db2.gz OKUVGXBLHZSORL-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@@H](O)CCCOc1ccccc1-n1cc[nH+]c1 ZINC000568491462 326359206 /nfs/dbraw/zinc/35/92/06/326359206.db2.gz VMVIJFYYQCTGLW-GFCCVEGCSA-N 1 2 246.310 2.412 20 0 BEADLO CC(C)C1(CNC(=O)C[C@@H](C)n2cc[nH+]c2)CC1 ZINC000568516489 326362336 /nfs/dbraw/zinc/36/23/36/326362336.db2.gz CTCBFXNRVWAURJ-GFCCVEGCSA-N 1 2 249.358 2.387 20 0 BEADLO Cn1c2ccc(F)cc2[nH]c1=[NH+]CC1(C)CC1 ZINC000568581172 326365831 /nfs/dbraw/zinc/36/58/31/326365831.db2.gz LFUSLHRQRCSMGJ-UHFFFAOYSA-N 1 2 233.290 2.346 20 0 BEADLO Cc1nnsc1C[NH+]1Cc2ccccc2C1 ZINC000568889134 326381587 /nfs/dbraw/zinc/38/15/87/326381587.db2.gz OJJRFBPGAHCPCU-UHFFFAOYSA-N 1 2 231.324 2.362 20 0 BEADLO CC(C)[C@@H](C)N(C)C(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000666027472 487986643 /nfs/dbraw/zinc/98/66/43/487986643.db2.gz RZDGHVVWMYBBHK-GHMZBOCLSA-N 1 2 249.358 2.018 20 0 BEADLO CC(C)[C@@H](C)N(C)C(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000666027472 487986648 /nfs/dbraw/zinc/98/66/48/487986648.db2.gz RZDGHVVWMYBBHK-GHMZBOCLSA-N 1 2 249.358 2.018 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)[C@H]1[C@@H]2CCCCCC[C@@H]21 ZINC000668604281 487997482 /nfs/dbraw/zinc/99/74/82/487997482.db2.gz MWUWMKZGBJMYRS-PJXYFTJBSA-N 1 2 247.342 2.242 20 0 BEADLO CCc1cc(NCCc2cc[nH+]cc2C)ncn1 ZINC000677241180 488004785 /nfs/dbraw/zinc/00/47/85/488004785.db2.gz MTZVHAFPTMYINV-UHFFFAOYSA-N 1 2 242.326 2.397 20 0 BEADLO Cc1[nH+]cc(CN2CCc3ccccc3C2)n1C ZINC000667462084 488015179 /nfs/dbraw/zinc/01/51/79/488015179.db2.gz YNXNVWHEXQGLIC-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO C[C@H](NC(=O)c1ccc2[nH+]ccn2c1)C1CCC1 ZINC000677338832 488020536 /nfs/dbraw/zinc/02/05/36/488020536.db2.gz CKVDVUKAZVDFBZ-JTQLQIEISA-N 1 2 243.310 2.253 20 0 BEADLO Cc1ccc(CN(C)Cc2c[nH+]c3n2CCC3)o1 ZINC000667476169 488021491 /nfs/dbraw/zinc/02/14/91/488021491.db2.gz OXKVAGVRTNWADI-UHFFFAOYSA-N 1 2 245.326 2.363 20 0 BEADLO Cc1cc(-n2cccn2)ccc1[NH2+]C[C@@H](C)CO ZINC000682709236 488024151 /nfs/dbraw/zinc/02/41/51/488024151.db2.gz FNISNWJWTDIEPT-LLVKDONJSA-N 1 2 245.326 2.221 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CCC2(C)C)cc[nH+]1 ZINC000668635890 488034531 /nfs/dbraw/zinc/03/45/31/488034531.db2.gz QGIJPORRTMDZEF-LLVKDONJSA-N 1 2 218.300 2.187 20 0 BEADLO Fc1ccc(C[N@@H+]2CCCOCC2)c(F)c1F ZINC000667532447 488039983 /nfs/dbraw/zinc/03/99/83/488039983.db2.gz NFWLGRHMEKXIMA-UHFFFAOYSA-N 1 2 245.244 2.326 20 0 BEADLO Fc1ccc(C[N@H+]2CCCOCC2)c(F)c1F ZINC000667532447 488039985 /nfs/dbraw/zinc/03/99/85/488039985.db2.gz NFWLGRHMEKXIMA-UHFFFAOYSA-N 1 2 245.244 2.326 20 0 BEADLO Cc1cnc(C[NH2+]Cc2ccc3c(c2)COC3)o1 ZINC000682781213 488040436 /nfs/dbraw/zinc/04/04/36/488040436.db2.gz XMRRBQGAQORIPU-UHFFFAOYSA-N 1 2 244.294 2.303 20 0 BEADLO C[N@H+](Cc1ccoc1)Cc1cnn2c1CCC2 ZINC000667545112 488041356 /nfs/dbraw/zinc/04/13/56/488041356.db2.gz XXMQEJSJXAYJHL-UHFFFAOYSA-N 1 2 231.299 2.054 20 0 BEADLO C[N@@H+](Cc1ccoc1)Cc1cnn2c1CCC2 ZINC000667545112 488041358 /nfs/dbraw/zinc/04/13/58/488041358.db2.gz XXMQEJSJXAYJHL-UHFFFAOYSA-N 1 2 231.299 2.054 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ccc(CO)o2)nc1 ZINC000682788453 488041858 /nfs/dbraw/zinc/04/18/58/488041858.db2.gz XQSJXXLNWFWNTN-UHFFFAOYSA-N 1 2 246.310 2.107 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ccc(CO)o2)nc1 ZINC000682788453 488041861 /nfs/dbraw/zinc/04/18/61/488041861.db2.gz XQSJXXLNWFWNTN-UHFFFAOYSA-N 1 2 246.310 2.107 20 0 BEADLO CC[C@@H](Nc1cc2c(nn1)CCC2)c1[nH]cc[nH+]1 ZINC000682919380 488063783 /nfs/dbraw/zinc/06/37/83/488063783.db2.gz JXEOHYQIRYVWGZ-SNVBAGLBSA-N 1 2 243.314 2.252 20 0 BEADLO CC(C)=CCCNC(=O)CCCn1cc[nH+]c1 ZINC000682950682 488070875 /nfs/dbraw/zinc/07/08/75/488070875.db2.gz FMMRRGJRJFUFGZ-UHFFFAOYSA-N 1 2 235.331 2.136 20 0 BEADLO O=C(CCCF)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000667652728 488075535 /nfs/dbraw/zinc/07/55/35/488075535.db2.gz IDKXIQMJCAEWIE-JTQLQIEISA-N 1 2 239.294 2.213 20 0 BEADLO Cc1ccc(CN(C)Cc2[nH]cc[nH+]2)cc1F ZINC000683001332 488083219 /nfs/dbraw/zinc/08/32/19/488083219.db2.gz RZODXHAACBULQT-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ncc[nH]2)cc1F ZINC000683001332 488083222 /nfs/dbraw/zinc/08/32/22/488083222.db2.gz RZODXHAACBULQT-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ncc[nH]2)cc1F ZINC000683001332 488083223 /nfs/dbraw/zinc/08/32/23/488083223.db2.gz RZODXHAACBULQT-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H]1CCC[C@H]2C[C@H]21 ZINC000667679348 488085000 /nfs/dbraw/zinc/08/50/00/488085000.db2.gz CCVKRACBRPJUKY-HBNTYKKESA-N 1 2 246.310 2.465 20 0 BEADLO CCc1cc(NCc2cncc(C)c2)nc[nH+]1 ZINC000677650629 488088843 /nfs/dbraw/zinc/08/88/43/488088843.db2.gz OVIPKZVEBJLTLU-UHFFFAOYSA-N 1 2 228.299 2.355 20 0 BEADLO Cc1ccc2cc(C[NH+]3CCOCC3)[nH]c2c1 ZINC000257933673 488092544 /nfs/dbraw/zinc/09/25/44/488092544.db2.gz UGLLMVFGTMNIAJ-UHFFFAOYSA-N 1 2 230.311 2.309 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2cc(C)ccn2)CCO1 ZINC000683019271 488094755 /nfs/dbraw/zinc/09/47/55/488094755.db2.gz NRIPKRSZMRMRGZ-CQSZACIVSA-N 1 2 234.343 2.391 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2cc(C)ccn2)CCO1 ZINC000683019271 488094757 /nfs/dbraw/zinc/09/47/57/488094757.db2.gz NRIPKRSZMRMRGZ-CQSZACIVSA-N 1 2 234.343 2.391 20 0 BEADLO COc1ccc2c(c1)CC[N@@H+](CC(F)F)CC2 ZINC000677703056 488095031 /nfs/dbraw/zinc/09/50/31/488095031.db2.gz BXSGWQZRHUMWLO-UHFFFAOYSA-N 1 2 241.281 2.361 20 0 BEADLO COc1ccc2c(c1)CC[N@H+](CC(F)F)CC2 ZINC000677703056 488095036 /nfs/dbraw/zinc/09/50/36/488095036.db2.gz BXSGWQZRHUMWLO-UHFFFAOYSA-N 1 2 241.281 2.361 20 0 BEADLO c1c(C[N@H+]2[C@H]3C=CC[C@@H]2CC3)nnn1C1CCC1 ZINC000667709676 488095918 /nfs/dbraw/zinc/09/59/18/488095918.db2.gz KNEYRKGDJLNKIK-QWHCGFSZSA-N 1 2 244.342 2.296 20 0 BEADLO c1c(C[N@@H+]2[C@H]3C=CC[C@@H]2CC3)nnn1C1CCC1 ZINC000667709676 488095926 /nfs/dbraw/zinc/09/59/26/488095926.db2.gz KNEYRKGDJLNKIK-QWHCGFSZSA-N 1 2 244.342 2.296 20 0 BEADLO Cc1ccnc(C[NH2+][C@@H](CCO)c2ccco2)c1 ZINC000683024008 488098986 /nfs/dbraw/zinc/09/89/86/488098986.db2.gz ICGJLKORYABBJP-ZDUSSCGKSA-N 1 2 246.310 2.196 20 0 BEADLO COCC1([N@H+](C)Cc2ccn(C(C)C)n2)CC1 ZINC000677726148 488103567 /nfs/dbraw/zinc/10/35/67/488103567.db2.gz KHHCEASNEJZGJO-UHFFFAOYSA-N 1 2 237.347 2.075 20 0 BEADLO COCC1([N@@H+](C)Cc2ccn(C(C)C)n2)CC1 ZINC000677726148 488103572 /nfs/dbraw/zinc/10/35/72/488103572.db2.gz KHHCEASNEJZGJO-UHFFFAOYSA-N 1 2 237.347 2.075 20 0 BEADLO COCC1([N@H+](C)Cc2csc(C)n2)CC1 ZINC000677726643 488103929 /nfs/dbraw/zinc/10/39/29/488103929.db2.gz NKMKNAJTIGXVCY-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO COCC1([N@@H+](C)Cc2csc(C)n2)CC1 ZINC000677726643 488103933 /nfs/dbraw/zinc/10/39/33/488103933.db2.gz NKMKNAJTIGXVCY-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1noc([C@H](C)[N@@H+]2CC[C@H](C(F)F)C2)n1 ZINC000677729873 488106210 /nfs/dbraw/zinc/10/62/10/488106210.db2.gz DPTFOANNYXHVIB-XPUUQOCRSA-N 1 2 231.246 2.026 20 0 BEADLO Cc1noc([C@H](C)[N@H+]2CC[C@H](C(F)F)C2)n1 ZINC000677729873 488106214 /nfs/dbraw/zinc/10/62/14/488106214.db2.gz DPTFOANNYXHVIB-XPUUQOCRSA-N 1 2 231.246 2.026 20 0 BEADLO CCc1nnc([C@H](C)[N@@H+]2CC[C@@H](C(F)F)C2)o1 ZINC000677730324 488108121 /nfs/dbraw/zinc/10/81/21/488108121.db2.gz BSIRFYNQVNPZHM-JGVFFNPUSA-N 1 2 245.273 2.280 20 0 BEADLO CCc1nnc([C@H](C)[N@H+]2CC[C@@H](C(F)F)C2)o1 ZINC000677730324 488108126 /nfs/dbraw/zinc/10/81/26/488108126.db2.gz BSIRFYNQVNPZHM-JGVFFNPUSA-N 1 2 245.273 2.280 20 0 BEADLO Cc1noc([C@H](C)[N@@H+]2CC[C@@H](C(F)F)C2)n1 ZINC000677729871 488108268 /nfs/dbraw/zinc/10/82/68/488108268.db2.gz DPTFOANNYXHVIB-POYBYMJQSA-N 1 2 231.246 2.026 20 0 BEADLO Cc1noc([C@H](C)[N@H+]2CC[C@@H](C(F)F)C2)n1 ZINC000677729871 488108273 /nfs/dbraw/zinc/10/82/73/488108273.db2.gz DPTFOANNYXHVIB-POYBYMJQSA-N 1 2 231.246 2.026 20 0 BEADLO Cc1cnc(NCc2c[nH+]c(C)cc2C)nc1 ZINC000397006583 487537061 /nfs/dbraw/zinc/53/70/61/487537061.db2.gz LEEHCGXEUSMJBW-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CC[C@H](C(F)F)C2)o1 ZINC000677734514 488112451 /nfs/dbraw/zinc/11/24/51/488112451.db2.gz OCGXDYDXGLHLMA-QMMMGPOBSA-N 1 2 245.273 2.280 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CC[C@H](C(F)F)C2)o1 ZINC000677734514 488112458 /nfs/dbraw/zinc/11/24/58/488112458.db2.gz OCGXDYDXGLHLMA-QMMMGPOBSA-N 1 2 245.273 2.280 20 0 BEADLO C[C@@H](c1cccc(F)c1)[N@H+](C)Cc1cn(C)nn1 ZINC000677761594 488118644 /nfs/dbraw/zinc/11/86/44/488118644.db2.gz PUNWBWPDHAADOM-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO C[C@@H](c1cccc(F)c1)[N@@H+](C)Cc1cn(C)nn1 ZINC000677761594 488118648 /nfs/dbraw/zinc/11/86/48/488118648.db2.gz PUNWBWPDHAADOM-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO O=C(CCC1CCCCC1)NCCn1cc[nH+]c1 ZINC000041979406 488124429 /nfs/dbraw/zinc/12/44/29/488124429.db2.gz GGHCWWLDIYGWFB-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO C[C@@H](CO)C[N@@H+](Cc1ccccc1)CC(F)F ZINC000121137238 490077074 /nfs/dbraw/zinc/07/70/74/490077074.db2.gz QFUHAYCJHMNDDQ-LLVKDONJSA-N 1 2 243.297 2.382 20 0 BEADLO C[C@@H](CO)C[N@H+](Cc1ccccc1)CC(F)F ZINC000121137238 490077078 /nfs/dbraw/zinc/07/70/78/490077078.db2.gz QFUHAYCJHMNDDQ-LLVKDONJSA-N 1 2 243.297 2.382 20 0 BEADLO Cc1ccncc1C[N@@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000336499591 487548946 /nfs/dbraw/zinc/54/89/46/487548946.db2.gz PGAVZKQXZDLUAQ-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccncc1C[N@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000336499591 487548951 /nfs/dbraw/zinc/54/89/51/487548951.db2.gz PGAVZKQXZDLUAQ-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1nc(C)c(C[N@H+](C)Cc2ccc[nH]2)o1 ZINC000685566044 487549050 /nfs/dbraw/zinc/54/90/50/487549050.db2.gz LLXPISHBTLHVGY-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO Cc1nc(C)c(C[N@@H+](C)Cc2ccc[nH]2)o1 ZINC000685566044 487549054 /nfs/dbraw/zinc/54/90/54/487549054.db2.gz LLXPISHBTLHVGY-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO Cn1c2ccccc2nc1C[NH+]1CC2(CC2)C1 ZINC000334743330 487551313 /nfs/dbraw/zinc/55/13/13/487551313.db2.gz RQSGMVGEVDXTLH-UHFFFAOYSA-N 1 2 227.311 2.169 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCc3ncsc3C2)o1 ZINC000685574713 487554351 /nfs/dbraw/zinc/55/43/51/487554351.db2.gz DGENRBFBJGDRHS-UHFFFAOYSA-N 1 2 249.339 2.306 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCc3ncsc3C2)o1 ZINC000685574713 487554356 /nfs/dbraw/zinc/55/43/56/487554356.db2.gz DGENRBFBJGDRHS-UHFFFAOYSA-N 1 2 249.339 2.306 20 0 BEADLO CCc1cc(NC[C@@]2(C)CCCC[C@@H]2O)nc[nH+]1 ZINC000673933460 487484049 /nfs/dbraw/zinc/48/40/49/487484049.db2.gz UGAKCASWFREULE-GXTWGEPZSA-N 1 2 249.358 2.392 20 0 BEADLO Cc1cn2c([nH+]1)CN([C@@H](C)c1ncc(C)o1)CC2 ZINC000679869999 487479388 /nfs/dbraw/zinc/47/93/88/487479388.db2.gz UKJFIYODRLXZEN-NSHDSACASA-N 1 2 246.314 2.065 20 0 BEADLO Cc1c(C(=O)Nc2cc(C)[nH+]cc2C)ccn1C ZINC000684976648 487479618 /nfs/dbraw/zinc/47/96/18/487479618.db2.gz YRQPSAPTNXPKHE-UHFFFAOYSA-N 1 2 243.310 2.020 20 0 BEADLO CCn1c[nH+]cc1CNC(C)(C)C(F)F ZINC000669563533 487485047 /nfs/dbraw/zinc/48/50/47/487485047.db2.gz CPICIYYMZIBDLE-UHFFFAOYSA-N 1 2 217.263 2.036 20 0 BEADLO O=C(NCc1c[nH+]c[nH]1)c1sccc1C1CC1 ZINC000673935759 487486282 /nfs/dbraw/zinc/48/62/82/487486282.db2.gz PAOKFVZAJGYLER-UHFFFAOYSA-N 1 2 247.323 2.279 20 0 BEADLO O=C(NCc1c[nH]c[nH+]1)c1sccc1C1CC1 ZINC000673935759 487486284 /nfs/dbraw/zinc/48/62/84/487486284.db2.gz PAOKFVZAJGYLER-UHFFFAOYSA-N 1 2 247.323 2.279 20 0 BEADLO Fc1cccc([C@H]2CCN2Cc2[nH]cc[nH+]2)c1 ZINC000674013050 487499426 /nfs/dbraw/zinc/49/94/26/487499426.db2.gz JPDOYNLIUUHXTJ-GFCCVEGCSA-N 1 2 231.274 2.496 20 0 BEADLO CCc1nnc(C[NH2+][C@@H](C)c2cnccc2C)o1 ZINC000679944789 487499980 /nfs/dbraw/zinc/49/99/80/487499980.db2.gz PMFDNENWSFTRCC-JTQLQIEISA-N 1 2 246.314 2.186 20 0 BEADLO CC(C)n1ccnc1C[NH+]1CC2(C1)CCOCC2 ZINC000668232214 487500278 /nfs/dbraw/zinc/50/02/78/487500278.db2.gz HDIPKPNNJFXIDL-UHFFFAOYSA-N 1 2 249.358 2.076 20 0 BEADLO Cc1cnc(C[NH2+][C@H](C)c2cnccc2C)nc1 ZINC000679945851 487500321 /nfs/dbraw/zinc/50/03/21/487500321.db2.gz OAQWOADUMUHFHG-GFCCVEGCSA-N 1 2 242.326 2.339 20 0 BEADLO COc1cccc(C[NH2+]Cc2csnn2)c1C ZINC000668764017 487503442 /nfs/dbraw/zinc/50/34/42/487503442.db2.gz KBPAIJDAFWNKBT-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO Cc1n[nH]cc1CNc1cc[nH+]c(C(C)(C)C)n1 ZINC000674064516 487507317 /nfs/dbraw/zinc/50/73/17/487507317.db2.gz YDXCTOLQHNESST-UHFFFAOYSA-N 1 2 245.330 2.418 20 0 BEADLO CC(C)(C)c1nc(NC[C@@](C)(O)C2CC2)cc[nH+]1 ZINC000674065319 487507452 /nfs/dbraw/zinc/50/74/52/487507452.db2.gz BYXYRRGCHPFSCL-CQSZACIVSA-N 1 2 249.358 2.347 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NCc2c[nH+]cn2C)C[C@H]1C ZINC000295935849 487515522 /nfs/dbraw/zinc/51/55/22/487515522.db2.gz GHUFXKBZPXGKNS-IJLUTSLNSA-N 1 2 249.358 2.109 20 0 BEADLO Cc1nc(N2CC(CC(F)(F)F)C2)cc[nH+]1 ZINC000675295615 487515571 /nfs/dbraw/zinc/51/55/71/487515571.db2.gz VBHVGOYCAFEZEF-UHFFFAOYSA-N 1 2 231.221 2.174 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2ccc(O)cc2)s1 ZINC000668774169 487519074 /nfs/dbraw/zinc/51/90/74/487519074.db2.gz PSTWHDOKQORNMZ-UHFFFAOYSA-N 1 2 249.339 2.184 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2ccc(O)cc2)s1 ZINC000668774169 487519081 /nfs/dbraw/zinc/51/90/81/487519081.db2.gz PSTWHDOKQORNMZ-UHFFFAOYSA-N 1 2 249.339 2.184 20 0 BEADLO CCn1cncc1C[NH+]1CC(CC(F)(F)F)C1 ZINC000669571605 487522619 /nfs/dbraw/zinc/52/26/19/487522619.db2.gz UMRZIFKAHRYNJF-UHFFFAOYSA-N 1 2 247.264 2.287 20 0 BEADLO CCn1ccc(C[N@@H+](C)Cc2cocn2)c1 ZINC000683354948 488152624 /nfs/dbraw/zinc/15/26/24/488152624.db2.gz HTCPDFLORBXKFQ-UHFFFAOYSA-N 1 2 219.288 2.128 20 0 BEADLO CC(C)CCO[C@@H]1CC[N@H+](Cc2cnc[nH]2)C1 ZINC000093476148 488157115 /nfs/dbraw/zinc/15/71/15/488157115.db2.gz HXBIPJHRIQNSLN-CYBMUJFWSA-N 1 2 237.347 2.047 20 0 BEADLO CC(C)CCO[C@@H]1CC[N@@H+](Cc2cnc[nH]2)C1 ZINC000093476148 488157121 /nfs/dbraw/zinc/15/71/21/488157121.db2.gz HXBIPJHRIQNSLN-CYBMUJFWSA-N 1 2 237.347 2.047 20 0 BEADLO COc1ccc([C@@H](C)[NH2+]Cc2cocn2)cc1O ZINC000685652635 487570688 /nfs/dbraw/zinc/57/06/88/487570688.db2.gz MZEVCJDODSHRGA-SECBINFHSA-N 1 2 248.282 2.240 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)NC1CC=CC1 ZINC000685651806 487570998 /nfs/dbraw/zinc/57/09/98/487570998.db2.gz MQCRPBDSRVUMQU-UHFFFAOYSA-N 1 2 242.282 2.174 20 0 BEADLO CCC[N@@H+]1C[C@@H](C(F)(F)F)OC[C@@H]1C ZINC000671714125 487704622 /nfs/dbraw/zinc/70/46/22/487704622.db2.gz NEZYHUCOQSAECT-YUMQZZPRSA-N 1 2 211.227 2.048 20 0 BEADLO CCC[N@H+]1C[C@@H](C(F)(F)F)OC[C@@H]1C ZINC000671714125 487704629 /nfs/dbraw/zinc/70/46/29/487704629.db2.gz NEZYHUCOQSAECT-YUMQZZPRSA-N 1 2 211.227 2.048 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)[C@H]1CC12CCC2 ZINC000675331792 487709491 /nfs/dbraw/zinc/70/94/91/487709491.db2.gz ULQNOCDGJFLOCR-LLVKDONJSA-N 1 2 241.294 2.463 20 0 BEADLO CCc1cc(N[C@@H]2CCCc3c[nH]nc32)nc[nH+]1 ZINC000675801332 487780659 /nfs/dbraw/zinc/78/06/59/487780659.db2.gz FOWRFQPDVBAUPZ-LLVKDONJSA-N 1 2 243.314 2.252 20 0 BEADLO Cc1cc(N2CCCOC[C@H]2C)nc(C2CC2)[nH+]1 ZINC000676492079 487856965 /nfs/dbraw/zinc/85/69/65/487856965.db2.gz ISKRPFMFDXCKGX-LLVKDONJSA-N 1 2 247.342 2.278 20 0 BEADLO c1n[nH]cc1CNc1ccc(N2CCCC2)[nH+]c1 ZINC000676494358 487857329 /nfs/dbraw/zinc/85/73/29/487857329.db2.gz HXUHBFYTGKOBNI-UHFFFAOYSA-N 1 2 243.314 2.017 20 0 BEADLO CC(C)[C@@H]1CCCN1c1cc(CO)cc[nH+]1 ZINC000084126801 487866720 /nfs/dbraw/zinc/86/67/20/487866720.db2.gz ZWTQHGCXVNQMGF-LBPRGKRZSA-N 1 2 220.316 2.199 20 0 BEADLO C[C@@H](C[N@H+](CCO)CC(F)F)C(C)(C)C ZINC000670270755 487888851 /nfs/dbraw/zinc/88/88/51/487888851.db2.gz URBQCNDHGULTCJ-VIFPVBQESA-N 1 2 223.307 2.228 20 0 BEADLO C[C@@H](C[N@@H+](CCO)CC(F)F)C(C)(C)C ZINC000670270755 487888855 /nfs/dbraw/zinc/88/88/55/487888855.db2.gz URBQCNDHGULTCJ-VIFPVBQESA-N 1 2 223.307 2.228 20 0 BEADLO Cc1ccncc1C[NH2+][C@H](C)C(F)F ZINC000228522772 488021007 /nfs/dbraw/zinc/02/10/07/488021007.db2.gz HLJUUFJSHOCAFU-MRVPVSSYSA-N 1 2 200.232 2.133 20 0 BEADLO c1cn(Cc2cnn(Cc3ccccc3)c2)c[nH+]1 ZINC000677441179 488037020 /nfs/dbraw/zinc/03/70/20/488037020.db2.gz ZIFFHWXIIVIAEF-UHFFFAOYSA-N 1 2 238.294 2.176 20 0 BEADLO C[C@@H](O)C(C)(C)Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000677810909 488128950 /nfs/dbraw/zinc/12/89/50/488128950.db2.gz YWQQDOOQPDPEJO-SECBINFHSA-N 1 2 237.347 2.345 20 0 BEADLO COCc1cc(C[NH2+]Cc2cccs2)no1 ZINC000085221987 488141223 /nfs/dbraw/zinc/14/12/23/488141223.db2.gz JDUMQIVPBFVUGA-UHFFFAOYSA-N 1 2 238.312 2.172 20 0 BEADLO CC1(C)C[C@H]1Nc1nc(N)c2ccccc2[nH+]1 ZINC000677877684 488144891 /nfs/dbraw/zinc/14/48/91/488144891.db2.gz FKILOODKSATIIL-SNVBAGLBSA-N 1 2 228.299 2.422 20 0 BEADLO c1ccc(N2CCC3(CCOC3)CC2)[nH+]c1 ZINC000685917487 488147639 /nfs/dbraw/zinc/14/76/39/488147639.db2.gz AGWGSUARZNLRCA-UHFFFAOYSA-N 1 2 218.300 2.089 20 0 BEADLO CCn1ccc(C[N@H+](C)Cc2cocn2)c1 ZINC000683354948 488152619 /nfs/dbraw/zinc/15/26/19/488152619.db2.gz HTCPDFLORBXKFQ-UHFFFAOYSA-N 1 2 219.288 2.128 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CO[C@@H](C2CC2)C1 ZINC000667918943 488158562 /nfs/dbraw/zinc/15/85/62/488158562.db2.gz QDBNHYAUQRKFDN-CMPLNLGQSA-N 1 2 234.299 2.070 20 0 BEADLO CCCc1nc(C)c(C[N@@H+]2CCO[C@@H](C)C2)o1 ZINC000339590298 488159854 /nfs/dbraw/zinc/15/98/54/488159854.db2.gz IGXPCYDXUYZMFY-JTQLQIEISA-N 1 2 238.331 2.156 20 0 BEADLO CCCc1nc(C)c(C[N@H+]2CCO[C@@H](C)C2)o1 ZINC000339590298 488159862 /nfs/dbraw/zinc/15/98/62/488159862.db2.gz IGXPCYDXUYZMFY-JTQLQIEISA-N 1 2 238.331 2.156 20 0 BEADLO CC1(CNc2ccc(-n3cncn3)c[nH+]2)CCC1 ZINC000683436267 488161590 /nfs/dbraw/zinc/16/15/90/488161590.db2.gz FFJZZGYWVAMXLQ-UHFFFAOYSA-N 1 2 243.314 2.264 20 0 BEADLO CCN(C)C(=O)Nc1c[nH+]c2c(C)cccn12 ZINC000667949828 488166568 /nfs/dbraw/zinc/16/65/68/488166568.db2.gz OLGAHXACGDRSOR-UHFFFAOYSA-N 1 2 232.287 2.126 20 0 BEADLO Cn1ncc(C2CC2)c1C[N@@H+]1CCC=C(F)C1 ZINC000667953403 488167143 /nfs/dbraw/zinc/16/71/43/488167143.db2.gz YRMCESFGKQQETQ-UHFFFAOYSA-N 1 2 235.306 2.357 20 0 BEADLO Cn1ncc(C2CC2)c1C[N@H+]1CCC=C(F)C1 ZINC000667953403 488167145 /nfs/dbraw/zinc/16/71/45/488167145.db2.gz YRMCESFGKQQETQ-UHFFFAOYSA-N 1 2 235.306 2.357 20 0 BEADLO CCCn1nccc1C[N@H+](C)Cc1ccncc1 ZINC000667976001 488172945 /nfs/dbraw/zinc/17/29/45/488172945.db2.gz DBPSFHUWKKBGIW-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CCCn1nccc1C[N@@H+](C)Cc1ccncc1 ZINC000667976001 488172949 /nfs/dbraw/zinc/17/29/49/488172949.db2.gz DBPSFHUWKKBGIW-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO C(=C/c1ccncn1)\c1c[nH+]c2ccccn12 ZINC000678027384 488174908 /nfs/dbraw/zinc/17/49/08/488174908.db2.gz GXJLYWMFCBPGKS-SNAWJCMRSA-N 1 2 222.251 2.295 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccc(F)cn1)c1ccn(C)n1 ZINC000680464757 488184834 /nfs/dbraw/zinc/18/48/34/488184834.db2.gz KBFGGZLPLJINQF-GFCCVEGCSA-N 1 2 248.305 2.195 20 0 BEADLO c1cc(C[NH+]2CC(Cc3ccccc3)C2)no1 ZINC000677716351 488188600 /nfs/dbraw/zinc/18/86/00/488188600.db2.gz AYHYACQEASEARI-UHFFFAOYSA-N 1 2 228.295 2.349 20 0 BEADLO CCC[C@H](C)NC(=O)Nc1cc[nH+]cc1C ZINC000678095641 488197699 /nfs/dbraw/zinc/19/76/99/488197699.db2.gz HSAZTEJRLTWTTA-JTQLQIEISA-N 1 2 221.304 2.122 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1[nH]nc2ccccc21 ZINC000678154119 488209360 /nfs/dbraw/zinc/20/93/60/488209360.db2.gz ZVHLHYHAHWAYGC-MNOVXSKESA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1[nH]nc2ccccc21 ZINC000678154119 488209363 /nfs/dbraw/zinc/20/93/63/488209363.db2.gz ZVHLHYHAHWAYGC-MNOVXSKESA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1n[nH]c2ccccc21 ZINC000678154119 488209366 /nfs/dbraw/zinc/20/93/66/488209366.db2.gz ZVHLHYHAHWAYGC-MNOVXSKESA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1n[nH]c2ccccc21 ZINC000678154119 488209369 /nfs/dbraw/zinc/20/93/69/488209369.db2.gz ZVHLHYHAHWAYGC-MNOVXSKESA-N 1 2 245.326 2.172 20 0 BEADLO C[C@H]1C[N@H+](Cc2[nH]nc3ccccc32)[C@@H](C)CO1 ZINC000678154120 488209664 /nfs/dbraw/zinc/20/96/64/488209664.db2.gz ZVHLHYHAHWAYGC-QWRGUYRKSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@H]1C[N@@H+](Cc2[nH]nc3ccccc32)[C@@H](C)CO1 ZINC000678154120 488209668 /nfs/dbraw/zinc/20/96/68/488209668.db2.gz ZVHLHYHAHWAYGC-QWRGUYRKSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@H]1C[N@H+](Cc2n[nH]c3ccccc32)[C@@H](C)CO1 ZINC000678154120 488209675 /nfs/dbraw/zinc/20/96/75/488209675.db2.gz ZVHLHYHAHWAYGC-QWRGUYRKSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@H]1C[N@@H+](Cc2n[nH]c3ccccc32)[C@@H](C)CO1 ZINC000678154120 488209680 /nfs/dbraw/zinc/20/96/80/488209680.db2.gz ZVHLHYHAHWAYGC-QWRGUYRKSA-N 1 2 245.326 2.172 20 0 BEADLO C=Cn1cc(C[N@@H+](C)Cc2ccc(C)cn2)cn1 ZINC000683715666 488211511 /nfs/dbraw/zinc/21/15/11/488211511.db2.gz VVCRAPFQBRWIHK-UHFFFAOYSA-N 1 2 242.326 2.319 20 0 BEADLO C=Cn1cc(C[N@H+](C)Cc2ccc(C)cn2)cn1 ZINC000683715666 488211515 /nfs/dbraw/zinc/21/15/15/488211515.db2.gz VVCRAPFQBRWIHK-UHFFFAOYSA-N 1 2 242.326 2.319 20 0 BEADLO Cc1cn2c(n1)C[N@@H+](CC1(C)CCC1)CC2 ZINC000683707752 488211819 /nfs/dbraw/zinc/21/18/19/488211819.db2.gz GLZVYQSPUGVRLG-UHFFFAOYSA-N 1 2 219.332 2.197 20 0 BEADLO Cc1cn2c(n1)C[N@H+](CC1(C)CCC1)CC2 ZINC000683707752 488211822 /nfs/dbraw/zinc/21/18/22/488211822.db2.gz GLZVYQSPUGVRLG-UHFFFAOYSA-N 1 2 219.332 2.197 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2csnn2)cn1 ZINC000398288688 488214963 /nfs/dbraw/zinc/21/49/63/488214963.db2.gz OOMUQOLJAUQSFI-SECBINFHSA-N 1 2 234.328 2.092 20 0 BEADLO C[C@H]1c2ccccc2OCC[N@H+]1Cc1cc[nH]n1 ZINC000678196952 488215618 /nfs/dbraw/zinc/21/56/18/488215618.db2.gz OHRKZFIQJAMNLU-NSHDSACASA-N 1 2 243.310 2.365 20 0 BEADLO C[C@H]1c2ccccc2OCC[N@@H+]1Cc1cc[nH]n1 ZINC000678196952 488215620 /nfs/dbraw/zinc/21/56/20/488215620.db2.gz OHRKZFIQJAMNLU-NSHDSACASA-N 1 2 243.310 2.365 20 0 BEADLO c1c2ccncc2sc1C[N@@H+]1CCO[C@@H]2C[C@@H]21 ZINC000668186795 488216998 /nfs/dbraw/zinc/21/69/98/488216998.db2.gz QIYHHEGKHAJGMV-NWDGAFQWSA-N 1 2 246.335 2.269 20 0 BEADLO c1c2ccncc2sc1C[N@H+]1CCO[C@@H]2C[C@@H]21 ZINC000668186795 488216999 /nfs/dbraw/zinc/21/69/99/488216999.db2.gz QIYHHEGKHAJGMV-NWDGAFQWSA-N 1 2 246.335 2.269 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C1CC2(CC2)C1 ZINC000668746652 488217961 /nfs/dbraw/zinc/21/79/61/488217961.db2.gz SBAVPFVRNVEMMM-UHFFFAOYSA-N 1 2 230.311 2.195 20 0 BEADLO CC1=CC[C@](C)(C(=O)NCc2[nH+]ccn2C)CC1 ZINC000668193619 488219749 /nfs/dbraw/zinc/21/97/49/488219749.db2.gz KFZMRJNWQICJJP-AWEZNQCLSA-N 1 2 247.342 2.173 20 0 BEADLO COc1ncccc1C[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000683787072 488222464 /nfs/dbraw/zinc/22/24/64/488222464.db2.gz YRCQTKDOKQZTOZ-PWSUYJOCSA-N 1 2 238.306 2.270 20 0 BEADLO COc1ncccc1C[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000683787072 488222468 /nfs/dbraw/zinc/22/24/68/488222468.db2.gz YRCQTKDOKQZTOZ-PWSUYJOCSA-N 1 2 238.306 2.270 20 0 BEADLO Cc1ccc(F)c(C[N@H+](C)Cc2cn[nH]c2)c1 ZINC000678266810 488226057 /nfs/dbraw/zinc/22/60/57/488226057.db2.gz LEIBFAGQBGZCAQ-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1ccc(F)c(C[N@@H+](C)Cc2cn[nH]c2)c1 ZINC000678266810 488226060 /nfs/dbraw/zinc/22/60/60/488226060.db2.gz LEIBFAGQBGZCAQ-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Fc1ccc2c(c1)C[N@@H+](Cc1cn[nH]c1)CC2 ZINC000678265662 488230420 /nfs/dbraw/zinc/23/04/20/488230420.db2.gz XSDXDITVUVLRJM-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO Fc1ccc2c(c1)C[N@H+](Cc1cn[nH]c1)CC2 ZINC000678265662 488230423 /nfs/dbraw/zinc/23/04/23/488230423.db2.gz XSDXDITVUVLRJM-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO Cc1ccc(C[N@@H+]2CCc3cn[nH]c3C2)s1 ZINC000678273132 488233497 /nfs/dbraw/zinc/23/34/97/488233497.db2.gz HXHVQCFKUAQHCJ-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1ccc(C[N@H+]2CCc3cn[nH]c3C2)s1 ZINC000678273132 488233499 /nfs/dbraw/zinc/23/34/99/488233499.db2.gz HXHVQCFKUAQHCJ-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1ccc(C[N@@H+]2CCc3c[nH]nc3C2)s1 ZINC000678273132 488233501 /nfs/dbraw/zinc/23/35/01/488233501.db2.gz HXHVQCFKUAQHCJ-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1ccc(C[N@H+]2CCc3c[nH]nc3C2)s1 ZINC000678273132 488233504 /nfs/dbraw/zinc/23/35/04/488233504.db2.gz HXHVQCFKUAQHCJ-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO CCc1ccc(C[N@@H+]2CCc3c[nH]nc3C2)o1 ZINC000678275903 488235436 /nfs/dbraw/zinc/23/54/36/488235436.db2.gz KISCBUHKXCNURU-UHFFFAOYSA-N 1 2 231.299 2.123 20 0 BEADLO CCc1ccc(C[N@H+]2CCc3c[nH]nc3C2)o1 ZINC000678275903 488235438 /nfs/dbraw/zinc/23/54/38/488235438.db2.gz KISCBUHKXCNURU-UHFFFAOYSA-N 1 2 231.299 2.123 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCOCC23CCC3)o1 ZINC000683898571 488240566 /nfs/dbraw/zinc/24/05/66/488240566.db2.gz OFEVIIRNPPEEGY-UHFFFAOYSA-N 1 2 236.315 2.046 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCOCC23CCC3)o1 ZINC000683898571 488240569 /nfs/dbraw/zinc/24/05/69/488240569.db2.gz OFEVIIRNPPEEGY-UHFFFAOYSA-N 1 2 236.315 2.046 20 0 BEADLO CCC[C@@H](C)CC(=O)N[C@H]1CCc2c[nH+]cn2C1 ZINC000672145235 488241012 /nfs/dbraw/zinc/24/10/12/488241012.db2.gz BAUBUMRZOHQVJP-NEPJUHHUSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1ccnc(NC(=O)C(C)(C)c2c[nH+]c[nH]2)c1 ZINC000683917929 488244420 /nfs/dbraw/zinc/24/44/20/488244420.db2.gz QUUIZAYIJZKOCS-UHFFFAOYSA-N 1 2 244.298 2.029 20 0 BEADLO Cc1ccnc(NC(=O)C(C)(C)c2c[nH]c[nH+]2)c1 ZINC000683917929 488244422 /nfs/dbraw/zinc/24/44/22/488244422.db2.gz QUUIZAYIJZKOCS-UHFFFAOYSA-N 1 2 244.298 2.029 20 0 BEADLO c1nc(N2CCC[C@H]3C[C@H]32)cc(N2CCCC2)[nH+]1 ZINC000672324099 488251575 /nfs/dbraw/zinc/25/15/75/488251575.db2.gz IZOLOKQSPLYUIY-NWDGAFQWSA-N 1 2 244.342 2.066 20 0 BEADLO c1nc(N2CCCC2)cc(N2CCC[C@H]3C[C@H]32)[nH+]1 ZINC000672324099 488251576 /nfs/dbraw/zinc/25/15/76/488251576.db2.gz IZOLOKQSPLYUIY-NWDGAFQWSA-N 1 2 244.342 2.066 20 0 BEADLO CCn1cc(CNc2cc3cc[nH]c3c[nH+]2)cn1 ZINC000672330964 488252019 /nfs/dbraw/zinc/25/20/19/488252019.db2.gz GBISTTQWPQMMLZ-UHFFFAOYSA-N 1 2 241.298 2.391 20 0 BEADLO CCC1(O)CCC(Nc2cc[nH+]c(C)n2)CC1 ZINC000678481638 488259896 /nfs/dbraw/zinc/25/98/96/488259896.db2.gz OHOASRCOLFXDNZ-UHFFFAOYSA-N 1 2 235.331 2.281 20 0 BEADLO Cc1cc(=O)[nH]c([C@H](C)[N@H+](C)Cc2ccoc2)n1 ZINC000684089316 488265223 /nfs/dbraw/zinc/26/52/23/488265223.db2.gz SWDWFFUVOBTJRG-JTQLQIEISA-N 1 2 247.298 2.277 20 0 BEADLO Cc1cc(=O)[nH]c([C@H](C)[N@@H+](C)Cc2ccoc2)n1 ZINC000684089316 488265224 /nfs/dbraw/zinc/26/52/24/488265224.db2.gz SWDWFFUVOBTJRG-JTQLQIEISA-N 1 2 247.298 2.277 20 0 BEADLO CCCCCNC(=O)C[NH+]1CCC(F)(F)CC1 ZINC000684624815 488334617 /nfs/dbraw/zinc/33/46/17/488334617.db2.gz XNNDANNTXYWLIC-UHFFFAOYSA-N 1 2 248.317 2.024 20 0 BEADLO CCc1cc(NC[C@H]2CCC[C@H]2OC)nc[nH+]1 ZINC000678720941 488278500 /nfs/dbraw/zinc/27/85/00/488278500.db2.gz SKDYYPUQLZETCR-ZYHUDNBSSA-N 1 2 235.331 2.266 20 0 BEADLO COc1ccc(NCc2ccnn2C(C)C)[nH+]c1 ZINC000684385268 488303633 /nfs/dbraw/zinc/30/36/33/488303633.db2.gz HPVFDXMJIBQDCS-UHFFFAOYSA-N 1 2 246.314 2.480 20 0 BEADLO CC[C@@H](Nc1ccc(OC)c[nH+]1)c1cnn(C)c1 ZINC000679068590 488305463 /nfs/dbraw/zinc/30/54/63/488305463.db2.gz JFAVYRDGOZXOSM-GFCCVEGCSA-N 1 2 246.314 2.387 20 0 BEADLO COc1ccc[nH+]c1N[C@@H](C)C[C@H]1CCOC1 ZINC000679092323 488308526 /nfs/dbraw/zinc/30/85/26/488308526.db2.gz ZKIWHZWYSPHBLS-WDEREUQCSA-N 1 2 236.315 2.317 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1cn2cccc(F)c2n1 ZINC000684411078 488309178 /nfs/dbraw/zinc/30/91/78/488309178.db2.gz FPLPUYGKFBMIDT-UWVGGRQHSA-N 1 2 233.290 2.456 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)nc1 ZINC000679219429 488317493 /nfs/dbraw/zinc/31/74/93/488317493.db2.gz FUTMRZXIZQBTEB-GWCFXTLKSA-N 1 2 238.306 2.270 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)nc1 ZINC000679219429 488317494 /nfs/dbraw/zinc/31/74/94/488317494.db2.gz FUTMRZXIZQBTEB-GWCFXTLKSA-N 1 2 238.306 2.270 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CC[C@H](C)[C@@H](F)C2)o1 ZINC000679219242 488318527 /nfs/dbraw/zinc/31/85/27/488318527.db2.gz FMQIKBQNHNWOPQ-NRPADANISA-N 1 2 227.283 2.119 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CC[C@H](C)[C@@H](F)C2)o1 ZINC000679219242 488318528 /nfs/dbraw/zinc/31/85/28/488318528.db2.gz FMQIKBQNHNWOPQ-NRPADANISA-N 1 2 227.283 2.119 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CC[C@@H](C)[C@H](F)C2)o1 ZINC000679219241 488318609 /nfs/dbraw/zinc/31/86/09/488318609.db2.gz FMQIKBQNHNWOPQ-KHQFGBGNSA-N 1 2 227.283 2.119 20 0 BEADLO CC[C@@](C)(OC)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000684574505 488328311 /nfs/dbraw/zinc/32/83/11/488328311.db2.gz CYIIFJBLNIBRCA-CYBMUJFWSA-N 1 2 247.298 2.088 20 0 BEADLO C1=CCN(c2cc(NCC3CC3)[nH+]cn2)CC1 ZINC000679279959 488328685 /nfs/dbraw/zinc/32/86/85/488328685.db2.gz MKXGBNNWVKGBFF-UHFFFAOYSA-N 1 2 230.315 2.065 20 0 BEADLO C1=CCN(c2cc(NCC3CC3)nc[nH+]2)CC1 ZINC000679279959 488328687 /nfs/dbraw/zinc/32/86/87/488328687.db2.gz MKXGBNNWVKGBFF-UHFFFAOYSA-N 1 2 230.315 2.065 20 0 BEADLO Fc1cncc(C[NH+]2CC3(C2)CC(F)(F)C3)c1 ZINC000684619888 488334275 /nfs/dbraw/zinc/33/42/75/488334275.db2.gz UIYKKDWDONDJGS-UHFFFAOYSA-N 1 2 242.244 2.452 20 0 BEADLO Cc1ccccc1NC(=O)C[N@H+]1CC=CCC1 ZINC000679323155 488337326 /nfs/dbraw/zinc/33/73/26/488337326.db2.gz KNZOKMWVEVJDPZ-UHFFFAOYSA-N 1 2 230.311 2.195 20 0 BEADLO Cc1ccccc1NC(=O)C[N@@H+]1CC=CCC1 ZINC000679323155 488337328 /nfs/dbraw/zinc/33/73/28/488337328.db2.gz KNZOKMWVEVJDPZ-UHFFFAOYSA-N 1 2 230.311 2.195 20 0 BEADLO Cc1ccc(NC(=O)N2CC=CCC2)c(C)[nH+]1 ZINC000679343852 488342109 /nfs/dbraw/zinc/34/21/09/488342109.db2.gz TVWPYJOPBCPUKS-UHFFFAOYSA-N 1 2 231.299 2.492 20 0 BEADLO CCCn1cc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)cn1 ZINC000679361671 488346729 /nfs/dbraw/zinc/34/67/29/488346729.db2.gz UNTJBHALMMJYOQ-DGCLKSJQSA-N 1 2 239.338 2.473 20 0 BEADLO CCCn1cc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)cn1 ZINC000679361671 488346731 /nfs/dbraw/zinc/34/67/31/488346731.db2.gz UNTJBHALMMJYOQ-DGCLKSJQSA-N 1 2 239.338 2.473 20 0 BEADLO Cn1c[nH+]c(CN2CCc3cc(F)ccc3C2)c1 ZINC000684837568 488348123 /nfs/dbraw/zinc/34/81/23/488348123.db2.gz LHNBOBJUTNTKOP-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1cnc(C[N@@H+]2CCc3cc(F)ccc3C2)c1 ZINC000684837568 488348126 /nfs/dbraw/zinc/34/81/26/488348126.db2.gz LHNBOBJUTNTKOP-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1cnc(C[N@H+]2CCc3cc(F)ccc3C2)c1 ZINC000684837568 488348128 /nfs/dbraw/zinc/34/81/28/488348128.db2.gz LHNBOBJUTNTKOP-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO CN(C(=O)C(C)(C)c1c[nH+]c[nH]1)C1CCCC1 ZINC000684871723 488348646 /nfs/dbraw/zinc/34/86/46/488348646.db2.gz PIQUDZUXOANPCM-UHFFFAOYSA-N 1 2 235.331 2.088 20 0 BEADLO FC(F)O[C@@H]1CCCN(c2cccc[nH+]2)C1 ZINC000679709523 488364865 /nfs/dbraw/zinc/36/48/65/488364865.db2.gz DTLHJZGGGPONTJ-SECBINFHSA-N 1 2 228.242 2.290 20 0 BEADLO Cc1nc(N[C@@H](C)C(C)(C)O)c2c([nH+]1)CCCC2 ZINC000679836472 488367494 /nfs/dbraw/zinc/36/74/94/488367494.db2.gz HQRQDSAQQADACS-VIFPVBQESA-N 1 2 249.358 2.235 20 0 BEADLO FC1(F)C[C@]12CCN(c1cccc[nH+]1)C2 ZINC000651486594 490099289 /nfs/dbraw/zinc/09/92/89/490099289.db2.gz FAIOFNKOBWUTPN-JTQLQIEISA-N 1 2 210.227 2.317 20 0 BEADLO c1nn[nH]c1C[NH2+]Cc1ccc(C2CCC2)cc1 ZINC000623578496 490135258 /nfs/dbraw/zinc/13/52/58/490135258.db2.gz JYWGGHTXCJGGNR-UHFFFAOYSA-N 1 2 242.326 2.362 20 0 BEADLO c1[nH]nnc1C[NH2+]Cc1ccc(C2CCC2)cc1 ZINC000623578496 490135262 /nfs/dbraw/zinc/13/52/62/490135262.db2.gz JYWGGHTXCJGGNR-UHFFFAOYSA-N 1 2 242.326 2.362 20 0 BEADLO c1n[nH]nc1C[NH2+]Cc1ccc(C2CCC2)cc1 ZINC000623578496 490135268 /nfs/dbraw/zinc/13/52/68/490135268.db2.gz JYWGGHTXCJGGNR-UHFFFAOYSA-N 1 2 242.326 2.362 20 0 BEADLO COC[C@@H]([NH2+]Cc1cc(C)ccn1)c1ccco1 ZINC000683022490 490154840 /nfs/dbraw/zinc/15/48/40/490154840.db2.gz USTMUUUBJLJTSU-CYBMUJFWSA-N 1 2 246.310 2.460 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@H]2CCc3ccccc32)no1 ZINC000045943434 490157476 /nfs/dbraw/zinc/15/74/76/490157476.db2.gz GCFFCBQBYQWKPS-ZDUSSCGKSA-N 1 2 243.310 2.497 20 0 BEADLO Cc1nc(C[N@H+](C)[C@H]2CCc3ccccc32)no1 ZINC000045943434 490157483 /nfs/dbraw/zinc/15/74/83/490157483.db2.gz GCFFCBQBYQWKPS-ZDUSSCGKSA-N 1 2 243.310 2.497 20 0 BEADLO C[C@@H](N[C@@H](C)c1nccs1)c1[nH+]ccn1C ZINC000070732295 490236470 /nfs/dbraw/zinc/23/64/70/490236470.db2.gz CFYQEMPSNRQLMA-BDAKNGLRSA-N 1 2 236.344 2.288 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1nccs1)c1nccn1C ZINC000070732295 490236476 /nfs/dbraw/zinc/23/64/76/490236476.db2.gz CFYQEMPSNRQLMA-BDAKNGLRSA-N 1 2 236.344 2.288 20 0 BEADLO c1cc2c(s1)CC[N@@H+](Cc1cncnc1)C2 ZINC000124271560 490342267 /nfs/dbraw/zinc/34/22/67/490342267.db2.gz BJAKXAOOODGONL-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1cc2c(s1)CC[N@H+](Cc1cncnc1)C2 ZINC000124271560 490342270 /nfs/dbraw/zinc/34/22/70/490342270.db2.gz BJAKXAOOODGONL-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO FC1(F)CCC[C@@H]1[NH2+]Cc1cncs1 ZINC000306632572 490645110 /nfs/dbraw/zinc/64/51/10/490645110.db2.gz PLKGDSUJAQDWOY-QMMMGPOBSA-N 1 2 218.272 2.421 20 0 BEADLO Cc1cnc(C[NH2+]Cc2ccsc2)o1 ZINC000227084075 491054840 /nfs/dbraw/zinc/05/48/40/491054840.db2.gz XSWCSIGBHIFPQO-UHFFFAOYSA-N 1 2 208.286 2.334 20 0 BEADLO CCC(C)(C)N(C)C(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000668898774 491059996 /nfs/dbraw/zinc/05/99/96/491059996.db2.gz BFRGNOQRYRBBBV-JTQLQIEISA-N 1 2 249.358 2.162 20 0 BEADLO CCC(C)(C)N(C)C(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000668898774 491059997 /nfs/dbraw/zinc/05/99/97/491059997.db2.gz BFRGNOQRYRBBBV-JTQLQIEISA-N 1 2 249.358 2.162 20 0 BEADLO CCCC(C)(C)C(=O)N[C@@H]1CCn2cc[nH+]c2C1 ZINC000651775962 491074842 /nfs/dbraw/zinc/07/48/42/491074842.db2.gz VHEBOGCDDIAVDT-LLVKDONJSA-N 1 2 249.358 2.140 20 0 BEADLO c1c(CNc2cccnc2)[nH+]c2ccccn12 ZINC000088627107 491075870 /nfs/dbraw/zinc/07/58/70/491075870.db2.gz DBOLFWCHKUEQMH-UHFFFAOYSA-N 1 2 224.267 2.341 20 0 BEADLO C[C@H]([NH2+]Cc1ccno1)c1cncc(F)c1 ZINC000228578806 491095683 /nfs/dbraw/zinc/09/56/83/491095683.db2.gz XDEXBBJRVMYZHD-QMMMGPOBSA-N 1 2 221.235 2.060 20 0 BEADLO CC(C)[C@@](C)(O)CNc1cc[nH+]c2ccncc12 ZINC000085686645 491097462 /nfs/dbraw/zinc/09/74/62/491097462.db2.gz OVXFUZDMZLOXMC-AWEZNQCLSA-N 1 2 245.326 2.449 20 0 BEADLO Cc1c[nH+]cc(NCc2ccc(C)nn2)c1 ZINC000414360773 491108099 /nfs/dbraw/zinc/10/80/99/491108099.db2.gz OKCCCNRYMIAZSB-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO Cc1[nH]ncc1C[NH2+]CCOCC1CCCC1 ZINC000313310657 491123216 /nfs/dbraw/zinc/12/32/16/491123216.db2.gz WMOZBNUQUXRYGV-UHFFFAOYSA-N 1 2 237.347 2.015 20 0 BEADLO CCc1cnc(CNc2nc(C)[nH+]cc2C)s1 ZINC000584241991 491124738 /nfs/dbraw/zinc/12/47/38/491124738.db2.gz CNETVLQCOHSBKG-UHFFFAOYSA-N 1 2 248.355 2.146 20 0 BEADLO Cc1ccc(CNc2ccc(N(C)C)[nH+]c2)cn1 ZINC000131976781 491134394 /nfs/dbraw/zinc/13/43/94/491134394.db2.gz LRMUPNOHAXJPFF-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO CCn1nc(C)c(C[NH2+]Cc2ncc(C)o2)c1C ZINC000307967651 491134895 /nfs/dbraw/zinc/13/48/95/491134895.db2.gz SYTSVBZDGPLCTR-UHFFFAOYSA-N 1 2 248.330 2.106 20 0 BEADLO C[C@@H]1CCN(C(=O)CCCn2cc[nH+]c2)C[C@@H]1C ZINC000132886474 491141571 /nfs/dbraw/zinc/14/15/71/491141571.db2.gz AUEPULOMWNZUBX-OLZOCXBDSA-N 1 2 249.358 2.168 20 0 BEADLO Cc1cc(N[C@H](C)C[C@@H]2CCOC2)nc[nH+]1 ZINC000309525013 491149929 /nfs/dbraw/zinc/14/99/29/491149929.db2.gz CLYLERLXVZGSOR-MNOVXSKESA-N 1 2 221.304 2.012 20 0 BEADLO Nc1[nH+]cnc(N[C@@H]2CCC(F)(F)C2)c1Cl ZINC000309644722 491153480 /nfs/dbraw/zinc/15/34/80/491153480.db2.gz VRDYTDNYUOFRIM-RXMQYKEDSA-N 1 2 248.664 2.312 20 0 BEADLO Nc1nc[nH+]c(N[C@@H]2CCC(F)(F)C2)c1Cl ZINC000309644722 491153481 /nfs/dbraw/zinc/15/34/81/491153481.db2.gz VRDYTDNYUOFRIM-RXMQYKEDSA-N 1 2 248.664 2.312 20 0 BEADLO O=C(CCCn1cc[nH+]c1)Nc1cccc(O)c1 ZINC000133724358 491159943 /nfs/dbraw/zinc/15/99/43/491159943.db2.gz MJUSPTZQQJAOLK-UHFFFAOYSA-N 1 2 245.282 2.008 20 0 BEADLO COc1ccccc1[C@@H](C)[NH2+]Cc1cn(C)cn1 ZINC000310790700 491162604 /nfs/dbraw/zinc/16/26/04/491162604.db2.gz UPXOFAZBLBHKPE-LLVKDONJSA-N 1 2 245.326 2.280 20 0 BEADLO C[C@@H]1CCC[C@H](C)C1NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493230149 533819198 /nfs/dbraw/zinc/81/91/98/533819198.db2.gz UPEUQUGZIVNFET-NDDQQYECSA-N 1 2 247.342 2.364 20 0 BEADLO C[C@@H]1CC[N@H+](CCCCCO)CC1(F)F ZINC000494221860 534030385 /nfs/dbraw/zinc/03/03/85/534030385.db2.gz AOHLWYUZRWOSNX-SNVBAGLBSA-N 1 2 221.291 2.126 20 0 BEADLO C[C@@H]1CC[N@@H+](CCCCCO)CC1(F)F ZINC000494221860 534030390 /nfs/dbraw/zinc/03/03/90/534030390.db2.gz AOHLWYUZRWOSNX-SNVBAGLBSA-N 1 2 221.291 2.126 20 0 BEADLO CC(C)Cc1ccc(C[NH+]2CCOCC2)cn1 ZINC000891391536 582676436 /nfs/dbraw/zinc/67/64/36/582676436.db2.gz VSNYKYVVGUINLW-UHFFFAOYSA-N 1 2 234.343 2.112 20 0 BEADLO C[C@@H]1CC[C@@H](C)N(C(=O)/C=C\c2[nH]cc[nH+]2)C1 ZINC000493231629 534140571 /nfs/dbraw/zinc/14/05/71/534140571.db2.gz YBHNZWCMIDSGNR-ADRPCIBZSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@@H]1CC[C@@H](C)N(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493231632 534141066 /nfs/dbraw/zinc/14/10/66/534141066.db2.gz YBHNZWCMIDSGNR-XIJCSBCJSA-N 1 2 233.315 2.070 20 0 BEADLO CCc1cc(NC[C@H](C)COC)nc(CC)[nH+]1 ZINC000892025422 582765058 /nfs/dbraw/zinc/76/50/58/582765058.db2.gz SAOJMPHDAVWWMB-JTQLQIEISA-N 1 2 237.347 2.296 20 0 BEADLO CCc1ccc(C[N@@H+]2C[C@H](C)OC[C@H]2C)nc1 ZINC000335929998 536179763 /nfs/dbraw/zinc/17/97/63/536179763.db2.gz ATXVKSXJHREOBZ-NEPJUHHUSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1ccc(C[N@H+]2C[C@H](C)OC[C@H]2C)nc1 ZINC000335929998 536179765 /nfs/dbraw/zinc/17/97/65/536179765.db2.gz ATXVKSXJHREOBZ-NEPJUHHUSA-N 1 2 234.343 2.253 20 0 BEADLO C[C@H]1CSCC[N@@H+]1Cc1nccn1C1CC1 ZINC000892045157 582772105 /nfs/dbraw/zinc/77/21/05/582772105.db2.gz CFPJLKIMNJKPGX-JTQLQIEISA-N 1 2 237.372 2.155 20 0 BEADLO C[C@H]1CSCC[N@H+]1Cc1nccn1C1CC1 ZINC000892045157 582772114 /nfs/dbraw/zinc/77/21/14/582772114.db2.gz CFPJLKIMNJKPGX-JTQLQIEISA-N 1 2 237.372 2.155 20 0 BEADLO CCc1nn(C[N@@H+]2CC[C@H](C)[C@H]2C)c(=S)o1 ZINC001332125896 974952950 /nfs/dbraw/zinc/95/29/50/974952950.db2.gz QKBRERINDFOYBS-DTWKUNHWSA-N 1 2 241.360 2.456 20 0 BEADLO CCc1nn(C[N@H+]2CC[C@H](C)[C@H]2C)c(=S)o1 ZINC001332125896 974952958 /nfs/dbraw/zinc/95/29/58/974952958.db2.gz QKBRERINDFOYBS-DTWKUNHWSA-N 1 2 241.360 2.456 20 0 BEADLO Cn1cccc1C[NH2+]C(C)(C)C(F)F ZINC000393661128 582852042 /nfs/dbraw/zinc/85/20/42/582852042.db2.gz WLNKPBHYGOIYTF-UHFFFAOYSA-N 1 2 202.248 2.158 20 0 BEADLO CC[C@H](C)CN(C)c1cc(N(C)C)[nH+]cn1 ZINC000892454309 582890237 /nfs/dbraw/zinc/89/02/37/582890237.db2.gz MZYWZOCOEKJJCO-JTQLQIEISA-N 1 2 222.336 2.025 20 0 BEADLO CC[C@H](C)CN(C)c1cc(N(C)C)nc[nH+]1 ZINC000892454309 582890238 /nfs/dbraw/zinc/89/02/38/582890238.db2.gz MZYWZOCOEKJJCO-JTQLQIEISA-N 1 2 222.336 2.025 20 0 BEADLO CC(=O)c1cccc(C[N@H+]2CCO[C@@H](C)[C@@H]2C)c1 ZINC000336196000 534888432 /nfs/dbraw/zinc/88/84/32/534888432.db2.gz KDTAWRPBMQYZIM-AAEUAGOBSA-N 1 2 247.338 2.498 20 0 BEADLO CC(=O)c1cccc(C[N@@H+]2CCO[C@@H](C)[C@@H]2C)c1 ZINC000336196000 534888436 /nfs/dbraw/zinc/88/84/36/534888436.db2.gz KDTAWRPBMQYZIM-AAEUAGOBSA-N 1 2 247.338 2.498 20 0 BEADLO CC(C)(CCNC(=O)C=Cc1c[nH]c[nH+]1)C1CC1 ZINC000492991271 527031937 /nfs/dbraw/zinc/03/19/37/527031937.db2.gz HISVPWNIMLOYDR-AATRIKPKSA-N 1 2 247.342 2.365 20 0 BEADLO C/C=C(/C=C/C(=O)NCc1[nH+]ccn1CC)CC ZINC000493761413 527553190 /nfs/dbraw/zinc/55/31/90/527553190.db2.gz VWJIMDLHIFLLHY-DVKGPQSVSA-N 1 2 247.342 2.432 20 0 BEADLO C/C=C(/C=C\C(=O)NCCCn1cc[nH+]c1)CC ZINC000493478652 527560546 /nfs/dbraw/zinc/56/05/46/527560546.db2.gz HQJPBZOKMFQOPG-YZWNIHMXSA-N 1 2 247.342 2.302 20 0 BEADLO CC(C)C(C)(C)CNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492808141 527562878 /nfs/dbraw/zinc/56/28/78/527562878.db2.gz CHSUMZXPXYKIKG-WAYWQWQTSA-N 1 2 235.331 2.221 20 0 BEADLO CC(C)C(CNC(=O)/C=C/c1[nH]cc[nH+]1)C(C)C ZINC000493591442 527576920 /nfs/dbraw/zinc/57/69/20/527576920.db2.gz WDGZBRLCWWCRRL-AATRIKPKSA-N 1 2 249.358 2.467 20 0 BEADLO C/C=C/C=C/C(=O)N[C@H](c1[nH+]ccn1C)C1CC1 ZINC000492879987 527585375 /nfs/dbraw/zinc/58/53/75/527585375.db2.gz IFVAIHIJWDNSLO-IHGYFHCZSA-N 1 2 245.326 2.120 20 0 BEADLO CC(C)CC[C@H](C)NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493576270 527835525 /nfs/dbraw/zinc/83/55/25/527835525.db2.gz CGIZYXUDBZVSPI-MLRMMBSGSA-N 1 2 235.331 2.364 20 0 BEADLO CC(C)CN(C(=O)/C=C\c1[nH]cc[nH+]1)C1CC1 ZINC000493672427 527889686 /nfs/dbraw/zinc/88/96/86/527889686.db2.gz GZMLOMKGLVEWLG-WAYWQWQTSA-N 1 2 233.315 2.070 20 0 BEADLO CCCCCCNC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493700636 528140780 /nfs/dbraw/zinc/14/07/80/528140780.db2.gz YETKITXIBZSQJZ-VOTSOKGWSA-N 1 2 221.304 2.119 20 0 BEADLO CC(C)c1nc(N(C)C[C@@H]2CCOC2)cc[nH+]1 ZINC000174919920 528363529 /nfs/dbraw/zinc/36/35/29/528363529.db2.gz GTRXYWZLASTLMV-NSHDSACASA-N 1 2 235.331 2.073 20 0 BEADLO CCO/C=C/C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000493527950 528496683 /nfs/dbraw/zinc/49/66/83/528496683.db2.gz QWNAULZBFZOAEG-VOTSOKGWSA-N 1 2 234.299 2.496 20 0 BEADLO CCC(C)(C)N(C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492867926 528536347 /nfs/dbraw/zinc/53/63/47/528536347.db2.gz SHWWRJHRYAGLME-SREVYHEPSA-N 1 2 221.304 2.070 20 0 BEADLO CCO/C=C\C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000493527941 528538296 /nfs/dbraw/zinc/53/82/96/528538296.db2.gz QWNAULZBFZOAEG-SREVYHEPSA-N 1 2 234.299 2.496 20 0 BEADLO CC(C)[C@@H]1CCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492899763 528671798 /nfs/dbraw/zinc/67/17/98/528671798.db2.gz MPCNDNOLGPQPGM-FJOGCWAESA-N 1 2 233.315 2.070 20 0 BEADLO CC(C)N(C(=O)C=Cc1c[nH]c[nH+]1)C1CCC1 ZINC000492772547 528766795 /nfs/dbraw/zinc/76/67/95/528766795.db2.gz SYSGPNYQIWBDRZ-VOTSOKGWSA-N 1 2 233.315 2.212 20 0 BEADLO CC1(C)CCCN(C(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000492871807 528923525 /nfs/dbraw/zinc/92/35/25/528923525.db2.gz YBUIWYOMPAMDJR-PLNGDYQASA-N 1 2 247.342 2.462 20 0 BEADLO CC(C)[C@H](C)N(C(=O)/C=C/c1[nH]cc[nH+]1)C1CC1 ZINC000493363373 528951055 /nfs/dbraw/zinc/95/10/55/528951055.db2.gz CBSMNTDHFXMDBM-MLRMMBSGSA-N 1 2 247.342 2.458 20 0 BEADLO CC1(C)CCC[C@@H]1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492775016 528965158 /nfs/dbraw/zinc/96/51/58/528965158.db2.gz XNGXURAJEXHTOU-GZTOBOFZSA-N 1 2 233.315 2.118 20 0 BEADLO CC1(C)CCC[C@H]1CNC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493082370 528987242 /nfs/dbraw/zinc/98/72/42/528987242.db2.gz KQNVEMRDBFPEGU-QRGHLMKCSA-N 1 2 247.342 2.365 20 0 BEADLO CC1(C)CCC[C@H]1NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493416391 528988806 /nfs/dbraw/zinc/98/88/06/528988806.db2.gz IBHUPKOWWXOMFG-BRAIEQGRSA-N 1 2 233.315 2.118 20 0 BEADLO CC1(C)CCN(C(=O)/C=C/c2[nH]cc[nH+]2)CC1 ZINC000493620273 529001376 /nfs/dbraw/zinc/00/13/76/529001376.db2.gz QQWNIZVVDAUIDF-ONEGZZNKSA-N 1 2 233.315 2.072 20 0 BEADLO CC1(C)CCN(C(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000493748452 529001558 /nfs/dbraw/zinc/00/15/58/529001558.db2.gz COCYRYRUHCXVFR-ARJAWSKDSA-N 1 2 233.315 2.072 20 0 BEADLO CC1(C)CC[C@H](NC(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493805555 529045800 /nfs/dbraw/zinc/04/58/00/529045800.db2.gz VKHAOYIFWWDKBK-FSIBCCDJSA-N 1 2 233.315 2.118 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492774157 529342204 /nfs/dbraw/zinc/34/22/04/529342204.db2.gz WKPQUNGEZAIZJE-VYELJELPSA-N 1 2 233.315 2.212 20 0 BEADLO CC(C)c1nnc(C[NH+]2CCCCC2)o1 ZINC000334441564 534971396 /nfs/dbraw/zinc/97/13/96/534971396.db2.gz BSQJWVYXAWYXKB-UHFFFAOYSA-N 1 2 209.293 2.179 20 0 BEADLO CC1(CC(=O)Nc2cccc3[nH+]ccn32)CC1 ZINC000336115516 535111814 /nfs/dbraw/zinc/11/18/14/535111814.db2.gz KDVHIKVATHRGKN-UHFFFAOYSA-N 1 2 229.283 2.463 20 0 BEADLO CCCCc1noc([C@@H](C)[N@H+](C)CCOC)n1 ZINC000077408602 535123730 /nfs/dbraw/zinc/12/37/30/535123730.db2.gz XKRBBTNYFUBSIE-SNVBAGLBSA-N 1 2 241.335 2.051 20 0 BEADLO CCCCc1noc([C@@H](C)[N@@H+](C)CCOC)n1 ZINC000077408602 535123735 /nfs/dbraw/zinc/12/37/35/535123735.db2.gz XKRBBTNYFUBSIE-SNVBAGLBSA-N 1 2 241.335 2.051 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCO[C@H](C)[C@H]1C ZINC000335307950 535146776 /nfs/dbraw/zinc/14/67/76/535146776.db2.gz VYSGKFPBKAXGRB-VXGBXAGGSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCO[C@H](C)[C@H]1C ZINC000335307950 535146780 /nfs/dbraw/zinc/14/67/80/535146780.db2.gz VYSGKFPBKAXGRB-VXGBXAGGSA-N 1 2 237.347 2.073 20 0 BEADLO CC[C@@H](C)C(=O)NCCCCNc1cccc[nH+]1 ZINC000078493514 535461163 /nfs/dbraw/zinc/46/11/63/535461163.db2.gz KZHATMKZSUXUOB-GFCCVEGCSA-N 1 2 249.358 2.436 20 0 BEADLO CCOc1cccc(C[NH2+][C@@H](C)c2ccon2)n1 ZINC000349206157 535462208 /nfs/dbraw/zinc/46/22/08/535462208.db2.gz XVOYRKPILCOKHQ-JTQLQIEISA-N 1 2 247.298 2.319 20 0 BEADLO CC[C@@H](C)CNc1ccc(N2CCOCC2)[nH+]c1 ZINC000037075995 535526990 /nfs/dbraw/zinc/52/69/90/535526990.db2.gz AVMZTKRNHHKGBT-GFCCVEGCSA-N 1 2 249.358 2.376 20 0 BEADLO CN(C(=O)C(C)(C)c1c[nH+]c[nH]1)C1CC(C)(C)C1 ZINC000335130972 535956378 /nfs/dbraw/zinc/95/63/78/535956378.db2.gz OIAOTQKEKPYURN-UHFFFAOYSA-N 1 2 249.358 2.334 20 0 BEADLO C[NH+](C)Cc1nc([C@H]2CCc3ccccc32)no1 ZINC000336182201 536063709 /nfs/dbraw/zinc/06/37/09/536063709.db2.gz PCCXSTHQPUYPBW-LBPRGKRZSA-N 1 2 243.310 2.209 20 0 BEADLO CCc1nc(N2C[C@H](C)O[C@H](C)[C@@H]2C)cc(C)[nH+]1 ZINC000342959624 536126673 /nfs/dbraw/zinc/12/66/73/536126673.db2.gz KVWUWISCXJNTTK-SDDRHHMPSA-N 1 2 249.358 2.350 20 0 BEADLO CCc1ccc(C[N@H+]2CCOC[C@@H]2CC)cn1 ZINC000347659799 536177544 /nfs/dbraw/zinc/17/75/44/536177544.db2.gz XLJAPEMRTTUWOQ-AWEZNQCLSA-N 1 2 234.343 2.255 20 0 BEADLO CCc1ccc(C[N@@H+]2CCOC[C@@H]2CC)cn1 ZINC000347659799 536177545 /nfs/dbraw/zinc/17/75/45/536177545.db2.gz XLJAPEMRTTUWOQ-AWEZNQCLSA-N 1 2 234.343 2.255 20 0 BEADLO CSC[C@@H](C)Nc1cccc([C@H](C)O)[nH+]1 ZINC000892604071 582926630 /nfs/dbraw/zinc/92/66/30/582926630.db2.gz XPYNAQRGBPPVCG-BDAKNGLRSA-N 1 2 226.345 2.298 20 0 BEADLO C[N@H+](CCC(=O)c1ccccc1)Cc1cc[nH]n1 ZINC000348125178 536314188 /nfs/dbraw/zinc/31/41/88/536314188.db2.gz XPGKRKIQSISNRH-UHFFFAOYSA-N 1 2 243.310 2.115 20 0 BEADLO C[N@@H+](CCC(=O)c1ccccc1)Cc1cc[nH]n1 ZINC000348125178 536314191 /nfs/dbraw/zinc/31/41/91/536314191.db2.gz XPGKRKIQSISNRH-UHFFFAOYSA-N 1 2 243.310 2.115 20 0 BEADLO CN(c1cc(N2CCCC2)[nH+]cn1)C1CCC1 ZINC000342300988 536487984 /nfs/dbraw/zinc/48/79/84/536487984.db2.gz YMOBBDKSHFQHPJ-UHFFFAOYSA-N 1 2 232.331 2.066 20 0 BEADLO CN(c1cc(N2CCCC2)nc[nH+]1)C1CCC1 ZINC000342300988 536487985 /nfs/dbraw/zinc/48/79/85/536487985.db2.gz YMOBBDKSHFQHPJ-UHFFFAOYSA-N 1 2 232.331 2.066 20 0 BEADLO CO[C@@H]1CN(c2nc(C)[nH+]c(C)c2C)CC[C@H]1C ZINC000302570369 536739268 /nfs/dbraw/zinc/73/92/68/536739268.db2.gz QIWLAEPBUDKNPO-NOZJJQNGSA-N 1 2 249.358 2.263 20 0 BEADLO COC1CCN(c2cc(C)[nH+]c(C3CC3)n2)CC1 ZINC000265404419 536756511 /nfs/dbraw/zinc/75/65/11/536756511.db2.gz ZDEXJYSLWJTNMT-UHFFFAOYSA-N 1 2 247.342 2.278 20 0 BEADLO Cc1cnc(C[NH2+]Cc2sc(C)nc2C)o1 ZINC000235958558 537907965 /nfs/dbraw/zinc/90/79/65/537907965.db2.gz CVFSUEIRDAYLJP-UHFFFAOYSA-N 1 2 237.328 2.346 20 0 BEADLO Cc1csc(C[N@@H+](C)Cc2c[nH]nc2C)n1 ZINC000093336513 538109907 /nfs/dbraw/zinc/10/99/07/538109907.db2.gz VNDFSCIWBLRTMP-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1csc(C[N@H+](C)Cc2c[nH]nc2C)n1 ZINC000093336513 538109908 /nfs/dbraw/zinc/10/99/08/538109908.db2.gz VNDFSCIWBLRTMP-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO CCC(F)(F)COC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000851493192 582960233 /nfs/dbraw/zinc/96/02/33/582960233.db2.gz MGWWGJMNGGIZJU-SECBINFHSA-N 1 2 246.257 2.423 20 0 BEADLO c1cc(-c2noc(CCc3c[nH]c[nH+]3)n2)cs1 ZINC000438834850 566372642 /nfs/dbraw/zinc/37/26/42/566372642.db2.gz VDHTWJLMGJZXBP-UHFFFAOYSA-N 1 2 246.295 2.306 20 0 BEADLO c1cc(-c2noc(CCc3c[nH+]c[nH]3)n2)cs1 ZINC000438834850 566372647 /nfs/dbraw/zinc/37/26/47/566372647.db2.gz VDHTWJLMGJZXBP-UHFFFAOYSA-N 1 2 246.295 2.306 20 0 BEADLO CC(C)c1c[nH]c(CN2CCOCC2(C)C)[nH+]1 ZINC000893969335 583264076 /nfs/dbraw/zinc/26/40/76/583264076.db2.gz LMAKGIDSFKVDAV-UHFFFAOYSA-N 1 2 237.347 2.144 20 0 BEADLO CCOC(=O)C[N@H+](Cc1cc(C)co1)C(C)C ZINC000893967514 583264082 /nfs/dbraw/zinc/26/40/82/583264082.db2.gz NMBRLYQRPWURIT-UHFFFAOYSA-N 1 2 239.315 2.362 20 0 BEADLO CCOC(=O)C[N@@H+](Cc1cc(C)co1)C(C)C ZINC000893967514 583264083 /nfs/dbraw/zinc/26/40/83/583264083.db2.gz NMBRLYQRPWURIT-UHFFFAOYSA-N 1 2 239.315 2.362 20 0 BEADLO CCc1cc(N2CC[C@@H](F)C2)nc(CC)[nH+]1 ZINC000894023699 583280369 /nfs/dbraw/zinc/28/03/69/583280369.db2.gz RXFOIXOQUVDPSA-SECBINFHSA-N 1 2 223.295 2.150 20 0 BEADLO CSc1ccc(C[N@H+](C)Cc2cn[nH]c2)o1 ZINC000894028935 583281335 /nfs/dbraw/zinc/28/13/35/583281335.db2.gz VDANRPOOIFYBIB-UHFFFAOYSA-N 1 2 237.328 2.357 20 0 BEADLO CSc1ccc(C[N@@H+](C)Cc2cn[nH]c2)o1 ZINC000894028935 583281339 /nfs/dbraw/zinc/28/13/39/583281339.db2.gz VDANRPOOIFYBIB-UHFFFAOYSA-N 1 2 237.328 2.357 20 0 BEADLO FC(F)(F)c1ccn(C[N@@H+]2CC[C@H]3C[C@H]3C2)n1 ZINC000853579111 588749539 /nfs/dbraw/zinc/74/95/39/588749539.db2.gz LOYRTLOTOJFHAO-IUCAKERBSA-N 1 2 245.248 2.201 20 0 BEADLO FC(F)(F)c1ccn(C[N@H+]2CC[C@H]3C[C@H]3C2)n1 ZINC000853579111 588749540 /nfs/dbraw/zinc/74/95/40/588749540.db2.gz LOYRTLOTOJFHAO-IUCAKERBSA-N 1 2 245.248 2.201 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@H]2CCC2(C)C)c1 ZINC000853623092 588750669 /nfs/dbraw/zinc/75/06/69/588750669.db2.gz NTOZAEWDCKHVAY-NSHDSACASA-N 1 2 248.326 2.398 20 0 BEADLO CC(C)OCC(N)=[NH+]OCCCC1CCC1 ZINC000853657453 588753074 /nfs/dbraw/zinc/75/30/74/588753074.db2.gz BNODUBFNDZTRBQ-UHFFFAOYSA-N 1 2 228.336 2.490 20 0 BEADLO CC(C)(C)OCC(N)=[NH+]OCC1CC=CC1 ZINC000853688542 588756653 /nfs/dbraw/zinc/75/66/53/588756653.db2.gz QBKJUELEJFDTGY-UHFFFAOYSA-N 1 2 226.320 2.266 20 0 BEADLO CCC(C)(C)CCO[NH+]=C(N)[C@H]1CCCO1 ZINC000853697071 588757520 /nfs/dbraw/zinc/75/75/20/588757520.db2.gz DVBIEZXMFWDKKQ-SNVBAGLBSA-N 1 2 228.336 2.490 20 0 BEADLO Cc1[nH+]c2cc(OCCC3(O)CC3)ccc2n1C ZINC000853706166 588758220 /nfs/dbraw/zinc/75/82/20/588758220.db2.gz JCUPKEYWHLMUCZ-UHFFFAOYSA-N 1 2 246.310 2.176 20 0 BEADLO CC(C)c1nc(N[C@@H]2C[C@@H](O)C23CCC3)cc[nH+]1 ZINC000853870247 588766762 /nfs/dbraw/zinc/76/67/62/588766762.db2.gz JLWLTAVRYJEEDW-GHMZBOCLSA-N 1 2 247.342 2.315 20 0 BEADLO CC(C)c1nc(N[C@@H]2C[C@H](O)C23CCC3)cc[nH+]1 ZINC000853870248 588766771 /nfs/dbraw/zinc/76/67/71/588766771.db2.gz JLWLTAVRYJEEDW-MNOVXSKESA-N 1 2 247.342 2.315 20 0 BEADLO CC1(C)C[N@H+](CCF)[C@H]1c1ccncc1 ZINC000854041009 588771226 /nfs/dbraw/zinc/77/12/26/588771226.db2.gz XOPZQVNYYRZKRL-NSHDSACASA-N 1 2 208.280 2.434 20 0 BEADLO CC1(C)C[N@@H+](CCF)[C@H]1c1ccncc1 ZINC000854041009 588771227 /nfs/dbraw/zinc/77/12/27/588771227.db2.gz XOPZQVNYYRZKRL-NSHDSACASA-N 1 2 208.280 2.434 20 0 BEADLO CC1(C)C[N@H+](CCF)[C@@H]1c1cccnc1 ZINC000854042017 588772366 /nfs/dbraw/zinc/77/23/66/588772366.db2.gz UWIOJYXHFUYXKO-LLVKDONJSA-N 1 2 208.280 2.434 20 0 BEADLO CC1(C)C[N@@H+](CCF)[C@@H]1c1cccnc1 ZINC000854042017 588772367 /nfs/dbraw/zinc/77/23/67/588772367.db2.gz UWIOJYXHFUYXKO-LLVKDONJSA-N 1 2 208.280 2.434 20 0 BEADLO CC[NH2+]Cc1noc(Cc2cc(C)cc(C)c2)n1 ZINC000854132060 588775724 /nfs/dbraw/zinc/77/57/24/588775724.db2.gz JTJXNJQTVIHILQ-UHFFFAOYSA-N 1 2 245.326 2.387 20 0 BEADLO O=C(NC1=[NH+]CCS1)[C@H]1CCCC2(CC2)C1 ZINC000854293329 588782876 /nfs/dbraw/zinc/78/28/76/588782876.db2.gz QXDBNANROQUITG-VIFPVBQESA-N 1 2 238.356 2.176 20 0 BEADLO CC1=CC[C@](C)(C(=O)NCc2c[nH+]cn2C)CC1 ZINC000854499017 588789549 /nfs/dbraw/zinc/78/95/49/588789549.db2.gz PUGHUKMXWHJVIT-AWEZNQCLSA-N 1 2 247.342 2.173 20 0 BEADLO CC[C@@H]1CCCC[C@H]1CNC(=O)Cc1[nH]cc[nH+]1 ZINC000854741177 588804866 /nfs/dbraw/zinc/80/48/66/588804866.db2.gz KEAYUZRFSQKQOM-NEPJUHHUSA-N 1 2 249.358 2.285 20 0 BEADLO CC(C)[C@@H]1CN(C(=O)Cc2[nH]cc[nH+]2)[C@@H]1C(C)C ZINC000854827285 588812272 /nfs/dbraw/zinc/81/22/72/588812272.db2.gz IAKFPKPFVXETOA-SMDDNHRTSA-N 1 2 249.358 2.091 20 0 BEADLO C[C@H]1CCCC[C@]1(C)NC(=O)Cc1[nH]cc[nH+]1 ZINC000854902465 588816165 /nfs/dbraw/zinc/81/61/65/588816165.db2.gz DUODNIZEIZZTLZ-GWCFXTLKSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)[C@@H]2CCC2(C)C)S1 ZINC000854989188 588819856 /nfs/dbraw/zinc/81/98/56/588819856.db2.gz ABEQTQMWRGVRFV-SFYZADRCSA-N 1 2 226.345 2.030 20 0 BEADLO C[C@H]1CC/C(=C/C(=O)N(C)Cc2c[nH+]c[nH]2)C1 ZINC000855134171 588822640 /nfs/dbraw/zinc/82/26/40/588822640.db2.gz HNVSSYNUZTYHTG-OYUORYAFSA-N 1 2 233.315 2.115 20 0 BEADLO C[C@H]1CC/C(=C/C(=O)N(C)Cc2c[nH]c[nH+]2)C1 ZINC000855134171 588822641 /nfs/dbraw/zinc/82/26/41/588822641.db2.gz HNVSSYNUZTYHTG-OYUORYAFSA-N 1 2 233.315 2.115 20 0 BEADLO Nc1cc(COC(=O)CCCC2CC2)cc[nH+]1 ZINC000812602393 582555159 /nfs/dbraw/zinc/55/51/59/582555159.db2.gz RVDBNTHHJQLWBO-UHFFFAOYSA-N 1 2 234.299 2.287 20 0 BEADLO C/C=C(/C)C(=O)NCc1c(C)[nH+]c2ccccn21 ZINC000890853964 582581026 /nfs/dbraw/zinc/58/10/26/582581026.db2.gz XAVQRALISDRLEA-WMZJFQQLSA-N 1 2 243.310 2.225 20 0 BEADLO C[C@H]1C[C@H](C)CN(c2nccn3c[nH+]cc23)C1 ZINC000891405033 582679160 /nfs/dbraw/zinc/67/91/60/582679160.db2.gz AKEYWZLPEPAGKB-QWRGUYRKSA-N 1 2 230.315 2.212 20 0 BEADLO CC[C@H](CO)Nc1cc(C)[nH+]c(C2CCC2)n1 ZINC000891412875 582680597 /nfs/dbraw/zinc/68/05/97/582680597.db2.gz GPKZTJUNQVRNJK-LLVKDONJSA-N 1 2 235.331 2.235 20 0 BEADLO COC1CCC(C[N@H+](C)CC(F)F)CC1 ZINC000891811901 582725194 /nfs/dbraw/zinc/72/51/94/582725194.db2.gz JEDSTKWXWIUEHK-UHFFFAOYSA-N 1 2 221.291 2.389 20 0 BEADLO COC1CCC(C[N@@H+](C)CC(F)F)CC1 ZINC000891811901 582725196 /nfs/dbraw/zinc/72/51/96/582725196.db2.gz JEDSTKWXWIUEHK-UHFFFAOYSA-N 1 2 221.291 2.389 20 0 BEADLO C[C@H](Nc1cc(N(C)C)nc[nH+]1)c1ccccn1 ZINC000891491884 582692118 /nfs/dbraw/zinc/69/21/18/582692118.db2.gz CRNRAISXSSLZAZ-JTQLQIEISA-N 1 2 243.314 2.111 20 0 BEADLO C[C@H](Nc1cc(N(C)C)[nH+]cn1)c1ccccn1 ZINC000891491884 582692120 /nfs/dbraw/zinc/69/21/20/582692120.db2.gz CRNRAISXSSLZAZ-JTQLQIEISA-N 1 2 243.314 2.111 20 0 BEADLO CCOc1ccc(C[N@@H+]2C[C@@H](C)OC[C@H]2C)o1 ZINC000891672347 582708948 /nfs/dbraw/zinc/70/89/48/582708948.db2.gz VRZAPJGYGXPWFW-GHMZBOCLSA-N 1 2 239.315 2.288 20 0 BEADLO CCOc1ccc(C[N@H+]2C[C@@H](C)OC[C@H]2C)o1 ZINC000891672347 582708951 /nfs/dbraw/zinc/70/89/51/582708951.db2.gz VRZAPJGYGXPWFW-GHMZBOCLSA-N 1 2 239.315 2.288 20 0 BEADLO COc1cccc2c[nH+]c(N[C@@H](C)CO)cc21 ZINC000891684066 582709733 /nfs/dbraw/zinc/70/97/33/582709733.db2.gz FKEITQYURVHUFQ-VIFPVBQESA-N 1 2 232.283 2.036 20 0 BEADLO Cc1cc(C[N@@H+]2CCOCC2(C)C)cnc1F ZINC000891777445 582719432 /nfs/dbraw/zinc/71/94/32/582719432.db2.gz BBPHBQFZDKBSOJ-UHFFFAOYSA-N 1 2 238.306 2.140 20 0 BEADLO Cc1cc(C[N@H+]2CCOCC2(C)C)cnc1F ZINC000891777445 582719433 /nfs/dbraw/zinc/71/94/33/582719433.db2.gz BBPHBQFZDKBSOJ-UHFFFAOYSA-N 1 2 238.306 2.140 20 0 BEADLO C[N@@H+](Cc1nccn1C1CC1)C[C@H]1CCCCO1 ZINC000891787157 582721381 /nfs/dbraw/zinc/72/13/81/582721381.db2.gz QPILDJYANNQOLI-CYBMUJFWSA-N 1 2 249.358 2.219 20 0 BEADLO C[N@H+](Cc1nccn1C1CC1)C[C@H]1CCCCO1 ZINC000891787157 582721383 /nfs/dbraw/zinc/72/13/83/582721383.db2.gz QPILDJYANNQOLI-CYBMUJFWSA-N 1 2 249.358 2.219 20 0 BEADLO CC[N@@H+](Cc1cnn(C)c1)Cc1ccc(OC)o1 ZINC000891791872 582722551 /nfs/dbraw/zinc/72/25/51/582722551.db2.gz CDNAOXFPRSBOCP-UHFFFAOYSA-N 1 2 249.314 2.044 20 0 BEADLO CC[N@H+](Cc1cnn(C)c1)Cc1ccc(OC)o1 ZINC000891791872 582722553 /nfs/dbraw/zinc/72/25/53/582722553.db2.gz CDNAOXFPRSBOCP-UHFFFAOYSA-N 1 2 249.314 2.044 20 0 BEADLO COc1ccc(C[N@@H+]2C[C@@H](C)OC(C)(C)C2)o1 ZINC000891797938 582723426 /nfs/dbraw/zinc/72/34/26/582723426.db2.gz MHZDFTLKVOLDOM-SNVBAGLBSA-N 1 2 239.315 2.288 20 0 BEADLO COc1ccc(C[N@H+]2C[C@@H](C)OC(C)(C)C2)o1 ZINC000891797938 582723428 /nfs/dbraw/zinc/72/34/28/582723428.db2.gz MHZDFTLKVOLDOM-SNVBAGLBSA-N 1 2 239.315 2.288 20 0 BEADLO CN(Cc1cscn1)Cc1[nH+]ccn1C1CC1 ZINC000891814670 582724964 /nfs/dbraw/zinc/72/49/64/582724964.db2.gz PABGBMPTPOCWKH-UHFFFAOYSA-N 1 2 248.355 2.307 20 0 BEADLO CCOCC[N@H+](CC)Cc1nccn1C1CC1 ZINC000891818261 582725905 /nfs/dbraw/zinc/72/59/05/582725905.db2.gz JUPOFBSAPPEBBW-UHFFFAOYSA-N 1 2 237.347 2.076 20 0 BEADLO CCOCC[N@@H+](CC)Cc1nccn1C1CC1 ZINC000891818261 582725908 /nfs/dbraw/zinc/72/59/08/582725908.db2.gz JUPOFBSAPPEBBW-UHFFFAOYSA-N 1 2 237.347 2.076 20 0 BEADLO C[C@H](O)c1cccc(NC[C@@H]2C[C@@H]2C)[nH+]1 ZINC000891824411 582726716 /nfs/dbraw/zinc/72/67/16/582726716.db2.gz BVLVNPYBKBKYSN-GUBZILKMSA-N 1 2 206.289 2.203 20 0 BEADLO Cc1ccc(CNc2cccc([C@H](C)O)[nH+]2)cn1 ZINC000891871893 582732836 /nfs/dbraw/zinc/73/28/36/582732836.db2.gz XSNPUOINWRPFRE-NSHDSACASA-N 1 2 243.310 2.450 20 0 BEADLO Cc1noc(C)c1CNc1cccc([C@H](C)O)[nH+]1 ZINC000892000328 582758274 /nfs/dbraw/zinc/75/82/74/582758274.db2.gz OUUQIJRKWAKAGK-VIFPVBQESA-N 1 2 247.298 2.352 20 0 BEADLO C[C@H](O)CN(C)c1cc(C2CC2)[nH+]c(C2CC2)n1 ZINC000892004637 582759707 /nfs/dbraw/zinc/75/97/07/582759707.db2.gz JZVXAFQEHINYIE-VIFPVBQESA-N 1 2 247.342 2.048 20 0 BEADLO CC(C)[C@@H](C)N(C)c1nccn2c[nH+]cc12 ZINC000892010538 582760835 /nfs/dbraw/zinc/76/08/35/582760835.db2.gz WDXOCOYENNTFLL-SNVBAGLBSA-N 1 2 218.304 2.210 20 0 BEADLO CC(C)[C@H]1CCCN1c1nccn2c[nH+]cc12 ZINC000892010207 582761004 /nfs/dbraw/zinc/76/10/04/582761004.db2.gz RIDMSQYIWGIZLR-LLVKDONJSA-N 1 2 230.315 2.354 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCO[C@H](C)[C@H]2C)o1 ZINC000892047787 582773167 /nfs/dbraw/zinc/77/31/67/582773167.db2.gz BYTHELFGMVMSEX-GHMZBOCLSA-N 1 2 239.315 2.288 20 0 BEADLO CCOc1ccc(C[N@H+]2CCO[C@H](C)[C@H]2C)o1 ZINC000892047787 582773168 /nfs/dbraw/zinc/77/31/68/582773168.db2.gz BYTHELFGMVMSEX-GHMZBOCLSA-N 1 2 239.315 2.288 20 0 BEADLO CCn1cc(C[N@H+](C)Cc2ccc(OC)o2)cn1 ZINC000892049638 582774976 /nfs/dbraw/zinc/77/49/76/582774976.db2.gz KNXNQUMCXVLIRS-UHFFFAOYSA-N 1 2 249.314 2.137 20 0 BEADLO CCn1cc(C[N@@H+](C)Cc2ccc(OC)o2)cn1 ZINC000892049638 582774978 /nfs/dbraw/zinc/77/49/78/582774978.db2.gz KNXNQUMCXVLIRS-UHFFFAOYSA-N 1 2 249.314 2.137 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2ccc(OC)o2)CCO1 ZINC000892068185 582785223 /nfs/dbraw/zinc/78/52/23/582785223.db2.gz GPLHAQWSGJMANO-LLVKDONJSA-N 1 2 239.315 2.289 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2ccc(OC)o2)CCO1 ZINC000892068185 582785225 /nfs/dbraw/zinc/78/52/25/582785225.db2.gz GPLHAQWSGJMANO-LLVKDONJSA-N 1 2 239.315 2.289 20 0 BEADLO C[N@H+](CCOCC1CC1)Cc1nccn1C1CC1 ZINC000892158455 582803650 /nfs/dbraw/zinc/80/36/50/582803650.db2.gz BJJXIRNOTDLCRX-UHFFFAOYSA-N 1 2 249.358 2.076 20 0 BEADLO C[N@@H+](CCOCC1CC1)Cc1nccn1C1CC1 ZINC000892158455 582803651 /nfs/dbraw/zinc/80/36/51/582803651.db2.gz BJJXIRNOTDLCRX-UHFFFAOYSA-N 1 2 249.358 2.076 20 0 BEADLO CCc1cc(N(C)C[C@@H]2CCCO2)nc(CC)[nH+]1 ZINC000892270466 582823598 /nfs/dbraw/zinc/82/35/98/582823598.db2.gz HEXQTCDJBCRYDU-LBPRGKRZSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@H]1CCC[C@H]1Nc1cc(N(C)C)nc[nH+]1 ZINC000892341669 582861665 /nfs/dbraw/zinc/86/16/65/582861665.db2.gz DFKQYGBMYARQCB-VHSXEESVSA-N 1 2 220.320 2.143 20 0 BEADLO C[C@H]1CCC[C@H]1Nc1cc(N(C)C)[nH+]cn1 ZINC000892341669 582861666 /nfs/dbraw/zinc/86/16/66/582861666.db2.gz DFKQYGBMYARQCB-VHSXEESVSA-N 1 2 220.320 2.143 20 0 BEADLO CCc1nnc(C[N@@H+]2CC[C@@H]2C(C)C)s1 ZINC000892403068 582876680 /nfs/dbraw/zinc/87/66/80/582876680.db2.gz JXFNFFBJLAZLHE-SECBINFHSA-N 1 2 225.361 2.331 20 0 BEADLO CCc1nnc(C[N@H+]2CC[C@@H]2C(C)C)s1 ZINC000892403068 582876682 /nfs/dbraw/zinc/87/66/82/582876682.db2.gz JXFNFFBJLAZLHE-SECBINFHSA-N 1 2 225.361 2.331 20 0 BEADLO Cc1cc(N[C@H](CO)C2CC2)nc(C2CCC2)[nH+]1 ZINC000892545714 582909504 /nfs/dbraw/zinc/90/95/04/582909504.db2.gz QWBQDTFRIOYNNO-GFCCVEGCSA-N 1 2 247.342 2.235 20 0 BEADLO CSC[C@@H](C)Nc1cccc([C@@H](C)O)[nH+]1 ZINC000892604074 582926664 /nfs/dbraw/zinc/92/66/64/582926664.db2.gz XPYNAQRGBPPVCG-RKDXNWHRSA-N 1 2 226.345 2.298 20 0 BEADLO CCc1cc(N[C@@H](CC)COC)nc(CC)[nH+]1 ZINC000892620549 582932186 /nfs/dbraw/zinc/93/21/86/582932186.db2.gz CBPVPYISTVIFPZ-NSHDSACASA-N 1 2 237.347 2.438 20 0 BEADLO Cn1cc(CNc2cccc[nH+]2)c(C2CC2)n1 ZINC000892636050 582934982 /nfs/dbraw/zinc/93/49/82/582934982.db2.gz CDEKKVOBXOBOOV-UHFFFAOYSA-N 1 2 228.299 2.305 20 0 BEADLO Cc1cc(F)ncc1C[NH2+]Cc1nccs1 ZINC000892640899 582936071 /nfs/dbraw/zinc/93/60/71/582936071.db2.gz MKZYVPSEALRATQ-UHFFFAOYSA-N 1 2 237.303 2.275 20 0 BEADLO C[C@H](CNC(=O)Cc1[nH]cc[nH+]1)C1CCCCC1 ZINC000856226323 588864946 /nfs/dbraw/zinc/86/49/46/588864946.db2.gz GNXHYCNJTALKTJ-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1CC[C@@H]1Nc1ccc(N2CCOCC2)c[nH+]1 ZINC000783279635 582955480 /nfs/dbraw/zinc/95/54/80/582955480.db2.gz YTYKCIMIVIHMTL-YPMHNXCESA-N 1 2 247.342 2.129 20 0 BEADLO C[C@H](NC(=O)C=C1CCCCC1)c1[nH+]ccn1C ZINC000856277685 588866553 /nfs/dbraw/zinc/86/65/53/588866553.db2.gz OLYLFEZUESTNBP-NSHDSACASA-N 1 2 247.342 2.488 20 0 BEADLO C[C@H](CC(=O)N[C@H](C)c1[nH+]ccn1C)C1CC1 ZINC000856278116 588866585 /nfs/dbraw/zinc/86/65/85/588866585.db2.gz XUFIRLVKTZCYHC-NXEZZACHSA-N 1 2 235.331 2.034 20 0 BEADLO C[C@@H](CC(=O)N[C@@H](C)c1[nH+]ccn1C)C1CC1 ZINC000856278117 588866683 /nfs/dbraw/zinc/86/66/83/588866683.db2.gz XUFIRLVKTZCYHC-UWVGGRQHSA-N 1 2 235.331 2.034 20 0 BEADLO Cc1cnc(CNc2cccc([C@H](C)O)[nH+]2)o1 ZINC000892747663 582975015 /nfs/dbraw/zinc/97/50/15/582975015.db2.gz DHJWEJBODFVICQ-VIFPVBQESA-N 1 2 233.271 2.043 20 0 BEADLO C[C@@H](NC(=O)/C=C/C1CCCC1)c1[nH+]ccn1C ZINC000856280913 588866772 /nfs/dbraw/zinc/86/67/72/588866772.db2.gz ZRFVIRHRWAYVEM-WSKFYRRCSA-N 1 2 247.342 2.344 20 0 BEADLO CC/C(C)=C(/C)C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000856281385 588866781 /nfs/dbraw/zinc/86/67/81/588866781.db2.gz OBWJODKDMSNIAG-JUDLJHIGSA-N 1 2 235.331 2.344 20 0 BEADLO CCc1cc(N[C@H](CO)C(C)C)nc(CC)[nH+]1 ZINC000892843828 582993595 /nfs/dbraw/zinc/99/35/95/582993595.db2.gz BQBIUPNUZPVXKY-LLVKDONJSA-N 1 2 237.347 2.030 20 0 BEADLO CCc1cc(NC2(CO)CCCC2)nc(CC)[nH+]1 ZINC000892854313 582997057 /nfs/dbraw/zinc/99/70/57/582997057.db2.gz BPMRLVXXAOSZAY-UHFFFAOYSA-N 1 2 249.358 2.318 20 0 BEADLO C[C@H](O)c1cccc(NC2CC=CC2)[nH+]1 ZINC000892915729 583008458 /nfs/dbraw/zinc/00/84/58/583008458.db2.gz DIZVYURKVUVLFI-VIFPVBQESA-N 1 2 204.273 2.265 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cccc(F)n2)[C@H](C)CO1 ZINC000852211420 583009400 /nfs/dbraw/zinc/00/94/00/583009400.db2.gz JZZSCWFKSMBECR-PWSUYJOCSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cccc(F)n2)[C@H](C)CO1 ZINC000852211420 583009403 /nfs/dbraw/zinc/00/94/03/583009403.db2.gz JZZSCWFKSMBECR-PWSUYJOCSA-N 1 2 238.306 2.220 20 0 BEADLO Cc1cc(N[C@H]2CCOC2)nc(C2CCC2)[nH+]1 ZINC000892953879 583018281 /nfs/dbraw/zinc/01/82/81/583018281.db2.gz MOXZGMDYIWWLML-NSHDSACASA-N 1 2 233.315 2.253 20 0 BEADLO c1cc(-c2ccc(N[C@H]3CCOC3)[nH+]c2)ccn1 ZINC000892953930 583018626 /nfs/dbraw/zinc/01/86/26/583018626.db2.gz OHHJNYQEVPNVNP-ZDUSSCGKSA-N 1 2 241.294 2.344 20 0 BEADLO CC[C@H]([NH2+]Cc1nnc(C)s1)c1ccncc1 ZINC000893032439 583034595 /nfs/dbraw/zinc/03/45/95/583034595.db2.gz NVUFRBNWLZZDKA-NSHDSACASA-N 1 2 248.355 2.482 20 0 BEADLO COC1(C)CN(c2cc(C)[nH+]c(C3CCC3)n2)C1 ZINC000893061180 583038970 /nfs/dbraw/zinc/03/89/70/583038970.db2.gz XTCFRBKZVRMHSW-UHFFFAOYSA-N 1 2 247.342 2.278 20 0 BEADLO CCc1cc(NCC[C@@H]2CCOC2)nc(CC)[nH+]1 ZINC000893143613 583056141 /nfs/dbraw/zinc/05/61/41/583056141.db2.gz LXWMCFOIKIJTEP-LLVKDONJSA-N 1 2 249.358 2.440 20 0 BEADLO COc1ccc(CNc2ccc(N(C)C)c[nH+]2)o1 ZINC000893141695 583056397 /nfs/dbraw/zinc/05/63/97/583056397.db2.gz WIKFCXMXSXQMHL-UHFFFAOYSA-N 1 2 247.298 2.361 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@H]2c2ncc[nH]2)ccn1 ZINC000856732476 588875506 /nfs/dbraw/zinc/87/55/06/588875506.db2.gz RWHBTWIWNBQHOF-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@H]2c2ncc[nH]2)ccn1 ZINC000856732476 588875507 /nfs/dbraw/zinc/87/55/07/588875507.db2.gz RWHBTWIWNBQHOF-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO CCc1cc(N[C@H]2C[C@@H](O)C2(C)C)nc(CC)[nH+]1 ZINC000893264832 583080867 /nfs/dbraw/zinc/08/08/67/583080867.db2.gz HQQZWNSMZGMJGA-WDEREUQCSA-N 1 2 249.358 2.173 20 0 BEADLO CCc1cc(NCC2(CCO)CC2)nc(CC)[nH+]1 ZINC000893283863 583085161 /nfs/dbraw/zinc/08/51/61/583085161.db2.gz ZYVYIWXXMVPINA-UHFFFAOYSA-N 1 2 249.358 2.176 20 0 BEADLO Fc1cc(F)c(C[NH2+]Cc2cocn2)cc1F ZINC000397707965 583108078 /nfs/dbraw/zinc/10/80/78/583108078.db2.gz ATANXPINWNBGRD-UHFFFAOYSA-N 1 2 242.200 2.382 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1cn(C)nc1Cl ZINC000856789678 588877693 /nfs/dbraw/zinc/87/76/93/588877693.db2.gz NJNIZGGQFLFGJE-UHFFFAOYSA-N 1 2 239.706 2.265 20 0 BEADLO Cc1nn(C)c(C)c1C[NH2+][C@@H]1CCCC1(F)F ZINC000398162051 583121227 /nfs/dbraw/zinc/12/12/27/583121227.db2.gz CKRORLBOZHLNQT-LLVKDONJSA-N 1 2 243.301 2.314 20 0 BEADLO C[C@H](O)c1cccc(NC[C@H]2CCC=CO2)[nH+]1 ZINC000893367750 583127165 /nfs/dbraw/zinc/12/71/65/583127165.db2.gz LUEWWYNZJNYFKW-WDEREUQCSA-N 1 2 234.299 2.240 20 0 BEADLO CCOC(C)(C)CNc1cccc([C@H](C)O)[nH+]1 ZINC000893370544 583129429 /nfs/dbraw/zinc/12/94/29/583129429.db2.gz OJTFOIIREIKBRW-JTQLQIEISA-N 1 2 238.331 2.362 20 0 BEADLO FC1=CCC[N@H+](Cc2cn3ccnc3s2)C1 ZINC000893437314 583142956 /nfs/dbraw/zinc/14/29/56/583142956.db2.gz RMFXWUDOSJCAMB-UHFFFAOYSA-N 1 2 237.303 2.455 20 0 BEADLO FC1=CCC[N@@H+](Cc2cn3ccnc3s2)C1 ZINC000893437314 583142957 /nfs/dbraw/zinc/14/29/57/583142957.db2.gz RMFXWUDOSJCAMB-UHFFFAOYSA-N 1 2 237.303 2.455 20 0 BEADLO Cc1c[nH+]c2n1CC[C@H]2OC(=O)Cc1ccco1 ZINC000893522799 583156777 /nfs/dbraw/zinc/15/67/77/583156777.db2.gz FZDDXPZJGXHBPW-LLVKDONJSA-N 1 2 246.266 2.015 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cn(C)nc2Cl)C[C@H]1F ZINC000857035765 588882945 /nfs/dbraw/zinc/88/29/45/588882945.db2.gz BIKAZCPMCJYEIR-PSASIEDQSA-N 1 2 245.729 2.253 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cn(C)nc2Cl)C[C@H]1F ZINC000857035765 588882946 /nfs/dbraw/zinc/88/29/46/588882946.db2.gz BIKAZCPMCJYEIR-PSASIEDQSA-N 1 2 245.729 2.253 20 0 BEADLO Cc1coc(COC(=O)C[C@@H](C)n2cc[nH+]c2)c1 ZINC000893746173 583217167 /nfs/dbraw/zinc/21/71/67/583217167.db2.gz XIIRDFUJLZKCAN-LLVKDONJSA-N 1 2 248.282 2.479 20 0 BEADLO Cc1cc(N2CCCCN2)[nH+]c(C2CCC2)n1 ZINC000893834045 583227797 /nfs/dbraw/zinc/22/77/97/583227797.db2.gz VJIZHMRESJNNEB-UHFFFAOYSA-N 1 2 232.331 2.157 20 0 BEADLO CN(C)c1cc(N2CCC[C@H](C3CC3)C2)nc[nH+]1 ZINC000893882194 583240742 /nfs/dbraw/zinc/24/07/42/583240742.db2.gz GATKMBHRUMXOIG-LBPRGKRZSA-N 1 2 246.358 2.169 20 0 BEADLO CN(C)c1cc(N2CCC[C@H](C3CC3)C2)[nH+]cn1 ZINC000893882194 583240743 /nfs/dbraw/zinc/24/07/43/583240743.db2.gz GATKMBHRUMXOIG-LBPRGKRZSA-N 1 2 246.358 2.169 20 0 BEADLO CNc1cc(N2CCC[C@@H](C3CC3)C2)nc[nH+]1 ZINC000893883475 583241074 /nfs/dbraw/zinc/24/10/74/583241074.db2.gz LNJDWCPLIWTHMI-LLVKDONJSA-N 1 2 232.331 2.145 20 0 BEADLO CNc1cc(N2CCC[C@@H](C3CC3)C2)[nH+]cn1 ZINC000893883475 583241077 /nfs/dbraw/zinc/24/10/77/583241077.db2.gz LNJDWCPLIWTHMI-LLVKDONJSA-N 1 2 232.331 2.145 20 0 BEADLO C[C@@H]1CN(Cc2[nH+]ccn2C2CC2)[C@@H](C)[C@H](C)O1 ZINC000893888424 583244254 /nfs/dbraw/zinc/24/42/54/583244254.db2.gz IYDOIQJTMXRXML-WOPDTQHZSA-N 1 2 249.358 2.216 20 0 BEADLO CSc1ccc(C[N@@H+]2CCO[C@@H](C)C2)o1 ZINC000893917772 583246798 /nfs/dbraw/zinc/24/67/98/583246798.db2.gz XFCAQOLKLYHEFX-VIFPVBQESA-N 1 2 227.329 2.222 20 0 BEADLO CSc1ccc(C[N@H+]2CCO[C@@H](C)C2)o1 ZINC000893917772 583246800 /nfs/dbraw/zinc/24/68/00/583246800.db2.gz XFCAQOLKLYHEFX-VIFPVBQESA-N 1 2 227.329 2.222 20 0 BEADLO CSc1ccc(C[N@@H+]2CCO[C@H](C)C2)o1 ZINC000893917771 583246994 /nfs/dbraw/zinc/24/69/94/583246994.db2.gz XFCAQOLKLYHEFX-SECBINFHSA-N 1 2 227.329 2.222 20 0 BEADLO CSc1ccc(C[N@H+]2CCO[C@H](C)C2)o1 ZINC000893917771 583246996 /nfs/dbraw/zinc/24/69/96/583246996.db2.gz XFCAQOLKLYHEFX-SECBINFHSA-N 1 2 227.329 2.222 20 0 BEADLO CCc1cc(N[C@H](C)[C@H](C)OC)nc(CC)[nH+]1 ZINC000893917722 583247178 /nfs/dbraw/zinc/24/71/78/583247178.db2.gz XZWOKVLXFYUDKF-ZJUUUORDSA-N 1 2 237.347 2.437 20 0 BEADLO Cc1n[nH]c(C[N@@H+](C)Cc2c(C)noc2C)c1C ZINC000893961524 583256236 /nfs/dbraw/zinc/25/62/36/583256236.db2.gz BCUFOPAVZNOJTC-UHFFFAOYSA-N 1 2 248.330 2.263 20 0 BEADLO Cc1n[nH]c(C[N@H+](C)Cc2c(C)noc2C)c1C ZINC000893961524 583256238 /nfs/dbraw/zinc/25/62/38/583256238.db2.gz BCUFOPAVZNOJTC-UHFFFAOYSA-N 1 2 248.330 2.263 20 0 BEADLO CCN(c1cc(C)[nH+]c(C2CCC2)n1)[C@@H](C)CO ZINC000893990421 583265751 /nfs/dbraw/zinc/26/57/51/583265751.db2.gz KJKPMACEASDLOK-NSHDSACASA-N 1 2 249.358 2.260 20 0 BEADLO C[C@H](O)c1cccc(N2CCC[C@@](C)(F)C2)[nH+]1 ZINC000894004850 583272011 /nfs/dbraw/zinc/27/20/11/583272011.db2.gz AYRFFFJRPWZCBJ-GXFFZTMASA-N 1 2 238.306 2.463 20 0 BEADLO CCC[C@H](CNc1cccc([C@@H](C)O)[nH+]1)OC ZINC000894017126 583273331 /nfs/dbraw/zinc/27/33/31/583273331.db2.gz XUDAGIHUSIZNEZ-GHMZBOCLSA-N 1 2 238.331 2.362 20 0 BEADLO CC[N@H+](Cc1[nH]nc(C)c1C)Cc1ccccn1 ZINC000894022265 583274352 /nfs/dbraw/zinc/27/43/52/583274352.db2.gz XBDLDRVVLJCLFS-UHFFFAOYSA-N 1 2 244.342 2.444 20 0 BEADLO CC[N@@H+](Cc1[nH]nc(C)c1C)Cc1ccccn1 ZINC000894022265 583274353 /nfs/dbraw/zinc/27/43/53/583274353.db2.gz XBDLDRVVLJCLFS-UHFFFAOYSA-N 1 2 244.342 2.444 20 0 BEADLO CC[C@@H](CO)N(C)c1cc(C)[nH+]c(C2CCC2)n1 ZINC000894016026 583275585 /nfs/dbraw/zinc/27/55/85/583275585.db2.gz HIOIIMAIICODOH-LBPRGKRZSA-N 1 2 249.358 2.260 20 0 BEADLO Cc1[nH]nc(C[N@H+]2C[C@H](C)[C@H](C)C2)c1C ZINC000894034296 583278739 /nfs/dbraw/zinc/27/87/39/583278739.db2.gz PBALZDOQUJWZRS-DTORHVGOSA-N 1 2 207.321 2.114 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2C[C@H](C)[C@H](C)C2)c1C ZINC000894034296 583278742 /nfs/dbraw/zinc/27/87/42/583278742.db2.gz PBALZDOQUJWZRS-DTORHVGOSA-N 1 2 207.321 2.114 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)C1CC2(CC2)C1 ZINC000857140709 588890353 /nfs/dbraw/zinc/89/03/53/588890353.db2.gz KWXJNXBTBSHPJN-UHFFFAOYSA-N 1 2 241.294 2.463 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2C[C@H](C)C[C@@H]2C)c1C ZINC000894046350 583287895 /nfs/dbraw/zinc/28/78/95/583287895.db2.gz WGFYIVZTWBBUQV-BDAKNGLRSA-N 1 2 207.321 2.257 20 0 BEADLO Cc1[nH]nc(C[N@H+]2C[C@H](C)C[C@@H]2C)c1C ZINC000894046350 583287896 /nfs/dbraw/zinc/28/78/96/583287896.db2.gz WGFYIVZTWBBUQV-BDAKNGLRSA-N 1 2 207.321 2.257 20 0 BEADLO Cc1ccncc1CNc1cccc([C@@H](C)O)[nH+]1 ZINC000894074295 583297730 /nfs/dbraw/zinc/29/77/30/583297730.db2.gz MLVFAASBPRPZRK-LLVKDONJSA-N 1 2 243.310 2.450 20 0 BEADLO CC[C@H]1CC[N@@H+](Cc2n[nH]c(C)c2C)C1 ZINC000894087274 583298737 /nfs/dbraw/zinc/29/87/37/583298737.db2.gz AZOJRMQTGDGCBR-NSHDSACASA-N 1 2 207.321 2.258 20 0 BEADLO C[C@H](O)c1cccc(NC[C@@H]2CC[C@@H](C)O2)[nH+]1 ZINC000894152033 583319131 /nfs/dbraw/zinc/31/91/31/583319131.db2.gz HXUQVCDBKISYBP-VWYCJHECSA-N 1 2 236.315 2.114 20 0 BEADLO C[C@H](O)c1cccc(N[C@@H](C)c2ccn(C)n2)[nH+]1 ZINC000894168028 583324643 /nfs/dbraw/zinc/32/46/43/583324643.db2.gz PSCJNLWKAKHVAS-UWVGGRQHSA-N 1 2 246.314 2.042 20 0 BEADLO CC[C@@H]1OCC[C@H]1Nc1cccc([C@@H](C)O)[nH+]1 ZINC000894169301 583325108 /nfs/dbraw/zinc/32/51/08/583325108.db2.gz GGAANFCEPMHJRP-JLLWLGSASA-N 1 2 236.315 2.114 20 0 BEADLO COCCC1C[NH+](Cc2nc(Cl)cs2)C1 ZINC000877623727 583340085 /nfs/dbraw/zinc/34/00/85/583340085.db2.gz YJKZNPMMXLVMNZ-UHFFFAOYSA-N 1 2 246.763 2.265 20 0 BEADLO FCC[NH2+]Cc1csc(C(F)(F)F)n1 ZINC000894220857 583382260 /nfs/dbraw/zinc/38/22/60/583382260.db2.gz KDBZAAQQVLIJLW-UHFFFAOYSA-N 1 2 228.214 2.221 20 0 BEADLO c1[nH+]cn2ccnc(N3CC[C@@H](C4CCC4)C3)c12 ZINC000894226656 583383726 /nfs/dbraw/zinc/38/37/26/583383726.db2.gz MDIWTICUHIKRBE-GFCCVEGCSA-N 1 2 242.326 2.356 20 0 BEADLO CCC[C@H]([NH2+]Cc1c[nH]cn1)c1ccccn1 ZINC000894234025 583385582 /nfs/dbraw/zinc/38/55/82/583385582.db2.gz CNSWJINSHCBFCM-LBPRGKRZSA-N 1 2 230.315 2.436 20 0 BEADLO O=C1CCN1C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000857231489 588896931 /nfs/dbraw/zinc/89/69/31/588896931.db2.gz KNHGXBCBULERDU-ZDUSSCGKSA-N 1 2 248.301 2.152 20 0 BEADLO O=C1CCN1C[N@@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000857231489 588896933 /nfs/dbraw/zinc/89/69/33/588896933.db2.gz KNHGXBCBULERDU-ZDUSSCGKSA-N 1 2 248.301 2.152 20 0 BEADLO Cc1ncoc1C[N@@H+](C)Cc1ccc(C)cn1 ZINC000894540224 583481278 /nfs/dbraw/zinc/48/12/78/583481278.db2.gz FQZYWYCJYXGLRM-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ncoc1C[N@H+](C)Cc1ccc(C)cn1 ZINC000894540224 583481280 /nfs/dbraw/zinc/48/12/80/583481280.db2.gz FQZYWYCJYXGLRM-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CC[C@@H](O)CNc1ccc(-c2ccncc2)c[nH+]1 ZINC000894551123 583482544 /nfs/dbraw/zinc/48/25/44/583482544.db2.gz QLYURTLLJVJKDP-CYBMUJFWSA-N 1 2 243.310 2.326 20 0 BEADLO CN(Cc1ccc(Cl)o1)Cc1[nH]cc[nH+]1 ZINC000894583913 583489636 /nfs/dbraw/zinc/48/96/36/583489636.db2.gz LRVRVOWQBSWMQS-UHFFFAOYSA-N 1 2 225.679 2.288 20 0 BEADLO Cc1ncoc1C[N@@H+](C)Cc1cnccc1C ZINC000894617106 583495285 /nfs/dbraw/zinc/49/52/85/583495285.db2.gz AUIJFYFIEOFDSY-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ncoc1C[N@H+](C)Cc1cnccc1C ZINC000894617106 583495289 /nfs/dbraw/zinc/49/52/89/583495289.db2.gz AUIJFYFIEOFDSY-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cn1cc(C[NH2+]CC(C)(F)F)c(C2CC2)n1 ZINC000894623907 583496220 /nfs/dbraw/zinc/49/62/20/583496220.db2.gz HFMWBJIKXBHMMX-UHFFFAOYSA-N 1 2 229.274 2.042 20 0 BEADLO CC1C[C@H]2CC[C@@H](C1)N2c1nccn2c[nH+]cc12 ZINC000894624596 583496296 /nfs/dbraw/zinc/49/62/96/583496296.db2.gz VSKROOORUQMQHC-YOGCLGLASA-N 1 2 242.326 2.497 20 0 BEADLO Cn1ncc(C[NH2+]CC(C)(F)F)c1C1CC1 ZINC000894625286 583496313 /nfs/dbraw/zinc/49/63/13/583496313.db2.gz RPYFURCAPFHTEX-UHFFFAOYSA-N 1 2 229.274 2.042 20 0 BEADLO C[C@H]1C[N@H+](Cc2cc(C(F)(F)F)nn2C)[C@H]1C ZINC000894862270 583534908 /nfs/dbraw/zinc/53/49/08/583534908.db2.gz WPCJKTHTKIHSPA-YUMQZZPRSA-N 1 2 247.264 2.279 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cc(C(F)(F)F)nn2C)[C@H]1C ZINC000894862270 583534910 /nfs/dbraw/zinc/53/49/10/583534910.db2.gz WPCJKTHTKIHSPA-YUMQZZPRSA-N 1 2 247.264 2.279 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+]2C[C@H](C)[C@H]2C)n1 ZINC000894862226 583535279 /nfs/dbraw/zinc/53/52/79/583535279.db2.gz UXLSHZLISMRKBK-VHSXEESVSA-N 1 2 207.321 2.373 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+]2C[C@H](C)[C@H]2C)n1 ZINC000894862226 583535280 /nfs/dbraw/zinc/53/52/80/583535280.db2.gz UXLSHZLISMRKBK-VHSXEESVSA-N 1 2 207.321 2.373 20 0 BEADLO CN(C)c1cc(N[C@H]2CCCC23CC3)[nH+]cn1 ZINC000894862723 583536904 /nfs/dbraw/zinc/53/69/04/583536904.db2.gz ICDFCMYKJHLCHI-JTQLQIEISA-N 1 2 232.331 2.287 20 0 BEADLO CN(C)c1cc(N[C@H]2CCCC23CC3)nc[nH+]1 ZINC000894862723 583536907 /nfs/dbraw/zinc/53/69/07/583536907.db2.gz ICDFCMYKJHLCHI-JTQLQIEISA-N 1 2 232.331 2.287 20 0 BEADLO CCNc1cc(CNc2ncncc2C)cc[nH+]1 ZINC000894871858 583540473 /nfs/dbraw/zinc/54/04/73/583540473.db2.gz FWBIDBUCIDXIPA-UHFFFAOYSA-N 1 2 243.314 2.224 20 0 BEADLO C[C@@H](NC(=O)/C=C/c1cccs1)c1[nH]cc[nH+]1 ZINC000141023579 583547510 /nfs/dbraw/zinc/54/75/10/583547510.db2.gz MOGLQVVMFAWLQR-XNPJLODASA-N 1 2 247.323 2.362 20 0 BEADLO CC(C)n1c[nH+]cc1CN1CC(C(F)(F)F)C1 ZINC000894890509 583547910 /nfs/dbraw/zinc/54/79/10/583547910.db2.gz IZNLDYOHEMQEDB-UHFFFAOYSA-N 1 2 247.264 2.458 20 0 BEADLO c1[nH+]cn2ccnc(N3C[C@@H]4CC=CC[C@@H]4C3)c12 ZINC000895010400 583567213 /nfs/dbraw/zinc/56/72/13/583567213.db2.gz WAGDKSYTKIBKDF-TXEJJXNPSA-N 1 2 240.310 2.132 20 0 BEADLO CCc1cc(C[NH2+][C@@H]2CCCc3cn[nH]c32)on1 ZINC000857855653 588912972 /nfs/dbraw/zinc/91/29/72/588912972.db2.gz VPWBPEZQWHGBLE-GFCCVEGCSA-N 1 2 246.314 2.127 20 0 BEADLO CCc1cc(C[NH2+][C@@H]2CCCc3c[nH]nc32)on1 ZINC000857855653 588912973 /nfs/dbraw/zinc/91/29/73/588912973.db2.gz VPWBPEZQWHGBLE-GFCCVEGCSA-N 1 2 246.314 2.127 20 0 BEADLO Fc1cccc(C[NH2+][C@@H]2CCCc3cn[nH]c32)n1 ZINC000857857330 588914139 /nfs/dbraw/zinc/91/41/39/588914139.db2.gz BPJOFUQKBDJJIL-LLVKDONJSA-N 1 2 246.289 2.111 20 0 BEADLO Fc1cccc(C[NH2+][C@@H]2CCCc3c[nH]nc32)n1 ZINC000857857330 588914140 /nfs/dbraw/zinc/91/41/40/588914140.db2.gz BPJOFUQKBDJJIL-LLVKDONJSA-N 1 2 246.289 2.111 20 0 BEADLO Cc1[nH+]cnc(N2CCC(CCCO)CC2)c1C ZINC000882174233 583597497 /nfs/dbraw/zinc/59/74/97/583597497.db2.gz PUKLPQXFNARPKW-UHFFFAOYSA-N 1 2 249.358 2.082 20 0 BEADLO CC(C)c1c[nH]c(CN2CCC[C@@H](F)C2)[nH+]1 ZINC000895150217 583606486 /nfs/dbraw/zinc/60/64/86/583606486.db2.gz HWXFGXYGLBTMOP-SNVBAGLBSA-N 1 2 225.311 2.467 20 0 BEADLO COCc1cc[nH+]c(NCc2ocnc2C)c1 ZINC000895151646 583607065 /nfs/dbraw/zinc/60/70/65/583607065.db2.gz VOLHVZVIICQUSM-UHFFFAOYSA-N 1 2 233.271 2.137 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@H](F)C2)cnc1F ZINC000895190851 583620703 /nfs/dbraw/zinc/62/07/03/583620703.db2.gz DAYZOELTGCAOOD-NSHDSACASA-N 1 2 226.270 2.463 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@H](F)C2)cnc1F ZINC000895190851 583620705 /nfs/dbraw/zinc/62/07/05/583620705.db2.gz DAYZOELTGCAOOD-NSHDSACASA-N 1 2 226.270 2.463 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)Cc1nc(C(C)(C)C)co1 ZINC000895303096 583644831 /nfs/dbraw/zinc/64/48/31/583644831.db2.gz RNVVNAKISVIXBM-UHFFFAOYSA-N 1 2 248.330 2.327 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)Cc1nc(C(C)(C)C)co1 ZINC000895303096 583644832 /nfs/dbraw/zinc/64/48/32/583644832.db2.gz RNVVNAKISVIXBM-UHFFFAOYSA-N 1 2 248.330 2.327 20 0 BEADLO c1nc(CC[N@@H+]2Cc3ccncc3C2)cs1 ZINC000857879496 588919731 /nfs/dbraw/zinc/91/97/31/588919731.db2.gz GGUIQHDCIOOPBB-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1nc(CC[N@H+]2Cc3ccncc3C2)cs1 ZINC000857879496 588919732 /nfs/dbraw/zinc/91/97/32/588919732.db2.gz GGUIQHDCIOOPBB-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO Cc1ncoc1C[N@@H+]1Cc2ccc(O)cc2C1 ZINC000895391315 583664306 /nfs/dbraw/zinc/66/43/06/583664306.db2.gz XPLCDXNRAAHCFV-UHFFFAOYSA-N 1 2 230.267 2.204 20 0 BEADLO Cc1ncoc1C[N@H+]1Cc2ccc(O)cc2C1 ZINC000895391315 583664309 /nfs/dbraw/zinc/66/43/09/583664309.db2.gz XPLCDXNRAAHCFV-UHFFFAOYSA-N 1 2 230.267 2.204 20 0 BEADLO Cc1ncoc1C[N@@H+]1CCc2c(O)cccc2C1 ZINC000895405850 583666406 /nfs/dbraw/zinc/66/64/06/583666406.db2.gz OUMZCNVIGWNXJW-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO Cc1ncoc1C[N@H+]1CCc2c(O)cccc2C1 ZINC000895405850 583666407 /nfs/dbraw/zinc/66/64/07/583666407.db2.gz OUMZCNVIGWNXJW-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CC[C@@H]1C(F)F ZINC000895430873 583670071 /nfs/dbraw/zinc/67/00/71/583670071.db2.gz JBRAKDSFBIOPRM-SECBINFHSA-N 1 2 229.274 2.303 20 0 BEADLO FC(F)[C@@H]1CCN1Cc1cccc2[nH+]ccn21 ZINC000895431038 583670104 /nfs/dbraw/zinc/67/01/04/583670104.db2.gz JVDDHUOIBRJNRA-JTQLQIEISA-N 1 2 237.253 2.174 20 0 BEADLO CO[C@H](CC(C)C)C[N@@H+]1CC[C@H]1C(F)F ZINC000895432052 583670590 /nfs/dbraw/zinc/67/05/90/583670590.db2.gz TZQIPIOCLRYNGG-ZJUUUORDSA-N 1 2 221.291 2.387 20 0 BEADLO CO[C@H](CC(C)C)C[N@H+]1CC[C@H]1C(F)F ZINC000895432052 583670591 /nfs/dbraw/zinc/67/05/91/583670591.db2.gz TZQIPIOCLRYNGG-ZJUUUORDSA-N 1 2 221.291 2.387 20 0 BEADLO FC(F)[C@H]1CC[N@@H+]1C[C@@H]1CCSC1 ZINC000895432856 583671215 /nfs/dbraw/zinc/67/12/15/583671215.db2.gz QUFMLFSFXXXIBP-JGVFFNPUSA-N 1 2 207.289 2.079 20 0 BEADLO FC(F)[C@H]1CC[N@H+]1C[C@@H]1CCSC1 ZINC000895432856 583671217 /nfs/dbraw/zinc/67/12/17/583671217.db2.gz QUFMLFSFXXXIBP-JGVFFNPUSA-N 1 2 207.289 2.079 20 0 BEADLO COC1(C[N@@H+]2CC[C@@H]2C(F)F)CCCC1 ZINC000895432878 583671380 /nfs/dbraw/zinc/67/13/80/583671380.db2.gz RBPOQHYOCNGNDJ-SECBINFHSA-N 1 2 219.275 2.285 20 0 BEADLO COC1(C[N@H+]2CC[C@@H]2C(F)F)CCCC1 ZINC000895432878 583671381 /nfs/dbraw/zinc/67/13/81/583671381.db2.gz RBPOQHYOCNGNDJ-SECBINFHSA-N 1 2 219.275 2.285 20 0 BEADLO C[C@@H]([NH2+][C@@H]1[C@@H]2CCC[C@@H]21)C(=O)OC(C)(C)C ZINC000895432742 583671408 /nfs/dbraw/zinc/67/14/08/583671408.db2.gz DDNMNWJAMUAYKC-CHWFTXMASA-N 1 2 225.332 2.105 20 0 BEADLO CCC[C@H](C)NC(=O)C(C)(C)n1c[nH+]c(C)c1 ZINC000895446444 583675994 /nfs/dbraw/zinc/67/59/94/583675994.db2.gz AVLXMMHCZUMARZ-JTQLQIEISA-N 1 2 237.347 2.231 20 0 BEADLO Fc1cc(C[NH+]2CCC(F)CC2)c(F)cn1 ZINC000895547237 583687068 /nfs/dbraw/zinc/68/70/68/583687068.db2.gz QZWZXIABCATEEP-UHFFFAOYSA-N 1 2 230.233 2.294 20 0 BEADLO C[C@@H](O)c1cccc(N[C@@H]2CCO[C@H]2C2CC2)[nH+]1 ZINC000895543351 583688803 /nfs/dbraw/zinc/68/88/03/583688803.db2.gz JOKWAWATZPHQLZ-IUPBHXKESA-N 1 2 248.326 2.114 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CCC[C@@H](CF)C2)c1C ZINC000895545665 583690249 /nfs/dbraw/zinc/69/02/49/583690249.db2.gz UYFHAGRTKBENKU-NSHDSACASA-N 1 2 225.311 2.208 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CCC[C@@H](CF)C2)c1C ZINC000895545665 583690251 /nfs/dbraw/zinc/69/02/51/583690251.db2.gz UYFHAGRTKBENKU-NSHDSACASA-N 1 2 225.311 2.208 20 0 BEADLO CC(C)Cc1ccc(C[NH2+]Cc2ncc[nH]2)cn1 ZINC000895705001 583710045 /nfs/dbraw/zinc/71/00/45/583710045.db2.gz RJJYDTCPKXUMEK-UHFFFAOYSA-N 1 2 244.342 2.293 20 0 BEADLO CC(C)c1nc(N2CCO[C@@H](C)CC2)cc[nH+]1 ZINC000895758052 583721057 /nfs/dbraw/zinc/72/10/57/583721057.db2.gz LUQRMXFMPYUCQX-NSHDSACASA-N 1 2 235.331 2.215 20 0 BEADLO C[C@H]1CCN(c2[nH]c3ccccc3[nH+]2)CCO1 ZINC000895759015 583721386 /nfs/dbraw/zinc/72/13/86/583721386.db2.gz SMXDWHVAEVBNMD-JTQLQIEISA-N 1 2 231.299 2.178 20 0 BEADLO COc1ccc(C[NH2+]Cc2ccc(C)o2)o1 ZINC000895769674 583723794 /nfs/dbraw/zinc/72/37/94/583723794.db2.gz FYEGIQGPZWIHLB-UHFFFAOYSA-N 1 2 221.256 2.479 20 0 BEADLO CCc1nc(N[C@@H](C)C(C)(C)OC)cc[nH+]1 ZINC000895785513 583727294 /nfs/dbraw/zinc/72/72/94/583727294.db2.gz HXQLXDKSJWAZAI-VIFPVBQESA-N 1 2 223.320 2.264 20 0 BEADLO CCCCCCC(=O)N[C@H]1CCn2c[nH+]cc2C1 ZINC000857944354 588924805 /nfs/dbraw/zinc/92/48/05/588924805.db2.gz LNYXPMXNICGQTK-LBPRGKRZSA-N 1 2 249.358 2.285 20 0 BEADLO CCC/C(C)=C\C(=O)N[C@H]1CCn2c[nH+]cc2C1 ZINC000857952385 588924980 /nfs/dbraw/zinc/92/49/80/588924980.db2.gz SFRKQPMRDTVMEA-RDQDRAATSA-N 1 2 247.342 2.061 20 0 BEADLO CCC(=CC(=O)N[C@H]1CCn2c[nH+]cc2C1)CC ZINC000857951314 588925010 /nfs/dbraw/zinc/92/50/10/588925010.db2.gz OKGKEQIUFJZNSG-LBPRGKRZSA-N 1 2 247.342 2.061 20 0 BEADLO O=C1OCC[C@@H]1[NH2+][C@H]1CC[C@H](c2ccccc2)C1 ZINC000895803029 583731420 /nfs/dbraw/zinc/73/14/20/583731420.db2.gz AIQQJDRCOHTGII-IHRRRGAJSA-N 1 2 245.322 2.228 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CC[C@@H]([C@H]3CCCO3)C2)c1C ZINC000895845922 583735742 /nfs/dbraw/zinc/73/57/42/583735742.db2.gz RPLQDOHBDDAIDA-TZMCWYRMSA-N 1 2 249.358 2.027 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CC[C@@H]([C@H]3CCCO3)C2)c1C ZINC000895845922 583735744 /nfs/dbraw/zinc/73/57/44/583735744.db2.gz RPLQDOHBDDAIDA-TZMCWYRMSA-N 1 2 249.358 2.027 20 0 BEADLO CC(C)c1nc(N[C@@H]2COC[C@@H]2C)cc[nH+]1 ZINC000895905060 583743109 /nfs/dbraw/zinc/74/31/09/583743109.db2.gz HOHGRGPPMXXOQC-VHSXEESVSA-N 1 2 221.304 2.047 20 0 BEADLO Cc1cc(N[C@H]2COC[C@H]2C)nc(C2CCC2)[nH+]1 ZINC000895911268 583745697 /nfs/dbraw/zinc/74/56/97/583745697.db2.gz XIWRKLVCWLHUJX-SKDRFNHKSA-N 1 2 247.342 2.499 20 0 BEADLO Cc1csc(C(=O)N[C@H]2CCn3c[nH+]cc32)c1 ZINC000857976249 588926216 /nfs/dbraw/zinc/92/62/16/588926216.db2.gz AJBODNGSFHRWBU-VIFPVBQESA-N 1 2 247.323 2.128 20 0 BEADLO O=C(/C=C/C1CCCC1)N[C@H]1CCn2c[nH+]cc21 ZINC000857976534 588926248 /nfs/dbraw/zinc/92/62/48/588926248.db2.gz GTKHJEXAUDXZKF-FYJFLYSWSA-N 1 2 245.326 2.191 20 0 BEADLO Cc1occc1C[NH+]1CC(OC(C)C)C1 ZINC000895954630 583752187 /nfs/dbraw/zinc/75/21/87/583752187.db2.gz DCRLSZWDQLZHHE-UHFFFAOYSA-N 1 2 209.289 2.197 20 0 BEADLO COCc1ccc(C[NH+]2CC(OC(C)C)C2)o1 ZINC000895954614 583752205 /nfs/dbraw/zinc/75/22/05/583752205.db2.gz CLIIUZDCAFDGGS-UHFFFAOYSA-N 1 2 239.315 2.035 20 0 BEADLO COCC1C[NH+](Cc2nc(C(C)(C)C)co2)C1 ZINC000895976639 583753201 /nfs/dbraw/zinc/75/32/01/583753201.db2.gz RKQKZZIWLRHEEL-UHFFFAOYSA-N 1 2 238.331 2.050 20 0 BEADLO CC(C)(C(=O)N[C@H]1CCn2c[nH+]cc21)C1CCC1 ZINC000857977686 588926672 /nfs/dbraw/zinc/92/66/72/588926672.db2.gz XRBCGNYIIWQIPQ-NSHDSACASA-N 1 2 247.342 2.270 20 0 BEADLO O=C(N[C@@H]1CCn2c[nH+]cc21)C1=CCCCCC1 ZINC000857978119 588926674 /nfs/dbraw/zinc/92/66/74/588926674.db2.gz KIGPYVPBBQQIPV-GFCCVEGCSA-N 1 2 245.326 2.335 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@@H](OC)C2)s1 ZINC000895968674 583755075 /nfs/dbraw/zinc/75/50/75/583755075.db2.gz QMKLPZFNBHXDNG-GFCCVEGCSA-N 1 2 241.356 2.115 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@@H](OC)C2)s1 ZINC000895968674 583755077 /nfs/dbraw/zinc/75/50/77/583755077.db2.gz QMKLPZFNBHXDNG-GFCCVEGCSA-N 1 2 241.356 2.115 20 0 BEADLO COCC1C[NH+](Cc2cc(F)c(F)cc2F)C1 ZINC000895971835 583756037 /nfs/dbraw/zinc/75/60/37/583756037.db2.gz UUQOKNIGAKOUOQ-UHFFFAOYSA-N 1 2 245.244 2.182 20 0 BEADLO C/C(=C/C(=O)N[C@@H]1CCn2c[nH+]cc21)C(C)(C)C ZINC000857977763 588926807 /nfs/dbraw/zinc/92/68/07/588926807.db2.gz ZIIYDYAKAIKKJO-ZJRUKIMVSA-N 1 2 247.342 2.437 20 0 BEADLO CO[C@H]1C[N@H+](C/C(C)=C\c2ccccc2)CCO1 ZINC000895970812 583756366 /nfs/dbraw/zinc/75/63/66/583756366.db2.gz VHKAFFDBNWLSAX-VSKPTYQZSA-N 1 2 247.338 2.395 20 0 BEADLO CO[C@H]1C[N@@H+](C/C(C)=C\c2ccccc2)CCO1 ZINC000895970812 583756367 /nfs/dbraw/zinc/75/63/67/583756367.db2.gz VHKAFFDBNWLSAX-VSKPTYQZSA-N 1 2 247.338 2.395 20 0 BEADLO CCCC[C@@H](C)C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857977421 588926891 /nfs/dbraw/zinc/92/68/91/588926891.db2.gz DTJWAJUCJQIGTR-MNOVXSKESA-N 1 2 235.331 2.270 20 0 BEADLO C/C(=C/C(C)(C)C)C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857979317 588927227 /nfs/dbraw/zinc/92/72/27/588927227.db2.gz AYKBSGPTLDTYRD-ZJRUKIMVSA-N 1 2 247.342 2.437 20 0 BEADLO CC1(C)CCC[C@H]1C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857982207 588928003 /nfs/dbraw/zinc/92/80/03/588928003.db2.gz NOPVWHDUMFYNSA-WDEREUQCSA-N 1 2 247.342 2.270 20 0 BEADLO O=C(N[C@H]1CCn2c[nH+]cc21)C(F)=C1CCCC1 ZINC000857982316 588928050 /nfs/dbraw/zinc/92/80/50/588928050.db2.gz HQYHICPRCCKMHJ-JTQLQIEISA-N 1 2 249.289 2.242 20 0 BEADLO CCC1(C(=O)N[C@H]2CCn3c[nH+]cc32)CCC1 ZINC000857982130 588928056 /nfs/dbraw/zinc/92/80/56/588928056.db2.gz FZFLTNSZYCIQGH-JTQLQIEISA-N 1 2 233.315 2.024 20 0 BEADLO CC1(C)CCC[C@@H]1C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857982201 588928141 /nfs/dbraw/zinc/92/81/41/588928141.db2.gz NOPVWHDUMFYNSA-GHMZBOCLSA-N 1 2 247.342 2.270 20 0 BEADLO O=C(N[C@@H]1CCn2c[nH+]cc21)C(F)=C1CCCC1 ZINC000857982317 588928252 /nfs/dbraw/zinc/92/82/52/588928252.db2.gz HQYHICPRCCKMHJ-SNVBAGLBSA-N 1 2 249.289 2.242 20 0 BEADLO CCC[C@@H](O)CCNc1ccc([C@@H](C)O)c[nH+]1 ZINC000896181850 583778223 /nfs/dbraw/zinc/77/82/23/583778223.db2.gz GLQXWSYCFGHGNZ-ZYHUDNBSSA-N 1 2 238.331 2.098 20 0 BEADLO COc1ccc[nH+]c1NC[C@]1(C)CCCCO1 ZINC000896182951 583779106 /nfs/dbraw/zinc/77/91/06/583779106.db2.gz VKCRNJHYFJHAHV-ZDUSSCGKSA-N 1 2 236.315 2.461 20 0 BEADLO CCC[C@@H](O)CCNc1cc[nH+]c2ccncc12 ZINC000896186743 583780934 /nfs/dbraw/zinc/78/09/34/583780934.db2.gz KWBAXDYOMPNDAC-LLVKDONJSA-N 1 2 245.326 2.015 20 0 BEADLO CCC[C@@H](O)CCNc1[nH+]c(C)nc2[nH]ccc21 ZINC000896187601 583781674 /nfs/dbraw/zinc/78/16/74/583781674.db2.gz RMIRUWGBFLCBCW-SNVBAGLBSA-N 1 2 248.330 2.181 20 0 BEADLO C[C@@H]1CCC[C@@H](C(=O)N[C@@H]2CCn3c[nH+]cc32)C1 ZINC000857985597 588929044 /nfs/dbraw/zinc/92/90/44/588929044.db2.gz IPMHAXVIHCRGSS-IJLUTSLNSA-N 1 2 247.342 2.270 20 0 BEADLO CNc1cc(N[C@H]2CCS[C@@H](C)C2)[nH+]cn1 ZINC000896245976 583784724 /nfs/dbraw/zinc/78/47/24/583784724.db2.gz KBYJYEWWKWFZBV-IUCAKERBSA-N 1 2 238.360 2.214 20 0 BEADLO Cc1nc(N[C@H]2CCS[C@@H](C)C2)cc[nH+]1 ZINC000896246643 583784951 /nfs/dbraw/zinc/78/49/51/583784951.db2.gz QJYPUUIBFHRICY-WPRPVWTQSA-N 1 2 223.345 2.481 20 0 BEADLO C/C=C(/C=C\C(=O)N[C@@H]1CCn2c[nH+]cc21)CC ZINC000857987627 588929240 /nfs/dbraw/zinc/92/92/40/588929240.db2.gz XDJLMNLFBHJOAT-GANNGHOVSA-N 1 2 245.326 2.357 20 0 BEADLO CS/C=C\C(=O)N1CCNc2[nH+]cc(C)cc21 ZINC000857996711 588929926 /nfs/dbraw/zinc/92/99/26/588929926.db2.gz DMOBSLNBEMLUMT-UTCJRWHESA-N 1 2 249.339 2.025 20 0 BEADLO Cc1cccc(C(=O)N[C@@H]2CCn3c[nH+]cc32)c1 ZINC000857990360 588930050 /nfs/dbraw/zinc/93/00/50/588930050.db2.gz OCSJATZDWMQHJM-GFCCVEGCSA-N 1 2 241.294 2.066 20 0 BEADLO Cc1ccc(C(=O)N[C@@H]2CCn3c[nH+]cc32)s1 ZINC000857989827 588930054 /nfs/dbraw/zinc/93/00/54/588930054.db2.gz LHKUWMNYZZHPPR-SECBINFHSA-N 1 2 247.323 2.128 20 0 BEADLO CCO[C@H]1CCN(c2cc(CC)[nH+]c(CC)n2)C1 ZINC000896404946 583799771 /nfs/dbraw/zinc/79/97/71/583799771.db2.gz TVGMUTKSBXWQDM-LBPRGKRZSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@H]([NH2+][C@@H]1C[C@H]1[C@@H]1C[C@H]1C)C(=O)OC(C)(C)C ZINC000896402198 583800245 /nfs/dbraw/zinc/80/02/45/583800245.db2.gz YNZPOSDXQIBURO-CSYMLDBXSA-N 1 2 239.359 2.351 20 0 BEADLO Cc1c[nH+]c2c(c1)N(C(=O)[C@H]1CC1(C)C)CCN2 ZINC000858000302 588930624 /nfs/dbraw/zinc/93/06/24/588930624.db2.gz YWCYPQWYJFGRKN-SNVBAGLBSA-N 1 2 245.326 2.195 20 0 BEADLO Cn1nc(CNc2cccc[nH+]2)cc1C1CC1 ZINC000896532394 583809011 /nfs/dbraw/zinc/80/90/11/583809011.db2.gz VUNRKURBGYDZKF-UHFFFAOYSA-N 1 2 228.299 2.305 20 0 BEADLO CCc1onc(C)c1CNc1cc[nH+]cc1F ZINC000896662755 583822029 /nfs/dbraw/zinc/82/20/29/583822029.db2.gz CXOWBTXMNKGZJD-UHFFFAOYSA-N 1 2 235.262 2.114 20 0 BEADLO Cc1cc[nH+]c(N[C@H]2C[C@H](CO)C2)c1Cl ZINC000896690536 583822450 /nfs/dbraw/zinc/82/24/50/583822450.db2.gz DFEDYXYDQYTJBG-KYZUINATSA-N 1 2 226.707 2.226 20 0 BEADLO c1cc2n(c1)CC[N@@H+](Cc1ccoc1)C2 ZINC000896760403 583831314 /nfs/dbraw/zinc/83/13/14/583831314.db2.gz LOWRCLNSNIXIQW-UHFFFAOYSA-N 1 2 202.257 2.097 20 0 BEADLO c1cc2n(c1)CC[N@H+](Cc1ccoc1)C2 ZINC000896760403 583831317 /nfs/dbraw/zinc/83/13/17/583831317.db2.gz LOWRCLNSNIXIQW-UHFFFAOYSA-N 1 2 202.257 2.097 20 0 BEADLO COCc1ccc(C[N@@H+]2CCn3cccc3C2)o1 ZINC000896762180 583831443 /nfs/dbraw/zinc/83/14/43/583831443.db2.gz ZGSDYGVRKRDPCO-UHFFFAOYSA-N 1 2 246.310 2.243 20 0 BEADLO COCc1ccc(C[N@H+]2CCn3cccc3C2)o1 ZINC000896762180 583831444 /nfs/dbraw/zinc/83/14/44/583831444.db2.gz ZGSDYGVRKRDPCO-UHFFFAOYSA-N 1 2 246.310 2.243 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+]2CCn3cccc3C2)n1 ZINC000896763845 583831627 /nfs/dbraw/zinc/83/16/27/583831627.db2.gz SASCKVFABZLRKS-UHFFFAOYSA-N 1 2 244.342 2.350 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+]2CCn3cccc3C2)n1 ZINC000896763845 583831631 /nfs/dbraw/zinc/83/16/31/583831631.db2.gz SASCKVFABZLRKS-UHFFFAOYSA-N 1 2 244.342 2.350 20 0 BEADLO COc1ccc[nH+]c1NCC1(C2(O)CCC2)CC1 ZINC000896811205 583835527 /nfs/dbraw/zinc/83/55/27/583835527.db2.gz HSGJVRIQUNXAQF-UHFFFAOYSA-N 1 2 248.326 2.197 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H]2C[C@H]2C2CCC2)[nH+]c1C ZINC000896906398 583851355 /nfs/dbraw/zinc/85/13/55/583851355.db2.gz BMGUDMNMCJUYGC-NWDGAFQWSA-N 1 2 247.342 2.079 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@H]2CCC2(C)C)[nH+]c1C ZINC000896908095 583851938 /nfs/dbraw/zinc/85/19/38/583851938.db2.gz UZUJETSIUHLIJG-SNVBAGLBSA-N 1 2 235.331 2.079 20 0 BEADLO Cc1coc(C)c1C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000896909970 583852710 /nfs/dbraw/zinc/85/27/10/583852710.db2.gz GCQYTFSDBRPDSY-UHFFFAOYSA-N 1 2 247.298 2.166 20 0 BEADLO CC[C@H](C)CCC(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000896911044 583853069 /nfs/dbraw/zinc/85/30/69/583853069.db2.gz YRZGBZLINPWEEI-VIFPVBQESA-N 1 2 237.347 2.469 20 0 BEADLO CC[C@@H](C)CCC(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000896911043 583853120 /nfs/dbraw/zinc/85/31/20/583853120.db2.gz YRZGBZLINPWEEI-SECBINFHSA-N 1 2 237.347 2.469 20 0 BEADLO Cc1[nH]c(CNC(=O)C[C@H]2CCC[C@@H]2C)[nH+]c1C ZINC000896913114 583853980 /nfs/dbraw/zinc/85/39/80/583853980.db2.gz ADKVYNYPZWZEDW-JOYOIKCWSA-N 1 2 249.358 2.469 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@H]2CCC[C@@H](C)C2)[nH+]c1C ZINC000896918705 583856127 /nfs/dbraw/zinc/85/61/27/583856127.db2.gz FJSVYOFZJNHDHN-SKDRFNHKSA-N 1 2 249.358 2.469 20 0 BEADLO Cc1[nH]c(CNC(=O)c2cccs2)[nH+]c1C ZINC000896930439 583860584 /nfs/dbraw/zinc/86/05/84/583860584.db2.gz ZELTZFUZRXKOGI-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO Cc1cn(C(C)(C)C(=O)NCCC2CCC2)c[nH+]1 ZINC000896944386 583862888 /nfs/dbraw/zinc/86/28/88/583862888.db2.gz HMDCQJFFTGHRBF-UHFFFAOYSA-N 1 2 249.358 2.233 20 0 BEADLO Cc1nc(NC2CC3(C2)CO[C@@H](C)C3)cc[nH+]1 ZINC000897054248 583874543 /nfs/dbraw/zinc/87/45/43/583874543.db2.gz ZIVJYYRDDVSQID-FJJSSXBZSA-N 1 2 233.315 2.155 20 0 BEADLO CCc1cc(N(C)[C@H]2CC[C@H]2OC)nc(CC)[nH+]1 ZINC000897139965 583884414 /nfs/dbraw/zinc/88/44/14/583884414.db2.gz LSGRGJMHBQNUMI-NWDGAFQWSA-N 1 2 249.358 2.215 20 0 BEADLO CO[C@H]1CC[C@@H]1N(C)c1[nH]c2ccccc2[nH+]1 ZINC000897149208 583884475 /nfs/dbraw/zinc/88/44/75/583884475.db2.gz QHHDEMJPWKMWPE-RYUDHWBXSA-N 1 2 231.299 2.177 20 0 BEADLO CO[C@@H]1CC[C@@H]1N(C)c1cc[nH+]c2ccncc21 ZINC000897148062 583884694 /nfs/dbraw/zinc/88/46/94/583884694.db2.gz UNVNJZGTACYORD-UONOGXRCSA-N 1 2 243.310 2.243 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N[C@H](C)C2CCC2)c[nH+]1 ZINC000897217960 583897120 /nfs/dbraw/zinc/89/71/20/583897120.db2.gz JINFWIVPIFTZRC-LLVKDONJSA-N 1 2 249.358 2.231 20 0 BEADLO CCc1cc(NC2CC(CCO)C2)nc(CC)[nH+]1 ZINC000897236303 583899997 /nfs/dbraw/zinc/89/99/97/583899997.db2.gz GGLMQSMEOXZBEK-UHFFFAOYSA-N 1 2 249.358 2.174 20 0 BEADLO CCC(F)(F)C[NH2+]Cc1ccc(F)nc1 ZINC000858259428 588941024 /nfs/dbraw/zinc/94/10/24/588941024.db2.gz SNBKINDIQOTRCM-UHFFFAOYSA-N 1 2 218.222 2.356 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1CCOC12CCCC2 ZINC000897322942 583922841 /nfs/dbraw/zinc/92/28/41/583922841.db2.gz SVZRCXMZISELIT-GFCCVEGCSA-N 1 2 236.290 2.156 20 0 BEADLO Fc1ccc(C[NH+]2CC(Cc3ccco3)C2)cn1 ZINC000862485560 583963336 /nfs/dbraw/zinc/96/33/36/583963336.db2.gz ABAGOSQXDAPUIC-UHFFFAOYSA-N 1 2 246.285 2.488 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)N1C[C@@H]2C[C@@H]2C1 ZINC000888130652 583967992 /nfs/dbraw/zinc/96/79/92/583967992.db2.gz ATGXLYYZNBRRRS-PHIMTYICSA-N 1 2 231.299 2.182 20 0 BEADLO CC(C)c1nc(N[C@@H]2COC[C@@H]2C2CC2)cc[nH+]1 ZINC000897446067 583986474 /nfs/dbraw/zinc/98/64/74/583986474.db2.gz BSMSNSMNFZRMNP-VXGBXAGGSA-N 1 2 247.342 2.437 20 0 BEADLO CCc1nc(N2C[C@@H]3CSC[C@]3(C)C2)cc[nH+]1 ZINC000897483262 583992507 /nfs/dbraw/zinc/99/25/07/583992507.db2.gz NKYJQHHXWDQYJF-MFKMUULPSA-N 1 2 249.383 2.228 20 0 BEADLO c1cc(C[NH2+]Cc2cccc3c2NCCC3)no1 ZINC000148730776 584035427 /nfs/dbraw/zinc/03/54/27/584035427.db2.gz INSVVUUTWYPPHP-UHFFFAOYSA-N 1 2 243.310 2.323 20 0 BEADLO CC(C)c1c[nH+]cc(N[C@H]2CCNC(=O)CC2)c1 ZINC000897707649 584042004 /nfs/dbraw/zinc/04/20/04/584042004.db2.gz WNCGIGRFWCSLMC-GFCCVEGCSA-N 1 2 247.342 2.286 20 0 BEADLO Cc1ccc(C[N@@H+]2CC[C@@H](O)[C@H](F)C2)c(F)c1 ZINC000898184538 584092886 /nfs/dbraw/zinc/09/28/86/584092886.db2.gz UQPSFQJETWIFIH-CHWSQXEVSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1ccc(C[N@H+]2CC[C@@H](O)[C@H](F)C2)c(F)c1 ZINC000898184538 584092887 /nfs/dbraw/zinc/09/28/87/584092887.db2.gz UQPSFQJETWIFIH-CHWSQXEVSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@@H](O)[C@@H](F)C2)ccc1F ZINC000898191248 584095608 /nfs/dbraw/zinc/09/56/08/584095608.db2.gz AGMLSCIPLOZLAN-QWHCGFSZSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@@H](O)[C@@H](F)C2)ccc1F ZINC000898191248 584095610 /nfs/dbraw/zinc/09/56/10/584095610.db2.gz AGMLSCIPLOZLAN-QWHCGFSZSA-N 1 2 241.281 2.039 20 0 BEADLO CCc1cc(N2C[C@H](OC)CC[C@H]2C)nc(C)[nH+]1 ZINC000866073308 584112321 /nfs/dbraw/zinc/11/23/21/584112321.db2.gz YSPFNAPTFMULGT-ZWNOBZJWSA-N 1 2 249.358 2.351 20 0 BEADLO Cc1c(Cl)c(C[NH2+]C/C=C/Cl)nn1C ZINC000898429528 584133890 /nfs/dbraw/zinc/13/38/90/584133890.db2.gz PLZLHKBFJNLVSL-ONEGZZNKSA-N 1 2 234.130 2.224 20 0 BEADLO CCC(F)(F)C[NH2+][C@H](C)c1cc(C)nn1C ZINC000858506303 588961588 /nfs/dbraw/zinc/96/15/88/588961588.db2.gz GHKQPSITMQJLRR-SECBINFHSA-N 1 2 231.290 2.424 20 0 BEADLO CC(C)CCC(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000898899475 584165076 /nfs/dbraw/zinc/16/50/76/584165076.db2.gz KDNVXTAOXWZEES-UHFFFAOYSA-N 1 2 237.347 2.171 20 0 BEADLO CCC[C@H](C)C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000898899785 584165181 /nfs/dbraw/zinc/16/51/81/584165181.db2.gz PGMXICCXSHAISQ-NSHDSACASA-N 1 2 237.347 2.171 20 0 BEADLO C[C@H]1CCN1C(=O)c1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000899199859 584180803 /nfs/dbraw/zinc/18/08/03/584180803.db2.gz JWHWYUHQFBHHKU-JTQLQIEISA-N 1 2 241.294 2.311 20 0 BEADLO CC1(C)C[C@]1(C)CNC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000899203229 584181366 /nfs/dbraw/zinc/18/13/66/584181366.db2.gz KRURYPVDLYXLOF-GPCCPHFNSA-N 1 2 247.342 2.066 20 0 BEADLO CC1(C)C[C@]1(C)CNC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000899203229 584181367 /nfs/dbraw/zinc/18/13/67/584181367.db2.gz KRURYPVDLYXLOF-GPCCPHFNSA-N 1 2 247.342 2.066 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)Nc1nccnc1F ZINC000858563510 588966402 /nfs/dbraw/zinc/96/64/02/588966402.db2.gz WIYLSFRECUNQJP-QMMMGPOBSA-N 1 2 235.266 2.005 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NC1CCC=CCC1 ZINC000899804822 584240100 /nfs/dbraw/zinc/24/01/00/584240100.db2.gz DFOJECIGJDTOAJ-NSHDSACASA-N 1 2 247.342 2.203 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NC1CCC=CCC1 ZINC000899804822 584240102 /nfs/dbraw/zinc/24/01/02/584240102.db2.gz DFOJECIGJDTOAJ-NSHDSACASA-N 1 2 247.342 2.203 20 0 BEADLO O=C(NC1CCC=CCC1)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000899804853 584240250 /nfs/dbraw/zinc/24/02/50/584240250.db2.gz FPJHJANXWKFUCS-VXGBXAGGSA-N 1 2 245.326 2.128 20 0 BEADLO O=C(NC1CCC=CCC1)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000899804853 584240251 /nfs/dbraw/zinc/24/02/51/584240251.db2.gz FPJHJANXWKFUCS-VXGBXAGGSA-N 1 2 245.326 2.128 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccns1)c1ccn(C)n1 ZINC000858577924 588968369 /nfs/dbraw/zinc/96/83/69/588968369.db2.gz VWWVVVNDWIUCJD-BDAKNGLRSA-N 1 2 236.344 2.288 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)NCCCC1CCCCC1 ZINC000900191380 584284615 /nfs/dbraw/zinc/28/46/15/584284615.db2.gz OVRUOEWDUUMVGE-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)NCCCC1CCCCC1 ZINC000900191380 584284618 /nfs/dbraw/zinc/28/46/18/584284618.db2.gz OVRUOEWDUUMVGE-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO CCC1CCN(C(=O)CNc2cccc[nH+]2)CC1 ZINC000900292117 584291759 /nfs/dbraw/zinc/29/17/59/584291759.db2.gz SPXJTBWTNFYAHG-UHFFFAOYSA-N 1 2 247.342 2.142 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)NCC1CCCCCCC1 ZINC000900293602 584292216 /nfs/dbraw/zinc/29/22/16/584292216.db2.gz MVYHLYDNEYKLEX-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)NCC1CCCCCCC1 ZINC000900293602 584292217 /nfs/dbraw/zinc/29/22/17/584292217.db2.gz MVYHLYDNEYKLEX-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO CC[C@@H](NC(=O)Cc1c[nH]c[nH+]1)C1CCCCC1 ZINC000900491443 584316943 /nfs/dbraw/zinc/31/69/43/584316943.db2.gz UDYJRAUIZZBVER-CYBMUJFWSA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@@H](NC(=O)Cc1c[nH+]c[nH]1)C1CCCCC1 ZINC000900491443 584316944 /nfs/dbraw/zinc/31/69/44/584316944.db2.gz UDYJRAUIZZBVER-CYBMUJFWSA-N 1 2 249.358 2.427 20 0 BEADLO CCN(C(=O)Cc1c[nH+]c[nH]1)[C@@H]1CCCC[C@@H]1C ZINC000900531011 584322742 /nfs/dbraw/zinc/32/27/42/584322742.db2.gz VFYCQCDTNMBACC-WCQYABFASA-N 1 2 249.358 2.379 20 0 BEADLO CCN(C(=O)Cc1c[nH+]c[nH]1)[C@H]1CCCC[C@H]1C ZINC000900531012 584323071 /nfs/dbraw/zinc/32/30/71/584323071.db2.gz VFYCQCDTNMBACC-YPMHNXCESA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H]1CCC[C@H](C)N1C(=O)CNc1cccc[nH+]1 ZINC000900565608 584325591 /nfs/dbraw/zinc/32/55/91/584325591.db2.gz NFXMVDQDHZEBCP-TXEJJXNPSA-N 1 2 247.342 2.283 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N1C(=O)CNc1cccc[nH+]1 ZINC000900565609 584325841 /nfs/dbraw/zinc/32/58/41/584325841.db2.gz NFXMVDQDHZEBCP-VXGBXAGGSA-N 1 2 247.342 2.283 20 0 BEADLO CC(C)[C@@H]1CCC[C@@H](NC(=O)Cc2c[nH]c[nH+]2)C1 ZINC000900572875 584326995 /nfs/dbraw/zinc/32/69/95/584326995.db2.gz JGQSWGVWPGEUQU-VXGBXAGGSA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)[C@@H]1CCC[C@@H](NC(=O)Cc2c[nH+]c[nH]2)C1 ZINC000900572875 584326997 /nfs/dbraw/zinc/32/69/97/584326997.db2.gz JGQSWGVWPGEUQU-VXGBXAGGSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H](CNC(=O)CNc1cccc[nH+]1)C(C)(C)C ZINC000900722466 584344812 /nfs/dbraw/zinc/34/48/12/584344812.db2.gz ICCZVOWQEVCCLH-NSHDSACASA-N 1 2 249.358 2.292 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)N[C@@H]1CC[C@H]2CCC[C@H]2C1 ZINC000900851142 584357444 /nfs/dbraw/zinc/35/74/44/584357444.db2.gz AGLSPGWPQQUHEP-GRYCIOLGSA-N 1 2 247.342 2.037 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)N[C@@H]1CC[C@H]2CCC[C@H]2C1 ZINC000900851142 584357445 /nfs/dbraw/zinc/35/74/45/584357445.db2.gz AGLSPGWPQQUHEP-GRYCIOLGSA-N 1 2 247.342 2.037 20 0 BEADLO CC[C@H](C)CN(CC)C(=O)CNc1cccc[nH+]1 ZINC000900943761 584368493 /nfs/dbraw/zinc/36/84/93/584368493.db2.gz FTTBFPIOOPQPLI-LBPRGKRZSA-N 1 2 249.358 2.388 20 0 BEADLO Cc1ccccc1-c1cc([C@@H]2COCC[NH2+]2)on1 ZINC000901388666 584437053 /nfs/dbraw/zinc/43/70/53/584437053.db2.gz XCNRMUPYVAVIDB-ZDUSSCGKSA-N 1 2 244.294 2.311 20 0 BEADLO Cc1ccc(-c2cc([C@H]3COCC[NH2+]3)on2)cc1 ZINC000901398993 584438829 /nfs/dbraw/zinc/43/88/29/584438829.db2.gz AGHUAUHBEYSARL-CYBMUJFWSA-N 1 2 244.294 2.311 20 0 BEADLO C[C@H](CO)C[NH2+]c1ccc2c(c1)C[C@@H](C)O2 ZINC000901447338 584447043 /nfs/dbraw/zinc/44/70/43/584447043.db2.gz MSHRRFKUTDFSBI-VHSXEESVSA-N 1 2 221.300 2.050 20 0 BEADLO CC(C)n1c[nH+]cc1C=Cc1n[nH]cc1C=O ZINC000901463789 584451304 /nfs/dbraw/zinc/45/13/04/584451304.db2.gz BAQRCBBKPSWGQX-ONEGZZNKSA-N 1 2 230.271 2.170 20 0 BEADLO C/C(=C\c1[nH]c(C)c(C)[nH+]1)c1cnccn1 ZINC000901492397 584453071 /nfs/dbraw/zinc/45/30/71/584453071.db2.gz YZBROXLYFXVFBP-SOFGYWHQSA-N 1 2 214.272 2.377 20 0 BEADLO CCn1c[nH+]cc1/C=C(\C)c1cnccn1 ZINC000901491346 584453073 /nfs/dbraw/zinc/45/30/73/584453073.db2.gz SUQPTLGVDJIKOW-UXBLZVDNSA-N 1 2 214.272 2.254 20 0 BEADLO Cc1cc(=O)[nH]c(C=Cc2c[nH+]cn2C(C)C)n1 ZINC000901505548 584455840 /nfs/dbraw/zinc/45/58/40/584455840.db2.gz WKNYKMCSKQPRGT-PLNGDYQASA-N 1 2 244.298 2.438 20 0 BEADLO CC(C)c1c[nH]c(C=Cc2c[nH]c(C=O)n2)[nH+]1 ZINC000901554882 584462359 /nfs/dbraw/zinc/46/23/59/584462359.db2.gz HJEYVZBRQKYHLC-ARJAWSKDSA-N 1 2 230.271 2.239 20 0 BEADLO COC/C(C)=C\CSCCn1cc[nH+]c1 ZINC000901880691 584502242 /nfs/dbraw/zinc/50/22/42/584502242.db2.gz BZOWPWQBJCKIRJ-JYOAFUTRSA-N 1 2 226.345 2.209 20 0 BEADLO Cc1[nH]c(CNc2ccc(Cl)nn2)[nH+]c1C ZINC000902079439 584520394 /nfs/dbraw/zinc/52/03/94/584520394.db2.gz VWJRWDMBJYMTMM-UHFFFAOYSA-N 1 2 237.694 2.082 20 0 BEADLO Cc1[nH]c(CNc2ccnc(F)c2F)[nH+]c1C ZINC000902140685 584529830 /nfs/dbraw/zinc/52/98/30/584529830.db2.gz WSCVMDMQSFPRSS-UHFFFAOYSA-N 1 2 238.241 2.312 20 0 BEADLO Cc1[nH]c(CNc2nnc([C@@H]3C[C@H]3C)o2)[nH+]c1C ZINC000902148431 584530821 /nfs/dbraw/zinc/53/08/21/584530821.db2.gz FKLRHMFVGJMNNG-HZGVNTEJSA-N 1 2 247.302 2.145 20 0 BEADLO Cc1cc(NCc2cnn(C(C)C)c2)nc[nH+]1 ZINC000902195039 584537037 /nfs/dbraw/zinc/53/70/37/584537037.db2.gz KBIHDVJXDMNOEC-UHFFFAOYSA-N 1 2 231.303 2.175 20 0 BEADLO CCc1ncc(NCc2[nH+]ccn2C2CC2)cn1 ZINC000902201695 584537616 /nfs/dbraw/zinc/53/76/16/584537616.db2.gz PEOVXEYBYYWZCR-UHFFFAOYSA-N 1 2 243.314 2.183 20 0 BEADLO CNc1ccc(C)cc1C[NH2+]Cc1cocn1 ZINC000902217238 584539526 /nfs/dbraw/zinc/53/95/26/584539526.db2.gz HLYPPIROMXEFAK-UHFFFAOYSA-N 1 2 231.299 2.315 20 0 BEADLO CC(C)Cc1ncc(NCc2c[nH+]cn2C)cn1 ZINC000902248773 584546960 /nfs/dbraw/zinc/54/69/60/584546960.db2.gz GUSUMWSECYQHEJ-UHFFFAOYSA-N 1 2 245.330 2.021 20 0 BEADLO Cc1ccc(C[N@H+](C)CN2CCOC2=O)cc1C ZINC000902289377 584548282 /nfs/dbraw/zinc/54/82/82/584548282.db2.gz CTCKPPRTKPDTON-UHFFFAOYSA-N 1 2 248.326 2.145 20 0 BEADLO Cc1ccc(C[N@@H+](C)CN2CCOC2=O)cc1C ZINC000902289377 584548283 /nfs/dbraw/zinc/54/82/83/584548283.db2.gz CTCKPPRTKPDTON-UHFFFAOYSA-N 1 2 248.326 2.145 20 0 BEADLO Cn1c[nH+]cc1CNc1cccnc1C1CC1 ZINC000902292274 584548606 /nfs/dbraw/zinc/54/86/06/584548606.db2.gz YSLCZKXHHPXDBX-UHFFFAOYSA-N 1 2 228.299 2.305 20 0 BEADLO Cc1cccc(C[N@H+](C)CN2CCOC2=O)c1C ZINC000902275293 584550457 /nfs/dbraw/zinc/55/04/57/584550457.db2.gz LFXITNSDEGTTHT-UHFFFAOYSA-N 1 2 248.326 2.145 20 0 BEADLO Cc1cccc(C[N@@H+](C)CN2CCOC2=O)c1C ZINC000902275293 584550458 /nfs/dbraw/zinc/55/04/58/584550458.db2.gz LFXITNSDEGTTHT-UHFFFAOYSA-N 1 2 248.326 2.145 20 0 BEADLO CCc1[nH+]c(C)ccc1OCc1cnsn1 ZINC000902355911 584570098 /nfs/dbraw/zinc/57/00/98/584570098.db2.gz WJCIGQPJBBHCFV-UHFFFAOYSA-N 1 2 235.312 2.383 20 0 BEADLO CC(F)(F)CCCO[NH+]=C(N)[C@H]1CCCO1 ZINC000902383983 584577210 /nfs/dbraw/zinc/57/72/10/584577210.db2.gz WXXSWSADXLGWJQ-MRVPVSSYSA-N 1 2 236.262 2.099 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccnc(F)c2)CC(C)(C)O1 ZINC000859091382 589000437 /nfs/dbraw/zinc/00/04/37/589000437.db2.gz LJBMHWRHGPCTEE-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccnc(F)c2)CC(C)(C)O1 ZINC000859091382 589000439 /nfs/dbraw/zinc/00/04/39/589000439.db2.gz LJBMHWRHGPCTEE-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO Cc1[nH]nc(NCc2[nH+]ccn2C2CC2)c1C ZINC000902644480 584650986 /nfs/dbraw/zinc/65/09/86/584650986.db2.gz NPGHHNMMSBGXMC-UHFFFAOYSA-N 1 2 231.303 2.170 20 0 BEADLO CC(C)c1ccccc1CO[NH+]=C(N)CCO ZINC000902729235 584661754 /nfs/dbraw/zinc/66/17/54/584661754.db2.gz MVDXFXHARHFLDY-UHFFFAOYSA-N 1 2 236.315 2.191 20 0 BEADLO CC1CC(CO[NH+]=C(N)COC2CCC2)C1 ZINC000902775444 584668504 /nfs/dbraw/zinc/66/85/04/584668504.db2.gz WDTJQOQDMITKGN-UHFFFAOYSA-N 1 2 226.320 2.100 20 0 BEADLO CC(C)[C@H](O)CCOc1ccc2c(c1)[nH+]cn2C ZINC000902781200 584670001 /nfs/dbraw/zinc/67/00/01/584670001.db2.gz JIMYOYVWYFRHJB-CQSZACIVSA-N 1 2 248.326 2.359 20 0 BEADLO C[C@@H]1OCC[C@H]1COc1ccc2c(c1)[nH+]cn2C ZINC000902781126 584670191 /nfs/dbraw/zinc/67/01/91/584670191.db2.gz GBOWRXWYZUCSDM-QWRGUYRKSA-N 1 2 246.310 2.377 20 0 BEADLO Cn1c[nH+]c2cc(OC[C@H]3CCCO3)ccc21 ZINC000902781087 584670195 /nfs/dbraw/zinc/67/01/95/584670195.db2.gz DSUJNVAJGSGTMR-LLVKDONJSA-N 1 2 232.283 2.131 20 0 BEADLO Cn1c[nH+]c2cc(OCCOC3CC3)ccc21 ZINC000902781382 584670414 /nfs/dbraw/zinc/67/04/14/584670414.db2.gz QNRUNVMIEXBVJN-UHFFFAOYSA-N 1 2 232.283 2.131 20 0 BEADLO COCCCCOc1ccc2c(c1)[nH+]cn2C ZINC000902781148 584670437 /nfs/dbraw/zinc/67/04/37/584670437.db2.gz HJJRLXVFMNCGRT-UHFFFAOYSA-N 1 2 234.299 2.379 20 0 BEADLO COc1ccc2[nH+]ccc(OCC[C@H](C)O)c2c1 ZINC000902901630 584693574 /nfs/dbraw/zinc/69/35/74/584693574.db2.gz XPIFPCIANXEFRT-JTQLQIEISA-N 1 2 247.294 2.393 20 0 BEADLO O[C@H](C[N@@H+]1CCC[C@H](F)C1)c1cccc(F)c1 ZINC000903002053 584716395 /nfs/dbraw/zinc/71/63/95/584716395.db2.gz VCQHRNGCKJHKPH-QWHCGFSZSA-N 1 2 241.281 2.293 20 0 BEADLO O[C@H](C[N@H+]1CCC[C@H](F)C1)c1cccc(F)c1 ZINC000903002053 584716397 /nfs/dbraw/zinc/71/63/97/584716397.db2.gz VCQHRNGCKJHKPH-QWHCGFSZSA-N 1 2 241.281 2.293 20 0 BEADLO C[C@@H](NCc1nc2c(s1)CCC2)c1[nH]cc[nH+]1 ZINC000903191018 584736086 /nfs/dbraw/zinc/73/60/86/584736086.db2.gz KWSWGKSSBVPBLL-MRVPVSSYSA-N 1 2 248.355 2.206 20 0 BEADLO C[C@@H]([NH2+]Cc1nc2c(s1)CCC2)c1ncc[nH]1 ZINC000903191018 584736088 /nfs/dbraw/zinc/73/60/88/584736088.db2.gz KWSWGKSSBVPBLL-MRVPVSSYSA-N 1 2 248.355 2.206 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@H]1CC[C@@H](C2CC2)O1 ZINC000903250868 584738874 /nfs/dbraw/zinc/73/88/74/584738874.db2.gz DSURMINIFCMXOR-BHYNMZESSA-N 1 2 249.358 2.326 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccnc(F)c2)C[C@H](C)O1 ZINC000859134074 589007066 /nfs/dbraw/zinc/00/70/66/589007066.db2.gz DCKWOORYTOSOBY-CMPLNLGQSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccnc(F)c2)C[C@H](C)O1 ZINC000859134074 589007067 /nfs/dbraw/zinc/00/70/67/589007067.db2.gz DCKWOORYTOSOBY-CMPLNLGQSA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccn(C)n1)c1cncs1 ZINC000903312636 584748219 /nfs/dbraw/zinc/74/82/19/584748219.db2.gz XMIPDLJHXBIPLJ-DTWKUNHWSA-N 1 2 236.344 2.288 20 0 BEADLO CCCn1cc([C@@H](C)[NH2+]C/C=C\Cl)nn1 ZINC000903444097 584768736 /nfs/dbraw/zinc/76/87/36/584768736.db2.gz MRHHDTFGSSSDED-XRVBUDJMSA-N 1 2 228.727 2.091 20 0 BEADLO FC(F)(F)CCCCN1CC=CC[NH2+]1 ZINC000903489669 584780519 /nfs/dbraw/zinc/78/05/19/584780519.db2.gz WECPXOWRKGKYAY-UHFFFAOYSA-N 1 2 208.227 2.095 20 0 BEADLO c1ccc2c(c1)CC[C@H]2CCN1CC=CC[NH2+]1 ZINC000903490750 584780882 /nfs/dbraw/zinc/78/08/82/584780882.db2.gz GPIXOIYMJLEODE-AWEZNQCLSA-N 1 2 228.339 2.483 20 0 BEADLO c1ccc([C@H]2CC[C@@H](CN3CC=CC[NH2+]3)O2)cc1 ZINC000903490798 584780998 /nfs/dbraw/zinc/78/09/98/584780998.db2.gz IMILHPSYGFEWAQ-LSDHHAIUSA-N 1 2 244.338 2.283 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+]1CC[C@@H]2CC[C@]21C[NH3+] ZINC000903856429 584809141 /nfs/dbraw/zinc/80/91/41/584809141.db2.gz QWYWNCLFZNXYFE-ZFWWWQNUSA-N 1 2 248.345 2.447 20 0 BEADLO C[C@@H]1[N@H+](Cc2ccnc(F)c2)CCOC1(C)C ZINC000859166012 589012885 /nfs/dbraw/zinc/01/28/85/589012885.db2.gz OJPWFPAMANLMMK-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H]1[N@@H+](Cc2ccnc(F)c2)CCOC1(C)C ZINC000859166012 589012887 /nfs/dbraw/zinc/01/28/87/589012887.db2.gz OJPWFPAMANLMMK-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H](OC)c1nc(-c2ccc(N)[nH+]c2C)no1 ZINC000904259077 584859222 /nfs/dbraw/zinc/85/92/22/584859222.db2.gz XLKXKWJJAXMNBA-SECBINFHSA-N 1 2 248.286 2.120 20 0 BEADLO Cc1[nH+]c(N)ccc1-c1noc(C2(C)CCC2)n1 ZINC000904260929 584859243 /nfs/dbraw/zinc/85/92/43/584859243.db2.gz URDQQTWGCVVGNZ-UHFFFAOYSA-N 1 2 244.298 2.464 20 0 BEADLO Cc1[nH+]c(N)ccc1-c1noc(C2CC=CC2)n1 ZINC000904259993 584859379 /nfs/dbraw/zinc/85/93/79/584859379.db2.gz MZVIIUVHRLOVAM-UHFFFAOYSA-N 1 2 242.282 2.456 20 0 BEADLO CCO[C@H](C)c1nc(-c2ccc(N)[nH+]c2C)no1 ZINC000904258843 584859530 /nfs/dbraw/zinc/85/95/30/584859530.db2.gz UFRGRGMMAXLCHC-MRVPVSSYSA-N 1 2 248.286 2.120 20 0 BEADLO CCCOC(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000859180925 589015239 /nfs/dbraw/zinc/01/52/39/589015239.db2.gz RPMNNWGWERXWRW-IUCAKERBSA-N 1 2 223.276 2.025 20 0 BEADLO C[C@H](OC(=O)[C@H]1CCCC[N@@H+]1C)c1ccncc1 ZINC000757711715 584903454 /nfs/dbraw/zinc/90/34/54/584903454.db2.gz RQKWWLAAAKDBDL-WCQYABFASA-N 1 2 248.326 2.170 20 0 BEADLO C[C@H](OC(=O)[C@H]1CCCC[N@H+]1C)c1ccncc1 ZINC000757711715 584903456 /nfs/dbraw/zinc/90/34/56/584903456.db2.gz RQKWWLAAAKDBDL-WCQYABFASA-N 1 2 248.326 2.170 20 0 BEADLO CC(C)[N@H+](CC(F)F)C[C@@H]1CC2(CC2)C(=O)O1 ZINC000763711211 584923956 /nfs/dbraw/zinc/92/39/56/584923956.db2.gz UBWKXIUESWIJPP-VIFPVBQESA-N 1 2 247.285 2.058 20 0 BEADLO CC(C)[N@@H+](CC(F)F)C[C@@H]1CC2(CC2)C(=O)O1 ZINC000763711211 584923957 /nfs/dbraw/zinc/92/39/57/584923957.db2.gz UBWKXIUESWIJPP-VIFPVBQESA-N 1 2 247.285 2.058 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1ncoc1C(C)C ZINC000732084796 584933507 /nfs/dbraw/zinc/93/35/07/584933507.db2.gz DCYWNYRDQLGGNZ-UHFFFAOYSA-N 1 2 245.282 2.176 20 0 BEADLO O[C@H](COc1ccc(-n2cc[nH+]c2)cc1)C1CC1 ZINC000840753387 584941520 /nfs/dbraw/zinc/94/15/20/584941520.db2.gz PVDDAJZTFGGQKI-CQSZACIVSA-N 1 2 244.294 2.022 20 0 BEADLO CCc1cc(CNc2cc[nH+]c(C3CC3)n2)[nH]n1 ZINC000732920972 584941791 /nfs/dbraw/zinc/94/17/91/584941791.db2.gz QFBFCKVMJAZDES-UHFFFAOYSA-N 1 2 243.314 2.252 20 0 BEADLO O[C@@H](COc1cccc(-n2cc[nH+]c2)c1)C1CC1 ZINC000840759902 584946800 /nfs/dbraw/zinc/94/68/00/584946800.db2.gz LJQWDKWJCFMPIL-AWEZNQCLSA-N 1 2 244.294 2.022 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000734159478 584959076 /nfs/dbraw/zinc/95/90/76/584959076.db2.gz ONPUXXFJPHWUMS-UBHSHLNASA-N 1 2 247.338 2.331 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+]C[C@H]1CCc2ccccc21 ZINC000734158664 584959279 /nfs/dbraw/zinc/95/92/79/584959279.db2.gz KCWLLRNKAJNAGH-DGCLKSJQSA-N 1 2 247.338 2.258 20 0 BEADLO Cc1cc(NCCNc2ccccc2)nc[nH+]1 ZINC000736294164 584995868 /nfs/dbraw/zinc/99/58/68/584995868.db2.gz DVCNDGILAZWNLO-UHFFFAOYSA-N 1 2 228.299 2.309 20 0 BEADLO C[C@@H]1CC(C(=O)NCc2cn(C)c[nH+]2)C[C@@H](C)C1 ZINC000890109268 585023765 /nfs/dbraw/zinc/02/37/65/585023765.db2.gz ILERLMXLJFZJLA-QWRGUYRKSA-N 1 2 249.358 2.109 20 0 BEADLO C[C@H]1CC(C(=O)NCc2cn(C)c[nH+]2)C[C@H](C)C1 ZINC000890109267 585023797 /nfs/dbraw/zinc/02/37/97/585023797.db2.gz ILERLMXLJFZJLA-GHMZBOCLSA-N 1 2 249.358 2.109 20 0 BEADLO COc1ccc[nH+]c1NCc1cccc(O)c1 ZINC000383515138 585037157 /nfs/dbraw/zinc/03/71/57/585037157.db2.gz PRVMZFNPKZFTEJ-UHFFFAOYSA-N 1 2 230.267 2.408 20 0 BEADLO Nc1cc(COC(=O)C[C@@H]2CC[C@H]3C[C@H]32)cc[nH+]1 ZINC000838122334 585046408 /nfs/dbraw/zinc/04/64/08/585046408.db2.gz JUXTUHSUQVNQOU-SDDRHHMPSA-N 1 2 246.310 2.143 20 0 BEADLO CCn1ncc(C[N@@H+]2CC[C@@H]2c2ccccc2)n1 ZINC000838781460 585069783 /nfs/dbraw/zinc/06/97/83/585069783.db2.gz YJCRZQMSSAZULG-CQSZACIVSA-N 1 2 242.326 2.245 20 0 BEADLO CCn1ncc(C[N@H+]2CC[C@@H]2c2ccccc2)n1 ZINC000838781460 585069784 /nfs/dbraw/zinc/06/97/84/585069784.db2.gz YJCRZQMSSAZULG-CQSZACIVSA-N 1 2 242.326 2.245 20 0 BEADLO C/C=C(/C)C(=O)OCCc1cn2ccccc2[nH+]1 ZINC000838921128 585078206 /nfs/dbraw/zinc/07/82/06/585078206.db2.gz JVPMAKPWLMEVRH-JYOAFUTRSA-N 1 2 244.294 2.386 20 0 BEADLO CN(C)c1[nH+]cccc1COC(=O)C=C1CCC1 ZINC000838954607 585080706 /nfs/dbraw/zinc/08/07/06/585080706.db2.gz UXEZGUYNCGPWRH-UHFFFAOYSA-N 1 2 246.310 2.301 20 0 BEADLO CCOC1C[NH+](Cc2cncc3ccccc32)C1 ZINC000839131589 585093697 /nfs/dbraw/zinc/09/36/97/585093697.db2.gz WZBZOBDFWZSGIO-UHFFFAOYSA-N 1 2 242.322 2.456 20 0 BEADLO CC(C)C1(O)C[NH+](Cc2cc3cccnc3o2)C1 ZINC000839132857 585094157 /nfs/dbraw/zinc/09/41/57/585094157.db2.gz GPZGHWPUXBPBMS-UHFFFAOYSA-N 1 2 246.310 2.031 20 0 BEADLO Fc1cc(C[NH+]2CC3(CC(F)C3)C2)c(F)cn1 ZINC000839140128 585094463 /nfs/dbraw/zinc/09/44/63/585094463.db2.gz ODSLMURSDLVHNE-UHFFFAOYSA-N 1 2 242.244 2.294 20 0 BEADLO Cc1cc(C[NH+]2CC(CC(F)(F)F)C2)no1 ZINC000839137221 585094489 /nfs/dbraw/zinc/09/44/89/585094489.db2.gz AJKNVWWESRHMNE-UHFFFAOYSA-N 1 2 234.221 2.367 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ccn(C)n2)c(C)o1 ZINC000839189631 585097205 /nfs/dbraw/zinc/09/72/05/585097205.db2.gz AYHCMBMRXYKYRO-JTQLQIEISA-N 1 2 233.315 2.481 20 0 BEADLO C[C@H](CNC(=O)C[C@H](C)C1CC1)Cn1cc[nH+]c1 ZINC000740727502 585106005 /nfs/dbraw/zinc/10/60/05/585106005.db2.gz RGQHPLBMHSOZLD-NEPJUHHUSA-N 1 2 249.358 2.072 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+]CCc1cc(C)cc(C)c1 ZINC000740898819 585107953 /nfs/dbraw/zinc/10/79/53/585107953.db2.gz ZRZWJLMABJMJDN-CYBMUJFWSA-N 1 2 249.354 2.387 20 0 BEADLO Cc1ccccc1[C@H](O)C[N@@H+](C)Cc1ccon1 ZINC000741796054 585119600 /nfs/dbraw/zinc/11/96/00/585119600.db2.gz REVPBFSQIMGSSN-CQSZACIVSA-N 1 2 246.310 2.148 20 0 BEADLO Cc1ccccc1[C@H](O)C[N@H+](C)Cc1ccon1 ZINC000741796054 585119601 /nfs/dbraw/zinc/11/96/01/585119601.db2.gz REVPBFSQIMGSSN-CQSZACIVSA-N 1 2 246.310 2.148 20 0 BEADLO C/C(=C\C(=O)NCc1[nH+]ccn1C)C(C)(C)C ZINC000742633293 585129230 /nfs/dbraw/zinc/12/92/30/585129230.db2.gz DSZXREVRKTXUAD-CSKARUKUSA-N 1 2 235.331 2.029 20 0 BEADLO Cc1ccc([C@H](C)C(=O)N(C)Cc2[nH]cc[nH+]2)o1 ZINC000742649428 585129411 /nfs/dbraw/zinc/12/94/11/585129411.db2.gz APWVUGSHPDMLAN-JTQLQIEISA-N 1 2 247.298 2.073 20 0 BEADLO O=C1CCCN1C[N@H+]1CC[C@H]1c1cccc(F)c1 ZINC000743391981 585136618 /nfs/dbraw/zinc/13/66/18/585136618.db2.gz YVSNJCVVWKGXBD-ZDUSSCGKSA-N 1 2 248.301 2.152 20 0 BEADLO O=C1CCCN1C[N@@H+]1CC[C@H]1c1cccc(F)c1 ZINC000743391981 585136619 /nfs/dbraw/zinc/13/66/19/585136619.db2.gz YVSNJCVVWKGXBD-ZDUSSCGKSA-N 1 2 248.301 2.152 20 0 BEADLO C/C(=C\C(=O)NCCc1[nH]cc[nH+]1)C(C)(C)C ZINC000746242719 585166477 /nfs/dbraw/zinc/16/64/77/585166477.db2.gz LKRPVNLRLUPUNB-MDZDMXLPSA-N 1 2 235.331 2.061 20 0 BEADLO FCC[NH+]1CCN(c2ccc(Cl)cc2)CC1 ZINC000746503336 585169331 /nfs/dbraw/zinc/16/93/31/585169331.db2.gz YUXUIKGIOVLWOQ-UHFFFAOYSA-N 1 2 242.725 2.432 20 0 BEADLO O=c1sccn1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000746602850 585170741 /nfs/dbraw/zinc/17/07/41/585170741.db2.gz HAAOXXYGFDKWNX-GFCCVEGCSA-N 1 2 246.335 2.314 20 0 BEADLO O=c1sccn1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000746602850 585170742 /nfs/dbraw/zinc/17/07/42/585170742.db2.gz HAAOXXYGFDKWNX-GFCCVEGCSA-N 1 2 246.335 2.314 20 0 BEADLO Cc1cc(NC(=O)C=Cc2ccco2)c(C)c[nH+]1 ZINC000747110967 585175022 /nfs/dbraw/zinc/17/50/22/585175022.db2.gz BWTPQJZJEVQVAL-AATRIKPKSA-N 1 2 242.278 2.365 20 0 BEADLO Cc1oc(C)c(C(=O)OCc2c[nH+]cn2C)c1C ZINC000747784514 585184307 /nfs/dbraw/zinc/18/43/07/585184307.db2.gz XPWIPSZMNMAAFA-UHFFFAOYSA-N 1 2 248.282 2.295 20 0 BEADLO Cn1cc[nH+]c1CSc1ccc(Cl)nn1 ZINC000747804639 585184461 /nfs/dbraw/zinc/18/44/61/585184461.db2.gz BIEJFOXJDVEWSI-UHFFFAOYSA-N 1 2 240.719 2.156 20 0 BEADLO CCN(CCc1ccccn1)c1cc[nH+]c(C)n1 ZINC000748279055 585190120 /nfs/dbraw/zinc/19/01/20/585190120.db2.gz AKBLJJOOKZILLV-UHFFFAOYSA-N 1 2 242.326 2.249 20 0 BEADLO Clc1ccc(C[N@@H+]2CCc3cn[nH]c3C2)cn1 ZINC000750721241 585218722 /nfs/dbraw/zinc/21/87/22/585218722.db2.gz MGOFVVXFRHRDAJ-UHFFFAOYSA-N 1 2 248.717 2.016 20 0 BEADLO Clc1ccc(C[N@H+]2CCc3cn[nH]c3C2)cn1 ZINC000750721241 585218723 /nfs/dbraw/zinc/21/87/23/585218723.db2.gz MGOFVVXFRHRDAJ-UHFFFAOYSA-N 1 2 248.717 2.016 20 0 BEADLO Cc1ccccc1CC(N)=[NH+]OCc1ccno1 ZINC000751126703 585224575 /nfs/dbraw/zinc/22/45/75/585224575.db2.gz PJVQHAFPDUATPS-UHFFFAOYSA-N 1 2 245.282 2.224 20 0 BEADLO CC(C)=C(C)C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000751377168 585228157 /nfs/dbraw/zinc/22/81/57/585228157.db2.gz VBTDHEFCUQKDRW-LBPRGKRZSA-N 1 2 247.342 2.472 20 0 BEADLO CCn1cnn(C[N@@H+]2CC[C@@H](C)[C@@H]2C)c1=S ZINC000751940304 585239506 /nfs/dbraw/zinc/23/95/06/585239506.db2.gz HIQRNMGLIMEPOL-ZJUUUORDSA-N 1 2 240.376 2.122 20 0 BEADLO CCn1cnn(C[N@H+]2CC[C@@H](C)[C@@H]2C)c1=S ZINC000751940304 585239507 /nfs/dbraw/zinc/23/95/07/585239507.db2.gz HIQRNMGLIMEPOL-ZJUUUORDSA-N 1 2 240.376 2.122 20 0 BEADLO C[C@H]1C[N@H+](CC(F)(F)C(F)F)C[C@H]1C ZINC000752077296 585241502 /nfs/dbraw/zinc/24/15/02/585241502.db2.gz WWPYKHULTPOLST-KNVOCYPGSA-N 1 2 213.218 2.475 20 0 BEADLO C[C@H]1C[N@@H+](CC(F)(F)C(F)F)C[C@H]1C ZINC000752077296 585241503 /nfs/dbraw/zinc/24/15/03/585241503.db2.gz WWPYKHULTPOLST-KNVOCYPGSA-N 1 2 213.218 2.475 20 0 BEADLO CC(C)C[C@@H](C)NC(=O)c1cccc2[nH+]ccn21 ZINC000752226928 585243819 /nfs/dbraw/zinc/24/38/19/585243819.db2.gz QNVNHYVNYRHPJH-LLVKDONJSA-N 1 2 245.326 2.499 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)/C=C1/CC[C@@H](C)C1 ZINC000753585347 585262933 /nfs/dbraw/zinc/26/29/33/585262933.db2.gz VECDPQKXXLATSI-LSOFDGFXSA-N 1 2 247.342 2.134 20 0 BEADLO C[N@H+](CC(F)F)CC1CCC2(CC1)OCCO2 ZINC000753704505 585266871 /nfs/dbraw/zinc/26/68/71/585266871.db2.gz IGRURMODRNESOC-UHFFFAOYSA-N 1 2 249.301 2.117 20 0 BEADLO C[N@@H+](CC(F)F)CC1CCC2(CC1)OCCO2 ZINC000753704505 585266872 /nfs/dbraw/zinc/26/68/72/585266872.db2.gz IGRURMODRNESOC-UHFFFAOYSA-N 1 2 249.301 2.117 20 0 BEADLO O=C(/C=C\C1CCCCC1)NCc1c[nH+]c[nH]1 ZINC000754295041 585282112 /nfs/dbraw/zinc/28/21/12/585282112.db2.gz VXVWYSBYWXAWMS-SREVYHEPSA-N 1 2 233.315 2.162 20 0 BEADLO O=C(C=CC1CCCCC1)NCc1c[nH]c[nH+]1 ZINC000754295041 585282113 /nfs/dbraw/zinc/28/21/13/585282113.db2.gz VXVWYSBYWXAWMS-SREVYHEPSA-N 1 2 233.315 2.162 20 0 BEADLO CC(C)c1cnc(C[N@@H+]2CCOC[C@@H](C)C2)o1 ZINC000754386363 585283918 /nfs/dbraw/zinc/28/39/18/585283918.db2.gz WEORJYLQIOMAOB-NSHDSACASA-N 1 2 238.331 2.266 20 0 BEADLO CC(C)c1cnc(C[N@H+]2CCOC[C@@H](C)C2)o1 ZINC000754386363 585283919 /nfs/dbraw/zinc/28/39/19/585283919.db2.gz WEORJYLQIOMAOB-NSHDSACASA-N 1 2 238.331 2.266 20 0 BEADLO CN(C)c1cc(COC(=O)/C=C/C2CC2)cc[nH+]1 ZINC000755887030 585309223 /nfs/dbraw/zinc/30/92/23/585309223.db2.gz MRRYCEBJJNWVIE-AATRIKPKSA-N 1 2 246.310 2.157 20 0 BEADLO CN(C)c1cc(COC(=O)C(C)(C)C)cc[nH+]1 ZINC000755885781 585309385 /nfs/dbraw/zinc/30/93/85/585309385.db2.gz FCRCCYUBGLASFV-UHFFFAOYSA-N 1 2 236.315 2.237 20 0 BEADLO C[C@H](C(=O)OCc1cc[nH+]c(N(C)C)c1)C1CC1 ZINC000755915591 585310318 /nfs/dbraw/zinc/31/03/18/585310318.db2.gz YFZGGMRGRBQEKS-JTQLQIEISA-N 1 2 248.326 2.237 20 0 BEADLO C[C@@H]([NH2+]Cc1coc(C2CC2)n1)c1cn[nH]c1 ZINC000756994811 585326227 /nfs/dbraw/zinc/32/62/27/585326227.db2.gz BOWXHGMUZLMUSG-MRVPVSSYSA-N 1 2 232.287 2.126 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CC[C@H](C(F)(F)F)C2)[nH]1 ZINC000839534494 585329306 /nfs/dbraw/zinc/32/93/06/585329306.db2.gz STILTFHCQAWSGC-XPUUQOCRSA-N 1 2 248.252 2.058 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CC[C@H](C(F)(F)F)C2)[nH]1 ZINC000839534494 585329307 /nfs/dbraw/zinc/32/93/07/585329307.db2.gz STILTFHCQAWSGC-XPUUQOCRSA-N 1 2 248.252 2.058 20 0 BEADLO C/C=C(/C)C(=O)OCc1cc(OC)cc(C)[nH+]1 ZINC000757717217 585344910 /nfs/dbraw/zinc/34/49/10/585344910.db2.gz WPSPDHXMMDODFS-UITAMQMPSA-N 1 2 235.283 2.408 20 0 BEADLO CCCC(=O)OCc1cn2cc(C)ccc2[nH+]1 ZINC000757932293 585347125 /nfs/dbraw/zinc/34/71/25/585347125.db2.gz WMSYTEOVQRIXDF-UHFFFAOYSA-N 1 2 232.283 2.486 20 0 BEADLO Cc1ccc2[nH+]c(COC(=O)[C@H]3C[C@@H]3C)cn2c1 ZINC000758031818 585348568 /nfs/dbraw/zinc/34/85/68/585348568.db2.gz ZQQLSZYXRZICGA-JQWIXIFHSA-N 1 2 244.294 2.342 20 0 BEADLO FCC[NH+]1CCN(c2cccc(F)c2F)CC1 ZINC000759343228 585369692 /nfs/dbraw/zinc/36/96/92/585369692.db2.gz SJSUUEXFWQAOHB-UHFFFAOYSA-N 1 2 244.260 2.056 20 0 BEADLO C[C@H](c1ccc([S@@](C)=O)cc1)[N@H+](C)CCF ZINC000759345656 585370284 /nfs/dbraw/zinc/37/02/84/585370284.db2.gz JYGRNOAFXMZFPE-QLJPJBMISA-N 1 2 243.347 2.386 20 0 BEADLO C[C@H](c1ccc([S@@](C)=O)cc1)[N@@H+](C)CCF ZINC000759345656 585370285 /nfs/dbraw/zinc/37/02/85/585370285.db2.gz JYGRNOAFXMZFPE-QLJPJBMISA-N 1 2 243.347 2.386 20 0 BEADLO C[C@@H](SCc1cc[nH+]c(N(C)C)c1)[C@H](C)O ZINC000762478334 585432825 /nfs/dbraw/zinc/43/28/25/585432825.db2.gz FWTABWMTLYNEGE-VHSXEESVSA-N 1 2 240.372 2.150 20 0 BEADLO CC(=O)[C@@H](C)SCc1cc[nH+]c(N(C)C)c1 ZINC000762481909 585432955 /nfs/dbraw/zinc/43/29/55/585432955.db2.gz VNRKIFAACMCUNV-SNVBAGLBSA-N 1 2 238.356 2.358 20 0 BEADLO Cc1oc(C)c(C(=O)OCCn2cc[nH+]c2)c1C ZINC000763111609 585443248 /nfs/dbraw/zinc/44/32/48/585443248.db2.gz BSGWVTREPOENDY-UHFFFAOYSA-N 1 2 248.282 2.258 20 0 BEADLO Cc1ccc(C)c(C(=O)OCCn2cc[nH+]c2)c1 ZINC000763115087 585443367 /nfs/dbraw/zinc/44/33/67/585443367.db2.gz KKIAGGOOFQKLCV-UHFFFAOYSA-N 1 2 244.294 2.357 20 0 BEADLO Cc1cccc(C(=O)OCCCn2cc[nH+]c2)c1 ZINC000763288400 585445933 /nfs/dbraw/zinc/44/59/33/585445933.db2.gz UTRNYGOUORIALC-UHFFFAOYSA-N 1 2 244.294 2.439 20 0 BEADLO CCC[N@H+](CCC(=O)C1CC1)CC(F)F ZINC000767384451 585518796 /nfs/dbraw/zinc/51/87/96/585518796.db2.gz XMTZOBYFDGYJPQ-UHFFFAOYSA-N 1 2 219.275 2.333 20 0 BEADLO CCC[N@@H+](CCC(=O)C1CC1)CC(F)F ZINC000767384451 585518797 /nfs/dbraw/zinc/51/87/97/585518797.db2.gz XMTZOBYFDGYJPQ-UHFFFAOYSA-N 1 2 219.275 2.333 20 0 BEADLO CN(C/C(Cl)=C/Cl)Cc1[nH+]ccn1C ZINC000767549583 585522429 /nfs/dbraw/zinc/52/24/29/585522429.db2.gz KBDLVQTUDFVGFB-YVMONPNESA-N 1 2 234.130 2.171 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@H+](C)CCOC(C)(C)C ZINC000767905544 585528027 /nfs/dbraw/zinc/52/80/27/585528027.db2.gz PMBMEQKZJDJTSV-LLVKDONJSA-N 1 2 245.363 2.075 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@@H+](C)CCOC(C)(C)C ZINC000767905544 585528028 /nfs/dbraw/zinc/52/80/28/585528028.db2.gz PMBMEQKZJDJTSV-LLVKDONJSA-N 1 2 245.363 2.075 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@H](C)c1ccc[nH]1 ZINC000767915180 585528078 /nfs/dbraw/zinc/52/80/78/585528078.db2.gz FHYQTLDKUAAWNJ-JTQLQIEISA-N 1 2 244.298 2.023 20 0 BEADLO c1oc(C2CC2)nc1C[NH+]1CCSCC1 ZINC000768238516 585534429 /nfs/dbraw/zinc/53/44/29/585534429.db2.gz ZXLSWDYTZFMPRP-UHFFFAOYSA-N 1 2 224.329 2.101 20 0 BEADLO C[N@@H+](Cc1coc(C2CC2)n1)C[C@@H]1CCCO1 ZINC000768247568 585534985 /nfs/dbraw/zinc/53/49/85/585534985.db2.gz BTABUFNJUIHZPI-LBPRGKRZSA-N 1 2 236.315 2.163 20 0 BEADLO C[N@H+](Cc1coc(C2CC2)n1)C[C@@H]1CCCO1 ZINC000768247568 585534986 /nfs/dbraw/zinc/53/49/86/585534986.db2.gz BTABUFNJUIHZPI-LBPRGKRZSA-N 1 2 236.315 2.163 20 0 BEADLO CCSCCO[NH+]=C(N)COC(C)(C)C ZINC000768931826 585546039 /nfs/dbraw/zinc/54/60/39/585546039.db2.gz LPRPHHWHXKLDAM-UHFFFAOYSA-N 1 2 234.365 2.053 20 0 BEADLO CC(C)(C)OCCO[NH+]=C(N)COC(C)(C)C ZINC000768932825 585546132 /nfs/dbraw/zinc/54/61/32/585546132.db2.gz QCOKPFUVOQCKNA-UHFFFAOYSA-N 1 2 246.351 2.115 20 0 BEADLO CC[C@@H](C)CO[NH+]=C(N)COC(C)(C)C ZINC000768931301 585546145 /nfs/dbraw/zinc/54/61/45/585546145.db2.gz KBXXHFORDVUJCU-SECBINFHSA-N 1 2 216.325 2.346 20 0 BEADLO CC(C)(C)OCC(N)=[NH+]OC1CCCC1 ZINC000768934461 585546560 /nfs/dbraw/zinc/54/65/60/585546560.db2.gz PIUOIFDKUJSHNF-UHFFFAOYSA-N 1 2 214.309 2.243 20 0 BEADLO Cc1cccc2c1CC[N@@H+](Cc1ccn(C)n1)C2 ZINC000769337627 585554284 /nfs/dbraw/zinc/55/42/84/585554284.db2.gz GLJAKLIFEIYBDV-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO Cc1cccc2c1CC[N@H+](Cc1ccn(C)n1)C2 ZINC000769337627 585554285 /nfs/dbraw/zinc/55/42/85/585554285.db2.gz GLJAKLIFEIYBDV-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO C[N@H+](Cc1ccon1)Cc1ccc2c(c1)COC2 ZINC000769467805 585557687 /nfs/dbraw/zinc/55/76/87/585557687.db2.gz ZALIQFLVHYQZTH-UHFFFAOYSA-N 1 2 244.294 2.337 20 0 BEADLO C[N@@H+](Cc1ccon1)Cc1ccc2c(c1)COC2 ZINC000769467805 585557688 /nfs/dbraw/zinc/55/76/88/585557688.db2.gz ZALIQFLVHYQZTH-UHFFFAOYSA-N 1 2 244.294 2.337 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2ccnc(F)c2)C[C@H]1F ZINC000859240151 589023283 /nfs/dbraw/zinc/02/32/83/589023283.db2.gz UMNPDLGHJAMSDC-MWLCHTKSSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2ccnc(F)c2)C[C@H]1F ZINC000859240151 589023285 /nfs/dbraw/zinc/02/32/85/589023285.db2.gz UMNPDLGHJAMSDC-MWLCHTKSSA-N 1 2 226.270 2.401 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H](F)c1ccccc1 ZINC000769585671 585560090 /nfs/dbraw/zinc/56/00/90/585560090.db2.gz INTWLLCRPUCBBA-GFCCVEGCSA-N 1 2 247.273 2.045 20 0 BEADLO Cc1cc(C)cc(C[N@@H+](C)[C@H]2CCOC2=O)c1 ZINC000769845223 585565322 /nfs/dbraw/zinc/56/53/22/585565322.db2.gz FRZLZKBJUCQWNU-ZDUSSCGKSA-N 1 2 233.311 2.051 20 0 BEADLO Cc1cc(C)cc(C[N@H+](C)[C@H]2CCOC2=O)c1 ZINC000769845223 585565323 /nfs/dbraw/zinc/56/53/23/585565323.db2.gz FRZLZKBJUCQWNU-ZDUSSCGKSA-N 1 2 233.311 2.051 20 0 BEADLO CCc1noc(C)c1[C@@H](C)[NH2+]Cc1nccn1C ZINC000769872700 585565772 /nfs/dbraw/zinc/56/57/72/585565772.db2.gz KGCDALOBQGLCLA-SECBINFHSA-N 1 2 248.330 2.130 20 0 BEADLO CC(C)CC(=O)OCc1cccc2[nH+]ccn21 ZINC000770926988 585584573 /nfs/dbraw/zinc/58/45/73/585584573.db2.gz VIVQNENAYYNWFR-UHFFFAOYSA-N 1 2 232.283 2.424 20 0 BEADLO CCCCCCC(=O)OCCn1cc[nH+]c1 ZINC000771916539 585604322 /nfs/dbraw/zinc/60/43/22/585604322.db2.gz AGGYCCDJAHDEPM-UHFFFAOYSA-N 1 2 224.304 2.397 20 0 BEADLO CC1(C)CCC[C@@H]1C(=O)NC1=[NH+]CCS1 ZINC000771926642 585604530 /nfs/dbraw/zinc/60/45/30/585604530.db2.gz HIDRBRMKPQNPOD-MRVPVSSYSA-N 1 2 226.345 2.032 20 0 BEADLO O=C(C=C1CCCCC1)OCCn1cc[nH+]c1 ZINC000771933420 585604870 /nfs/dbraw/zinc/60/48/70/585604870.db2.gz LMRDMZAMGDCLDY-UHFFFAOYSA-N 1 2 234.299 2.317 20 0 BEADLO C[C@H](C(=O)OCCn1cc[nH+]c1)C(C)(C)C ZINC000771964137 585605857 /nfs/dbraw/zinc/60/58/57/585605857.db2.gz GUFXLSUAANTPKL-SNVBAGLBSA-N 1 2 224.304 2.109 20 0 BEADLO Cc1ccc(C(=O)OCCn2cc[nH+]c2)c(F)c1 ZINC000771991403 585605950 /nfs/dbraw/zinc/60/59/50/585605950.db2.gz DKEYFGIBTDZUAP-UHFFFAOYSA-N 1 2 248.257 2.188 20 0 BEADLO CCC(CC)[C@H](C)C(=O)OCCn1cc[nH+]c1 ZINC000772030054 585607273 /nfs/dbraw/zinc/60/72/73/585607273.db2.gz NOSVKBWMCGHDJQ-NSHDSACASA-N 1 2 238.331 2.499 20 0 BEADLO Cc1ccc(COC(=O)[C@@H]2CCCOC2)c(C)[nH+]1 ZINC000772088320 585608253 /nfs/dbraw/zinc/60/82/53/585608253.db2.gz MNNSVYJVLXJJQY-CYBMUJFWSA-N 1 2 249.310 2.168 20 0 BEADLO COC(C)(C)C(=O)OCc1ccc(C)[nH+]c1C ZINC000772098478 585608366 /nfs/dbraw/zinc/60/83/66/585608366.db2.gz ROUMFBQDRFDWDZ-UHFFFAOYSA-N 1 2 237.299 2.167 20 0 BEADLO Cc1ccc(COC(=O)[C@@]2(C)CCCO2)c(C)[nH+]1 ZINC000772187633 585609783 /nfs/dbraw/zinc/60/97/83/585609783.db2.gz VYFNVWQEZAGMRZ-CQSZACIVSA-N 1 2 249.310 2.311 20 0 BEADLO Cc1ccc(COC(=O)[C@@H]2CCCCO2)c(C)[nH+]1 ZINC000772208175 585609948 /nfs/dbraw/zinc/60/99/48/585609948.db2.gz SPORMLKDJBJFJC-ZDUSSCGKSA-N 1 2 249.310 2.311 20 0 BEADLO Cc1ccc(COC(=O)[C@@H]2CCO[C@H]2C)c(C)[nH+]1 ZINC000772237354 585610629 /nfs/dbraw/zinc/61/06/29/585610629.db2.gz XEZGJBNEFCJEOV-WCQYABFASA-N 1 2 249.310 2.167 20 0 BEADLO CCN(C[C@H]1CCOC1)c1cc[nH+]c(C(C)C)n1 ZINC000772899808 585626907 /nfs/dbraw/zinc/62/69/07/585626907.db2.gz ZIRMRFREEAPPDG-GFCCVEGCSA-N 1 2 249.358 2.463 20 0 BEADLO CC(C)c1nc(N2CCCOC[C@H]2C)cc[nH+]1 ZINC000772908647 585627284 /nfs/dbraw/zinc/62/72/84/585627284.db2.gz DCRAPAUTFGODAJ-LLVKDONJSA-N 1 2 235.331 2.215 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C1(F)CCCC1 ZINC000772988153 585629033 /nfs/dbraw/zinc/62/90/33/585629033.db2.gz KJZVVPNHMBAKFG-UHFFFAOYSA-N 1 2 236.290 2.287 20 0 BEADLO C/C(=C/C(C)(C)C)C(=O)OCc1c[nH+]cn1C ZINC000774139386 585651512 /nfs/dbraw/zinc/65/15/12/585651512.db2.gz PXOWKRRAFOFUOL-POHAHGRESA-N 1 2 236.315 2.456 20 0 BEADLO Cc1ccc(CONC(=O)C(C)(C)C)c(C)[nH+]1 ZINC000774758525 585665342 /nfs/dbraw/zinc/66/53/42/585665342.db2.gz LGDIRZGPZCPTHL-UHFFFAOYSA-N 1 2 236.315 2.292 20 0 BEADLO CCCC[N@H+](CCCO)CC(F)(F)C(F)F ZINC000775561674 585679681 /nfs/dbraw/zinc/67/96/81/585679681.db2.gz VIRZPZBVOJKLLD-UHFFFAOYSA-N 1 2 245.260 2.371 20 0 BEADLO CCCC[N@@H+](CCCO)CC(F)(F)C(F)F ZINC000775561674 585679682 /nfs/dbraw/zinc/67/96/82/585679682.db2.gz VIRZPZBVOJKLLD-UHFFFAOYSA-N 1 2 245.260 2.371 20 0 BEADLO COC(=O)[C@@H]1C[C@H](C)CC[N@@H+]1Cc1ccoc1 ZINC000775996962 585689097 /nfs/dbraw/zinc/68/90/97/585689097.db2.gz ATAPLWXBUOWALE-PWSUYJOCSA-N 1 2 237.299 2.053 20 0 BEADLO COC(=O)[C@@H]1C[C@H](C)CC[N@H+]1Cc1ccoc1 ZINC000775996962 585689098 /nfs/dbraw/zinc/68/90/98/585689098.db2.gz ATAPLWXBUOWALE-PWSUYJOCSA-N 1 2 237.299 2.053 20 0 BEADLO CC(C)COC(=O)C[N@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000776587422 585702055 /nfs/dbraw/zinc/70/20/55/585702055.db2.gz GCCWKWFVCGOXAD-PHIMTYICSA-N 1 2 245.388 2.011 20 0 BEADLO CC(C)COC(=O)C[N@@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000776587422 585702056 /nfs/dbraw/zinc/70/20/56/585702056.db2.gz GCCWKWFVCGOXAD-PHIMTYICSA-N 1 2 245.388 2.011 20 0 BEADLO C[N@@H+](Cc1ccc(Cl)s1)Cn1cnnc1 ZINC000776756143 585703969 /nfs/dbraw/zinc/70/39/69/585703969.db2.gz KYGWBXABKIGZLV-UHFFFAOYSA-N 1 2 242.735 2.083 20 0 BEADLO C[N@H+](Cc1ccc(Cl)s1)Cn1cnnc1 ZINC000776756143 585703970 /nfs/dbraw/zinc/70/39/70/585703970.db2.gz KYGWBXABKIGZLV-UHFFFAOYSA-N 1 2 242.735 2.083 20 0 BEADLO Cc1ccc(OCCOCc2[nH]cc[nH+]2)cc1 ZINC000776863142 585706289 /nfs/dbraw/zinc/70/62/89/585706289.db2.gz VGUJWQJPVLABLM-UHFFFAOYSA-N 1 2 232.283 2.314 20 0 BEADLO Clc1ncccc1COCc1[nH]cc[nH+]1 ZINC000776859597 585706315 /nfs/dbraw/zinc/70/63/15/585706315.db2.gz FQEGANFTNCJYPY-UHFFFAOYSA-N 1 2 223.663 2.175 20 0 BEADLO C[C@@H]1[C@@H](C)CCN1C(=O)c1cccc2[nH+]ccn21 ZINC000776982269 585707187 /nfs/dbraw/zinc/70/71/87/585707187.db2.gz FJGNNKRDZGNKKP-WDEREUQCSA-N 1 2 243.310 2.205 20 0 BEADLO C[C@H]1CCN(C(=O)c2cccc3[nH+]ccn32)[C@H]1C ZINC000776982267 585707212 /nfs/dbraw/zinc/70/72/12/585707212.db2.gz FJGNNKRDZGNKKP-QWRGUYRKSA-N 1 2 243.310 2.205 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OCc1ccc(CF)cc1 ZINC000777543054 585714634 /nfs/dbraw/zinc/71/46/34/585714634.db2.gz WWVCCZSANZBMQV-VIFPVBQESA-N 1 2 240.278 2.189 20 0 BEADLO CC(C)c1cnc(C[NH2+][C@@H](C)c2cn[nH]c2)o1 ZINC000778143484 585726083 /nfs/dbraw/zinc/72/60/83/585726083.db2.gz XHFLEKVOOOCYQH-VIFPVBQESA-N 1 2 234.303 2.372 20 0 BEADLO CCCCOC(=O)[C@H](C)[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000778230813 585728494 /nfs/dbraw/zinc/72/84/94/585728494.db2.gz CKZMGMPOVPXPBY-GRYCIOLGSA-N 1 2 245.338 2.398 20 0 BEADLO CCCCOC(=O)[C@H](C)[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000778230813 585728495 /nfs/dbraw/zinc/72/84/95/585728495.db2.gz CKZMGMPOVPXPBY-GRYCIOLGSA-N 1 2 245.338 2.398 20 0 BEADLO Cc1ccc([C@@H](O)C[NH2+][C@H](C)c2cn[nH]c2C)o1 ZINC000779071255 585744556 /nfs/dbraw/zinc/74/45/56/585744556.db2.gz DBDWNGOWLXQPIP-SKDRFNHKSA-N 1 2 249.314 2.004 20 0 BEADLO C[C@H]1CC[N@H+](Cc2ccc(F)nc2)C[C@@H]1F ZINC000779166737 585746885 /nfs/dbraw/zinc/74/68/85/585746885.db2.gz UYUPTLQGWBVXGU-ONGXEEELSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2ccc(F)nc2)C[C@@H]1F ZINC000779166737 585746886 /nfs/dbraw/zinc/74/68/86/585746886.db2.gz UYUPTLQGWBVXGU-ONGXEEELSA-N 1 2 226.270 2.401 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OCCCC(C)(C)C ZINC000780126103 585772804 /nfs/dbraw/zinc/77/28/04/585772804.db2.gz SZMCTNZRLRHLLC-VIFPVBQESA-N 1 2 216.325 2.346 20 0 BEADLO CC/C(C)=C(/C)C(=O)OCCn1cc[nH+]c1 ZINC000780215365 585773608 /nfs/dbraw/zinc/77/36/08/585773608.db2.gz JKMPKKVLJRZKOL-KHPPLWFESA-N 1 2 222.288 2.173 20 0 BEADLO COC(=O)C(C)(C)[NH2+]C[C@H]1CCc2ccccc21 ZINC000780294983 585777350 /nfs/dbraw/zinc/77/73/50/585777350.db2.gz YURSUKNBBZBHHI-GFCCVEGCSA-N 1 2 247.338 2.258 20 0 BEADLO CC/C(C)=C(\C)C(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000780893104 585785601 /nfs/dbraw/zinc/78/56/01/585785601.db2.gz TWLGCJSONMHUPJ-OCUQMRJBSA-N 1 2 235.331 2.134 20 0 BEADLO COc1ccc(CNc2cc(F)cc[nH+]2)cn1 ZINC000780905877 585785977 /nfs/dbraw/zinc/78/59/77/585785977.db2.gz CSUQGGGSTIRFIP-UHFFFAOYSA-N 1 2 233.246 2.236 20 0 BEADLO CC/C=C(/C)C(=O)OCCCn1cc[nH+]c1 ZINC000782306354 585814564 /nfs/dbraw/zinc/81/45/64/585814564.db2.gz REXDAUAPDMQLOY-WZUFQYTHSA-N 1 2 222.288 2.173 20 0 BEADLO CCC/C(C)=C\C(=O)N1CCn2cc(C)[nH+]c2C1 ZINC000782727164 585824195 /nfs/dbraw/zinc/82/41/95/585824195.db2.gz CWZJMSDJMLCBHQ-FLIBITNWSA-N 1 2 247.342 2.280 20 0 BEADLO C[C@H](C(=O)OC1CC1)[N@@H+]1CCc2ccccc2C1 ZINC000783187510 585829357 /nfs/dbraw/zinc/82/93/57/585829357.db2.gz CSABEWIRPQCQKT-LLVKDONJSA-N 1 2 245.322 2.139 20 0 BEADLO C[C@H](C(=O)OC1CC1)[N@H+]1CCc2ccccc2C1 ZINC000783187510 585829358 /nfs/dbraw/zinc/82/93/58/585829358.db2.gz CSABEWIRPQCQKT-LLVKDONJSA-N 1 2 245.322 2.139 20 0 BEADLO O=C(CC1CCC1)OCCCn1cc[nH+]c1 ZINC000783910130 585845808 /nfs/dbraw/zinc/84/58/08/585845808.db2.gz LNISMEQYQXHDGS-UHFFFAOYSA-N 1 2 222.288 2.007 20 0 BEADLO CC1(C(=O)OCCCn2cc[nH+]c2)CCC1 ZINC000784014497 585847081 /nfs/dbraw/zinc/84/70/81/585847081.db2.gz BNQUQZVVNPGJAL-UHFFFAOYSA-N 1 2 222.288 2.007 20 0 BEADLO Cc1ccc(COC(=O)[C@@H]2CO[C@H](C)C2)c(C)[nH+]1 ZINC000784271944 585854017 /nfs/dbraw/zinc/85/40/17/585854017.db2.gz OHORXPJNMGJVRT-MFKMUULPSA-N 1 2 249.310 2.167 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)C(C1CC1)C1CC1 ZINC000784361025 585857283 /nfs/dbraw/zinc/85/72/83/585857283.db2.gz OKPXBVJQTBJJFC-UHFFFAOYSA-N 1 2 248.326 2.253 20 0 BEADLO CC(C)/C=C\C(=O)OCCCn1cc[nH+]c1 ZINC000785044836 585869974 /nfs/dbraw/zinc/86/99/74/585869974.db2.gz ZZORYIVQLLLQIF-PLNGDYQASA-N 1 2 222.288 2.029 20 0 BEADLO Cc1nc(F)ccc1C[N@H+]1CCO[C@H](C)[C@H]1C ZINC000787174295 585902496 /nfs/dbraw/zinc/90/24/96/585902496.db2.gz BCJBULQGRWUZJS-GHMZBOCLSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1nc(F)ccc1C[N@@H+]1CCO[C@H](C)[C@H]1C ZINC000787174295 585902497 /nfs/dbraw/zinc/90/24/97/585902497.db2.gz BCJBULQGRWUZJS-GHMZBOCLSA-N 1 2 238.306 2.138 20 0 BEADLO Nc1cc(COC(=O)/C=C/c2ccco2)cc[nH+]1 ZINC000787578547 585912065 /nfs/dbraw/zinc/91/20/65/585912065.db2.gz LINFBWHKBHNBQU-ONEGZZNKSA-N 1 2 244.250 2.013 20 0 BEADLO C/C=C(/CC)C(=O)NCCCCn1cc[nH+]c1 ZINC000788799128 585930664 /nfs/dbraw/zinc/93/06/64/585930664.db2.gz SFBGMOLWPNDLGZ-BASWHVEKSA-N 1 2 235.331 2.136 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cnc(C)cn2)nc1 ZINC000789594860 585945215 /nfs/dbraw/zinc/94/52/15/585945215.db2.gz MMWJOBFTJRWKGL-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cnc(C)cn2)nc1 ZINC000789594860 585945216 /nfs/dbraw/zinc/94/52/16/585945216.db2.gz MMWJOBFTJRWKGL-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccc(C)c(CO[NH+]=C(N)[C@H]2CCCO2)c1 ZINC000789612062 585946570 /nfs/dbraw/zinc/94/65/70/585946570.db2.gz SBHIIWAMBCWQNR-CYBMUJFWSA-N 1 2 248.326 2.481 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+]C[C@@H](C)Cc1ccccc1 ZINC000789744622 585949089 /nfs/dbraw/zinc/94/90/89/585949089.db2.gz WYDFUINJJVAMCR-STQMWFEESA-N 1 2 249.354 2.406 20 0 BEADLO C/C=C(/CC)C(=O)N1CC(Oc2cc[nH+]cc2)C1 ZINC000789754209 585949291 /nfs/dbraw/zinc/94/92/91/585949291.db2.gz DOAUFENVKWUNJW-JYOAFUTRSA-N 1 2 246.310 2.028 20 0 BEADLO Cc1ccccc1C(=O)OCCc1c[nH+]cn1C ZINC000789777208 585949677 /nfs/dbraw/zinc/94/96/77/585949677.db2.gz PXWZBJPGAYUHKO-UHFFFAOYSA-N 1 2 244.294 2.128 20 0 BEADLO Cn1cc[nH+]c1CCCOC(=O)c1ccccc1 ZINC000789792764 585950394 /nfs/dbraw/zinc/95/03/94/585950394.db2.gz ZLIANMOHZATCCV-UHFFFAOYSA-N 1 2 244.294 2.210 20 0 BEADLO C/C=C(/CC)C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000789807384 585951040 /nfs/dbraw/zinc/95/10/40/585951040.db2.gz UITUSLBDZAUIFO-JYOAFUTRSA-N 1 2 247.342 2.472 20 0 BEADLO C/C=C(/CC)C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000789807384 585951041 /nfs/dbraw/zinc/95/10/41/585951041.db2.gz UITUSLBDZAUIFO-JYOAFUTRSA-N 1 2 247.342 2.472 20 0 BEADLO C/C=C(\CC)C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000789849699 585951792 /nfs/dbraw/zinc/95/17/92/585951792.db2.gz UPRBLIPZQBRZQE-WXLQGSQKSA-N 1 2 221.304 2.333 20 0 BEADLO CC=C(CC)C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000789849699 585951793 /nfs/dbraw/zinc/95/17/93/585951793.db2.gz UPRBLIPZQBRZQE-WXLQGSQKSA-N 1 2 221.304 2.333 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1CC(=O)OCc1ccccc1 ZINC000791566041 585984113 /nfs/dbraw/zinc/98/41/13/585984113.db2.gz LHURJIOYTWNJMT-VXGBXAGGSA-N 1 2 233.311 2.213 20 0 BEADLO C[C@H]1CC/C(=C\C(=O)OCc2cc[nH+]c(N)c2)C1 ZINC000791994937 585993011 /nfs/dbraw/zinc/99/30/11/585993011.db2.gz JXWLIPQBJQLYTB-NGPGYTDTSA-N 1 2 246.310 2.453 20 0 BEADLO Nc1cc(COC(=O)C23CCC(CC2)C3)cc[nH+]1 ZINC000792132944 585996198 /nfs/dbraw/zinc/99/61/98/585996198.db2.gz HVNCADAHENLVKO-UHFFFAOYSA-N 1 2 246.310 2.287 20 0 BEADLO CC(C)[C@H]([NH2+]Cc1ncccn1)c1ccccn1 ZINC000792273759 585998570 /nfs/dbraw/zinc/99/85/70/585998570.db2.gz XLXXUYRXGLOGKU-AWEZNQCLSA-N 1 2 242.326 2.359 20 0 BEADLO Cc1nonc1C[N@@H+]1CCc2cc(C)ccc2C1 ZINC000792311846 585999730 /nfs/dbraw/zinc/99/97/30/585999730.db2.gz JZTHZTWCJUTZKT-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1nonc1C[N@H+]1CCc2cc(C)ccc2C1 ZINC000792311846 585999731 /nfs/dbraw/zinc/99/97/31/585999731.db2.gz JZTHZTWCJUTZKT-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO CC[C@H]1CCCC[C@@H]1C(=O)NC1=[NH+]CCS1 ZINC000792857349 586005736 /nfs/dbraw/zinc/00/57/36/586005736.db2.gz YOKPZOOELATYDZ-UWVGGRQHSA-N 1 2 240.372 2.422 20 0 BEADLO CCCC[C@@H](C)C(=O)OCCc1c[nH+]cn1C ZINC000793251438 586015179 /nfs/dbraw/zinc/01/51/79/586015179.db2.gz RLXUQBCCHACMBO-LLVKDONJSA-N 1 2 238.331 2.332 20 0 BEADLO CC[C@H]1CC[N@@H+]1Cn1ncc(Cl)c1C ZINC000793820503 586026650 /nfs/dbraw/zinc/02/66/50/586026650.db2.gz LXKXFMFOJMEXQJ-VIFPVBQESA-N 1 2 213.712 2.287 20 0 BEADLO CC[C@H]1CC[N@H+]1Cn1ncc(Cl)c1C ZINC000793820503 586026651 /nfs/dbraw/zinc/02/66/51/586026651.db2.gz LXKXFMFOJMEXQJ-VIFPVBQESA-N 1 2 213.712 2.287 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1cc(Cl)n(C)n1 ZINC000859283848 589027729 /nfs/dbraw/zinc/02/77/29/589027729.db2.gz HTPWMJFKVLLRRB-HTQZYQBOSA-N 1 2 213.712 2.056 20 0 BEADLO Cc1nccnc1[C@@H](C)[NH2+]Cc1cccnc1F ZINC000794834340 586049762 /nfs/dbraw/zinc/04/97/62/586049762.db2.gz IRYXFHRYZWFECM-SNVBAGLBSA-N 1 2 246.289 2.170 20 0 BEADLO Cc1nc(N2[C@H](C)C[C@H]2C)c(C)c(C)[nH+]1 ZINC000795195579 586071178 /nfs/dbraw/zinc/07/11/78/586071178.db2.gz WUKOEVBUIOMKMX-HTQZYQBOSA-N 1 2 205.305 2.389 20 0 BEADLO NC(=[NH+]OCCCCF)c1cccc(F)c1 ZINC000795204633 586071680 /nfs/dbraw/zinc/07/16/80/586071680.db2.gz JUKBTKMDMLHEFE-UHFFFAOYSA-N 1 2 228.242 2.422 20 0 BEADLO CCc1cc(NCc2cccnc2F)nc[nH+]1 ZINC000795228270 586072901 /nfs/dbraw/zinc/07/29/01/586072901.db2.gz BTYJAYGQMLZXIL-UHFFFAOYSA-N 1 2 232.262 2.185 20 0 BEADLO c1cc(C[N@@H+]2CCc3nc[nH]c3C2)cs1 ZINC000859305993 589029509 /nfs/dbraw/zinc/02/95/09/589029509.db2.gz PMUFJJINVHPLQS-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO c1cc(C[N@H+]2CCc3nc[nH]c3C2)cs1 ZINC000859305993 589029511 /nfs/dbraw/zinc/02/95/11/589029511.db2.gz PMUFJJINVHPLQS-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO C[N@H+](Cc1cccs1)[C@H]1CC(C)(C)OC1=O ZINC000795653196 586090251 /nfs/dbraw/zinc/09/02/51/586090251.db2.gz PNDQGRKJBXPVKZ-JTQLQIEISA-N 1 2 239.340 2.274 20 0 BEADLO C[N@@H+](Cc1cccs1)[C@H]1CC(C)(C)OC1=O ZINC000795653196 586090252 /nfs/dbraw/zinc/09/02/52/586090252.db2.gz PNDQGRKJBXPVKZ-JTQLQIEISA-N 1 2 239.340 2.274 20 0 BEADLO C[N@H+](Cc1ccccc1)[C@@H]1CC(C)(C)OC1=O ZINC000795662119 586090526 /nfs/dbraw/zinc/09/05/26/586090526.db2.gz RHGSVBIQKINKKO-GFCCVEGCSA-N 1 2 233.311 2.213 20 0 BEADLO C[N@@H+](Cc1ccccc1)[C@@H]1CC(C)(C)OC1=O ZINC000795662119 586090527 /nfs/dbraw/zinc/09/05/27/586090527.db2.gz RHGSVBIQKINKKO-GFCCVEGCSA-N 1 2 233.311 2.213 20 0 BEADLO CCC[N@@H+]1CCN(c2ccc(C)cc2)C(=O)C1 ZINC000796088827 586097497 /nfs/dbraw/zinc/09/74/97/586097497.db2.gz IHLOOAWLWBAUCK-UHFFFAOYSA-N 1 2 232.327 2.054 20 0 BEADLO CCC[N@H+]1CCN(c2ccc(C)cc2)C(=O)C1 ZINC000796088827 586097498 /nfs/dbraw/zinc/09/74/98/586097498.db2.gz IHLOOAWLWBAUCK-UHFFFAOYSA-N 1 2 232.327 2.054 20 0 BEADLO Fc1ccc(C2([NH2+]Cc3c[nH]cn3)CC2)cc1 ZINC000796449057 586103116 /nfs/dbraw/zinc/10/31/16/586103116.db2.gz MWOITQGWTDIXKU-UHFFFAOYSA-N 1 2 231.274 2.328 20 0 BEADLO Cc1csc([C@H]([NH2+]Cc2cnc[nH]2)C2CC2)n1 ZINC000796451180 586103918 /nfs/dbraw/zinc/10/39/18/586103918.db2.gz RJYSAZRMBXHECP-LLVKDONJSA-N 1 2 248.355 2.416 20 0 BEADLO Cc1noc(C)c1[C@H](C)[NH2+][C@H](C)c1ncc[nH]1 ZINC000796764885 586111782 /nfs/dbraw/zinc/11/17/82/586111782.db2.gz VSRIAIXFWSMXPH-IONNQARKSA-N 1 2 234.303 2.426 20 0 BEADLO c1n[nH]c2c1[C@@H]([NH2+]CCOCC1CCC1)CCC2 ZINC000796940409 586117438 /nfs/dbraw/zinc/11/74/38/586117438.db2.gz HKYOFJGGEBWIQZ-ZDUSSCGKSA-N 1 2 249.358 2.193 20 0 BEADLO Cc1cc(C(=O)OCc2c[nH+]cn2C)cs1 ZINC000797101969 586120352 /nfs/dbraw/zinc/12/03/52/586120352.db2.gz HBAPBHPZFFYPEC-UHFFFAOYSA-N 1 2 236.296 2.147 20 0 BEADLO Cc1ccc(COC(=O)c2ccc[nH]2)c(C)[nH+]1 ZINC000797856708 586133123 /nfs/dbraw/zinc/13/31/23/586133123.db2.gz NBEKPNYDQFNEFO-UHFFFAOYSA-N 1 2 230.267 2.384 20 0 BEADLO Cc1cc[nH]c1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000797874114 586133594 /nfs/dbraw/zinc/13/35/94/586133594.db2.gz GJWCEZUEFIBPSW-UHFFFAOYSA-N 1 2 240.266 2.223 20 0 BEADLO Cc1cc[nH]c1C(=O)Nc1cc(N(C)C)cc[nH+]1 ZINC000797982812 586135290 /nfs/dbraw/zinc/13/52/90/586135290.db2.gz NODDMUAVBLVQIP-UHFFFAOYSA-N 1 2 244.298 2.036 20 0 BEADLO C[N@H+](CC[S@@](C)=O)Cc1ccccc1Cl ZINC000798194277 586139245 /nfs/dbraw/zinc/13/92/45/586139245.db2.gz YZSHMUAUCADOIU-OAHLLOKOSA-N 1 2 245.775 2.150 20 0 BEADLO C[N@@H+](CC[S@@](C)=O)Cc1ccccc1Cl ZINC000798194277 586139246 /nfs/dbraw/zinc/13/92/46/586139246.db2.gz YZSHMUAUCADOIU-OAHLLOKOSA-N 1 2 245.775 2.150 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1ccnc(F)c1 ZINC000859316555 589031380 /nfs/dbraw/zinc/03/13/80/589031380.db2.gz XBPWTPJFOJXMAC-UHFFFAOYSA-N 1 2 249.289 2.403 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1ccnc(F)c1 ZINC000859316555 589031382 /nfs/dbraw/zinc/03/13/82/589031382.db2.gz XBPWTPJFOJXMAC-UHFFFAOYSA-N 1 2 249.289 2.403 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2nccnc2C)no1 ZINC000800502794 586223502 /nfs/dbraw/zinc/22/35/02/586223502.db2.gz GZSLVPASPLMGSS-MWLCHTKSSA-N 1 2 246.314 2.493 20 0 BEADLO Cc1cccc(C[N@@H+]2CCO[C@H](C(F)F)C2)c1 ZINC000801561714 586261664 /nfs/dbraw/zinc/26/16/64/586261664.db2.gz STKKSKZZPHVXRL-LBPRGKRZSA-N 1 2 241.281 2.461 20 0 BEADLO Cc1cccc(C[N@H+]2CCO[C@H](C(F)F)C2)c1 ZINC000801561714 586261665 /nfs/dbraw/zinc/26/16/65/586261665.db2.gz STKKSKZZPHVXRL-LBPRGKRZSA-N 1 2 241.281 2.461 20 0 BEADLO CC(C)C[C@H](C)C(=O)O[C@H]1CC[N@H+](CCF)C1 ZINC000802237393 586296183 /nfs/dbraw/zinc/29/61/83/586296183.db2.gz FIWDOUAGTBPCOR-RYUDHWBXSA-N 1 2 245.338 2.256 20 0 BEADLO CC(C)C[C@H](C)C(=O)O[C@H]1CC[N@@H+](CCF)C1 ZINC000802237393 586296184 /nfs/dbraw/zinc/29/61/84/586296184.db2.gz FIWDOUAGTBPCOR-RYUDHWBXSA-N 1 2 245.338 2.256 20 0 BEADLO CC(C)C[C@@H](C)C(=O)O[C@@H]1CC[N@H+](CCF)C1 ZINC000802237394 586296215 /nfs/dbraw/zinc/29/62/15/586296215.db2.gz FIWDOUAGTBPCOR-VXGBXAGGSA-N 1 2 245.338 2.256 20 0 BEADLO CC(C)C[C@@H](C)C(=O)O[C@@H]1CC[N@@H+](CCF)C1 ZINC000802237394 586296217 /nfs/dbraw/zinc/29/62/17/586296217.db2.gz FIWDOUAGTBPCOR-VXGBXAGGSA-N 1 2 245.338 2.256 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)O[C@@H]2CC[N@H+](CCF)C2)C1 ZINC000802234224 586298309 /nfs/dbraw/zinc/29/83/09/586298309.db2.gz BGDDNKMUCZSKNW-GRYCIOLGSA-N 1 2 243.322 2.010 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)O[C@@H]2CC[N@@H+](CCF)C2)C1 ZINC000802234224 586298310 /nfs/dbraw/zinc/29/83/10/586298310.db2.gz BGDDNKMUCZSKNW-GRYCIOLGSA-N 1 2 243.322 2.010 20 0 BEADLO CCC(C)(CC)C(=O)O[C@H]1CC[N@H+](CCF)C1 ZINC000802241287 586298817 /nfs/dbraw/zinc/29/88/17/586298817.db2.gz LESCBRDHMWLKLX-NSHDSACASA-N 1 2 245.338 2.400 20 0 BEADLO CCC(C)(CC)C(=O)O[C@H]1CC[N@@H+](CCF)C1 ZINC000802241287 586298819 /nfs/dbraw/zinc/29/88/19/586298819.db2.gz LESCBRDHMWLKLX-NSHDSACASA-N 1 2 245.338 2.400 20 0 BEADLO CCC[C@@H](C)C(=O)O[C@H]1CC[N@H+](CCF)C1 ZINC000802240423 586299088 /nfs/dbraw/zinc/29/90/88/586299088.db2.gz YGZAQMLOOYYHLY-MNOVXSKESA-N 1 2 231.311 2.010 20 0 BEADLO CCC[C@@H](C)C(=O)O[C@H]1CC[N@@H+](CCF)C1 ZINC000802240423 586299090 /nfs/dbraw/zinc/29/90/90/586299090.db2.gz YGZAQMLOOYYHLY-MNOVXSKESA-N 1 2 231.311 2.010 20 0 BEADLO FC(F)[C@@H]1C[N@H+](Cc2ccsc2)CCO1 ZINC000802653161 586307586 /nfs/dbraw/zinc/30/75/86/586307586.db2.gz IUBHUAQFZXESDZ-VIFPVBQESA-N 1 2 233.283 2.214 20 0 BEADLO FC(F)[C@@H]1C[N@@H+](Cc2ccsc2)CCO1 ZINC000802653161 586307588 /nfs/dbraw/zinc/30/75/88/586307588.db2.gz IUBHUAQFZXESDZ-VIFPVBQESA-N 1 2 233.283 2.214 20 0 BEADLO CC1C[NH+](Cc2c(Cl)nc3ccccn32)C1 ZINC000802651600 586307687 /nfs/dbraw/zinc/30/76/87/586307687.db2.gz RZAVZDVSANFPBB-UHFFFAOYSA-N 1 2 235.718 2.439 20 0 BEADLO C[C@H]1C[C@@H]1COC(=O)c1ccc2[nH+]ccn2c1 ZINC000859551822 589044396 /nfs/dbraw/zinc/04/43/96/589044396.db2.gz HIXKBFIAVJISHI-GXSJLCMTSA-N 1 2 230.267 2.147 20 0 BEADLO CC(C)(C)c1nnc(C[NH+](C2CC2)C2CC2)o1 ZINC000859620534 589049075 /nfs/dbraw/zinc/04/90/75/589049075.db2.gz AHSKUVVIZJKRBA-UHFFFAOYSA-N 1 2 235.331 2.494 20 0 BEADLO CC/C(C)=C(/C)C(=O)N[C@H]1CCc2c[nH+]cn2C1 ZINC000804331888 586390972 /nfs/dbraw/zinc/39/09/72/586390972.db2.gz FEZHEBGVYMZGJW-WEHUKYGOSA-N 1 2 247.342 2.061 20 0 BEADLO NC(Cc1ccccc1)=[NH+]OCCOC1CCC1 ZINC000808251432 586468810 /nfs/dbraw/zinc/46/88/10/586468810.db2.gz LHLCMWFWYKUJCB-UHFFFAOYSA-N 1 2 248.326 2.297 20 0 BEADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cn(C)cn2)o1 ZINC000808381241 586470536 /nfs/dbraw/zinc/47/05/36/586470536.db2.gz NFJHCVOCADDTIZ-MFKMUULPSA-N 1 2 245.326 2.426 20 0 BEADLO CC(C)CCn1ccc(NCc2cn(C)c[nH+]2)n1 ZINC000808396782 586470715 /nfs/dbraw/zinc/47/07/15/586470715.db2.gz YOJRNLKEFFOJTA-UHFFFAOYSA-N 1 2 247.346 2.275 20 0 BEADLO CC(C)Oc1ccc(NCc2cn(C)c[nH+]2)cn1 ZINC000808398657 586470961 /nfs/dbraw/zinc/47/09/61/586470961.db2.gz FDDZLNSPVMMKPO-UHFFFAOYSA-N 1 2 246.314 2.214 20 0 BEADLO Cc1cc(NCc2cn(C)cn2)ccc1[NH+](C)C ZINC000808397228 586471240 /nfs/dbraw/zinc/47/12/40/586471240.db2.gz LGKZRWGLOFEBGN-UHFFFAOYSA-N 1 2 244.342 2.407 20 0 BEADLO CCCCn1ncc(NCc2cn(C)c[nH+]2)c1C ZINC000808403483 586471756 /nfs/dbraw/zinc/47/17/56/586471756.db2.gz NBLILQTXFBQMNP-UHFFFAOYSA-N 1 2 247.346 2.337 20 0 BEADLO CC(C)=CCOC(=O)c1ccc2[nH+]ccn2c1 ZINC000808516131 586476698 /nfs/dbraw/zinc/47/66/98/586476698.db2.gz APNNOHLGCSAROY-UHFFFAOYSA-N 1 2 230.267 2.457 20 0 BEADLO CO[C@@H](C)C[N@H+](C)Cc1coc(C2CC2)n1 ZINC000809717770 586514388 /nfs/dbraw/zinc/51/43/88/586514388.db2.gz NAEFJAONIBUUGC-VIFPVBQESA-N 1 2 224.304 2.019 20 0 BEADLO CO[C@@H](C)C[N@@H+](C)Cc1coc(C2CC2)n1 ZINC000809717770 586514389 /nfs/dbraw/zinc/51/43/89/586514389.db2.gz NAEFJAONIBUUGC-VIFPVBQESA-N 1 2 224.304 2.019 20 0 BEADLO C[C@@H]1CCOCC[N@@H+]1Cc1coc(C2CC2)n1 ZINC000809764934 586518484 /nfs/dbraw/zinc/51/84/84/586518484.db2.gz JPSRDYFOWRIZMQ-SNVBAGLBSA-N 1 2 236.315 2.163 20 0 BEADLO C[C@@H]1CCOCC[N@H+]1Cc1coc(C2CC2)n1 ZINC000809764934 586518486 /nfs/dbraw/zinc/51/84/86/586518486.db2.gz JPSRDYFOWRIZMQ-SNVBAGLBSA-N 1 2 236.315 2.163 20 0 BEADLO Cc1ncccc1CO[NH+]=C(N)c1ccccc1 ZINC000809991155 586529260 /nfs/dbraw/zinc/52/92/60/586529260.db2.gz XZWYIMDGBINOCS-UHFFFAOYSA-N 1 2 241.294 2.437 20 0 BEADLO CCCCOC(=O)C[N@@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000810045146 586532584 /nfs/dbraw/zinc/53/25/84/586532584.db2.gz FIONCQVLXCEGPJ-JTQLQIEISA-N 1 2 249.301 2.307 20 0 BEADLO CCCCOC(=O)C[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000810045146 586532585 /nfs/dbraw/zinc/53/25/85/586532585.db2.gz FIONCQVLXCEGPJ-JTQLQIEISA-N 1 2 249.301 2.307 20 0 BEADLO Cc1cn[nH]c1C[NH2+]Cc1c(C)cccc1F ZINC000810145820 586535292 /nfs/dbraw/zinc/53/52/92/586535292.db2.gz JCHSBQJNKQBGLA-UHFFFAOYSA-N 1 2 233.290 2.455 20 0 BEADLO Cc1c[nH]nc1C[NH2+]Cc1c(C)cccc1F ZINC000810145820 586535294 /nfs/dbraw/zinc/53/52/94/586535294.db2.gz JCHSBQJNKQBGLA-UHFFFAOYSA-N 1 2 233.290 2.455 20 0 BEADLO CC1CC(OC(=O)Cc2cn3ccccc3[nH+]2)C1 ZINC000813229127 586597626 /nfs/dbraw/zinc/59/76/26/586597626.db2.gz DHIINKGWBHEKBQ-UHFFFAOYSA-N 1 2 244.294 2.219 20 0 BEADLO CCCCOC(=O)[C@@H](C)[NH2+]C(C)(C)COCC ZINC000815136555 586670002 /nfs/dbraw/zinc/67/00/02/586670002.db2.gz GMMYLMFMEAESLZ-LLVKDONJSA-N 1 2 245.363 2.123 20 0 BEADLO C[C@H]1C[N@H+](Cc2cnn(-c3ccccc3)n2)[C@H]1C ZINC000815162684 586671525 /nfs/dbraw/zinc/67/15/25/586671525.db2.gz GPHSNFVTLYTKBT-RYUDHWBXSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cnn(-c3ccccc3)n2)[C@H]1C ZINC000815162684 586671526 /nfs/dbraw/zinc/67/15/26/586671526.db2.gz GPHSNFVTLYTKBT-RYUDHWBXSA-N 1 2 242.326 2.108 20 0 BEADLO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1cnn(C)n1 ZINC000815626127 586689090 /nfs/dbraw/zinc/68/90/90/586689090.db2.gz WMOIGPORMRJMBM-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO Cc1ccc(NC(=O)C(C)(F)F)c(N(C)C)[nH+]1 ZINC000815859609 586694818 /nfs/dbraw/zinc/69/48/18/586694818.db2.gz HJQRFEAQPROXJH-UHFFFAOYSA-N 1 2 243.257 2.050 20 0 BEADLO Cc1ccc(NC(=O)Cc2[nH]cc[nH+]2)c(C)c1 ZINC000816809894 586765370 /nfs/dbraw/zinc/76/53/70/586765370.db2.gz PLZIZZQPTMOHJP-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO CSc1cccc(NC(=O)Cc2[nH]cc[nH+]2)c1 ZINC000816811157 586765780 /nfs/dbraw/zinc/76/57/80/586765780.db2.gz OMGHNUPQAMNJLN-UHFFFAOYSA-N 1 2 247.323 2.313 20 0 BEADLO CCCCCC[C@@H](C)NC(=O)Cc1[nH]cc[nH+]1 ZINC000816842709 586767535 /nfs/dbraw/zinc/76/75/35/586767535.db2.gz BZCUMZRALGAOEK-LLVKDONJSA-N 1 2 237.347 2.427 20 0 BEADLO CCCCCCNC(=O)[C@H]1CCc2c[nH+]cn2C1 ZINC000816839376 586767619 /nfs/dbraw/zinc/76/76/19/586767619.db2.gz CRADMRSCLHZZSJ-LBPRGKRZSA-N 1 2 249.358 2.142 20 0 BEADLO C[C@@H](c1cccs1)N(C)C(=O)Cc1[nH]cc[nH+]1 ZINC000816889335 586769542 /nfs/dbraw/zinc/76/95/42/586769542.db2.gz UUHJGBHKXLHMGJ-VIFPVBQESA-N 1 2 249.339 2.233 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)Nc1cccc2[nH]ccc21 ZINC000816914780 586771307 /nfs/dbraw/zinc/77/13/07/586771307.db2.gz DVMNLVRJWJNMAJ-UHFFFAOYSA-N 1 2 240.266 2.072 20 0 BEADLO C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)Cc1[nH]cc[nH+]1 ZINC000816926770 586771714 /nfs/dbraw/zinc/77/17/14/586771714.db2.gz GYUULNFJLNFCBC-WOPDTQHZSA-N 1 2 247.342 2.132 20 0 BEADLO CC(C)[C@@H]1CCCN(C(=O)Cc2[nH]cc[nH+]2)CC1 ZINC000816925916 586771843 /nfs/dbraw/zinc/77/18/43/586771843.db2.gz BXQTXBLTXHBGAE-GFCCVEGCSA-N 1 2 249.358 2.237 20 0 BEADLO CO[C@@H](CO[NH+]=C(N)Cc1ccccc1)C1CC1 ZINC000818076592 586869540 /nfs/dbraw/zinc/86/95/40/586869540.db2.gz KEZOVQMKJGUVMX-ZDUSSCGKSA-N 1 2 248.326 2.153 20 0 BEADLO CCCCCC[C@H](O)C[NH2+]Cc1cn[nH]c1C ZINC000818948426 586916488 /nfs/dbraw/zinc/91/64/88/586916488.db2.gz DPXLRGVRUBIESI-ZDUSSCGKSA-N 1 2 239.363 2.139 20 0 BEADLO CC[C@@H](O)CNc1ccc([NH+](C)C)c(C)c1 ZINC000819409157 586961945 /nfs/dbraw/zinc/96/19/45/586961945.db2.gz XTZGEAOFEAUWOA-GFCCVEGCSA-N 1 2 222.332 2.244 20 0 BEADLO C[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000819544688 586976300 /nfs/dbraw/zinc/97/63/00/586976300.db2.gz TYUAEHLDQDHDHJ-UTUOFQBUSA-N 1 2 247.342 2.270 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)C2CCCCC2)S1 ZINC000819758952 586990432 /nfs/dbraw/zinc/99/04/32/586990432.db2.gz CGULSZAGWNPNGP-MRVPVSSYSA-N 1 2 226.345 2.174 20 0 BEADLO CCC(C)(CC)C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819775570 586992636 /nfs/dbraw/zinc/99/26/36/586992636.db2.gz HMFZJEOIIRLFJP-MRVPVSSYSA-N 1 2 228.361 2.420 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819775891 586992801 /nfs/dbraw/zinc/99/28/01/586992801.db2.gz KMSCGQPUQLLYBV-CIUDSAMLSA-N 1 2 228.361 2.276 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)[C@]2(C)CC=CCC2)S1 ZINC000819781074 586993759 /nfs/dbraw/zinc/99/37/59/586993759.db2.gz LDXIPNIRNWMULJ-JOYOIKCWSA-N 1 2 238.356 2.340 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)CC(C)(C)C2CC2)S1 ZINC000819780717 586993781 /nfs/dbraw/zinc/99/37/81/586993781.db2.gz IUTMIOHDMDASJS-QMMMGPOBSA-N 1 2 240.372 2.420 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819781174 586993854 /nfs/dbraw/zinc/99/38/54/586993854.db2.gz MELZNAXVJFAHEZ-OPRDCNLKSA-N 1 2 240.372 2.420 20 0 BEADLO CC[C@H](C)CC(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819779925 586993898 /nfs/dbraw/zinc/99/38/98/586993898.db2.gz BJTPZAVSZLKBFO-JGVFFNPUSA-N 1 2 214.334 2.030 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1C[C@@H]2CCCC[C@H]12)c1[nH]cc[nH+]1 ZINC000820191380 587033827 /nfs/dbraw/zinc/03/38/27/587033827.db2.gz DCCZEAMPYXWNJY-NOOOWODRSA-N 1 2 247.342 2.413 20 0 BEADLO C/C=C(/C=C/C(=O)N[C@H](C)c1[nH]cc[nH+]1)CC ZINC000820267870 587039426 /nfs/dbraw/zinc/03/94/26/587039426.db2.gz LDRWGRPEUCYLIR-BDEKNJNYSA-N 1 2 233.315 2.499 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C(=O)OCCn1cc[nH+]c1 ZINC000820858430 587078009 /nfs/dbraw/zinc/07/80/09/587078009.db2.gz YSWWXGJYNFQPDU-NEPJUHHUSA-N 1 2 236.315 2.253 20 0 BEADLO O=C(C[C@@H]1CC=CCC1)N[C@H]1CCn2cc[nH+]c21 ZINC000820947574 587083452 /nfs/dbraw/zinc/08/34/52/587083452.db2.gz FOORGIFIEFKDHU-NEPJUHHUSA-N 1 2 245.326 2.191 20 0 BEADLO CCCCC1(C(=O)N[C@@H]2CCn3cc[nH+]c32)CC1 ZINC000820948274 587084140 /nfs/dbraw/zinc/08/41/40/587084140.db2.gz QZQPATYJDMVHIY-LLVKDONJSA-N 1 2 247.342 2.415 20 0 BEADLO Cc1ccc(C2CC[NH+]([C@@H](C)C(=O)[O-])CC2)c[nH+]1 ZINC000821076179 587094353 /nfs/dbraw/zinc/09/43/53/587094353.db2.gz VBYCKDYSSULQMT-NSHDSACASA-N 1 2 248.326 2.043 20 0 BEADLO CCC[C@H](CC)C(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000821105672 587095896 /nfs/dbraw/zinc/09/58/96/587095896.db2.gz DBFCNZWGWDMSSY-QWRGUYRKSA-N 1 2 249.358 2.210 20 0 BEADLO CCC[C@H](CC)C(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000821105672 587095897 /nfs/dbraw/zinc/09/58/97/587095897.db2.gz DBFCNZWGWDMSSY-QWRGUYRKSA-N 1 2 249.358 2.210 20 0 BEADLO CCC1(NC(=O)c2cc3c[nH+]ccc3[nH]2)CC1 ZINC000821105876 587096085 /nfs/dbraw/zinc/09/60/85/587096085.db2.gz SWXAGOKTMSGISF-UHFFFAOYSA-N 1 2 229.283 2.235 20 0 BEADLO O=C(c1cc2c[nH+]ccc2[nH]1)N1CC[C@@H]1C1CC1 ZINC000821149986 587099214 /nfs/dbraw/zinc/09/92/14/587099214.db2.gz UCCSMHWMUUXWLI-CYBMUJFWSA-N 1 2 241.294 2.187 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)[C@]12C[C@H]1CCC2 ZINC000821309659 587106561 /nfs/dbraw/zinc/10/65/61/587106561.db2.gz UPAZKOUNVBFQKF-JTNHKYCSSA-N 1 2 247.342 2.270 20 0 BEADLO CC(C)CC(=O)OCCc1cn2ccccc2[nH+]1 ZINC000821594157 587131506 /nfs/dbraw/zinc/13/15/06/587131506.db2.gz AYEBLWQNLCYXTA-UHFFFAOYSA-N 1 2 246.310 2.466 20 0 BEADLO C[C@@H]1C[C@@H]1C(=O)OCCc1cn2ccccc2[nH+]1 ZINC000821596089 587131651 /nfs/dbraw/zinc/13/16/51/587131651.db2.gz ZAAAZBKQKXDXKV-PWSUYJOCSA-N 1 2 244.294 2.076 20 0 BEADLO CC(C)C(=O)OCc1ccc[nH+]c1N1CCCC1 ZINC000821609349 587132550 /nfs/dbraw/zinc/13/25/50/587132550.db2.gz SHUSGBYSQCPHEZ-UHFFFAOYSA-N 1 2 248.326 2.381 20 0 BEADLO O=C(OCCn1cc[nH+]c1)[C@@H]1CCCC12CC2 ZINC000860174278 589086763 /nfs/dbraw/zinc/08/67/63/589086763.db2.gz LYJPCFJPGBJAAE-NSHDSACASA-N 1 2 234.299 2.007 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)[C@@H]1CCCC12CC2 ZINC000860175098 589086812 /nfs/dbraw/zinc/08/68/12/589086812.db2.gz DUBMIJBQIFXUGZ-LBPRGKRZSA-N 1 2 248.326 2.086 20 0 BEADLO CCC[C@@H](CC)C(=O)N[C@@H]1CCn2cc[nH+]c2C1 ZINC000822131801 587155395 /nfs/dbraw/zinc/15/53/95/587155395.db2.gz FBUPQFODRMCYPR-VXGBXAGGSA-N 1 2 249.358 2.140 20 0 BEADLO C[C@@H](CC(C)(C)C)NC(=O)/C=C\c1cn(C)c[nH+]1 ZINC000822276438 587160426 /nfs/dbraw/zinc/16/04/26/587160426.db2.gz FEYXCRMQOMQQJG-ZADCQDASSA-N 1 2 249.358 2.374 20 0 BEADLO C[C@H]1CC(C)(C)CN1C(=O)/C=C/c1cn(C)c[nH+]1 ZINC000822738235 587183534 /nfs/dbraw/zinc/18/35/34/587183534.db2.gz HLSSKNIIRGRHGS-QRGHLMKCSA-N 1 2 247.342 2.080 20 0 BEADLO CCC[C@H](CC)C(=O)N[C@H]1CCc2c[nH+]cn2C1 ZINC000822861261 587189660 /nfs/dbraw/zinc/18/96/60/587189660.db2.gz IUUIEFGJPLUKCP-RYUDHWBXSA-N 1 2 249.358 2.140 20 0 BEADLO O[C@H](C[N@@H+]1Cc2cccnc2C1)c1ccccc1 ZINC000822995892 587196988 /nfs/dbraw/zinc/19/69/88/587196988.db2.gz BOWLOUFMQGVFNK-OAHLLOKOSA-N 1 2 240.306 2.131 20 0 BEADLO O[C@H](C[N@H+]1Cc2cccnc2C1)c1ccccc1 ZINC000822995892 587196990 /nfs/dbraw/zinc/19/69/90/587196990.db2.gz BOWLOUFMQGVFNK-OAHLLOKOSA-N 1 2 240.306 2.131 20 0 BEADLO CCCCCN(C(=O)Cc1[nH]cc[nH+]1)C(C)C ZINC000822991322 587197081 /nfs/dbraw/zinc/19/70/81/587197081.db2.gz SVYSAXOTZWQWBC-UHFFFAOYSA-N 1 2 237.347 2.379 20 0 BEADLO CCC[C@@H](CC)C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000823005761 587197887 /nfs/dbraw/zinc/19/78/87/587197887.db2.gz CKJLTJSYQMYUAO-SNVBAGLBSA-N 1 2 235.331 2.121 20 0 BEADLO CCC[C@@H](CC)C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000823005761 587197888 /nfs/dbraw/zinc/19/78/88/587197888.db2.gz CKJLTJSYQMYUAO-SNVBAGLBSA-N 1 2 235.331 2.121 20 0 BEADLO O=C(N[C@@H]1CCn2cc[nH+]c21)C1CCC=CCC1 ZINC000823236991 587210377 /nfs/dbraw/zinc/21/03/77/587210377.db2.gz JRFQNSHEJSMPOQ-GFCCVEGCSA-N 1 2 245.326 2.191 20 0 BEADLO Cc1ccc([C@@H](C)NC(=O)Cc2[nH]cc[nH+]2)s1 ZINC000823278231 587213211 /nfs/dbraw/zinc/21/32/11/587213211.db2.gz LNWAAZCGTHWKAP-SECBINFHSA-N 1 2 249.339 2.200 20 0 BEADLO CC/C(C)=C/C(=O)NCCCCn1cc[nH+]c1 ZINC000823310036 587215342 /nfs/dbraw/zinc/21/53/42/587215342.db2.gz GTADSADJTBNVOA-ZRDIBKRKSA-N 1 2 235.331 2.136 20 0 BEADLO CCC(=O)N1CC[N@H+](CCSC(C)(C)C)C1 ZINC000823498048 587227731 /nfs/dbraw/zinc/22/77/31/587227731.db2.gz UYEDAIYLLTYDRQ-UHFFFAOYSA-N 1 2 244.404 2.030 20 0 BEADLO CCC(=O)N1CC[N@@H+](CCSC(C)(C)C)C1 ZINC000823498048 587227732 /nfs/dbraw/zinc/22/77/32/587227732.db2.gz UYEDAIYLLTYDRQ-UHFFFAOYSA-N 1 2 244.404 2.030 20 0 BEADLO CC(C)C1C[NH+](Cc2cc(F)ncc2F)C1 ZINC000824307305 587265433 /nfs/dbraw/zinc/26/54/33/587265433.db2.gz GAZKDCMKZVXCPL-UHFFFAOYSA-N 1 2 226.270 2.448 20 0 BEADLO CCC[C@H]([NH2+][C@@H](CF)C(=O)OC)C1CCCC1 ZINC000824396971 587268897 /nfs/dbraw/zinc/26/88/97/587268897.db2.gz WLZGIKZVBWIAHR-RYUDHWBXSA-N 1 2 245.338 2.446 20 0 BEADLO Cc1cc(C[NH2+][C@@H]2CCn3ccnc32)c(C)o1 ZINC000824528055 587273720 /nfs/dbraw/zinc/27/37/20/587273720.db2.gz ZXJCIFBWBICHJT-GFCCVEGCSA-N 1 2 231.299 2.328 20 0 BEADLO Cc1nc(F)ccc1C[N@@H+]1CC[C@H](F)C1 ZINC000824572529 587277206 /nfs/dbraw/zinc/27/72/06/587277206.db2.gz ZFLWNZCKXMAAEP-JTQLQIEISA-N 1 2 212.243 2.073 20 0 BEADLO Cc1nc(F)ccc1C[N@H+]1CC[C@H](F)C1 ZINC000824572529 587277207 /nfs/dbraw/zinc/27/72/07/587277207.db2.gz ZFLWNZCKXMAAEP-JTQLQIEISA-N 1 2 212.243 2.073 20 0 BEADLO C[C@]1(C[NH2+]Cc2ccn[nH]2)CC1(Cl)Cl ZINC000824765506 587286634 /nfs/dbraw/zinc/28/66/34/587286634.db2.gz MNWRUVVILMBXOP-MRVPVSSYSA-N 1 2 234.130 2.083 20 0 BEADLO CC1(C[NH2+]c2ccc(O[C@H]3CC(=O)N3)cc2)CC1 ZINC000825000292 587298306 /nfs/dbraw/zinc/29/83/06/587298306.db2.gz YPNMOFGTPLTYIV-ZDUSSCGKSA-N 1 2 246.310 2.123 20 0 BEADLO CCCONC(=O)Nc1c[nH+]c2c(C)cccn12 ZINC000825468521 587320324 /nfs/dbraw/zinc/32/03/24/587320324.db2.gz MTTZIDIRUMEYKG-UHFFFAOYSA-N 1 2 248.286 2.106 20 0 BEADLO CC1(CCC(=O)N[C@@H]2CCn3c[nH+]cc32)CC1 ZINC000825512312 587322669 /nfs/dbraw/zinc/32/26/69/587322669.db2.gz AYLUFAJUOLGGMH-SNVBAGLBSA-N 1 2 233.315 2.024 20 0 BEADLO C[C@@H](NC(=O)C[C@H]1CC=CCC1)c1[nH+]ccn1C ZINC000825544397 587324635 /nfs/dbraw/zinc/32/46/35/587324635.db2.gz JLGSQLZOHHWPAD-NEPJUHHUSA-N 1 2 247.342 2.344 20 0 BEADLO C[C@@H](NC(=O)C[C@@H]1CC=CCC1)c1[nH+]ccn1C ZINC000825544400 587324655 /nfs/dbraw/zinc/32/46/55/587324655.db2.gz JLGSQLZOHHWPAD-VXGBXAGGSA-N 1 2 247.342 2.344 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NCCCCC1CC1 ZINC000825662238 587330102 /nfs/dbraw/zinc/33/01/02/587330102.db2.gz SYRYACWQXCYOBT-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NCCCCC1CC1 ZINC000825662238 587330104 /nfs/dbraw/zinc/33/01/04/587330104.db2.gz SYRYACWQXCYOBT-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO CC1(C)C[C@@]1(C)NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000825684606 587332349 /nfs/dbraw/zinc/33/23/49/587332349.db2.gz YDIQFPMLRVGFGG-CQSZACIVSA-N 1 2 243.310 2.481 20 0 BEADLO COc1ncccc1C[N@@H+]1CCC[C@@H](F)C1 ZINC000826142461 587351317 /nfs/dbraw/zinc/35/13/17/587351317.db2.gz CNQCAMHFTKADOK-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO COc1ncccc1C[N@H+]1CCC[C@@H](F)C1 ZINC000826142461 587351318 /nfs/dbraw/zinc/35/13/18/587351318.db2.gz CNQCAMHFTKADOK-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO Cc1cc[nH+]c(N[C@H](C)C(C)C)c1-c1nn[nH]n1 ZINC000826311635 587352489 /nfs/dbraw/zinc/35/24/89/587352489.db2.gz KAJQHSWNHJTPPO-SECBINFHSA-N 1 2 246.318 2.027 20 0 BEADLO CC[C@H](C)C(=O)NC[C@@H]1c2ccccc2C[N@H+]1C ZINC000826731807 587360550 /nfs/dbraw/zinc/36/05/50/587360550.db2.gz ZMXNFLRYTRZERZ-SMDDNHRTSA-N 1 2 246.354 2.335 20 0 BEADLO CC[C@H](C)C(=O)NC[C@@H]1c2ccccc2C[N@@H+]1C ZINC000826731807 587360551 /nfs/dbraw/zinc/36/05/51/587360551.db2.gz ZMXNFLRYTRZERZ-SMDDNHRTSA-N 1 2 246.354 2.335 20 0 BEADLO Cc1c[nH]c(CNC(=O)C[C@H]2CC=CCC2)[nH+]1 ZINC000827582745 587390712 /nfs/dbraw/zinc/39/07/12/587390712.db2.gz WXSYZCOFRHYOAL-NSHDSACASA-N 1 2 233.315 2.081 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)C[C@@]1(C)CC1(Cl)Cl ZINC000827804221 587402874 /nfs/dbraw/zinc/40/28/74/587402874.db2.gz XKHRSOASHKWKNE-SECBINFHSA-N 1 2 248.157 2.425 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)C[C@@]1(C)CC1(Cl)Cl ZINC000827804221 587402876 /nfs/dbraw/zinc/40/28/76/587402876.db2.gz XKHRSOASHKWKNE-SECBINFHSA-N 1 2 248.157 2.425 20 0 BEADLO Cc1cc(C[NH2+][C@@H](c2ccccc2)[C@H](C)O)no1 ZINC000827855604 587405547 /nfs/dbraw/zinc/40/55/47/587405547.db2.gz FULOQCQMRJMVLI-SMDDNHRTSA-N 1 2 246.310 2.195 20 0 BEADLO C[C@@]1(Cn2cc[nH+]c2)CC1(Cl)Cl ZINC000828110373 587419777 /nfs/dbraw/zinc/41/97/77/587419777.db2.gz ZRYMORAKPGKNHI-ZETCQYMHSA-N 1 2 205.088 2.467 20 0 BEADLO C[C@H](CC1CCC1)NC(=O)/C=C\c1cn(C)c[nH+]1 ZINC000828271485 587429934 /nfs/dbraw/zinc/42/99/34/587429934.db2.gz ZODULWHRXUOGRL-JMEBYUIHSA-N 1 2 247.342 2.128 20 0 BEADLO CCCc1nsc(N[C@@H]2CCn3cc[nH+]c32)n1 ZINC000828358252 587437952 /nfs/dbraw/zinc/43/79/52/587437952.db2.gz QFRVIGWFNFPEQY-MRVPVSSYSA-N 1 2 249.343 2.244 20 0 BEADLO C[N@H+](Cc1csc(Cl)n1)CC1(O)CCC1 ZINC000828868981 587467890 /nfs/dbraw/zinc/46/78/90/587467890.db2.gz XOYSIIVRHXZXHY-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO C[N@@H+](Cc1csc(Cl)n1)CC1(O)CCC1 ZINC000828868981 587467891 /nfs/dbraw/zinc/46/78/91/587467891.db2.gz XOYSIIVRHXZXHY-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO O=C(N[C@@H]1CC12CCC2)c1cc2c[nH+]ccc2[nH]1 ZINC000828943592 587474026 /nfs/dbraw/zinc/47/40/26/587474026.db2.gz DFBGQCJOQOOPIS-GFCCVEGCSA-N 1 2 241.294 2.235 20 0 BEADLO C[C@H]1C[C@@H](Nc2cncc(Cl)n2)c2[nH+]ccn21 ZINC000829126841 587483919 /nfs/dbraw/zinc/48/39/19/587483919.db2.gz OHNNGAKDCBLDQU-JGVFFNPUSA-N 1 2 249.705 2.444 20 0 BEADLO O=C(NC[C@H]1C=CCC1)c1cc2c[nH+]ccc2[nH]1 ZINC000829149413 587485198 /nfs/dbraw/zinc/48/51/98/587485198.db2.gz FMDXAPPKPVOBDZ-JTQLQIEISA-N 1 2 241.294 2.259 20 0 BEADLO CCC[C@@H](C)CCNC(=O)/C=C/c1cn(C)c[nH+]1 ZINC000829165415 587485988 /nfs/dbraw/zinc/48/59/88/587485988.db2.gz QIIBFQWVLCOJMJ-NNNHXZLVSA-N 1 2 249.358 2.376 20 0 BEADLO O=C(NCc1cn2ccccc2[nH+]1)OC1CCC1 ZINC000829748598 587513696 /nfs/dbraw/zinc/51/36/96/587513696.db2.gz SNSFJTGYMUCTKO-UHFFFAOYSA-N 1 2 245.282 2.113 20 0 BEADLO C[C@]1([NH2+]CC/C=C/c2ccccc2)CCOC1=O ZINC000829962586 587530400 /nfs/dbraw/zinc/53/04/00/587530400.db2.gz LGLIVTVOPKRRAU-BOSPYUDASA-N 1 2 245.322 2.385 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@@H+]1CCC[C@](C)(F)C1 ZINC000830212701 587541318 /nfs/dbraw/zinc/54/13/18/587541318.db2.gz TZWQDSSHLONTIA-PWSUYJOCSA-N 1 2 231.311 2.152 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@H+]1CCC[C@](C)(F)C1 ZINC000830212701 587541319 /nfs/dbraw/zinc/54/13/19/587541319.db2.gz TZWQDSSHLONTIA-PWSUYJOCSA-N 1 2 231.311 2.152 20 0 BEADLO ClC1(Cl)C[C@@H]1C[N@H+](C1CC1)C1COC1 ZINC000830227479 587542650 /nfs/dbraw/zinc/54/26/50/587542650.db2.gz MIKHEXBMZHTHQI-SSDOTTSWSA-N 1 2 236.142 2.043 20 0 BEADLO ClC1(Cl)C[C@@H]1C[N@@H+](C1CC1)C1COC1 ZINC000830227479 587542651 /nfs/dbraw/zinc/54/26/51/587542651.db2.gz MIKHEXBMZHTHQI-SSDOTTSWSA-N 1 2 236.142 2.043 20 0 BEADLO CC(C)C1CCC(NC(=O)Cc2[nH]cc[nH+]2)CC1 ZINC000830349118 587546768 /nfs/dbraw/zinc/54/67/68/587546768.db2.gz XGAMTYBLYONNJY-UHFFFAOYSA-N 1 2 249.358 2.283 20 0 BEADLO O[C@@H](C[N@@H+]1CC[C@H](F)C1)c1cccc(Cl)c1 ZINC000830467841 587552671 /nfs/dbraw/zinc/55/26/71/587552671.db2.gz SHTUMZGBYXOFPC-RYUDHWBXSA-N 1 2 243.709 2.417 20 0 BEADLO O[C@@H](C[N@H+]1CC[C@H](F)C1)c1cccc(Cl)c1 ZINC000830467841 587552673 /nfs/dbraw/zinc/55/26/73/587552673.db2.gz SHTUMZGBYXOFPC-RYUDHWBXSA-N 1 2 243.709 2.417 20 0 BEADLO O=C1C[C@H](Oc2ccc([NH2+]C3CCCC3)cc2)N1 ZINC000830633787 587561854 /nfs/dbraw/zinc/56/18/54/587561854.db2.gz ZXYNEIOHVTXYBY-AWEZNQCLSA-N 1 2 246.310 2.266 20 0 BEADLO Cc1ccc2[nH+]c(COC(=O)C3(F)CC3)cn2c1 ZINC000830765727 587568897 /nfs/dbraw/zinc/56/88/97/587568897.db2.gz VVKJLNPYNRESLB-UHFFFAOYSA-N 1 2 248.257 2.188 20 0 BEADLO Cc1oncc1C[N@@H+](C)Cc1ccc(C)cn1 ZINC000831058669 587584238 /nfs/dbraw/zinc/58/42/38/587584238.db2.gz KQMNOKQQGVMVJJ-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1oncc1C[N@H+](C)Cc1ccc(C)cn1 ZINC000831058669 587584240 /nfs/dbraw/zinc/58/42/40/587584240.db2.gz KQMNOKQQGVMVJJ-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)N1CCCC12CCCCC2 ZINC000831340251 587599431 /nfs/dbraw/zinc/59/94/31/587599431.db2.gz AKECKHJVQNXMCP-UHFFFAOYSA-N 1 2 247.342 2.278 20 0 BEADLO CCCONC(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000831416625 587604819 /nfs/dbraw/zinc/60/48/19/587604819.db2.gz KHKPFMOAGUERNY-UHFFFAOYSA-N 1 2 248.286 2.106 20 0 BEADLO O=C(C1CC2(CC2)C1)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000831606598 587622929 /nfs/dbraw/zinc/62/29/29/587622929.db2.gz FGBNAAQWCJZSEZ-LLVKDONJSA-N 1 2 245.326 2.263 20 0 BEADLO CC[C@H](C)CCC(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833271636 587703354 /nfs/dbraw/zinc/70/33/54/587703354.db2.gz IMUXTZYRAMKXCK-QWRGUYRKSA-N 1 2 235.331 2.270 20 0 BEADLO CC1(C)CCC[C@H]1C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833279314 587703774 /nfs/dbraw/zinc/70/37/74/587703774.db2.gz YRXNIHVOAGZHCW-WDEREUQCSA-N 1 2 247.342 2.270 20 0 BEADLO CC(C)(C(=O)N[C@H]1CCn2cc[nH+]c21)C1CCC1 ZINC000833272612 587703843 /nfs/dbraw/zinc/70/38/43/587703843.db2.gz QHYAKNXSWIESMI-NSHDSACASA-N 1 2 247.342 2.270 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833278222 587704021 /nfs/dbraw/zinc/70/40/21/587704021.db2.gz PNQPSBMEQCZAAL-GYSYKLTISA-N 1 2 247.342 2.126 20 0 BEADLO CCCC[C@@H](C)C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833273086 587704242 /nfs/dbraw/zinc/70/42/42/587704242.db2.gz XLFIMOIKQYBVIM-GHMZBOCLSA-N 1 2 235.331 2.270 20 0 BEADLO CC1(C)C(C(=O)N[C@H]2CCn3cc[nH+]c32)C1(C)C ZINC000833285777 587704459 /nfs/dbraw/zinc/70/44/59/587704459.db2.gz SRSFKNGFAJIEIC-VIFPVBQESA-N 1 2 247.342 2.126 20 0 BEADLO CCC(CC)CC(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833283714 587704530 /nfs/dbraw/zinc/70/45/30/587704530.db2.gz DWXVDQXOLQWAGY-NSHDSACASA-N 1 2 235.331 2.270 20 0 BEADLO O=C(CC1=CCCCC1)N[C@H]1CCn2cc[nH+]c21 ZINC000833292689 587704692 /nfs/dbraw/zinc/70/46/92/587704692.db2.gz KGLBGSLOFLIXLC-LBPRGKRZSA-N 1 2 245.326 2.335 20 0 BEADLO O=C(CCC1CCC1)N[C@@H]1CCn2cc[nH+]c21 ZINC000833285796 587704808 /nfs/dbraw/zinc/70/48/08/587704808.db2.gz SWJFAHGIAQGNRP-LLVKDONJSA-N 1 2 233.315 2.024 20 0 BEADLO CCC(=CC(=O)N[C@@H]1CCn2cc[nH+]c21)CC ZINC000833284170 587704894 /nfs/dbraw/zinc/70/48/94/587704894.db2.gz HGYRFEVFAKIABL-LLVKDONJSA-N 1 2 233.315 2.191 20 0 BEADLO C[C@@H](C(=O)N[C@H]1CCn2cc[nH+]c21)C(C)(C)C ZINC000833292884 587705405 /nfs/dbraw/zinc/70/54/05/587705405.db2.gz OGWYYHMPLMDKSK-UWVGGRQHSA-N 1 2 235.331 2.126 20 0 BEADLO O=C(NC1=[NH+]CCS1)C1CCCCCC1 ZINC000101806595 587769749 /nfs/dbraw/zinc/76/97/49/587769749.db2.gz KDOMQSUTYLPRKU-UHFFFAOYSA-N 1 2 226.345 2.176 20 0 BEADLO CC(C)CCCC(=O)OCc1c[nH+]cn1C ZINC000835193651 587788390 /nfs/dbraw/zinc/78/83/90/587788390.db2.gz MTPXGPBYDXQBGV-UHFFFAOYSA-N 1 2 224.304 2.290 20 0 BEADLO CC(C)CCCC(=O)OCCc1c[nH+]cn1C ZINC000835322243 587796318 /nfs/dbraw/zinc/79/63/18/587796318.db2.gz GCZYBJDUGCOVAP-UHFFFAOYSA-N 1 2 238.331 2.332 20 0 BEADLO CC/C(C)=C\C(=O)OCCCc1[nH+]ccn1C ZINC000835329506 587796745 /nfs/dbraw/zinc/79/67/45/587796745.db2.gz CXHZKUGEIVRUBC-KHPPLWFESA-N 1 2 236.315 2.252 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)OCCn1cc[nH+]c1 ZINC000835348877 587797825 /nfs/dbraw/zinc/79/78/25/587797825.db2.gz DHWDGMVIFAEKJX-NEPJUHHUSA-N 1 2 236.315 2.253 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1C(=O)OCCn1cc[nH+]c1 ZINC000835351214 587798004 /nfs/dbraw/zinc/79/80/04/587798004.db2.gz YCQFHLWRRMAKRE-VXGBXAGGSA-N 1 2 236.315 2.109 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)OCc1c[nH+]ccc1OC ZINC000835443998 587802260 /nfs/dbraw/zinc/80/22/60/587802260.db2.gz TUJXIOYSWZXWLZ-MWLCHTKSSA-N 1 2 235.283 2.180 20 0 BEADLO CCC(C)(C)c1noc([C@H](C)[NH+](C)C)n1 ZINC000867172870 587830086 /nfs/dbraw/zinc/83/00/86/587830086.db2.gz IOELTDAFEMDOOA-QMMMGPOBSA-N 1 2 211.309 2.380 20 0 BEADLO CC(C)(C)C1CC(C(=O)NC2=[NH+]CCS2)C1 ZINC000837316783 587865864 /nfs/dbraw/zinc/86/58/64/587865864.db2.gz MOMFRMQVBLXPEL-UHFFFAOYSA-N 1 2 240.372 2.278 20 0 BEADLO C/C=C(/C=C/C(=O)OCCc1c[nH+]cn1C)CC ZINC000837580155 587883758 /nfs/dbraw/zinc/88/37/58/587883758.db2.gz APABKFXLODIFDF-GJQNCLFESA-N 1 2 248.326 2.418 20 0 BEADLO C/C(=C/C(=O)NCCc1cn(C)c[nH+]1)C(C)(C)C ZINC000837715105 587892045 /nfs/dbraw/zinc/89/20/45/587892045.db2.gz BGODHOPOQNZBGK-FLIBITNWSA-N 1 2 249.358 2.071 20 0 BEADLO NC(=[NH+]OCCC1CCOCC1)c1ccccc1 ZINC000842013696 587989048 /nfs/dbraw/zinc/98/90/48/587989048.db2.gz SHRXIPSRYNHPFG-UHFFFAOYSA-N 1 2 248.326 2.350 20 0 BEADLO CC[C@@H](CO[NH+]=C(N)Cc1ccccc1)OC ZINC000842022636 587989421 /nfs/dbraw/zinc/98/94/21/587989421.db2.gz ZXESZKDNGZETAO-LBPRGKRZSA-N 1 2 236.315 2.153 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OCc1cc(C)ccc1F ZINC000842037311 587992183 /nfs/dbraw/zinc/99/21/83/587992183.db2.gz XBGUNWPEIGUBIB-VIFPVBQESA-N 1 2 240.278 2.167 20 0 BEADLO CC(C)C[C@@H](C)O[NH+]=C(N)[C@H]1CCCO1 ZINC000842047833 587992790 /nfs/dbraw/zinc/99/27/90/587992790.db2.gz UWSOBOXCKVMWLK-NXEZZACHSA-N 1 2 214.309 2.098 20 0 BEADLO CCCCO[C@@H](C)c1nc(C[NH2+]CC)no1 ZINC000843145308 588086888 /nfs/dbraw/zinc/08/68/88/588086888.db2.gz IWBJXMAYLVOLFY-VIFPVBQESA-N 1 2 227.308 2.057 20 0 BEADLO CC[C@H]([NH3+])c1nc(-c2ccc3[nH]cnc3c2)no1 ZINC000843187315 588091069 /nfs/dbraw/zinc/09/10/69/588091069.db2.gz FFALJWBKNUWKHY-QMMMGPOBSA-N 1 2 243.270 2.023 20 0 BEADLO O=C(/C=C/C1CCCC1)N[C@H]1CCn2cc[nH+]c21 ZINC000843600370 588128452 /nfs/dbraw/zinc/12/84/52/588128452.db2.gz BZBMUIITZGJIHF-FYJFLYSWSA-N 1 2 245.326 2.191 20 0 BEADLO O=C(/C=C/C1CCCC1)N[C@@H]1CCn2cc[nH+]c21 ZINC000843600367 588128459 /nfs/dbraw/zinc/12/84/59/588128459.db2.gz BZBMUIITZGJIHF-BTDICHCPSA-N 1 2 245.326 2.191 20 0 BEADLO C[C@@]1(F)CCC[N@H+](Cc2cc3n(n2)CCC3)C1 ZINC000844333337 588185688 /nfs/dbraw/zinc/18/56/88/588185688.db2.gz HQUABDPLQWAMGY-CYBMUJFWSA-N 1 2 237.322 2.153 20 0 BEADLO C[C@@]1(F)CCC[N@@H+](Cc2cc3n(n2)CCC3)C1 ZINC000844333337 588185689 /nfs/dbraw/zinc/18/56/89/588185689.db2.gz HQUABDPLQWAMGY-CYBMUJFWSA-N 1 2 237.322 2.153 20 0 BEADLO CC(C)(C)OC(=O)C[N@H+](CCF)CC1CC1 ZINC000844411428 588191061 /nfs/dbraw/zinc/19/10/61/588191061.db2.gz YXAQHLKTOBDIHL-UHFFFAOYSA-N 1 2 231.311 2.010 20 0 BEADLO CC(C)(C)OC(=O)C[N@@H+](CCF)CC1CC1 ZINC000844411428 588191062 /nfs/dbraw/zinc/19/10/62/588191062.db2.gz YXAQHLKTOBDIHL-UHFFFAOYSA-N 1 2 231.311 2.010 20 0 BEADLO CCCOC(=O)[C@@H](C)[NH2+]C1(C2CCC2)CC1 ZINC000844418663 588191259 /nfs/dbraw/zinc/19/12/59/588191259.db2.gz IDKVMLSOVJZDTN-SNVBAGLBSA-N 1 2 225.332 2.250 20 0 BEADLO C[C@@H](CC(=O)N[C@@H](C)c1ccc[nH]1)n1cc[nH+]c1 ZINC000844453897 588195838 /nfs/dbraw/zinc/19/58/38/588195838.db2.gz IMEFSMACTRICLK-QWRGUYRKSA-N 1 2 246.314 2.040 20 0 BEADLO C[C@@H](OC(=O)C[C@H](C)n1cc[nH+]c1)C1CC1 ZINC000844457639 588196544 /nfs/dbraw/zinc/19/65/44/588196544.db2.gz DJHOMUTUMMVHHG-VHSXEESVSA-N 1 2 222.288 2.176 20 0 BEADLO C[C@H](CC(=O)NC12CCC(CC1)C2)n1cc[nH+]c1 ZINC000844475292 588198681 /nfs/dbraw/zinc/19/86/81/588198681.db2.gz ZVVRGGPTBZOUBT-LKSINWNRSA-N 1 2 247.342 2.283 20 0 BEADLO C[C@@H](CC(=O)N[C@@H]1CC[C@@H](C)C1)n1cc[nH+]c1 ZINC000844491977 588199594 /nfs/dbraw/zinc/19/95/94/588199594.db2.gz VJUOEWNNQLRKMT-GRYCIOLGSA-N 1 2 235.331 2.139 20 0 BEADLO Nc1cc(COC(=O)[C@@H]2C[C@H]2C2CCC2)cc[nH+]1 ZINC000845220300 588223851 /nfs/dbraw/zinc/22/38/51/588223851.db2.gz RQDORXIVUDSHLM-NWDGAFQWSA-N 1 2 246.310 2.143 20 0 BEADLO COC/C(C)=C\C(=O)OCc1ccc(C)[nH+]c1C ZINC000845242236 588224646 /nfs/dbraw/zinc/22/46/46/588224646.db2.gz HYYJWEGIBYNFEF-YFHOEESVSA-N 1 2 249.310 2.334 20 0 BEADLO C[C@@H](CC(=O)OCCC1CC1)n1cc[nH+]c1 ZINC000845281432 588225520 /nfs/dbraw/zinc/22/55/20/588225520.db2.gz HIQSYVLOCGJABU-JTQLQIEISA-N 1 2 222.288 2.178 20 0 BEADLO CC(C)CCOC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000845279649 588225558 /nfs/dbraw/zinc/22/55/58/588225558.db2.gz XGOHRRUBNLCJQU-LLVKDONJSA-N 1 2 224.304 2.424 20 0 BEADLO CC(C)=CCOC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000845285780 588225755 /nfs/dbraw/zinc/22/57/55/588225755.db2.gz SVSKDFOPCWLXAS-NSHDSACASA-N 1 2 222.288 2.344 20 0 BEADLO C[C@H](CC(=O)OC1(C2CC2)CC1)n1cc[nH+]c1 ZINC000845477115 588229836 /nfs/dbraw/zinc/22/98/36/588229836.db2.gz LFRBYRJYRIBALI-SNVBAGLBSA-N 1 2 234.299 2.320 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@@H]1C[C@@H]2C=C[C@H]1CC2 ZINC000845479525 588230023 /nfs/dbraw/zinc/23/00/23/588230023.db2.gz PJGJKBBADPYVSR-NTZNESFSSA-N 1 2 246.310 2.066 20 0 BEADLO C[C@H](CC(=O)O[C@@H](C)C(F)F)n1cc[nH+]c1 ZINC000845526809 588232123 /nfs/dbraw/zinc/23/21/23/588232123.db2.gz MAYUOCOOTABYSK-SFYZADRCSA-N 1 2 232.230 2.031 20 0 BEADLO Cc1cc(COC(=O)C[C@H](C)n2cc[nH+]c2)co1 ZINC000845582000 588234078 /nfs/dbraw/zinc/23/40/78/588234078.db2.gz DRWWIDQTNWFTDR-JTQLQIEISA-N 1 2 248.282 2.479 20 0 BEADLO CS[C@H](C)COC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000845585584 588234158 /nfs/dbraw/zinc/23/41/58/588234158.db2.gz GIKQTUNGOYOHDE-VHSXEESVSA-N 1 2 242.344 2.129 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1cccc2c1CCC2 ZINC000845910481 588250280 /nfs/dbraw/zinc/25/02/80/588250280.db2.gz BAJNHXFPEPSBSF-UHFFFAOYSA-N 1 2 247.338 2.170 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1cccc2c1CCC2 ZINC000845910481 588250281 /nfs/dbraw/zinc/25/02/81/588250281.db2.gz BAJNHXFPEPSBSF-UHFFFAOYSA-N 1 2 247.338 2.170 20 0 BEADLO FCC(CF)[NH2+]Cc1cc2cnccc2o1 ZINC000845983678 588252506 /nfs/dbraw/zinc/25/25/06/588252506.db2.gz XJIGKKLUJMGETR-UHFFFAOYSA-N 1 2 226.226 2.225 20 0 BEADLO FC1(F)[C@H]2C[N@H+](Cc3coc(C4CC4)n3)C[C@H]21 ZINC000846112244 588257377 /nfs/dbraw/zinc/25/73/77/588257377.db2.gz QRKPIGXEOPPVCU-AOOOYVTPSA-N 1 2 240.253 2.249 20 0 BEADLO FC1(F)[C@H]2C[N@@H+](Cc3coc(C4CC4)n3)C[C@H]21 ZINC000846112244 588257378 /nfs/dbraw/zinc/25/73/78/588257378.db2.gz QRKPIGXEOPPVCU-AOOOYVTPSA-N 1 2 240.253 2.249 20 0 BEADLO C[C@@H](O)c1ncc(C[N@@H+]2CCC[C@H](F)C2)s1 ZINC000846120527 588258109 /nfs/dbraw/zinc/25/81/09/588258109.db2.gz RHDGWAYFIWAHTA-BDAKNGLRSA-N 1 2 244.335 2.130 20 0 BEADLO C[C@@H](O)c1ncc(C[N@H+]2CCC[C@H](F)C2)s1 ZINC000846120527 588258110 /nfs/dbraw/zinc/25/81/10/588258110.db2.gz RHDGWAYFIWAHTA-BDAKNGLRSA-N 1 2 244.335 2.130 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCC[C@H](F)C2)nc1 ZINC000846120333 588258198 /nfs/dbraw/zinc/25/81/98/588258198.db2.gz OINJJGFCSFUKNY-NSHDSACASA-N 1 2 238.306 2.414 20 0 BEADLO CCOc1ccc(C[N@H+]2CCC[C@H](F)C2)nc1 ZINC000846120333 588258199 /nfs/dbraw/zinc/25/81/99/588258199.db2.gz OINJJGFCSFUKNY-NSHDSACASA-N 1 2 238.306 2.414 20 0 BEADLO CC(C)(NC(=O)C1(F)CCCC1)c1[nH]cc[nH+]1 ZINC000846244860 588262367 /nfs/dbraw/zinc/26/23/67/588262367.db2.gz OUIDIEWLOJLUMQ-UHFFFAOYSA-N 1 2 239.294 2.043 20 0 BEADLO C[C@@H]([N@H+](C)Cc1cnsn1)C(C)(C)C ZINC000846768705 588286798 /nfs/dbraw/zinc/28/67/98/588286798.db2.gz DJSLXTFRAIMTNT-MRVPVSSYSA-N 1 2 213.350 2.405 20 0 BEADLO C[C@@H]([N@@H+](C)Cc1cnsn1)C(C)(C)C ZINC000846768705 588286799 /nfs/dbraw/zinc/28/67/99/588286799.db2.gz DJSLXTFRAIMTNT-MRVPVSSYSA-N 1 2 213.350 2.405 20 0 BEADLO Cc1cc[nH+]cc1NCc1cnc(Cl)n1C ZINC000846774566 588287413 /nfs/dbraw/zinc/28/74/13/588287413.db2.gz DRDHPANDGPXYFS-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO Cc1[nH+]cccc1NCc1cnc(Cl)n1C ZINC000846774532 588287459 /nfs/dbraw/zinc/28/74/59/588287459.db2.gz USOUCPBLOADTDI-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO CC(C)C1CC[NH+](Cc2cnsn2)CC1 ZINC000846807959 588289975 /nfs/dbraw/zinc/28/99/75/588289975.db2.gz XICYADKEDKKTSL-UHFFFAOYSA-N 1 2 225.361 2.406 20 0 BEADLO CC(C)[N@@H+](Cc1cnsn1)CC1CC1 ZINC000846817161 588290749 /nfs/dbraw/zinc/29/07/49/588290749.db2.gz LURMMOXRNVYBNB-UHFFFAOYSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@@H+]1CC1(Br)CC1 ZINC000846817835 588291063 /nfs/dbraw/zinc/29/10/63/588291063.db2.gz OXRWJPJSVHQBOG-BDAKNGLRSA-N 1 2 248.164 2.023 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@H+]1CC1(Br)CC1 ZINC000846817835 588291064 /nfs/dbraw/zinc/29/10/64/588291064.db2.gz OXRWJPJSVHQBOG-BDAKNGLRSA-N 1 2 248.164 2.023 20 0 BEADLO Fc1cc(C[N@@H+]2CC[C@@H]3C[C@@H]32)cnc1Cl ZINC000846837126 588291895 /nfs/dbraw/zinc/29/18/95/588291895.db2.gz KRMASHORFIZTRV-SCZZXKLOSA-N 1 2 226.682 2.468 20 0 BEADLO Fc1cc(C[N@H+]2CC[C@@H]3C[C@@H]32)cnc1Cl ZINC000846837126 588291896 /nfs/dbraw/zinc/29/18/96/588291896.db2.gz KRMASHORFIZTRV-SCZZXKLOSA-N 1 2 226.682 2.468 20 0 BEADLO CC[C@H](CSC)[N@H+](C)Cc1cnsn1 ZINC000846839128 588292073 /nfs/dbraw/zinc/29/20/73/588292073.db2.gz DBHKKCAAZRYBIT-SECBINFHSA-N 1 2 231.390 2.112 20 0 BEADLO CC[C@H](CSC)[N@@H+](C)Cc1cnsn1 ZINC000846839128 588292074 /nfs/dbraw/zinc/29/20/74/588292074.db2.gz DBHKKCAAZRYBIT-SECBINFHSA-N 1 2 231.390 2.112 20 0 BEADLO Fc1cccc(C2([NH2+]Cc3cnsn3)CC2)c1 ZINC000846844961 588293034 /nfs/dbraw/zinc/29/30/34/588293034.db2.gz GCGNPTQTLAUJLM-UHFFFAOYSA-N 1 2 249.314 2.456 20 0 BEADLO C[N@@H+](Cc1cnsn1)C[C@@H]1CC=CCC1 ZINC000846852076 588293452 /nfs/dbraw/zinc/29/34/52/588293452.db2.gz VZKNLPQBPRPRJP-SNVBAGLBSA-N 1 2 223.345 2.326 20 0 BEADLO C[N@H+](Cc1cnsn1)C[C@@H]1CC=CCC1 ZINC000846852076 588293453 /nfs/dbraw/zinc/29/34/53/588293453.db2.gz VZKNLPQBPRPRJP-SNVBAGLBSA-N 1 2 223.345 2.326 20 0 BEADLO FCC[N@@H+]1CCC=C(c2ccccn2)C1 ZINC000846923940 588297232 /nfs/dbraw/zinc/29/72/32/588297232.db2.gz VISDENGRDFWNEC-UHFFFAOYSA-N 1 2 206.264 2.140 20 0 BEADLO FCC[N@H+]1CCC=C(c2ccccn2)C1 ZINC000846923940 588297233 /nfs/dbraw/zinc/29/72/33/588297233.db2.gz VISDENGRDFWNEC-UHFFFAOYSA-N 1 2 206.264 2.140 20 0 BEADLO CC(=O)C1CC[NH+](Cc2ccncc2F)CC1 ZINC000846938362 588297813 /nfs/dbraw/zinc/29/78/13/588297813.db2.gz IWHJIBKNGYCGPP-UHFFFAOYSA-N 1 2 236.290 2.022 20 0 BEADLO CON1CC[NH+](Cc2sccc2Cl)CC1 ZINC000846973273 588299365 /nfs/dbraw/zinc/29/93/65/588299365.db2.gz XHPKGSCEQPSESV-UHFFFAOYSA-N 1 2 246.763 2.081 20 0 BEADLO C[C@@H]1CCC[C@@H](CNC(=O)Cc2[nH]cc[nH+]2)[C@H]1C ZINC000846986361 588300450 /nfs/dbraw/zinc/30/04/50/588300450.db2.gz JXBUYNDYDGNGPX-WOPDTQHZSA-N 1 2 249.358 2.141 20 0 BEADLO CCCCOC(=O)C(C)(C)[NH2+]CCSC ZINC000847057088 588305143 /nfs/dbraw/zinc/30/51/43/588305143.db2.gz FNYVMQBVCOZHEG-UHFFFAOYSA-N 1 2 233.377 2.061 20 0 BEADLO C[C@@H](NC(=O)C(F)=C1CCCC1)c1[nH]cc[nH+]1 ZINC000848387151 588375912 /nfs/dbraw/zinc/37/59/12/588375912.db2.gz KYFLXHNZUGUIAL-MRVPVSSYSA-N 1 2 237.278 2.385 20 0 BEADLO Cn1c(C[NH2+][C@@H]2CCCC2(F)F)cnc1Cl ZINC000848553093 588394287 /nfs/dbraw/zinc/39/42/87/588394287.db2.gz QGKCMBAFKSJBKE-MRVPVSSYSA-N 1 2 249.692 2.351 20 0 BEADLO CC[NH2+]Cc1noc(/C(C)=C/c2ccccn2)n1 ZINC000848617804 588401971 /nfs/dbraw/zinc/40/19/71/588401971.db2.gz MZKGAOIAYJCMJW-CSKARUKUSA-N 1 2 244.298 2.135 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)OCC3CC3)ccn12 ZINC000848781382 588413773 /nfs/dbraw/zinc/41/37/73/588413773.db2.gz JXNNGKDCEGNYOE-UHFFFAOYSA-N 1 2 230.267 2.210 20 0 BEADLO Cc1cc(CNC(=S)NCC2CC2)cc(C)[nH+]1 ZINC000849265369 588467897 /nfs/dbraw/zinc/46/78/97/588467897.db2.gz KZMMXAXSTZDSAU-UHFFFAOYSA-N 1 2 249.383 2.073 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[NH2+][C@@H]1C=CCC1 ZINC000849322277 588472603 /nfs/dbraw/zinc/47/26/03/588472603.db2.gz GJYJFZMKQQAEKZ-VXGBXAGGSA-N 1 2 225.332 2.272 20 0 BEADLO Cc1[nH]c(CNc2cnn(C)c2C2CC2)[nH+]c1C ZINC000850250270 588531409 /nfs/dbraw/zinc/53/14/09/588531409.db2.gz RPQVDZLPRXZSMW-UHFFFAOYSA-N 1 2 245.330 2.250 20 0 BEADLO CCONC(=O)C[NH2+][C@@H]1CCCC(C)(C)CC1 ZINC000850339417 588535936 /nfs/dbraw/zinc/53/59/36/588535936.db2.gz SGGRHSCAFMEICU-LLVKDONJSA-N 1 2 242.363 2.003 20 0 BEADLO c1csc([C@H]([NH2+][C@H]2C=CCC2)c2nnc[nH]2)c1 ZINC000850509552 588554596 /nfs/dbraw/zinc/55/45/96/588554596.db2.gz RJRASDWZGBTUDF-ONGXEEELSA-N 1 2 246.339 2.264 20 0 BEADLO CCc1noc(C)c1[C@H](C)[NH2+]Cc1ncccn1 ZINC000850552039 588559556 /nfs/dbraw/zinc/55/95/56/588559556.db2.gz JTYRQVAXMDQTKX-VIFPVBQESA-N 1 2 246.314 2.186 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]CC1SCCS1 ZINC000850562268 588560652 /nfs/dbraw/zinc/56/06/52/588560652.db2.gz YYPZRHYNZJLLOT-ZETCQYMHSA-N 1 2 243.401 2.175 20 0 BEADLO Cc1ccccc1C(F)(F)C[NH2+][C@@H](C)CCO ZINC000850562459 588560667 /nfs/dbraw/zinc/56/06/67/588560667.db2.gz VIIHFXWZHGWCNZ-NSHDSACASA-N 1 2 243.297 2.447 20 0 BEADLO CCCC[C@@](C)(F)C(=O)OCc1c[nH+]cn1C ZINC000850868263 588571951 /nfs/dbraw/zinc/57/19/51/588571951.db2.gz BKEVDDVHNHLHKY-GFCCVEGCSA-N 1 2 242.294 2.382 20 0 BEADLO C[C@H](CC(=O)OC[C@@H]1C[C@H]2C[C@H]2C1)n1cc[nH+]c1 ZINC000851218570 588597223 /nfs/dbraw/zinc/59/72/23/588597223.db2.gz XYUXRBRMPYCRRT-FVCCEPFGSA-N 1 2 248.326 2.424 20 0 BEADLO C[C@@H](CC(=O)OCC1CC(C)C1)n1cc[nH+]c1 ZINC000851465320 588606533 /nfs/dbraw/zinc/60/65/33/588606533.db2.gz YSWKNNAKIZWBQO-CXQJBGSLSA-N 1 2 236.315 2.424 20 0 BEADLO Cn1cc(C[N@H+](C)CC=C(Cl)Cl)cn1 ZINC000851713624 588615680 /nfs/dbraw/zinc/61/56/80/588615680.db2.gz HMPHHYNMYWGNPW-UHFFFAOYSA-N 1 2 234.130 2.171 20 0 BEADLO Cn1cc(C[N@@H+](C)CC=C(Cl)Cl)cn1 ZINC000851713624 588615681 /nfs/dbraw/zinc/61/56/81/588615681.db2.gz HMPHHYNMYWGNPW-UHFFFAOYSA-N 1 2 234.130 2.171 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1cccc(F)n1 ZINC000851729244 588618931 /nfs/dbraw/zinc/61/89/31/588618931.db2.gz IXIITCKJMJUTOD-JQWIXIFHSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1cccc(F)n1 ZINC000851729244 588618932 /nfs/dbraw/zinc/61/89/32/588618932.db2.gz IXIITCKJMJUTOD-JQWIXIFHSA-N 1 2 238.306 2.220 20 0 BEADLO C[N@H+](CC=C(Cl)Cl)C[C@@H]1CCCO1 ZINC000851730951 588619691 /nfs/dbraw/zinc/61/96/91/588619691.db2.gz VRDKEMZSRDGPPW-QMMMGPOBSA-N 1 2 224.131 2.416 20 0 BEADLO C[N@@H+](CC=C(Cl)Cl)C[C@@H]1CCCO1 ZINC000851730951 588619692 /nfs/dbraw/zinc/61/96/92/588619692.db2.gz VRDKEMZSRDGPPW-QMMMGPOBSA-N 1 2 224.131 2.416 20 0 BEADLO CC[N@H+](Cc1cnon1)[C@H](C)c1cccc(O)c1 ZINC000851801321 588630966 /nfs/dbraw/zinc/63/09/66/588630966.db2.gz GTTPCHUDEZMTGK-SNVBAGLBSA-N 1 2 247.298 2.358 20 0 BEADLO CC[N@@H+](Cc1cnon1)[C@H](C)c1cccc(O)c1 ZINC000851801321 588630967 /nfs/dbraw/zinc/63/09/67/588630967.db2.gz GTTPCHUDEZMTGK-SNVBAGLBSA-N 1 2 247.298 2.358 20 0 BEADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cnon2)n1 ZINC000851812672 588632542 /nfs/dbraw/zinc/63/25/42/588632542.db2.gz JDWQDEAYADUFQU-ZDUSSCGKSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cnon2)n1 ZINC000851812672 588632543 /nfs/dbraw/zinc/63/25/43/588632543.db2.gz JDWQDEAYADUFQU-ZDUSSCGKSA-N 1 2 244.298 2.110 20 0 BEADLO CC(C)[N@H+](CC(F)F)C[C@@H]1COC(C)(C)O1 ZINC000851817727 588633047 /nfs/dbraw/zinc/63/30/47/588633047.db2.gz HXZLLOJFNFMNBR-SECBINFHSA-N 1 2 237.290 2.113 20 0 BEADLO CC(C)[N@@H+](CC(F)F)C[C@@H]1COC(C)(C)O1 ZINC000851817727 588633048 /nfs/dbraw/zinc/63/30/48/588633048.db2.gz HXZLLOJFNFMNBR-SECBINFHSA-N 1 2 237.290 2.113 20 0 BEADLO CC(C)[N@H+](CC(F)F)C[C@H]1COC(C)(C)O1 ZINC000851817729 588633055 /nfs/dbraw/zinc/63/30/55/588633055.db2.gz HXZLLOJFNFMNBR-VIFPVBQESA-N 1 2 237.290 2.113 20 0 BEADLO CC(C)[N@@H+](CC(F)F)C[C@H]1COC(C)(C)O1 ZINC000851817729 588633056 /nfs/dbraw/zinc/63/30/56/588633056.db2.gz HXZLLOJFNFMNBR-VIFPVBQESA-N 1 2 237.290 2.113 20 0 BEADLO Oc1ccc([C@@H]2CCC[N@@H+]2Cc2cnon2)cc1 ZINC000851825003 588633771 /nfs/dbraw/zinc/63/37/71/588633771.db2.gz RDNFGNDWOZFHKH-ZDUSSCGKSA-N 1 2 245.282 2.112 20 0 BEADLO Oc1ccc([C@@H]2CCC[N@H+]2Cc2cnon2)cc1 ZINC000851825003 588633772 /nfs/dbraw/zinc/63/37/72/588633772.db2.gz RDNFGNDWOZFHKH-ZDUSSCGKSA-N 1 2 245.282 2.112 20 0 BEADLO C[N@H+](CC=C(Cl)Cl)Cc1cn[nH]c1 ZINC000851851852 588635025 /nfs/dbraw/zinc/63/50/25/588635025.db2.gz VFHCSLDAQMGTQU-UHFFFAOYSA-N 1 2 220.103 2.161 20 0 BEADLO C[N@@H+](CC=C(Cl)Cl)Cc1cn[nH]c1 ZINC000851851852 588635026 /nfs/dbraw/zinc/63/50/26/588635026.db2.gz VFHCSLDAQMGTQU-UHFFFAOYSA-N 1 2 220.103 2.161 20 0 BEADLO ClC(Cl)=CC[N@@H+]1CCOC[C@@H]1C1CC1 ZINC000851878595 588639092 /nfs/dbraw/zinc/63/90/92/588639092.db2.gz CZHXRRONOCJFJB-SECBINFHSA-N 1 2 236.142 2.416 20 0 BEADLO ClC(Cl)=CC[N@H+]1CCOC[C@@H]1C1CC1 ZINC000851878595 588639093 /nfs/dbraw/zinc/63/90/93/588639093.db2.gz CZHXRRONOCJFJB-SECBINFHSA-N 1 2 236.142 2.416 20 0 BEADLO CCc1nocc1CN1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000851887553 588640328 /nfs/dbraw/zinc/64/03/28/588640328.db2.gz RNIZWRULYLSFAX-GFCCVEGCSA-N 1 2 246.314 2.297 20 0 BEADLO CCc1nocc1C[N@@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000851887553 588640329 /nfs/dbraw/zinc/64/03/29/588640329.db2.gz RNIZWRULYLSFAX-GFCCVEGCSA-N 1 2 246.314 2.297 20 0 BEADLO CCc1nocc1C[N@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000851887553 588640330 /nfs/dbraw/zinc/64/03/30/588640330.db2.gz RNIZWRULYLSFAX-GFCCVEGCSA-N 1 2 246.314 2.297 20 0 BEADLO CCc1nocc1CN1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000851887555 588640573 /nfs/dbraw/zinc/64/05/73/588640573.db2.gz RNIZWRULYLSFAX-LBPRGKRZSA-N 1 2 246.314 2.297 20 0 BEADLO CCc1nocc1C[N@@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000851887555 588640574 /nfs/dbraw/zinc/64/05/74/588640574.db2.gz RNIZWRULYLSFAX-LBPRGKRZSA-N 1 2 246.314 2.297 20 0 BEADLO CCc1nocc1C[N@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000851887555 588640575 /nfs/dbraw/zinc/64/05/75/588640575.db2.gz RNIZWRULYLSFAX-LBPRGKRZSA-N 1 2 246.314 2.297 20 0 BEADLO C[C@@H]([NH2+]Cc1cnon1)c1ccc(F)cc1F ZINC000851892488 588641454 /nfs/dbraw/zinc/64/14/54/588641454.db2.gz KJWWWOOOVSMJFI-SSDOTTSWSA-N 1 2 239.225 2.199 20 0 BEADLO Cc1cccc(C(C)(C)[NH2+]Cc2cnon2)c1 ZINC000851902730 588642103 /nfs/dbraw/zinc/64/21/03/588642103.db2.gz KJPMMPSNLXHRES-UHFFFAOYSA-N 1 2 231.299 2.403 20 0 BEADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1cnon1 ZINC000851912629 588643269 /nfs/dbraw/zinc/64/32/69/588643269.db2.gz OCIRFAXYFLCASR-SFYZADRCSA-N 1 2 249.236 2.232 20 0 BEADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1cnon1 ZINC000851912629 588643270 /nfs/dbraw/zinc/64/32/70/588643270.db2.gz OCIRFAXYFLCASR-SFYZADRCSA-N 1 2 249.236 2.232 20 0 BEADLO COc1cc(C[N@@H+]2CCC[C@](C)(F)C2)on1 ZINC000852096066 588661849 /nfs/dbraw/zinc/66/18/49/588661849.db2.gz HMWFTUDSBDVESJ-NSHDSACASA-N 1 2 228.267 2.007 20 0 BEADLO COc1cc(C[N@H+]2CCC[C@](C)(F)C2)on1 ZINC000852096066 588661850 /nfs/dbraw/zinc/66/18/50/588661850.db2.gz HMWFTUDSBDVESJ-NSHDSACASA-N 1 2 228.267 2.007 20 0 BEADLO CN(C/C(Cl)=C\Cl)Cc1c[nH+]c[nH]1 ZINC000852288683 588676497 /nfs/dbraw/zinc/67/64/97/588676497.db2.gz RTVFUDUTHRQBRR-FARCUNLSSA-N 1 2 220.103 2.161 20 0 BEADLO CN(C/C(Cl)=C\Cl)Cc1c[nH]c[nH+]1 ZINC000852288683 588676498 /nfs/dbraw/zinc/67/64/98/588676498.db2.gz RTVFUDUTHRQBRR-FARCUNLSSA-N 1 2 220.103 2.161 20 0 BEADLO Cc1oncc1C[NH2+][C@@H](C)c1cscn1 ZINC000852417751 588681878 /nfs/dbraw/zinc/68/18/78/588681878.db2.gz XGFZXDAYMBDXOS-ZETCQYMHSA-N 1 2 223.301 2.290 20 0 BEADLO COCC[N@H+](CCF)Cc1ccsc1 ZINC000852479368 588683303 /nfs/dbraw/zinc/68/33/03/588683303.db2.gz DNSCZXJTHQJMFH-UHFFFAOYSA-N 1 2 217.309 2.166 20 0 BEADLO COCC[N@@H+](CCF)Cc1ccsc1 ZINC000852479368 588683304 /nfs/dbraw/zinc/68/33/04/588683304.db2.gz DNSCZXJTHQJMFH-UHFFFAOYSA-N 1 2 217.309 2.166 20 0 BEADLO COCC[N@H+](CCF)C[C@H]1CC1(Cl)Cl ZINC000852484510 588685054 /nfs/dbraw/zinc/68/50/54/588685054.db2.gz GGJFUAQRFKPTSD-MRVPVSSYSA-N 1 2 244.137 2.098 20 0 BEADLO COCC[N@@H+](CCF)C[C@H]1CC1(Cl)Cl ZINC000852484510 588685055 /nfs/dbraw/zinc/68/50/55/588685055.db2.gz GGJFUAQRFKPTSD-MRVPVSSYSA-N 1 2 244.137 2.098 20 0 BEADLO Cc1c(C[N@@H+]2CCOCC2(C)C)ccnc1F ZINC000862231506 589195607 /nfs/dbraw/zinc/19/56/07/589195607.db2.gz IRNNTFDHNMCCST-UHFFFAOYSA-N 1 2 238.306 2.140 20 0 BEADLO Cc1c(C[N@H+]2CCOCC2(C)C)ccnc1F ZINC000862231506 589195608 /nfs/dbraw/zinc/19/56/08/589195608.db2.gz IRNNTFDHNMCCST-UHFFFAOYSA-N 1 2 238.306 2.140 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1ccnc(F)c1C ZINC000862228637 589195809 /nfs/dbraw/zinc/19/58/09/589195809.db2.gz UIUFYCWYBXSWQA-LBPRGKRZSA-N 1 2 238.306 2.140 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1ccnc(F)c1C ZINC000862228637 589195811 /nfs/dbraw/zinc/19/58/11/589195811.db2.gz UIUFYCWYBXSWQA-LBPRGKRZSA-N 1 2 238.306 2.140 20 0 BEADLO Cc1c(C[N@H+]2CCO[C@H](C)[C@H]2C)ccnc1F ZINC000862245739 589196624 /nfs/dbraw/zinc/19/66/24/589196624.db2.gz WIVQGAFMHPDBEL-GHMZBOCLSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1c(C[N@@H+]2CCO[C@H](C)[C@H]2C)ccnc1F ZINC000862245739 589196626 /nfs/dbraw/zinc/19/66/26/589196626.db2.gz WIVQGAFMHPDBEL-GHMZBOCLSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1c[nH]c(CN2CCC[C@](C)(F)C2)[nH+]1 ZINC000862381296 589206300 /nfs/dbraw/zinc/20/63/00/589206300.db2.gz BVXDIEKPGNPICU-NSHDSACASA-N 1 2 211.284 2.042 20 0 BEADLO Fc1cc(C[NH+]2CC3(CC(F)C3)C2)ccn1 ZINC000862390152 589208075 /nfs/dbraw/zinc/20/80/75/589208075.db2.gz SKADKPQKUZQJDG-UHFFFAOYSA-N 1 2 224.254 2.155 20 0 BEADLO c1c[nH+]c(COC[C@H]2C[C@H]3C=C[C@@H]2C3)[nH]1 ZINC000863315199 589278724 /nfs/dbraw/zinc/27/87/24/589278724.db2.gz OOWRSRTVPWELBL-HBNTYKKESA-N 1 2 204.273 2.139 20 0 BEADLO COc1cccc(C(N)=[NH+]OC[C@@H]2C[C@@H]2C)c1 ZINC000863458270 589289912 /nfs/dbraw/zinc/28/99/12/589289912.db2.gz XUGPJQSWBCWRTP-ONGXEEELSA-N 1 2 234.299 2.198 20 0 BEADLO CCC[C@@H](OCC)c1nc(C[NH2+]CC)no1 ZINC000863655160 589308208 /nfs/dbraw/zinc/30/82/08/589308208.db2.gz AUYCVRONTUPIHV-SECBINFHSA-N 1 2 227.308 2.057 20 0 BEADLO CC[C@@H]1CC[N@H+](Cn2ncsc2=S)C1 ZINC000119579206 589309511 /nfs/dbraw/zinc/30/95/11/589309511.db2.gz VDUNVWBMBZABLK-MRVPVSSYSA-N 1 2 229.374 2.363 20 0 BEADLO CC[C@@H]1CC[N@@H+](Cn2ncsc2=S)C1 ZINC000119579206 589309512 /nfs/dbraw/zinc/30/95/12/589309512.db2.gz VDUNVWBMBZABLK-MRVPVSSYSA-N 1 2 229.374 2.363 20 0 BEADLO Cc1[nH]cc(-c2cccc3c2OCC3)[nH+]1 ZINC000863700418 589311831 /nfs/dbraw/zinc/31/18/31/589311831.db2.gz PWGNNDAEBDUGCM-UHFFFAOYSA-N 1 2 200.241 2.320 20 0 BEADLO Cc1ncc(C[N@H+]2CC3(CCC3)OC[C@H]2C)o1 ZINC000864051962 589335407 /nfs/dbraw/zinc/33/54/07/589335407.db2.gz WXOWXVPNKNHHMQ-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1ncc(C[N@@H+]2CC3(CCC3)OC[C@H]2C)o1 ZINC000864051962 589335409 /nfs/dbraw/zinc/33/54/09/589335409.db2.gz WXOWXVPNKNHHMQ-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO C[C@H](O)c1cccc(N[C@H]2CO[C@H](C3CC3)C2)[nH+]1 ZINC000864090603 589343470 /nfs/dbraw/zinc/34/34/70/589343470.db2.gz GTYUFZNTFUFCME-NDMJEZRESA-N 1 2 248.326 2.114 20 0 BEADLO CCO[C@@]1(C)C[C@H]1Nc1cccc([C@H](C)O)[nH+]1 ZINC000864093322 589344483 /nfs/dbraw/zinc/34/44/83/589344483.db2.gz NHMMDPDIOWTGIQ-NDMJEZRESA-N 1 2 236.315 2.114 20 0 BEADLO C[C@@H](C[S@](=O)Cc1c[nH+]cn1C)C(C)(C)C ZINC000864472041 589373424 /nfs/dbraw/zinc/37/34/24/589373424.db2.gz HPKSBNLUXJVNSS-QFYYESIMSA-N 1 2 242.388 2.351 20 0 BEADLO Cc1[nH]cc(-c2ccc([C@@H](C)O)cc2)[nH+]1 ZINC000864549806 589378197 /nfs/dbraw/zinc/37/81/97/589378197.db2.gz JASCLLGWYUWMJD-MRVPVSSYSA-N 1 2 202.257 2.438 20 0 BEADLO CC(C)(C)c1cn(C[C@@H]2CCOC2)c[nH+]1 ZINC000865375975 589428000 /nfs/dbraw/zinc/42/80/00/589428000.db2.gz SWCYFLNTDQRCMM-JTQLQIEISA-N 1 2 208.305 2.217 20 0 BEADLO CC(C)(C)c1cn(C[C@H]2CCCO2)c[nH+]1 ZINC000865374775 589428076 /nfs/dbraw/zinc/42/80/76/589428076.db2.gz KFHXVFFKPPMYIQ-SNVBAGLBSA-N 1 2 208.305 2.360 20 0 BEADLO CC(C)(C)c1cn(CN2CCCCC2=O)c[nH+]1 ZINC000865376248 589428279 /nfs/dbraw/zinc/42/82/79/589428279.db2.gz GDIWWQBYMOWQEZ-UHFFFAOYSA-N 1 2 235.331 2.151 20 0 BEADLO CC(C)(C)c1cn(Cc2noc(C3CC3)n2)c[nH+]1 ZINC000865375927 589428409 /nfs/dbraw/zinc/42/84/09/589428409.db2.gz RCMHETPLPKPDIF-UHFFFAOYSA-N 1 2 246.314 2.489 20 0 BEADLO CN(CC1CC1)C(=O)Cn1c[nH+]c(C(C)(C)C)c1 ZINC000865375964 589428496 /nfs/dbraw/zinc/42/84/96/589428496.db2.gz SIZAKDCOZMGZQN-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO COc1cc(Cn2c[nH+]c(C(C)(C)C)c2)on1 ZINC000865376552 589428873 /nfs/dbraw/zinc/42/88/73/589428873.db2.gz SMBBJOYZSRJOQM-UHFFFAOYSA-N 1 2 235.287 2.226 20 0 BEADLO c1nc(CNc2cccc[nH+]2)cn1C1CC1 ZINC000865422744 589434900 /nfs/dbraw/zinc/43/49/00/589434900.db2.gz VOHIXPMUVXKDIR-UHFFFAOYSA-N 1 2 214.272 2.225 20 0 BEADLO c1[nH+]c(CNc2cccnc2)cn1C1CC1 ZINC000865487324 589440349 /nfs/dbraw/zinc/44/03/49/589440349.db2.gz OHVUGVLJTMZRSN-UHFFFAOYSA-N 1 2 214.272 2.225 20 0 BEADLO CC(C)(NCc1cn(C2CC2)c[nH+]1)C(F)F ZINC000865548336 589445349 /nfs/dbraw/zinc/44/53/49/589445349.db2.gz DPGPQFVKWGGQBU-UHFFFAOYSA-N 1 2 229.274 2.351 20 0 BEADLO CC(C)Cc1cc(NC[C@@H](C)CCO)nc[nH+]1 ZINC000865571795 589447817 /nfs/dbraw/zinc/44/78/17/589447817.db2.gz WDARYLFSTHIXHZ-NSHDSACASA-N 1 2 237.347 2.106 20 0 BEADLO CCCN(CC)c1nc(N)[nH+]c(C2CCCC2)n1 ZINC000865579852 589448497 /nfs/dbraw/zinc/44/84/97/589448497.db2.gz HLVPHBYREPSYCG-UHFFFAOYSA-N 1 2 249.362 2.348 20 0 BEADLO CCCN(CC)c1nc(N)nc(C2CCCC2)[nH+]1 ZINC000865579852 589448499 /nfs/dbraw/zinc/44/84/99/589448499.db2.gz HLVPHBYREPSYCG-UHFFFAOYSA-N 1 2 249.362 2.348 20 0 BEADLO CCc1nc(CNCc2cn(C3CC3)c[nH+]2)co1 ZINC000865591098 589449584 /nfs/dbraw/zinc/44/95/84/589449584.db2.gz CHEZDKKPJWXHKF-UHFFFAOYSA-N 1 2 246.314 2.058 20 0 BEADLO CCC(F)(F)CNCc1cn(C2CC2)c[nH+]1 ZINC000865641505 589453789 /nfs/dbraw/zinc/45/37/89/589453789.db2.gz XHPHNJFZRODEPZ-UHFFFAOYSA-N 1 2 229.274 2.353 20 0 BEADLO C[C@H](O)c1ccc(N2CC[C@H](C)[C@H](F)C2)[nH+]c1 ZINC000865662525 589454895 /nfs/dbraw/zinc/45/48/95/589454895.db2.gz APLNGWVYGWGHOX-JBLDHEPKSA-N 1 2 238.306 2.319 20 0 BEADLO CC(C)Cc1cc(NCCC[C@@H](C)O)nc[nH+]1 ZINC000865737006 589459293 /nfs/dbraw/zinc/45/92/93/589459293.db2.gz YNFNMYKXVADQNK-LLVKDONJSA-N 1 2 237.347 2.248 20 0 BEADLO CCCNc1cc(N2CCC=C(C)C2)nc[nH+]1 ZINC000865755001 589460905 /nfs/dbraw/zinc/46/09/05/589460905.db2.gz ULAHHYKWCGTHKW-UHFFFAOYSA-N 1 2 232.331 2.455 20 0 BEADLO CCCNc1cc(N2CCC=C(C)C2)[nH+]cn1 ZINC000865755001 589460906 /nfs/dbraw/zinc/46/09/06/589460906.db2.gz ULAHHYKWCGTHKW-UHFFFAOYSA-N 1 2 232.331 2.455 20 0 BEADLO COCC[C@H](C)CNc1ccc([C@@H](C)O)c[nH+]1 ZINC000865874331 589466794 /nfs/dbraw/zinc/46/67/94/589466794.db2.gz BPOJYQXYBIPDRD-WDEREUQCSA-N 1 2 238.331 2.219 20 0 BEADLO CC(C)Cc1cc(N[C@H]2C[C@@](C)(O)C2)nc[nH+]1 ZINC000865882184 589467202 /nfs/dbraw/zinc/46/72/02/589467202.db2.gz NKJUNFVZSGUSGN-BJHJDKERSA-N 1 2 235.331 2.000 20 0 BEADLO CCCNc1cc(N2CC3CC2(C)C3)nc[nH+]1 ZINC000865960020 589470507 /nfs/dbraw/zinc/47/05/07/589470507.db2.gz YNSVJNOTOOPYPL-UHFFFAOYSA-N 1 2 232.331 2.287 20 0 BEADLO CCCNc1cc(N2CC3CC2(C)C3)[nH+]cn1 ZINC000865960020 589470508 /nfs/dbraw/zinc/47/05/08/589470508.db2.gz YNSVJNOTOOPYPL-UHFFFAOYSA-N 1 2 232.331 2.287 20 0 BEADLO C/C=C\CNc1nc(N)[nH+]c(C2CCCC2)n1 ZINC000865972511 589470783 /nfs/dbraw/zinc/47/07/83/589470783.db2.gz WURXDJUDJFHGAU-IHWYPQMZSA-N 1 2 233.319 2.099 20 0 BEADLO C/C=C\CNc1nc(N)nc(C2CCCC2)[nH+]1 ZINC000865972511 589470784 /nfs/dbraw/zinc/47/07/84/589470784.db2.gz WURXDJUDJFHGAU-IHWYPQMZSA-N 1 2 233.319 2.099 20 0 BEADLO CO[C@H]1CC[C@@H](C)N(c2cccc[nH+]2)C1 ZINC000866070645 589474836 /nfs/dbraw/zinc/47/48/36/589474836.db2.gz ZZWBOAYONXMERK-MNOVXSKESA-N 1 2 206.289 2.085 20 0 BEADLO COc1ccc[nH+]c1N1C[C@@H]2CC=CC[C@@H]2C1 ZINC000866162097 589478339 /nfs/dbraw/zinc/47/83/39/589478339.db2.gz JHZIENOEODRKKS-TXEJJXNPSA-N 1 2 230.311 2.493 20 0 BEADLO Cc1nc(NC[C@@H]2C[C@H]2C2CCOCC2)cc[nH+]1 ZINC000866182610 589479115 /nfs/dbraw/zinc/47/91/15/589479115.db2.gz WOMYIZSFKRRJNS-STQMWFEESA-N 1 2 247.342 2.260 20 0 BEADLO CC1(C)C[C@H](O)CN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000866226405 589481710 /nfs/dbraw/zinc/48/17/10/589481710.db2.gz NJOOQQLANNQIDQ-JTQLQIEISA-N 1 2 245.326 2.160 20 0 BEADLO CC1(C)C[C@@H](O)CN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000866226407 589481719 /nfs/dbraw/zinc/48/17/19/589481719.db2.gz NJOOQQLANNQIDQ-SNVBAGLBSA-N 1 2 245.326 2.160 20 0 BEADLO FCC[NH2+][C@H]1c2ccccc2OC[C@@H]1F ZINC000866351597 589486788 /nfs/dbraw/zinc/48/67/88/589486788.db2.gz BYFHCPUALCYNKB-ONGXEEELSA-N 1 2 213.227 2.017 20 0 BEADLO FC(F)(F)[C@@H]1C[C@H]1[NH2+][C@H]1CCCc2[nH]ncc21 ZINC000866498861 589497804 /nfs/dbraw/zinc/49/78/04/589497804.db2.gz BRNFAGXPZOHMRX-KHQFGBGNSA-N 1 2 245.248 2.328 20 0 BEADLO CCC=C(F)C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000867459798 589521113 /nfs/dbraw/zinc/52/11/13/589521113.db2.gz ZICJHNFQHZZEOL-WHXYTISESA-N 1 2 225.267 2.240 20 0 BEADLO CC/C=C(/F)C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000867459798 589521115 /nfs/dbraw/zinc/52/11/15/589521115.db2.gz ZICJHNFQHZZEOL-WHXYTISESA-N 1 2 225.267 2.240 20 0 BEADLO CCCOC(=O)NC[C@H]1c2ccccc2C[N@H+]1C ZINC000867793052 589534531 /nfs/dbraw/zinc/53/45/31/589534531.db2.gz DESMEDWXSZGKNE-ZDUSSCGKSA-N 1 2 248.326 2.309 20 0 BEADLO CCCOC(=O)NC[C@H]1c2ccccc2C[N@@H+]1C ZINC000867793052 589534532 /nfs/dbraw/zinc/53/45/32/589534532.db2.gz DESMEDWXSZGKNE-ZDUSSCGKSA-N 1 2 248.326 2.309 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)[C@@H]2C[C@@H]2C)c1 ZINC000122285334 589576708 /nfs/dbraw/zinc/57/67/08/589576708.db2.gz LVCSUHXHBJQPRM-QPUJVOFHSA-N 1 2 235.283 2.098 20 0 BEADLO CC(C)(C)[C@@H]1C[C@H]1C(=O)OCc1cc[nH+]c(N)c1 ZINC000869649357 589619244 /nfs/dbraw/zinc/61/92/44/589619244.db2.gz XVESEUHGJSTWBR-GHMZBOCLSA-N 1 2 248.326 2.389 20 0 BEADLO C[C@@H](CC(=O)OC[C@@H]1C[C@H]1C1CC1)n1cc[nH+]c1 ZINC000870671530 589682241 /nfs/dbraw/zinc/68/22/41/589682241.db2.gz PYZHKLYCTPMFKH-DRZSPHRISA-N 1 2 248.326 2.424 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OC[C@H]1CCO[C@@H]1C ZINC000871719480 589798191 /nfs/dbraw/zinc/79/81/91/589798191.db2.gz WXNUZRAPMPRWJA-VXGBXAGGSA-N 1 2 248.326 2.267 20 0 BEADLO CO[C@H]1C[C@@H](CO[NH+]=C(N)Cc2ccccc2)C1 ZINC000871727784 589799735 /nfs/dbraw/zinc/79/97/35/589799735.db2.gz LELREPXRISLQFW-BETUJISGSA-N 1 2 248.326 2.153 20 0 BEADLO C[C@@H]1OCC[C@@H]1CO[NH+]=C(N)Cc1ccccc1 ZINC000871727673 589799949 /nfs/dbraw/zinc/79/99/49/589799949.db2.gz JOKCVAIHYNEYQW-WCQYABFASA-N 1 2 248.326 2.153 20 0 BEADLO C[C@@H]1OCC[C@H]1CO[NH+]=C(N)Cc1ccccc1 ZINC000871727671 589800034 /nfs/dbraw/zinc/80/00/34/589800034.db2.gz JOKCVAIHYNEYQW-AAEUAGOBSA-N 1 2 248.326 2.153 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OCCCSC(C)(C)C ZINC000871735525 589801022 /nfs/dbraw/zinc/80/10/22/589801022.db2.gz SPXSTNWJNOHTEO-SECBINFHSA-N 1 2 248.392 2.442 20 0 BEADLO C[C@@H](CO[NH+]=C(N)[C@H]1CCCO1)C(C)(C)C ZINC000871748649 589804266 /nfs/dbraw/zinc/80/42/66/589804266.db2.gz MJXATRXVUCNAPO-VHSXEESVSA-N 1 2 228.336 2.346 20 0 BEADLO CC1(CO[NH+]=C(N)COC2CCC2)CCC1 ZINC000871778869 589815314 /nfs/dbraw/zinc/81/53/14/589815314.db2.gz WIRMPWMBOZYCJF-UHFFFAOYSA-N 1 2 226.320 2.244 20 0 BEADLO CS[C@H]1C[C@H]([NH2+][C@@H](C)C(=O)OC(C)(C)C)C1 ZINC000871916465 589832374 /nfs/dbraw/zinc/83/23/74/589832374.db2.gz MEYWHGPFOYUNEM-GUBZILKMSA-N 1 2 245.388 2.200 20 0 BEADLO Cc1nonc1C[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000871937092 589834819 /nfs/dbraw/zinc/83/48/19/589834819.db2.gz AQDZFMYORPHXRA-GFCCVEGCSA-N 1 2 247.273 2.294 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[NH2+][C@H]1CC12CCC2 ZINC000871937995 589835209 /nfs/dbraw/zinc/83/52/09/589835209.db2.gz KFRTWZREQONIAN-RYUDHWBXSA-N 1 2 239.359 2.496 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2cc(O)ccc2F)[nH]n1 ZINC000872037305 589857988 /nfs/dbraw/zinc/85/79/88/589857988.db2.gz DHOQLJHUKVHFRG-VIFPVBQESA-N 1 2 249.289 2.414 20 0 BEADLO C[C@H]([NH2+]Cc1cc[nH]n1)c1cc(O)ccc1F ZINC000872033910 589858377 /nfs/dbraw/zinc/85/83/77/589858377.db2.gz KBJVQOIVAHMJFA-QMMMGPOBSA-N 1 2 235.262 2.105 20 0 BEADLO Cc1nonc1C[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC000872135721 589878935 /nfs/dbraw/zinc/87/89/35/589878935.db2.gz IHNPKGFDXLIWAL-GFCCVEGCSA-N 1 2 247.273 2.294 20 0 BEADLO FC(F)C(F)(F)C[NH2+][C@]12CCC[C@H]1OCC2 ZINC000872313518 589909325 /nfs/dbraw/zinc/90/93/25/589909325.db2.gz VVOKYXASMXBHQJ-APPZFPTMSA-N 1 2 241.228 2.188 20 0 BEADLO Cc1ccc(CCNc2ncnc(F)c2C)c[nH+]1 ZINC000872449761 589940520 /nfs/dbraw/zinc/94/05/20/589940520.db2.gz CBLBQHOJYREOPD-UHFFFAOYSA-N 1 2 246.289 2.282 20 0 BEADLO CC(=O)C1CCN(c2cc[nH+]c(C(C)C)n2)CC1 ZINC000872668738 589960095 /nfs/dbraw/zinc/96/00/95/589960095.db2.gz YNSZFXCOEFQDEZ-UHFFFAOYSA-N 1 2 247.342 2.405 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1C[C@@H]2CCC[C@@H]2O1 ZINC000872695656 589962236 /nfs/dbraw/zinc/96/22/36/589962236.db2.gz IQYNWSHDWMUVAU-SRVKXCTJSA-N 1 2 248.326 2.460 20 0 BEADLO COC(=O)CC[C@@H]1CCCN(c2cccc[nH+]2)C1 ZINC000872750192 589966631 /nfs/dbraw/zinc/96/66/31/589966631.db2.gz OVLKBRLIFODOSX-LBPRGKRZSA-N 1 2 248.326 2.251 20 0 BEADLO Clc1cc2c(nc[nH+]c2N[C@@H]2CC23CCC3)[nH]1 ZINC000872775689 589968052 /nfs/dbraw/zinc/96/80/52/589968052.db2.gz XDEJTPYYDCEMLS-MRVPVSSYSA-N 1 2 248.717 2.388 20 0 BEADLO CC(C)c1nc(N2CC[C@@H](C(C)(C)O)C2)cc[nH+]1 ZINC000872783238 589969687 /nfs/dbraw/zinc/96/96/87/589969687.db2.gz QMFUXUOBVDKFQT-LLVKDONJSA-N 1 2 249.358 2.197 20 0 BEADLO COCC[C@H](C)[NH2+]c1ccc(OC)c(CO)c1 ZINC000124308174 589974183 /nfs/dbraw/zinc/97/41/83/589974183.db2.gz GYHBGIVZAYOGRS-JTQLQIEISA-N 1 2 239.315 2.024 20 0 BEADLO CCOc1ccc([NH2+][C@H]2CCNC(=O)CC2)cc1 ZINC000873009662 589979248 /nfs/dbraw/zinc/97/92/48/589979248.db2.gz QPWGJJUGEPIMPG-GFCCVEGCSA-N 1 2 248.326 2.166 20 0 BEADLO C[C@@H](O)c1ccc(C[NH2+]Cc2ccon2)cc1 ZINC000873023059 589980301 /nfs/dbraw/zinc/98/03/01/589980301.db2.gz ZPDHLRJKGGYWTB-SNVBAGLBSA-N 1 2 232.283 2.018 20 0 BEADLO CC[C@H]([NH2+]Cc1ccn[nH]1)[C@H](O)c1ccccc1 ZINC000873195160 589991430 /nfs/dbraw/zinc/99/14/30/589991430.db2.gz YKBHYCVOQQFYLL-UONOGXRCSA-N 1 2 245.326 2.012 20 0 BEADLO c1cc(C[NH2+]C2CC(Nc3ccccc3)C2)[nH]n1 ZINC000873190858 589991604 /nfs/dbraw/zinc/99/16/04/589991604.db2.gz LPYKTKYZCIMOSE-UHFFFAOYSA-N 1 2 242.326 2.142 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)C1CCC=CCC1 ZINC000873430614 590043525 /nfs/dbraw/zinc/04/35/25/590043525.db2.gz TVKRENQZLIEXPQ-UHFFFAOYSA-N 1 2 248.326 2.252 20 0 BEADLO CCC[C@@H](CC)C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000874049591 590087895 /nfs/dbraw/zinc/08/78/95/590087895.db2.gz IRJXQQYFAQTVEE-VXGBXAGGSA-N 1 2 237.347 2.214 20 0 BEADLO C[N@H+](Cn1ncsc1=S)[C@H]1CCSC1 ZINC000125041167 590115755 /nfs/dbraw/zinc/11/57/55/590115755.db2.gz DCCLYIZWSJULQT-ZETCQYMHSA-N 1 2 247.414 2.069 20 0 BEADLO C[N@@H+](Cn1ncsc1=S)[C@H]1CCSC1 ZINC000125041167 590115756 /nfs/dbraw/zinc/11/57/56/590115756.db2.gz DCCLYIZWSJULQT-ZETCQYMHSA-N 1 2 247.414 2.069 20 0 BEADLO CCC1(CC)CCCN1C(=O)Cn1cc[nH+]c1 ZINC000874628948 590119736 /nfs/dbraw/zinc/11/97/36/590119736.db2.gz OYGALPVOBGRRRA-UHFFFAOYSA-N 1 2 235.331 2.064 20 0 BEADLO O=C(N[C@H]1CC12CCC2)c1ccc2[nH+]ccn2c1 ZINC000874787385 590136108 /nfs/dbraw/zinc/13/61/08/590136108.db2.gz WDFXPKKQYYBBJD-NSHDSACASA-N 1 2 241.294 2.007 20 0 BEADLO CSC[C@@H](C)[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000125237181 590157424 /nfs/dbraw/zinc/15/74/24/590157424.db2.gz YUFNAROYHHAZEY-RKDXNWHRSA-N 1 2 233.377 2.058 20 0 BEADLO CCCCSCC(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000125381188 590163018 /nfs/dbraw/zinc/16/30/18/590163018.db2.gz QIVHYPXHCWDOQT-SECBINFHSA-N 1 2 241.360 2.120 20 0 BEADLO Fc1cccc2cc(C[NH+]3CCOCC3)cnc12 ZINC000876510233 590205630 /nfs/dbraw/zinc/20/56/30/590205630.db2.gz RGYWGBMHHGKAQW-UHFFFAOYSA-N 1 2 246.285 2.206 20 0 BEADLO CCCn1cc(C[N@H+](CC)Cc2ccoc2)nn1 ZINC000876677335 590229746 /nfs/dbraw/zinc/22/97/46/590229746.db2.gz MFYNTCHIJVDOQM-UHFFFAOYSA-N 1 2 248.330 2.303 20 0 BEADLO CCCn1cc(C[N@@H+](CC)Cc2ccoc2)nn1 ZINC000876677335 590229747 /nfs/dbraw/zinc/22/97/47/590229747.db2.gz MFYNTCHIJVDOQM-UHFFFAOYSA-N 1 2 248.330 2.303 20 0 BEADLO CC(C)Cc1noc([C@@H]([NH3+])c2ccccc2)n1 ZINC000021808541 590234267 /nfs/dbraw/zinc/23/42/67/590234267.db2.gz ZUYGPZKHWAJIPX-LBPRGKRZSA-N 1 2 231.299 2.316 20 0 BEADLO CC1(O)CC[NH+](Cc2nc(Cl)cs2)CC1 ZINC000876746332 590237435 /nfs/dbraw/zinc/23/74/35/590237435.db2.gz KBBVDVGKRFOQDE-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO C[C@H]1COCC[N@H+](Cc2nc(Cl)cs2)C1 ZINC000876752569 590238111 /nfs/dbraw/zinc/23/81/11/590238111.db2.gz TWHGFPIDJPTWKM-MRVPVSSYSA-N 1 2 246.763 2.265 20 0 BEADLO C[C@H]1COCC[N@@H+](Cc2nc(Cl)cs2)C1 ZINC000876752569 590238112 /nfs/dbraw/zinc/23/81/12/590238112.db2.gz TWHGFPIDJPTWKM-MRVPVSSYSA-N 1 2 246.763 2.265 20 0 BEADLO Cc1cc(C[NH2+]Cc2nc(Cl)cs2)[nH]n1 ZINC000877058264 590275527 /nfs/dbraw/zinc/27/55/27/590275527.db2.gz WVXUDPIIQJKZFK-UHFFFAOYSA-N 1 2 242.735 2.118 20 0 BEADLO CSC(C)(C)CC[N@H+](CCO)CC(F)F ZINC000877491968 590340112 /nfs/dbraw/zinc/34/01/12/590340112.db2.gz ZAZIWCVUCYUDNO-UHFFFAOYSA-N 1 2 241.347 2.078 20 0 BEADLO CSC(C)(C)CC[N@@H+](CCO)CC(F)F ZINC000877491968 590340113 /nfs/dbraw/zinc/34/01/13/590340113.db2.gz ZAZIWCVUCYUDNO-UHFFFAOYSA-N 1 2 241.347 2.078 20 0 BEADLO Cc1c(Cl)cccc1C[NH+]1CC(C)(O)C1 ZINC000877581188 590365235 /nfs/dbraw/zinc/36/52/35/590365235.db2.gz PTPKCQWLOFVIOM-UHFFFAOYSA-N 1 2 225.719 2.215 20 0 BEADLO CSC(C)(C)CC[N@H+](C)Cc1noc(C)n1 ZINC000877641668 590383283 /nfs/dbraw/zinc/38/32/83/590383283.db2.gz DPJRIHYWXUVZLQ-UHFFFAOYSA-N 1 2 243.376 2.342 20 0 BEADLO CSC(C)(C)CC[N@@H+](C)Cc1noc(C)n1 ZINC000877641668 590383287 /nfs/dbraw/zinc/38/32/87/590383287.db2.gz DPJRIHYWXUVZLQ-UHFFFAOYSA-N 1 2 243.376 2.342 20 0 BEADLO CN(C)c1c[nH+]cc(NC[C@H]2CCC=CO2)c1 ZINC000877668037 590389145 /nfs/dbraw/zinc/38/91/45/590389145.db2.gz MOWLKIUHABMMME-CYBMUJFWSA-N 1 2 233.315 2.252 20 0 BEADLO CCCOC(=O)[C@H](C)[N@@H+]1CCc2ccccc2C1 ZINC000126650553 590391784 /nfs/dbraw/zinc/39/17/84/590391784.db2.gz ROADFEINENVOIV-LBPRGKRZSA-N 1 2 247.338 2.386 20 0 BEADLO CCCOC(=O)[C@H](C)[N@H+]1CCc2ccccc2C1 ZINC000126650553 590391787 /nfs/dbraw/zinc/39/17/87/590391787.db2.gz ROADFEINENVOIV-LBPRGKRZSA-N 1 2 247.338 2.386 20 0 BEADLO CC1(F)CC[NH+](Cc2ccc(Cl)nn2)CC1 ZINC000877700264 590393582 /nfs/dbraw/zinc/39/35/82/590393582.db2.gz KXWWCXOEQFFAMX-UHFFFAOYSA-N 1 2 243.713 2.454 20 0 BEADLO COc1cnc(F)c(C[NH+]2CC(C)(C)C2)c1 ZINC000877718176 590399472 /nfs/dbraw/zinc/39/94/72/590399472.db2.gz YTFOCWCCHSWXPD-UHFFFAOYSA-N 1 2 224.279 2.071 20 0 BEADLO C[C@@H]1CCC[C@@H](C2C[NH+](Cc3ncnn3C)C2)C1 ZINC000877763583 590420046 /nfs/dbraw/zinc/42/00/46/590420046.db2.gz CRJZNNZSFLBUSN-VXGBXAGGSA-N 1 2 248.374 2.073 20 0 BEADLO C[C@H]1CCC[C@H](C2C[NH+](Cc3ncnn3C)C2)C1 ZINC000877763582 590420175 /nfs/dbraw/zinc/42/01/75/590420175.db2.gz CRJZNNZSFLBUSN-RYUDHWBXSA-N 1 2 248.374 2.073 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CC[C@@](C)(C(F)(F)F)C2)n1 ZINC000877811929 590427047 /nfs/dbraw/zinc/42/70/47/590427047.db2.gz CKWCRFFWFBGTBH-SNVBAGLBSA-N 1 2 247.264 2.492 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CC[C@@](C)(C(F)(F)F)C2)n1 ZINC000877811929 590427048 /nfs/dbraw/zinc/42/70/48/590427048.db2.gz CKWCRFFWFBGTBH-SNVBAGLBSA-N 1 2 247.264 2.492 20 0 BEADLO CCc1[nH+]c(C)ccc1OCCc1nnc(C)o1 ZINC000877882677 590438265 /nfs/dbraw/zinc/43/82/65/590438265.db2.gz UVPVAARKQHUAHX-UHFFFAOYSA-N 1 2 247.298 2.265 20 0 BEADLO Cc1ccc(C[N@H+]2CCCOCC2)nc1Cl ZINC000878014082 590471287 /nfs/dbraw/zinc/47/12/87/590471287.db2.gz HTQNIPQYPGOVHA-UHFFFAOYSA-N 1 2 240.734 2.266 20 0 BEADLO Cc1ccc(C[N@@H+]2CCCOCC2)nc1Cl ZINC000878014082 590471285 /nfs/dbraw/zinc/47/12/85/590471285.db2.gz HTQNIPQYPGOVHA-UHFFFAOYSA-N 1 2 240.734 2.266 20 0 BEADLO CCC[N@H+](CC[C@H](O)C(C)C)CC(F)F ZINC000878031739 590475660 /nfs/dbraw/zinc/47/56/60/590475660.db2.gz CKFQXWCWINKGJE-JTQLQIEISA-N 1 2 223.307 2.371 20 0 BEADLO CCC[N@@H+](CC[C@H](O)C(C)C)CC(F)F ZINC000878031739 590475663 /nfs/dbraw/zinc/47/56/63/590475663.db2.gz CKFQXWCWINKGJE-JTQLQIEISA-N 1 2 223.307 2.371 20 0 BEADLO CC(=O)C[N@@H+]1[C@H](C)CO[C@H](c2ccccc2)[C@@H]1C ZINC000878096093 590493005 /nfs/dbraw/zinc/49/30/05/590493005.db2.gz LGDVTIYKTRHRQO-ZLDLUXBVSA-N 1 2 247.338 2.426 20 0 BEADLO CC(=O)C[N@H+]1[C@H](C)CO[C@H](c2ccccc2)[C@@H]1C ZINC000878096093 590493006 /nfs/dbraw/zinc/49/30/06/590493006.db2.gz LGDVTIYKTRHRQO-ZLDLUXBVSA-N 1 2 247.338 2.426 20 0 BEADLO Cc1conc1C[N@H+]1CCOC[C@@H]1CC(C)C ZINC000878106241 590494710 /nfs/dbraw/zinc/49/47/10/590494710.db2.gz FUMKDQBUFVKFGK-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1conc1C[N@@H+]1CCOC[C@@H]1CC(C)C ZINC000878106241 590494713 /nfs/dbraw/zinc/49/47/13/590494713.db2.gz FUMKDQBUFVKFGK-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO C[N@H+](CCCSC(C)(C)C)Cc1nnc[nH]1 ZINC000878177637 590515944 /nfs/dbraw/zinc/51/59/44/590515944.db2.gz YCUUPLRXHCXDPK-UHFFFAOYSA-N 1 2 242.392 2.158 20 0 BEADLO C[N@@H+](CCCSC(C)(C)C)Cc1nnc[nH]1 ZINC000878177637 590515946 /nfs/dbraw/zinc/51/59/46/590515946.db2.gz YCUUPLRXHCXDPK-UHFFFAOYSA-N 1 2 242.392 2.158 20 0 BEADLO C[C@H](C[N@H+](C)Cc1nnc[nH]1)CC(C)(C)C ZINC000878175787 590516065 /nfs/dbraw/zinc/51/60/65/590516065.db2.gz BVQRMGUZZBSVMX-JTQLQIEISA-N 1 2 224.352 2.309 20 0 BEADLO C[C@H](C[N@@H+](C)Cc1nnc[nH]1)CC(C)(C)C ZINC000878175787 590516067 /nfs/dbraw/zinc/51/60/67/590516067.db2.gz BVQRMGUZZBSVMX-JTQLQIEISA-N 1 2 224.352 2.309 20 0 BEADLO C[N@@H+](CC[C@@H]1CCCC1(F)F)Cc1nnc[nH]1 ZINC000878175890 590516467 /nfs/dbraw/zinc/51/64/67/590516467.db2.gz FJRXDJDDAFEICY-VIFPVBQESA-N 1 2 244.289 2.062 20 0 BEADLO C[N@H+](CC[C@@H]1CCCC1(F)F)Cc1nnc[nH]1 ZINC000878175890 590516464 /nfs/dbraw/zinc/51/64/64/590516464.db2.gz FJRXDJDDAFEICY-VIFPVBQESA-N 1 2 244.289 2.062 20 0 BEADLO CC(=O)C[NH+]1CCN(c2ccc(C)c(C)c2)CC1 ZINC000878305691 590538701 /nfs/dbraw/zinc/53/87/01/590538701.db2.gz FDIJOLQCIRAHDH-UHFFFAOYSA-N 1 2 246.354 2.014 20 0 BEADLO C[N@@H+](Cc1ncc[nH]1)C[C@@H]1CCC(C)(C)CO1 ZINC000878315399 590541726 /nfs/dbraw/zinc/54/17/26/590541726.db2.gz NJDHNGZZTIGDLE-NSHDSACASA-N 1 2 237.347 2.047 20 0 BEADLO C[N@H+](Cc1ncc[nH]1)C[C@@H]1CCC(C)(C)CO1 ZINC000878315399 590541727 /nfs/dbraw/zinc/54/17/27/590541727.db2.gz NJDHNGZZTIGDLE-NSHDSACASA-N 1 2 237.347 2.047 20 0 BEADLO CCOCC[N@H+](C)Cc1scnc1Cl ZINC000878340469 590550393 /nfs/dbraw/zinc/55/03/93/590550393.db2.gz LMUQJCUTDUHSJC-UHFFFAOYSA-N 1 2 234.752 2.265 20 0 BEADLO CCOCC[N@@H+](C)Cc1scnc1Cl ZINC000878340469 590550396 /nfs/dbraw/zinc/55/03/96/590550396.db2.gz LMUQJCUTDUHSJC-UHFFFAOYSA-N 1 2 234.752 2.265 20 0 BEADLO Cc1conc1C[N@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000878383828 590558061 /nfs/dbraw/zinc/55/80/61/590558061.db2.gz WKBAYTLEUKGBIO-WPRPVWTQSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1conc1C[N@@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000878383828 590558063 /nfs/dbraw/zinc/55/80/63/590558063.db2.gz WKBAYTLEUKGBIO-WPRPVWTQSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1conc1C[NH2+][C@H](CO)c1ccccc1C ZINC000878396529 590559511 /nfs/dbraw/zinc/55/95/11/590559511.db2.gz JGUZXQAMLAJCPM-CQSZACIVSA-N 1 2 246.310 2.115 20 0 BEADLO C=C/C=C\CC[N@@H+](C)Cc1nncn1C(C)C ZINC000878645414 590601222 /nfs/dbraw/zinc/60/12/22/590601222.db2.gz LLMNVILKGQEPKE-SREVYHEPSA-N 1 2 234.347 2.423 20 0 BEADLO C=C/C=C\CC[N@H+](C)Cc1nncn1C(C)C ZINC000878645414 590601224 /nfs/dbraw/zinc/60/12/24/590601224.db2.gz LLMNVILKGQEPKE-SREVYHEPSA-N 1 2 234.347 2.423 20 0 BEADLO C[C@@H](O)C[N@H+](CCCC1CC1)CC(F)F ZINC000878684306 590609370 /nfs/dbraw/zinc/60/93/70/590609370.db2.gz RFXVMQAUMBSFNI-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO C[C@@H](O)C[N@@H+](CCCC1CC1)CC(F)F ZINC000878684306 590609372 /nfs/dbraw/zinc/60/93/72/590609372.db2.gz RFXVMQAUMBSFNI-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO Cc1cc(C[N@@H+]2CCC=C(Cl)C2)nc(C)n1 ZINC000878790017 590622401 /nfs/dbraw/zinc/62/24/01/590622401.db2.gz AQUNGPHCWPRDHP-UHFFFAOYSA-N 1 2 237.734 2.422 20 0 BEADLO Cc1cc(C[N@H+]2CCC=C(Cl)C2)nc(C)n1 ZINC000878790017 590622402 /nfs/dbraw/zinc/62/24/02/590622402.db2.gz AQUNGPHCWPRDHP-UHFFFAOYSA-N 1 2 237.734 2.422 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC=C(Cl)C2)cn1 ZINC000878794000 590624255 /nfs/dbraw/zinc/62/42/55/590624255.db2.gz PRBNZRTZHHJFQW-UHFFFAOYSA-N 1 2 223.707 2.113 20 0 BEADLO Cc1cnc(C[N@H+]2CCC=C(Cl)C2)cn1 ZINC000878794000 590624256 /nfs/dbraw/zinc/62/42/56/590624256.db2.gz PRBNZRTZHHJFQW-UHFFFAOYSA-N 1 2 223.707 2.113 20 0 BEADLO CC[C@@H](C)NC(=O)[C@@H](C)[N@@H+]1CCC=C(Cl)C1 ZINC000878793112 590624531 /nfs/dbraw/zinc/62/45/31/590624531.db2.gz FPOMVXISGQLTSM-NXEZZACHSA-N 1 2 244.766 2.118 20 0 BEADLO CC[C@@H](C)NC(=O)[C@@H](C)[N@H+]1CCC=C(Cl)C1 ZINC000878793112 590624533 /nfs/dbraw/zinc/62/45/33/590624533.db2.gz FPOMVXISGQLTSM-NXEZZACHSA-N 1 2 244.766 2.118 20 0 BEADLO CC[C@@H]1CCC[C@]1(C)C(=O)NCCc1[nH]cc[nH+]1 ZINC000878798793 590625159 /nfs/dbraw/zinc/62/51/59/590625159.db2.gz XBBOORPJNYCFJQ-RISCZKNCSA-N 1 2 249.358 2.285 20 0 BEADLO CC(C)(CC(=O)NCc1[nH]cc[nH+]1)CC(F)F ZINC000878816136 590626835 /nfs/dbraw/zinc/62/68/35/590626835.db2.gz MYHARIGZHCYDDA-UHFFFAOYSA-N 1 2 245.273 2.097 20 0 BEADLO CC[C@H]1CCC[C@@]1(C)C(=O)NCc1[nH]cc[nH+]1 ZINC000878816932 590627211 /nfs/dbraw/zinc/62/72/11/590627211.db2.gz XYBYDEKMAWAMDD-GXFFZTMASA-N 1 2 235.331 2.242 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)Cc1scnc1Cl ZINC000878885110 590639974 /nfs/dbraw/zinc/63/99/74/590639974.db2.gz VZKMSCSFYSLRPS-UHFFFAOYSA-N 1 2 242.735 2.152 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)Cc1scnc1Cl ZINC000878885110 590639979 /nfs/dbraw/zinc/63/99/79/590639979.db2.gz VZKMSCSFYSLRPS-UHFFFAOYSA-N 1 2 242.735 2.152 20 0 BEADLO Cc1conc1C[NH+]1CCC(c2ccon2)CC1 ZINC000878994280 590672714 /nfs/dbraw/zinc/67/27/14/590672714.db2.gz PYZJNPNWSRTRNC-UHFFFAOYSA-N 1 2 247.298 2.351 20 0 BEADLO CC12CC(C1)C[N@@H+]2Cc1nccn1CC(F)F ZINC000879009235 590676313 /nfs/dbraw/zinc/67/63/13/590676313.db2.gz RXDBTDVYKGHCGK-UHFFFAOYSA-N 1 2 241.285 2.133 20 0 BEADLO CC12CC(C1)C[N@H+]2Cc1nccn1CC(F)F ZINC000879009235 590676315 /nfs/dbraw/zinc/67/63/15/590676315.db2.gz RXDBTDVYKGHCGK-UHFFFAOYSA-N 1 2 241.285 2.133 20 0 BEADLO Cc1cc(NC(=O)NC[C@@H]2C=CCC2)c(C)c[nH+]1 ZINC000879075017 590693469 /nfs/dbraw/zinc/69/34/69/590693469.db2.gz DHOKISWTZZEXFK-GFCCVEGCSA-N 1 2 245.326 2.208 20 0 BEADLO Cc1n[nH]cc1C[N@@H+](C)CC=C(Cl)Cl ZINC000879188205 590710726 /nfs/dbraw/zinc/71/07/26/590710726.db2.gz HSKPMEMSSRIROQ-UHFFFAOYSA-N 1 2 234.130 2.469 20 0 BEADLO Cn1nc(C[NH+]2CCC(C)(F)CC2)cc1Cl ZINC000879383481 590758378 /nfs/dbraw/zinc/75/83/78/590758378.db2.gz NEGLILHSDMJHGE-UHFFFAOYSA-N 1 2 245.729 2.398 20 0 BEADLO CC(C)[N@@H+]1CCO[C@@](C)(C(F)(F)F)C1 ZINC000879506323 590782487 /nfs/dbraw/zinc/78/24/87/590782487.db2.gz MBULMQBKGITONO-MRVPVSSYSA-N 1 2 211.227 2.048 20 0 BEADLO CC(C)[N@H+]1CCO[C@@](C)(C(F)(F)F)C1 ZINC000879506323 590782492 /nfs/dbraw/zinc/78/24/92/590782492.db2.gz MBULMQBKGITONO-MRVPVSSYSA-N 1 2 211.227 2.048 20 0 BEADLO CO[C@@H]1CC[C@@H]([N@@H+]2OC3CCC2CC3)C1 ZINC000879799140 590877298 /nfs/dbraw/zinc/87/72/98/590877298.db2.gz GLYAKONWQAHMEA-RUJICJSRSA-N 1 2 211.305 2.112 20 0 BEADLO CO[C@@H]1CC[C@@H]([N@H+]2OC3CCC2CC3)C1 ZINC000879799140 590877303 /nfs/dbraw/zinc/87/73/03/590877303.db2.gz GLYAKONWQAHMEA-RUJICJSRSA-N 1 2 211.305 2.112 20 0 BEADLO Cc1nonc1C[N@@H+]1CC[C@](C)(C(F)(F)F)C1 ZINC000880002433 590907430 /nfs/dbraw/zinc/90/74/30/590907430.db2.gz KFOAXKRQAKDSHT-VIFPVBQESA-N 1 2 249.236 2.152 20 0 BEADLO Cc1nonc1C[N@H+]1CC[C@](C)(C(F)(F)F)C1 ZINC000880002433 590907431 /nfs/dbraw/zinc/90/74/31/590907431.db2.gz KFOAXKRQAKDSHT-VIFPVBQESA-N 1 2 249.236 2.152 20 0 BEADLO CSC(C)(C)C[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000128180312 590918469 /nfs/dbraw/zinc/91/84/69/590918469.db2.gz CNRDSAPFWKVAKX-SECBINFHSA-N 1 2 247.404 2.448 20 0 BEADLO C[C@@H](c1nc(C2CC2)no1)[NH+]1CCC(F)CC1 ZINC000880243289 590976967 /nfs/dbraw/zinc/97/69/67/590976967.db2.gz WHSMNRRCJPIPAV-QMMMGPOBSA-N 1 2 239.294 2.442 20 0 BEADLO CC(C)(C)c1noc(C[N@@H+]2CC[C@H](CF)C2)n1 ZINC000880290903 590986267 /nfs/dbraw/zinc/98/62/67/590986267.db2.gz GMQBHPKIKUIEBB-SECBINFHSA-N 1 2 241.310 2.159 20 0 BEADLO CC(C)(C)c1noc(C[N@H+]2CC[C@H](CF)C2)n1 ZINC000880290903 590986270 /nfs/dbraw/zinc/98/62/70/590986270.db2.gz GMQBHPKIKUIEBB-SECBINFHSA-N 1 2 241.310 2.159 20 0 BEADLO Cl/C=C/C[NH2+]C1(c2ncccn2)CCC1 ZINC000880364931 591010448 /nfs/dbraw/zinc/01/04/48/591010448.db2.gz XNHLVABTEWNUTF-QHHAFSJGSA-N 1 2 223.707 2.198 20 0 BEADLO Fc1cc2c(cc1F)CN(Cc1[nH]cc[nH+]1)CC2 ZINC000880447253 591047095 /nfs/dbraw/zinc/04/70/95/591047095.db2.gz ZQJVAUHGGTXMDD-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO OC[C@@H]1C=CC[N@@H+]1Cc1ccc(F)cc1Cl ZINC000880484909 591059283 /nfs/dbraw/zinc/05/92/83/591059283.db2.gz VREIFXGEGJJWBQ-NSHDSACASA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@@H]1C=CC[N@H+]1Cc1ccc(F)cc1Cl ZINC000880484909 591059285 /nfs/dbraw/zinc/05/92/85/591059285.db2.gz VREIFXGEGJJWBQ-NSHDSACASA-N 1 2 241.693 2.212 20 0 BEADLO CCC[C@H](C)CCNC(=O)CCc1c[nH+]c[nH]1 ZINC000881532557 591231675 /nfs/dbraw/zinc/23/16/75/591231675.db2.gz SDHFCRDIEULCLE-NSHDSACASA-N 1 2 237.347 2.285 20 0 BEADLO CCC[C@H](C)CCNC(=O)CCc1c[nH]c[nH+]1 ZINC000881532557 591231677 /nfs/dbraw/zinc/23/16/77/591231677.db2.gz SDHFCRDIEULCLE-NSHDSACASA-N 1 2 237.347 2.285 20 0 BEADLO OCCCNc1cc2ccc(F)cc2c[nH+]1 ZINC000881735925 591267974 /nfs/dbraw/zinc/26/79/74/591267974.db2.gz TXWMJTGLZHISRI-UHFFFAOYSA-N 1 2 220.247 2.168 20 0 BEADLO Cc1ncnc(NC[C@H](C)Cn2cc[nH+]c2)c1C ZINC000881819567 591273373 /nfs/dbraw/zinc/27/33/73/591273373.db2.gz ZCVBBSRSCZSYTH-JTQLQIEISA-N 1 2 245.330 2.038 20 0 BEADLO Fc1c[nH+]ccc1N1CCC(n2cccn2)CC1 ZINC000881859274 591274944 /nfs/dbraw/zinc/27/49/44/591274944.db2.gz RAIUBTVJTKGWOE-UHFFFAOYSA-N 1 2 246.289 2.259 20 0 BEADLO CCc1cc(CNc2nc[nH+]c(C)c2C)on1 ZINC000882007909 591287447 /nfs/dbraw/zinc/28/74/47/591287447.db2.gz ABOALGVBMHBWDG-UHFFFAOYSA-N 1 2 232.287 2.256 20 0 BEADLO Cc1[nH+]cnc(NC[C@]2(C)CCCC[C@@H]2O)c1C ZINC000882052322 591292474 /nfs/dbraw/zinc/29/24/74/591292474.db2.gz CDDYAVVXTDUALH-JSGCOSHPSA-N 1 2 249.358 2.447 20 0 BEADLO Cc1csc(SCc2cn(C)c[nH+]2)n1 ZINC000882053357 591292505 /nfs/dbraw/zinc/29/25/05/591292505.db2.gz VIOJIFFCHAXCSO-UHFFFAOYSA-N 1 2 225.342 2.477 20 0 BEADLO Cc1[nH+]cnc(NC[C@@]2(C)CCCC[C@@H]2O)c1C ZINC000882052321 591292646 /nfs/dbraw/zinc/29/26/46/591292646.db2.gz CDDYAVVXTDUALH-GXTWGEPZSA-N 1 2 249.358 2.447 20 0 BEADLO CO[C@H]1C[C@H](Nc2nc[nH+]c(C)c2C)C1(C)C ZINC000882071302 591293820 /nfs/dbraw/zinc/29/38/20/591293820.db2.gz BNWCZLHBXLAWMT-QWRGUYRKSA-N 1 2 235.331 2.319 20 0 BEADLO OCc1cc[nH+]c(NCCC2CCC2)c1 ZINC000882077741 591294739 /nfs/dbraw/zinc/29/47/39/591294739.db2.gz HKVDNWMPMVYLDT-UHFFFAOYSA-N 1 2 206.289 2.176 20 0 BEADLO Cc1[nH+]cnc(N[C@@H](C)C[C@H]2CCOC2)c1C ZINC000882088807 591295944 /nfs/dbraw/zinc/29/59/44/591295944.db2.gz MSGVRTGZSZOHQA-JOYOIKCWSA-N 1 2 235.331 2.320 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2CCC[C@H]3OCC[C@H]32)c1C ZINC000882092922 591296405 /nfs/dbraw/zinc/29/64/05/591296405.db2.gz NPLXRIJROZJYKR-YNEHKIRRSA-N 1 2 247.342 2.463 20 0 BEADLO Cc1[nH+]cnc(NCCc2ccncc2)c1C ZINC000882096111 591296926 /nfs/dbraw/zinc/29/69/26/591296926.db2.gz LBHRYHCMOAAAFT-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO Cc1[nH+]cnc(N(C)C[C@@H]2CCCC[C@H]2O)c1C ZINC000882165548 591309972 /nfs/dbraw/zinc/30/99/72/591309972.db2.gz AZQDWFXWZZKVFP-QWHCGFSZSA-N 1 2 249.358 2.081 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2CCO[C@H](C3CC3)C2)c1C ZINC000882192444 591314395 /nfs/dbraw/zinc/31/43/95/591314395.db2.gz BODFTJZQBGOHQU-STQMWFEESA-N 1 2 247.342 2.463 20 0 BEADLO Cc1[nH+]cnc(NC[C@H]2CCC(C)(C)O2)c1C ZINC000882212942 591317268 /nfs/dbraw/zinc/31/72/68/591317268.db2.gz YEFCSTPGRNRFPG-LLVKDONJSA-N 1 2 235.331 2.463 20 0 BEADLO CC(C)C(=O)N(C)Cn1c[nH+]c(C(C)(C)C)c1 ZINC000882280931 591326182 /nfs/dbraw/zinc/32/61/82/591326182.db2.gz OQGKXBSZJBBNPU-UHFFFAOYSA-N 1 2 237.347 2.253 20 0 BEADLO Cc1[nH+]cnc(N2CCC3(CC3)C2)c1C ZINC000882311090 591326781 /nfs/dbraw/zinc/32/67/81/591326781.db2.gz DCUKCKIZQQIFSO-UHFFFAOYSA-N 1 2 203.289 2.084 20 0 BEADLO Cc1ccnc(CNc2nc[nH+]c(C)c2C)c1 ZINC000882402160 591343478 /nfs/dbraw/zinc/34/34/78/591343478.db2.gz WBOJCEHOVBQCGS-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2CC23CCOCC3)c1C ZINC000882423385 591345959 /nfs/dbraw/zinc/34/59/59/591345959.db2.gz RFICLCLOPRPKHA-LLVKDONJSA-N 1 2 233.315 2.074 20 0 BEADLO Cc1ncnc(N[C@H]2C[C@H](C)n3cc[nH+]c32)c1C ZINC000882426684 591346391 /nfs/dbraw/zinc/34/63/91/591346391.db2.gz PFUMMVSKLSUQOV-KWQFWETISA-N 1 2 243.314 2.408 20 0 BEADLO Cc1cnc(C)c(N[C@@H]2C[C@H](C)n3cc[nH+]c32)n1 ZINC000882426595 591346516 /nfs/dbraw/zinc/34/65/16/591346516.db2.gz NBATXDMUWAAUSG-GXSJLCMTSA-N 1 2 243.314 2.408 20 0 BEADLO CCO[C@H]1C[C@@H](Nc2nc[nH+]c(C)c2C)C1 ZINC000882439816 591349061 /nfs/dbraw/zinc/34/90/61/591349061.db2.gz RKEXHCKWDSOZKG-PHIMTYICSA-N 1 2 221.304 2.073 20 0 BEADLO Cc1[nH+]cnc(N2CCC[C@@H](CCO)CC2)c1C ZINC000882473715 591355230 /nfs/dbraw/zinc/35/52/30/591355230.db2.gz QQVFAQAJEBYMCP-CYBMUJFWSA-N 1 2 249.358 2.082 20 0 BEADLO CSc1cnc(NC(C)(C)c2[nH]cc[nH+]2)nc1 ZINC000882626635 591402158 /nfs/dbraw/zinc/40/21/58/591402158.db2.gz OLDWQHAKDCJSDY-UHFFFAOYSA-N 1 2 249.343 2.269 20 0 BEADLO Cc1[nH+]cnc(NCC2SCCS2)c1C ZINC000882631798 591404945 /nfs/dbraw/zinc/40/49/45/591404945.db2.gz KMDHOMBEXDNLPV-UHFFFAOYSA-N 1 2 241.385 2.311 20 0 BEADLO CC(C)Cc1cc(NCC2CSC2)nc[nH+]1 ZINC000882678739 591410438 /nfs/dbraw/zinc/41/04/38/591410438.db2.gz ZCDYNQMWXBHWDC-UHFFFAOYSA-N 1 2 237.372 2.450 20 0 BEADLO CO[C@H]1CC[C@H](C)N(c2cc[nH+]cc2F)C1 ZINC000882683014 591411863 /nfs/dbraw/zinc/41/18/63/591411863.db2.gz PAEIUDDNRDSNIO-UWVGGRQHSA-N 1 2 224.279 2.224 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@@H]2CSC[C@@H]2C1 ZINC000882697420 591413501 /nfs/dbraw/zinc/41/35/01/591413501.db2.gz FLOPJDIBSMWDOA-ZJUUUORDSA-N 1 2 238.331 2.410 20 0 BEADLO Cc1[nH+]cnc(N2CC[C@@H]3CSC[C@@H]3C2)c1C ZINC000882697846 591414060 /nfs/dbraw/zinc/41/40/60/591414060.db2.gz HEIQVPRJMKHGDP-NEPJUHHUSA-N 1 2 249.383 2.283 20 0 BEADLO Cc1[nH+]cnc(N2C[C@@H]3CC=CC[C@@H]3C2)c1C ZINC000882701274 591414180 /nfs/dbraw/zinc/41/41/80/591414180.db2.gz VNHDTDMKJCPKRF-BETUJISGSA-N 1 2 229.327 2.496 20 0 BEADLO Cc1[nH+]cnc(N2CCC[C@@H](C(C)(C)O)C2)c1C ZINC000882714866 591417954 /nfs/dbraw/zinc/41/79/54/591417954.db2.gz ZXBZNYYOYWMADM-GFCCVEGCSA-N 1 2 249.358 2.081 20 0 BEADLO CCCNC(=S)Nc1ccc(C)[nH+]c1C ZINC000130103698 591438347 /nfs/dbraw/zinc/43/83/47/591438347.db2.gz RQQAOSJLGXLTFZ-UHFFFAOYSA-N 1 2 223.345 2.395 20 0 BEADLO C=C/C=C\CCNc1cc(CC(=O)OC)cc[nH+]1 ZINC000882795662 591439819 /nfs/dbraw/zinc/43/98/19/591439819.db2.gz QWLMUISRBDFQTQ-PLNGDYQASA-N 1 2 246.310 2.341 20 0 BEADLO C=C/C=C\CCNc1cc(CO)cc[nH+]1 ZINC000882795952 591441106 /nfs/dbraw/zinc/44/11/06/591441106.db2.gz XZOVFCITHSYALE-ARJAWSKDSA-N 1 2 204.273 2.118 20 0 BEADLO C=C/C=C/CCNc1nc[nH+]c(C)c1OC ZINC000882795693 591441196 /nfs/dbraw/zinc/44/11/96/591441196.db2.gz RGQFZEHEWMODNB-AATRIKPKSA-N 1 2 219.288 2.338 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CC[C@@H](CF)C2)[nH+]1 ZINC000882840836 591450752 /nfs/dbraw/zinc/45/07/52/591450752.db2.gz GAXRVBLFBNVGTJ-VIFPVBQESA-N 1 2 234.278 2.062 20 0 BEADLO FC[C@H]1CCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000882842213 591452103 /nfs/dbraw/zinc/45/21/03/591452103.db2.gz PRGKYGWNCRKFSG-SECBINFHSA-N 1 2 219.263 2.359 20 0 BEADLO Cc1cc(N2CC[C@H](CF)C2)nc(C2CC2)[nH+]1 ZINC000882841618 591452420 /nfs/dbraw/zinc/45/24/20/591452420.db2.gz ANQYGRITWABRRX-SNVBAGLBSA-N 1 2 235.306 2.458 20 0 BEADLO Cc1nc(N2CC(CC3CCOCC3)C2)cc[nH+]1 ZINC000882885974 591463367 /nfs/dbraw/zinc/46/33/67/591463367.db2.gz WXTXFGUKAXLKPG-UHFFFAOYSA-N 1 2 247.342 2.038 20 0 BEADLO CC(C)c1c[nH]c(CNCc2nccs2)[nH+]1 ZINC000882905333 591472646 /nfs/dbraw/zinc/47/26/46/591472646.db2.gz ADGJSUFVWJBQED-UHFFFAOYSA-N 1 2 236.344 2.279 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccc([C@H](C)O)cc2)no1 ZINC000882917441 591474861 /nfs/dbraw/zinc/47/48/61/591474861.db2.gz MGVWRZLAYOPTRU-NSHDSACASA-N 1 2 246.310 2.326 20 0 BEADLO CC(C)c1c[nH]c(CNCC(C)(F)F)[nH+]1 ZINC000883130598 591545923 /nfs/dbraw/zinc/54/59/23/591545923.db2.gz LMKCIGXOFYCDIQ-UHFFFAOYSA-N 1 2 217.263 2.278 20 0 BEADLO CC(F)(F)C[NH2+]Cc1ccc2oc(=O)oc2c1 ZINC000883130568 591545981 /nfs/dbraw/zinc/54/59/81/591545981.db2.gz JSDNGDMCKHJRAV-UHFFFAOYSA-N 1 2 243.209 2.131 20 0 BEADLO CCc1nc(CNCc2[nH]cc(C(C)C)[nH+]2)co1 ZINC000883136786 591547993 /nfs/dbraw/zinc/54/79/93/591547993.db2.gz NQYZPTFYZVJBEM-UHFFFAOYSA-N 1 2 248.330 2.373 20 0 BEADLO CCn1ccc(CNCc2[nH]cc(C(C)C)[nH+]2)n1 ZINC000883145931 591550807 /nfs/dbraw/zinc/55/08/07/591550807.db2.gz ULJGQYQWCWVHSQ-UHFFFAOYSA-N 1 2 247.346 2.039 20 0 BEADLO CC(C)c1c[nH]c(C[NH2+]Cc2ccnc(F)c2)n1 ZINC000883194778 591568720 /nfs/dbraw/zinc/56/87/20/591568720.db2.gz COBHLDWCVCADRX-UHFFFAOYSA-N 1 2 248.305 2.357 20 0 BEADLO Cc1nocc1C[NH2+]Cc1nc(C(C)C)c[nH]1 ZINC000883194508 591569523 /nfs/dbraw/zinc/56/95/23/591569523.db2.gz XKWNENCGSHIVJZ-UHFFFAOYSA-N 1 2 234.303 2.119 20 0 BEADLO c1coc(C[NH2+]C2(c3ncccn3)CCC2)c1 ZINC000883308436 591610210 /nfs/dbraw/zinc/61/02/10/591610210.db2.gz PEBZPCAHIQDWDA-UHFFFAOYSA-N 1 2 229.283 2.239 20 0 BEADLO CCn1nc(C)c(CNc2c[nH+]c(C)c(C)c2)n1 ZINC000883341532 591620361 /nfs/dbraw/zinc/62/03/61/591620361.db2.gz SGNZHKPJEZQRRR-UHFFFAOYSA-N 1 2 245.330 2.230 20 0 BEADLO Cc1cc(NCc2cnn3c2CCC3)c[nH+]c1C ZINC000883341125 591620541 /nfs/dbraw/zinc/62/05/41/591620541.db2.gz IUHWZGMAYGTGDO-UHFFFAOYSA-N 1 2 242.326 2.453 20 0 BEADLO CCn1cc(C[N@H+](Cc2ccco2)C(C)C)nn1 ZINC000883999278 591790279 /nfs/dbraw/zinc/79/02/79/591790279.db2.gz PZXNGXFXNJTCLZ-UHFFFAOYSA-N 1 2 248.330 2.302 20 0 BEADLO CCn1cc(C[N@@H+](Cc2ccco2)C(C)C)nn1 ZINC000883999278 591790281 /nfs/dbraw/zinc/79/02/81/591790281.db2.gz PZXNGXFXNJTCLZ-UHFFFAOYSA-N 1 2 248.330 2.302 20 0 BEADLO Cc1cnc(N2CC[C@@H](Oc3cc[nH+]cc3)C2)o1 ZINC000884490463 591955208 /nfs/dbraw/zinc/95/52/08/591955208.db2.gz XTKQDJFMDWTQSK-GFCCVEGCSA-N 1 2 245.282 2.036 20 0 BEADLO CCc1nc(N[C@@H]2[C@@H]3CCC[C@@H]32)cc[nH+]1 ZINC000884488967 591955372 /nfs/dbraw/zinc/95/53/72/591955372.db2.gz LKIIQJGQURKFAP-BZBKMWRSSA-N 1 2 203.289 2.249 20 0 BEADLO CCc1nc(N(C)Cc2cnccc2C)cc[nH+]1 ZINC000884493913 591955945 /nfs/dbraw/zinc/95/59/45/591955945.db2.gz GHXUPQCUMXRMTG-UHFFFAOYSA-N 1 2 242.326 2.379 20 0 BEADLO CCc1nc(N2C[C@H](C)O[C@@H](C3CC3)C2)cc[nH+]1 ZINC000884492175 591956315 /nfs/dbraw/zinc/95/63/15/591956315.db2.gz OMBMYJBZRTWLHW-CMPLNLGQSA-N 1 2 247.342 2.043 20 0 BEADLO CCc1nc(N2CCC=C(C)C2)cc[nH+]1 ZINC000884495600 591956814 /nfs/dbraw/zinc/95/68/14/591956814.db2.gz ZDQAVLJTFXMWQK-UHFFFAOYSA-N 1 2 203.289 2.195 20 0 BEADLO CCc1nc(N2CCCO[C@@H](CC)C2)cc[nH+]1 ZINC000884496561 591957203 /nfs/dbraw/zinc/95/72/03/591957203.db2.gz ZUXJCOCSEXPYSW-NSHDSACASA-N 1 2 235.331 2.044 20 0 BEADLO CCc1nc(N[C@@H]2C[C@H]2C(F)(F)F)cc[nH+]1 ZINC000884498197 591957991 /nfs/dbraw/zinc/95/79/91/591957991.db2.gz UPXCPODECYIAJL-RNFRBKRXSA-N 1 2 231.221 2.402 20 0 BEADLO CCc1nc(N2CC[C@@]3(C2)CCCOC3)cc[nH+]1 ZINC000884500194 591958360 /nfs/dbraw/zinc/95/83/60/591958360.db2.gz ZBHCKPNPEHJIPR-CQSZACIVSA-N 1 2 247.342 2.046 20 0 BEADLO CCc1nc(NC[C@@H]2CCOC[C@H]2C)cc[nH+]1 ZINC000884506773 591960012 /nfs/dbraw/zinc/96/00/12/591960012.db2.gz MRBCZDVQGGIYPJ-MNOVXSKESA-N 1 2 235.331 2.124 20 0 BEADLO CCc1nc(NCc2cc(C)ccn2)cc[nH+]1 ZINC000884516616 591962671 /nfs/dbraw/zinc/96/26/71/591962671.db2.gz OQKYZCCCRIQUGC-UHFFFAOYSA-N 1 2 228.299 2.355 20 0 BEADLO CCc1nc(NC[C@]2(O)CCC[C@@H]2C)cc[nH+]1 ZINC000884516180 591962678 /nfs/dbraw/zinc/96/26/78/591962678.db2.gz DPRSKHMAOMKWNC-GXFFZTMASA-N 1 2 235.331 2.002 20 0 BEADLO CCc1nc(N2CC[C@H](OC)C(C)(C)C2)cc[nH+]1 ZINC000884521199 591964671 /nfs/dbraw/zinc/96/46/71/591964671.db2.gz PYWFIWLDYWAKMU-NSHDSACASA-N 1 2 249.358 2.290 20 0 BEADLO CCc1nc(NCC(C)(C)C(C)(C)O)cc[nH+]1 ZINC000884524417 591965710 /nfs/dbraw/zinc/96/57/10/591965710.db2.gz XOKAZQDZJIXUCI-UHFFFAOYSA-N 1 2 237.347 2.248 20 0 BEADLO CCc1nc(N2CCCC[C@@H]2COC)cc[nH+]1 ZINC000884525641 591966006 /nfs/dbraw/zinc/96/60/06/591966006.db2.gz ZYTUORXMZYUZDR-LLVKDONJSA-N 1 2 235.331 2.044 20 0 BEADLO CCc1nc(NCCc2ccc(C)cn2)cc[nH+]1 ZINC000884525718 591966767 /nfs/dbraw/zinc/96/67/67/591966767.db2.gz CBLBGWZFKNOWEZ-UHFFFAOYSA-N 1 2 242.326 2.397 20 0 BEADLO CCc1nc(N[C@H]2CS[C@@H](C)C2)cc[nH+]1 ZINC000884530748 591968887 /nfs/dbraw/zinc/96/88/87/591968887.db2.gz SKVRNFRTHIOAGP-DTWKUNHWSA-N 1 2 223.345 2.345 20 0 BEADLO CCc1nc(N[C@@H](CC)[C@@H](O)C(C)C)cc[nH+]1 ZINC000884530340 591969155 /nfs/dbraw/zinc/96/91/55/591969155.db2.gz JQAZAZXAPLZARW-GWCFXTLKSA-N 1 2 237.347 2.246 20 0 BEADLO CCc1nc(N[C@@H]2CCC[C@@H](CO)C2)cc[nH+]1 ZINC000884532246 591969877 /nfs/dbraw/zinc/96/98/77/591969877.db2.gz FVHJEYBNQLTVAQ-GHMZBOCLSA-N 1 2 235.331 2.002 20 0 BEADLO CCc1nc(N[C@@H](CO)C[C@@H](C)CC)cc[nH+]1 ZINC000884542667 591972232 /nfs/dbraw/zinc/97/22/32/591972232.db2.gz KJPWBAVAGZBIMK-WDEREUQCSA-N 1 2 237.347 2.248 20 0 BEADLO CCc1nc(N2CCC=C(Cl)C2)cc[nH+]1 ZINC000884543862 591973609 /nfs/dbraw/zinc/97/36/09/591973609.db2.gz PDPXSLUDPLUKKX-UHFFFAOYSA-N 1 2 223.707 2.372 20 0 BEADLO CCc1nc(NCCC2(CO)CCC2)cc[nH+]1 ZINC000884546755 591975272 /nfs/dbraw/zinc/97/52/72/591975272.db2.gz SWXFYOHIRNNPRV-UHFFFAOYSA-N 1 2 235.331 2.004 20 0 BEADLO CCc1nc(N2CCO[C@@](C)(C3CC3)C2)cc[nH+]1 ZINC000884553106 591977138 /nfs/dbraw/zinc/97/71/38/591977138.db2.gz PJHSGNXKBAVQCC-CQSZACIVSA-N 1 2 247.342 2.044 20 0 BEADLO CCc1nc(N2CC3(CCC3)OC[C@@H]2C)cc[nH+]1 ZINC000884554795 591977413 /nfs/dbraw/zinc/97/74/13/591977413.db2.gz CLGKFQLXDLSAKX-NSHDSACASA-N 1 2 247.342 2.187 20 0 BEADLO CCc1nc(NC[C@@H]2CCC[C@H](C)O2)cc[nH+]1 ZINC000884557158 591978179 /nfs/dbraw/zinc/97/81/79/591978179.db2.gz ISTCULGMZLCUPC-QWRGUYRKSA-N 1 2 235.331 2.409 20 0 BEADLO CCc1nc(N2CCCC[C@H]2[C@H](C)CO)cc[nH+]1 ZINC000884555732 591978224 /nfs/dbraw/zinc/97/82/24/591978224.db2.gz YHXPCXXSJPZERP-NEPJUHHUSA-N 1 2 249.358 2.026 20 0 BEADLO CCc1nc(N2CCCC[C@@H]2[C@@H](C)CO)cc[nH+]1 ZINC000884555733 591978346 /nfs/dbraw/zinc/97/83/46/591978346.db2.gz YHXPCXXSJPZERP-NWDGAFQWSA-N 1 2 249.358 2.026 20 0 BEADLO CCc1nc(NC[C@]2(C)CC2(F)F)cc[nH+]1 ZINC000884556949 591978652 /nfs/dbraw/zinc/97/86/52/591978652.db2.gz DFJJVAGYULHCHF-JTQLQIEISA-N 1 2 227.258 2.496 20 0 BEADLO CCc1nc(NCC(C)(C)n2cccn2)cc[nH+]1 ZINC000884559436 591979658 /nfs/dbraw/zinc/97/96/58/591979658.db2.gz UYRFYJPRIRNUNW-UHFFFAOYSA-N 1 2 245.330 2.083 20 0 BEADLO CCc1nc(NC(C)(C)c2ncc[nH]2)cc[nH+]1 ZINC000884559079 591979787 /nfs/dbraw/zinc/97/97/87/591979787.db2.gz LYFGYLPDRJFCMS-UHFFFAOYSA-N 1 2 231.303 2.109 20 0 BEADLO CCc1nc(N2CC(CC3CC3)C2)cc[nH+]1 ZINC000884562057 591980679 /nfs/dbraw/zinc/98/06/79/591980679.db2.gz QHSMTKGLXRZSEU-UHFFFAOYSA-N 1 2 217.316 2.275 20 0 BEADLO CCc1nc(N2CC(Cc3ccco3)C2)cc[nH+]1 ZINC000884564441 591982637 /nfs/dbraw/zinc/98/26/37/591982637.db2.gz HCUVYXPKVUYKAB-UHFFFAOYSA-N 1 2 243.310 2.311 20 0 BEADLO CCc1nc(N2CC[C@H]3CSC[C@H]3C2)cc[nH+]1 ZINC000884573905 591984499 /nfs/dbraw/zinc/98/44/99/591984499.db2.gz XFDLALCOGFMQCZ-WDEREUQCSA-N 1 2 249.383 2.228 20 0 BEADLO CCc1nc(NC[C@@H]2C[C@H]3CCC[C@H]3O2)cc[nH+]1 ZINC000884579212 591986304 /nfs/dbraw/zinc/98/63/04/591986304.db2.gz UIZOQZHDHHNBSU-GRYCIOLGSA-N 1 2 247.342 2.409 20 0 BEADLO CC/C=C(/C)C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000135388872 592011180 /nfs/dbraw/zinc/01/11/80/592011180.db2.gz BHSOAMWBZNCVQW-ABRRARGCSA-N 1 2 221.304 2.333 20 0 BEADLO CCC=C(C)C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000135388872 592011182 /nfs/dbraw/zinc/01/11/82/592011182.db2.gz BHSOAMWBZNCVQW-ABRRARGCSA-N 1 2 221.304 2.333 20 0 BEADLO Cc1coc(C(=O)OCCCn2cc[nH+]c2)c1 ZINC000884710431 592014329 /nfs/dbraw/zinc/01/43/29/592014329.db2.gz IWOJFNGDSSOPFU-UHFFFAOYSA-N 1 2 234.255 2.032 20 0 BEADLO Cc1[nH+]cnc(N2CC[C@H]([C@H]3CCCO3)C2)c1C ZINC000884752254 592017257 /nfs/dbraw/zinc/01/72/57/592017257.db2.gz SRVAZJBSPBAMOT-QWHCGFSZSA-N 1 2 247.342 2.099 20 0 BEADLO Cc1[nH+]cnc(N2CC[C@H]([C@@H]3CCCO3)C2)c1C ZINC000884752255 592017489 /nfs/dbraw/zinc/01/74/89/592017489.db2.gz SRVAZJBSPBAMOT-STQMWFEESA-N 1 2 247.342 2.099 20 0 BEADLO FC(F)C[N@H+](C[C@@H]1C[C@]12CCOC2)C1CC1 ZINC000886002075 592127619 /nfs/dbraw/zinc/12/76/19/592127619.db2.gz QCEIRGJSXDAMKA-CABZTGNLSA-N 1 2 231.286 2.143 20 0 BEADLO FC(F)C[N@@H+](C[C@@H]1C[C@]12CCOC2)C1CC1 ZINC000886002075 592127621 /nfs/dbraw/zinc/12/76/21/592127621.db2.gz QCEIRGJSXDAMKA-CABZTGNLSA-N 1 2 231.286 2.143 20 0 BEADLO CCc1nnc([C@@H](C)[NH2+]Cc2cc(C)co2)[nH]1 ZINC000886052325 592141101 /nfs/dbraw/zinc/14/11/01/592141101.db2.gz OOOOWFWNZCPVBH-SECBINFHSA-N 1 2 234.303 2.119 20 0 BEADLO Cc1nc(C[N@H+](C)CC[C@@H]2C[C@H]2C2CC2)no1 ZINC000886116444 592156899 /nfs/dbraw/zinc/15/68/99/592156899.db2.gz IOGPKYZAVCRIBG-NEPJUHHUSA-N 1 2 235.331 2.246 20 0 BEADLO Cc1nc(C[N@@H+](C)CC[C@@H]2C[C@H]2C2CC2)no1 ZINC000886116444 592156901 /nfs/dbraw/zinc/15/69/01/592156901.db2.gz IOGPKYZAVCRIBG-NEPJUHHUSA-N 1 2 235.331 2.246 20 0 BEADLO Cc1coc(C[NH2+]Cc2nnc(C(C)C)[nH]2)c1 ZINC000886129290 592159843 /nfs/dbraw/zinc/15/98/43/592159843.db2.gz BBCOVZQOWGFZDJ-UHFFFAOYSA-N 1 2 234.303 2.119 20 0 BEADLO Cn1cnc(C[NH2+]Cc2cscc2Cl)c1 ZINC000886199226 592174084 /nfs/dbraw/zinc/17/40/84/592174084.db2.gz OQFFTSIRGQOCLB-UHFFFAOYSA-N 1 2 241.747 2.425 20 0 BEADLO Cc1nc(C)c(C[NH2+]Cc2cc(C3CC3)no2)o1 ZINC000886270758 592192046 /nfs/dbraw/zinc/19/20/46/592192046.db2.gz MBNHSFKJLFZLQZ-UHFFFAOYSA-N 1 2 247.298 2.447 20 0 BEADLO C[C@@H]([NH2+]Cc1ccnc(F)c1)c1ncco1 ZINC000886271914 592192893 /nfs/dbraw/zinc/19/28/93/592192893.db2.gz APLYSSMEHRVJRP-MRVPVSSYSA-N 1 2 221.235 2.060 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2ncco2)ccn1 ZINC000886272067 592193020 /nfs/dbraw/zinc/19/30/20/592193020.db2.gz GFIWNQLEUSATPU-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO COc1cccc(NCc2[nH]cc(C)[nH+]2)c1OC ZINC000886275823 592195491 /nfs/dbraw/zinc/19/54/91/592195491.db2.gz NJVULTOFDUJLOH-UHFFFAOYSA-N 1 2 247.298 2.347 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCC(F)(F)C[C@@H]1C ZINC000886300889 592203099 /nfs/dbraw/zinc/20/30/99/592203099.db2.gz RGZQTZCPZRDYNB-VIFPVBQESA-N 1 2 229.274 2.338 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCC(F)(F)C[C@@H]1C ZINC000886300889 592203100 /nfs/dbraw/zinc/20/31/00/592203100.db2.gz RGZQTZCPZRDYNB-VIFPVBQESA-N 1 2 229.274 2.338 20 0 BEADLO CCc1cc(C[NH2+][C@@H]2CCc3cccnc32)on1 ZINC000886529960 592247742 /nfs/dbraw/zinc/24/77/42/592247742.db2.gz AUBCVDFNVSLURI-CYBMUJFWSA-N 1 2 243.310 2.409 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ccccn1)c1ncco1 ZINC000886536228 592251158 /nfs/dbraw/zinc/25/11/58/592251158.db2.gz DHJYFWDNCOCPLL-UWVGGRQHSA-N 1 2 217.272 2.481 20 0 BEADLO COC(=O)[C@@H]1CC[C@@H](Nc2ccc(C)[nH+]c2)C1 ZINC000886577105 592266846 /nfs/dbraw/zinc/26/68/46/592266846.db2.gz XDOCANKBYOFSSE-GHMZBOCLSA-N 1 2 234.299 2.144 20 0 BEADLO CC(C)[C@@H]([NH2+]CC(C)(F)F)c1cnn(C)c1 ZINC000886615863 592276201 /nfs/dbraw/zinc/27/62/01/592276201.db2.gz POIPVEYBHAHNIB-SNVBAGLBSA-N 1 2 231.290 2.362 20 0 BEADLO CCCCC(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000075552362 592314070 /nfs/dbraw/zinc/31/40/70/592314070.db2.gz IHNNKEMVFPJONN-LLVKDONJSA-N 1 2 235.331 2.306 20 0 BEADLO CCOC(=O)CC[N@H+](CC(F)F)C1CCC1 ZINC000887100839 592439698 /nfs/dbraw/zinc/43/96/98/592439698.db2.gz SYNLUKVGCNLZFY-UHFFFAOYSA-N 1 2 235.274 2.059 20 0 BEADLO CCOC(=O)CC[N@@H+](CC(F)F)C1CCC1 ZINC000887100839 592439701 /nfs/dbraw/zinc/43/97/01/592439701.db2.gz SYNLUKVGCNLZFY-UHFFFAOYSA-N 1 2 235.274 2.059 20 0 BEADLO Cn1cc(CC[N@H+](CC(F)F)C2CCC2)cn1 ZINC000887099091 592441730 /nfs/dbraw/zinc/44/17/30/592441730.db2.gz QPNODLXVBSOQSD-UHFFFAOYSA-N 1 2 243.301 2.082 20 0 BEADLO Cn1cc(CC[N@@H+](CC(F)F)C2CCC2)cn1 ZINC000887099091 592441731 /nfs/dbraw/zinc/44/17/31/592441731.db2.gz QPNODLXVBSOQSD-UHFFFAOYSA-N 1 2 243.301 2.082 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NCC(C)(C)C1CC1 ZINC000887371682 592495311 /nfs/dbraw/zinc/49/53/11/592495311.db2.gz BKKFGOZRIXDWAT-SNVBAGLBSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NCC(C)(C)C1CC1 ZINC000887371682 592495313 /nfs/dbraw/zinc/49/53/13/592495313.db2.gz BKKFGOZRIXDWAT-SNVBAGLBSA-N 1 2 249.358 2.141 20 0 BEADLO CSCc1cn(CCc2cccc(C)[nH+]2)nn1 ZINC000887427894 592505252 /nfs/dbraw/zinc/50/52/52/592505252.db2.gz GDJIUCAWHLBVEO-UHFFFAOYSA-N 1 2 248.355 2.087 20 0 BEADLO C[C@H](NCc1ncc(Cl)s1)c1[nH]cc[nH+]1 ZINC000223053274 592515846 /nfs/dbraw/zinc/51/58/46/592515846.db2.gz QUVBTUTWLFKYSD-LURJTMIESA-N 1 2 242.735 2.370 20 0 BEADLO CCCC[C@H](C)c1nc(C[NH2+]CC)no1 ZINC000300909237 592524661 /nfs/dbraw/zinc/52/46/61/592524661.db2.gz JUOYRMSDASNFKG-VIFPVBQESA-N 1 2 211.309 2.473 20 0 BEADLO O=C(CCn1cc[nH+]c1)N1CC[C@@H]1C1CCCC1 ZINC000889399030 592607359 /nfs/dbraw/zinc/60/73/59/592607359.db2.gz WCWWFAYFRSNSKV-CYBMUJFWSA-N 1 2 247.342 2.064 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2C[C@@H](C)CO2)c(C)[nH+]1 ZINC000889464237 592613232 /nfs/dbraw/zinc/61/32/32/592613232.db2.gz DOLNZBBBLFIGQO-PELKAZGASA-N 1 2 234.299 2.062 20 0 BEADLO CC[C@H]1CCC[C@@]1(C)C(=O)NCc1cn(C)c[nH+]1 ZINC000890100372 592679024 /nfs/dbraw/zinc/67/90/24/592679024.db2.gz USGDSLFKEVYEOX-SMDDNHRTSA-N 1 2 249.358 2.253 20 0 BEADLO Cn1c[nH+]c(CNC(=O)[C@@H]2CCC=CCCC2)c1 ZINC000890099827 592679409 /nfs/dbraw/zinc/67/94/09/592679409.db2.gz LBHLUCMTKUHKAE-GFCCVEGCSA-N 1 2 247.342 2.173 20 0 BEADLO CCC1(C(=O)NCc2cn(C)c[nH+]2)CCCCC1 ZINC000890106683 592681816 /nfs/dbraw/zinc/68/18/16/592681816.db2.gz ALIQTOBZKWYBHO-UHFFFAOYSA-N 1 2 249.358 2.397 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1C(=O)NCc1cn(C)c[nH+]1 ZINC000890106487 592681856 /nfs/dbraw/zinc/68/18/56/592681856.db2.gz ALDPPCQIXNNVSS-YPMHNXCESA-N 1 2 249.358 2.253 20 0 BEADLO CCC[C@@H]1CCC[C@@H]1C(=O)NCc1cn(C)c[nH+]1 ZINC000890107812 592682654 /nfs/dbraw/zinc/68/26/54/592682654.db2.gz QXUPZRKDWHRIBQ-YPMHNXCESA-N 1 2 249.358 2.253 20 0 BEADLO Cc1cc(C(=O)NCc2cn(C)c[nH+]2)c(C)s1 ZINC000890116975 592685917 /nfs/dbraw/zinc/68/59/17/592685917.db2.gz DYSOEMWSHHJDLT-UHFFFAOYSA-N 1 2 249.339 2.028 20 0 BEADLO Cn1c[nH+]c(CNC(=O)CCC2CCCC2)c1 ZINC000890120231 592686620 /nfs/dbraw/zinc/68/66/20/592686620.db2.gz XIJAECGTPJERBW-UHFFFAOYSA-N 1 2 235.331 2.007 20 0 BEADLO OCc1ccc(F)cc1-c1cn2c([nH+]1)CCC2 ZINC000828826018 592706199 /nfs/dbraw/zinc/70/61/99/592706199.db2.gz ZYAYPRUNFGPLNQ-UHFFFAOYSA-N 1 2 232.258 2.128 20 0 BEADLO CCc1cc(N[C@H]2CCOC[C@@H]2C)nc(CC)[nH+]1 ZINC000893503186 634539215 /nfs/dbraw/zinc/53/92/15/634539215.db2.gz YTNMPLWGRVIHKJ-JQWIXIFHSA-N 1 2 249.358 2.438 20 0 BEADLO Nc1ccc(COC(=O)C[C@H]2CC=CCC2)c[nH+]1 ZINC000924252139 635571932 /nfs/dbraw/zinc/57/19/32/635571932.db2.gz UVTCGOPXWCIVHQ-NSHDSACASA-N 1 2 246.310 2.453 20 0 BEADLO C[C@H](NCc1cocn1)c1cn2c([nH+]1)CCCC2 ZINC000925869884 635578882 /nfs/dbraw/zinc/57/88/82/635578882.db2.gz RTPZTVQXGSMYEF-JTQLQIEISA-N 1 2 246.314 2.058 20 0 BEADLO CC1(C)C[N@H+](C/C(Cl)=C\Cl)C[C@@H]1O ZINC000308299850 631273503 /nfs/dbraw/zinc/27/35/03/631273503.db2.gz LJHHJBLUTWGCAJ-DKCNVOGISA-N 1 2 224.131 2.008 20 0 BEADLO CC1(C)C[N@@H+](C/C(Cl)=C\Cl)C[C@@H]1O ZINC000308299850 631273506 /nfs/dbraw/zinc/27/35/06/631273506.db2.gz LJHHJBLUTWGCAJ-DKCNVOGISA-N 1 2 224.131 2.008 20 0 BEADLO C[C@H]1CCOCC[N@@H+]1C/C(Cl)=C\Cl ZINC000308310108 631278304 /nfs/dbraw/zinc/27/83/04/631278304.db2.gz QVFDCXMGXPJTNG-CYXIBPNKSA-N 1 2 224.131 2.416 20 0 BEADLO C[C@H]1CCOCC[N@H+]1C/C(Cl)=C\Cl ZINC000308310108 631278307 /nfs/dbraw/zinc/27/83/07/631278307.db2.gz QVFDCXMGXPJTNG-CYXIBPNKSA-N 1 2 224.131 2.416 20 0 BEADLO OCCC[N@H+](C/C(Cl)=C/Cl)C1CC1 ZINC000308406878 631324266 /nfs/dbraw/zinc/32/42/66/631324266.db2.gz MKSVJBUUMLPJMV-VURMDHGXSA-N 1 2 224.131 2.152 20 0 BEADLO OCCC[N@@H+](C/C(Cl)=C/Cl)C1CC1 ZINC000308406878 631324270 /nfs/dbraw/zinc/32/42/70/631324270.db2.gz MKSVJBUUMLPJMV-VURMDHGXSA-N 1 2 224.131 2.152 20 0 BEADLO C[C@@]1([NH2+]Cc2ccon2)CCOc2ccccc21 ZINC000933368878 631329859 /nfs/dbraw/zinc/32/98/59/631329859.db2.gz MHPCPMXSXZDFOO-CQSZACIVSA-N 1 2 244.294 2.462 20 0 BEADLO CC(C)(NC(=O)c1cc2c[nH+]ccc2[nH]1)C1CC1 ZINC000933467147 631383962 /nfs/dbraw/zinc/38/39/62/631383962.db2.gz LGYHELCEWQWUAL-UHFFFAOYSA-N 1 2 243.310 2.481 20 0 BEADLO CCC[C@@H](C)N(C)c1cc(N(C)C)[nH+]cn1 ZINC000891808584 631498997 /nfs/dbraw/zinc/49/89/97/631498997.db2.gz ICNIQILOIDUICD-SNVBAGLBSA-N 1 2 222.336 2.167 20 0 BEADLO CCC[C@@H](C)N(C)c1cc(N(C)C)nc[nH+]1 ZINC000891808584 631499008 /nfs/dbraw/zinc/49/90/08/631499008.db2.gz ICNIQILOIDUICD-SNVBAGLBSA-N 1 2 222.336 2.167 20 0 BEADLO CNc1cc(N[C@H]2CC[C@H](SC)C2)[nH+]cn1 ZINC000234536062 631569604 /nfs/dbraw/zinc/56/96/04/631569604.db2.gz BAUBUIUXQNCDFA-IUCAKERBSA-N 1 2 238.360 2.214 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@@H+]1CCS[C@@H](CC)C1 ZINC000247579863 631586523 /nfs/dbraw/zinc/58/65/23/631586523.db2.gz SRFSFTQPMMKVQC-MNOVXSKESA-N 1 2 245.388 2.156 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@H+]1CCS[C@@H](CC)C1 ZINC000247579863 631586526 /nfs/dbraw/zinc/58/65/26/631586526.db2.gz SRFSFTQPMMKVQC-MNOVXSKESA-N 1 2 245.388 2.156 20 0 BEADLO OC[C@H]1CC[N@@H+]1Cc1cc(Cl)ccc1F ZINC000934013268 631591838 /nfs/dbraw/zinc/59/18/38/631591838.db2.gz GSYYQMSTSMGQBG-SNVBAGLBSA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@H]1CC[N@H+]1Cc1cc(Cl)ccc1F ZINC000934013268 631591842 /nfs/dbraw/zinc/59/18/42/631591842.db2.gz GSYYQMSTSMGQBG-SNVBAGLBSA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@@H]1CC[N@@H+]1Cc1cc(F)ccc1Cl ZINC000934015253 631608586 /nfs/dbraw/zinc/60/85/86/631608586.db2.gz UNXWFYFMZGNWGF-JTQLQIEISA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@@H]1CC[N@H+]1Cc1cc(F)ccc1Cl ZINC000934015253 631608591 /nfs/dbraw/zinc/60/85/91/631608591.db2.gz UNXWFYFMZGNWGF-JTQLQIEISA-N 1 2 229.682 2.046 20 0 BEADLO CC1(CNC(=O)c2cc3c[nH+]ccc3[nH]2)CC1 ZINC000934067243 631650375 /nfs/dbraw/zinc/65/03/75/631650375.db2.gz YXRSPUKQUHISDW-UHFFFAOYSA-N 1 2 229.283 2.093 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@H+](C)Cc1coc(C2CC2)n1 ZINC000934108205 631679767 /nfs/dbraw/zinc/67/97/67/631679767.db2.gz ZNHPYLOTRRRCIR-VXGBXAGGSA-N 1 2 236.315 2.161 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@@H+](C)Cc1coc(C2CC2)n1 ZINC000934108205 631679770 /nfs/dbraw/zinc/67/97/70/631679770.db2.gz ZNHPYLOTRRRCIR-VXGBXAGGSA-N 1 2 236.315 2.161 20 0 BEADLO C[C@H]1CCCN(c2cc(N(C)C)[nH+]cn2)CC1 ZINC000892100123 631729554 /nfs/dbraw/zinc/72/95/54/631729554.db2.gz CSHZPADMOOTAAA-NSHDSACASA-N 1 2 234.347 2.169 20 0 BEADLO C[C@H]1CCCN(c2cc(N(C)C)nc[nH+]2)CC1 ZINC000892100123 631729558 /nfs/dbraw/zinc/72/95/58/631729558.db2.gz CSHZPADMOOTAAA-NSHDSACASA-N 1 2 234.347 2.169 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@H](C)CSC(C)(C)C ZINC000308924732 631745800 /nfs/dbraw/zinc/74/58/00/631745800.db2.gz HXBZAHZGOBZVSO-BDAKNGLRSA-N 1 2 233.377 2.058 20 0 BEADLO CCC(CC)CC(=O)NCc1ccc(N)[nH+]c1 ZINC000927777705 635746439 /nfs/dbraw/zinc/74/64/39/635746439.db2.gz XZWIAAPZCJKMSY-UHFFFAOYSA-N 1 2 235.331 2.106 20 0 BEADLO C[C@H]([N@H+](C)Cn1ncn(C)c1=S)C1(C)CC1 ZINC000176831478 632533014 /nfs/dbraw/zinc/53/30/14/632533014.db2.gz RHAQQMARAXEWBT-VIFPVBQESA-N 1 2 240.376 2.029 20 0 BEADLO C[C@H]([N@@H+](C)Cn1ncn(C)c1=S)C1(C)CC1 ZINC000176831478 632533020 /nfs/dbraw/zinc/53/30/20/632533020.db2.gz RHAQQMARAXEWBT-VIFPVBQESA-N 1 2 240.376 2.029 20 0 BEADLO Cc1cc(Cl)nc(C[NH2+]Cc2cnc[nH]2)c1 ZINC000309690928 632652592 /nfs/dbraw/zinc/65/25/92/632652592.db2.gz JHIQHDWRUIUSMQ-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO Cc1ccc(Cl)c(NCCn2cc[nH+]c2)n1 ZINC000309717472 632656173 /nfs/dbraw/zinc/65/61/73/632656173.db2.gz UNZYUNZREVNKMH-UHFFFAOYSA-N 1 2 236.706 2.352 20 0 BEADLO Cc1ccc(NCc2cn(C)cn2)c(C)[nH+]1 ZINC000309767792 632667324 /nfs/dbraw/zinc/66/73/24/632667324.db2.gz OAVPOUTZCKUESZ-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO CCCCOC(=O)[C@H](C)[NH2+][C@@H]1CSC[C@H]1C ZINC000310023003 632694232 /nfs/dbraw/zinc/69/42/32/632694232.db2.gz OEJHQNLGLMENJX-OUAUKWLOSA-N 1 2 245.388 2.059 20 0 BEADLO C[C@H](O)C[NH2+][C@@H](C)C(F)(F)c1ccccc1 ZINC000924528249 632696842 /nfs/dbraw/zinc/69/68/42/632696842.db2.gz MSCHEGIIQTYKSY-UWVGGRQHSA-N 1 2 229.270 2.137 20 0 BEADLO C[C@@H]1C[N@H+](C/C(Cl)=C/Cl)CCCO1 ZINC000177728477 632869163 /nfs/dbraw/zinc/86/91/63/632869163.db2.gz IIRFJPPOIZVYOW-CPJBWDMUSA-N 1 2 224.131 2.416 20 0 BEADLO C[C@@H]1C[N@@H+](C/C(Cl)=C/Cl)CCCO1 ZINC000177728477 632869166 /nfs/dbraw/zinc/86/91/66/632869166.db2.gz IIRFJPPOIZVYOW-CPJBWDMUSA-N 1 2 224.131 2.416 20 0 BEADLO Cc1ccc(NC(=O)N(C)C2CC2)c(N(C)C)[nH+]1 ZINC000162148994 633022001 /nfs/dbraw/zinc/02/20/01/633022001.db2.gz JIAPHMCMLPCGKO-UHFFFAOYSA-N 1 2 248.330 2.082 20 0 BEADLO Cc1cc(N(C)[C@H](C)CCO)nc(C2CCC2)[nH+]1 ZINC000894407682 635893279 /nfs/dbraw/zinc/89/32/79/635893279.db2.gz ARGLNQCKCBNDSI-LLVKDONJSA-N 1 2 249.358 2.260 20 0 BEADLO Cc1n[nH]c(C[N@H+]2CC[C@@H](C)[C@H](F)C2)c1C ZINC000894415922 635896959 /nfs/dbraw/zinc/89/69/59/635896959.db2.gz QRJSAZYNXNJITL-LDYMZIIASA-N 1 2 225.311 2.206 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)c1C ZINC000894415922 635896961 /nfs/dbraw/zinc/89/69/61/635896961.db2.gz QRJSAZYNXNJITL-LDYMZIIASA-N 1 2 225.311 2.206 20 0 BEADLO COCC1CN(c2cc(C)[nH+]c(C3CCC3)n2)C1 ZINC000894420432 635898871 /nfs/dbraw/zinc/89/88/71/635898871.db2.gz ZWBKLSVHXGUMFK-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO O=C(c1cc2c[nH+]ccc2[nH]1)N1CCC[C@@H]2C[C@@H]21 ZINC000935922157 633103755 /nfs/dbraw/zinc/10/37/55/633103755.db2.gz DXYQBFBSOAMDIX-RNCFNFMXSA-N 1 2 241.294 2.187 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2cnn(C)n2)ccc1F ZINC000924592294 633126363 /nfs/dbraw/zinc/12/63/63/633126363.db2.gz BBXUIRDVOSEUOY-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO C[C@H]1CCC[N@@H+]1Cn1cc(Br)cn1 ZINC000173530005 633238471 /nfs/dbraw/zinc/23/84/71/633238471.db2.gz LXCJAPZKPIOBQU-QMMMGPOBSA-N 1 2 244.136 2.087 20 0 BEADLO C[C@H]1CCC[N@H+]1Cn1cc(Br)cn1 ZINC000173530005 633238479 /nfs/dbraw/zinc/23/84/79/633238479.db2.gz LXCJAPZKPIOBQU-QMMMGPOBSA-N 1 2 244.136 2.087 20 0 BEADLO C[C@H](NC(=O)Cc1c[nH]c[nH+]1)[C@H]1CCC[C@@H](C)C1 ZINC000909412333 635956800 /nfs/dbraw/zinc/95/68/00/635956800.db2.gz AZNGDBSQLCJHJI-WOPDTQHZSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H]1COCCC[N@@H+]1Cc1cnc(Cl)s1 ZINC000306974323 635979590 /nfs/dbraw/zinc/97/95/90/635979590.db2.gz MDVSWKUGKMMPJM-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@H]1COCCC[N@H+]1Cc1cnc(Cl)s1 ZINC000306974323 635979594 /nfs/dbraw/zinc/97/95/94/635979594.db2.gz MDVSWKUGKMMPJM-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO CCc1cc(NCC[C@@H](O)CC)nc(CC)[nH+]1 ZINC000892936651 633737223 /nfs/dbraw/zinc/73/72/23/633737223.db2.gz JSVSUNNKSQRCIS-NSHDSACASA-N 1 2 237.347 2.174 20 0 BEADLO C[C@H]1OCC[C@@]1(C)[NH2+]CC(F)(F)C(F)F ZINC000308867279 633824843 /nfs/dbraw/zinc/82/48/43/633824843.db2.gz LKXPZCWUMDNMAT-HTRCEHHLSA-N 1 2 229.217 2.044 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]C[C@H](O)c1ccccc1 ZINC000179978827 633876349 /nfs/dbraw/zinc/87/63/49/633876349.db2.gz ONLZVCAGJORPPQ-YGRLFVJLSA-N 1 2 245.326 2.102 20 0 BEADLO C[NH+](C)c1ccc(NCc2cn[nH]c2)cc1 ZINC000309582215 633959675 /nfs/dbraw/zinc/95/96/75/633959675.db2.gz QSGLDTLUWSERCF-UHFFFAOYSA-N 1 2 216.288 2.088 20 0 BEADLO CC[NH2+]Cc1noc(C=C2CCCC2)n1 ZINC000309617750 633973640 /nfs/dbraw/zinc/97/36/40/633973640.db2.gz FWIUPQNTHZNXCF-UHFFFAOYSA-N 1 2 207.277 2.137 20 0 BEADLO Cc1cnc(Cl)c(C[NH2+]Cc2ccno2)c1 ZINC000893549510 635141593 /nfs/dbraw/zinc/14/15/93/635141593.db2.gz WUQRALKVUULGKJ-UHFFFAOYSA-N 1 2 237.690 2.321 20 0 BEADLO Cc1ncc(C[N@H+]2CCC[C@H]2c2ccnn2C)o1 ZINC000932264184 635629040 /nfs/dbraw/zinc/62/90/40/635629040.db2.gz WEYYRZMGJGIDTE-ZDUSSCGKSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1ncc(C[N@@H+]2CCC[C@H]2c2ccnn2C)o1 ZINC000932264184 635629042 /nfs/dbraw/zinc/62/90/42/635629042.db2.gz WEYYRZMGJGIDTE-ZDUSSCGKSA-N 1 2 246.314 2.054 20 0 BEADLO C[C@H]([NH2+]Cc1cc[nH]n1)c1ccnn1C1CCC1 ZINC000924993917 635830942 /nfs/dbraw/zinc/83/09/42/635830942.db2.gz RSNKICUORQPSGN-JTQLQIEISA-N 1 2 245.330 2.182 20 0 BEADLO Cc1c[nH]c(CNc2cc(C)[nH+]c(C3CC3)n2)n1 ZINC000894788095 635925048 /nfs/dbraw/zinc/92/50/48/635925048.db2.gz MCHABJYNTHVJRR-UHFFFAOYSA-N 1 2 243.314 2.306 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N2CCC(C)CC2)c[nH+]1 ZINC000895438822 636143949 /nfs/dbraw/zinc/14/39/49/636143949.db2.gz MGCKUMLUOLYJPJ-UHFFFAOYSA-N 1 2 249.358 2.185 20 0 BEADLO Cc1cc(NCc2ccon2)c[nH+]c1C ZINC000895644630 636171570 /nfs/dbraw/zinc/17/15/70/636171570.db2.gz CGKVAHFMJAYLHK-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO CCO[C@@H]1C[C@H]([NH2+][C@H](C)C(F)F)[C@@H]1SC ZINC000895725754 636174959 /nfs/dbraw/zinc/17/49/59/636174959.db2.gz SMBDMJNOEZOKOR-XAVMHZPKSA-N 1 2 239.331 2.139 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](C)c2ccnnc2)s1 ZINC000925149854 636309401 /nfs/dbraw/zinc/30/94/01/636309401.db2.gz ASRKKSROWAKYSX-VIFPVBQESA-N 1 2 234.328 2.092 20 0 BEADLO Cc1cccc(F)c1C[NH2+][C@@H](C)c1cnn(C)n1 ZINC000925165650 636346034 /nfs/dbraw/zinc/34/60/34/636346034.db2.gz KFIAZYAOZQCSLS-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO C/C=C/C=C/C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000169812696 636575514 /nfs/dbraw/zinc/57/55/14/636575514.db2.gz FIUBIOAHEJUWFF-ZNOLUKTJSA-N 1 2 245.326 2.248 20 0 BEADLO C/C=C/C=C/C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000169812695 636575576 /nfs/dbraw/zinc/57/55/76/636575576.db2.gz VUZWNOWMYBJMOC-MQQKCMAXSA-N 1 2 245.326 2.248 20 0 BEADLO C[C@@H]([NH2+]Cc1ccon1)c1ccc2c(c1)CCO2 ZINC000148701437 636831624 /nfs/dbraw/zinc/83/16/24/636831624.db2.gz ISDQBHDIIILUOW-SNVBAGLBSA-N 1 2 244.294 2.460 20 0 BEADLO C[C@@H](NC(=O)Cc1c[nH]c[nH+]1)C1CCCCC1 ZINC000900822698 637193328 /nfs/dbraw/zinc/19/33/28/637193328.db2.gz GGUVMROEXUOXBP-SNVBAGLBSA-N 1 2 235.331 2.037 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(C(C)(C)O)cc1 ZINC000905304679 637762068 /nfs/dbraw/zinc/76/20/68/637762068.db2.gz FLKWAULWEVRZDG-UHFFFAOYSA-N 1 2 216.284 2.315 20 0 BEADLO CC[C@H](C)[C@@H]([NH2+][C@@H]1CSC1(C)C)C(=O)OC ZINC000905767252 637923520 /nfs/dbraw/zinc/92/35/20/637923520.db2.gz JQUOOPJGTDNAGY-IVZWLZJFSA-N 1 2 245.388 2.058 20 0 BEADLO CC[C@H](C)[C@@H]([NH2+][C@H]1CCC(F)(F)C1)C(=O)OC ZINC000905768012 637923526 /nfs/dbraw/zinc/92/35/26/637923526.db2.gz POOZETGGQZGBDR-LPEHRKFASA-N 1 2 249.301 2.352 20 0 BEADLO CC/C=C\C[NH2+][C@H](C(=O)OC)[C@H](C)CC ZINC000905769768 637925136 /nfs/dbraw/zinc/92/51/36/637925136.db2.gz JAMCCFRPALOMLD-UOECRDIDSA-N 1 2 213.321 2.130 20 0 BEADLO O=C(NCCn1cc[nH+]c1)[C@@H]1CCC=CCCC1 ZINC000906130021 638057341 /nfs/dbraw/zinc/05/73/41/638057341.db2.gz KHDLPXHTRQVFNL-CYBMUJFWSA-N 1 2 247.342 2.136 20 0 BEADLO OCc1cccc(-c2c[nH+]c3c(c2)CCCN3)c1 ZINC000906154020 638064913 /nfs/dbraw/zinc/06/49/13/638064913.db2.gz PLOLUJWWVNRYLX-UHFFFAOYSA-N 1 2 240.306 2.242 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)Cc2c[nH]c[nH+]2)CC1 ZINC000907629597 638424535 /nfs/dbraw/zinc/42/45/35/638424535.db2.gz FYUCKLLJHQOHHQ-GHMZBOCLSA-N 1 2 235.331 2.037 20 0 BEADLO CC(C)(C)[C@H]1CCCN(C(=O)Cc2c[nH+]c[nH]2)C1 ZINC000907922536 638512052 /nfs/dbraw/zinc/51/20/52/638512052.db2.gz YRSVTEAIVAWMRR-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO Cc1cc(C)c(C(=O)NCC[C@@H](C)F)c(C)[nH+]1 ZINC000908428287 638705826 /nfs/dbraw/zinc/70/58/26/638705826.db2.gz PULQYGUUPMZIIP-SECBINFHSA-N 1 2 238.306 2.485 20 0 BEADLO Cc1cc(C)c(C(=O)N2C[C@@H](C)[C@H]2C)c(C)[nH+]1 ZINC000908437074 638713628 /nfs/dbraw/zinc/71/36/28/638713628.db2.gz YSJVGGMYFKJLJA-BXKDBHETSA-N 1 2 232.327 2.487 20 0 BEADLO CC[C@H](NC(=O)Cc1c[nH]c[nH+]1)C1CCCC1 ZINC000909279834 639193681 /nfs/dbraw/zinc/19/36/81/639193681.db2.gz MGARFJKCPCSTDM-LBPRGKRZSA-N 1 2 235.331 2.037 20 0 BEADLO CC1(CCC(=O)OCCn2cc[nH+]c2)CC1 ZINC000910037190 639343898 /nfs/dbraw/zinc/34/38/98/639343898.db2.gz CGGHLCJGIVQJCW-UHFFFAOYSA-N 1 2 222.288 2.007 20 0 BEADLO CC(C)(C)[C@@H]1CCC[C@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000910470522 639462448 /nfs/dbraw/zinc/46/24/48/639462448.db2.gz SEFWNOMBQOPQPD-VXGBXAGGSA-N 1 2 249.358 2.283 20 0 BEADLO CCc1ncc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)o1 ZINC000930243774 639653141 /nfs/dbraw/zinc/65/31/41/639653141.db2.gz IJCCSAFDTGXAHW-KOLCDFICSA-N 1 2 226.295 2.417 20 0 BEADLO CCc1ncc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)o1 ZINC000930243774 639653147 /nfs/dbraw/zinc/65/31/47/639653147.db2.gz IJCCSAFDTGXAHW-KOLCDFICSA-N 1 2 226.295 2.417 20 0 BEADLO CN(CCC(C)(C)C)C(=O)CNc1cccc[nH+]1 ZINC000911525746 639662733 /nfs/dbraw/zinc/66/27/33/639662733.db2.gz UZWBELQGDSZQRQ-UHFFFAOYSA-N 1 2 249.358 2.388 20 0 BEADLO CC1=C(C)C[N@H+](Cc2nncs2)CC1 ZINC000930297934 639687153 /nfs/dbraw/zinc/68/71/53/639687153.db2.gz HJWJENBAALXECP-UHFFFAOYSA-N 1 2 209.318 2.080 20 0 BEADLO CC1=C(C)C[N@@H+](Cc2nncs2)CC1 ZINC000930297934 639687161 /nfs/dbraw/zinc/68/71/61/639687161.db2.gz HJWJENBAALXECP-UHFFFAOYSA-N 1 2 209.318 2.080 20 0 BEADLO c1nnc(C[NH+]2CCC3(CCC3)CC2)s1 ZINC000930464259 639765234 /nfs/dbraw/zinc/76/52/34/639765234.db2.gz NNVYCZIWDBINEH-UHFFFAOYSA-N 1 2 223.345 2.304 20 0 BEADLO c1nnc(C[NH+]2CCC(C3CC3)CC2)s1 ZINC000930544220 639809809 /nfs/dbraw/zinc/80/98/09/639809809.db2.gz FDOMVDMUOJGRFW-UHFFFAOYSA-N 1 2 223.345 2.160 20 0 BEADLO F[C@@H]1CC[N@H+](C[C@@H]2CC[C@H](C(F)(F)F)O2)C1 ZINC000930604338 639817908 /nfs/dbraw/zinc/81/79/08/639817908.db2.gz XDKHSOAJTYRLHX-HRDYMLBCSA-N 1 2 241.228 2.140 20 0 BEADLO F[C@@H]1CC[N@@H+](C[C@@H]2CC[C@H](C(F)(F)F)O2)C1 ZINC000930604338 639817909 /nfs/dbraw/zinc/81/79/09/639817909.db2.gz XDKHSOAJTYRLHX-HRDYMLBCSA-N 1 2 241.228 2.140 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccccn2)c(C)nn1 ZINC000930615798 639822873 /nfs/dbraw/zinc/82/28/73/639822873.db2.gz UJZWOPPWDGRPRQ-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccccn2)c(C)nn1 ZINC000930615798 639822878 /nfs/dbraw/zinc/82/28/78/639822878.db2.gz UJZWOPPWDGRPRQ-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO F[C@H]1CC[N@H+](C[C@@H]2CC[C@H](C(F)(F)F)O2)C1 ZINC000930623714 639829125 /nfs/dbraw/zinc/82/91/25/639829125.db2.gz XDKHSOAJTYRLHX-XHNCKOQMSA-N 1 2 241.228 2.140 20 0 BEADLO F[C@H]1CC[N@@H+](C[C@@H]2CC[C@H](C(F)(F)F)O2)C1 ZINC000930623714 639829130 /nfs/dbraw/zinc/82/91/30/639829130.db2.gz XDKHSOAJTYRLHX-XHNCKOQMSA-N 1 2 241.228 2.140 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)CNc1cccc[nH+]1 ZINC000912277476 640021895 /nfs/dbraw/zinc/02/18/95/640021895.db2.gz BTIQTBULZKQDSJ-LLVKDONJSA-N 1 2 235.331 2.141 20 0 BEADLO Cc1cc(C)c(C(=O)N[C@H]2C=CCC2)c(C)[nH+]1 ZINC000912388842 640049035 /nfs/dbraw/zinc/04/90/35/640049035.db2.gz YROQVDPOBIYWLS-LBPRGKRZSA-N 1 2 230.311 2.455 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@H](C)CSC(C)(C)C ZINC000193093489 640088798 /nfs/dbraw/zinc/08/87/98/640088798.db2.gz HXBZAHZGOBZVSO-RKDXNWHRSA-N 1 2 233.377 2.058 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)N1CC=CC12CCCCC2 ZINC000912472586 640089244 /nfs/dbraw/zinc/08/92/44/640089244.db2.gz YOGUTOGOGDRWBY-UHFFFAOYSA-N 1 2 245.326 2.054 20 0 BEADLO C/C(=C(\F)C(=O)N[C@@H]1CCn2c[nH+]cc21)C1CC1 ZINC000912585709 640122652 /nfs/dbraw/zinc/12/26/52/640122652.db2.gz ZJUDKMCFQODMSY-ZDIKFAODSA-N 1 2 249.289 2.098 20 0 BEADLO Cc1n[nH]cc1C[N@H+](C)Cc1cnc(C2CC2)o1 ZINC000931416688 640187384 /nfs/dbraw/zinc/18/73/84/640187384.db2.gz VRCRPBBQEYLUHK-UHFFFAOYSA-N 1 2 246.314 2.216 20 0 BEADLO Cc1n[nH]cc1C[N@@H+](C)Cc1cnc(C2CC2)o1 ZINC000931416688 640187403 /nfs/dbraw/zinc/18/74/03/640187403.db2.gz VRCRPBBQEYLUHK-UHFFFAOYSA-N 1 2 246.314 2.216 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2Cc3c[nH]nc3[C@@H](C)C2)o1 ZINC000931461259 640221571 /nfs/dbraw/zinc/22/15/71/640221571.db2.gz RZNWXZDFJMYQRR-QMMMGPOBSA-N 1 2 246.314 2.134 20 0 BEADLO Cc1nc(C)c(C[N@H+]2Cc3c[nH]nc3[C@@H](C)C2)o1 ZINC000931461259 640221578 /nfs/dbraw/zinc/22/15/78/640221578.db2.gz RZNWXZDFJMYQRR-QMMMGPOBSA-N 1 2 246.314 2.134 20 0 BEADLO CCC(F)(F)C[N@@H+]1C[C@@H](C)[C@H](CC(=O)OC)C1 ZINC000932101560 640423778 /nfs/dbraw/zinc/42/37/78/640423778.db2.gz QWPRJHGDQPTOFY-NXEZZACHSA-N 1 2 249.301 2.163 20 0 BEADLO CCC(F)(F)C[N@H+]1C[C@@H](C)[C@H](CC(=O)OC)C1 ZINC000932101560 640423783 /nfs/dbraw/zinc/42/37/83/640423783.db2.gz QWPRJHGDQPTOFY-NXEZZACHSA-N 1 2 249.301 2.163 20 0 BEADLO CCSCC[C@@H](C)Nc1cc(NC)nc[nH+]1 ZINC000156679176 640479114 /nfs/dbraw/zinc/47/91/14/640479114.db2.gz OMUQXGNVTWUIIA-SECBINFHSA-N 1 2 240.376 2.462 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2coc(C3CC3)n2)CCO1 ZINC000932338088 640479607 /nfs/dbraw/zinc/47/96/07/640479607.db2.gz YKGKLYMNIRKXCX-SNVBAGLBSA-N 1 2 236.315 2.163 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2coc(C3CC3)n2)CCO1 ZINC000932338088 640479612 /nfs/dbraw/zinc/47/96/12/640479612.db2.gz YKGKLYMNIRKXCX-SNVBAGLBSA-N 1 2 236.315 2.163 20 0 BEADLO CCSCC[C@H](C)Nc1cc(NC)nc[nH+]1 ZINC000156679306 640479698 /nfs/dbraw/zinc/47/96/98/640479698.db2.gz OMUQXGNVTWUIIA-VIFPVBQESA-N 1 2 240.376 2.462 20 0 BEADLO Cl/C=C\C[NH2+][C@H](c1ncccn1)C1CC1 ZINC000932360482 640499872 /nfs/dbraw/zinc/49/98/72/640499872.db2.gz LXYYEQVYRRQZCJ-RIXFDMRVSA-N 1 2 223.707 2.270 20 0 BEADLO COC[C@@H]([NH2+]Cc1ccoc1)c1ccco1 ZINC000165121060 640539066 /nfs/dbraw/zinc/53/90/66/640539066.db2.gz RTMZBBIUSSKWTF-LLVKDONJSA-N 1 2 221.256 2.350 20 0 BEADLO C[C@@H](c1ccccn1)[N@@H+]1CCn2cccc2C1 ZINC000932524905 640563886 /nfs/dbraw/zinc/56/38/86/640563886.db2.gz BKAQGHGTYZXMBS-LBPRGKRZSA-N 1 2 227.311 2.460 20 0 BEADLO C[C@@H](c1ccccn1)[N@H+]1CCn2cccc2C1 ZINC000932524905 640563893 /nfs/dbraw/zinc/56/38/93/640563893.db2.gz BKAQGHGTYZXMBS-LBPRGKRZSA-N 1 2 227.311 2.460 20 0 BEADLO CC1(C)C[C@@H]1CNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000932634083 640590187 /nfs/dbraw/zinc/59/01/87/640590187.db2.gz SZSIPVREWVKJKJ-SNVBAGLBSA-N 1 2 243.310 2.339 20 0 BEADLO CO[C@H](C[N@@H+]1CC(=O)CC[C@H]1C)C1CCCC1 ZINC000932875591 640634656 /nfs/dbraw/zinc/63/46/56/640634656.db2.gz ANIAWHOXGOLXIX-BXUZGUMPSA-N 1 2 239.359 2.245 20 0 BEADLO CO[C@H](C[N@H+]1CC(=O)CC[C@H]1C)C1CCCC1 ZINC000932875591 640634661 /nfs/dbraw/zinc/63/46/61/640634661.db2.gz ANIAWHOXGOLXIX-BXUZGUMPSA-N 1 2 239.359 2.245 20 0 BEADLO CCO[C@H]1CC[N@H+](Cc2coc(C3CC3)n2)C1 ZINC000932971356 640656302 /nfs/dbraw/zinc/65/63/02/640656302.db2.gz IDMSLJHQRPELAP-LBPRGKRZSA-N 1 2 236.315 2.163 20 0 BEADLO CCO[C@H]1CC[N@@H+](Cc2coc(C3CC3)n2)C1 ZINC000932971356 640656307 /nfs/dbraw/zinc/65/63/07/640656307.db2.gz IDMSLJHQRPELAP-LBPRGKRZSA-N 1 2 236.315 2.163 20 0 BEADLO CCO[C@H]1CC[N@H+](Cc2scnc2Cl)C1 ZINC000932973650 640658089 /nfs/dbraw/zinc/65/80/89/640658089.db2.gz WGSHQLDXXIYEGE-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO CCO[C@H]1CC[N@@H+](Cc2scnc2Cl)C1 ZINC000932973650 640658091 /nfs/dbraw/zinc/65/80/91/640658091.db2.gz WGSHQLDXXIYEGE-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO COc1cc([NH2+]C[C@@H]2C[C@@H]2C)ccc1N ZINC000166747858 640668485 /nfs/dbraw/zinc/66/84/85/640668485.db2.gz WMTXIQGARUQFGU-IUCAKERBSA-N 1 2 206.289 2.345 20 0 BEADLO CSCCCNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000933162172 640673173 /nfs/dbraw/zinc/67/31/73/640673173.db2.gz XPHRWYKUWYOLFE-UHFFFAOYSA-N 1 2 249.339 2.046 20 0 BEADLO CSC[C@H](C)NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000933176592 640675256 /nfs/dbraw/zinc/67/52/56/640675256.db2.gz OVKQFQGCRMTBKC-QMMMGPOBSA-N 1 2 249.339 2.044 20 0 BEADLO CC1(C(=O)NC2C[NH+](CC3=CCCCC3)C2)CC1 ZINC001030352481 640780992 /nfs/dbraw/zinc/78/09/92/640780992.db2.gz NIRXMSPEERCQKE-UHFFFAOYSA-N 1 2 248.370 2.087 20 0 BEADLO CC[C@H](C)[C@H]([NH2+][C@@H]1CS[C@@H](C)C1)C(=O)OC ZINC000227503269 640836269 /nfs/dbraw/zinc/83/62/69/640836269.db2.gz RRJPEPMQXZPOFS-NAKRPEOUSA-N 1 2 245.388 2.058 20 0 BEADLO CNc1cc(N(C)CCC(C)C)nc[nH+]1 ZINC000087821538 641056772 /nfs/dbraw/zinc/05/67/72/641056772.db2.gz SNJBYKSLOVOMTE-UHFFFAOYSA-N 1 2 208.309 2.001 20 0 BEADLO CNc1cc(N(C)CCC(C)C)[nH+]cn1 ZINC000087821538 641056773 /nfs/dbraw/zinc/05/67/73/641056773.db2.gz SNJBYKSLOVOMTE-UHFFFAOYSA-N 1 2 208.309 2.001 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@H+](C)Cc1scnc1Cl ZINC000934107994 641062142 /nfs/dbraw/zinc/06/21/42/641062142.db2.gz YIEMEWUUDQQDCJ-JGVFFNPUSA-N 1 2 246.763 2.406 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@@H+](C)Cc1scnc1Cl ZINC000934107994 641062144 /nfs/dbraw/zinc/06/21/44/641062144.db2.gz YIEMEWUUDQQDCJ-JGVFFNPUSA-N 1 2 246.763 2.406 20 0 BEADLO CNc1cc(N2CCC[C@H](C)CC2)nc[nH+]1 ZINC000087830132 641062838 /nfs/dbraw/zinc/06/28/38/641062838.db2.gz SQUJHZHOGCVISV-JTQLQIEISA-N 1 2 220.320 2.145 20 0 BEADLO CNc1cc(N2CCC[C@H](C)CC2)[nH+]cn1 ZINC000087830132 641062839 /nfs/dbraw/zinc/06/28/39/641062839.db2.gz SQUJHZHOGCVISV-JTQLQIEISA-N 1 2 220.320 2.145 20 0 BEADLO CO[C@H]1CC[C@H]1[N@H+](C)Cc1coc(C2CC2)n1 ZINC000934108199 641070319 /nfs/dbraw/zinc/07/03/19/641070319.db2.gz ZNHPYLOTRRRCIR-NEPJUHHUSA-N 1 2 236.315 2.161 20 0 BEADLO CO[C@H]1CC[C@H]1[N@@H+](C)Cc1coc(C2CC2)n1 ZINC000934108199 641070324 /nfs/dbraw/zinc/07/03/24/641070324.db2.gz ZNHPYLOTRRRCIR-NEPJUHHUSA-N 1 2 236.315 2.161 20 0 BEADLO CCCCOC(=O)[C@@H](C)[N@@H+]1CCSC[C@@H]1C ZINC000172831541 641113069 /nfs/dbraw/zinc/11/30/69/641113069.db2.gz IOGSDZOTLTVOCH-WDEREUQCSA-N 1 2 245.388 2.156 20 0 BEADLO CCCCOC(=O)[C@@H](C)[N@H+]1CCSC[C@@H]1C ZINC000172831541 641113075 /nfs/dbraw/zinc/11/30/75/641113075.db2.gz IOGSDZOTLTVOCH-WDEREUQCSA-N 1 2 245.388 2.156 20 0 BEADLO CCC1(CNC(=O)c2cc3c[nH+]ccc3[nH]2)CC1 ZINC000934245527 641113423 /nfs/dbraw/zinc/11/34/23/641113423.db2.gz CYLFNIPSXWPBFA-UHFFFAOYSA-N 1 2 243.310 2.483 20 0 BEADLO c1nnc(C[NH2+][C@@H](c2ccncc2)C2CC2)s1 ZINC000934701950 641251964 /nfs/dbraw/zinc/25/19/64/641251964.db2.gz UIHVSAPHYFQPFF-GFCCVEGCSA-N 1 2 246.339 2.174 20 0 BEADLO Cc1cccc([C@@H](O)C[N@@H+](C)Cc2ccon2)c1 ZINC000929694488 641400665 /nfs/dbraw/zinc/40/06/65/641400665.db2.gz BBSLMSGJWROLTF-AWEZNQCLSA-N 1 2 246.310 2.148 20 0 BEADLO Cc1cccc([C@@H](O)C[N@H+](C)Cc2ccon2)c1 ZINC000929694488 641400671 /nfs/dbraw/zinc/40/06/71/641400671.db2.gz BBSLMSGJWROLTF-AWEZNQCLSA-N 1 2 246.310 2.148 20 0 BEADLO O=C(N[C@@H]1[C@@H]2CCC[C@@H]21)c1cc2c[nH+]ccc2[nH]1 ZINC000935702096 641465491 /nfs/dbraw/zinc/46/54/91/641465491.db2.gz QWBGITBLXYCJPK-DDFAGTSDSA-N 1 2 241.294 2.091 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)C1(C)C(C)(C)C1(C)C ZINC000936024976 641519436 /nfs/dbraw/zinc/51/94/36/641519436.db2.gz UQSZGVKFOBABLU-UHFFFAOYSA-N 1 2 249.358 2.109 20 0 BEADLO Cn1c[nH+]c(CCNc2cccc(Cl)n2)c1 ZINC000313358036 641557356 /nfs/dbraw/zinc/55/73/56/641557356.db2.gz SHMXQSFVXODMDK-UHFFFAOYSA-N 1 2 236.706 2.123 20 0 BEADLO CC1(C)COCC[N@@H+]1Cc1ccc(O)c(F)c1 ZINC000232768781 641560732 /nfs/dbraw/zinc/56/07/32/641560732.db2.gz AHSZVZRIYXKWFA-UHFFFAOYSA-N 1 2 239.290 2.142 20 0 BEADLO CC(C)c1cnc(C[N@@H+](C)CC[C@H](C)O)o1 ZINC000075777388 641769480 /nfs/dbraw/zinc/76/94/80/641769480.db2.gz USVWBVGIMMKIJU-JTQLQIEISA-N 1 2 226.320 2.001 20 0 BEADLO CC(C)c1cnc(C[N@H+](C)CC[C@H](C)O)o1 ZINC000075777388 641769500 /nfs/dbraw/zinc/76/95/00/641769500.db2.gz USVWBVGIMMKIJU-JTQLQIEISA-N 1 2 226.320 2.001 20 0 BEADLO CC[C@H]1CCCC[C@@H]1C(=O)NC1C[NH+](CC)C1 ZINC001031173184 641771807 /nfs/dbraw/zinc/77/18/07/641771807.db2.gz SCCWRMZREVLAOA-AAEUAGOBSA-N 1 2 238.375 2.023 20 0 BEADLO Cc1[nH]c(CN(C)Cc2cccc(O)c2)[nH+]c1C ZINC000628117629 641856810 /nfs/dbraw/zinc/85/68/10/641856810.db2.gz PLDZPBAIQRYCIS-UHFFFAOYSA-N 1 2 245.326 2.364 20 0 BEADLO CCC/C=C/C(=O)N1CC(Oc2cc[nH+]cc2)C1 ZINC000732760504 641866909 /nfs/dbraw/zinc/86/69/09/641866909.db2.gz AUXIZSKKUGMPKM-SNAWJCMRSA-N 1 2 246.310 2.028 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccnc2)c(C)nn1 ZINC000930089682 642368734 /nfs/dbraw/zinc/36/87/34/642368734.db2.gz GAYSGZISOJWLQE-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccnc2)c(C)nn1 ZINC000930089682 642368740 /nfs/dbraw/zinc/36/87/40/642368740.db2.gz GAYSGZISOJWLQE-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO CC(C)(C)[C@H](Cn1cc[nH+]c1)NC(=O)C1CCC1 ZINC000920768921 642547444 /nfs/dbraw/zinc/54/74/44/642547444.db2.gz WYAQMPWGGPLNTG-LBPRGKRZSA-N 1 2 249.358 2.214 20 0 BEADLO Cc1cc(NC(=O)c2ccnc(F)c2F)cc[nH+]1 ZINC000097866693 642637088 /nfs/dbraw/zinc/63/70/88/642637088.db2.gz YWCAVRUZNFNUTC-UHFFFAOYSA-N 1 2 249.220 2.316 20 0 BEADLO CC(C)(C)[C@@H](Cn1cc[nH+]c1)NC(=O)C1CCC1 ZINC000064441350 642658609 /nfs/dbraw/zinc/65/86/09/642658609.db2.gz WYAQMPWGGPLNTG-GFCCVEGCSA-N 1 2 249.358 2.214 20 0 BEADLO C[C@H]1COCCC[N@@H+]1C/C(Cl)=C/Cl ZINC000306261998 642732474 /nfs/dbraw/zinc/73/24/74/642732474.db2.gz XTPCGTPDZOBLFZ-HXOPTJOXSA-N 1 2 224.131 2.416 20 0 BEADLO C[C@H]1COCCC[N@H+]1C/C(Cl)=C/Cl ZINC000306261998 642732480 /nfs/dbraw/zinc/73/24/80/642732480.db2.gz XTPCGTPDZOBLFZ-HXOPTJOXSA-N 1 2 224.131 2.416 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]C[C@@H](O)c1ccccc1 ZINC000179978857 642760678 /nfs/dbraw/zinc/76/06/78/642760678.db2.gz ONLZVCAGJORPPQ-QMTHXVAHSA-N 1 2 245.326 2.102 20 0 BEADLO C[C@@]1(O)CC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000180634432 642803314 /nfs/dbraw/zinc/80/33/14/642803314.db2.gz ZJIHSYTZUSBAQT-GFCCVEGCSA-N 1 2 241.718 2.002 20 0 BEADLO C[C@@]1(O)CC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000180634432 642803319 /nfs/dbraw/zinc/80/33/19/642803319.db2.gz ZJIHSYTZUSBAQT-GFCCVEGCSA-N 1 2 241.718 2.002 20 0 BEADLO CC(C)COC(=O)C[N@@H+]1CCS[C@@H](C)[C@@H]1C ZINC000181461212 642873249 /nfs/dbraw/zinc/87/32/49/642873249.db2.gz YEQPWAJMOSKYJX-QWRGUYRKSA-N 1 2 245.388 2.011 20 0 BEADLO CC(C)COC(=O)C[N@H+]1CCS[C@@H](C)[C@@H]1C ZINC000181461212 642873250 /nfs/dbraw/zinc/87/32/50/642873250.db2.gz YEQPWAJMOSKYJX-QWRGUYRKSA-N 1 2 245.388 2.011 20 0 BEADLO C[NH+](C)[C@H](C(=O)OCC1CC1)c1ccccc1 ZINC000181974170 642934636 /nfs/dbraw/zinc/93/46/36/642934636.db2.gz JRARKKXDQJNLTD-ZDUSSCGKSA-N 1 2 233.311 2.243 20 0 BEADLO Cc1nonc1C[NH2+][C@@H](C)c1cccc(F)c1 ZINC000070261757 643008935 /nfs/dbraw/zinc/00/89/35/643008935.db2.gz RFYANHZWXKCOIB-QMMMGPOBSA-N 1 2 235.262 2.368 20 0 BEADLO C[N@H+](C/C(Cl)=C/Cl)[C@H]1CCCOC1 ZINC000306747242 643232406 /nfs/dbraw/zinc/23/24/06/643232406.db2.gz FONSDPIIKSZXHH-RDOCRHDPSA-N 1 2 224.131 2.416 20 0 BEADLO C[N@@H+](C/C(Cl)=C/Cl)[C@H]1CCCOC1 ZINC000306747242 643232410 /nfs/dbraw/zinc/23/24/10/643232410.db2.gz FONSDPIIKSZXHH-RDOCRHDPSA-N 1 2 224.131 2.416 20 0 BEADLO C/C(=C/C(=O)N[C@@H](C)Cn1cc[nH+]c1)C(C)(C)C ZINC000079577685 643277823 /nfs/dbraw/zinc/27/78/23/643277823.db2.gz ROYFIMNBHYGKTE-KGTBHZDVSA-N 1 2 249.358 2.380 20 0 BEADLO CC1(C)CC[N@@H+]1Cc1cnn(-c2ccccc2)n1 ZINC000081045259 643288644 /nfs/dbraw/zinc/28/86/44/643288644.db2.gz UDPLLAHOORWLRH-UHFFFAOYSA-N 1 2 242.326 2.252 20 0 BEADLO CC1(C)CC[N@H+]1Cc1cnn(-c2ccccc2)n1 ZINC000081045259 643288647 /nfs/dbraw/zinc/28/86/47/643288647.db2.gz UDPLLAHOORWLRH-UHFFFAOYSA-N 1 2 242.326 2.252 20 0 BEADLO C/C=C/C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000082275566 643291499 /nfs/dbraw/zinc/29/14/99/643291499.db2.gz FKDFYKBTNZYAJE-DUXPYHPUSA-N 1 2 227.267 2.387 20 0 BEADLO Clc1cccc(NCCn2cc[nH+]c2)n1 ZINC000082461194 643317630 /nfs/dbraw/zinc/31/76/30/643317630.db2.gz LVNGABITYCPBDG-UHFFFAOYSA-N 1 2 222.679 2.044 20 0 BEADLO CCCCOC(=O)C[N@@H+]1CCS[C@H](CC)C1 ZINC000076072185 643476950 /nfs/dbraw/zinc/47/69/50/643476950.db2.gz NNLMBBOBLKMHLP-LLVKDONJSA-N 1 2 245.388 2.157 20 0 BEADLO CCCCOC(=O)C[N@H+]1CCS[C@H](CC)C1 ZINC000076072185 643476954 /nfs/dbraw/zinc/47/69/54/643476954.db2.gz NNLMBBOBLKMHLP-LLVKDONJSA-N 1 2 245.388 2.157 20 0 BEADLO CSCCC[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000082784080 643525180 /nfs/dbraw/zinc/52/51/80/643525180.db2.gz OYMDJZDXDLWPMT-SECBINFHSA-N 1 2 233.377 2.059 20 0 BEADLO Cc1cc(C)c(C(=O)NC/C=C/Cl)c(C)[nH+]1 ZINC000891195653 643545132 /nfs/dbraw/zinc/54/51/32/643545132.db2.gz JZALRQCUXOTZEE-SNAWJCMRSA-N 1 2 238.718 2.489 20 0 BEADLO Cc1ccc(C[NH2+]Cc2nccn2C(F)F)o1 ZINC000049948423 643564598 /nfs/dbraw/zinc/56/45/98/643564598.db2.gz TUPUMAYCVXJZIA-UHFFFAOYSA-N 1 2 241.241 2.469 20 0 BEADLO CCn1c[nH+]cc1CNc1ccc(F)nc1 ZINC000234203767 643580131 /nfs/dbraw/zinc/58/01/31/643580131.db2.gz RACDKSBFYNYICM-UHFFFAOYSA-N 1 2 220.251 2.049 20 0 BEADLO CCCCOC(=O)[C@H](C)[N@@H+]1CCS[C@H](C)C1 ZINC000160583855 643692495 /nfs/dbraw/zinc/69/24/95/643692495.db2.gz AXYLYBDMFUFTST-MNOVXSKESA-N 1 2 245.388 2.156 20 0 BEADLO CCCCOC(=O)[C@H](C)[N@H+]1CCS[C@H](C)C1 ZINC000160583855 643692497 /nfs/dbraw/zinc/69/24/97/643692497.db2.gz AXYLYBDMFUFTST-MNOVXSKESA-N 1 2 245.388 2.156 20 0 BEADLO C/C(=C\C(=O)OCc1c[nH+]cn1C)C(C)(C)C ZINC000085987295 643880229 /nfs/dbraw/zinc/88/02/29/643880229.db2.gz UKRFPWJNWGRZKQ-UXBLZVDNSA-N 1 2 236.315 2.456 20 0 BEADLO CC(C)(C)CC(=O)OCc1ccc(N)[nH+]c1 ZINC000922179498 643893683 /nfs/dbraw/zinc/89/36/83/643893683.db2.gz KZMUNKGJICVGCI-UHFFFAOYSA-N 1 2 222.288 2.143 20 0 BEADLO C[C@H](CC(=O)OCc1ccc[nH+]c1N)C1CC1 ZINC000922387958 643982901 /nfs/dbraw/zinc/98/29/01/643982901.db2.gz YJBAUGJFYGABRB-SECBINFHSA-N 1 2 234.299 2.143 20 0 BEADLO CCC/C(C)=C/C(=O)OCc1ccc(N)[nH+]c1 ZINC000922384040 643984167 /nfs/dbraw/zinc/98/41/67/643984167.db2.gz ZVWPIMNUVVBNNZ-JXMROGBWSA-N 1 2 234.299 2.453 20 0 BEADLO C[C@H](C(=O)OCc1ccc[nH+]c1N)C(C)(C)C ZINC000922461314 643998377 /nfs/dbraw/zinc/99/83/77/643998377.db2.gz LTFJGJZENDXPMQ-SECBINFHSA-N 1 2 236.315 2.389 20 0 BEADLO Nc1ccc(COC(=O)[C@H]2[C@@H]3CCCC[C@@H]32)c[nH+]1 ZINC000922511716 644009582 /nfs/dbraw/zinc/00/95/82/644009582.db2.gz KZQGTXSFDUMTLV-PJXYFTJBSA-N 1 2 246.310 2.143 20 0 BEADLO Cn1ccc(C[NH2+][C@H](c2ccccn2)C2CC2)n1 ZINC000922584810 644033817 /nfs/dbraw/zinc/03/38/17/644033817.db2.gz AUBHPAASCPSOMP-AWEZNQCLSA-N 1 2 242.326 2.056 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@@H](c2ccccn2)C2CC2)n1 ZINC000922583123 644034347 /nfs/dbraw/zinc/03/43/47/644034347.db2.gz UIDGAQTWBOVKON-CQSZACIVSA-N 1 2 242.326 2.354 20 0 BEADLO c1cc(C[NH2+][C@@H](c2ncccn2)C2CC2)co1 ZINC000922581878 644034622 /nfs/dbraw/zinc/03/46/22/644034622.db2.gz WVHRKALXNCLBES-GFCCVEGCSA-N 1 2 229.283 2.311 20 0 BEADLO c1cc(C[NH2+][C@H](c2ccccn2)C2CC2)n[nH]1 ZINC000922587299 644035342 /nfs/dbraw/zinc/03/53/42/644035342.db2.gz YMUVXYMSKIUKKV-ZDUSSCGKSA-N 1 2 228.299 2.046 20 0 BEADLO Cn1ccnc1C[NH2+][C@H](c1ccccn1)C1CC1 ZINC000922587136 644035405 /nfs/dbraw/zinc/03/54/05/644035405.db2.gz WUZQDEMBNRFIDB-AWEZNQCLSA-N 1 2 242.326 2.056 20 0 BEADLO C[C@H]1CCC[C@@H]1C(=O)OCc1ccc(N)[nH+]c1 ZINC000922606071 644040737 /nfs/dbraw/zinc/04/07/37/644040737.db2.gz VDTSCBGGGRUPIV-ONGXEEELSA-N 1 2 234.299 2.143 20 0 BEADLO Nc1ccc(COC(=O)C23CCC(CC2)C3)c[nH+]1 ZINC000922604430 644041386 /nfs/dbraw/zinc/04/13/86/644041386.db2.gz VPCFKIQQXQWPOJ-UHFFFAOYSA-N 1 2 246.310 2.287 20 0 BEADLO CC(C)C(C)(C)C(=O)OCc1ccc(N)[nH+]c1 ZINC000922635198 644046959 /nfs/dbraw/zinc/04/69/59/644046959.db2.gz QADYKNKTEDXWQJ-UHFFFAOYSA-N 1 2 236.315 2.389 20 0 BEADLO CC(C)n1ncnc1C[NH2+]C(C)(C)/C=C/Cl ZINC000922646100 644051028 /nfs/dbraw/zinc/05/10/28/644051028.db2.gz YJNCQNGCSCBCFB-AATRIKPKSA-N 1 2 242.754 2.480 20 0 BEADLO Cc1ncoc1C[NH2+]Cc1ncc(C)cc1C ZINC000922736990 644077584 /nfs/dbraw/zinc/07/75/84/644077584.db2.gz HMSKYYXRYGDPID-UHFFFAOYSA-N 1 2 231.299 2.285 20 0 BEADLO CC/C(C)=C/C(=O)OCc1ccc(N)[nH+]c1 ZINC000922777445 644092601 /nfs/dbraw/zinc/09/26/01/644092601.db2.gz SPOADZOPGOEVAN-RMKNXTFCSA-N 1 2 220.272 2.063 20 0 BEADLO Nc1ccc(COC(=O)/C=C/C2CCCC2)c[nH+]1 ZINC000922840150 644116363 /nfs/dbraw/zinc/11/63/63/644116363.db2.gz UYNQMZFZSOFHLX-SOFGYWHQSA-N 1 2 246.310 2.453 20 0 BEADLO C[C@H]1CSCC[N@H+](Cn2cc(Cl)cn2)C1 ZINC000192179879 644135201 /nfs/dbraw/zinc/13/52/01/644135201.db2.gz YJZBGXOIQVTYOJ-SECBINFHSA-N 1 2 245.779 2.179 20 0 BEADLO C[C@H]1CSCC[N@@H+](Cn2cc(Cl)cn2)C1 ZINC000192179879 644135206 /nfs/dbraw/zinc/13/52/06/644135206.db2.gz YJZBGXOIQVTYOJ-SECBINFHSA-N 1 2 245.779 2.179 20 0 BEADLO C[C@@H]1CCC[N@H+](Cn2ncsc2=S)C1 ZINC000073878953 644142130 /nfs/dbraw/zinc/14/21/30/644142130.db2.gz VODUGHZGURCHLC-MRVPVSSYSA-N 1 2 229.374 2.363 20 0 BEADLO C[C@@H]1CCC[N@@H+](Cn2ncsc2=S)C1 ZINC000073878953 644142136 /nfs/dbraw/zinc/14/21/36/644142136.db2.gz VODUGHZGURCHLC-MRVPVSSYSA-N 1 2 229.374 2.363 20 0 BEADLO CC(C)(C)[C@@H]1C[C@H]1C(=O)OCc1ccc[nH+]c1N ZINC000922908577 644187342 /nfs/dbraw/zinc/18/73/42/644187342.db2.gz LIHMWCUJBDEQMX-GHMZBOCLSA-N 1 2 248.326 2.389 20 0 BEADLO Nc1ccc(COC(=O)[C@]23C[C@H]2CCCC3)c[nH+]1 ZINC000922911283 644187639 /nfs/dbraw/zinc/18/76/39/644187639.db2.gz DKEWBCWTHUKQQY-BXUZGUMPSA-N 1 2 246.310 2.287 20 0 BEADLO C[C@@H]1CC=CC[C@H]1C(=O)OCc1ccc(N)[nH+]c1 ZINC000922940978 644196226 /nfs/dbraw/zinc/19/62/26/644196226.db2.gz JSBVUTIZNIDNBG-ZYHUDNBSSA-N 1 2 246.310 2.309 20 0 BEADLO CCc1cnc(C[NH2+]Cc2cncc(O)c2)s1 ZINC000922975712 644205403 /nfs/dbraw/zinc/20/54/03/644205403.db2.gz JCSGEEVPCHAYKY-UHFFFAOYSA-N 1 2 249.339 2.096 20 0 BEADLO CCc1onc(C)c1C[NH2+]Cc1ocnc1C ZINC000922980806 644215038 /nfs/dbraw/zinc/21/50/38/644215038.db2.gz DBQMOFULRMRKAC-UHFFFAOYSA-N 1 2 235.287 2.132 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC[C@H](C)C(C)(C)C ZINC000923333859 644354221 /nfs/dbraw/zinc/35/42/21/644354221.db2.gz YFRBIZQVIOXOCT-VIFPVBQESA-N 1 2 237.347 2.059 20 0 BEADLO CC[N@@H+](Cc1ccccn1)Cn1cc[nH]c1=S ZINC000084481270 644425432 /nfs/dbraw/zinc/42/54/32/644425432.db2.gz PJLWIKUGXLDREN-UHFFFAOYSA-N 1 2 248.355 2.420 20 0 BEADLO CC[N@H+](Cc1ccccn1)Cn1cc[nH]c1=S ZINC000084481270 644425436 /nfs/dbraw/zinc/42/54/36/644425436.db2.gz PJLWIKUGXLDREN-UHFFFAOYSA-N 1 2 248.355 2.420 20 0 BEADLO CC(=O)C1CC[NH+](Cc2nc(C)cs2)CC1 ZINC000087376991 644491173 /nfs/dbraw/zinc/49/11/73/644491173.db2.gz FJJSUPIXQSUEKM-UHFFFAOYSA-N 1 2 238.356 2.253 20 0 BEADLO C[C@H](c1ccccc1)[C@H](C)[NH2+][C@H]1CCOC1=O ZINC000245456617 644525956 /nfs/dbraw/zinc/52/59/56/644525956.db2.gz BLBCZHDKRBIHSU-GVXVVHGQSA-N 1 2 233.311 2.084 20 0 BEADLO CCOCCCO[NH+]=C(N)c1ccccc1C ZINC000742348394 644565175 /nfs/dbraw/zinc/56/51/75/644565175.db2.gz DZTXDVCZCPIVLY-UHFFFAOYSA-N 1 2 236.315 2.268 20 0 BEADLO CCn1c[nH+]cc1CNc1ccc2c(c1)CCO2 ZINC000090171509 644583230 /nfs/dbraw/zinc/58/32/30/644583230.db2.gz HKVMWXXQRPPBQK-UHFFFAOYSA-N 1 2 243.310 2.450 20 0 BEADLO Cc1cc(NCc2ccon2)nc(C2CC2)[nH+]1 ZINC000747622435 644584571 /nfs/dbraw/zinc/58/45/71/644584571.db2.gz ZPINVCZVVUJSQG-UHFFFAOYSA-N 1 2 230.271 2.263 20 0 BEADLO CCCCN(CC)c1nccn2c[nH+]cc12 ZINC000891443424 711522694 /nfs/dbraw/zinc/52/26/94/711522694.db2.gz ZHRHVUDYLAKEJT-UHFFFAOYSA-N 1 2 218.304 2.356 20 0 BEADLO CCOCC[N@H+](C)Cc1ncc(C(C)C)o1 ZINC000093313362 644686769 /nfs/dbraw/zinc/68/67/69/644686769.db2.gz SWHINBPHKRGYAG-UHFFFAOYSA-N 1 2 226.320 2.266 20 0 BEADLO CCOCC[N@@H+](C)Cc1ncc(C(C)C)o1 ZINC000093313362 644686773 /nfs/dbraw/zinc/68/67/73/644686773.db2.gz SWHINBPHKRGYAG-UHFFFAOYSA-N 1 2 226.320 2.266 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2CC[C@H](C)C2)c(C)c[nH+]1 ZINC000782059442 644738905 /nfs/dbraw/zinc/73/89/05/644738905.db2.gz WYGYNHHYYTWDDO-JOYOIKCWSA-N 1 2 247.342 2.430 20 0 BEADLO CCC[C@H](C)C(=O)OCCCn1cc[nH+]c1 ZINC000782985601 644749723 /nfs/dbraw/zinc/74/97/23/644749723.db2.gz IZKAMGRFBJOHRM-NSHDSACASA-N 1 2 224.304 2.253 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)C[C@@H]1C=CCCC1 ZINC000793240427 644802037 /nfs/dbraw/zinc/80/20/37/644802037.db2.gz ZVOVTRUIGSTSQC-GFCCVEGCSA-N 1 2 248.326 2.252 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)C[C@H]1C=CCCC1 ZINC000793240430 644802100 /nfs/dbraw/zinc/80/21/00/644802100.db2.gz ZVOVTRUIGSTSQC-LBPRGKRZSA-N 1 2 248.326 2.252 20 0 BEADLO COC[C@H]([NH3+])c1nc([C@@H]2CCC[C@H](C)C2)no1 ZINC000251857839 644828180 /nfs/dbraw/zinc/82/81/80/644828180.db2.gz PPFVIYZVEXINHV-AEJSXWLSSA-N 1 2 239.319 2.010 20 0 BEADLO CC[C@H](C)[C@H]([NH2+][C@@H]1CS[C@H](C)C1)C(=O)OC ZINC000251934299 644832576 /nfs/dbraw/zinc/83/25/76/644832576.db2.gz RRJPEPMQXZPOFS-VLEAKVRGSA-N 1 2 245.388 2.058 20 0 BEADLO O[C@@H](CC1CCCC1)C[N@@H+]1Cc2ccncc2C1 ZINC000809564682 644892352 /nfs/dbraw/zinc/89/23/52/644892352.db2.gz CRXUVDKMCUPIOM-HNNXBMFYSA-N 1 2 246.354 2.338 20 0 BEADLO O[C@@H](CC1CCCC1)C[N@H+]1Cc2ccncc2C1 ZINC000809564682 644892355 /nfs/dbraw/zinc/89/23/55/644892355.db2.gz CRXUVDKMCUPIOM-HNNXBMFYSA-N 1 2 246.354 2.338 20 0 BEADLO CNc1cc(N2CC[C@@H](C)[C@H](C)C2)nc[nH+]1 ZINC000253070369 644933909 /nfs/dbraw/zinc/93/39/09/644933909.db2.gz MHVJKHFUNYOTBE-NXEZZACHSA-N 1 2 220.320 2.001 20 0 BEADLO CNc1cc(N2CC[C@@H](C)[C@H](C)C2)[nH+]cn1 ZINC000253070369 644933913 /nfs/dbraw/zinc/93/39/13/644933913.db2.gz MHVJKHFUNYOTBE-NXEZZACHSA-N 1 2 220.320 2.001 20 0 BEADLO Cc1cc(CNC(=O)C=C2CCC2)cc(C)[nH+]1 ZINC000817459175 644983912 /nfs/dbraw/zinc/98/39/12/644983912.db2.gz RJARNEQFZSGHSP-UHFFFAOYSA-N 1 2 230.311 2.425 20 0 BEADLO CC(C)C[C@H]1CCCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC000830020707 645114675 /nfs/dbraw/zinc/11/46/75/645114675.db2.gz DPYVFZNASTVXMM-GFCCVEGCSA-N 1 2 249.358 2.379 20 0 BEADLO Cc1nonc1[C@@H](C)[NH2+]Cc1cnc(C)cc1C ZINC000926551075 645273769 /nfs/dbraw/zinc/27/37/69/645273769.db2.gz PWFFXIYRGHXSNP-SNVBAGLBSA-N 1 2 246.314 2.241 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@@H+]1Cc1cnc(C)cn1 ZINC000844386919 645327208 /nfs/dbraw/zinc/32/72/08/645327208.db2.gz PWAMPUCZGRCULH-ZDUSSCGKSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@H+]1Cc1cnc(C)cn1 ZINC000844386919 645327213 /nfs/dbraw/zinc/32/72/13/645327213.db2.gz PWAMPUCZGRCULH-ZDUSSCGKSA-N 1 2 249.358 2.174 20 0 BEADLO Cc1cc(N)nc(SCc2cscn2)[nH+]1 ZINC000105831176 645358290 /nfs/dbraw/zinc/35/82/90/645358290.db2.gz NRZIRGPPUWMSBW-UHFFFAOYSA-N 1 2 238.341 2.116 20 0 BEADLO C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H]2F)c2ncnn21 ZINC000926783885 645430471 /nfs/dbraw/zinc/43/04/71/645430471.db2.gz CHSAKCCRMSAKNH-YTWAJWBKSA-N 1 2 238.310 2.154 20 0 BEADLO C[C@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@@H]2F)c2ncnn21 ZINC000926783884 645431170 /nfs/dbraw/zinc/43/11/70/645431170.db2.gz CHSAKCCRMSAKNH-UKKRHICBSA-N 1 2 238.310 2.154 20 0 BEADLO Cc1cc(N[C@@H]2COC[C@H]2C)c[nH+]c1C ZINC000926854614 645456596 /nfs/dbraw/zinc/45/65/96/645456596.db2.gz DGMGBWROZDEETD-BXKDBHETSA-N 1 2 206.289 2.145 20 0 BEADLO CC(=O)C[N@@H+]1CC[C@]2(C)[C@H](C1)C2(Cl)Cl ZINC000878571040 645817405 /nfs/dbraw/zinc/81/74/05/645817405.db2.gz KZRSRBGMHSUEEJ-DTWKUNHWSA-N 1 2 236.142 2.091 20 0 BEADLO CC(=O)C[N@H+]1CC[C@]2(C)[C@H](C1)C2(Cl)Cl ZINC000878571040 645817409 /nfs/dbraw/zinc/81/74/09/645817409.db2.gz KZRSRBGMHSUEEJ-DTWKUNHWSA-N 1 2 236.142 2.091 20 0 BEADLO CCn1cc(C[N@H+](C)Cc2ccc(C)cc2)nn1 ZINC000883996036 645865319 /nfs/dbraw/zinc/86/53/19/645865319.db2.gz FRVDYDQCDZGTDY-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1cc(C[N@@H+](C)Cc2ccc(C)cc2)nn1 ZINC000883996036 645865329 /nfs/dbraw/zinc/86/53/29/645865329.db2.gz FRVDYDQCDZGTDY-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO C[C@@H](c1ccc(F)nc1)[N@@H+]1CCc2nc[nH]c2C1 ZINC000929069129 645933156 /nfs/dbraw/zinc/93/31/56/645933156.db2.gz HDGFLZCDECVKKH-VIFPVBQESA-N 1 2 246.289 2.063 20 0 BEADLO C[C@@H](c1ccc(F)nc1)[N@H+]1CCc2nc[nH]c2C1 ZINC000929069129 645933162 /nfs/dbraw/zinc/93/31/62/645933162.db2.gz HDGFLZCDECVKKH-VIFPVBQESA-N 1 2 246.289 2.063 20 0 BEADLO C[C@H](c1nc([C@@H](C)C2CC2)no1)[NH+](C)C ZINC000923957282 645965650 /nfs/dbraw/zinc/96/56/50/645965650.db2.gz SJXUSLQJGFBBRU-JGVFFNPUSA-N 1 2 209.293 2.206 20 0 BEADLO CC(C)CCNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000929159816 645979085 /nfs/dbraw/zinc/97/90/85/645979085.db2.gz QUIRQCGAUXDVQS-UHFFFAOYSA-N 1 2 231.299 2.339 20 0 BEADLO CC[C@H](C)Cc1noc([C@@H](C)[NH+](C)C)n1 ZINC000924152424 645998173 /nfs/dbraw/zinc/99/81/73/645998173.db2.gz KNAYVIKASCOWIR-DTWKUNHWSA-N 1 2 211.309 2.281 20 0 BEADLO O=C(NC1CCCC1)c1cc2c[nH+]ccc2[nH]1 ZINC000929197137 645998514 /nfs/dbraw/zinc/99/85/14/645998514.db2.gz QIMZUXNSULGOLZ-UHFFFAOYSA-N 1 2 229.283 2.235 20 0 BEADLO O=C(OCCn1cc[nH+]c1)[C@H]1CC[C@@H]2C[C@@H]2CC1 ZINC000924369216 646025685 /nfs/dbraw/zinc/02/56/85/646025685.db2.gz LDACCZMFMHGBPJ-CLLJXQQHSA-N 1 2 248.326 2.253 20 0 BEADLO CC(C)C[N@H+](Cc1nncs1)C1CC1 ZINC000929256722 646038816 /nfs/dbraw/zinc/03/88/16/646038816.db2.gz HQRLODQGOMTZTG-UHFFFAOYSA-N 1 2 211.334 2.159 20 0 BEADLO CC(C)C[N@@H+](Cc1nncs1)C1CC1 ZINC000929256722 646038818 /nfs/dbraw/zinc/03/88/18/646038818.db2.gz HQRLODQGOMTZTG-UHFFFAOYSA-N 1 2 211.334 2.159 20 0 BEADLO COc1nnc(C[N@H+](CC(C)C)C2CC2)s1 ZINC000929256986 646039317 /nfs/dbraw/zinc/03/93/17/646039317.db2.gz LIGQUMHVBBBYEU-UHFFFAOYSA-N 1 2 241.360 2.167 20 0 BEADLO COc1nnc(C[N@@H+](CC(C)C)C2CC2)s1 ZINC000929256986 646039320 /nfs/dbraw/zinc/03/93/20/646039320.db2.gz LIGQUMHVBBBYEU-UHFFFAOYSA-N 1 2 241.360 2.167 20 0 BEADLO Cc1nonc1[C@@H](C)[NH2+]Cc1ccc(F)cc1 ZINC000924525324 646046936 /nfs/dbraw/zinc/04/69/36/646046936.db2.gz NBPGGVWULXRJQL-MRVPVSSYSA-N 1 2 235.262 2.368 20 0 BEADLO COC/C(C)=C/C[N@@H+]1CCC[C@H](c2ccn[nH]2)C1 ZINC000929297103 646070510 /nfs/dbraw/zinc/07/05/10/646070510.db2.gz UCSWIHLPEXZBBB-UWUHSAQLSA-N 1 2 249.358 2.182 20 0 BEADLO COC/C(C)=C/C[N@H+]1CCC[C@H](c2ccn[nH]2)C1 ZINC000929297103 646070516 /nfs/dbraw/zinc/07/05/16/646070516.db2.gz UCSWIHLPEXZBBB-UWUHSAQLSA-N 1 2 249.358 2.182 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCCc2c1cnn2C)c1ncco1 ZINC000924650909 646085772 /nfs/dbraw/zinc/08/57/72/646085772.db2.gz MLOQQBZVSZCLFO-MWLCHTKSSA-N 1 2 246.314 2.136 20 0 BEADLO C[N@H+](CCc1ccns1)Cc1cscn1 ZINC000929345190 646087852 /nfs/dbraw/zinc/08/78/52/646087852.db2.gz ZHAAWGGPWACONP-UHFFFAOYSA-N 1 2 239.369 2.274 20 0 BEADLO C[N@@H+](CCc1ccns1)Cc1cscn1 ZINC000929345190 646087854 /nfs/dbraw/zinc/08/78/54/646087854.db2.gz ZHAAWGGPWACONP-UHFFFAOYSA-N 1 2 239.369 2.274 20 0 BEADLO CCc1nc(C[NH2+][C@H](C)c2ccnnc2)cs1 ZINC000925000313 646155896 /nfs/dbraw/zinc/15/58/96/646155896.db2.gz SGDNFRUIQPDVOD-SECBINFHSA-N 1 2 248.355 2.346 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1ccccc1CF ZINC000929506179 646156096 /nfs/dbraw/zinc/15/60/96/646156096.db2.gz YNVVRPISFSXDIT-UHFFFAOYSA-N 1 2 239.290 2.151 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1ccccc1CF ZINC000929506179 646156101 /nfs/dbraw/zinc/15/61/01/646156101.db2.gz YNVVRPISFSXDIT-UHFFFAOYSA-N 1 2 239.290 2.151 20 0 BEADLO C[N@H+](Cc1coc(C(C)(C)C)n1)[C@@H]1CCOC1 ZINC000929600499 646193029 /nfs/dbraw/zinc/19/30/29/646193029.db2.gz IMVMHAUOMZTEHK-LLVKDONJSA-N 1 2 238.331 2.193 20 0 BEADLO C[N@@H+](Cc1coc(C(C)(C)C)n1)[C@@H]1CCOC1 ZINC000929600499 646193038 /nfs/dbraw/zinc/19/30/38/646193038.db2.gz IMVMHAUOMZTEHK-LLVKDONJSA-N 1 2 238.331 2.193 20 0 BEADLO C[C@@H]([NH2+][C@H](CCO)c1ccccc1)c1ncco1 ZINC000925132970 646193733 /nfs/dbraw/zinc/19/37/33/646193733.db2.gz NECRRRJLXDQEBY-DGCLKSJQSA-N 1 2 246.310 2.449 20 0 BEADLO Cc1cn(C)nc1C[N@H+](C)Cc1cccc(O)c1 ZINC000929779164 646309912 /nfs/dbraw/zinc/30/99/12/646309912.db2.gz WNEMPYNHUACPDH-UHFFFAOYSA-N 1 2 245.326 2.066 20 0 BEADLO Cc1cn(C)nc1C[N@@H+](C)Cc1cccc(O)c1 ZINC000929779164 646309926 /nfs/dbraw/zinc/30/99/26/646309926.db2.gz WNEMPYNHUACPDH-UHFFFAOYSA-N 1 2 245.326 2.066 20 0 BEADLO C[C@@H]([N@H+](C)Cc1nncs1)C1(C)CC1 ZINC000929816679 646335064 /nfs/dbraw/zinc/33/50/64/646335064.db2.gz KVQNHZBIFOFZPP-MRVPVSSYSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]([N@@H+](C)Cc1nncs1)C1(C)CC1 ZINC000929816679 646335070 /nfs/dbraw/zinc/33/50/70/646335070.db2.gz KVQNHZBIFOFZPP-MRVPVSSYSA-N 1 2 211.334 2.159 20 0 BEADLO Cc1cc(C)nc(C[N@@H+]2CCOCC23CCC3)c1 ZINC000930066230 646418054 /nfs/dbraw/zinc/41/80/54/646418054.db2.gz ZGLAVRHEINWIBR-UHFFFAOYSA-N 1 2 246.354 2.453 20 0 BEADLO Cc1cc(C)nc(C[N@H+]2CCOCC23CCC3)c1 ZINC000930066230 646418057 /nfs/dbraw/zinc/41/80/57/646418057.db2.gz ZGLAVRHEINWIBR-UHFFFAOYSA-N 1 2 246.354 2.453 20 0 BEADLO CCc1ncc(C[N@@H+]2CCOC[C@]2(C)CC)o1 ZINC000930124505 646447368 /nfs/dbraw/zinc/44/73/68/646447368.db2.gz VQBLAGMFSYGQSC-ZDUSSCGKSA-N 1 2 238.331 2.238 20 0 BEADLO CCc1ncc(C[N@H+]2CCOC[C@]2(C)CC)o1 ZINC000930124505 646447369 /nfs/dbraw/zinc/44/73/69/646447369.db2.gz VQBLAGMFSYGQSC-ZDUSSCGKSA-N 1 2 238.331 2.238 20 0 BEADLO Fc1cncc(F)c1C[N@H+]1CC[C@@H](C(F)F)C1 ZINC000930127595 646449988 /nfs/dbraw/zinc/44/99/88/646449988.db2.gz VEEPFLCWRJDQHL-SSDOTTSWSA-N 1 2 248.223 2.447 20 0 BEADLO Fc1cncc(F)c1C[N@@H+]1CC[C@@H](C(F)F)C1 ZINC000930127595 646449991 /nfs/dbraw/zinc/44/99/91/646449991.db2.gz VEEPFLCWRJDQHL-SSDOTTSWSA-N 1 2 248.223 2.447 20 0 BEADLO CCc1ncc(C[NH+]2CC3(C2)CC(F)(F)C3)o1 ZINC000930129532 646451408 /nfs/dbraw/zinc/45/14/08/646451408.db2.gz WWNQTQJOYBIROV-UHFFFAOYSA-N 1 2 242.269 2.468 20 0 BEADLO CC[C@@H](CSC)[N@H+](C)Cc1nncs1 ZINC000930178785 646479952 /nfs/dbraw/zinc/47/99/52/646479952.db2.gz ATDLKMQCNCWDSR-QMMMGPOBSA-N 1 2 231.390 2.112 20 0 BEADLO CC[C@@H](CSC)[N@@H+](C)Cc1nncs1 ZINC000930178785 646479955 /nfs/dbraw/zinc/47/99/55/646479955.db2.gz ATDLKMQCNCWDSR-QMMMGPOBSA-N 1 2 231.390 2.112 20 0 BEADLO COc1ccc([C@@H](C)[NH2+]Cc2nncs2)cc1 ZINC000930189597 646484086 /nfs/dbraw/zinc/48/40/86/646484086.db2.gz JZLDCSLIOYZOHC-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO C[C@H](Cc1ccccn1)[NH2+]C1(C(F)F)CC1 ZINC000926366393 646627041 /nfs/dbraw/zinc/62/70/41/646627041.db2.gz CMTUYTWEMOVONN-SECBINFHSA-N 1 2 226.270 2.400 20 0 BEADLO Cc1ccc(NC(=O)C[C@@H]([NH3+])C(F)F)c(F)c1 ZINC000724740891 711609672 /nfs/dbraw/zinc/60/96/72/711609672.db2.gz RHDRUGCNDFPMQP-MRVPVSSYSA-N 1 2 246.232 2.055 20 0 BEADLO [NH3+][C@@H](CC(=O)Nc1ccc(Cl)cc1)C(F)F ZINC000724738603 711609728 /nfs/dbraw/zinc/60/97/28/711609728.db2.gz IDZOUPATOIAHLD-QMMMGPOBSA-N 1 2 248.660 2.261 20 0 BEADLO Cc1c(F)cccc1NC(=O)C[C@@H]([NH3+])C(F)F ZINC000724739913 711610097 /nfs/dbraw/zinc/61/00/97/711610097.db2.gz ORPMSJGPDWFWNJ-MRVPVSSYSA-N 1 2 246.232 2.055 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1c1cc(NC)[nH+]cn1 ZINC000136785507 711744297 /nfs/dbraw/zinc/74/42/97/711744297.db2.gz DFCIPNRCBPARFM-VHSXEESVSA-N 1 2 220.320 2.286 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1c1cc(NC)nc[nH+]1 ZINC000136785507 711744299 /nfs/dbraw/zinc/74/42/99/711744299.db2.gz DFCIPNRCBPARFM-VHSXEESVSA-N 1 2 220.320 2.286 20 0 BEADLO C[C@@H](O)C[N@H+](Cc1scnc1Cl)C1CC1 ZINC000721954692 711947704 /nfs/dbraw/zinc/94/77/04/711947704.db2.gz JZKNANQLIUHXTH-SSDOTTSWSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H](O)C[N@@H+](Cc1scnc1Cl)C1CC1 ZINC000721954692 711947707 /nfs/dbraw/zinc/94/77/07/711947707.db2.gz JZKNANQLIUHXTH-SSDOTTSWSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H]1C[C@H](O)CC[N@@H+]1Cc1cnc(Cl)s1 ZINC000705349268 712129648 /nfs/dbraw/zinc/12/96/48/712129648.db2.gz VVPMYMSDMRJGCY-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H]1C[C@H](O)CC[N@H+]1Cc1cnc(Cl)s1 ZINC000705349268 712129651 /nfs/dbraw/zinc/12/96/51/712129651.db2.gz VVPMYMSDMRJGCY-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO CC[N@H+](C/C(Cl)=C/Cl)[C@@H]1CCOC1 ZINC000379387809 712380146 /nfs/dbraw/zinc/38/01/46/712380146.db2.gz IGBFIXVXVWXNJL-BZJXQOFCSA-N 1 2 224.131 2.416 20 0 BEADLO CC[N@@H+](C/C(Cl)=C/Cl)[C@@H]1CCOC1 ZINC000379387809 712380147 /nfs/dbraw/zinc/38/01/47/712380147.db2.gz IGBFIXVXVWXNJL-BZJXQOFCSA-N 1 2 224.131 2.416 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@H](C)c1cncs1 ZINC000716459973 712562676 /nfs/dbraw/zinc/56/26/76/712562676.db2.gz CCXZXBYYKAQPBM-MRVPVSSYSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1nc(NC[C@@H]2C[C@@H]2[C@H]2C[C@@H]2C)cc[nH+]1 ZINC000716591650 712564505 /nfs/dbraw/zinc/56/45/05/712564505.db2.gz LNUYBWXFEDNNGG-VGDYDELISA-N 1 2 217.316 2.489 20 0 BEADLO CC1(C)CO[C@H](CCNc2cc[nH+]cc2F)C1 ZINC000717335516 712649134 /nfs/dbraw/zinc/64/91/34/712649134.db2.gz VBMBFWFXEIENPB-SNVBAGLBSA-N 1 2 238.306 2.260 20 0 BEADLO Cc1conc1C[NH2+][C@@H](C)c1cccnc1 ZINC000720406214 712839863 /nfs/dbraw/zinc/83/98/63/712839863.db2.gz GECBNGVEZBHRRW-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO CC[NH2+]Cc1noc(C2=C(C)CCC2)n1 ZINC000381488403 710644805 /nfs/dbraw/zinc/64/48/05/710644805.db2.gz KYTXHHSAVJZZKX-UHFFFAOYSA-N 1 2 207.277 2.137 20 0 BEADLO CCC[C@H]([NH2+][C@@H]1CC12CCC2)C(=O)OCC ZINC000721220459 712899196 /nfs/dbraw/zinc/89/91/96/712899196.db2.gz JJJFWYMSZOXLHP-WDEREUQCSA-N 1 2 225.332 2.250 20 0 BEADLO CC[NH2+]Cc1noc(/C=C\C(C)(C)C)n1 ZINC000381637734 710665789 /nfs/dbraw/zinc/66/57/89/710665789.db2.gz XPOBKHMUMWQGDL-SREVYHEPSA-N 1 2 209.293 2.238 20 0 BEADLO CCN(C(=O)C[C@@H]([NH3+])C(F)F)C1CCCCC1 ZINC000724757897 710746980 /nfs/dbraw/zinc/74/69/80/710746980.db2.gz HDJVKXHYBUNCRR-SNVBAGLBSA-N 1 2 248.317 2.150 20 0 BEADLO C[C@@H]([NH2+]Cc1cnsn1)c1ccccc1 ZINC000399811129 710912815 /nfs/dbraw/zinc/91/28/15/710912815.db2.gz DKHDLHFGWWJWNS-SECBINFHSA-N 1 2 219.313 2.389 20 0 BEADLO Cc1ccnc(C[NH2+][C@H](C)c2nccnc2C)c1 ZINC000385829999 711017872 /nfs/dbraw/zinc/01/78/72/711017872.db2.gz QHIXFQHWQFQBHV-GFCCVEGCSA-N 1 2 242.326 2.339 20 0 BEADLO CCC[N@H+](CCC1OCCCO1)CC(F)F ZINC000387304979 711043011 /nfs/dbraw/zinc/04/30/11/711043011.db2.gz QAJDHNPRHFYDEQ-UHFFFAOYSA-N 1 2 237.290 2.117 20 0 BEADLO CCC[N@@H+](CCC1OCCCO1)CC(F)F ZINC000387304979 711043013 /nfs/dbraw/zinc/04/30/13/711043013.db2.gz QAJDHNPRHFYDEQ-UHFFFAOYSA-N 1 2 237.290 2.117 20 0 BEADLO FC(F)C1([NH2+]C[C@@H]2CCC=CO2)CC1 ZINC000389213249 711073179 /nfs/dbraw/zinc/07/31/79/711073179.db2.gz JIMISSRXOAYURW-QMMMGPOBSA-N 1 2 203.232 2.066 20 0 BEADLO CCCCOC(=O)[C@@H](C)[NH2+]C1(C2CC2)CC1 ZINC000390779942 711133522 /nfs/dbraw/zinc/13/35/22/711133522.db2.gz IPWBXXICSSGYIM-SNVBAGLBSA-N 1 2 225.332 2.250 20 0 BEADLO Cc1nc(C[NH2+]Cc2ccc(F)nc2)cs1 ZINC000393769394 711173912 /nfs/dbraw/zinc/17/39/12/711173912.db2.gz DWFFQWXJKRYNBG-UHFFFAOYSA-N 1 2 237.303 2.275 20 0 BEADLO CC[C@@H]([NH2+]Cc1cnn[nH]1)c1ccccc1OC ZINC000398334683 711408551 /nfs/dbraw/zinc/40/85/51/711408551.db2.gz JVYXXFZHBYMILD-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO CC[NH2+]Cc1noc([C@@H](C)C(C)(C)C)n1 ZINC000399083148 711420125 /nfs/dbraw/zinc/42/01/25/711420125.db2.gz SXZRXMRHHIDNOU-MRVPVSSYSA-N 1 2 211.309 2.329 20 0 BEADLO CCc1cc(C[NH2+][C@H](C)c2cscn2)[nH]n1 ZINC000381197151 710607931 /nfs/dbraw/zinc/60/79/31/710607931.db2.gz BJFISDBHMLKZNZ-MRVPVSSYSA-N 1 2 236.344 2.279 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1ncc(Cl)n1C ZINC000381332814 710623791 /nfs/dbraw/zinc/62/37/91/710623791.db2.gz UONYKBKULDBRFB-UHFFFAOYSA-N 1 2 239.706 2.265 20 0 BEADLO Cc1cc(C)c(CNc2nccnc2Cl)c[nH+]1 ZINC000397020969 711374346 /nfs/dbraw/zinc/37/43/46/711374346.db2.gz RKLBVBIXBKFGFC-UHFFFAOYSA-N 1 2 248.717 2.176 20 0 BEADLO Cc1nocc1C[NH2+]Cc1cc(C#N)ccc1F ZINC000397896524 711395356 /nfs/dbraw/zinc/39/53/56/711395356.db2.gz UWOKDWWRPIETNT-UHFFFAOYSA-N 1 2 245.257 2.284 20 0 BEADLO Cc1cc(C)nc(C[NH+]2C[C@@H](C)C(=O)[C@H](C)C2)c1 ZINC000723621516 711526840 /nfs/dbraw/zinc/52/68/40/711526840.db2.gz QTRRCDUYLRHDRA-VXGBXAGGSA-N 1 2 246.354 2.355 20 0 BEADLO Cc1cnc(CNc2cc[nH+]c(C)n2)c(C)c1 ZINC000724025322 711556847 /nfs/dbraw/zinc/55/68/47/711556847.db2.gz VMQGLAPNYWLGKI-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO O=C(Nc1ccccc1-n1cc[nH+]c1)C(F)F ZINC000236142710 711558152 /nfs/dbraw/zinc/55/81/52/711558152.db2.gz DOWGJSFXBOXWPR-UHFFFAOYSA-N 1 2 237.209 2.076 20 0 BEADLO CO[C@@]1(C)C[C@H]1[NH2+]Cc1nc(C(C)(C)C)co1 ZINC000724375279 711576881 /nfs/dbraw/zinc/57/68/81/711576881.db2.gz DEQGBWVBNZXWKV-RNCFNFMXSA-N 1 2 238.331 2.239 20 0 BEADLO COc1ccccc1C[NH2+][C@@H]1CCn2ccnc21 ZINC000382307036 711659013 /nfs/dbraw/zinc/65/90/13/711659013.db2.gz QZFDWHKQDCSXTC-GFCCVEGCSA-N 1 2 243.310 2.126 20 0 BEADLO CC[C@H]1CC[C@H](C)N1c1cc(NC)[nH+]cn1 ZINC000136785556 711744208 /nfs/dbraw/zinc/74/42/08/711744208.db2.gz DFCIPNRCBPARFM-UWVGGRQHSA-N 1 2 220.320 2.286 20 0 BEADLO CC[C@H]1CC[C@H](C)N1c1cc(NC)nc[nH+]1 ZINC000136785556 711744210 /nfs/dbraw/zinc/74/42/10/711744210.db2.gz DFCIPNRCBPARFM-UWVGGRQHSA-N 1 2 220.320 2.286 20 0 BEADLO Cn1c[nH+]cc1CNc1cnn(C2CCCC2)c1 ZINC000722365749 711750439 /nfs/dbraw/zinc/75/04/39/711750439.db2.gz ZYXJUQKHUDIAJB-UHFFFAOYSA-N 1 2 245.330 2.344 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccc(O)c(F)c2)no1 ZINC000232422551 711760672 /nfs/dbraw/zinc/76/06/72/711760672.db2.gz QQAZYBMOZGZMOL-UHFFFAOYSA-N 1 2 236.246 2.118 20 0 BEADLO CC(C)=CC[NH+]1CC(N(C)C(=O)c2ccoc2)C1 ZINC001042475061 711768726 /nfs/dbraw/zinc/76/87/26/711768726.db2.gz HHMHTQJDYPVUJV-UHFFFAOYSA-N 1 2 248.326 2.002 20 0 BEADLO Cc1csc(C(=O)NCc2[nH]c(C)c(C)[nH+]2)c1 ZINC000896910321 711783840 /nfs/dbraw/zinc/78/38/40/711783840.db2.gz QGGAJOUJELICDV-UHFFFAOYSA-N 1 2 249.339 2.326 20 0 BEADLO C[C@H](c1nc(Cc2ccccc2)no1)[NH+](C)C ZINC000923752531 711797764 /nfs/dbraw/zinc/79/77/64/711797764.db2.gz KCYQCKDKZUUOJN-SNVBAGLBSA-N 1 2 231.299 2.283 20 0 BEADLO CCn1cc([C@@H](C)[NH2+][C@@H](C)c2ncc[nH]2)cn1 ZINC000138994388 711839657 /nfs/dbraw/zinc/83/96/57/711839657.db2.gz XFDCNVKJXGBENL-ZJUUUORDSA-N 1 2 233.319 2.038 20 0 BEADLO C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1[NH2+]CC(F)(F)C(F)F ZINC000701034489 712012972 /nfs/dbraw/zinc/01/29/72/712012972.db2.gz JIVGNZURDULPEI-ULAWRXDQSA-N 1 2 243.244 2.288 20 0 BEADLO c1csc(C[NH2+]Cc2cccc3c2OCC3)n1 ZINC000703112327 712066466 /nfs/dbraw/zinc/06/64/66/712066466.db2.gz KNPBKICKURTPIA-UHFFFAOYSA-N 1 2 246.335 2.368 20 0 BEADLO CC[NH2+]Cc1noc([C@@H](C)Oc2ccccc2)n1 ZINC000704260554 712102311 /nfs/dbraw/zinc/10/23/11/712102311.db2.gz NXAGEQVVQLIHBA-SNVBAGLBSA-N 1 2 247.298 2.319 20 0 BEADLO CNc1cc(N[C@H]2CCCC23CC3)nc[nH+]1 ZINC000706568343 712149701 /nfs/dbraw/zinc/14/97/01/712149701.db2.gz IMFJENLIVIQBHQ-VIFPVBQESA-N 1 2 218.304 2.263 20 0 BEADLO CNc1cc(N[C@H]2CCCC23CC3)[nH+]cn1 ZINC000706568343 712149702 /nfs/dbraw/zinc/14/97/02/712149702.db2.gz IMFJENLIVIQBHQ-VIFPVBQESA-N 1 2 218.304 2.263 20 0 BEADLO FC(F)[C@@H]1CC[N@H+](Cc2ccc(Cl)nn2)C1 ZINC000707168269 712166461 /nfs/dbraw/zinc/16/64/61/712166461.db2.gz PLKLEMKMMXZCPS-SSDOTTSWSA-N 1 2 247.676 2.217 20 0 BEADLO FC(F)[C@@H]1CC[N@@H+](Cc2ccc(Cl)nn2)C1 ZINC000707168269 712166464 /nfs/dbraw/zinc/16/64/64/712166464.db2.gz PLKLEMKMMXZCPS-SSDOTTSWSA-N 1 2 247.676 2.217 20 0 BEADLO CCc1nnc(NCc2[nH]c(C)c(C)[nH+]2)s1 ZINC000709056485 712207169 /nfs/dbraw/zinc/20/71/69/712207169.db2.gz JPVZBRZAQYDJBF-UHFFFAOYSA-N 1 2 237.332 2.053 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2cn(C)cn2)nc1C ZINC000709975274 712236751 /nfs/dbraw/zinc/23/67/51/712236751.db2.gz FKDKSJXPPGOWSX-LBPRGKRZSA-N 1 2 244.342 2.283 20 0 BEADLO Cc1ccoc1C[NH2+][C@H](C)c1cn(C)cn1 ZINC000710006910 712239250 /nfs/dbraw/zinc/23/92/50/712239250.db2.gz ORAHHIWZEWWEKL-SNVBAGLBSA-N 1 2 219.288 2.172 20 0 BEADLO Cc1noc(C)c1[C@H](C)[NH2+][C@@H](C)c1cn(C)cn1 ZINC000710022242 712241162 /nfs/dbraw/zinc/24/11/62/712241162.db2.gz BPCLZXRASSZCQM-IUCAKERBSA-N 1 2 248.330 2.437 20 0 BEADLO CC1(C)CC[C@@H](CNc2cc[nH+]cc2F)OC1 ZINC000710685668 712254330 /nfs/dbraw/zinc/25/43/30/712254330.db2.gz OGAZNVJWKNJNMP-JTQLQIEISA-N 1 2 238.306 2.260 20 0 BEADLO CC1(C)CC[C@H](CNc2cc[nH+]cc2F)OC1 ZINC000710685671 712254346 /nfs/dbraw/zinc/25/43/46/712254346.db2.gz OGAZNVJWKNJNMP-SNVBAGLBSA-N 1 2 238.306 2.260 20 0 BEADLO Nc1[nH+]cccc1COC(=O)[C@@]12C[C@@H]1CCCC2 ZINC000922912529 712286549 /nfs/dbraw/zinc/28/65/49/712286549.db2.gz ZOJQRUBOEFXDHC-FZMZJTMJSA-N 1 2 246.310 2.287 20 0 BEADLO Cn1nc(C[NH+]2CCCCC2)cc1Cl ZINC000606284197 712352191 /nfs/dbraw/zinc/35/21/91/712352191.db2.gz DXHPOKULJWCXFN-UHFFFAOYSA-N 1 2 213.712 2.059 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCn2ccnc21)c1ccco1 ZINC000379017400 712369019 /nfs/dbraw/zinc/36/90/19/712369019.db2.gz RCCINODALNBXPS-NXEZZACHSA-N 1 2 217.272 2.272 20 0 BEADLO C[N@H+](C/C(Cl)=C\Cl)[C@H]1CCCOC1 ZINC000379382746 712379624 /nfs/dbraw/zinc/37/96/24/712379624.db2.gz FONSDPIIKSZXHH-QRJSTWQJSA-N 1 2 224.131 2.416 20 0 BEADLO C[N@@H+](C/C(Cl)=C\Cl)[C@H]1CCCOC1 ZINC000379382746 712379625 /nfs/dbraw/zinc/37/96/25/712379625.db2.gz FONSDPIIKSZXHH-QRJSTWQJSA-N 1 2 224.131 2.416 20 0 BEADLO C=C/C=C\CC[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000713661803 712468946 /nfs/dbraw/zinc/46/89/46/712468946.db2.gz RTNYDLMQTQGBGO-TVRMLOFPSA-N 1 2 225.332 2.439 20 0 BEADLO Fc1c[nH+]ccc1NCC[C@H]1CCCS1 ZINC000715654055 712529711 /nfs/dbraw/zinc/52/97/11/712529711.db2.gz ATBRIZYMZXLDDL-SECBINFHSA-N 1 2 226.320 2.340 20 0 BEADLO Cc1nc(N[C@H](C)c2ccns2)cc[nH+]1 ZINC000715907815 712541875 /nfs/dbraw/zinc/54/18/75/712541875.db2.gz HJIMLUVYHDAQKD-SSDOTTSWSA-N 1 2 220.301 2.415 20 0 BEADLO Cc1cnc(C[NH2+][C@H](C)c2ccns2)cn1 ZINC000715968941 712546112 /nfs/dbraw/zinc/54/61/12/712546112.db2.gz WMRDKLPPAIRYDE-SECBINFHSA-N 1 2 234.328 2.092 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1nccn1C)c1ccns1 ZINC000716036244 712547668 /nfs/dbraw/zinc/54/76/68/712547668.db2.gz ZYJHLMIXFGYSRZ-IUCAKERBSA-N 1 2 236.344 2.288 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccns1)c1cnccn1 ZINC000716036229 712547736 /nfs/dbraw/zinc/54/77/36/712547736.db2.gz ZXYHEBNGTKPAMK-BDAKNGLRSA-N 1 2 234.328 2.345 20 0 BEADLO Cc1csc(C[NH2+]Cc2[nH]nc(C)c2C)n1 ZINC000716453020 712561820 /nfs/dbraw/zinc/56/18/20/712561820.db2.gz ZXGBBUYOESJOHQ-UHFFFAOYSA-N 1 2 236.344 2.081 20 0 BEADLO C[C@H]1C[N@@H+](CC[C@@H]2CC2(Cl)Cl)CCO1 ZINC000822564894 712591299 /nfs/dbraw/zinc/59/12/99/712591299.db2.gz YXTMMVASHINSJH-DTWKUNHWSA-N 1 2 238.158 2.291 20 0 BEADLO C[C@H]1CC[C@H](OC(=O)CCc2ccc(N)[nH+]c2)C1 ZINC000815224290 712588488 /nfs/dbraw/zinc/58/84/88/712588488.db2.gz SMORIZQOIZECFV-JQWIXIFHSA-N 1 2 248.326 2.328 20 0 BEADLO C[C@H]1C[N@H+](CC[C@@H]2CC2(Cl)Cl)CCO1 ZINC000822564894 712591297 /nfs/dbraw/zinc/59/12/97/712591297.db2.gz YXTMMVASHINSJH-DTWKUNHWSA-N 1 2 238.158 2.291 20 0 BEADLO CNc1cc(N[C@@H](C)c2ccns2)nc[nH+]1 ZINC000717421696 712657381 /nfs/dbraw/zinc/65/73/81/712657381.db2.gz QPLPRHVDEFMZDR-ZETCQYMHSA-N 1 2 235.316 2.148 20 0 BEADLO CNc1cc(N[C@@H](C)c2ccns2)[nH+]cn1 ZINC000717421696 712657382 /nfs/dbraw/zinc/65/73/82/712657382.db2.gz QPLPRHVDEFMZDR-ZETCQYMHSA-N 1 2 235.316 2.148 20 0 BEADLO C[NH+](C)c1ccc(NCc2ccon2)cc1 ZINC000720388379 712837930 /nfs/dbraw/zinc/83/79/30/712837930.db2.gz BXMUDPWMTFORED-UHFFFAOYSA-N 1 2 217.272 2.353 20 0 BEADLO COCCCC[N@@H+]1CCC[C@H](F)C(F)(F)C1 ZINC001209214945 957360112 /nfs/dbraw/zinc/36/01/12/957360112.db2.gz YTOAQGXSYCNKEN-JTQLQIEISA-N 1 2 239.281 2.482 20 0 BEADLO COCCCC[N@H+]1CCC[C@H](F)C(F)(F)C1 ZINC001209214945 957360124 /nfs/dbraw/zinc/36/01/24/957360124.db2.gz YTOAQGXSYCNKEN-JTQLQIEISA-N 1 2 239.281 2.482 20 0 BEADLO CCCNc1nc(C2CC2)[nH+]c(C)c1OC ZINC000309433432 959875833 /nfs/dbraw/zinc/87/58/33/959875833.db2.gz JXGAFJXFDNBGFR-UHFFFAOYSA-N 1 2 221.304 2.493 20 0 BEADLO CCCCc1ncc(C[N@H+](CC)CCOC)[nH]1 ZINC001141066533 960853460 /nfs/dbraw/zinc/85/34/60/960853460.db2.gz IGFOABQMJZGVSM-UHFFFAOYSA-N 1 2 239.363 2.221 20 0 BEADLO CCCCc1ncc(C[N@@H+](CC)CCOC)[nH]1 ZINC001141066533 960853463 /nfs/dbraw/zinc/85/34/63/960853463.db2.gz IGFOABQMJZGVSM-UHFFFAOYSA-N 1 2 239.363 2.221 20 0 BEADLO CCCNc1cc(N(CC)CC)nc[nH+]1 ZINC000087805831 961751408 /nfs/dbraw/zinc/75/14/08/961751408.db2.gz XCTXMZWYNNOBEZ-UHFFFAOYSA-N 1 2 208.309 2.145 20 0 BEADLO CCCNc1cc(N(CC)CC)[nH+]cn1 ZINC000087805831 961751420 /nfs/dbraw/zinc/75/14/20/961751420.db2.gz XCTXMZWYNNOBEZ-UHFFFAOYSA-N 1 2 208.309 2.145 20 0 BEADLO COCc1cc[nH+]c(NCCCSC)c1 ZINC001155976574 963218505 /nfs/dbraw/zinc/21/85/05/963218505.db2.gz SMYMOESEQMKVSS-UHFFFAOYSA-N 1 2 226.345 2.393 20 0 BEADLO CSCc1ccc(N[C@H]2C[C@@H](CO)C2)[nH+]c1 ZINC001157463922 963620576 /nfs/dbraw/zinc/62/05/76/963620576.db2.gz CXMZGFUSUNOSPD-PHIMTYICSA-N 1 2 238.356 2.127 20 0 BEADLO CCc1cc(C[N@H+]2C[C@@H](F)C[C@H]2C)on1 ZINC001203212470 963649982 /nfs/dbraw/zinc/64/99/82/963649982.db2.gz NWCLTPKVYPMIAS-BDAKNGLRSA-N 1 2 212.268 2.169 20 0 BEADLO CC1CCC(N2CC[NH2+]CC(F)(F)C2)CC1 ZINC001168210706 963990684 /nfs/dbraw/zinc/99/06/84/963990684.db2.gz WTOIPAYSKSEGFQ-UHFFFAOYSA-N 1 2 232.318 2.106 20 0 BEADLO COc1c(C)[nH+]c(C2CC2)nc1NCC(F)F ZINC001161811560 964763690 /nfs/dbraw/zinc/76/36/90/964763690.db2.gz PQLUQIBTHVYDJI-UHFFFAOYSA-N 1 2 243.257 2.348 20 0 BEADLO Cc1cnsc1C[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC001233318308 965489833 /nfs/dbraw/zinc/48/98/33/965489833.db2.gz YSUATIJKLWHXKU-UWVGGRQHSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1cnsc1C[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC001233318307 965485525 /nfs/dbraw/zinc/48/55/25/965485525.db2.gz YSUATIJKLWHXKU-NXEZZACHSA-N 1 2 226.345 2.061 20 0 BEADLO C[C@H]1CC[C@@H](C[NH3+])[N@@H+]1Cc1ccc([S-])cc1 ZINC001205082933 965601998 /nfs/dbraw/zinc/60/19/98/965601998.db2.gz LBQHSPIRSOLTPM-JQWIXIFHSA-N 1 2 236.384 2.287 20 0 BEADLO C[C@H]1CC[C@@H](C[NH3+])[N@H+]1Cc1ccc([S-])cc1 ZINC001205082933 965602005 /nfs/dbraw/zinc/60/20/05/965602005.db2.gz LBQHSPIRSOLTPM-JQWIXIFHSA-N 1 2 236.384 2.287 20 0 BEADLO CSCCCNc1ccn2cc[nH+]c2c1 ZINC001163874569 965612610 /nfs/dbraw/zinc/61/26/10/965612610.db2.gz FWLGKQFTRDUMBM-UHFFFAOYSA-N 1 2 221.329 2.499 20 0 BEADLO CCC1(CC)CCN(c2cc(N)nc[nH+]2)C1 ZINC000087838756 1165782494 /nfs/dbraw/zinc/78/24/94/1165782494.db2.gz MSMVQZDJZBENQZ-UHFFFAOYSA-N 1 2 220.320 2.075 20 0 BEADLO C[C@@H]1CC(C[NH+]2CC(C)(F)C2)C[C@@H](C)O1 ZINC001209381237 1165808194 /nfs/dbraw/zinc/80/81/94/1165808194.db2.gz DHIRNABGOYXMPP-NXEZZACHSA-N 1 2 215.312 2.234 20 0 BEADLO c1nnc(C[NH2+][C@H](c2ccccc2)C2CC2)[nH]1 ZINC000041075751 1165808208 /nfs/dbraw/zinc/80/82/08/1165808208.db2.gz GOMAYVCRXOIBAZ-CYBMUJFWSA-N 1 2 228.299 2.046 20 0 BEADLO Cc1[nH+]c[nH]c1CN1CC[C@H](C)C(F)(F)C1 ZINC001204587523 967071822 /nfs/dbraw/zinc/07/18/22/967071822.db2.gz DQXDAOCBXQSULV-QMMMGPOBSA-N 1 2 229.274 2.195 20 0 BEADLO CN(C)c1cc(F)cc(C[N@@H+]2CC[C@H](F)C2)c1 ZINC001249941328 967182000 /nfs/dbraw/zinc/18/20/00/967182000.db2.gz FGFRFXFJTSMTLV-NSHDSACASA-N 1 2 240.297 2.436 20 0 BEADLO CN(C)c1cc(F)cc(C[N@H+]2CC[C@H](F)C2)c1 ZINC001249941328 967182003 /nfs/dbraw/zinc/18/20/03/967182003.db2.gz FGFRFXFJTSMTLV-NSHDSACASA-N 1 2 240.297 2.436 20 0 BEADLO CCN(CC)C(=O)Cc1cc(C)[nH+]c(C)c1 ZINC001250010856 967270051 /nfs/dbraw/zinc/27/00/51/967270051.db2.gz JUMZMOHYVIAPOO-UHFFFAOYSA-N 1 2 220.316 2.109 20 0 BEADLO CC(=O)OC1C[NH+](Cc2cccc(C)c2C)C1 ZINC001205088717 967337751 /nfs/dbraw/zinc/33/77/51/967337751.db2.gz IEZWSUXHZVWISE-UHFFFAOYSA-N 1 2 233.311 2.051 20 0 BEADLO CCc1cnc(Nc2c[nH+]c(C)c(N)c2)cn1 ZINC001210287068 1165865106 /nfs/dbraw/zinc/86/51/06/1165865106.db2.gz KUIOZLBBXGISSJ-UHFFFAOYSA-N 1 2 229.287 2.068 20 0 BEADLO Cc1[nH]c(CN2CC3(CCC3)C2)[nH+]c1C ZINC001206186567 968115401 /nfs/dbraw/zinc/11/54/01/968115401.db2.gz MTQSOZJJTMVQCC-UHFFFAOYSA-N 1 2 205.305 2.012 20 0 BEADLO COc1ncccc1C[N@H+]1C[C@H](F)C[C@H]1C ZINC001206554165 968381256 /nfs/dbraw/zinc/38/12/56/968381256.db2.gz UKMDGBDWIXHORD-MWLCHTKSSA-N 1 2 224.279 2.023 20 0 BEADLO Cc1[nH+]cc(CN2CCCC[C@@](C)(F)C2)n1C ZINC001206792324 968478156 /nfs/dbraw/zinc/47/81/56/968478156.db2.gz VNASEQZRGQHSBP-CYBMUJFWSA-N 1 2 239.338 2.443 20 0 BEADLO COCCNc1ccc2ccc(OC)cc2[nH+]1 ZINC000891389029 1166062859 /nfs/dbraw/zinc/06/28/59/1166062859.db2.gz AMKDYYTWSSIXGA-UHFFFAOYSA-N 1 2 232.283 2.302 20 0 BEADLO CCSC[C@H](C)[N@H+](C)CC(=O)OC(C)(C)C ZINC000706991928 1166065493 /nfs/dbraw/zinc/06/54/93/1166065493.db2.gz NEFJUEJBSSVAIX-JTQLQIEISA-N 1 2 247.404 2.402 20 0 BEADLO CCSC[C@H](C)[N@@H+](C)CC(=O)OC(C)(C)C ZINC000706991928 1166065499 /nfs/dbraw/zinc/06/54/99/1166065499.db2.gz NEFJUEJBSSVAIX-JTQLQIEISA-N 1 2 247.404 2.402 20 0 BEADLO Cc1cc(-c2ccccc2O)c[nH+]c1N ZINC000082730037 1166076624 /nfs/dbraw/zinc/07/66/24/1166076624.db2.gz WMESAGGRSNBXOK-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO CS[C@@H](C)CC[NH+]1C[C@@H](F)[C@H](F)C1 ZINC001208139459 969051610 /nfs/dbraw/zinc/05/16/10/969051610.db2.gz RVRZDUJHGHZZHG-DJLDLDEBSA-N 1 2 209.305 2.120 20 0 BEADLO CCCCC[C@@H](C)[NH2+]CC(=O)OC(C)C ZINC000043446460 1166269624 /nfs/dbraw/zinc/26/96/24/1166269624.db2.gz PVXCQADPFYATPF-LLVKDONJSA-N 1 2 215.337 2.496 20 0 BEADLO CC1(O)C[NH+](CCCc2ccccc2Cl)C1 ZINC001208871570 969261071 /nfs/dbraw/zinc/26/10/71/969261071.db2.gz LTGHKVXRUVQVLO-UHFFFAOYSA-N 1 2 239.746 2.339 20 0 BEADLO CCc1[nH+]ccc(C)c1NC[C@H](O)C(C)C ZINC001253757690 969377849 /nfs/dbraw/zinc/37/78/49/969377849.db2.gz RDHMMFFNKJAKSO-LBPRGKRZSA-N 1 2 222.332 2.381 20 0 BEADLO CCCOC1C[NH+](CCOc2ccccc2)C1 ZINC001209302788 969434042 /nfs/dbraw/zinc/43/40/42/969434042.db2.gz OLEOWDJAXFLSMC-UHFFFAOYSA-N 1 2 235.327 2.176 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1cc(C)n[nH]1 ZINC001254004928 969447255 /nfs/dbraw/zinc/44/72/55/969447255.db2.gz QRNNYXULYVKOBX-UHFFFAOYSA-N 1 2 219.288 2.333 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1cc(C)n[nH]1 ZINC001254004928 969447262 /nfs/dbraw/zinc/44/72/62/969447262.db2.gz QRNNYXULYVKOBX-UHFFFAOYSA-N 1 2 219.288 2.333 20 0 BEADLO CO[C@@H](C)CNc1cc2cc[nH]c2c[nH+]1 ZINC000308956702 1166439305 /nfs/dbraw/zinc/43/93/05/1166439305.db2.gz QTAWQNHAOSIEDI-QMMMGPOBSA-N 1 2 205.261 2.010 20 0 BEADLO FC1(F)CCCC[N@H+]([C@@H]2CCCOC2)C1 ZINC001254376658 969590787 /nfs/dbraw/zinc/59/07/87/969590787.db2.gz WVIFCDRWCUDNJO-SNVBAGLBSA-N 1 2 219.275 2.287 20 0 BEADLO CC(C)(C)OC(=O)C(C)(C)[NH2+][C@H]1CCSC1 ZINC001255271782 970022692 /nfs/dbraw/zinc/02/26/92/970022692.db2.gz IJVGHRJBNYCFPE-VIFPVBQESA-N 1 2 245.388 2.202 20 0 BEADLO CCOC(=O)[C@@H]1CCC[C@H]([NH2+][C@@H]2CC2(F)F)C1 ZINC001255337329 970120716 /nfs/dbraw/zinc/12/07/16/970120716.db2.gz PNYQGVSSBLJMOC-KXUCPTDWSA-N 1 2 247.285 2.106 20 0 BEADLO C[C@@H](CC(F)(F)F)[NH2+]Cc1ncco1 ZINC001255633960 970409327 /nfs/dbraw/zinc/40/93/27/970409327.db2.gz YHEFPYHQVUPDDR-LURJTMIESA-N 1 2 208.183 2.105 20 0 BEADLO C[C@H](CC(F)(F)F)[NH2+]Cc1ncco1 ZINC001255633961 970408315 /nfs/dbraw/zinc/40/83/15/970408315.db2.gz YHEFPYHQVUPDDR-ZCFIWIBFSA-N 1 2 208.183 2.105 20 0 BEADLO C[C@@H](CC(F)(F)F)[N@H+]1CCC(=O)[C@H](F)CC1 ZINC001255646582 970426471 /nfs/dbraw/zinc/42/64/71/970426471.db2.gz PFFPHXYCMZAOIZ-JGVFFNPUSA-N 1 2 241.228 2.330 20 0 BEADLO C[C@@H](CC(F)(F)F)[N@@H+]1CCC(=O)[C@H](F)CC1 ZINC001255646582 970426480 /nfs/dbraw/zinc/42/64/80/970426480.db2.gz PFFPHXYCMZAOIZ-JGVFFNPUSA-N 1 2 241.228 2.330 20 0 BEADLO C[C@@H](CC(F)(F)F)[NH+]1CC2(C1)CCCO2 ZINC001255652013 970433354 /nfs/dbraw/zinc/43/33/54/970433354.db2.gz MTAXZXXALSSETA-QMMMGPOBSA-N 1 2 223.238 2.192 20 0 BEADLO CC(C)OC1C[NH+]([C@@H](C)CC(F)(F)F)C1 ZINC001255660961 970442848 /nfs/dbraw/zinc/44/28/48/970442848.db2.gz MEHYRUFMMBXTTL-QMMMGPOBSA-N 1 2 225.254 2.437 20 0 BEADLO C[C@H](CC(F)(F)F)[N@@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001255662169 970445547 /nfs/dbraw/zinc/44/55/47/970445547.db2.gz HXJLEQFPRMQMCA-IWSPIJDZSA-N 1 2 223.238 2.191 20 0 BEADLO C[C@H](CC(F)(F)F)[N@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001255662169 970445551 /nfs/dbraw/zinc/44/55/51/970445551.db2.gz HXJLEQFPRMQMCA-IWSPIJDZSA-N 1 2 223.238 2.191 20 0 BEADLO Fc1c[nH+]ccc1NC[C@@H]1CC[C@H](C2CC2)O1 ZINC000722321312 1166784522 /nfs/dbraw/zinc/78/45/22/1166784522.db2.gz MCOMLNLUJDUDOS-GXFFZTMASA-N 1 2 236.290 2.012 20 0 BEADLO C[C@H](CC(F)(F)F)[N@@H+]1CCC(=O)C[C@@H]1C ZINC000235554195 1166793053 /nfs/dbraw/zinc/79/30/53/1166793053.db2.gz VMAKFOXNFIMCFC-JGVFFNPUSA-N 1 2 223.238 2.381 20 0 BEADLO C[C@H](CC(F)(F)F)[N@H+]1CCC(=O)C[C@@H]1C ZINC000235554195 1166793060 /nfs/dbraw/zinc/79/30/60/1166793060.db2.gz VMAKFOXNFIMCFC-JGVFFNPUSA-N 1 2 223.238 2.381 20 0 BEADLO Cc1ccc(NCCCn2cc[nH+]c2)cn1 ZINC001161682761 1167125161 /nfs/dbraw/zinc/12/51/61/1167125161.db2.gz ZSKBZESAVWFKOD-UHFFFAOYSA-N 1 2 216.288 2.089 20 0 BEADLO CC[C@H](C)Nc1cc(N(C)CC)nc[nH+]1 ZINC001167999115 1167129792 /nfs/dbraw/zinc/12/97/92/1167129792.db2.gz MFWPDMIAFWROJC-VIFPVBQESA-N 1 2 208.309 2.143 20 0 BEADLO CC[C@H](C)Nc1cc(N(C)CC)[nH+]cn1 ZINC001167999115 1167129796 /nfs/dbraw/zinc/12/97/96/1167129796.db2.gz MFWPDMIAFWROJC-VIFPVBQESA-N 1 2 208.309 2.143 20 0 BEADLO Cc1cc(-c2cccc(=O)[nH]2)cc(C)[nH+]1 ZINC000308955190 1167227315 /nfs/dbraw/zinc/22/73/15/1167227315.db2.gz YGSFYFRDVFQDGJ-UHFFFAOYSA-N 1 2 200.241 2.466 20 0 BEADLO CC[C@H](C)[C@@H](C)[N@H+](Cc1nnc[nH]1)C1CC1 ZINC001333583192 975868836 /nfs/dbraw/zinc/86/88/36/975868836.db2.gz QCYKTEYFRJCAIN-VHSXEESVSA-N 1 2 222.336 2.204 20 0 BEADLO CC[C@H](C)[C@@H](C)[N@@H+](Cc1nnc[nH]1)C1CC1 ZINC001333583192 975868841 /nfs/dbraw/zinc/86/88/41/975868841.db2.gz QCYKTEYFRJCAIN-VHSXEESVSA-N 1 2 222.336 2.204 20 0 BEADLO COC[C@H](CNc1[nH+]cccc1OC)C(C)C ZINC000896501120 1167285926 /nfs/dbraw/zinc/28/59/26/1167285926.db2.gz CNIIWLBQUXRVBZ-NSHDSACASA-N 1 2 238.331 2.421 20 0 BEADLO Cc1ccc2[nH+]c(CCCCO)[nH]c2c1C ZINC000309319723 1167289810 /nfs/dbraw/zinc/28/98/10/1167289810.db2.gz PWQHZNUQHZMIRF-UHFFFAOYSA-N 1 2 218.300 2.495 20 0 BEADLO CC[NH+]1CC(Oc2cccnc2C(F)(F)F)C1 ZINC001228593978 976371388 /nfs/dbraw/zinc/37/13/88/976371388.db2.gz RPIYNUOJUKSOIE-UHFFFAOYSA-N 1 2 246.232 2.183 20 0 BEADLO CCc1cccc(O)c1OC1C[NH+](CC)C1 ZINC001230372456 977198800 /nfs/dbraw/zinc/19/88/00/977198800.db2.gz XRXAYPKVSSWHHZ-UHFFFAOYSA-N 1 2 221.300 2.038 20 0 BEADLO CCOc1cccc(OC2C[NH+](CC)C2)c1 ZINC001230554126 977251992 /nfs/dbraw/zinc/25/19/92/977251992.db2.gz JEVRXZYSHUGQDH-UHFFFAOYSA-N 1 2 221.300 2.168 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1ccc(Cl)c(O)c1 ZINC001231733445 977721170 /nfs/dbraw/zinc/72/11/70/977721170.db2.gz UPWHLDOOHLBQFZ-UHFFFAOYSA-N 1 2 227.691 2.066 20 0 BEADLO CC(=O)C[N@H+](C)Cc1ccc(Cl)c(O)c1 ZINC001231733445 977721183 /nfs/dbraw/zinc/72/11/83/977721183.db2.gz UPWHLDOOHLBQFZ-UHFFFAOYSA-N 1 2 227.691 2.066 20 0 BEADLO CC(C)(C)Oc1ccc(C[NH+]2CC(O)C2)cc1 ZINC001231804041 977753906 /nfs/dbraw/zinc/75/39/06/977753906.db2.gz SBLLUORNDTVSAV-UHFFFAOYSA-N 1 2 235.327 2.040 20 0 BEADLO C[C@@H](Nc1cc(N(C)C)nc[nH+]1)C1(C)CC1 ZINC001336739248 977896316 /nfs/dbraw/zinc/89/63/16/977896316.db2.gz DSNGGENZPMZNHT-SECBINFHSA-N 1 2 220.320 2.143 20 0 BEADLO C[C@@H](Nc1cc(N(C)C)[nH+]cn1)C1(C)CC1 ZINC001336739248 977896319 /nfs/dbraw/zinc/89/63/19/977896319.db2.gz DSNGGENZPMZNHT-SECBINFHSA-N 1 2 220.320 2.143 20 0 BEADLO CC(C)C1CCC(C[NH2+]Cc2ncn[nH]2)CC1 ZINC000310259000 1167601366 /nfs/dbraw/zinc/60/13/66/1167601366.db2.gz YYUBCAYXNKKZLW-UHFFFAOYSA-N 1 2 236.363 2.357 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1cnsc1 ZINC001232225220 977953209 /nfs/dbraw/zinc/95/32/09/977953209.db2.gz XHGOXRWPSNXYGW-APPZFPTMSA-N 1 2 200.282 2.075 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1cnsc1 ZINC001232225220 977953218 /nfs/dbraw/zinc/95/32/18/977953218.db2.gz XHGOXRWPSNXYGW-APPZFPTMSA-N 1 2 200.282 2.075 20 0 BEADLO COc1cc[nH+]cc1Nc1ncncc1Cl ZINC001176119543 977953505 /nfs/dbraw/zinc/95/35/05/977953505.db2.gz SRBGRQDMSOVDNO-UHFFFAOYSA-N 1 2 236.662 2.277 20 0 BEADLO C[N@H+](Cc1cncc(O)c1)C1CC(F)(F)C1 ZINC001232039836 1167671007 /nfs/dbraw/zinc/67/10/07/1167671007.db2.gz XTJOSDJDQJYXMK-UHFFFAOYSA-N 1 2 228.242 2.017 20 0 BEADLO C[N@@H+](Cc1cncc(O)c1)C1CC(F)(F)C1 ZINC001232039836 1167671010 /nfs/dbraw/zinc/67/10/10/1167671010.db2.gz XTJOSDJDQJYXMK-UHFFFAOYSA-N 1 2 228.242 2.017 20 0 BEADLO Cc1[nH]c(CN2CCC[C@](C)(F)C2)c[nH+]1 ZINC001232460431 978093855 /nfs/dbraw/zinc/09/38/55/978093855.db2.gz QHYSOGLXACAHCV-NSHDSACASA-N 1 2 211.284 2.042 20 0 BEADLO CCc1csc(C[N@@H+]2CC[C@]23CCOC3)n1 ZINC001232477762 978127261 /nfs/dbraw/zinc/12/72/61/978127261.db2.gz PINNTAKIQDOKLC-GFCCVEGCSA-N 1 2 238.356 2.070 20 0 BEADLO CCc1csc(C[N@H+]2CC[C@]23CCOC3)n1 ZINC001232477762 978127266 /nfs/dbraw/zinc/12/72/66/978127266.db2.gz PINNTAKIQDOKLC-GFCCVEGCSA-N 1 2 238.356 2.070 20 0 BEADLO CCC(C)(C)CCNC(=O)CNc1cccc[nH+]1 ZINC000913649265 1167725089 /nfs/dbraw/zinc/72/50/89/1167725089.db2.gz XNCYGXNSVDORFC-UHFFFAOYSA-N 1 2 249.358 2.436 20 0 BEADLO Oc1cnc(Cl)cc1C[NH+]1CC2(CCC2)C1 ZINC001233033038 978419413 /nfs/dbraw/zinc/41/94/13/978419413.db2.gz YCAFHYJFJXVBQO-UHFFFAOYSA-N 1 2 238.718 2.427 20 0 BEADLO Oc1cnc(Cl)cc1C[NH+]1CC(C(F)F)C1 ZINC001233041261 978422822 /nfs/dbraw/zinc/42/28/22/978422822.db2.gz TYXNIIOADMOTEX-UHFFFAOYSA-N 1 2 248.660 2.138 20 0 BEADLO CCc1cccc(C[NH+]2C[C@H](C)O[C@@H](C)C2)n1 ZINC001235251877 1167783806 /nfs/dbraw/zinc/78/38/06/1167783806.db2.gz VHLBPCLUFKZTAG-RYUDHWBXSA-N 1 2 234.343 2.253 20 0 BEADLO Cc1cnsc1C[N@@H+]1CCC(=O)[C@@H](C)CC1 ZINC001233318469 978552378 /nfs/dbraw/zinc/55/23/78/978552378.db2.gz DVIPRGZNWJPYGG-VIFPVBQESA-N 1 2 238.356 2.253 20 0 BEADLO Cc1cnsc1C[N@H+]1CCC(=O)[C@@H](C)CC1 ZINC001233318469 978552390 /nfs/dbraw/zinc/55/23/90/978552390.db2.gz DVIPRGZNWJPYGG-VIFPVBQESA-N 1 2 238.356 2.253 20 0 BEADLO Cc1cnsc1C[N@@H+]1CCC[C@H](F)C1 ZINC001233320755 978555437 /nfs/dbraw/zinc/55/54/37/978555437.db2.gz MECDVNVITTYEHL-VIFPVBQESA-N 1 2 214.309 2.385 20 0 BEADLO Cc1cnsc1C[N@H+]1CCC[C@H](F)C1 ZINC001233320755 978555440 /nfs/dbraw/zinc/55/54/40/978555440.db2.gz MECDVNVITTYEHL-VIFPVBQESA-N 1 2 214.309 2.385 20 0 BEADLO Cc1ncc(C[NH+]2CC3(C2)C[C@H](F)CS3)o1 ZINC001233367697 978580111 /nfs/dbraw/zinc/58/01/11/978580111.db2.gz ZACHBMBQAJRIBF-VIFPVBQESA-N 1 2 242.319 2.012 20 0 BEADLO CC[NH+]1CC(Oc2cc(Cl)c(O)cc2C)C1 ZINC001233592718 978638786 /nfs/dbraw/zinc/63/87/86/978638786.db2.gz NZFBGOBYCILLPR-UHFFFAOYSA-N 1 2 241.718 2.437 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1cc(C)c(C)s1 ZINC001233685410 978674609 /nfs/dbraw/zinc/67/46/09/978674609.db2.gz RBHXNKCNHOSMJZ-SECBINFHSA-N 1 2 241.356 2.358 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1cc(C)c(C)s1 ZINC001233685410 978674613 /nfs/dbraw/zinc/67/46/13/978674613.db2.gz RBHXNKCNHOSMJZ-SECBINFHSA-N 1 2 241.356 2.358 20 0 BEADLO CC(C)c1ccc(OC2C[NH+](C(C)C)C2)nn1 ZINC001233882793 978723278 /nfs/dbraw/zinc/72/32/78/978723278.db2.gz GXOVEJBXCSPEQS-UHFFFAOYSA-N 1 2 235.331 2.071 20 0 BEADLO Cc1cc(F)cc(N2C[C@@H](F)[C@@H](F)C2)[nH+]1 ZINC001339737779 978904204 /nfs/dbraw/zinc/90/42/04/978904204.db2.gz SRWXFMBRHOHZOO-DTORHVGOSA-N 1 2 216.206 2.025 20 0 BEADLO CCCCc1c[nH+]c2c(c1)OCCN2C ZINC001249978092 978902936 /nfs/dbraw/zinc/90/29/36/978902936.db2.gz CGOQSJKMNOCPCW-UHFFFAOYSA-N 1 2 206.289 2.253 20 0 BEADLO COc1cc(C[NH+]2CC=CC2)cc(F)c1F ZINC001235434332 979045114 /nfs/dbraw/zinc/04/51/14/979045114.db2.gz HZPYQZKLDOHHLS-UHFFFAOYSA-N 1 2 225.238 2.345 20 0 BEADLO Cc1noc(C)c1[C@H](C)[NH2+][C@H]1CCn2ccnc21 ZINC000382312066 1168242142 /nfs/dbraw/zinc/24/21/42/1168242142.db2.gz SIXLYLZCCDHDDY-KWQFWETISA-N 1 2 246.314 2.284 20 0 BEADLO C[N@@H+]1CCN(CC2OC=CC2=S)CC1(C)C ZINC001237180776 979828701 /nfs/dbraw/zinc/82/87/01/979828701.db2.gz BFWGJNAYALKDSC-UHFFFAOYSA-N 1 2 240.372 2.094 20 0 BEADLO C[N@H+]1CCN(CC2OC=CC2=S)CC1(C)C ZINC001237180776 979828709 /nfs/dbraw/zinc/82/87/09/979828709.db2.gz BFWGJNAYALKDSC-UHFFFAOYSA-N 1 2 240.372 2.094 20 0 BEADLO S=C1C=COC1C[NH+]1CC2(C1)CCCCO2 ZINC001237183294 979832772 /nfs/dbraw/zinc/83/27/72/979832772.db2.gz ZBJOZFPKDUBTLS-UHFFFAOYSA-N 1 2 239.340 2.323 20 0 BEADLO COc1ccc(OC)c(C[N@@H+]2CC[C@H]2C)c1F ZINC001237573874 979945849 /nfs/dbraw/zinc/94/58/49/979945849.db2.gz XYXHDVQTMMVPSF-SECBINFHSA-N 1 2 239.290 2.437 20 0 BEADLO COc1ccc(OC)c(C[N@H+]2CC[C@H]2C)c1F ZINC001237573874 979945856 /nfs/dbraw/zinc/94/58/56/979945856.db2.gz XYXHDVQTMMVPSF-SECBINFHSA-N 1 2 239.290 2.437 20 0 BEADLO Cc1coc(C[N@@H+]2CC[C@H](C(F)(F)F)C2)n1 ZINC001237645114 979978465 /nfs/dbraw/zinc/97/84/65/979978465.db2.gz IUTITUZYXRYKEZ-QMMMGPOBSA-N 1 2 234.221 2.367 20 0 BEADLO Cc1coc(C[N@H+]2CC[C@H](C(F)(F)F)C2)n1 ZINC001237645114 979978467 /nfs/dbraw/zinc/97/84/67/979978467.db2.gz IUTITUZYXRYKEZ-QMMMGPOBSA-N 1 2 234.221 2.367 20 0 BEADLO COc1ccoc1C[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC001237864119 980101761 /nfs/dbraw/zinc/10/17/61/980101761.db2.gz SBMHXOMRKMVMCQ-NXEZZACHSA-N 1 2 227.279 2.468 20 0 BEADLO COc1ccoc1C[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC001237864119 980101767 /nfs/dbraw/zinc/10/17/67/980101767.db2.gz SBMHXOMRKMVMCQ-NXEZZACHSA-N 1 2 227.279 2.468 20 0 BEADLO COc1cc(C[N@@H+]2CC[C@H]2C)c(Cl)cn1 ZINC001238360726 980239583 /nfs/dbraw/zinc/23/95/83/980239583.db2.gz OKAXTQNOEQGJCG-MRVPVSSYSA-N 1 2 226.707 2.338 20 0 BEADLO COc1cc(C[N@H+]2CC[C@H]2C)c(Cl)cn1 ZINC001238360726 980239597 /nfs/dbraw/zinc/23/95/97/980239597.db2.gz OKAXTQNOEQGJCG-MRVPVSSYSA-N 1 2 226.707 2.338 20 0 BEADLO Cc1cc(-c2ccc(N)[nH+]c2)cc(O)c1F ZINC001244516266 1168558947 /nfs/dbraw/zinc/55/89/47/1168558947.db2.gz QSPFUTATZMCNIQ-UHFFFAOYSA-N 1 2 218.231 2.484 20 0 BEADLO Cn1cc(Nc2ccc3c(c2)[nH+]cn3C)cn1 ZINC001174331003 1168692787 /nfs/dbraw/zinc/69/27/87/1168692787.db2.gz YENSRUGWEYUYPL-UHFFFAOYSA-N 1 2 227.271 2.050 20 0 BEADLO C[C@H](C(=O)NC[C@@H]1CCCC[C@@H]1C)n1cc[nH+]c1 ZINC001177927551 1168720137 /nfs/dbraw/zinc/72/01/37/1168720137.db2.gz ZWIWWHIBELRKPC-XQQFMLRXSA-N 1 2 249.358 2.387 20 0 BEADLO C[C@H](C(=O)NC[C@@H]1CCCC[C@H]1C)n1cc[nH+]c1 ZINC001177927550 1168719535 /nfs/dbraw/zinc/71/95/35/1168719535.db2.gz ZWIWWHIBELRKPC-UPJWGTAASA-N 1 2 249.358 2.387 20 0 BEADLO CC[C@@H](C)COC(=O)NCCCn1cc[nH+]c1 ZINC001194756657 981885905 /nfs/dbraw/zinc/88/59/05/981885905.db2.gz NWVHWZIZZBORHW-LLVKDONJSA-N 1 2 239.319 2.046 20 0 BEADLO Cc1ccccc1C[N@@H+]1CCn2nccc2C1 ZINC001203708930 1168774671 /nfs/dbraw/zinc/77/46/71/1168774671.db2.gz SNIHBASVSVRFMW-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO Cc1ccccc1C[N@H+]1CCn2nccc2C1 ZINC001203708930 1168774674 /nfs/dbraw/zinc/77/46/74/1168774674.db2.gz SNIHBASVSVRFMW-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)o1 ZINC001352010895 982432724 /nfs/dbraw/zinc/43/27/24/982432724.db2.gz CZNQRNJWWLHJRN-KOLCDFICSA-N 1 2 227.279 2.468 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)o1 ZINC001352010895 982432734 /nfs/dbraw/zinc/43/27/34/982432734.db2.gz CZNQRNJWWLHJRN-KOLCDFICSA-N 1 2 227.279 2.468 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)o1 ZINC001352010897 982435768 /nfs/dbraw/zinc/43/57/68/982435768.db2.gz CZNQRNJWWLHJRN-ONGXEEELSA-N 1 2 227.279 2.468 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)o1 ZINC001352010897 982435771 /nfs/dbraw/zinc/43/57/71/982435771.db2.gz CZNQRNJWWLHJRN-ONGXEEELSA-N 1 2 227.279 2.468 20 0 BEADLO C[C@H]([NH2+]CC1=NOCC1)c1c(F)cccc1F ZINC001197978102 982648187 /nfs/dbraw/zinc/64/81/87/982648187.db2.gz FXGBDTMEHUIUCD-QMMMGPOBSA-N 1 2 240.253 2.392 20 0 BEADLO COC1C[NH+](Cc2c[nH]c3c2cccc3F)C1 ZINC001137051045 1168868354 /nfs/dbraw/zinc/86/83/54/1168868354.db2.gz CIMKDNGDUFUSGF-UHFFFAOYSA-N 1 2 234.274 2.138 20 0 BEADLO Cc1nnc(-c2cccc(-n3cc[nH+]c3)c2)o1 ZINC001253456957 1168975921 /nfs/dbraw/zinc/97/59/21/1168975921.db2.gz MGLUIWJVLBJXNS-UHFFFAOYSA-N 1 2 226.239 2.231 20 0 BEADLO CCC[C@H](O)CNc1ccc([NH+](C)C)cc1 ZINC001252771953 983874642 /nfs/dbraw/zinc/87/46/42/983874642.db2.gz XGSFIYHAKQJLMA-ZDUSSCGKSA-N 1 2 222.332 2.326 20 0 BEADLO CCC[C@@H](O)CNc1cc[nH+]c(OCC)c1 ZINC001252774193 983876370 /nfs/dbraw/zinc/87/63/70/983876370.db2.gz IZANUEMVEQDAJX-LLVKDONJSA-N 1 2 224.304 2.053 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1cc(C)cs1 ZINC001137158427 984004848 /nfs/dbraw/zinc/00/48/48/984004848.db2.gz RYJNKZZWKMJAQI-SECBINFHSA-N 1 2 227.329 2.050 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1cc(C)cs1 ZINC001137158427 984004857 /nfs/dbraw/zinc/00/48/57/984004857.db2.gz RYJNKZZWKMJAQI-SECBINFHSA-N 1 2 227.329 2.050 20 0 BEADLO CC[C@H]1CCCC[C@@H]1NC(=O)Cc1[nH]c[nH+]c1C ZINC001464080462 1169255915 /nfs/dbraw/zinc/25/59/15/1169255915.db2.gz YFXGXMMTYAEKSX-RYUDHWBXSA-N 1 2 249.358 2.346 20 0 BEADLO CC(C)OCC[C@H](C)[NH2+]CC(=O)OC(C)(C)C ZINC001172432891 974719202 /nfs/dbraw/zinc/71/92/02/974719202.db2.gz DPGCEQIFBXFSBW-NSHDSACASA-N 1 2 245.363 2.121 20 0 BEADLO CC(C)OCC[C@H](C)[N@@H+]1CCC[C@H](F)C(=O)C1 ZINC001172444684 974804574 /nfs/dbraw/zinc/80/45/74/974804574.db2.gz VFDYNEHAKUWRRS-RYUDHWBXSA-N 1 2 245.338 2.193 20 0 BEADLO CC(C)OCC[C@H](C)[N@H+]1CCC[C@H](F)C(=O)C1 ZINC001172444684 974804579 /nfs/dbraw/zinc/80/45/79/974804579.db2.gz VFDYNEHAKUWRRS-RYUDHWBXSA-N 1 2 245.338 2.193 20 0 BEADLO CC(C)c1nc(COC2C[NH+](C)C2)cs1 ZINC001222989743 972783242 /nfs/dbraw/zinc/78/32/42/972783242.db2.gz WXOAOSHERDCKEV-UHFFFAOYSA-N 1 2 226.345 2.097 20 0 BEADLO Cc1cc(C[N@@H+]2CCSC[C@@H]2C2CC2)n[nH]1 ZINC001327951009 972824682 /nfs/dbraw/zinc/82/46/82/972824682.db2.gz AZLWBNIGCWTVDA-GFCCVEGCSA-N 1 2 237.372 2.046 20 0 BEADLO Cc1cc(C[N@H+]2CCSC[C@@H]2C2CC2)n[nH]1 ZINC001327951009 972824691 /nfs/dbraw/zinc/82/46/91/972824691.db2.gz AZLWBNIGCWTVDA-GFCCVEGCSA-N 1 2 237.372 2.046 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2ncoc2c1 ZINC001243473700 970765837 /nfs/dbraw/zinc/76/58/37/970765837.db2.gz FEMUAKNTJMRYAR-UHFFFAOYSA-N 1 2 211.224 2.472 20 0 BEADLO c1nsnc1C[N@@H+]1CCC[C@H](C2CC2)C1 ZINC000846907342 973060964 /nfs/dbraw/zinc/06/09/64/973060964.db2.gz XCOYWGSIHKIGQS-JTQLQIEISA-N 1 2 223.345 2.160 20 0 BEADLO c1nsnc1C[N@H+]1CCC[C@H](C2CC2)C1 ZINC000846907342 973060972 /nfs/dbraw/zinc/06/09/72/973060972.db2.gz XCOYWGSIHKIGQS-JTQLQIEISA-N 1 2 223.345 2.160 20 0 BEADLO Nc1[nH+]cccc1-c1cnc2ncccc2c1 ZINC001243475434 970770178 /nfs/dbraw/zinc/77/01/78/970770178.db2.gz HWYXPLMKQUMMGY-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO Nc1[nH+]cccc1-c1cccc2c1NC(=O)CC2 ZINC001243475473 970771328 /nfs/dbraw/zinc/77/13/28/970771328.db2.gz JHOLHUZKHFPUMC-UHFFFAOYSA-N 1 2 239.278 2.216 20 0 BEADLO Nc1[nH+]cccc1-c1cc(F)c2nccnc2c1 ZINC001243475421 970772020 /nfs/dbraw/zinc/77/20/20/970772020.db2.gz HQZCDUAKPCWTRU-UHFFFAOYSA-N 1 2 240.241 2.413 20 0 BEADLO CCN(CC1CCC1)C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001256371084 970784830 /nfs/dbraw/zinc/78/48/30/970784830.db2.gz XEBNJWGWNYIVSD-LLVKDONJSA-N 1 2 235.331 2.093 20 0 BEADLO C[C@@]1(O)CC[N@H+](Cc2ccc(F)cc2)C[C@@H]1F ZINC001203913288 1169470471 /nfs/dbraw/zinc/47/04/71/1169470471.db2.gz WCGZEPJJWPCRDP-QWHCGFSZSA-N 1 2 241.281 2.121 20 0 BEADLO C[C@@]1(O)CC[N@@H+](Cc2ccc(F)cc2)C[C@@H]1F ZINC001203913288 1169470476 /nfs/dbraw/zinc/47/04/76/1169470476.db2.gz WCGZEPJJWPCRDP-QWHCGFSZSA-N 1 2 241.281 2.121 20 0 BEADLO O=c1cccc(-c2cc[nH+]c(N3CCCC3)c2)[nH]1 ZINC001243736610 970894765 /nfs/dbraw/zinc/89/47/65/970894765.db2.gz BQVBHXKEUKNVGH-UHFFFAOYSA-N 1 2 241.294 2.449 20 0 BEADLO O=C1CC[N@@H+]([C@@H]2CCO[C@@H](c3ccccc3)C2)C1 ZINC001256817251 970993584 /nfs/dbraw/zinc/99/35/84/970993584.db2.gz LDSRAKHVQAWOBR-UKRRQHHQSA-N 1 2 245.322 2.182 20 0 BEADLO O=C1CC[N@H+]([C@@H]2CCO[C@@H](c3ccccc3)C2)C1 ZINC001256817251 970993594 /nfs/dbraw/zinc/99/35/94/970993594.db2.gz LDSRAKHVQAWOBR-UKRRQHHQSA-N 1 2 245.322 2.182 20 0 BEADLO c1cn2c(cccc2NC2=CCCOC2)[nH+]1 ZINC001216504785 971102741 /nfs/dbraw/zinc/10/27/41/971102741.db2.gz QMMLVUMRRQMKQL-UHFFFAOYSA-N 1 2 215.256 2.050 20 0 BEADLO C[C@](O)(C[N@@H+]1CCC=C(Cl)C1)C(F)(F)F ZINC000404408852 971156091 /nfs/dbraw/zinc/15/60/91/971156091.db2.gz YQYPFFCHTCPCNF-QMMMGPOBSA-N 1 2 243.656 2.128 20 0 BEADLO C[C@](O)(C[N@H+]1CCC=C(Cl)C1)C(F)(F)F ZINC000404408852 971156099 /nfs/dbraw/zinc/15/60/99/971156099.db2.gz YQYPFFCHTCPCNF-QMMMGPOBSA-N 1 2 243.656 2.128 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)C1CCCCCCC1 ZINC001329876843 973996746 /nfs/dbraw/zinc/99/67/46/973996746.db2.gz BVNPGQXNJPFEEB-UHFFFAOYSA-N 1 2 222.336 2.349 20 0 BEADLO Nc1cc(-c2cc(F)ccc2N)cc[nH+]1 ZINC001244399738 971245040 /nfs/dbraw/zinc/24/50/40/971245040.db2.gz PSSQTRQWFZXPTC-UHFFFAOYSA-N 1 2 203.220 2.052 20 0 BEADLO CCCCOC(=O)CC[C@@H](C)[NH2+]CC(F)F ZINC001257377160 971292029 /nfs/dbraw/zinc/29/20/29/971292029.db2.gz XEOYKNCULFOAGR-SECBINFHSA-N 1 2 237.290 2.353 20 0 BEADLO CC[NH+]1CC(OCCSc2ccccc2)C1 ZINC001224906959 974068124 /nfs/dbraw/zinc/06/81/24/974068124.db2.gz VPBCXYLQZSXEOF-UHFFFAOYSA-N 1 2 237.368 2.499 20 0 BEADLO Cc1nc(N(C)[C@H]2CCOC2)cc(C(C)C)[nH+]1 ZINC001158569715 971328600 /nfs/dbraw/zinc/32/86/00/971328600.db2.gz VRJZIPOPISNFOK-NSHDSACASA-N 1 2 235.331 2.134 20 0 BEADLO C[C@@H]1C[C@@H]1c1nnc([C@@H]([NH3+])COC(C)(C)C)o1 ZINC001217695184 971329599 /nfs/dbraw/zinc/32/95/99/971329599.db2.gz DDWDGLITLPOWNP-VGMNWLOBSA-N 1 2 239.319 2.008 20 0 BEADLO C[C@H]1C[C@@H]1c1nnc([C@@H]([NH3+])COC(C)(C)C)o1 ZINC001217695182 971332275 /nfs/dbraw/zinc/33/22/75/971332275.db2.gz DDWDGLITLPOWNP-CIUDSAMLSA-N 1 2 239.319 2.008 20 0 BEADLO C[C@@H]1C[C@@H]1c1nnc([C@H]([NH3+])COC(C)(C)C)o1 ZINC001217700355 971338332 /nfs/dbraw/zinc/33/83/32/971338332.db2.gz DDWDGLITLPOWNP-HRDYMLBCSA-N 1 2 239.319 2.008 20 0 BEADLO C[C@@H]1C[C@H]1c1nnc([C@H]([NH3+])COC(C)(C)C)o1 ZINC001217700356 971339518 /nfs/dbraw/zinc/33/95/18/971339518.db2.gz DDWDGLITLPOWNP-IWSPIJDZSA-N 1 2 239.319 2.008 20 0 BEADLO CC(C)(C)OC[C@@H]([NH3+])c1nnc(C2CCC2)o1 ZINC001217700741 971341838 /nfs/dbraw/zinc/34/18/38/971341838.db2.gz KSOPBRZWQPNCKK-SECBINFHSA-N 1 2 239.319 2.152 20 0 BEADLO CCc1nnc([C@@H]2CC[C@H](C(F)(F)F)C[NH2+]2)o1 ZINC001217706046 971344287 /nfs/dbraw/zinc/34/42/87/971344287.db2.gz LOZNCTOUDIJVOZ-BQBZGAKWSA-N 1 2 249.236 2.235 20 0 BEADLO CC[C@@H](C)[N@@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001257446787 971364871 /nfs/dbraw/zinc/36/48/71/971364871.db2.gz RIPQAWYQSRSBTI-LLVKDONJSA-N 1 2 249.358 2.349 20 0 BEADLO CC[C@@H](C)[N@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001257446787 971364875 /nfs/dbraw/zinc/36/48/75/971364875.db2.gz RIPQAWYQSRSBTI-LLVKDONJSA-N 1 2 249.358 2.349 20 0 BEADLO CC(C)CCCO[C@@H]1C[NH2+]CC(F)(F)C1 ZINC001217854664 971445055 /nfs/dbraw/zinc/44/50/55/971445055.db2.gz CWOKOBLBVLSVJS-JTQLQIEISA-N 1 2 221.291 2.436 20 0 BEADLO CCCC[C@H](C)N(C)C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001330192871 974150804 /nfs/dbraw/zinc/15/08/04/974150804.db2.gz RTHSCCMBCHSSTL-NWDGAFQWSA-N 1 2 237.347 2.481 20 0 BEADLO CO[C@@H](C)CNc1ccc(CSC)c[nH+]1 ZINC001158812916 971465764 /nfs/dbraw/zinc/46/57/64/971465764.db2.gz VWJZNBVWBSZKPB-VIFPVBQESA-N 1 2 226.345 2.391 20 0 BEADLO CCCCCOC(=O)C[NH2+][C@H]1CCCSC1 ZINC001257668321 971469190 /nfs/dbraw/zinc/46/91/90/971469190.db2.gz OTHADRHOUZEVGT-NSHDSACASA-N 1 2 245.388 2.205 20 0 BEADLO Cc1cc(S)ccc1O[C@@H]1CCC[NH2+]C1 ZINC001217963073 971549072 /nfs/dbraw/zinc/54/90/72/971549072.db2.gz NKFKDJJBHUXASC-SNVBAGLBSA-N 1 2 223.341 2.415 20 0 BEADLO CCOC(=O)CC1CCC([NH+]2CC(F)C2)CC1 ZINC001258029468 971558279 /nfs/dbraw/zinc/55/82/79/971558279.db2.gz CEMDNNYXJUJNPL-UHFFFAOYSA-N 1 2 243.322 2.152 20 0 BEADLO CCN(C(=O)CCCn1cc[nH+]c1)C(C)(C)C ZINC001327286968 972535835 /nfs/dbraw/zinc/53/58/35/972535835.db2.gz XDFFZULKIGLWHZ-UHFFFAOYSA-N 1 2 237.347 2.310 20 0 BEADLO C[C@@H]1CC[NH2+]C[C@H]1Oc1cccc(S)c1 ZINC001218047136 971586587 /nfs/dbraw/zinc/58/65/87/971586587.db2.gz DOKTYIAGSBWPEJ-BXKDBHETSA-N 1 2 223.341 2.352 20 0 BEADLO CCC1(CC)CCC[N@H+](Cc2nnc[nH]2)C1 ZINC001330575443 974327286 /nfs/dbraw/zinc/32/72/86/974327286.db2.gz GWGDORJROXBDIL-UHFFFAOYSA-N 1 2 222.336 2.207 20 0 BEADLO CCC1(CC)CCC[N@@H+](Cc2nnc[nH]2)C1 ZINC001330575443 974327296 /nfs/dbraw/zinc/32/72/96/974327296.db2.gz GWGDORJROXBDIL-UHFFFAOYSA-N 1 2 222.336 2.207 20 0 BEADLO CNc1ccc(O[C@H]2C[NH2+]CC(F)(F)C2)cc1 ZINC001218278348 971668625 /nfs/dbraw/zinc/66/86/25/971668625.db2.gz MCPMXQSUFRIAGK-LLVKDONJSA-N 1 2 242.269 2.104 20 0 BEADLO CC1(C)[C@@H]2C[C@@H]([N@@H+]3CC[C@H](O)C(F)(F)C3)C[C@@H]21 ZINC001170761888 971745170 /nfs/dbraw/zinc/74/51/70/971745170.db2.gz PCRVGEVEJWHKQP-MMWGEVLESA-N 1 2 245.313 2.123 20 0 BEADLO CC1(C)[C@@H]2C[C@@H]([N@H+]3CC[C@H](O)C(F)(F)C3)C[C@@H]21 ZINC001170761888 971745177 /nfs/dbraw/zinc/74/51/77/971745177.db2.gz PCRVGEVEJWHKQP-MMWGEVLESA-N 1 2 245.313 2.123 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(-c2cc[nH]n2)cc1 ZINC001245312840 971777097 /nfs/dbraw/zinc/77/70/97/971777097.db2.gz YWQYEMZUEKZBNP-UHFFFAOYSA-N 1 2 224.267 2.477 20 0 BEADLO O[C@H]1C[C@@H](COc2ccc(-c3[nH]cc[nH+]3)cc2)C1 ZINC001218435328 971815315 /nfs/dbraw/zinc/81/53/15/971815315.db2.gz UZQWSRRZKNSGSL-KLPPZKSPSA-N 1 2 244.294 2.226 20 0 BEADLO Cc1cc(S)ccc1O[C@@H]1[C@@H]2CC[C@H]1[NH2+]C2 ZINC001218443989 971821507 /nfs/dbraw/zinc/82/15/07/971821507.db2.gz DYQBIMOLYHUMTC-IRUJWGPZSA-N 1 2 235.352 2.413 20 0 BEADLO C[C@@H]1COCC[C@H]1Nc1ccn2cc[nH+]c2c1 ZINC001170818643 971898621 /nfs/dbraw/zinc/89/86/21/971898621.db2.gz MGRRYEBFQLSYNU-ZYHUDNBSSA-N 1 2 231.299 2.171 20 0 BEADLO CCOC(=O)C1([NH2+][C@@H]2CC[C@@H](C)[C@@H](C)C2)CC1 ZINC001172358637 974628025 /nfs/dbraw/zinc/62/80/25/974628025.db2.gz JGZUFHYYHOAISU-GRYCIOLGSA-N 1 2 239.359 2.496 20 0 BEADLO CS[C@H](C)CC[N@@H+]1CCC[C@H](F)C(=O)C1 ZINC001208139760 957006879 /nfs/dbraw/zinc/00/68/79/957006879.db2.gz VAMGQILSOKHHKU-ZJUUUORDSA-N 1 2 233.352 2.131 20 0 BEADLO CS[C@H](C)CC[N@H+]1CCC[C@H](F)C(=O)C1 ZINC001208139760 957006899 /nfs/dbraw/zinc/00/68/99/957006899.db2.gz VAMGQILSOKHHKU-ZJUUUORDSA-N 1 2 233.352 2.131 20 0 BEADLO CS[C@H](C)CC[N@@H+]1CCC[C@@H](F)C(=O)C1 ZINC001208139757 957010969 /nfs/dbraw/zinc/01/09/69/957010969.db2.gz VAMGQILSOKHHKU-NXEZZACHSA-N 1 2 233.352 2.131 20 0 BEADLO CS[C@H](C)CC[N@H+]1CCC[C@@H](F)C(=O)C1 ZINC001208139757 957010987 /nfs/dbraw/zinc/01/09/87/957010987.db2.gz VAMGQILSOKHHKU-NXEZZACHSA-N 1 2 233.352 2.131 20 0 BEADLO Cc1ccc([C@@H](C)CC[NH+]2CCN(C#N)CC2)o1 ZINC001208166463 957052067 /nfs/dbraw/zinc/05/20/67/957052067.db2.gz XQZIHXREXPDBDZ-LBPRGKRZSA-N 1 2 247.342 2.180 20 0 BEADLO Cc1nc(N2CC[C@@H](O)C[C@H]2C)cc(C(C)C)[nH+]1 ZINC000705382362 957200703 /nfs/dbraw/zinc/20/07/03/957200703.db2.gz VEZVESKMUAIGKK-ZYHUDNBSSA-N 1 2 249.358 2.258 20 0 BEADLO Cc1nc2c(o1)CC[N@H+](C[C@@H]1CCC=CO1)C2 ZINC001208888208 957203760 /nfs/dbraw/zinc/20/37/60/957203760.db2.gz TUEIYRXHQFEGJQ-NSHDSACASA-N 1 2 234.299 2.034 20 0 BEADLO Cc1nc2c(o1)CC[N@@H+](C[C@@H]1CCC=CO1)C2 ZINC001208888208 957203772 /nfs/dbraw/zinc/20/37/72/957203772.db2.gz TUEIYRXHQFEGJQ-NSHDSACASA-N 1 2 234.299 2.034 20 0 BEADLO C[C@H](C[NH+]1CC2(C1)CCCCO2)C(F)(F)F ZINC001208895301 957217249 /nfs/dbraw/zinc/21/72/49/957217249.db2.gz HECNIFWVPWGWOA-SECBINFHSA-N 1 2 237.265 2.440 20 0 BEADLO Cc1cc2cc(NCc3cncnc3)[nH+]cc2[nH]1 ZINC001167256561 957592894 /nfs/dbraw/zinc/59/28/94/957592894.db2.gz RDEGJBQLCFHVQK-UHFFFAOYSA-N 1 2 239.282 2.273 20 0 BEADLO C[C@H]1CC(OCC[NH+]2CCOCC2)C[C@H](C)C1 ZINC001210206830 957670064 /nfs/dbraw/zinc/67/00/64/957670064.db2.gz JSYJNQBHQVSTTC-CHWSQXEVSA-N 1 2 241.375 2.160 20 0 BEADLO C[C@H]1C[C@H](OCC[NH+]2CCOCC2)C[C@@H](C)C1 ZINC001210206833 957670804 /nfs/dbraw/zinc/67/08/04/957670804.db2.gz JSYJNQBHQVSTTC-WDNDVIMCSA-N 1 2 241.375 2.160 20 0 BEADLO Cc1nc(Cl)cc(Nc2c[nH+]c(C)c(N)c2)n1 ZINC001210285823 957713928 /nfs/dbraw/zinc/71/39/28/957713928.db2.gz SVDAELSHGVFGDV-UHFFFAOYSA-N 1 2 249.705 2.468 20 0 BEADLO O=C1CCC2(CC1)CC[NH+](Cc1cnc[nH]1)CC2 ZINC001136873472 972286779 /nfs/dbraw/zinc/28/67/79/972286779.db2.gz RCYSAGJOIWVFQK-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2c[nH]cn2)cn1 ZINC001136871915 972293684 /nfs/dbraw/zinc/29/36/84/972293684.db2.gz SOHQQOWDOMWMJP-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2c[nH]cn2)cn1 ZINC001136871915 972293685 /nfs/dbraw/zinc/29/36/85/972293685.db2.gz SOHQQOWDOMWMJP-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO CC(=O)Nc1cc(Nc2nccs2)cc[nH+]1 ZINC001210990354 957974359 /nfs/dbraw/zinc/97/43/59/957974359.db2.gz DGNIYSKBGQDPFX-UHFFFAOYSA-N 1 2 234.284 2.240 20 0 BEADLO Cc1ccc(C)c(Nc2cncc(CO)c2)[nH+]1 ZINC001211103342 958030660 /nfs/dbraw/zinc/03/06/60/958030660.db2.gz RWDQEQIBCFVESR-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO CC[NH2+]Cc1noc([C@H]2CCCCS2)n1 ZINC000087682134 958038130 /nfs/dbraw/zinc/03/81/30/958038130.db2.gz DCVHGSAAQSBIMC-MRVPVSSYSA-N 1 2 227.333 2.137 20 0 BEADLO C=COc1ccc(NC(=O)Cc2c[nH]c[nH+]2)cc1 ZINC001299155763 958068108 /nfs/dbraw/zinc/06/81/08/958068108.db2.gz BLXZJNDTCNUHAC-UHFFFAOYSA-N 1 2 243.266 2.113 20 0 BEADLO COc1cnccc1-n1c(N)[nH+]c2ccccc21 ZINC001211257505 958119195 /nfs/dbraw/zinc/11/91/95/958119195.db2.gz ODNRWIOCRUCPKO-UHFFFAOYSA-N 1 2 240.266 2.011 20 0 BEADLO C[C@@H]1CC[N@@H+]1Cc1ncccc1Br ZINC000706777982 958195848 /nfs/dbraw/zinc/19/58/48/958195848.db2.gz UXYVEWYBEAOBLK-MRVPVSSYSA-N 1 2 241.132 2.438 20 0 BEADLO C[C@@H]1CC[N@H+]1Cc1ncccc1Br ZINC000706777982 958195861 /nfs/dbraw/zinc/19/58/61/958195861.db2.gz UXYVEWYBEAOBLK-MRVPVSSYSA-N 1 2 241.132 2.438 20 0 BEADLO Cc1c[nH+]cc(Nc2nc(N)cnc2Cl)c1C ZINC001213527367 958207557 /nfs/dbraw/zinc/20/75/57/958207557.db2.gz HZMLOMABEDTTBW-UHFFFAOYSA-N 1 2 249.705 2.468 20 0 BEADLO Cc1c[nH+]cc(Nc2cccc(CO)n2)c1C ZINC001213527447 958213201 /nfs/dbraw/zinc/21/32/01/958213201.db2.gz LMTYDPPSXKWKTI-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO C[C@@H]1C[C@H](N[C@@H]2C[NH2+]CC2(F)F)CC(C)(C)C1 ZINC001246462167 972333315 /nfs/dbraw/zinc/33/33/15/972333315.db2.gz QXAQMHDSLXEQIX-OUAUKWLOSA-N 1 2 246.345 2.398 20 0 BEADLO C[C@@H]1CC[C@H](N[C@@H]2C[NH2+]CC2(F)F)C[C@H]1C ZINC001246464563 972339064 /nfs/dbraw/zinc/33/90/64/972339064.db2.gz RXBYGJUWDLVYRA-CHWFTXMASA-N 1 2 232.318 2.008 20 0 BEADLO C[C@@H]1CC[C@H]([NH2+][C@@H]2CNCC2(F)F)C[C@H]1C ZINC001246464563 972339067 /nfs/dbraw/zinc/33/90/67/972339067.db2.gz RXBYGJUWDLVYRA-CHWFTXMASA-N 1 2 232.318 2.008 20 0 BEADLO Cc1cc([NH+](C)C)ccc1NCc1cn[nH]c1 ZINC000693464458 958474178 /nfs/dbraw/zinc/47/41/78/958474178.db2.gz BUQVXMWNLMCBFN-UHFFFAOYSA-N 1 2 230.315 2.396 20 0 BEADLO Cc1nn(C)cc1C[N@@H+]1CC[C@](C)(F)[C@@H](F)C1 ZINC001204576135 958535029 /nfs/dbraw/zinc/53/50/29/958535029.db2.gz FIBFABKYPYNAMM-RYUDHWBXSA-N 1 2 243.301 2.001 20 0 BEADLO Cc1nn(C)cc1C[N@H+]1CC[C@](C)(F)[C@@H](F)C1 ZINC001204576135 958535046 /nfs/dbraw/zinc/53/50/46/958535046.db2.gz FIBFABKYPYNAMM-RYUDHWBXSA-N 1 2 243.301 2.001 20 0 BEADLO Cc1c(F)cc(F)cc1C[NH+]1CC(C)(CO)C1 ZINC001143757766 972363194 /nfs/dbraw/zinc/36/31/94/972363194.db2.gz MMFPXCPILIHZTB-UHFFFAOYSA-N 1 2 241.281 2.087 20 0 BEADLO c1cn(CCO[C@H]2COCc3ccccc32)c[nH+]1 ZINC001222134533 972379952 /nfs/dbraw/zinc/37/99/52/972379952.db2.gz FXFIYQZCEMWJSR-AWEZNQCLSA-N 1 2 244.294 2.171 20 0 BEADLO CC(=O)[C@H](OCCn1cc[nH+]c1)c1ccccc1 ZINC001222138946 972387124 /nfs/dbraw/zinc/38/71/24/972387124.db2.gz MLWMCMHINKONOX-AWEZNQCLSA-N 1 2 244.294 2.230 20 0 BEADLO COC(C)(C)C[C@@H](C)OCCn1cc[nH+]c1 ZINC001222138808 972389790 /nfs/dbraw/zinc/38/97/90/972389790.db2.gz KOKSFISLCOTVGQ-LLVKDONJSA-N 1 2 226.320 2.103 20 0 BEADLO Nc1cc(CNc2cccc3c2OCC3)cc[nH+]1 ZINC001167616325 959081978 /nfs/dbraw/zinc/08/19/78/959081978.db2.gz GFJHACOWAWBTBR-UHFFFAOYSA-N 1 2 241.294 2.211 20 0 BEADLO COCc1ccc(NCc2cc[nH+]c(N)c2)cc1 ZINC001167617219 959083712 /nfs/dbraw/zinc/08/37/12/959083712.db2.gz WZNCIKRNTGSMLY-UHFFFAOYSA-N 1 2 243.310 2.422 20 0 BEADLO Cc1ncnc(Cl)c1NCc1cc[nH+]c(N)c1 ZINC001167617451 959093558 /nfs/dbraw/zinc/09/35/58/959093558.db2.gz NLJOHIJRMYSIBF-UHFFFAOYSA-N 1 2 249.705 2.028 20 0 BEADLO Cc1cc(C)cc(NC(=O)C[C@H]([NH3+])C(F)F)c1 ZINC000724762665 959304856 /nfs/dbraw/zinc/30/48/56/959304856.db2.gz SCEWLHQRCDSJMF-JTQLQIEISA-N 1 2 242.269 2.224 20 0 BEADLO C[C@H](NC(=O)C[C@H]([NH3+])C(F)F)C1CCCCC1 ZINC000724754634 959367625 /nfs/dbraw/zinc/36/76/25/959367625.db2.gz DYAQQRHMLKPYSD-WPRPVWTQSA-N 1 2 248.317 2.054 20 0 BEADLO c1ccc2c(C[NH2+]CCOC3CCC3)n[nH]c2c1 ZINC000694019144 959674073 /nfs/dbraw/zinc/67/40/73/959674073.db2.gz OPBCXWRAHNCHSK-UHFFFAOYSA-N 1 2 245.326 2.222 20 0 BEADLO Fc1ccc(F)c(O[C@@H]2CC[NH2+]CC2(F)F)c1 ZINC001218007480 959830062 /nfs/dbraw/zinc/83/00/62/959830062.db2.gz QQAYWKRAUIUBOS-SNVBAGLBSA-N 1 2 249.207 2.341 20 0 BEADLO CCCN(CC1CC1)C(=O)[C@H](C)n1cc[nH+]c1 ZINC000056482580 959963480 /nfs/dbraw/zinc/96/34/80/959963480.db2.gz NPMUNUKGLNVOGT-NSHDSACASA-N 1 2 235.331 2.093 20 0 BEADLO OC1(C[NH2+]CC(F)(F)C(F)F)CCCCC1 ZINC000230690608 960123959 /nfs/dbraw/zinc/12/39/59/960123959.db2.gz BUGLMGQIFQMHHC-UHFFFAOYSA-N 1 2 243.244 2.172 20 0 BEADLO C[C@H](NC(=O)[C@H](C)n1cc[nH+]c1)c1ccsc1 ZINC001327188024 972485846 /nfs/dbraw/zinc/48/58/46/972485846.db2.gz OWGRQMBNYYXXHM-UWVGGRQHSA-N 1 2 249.339 2.383 20 0 BEADLO CSc1cc(NC(C)(C)CCO)nc(C)[nH+]1 ZINC001167735102 960283373 /nfs/dbraw/zinc/28/33/73/960283373.db2.gz XYJLVEXMCBOONF-UHFFFAOYSA-N 1 2 241.360 2.080 20 0 BEADLO CC(C)(CCO)Nc1[nH+]cccc1-n1cccc1 ZINC001167741138 960390219 /nfs/dbraw/zinc/39/02/19/960390219.db2.gz PLRIPCYCQWJITN-UHFFFAOYSA-N 1 2 245.326 2.445 20 0 BEADLO CC(C)(O)C=CNc1cccc2[nH+]ccn21 ZINC001203210084 960575477 /nfs/dbraw/zinc/57/54/77/960575477.db2.gz VAMQOJYDZUTPLZ-VOTSOKGWSA-N 1 2 217.272 2.031 20 0 BEADLO C[C@H]1C[NH+](Cc2c[nH]c3ccncc23)C[C@H](C)O1 ZINC001140799385 960578287 /nfs/dbraw/zinc/57/82/87/960578287.db2.gz BNWNOGQAUYKBFQ-QWRGUYRKSA-N 1 2 245.326 2.172 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1c[nH]c2ccncc12 ZINC001140804906 960604673 /nfs/dbraw/zinc/60/46/73/960604673.db2.gz JXGRCRKFDXGIKG-GFCCVEGCSA-N 1 2 245.326 2.174 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1c[nH]c2ccncc12 ZINC001140804906 960604684 /nfs/dbraw/zinc/60/46/84/960604684.db2.gz JXGRCRKFDXGIKG-GFCCVEGCSA-N 1 2 245.326 2.174 20 0 BEADLO COc1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001140823491 960611223 /nfs/dbraw/zinc/61/12/23/960611223.db2.gz KCOPBHYGGLYZJT-UHFFFAOYSA-N 1 2 201.216 2.035 20 0 BEADLO CC[N@H+](Cc1cc(C)n[nH]1)Cc1cccnc1 ZINC001203077003 960687450 /nfs/dbraw/zinc/68/74/50/960687450.db2.gz NPFJHTAFLOSUNX-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CC[N@@H+](Cc1cc(C)n[nH]1)Cc1cccnc1 ZINC001203077003 960687456 /nfs/dbraw/zinc/68/74/56/960687456.db2.gz NPFJHTAFLOSUNX-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO COC1=CC[C@@H](OCc2c[nH+]cn2C)CC1 ZINC001222601115 960721151 /nfs/dbraw/zinc/72/11/51/960721151.db2.gz YCUOOEOKNNXHDD-GFCCVEGCSA-N 1 2 222.288 2.020 20 0 BEADLO C[C@@H](OCc1c[nH+]cn1C)c1cccnc1F ZINC001222601103 960722335 /nfs/dbraw/zinc/72/23/35/960722335.db2.gz XXHGDPHIWUFQFR-SECBINFHSA-N 1 2 235.262 2.232 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccc(C)nc2)[nH]n1 ZINC001203081340 960732223 /nfs/dbraw/zinc/73/22/23/960732223.db2.gz PFBHGHLOYFVYHX-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccc(C)nc2)[nH]n1 ZINC001203081340 960732232 /nfs/dbraw/zinc/73/22/32/960732232.db2.gz PFBHGHLOYFVYHX-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1ncccc1C[N@@H+](C)Cc1nccnc1C ZINC001140940248 960735817 /nfs/dbraw/zinc/73/58/17/960735817.db2.gz UWGBVBKEXNZRRV-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ncccc1C[N@H+](C)Cc1nccnc1C ZINC001140940248 960735834 /nfs/dbraw/zinc/73/58/34/960735834.db2.gz UWGBVBKEXNZRRV-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO C[N@H+](CCF)Cc1cc(F)c(O)c(F)c1 ZINC001140994242 960791920 /nfs/dbraw/zinc/79/19/20/960791920.db2.gz MVEKYVRJEIPIQD-UHFFFAOYSA-N 1 2 219.206 2.072 20 0 BEADLO C[N@@H+](CCF)Cc1cc(F)c(O)c(F)c1 ZINC001140994242 960791939 /nfs/dbraw/zinc/79/19/39/960791939.db2.gz MVEKYVRJEIPIQD-UHFFFAOYSA-N 1 2 219.206 2.072 20 0 BEADLO C[C@H]1CC[N@@H+]1Cc1c[nH]nc1C(F)(F)F ZINC001141012272 960816898 /nfs/dbraw/zinc/81/68/98/960816898.db2.gz XUMGRGJZYXCXPY-LURJTMIESA-N 1 2 219.210 2.023 20 0 BEADLO C[C@H]1CC[N@H+]1Cc1c[nH]nc1C(F)(F)F ZINC001141012272 960816899 /nfs/dbraw/zinc/81/68/99/960816899.db2.gz XUMGRGJZYXCXPY-LURJTMIESA-N 1 2 219.210 2.023 20 0 BEADLO Cc1cccc(CC[N@@H+]2Cc3cncnc3C2)c1 ZINC001207533289 960835971 /nfs/dbraw/zinc/83/59/71/960835971.db2.gz XYMADUODMRDJRH-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1cccc(CC[N@H+]2Cc3cncnc3C2)c1 ZINC001207533289 960835976 /nfs/dbraw/zinc/83/59/76/960835976.db2.gz XYMADUODMRDJRH-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1ncoc1C[N@@H+]1CCC(=O)[C@H]2CCCC[C@H]21 ZINC001141050603 960838660 /nfs/dbraw/zinc/83/86/60/960838660.db2.gz DXAICJQCSUHMFT-NWDGAFQWSA-N 1 2 248.326 2.317 20 0 BEADLO Cc1ncoc1C[N@H+]1CCC(=O)[C@H]2CCCC[C@H]21 ZINC001141050603 960838668 /nfs/dbraw/zinc/83/86/68/960838668.db2.gz DXAICJQCSUHMFT-NWDGAFQWSA-N 1 2 248.326 2.317 20 0 BEADLO Cc1ncoc1C[NH+]1CC2(C1)CC(F)(F)C2 ZINC001141051342 960842074 /nfs/dbraw/zinc/84/20/74/960842074.db2.gz ZZCCJNDQFALONF-UHFFFAOYSA-N 1 2 228.242 2.214 20 0 BEADLO CCCCc1[nH]cc(CN2C[C@@H](F)[C@@H](F)C2)[nH+]1 ZINC001141067749 960862080 /nfs/dbraw/zinc/86/20/80/960862080.db2.gz MMVSXICCLLXNKG-PHIMTYICSA-N 1 2 243.301 2.244 20 0 BEADLO CCCCc1[nH]c(CN2C[C@@H](F)[C@@H](F)C2)c[nH+]1 ZINC001141067749 960862076 /nfs/dbraw/zinc/86/20/76/960862076.db2.gz MMVSXICCLLXNKG-PHIMTYICSA-N 1 2 243.301 2.244 20 0 BEADLO COc1c(F)cccc1C[N@@H+]1CC[C@H](F)C1 ZINC001143521791 960895679 /nfs/dbraw/zinc/89/56/79/960895679.db2.gz HXBUDKWNIFLJQD-JTQLQIEISA-N 1 2 227.254 2.378 20 0 BEADLO COc1c(F)cccc1C[N@H+]1CC[C@H](F)C1 ZINC001143521791 960895681 /nfs/dbraw/zinc/89/56/81/960895681.db2.gz HXBUDKWNIFLJQD-JTQLQIEISA-N 1 2 227.254 2.378 20 0 BEADLO c1coc(C[N@H+](Cc2cn[nH]c2)C2CC2)c1 ZINC001203099695 960913354 /nfs/dbraw/zinc/91/33/54/960913354.db2.gz RPRRZMKQOBUHHJ-UHFFFAOYSA-N 1 2 217.272 2.167 20 0 BEADLO c1coc(C[N@@H+](Cc2cn[nH]c2)C2CC2)c1 ZINC001203099695 960913397 /nfs/dbraw/zinc/91/33/97/960913397.db2.gz RPRRZMKQOBUHHJ-UHFFFAOYSA-N 1 2 217.272 2.167 20 0 BEADLO Cc1ccc(C[N@@H+]2CCOC3(CC3)C2)c(F)c1 ZINC001141195172 960920847 /nfs/dbraw/zinc/92/08/47/960920847.db2.gz CUCHETJZIYKBOJ-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1ccc(C[N@H+]2CCOC3(CC3)C2)c(F)c1 ZINC001141195172 960920859 /nfs/dbraw/zinc/92/08/59/960920859.db2.gz CUCHETJZIYKBOJ-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO C[N@H+](Cc1ccc2cc(F)ccc2n1)C1COC1 ZINC001141648967 961130419 /nfs/dbraw/zinc/13/04/19/961130419.db2.gz NFVQWMYURCPDNP-UHFFFAOYSA-N 1 2 246.285 2.205 20 0 BEADLO C[N@@H+](Cc1ccc2cc(F)ccc2n1)C1COC1 ZINC001141648967 961130448 /nfs/dbraw/zinc/13/04/48/961130448.db2.gz NFVQWMYURCPDNP-UHFFFAOYSA-N 1 2 246.285 2.205 20 0 BEADLO CSc1ccc(C[N@H+](C)CC(C)=O)s1 ZINC001142018261 961220819 /nfs/dbraw/zinc/22/08/19/961220819.db2.gz BEHNKHKELKYAFQ-UHFFFAOYSA-N 1 2 229.370 2.491 20 0 BEADLO CSc1ccc(C[N@@H+](C)CC(C)=O)s1 ZINC001142018261 961220833 /nfs/dbraw/zinc/22/08/33/961220833.db2.gz BEHNKHKELKYAFQ-UHFFFAOYSA-N 1 2 229.370 2.491 20 0 BEADLO Cc1cc(CO[C@@H]2C(=O)OCC2(C)C)cc(C)[nH+]1 ZINC001223418904 961300244 /nfs/dbraw/zinc/30/02/44/961300244.db2.gz CQSRUNCLXWLUOM-GFCCVEGCSA-N 1 2 249.310 2.167 20 0 BEADLO COc1nc(NC=[NH2+])cc2cc(F)ccc21 ZINC001167865315 961340402 /nfs/dbraw/zinc/34/04/02/961340402.db2.gz ORLSFLFWHQQUPA-UHFFFAOYSA-N 1 2 219.219 2.401 20 0 BEADLO Cc1nc(NC(C)(C)CCO)cc(C(C)C)[nH+]1 ZINC000709807794 961619542 /nfs/dbraw/zinc/61/95/42/961619542.db2.gz GDJLPXHOWIEAPE-UHFFFAOYSA-N 1 2 237.347 2.481 20 0 BEADLO Cc1nc(N2CC[C@@H](C)[C@H](O)C2)cc(C(C)C)[nH+]1 ZINC000709831485 961674152 /nfs/dbraw/zinc/67/41/52/961674152.db2.gz PZSHBBLLUYBTHA-ZWNOBZJWSA-N 1 2 249.358 2.116 20 0 BEADLO O[C@H]1C[N@H+](Cc2csc(Cl)c2)CC[C@@H]1F ZINC001142760650 961707802 /nfs/dbraw/zinc/70/78/02/961707802.db2.gz ZQHZZSXMJWZMNJ-IUCAKERBSA-N 1 2 249.738 2.306 20 0 BEADLO O[C@H]1C[N@@H+](Cc2csc(Cl)c2)CC[C@@H]1F ZINC001142760650 961707821 /nfs/dbraw/zinc/70/78/21/961707821.db2.gz ZQHZZSXMJWZMNJ-IUCAKERBSA-N 1 2 249.738 2.306 20 0 BEADLO C[C@@H](CCCC(C)(C)O)CC[N@@H+]1CCC(=O)C1 ZINC001207671224 961743816 /nfs/dbraw/zinc/74/38/16/961743816.db2.gz ULOKFGLLGLQPBT-LBPRGKRZSA-N 1 2 241.375 2.229 20 0 BEADLO C[C@@H](CCCC(C)(C)O)CC[N@H+]1CCC(=O)C1 ZINC001207671224 961743834 /nfs/dbraw/zinc/74/38/34/961743834.db2.gz ULOKFGLLGLQPBT-LBPRGKRZSA-N 1 2 241.375 2.229 20 0 BEADLO CN(Cc1ccc2[nH+]ccn2c1)CC(F)(F)F ZINC001143019115 961864950 /nfs/dbraw/zinc/86/49/50/961864950.db2.gz XMWUNKIQWGZULJ-UHFFFAOYSA-N 1 2 243.232 2.328 20 0 BEADLO C[C@H](C(=O)N1CC[C@@H]2CCCC[C@@H]21)n1cc[nH+]c1 ZINC001143209867 961951355 /nfs/dbraw/zinc/95/13/55/961951355.db2.gz WGNMXAANKAKGSC-AGIUHOORSA-N 1 2 247.342 2.235 20 0 BEADLO CCCCCOC(=O)C[NH2+][C@@H]1C[C@H]2C[C@H]2C1 ZINC001167923470 961985163 /nfs/dbraw/zinc/98/51/63/961985163.db2.gz FFRHGLJOOQZANL-ZSBIGDGJSA-N 1 2 225.332 2.108 20 0 BEADLO CCOC(=O)[C@H]1CC[C@H](Oc2cc[nH+]cc2)C1 ZINC001225295668 962067134 /nfs/dbraw/zinc/06/71/34/962067134.db2.gz NHRCEHWYGRHQAX-JQWIXIFHSA-N 1 2 235.283 2.192 20 0 BEADLO CCC/C=C\C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000729371891 962184294 /nfs/dbraw/zinc/18/42/94/962184294.db2.gz NODOZTQVKLRJBR-IRBQFCFKSA-N 1 2 247.342 2.403 20 0 BEADLO COCc1cc[nH+]c(NCc2cnoc2C)c1 ZINC001154884865 962875477 /nfs/dbraw/zinc/87/54/77/962875477.db2.gz YVNWBLCQJAQFEZ-UHFFFAOYSA-N 1 2 233.271 2.137 20 0 BEADLO COc1cc(C)c[nH+]c1NC[C@H](O)c1ccco1 ZINC001154878308 962879399 /nfs/dbraw/zinc/87/93/99/962879399.db2.gz ODBOGGWGEPLENV-JTQLQIEISA-N 1 2 248.282 2.137 20 0 BEADLO COc1cc(C)c[nH+]c1NC[C@@H](O)c1ccco1 ZINC001154878309 962880717 /nfs/dbraw/zinc/88/07/17/962880717.db2.gz ODBOGGWGEPLENV-SNVBAGLBSA-N 1 2 248.282 2.137 20 0 BEADLO Cc1cc(Cl)c(C)c(NCc2ncon2)[nH+]1 ZINC001154896163 962887949 /nfs/dbraw/zinc/88/79/49/962887949.db2.gz JTGDIZUORUOWTA-UHFFFAOYSA-N 1 2 238.678 2.347 20 0 BEADLO C=Cc1ccc(NCCC(=O)N(C)C2CC2)[nH+]c1 ZINC001155156904 962997167 /nfs/dbraw/zinc/99/71/67/962997167.db2.gz SCMAGJCCHXEMCF-UHFFFAOYSA-N 1 2 245.326 2.147 20 0 BEADLO CC(C)(C)C(=[NH2+])Nc1cncc(-n2ccnc2)n1 ZINC001155179689 962999138 /nfs/dbraw/zinc/99/91/38/962999138.db2.gz BZFCGXBLIHEXSE-UHFFFAOYSA-N 1 2 244.302 2.098 20 0 BEADLO CCNC(=O)c1cccnc1NC(=[NH2+])C(C)(C)C ZINC001155180448 963007715 /nfs/dbraw/zinc/00/77/15/963007715.db2.gz YOSWAJXNEJDLDN-UHFFFAOYSA-N 1 2 248.330 2.267 20 0 BEADLO COc1c[nH+]c(NCc2cccn2C)c(C)c1 ZINC001155212378 963026311 /nfs/dbraw/zinc/02/63/11/963026311.db2.gz CJQMMJJXAWJSNS-UHFFFAOYSA-N 1 2 231.299 2.349 20 0 BEADLO Cc1ccc(CN2CCC(F)(F)[C@H]([NH3+])C2)cc1 ZINC001206654763 963035033 /nfs/dbraw/zinc/03/50/33/963035033.db2.gz DDKPDGAAWNKIGA-GFCCVEGCSA-N 1 2 240.297 2.163 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(F)(F)[C@@H](N)C2)oc1C ZINC001206654906 963040074 /nfs/dbraw/zinc/04/00/74/963040074.db2.gz FKXIQDZQOXOWPJ-NSHDSACASA-N 1 2 244.285 2.065 20 0 BEADLO Cc1cc(C[N@H+]2CCC(F)(F)[C@@H](N)C2)oc1C ZINC001206654906 963040085 /nfs/dbraw/zinc/04/00/85/963040085.db2.gz FKXIQDZQOXOWPJ-NSHDSACASA-N 1 2 244.285 2.065 20 0 BEADLO Cc1ccc(CN2CCC(F)(F)[C@H]([NH3+])C2)s1 ZINC001206655269 963077107 /nfs/dbraw/zinc/07/71/07/963077107.db2.gz GIVCYWDDOIJNSY-SNVBAGLBSA-N 1 2 246.326 2.225 20 0 BEADLO Cc1cc(F)cc(C[N@@H+]2CCO[C@H](C)C2)c1 ZINC001143580411 963158680 /nfs/dbraw/zinc/15/86/80/963158680.db2.gz IXHXVXPCDIJOLN-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cc(F)cc(C[N@H+]2CCO[C@H](C)C2)c1 ZINC001143580411 963158692 /nfs/dbraw/zinc/15/86/92/963158692.db2.gz IXHXVXPCDIJOLN-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO CO[C@@H]1C[N@H+](Cc2cc(C)cc(F)c2)C[C@@H]1F ZINC001143580710 963170884 /nfs/dbraw/zinc/17/08/84/963170884.db2.gz SWSDMPCHVBOPJD-QWHCGFSZSA-N 1 2 241.281 2.303 20 0 BEADLO CO[C@@H]1C[N@@H+](Cc2cc(C)cc(F)c2)C[C@@H]1F ZINC001143580710 963170889 /nfs/dbraw/zinc/17/08/89/963170889.db2.gz SWSDMPCHVBOPJD-QWHCGFSZSA-N 1 2 241.281 2.303 20 0 BEADLO c1cn(CCCNc2cnc(C3CC3)nc2)c[nH+]1 ZINC001161684948 963205363 /nfs/dbraw/zinc/20/53/63/963205363.db2.gz YVZZAJIQYVCYQS-UHFFFAOYSA-N 1 2 243.314 2.053 20 0 BEADLO CC[C@H](C)Nc1ccc2c([nH+]1)CCOC2 ZINC001167998837 963207972 /nfs/dbraw/zinc/20/79/72/963207972.db2.gz KVCVBHDRFFUHIN-VIFPVBQESA-N 1 2 206.289 2.365 20 0 BEADLO COC(C)(C)CNc1ccc(Cl)c(N)[nH+]1 ZINC001156440098 963349512 /nfs/dbraw/zinc/34/95/12/963349512.db2.gz SOQBLXOZFZPGRS-UHFFFAOYSA-N 1 2 229.711 2.154 20 0 BEADLO CCc1[nH]c(CNC(=O)C(C)(C)C(C)C)c[nH+]1 ZINC001156538612 963378962 /nfs/dbraw/zinc/37/89/62/963378962.db2.gz YKGJWMXCZGHBJP-UHFFFAOYSA-N 1 2 237.347 2.271 20 0 BEADLO CCc1[nH]cc(CNC(=O)C(C)(C)C(C)C)[nH+]1 ZINC001156538612 963378973 /nfs/dbraw/zinc/37/89/73/963378973.db2.gz YKGJWMXCZGHBJP-UHFFFAOYSA-N 1 2 237.347 2.271 20 0 BEADLO CSCc1ccc(NCc2cncnc2)[nH+]c1 ZINC001156573676 963389391 /nfs/dbraw/zinc/38/93/91/963389391.db2.gz QHJUQGRETAXEHD-UHFFFAOYSA-N 1 2 246.339 2.347 20 0 BEADLO CSCc1cc[nH+]c(NCc2cccnn2)c1 ZINC001156610086 963406233 /nfs/dbraw/zinc/40/62/33/963406233.db2.gz CROILXXKJKENFP-UHFFFAOYSA-N 1 2 246.339 2.347 20 0 BEADLO Cc1nc(Cl)cc(NCc2cc[nH+]c(N)c2)n1 ZINC001156755483 963452976 /nfs/dbraw/zinc/45/29/76/963452976.db2.gz CGFPRQSEXOZSDK-UHFFFAOYSA-N 1 2 249.705 2.028 20 0 BEADLO CC(C)c1cc(NCc2cc[nH+]c(N)c2)ncn1 ZINC001156757054 963454396 /nfs/dbraw/zinc/45/43/96/963454396.db2.gz JEGVMVDQHUJZSV-UHFFFAOYSA-N 1 2 243.314 2.189 20 0 BEADLO Nc1cc(CNc2ccc3occc3n2)cc[nH+]1 ZINC001156756849 963454488 /nfs/dbraw/zinc/45/44/88/963454488.db2.gz IEGIVFXLHZLFCX-UHFFFAOYSA-N 1 2 240.266 2.417 20 0 BEADLO COc1ccc(C)[nH+]c1N1CC2CC(C2)C1 ZINC001156892696 963482663 /nfs/dbraw/zinc/48/26/63/963482663.db2.gz QVKJZQZXYBQIFA-UHFFFAOYSA-N 1 2 218.300 2.245 20 0 BEADLO Cc1c(F)cc[nH+]c1NC1(CO)CCCC1 ZINC001157003948 963515256 /nfs/dbraw/zinc/51/52/56/963515256.db2.gz ODJWIWHEHIFYRO-UHFFFAOYSA-N 1 2 224.279 2.246 20 0 BEADLO CNc1ncccc1C[N@H+](C)Cc1cccnc1 ZINC000052721199 963515942 /nfs/dbraw/zinc/51/59/42/963515942.db2.gz DZNSYCIJNIOLCF-UHFFFAOYSA-N 1 2 242.326 2.150 20 0 BEADLO CNc1ncccc1C[N@@H+](C)Cc1cccnc1 ZINC000052721199 963515949 /nfs/dbraw/zinc/51/59/49/963515949.db2.gz DZNSYCIJNIOLCF-UHFFFAOYSA-N 1 2 242.326 2.150 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)c2ccccc2)[nH+]1 ZINC001157120285 963535739 /nfs/dbraw/zinc/53/57/39/963535739.db2.gz UABVGTMNOZGXLW-UHFFFAOYSA-N 1 2 243.310 2.463 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)c2ccccc2)c[nH+]1 ZINC001157120285 963535744 /nfs/dbraw/zinc/53/57/44/963535744.db2.gz UABVGTMNOZGXLW-UHFFFAOYSA-N 1 2 243.310 2.463 20 0 BEADLO Cc1nc(N2CCC[C@H]3C[C@H]32)c2c([nH+]1)CCC2 ZINC001157143855 963545319 /nfs/dbraw/zinc/54/53/19/963545319.db2.gz OFPNYEOETNOWBD-GXFFZTMASA-N 1 2 229.327 2.262 20 0 BEADLO CCCNc1[nH+]cccc1/C=C/C(=O)OCC ZINC001157358124 963581522 /nfs/dbraw/zinc/58/15/22/963581522.db2.gz KISIBRIFHHJEEG-BQYQJAHWSA-N 1 2 234.299 2.480 20 0 BEADLO C[C@H]1C[C@@H]([NH2+]CC(F)(F)C(F)(F)F)CCO1 ZINC001168072662 963602080 /nfs/dbraw/zinc/60/20/80/963602080.db2.gz VXDKRICAZSCEND-BQBZGAKWSA-N 1 2 247.207 2.341 20 0 BEADLO CCc1cc(C[N@@H+]2C[C@@H](F)C[C@H]2C)on1 ZINC001203212470 963649975 /nfs/dbraw/zinc/64/99/75/963649975.db2.gz NWCLTPKVYPMIAS-BDAKNGLRSA-N 1 2 212.268 2.169 20 0 BEADLO Cc1nc(NCC2CC(=O)C2)cc(C(C)C)[nH+]1 ZINC001157606208 963674562 /nfs/dbraw/zinc/67/45/62/963674562.db2.gz WESJAHZEMVBBDH-UHFFFAOYSA-N 1 2 233.315 2.299 20 0 BEADLO COc1cc(C)c[nH+]c1NC[C@@H]1CC(C)(C)O1 ZINC001157659387 963693183 /nfs/dbraw/zinc/69/31/83/963693183.db2.gz CRFRRAFALVJEPK-JTQLQIEISA-N 1 2 236.315 2.378 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1CC(C)(C)O1 ZINC001157662971 963694544 /nfs/dbraw/zinc/69/45/44/963694544.db2.gz OOZFNIYLPWTUMC-VIFPVBQESA-N 1 2 222.288 2.070 20 0 BEADLO COc1c[nH+]c(NC[C@H]2CC(C)(C)O2)c(C)c1 ZINC001157662316 963695018 /nfs/dbraw/zinc/69/50/18/963695018.db2.gz DBIZRTXLGXAPPX-LLVKDONJSA-N 1 2 236.315 2.378 20 0 BEADLO CCCNc1ccc([C@H](C)C(=O)OC)c[nH+]1 ZINC001168132227 963820721 /nfs/dbraw/zinc/82/07/21/963820721.db2.gz LQKSGOZXKQAKEF-VIFPVBQESA-N 1 2 222.288 2.180 20 0 BEADLO C[C@H](C(=O)N(C)c1ccccc1)n1cc[nH+]c1 ZINC000053898551 963843001 /nfs/dbraw/zinc/84/30/01/963843001.db2.gz NZHUBDNHHOKLOY-LLVKDONJSA-N 1 2 229.283 2.107 20 0 BEADLO CC(C)c1ccc(N(C)[C@H]2CCOC2)[nH+]c1 ZINC001158574947 963890334 /nfs/dbraw/zinc/89/03/34/963890334.db2.gz QRYIKUOTTHDQEE-LBPRGKRZSA-N 1 2 220.316 2.430 20 0 BEADLO COc1cc(C)c[nH+]c1N[C@H](C)c1cnccn1 ZINC001158596747 963893130 /nfs/dbraw/zinc/89/31/30/963893130.db2.gz KBGYFXHYCVPKAS-SNVBAGLBSA-N 1 2 244.298 2.362 20 0 BEADLO Nc1ccc(N2Cc3cnc(Cl)cc3C2)[nH+]c1 ZINC001158754549 963915532 /nfs/dbraw/zinc/91/55/32/963915532.db2.gz WFLZPQZZNHNPOD-UHFFFAOYSA-N 1 2 246.701 2.232 20 0 BEADLO CN(CC(F)F)c1ccc(Cl)c(N)[nH+]1 ZINC001158934122 963964227 /nfs/dbraw/zinc/96/42/27/963964227.db2.gz KIFNSVCWTJVGQY-UHFFFAOYSA-N 1 2 221.638 2.019 20 0 BEADLO COc1ccc2c(c1)C[C@@H]([NH2+][C@H]1CC1(F)F)C2 ZINC001168228711 964010846 /nfs/dbraw/zinc/01/08/46/964010846.db2.gz ISDRJQAOMPZEKK-JQWIXIFHSA-N 1 2 239.265 2.160 20 0 BEADLO Cc1c(F)cc[nH+]c1N[C@H]1CCOC[C@@H]1C ZINC001159711876 964163991 /nfs/dbraw/zinc/16/39/91/964163991.db2.gz URGFZQMNQNHODH-KWQFWETISA-N 1 2 224.279 2.366 20 0 BEADLO Fc1ccc(-c2noc(C[NH+]3CCC3)n2)cc1 ZINC001212095617 964252213 /nfs/dbraw/zinc/25/22/13/964252213.db2.gz QADQHROTTJYGRO-UHFFFAOYSA-N 1 2 233.246 2.081 20 0 BEADLO CC(=O)CC(C)(C)Nc1ccc(Cl)c(N)[nH+]1 ZINC001160301253 964279789 /nfs/dbraw/zinc/27/97/89/964279789.db2.gz USKUMWRJVQXEIZ-UHFFFAOYSA-N 1 2 241.722 2.487 20 0 BEADLO Cc1nc(NCC[C@@H](C)CO)cc(C(C)C)[nH+]1 ZINC001160602372 964353462 /nfs/dbraw/zinc/35/34/62/964353462.db2.gz JJHIUFLNLDZNBC-SNVBAGLBSA-N 1 2 237.347 2.339 20 0 BEADLO Fc1cncc(F)c1Nc1cccc2[nH+]c[nH]c21 ZINC001213025959 964399255 /nfs/dbraw/zinc/39/92/55/964399255.db2.gz BHZKDHFCWQSLFB-UHFFFAOYSA-N 1 2 246.220 2.402 20 0 BEADLO Cc1cc(Nc2cccc3[nH+]c[nH]c32)n(C)n1 ZINC001213026384 964408865 /nfs/dbraw/zinc/40/88/65/964408865.db2.gz WRMHDCUTHCKNOO-UHFFFAOYSA-N 1 2 227.271 2.348 20 0 BEADLO Cc1c(Nc2cccc3[nH+]c[nH]c32)cnn1C ZINC001213026365 964411499 /nfs/dbraw/zinc/41/14/99/964411499.db2.gz VVJAVDMGUCHHHH-UHFFFAOYSA-N 1 2 227.271 2.348 20 0 BEADLO Cc1ncc(Nc2cccc3[nH+]c[nH]c32)cn1 ZINC001213027138 964437615 /nfs/dbraw/zinc/43/76/15/964437615.db2.gz LACKJVLGKOTDOJ-UHFFFAOYSA-N 1 2 225.255 2.405 20 0 BEADLO COC(=O)[C@@H]1C[C@H](Nc2cccc[nH+]2)C1(C)C ZINC001168334386 964468003 /nfs/dbraw/zinc/46/80/03/964468003.db2.gz QCWPZVGITQMRJQ-UWVGGRQHSA-N 1 2 234.299 2.081 20 0 BEADLO COC(CN(C)c1[nH+]ccc2ccccc21)OC ZINC000714705430 964510237 /nfs/dbraw/zinc/51/02/37/964510237.db2.gz MPYUGHXRHZRZFF-UHFFFAOYSA-N 1 2 246.310 2.290 20 0 BEADLO Cc1cc2cc(NC3CSC3)[nH+]cc2[nH]1 ZINC001168362054 964623853 /nfs/dbraw/zinc/62/38/53/964623853.db2.gz KLRAPBKPTQITNN-UHFFFAOYSA-N 1 2 219.313 2.399 20 0 BEADLO Cc1cc(C)c(NCc2c[nH+]cn2C(C)C)nn1 ZINC001161563166 964644547 /nfs/dbraw/zinc/64/45/47/964644547.db2.gz QKXDLEOEGUECFX-UHFFFAOYSA-N 1 2 245.330 2.483 20 0 BEADLO COC(=O)Cc1ccc(NCC(C)(C)C)[nH+]c1 ZINC001161636747 964653517 /nfs/dbraw/zinc/65/35/17/964653517.db2.gz MGIWPQPRUIKVBZ-UHFFFAOYSA-N 1 2 236.315 2.255 20 0 BEADLO CC(C)CNc1[nH+]cnc2[nH]cc(F)c21 ZINC001161642364 964660657 /nfs/dbraw/zinc/66/06/57/964660657.db2.gz OSTVFMMQKKDAKX-UHFFFAOYSA-N 1 2 208.240 2.117 20 0 BEADLO c1cn(CCCNc2ccc3c(c2)NCC3)c[nH+]1 ZINC001161688889 964688589 /nfs/dbraw/zinc/68/85/89/964688589.db2.gz AYUCICMKBQKEDY-UHFFFAOYSA-N 1 2 242.326 2.353 20 0 BEADLO C=Cc1ccc(NCCc2nncs2)[nH+]c1 ZINC001161732298 964720834 /nfs/dbraw/zinc/72/08/34/964720834.db2.gz TUFQTXVXLIZFGW-UHFFFAOYSA-N 1 2 232.312 2.231 20 0 BEADLO CCN(C)c1cc(NCc2ccc(C)o2)[nH+]cn1 ZINC001161764663 964743371 /nfs/dbraw/zinc/74/33/71/964743371.db2.gz BRYUJFVTNIKNNB-UHFFFAOYSA-N 1 2 246.314 2.446 20 0 BEADLO CCN(C)c1cc(NCc2ccc(C)o2)nc[nH+]1 ZINC001161764663 964743375 /nfs/dbraw/zinc/74/33/75/964743375.db2.gz BRYUJFVTNIKNNB-UHFFFAOYSA-N 1 2 246.314 2.446 20 0 BEADLO COC(=[NH2+])c1cccc(NCCOC(C)C)c1 ZINC001161794549 964756383 /nfs/dbraw/zinc/75/63/83/964756383.db2.gz DTCZQPGPAGHJRB-UHFFFAOYSA-N 1 2 236.315 2.495 20 0 BEADLO Cn1c[nH+]cc1-c1cccc(NCC2COC2)c1 ZINC001161951598 964835883 /nfs/dbraw/zinc/83/58/83/964835883.db2.gz XPQCBONFHJIGGX-UHFFFAOYSA-N 1 2 243.310 2.145 20 0 BEADLO CSc1cc(NC2CC(F)C2)nc(C)[nH+]1 ZINC001162207762 964868221 /nfs/dbraw/zinc/86/82/21/964868221.db2.gz QQBAQBOUOFWNMT-UHFFFAOYSA-N 1 2 227.308 2.419 20 0 BEADLO O[C@H](CNc1cc2cc[nH]c2c[nH+]1)c1ccco1 ZINC001162247213 964891951 /nfs/dbraw/zinc/89/19/51/964891951.db2.gz KWOVCNHOKVMKIW-LLVKDONJSA-N 1 2 243.266 2.301 20 0 BEADLO COc1cc[nH+]cc1N[C@H]1CC[C@](C)(O)CC1 ZINC001162359722 964941620 /nfs/dbraw/zinc/94/16/20/964941620.db2.gz HXJHPYKIORADNA-MJHDQNEOSA-N 1 2 236.315 2.196 20 0 BEADLO Cn1c[nH+]cc1NC(C)(C)C(=O)c1ccccc1 ZINC001162634660 965078977 /nfs/dbraw/zinc/07/89/77/965078977.db2.gz JELPMUUDHZVPFR-UHFFFAOYSA-N 1 2 243.310 2.494 20 0 BEADLO COc1cc[nH+]cc1NCc1ccc(C)nc1 ZINC001162871270 965196979 /nfs/dbraw/zinc/19/69/79/965196979.db2.gz CZBGWMHCQSBQQI-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO Cc1cnnc(NCc2ccc3[nH+]ccn3c2)c1 ZINC001163136197 965262396 /nfs/dbraw/zinc/26/23/96/965262396.db2.gz BJLGVYCWCLUDLL-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO C[C@H](Nc1ccc(Cl)c(N)[nH+]1)c1ccno1 ZINC001163214379 965306303 /nfs/dbraw/zinc/30/63/03/965306303.db2.gz BOVLKGPJVUSXCV-LURJTMIESA-N 1 2 238.678 2.478 20 0 BEADLO CCN(Cc1c[nH+]c(C)[nH]1)Cc1ccccn1 ZINC001232464027 965358483 /nfs/dbraw/zinc/35/84/83/965358483.db2.gz SEKZENIFBMHVAS-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CCCN(CCOC)c1nc(C)[nH+]c2c1CCC2 ZINC001163647782 965493908 /nfs/dbraw/zinc/49/39/08/965493908.db2.gz MIKLZAXQWGWWGH-UHFFFAOYSA-N 1 2 249.358 2.137 20 0 BEADLO CNc1ccc(Nc2cncc(N(C)C)c2)c[nH+]1 ZINC001203449814 965495545 /nfs/dbraw/zinc/49/55/45/965495545.db2.gz LWNKOQRZEHXYKZ-UHFFFAOYSA-N 1 2 243.314 2.328 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H](C)C(C)C ZINC001121231072 965521346 /nfs/dbraw/zinc/52/13/46/965521346.db2.gz HOOANWVLHONDLZ-LLVKDONJSA-N 1 2 220.316 2.351 20 0 BEADLO COCC1CN(c2[nH+]ccc3ccccc32)C1 ZINC001163730521 965543905 /nfs/dbraw/zinc/54/39/05/965543905.db2.gz RBPIHHRMLSSXHU-UHFFFAOYSA-N 1 2 228.295 2.317 20 0 BEADLO Nc1ccc(N2CCC(=O)[C@H]3CCCC[C@@H]32)[nH+]c1 ZINC001163789111 965589251 /nfs/dbraw/zinc/58/92/51/965589251.db2.gz AIZKOWOZKBZENV-RYUDHWBXSA-N 1 2 245.326 2.002 20 0 BEADLO COc1c[nH+]c(NCCn2cc[nH+]c2C)cc1C ZINC001163920233 965633917 /nfs/dbraw/zinc/63/39/17/965633917.db2.gz SVDUPJBHFVQXBP-UHFFFAOYSA-N 1 2 246.314 2.016 20 0 BEADLO CCCN(CCC)c1cc(N2CC=CC2)nc[nH+]1 ZINC001163919344 965634408 /nfs/dbraw/zinc/63/44/08/965634408.db2.gz YATSCXBHQDWCMR-UHFFFAOYSA-N 1 2 246.358 2.479 20 0 BEADLO CCCN(CCC)c1cc(N2CC=CC2)[nH+]cn1 ZINC001163919344 965634413 /nfs/dbraw/zinc/63/44/13/965634413.db2.gz YATSCXBHQDWCMR-UHFFFAOYSA-N 1 2 246.358 2.479 20 0 BEADLO CCCc1cc(N2CCCO[C@H](C)C2)nc(C)[nH+]1 ZINC001163961883 965663221 /nfs/dbraw/zinc/66/32/21/965663221.db2.gz BFFMFWPAWALBDW-LLVKDONJSA-N 1 2 249.358 2.353 20 0 BEADLO CCc1nc(N2CC(F)(C3CC3)C2)cc(C)[nH+]1 ZINC001163972731 965669791 /nfs/dbraw/zinc/66/97/91/965669791.db2.gz XPKRGNWSAPBZEG-UHFFFAOYSA-N 1 2 235.306 2.286 20 0 BEADLO COc1cc(C)c[nH+]c1N1CC(F)(C2CC2)C1 ZINC001163969455 965670433 /nfs/dbraw/zinc/67/04/33/965670433.db2.gz ULAVAOVNUGSCPY-UHFFFAOYSA-N 1 2 236.290 2.337 20 0 BEADLO CCN(C)c1cc(NC2(C)CCC2)[nH+]cn1 ZINC001164024928 965699430 /nfs/dbraw/zinc/69/94/30/965699430.db2.gz FTTFWBZIJJNCKE-UHFFFAOYSA-N 1 2 220.320 2.287 20 0 BEADLO CCN(C)c1cc(NC2(C)CCC2)nc[nH+]1 ZINC001164024928 965699436 /nfs/dbraw/zinc/69/94/36/965699436.db2.gz FTTFWBZIJJNCKE-UHFFFAOYSA-N 1 2 220.320 2.287 20 0 BEADLO C[C@H]1C[C@@H](CO)N(c2cccc(C3CC3)[nH+]2)C1 ZINC001164154471 965763977 /nfs/dbraw/zinc/76/39/77/965763977.db2.gz HWGXNQVCGJYAAN-JQWIXIFHSA-N 1 2 232.327 2.166 20 0 BEADLO CCCNc1cc(N2CC[C@H]3C[C@H]3C2)nc[nH+]1 ZINC000699171205 965800073 /nfs/dbraw/zinc/80/00/73/965800073.db2.gz CXNKVWBHHDQYPF-QWRGUYRKSA-N 1 2 232.331 2.145 20 0 BEADLO CCCNc1cc(N2CC[C@H]3C[C@H]3C2)[nH+]cn1 ZINC000699171205 965800078 /nfs/dbraw/zinc/80/00/78/965800078.db2.gz CXNKVWBHHDQYPF-QWRGUYRKSA-N 1 2 232.331 2.145 20 0 BEADLO C[C@H]1CC[C@@H](CO)N1c1cccc(C2CC2)[nH+]1 ZINC001164309810 965839248 /nfs/dbraw/zinc/83/92/48/965839248.db2.gz DDVCBZRGCIFKNF-JQWIXIFHSA-N 1 2 232.327 2.309 20 0 BEADLO Cc1cc2cc(NCC3(CO)CCC3)[nH+]cc2[nH]1 ZINC001164357515 965857327 /nfs/dbraw/zinc/85/73/27/965857327.db2.gz HTLXKNRWIOHHRU-UHFFFAOYSA-N 1 2 245.326 2.446 20 0 BEADLO C[C@H](Cc1cccc(F)c1)[NH+]1CCC(=O)CC1 ZINC001168478623 965878565 /nfs/dbraw/zinc/87/85/65/965878565.db2.gz GUFDEBFQKNRTFP-LLVKDONJSA-N 1 2 235.302 2.422 20 0 BEADLO CN(C)c1ccc(NCCn2cccc2)[nH+]c1 ZINC001164454757 965890877 /nfs/dbraw/zinc/89/08/77/965890877.db2.gz CIDAKPPKBNKVDB-UHFFFAOYSA-N 1 2 230.315 2.061 20 0 BEADLO COc1cc(C)c[nH+]c1N1CC[C@]2(CCOC2)C1 ZINC001165254254 966012779 /nfs/dbraw/zinc/01/27/79/966012779.db2.gz NWFAKTZQZJZKDJ-AWEZNQCLSA-N 1 2 248.326 2.015 20 0 BEADLO Fc1c[nH+]ccc1NC1C[C@H]2CC[C@@H](C1)S2 ZINC000699645576 966024234 /nfs/dbraw/zinc/02/42/34/966024234.db2.gz DRKWJSBCLMVRFK-PBINXNQUSA-N 1 2 238.331 2.481 20 0 BEADLO Cc1c(F)cc[nH+]c1N1C[C@@H]2C[C@@H]2[C@H](F)C1 ZINC001165367396 966065414 /nfs/dbraw/zinc/06/54/14/966065414.db2.gz WHTVSAGIERECRC-ATZCPNFKSA-N 1 2 224.254 2.323 20 0 BEADLO C[C@@H]1COC[C@H]1Nc1[nH+]c2ccccc2n1C ZINC000699752087 966066389 /nfs/dbraw/zinc/06/63/89/966066389.db2.gz CTFIPHHPVOUWNK-MWLCHTKSSA-N 1 2 231.299 2.020 20 0 BEADLO COC(C)(C)CNc1cc(SC)[nH+]c(C)n1 ZINC001165792265 966158385 /nfs/dbraw/zinc/15/83/85/966158385.db2.gz PSXIRIAJYVZQHP-UHFFFAOYSA-N 1 2 241.360 2.344 20 0 BEADLO COc1cccc2[nH+]c(N[C@@H](C)CCO)ccc21 ZINC001165866246 966182396 /nfs/dbraw/zinc/18/23/96/966182396.db2.gz GGDJLCBOYQNSLX-JTQLQIEISA-N 1 2 246.310 2.426 20 0 BEADLO Cc1nc(N2C[C@@H]3C[C@H]2C[C@H]3F)c(C)c(C)[nH+]1 ZINC001166530370 966282518 /nfs/dbraw/zinc/28/25/18/966282518.db2.gz DUNHYSMEOYMAKM-SDDRHHMPSA-N 1 2 235.306 2.339 20 0 BEADLO O=C(Cn1c[nH+]c(Cc2ccccc2)c1)C1CC1 ZINC000919143291 966294440 /nfs/dbraw/zinc/29/44/40/966294440.db2.gz GJWZTWUFYGOIPI-UHFFFAOYSA-N 1 2 240.306 2.453 20 0 BEADLO OC1(CCn2c[nH+]c(Cc3ccccc3)c2)CC1 ZINC000919150581 966296611 /nfs/dbraw/zinc/29/66/11/966296611.db2.gz MOUUTHMKOLKEEI-UHFFFAOYSA-N 1 2 242.322 2.389 20 0 BEADLO Nc1ccc(-c2ccc3cnncc3c2)c[nH+]1 ZINC001236311315 966360634 /nfs/dbraw/zinc/36/06/34/966360634.db2.gz AEGNOWCCTZWTPX-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO c1ccc2cc(N3C[C@@H]4C[C@H]3CO4)[nH+]cc2c1 ZINC001166754358 966392920 /nfs/dbraw/zinc/39/29/20/966392920.db2.gz BYYCYHBTBXZZOQ-STQMWFEESA-N 1 2 226.279 2.212 20 0 BEADLO CCc1cn(C[C@@H]2CC[C@H](C3CC3)O2)c[nH+]1 ZINC001166822322 966426808 /nfs/dbraw/zinc/42/68/08/966426808.db2.gz KDLIQGKWEQEJBO-QWHCGFSZSA-N 1 2 220.316 2.403 20 0 BEADLO CCc1cn(CCOC2CCCC2)c[nH+]1 ZINC001166823021 966426935 /nfs/dbraw/zinc/42/69/35/966426935.db2.gz QRMSHWIWZAHSGB-UHFFFAOYSA-N 1 2 208.305 2.405 20 0 BEADLO CCc1cn(C[C@H](O)c2ccc(F)cc2)c[nH+]1 ZINC001166822251 966427605 /nfs/dbraw/zinc/42/76/05/966427605.db2.gz JYHCLWDSIRGDLN-ZDUSSCGKSA-N 1 2 234.274 2.318 20 0 BEADLO Cc1nc(N2CC(O)C2)cc(C2CCCCC2)[nH+]1 ZINC001166936418 966452351 /nfs/dbraw/zinc/45/23/51/966452351.db2.gz PHCYFXCRCLNRNM-UHFFFAOYSA-N 1 2 247.342 2.014 20 0 BEADLO CC(C)c1ccc(N2CC3(CCO3)C2)[nH+]c1 ZINC001166941183 966463305 /nfs/dbraw/zinc/46/33/05/966463305.db2.gz HOAHDGFTJCBCDS-UHFFFAOYSA-N 1 2 218.300 2.184 20 0 BEADLO CC(C)(C)c1ccc(N2CC3(CCO3)C2)[nH+]c1 ZINC001166942533 966465290 /nfs/dbraw/zinc/46/52/90/966465290.db2.gz HLBUNAXRRVCMGE-UHFFFAOYSA-N 1 2 232.327 2.358 20 0 BEADLO CN(CC1COC1)c1cc2ccccc2c[nH+]1 ZINC001166948106 966475104 /nfs/dbraw/zinc/47/51/04/966475104.db2.gz DKQMVQDTLNHUKP-UHFFFAOYSA-N 1 2 228.295 2.317 20 0 BEADLO Cc1ccc(O)cc1N(C)c1[nH+]cccc1N ZINC001214338896 966483416 /nfs/dbraw/zinc/48/34/16/966483416.db2.gz FVCLLERMQNYHQM-UHFFFAOYSA-N 1 2 229.283 2.446 20 0 BEADLO CCc1nc(N2CCOC[C@H]2C(C)C)cc(C)[nH+]1 ZINC001166999299 966512874 /nfs/dbraw/zinc/51/28/74/966512874.db2.gz KGKQBPCNOPJKTA-LBPRGKRZSA-N 1 2 249.358 2.209 20 0 BEADLO CCN(C)c1ccc(NC=CC(C)(C)O)c[nH+]1 ZINC001203216329 966562405 /nfs/dbraw/zinc/56/24/05/966562405.db2.gz JQABWYDVONFOFP-CMDGGOBGSA-N 1 2 235.331 2.234 20 0 BEADLO CCc1cc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)on1 ZINC001203219562 966566343 /nfs/dbraw/zinc/56/63/43/966566343.db2.gz VAHNRSMBVQMTSG-UWJYBYFXSA-N 1 2 224.279 2.027 20 0 BEADLO CCc1cc(C[N@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)on1 ZINC001203219562 966566351 /nfs/dbraw/zinc/56/63/51/966566351.db2.gz VAHNRSMBVQMTSG-UWJYBYFXSA-N 1 2 224.279 2.027 20 0 BEADLO Fc1ccccc1C[N@@H+]1CCCC12COC2 ZINC001203352278 966608930 /nfs/dbraw/zinc/60/89/30/966608930.db2.gz ADYLCJKZDUFCBH-UHFFFAOYSA-N 1 2 221.275 2.191 20 0 BEADLO Fc1ccccc1C[N@H+]1CCCC12COC2 ZINC001203352278 966608942 /nfs/dbraw/zinc/60/89/42/966608942.db2.gz ADYLCJKZDUFCBH-UHFFFAOYSA-N 1 2 221.275 2.191 20 0 BEADLO Cc1ccc(Nc2cncc(N)c2)c(C)[nH+]1 ZINC001203370540 966618354 /nfs/dbraw/zinc/61/83/54/966618354.db2.gz NPFIIDRFEYSYKL-UHFFFAOYSA-N 1 2 214.272 2.419 20 0 BEADLO CC(=O)c1nn(C)cc1Nc1ccc(C)[nH+]c1C ZINC001203370016 966619739 /nfs/dbraw/zinc/61/97/39/966619739.db2.gz WDBJXUWVIMFSCA-UHFFFAOYSA-N 1 2 244.298 2.378 20 0 BEADLO COCCn1cnc(Nc2ccc(C)[nH+]c2C)c1 ZINC001203369855 966621211 /nfs/dbraw/zinc/62/12/11/966621211.db2.gz UIQDFHZPRSVACK-UHFFFAOYSA-N 1 2 246.314 2.285 20 0 BEADLO COc1ncc(Nc2[nH+]cc(C)cc2N)cc1F ZINC001203400508 966637830 /nfs/dbraw/zinc/63/78/30/966637830.db2.gz JATIQHGYRJFBQS-UHFFFAOYSA-N 1 2 248.261 2.259 20 0 BEADLO CNc1ccc(Nc2cc(=O)[nH]cc2C)c[nH+]1 ZINC001203449548 966647188 /nfs/dbraw/zinc/64/71/88/966647188.db2.gz IORDMLSICVVQDB-UHFFFAOYSA-N 1 2 230.271 2.276 20 0 BEADLO CCc1nnc(Nc2ccc(NC)[nH+]c2)s1 ZINC001203447605 966647339 /nfs/dbraw/zinc/64/73/39/966647339.db2.gz MIOMNPVWTJPIDL-UHFFFAOYSA-N 1 2 235.316 2.281 20 0 BEADLO CNc1ccc(Nc2ccnc(F)c2)c[nH+]1 ZINC001203449019 966649148 /nfs/dbraw/zinc/64/91/48/966649148.db2.gz WDTKEFKHPSMDQG-UHFFFAOYSA-N 1 2 218.235 2.401 20 0 BEADLO CCOc1ccccc1C[N@@H+]1CCOC[C@@H]1C ZINC001203534969 966673203 /nfs/dbraw/zinc/67/32/03/966673203.db2.gz KHROUAZLFBJFCP-LBPRGKRZSA-N 1 2 235.327 2.306 20 0 BEADLO CCOc1ccccc1C[N@H+]1CCOC[C@@H]1C ZINC001203534969 966673217 /nfs/dbraw/zinc/67/32/17/966673217.db2.gz KHROUAZLFBJFCP-LBPRGKRZSA-N 1 2 235.327 2.306 20 0 BEADLO CCOc1ccccc1C[N@H+](C1CC1)C1COC1 ZINC001203544148 966679596 /nfs/dbraw/zinc/67/95/96/966679596.db2.gz XEJBFOUUDCDMRZ-UHFFFAOYSA-N 1 2 247.338 2.449 20 0 BEADLO CCOc1ccccc1C[N@@H+](C1CC1)C1COC1 ZINC001203544148 966679606 /nfs/dbraw/zinc/67/96/06/966679606.db2.gz XEJBFOUUDCDMRZ-UHFFFAOYSA-N 1 2 247.338 2.449 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2cnc3cccnn32)c1 ZINC001203657565 966722646 /nfs/dbraw/zinc/72/26/46/966722646.db2.gz PADIPDSIOMNGTN-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO CC(=O)[C@H]1C[N@H+](Cc2cc(C)ccc2C)CCO1 ZINC001203751612 966770802 /nfs/dbraw/zinc/77/08/02/966770802.db2.gz DQRBAOHTMYPFTG-OAHLLOKOSA-N 1 2 247.338 2.093 20 0 BEADLO CC(=O)[C@H]1C[N@@H+](Cc2cc(C)ccc2C)CCO1 ZINC001203751612 966770808 /nfs/dbraw/zinc/77/08/08/966770808.db2.gz DQRBAOHTMYPFTG-OAHLLOKOSA-N 1 2 247.338 2.093 20 0 BEADLO CC(=Cc1ccco1)C(=O)Nc1cc[nH+]c(C)c1 ZINC001127730147 966773836 /nfs/dbraw/zinc/77/38/36/966773836.db2.gz LHBAZFBGLTZENN-NTMALXAHSA-N 1 2 242.278 2.447 20 0 BEADLO CC(C)(O)/C=C/c1cccc2[nH+]ccn21 ZINC001239156266 966831401 /nfs/dbraw/zinc/83/14/01/966831401.db2.gz PHQQYVZZXURYQY-VOTSOKGWSA-N 1 2 202.257 2.118 20 0 BEADLO O=C1CC[N@@H+](Cc2cccs2)CC[C@@H]1F ZINC001204014026 966852829 /nfs/dbraw/zinc/85/28/29/966852829.db2.gz DNBZBFPOBDBNGD-JTQLQIEISA-N 1 2 227.304 2.251 20 0 BEADLO O=C1CC[N@H+](Cc2cccs2)CC[C@@H]1F ZINC001204014026 966852830 /nfs/dbraw/zinc/85/28/30/966852830.db2.gz DNBZBFPOBDBNGD-JTQLQIEISA-N 1 2 227.304 2.251 20 0 BEADLO CCCCOC(=O)N1CC[NH2+]C2=CCCC[C@H]21 ZINC001239340212 966862947 /nfs/dbraw/zinc/86/29/47/966862947.db2.gz MNJLNYLPFIYWNH-GFCCVEGCSA-N 1 2 238.331 2.265 20 0 BEADLO FC1C[C@@H]2COC[C@H](C1)[N@@H+]2Cc1ccsc1 ZINC001204042692 966864573 /nfs/dbraw/zinc/86/45/73/966864573.db2.gz MVIFJRKSCXBOLP-YOGCLGLASA-N 1 2 241.331 2.449 20 0 BEADLO FC1C[C@@H]2COC[C@H](C1)[N@H+]2Cc1ccsc1 ZINC001204042692 966864578 /nfs/dbraw/zinc/86/45/78/966864578.db2.gz MVIFJRKSCXBOLP-YOGCLGLASA-N 1 2 241.331 2.449 20 0 BEADLO FC(F)C1C[NH+](Cc2ccc3c(c2)OCO3)C1 ZINC001204057591 966873248 /nfs/dbraw/zinc/87/32/48/966873248.db2.gz ZJUDORRKMAAMHR-UHFFFAOYSA-N 1 2 241.237 2.112 20 0 BEADLO CSc1ccc(C[N@H+]2C[C@H]3C[C@@H](C2)O3)cc1 ZINC001204141504 966903135 /nfs/dbraw/zinc/90/31/35/966903135.db2.gz UWFLOMGHRHJPQS-TXEJJXNPSA-N 1 2 235.352 2.382 20 0 BEADLO CSc1ccc(C[N@@H+]2C[C@H]3C[C@@H](C2)O3)cc1 ZINC001204141504 966903137 /nfs/dbraw/zinc/90/31/37/966903137.db2.gz UWFLOMGHRHJPQS-TXEJJXNPSA-N 1 2 235.352 2.382 20 0 BEADLO CC(C)c1ccc(C[N@@H+]2CC(=O)NC[C@H]2C)cc1 ZINC001204167853 966905599 /nfs/dbraw/zinc/90/55/99/966905599.db2.gz DLHYDHYQJFCSLS-GFCCVEGCSA-N 1 2 246.354 2.130 20 0 BEADLO CC(C)c1ccc(C[N@H+]2CC(=O)NC[C@H]2C)cc1 ZINC001204167853 966905605 /nfs/dbraw/zinc/90/56/05/966905605.db2.gz DLHYDHYQJFCSLS-GFCCVEGCSA-N 1 2 246.354 2.130 20 0 BEADLO Cn1c[nH+]cc1CN1CCCC[C@H]1C(F)(F)F ZINC001204383226 966986364 /nfs/dbraw/zinc/98/63/64/966986364.db2.gz CAAUBAFLFHYVDF-JTQLQIEISA-N 1 2 247.264 2.337 20 0 BEADLO Cc1c(F)cccc1C[N@@H+]1CC[C@@H](O)[C@H](F)C1 ZINC001204507777 967014267 /nfs/dbraw/zinc/01/42/67/967014267.db2.gz KETDGCVVUSELKC-CHWSQXEVSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1c(F)cccc1C[N@H+]1CC[C@@H](O)[C@H](F)C1 ZINC001204507777 967014271 /nfs/dbraw/zinc/01/42/71/967014271.db2.gz KETDGCVVUSELKC-CHWSQXEVSA-N 1 2 241.281 2.039 20 0 BEADLO CCN1CC[NH+](Cc2cc(C)c(C)o2)CC1 ZINC001204530673 967030365 /nfs/dbraw/zinc/03/03/65/967030365.db2.gz GSVOBDXSECCGCS-UHFFFAOYSA-N 1 2 222.332 2.034 20 0 BEADLO Cc1cc(C[N@H+](C2CC2)C2COC2)oc1C ZINC001204534347 967032978 /nfs/dbraw/zinc/03/29/78/967032978.db2.gz YJVCVKUPYWGMHX-UHFFFAOYSA-N 1 2 221.300 2.260 20 0 BEADLO Cc1cc(C[N@@H+](C2CC2)C2COC2)oc1C ZINC001204534347 967032986 /nfs/dbraw/zinc/03/29/86/967032986.db2.gz YJVCVKUPYWGMHX-UHFFFAOYSA-N 1 2 221.300 2.260 20 0 BEADLO Cc1cc[nH+]c(Nc2cnc(N)c(F)c2)c1 ZINC001249753763 967041506 /nfs/dbraw/zinc/04/15/06/967041506.db2.gz HWYPPRBCTQXSMS-UHFFFAOYSA-N 1 2 218.235 2.250 20 0 BEADLO CN(C)c1ccc(Nc2cnc(N)c(F)c2)c[nH+]1 ZINC001249754505 967043511 /nfs/dbraw/zinc/04/35/11/967043511.db2.gz NZWRYDQEOZECRN-UHFFFAOYSA-N 1 2 247.277 2.008 20 0 BEADLO CC[C@H](C)c1c[nH+]c2c(c1)OCCN2C ZINC001249863731 967100020 /nfs/dbraw/zinc/10/00/20/967100020.db2.gz XDICWZHRPJQGKO-VIFPVBQESA-N 1 2 206.289 2.424 20 0 BEADLO CC(C)(C)C(=O)Cc1ccc2[nH+]ccn2c1 ZINC001249916679 967155672 /nfs/dbraw/zinc/15/56/72/967155672.db2.gz PMNGAVNXNACGKQ-UHFFFAOYSA-N 1 2 216.284 2.492 20 0 BEADLO OCC1CC[NH+](Cc2scnc2Cl)CC1 ZINC000721924837 967240082 /nfs/dbraw/zinc/24/00/82/967240082.db2.gz XUNQGVBPWWLNNX-UHFFFAOYSA-N 1 2 246.763 2.001 20 0 BEADLO Cc1cnc(Nc2ccn3cc[nH+]c3c2)cn1 ZINC001204951716 967250553 /nfs/dbraw/zinc/25/05/53/967250553.db2.gz XQGFYJCMRROBMF-UHFFFAOYSA-N 1 2 225.255 2.176 20 0 BEADLO Cc1ncc(Nc2ccn3cc[nH+]c3c2)nc1C ZINC001204959820 967260880 /nfs/dbraw/zinc/26/08/80/967260880.db2.gz WFGUQVIWJGDDPY-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO CCOc1cc(Nc2ccn3cc[nH+]c3c2)no1 ZINC001204966475 967267723 /nfs/dbraw/zinc/26/77/23/967267723.db2.gz UWITULPZSRYIEX-UHFFFAOYSA-N 1 2 244.254 2.465 20 0 BEADLO Nc1ccc2c(cnn2-c2ccn3cc[nH+]c3c2)c1 ZINC001204971724 967269913 /nfs/dbraw/zinc/26/99/13/967269913.db2.gz NTJLVKGRBYOSFV-UHFFFAOYSA-N 1 2 249.277 2.255 20 0 BEADLO CCSCCc1c[nH+]c2c(c1)OCCN2C ZINC001250021240 967277469 /nfs/dbraw/zinc/27/74/69/967277469.db2.gz UFDCSYRPMZNDMC-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)c1ccc(F)cc1 ZINC001250025854 967280239 /nfs/dbraw/zinc/28/02/39/967280239.db2.gz NYYYPPDMOCESDA-UHFFFAOYSA-N 1 2 218.231 2.364 20 0 BEADLO F[C@@H]1C[N@@H+](CCc2ccccc2)C[C@@H]1F ZINC000295209107 967283998 /nfs/dbraw/zinc/28/39/98/967283998.db2.gz WIHOJUSRMXIEJB-TXEJJXNPSA-N 1 2 211.255 2.221 20 0 BEADLO F[C@@H]1C[N@H+](CCc2ccccc2)C[C@@H]1F ZINC000295209107 967284011 /nfs/dbraw/zinc/28/40/11/967284011.db2.gz WIHOJUSRMXIEJB-TXEJJXNPSA-N 1 2 211.255 2.221 20 0 BEADLO CO[C@@H]1C[N@H+](Cc2ccc(F)c(C)c2)C[C@@H]1F ZINC001205161281 967405324 /nfs/dbraw/zinc/40/53/24/967405324.db2.gz FMMPRWOJYHUKEJ-QWHCGFSZSA-N 1 2 241.281 2.303 20 0 BEADLO CO[C@@H]1C[N@@H+](Cc2ccc(F)c(C)c2)C[C@@H]1F ZINC001205161281 967405331 /nfs/dbraw/zinc/40/53/31/967405331.db2.gz FMMPRWOJYHUKEJ-QWHCGFSZSA-N 1 2 241.281 2.303 20 0 BEADLO c1cn2cc(-c3cnc4[nH]cnc4c3)ccc2[nH+]1 ZINC001240217711 967428995 /nfs/dbraw/zinc/42/89/95/967428995.db2.gz NBVKOTZXRCTBJY-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO Cc1cc(-c2cnn(C)c2)cn2cc[nH+]c12 ZINC001240296831 967502347 /nfs/dbraw/zinc/50/23/47/967502347.db2.gz ZOVXCHCOJZDNCW-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO CC(C)[NH+]1CC(OCCC(=O)c2ccccc2)C1 ZINC001205358615 967583890 /nfs/dbraw/zinc/58/38/90/967583890.db2.gz VSJKYHQWQTWBEQ-UHFFFAOYSA-N 1 2 247.338 2.369 20 0 BEADLO Fc1ccc(CC[NH+]2CCOCC2)c2occc21 ZINC001250277083 967612844 /nfs/dbraw/zinc/61/28/44/967612844.db2.gz YLGBRRXWSJEEIK-UHFFFAOYSA-N 1 2 249.285 2.447 20 0 BEADLO c1cn2ccc(Cc3ccncc3)cc2[nH+]1 ZINC001250313741 967672167 /nfs/dbraw/zinc/67/21/67/967672167.db2.gz ZVSYFYDPZXXUJA-UHFFFAOYSA-N 1 2 209.252 2.320 20 0 BEADLO Oc1ccc(F)c(CCn2cc[nH+]c2)c1F ZINC001250316351 967678441 /nfs/dbraw/zinc/67/84/41/967678441.db2.gz KLDSJZMABSWKMQ-UHFFFAOYSA-N 1 2 224.210 2.110 20 0 BEADLO COc1c(F)cc(F)cc1CCn1cc[nH+]c1 ZINC001250318620 967686798 /nfs/dbraw/zinc/68/67/98/967686798.db2.gz GYZWIVDSEUPDTN-UHFFFAOYSA-N 1 2 238.237 2.413 20 0 BEADLO Cc1cnc(C)c(CCn2cc[nH+]c2)c1 ZINC001250316696 967688611 /nfs/dbraw/zinc/68/86/11/967688611.db2.gz SXIIAFVGZDXNMV-UHFFFAOYSA-N 1 2 201.273 2.138 20 0 BEADLO FC(F)Oc1ncccc1CCn1cc[nH+]c1 ZINC001250318683 967692480 /nfs/dbraw/zinc/69/24/80/967692480.db2.gz KJHFWVBPOXAEFD-UHFFFAOYSA-N 1 2 239.225 2.122 20 0 BEADLO COCOc1ccc(C)cc1CCn1cc[nH+]c1 ZINC001250319091 967693232 /nfs/dbraw/zinc/69/32/32/967693232.db2.gz AGAHYYFGZZLPNJ-UHFFFAOYSA-N 1 2 246.310 2.417 20 0 BEADLO COC(=O)c1cc(CCn2cc[nH+]c2)ccc1F ZINC001250319476 967694097 /nfs/dbraw/zinc/69/40/97/967694097.db2.gz FDNATMNMIONQST-UHFFFAOYSA-N 1 2 248.257 2.052 20 0 BEADLO Cc1cc(CCn2cc[nH+]c2)cc(C)c1O ZINC001250318945 967694124 /nfs/dbraw/zinc/69/41/24/967694124.db2.gz NSKKDJSMXSGPJY-UHFFFAOYSA-N 1 2 216.284 2.448 20 0 BEADLO CSc1cncc(CCn2cc[nH+]c2)c1 ZINC001250319533 967694637 /nfs/dbraw/zinc/69/46/37/967694637.db2.gz UKQNXUFPKQOEGW-UHFFFAOYSA-N 1 2 219.313 2.243 20 0 BEADLO COc1cc(CCn2cc[nH+]c2)c(Cl)cn1 ZINC001250319093 967694846 /nfs/dbraw/zinc/69/48/46/967694846.db2.gz AHTJWDKZFLYETC-UHFFFAOYSA-N 1 2 237.690 2.183 20 0 BEADLO COC(=O)c1ccc(F)cc1CCn1cc[nH+]c1 ZINC001250319566 967695286 /nfs/dbraw/zinc/69/52/86/967695286.db2.gz VLYCPZLXMZQIMD-UHFFFAOYSA-N 1 2 248.257 2.052 20 0 BEADLO COCOc1cccc(CCn2cc[nH+]c2)c1 ZINC001250320151 967696106 /nfs/dbraw/zinc/69/61/06/967696106.db2.gz ZAASBUJERXNFJC-UHFFFAOYSA-N 1 2 232.283 2.109 20 0 BEADLO COc1nccc(SC)c1CCn1cc[nH+]c1 ZINC001250320323 967697216 /nfs/dbraw/zinc/69/72/16/967697216.db2.gz KSAOPIWMJGKFRF-UHFFFAOYSA-N 1 2 249.339 2.251 20 0 BEADLO CCc1ncccc1CCn1cc[nH+]c1 ZINC001250320101 967697458 /nfs/dbraw/zinc/69/74/58/967697458.db2.gz YFCYAJSKOMTEQG-UHFFFAOYSA-N 1 2 201.273 2.083 20 0 BEADLO COc1c(F)cc(CCn2cc[nH+]c2)cc1F ZINC001250320071 967697511 /nfs/dbraw/zinc/69/75/11/967697511.db2.gz XMPDAYAEFBZQJO-UHFFFAOYSA-N 1 2 238.237 2.413 20 0 BEADLO CC[C@@H](C)[C@@H](C)C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000822576019 967844175 /nfs/dbraw/zinc/84/41/75/967844175.db2.gz YCGMLMRGAAGMIG-RKDXNWHRSA-N 1 2 237.347 2.325 20 0 BEADLO Cc1cnccc1C[N@H+](C)Cc1cncs1 ZINC001205867893 967864988 /nfs/dbraw/zinc/86/49/88/967864988.db2.gz PGIGJKCMFSJKIO-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cnccc1C[N@@H+](C)Cc1cncs1 ZINC001205867893 967864990 /nfs/dbraw/zinc/86/49/90/967864990.db2.gz PGIGJKCMFSJKIO-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cnccc1C[N@H+](C)Cc1ccno1 ZINC001205867574 967866678 /nfs/dbraw/zinc/86/66/78/967866678.db2.gz IONQUEBAVGTRNX-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1cnccc1C[N@@H+](C)Cc1ccno1 ZINC001205867574 967866679 /nfs/dbraw/zinc/86/66/79/967866679.db2.gz IONQUEBAVGTRNX-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO c1cn(Cc2ccc(-c3cnccn3)cc2)c[nH+]1 ZINC001250443184 967867157 /nfs/dbraw/zinc/86/71/57/967867157.db2.gz VJHXAPYGRZVFAZ-UHFFFAOYSA-N 1 2 236.278 2.388 20 0 BEADLO CC[N@H+](Cc1cc(C)nn1C)Cc1cccnc1 ZINC001205910846 967879971 /nfs/dbraw/zinc/87/99/71/967879971.db2.gz JBYZCMJTHCZADH-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CC[N@@H+](Cc1cc(C)nn1C)Cc1cccnc1 ZINC001205910846 967879978 /nfs/dbraw/zinc/87/99/78/967879978.db2.gz JBYZCMJTHCZADH-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CCc1nc(C[NH2+]Cc2c[nH]nc2C)cs1 ZINC000163667265 967986092 /nfs/dbraw/zinc/98/60/92/967986092.db2.gz AAWIAHZEURRNJH-UHFFFAOYSA-N 1 2 236.344 2.027 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H](C)c2ccno2)[nH+]1 ZINC001163208801 968007215 /nfs/dbraw/zinc/00/72/15/968007215.db2.gz NJXKDLCMGGJGBE-ZETCQYMHSA-N 1 2 243.270 2.427 20 0 BEADLO C[NH+](C)Cc1nnc(C[C@H]2C=CCCC2)o1 ZINC001118138419 968017476 /nfs/dbraw/zinc/01/74/76/968017476.db2.gz DBQRFNHGDLDJBL-JTQLQIEISA-N 1 2 221.304 2.030 20 0 BEADLO Nc1cn2ccc(-c3ccc(O)cc3F)cc2[nH+]1 ZINC001206051976 968020018 /nfs/dbraw/zinc/02/00/18/968020018.db2.gz VFRUPIJCJCXYLR-UHFFFAOYSA-N 1 2 243.241 2.428 20 0 BEADLO Cc1ccc(-c2c[nH+]c(N(C)C)cc2C)nn1 ZINC001250519925 968022954 /nfs/dbraw/zinc/02/29/54/968022954.db2.gz MMZXGHCLYHZAIO-UHFFFAOYSA-N 1 2 228.299 2.221 20 0 BEADLO CCOC(=O)Cc1cc[nH+]c(N2CC(C)(C)C2)c1 ZINC001163729996 968105464 /nfs/dbraw/zinc/10/54/64/968105464.db2.gz ILYIYCLTGJGZPF-UHFFFAOYSA-N 1 2 248.326 2.033 20 0 BEADLO Cn1cnc(C[N@@H+]2CCCC[C@@](C)(F)C2)c1 ZINC001206207026 968137114 /nfs/dbraw/zinc/13/71/14/968137114.db2.gz NAVMUUBUPCGPTH-GFCCVEGCSA-N 1 2 225.311 2.134 20 0 BEADLO Cn1cnc(C[N@H+]2CCCC[C@@](C)(F)C2)c1 ZINC001206207026 968137127 /nfs/dbraw/zinc/13/71/27/968137127.db2.gz NAVMUUBUPCGPTH-GFCCVEGCSA-N 1 2 225.311 2.134 20 0 BEADLO Cc1ccc2[nH+]c(CCC3OCCO3)[nH]c2c1C ZINC001250608040 968154188 /nfs/dbraw/zinc/15/41/88/968154188.db2.gz MHVDCNULTBOZLR-UHFFFAOYSA-N 1 2 246.310 2.485 20 0 BEADLO O=C1CCCN(c2cc(C3CC3)cc[nH+]2)C[C@H]1F ZINC001164136996 968175482 /nfs/dbraw/zinc/17/54/82/968175482.db2.gz RGAOOBMJRNRBCD-GFCCVEGCSA-N 1 2 248.301 2.466 20 0 BEADLO CSc1cc[nH+]c(N2C[C@@H](C)C[C@H]2CO)c1 ZINC001164154725 968180759 /nfs/dbraw/zinc/18/07/59/968180759.db2.gz ULLGBYVLWQCUFI-UWVGGRQHSA-N 1 2 238.356 2.011 20 0 BEADLO C[C@@H](C(=O)NC[C@@H]1CCC[C@@H](C)C1)n1cc[nH+]c1 ZINC001251289283 968277860 /nfs/dbraw/zinc/27/78/60/968277860.db2.gz ZVZLYEORKCBIGO-FRRDWIJNSA-N 1 2 249.358 2.387 20 0 BEADLO COc1cnccc1C[N@@H+]1CCC[C@](C)(F)C1 ZINC001206438196 968300803 /nfs/dbraw/zinc/30/08/03/968300803.db2.gz MBCJZAXZKDVMBB-ZDUSSCGKSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cnccc1C[N@H+]1CCC[C@](C)(F)C1 ZINC001206438196 968300815 /nfs/dbraw/zinc/30/08/15/968300815.db2.gz MBCJZAXZKDVMBB-ZDUSSCGKSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cnccc1C[N@@H+]1CCC[C@@H]1CF ZINC001206499954 968343919 /nfs/dbraw/zinc/34/39/19/968343919.db2.gz MPASPDWPXKOQOG-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO COc1cnccc1C[N@H+]1CCC[C@@H]1CF ZINC001206499954 968343929 /nfs/dbraw/zinc/34/39/29/968343929.db2.gz MPASPDWPXKOQOG-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO COc1ncccc1C[N@@H+]1C[C@H](F)C[C@H]1C ZINC001206554165 968381247 /nfs/dbraw/zinc/38/12/47/968381247.db2.gz UKMDGBDWIXHORD-MWLCHTKSSA-N 1 2 224.279 2.023 20 0 BEADLO COc1cccnc1C[N@@H+]1CCCC[C@@H](F)C1 ZINC001206610486 968413334 /nfs/dbraw/zinc/41/33/34/968413334.db2.gz HVYNRDQITJDOQV-LLVKDONJSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cccnc1C[N@H+]1CCCC[C@@H](F)C1 ZINC001206610486 968413340 /nfs/dbraw/zinc/41/33/40/968413340.db2.gz HVYNRDQITJDOQV-LLVKDONJSA-N 1 2 238.306 2.414 20 0 BEADLO CCOC[C@@H](O)CNc1cc2ccccc2c[nH+]1 ZINC001252018023 968439132 /nfs/dbraw/zinc/43/91/32/968439132.db2.gz MSMFATQZEUHEDN-ZDUSSCGKSA-N 1 2 246.310 2.044 20 0 BEADLO Fc1cnccc1C[NH+]1CC2(CCC2)C1 ZINC001206783326 968468083 /nfs/dbraw/zinc/46/80/83/968468083.db2.gz CLVBPMCHOSCUDB-UHFFFAOYSA-N 1 2 206.264 2.207 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@H](C(F)F)C2)no1 ZINC001206819070 968488390 /nfs/dbraw/zinc/48/83/90/968488390.db2.gz VLKNKILVMPPSBA-VIFPVBQESA-N 1 2 230.258 2.460 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@H](C(F)F)C2)no1 ZINC001206819070 968488394 /nfs/dbraw/zinc/48/83/94/968488394.db2.gz VLKNKILVMPPSBA-VIFPVBQESA-N 1 2 230.258 2.460 20 0 BEADLO C[C@@H](Nc1cc(N(C)C)nc[nH+]1)c1cncs1 ZINC001119982413 968491753 /nfs/dbraw/zinc/49/17/53/968491753.db2.gz FROKSRPTONAKCH-MRVPVSSYSA-N 1 2 249.343 2.172 20 0 BEADLO C[C@@H](Nc1cc(N(C)C)[nH+]cn1)c1cncs1 ZINC001119982413 968491759 /nfs/dbraw/zinc/49/17/59/968491759.db2.gz FROKSRPTONAKCH-MRVPVSSYSA-N 1 2 249.343 2.172 20 0 BEADLO Cc1ncsc1C[N@@H+]1CCC(=O)[C@@H](C)CC1 ZINC001206862722 968504645 /nfs/dbraw/zinc/50/46/45/968504645.db2.gz FBUJYTCTUVCMGT-VIFPVBQESA-N 1 2 238.356 2.253 20 0 BEADLO Cc1ncsc1C[N@H+]1CCC(=O)[C@@H](C)CC1 ZINC001206862722 968504649 /nfs/dbraw/zinc/50/46/49/968504649.db2.gz FBUJYTCTUVCMGT-VIFPVBQESA-N 1 2 238.356 2.253 20 0 BEADLO CC[C@@H](C)[C@H](C)C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000822576016 968530166 /nfs/dbraw/zinc/53/01/66/968530166.db2.gz YCGMLMRGAAGMIG-BDAKNGLRSA-N 1 2 237.347 2.325 20 0 BEADLO CC[C@H]1CCC[C@@H]1C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000822715600 968533913 /nfs/dbraw/zinc/53/39/13/968533913.db2.gz HBRUDPHTHPNLGM-RYUDHWBXSA-N 1 2 249.358 2.469 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cncc(F)c2)C[C@@H]1F ZINC001207017259 968553089 /nfs/dbraw/zinc/55/30/89/968553089.db2.gz RLFJFHIVMYJZJD-KCJUWKMLSA-N 1 2 212.243 2.011 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cncc(F)c2)C[C@@H]1F ZINC001207017259 968553094 /nfs/dbraw/zinc/55/30/94/968553094.db2.gz RLFJFHIVMYJZJD-KCJUWKMLSA-N 1 2 212.243 2.011 20 0 BEADLO Fc1cccnc1C[NH+]1CCC(F)(F)CC1 ZINC001207026681 968561847 /nfs/dbraw/zinc/56/18/47/968561847.db2.gz MDYBDHFUCGTTFW-UHFFFAOYSA-N 1 2 230.233 2.452 20 0 BEADLO C[N@H+](Cc1ccccn1)Cc1ccc(F)cn1 ZINC001207037291 968570274 /nfs/dbraw/zinc/57/02/74/968570274.db2.gz VNZNBZRFXOCLJI-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[N@@H+](Cc1ccccn1)Cc1ccc(F)cn1 ZINC001207037291 968570282 /nfs/dbraw/zinc/57/02/82/968570282.db2.gz VNZNBZRFXOCLJI-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO CC(C)=Cc1cc[nH+]c(N2CCOCC2)c1 ZINC001240631891 968584182 /nfs/dbraw/zinc/58/41/82/968584182.db2.gz GKCSAQJPXTWWLE-UHFFFAOYSA-N 1 2 218.300 2.341 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2cccc(=O)[nH]2)C[C@H]1F ZINC001207065133 968597196 /nfs/dbraw/zinc/59/71/96/968597196.db2.gz IULZONLJJCPOHZ-PWSUYJOCSA-N 1 2 242.269 2.059 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2cccc(=O)[nH]2)C[C@H]1F ZINC001207065133 968597204 /nfs/dbraw/zinc/59/72/04/968597204.db2.gz IULZONLJJCPOHZ-PWSUYJOCSA-N 1 2 242.269 2.059 20 0 BEADLO COC(=O)[C@H]([NH3+])c1ccc(C=C(C)C)cc1 ZINC001240638814 968604730 /nfs/dbraw/zinc/60/47/30/968604730.db2.gz HSAGOZCGBYBQKC-GFCCVEGCSA-N 1 2 219.284 2.283 20 0 BEADLO Fc1cnc(C[N@@H+]2CCC[C@@H]3C[C@@H]32)c(F)c1 ZINC001207100953 968630890 /nfs/dbraw/zinc/63/08/90/968630890.db2.gz FUXVZYBVDFDTPE-PELKAZGASA-N 1 2 224.254 2.344 20 0 BEADLO Fc1cnc(C[N@H+]2CCC[C@@H]3C[C@@H]32)c(F)c1 ZINC001207100953 968630895 /nfs/dbraw/zinc/63/08/95/968630895.db2.gz FUXVZYBVDFDTPE-PELKAZGASA-N 1 2 224.254 2.344 20 0 BEADLO Cc1cncc(C[N@H+](C)Cc2cnc(C)nc2)c1 ZINC001207162551 968671284 /nfs/dbraw/zinc/67/12/84/968671284.db2.gz PZEGQMLQGBTEGB-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cncc(C[N@@H+](C)Cc2cnc(C)nc2)c1 ZINC001207162551 968671287 /nfs/dbraw/zinc/67/12/87/968671287.db2.gz PZEGQMLQGBTEGB-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccnc(CNc2ccc(Cl)c(N)[nH+]2)n1 ZINC001154827066 968683147 /nfs/dbraw/zinc/68/31/47/968683147.db2.gz TXRLHASWRKHXCX-UHFFFAOYSA-N 1 2 249.705 2.028 20 0 BEADLO Cc1cc(CN2CC3(CC[N@H+]3C)C2)sc1C ZINC001276527108 968740611 /nfs/dbraw/zinc/74/06/11/968740611.db2.gz FIHWTUBUTOFONH-UHFFFAOYSA-N 1 2 236.384 2.255 20 0 BEADLO Cc1cc(CN2CC3(CC[N@@H+]3C)C2)sc1C ZINC001276527108 968740613 /nfs/dbraw/zinc/74/06/13/968740613.db2.gz FIHWTUBUTOFONH-UHFFFAOYSA-N 1 2 236.384 2.255 20 0 BEADLO OCCC[N@H+](Cc1csc(Cl)n1)C1CC1 ZINC000404339729 968871126 /nfs/dbraw/zinc/87/11/26/968871126.db2.gz ROGZKOJBEBHDBX-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO OCCC[N@@H+](Cc1csc(Cl)n1)C1CC1 ZINC000404339729 968871130 /nfs/dbraw/zinc/87/11/30/968871130.db2.gz ROGZKOJBEBHDBX-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO O=c1[nH]cccc1-c1[nH+]ccc2[nH]ccc21 ZINC001241102331 968918733 /nfs/dbraw/zinc/91/87/33/968918733.db2.gz ZUISZIBNPPXEGQ-UHFFFAOYSA-N 1 2 211.224 2.331 20 0 BEADLO Cc1cc(-c2ccc[nH]c2=O)cn2cc[nH+]c12 ZINC001241119136 968931149 /nfs/dbraw/zinc/93/11/49/968931149.db2.gz LHEUEFNUHHDEPX-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO Nc1cc(-c2cnc3scnc3c2)cc[nH+]1 ZINC001241162431 968944533 /nfs/dbraw/zinc/94/45/33/968944533.db2.gz IZYWWYSSTHFJPR-UHFFFAOYSA-N 1 2 228.280 2.336 20 0 BEADLO CN(C)c1cc(-c2cccc(CO)c2)cc[nH+]1 ZINC001241509744 969020798 /nfs/dbraw/zinc/02/07/98/969020798.db2.gz RSOOOWIWADXHJY-UHFFFAOYSA-N 1 2 228.295 2.307 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(-c2ncc[nH]2)cc1 ZINC001242018592 969170144 /nfs/dbraw/zinc/17/01/44/969170144.db2.gz LAVFOGZOGPQJOY-UHFFFAOYSA-N 1 2 224.267 2.477 20 0 BEADLO CCOC(=[NH2+])c1cccc(-c2ncc[nH]2)c1 ZINC001242017698 969173423 /nfs/dbraw/zinc/17/34/23/969173423.db2.gz SXACTEMJWPMAHD-UHFFFAOYSA-N 1 2 215.256 2.439 20 0 BEADLO Cc1cc(-c2ccnnc2)c2[nH+]ccn2c1 ZINC001242055583 969186286 /nfs/dbraw/zinc/18/62/86/969186286.db2.gz HLUHJFKUSPRDTM-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1ncnc2occc21 ZINC001242071247 969196841 /nfs/dbraw/zinc/19/68/41/969196841.db2.gz XQRRTQFPIOZOEW-UHFFFAOYSA-N 1 2 226.239 2.175 20 0 BEADLO CCCCC[C@H](O)CNc1[nH+]cccc1OC ZINC001253519472 969198066 /nfs/dbraw/zinc/19/80/66/969198066.db2.gz FDVUTPPYRFKMNP-NSHDSACASA-N 1 2 238.331 2.443 20 0 BEADLO C[C@@H](C[NH+]1CC2(CCO2)C1)OCc1ccccc1 ZINC001208703138 969198199 /nfs/dbraw/zinc/19/81/99/969198199.db2.gz VZSDEDIFPWOILL-ZDUSSCGKSA-N 1 2 247.338 2.066 20 0 BEADLO CC[N@H+](C)Cc1nnc(Cc2ccccc2)o1 ZINC001253525128 969202941 /nfs/dbraw/zinc/20/29/41/969202941.db2.gz MFMRRJTYQHUGPK-UHFFFAOYSA-N 1 2 231.299 2.112 20 0 BEADLO CC[N@@H+](C)Cc1nnc(Cc2ccccc2)o1 ZINC001253525128 969202945 /nfs/dbraw/zinc/20/29/45/969202945.db2.gz MFMRRJTYQHUGPK-UHFFFAOYSA-N 1 2 231.299 2.112 20 0 BEADLO CCCCC[C@@H](O)C[N@@H+]1Cc2ccncc2C1 ZINC001253535636 969208105 /nfs/dbraw/zinc/20/81/05/969208105.db2.gz NDYDVTZEHHOCJZ-CQSZACIVSA-N 1 2 234.343 2.338 20 0 BEADLO CCCCC[C@@H](O)C[N@H+]1Cc2ccncc2C1 ZINC001253535636 969208110 /nfs/dbraw/zinc/20/81/10/969208110.db2.gz NDYDVTZEHHOCJZ-CQSZACIVSA-N 1 2 234.343 2.338 20 0 BEADLO C[NH+](C)C1(c2nnc(Cc3ccccc3)o2)CC1 ZINC001253534421 969208208 /nfs/dbraw/zinc/20/82/08/969208208.db2.gz IOOBRDGRHMMQKB-UHFFFAOYSA-N 1 2 243.310 2.211 20 0 BEADLO F[C@@H]1C[N@H+](C[C@@H]2CCC=CO2)CCC1(F)F ZINC001208876571 969264167 /nfs/dbraw/zinc/26/41/67/969264167.db2.gz KXCVWKQFLGFPIK-VHSXEESVSA-N 1 2 235.249 2.358 20 0 BEADLO F[C@@H]1C[N@@H+](C[C@@H]2CCC=CO2)CCC1(F)F ZINC001208876571 969264174 /nfs/dbraw/zinc/26/41/74/969264174.db2.gz KXCVWKQFLGFPIK-VHSXEESVSA-N 1 2 235.249 2.358 20 0 BEADLO CCCc1nnc([C@H]2CCCc3[nH]c[nH+]c32)o1 ZINC001253962972 969432402 /nfs/dbraw/zinc/43/24/02/969432402.db2.gz OWHAGRAQYJOARL-QMMMGPOBSA-N 1 2 232.287 2.213 20 0 BEADLO COC(=O)C[N@H+](C)Cc1c[nH]c2ccc(C)cc12 ZINC001209495332 969525565 /nfs/dbraw/zinc/52/55/65/969525565.db2.gz RVUZNNIAWLTOSO-UHFFFAOYSA-N 1 2 246.310 2.081 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1c[nH]c2ccc(C)cc12 ZINC001209495332 969525567 /nfs/dbraw/zinc/52/55/67/969525567.db2.gz RVUZNNIAWLTOSO-UHFFFAOYSA-N 1 2 246.310 2.081 20 0 BEADLO Cc1n[nH]cc1C[N@@H+]1CCC(=O)[C@@H]2CCCC[C@H]21 ZINC001209554899 969540672 /nfs/dbraw/zinc/54/06/72/969540672.db2.gz QQKKSUJUSBZCCN-CHWSQXEVSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1n[nH]cc1C[N@H+]1CCC(=O)[C@@H]2CCCC[C@H]21 ZINC001209554899 969540677 /nfs/dbraw/zinc/54/06/77/969540677.db2.gz QQKKSUJUSBZCCN-CHWSQXEVSA-N 1 2 247.342 2.052 20 0 BEADLO O=C1CCC2(CC1)CC[NH+](Cc1ccon1)CC2 ZINC001209567785 969550652 /nfs/dbraw/zinc/55/06/52/969550652.db2.gz MDLSWIBDCFMIDQ-UHFFFAOYSA-N 1 2 248.326 2.400 20 0 BEADLO FC1(F)CCCC[N@@H+]([C@@H]2CCCOC2)C1 ZINC001254376658 969590785 /nfs/dbraw/zinc/59/07/85/969590785.db2.gz WVIFCDRWCUDNJO-SNVBAGLBSA-N 1 2 219.275 2.287 20 0 BEADLO FC1(F)C[NH2+]CCN(C2CCC3(CC3)CC2)C1 ZINC001254441185 969627092 /nfs/dbraw/zinc/62/70/92/969627092.db2.gz JGKJKFHGYDTBTJ-UHFFFAOYSA-N 1 2 244.329 2.250 20 0 BEADLO Nc1ccc[nH+]c1Nc1ccc2c(c1)NCCO2 ZINC001209794045 969627695 /nfs/dbraw/zinc/62/76/95/969627695.db2.gz SALIRTVPHWPAGJ-UHFFFAOYSA-N 1 2 242.282 2.212 20 0 BEADLO c1[nH]c2ccc(Nc3cnccn3)cc2[nH+]1 ZINC001209841441 969655416 /nfs/dbraw/zinc/65/54/16/969655416.db2.gz OSBTZCWEANDFPH-UHFFFAOYSA-N 1 2 211.228 2.097 20 0 BEADLO COc1nccnc1Nc1ccc2[nH]c[nH+]c2c1 ZINC001209843011 969656416 /nfs/dbraw/zinc/65/64/16/969656416.db2.gz TXUXIAIOLQISCA-UHFFFAOYSA-N 1 2 241.254 2.105 20 0 BEADLO Cc1cncc(Nc2ccc3[nH]c[nH+]c3c2)n1 ZINC001209841432 969657527 /nfs/dbraw/zinc/65/75/27/969657527.db2.gz OIEWNHWEXKIDIN-UHFFFAOYSA-N 1 2 225.255 2.405 20 0 BEADLO Cc1ncc(Nc2ccc3[nH]c[nH+]c3c2)c(=O)[nH]1 ZINC001209848938 969658467 /nfs/dbraw/zinc/65/84/67/969658467.db2.gz UBRRTTUVJNYVGG-UHFFFAOYSA-N 1 2 241.254 2.111 20 0 BEADLO COc1cc(C)c(Nc2[nH+]cccc2N)cn1 ZINC001209868228 969671009 /nfs/dbraw/zinc/67/10/09/969671009.db2.gz JNDRARHIGRTETL-UHFFFAOYSA-N 1 2 230.271 2.119 20 0 BEADLO Nc1ccc[nH+]c1Nc1ccc(F)c(CO)c1 ZINC001209873183 969677369 /nfs/dbraw/zinc/67/73/69/969677369.db2.gz PYLGUCAKRREPCA-UHFFFAOYSA-N 1 2 233.246 2.039 20 0 BEADLO C[C@H](Nc1ccn2cc[nH+]c2c1)c1cnccn1 ZINC001169529768 969713651 /nfs/dbraw/zinc/71/36/51/969713651.db2.gz PLVXDYWIVFWYON-JTQLQIEISA-N 1 2 239.282 2.297 20 0 BEADLO Oc1cccnc1CNc1cc2cc[nH]c2c[nH+]1 ZINC001169726919 969819937 /nfs/dbraw/zinc/81/99/37/969819937.db2.gz GAXJSACDVUDVKY-UHFFFAOYSA-N 1 2 240.266 2.276 20 0 BEADLO C[C@@H]1CC[C@@H](OCC[NH+]2CCOCC2)C[C@@H]1C ZINC001210209214 969831767 /nfs/dbraw/zinc/83/17/67/969831767.db2.gz YGUBQLAIHJLIDU-HZSPNIEDSA-N 1 2 241.375 2.160 20 0 BEADLO C[C@@H]1CCC[C@H](OCC[NH+]2CCOCC2)[C@H]1C ZINC001210224907 969837693 /nfs/dbraw/zinc/83/76/93/969837693.db2.gz KEDMJCDCUBQWAU-RDBSUJKOSA-N 1 2 241.375 2.160 20 0 BEADLO C[C@@H]1CCC[C@H](OCC[NH+]2CCOCC2)[C@@H]1C ZINC001210224905 969838576 /nfs/dbraw/zinc/83/85/76/969838576.db2.gz KEDMJCDCUBQWAU-MCIONIFRSA-N 1 2 241.375 2.160 20 0 BEADLO C[C@@H]1CCC[C@@H](OCC[NH+]2CCOCC2)[C@@H]1C ZINC001210224906 969839094 /nfs/dbraw/zinc/83/90/94/969839094.db2.gz KEDMJCDCUBQWAU-MGPQQGTHSA-N 1 2 241.375 2.160 20 0 BEADLO O=C1C[C@@H]2CC([N@H+]3Cc4ncsc4C3)C[C@H]2C1 ZINC001254960428 969839263 /nfs/dbraw/zinc/83/92/63/969839263.db2.gz IWTHMUNNTDSWFY-IUCAKERBSA-N 1 2 248.351 2.216 20 0 BEADLO O=C1C[C@@H]2CC([N@@H+]3Cc4ncsc4C3)C[C@H]2C1 ZINC001254960428 969839265 /nfs/dbraw/zinc/83/92/65/969839265.db2.gz IWTHMUNNTDSWFY-IUCAKERBSA-N 1 2 248.351 2.216 20 0 BEADLO CO[C@@H](C)CNc1cc(C)c2[nH]ccc2[nH+]1 ZINC001169777600 969842967 /nfs/dbraw/zinc/84/29/67/969842967.db2.gz AZCGLMNXRYXAKO-VIFPVBQESA-N 1 2 219.288 2.318 20 0 BEADLO O=C1CCC[N@H+](C2Cc3ccccc3C2)C[C@@H]1F ZINC001255019328 969848610 /nfs/dbraw/zinc/84/86/10/969848610.db2.gz HALZLJXHNJTYFK-AWEZNQCLSA-N 1 2 247.313 2.157 20 0 BEADLO O=C1CCC[N@@H+](C2Cc3ccccc3C2)C[C@@H]1F ZINC001255019328 969848612 /nfs/dbraw/zinc/84/86/12/969848612.db2.gz HALZLJXHNJTYFK-AWEZNQCLSA-N 1 2 247.313 2.157 20 0 BEADLO Cc1[nH+]cc(Nc2ccccn2)cc1N ZINC001210284489 969851342 /nfs/dbraw/zinc/85/13/42/969851342.db2.gz GYHFCWJTVRKQNK-UHFFFAOYSA-N 1 2 200.245 2.111 20 0 BEADLO Cc1[nH+]cc(Nc2noc3cccnc23)cc1N ZINC001210283949 969851666 /nfs/dbraw/zinc/85/16/66/969851666.db2.gz DGLDTMLQYPWRSH-UHFFFAOYSA-N 1 2 241.254 2.252 20 0 BEADLO Cc1ncc(Nc2cccc3[nH+]ccn32)cc1N ZINC001210284051 969852493 /nfs/dbraw/zinc/85/24/93/969852493.db2.gz DRCAMQLOJOAPQU-UHFFFAOYSA-N 1 2 239.282 2.364 20 0 BEADLO Cc1[nH+]cc(Nc2cnnc(Cl)c2)cc1N ZINC001210284511 969852518 /nfs/dbraw/zinc/85/25/18/969852518.db2.gz HUXHDMJKXZBCFZ-UHFFFAOYSA-N 1 2 235.678 2.159 20 0 BEADLO COc1ccc(C)nc1Nc1c[nH+]c(C)c(N)c1 ZINC001210287108 969853960 /nfs/dbraw/zinc/85/39/60/969853960.db2.gz LATJZZFEGZCNST-UHFFFAOYSA-N 1 2 244.298 2.428 20 0 BEADLO Cc1[nH+]cc(Nc2ccccc2CO)cc1N ZINC001210288617 969855766 /nfs/dbraw/zinc/85/57/66/969855766.db2.gz QPDHMJDINROYMT-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO Cc1[nH+]cc(Nc2cccc(O)c2)cc1N ZINC001210287814 969855891 /nfs/dbraw/zinc/85/58/91/969855891.db2.gz ATGGGZOZEPYISH-UHFFFAOYSA-N 1 2 215.256 2.421 20 0 BEADLO COc1cc(Nc2cnc(C)c(N)c2)cc(C)[nH+]1 ZINC001210289065 969856528 /nfs/dbraw/zinc/85/65/28/969856528.db2.gz SNGOCWIDPLRICV-UHFFFAOYSA-N 1 2 244.298 2.428 20 0 BEADLO COc1ccc(Nc2c[nH+]c(C)c(N)c2)cc1O ZINC001210288875 969856705 /nfs/dbraw/zinc/85/67/05/969856705.db2.gz VPCWIRXDOHZYCQ-UHFFFAOYSA-N 1 2 245.282 2.430 20 0 BEADLO Cc1[nH+]cc(Nc2cc(CO)ccc2F)cc1N ZINC001210288288 969856758 /nfs/dbraw/zinc/85/67/58/969856758.db2.gz PLMRRBQZWZUOHE-UHFFFAOYSA-N 1 2 247.273 2.347 20 0 BEADLO Cc1ccc(F)c(C[N@H+](C)CC2=NOCC2)c1 ZINC001169821826 969865395 /nfs/dbraw/zinc/86/53/95/969865395.db2.gz OSQPVHUMWLBDDH-UHFFFAOYSA-N 1 2 236.290 2.342 20 0 BEADLO Cc1ccc(F)c(C[N@@H+](C)CC2=NOCC2)c1 ZINC001169821826 969865399 /nfs/dbraw/zinc/86/53/99/969865399.db2.gz OSQPVHUMWLBDDH-UHFFFAOYSA-N 1 2 236.290 2.342 20 0 BEADLO Cc1cn2cccc(Nc3ccn(C)n3)c2[nH+]1 ZINC001210349025 969875445 /nfs/dbraw/zinc/87/54/45/969875445.db2.gz VCOVJGSQISSCRI-UHFFFAOYSA-N 1 2 227.271 2.120 20 0 BEADLO COc1cc[nH+]cc1NCCc1cncs1 ZINC001169866970 969877305 /nfs/dbraw/zinc/87/73/05/969877305.db2.gz WCIDHNDCFZROSF-UHFFFAOYSA-N 1 2 235.312 2.201 20 0 BEADLO CSCc1ccc(N[C@H](C)CCO)[nH+]c1 ZINC001156452354 969896872 /nfs/dbraw/zinc/89/68/72/969896872.db2.gz SACDEXMCLBJWCF-SECBINFHSA-N 1 2 226.345 2.127 20 0 BEADLO Cc1cc(O)c[nH+]c1Nc1ccc(CO)c(F)c1 ZINC001210481214 969901895 /nfs/dbraw/zinc/90/18/95/969901895.db2.gz GLBIOTURGJAUHT-UHFFFAOYSA-N 1 2 248.257 2.471 20 0 BEADLO Cc1ncc(-c2ccc3[nH+]ccn3c2)cc1N ZINC001242411068 969920268 /nfs/dbraw/zinc/92/02/68/969920268.db2.gz XHTKJSRMNMZYAO-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO COc1cc[nH+]cc1Nc1cnoc1C ZINC001210583071 969960013 /nfs/dbraw/zinc/96/00/13/969960013.db2.gz BKYRPEYBFWPNST-UHFFFAOYSA-N 1 2 205.217 2.130 20 0 BEADLO CCOC(=O)C1CCC([NH+]2CC(C)(F)C2)CC1 ZINC001255258232 970015097 /nfs/dbraw/zinc/01/50/97/970015097.db2.gz DCIVCLVSZUONFB-UHFFFAOYSA-N 1 2 243.322 2.152 20 0 BEADLO CCOC(=O)[C@@H]([NH2+][C@H]1CCSC1)[C@@H](C)CC ZINC001255270482 970021989 /nfs/dbraw/zinc/02/19/89/970021989.db2.gz DYFFIENHETUAEX-DCAQKATOSA-N 1 2 245.388 2.059 20 0 BEADLO COc1cc(Nc2ccc(CO)nc2)cc(C)[nH+]1 ZINC001210779090 970028367 /nfs/dbraw/zinc/02/83/67/970028367.db2.gz GCAYWZUWJNHOTM-UHFFFAOYSA-N 1 2 245.282 2.030 20 0 BEADLO CC1(CN2CC[NH2+]CC(F)(F)C2)CCCCC1 ZINC001210815011 970048801 /nfs/dbraw/zinc/04/88/01/970048801.db2.gz MJULBWYRVKBIET-UHFFFAOYSA-N 1 2 246.345 2.497 20 0 BEADLO C/C=C(\C)c1ccc([C@@H]([NH3+])C(=O)OC)cc1 ZINC001242759763 970056824 /nfs/dbraw/zinc/05/68/24/970056824.db2.gz FHJGPYYTTDIZEZ-OXFRDRNISA-N 1 2 219.284 2.283 20 0 BEADLO CCCn1nccc1Nc1[nH+]cc(C)cc1N ZINC001210914684 970069842 /nfs/dbraw/zinc/06/98/42/970069842.db2.gz XFQTXEIXSGXZJS-UHFFFAOYSA-N 1 2 231.303 2.322 20 0 BEADLO CC(C)c1noc(-c2ccnc(NC=[NH2+])c2)n1 ZINC001157080503 970078534 /nfs/dbraw/zinc/07/85/34/970078534.db2.gz XYYNNPUCIOFOMH-UHFFFAOYSA-N 1 2 231.259 2.274 20 0 BEADLO [NH2+]=CNc1ccc2cc(Cl)cnc2n1 ZINC001157078953 970081111 /nfs/dbraw/zinc/08/11/11/970081111.db2.gz TVJCQILVKCAJHK-UHFFFAOYSA-N 1 2 206.636 2.302 20 0 BEADLO Cc1cn2c(cccc2-c2ccncn2)[nH+]1 ZINC001242917454 970144424 /nfs/dbraw/zinc/14/44/24/970144424.db2.gz WBNKSNLDZKUJLO-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO CCOc1cc[nH+]cc1Nc1cncc(CO)c1 ZINC001211103055 970147531 /nfs/dbraw/zinc/14/75/31/970147531.db2.gz OQPBGHYVQFKJIL-UHFFFAOYSA-N 1 2 245.282 2.111 20 0 BEADLO CC(C)CCC[C@H](C)[N@@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001170088348 970222084 /nfs/dbraw/zinc/22/20/84/970222084.db2.gz QXQBTDXYJQSSBP-SRVKXCTJSA-N 1 2 225.332 2.201 20 0 BEADLO CC(C)CCC[C@H](C)[N@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001170088348 970222095 /nfs/dbraw/zinc/22/20/95/970222095.db2.gz QXQBTDXYJQSSBP-SRVKXCTJSA-N 1 2 225.332 2.201 20 0 BEADLO C=CC[NH+]1CCN(C(=O)CCCCCC)CC1 ZINC000020466011 970226318 /nfs/dbraw/zinc/22/63/18/970226318.db2.gz NDDABMUELDRCIB-UHFFFAOYSA-N 1 2 238.375 2.287 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(C2OCCO2)c(F)c1 ZINC001243068964 970262036 /nfs/dbraw/zinc/26/20/36/970262036.db2.gz LIOCPTYMAWTVQI-UHFFFAOYSA-N 1 2 248.257 2.272 20 0 BEADLO COc1cc(C)cc(-c2c[nH+]cn2C)c1 ZINC001243069795 970264581 /nfs/dbraw/zinc/26/45/81/970264581.db2.gz YLUBHASWVKNORZ-UHFFFAOYSA-N 1 2 202.257 2.404 20 0 BEADLO COC(=O)/C=C\c1ccc(-c2c[nH+]cn2C)cc1 ZINC001243070984 970269232 /nfs/dbraw/zinc/26/92/32/970269232.db2.gz DOFNSXZAIAREHF-YVMONPNESA-N 1 2 242.278 2.273 20 0 BEADLO CCN(c1ncc(F)cc1Cl)C1C[NH+](C)C1 ZINC001157455796 970327161 /nfs/dbraw/zinc/32/71/61/970327161.db2.gz TWWJWOPOIRDWAS-UHFFFAOYSA-N 1 2 243.713 2.014 20 0 BEADLO Cc1nonc1Nc1c[nH+]c(C)cc1C ZINC001213505927 970333041 /nfs/dbraw/zinc/33/30/41/970333041.db2.gz UCZLLNFQSVAZIV-UHFFFAOYSA-N 1 2 204.233 2.133 20 0 BEADLO Cc1c(Nc2c[nH+]c(C)cc2C)ncn1C ZINC001213510853 970336976 /nfs/dbraw/zinc/33/69/76/970336976.db2.gz KGBMYWPNWCTWAQ-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO COc1cnc(Nc2c[nH+]cc(C)c2C)cn1 ZINC001213525308 970346700 /nfs/dbraw/zinc/34/67/00/970346700.db2.gz QYLSIDBVDFGJKC-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO CC(C)=CC(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000301216903 970354755 /nfs/dbraw/zinc/35/47/55/970354755.db2.gz KZKRPXCGMZJFCL-LBPRGKRZSA-N 1 2 249.358 2.380 20 0 BEADLO CC[C@@H]1C[C@H]([N@H+](C)CC(F)F)CCO1 ZINC001170240070 970616360 /nfs/dbraw/zinc/61/63/60/970616360.db2.gz CQXPZBCHAUSCDX-RKDXNWHRSA-N 1 2 207.264 2.141 20 0 BEADLO CC[C@@H]1C[C@H]([N@@H+](C)CC(F)F)CCO1 ZINC001170240070 970616366 /nfs/dbraw/zinc/61/63/66/970616366.db2.gz CQXPZBCHAUSCDX-RKDXNWHRSA-N 1 2 207.264 2.141 20 0 BEADLO CCCCCc1nnc(Cc2cn(C)c[nH+]2)o1 ZINC001256086101 970653394 /nfs/dbraw/zinc/65/33/94/970653394.db2.gz ROWNYOQSEROBFF-UHFFFAOYSA-N 1 2 234.303 2.127 20 0 BEADLO Cc1cc(-c2cc[nH]c(=O)c2)c2[nH+]ccn2c1 ZINC001243426921 970669928 /nfs/dbraw/zinc/66/99/28/970669928.db2.gz GUXGRNUQMNIBCR-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO C[C@@H]1C[C@H](Nc2ccc(N3CCCC3)[nH+]c2)CO1 ZINC000401805911 970730953 /nfs/dbraw/zinc/73/09/53/970730953.db2.gz BTSSTIPHQUYBOV-YPMHNXCESA-N 1 2 247.342 2.271 20 0 BEADLO CC1(CO)CC[NH+](C/C(Cl)=C/Cl)CC1 ZINC000401811635 970731786 /nfs/dbraw/zinc/73/17/86/970731786.db2.gz UOBARYUBJQJMJB-TWGQIWQCSA-N 1 2 238.158 2.400 20 0 BEADLO COC(=O)C1([NH2+][C@H](C)CCC(C)C)CC1 ZINC001256350893 970745333 /nfs/dbraw/zinc/74/53/33/970745333.db2.gz FPAWHUAXPIFJBG-SNVBAGLBSA-N 1 2 213.321 2.106 20 0 BEADLO Cc1cc(-c2ccc(CO)nc2)cn2cc[nH+]c12 ZINC001243468860 970762240 /nfs/dbraw/zinc/76/22/40/970762240.db2.gz SMBBCMOVZLZPKA-UHFFFAOYSA-N 1 2 239.278 2.197 20 0 BEADLO C[NH+](C)Cc1nnc([C@@H]2CCC[C@@H]3C[C@@H]32)o1 ZINC001327351782 972558852 /nfs/dbraw/zinc/55/88/52/972558852.db2.gz CDDPDFVTTJMZGO-BBBLOLIVSA-N 1 2 221.304 2.035 20 0 BEADLO Cc1c(O)cccc1C[N@@H+]1CCC(=O)[C@H](C)C1 ZINC001144108011 972575158 /nfs/dbraw/zinc/57/51/58/972575158.db2.gz RTMALBAAKYFMAR-SNVBAGLBSA-N 1 2 233.311 2.112 20 0 BEADLO Cc1c(O)cccc1C[N@H+]1CCC(=O)[C@H](C)C1 ZINC001144108011 972575165 /nfs/dbraw/zinc/57/51/65/972575165.db2.gz RTMALBAAKYFMAR-SNVBAGLBSA-N 1 2 233.311 2.112 20 0 BEADLO Cc1c(O)cccc1C[NH+]1CC2(C1)CCCO2 ZINC001144111917 972586170 /nfs/dbraw/zinc/58/61/70/972586170.db2.gz WRZQMNSEAGBKQJ-UHFFFAOYSA-N 1 2 233.311 2.065 20 0 BEADLO Cn1c[nH+]cc1COC1Cc2ccccc2C1 ZINC001222588470 972591231 /nfs/dbraw/zinc/59/12/31/972591231.db2.gz YTWKVGLYWLDPBN-UHFFFAOYSA-N 1 2 228.295 2.104 20 0 BEADLO Cn1c[nH+]cc1CO[C@@H]1CCC(=O)CC1(C)C ZINC001222595318 972598901 /nfs/dbraw/zinc/59/89/01/972598901.db2.gz WMSHFZKEGQMBAP-GFCCVEGCSA-N 1 2 236.315 2.085 20 0 BEADLO Cn1c[nH+]cc1CO[C@H]1CCC(F)(F)C1 ZINC001222600972 972600889 /nfs/dbraw/zinc/60/08/89/972600889.db2.gz WVWUYNMFFRBDEP-VIFPVBQESA-N 1 2 216.231 2.125 20 0 BEADLO CCC[C@@H]1CCCC[C@@H]1[NH2+]Cc1ncn[nH]1 ZINC001327554329 972637129 /nfs/dbraw/zinc/63/71/29/972637129.db2.gz NTXLBSOGEMFHDJ-MNOVXSKESA-N 1 2 222.336 2.253 20 0 BEADLO COC(=O)Cc1cc[nH+]c(NC/C=C/C2CC2)c1 ZINC001327713304 972709307 /nfs/dbraw/zinc/70/93/07/972709307.db2.gz BJZFMKZEOYWKGV-NSCUHMNNSA-N 1 2 246.310 2.175 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nnc[nH]2)[C@@H]2CCCC[C@H]12 ZINC001327866409 972769003 /nfs/dbraw/zinc/76/90/03/972769003.db2.gz XBKXNKGYSSAKBK-IJLUTSLNSA-N 1 2 234.347 2.205 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nnc[nH]2)[C@@H]2CCCC[C@H]12 ZINC001327866409 972769014 /nfs/dbraw/zinc/76/90/14/972769014.db2.gz XBKXNKGYSSAKBK-IJLUTSLNSA-N 1 2 234.347 2.205 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nc[nH]n2)[C@@H]2CCCC[C@H]12 ZINC001327866409 972769029 /nfs/dbraw/zinc/76/90/29/972769029.db2.gz XBKXNKGYSSAKBK-IJLUTSLNSA-N 1 2 234.347 2.205 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nc[nH]n2)[C@@H]2CCCC[C@H]12 ZINC001327866409 972769042 /nfs/dbraw/zinc/76/90/42/972769042.db2.gz XBKXNKGYSSAKBK-IJLUTSLNSA-N 1 2 234.347 2.205 20 0 BEADLO COc1ccc(C[N@@H+]2C[C@@H](F)C[C@H]2C)nc1 ZINC001144420098 972812504 /nfs/dbraw/zinc/81/25/04/972812504.db2.gz VCMPMOUMRVAUHC-ZJUUUORDSA-N 1 2 224.279 2.023 20 0 BEADLO COc1ccc(C[N@H+]2C[C@@H](F)C[C@H]2C)nc1 ZINC001144420098 972812508 /nfs/dbraw/zinc/81/25/08/972812508.db2.gz VCMPMOUMRVAUHC-ZJUUUORDSA-N 1 2 224.279 2.023 20 0 BEADLO COc1ccc(C[N@@H+]2CCCC[C@H]2C(C)=O)nc1 ZINC001144430350 972812606 /nfs/dbraw/zinc/81/26/06/972812606.db2.gz FCLRWHLMUFGSRA-AWEZNQCLSA-N 1 2 248.326 2.034 20 0 BEADLO COc1ccc(C[N@H+]2CCCC[C@H]2C(C)=O)nc1 ZINC001144430350 972812617 /nfs/dbraw/zinc/81/26/17/972812617.db2.gz FCLRWHLMUFGSRA-AWEZNQCLSA-N 1 2 248.326 2.034 20 0 BEADLO COc1ncc(C[NH+]2CC3(CCC3)C2)cc1F ZINC001144454471 972837356 /nfs/dbraw/zinc/83/73/56/972837356.db2.gz FPLNGBFJQOJYSM-UHFFFAOYSA-N 1 2 236.290 2.215 20 0 BEADLO C[NH+]1CC(OCc2nccc3ccccc32)C1 ZINC001223138178 972850239 /nfs/dbraw/zinc/85/02/39/972850239.db2.gz VWSXNMSTEKTSJS-UHFFFAOYSA-N 1 2 228.295 2.065 20 0 BEADLO CC[NH+]1CC(OCc2ccc(C)s2)C1 ZINC001223187584 972859169 /nfs/dbraw/zinc/85/91/69/972859169.db2.gz ZNNXLKYNTISNLF-UHFFFAOYSA-N 1 2 211.330 2.277 20 0 BEADLO C[C@H](C(=O)N[C@H]1CC[C@@H](C)C[C@@H]1C)n1cc[nH+]c1 ZINC001328074863 972865789 /nfs/dbraw/zinc/86/57/89/972865789.db2.gz FHFDMTZPFAXPAT-XQHKEYJVSA-N 1 2 249.358 2.385 20 0 BEADLO C[NH+]1CC(OCc2cnc3ccccc3c2)C1 ZINC001223212021 972885397 /nfs/dbraw/zinc/88/53/97/972885397.db2.gz BHSPPNSDXVBRPX-UHFFFAOYSA-N 1 2 228.295 2.065 20 0 BEADLO Oc1cc(F)c(C[NH+]2CCCC2)cc1F ZINC001144646813 972905456 /nfs/dbraw/zinc/90/54/56/972905456.db2.gz LSFHYIHRDMYQFV-UHFFFAOYSA-N 1 2 213.227 2.266 20 0 BEADLO C[NH+]1CC(OCc2ccc3ccncc3c2)C1 ZINC001223382363 973034814 /nfs/dbraw/zinc/03/48/14/973034814.db2.gz XLRXZUVDFJANTF-UHFFFAOYSA-N 1 2 228.295 2.065 20 0 BEADLO CC(C)(C)C[C@H]1CC[N@H+](Cc2nnc[nH]2)C1 ZINC001328412368 973037127 /nfs/dbraw/zinc/03/71/27/973037127.db2.gz KVIURXWNAWCPCP-SNVBAGLBSA-N 1 2 222.336 2.063 20 0 BEADLO CC(C)(C)C[C@H]1CC[N@@H+](Cc2nnc[nH]2)C1 ZINC001328412368 973037142 /nfs/dbraw/zinc/03/71/42/973037142.db2.gz KVIURXWNAWCPCP-SNVBAGLBSA-N 1 2 222.336 2.063 20 0 BEADLO CC(=O)[C@@H](C)OCc1cc(C)[nH+]c(C)c1 ZINC001223418849 973050896 /nfs/dbraw/zinc/05/08/96/973050896.db2.gz BMNCVTNYFIVUHH-LLVKDONJSA-N 1 2 207.273 2.193 20 0 BEADLO Cc1cc(COC[C@H]2CCCO2)cc(C)[nH+]1 ZINC001223420060 973057307 /nfs/dbraw/zinc/05/73/07/973057307.db2.gz HIIJFTZREUSGEA-CYBMUJFWSA-N 1 2 221.300 2.394 20 0 BEADLO Cc1cc(CO[C@H]2C=C(C)OC(=O)C2)cc(C)[nH+]1 ZINC001223422686 973062049 /nfs/dbraw/zinc/06/20/49/973062049.db2.gz YWGIHZWVKYJWKP-ZDUSSCGKSA-N 1 2 247.294 2.434 20 0 BEADLO COC(=O)C[C@@H](C)OCc1cc(C)[nH+]c(C)c1 ZINC001223422328 973062073 /nfs/dbraw/zinc/06/20/73/973062073.db2.gz WTYFFBPYCAUZSK-LLVKDONJSA-N 1 2 237.299 2.167 20 0 BEADLO C[C@H]1CC([N@@H+]2CC[C@H](N)C(F)(F)C2)C[C@H](C)C1 ZINC001246837630 973142118 /nfs/dbraw/zinc/14/21/18/973142118.db2.gz RHMDZYPXUBKKNV-FOGDFJRCSA-N 1 2 246.345 2.479 20 0 BEADLO C[C@H]1CC([N@H+]2CC[C@H](N)C(F)(F)C2)C[C@H](C)C1 ZINC001246837630 973142126 /nfs/dbraw/zinc/14/21/26/973142126.db2.gz RHMDZYPXUBKKNV-FOGDFJRCSA-N 1 2 246.345 2.479 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1Cc1cc(C)n[nH]1 ZINC001328709253 973291651 /nfs/dbraw/zinc/29/16/51/973291651.db2.gz XRSXPSIAXTUCKJ-OLZOCXBDSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@H+]1Cc1cc(C)n[nH]1 ZINC001328709253 973291667 /nfs/dbraw/zinc/29/16/67/973291667.db2.gz XRSXPSIAXTUCKJ-OLZOCXBDSA-N 1 2 237.347 2.108 20 0 BEADLO CC(=O)C[N@H+]1CCC[C@@H](c2cc(C(C)C)[nH]n2)C1 ZINC001330733392 1169959261 /nfs/dbraw/zinc/95/92/61/1169959261.db2.gz PVRXLGZVSCUHOK-GFCCVEGCSA-N 1 2 249.358 2.302 20 0 BEADLO CC(=O)C[N@@H+]1CCC[C@@H](c2cc(C(C)C)[nH]n2)C1 ZINC001330733392 1169959264 /nfs/dbraw/zinc/95/92/64/1169959264.db2.gz PVRXLGZVSCUHOK-GFCCVEGCSA-N 1 2 249.358 2.302 20 0 BEADLO O=C(NCc1c[nH+]cn1C1CCC1)c1ccco1 ZINC001147105207 973435592 /nfs/dbraw/zinc/43/55/92/973435592.db2.gz QKCDHMBWFMVOIJ-UHFFFAOYSA-N 1 2 245.282 2.131 20 0 BEADLO C[NH+]1CC(OCc2coc3ccccc23)C1 ZINC001224137794 973463424 /nfs/dbraw/zinc/46/34/24/973463424.db2.gz PLFKGVSMBRQRJJ-UHFFFAOYSA-N 1 2 217.268 2.263 20 0 BEADLO C[C@@H](C(=O)NCC[C@H]1CC=CCC1)n1cc[nH+]c1 ZINC001329182996 973551876 /nfs/dbraw/zinc/55/18/76/973551876.db2.gz FUROLROQQUXEKA-STQMWFEESA-N 1 2 247.342 2.307 20 0 BEADLO C[C@H](C(=O)N[C@@H](C)CC1CCC1)n1cc[nH+]c1 ZINC001332201314 1169967554 /nfs/dbraw/zinc/96/75/54/1169967554.db2.gz JNMLPWGQFPNPRX-WDEREUQCSA-N 1 2 235.331 2.139 20 0 BEADLO CCc1ccccc1C(=O)N(CC)C1C[NH+](C)C1 ZINC001148411624 973839809 /nfs/dbraw/zinc/83/98/09/973839809.db2.gz OQKAYNZQJHSLCF-UHFFFAOYSA-N 1 2 246.354 2.025 20 0 BEADLO CCN(C(=O)C[C@@H](C)n1cc[nH+]c1)C(C)(C)C ZINC001329598595 973846369 /nfs/dbraw/zinc/84/63/69/973846369.db2.gz XXNKXKCYWIFSDG-LLVKDONJSA-N 1 2 237.347 2.481 20 0 BEADLO c1coc(C2CC[NH+](Cc3ccon3)CC2)n1 ZINC000585576947 973924735 /nfs/dbraw/zinc/92/47/35/973924735.db2.gz IQYTVWVBBRFVHN-UHFFFAOYSA-N 1 2 233.271 2.042 20 0 BEADLO C[C@@]1([NH2+]Cc2nnc[nH]2)CCCc2ccccc21 ZINC001329876530 973986501 /nfs/dbraw/zinc/98/65/01/973986501.db2.gz LZKMEQFYLOZDHS-CQSZACIVSA-N 1 2 242.326 2.146 20 0 BEADLO C[C@]1([NH2+]Cc2nnc[nH]2)CCCc2ccccc21 ZINC001329876529 973986923 /nfs/dbraw/zinc/98/69/23/973986923.db2.gz LZKMEQFYLOZDHS-AWEZNQCLSA-N 1 2 242.326 2.146 20 0 BEADLO CCOC(=[NH2+])CCCCOC[C@H]1CCCO1 ZINC001224963156 974102085 /nfs/dbraw/zinc/10/20/85/974102085.db2.gz HMNRSKKTCJRJRU-LLVKDONJSA-N 1 2 229.320 2.366 20 0 BEADLO Cc1cccc2c1CC[C@@H]([N@@H+]1CCC(=O)C1)C2 ZINC001171571194 974105413 /nfs/dbraw/zinc/10/54/13/974105413.db2.gz UYHCFVGAJHISDF-CYBMUJFWSA-N 1 2 229.323 2.127 20 0 BEADLO Cc1cccc2c1CC[C@@H]([N@H+]1CCC(=O)C1)C2 ZINC001171571194 974105415 /nfs/dbraw/zinc/10/54/15/974105415.db2.gz UYHCFVGAJHISDF-CYBMUJFWSA-N 1 2 229.323 2.127 20 0 BEADLO CCOC(=[NH2+])CCCCO[C@@H]1CCOC[C@H]1F ZINC001224964719 974105913 /nfs/dbraw/zinc/10/59/13/974105913.db2.gz CBQOVJSKQUOLFV-GHMZBOCLSA-N 1 2 247.310 2.314 20 0 BEADLO CCOC(=[NH2+])CCCCO[C@@H]1CCOC[C@@H]1F ZINC001224964722 974106810 /nfs/dbraw/zinc/10/68/10/974106810.db2.gz CBQOVJSKQUOLFV-WDEREUQCSA-N 1 2 247.310 2.314 20 0 BEADLO C[NH+](C)Cc1nnc(C2(C)CCCCC2)o1 ZINC001330101782 974107607 /nfs/dbraw/zinc/10/76/07/974107607.db2.gz UZQDFVSKBVPZSW-UHFFFAOYSA-N 1 2 223.320 2.353 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1c1nnc(C[NH+](C)C)o1 ZINC001330100963 974107620 /nfs/dbraw/zinc/10/76/20/974107620.db2.gz QETGGKOVDQVKOX-SKDRFNHKSA-N 1 2 223.320 2.281 20 0 BEADLO C[C@H](C(=O)N(C)CC1CCCC1)n1cc[nH+]c1 ZINC000064089415 974146692 /nfs/dbraw/zinc/14/66/92/974146692.db2.gz NEUQIAMEEHQJPG-LLVKDONJSA-N 1 2 235.331 2.093 20 0 BEADLO Fc1cccc2c(C[NH+]3CCOCC3)c[nH]c21 ZINC000257850507 974154644 /nfs/dbraw/zinc/15/46/44/974154644.db2.gz BJIPARKGONOZBU-UHFFFAOYSA-N 1 2 234.274 2.139 20 0 BEADLO CC12CC(C[N@@H+]3CCCC(F)(F)C3)(C1)CO2 ZINC001171735763 974161989 /nfs/dbraw/zinc/16/19/89/974161989.db2.gz XUMCQPTXFFFUIO-UHFFFAOYSA-N 1 2 231.286 2.287 20 0 BEADLO CC12CC(C[N@H+]3CCCC(F)(F)C3)(C1)CO2 ZINC001171735763 974162010 /nfs/dbraw/zinc/16/20/10/974162010.db2.gz XUMCQPTXFFFUIO-UHFFFAOYSA-N 1 2 231.286 2.287 20 0 BEADLO C[C@H](Oc1cc[nH+]cc1)c1cncnc1 ZINC001225290843 974363252 /nfs/dbraw/zinc/36/32/52/974363252.db2.gz KBOJAAOUNUFWHS-VIFPVBQESA-N 1 2 201.229 2.012 20 0 BEADLO CC(C)CCOC(=O)[C@@H](C)Oc1cc[nH+]cc1 ZINC001225295604 974368520 /nfs/dbraw/zinc/36/85/20/974368520.db2.gz LZWXWAKYQVKTGX-LLVKDONJSA-N 1 2 237.299 2.438 20 0 BEADLO CC[NH+]1CC(Oc2cc(C)ccc2OC)C1 ZINC001225324044 974398084 /nfs/dbraw/zinc/39/80/84/974398084.db2.gz KKCHQXAOFWRDAB-UHFFFAOYSA-N 1 2 221.300 2.087 20 0 BEADLO CC(C)c1ocnc1C[NH2+][C@@H](C)c1ccnn1C ZINC001330693649 974423461 /nfs/dbraw/zinc/42/34/61/974423461.db2.gz APMBCMUNWIWOKZ-JTQLQIEISA-N 1 2 248.330 2.382 20 0 BEADLO CCc1ccc(NC(=O)[C@H](C)n2cc[nH+]c2)nc1 ZINC001330829400 974491861 /nfs/dbraw/zinc/49/18/61/974491861.db2.gz AFABZYODOOINKX-JTQLQIEISA-N 1 2 244.298 2.040 20 0 BEADLO FC1(F)[C@H]2C[N@H+](Cc3nc4ccccc4[nH]3)C[C@H]21 ZINC001330862221 974508672 /nfs/dbraw/zinc/50/86/72/974508672.db2.gz PQRTVZUAEOIIRS-DTORHVGOSA-N 1 2 249.264 2.260 20 0 BEADLO FC1(F)[C@H]2C[N@@H+](Cc3nc4ccccc4[nH]3)C[C@H]21 ZINC001330862221 974508677 /nfs/dbraw/zinc/50/86/77/974508677.db2.gz PQRTVZUAEOIIRS-DTORHVGOSA-N 1 2 249.264 2.260 20 0 BEADLO CC1(C)C[C@@H]([NH+]2CC(Oc3ccccc3)C2)CO1 ZINC001172287571 974549518 /nfs/dbraw/zinc/54/95/18/974549518.db2.gz XPLKAQSHXUREIQ-GFCCVEGCSA-N 1 2 247.338 2.317 20 0 BEADLO CCCOC(=O)C[NH2+][C@H](C)CCO[C@H](C)CC ZINC001172353818 974625065 /nfs/dbraw/zinc/62/50/65/974625065.db2.gz YDXXHTVSRMQXOO-VXGBXAGGSA-N 1 2 245.363 2.123 20 0 BEADLO CCOC(=O)C1([NH2+][C@@H]2CC[C@H](C)[C@H](C)C2)CC1 ZINC001172358646 974627012 /nfs/dbraw/zinc/62/70/12/974627012.db2.gz JGZUFHYYHOAISU-QJPTWQEYSA-N 1 2 239.359 2.496 20 0 BEADLO CC[NH+]1CC(Oc2ccc(C)c(F)c2)C1 ZINC001225772790 974676781 /nfs/dbraw/zinc/67/67/81/974676781.db2.gz QSZSOOMKDPMMND-UHFFFAOYSA-N 1 2 209.264 2.217 20 0 BEADLO CC(C)[NH+]1CC(Oc2cnc(Cl)c(F)c2)C1 ZINC001225790558 974684235 /nfs/dbraw/zinc/68/42/35/974684235.db2.gz NLPZLMPDQQYEFO-UHFFFAOYSA-N 1 2 244.697 2.346 20 0 BEADLO CC(C)(C)[NH+]1CC(Oc2c(O)cccc2F)C1 ZINC001225802280 974689276 /nfs/dbraw/zinc/68/92/76/974689276.db2.gz ZFKVRYNSDIVWTG-UHFFFAOYSA-N 1 2 239.290 2.393 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2CCOC3(CCCC3)C2)c1C ZINC001331527638 974748603 /nfs/dbraw/zinc/74/86/03/974748603.db2.gz CEILFHJCYYWYCW-UHFFFAOYSA-N 1 2 249.358 2.172 20 0 BEADLO Cc1n[nH]c(C[N@H+]2CCOC3(CCCC3)C2)c1C ZINC001331527638 974748611 /nfs/dbraw/zinc/74/86/11/974748611.db2.gz CEILFHJCYYWYCW-UHFFFAOYSA-N 1 2 249.358 2.172 20 0 BEADLO Cc1n[nH]c(C)c1C[N@H+](C)Cc1ccns1 ZINC001331564323 974763787 /nfs/dbraw/zinc/76/37/87/974763787.db2.gz AQBWUQDCMNNIIR-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1n[nH]c(C)c1C[N@@H+](C)Cc1ccns1 ZINC001331564323 974763794 /nfs/dbraw/zinc/76/37/94/974763794.db2.gz AQBWUQDCMNNIIR-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO CC(C)c1ocnc1CN1CCc2[nH+]c[nH]c2C1 ZINC001331591691 974770772 /nfs/dbraw/zinc/77/07/72/974770772.db2.gz YIYDNLJTMYFUPU-UHFFFAOYSA-N 1 2 246.314 2.079 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N[C@@H]2CC[C@@H](C)C2)c[nH+]1 ZINC001331728090 974806344 /nfs/dbraw/zinc/80/63/44/974806344.db2.gz CYKRWWKLYLBEIQ-ZYHUDNBSSA-N 1 2 249.358 2.231 20 0 BEADLO CCCn1ncnc1Cn1c[nH+]c(C(C)(C)C)c1 ZINC001331891938 974852728 /nfs/dbraw/zinc/85/27/28/974852728.db2.gz QQCCDNAIQDNLBL-UHFFFAOYSA-N 1 2 247.346 2.230 20 0 BEADLO CC[NH+]1CC(Oc2cc(C)cc(O)c2C)C1 ZINC001226522177 974943302 /nfs/dbraw/zinc/94/33/02/974943302.db2.gz HIJMOAVUIPPJSI-UHFFFAOYSA-N 1 2 221.300 2.092 20 0 BEADLO CCc1nn(C[N@@H+]2CC[C@@H](C)[C@@H]2C)c(=S)o1 ZINC001332125895 974952502 /nfs/dbraw/zinc/95/25/02/974952502.db2.gz QKBRERINDFOYBS-BDAKNGLRSA-N 1 2 241.360 2.456 20 0 BEADLO CCc1nn(C[N@H+]2CC[C@@H](C)[C@@H]2C)c(=S)o1 ZINC001332125895 974952508 /nfs/dbraw/zinc/95/25/08/974952508.db2.gz QKBRERINDFOYBS-BDAKNGLRSA-N 1 2 241.360 2.456 20 0 BEADLO C[NH+]1CC(Oc2ccc3c(c2)CCCC3)C1 ZINC001226760446 975061875 /nfs/dbraw/zinc/06/18/75/975061875.db2.gz JZUHYFLHCQKSAD-UHFFFAOYSA-N 1 2 217.312 2.258 20 0 BEADLO CCOC(=O)C[NH2+][C@H](C)Cc1ccc(CC)cc1 ZINC001173244124 975079597 /nfs/dbraw/zinc/07/95/97/975079597.db2.gz MQOFLXDSCPVPKL-GFCCVEGCSA-N 1 2 249.354 2.333 20 0 BEADLO C[C@@H](C(=O)NCCC[C@@H]1C=CCC1)n1cc[nH+]c1 ZINC001332398499 975092775 /nfs/dbraw/zinc/09/27/75/975092775.db2.gz WYAGHXDAGIDYLM-QWHCGFSZSA-N 1 2 247.342 2.307 20 0 BEADLO Cc1nocc1Nc1cccc2[nH+]ccn21 ZINC001212717558 975103404 /nfs/dbraw/zinc/10/34/04/975103404.db2.gz JCKUTKCGZAGOEF-UHFFFAOYSA-N 1 2 214.228 2.374 20 0 BEADLO CC[C@@H]1CC[C@@H]([N@@H+]2C[C@H](F)C[C@H]2C(=O)OC)C1 ZINC001173280299 975233296 /nfs/dbraw/zinc/23/32/96/975233296.db2.gz LMPNYZJSFHQFPH-KKOKHZNYSA-N 1 2 243.322 2.151 20 0 BEADLO CC[C@@H]1CC[C@@H]([N@H+]2C[C@H](F)C[C@H]2C(=O)OC)C1 ZINC001173280299 975233304 /nfs/dbraw/zinc/23/33/04/975233304.db2.gz LMPNYZJSFHQFPH-KKOKHZNYSA-N 1 2 243.322 2.151 20 0 BEADLO CC[C@@H]1CC[C@H]([N@@H+]2C[C@H](F)C[C@H]2C(=O)OC)C1 ZINC001173280308 975236500 /nfs/dbraw/zinc/23/65/00/975236500.db2.gz LMPNYZJSFHQFPH-WYUUTHIRSA-N 1 2 243.322 2.151 20 0 BEADLO CC[C@@H]1CC[C@H]([N@H+]2C[C@H](F)C[C@H]2C(=O)OC)C1 ZINC001173280308 975236506 /nfs/dbraw/zinc/23/65/06/975236506.db2.gz LMPNYZJSFHQFPH-WYUUTHIRSA-N 1 2 243.322 2.151 20 0 BEADLO C[C@H](C(=O)N[C@@H]1C[C@H]1CC(C)(C)C)n1cc[nH+]c1 ZINC001332702259 975261168 /nfs/dbraw/zinc/26/11/68/975261168.db2.gz APFWJVKPMKKCSW-GRYCIOLGSA-N 1 2 249.358 2.385 20 0 BEADLO Cc1cc[nH+]c(C)c1OC1CCOCC1 ZINC001227261046 975336212 /nfs/dbraw/zinc/33/62/12/975336212.db2.gz XCORSCMLMXMFOD-UHFFFAOYSA-N 1 2 207.273 2.256 20 0 BEADLO Cc1cc[nH+]c(C)c1O[C@@H]1CCOC[C@@H]1F ZINC001227262679 975340661 /nfs/dbraw/zinc/34/06/61/975340661.db2.gz UVMSPBHYHWWNOZ-WDEREUQCSA-N 1 2 225.263 2.204 20 0 BEADLO CC[C@H](C)[C@H](C[NH2+][C@H](C)c1noc(C)n1)OC ZINC001332998473 975363338 /nfs/dbraw/zinc/36/33/38/975363338.db2.gz FVAPXRISYBPNIN-NGZCFLSTSA-N 1 2 241.335 2.090 20 0 BEADLO C[NH+]1CC(Oc2ccc3ccc(O)cc3c2)C1 ZINC001227452517 975436620 /nfs/dbraw/zinc/43/66/20/975436620.db2.gz FSWNBOFYCRNZSR-UHFFFAOYSA-N 1 2 229.279 2.238 20 0 BEADLO CCOC(=O)C[C@@H]1CC[C@@H]([NH+]2CC(C)(F)C2)C1 ZINC001173643668 975515470 /nfs/dbraw/zinc/51/54/70/975515470.db2.gz XGMQWKMQBFNVLC-GHMZBOCLSA-N 1 2 243.322 2.152 20 0 BEADLO CC(C)[NH+]1CC(Oc2cccc(Cl)n2)C1 ZINC001227929401 975800164 /nfs/dbraw/zinc/80/01/64/975800164.db2.gz LNGVLWIRGPKLNT-UHFFFAOYSA-N 1 2 226.707 2.206 20 0 BEADLO COc1ccc(Nc2ccc(N(C)C)[nH+]c2)cn1 ZINC001173957695 975988478 /nfs/dbraw/zinc/98/84/78/975988478.db2.gz JAXKCRJNVBFWMH-UHFFFAOYSA-N 1 2 244.298 2.295 20 0 BEADLO CC(C)OC1C[NH+](Cc2cccn2C2CC2)C1 ZINC001333849049 976121823 /nfs/dbraw/zinc/12/18/23/976121823.db2.gz IJTLBVGQJFTKNV-UHFFFAOYSA-N 1 2 234.343 2.432 20 0 BEADLO Cc1[nH]c2ccc(O[C@@H]3CCOC3)cc2[nH+]1 ZINC001228327455 976123706 /nfs/dbraw/zinc/12/37/06/976123706.db2.gz QXRSXGWOYIPBQE-SNVBAGLBSA-N 1 2 218.256 2.039 20 0 BEADLO C1=C(Nc2ccc[nH+]c2N2CCOCC2)CCC1 ZINC001173997072 976140740 /nfs/dbraw/zinc/14/07/40/976140740.db2.gz QUPLSVVBLMNMGL-UHFFFAOYSA-N 1 2 245.326 2.398 20 0 BEADLO O[C@H]1CCN(c2ccc(NC3=CCCC3)c[nH+]2)C1 ZINC001174000043 976156865 /nfs/dbraw/zinc/15/68/65/976156865.db2.gz XEYBHCUVEROWBM-ZDUSSCGKSA-N 1 2 245.326 2.132 20 0 BEADLO c1coc(Nc2cc[nH+]c3ccccc23)n1 ZINC001174037345 976242479 /nfs/dbraw/zinc/24/24/79/976242479.db2.gz PVWZEQBAZCVNAM-UHFFFAOYSA-N 1 2 211.224 2.388 20 0 BEADLO COc1ncccc1Nc1ccc(N(C)C)[nH+]c1 ZINC001174040585 976244430 /nfs/dbraw/zinc/24/44/30/976244430.db2.gz QLFRFRGAEFYQPE-UHFFFAOYSA-N 1 2 244.298 2.295 20 0 BEADLO Cc1ccc(C(C)(C)[NH2+]Cc2nncs2)cn1 ZINC001334069024 976273325 /nfs/dbraw/zinc/27/33/25/976273325.db2.gz CQIJSGOMTLLZCE-UHFFFAOYSA-N 1 2 248.355 2.266 20 0 BEADLO CCc1cc(N[C@@H](CC)[C@H](C)O)nc(CC)[nH+]1 ZINC001334265154 976414072 /nfs/dbraw/zinc/41/40/72/976414072.db2.gz QFEJPBWOIMYQPW-ONGXEEELSA-N 1 2 237.347 2.173 20 0 BEADLO Cc1nn(C)c(C)c1Nc1cccn2cc[nH+]c12 ZINC001174225743 976418956 /nfs/dbraw/zinc/41/89/56/976418956.db2.gz MDHCPAIUMNVPDS-UHFFFAOYSA-N 1 2 241.298 2.428 20 0 BEADLO Cc1nn(C)c(C)c1Nc1ccc(N(C)C)[nH+]c1 ZINC001174223974 976419882 /nfs/dbraw/zinc/41/98/82/976419882.db2.gz JKBZTLJFMRQGEW-UHFFFAOYSA-N 1 2 245.330 2.242 20 0 BEADLO Cc1[nH+]cn(C)c1Nc1ccc2nccn2c1 ZINC001174279221 976430310 /nfs/dbraw/zinc/43/03/10/976430310.db2.gz XZCQLNAGWSKRNI-UHFFFAOYSA-N 1 2 227.271 2.120 20 0 BEADLO C[N@@H+]1CCO[C@H](COc2ccc3ccoc3c2)C1 ZINC001228728000 976462186 /nfs/dbraw/zinc/46/21/86/976462186.db2.gz SYCQJUMPSKFTLA-ZDUSSCGKSA-N 1 2 247.294 2.142 20 0 BEADLO C[N@H+]1CCO[C@H](COc2ccc3ccoc3c2)C1 ZINC001228728000 976462192 /nfs/dbraw/zinc/46/21/92/976462192.db2.gz SYCQJUMPSKFTLA-ZDUSSCGKSA-N 1 2 247.294 2.142 20 0 BEADLO Cc1cc2ccccc2c(OC2C[NH+](C)C2)n1 ZINC001228734863 976467491 /nfs/dbraw/zinc/46/74/91/976467491.db2.gz PHAWMUOAPSWGMY-UHFFFAOYSA-N 1 2 228.295 2.236 20 0 BEADLO c1cn(-c2cccc(Nc3cn[nH]c3)c2)c[nH+]1 ZINC001174293637 976468904 /nfs/dbraw/zinc/46/89/04/976468904.db2.gz PVRFVIUXMDXUBU-UHFFFAOYSA-N 1 2 225.255 2.339 20 0 BEADLO Cn1cc(Nc2ccc(-n3cc[nH+]c3)cc2)cn1 ZINC001174330285 976534167 /nfs/dbraw/zinc/53/41/67/976534167.db2.gz UXMMATOWZQGVNQ-UHFFFAOYSA-N 1 2 239.282 2.349 20 0 BEADLO CC[C@@](C)(NC(=O)[C@H](C)n1cc[nH+]c1)C1CC1 ZINC001334566638 976554697 /nfs/dbraw/zinc/55/46/97/976554697.db2.gz RRRYWIWXEFIDBM-GXFFZTMASA-N 1 2 235.331 2.139 20 0 BEADLO Cc1nn(C)cc1Nc1ccn2cc[nH+]c2c1 ZINC001174335187 976554769 /nfs/dbraw/zinc/55/47/69/976554769.db2.gz XFEQANRBKOBILH-UHFFFAOYSA-N 1 2 227.271 2.120 20 0 BEADLO Cc1cc(C)c(Nc2cncnc2)c[nH+]1 ZINC001174383214 976617405 /nfs/dbraw/zinc/61/74/05/976617405.db2.gz ULWAOXOFFISBCN-UHFFFAOYSA-N 1 2 200.245 2.232 20 0 BEADLO CC(C)[NH+]1CC(Oc2ncccc2C2CC2)C1 ZINC001229020181 976663115 /nfs/dbraw/zinc/66/31/15/976663115.db2.gz JPLFXROXSPXRHW-UHFFFAOYSA-N 1 2 232.327 2.430 20 0 BEADLO COc1cc[nH+]cc1Nc1cnn(CC2CC2)c1 ZINC001174467438 976766014 /nfs/dbraw/zinc/76/60/14/976766014.db2.gz MTIBTWQAPHXZGE-UHFFFAOYSA-N 1 2 244.298 2.440 20 0 BEADLO CCc1cc(NC[C@H]2CCOC2)nc(CC)[nH+]1 ZINC001334901180 976782660 /nfs/dbraw/zinc/78/26/60/976782660.db2.gz HDWLPPKXNGXLFT-SNVBAGLBSA-N 1 2 235.331 2.050 20 0 BEADLO Cc1c[nH+]ccc1Nc1c[nH]c(Cl)cc1=O ZINC001174536170 976817271 /nfs/dbraw/zinc/81/72/71/976817271.db2.gz JCRBDQHFQVISMW-UHFFFAOYSA-N 1 2 235.674 2.310 20 0 BEADLO CNC(=O)c1ccc(Nc2[nH+]cccc2C)cc1 ZINC001174509706 976836721 /nfs/dbraw/zinc/83/67/21/976836721.db2.gz ICWMUMMNAXNZBS-UHFFFAOYSA-N 1 2 241.294 2.493 20 0 BEADLO CCN(C)c1ccc(Nc2cnn(CC)c2)c[nH+]1 ZINC001174567655 976884426 /nfs/dbraw/zinc/88/44/26/976884426.db2.gz FRVKMADCZGUNBI-UHFFFAOYSA-N 1 2 245.330 2.498 20 0 BEADLO OCCc1ccc[nH+]c1Nc1ccc(O)c(F)c1 ZINC001174734551 976977463 /nfs/dbraw/zinc/97/74/63/976977463.db2.gz FMOHPSJKBSBYHT-UHFFFAOYSA-N 1 2 248.257 2.205 20 0 BEADLO Cc1cc(Nc2cccn3cc[nH+]c23)n(C)n1 ZINC001174820196 977073869 /nfs/dbraw/zinc/07/38/69/977073869.db2.gz HMYSKIPFQKSKGF-UHFFFAOYSA-N 1 2 227.271 2.120 20 0 BEADLO Cc1cc(Nc2cccc(C)[nH+]2)n(C)n1 ZINC001174822506 977080056 /nfs/dbraw/zinc/08/00/56/977080056.db2.gz VFEUTFYQRIHTQV-UHFFFAOYSA-N 1 2 202.261 2.176 20 0 BEADLO CCOc1ccc(C[NH2+]Cc2cnc(C)o2)o1 ZINC001335544504 977135042 /nfs/dbraw/zinc/13/50/42/977135042.db2.gz XXRSYHGWEITQII-UHFFFAOYSA-N 1 2 236.271 2.265 20 0 BEADLO N#Cc1ccc(C[NH+]2Cc3ccccc3C2)cn1 ZINC000260034269 977168847 /nfs/dbraw/zinc/16/88/47/977168847.db2.gz FXOKCNTUHSEDNU-UHFFFAOYSA-N 1 2 235.290 2.469 20 0 BEADLO Cc1ccc(Nc2[nH+]cccc2N)cc1N ZINC001174932565 977170343 /nfs/dbraw/zinc/17/03/43/977170343.db2.gz BCTQVDWSCDVQQO-UHFFFAOYSA-N 1 2 214.272 2.298 20 0 BEADLO C[NH+]1CC(Oc2ccc(O)c3ccccc23)C1 ZINC001230456927 977215258 /nfs/dbraw/zinc/21/52/58/977215258.db2.gz NMAZWCQVARUWBK-UHFFFAOYSA-N 1 2 229.279 2.238 20 0 BEADLO COc1cc(Nc2ccncc2F)cc(C)[nH+]1 ZINC001175198938 977301441 /nfs/dbraw/zinc/30/14/41/977301441.db2.gz PIJZZZAFAFAZDN-UHFFFAOYSA-N 1 2 233.246 2.098 20 0 BEADLO CN(C)c1ccc(N(C)c2cccc(N)c2)c[nH+]1 ZINC001175344026 977366100 /nfs/dbraw/zinc/36/61/00/977366100.db2.gz NNOOIRNEFGVQEO-UHFFFAOYSA-N 1 2 242.326 2.498 20 0 BEADLO c1nocc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175346203 977366536 /nfs/dbraw/zinc/36/65/36/977366536.db2.gz ODOBZJODVAFZHQ-UHFFFAOYSA-N 1 2 230.271 2.413 20 0 BEADLO CN(C)c1ccc(Nc2ccc(F)cn2)c[nH+]1 ZINC001175337397 977382865 /nfs/dbraw/zinc/38/28/65/977382865.db2.gz GRGIEMNJOUASPG-UHFFFAOYSA-N 1 2 232.262 2.425 20 0 BEADLO CN(C)c1ccc(Nc2nonc2C2CC2)c[nH+]1 ZINC001175341312 977387320 /nfs/dbraw/zinc/38/73/20/977387320.db2.gz FLBRQAVCJYATQK-UHFFFAOYSA-N 1 2 245.286 2.152 20 0 BEADLO CCn1cc(Nc2ccc(N(C)C)[nH+]c2)c(C)n1 ZINC001175338722 977387448 /nfs/dbraw/zinc/38/74/48/977387448.db2.gz LKZZWENBPHWUOV-UHFFFAOYSA-N 1 2 245.330 2.416 20 0 BEADLO Cc1ncnc(C)c1Nc1ccc(N(C)C)[nH+]c1 ZINC001175340109 977389090 /nfs/dbraw/zinc/38/90/90/977389090.db2.gz AHLLNPLKFHEOKC-UHFFFAOYSA-N 1 2 243.314 2.298 20 0 BEADLO CC[NH+]1CC(Oc2ccc(Cl)c(OC)c2)C1 ZINC001230981081 977414410 /nfs/dbraw/zinc/41/44/10/977414410.db2.gz LEAMBMQURBTVRS-UHFFFAOYSA-N 1 2 241.718 2.432 20 0 BEADLO C[S@](=O)c1ccc(Nc2[nH+]cccc2N)cc1 ZINC001175471776 977439684 /nfs/dbraw/zinc/43/96/84/977439684.db2.gz VLTZHEJOEXBEBR-KRWDZBQOSA-N 1 2 247.323 2.145 20 0 BEADLO CC[NH+]1CC(Oc2nccc3ccsc32)C1 ZINC001231346775 977573514 /nfs/dbraw/zinc/57/35/14/977573514.db2.gz BFDAYPKBPVUGTI-UHFFFAOYSA-N 1 2 234.324 2.379 20 0 BEADLO C[N@@H+]1CCCC(=Nc2snc3cccnc32)C1 ZINC001175577393 977584882 /nfs/dbraw/zinc/58/48/82/977584882.db2.gz RTSCULDAGSJQBU-UHFFFAOYSA-N 1 2 246.339 2.323 20 0 BEADLO C[N@H+]1CCCC(=Nc2snc3cccnc32)C1 ZINC001175577393 977584891 /nfs/dbraw/zinc/58/48/91/977584891.db2.gz RTSCULDAGSJQBU-UHFFFAOYSA-N 1 2 246.339 2.323 20 0 BEADLO C[C@@H]1CC(=O)CC[N@@H+]1Cc1c[nH]c2cnccc12 ZINC001231514549 977625588 /nfs/dbraw/zinc/62/55/88/977625588.db2.gz SLJVIIGZKDWCQI-SNVBAGLBSA-N 1 2 243.310 2.116 20 0 BEADLO C[C@@H]1CC(=O)CC[N@H+]1Cc1c[nH]c2cnccc12 ZINC001231514549 977625595 /nfs/dbraw/zinc/62/55/95/977625595.db2.gz SLJVIIGZKDWCQI-SNVBAGLBSA-N 1 2 243.310 2.116 20 0 BEADLO C[N@H+](CCF)Cc1cc(Br)c[nH]1 ZINC001231577988 977634531 /nfs/dbraw/zinc/63/45/31/977634531.db2.gz FGZBKGPPRYQVMK-UHFFFAOYSA-N 1 2 235.100 2.179 20 0 BEADLO C[N@@H+](CCF)Cc1cc(Br)c[nH]1 ZINC001231577988 977634542 /nfs/dbraw/zinc/63/45/42/977634542.db2.gz FGZBKGPPRYQVMK-UHFFFAOYSA-N 1 2 235.100 2.179 20 0 BEADLO CC(C)(C)[C@@H]1CCN1C(=O)CCCn1cc[nH+]c1 ZINC001336356779 977643461 /nfs/dbraw/zinc/64/34/61/977643461.db2.gz TXFRLWOYARGVIQ-LBPRGKRZSA-N 1 2 249.358 2.310 20 0 BEADLO CCOc1ccc(C[N@@H+]2C[C@@H](F)C[C@H]2C)cn1 ZINC001231650304 977664933 /nfs/dbraw/zinc/66/49/33/977664933.db2.gz XXOJQDFBZSICMB-PWSUYJOCSA-N 1 2 238.306 2.413 20 0 BEADLO CCOc1ccc(C[N@H+]2C[C@@H](F)C[C@H]2C)cn1 ZINC001231650304 977664945 /nfs/dbraw/zinc/66/49/45/977664945.db2.gz XXOJQDFBZSICMB-PWSUYJOCSA-N 1 2 238.306 2.413 20 0 BEADLO COCC1C[NH+](Cc2ccc(Cl)c(O)c2)C1 ZINC001231730528 977719272 /nfs/dbraw/zinc/71/92/72/977719272.db2.gz BNTDDTBYCDIJMY-UHFFFAOYSA-N 1 2 241.718 2.124 20 0 BEADLO COc1ncc(F)cc1C[NH+]1CC2(CCC2)C1 ZINC001231740148 977724168 /nfs/dbraw/zinc/72/41/68/977724168.db2.gz UXWXIBGHCVGGQF-UHFFFAOYSA-N 1 2 236.290 2.215 20 0 BEADLO COc1ncc(F)cc1C[N@@H+]1CCC[C@@H]2C[C@@H]21 ZINC001231743231 977724461 /nfs/dbraw/zinc/72/44/61/977724461.db2.gz ZTVAJMNPDLSCHK-SKDRFNHKSA-N 1 2 236.290 2.214 20 0 BEADLO COc1ncc(F)cc1C[N@H+]1CCC[C@@H]2C[C@@H]21 ZINC001231743231 977724474 /nfs/dbraw/zinc/72/44/74/977724474.db2.gz ZTVAJMNPDLSCHK-SKDRFNHKSA-N 1 2 236.290 2.214 20 0 BEADLO CCOc1ncccc1C[N@@H+]1CCC[C@@H]1CF ZINC001231767394 977743396 /nfs/dbraw/zinc/74/33/96/977743396.db2.gz VADXFNCPYIHLCG-GFCCVEGCSA-N 1 2 238.306 2.414 20 0 BEADLO CCOc1ncccc1C[N@H+]1CCC[C@@H]1CF ZINC001231767394 977743408 /nfs/dbraw/zinc/74/34/08/977743408.db2.gz VADXFNCPYIHLCG-GFCCVEGCSA-N 1 2 238.306 2.414 20 0 BEADLO CSc1ccccc1C[N@@H+]1CCO[C@H]2C[C@H]21 ZINC001231786641 977746015 /nfs/dbraw/zinc/74/60/15/977746015.db2.gz IBFADHPHMUOGHO-NEPJUHHUSA-N 1 2 235.352 2.382 20 0 BEADLO CSc1ccccc1C[N@H+]1CCO[C@H]2C[C@H]21 ZINC001231786641 977746026 /nfs/dbraw/zinc/74/60/26/977746026.db2.gz IBFADHPHMUOGHO-NEPJUHHUSA-N 1 2 235.352 2.382 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1ccnc(C(F)F)c1 ZINC001231893341 977786528 /nfs/dbraw/zinc/78/65/28/977786528.db2.gz CVTPSIWRBGVBQJ-SNVBAGLBSA-N 1 2 242.269 2.240 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1ccnc(C(F)F)c1 ZINC001231893341 977786542 /nfs/dbraw/zinc/78/65/42/977786542.db2.gz CVTPSIWRBGVBQJ-SNVBAGLBSA-N 1 2 242.269 2.240 20 0 BEADLO CC[N@H+](CCOC)Cc1cc(Cl)cnc1F ZINC001231992107 977825617 /nfs/dbraw/zinc/82/56/17/977825617.db2.gz MEFKMPDLLVJFBT-UHFFFAOYSA-N 1 2 246.713 2.342 20 0 BEADLO CC[N@@H+](CCOC)Cc1cc(Cl)cnc1F ZINC001231992107 977825624 /nfs/dbraw/zinc/82/56/24/977825624.db2.gz MEFKMPDLLVJFBT-UHFFFAOYSA-N 1 2 246.713 2.342 20 0 BEADLO C[NH+](C)Cc1ncc(Br)cc1F ZINC001231987393 977826352 /nfs/dbraw/zinc/82/63/52/977826352.db2.gz UCPLJRPVWZLOMB-UHFFFAOYSA-N 1 2 233.084 2.045 20 0 BEADLO Cc1cc(F)ncc1C[N@@H+]1CCC[C@@H]1CF ZINC001231987299 977826428 /nfs/dbraw/zinc/82/64/28/977826428.db2.gz RIMQYBNNPJJGIS-LLVKDONJSA-N 1 2 226.270 2.463 20 0 BEADLO Cc1cc(F)ncc1C[N@H+]1CCC[C@@H]1CF ZINC001231987299 977826436 /nfs/dbraw/zinc/82/64/36/977826436.db2.gz RIMQYBNNPJJGIS-LLVKDONJSA-N 1 2 226.270 2.463 20 0 BEADLO COC[C@]1(C)CCN(c2cc(F)cc(C)[nH+]2)C1 ZINC001336646432 977827717 /nfs/dbraw/zinc/82/77/17/977827717.db2.gz JEGUNCFHDZVAHO-CYBMUJFWSA-N 1 2 238.306 2.392 20 0 BEADLO COc1cccc2[nH]cc(C[NH+]3CC(OC)C3)c21 ZINC001232033701 977858100 /nfs/dbraw/zinc/85/81/00/977858100.db2.gz PMFNUGGRZHRENE-UHFFFAOYSA-N 1 2 246.310 2.007 20 0 BEADLO C/C=C\C[C@@H]1CCCN(c2cc(N)nc[nH+]2)C1 ZINC001336702993 977865526 /nfs/dbraw/zinc/86/55/26/977865526.db2.gz IYVYYYCHZFMSRM-OTDNITJGSA-N 1 2 232.331 2.241 20 0 BEADLO FC(F)C1C[NH+](Cc2cc3ncccc3[nH]2)C1 ZINC001232066539 977877658 /nfs/dbraw/zinc/87/76/58/977877658.db2.gz HUMSQLXXQRBNQN-UHFFFAOYSA-N 1 2 237.253 2.260 20 0 BEADLO FC(F)(F)c1cccc(C[NH+]2CCC2)n1 ZINC001232067004 977877955 /nfs/dbraw/zinc/87/79/55/977877955.db2.gz NDPDBAZBCPVOOK-UHFFFAOYSA-N 1 2 216.206 2.306 20 0 BEADLO Nc1ccc(N(c2[nH]cc[nH+]2)C2CCCC2)nc1 ZINC001176082433 977878877 /nfs/dbraw/zinc/87/88/77/977878877.db2.gz KFHCNLSCOOFLLQ-UHFFFAOYSA-N 1 2 243.314 2.468 20 0 BEADLO CCc1ncnc(NCc2[nH]c(C)c(C)[nH+]2)c1F ZINC001336727566 977885418 /nfs/dbraw/zinc/88/54/18/977885418.db2.gz ZEHKAJRVRVFKLQ-UHFFFAOYSA-N 1 2 249.293 2.130 20 0 BEADLO Cc1cc2c(cccc2N)n1-c1[nH]cc[nH+]1 ZINC001176086063 977890403 /nfs/dbraw/zinc/89/04/03/977890403.db2.gz YDCWSHRCNUMANZ-UHFFFAOYSA-N 1 2 212.256 2.244 20 0 BEADLO C[C@H](Nc1cc(N(C)C)nc[nH+]1)C1(C)CC1 ZINC001336739249 977897573 /nfs/dbraw/zinc/89/75/73/977897573.db2.gz DSNGGENZPMZNHT-VIFPVBQESA-N 1 2 220.320 2.143 20 0 BEADLO C[C@H](Nc1cc(N(C)C)[nH+]cn1)C1(C)CC1 ZINC001336739249 977897574 /nfs/dbraw/zinc/89/75/74/977897574.db2.gz DSNGGENZPMZNHT-VIFPVBQESA-N 1 2 220.320 2.143 20 0 BEADLO C[N@H+](Cc1nc(Cl)ccc1F)C1CC1 ZINC001232155072 977898036 /nfs/dbraw/zinc/89/80/36/977898036.db2.gz CQESWHBXPKQBSE-UHFFFAOYSA-N 1 2 214.671 2.468 20 0 BEADLO C[N@@H+](Cc1nc(Cl)ccc1F)C1CC1 ZINC001232155072 977898037 /nfs/dbraw/zinc/89/80/37/977898037.db2.gz CQESWHBXPKQBSE-UHFFFAOYSA-N 1 2 214.671 2.468 20 0 BEADLO Cc1cnc(C[NH+](C)C)c(Br)c1 ZINC001232173756 977905050 /nfs/dbraw/zinc/90/50/50/977905050.db2.gz MSHZIEVXMOOOAR-UHFFFAOYSA-N 1 2 229.121 2.214 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1ccns1 ZINC001232188815 977907275 /nfs/dbraw/zinc/90/72/75/977907275.db2.gz NBGURKAUPZNFQD-SFYZADRCSA-N 1 2 200.282 2.075 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1ccns1 ZINC001232188815 977907289 /nfs/dbraw/zinc/90/72/89/977907289.db2.gz NBGURKAUPZNFQD-SFYZADRCSA-N 1 2 200.282 2.075 20 0 BEADLO Cc1[nH+]c2ccc(N)cc2n1C1=CCOCC1 ZINC001176142389 977925477 /nfs/dbraw/zinc/92/54/77/977925477.db2.gz FETPUAZQJKPSNT-UHFFFAOYSA-N 1 2 229.283 2.188 20 0 BEADLO CCN(C)c1ccc(NC2=CCOCC2)c[nH+]1 ZINC001176143588 977925927 /nfs/dbraw/zinc/92/59/27/977925927.db2.gz BHNWSVMNGDCCKF-UHFFFAOYSA-N 1 2 233.315 2.254 20 0 BEADLO COc1cc[nH+]cc1Nc1cnsc1 ZINC001176118462 977946083 /nfs/dbraw/zinc/94/60/83/977946083.db2.gz HWLFMFFYWGFLHK-UHFFFAOYSA-N 1 2 207.258 2.290 20 0 BEADLO COc1cc[nH+]cc1Nc1cnn2ccccc12 ZINC001176119114 977951458 /nfs/dbraw/zinc/95/14/58/977951458.db2.gz OQOVSUWDYCVSFV-UHFFFAOYSA-N 1 2 240.266 2.482 20 0 BEADLO COc1cc[nH+]cc1Nc1c(F)cccc1CO ZINC001176124129 977955806 /nfs/dbraw/zinc/95/58/06/977955806.db2.gz NYQKMWMMHSTMPK-UHFFFAOYSA-N 1 2 248.257 2.465 20 0 BEADLO COc1cc[nH+]cc1N1CCc2cccc(N)c21 ZINC001176125144 977963402 /nfs/dbraw/zinc/96/34/02/977963402.db2.gz XFQYYAUXDGZUEA-UHFFFAOYSA-N 1 2 241.294 2.367 20 0 BEADLO COc1cc(Nc2ccc(=O)[nH]c2)cc(C)[nH+]1 ZINC001176127414 977966007 /nfs/dbraw/zinc/96/60/07/977966007.db2.gz IZIDCKOGLFCDLZ-UHFFFAOYSA-N 1 2 231.255 2.243 20 0 BEADLO c1ccc2c(c1)ccnc2C[N@@H+]1CCO[C@@H]2C[C@@H]21 ZINC001232249213 977976778 /nfs/dbraw/zinc/97/67/78/977976778.db2.gz JEWHFMOAISVTTR-LSDHHAIUSA-N 1 2 240.306 2.208 20 0 BEADLO c1ccc2c(c1)ccnc2C[N@H+]1CCO[C@@H]2C[C@@H]21 ZINC001232249213 977976789 /nfs/dbraw/zinc/97/67/89/977976789.db2.gz JEWHFMOAISVTTR-LSDHHAIUSA-N 1 2 240.306 2.208 20 0 BEADLO CCOc1ccc(C[N@@H+]2CC[C@H](F)C2)c(C)n1 ZINC001232307994 978000993 /nfs/dbraw/zinc/00/09/93/978000993.db2.gz LNGCJPSVWUICKB-LBPRGKRZSA-N 1 2 238.306 2.333 20 0 BEADLO CCOc1ccc(C[N@H+]2CC[C@H](F)C2)c(C)n1 ZINC001232307994 978001003 /nfs/dbraw/zinc/00/10/03/978001003.db2.gz LNGCJPSVWUICKB-LBPRGKRZSA-N 1 2 238.306 2.333 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)Nc1cc(Cl)ccn1 ZINC001336968815 978088376 /nfs/dbraw/zinc/08/83/76/978088376.db2.gz DTIIHVQCDBKQDT-SECBINFHSA-N 1 2 236.706 2.432 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@H](C(F)F)C2)c[nH]1 ZINC001232464344 978109140 /nfs/dbraw/zinc/10/91/40/978109140.db2.gz YYPTVHWINWIGKU-VIFPVBQESA-N 1 2 229.274 2.195 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@H](C(F)F)C2)c[nH]1 ZINC001232464344 978109150 /nfs/dbraw/zinc/10/91/50/978109150.db2.gz YYPTVHWINWIGKU-VIFPVBQESA-N 1 2 229.274 2.195 20 0 BEADLO Cc1ncc(C[N@@H+]2CCC[C@H](C(F)F)C2)[nH]1 ZINC001232464344 978109159 /nfs/dbraw/zinc/10/91/59/978109159.db2.gz YYPTVHWINWIGKU-VIFPVBQESA-N 1 2 229.274 2.195 20 0 BEADLO Cc1ncc(C[N@H+]2CCC[C@H](C(F)F)C2)[nH]1 ZINC001232464344 978109171 /nfs/dbraw/zinc/10/91/71/978109171.db2.gz YYPTVHWINWIGKU-VIFPVBQESA-N 1 2 229.274 2.195 20 0 BEADLO Cc1nc(N2CC(F)(F)C2)c2c([nH+]1)CCCC2 ZINC001336991501 978113858 /nfs/dbraw/zinc/11/38/58/978113858.db2.gz NBWOLOOMVURJHF-UHFFFAOYSA-N 1 2 239.269 2.119 20 0 BEADLO CCc1csc(C[N@@H+]2CC[C@@]23CCOC3)n1 ZINC001232477763 978130023 /nfs/dbraw/zinc/13/00/23/978130023.db2.gz PINNTAKIQDOKLC-LBPRGKRZSA-N 1 2 238.356 2.070 20 0 BEADLO CCc1csc(C[N@H+]2CC[C@@]23CCOC3)n1 ZINC001232477763 978130029 /nfs/dbraw/zinc/13/00/29/978130029.db2.gz PINNTAKIQDOKLC-LBPRGKRZSA-N 1 2 238.356 2.070 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cccc(CF)n2)C[C@H](C)O1 ZINC001232531474 978161468 /nfs/dbraw/zinc/16/14/68/978161468.db2.gz BKERJDAQFTVSSK-PHIMTYICSA-N 1 2 238.306 2.160 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cccc(CF)n2)C[C@H](C)O1 ZINC001232531474 978161474 /nfs/dbraw/zinc/16/14/74/978161474.db2.gz BKERJDAQFTVSSK-PHIMTYICSA-N 1 2 238.306 2.160 20 0 BEADLO COc1cccc(C)c1C[N@@H+]1CCC(=O)[C@H](C)C1 ZINC001232619608 978196704 /nfs/dbraw/zinc/19/67/04/978196704.db2.gz FHLCRFMGEAPYAP-GFCCVEGCSA-N 1 2 247.338 2.415 20 0 BEADLO COc1cccc(C)c1C[N@H+]1CCC(=O)[C@H](C)C1 ZINC001232619608 978196708 /nfs/dbraw/zinc/19/67/08/978196708.db2.gz FHLCRFMGEAPYAP-GFCCVEGCSA-N 1 2 247.338 2.415 20 0 BEADLO CC(C)(CNC(=O)CCn1cc[nH+]c1)CC1CC1 ZINC001176884246 978227181 /nfs/dbraw/zinc/22/71/81/978227181.db2.gz YNCXZFYQFFBEQZ-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1cc(F)cc(N2C[C@@H](O)CC(C)(C)C2)[nH+]1 ZINC001337239641 978240535 /nfs/dbraw/zinc/24/05/35/978240535.db2.gz NRGXMNJWSRMUOK-NSHDSACASA-N 1 2 238.306 2.126 20 0 BEADLO CCc1ccc(N2CC[C@H](CF)C2)[nH+]c1 ZINC001337254706 978251099 /nfs/dbraw/zinc/25/10/99/978251099.db2.gz ZBJOHEHGGVKNBW-LLVKDONJSA-N 1 2 208.280 2.440 20 0 BEADLO Cc1cc(C[NH2+]Cc2cc(C(C)C)no2)[nH]n1 ZINC001337264902 978252810 /nfs/dbraw/zinc/25/28/10/978252810.db2.gz UPFJAQBZLYMUIY-UHFFFAOYSA-N 1 2 234.303 2.119 20 0 BEADLO c1nc2ccc(C[N@@H+]3C[C@@H]4C[C@H]3CO4)cc2s1 ZINC001232741454 978255026 /nfs/dbraw/zinc/25/50/26/978255026.db2.gz LSMOIDRNPZXTDN-QWRGUYRKSA-N 1 2 246.335 2.269 20 0 BEADLO c1nc2ccc(C[N@H+]3C[C@@H]4C[C@H]3CO4)cc2s1 ZINC001232741454 978255036 /nfs/dbraw/zinc/25/50/36/978255036.db2.gz LSMOIDRNPZXTDN-QWRGUYRKSA-N 1 2 246.335 2.269 20 0 BEADLO Cc1cc(C)c2c(c1)CC[N@@H+](Cc1cnon1)C2 ZINC001177033700 978266951 /nfs/dbraw/zinc/26/69/51/978266951.db2.gz PXKPVXHGDOJUIT-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1cc(C)c2c(c1)CC[N@H+](Cc1cnon1)C2 ZINC001177033700 978266960 /nfs/dbraw/zinc/26/69/60/978266960.db2.gz PXKPVXHGDOJUIT-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H](C)C(C)(C)C)c[nH+]1 ZINC001597251223 978300253 /nfs/dbraw/zinc/30/02/53/978300253.db2.gz RJSFUPMRFXZMMG-SECBINFHSA-N 1 2 237.347 2.271 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H](C)C(C)(C)C)[nH+]1 ZINC001597251223 978300264 /nfs/dbraw/zinc/30/02/64/978300264.db2.gz RJSFUPMRFXZMMG-SECBINFHSA-N 1 2 237.347 2.271 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@H](C)C(C)(C)C)c[nH+]1 ZINC001597251225 978302555 /nfs/dbraw/zinc/30/25/55/978302555.db2.gz RJSFUPMRFXZMMG-VIFPVBQESA-N 1 2 237.347 2.271 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@H](C)C(C)(C)C)[nH+]1 ZINC001597251225 978302569 /nfs/dbraw/zinc/30/25/69/978302569.db2.gz RJSFUPMRFXZMMG-VIFPVBQESA-N 1 2 237.347 2.271 20 0 BEADLO O[C@@H]1CC[N@H+](Cc2ccc(F)c(F)c2Cl)C1 ZINC001232874203 978316788 /nfs/dbraw/zinc/31/67/88/978316788.db2.gz PKCALDPBIWGFFU-MRVPVSSYSA-N 1 2 247.672 2.185 20 0 BEADLO O[C@@H]1CC[N@@H+](Cc2ccc(F)c(F)c2Cl)C1 ZINC001232874203 978316797 /nfs/dbraw/zinc/31/67/97/978316797.db2.gz PKCALDPBIWGFFU-MRVPVSSYSA-N 1 2 247.672 2.185 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC[C@H]1CCC[C@H](C)C1 ZINC001597575091 978341770 /nfs/dbraw/zinc/34/17/70/978341770.db2.gz QBARJWPQZUCEAN-JQWIXIFHSA-N 1 2 249.358 2.203 20 0 BEADLO COC1(C)C[NH+](Cc2ccc3ncoc3c2)C1 ZINC001232937607 978348457 /nfs/dbraw/zinc/34/84/57/978348457.db2.gz DZWYAPWZYHSPON-UHFFFAOYSA-N 1 2 232.283 2.049 20 0 BEADLO CCC(CC)CNC(=O)CN(C)c1cccc[nH+]1 ZINC001177408468 978350239 /nfs/dbraw/zinc/35/02/39/978350239.db2.gz IMCSQUVGYFSHEX-UHFFFAOYSA-N 1 2 249.358 2.070 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H](C)c1ccco1 ZINC001337510854 978379498 /nfs/dbraw/zinc/37/94/98/978379498.db2.gz XBGOIWTUWNMHTH-LLVKDONJSA-N 1 2 244.294 2.456 20 0 BEADLO Cc1ncc(F)cc1C[NH+]1CC2(CSC2)C1 ZINC001232991549 978395269 /nfs/dbraw/zinc/39/52/69/978395269.db2.gz DDYHZUVETORIDW-UHFFFAOYSA-N 1 2 238.331 2.078 20 0 BEADLO Cc1cc(C)c(C[N@@H+]2C[C@H]3CC[C@@H]2CO3)cn1 ZINC001233008551 978399128 /nfs/dbraw/zinc/39/91/28/978399128.db2.gz DDYQXUVDXRJSKI-ZIAGYGMSSA-N 1 2 232.327 2.062 20 0 BEADLO Cc1cc(C)c(C[N@H+]2C[C@H]3CC[C@@H]2CO3)cn1 ZINC001233008551 978399138 /nfs/dbraw/zinc/39/91/38/978399138.db2.gz DDYQXUVDXRJSKI-ZIAGYGMSSA-N 1 2 232.327 2.062 20 0 BEADLO Cc1ccc(O)c(Nc2ccccc2N)[nH+]1 ZINC001206309454 978419077 /nfs/dbraw/zinc/41/90/77/978419077.db2.gz ZSSWRBQZAKPBMI-UHFFFAOYSA-N 1 2 215.256 2.421 20 0 BEADLO O[C@@H]1C[N@@H+](Cc2ccsc2Cl)CC[C@@H]1F ZINC001233053392 978446237 /nfs/dbraw/zinc/44/62/37/978446237.db2.gz ILRFLOJGJKBHOU-DTWKUNHWSA-N 1 2 249.738 2.306 20 0 BEADLO O[C@@H]1C[N@H+](Cc2ccsc2Cl)CC[C@@H]1F ZINC001233053392 978446228 /nfs/dbraw/zinc/44/62/28/978446228.db2.gz ILRFLOJGJKBHOU-DTWKUNHWSA-N 1 2 249.738 2.306 20 0 BEADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1nc2ccccn2n1 ZINC001233068494 978451950 /nfs/dbraw/zinc/45/19/50/978451950.db2.gz WTHNUPRTRPGDIS-TXEJJXNPSA-N 1 2 244.342 2.492 20 0 BEADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1nc2ccccn2n1 ZINC001233068494 978451963 /nfs/dbraw/zinc/45/19/63/978451963.db2.gz WTHNUPRTRPGDIS-TXEJJXNPSA-N 1 2 244.342 2.492 20 0 BEADLO c1ccn2nc(C[N@@H+](CC3CC3)C3CC3)nc2c1 ZINC001233073987 978458969 /nfs/dbraw/zinc/45/89/69/978458969.db2.gz JOORZOAPIQEAJZ-UHFFFAOYSA-N 1 2 242.326 2.104 20 0 BEADLO c1ccn2nc(C[N@H+](CC3CC3)C3CC3)nc2c1 ZINC001233073987 978458970 /nfs/dbraw/zinc/45/89/70/978458970.db2.gz JOORZOAPIQEAJZ-UHFFFAOYSA-N 1 2 242.326 2.104 20 0 BEADLO CC[C@@H]1CCCC[N@@H+]1Cc1nc2ccccn2n1 ZINC001233072982 978460572 /nfs/dbraw/zinc/46/05/72/978460572.db2.gz MBDQEQVJXAGMED-GFCCVEGCSA-N 1 2 244.342 2.494 20 0 BEADLO CC[C@@H]1CCCC[N@H+]1Cc1nc2ccccn2n1 ZINC001233072982 978460579 /nfs/dbraw/zinc/46/05/79/978460579.db2.gz MBDQEQVJXAGMED-GFCCVEGCSA-N 1 2 244.342 2.494 20 0 BEADLO C[C@H](C(=O)N1[C@H](C)CCC[C@@H]1C)n1cc[nH+]c1 ZINC001177922395 978472190 /nfs/dbraw/zinc/47/21/90/978472190.db2.gz ULAXRTAKVIFVGI-GRYCIOLGSA-N 1 2 235.331 2.234 20 0 BEADLO CCCC1CCN(C(=O)[C@@H](C)n2cc[nH+]c2)CC1 ZINC001177921909 978474432 /nfs/dbraw/zinc/47/44/32/978474432.db2.gz JTWWJYOGJKNWKY-GFCCVEGCSA-N 1 2 249.358 2.483 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N1C(=O)CCc1[nH]cc[nH+]1 ZINC001177989999 978494125 /nfs/dbraw/zinc/49/41/25/978494125.db2.gz FSQZJQIMQBIDMA-GHMZBOCLSA-N 1 2 235.331 2.132 20 0 BEADLO Cc1ccc(C[N@H+](C2CC2)C2COC2)cc1O ZINC001233234286 978505731 /nfs/dbraw/zinc/50/57/31/978505731.db2.gz QUHDRZMNZDXWRF-UHFFFAOYSA-N 1 2 233.311 2.064 20 0 BEADLO Cc1ccc(C[N@@H+](C2CC2)C2COC2)cc1O ZINC001233234286 978505738 /nfs/dbraw/zinc/50/57/38/978505738.db2.gz QUHDRZMNZDXWRF-UHFFFAOYSA-N 1 2 233.311 2.064 20 0 BEADLO Cc1ccc2c(c1)[C@H](Nc1cc(N)nc[nH+]1)CC2 ZINC001337851749 978527152 /nfs/dbraw/zinc/52/71/52/978527152.db2.gz QQBYJOPCOMQRAP-GFCCVEGCSA-N 1 2 240.310 2.467 20 0 BEADLO CC(=O)[C@H]1CCCC[N@@H+]1Cc1cc(C)ns1 ZINC001233312909 978539447 /nfs/dbraw/zinc/53/94/47/978539447.db2.gz SVSYCVGGKBQNMF-GFCCVEGCSA-N 1 2 238.356 2.395 20 0 BEADLO CC(=O)[C@H]1CCCC[N@H+]1Cc1cc(C)ns1 ZINC001233312909 978539468 /nfs/dbraw/zinc/53/94/68/978539468.db2.gz SVSYCVGGKBQNMF-GFCCVEGCSA-N 1 2 238.356 2.395 20 0 BEADLO Clc1ccc(C[NH+]2CC3(CSC3)C2)o1 ZINC001233317343 978546455 /nfs/dbraw/zinc/54/64/55/978546455.db2.gz JATKHPCPJCKTMK-UHFFFAOYSA-N 1 2 229.732 2.482 20 0 BEADLO CCOC(=O)CCN(C)c1ccc(CC)c[nH+]1 ZINC001337901749 978554164 /nfs/dbraw/zinc/55/41/64/978554164.db2.gz HIAOQDIPGPVZSO-UHFFFAOYSA-N 1 2 236.315 2.033 20 0 BEADLO Cc1cnsc1C[NH+]1CC(C(F)F)C1 ZINC001233322674 978562055 /nfs/dbraw/zinc/56/20/55/978562055.db2.gz PDLPHTXXPYOXJH-UHFFFAOYSA-N 1 2 218.272 2.148 20 0 BEADLO c1c2cccnc2sc1C[NH+]1CCOCC1 ZINC001233345059 978568680 /nfs/dbraw/zinc/56/86/80/978568680.db2.gz DPEXKEANNFXZTP-UHFFFAOYSA-N 1 2 234.324 2.129 20 0 BEADLO C[C@@H]1CCN(Cc2cccc(N)[nH+]2)CC1(F)F ZINC001233368939 978584633 /nfs/dbraw/zinc/58/46/33/978584633.db2.gz PARJCEAMPXXPBG-SECBINFHSA-N 1 2 241.285 2.141 20 0 BEADLO Clc1cccn2cc(C[N@@H+]3C[C@@H]4C[C@@H]4C3)nc12 ZINC001233420144 978598729 /nfs/dbraw/zinc/59/87/29/978598729.db2.gz AVOMQZMJPWCFHF-AOOOYVTPSA-N 1 2 247.729 2.439 20 0 BEADLO Clc1cccn2cc(C[N@H+]3C[C@@H]4C[C@@H]4C3)nc12 ZINC001233420144 978598735 /nfs/dbraw/zinc/59/87/35/978598735.db2.gz AVOMQZMJPWCFHF-AOOOYVTPSA-N 1 2 247.729 2.439 20 0 BEADLO CCc1ccc(N2C[C@@H](O)CC(C)(C)C2)[nH+]c1 ZINC001338063724 978602113 /nfs/dbraw/zinc/60/21/13/978602113.db2.gz LSIPKMBJHVHQIV-LBPRGKRZSA-N 1 2 234.343 2.241 20 0 BEADLO CCc1[nH]c(CNC(=O)C(C)=C2CCC2)c[nH+]1 ZINC001178669651 978603538 /nfs/dbraw/zinc/60/35/38/978603538.db2.gz LLNLNWCCHHFKQB-UHFFFAOYSA-N 1 2 233.315 2.089 20 0 BEADLO CCc1[nH]cc(CNC(=O)C(C)=C2CCC2)[nH+]1 ZINC001178669651 978603542 /nfs/dbraw/zinc/60/35/42/978603542.db2.gz LLNLNWCCHHFKQB-UHFFFAOYSA-N 1 2 233.315 2.089 20 0 BEADLO C=Cc1ccc(OC2C[NH+](CC)C2)c(OC)c1 ZINC001233568161 978626837 /nfs/dbraw/zinc/62/68/37/978626837.db2.gz PEGSYOFTGGBXOA-UHFFFAOYSA-N 1 2 233.311 2.421 20 0 BEADLO CC(C)n1nccc1C[NH2+][C@@H](C)c1ccn(C)n1 ZINC001178926837 978639765 /nfs/dbraw/zinc/63/97/65/978639765.db2.gz AHPSPUSPIVYTBZ-NSHDSACASA-N 1 2 247.346 2.048 20 0 BEADLO CC=C(C)C(=O)Nc1c(C)c[nH+]cc1C ZINC001338241965 978640096 /nfs/dbraw/zinc/64/00/96/978640096.db2.gz JKQHELOAKVFTKR-YVMONPNESA-N 1 2 204.273 2.025 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H]1CC[C@H](C)C1 ZINC001338243446 978641450 /nfs/dbraw/zinc/64/14/50/978641450.db2.gz OMSUDWAKPRIHJN-JOYOIKCWSA-N 1 2 232.327 2.495 20 0 BEADLO CC(C)(C)CC(=O)NCc1[nH]c2c([nH+]1)CCCC2 ZINC001178918108 978642341 /nfs/dbraw/zinc/64/23/41/978642341.db2.gz XQSRMTVQUYPNDB-UHFFFAOYSA-N 1 2 249.358 2.341 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2ccoc2)CCC1=O ZINC001204241538 978692394 /nfs/dbraw/zinc/69/23/94/978692394.db2.gz GGZUUBZXACNCIM-SNVBAGLBSA-N 1 2 207.273 2.081 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2ccoc2)CCC1=O ZINC001204241538 978692398 /nfs/dbraw/zinc/69/23/98/978692398.db2.gz GGZUUBZXACNCIM-SNVBAGLBSA-N 1 2 207.273 2.081 20 0 BEADLO CC(C)[NH+]1CC(Oc2cccc(O)c2F)C1 ZINC001233868171 978717504 /nfs/dbraw/zinc/71/75/04/978717504.db2.gz OSGZZFGXMAUKIH-UHFFFAOYSA-N 1 2 225.263 2.003 20 0 BEADLO C[NH+]1CC(Oc2ncccc2-c2ccccc2)C1 ZINC001233975766 978746293 /nfs/dbraw/zinc/74/62/93/978746293.db2.gz HDNDZLLSGXPCTG-UHFFFAOYSA-N 1 2 240.306 2.441 20 0 BEADLO C[C@@H]1CN(c2cc(N)nc[nH+]2)Cc2ccccc21 ZINC001339431957 978851720 /nfs/dbraw/zinc/85/17/20/978851720.db2.gz VYQNGDVCZKIFSA-SNVBAGLBSA-N 1 2 240.310 2.183 20 0 BEADLO CCOC(=[NH2+])c1ccc(OC[C@@H](C)OC)cc1 ZINC001234588021 978865162 /nfs/dbraw/zinc/86/51/62/978865162.db2.gz ICMXJGWUALCSGW-SNVBAGLBSA-N 1 2 237.299 2.462 20 0 BEADLO CCc1ccc(N2C[C@H]3[C@@H](C2)C3(F)F)[nH+]c1 ZINC001339756803 978906020 /nfs/dbraw/zinc/90/60/20/978906020.db2.gz OUSKJHILSPJHEL-AOOOYVTPSA-N 1 2 224.254 2.345 20 0 BEADLO Cc1ccc(Nc2cn(C)cn2)c(C)[nH+]1 ZINC001203363598 978914715 /nfs/dbraw/zinc/91/47/15/978914715.db2.gz WFWRBUUGGIEENA-UHFFFAOYSA-N 1 2 202.261 2.176 20 0 BEADLO Nc1cc(N2CCC[C@H](C3CCC3)CC2)[nH+]cn1 ZINC001339793174 978915454 /nfs/dbraw/zinc/91/54/54/978915454.db2.gz KQCHSLBXBOPLFQ-LBPRGKRZSA-N 1 2 246.358 2.465 20 0 BEADLO CC(=O)c1cccc(NC(=O)[C@H](C)[NH+](C)C)c1C ZINC001180863438 978955563 /nfs/dbraw/zinc/95/55/63/978955563.db2.gz ZTEMFFWIRYKSCJ-JTQLQIEISA-N 1 2 248.326 2.086 20 0 BEADLO CCC[C@@H]1CCCN(C(=O)[C@@H](C)n2cc[nH+]c2)C1 ZINC001340272578 978999800 /nfs/dbraw/zinc/99/98/00/978999800.db2.gz FUEMCKLLCSIVJA-CHWSQXEVSA-N 1 2 249.358 2.483 20 0 BEADLO CCc1cccc(C[N@@H+]2CCCC(=O)[C@@H](C)C2)n1 ZINC001235249334 979006320 /nfs/dbraw/zinc/00/63/20/979006320.db2.gz BLOIMCXVZHFKSK-LBPRGKRZSA-N 1 2 246.354 2.445 20 0 BEADLO CCc1cccc(C[N@H+]2CCCC(=O)[C@@H](C)C2)n1 ZINC001235249334 979006323 /nfs/dbraw/zinc/00/63/23/979006323.db2.gz BLOIMCXVZHFKSK-LBPRGKRZSA-N 1 2 246.354 2.445 20 0 BEADLO CCc1cccc(C[N@@H+]2CC[C@H](F)C2)n1 ZINC001235256238 979010201 /nfs/dbraw/zinc/01/02/01/979010201.db2.gz YUUCWOMJYJWLFH-JTQLQIEISA-N 1 2 208.280 2.188 20 0 BEADLO CCc1cccc(C[N@H+]2CC[C@H](F)C2)n1 ZINC001235256238 979010206 /nfs/dbraw/zinc/01/02/06/979010206.db2.gz YUUCWOMJYJWLFH-JTQLQIEISA-N 1 2 208.280 2.188 20 0 BEADLO Clc1cnc(C[N@@H+]2C[C@H]3CC[C@@H]2C3)nc1 ZINC001235414220 979037788 /nfs/dbraw/zinc/03/77/88/979037788.db2.gz LXJQSICNKJXTCL-WCBMZHEXSA-N 1 2 223.707 2.114 20 0 BEADLO Clc1cnc(C[N@H+]2C[C@H]3CC[C@@H]2C3)nc1 ZINC001235414220 979037794 /nfs/dbraw/zinc/03/77/94/979037794.db2.gz LXJQSICNKJXTCL-WCBMZHEXSA-N 1 2 223.707 2.114 20 0 BEADLO Cc1cc[nH+]c(Nc2ccc3nncn3c2)c1 ZINC001250000741 979041823 /nfs/dbraw/zinc/04/18/23/979041823.db2.gz UZSIVUBAHCBGSS-UHFFFAOYSA-N 1 2 225.255 2.176 20 0 BEADLO Cc1cc(NC(=O)C(C)(C)C(F)(F)F)cc[nH+]1 ZINC001340594782 979043291 /nfs/dbraw/zinc/04/32/91/979043291.db2.gz LXBWWHQHCBIYER-UHFFFAOYSA-N 1 2 246.232 2.339 20 0 BEADLO Cc1ccnc(C[N@@H+](C)[C@H]2CCOC2)c1Cl ZINC001235586818 979096438 /nfs/dbraw/zinc/09/64/38/979096438.db2.gz WXJKZSOORXOLJJ-JTQLQIEISA-N 1 2 240.734 2.264 20 0 BEADLO Cc1ccnc(C[N@H+](C)[C@H]2CCOC2)c1Cl ZINC001235586818 979096447 /nfs/dbraw/zinc/09/64/47/979096447.db2.gz WXJKZSOORXOLJJ-JTQLQIEISA-N 1 2 240.734 2.264 20 0 BEADLO CC[C@H]1C[NH2+]CCN1Cc1ccc(S)cc1 ZINC001235773509 979150398 /nfs/dbraw/zinc/15/03/98/979150398.db2.gz NYCWBLUGMOLJEI-LBPRGKRZSA-N 1 2 236.384 2.159 20 0 BEADLO COCOc1ccc(F)cc1-c1ccc[nH+]c1N ZINC001236071032 979357669 /nfs/dbraw/zinc/35/76/69/979357669.db2.gz UIMRLWFIKONFCW-UHFFFAOYSA-N 1 2 248.257 2.453 20 0 BEADLO C[C@@H]1C[C@@H]1C[N@@H+]1CCNC[C@H]1c1ccc(F)cc1 ZINC001236126931 979400992 /nfs/dbraw/zinc/40/09/92/979400992.db2.gz FNNQDQDNGWVUCT-KYOSRNDESA-N 1 2 248.345 2.428 20 0 BEADLO C[C@@H]1C[C@@H]1C[N@H+]1CCNC[C@H]1c1ccc(F)cc1 ZINC001236126931 979401009 /nfs/dbraw/zinc/40/10/09/979401009.db2.gz FNNQDQDNGWVUCT-KYOSRNDESA-N 1 2 248.345 2.428 20 0 BEADLO Cn1cc(C[N@@H+]2CCO[C@H]3C[C@H]32)c2ccccc21 ZINC001204319616 979454707 /nfs/dbraw/zinc/45/47/07/979454707.db2.gz YCJXIFSLBBXHPF-CABCVRRESA-N 1 2 242.322 2.151 20 0 BEADLO Cn1cc(C[N@H+]2CCO[C@H]3C[C@H]32)c2ccccc21 ZINC001204319616 979454718 /nfs/dbraw/zinc/45/47/18/979454718.db2.gz YCJXIFSLBBXHPF-CABCVRRESA-N 1 2 242.322 2.151 20 0 BEADLO Cc1cc(C[NH+]2CCC(OCC3CC3)CC2)n[nH]1 ZINC001341569306 979473981 /nfs/dbraw/zinc/47/39/81/979473981.db2.gz NIFOAAPXPKDPPF-UHFFFAOYSA-N 1 2 249.358 2.109 20 0 BEADLO Nc1ccc(-c2ccc3c(c2)CCC(=O)O3)c[nH+]1 ZINC001236311393 979515753 /nfs/dbraw/zinc/51/57/53/979515753.db2.gz AGPOBFORPFHGAJ-UHFFFAOYSA-N 1 2 240.262 2.182 20 0 BEADLO Nc1ccc(-c2ccc3c(c2)NC(=O)CC3)c[nH+]1 ZINC001236311599 979517139 /nfs/dbraw/zinc/51/71/39/979517139.db2.gz CJVMPHSKYKMVJB-UHFFFAOYSA-N 1 2 239.278 2.216 20 0 BEADLO Nc1ccc(-c2ccc3c(c2)NCCO3)c[nH+]1 ZINC001236311646 979517305 /nfs/dbraw/zinc/51/73/05/979517305.db2.gz FOHROYVOAQHZKU-UHFFFAOYSA-N 1 2 227.267 2.135 20 0 BEADLO Cc1cc(-c2ccc(N)nc2)c2[nH+]ccn2c1 ZINC001236313748 979524248 /nfs/dbraw/zinc/52/42/48/979524248.db2.gz ZZZRCRMPKPGTQA-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO Nc1ccc(-c2ccc3[nH]c(=S)[nH]c3c2)c[nH+]1 ZINC001236316502 979528849 /nfs/dbraw/zinc/52/88/49/979528849.db2.gz NQNRUJZAWKYHHQ-UHFFFAOYSA-N 1 2 242.307 2.496 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cnn(Cc2ccccn2)c1 ZINC001236430459 979596284 /nfs/dbraw/zinc/59/62/84/979596284.db2.gz BZUFIQMIEOPSFV-WICBUYNWSA-N 1 2 240.310 2.202 20 0 BEADLO Cc1c(-c2cncc(O)c2)ccc2[nH+]ccn21 ZINC001236584902 979667942 /nfs/dbraw/zinc/66/79/42/979667942.db2.gz LDFUCWCCWCEJCQ-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO COC(=O)C[N@H+](C)Cc1cccc2occc21 ZINC001236740274 979724008 /nfs/dbraw/zinc/72/40/08/979724008.db2.gz UMXATMIFQYPNBT-UHFFFAOYSA-N 1 2 233.267 2.038 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1cccc2occc21 ZINC001236740274 979724017 /nfs/dbraw/zinc/72/40/17/979724017.db2.gz UMXATMIFQYPNBT-UHFFFAOYSA-N 1 2 233.267 2.038 20 0 BEADLO COC(=O)c1cc(F)cc(C[N@H+](C)CCF)c1 ZINC001236792056 979740881 /nfs/dbraw/zinc/74/08/81/979740881.db2.gz JAGQGHLMOKYTKJ-UHFFFAOYSA-N 1 2 243.253 2.014 20 0 BEADLO COC(=O)c1cc(F)cc(C[N@@H+](C)CCF)c1 ZINC001236792056 979740888 /nfs/dbraw/zinc/74/08/88/979740888.db2.gz JAGQGHLMOKYTKJ-UHFFFAOYSA-N 1 2 243.253 2.014 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@@H](C)c2ccccn2)[nH]n1 ZINC001342420490 979798036 /nfs/dbraw/zinc/79/80/36/979798036.db2.gz IVTKZUGQFZTKHP-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO Cc1cc(C[N@H+](C)[C@@H](C)c2ccccn2)[nH]n1 ZINC001342420490 979798044 /nfs/dbraw/zinc/79/80/44/979798044.db2.gz IVTKZUGQFZTKHP-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO Cc1[nH+]cc2n1CCN(CC1OC=CC1=S)C2 ZINC001237178585 979827286 /nfs/dbraw/zinc/82/72/86/979827286.db2.gz XYPNHENOZPSZTJ-UHFFFAOYSA-N 1 2 249.339 2.089 20 0 BEADLO Cc1cc(F)cc(C)c1C[NH+]1CCN(C#N)CC1 ZINC001237327244 979872376 /nfs/dbraw/zinc/87/23/76/979872376.db2.gz AGMLQGICSGYNNN-UHFFFAOYSA-N 1 2 247.317 2.041 20 0 BEADLO C[N@H+](Cc1cnccc1Br)C1CC1 ZINC001237383786 979881936 /nfs/dbraw/zinc/88/19/36/979881936.db2.gz FNVLBRNKRIAKLK-UHFFFAOYSA-N 1 2 241.132 2.438 20 0 BEADLO C[N@@H+](Cc1cnccc1Br)C1CC1 ZINC001237383786 979881942 /nfs/dbraw/zinc/88/19/42/979881942.db2.gz FNVLBRNKRIAKLK-UHFFFAOYSA-N 1 2 241.132 2.438 20 0 BEADLO CC1(C)C[NH+](Cc2cc3ccccn3n2)C1 ZINC001237440980 979893432 /nfs/dbraw/zinc/89/34/32/979893432.db2.gz IKVBURWWZDAUNA-UHFFFAOYSA-N 1 2 215.300 2.176 20 0 BEADLO COc1c(C)cccc1C[N@H+](C)CCF ZINC001237505788 979922123 /nfs/dbraw/zinc/92/21/23/979922123.db2.gz LUVIYYMEYQRURR-UHFFFAOYSA-N 1 2 211.280 2.405 20 0 BEADLO COc1c(C)cccc1C[N@@H+](C)CCF ZINC001237505788 979922129 /nfs/dbraw/zinc/92/21/29/979922129.db2.gz LUVIYYMEYQRURR-UHFFFAOYSA-N 1 2 211.280 2.405 20 0 BEADLO CCn1cncc1C[N@H+](C)Cc1ccc(C)nc1 ZINC001237592273 979950714 /nfs/dbraw/zinc/95/07/14/979950714.db2.gz DWXIWNKSMKWKAN-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1cncc1C[N@@H+](C)Cc1ccc(C)nc1 ZINC001237592273 979950726 /nfs/dbraw/zinc/95/07/26/979950726.db2.gz DWXIWNKSMKWKAN-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CC(C)C[N@H+](Cc1nnc[nH]1)Cc1ccccc1 ZINC001237602311 979960686 /nfs/dbraw/zinc/96/06/86/979960686.db2.gz SEDOOWIOCUBBGU-UHFFFAOYSA-N 1 2 244.342 2.463 20 0 BEADLO CC(C)C[N@@H+](Cc1nnc[nH]1)Cc1ccccc1 ZINC001237602311 979960691 /nfs/dbraw/zinc/96/06/91/979960691.db2.gz SEDOOWIOCUBBGU-UHFFFAOYSA-N 1 2 244.342 2.463 20 0 BEADLO CCc1[nH]ncc1C[N@@H+]1CCC(F)(F)[C@H](C)C1 ZINC001237652294 980014147 /nfs/dbraw/zinc/01/41/47/980014147.db2.gz QZNJJJWGTZUMAL-SECBINFHSA-N 1 2 243.301 2.449 20 0 BEADLO CCc1[nH]ncc1C[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC001237652294 980014159 /nfs/dbraw/zinc/01/41/59/980014159.db2.gz QZNJJJWGTZUMAL-SECBINFHSA-N 1 2 243.301 2.449 20 0 BEADLO COc1ccoc1C[N@H+](C)Cc1ccncc1 ZINC001237862838 980101813 /nfs/dbraw/zinc/10/18/13/980101813.db2.gz DWHPYVKCLFLHSP-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1ccoc1C[N@@H+](C)Cc1ccncc1 ZINC001237862838 980101823 /nfs/dbraw/zinc/10/18/23/980101823.db2.gz DWHPYVKCLFLHSP-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO Cc1sccc1C[NH+]1CCC(=O)CC1 ZINC001237964969 980117203 /nfs/dbraw/zinc/11/72/03/980117203.db2.gz RSYFUTPYWCVPKN-UHFFFAOYSA-N 1 2 209.314 2.221 20 0 BEADLO COCC[N@H+](C)Cc1cc(F)c(O)c(Cl)c1 ZINC001237991105 980123748 /nfs/dbraw/zinc/12/37/48/980123748.db2.gz VSYKJTCZZKMAAJ-UHFFFAOYSA-N 1 2 247.697 2.263 20 0 BEADLO COCC[N@@H+](C)Cc1cc(F)c(O)c(Cl)c1 ZINC001237991105 980123756 /nfs/dbraw/zinc/12/37/56/980123756.db2.gz VSYKJTCZZKMAAJ-UHFFFAOYSA-N 1 2 247.697 2.263 20 0 BEADLO Cc1ccc(O)cc1C[NH+]1CC2(C1)CCCCO2 ZINC001238095548 980146596 /nfs/dbraw/zinc/14/65/96/980146596.db2.gz PVROOHKCRKCSRQ-UHFFFAOYSA-N 1 2 247.338 2.456 20 0 BEADLO CC/C=C(\C)C(=O)OCCCc1c[nH+]cn1C ZINC001343725093 980221256 /nfs/dbraw/zinc/22/12/56/980221256.db2.gz MXFIMDLXYGCLOO-IZZDOVSWSA-N 1 2 236.315 2.252 20 0 BEADLO CC[C@@H](C)CCC(=O)NCCc1[nH]cc(C)[nH+]1 ZINC001185571604 980248611 /nfs/dbraw/zinc/24/86/11/980248611.db2.gz BUXXOAREYFYDRK-SNVBAGLBSA-N 1 2 237.347 2.203 20 0 BEADLO COc1cc(C[NH+]2CC3(CCC3)C2)cnc1F ZINC001238453242 980268211 /nfs/dbraw/zinc/26/82/11/980268211.db2.gz VYESCUFECYPHND-UHFFFAOYSA-N 1 2 236.290 2.215 20 0 BEADLO Cc1ccc(OC(C)C)cc1C[NH+]1CC(C)(O)C1 ZINC001238478176 980276199 /nfs/dbraw/zinc/27/61/99/980276199.db2.gz SSBKEYBQNAUDPZ-UHFFFAOYSA-N 1 2 249.354 2.349 20 0 BEADLO CC(C)Oc1cc(C[NH+]2CC=CC2)cnc1F ZINC001238605987 980295148 /nfs/dbraw/zinc/29/51/48/980295148.db2.gz KPUGKGPGKJAGOX-UHFFFAOYSA-N 1 2 236.290 2.380 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H]3C[C@H]2CO3)cnc1C1CC1 ZINC001238616589 980299781 /nfs/dbraw/zinc/29/97/81/980299781.db2.gz FEAZTIWBBRUXNN-KBPBESRZSA-N 1 2 244.338 2.241 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H]3C[C@H]2CO3)cnc1C1CC1 ZINC001238616589 980299795 /nfs/dbraw/zinc/29/97/95/980299795.db2.gz FEAZTIWBBRUXNN-KBPBESRZSA-N 1 2 244.338 2.241 20 0 BEADLO Cc1cc(C[N@@H+](C)C2(C)COC2)cnc1C1CC1 ZINC001238627745 980303391 /nfs/dbraw/zinc/30/33/91/980303391.db2.gz KJKPALHAZSSZIL-UHFFFAOYSA-N 1 2 246.354 2.488 20 0 BEADLO Cc1cc(C[N@H+](C)C2(C)COC2)cnc1C1CC1 ZINC001238627745 980303402 /nfs/dbraw/zinc/30/34/02/980303402.db2.gz KJKPALHAZSSZIL-UHFFFAOYSA-N 1 2 246.354 2.488 20 0 BEADLO Cc1cc(F)cc(Cl)c1C[NH+]1CC(CO)C1 ZINC001238785866 980326284 /nfs/dbraw/zinc/32/62/84/980326284.db2.gz VTIHTPXBNPZCFC-UHFFFAOYSA-N 1 2 243.709 2.212 20 0 BEADLO CC(C)(COC(=O)[C@@H]1CC1(C)C)n1cc[nH+]c1 ZINC001344110210 980350422 /nfs/dbraw/zinc/35/04/22/980350422.db2.gz NPZNFVVVZLBAKB-JTQLQIEISA-N 1 2 236.315 2.208 20 0 BEADLO Cc1cc(-c2cccc(CCO)c2)c[nH+]c1N ZINC001239028398 980415984 /nfs/dbraw/zinc/41/59/84/980415984.db2.gz BGCLSRXPLSXKFG-UHFFFAOYSA-N 1 2 228.295 2.174 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cnn(Cc2ccncc2)c1 ZINC001239049948 980425183 /nfs/dbraw/zinc/42/51/83/980425183.db2.gz XFLUILYEKIQVSU-NXADRHRGSA-N 1 2 240.310 2.202 20 0 BEADLO COC1(C)C[NH+](Cc2cccn2C2CC2)C1 ZINC001344568842 980433461 /nfs/dbraw/zinc/43/34/61/980433461.db2.gz PBYULUANMLZATE-UHFFFAOYSA-N 1 2 220.316 2.044 20 0 BEADLO Cc1cn2c(cccc2/C=C/C(C)(C)O)[nH+]1 ZINC001239151187 980466773 /nfs/dbraw/zinc/46/67/73/980466773.db2.gz MBWPFSAJXHSDMP-BQYQJAHWSA-N 1 2 216.284 2.427 20 0 BEADLO Cc1nn(C)cc1Nc1cc(C)c[nH+]c1C ZINC001203654318 980477398 /nfs/dbraw/zinc/47/73/98/980477398.db2.gz HBBUDXFAGLXXEW-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO CCn1c[nH+]cc1COC(=O)C1CC(C)(C)C1 ZINC001344970574 980509225 /nfs/dbraw/zinc/50/92/25/980509225.db2.gz BTJIGLWTEIZGRY-UHFFFAOYSA-N 1 2 236.315 2.382 20 0 BEADLO CCC[C@H](C)C(=O)OCc1c[nH+]cn1CC ZINC001344972419 980509443 /nfs/dbraw/zinc/50/94/43/980509443.db2.gz OLABKEWQRDZOAG-JTQLQIEISA-N 1 2 224.304 2.382 20 0 BEADLO CCn1c[nH+]cc1COC(=O)c1occc1C ZINC001345590299 980638072 /nfs/dbraw/zinc/63/80/72/980638072.db2.gz LVVGPFRTIJOLRP-UHFFFAOYSA-N 1 2 234.255 2.161 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)c1cc(F)c[nH]1 ZINC001188479474 980648771 /nfs/dbraw/zinc/64/87/71/980648771.db2.gz WJADDYRVVPECPD-UHFFFAOYSA-N 1 2 244.229 2.054 20 0 BEADLO Fc1ccc2[nH]ccc2c1CC[NH+]1CCOCC1 ZINC001250277844 980651676 /nfs/dbraw/zinc/65/16/76/980651676.db2.gz PPWKAWNGKJXNFX-UHFFFAOYSA-N 1 2 248.301 2.182 20 0 BEADLO Fc1ccc(C2=CCOC2)cc1-n1cc[nH+]c1 ZINC001239495697 980655120 /nfs/dbraw/zinc/65/51/20/980655120.db2.gz ZYXXBTQYIZKEMT-UHFFFAOYSA-N 1 2 230.242 2.425 20 0 BEADLO Cc1cc(NC(=O)N[C@@H](C)C2(C)CC2)c(C)c[nH+]1 ZINC001345842169 980696586 /nfs/dbraw/zinc/69/65/86/980696586.db2.gz FFTNGQKTFQFBEY-NSHDSACASA-N 1 2 247.342 2.430 20 0 BEADLO Cn1ncc2cc(CCn3cc[nH+]c3)ccc21 ZINC001250316721 980755417 /nfs/dbraw/zinc/75/54/17/980755417.db2.gz UQIGHSIUQWSQDF-UHFFFAOYSA-N 1 2 226.283 2.013 20 0 BEADLO c1cn(CCc2cnccc2C2CC2)c[nH+]1 ZINC001250318903 980755534 /nfs/dbraw/zinc/75/55/34/980755534.db2.gz LNSIBLFPEAINEH-UHFFFAOYSA-N 1 2 213.284 2.398 20 0 BEADLO COc1cc(F)c(F)cc1CCn1cc[nH+]c1 ZINC001250318909 980755538 /nfs/dbraw/zinc/75/55/38/980755538.db2.gz LSNQVJGIZLDYHI-UHFFFAOYSA-N 1 2 238.237 2.413 20 0 BEADLO COC(=O)c1ccc(CCn2cc[nH+]c2)cc1C ZINC001250319357 980757484 /nfs/dbraw/zinc/75/74/84/980757484.db2.gz QDEAVGLYQXXCFV-UHFFFAOYSA-N 1 2 244.294 2.221 20 0 BEADLO C[C@H](C(=O)N(C)[C@H](C)c1ccco1)n1cc[nH+]c1 ZINC000076901995 980805163 /nfs/dbraw/zinc/80/51/63/980805163.db2.gz GIDMUYBYBMOIQQ-GHMZBOCLSA-N 1 2 247.298 2.257 20 0 BEADLO C[C@H]1CCC[C@H](C)N1C(=O)CCc1[nH+]ccn1C ZINC001346411571 980830947 /nfs/dbraw/zinc/83/09/47/980830947.db2.gz UVCXNTSBWUJRSA-RYUDHWBXSA-N 1 2 249.358 2.142 20 0 BEADLO COC(C)(C)Cc1ccc(N(C)C)[nH+]c1 ZINC001250351102 980838312 /nfs/dbraw/zinc/83/83/12/980838312.db2.gz DIZPWLQPOHRUJJ-UHFFFAOYSA-N 1 2 208.305 2.115 20 0 BEADLO C[C@H]1CCN1C(=O)c1ccccc1-n1cc[nH+]c1 ZINC001190086225 980846859 /nfs/dbraw/zinc/84/68/59/980846859.db2.gz SDTQSJSPOBPAGG-NSHDSACASA-N 1 2 241.294 2.107 20 0 BEADLO CC[C@H](C)NC(=O)c1ccccc1-n1cc[nH+]c1 ZINC001190108196 980847324 /nfs/dbraw/zinc/84/73/24/980847324.db2.gz ZZMRNDKXTHGUNV-NSHDSACASA-N 1 2 243.310 2.401 20 0 BEADLO C[NH+](C)Cc1nnc([C@@H]2CCCC2(C)C)o1 ZINC001346662063 980877216 /nfs/dbraw/zinc/87/72/16/980877216.db2.gz JKHANOHBGCSWFH-VIFPVBQESA-N 1 2 223.320 2.425 20 0 BEADLO FC(F)Cc1ccccc1C[NH+]1CCOCC1 ZINC001250390430 980905405 /nfs/dbraw/zinc/90/54/05/980905405.db2.gz VKMYZCGUGLVGSD-UHFFFAOYSA-N 1 2 241.281 2.326 20 0 BEADLO [NH3+]Cc1cncc(-c2ccccc2S)c1 ZINC001239797338 980936419 /nfs/dbraw/zinc/93/64/19/980936419.db2.gz PEVRRXAXIIAKSE-UHFFFAOYSA-N 1 2 216.309 2.496 20 0 BEADLO Nc1ccc(-c2cccc3[nH+]ccn32)c(F)n1 ZINC001239823867 980970306 /nfs/dbraw/zinc/97/03/06/980970306.db2.gz ZYGDCKXTKIJMHB-UHFFFAOYSA-N 1 2 228.230 2.118 20 0 BEADLO COc1ncc(-c2ccc3[nH+]c(C)cn3c2)cn1 ZINC001239847090 980985612 /nfs/dbraw/zinc/98/56/12/980985612.db2.gz YARNYZFYTCWBAD-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO CCN(C)c1ccc(Nc2cnoc2)c[nH+]1 ZINC001203237081 981032784 /nfs/dbraw/zinc/03/27/84/981032784.db2.gz REJWOHHQTZEREY-UHFFFAOYSA-N 1 2 218.260 2.269 20 0 BEADLO COc1cncc(-c2c[nH+]c3c(c2)CCCN3)c1 ZINC001239932808 981044158 /nfs/dbraw/zinc/04/41/58/981044158.db2.gz VCPJCHAOKWOMNA-UHFFFAOYSA-N 1 2 241.294 2.153 20 0 BEADLO Cc1nc([C@@H](C)[NH2+][C@H](C)CSCCF)no1 ZINC001347393679 981067089 /nfs/dbraw/zinc/06/70/89/981067089.db2.gz BZZYQGOKVJQKGF-HTQZYQBOSA-N 1 2 247.339 2.120 20 0 BEADLO Cc1n[nH]c(C)c1-c1cccc2[nH+]ccn21 ZINC001240126107 981123996 /nfs/dbraw/zinc/12/39/96/981123996.db2.gz GSECFAKSJFRFJV-UHFFFAOYSA-N 1 2 212.256 2.341 20 0 BEADLO Cn1cc[nH+]c1CCC(=O)NCC1(C)CCCC1 ZINC001347625689 981131476 /nfs/dbraw/zinc/13/14/76/981131476.db2.gz CHTZXRHPAVQPOD-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO c1cn2cc(-c3ncnc4cnccc43)ccc2[nH+]1 ZINC001240214333 981160647 /nfs/dbraw/zinc/16/06/47/981160647.db2.gz OCPMZOZKZKPWLR-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO c1cn2cc(-c3ccc4nc[nH]c4n3)ccc2[nH+]1 ZINC001240214223 981161401 /nfs/dbraw/zinc/16/14/01/981161401.db2.gz LQFVBAJZJHPOJN-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO Cn1cnc2c1ccnc2-c1ccc2[nH+]ccn2c1 ZINC001240214210 981162104 /nfs/dbraw/zinc/16/21/04/981162104.db2.gz LKKADZUPVGFSAR-UHFFFAOYSA-N 1 2 249.277 2.283 20 0 BEADLO COc1cc(C)c(-c2ccc3[nH+]ccn3c2)nn1 ZINC001240215415 981164823 /nfs/dbraw/zinc/16/48/23/981164823.db2.gz WBZRQTCJRQWFNJ-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO c1cn2cc(-c3cccn4ncnc34)ccc2[nH+]1 ZINC001240217959 981167596 /nfs/dbraw/zinc/16/75/96/981167596.db2.gz TXYOVDASXAERJH-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO COc1ncnc(C)c1-c1ccc2[nH+]ccn2c1 ZINC001240219908 981168826 /nfs/dbraw/zinc/16/88/26/981168826.db2.gz ZRSINNIWKKPLQF-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO c1cn2cc(-c3cncc4nccnc43)ccc2[nH+]1 ZINC001240218508 981170630 /nfs/dbraw/zinc/17/06/30/981170630.db2.gz PETKCGPQMVJBSB-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO CCc1cccc(C(=O)N(CC)C2C[NH+](C)C2)c1 ZINC001192964518 981220885 /nfs/dbraw/zinc/22/08/85/981220885.db2.gz PQRGYRPYFAQNAW-UHFFFAOYSA-N 1 2 246.354 2.025 20 0 BEADLO COc1cc(-c2c[nH+]c3c(c2)CCCN3)ccn1 ZINC001240257942 981233535 /nfs/dbraw/zinc/23/35/35/981233535.db2.gz BJUMNBKSMGEPRB-UHFFFAOYSA-N 1 2 241.294 2.153 20 0 BEADLO CCc1ccc(N2C[C@H]3COC[C@@]3(C)C2)[nH+]c1 ZINC001348247546 981316882 /nfs/dbraw/zinc/31/68/82/981316882.db2.gz RTYXHJWWIHANQR-GXTWGEPZSA-N 1 2 232.327 2.117 20 0 BEADLO Cc1c(-c2cccc3[nH+]ccn32)cnn1C ZINC001240381395 981341170 /nfs/dbraw/zinc/34/11/70/981341170.db2.gz PJICLWAAZVSBGT-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO Nc1cc(-c2cnc3[nH]ccc3c2)cc[nH+]1 ZINC001240392059 981351355 /nfs/dbraw/zinc/35/13/55/981351355.db2.gz YKOIKNSHNGKQRI-UHFFFAOYSA-N 1 2 210.240 2.159 20 0 BEADLO CCCCC1(NC(=O)CCc2[nH+]ccn2C)CC1 ZINC001348534426 981384020 /nfs/dbraw/zinc/38/40/20/981384020.db2.gz AUYGXKMHTWEHNZ-UHFFFAOYSA-N 1 2 249.358 2.192 20 0 BEADLO COC(=O)/C(C)=C/Cn1c[nH+]c(C(C)(C)C)c1 ZINC001348537173 981387441 /nfs/dbraw/zinc/38/74/41/981387441.db2.gz IGBFIODYFLCVBU-UXBLZVDNSA-N 1 2 236.315 2.300 20 0 BEADLO Cc1nc(NC[C@H]2C[C@@H]2C2CCCC2)nc(N)[nH+]1 ZINC001348541955 981387507 /nfs/dbraw/zinc/38/75/07/981387507.db2.gz CUAVYCWCTJWHTM-GHMZBOCLSA-N 1 2 247.346 2.000 20 0 BEADLO Cc1nc(N)nc(NC[C@H]2C[C@@H]2C2CCCC2)[nH+]1 ZINC001348541955 981387512 /nfs/dbraw/zinc/38/75/12/981387512.db2.gz CUAVYCWCTJWHTM-GHMZBOCLSA-N 1 2 247.346 2.000 20 0 BEADLO CC(C)=CC(=O)N1CCC(Cc2c[nH]c[nH+]2)CC1 ZINC001348558163 981392485 /nfs/dbraw/zinc/39/24/85/981392485.db2.gz KBUOGUALBOIQHA-UHFFFAOYSA-N 1 2 247.342 2.157 20 0 BEADLO COc1cc(C)c(-c2ccn3cc[nH+]c3c2)nn1 ZINC001240496288 981417413 /nfs/dbraw/zinc/41/74/13/981417413.db2.gz AEZSTGRDMFSNKI-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO COc1ccnc(-c2ccn3cc[nH+]c3c2)c1 ZINC001240496542 981417673 /nfs/dbraw/zinc/41/76/73/981417673.db2.gz NHGZEENESOIDLD-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO Cc1cc(-c2ccn3cc[nH+]c3c2)nnc1C ZINC001240496505 981418634 /nfs/dbraw/zinc/41/86/34/981418634.db2.gz DYNSOFLQYFJXNK-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO c1cn2ccc(-c3c[nH]cc4ncnc3-4)cc2[nH+]1 ZINC001240509405 981433243 /nfs/dbraw/zinc/43/32/43/981433243.db2.gz YSROGNLOTNRWAC-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO Cn1nnc2cc(-c3ccn4cc[nH+]c4c3)ccc21 ZINC001240510666 981436914 /nfs/dbraw/zinc/43/69/14/981436914.db2.gz OYHFYPYADGOFDJ-UHFFFAOYSA-N 1 2 249.277 2.283 20 0 BEADLO CNc1cc(-c2ccn3cc[nH+]c3c2)ccn1 ZINC001240513482 981438325 /nfs/dbraw/zinc/43/83/25/981438325.db2.gz UOGJPWVXUSYSLJ-UHFFFAOYSA-N 1 2 224.267 2.438 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cnn(CC2CC2)c1 ZINC001240514990 981440814 /nfs/dbraw/zinc/44/08/14/981440814.db2.gz SXRBONGQEIDFBU-ZRSOPRJESA-N 1 2 203.289 2.169 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(N2CCCCC2)nc1 ZINC001240584552 981486958 /nfs/dbraw/zinc/48/69/58/981486958.db2.gz UXZYJLRDNIHBGN-UHFFFAOYSA-N 1 2 242.326 2.472 20 0 BEADLO Cc1cc([NH+](C)C)ccc1N[C@@H](C)[C@@H](C)O ZINC001348973496 981492236 /nfs/dbraw/zinc/49/22/36/981492236.db2.gz RXJAAXGANCRWKP-WDEREUQCSA-N 1 2 222.332 2.242 20 0 BEADLO Cc1cc(-c2cncc(C(C)(C)O)c2)c[nH+]c1N ZINC001240668137 981578710 /nfs/dbraw/zinc/57/87/10/981578710.db2.gz OAPBAVHMQZIZDP-UHFFFAOYSA-N 1 2 243.310 2.262 20 0 BEADLO CCn1nccc1-c1cc(-n2ccnc2)cc[nH+]1 ZINC001240694936 981603821 /nfs/dbraw/zinc/60/38/21/981603821.db2.gz RBPCPGYCMQHRME-UHFFFAOYSA-N 1 2 239.282 2.151 20 0 BEADLO c1ccc(N2CC[C@@H](CN3CCCC[NH2+]3)C2)cc1 ZINC001580895210 981722499 /nfs/dbraw/zinc/72/24/99/981722499.db2.gz GSPVQOPFXKZKCC-CQSZACIVSA-N 1 2 245.370 2.113 20 0 BEADLO CCCC1(c2nnc(C[NH+](C)C)o2)CCC1 ZINC001349947122 981823966 /nfs/dbraw/zinc/82/39/66/981823966.db2.gz JFQZRMARSUZMOS-UHFFFAOYSA-N 1 2 223.320 2.353 20 0 BEADLO Cn1ccc2cc(-c3ccc[nH+]c3N)cnc21 ZINC001240835679 981878348 /nfs/dbraw/zinc/87/83/48/981878348.db2.gz LDRHOBIVNDEKAT-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO Cc1cc(-c2cn3cc[nH+]c3cc2C)n(C)n1 ZINC001240858411 981898194 /nfs/dbraw/zinc/89/81/94/981898194.db2.gz LEPSOGABCMMKJT-UHFFFAOYSA-N 1 2 226.283 2.352 20 0 BEADLO Cc1cc(-c2ccc3[nH+]ccn3c2C)n(C)n1 ZINC001240861666 981902306 /nfs/dbraw/zinc/90/23/06/981902306.db2.gz VLRCRELDTRBIGX-UHFFFAOYSA-N 1 2 226.283 2.352 20 0 BEADLO CCn1c[nH+]cc1COC(=O)C[C@H](C)SC ZINC001350344122 981933470 /nfs/dbraw/zinc/93/34/70/981933470.db2.gz KDKYSXWFBAQZKZ-VIFPVBQESA-N 1 2 242.344 2.088 20 0 BEADLO CC1(C)C[C@@H]1CNC(=O)c1cccc2[nH+]ccn21 ZINC001585740295 981944599 /nfs/dbraw/zinc/94/45/99/981944599.db2.gz INFOPNPMMHABDO-SNVBAGLBSA-N 1 2 243.310 2.110 20 0 BEADLO Cc1cc(NC2CC2)nc(-c2ccc(O)cc2)[nH+]1 ZINC001241059343 982159142 /nfs/dbraw/zinc/15/91/42/982159142.db2.gz SMISKWQEYOLTRE-UHFFFAOYSA-N 1 2 241.294 2.154 20 0 BEADLO Nc1cn2ccc(-c3ccc(O)cc3)cc2[nH+]1 ZINC001241062642 982168196 /nfs/dbraw/zinc/16/81/96/982168196.db2.gz REBVSVVHPRNASC-UHFFFAOYSA-N 1 2 225.251 2.289 20 0 BEADLO Cc1cn2c(cccc2-c2ccc[nH]c2=O)[nH+]1 ZINC001241114347 982227419 /nfs/dbraw/zinc/22/74/19/982227419.db2.gz ZDTBZLPVZOFPHM-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO CCNC(=O)c1ccccc1-c1cc[nH+]c(N)c1 ZINC001241162857 982301996 /nfs/dbraw/zinc/30/19/96/982301996.db2.gz NPCDEZRGXRQQNX-UHFFFAOYSA-N 1 2 241.294 2.081 20 0 BEADLO COC(=O)c1ccc(-c2cc[nH+]c(N)c2)c(C)c1 ZINC001241163762 982305903 /nfs/dbraw/zinc/30/59/03/982305903.db2.gz ZOHTVVPTCGMZGF-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO C[C@H]1c2ccc(-c3cc[nH+]c(N)c3)cc2NC1=O ZINC001241164199 982307037 /nfs/dbraw/zinc/30/70/37/982307037.db2.gz YDOFPLLAOSLWEQ-QMMMGPOBSA-N 1 2 239.278 2.386 20 0 BEADLO Cc1ncc(F)cc1-c1cc[nH+]c(N)c1 ZINC001241169898 982309650 /nfs/dbraw/zinc/30/96/50/982309650.db2.gz QMNLSCVDPPBTJH-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO Nc1cc(-c2cccc3c2COC3)cc[nH+]1 ZINC001241169656 982310958 /nfs/dbraw/zinc/31/09/58/982310958.db2.gz JTMZZESCMUJKBT-UHFFFAOYSA-N 1 2 212.252 2.361 20 0 BEADLO Nc1ccc2cccc(-c3cc[nH+]c(N)c3)c2n1 ZINC001241169712 982313707 /nfs/dbraw/zinc/31/37/07/982313707.db2.gz MBTRYJSETOXZPW-UHFFFAOYSA-N 1 2 236.278 2.461 20 0 BEADLO Nc1cnc2cc(-c3cc[nH+]c(N)c3)ccc2c1 ZINC001241170266 982315306 /nfs/dbraw/zinc/31/53/06/982315306.db2.gz ZZDSHNPQGRAVRU-UHFFFAOYSA-N 1 2 236.278 2.461 20 0 BEADLO Cn1ccc2ncc(-c3cc[nH+]c(N)c3)cc21 ZINC001241170202 982315547 /nfs/dbraw/zinc/31/55/47/982315547.db2.gz XLGZBXFWEMTWSX-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO CCOc1ncc(-c2cc[nH+]c(N)c2)cc1C ZINC001241170677 982315780 /nfs/dbraw/zinc/31/57/80/982315780.db2.gz OYCHPJHDKKMMOE-UHFFFAOYSA-N 1 2 229.283 2.433 20 0 BEADLO Nc1cc(-c2ccn(C3CCC3)c(=O)c2)cc[nH+]1 ZINC001241170389 982318407 /nfs/dbraw/zinc/31/84/07/982318407.db2.gz LWCHISSPZRUEFM-UHFFFAOYSA-N 1 2 241.294 2.218 20 0 BEADLO Nc1cc(-c2cc(F)nc(F)c2)cc[nH+]1 ZINC001241171197 982323790 /nfs/dbraw/zinc/32/37/90/982323790.db2.gz XSYBYMRUMVEZKN-UHFFFAOYSA-N 1 2 207.183 2.004 20 0 BEADLO CC(C)SCSCC[NH+]1CCOCC1 ZINC001351650232 982348008 /nfs/dbraw/zinc/34/80/08/982348008.db2.gz FXGNPZDUQOIAGM-UHFFFAOYSA-N 1 2 235.418 2.151 20 0 BEADLO Cc1ncc(F)c(-c2c[nH+]c(N(C)C)cc2C)n1 ZINC001241228143 982377823 /nfs/dbraw/zinc/37/78/23/982377823.db2.gz HBCNZLDGEDHWFX-UHFFFAOYSA-N 1 2 246.289 2.361 20 0 BEADLO Cc1cc(-c2ccccc2[S@@](C)=O)c[nH+]c1N ZINC001241340864 982503185 /nfs/dbraw/zinc/50/31/85/982503185.db2.gz NYKUTRFDTJZPEQ-QGZVFWFLSA-N 1 2 246.335 2.377 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccccc1[S@](C)=O ZINC001241341132 982503648 /nfs/dbraw/zinc/50/36/48/982503648.db2.gz KRTRBSWTFSVFBN-ZDAGLYJCSA-N 1 2 221.325 2.300 20 0 BEADLO C[S@@](=O)c1ccccc1-c1cc[nH+]c(N)c1 ZINC001241342000 982503766 /nfs/dbraw/zinc/50/37/66/982503766.db2.gz QVWOLWWGJUZANU-MRXNPFEDSA-N 1 2 232.308 2.068 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(-n2cccn2)cc1 ZINC001241391258 982547689 /nfs/dbraw/zinc/54/76/89/982547689.db2.gz FIOWAHHDZJOWBW-UHFFFAOYSA-N 1 2 224.267 2.273 20 0 BEADLO C[N@H+](CCSC(C)(C)C)Cc1ncccn1 ZINC001197303262 982548785 /nfs/dbraw/zinc/54/87/85/982548785.db2.gz BSHAPYYKGAKGBV-UHFFFAOYSA-N 1 2 239.388 2.440 20 0 BEADLO C[N@@H+](CCSC(C)(C)C)Cc1ncccn1 ZINC001197303262 982548791 /nfs/dbraw/zinc/54/87/91/982548791.db2.gz BSHAPYYKGAKGBV-UHFFFAOYSA-N 1 2 239.388 2.440 20 0 BEADLO COc1ncc(-c2cc(N(C)C)cc[nH+]2)s1 ZINC001241410242 982558015 /nfs/dbraw/zinc/55/80/15/982558015.db2.gz DIOUUGKKOSEXIT-UHFFFAOYSA-N 1 2 235.312 2.280 20 0 BEADLO CN(C)c1cc[nH+]c(-c2cncs2)c1 ZINC001241495775 982648898 /nfs/dbraw/zinc/64/88/98/982648898.db2.gz WCSNPXXVKPAZGQ-UHFFFAOYSA-N 1 2 205.286 2.271 20 0 BEADLO CC[C@H](C)CNC(=S)Nc1cc[nH+]c(C)c1 ZINC001200242818 982738024 /nfs/dbraw/zinc/73/80/24/982738024.db2.gz UBJMQEWAPLSAJD-VIFPVBQESA-N 1 2 237.372 2.144 20 0 BEADLO Cc1cn2c(cccc2-c2cnc(C)nc2)[nH+]1 ZINC001205847029 982819434 /nfs/dbraw/zinc/81/94/34/982819434.db2.gz IVFACLUKGMDNAF-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO CCNC(=O)c1ccc(/C(C)=C/C=C/[NH3+])cc1 ZINC001241617183 982852639 /nfs/dbraw/zinc/85/26/39/982852639.db2.gz PVEDBJREOSJHGP-ZVSIBQGLSA-N 1 2 230.311 2.312 20 0 BEADLO CSc1ncc(-c2c[nH+]c(N)c(C)c2)cn1 ZINC001241629505 982866440 /nfs/dbraw/zinc/86/64/40/982866440.db2.gz AZDXDISPZSAQHC-UHFFFAOYSA-N 1 2 232.312 2.151 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NC12CCC(CC1)C2 ZINC000847716890 982870165 /nfs/dbraw/zinc/87/01/65/982870165.db2.gz RYUQKGNXLJGKNT-IFQILLTASA-N 1 2 247.342 2.037 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NC12CCC(CC1)C2 ZINC000847716890 982870167 /nfs/dbraw/zinc/87/01/67/982870167.db2.gz RYUQKGNXLJGKNT-IFQILLTASA-N 1 2 247.342 2.037 20 0 BEADLO CC(C)(C(=O)N1C[C@H]2CCCC[C@H]21)c1c[nH+]c[nH]1 ZINC001300328605 982879412 /nfs/dbraw/zinc/87/94/12/982879412.db2.gz VKUFHRQMKHDKBM-GHMZBOCLSA-N 1 2 247.342 2.088 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)C1=CC=CC1 ZINC001199691836 982980865 /nfs/dbraw/zinc/98/08/65/982980865.db2.gz HACDYTYEVIPXBO-UHFFFAOYSA-N 1 2 225.251 2.159 20 0 BEADLO CC(C)(C)NC(=S)Nc1ccn2cc[nH+]c2c1 ZINC001200899415 983117859 /nfs/dbraw/zinc/11/78/59/983117859.db2.gz QCNPBTWQYDOKAG-UHFFFAOYSA-N 1 2 248.355 2.419 20 0 BEADLO Cc1cnc(Nc2ccc(N)[nH+]c2)c(F)c1 ZINC001201279730 983156462 /nfs/dbraw/zinc/15/64/62/983156462.db2.gz ZBQOLVMIGQAEEJ-UHFFFAOYSA-N 1 2 218.235 2.250 20 0 BEADLO Cc1cc(Nc2ccc(N)[nH+]c2)ccc1O ZINC001201284192 983156516 /nfs/dbraw/zinc/15/65/16/983156516.db2.gz MNBOCRXRIOMDBC-UHFFFAOYSA-N 1 2 215.256 2.421 20 0 BEADLO Nc1ccc(Nc2ccc(O)c(F)c2)c[nH+]1 ZINC001201284340 983156644 /nfs/dbraw/zinc/15/66/44/983156644.db2.gz RBCUFYHUFRNNFA-UHFFFAOYSA-N 1 2 219.219 2.252 20 0 BEADLO Nc1ccc(Nc2cc3ccccn3n2)c[nH+]1 ZINC001201279701 983157111 /nfs/dbraw/zinc/15/71/11/983157111.db2.gz UBCZSFFRMAWVBL-UHFFFAOYSA-N 1 2 225.255 2.055 20 0 BEADLO Nc1ccc(Nc2cnn3ccccc23)c[nH+]1 ZINC001201279722 983157705 /nfs/dbraw/zinc/15/77/05/983157705.db2.gz UNWUTHXZRQOHFF-UHFFFAOYSA-N 1 2 225.255 2.055 20 0 BEADLO Cn1ncc2cc(Nc3ccc(N)[nH+]c3)ccc21 ZINC001201284665 983158009 /nfs/dbraw/zinc/15/80/09/983158009.db2.gz VKIZQWANPWMXOH-UHFFFAOYSA-N 1 2 239.282 2.294 20 0 BEADLO CC(=O)c1cc(Nc2ccc(N)[nH+]c2)ccc1O ZINC001201285178 983159759 /nfs/dbraw/zinc/15/97/59/983159759.db2.gz BUFWXIQIDGAJGH-UHFFFAOYSA-N 1 2 243.266 2.316 20 0 BEADLO COC[C@H]1CCN(c2cc(F)cc(C)[nH+]2)C1 ZINC001354110636 983160234 /nfs/dbraw/zinc/16/02/34/983160234.db2.gz ULYPGANPJJSVKI-JTQLQIEISA-N 1 2 224.279 2.002 20 0 BEADLO Nc1ccc(Nc2cccc3c2OCCO3)c[nH+]1 ZINC001201286796 983163339 /nfs/dbraw/zinc/16/33/39/983163339.db2.gz AMNKVYRFDQBLDY-UHFFFAOYSA-N 1 2 243.266 2.179 20 0 BEADLO Nc1ccc(Nc2cccc(F)c2CO)c[nH+]1 ZINC001201293064 983173190 /nfs/dbraw/zinc/17/31/90/983173190.db2.gz XEMHTJQCXVOQAN-UHFFFAOYSA-N 1 2 233.246 2.039 20 0 BEADLO Nc1ccc(Nc2ncc(F)cc2F)c[nH+]1 ZINC001201272051 983173591 /nfs/dbraw/zinc/17/35/91/983173591.db2.gz GQOKCLMWTKPGOE-UHFFFAOYSA-N 1 2 222.198 2.081 20 0 BEADLO Nc1ccc(Nc2cc(F)c(O)cc2F)c[nH+]1 ZINC001201293052 983174256 /nfs/dbraw/zinc/17/42/56/983174256.db2.gz WOOCMEYAZOLURX-UHFFFAOYSA-N 1 2 237.209 2.391 20 0 BEADLO CNc1ccnc(Cl)c1Nc1ccc(N)[nH+]c1 ZINC001201275658 983174783 /nfs/dbraw/zinc/17/47/83/983174783.db2.gz HZUYYXPNYDTCQM-UHFFFAOYSA-N 1 2 249.705 2.498 20 0 BEADLO CC(=O)N1CC=C(c2c(C)cc[nH+]c2C)CC1 ZINC001241968503 983175959 /nfs/dbraw/zinc/17/59/59/983175959.db2.gz JVEOLQHMGLVPJS-UHFFFAOYSA-N 1 2 230.311 2.334 20 0 BEADLO Nc1ccc(Nc2nc(Cl)ccc2N)c[nH+]1 ZINC001201276687 983175987 /nfs/dbraw/zinc/17/59/87/983175987.db2.gz ZOPPPJYVBISSQR-UHFFFAOYSA-N 1 2 235.678 2.038 20 0 BEADLO Cn1ccc2cc(Nc3ccc(N)[nH+]c3)cnc21 ZINC001201275938 983176974 /nfs/dbraw/zinc/17/69/74/983176974.db2.gz NIQFEGQIDBVKME-UHFFFAOYSA-N 1 2 239.282 2.294 20 0 BEADLO Cc1nc(Nc2ccc(N)[nH+]c2)cs1 ZINC001201278892 983179226 /nfs/dbraw/zinc/17/92/26/983179226.db2.gz IZKXLQQWUAJDLU-UHFFFAOYSA-N 1 2 206.274 2.172 20 0 BEADLO Cc1cc(-c2cc(C)c(=O)n(C)c2)cc(C)[nH+]1 ZINC001241996307 983191303 /nfs/dbraw/zinc/19/13/03/983191303.db2.gz XAQWIOHOXNGYFL-UHFFFAOYSA-N 1 2 228.295 2.373 20 0 BEADLO CCc1ccc(-c2[nH]cc[nH+]2)cc1C(=O)OC ZINC001242017143 983216923 /nfs/dbraw/zinc/21/69/23/983216923.db2.gz FIXBOUYXUFQXJE-UHFFFAOYSA-N 1 2 230.267 2.426 20 0 BEADLO c1c[nH+]c(-c2ccc3c(c2)C2(CC3)OCCO2)[nH]1 ZINC001242019670 983226593 /nfs/dbraw/zinc/22/65/93/983226593.db2.gz JLDRPUFQUHJKSO-UHFFFAOYSA-N 1 2 242.278 2.223 20 0 BEADLO CC(C)(C)C[N@@H+]1CCC[C@H](F)C(=O)C1 ZINC001201427266 983230226 /nfs/dbraw/zinc/23/02/26/983230226.db2.gz VVNDNILMYIUGSW-VIFPVBQESA-N 1 2 201.285 2.036 20 0 BEADLO CC(C)(C)C[N@H+]1CCC[C@H](F)C(=O)C1 ZINC001201427266 983230235 /nfs/dbraw/zinc/23/02/35/983230235.db2.gz VVNDNILMYIUGSW-VIFPVBQESA-N 1 2 201.285 2.036 20 0 BEADLO Cc1cc(F)cc(N2CCC(F)CC2)[nH+]1 ZINC001354256934 983230678 /nfs/dbraw/zinc/23/06/78/983230678.db2.gz OAMFAAAQUOAMLQ-UHFFFAOYSA-N 1 2 212.243 2.467 20 0 BEADLO CC(C)[NH2+]c1ccc(-n2cc(N)cn2)cc1 ZINC001201487433 983255374 /nfs/dbraw/zinc/25/53/74/983255374.db2.gz HWFSKSHCICIBOZ-UHFFFAOYSA-N 1 2 216.288 2.275 20 0 BEADLO Cc1cn2c(cccc2-c2ccnnc2)[nH+]1 ZINC001242051492 983257512 /nfs/dbraw/zinc/25/75/12/983257512.db2.gz JRQBNUFWLHEBDB-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO Cc1c(-c2ccnnc2)ccc2[nH+]ccn21 ZINC001242068359 983296001 /nfs/dbraw/zinc/29/60/01/983296001.db2.gz NQGMODATKUZIQB-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1ncccc1F ZINC001242071105 983304043 /nfs/dbraw/zinc/30/40/43/983304043.db2.gz UIISUSFXEZSIAI-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO CCOc1cc(C)nc(-c2c[nH+]c(N)cc2C)n1 ZINC001242070771 983306396 /nfs/dbraw/zinc/30/63/96/983306396.db2.gz LJFKZLWEPUXBGE-UHFFFAOYSA-N 1 2 244.298 2.136 20 0 BEADLO c1cc(C2=CCOCC2)cc(N2CCCC2)[nH+]1 ZINC001242074905 983314646 /nfs/dbraw/zinc/31/46/46/983314646.db2.gz LQTAOHRTUMZOBH-UHFFFAOYSA-N 1 2 230.311 2.486 20 0 BEADLO CCc1ccc2c(c1)C[N@H+]([C@@H](C)C(=O)OC)CC2 ZINC000082791772 983347613 /nfs/dbraw/zinc/34/76/13/983347613.db2.gz YKYHPPLKBLIFBP-NSHDSACASA-N 1 2 247.338 2.169 20 0 BEADLO CCc1ccc2c(c1)C[N@@H+]([C@@H](C)C(=O)OC)CC2 ZINC000082791772 983347619 /nfs/dbraw/zinc/34/76/19/983347619.db2.gz YKYHPPLKBLIFBP-NSHDSACASA-N 1 2 247.338 2.169 20 0 BEADLO Oc1cncc(Nc2ccn3cc[nH+]c3c2)c1 ZINC001201635362 983364291 /nfs/dbraw/zinc/36/42/91/983364291.db2.gz AYDHQVLLSCWHSA-UHFFFAOYSA-N 1 2 226.239 2.179 20 0 BEADLO COc1ccc(-c2nc3[nH]ccc3c[nH+]2)cc1O ZINC001242170952 983387583 /nfs/dbraw/zinc/38/75/83/983387583.db2.gz QTAPUMGLHHRCMH-UHFFFAOYSA-N 1 2 241.250 2.291 20 0 BEADLO COc1ccc(-c2ccc[nH+]c2N)cc1O ZINC001242174613 983391795 /nfs/dbraw/zinc/39/17/95/983391795.db2.gz VVAIVPTZXDEBJY-UHFFFAOYSA-N 1 2 216.240 2.045 20 0 BEADLO CCCCC[N@@H+]1CC(F)(F)C[C@]1(C)CO ZINC001201725628 983432324 /nfs/dbraw/zinc/43/23/24/983432324.db2.gz ROWPNTIVORZFLG-SNVBAGLBSA-N 1 2 221.291 2.269 20 0 BEADLO CCCCC[N@H+]1CC(F)(F)C[C@]1(C)CO ZINC001201725628 983432328 /nfs/dbraw/zinc/43/23/28/983432328.db2.gz ROWPNTIVORZFLG-SNVBAGLBSA-N 1 2 221.291 2.269 20 0 BEADLO CCCCC[N@@H+]1CCC[C@H](F)C(=O)C1 ZINC001201725887 983434467 /nfs/dbraw/zinc/43/44/67/983434467.db2.gz VNPFPUNVPWTPHD-JTQLQIEISA-N 1 2 201.285 2.180 20 0 BEADLO CCCCC[N@H+]1CCC[C@H](F)C(=O)C1 ZINC001201725887 983434469 /nfs/dbraw/zinc/43/44/69/983434469.db2.gz VNPFPUNVPWTPHD-JTQLQIEISA-N 1 2 201.285 2.180 20 0 BEADLO CCCC[C@H](O)CNc1cc([C@H](C)O)cc[nH+]1 ZINC001252083327 983446122 /nfs/dbraw/zinc/44/61/22/983446122.db2.gz NVISUYFMZDOETB-JQWIXIFHSA-N 1 2 238.331 2.098 20 0 BEADLO Cc1cc(C)c(NC(=O)[C@@H]2C[C@@H](C)CO2)c(C)[nH+]1 ZINC001355891384 983544938 /nfs/dbraw/zinc/54/49/38/983544938.db2.gz LGLYDQROJWTLQU-PELKAZGASA-N 1 2 248.326 2.370 20 0 BEADLO Cc1ccc(-c2nc3[nH]ccc3c[nH+]2)cc1CO ZINC001242382218 983671254 /nfs/dbraw/zinc/67/12/54/983671254.db2.gz QAXSPCXUCLLOIA-UHFFFAOYSA-N 1 2 239.278 2.377 20 0 BEADLO CC(=O)c1ccc(-c2cc[nH+]c3c2CCN3)cn1 ZINC001242402916 983686755 /nfs/dbraw/zinc/68/67/55/983686755.db2.gz KBVKNSNECPLZAL-UHFFFAOYSA-N 1 2 239.278 2.314 20 0 BEADLO Cn1ccc(-c2ccc(-c3c[nH+]cn3C)cc2)n1 ZINC001242459803 983774422 /nfs/dbraw/zinc/77/44/22/983774422.db2.gz KPSNDDSCRGMKLW-UHFFFAOYSA-N 1 2 238.294 2.488 20 0 BEADLO Cc1cc(-c2cnn(C(F)(F)F)c2)c[nH+]c1N ZINC001242464343 983791869 /nfs/dbraw/zinc/79/18/69/983791869.db2.gz JKDPCRUWVIONGS-UHFFFAOYSA-N 1 2 242.204 2.312 20 0 BEADLO Cn1ccnc1-c1ccc(-c2c[nH+]cn2C)cc1 ZINC001242493417 983815377 /nfs/dbraw/zinc/81/53/77/983815377.db2.gz AIEYMKDNSMVGQO-UHFFFAOYSA-N 1 2 238.294 2.488 20 0 BEADLO Cc1cn2c(cccc2-c2cncc(N)c2)[nH+]1 ZINC001242499357 983820477 /nfs/dbraw/zinc/82/04/77/983820477.db2.gz RLERMOBTAVMHLX-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO CC[C@@H](F)C(=O)NCc1c[nH+]c(C)cc1C ZINC001358285713 983848796 /nfs/dbraw/zinc/84/87/96/983848796.db2.gz GRQBRGWMDFBRFZ-LLVKDONJSA-N 1 2 224.279 2.063 20 0 BEADLO CC(C)n1nccc1-c1ccn2cc(N)[nH+]c2c1 ZINC001242556623 983879095 /nfs/dbraw/zinc/87/90/95/983879095.db2.gz QNZBGKRQJXWRPW-UHFFFAOYSA-N 1 2 241.298 2.361 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@H+]1Cc1cnn(C(C)C)c1 ZINC001137080755 983918014 /nfs/dbraw/zinc/91/80/14/983918014.db2.gz SABILOOOKCDNMN-AWEZNQCLSA-N 1 2 249.358 2.408 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1cnn(C(C)C)c1 ZINC001137080755 983918021 /nfs/dbraw/zinc/91/80/21/983918021.db2.gz SABILOOOKCDNMN-AWEZNQCLSA-N 1 2 249.358 2.408 20 0 BEADLO Cc1oncc1-c1cc(-n2cc[nH+]c2)ccn1 ZINC001242600715 983942128 /nfs/dbraw/zinc/94/21/28/983942128.db2.gz GGOKXZVCRPDILB-UHFFFAOYSA-N 1 2 226.239 2.231 20 0 BEADLO CC(=O)c1cc(-c2ccc(C)c(N)[nH+]2)ccn1 ZINC001242609352 983971739 /nfs/dbraw/zinc/97/17/39/983971739.db2.gz SXKGXWDGCSLXRZ-UHFFFAOYSA-N 1 2 227.267 2.237 20 0 BEADLO O=c1[nH]cc(-c2ccc3[nH+]ccn3c2)cc1F ZINC001242615664 983996377 /nfs/dbraw/zinc/99/63/77/983996377.db2.gz OVFIYKFBUGDYCA-UHFFFAOYSA-N 1 2 229.214 2.241 20 0 BEADLO O=c1cccc(Nc2cccc3[nH+]ccn32)[nH]1 ZINC001212786037 984011802 /nfs/dbraw/zinc/01/18/02/984011802.db2.gz AMWPKZQIFJNLJV-UHFFFAOYSA-N 1 2 226.239 2.179 20 0 BEADLO Cc1ccc(-c2cc(F)c(N)c(F)c2)[nH+]c1N ZINC001242837831 984185456 /nfs/dbraw/zinc/18/54/56/984185456.db2.gz UKTYLRZCDMTCPG-UHFFFAOYSA-N 1 2 235.237 2.500 20 0 BEADLO Nc1cc[nH+]cc1-c1cccc(S)c1 ZINC001242866928 984189189 /nfs/dbraw/zinc/18/91/89/984189189.db2.gz IQRZENBZMCEZKZ-UHFFFAOYSA-N 1 2 202.282 2.450 20 0 BEADLO Nc1cn2ccc(-c3c[nH]c4ncccc34)cc2[nH+]1 ZINC001242861455 984201903 /nfs/dbraw/zinc/20/19/03/984201903.db2.gz ZKPFUHAMXKFICC-UHFFFAOYSA-N 1 2 249.277 2.460 20 0 BEADLO Cc1ccncc1C(=O)Nc1c(C)c[nH+]cc1C ZINC001439227576 984384804 /nfs/dbraw/zinc/38/48/04/984384804.db2.gz XCAGLTKETXQMFE-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO CCN1CC2(CC[N@@H+]2CCCC(F)(F)F)C1 ZINC001275084693 984479730 /nfs/dbraw/zinc/47/97/30/984479730.db2.gz BITYBARZUPWGMK-UHFFFAOYSA-N 1 2 236.281 2.109 20 0 BEADLO CCN1CC2(CC[N@H+]2CCCC(F)(F)F)C1 ZINC001275084693 984479734 /nfs/dbraw/zinc/47/97/34/984479734.db2.gz BITYBARZUPWGMK-UHFFFAOYSA-N 1 2 236.281 2.109 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2c(c1)SCC(=O)N2 ZINC001243067370 984483565 /nfs/dbraw/zinc/48/35/65/984483565.db2.gz KKLBVKPJHJYFNX-UHFFFAOYSA-N 1 2 245.307 2.131 20 0 BEADLO CC(=O)Nc1ccc(-c2c[nH+]cn2C)c(C)c1 ZINC001243067584 984484760 /nfs/dbraw/zinc/48/47/60/984484760.db2.gz LVLJLIQQOFHPGJ-UHFFFAOYSA-N 1 2 229.283 2.354 20 0 BEADLO Cn1c[nH+]cc1-c1cc2[nH]cnc2c(F)c1 ZINC001243069739 984487672 /nfs/dbraw/zinc/48/76/72/984487672.db2.gz JZOHBIGMIUGRQZ-UHFFFAOYSA-N 1 2 216.219 2.103 20 0 BEADLO Cn1c[nH+]cc1-c1cccc(C2OCCO2)c1 ZINC001243069491 984487762 /nfs/dbraw/zinc/48/77/62/984487762.db2.gz SNMUMSKMURRRFV-UHFFFAOYSA-N 1 2 230.267 2.133 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2nsnc2c1 ZINC001243068502 984488445 /nfs/dbraw/zinc/48/84/45/984488445.db2.gz AUGLOXRKOMSPPR-UHFFFAOYSA-N 1 2 216.269 2.092 20 0 BEADLO COc1c(F)cc(-c2c[nH+]cn2C)cc1F ZINC001243068582 984488743 /nfs/dbraw/zinc/48/87/43/984488743.db2.gz FQWGXLMKGGXDBC-UHFFFAOYSA-N 1 2 224.210 2.374 20 0 BEADLO COc1cc(-c2c[nH+]cn2C)ccc1NC(C)=O ZINC001243068469 984489102 /nfs/dbraw/zinc/48/91/02/984489102.db2.gz ZBNWYYUMWRDVHL-UHFFFAOYSA-N 1 2 245.282 2.054 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2cnncc2c1 ZINC001243068507 984489539 /nfs/dbraw/zinc/48/95/39/984489539.db2.gz BDQLFMFKAAONAA-UHFFFAOYSA-N 1 2 210.240 2.030 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2c(c1)NC(=O)C21CC1 ZINC001243069871 984491644 /nfs/dbraw/zinc/49/16/44/984491644.db2.gz MYFGANRFXNNHLA-UHFFFAOYSA-N 1 2 239.278 2.071 20 0 BEADLO C[C@@H]1C(=O)Nc2cc(-c3c[nH+]cn3C)ccc21 ZINC001243069831 984495099 /nfs/dbraw/zinc/49/50/99/984495099.db2.gz ZAPSMVKPJBIWIH-QMMMGPOBSA-N 1 2 227.267 2.143 20 0 BEADLO COC(=[NH2+])c1cccc(-c2cncn2C)c1 ZINC001243071178 984500986 /nfs/dbraw/zinc/50/09/86/984500986.db2.gz OOOPBUNHLLVXRX-UHFFFAOYSA-N 1 2 215.256 2.059 20 0 BEADLO C=C/C=C\CC(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC001443386648 984523891 /nfs/dbraw/zinc/52/38/91/984523891.db2.gz ITFPCNIQAQZUPG-DHCBQETCSA-N 1 2 245.326 2.179 20 0 BEADLO COC(=O)c1cc(/C(C)=C/C=C/[NH3+])ccc1F ZINC001243286931 984814508 /nfs/dbraw/zinc/81/45/08/984814508.db2.gz UEMZWLBPMYPIMJ-DDEWIXKASA-N 1 2 235.258 2.488 20 0 BEADLO Cc1cc(-c2cnc(F)c(C)c2)c[nH+]c1N ZINC001243399473 984889446 /nfs/dbraw/zinc/88/94/46/984889446.db2.gz ZAXUJWXRJFLYPZ-UHFFFAOYSA-N 1 2 217.247 2.482 20 0 BEADLO Cc1cc(-c2ccc(CO)nc2)c2[nH+]ccn2c1 ZINC001243468507 985004701 /nfs/dbraw/zinc/00/47/01/985004701.db2.gz LZHASGYNABVNOX-UHFFFAOYSA-N 1 2 239.278 2.197 20 0 BEADLO Cc1nc(F)ccc1-c1ccc[nH+]c1N ZINC001243472324 985018700 /nfs/dbraw/zinc/01/87/00/985018700.db2.gz IFMREFHLXKCTPW-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO Nc1[nH+]cccc1-c1cccc2nsnc21 ZINC001243473944 985021366 /nfs/dbraw/zinc/02/13/66/985021366.db2.gz FZJOMDDPXKFKCC-UHFFFAOYSA-N 1 2 228.280 2.336 20 0 BEADLO Nc1[nH+]cccc1-c1ccc(-c2nc[nH]n2)cc1 ZINC001243473381 985021579 /nfs/dbraw/zinc/02/15/79/985021579.db2.gz AMEKDIPSHWMNQB-UHFFFAOYSA-N 1 2 237.266 2.116 20 0 BEADLO Nc1ccc2cccc(-c3ccc[nH+]c3N)c2n1 ZINC001243474094 985024738 /nfs/dbraw/zinc/02/47/38/985024738.db2.gz UFHGZWYYJUACFO-UHFFFAOYSA-N 1 2 236.278 2.461 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2c(c1)CCN2 ZINC001243473983 985025720 /nfs/dbraw/zinc/02/57/20/985025720.db2.gz GRVPUHSXPSWEQB-UHFFFAOYSA-N 1 2 211.268 2.299 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2nnccc2c1 ZINC001243474831 985029190 /nfs/dbraw/zinc/02/91/90/985029190.db2.gz ANFUCHLHMSLUFX-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO Nc1ccc(-c2ccc[nH+]c2N)cc1F ZINC001243475440 985029351 /nfs/dbraw/zinc/02/93/51/985029351.db2.gz IAQRMFDFKJAJSI-UHFFFAOYSA-N 1 2 203.220 2.052 20 0 BEADLO Nc1[nH+]cccc1-c1cccc2cncnc21 ZINC001243476113 985029671 /nfs/dbraw/zinc/02/96/71/985029671.db2.gz OOLYZQKAWQIJCY-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO Cc1cc(-c2cccnc2N)cn2cc[nH+]c12 ZINC001243475102 985031227 /nfs/dbraw/zinc/03/12/27/985031227.db2.gz DSOKQCFIUWUALY-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO Cc1nc2[nH]ccc2cc1-c1ccc[nH+]c1N ZINC001243475487 985031473 /nfs/dbraw/zinc/03/14/73/985031473.db2.gz JUKWQXDOXLUKQM-UHFFFAOYSA-N 1 2 224.267 2.467 20 0 BEADLO Cc1ccnc(F)c1-c1c[nH+]c(N)c(C)c1 ZINC001243553478 985112261 /nfs/dbraw/zinc/11/22/61/985112261.db2.gz JYHHNVSIQFNLLV-UHFFFAOYSA-N 1 2 217.247 2.482 20 0 BEADLO CCc1[nH]c(CNC(=O)CC(C)(C)CC)c[nH+]1 ZINC001456142394 985116003 /nfs/dbraw/zinc/11/60/03/985116003.db2.gz MQOROSRALQQVLD-UHFFFAOYSA-N 1 2 237.347 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)CC(C)(C)CC)[nH+]1 ZINC001456142394 985116009 /nfs/dbraw/zinc/11/60/09/985116009.db2.gz MQOROSRALQQVLD-UHFFFAOYSA-N 1 2 237.347 2.415 20 0 BEADLO CC/C(C)=C(/C)C(=O)NCc1c[nH+]c(CC)[nH]1 ZINC001456141478 985119150 /nfs/dbraw/zinc/11/91/50/985119150.db2.gz HZSZSGOGQGPHLE-KTKRTIGZSA-N 1 2 235.331 2.335 20 0 BEADLO CCC(C)=C(C)C(=O)NCc1c[nH]c(CC)[nH+]1 ZINC001456141478 985119161 /nfs/dbraw/zinc/11/91/61/985119161.db2.gz HZSZSGOGQGPHLE-KTKRTIGZSA-N 1 2 235.331 2.335 20 0 BEADLO CSC=CC(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001456344600 985135833 /nfs/dbraw/zinc/13/58/33/985135833.db2.gz LPNZORUWOGEPJS-SNAWJCMRSA-N 1 2 239.344 2.026 20 0 BEADLO CS/C=C/C(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001456344600 985135841 /nfs/dbraw/zinc/13/58/41/985135841.db2.gz LPNZORUWOGEPJS-SNAWJCMRSA-N 1 2 239.344 2.026 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)C[C@H]1CC=CCC1 ZINC001546081989 985137771 /nfs/dbraw/zinc/13/77/71/985137771.db2.gz BKLHOJXPJPAXKS-LBPRGKRZSA-N 1 2 247.342 2.075 20 0 BEADLO COC(=O)Cc1ccc(/C(C)=C/C=C/[NH3+])cc1 ZINC001243600463 985150519 /nfs/dbraw/zinc/15/05/19/985150519.db2.gz RACXHNFQTGVBQN-FSCUZGFYSA-N 1 2 231.295 2.278 20 0 BEADLO CN(C)c1cc(-c2cc(F)cc(CO)c2)cc[nH+]1 ZINC001243695326 985226121 /nfs/dbraw/zinc/22/61/21/985226121.db2.gz ANIFKLVNMVZHTE-UHFFFAOYSA-N 1 2 246.285 2.446 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cc(C)cc(CO)c1 ZINC001243698770 985232969 /nfs/dbraw/zinc/23/29/69/985232969.db2.gz SXSCNHXFCYMWCU-NIDLAPIMSA-N 1 2 203.285 2.363 20 0 BEADLO COc1nccc(SC)c1-c1cc(N)cc[nH+]1 ZINC001243700881 985237038 /nfs/dbraw/zinc/23/70/38/985237038.db2.gz LJGYIXPXKRWAJB-UHFFFAOYSA-N 1 2 247.323 2.456 20 0 BEADLO CO[C@H]1CC=C(c2ccn3cc(N)[nH+]c3c2)CC1 ZINC001243809841 985396632 /nfs/dbraw/zinc/39/66/32/985396632.db2.gz UDXGYBPINBUWNF-LBPRGKRZSA-N 1 2 243.310 2.499 20 0 BEADLO CO[C@@H]1CC=C(c2nc3[nH]ccc3c[nH+]2)CC1 ZINC001243810038 985399122 /nfs/dbraw/zinc/39/91/22/985399122.db2.gz UPAMRVCFMSUPQL-LLVKDONJSA-N 1 2 229.283 2.492 20 0 BEADLO CO[C@@H]1CC=C(c2ccc(N)[nH+]c2)CC1 ZINC001243813776 985402422 /nfs/dbraw/zinc/40/24/22/985402422.db2.gz JMFYRLLXJYDLGQ-LLVKDONJSA-N 1 2 204.273 2.246 20 0 BEADLO COCOc1cccc(-c2cc[nH+]c(N)c2)c1 ZINC001243823664 985428378 /nfs/dbraw/zinc/42/83/78/985428378.db2.gz GCVGOJRFJAUICU-UHFFFAOYSA-N 1 2 230.267 2.314 20 0 BEADLO C[C@H]1COC[C@@H]1Nc1ccc(N2CCCC2)[nH+]c1 ZINC000687997210 985451820 /nfs/dbraw/zinc/45/18/20/985451820.db2.gz PAFRQLYYKZJERW-AAEUAGOBSA-N 1 2 247.342 2.129 20 0 BEADLO CCOC(=O)C1([NH2+][C@H]2C[C@H](C)C[C@H](C)C2)CC1 ZINC001258152415 985473386 /nfs/dbraw/zinc/47/33/86/985473386.db2.gz WMJZLUGSNJFYJL-GDNZZTSVSA-N 1 2 239.359 2.496 20 0 BEADLO c1n[nH]c2c1[C@@H]([NH2+][C@@H]1COC3(CCC3)C1)CCC2 ZINC000688285211 985604660 /nfs/dbraw/zinc/60/46/60/985604660.db2.gz XBVPEHUUSFJHMH-JQWIXIFHSA-N 1 2 247.342 2.088 20 0 BEADLO c1ccc(N[C@H]2COC3(CCC3)C2)[nH+]c1 ZINC000688319581 985609262 /nfs/dbraw/zinc/60/92/62/985609262.db2.gz HMXWZRIOWILDCW-SNVBAGLBSA-N 1 2 204.273 2.205 20 0 BEADLO c1ccc(N[C@@H]2COC3(CCC3)C2)[nH+]c1 ZINC000688319579 985610327 /nfs/dbraw/zinc/61/03/27/985610327.db2.gz HMXWZRIOWILDCW-JTQLQIEISA-N 1 2 204.273 2.205 20 0 BEADLO CN1CCOc2cc(-c3cccc(N)[nH+]3)ccc21 ZINC001243938640 985613403 /nfs/dbraw/zinc/61/34/03/985613403.db2.gz MKIPBAWKTSGKJM-UHFFFAOYSA-N 1 2 241.294 2.159 20 0 BEADLO CC(C)(C)c1nccc(C2=C[NH2+]CCC2)n1 ZINC001243947365 985622919 /nfs/dbraw/zinc/62/29/19/985622919.db2.gz IPHSXZDXFHCMQE-UHFFFAOYSA-N 1 2 217.316 2.498 20 0 BEADLO Fc1ccc2nc(C3=C[NH2+]CCC3)cnc2c1 ZINC001243947685 985624503 /nfs/dbraw/zinc/62/45/03/985624503.db2.gz OVUJHLXBLLCWAC-UHFFFAOYSA-N 1 2 229.258 2.493 20 0 BEADLO CSc1ncc(C)c(C2=C[NH2+]CCC2)n1 ZINC001243948095 985627966 /nfs/dbraw/zinc/62/79/66/985627966.db2.gz UBOHBFWAJZQTAH-UHFFFAOYSA-N 1 2 221.329 2.231 20 0 BEADLO c1cc2ncnc(C3=C[NH2+]CCC3)c2s1 ZINC001243948070 985631591 /nfs/dbraw/zinc/63/15/91/985631591.db2.gz UJSXPVJKINPUNZ-UHFFFAOYSA-N 1 2 217.297 2.416 20 0 BEADLO Cc1nc2ccc(C3=C[NH2+]CCC3)cc2c(=O)o1 ZINC001243950141 985643561 /nfs/dbraw/zinc/64/35/61/985643561.db2.gz NUHUBEHLOGDAIA-UHFFFAOYSA-N 1 2 242.278 2.221 20 0 BEADLO CCCn1ncc(C[N@@H+]2CC[C@@H](F)C2)c1C ZINC001138638052 985651062 /nfs/dbraw/zinc/65/10/62/985651062.db2.gz YWMRTOOFZUEYPN-GFCCVEGCSA-N 1 2 225.311 2.145 20 0 BEADLO CCCn1ncc(C[N@H+]2CC[C@@H](F)C2)c1C ZINC001138638052 985651066 /nfs/dbraw/zinc/65/10/66/985651066.db2.gz YWMRTOOFZUEYPN-GFCCVEGCSA-N 1 2 225.311 2.145 20 0 BEADLO c1nc(C2=C[NH2+]CCC2)cnc1OC1CCC1 ZINC001243952760 985663149 /nfs/dbraw/zinc/66/31/49/985663149.db2.gz TUFKAUQZSSAYNS-UHFFFAOYSA-N 1 2 231.299 2.132 20 0 BEADLO Fc1cc(-c2cc[nH+]c3c2CCN3)cc(F)n1 ZINC001243975010 985705135 /nfs/dbraw/zinc/70/51/35/985705135.db2.gz SJJZAESKAKNFTG-UHFFFAOYSA-N 1 2 233.221 2.390 20 0 BEADLO CC1(C)C[N@H+](CC2=NOCC2)[C@@H]1c1cccnc1 ZINC001460541081 985864825 /nfs/dbraw/zinc/86/48/25/985864825.db2.gz IALQUQWPQZARLH-CYBMUJFWSA-N 1 2 245.326 2.241 20 0 BEADLO CC1(C)C[N@@H+](CC2=NOCC2)[C@@H]1c1cccnc1 ZINC001460541081 985864834 /nfs/dbraw/zinc/86/48/34/985864834.db2.gz IALQUQWPQZARLH-CYBMUJFWSA-N 1 2 245.326 2.241 20 0 BEADLO Cc1cn(C)nc1C[NH2+][C@H](C)c1ncccc1C ZINC001460930017 985948474 /nfs/dbraw/zinc/94/84/74/985948474.db2.gz DOZNGJRLMDXBEV-GFCCVEGCSA-N 1 2 244.342 2.283 20 0 BEADLO Oc1cc(Cl)cc(C[NH2+]Cc2cc[nH]n2)c1 ZINC001461018419 985997464 /nfs/dbraw/zinc/99/74/64/985997464.db2.gz FDFZXMGJRLGHBC-UHFFFAOYSA-N 1 2 237.690 2.059 20 0 BEADLO Nc1cn2ccc(-c3cc(F)ccc3N)cc2[nH+]1 ZINC001244399082 986053167 /nfs/dbraw/zinc/05/31/67/986053167.db2.gz ZBSJMZFAMSPKDV-UHFFFAOYSA-N 1 2 242.257 2.305 20 0 BEADLO Nc1ccc(F)cc1-c1cc[nH+]c2c1CCN2 ZINC001244400071 986060657 /nfs/dbraw/zinc/06/06/57/986060657.db2.gz PKBVSCRASRYDOB-UHFFFAOYSA-N 1 2 229.258 2.438 20 0 BEADLO CCc1cn(CC(=O)N[C@@H]2CCCC[C@H]2C)c[nH+]1 ZINC001459257926 986073703 /nfs/dbraw/zinc/07/37/03/986073703.db2.gz DOBUIDXIASHGIJ-DGCLKSJQSA-N 1 2 249.358 2.140 20 0 BEADLO COC(=O)c1cnc([C@H](C)[NH+]2CCCC2)s1 ZINC001462007887 986259523 /nfs/dbraw/zinc/25/95/23/986259523.db2.gz LXWLTWZJDPISFG-QMMMGPOBSA-N 1 2 240.328 2.087 20 0 BEADLO Cc1ccc(-c2ccc(CO)cc2C)[nH+]c1N ZINC001244583036 986268612 /nfs/dbraw/zinc/26/86/12/986268612.db2.gz LRHUJEZKDFKZQV-UHFFFAOYSA-N 1 2 228.295 2.440 20 0 BEADLO CCc1cc(-c2ccc[nH+]c2N)ccc1CO ZINC001244637200 986293119 /nfs/dbraw/zinc/29/31/19/986293119.db2.gz XYOOFYFAWGZLBC-UHFFFAOYSA-N 1 2 228.295 2.386 20 0 BEADLO Cc1cc(-c2ccc[nH+]c2N)cc(C)c1CO ZINC001244693914 986310251 /nfs/dbraw/zinc/31/02/51/986310251.db2.gz HPJMIKYJFBFWRE-UHFFFAOYSA-N 1 2 228.295 2.440 20 0 BEADLO CCCn1c[nH+]cc1CN1CC(C(F)(F)F)C1 ZINC001462272091 986331924 /nfs/dbraw/zinc/33/19/24/986331924.db2.gz SLGRZUPUFCVCEX-UHFFFAOYSA-N 1 2 247.264 2.287 20 0 BEADLO CC(C)(C)[C@@H](O)CNc1ccn2cc[nH+]c2c1 ZINC001253720185 986340999 /nfs/dbraw/zinc/34/09/99/986340999.db2.gz PYEBNAZCVPUMAP-NSHDSACASA-N 1 2 233.315 2.153 20 0 BEADLO CNc1cc(F)cc(-c2c[nH+]cn2C)c1 ZINC001244825720 986359183 /nfs/dbraw/zinc/35/91/83/986359183.db2.gz BGNXZTDFPLHRBO-UHFFFAOYSA-N 1 2 205.236 2.268 20 0 BEADLO CC(C)[C@H](O)C[N@@H+]1CCC[C@H](F)C(F)(F)C1 ZINC001253757601 986386189 /nfs/dbraw/zinc/38/61/89/986386189.db2.gz PVUVGWXHQWEMQX-ZJUUUORDSA-N 1 2 239.281 2.073 20 0 BEADLO CC(C)[C@H](O)C[N@H+]1CCC[C@H](F)C(F)(F)C1 ZINC001253757601 986386198 /nfs/dbraw/zinc/38/61/98/986386198.db2.gz PVUVGWXHQWEMQX-ZJUUUORDSA-N 1 2 239.281 2.073 20 0 BEADLO CNc1cc(-c2ccc(C)c(N)[nH+]2)ccn1 ZINC001244972300 986546850 /nfs/dbraw/zinc/54/68/50/986546850.db2.gz QHDALRUDNBUOHE-UHFFFAOYSA-N 1 2 214.272 2.076 20 0 BEADLO CNc1cc(-c2ccc(F)nc2)cc[nH+]1 ZINC001244973889 986552999 /nfs/dbraw/zinc/55/29/99/986552999.db2.gz SAEMLMWMVAKMQO-UHFFFAOYSA-N 1 2 203.220 2.324 20 0 BEADLO COc1c(O)cccc1-c1cc[nH+]c2c1CCN2 ZINC001244993805 986594768 /nfs/dbraw/zinc/59/47/68/986594768.db2.gz YROAZXISLASALP-UHFFFAOYSA-N 1 2 242.278 2.074 20 0 BEADLO COc1c(O)cccc1/C(C)=C/C=C/[NH3+] ZINC001244993961 986595312 /nfs/dbraw/zinc/59/53/12/986595312.db2.gz VYWNBUDPKCBNMW-KBXRYBNXSA-N 1 2 205.257 2.277 20 0 BEADLO Cc1c[nH+]c(CCNc2cc(F)ncn2)c(C)c1 ZINC000689438173 986613029 /nfs/dbraw/zinc/61/30/29/986613029.db2.gz HNDHXYBYULZCTR-UHFFFAOYSA-N 1 2 246.289 2.282 20 0 BEADLO COc1cc(/C(C)=C/C=C/[NH3+])cnc1F ZINC001245075005 986633781 /nfs/dbraw/zinc/63/37/81/986633781.db2.gz FULHYSSUVCHCBP-MSLMYCKWSA-N 1 2 208.236 2.105 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1ccc(C)cc1OC ZINC001464605872 986647991 /nfs/dbraw/zinc/64/79/91/986647991.db2.gz QMIQWWBVVYUSQO-GFCCVEGCSA-N 1 2 248.326 2.036 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1ccc(C)cc1OC ZINC001464605872 986647997 /nfs/dbraw/zinc/64/79/97/986647997.db2.gz QMIQWWBVVYUSQO-GFCCVEGCSA-N 1 2 248.326 2.036 20 0 BEADLO C[NH+](C)Cc1cc(Cl)cnc1Cl ZINC001139354693 986678229 /nfs/dbraw/zinc/67/82/29/986678229.db2.gz YZSSUQOIDYNWOW-UHFFFAOYSA-N 1 2 205.088 2.450 20 0 BEADLO Cc1c(CN(C)CC(F)F)[nH+]c2ccccn12 ZINC001137277102 986711506 /nfs/dbraw/zinc/71/15/06/986711506.db2.gz PHDJDBMOVIUAJY-UHFFFAOYSA-N 1 2 239.269 2.340 20 0 BEADLO Cc1c(CN(C)CCF)[nH+]c2ccccn12 ZINC001137277103 986712868 /nfs/dbraw/zinc/71/28/68/986712868.db2.gz PHGGQLUPRBYIGP-UHFFFAOYSA-N 1 2 221.279 2.044 20 0 BEADLO COCn1cc(-c2cc(C)cn3cc[nH+]c23)cn1 ZINC001245221612 986747738 /nfs/dbraw/zinc/74/77/38/986747738.db2.gz XGLWERWYODJMSK-UHFFFAOYSA-N 1 2 242.282 2.110 20 0 BEADLO CCN(Cc1cc2ccccc2[nH]1)C1C[NH+](C)C1 ZINC001137320609 986764381 /nfs/dbraw/zinc/76/43/81/986764381.db2.gz BTDIJGNFDDJFER-UHFFFAOYSA-N 1 2 243.354 2.304 20 0 BEADLO Cc1cc(C)c(C[N@H+]2CCC(=O)[C@@H](F)CC2)[nH]1 ZINC001137322331 986765879 /nfs/dbraw/zinc/76/58/79/986765879.db2.gz AHYSIYMCKPNPTJ-NSHDSACASA-N 1 2 238.306 2.135 20 0 BEADLO Cc1cc(C)c(C[N@@H+]2CCC(=O)[C@@H](F)CC2)[nH]1 ZINC001137322331 986765891 /nfs/dbraw/zinc/76/58/91/986765891.db2.gz AHYSIYMCKPNPTJ-NSHDSACASA-N 1 2 238.306 2.135 20 0 BEADLO Cc1cc(C)c(C[NH+]2CC3(C2)CCCCO3)[nH]1 ZINC001137322602 986768515 /nfs/dbraw/zinc/76/85/15/986768515.db2.gz KAOGSADQPVCLMC-UHFFFAOYSA-N 1 2 234.343 2.386 20 0 BEADLO O=C1C[N@H+](C2Cc3ccccc3C2)CCC[C@H]1F ZINC001255020708 986778207 /nfs/dbraw/zinc/77/82/07/986778207.db2.gz ZRXSGCICMQPFNS-CQSZACIVSA-N 1 2 247.313 2.157 20 0 BEADLO O=C1C[N@@H+](C2Cc3ccccc3C2)CCC[C@H]1F ZINC001255020708 986778224 /nfs/dbraw/zinc/77/82/24/986778224.db2.gz ZRXSGCICMQPFNS-CQSZACIVSA-N 1 2 247.313 2.157 20 0 BEADLO Nc1cc(-c2c[nH]c3ncc(F)cc23)cc[nH+]1 ZINC001245430174 986846574 /nfs/dbraw/zinc/84/65/74/986846574.db2.gz HSFDZWZQSOXAJF-UHFFFAOYSA-N 1 2 228.230 2.346 20 0 BEADLO C/C(Cl)=C/C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001467760764 986866725 /nfs/dbraw/zinc/86/67/25/986866725.db2.gz JMXOKMLIFHWEIA-VURMDHGXSA-N 1 2 235.674 2.415 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC1CCC2(CC2)CC1 ZINC001467791185 986869512 /nfs/dbraw/zinc/86/95/12/986869512.db2.gz RGNLQOBTEANGJN-UHFFFAOYSA-N 1 2 247.342 2.100 20 0 BEADLO CCCOC1C[NH+](Cc2c[nH]c3ncccc23)C1 ZINC001137402125 986880313 /nfs/dbraw/zinc/88/03/13/986880313.db2.gz OUKMUEOCDIOYJX-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO C[C@H]1CC[N@@H+]([C@H]2CCSC2)CC1(F)F ZINC001255283034 986889514 /nfs/dbraw/zinc/88/95/14/986889514.db2.gz XULWRCLHNWUXAC-IUCAKERBSA-N 1 2 221.316 2.469 20 0 BEADLO C[C@H]1CC[N@H+]([C@H]2CCSC2)CC1(F)F ZINC001255283034 986889518 /nfs/dbraw/zinc/88/95/18/986889518.db2.gz XULWRCLHNWUXAC-IUCAKERBSA-N 1 2 221.316 2.469 20 0 BEADLO C[C@@H]1CC[N@@H+]([C@H]2CCSC2)CC1(F)F ZINC001255282965 986889921 /nfs/dbraw/zinc/88/99/21/986889921.db2.gz XULWRCLHNWUXAC-BDAKNGLRSA-N 1 2 221.316 2.469 20 0 BEADLO C[C@@H]1CC[N@H+]([C@H]2CCSC2)CC1(F)F ZINC001255282965 986889926 /nfs/dbraw/zinc/88/99/26/986889926.db2.gz XULWRCLHNWUXAC-BDAKNGLRSA-N 1 2 221.316 2.469 20 0 BEADLO CCCC[C@H](C)[NH+]1CC(O)(C(F)(F)F)C1 ZINC001255322110 986919559 /nfs/dbraw/zinc/91/95/59/986919559.db2.gz GGNWPQKBPNVUOX-QMMMGPOBSA-N 1 2 225.254 2.174 20 0 BEADLO Cc1cc(-c2c[nH+]c(N)c(C)c2)nc2[nH]cnc21 ZINC001245537765 986921559 /nfs/dbraw/zinc/92/15/59/986921559.db2.gz HVFUQJNTSDIWTP-UHFFFAOYSA-N 1 2 239.282 2.219 20 0 BEADLO Cc1cc(-c2cncc3ncoc32)c[nH+]c1N ZINC001245540696 986923174 /nfs/dbraw/zinc/92/31/74/986923174.db2.gz YXEWETDLRLYQDK-UHFFFAOYSA-N 1 2 226.239 2.175 20 0 BEADLO CCCc1cc(-c2c[nH+]c(N)c(C)c2)ncn1 ZINC001245539333 986924792 /nfs/dbraw/zinc/92/47/92/986924792.db2.gz XWSIDIDJLCEHBV-UHFFFAOYSA-N 1 2 228.299 2.382 20 0 BEADLO Cc1nc2ncc(-c3c[nH+]c(N)c(C)c3)cc2o1 ZINC001245539736 986925969 /nfs/dbraw/zinc/92/59/69/986925969.db2.gz XXZNMZIXLURFIV-UHFFFAOYSA-N 1 2 240.266 2.484 20 0 BEADLO O=C1Cc2ccc(-c3cccc4[nH+]ccn43)cc2N1 ZINC001245889676 987100531 /nfs/dbraw/zinc/10/05/31/987100531.db2.gz BDPVTIXMTLCGBJ-UHFFFAOYSA-N 1 2 249.273 2.496 20 0 BEADLO CC1(C)C[C@H]1C(=O)OCc1cccc2[nH+]ccn21 ZINC000752521937 987105025 /nfs/dbraw/zinc/10/50/25/987105025.db2.gz DRNCDXGZTZIHNI-NSHDSACASA-N 1 2 244.294 2.424 20 0 BEADLO Cc1ccc(-c2ccc3c(c2)NC(=O)C3)[nH+]c1N ZINC001245894721 987114257 /nfs/dbraw/zinc/11/42/57/987114257.db2.gz WEZNTXLAOTWBSC-UHFFFAOYSA-N 1 2 239.278 2.134 20 0 BEADLO C[C@@H]1C[C@H]1C1=NNC(=c2ccnc3c2=CC=[NH+]3)O1 ZINC001256688990 987266555 /nfs/dbraw/zinc/26/65/55/987266555.db2.gz BWFUMCMSVWBRKV-SZEHBUNVSA-N 1 2 240.266 2.213 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@@H]2CCCc3cccnc32)n1 ZINC000693488089 987310341 /nfs/dbraw/zinc/31/03/41/987310341.db2.gz WBQCOAXAMPFEDL-GFCCVEGCSA-N 1 2 242.326 2.280 20 0 BEADLO CS[C@@H]1CC[C@H](Nc2cc[nH+]cc2F)C1 ZINC000699602462 987376713 /nfs/dbraw/zinc/37/67/13/987376713.db2.gz VLHLAHFQDNZGAW-DTWKUNHWSA-N 1 2 226.320 2.339 20 0 BEADLO CO[C@@H]1C[N@H+](Cc2cccc(C)c2F)C[C@@H]1F ZINC001137672650 987385320 /nfs/dbraw/zinc/38/53/20/987385320.db2.gz QWSNBPKSXVWAJH-NWDGAFQWSA-N 1 2 241.281 2.303 20 0 BEADLO CO[C@@H]1C[N@@H+](Cc2cccc(C)c2F)C[C@@H]1F ZINC001137672650 987385324 /nfs/dbraw/zinc/38/53/24/987385324.db2.gz QWSNBPKSXVWAJH-NWDGAFQWSA-N 1 2 241.281 2.303 20 0 BEADLO F[C@@]1(c2ccccc2)CC[N@H+](CC2=NOCC2)C1 ZINC001473423012 987431856 /nfs/dbraw/zinc/43/18/56/987431856.db2.gz HCPXAZJKPJJXPG-AWEZNQCLSA-N 1 2 248.301 2.333 20 0 BEADLO F[C@@]1(c2ccccc2)CC[N@@H+](CC2=NOCC2)C1 ZINC001473423012 987431863 /nfs/dbraw/zinc/43/18/63/987431863.db2.gz HCPXAZJKPJJXPG-AWEZNQCLSA-N 1 2 248.301 2.333 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1c(C)cccc1F ZINC001116247334 987492683 /nfs/dbraw/zinc/49/26/83/987492683.db2.gz WYBBWWQHNDOLPS-UHFFFAOYSA-N 1 2 247.273 2.096 20 0 BEADLO C[N@H+](Cc1ncccn1)[C@@H]1C=CCCC1 ZINC001473753201 987542695 /nfs/dbraw/zinc/54/26/95/987542695.db2.gz SMRSZMKYHVSQCP-LLVKDONJSA-N 1 2 203.289 2.017 20 0 BEADLO C[N@@H+](Cc1ncccn1)[C@@H]1C=CCCC1 ZINC001473753201 987542703 /nfs/dbraw/zinc/54/27/03/987542703.db2.gz SMRSZMKYHVSQCP-LLVKDONJSA-N 1 2 203.289 2.017 20 0 BEADLO Cc1[nH]c([C@H]2CCCN2Cc2cn[nH]c2)[nH+]c1C ZINC001473788917 987560843 /nfs/dbraw/zinc/56/08/43/987560843.db2.gz SZANKDYGTGEYBM-GFCCVEGCSA-N 1 2 245.330 2.087 20 0 BEADLO O=C(CCCn1cc[nH+]c1)N1CC2CCC1CC2 ZINC001116460443 987589722 /nfs/dbraw/zinc/58/97/22/987589722.db2.gz QBFVFVYYZFDJHO-UHFFFAOYSA-N 1 2 247.342 2.064 20 0 BEADLO CCC1CCC(N[C@H]2C[NH2+]CC[C@H]2F)CC1 ZINC001246218271 987616794 /nfs/dbraw/zinc/61/67/94/987616794.db2.gz RUDWVUAMLZKNTH-TUUUFIMRSA-N 1 2 228.355 2.245 20 0 BEADLO CCC1CCC([NH2+][C@H]2CNCC[C@H]2F)CC1 ZINC001246218271 987616800 /nfs/dbraw/zinc/61/68/00/987616800.db2.gz RUDWVUAMLZKNTH-TUUUFIMRSA-N 1 2 228.355 2.245 20 0 BEADLO COc1nccc(CNc2cccc[nH+]2)c1F ZINC001473945021 987623999 /nfs/dbraw/zinc/62/39/99/987623999.db2.gz SNKICSNYQMVIIG-UHFFFAOYSA-N 1 2 233.246 2.236 20 0 BEADLO Cn1nc(C[NH2+]Cc2cnsc2)cc1C1CC1 ZINC001474280019 987672921 /nfs/dbraw/zinc/67/29/21/987672921.db2.gz NYJTYEMHNAERJJ-UHFFFAOYSA-N 1 2 248.355 2.044 20 0 BEADLO CCCn1c[nH+]cc1CN1CCC(F)(F)C1 ZINC001474395743 987711933 /nfs/dbraw/zinc/71/19/33/987711933.db2.gz BRYLAUBWORLRNP-UHFFFAOYSA-N 1 2 229.274 2.134 20 0 BEADLO C[C@@H](C(=O)NCC1C(C)(C)C1(C)C)n1cc[nH+]c1 ZINC001116886956 987747796 /nfs/dbraw/zinc/74/77/96/987747796.db2.gz MOERTOPCYJTJPC-JTQLQIEISA-N 1 2 249.358 2.243 20 0 BEADLO CCCC[C@H](CC)N[C@@H]1C[NH2+]CC1(F)F ZINC001246457061 987812539 /nfs/dbraw/zinc/81/25/39/987812539.db2.gz CBZBBHSOSQNLQN-VHSXEESVSA-N 1 2 220.307 2.152 20 0 BEADLO CCCC[C@H](CC)[NH2+][C@@H]1CNCC1(F)F ZINC001246457061 987812544 /nfs/dbraw/zinc/81/25/44/987812544.db2.gz CBZBBHSOSQNLQN-VHSXEESVSA-N 1 2 220.307 2.152 20 0 BEADLO CCOC(=O)[C@@H]([NH2+]CCSC(C)C)C1CC1 ZINC001118224605 988130923 /nfs/dbraw/zinc/13/09/23/988130923.db2.gz LAHHSRRMRSJSQI-NSHDSACASA-N 1 2 245.388 2.059 20 0 BEADLO CC(C)CONC(=O)Nc1ccc2[nH+]ccn2c1 ZINC001118555833 988433224 /nfs/dbraw/zinc/43/32/24/988433224.db2.gz PINATRWBNDWIBV-UHFFFAOYSA-N 1 2 248.286 2.043 20 0 BEADLO CC[C@H](Cc1ccccc1)[N@H+](C)Cc1nnc[nH]1 ZINC001118557124 988434751 /nfs/dbraw/zinc/43/47/51/988434751.db2.gz NPJKNZBESHHHKM-CYBMUJFWSA-N 1 2 244.342 2.258 20 0 BEADLO CC[C@H](Cc1ccccc1)[N@@H+](C)Cc1nnc[nH]1 ZINC001118557124 988434755 /nfs/dbraw/zinc/43/47/55/988434755.db2.gz NPJKNZBESHHHKM-CYBMUJFWSA-N 1 2 244.342 2.258 20 0 BEADLO CCCCCC[C@H](CC)N1CC[NH2+][C@@H](CO)C1 ZINC001246800118 988481789 /nfs/dbraw/zinc/48/17/89/988481789.db2.gz YLAYHSVTUCILMK-KGLIPLIRSA-N 1 2 242.407 2.002 20 0 BEADLO Cc1cc(C[N@H+](Cc2cccnc2)C2CC2)[nH]n1 ZINC001323758574 988606862 /nfs/dbraw/zinc/60/68/62/988606862.db2.gz DKRMNRFHWQQRSL-UHFFFAOYSA-N 1 2 242.326 2.278 20 0 BEADLO Cc1cc(C[N@@H+](Cc2cccnc2)C2CC2)[nH]n1 ZINC001323758574 988606878 /nfs/dbraw/zinc/60/68/78/988606878.db2.gz DKRMNRFHWQQRSL-UHFFFAOYSA-N 1 2 242.326 2.278 20 0 BEADLO CC[C@H](C)C(=O)N(C)C1C[NH+](CC=C(C)C)C1 ZINC001323887911 988644786 /nfs/dbraw/zinc/64/47/86/988644786.db2.gz XUDZSJVAGLIAOX-LBPRGKRZSA-N 1 2 238.375 2.141 20 0 BEADLO C[C@@H]1CC[C@]2(CCN(c3cc(N)nc[nH+]3)C2)C1 ZINC001548515176 988679163 /nfs/dbraw/zinc/67/91/63/988679163.db2.gz SUABKUWXGXZTRK-MFKMUULPSA-N 1 2 232.331 2.075 20 0 BEADLO CCc1nnc(Cn2c[nH+]c(C(C)(C)C)c2)o1 ZINC001118927446 988708075 /nfs/dbraw/zinc/70/80/75/988708075.db2.gz OYBQKCRFTDBPOH-UHFFFAOYSA-N 1 2 234.303 2.174 20 0 BEADLO C[C@@H]([NH3+])c1nc2ccc3ncccc3c2[nH]1 ZINC001247015542 988839332 /nfs/dbraw/zinc/83/93/32/988839332.db2.gz ZKXXAQOJHJQHGE-SSDOTTSWSA-N 1 2 212.256 2.131 20 0 BEADLO CCc1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001247389083 988871470 /nfs/dbraw/zinc/87/14/70/988871470.db2.gz FSCVCSXFZZROKF-UHFFFAOYSA-N 1 2 240.266 2.485 20 0 BEADLO CCOc1ncccc1C[NH2+]Cc1ocnc1C ZINC001119445926 989081689 /nfs/dbraw/zinc/08/16/89/989081689.db2.gz RQODIDOVRSCHMP-UHFFFAOYSA-N 1 2 247.298 2.067 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@H](c3nccs3)C2)n[nH]1 ZINC001119516250 989120008 /nfs/dbraw/zinc/12/00/08/989120008.db2.gz SJUALVXQWHYTKH-JTQLQIEISA-N 1 2 248.355 2.164 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@H](c3nccs3)C2)n[nH]1 ZINC001119516250 989120016 /nfs/dbraw/zinc/12/00/16/989120016.db2.gz SJUALVXQWHYTKH-JTQLQIEISA-N 1 2 248.355 2.164 20 0 BEADLO C[C@H](c1nc(CCCCF)no1)n1cc[nH+]c1 ZINC001119524198 989124580 /nfs/dbraw/zinc/12/45/80/989124580.db2.gz GJPVTXVMHJGOOO-SECBINFHSA-N 1 2 238.266 2.168 20 0 BEADLO C[C@@H](C(=O)N1CC(C)(C)C[C@H]1C)n1cc[nH+]c1 ZINC001325251006 989132837 /nfs/dbraw/zinc/13/28/37/989132837.db2.gz ZPBOHGJJMLQGFV-MNOVXSKESA-N 1 2 235.331 2.091 20 0 BEADLO c1cc2n(c1)CC[N@@H+](Cc1ccc3n1CCC3)C2 ZINC001248823515 989182086 /nfs/dbraw/zinc/18/20/86/989182086.db2.gz ZYNSBHOFZIKCNT-UHFFFAOYSA-N 1 2 241.338 2.252 20 0 BEADLO c1cc2n(c1)CC[N@H+](Cc1ccc3n1CCC3)C2 ZINC001248823515 989182095 /nfs/dbraw/zinc/18/20/95/989182095.db2.gz ZYNSBHOFZIKCNT-UHFFFAOYSA-N 1 2 241.338 2.252 20 0 BEADLO Cc1ccc2[nH]c(C[N@H+]3CC[C@H]3C)nc2c1 ZINC001248839427 989188467 /nfs/dbraw/zinc/18/84/67/989188467.db2.gz JENODYMHFFRKBH-SNVBAGLBSA-N 1 2 215.300 2.466 20 0 BEADLO Cc1ccc2[nH]c(C[N@@H+]3CC[C@H]3C)nc2c1 ZINC001248839427 989188470 /nfs/dbraw/zinc/18/84/70/989188470.db2.gz JENODYMHFFRKBH-SNVBAGLBSA-N 1 2 215.300 2.466 20 0 BEADLO Cc1ccc2nc(C[N@H+]3CC[C@H]3C)[nH]c2c1 ZINC001248839427 989188473 /nfs/dbraw/zinc/18/84/73/989188473.db2.gz JENODYMHFFRKBH-SNVBAGLBSA-N 1 2 215.300 2.466 20 0 BEADLO Cc1ccc2nc(C[N@@H+]3CC[C@H]3C)[nH]c2c1 ZINC001248839427 989188479 /nfs/dbraw/zinc/18/84/79/989188479.db2.gz JENODYMHFFRKBH-SNVBAGLBSA-N 1 2 215.300 2.466 20 0 BEADLO CC(C)Sc1nccc(C[NH+]2CC(C)C2)n1 ZINC001248829830 989192868 /nfs/dbraw/zinc/19/28/68/989192868.db2.gz SUZKEJYZXNGBHW-UHFFFAOYSA-N 1 2 237.372 2.429 20 0 BEADLO Cc1cc(C)nc(C[NH+]2CCC(F)CC2)n1 ZINC001248933240 989217959 /nfs/dbraw/zinc/21/79/59/989217959.db2.gz ULTQOBZSGLUXEC-UHFFFAOYSA-N 1 2 223.295 2.027 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@H]1CC[C@H](C)C1 ZINC001518049742 989270554 /nfs/dbraw/zinc/27/05/54/989270554.db2.gz XFBHOOKGPKPGSZ-QWRGUYRKSA-N 1 2 236.315 2.382 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@@H]1CC12CCC2 ZINC001518047103 989276210 /nfs/dbraw/zinc/27/62/10/989276210.db2.gz CIVAEIJHICTMOX-NSHDSACASA-N 1 2 234.299 2.136 20 0 BEADLO CCN(Cc1cc(C(C)(C)C)c[nH]1)C1C[NH+](C)C1 ZINC001249480493 989293189 /nfs/dbraw/zinc/29/31/89/989293189.db2.gz VLRFOZMIQMNCRC-UHFFFAOYSA-N 1 2 249.402 2.448 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)CCC(C)(F)F ZINC001518383493 989300613 /nfs/dbraw/zinc/30/06/13/989300613.db2.gz GLDHRZKWFUZBQU-UHFFFAOYSA-N 1 2 242.269 2.494 20 0 BEADLO CC[C@H]1CC[C@@H](C(=O)Nc2c(C)c[nH+]cc2C)O1 ZINC001518385933 989301859 /nfs/dbraw/zinc/30/18/59/989301859.db2.gz YERPCFKCGVXDDJ-RYUDHWBXSA-N 1 2 248.326 2.016 20 0 BEADLO Cc1cc(C[NH+]2CCC(F)CC2)ns1 ZINC001249571148 989310072 /nfs/dbraw/zinc/31/00/72/989310072.db2.gz MFMFRVGJWXNSOV-UHFFFAOYSA-N 1 2 214.309 2.385 20 0 BEADLO CCO[C@@H]1CCC[N@H+](Cc2cc(C)sn2)C1 ZINC001249580895 989311790 /nfs/dbraw/zinc/31/17/90/989311790.db2.gz BXCFSWSGUKQZTQ-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO CCO[C@@H]1CCC[N@@H+](Cc2cc(C)sn2)C1 ZINC001249580895 989311800 /nfs/dbraw/zinc/31/18/00/989311800.db2.gz BXCFSWSGUKQZTQ-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO CCC1(O)CC[NH+](Cc2cc(C)sn2)CC1 ZINC001249589008 989315913 /nfs/dbraw/zinc/31/59/13/989315913.db2.gz RCDWRBWAOJKWEI-UHFFFAOYSA-N 1 2 240.372 2.188 20 0 BEADLO FC(F)(F)c1c[nH+]ccc1Nc1ncco1 ZINC001249582807 989316844 /nfs/dbraw/zinc/31/68/44/989316844.db2.gz FWOWWKVYFHETEO-UHFFFAOYSA-N 1 2 229.161 2.254 20 0 BEADLO Cc1cc(C[N@H+](C)C[C@@H]2CCCCO2)ns1 ZINC001249583110 989317526 /nfs/dbraw/zinc/31/75/26/989317526.db2.gz ZGAVCLVFIFTVAR-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO Cc1cc(C[N@@H+](C)C[C@@H]2CCCCO2)ns1 ZINC001249583110 989317533 /nfs/dbraw/zinc/31/75/33/989317533.db2.gz ZGAVCLVFIFTVAR-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO COC(=O)c1cc(F)ccc1C[N@@H+]1CC[C@@H]1C ZINC001249600544 989321484 /nfs/dbraw/zinc/32/14/84/989321484.db2.gz PPSQCVYSQCZHMY-VIFPVBQESA-N 1 2 237.274 2.207 20 0 BEADLO COC(=O)c1cc(F)ccc1C[N@H+]1CC[C@@H]1C ZINC001249600544 989321490 /nfs/dbraw/zinc/32/14/90/989321490.db2.gz PPSQCVYSQCZHMY-VIFPVBQESA-N 1 2 237.274 2.207 20 0 BEADLO Cc1cccc(Nc2ccccc2CC(N)=O)[nH+]1 ZINC001249597953 989321561 /nfs/dbraw/zinc/32/15/61/989321561.db2.gz RLWYIEVTECDTHC-UHFFFAOYSA-N 1 2 241.294 2.161 20 0 BEADLO Cc1ccc(Nc2ccccc2CC(N)=O)[nH+]c1 ZINC001249597080 989323166 /nfs/dbraw/zinc/32/31/66/989323166.db2.gz FJLJOQOYUJKPLW-UHFFFAOYSA-N 1 2 241.294 2.161 20 0 BEADLO Cc1cc[nH+]c(Nc2cnc3c(cnn3C)c2)c1 ZINC001249658688 989335014 /nfs/dbraw/zinc/33/50/14/989335014.db2.gz GMWKVDPDXCZSCY-UHFFFAOYSA-N 1 2 239.282 2.415 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cccnc1)c1ncccn1 ZINC001119692625 989340619 /nfs/dbraw/zinc/34/06/19/989340619.db2.gz LFXVREPEXOUZSH-WDEREUQCSA-N 1 2 228.299 2.283 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2CCC[C@H](F)C2)n1 ZINC001326236883 989442845 /nfs/dbraw/zinc/44/28/45/989442845.db2.gz RMWBSACZNMPLDX-BDAKNGLRSA-N 1 2 227.283 2.175 20 0 BEADLO CC(C)CC(=O)N1CCC(Cc2c[nH]c[nH+]2)CC1 ZINC001520813901 989607896 /nfs/dbraw/zinc/60/78/96/989607896.db2.gz GXQPJYOVDBFRFX-UHFFFAOYSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H](NC(=O)[C@@H](C)n1cc[nH+]c1)C1CCCC1 ZINC001326731611 989667627 /nfs/dbraw/zinc/66/76/27/989667627.db2.gz ZOWQKPRQMJHPBK-GHMZBOCLSA-N 1 2 235.331 2.139 20 0 BEADLO Cc1nc([C@H](C)[NH2+][C@@H]2CC[C@H](C)SC2)no1 ZINC001326853512 989749360 /nfs/dbraw/zinc/74/93/60/989749360.db2.gz OMJOTWXQIMYVPZ-OYNCUSHFSA-N 1 2 241.360 2.313 20 0 BEADLO CCc1ccc(N2CCC[C@H]([C@@H](C)O)C2)[nH+]c1 ZINC001120828195 989908892 /nfs/dbraw/zinc/90/88/92/989908892.db2.gz PEVPBGOEHLECGL-YPMHNXCESA-N 1 2 234.343 2.241 20 0 BEADLO Cc1noc(NCc2cc(C)[nH+]c(C)c2)n1 ZINC001120857383 989927513 /nfs/dbraw/zinc/92/75/13/989927513.db2.gz YIVXAVGSLVQPOF-UHFFFAOYSA-N 1 2 218.260 2.002 20 0 BEADLO CCc1ccc(N2CC[C@H](C)[C@H](CO)C2)[nH+]c1 ZINC001120867316 989935845 /nfs/dbraw/zinc/93/58/45/989935845.db2.gz GHRBPVUMKQRPOH-AAEUAGOBSA-N 1 2 234.343 2.099 20 0 BEADLO CNc1cc(N2CC(F)(F)CC[C@@H]2C)nc[nH+]1 ZINC001120888914 989949357 /nfs/dbraw/zinc/94/93/57/989949357.db2.gz PYSBYVSYTYBMCD-QMMMGPOBSA-N 1 2 242.273 2.142 20 0 BEADLO CNc1cc(N2CC(F)(F)CC[C@@H]2C)[nH+]cn1 ZINC001120888914 989949364 /nfs/dbraw/zinc/94/93/64/989949364.db2.gz PYSBYVSYTYBMCD-QMMMGPOBSA-N 1 2 242.273 2.142 20 0 BEADLO CCc1ccc(N2CCC(O)(CC)CC2)[nH+]c1 ZINC001120902432 989957848 /nfs/dbraw/zinc/95/78/48/989957848.db2.gz RDKZNWGWLMHXRE-UHFFFAOYSA-N 1 2 234.343 2.385 20 0 BEADLO CCc1ccc(N2CCC([C@H](C)CO)CC2)[nH+]c1 ZINC001120943580 989979397 /nfs/dbraw/zinc/97/93/97/989979397.db2.gz IDZHMFZFAVNNLB-GFCCVEGCSA-N 1 2 248.370 2.489 20 0 BEADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)[C@@H]1C[C@@H]1F ZINC001525657410 990064692 /nfs/dbraw/zinc/06/46/92/990064692.db2.gz DGMYHIWXMUVMMB-NEPJUHHUSA-N 1 2 245.257 2.169 20 0 BEADLO Cc1cocc1C(=O)OCC(C)(C)n1cc[nH+]c1 ZINC001123153877 990518794 /nfs/dbraw/zinc/51/87/94/990518794.db2.gz IYHQLHMGFHLKNT-UHFFFAOYSA-N 1 2 248.282 2.377 20 0 BEADLO Cc1coc(C(=O)Nc2cccc3[nH+]ccn32)c1 ZINC001538058931 990521673 /nfs/dbraw/zinc/52/16/73/990521673.db2.gz YCQJVENBLGZSHR-UHFFFAOYSA-N 1 2 241.250 2.488 20 0 BEADLO O=C(CCF)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001540619072 990630329 /nfs/dbraw/zinc/63/03/29/990630329.db2.gz NOCFFAIAVMQYDI-UHFFFAOYSA-N 1 2 233.246 2.170 20 0 BEADLO CCc1ccccc1NC(=O)[C@@H]1CC[N@H+]1CC ZINC001540677991 990637367 /nfs/dbraw/zinc/63/73/67/990637367.db2.gz AFCXFQJPGXKEQN-ZDUSSCGKSA-N 1 2 232.327 2.282 20 0 BEADLO CCc1ccccc1NC(=O)[C@@H]1CC[N@@H+]1CC ZINC001540677991 990637371 /nfs/dbraw/zinc/63/73/71/990637371.db2.gz AFCXFQJPGXKEQN-ZDUSSCGKSA-N 1 2 232.327 2.282 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1C(=O)CCc1[nH+]ccn1C ZINC001123782048 990668782 /nfs/dbraw/zinc/66/87/82/990668782.db2.gz DGLBRJXDHLUSFG-NEPJUHHUSA-N 1 2 249.358 2.142 20 0 BEADLO C[C@H]1C[C@H](C)N(C(=O)c2cccc3[nH+]ccn32)C1 ZINC001544455990 990721897 /nfs/dbraw/zinc/72/18/97/990721897.db2.gz LQNSRYWCOHKLSK-QWRGUYRKSA-N 1 2 243.310 2.205 20 0 BEADLO CC(C)c1cc(NC(=O)[C@@H](C)n2cc[nH+]c2)no1 ZINC001544893932 990739165 /nfs/dbraw/zinc/73/91/65/990739165.db2.gz YRORNYDOJBRCLQ-SECBINFHSA-N 1 2 248.286 2.194 20 0 BEADLO C=C/C=C\CC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001556482164 990830045 /nfs/dbraw/zinc/83/00/45/990830045.db2.gz SEFLGIDJJVFORN-ARJAWSKDSA-N 1 2 227.267 2.405 20 0 BEADLO Fc1ccc(C[NH+]2CC(c3cccnc3)C2)cn1 ZINC001137741778 990846031 /nfs/dbraw/zinc/84/60/31/990846031.db2.gz XEVOAQVSYIQZFI-UHFFFAOYSA-N 1 2 243.285 2.215 20 0 BEADLO CC(=O)[C@H]1CC[N@H+](Cc2scnc2Cl)C1 ZINC001137824719 990854308 /nfs/dbraw/zinc/85/43/08/990854308.db2.gz DFPDRHJTKAFSQE-QMMMGPOBSA-N 1 2 244.747 2.207 20 0 BEADLO CC(=O)[C@H]1CC[N@@H+](Cc2scnc2Cl)C1 ZINC001137824719 990854310 /nfs/dbraw/zinc/85/43/10/990854310.db2.gz DFPDRHJTKAFSQE-QMMMGPOBSA-N 1 2 244.747 2.207 20 0 BEADLO COC(=O)[C@@H]1CC[N@@H+]1Cc1c(C)cccc1C ZINC001137848020 990860697 /nfs/dbraw/zinc/86/06/97/990860697.db2.gz PGACTJMFZPKFSX-ZDUSSCGKSA-N 1 2 233.311 2.051 20 0 BEADLO COC(=O)[C@@H]1CC[N@H+]1Cc1c(C)cccc1C ZINC001137848020 990860698 /nfs/dbraw/zinc/86/06/98/990860698.db2.gz PGACTJMFZPKFSX-ZDUSSCGKSA-N 1 2 233.311 2.051 20 0 BEADLO CO[C@H]1CC[N@H+](Cc2cc(F)cc(F)c2F)C1 ZINC001137868863 990862719 /nfs/dbraw/zinc/86/27/19/990862719.db2.gz UTFBAYLFJIKYSS-JTQLQIEISA-N 1 2 245.244 2.325 20 0 BEADLO CO[C@H]1CC[N@@H+](Cc2cc(F)cc(F)c2F)C1 ZINC001137868863 990862720 /nfs/dbraw/zinc/86/27/20/990862720.db2.gz UTFBAYLFJIKYSS-JTQLQIEISA-N 1 2 245.244 2.325 20 0 BEADLO CCOc1cccc(C[N@@H+]2CCC(=O)[C@@H](C)C2)c1 ZINC001138096045 990882237 /nfs/dbraw/zinc/88/22/37/990882237.db2.gz RDCWJXFFPUSIOF-LBPRGKRZSA-N 1 2 247.338 2.496 20 0 BEADLO CCOc1cccc(C[N@H+]2CCC(=O)[C@@H](C)C2)c1 ZINC001138096045 990882238 /nfs/dbraw/zinc/88/22/38/990882238.db2.gz RDCWJXFFPUSIOF-LBPRGKRZSA-N 1 2 247.338 2.496 20 0 BEADLO O=C(CCCn1cc[nH+]c1)NCCC1CC=CC1 ZINC000831446197 990907964 /nfs/dbraw/zinc/90/79/64/990907964.db2.gz MQXJEXAPLKWIEY-UHFFFAOYSA-N 1 2 247.342 2.136 20 0 BEADLO Oc1cc(O)cc(C[N@@H+]2CCC[C@@H]2CF)c1 ZINC001138333916 990920745 /nfs/dbraw/zinc/92/07/45/990920745.db2.gz WSLLQDMLGFIIKQ-SNVBAGLBSA-N 1 2 225.263 2.032 20 0 BEADLO Oc1cc(O)cc(C[N@H+]2CCC[C@@H]2CF)c1 ZINC001138333916 990920747 /nfs/dbraw/zinc/92/07/47/990920747.db2.gz WSLLQDMLGFIIKQ-SNVBAGLBSA-N 1 2 225.263 2.032 20 0 BEADLO COc1c(C)cc(C[NH+]2CCC(=O)CC2)cc1C ZINC001138426102 990944163 /nfs/dbraw/zinc/94/41/63/990944163.db2.gz WKXFWIQSRCWMKM-UHFFFAOYSA-N 1 2 247.338 2.477 20 0 BEADLO CC[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)[C@@H]1C ZINC001138451240 990947968 /nfs/dbraw/zinc/94/79/68/990947968.db2.gz AWYDFACGXJGTJL-WRWGMCAJSA-N 1 2 247.342 2.160 20 0 BEADLO CC[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)[C@@H]1C ZINC001138451240 990947974 /nfs/dbraw/zinc/94/79/74/990947974.db2.gz AWYDFACGXJGTJL-WRWGMCAJSA-N 1 2 247.342 2.160 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H]2CCCC[C@@H]2C)c[nH+]1 ZINC001558497329 990950063 /nfs/dbraw/zinc/95/00/63/990950063.db2.gz KDSKOXBRNUFTEC-CMPLNLGQSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H]2CCCC[C@@H]2C)[nH+]1 ZINC001558497329 990950065 /nfs/dbraw/zinc/95/00/65/990950065.db2.gz KDSKOXBRNUFTEC-CMPLNLGQSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H]2CCC[C@@H]2CC)c[nH+]1 ZINC001558497570 990956218 /nfs/dbraw/zinc/95/62/18/990956218.db2.gz UPCQXMBWDORVMU-CMPLNLGQSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H]2CCC[C@@H]2CC)[nH+]1 ZINC001558497570 990956230 /nfs/dbraw/zinc/95/62/30/990956230.db2.gz UPCQXMBWDORVMU-CMPLNLGQSA-N 1 2 249.358 2.415 20 0 BEADLO COc1ccc(C)cc1C[N@H+](C)C1(C)COC1 ZINC001138487919 990960244 /nfs/dbraw/zinc/96/02/44/990960244.db2.gz PDGZRSNZACSYAW-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO COc1ccc(C)cc1C[N@@H+](C)C1(C)COC1 ZINC001138487919 990960256 /nfs/dbraw/zinc/96/02/56/990960256.db2.gz PDGZRSNZACSYAW-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO CCCCC(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001558560157 990965818 /nfs/dbraw/zinc/96/58/18/990965818.db2.gz FNPNKDYTMDGZCW-UHFFFAOYSA-N 1 2 223.320 2.340 20 0 BEADLO CCCCC(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001558560157 990965823 /nfs/dbraw/zinc/96/58/23/990965823.db2.gz FNPNKDYTMDGZCW-UHFFFAOYSA-N 1 2 223.320 2.340 20 0 BEADLO C[C@H]1C[C@@H]([NH2+]Cc2ccc(F)nc2)c2nccn21 ZINC001308404551 990982818 /nfs/dbraw/zinc/98/28/18/990982818.db2.gz YYWVTQCVLCMTER-GXSJLCMTSA-N 1 2 246.289 2.213 20 0 BEADLO Cc1ccc2[nH+]c(NCc3cn(C)cn3)[nH]c2c1 ZINC001308501542 991009897 /nfs/dbraw/zinc/00/98/97/991009897.db2.gz OCWPIRTYUPDORG-UHFFFAOYSA-N 1 2 241.298 2.217 20 0 BEADLO CNc1ccccc1C[N@@H+]1CCc2c[nH]nc2C1 ZINC001308608235 991059047 /nfs/dbraw/zinc/05/90/47/991059047.db2.gz COFCOCWDIQTBKB-UHFFFAOYSA-N 1 2 242.326 2.010 20 0 BEADLO CNc1ccccc1C[N@H+]1CCc2c[nH]nc2C1 ZINC001308608235 991059057 /nfs/dbraw/zinc/05/90/57/991059057.db2.gz COFCOCWDIQTBKB-UHFFFAOYSA-N 1 2 242.326 2.010 20 0 BEADLO Cc1cc(C[N@@H+]2CCCC[C@@H](F)C2)nn1C ZINC001138826642 991079754 /nfs/dbraw/zinc/07/97/54/991079754.db2.gz KZOCFLYGBRAKAO-LLVKDONJSA-N 1 2 225.311 2.053 20 0 BEADLO Cc1cc(C[N@H+]2CCCC[C@@H](F)C2)nn1C ZINC001138826642 991079762 /nfs/dbraw/zinc/07/97/62/991079762.db2.gz KZOCFLYGBRAKAO-LLVKDONJSA-N 1 2 225.311 2.053 20 0 BEADLO CCCn1c[nH+]cc1CN(CC)CC(F)F ZINC001308671900 991090440 /nfs/dbraw/zinc/09/04/40/991090440.db2.gz FDKWKFIDMAGLIT-UHFFFAOYSA-N 1 2 231.290 2.380 20 0 BEADLO CO[C@@H]1CC[N@H+](Cc2cc(F)cnc2Cl)C1 ZINC001138891034 991093068 /nfs/dbraw/zinc/09/30/68/991093068.db2.gz LFQUBECWVTUPHL-SNVBAGLBSA-N 1 2 244.697 2.095 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2cc(F)cnc2Cl)C1 ZINC001138891034 991093076 /nfs/dbraw/zinc/09/30/76/991093076.db2.gz LFQUBECWVTUPHL-SNVBAGLBSA-N 1 2 244.697 2.095 20 0 BEADLO Cc1[nH+]cc2n1CCN([C@H](C)Cc1ccco1)C2 ZINC001258186921 991095919 /nfs/dbraw/zinc/09/59/19/991095919.db2.gz AWLHLJJSVIWPON-LLVKDONJSA-N 1 2 245.326 2.231 20 0 BEADLO CSCC[C@H](C)[N@@H+]1CCC(F)(F)C1 ZINC001258212826 991132110 /nfs/dbraw/zinc/13/21/10/991132110.db2.gz JSDXHBXNEWZCGY-QMMMGPOBSA-N 1 2 209.305 2.469 20 0 BEADLO CSCC[C@H](C)[N@H+]1CCC(F)(F)C1 ZINC001258212826 991132120 /nfs/dbraw/zinc/13/21/20/991132120.db2.gz JSDXHBXNEWZCGY-QMMMGPOBSA-N 1 2 209.305 2.469 20 0 BEADLO COC1C[NH+](Cc2ccc3cccnc3c2)C1 ZINC001139164547 991170168 /nfs/dbraw/zinc/17/01/68/991170168.db2.gz IWZLKZPWVZQTMY-UHFFFAOYSA-N 1 2 228.295 2.065 20 0 BEADLO Cn1ccc2cc(C[N@@H+]3CCO[C@H]4C[C@H]43)ccc21 ZINC001139192442 991184605 /nfs/dbraw/zinc/18/46/05/991184605.db2.gz LJJNPMVAQXWFKU-CABCVRRESA-N 1 2 242.322 2.151 20 0 BEADLO Cn1ccc2cc(C[N@H+]3CCO[C@H]4C[C@H]43)ccc21 ZINC001139192442 991184612 /nfs/dbraw/zinc/18/46/12/991184612.db2.gz LJJNPMVAQXWFKU-CABCVRRESA-N 1 2 242.322 2.151 20 0 BEADLO CC(C)c1ccc(NC(=O)NC2C[NH+](C)C2)cc1 ZINC001202926295 991228790 /nfs/dbraw/zinc/22/87/90/991228790.db2.gz XMNLOXXINCYERM-UHFFFAOYSA-N 1 2 247.342 2.246 20 0 BEADLO CC(C)CCc1nnc([C@H](C)[NH+](C)C)o1 ZINC001258301884 991234514 /nfs/dbraw/zinc/23/45/14/991234514.db2.gz NVSOQHPDYBRGQC-VIFPVBQESA-N 1 2 211.309 2.281 20 0 BEADLO CCOC(=O)C[NH2+][C@H](C)CC(C)(C)SC ZINC001258328148 991238986 /nfs/dbraw/zinc/23/89/86/991238986.db2.gz VVPVQQPNCFEMMY-SECBINFHSA-N 1 2 233.377 2.059 20 0 BEADLO CCOC(=O)C[NH2+][C@@H](C)CC(C)(C)SC ZINC001258328149 991240320 /nfs/dbraw/zinc/24/03/20/991240320.db2.gz VVPVQQPNCFEMMY-VIFPVBQESA-N 1 2 233.377 2.059 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H](C)CC(C)(C)SC ZINC001258321852 991245971 /nfs/dbraw/zinc/24/59/71/991245971.db2.gz SCAASVMREKLFIA-IUCAKERBSA-N 1 2 233.377 2.058 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@@H](C)CC(C)(C)SC ZINC001258321502 991246351 /nfs/dbraw/zinc/24/63/51/991246351.db2.gz MYNQCRDQYCXHTB-UWVGGRQHSA-N 1 2 247.404 2.448 20 0 BEADLO CSC(C)(C)C[C@@H](C)[N@@H+]1CCC(=O)C1 ZINC001258341059 991269824 /nfs/dbraw/zinc/26/98/24/991269824.db2.gz JDAALKQPGYHFBI-SECBINFHSA-N 1 2 215.362 2.181 20 0 BEADLO CSC(C)(C)C[C@@H](C)[N@H+]1CCC(=O)C1 ZINC001258341059 991269841 /nfs/dbraw/zinc/26/98/41/991269841.db2.gz JDAALKQPGYHFBI-SECBINFHSA-N 1 2 215.362 2.181 20 0 BEADLO C[C@H]1CC[N@@H+]1Cc1cn2c(cccc2F)n1 ZINC001139571416 991278754 /nfs/dbraw/zinc/27/87/54/991278754.db2.gz XLEZJBVTIAGYQR-VIFPVBQESA-N 1 2 219.263 2.068 20 0 BEADLO C[C@H]1CC[N@H+]1Cc1cn2c(cccc2F)n1 ZINC001139571416 991278763 /nfs/dbraw/zinc/27/87/63/991278763.db2.gz XLEZJBVTIAGYQR-VIFPVBQESA-N 1 2 219.263 2.068 20 0 BEADLO COc1ccncc1C[N@@H+]1C[C@@H](F)C[C@H]1C ZINC001139606209 991288068 /nfs/dbraw/zinc/28/80/68/991288068.db2.gz FOHLASTUXOZYKF-KOLCDFICSA-N 1 2 224.279 2.023 20 0 BEADLO COc1ccncc1C[N@H+]1C[C@@H](F)C[C@H]1C ZINC001139606209 991288077 /nfs/dbraw/zinc/28/80/77/991288077.db2.gz FOHLASTUXOZYKF-KOLCDFICSA-N 1 2 224.279 2.023 20 0 BEADLO CCOc1ccncc1C[NH+]1CCSCC1 ZINC001139625592 991294233 /nfs/dbraw/zinc/29/42/33/991294233.db2.gz AFKQTOOFTDJUDC-UHFFFAOYSA-N 1 2 238.356 2.029 20 0 BEADLO COc1ncc(C[N@@H+]2C[C@@H](C)C[C@H]2CF)s1 ZINC001139814821 991380635 /nfs/dbraw/zinc/38/06/35/991380635.db2.gz NXTWZRNDKOWPMX-IUCAKERBSA-N 1 2 244.335 2.332 20 0 BEADLO COc1ncc(C[N@H+]2C[C@@H](C)C[C@H]2CF)s1 ZINC001139814821 991380640 /nfs/dbraw/zinc/38/06/40/991380640.db2.gz NXTWZRNDKOWPMX-IUCAKERBSA-N 1 2 244.335 2.332 20 0 BEADLO CCCCC[C@H](CC)[N@@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001258442954 991382892 /nfs/dbraw/zinc/38/28/92/991382892.db2.gz IBKDJWJNDDKBIE-SRVKXCTJSA-N 1 2 225.332 2.345 20 0 BEADLO CCCCC[C@H](CC)[N@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001258442954 991382900 /nfs/dbraw/zinc/38/29/00/991382900.db2.gz IBKDJWJNDDKBIE-SRVKXCTJSA-N 1 2 225.332 2.345 20 0 BEADLO C[N@H+](Cc1ccsc1)Cc1cccnn1 ZINC001139970755 991438379 /nfs/dbraw/zinc/43/83/79/991438379.db2.gz FMSDRGDGSHPMGS-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO C[N@@H+](Cc1ccsc1)Cc1cccnn1 ZINC001139970755 991438383 /nfs/dbraw/zinc/43/83/83/991438383.db2.gz FMSDRGDGSHPMGS-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO Cc1n[nH]c(C)c1C[NH2+]Cc1ccn(C(C)C)n1 ZINC001560342292 991457089 /nfs/dbraw/zinc/45/70/89/991457089.db2.gz NJDGCRJKRBOMSW-UHFFFAOYSA-N 1 2 247.346 2.094 20 0 BEADLO F[C@@H]1C[C@@H]2C[C@H]1C[N@@H+]2Cc1cnc(Cl)nc1 ZINC001139990183 991470543 /nfs/dbraw/zinc/47/05/43/991470543.db2.gz KFQYKZHCDKIASC-LPEHRKFASA-N 1 2 241.697 2.062 20 0 BEADLO F[C@@H]1C[C@@H]2C[C@H]1C[N@H+]2Cc1cnc(Cl)nc1 ZINC001139990183 991470546 /nfs/dbraw/zinc/47/05/46/991470546.db2.gz KFQYKZHCDKIASC-LPEHRKFASA-N 1 2 241.697 2.062 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2ncnn2C)cs1 ZINC001560462593 991480198 /nfs/dbraw/zinc/48/01/98/991480198.db2.gz PWHFFEOUVOQAJX-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO CC1(C)CC[C@H]([NH+]2CC(O)(C(F)(F)F)C2)C1 ZINC001258601795 991509520 /nfs/dbraw/zinc/50/95/20/991509520.db2.gz FCDKFOPYEZHGIS-QMMMGPOBSA-N 1 2 237.265 2.174 20 0 BEADLO COc1ccc2[nH]nc(C[N@H+](C)C3CC3)c2c1 ZINC001140065998 991512725 /nfs/dbraw/zinc/51/27/25/991512725.db2.gz PHZYXSHQZXMGTO-UHFFFAOYSA-N 1 2 231.299 2.166 20 0 BEADLO COc1ccc2[nH]nc(C[N@@H+](C)C3CC3)c2c1 ZINC001140065998 991512736 /nfs/dbraw/zinc/51/27/36/991512736.db2.gz PHZYXSHQZXMGTO-UHFFFAOYSA-N 1 2 231.299 2.166 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@H]3CCCC[C@H]3C2)no1 ZINC001317881941 991592076 /nfs/dbraw/zinc/59/20/76/991592076.db2.gz YFYIYGFFMCHDRR-NEPJUHHUSA-N 1 2 235.331 2.390 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@H]3CCCC[C@H]3C2)no1 ZINC001317881941 991592088 /nfs/dbraw/zinc/59/20/88/991592088.db2.gz YFYIYGFFMCHDRR-NEPJUHHUSA-N 1 2 235.331 2.390 20 0 BEADLO Oc1cnccc1C[N@@H+]1Cc2ccc(F)cc2C1 ZINC001140276597 991594062 /nfs/dbraw/zinc/59/40/62/991594062.db2.gz HJLLXIPKEXUZKZ-UHFFFAOYSA-N 1 2 244.269 2.442 20 0 BEADLO Oc1cnccc1C[N@H+]1Cc2ccc(F)cc2C1 ZINC001140276597 991594071 /nfs/dbraw/zinc/59/40/71/991594071.db2.gz HJLLXIPKEXUZKZ-UHFFFAOYSA-N 1 2 244.269 2.442 20 0 BEADLO C[C@@H](N(C)C(=O)[C@H](C)n1cc[nH+]c1)C(C)(C)C ZINC001317998788 991608093 /nfs/dbraw/zinc/60/80/93/991608093.db2.gz OQHBWIUSZXDGPQ-WDEREUQCSA-N 1 2 237.347 2.337 20 0 BEADLO Nc1[nH+]cccc1CN1CCc2cccc(F)c21 ZINC001560814687 991609660 /nfs/dbraw/zinc/60/96/60/991609660.db2.gz FTAAPBKLDBGHAK-UHFFFAOYSA-N 1 2 243.285 2.366 20 0 BEADLO Cc1ccc2[nH]nc(C[NH+]3CCSCC3)c2c1 ZINC001140329522 991611761 /nfs/dbraw/zinc/61/17/61/991611761.db2.gz ZRFCJVWLBYFODT-UHFFFAOYSA-N 1 2 247.367 2.420 20 0 BEADLO Fc1ccc2c(c1)C[N@@H+](Cc1ccncn1)CC2 ZINC001140348099 991619928 /nfs/dbraw/zinc/61/99/28/991619928.db2.gz KCMRRDXZSGRCPZ-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1ccc2c(c1)C[N@H+](Cc1ccncn1)CC2 ZINC001140348099 991619930 /nfs/dbraw/zinc/61/99/30/991619930.db2.gz KCMRRDXZSGRCPZ-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO CC(C)C[C@@H]1CCCN1C(=O)[C@H](C)n1cc[nH+]c1 ZINC001318080654 991621479 /nfs/dbraw/zinc/62/14/79/991621479.db2.gz RUSFCLHNLVONKM-STQMWFEESA-N 1 2 249.358 2.481 20 0 BEADLO C[N@H+](Cc1ccon1)Cc1ccc2n[nH]cc2c1 ZINC001140385826 991632007 /nfs/dbraw/zinc/63/20/07/991632007.db2.gz HZDGQBGLNHWWQW-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO C[N@@H+](Cc1ccon1)Cc1ccc2n[nH]cc2c1 ZINC001140385826 991632013 /nfs/dbraw/zinc/63/20/13/991632013.db2.gz HZDGQBGLNHWWQW-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO Cc1ccc(Cl)nc1C[N@H+](C)CCF ZINC001140448049 991641032 /nfs/dbraw/zinc/64/10/32/991641032.db2.gz DHKPWKONDWPJJA-UHFFFAOYSA-N 1 2 216.687 2.445 20 0 BEADLO Cc1ccc(Cl)nc1C[N@@H+](C)CCF ZINC001140448049 991641042 /nfs/dbraw/zinc/64/10/42/991641042.db2.gz DHKPWKONDWPJJA-UHFFFAOYSA-N 1 2 216.687 2.445 20 0 BEADLO OC[C@@H]1CCC[N@@H+]1Cc1c(F)cc(F)cc1F ZINC001140530001 991661291 /nfs/dbraw/zinc/66/12/91/991661291.db2.gz LPBRZASEHJAZAT-VIFPVBQESA-N 1 2 245.244 2.061 20 0 BEADLO OC[C@@H]1CCC[N@H+]1Cc1c(F)cc(F)cc1F ZINC001140530001 991661294 /nfs/dbraw/zinc/66/12/94/991661294.db2.gz LPBRZASEHJAZAT-VIFPVBQESA-N 1 2 245.244 2.061 20 0 BEADLO Cc1cn2cc(NC(=O)NC3(C)CC3)ccc2[nH+]1 ZINC001318647991 991692390 /nfs/dbraw/zinc/69/23/90/991692390.db2.gz YKBNATRZGXSHEP-UHFFFAOYSA-N 1 2 244.298 2.317 20 0 BEADLO C[C@@H](C(=O)NCCCC(C)(C)C)n1cc[nH+]c1 ZINC001318648188 991692614 /nfs/dbraw/zinc/69/26/14/991692614.db2.gz BPNBPXSLKOSSBS-NSHDSACASA-N 1 2 237.347 2.387 20 0 BEADLO C[C@H](Cc1cccc(Cl)c1)[NH+]1CC(C)(O)C1 ZINC001258744703 991694329 /nfs/dbraw/zinc/69/43/29/991694329.db2.gz FCBUJYKDGASGKB-SNVBAGLBSA-N 1 2 239.746 2.338 20 0 BEADLO CCCC[C@@H](CCC)[N@@H+]1CCOC(=O)C1 ZINC001258766699 991725909 /nfs/dbraw/zinc/72/59/09/991725909.db2.gz MWRUIUXETHMAJN-LLVKDONJSA-N 1 2 213.321 2.204 20 0 BEADLO CCCC[C@@H](CCC)[N@H+]1CCOC(=O)C1 ZINC001258766699 991725920 /nfs/dbraw/zinc/72/59/20/991725920.db2.gz MWRUIUXETHMAJN-LLVKDONJSA-N 1 2 213.321 2.204 20 0 BEADLO C[C@H](C(=O)N1CC(C)(C)C1(C)C)n1cc[nH+]c1 ZINC001318921795 991737879 /nfs/dbraw/zinc/73/78/79/991737879.db2.gz WJUYVDCMVXGYRO-SNVBAGLBSA-N 1 2 235.331 2.091 20 0 BEADLO CC(C)C1CCC([N@@H+]2CCC(=O)C2)CC1 ZINC001258803881 991801770 /nfs/dbraw/zinc/80/17/70/991801770.db2.gz LKBWUHVEHXMECD-UHFFFAOYSA-N 1 2 209.333 2.476 20 0 BEADLO CC(C)C1CCC([N@H+]2CCC(=O)C2)CC1 ZINC001258803881 991801771 /nfs/dbraw/zinc/80/17/71/991801771.db2.gz LKBWUHVEHXMECD-UHFFFAOYSA-N 1 2 209.333 2.476 20 0 BEADLO CCOc1ccc2c(c1)C[N@@H+](CCF)CC2 ZINC001319314584 991837654 /nfs/dbraw/zinc/83/76/54/991837654.db2.gz IVLOAWPLYOFAJE-UHFFFAOYSA-N 1 2 223.291 2.413 20 0 BEADLO CCOc1ccc2c(c1)C[N@H+](CCF)CC2 ZINC001319314584 991837658 /nfs/dbraw/zinc/83/76/58/991837658.db2.gz IVLOAWPLYOFAJE-UHFFFAOYSA-N 1 2 223.291 2.413 20 0 BEADLO C[C@@H]1CCC[C@@H]([N@@H+]2CC[C@@H](O)C(F)(F)C2)C1 ZINC001258826334 991851353 /nfs/dbraw/zinc/85/13/53/991851353.db2.gz JBFJSJDGUQLRTR-GMTAPVOTSA-N 1 2 233.302 2.267 20 0 BEADLO C[C@@H]1CCC[C@@H]([N@H+]2CC[C@@H](O)C(F)(F)C2)C1 ZINC001258826334 991851358 /nfs/dbraw/zinc/85/13/58/991851358.db2.gz JBFJSJDGUQLRTR-GMTAPVOTSA-N 1 2 233.302 2.267 20 0 BEADLO COc1ccccc1C[C@@H](C)[NH+]1CCC(=O)CC1 ZINC001258888538 991891384 /nfs/dbraw/zinc/89/13/84/991891384.db2.gz LRGRPQKRWZDSLP-GFCCVEGCSA-N 1 2 247.338 2.291 20 0 BEADLO C[C@@H](C(=O)N[C@H]1CC12CCCCC2)n1cc[nH+]c1 ZINC001319864701 992012824 /nfs/dbraw/zinc/01/28/24/992012824.db2.gz AANJQGIXNOBUDA-RYUDHWBXSA-N 1 2 247.342 2.283 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1cc(O)c(C)cc1C ZINC001567325844 992014241 /nfs/dbraw/zinc/01/42/41/992014241.db2.gz ONPCMTICXJAYDY-LBPRGKRZSA-N 1 2 248.326 2.042 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1cc(O)c(C)cc1C ZINC001567325844 992014247 /nfs/dbraw/zinc/01/42/47/992014247.db2.gz ONPCMTICXJAYDY-LBPRGKRZSA-N 1 2 248.326 2.042 20 0 BEADLO C[C@H](C(=O)N[C@H]1CC12CCCCC2)n1cc[nH+]c1 ZINC001319864699 992014662 /nfs/dbraw/zinc/01/46/62/992014662.db2.gz AANJQGIXNOBUDA-NEPJUHHUSA-N 1 2 247.342 2.283 20 0 BEADLO Cc1cccnc1C[NH2+][C@@H]1CCCc2cn[nH]c21 ZINC001320026504 992075691 /nfs/dbraw/zinc/07/56/91/992075691.db2.gz PXIJHSKMBXLXPD-GFCCVEGCSA-N 1 2 242.326 2.280 20 0 BEADLO Cc1cccnc1C[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC001320026504 992075698 /nfs/dbraw/zinc/07/56/98/992075698.db2.gz PXIJHSKMBXLXPD-GFCCVEGCSA-N 1 2 242.326 2.280 20 0 BEADLO Cc1cccnc1C[NH2+][C@H]1CCCc2cn[nH]c21 ZINC001320026505 992078604 /nfs/dbraw/zinc/07/86/04/992078604.db2.gz PXIJHSKMBXLXPD-LBPRGKRZSA-N 1 2 242.326 2.280 20 0 BEADLO Cc1cccnc1C[NH2+][C@H]1CCCc2c[nH]nc21 ZINC001320026505 992078616 /nfs/dbraw/zinc/07/86/16/992078616.db2.gz PXIJHSKMBXLXPD-LBPRGKRZSA-N 1 2 242.326 2.280 20 0 BEADLO C[C@@H](C(=O)NC1(C)CCCCC1)n1cc[nH+]c1 ZINC001320178578 992121430 /nfs/dbraw/zinc/12/14/30/992121430.db2.gz CLCZRKGMSWGFBB-NSHDSACASA-N 1 2 235.331 2.283 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1c(C)cccc1OC ZINC001568280437 992155915 /nfs/dbraw/zinc/15/59/15/992155915.db2.gz TUSCFSSPGIDEPZ-LLVKDONJSA-N 1 2 248.326 2.036 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1c(C)cccc1OC ZINC001568280437 992155922 /nfs/dbraw/zinc/15/59/22/992155922.db2.gz TUSCFSSPGIDEPZ-LLVKDONJSA-N 1 2 248.326 2.036 20 0 BEADLO C[C@@H](C(=O)N1CCC2(CCC2)CC1)n1cc[nH+]c1 ZINC001261115657 992180529 /nfs/dbraw/zinc/18/05/29/992180529.db2.gz IKQUBNAVUIISLB-LBPRGKRZSA-N 1 2 247.342 2.237 20 0 BEADLO CCC[C@H](CC)NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001320385498 992189212 /nfs/dbraw/zinc/18/92/12/992189212.db2.gz HEDZTCMYHZWWOK-QWRGUYRKSA-N 1 2 223.320 2.139 20 0 BEADLO C[C@@H](C(=O)N1CCCC[C@H](C)C1)n1cc[nH+]c1 ZINC001320404264 992195773 /nfs/dbraw/zinc/19/57/73/992195773.db2.gz UDSFGIUSOJFEFY-RYUDHWBXSA-N 1 2 235.331 2.093 20 0 BEADLO CCc1ccncc1NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001261526679 992368436 /nfs/dbraw/zinc/36/84/36/992368436.db2.gz REQWVZLYYUKPSR-SNVBAGLBSA-N 1 2 244.298 2.040 20 0 BEADLO CCCc1ccn(Cc2ccc(N(C)C)[nH+]c2)n1 ZINC001262159020 992716021 /nfs/dbraw/zinc/71/60/21/992716021.db2.gz GLPMYEGJDGABPJ-UHFFFAOYSA-N 1 2 244.342 2.345 20 0 BEADLO COC(=O)c1sccc1C[NH2+]C(C)(C)CF ZINC001262364840 992859871 /nfs/dbraw/zinc/85/98/71/992859871.db2.gz KHGDRNDDGGFJPS-UHFFFAOYSA-N 1 2 245.319 2.372 20 0 BEADLO CCC[C@H]1CCCN1C(=O)CCc1c[nH]c[nH+]1 ZINC001262646501 992996927 /nfs/dbraw/zinc/99/69/27/992996927.db2.gz DYHXGTINEKOJNQ-LBPRGKRZSA-N 1 2 235.331 2.133 20 0 BEADLO CCC[C@H]1CCCN1C(=O)CCc1c[nH+]c[nH]1 ZINC001262646501 992996936 /nfs/dbraw/zinc/99/69/36/992996936.db2.gz DYHXGTINEKOJNQ-LBPRGKRZSA-N 1 2 235.331 2.133 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@@H]([C@@H](C)O)C2)[nH+]1 ZINC001262688399 993028999 /nfs/dbraw/zinc/02/89/99/993028999.db2.gz PNKIEYFRYHZEGD-GHMZBOCLSA-N 1 2 238.306 2.126 20 0 BEADLO Cc1cc(F)cc(N2CCC(C)(CO)CC2)[nH+]1 ZINC001262690466 993034017 /nfs/dbraw/zinc/03/40/17/993034017.db2.gz BVBOXWDKLIHFDE-UHFFFAOYSA-N 1 2 238.306 2.128 20 0 BEADLO CC(C)COC1C[NH+](Cc2sccc2N)C1 ZINC001575612075 993083751 /nfs/dbraw/zinc/08/37/51/993083751.db2.gz FWQHIYKOSXJJEF-UHFFFAOYSA-N 1 2 240.372 2.187 20 0 BEADLO C[C@@H]1CCC[C@H](C)N(C(=O)C[C@H]([NH3+])C(F)F)C1 ZINC001263085653 993105801 /nfs/dbraw/zinc/10/58/01/993105801.db2.gz HZXXCRCNQYXWJZ-UTLUCORTSA-N 1 2 248.317 2.006 20 0 BEADLO CC[C@H](F)C(=O)OCc1cccc2[nH+]ccn21 ZINC001263416194 993292226 /nfs/dbraw/zinc/29/22/26/993292226.db2.gz ZKYJEGSFSOWXID-JTQLQIEISA-N 1 2 236.246 2.126 20 0 BEADLO Cc1ncc(CNc2cc[nH+]cc2F)s1 ZINC000379929388 993298148 /nfs/dbraw/zinc/29/81/48/993298148.db2.gz NKVCTKQXBFEZSN-UHFFFAOYSA-N 1 2 223.276 2.020 20 0 BEADLO O=C(CC1CC1)OCCc1cn2c([nH+]1)CCCC2 ZINC001263500378 993344789 /nfs/dbraw/zinc/34/47/89/993344789.db2.gz HYUAHOOFUDAGFX-UHFFFAOYSA-N 1 2 248.326 2.105 20 0 BEADLO Cn1c[nH+]cc1CCCOC(=O)C1=CCCCC1 ZINC001263510631 993354575 /nfs/dbraw/zinc/35/45/75/993354575.db2.gz JIDQDXBGYKKHSS-UHFFFAOYSA-N 1 2 248.326 2.396 20 0 BEADLO CCn1c[nH+]cc1COC(=O)CCc1ccoc1 ZINC001263663192 993455078 /nfs/dbraw/zinc/45/50/78/993455078.db2.gz WXACBRJKSMAIMV-UHFFFAOYSA-N 1 2 248.282 2.172 20 0 BEADLO Cc1ccnc(C[NH2+][C@@H]2C[C@H](C)n3ccnc32)c1 ZINC000385979379 993675596 /nfs/dbraw/zinc/67/55/96/993675596.db2.gz NWYYTBWSTFVRQS-WCQYABFASA-N 1 2 242.326 2.382 20 0 BEADLO CN(C)c1ccc(Nc2ccc(C#N)nc2)c[nH+]1 ZINC000387176148 993701519 /nfs/dbraw/zinc/70/15/19/993701519.db2.gz CKGOEYTZHVUENO-UHFFFAOYSA-N 1 2 239.282 2.158 20 0 BEADLO Cc1[nH]c(CNC(=O)c2ccccc2F)[nH+]c1C ZINC001294514710 994703381 /nfs/dbraw/zinc/70/33/81/994703381.db2.gz CJRDJXDLROXUFC-UHFFFAOYSA-N 1 2 247.273 2.096 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1cccc(OC)c1C ZINC001300815831 995058851 /nfs/dbraw/zinc/05/88/51/995058851.db2.gz KZFGSOUXBDMHKJ-GFCCVEGCSA-N 1 2 248.326 2.036 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1cccc(OC)c1C ZINC001300815831 995058858 /nfs/dbraw/zinc/05/88/58/995058858.db2.gz KZFGSOUXBDMHKJ-GFCCVEGCSA-N 1 2 248.326 2.036 20 0 BEADLO CCc1ccc(N2CC[C@H](n3cccn3)C2)[nH+]c1 ZINC001337179086 995150125 /nfs/dbraw/zinc/15/01/25/995150125.db2.gz KTVORQDJCMYTSD-ZDUSSCGKSA-N 1 2 242.326 2.292 20 0 BEADLO CCc1cn(CC(=O)C(C)(C)CC)c[nH+]1 ZINC001307397861 995344046 /nfs/dbraw/zinc/34/40/46/995344046.db2.gz WUVPQIMHCJHAER-UHFFFAOYSA-N 1 2 208.305 2.451 20 0 BEADLO CCO[C@@H](Cn1c[nH+]c(CC)c1)C1CC1 ZINC001307397829 995344262 /nfs/dbraw/zinc/34/42/62/995344262.db2.gz WAYXZKNFKSVSFI-LBPRGKRZSA-N 1 2 208.305 2.261 20 0 BEADLO Cc1[nH]c(CN2CCC(=O)CC23CCC3)[nH+]c1C ZINC001307868744 995490727 /nfs/dbraw/zinc/49/07/27/995490727.db2.gz ZMSJPYXBJLGPHI-UHFFFAOYSA-N 1 2 247.342 2.114 20 0 BEADLO CCC[C@H](O)C[N@@H+]1CC(F)(F)CC[C@H]1C ZINC001308155094 995573524 /nfs/dbraw/zinc/57/35/24/995573524.db2.gz XJSOGNIUPKGMGV-ZJUUUORDSA-N 1 2 221.291 2.267 20 0 BEADLO CCC[C@H](O)C[N@H+]1CC(F)(F)CC[C@H]1C ZINC001308155094 995573531 /nfs/dbraw/zinc/57/35/31/995573531.db2.gz XJSOGNIUPKGMGV-ZJUUUORDSA-N 1 2 221.291 2.267 20 0 BEADLO Cc1cc(NCCc2cc[nH]n2)nc(C2CC2)[nH+]1 ZINC001515955314 1170059619 /nfs/dbraw/zinc/05/96/19/1170059619.db2.gz DSTFIQWIVVNSCF-UHFFFAOYSA-N 1 2 243.314 2.040 20 0 BEADLO COc1cc(Nc2ccc(N)[nH+]c2)cc(OC)c1 ZINC000020585254 1170127167 /nfs/dbraw/zinc/12/71/67/1170127167.db2.gz WDLFDDAODLPMHY-UHFFFAOYSA-N 1 2 245.282 2.425 20 0 BEADLO CCCCCC[C@H](C)[NH2+]CC(=O)OC ZINC000020359852 1170153172 /nfs/dbraw/zinc/15/31/72/1170153172.db2.gz PNACULLZQVYZME-JTQLQIEISA-N 1 2 201.310 2.108 20 0 BEADLO Cc1occc1C[NH2+][C@@H](c1nncn1C)C(C)C ZINC001620932003 1170168298 /nfs/dbraw/zinc/16/82/98/1170168298.db2.gz UHBRWECIUIYREI-GFCCVEGCSA-N 1 2 248.330 2.203 20 0 BEADLO OCc1ccc(CNc2cc3cc[nH]c3c[nH+]2)o1 ZINC001620987670 1170180311 /nfs/dbraw/zinc/18/03/11/1170180311.db2.gz CMUBHJFHGUHCLV-UHFFFAOYSA-N 1 2 243.266 2.260 20 0 BEADLO CCc1cn(CC(=O)Nc2cccc(C)c2)c[nH+]1 ZINC001614960016 1170500184 /nfs/dbraw/zinc/50/01/84/1170500184.db2.gz JKBRGNAYAQDRNA-UHFFFAOYSA-N 1 2 243.310 2.393 20 0 BEADLO CCc1cn(CCOC2CCSCC2)c[nH+]1 ZINC001614966525 1170503561 /nfs/dbraw/zinc/50/35/61/1170503561.db2.gz MJEOKIGXNSGLOZ-UHFFFAOYSA-N 1 2 240.372 2.358 20 0 BEADLO Cc1ccc([C@@H]2CC[N@H+](Cc3nnc[nH]3)C2)cc1 ZINC001617146899 1170581191 /nfs/dbraw/zinc/58/11/91/1170581191.db2.gz MFKBBWJKRUJCQW-CYBMUJFWSA-N 1 2 242.326 2.103 20 0 BEADLO Cc1ccc([C@@H]2CC[N@@H+](Cc3nnc[nH]3)C2)cc1 ZINC001617146899 1170581194 /nfs/dbraw/zinc/58/11/94/1170581194.db2.gz MFKBBWJKRUJCQW-CYBMUJFWSA-N 1 2 242.326 2.103 20 0 BEADLO CC[C@@H]1CCCN(C(=O)Cc2[nH]c[nH+]c2C)CC1 ZINC001617165218 1170581667 /nfs/dbraw/zinc/58/16/67/1170581667.db2.gz QOWJYOHJBMAHST-GFCCVEGCSA-N 1 2 249.358 2.299 20 0 BEADLO C[C@@H]1CN(C(=O)c2cccc3[nH+]ccn32)C[C@H]1C ZINC001618560482 1170642247 /nfs/dbraw/zinc/64/22/47/1170642247.db2.gz LXFXRQQFITVFPY-GHMZBOCLSA-N 1 2 243.310 2.062 20 0 BEADLO CCOCC[N@@H+]1CCCC[C@@H]1c1cc(C)[nH]n1 ZINC001620614999 1170687482 /nfs/dbraw/zinc/68/74/82/1170687482.db2.gz IUPCPKYNSCXLAX-CYBMUJFWSA-N 1 2 237.347 2.282 20 0 BEADLO CCOCC[N@H+]1CCCC[C@@H]1c1cc(C)[nH]n1 ZINC001620614999 1170687489 /nfs/dbraw/zinc/68/74/89/1170687489.db2.gz IUPCPKYNSCXLAX-CYBMUJFWSA-N 1 2 237.347 2.282 20 0 BEADLO Cc1ccc(CC[NH+]2CC(OC(F)F)C2)cc1 ZINC001621380915 1170790821 /nfs/dbraw/zinc/79/08/21/1170790821.db2.gz JFRUNOXXGKFGAZ-UHFFFAOYSA-N 1 2 241.281 2.461 20 0 BEADLO Fc1cccnc1C[NH+]1CC(Cc2ccoc2)C1 ZINC001621555037 1170847938 /nfs/dbraw/zinc/84/79/38/1170847938.db2.gz QEZRXWQWGOVKGX-UHFFFAOYSA-N 1 2 246.285 2.488 20 0 BEADLO CCCOC(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001622611555 1170894434 /nfs/dbraw/zinc/89/44/34/1170894434.db2.gz SDMJLPSNHCJVFC-UHFFFAOYSA-N 1 2 225.292 2.169 20 0 BEADLO CCCOC(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001622611555 1170894443 /nfs/dbraw/zinc/89/44/43/1170894443.db2.gz SDMJLPSNHCJVFC-UHFFFAOYSA-N 1 2 225.292 2.169 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1cc(F)ccc1C ZINC001624054569 1171001560 /nfs/dbraw/zinc/00/15/60/1171001560.db2.gz HNFVXJUKQIDZAS-LBPRGKRZSA-N 1 2 236.290 2.167 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1cc(F)ccc1C ZINC001624054569 1171001566 /nfs/dbraw/zinc/00/15/66/1171001566.db2.gz HNFVXJUKQIDZAS-LBPRGKRZSA-N 1 2 236.290 2.167 20 0 BEADLO CC(C)[C@H]1CCCCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC001624054193 1171004426 /nfs/dbraw/zinc/00/44/26/1171004426.db2.gz FOGQGBHLGUZTEO-CYBMUJFWSA-N 1 2 249.358 2.379 20 0 BEADLO CC(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC000038812732 1171082791 /nfs/dbraw/zinc/08/27/91/1171082791.db2.gz KKXFKGODTKLCRB-UHFFFAOYSA-N 1 2 215.256 2.139 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NCCC1CCCCC1 ZINC001625451001 1171102038 /nfs/dbraw/zinc/10/20/38/1171102038.db2.gz ZVVMLNCRPDTIEM-UHFFFAOYSA-N 1 2 249.358 2.347 20 0 BEADLO CCCCCCOC(=O)C[NH2+][C@H](C)CC ZINC000040952980 1171159977 /nfs/dbraw/zinc/15/99/77/1171159977.db2.gz GQZPOUBGKDGOEB-LLVKDONJSA-N 1 2 215.337 2.498 20 0 BEADLO C[C@@H]1CCC[C@H](OC(=O)[C@@H]2CCCC[NH2+]2)C1 ZINC000040953451 1171159508 /nfs/dbraw/zinc/15/95/08/1171159508.db2.gz YTBDTTBTGHSCIV-WOPDTQHZSA-N 1 2 225.332 2.250 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1[C@@H](C)CCC[C@@H]1C ZINC001628457341 1171237665 /nfs/dbraw/zinc/23/76/65/1171237665.db2.gz UNPGGHWYXDYXBQ-UWVGGRQHSA-N 1 2 235.331 2.050 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1cc(C)cc(F)c1 ZINC001630048226 1171366400 /nfs/dbraw/zinc/36/64/00/1171366400.db2.gz HHUBFURZQGRBFI-LBPRGKRZSA-N 1 2 236.290 2.167 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1cc(C)cc(F)c1 ZINC001630048226 1171366402 /nfs/dbraw/zinc/36/64/02/1171366402.db2.gz HHUBFURZQGRBFI-LBPRGKRZSA-N 1 2 236.290 2.167 20 0 BEADLO CCOc1cccc(NC(=O)[C@@H]2CC[N@@H+]2CC)c1 ZINC001630609575 1171408633 /nfs/dbraw/zinc/40/86/33/1171408633.db2.gz AOWNKLNBACTDRE-ZDUSSCGKSA-N 1 2 248.326 2.118 20 0 BEADLO CCOc1cccc(NC(=O)[C@@H]2CC[N@H+]2CC)c1 ZINC001630609575 1171408639 /nfs/dbraw/zinc/40/86/39/1171408639.db2.gz AOWNKLNBACTDRE-ZDUSSCGKSA-N 1 2 248.326 2.118 20 0 BEADLO CCCCCCNC(=O)[C@@H](C)n1cc[nH+]c1 ZINC000045878979 1171464800 /nfs/dbraw/zinc/46/48/00/1171464800.db2.gz VLWLCSPEADETQE-LLVKDONJSA-N 1 2 223.320 2.141 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cccs2)CCC1=O ZINC000049693702 1171722088 /nfs/dbraw/zinc/72/20/88/1171722088.db2.gz DEEQFTYYKSAPJI-SECBINFHSA-N 1 2 209.314 2.159 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cccs2)CCC1=O ZINC000049693702 1171722094 /nfs/dbraw/zinc/72/20/94/1171722094.db2.gz DEEQFTYYKSAPJI-SECBINFHSA-N 1 2 209.314 2.159 20 0 BEADLO CCc1[nH]c(CNC(=O)C[C@@H]2CCC[C@H]2C)c[nH+]1 ZINC001635610462 1171740635 /nfs/dbraw/zinc/74/06/35/1171740635.db2.gz MQTFXOQLTXGBAH-MNOVXSKESA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)C[C@@H]2CCC[C@H]2C)[nH+]1 ZINC001635610462 1171740639 /nfs/dbraw/zinc/74/06/39/1171740639.db2.gz MQTFXOQLTXGBAH-MNOVXSKESA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@H](C)[C@@H](C)CC)c[nH+]1 ZINC001635610304 1171743002 /nfs/dbraw/zinc/74/30/02/1171743002.db2.gz GTTRTZRBPIGHBQ-VHSXEESVSA-N 1 2 237.347 2.271 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@H](C)[C@@H](C)CC)[nH+]1 ZINC001635610304 1171743015 /nfs/dbraw/zinc/74/30/15/1171743015.db2.gz GTTRTZRBPIGHBQ-VHSXEESVSA-N 1 2 237.347 2.271 20 0 BEADLO Cc1ccc(C[N@@H+]2CCOCC23CCC3)nc1 ZINC000135540928 398135566 /nfs/dbraw/zinc/13/55/66/398135566.db2.gz IEEPUBQENWWSLR-UHFFFAOYSA-N 1 2 232.327 2.145 20 0 BEADLO Cc1ccc(C[N@H+]2CCOCC23CCC3)nc1 ZINC000135540928 398135568 /nfs/dbraw/zinc/13/55/68/398135568.db2.gz IEEPUBQENWWSLR-UHFFFAOYSA-N 1 2 232.327 2.145 20 0 BEADLO C[C@@H](O)C1CCN(c2[nH]c3ccccc3[nH+]2)CC1 ZINC000230467088 398142210 /nfs/dbraw/zinc/14/22/10/398142210.db2.gz IQEQIQBIOFTBSF-SNVBAGLBSA-N 1 2 245.326 2.160 20 0 BEADLO CCC(CC)(CNc1cc[nH+]c(C)n1)OC ZINC000292433270 168326928 /nfs/dbraw/zinc/32/69/28/168326928.db2.gz XQKKRYQMTCZTOK-UHFFFAOYSA-N 1 2 223.320 2.402 20 0 BEADLO CCC[C@H](OC)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000297845801 398146846 /nfs/dbraw/zinc/14/68/46/398146846.db2.gz RQWVGBFYPVNMGK-NSHDSACASA-N 1 2 247.298 2.088 20 0 BEADLO CCC(CC)([NH2+]CCOC(C)(C)C)C(=O)OC ZINC000338380008 168331626 /nfs/dbraw/zinc/33/16/26/168331626.db2.gz RPCDVKXFCBQYGQ-UHFFFAOYSA-N 1 2 245.363 2.123 20 0 BEADLO CCC(CC)C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000120300147 168333928 /nfs/dbraw/zinc/33/39/28/168333928.db2.gz STUKYTCHUNWEQZ-UHFFFAOYSA-N 1 2 249.358 2.483 20 0 BEADLO CCCn1cc(C[NH2+][C@@H](C)C(F)F)cn1 ZINC000389913510 398148480 /nfs/dbraw/zinc/14/84/80/398148480.db2.gz LMDJFWHYCMVKGT-QMMMGPOBSA-N 1 2 217.263 2.036 20 0 BEADLO CCCC(=O)NCc1cn2cc(C)ccc2[nH+]1 ZINC000071435608 398149208 /nfs/dbraw/zinc/14/92/08/398149208.db2.gz RVJHMHVTSPAAJT-UHFFFAOYSA-N 1 2 231.299 2.059 20 0 BEADLO CCc1ncc(C[NH2+][C@H](C)C(F)F)s1 ZINC000389936647 398150829 /nfs/dbraw/zinc/15/08/29/398150829.db2.gz NHFKXVKIFCDNOU-ZCFIWIBFSA-N 1 2 220.288 2.449 20 0 BEADLO Cc1cc(C[N@@H+]2CCn3cccc3[C@H]2C)nn1C ZINC000336720068 178006080 /nfs/dbraw/zinc/00/60/80/178006080.db2.gz WGSXTSMWBKZKMY-GFCCVEGCSA-N 1 2 244.342 2.107 20 0 BEADLO Cc1cc(C[N@H+]2CCn3cccc3[C@H]2C)nn1C ZINC000336720068 178006082 /nfs/dbraw/zinc/00/60/82/178006082.db2.gz WGSXTSMWBKZKMY-GFCCVEGCSA-N 1 2 244.342 2.107 20 0 BEADLO CC[C@H]1CCCC[C@H]1NC(=O)CCn1cc[nH+]c1 ZINC000299694452 398152452 /nfs/dbraw/zinc/15/24/52/398152452.db2.gz XKJSRMMXDAEXHH-QWHCGFSZSA-N 1 2 249.358 2.358 20 0 BEADLO CCCN(CCn1cc[nH+]c1)CC(F)(F)F ZINC000677985294 488169926 /nfs/dbraw/zinc/16/99/26/488169926.db2.gz SVIAPOJNZKBWNR-UHFFFAOYSA-N 1 2 235.253 2.157 20 0 BEADLO Cc1cc(CNc2ccc(CO)c[nH+]2)ccc1F ZINC000340585087 178010067 /nfs/dbraw/zinc/01/00/67/178010067.db2.gz ZUNHBYGRNAJKCR-UHFFFAOYSA-N 1 2 246.285 2.055 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccnn2C(C)C)on1 ZINC000280310577 178028006 /nfs/dbraw/zinc/02/80/06/178028006.db2.gz OQKIWHQVADTGOB-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2cscn2)n(C)n1 ZINC000284105333 178030831 /nfs/dbraw/zinc/03/08/31/178030831.db2.gz BYQIVLZPYZRCFA-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ccccn2)no1 ZINC000044296395 178031595 /nfs/dbraw/zinc/03/15/95/178031595.db2.gz PWEQDZPJMOQGKC-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO CCC(CC)NC(=O)/C=C/c1[nH+]ccn1CC ZINC000158627043 398172152 /nfs/dbraw/zinc/17/21/52/398172152.db2.gz KRKVDCKNKOWWMH-BQYQJAHWSA-N 1 2 235.331 2.221 20 0 BEADLO Cc1cc(CNc2cc[nH+]c(C3CC3)n2)n(C)n1 ZINC000286496807 178043874 /nfs/dbraw/zinc/04/38/74/178043874.db2.gz QAWKOKHQOVZTJK-UHFFFAOYSA-N 1 2 243.314 2.008 20 0 BEADLO CCc1cc(NC2(CCO)CCCC2)nc[nH+]1 ZINC000649366718 398178803 /nfs/dbraw/zinc/17/88/03/398178803.db2.gz KIKFDSNXFFRVMU-UHFFFAOYSA-N 1 2 235.331 2.146 20 0 BEADLO Cc1cnc(C[N@@H+]2CC[C@]3(CC3(F)F)C2)nc1 ZINC000649907461 398180291 /nfs/dbraw/zinc/18/02/91/398180291.db2.gz RWAHILNQLKMBFB-NSHDSACASA-N 1 2 239.269 2.016 20 0 BEADLO Cc1cnc(C[N@H+]2CC[C@]3(CC3(F)F)C2)nc1 ZINC000649907461 398180294 /nfs/dbraw/zinc/18/02/94/398180294.db2.gz RWAHILNQLKMBFB-NSHDSACASA-N 1 2 239.269 2.016 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2CC[C@]3(CC3(F)F)C2)no1 ZINC000649908311 398184019 /nfs/dbraw/zinc/18/40/19/398184019.db2.gz LNIRGMJJHUKDPI-XVKPBYJWSA-N 1 2 243.257 2.170 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2CC[C@]3(CC3(F)F)C2)no1 ZINC000649908311 398184020 /nfs/dbraw/zinc/18/40/20/398184020.db2.gz LNIRGMJJHUKDPI-XVKPBYJWSA-N 1 2 243.257 2.170 20 0 BEADLO CC[C@@H]1CC[C@@H](C)C[C@H]1NCC(F)(F)C[NH3+] ZINC000423343911 398166552 /nfs/dbraw/zinc/16/65/52/398166552.db2.gz MHAOZFQTEUGWFI-GMTAPVOTSA-N 1 2 234.334 2.385 20 0 BEADLO Cc1cc(Cl)nc(C[NH2+]Cc2ncc[nH]2)c1 ZINC000282054707 178071833 /nfs/dbraw/zinc/07/18/33/178071833.db2.gz PPBNAGXKPYWSKQ-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO Cc1cc(Cl)nc(CNCc2[nH]cc[nH+]2)c1 ZINC000282054707 178071835 /nfs/dbraw/zinc/07/18/35/178071835.db2.gz PPBNAGXKPYWSKQ-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1ccc(F)cc1C ZINC000335391749 178081675 /nfs/dbraw/zinc/08/16/75/178081675.db2.gz XCWDXEVOLIOZMN-UHFFFAOYSA-N 1 2 247.273 2.096 20 0 BEADLO Cc1[nH]ncc1C[NH2+]Cc1ccc(F)cc1C ZINC000050577151 178086760 /nfs/dbraw/zinc/08/67/60/178086760.db2.gz OXFPLUQZJLICPX-UHFFFAOYSA-N 1 2 233.290 2.455 20 0 BEADLO Cn1c(Cl)cnc1C[NH+]1CCCCC1 ZINC000072937918 398190323 /nfs/dbraw/zinc/19/03/23/398190323.db2.gz MWHPHNGWXGVSBB-UHFFFAOYSA-N 1 2 213.712 2.059 20 0 BEADLO CC(=O)c1cccc(C[N@H+](C)Cc2cn[nH]c2)c1 ZINC000649385689 398191774 /nfs/dbraw/zinc/19/17/74/398191774.db2.gz CZCVRFVXIFOZHB-UHFFFAOYSA-N 1 2 243.310 2.244 20 0 BEADLO CC(=O)c1cccc(C[N@@H+](C)Cc2cn[nH]c2)c1 ZINC000649385689 398191780 /nfs/dbraw/zinc/19/17/80/398191780.db2.gz CZCVRFVXIFOZHB-UHFFFAOYSA-N 1 2 243.310 2.244 20 0 BEADLO CCc1cc(N[C@@H](CC)C(F)F)nc[nH+]1 ZINC000649384048 398192535 /nfs/dbraw/zinc/19/25/35/398192535.db2.gz NHLFSHFBFDKQNR-QMMMGPOBSA-N 1 2 215.247 2.495 20 0 BEADLO Cc1cc([NH+](C)C)ccc1NCc1cnccn1 ZINC000054765876 178095640 /nfs/dbraw/zinc/09/56/40/178095640.db2.gz XKROLZYCUGZRDQ-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO Cc1cc([NH+](C)C)ccc1N[C@H]1CCOC1 ZINC000070965835 178096915 /nfs/dbraw/zinc/09/69/15/178096915.db2.gz DNNXRGQXJXMHMK-NSHDSACASA-N 1 2 220.316 2.262 20 0 BEADLO Cc1cc(N(C)CCCOC(C)C)nc[nH+]1 ZINC000354342047 178098328 /nfs/dbraw/zinc/09/83/28/178098328.db2.gz VAXOIFVHTHXMCZ-UHFFFAOYSA-N 1 2 223.320 2.036 20 0 BEADLO Cc1cc(N(C)[C@@H](C)C2(C)CC2)nc[nH+]1 ZINC000301537918 178100035 /nfs/dbraw/zinc/10/00/35/178100035.db2.gz BBCFIJRXOMSSTA-JTQLQIEISA-N 1 2 205.305 2.410 20 0 BEADLO Cc1cc(N(CCO)C2CCC2)nc(C(C)C)[nH+]1 ZINC000221026534 178101874 /nfs/dbraw/zinc/10/18/74/178101874.db2.gz DIODEVYSJNZKPF-UHFFFAOYSA-N 1 2 249.358 2.260 20 0 BEADLO Cc1cc(N(CC2CC2)CC2CC2)nc[nH+]1 ZINC000301307970 178102841 /nfs/dbraw/zinc/10/28/41/178102841.db2.gz WCYLLMYUKCSDBP-UHFFFAOYSA-N 1 2 217.316 2.411 20 0 BEADLO Cc1cc(N2CCC[C@@H](O)CC2)nc(C(C)C)[nH+]1 ZINC000338837660 178115300 /nfs/dbraw/zinc/11/53/00/178115300.db2.gz RPCMEIIKTBXGCV-GFCCVEGCSA-N 1 2 249.358 2.260 20 0 BEADLO Cc1cc(N)nc(SC2CCCC2)[nH+]1 ZINC000072066556 178109640 /nfs/dbraw/zinc/10/96/40/178109640.db2.gz HKQSNDVEBSTOFZ-UHFFFAOYSA-N 1 2 209.318 2.402 20 0 BEADLO Cc1cc(N2CC(C)(C)[C@@H]2[C@H]2CCCO2)nc[nH+]1 ZINC000357594761 178111220 /nfs/dbraw/zinc/11/12/20/178111220.db2.gz LWFSFQVTFFCUPM-YPMHNXCESA-N 1 2 247.342 2.179 20 0 BEADLO Cc1cc(N2CC3(C2)CCOC3)nc(C(C)C)[nH+]1 ZINC000338837779 178111977 /nfs/dbraw/zinc/11/19/77/178111977.db2.gz JPQTWQSYRFLLDL-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO CCCc1nsc(NCc2ccc(N)[nH+]c2)n1 ZINC000292684504 398203463 /nfs/dbraw/zinc/20/34/63/398203463.db2.gz RDXMJWKXUCUUAS-UHFFFAOYSA-N 1 2 249.343 2.080 20 0 BEADLO Cc1cc(NC(=O)C=C2CCC2)cc[nH+]1 ZINC000087355229 178126866 /nfs/dbraw/zinc/12/68/66/178126866.db2.gz GAVACHOANHLOPS-UHFFFAOYSA-N 1 2 202.257 2.439 20 0 BEADLO CCC(CC)C(=O)Nc1cc[nH+]cc1O ZINC000135401352 168341635 /nfs/dbraw/zinc/34/16/35/168341635.db2.gz KDNHIBABURNGPX-UHFFFAOYSA-N 1 2 208.261 2.162 20 0 BEADLO Cc1cc(NC(=O)N2CCC[C@@H]2CF)cc[nH+]1 ZINC000297793983 178136765 /nfs/dbraw/zinc/13/67/65/178136765.db2.gz OOWKVFNFAIBQCO-LLVKDONJSA-N 1 2 237.278 2.356 20 0 BEADLO Cc1cc(NC(=O)NOCC(C)C)cc[nH+]1 ZINC000120252333 178141040 /nfs/dbraw/zinc/14/10/40/178141040.db2.gz QBEUKRSBTLFNTR-UHFFFAOYSA-N 1 2 223.276 2.099 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2CCO[C@H](C)C2)cc[nH+]1 ZINC000271550922 178141776 /nfs/dbraw/zinc/14/17/76/178141776.db2.gz ZYCDHBLZFBMESN-PWSUYJOCSA-N 1 2 249.314 2.079 20 0 BEADLO Cc1n[nH]c(C)c1NC(=O)Nc1cc[nH+]c(C)c1 ZINC000119266775 178141819 /nfs/dbraw/zinc/14/18/19/178141819.db2.gz FIDRCMSSZMKQFL-UHFFFAOYSA-N 1 2 245.286 2.374 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2CCO[C@H](C)C2)cc[nH+]1 ZINC000271550923 178142181 /nfs/dbraw/zinc/14/21/81/178142181.db2.gz ZYCDHBLZFBMESN-ZYHUDNBSSA-N 1 2 249.314 2.079 20 0 BEADLO Cc1n[nH]cc1NC(=O)Nc1cc[nH+]c(C)c1 ZINC000119404246 178142625 /nfs/dbraw/zinc/14/26/25/178142625.db2.gz SFRXBLVUHRJFSI-UHFFFAOYSA-N 1 2 231.259 2.066 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CCCO[C@@H]2C)cc[nH+]1 ZINC000191633052 178145095 /nfs/dbraw/zinc/14/50/95/178145095.db2.gz FVJQVWUCAKIBCA-ZYHUDNBSSA-N 1 2 234.299 2.144 20 0 BEADLO Cc1cc(NC(=O)[C@@]2(C)C[C@H]3CC[C@@H]2O3)cc[nH+]1 ZINC000191633157 178146388 /nfs/dbraw/zinc/14/63/88/178146388.db2.gz CQLSUZFBRWKQQD-DYEKYZERSA-N 1 2 246.310 2.286 20 0 BEADLO Cc1cc(NC[C@@H](C)C(F)(F)F)nc[nH+]1 ZINC000308849928 178165585 /nfs/dbraw/zinc/16/55/85/178165585.db2.gz NVIGWBBOVOJGPR-ZCFIWIBFSA-N 1 2 219.210 2.395 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CC=CCC2)s1 ZINC000649417213 398217001 /nfs/dbraw/zinc/21/70/01/398217001.db2.gz AAWFLYCZTNAMNA-UHFFFAOYSA-N 1 2 223.345 2.423 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CC=CCC2)s1 ZINC000649417213 398217006 /nfs/dbraw/zinc/21/70/06/398217006.db2.gz AAWFLYCZTNAMNA-UHFFFAOYSA-N 1 2 223.345 2.423 20 0 BEADLO Cc1nc(C)c(C(=O)Nc2cc[nH+]c(C)c2)o1 ZINC000073609994 178152366 /nfs/dbraw/zinc/15/23/66/178152366.db2.gz ZZHMJWPCXKSMTF-UHFFFAOYSA-N 1 2 231.255 2.247 20 0 BEADLO Cc1cc(NC(C)(C)[C@@H](C)O)nc(C2CC2)[nH+]1 ZINC000270711668 178152418 /nfs/dbraw/zinc/15/24/18/178152418.db2.gz LPEOMLBFENAXSK-SECBINFHSA-N 1 2 235.331 2.234 20 0 BEADLO Cc1cc(NC2CCOCC2)nc(C(C)C)[nH+]1 ZINC000036319995 178154859 /nfs/dbraw/zinc/15/48/59/178154859.db2.gz AYPULTIOABPCSH-UHFFFAOYSA-N 1 2 235.331 2.499 20 0 BEADLO Cc1cc(NCCN(C)c2ccccc2)nc[nH+]1 ZINC000301237891 178161798 /nfs/dbraw/zinc/16/17/98/178161798.db2.gz LEBANEDQKSNGCL-UHFFFAOYSA-N 1 2 242.326 2.333 20 0 BEADLO Cc1cc(NCC[C@@H]2CCCCO2)nc[nH+]1 ZINC000227316390 178163247 /nfs/dbraw/zinc/16/32/47/178163247.db2.gz BLZINSACCFFGLK-NSHDSACASA-N 1 2 221.304 2.156 20 0 BEADLO Cc1cc(NC[C@@H]2CCCO2)nc(C(C)C)[nH+]1 ZINC000035121225 178166809 /nfs/dbraw/zinc/16/68/09/178166809.db2.gz MXQGUDNACBJQGZ-NSHDSACASA-N 1 2 235.331 2.499 20 0 BEADLO Cc1cc(NC[C@@]2(C)CCCC[C@@H]2O)nc[nH+]1 ZINC000301474730 178167279 /nfs/dbraw/zinc/16/72/79/178167279.db2.gz AHEPIOMBFGJXLT-WCQYABFASA-N 1 2 235.331 2.138 20 0 BEADLO COc1cccc(-c2c[nH+]cn2C)c1OC ZINC000649424368 398225660 /nfs/dbraw/zinc/22/56/60/398225660.db2.gz VHWIVWUZKYHEKM-UHFFFAOYSA-N 1 2 218.256 2.104 20 0 BEADLO Cc1cc(NC[C@H](O)c2ccccc2F)nc[nH+]1 ZINC000301222878 178168409 /nfs/dbraw/zinc/16/84/09/178168409.db2.gz DCZAKNJZVDDJLL-LBPRGKRZSA-N 1 2 247.273 2.070 20 0 BEADLO Cc1cc(NC[C@H](CCO)CC(C)C)nc[nH+]1 ZINC000301445596 178168523 /nfs/dbraw/zinc/16/85/23/178168523.db2.gz YAEAHSGHTQZPLS-GFCCVEGCSA-N 1 2 237.347 2.242 20 0 BEADLO Cc1cc(N[C@H]2CCCOC2)nc(C2CC2)[nH+]1 ZINC000172015336 178188517 /nfs/dbraw/zinc/18/85/17/178188517.db2.gz OMOPVAZTCIMQDD-NSHDSACASA-N 1 2 233.315 2.253 20 0 BEADLO Cc1cc(NCc2cccs2)nc[nH+]1 ZINC000040727123 178174243 /nfs/dbraw/zinc/17/42/43/178174243.db2.gz ZDPONDHSMQCGCU-UHFFFAOYSA-N 1 2 205.286 2.459 20 0 BEADLO Cc1cc(N[C@@H](CO)C(C)(C)C)nc(C2CC2)[nH+]1 ZINC000268458542 178181236 /nfs/dbraw/zinc/18/12/36/178181236.db2.gz DAJIHEPQLFEGGH-NSHDSACASA-N 1 2 249.358 2.481 20 0 BEADLO Cc1cc(N[C@@H]2[C@H]3CCO[C@H]3C23CCC3)nc[nH+]1 ZINC000301799246 178184176 /nfs/dbraw/zinc/18/41/76/178184176.db2.gz BLMFIHMEBFNTSE-RAIGVLPGSA-N 1 2 245.326 2.155 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)CCCC(C)(C)C ZINC000264058468 398223795 /nfs/dbraw/zinc/22/37/95/398223795.db2.gz KZMHNBYWEQLWOS-UHFFFAOYSA-N 1 2 237.347 2.253 20 0 BEADLO Cc1cc(N[C@H](C)[C@H](C)CO)nc(C2CC2)[nH+]1 ZINC000265813898 178185365 /nfs/dbraw/zinc/18/53/65/178185365.db2.gz GGDQXWAWOCRWST-PSASIEDQSA-N 1 2 235.331 2.091 20 0 BEADLO Cc1cc(N[C@H](C)[C@@H]2CCCOC2)nc[nH+]1 ZINC000336777808 178185450 /nfs/dbraw/zinc/18/54/50/178185450.db2.gz JPKXEWDCKUCORF-GHMZBOCLSA-N 1 2 221.304 2.012 20 0 BEADLO Cc1cc(N[C@H]2CCO[C@@H]2C)nc(C(C)C)[nH+]1 ZINC000149981273 178190021 /nfs/dbraw/zinc/19/00/21/178190021.db2.gz ZGQNWUQKDCBDKQ-MNOVXSKESA-N 1 2 235.331 2.498 20 0 BEADLO Cc1cc(N[C@H]2CS[C@@H](C)C2)nc[nH+]1 ZINC000307563380 178190633 /nfs/dbraw/zinc/19/06/33/178190633.db2.gz CCHDWUNPZVZLCJ-DTWKUNHWSA-N 1 2 209.318 2.091 20 0 BEADLO Cc1cc(N[C@H]2CS[C@H](C)C2)nc[nH+]1 ZINC000307563383 178190638 /nfs/dbraw/zinc/19/06/38/178190638.db2.gz CCHDWUNPZVZLCJ-RKDXNWHRSA-N 1 2 209.318 2.091 20 0 BEADLO Cc1cc(N[C@H]2CCO[C@H](C(C)C)C2)nc[nH+]1 ZINC000357216550 178190735 /nfs/dbraw/zinc/19/07/35/178190735.db2.gz YCBIDVTYQNNZJB-RYUDHWBXSA-N 1 2 235.331 2.401 20 0 BEADLO Cc1cc(N[C@H]2CCO[C@H]2C)nc(C(C)C)[nH+]1 ZINC000149981543 178190876 /nfs/dbraw/zinc/19/08/76/178190876.db2.gz ZGQNWUQKDCBDKQ-QWRGUYRKSA-N 1 2 235.331 2.498 20 0 BEADLO CC/C=C/C[NH2+]Cc1nn(C)c(C)c1Cl ZINC000421385682 192327523 /nfs/dbraw/zinc/32/75/23/192327523.db2.gz QUWFKNVKPMXRSE-AATRIKPKSA-N 1 2 227.739 2.438 20 0 BEADLO C/C=C\C[C@H]1CCCN(C(=O)Cn2cc[nH+]c2)C1 ZINC000629871539 361745399 /nfs/dbraw/zinc/74/53/99/361745399.db2.gz QYSZMHHGQJFUKY-ZRMMWKCHSA-N 1 2 247.342 2.088 20 0 BEADLO CCC[C@@H]1CCCC[C@@H]1NC(=O)Cn1cc[nH+]c1 ZINC000073361540 343987062 /nfs/dbraw/zinc/98/70/62/343987062.db2.gz BAJULYXGBUMUAY-OLZOCXBDSA-N 1 2 249.358 2.358 20 0 BEADLO C[C@H]1Oc2cc(F)ccc2[C@H]1[NH2+]Cc1cocn1 ZINC000342316637 136222939 /nfs/dbraw/zinc/22/29/39/136222939.db2.gz ZPXHSAVNAYJYNB-OQPBUACISA-N 1 2 248.257 2.426 20 0 BEADLO CCc1cnc(C[N@@H+]2CC[C@]23CCOC3)s1 ZINC000421400565 192330612 /nfs/dbraw/zinc/33/06/12/192330612.db2.gz KDFMRBUXHAYCIK-GFCCVEGCSA-N 1 2 238.356 2.070 20 0 BEADLO CCc1cnc(C[N@H+]2CC[C@]23CCOC3)s1 ZINC000421400565 192330615 /nfs/dbraw/zinc/33/06/15/192330615.db2.gz KDFMRBUXHAYCIK-GFCCVEGCSA-N 1 2 238.356 2.070 20 0 BEADLO CCCCN(C(=O)CCc1c[nH+]c[nH]1)C1CC1 ZINC000276648798 538932951 /nfs/dbraw/zinc/93/29/51/538932951.db2.gz WGCHMRSXCUTNIF-UHFFFAOYSA-N 1 2 235.331 2.133 20 0 BEADLO CCCCN(C(=O)CCc1c[nH]c[nH+]1)C1CC1 ZINC000276648798 538932952 /nfs/dbraw/zinc/93/29/52/538932952.db2.gz WGCHMRSXCUTNIF-UHFFFAOYSA-N 1 2 235.331 2.133 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2cnn(C)n2)ccc1F ZINC000287049690 178229719 /nfs/dbraw/zinc/22/97/19/178229719.db2.gz MUODUSRVBZXESK-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2cnn(C)c2)no1 ZINC000282883058 178230902 /nfs/dbraw/zinc/23/09/02/178230902.db2.gz VTRAGZOCRLWXCV-VHSXEESVSA-N 1 2 234.303 2.128 20 0 BEADLO c1[nH]cc(-c2ccccc2OC[C@H]2CCOC2)[nH+]1 ZINC000649434520 398235918 /nfs/dbraw/zinc/23/59/18/398235918.db2.gz PCPLGNKSYOCMCJ-NSHDSACASA-N 1 2 244.294 2.492 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@@H](C)c2nncn2C)c(C)o1 ZINC000037017605 178253507 /nfs/dbraw/zinc/25/35/07/178253507.db2.gz HTIHKOKLNVCDGU-UWVGGRQHSA-N 1 2 248.330 2.437 20 0 BEADLO CCc1nsc(NCCc2cccc(C)[nH+]2)n1 ZINC000280445846 538937350 /nfs/dbraw/zinc/93/73/50/538937350.db2.gz KVHHJIOMTMNFOC-UHFFFAOYSA-N 1 2 248.355 2.459 20 0 BEADLO CC(C)Cn1cc(N[C@@H](C)c2[nH]cc[nH+]2)cn1 ZINC000278859221 538935103 /nfs/dbraw/zinc/93/51/03/538935103.db2.gz FJETXUCCSYPLLY-JTQLQIEISA-N 1 2 233.319 2.435 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2c[nH]cn2)c(C)o1 ZINC000054765277 178251134 /nfs/dbraw/zinc/25/11/34/178251134.db2.gz RCPYOILUFNGTLP-VIFPVBQESA-N 1 2 219.288 2.470 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@@H]2C[C@@H](C)N(C3CC3)C2)no1 ZINC000337552958 178255709 /nfs/dbraw/zinc/25/57/09/178255709.db2.gz POSPELQJWMVTAH-ADEWGFFLSA-N 1 2 249.358 2.259 20 0 BEADLO C[C@@H]1CCN(C(=O)CCc2c[nH+]c[nH]2)CC1(C)C ZINC000281655256 538938967 /nfs/dbraw/zinc/93/89/67/538938967.db2.gz RTNDRMBELCAESH-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H]1CCN(C(=O)CCc2c[nH]c[nH+]2)CC1(C)C ZINC000281655256 538938968 /nfs/dbraw/zinc/93/89/68/538938968.db2.gz RTNDRMBELCAESH-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO COc1ccc[nH+]c1NC[C@H](OC)C(C)C ZINC000381242337 398240549 /nfs/dbraw/zinc/24/05/49/398240549.db2.gz VUZDOVPPUPBECL-NSHDSACASA-N 1 2 224.304 2.173 20 0 BEADLO Cc1cc2ccccc2[nH+]c1N1CC[C@H](O)C1 ZINC000063106518 178298377 /nfs/dbraw/zinc/29/83/77/178298377.db2.gz CLUUYLQVJAPCCL-LBPRGKRZSA-N 1 2 228.295 2.114 20 0 BEADLO Cc1cc2ccccc2[nH+]c1N1CC[C@@H](CO)C1 ZINC000063106508 178298475 /nfs/dbraw/zinc/29/84/75/178298475.db2.gz RHTYDIOANHCMDL-GFCCVEGCSA-N 1 2 242.322 2.362 20 0 BEADLO CCc1nnc(C[NH2+][C@H](C)c2ccncc2)s1 ZINC000343699835 365622384 /nfs/dbraw/zinc/62/23/84/365622384.db2.gz VPKDHXIKQXHHMH-SECBINFHSA-N 1 2 248.355 2.346 20 0 BEADLO Cc1cc2[nH+]cn(Cc3ncccn3)c2cc1C ZINC000128313821 178306216 /nfs/dbraw/zinc/30/62/16/178306216.db2.gz DLRPQQHTEQQVFG-UHFFFAOYSA-N 1 2 238.294 2.491 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C1CC=CC1 ZINC000076995733 398251431 /nfs/dbraw/zinc/25/14/31/398251431.db2.gz AXSJRKJCJUBOHF-UHFFFAOYSA-N 1 2 202.257 2.295 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CC[C@@H]1SC ZINC000576631320 365641973 /nfs/dbraw/zinc/64/19/73/365641973.db2.gz ZPBLIYIVYQTSTA-SCZZXKLOSA-N 1 2 224.329 2.396 20 0 BEADLO COc1ncc(CNc2ccc(C)[nH+]c2)s1 ZINC000380768375 398251881 /nfs/dbraw/zinc/25/18/81/398251881.db2.gz YEBHMRFVMJAXSM-UHFFFAOYSA-N 1 2 235.312 2.467 20 0 BEADLO CC(C)c1nnc([C@H](C)N[C@@H](C)c2[nH]cc[nH+]2)[nH]1 ZINC000286356772 538944091 /nfs/dbraw/zinc/94/40/91/538944091.db2.gz ZNIHYROCPWNVQN-IUCAKERBSA-N 1 2 248.334 2.063 20 0 BEADLO CC(C)[NH2+][C@@H](c1ncn[nH]1)C1CCCCC1 ZINC000381166835 398252521 /nfs/dbraw/zinc/25/25/21/398252521.db2.gz SMRYFGYXDOVQJE-LLVKDONJSA-N 1 2 222.336 2.424 20 0 BEADLO CC(C)CC(C)(C)C(=O)NCc1c[nH+]cn1C ZINC000291355387 538947677 /nfs/dbraw/zinc/94/76/77/538947677.db2.gz XVRQCCKOSAELPK-UHFFFAOYSA-N 1 2 237.347 2.109 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1C(=O)NCc1c[nH+]cn1C ZINC000291432254 538948191 /nfs/dbraw/zinc/94/81/91/538948191.db2.gz LLXMHUYTLQULLA-YPMHNXCESA-N 1 2 249.358 2.253 20 0 BEADLO COc1ncncc1C[N@H+](C)Cc1ccccc1 ZINC000647997880 398263703 /nfs/dbraw/zinc/26/37/03/398263703.db2.gz AJIODXHICQOGIN-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1ncncc1C[N@@H+](C)Cc1ccccc1 ZINC000647997880 398263707 /nfs/dbraw/zinc/26/37/07/398263707.db2.gz AJIODXHICQOGIN-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO CC(C)C[C@H](C)CC(=O)NCc1c[nH+]cn1C ZINC000291402164 538947865 /nfs/dbraw/zinc/94/78/65/538947865.db2.gz ISSRPQWEOAWXPL-NSHDSACASA-N 1 2 237.347 2.109 20 0 BEADLO C[C@H]1C[C@H](NC(=O)c2cccs2)c2[nH+]ccn21 ZINC000334745063 136232423 /nfs/dbraw/zinc/23/24/23/136232423.db2.gz WNBAJMISQPPDSH-IUCAKERBSA-N 1 2 247.323 2.380 20 0 BEADLO CC(C)CC[N@H+](C)Cc1nsc(N(C)C)n1 ZINC000178919251 538954182 /nfs/dbraw/zinc/95/41/82/538954182.db2.gz YPUYNCJMCDFFTC-UHFFFAOYSA-N 1 2 242.392 2.082 20 0 BEADLO CC(C)CC[N@@H+](C)Cc1nsc(N(C)C)n1 ZINC000178919251 538954183 /nfs/dbraw/zinc/95/41/83/538954183.db2.gz YPUYNCJMCDFFTC-UHFFFAOYSA-N 1 2 242.392 2.082 20 0 BEADLO Cc1cc(C)c(CNC(=O)N(C)C2CC2)c[nH+]1 ZINC000335130751 136233353 /nfs/dbraw/zinc/23/33/53/136233353.db2.gz MJUSQBDIUCDIAS-UHFFFAOYSA-N 1 2 233.315 2.002 20 0 BEADLO Cc1n[nH]cc1[C@H](C)[NH2+]Cc1nccs1 ZINC000180181343 538957355 /nfs/dbraw/zinc/95/73/55/538957355.db2.gz RSLXVGPKQQCZGZ-ZETCQYMHSA-N 1 2 222.317 2.025 20 0 BEADLO CC[C@@H](C(N)=O)[N@H+](C)Cc1ccccc1Cl ZINC000061679445 349602439 /nfs/dbraw/zinc/60/24/39/349602439.db2.gz OWQZDSWUNVVPSH-NSHDSACASA-N 1 2 240.734 2.036 20 0 BEADLO CC[C@@H](C(N)=O)[N@@H+](C)Cc1ccccc1Cl ZINC000061679445 349602442 /nfs/dbraw/zinc/60/24/42/349602442.db2.gz OWQZDSWUNVVPSH-NSHDSACASA-N 1 2 240.734 2.036 20 0 BEADLO CC(C)C[C@H](C)[N@@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000649473940 398272425 /nfs/dbraw/zinc/27/24/25/398272425.db2.gz URPYRWINXXBKCT-UWVGGRQHSA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)C[C@H](C)[N@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000649473940 398272427 /nfs/dbraw/zinc/27/24/27/398272427.db2.gz URPYRWINXXBKCT-UWVGGRQHSA-N 1 2 221.291 2.123 20 0 BEADLO O[C@@H]1C[N@H+](CC23CCC(CC2)C3)CC(F)(F)C1 ZINC000649473957 398272671 /nfs/dbraw/zinc/27/26/71/398272671.db2.gz VRUVISSALLODDX-CXQJBGSLSA-N 1 2 245.313 2.269 20 0 BEADLO O[C@@H]1C[N@@H+](CC23CCC(CC2)C3)CC(F)(F)C1 ZINC000649473957 398272673 /nfs/dbraw/zinc/27/26/73/398272673.db2.gz VRUVISSALLODDX-CXQJBGSLSA-N 1 2 245.313 2.269 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]CCOc1ccccc1 ZINC000179987196 538956960 /nfs/dbraw/zinc/95/69/60/538956960.db2.gz KZOGBQUXKOQBGB-LLVKDONJSA-N 1 2 245.326 2.448 20 0 BEADLO CC[C@H](OCC[NH+]1CCOCC1)c1ccccc1 ZINC000649474908 398273989 /nfs/dbraw/zinc/27/39/89/398273989.db2.gz ZZZKEPSDJYLKGM-HNNXBMFYSA-N 1 2 249.354 2.487 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1ccc2cc[nH]c2c1 ZINC000600153901 342691791 /nfs/dbraw/zinc/69/17/91/342691791.db2.gz RQICDPPTPFGDHG-SNVBAGLBSA-N 1 2 246.310 2.161 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1ccc2cc[nH]c2c1 ZINC000600153901 342691792 /nfs/dbraw/zinc/69/17/92/342691792.db2.gz RQICDPPTPFGDHG-SNVBAGLBSA-N 1 2 246.310 2.161 20 0 BEADLO CCN(CCSC)Cc1[nH]c(C)c(C)[nH+]1 ZINC000600172751 342695439 /nfs/dbraw/zinc/69/54/39/342695439.db2.gz HHGKFXPWCBHYCQ-UHFFFAOYSA-N 1 2 227.377 2.211 20 0 BEADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1cncnc1 ZINC000182063624 538961689 /nfs/dbraw/zinc/96/16/89/538961689.db2.gz VYRDMKFFCZOJBD-NSHDSACASA-N 1 2 228.299 2.065 20 0 BEADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1cncnc1 ZINC000182063624 538961690 /nfs/dbraw/zinc/96/16/90/538961690.db2.gz VYRDMKFFCZOJBD-NSHDSACASA-N 1 2 228.299 2.065 20 0 BEADLO CCCc1ncc(C[NH2+]Cc2ccns2)o1 ZINC000639253972 398285212 /nfs/dbraw/zinc/28/52/12/398285212.db2.gz SWJFAKVZIXACBH-UHFFFAOYSA-N 1 2 237.328 2.373 20 0 BEADLO CCN(Cc1c[nH+]c2ccccn12)CC(F)F ZINC000185750391 538970552 /nfs/dbraw/zinc/97/05/52/538970552.db2.gz OFCMJOHSSOCJOQ-UHFFFAOYSA-N 1 2 239.269 2.421 20 0 BEADLO FCC[C@H]1CN(c2[nH]c3ccccc3[nH+]2)CCO1 ZINC000624650684 342809099 /nfs/dbraw/zinc/80/90/99/342809099.db2.gz IIJBGWZXHLINEQ-JTQLQIEISA-N 1 2 249.289 2.128 20 0 BEADLO C/C=C\CNc1cc[nH+]c(C(C)(C)C)n1 ZINC000624656158 342810186 /nfs/dbraw/zinc/81/01/86/342810186.db2.gz HYVUJIBAAWKSIM-WAYWQWQTSA-N 1 2 205.305 2.184 20 0 BEADLO COc1cccc2c1CN(c1cc(C)[nH+]cn1)C2 ZINC000624672322 342816470 /nfs/dbraw/zinc/81/64/70/342816470.db2.gz IMYPIYUQIPALTF-UHFFFAOYSA-N 1 2 241.294 2.314 20 0 BEADLO c1ccc(N[C@@H]2CO[C@H](C3CC3)C2)[nH+]c1 ZINC000624672327 342816484 /nfs/dbraw/zinc/81/64/84/342816484.db2.gz ISGMSUYCRQYALN-QWRGUYRKSA-N 1 2 204.273 2.061 20 0 BEADLO Cc1[nH+]cc(-c2cc(C(F)(F)F)[nH]n2)n1C ZINC000630052437 361921283 /nfs/dbraw/zinc/92/12/83/361921283.db2.gz JFKMEPRRCNUPIH-UHFFFAOYSA-N 1 2 230.193 2.137 20 0 BEADLO COc1c(C)[nH+]cnc1NC[C@H]1CCCC12CC2 ZINC000624758213 342825883 /nfs/dbraw/zinc/82/58/83/342825883.db2.gz LNBBEMXSPFLMNV-LLVKDONJSA-N 1 2 247.342 2.208 20 0 BEADLO C[C@H](C1CC1)n1cc(NCc2[nH]cc[nH+]2)cn1 ZINC000189244125 346864539 /nfs/dbraw/zinc/86/45/39/346864539.db2.gz WUNSVFOZALMHEP-SECBINFHSA-N 1 2 231.303 2.189 20 0 BEADLO CCc1cnc(C[NH2+]Cc2cc(C)no2)s1 ZINC000381018730 538994226 /nfs/dbraw/zinc/99/42/26/538994226.db2.gz VOOVSKKUQFSNGL-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO C[C@@H](C1CC1)N(C(=O)CCc1c[nH+]c[nH]1)C1CC1 ZINC000188779622 538979810 /nfs/dbraw/zinc/97/98/10/538979810.db2.gz WETFNNRDRHCKDL-JTQLQIEISA-N 1 2 247.342 2.132 20 0 BEADLO C[C@@H](C1CC1)N(C(=O)CCc1c[nH]c[nH+]1)C1CC1 ZINC000188779622 538979811 /nfs/dbraw/zinc/97/98/11/538979811.db2.gz WETFNNRDRHCKDL-JTQLQIEISA-N 1 2 247.342 2.132 20 0 BEADLO Cc1cc(CNC(=O)[C@@]2(C)C[C@H]2F)cc(C)[nH+]1 ZINC000335623001 136240367 /nfs/dbraw/zinc/24/03/67/136240367.db2.gz GHBKGHPOTMHGNX-YPMHNXCESA-N 1 2 236.290 2.063 20 0 BEADLO O=C(N1CCCC[C@H]1c1[nH]cc[nH+]1)C12CC(C1)C2 ZINC000624935161 342838171 /nfs/dbraw/zinc/83/81/71/342838171.db2.gz MYQQCCCXFWRBMR-CVZZAPKMSA-N 1 2 245.326 2.263 20 0 BEADLO CC(C)[C@H](NC(=O)[C@@H]1CC12CCC2)c1[nH]cc[nH+]1 ZINC000640723847 361961884 /nfs/dbraw/zinc/96/18/84/361961884.db2.gz JIYDOMZSYFUYNH-QWRGUYRKSA-N 1 2 247.342 2.413 20 0 BEADLO OCCC[C@H]([NH2+]Cc1ccn[nH]1)c1ccccc1 ZINC000304254922 398295091 /nfs/dbraw/zinc/29/50/91/398295091.db2.gz BPSZZQGKKLPZDH-AWEZNQCLSA-N 1 2 245.326 2.013 20 0 BEADLO CCc1cc(NC(=O)Nc2cc[nH+]c(C)c2)n[nH]1 ZINC000192288384 538994689 /nfs/dbraw/zinc/99/46/89/538994689.db2.gz DLRJPJROLHGANM-UHFFFAOYSA-N 1 2 245.286 2.320 20 0 BEADLO Cc1cc(C(=O)N(C)Cc2[nH]cc[nH+]2)cs1 ZINC000381113536 538995122 /nfs/dbraw/zinc/99/51/22/538995122.db2.gz CPEJLBQKNHGNEA-UHFFFAOYSA-N 1 2 235.312 2.052 20 0 BEADLO C[C@@H](c1ccccc1)[C@H](CO)[NH2+]CC(F)F ZINC000390211319 539020502 /nfs/dbraw/zinc/02/05/02/539020502.db2.gz VJPIACAYWGLTEN-ONGXEEELSA-N 1 2 229.270 2.006 20 0 BEADLO CCCCNC(=O)[C@H](C)[N@H+](C)Cc1ccco1 ZINC000042334361 361980919 /nfs/dbraw/zinc/98/09/19/361980919.db2.gz PYBROSSPAUNKQQ-NSHDSACASA-N 1 2 238.331 2.016 20 0 BEADLO CCCCNC(=O)[C@H](C)[N@@H+](C)Cc1ccco1 ZINC000042334361 361980921 /nfs/dbraw/zinc/98/09/21/361980921.db2.gz PYBROSSPAUNKQQ-NSHDSACASA-N 1 2 238.331 2.016 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccc(Cl)o2)ncn1 ZINC000390480512 539022888 /nfs/dbraw/zinc/02/28/88/539022888.db2.gz MPAAMCRPDNWXJX-UHFFFAOYSA-N 1 2 237.690 2.321 20 0 BEADLO Cc1nn(C)cc1C[NH2+][C@H]1CCCC1(F)F ZINC000390665756 539027061 /nfs/dbraw/zinc/02/70/61/539027061.db2.gz UGMLMUBNNSNDPG-JTQLQIEISA-N 1 2 229.274 2.006 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2ccc(O)cc2)s1 ZINC000391939442 539027838 /nfs/dbraw/zinc/02/78/38/539027838.db2.gz MZAJAAVZDDTNGM-QMMMGPOBSA-N 1 2 249.339 2.403 20 0 BEADLO CCc1nnc(C[NH2+]Cc2ccc(O)cc2)s1 ZINC000391856899 539027916 /nfs/dbraw/zinc/02/79/16/539027916.db2.gz VIDYRFFYLOFNJS-UHFFFAOYSA-N 1 2 249.339 2.096 20 0 BEADLO C[C@H]1CCCC[C@H]1C(=O)N(C)Cc1[nH+]ccn1C ZINC000335633607 136241664 /nfs/dbraw/zinc/24/16/64/136241664.db2.gz LBWONQYOHUCNEE-NWDGAFQWSA-N 1 2 249.358 2.205 20 0 BEADLO Cn1ccc(C[NH2+]Cc2cscc2Cl)n1 ZINC000389897321 539018463 /nfs/dbraw/zinc/01/84/63/539018463.db2.gz BAJCHDLGRGVQLE-UHFFFAOYSA-N 1 2 241.747 2.425 20 0 BEADLO CCc1cc(N[C@H]2CSC[C@H]2C)nc[nH+]1 ZINC000389979732 539019405 /nfs/dbraw/zinc/01/94/05/539019405.db2.gz HUQLYHNBZKNIOB-SCZZXKLOSA-N 1 2 223.345 2.202 20 0 BEADLO CCOC[C@H]1CCC[C@@H]1Nc1c[nH]c[nH+]1 ZINC000389996898 539019413 /nfs/dbraw/zinc/01/94/13/539019413.db2.gz QULDALVYEBNYEP-ZJUUUORDSA-N 1 2 209.293 2.027 20 0 BEADLO CCOC[C@@H]1CCC[C@H]1Nc1c[nH]c[nH+]1 ZINC000389996897 539019560 /nfs/dbraw/zinc/01/95/60/539019560.db2.gz QULDALVYEBNYEP-VHSXEESVSA-N 1 2 209.293 2.027 20 0 BEADLO Cc1cn2cc(NC(=O)C34CC(C3)C4)ccc2[nH+]1 ZINC000625062008 342847617 /nfs/dbraw/zinc/84/76/17/342847617.db2.gz JFQJLSSKGAAMRB-UHFFFAOYSA-N 1 2 241.294 2.381 20 0 BEADLO C[N@H+](Cc1ccncc1Br)C1CC1 ZINC000625083092 342849068 /nfs/dbraw/zinc/84/90/68/342849068.db2.gz FFXUAZSWIYHQPP-UHFFFAOYSA-N 1 2 241.132 2.438 20 0 BEADLO C[N@@H+](Cc1ccncc1Br)C1CC1 ZINC000625083092 342849070 /nfs/dbraw/zinc/84/90/70/342849070.db2.gz FFXUAZSWIYHQPP-UHFFFAOYSA-N 1 2 241.132 2.438 20 0 BEADLO COc1cncc(C[N@H+](C)Cc2ccoc2C)n1 ZINC000625100616 342856401 /nfs/dbraw/zinc/85/64/01/342856401.db2.gz CRWJDNGCJVNTKD-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1cncc(C[N@@H+](C)Cc2ccoc2C)n1 ZINC000625100616 342856404 /nfs/dbraw/zinc/85/64/04/342856404.db2.gz CRWJDNGCJVNTKD-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO CO[C@@H]1CC[N@H+](Cc2cc(C(C)(C)C)on2)C1 ZINC000351512110 136246488 /nfs/dbraw/zinc/24/64/88/136246488.db2.gz FKNNAAHRXHXKOP-LLVKDONJSA-N 1 2 238.331 2.193 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2cc(C(C)(C)C)on2)C1 ZINC000351512110 136246489 /nfs/dbraw/zinc/24/64/89/136246489.db2.gz FKNNAAHRXHXKOP-LLVKDONJSA-N 1 2 238.331 2.193 20 0 BEADLO C[C@@H]([NH2+]Cc1ccn[nH]1)c1cccs1 ZINC000036900231 342913145 /nfs/dbraw/zinc/91/31/45/342913145.db2.gz PKYZCTXLUYVMQV-MRVPVSSYSA-N 1 2 207.302 2.322 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+](C)CCCOC(C)C)no1 ZINC000351518147 136246671 /nfs/dbraw/zinc/24/66/71/136246671.db2.gz LEWGGXRFLPCSPD-SNVBAGLBSA-N 1 2 241.335 2.186 20 0 BEADLO Cc1nc([C@@H](C)[N@H+](C)CCCOC(C)C)no1 ZINC000351518147 136246672 /nfs/dbraw/zinc/24/66/72/136246672.db2.gz LEWGGXRFLPCSPD-SNVBAGLBSA-N 1 2 241.335 2.186 20 0 BEADLO COc1c(O)cccc1C[NH2+][C@@H](C)c1ccon1 ZINC000351572838 136246827 /nfs/dbraw/zinc/24/68/27/136246827.db2.gz GKEQPUMTSRONTL-VIFPVBQESA-N 1 2 248.282 2.240 20 0 BEADLO CCCCc1cc(N[C@@H](CC)[C@@H](C)O)nc[nH+]1 ZINC000631291950 342903361 /nfs/dbraw/zinc/90/33/61/342903361.db2.gz DEYNJVFBXAQWLC-PWSUYJOCSA-N 1 2 237.347 2.391 20 0 BEADLO C[C@@H]([NH2+][C@H](C)[C@H]1CC1(F)F)C(=O)OC(C)(C)C ZINC000602594944 349644086 /nfs/dbraw/zinc/64/40/86/349644086.db2.gz STFMTYROAOFJJK-IWSPIJDZSA-N 1 2 249.301 2.350 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2ccc(F)cc2C)o1 ZINC000351650496 136249397 /nfs/dbraw/zinc/24/93/97/136249397.db2.gz OZBNFCMRNHMWID-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2ccc(F)cc2C)o1 ZINC000351650496 136249398 /nfs/dbraw/zinc/24/93/98/136249398.db2.gz OZBNFCMRNHMWID-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO CC[C@@H]1C[C@H]1CNC(=O)/C=C\c1[nH+]ccn1CC ZINC000493424351 529452860 /nfs/dbraw/zinc/45/28/60/529452860.db2.gz DQTOAWFTHPOJDX-DUVUQDDDSA-N 1 2 247.342 2.079 20 0 BEADLO Cc1[nH]c(CN2C[C@@H](C)OC(C)(C)C2)[nH+]c1C ZINC000628154179 398336142 /nfs/dbraw/zinc/33/61/42/398336142.db2.gz PDOCKLMLOXMMGA-SECBINFHSA-N 1 2 237.347 2.026 20 0 BEADLO CS[C@H](C)CC(=O)Nc1cc[nH+]c(C)c1 ZINC000120757956 398337316 /nfs/dbraw/zinc/33/73/16/398337316.db2.gz HDLMDNCKIFQWLK-SECBINFHSA-N 1 2 224.329 2.470 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCCc2occc21)c1nncn1C ZINC000123951459 398338725 /nfs/dbraw/zinc/33/87/25/398338725.db2.gz GJXUTFYPLLRHTM-MWLCHTKSSA-N 1 2 246.314 2.136 20 0 BEADLO CC[C@H](NC(=O)C=Cc1c[nH]c[nH+]1)C(C)(C)C ZINC000493454379 529457082 /nfs/dbraw/zinc/45/70/82/529457082.db2.gz GPUUIFRBVFWBKQ-MLRMMBSGSA-N 1 2 235.331 2.364 20 0 BEADLO C[C@@H](F)CC[N@@H+]1CCCC[C@H]1c1nnc[nH]1 ZINC000351752939 136250966 /nfs/dbraw/zinc/25/09/66/136250966.db2.gz UAJMJJMJMLVILJ-ZJUUUORDSA-N 1 2 226.299 2.080 20 0 BEADLO C[C@@H](F)CC[N@H+]1CCCC[C@H]1c1nnc[nH]1 ZINC000351752939 136250967 /nfs/dbraw/zinc/25/09/67/136250967.db2.gz UAJMJJMJMLVILJ-ZJUUUORDSA-N 1 2 226.299 2.080 20 0 BEADLO C[C@@H](F)CC[N@@H+]1CCCC[C@H]1c1nc[nH]n1 ZINC000351752939 136250968 /nfs/dbraw/zinc/25/09/68/136250968.db2.gz UAJMJJMJMLVILJ-ZJUUUORDSA-N 1 2 226.299 2.080 20 0 BEADLO C[C@@H](F)CC[N@H+]1CCCC[C@H]1c1nc[nH]n1 ZINC000351752939 136250969 /nfs/dbraw/zinc/25/09/69/136250969.db2.gz UAJMJJMJMLVILJ-ZJUUUORDSA-N 1 2 226.299 2.080 20 0 BEADLO CCc1ccc(C[NH2+]Cc2ccn[nH]2)s1 ZINC000051718669 398344272 /nfs/dbraw/zinc/34/42/72/398344272.db2.gz LEHQRODYTYSMLL-UHFFFAOYSA-N 1 2 221.329 2.323 20 0 BEADLO CCc1c[nH]c(CC(=O)N(C)[C@@H](C)C2(C)CC2)[nH+]1 ZINC000635661106 398344323 /nfs/dbraw/zinc/34/43/23/398344323.db2.gz LOUDGMXRUYWUKU-JTQLQIEISA-N 1 2 249.358 2.162 20 0 BEADLO Cc1nc([C@@H]2CCC[N@H+]2CC[C@H](C)F)no1 ZINC000351759874 136252725 /nfs/dbraw/zinc/25/27/25/136252725.db2.gz MSHVZOUPPZMKJF-WPRPVWTQSA-N 1 2 227.283 2.263 20 0 BEADLO Cc1nc([C@@H]2CCC[N@@H+]2CC[C@H](C)F)no1 ZINC000351759874 136252726 /nfs/dbraw/zinc/25/27/26/136252726.db2.gz MSHVZOUPPZMKJF-WPRPVWTQSA-N 1 2 227.283 2.263 20 0 BEADLO CC[C@@H]([NH2+][C@@H]1CCOC1=O)c1ccccc1 ZINC000019876276 342960503 /nfs/dbraw/zinc/96/05/03/342960503.db2.gz VOTZOMCBZGJFFD-VXGBXAGGSA-N 1 2 219.284 2.043 20 0 BEADLO CC[C@@H](C)C[NH2+]c1ccc(-n2cnnn2)cc1 ZINC000020094473 342969160 /nfs/dbraw/zinc/96/91/60/342969160.db2.gz IDMQALGYOTWYMA-SNVBAGLBSA-N 1 2 231.303 2.120 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)NCCC=C(C)C ZINC000493457015 529553267 /nfs/dbraw/zinc/55/32/67/529553267.db2.gz JDUWMFLBASYKLJ-BQYQJAHWSA-N 1 2 247.342 2.389 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)NCCCC1CC1 ZINC000492494627 529553870 /nfs/dbraw/zinc/55/38/70/529553870.db2.gz RJJLHMABGBUTNB-BQYQJAHWSA-N 1 2 247.342 2.223 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)NC[C@H](C)C(C)C ZINC000492465786 529554081 /nfs/dbraw/zinc/55/40/81/529554081.db2.gz ZDJVPJLEEGVPCU-SYTKJHMZSA-N 1 2 249.358 2.325 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N1[C@H](C)CC[C@H]1C ZINC000492492545 529558763 /nfs/dbraw/zinc/55/87/63/529558763.db2.gz MBGZYHVWMADOMU-PKJDGDQJSA-N 1 2 247.342 2.316 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)NC[C@H](C)C(C)C ZINC000492465784 529559891 /nfs/dbraw/zinc/55/98/91/529559891.db2.gz ZDJVPJLEEGVPCU-DGMVEKRQSA-N 1 2 249.358 2.325 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N(C)CC(C)(C)C ZINC000492543089 529549565 /nfs/dbraw/zinc/54/95/65/529549565.db2.gz ZWPIQZIHGIURNJ-BQYQJAHWSA-N 1 2 249.358 2.421 20 0 BEADLO COC(=O)[C@H](CC(C)C)[N@H+](C)Cc1ccoc1 ZINC000351858895 136258893 /nfs/dbraw/zinc/25/88/93/136258893.db2.gz NUNXNDNOHACKHO-LBPRGKRZSA-N 1 2 239.315 2.299 20 0 BEADLO COC(=O)[C@H](CC(C)C)[N@@H+](C)Cc1ccoc1 ZINC000351858895 136258894 /nfs/dbraw/zinc/25/88/94/136258894.db2.gz NUNXNDNOHACKHO-LBPRGKRZSA-N 1 2 239.315 2.299 20 0 BEADLO CS[C@H]1CC[C@H]1Nc1c[nH+]cc(N(C)C)c1 ZINC000602726014 349714972 /nfs/dbraw/zinc/71/49/72/349714972.db2.gz UIQGZKGFNFVXCA-NEPJUHHUSA-N 1 2 237.372 2.454 20 0 BEADLO CCSCCNc1c[nH+]cc(N(C)C)c1 ZINC000602726378 349715803 /nfs/dbraw/zinc/71/58/03/349715803.db2.gz VXYRDDVWMVDUCF-UHFFFAOYSA-N 1 2 225.361 2.313 20 0 BEADLO CC[N@H+](Cc1nnc(C)[nH]1)Cc1ccc(C)cc1 ZINC000584029986 342998703 /nfs/dbraw/zinc/99/87/03/342998703.db2.gz BETNMLRJTYDONZ-UHFFFAOYSA-N 1 2 244.342 2.444 20 0 BEADLO CC[N@@H+](Cc1nnc(C)[nH]1)Cc1ccc(C)cc1 ZINC000584029986 342998706 /nfs/dbraw/zinc/99/87/06/342998706.db2.gz BETNMLRJTYDONZ-UHFFFAOYSA-N 1 2 244.342 2.444 20 0 BEADLO CC1=CCN(c2[nH+]c(C)nc3[nH]ccc32)CC1 ZINC000335904408 136260289 /nfs/dbraw/zinc/26/02/89/136260289.db2.gz UHZORVQEGQLXJC-UHFFFAOYSA-N 1 2 228.299 2.423 20 0 BEADLO Cc1ncc(C[N@@H+]2CCO[C@@H](C3CC3)C2)s1 ZINC000335908505 136261795 /nfs/dbraw/zinc/26/17/95/136261795.db2.gz IGJUATJVRGWVPE-GFCCVEGCSA-N 1 2 238.356 2.062 20 0 BEADLO Cc1ncc(C[N@H+]2CCO[C@@H](C3CC3)C2)s1 ZINC000335908505 136261796 /nfs/dbraw/zinc/26/17/96/136261796.db2.gz IGJUATJVRGWVPE-GFCCVEGCSA-N 1 2 238.356 2.062 20 0 BEADLO CC(C)c1ccc(C[N@@H+]2CCN(C)C(=O)C2)cc1 ZINC000119329783 343072055 /nfs/dbraw/zinc/07/20/55/343072055.db2.gz SQGDKZYXAKMJBT-UHFFFAOYSA-N 1 2 246.354 2.084 20 0 BEADLO CC(C)c1ccc(C[N@H+]2CCN(C)C(=O)C2)cc1 ZINC000119329783 343072056 /nfs/dbraw/zinc/07/20/56/343072056.db2.gz SQGDKZYXAKMJBT-UHFFFAOYSA-N 1 2 246.354 2.084 20 0 BEADLO Nc1[nH+]cnc(NCCCC2CC2)c1Cl ZINC000236390958 343091565 /nfs/dbraw/zinc/09/15/65/343091565.db2.gz NSUKWPDSYCGHBL-UHFFFAOYSA-N 1 2 226.711 2.314 20 0 BEADLO Nc1nc[nH+]c(NCCCC2CC2)c1Cl ZINC000236390958 343091566 /nfs/dbraw/zinc/09/15/66/343091566.db2.gz NSUKWPDSYCGHBL-UHFFFAOYSA-N 1 2 226.711 2.314 20 0 BEADLO CC(C)[C@@H](C)Nc1[nH+]cnc(N)c1Cl ZINC000227841444 167388099 /nfs/dbraw/zinc/38/80/99/167388099.db2.gz FTWBUHNGVCHLAX-ZCFIWIBFSA-N 1 2 214.700 2.169 20 0 BEADLO COc1cc(F)cc(OC)c1C[NH2+][C@H](C)CF ZINC000631136855 343099626 /nfs/dbraw/zinc/09/96/26/343099626.db2.gz RGIGKJFSDNRNAZ-MRVPVSSYSA-N 1 2 245.269 2.291 20 0 BEADLO COC(=O)[C@H]([NH2+]CCC(F)(F)F)C(C)(C)C ZINC000309960202 343109480 /nfs/dbraw/zinc/10/94/80/343109480.db2.gz KPYUCKXANCZIEJ-ZETCQYMHSA-N 1 2 241.253 2.116 20 0 BEADLO CC(C)[C@H](C)CC(=O)N(C)Cc1[nH+]ccn1C ZINC000067901166 362097988 /nfs/dbraw/zinc/09/79/88/362097988.db2.gz VBRRPFCLPHBPCG-LLVKDONJSA-N 1 2 237.347 2.061 20 0 BEADLO CCc1ccc(C[N@H+](CC)CC(=O)OC)s1 ZINC000050066230 343134382 /nfs/dbraw/zinc/13/43/82/343134382.db2.gz NGHXENCRYPRZGB-UHFFFAOYSA-N 1 2 241.356 2.305 20 0 BEADLO CCc1ccc(C[N@@H+](CC)CC(=O)OC)s1 ZINC000050066230 343134384 /nfs/dbraw/zinc/13/43/84/343134384.db2.gz NGHXENCRYPRZGB-UHFFFAOYSA-N 1 2 241.356 2.305 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1nc(C)c(C)s1 ZINC000176374163 365725546 /nfs/dbraw/zinc/72/55/46/365725546.db2.gz HMEUHAMFKPPVIR-NSHDSACASA-N 1 2 240.372 2.371 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1nc(C)c(C)s1 ZINC000176374163 365725551 /nfs/dbraw/zinc/72/55/51/365725551.db2.gz HMEUHAMFKPPVIR-NSHDSACASA-N 1 2 240.372 2.371 20 0 BEADLO CC[C@@H]([NH2+][C@@H]1CCSC1)C(=O)OC(C)(C)C ZINC000310015496 343179166 /nfs/dbraw/zinc/17/91/66/343179166.db2.gz KSDNUDOKHYRRDY-NXEZZACHSA-N 1 2 245.388 2.202 20 0 BEADLO COc1ccc[nH+]c1NCc1ccc(C)nc1 ZINC000128034265 343179759 /nfs/dbraw/zinc/17/97/59/343179759.db2.gz XRAYDWLDVWQEBA-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO Cc1cccc(C)c1C[NH2+]Cc1ccn[nH]1 ZINC000122060220 343158254 /nfs/dbraw/zinc/15/82/54/343158254.db2.gz XJGQTVHILDIBID-UHFFFAOYSA-N 1 2 215.300 2.316 20 0 BEADLO CCC[C@@H](C)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000125361196 343173151 /nfs/dbraw/zinc/17/31/51/343173151.db2.gz CEMDVMVETUIEGV-RKDXNWHRSA-N 1 2 209.293 2.023 20 0 BEADLO CC[C@@H](C(=O)OC)[N@H+](CC)Cc1ccoc1 ZINC000608840318 343220657 /nfs/dbraw/zinc/22/06/57/343220657.db2.gz RCLFZUXPCIBSAU-NSHDSACASA-N 1 2 225.288 2.053 20 0 BEADLO CC[C@@H](C(=O)OC)[N@@H+](CC)Cc1ccoc1 ZINC000608840318 343220660 /nfs/dbraw/zinc/22/06/60/343220660.db2.gz RCLFZUXPCIBSAU-NSHDSACASA-N 1 2 225.288 2.053 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C[C@H](C)C(F)(F)F ZINC000625356280 343247517 /nfs/dbraw/zinc/24/75/17/343247517.db2.gz XUCBGPXVXMOVIJ-QMMMGPOBSA-N 1 2 246.232 2.339 20 0 BEADLO CC1(C)CC(C[N@@H+]2CC(F)(F)C[C@@H]2CO)C1 ZINC000625356117 343247561 /nfs/dbraw/zinc/24/75/61/343247561.db2.gz NZMHAYAGSRTOIP-SNVBAGLBSA-N 1 2 233.302 2.125 20 0 BEADLO CC1(C)CC(C[N@H+]2CC(F)(F)C[C@@H]2CO)C1 ZINC000625356117 343247563 /nfs/dbraw/zinc/24/75/63/343247563.db2.gz NZMHAYAGSRTOIP-SNVBAGLBSA-N 1 2 233.302 2.125 20 0 BEADLO CC(C)(C)CCCn1cc(Cn2cc[nH+]c2)nn1 ZINC000641049283 362159980 /nfs/dbraw/zinc/15/99/80/362159980.db2.gz IHFYSFZTBVGINH-UHFFFAOYSA-N 1 2 247.346 2.349 20 0 BEADLO Cc1ccc(C[NH2+]Cc2csnn2)cc1 ZINC000036901957 343327220 /nfs/dbraw/zinc/32/72/20/343327220.db2.gz SYACQRJXMKOUCM-UHFFFAOYSA-N 1 2 219.313 2.136 20 0 BEADLO C[C@@H]([NH2+]c1ccc(OCCC(N)=O)cc1)C1CC1 ZINC000036934256 343328313 /nfs/dbraw/zinc/32/83/13/343328313.db2.gz PQSUDALLROQERX-SNVBAGLBSA-N 1 2 248.326 2.151 20 0 BEADLO CCCC1(C(=O)Nc2cc[nH+]cc2C)CC1 ZINC000348760426 136297300 /nfs/dbraw/zinc/29/73/00/136297300.db2.gz AKJNXGILGWIKGH-UHFFFAOYSA-N 1 2 218.300 2.331 20 0 BEADLO CC(C)[C@H](C)CNC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000584056345 343308261 /nfs/dbraw/zinc/30/82/61/343308261.db2.gz NDGPZWUGJGOATD-NEPJUHHUSA-N 1 2 237.347 2.243 20 0 BEADLO C/C=C\c1cn(Cc2ccc[nH+]c2C)nn1 ZINC000641051212 362163970 /nfs/dbraw/zinc/16/39/70/362163970.db2.gz ISUXGGXCCJFWCA-HYXAFXHYSA-N 1 2 214.272 2.063 20 0 BEADLO COC(=O)C(C)(C)[NH2+]C1CC(c2ccccc2)C1 ZINC000037085613 343333316 /nfs/dbraw/zinc/33/33/16/343333316.db2.gz VYMMMNVXTUYXMD-UHFFFAOYSA-N 1 2 247.338 2.474 20 0 BEADLO COC(=O)C(C)(C)[NH2+][C@H](C)CCc1ccco1 ZINC000037085660 343333460 /nfs/dbraw/zinc/33/34/60/343333460.db2.gz BMHRFTQOJPONND-SNVBAGLBSA-N 1 2 239.315 2.142 20 0 BEADLO COC(=O)[C@H](Cc1ccccc1)[NH2+]CC(C)C ZINC000037965902 343362785 /nfs/dbraw/zinc/36/27/85/343362785.db2.gz TUCABHZWGGZAAF-ZDUSSCGKSA-N 1 2 235.327 2.016 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1ccon1 ZINC000157776789 343366093 /nfs/dbraw/zinc/36/60/93/343366093.db2.gz NUBKEAFZGMMWMH-UHFFFAOYSA-N 1 2 206.245 2.290 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1ccon1 ZINC000157776789 343366095 /nfs/dbraw/zinc/36/60/95/343366095.db2.gz NUBKEAFZGMMWMH-UHFFFAOYSA-N 1 2 206.245 2.290 20 0 BEADLO Fc1ccc2c(c1F)CN(Cc1[nH]cc[nH+]1)CC2 ZINC000335652073 136305274 /nfs/dbraw/zinc/30/52/74/136305274.db2.gz JOXJPCGPYDFKHY-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO Cc1cc(NC(=O)C(C)(C)C(C)(F)F)cc[nH+]1 ZINC000335653213 136305707 /nfs/dbraw/zinc/30/57/07/136305707.db2.gz XXNPQTWUQAIALQ-UHFFFAOYSA-N 1 2 242.269 2.432 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C1=CCCC1 ZINC000151606517 343398671 /nfs/dbraw/zinc/39/86/71/343398671.db2.gz UNHNVLXILQQQJP-UHFFFAOYSA-N 1 2 218.256 2.139 20 0 BEADLO CC[C@H](O)Cn1cc[nH+]c1-c1ccccc1 ZINC000040228500 343398675 /nfs/dbraw/zinc/39/86/75/343398675.db2.gz OZZNYUVQRGPPTJ-LBPRGKRZSA-N 1 2 216.284 2.321 20 0 BEADLO c1cn(Cc2cn(CCCC3CCC3)nn2)c[nH+]1 ZINC000641087425 362208938 /nfs/dbraw/zinc/20/89/38/362208938.db2.gz FJVIXZAWDFCDBG-UHFFFAOYSA-N 1 2 245.330 2.103 20 0 BEADLO CC1=C(C)C[N@H+](Cc2nnc3n2CCCC3)CC1 ZINC000335829477 136352872 /nfs/dbraw/zinc/35/28/72/136352872.db2.gz GVPRJPJYFTYUSG-UHFFFAOYSA-N 1 2 246.358 2.157 20 0 BEADLO CC1=C(C)C[N@@H+](Cc2nnc3n2CCCC3)CC1 ZINC000335829477 136352873 /nfs/dbraw/zinc/35/28/73/136352873.db2.gz GVPRJPJYFTYUSG-UHFFFAOYSA-N 1 2 246.358 2.157 20 0 BEADLO c1cc(C[N@@H+]2CCC[C@@H]2c2cccnc2)n[nH]1 ZINC000335716675 136339393 /nfs/dbraw/zinc/33/93/93/136339393.db2.gz HODDKTORWQIDFC-CYBMUJFWSA-N 1 2 228.299 2.142 20 0 BEADLO c1cc(C[N@H+]2CCC[C@@H]2c2cccnc2)n[nH]1 ZINC000335716675 136339394 /nfs/dbraw/zinc/33/93/94/136339394.db2.gz HODDKTORWQIDFC-CYBMUJFWSA-N 1 2 228.299 2.142 20 0 BEADLO Cn1c2cccc(F)c2[nH]c1=[NH+][C@@H]1CC1(C)C ZINC000350289551 136357738 /nfs/dbraw/zinc/35/77/38/136357738.db2.gz RAPWCEDFASOAKV-SNVBAGLBSA-N 1 2 233.290 2.345 20 0 BEADLO c1ccc2c(c1)[nH]c1c2CC[N@@H+]([C@H]2CCOC2)C1 ZINC000335896680 136359356 /nfs/dbraw/zinc/35/93/56/136359356.db2.gz UJHVWWVVQBARDO-NSHDSACASA-N 1 2 242.322 2.315 20 0 BEADLO c1ccc2c(c1)[nH]c1c2CC[N@H+]([C@H]2CCOC2)C1 ZINC000335896680 136359357 /nfs/dbraw/zinc/35/93/57/136359357.db2.gz UJHVWWVVQBARDO-NSHDSACASA-N 1 2 242.322 2.315 20 0 BEADLO C[C@@H]1C[C@@H]1CC(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000353991760 136363781 /nfs/dbraw/zinc/36/37/81/136363781.db2.gz DMKPGSZXTJJHAM-IJLUTSLNSA-N 1 2 247.342 2.162 20 0 BEADLO CCOC(C)(C)C[NH2+]CCSCC ZINC000167006291 136367885 /nfs/dbraw/zinc/36/78/85/136367885.db2.gz BOOPMYSTSRTSOQ-UHFFFAOYSA-N 1 2 205.367 2.144 20 0 BEADLO COC(=O)C(C)(C)[NH2+]Cc1cccc(C)c1C ZINC000043313987 343467719 /nfs/dbraw/zinc/46/77/19/343467719.db2.gz XSIPFPLAMHNUAK-UHFFFAOYSA-N 1 2 235.327 2.345 20 0 BEADLO COC(=O)C(C)(C)[NH2+]Cc1cc(C)cc(C)c1 ZINC000043393325 343469513 /nfs/dbraw/zinc/46/95/13/343469513.db2.gz RCHYWVUPUADSDG-UHFFFAOYSA-N 1 2 235.327 2.345 20 0 BEADLO Clc1ccc(C[NH2+]Cc2cocn2)o1 ZINC000379575567 343576889 /nfs/dbraw/zinc/57/68/89/343576889.db2.gz MGOVOVTYZNGBIC-UHFFFAOYSA-N 1 2 212.636 2.211 20 0 BEADLO CCC(F)(F)C[N@@H+]1CC[C@H](C(=O)OC)[C@H](C)C1 ZINC000602903415 349817230 /nfs/dbraw/zinc/81/72/30/349817230.db2.gz PFVOOKYNSGOXDD-ZJUUUORDSA-N 1 2 249.301 2.163 20 0 BEADLO CCC(F)(F)C[N@H+]1CC[C@H](C(=O)OC)[C@H](C)C1 ZINC000602903415 349817234 /nfs/dbraw/zinc/81/72/34/349817234.db2.gz PFVOOKYNSGOXDD-ZJUUUORDSA-N 1 2 249.301 2.163 20 0 BEADLO Cn1cccc1C(=O)C[N@H+](C)Cc1cccs1 ZINC000048776886 343587151 /nfs/dbraw/zinc/58/71/51/343587151.db2.gz MRTSQFRNXDXUJS-UHFFFAOYSA-N 1 2 248.351 2.401 20 0 BEADLO Cn1cccc1C(=O)C[N@@H+](C)Cc1cccs1 ZINC000048776886 343587154 /nfs/dbraw/zinc/58/71/54/343587154.db2.gz MRTSQFRNXDXUJS-UHFFFAOYSA-N 1 2 248.351 2.401 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCC[C@]2(CCOC2)C1 ZINC000580570854 365777010 /nfs/dbraw/zinc/77/70/10/365777010.db2.gz NXXOUKMOVIIONG-AWEZNQCLSA-N 1 2 247.342 2.100 20 0 BEADLO COC(=O)[C@@H]([NH2+][C@@H](C)C1CC1)c1ccccc1 ZINC000049538322 343601109 /nfs/dbraw/zinc/60/11/09/343601109.db2.gz OXOLIYDJOFTEJX-GWCFXTLKSA-N 1 2 233.311 2.289 20 0 BEADLO Cc1ccc(C(=O)N(C)Cc2c[nH+]c[nH]2)c(F)c1 ZINC000622745775 343605309 /nfs/dbraw/zinc/60/53/09/343605309.db2.gz WKAYJGUNNNYVTD-UHFFFAOYSA-N 1 2 247.273 2.129 20 0 BEADLO Cc1ccc(C(=O)N(C)Cc2c[nH]c[nH+]2)c(F)c1 ZINC000622745775 343605312 /nfs/dbraw/zinc/60/53/12/343605312.db2.gz WKAYJGUNNNYVTD-UHFFFAOYSA-N 1 2 247.273 2.129 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)CCSC(C)C ZINC000602939680 349825141 /nfs/dbraw/zinc/82/51/41/349825141.db2.gz BVVCWOKJYBEEOY-UHFFFAOYSA-N 1 2 227.377 2.292 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)CCSC(C)C ZINC000602939680 349825144 /nfs/dbraw/zinc/82/51/44/349825144.db2.gz BVVCWOKJYBEEOY-UHFFFAOYSA-N 1 2 227.377 2.292 20 0 BEADLO Cc1cc(NCC(F)(F)C(F)F)nc[nH+]1 ZINC000230715568 346956305 /nfs/dbraw/zinc/95/63/05/346956305.db2.gz QOKDDCPDKVAAOO-UHFFFAOYSA-N 1 2 223.173 2.097 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCc3nc[nH]c3C2)s1 ZINC000625436991 343734192 /nfs/dbraw/zinc/73/41/92/343734192.db2.gz KQYLZCFENJNOGF-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCc3nc[nH]c3C2)s1 ZINC000625436991 343734195 /nfs/dbraw/zinc/73/41/95/343734195.db2.gz KQYLZCFENJNOGF-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO C[C@H](c1ccccc1F)[NH+]1CCOCC1 ZINC000051151250 346962473 /nfs/dbraw/zinc/96/24/73/346962473.db2.gz XIBUZXFGJAFKNW-SNVBAGLBSA-N 1 2 209.264 2.219 20 0 BEADLO Cc1cc(NC(=O)/C=C/c2ccc[nH]2)cc[nH+]1 ZINC000187889993 259370257 /nfs/dbraw/zinc/37/02/57/259370257.db2.gz FBPYDULYYHPNMX-SNAWJCMRSA-N 1 2 227.267 2.370 20 0 BEADLO COc1ccc[nH+]c1N1CCCC(F)(F)C1 ZINC000624349716 343728967 /nfs/dbraw/zinc/72/89/67/343728967.db2.gz VGIQUNHZMPXYSH-UHFFFAOYSA-N 1 2 228.242 2.326 20 0 BEADLO CCOC(=O)CCCC[N@@H+]1OC2CCC1CC2 ZINC000603030951 349859854 /nfs/dbraw/zinc/85/98/54/349859854.db2.gz IIIQLVFDZWLRAI-UHFFFAOYSA-N 1 2 241.331 2.278 20 0 BEADLO CCOC(=O)CCCC[N@H+]1OC2CCC1CC2 ZINC000603030951 349859859 /nfs/dbraw/zinc/85/98/59/349859859.db2.gz IIIQLVFDZWLRAI-UHFFFAOYSA-N 1 2 241.331 2.278 20 0 BEADLO CCn1cccc1C[NH2+]CC(C)(F)F ZINC000584153293 343765554 /nfs/dbraw/zinc/76/55/54/343765554.db2.gz DGCBQWASYNRPPY-UHFFFAOYSA-N 1 2 202.248 2.253 20 0 BEADLO CN(CC1CCCCC1)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492865855 529864151 /nfs/dbraw/zinc/86/41/51/529864151.db2.gz VRLPJKMVERUVBI-FPLPWBNLSA-N 1 2 247.342 2.462 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)[C@H]1CC12CCCCC2 ZINC000336531411 537814645 /nfs/dbraw/zinc/81/46/45/537814645.db2.gz OXAVAIBVVGOUNC-GFCCVEGCSA-N 1 2 247.342 2.007 20 0 BEADLO Cc1[nH]c(CN[C@@H]2CCCC[C@H]2F)[nH+]c1C ZINC000577006600 343804708 /nfs/dbraw/zinc/80/47/08/343804708.db2.gz ZTZKUBNFHOGIMO-GHMZBOCLSA-N 1 2 225.311 2.397 20 0 BEADLO COc1c(C)[nH+]cnc1NC[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000624430079 343841842 /nfs/dbraw/zinc/84/18/42/343841842.db2.gz RDZHCLFQIWOFTC-GRYCIOLGSA-N 1 2 247.342 2.064 20 0 BEADLO Cc1cnc(NCCc2cccc(C)[nH+]2)s1 ZINC000336729230 537832453 /nfs/dbraw/zinc/83/24/53/537832453.db2.gz HQIWQZBAXOUESQ-UHFFFAOYSA-N 1 2 233.340 2.231 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1c(C)nsc1C ZINC000570579456 323063668 /nfs/dbraw/zinc/06/36/68/323063668.db2.gz UPQGEXMPILVRMW-NSHDSACASA-N 1 2 240.372 2.371 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1c(C)nsc1C ZINC000570579456 323063669 /nfs/dbraw/zinc/06/36/69/323063669.db2.gz UPQGEXMPILVRMW-NSHDSACASA-N 1 2 240.372 2.371 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CSC1(C)C ZINC000393749007 343923608 /nfs/dbraw/zinc/92/36/08/343923608.db2.gz PPZKNYXZLPPSAE-SECBINFHSA-N 1 2 224.329 2.396 20 0 BEADLO CC1(C)CC(C[N@@H+]2CC[C@H](O)C(F)(F)C2)C1 ZINC000625535132 343925925 /nfs/dbraw/zinc/92/59/25/343925925.db2.gz KIILNJDMEJAVRX-JTQLQIEISA-N 1 2 233.302 2.125 20 0 BEADLO CC1(C)CC(C[N@H+]2CC[C@H](O)C(F)(F)C2)C1 ZINC000625535132 343925927 /nfs/dbraw/zinc/92/59/27/343925927.db2.gz KIILNJDMEJAVRX-JTQLQIEISA-N 1 2 233.302 2.125 20 0 BEADLO CCOc1nnc(C[N@H+](CC)CC2CC2)s1 ZINC000070015286 343946962 /nfs/dbraw/zinc/94/69/62/343946962.db2.gz XNOGTYRWEOXPOZ-UHFFFAOYSA-N 1 2 241.360 2.169 20 0 BEADLO CCOc1nnc(C[N@@H+](CC)CC2CC2)s1 ZINC000070015286 343946966 /nfs/dbraw/zinc/94/69/66/343946966.db2.gz XNOGTYRWEOXPOZ-UHFFFAOYSA-N 1 2 241.360 2.169 20 0 BEADLO CCN(Cc1[nH+]ccn1C)c1ccccc1 ZINC000070922653 343957535 /nfs/dbraw/zinc/95/75/35/343957535.db2.gz WOSDNFGWMWYJIE-UHFFFAOYSA-N 1 2 215.300 2.447 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCc3ccccc3C2)n1 ZINC000628116896 343967418 /nfs/dbraw/zinc/96/74/18/343967418.db2.gz IUHKCPBIBHFGJZ-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCc3ccccc3C2)n1 ZINC000628116896 343967420 /nfs/dbraw/zinc/96/74/20/343967420.db2.gz IUHKCPBIBHFGJZ-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Oc1ccc2c(c1)C[N@@H+](CCOCC1CC1)C2 ZINC000625727393 344058374 /nfs/dbraw/zinc/05/83/74/344058374.db2.gz WCLCEPFZIQZBDX-UHFFFAOYSA-N 1 2 233.311 2.134 20 0 BEADLO Oc1ccc2c(c1)C[N@H+](CCOCC1CC1)C2 ZINC000625727393 344058376 /nfs/dbraw/zinc/05/83/76/344058376.db2.gz WCLCEPFZIQZBDX-UHFFFAOYSA-N 1 2 233.311 2.134 20 0 BEADLO c1snnc1C[N@@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000625777755 344071630 /nfs/dbraw/zinc/07/16/30/344071630.db2.gz IQUVUULLTLVEDF-ZJUUUORDSA-N 1 2 241.385 2.008 20 0 BEADLO c1snnc1C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000625777755 344071634 /nfs/dbraw/zinc/07/16/34/344071634.db2.gz IQUVUULLTLVEDF-ZJUUUORDSA-N 1 2 241.385 2.008 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCC[C@](C)(F)C1 ZINC000573338794 344102148 /nfs/dbraw/zinc/10/21/48/344102148.db2.gz YYURFZQNZGUIOS-LBPRGKRZSA-N 1 2 223.295 2.422 20 0 BEADLO CC[C@@H](C(=O)OC)[N@H+](C)Cc1ccsc1 ZINC000588689908 344173447 /nfs/dbraw/zinc/17/34/47/344173447.db2.gz VKLVVHAJELXKHE-JTQLQIEISA-N 1 2 227.329 2.132 20 0 BEADLO CC[C@@H](C(=O)OC)[N@@H+](C)Cc1ccsc1 ZINC000588689908 344173449 /nfs/dbraw/zinc/17/34/49/344173449.db2.gz VKLVVHAJELXKHE-JTQLQIEISA-N 1 2 227.329 2.132 20 0 BEADLO CCc1nc(C[NH+]2CCC(C)(O)CC2)cs1 ZINC000087781422 344236699 /nfs/dbraw/zinc/23/66/99/344236699.db2.gz UVVKDUZVMDIWMW-UHFFFAOYSA-N 1 2 240.372 2.052 20 0 BEADLO C[C@@H](CCO)SCc1cn2ccccc2[nH+]1 ZINC000083812633 344183238 /nfs/dbraw/zinc/18/32/38/344183238.db2.gz RNVXHTQXWCTWQS-JTQLQIEISA-N 1 2 236.340 2.338 20 0 BEADLO C[N@H+](Cc1cn(-c2ccc(F)cc2)nn1)C1CC1 ZINC000628135281 344193292 /nfs/dbraw/zinc/19/32/92/344193292.db2.gz RFBZMDRRQULDPJ-UHFFFAOYSA-N 1 2 246.289 2.001 20 0 BEADLO C[N@@H+](Cc1cn(-c2ccc(F)cc2)nn1)C1CC1 ZINC000628135281 344193294 /nfs/dbraw/zinc/19/32/94/344193294.db2.gz RFBZMDRRQULDPJ-UHFFFAOYSA-N 1 2 246.289 2.001 20 0 BEADLO CCn1ccnc1C[NH2+][C@H](C)c1c(C)noc1C ZINC000084224985 344329843 /nfs/dbraw/zinc/32/98/43/344329843.db2.gz AFFBVJUQRYPPKI-SECBINFHSA-N 1 2 248.330 2.359 20 0 BEADLO C[C@H](NC(=O)CCC(C)(F)F)c1[nH+]ccn1C ZINC000620594960 344330333 /nfs/dbraw/zinc/33/03/33/344330333.db2.gz FPEWOGPCCBVVOG-QMMMGPOBSA-N 1 2 245.273 2.033 20 0 BEADLO CC1(C)C[C@H]1CNc1cc(CO)cc[nH+]1 ZINC000641371247 362379857 /nfs/dbraw/zinc/37/98/57/362379857.db2.gz BMVVSJWDELWROA-JTQLQIEISA-N 1 2 206.289 2.032 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CC[C@@H](C)C1)c1[nH+]ccn1C ZINC000620603055 344352675 /nfs/dbraw/zinc/35/26/75/344352675.db2.gz DTYZSWJMXLEDNX-GMTAPVOTSA-N 1 2 235.331 2.034 20 0 BEADLO C[C@H](NC(=O)[C@@H]1CCCC1(C)C)c1[nH+]ccn1C ZINC000620603786 344354337 /nfs/dbraw/zinc/35/43/37/344354337.db2.gz LKLPIMQNGAHZMJ-QWRGUYRKSA-N 1 2 249.358 2.424 20 0 BEADLO OCc1cc[nH+]c(NCC2CCSCC2)c1 ZINC000641376001 362380581 /nfs/dbraw/zinc/38/05/81/362380581.db2.gz PIXMLLVRLNLJIV-UHFFFAOYSA-N 1 2 238.356 2.129 20 0 BEADLO c1cc2ccc(C[N@@H+]3CCO[C@@H]4C[C@@H]43)cc2[nH]1 ZINC000628291771 347048948 /nfs/dbraw/zinc/04/89/48/347048948.db2.gz TUJCZQXCJARING-UONOGXRCSA-N 1 2 228.295 2.141 20 0 BEADLO c1cc2ccc(C[N@H+]3CCO[C@@H]4C[C@@H]43)cc2[nH]1 ZINC000628291771 347048951 /nfs/dbraw/zinc/04/89/51/347048951.db2.gz TUJCZQXCJARING-UONOGXRCSA-N 1 2 228.295 2.141 20 0 BEADLO CCC[N@@H+]1CC[C@@H](NCc2cc(C#N)cs2)C1 ZINC000389308952 344429685 /nfs/dbraw/zinc/42/96/85/344429685.db2.gz FQLSFGXDORXRHI-GFCCVEGCSA-N 1 2 249.383 2.194 20 0 BEADLO CCC[N@H+]1CC[C@@H](NCc2cc(C#N)cs2)C1 ZINC000389308952 344429688 /nfs/dbraw/zinc/42/96/88/344429688.db2.gz FQLSFGXDORXRHI-GFCCVEGCSA-N 1 2 249.383 2.194 20 0 BEADLO C[C@@H](NC(=O)[C@@H](C)C1CCC1)c1[nH+]ccn1C ZINC000620612641 344368875 /nfs/dbraw/zinc/36/88/75/344368875.db2.gz ZXQLQYVOINRLDD-VHSXEESVSA-N 1 2 235.331 2.034 20 0 BEADLO CCCC[C@@H](COC)Nc1cc(CO)cc[nH+]1 ZINC000641384660 362385930 /nfs/dbraw/zinc/38/59/30/362385930.db2.gz HPOCQGWBSOFBGX-LBPRGKRZSA-N 1 2 238.331 2.191 20 0 BEADLO C[C@H]1CSCCN1c1cc[nH+]cc1F ZINC000641386917 362387065 /nfs/dbraw/zinc/38/70/65/362387065.db2.gz NBUGVNGLFRGLQN-QMMMGPOBSA-N 1 2 212.293 2.162 20 0 BEADLO CO[C@@H]1CC[C@H](C(=O)Nc2c(C)cc[nH+]c2C)C1 ZINC000622866431 344435331 /nfs/dbraw/zinc/43/53/31/344435331.db2.gz FEFDVORGRDWSGB-NWDGAFQWSA-N 1 2 248.326 2.452 20 0 BEADLO CC(C)OCCCN(C)c1cc[nH+]cc1F ZINC000641390255 362389711 /nfs/dbraw/zinc/38/97/11/362389711.db2.gz KESASIMCJUIETI-UHFFFAOYSA-N 1 2 226.295 2.472 20 0 BEADLO COC(=O)C[N@H+](Cc1cccs1)C(C)C ZINC000042518722 344457148 /nfs/dbraw/zinc/45/71/48/344457148.db2.gz DBWVEHSCAFSLPI-UHFFFAOYSA-N 1 2 227.329 2.132 20 0 BEADLO COC(=O)C[N@@H+](Cc1cccs1)C(C)C ZINC000042518722 344457149 /nfs/dbraw/zinc/45/71/49/344457149.db2.gz DBWVEHSCAFSLPI-UHFFFAOYSA-N 1 2 227.329 2.132 20 0 BEADLO O=C([C@H]1CC12CC2)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000622337957 344506536 /nfs/dbraw/zinc/50/65/36/344506536.db2.gz RBCMUOCGYLZEPV-MNOVXSKESA-N 1 2 245.326 2.263 20 0 BEADLO COc1ccc[nH+]c1N1CC[C@@H](C)[C@H](F)C1 ZINC000624088896 344494116 /nfs/dbraw/zinc/49/41/16/344494116.db2.gz ZOHQNCSQBJJVKH-NXEZZACHSA-N 1 2 224.279 2.275 20 0 BEADLO c1ccc(N2CC[C@@H]3OCCC[C@@H]3C2)[nH+]c1 ZINC000152434415 344563887 /nfs/dbraw/zinc/56/38/87/344563887.db2.gz SKZXBTOAAZCYIY-NEPJUHHUSA-N 1 2 218.300 2.087 20 0 BEADLO CC(C)[C@@H]1C[C@@H](Nc2cc[nH+]cc2F)CCO1 ZINC000641476745 362445159 /nfs/dbraw/zinc/44/51/59/362445159.db2.gz PWKMVHIZCOODPT-GWCFXTLKSA-N 1 2 238.306 2.258 20 0 BEADLO CC(C)C[C@@H](C)Nc1cc(CO)cc[nH+]1 ZINC000641457055 362431063 /nfs/dbraw/zinc/43/10/63/362431063.db2.gz NKQNGNNZEXUSBH-SNVBAGLBSA-N 1 2 208.305 2.420 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 ZINC000641461946 362436786 /nfs/dbraw/zinc/43/67/86/362436786.db2.gz ZNZLDZFAMIPKQN-BIMULSAOSA-N 1 2 248.301 2.012 20 0 BEADLO CCc1noc(CC)c1CNc1cc[nH+]cc1F ZINC000641428012 362412086 /nfs/dbraw/zinc/41/20/86/362412086.db2.gz FILBBZUNQAHSDR-UHFFFAOYSA-N 1 2 249.289 2.368 20 0 BEADLO CC(C)n1ccnc1SCc1cn(C)c[nH+]1 ZINC000641438742 362418469 /nfs/dbraw/zinc/41/84/69/362418469.db2.gz KKRJQFCABRERHI-UHFFFAOYSA-N 1 2 236.344 2.490 20 0 BEADLO CN(C[C@H]1CCCC[C@@H]1O)c1cc[nH+]cc1F ZINC000641483523 362450964 /nfs/dbraw/zinc/45/09/64/362450964.db2.gz RHNSAIFKSJRRIE-MFKMUULPSA-N 1 2 238.306 2.208 20 0 BEADLO CC(C)[C@H]1CN(c2cc[nH+]cc2F)CCO1 ZINC000641482757 362453873 /nfs/dbraw/zinc/45/38/73/362453873.db2.gz DZANRDOCXCBJAV-GFCCVEGCSA-N 1 2 224.279 2.082 20 0 BEADLO C[C@H]1C[C@@H](CCNc2cc[nH+]cc2F)CCO1 ZINC000641487910 362454725 /nfs/dbraw/zinc/45/47/25/362454725.db2.gz XBAJWZDATBBDAX-QWRGUYRKSA-N 1 2 238.306 2.260 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1CCO[C@@H](C2CC2)C1 ZINC000641491431 362459619 /nfs/dbraw/zinc/45/96/19/362459619.db2.gz PFRKFHALLAOEGJ-ZWNOBZJWSA-N 1 2 236.290 2.012 20 0 BEADLO C[C@H]1CCCCN(c2cc(CO)cc[nH+]2)C1 ZINC000641496691 362462139 /nfs/dbraw/zinc/46/21/39/362462139.db2.gz KKFXAAUUQNTXNC-NSHDSACASA-N 1 2 220.316 2.200 20 0 BEADLO CC1(C)CC[C@H](CNc2cc[nH+]cc2F)O1 ZINC000641503963 362466737 /nfs/dbraw/zinc/46/67/37/362466737.db2.gz QEHRHSKVZQHXBN-SECBINFHSA-N 1 2 224.279 2.012 20 0 BEADLO Fc1c[nH+]ccc1N1CCc2ncsc2C1 ZINC000641521311 362479318 /nfs/dbraw/zinc/47/93/18/362479318.db2.gz GRTVDRYJEVFAQJ-UHFFFAOYSA-N 1 2 235.287 2.240 20 0 BEADLO C[C@@H]1CN(c2cc[nH+]cc2F)[C@H](C)[C@H](C)O1 ZINC000641522873 362479931 /nfs/dbraw/zinc/47/99/31/362479931.db2.gz WXAUPHWNQGZWDL-BBBLOLIVSA-N 1 2 224.279 2.223 20 0 BEADLO CO[C@H]1CN(c2cc[nH+]cc2F)CC[C@H]1C ZINC000641523008 362480236 /nfs/dbraw/zinc/48/02/36/362480236.db2.gz XLGJVZTVRDAYEC-SKDRFNHKSA-N 1 2 224.279 2.082 20 0 BEADLO C[C@H]1CC2(CCC2)CN1c1cc(CO)cc[nH+]1 ZINC000641538101 362490305 /nfs/dbraw/zinc/49/03/05/362490305.db2.gz SDSYWHKFASTBSN-NSHDSACASA-N 1 2 232.327 2.343 20 0 BEADLO FCC[C@@H]1C[N@H+](Cc2cccc(F)c2)CCO1 ZINC000625998859 344660745 /nfs/dbraw/zinc/66/07/45/344660745.db2.gz AANDPAMGJNWLFB-CYBMUJFWSA-N 1 2 241.281 2.386 20 0 BEADLO FCC[C@@H]1C[N@@H+](Cc2cccc(F)c2)CCO1 ZINC000625998859 344660748 /nfs/dbraw/zinc/66/07/48/344660748.db2.gz AANDPAMGJNWLFB-CYBMUJFWSA-N 1 2 241.281 2.386 20 0 BEADLO FCC[C@H]1C[N@H+](Cc2ccccc2F)CCO1 ZINC000625999490 344660884 /nfs/dbraw/zinc/66/08/84/344660884.db2.gz VEYVFORJMFHIEC-LBPRGKRZSA-N 1 2 241.281 2.386 20 0 BEADLO FCC[C@H]1C[N@@H+](Cc2ccccc2F)CCO1 ZINC000625999490 344660886 /nfs/dbraw/zinc/66/08/86/344660886.db2.gz VEYVFORJMFHIEC-LBPRGKRZSA-N 1 2 241.281 2.386 20 0 BEADLO FCC[C@H]1C[N@H+](Cc2ccc(F)cc2)CCO1 ZINC000626000099 344661601 /nfs/dbraw/zinc/66/16/01/344661601.db2.gz IWYURTLDGOZYDT-ZDUSSCGKSA-N 1 2 241.281 2.386 20 0 BEADLO FCC[C@H]1C[N@@H+](Cc2ccc(F)cc2)CCO1 ZINC000626000099 344661602 /nfs/dbraw/zinc/66/16/02/344661602.db2.gz IWYURTLDGOZYDT-ZDUSSCGKSA-N 1 2 241.281 2.386 20 0 BEADLO C[C@H](c1ccncc1)[N@@H+]1CCO[C@H](CCF)C1 ZINC000626002012 344662435 /nfs/dbraw/zinc/66/24/35/344662435.db2.gz DMSOVQXQSGNTCK-DGCLKSJQSA-N 1 2 238.306 2.203 20 0 BEADLO C[C@H](c1ccncc1)[N@H+]1CCO[C@H](CCF)C1 ZINC000626002012 344662437 /nfs/dbraw/zinc/66/24/37/344662437.db2.gz DMSOVQXQSGNTCK-DGCLKSJQSA-N 1 2 238.306 2.203 20 0 BEADLO C[C@H](c1ccccn1)[N@@H+]1CCO[C@@H](CCF)C1 ZINC000626004260 344666343 /nfs/dbraw/zinc/66/63/43/344666343.db2.gz COGPRFVZLGOFCP-NEPJUHHUSA-N 1 2 238.306 2.203 20 0 BEADLO C[C@H](c1ccccn1)[N@H+]1CCO[C@@H](CCF)C1 ZINC000626004260 344666344 /nfs/dbraw/zinc/66/63/44/344666344.db2.gz COGPRFVZLGOFCP-NEPJUHHUSA-N 1 2 238.306 2.203 20 0 BEADLO OC[C@@H]1CCN(c2[nH+]ccc3ccccc32)C1 ZINC000168747613 344681507 /nfs/dbraw/zinc/68/15/07/344681507.db2.gz AHLXMJAWLDIPLF-LLVKDONJSA-N 1 2 228.295 2.053 20 0 BEADLO C[C@@H](CC(=O)NC1CC(C)(C)C1)n1cc[nH+]c1 ZINC000620735383 344677473 /nfs/dbraw/zinc/67/74/73/344677473.db2.gz GTOVKUSNHJADNE-JTQLQIEISA-N 1 2 235.331 2.139 20 0 BEADLO C[C@H](CC(=O)NC1CC(C)(C)C1)n1cc[nH+]c1 ZINC000620735384 344677602 /nfs/dbraw/zinc/67/76/02/344677602.db2.gz GTOVKUSNHJADNE-SNVBAGLBSA-N 1 2 235.331 2.139 20 0 BEADLO CC[N@@H+]1CCOC[C@H]1c1cccc(F)c1 ZINC000226173969 344720566 /nfs/dbraw/zinc/72/05/66/344720566.db2.gz RUXOFEXRINYRKA-LBPRGKRZSA-N 1 2 209.264 2.219 20 0 BEADLO CC[N@H+]1CCOC[C@H]1c1cccc(F)c1 ZINC000226173969 344720570 /nfs/dbraw/zinc/72/05/70/344720570.db2.gz RUXOFEXRINYRKA-LBPRGKRZSA-N 1 2 209.264 2.219 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1ccc2occc2c1 ZINC000289191891 344693155 /nfs/dbraw/zinc/69/31/55/344693155.db2.gz UMRNIJQZUBKQTK-UHFFFAOYSA-N 1 2 247.294 2.428 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1ccc2occc2c1 ZINC000289191891 344693158 /nfs/dbraw/zinc/69/31/58/344693158.db2.gz UMRNIJQZUBKQTK-UHFFFAOYSA-N 1 2 247.294 2.428 20 0 BEADLO C[C@H]1CC[C@H](CNc2cc(CO)cc[nH+]2)C1 ZINC000641547430 362494760 /nfs/dbraw/zinc/49/47/60/362494760.db2.gz QNXBLUPOMTVDTD-QWRGUYRKSA-N 1 2 220.316 2.422 20 0 BEADLO Cc1ccccc1C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000082285381 344714757 /nfs/dbraw/zinc/71/47/57/344714757.db2.gz DEQDMLTVVSSZIZ-LLVKDONJSA-N 1 2 243.310 2.220 20 0 BEADLO CC(C)[C@H](C)CC(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000075630058 344781958 /nfs/dbraw/zinc/78/19/58/344781958.db2.gz CHMXYKRRRAYGJA-NEPJUHHUSA-N 1 2 237.347 2.070 20 0 BEADLO CCN(Cc1[nH]cc(C)[nH+]1)CC(F)(F)F ZINC000628144017 344816024 /nfs/dbraw/zinc/81/60/24/344816024.db2.gz KOALHPYKUQYOSY-UHFFFAOYSA-N 1 2 221.226 2.102 20 0 BEADLO Cc1c[nH]c(CN(C)Cc2cnc(C)s2)[nH+]1 ZINC000628149437 344836089 /nfs/dbraw/zinc/83/60/89/344836089.db2.gz ZDBQJBCZHBXEEG-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1ccccc1[C@@H](O)CNc1cc[nH+]c(C)n1 ZINC000078251948 344837314 /nfs/dbraw/zinc/83/73/14/344837314.db2.gz IBUUQIBKIIQCPI-ZDUSSCGKSA-N 1 2 243.310 2.239 20 0 BEADLO CCCC[C@@H](COC)Nc1cc[nH+]c(C)n1 ZINC000078293048 344841808 /nfs/dbraw/zinc/84/18/08/344841808.db2.gz USYOUDUBGNECSW-NSHDSACASA-N 1 2 223.320 2.402 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2ccoc2)o1 ZINC000628152892 344841558 /nfs/dbraw/zinc/84/15/58/344841558.db2.gz RUBDCGFQNNOVEF-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2ccoc2)o1 ZINC000628152892 344841561 /nfs/dbraw/zinc/84/15/61/344841561.db2.gz RUBDCGFQNNOVEF-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO Cc1csc(SCc2[nH+]ccn2C)n1 ZINC000078384657 344858253 /nfs/dbraw/zinc/85/82/53/344858253.db2.gz JKRKUIAQKPBIAD-UHFFFAOYSA-N 1 2 225.342 2.477 20 0 BEADLO Cc1noc(C)c1C[C@H](C)Nc1cc[nH+]c(C)n1 ZINC000078294958 344843538 /nfs/dbraw/zinc/84/35/38/344843538.db2.gz JYUQLYBWIJNPDY-QMMMGPOBSA-N 1 2 246.314 2.433 20 0 BEADLO CC(C)(C)OC(=O)CCNc1cccc[nH+]1 ZINC000078305975 344844124 /nfs/dbraw/zinc/84/41/24/344844124.db2.gz WSJYZQLAPHUWGZ-UHFFFAOYSA-N 1 2 222.288 2.225 20 0 BEADLO CO[C@@H]1CCCC[C@@H]1Nc1cc[nH+]c(C)n1 ZINC000078426998 344867313 /nfs/dbraw/zinc/86/73/13/344867313.db2.gz UGFOXJUMQPRABG-WDEREUQCSA-N 1 2 221.304 2.155 20 0 BEADLO COC[C@H]([NH2+][C@H](C)c1ncc[nH]1)c1ccccc1 ZINC000234739198 537871367 /nfs/dbraw/zinc/87/13/67/537871367.db2.gz FEAMJYPOGMIAFI-YPMHNXCESA-N 1 2 245.326 2.448 20 0 BEADLO COC[C@@H]([NH2+][C@H](C)c1ncc[nH]1)c1ccccc1 ZINC000234748363 537871643 /nfs/dbraw/zinc/87/16/43/537871643.db2.gz FEAMJYPOGMIAFI-DGCLKSJQSA-N 1 2 245.326 2.448 20 0 BEADLO Cc1ccc(N[C@H]2CCOC[C@@H]2C)c[nH+]1 ZINC000192631494 178778196 /nfs/dbraw/zinc/77/81/96/178778196.db2.gz WUPINFZODLKAKR-CABZTGNLSA-N 1 2 206.289 2.227 20 0 BEADLO CC[C@H]1C[N@H+](Cc2nc(C)c[nH]2)CCS1 ZINC000628178952 344913507 /nfs/dbraw/zinc/91/35/07/344913507.db2.gz JFSBNRISCSBUOY-JTQLQIEISA-N 1 2 225.361 2.046 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2nc(C)c[nH]2)CCS1 ZINC000628178952 344913509 /nfs/dbraw/zinc/91/35/09/344913509.db2.gz JFSBNRISCSBUOY-JTQLQIEISA-N 1 2 225.361 2.046 20 0 BEADLO Cc1nc(C[N@H+]2CC=C(C)CC2)[nH]c1C ZINC000628179117 344914192 /nfs/dbraw/zinc/91/41/92/344914192.db2.gz OIKQEJVOPQFGAP-UHFFFAOYSA-N 1 2 205.305 2.179 20 0 BEADLO Cc1nc(C[N@@H+]2CC=C(C)CC2)[nH]c1C ZINC000628179117 344914196 /nfs/dbraw/zinc/91/41/96/344914196.db2.gz OIKQEJVOPQFGAP-UHFFFAOYSA-N 1 2 205.305 2.179 20 0 BEADLO Cc1[nH]c(CN2CC=C(C)CC2)[nH+]c1C ZINC000628179117 344914198 /nfs/dbraw/zinc/91/41/98/344914198.db2.gz OIKQEJVOPQFGAP-UHFFFAOYSA-N 1 2 205.305 2.179 20 0 BEADLO COc1ccc(N[C@@H]2CCOC(C)(C)C2)[nH+]c1 ZINC000234945894 537882133 /nfs/dbraw/zinc/88/21/33/537882133.db2.gz XRQIZCZCRNZPMC-SNVBAGLBSA-N 1 2 236.315 2.460 20 0 BEADLO CCC[C@H]1CCC[C@@H]1C(=O)NCCc1[nH]cc[nH+]1 ZINC000448955944 201777644 /nfs/dbraw/zinc/77/76/44/201777644.db2.gz YGQSFDDNQUTROV-RYUDHWBXSA-N 1 2 249.358 2.285 20 0 BEADLO CO[C@H]1CCCC[C@@H]1Nc1cc[nH+]cc1F ZINC000641555999 362500144 /nfs/dbraw/zinc/50/01/44/362500144.db2.gz SVPUFJJOMOFQOX-RYUDHWBXSA-N 1 2 224.279 2.012 20 0 BEADLO Fc1c[nH+]ccc1N1CCC[C@@H]1[C@@H]1CCCO1 ZINC000641560654 362500267 /nfs/dbraw/zinc/50/02/67/362500267.db2.gz FNTCRIUWYVRJOV-OLZOCXBDSA-N 1 2 236.290 2.369 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@H](OC(F)F)C1 ZINC000641558825 362503609 /nfs/dbraw/zinc/50/36/09/362503609.db2.gz ZYZWYNKUUTXHKZ-ZETCQYMHSA-N 1 2 232.205 2.039 20 0 BEADLO O[C@H](CNc1cccc[nH+]1)c1ccc(F)cc1 ZINC000079883443 345048269 /nfs/dbraw/zinc/04/82/69/345048269.db2.gz JLYMCGALOHWXFR-GFCCVEGCSA-N 1 2 232.258 2.366 20 0 BEADLO CN(C)c1[nH+]cccc1N(C)C(=O)CCC1CC1 ZINC000079724181 345028069 /nfs/dbraw/zinc/02/80/69/345028069.db2.gz SSPJZUGZZHZXEX-UHFFFAOYSA-N 1 2 247.342 2.301 20 0 BEADLO CCOC1(CNc2cc[nH+]cc2F)CCCC1 ZINC000641611808 362547511 /nfs/dbraw/zinc/54/75/11/362547511.db2.gz ZHNPBTMKUWNRBO-UHFFFAOYSA-N 1 2 238.306 2.404 20 0 BEADLO CO[C@@H]1CCN(c2cc[nH+]cc2F)C[C@@H]1C ZINC000641618398 362552161 /nfs/dbraw/zinc/55/21/61/362552161.db2.gz FZJAQUVMJXOHJE-JOYOIKCWSA-N 1 2 224.279 2.082 20 0 BEADLO CC(C)Cn1cc[nH+]c1CNC(=O)[C@@H]1CC1(C)C ZINC000155243409 345074876 /nfs/dbraw/zinc/07/48/76/345074876.db2.gz MAHJIKZXHXUKSV-NSHDSACASA-N 1 2 249.358 2.201 20 0 BEADLO OCc1cc[nH+]c(NC[C@@H]2CCCC2(F)F)c1 ZINC000641618873 362553343 /nfs/dbraw/zinc/55/33/43/362553343.db2.gz LFJIPPGMFMQYGN-JTQLQIEISA-N 1 2 242.269 2.421 20 0 BEADLO OCc1cc[nH+]c(NCC2(C(F)(F)F)CC2)c1 ZINC000641594207 362535744 /nfs/dbraw/zinc/53/57/44/362535744.db2.gz DZBQJILDZYVGFF-UHFFFAOYSA-N 1 2 246.232 2.328 20 0 BEADLO OCc1cc[nH+]c(NC[C@@H]2CCCSC2)c1 ZINC000641599550 362540523 /nfs/dbraw/zinc/54/05/23/362540523.db2.gz SDIPLXJMZOHDLT-NSHDSACASA-N 1 2 238.356 2.129 20 0 BEADLO CCC(CC)(CNc1cc(CO)cc[nH+]1)OC ZINC000641608838 362543122 /nfs/dbraw/zinc/54/31/22/362543122.db2.gz ZINNAHKHDSJZJB-UHFFFAOYSA-N 1 2 238.331 2.191 20 0 BEADLO CC(F)(F)CCNc1cc[nH+]cc1F ZINC000641612886 362545518 /nfs/dbraw/zinc/54/55/18/362545518.db2.gz LKRBMFVDNBFVNU-UHFFFAOYSA-N 1 2 204.195 2.100 20 0 BEADLO C[C@H](CNc1cc(CO)cc[nH+]1)CC(F)F ZINC000641646763 362574841 /nfs/dbraw/zinc/57/48/41/362574841.db2.gz WDJZCUNWDHMOEC-QMMMGPOBSA-N 1 2 230.258 2.277 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@@]2(CC2(F)F)C1 ZINC000641652055 362578915 /nfs/dbraw/zinc/57/89/15/362578915.db2.gz MQGKSAUJRARGMS-SNVBAGLBSA-N 1 2 228.217 2.456 20 0 BEADLO CC1(C)C[C@H](CNc2cc[nH+]cc2F)CCO1 ZINC000641624008 362555451 /nfs/dbraw/zinc/55/54/51/362555451.db2.gz COAXMDCRSCYBPX-SNVBAGLBSA-N 1 2 238.306 2.260 20 0 BEADLO COC1CCC(Nc2cc[nH+]cc2F)CC1 ZINC000641628748 362558937 /nfs/dbraw/zinc/55/89/37/362558937.db2.gz QNORGTGNAIMBGY-UHFFFAOYSA-N 1 2 224.279 2.012 20 0 BEADLO CCn1cc([C@H](C)Nc2cc[nH+]cc2F)cn1 ZINC000641629467 362559396 /nfs/dbraw/zinc/55/93/96/362559396.db2.gz LLUSZPCQEMXUSM-VIFPVBQESA-N 1 2 234.278 2.032 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1Nc1cc(CO)cc[nH+]1 ZINC000641631052 362563154 /nfs/dbraw/zinc/56/31/54/362563154.db2.gz XHKQGDDAYLEOON-DGCLKSJQSA-N 1 2 220.316 2.420 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1Nc1cc(CO)cc[nH+]1 ZINC000641631053 362563457 /nfs/dbraw/zinc/56/34/57/362563457.db2.gz XHKQGDDAYLEOON-WCQYABFASA-N 1 2 220.316 2.420 20 0 BEADLO CO[C@@H](CNc1cc(CO)cc[nH+]1)CC(C)C ZINC000641637972 362566340 /nfs/dbraw/zinc/56/63/40/362566340.db2.gz MZXJXYGZMDOFPE-GFCCVEGCSA-N 1 2 238.331 2.047 20 0 BEADLO OCc1cc[nH+]c(N2CC[C@@H](C3CCC3)C2)c1 ZINC000641639143 362567220 /nfs/dbraw/zinc/56/72/20/362567220.db2.gz UJFWVBPTHOIAAO-CYBMUJFWSA-N 1 2 232.327 2.200 20 0 BEADLO CCCCNC(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC000635065289 345237256 /nfs/dbraw/zinc/23/72/56/345237256.db2.gz LGVZWWNXEUFBEH-LBPRGKRZSA-N 1 2 237.347 2.387 20 0 BEADLO CCc1c[nH]c(CC(=O)N2C[C@H](C)C[C@H](C)C2)[nH+]1 ZINC000635066246 345237792 /nfs/dbraw/zinc/23/77/92/345237792.db2.gz ZPWKETHZBGDFBS-PHIMTYICSA-N 1 2 249.358 2.019 20 0 BEADLO CC(C)CNC(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC000635087051 345243611 /nfs/dbraw/zinc/24/36/11/345243611.db2.gz OLLCZPFKZNWNHA-GFCCVEGCSA-N 1 2 237.347 2.243 20 0 BEADLO Cc1cn2ccc(C(=O)N[C@H](C)C3CC3)cc2[nH+]1 ZINC000635125024 345252904 /nfs/dbraw/zinc/25/29/04/345252904.db2.gz FCZIURFCQYIKGM-SNVBAGLBSA-N 1 2 243.310 2.171 20 0 BEADLO CC(C)C[C@H](C(=O)N(C)C(C)C)n1cc[nH+]c1 ZINC000635225708 345278667 /nfs/dbraw/zinc/27/86/67/345278667.db2.gz LPFIEHUXHUUDOR-GFCCVEGCSA-N 1 2 237.347 2.337 20 0 BEADLO CCc1c[nH]c(CC(=O)N(C)CCC(C)C)[nH+]1 ZINC000635249177 345286148 /nfs/dbraw/zinc/28/61/48/345286148.db2.gz QKFABWVHALRGBT-UHFFFAOYSA-N 1 2 237.347 2.019 20 0 BEADLO Cc1cc(N[C@@H]2C[C@H]2C2CCC2)nc[nH+]1 ZINC000425276912 192086984 /nfs/dbraw/zinc/08/69/84/192086984.db2.gz WOBAIYKRHYPDJY-WDEREUQCSA-N 1 2 203.289 2.386 20 0 BEADLO CC(C)=C(C)CC(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000635326009 345308285 /nfs/dbraw/zinc/30/82/85/345308285.db2.gz ADEJLRYSUGPANW-GFCCVEGCSA-N 1 2 235.331 2.134 20 0 BEADLO CC(C)C[C@@H](C(=O)N[C@@H]1CC1(C)C)n1cc[nH+]c1 ZINC000635406984 345351053 /nfs/dbraw/zinc/35/10/53/345351053.db2.gz PRRDWCKZVCITMN-NWDGAFQWSA-N 1 2 249.358 2.385 20 0 BEADLO c1cc(N[C@@H]2C[C@H]2C2CCC2)nc(C2CC2)[nH+]1 ZINC000425276138 192087796 /nfs/dbraw/zinc/08/77/96/192087796.db2.gz VBYGJDCEXLPEOO-NWDGAFQWSA-N 1 2 229.327 2.376 20 0 BEADLO CCc1c[nH]c(CC(=O)N(C)CC2CCCC2)[nH+]1 ZINC000635449743 345376664 /nfs/dbraw/zinc/37/66/64/345376664.db2.gz GQRVOLUJWOUWKD-UHFFFAOYSA-N 1 2 249.358 2.163 20 0 BEADLO CCC[C@H]([NH2+]CC(C)(C)OCC)C(=O)OCC ZINC000159386063 345431234 /nfs/dbraw/zinc/43/12/34/345431234.db2.gz OABAIJGRPXTMJY-NSHDSACASA-N 1 2 245.363 2.123 20 0 BEADLO Cc1nc2[nH]ccc2c(NCCCOC(C)C)[nH+]1 ZINC000080944840 345454205 /nfs/dbraw/zinc/45/42/05/345454205.db2.gz AWBMFUOWQIGMLV-UHFFFAOYSA-N 1 2 248.330 2.493 20 0 BEADLO C[C@H](c1ccncc1)[N@H+](C)Cc1cnccn1 ZINC000080964829 345455644 /nfs/dbraw/zinc/45/56/44/345455644.db2.gz DRHURDZDKFEVOW-LLVKDONJSA-N 1 2 228.299 2.065 20 0 BEADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1cnccn1 ZINC000080964829 345455646 /nfs/dbraw/zinc/45/56/46/345455646.db2.gz DRHURDZDKFEVOW-LLVKDONJSA-N 1 2 228.299 2.065 20 0 BEADLO CC(C)(C)c1nc(NC[C@@H]2CCCO2)cc[nH+]1 ZINC000080761659 345449360 /nfs/dbraw/zinc/44/93/60/345449360.db2.gz ITGFIKRRIUYKEP-JTQLQIEISA-N 1 2 235.331 2.365 20 0 BEADLO COC[C@H](C)Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000080762776 345449974 /nfs/dbraw/zinc/44/99/74/345449974.db2.gz ODYRNNHLRARSEX-VIFPVBQESA-N 1 2 223.320 2.221 20 0 BEADLO CCc1c[nH]c(CC(=O)NC(C)(C)C(C)C)[nH+]1 ZINC000635489480 345396329 /nfs/dbraw/zinc/39/63/29/345396329.db2.gz KHUQPARJYHSELE-UHFFFAOYSA-N 1 2 237.347 2.065 20 0 BEADLO CC(C)C(C)(C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635490776 345397472 /nfs/dbraw/zinc/39/74/72/345397472.db2.gz WGPULSFZIWVVEL-NXEZZACHSA-N 1 2 235.331 2.064 20 0 BEADLO CC(C)C(C)(C)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635490776 345397474 /nfs/dbraw/zinc/39/74/74/345397474.db2.gz WGPULSFZIWVVEL-NXEZZACHSA-N 1 2 235.331 2.064 20 0 BEADLO Cn1cc[nH+]c1[C@@H](NC(=O)C1CCCC1)C1CC1 ZINC000082278152 345501280 /nfs/dbraw/zinc/50/12/80/345501280.db2.gz HTHXJHBSWPPPSF-LBPRGKRZSA-N 1 2 247.342 2.178 20 0 BEADLO C[C@@H]1CCN(c2cc[nH+]cc2F)C[C@H](C)O1 ZINC000641661843 362586870 /nfs/dbraw/zinc/58/68/70/362586870.db2.gz ZYZIZMDUTKQTEZ-ZJUUUORDSA-N 1 2 224.279 2.224 20 0 BEADLO CO[C@H](CNc1cc[nH+]cc1F)C1CCCC1 ZINC000641667575 362589615 /nfs/dbraw/zinc/58/96/15/362589615.db2.gz SFNPSDQFWQMGPA-CYBMUJFWSA-N 1 2 238.306 2.260 20 0 BEADLO CC[C@@H](COC)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000081002452 345458043 /nfs/dbraw/zinc/45/80/43/345458043.db2.gz NXNAZWFYMOGQFM-VIFPVBQESA-N 1 2 234.303 2.103 20 0 BEADLO COCC[C@H](C)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000080985661 345458209 /nfs/dbraw/zinc/45/82/09/345458209.db2.gz WMDJZQABAGGQTQ-QMMMGPOBSA-N 1 2 234.303 2.103 20 0 BEADLO C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)Cn1cc[nH+]c1 ZINC000081410444 345472478 /nfs/dbraw/zinc/47/24/78/345472478.db2.gz GMQQWBWKJWZSRH-UPJWGTAASA-N 1 2 247.342 2.063 20 0 BEADLO C[C@@H](O)C[C@@H](C)CNc1cc[nH+]c2ccncc12 ZINC000085687900 345529030 /nfs/dbraw/zinc/52/90/30/345529030.db2.gz VXEGRXGYLCSOBS-GHMZBOCLSA-N 1 2 245.326 2.449 20 0 BEADLO Cc1cc(N2CCOCC[C@H]2C)nc(C2CC2)[nH+]1 ZINC000089269500 345552829 /nfs/dbraw/zinc/55/28/29/345552829.db2.gz ZJXLGGHVJVIWOB-LLVKDONJSA-N 1 2 247.342 2.278 20 0 BEADLO Cc1cc(CN(C)c2[nH]c3ccccc3[nH+]2)no1 ZINC000091429203 345592121 /nfs/dbraw/zinc/59/21/21/345592121.db2.gz XEMCYRIDJJPOEW-UHFFFAOYSA-N 1 2 242.282 2.496 20 0 BEADLO c1cn(CCCNc2nnc(C3CC3)s2)c[nH+]1 ZINC000091424556 345592278 /nfs/dbraw/zinc/59/22/78/345592278.db2.gz VLANCHSYWGZKJV-UHFFFAOYSA-N 1 2 249.343 2.114 20 0 BEADLO CC1(C[NH2+]c2ccc(-n3cnnn3)cc2)CCC1 ZINC000434778881 537900428 /nfs/dbraw/zinc/90/04/28/537900428.db2.gz VRQJXRFWGKRDOJ-UHFFFAOYSA-N 1 2 243.314 2.264 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)s1 ZINC000092017107 345614819 /nfs/dbraw/zinc/61/48/19/345614819.db2.gz KRGNJZNZHBRNAR-VHSXEESVSA-N 1 2 240.372 2.315 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@@H](C)OC[C@@H]2C)s1 ZINC000092017107 345614820 /nfs/dbraw/zinc/61/48/20/345614820.db2.gz KRGNJZNZHBRNAR-VHSXEESVSA-N 1 2 240.372 2.315 20 0 BEADLO CSC1(CNc2cc[nH+]cc2F)CCC1 ZINC000603368656 349934417 /nfs/dbraw/zinc/93/44/17/349934417.db2.gz ZJPLOKQKSVCKRI-UHFFFAOYSA-N 1 2 226.320 2.340 20 0 BEADLO CCC(F)(F)CNc1cc[nH+]cc1F ZINC000641677620 362598549 /nfs/dbraw/zinc/59/85/49/362598549.db2.gz KQQWEUBUQACVEV-UHFFFAOYSA-N 1 2 204.195 2.100 20 0 BEADLO Fc1c[nH+]ccc1N[C@H]1CCCC12CC2 ZINC000641680166 362601782 /nfs/dbraw/zinc/60/17/82/362601782.db2.gz LLSHNUUIOJHGKS-NSHDSACASA-N 1 2 206.264 2.387 20 0 BEADLO OCc1cc[nH+]c(N[C@H]2CCCC23CC3)c1 ZINC000641680498 362602152 /nfs/dbraw/zinc/60/21/52/362602152.db2.gz RLQVRWAXBBSGIV-NSHDSACASA-N 1 2 218.300 2.319 20 0 BEADLO COc1ccsc1C[N@@H+]1CCO[C@H](C)[C@H]1C ZINC000093417901 345671020 /nfs/dbraw/zinc/67/10/20/345671020.db2.gz LEFQQNFFDURJHG-NXEZZACHSA-N 1 2 241.356 2.366 20 0 BEADLO COc1ccsc1C[N@H+]1CCO[C@H](C)[C@H]1C ZINC000093417901 345671022 /nfs/dbraw/zinc/67/10/22/345671022.db2.gz LEFQQNFFDURJHG-NXEZZACHSA-N 1 2 241.356 2.366 20 0 BEADLO COc1ccsc1C[N@@H+]1CCO[C@H](C)[C@@H]1C ZINC000093417902 345671037 /nfs/dbraw/zinc/67/10/37/345671037.db2.gz LEFQQNFFDURJHG-VHSXEESVSA-N 1 2 241.356 2.366 20 0 BEADLO COc1ccsc1C[N@H+]1CCO[C@H](C)[C@@H]1C ZINC000093417902 345671038 /nfs/dbraw/zinc/67/10/38/345671038.db2.gz LEFQQNFFDURJHG-VHSXEESVSA-N 1 2 241.356 2.366 20 0 BEADLO CC(C)([NH2+]Cc1ccncc1N)c1nccs1 ZINC000641728434 362649239 /nfs/dbraw/zinc/64/92/39/362649239.db2.gz SSKVFSPSOMVTKE-UHFFFAOYSA-N 1 2 248.355 2.145 20 0 BEADLO Cc1cc(N(C)CC(=O)OC(C)(C)C)cc[nH+]1 ZINC000418930493 192089882 /nfs/dbraw/zinc/08/98/82/192089882.db2.gz XYYQPRCSEOHVHY-UHFFFAOYSA-N 1 2 236.315 2.168 20 0 BEADLO c1cn(-c2ccccc2OC[C@@H]2CCCO2)c[nH+]1 ZINC000221740734 345747163 /nfs/dbraw/zinc/74/71/63/345747163.db2.gz ATRLHKDJANBNPR-LBPRGKRZSA-N 1 2 244.294 2.430 20 0 BEADLO CC(=O)c1ccc(C[N@H+]2CCOC[C@H]2C)cc1 ZINC000215868917 349937979 /nfs/dbraw/zinc/93/79/79/349937979.db2.gz AUYXJBXCMXMRLL-LLVKDONJSA-N 1 2 233.311 2.110 20 0 BEADLO CC(=O)c1ccc(C[N@@H+]2CCOC[C@H]2C)cc1 ZINC000215868917 349937983 /nfs/dbraw/zinc/93/79/83/349937983.db2.gz AUYXJBXCMXMRLL-LLVKDONJSA-N 1 2 233.311 2.110 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1CCC[C@H]2C[C@H]21 ZINC000668420253 537910492 /nfs/dbraw/zinc/91/04/92/537910492.db2.gz YTIKCFYFMGGFBT-QJPTWQEYSA-N 1 2 230.311 2.187 20 0 BEADLO Cn1c2cccc(F)c2[nH]c1=[NH+]C[C@@H]1CC12CC2 ZINC000418981963 192090954 /nfs/dbraw/zinc/09/09/54/192090954.db2.gz RAEVHZKWGUWNAN-VIFPVBQESA-N 1 2 245.301 2.346 20 0 BEADLO Cc1c[nH+]ccc1N(C)CC(=O)OC(C)(C)C ZINC000418916725 192090973 /nfs/dbraw/zinc/09/09/73/192090973.db2.gz HPQOZWVCHZVIBZ-UHFFFAOYSA-N 1 2 236.315 2.168 20 0 BEADLO C[C@@H]1CCCCCN1C(=O)CCCn1cc[nH+]c1 ZINC000074650406 345796880 /nfs/dbraw/zinc/79/68/80/345796880.db2.gz MILNWVIUEZDPHK-CYBMUJFWSA-N 1 2 249.358 2.454 20 0 BEADLO Fc1ccc2[nH+]c(NCc3cc[nH]n3)[nH]c2c1 ZINC000236187478 537912448 /nfs/dbraw/zinc/91/24/48/537912448.db2.gz NIDROFQIQIHUAW-UHFFFAOYSA-N 1 2 231.234 2.037 20 0 BEADLO Cc1ccccc1CC(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000140924849 345825358 /nfs/dbraw/zinc/82/53/58/345825358.db2.gz YJCRQUYBIXRMDD-LLVKDONJSA-N 1 2 243.310 2.138 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CCC[C@@H](C)[C@H]2C)[nH+]1 ZINC000635602616 345888164 /nfs/dbraw/zinc/88/81/64/345888164.db2.gz JGFSCIKWUGAZTR-GHMZBOCLSA-N 1 2 249.358 2.162 20 0 BEADLO CCC[C@@H]([NH2+]CCc1cccc(C)c1)C(=O)OC ZINC000449258525 201851539 /nfs/dbraw/zinc/85/15/39/201851539.db2.gz PQSSAYNITFNNHG-CQSZACIVSA-N 1 2 249.354 2.469 20 0 BEADLO C[C@@H]1C[C@H](Nc2cc[nH+]c3ccncc23)[C@@H](C)O1 ZINC000631466439 345874510 /nfs/dbraw/zinc/87/45/10/345874510.db2.gz VXISTKQIGCSPLO-RULNRJAQSA-N 1 2 243.310 2.030 20 0 BEADLO CC(C)C[C@H](C(=O)N1CCC[C@@H]1C)n1cc[nH+]c1 ZINC000635628867 345903391 /nfs/dbraw/zinc/90/33/91/345903391.db2.gz RVGRGVDWCYFAEB-QWHCGFSZSA-N 1 2 249.358 2.481 20 0 BEADLO CCc1c[nH]c(CC(=O)N2C[C@@H](C)C[C@@H]2CC)[nH+]1 ZINC000635636171 345910783 /nfs/dbraw/zinc/91/07/83/345910783.db2.gz XXZQPUANBYZOLJ-JQWIXIFHSA-N 1 2 249.358 2.162 20 0 BEADLO C[C@@H]1C[C@@H](Nc2cc(NC3CC3)[nH+]cn2)[C@@H](C)O1 ZINC000631466785 345921657 /nfs/dbraw/zinc/92/16/57/345921657.db2.gz XAUXHQWXGBGPDG-FXPVBKGRSA-N 1 2 248.330 2.029 20 0 BEADLO C[C@@H]1C[C@@H](Nc2cc(NC3CC3)nc[nH+]2)[C@@H](C)O1 ZINC000631466785 345921659 /nfs/dbraw/zinc/92/16/59/345921659.db2.gz XAUXHQWXGBGPDG-FXPVBKGRSA-N 1 2 248.330 2.029 20 0 BEADLO CC1(C)CCC[C@@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635655168 345934117 /nfs/dbraw/zinc/93/41/17/345934117.db2.gz NPGSYWGRPWOSTC-FOGDFJRCSA-N 1 2 247.342 2.208 20 0 BEADLO CC1(C)CCC[C@@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635655168 345934121 /nfs/dbraw/zinc/93/41/21/345934121.db2.gz NPGSYWGRPWOSTC-FOGDFJRCSA-N 1 2 247.342 2.208 20 0 BEADLO COc1cccc2c(NCCCCO)cc[nH+]c12 ZINC000145633123 345940002 /nfs/dbraw/zinc/94/00/02/345940002.db2.gz ODKTWWAIEYTRON-UHFFFAOYSA-N 1 2 246.310 2.428 20 0 BEADLO CCCCN(CC)c1cc(NC)[nH+]cn1 ZINC000087800891 345941280 /nfs/dbraw/zinc/94/12/80/345941280.db2.gz SHNPAGHFSQPFAU-UHFFFAOYSA-N 1 2 208.309 2.145 20 0 BEADLO CCCCN(CC)c1cc(NC)nc[nH+]1 ZINC000087800891 345941281 /nfs/dbraw/zinc/94/12/81/345941281.db2.gz SHNPAGHFSQPFAU-UHFFFAOYSA-N 1 2 208.309 2.145 20 0 BEADLO CC[C@@H]1CCC[C@@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635677443 345974831 /nfs/dbraw/zinc/97/48/31/345974831.db2.gz SDPLFVRZRFBFOA-KKOKHZNYSA-N 1 2 247.342 2.208 20 0 BEADLO CC[C@@H]1CCC[C@@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635677443 345974833 /nfs/dbraw/zinc/97/48/33/345974833.db2.gz SDPLFVRZRFBFOA-KKOKHZNYSA-N 1 2 247.342 2.208 20 0 BEADLO Cc1csc([C@H](C)[NH2+]Cc2ccno2)n1 ZINC000380305368 345981251 /nfs/dbraw/zinc/98/12/51/345981251.db2.gz FLMVFYKJRHIDDQ-QMMMGPOBSA-N 1 2 223.301 2.290 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)C1CCCC1 ZINC000074859410 345981838 /nfs/dbraw/zinc/98/18/38/345981838.db2.gz AVFTXNVUAXPNDF-UHFFFAOYSA-N 1 2 229.283 2.463 20 0 BEADLO c1nc(NC2CC2)cc(NC[C@@H]2CC23CC3)[nH+]1 ZINC000418973958 192093571 /nfs/dbraw/zinc/09/35/71/192093571.db2.gz FJVYCNSOHADGAC-VIFPVBQESA-N 1 2 230.315 2.263 20 0 BEADLO c1nc(NC[C@@H]2CC23CC3)cc(NC2CC2)[nH+]1 ZINC000418973958 192093573 /nfs/dbraw/zinc/09/35/73/192093573.db2.gz FJVYCNSOHADGAC-VIFPVBQESA-N 1 2 230.315 2.263 20 0 BEADLO Cc1cc(N2C[C@H](C)[C@H](C)[C@H]2C)nc[nH+]1 ZINC000419019696 192094846 /nfs/dbraw/zinc/09/48/46/192094846.db2.gz QXGQGYLUXNMWGE-INTQDDNPSA-N 1 2 205.305 2.266 20 0 BEADLO c1cc(C[N@H+](C2CC2)C2COC2)cs1 ZINC000449352450 201879037 /nfs/dbraw/zinc/87/90/37/201879037.db2.gz VMWCDJWFFRVSAP-UHFFFAOYSA-N 1 2 209.314 2.111 20 0 BEADLO c1cc(C[N@@H+](C2CC2)C2COC2)cs1 ZINC000449352450 201879041 /nfs/dbraw/zinc/87/90/41/201879041.db2.gz VMWCDJWFFRVSAP-UHFFFAOYSA-N 1 2 209.314 2.111 20 0 BEADLO CCc1cc(N(C)C[C@H]2CCCCO2)nc[nH+]1 ZINC000603385038 349941652 /nfs/dbraw/zinc/94/16/52/349941652.db2.gz WIRHZTADJODBLH-GFCCVEGCSA-N 1 2 235.331 2.044 20 0 BEADLO CCc1[nH]c(CNC(=O)C[C@H](C)CC)c[nH+]1 ZINC001639093567 1172073558 /nfs/dbraw/zinc/07/35/58/1172073558.db2.gz JDCKCLGETAADJK-SECBINFHSA-N 1 2 223.320 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)C[C@H](C)CC)[nH+]1 ZINC001639093567 1172073566 /nfs/dbraw/zinc/07/35/66/1172073566.db2.gz JDCKCLGETAADJK-SECBINFHSA-N 1 2 223.320 2.025 20 0 BEADLO CCc1c[nH]c(CC(=O)NC[C@@H]2CC[C@H](C)C2)[nH+]1 ZINC000635882153 346100680 /nfs/dbraw/zinc/10/06/80/346100680.db2.gz SYAGQEQXKXTJNV-WDEREUQCSA-N 1 2 249.358 2.067 20 0 BEADLO CCc1c[nH]c(CC(=O)NC[C@@H]2CCC[C@H]2C)[nH+]1 ZINC000635893202 346104283 /nfs/dbraw/zinc/10/42/83/346104283.db2.gz MNKFBACTUAPSOI-MNOVXSKESA-N 1 2 249.358 2.067 20 0 BEADLO CC(C)C[C@@H](C(=O)N1CC=CCC1)n1cc[nH+]c1 ZINC000635777510 346062878 /nfs/dbraw/zinc/06/28/78/346062878.db2.gz ADFOGVMGLVQPGT-ZDUSSCGKSA-N 1 2 247.342 2.259 20 0 BEADLO Cc1sccc1C[NH2+]C(CF)CF ZINC000449378340 201894223 /nfs/dbraw/zinc/89/42/23/201894223.db2.gz DGFPUBNEKLHIPX-UHFFFAOYSA-N 1 2 205.273 2.454 20 0 BEADLO CC(C)=C(C)CC(=O)N[C@H]1CCc2c[nH+]cn2C1 ZINC000635918693 346109698 /nfs/dbraw/zinc/10/96/98/346109698.db2.gz SKRGHPXBYMXUIM-LBPRGKRZSA-N 1 2 247.342 2.061 20 0 BEADLO O=C(C1CCC=CCC1)N1CCc2[nH]c[nH+]c2C1 ZINC000635943355 346118142 /nfs/dbraw/zinc/11/81/42/346118142.db2.gz MNLJPJFNKOCFFN-UHFFFAOYSA-N 1 2 245.326 2.041 20 0 BEADLO O=C(C1CCC=CCC1)N1CCc2[nH+]c[nH]c2C1 ZINC000635943355 346118145 /nfs/dbraw/zinc/11/81/45/346118145.db2.gz MNLJPJFNKOCFFN-UHFFFAOYSA-N 1 2 245.326 2.041 20 0 BEADLO Cc1nc(N[C@@H]2COCc3ccccc32)cc[nH+]1 ZINC000418999142 192096983 /nfs/dbraw/zinc/09/69/83/192096983.db2.gz QPRCLDKRPYEHRM-CYBMUJFWSA-N 1 2 241.294 2.468 20 0 BEADLO Cc1cn2ccc(C(=O)N3C[C@@H](C)[C@@H]3C)cc2[nH+]1 ZINC000635966535 346125705 /nfs/dbraw/zinc/12/57/05/346125705.db2.gz RBUCDNOEHIHTCG-KOLCDFICSA-N 1 2 243.310 2.123 20 0 BEADLO Cc1nc(C)c(CNc2ccc(N(C)C)c[nH+]2)o1 ZINC000628229581 346178375 /nfs/dbraw/zinc/17/83/75/346178375.db2.gz ZODSEPGSNWAWEV-UHFFFAOYSA-N 1 2 246.314 2.365 20 0 BEADLO C[C@H](CC(C)(C)C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636011963 346153049 /nfs/dbraw/zinc/15/30/49/346153049.db2.gz AAKUVJVXWYLASW-GMTAPVOTSA-N 1 2 249.358 2.454 20 0 BEADLO C[C@H](CC(C)(C)C)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636011963 346153053 /nfs/dbraw/zinc/15/30/53/346153053.db2.gz AAKUVJVXWYLASW-GMTAPVOTSA-N 1 2 249.358 2.454 20 0 BEADLO C[C@@H](CC(C)(C)C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636011964 346153473 /nfs/dbraw/zinc/15/34/73/346153473.db2.gz AAKUVJVXWYLASW-HBNTYKKESA-N 1 2 249.358 2.454 20 0 BEADLO C[C@@H](CC(C)(C)C)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636011964 346153475 /nfs/dbraw/zinc/15/34/75/346153475.db2.gz AAKUVJVXWYLASW-HBNTYKKESA-N 1 2 249.358 2.454 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@@H]2C[C@H]2CC(C)C)[nH+]1 ZINC000636016537 346157052 /nfs/dbraw/zinc/15/70/52/346157052.db2.gz DSIHTQHCRPMSDC-ZYHUDNBSSA-N 1 2 249.358 2.065 20 0 BEADLO Cc1cc(C(=O)NC[C@H]2C[C@H]2C)c2[nH+]ccn2c1 ZINC000624108352 346207411 /nfs/dbraw/zinc/20/74/11/346207411.db2.gz RIJTWLGRYBELPQ-GHMZBOCLSA-N 1 2 243.310 2.029 20 0 BEADLO Cc1c[nH]c(C[NH+]2CC(C)(C)OC(C)(C)C2)n1 ZINC000628245434 346208529 /nfs/dbraw/zinc/20/85/29/346208529.db2.gz XAVVJDBRHPCSEH-UHFFFAOYSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2cccnc2)o1 ZINC000628234575 346187646 /nfs/dbraw/zinc/18/76/46/346187646.db2.gz FUHRYFJLMZQCHK-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2cccnc2)o1 ZINC000628234575 346187648 /nfs/dbraw/zinc/18/76/48/346187648.db2.gz FUHRYFJLMZQCHK-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO CCCc1ncc(C[NH2+]Cc2cc(C)no2)o1 ZINC000631153384 346227258 /nfs/dbraw/zinc/22/72/58/346227258.db2.gz USUAKXZVSGTUIS-UHFFFAOYSA-N 1 2 235.287 2.213 20 0 BEADLO Cc1[nH]c(CN2CC(C)(C)OC[C@@H]2C)[nH+]c1C ZINC000628252494 346224937 /nfs/dbraw/zinc/22/49/37/346224937.db2.gz WXUKKONUYUDPAN-VIFPVBQESA-N 1 2 237.347 2.026 20 0 BEADLO Cc1[nH]c(CN(C)Cc2cnccc2C)[nH+]c1C ZINC000628256462 346254364 /nfs/dbraw/zinc/25/43/64/346254364.db2.gz XVGMCHMJUDBVLR-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO COCc1cc(C[NH2+]Cc2occc2C)no1 ZINC000641756241 362681415 /nfs/dbraw/zinc/68/14/15/362681415.db2.gz GNZDBIDIGGJBPQ-UHFFFAOYSA-N 1 2 236.271 2.012 20 0 BEADLO CC(C)=C(C)CC(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000636169202 346344938 /nfs/dbraw/zinc/34/49/38/346344938.db2.gz ORNFTPKCVYGBSI-UHFFFAOYSA-N 1 2 221.304 2.115 20 0 BEADLO CC(C)=C(C)CC(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000636169202 346344940 /nfs/dbraw/zinc/34/49/40/346344940.db2.gz ORNFTPKCVYGBSI-UHFFFAOYSA-N 1 2 221.304 2.115 20 0 BEADLO C[C@H](CC(=O)OC(C)(C)C)[NH2+][C@H](C)C(F)F ZINC000603431475 349953375 /nfs/dbraw/zinc/95/33/75/349953375.db2.gz YCBPBMCELHSUBK-HTQZYQBOSA-N 1 2 237.290 2.350 20 0 BEADLO CCCC[C@H]([NH2+]CC[C@@H](C)F)C(=O)OC ZINC000419171070 192101961 /nfs/dbraw/zinc/10/19/61/192101961.db2.gz IIEYEIZBKDXVRV-ZJUUUORDSA-N 1 2 219.300 2.056 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2nccn2C)c1 ZINC000272473887 179068334 /nfs/dbraw/zinc/06/83/34/179068334.db2.gz AHUNZZNGEJWWCG-UHFFFAOYSA-N 1 2 229.327 2.361 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2nccn2C)c1 ZINC000272473887 179068335 /nfs/dbraw/zinc/06/83/35/179068335.db2.gz AHUNZZNGEJWWCG-UHFFFAOYSA-N 1 2 229.327 2.361 20 0 BEADLO Cc1cccc(C[N@@H+](C)[C@@H](C)c2nncn2C)c1 ZINC000286690066 179069065 /nfs/dbraw/zinc/06/90/65/179069065.db2.gz BNTSBQQRLCOIBJ-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cccc(C[N@H+](C)[C@@H](C)c2nncn2C)c1 ZINC000286690066 179069066 /nfs/dbraw/zinc/06/90/66/179069066.db2.gz BNTSBQQRLCOIBJ-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cccc(C[N@H+]2CCOC[C@H]2C)c1F ZINC000294759055 179078253 /nfs/dbraw/zinc/07/82/53/179078253.db2.gz IQVQMRCYVKIVCN-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cccc(C[N@@H+]2CCOC[C@H]2C)c1F ZINC000294759055 179078254 /nfs/dbraw/zinc/07/82/54/179078254.db2.gz IQVQMRCYVKIVCN-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1n[nH]cc1[C@@H](C)[NH2+][C@@H](C)C(F)F ZINC000641792289 362727753 /nfs/dbraw/zinc/72/77/53/362727753.db2.gz TXVIIAJJXUVONV-VDTYLAMSSA-N 1 2 203.236 2.022 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CC[C@H]3CCC[C@@H]3C2)c[nH+]1 ZINC000332747597 346428743 /nfs/dbraw/zinc/42/87/43/346428743.db2.gz OEBJCAHXFVNXJN-IJLUTSLNSA-N 1 2 247.342 2.417 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)N[C@@H](C)C(F)F ZINC000641791636 362731733 /nfs/dbraw/zinc/73/17/33/362731733.db2.gz LKERPIWVMJURMS-YUMQZZPRSA-N 1 2 217.263 2.207 20 0 BEADLO C[C@H](NCc1cccc2[nH+]ccn21)C(F)F ZINC000641794226 362734523 /nfs/dbraw/zinc/73/45/23/362734523.db2.gz SPVBNEADXRZSEV-QMMMGPOBSA-N 1 2 225.242 2.078 20 0 BEADLO C[C@H]([NH2+]Cc1[nH]nc2ccccc21)C(F)F ZINC000641793335 362735308 /nfs/dbraw/zinc/73/53/08/362735308.db2.gz IZAXVBSAOKATGD-ZETCQYMHSA-N 1 2 225.242 2.306 20 0 BEADLO Cc1cccc(C[NH2+][C@@H](C)c2ncn(C)n2)c1C ZINC000275749134 179098026 /nfs/dbraw/zinc/09/80/26/179098026.db2.gz CZZGWOXESZOVSY-LBPRGKRZSA-N 1 2 244.342 2.283 20 0 BEADLO Cc1cccc(C[NH2+]Cc2ccn[nH]2)c1C ZINC000043314303 179094197 /nfs/dbraw/zinc/09/41/97/179094197.db2.gz YKSRXBGZCLJVHP-UHFFFAOYSA-N 1 2 215.300 2.316 20 0 BEADLO Cc1cnccc1C[N@@H+]1[C@H](C)[C@@H](C)CC[C@H]1C[NH3+] ZINC000641806383 362764686 /nfs/dbraw/zinc/76/46/86/362764686.db2.gz RIPAHFCEZSMLRI-LNSITVRQSA-N 1 2 247.386 2.338 20 0 BEADLO Cc1cnccc1C[N@H+]1[C@H](C)[C@@H](C)CC[C@H]1C[NH3+] ZINC000641806383 362764691 /nfs/dbraw/zinc/76/46/91/362764691.db2.gz RIPAHFCEZSMLRI-LNSITVRQSA-N 1 2 247.386 2.338 20 0 BEADLO Cc1cccc(F)c1NC(=O)[C@@H]1CCC[N@H+]1C ZINC000296295520 179111568 /nfs/dbraw/zinc/11/15/68/179111568.db2.gz MFVLOMBPYWNFDA-NSHDSACASA-N 1 2 236.290 2.167 20 0 BEADLO Cc1cccc(F)c1NC(=O)[C@@H]1CCC[N@@H+]1C ZINC000296295520 179111570 /nfs/dbraw/zinc/11/15/70/179111570.db2.gz MFVLOMBPYWNFDA-NSHDSACASA-N 1 2 236.290 2.167 20 0 BEADLO COc1cc(CNc2c[nH]c[nH+]2)cc(OC)c1 ZINC000580151071 346564481 /nfs/dbraw/zinc/56/44/81/346564481.db2.gz ZEKUTFBVDUTYAL-UHFFFAOYSA-N 1 2 233.271 2.039 20 0 BEADLO Cc1ccc(F)c(NC(=O)Cc2c[nH+]cn2C)c1 ZINC000186854735 346542279 /nfs/dbraw/zinc/54/22/79/346542279.db2.gz KYZRUZCSZSYTCR-UHFFFAOYSA-N 1 2 247.273 2.049 20 0 BEADLO C[N@@H+]1CCC[C@@H]1C(=O)Nc1cscc1Cl ZINC000636438959 346547399 /nfs/dbraw/zinc/54/73/99/346547399.db2.gz QOSPDUDHBCZFFP-SECBINFHSA-N 1 2 244.747 2.434 20 0 BEADLO C[N@H+]1CCC[C@@H]1C(=O)Nc1cscc1Cl ZINC000636438959 346547404 /nfs/dbraw/zinc/54/74/04/346547404.db2.gz QOSPDUDHBCZFFP-SECBINFHSA-N 1 2 244.747 2.434 20 0 BEADLO CC[C@@H](Nc1cc(C)[nH+]cn1)[C@H]1CCCO1 ZINC000301824747 346592703 /nfs/dbraw/zinc/59/27/03/346592703.db2.gz IKAHUNPVUFIZDG-GHMZBOCLSA-N 1 2 221.304 2.155 20 0 BEADLO Cc1cccc(NC(=O)NCc2[nH+]ccn2C)c1 ZINC000336588229 179135065 /nfs/dbraw/zinc/13/50/65/179135065.db2.gz GHHIDFVDSHPYAC-UHFFFAOYSA-N 1 2 244.298 2.050 20 0 BEADLO CSC1CCN(c2cc(C)[nH+]cn2)CC1 ZINC000601206301 346668731 /nfs/dbraw/zinc/66/87/31/346668731.db2.gz UYRUTVOHKJCDKI-UHFFFAOYSA-N 1 2 223.345 2.117 20 0 BEADLO C[C@@H]1CCC[C@H]1CNC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000621993637 370649087 /nfs/dbraw/zinc/64/90/87/370649087.db2.gz PGIWOFKTHSYZES-MNOVXSKESA-N 1 2 249.358 2.240 20 0 BEADLO Cc1cc(N[C@@H]2CCC[C@@H]3OCC[C@H]32)nc[nH+]1 ZINC000301658746 187371688 /nfs/dbraw/zinc/37/16/88/187371688.db2.gz LXBOLWBXHUACPZ-TUAOUCFPSA-N 1 2 233.315 2.155 20 0 BEADLO C[C@@H]1CCC[C@@H]1CNC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000621993636 370649491 /nfs/dbraw/zinc/64/94/91/370649491.db2.gz PGIWOFKTHSYZES-GHMZBOCLSA-N 1 2 249.358 2.240 20 0 BEADLO Cc1cnc(C[NH2+][C@H](C)c2nccnc2C)s1 ZINC000188080907 346738887 /nfs/dbraw/zinc/73/88/87/346738887.db2.gz VQYMTLFSKMFHSM-SNVBAGLBSA-N 1 2 248.355 2.401 20 0 BEADLO CN(CC(C)(C)O)c1[nH+]ccc2ccccc21 ZINC000168749666 346742545 /nfs/dbraw/zinc/74/25/45/346742545.db2.gz ACBGEXVUGNSQIH-UHFFFAOYSA-N 1 2 230.311 2.442 20 0 BEADLO CCc1cc(N[C@H](CO)c2ccccc2)nc[nH+]1 ZINC000063001757 346783684 /nfs/dbraw/zinc/78/36/84/346783684.db2.gz OSJNAGQQTVMDJT-CYBMUJFWSA-N 1 2 243.310 2.185 20 0 BEADLO CC(C)C[C@H]1CCCN(C(=O)Cn2cc[nH+]c2)C1 ZINC000580258442 346800221 /nfs/dbraw/zinc/80/02/21/346800221.db2.gz QOIFAPDMKSXXPS-CYBMUJFWSA-N 1 2 249.358 2.168 20 0 BEADLO Cc1cccc(OCC[N@@H+](C)Cc2ccon2)c1 ZINC000172385806 179166842 /nfs/dbraw/zinc/16/68/42/179166842.db2.gz PPPXHXUFCFPATM-UHFFFAOYSA-N 1 2 246.310 2.494 20 0 BEADLO Cc1cccc(OCC[N@H+](C)Cc2ccon2)c1 ZINC000172385806 179166845 /nfs/dbraw/zinc/16/68/45/179166845.db2.gz PPPXHXUFCFPATM-UHFFFAOYSA-N 1 2 246.310 2.494 20 0 BEADLO Cc1cccc(OCCOCc2[nH]cc[nH+]2)c1 ZINC000123835650 179169808 /nfs/dbraw/zinc/16/98/08/179169808.db2.gz WTYGIBBSNLJVBY-UHFFFAOYSA-N 1 2 232.283 2.314 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1cc(O)cc(F)c1 ZINC000184148898 347151308 /nfs/dbraw/zinc/15/13/08/347151308.db2.gz AROHCHIGRNQARU-GFCCVEGCSA-N 1 2 239.290 2.142 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1cc(O)cc(F)c1 ZINC000184148898 347151310 /nfs/dbraw/zinc/15/13/10/347151310.db2.gz AROHCHIGRNQARU-GFCCVEGCSA-N 1 2 239.290 2.142 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000387909316 347126030 /nfs/dbraw/zinc/12/60/30/347126030.db2.gz GZWBETIPEOLHPA-GMTAPVOTSA-N 1 2 235.331 2.269 20 0 BEADLO CCCN(C(=O)C[C@H](C)n1cc[nH+]c1)C1CC1 ZINC000571214661 323138168 /nfs/dbraw/zinc/13/81/68/323138168.db2.gz REDKCZBSZZZANW-NSHDSACASA-N 1 2 235.331 2.235 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)Nc1ccccc1 ZINC000011008925 347212653 /nfs/dbraw/zinc/21/26/53/347212653.db2.gz GRASOCKPBDOAOU-UHFFFAOYSA-N 1 2 244.298 2.084 20 0 BEADLO CCc1noc(C)c1C[NH2+]Cc1oc(C)nc1C ZINC000628295368 347213210 /nfs/dbraw/zinc/21/32/10/347213210.db2.gz MYTMHVXPUBGQFM-UHFFFAOYSA-N 1 2 249.314 2.440 20 0 BEADLO CCCC[C@@H]([NH2+][C@H]1CSC1(C)C)C(=O)OC ZINC000310038179 347221614 /nfs/dbraw/zinc/22/16/14/347221614.db2.gz VVSGGUDIACYOGI-ZJUUUORDSA-N 1 2 245.388 2.202 20 0 BEADLO Cc1cc(N2C[C@H](O)C(C)(C)C2)nc(C(C)C)[nH+]1 ZINC000388198858 347231800 /nfs/dbraw/zinc/23/18/00/347231800.db2.gz SDZUDLFAVXWVRG-NSHDSACASA-N 1 2 249.358 2.116 20 0 BEADLO CCc1noc(C[N@H+]2CC(C)=C[C@H](C)C2)n1 ZINC000684669352 488337605 /nfs/dbraw/zinc/33/76/05/488337605.db2.gz CFVGUVYCPNPKQZ-VIFPVBQESA-N 1 2 221.304 2.030 20 0 BEADLO CCc1noc(C[N@@H+]2CC(C)=C[C@H](C)C2)n1 ZINC000684669352 488337608 /nfs/dbraw/zinc/33/76/08/488337608.db2.gz CFVGUVYCPNPKQZ-VIFPVBQESA-N 1 2 221.304 2.030 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627372830 347256335 /nfs/dbraw/zinc/25/63/35/347256335.db2.gz XWRYOGNQTCSCMA-MNOVXSKESA-N 1 2 247.342 2.121 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627372830 347256337 /nfs/dbraw/zinc/25/63/37/347256337.db2.gz XWRYOGNQTCSCMA-MNOVXSKESA-N 1 2 247.342 2.121 20 0 BEADLO CCC(F)(F)CN[C@@H](C)c1[nH+]ccn1C ZINC000624148250 347265432 /nfs/dbraw/zinc/26/54/32/347265432.db2.gz ZDMQICIHZXFLPH-QMMMGPOBSA-N 1 2 217.263 2.116 20 0 BEADLO CCc1nc(C)c(C[NH2+][C@H](C)c2nccn2C)o1 ZINC000311687953 349975821 /nfs/dbraw/zinc/97/58/21/349975821.db2.gz NYYVYSHPBIPFRL-SNVBAGLBSA-N 1 2 248.330 2.130 20 0 BEADLO CCC[C@H]([NH2+]CC(=O)OC)c1ccccc1 ZINC000019885741 347306114 /nfs/dbraw/zinc/30/61/14/347306114.db2.gz ABGMJLGFKRJDEG-LBPRGKRZSA-N 1 2 221.300 2.290 20 0 BEADLO CCn1nccc1C[N@@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000679359480 488345057 /nfs/dbraw/zinc/34/50/57/488345057.db2.gz QEWXFFPTRJWYIU-JQWIXIFHSA-N 1 2 225.311 2.083 20 0 BEADLO CCn1nccc1C[N@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000679359480 488345058 /nfs/dbraw/zinc/34/50/58/488345058.db2.gz QEWXFFPTRJWYIU-JQWIXIFHSA-N 1 2 225.311 2.083 20 0 BEADLO Cc1cccc2nc(C[N@@H+]3CC[C@@H](F)C3)cn21 ZINC000336259742 179230334 /nfs/dbraw/zinc/23/03/34/179230334.db2.gz RADWRBDGZCPRCA-LLVKDONJSA-N 1 2 233.290 2.187 20 0 BEADLO C[C@H]1CC[C@H](C(=O)N(C)Cc2c[nH+]c[nH]2)CC1 ZINC000616921619 347451479 /nfs/dbraw/zinc/45/14/79/347451479.db2.gz XSMQFEOFLUUSFD-XYPYZODXSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@H]1CC[C@H](C(=O)N(C)Cc2c[nH]c[nH+]2)CC1 ZINC000616921619 347451481 /nfs/dbraw/zinc/45/14/81/347451481.db2.gz XSMQFEOFLUUSFD-XYPYZODXSA-N 1 2 235.331 2.194 20 0 BEADLO Cc1cccc2nc(C[N@H+]3CC[C@@H](F)C3)cn21 ZINC000336259742 179230336 /nfs/dbraw/zinc/23/03/36/179230336.db2.gz RADWRBDGZCPRCA-LLVKDONJSA-N 1 2 233.290 2.187 20 0 BEADLO Cc1cccc2[nH+]c(CN3CC[C@@H](F)C3)cn21 ZINC000336259742 179230338 /nfs/dbraw/zinc/23/03/38/179230338.db2.gz RADWRBDGZCPRCA-LLVKDONJSA-N 1 2 233.290 2.187 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)CCc1cccs1 ZINC000616923061 347453508 /nfs/dbraw/zinc/45/35/08/347453508.db2.gz SSHYJNMOWONNDE-UHFFFAOYSA-N 1 2 249.339 2.062 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)CCc1cccs1 ZINC000616923061 347453510 /nfs/dbraw/zinc/45/35/10/347453510.db2.gz SSHYJNMOWONNDE-UHFFFAOYSA-N 1 2 249.339 2.062 20 0 BEADLO Cc1cc(C(=O)N(C)Cc2c[nH+]c[nH]2)c(C)s1 ZINC000616922999 347454096 /nfs/dbraw/zinc/45/40/96/347454096.db2.gz QEGBUCDHOXTFMM-UHFFFAOYSA-N 1 2 249.339 2.360 20 0 BEADLO Cc1cc(C(=O)N(C)Cc2c[nH]c[nH+]2)c(C)s1 ZINC000616922999 347454099 /nfs/dbraw/zinc/45/40/99/347454099.db2.gz QEGBUCDHOXTFMM-UHFFFAOYSA-N 1 2 249.339 2.360 20 0 BEADLO C[C@@H](C(=O)N(C)Cc1c[nH+]c[nH]1)c1ccsc1 ZINC000616925355 347456055 /nfs/dbraw/zinc/45/60/55/347456055.db2.gz FILFGHSXPHOLRR-SECBINFHSA-N 1 2 249.339 2.233 20 0 BEADLO C[C@@H](C(=O)N(C)Cc1c[nH]c[nH+]1)c1ccsc1 ZINC000616925355 347456058 /nfs/dbraw/zinc/45/60/58/347456058.db2.gz FILFGHSXPHOLRR-SECBINFHSA-N 1 2 249.339 2.233 20 0 BEADLO Cc1cccc2nc(C[NH+]3CCSCC3)cn21 ZINC000051914754 179228942 /nfs/dbraw/zinc/22/89/42/179228942.db2.gz GIWWMBWGJQQHAK-UHFFFAOYSA-N 1 2 247.367 2.192 20 0 BEADLO Cc1cccc2[nH+]c(CNc3ncccn3)cn21 ZINC000035451289 179229011 /nfs/dbraw/zinc/22/90/11/179229011.db2.gz ZTQVWQBTOOEEGT-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO Cc1cscc1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616925708 347457365 /nfs/dbraw/zinc/45/73/65/347457365.db2.gz NWGTVRBFPUZVSQ-UHFFFAOYSA-N 1 2 235.312 2.052 20 0 BEADLO Cc1cscc1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616925708 347457367 /nfs/dbraw/zinc/45/73/67/347457367.db2.gz NWGTVRBFPUZVSQ-UHFFFAOYSA-N 1 2 235.312 2.052 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H]1CCCc2ccccc2C1 ZINC000590652742 347483631 /nfs/dbraw/zinc/48/36/31/347483631.db2.gz VFCDNQFHMRWVGR-BXUZGUMPSA-N 1 2 247.338 2.085 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@H]1CCCc2ccccc2C1 ZINC000590652340 347485749 /nfs/dbraw/zinc/48/57/49/347485749.db2.gz VFCDNQFHMRWVGR-FZMZJTMJSA-N 1 2 247.338 2.085 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616929129 347496426 /nfs/dbraw/zinc/49/64/26/347496426.db2.gz UVTHBDSNSQVRQA-ZYHUDNBSSA-N 1 2 235.331 2.050 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616929129 347496427 /nfs/dbraw/zinc/49/64/27/347496427.db2.gz UVTHBDSNSQVRQA-ZYHUDNBSSA-N 1 2 235.331 2.050 20 0 BEADLO CC(C)CCC(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000590730938 347497366 /nfs/dbraw/zinc/49/73/66/347497366.db2.gz LBZNZPLLCVNWKV-CYBMUJFWSA-N 1 2 249.358 2.483 20 0 BEADLO CCCC1(C(=O)N(C)Cc2c[nH+]c[nH]2)CCC1 ZINC000616926407 347458555 /nfs/dbraw/zinc/45/85/55/347458555.db2.gz AVAFBOYFZVMCLZ-UHFFFAOYSA-N 1 2 235.331 2.339 20 0 BEADLO CCCC1(C(=O)N(C)Cc2c[nH]c[nH+]2)CCC1 ZINC000616926407 347458556 /nfs/dbraw/zinc/45/85/56/347458556.db2.gz AVAFBOYFZVMCLZ-UHFFFAOYSA-N 1 2 235.331 2.339 20 0 BEADLO C[C@H]1CC[C@H](CC(=O)N(C)Cc2c[nH+]c[nH]2)C1 ZINC000616926745 347459334 /nfs/dbraw/zinc/45/93/34/347459334.db2.gz OCTMTYYPZCTAHS-QWRGUYRKSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@H]1CC[C@H](CC(=O)N(C)Cc2c[nH]c[nH+]2)C1 ZINC000616926745 347459337 /nfs/dbraw/zinc/45/93/37/347459337.db2.gz OCTMTYYPZCTAHS-QWRGUYRKSA-N 1 2 235.331 2.194 20 0 BEADLO O=C(CCC1CC1)NCc1[nH]c2c([nH+]1)CCCC2 ZINC001639295671 1172093091 /nfs/dbraw/zinc/09/30/91/1172093091.db2.gz CQPCUEKGCMALEG-UHFFFAOYSA-N 1 2 247.342 2.095 20 0 BEADLO COC1CC(C(=O)Nc2c(C)cc(C)[nH+]c2C)C1 ZINC000636581699 347519404 /nfs/dbraw/zinc/51/94/04/347519404.db2.gz JFNQWDQSHJSDGQ-UHFFFAOYSA-N 1 2 248.326 2.370 20 0 BEADLO Cc1c[nH+]c(C)nc1N1Cc2cccnc2C1 ZINC000577232233 365893626 /nfs/dbraw/zinc/89/36/26/365893626.db2.gz XMXDSDGSDYRCAI-UHFFFAOYSA-N 1 2 226.283 2.009 20 0 BEADLO CCNc1nc(NCC)c2ccccc2[nH+]1 ZINC000082409904 347540422 /nfs/dbraw/zinc/54/04/22/347540422.db2.gz CQCLFLRRIMEBFA-UHFFFAOYSA-N 1 2 216.288 2.493 20 0 BEADLO CN(C(=O)CCc1[nH]cc[nH+]1)[C@@H]1CCC(C)(C)C1 ZINC000357675818 187378035 /nfs/dbraw/zinc/37/80/35/187378035.db2.gz NVJWDSSPRPGVJA-LLVKDONJSA-N 1 2 249.358 2.379 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)[C@@H]1CCc2c[nH+]cn2C1 ZINC000616976850 347557053 /nfs/dbraw/zinc/55/70/53/347557053.db2.gz YCNRBIVFXUGYHI-VXGBXAGGSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)[C@@H]1CCn2c[nH+]cc2C1 ZINC000616978948 347562021 /nfs/dbraw/zinc/56/20/21/347562021.db2.gz JUSYHCVBAORMGB-VXGBXAGGSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1[nH]c2ccc(NC(=O)c3cocn3)cc2[nH+]1 ZINC000591115317 347621553 /nfs/dbraw/zinc/62/15/53/347621553.db2.gz PCOABQZNTOKNME-UHFFFAOYSA-N 1 2 242.238 2.112 20 0 BEADLO CCCC[C@H]([NH2+][C@@H](C)[C@@H]1CC1(F)F)C(=O)OC ZINC000591377447 347651261 /nfs/dbraw/zinc/65/12/61/347651261.db2.gz ZXADOXVWHZPTQV-GUBZILKMSA-N 1 2 249.301 2.352 20 0 BEADLO O=C(N[C@H]1C=CCCC1)c1ccc2[nH+]ccn2c1 ZINC000176825331 365909108 /nfs/dbraw/zinc/90/91/08/365909108.db2.gz SKDKVRMDQZSOQF-LBPRGKRZSA-N 1 2 241.294 2.173 20 0 BEADLO COc1cc(C)[nH+]c(CSCC(C)=O)c1 ZINC000534520093 323153036 /nfs/dbraw/zinc/15/30/36/323153036.db2.gz YARZZYPXWKTQBU-UHFFFAOYSA-N 1 2 225.313 2.221 20 0 BEADLO CCC[C@](C)([NH2+]CC1=CCCC1)C(=O)OC ZINC000592068588 347726775 /nfs/dbraw/zinc/72/67/75/347726775.db2.gz DZHZSHCPMQMWBW-ZDUSSCGKSA-N 1 2 225.332 2.418 20 0 BEADLO CCCN(CCC)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000577282898 365917957 /nfs/dbraw/zinc/91/79/57/365917957.db2.gz CCQAWEOEKNIBRA-GFCCVEGCSA-N 1 2 237.347 2.483 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@H](OC(F)F)C2)o1 ZINC000679676996 488363796 /nfs/dbraw/zinc/36/37/96/488363796.db2.gz SRYCCQLFROUNMK-VIFPVBQESA-N 1 2 246.257 2.187 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@H](OC(F)F)C2)o1 ZINC000679676996 488363797 /nfs/dbraw/zinc/36/37/97/488363797.db2.gz SRYCCQLFROUNMK-VIFPVBQESA-N 1 2 246.257 2.187 20 0 BEADLO Cc1noc(C[N@@H+]2CCCc3sccc3C2)n1 ZINC000592982121 347842154 /nfs/dbraw/zinc/84/21/54/347842154.db2.gz FFDAAENQRJJBFL-UHFFFAOYSA-N 1 2 249.339 2.388 20 0 BEADLO Cc1noc(C[N@H+]2CCCc3sccc3C2)n1 ZINC000592982121 347842156 /nfs/dbraw/zinc/84/21/56/347842156.db2.gz FFDAAENQRJJBFL-UHFFFAOYSA-N 1 2 249.339 2.388 20 0 BEADLO CCSCC[N@@H+]1CCCC(F)(F)C1 ZINC000593049078 347844337 /nfs/dbraw/zinc/84/43/37/347844337.db2.gz QKXZDSXJPYCQNO-UHFFFAOYSA-N 1 2 209.305 2.471 20 0 BEADLO CCSCC[N@H+]1CCCC(F)(F)C1 ZINC000593049078 347844340 /nfs/dbraw/zinc/84/43/40/347844340.db2.gz QKXZDSXJPYCQNO-UHFFFAOYSA-N 1 2 209.305 2.471 20 0 BEADLO COC(=O)C(C)(C)CC[N@@H+]1CCCC(F)(F)C1 ZINC000593052173 347853051 /nfs/dbraw/zinc/85/30/51/347853051.db2.gz GUBNNOHFIALVOI-UHFFFAOYSA-N 1 2 249.301 2.307 20 0 BEADLO COC(=O)C(C)(C)CC[N@H+]1CCCC(F)(F)C1 ZINC000593052173 347853053 /nfs/dbraw/zinc/85/30/53/347853053.db2.gz GUBNNOHFIALVOI-UHFFFAOYSA-N 1 2 249.301 2.307 20 0 BEADLO FC(F)O[C@@H]1CCC[N@H+](Cc2nccs2)C1 ZINC000679682191 488364358 /nfs/dbraw/zinc/36/43/58/488364358.db2.gz NFPPSFZYACFNFH-MRVPVSSYSA-N 1 2 248.298 2.347 20 0 BEADLO FC(F)O[C@@H]1CCC[N@@H+](Cc2nccs2)C1 ZINC000679682191 488364359 /nfs/dbraw/zinc/36/43/59/488364359.db2.gz NFPPSFZYACFNFH-MRVPVSSYSA-N 1 2 248.298 2.347 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1cccc2c1CCC2 ZINC000593621904 347916919 /nfs/dbraw/zinc/91/69/19/347916919.db2.gz NTTIRHHEJUCUST-LLVKDONJSA-N 1 2 247.338 2.169 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1cccc2c1CCC2 ZINC000593621904 347916922 /nfs/dbraw/zinc/91/69/22/347916922.db2.gz NTTIRHHEJUCUST-LLVKDONJSA-N 1 2 247.338 2.169 20 0 BEADLO Cc1ccccc1[C@H](C)[N@H+](C)Cc1cn(C)nn1 ZINC000341628154 179334314 /nfs/dbraw/zinc/33/43/14/179334314.db2.gz XLBJXAJQJBFFNC-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1ccccc1[C@H](C)[N@@H+](C)Cc1cn(C)nn1 ZINC000341628154 179334317 /nfs/dbraw/zinc/33/43/17/179334317.db2.gz XLBJXAJQJBFFNC-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1ccccc1[C@H](C)[N@H+](C)Cc1nncn1C ZINC000340680494 179334485 /nfs/dbraw/zinc/33/44/85/179334485.db2.gz XVXRDSQVMGYOPY-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1ccccc1[C@H](C)[N@@H+](C)Cc1nncn1C ZINC000340680494 179334487 /nfs/dbraw/zinc/33/44/87/179334487.db2.gz XVXRDSQVMGYOPY-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cccn2cc(CNC(=O)OC(C)C)[nH+]c12 ZINC000295169409 179356342 /nfs/dbraw/zinc/35/63/42/179356342.db2.gz OFJSJRHCBNYZTK-UHFFFAOYSA-N 1 2 247.298 2.277 20 0 BEADLO Cc1cccn2cc(CC(=O)NC(C)(C)C)[nH+]c12 ZINC000041287545 179357319 /nfs/dbraw/zinc/35/73/19/179357319.db2.gz QXJCMTWCYALIHI-UHFFFAOYSA-N 1 2 245.326 2.100 20 0 BEADLO CCc1cc[nH+]cc1N[C@H](C)[C@@H]1C[C@H]1C(=O)OC ZINC000594948049 348146653 /nfs/dbraw/zinc/14/66/53/348146653.db2.gz JZYFOCHOCITUQF-ADEWGFFLSA-N 1 2 248.326 2.254 20 0 BEADLO Cc1ccc[nH+]c1CCNc1nnc(C2CC2)o1 ZINC000295817517 179371357 /nfs/dbraw/zinc/37/13/57/179371357.db2.gz UWADOQJRMWMHPV-UHFFFAOYSA-N 1 2 244.298 2.305 20 0 BEADLO CCOC(=O)C[NH+]1CCC(c2ccco2)CC1 ZINC000595613621 348288402 /nfs/dbraw/zinc/28/84/02/348288402.db2.gz BNEGDEKBNNUEHK-UHFFFAOYSA-N 1 2 237.299 2.022 20 0 BEADLO CC[C@@H](C[N@@H+]1CC[C@H](C)C(F)(F)C1)OC ZINC000419314901 192121044 /nfs/dbraw/zinc/12/10/44/192121044.db2.gz VAWIZIUJDXTSTE-UWVGGRQHSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@@H](C[N@H+]1CC[C@H](C)C(F)(F)C1)OC ZINC000419314901 192121046 /nfs/dbraw/zinc/12/10/46/192121046.db2.gz VAWIZIUJDXTSTE-UWVGGRQHSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@@H](C[N@@H+]1CC[C@@H](C)C(F)(F)C1)OC ZINC000419314903 192121188 /nfs/dbraw/zinc/12/11/88/192121188.db2.gz VAWIZIUJDXTSTE-ZJUUUORDSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@@H](C[N@H+]1CC[C@@H](C)C(F)(F)C1)OC ZINC000419314903 192121189 /nfs/dbraw/zinc/12/11/89/192121189.db2.gz VAWIZIUJDXTSTE-ZJUUUORDSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@H](C[N@@H+]1CCC[C@@H]1C(F)F)OC ZINC000419280791 192122586 /nfs/dbraw/zinc/12/25/86/192122586.db2.gz PHJACUMQMLMDEC-RKDXNWHRSA-N 1 2 207.264 2.141 20 0 BEADLO CC[C@H](C[N@H+]1CCC[C@@H]1C(F)F)OC ZINC000419280791 192122587 /nfs/dbraw/zinc/12/25/87/192122587.db2.gz PHJACUMQMLMDEC-RKDXNWHRSA-N 1 2 207.264 2.141 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N2CCC[C@H](C)C2)c1 ZINC000596051408 348433575 /nfs/dbraw/zinc/43/35/75/348433575.db2.gz QZWPZSRKAIHDBS-NSHDSACASA-N 1 2 248.326 2.033 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N2CCCC[C@H]2C)c1 ZINC000596055840 348434576 /nfs/dbraw/zinc/43/45/76/348434576.db2.gz ODPOOZHFKVMXJU-LLVKDONJSA-N 1 2 248.326 2.176 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N2CCCC[C@@H]2C)c1 ZINC000596055842 348434802 /nfs/dbraw/zinc/43/48/02/348434802.db2.gz ODPOOZHFKVMXJU-NSHDSACASA-N 1 2 248.326 2.176 20 0 BEADLO Cc1oncc1C[N@H+](C)Cc1ccoc1 ZINC000526083414 323188259 /nfs/dbraw/zinc/18/82/59/323188259.db2.gz WTGOQEBZFIPCCP-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO Cc1oncc1C[N@@H+](C)Cc1ccoc1 ZINC000526083414 323188260 /nfs/dbraw/zinc/18/82/60/323188260.db2.gz WTGOQEBZFIPCCP-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N2CC[C@H](C)[C@H]2C)c1 ZINC000596148570 348451983 /nfs/dbraw/zinc/45/19/83/348451983.db2.gz CMIUZJYAVOPFTO-WDEREUQCSA-N 1 2 248.326 2.032 20 0 BEADLO COC(=O)Cc1cc[nH+]c(NCC2(C)CCC2)c1 ZINC000596153696 348453299 /nfs/dbraw/zinc/45/32/99/348453299.db2.gz WQNXDIPFCTUQQC-UHFFFAOYSA-N 1 2 248.326 2.399 20 0 BEADLO CO[C@@H](CSCCn1cc[nH+]c1)C1CCC1 ZINC000596417149 348541072 /nfs/dbraw/zinc/54/10/72/348541072.db2.gz FNJJFHNBQJAOHI-LBPRGKRZSA-N 1 2 240.372 2.431 20 0 BEADLO C[S@](=O)[C@@H]1CCC[C@@H](Nc2cccc[nH+]2)C1 ZINC000596373146 348514307 /nfs/dbraw/zinc/51/43/07/348514307.db2.gz GUZDSWCDDZCWOO-UVWXRNBGSA-N 1 2 238.356 2.183 20 0 BEADLO Cc1cnc(C[NH2+][C@H](C)c2cncc(F)c2)n1C ZINC000341339936 179611566 /nfs/dbraw/zinc/61/15/66/179611566.db2.gz BOPAAKAFPLTGSC-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO Cc1c[nH+]c(CN[C@H](C)c2cncc(F)c2)n1C ZINC000341339936 179611568 /nfs/dbraw/zinc/61/15/68/179611568.db2.gz BOPAAKAFPLTGSC-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@@H+]1CCC[C@@H]1C ZINC000208677221 348938882 /nfs/dbraw/zinc/93/88/82/348938882.db2.gz OPKVCONGKSHHMS-ONGXEEELSA-N 1 2 239.340 2.447 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@H+]1CCC[C@@H]1C ZINC000208677221 348938883 /nfs/dbraw/zinc/93/88/83/348938883.db2.gz OPKVCONGKSHHMS-ONGXEEELSA-N 1 2 239.340 2.447 20 0 BEADLO CS[C@H](C)C(=O)Nc1ccn2cc(C)[nH+]c2c1 ZINC000598468862 348979743 /nfs/dbraw/zinc/97/97/43/348979743.db2.gz MOFXQOAXGZYZQF-SECBINFHSA-N 1 2 249.339 2.333 20 0 BEADLO CCOc1cccc(C[NH2+]Cc2ncccn2)c1 ZINC000054459276 349033666 /nfs/dbraw/zinc/03/36/66/349033666.db2.gz QDCSXWNVTDKSOF-UHFFFAOYSA-N 1 2 243.310 2.165 20 0 BEADLO CCc1cc(N[C@@H]2CCO[C@@H](C)C2)nc[nH+]1 ZINC000220082090 490224508 /nfs/dbraw/zinc/22/45/08/490224508.db2.gz OEVPXRUPRBGFEY-GXSJLCMTSA-N 1 2 221.304 2.018 20 0 BEADLO CCC[C@H](C)CCC[NH+]1CCS(=O)CC1 ZINC000599291944 349148941 /nfs/dbraw/zinc/14/89/41/349148941.db2.gz WNHHHVDBJADIRN-LBPRGKRZSA-N 1 2 231.405 2.267 20 0 BEADLO Cc1csc([C@H](C)[NH2+]Cc2cncn2C)n1 ZINC000082403793 179796396 /nfs/dbraw/zinc/79/63/96/179796396.db2.gz NJPLRQDXDQRKIU-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO c1nn[nH]c1CC[N@@H+]1CCC[C@@H](C2CCC2)CC1 ZINC000640107131 538034894 /nfs/dbraw/zinc/03/48/94/538034894.db2.gz NYNXGJBDHGPTHN-CYBMUJFWSA-N 1 2 248.374 2.249 20 0 BEADLO c1nn[nH]c1CC[N@H+]1CCC[C@@H](C2CCC2)CC1 ZINC000640107131 538034899 /nfs/dbraw/zinc/03/48/99/538034899.db2.gz NYNXGJBDHGPTHN-CYBMUJFWSA-N 1 2 248.374 2.249 20 0 BEADLO COc1c(N)[nH+]cnc1N[C@H]1CC[C@H](C)CC1 ZINC000253143762 349227428 /nfs/dbraw/zinc/22/74/28/349227428.db2.gz YMNHOKHPNWNVHW-KYZUINATSA-N 1 2 236.319 2.058 20 0 BEADLO COc1c(N)nc[nH+]c1N[C@H]1CC[C@H](C)CC1 ZINC000253143762 349227431 /nfs/dbraw/zinc/22/74/31/349227431.db2.gz YMNHOKHPNWNVHW-KYZUINATSA-N 1 2 236.319 2.058 20 0 BEADLO Cc1nnc(C[NH2+]C(C)(C)c2ccccc2F)[nH]1 ZINC000292111824 179835449 /nfs/dbraw/zinc/83/54/49/179835449.db2.gz JBPPOAARWZRZNN-UHFFFAOYSA-N 1 2 248.305 2.277 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@H]2CC[C@@H]2C)[nH+]1 ZINC000336729949 180025602 /nfs/dbraw/zinc/02/56/02/180025602.db2.gz DMPXNYDXTNLWFP-XVKPBYJWSA-N 1 2 216.288 2.477 20 0 BEADLO Cc1nc([C@@H](C)[NH+]2CCC(C(F)F)CC2)no1 ZINC000336347879 180032400 /nfs/dbraw/zinc/03/24/00/180032400.db2.gz NBQIUDMAWZUUGW-SSDOTTSWSA-N 1 2 245.273 2.416 20 0 BEADLO Cc1nnc([C@@H](C)[NH+]2CCC(C(F)F)CC2)[nH]1 ZINC000336283902 180033266 /nfs/dbraw/zinc/03/32/66/180033266.db2.gz ALJHAWNKOXFYFT-SSDOTTSWSA-N 1 2 244.289 2.151 20 0 BEADLO Cc1nc(NCCOC(C)(C)C)cc[nH+]1 ZINC000309166293 350113964 /nfs/dbraw/zinc/11/39/64/350113964.db2.gz JCYWZMNOJVKOIP-UHFFFAOYSA-N 1 2 209.293 2.012 20 0 BEADLO Cc1nc([C@@H]2CCCC[N@@H+]2Cc2cc[nH]c2)no1 ZINC000362622358 180043189 /nfs/dbraw/zinc/04/31/89/180043189.db2.gz MWZHDQQCAFOSJY-LBPRGKRZSA-N 1 2 246.314 2.433 20 0 BEADLO Cc1nc([C@@H]2CCCC[N@H+]2Cc2cc[nH]c2)no1 ZINC000362622358 180043191 /nfs/dbraw/zinc/04/31/91/180043191.db2.gz MWZHDQQCAFOSJY-LBPRGKRZSA-N 1 2 246.314 2.433 20 0 BEADLO Cc1nc([C@H](C)[NH2+]Cc2c[nH]nc2C)cs1 ZINC000038011396 180048489 /nfs/dbraw/zinc/04/84/89/180048489.db2.gz LQGUFDIECUVWBJ-QMMMGPOBSA-N 1 2 236.344 2.334 20 0 BEADLO Cc1nc([C@H](C)NCc2[nH+]ccn2C)cs1 ZINC000070852887 180051811 /nfs/dbraw/zinc/05/18/11/180051811.db2.gz NKMBBOFBQYCSJQ-QMMMGPOBSA-N 1 2 236.344 2.036 20 0 BEADLO CCc1cc(N[C@]2(C)CCO[C@@H]2C)nc[nH+]1 ZINC000230098181 538055477 /nfs/dbraw/zinc/05/54/77/538055477.db2.gz XLKDRFMUVNBJBI-BXKDBHETSA-N 1 2 221.304 2.018 20 0 BEADLO Cc1[nH+]c2ccc(C(=O)N(C)C(C)C)cc2n1C ZINC000336414136 180089310 /nfs/dbraw/zinc/08/93/10/180089310.db2.gz IQMNAPOVMJDMRZ-UHFFFAOYSA-N 1 2 245.326 2.362 20 0 BEADLO Cc1nc(NCC2CCC2)c2c([nH+]1)CCCC2 ZINC000359714994 180068486 /nfs/dbraw/zinc/06/84/86/180068486.db2.gz IOPRFDSIIJWQGR-UHFFFAOYSA-N 1 2 231.343 2.298 20 0 BEADLO Cc1nc(NC2CCOCC2)c2c([nH+]1)CCCC2 ZINC000177553368 180068734 /nfs/dbraw/zinc/06/87/34/180068734.db2.gz VVEMAKIISLURMS-UHFFFAOYSA-N 1 2 247.342 2.255 20 0 BEADLO Cc1nc(NCCC(C)(C)O)c2c([nH+]1)CCCC2 ZINC000274766427 180068862 /nfs/dbraw/zinc/06/88/62/180068862.db2.gz LKPVISWPGBLAGT-UHFFFAOYSA-N 1 2 249.358 2.237 20 0 BEADLO Cc1nc(NC[C@@H]2CCOC2)c2c([nH+]1)CCCC2 ZINC000272926106 180069949 /nfs/dbraw/zinc/06/99/49/180069949.db2.gz UPSUBFQCGNKTGU-NSHDSACASA-N 1 2 247.342 2.112 20 0 BEADLO Cc1nc(N[C@@H](C)CCCO)c2c([nH+]1)CCCC2 ZINC000272828507 180070369 /nfs/dbraw/zinc/07/03/69/180070369.db2.gz GMERTCRPLLIVAA-JTQLQIEISA-N 1 2 249.358 2.237 20 0 BEADLO CCC[N@H+](CCOC(C)C)CC(F)F ZINC000133341213 191039711 /nfs/dbraw/zinc/03/97/11/191039711.db2.gz FMVHCIQTPNMKLS-UHFFFAOYSA-N 1 2 209.280 2.389 20 0 BEADLO CCC[N@@H+](CCOC(C)C)CC(F)F ZINC000133341213 191039714 /nfs/dbraw/zinc/03/97/14/191039714.db2.gz FMVHCIQTPNMKLS-UHFFFAOYSA-N 1 2 209.280 2.389 20 0 BEADLO Cc1[nH+]c2ccccc2n1CC(=O)NC1CCC1 ZINC000264534783 180104082 /nfs/dbraw/zinc/10/40/82/180104082.db2.gz OYDDYNCACGHWBC-UHFFFAOYSA-N 1 2 243.310 2.013 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H](C2CC2)C2CCC2)c[nH+]1 ZINC000333471508 180131336 /nfs/dbraw/zinc/13/13/36/180131336.db2.gz FYLOGLGIIGBORR-LBPRGKRZSA-N 1 2 233.315 2.027 20 0 BEADLO Cc1[nH]c(C(=O)NCc2ccc(Cl)cc2)c[nH+]1 ZINC000336382819 180132530 /nfs/dbraw/zinc/13/25/30/180132530.db2.gz URZAWCGUWMMDJY-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO Cc1ncc(C[N@@H+]2CCO[C@H](C(C)(C)C)C2)cn1 ZINC000352414146 180143437 /nfs/dbraw/zinc/14/34/37/180143437.db2.gz SJUZYXWVMZWAQR-ZDUSSCGKSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1ncc(C[N@H+]2CCO[C@H](C(C)(C)C)C2)cn1 ZINC000352414146 180143439 /nfs/dbraw/zinc/14/34/39/180143439.db2.gz SJUZYXWVMZWAQR-ZDUSSCGKSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H](C)C(C)(C)C ZINC000331113245 180119342 /nfs/dbraw/zinc/11/93/42/180119342.db2.gz ULKKUSSCDMSNRV-QMMMGPOBSA-N 1 2 223.320 2.017 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1CCC[C@H](C)C1 ZINC000336080193 180120388 /nfs/dbraw/zinc/12/03/88/180120388.db2.gz XWTPWAACUJBWFW-GXSJLCMTSA-N 1 2 235.331 2.161 20 0 BEADLO Cc1nc(NCC2(CO)CC3(CCC3)C2)cc[nH+]1 ZINC000278813278 180197738 /nfs/dbraw/zinc/19/77/38/180197738.db2.gz INTRRQONPZYZOI-UHFFFAOYSA-N 1 2 247.342 2.140 20 0 BEADLO Cc1nc(NCC(C)(C)[C@@H](O)C(C)C)cc[nH+]1 ZINC000158669977 180198032 /nfs/dbraw/zinc/19/80/32/180198032.db2.gz OZMSQPFSNFMFCQ-LBPRGKRZSA-N 1 2 237.347 2.240 20 0 BEADLO Cc1nc(NCC2(O)CCCCCC2)cc[nH+]1 ZINC000087089700 180198195 /nfs/dbraw/zinc/19/81/95/180198195.db2.gz GSEUHWDGDUZQTD-UHFFFAOYSA-N 1 2 235.331 2.282 20 0 BEADLO Cc1nc(NC[C@@H](O)C2CCCCC2)cc[nH+]1 ZINC000266380805 180200692 /nfs/dbraw/zinc/20/06/92/180200692.db2.gz MZRRUDBWBFQICF-GFCCVEGCSA-N 1 2 235.331 2.138 20 0 BEADLO Cc1nc(N[C@H](C)C[C@H]2CCCO2)cc[nH+]1 ZINC000309761119 180204679 /nfs/dbraw/zinc/20/46/79/180204679.db2.gz MOZNSBFOTDJNLX-MWLCHTKSSA-N 1 2 221.304 2.155 20 0 BEADLO Cc1nc(N[C@H](C)[C@H]2CCCCO2)cc[nH+]1 ZINC000271915269 180205644 /nfs/dbraw/zinc/20/56/44/180205644.db2.gz BUHSMESIXWDICA-MWLCHTKSSA-N 1 2 221.304 2.155 20 0 BEADLO Cc1nc(N[C@H]2C[C@@H](C)n3ccnc32)cc[nH+]1 ZINC000333657886 180206921 /nfs/dbraw/zinc/20/69/21/180206921.db2.gz GIHCMMGEBDECSS-SCZZXKLOSA-N 1 2 229.287 2.099 20 0 BEADLO Cc1nc(N[C@H]2CCOC3(CCC3)C2)cc[nH+]1 ZINC000268982145 180207470 /nfs/dbraw/zinc/20/74/70/180207470.db2.gz RVNRDBKMKYMEGB-NSHDSACASA-N 1 2 233.315 2.299 20 0 BEADLO Cc1nc(N[C@H]2CCO[C@@H](C(C)C)C2)cc[nH+]1 ZINC000271485276 180208068 /nfs/dbraw/zinc/20/80/68/180208068.db2.gz VCLQJBYKXCYLRS-NWDGAFQWSA-N 1 2 235.331 2.401 20 0 BEADLO Cc1nc(NC[C@H]2C[C@@H]2c2ccccc2)cc[nH+]1 ZINC000338769778 180181244 /nfs/dbraw/zinc/18/12/44/180181244.db2.gz LVLVRWSSPJMYRK-ZIAGYGMSSA-N 1 2 239.322 2.423 20 0 BEADLO Cc1nccc(C[N@@H+](C)[C@H](C)c2ccccn2)n1 ZINC000352822557 180184916 /nfs/dbraw/zinc/18/49/16/180184916.db2.gz HGWNASGALUMSSZ-LLVKDONJSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1nccc(C[N@H+](C)[C@H](C)c2ccccn2)n1 ZINC000352822557 180184917 /nfs/dbraw/zinc/18/49/17/180184917.db2.gz HGWNASGALUMSSZ-LLVKDONJSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1[nH+]cccc1Cc1nc(CCCF)no1 ZINC000297414095 180222701 /nfs/dbraw/zinc/22/27/01/180222701.db2.gz UEWUGCKVGQBVNJ-UHFFFAOYSA-N 1 2 235.262 2.266 20 0 BEADLO Cc1[nH+]cccc1NC[C@H]1CCC=CO1 ZINC000085711503 180225645 /nfs/dbraw/zinc/22/56/45/180225645.db2.gz JBTDOFHXANUSBJ-LLVKDONJSA-N 1 2 204.273 2.495 20 0 BEADLO CC[N@@H+]1CCOC[C@@H]1c1cccc(F)c1 ZINC000226173958 350405077 /nfs/dbraw/zinc/40/50/77/350405077.db2.gz RUXOFEXRINYRKA-GFCCVEGCSA-N 1 2 209.264 2.219 20 0 BEADLO CC[N@H+]1CCOC[C@@H]1c1cccc(F)c1 ZINC000226173958 350405080 /nfs/dbraw/zinc/40/50/80/350405080.db2.gz RUXOFEXRINYRKA-GFCCVEGCSA-N 1 2 209.264 2.219 20 0 BEADLO CCN(CC)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606582679 350373128 /nfs/dbraw/zinc/37/31/28/350373128.db2.gz YXDIYCHGTCXQQQ-UHFFFAOYSA-N 1 2 232.287 2.208 20 0 BEADLO CC(C)CN(C)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606581791 350373341 /nfs/dbraw/zinc/37/33/41/350373341.db2.gz QHGCSIMMQSDOKQ-UHFFFAOYSA-N 1 2 246.314 2.454 20 0 BEADLO CN(CC1CC1)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606580965 350374163 /nfs/dbraw/zinc/37/41/63/350374163.db2.gz LIMRJSXSLIWNTI-UHFFFAOYSA-N 1 2 244.298 2.208 20 0 BEADLO C[C@@H]([NH2+]CC(F)F)c1ccc([S@](C)=O)cc1 ZINC000309413003 350376332 /nfs/dbraw/zinc/37/63/32/350376332.db2.gz IVIGMVFOTYOKPG-BCTVWOGZSA-N 1 2 247.310 2.340 20 0 BEADLO C[C@@H]([NH2+]CC(F)F)c1ccc([S@@](C)=O)cc1 ZINC000309413009 350376432 /nfs/dbraw/zinc/37/64/32/350376432.db2.gz IVIGMVFOTYOKPG-VPTHRUTESA-N 1 2 247.310 2.340 20 0 BEADLO Cc1ncsc1C[NH2+][C@H](C)c1ccon1 ZINC000336768681 180322040 /nfs/dbraw/zinc/32/20/40/180322040.db2.gz UVMYRHNXGZYAHC-SSDOTTSWSA-N 1 2 223.301 2.290 20 0 BEADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2cc[nH]n2)o1 ZINC000041014030 350402864 /nfs/dbraw/zinc/40/28/64/350402864.db2.gz UKPUPEWLYHCFKX-BXKDBHETSA-N 1 2 231.299 2.416 20 0 BEADLO CCn1ccnc1C[N@H+](CC)Cc1ccncc1 ZINC000336719290 350474239 /nfs/dbraw/zinc/47/42/39/350474239.db2.gz VRLRRLHRWKNVNW-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CCn1ccnc1C[N@@H+](CC)Cc1ccncc1 ZINC000336719290 350474244 /nfs/dbraw/zinc/47/42/44/350474244.db2.gz VRLRRLHRWKNVNW-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CCN(Cc1[nH+]ccn1CC)Cc1ccncc1 ZINC000336719290 350474247 /nfs/dbraw/zinc/47/42/47/350474247.db2.gz VRLRRLHRWKNVNW-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO FC[C@@H]([NH2+]Cc1cn[nH]c1)c1ccc(F)cc1 ZINC000631283374 350492729 /nfs/dbraw/zinc/49/27/29/350492729.db2.gz KNDHZUDFGYOOPV-GFCCVEGCSA-N 1 2 237.253 2.349 20 0 BEADLO Cc1nn(C)cc1[C@H]1CCC[N@@H+]1Cc1ccon1 ZINC000363928085 180383036 /nfs/dbraw/zinc/38/30/36/180383036.db2.gz YKACIOQPDLCBNE-CYBMUJFWSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1nn(C)cc1[C@H]1CCC[N@H+]1Cc1ccon1 ZINC000363928085 180383040 /nfs/dbraw/zinc/38/30/40/180383040.db2.gz YKACIOQPDLCBNE-CYBMUJFWSA-N 1 2 246.314 2.054 20 0 BEADLO CCCc1nc(C[N@H+](CC)CC2CC2)no1 ZINC000070012921 350494223 /nfs/dbraw/zinc/49/42/23/350494223.db2.gz LOIBXXDVAGEONR-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO CCCc1nc(C[N@@H+](CC)CC2CC2)no1 ZINC000070012921 350494228 /nfs/dbraw/zinc/49/42/28/350494228.db2.gz LOIBXXDVAGEONR-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO COc1c(C)[nH+]c(C2CC2)nc1N[C@H]1CC[C@H]1C ZINC000580784280 350533519 /nfs/dbraw/zinc/53/35/19/350533519.db2.gz RZEHOYJAHKVSJL-KCJUWKMLSA-N 1 2 247.342 2.303 20 0 BEADLO CC[C@@H]1[C@H](C)CCN1C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000577498157 365970158 /nfs/dbraw/zinc/97/01/58/365970158.db2.gz LZXOHJRVSPLSGL-JHJVBQTASA-N 1 2 249.358 2.481 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1CCC[C@@H]1CCO ZINC000577510564 365974366 /nfs/dbraw/zinc/97/43/66/365974366.db2.gz MVSLXLRHRUCHGV-NEPJUHHUSA-N 1 2 235.331 2.056 20 0 BEADLO CCc1noc([C@@H](C)[N@@H+]2CC[C@@H](C(F)F)C2)n1 ZINC000677735473 490654177 /nfs/dbraw/zinc/65/41/77/490654177.db2.gz QVNKNWUSELZNCX-HTQZYQBOSA-N 1 2 245.273 2.280 20 0 BEADLO CCc1noc([C@@H](C)[N@H+]2CC[C@@H](C(F)F)C2)n1 ZINC000677735473 490654180 /nfs/dbraw/zinc/65/41/80/490654180.db2.gz QVNKNWUSELZNCX-HTQZYQBOSA-N 1 2 245.273 2.280 20 0 BEADLO CCN(Cc1[nH+]ccn1CC)CC(F)(F)F ZINC000112344197 350654298 /nfs/dbraw/zinc/65/42/98/350654298.db2.gz YRDORZOGYDCMSS-UHFFFAOYSA-N 1 2 235.253 2.287 20 0 BEADLO CC(C)[C@@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000216379465 350685418 /nfs/dbraw/zinc/68/54/18/350685418.db2.gz SUJDRJPYHYZNRL-FOQNGQEVSA-N 1 2 247.342 2.318 20 0 BEADLO Cc1ncc(C[NH2+][C@@H](C)c2cscn2)o1 ZINC000397976027 362976205 /nfs/dbraw/zinc/97/62/05/362976205.db2.gz FTGHAJPCZSYOIJ-ZETCQYMHSA-N 1 2 223.301 2.290 20 0 BEADLO CC[C@@H](O)C[N@@H+]1CCn2c(Cl)ccc2[C@@H]1C ZINC000366383842 350759015 /nfs/dbraw/zinc/75/90/15/350759015.db2.gz HVOHQQRYIMCIIC-VHSXEESVSA-N 1 2 242.750 2.289 20 0 BEADLO CC[C@@H](O)C[N@H+]1CCn2c(Cl)ccc2[C@@H]1C ZINC000366383842 350759019 /nfs/dbraw/zinc/75/90/19/350759019.db2.gz HVOHQQRYIMCIIC-VHSXEESVSA-N 1 2 242.750 2.289 20 0 BEADLO CCc1csc(NCCc2cc[nH+]cc2C)n1 ZINC000339056891 350729414 /nfs/dbraw/zinc/72/94/14/350729414.db2.gz ZGXJVLKIMGBVBA-UHFFFAOYSA-N 1 2 247.367 2.485 20 0 BEADLO CCc1nc(C[N@@H+]2CC[C@@H](CC3CC3)C2)no1 ZINC000339688251 350773697 /nfs/dbraw/zinc/77/36/97/350773697.db2.gz UFISBYOGIKNTIA-NSHDSACASA-N 1 2 235.331 2.254 20 0 BEADLO CCc1nc(C[N@H+]2CC[C@@H](CC3CC3)C2)no1 ZINC000339688251 350773698 /nfs/dbraw/zinc/77/36/98/350773698.db2.gz UFISBYOGIKNTIA-NSHDSACASA-N 1 2 235.331 2.254 20 0 BEADLO Cc1cc(N2CCCOCC2)nc(C(C)C)[nH+]1 ZINC000344011016 351009517 /nfs/dbraw/zinc/00/95/17/351009517.db2.gz OWUQAADJRWUWRT-UHFFFAOYSA-N 1 2 235.331 2.135 20 0 BEADLO Clc1ncccc1C[NH+]1CCSCC1 ZINC000052709103 351126228 /nfs/dbraw/zinc/12/62/28/351126228.db2.gz IBIFBSSUJRBLET-UHFFFAOYSA-N 1 2 228.748 2.284 20 0 BEADLO C[C@@H]([NH2+]Cc1csnn1)c1cccc(C#N)c1 ZINC000398364909 351123198 /nfs/dbraw/zinc/12/31/98/351123198.db2.gz NHBWIWDJAAOEFC-SECBINFHSA-N 1 2 244.323 2.261 20 0 BEADLO C[C@@H]([NH2+]Cc1cc(C#N)cs1)C(F)F ZINC000389923498 351068803 /nfs/dbraw/zinc/06/88/03/351068803.db2.gz ACZGRZZNYUVDNH-ZCFIWIBFSA-N 1 2 216.256 2.363 20 0 BEADLO CCCc1ccc(C[NH2+]Cc2cnn[nH]2)cc1 ZINC000623577450 363008098 /nfs/dbraw/zinc/00/80/98/363008098.db2.gz OYWPNUFWAZXDJH-UHFFFAOYSA-N 1 2 230.315 2.047 20 0 BEADLO CCCc1ccc(C[NH2+]Cc2c[nH]nn2)cc1 ZINC000623577450 363008099 /nfs/dbraw/zinc/00/80/99/363008099.db2.gz OYWPNUFWAZXDJH-UHFFFAOYSA-N 1 2 230.315 2.047 20 0 BEADLO CCCc1ccc(C[NH2+]Cc2cn[nH]n2)cc1 ZINC000623577450 363008107 /nfs/dbraw/zinc/00/81/07/363008107.db2.gz OYWPNUFWAZXDJH-UHFFFAOYSA-N 1 2 230.315 2.047 20 0 BEADLO CC1(C[NH2+]Cc2c[nH]nn2)CCCCCC1 ZINC000398374759 351124846 /nfs/dbraw/zinc/12/48/46/351124846.db2.gz FALWZSFEDOXSBF-UHFFFAOYSA-N 1 2 222.336 2.255 20 0 BEADLO CC1(C[NH2+]Cc2cn[nH]n2)CCCCCC1 ZINC000398374759 351124848 /nfs/dbraw/zinc/12/48/48/351124848.db2.gz FALWZSFEDOXSBF-UHFFFAOYSA-N 1 2 222.336 2.255 20 0 BEADLO CC(C)c1cccc(C[NH2+]Cc2cnn[nH]2)c1 ZINC000623578627 363011440 /nfs/dbraw/zinc/01/14/40/363011440.db2.gz QFROJXZYRBRGMR-UHFFFAOYSA-N 1 2 230.315 2.218 20 0 BEADLO CC(C)c1cccc(C[NH2+]Cc2c[nH]nn2)c1 ZINC000623578627 363011442 /nfs/dbraw/zinc/01/14/42/363011442.db2.gz QFROJXZYRBRGMR-UHFFFAOYSA-N 1 2 230.315 2.218 20 0 BEADLO CC(C)c1cccc(C[NH2+]Cc2cn[nH]n2)c1 ZINC000623578627 363011444 /nfs/dbraw/zinc/01/14/44/363011444.db2.gz QFROJXZYRBRGMR-UHFFFAOYSA-N 1 2 230.315 2.218 20 0 BEADLO Cc1ncc(C[NH+]2CC(C)(CC(F)F)C2)o1 ZINC000628321817 351187685 /nfs/dbraw/zinc/18/76/85/351187685.db2.gz GGXOBJALFDRSIJ-UHFFFAOYSA-N 1 2 230.258 2.460 20 0 BEADLO Cc1cc(Cl)ccc1C[NH2+]Cc1cnn[nH]1 ZINC000398396064 351130405 /nfs/dbraw/zinc/13/04/05/351130405.db2.gz LBBQYZNPCRFEPG-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO Cc1cc(Cl)ccc1C[NH2+]Cc1c[nH]nn1 ZINC000398396064 351130410 /nfs/dbraw/zinc/13/04/10/351130410.db2.gz LBBQYZNPCRFEPG-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO Cc1cc(Cl)ccc1C[NH2+]Cc1cn[nH]n1 ZINC000398396064 351130412 /nfs/dbraw/zinc/13/04/12/351130412.db2.gz LBBQYZNPCRFEPG-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C(C)(C)OC ZINC000265209427 351265422 /nfs/dbraw/zinc/26/54/22/351265422.db2.gz LJXBAEYDJHBZNS-UHFFFAOYSA-N 1 2 222.288 2.008 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)CCOC(C)C ZINC000265173357 351264248 /nfs/dbraw/zinc/26/42/48/351264248.db2.gz FITDQLGGYNUXSP-UHFFFAOYSA-N 1 2 236.315 2.398 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC[C@@H](OC3CCC3)C2)n1 ZINC000628327587 351265070 /nfs/dbraw/zinc/26/50/70/351265070.db2.gz HJJHUOSLSCWKTF-CYBMUJFWSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC[C@@H](OC3CCC3)C2)n1 ZINC000628327587 351265074 /nfs/dbraw/zinc/26/50/74/351265074.db2.gz HJJHUOSLSCWKTF-CYBMUJFWSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1[nH]c(CN2CCO[C@@](C)(C3CC3)C2)[nH+]c1C ZINC000628338026 351281067 /nfs/dbraw/zinc/28/10/67/351281067.db2.gz XRLXRYIHCRQLIO-CQSZACIVSA-N 1 2 249.358 2.027 20 0 BEADLO Cc1[nH]c(CN2CCO[C@](C)(C3CC3)C2)[nH+]c1C ZINC000628338025 351281279 /nfs/dbraw/zinc/28/12/79/351281279.db2.gz XRLXRYIHCRQLIO-AWEZNQCLSA-N 1 2 249.358 2.027 20 0 BEADLO Cc1[nH]c(CN(C)CC2=CCSC2)[nH+]c1C ZINC000628352842 351316433 /nfs/dbraw/zinc/31/64/33/351316433.db2.gz WMSRGLKYKLYYFG-UHFFFAOYSA-N 1 2 237.372 2.132 20 0 BEADLO Cc1nc(C[N@H+](C)CC2=CCSC2)[nH]c1C ZINC000628352842 351316436 /nfs/dbraw/zinc/31/64/36/351316436.db2.gz WMSRGLKYKLYYFG-UHFFFAOYSA-N 1 2 237.372 2.132 20 0 BEADLO Cc1nc(C[N@@H+](C)CC2=CCSC2)[nH]c1C ZINC000628352842 351316441 /nfs/dbraw/zinc/31/64/41/351316441.db2.gz WMSRGLKYKLYYFG-UHFFFAOYSA-N 1 2 237.372 2.132 20 0 BEADLO OC[C@@H]1CCN(c2cc3ccccc3c[nH+]2)C1 ZINC000631126380 351368443 /nfs/dbraw/zinc/36/84/43/351368443.db2.gz MNQGEFLCNBXPHT-LLVKDONJSA-N 1 2 228.295 2.053 20 0 BEADLO CC[N@H+](Cc1cccs1)Cc1nccc(N)n1 ZINC000268685889 351339133 /nfs/dbraw/zinc/33/91/33/351339133.db2.gz QOWJQYBUUTVDFD-UHFFFAOYSA-N 1 2 248.355 2.142 20 0 BEADLO CC[N@@H+](Cc1cccs1)Cc1nccc(N)n1 ZINC000268685889 351339136 /nfs/dbraw/zinc/33/91/36/351339136.db2.gz QOWJQYBUUTVDFD-UHFFFAOYSA-N 1 2 248.355 2.142 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1CCO[C@@H](C)C1 ZINC000271867803 351441709 /nfs/dbraw/zinc/44/17/09/351441709.db2.gz FYMQNHZEBJUQPU-CMPLNLGQSA-N 1 2 248.326 2.398 20 0 BEADLO CCc1nc(C[N@H+](C)C[C@@H](C)OC)cs1 ZINC000272812943 351496923 /nfs/dbraw/zinc/49/69/23/351496923.db2.gz NLGAZTAHOZUHEO-SECBINFHSA-N 1 2 228.361 2.172 20 0 BEADLO CCc1nc(C[N@@H+](C)C[C@@H](C)OC)cs1 ZINC000272812943 351496926 /nfs/dbraw/zinc/49/69/26/351496926.db2.gz NLGAZTAHOZUHEO-SECBINFHSA-N 1 2 228.361 2.172 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+][C@@H](CC)CC(F)(F)F ZINC000309978332 187485674 /nfs/dbraw/zinc/48/56/74/187485674.db2.gz UZKXPYMSIKSSNM-SFYZADRCSA-N 1 2 241.253 2.259 20 0 BEADLO Cc1nn(Cc2ccc(C)[nH+]c2C)c(C)c1N ZINC000637796663 351622888 /nfs/dbraw/zinc/62/28/88/351622888.db2.gz SJSJWDALYRHZOU-UHFFFAOYSA-N 1 2 230.315 2.142 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N(C)[C@H](C)C1(C)CC1 ZINC000577647079 366030893 /nfs/dbraw/zinc/03/08/93/366030893.db2.gz GCRYGJWPKCQDTQ-GHMZBOCLSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N(C)[C@H](C)C1(C)CC1 ZINC000577647079 366030898 /nfs/dbraw/zinc/03/08/98/366030898.db2.gz GCRYGJWPKCQDTQ-GHMZBOCLSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nncn2C)[C@@H]1c1ccccc1 ZINC000177824162 366065648 /nfs/dbraw/zinc/06/56/48/366065648.db2.gz KIFXWGMEUVXOSB-RISCZKNCSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nncn2C)[C@@H]1c1ccccc1 ZINC000177824162 366065652 /nfs/dbraw/zinc/06/56/52/366065652.db2.gz KIFXWGMEUVXOSB-RISCZKNCSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccc(C(F)F)nc2)CCO1 ZINC000637884414 351749910 /nfs/dbraw/zinc/74/99/10/351749910.db2.gz XEPJHMMYAOSXOS-VIFPVBQESA-N 1 2 242.269 2.240 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccc(C(F)F)nc2)CCO1 ZINC000637884414 351749914 /nfs/dbraw/zinc/74/99/14/351749914.db2.gz XEPJHMMYAOSXOS-VIFPVBQESA-N 1 2 242.269 2.240 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1cc(C)ns1 ZINC000637853160 351708961 /nfs/dbraw/zinc/70/89/61/351708961.db2.gz RHGVUFSSKQKOHY-WDEREUQCSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1cc(C)ns1 ZINC000637853160 351708963 /nfs/dbraw/zinc/70/89/63/351708963.db2.gz RHGVUFSSKQKOHY-WDEREUQCSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cc(C)ns2)CCO1 ZINC000637890103 351759657 /nfs/dbraw/zinc/75/96/57/351759657.db2.gz SSNRCXRJQNDNLT-JTQLQIEISA-N 1 2 226.345 2.062 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cc(C)ns2)CCO1 ZINC000637890103 351759662 /nfs/dbraw/zinc/75/96/62/351759662.db2.gz SSNRCXRJQNDNLT-JTQLQIEISA-N 1 2 226.345 2.062 20 0 BEADLO Cc1ncc([C@@H](C)[N@@H+]2CCOCC2(C)C)c(C)n1 ZINC000637964151 351837100 /nfs/dbraw/zinc/83/71/00/351837100.db2.gz HMZZSQAUKKYLOZ-LLVKDONJSA-N 1 2 249.358 2.265 20 0 BEADLO Cc1ncc([C@@H](C)[N@H+]2CCOCC2(C)C)c(C)n1 ZINC000637964151 351837102 /nfs/dbraw/zinc/83/71/02/351837102.db2.gz HMZZSQAUKKYLOZ-LLVKDONJSA-N 1 2 249.358 2.265 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H](C)OC[C@@H]2C)sn1 ZINC000637930641 351806994 /nfs/dbraw/zinc/80/69/94/351806994.db2.gz QTTARANVTMIOAA-UWVGGRQHSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H](C)OC[C@@H]2C)sn1 ZINC000637930641 351806996 /nfs/dbraw/zinc/80/69/96/351806996.db2.gz QTTARANVTMIOAA-UWVGGRQHSA-N 1 2 226.345 2.061 20 0 BEADLO CC[C@@H]1CCCC[C@H]1NC(=O)CCc1c[nH+]c[nH]1 ZINC000280461364 351845211 /nfs/dbraw/zinc/84/52/11/351845211.db2.gz ZUSVYDWXUJWGJT-DGCLKSJQSA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@@H]1CCCC[C@H]1NC(=O)CCc1c[nH]c[nH+]1 ZINC000280461364 351845214 /nfs/dbraw/zinc/84/52/14/351845214.db2.gz ZUSVYDWXUJWGJT-DGCLKSJQSA-N 1 2 249.358 2.427 20 0 BEADLO CCC[C@@H](C[N@H+](C)Cc1cscn1)OC ZINC000637974346 351850009 /nfs/dbraw/zinc/85/00/09/351850009.db2.gz SWMAQDGWCQRLFQ-NSHDSACASA-N 1 2 228.361 2.390 20 0 BEADLO CCC[C@@H](C[N@@H+](C)Cc1cscn1)OC ZINC000637974346 351850011 /nfs/dbraw/zinc/85/00/11/351850011.db2.gz SWMAQDGWCQRLFQ-NSHDSACASA-N 1 2 228.361 2.390 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@H](C)[C@H]2C)sn1 ZINC000638085601 351962282 /nfs/dbraw/zinc/96/22/82/351962282.db2.gz SAQAJRDAIWQAML-NXEZZACHSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@H](C)[C@H]2C)sn1 ZINC000638085601 351962284 /nfs/dbraw/zinc/96/22/84/351962284.db2.gz SAQAJRDAIWQAML-NXEZZACHSA-N 1 2 226.345 2.061 20 0 BEADLO COc1ncc(C[N@@H+]2CCSC[C@H]2C)s1 ZINC000638085367 351962437 /nfs/dbraw/zinc/96/24/37/351962437.db2.gz YIPZGUOJJIHVCC-MRVPVSSYSA-N 1 2 244.385 2.089 20 0 BEADLO COc1ncc(C[N@H+]2CCSC[C@H]2C)s1 ZINC000638085367 351962438 /nfs/dbraw/zinc/96/24/38/351962438.db2.gz YIPZGUOJJIHVCC-MRVPVSSYSA-N 1 2 244.385 2.089 20 0 BEADLO c1cc(C[N@@H+]2CCOC3(CCCC3)C2)sn1 ZINC000638106905 351985412 /nfs/dbraw/zinc/98/54/12/351985412.db2.gz FMULCXUOUCJWPO-UHFFFAOYSA-N 1 2 238.356 2.288 20 0 BEADLO c1cc(C[N@H+]2CCOC3(CCCC3)C2)sn1 ZINC000638106905 351985413 /nfs/dbraw/zinc/98/54/13/351985413.db2.gz FMULCXUOUCJWPO-UHFFFAOYSA-N 1 2 238.356 2.288 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1NC(=O)CCc1[nH]cc[nH+]1 ZINC000287470898 352127370 /nfs/dbraw/zinc/12/73/70/352127370.db2.gz YGCGJBPLMRSYMO-NEPJUHHUSA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@@H]1CCC[C@@H](NC(=O)CCc2[nH]cc[nH+]2)C1 ZINC000287770083 352133890 /nfs/dbraw/zinc/13/38/90/352133890.db2.gz UWKSUDNDKPIRQC-VXGBXAGGSA-N 1 2 249.358 2.427 20 0 BEADLO CCc1nc(N[C@H](C)Cn2ccnc2)cc(C)[nH+]1 ZINC000286204049 352080757 /nfs/dbraw/zinc/08/07/57/352080757.db2.gz RUAUMCDEKRGSPC-LLVKDONJSA-N 1 2 245.330 2.045 20 0 BEADLO CC[N@H+](Cc1c(C)cnn1C)Cc1ccccn1 ZINC000290103355 352210603 /nfs/dbraw/zinc/21/06/03/352210603.db2.gz SFSMLRXUFYNRIT-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CC[N@@H+](Cc1c(C)cnn1C)Cc1ccccn1 ZINC000290103355 352210609 /nfs/dbraw/zinc/21/06/09/352210609.db2.gz SFSMLRXUFYNRIT-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO C[C@@H]1C[N@@H+]([C@H]2C[C@H]2c2cccc(F)c2)CCO1 ZINC000411126918 191162271 /nfs/dbraw/zinc/16/22/71/191162271.db2.gz QJECXBIHOVIFMF-SWHYSGLUSA-N 1 2 235.302 2.402 20 0 BEADLO C[C@@H]1C[N@H+]([C@H]2C[C@H]2c2cccc(F)c2)CCO1 ZINC000411126918 191162274 /nfs/dbraw/zinc/16/22/74/191162274.db2.gz QJECXBIHOVIFMF-SWHYSGLUSA-N 1 2 235.302 2.402 20 0 BEADLO Cc1nc(N[C@H]2[C@@H](C)[C@@H](C)O[C@H]2C)cc[nH+]1 ZINC000528207198 323781327 /nfs/dbraw/zinc/78/13/27/323781327.db2.gz OZPWAMKHBGNINW-NHRVJRKFSA-N 1 2 221.304 2.009 20 0 BEADLO CC[N@H+](Cc1nnc(C)[nH]1)Cc1ccccc1 ZINC000292199968 352307195 /nfs/dbraw/zinc/30/71/95/352307195.db2.gz OPONATZVTYJZRD-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CC[N@@H+](Cc1nnc(C)[nH]1)Cc1ccccc1 ZINC000292199968 352307198 /nfs/dbraw/zinc/30/71/98/352307198.db2.gz OPONATZVTYJZRD-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CCC[C@H]1CCCC[C@@H]1NC(=O)Cn1cc[nH+]c1 ZINC000073361544 352327220 /nfs/dbraw/zinc/32/72/20/352327220.db2.gz BAJULYXGBUMUAY-STQMWFEESA-N 1 2 249.358 2.358 20 0 BEADLO Cc1cnc(C[NH2+]Cc2cccc(N(C)C)c2)o1 ZINC000638546824 352376481 /nfs/dbraw/zinc/37/64/81/352376481.db2.gz CXXFTENOXSVQRX-UHFFFAOYSA-N 1 2 245.326 2.339 20 0 BEADLO CCC[C@H](C[NH2+]C(C)(C)c1noc(C)n1)OC ZINC000638524442 352357506 /nfs/dbraw/zinc/35/75/06/352357506.db2.gz QODNGTDSFIJZTE-SNVBAGLBSA-N 1 2 241.335 2.018 20 0 BEADLO CCc1ccc(C[NH2+][C@@H](C)c2ccn(C)n2)nc1 ZINC000411822623 191213005 /nfs/dbraw/zinc/21/30/05/191213005.db2.gz OXAYXPPEXBHUSG-NSHDSACASA-N 1 2 244.342 2.228 20 0 BEADLO Cn1cc[nH+]c1[C@@H]1CCCN(C(=O)C(C)(C)C)C1 ZINC000373071031 180756581 /nfs/dbraw/zinc/75/65/81/180756581.db2.gz QMQFJCAWCUPHLV-LLVKDONJSA-N 1 2 249.358 2.172 20 0 BEADLO COc1ccc(C)cc1CNc1cc[nH+]c(C)n1 ZINC000608078948 352701198 /nfs/dbraw/zinc/70/11/98/352701198.db2.gz UDXGFQCRVHGTEL-UHFFFAOYSA-N 1 2 243.310 2.136 20 0 BEADLO CC(=O)c1ccc2c(c1)C[N@H+](CCC[C@@H](C)O)C2 ZINC000411940962 191231308 /nfs/dbraw/zinc/23/13/08/191231308.db2.gz ICUNUGVDQWRJDX-LLVKDONJSA-N 1 2 247.338 2.366 20 0 BEADLO CC(=O)c1ccc2c(c1)C[N@@H+](CCC[C@@H](C)O)C2 ZINC000411940962 191231310 /nfs/dbraw/zinc/23/13/10/191231310.db2.gz ICUNUGVDQWRJDX-LLVKDONJSA-N 1 2 247.338 2.366 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+](CC=C(C)C)C1CC1 ZINC000190831431 358473154 /nfs/dbraw/zinc/47/31/54/358473154.db2.gz DMFLTGBJPZNWMY-NSHDSACASA-N 1 2 225.332 2.369 20 0 BEADLO CC1(C)C[C@H]1CNC(=O)c1ccc2[nH+]ccn2c1 ZINC000334218442 352819695 /nfs/dbraw/zinc/81/96/95/352819695.db2.gz DWESWOVJQKKNSQ-NSHDSACASA-N 1 2 243.310 2.110 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+](CC=C(C)C)C1CC1 ZINC000190831431 358473149 /nfs/dbraw/zinc/47/31/49/358473149.db2.gz DMFLTGBJPZNWMY-NSHDSACASA-N 1 2 225.332 2.369 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nncn2-c2ccccc2)[C@@H]1C ZINC000334220834 352823345 /nfs/dbraw/zinc/82/33/45/352823345.db2.gz SERVHMCKKVUJQE-VXGBXAGGSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nncn2-c2ccccc2)[C@@H]1C ZINC000334220834 352823347 /nfs/dbraw/zinc/82/33/47/352823347.db2.gz SERVHMCKKVUJQE-VXGBXAGGSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nncn2-c2ccccc2)[C@H]1C ZINC000334220827 352823744 /nfs/dbraw/zinc/82/37/44/352823744.db2.gz SERVHMCKKVUJQE-NEPJUHHUSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nncn2-c2ccccc2)[C@H]1C ZINC000334220827 352823749 /nfs/dbraw/zinc/82/37/49/352823749.db2.gz SERVHMCKKVUJQE-NEPJUHHUSA-N 1 2 242.326 2.108 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CC[C@@](C)(F)C1 ZINC000334199751 352792272 /nfs/dbraw/zinc/79/22/72/352792272.db2.gz MPYVEEJHAYNEFS-GFCCVEGCSA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1ccnc1C[N@@H+]1CC[C@@](C)(F)C1 ZINC000334199751 352792274 /nfs/dbraw/zinc/79/22/74/352792274.db2.gz MPYVEEJHAYNEFS-GFCCVEGCSA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1ccnc1C[N@H+]1CC[C@@](C)(F)C1 ZINC000334199751 352792276 /nfs/dbraw/zinc/79/22/76/352792276.db2.gz MPYVEEJHAYNEFS-GFCCVEGCSA-N 1 2 225.311 2.398 20 0 BEADLO C[C@H]1COCCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000334200025 352793298 /nfs/dbraw/zinc/79/32/98/352793298.db2.gz NYAOAJKBZSXYNJ-SNVBAGLBSA-N 1 2 231.299 2.036 20 0 BEADLO c1cc(C[N@@H+]2CCC[C@@H]2c2cccnc2)no1 ZINC000334239602 352858624 /nfs/dbraw/zinc/85/86/24/352858624.db2.gz LCNMTLGTWVQCED-CYBMUJFWSA-N 1 2 229.283 2.407 20 0 BEADLO c1cc(C[N@H+]2CCC[C@@H]2c2cccnc2)no1 ZINC000334239602 352858626 /nfs/dbraw/zinc/85/86/26/352858626.db2.gz LCNMTLGTWVQCED-CYBMUJFWSA-N 1 2 229.283 2.407 20 0 BEADLO CC(F)(F)CC(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000334246415 352837505 /nfs/dbraw/zinc/83/75/05/352837505.db2.gz IDQHIFDNAORESL-MRVPVSSYSA-N 1 2 243.257 2.119 20 0 BEADLO Cc1nnc(C[N@@H+]2CC(C)=C[C@H](C)C2)s1 ZINC000334247122 352838355 /nfs/dbraw/zinc/83/83/55/352838355.db2.gz JWVUSSBJWHLUDT-QMMMGPOBSA-N 1 2 223.345 2.245 20 0 BEADLO Cc1nnc(C[N@H+]2CC(C)=C[C@H](C)C2)s1 ZINC000334247122 352838359 /nfs/dbraw/zinc/83/83/59/352838359.db2.gz JWVUSSBJWHLUDT-QMMMGPOBSA-N 1 2 223.345 2.245 20 0 BEADLO C[C@H](C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1)C1CC1 ZINC000334249589 352842725 /nfs/dbraw/zinc/84/27/25/352842725.db2.gz WHBRBWVSGFUKEQ-GXSJLCMTSA-N 1 2 233.315 2.119 20 0 BEADLO CC(C)c1noc(C[N@@H+]2C[C@H](C)[C@@H]2C)n1 ZINC000334229078 352846235 /nfs/dbraw/zinc/84/62/35/352846235.db2.gz HSDKLHJDBJWYHC-IUCAKERBSA-N 1 2 209.293 2.033 20 0 BEADLO CC(C)c1noc(C[N@H+]2C[C@H](C)[C@@H]2C)n1 ZINC000334229078 352846237 /nfs/dbraw/zinc/84/62/37/352846237.db2.gz HSDKLHJDBJWYHC-IUCAKERBSA-N 1 2 209.293 2.033 20 0 BEADLO c1ccc(C[N@@H+]2C[C@]3(CCCO3)[C@H]2C2CC2)nc1 ZINC000334279164 352913363 /nfs/dbraw/zinc/91/33/63/352913363.db2.gz FUCHYDGWEOBENG-HUUCEWRRSA-N 1 2 244.338 2.225 20 0 BEADLO c1ccc(C[N@H+]2C[C@]3(CCCO3)[C@H]2C2CC2)nc1 ZINC000334279164 352913369 /nfs/dbraw/zinc/91/33/69/352913369.db2.gz FUCHYDGWEOBENG-HUUCEWRRSA-N 1 2 244.338 2.225 20 0 BEADLO CCc1nc(N2[C@@H](C)C[C@@H]2C)cc(C)[nH+]1 ZINC000334251634 352887869 /nfs/dbraw/zinc/88/78/69/352887869.db2.gz VMGLIULPIKUIMD-UWVGGRQHSA-N 1 2 205.305 2.335 20 0 BEADLO FC1(F)CC[N@H+](Cc2cccc3c[nH]nc32)C1 ZINC000334332162 352968834 /nfs/dbraw/zinc/96/88/34/352968834.db2.gz PZYSRIUWCMJGNK-UHFFFAOYSA-N 1 2 237.253 2.404 20 0 BEADLO FC1(F)CC[N@@H+](Cc2cccc3c[nH]nc32)C1 ZINC000334332162 352968835 /nfs/dbraw/zinc/96/88/35/352968835.db2.gz PZYSRIUWCMJGNK-UHFFFAOYSA-N 1 2 237.253 2.404 20 0 BEADLO CC[C@](C)(C[N@@H+]1CCC(F)(F)C1)OC ZINC000638842070 353018456 /nfs/dbraw/zinc/01/84/56/353018456.db2.gz KZYHYXPHNKULPY-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CC[C@](C)(C[N@H+]1CCC(F)(F)C1)OC ZINC000638842070 353018459 /nfs/dbraw/zinc/01/84/59/353018459.db2.gz KZYHYXPHNKULPY-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CC[C@@](C)(C[N@@H+]1CCC(F)(F)C1)OC ZINC000638842071 353018483 /nfs/dbraw/zinc/01/84/83/353018483.db2.gz KZYHYXPHNKULPY-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CC[C@@](C)(C[N@H+]1CCC(F)(F)C1)OC ZINC000638842071 353018485 /nfs/dbraw/zinc/01/84/85/353018485.db2.gz KZYHYXPHNKULPY-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO Cc1cc(C[N@@H+]2CCOCC23CC3)ccc1F ZINC000334468769 353116001 /nfs/dbraw/zinc/11/60/01/353116001.db2.gz YIFXFGYYRDNKKT-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1cc(C[N@H+]2CCOCC23CC3)ccc1F ZINC000334468769 353116004 /nfs/dbraw/zinc/11/60/04/353116004.db2.gz YIFXFGYYRDNKKT-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO CC(=O)c1ccc2c(c1)C[N@@H+](C[C@@H]1CCCO1)C2 ZINC000058011798 188086117 /nfs/dbraw/zinc/08/61/17/188086117.db2.gz PBRLWXVHYNNTOJ-HNNXBMFYSA-N 1 2 245.322 2.384 20 0 BEADLO CC(=O)c1ccc2c(c1)C[N@H+](C[C@@H]1CCCO1)C2 ZINC000058011798 188086119 /nfs/dbraw/zinc/08/61/19/188086119.db2.gz PBRLWXVHYNNTOJ-HNNXBMFYSA-N 1 2 245.322 2.384 20 0 BEADLO CC(=O)CC[N@@H+]1CCOC[C@H]1c1ccccc1 ZINC000372768389 188075358 /nfs/dbraw/zinc/07/53/58/188075358.db2.gz UGYVNVVNJKNXIR-AWEZNQCLSA-N 1 2 233.311 2.039 20 0 BEADLO CC(=O)CC[N@H+]1CCOC[C@H]1c1ccccc1 ZINC000372768389 188075360 /nfs/dbraw/zinc/07/53/60/188075360.db2.gz UGYVNVVNJKNXIR-AWEZNQCLSA-N 1 2 233.311 2.039 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccn(C)n1)c1c(C)noc1C ZINC000330494214 353172932 /nfs/dbraw/zinc/17/29/32/353172932.db2.gz UQQGPWKMSQPUJE-GFCCVEGCSA-N 1 2 248.330 2.266 20 0 BEADLO FC(F)O[C@@H]1CCC[N@H+](Cc2ccns2)C1 ZINC000638969838 353176487 /nfs/dbraw/zinc/17/64/87/353176487.db2.gz JBHSFNBPOQNSFU-MRVPVSSYSA-N 1 2 248.298 2.347 20 0 BEADLO FC(F)O[C@@H]1CCC[N@@H+](Cc2ccns2)C1 ZINC000638969838 353176488 /nfs/dbraw/zinc/17/64/88/353176488.db2.gz JBHSFNBPOQNSFU-MRVPVSSYSA-N 1 2 248.298 2.347 20 0 BEADLO Cc1cc(N(C)[C@H]2CCCOC2)nc(C2CC2)[nH+]1 ZINC000343251793 353195237 /nfs/dbraw/zinc/19/52/37/353195237.db2.gz PHXAFFMNHUTFIQ-LBPRGKRZSA-N 1 2 247.342 2.278 20 0 BEADLO CC(C)[C@H]([NH2+]Cc1nnc[nH]1)c1ccccc1 ZINC000037919877 188115332 /nfs/dbraw/zinc/11/53/32/188115332.db2.gz LYYYHOMITHLDQW-ZDUSSCGKSA-N 1 2 230.315 2.292 20 0 BEADLO c1cc(N2CCCC2)[nH+]cc1N[C@H]1CCCOC1 ZINC000070464224 188130211 /nfs/dbraw/zinc/13/02/11/188130211.db2.gz KAPRWBSAWBPPBQ-ZDUSSCGKSA-N 1 2 247.342 2.273 20 0 BEADLO CC(C)[C@@H]1C[C@H]1C(=O)N(C)CCCn1cc[nH+]c1 ZINC000185754755 188170168 /nfs/dbraw/zinc/17/01/68/188170168.db2.gz ZAJMFSCOPIOEQP-QWHCGFSZSA-N 1 2 249.358 2.024 20 0 BEADLO Clc1cnc(C[NH2+]Cc2ccccn2)s1 ZINC000225294251 538111910 /nfs/dbraw/zinc/11/19/10/538111910.db2.gz RXBTYUVFEKHDHC-UHFFFAOYSA-N 1 2 239.731 2.481 20 0 BEADLO Cc1nc(N(C)Cc2ccc(Cl)nc2)cc[nH+]1 ZINC000266185913 188195794 /nfs/dbraw/zinc/19/57/94/188195794.db2.gz WWVCLCIYJJVOKL-UHFFFAOYSA-N 1 2 248.717 2.470 20 0 BEADLO Cc1cccc(C(=O)Nc2cc[nH+]cc2O)c1 ZINC000109889963 188176677 /nfs/dbraw/zinc/17/66/77/188176677.db2.gz GAAREHLOWPLQER-UHFFFAOYSA-N 1 2 228.251 2.348 20 0 BEADLO C/C=C\C[C@@H]([NH2+]CCSCC)C(=O)OCC ZINC000336781080 188176799 /nfs/dbraw/zinc/17/67/99/188176799.db2.gz TWLYNVSMFXTQNQ-MEQVVJDKSA-N 1 2 245.388 2.227 20 0 BEADLO C1=C[C@H]([N@@H+]2CCc3n[nH]nc3C2)CCCCC1 ZINC000339118943 188190322 /nfs/dbraw/zinc/19/03/22/188190322.db2.gz NZKZPKINRMXRIO-NSHDSACASA-N 1 2 232.331 2.052 20 0 BEADLO C1=C[C@H]([N@H+]2CCc3n[nH]nc3C2)CCCCC1 ZINC000339118943 188190324 /nfs/dbraw/zinc/19/03/24/188190324.db2.gz NZKZPKINRMXRIO-NSHDSACASA-N 1 2 232.331 2.052 20 0 BEADLO c1coc(C2=CCC[N@@H+](Cc3cnns3)C2)c1 ZINC000294917379 188213856 /nfs/dbraw/zinc/21/38/56/188213856.db2.gz CBEFCFNQCJRIPV-UHFFFAOYSA-N 1 2 247.323 2.420 20 0 BEADLO c1coc(C2=CCC[N@H+](Cc3cnns3)C2)c1 ZINC000294917379 188213857 /nfs/dbraw/zinc/21/38/57/188213857.db2.gz CBEFCFNQCJRIPV-UHFFFAOYSA-N 1 2 247.323 2.420 20 0 BEADLO CC(C)c1nc(N(C)Cc2cnccn2)cc[nH+]1 ZINC000301307042 188216105 /nfs/dbraw/zinc/21/61/05/188216105.db2.gz ZODAETZTQQDTMC-UHFFFAOYSA-N 1 2 243.314 2.026 20 0 BEADLO C/C=C/C[C@@H](CO)Nc1cc[nH+]c2ccncc12 ZINC000274474909 188200734 /nfs/dbraw/zinc/20/07/34/188200734.db2.gz NBTWTFMEDYGNSV-VUDBWIFFSA-N 1 2 243.310 2.369 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000274761747 188201357 /nfs/dbraw/zinc/20/13/57/188201357.db2.gz NOIUYGWLFIENJL-YRGRVCCFSA-N 1 2 249.358 2.070 20 0 BEADLO CC(C)(C)n1cc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)cn1 ZINC000336527795 188230960 /nfs/dbraw/zinc/23/09/60/188230960.db2.gz HECJYOHUVHFJOF-BETUJISGSA-N 1 2 249.358 2.001 20 0 BEADLO CC(C)(C)n1cc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)cn1 ZINC000336527795 188230962 /nfs/dbraw/zinc/23/09/62/188230962.db2.gz HECJYOHUVHFJOF-BETUJISGSA-N 1 2 249.358 2.001 20 0 BEADLO Cc1cc(N(C)[C@H]2CCC[C@@H]2O)nc(C(C)C)[nH+]1 ZINC000343272435 353294585 /nfs/dbraw/zinc/29/45/85/353294585.db2.gz UGHJQSIBWHLTEL-RYUDHWBXSA-N 1 2 249.358 2.258 20 0 BEADLO Cc1ccc(F)c(C[NH2+]Cc2cc[nH]n2)c1 ZINC000164530105 353390036 /nfs/dbraw/zinc/39/00/36/353390036.db2.gz COUBEWZKJRKCMS-UHFFFAOYSA-N 1 2 219.263 2.147 20 0 BEADLO CC[C@H](C)C[C@H](CC)[NH2+]Cc1c[nH]nn1 ZINC000398330123 363219022 /nfs/dbraw/zinc/21/90/22/363219022.db2.gz HPOPIFDEJPKEHD-UWVGGRQHSA-N 1 2 210.325 2.109 20 0 BEADLO CC[C@H](C)C[C@H](CC)[NH2+]Cc1cn[nH]n1 ZINC000398330123 363219027 /nfs/dbraw/zinc/21/90/27/363219027.db2.gz HPOPIFDEJPKEHD-UWVGGRQHSA-N 1 2 210.325 2.109 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccns2)[C@@H](C)[C@H](C)O1 ZINC000639085884 353433327 /nfs/dbraw/zinc/43/33/27/353433327.db2.gz MBVFMRJHFWOKOK-UTLUCORTSA-N 1 2 226.345 2.141 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccns2)[C@@H](C)[C@H](C)O1 ZINC000639085884 353433328 /nfs/dbraw/zinc/43/33/28/353433328.db2.gz MBVFMRJHFWOKOK-UTLUCORTSA-N 1 2 226.345 2.141 20 0 BEADLO C[C@@H]([NH2+]CC(F)F)c1cccc(O)c1 ZINC000147332516 538117515 /nfs/dbraw/zinc/11/75/15/538117515.db2.gz YGTPQHVDUYHLSC-SSDOTTSWSA-N 1 2 201.216 2.308 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2cnn(C)c2)o1 ZINC000230639949 353518962 /nfs/dbraw/zinc/51/89/62/353518962.db2.gz RHZVGGOAWIGNAP-VHSXEESVSA-N 1 2 234.303 2.128 20 0 BEADLO CO[C@@H]1CC[C@H](NC(=O)Nc2cc[nH+]cc2C)C1 ZINC000189755721 353534745 /nfs/dbraw/zinc/53/47/45/353534745.db2.gz BBWGJTMTRIXERB-WDEREUQCSA-N 1 2 249.314 2.079 20 0 BEADLO CO[C@H]1CC[C@H](NC(=O)Nc2cc[nH+]c(C)c2)C1 ZINC000189754213 353534830 /nfs/dbraw/zinc/53/48/30/353534830.db2.gz YPUCUQFRVVFJDF-JQWIXIFHSA-N 1 2 249.314 2.079 20 0 BEADLO CO[C@H]1CC[C@@H](NC(=O)Nc2cc[nH+]cc2C)C1 ZINC000189755672 353534873 /nfs/dbraw/zinc/53/48/73/353534873.db2.gz BBWGJTMTRIXERB-MNOVXSKESA-N 1 2 249.314 2.079 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCc1cccs1 ZINC000563842338 353587164 /nfs/dbraw/zinc/58/71/64/353587164.db2.gz OWJXFNPEJKUMSG-UHFFFAOYSA-N 1 2 233.340 2.231 20 0 BEADLO c1snnc1C[NH+]1CC(C2CCCC2)C1 ZINC000334517942 353641548 /nfs/dbraw/zinc/64/15/48/353641548.db2.gz MMTPRXBFZSFCEQ-UHFFFAOYSA-N 1 2 223.345 2.160 20 0 BEADLO Fc1ccccc1CN1CCn2c[nH+]cc2C1 ZINC000291592323 181011806 /nfs/dbraw/zinc/01/18/06/181011806.db2.gz PWAHEMDYMDCPRD-UHFFFAOYSA-N 1 2 231.274 2.038 20 0 BEADLO Fc1ccccc1COCc1[nH]cc[nH+]1 ZINC000123752138 181013377 /nfs/dbraw/zinc/01/33/77/181013377.db2.gz FAKULOOZDNSHPS-UHFFFAOYSA-N 1 2 206.220 2.266 20 0 BEADLO COc1ccccc1C[NH2+][C@H](C)c1nc(C)no1 ZINC000074071581 353742588 /nfs/dbraw/zinc/74/25/88/353742588.db2.gz YGXRMRGRVKDQSS-SECBINFHSA-N 1 2 247.298 2.237 20 0 BEADLO Fc1ccccc1C[N@@H+]1CCOC[C@@H]1C1CC1 ZINC000090007467 181011500 /nfs/dbraw/zinc/01/15/00/181011500.db2.gz PYRFFROYCGFCHB-CQSZACIVSA-N 1 2 235.302 2.437 20 0 BEADLO Fc1ccccc1C[N@H+]1CCOC[C@@H]1C1CC1 ZINC000090007467 181011501 /nfs/dbraw/zinc/01/15/01/181011501.db2.gz PYRFFROYCGFCHB-CQSZACIVSA-N 1 2 235.302 2.437 20 0 BEADLO Fc1cncc(CNc2cccc[nH+]2)c1 ZINC000335616209 181021140 /nfs/dbraw/zinc/02/11/40/181021140.db2.gz OJPRQLWWVYSIDK-UHFFFAOYSA-N 1 2 203.220 2.228 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000360800931 188516270 /nfs/dbraw/zinc/51/62/70/188516270.db2.gz IWZGMHZKJJPQMS-ZWNOBZJWSA-N 1 2 235.331 2.050 20 0 BEADLO CC(C)C1(CNc2ccc(CO)c[nH+]2)CC1 ZINC000639132742 353842306 /nfs/dbraw/zinc/84/23/06/353842306.db2.gz TVEPTWCZQVLRAV-UHFFFAOYSA-N 1 2 220.316 2.422 20 0 BEADLO CO[C@@H]1C[C@H](Nc2cccc[nH+]2)C12CCC2 ZINC000334533978 353913404 /nfs/dbraw/zinc/91/34/04/353913404.db2.gz GKAPYFFBVWVFTL-WDEREUQCSA-N 1 2 218.300 2.451 20 0 BEADLO CCOC1CC2(C1)CCN(c1cc(C)[nH+]cn1)C2 ZINC000343505416 353921439 /nfs/dbraw/zinc/92/14/39/353921439.db2.gz JCJPPLFJCAFMEN-UHFFFAOYSA-N 1 2 247.342 2.180 20 0 BEADLO C[N@H+](Cc1nc(C2CC2)cs1)[C@H]1CCOC1 ZINC000343522751 353927428 /nfs/dbraw/zinc/92/74/28/353927428.db2.gz HBRISQCBZRYVID-JTQLQIEISA-N 1 2 238.356 2.241 20 0 BEADLO C[N@@H+](Cc1nc(C2CC2)cs1)[C@H]1CCOC1 ZINC000343522751 353927430 /nfs/dbraw/zinc/92/74/30/353927430.db2.gz HBRISQCBZRYVID-JTQLQIEISA-N 1 2 238.356 2.241 20 0 BEADLO COc1cc[nH+]cc1Cn1cc(C(C)C)cn1 ZINC000577952031 366135884 /nfs/dbraw/zinc/13/58/84/366135884.db2.gz NHPOIVNLCUOWNF-UHFFFAOYSA-N 1 2 231.299 2.458 20 0 BEADLO Cc1csc(CNC(=O)c2c[nH+]c(C)[nH]2)c1 ZINC000334545827 353983111 /nfs/dbraw/zinc/98/31/11/353983111.db2.gz QSWUYHSILQEYNC-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO CC(C)OC1CC([N@@H+]2CCC(F)(F)C2)C1 ZINC000334556989 354003693 /nfs/dbraw/zinc/00/36/93/354003693.db2.gz IEWVBNIOVQMJRJ-UHFFFAOYSA-N 1 2 219.275 2.283 20 0 BEADLO CC(C)OC1CC([N@H+]2CCC(F)(F)C2)C1 ZINC000334556989 354003694 /nfs/dbraw/zinc/00/36/94/354003694.db2.gz IEWVBNIOVQMJRJ-UHFFFAOYSA-N 1 2 219.275 2.283 20 0 BEADLO Cc1nc(C[N@H+]2CCO[C@H](C)[C@@H]2C)sc1C ZINC000178585202 366142927 /nfs/dbraw/zinc/14/29/27/366142927.db2.gz ZSYNOTRUKROHLN-VHSXEESVSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nc(C[N@@H+]2CCO[C@H](C)[C@@H]2C)sc1C ZINC000178585202 366142931 /nfs/dbraw/zinc/14/29/31/366142931.db2.gz ZSYNOTRUKROHLN-VHSXEESVSA-N 1 2 240.372 2.369 20 0 BEADLO CC1(C)COCC[N@@H+]1Cc1ccc2c(n1)CCC2 ZINC000334558387 354006841 /nfs/dbraw/zinc/00/68/41/354006841.db2.gz RGYDKEKTBLIZNR-UHFFFAOYSA-N 1 2 246.354 2.181 20 0 BEADLO CC1(C)COCC[N@H+]1Cc1ccc2c(n1)CCC2 ZINC000334558387 354006845 /nfs/dbraw/zinc/00/68/45/354006845.db2.gz RGYDKEKTBLIZNR-UHFFFAOYSA-N 1 2 246.354 2.181 20 0 BEADLO FC1=CCC[N@H+](CCc2cncs2)C1 ZINC000334559097 354008686 /nfs/dbraw/zinc/00/86/86/354008686.db2.gz LTKSDCWOUAPTNA-UHFFFAOYSA-N 1 2 212.293 2.245 20 0 BEADLO FC1=CCC[N@@H+](CCc2cncs2)C1 ZINC000334559097 354008688 /nfs/dbraw/zinc/00/86/88/354008688.db2.gz LTKSDCWOUAPTNA-UHFFFAOYSA-N 1 2 212.293 2.245 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CCc3ccccc3C2)[nH]1 ZINC000334549673 354016899 /nfs/dbraw/zinc/01/68/99/354016899.db2.gz OALKVAXBHKDLEE-JTQLQIEISA-N 1 2 242.326 2.232 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CCc3ccccc3C2)[nH]1 ZINC000334549673 354016902 /nfs/dbraw/zinc/01/69/02/354016902.db2.gz OALKVAXBHKDLEE-JTQLQIEISA-N 1 2 242.326 2.232 20 0 BEADLO CC(C)C[C@H](C)C(=O)NCCNc1cccc[nH+]1 ZINC000274183660 188557399 /nfs/dbraw/zinc/55/73/99/188557399.db2.gz DSAJDSITQFGCJS-LBPRGKRZSA-N 1 2 249.358 2.292 20 0 BEADLO c1ccc(N[C@H]2CCO[C@H]2C2CC2)[nH+]c1 ZINC000230307491 363304050 /nfs/dbraw/zinc/30/40/50/363304050.db2.gz FGRGCCPYAKYMND-JQWIXIFHSA-N 1 2 204.273 2.061 20 0 BEADLO C[C@@H]1OCC[N@H+](Cc2ccc3c(n2)CCC3)[C@H]1C ZINC000334565835 354086147 /nfs/dbraw/zinc/08/61/47/354086147.db2.gz YNLMYLAFXQOMMD-RYUDHWBXSA-N 1 2 246.354 2.180 20 0 BEADLO C[C@@H]1OCC[N@@H+](Cc2ccc3c(n2)CCC3)[C@H]1C ZINC000334565835 354086150 /nfs/dbraw/zinc/08/61/50/354086150.db2.gz YNLMYLAFXQOMMD-RYUDHWBXSA-N 1 2 246.354 2.180 20 0 BEADLO Cc1cc(N2CC(CF)C2)nc(C2CC2)[nH+]1 ZINC000334579179 354125711 /nfs/dbraw/zinc/12/57/11/354125711.db2.gz KRKMADHQNZSDKV-UHFFFAOYSA-N 1 2 221.279 2.068 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CCC(F)(F)[C@H](C)C2)[nH]1 ZINC000334580765 354197001 /nfs/dbraw/zinc/19/70/01/354197001.db2.gz AZGONDBBFQAAAH-SFYZADRCSA-N 1 2 244.289 2.151 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CCC(F)(F)[C@H](C)C2)[nH]1 ZINC000334580765 354197003 /nfs/dbraw/zinc/19/70/03/354197003.db2.gz AZGONDBBFQAAAH-SFYZADRCSA-N 1 2 244.289 2.151 20 0 BEADLO Cn1cncc1C[NH2+]Cc1csc(C2CC2)n1 ZINC000344367239 354244406 /nfs/dbraw/zinc/24/44/06/354244406.db2.gz AUNXWJBAWLYCPD-UHFFFAOYSA-N 1 2 248.355 2.044 20 0 BEADLO COCc1cc(C[NH+]2CCC(F)(F)CC2)no1 ZINC000529661981 324372675 /nfs/dbraw/zinc/37/26/75/324372675.db2.gz MCZWFXRSRFTLMI-UHFFFAOYSA-N 1 2 246.257 2.052 20 0 BEADLO Fc1ccc(C[N@H+]2CCC[C@@H](F)C2)nc1 ZINC000529618216 324366122 /nfs/dbraw/zinc/36/61/22/324366122.db2.gz GPZVEGDNUARBSB-SNVBAGLBSA-N 1 2 212.243 2.155 20 0 BEADLO Fc1ccc(C[N@@H+]2CCC[C@@H](F)C2)nc1 ZINC000529618216 324366125 /nfs/dbraw/zinc/36/61/25/324366125.db2.gz GPZVEGDNUARBSB-SNVBAGLBSA-N 1 2 212.243 2.155 20 0 BEADLO COC1(C)C[NH+](Cc2ccc(C(F)F)nc2)C1 ZINC000639180917 354289873 /nfs/dbraw/zinc/28/98/73/354289873.db2.gz PRSGBXHVXWOMRR-UHFFFAOYSA-N 1 2 242.269 2.240 20 0 BEADLO Cc1[nH]c(CNCc2cnccc2C)[nH+]c1C ZINC000577963691 366148183 /nfs/dbraw/zinc/14/81/83/366148183.db2.gz KXXLXKFSYZRKTA-UHFFFAOYSA-N 1 2 230.315 2.020 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+]1CCOCC12CC2 ZINC000334615028 354300954 /nfs/dbraw/zinc/30/09/54/354300954.db2.gz WAIFGZCNTVAYGJ-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1ccc(F)cc1C[N@H+]1CCOCC12CC2 ZINC000334615028 354300956 /nfs/dbraw/zinc/30/09/56/354300956.db2.gz WAIFGZCNTVAYGJ-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1cnc(C[NH+]2CC3(C2)CCCC3)o1 ZINC000639182016 354322681 /nfs/dbraw/zinc/32/26/81/354322681.db2.gz YVUIEJOHKLPAEW-UHFFFAOYSA-N 1 2 206.289 2.359 20 0 BEADLO Fc1ccc(C[NH2+]Cc2ccon2)cc1 ZINC000086452701 491061789 /nfs/dbraw/zinc/06/17/89/491061789.db2.gz WDVBZSXGFILRHN-UHFFFAOYSA-N 1 2 206.220 2.104 20 0 BEADLO Clc1ccc(C[NH2+]Cc2ccon2)o1 ZINC000086452635 491061811 /nfs/dbraw/zinc/06/18/11/491061811.db2.gz HBJCAORZDMVNBR-UHFFFAOYSA-N 1 2 212.636 2.211 20 0 BEADLO C[C@H](CF)[NH2+]Cc1nc2ccccc2o1 ZINC000639182268 354343845 /nfs/dbraw/zinc/34/38/45/354343845.db2.gz DUNAJSWCPAVXAV-MRVPVSSYSA-N 1 2 208.236 2.275 20 0 BEADLO CCOC(=O)[C@@H]1CCC[N@@H+]1Cc1occc1C ZINC000344707264 354352867 /nfs/dbraw/zinc/35/28/67/354352867.db2.gz QAZHTGPXNFITDB-NSHDSACASA-N 1 2 237.299 2.116 20 0 BEADLO CCOC(=O)[C@@H]1CCC[N@H+]1Cc1occc1C ZINC000344707264 354352869 /nfs/dbraw/zinc/35/28/69/354352869.db2.gz QAZHTGPXNFITDB-NSHDSACASA-N 1 2 237.299 2.116 20 0 BEADLO Cn1cc([C@H]([NH2+]Cc2c[nH]cn2)C(C)(C)C)cn1 ZINC000344802782 354378159 /nfs/dbraw/zinc/37/81/59/354378159.db2.gz DZTWEJXMQGEUGF-LBPRGKRZSA-N 1 2 247.346 2.020 20 0 BEADLO CC1(CO)C[NH+](Cc2ccc(F)cc2Cl)C1 ZINC000334646232 354436375 /nfs/dbraw/zinc/43/63/75/354436375.db2.gz MCAXOZHSERBCBA-UHFFFAOYSA-N 1 2 243.709 2.293 20 0 BEADLO Cc1cc(C(=O)Nc2c[nH+]c3n2CCCC3)co1 ZINC000334668066 354407435 /nfs/dbraw/zinc/40/74/35/354407435.db2.gz QKDIDBHGLHSFSR-UHFFFAOYSA-N 1 2 245.282 2.373 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NC1C(C)(C)C1(C)C ZINC000578023700 366189114 /nfs/dbraw/zinc/18/91/14/366189114.db2.gz AQSXOUVYVBAHEV-VIFPVBQESA-N 1 2 249.358 2.139 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NC1C(C)(C)C1(C)C ZINC000578023700 366189121 /nfs/dbraw/zinc/18/91/21/366189121.db2.gz AQSXOUVYVBAHEV-VIFPVBQESA-N 1 2 249.358 2.139 20 0 BEADLO C[C@H](c1csnn1)[N@@H+]1CCCC2(CC2)C1 ZINC000334674037 354416908 /nfs/dbraw/zinc/41/69/08/354416908.db2.gz CNYPDEZPRDDUAS-SECBINFHSA-N 1 2 223.345 2.475 20 0 BEADLO C[C@H](c1csnn1)[N@H+]1CCCC2(CC2)C1 ZINC000334674037 354416911 /nfs/dbraw/zinc/41/69/11/354416911.db2.gz CNYPDEZPRDDUAS-SECBINFHSA-N 1 2 223.345 2.475 20 0 BEADLO Cc1nc(N2C[C@@H](C3CC3)[C@@H]2C2CC2)cc[nH+]1 ZINC000334683236 354429123 /nfs/dbraw/zinc/42/91/23/354429123.db2.gz IZFWYHBZZGEAOS-JSGCOSHPSA-N 1 2 229.327 2.410 20 0 BEADLO Cc1nc(N2C[C@@H](C3CC3)[C@H]2C2CC2)cc[nH+]1 ZINC000334683233 354429140 /nfs/dbraw/zinc/42/91/40/354429140.db2.gz IZFWYHBZZGEAOS-GXTWGEPZSA-N 1 2 229.327 2.410 20 0 BEADLO FC[C@H]1CN(c2[nH]c3ccccc3[nH+]2)CCCO1 ZINC000334652749 354445940 /nfs/dbraw/zinc/44/59/40/354445940.db2.gz STYSXMKZXSKWDU-JTQLQIEISA-N 1 2 249.289 2.128 20 0 BEADLO CC(C)=CCNC(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000334694745 354485238 /nfs/dbraw/zinc/48/52/38/354485238.db2.gz BHRXJSCRPHNUMT-MNOVXSKESA-N 1 2 248.330 2.154 20 0 BEADLO CC1(C)C[C@@H]1C(=O)Nc1c[nH+]c2n1CCCC2 ZINC000334665270 354466820 /nfs/dbraw/zinc/46/68/20/354466820.db2.gz CTHRRGZFFNTAGF-SECBINFHSA-N 1 2 233.315 2.204 20 0 BEADLO CC(C)[C@@H]1C[C@@H]1C(=O)Nc1c[nH+]c2n1CCCC2 ZINC000334665219 354467060 /nfs/dbraw/zinc/46/70/60/354467060.db2.gz DLCCSYIBPJGMGQ-QWRGUYRKSA-N 1 2 247.342 2.450 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@H](F)C1 ZINC000334689512 354477782 /nfs/dbraw/zinc/47/77/82/354477782.db2.gz LUZMATFMHLRJAL-JTQLQIEISA-N 1 2 237.278 2.274 20 0 BEADLO C[C@@H]1c2nncn2CC[N@H+]1CC1=CCCCC1 ZINC000334692050 354481536 /nfs/dbraw/zinc/48/15/36/354481536.db2.gz JVWISOOODZVZQM-LLVKDONJSA-N 1 2 232.331 2.155 20 0 BEADLO C[C@@H]1c2nncn2CC[N@@H+]1CC1=CCCCC1 ZINC000334692050 354481538 /nfs/dbraw/zinc/48/15/38/354481538.db2.gz JVWISOOODZVZQM-LLVKDONJSA-N 1 2 232.331 2.155 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@]1(C)CC=CCC1 ZINC000334729150 354529675 /nfs/dbraw/zinc/52/96/75/354529675.db2.gz YGAIHVPUOZVJTB-AWEZNQCLSA-N 1 2 230.311 2.497 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000334731111 354531339 /nfs/dbraw/zinc/53/13/39/354531339.db2.gz MFFPDCDVCNBLLQ-MWLCHTKSSA-N 1 2 229.283 2.319 20 0 BEADLO Cc1ccc(NC(=O)N2CC[C@@H](F)C2)c(C)[nH+]1 ZINC000334696385 354487758 /nfs/dbraw/zinc/48/77/58/354487758.db2.gz IEVORIDKRQSSRR-SNVBAGLBSA-N 1 2 237.278 2.274 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)c2ccc3[nH+]ccn3c2)C1 ZINC000334699723 354492010 /nfs/dbraw/zinc/49/20/10/354492010.db2.gz RTBDDFMOFZUDOM-PWSUYJOCSA-N 1 2 243.310 2.253 20 0 BEADLO Cc1coc(C)c1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000578076830 366224252 /nfs/dbraw/zinc/22/42/52/366224252.db2.gz ZJURYRBKIDBVJZ-UHFFFAOYSA-N 1 2 247.298 2.285 20 0 BEADLO Cc1cn[nH]c1C[NH+]1CC2(C1)CCCCC2 ZINC000334712847 354510745 /nfs/dbraw/zinc/51/07/45/354510745.db2.gz CODPXAPHQKBSGL-UHFFFAOYSA-N 1 2 219.332 2.484 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@H](C)CC(F)(F)F)c[nH+]1 ZINC000412666704 191304069 /nfs/dbraw/zinc/30/40/69/191304069.db2.gz ZALINLWDGSPCNE-ZCFIWIBFSA-N 1 2 249.236 2.036 20 0 BEADLO CC(C)c1nc(N[C@@H]2CS[C@H](C)C2)cc[nH+]1 ZINC000334802717 354558789 /nfs/dbraw/zinc/55/87/89/354558789.db2.gz ADHAQDPTQKKAKU-ZJUUUORDSA-N 1 2 237.372 2.328 20 0 BEADLO Cc1cc(N[C@@H]2CS[C@@H](C)C2)nc(C2CC2)[nH+]1 ZINC000334805626 354562456 /nfs/dbraw/zinc/56/24/56/354562456.db2.gz LFSQBTPLJXMIBO-ONGXEEELSA-N 1 2 249.383 2.390 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)CC(C)(C)C)c2[nH+]ccn21 ZINC000334756069 354577748 /nfs/dbraw/zinc/57/77/48/354577748.db2.gz SEVFCYVDAPJMOW-VHSXEESVSA-N 1 2 235.331 2.441 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@]1(C)CCCC[C@H]1C ZINC000334762578 354582936 /nfs/dbraw/zinc/58/29/36/354582936.db2.gz XEVNHKVZDQQQBA-QMTHXVAHSA-N 1 2 249.358 2.346 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@]1(C)CCCC[C@H]1C ZINC000334762578 354582938 /nfs/dbraw/zinc/58/29/38/354582938.db2.gz XEVNHKVZDQQQBA-QMTHXVAHSA-N 1 2 249.358 2.346 20 0 BEADLO Fc1ccccc1C1C[NH+](Cc2ccon2)C1 ZINC000639197852 354599378 /nfs/dbraw/zinc/59/93/78/354599378.db2.gz UQOPSFMMRBQKSQ-UHFFFAOYSA-N 1 2 232.258 2.413 20 0 BEADLO CC(C)CC(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000334743792 354547730 /nfs/dbraw/zinc/54/77/30/354547730.db2.gz NADHBEBYZVILIZ-VHSXEESVSA-N 1 2 221.304 2.051 20 0 BEADLO O=C(Nc1ccccc1)[C@@H]1CCc2c[nH+]cn2C1 ZINC000334744671 354548127 /nfs/dbraw/zinc/54/81/27/354548127.db2.gz NYFXKIHYKXLRTE-LLVKDONJSA-N 1 2 241.294 2.084 20 0 BEADLO Cc1ccc(NC(=O)N2CC(C)C2)c(C)[nH+]1 ZINC000335091449 354627530 /nfs/dbraw/zinc/62/75/30/354627530.db2.gz NHZBNVBFYJSORP-UHFFFAOYSA-N 1 2 219.288 2.182 20 0 BEADLO CC1=C[C@@H](C)C[N@H+](Cc2nc(C(F)F)no2)C1 ZINC000335096335 354636202 /nfs/dbraw/zinc/63/62/02/354636202.db2.gz KOTVLEOACKWDCS-SSDOTTSWSA-N 1 2 243.257 2.405 20 0 BEADLO CC1=C[C@@H](C)C[N@@H+](Cc2nc(C(F)F)no2)C1 ZINC000335096335 354636205 /nfs/dbraw/zinc/63/62/05/354636205.db2.gz KOTVLEOACKWDCS-SSDOTTSWSA-N 1 2 243.257 2.405 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1CCCC[C@H]1C ZINC000335105583 354690436 /nfs/dbraw/zinc/69/04/36/354690436.db2.gz VPTNXERHVHXQDQ-MWLCHTKSSA-N 1 2 235.331 2.161 20 0 BEADLO CC(C)(C(=O)NCc1ccccc1)c1c[nH]c[nH+]1 ZINC000345631648 354718790 /nfs/dbraw/zinc/71/87/90/354718790.db2.gz DKJPKTTYXLQPAZ-UHFFFAOYSA-N 1 2 243.310 2.004 20 0 BEADLO CCCCN(CC)C(=O)C(C)(C)c1c[nH+]c[nH]1 ZINC000345639199 354721661 /nfs/dbraw/zinc/72/16/61/354721661.db2.gz MYBDYYFPPBMSNE-UHFFFAOYSA-N 1 2 237.347 2.336 20 0 BEADLO C[C@H]1CC[C@@H](CC(=O)N(C)Cc2[nH]cc[nH+]2)C1 ZINC000345659569 354739162 /nfs/dbraw/zinc/73/91/62/354739162.db2.gz YPFRLPHXFSYCFH-WDEREUQCSA-N 1 2 235.331 2.194 20 0 BEADLO Cc1cc(C[N@@H+](C(C)C)C2COC2)sn1 ZINC000639215873 354833494 /nfs/dbraw/zinc/83/34/94/354833494.db2.gz KLODGPBJJXYCLP-UHFFFAOYSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1cc(C[N@H+](C(C)C)C2COC2)sn1 ZINC000639215873 354833496 /nfs/dbraw/zinc/83/34/96/354833496.db2.gz KLODGPBJJXYCLP-UHFFFAOYSA-N 1 2 226.345 2.061 20 0 BEADLO CCCCCNc1nc[nH+]c(N)c1Cl ZINC000232981840 363390712 /nfs/dbraw/zinc/39/07/12/363390712.db2.gz DIRONFRWITXBDW-UHFFFAOYSA-N 1 2 214.700 2.314 20 0 BEADLO CCCCCNc1[nH+]cnc(N)c1Cl ZINC000232981840 363390716 /nfs/dbraw/zinc/39/07/16/363390716.db2.gz DIRONFRWITXBDW-UHFFFAOYSA-N 1 2 214.700 2.314 20 0 BEADLO CCc1nc(C[N@@H+]2C[C@@H]3C[C@H]2CS3)cs1 ZINC000335156502 354866437 /nfs/dbraw/zinc/86/64/37/354866437.db2.gz RCYNEZJWRNMFNB-UWVGGRQHSA-N 1 2 240.397 2.395 20 0 BEADLO CCc1nc(C[N@H+]2C[C@@H]3C[C@H]2CS3)cs1 ZINC000335156502 354866438 /nfs/dbraw/zinc/86/64/38/354866438.db2.gz RCYNEZJWRNMFNB-UWVGGRQHSA-N 1 2 240.397 2.395 20 0 BEADLO C[C@H]1COCC[N@@H+]1Cc1ccc(C(F)F)nc1 ZINC000639216795 354857889 /nfs/dbraw/zinc/85/78/89/354857889.db2.gz CGWHIVSXGSVHRB-VIFPVBQESA-N 1 2 242.269 2.240 20 0 BEADLO C[C@H]1COCC[N@H+]1Cc1ccc(C(F)F)nc1 ZINC000639216795 354857892 /nfs/dbraw/zinc/85/78/92/354857892.db2.gz CGWHIVSXGSVHRB-VIFPVBQESA-N 1 2 242.269 2.240 20 0 BEADLO Cc1cc(F)c(C[N@@H+](C)[C@@H]2CCOC2)c(F)c1 ZINC000335148729 354862702 /nfs/dbraw/zinc/86/27/02/354862702.db2.gz YDGHFVPBZFPFMZ-SNVBAGLBSA-N 1 2 241.281 2.494 20 0 BEADLO Cc1cc(F)c(C[N@H+](C)[C@@H]2CCOC2)c(F)c1 ZINC000335148729 354862705 /nfs/dbraw/zinc/86/27/05/354862705.db2.gz YDGHFVPBZFPFMZ-SNVBAGLBSA-N 1 2 241.281 2.494 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CC[C@H](CC(C)C)C1 ZINC000346388519 354907826 /nfs/dbraw/zinc/90/78/26/354907826.db2.gz QOWKFRLXCHCREU-GFCCVEGCSA-N 1 2 249.358 2.155 20 0 BEADLO C[C@@H]1OCC[C@H]1Nc1ccc(N2CCCC2)c[nH+]1 ZINC000346423080 354924933 /nfs/dbraw/zinc/92/49/33/354924933.db2.gz ZCDMIQBQHKZSNO-WCQYABFASA-N 1 2 247.342 2.271 20 0 BEADLO C[C@@H](c1cnn(C)c1)[N@H+](C)Cc1ccc(F)cn1 ZINC000346505563 354962133 /nfs/dbraw/zinc/96/21/33/354962133.db2.gz SHLLIUWGKGBTCT-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO C[C@@H](c1cnn(C)c1)[N@@H+](C)Cc1ccc(F)cn1 ZINC000346505563 354962137 /nfs/dbraw/zinc/96/21/37/354962137.db2.gz SHLLIUWGKGBTCT-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO c1cc(NC2CCOCC2)[nH+]cc1N1CCCC1 ZINC000346459476 354964546 /nfs/dbraw/zinc/96/45/46/354964546.db2.gz GYCRBZDWCQBQON-UHFFFAOYSA-N 1 2 247.342 2.273 20 0 BEADLO CC[C@](C)(O)C[N@@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000335201187 355034455 /nfs/dbraw/zinc/03/44/55/355034455.db2.gz HFOBLBDZOFKGNP-ZJUUUORDSA-N 1 2 221.291 2.125 20 0 BEADLO CC[C@](C)(O)C[N@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000335201187 355034459 /nfs/dbraw/zinc/03/44/59/355034459.db2.gz HFOBLBDZOFKGNP-ZJUUUORDSA-N 1 2 221.291 2.125 20 0 BEADLO C[C@H]1COC(C)(C)CN1c1cccc[nH+]1 ZINC000335205691 355041552 /nfs/dbraw/zinc/04/15/52/355041552.db2.gz XAEOFYROZQUOPW-JTQLQIEISA-N 1 2 206.289 2.085 20 0 BEADLO Cc1c(Cl)c(C[NH2+][C@@H]2CCC[C@@H]2F)nn1C ZINC000335181433 355078539 /nfs/dbraw/zinc/07/85/39/355078539.db2.gz ZUZDYYDHPULITA-DTWKUNHWSA-N 1 2 245.729 2.362 20 0 BEADLO Cc1nnc(C[N@@H+]2CCCc3ccccc3C2)[nH]1 ZINC000335212105 355049625 /nfs/dbraw/zinc/04/96/25/355049625.db2.gz RHVZMXIMXXKXII-UHFFFAOYSA-N 1 2 242.326 2.062 20 0 BEADLO Cc1nnc(C[N@H+]2CCCc3ccccc3C2)[nH]1 ZINC000335212105 355049629 /nfs/dbraw/zinc/04/96/29/355049629.db2.gz RHVZMXIMXXKXII-UHFFFAOYSA-N 1 2 242.326 2.062 20 0 BEADLO C[N@H+](Cc1ccoc1)Cc1cncc(F)c1 ZINC000346829719 355128833 /nfs/dbraw/zinc/12/88/33/355128833.db2.gz RPBPJZOZJRQLIC-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO C[N@@H+](Cc1ccoc1)Cc1cncc(F)c1 ZINC000346829719 355128836 /nfs/dbraw/zinc/12/88/36/355128836.db2.gz RPBPJZOZJRQLIC-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO COc1cccc(OC)c1C[N@@H+]1CC[C@H](F)C1 ZINC000639229633 355132606 /nfs/dbraw/zinc/13/26/06/355132606.db2.gz WMKKSASNKQOVCY-JTQLQIEISA-N 1 2 239.290 2.248 20 0 BEADLO COc1cccc(OC)c1C[N@H+]1CC[C@H](F)C1 ZINC000639229633 355132609 /nfs/dbraw/zinc/13/26/09/355132609.db2.gz WMKKSASNKQOVCY-JTQLQIEISA-N 1 2 239.290 2.248 20 0 BEADLO C[C@H](c1nncn1C)[N@H+](C)Cc1ccc(F)cc1 ZINC000346850857 355138172 /nfs/dbraw/zinc/13/81/72/355138172.db2.gz RXLXWNUPSIYSJE-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO C[C@H](c1nncn1C)[N@@H+](C)Cc1ccc(F)cc1 ZINC000346850857 355138174 /nfs/dbraw/zinc/13/81/74/355138174.db2.gz RXLXWNUPSIYSJE-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO Cc1occc1SCC[N@H+]1CCOC[C@@H]1C ZINC000412997584 191333582 /nfs/dbraw/zinc/33/35/82/191333582.db2.gz HOQZOJYKSDJJQT-JTQLQIEISA-N 1 2 241.356 2.401 20 0 BEADLO Cc1occc1SCC[N@@H+]1CCOC[C@@H]1C ZINC000412997584 191333584 /nfs/dbraw/zinc/33/35/84/191333584.db2.gz HOQZOJYKSDJJQT-JTQLQIEISA-N 1 2 241.356 2.401 20 0 BEADLO CCC[N@H+](CC(F)F)C[C@H](CC)OC ZINC000412975646 191347538 /nfs/dbraw/zinc/34/75/38/191347538.db2.gz GIIWDZWWEPIRGC-VIFPVBQESA-N 1 2 209.280 2.389 20 0 BEADLO CCC[N@@H+](CC(F)F)C[C@H](CC)OC ZINC000412975646 191347541 /nfs/dbraw/zinc/34/75/41/191347541.db2.gz GIIWDZWWEPIRGC-VIFPVBQESA-N 1 2 209.280 2.389 20 0 BEADLO CC[C@H](C[N@H+](CC(F)F)C(C)C)OC ZINC000412978657 191348221 /nfs/dbraw/zinc/34/82/21/191348221.db2.gz QQGBVHCBUXTVPW-SECBINFHSA-N 1 2 209.280 2.387 20 0 BEADLO CC[C@H](C[N@@H+](CC(F)F)C(C)C)OC ZINC000412978657 191348224 /nfs/dbraw/zinc/34/82/24/191348224.db2.gz QQGBVHCBUXTVPW-SECBINFHSA-N 1 2 209.280 2.387 20 0 BEADLO CC(C)C1(C[N@@H+](CC(F)F)C[C@@H](C)O)CC1 ZINC000639234688 355219289 /nfs/dbraw/zinc/21/92/89/355219289.db2.gz KZXXCBVEINCEIR-SNVBAGLBSA-N 1 2 235.318 2.371 20 0 BEADLO CC(C)C1(C[N@H+](CC(F)F)C[C@@H](C)O)CC1 ZINC000639234688 355219292 /nfs/dbraw/zinc/21/92/92/355219292.db2.gz KZXXCBVEINCEIR-SNVBAGLBSA-N 1 2 235.318 2.371 20 0 BEADLO Cc1[nH+]c(C(C)C)ccc1Cn1ccncc1=O ZINC000335288950 355259771 /nfs/dbraw/zinc/25/97/71/355259771.db2.gz WDYNWRIYHJEINH-UHFFFAOYSA-N 1 2 243.310 2.118 20 0 BEADLO COCC[C@@H](C)CNc1cc[nH+]c2ccncc12 ZINC000413490627 191388542 /nfs/dbraw/zinc/38/85/42/191388542.db2.gz JCFIHMZQYLVBMB-LLVKDONJSA-N 1 2 245.326 2.136 20 0 BEADLO F[C@@H]1CCCC[C@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000413528366 191392861 /nfs/dbraw/zinc/39/28/61/191392861.db2.gz DHQNEUIFDAVGSZ-GHMZBOCLSA-N 1 2 235.306 2.469 20 0 BEADLO C[C@@H]1C[C@@H](CNc2cccc[nH+]2)[C@@H](C)O1 ZINC000413539438 191394141 /nfs/dbraw/zinc/39/41/41/191394141.db2.gz UBNIGBSDNOTLNU-MXWKQRLJSA-N 1 2 206.289 2.307 20 0 BEADLO CC1=CCN(c2cc(NC3CC3)[nH+]cn2)CC1 ZINC000413197319 191362699 /nfs/dbraw/zinc/36/26/99/191362699.db2.gz FYWNDJDDMHQMRA-UHFFFAOYSA-N 1 2 230.315 2.207 20 0 BEADLO CC1=CCN(c2cc(NC3CC3)nc[nH+]2)CC1 ZINC000413197319 191362701 /nfs/dbraw/zinc/36/27/01/191362701.db2.gz FYWNDJDDMHQMRA-UHFFFAOYSA-N 1 2 230.315 2.207 20 0 BEADLO CCc1csc(NCCc2ccc(C)c[nH+]2)n1 ZINC000413351202 191373698 /nfs/dbraw/zinc/37/36/98/191373698.db2.gz LHPWESGPUAOAGV-UHFFFAOYSA-N 1 2 247.367 2.485 20 0 BEADLO Cc1ccc(CCNc2nccc(C)n2)[nH+]c1 ZINC000413357284 191374840 /nfs/dbraw/zinc/37/48/40/191374840.db2.gz VIDOIPFDIHRFQQ-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO Cc1cc(NC[C@@H]2CC[C@@H](C)O2)nc(C2CC2)[nH+]1 ZINC000413377057 191377276 /nfs/dbraw/zinc/37/72/76/191377276.db2.gz NVNACOMCUJBZCN-PWSUYJOCSA-N 1 2 247.342 2.064 20 0 BEADLO CCOC[C@@H]1CCCCN1c1cc(C)[nH+]cn1 ZINC000413421989 191379259 /nfs/dbraw/zinc/37/92/59/191379259.db2.gz CAAPVFDWTMYLSF-LBPRGKRZSA-N 1 2 235.331 2.180 20 0 BEADLO Cc1nc(N(C)C2CC(C)(C)C2)cc[nH+]1 ZINC000413438480 191380760 /nfs/dbraw/zinc/38/07/60/191380760.db2.gz LUCNMNRQUSJWFC-UHFFFAOYSA-N 1 2 205.305 2.410 20 0 BEADLO CC(C)(C)c1nnc(CNc2cccc[nH+]2)[nH]1 ZINC000413419650 191381648 /nfs/dbraw/zinc/38/16/48/191381648.db2.gz NNJJZEYVFBWBAY-UHFFFAOYSA-N 1 2 231.303 2.109 20 0 BEADLO Cc1nc2ccc(C[NH+]3CC(C)(O)C3)cc2s1 ZINC000639253456 355291445 /nfs/dbraw/zinc/29/14/45/355291445.db2.gz GGGLBSMQWATQNX-UHFFFAOYSA-N 1 2 248.351 2.171 20 0 BEADLO CC(C)n1ncnc1C[NH+]1CC(C(C)(C)C)C1 ZINC000639255207 355298336 /nfs/dbraw/zinc/29/83/36/355298336.db2.gz CUWDCAHAPYFLJF-UHFFFAOYSA-N 1 2 236.363 2.337 20 0 BEADLO c1cc(C[N@@H+]2CCO[C@H](C3CCC3)C2)sn1 ZINC000639261048 355310997 /nfs/dbraw/zinc/31/09/97/355310997.db2.gz KJICMKUGZCBSQI-LBPRGKRZSA-N 1 2 238.356 2.144 20 0 BEADLO c1cc(C[N@H+]2CCO[C@H](C3CCC3)C2)sn1 ZINC000639261048 355310999 /nfs/dbraw/zinc/31/09/99/355310999.db2.gz KJICMKUGZCBSQI-LBPRGKRZSA-N 1 2 238.356 2.144 20 0 BEADLO Cc1cnc(C[NH2+][C@@H]2CCCC[C@H]2F)o1 ZINC000639268079 355329877 /nfs/dbraw/zinc/32/98/77/355329877.db2.gz UYJUSZDZZQNLKC-NXEZZACHSA-N 1 2 212.268 2.353 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1[C@H](C)[C@H]1C1CC1 ZINC000528464802 355333265 /nfs/dbraw/zinc/33/32/65/355333265.db2.gz GGPWGESEZIKUKE-JIMOISOXSA-N 1 2 230.311 2.043 20 0 BEADLO c1coc([C@@H]2C[C@H]2Nc2cc[nH+]c(C3CC3)n2)c1 ZINC000413602833 191398844 /nfs/dbraw/zinc/39/88/44/191398844.db2.gz JZNHXYQFWPMYAC-GHMZBOCLSA-N 1 2 241.294 2.337 20 0 BEADLO Cc1ncc([C@H](C)[NH+]2CC(C(F)F)C2)c(C)n1 ZINC000639252942 355287067 /nfs/dbraw/zinc/28/70/67/355287067.db2.gz WLIYSRLPFYDCFL-QMMMGPOBSA-N 1 2 241.285 2.351 20 0 BEADLO Cc1cnc(C[NH2+]Cc2cc(C)nc(C)c2)o1 ZINC000639272959 355343818 /nfs/dbraw/zinc/34/38/18/355343818.db2.gz QGYLDOSDBWKYIW-UHFFFAOYSA-N 1 2 231.299 2.285 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1C[C@H](C)C[C@H](C)C1 ZINC000583508470 355346192 /nfs/dbraw/zinc/34/61/92/355346192.db2.gz LGMJBJLMNZISCE-TUAOUCFPSA-N 1 2 249.358 2.093 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1C[C@H](C)C[C@H](C)C1 ZINC000583508470 355346195 /nfs/dbraw/zinc/34/61/95/355346195.db2.gz LGMJBJLMNZISCE-TUAOUCFPSA-N 1 2 249.358 2.093 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1C[C@H](C)C[C@@H](C)C1 ZINC000583508471 355346207 /nfs/dbraw/zinc/34/62/07/355346207.db2.gz LGMJBJLMNZISCE-UTUOFQBUSA-N 1 2 249.358 2.093 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1C[C@H](C)C[C@@H](C)C1 ZINC000583508471 355346212 /nfs/dbraw/zinc/34/62/12/355346212.db2.gz LGMJBJLMNZISCE-UTUOFQBUSA-N 1 2 249.358 2.093 20 0 BEADLO C[C@@H](N[C@@H](c1[nH+]ccn1C)C1CC1)C(F)(F)F ZINC000639276840 355353460 /nfs/dbraw/zinc/35/34/60/355353460.db2.gz GSMXOHFHYWPNAX-VXNVDRBHSA-N 1 2 247.264 2.412 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccns2)CC2(CCC2)O1 ZINC000639289005 355407486 /nfs/dbraw/zinc/40/74/86/355407486.db2.gz VLPXQVWWWKXTCX-JTQLQIEISA-N 1 2 238.356 2.287 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccns2)CC2(CCC2)O1 ZINC000639289005 355407491 /nfs/dbraw/zinc/40/74/91/355407491.db2.gz VLPXQVWWWKXTCX-JTQLQIEISA-N 1 2 238.356 2.287 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)[C@@H]1CCCCC1(C)C ZINC000335791009 355442710 /nfs/dbraw/zinc/44/27/10/355442710.db2.gz SRUFTWCKLOHLQO-NSHDSACASA-N 1 2 249.358 2.253 20 0 BEADLO Cc1sccc1CC(=O)Nc1cc[nH+]c(C)c1 ZINC000335791846 355444312 /nfs/dbraw/zinc/44/43/12/355444312.db2.gz XOLMUUUMCUFVHJ-UHFFFAOYSA-N 1 2 246.335 2.363 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC000335774389 355399347 /nfs/dbraw/zinc/39/93/47/355399347.db2.gz MGPXQDFRFOZYAO-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO CC(=O)c1cc(NCc2c[nH+]cn2C)ccc1F ZINC000349786246 355462191 /nfs/dbraw/zinc/46/21/91/355462191.db2.gz ALCHNMLOSIXJHB-UHFFFAOYSA-N 1 2 247.273 2.374 20 0 BEADLO C[NH2+]Cc1noc(C2(CC(C)C)CCC2)n1 ZINC000349889674 355530066 /nfs/dbraw/zinc/53/00/66/355530066.db2.gz KPPSXJRHQIJGSU-UHFFFAOYSA-N 1 2 223.320 2.257 20 0 BEADLO C[C@H]1Oc2cc(F)ccc2[C@H]1[NH2+]Cc1cc[nH]n1 ZINC000335826744 355552004 /nfs/dbraw/zinc/55/20/04/355552004.db2.gz HIVUFWRKPAXJAD-OQPBUACISA-N 1 2 247.273 2.161 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H]1CC[C@H](C)C1 ZINC000335827749 355553742 /nfs/dbraw/zinc/55/37/42/355553742.db2.gz MTMUMKDWBXMYIF-VHSXEESVSA-N 1 2 234.299 2.465 20 0 BEADLO COC(=O)c1coc(C[N@H+](C)Cc2ccc[nH]2)c1 ZINC000349979411 355558404 /nfs/dbraw/zinc/55/84/04/355558404.db2.gz WSASSVYXSFFCCT-UHFFFAOYSA-N 1 2 248.282 2.026 20 0 BEADLO COC(=O)c1coc(C[N@@H+](C)Cc2ccc[nH]2)c1 ZINC000349979411 355558407 /nfs/dbraw/zinc/55/84/07/355558407.db2.gz WSASSVYXSFFCCT-UHFFFAOYSA-N 1 2 248.282 2.026 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1nc(-c2ccco2)no1 ZINC000335817451 355507854 /nfs/dbraw/zinc/50/78/54/355507854.db2.gz JYJUOCMHPOXKKQ-RKDXNWHRSA-N 1 2 233.271 2.312 20 0 BEADLO C[NH2+]Cc1noc(CCCc2ccc(C)cc2)n1 ZINC000349893026 355520305 /nfs/dbraw/zinc/52/03/05/355520305.db2.gz MZKAKUFAVKQHBV-UHFFFAOYSA-N 1 2 245.326 2.273 20 0 BEADLO C[NH2+]Cc1noc(C(C)(C)c2ccccc2F)n1 ZINC000349896528 355520876 /nfs/dbraw/zinc/52/08/76/355520876.db2.gz RDYDVTVPDVBNET-UHFFFAOYSA-N 1 2 249.289 2.254 20 0 BEADLO C[NH2+]Cc1noc(C[C@@H]2CCC[C@H](C)C2)n1 ZINC000349893676 355521015 /nfs/dbraw/zinc/52/10/15/355521015.db2.gz NXVOJHYZWZSJHS-VHSXEESVSA-N 1 2 223.320 2.158 20 0 BEADLO CCc1ccc(CCc2nc(C[NH2+]C)no2)cc1 ZINC000349910397 355524624 /nfs/dbraw/zinc/52/46/24/355524624.db2.gz LXQDYZIEVVIZCT-UHFFFAOYSA-N 1 2 245.326 2.137 20 0 BEADLO C[NH2+]Cc1noc([C@H](C)c2cccc(F)c2)n1 ZINC000349914670 355525825 /nfs/dbraw/zinc/52/58/25/355525825.db2.gz UKMRYBKWQSYSIU-MRVPVSSYSA-N 1 2 235.262 2.080 20 0 BEADLO C[NH2+]Cc1noc([C@H](C)c2ccccc2F)n1 ZINC000349919130 355526480 /nfs/dbraw/zinc/52/64/80/355526480.db2.gz GGYYUTRNNBQLFU-MRVPVSSYSA-N 1 2 235.262 2.080 20 0 BEADLO C[NH2+]Cc1noc(CC/C=C/c2ccccc2)n1 ZINC000349917851 355526794 /nfs/dbraw/zinc/52/67/94/355526794.db2.gz BPXWKQFDNZQHON-WEVVVXLNSA-N 1 2 243.310 2.435 20 0 BEADLO C[NH2+]Cc1noc(C(C)(C)c2ccccc2C)n1 ZINC000349920618 355527849 /nfs/dbraw/zinc/52/78/49/355527849.db2.gz KMBJPFNXEAZMFW-UHFFFAOYSA-N 1 2 245.326 2.423 20 0 BEADLO C[NH2+]Cc1noc(C[C@@H](C)c2ccccc2C)n1 ZINC000349919660 355527896 /nfs/dbraw/zinc/52/78/96/355527896.db2.gz HWJKHGRYQSZVFE-LLVKDONJSA-N 1 2 245.326 2.444 20 0 BEADLO C[NH2+]Cc1noc(C2(c3cccc(F)c3)CC2)n1 ZINC000349923550 355528505 /nfs/dbraw/zinc/52/85/05/355528505.db2.gz WWTDMYOIUSHMDZ-UHFFFAOYSA-N 1 2 247.273 2.008 20 0 BEADLO Cc1nnc(C[N@@H+]2CCCC3(CC3)C2)s1 ZINC000335841355 355585552 /nfs/dbraw/zinc/58/55/52/355585552.db2.gz BYVAGBFKUOBFSR-UHFFFAOYSA-N 1 2 223.345 2.223 20 0 BEADLO Cc1nnc(C[N@H+]2CCCC3(CC3)C2)s1 ZINC000335841355 355585557 /nfs/dbraw/zinc/58/55/57/355585557.db2.gz BYVAGBFKUOBFSR-UHFFFAOYSA-N 1 2 223.345 2.223 20 0 BEADLO CC(C)C[N@@H+]1CC(=O)N[C@@H]1[C@@H]1CCC[C@@H](C)C1 ZINC000350129102 355611101 /nfs/dbraw/zinc/61/11/01/355611101.db2.gz YUUPCZMFRNTIAP-BZPMIXESSA-N 1 2 238.375 2.227 20 0 BEADLO CC(C)C[N@H+]1CC(=O)N[C@@H]1[C@@H]1CCC[C@@H](C)C1 ZINC000350129102 355611104 /nfs/dbraw/zinc/61/11/04/355611104.db2.gz YUUPCZMFRNTIAP-BZPMIXESSA-N 1 2 238.375 2.227 20 0 BEADLO CCc1cc[nH+]cc1N[C@H](C)[C@H](C)OC ZINC000639295113 355577502 /nfs/dbraw/zinc/57/75/02/355577502.db2.gz NDOLCUFVCROPGA-ZJUUUORDSA-N 1 2 208.305 2.479 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2CCSC2)c(C)[nH+]1 ZINC000335872785 355640508 /nfs/dbraw/zinc/64/05/08/355640508.db2.gz UMACITVAHSWBSE-SNVBAGLBSA-N 1 2 236.340 2.390 20 0 BEADLO Cc1cc(C(=O)N2CCC[C@H]2c2[nH]cc[nH+]2)co1 ZINC000335875878 355645285 /nfs/dbraw/zinc/64/52/85/355645285.db2.gz HQQGTRNFMRNOHK-NSHDSACASA-N 1 2 245.282 2.288 20 0 BEADLO CCC[C@@H](C)C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000582186484 355656045 /nfs/dbraw/zinc/65/60/45/355656045.db2.gz CSOOEVBJSQDZAZ-SECBINFHSA-N 1 2 223.320 2.197 20 0 BEADLO NC(=O)[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](F)C1 ZINC000336261185 181203657 /nfs/dbraw/zinc/20/36/57/181203657.db2.gz SCPBHFKBQXDWNW-GHMZBOCLSA-N 1 2 222.263 2.307 20 0 BEADLO NC(=O)[C@@H](c1ccccc1)[N@H+]1CC[C@@H](F)C1 ZINC000336261185 181203659 /nfs/dbraw/zinc/20/36/59/181203659.db2.gz SCPBHFKBQXDWNW-GHMZBOCLSA-N 1 2 222.263 2.307 20 0 BEADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccon1 ZINC000336006447 134049207 /nfs/dbraw/zinc/04/92/07/134049207.db2.gz RHFNYNWTLDUYCE-APPZFPTMSA-N 1 2 234.221 2.447 20 0 BEADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccon1 ZINC000336006447 134049208 /nfs/dbraw/zinc/04/92/08/134049208.db2.gz RHFNYNWTLDUYCE-APPZFPTMSA-N 1 2 234.221 2.447 20 0 BEADLO Cc1ccccc1C[N@@H+]1Cc2cnn(C)c2C1 ZINC000639324410 355718893 /nfs/dbraw/zinc/71/88/93/355718893.db2.gz JQDRGFCMEOUQIR-UHFFFAOYSA-N 1 2 227.311 2.244 20 0 BEADLO Cc1ccccc1C[N@H+]1Cc2cnn(C)c2C1 ZINC000639324410 355718896 /nfs/dbraw/zinc/71/88/96/355718896.db2.gz JQDRGFCMEOUQIR-UHFFFAOYSA-N 1 2 227.311 2.244 20 0 BEADLO Cc1ccc(CC[N@@H+]2Cc3cnn(C)c3C2)cc1 ZINC000639320050 355720506 /nfs/dbraw/zinc/72/05/06/355720506.db2.gz BZEYITPXIQTCBF-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO Cc1ccc(CC[N@H+]2Cc3cnn(C)c3C2)cc1 ZINC000639320050 355720508 /nfs/dbraw/zinc/72/05/08/355720508.db2.gz BZEYITPXIQTCBF-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO NC(=O)[C@H](c1ccccc1)[N@@H+]1CC[C@@H](F)C1 ZINC000336261186 181205803 /nfs/dbraw/zinc/20/58/03/181205803.db2.gz SCPBHFKBQXDWNW-MNOVXSKESA-N 1 2 222.263 2.307 20 0 BEADLO NC(=O)[C@H](c1ccccc1)[N@H+]1CC[C@@H](F)C1 ZINC000336261186 181205805 /nfs/dbraw/zinc/20/58/05/181205805.db2.gz SCPBHFKBQXDWNW-MNOVXSKESA-N 1 2 222.263 2.307 20 0 BEADLO COc1cc(C[N@@H+]2CCC[C@@H](F)C2)sn1 ZINC000639312754 355684505 /nfs/dbraw/zinc/68/45/05/355684505.db2.gz JGDRLKPFUMZYNB-MRVPVSSYSA-N 1 2 230.308 2.086 20 0 BEADLO COc1cc(C[N@H+]2CCC[C@@H](F)C2)sn1 ZINC000639312754 355684507 /nfs/dbraw/zinc/68/45/07/355684507.db2.gz JGDRLKPFUMZYNB-MRVPVSSYSA-N 1 2 230.308 2.086 20 0 BEADLO Cc1nccc(C[N@H+](C)Cc2ccoc2)n1 ZINC000350654834 355737273 /nfs/dbraw/zinc/73/72/73/355737273.db2.gz HNQMVJVXOLPNAQ-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1nccc(C[N@@H+](C)Cc2ccoc2)n1 ZINC000350654834 355737276 /nfs/dbraw/zinc/73/72/76/355737276.db2.gz HNQMVJVXOLPNAQ-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ncc(C[NH+]2CC3(CCC3(F)F)C2)cn1 ZINC000336017890 134053864 /nfs/dbraw/zinc/05/38/64/134053864.db2.gz BUDATAHDGJEMBH-UHFFFAOYSA-N 1 2 239.269 2.016 20 0 BEADLO COC(=O)[C@H](CC(C)C)[NH2+][C@H]1CC[C@@H]1SC ZINC000425343497 191816618 /nfs/dbraw/zinc/81/66/18/191816618.db2.gz RSXFETVJYMUQBI-DCAQKATOSA-N 1 2 245.388 2.058 20 0 BEADLO Cc1cccc(C[N@@H+]2Cc3cnn(C)c3C2)c1 ZINC000639325480 355728285 /nfs/dbraw/zinc/72/82/85/355728285.db2.gz SMWRPVKGVIKHBO-UHFFFAOYSA-N 1 2 227.311 2.244 20 0 BEADLO Cc1cccc(C[N@H+]2Cc3cnn(C)c3C2)c1 ZINC000639325480 355728287 /nfs/dbraw/zinc/72/82/87/355728287.db2.gz SMWRPVKGVIKHBO-UHFFFAOYSA-N 1 2 227.311 2.244 20 0 BEADLO Oc1cccc2c1CC[N@H+](Cc1ccns1)C2 ZINC000639354087 355804979 /nfs/dbraw/zinc/80/49/79/355804979.db2.gz DECNLJKOSGKVAM-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO Oc1cccc2c1CC[N@@H+](Cc1ccns1)C2 ZINC000639354087 355804982 /nfs/dbraw/zinc/80/49/82/355804982.db2.gz DECNLJKOSGKVAM-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO CCc1cnc(C[N@H+]2C[C@H](C)OC[C@H]2CC)o1 ZINC000608492517 355809094 /nfs/dbraw/zinc/80/90/94/355809094.db2.gz ITVVOQNANVLJSP-WDEREUQCSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1cnc(C[N@@H+]2C[C@H](C)OC[C@H]2CC)o1 ZINC000608492517 355809096 /nfs/dbraw/zinc/80/90/96/355809096.db2.gz ITVVOQNANVLJSP-WDEREUQCSA-N 1 2 238.331 2.236 20 0 BEADLO CCC[C@H](Cc1ccccc1)[NH2+]Cc1c[nH]nn1 ZINC000628363429 355848538 /nfs/dbraw/zinc/84/85/38/355848538.db2.gz JXNNXWJEQJQEFC-CYBMUJFWSA-N 1 2 244.342 2.306 20 0 BEADLO CCC[C@H](Cc1ccccc1)[NH2+]Cc1cn[nH]n1 ZINC000628363429 355848541 /nfs/dbraw/zinc/84/85/41/355848541.db2.gz JXNNXWJEQJQEFC-CYBMUJFWSA-N 1 2 244.342 2.306 20 0 BEADLO CC1(c2ccccc2)CC([NH2+]Cc2c[nH]nn2)C1 ZINC000628363835 355850085 /nfs/dbraw/zinc/85/00/85/355850085.db2.gz ZURCOMYIUAGECT-UHFFFAOYSA-N 1 2 242.326 2.015 20 0 BEADLO CC1(c2ccccc2)CC([NH2+]Cc2cn[nH]n2)C1 ZINC000628363835 355850088 /nfs/dbraw/zinc/85/00/88/355850088.db2.gz ZURCOMYIUAGECT-UHFFFAOYSA-N 1 2 242.326 2.015 20 0 BEADLO CC[C@](C)(CNc1c[nH+]cc(N(C)C)c1)OC ZINC000639363933 355832339 /nfs/dbraw/zinc/83/23/39/355832339.db2.gz FHFXVBVYNBXBQR-CYBMUJFWSA-N 1 2 237.347 2.375 20 0 BEADLO COC(=O)[C@@H](c1ccsc1)[N@@H+]1CCC[C@H]1C ZINC000034567205 355907392 /nfs/dbraw/zinc/90/73/92/355907392.db2.gz OPKVCONGKSHHMS-MWLCHTKSSA-N 1 2 239.340 2.447 20 0 BEADLO COC(=O)[C@@H](c1ccsc1)[N@H+]1CCC[C@H]1C ZINC000034567205 355907397 /nfs/dbraw/zinc/90/73/97/355907397.db2.gz OPKVCONGKSHHMS-MWLCHTKSSA-N 1 2 239.340 2.447 20 0 BEADLO CC1([NH2+]Cc2cscc2Cl)COC1 ZINC000639380243 355916022 /nfs/dbraw/zinc/91/60/22/355916022.db2.gz CQOVSZSNGYMTDF-UHFFFAOYSA-N 1 2 217.721 2.280 20 0 BEADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]C2(C)COC2)o1 ZINC000639382448 355928642 /nfs/dbraw/zinc/92/86/42/355928642.db2.gz QELBIGGYTAKORK-GXSJLCMTSA-N 1 2 221.300 2.282 20 0 BEADLO FCCC1CC[NH+](Cc2csnn2)CC1 ZINC000639376787 355901415 /nfs/dbraw/zinc/90/14/15/355901415.db2.gz ZUPNJXNKEZLTHK-UHFFFAOYSA-N 1 2 229.324 2.110 20 0 BEADLO COc1ccc(CNc2cccc(CO)[nH+]2)cc1 ZINC000351416793 355987701 /nfs/dbraw/zinc/98/77/01/355987701.db2.gz POEYDWSAZPIYJW-UHFFFAOYSA-N 1 2 244.294 2.195 20 0 BEADLO CCOC[C@@H]([NH2+][C@@H](C)c1noc(C)n1)C(C)C ZINC000352114710 134069673 /nfs/dbraw/zinc/06/96/73/134069673.db2.gz CCPPLMMJZSJNFB-GXSJLCMTSA-N 1 2 241.335 2.090 20 0 BEADLO C[N@H+](Cc1cc(C(C)(C)C)on1)[C@H]1CCOC1 ZINC000351495993 356003147 /nfs/dbraw/zinc/00/31/47/356003147.db2.gz QTEFOVDCEACUCB-NSHDSACASA-N 1 2 238.331 2.193 20 0 BEADLO C[N@@H+](Cc1cc(C(C)(C)C)on1)[C@H]1CCOC1 ZINC000351495993 356003150 /nfs/dbraw/zinc/00/31/50/356003150.db2.gz QTEFOVDCEACUCB-NSHDSACASA-N 1 2 238.331 2.193 20 0 BEADLO CCc1cc(C[NH2+][C@@H](C)c2cncnc2C)on1 ZINC000583641343 355947138 /nfs/dbraw/zinc/94/71/38/355947138.db2.gz NAWKTGOCZMCTTF-VIFPVBQESA-N 1 2 246.314 2.186 20 0 BEADLO CCC(=O)NCCCn1c(C)[nH+]c2ccccc21 ZINC000036125980 356007692 /nfs/dbraw/zinc/00/76/92/356007692.db2.gz RIYFBHHSHDXUAD-UHFFFAOYSA-N 1 2 245.326 2.261 20 0 BEADLO C[C@H]([NH2+]Cc1ncccn1)c1cccc(O)c1 ZINC000192154907 355958856 /nfs/dbraw/zinc/95/88/56/355958856.db2.gz VZYYGRRMQQSRJF-JTQLQIEISA-N 1 2 229.283 2.033 20 0 BEADLO C/C=C\C[C@H](CO)Nc1cc(C)[nH+]c(C(C)C)n1 ZINC000351543320 356012871 /nfs/dbraw/zinc/01/28/71/356012871.db2.gz JGMDXTOBFVWKAH-FOQNGQEVSA-N 1 2 249.358 2.069 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N(C)[C@H]1CC[C@@H](C)C1 ZINC000335906367 356105946 /nfs/dbraw/zinc/10/59/46/356105946.db2.gz AKTODRGPGMFOMU-PWSUYJOCSA-N 1 2 247.342 2.464 20 0 BEADLO CC1(C)C[NH+](Cc2cnnn2-c2ccccc2)C1 ZINC000639393320 356070664 /nfs/dbraw/zinc/07/06/64/356070664.db2.gz IYBKZELWWCISAT-UHFFFAOYSA-N 1 2 242.326 2.109 20 0 BEADLO Cc1cc(N2CC[C@H]3CCC[C@@H]32)nc[nH+]1 ZINC000336091216 134078487 /nfs/dbraw/zinc/07/84/87/134078487.db2.gz WFDCFXKWYIJSAX-MNOVXSKESA-N 1 2 203.289 2.164 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@@H]1[C@@H]1CCC[C@@H](C)C1 ZINC000639428941 356209064 /nfs/dbraw/zinc/20/90/64/356209064.db2.gz ZJDMZAPBADQWHG-UTUOFQBUSA-N 1 2 238.375 2.369 20 0 BEADLO CC[C@H](C)CCNC(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000617641461 356257621 /nfs/dbraw/zinc/25/76/21/356257621.db2.gz OQSBLOFEFPFZDK-QWRGUYRKSA-N 1 2 249.358 2.067 20 0 BEADLO CC[C@H](C)CCNC(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000617641461 356257626 /nfs/dbraw/zinc/25/76/26/356257626.db2.gz OQSBLOFEFPFZDK-QWRGUYRKSA-N 1 2 249.358 2.067 20 0 BEADLO CC[C@@H](C)CCNC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000617643206 356258788 /nfs/dbraw/zinc/25/87/88/356258788.db2.gz OUYWXXRNUQELDO-MNOVXSKESA-N 1 2 237.347 2.141 20 0 BEADLO CC[C@@H](C)CCNC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000617643206 356258789 /nfs/dbraw/zinc/25/87/89/356258789.db2.gz OUYWXXRNUQELDO-MNOVXSKESA-N 1 2 237.347 2.141 20 0 BEADLO COC[C@H](Nc1ccc[nH+]c1C)C1CC1 ZINC000087481642 491089018 /nfs/dbraw/zinc/08/90/18/491089018.db2.gz WEYGLWNJUHPMIM-LBPRGKRZSA-N 1 2 206.289 2.227 20 0 BEADLO CC(=O)C[N@@H+]1CCC[C@@H]1c1ccc2c(c1)OCO2 ZINC000639474356 356267552 /nfs/dbraw/zinc/26/75/52/356267552.db2.gz SDYPODATHDOSFW-GFCCVEGCSA-N 1 2 247.294 2.141 20 0 BEADLO CC(=O)C[N@H+]1CCC[C@@H]1c1ccc2c(c1)OCO2 ZINC000639474356 356267554 /nfs/dbraw/zinc/26/75/54/356267554.db2.gz SDYPODATHDOSFW-GFCCVEGCSA-N 1 2 247.294 2.141 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCS[C@H](C)C1 ZINC000639476694 356271986 /nfs/dbraw/zinc/27/19/86/356271986.db2.gz QSSXOUXZHNTBBR-MRVPVSSYSA-N 1 2 209.305 2.469 20 0 BEADLO CCC(F)(F)C[N@H+]1CCS[C@H](C)C1 ZINC000639476694 356271988 /nfs/dbraw/zinc/27/19/88/356271988.db2.gz QSSXOUXZHNTBBR-MRVPVSSYSA-N 1 2 209.305 2.469 20 0 BEADLO C[C@@H]1OCC[C@@H]1C[N@H+](CC(F)F)C1CC1 ZINC000639483046 356297859 /nfs/dbraw/zinc/29/78/59/356297859.db2.gz PMPXJERCHJIOEU-DTWKUNHWSA-N 1 2 219.275 2.141 20 0 BEADLO C[C@@H]1OCC[C@@H]1C[N@@H+](CC(F)F)C1CC1 ZINC000639483046 356297863 /nfs/dbraw/zinc/29/78/63/356297863.db2.gz PMPXJERCHJIOEU-DTWKUNHWSA-N 1 2 219.275 2.141 20 0 BEADLO CC1CC[NH+](Cc2nnc(C(C)(C)C)[nH]2)CC1 ZINC000336137250 134096153 /nfs/dbraw/zinc/09/61/53/134096153.db2.gz FMVJRQLKEPELQS-UHFFFAOYSA-N 1 2 236.363 2.334 20 0 BEADLO CS[C@H](C)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000609618974 356391615 /nfs/dbraw/zinc/39/16/15/356391615.db2.gz SEOSQCOXNQCTCL-MRVPVSSYSA-N 1 2 235.312 2.024 20 0 BEADLO CC(=O)C[NH2+]C(C)(C)c1nc(C)c(C)s1 ZINC000639536650 356391651 /nfs/dbraw/zinc/39/16/51/356391651.db2.gz PQXBWIHZYQODQF-UHFFFAOYSA-N 1 2 226.345 2.174 20 0 BEADLO CCC(F)(F)C[N@H+](C)[C@@H](CO)C(C)(C)C ZINC000639542573 356396128 /nfs/dbraw/zinc/39/61/28/356396128.db2.gz YNPZFDFDFFFAHK-VIFPVBQESA-N 1 2 223.307 2.371 20 0 BEADLO CCC(F)(F)C[N@@H+](C)[C@@H](CO)C(C)(C)C ZINC000639542573 356396132 /nfs/dbraw/zinc/39/61/32/356396132.db2.gz YNPZFDFDFFFAHK-VIFPVBQESA-N 1 2 223.307 2.371 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2nnc(C(C)C)[nH]2)on1 ZINC000631101686 356420212 /nfs/dbraw/zinc/42/02/12/356420212.db2.gz LTBOFOGSDZORDB-VIFPVBQESA-N 1 2 249.318 2.075 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCC[C@@H]([C@@H](C)O)C1 ZINC000639543729 356402822 /nfs/dbraw/zinc/40/28/22/356402822.db2.gz OCMSLYHMDJVXFQ-NXEZZACHSA-N 1 2 221.291 2.125 20 0 BEADLO CCC(F)(F)C[N@H+]1CCC[C@@H]([C@@H](C)O)C1 ZINC000639543729 356402824 /nfs/dbraw/zinc/40/28/24/356402824.db2.gz OCMSLYHMDJVXFQ-NXEZZACHSA-N 1 2 221.291 2.125 20 0 BEADLO CSC[C@H](C)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000609622970 356403851 /nfs/dbraw/zinc/40/38/51/356403851.db2.gz AFMIPQMDMAURIC-VIFPVBQESA-N 1 2 249.339 2.272 20 0 BEADLO CCCC[C@@H](CC)C(=O)N[C@@H]1Cc2c[nH+]cn2C1 ZINC000623274825 356409143 /nfs/dbraw/zinc/40/91/43/356409143.db2.gz WBWJVGFOGITWGE-VXGBXAGGSA-N 1 2 249.358 2.140 20 0 BEADLO CC[C@H]1CN(c2cc(C)[nH+]cn2)C[C@H](CC)O1 ZINC000420627513 192251916 /nfs/dbraw/zinc/25/19/16/192251916.db2.gz NEAXZKLPSKKFRJ-RYUDHWBXSA-N 1 2 235.331 2.179 20 0 BEADLO FC1=CCC[N@H+](C[C@@H]2COc3ccccc3O2)C1 ZINC000639558788 356465152 /nfs/dbraw/zinc/46/51/52/356465152.db2.gz JPLIESBYLRVYQL-GFCCVEGCSA-N 1 2 249.285 2.386 20 0 BEADLO FC1=CCC[N@@H+](C[C@@H]2COc3ccccc3O2)C1 ZINC000639558788 356465154 /nfs/dbraw/zinc/46/51/54/356465154.db2.gz JPLIESBYLRVYQL-GFCCVEGCSA-N 1 2 249.285 2.386 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@H](C(F)F)C2)[nH]c1C ZINC000639554929 356459960 /nfs/dbraw/zinc/45/99/60/356459960.db2.gz LZHJGPLDMMOZMM-VIFPVBQESA-N 1 2 229.274 2.114 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@H](C(F)F)C2)[nH]c1C ZINC000639554929 356459963 /nfs/dbraw/zinc/45/99/63/356459963.db2.gz LZHJGPLDMMOZMM-VIFPVBQESA-N 1 2 229.274 2.114 20 0 BEADLO Cc1[nH]c(CN2CC[C@H](C(F)F)C2)[nH+]c1C ZINC000639554929 356459968 /nfs/dbraw/zinc/45/99/68/356459968.db2.gz LZHJGPLDMMOZMM-VIFPVBQESA-N 1 2 229.274 2.114 20 0 BEADLO CC[C@@H]1C[C@H](Nc2cc[nH+]c(C(C)C)n2)CCO1 ZINC000420617057 192249229 /nfs/dbraw/zinc/24/92/29/192249229.db2.gz JFUZRTCRBSFXST-VXGBXAGGSA-N 1 2 249.358 2.391 20 0 BEADLO CC[C@@H]1C[C@H](Nc2cc[nH+]c(C)n2)CCO1 ZINC000420616021 192249432 /nfs/dbraw/zinc/24/94/32/192249432.db2.gz FZDYPHHGLSWYPH-GHMZBOCLSA-N 1 2 221.304 2.155 20 0 BEADLO CCC(F)(F)C[N@H+](C)C[C@H]1CCC[C@H]1O ZINC000639567889 356490214 /nfs/dbraw/zinc/49/02/14/356490214.db2.gz QLRHXHYVDNUZHL-NXEZZACHSA-N 1 2 221.291 2.125 20 0 BEADLO CCC(F)(F)C[N@@H+](C)C[C@H]1CCC[C@H]1O ZINC000639567889 356490218 /nfs/dbraw/zinc/49/02/18/356490218.db2.gz QLRHXHYVDNUZHL-NXEZZACHSA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)c1nc(N2C[C@H](C)C[C@H](CO)C2)cc[nH+]1 ZINC000420640572 192253763 /nfs/dbraw/zinc/25/37/63/192253763.db2.gz YVKUOISKPZGSNE-NEPJUHHUSA-N 1 2 249.358 2.055 20 0 BEADLO COc1cc(NCc2cc(C)[nH+]c(C)c2)ncn1 ZINC000420649810 192254974 /nfs/dbraw/zinc/25/49/74/192254974.db2.gz GSSXCJXXHABDDD-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO CC[C@H](C)CNc1cc[nH+]c(C2CC2)n1 ZINC000420653830 192255413 /nfs/dbraw/zinc/25/54/13/192255413.db2.gz PAMQTZSGKLDXJO-VIFPVBQESA-N 1 2 205.305 2.234 20 0 BEADLO CC[C@@H]([NH2+]CC(C)=O)c1nc(C)cs1 ZINC000639578954 356499869 /nfs/dbraw/zinc/49/98/69/356499869.db2.gz VOQAOCXRADLYQC-SECBINFHSA-N 1 2 212.318 2.081 20 0 BEADLO CCC[C@H](CC)NC(=O)CCCn1cc[nH+]c1 ZINC000623291006 356505588 /nfs/dbraw/zinc/50/55/88/356505588.db2.gz SFKRNPUIJZTVCN-LBPRGKRZSA-N 1 2 237.347 2.358 20 0 BEADLO C[C@@H]1Cc2ccccc2[N@@H+](C[C@H]2C[C@@H](O)C2)C1 ZINC000420906202 192270114 /nfs/dbraw/zinc/27/01/14/192270114.db2.gz RZEZNZIJCPSYSU-BZPMIXESSA-N 1 2 231.339 2.456 20 0 BEADLO C[C@@H]1Cc2ccccc2[N@H+](C[C@H]2C[C@@H](O)C2)C1 ZINC000420906202 192270115 /nfs/dbraw/zinc/27/01/15/192270115.db2.gz RZEZNZIJCPSYSU-BZPMIXESSA-N 1 2 231.339 2.456 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ncc(C)cn2)C[C@H](CC)O1 ZINC000420950016 192276800 /nfs/dbraw/zinc/27/68/00/192276800.db2.gz FWLNDMWNNXFEDR-BETUJISGSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ncc(C)cn2)C[C@H](CC)O1 ZINC000420950016 192276803 /nfs/dbraw/zinc/27/68/03/192276803.db2.gz FWLNDMWNNXFEDR-BETUJISGSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccon2)C[C@H](CC)O1 ZINC000420952062 192277524 /nfs/dbraw/zinc/27/75/24/192277524.db2.gz HWRGXGQHLDMCCP-TXEJJXNPSA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccon2)C[C@H](CC)O1 ZINC000420952062 192277527 /nfs/dbraw/zinc/27/75/27/192277527.db2.gz HWRGXGQHLDMCCP-TXEJJXNPSA-N 1 2 224.304 2.064 20 0 BEADLO C[C@H]1CCCC[C@H]1c1noc(C[NH+](C)C)n1 ZINC000336181441 134119970 /nfs/dbraw/zinc/11/99/70/134119970.db2.gz ALYRSNTTWYIQCP-VHSXEESVSA-N 1 2 223.320 2.425 20 0 BEADLO O[C@H]1C[C@@H](C[NH2+][C@H](c2ccccc2)C(F)F)C1 ZINC000420974456 192286084 /nfs/dbraw/zinc/28/60/84/192286084.db2.gz OIRIPKJJQOLMGC-ADEWGFFLSA-N 1 2 241.281 2.353 20 0 BEADLO CCn1cc[nH+]c1[C@@H]1CCCCN1CC(C)=O ZINC000639623804 356543425 /nfs/dbraw/zinc/54/34/25/356543425.db2.gz MSPXYGAVEPMJFH-LBPRGKRZSA-N 1 2 235.331 2.019 20 0 BEADLO CC(=O)C[N@@H+]1CC[C@](F)(c2ccccc2)C1 ZINC000639630818 356545848 /nfs/dbraw/zinc/54/58/48/356545848.db2.gz ZXPFRYDLXVXKQU-CYBMUJFWSA-N 1 2 221.275 2.146 20 0 BEADLO CC(=O)C[N@H+]1CC[C@](F)(c2ccccc2)C1 ZINC000639630818 356545853 /nfs/dbraw/zinc/54/58/53/356545853.db2.gz ZXPFRYDLXVXKQU-CYBMUJFWSA-N 1 2 221.275 2.146 20 0 BEADLO CC[C@@H](C)[N@H+](C)Cc1nn(C)cc1Cl ZINC000420936321 192287707 /nfs/dbraw/zinc/28/77/07/192287707.db2.gz MOYZMZRJXWRFCP-MRVPVSSYSA-N 1 2 215.728 2.304 20 0 BEADLO CC[C@@H](C)[N@@H+](C)Cc1nn(C)cc1Cl ZINC000420936321 192287709 /nfs/dbraw/zinc/28/77/09/192287709.db2.gz MOYZMZRJXWRFCP-MRVPVSSYSA-N 1 2 215.728 2.304 20 0 BEADLO Cc1cc(N2CC[C@H](F)C2)nc(C2CC2)[nH+]1 ZINC000336189133 134122448 /nfs/dbraw/zinc/12/24/48/134122448.db2.gz DRIMIJGQUCIGMO-JTQLQIEISA-N 1 2 221.279 2.211 20 0 BEADLO CC1(C)CO[C@@H](C[N@@H+]2Cc3cccnc3C2)C1 ZINC000639622644 356542465 /nfs/dbraw/zinc/54/24/65/356542465.db2.gz FCHQZQYEIUNOFG-GFCCVEGCSA-N 1 2 232.327 2.212 20 0 BEADLO CC1(C)CO[C@@H](C[N@H+]2Cc3cccnc3C2)C1 ZINC000639622644 356542467 /nfs/dbraw/zinc/54/24/67/356542467.db2.gz FCHQZQYEIUNOFG-GFCCVEGCSA-N 1 2 232.327 2.212 20 0 BEADLO C[N@H+](Cc1ncccn1)C1CC(OC(C)(C)C)C1 ZINC000421006345 192297711 /nfs/dbraw/zinc/29/77/11/192297711.db2.gz JUXRGZCSMIAWPV-UHFFFAOYSA-N 1 2 249.358 2.255 20 0 BEADLO C[N@@H+](Cc1ncccn1)C1CC(OC(C)(C)C)C1 ZINC000421006345 192297713 /nfs/dbraw/zinc/29/77/13/192297713.db2.gz JUXRGZCSMIAWPV-UHFFFAOYSA-N 1 2 249.358 2.255 20 0 BEADLO CC(=O)C[N@@H+]1CC[C@@](F)(c2ccccc2C)C1 ZINC000639627270 356548439 /nfs/dbraw/zinc/54/84/39/356548439.db2.gz HKWAFXYMDBDUIX-AWEZNQCLSA-N 1 2 235.302 2.455 20 0 BEADLO CC(=O)C[N@H+]1CC[C@@](F)(c2ccccc2C)C1 ZINC000639627270 356548440 /nfs/dbraw/zinc/54/84/40/356548440.db2.gz HKWAFXYMDBDUIX-AWEZNQCLSA-N 1 2 235.302 2.455 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CCO[C@H](C)[C@@H]2C)cn1 ZINC000179678293 366283859 /nfs/dbraw/zinc/28/38/59/366283859.db2.gz HZCYXLAFECLTEV-NWDGAFQWSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)n1cc(C[N@H+]2CCO[C@H](C)[C@@H]2C)cn1 ZINC000179678293 366283863 /nfs/dbraw/zinc/28/38/63/366283863.db2.gz HZCYXLAFECLTEV-NWDGAFQWSA-N 1 2 237.347 2.073 20 0 BEADLO C[C@H](c1csnn1)[N@@H+]1CCCSCC1 ZINC000336196556 134126396 /nfs/dbraw/zinc/12/63/96/134126396.db2.gz KTWCDSGEMCPEQX-MRVPVSSYSA-N 1 2 229.374 2.038 20 0 BEADLO C[C@H](c1csnn1)[N@H+]1CCCSCC1 ZINC000336196556 134126397 /nfs/dbraw/zinc/12/63/97/134126397.db2.gz KTWCDSGEMCPEQX-MRVPVSSYSA-N 1 2 229.374 2.038 20 0 BEADLO Clc1cnccc1C[N@@H+]1CC[C@]12CCOC2 ZINC000421016415 192304576 /nfs/dbraw/zinc/30/45/76/192304576.db2.gz JCAGVEWZJJHPDO-GFCCVEGCSA-N 1 2 238.718 2.100 20 0 BEADLO Clc1cnccc1C[N@H+]1CC[C@]12CCOC2 ZINC000421016415 192304578 /nfs/dbraw/zinc/30/45/78/192304578.db2.gz JCAGVEWZJJHPDO-GFCCVEGCSA-N 1 2 238.718 2.100 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CCOC(C)(C)C2)cn1 ZINC000179768136 366301356 /nfs/dbraw/zinc/30/13/56/366301356.db2.gz IJXKBTAAOSHXGO-UHFFFAOYSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1cc(C[N@H+]2CCOC(C)(C)C2)cn1 ZINC000179768136 366301358 /nfs/dbraw/zinc/30/13/58/366301358.db2.gz IJXKBTAAOSHXGO-UHFFFAOYSA-N 1 2 237.347 2.075 20 0 BEADLO COc1cc(C)ccc1[NH2+]C[C@H]1C[C@@H](O)C1 ZINC000421189322 192313950 /nfs/dbraw/zinc/31/39/50/192313950.db2.gz NCFNDHUPYUTHAO-PHIMTYICSA-N 1 2 221.300 2.186 20 0 BEADLO CC[C@@H](CC(C)C)C(=O)NCc1[nH+]ccn1C ZINC000449839420 202044533 /nfs/dbraw/zinc/04/45/33/202044533.db2.gz MEMBLDXOLJOUMS-NSHDSACASA-N 1 2 237.347 2.109 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+]1CCSC(C)(C)C1 ZINC000336201541 134130688 /nfs/dbraw/zinc/13/06/88/134130688.db2.gz VQFAQXBECBHWIA-QMMMGPOBSA-N 1 2 243.401 2.427 20 0 BEADLO C[C@@H](c1csnn1)[N@H+]1CCSC(C)(C)C1 ZINC000336201541 134130689 /nfs/dbraw/zinc/13/06/89/134130689.db2.gz VQFAQXBECBHWIA-QMMMGPOBSA-N 1 2 243.401 2.427 20 0 BEADLO COC(=O)C[N@H+](C)Cc1cccc(C2CC2)c1 ZINC000421326913 192318087 /nfs/dbraw/zinc/31/80/87/192318087.db2.gz HVPZHMDQQNZDIZ-UHFFFAOYSA-N 1 2 233.311 2.169 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1cccc(C2CC2)c1 ZINC000421326913 192318090 /nfs/dbraw/zinc/31/80/90/192318090.db2.gz HVPZHMDQQNZDIZ-UHFFFAOYSA-N 1 2 233.311 2.169 20 0 BEADLO Cc1cc(C)c(C[N@H+](C2CC2)C2COC2)c(C)n1 ZINC000639659185 356567360 /nfs/dbraw/zinc/56/73/60/356567360.db2.gz NBXWJDHGAJEXGF-UHFFFAOYSA-N 1 2 246.354 2.370 20 0 BEADLO Cc1cc(C)c(C[N@@H+](C2CC2)C2COC2)c(C)n1 ZINC000639659185 356567365 /nfs/dbraw/zinc/56/73/65/356567365.db2.gz NBXWJDHGAJEXGF-UHFFFAOYSA-N 1 2 246.354 2.370 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)NCc1[nH+]ccn1CC(C)C ZINC000449933539 202055793 /nfs/dbraw/zinc/05/57/93/202055793.db2.gz BYSCPRPLVOOQQI-VXGBXAGGSA-N 1 2 249.358 2.201 20 0 BEADLO CC[N@H+](C[C@@H](C)OC)CC(F)(F)CC ZINC000639652324 356563733 /nfs/dbraw/zinc/56/37/33/356563733.db2.gz PGCKDQZSECUFIL-SECBINFHSA-N 1 2 209.280 2.389 20 0 BEADLO CC[N@@H+](C[C@@H](C)OC)CC(F)(F)CC ZINC000639652324 356563737 /nfs/dbraw/zinc/56/37/37/356563737.db2.gz PGCKDQZSECUFIL-SECBINFHSA-N 1 2 209.280 2.389 20 0 BEADLO Cc1noc([C@@H](C)[N@H+]2CCSC(C)(C)C2)n1 ZINC000083415869 491097104 /nfs/dbraw/zinc/09/71/04/491097104.db2.gz JFODMKLJWGOWHB-MRVPVSSYSA-N 1 2 241.360 2.266 20 0 BEADLO COc1ccc[nH+]c1N1C[C@H](C)S[C@@H](C)C1 ZINC000624003453 363496507 /nfs/dbraw/zinc/49/65/07/363496507.db2.gz ZMMTZTOYTIBNSD-UWVGGRQHSA-N 1 2 238.356 2.420 20 0 BEADLO NC(=O)[C@H]1CCCC[N@@H+]1Cc1ccncc1F ZINC000336219469 134138739 /nfs/dbraw/zinc/13/87/39/134138739.db2.gz FEZZTWSDDVIXAZ-LLVKDONJSA-N 1 2 237.278 2.110 20 0 BEADLO NC(=O)[C@H]1CCCC[N@H+]1Cc1ccncc1F ZINC000336219469 134138740 /nfs/dbraw/zinc/13/87/40/134138740.db2.gz FEZZTWSDDVIXAZ-LLVKDONJSA-N 1 2 237.278 2.110 20 0 BEADLO CCCC[C@H](C)C(=O)N[C@@H]1CCn2c[nH+]cc2C1 ZINC000623301919 356577671 /nfs/dbraw/zinc/57/76/71/356577671.db2.gz WHNHSDYMYBYHGV-NWDGAFQWSA-N 1 2 249.358 2.140 20 0 BEADLO CCCC[C@H](C)C(=O)N[C@H]1CCn2c[nH+]cc2C1 ZINC000623301920 356577925 /nfs/dbraw/zinc/57/79/25/356577925.db2.gz WHNHSDYMYBYHGV-RYUDHWBXSA-N 1 2 249.358 2.140 20 0 BEADLO CCC(F)(F)C[N@H+](C)CCCCOC ZINC000639675427 356584414 /nfs/dbraw/zinc/58/44/14/356584414.db2.gz UPYGDBPLVUWCNA-UHFFFAOYSA-N 1 2 209.280 2.390 20 0 BEADLO CCC(F)(F)C[N@@H+](C)CCCCOC ZINC000639675427 356584417 /nfs/dbraw/zinc/58/44/17/356584417.db2.gz UPYGDBPLVUWCNA-UHFFFAOYSA-N 1 2 209.280 2.390 20 0 BEADLO C[C@]1(CNc2cc(CO)cc[nH+]2)CC1(F)F ZINC000630092378 363514777 /nfs/dbraw/zinc/51/47/77/363514777.db2.gz DWMZREZOIQIHJA-SNVBAGLBSA-N 1 2 228.242 2.031 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@H](C)C(C)(C)C)no1 ZINC000613599255 363531054 /nfs/dbraw/zinc/53/10/54/363531054.db2.gz MYDNACLLKSPJJW-MRVPVSSYSA-N 1 2 211.309 2.244 20 0 BEADLO Cc1nc(C[N@H+](C)[C@H](C)C(C)(C)C)no1 ZINC000613599255 363531057 /nfs/dbraw/zinc/53/10/57/363531057.db2.gz MYDNACLLKSPJJW-MRVPVSSYSA-N 1 2 211.309 2.244 20 0 BEADLO CC[C@H](NC(=O)[C@@H]1CCC[C@@H]2C[C@@H]21)c1[nH]cc[nH+]1 ZINC000613579947 363522795 /nfs/dbraw/zinc/52/27/95/363522795.db2.gz ZNKBXHXROGGABL-WYUUTHIRSA-N 1 2 247.342 2.413 20 0 BEADLO CC[C@H](NC(=O)[C@H]1C[C@H]2C[C@H]2C1)c1[nH]cc[nH+]1 ZINC000613579652 363523076 /nfs/dbraw/zinc/52/30/76/363523076.db2.gz RZMLXMLAGFMNDF-ZDCRXTMVSA-N 1 2 233.315 2.023 20 0 BEADLO CSCCCC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000609875337 356621548 /nfs/dbraw/zinc/62/15/48/356621548.db2.gz HYSDZLSGIVVVRI-UHFFFAOYSA-N 1 2 249.339 2.416 20 0 BEADLO COCC1(CCNc2nc(C)[nH+]cc2C)CCC1 ZINC000580725186 363527803 /nfs/dbraw/zinc/52/78/03/363527803.db2.gz PFFAOCLXOSNLJT-UHFFFAOYSA-N 1 2 249.358 2.134 20 0 BEADLO OCc1cc[nH+]c(NCC[C@H]2CC2(F)F)c1 ZINC000630095375 363550161 /nfs/dbraw/zinc/55/01/61/363550161.db2.gz ZZYQEVZAMICAKP-VIFPVBQESA-N 1 2 228.242 2.031 20 0 BEADLO C[C@H]([NH2+]Cc1cccnc1)C(C)(F)F ZINC000389458513 356678834 /nfs/dbraw/zinc/67/88/34/356678834.db2.gz CLUUWBZSAQDSHB-QMMMGPOBSA-N 1 2 200.232 2.215 20 0 BEADLO CCc1nnc(C[N@@H+]2CCc3ccccc3C2)o1 ZINC000054114624 363561141 /nfs/dbraw/zinc/56/11/41/363561141.db2.gz HDETVCUMFDCJTB-UHFFFAOYSA-N 1 2 243.310 2.190 20 0 BEADLO CCc1nnc(C[N@H+]2CCc3ccccc3C2)o1 ZINC000054114624 363561147 /nfs/dbraw/zinc/56/11/47/363561147.db2.gz HDETVCUMFDCJTB-UHFFFAOYSA-N 1 2 243.310 2.190 20 0 BEADLO C[C@H]([NH2+]Cc1ccncc1)C(C)(F)F ZINC000389474246 356682203 /nfs/dbraw/zinc/68/22/03/356682203.db2.gz WNESVULSIMOSDV-QMMMGPOBSA-N 1 2 200.232 2.215 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccnn1C)C(C)(F)F ZINC000389475678 356684957 /nfs/dbraw/zinc/68/49/57/356684957.db2.gz ZCDLKSFFEAGBRZ-JGVFFNPUSA-N 1 2 217.263 2.114 20 0 BEADLO Cc1cc(NC[C@H](C)C2CC2)c(C#N)c[nH+]1 ZINC000399443582 356700739 /nfs/dbraw/zinc/70/07/39/356700739.db2.gz LGCAVMDJTKVSLR-VIFPVBQESA-N 1 2 215.300 2.142 20 0 BEADLO Cc1nc(C[N@@H+]2CCOCC2(C)C)sc1C ZINC000088579926 538574208 /nfs/dbraw/zinc/57/42/08/538574208.db2.gz KFVKIYRHGNZZPG-UHFFFAOYSA-N 1 2 240.372 2.371 20 0 BEADLO Cc1nc(C[N@H+]2CCOCC2(C)C)sc1C ZINC000088579926 538574216 /nfs/dbraw/zinc/57/42/16/538574216.db2.gz KFVKIYRHGNZZPG-UHFFFAOYSA-N 1 2 240.372 2.371 20 0 BEADLO CCCCCNC(=O)[C@@H]1CCn2cc(C)[nH+]c2C1 ZINC000623346022 356753396 /nfs/dbraw/zinc/75/33/96/356753396.db2.gz BBOJHUFRACTYPX-GFCCVEGCSA-N 1 2 249.358 2.060 20 0 BEADLO CCn1cc(C[NH2+]C(C)(C)C(F)F)cn1 ZINC000379917103 538671897 /nfs/dbraw/zinc/67/18/97/538671897.db2.gz DETQAHQUCYYTBO-UHFFFAOYSA-N 1 2 217.263 2.036 20 0 BEADLO C[N@H+](CC/C=C/c1ccccc1)Cc1nnc[nH]1 ZINC000450478789 202179316 /nfs/dbraw/zinc/17/93/16/202179316.db2.gz JBTIIPGQTVKQMQ-WEVVVXLNSA-N 1 2 242.326 2.340 20 0 BEADLO C[N@@H+](CC/C=C/c1ccccc1)Cc1nnc[nH]1 ZINC000450478789 202179317 /nfs/dbraw/zinc/17/93/17/202179317.db2.gz JBTIIPGQTVKQMQ-WEVVVXLNSA-N 1 2 242.326 2.340 20 0 BEADLO CO[C@@H]1C[N@@H+]([C@@H](C)c2ccc(F)cc2)CCO1 ZINC000639836592 356822676 /nfs/dbraw/zinc/82/26/76/356822676.db2.gz UZFMGBDJIUPTFB-GWCFXTLKSA-N 1 2 239.290 2.191 20 0 BEADLO CO[C@@H]1C[N@H+]([C@@H](C)c2ccc(F)cc2)CCO1 ZINC000639836592 356822680 /nfs/dbraw/zinc/82/26/80/356822680.db2.gz UZFMGBDJIUPTFB-GWCFXTLKSA-N 1 2 239.290 2.191 20 0 BEADLO CO[C@@H]1C[N@H+](C/C=C\c2ccccc2)CCO1 ZINC000639836565 356822782 /nfs/dbraw/zinc/82/27/82/356822782.db2.gz UTGYAKGTYJMRIV-PODYEWJSSA-N 1 2 233.311 2.005 20 0 BEADLO CO[C@@H]1C[N@@H+](C/C=C\c2ccccc2)CCO1 ZINC000639836565 356822783 /nfs/dbraw/zinc/82/27/83/356822783.db2.gz UTGYAKGTYJMRIV-PODYEWJSSA-N 1 2 233.311 2.005 20 0 BEADLO CO[C@H]1C[N@H+](C/C=C/c2ccccc2)CCO1 ZINC000639836564 356822810 /nfs/dbraw/zinc/82/28/10/356822810.db2.gz UTGYAKGTYJMRIV-LHRNQBEKSA-N 1 2 233.311 2.005 20 0 BEADLO CO[C@H]1C[N@@H+](C/C=C/c2ccccc2)CCO1 ZINC000639836564 356822811 /nfs/dbraw/zinc/82/28/11/356822811.db2.gz UTGYAKGTYJMRIV-LHRNQBEKSA-N 1 2 233.311 2.005 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1[C@H](C)CCC[C@H]1C ZINC000654713898 538696964 /nfs/dbraw/zinc/69/69/64/538696964.db2.gz XKCWYFJMEHMHSJ-IJLUTSLNSA-N 1 2 249.358 2.378 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1[C@H](C)CCC[C@H]1C ZINC000654713898 538696971 /nfs/dbraw/zinc/69/69/71/538696971.db2.gz XKCWYFJMEHMHSJ-IJLUTSLNSA-N 1 2 249.358 2.378 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1[C@H](C)CCC[C@@H]1C ZINC000654713899 538697285 /nfs/dbraw/zinc/69/72/85/538697285.db2.gz XKCWYFJMEHMHSJ-SDDRHHMPSA-N 1 2 249.358 2.378 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1[C@H](C)CCC[C@@H]1C ZINC000654713899 538697295 /nfs/dbraw/zinc/69/72/95/538697295.db2.gz XKCWYFJMEHMHSJ-SDDRHHMPSA-N 1 2 249.358 2.378 20 0 BEADLO CCC(=O)CCC[N@H+](C)[C@H](C)C(=O)OC(C)C ZINC000450488017 202182133 /nfs/dbraw/zinc/18/21/33/202182133.db2.gz FSLOADAIEFKATM-LLVKDONJSA-N 1 2 243.347 2.018 20 0 BEADLO CCC(=O)CCC[N@@H+](C)[C@H](C)C(=O)OC(C)C ZINC000450488017 202182136 /nfs/dbraw/zinc/18/21/36/202182136.db2.gz FSLOADAIEFKATM-LLVKDONJSA-N 1 2 243.347 2.018 20 0 BEADLO Cc1c[nH]nc1C[N@H+](C)CCC(F)(F)F ZINC000356063082 356787593 /nfs/dbraw/zinc/78/75/93/356787593.db2.gz LUKWXAHTMRQVSL-UHFFFAOYSA-N 1 2 221.226 2.102 20 0 BEADLO Cc1c[nH]nc1C[N@@H+](C)CCC(F)(F)F ZINC000356063082 356787595 /nfs/dbraw/zinc/78/75/95/356787595.db2.gz LUKWXAHTMRQVSL-UHFFFAOYSA-N 1 2 221.226 2.102 20 0 BEADLO Cc1cn[nH]c1C[N@H+](C)CCC(F)(F)F ZINC000356063082 356787596 /nfs/dbraw/zinc/78/75/96/356787596.db2.gz LUKWXAHTMRQVSL-UHFFFAOYSA-N 1 2 221.226 2.102 20 0 BEADLO Cc1cn[nH]c1C[N@@H+](C)CCC(F)(F)F ZINC000356063082 356787598 /nfs/dbraw/zinc/78/75/98/356787598.db2.gz LUKWXAHTMRQVSL-UHFFFAOYSA-N 1 2 221.226 2.102 20 0 BEADLO Cc1cc(C(=O)NCCC(C)C)c2[nH+]ccn2c1 ZINC000623368945 356871388 /nfs/dbraw/zinc/87/13/88/356871388.db2.gz GLKRYZQJQQAFCS-UHFFFAOYSA-N 1 2 245.326 2.419 20 0 BEADLO C[C@@H](c1ccccc1)[C@@H](O)Cn1cc[nH+]c1 ZINC000450512914 202189530 /nfs/dbraw/zinc/18/95/30/202189530.db2.gz VLSJAQWJEJWZGN-AAEUAGOBSA-N 1 2 216.284 2.048 20 0 BEADLO CCCC[C@@H]([NH2+]CC1(C(F)F)CC1)C(=O)OC ZINC000360619165 356908357 /nfs/dbraw/zinc/90/83/57/356908357.db2.gz LDCSKJXVMMXHAO-SECBINFHSA-N 1 2 249.301 2.353 20 0 BEADLO CC[C@H](Nc1cc[nH+]c(C2CC2)n1)C(F)F ZINC000450565950 202199087 /nfs/dbraw/zinc/19/90/87/202199087.db2.gz ONDHXOJVYBEZOU-QMMMGPOBSA-N 1 2 227.258 2.232 20 0 BEADLO CC[N@@H+](Cc1nc(C(C)C)no1)C[C@H](C)OC ZINC000361557634 356932530 /nfs/dbraw/zinc/93/25/30/356932530.db2.gz BMDVZMRXWFFOMG-JTQLQIEISA-N 1 2 241.335 2.050 20 0 BEADLO CC[N@H+](Cc1nc(C(C)C)no1)C[C@H](C)OC ZINC000361557634 356932532 /nfs/dbraw/zinc/93/25/32/356932532.db2.gz BMDVZMRXWFFOMG-JTQLQIEISA-N 1 2 241.335 2.050 20 0 BEADLO CC(C)C[N@@H+]1CC(=O)N[C@]12CCCC(C)(C)C2 ZINC000362892499 356950682 /nfs/dbraw/zinc/95/06/82/356950682.db2.gz LKQCYZWRGIFCAK-CQSZACIVSA-N 1 2 238.375 2.371 20 0 BEADLO CC(C)C[N@H+]1CC(=O)N[C@]12CCCC(C)(C)C2 ZINC000362892499 356950686 /nfs/dbraw/zinc/95/06/86/356950686.db2.gz LKQCYZWRGIFCAK-CQSZACIVSA-N 1 2 238.375 2.371 20 0 BEADLO Cc1cc(F)ccc1CNc1c[nH]c[nH+]1 ZINC000389856301 357055871 /nfs/dbraw/zinc/05/58/71/357055871.db2.gz ABLRBCIUZFBPAI-UHFFFAOYSA-N 1 2 205.236 2.469 20 0 BEADLO CCCC(C)(C)CC(=O)NCc1c[nH+]cn1C ZINC000355262767 538792216 /nfs/dbraw/zinc/79/22/16/538792216.db2.gz HGOTZCNDIHJHIB-UHFFFAOYSA-N 1 2 237.347 2.253 20 0 BEADLO CC(=O)C[N@@H+]1CC(C)(C)[C@H]1c1ccncc1 ZINC000639879439 357113466 /nfs/dbraw/zinc/11/34/66/357113466.db2.gz WTIBBELRNMBZIL-GFCCVEGCSA-N 1 2 218.300 2.054 20 0 BEADLO CC(=O)C[N@H+]1CC(C)(C)[C@H]1c1ccncc1 ZINC000639879439 357113468 /nfs/dbraw/zinc/11/34/68/357113468.db2.gz WTIBBELRNMBZIL-GFCCVEGCSA-N 1 2 218.300 2.054 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCC[C@@H]1COC ZINC000639892652 357221560 /nfs/dbraw/zinc/22/15/60/357221560.db2.gz XEWKTKUNJOIQHD-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CCC(F)(F)C[N@H+]1CCC[C@@H]1COC ZINC000639892652 357221562 /nfs/dbraw/zinc/22/15/62/357221562.db2.gz XEWKTKUNJOIQHD-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CCc1nc(C[NH+]2CCC3(CCC3)CC2)n[nH]1 ZINC000375738739 357187645 /nfs/dbraw/zinc/18/76/45/357187645.db2.gz RPSXEDVHDSMFQQ-UHFFFAOYSA-N 1 2 234.347 2.133 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCCC(F)(F)CC1 ZINC000628422159 357243016 /nfs/dbraw/zinc/24/30/16/357243016.db2.gz PZSOFPAPSDZBAC-UHFFFAOYSA-N 1 2 229.274 2.339 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCCC(F)(F)CC1 ZINC000628422159 357243019 /nfs/dbraw/zinc/24/30/19/357243019.db2.gz PZSOFPAPSDZBAC-UHFFFAOYSA-N 1 2 229.274 2.339 20 0 BEADLO C=Cn1cc(C[NH+]2CC(OC(C)(C)CC)C2)cn1 ZINC000628422490 357245632 /nfs/dbraw/zinc/24/56/32/357245632.db2.gz NTVWNEYKRJWSOL-UHFFFAOYSA-N 1 2 249.358 2.373 20 0 BEADLO CCc1nc(C[N@@H+]2CC3CCC2CC3)no1 ZINC000378382405 357252104 /nfs/dbraw/zinc/25/21/04/357252104.db2.gz GLAFEFAJLBUEET-UHFFFAOYSA-N 1 2 221.304 2.006 20 0 BEADLO CCc1nc(C[N@H+]2CC3CCC2CC3)no1 ZINC000378382405 357252110 /nfs/dbraw/zinc/25/21/10/357252110.db2.gz GLAFEFAJLBUEET-UHFFFAOYSA-N 1 2 221.304 2.006 20 0 BEADLO CN(C)c1ccccc1C[NH+]1CC2(C1)CCCO2 ZINC000628427060 357255599 /nfs/dbraw/zinc/25/55/99/357255599.db2.gz CZCYZLZGLZSGMD-UHFFFAOYSA-N 1 2 246.354 2.117 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2CCCC23CC3)cc[nH+]1 ZINC000639900152 357312348 /nfs/dbraw/zinc/31/23/48/357312348.db2.gz IYFMOJRJHDNVOS-LBPRGKRZSA-N 1 2 245.326 2.266 20 0 BEADLO C[C@H](CC(F)F)C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000583029687 357463363 /nfs/dbraw/zinc/46/33/63/357463363.db2.gz AQQGZXJRDHLWAO-SSDOTTSWSA-N 1 2 245.273 2.052 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+](CC)Cc1ccoc1 ZINC000102517441 357477509 /nfs/dbraw/zinc/47/75/09/357477509.db2.gz QSVRWXZWSLSDIS-SNVBAGLBSA-N 1 2 225.288 2.053 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+](CC)Cc1ccoc1 ZINC000102517441 357477511 /nfs/dbraw/zinc/47/75/11/357477511.db2.gz QSVRWXZWSLSDIS-SNVBAGLBSA-N 1 2 225.288 2.053 20 0 BEADLO Cc1oncc1C[N@@H+]1CCn2cccc2[C@H]1C ZINC000188797594 357574577 /nfs/dbraw/zinc/57/45/77/357574577.db2.gz QTJFNWMMRNUTPR-SNVBAGLBSA-N 1 2 231.299 2.361 20 0 BEADLO Cc1oncc1C[N@H+]1CCn2cccc2[C@H]1C ZINC000188797594 357574579 /nfs/dbraw/zinc/57/45/79/357574579.db2.gz QTJFNWMMRNUTPR-SNVBAGLBSA-N 1 2 231.299 2.361 20 0 BEADLO CCn1c[nH+]cc1CNc1cccnc1C ZINC000085712343 357560659 /nfs/dbraw/zinc/56/06/59/357560659.db2.gz RNEXVDVDIZXLAI-UHFFFAOYSA-N 1 2 216.288 2.219 20 0 BEADLO CCCc1nc(C[N@@H+]2CCC[C@@H](C)C2)no1 ZINC000054982759 363583559 /nfs/dbraw/zinc/58/35/59/363583559.db2.gz BOAWGRMITBYWGL-SNVBAGLBSA-N 1 2 223.320 2.254 20 0 BEADLO CCCc1nc(C[N@H+]2CCC[C@@H](C)C2)no1 ZINC000054982759 363583561 /nfs/dbraw/zinc/58/35/61/363583561.db2.gz BOAWGRMITBYWGL-SNVBAGLBSA-N 1 2 223.320 2.254 20 0 BEADLO OCC(F)(F)C[NH2+][C@H]1CCc2c1cccc2F ZINC000231792554 357629703 /nfs/dbraw/zinc/62/97/03/357629703.db2.gz IUUWLGWXGGBZBA-NSHDSACASA-N 1 2 245.244 2.030 20 0 BEADLO CCn1c[nH+]cc1CNc1cncc(C)c1 ZINC000232072998 357648296 /nfs/dbraw/zinc/64/82/96/357648296.db2.gz UAKIQPYEIYYWQI-UHFFFAOYSA-N 1 2 216.288 2.219 20 0 BEADLO CCCCc1nc(C[N@H+](C)CCC)no1 ZINC000063755551 357717069 /nfs/dbraw/zinc/71/70/69/357717069.db2.gz OYDHVDDTFLXHOV-UHFFFAOYSA-N 1 2 211.309 2.254 20 0 BEADLO CCCCc1nc(C[N@@H+](C)CCC)no1 ZINC000063755551 357717073 /nfs/dbraw/zinc/71/70/73/357717073.db2.gz OYDHVDDTFLXHOV-UHFFFAOYSA-N 1 2 211.309 2.254 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@@H]1CCC[C@@H]1SCC ZINC000233698121 357732759 /nfs/dbraw/zinc/73/27/59/357732759.db2.gz PMIZLZJHJCDLEV-AXFHLTTASA-N 1 2 245.388 2.202 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2ncccn2)cc1 ZINC000191912053 357804269 /nfs/dbraw/zinc/80/42/69/357804269.db2.gz VCFQOSTXQGLWEW-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2ncccn2)cc1 ZINC000191912053 357804270 /nfs/dbraw/zinc/80/42/70/357804270.db2.gz VCFQOSTXQGLWEW-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO CC[N@H+](Cc1ccccc1)Cc1ncccn1 ZINC000191872112 357810578 /nfs/dbraw/zinc/81/05/78/357810578.db2.gz KBBZHGRSMYPLKT-UHFFFAOYSA-N 1 2 227.311 2.499 20 0 BEADLO CC[N@@H+](Cc1ccccc1)Cc1ncccn1 ZINC000191872112 357810582 /nfs/dbraw/zinc/81/05/82/357810582.db2.gz KBBZHGRSMYPLKT-UHFFFAOYSA-N 1 2 227.311 2.499 20 0 BEADLO CCN(C)c1ccc(CNc2cc(C)on2)c[nH+]1 ZINC000191511136 357783111 /nfs/dbraw/zinc/78/31/11/357783111.db2.gz WYHJWXHZXODAGF-UHFFFAOYSA-N 1 2 246.314 2.446 20 0 BEADLO COc1cccc2c1cc[nH+]c2N[C@@H](C)CO ZINC000234916543 357836885 /nfs/dbraw/zinc/83/68/85/357836885.db2.gz DHSPLZIRYXWNLM-VIFPVBQESA-N 1 2 232.283 2.036 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1CC[C@@H](C)O1 ZINC000398118534 357843114 /nfs/dbraw/zinc/84/31/14/357843114.db2.gz VVTWNPAKCXEFGD-NXEZZACHSA-N 1 2 222.288 2.070 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1CC[C@H](C)O1 ZINC000398118539 357843122 /nfs/dbraw/zinc/84/31/22/357843122.db2.gz VVTWNPAKCXEFGD-UWVGGRQHSA-N 1 2 222.288 2.070 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H](C)[C@H](C)c1ccccc1 ZINC000193097308 357866849 /nfs/dbraw/zinc/86/68/49/357866849.db2.gz GLWJGVMAWUBBFY-SDDRHHMPSA-N 1 2 235.327 2.330 20 0 BEADLO COC(=O)[C@@H]([NH2+]CCc1ccccc1)C(C)C ZINC000035084986 357962878 /nfs/dbraw/zinc/96/28/78/357962878.db2.gz NPRVWYSELJMXHX-ZDUSSCGKSA-N 1 2 235.327 2.016 20 0 BEADLO Cc1ncc([C@H](C)[NH2+]Cc2ncc(C)cn2)s1 ZINC000639995230 358034059 /nfs/dbraw/zinc/03/40/59/358034059.db2.gz JMMCWMDKOSOOIS-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+](C)Cc2c[nH]nc2C)o1 ZINC000639971229 358021945 /nfs/dbraw/zinc/02/19/45/358021945.db2.gz OQJVZJVIQJYJQS-SNVBAGLBSA-N 1 2 234.303 2.208 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+](C)Cc2c[nH]nc2C)o1 ZINC000639971229 358021947 /nfs/dbraw/zinc/02/19/47/358021947.db2.gz OQJVZJVIQJYJQS-SNVBAGLBSA-N 1 2 234.303 2.208 20 0 BEADLO Cc1ccoc1C[N@@H+]1CCO[C@@H](CCF)C1 ZINC000628458098 358040348 /nfs/dbraw/zinc/04/03/48/358040348.db2.gz CLSULXFZKKLMKS-NSHDSACASA-N 1 2 227.279 2.148 20 0 BEADLO Cc1ccoc1C[N@H+]1CCO[C@@H](CCF)C1 ZINC000628458098 358040351 /nfs/dbraw/zinc/04/03/51/358040351.db2.gz CLSULXFZKKLMKS-NSHDSACASA-N 1 2 227.279 2.148 20 0 BEADLO CCn1ccnc1C[NH2+]Cc1ccccc1F ZINC000051920905 358100557 /nfs/dbraw/zinc/10/05/57/358100557.db2.gz FHWPOVQQAZHIMG-UHFFFAOYSA-N 1 2 233.290 2.332 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@H]1CCC(C)(C)C1 ZINC000583881016 358114989 /nfs/dbraw/zinc/11/49/89/358114989.db2.gz PSSIBNJRXPLPLC-WDEREUQCSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@H]1CCC(C)(C)C1 ZINC000583881016 358114990 /nfs/dbraw/zinc/11/49/90/358114990.db2.gz PSSIBNJRXPLPLC-WDEREUQCSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]([NH2+]CC(F)F)c1ccc2[nH]c(=O)oc2c1 ZINC000640061382 358150282 /nfs/dbraw/zinc/15/02/82/358150282.db2.gz SPWLCZCNHRATFQ-ZCFIWIBFSA-N 1 2 242.225 2.449 20 0 BEADLO C[C@H](CC(=O)N1C[C@H](C)CC[C@H]1C)n1cc[nH+]c1 ZINC000584723243 358165467 /nfs/dbraw/zinc/16/54/67/358165467.db2.gz HIHCBNRPNRJKEH-JHJVBQTASA-N 1 2 249.358 2.481 20 0 BEADLO C[C@H](CC(=O)N1CC[C@@H](C)[C@H]1C)n1cc[nH+]c1 ZINC000584842644 358199790 /nfs/dbraw/zinc/19/97/90/358199790.db2.gz BKFHGWOMZFEMQP-IJLUTSLNSA-N 1 2 235.331 2.091 20 0 BEADLO c1cn(CCCN2Cc3ccccc3CO2)c[nH+]1 ZINC000640128311 358207256 /nfs/dbraw/zinc/20/72/56/358207256.db2.gz ZFUNVPJISMJWGY-UHFFFAOYSA-N 1 2 243.310 2.221 20 0 BEADLO C[C@H]([NH2+]Cc1c[nH]nn1)[C@@H](C)C1CCCCC1 ZINC000450728008 202248876 /nfs/dbraw/zinc/24/88/76/202248876.db2.gz NUCQAPXNRVNDLU-MNOVXSKESA-N 1 2 236.363 2.499 20 0 BEADLO C[C@H]([NH2+]Cc1cn[nH]n1)[C@@H](C)C1CCCCC1 ZINC000450728008 202248879 /nfs/dbraw/zinc/24/88/79/202248879.db2.gz NUCQAPXNRVNDLU-MNOVXSKESA-N 1 2 236.363 2.499 20 0 BEADLO CO[C@@H]1CCN(c2cc(C)[nH+]cn2)CC1(C)C ZINC000450749851 202256055 /nfs/dbraw/zinc/25/60/55/202256055.db2.gz AFHZFSGTOAYYTL-LLVKDONJSA-N 1 2 235.331 2.036 20 0 BEADLO CO[C@H]1CCN(c2nc(C)[nH+]c(C)c2C)C[C@H]1C ZINC000450756597 202256061 /nfs/dbraw/zinc/25/60/61/202256061.db2.gz KKJUMTHABCNFBY-RNCFNFMXSA-N 1 2 249.358 2.263 20 0 BEADLO CO[C@@H]1CCN(c2cc[nH+]c(C(C)C)n2)C[C@@H]1C ZINC000450764332 202258501 /nfs/dbraw/zinc/25/85/01/202258501.db2.gz BYFXHUSAJNYPDC-NWDGAFQWSA-N 1 2 249.358 2.461 20 0 BEADLO Cc1csc(CN[C@@H](C)c2[nH]cc[nH+]2)n1 ZINC000124805480 491128639 /nfs/dbraw/zinc/12/86/39/491128639.db2.gz OHLFBBNZXZDUNO-QMMMGPOBSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1csc(C[NH2+][C@@H](C)c2ncc[nH]2)n1 ZINC000124805480 491128640 /nfs/dbraw/zinc/12/86/40/491128640.db2.gz OHLFBBNZXZDUNO-QMMMGPOBSA-N 1 2 222.317 2.025 20 0 BEADLO CC[C@@H]([NH2+]Cc1cccc2cc[nH]c21)C(=O)OC ZINC000310740291 358445180 /nfs/dbraw/zinc/44/51/80/358445180.db2.gz GVRLLQZGKMLITQ-GFCCVEGCSA-N 1 2 246.310 2.209 20 0 BEADLO COC(=O)[C@@H](C)[NH2+]CCc1ccc(Cl)cc1 ZINC000043627695 358541038 /nfs/dbraw/zinc/54/10/38/358541038.db2.gz TYJGEFSRPLCLCF-SECBINFHSA-N 1 2 241.718 2.034 20 0 BEADLO CCOC(=O)C[N@H+](CC)Cc1cccc(F)c1 ZINC000048695492 358648064 /nfs/dbraw/zinc/64/80/64/358648064.db2.gz COWMPTXHOWZLSJ-UHFFFAOYSA-N 1 2 239.290 2.211 20 0 BEADLO CCOC(=O)C[N@@H+](CC)Cc1cccc(F)c1 ZINC000048695492 358648065 /nfs/dbraw/zinc/64/80/65/358648065.db2.gz COWMPTXHOWZLSJ-UHFFFAOYSA-N 1 2 239.290 2.211 20 0 BEADLO CC[C@H](OC)C(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC000049447122 358689425 /nfs/dbraw/zinc/68/94/25/358689425.db2.gz LFCHJKQPGHFUAE-LBPRGKRZSA-N 1 2 247.298 2.235 20 0 BEADLO CC[C@H](OC)C(=O)Nc1ccc2[nH+]c(C)[nH]c2c1 ZINC000049447122 358689427 /nfs/dbraw/zinc/68/94/27/358689427.db2.gz LFCHJKQPGHFUAE-LBPRGKRZSA-N 1 2 247.298 2.235 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1cc(C)cc(C)c1 ZINC000049949491 358708152 /nfs/dbraw/zinc/70/81/52/358708152.db2.gz RBONLAVEVXNWOD-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1cc(C)cc(C)c1 ZINC000049949491 358708153 /nfs/dbraw/zinc/70/81/53/358708153.db2.gz RBONLAVEVXNWOD-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NCCC1CCCC1 ZINC000578245517 366469127 /nfs/dbraw/zinc/46/91/27/366469127.db2.gz QXTDMXHITJHQIU-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NCCC1CCCC1 ZINC000578245517 366469135 /nfs/dbraw/zinc/46/91/35/366469135.db2.gz QXTDMXHITJHQIU-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2ccn(C)c2)s1 ZINC000135000524 358815969 /nfs/dbraw/zinc/81/59/69/358815969.db2.gz GSQROYWUBPZDCM-QMMMGPOBSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1cc(C(=O)NCc2c[nH+]c[nH]2)ccc1Cl ZINC000135025468 358816871 /nfs/dbraw/zinc/81/68/71/358816871.db2.gz ACRPZPHKWOBKHE-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO Cc1cc(C(=O)NCc2c[nH]c[nH+]2)ccc1Cl ZINC000135025468 358816877 /nfs/dbraw/zinc/81/68/77/358816877.db2.gz ACRPZPHKWOBKHE-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO COc1c(C[NH2+][C@H](C)c2ccco2)c(C)nn1C ZINC000134108413 358780991 /nfs/dbraw/zinc/78/09/91/358780991.db2.gz SOMHNZVCHMOUQP-SNVBAGLBSA-N 1 2 249.314 2.181 20 0 BEADLO Cc1nc(C[NH2+]Cc2cnccc2C)cs1 ZINC000135455879 358838291 /nfs/dbraw/zinc/83/82/91/358838291.db2.gz AIZXEWDTNDKWMQ-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CCOCC12CCC2 ZINC000135498548 358840861 /nfs/dbraw/zinc/84/08/61/358840861.db2.gz PJTGGUXQCNNCRA-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO CCOc1cc(C[NH2+]CC(F)F)ccc1OC ZINC000136580631 358881412 /nfs/dbraw/zinc/88/14/12/358881412.db2.gz VIHJNXZHIWWCCE-UHFFFAOYSA-N 1 2 245.269 2.449 20 0 BEADLO CC[C@]1(C)C[C@H]1C(=O)Nc1cc[nH+]cc1O ZINC000136791204 358886319 /nfs/dbraw/zinc/88/63/19/358886319.db2.gz KJLNRUJCHPGYQT-QPUJVOFHSA-N 1 2 220.272 2.162 20 0 BEADLO CC[C@@H](NC(=O)Cc1ccsc1)c1[nH]cc[nH+]1 ZINC000140475156 358922392 /nfs/dbraw/zinc/92/23/92/358922392.db2.gz FSWGEAPGHHURFA-SNVBAGLBSA-N 1 2 249.339 2.281 20 0 BEADLO CC[C@@H](NC(=O)Cc1ccccc1)c1[nH]cc[nH+]1 ZINC000140724749 358925657 /nfs/dbraw/zinc/92/56/57/358925657.db2.gz BTOLTKYPRRUZHY-GFCCVEGCSA-N 1 2 243.310 2.220 20 0 BEADLO CCOC(=O)[C@H](CC)[NH+]1CC2(C1)CC(F)(F)C2 ZINC000611180816 358928997 /nfs/dbraw/zinc/92/89/97/358928997.db2.gz VHQMQTNFNOJJNK-VIFPVBQESA-N 1 2 247.285 2.059 20 0 BEADLO C[C@H](Cc1nc([C@H]2C[C@H]2C)no1)n1cc[nH+]c1 ZINC000351425884 366526327 /nfs/dbraw/zinc/52/63/27/366526327.db2.gz PGLQJEXHSPQWHN-BBBLOLIVSA-N 1 2 232.287 2.193 20 0 BEADLO CO[C@@H]1CCN(c2cc[nH+]c(C3CC3)n2)C[C@H]1C ZINC000450780789 202263386 /nfs/dbraw/zinc/26/33/86/202263386.db2.gz YPORXNZATSOASP-ZYHUDNBSSA-N 1 2 247.342 2.215 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H]1CCCC2(CC2)C1 ZINC000611796092 359452501 /nfs/dbraw/zinc/45/25/01/359452501.db2.gz WINWTDYRGBLKRB-NSHDSACASA-N 1 2 247.342 2.305 20 0 BEADLO CCC[C@@H]1C[C@@H]1C(=O)Nc1c[nH+]ccc1OC ZINC000079843599 359489151 /nfs/dbraw/zinc/48/91/51/359489151.db2.gz BIJVROJZRKWQPW-ZJUUUORDSA-N 1 2 234.299 2.465 20 0 BEADLO CCSCCNc1[nH+]cccc1OC ZINC000379586003 359560740 /nfs/dbraw/zinc/56/07/40/359560740.db2.gz QHZVAPMJHABLGH-UHFFFAOYSA-N 1 2 212.318 2.255 20 0 BEADLO Cc1onc(NC(=O)C[C@H](C)n2cc[nH+]c2)c1C ZINC000580459985 359565218 /nfs/dbraw/zinc/56/52/18/359565218.db2.gz XXIUEGRFGNGSCW-QMMMGPOBSA-N 1 2 248.286 2.078 20 0 BEADLO CC[C@H](N[C@@H](C)c1[nH]cc[nH+]1)C(F)(F)F ZINC000309033066 491142939 /nfs/dbraw/zinc/14/29/39/491142939.db2.gz GGTAJXVKWRLHNU-BQBZGAKWSA-N 1 2 221.226 2.401 20 0 BEADLO CC(C)c1nc(N[C@@H]2CC23CCOCC3)cc[nH+]1 ZINC000450788952 202266359 /nfs/dbraw/zinc/26/63/59/202266359.db2.gz FDPSSQNVSXVTJB-LLVKDONJSA-N 1 2 247.342 2.003 20 0 BEADLO CCc1cc(N[C@H]2[C@@H]3CCC[C@@H]32)nc[nH+]1 ZINC000309050068 491143447 /nfs/dbraw/zinc/14/34/47/491143447.db2.gz QMXUCIDPPMWXSU-IAZYJMLFSA-N 1 2 203.289 2.249 20 0 BEADLO Cc1ccc(F)c(CCNc2cc[nH+]c(C)n2)c1 ZINC000450810157 202272931 /nfs/dbraw/zinc/27/29/31/202272931.db2.gz MCUAHIBQUZXQFK-UHFFFAOYSA-N 1 2 245.301 2.309 20 0 BEADLO CO[C@H]([C@H](C)Nc1cc[nH+]c(C2CC2)n1)C1CC1 ZINC000450855731 202289825 /nfs/dbraw/zinc/28/98/25/202289825.db2.gz GRHCISYBUZYMMM-TVQRCGJNSA-N 1 2 247.342 2.001 20 0 BEADLO Cc1cc(N(C)[C@H](CO)CC(C)(C)C)nc[nH+]1 ZINC000450838437 202283685 /nfs/dbraw/zinc/28/36/85/202283685.db2.gz YDJCIEMLQHYFBP-NSHDSACASA-N 1 2 237.347 2.018 20 0 BEADLO Cc1cc(N[C@H]2CCC(F)(F)C2)nc[nH+]1 ZINC000309076814 491144123 /nfs/dbraw/zinc/14/41/23/491144123.db2.gz LKTAPAQJZQOZIG-QMMMGPOBSA-N 1 2 213.231 2.385 20 0 BEADLO Cc1ccc(NC(=O)Cc2cscn2)c(C)[nH+]1 ZINC000612227594 359740487 /nfs/dbraw/zinc/74/04/87/359740487.db2.gz VJBPKVOWNZYAEB-UHFFFAOYSA-N 1 2 247.323 2.336 20 0 BEADLO CC(C)(C)c1cc(COCc2[nH]cc[nH+]2)no1 ZINC000450902437 202303309 /nfs/dbraw/zinc/30/33/09/202303309.db2.gz XVUFNTACNPJDMT-UHFFFAOYSA-N 1 2 235.287 2.412 20 0 BEADLO CCC[C@H](C)N(C)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000578364812 366540481 /nfs/dbraw/zinc/54/04/81/366540481.db2.gz JHTGPAFHLDTWTQ-NWDGAFQWSA-N 1 2 237.347 2.481 20 0 BEADLO CCO[C@H](CC)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000578441631 366569882 /nfs/dbraw/zinc/56/98/82/366569882.db2.gz UOLRXXFIRXSXIS-LLVKDONJSA-N 1 2 247.298 2.088 20 0 BEADLO CCOC(=O)[C@@H](CC)[N@@H+]1CCC[C@@](C)(F)C1 ZINC000451118404 202358027 /nfs/dbraw/zinc/35/80/27/202358027.db2.gz XTBBPAYCMRLJOQ-ZYHUDNBSSA-N 1 2 231.311 2.152 20 0 BEADLO CCOC(=O)[C@@H](CC)[N@H+]1CCC[C@@](C)(F)C1 ZINC000451118404 202358029 /nfs/dbraw/zinc/35/80/29/202358029.db2.gz XTBBPAYCMRLJOQ-ZYHUDNBSSA-N 1 2 231.311 2.152 20 0 BEADLO COC(=O)c1ccc([C@H](C)[N@@H+]2CC[C@@H](F)C2)o1 ZINC000451192885 202375831 /nfs/dbraw/zinc/37/58/31/202375831.db2.gz UGCDPXULJZNGAC-DTWKUNHWSA-N 1 2 241.262 2.171 20 0 BEADLO COC(=O)c1ccc([C@H](C)[N@H+]2CC[C@@H](F)C2)o1 ZINC000451192885 202375834 /nfs/dbraw/zinc/37/58/34/202375834.db2.gz UGCDPXULJZNGAC-DTWKUNHWSA-N 1 2 241.262 2.171 20 0 BEADLO Cc1noc([C@H](C)[N@H+](C)CCC(C)(F)F)n1 ZINC000578761893 366631021 /nfs/dbraw/zinc/63/10/21/366631021.db2.gz SUXCWBGXUFMZNJ-ZETCQYMHSA-N 1 2 233.262 2.416 20 0 BEADLO Cc1noc([C@H](C)[N@@H+](C)CCC(C)(F)F)n1 ZINC000578761893 366631027 /nfs/dbraw/zinc/63/10/27/366631027.db2.gz SUXCWBGXUFMZNJ-ZETCQYMHSA-N 1 2 233.262 2.416 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CCCC(C)(C)C1 ZINC000578785625 366648625 /nfs/dbraw/zinc/64/86/25/366648625.db2.gz OOJDMYDAYSUEAX-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CCCC(C)(C)C1 ZINC000578785625 366648630 /nfs/dbraw/zinc/64/86/30/366648630.db2.gz OOJDMYDAYSUEAX-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)C[C@H]2C[C@H]2C)[nH+]1 ZINC000578875833 366665080 /nfs/dbraw/zinc/66/50/80/366665080.db2.gz YJVOTMMGVWFQDT-PSASIEDQSA-N 1 2 235.331 2.116 20 0 BEADLO CC[C@@H](C)C[N@H+](CCOC)CC(F)F ZINC000088506107 359964263 /nfs/dbraw/zinc/96/42/63/359964263.db2.gz IRBRYWFDTLNNDN-SECBINFHSA-N 1 2 209.280 2.246 20 0 BEADLO CC[C@@H](C)C[N@@H+](CCOC)CC(F)F ZINC000088506107 359964266 /nfs/dbraw/zinc/96/42/66/359964266.db2.gz IRBRYWFDTLNNDN-SECBINFHSA-N 1 2 209.280 2.246 20 0 BEADLO O=C(CCCc1cccs1)NCc1c[nH+]c[nH]1 ZINC000088759287 359976730 /nfs/dbraw/zinc/97/67/30/359976730.db2.gz NMIMEAWBPFEKLE-UHFFFAOYSA-N 1 2 249.339 2.110 20 0 BEADLO O=C(CCCc1cccs1)NCc1c[nH]c[nH+]1 ZINC000088759287 359976736 /nfs/dbraw/zinc/97/67/36/359976736.db2.gz NMIMEAWBPFEKLE-UHFFFAOYSA-N 1 2 249.339 2.110 20 0 BEADLO Cc1cc(NC(=O)[C@H]2C[C@H]3C[C@H]3C2)c(C)c[nH+]1 ZINC000612747559 360040333 /nfs/dbraw/zinc/04/03/33/360040333.db2.gz PPRXSGPFTMJIDG-GDNZZTSVSA-N 1 2 230.311 2.105 20 0 BEADLO Cc1cc(NC[C@H]2CCC[C@H]2O)nc(C(C)C)[nH+]1 ZINC000089166510 359997071 /nfs/dbraw/zinc/99/70/71/359997071.db2.gz MVSXXVDTURAOBN-VXGBXAGGSA-N 1 2 249.358 2.481 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CCOC[C@@H]1C1CC1 ZINC000090007907 360053278 /nfs/dbraw/zinc/05/32/78/360053278.db2.gz NBDDQDGLTQROPV-CYBMUJFWSA-N 1 2 249.358 2.075 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)C1C(C)(C)C1(C)C ZINC000091492613 360117277 /nfs/dbraw/zinc/11/72/77/360117277.db2.gz DERFJPIWUKNEGX-UHFFFAOYSA-N 1 2 235.331 2.050 20 0 BEADLO COCc1ccc(C[N@@H+]2CCO[C@@H](C)[C@@H]2C)o1 ZINC000093417711 360241367 /nfs/dbraw/zinc/24/13/67/360241367.db2.gz CZHDEFIIGZSDLM-QWRGUYRKSA-N 1 2 239.315 2.035 20 0 BEADLO COCc1ccc(C[N@H+]2CCO[C@@H](C)[C@@H]2C)o1 ZINC000093417711 360241369 /nfs/dbraw/zinc/24/13/69/360241369.db2.gz CZHDEFIIGZSDLM-QWRGUYRKSA-N 1 2 239.315 2.035 20 0 BEADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cc[nH]n2)n1 ZINC000093453644 360245065 /nfs/dbraw/zinc/24/50/65/360245065.db2.gz RYXIGJMHCOKIKL-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2cc[nH]n2)n1 ZINC000093453644 360245068 /nfs/dbraw/zinc/24/50/68/360245068.db2.gz RYXIGJMHCOKIKL-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccncc2Cl)ncn1 ZINC000623473694 360405588 /nfs/dbraw/zinc/40/55/88/360405588.db2.gz DWJRCCFZWNGYLT-UHFFFAOYSA-N 1 2 248.717 2.123 20 0 BEADLO C/C=C/CNC(=O)c1ccc2[nH+]c(C)n(C)c2c1 ZINC000629032663 360813424 /nfs/dbraw/zinc/81/34/24/360813424.db2.gz GHIBDDQBPIYRAY-SNAWJCMRSA-N 1 2 243.310 2.188 20 0 BEADLO CC[C@H]1C[C@@H](Nc2c[nH+]cc(N(C)C)c2)CO1 ZINC000631203731 360911127 /nfs/dbraw/zinc/91/11/27/360911127.db2.gz TUFVMMIMDIJRKI-YPMHNXCESA-N 1 2 235.331 2.127 20 0 BEADLO Cc1cnccc1CNc1c[nH+]cc(N(C)C)c1 ZINC000631203957 360915422 /nfs/dbraw/zinc/91/54/22/360915422.db2.gz UYNIAXKYOMHKEF-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO Nc1[nH+]cnc(N[C@H]2CCC(F)(F)C2)c1Cl ZINC000309644723 491153448 /nfs/dbraw/zinc/15/34/48/491153448.db2.gz VRDYTDNYUOFRIM-YFKPBYRVSA-N 1 2 248.664 2.312 20 0 BEADLO Nc1nc[nH+]c(N[C@H]2CCC(F)(F)C2)c1Cl ZINC000309644723 491153449 /nfs/dbraw/zinc/15/34/49/491153449.db2.gz VRDYTDNYUOFRIM-YFKPBYRVSA-N 1 2 248.664 2.312 20 0 BEADLO CCO[C@@H](COc1cc[nH+]cc1)C1CC1 ZINC000629361703 361011151 /nfs/dbraw/zinc/01/11/51/361011151.db2.gz KMFZEXJUKSJQKK-LBPRGKRZSA-N 1 2 207.273 2.276 20 0 BEADLO Cc1cc(N[C@@H]2CCC[C@H]3OCC[C@H]32)nc[nH+]1 ZINC000301658744 200825215 /nfs/dbraw/zinc/82/52/15/200825215.db2.gz LXBOLWBXHUACPZ-QJPTWQEYSA-N 1 2 233.315 2.155 20 0 BEADLO NC(=S)c1ccc[nH+]c1NC(C1CC1)C1CC1 ZINC000049237559 181322081 /nfs/dbraw/zinc/32/20/81/181322081.db2.gz WAKHVOCFLQKTMK-UHFFFAOYSA-N 1 2 247.367 2.316 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ccco2)ncn1 ZINC000309660660 491153922 /nfs/dbraw/zinc/15/39/22/491153922.db2.gz AVDCYIGKQYFFHM-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO CC(C)c1nc(C[N@H+](C)[C@H](C)CO)cs1 ZINC000159149304 361223965 /nfs/dbraw/zinc/22/39/65/361223965.db2.gz NJAMZRLYAORSOH-SECBINFHSA-N 1 2 228.361 2.079 20 0 BEADLO CC(C)c1nc(C[N@@H+](C)[C@H](C)CO)cs1 ZINC000159149304 361223968 /nfs/dbraw/zinc/22/39/68/361223968.db2.gz NJAMZRLYAORSOH-SECBINFHSA-N 1 2 228.361 2.079 20 0 BEADLO C[C@H](CC(=O)NCCC1=CCCC1)n1cc[nH+]c1 ZINC000578991729 366688875 /nfs/dbraw/zinc/68/88/75/366688875.db2.gz KWRVNEPGRPWAIP-GFCCVEGCSA-N 1 2 247.342 2.451 20 0 BEADLO Cc1csc([C@@H](C)[NH2+]Cc2cc(C)ncn2)n1 ZINC000428347981 201009760 /nfs/dbraw/zinc/00/97/60/201009760.db2.gz IZXRJOGTEWGGRO-SNVBAGLBSA-N 1 2 248.355 2.401 20 0 BEADLO CCCc1nc(C)c(C[N@@H+]2CCOC[C@@H]2C)o1 ZINC000428446553 201018147 /nfs/dbraw/zinc/01/81/47/201018147.db2.gz JXXJSTBXNMPUBJ-JTQLQIEISA-N 1 2 238.331 2.156 20 0 BEADLO CCCc1nc(C)c(C[N@H+]2CCOC[C@@H]2C)o1 ZINC000428446553 201018150 /nfs/dbraw/zinc/01/81/50/201018150.db2.gz JXXJSTBXNMPUBJ-JTQLQIEISA-N 1 2 238.331 2.156 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccoc2)ncn1 ZINC000428463002 201019160 /nfs/dbraw/zinc/01/91/60/201019160.db2.gz VDYBZIVLISLEHC-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccoc2)ncn1 ZINC000428463002 201019162 /nfs/dbraw/zinc/01/91/62/201019162.db2.gz VDYBZIVLISLEHC-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO CCc1cnccc1[C@@H](C)[NH2+]Cc1cocn1 ZINC000428887398 201048626 /nfs/dbraw/zinc/04/86/26/201048626.db2.gz LIIIWXPFHNISNU-SNVBAGLBSA-N 1 2 231.299 2.483 20 0 BEADLO Cc1ncsc1C(=O)Nc1cc[nH+]c(C)c1 ZINC000079718478 370689180 /nfs/dbraw/zinc/68/91/80/370689180.db2.gz MMJBUFBZWVMECL-UHFFFAOYSA-N 1 2 233.296 2.407 20 0 BEADLO CC[C@@H]([NH2+]CC(F)(F)CO)c1cccc(F)c1 ZINC000188477795 219896553 /nfs/dbraw/zinc/89/65/53/219896553.db2.gz SZDWJVWOUHTCDW-LLVKDONJSA-N 1 2 247.260 2.494 20 0 BEADLO COc1ccc(N[C@@H](C)CCCCO)[nH+]c1 ZINC000309871254 491157818 /nfs/dbraw/zinc/15/78/18/491157818.db2.gz QUGPBCJRVOSTDJ-JTQLQIEISA-N 1 2 224.304 2.053 20 0 BEADLO CC1(C)CC(CC(=O)NCCCn2cc[nH+]c2)C1 ZINC000429907742 201134111 /nfs/dbraw/zinc/13/41/11/201134111.db2.gz CTHYBXRMYVYOGC-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO CCC[N@H+](CC(N)=O)Cc1ccsc1Cl ZINC000430142530 201146622 /nfs/dbraw/zinc/14/66/22/201146622.db2.gz AIFAEPGOMLUZFL-UHFFFAOYSA-N 1 2 246.763 2.099 20 0 BEADLO CCC[N@@H+](CC(N)=O)Cc1ccsc1Cl ZINC000430142530 201146625 /nfs/dbraw/zinc/14/66/25/201146625.db2.gz AIFAEPGOMLUZFL-UHFFFAOYSA-N 1 2 246.763 2.099 20 0 BEADLO Cc1nc(N2CCc3ccc(O)cc3C2)cc[nH+]1 ZINC000433412297 201185456 /nfs/dbraw/zinc/18/54/56/201185456.db2.gz QINVQVIQMVZGKK-UHFFFAOYSA-N 1 2 241.294 2.053 20 0 BEADLO CS[C@@H]1CC[N@H+](Cc2noc(C(C)C)n2)C1 ZINC000448545981 201197765 /nfs/dbraw/zinc/19/77/65/201197765.db2.gz QWCOHTIWQQJFAM-SECBINFHSA-N 1 2 241.360 2.130 20 0 BEADLO CS[C@@H]1CC[N@@H+](Cc2noc(C(C)C)n2)C1 ZINC000448545981 201197768 /nfs/dbraw/zinc/19/77/68/201197768.db2.gz QWCOHTIWQQJFAM-SECBINFHSA-N 1 2 241.360 2.130 20 0 BEADLO C[C@H]1CN(c2cc(N3CCCC3)[nH+]cn2)C[C@@H]1C ZINC000433772472 201193275 /nfs/dbraw/zinc/19/32/75/201193275.db2.gz AXYDRWXKDVCZIX-RYUDHWBXSA-N 1 2 246.358 2.169 20 0 BEADLO C[C@H]1CN(c2cc(N3CCCC3)nc[nH+]2)C[C@@H]1C ZINC000433772472 201193278 /nfs/dbraw/zinc/19/32/78/201193278.db2.gz AXYDRWXKDVCZIX-RYUDHWBXSA-N 1 2 246.358 2.169 20 0 BEADLO Cc1nc2[nH]ccc2c(NC[C@H]2CC2(C)C)[nH+]1 ZINC000433799611 201193718 /nfs/dbraw/zinc/19/37/18/201193718.db2.gz BOURPKNBUIRYRN-SECBINFHSA-N 1 2 230.315 2.146 20 0 BEADLO CC(C)Nc1ccc(-c2ccnn2C)c[nH+]1 ZINC000629697004 361627474 /nfs/dbraw/zinc/62/74/74/361627474.db2.gz QWQFSIQAIWCNES-UHFFFAOYSA-N 1 2 216.288 2.302 20 0 BEADLO CC(C)c1nc(N2CC(OC(F)F)C2)cc[nH+]1 ZINC000435602389 201279994 /nfs/dbraw/zinc/27/99/94/201279994.db2.gz CIBAZKPQZBAWTO-UHFFFAOYSA-N 1 2 243.257 2.028 20 0 BEADLO CC(C)CCn1cccc1C[NH+]1CCOCC1 ZINC000154516415 201281403 /nfs/dbraw/zinc/28/14/03/201281403.db2.gz PIGCDCKCOKOUAC-UHFFFAOYSA-N 1 2 236.359 2.366 20 0 BEADLO C[C@H]1CCC[C@]1(C)C(=O)NCCCn1cc[nH+]c1 ZINC000448564604 201288522 /nfs/dbraw/zinc/28/85/22/201288522.db2.gz HDXBXTWMOUQNQN-JSGCOSHPSA-N 1 2 249.358 2.216 20 0 BEADLO COc1cccc(C)c1NCc1c[nH+]cn1C ZINC000435885377 201296804 /nfs/dbraw/zinc/29/68/04/201296804.db2.gz JCNMPGHSSKVDEP-UHFFFAOYSA-N 1 2 231.299 2.349 20 0 BEADLO CNc1ccc(-c2csc(COC)c2)c[nH+]1 ZINC000629750745 361682899 /nfs/dbraw/zinc/68/28/99/361682899.db2.gz ZIYSUZZFVTXJMN-UHFFFAOYSA-N 1 2 234.324 2.420 20 0 BEADLO CC(C)c1cc(N2CCC(=O)[C@H](C)C2)nc[nH+]1 ZINC000436350377 201321970 /nfs/dbraw/zinc/32/19/70/201321970.db2.gz VFNLAXVTTFWMHZ-SNVBAGLBSA-N 1 2 233.315 2.015 20 0 BEADLO CC1=C(C(=O)NC[C@@H](C)Cn2cc[nH+]c2)CCC1 ZINC000437658516 201364486 /nfs/dbraw/zinc/36/44/86/201364486.db2.gz FTJFWRPXVGTXDJ-LLVKDONJSA-N 1 2 247.342 2.136 20 0 BEADLO C[C@H](CC1CCC1)Nc1[nH+]cnc2c1cnn2C ZINC000630386927 364101281 /nfs/dbraw/zinc/10/12/81/364101281.db2.gz BIGZWGZJGAQPJY-SECBINFHSA-N 1 2 245.330 2.354 20 0 BEADLO Cc1cc(NC(=O)[C@H](C)OCC2CC2)cc[nH+]1 ZINC000068350181 370779953 /nfs/dbraw/zinc/77/99/53/370779953.db2.gz HBOSBOONDHCMBT-JTQLQIEISA-N 1 2 234.299 2.144 20 0 BEADLO CCc1cc(N2C[C@H](C)O[C@H](C)[C@H]2C)nc(C)[nH+]1 ZINC000445670908 541350117 /nfs/dbraw/zinc/35/01/17/541350117.db2.gz YDRAXPHEJVSQBW-HBNTYKKESA-N 1 2 249.358 2.350 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)n[nH]1 ZINC000181718986 366841800 /nfs/dbraw/zinc/84/18/00/366841800.db2.gz FGMNRDGZAGCJEZ-QWRGUYRKSA-N 1 2 234.347 2.132 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)n[nH]1 ZINC000181718986 366841802 /nfs/dbraw/zinc/84/18/02/366841802.db2.gz FGMNRDGZAGCJEZ-QWRGUYRKSA-N 1 2 234.347 2.132 20 0 BEADLO COc1ccccc1C[C@@H](C)Nc1c[nH]c[nH+]1 ZINC000516560696 541358915 /nfs/dbraw/zinc/35/89/15/541358915.db2.gz OKCAEAZUGKWNBR-SNVBAGLBSA-N 1 2 231.299 2.461 20 0 BEADLO C[C@@H]([NH2+]Cc1cocn1)c1ccc2c(c1)OCO2 ZINC000182068808 366864642 /nfs/dbraw/zinc/86/46/42/366864642.db2.gz GIKKKBKXEMINNF-SECBINFHSA-N 1 2 246.266 2.254 20 0 BEADLO CCc1nc(C)c(C[NH2+][C@H](C)c2cnccn2)o1 ZINC000336817115 364794552 /nfs/dbraw/zinc/79/45/52/364794552.db2.gz OQYOILYLCIRDMO-SECBINFHSA-N 1 2 246.314 2.186 20 0 BEADLO Cc1cc(N2CCC[C@@H]2[C@@H]2CCCOC2)nc[nH+]1 ZINC000567767345 364754460 /nfs/dbraw/zinc/75/44/60/364754460.db2.gz JSTOWVDLISMTFN-CHWSQXEVSA-N 1 2 247.342 2.180 20 0 BEADLO CCc1nnc(C[NH2+]Cc2cc(F)ccc2C)[nH]1 ZINC000296093317 364781576 /nfs/dbraw/zinc/78/15/76/364781576.db2.gz RJMRDRMRYCDHIK-UHFFFAOYSA-N 1 2 248.305 2.104 20 0 BEADLO CCc1nnc(C[NH2+]Cc2cccc(C)c2F)[nH]1 ZINC000295932082 364782685 /nfs/dbraw/zinc/78/26/85/364782685.db2.gz FSLYFYJNDWWVII-UHFFFAOYSA-N 1 2 248.305 2.104 20 0 BEADLO CC[C@H](NCc1[nH]c(C)c(C)[nH+]1)C(F)F ZINC000573386489 364821754 /nfs/dbraw/zinc/82/17/54/364821754.db2.gz CPJUKIWRVKFEJV-QMMMGPOBSA-N 1 2 217.263 2.160 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(=O)CC23CCC3)on1 ZINC000573621962 364877185 /nfs/dbraw/zinc/87/71/85/364877185.db2.gz RXPBCOKEJQPTGA-UHFFFAOYSA-N 1 2 234.299 2.071 20 0 BEADLO Cc1cc(C[N@H+]2CCC(=O)CC23CCC3)on1 ZINC000573621962 364877188 /nfs/dbraw/zinc/87/71/88/364877188.db2.gz RXPBCOKEJQPTGA-UHFFFAOYSA-N 1 2 234.299 2.071 20 0 BEADLO CC[C@@H]1CCN(c2nc(C)[nH+]cc2C)C1 ZINC000573742084 364907582 /nfs/dbraw/zinc/90/75/82/364907582.db2.gz QXFPSQFUCCYXDM-LLVKDONJSA-N 1 2 205.305 2.330 20 0 BEADLO CC[C@H]1CCN(c2nc(C)[nH+]cc2C)C1 ZINC000573742085 364908412 /nfs/dbraw/zinc/90/84/12/364908412.db2.gz QXFPSQFUCCYXDM-NSHDSACASA-N 1 2 205.305 2.330 20 0 BEADLO C[C@@H]1CN(C(=O)CCc2c[nH+]c[nH]2)CC(C)(C)C1 ZINC000334722531 541417315 /nfs/dbraw/zinc/41/73/15/541417315.db2.gz NPNNSNOLHIEOTI-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H]1CN(C(=O)CCc2c[nH]c[nH+]2)CC(C)(C)C1 ZINC000334722531 541417320 /nfs/dbraw/zinc/41/73/20/541417320.db2.gz NPNNSNOLHIEOTI-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO O[C@H]1CCCN(c2[nH+]ccc3ccccc32)C1 ZINC000168745007 364995497 /nfs/dbraw/zinc/99/54/97/364995497.db2.gz MPMOENFXMBNRCV-LBPRGKRZSA-N 1 2 228.295 2.196 20 0 BEADLO C[C@@H](CC(=O)N(C)CC(C)(C)C)n1cc[nH+]c1 ZINC000574330852 365038910 /nfs/dbraw/zinc/03/89/10/365038910.db2.gz YYJILALFIAYBGH-NSHDSACASA-N 1 2 237.347 2.339 20 0 BEADLO Cc1cncc(C[N@@H+]2CCc3ncsc3C2)c1 ZINC000442888397 193000071 /nfs/dbraw/zinc/00/00/71/193000071.db2.gz BFQOWUXEGKFVRO-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cncc(C[N@H+]2CCc3ncsc3C2)c1 ZINC000442888397 193000074 /nfs/dbraw/zinc/00/00/74/193000074.db2.gz BFQOWUXEGKFVRO-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1c[nH+]c(C)nc1NCC1C[C@H](C)O[C@@H](C)C1 ZINC000574770033 365142053 /nfs/dbraw/zinc/14/20/53/365142053.db2.gz GCHXLBPVZXUKOZ-QWRGUYRKSA-N 1 2 249.358 2.131 20 0 BEADLO C[C@H](CC(=O)NCc1ccsc1)n1cc[nH+]c1 ZINC000574814542 365149824 /nfs/dbraw/zinc/14/98/24/365149824.db2.gz JGNYOTIQRQTZJF-SNVBAGLBSA-N 1 2 249.339 2.212 20 0 BEADLO OC1(CCSCc2cn3ccccc3[nH+]2)CC1 ZINC000443136981 193013909 /nfs/dbraw/zinc/01/39/09/193013909.db2.gz SDMDWAWYHBBJBZ-UHFFFAOYSA-N 1 2 248.351 2.483 20 0 BEADLO C[C@H](CC(=O)N1CC(CC2CC2)C1)n1cc[nH+]c1 ZINC000622246386 370795707 /nfs/dbraw/zinc/79/57/07/370795707.db2.gz POOULRTVLKVSCS-LLVKDONJSA-N 1 2 247.342 2.093 20 0 BEADLO C[C@H](CC(=O)N[C@H](C)c1[nH]cc[nH+]1)n1cccc1 ZINC000575137412 365218107 /nfs/dbraw/zinc/21/81/07/365218107.db2.gz XJUZXWDHUZSRSV-GHMZBOCLSA-N 1 2 246.314 2.040 20 0 BEADLO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1ncccn1 ZINC000192080272 365272867 /nfs/dbraw/zinc/27/28/67/365272867.db2.gz NQAAVWNSJDILQR-CYBMUJFWSA-N 1 2 242.326 2.152 20 0 BEADLO Cn1cccc1[C@H]1CCC[N@H+]1Cc1ncccn1 ZINC000192080272 365272873 /nfs/dbraw/zinc/27/28/73/365272873.db2.gz NQAAVWNSJDILQR-CYBMUJFWSA-N 1 2 242.326 2.152 20 0 BEADLO Cc1oncc1C[N@@H+]1CCC(=O)CC12CCC2 ZINC000575327413 365290642 /nfs/dbraw/zinc/29/06/42/365290642.db2.gz WBGUBUHFMLBKHK-UHFFFAOYSA-N 1 2 234.299 2.071 20 0 BEADLO Cc1oncc1C[N@H+]1CCC(=O)CC12CCC2 ZINC000575327413 365290646 /nfs/dbraw/zinc/29/06/46/365290646.db2.gz WBGUBUHFMLBKHK-UHFFFAOYSA-N 1 2 234.299 2.071 20 0 BEADLO O=C(NCc1c[nH+]c[nH]1)c1csc(Cl)c1 ZINC000336531782 365340414 /nfs/dbraw/zinc/34/04/14/365340414.db2.gz CTEONXFGPYPOGH-UHFFFAOYSA-N 1 2 241.703 2.055 20 0 BEADLO O=C(NCc1c[nH]c[nH+]1)c1csc(Cl)c1 ZINC000336531782 365340418 /nfs/dbraw/zinc/34/04/18/365340418.db2.gz CTEONXFGPYPOGH-UHFFFAOYSA-N 1 2 241.703 2.055 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CCSC[C@H]2C)o1 ZINC000172591985 365343378 /nfs/dbraw/zinc/34/33/78/365343378.db2.gz PZPOGAGIZMCKFV-SECBINFHSA-N 1 2 241.360 2.130 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CCSC[C@H]2C)o1 ZINC000172591985 365343384 /nfs/dbraw/zinc/34/33/84/365343384.db2.gz PZPOGAGIZMCKFV-SECBINFHSA-N 1 2 241.360 2.130 20 0 BEADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1nccn1C ZINC000172909884 365387240 /nfs/dbraw/zinc/38/72/40/365387240.db2.gz CDDNWVVTWMGHFD-GFCCVEGCSA-N 1 2 241.338 2.367 20 0 BEADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1nccn1C ZINC000172909884 365387245 /nfs/dbraw/zinc/38/72/45/365387245.db2.gz CDDNWVVTWMGHFD-GFCCVEGCSA-N 1 2 241.338 2.367 20 0 BEADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1nccn1C ZINC000172909889 365387373 /nfs/dbraw/zinc/38/73/73/365387373.db2.gz CDDNWVVTWMGHFD-LBPRGKRZSA-N 1 2 241.338 2.367 20 0 BEADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1nccn1C ZINC000172909889 365387375 /nfs/dbraw/zinc/38/73/75/365387375.db2.gz CDDNWVVTWMGHFD-LBPRGKRZSA-N 1 2 241.338 2.367 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N[C@H]1CCCC1(C)C ZINC000575933396 365420292 /nfs/dbraw/zinc/42/02/92/365420292.db2.gz LKCZXBQJEZOGPS-JQWIXIFHSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N[C@H]1CCCC1(C)C ZINC000575933396 365420299 /nfs/dbraw/zinc/42/02/99/365420299.db2.gz LKCZXBQJEZOGPS-JQWIXIFHSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@H]1CCCC1(C)C ZINC000575933397 365420366 /nfs/dbraw/zinc/42/03/66/365420366.db2.gz LKCZXBQJEZOGPS-PWSUYJOCSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@H]1CCCC1(C)C ZINC000575933397 365420370 /nfs/dbraw/zinc/42/03/70/365420370.db2.gz LKCZXBQJEZOGPS-PWSUYJOCSA-N 1 2 249.358 2.283 20 0 BEADLO Cc1sccc1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000575995185 365440414 /nfs/dbraw/zinc/44/04/14/365440414.db2.gz GZIZHYODVNYINM-UHFFFAOYSA-N 1 2 249.339 2.445 20 0 BEADLO c1n[nH]c([C@@H]([NH2+]CC2CC2)C2CCCCC2)n1 ZINC000576174782 365511236 /nfs/dbraw/zinc/51/12/36/365511236.db2.gz NRYVHXCLQKMXDY-LBPRGKRZSA-N 1 2 234.347 2.426 20 0 BEADLO Cc1sccc1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000576121939 365493946 /nfs/dbraw/zinc/49/39/46/365493946.db2.gz RPGLNAKMZJOEAG-SSDOTTSWSA-N 1 2 235.312 2.271 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000576164285 365506351 /nfs/dbraw/zinc/50/63/51/365506351.db2.gz SIVDXJUWDRQRRI-SDDRHHMPSA-N 1 2 237.347 2.385 20 0 BEADLO CCN(CC)C(=O)C[C@H](C)Nc1ccc(C)[nH+]c1 ZINC000182906569 366955740 /nfs/dbraw/zinc/95/57/40/366955740.db2.gz MSFKWFPDPRXUMO-LBPRGKRZSA-N 1 2 249.358 2.449 20 0 BEADLO Cc1ccc(NC(=O)[C@@H](C)OCC2CC2)c(C)[nH+]1 ZINC000176208128 541500931 /nfs/dbraw/zinc/50/09/31/541500931.db2.gz OZGXFQVAILLZOS-LLVKDONJSA-N 1 2 248.326 2.452 20 0 BEADLO Cc1cccc2c1CCN2Cc1c[nH+]cn1C ZINC000177028029 541502514 /nfs/dbraw/zinc/50/25/14/541502514.db2.gz HDENSKPJHSDZEC-UHFFFAOYSA-N 1 2 227.311 2.291 20 0 BEADLO CC[C@H]1CCC[C@@H](C[N@H+](C)Cc2nnc[nH]2)C1 ZINC000183085125 366976035 /nfs/dbraw/zinc/97/60/35/366976035.db2.gz XRRYRWZWILODSO-NWDGAFQWSA-N 1 2 236.363 2.453 20 0 BEADLO CC[C@H]1CCC[C@@H](C[N@@H+](C)Cc2nnc[nH]2)C1 ZINC000183085125 366976041 /nfs/dbraw/zinc/97/60/41/366976041.db2.gz XRRYRWZWILODSO-NWDGAFQWSA-N 1 2 236.363 2.453 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC1CCCCCC1 ZINC000579728717 366995242 /nfs/dbraw/zinc/99/52/42/366995242.db2.gz IYLOMOASAHAJLT-LLVKDONJSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC1CCCCCC1 ZINC000579728717 366995246 /nfs/dbraw/zinc/99/52/46/366995246.db2.gz IYLOMOASAHAJLT-LLVKDONJSA-N 1 2 249.358 2.427 20 0 BEADLO CCN(CC)C(=O)N[C@H](c1[nH]cc[nH+]1)C(C)C ZINC000579773169 367003477 /nfs/dbraw/zinc/00/34/77/367003477.db2.gz OXJZOUUVFPNURO-JTQLQIEISA-N 1 2 238.335 2.158 20 0 BEADLO Cc1cc(NC(=O)c2ccc(F)cn2)cc[nH+]1 ZINC000183263082 367006874 /nfs/dbraw/zinc/00/68/74/367006874.db2.gz SWUTYDXZBMCPPP-UHFFFAOYSA-N 1 2 231.230 2.176 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)N[C@H]1CC12CC2 ZINC000580771123 367161379 /nfs/dbraw/zinc/16/13/79/367161379.db2.gz XAIWOWNVCPPYSL-JTQLQIEISA-N 1 2 242.282 2.008 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)N[C@@H]1CC12CC2 ZINC000580771124 367161937 /nfs/dbraw/zinc/16/19/37/367161937.db2.gz XAIWOWNVCPPYSL-SNVBAGLBSA-N 1 2 242.282 2.008 20 0 BEADLO CCN(CCC1CC1)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000580956615 367216736 /nfs/dbraw/zinc/21/67/36/367216736.db2.gz CYKKKXRPICZESB-LBPRGKRZSA-N 1 2 249.358 2.483 20 0 BEADLO FC(F)c1ccnc(C[NH2+]CC2(F)CC2)n1 ZINC000381629751 367441819 /nfs/dbraw/zinc/44/18/19/367441819.db2.gz OQVAIIRXAHLRST-UHFFFAOYSA-N 1 2 231.221 2.006 20 0 BEADLO O=C(NCCc1[nH]cc[nH+]1)C1(C2CCC2)CCC1 ZINC000581472222 367505657 /nfs/dbraw/zinc/50/56/57/367505657.db2.gz SBUOXLMWWYLIEP-UHFFFAOYSA-N 1 2 247.342 2.039 20 0 BEADLO CC(=O)c1cc(C[N@@H+](C)[C@@H]2CC2(C)C)on1 ZINC000581556237 367587259 /nfs/dbraw/zinc/58/72/59/367587259.db2.gz ZKAOXYLHKWCJIZ-LLVKDONJSA-N 1 2 222.288 2.108 20 0 BEADLO CC(=O)c1cc(C[N@H+](C)[C@@H]2CC2(C)C)on1 ZINC000581556237 367587262 /nfs/dbraw/zinc/58/72/62/367587262.db2.gz ZKAOXYLHKWCJIZ-LLVKDONJSA-N 1 2 222.288 2.108 20 0 BEADLO FC(F)Cn1cc(C[N@@H+]2CCC[C@@H](F)C2)cn1 ZINC000581612909 367634490 /nfs/dbraw/zinc/63/44/90/367634490.db2.gz JHKCJZMIURJRJS-SNVBAGLBSA-N 1 2 247.264 2.082 20 0 BEADLO FC(F)Cn1cc(C[N@H+]2CCC[C@@H](F)C2)cn1 ZINC000581612909 367634493 /nfs/dbraw/zinc/63/44/93/367634493.db2.gz JHKCJZMIURJRJS-SNVBAGLBSA-N 1 2 247.264 2.082 20 0 BEADLO Cc1cc(N2CCC[C@H](O)[C@@H]2C)nc(C(C)C)[nH+]1 ZINC000385016706 367773797 /nfs/dbraw/zinc/77/37/97/367773797.db2.gz NXROFOLQDGRRMB-RYUDHWBXSA-N 1 2 249.358 2.258 20 0 BEADLO C[C@H](C1CC1)N(C)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000581827496 367835585 /nfs/dbraw/zinc/83/55/85/367835585.db2.gz TWPXBLBNKJIUPU-WDEREUQCSA-N 1 2 235.331 2.091 20 0 BEADLO CN(C)c1c[nH+]cc(NCc2cscn2)c1 ZINC000630957440 368155016 /nfs/dbraw/zinc/15/50/16/368155016.db2.gz SXWWGPRKYISNGA-UHFFFAOYSA-N 1 2 234.328 2.216 20 0 BEADLO CN(C)c1c[nH+]cc(NCC2(F)CC2)c1 ZINC000630955973 368149699 /nfs/dbraw/zinc/14/96/99/368149699.db2.gz JSRFYRBFTWGKAH-UHFFFAOYSA-N 1 2 209.268 2.062 20 0 BEADLO COCC[N@H+](C/C=C/Cl)Cc1ccco1 ZINC000046062150 368435794 /nfs/dbraw/zinc/43/57/94/368435794.db2.gz LQDNSHKDSBAYKG-HWKANZROSA-N 1 2 229.707 2.481 20 0 BEADLO COCC[N@@H+](C/C=C/Cl)Cc1ccco1 ZINC000046062150 368435798 /nfs/dbraw/zinc/43/57/98/368435798.db2.gz LQDNSHKDSBAYKG-HWKANZROSA-N 1 2 229.707 2.481 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2nccn2C)cc1 ZINC000057592379 368496817 /nfs/dbraw/zinc/49/68/17/368496817.db2.gz RDFVUWZNRJAMIV-UHFFFAOYSA-N 1 2 245.326 2.061 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2nccn2C)cc1 ZINC000057592379 368496821 /nfs/dbraw/zinc/49/68/21/368496821.db2.gz RDFVUWZNRJAMIV-UHFFFAOYSA-N 1 2 245.326 2.061 20 0 BEADLO COC(=O)c1ccc(C[N@H+](C)Cc2ccco2)o1 ZINC000058829990 368521693 /nfs/dbraw/zinc/52/16/93/368521693.db2.gz BKAJDBWXZZAQTF-UHFFFAOYSA-N 1 2 249.266 2.291 20 0 BEADLO COC(=O)c1ccc(C[N@@H+](C)Cc2ccco2)o1 ZINC000058829990 368521700 /nfs/dbraw/zinc/52/17/00/368521700.db2.gz BKAJDBWXZZAQTF-UHFFFAOYSA-N 1 2 249.266 2.291 20 0 BEADLO Cc1scc(CNc2cc(C)[nH+]cn2)c1C ZINC000399751630 368555920 /nfs/dbraw/zinc/55/59/20/368555920.db2.gz ANMOSNKMLOKAEZ-UHFFFAOYSA-N 1 2 233.340 2.497 20 0 BEADLO O=C(C[C@H]1C=CCC1)NCCCCn1cc[nH+]c1 ZINC000060408163 368542428 /nfs/dbraw/zinc/54/24/28/368542428.db2.gz AFEYQJDKVHVSSY-ZDUSSCGKSA-N 1 2 247.342 2.136 20 0 BEADLO Cc1cc(C[N@H+](C)CCOc2ccccc2)no1 ZINC000061759023 368568739 /nfs/dbraw/zinc/56/87/39/368568739.db2.gz SKUQYTQRBGWUEU-UHFFFAOYSA-N 1 2 246.310 2.494 20 0 BEADLO Cc1cc(C[N@@H+](C)CCOc2ccccc2)no1 ZINC000061759023 368568744 /nfs/dbraw/zinc/56/87/44/368568744.db2.gz SKUQYTQRBGWUEU-UHFFFAOYSA-N 1 2 246.310 2.494 20 0 BEADLO C[C@H](C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21)C1CC1 ZINC000456422305 202942986 /nfs/dbraw/zinc/94/29/86/202942986.db2.gz OCFYNAFLLNYOGK-WCABBAIRSA-N 1 2 233.315 2.051 20 0 BEADLO CCCCCC(=O)NCCNc1cccc[nH+]1 ZINC000063705453 368592723 /nfs/dbraw/zinc/59/27/23/368592723.db2.gz UWRIAABBVKPQFT-UHFFFAOYSA-N 1 2 235.331 2.190 20 0 BEADLO CCN(C(=O)Cn1cc[nH+]c1)c1cccc(C)c1 ZINC000082338870 368677385 /nfs/dbraw/zinc/67/73/85/368677385.db2.gz RCHAHTCRASLRJO-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO CC[C@@]1(C(C)C)C[C@H]1NC(=O)CCc1[nH]cc[nH+]1 ZINC000457277692 203031154 /nfs/dbraw/zinc/03/11/54/203031154.db2.gz KUGPEFQESXUDGN-RISCZKNCSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@]1(C(C)C)C[C@@H]1NC(=O)CCc1[nH]cc[nH+]1 ZINC000457277693 203031369 /nfs/dbraw/zinc/03/13/69/203031369.db2.gz KUGPEFQESXUDGN-SMDDNHRTSA-N 1 2 249.358 2.283 20 0 BEADLO Cc1ccc(NC(=O)c2ccsn2)c(C)[nH+]1 ZINC000622425839 370913876 /nfs/dbraw/zinc/91/38/76/370913876.db2.gz OEEOVNXQHSXUQU-UHFFFAOYSA-N 1 2 233.296 2.407 20 0 BEADLO Cc1ncc(C[N@@H+]2CCOC3(CCC3)C2)s1 ZINC000154178283 326134437 /nfs/dbraw/zinc/13/44/37/326134437.db2.gz RQMSDOIKXBGZNL-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO Cc1ncc(C[N@H+]2CCOC3(CCC3)C2)s1 ZINC000154178283 326134440 /nfs/dbraw/zinc/13/44/40/326134440.db2.gz RQMSDOIKXBGZNL-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)CCn2cc[nH+]c2)[C@@H]1C ZINC000072621095 368776128 /nfs/dbraw/zinc/77/61/28/368776128.db2.gz RVTYRIBZDDXCDN-JHJVBQTASA-N 1 2 249.358 2.214 20 0 BEADLO CC(C)[C@@H](C)CC(=O)NCCCn1cc[nH+]c1 ZINC000069367672 368753302 /nfs/dbraw/zinc/75/33/02/368753302.db2.gz IPPQFPPQUIDHHG-LBPRGKRZSA-N 1 2 237.347 2.072 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)[C@H]2C[C@H]3C[C@H]3C2)c2[nH+]ccn21 ZINC000615963988 368800996 /nfs/dbraw/zinc/80/09/96/368800996.db2.gz UVVSBCINGJJOQO-LDMBFOFVSA-N 1 2 245.326 2.051 20 0 BEADLO c1cn(Cc2ccc3ncccc3c2)c[nH+]1 ZINC000111550604 368859130 /nfs/dbraw/zinc/85/91/30/368859130.db2.gz WNECEKQMVXTHTM-UHFFFAOYSA-N 1 2 209.252 2.480 20 0 BEADLO CCC[C@H](O)CNc1cc[nH+]c(C(C)C)n1 ZINC000112333793 368870738 /nfs/dbraw/zinc/87/07/38/368870738.db2.gz YWEYVDQUUVNJLN-JTQLQIEISA-N 1 2 223.320 2.173 20 0 BEADLO CCCn1ccc(C[NH2+]Cc2cc(C)on2)c1 ZINC000091013071 369003975 /nfs/dbraw/zinc/00/39/75/369003975.db2.gz CTHBCWRJODJVDC-UHFFFAOYSA-N 1 2 233.315 2.484 20 0 BEADLO CC(C)CCCCC(=O)NCc1[nH]cc[nH+]1 ZINC000457561573 203075384 /nfs/dbraw/zinc/07/53/84/203075384.db2.gz LSRXJDGAJWFOEH-UHFFFAOYSA-N 1 2 223.320 2.242 20 0 BEADLO C[C@H](CNC(=O)[C@H](C)C1CCC1)Cn1cc[nH+]c1 ZINC000457568523 203075702 /nfs/dbraw/zinc/07/57/02/203075702.db2.gz FNXFDAZBBXHIJE-VXGBXAGGSA-N 1 2 249.358 2.072 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)C1CC(C(C)(C)C)C1 ZINC000457528076 203071257 /nfs/dbraw/zinc/07/12/57/203071257.db2.gz OIHYMUAAZWNUBB-UHFFFAOYSA-N 1 2 249.358 2.109 20 0 BEADLO CC[C@@H](NC(=O)[C@@H](C)C1CCC1)c1[nH]cc[nH+]1 ZINC000457724252 203094816 /nfs/dbraw/zinc/09/48/16/203094816.db2.gz DZFPIJHELHXZRO-GXSJLCMTSA-N 1 2 235.331 2.413 20 0 BEADLO C[C@@H](C(=O)N(C)CCCn1cc[nH+]c1)C1CCC1 ZINC000457656862 203086445 /nfs/dbraw/zinc/08/64/45/203086445.db2.gz QZKLXSMIAIUXJX-GFCCVEGCSA-N 1 2 249.358 2.168 20 0 BEADLO C[C@H](C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21)C1CCC1 ZINC000457889797 203119059 /nfs/dbraw/zinc/11/90/59/203119059.db2.gz YTGBYGKOVHRKAV-JFGNBEQYSA-N 1 2 247.342 2.441 20 0 BEADLO Cc1[nH]c(C(=O)NCCCC2CCC2)c[nH+]1 ZINC000618616651 369186286 /nfs/dbraw/zinc/18/62/86/369186286.db2.gz LPTHWNNCKJEERG-UHFFFAOYSA-N 1 2 221.304 2.028 20 0 BEADLO CC[C@](C)(NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1)C1CC1 ZINC000618950907 369244313 /nfs/dbraw/zinc/24/43/13/369244313.db2.gz GCBIEDUEBARKCA-HZMBPMFUSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@](C)(NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1)C1CC1 ZINC000618950907 369244316 /nfs/dbraw/zinc/24/43/16/369244316.db2.gz GCBIEDUEBARKCA-HZMBPMFUSA-N 1 2 249.358 2.283 20 0 BEADLO COC(C)(C)C(=O)Nc1c[nH+]c2c(C)cccn12 ZINC000619013430 369257575 /nfs/dbraw/zinc/25/75/75/369257575.db2.gz ORANOGPGWHGQQJ-UHFFFAOYSA-N 1 2 247.298 2.006 20 0 BEADLO Cc1cccn2c(NC(=O)C3CCC3)c[nH+]c12 ZINC000619011642 369257608 /nfs/dbraw/zinc/25/76/08/369257608.db2.gz XMEHJXHKENVKPH-UHFFFAOYSA-N 1 2 229.283 2.381 20 0 BEADLO CCn1nncc1C[N@H+](Cc1ccco1)C(C)C ZINC000459332351 203257800 /nfs/dbraw/zinc/25/78/00/203257800.db2.gz VYEJSZSCEXMQQZ-UHFFFAOYSA-N 1 2 248.330 2.302 20 0 BEADLO CCn1nncc1C[N@@H+](Cc1ccco1)C(C)C ZINC000459332351 203257804 /nfs/dbraw/zinc/25/78/04/203257804.db2.gz VYEJSZSCEXMQQZ-UHFFFAOYSA-N 1 2 248.330 2.302 20 0 BEADLO CCC(F)(F)C[NH2+][C@H]1C[C@H](C)N(C2CC2)C1 ZINC000623680127 369381578 /nfs/dbraw/zinc/38/15/78/369381578.db2.gz YSEZFOLMYHDXES-UWVGGRQHSA-N 1 2 232.318 2.247 20 0 BEADLO CCOC1C[NH+](C/C=C/c2ccccc2OC)C1 ZINC000459602334 203314894 /nfs/dbraw/zinc/31/48/94/203314894.db2.gz DKMRGVICLBKKKD-SOFGYWHQSA-N 1 2 247.338 2.429 20 0 BEADLO CCC(F)(F)C[NH2+][C@@H]1C[C@H](C)N(C2CC2)C1 ZINC000623680128 369382108 /nfs/dbraw/zinc/38/21/08/369382108.db2.gz YSEZFOLMYHDXES-VHSXEESVSA-N 1 2 232.318 2.247 20 0 BEADLO COC1C[NH+](Cc2ccc([C@H]3C[C@@H]3C)o2)C1 ZINC000459588109 203308249 /nfs/dbraw/zinc/30/82/49/203308249.db2.gz VVHCXINWBXXGRI-CABZTGNLSA-N 1 2 221.300 2.234 20 0 BEADLO OCCC1C[NH+](Cc2ccc(F)cc2Cl)C1 ZINC000459593354 203309520 /nfs/dbraw/zinc/30/95/20/203309520.db2.gz OOLYGLNHWYDCHP-UHFFFAOYSA-N 1 2 243.709 2.293 20 0 BEADLO COc1cc(F)cc(C[NH+]2CC(C)(OC)C2)c1 ZINC000459594581 203310427 /nfs/dbraw/zinc/31/04/27/203310427.db2.gz WWQDUPMSYDWHHA-UHFFFAOYSA-N 1 2 239.290 2.055 20 0 BEADLO CCC(CC)C[N@@H+]1C[C@@H](F)C[C@H]1C(=O)OC ZINC000619433654 369353172 /nfs/dbraw/zinc/35/31/72/369353172.db2.gz IMYWMYNFHAUFSX-QWRGUYRKSA-N 1 2 231.311 2.008 20 0 BEADLO CCC(CC)C[N@H+]1C[C@@H](F)C[C@H]1C(=O)OC ZINC000619433654 369353178 /nfs/dbraw/zinc/35/31/78/369353178.db2.gz IMYWMYNFHAUFSX-QWRGUYRKSA-N 1 2 231.311 2.008 20 0 BEADLO COc1ccc(C[NH+]2CC(C)(OC)C2)cc1F ZINC000459571352 203303026 /nfs/dbraw/zinc/30/30/26/203303026.db2.gz CTDINWJGDPBTLN-UHFFFAOYSA-N 1 2 239.290 2.055 20 0 BEADLO COC1C[NH+](C/C(C)=C/c2ccccc2)C1 ZINC000459578414 203304148 /nfs/dbraw/zinc/30/41/48/203304148.db2.gz IFKPSUMHVHQZDC-XYOKQWHBSA-N 1 2 217.312 2.421 20 0 BEADLO CCC[C@@H](C)NC(=O)[C@@H]1CCn2cc(C)[nH+]c2C1 ZINC000623685907 369404591 /nfs/dbraw/zinc/40/45/91/369404591.db2.gz YDBFMSAAFGXZEG-ZYHUDNBSSA-N 1 2 249.358 2.059 20 0 BEADLO CCC[C@H](C)NC(=O)[C@H]1CCn2cc(C)[nH+]c2C1 ZINC000623685905 369404783 /nfs/dbraw/zinc/40/47/83/369404783.db2.gz YDBFMSAAFGXZEG-JQWIXIFHSA-N 1 2 249.358 2.059 20 0 BEADLO CCc1nc(C[NH+]2CC(C)(COC)C2)cs1 ZINC000459626241 203320795 /nfs/dbraw/zinc/32/07/95/203320795.db2.gz ZSZCOSUDSXYKTA-UHFFFAOYSA-N 1 2 240.372 2.174 20 0 BEADLO CCOC1(C)C[NH+](C/C=C\c2ccncc2)C1 ZINC000459626557 203321277 /nfs/dbraw/zinc/32/12/77/203321277.db2.gz VAWQGDLCOIYZEA-PLNGDYQASA-N 1 2 232.327 2.206 20 0 BEADLO CCC1(C)C[NH+](Cc2cn(C(C)C)nn2)C1 ZINC000459638941 203327017 /nfs/dbraw/zinc/32/70/17/203327017.db2.gz VCDNPOXSHMAKFU-UHFFFAOYSA-N 1 2 222.336 2.091 20 0 BEADLO CCC(C)(C)CC[N@@H+]1C[C@@H](F)C[C@H]1C(=O)OC ZINC000619513832 369456494 /nfs/dbraw/zinc/45/64/94/369456494.db2.gz ZVWABMVCTGVYHW-QWRGUYRKSA-N 1 2 245.338 2.398 20 0 BEADLO CCC(C)(C)CC[N@H+]1C[C@@H](F)C[C@H]1C(=O)OC ZINC000619513832 369456498 /nfs/dbraw/zinc/45/64/98/369456498.db2.gz ZVWABMVCTGVYHW-QWRGUYRKSA-N 1 2 245.338 2.398 20 0 BEADLO CCOC(=O)CC[N@@H+]1Cc2cccc(F)c2C1 ZINC000459734953 203346247 /nfs/dbraw/zinc/34/62/47/203346247.db2.gz PAXHFNDLSHQMPT-UHFFFAOYSA-N 1 2 237.274 2.095 20 0 BEADLO CCOC(=O)CC[N@H+]1Cc2cccc(F)c2C1 ZINC000459734953 203346249 /nfs/dbraw/zinc/34/62/49/203346249.db2.gz PAXHFNDLSHQMPT-UHFFFAOYSA-N 1 2 237.274 2.095 20 0 BEADLO CC(C)n1ncnc1C[N@H+](C)C1CC(C)(C)C1 ZINC000459770009 203364081 /nfs/dbraw/zinc/36/40/81/203364081.db2.gz ROIGFQLVXCWMQZ-UHFFFAOYSA-N 1 2 236.363 2.479 20 0 BEADLO CC(C)n1ncnc1C[N@@H+](C)C1CC(C)(C)C1 ZINC000459770009 203364083 /nfs/dbraw/zinc/36/40/83/203364083.db2.gz ROIGFQLVXCWMQZ-UHFFFAOYSA-N 1 2 236.363 2.479 20 0 BEADLO CS[C@H](C)CC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000619867571 369622909 /nfs/dbraw/zinc/62/29/09/369622909.db2.gz WSIBWDWPHQMSLT-SECBINFHSA-N 1 2 249.339 2.414 20 0 BEADLO CC(C)[C@@H](NC(=O)C(C)(C)c1c[nH]c[nH+]1)C1CC1 ZINC000620044496 369688020 /nfs/dbraw/zinc/68/80/20/369688020.db2.gz IRULZDUXNQQBLC-GFCCVEGCSA-N 1 2 249.358 2.238 20 0 BEADLO CC(C)CC1(NC(=O)CCc2c[nH+]cn2C)CC1 ZINC000620284485 369800939 /nfs/dbraw/zinc/80/09/39/369800939.db2.gz DNUCLEPRSSCBRS-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CC(C)CC1(NC(=O)CCc2[nH]cc[nH+]2)CC1 ZINC000620284831 369801276 /nfs/dbraw/zinc/80/12/76/369801276.db2.gz LTWMBUSVKDYMPE-UHFFFAOYSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H](CNC(=O)Cn1cc[nH+]c1)C1CCCCC1 ZINC000620368323 369855954 /nfs/dbraw/zinc/85/59/54/369855954.db2.gz KKJGTRKWCVVWMF-GFCCVEGCSA-N 1 2 249.358 2.216 20 0 BEADLO O=C(CCCn1cc[nH+]c1)N1CCCCCC1 ZINC000620411807 369867884 /nfs/dbraw/zinc/86/78/84/369867884.db2.gz LPPNUUSXGBQAEP-UHFFFAOYSA-N 1 2 235.331 2.066 20 0 BEADLO CCC[C@@H](C)C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620599355 369949341 /nfs/dbraw/zinc/94/93/41/369949341.db2.gz FHSFOCCWJSLHJA-NXEZZACHSA-N 1 2 223.320 2.034 20 0 BEADLO C[C@@H](NC(=O)[C@H]1[C@@H]2CCCC[C@@H]21)c1[nH+]ccn1C ZINC000620600791 369950694 /nfs/dbraw/zinc/95/06/94/369950694.db2.gz QNGXQCKBWTUPJJ-WYUUTHIRSA-N 1 2 247.342 2.034 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CCC(C)(C)C1)c1[nH+]ccn1C ZINC000620604194 369951321 /nfs/dbraw/zinc/95/13/21/369951321.db2.gz PMZMSEFDBDYBAY-GHMZBOCLSA-N 1 2 249.358 2.424 20 0 BEADLO C[C@H](NC(=O)CCC1CCC1)c1[nH+]ccn1C ZINC000620603878 369951535 /nfs/dbraw/zinc/95/15/35/369951535.db2.gz OFERYSUQFNEGSB-JTQLQIEISA-N 1 2 235.331 2.178 20 0 BEADLO C[C@H](NC(=O)C[C@@H]1CCC[C@@H]1C)c1[nH+]ccn1C ZINC000620604188 369951828 /nfs/dbraw/zinc/95/18/28/369951828.db2.gz PLWXYWWDNCOWNA-SRVKXCTJSA-N 1 2 249.358 2.424 20 0 BEADLO Cc1cscc1C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620603722 369952071 /nfs/dbraw/zinc/95/20/71/369952071.db2.gz MUHUUVOBLGXJSU-VIFPVBQESA-N 1 2 249.339 2.281 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CC12CCCC2)c1[nH+]ccn1C ZINC000620603904 369952096 /nfs/dbraw/zinc/95/20/96/369952096.db2.gz OLLLUOGYFIXHCO-GHMZBOCLSA-N 1 2 247.342 2.178 20 0 BEADLO C[C@H](NC(=O)[C@H]1CCC(C)(C)C1)c1[nH+]ccn1C ZINC000620604196 369952991 /nfs/dbraw/zinc/95/29/91/369952991.db2.gz PMZMSEFDBDYBAY-QWRGUYRKSA-N 1 2 249.358 2.424 20 0 BEADLO C[C@H](NC(=O)C[C@H]1C=CCCC1)c1[nH+]ccn1C ZINC000620604572 369953009 /nfs/dbraw/zinc/95/30/09/369953009.db2.gz SQIDQDPBXYDDDL-RYUDHWBXSA-N 1 2 247.342 2.344 20 0 BEADLO Cc1cc(C(=O)N[C@H](C)c2[nH+]ccn2C)oc1C ZINC000620604892 369953543 /nfs/dbraw/zinc/95/35/43/369953543.db2.gz YAFOMUGYQZFMIC-SECBINFHSA-N 1 2 247.298 2.121 20 0 BEADLO Cc1coc(C)c1C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620607859 369955294 /nfs/dbraw/zinc/95/52/94/369955294.db2.gz JHXRDBKHCFDSKS-VIFPVBQESA-N 1 2 247.298 2.121 20 0 BEADLO CC[C@H](C)CCC(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620607563 369956280 /nfs/dbraw/zinc/95/62/80/369956280.db2.gz IHZPSSYDJXRJEE-WDEREUQCSA-N 1 2 237.347 2.424 20 0 BEADLO C[C@H](NC(=O)CC(C)(C)C1CC1)c1[nH+]ccn1C ZINC000620609499 369957273 /nfs/dbraw/zinc/95/72/73/369957273.db2.gz RLGQVSHZMIZREM-JTQLQIEISA-N 1 2 249.358 2.424 20 0 BEADLO C[C@@H](NC(=O)C1=CC[C@H](C)CC1)c1[nH+]ccn1C ZINC000620611910 369957892 /nfs/dbraw/zinc/95/78/92/369957892.db2.gz OXZRZYRMRXOWMO-WDEREUQCSA-N 1 2 247.342 2.344 20 0 BEADLO C[C@@H](NC(=O)C(C)(C)C1CCC1)c1[nH+]ccn1C ZINC000620612624 369958110 /nfs/dbraw/zinc/95/81/10/369958110.db2.gz ZOAUCWBCPJAUFA-SNVBAGLBSA-N 1 2 249.358 2.424 20 0 BEADLO CCC[C@@H](C)CC(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620594311 369946722 /nfs/dbraw/zinc/94/67/22/369946722.db2.gz BXPQXERKYXPIDR-MNOVXSKESA-N 1 2 237.347 2.424 20 0 BEADLO C[C@H](NC(=O)CC(C)(C)C)c1[nH+]ccn1C ZINC000620595258 369948091 /nfs/dbraw/zinc/94/80/91/369948091.db2.gz FQEAVLKJWSRJGY-VIFPVBQESA-N 1 2 223.320 2.034 20 0 BEADLO CCCCCC(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620596362 369948196 /nfs/dbraw/zinc/94/81/96/369948196.db2.gz OAEIXHYRPYOGRF-JTQLQIEISA-N 1 2 223.320 2.178 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)NC1CCCC1 ZINC000074904707 370057384 /nfs/dbraw/zinc/05/73/84/370057384.db2.gz NHEOCPFHCDWIGB-UHFFFAOYSA-N 1 2 244.298 2.398 20 0 BEADLO C[C@H](CC(=O)N(C)C[C@H]1CC1(C)C)n1cc[nH+]c1 ZINC000621045618 370080974 /nfs/dbraw/zinc/08/09/74/370080974.db2.gz SNOWQLJHSSVJDL-VXGBXAGGSA-N 1 2 249.358 2.339 20 0 BEADLO CCC[C@H](C)NC(=O)c1ccc2[nH+]ccn2c1 ZINC000075465991 370135191 /nfs/dbraw/zinc/13/51/91/370135191.db2.gz UVNRMIKEMGKAQJ-JTQLQIEISA-N 1 2 231.299 2.253 20 0 BEADLO CCC[C@@H](C)NC(=O)c1ccc2[nH+]ccn2c1 ZINC000075465990 370135668 /nfs/dbraw/zinc/13/56/68/370135668.db2.gz UVNRMIKEMGKAQJ-SNVBAGLBSA-N 1 2 231.299 2.253 20 0 BEADLO c1[nH]cc(NCC2Cc3ccccc3C2)[nH+]1 ZINC000309669595 370242799 /nfs/dbraw/zinc/24/27/99/370242799.db2.gz JEXDQOOIVBXUOF-UHFFFAOYSA-N 1 2 213.284 2.237 20 0 BEADLO C[C@@H]1CCN(c2[nH]c3ccccc3[nH+]2)C[C@H]1CO ZINC000621347737 370282358 /nfs/dbraw/zinc/28/23/58/370282358.db2.gz KXOVISMBJMZJAJ-MNOVXSKESA-N 1 2 245.326 2.018 20 0 BEADLO CCC[C@@](C)(O)CNc1cc(CC)[nH+]cn1 ZINC000226530693 370351425 /nfs/dbraw/zinc/35/14/25/370351425.db2.gz TXXZOOLYWXZKLS-GFCCVEGCSA-N 1 2 223.320 2.002 20 0 BEADLO Cc1cc(NC(=O)N2CC(CC3CC3)C2)cc[nH+]1 ZINC000621448867 370356674 /nfs/dbraw/zinc/35/66/74/370356674.db2.gz WYUHKMYKPQIESQ-UHFFFAOYSA-N 1 2 245.326 2.076 20 0 BEADLO COC[C@@H]1C[N@H+](C/C=C\c2ccccc2)CCO1 ZINC000254950759 370370741 /nfs/dbraw/zinc/37/07/41/370370741.db2.gz VXFKXTZAKWDARV-KKTNHOPESA-N 1 2 247.338 2.047 20 0 BEADLO COC[C@@H]1C[N@@H+](C/C=C\c2ccccc2)CCO1 ZINC000254950759 370370745 /nfs/dbraw/zinc/37/07/45/370370745.db2.gz VXFKXTZAKWDARV-KKTNHOPESA-N 1 2 247.338 2.047 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)[C@@H]1CCc2[nH+]ccn2C1 ZINC000621545780 370384607 /nfs/dbraw/zinc/38/46/07/370384607.db2.gz FNHJIBGOVQESND-VXGBXAGGSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@H]([NH2+][C@H](C(F)F)C1CCCCC1)C(N)=O ZINC000621403973 370340301 /nfs/dbraw/zinc/34/03/01/370340301.db2.gz FBOPAIOJTYJIFD-UWVGGRQHSA-N 1 2 248.317 2.054 20 0 BEADLO CCn1cc[nH+]c1CN1CCNc2ccccc21 ZINC000311215980 370394663 /nfs/dbraw/zinc/39/46/63/370394663.db2.gz MOEPJWZMMGHZRK-UHFFFAOYSA-N 1 2 242.326 2.335 20 0 BEADLO CCC[C@H](C)N(C)c1cc(-n2cc[nH+]c2)ncn1 ZINC000077189591 370398629 /nfs/dbraw/zinc/39/86/29/370398629.db2.gz CAYUOPGUYCYDMD-NSHDSACASA-N 1 2 245.330 2.287 20 0 BEADLO CCn1cc[nH+]c1CNc1cccc(CCO)c1 ZINC000313160758 370570893 /nfs/dbraw/zinc/57/08/93/370570893.db2.gz LCUWQFLXXIGYBL-UHFFFAOYSA-N 1 2 245.326 2.050 20 0 BEADLO CC(C)[C@@H](C)CNC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000621878428 370576868 /nfs/dbraw/zinc/57/68/68/370576868.db2.gz NPZDVIVVVZFVDL-JTQLQIEISA-N 1 2 237.347 2.096 20 0 BEADLO C[C@@H](CCC1CC1)NC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000621956877 370619854 /nfs/dbraw/zinc/61/98/54/370619854.db2.gz AOGOBAQWYBABMI-JTQLQIEISA-N 1 2 249.358 2.382 20 0 BEADLO Cc1occc1C[NH2+]Cc1cscn1 ZINC000067217745 370644179 /nfs/dbraw/zinc/64/41/79/370644179.db2.gz MRUJCNKDBRIUJZ-UHFFFAOYSA-N 1 2 208.286 2.334 20 0 BEADLO CCC[C@H]1CN(c2nc(C)[nH+]cc2C)CCO1 ZINC000568664651 326371903 /nfs/dbraw/zinc/37/19/03/326371903.db2.gz XNQQCMGCMVVPTL-LBPRGKRZSA-N 1 2 235.331 2.099 20 0 BEADLO CCc1nc(C[NH2+]Cc2ccc[nH]c2=O)cs1 ZINC000623777272 371087426 /nfs/dbraw/zinc/08/74/26/371087426.db2.gz XQJXNJMJDZKBCE-UHFFFAOYSA-N 1 2 249.339 2.096 20 0 BEADLO COc1ccc(N[C@@H]2CC[C@@H]2SC)[nH+]c1 ZINC000389935793 371182316 /nfs/dbraw/zinc/18/23/16/371182316.db2.gz MWYWSRVHSCUFMA-ZJUUUORDSA-N 1 2 224.329 2.396 20 0 BEADLO CCc1cc(N[C@@H](C)CSC)nc[nH+]1 ZINC000124730288 371227183 /nfs/dbraw/zinc/22/71/83/371227183.db2.gz AXESLHWCHYUYSW-QMMMGPOBSA-N 1 2 211.334 2.202 20 0 BEADLO CCc1cc(NCCSCC(C)C)nc[nH+]1 ZINC000390513370 371211851 /nfs/dbraw/zinc/21/18/51/371211851.db2.gz CJTAXJTUQHMCKV-UHFFFAOYSA-N 1 2 239.388 2.262 20 0 BEADLO FCC[NH2+][C@@H]1CCCc2scnc21 ZINC000623977350 371212297 /nfs/dbraw/zinc/21/22/97/371212297.db2.gz OOOBKKIITXQLEJ-SSDOTTSWSA-N 1 2 200.282 2.080 20 0 BEADLO CCCCc1cc(NCc2cc(C)on2)nc[nH+]1 ZINC000631074199 371355511 /nfs/dbraw/zinc/35/55/11/371355511.db2.gz UPVDZHARGMCIGE-UHFFFAOYSA-N 1 2 246.314 2.150 20 0 BEADLO CCC(F)(F)C[NH2+][C@@H](C)c1c[nH]nc1C ZINC000624147698 371342793 /nfs/dbraw/zinc/34/27/93/371342793.db2.gz IOGDWNNTOUYTPC-ZETCQYMHSA-N 1 2 217.263 2.414 20 0 BEADLO COc1ccc[nH+]c1N1CC[C@]2(C1)CCCOC2 ZINC000624192507 371380367 /nfs/dbraw/zinc/38/03/67/371380367.db2.gz ZRQRSYUKHFMNSH-AWEZNQCLSA-N 1 2 248.326 2.097 20 0 BEADLO CCc1cc(N[C@]23C[C@H]2COC3(C)C)nc[nH+]1 ZINC000624517186 371526331 /nfs/dbraw/zinc/52/63/31/371526331.db2.gz HJPOYGACZXGKEY-TVQRCGJNSA-N 1 2 233.315 2.018 20 0 BEADLO CCC(CC)[C@H](C)C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627370202 371588473 /nfs/dbraw/zinc/58/84/73/371588473.db2.gz QQZBXXKDQWVGIG-JTQLQIEISA-N 1 2 249.358 2.367 20 0 BEADLO CCC(CC)[C@H](C)C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627370202 371588480 /nfs/dbraw/zinc/58/84/80/371588480.db2.gz QQZBXXKDQWVGIG-JTQLQIEISA-N 1 2 249.358 2.367 20 0 BEADLO O=C(C[C@@H]1C=CCCC1)N1CCc2[nH]c[nH+]c2C1 ZINC000627371157 371588581 /nfs/dbraw/zinc/58/85/81/371588581.db2.gz WSBHJPNUGFDQBX-LLVKDONJSA-N 1 2 245.326 2.041 20 0 BEADLO O=C(C[C@@H]1C=CCCC1)N1CCc2[nH+]c[nH]c2C1 ZINC000627371157 371588587 /nfs/dbraw/zinc/58/85/87/371588587.db2.gz WSBHJPNUGFDQBX-LLVKDONJSA-N 1 2 245.326 2.041 20 0 BEADLO C[C@H]1CCCC[C@H]1C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627373264 371591610 /nfs/dbraw/zinc/59/16/10/371591610.db2.gz MELSYANKAOYIFV-WDEREUQCSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@H]1CCCC[C@H]1C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627373264 371591613 /nfs/dbraw/zinc/59/16/13/371591613.db2.gz MELSYANKAOYIFV-WDEREUQCSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627373262 371592609 /nfs/dbraw/zinc/59/26/09/371592609.db2.gz MELSYANKAOYIFV-MNOVXSKESA-N 1 2 247.342 2.121 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627373262 371592621 /nfs/dbraw/zinc/59/26/21/371592621.db2.gz MELSYANKAOYIFV-MNOVXSKESA-N 1 2 247.342 2.121 20 0 BEADLO CCc1cc(NCCCCCOC)nc[nH+]1 ZINC000226529731 371688654 /nfs/dbraw/zinc/68/86/54/371688654.db2.gz MWUGOALHIGZRGE-UHFFFAOYSA-N 1 2 223.320 2.268 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CCC[C@H]1C1CCC1 ZINC000283969545 181835117 /nfs/dbraw/zinc/83/51/17/181835117.db2.gz MFKZQNLDAZTOLQ-YBJDMEARSA-N 1 2 245.326 2.214 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)NCC1=CCCCC1 ZINC000295954561 181835149 /nfs/dbraw/zinc/83/51/49/181835149.db2.gz GYCIQCVDVHPRTN-VOTSOKGWSA-N 1 2 231.299 2.040 20 0 BEADLO FC(F)CN1CCC(Nc2cccc[nH+]2)CC1 ZINC000057857508 371921652 /nfs/dbraw/zinc/92/16/52/371921652.db2.gz AKMNPSWHSVWEEH-UHFFFAOYSA-N 1 2 241.285 2.223 20 0 BEADLO Cc1c[nH+]c(C)c(NCc2ncnn2C(C)C)c1 ZINC000631167193 372215900 /nfs/dbraw/zinc/21/59/00/372215900.db2.gz GGUYWNDTIKDRDM-UHFFFAOYSA-N 1 2 245.330 2.483 20 0 BEADLO C[C@H](CO)N(C)c1cc2ccccc2c[nH+]1 ZINC000631180887 372219281 /nfs/dbraw/zinc/21/92/81/372219281.db2.gz WUEAUVWOXLLLDJ-SNVBAGLBSA-N 1 2 216.284 2.052 20 0 BEADLO CCCCc1cc(NCc2ncoc2C)nc[nH+]1 ZINC000631187191 372223340 /nfs/dbraw/zinc/22/33/40/372223340.db2.gz VRVMRKOHBCYPKB-UHFFFAOYSA-N 1 2 246.314 2.150 20 0 BEADLO CCN(C)C(=O)CNc1cc2ccccc2c[nH+]1 ZINC000631214676 372237058 /nfs/dbraw/zinc/23/70/58/372237058.db2.gz WNWLDQYZZCVUSP-UHFFFAOYSA-N 1 2 243.310 2.125 20 0 BEADLO c1ccc2cc(NC3COCCOC3)[nH+]cc2c1 ZINC000631280807 372275127 /nfs/dbraw/zinc/27/51/27/372275127.db2.gz WSANEHCVPYXGOH-UHFFFAOYSA-N 1 2 244.294 2.062 20 0 BEADLO CC[C@@H](Nc1cc2ccccc2c[nH+]1)C(=O)NC ZINC000631296975 372281461 /nfs/dbraw/zinc/28/14/61/372281461.db2.gz QZQVWRMKNKGVKT-GFCCVEGCSA-N 1 2 243.310 2.171 20 0 BEADLO CCCCc1cc(NCC2(COC)CC2)nc[nH+]1 ZINC000631346446 372305822 /nfs/dbraw/zinc/30/58/22/372305822.db2.gz KBKIHWAVDXAOCT-UHFFFAOYSA-N 1 2 249.358 2.080 20 0 BEADLO CCc1cc(Nc2c[nH+]cc(N(C)C)c2)ncn1 ZINC000631431630 372361081 /nfs/dbraw/zinc/36/10/81/372361081.db2.gz CGVKLJITTXEWOS-UHFFFAOYSA-N 1 2 243.314 2.244 20 0 BEADLO OC[C@H]1C[C@@H](Nc2cc3ccccc3c[nH+]2)C1 ZINC000631429659 372359040 /nfs/dbraw/zinc/35/90/40/372359040.db2.gz JQXXOWDIDRGVBG-GSJFWJNXSA-N 1 2 228.295 2.418 20 0 BEADLO O=C(CCC1CCCC1)N1CCn2c[nH+]cc2C1 ZINC000290906798 181906429 /nfs/dbraw/zinc/90/64/29/181906429.db2.gz IISKBRGBSZGECT-UHFFFAOYSA-N 1 2 247.342 2.196 20 0 BEADLO CCc1cc(N[C@@H]2CCCn3nccc32)nc[nH+]1 ZINC000631595200 372447233 /nfs/dbraw/zinc/44/72/33/372447233.db2.gz VEUYVABWPWHIMU-LLVKDONJSA-N 1 2 243.314 2.183 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2C[C@H](C)O[C@@H]2C)c(C)[nH+]1 ZINC000631743433 372544055 /nfs/dbraw/zinc/54/40/55/372544055.db2.gz UQTKDMFYNOKKTI-MVWJERBFSA-N 1 2 248.326 2.450 20 0 BEADLO Cc1ccc(C[NH2+][C@@H]2CCCn3ccnc32)o1 ZINC000631729368 372534272 /nfs/dbraw/zinc/53/42/72/372534272.db2.gz DEBHCMIBWZYQNW-GFCCVEGCSA-N 1 2 231.299 2.409 20 0 BEADLO Cc1nsc(C)c1C[N@@H+]1CCOC(C)(C)C1 ZINC000521894786 259557216 /nfs/dbraw/zinc/55/72/16/259557216.db2.gz WZPIZIIRUMSLEC-UHFFFAOYSA-N 1 2 240.372 2.371 20 0 BEADLO Cc1nsc(C)c1C[N@H+]1CCOC(C)(C)C1 ZINC000521894786 259557218 /nfs/dbraw/zinc/55/72/18/259557218.db2.gz WZPIZIIRUMSLEC-UHFFFAOYSA-N 1 2 240.372 2.371 20 0 BEADLO CC(C)c1nc(NC[C@@](C)(O)C(C)C)cc[nH+]1 ZINC000171945540 372837890 /nfs/dbraw/zinc/83/78/90/372837890.db2.gz PSSZZKRLKINIMN-CYBMUJFWSA-N 1 2 237.347 2.419 20 0 BEADLO O=C(CSc1[nH+]cc2ccccn21)C1CC1 ZINC000068044212 182011265 /nfs/dbraw/zinc/01/12/65/182011265.db2.gz ORZOENWZVQTVSQ-UHFFFAOYSA-N 1 2 232.308 2.406 20 0 BEADLO CCO[C@H]1C[C@@H]([N@H+](C)CC(F)F)C1(C)C ZINC000172665905 373036955 /nfs/dbraw/zinc/03/69/55/373036955.db2.gz RBFHVDOWPQPAAK-BDAKNGLRSA-N 1 2 221.291 2.387 20 0 BEADLO CCO[C@H]1C[C@@H]([N@@H+](C)CC(F)F)C1(C)C ZINC000172665905 373036958 /nfs/dbraw/zinc/03/69/58/373036958.db2.gz RBFHVDOWPQPAAK-BDAKNGLRSA-N 1 2 221.291 2.387 20 0 BEADLO Cc1nc(C[N@@H+]2CCOC(C)(C)C2)sc1C ZINC000173193818 373262378 /nfs/dbraw/zinc/26/23/78/373262378.db2.gz TXAIOZULAYSJCC-UHFFFAOYSA-N 1 2 240.372 2.371 20 0 BEADLO Cc1nc(C[N@H+]2CCOC(C)(C)C2)sc1C ZINC000173193818 373262382 /nfs/dbraw/zinc/26/23/82/373262382.db2.gz TXAIOZULAYSJCC-UHFFFAOYSA-N 1 2 240.372 2.371 20 0 BEADLO CC(C)C(=O)NCc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000633522527 373583040 /nfs/dbraw/zinc/58/30/40/373583040.db2.gz WWLPUQZYIOQYHN-UHFFFAOYSA-N 1 2 243.310 2.349 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2[C@H](C)[C@H]2c2ccccc2)n1 ZINC000414649553 205766937 /nfs/dbraw/zinc/76/69/37/205766937.db2.gz XAFCETDAWWPNBQ-JIMOISOXSA-N 1 2 243.310 2.306 20 0 BEADLO F[C@@]1(c2ccccc2)C[C@@H]1[NH2+]Cc1cc[nH]n1 ZINC000424194290 206034167 /nfs/dbraw/zinc/03/41/67/206034167.db2.gz LHKRUYXHNQIRRY-QWHCGFSZSA-N 1 2 231.274 2.137 20 0 BEADLO CC[C@@H](O)CCNc1cc[nH+]c(C(C)C)n1 ZINC000154683572 206065765 /nfs/dbraw/zinc/06/57/65/206065765.db2.gz AEULCYSQIUBDAT-SNVBAGLBSA-N 1 2 223.320 2.173 20 0 BEADLO CC[C@@H](F)C[NH2+][C@@H](CO)c1c(F)cccc1F ZINC000440482853 206076562 /nfs/dbraw/zinc/07/65/62/206076562.db2.gz DRUSTEDNRTVSOP-KCJUWKMLSA-N 1 2 247.260 2.336 20 0 BEADLO COCc1cc(C[NH+]2CC(C3CCC3)C2)no1 ZINC000459542033 206132805 /nfs/dbraw/zinc/13/28/05/206132805.db2.gz JLRQZHZHKGCTJB-UHFFFAOYSA-N 1 2 236.315 2.053 20 0 BEADLO COc1c(C)cc(C[NH+]2CC(OC)C2)cc1C ZINC000459579197 206134771 /nfs/dbraw/zinc/13/47/71/206134771.db2.gz JEXJWBTZODLBLI-UHFFFAOYSA-N 1 2 235.327 2.143 20 0 BEADLO COC1C[NH+](C[C@@H](C)c2cc(F)cc(F)c2)C1 ZINC000459580183 206136094 /nfs/dbraw/zinc/13/60/94/206136094.db2.gz KUYOGCYCQRNDPZ-SECBINFHSA-N 1 2 241.281 2.399 20 0 BEADLO O=C(Nc1ccccc1)[C@@H]1CCc2[nH+]ccn2C1 ZINC000377465564 182376713 /nfs/dbraw/zinc/37/67/13/182376713.db2.gz QVVRRPZWRPBWGP-LLVKDONJSA-N 1 2 241.294 2.084 20 0 BEADLO O=C(Nc1ccccc1)[C@H]1CCc2[nH+]ccn2C1 ZINC000377465565 182376959 /nfs/dbraw/zinc/37/69/59/182376959.db2.gz QVVRRPZWRPBWGP-NSHDSACASA-N 1 2 241.294 2.084 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)C1(CCF)CC1 ZINC000297746871 182385391 /nfs/dbraw/zinc/38/53/91/182385391.db2.gz LHFOKBHYWCFYNH-UHFFFAOYSA-N 1 2 247.273 2.413 20 0 BEADLO O=S1CC[NH+]([C@@H]2CCCc3ccccc32)CC1 ZINC000111223548 182917402 /nfs/dbraw/zinc/91/74/02/182917402.db2.gz YSSKELOOGBNJKP-CQSZACIVSA-N 1 2 249.379 2.128 20 0 BEADLO OCC1(Nc2cc(C(F)(F)F)cc[nH+]2)CCC1 ZINC000128396290 183040064 /nfs/dbraw/zinc/04/00/64/183040064.db2.gz PAGLCICRVNVRBO-UHFFFAOYSA-N 1 2 246.232 2.427 20 0 BEADLO OCC1CC[NH+](Cc2csc(Cl)n2)CC1 ZINC000289496706 183041106 /nfs/dbraw/zinc/04/11/06/183041106.db2.gz DCILPRSOZJNBAC-UHFFFAOYSA-N 1 2 246.763 2.001 20 0 BEADLO OCCCOc1ccc([NH2+]CC2CC2)cc1 ZINC000285502678 183061337 /nfs/dbraw/zinc/06/13/37/183061337.db2.gz NHYGOHCCOLRGHR-UHFFFAOYSA-N 1 2 221.300 2.270 20 0 BEADLO OCCCSCc1ccc(-n2cc[nH+]c2)cc1 ZINC000090107915 183063374 /nfs/dbraw/zinc/06/33/74/183063374.db2.gz NHVZICLFUYQOGX-UHFFFAOYSA-N 1 2 248.351 2.488 20 0 BEADLO OCC[N@@H+](Cc1ncc(Cl)s1)CC1CC1 ZINC000352459292 183073131 /nfs/dbraw/zinc/07/31/31/183073131.db2.gz WNGXQPZIPSRPBL-UHFFFAOYSA-N 1 2 246.763 2.001 20 0 BEADLO OCC[N@H+](Cc1ncc(Cl)s1)CC1CC1 ZINC000352459292 183073133 /nfs/dbraw/zinc/07/31/33/183073133.db2.gz WNGXQPZIPSRPBL-UHFFFAOYSA-N 1 2 246.763 2.001 20 0 BEADLO OCC[C@H](Nc1cccc[nH+]1)c1ccco1 ZINC000274464575 183096548 /nfs/dbraw/zinc/09/65/48/183096548.db2.gz YCEJQRWVIUAVQU-JTQLQIEISA-N 1 2 218.256 2.210 20 0 BEADLO OC[C@@H]1CCCN(c2[nH]c3ccccc3[nH+]2)CC1 ZINC000293978815 183119623 /nfs/dbraw/zinc/11/96/23/183119623.db2.gz IGZYETDSWWMVFX-LLVKDONJSA-N 1 2 245.326 2.162 20 0 BEADLO OC[C@@H](CC1CCCC1)Nc1cccc[nH+]1 ZINC000309605795 183104639 /nfs/dbraw/zinc/10/46/39/183104639.db2.gz XWXZFCITQCRFAT-GFCCVEGCSA-N 1 2 220.316 2.435 20 0 BEADLO OC[C@@H](CNc1cccc[nH+]1)Cc1ccccc1 ZINC000362743035 183106092 /nfs/dbraw/zinc/10/60/92/183106092.db2.gz VBXOFYNSTXSHPC-CQSZACIVSA-N 1 2 242.322 2.345 20 0 BEADLO OC[C@H](CC1CCCC1)Nc1cccc[nH+]1 ZINC000309605797 183137221 /nfs/dbraw/zinc/13/72/21/183137221.db2.gz XWXZFCITQCRFAT-LBPRGKRZSA-N 1 2 220.316 2.435 20 0 BEADLO OC[C@H](CC1CCC1)Nc1cc[nH+]c(C2CC2)n1 ZINC000280281960 183137237 /nfs/dbraw/zinc/13/72/37/183137237.db2.gz PVGVRFVOVQQJHQ-LBPRGKRZSA-N 1 2 247.342 2.317 20 0 BEADLO OC[C@H]([NH2+]Cc1nccs1)c1ccsc1 ZINC000336656886 183140840 /nfs/dbraw/zinc/14/08/40/183140840.db2.gz AOCKWVIGFBADEH-VIFPVBQESA-N 1 2 240.353 2.028 20 0 BEADLO CCCCc1nc(C[N@@H+]2CC[C@H](C)C2)no1 ZINC000336698291 169025832 /nfs/dbraw/zinc/02/58/32/169025832.db2.gz IMAUKBHXTIQIIT-JTQLQIEISA-N 1 2 223.320 2.254 20 0 BEADLO CCCCc1nc(C[N@H+]2CC[C@H](C)C2)no1 ZINC000336698291 169025834 /nfs/dbraw/zinc/02/58/34/169025834.db2.gz IMAUKBHXTIQIIT-JTQLQIEISA-N 1 2 223.320 2.254 20 0 BEADLO OC[C@H]1CCCN(c2[nH]c3ccccc3[nH+]2)CC1 ZINC000293978817 183149871 /nfs/dbraw/zinc/14/98/71/183149871.db2.gz IGZYETDSWWMVFX-NSHDSACASA-N 1 2 245.326 2.162 20 0 BEADLO OC[C@H]1CCC[N@@H+]1Cc1cc(F)c(F)cc1F ZINC000092471067 183151328 /nfs/dbraw/zinc/15/13/28/183151328.db2.gz XBJGCCJGRYIPCL-SECBINFHSA-N 1 2 245.244 2.061 20 0 BEADLO OC[C@H]1CCC[N@H+]1Cc1cc(F)c(F)cc1F ZINC000092471067 183151330 /nfs/dbraw/zinc/15/13/30/183151330.db2.gz XBJGCCJGRYIPCL-SECBINFHSA-N 1 2 245.244 2.061 20 0 BEADLO OC[C@]1(F)CC[N@H+](Cc2cc(Cl)cs2)C1 ZINC000334508964 183158874 /nfs/dbraw/zinc/15/88/74/183158874.db2.gz NFGHWASQLFOFAX-JTQLQIEISA-N 1 2 249.738 2.308 20 0 BEADLO OC[C@]1(F)CC[N@@H+](Cc2cc(Cl)cs2)C1 ZINC000334508964 183158877 /nfs/dbraw/zinc/15/88/77/183158877.db2.gz NFGHWASQLFOFAX-JTQLQIEISA-N 1 2 249.738 2.308 20 0 BEADLO OCc1ccc(NCCC2CCCCC2)[nH+]c1 ZINC000340580385 183162502 /nfs/dbraw/zinc/16/25/02/183162502.db2.gz QBPDMPPPSGEWNS-UHFFFAOYSA-N 1 2 234.343 2.378 20 0 BEADLO OCc1ccc(NCC2CCCCCC2)[nH+]c1 ZINC000356302020 183163005 /nfs/dbraw/zinc/16/30/05/183163005.db2.gz MOYHTZWPMNAGLV-UHFFFAOYSA-N 1 2 234.343 2.378 20 0 BEADLO CCC[N@H+](C)Cc1nc([C@@H](C)OCC)no1 ZINC000120561850 169079773 /nfs/dbraw/zinc/07/97/73/169079773.db2.gz LHODBFSGDBKYNI-SECBINFHSA-N 1 2 227.308 2.009 20 0 BEADLO CCC[N@@H+](C)Cc1nc([C@@H](C)OCC)no1 ZINC000120561850 169079778 /nfs/dbraw/zinc/07/97/78/169079778.db2.gz LHODBFSGDBKYNI-SECBINFHSA-N 1 2 227.308 2.009 20 0 BEADLO CCC[N@H+](C)Cc1c(Cl)ncnc1N(C)C ZINC000283558082 169079787 /nfs/dbraw/zinc/07/97/87/169079787.db2.gz NRXRQITZSMJEMT-UHFFFAOYSA-N 1 2 242.754 2.038 20 0 BEADLO CCC[N@@H+](C)Cc1c(Cl)ncnc1N(C)C ZINC000283558082 169079790 /nfs/dbraw/zinc/07/97/90/169079790.db2.gz NRXRQITZSMJEMT-UHFFFAOYSA-N 1 2 242.754 2.038 20 0 BEADLO CCC[N@H+](C)Cc1ncn(-c2ccccc2)n1 ZINC000092795109 169083408 /nfs/dbraw/zinc/08/34/08/169083408.db2.gz YFDWYVXKUJNFPF-UHFFFAOYSA-N 1 2 230.315 2.109 20 0 BEADLO CCC[N@@H+](C)Cc1ncn(-c2ccccc2)n1 ZINC000092795109 169083409 /nfs/dbraw/zinc/08/34/09/169083409.db2.gz YFDWYVXKUJNFPF-UHFFFAOYSA-N 1 2 230.315 2.109 20 0 BEADLO Cl/C=C(/Cl)C[N@@H+]1CCn2nccc2C1 ZINC001643955792 1172515064 /nfs/dbraw/zinc/51/50/64/1172515064.db2.gz MYYOJZQTKLBULS-VMPITWQZSA-N 1 2 232.114 2.018 20 0 BEADLO Cl/C=C(/Cl)C[N@H+]1CCn2nccc2C1 ZINC001643955792 1172515070 /nfs/dbraw/zinc/51/50/70/1172515070.db2.gz MYYOJZQTKLBULS-VMPITWQZSA-N 1 2 232.114 2.018 20 0 BEADLO CCC[N@H+](CC(=O)OC)Cc1csc(C)c1 ZINC000294522452 169101856 /nfs/dbraw/zinc/10/18/56/169101856.db2.gz FWNAEUORXPOJST-UHFFFAOYSA-N 1 2 241.356 2.442 20 0 BEADLO CCC[N@@H+](CC(=O)OC)Cc1csc(C)c1 ZINC000294522452 169101857 /nfs/dbraw/zinc/10/18/57/169101857.db2.gz FWNAEUORXPOJST-UHFFFAOYSA-N 1 2 241.356 2.442 20 0 BEADLO CCCN(CC(C)C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000283613786 169104525 /nfs/dbraw/zinc/10/45/25/169104525.db2.gz ZQPVAOCLBGWPRZ-AATRIKPKSA-N 1 2 235.331 2.318 20 0 BEADLO Oc1ccc(CCNc2cccc[nH+]2)cc1 ZINC000042372243 183269757 /nfs/dbraw/zinc/26/97/57/183269757.db2.gz MGFZCVIMTBGFSA-UHFFFAOYSA-N 1 2 214.268 2.442 20 0 BEADLO c1c[nH]c(C[NH2+][C@@H]2CCCc3occc32)n1 ZINC000049714779 183325656 /nfs/dbraw/zinc/32/56/56/183325656.db2.gz BKSDOAFDPAVMQY-SNVBAGLBSA-N 1 2 217.272 2.170 20 0 BEADLO CCCNC(=O)C[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000361053958 169223925 /nfs/dbraw/zinc/22/39/25/169223925.db2.gz ARLADXXFQKLVEL-NSHDSACASA-N 1 2 232.327 2.089 20 0 BEADLO CCCNC(=O)C[N@H+]1Cc2ccccc2[C@@H]1C ZINC000361053958 169223926 /nfs/dbraw/zinc/22/39/26/169223926.db2.gz ARLADXXFQKLVEL-NSHDSACASA-N 1 2 232.327 2.089 20 0 BEADLO c1cc(C[N@H+]2CCC[C@@H](OCC3CC3)C2)no1 ZINC000368412524 183343239 /nfs/dbraw/zinc/34/32/39/183343239.db2.gz SDRWWNXLIJJAKO-CYBMUJFWSA-N 1 2 236.315 2.066 20 0 BEADLO c1cc(C[N@@H+]2CCC[C@@H](OCC3CC3)C2)no1 ZINC000368412524 183343240 /nfs/dbraw/zinc/34/32/40/183343240.db2.gz SDRWWNXLIJJAKO-CYBMUJFWSA-N 1 2 236.315 2.066 20 0 BEADLO c1cc(C[N@H+]2CCOC[C@H]2CC2CCC2)no1 ZINC000339775353 183344103 /nfs/dbraw/zinc/34/41/03/183344103.db2.gz DFAZTEQXXZWUPX-CYBMUJFWSA-N 1 2 236.315 2.066 20 0 BEADLO c1cc(C[N@@H+]2CCOC[C@H]2CC2CCC2)no1 ZINC000339775353 183344105 /nfs/dbraw/zinc/34/41/05/183344105.db2.gz DFAZTEQXXZWUPX-CYBMUJFWSA-N 1 2 236.315 2.066 20 0 BEADLO c1cc(C[N@@H+]2CCc3sccc3C2)n[nH]1 ZINC000124303664 183346183 /nfs/dbraw/zinc/34/61/83/183346183.db2.gz WCBFZXLDPCKLFQ-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO c1cc(C[N@H+]2CCc3sccc3C2)n[nH]1 ZINC000124303664 183346185 /nfs/dbraw/zinc/34/61/85/183346185.db2.gz WCBFZXLDPCKLFQ-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO c1cc(NC[C@@H]2CCCCO2)nc(C2CC2)[nH+]1 ZINC000264736030 183356997 /nfs/dbraw/zinc/35/69/97/183356997.db2.gz YBPIVMLZMLKGMP-NSHDSACASA-N 1 2 233.315 2.335 20 0 BEADLO c1nnc(-c2cccc(NCc3c[nH+]c[nH]3)c2)o1 ZINC000054763782 183357180 /nfs/dbraw/zinc/35/71/80/183357180.db2.gz ALHUIWHSTXTOGP-UHFFFAOYSA-N 1 2 241.254 2.072 20 0 BEADLO c1nnc(-c2cccc(NCc3c[nH]c[nH+]3)c2)o1 ZINC000054763782 183357182 /nfs/dbraw/zinc/35/71/82/183357182.db2.gz ALHUIWHSTXTOGP-UHFFFAOYSA-N 1 2 241.254 2.072 20 0 BEADLO c1cc(NC[C@H]2CCCOC2)nc(C2CC2)[nH+]1 ZINC000264705169 183357828 /nfs/dbraw/zinc/35/78/28/183357828.db2.gz REAXNCKCPPFRGX-SNVBAGLBSA-N 1 2 233.315 2.193 20 0 BEADLO c1cn(-c2ncncc2-c2ccccc2)c[nH+]1 ZINC000340847987 183380678 /nfs/dbraw/zinc/38/06/78/183380678.db2.gz NZMCRDSUAIDHMW-UHFFFAOYSA-N 1 2 222.251 2.329 20 0 BEADLO c1cn(Cc2nnc(-c3ccccc3)s2)c[nH+]1 ZINC000125909906 183383195 /nfs/dbraw/zinc/38/31/95/183383195.db2.gz WEOKPQJFVITOMD-UHFFFAOYSA-N 1 2 242.307 2.450 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@H+](C)Cc1ccc(C)o1 ZINC000158357984 169298900 /nfs/dbraw/zinc/29/89/00/169298900.db2.gz NDCRENVHQZUJSD-LLVKDONJSA-N 1 2 239.315 2.362 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(C)o1 ZINC000158357984 169298902 /nfs/dbraw/zinc/29/89/02/169298902.db2.gz NDCRENVHQZUJSD-LLVKDONJSA-N 1 2 239.315 2.362 20 0 BEADLO CCCOC(=O)[C@H](C)[N@H+](C)Cc1occc1C ZINC000292060146 169299329 /nfs/dbraw/zinc/29/93/29/169299329.db2.gz BOHFPNKZDDMRBQ-NSHDSACASA-N 1 2 239.315 2.362 20 0 BEADLO CCCOC(=O)[C@H](C)[N@@H+](C)Cc1occc1C ZINC000292060146 169299331 /nfs/dbraw/zinc/29/93/31/169299331.db2.gz BOHFPNKZDDMRBQ-NSHDSACASA-N 1 2 239.315 2.362 20 0 BEADLO CCCNc1ccc(-n2cc[nH+]c2)nc1 ZINC000037040729 169294240 /nfs/dbraw/zinc/29/42/40/169294240.db2.gz CNSMRHVXDPNLER-UHFFFAOYSA-N 1 2 202.261 2.089 20 0 BEADLO CCC[C@@H](C)C[N@@H+]1CC(F)(F)C[C@@H]1CO ZINC000372638882 169358128 /nfs/dbraw/zinc/35/81/28/169358128.db2.gz KRENLXVXSYBUCV-NXEZZACHSA-N 1 2 221.291 2.125 20 0 BEADLO CCC[C@@H](C)C[N@H+]1CC(F)(F)C[C@@H]1CO ZINC000372638882 169358129 /nfs/dbraw/zinc/35/81/29/169358129.db2.gz KRENLXVXSYBUCV-NXEZZACHSA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)c1noc(C[N@H+](C)[C@H]2CCSC2)n1 ZINC000179263908 134319651 /nfs/dbraw/zinc/31/96/51/134319651.db2.gz YTXIAPKBHSTUQT-VIFPVBQESA-N 1 2 241.360 2.130 20 0 BEADLO CC(C)c1noc(C[N@@H+](C)[C@H]2CCSC2)n1 ZINC000179263908 134319652 /nfs/dbraw/zinc/31/96/52/134319652.db2.gz YTXIAPKBHSTUQT-VIFPVBQESA-N 1 2 241.360 2.130 20 0 BEADLO CS[C@@H]1CCCC[N@H+](Cc2csnn2)C1 ZINC000180754521 134331170 /nfs/dbraw/zinc/33/11/70/134331170.db2.gz YJKNBDPKMVBGJX-SNVBAGLBSA-N 1 2 243.401 2.256 20 0 BEADLO CS[C@@H]1CCCC[N@@H+](Cc2csnn2)C1 ZINC000180754521 134331171 /nfs/dbraw/zinc/33/11/71/134331171.db2.gz YJKNBDPKMVBGJX-SNVBAGLBSA-N 1 2 243.401 2.256 20 0 BEADLO CCc1cn(Cc2ccc3nonc3c2)c[nH+]1 ZINC001644227069 1172533793 /nfs/dbraw/zinc/53/37/93/1172533793.db2.gz BRQHKFGWULDXQN-UHFFFAOYSA-N 1 2 228.255 2.030 20 0 BEADLO CCc1cn(C[C@H]2CC3(CCC3)CO2)c[nH+]1 ZINC001644227332 1172533927 /nfs/dbraw/zinc/53/39/27/1172533927.db2.gz KAGNDKREUADEFQ-GFCCVEGCSA-N 1 2 220.316 2.405 20 0 BEADLO CCc1cn(Cc2ccc3nccnc3c2)c[nH+]1 ZINC001644227301 1172534662 /nfs/dbraw/zinc/53/46/62/1172534662.db2.gz JPIAQVDWICBILR-UHFFFAOYSA-N 1 2 238.294 2.437 20 0 BEADLO Cn1cc[nH+]c1CN1CCc2ccc(F)cc21 ZINC000195515425 259607698 /nfs/dbraw/zinc/60/76/98/259607698.db2.gz GFTONDUMKIRBGT-UHFFFAOYSA-N 1 2 231.274 2.122 20 0 BEADLO O=c1[nH]cc(Cn2cc[nH+]c2)c2ccccc12 ZINC001644813893 1172613399 /nfs/dbraw/zinc/61/33/99/1172613399.db2.gz XPCFRVMCEDJHBO-UHFFFAOYSA-N 1 2 225.251 2.185 20 0 BEADLO C[C@@H](O)CC[N@H+](C)C/C(Cl)=C/Cl ZINC000131728763 383845915 /nfs/dbraw/zinc/84/59/15/383845915.db2.gz CENLFNQQJBZCGO-BESBCXERSA-N 1 2 212.120 2.008 20 0 BEADLO C[C@@H](O)CC[N@@H+](C)C/C(Cl)=C/Cl ZINC000131728763 383845916 /nfs/dbraw/zinc/84/59/16/383845916.db2.gz CENLFNQQJBZCGO-BESBCXERSA-N 1 2 212.120 2.008 20 0 BEADLO c1cc(C[NH2+][C@H]2CCOc3ccccc32)n[nH]1 ZINC000037074415 383934154 /nfs/dbraw/zinc/93/41/54/383934154.db2.gz YVIYWWZIIAUFRK-LBPRGKRZSA-N 1 2 229.283 2.023 20 0 BEADLO CSC[C@@H](C)C(=O)Nc1cc[nH+]c(C)c1 ZINC000066927305 383903583 /nfs/dbraw/zinc/90/35/83/383903583.db2.gz IXHGATPUDKOHHR-MRVPVSSYSA-N 1 2 224.329 2.328 20 0 BEADLO c1cnn(-c2ccc([NH2+]CC3CC3)cc2)n1 ZINC000037128373 383940548 /nfs/dbraw/zinc/94/05/48/383940548.db2.gz NCNNQQQWJJDLCW-UHFFFAOYSA-N 1 2 214.272 2.089 20 0 BEADLO C[C@H]([NH2+]Cc1nccs1)c1nccs1 ZINC000070650438 383952736 /nfs/dbraw/zinc/95/27/36/383952736.db2.gz FOCQVHCMPXBZON-ZETCQYMHSA-N 1 2 225.342 2.450 20 0 BEADLO C[NH2+]Cc1noc(C[C@H]2CCCC[C@@H]2C)n1 ZINC000518490580 383955683 /nfs/dbraw/zinc/95/56/83/383955683.db2.gz JEJKWYKHCBLHLY-VHSXEESVSA-N 1 2 223.320 2.158 20 0 BEADLO CC[C@H]1CCCC[C@@H]1C[NH2+]Cc1c[nH]nn1 ZINC000401762715 383957743 /nfs/dbraw/zinc/95/77/43/383957743.db2.gz SPXBMEJJQIBSAI-WDEREUQCSA-N 1 2 222.336 2.111 20 0 BEADLO CC[C@H]1CCCC[C@@H]1C[NH2+]Cc1cn[nH]n1 ZINC000401762715 383957747 /nfs/dbraw/zinc/95/77/47/383957747.db2.gz SPXBMEJJQIBSAI-WDEREUQCSA-N 1 2 222.336 2.111 20 0 BEADLO FC1(F)CC[N@H+](CC[C@H]2CCCCO2)C1 ZINC000336500311 384016755 /nfs/dbraw/zinc/01/67/55/384016755.db2.gz GHNMICYCJMFTFJ-SNVBAGLBSA-N 1 2 219.275 2.287 20 0 BEADLO FC1(F)CC[N@@H+](CC[C@H]2CCCCO2)C1 ZINC000336500311 384016759 /nfs/dbraw/zinc/01/67/59/384016759.db2.gz GHNMICYCJMFTFJ-SNVBAGLBSA-N 1 2 219.275 2.287 20 0 BEADLO CCOc1cccc(NCc2c[nH+]cn2C)c1 ZINC000090167029 384030858 /nfs/dbraw/zinc/03/08/58/384030858.db2.gz WLCFJWXDLWPPGJ-UHFFFAOYSA-N 1 2 231.299 2.431 20 0 BEADLO CC(C)(C)CCCC(=O)NCc1[nH]cc[nH+]1 ZINC000114336875 384032828 /nfs/dbraw/zinc/03/28/28/384032828.db2.gz PEULRIPSCFMHFE-UHFFFAOYSA-N 1 2 223.320 2.242 20 0 BEADLO CCc1oc(C[NH+]2CC3(CC3)C2)cc1C(=O)OC ZINC000449371787 384037920 /nfs/dbraw/zinc/03/79/20/384037920.db2.gz YTTWVTJITOLSAK-UHFFFAOYSA-N 1 2 249.310 2.224 20 0 BEADLO CO[C@@H]1C[C@H](Nc2cc[nH+]c(C)n2)C1(C)C ZINC000227822090 134389255 /nfs/dbraw/zinc/38/92/55/134389255.db2.gz XCCHEVWFOSUXCP-VHSXEESVSA-N 1 2 221.304 2.010 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2nonc2C)o1 ZINC000069794921 384064153 /nfs/dbraw/zinc/06/41/53/384064153.db2.gz BZPAISOBPWUUNH-VIFPVBQESA-N 1 2 221.260 2.130 20 0 BEADLO C[C@@H](CC(=O)NCC1(C)CCC1)n1cc[nH+]c1 ZINC000569461093 384071751 /nfs/dbraw/zinc/07/17/51/384071751.db2.gz MLNOKQIYVIOLKE-NSHDSACASA-N 1 2 235.331 2.141 20 0 BEADLO Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1Cc1ccon1 ZINC000091081169 384099143 /nfs/dbraw/zinc/09/91/43/384099143.db2.gz XNDUSSRXJQRVMW-GFCCVEGCSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1Cc1ccon1 ZINC000091081169 384099146 /nfs/dbraw/zinc/09/91/46/384099146.db2.gz XNDUSSRXJQRVMW-GFCCVEGCSA-N 1 2 246.314 2.352 20 0 BEADLO COC(=O)[C@@H]([NH2+][C@@H](C)c1ccccc1)C1CC1 ZINC000115991187 384111032 /nfs/dbraw/zinc/11/10/32/384111032.db2.gz KEQVOAWPFMVSML-GWCFXTLKSA-N 1 2 233.311 2.289 20 0 BEADLO COC(=O)[C@H]([NH2+][C@H](C)c1ccccc1)C1CC1 ZINC000115996473 384111193 /nfs/dbraw/zinc/11/11/93/384111193.db2.gz KEQVOAWPFMVSML-ZWNOBZJWSA-N 1 2 233.311 2.289 20 0 BEADLO CC(C)[C@H]1CCCCC[N@@H+]1Cc1nc[nH]n1 ZINC001645054321 1172632614 /nfs/dbraw/zinc/63/26/14/1172632614.db2.gz IRIMRDKUGZNCJM-LLVKDONJSA-N 1 2 222.336 2.205 20 0 BEADLO CC(C)[C@H]1CCCCC[N@H+]1Cc1nc[nH]n1 ZINC001645054321 1172632617 /nfs/dbraw/zinc/63/26/17/1172632617.db2.gz IRIMRDKUGZNCJM-LLVKDONJSA-N 1 2 222.336 2.205 20 0 BEADLO CC1(C)C(C(=O)Nc2ccc(N)[nH+]c2)C1(C)C ZINC000091492689 384130670 /nfs/dbraw/zinc/13/06/70/384130670.db2.gz HDJCXCHEZPZEQA-UHFFFAOYSA-N 1 2 233.315 2.285 20 0 BEADLO CC[C@H](Cc1ccccc1)[NH2+][C@@H](C)C(=O)OC ZINC000116384502 384132075 /nfs/dbraw/zinc/13/20/75/384132075.db2.gz HTEJEKCFBZISRP-WCQYABFASA-N 1 2 235.327 2.159 20 0 BEADLO CC[C@H](NC(=O)C[C@@H]1C=CCC1)c1[nH]cc[nH+]1 ZINC000140607269 384156221 /nfs/dbraw/zinc/15/62/21/384156221.db2.gz FPRSVQIYHZSSRG-MNOVXSKESA-N 1 2 233.315 2.333 20 0 BEADLO CCC1(CNc2cc(C)[nH+]cn2)CCOCC1 ZINC000310454152 384174315 /nfs/dbraw/zinc/17/43/15/384174315.db2.gz WIODEXURJUHLFH-UHFFFAOYSA-N 1 2 235.331 2.404 20 0 BEADLO CC[C@H]1CC[C@H]1[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000309620892 384164877 /nfs/dbraw/zinc/16/48/77/384164877.db2.gz DFUSKTLBWFSTHX-OUAUKWLOSA-N 1 2 227.348 2.495 20 0 BEADLO CCN(CC)CC[NH2+][C@@H](C)c1ccc(F)cn1 ZINC000092195079 384167460 /nfs/dbraw/zinc/16/74/60/384167460.db2.gz VUCAPDKEVQDQHK-NSHDSACASA-N 1 2 239.338 2.213 20 0 BEADLO c1csc([C@@H]2CN(Cc3c[nH+]c[nH]3)CCO2)c1 ZINC000092594010 384185158 /nfs/dbraw/zinc/18/51/58/384185158.db2.gz PXDXLBPXTQMTIC-NSHDSACASA-N 1 2 249.339 2.045 20 0 BEADLO c1csc([C@@H]2CN(Cc3c[nH]c[nH+]3)CCO2)c1 ZINC000092594010 384185160 /nfs/dbraw/zinc/18/51/60/384185160.db2.gz PXDXLBPXTQMTIC-NSHDSACASA-N 1 2 249.339 2.045 20 0 BEADLO CCC[N@H+](CCC(F)(F)F)CC(=O)OCC ZINC000080947055 384178038 /nfs/dbraw/zinc/17/80/38/384178038.db2.gz XXVHBCTVPJYQNE-UHFFFAOYSA-N 1 2 241.253 2.214 20 0 BEADLO CCC[N@@H+](CCC(F)(F)F)CC(=O)OCC ZINC000080947055 384178042 /nfs/dbraw/zinc/17/80/42/384178042.db2.gz XXVHBCTVPJYQNE-UHFFFAOYSA-N 1 2 241.253 2.214 20 0 BEADLO Cc1cc(NC(=O)N2C[C@H](C)C[C@@H]2C)cc[nH+]1 ZINC000336587491 384183605 /nfs/dbraw/zinc/18/36/05/384183605.db2.gz DMDDUPVAEPQSNY-KOLCDFICSA-N 1 2 233.315 2.074 20 0 BEADLO Cc1cc(NC(=O)N2C[C@@H](C)C[C@H]2C)cc[nH+]1 ZINC000336587490 384183766 /nfs/dbraw/zinc/18/37/66/384183766.db2.gz DMDDUPVAEPQSNY-GXSJLCMTSA-N 1 2 233.315 2.074 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2cc[nH]n2)cc1C ZINC000092787166 384192932 /nfs/dbraw/zinc/19/29/32/384192932.db2.gz GRDNSFYOFDEBSD-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2cc[nH]n2)cc1C ZINC000092787166 384192938 /nfs/dbraw/zinc/19/29/38/384192938.db2.gz GRDNSFYOFDEBSD-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO CC[NH+](CC)Cc1ncn(-c2ccccc2)n1 ZINC000092793270 384194200 /nfs/dbraw/zinc/19/42/00/384194200.db2.gz ONEQQJQTMWABBJ-UHFFFAOYSA-N 1 2 230.315 2.109 20 0 BEADLO CCCC[N@H+](C)Cc1ncn(-c2ccccc2)n1 ZINC000092792615 384194660 /nfs/dbraw/zinc/19/46/60/384194660.db2.gz DIRNKSYYMQXCJH-UHFFFAOYSA-N 1 2 244.342 2.499 20 0 BEADLO CCCC[N@@H+](C)Cc1ncn(-c2ccccc2)n1 ZINC000092792615 384194666 /nfs/dbraw/zinc/19/46/66/384194666.db2.gz DIRNKSYYMQXCJH-UHFFFAOYSA-N 1 2 244.342 2.499 20 0 BEADLO CO[C@@H]1CCCC[C@@H]1Nc1cc[nH+]c(C(C)C)n1 ZINC000361137794 384230400 /nfs/dbraw/zinc/23/04/00/384230400.db2.gz AZCCOXOIMBWVJY-NWDGAFQWSA-N 1 2 249.358 2.391 20 0 BEADLO CCC(C)(C)OCCNc1nc(C)[nH+]cc1C ZINC000564471097 384235468 /nfs/dbraw/zinc/23/54/68/384235468.db2.gz UEACADVECMXSJI-UHFFFAOYSA-N 1 2 237.347 2.132 20 0 BEADLO CC[C@H](C)C[NH2+]c1ccc2c(c1)N(C)C(=O)CO2 ZINC000158258728 384215534 /nfs/dbraw/zinc/21/55/34/384215534.db2.gz JEBWYPRISTVJIW-JTQLQIEISA-N 1 2 248.326 2.500 20 0 BEADLO CC[C@H]([NH2+]Cc1ccoc1)c1nccn1C ZINC000132116046 384218112 /nfs/dbraw/zinc/21/81/12/384218112.db2.gz SAYHMCSICLVNLL-NSHDSACASA-N 1 2 219.288 2.254 20 0 BEADLO Cc1ccc([C@H]2COCC[N@@H+]2CCCF)o1 ZINC000132309824 384226044 /nfs/dbraw/zinc/22/60/44/384226044.db2.gz UQOMDLHWQFRKHX-LLVKDONJSA-N 1 2 227.279 2.321 20 0 BEADLO Cc1ccc([C@H]2COCC[N@H+]2CCCF)o1 ZINC000132309824 384226049 /nfs/dbraw/zinc/22/60/49/384226049.db2.gz UQOMDLHWQFRKHX-LLVKDONJSA-N 1 2 227.279 2.321 20 0 BEADLO CSCC[C@@H](C)[N@H+](C)Cc1cn[nH]c1C ZINC000093558999 384251829 /nfs/dbraw/zinc/25/18/29/384251829.db2.gz ZEDLHGMXCNVFFH-SECBINFHSA-N 1 2 227.377 2.292 20 0 BEADLO CSCC[C@@H](C)[N@@H+](C)Cc1cn[nH]c1C ZINC000093558999 384251835 /nfs/dbraw/zinc/25/18/35/384251835.db2.gz ZEDLHGMXCNVFFH-SECBINFHSA-N 1 2 227.377 2.292 20 0 BEADLO CN(C)c1cccc(C[N@H+](C)Cc2cnc[nH]2)c1 ZINC000093845684 384277842 /nfs/dbraw/zinc/27/78/42/384277842.db2.gz ZVPPHQOJCBKPBX-UHFFFAOYSA-N 1 2 244.342 2.108 20 0 BEADLO CN(C)c1cccc(C[N@@H+](C)Cc2cnc[nH]2)c1 ZINC000093845684 384277847 /nfs/dbraw/zinc/27/78/47/384277847.db2.gz ZVPPHQOJCBKPBX-UHFFFAOYSA-N 1 2 244.342 2.108 20 0 BEADLO Cc1ccc(C[N@@H+](C)[C@@H](C)C(=O)OC(C)C)o1 ZINC000093772990 384267332 /nfs/dbraw/zinc/26/73/32/384267332.db2.gz ZBECKAWKRSDVJN-NSHDSACASA-N 1 2 239.315 2.360 20 0 BEADLO Cc1ccc(C[N@H+](C)[C@@H](C)C(=O)OC(C)C)o1 ZINC000093772990 384267340 /nfs/dbraw/zinc/26/73/40/384267340.db2.gz ZBECKAWKRSDVJN-NSHDSACASA-N 1 2 239.315 2.360 20 0 BEADLO Cc1[nH]ncc1C[NH2+]Cc1ccsc1C ZINC000294045225 384267520 /nfs/dbraw/zinc/26/75/20/384267520.db2.gz IZKHLSOHALAMLK-UHFFFAOYSA-N 1 2 221.329 2.378 20 0 BEADLO CCCC[C@H](C)N(C)C(=O)CCc1c[nH+]c[nH]1 ZINC000291328336 384304958 /nfs/dbraw/zinc/30/49/58/384304958.db2.gz RURUTFYNPOWVPP-NSHDSACASA-N 1 2 237.347 2.379 20 0 BEADLO CCCC[C@H](C)N(C)C(=O)CCc1c[nH]c[nH+]1 ZINC000291328336 384304968 /nfs/dbraw/zinc/30/49/68/384304968.db2.gz RURUTFYNPOWVPP-NSHDSACASA-N 1 2 237.347 2.379 20 0 BEADLO C[C@@H](NC(=O)CCc1ccsc1)c1[nH]cc[nH+]1 ZINC000560700548 384308856 /nfs/dbraw/zinc/30/88/56/384308856.db2.gz SBXIBUQFROASSR-SECBINFHSA-N 1 2 249.339 2.281 20 0 BEADLO C[C@H]1C[C@@H](Nc2ccc3ccccc3[nH+]2)CO1 ZINC000335436825 384278698 /nfs/dbraw/zinc/27/86/98/384278698.db2.gz CVNXSPYNAOMRPO-CMPLNLGQSA-N 1 2 228.295 2.246 20 0 BEADLO COC(=O)C1([N@H+](C)C/C=C/Cl)CCCC1 ZINC000159326057 384321461 /nfs/dbraw/zinc/32/14/61/384321461.db2.gz BGTMBSPQNPSEIY-VMPITWQZSA-N 1 2 231.723 2.157 20 0 BEADLO COC(=O)C1([N@@H+](C)C/C=C/Cl)CCCC1 ZINC000159326057 384321466 /nfs/dbraw/zinc/32/14/66/384321466.db2.gz BGTMBSPQNPSEIY-VMPITWQZSA-N 1 2 231.723 2.157 20 0 BEADLO COC(=O)C[N@@H+]1CC[C@H](C)C[C@H]1c1ccco1 ZINC000076184564 384362176 /nfs/dbraw/zinc/36/21/76/384362176.db2.gz BLTBRMOBDYAQMW-QWRGUYRKSA-N 1 2 237.299 2.226 20 0 BEADLO COC(=O)C[N@H+]1CC[C@H](C)C[C@H]1c1ccco1 ZINC000076184564 384362180 /nfs/dbraw/zinc/36/21/80/384362180.db2.gz BLTBRMOBDYAQMW-QWRGUYRKSA-N 1 2 237.299 2.226 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)OC(C)(C)C ZINC000134549227 384365409 /nfs/dbraw/zinc/36/54/09/384365409.db2.gz AJMYMGHXWIRGRA-UHFFFAOYSA-N 1 2 239.319 2.140 20 0 BEADLO C[C@H]1C[C@H](CO)CN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000335571260 384333534 /nfs/dbraw/zinc/33/35/34/384333534.db2.gz ZBQDPLXWWWRZKP-QWRGUYRKSA-N 1 2 245.326 2.018 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2cncc(C)c2)s1 ZINC000276004349 384426501 /nfs/dbraw/zinc/42/65/01/384426501.db2.gz IKFKQJSLNGDYCD-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO Cc1ccsc1CN1CCn2cc[nH+]c2C1 ZINC000334218552 384409662 /nfs/dbraw/zinc/40/96/62/384409662.db2.gz IKMSHBBYOPUEOS-UHFFFAOYSA-N 1 2 233.340 2.269 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC1CCCC1 ZINC000121351936 384413422 /nfs/dbraw/zinc/41/34/22/384413422.db2.gz OZYQWQDRESYZMN-UHFFFAOYSA-N 1 2 219.288 2.454 20 0 BEADLO CCCc1ccc(C(=O)NCc2c[nH+]c[nH]2)cc1 ZINC000359702315 384416462 /nfs/dbraw/zinc/41/64/62/384416462.db2.gz YENLVPQEQDPASF-UHFFFAOYSA-N 1 2 243.310 2.292 20 0 BEADLO CCCc1ccc(C(=O)NCc2c[nH]c[nH+]2)cc1 ZINC000359702315 384416464 /nfs/dbraw/zinc/41/64/64/384416464.db2.gz YENLVPQEQDPASF-UHFFFAOYSA-N 1 2 243.310 2.292 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N(C)C[C@H]1CCCO1 ZINC000121445306 384417347 /nfs/dbraw/zinc/41/73/47/384417347.db2.gz UIKNMRHAABYNAG-LLVKDONJSA-N 1 2 249.314 2.033 20 0 BEADLO FC(F)(F)c1cc(C[N@@H+]2CC[C@H]2C2CC2)[nH]n1 ZINC000449430085 384390734 /nfs/dbraw/zinc/39/07/34/384390734.db2.gz WDRRPKKYUSQHSP-VIFPVBQESA-N 1 2 245.248 2.413 20 0 BEADLO FC(F)(F)c1cc(C[N@H+]2CC[C@H]2C2CC2)[nH]n1 ZINC000449430085 384390743 /nfs/dbraw/zinc/39/07/43/384390743.db2.gz WDRRPKKYUSQHSP-VIFPVBQESA-N 1 2 245.248 2.413 20 0 BEADLO C[C@@H](O)CCNc1cc(C(F)(F)F)cc[nH+]1 ZINC000078612494 384451568 /nfs/dbraw/zinc/45/15/68/384451568.db2.gz JYWKQWNHMZTOPW-SSDOTTSWSA-N 1 2 234.221 2.283 20 0 BEADLO CC(C)(C)C[C@H]1CCN(C(=O)Cn2cc[nH+]c2)C1 ZINC000556693515 384453417 /nfs/dbraw/zinc/45/34/17/384453417.db2.gz NJLBDSWHBUBQES-GFCCVEGCSA-N 1 2 249.358 2.168 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC[C@@]2(C)[C@@H](C1)C2(F)F ZINC000292841130 384432491 /nfs/dbraw/zinc/43/24/91/384432491.db2.gz SEAZCFSQTYRXDM-MNOVXSKESA-N 1 2 241.285 2.195 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC[C@@]2(C)[C@@H](C1)C2(F)F ZINC000292841130 384432494 /nfs/dbraw/zinc/43/24/94/384432494.db2.gz SEAZCFSQTYRXDM-MNOVXSKESA-N 1 2 241.285 2.195 20 0 BEADLO Cc1ccncc1CNc1ccc(N(C)C)[nH+]c1 ZINC000135441643 384443738 /nfs/dbraw/zinc/44/37/38/384443738.db2.gz BXTFTYQWXYZVLZ-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO COC[C@@H](C)Sc1[nH+]cc2ccccn21 ZINC000078940721 384473763 /nfs/dbraw/zinc/47/37/63/384473763.db2.gz CMYSQRYPRFLROX-SECBINFHSA-N 1 2 222.313 2.461 20 0 BEADLO CCOC[C@H](Nc1cc(C)[nH+]cn1)C(C)C ZINC000233796049 384510791 /nfs/dbraw/zinc/51/07/91/384510791.db2.gz NEDGULVBSQLFSR-NSHDSACASA-N 1 2 223.320 2.258 20 0 BEADLO CCOC(=O)C[N@H+](CC)Cc1ccsc1C ZINC000556800196 384487076 /nfs/dbraw/zinc/48/70/76/384487076.db2.gz UZRMHKVZTLFXKD-UHFFFAOYSA-N 1 2 241.356 2.442 20 0 BEADLO CCOC(=O)C[N@@H+](CC)Cc1ccsc1C ZINC000556800196 384487077 /nfs/dbraw/zinc/48/70/77/384487077.db2.gz UZRMHKVZTLFXKD-UHFFFAOYSA-N 1 2 241.356 2.442 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)[C@H]1CC12CC2 ZINC000335059888 384519392 /nfs/dbraw/zinc/51/93/92/384519392.db2.gz JFTLEGAXHHRPHB-SNVBAGLBSA-N 1 2 227.267 2.073 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1C[C@H](C)CC[C@@H]1C ZINC000566444566 384520373 /nfs/dbraw/zinc/52/03/73/384520373.db2.gz HXNRVTNMNSBVHW-WOPDTQHZSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1C[C@H](C)CC[C@@H]1C ZINC000566444566 384520377 /nfs/dbraw/zinc/52/03/77/384520377.db2.gz HXNRVTNMNSBVHW-WOPDTQHZSA-N 1 2 249.358 2.235 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccnn2CC(C)C)on1 ZINC000647179642 384528670 /nfs/dbraw/zinc/52/86/70/384528670.db2.gz JELLCSQRRSYHHY-UHFFFAOYSA-N 1 2 248.330 2.125 20 0 BEADLO CS[C@@H]1CC[N@H+](Cc2ccn(C(F)F)n2)C1 ZINC000449446827 384562677 /nfs/dbraw/zinc/56/26/77/384562677.db2.gz UMTCXLKHHJNQRK-SECBINFHSA-N 1 2 247.314 2.216 20 0 BEADLO CS[C@@H]1CC[N@@H+](Cc2ccn(C(F)F)n2)C1 ZINC000449446827 384562686 /nfs/dbraw/zinc/56/26/86/384562686.db2.gz UMTCXLKHHJNQRK-SECBINFHSA-N 1 2 247.314 2.216 20 0 BEADLO Cc1cncc(CNc2cc(C)[nH+]cn2)c1 ZINC000309706957 384550103 /nfs/dbraw/zinc/55/01/03/384550103.db2.gz OXVWFFVVHZNDLP-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO Cc1[nH+]cccc1NC[C@H]1CCCOC1 ZINC000085726827 384553753 /nfs/dbraw/zinc/55/37/53/384553753.db2.gz TZUUNSPHBITRND-LLVKDONJSA-N 1 2 206.289 2.229 20 0 BEADLO Cc1[nH+]cccc1N[C@H]1CCO[C@H](C)C1 ZINC000085726716 384554770 /nfs/dbraw/zinc/55/47/70/384554770.db2.gz OPHSIJJUJVNUKL-KOLCDFICSA-N 1 2 206.289 2.369 20 0 BEADLO COC(=O)C(C)(C)[NH2+]Cc1cc(C)ccc1C ZINC000049670220 384556397 /nfs/dbraw/zinc/55/63/97/384556397.db2.gz OFXMYDNJSULQAM-UHFFFAOYSA-N 1 2 235.327 2.345 20 0 BEADLO CC(C)n1cc[nH+]c1CN(C)CC(F)F ZINC000103487443 384632882 /nfs/dbraw/zinc/63/28/82/384632882.db2.gz VZABEQZGMFXXOA-UHFFFAOYSA-N 1 2 217.263 2.161 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N1CCCC[C@H]1C ZINC000158635826 384615229 /nfs/dbraw/zinc/61/52/29/384615229.db2.gz LVUUISKMXGIRFF-ABZNLYFFSA-N 1 2 247.342 2.317 20 0 BEADLO COc1cc(C)c(NCc2[nH+]ccn2C)cc1F ZINC000184565920 384620067 /nfs/dbraw/zinc/62/00/67/384620067.db2.gz NRHRIAIINXSYLU-UHFFFAOYSA-N 1 2 249.289 2.488 20 0 BEADLO CC[C@@H](C)[C@H]([NH2+]CC=C(C)C)C(=O)OC ZINC000336747479 384629179 /nfs/dbraw/zinc/62/91/79/384629179.db2.gz BWJPSELYULBMDM-MNOVXSKESA-N 1 2 213.321 2.130 20 0 BEADLO Cc1c[nH+]c(C)nc1N1C[C@@H]2CCC[C@H]21 ZINC000517960326 384593497 /nfs/dbraw/zinc/59/34/97/384593497.db2.gz HJHHQPRKIPJKRT-WDEREUQCSA-N 1 2 203.289 2.082 20 0 BEADLO CCc1ccc(C[NH2+]Cc2ccn[nH]2)cc1 ZINC000041013844 384599697 /nfs/dbraw/zinc/59/96/97/384599697.db2.gz PNQQTTXTNMNGKI-UHFFFAOYSA-N 1 2 215.300 2.262 20 0 BEADLO CCCCS[C@H](C)c1nc(C[NH2+]C)no1 ZINC000309850041 384667677 /nfs/dbraw/zinc/66/76/77/384667677.db2.gz XCRFTSOCZOBCQK-MRVPVSSYSA-N 1 2 229.349 2.383 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1c(Cl)cnn1C ZINC000309854469 384669718 /nfs/dbraw/zinc/66/97/18/384669718.db2.gz JXRFFYGXOKXGKY-UHFFFAOYSA-N 1 2 239.706 2.265 20 0 BEADLO C[N@H+](CCC(=O)Nc1ccccc1)CC(F)F ZINC000103487407 384634665 /nfs/dbraw/zinc/63/46/65/384634665.db2.gz QSPVCZZLAAOKOQ-UHFFFAOYSA-N 1 2 242.269 2.212 20 0 BEADLO C[N@@H+](CCC(=O)Nc1ccccc1)CC(F)F ZINC000103487407 384634672 /nfs/dbraw/zinc/63/46/72/384634672.db2.gz QSPVCZZLAAOKOQ-UHFFFAOYSA-N 1 2 242.269 2.212 20 0 BEADLO CC[C@H]([NH2+]CC(F)(F)CO)c1ccc(F)cc1 ZINC000184690639 384635725 /nfs/dbraw/zinc/63/57/25/384635725.db2.gz GUWGZSQPUAKVNK-NSHDSACASA-N 1 2 247.260 2.494 20 0 BEADLO CC(C)C(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000082275821 384655495 /nfs/dbraw/zinc/65/54/95/384655495.db2.gz RECKNJYGDGJIJY-SNVBAGLBSA-N 1 2 221.304 2.119 20 0 BEADLO O=C(c1ccc[nH]1)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000082277635 384660611 /nfs/dbraw/zinc/66/06/11/384660611.db2.gz VOPLBJLXXAYFHL-LLVKDONJSA-N 1 2 244.298 2.105 20 0 BEADLO C[C@@H](CC(=O)NCCn1cc[nH+]c1)C(C)(C)C ZINC000108678070 384723078 /nfs/dbraw/zinc/72/30/78/384723078.db2.gz BCZUIOORAQTNLG-NSHDSACASA-N 1 2 237.347 2.072 20 0 BEADLO COc1cc(C)[nH+]c(CSCCCO)c1 ZINC000125985654 384723814 /nfs/dbraw/zinc/72/38/14/384723814.db2.gz OSKKOXQQLIKGLY-UHFFFAOYSA-N 1 2 227.329 2.014 20 0 BEADLO CC[C@]1(C)C[C@H]1C(=O)Nc1ccc(N)[nH+]c1 ZINC000151655266 384677398 /nfs/dbraw/zinc/67/73/98/384677398.db2.gz KNNQVXVVDABOJS-JOYOIKCWSA-N 1 2 219.288 2.039 20 0 BEADLO Cc1c([C@H](C)[NH2+]Cc2nccs2)cnn1C ZINC000082394231 384678408 /nfs/dbraw/zinc/67/84/08/384678408.db2.gz KBVYEBUBDSEINA-QMMMGPOBSA-N 1 2 236.344 2.036 20 0 BEADLO CCC[C@](C)([NH2+][C@H]1C=CCCC1)C(=O)OC ZINC000171935987 384679011 /nfs/dbraw/zinc/67/90/11/384679011.db2.gz XHVCHALBRJSTDO-AAEUAGOBSA-N 1 2 225.332 2.417 20 0 BEADLO COC(=O)C[N@H+](C)Cc1c(C)cc(C)cc1C ZINC000049899184 384685239 /nfs/dbraw/zinc/68/52/39/384685239.db2.gz MIVOBABHWGJXLC-UHFFFAOYSA-N 1 2 235.327 2.217 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1c(C)cc(C)cc1C ZINC000049899184 384685246 /nfs/dbraw/zinc/68/52/46/384685246.db2.gz MIVOBABHWGJXLC-UHFFFAOYSA-N 1 2 235.327 2.217 20 0 BEADLO C[C@H]([NH2+]C1CC(C)(C)C1)C(=O)OC(C)(C)C ZINC000309888923 384687581 /nfs/dbraw/zinc/68/75/81/384687581.db2.gz ZLMFBIPRUKXHCH-VIFPVBQESA-N 1 2 227.348 2.495 20 0 BEADLO Cc1ccc(N[C@H]2COC(C)(C)C2)c[nH+]1 ZINC000335357057 384693684 /nfs/dbraw/zinc/69/36/84/384693684.db2.gz MNIBATHRPQYXQJ-LLVKDONJSA-N 1 2 206.289 2.369 20 0 BEADLO c1cn2c([nH+]1)[C@@H](Nc1ccc3c(c1)CCO3)CC2 ZINC000294259174 384702585 /nfs/dbraw/zinc/70/25/85/384702585.db2.gz XCPXVTBYPRXNAC-LBPRGKRZSA-N 1 2 241.294 2.375 20 0 BEADLO C[C@@H]1C[C@H]([NH2+]Cc2ccco2)c2nccn21 ZINC000294284771 384721447 /nfs/dbraw/zinc/72/14/47/384721447.db2.gz YTKSHRXZNVNENH-KOLCDFICSA-N 1 2 217.272 2.272 20 0 BEADLO CSCCCSc1nc(N)cc(C)[nH+]1 ZINC000126109759 384735355 /nfs/dbraw/zinc/73/53/55/384735355.db2.gz PZMUJRKXSAEPTQ-UHFFFAOYSA-N 1 2 229.374 2.212 20 0 BEADLO Cc1cnc(C[N@@H+]2CCO[C@@H]3CCC[C@H]32)s1 ZINC000271441200 384735569 /nfs/dbraw/zinc/73/55/69/384735569.db2.gz CPICJAGEHMJOJJ-GHMZBOCLSA-N 1 2 238.356 2.205 20 0 BEADLO Cc1cnc(C[N@H+]2CCO[C@@H]3CCC[C@H]32)s1 ZINC000271441200 384735575 /nfs/dbraw/zinc/73/55/75/384735575.db2.gz CPICJAGEHMJOJJ-GHMZBOCLSA-N 1 2 238.356 2.205 20 0 BEADLO Cc1csc([C@@H](C)[NH2+][C@H]2CCn3ccnc32)n1 ZINC000335953147 384737341 /nfs/dbraw/zinc/73/73/41/384737341.db2.gz WMLMSVJHBMPZJF-ZJUUUORDSA-N 1 2 248.355 2.444 20 0 BEADLO Cc1csc([C@@H](C)N[C@H]2CCn3cc[nH+]c32)n1 ZINC000335953147 384737347 /nfs/dbraw/zinc/73/73/47/384737347.db2.gz WMLMSVJHBMPZJF-ZJUUUORDSA-N 1 2 248.355 2.444 20 0 BEADLO C[C@@H]1OCC[C@H]1SCCCn1cc[nH+]c1 ZINC000185635237 384752494 /nfs/dbraw/zinc/75/24/94/384752494.db2.gz NOFSLMDLGNYFAU-WDEREUQCSA-N 1 2 226.345 2.184 20 0 BEADLO CC[C@H](CC(F)(F)F)[NH2+][C@H](CC)C(=O)OC ZINC000309713868 384757658 /nfs/dbraw/zinc/75/76/58/384757658.db2.gz RXZANDMCPBAYPD-HTQZYQBOSA-N 1 2 241.253 2.259 20 0 BEADLO Cc1cc(NC(=O)c2ccccc2O)cc[nH+]1 ZINC000072709689 384764633 /nfs/dbraw/zinc/76/46/33/384764633.db2.gz XERAURWDDCUMRS-UHFFFAOYSA-N 1 2 228.251 2.348 20 0 BEADLO Cc1cc(NCCCC(C)(F)F)nc[nH+]1 ZINC000390023913 384826393 /nfs/dbraw/zinc/82/63/93/384826393.db2.gz NHYFGSJVGAMEDT-UHFFFAOYSA-N 1 2 215.247 2.054 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1CCO[C@H]([C@@H]2CCCO2)C1 ZINC000528407729 384837768 /nfs/dbraw/zinc/83/77/68/384837768.db2.gz WZVPJTUECMZBHA-FDZLHUOSSA-N 1 2 245.750 2.009 20 0 BEADLO C/C(Cl)=C\C[N@H+]1CCO[C@H]([C@@H]2CCCO2)C1 ZINC000528407729 384837775 /nfs/dbraw/zinc/83/77/75/384837775.db2.gz WZVPJTUECMZBHA-FDZLHUOSSA-N 1 2 245.750 2.009 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1ccncc1C ZINC000471770274 533090514 /nfs/dbraw/zinc/09/05/14/533090514.db2.gz MCTVJFCZABKAKR-UHFFFAOYSA-N 1 2 243.266 2.046 20 0 BEADLO CCc1ccc(C[N@@H+]2CC[C@H](F)C2)nc1 ZINC000335467185 384805736 /nfs/dbraw/zinc/80/57/36/384805736.db2.gz AYZYSPKCTYQSOE-NSHDSACASA-N 1 2 208.280 2.188 20 0 BEADLO CCc1ccc(C[N@H+]2CC[C@H](F)C2)nc1 ZINC000335467185 384805742 /nfs/dbraw/zinc/80/57/42/384805742.db2.gz AYZYSPKCTYQSOE-NSHDSACASA-N 1 2 208.280 2.188 20 0 BEADLO O=C1OCC[C@]12CCC[N@H+]2Cc1ccccc1F ZINC000186716399 384871856 /nfs/dbraw/zinc/87/18/56/384871856.db2.gz DQRCQTVEHLGLOJ-CQSZACIVSA-N 1 2 249.285 2.107 20 0 BEADLO O=C1OCC[C@]12CCC[N@@H+]2Cc1ccccc1F ZINC000186716399 384871865 /nfs/dbraw/zinc/87/18/65/384871865.db2.gz DQRCQTVEHLGLOJ-CQSZACIVSA-N 1 2 249.285 2.107 20 0 BEADLO FC(F)(F)C1CC[NH+](Cc2cc[nH]n2)CC1 ZINC000127202353 384874211 /nfs/dbraw/zinc/87/42/11/384874211.db2.gz YOBMPHQGPAKMHU-UHFFFAOYSA-N 1 2 233.237 2.184 20 0 BEADLO CC[C@H](c1ccccc1)[N@@H+]1CCn2cnnc2C1 ZINC000105880825 384886930 /nfs/dbraw/zinc/88/69/30/384886930.db2.gz UUJPVHKNQPXDPS-CYBMUJFWSA-N 1 2 242.326 2.245 20 0 BEADLO CC[C@H](c1ccccc1)[N@H+]1CCn2cnnc2C1 ZINC000105880825 384886938 /nfs/dbraw/zinc/88/69/38/384886938.db2.gz UUJPVHKNQPXDPS-CYBMUJFWSA-N 1 2 242.326 2.245 20 0 BEADLO CCCCOCC[NH2+][C@H](C)c1csnn1 ZINC000398284354 384887397 /nfs/dbraw/zinc/88/73/97/384887397.db2.gz XUJJURQQRFUZOW-SECBINFHSA-N 1 2 229.349 2.005 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1CCO[C@H]([C@H]2CCCO2)C1 ZINC000528407732 384839655 /nfs/dbraw/zinc/83/96/55/384839655.db2.gz WZVPJTUECMZBHA-KAZJJLNOSA-N 1 2 245.750 2.009 20 0 BEADLO C/C(Cl)=C\C[N@H+]1CCO[C@H]([C@H]2CCCO2)C1 ZINC000528407732 384839658 /nfs/dbraw/zinc/83/96/58/384839658.db2.gz WZVPJTUECMZBHA-KAZJJLNOSA-N 1 2 245.750 2.009 20 0 BEADLO CCC[C@H]1CCC[C@H]1C(=O)NCc1c[nH+]c[nH]1 ZINC000449907794 384843734 /nfs/dbraw/zinc/84/37/34/384843734.db2.gz PUVQORUPDRXQBN-CMPLNLGQSA-N 1 2 235.331 2.242 20 0 BEADLO CCC[C@H]1CCC[C@H]1C(=O)NCc1c[nH]c[nH+]1 ZINC000449907794 384843741 /nfs/dbraw/zinc/84/37/41/384843741.db2.gz PUVQORUPDRXQBN-CMPLNLGQSA-N 1 2 235.331 2.242 20 0 BEADLO COCc1ccc(C[NH2+]Cc2cc(C)no2)o1 ZINC000127362798 384855657 /nfs/dbraw/zinc/85/56/57/384855657.db2.gz HWWBGABGAFOWSE-UHFFFAOYSA-N 1 2 236.271 2.012 20 0 BEADLO CO[C@@H](C)c1nc(C[NH+]2CCCC2)cs1 ZINC000175060834 384861667 /nfs/dbraw/zinc/86/16/67/384861667.db2.gz CUDIBGWKHTVCNA-VIFPVBQESA-N 1 2 226.345 2.446 20 0 BEADLO CC(C)C1(CNc2[nH+]cnc3c2cnn3C)CC1 ZINC000175761068 384953929 /nfs/dbraw/zinc/95/39/29/384953929.db2.gz DLTHMJFNSFTQOG-UHFFFAOYSA-N 1 2 245.330 2.211 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)Nc1cc(C)[nH+]cc1C ZINC000521189135 384898684 /nfs/dbraw/zinc/89/86/84/384898684.db2.gz HSYPLRSTJMKDOP-GHMZBOCLSA-N 1 2 218.300 2.105 20 0 BEADLO CN(CC1(O)CCCC1)c1[nH]c2ccccc2[nH+]1 ZINC000127457556 384900028 /nfs/dbraw/zinc/90/00/28/384900028.db2.gz OALYYRDHSHMXGS-UHFFFAOYSA-N 1 2 245.326 2.304 20 0 BEADLO Nc1[nH+]cnc(N[C@H]2CCC[C@H]2F)c1Cl ZINC000338841910 384958536 /nfs/dbraw/zinc/95/85/36/384958536.db2.gz IJVMABAKBVQCBC-RITPCOANSA-N 1 2 230.674 2.015 20 0 BEADLO Nc1nc[nH+]c(N[C@H]2CCC[C@H]2F)c1Cl ZINC000338841910 384958547 /nfs/dbraw/zinc/95/85/47/384958547.db2.gz IJVMABAKBVQCBC-RITPCOANSA-N 1 2 230.674 2.015 20 0 BEADLO Cc1cc(C)c(C[NH2+]CC(F)(F)CO)cc1C ZINC000183896304 384934499 /nfs/dbraw/zinc/93/44/99/384934499.db2.gz BQACXZDUMZBAQY-UHFFFAOYSA-N 1 2 243.297 2.329 20 0 BEADLO COc1cc(C[NH2+]Cc2csc(C)n2)ccn1 ZINC000057395254 384944280 /nfs/dbraw/zinc/94/42/80/384944280.db2.gz CDELOPIHAKVWNK-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO COc1ncccc1C[NH2+][C@H](C)c1nccs1 ZINC000086509849 385022434 /nfs/dbraw/zinc/02/24/34/385022434.db2.gz ZBPWDYBZLVXTNW-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO CSC[C@H](O)Cn1cc[nH+]c1-c1ccccc1 ZINC000187895263 384993024 /nfs/dbraw/zinc/99/30/24/384993024.db2.gz GFJXUTVINZXPGY-GFCCVEGCSA-N 1 2 248.351 2.274 20 0 BEADLO COc1ccc(NCc2cc(C)ns2)[nH+]c1 ZINC000404450187 384998530 /nfs/dbraw/zinc/99/85/30/384998530.db2.gz YLUAOVVEUCPGTP-UHFFFAOYSA-N 1 2 235.312 2.467 20 0 BEADLO CO[C@@H](C)[C@H](C)Nc1cc[nH+]c(C(C)C)n1 ZINC000302723681 385016606 /nfs/dbraw/zinc/01/66/06/385016606.db2.gz QRQMUROLCKNILE-UWVGGRQHSA-N 1 2 223.320 2.435 20 0 BEADLO CCC[C@H]([NH2+][C@@H]1CC[C@@H](F)C1)C(=O)OCC ZINC000310007703 385018872 /nfs/dbraw/zinc/01/88/72/385018872.db2.gz HKHGAEGDENFGAD-MXWKQRLJSA-N 1 2 231.311 2.198 20 0 BEADLO CCO[C@H]1C[C@@H](N(C)c2cc(C)[nH+]cn2)C1(C)C ZINC000156793482 384961250 /nfs/dbraw/zinc/96/12/50/384961250.db2.gz UJCZEFABBOBCDW-NEPJUHHUSA-N 1 2 249.358 2.425 20 0 BEADLO C/C=C(\C)C(=O)NCc1cn2cccc(C)c2[nH+]1 ZINC000176284190 385055969 /nfs/dbraw/zinc/05/59/69/385055969.db2.gz NOUQSXIKYDQQIK-ONNFQVAWSA-N 1 2 243.310 2.225 20 0 BEADLO CC(C)[C@H]1CC[C@H](C(=O)NCc2[nH]cc[nH+]2)CC1 ZINC000128618224 385057079 /nfs/dbraw/zinc/05/70/79/385057079.db2.gz KYBRWURYGLOERW-TXEJJXNPSA-N 1 2 249.358 2.488 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@H](C)C3(CCC3)C2)no1 ZINC000334150350 385057884 /nfs/dbraw/zinc/05/78/84/385057884.db2.gz IVYCTKMNMBBWQS-SNVBAGLBSA-N 1 2 235.331 2.390 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@H](C)C3(CCC3)C2)no1 ZINC000334150350 385057890 /nfs/dbraw/zinc/05/78/90/385057890.db2.gz IVYCTKMNMBBWQS-SNVBAGLBSA-N 1 2 235.331 2.390 20 0 BEADLO Cc1cc(CC(=O)Nc2ccc(C)[nH+]c2C)no1 ZINC000176294733 385058426 /nfs/dbraw/zinc/05/84/26/385058426.db2.gz NUWNHNHCTVFIFD-UHFFFAOYSA-N 1 2 245.282 2.176 20 0 BEADLO Cc1csc(CNc2cc(C)[nH+]cn2)c1 ZINC000335317028 385059383 /nfs/dbraw/zinc/05/93/83/385059383.db2.gz MJWGMIUZLKGABK-UHFFFAOYSA-N 1 2 219.313 2.189 20 0 BEADLO COC[C@@H]([NH2+]Cc1nccs1)c1ccco1 ZINC000177577848 385059929 /nfs/dbraw/zinc/05/99/29/385059929.db2.gz IUKCOPQLLBKIOE-SECBINFHSA-N 1 2 238.312 2.213 20 0 BEADLO CC[C@H]1C[N@H+](Cc2nc(C)c(C)s2)CCO1 ZINC000176323888 385061891 /nfs/dbraw/zinc/06/18/91/385061891.db2.gz BLJCTUXRXWIPNP-NSHDSACASA-N 1 2 240.372 2.371 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2nc(C)c(C)s2)CCO1 ZINC000176323888 385061897 /nfs/dbraw/zinc/06/18/97/385061897.db2.gz BLJCTUXRXWIPNP-NSHDSACASA-N 1 2 240.372 2.371 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)C=C1CCC1 ZINC000087154617 385078288 /nfs/dbraw/zinc/07/82/88/385078288.db2.gz OSRMWSSLPVOGTR-UHFFFAOYSA-N 1 2 231.299 2.196 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cccc(F)c2N)[C@H](C)CO1 ZINC000156343080 385035588 /nfs/dbraw/zinc/03/55/88/385035588.db2.gz MXMONYHUSKVQCX-NXEZZACHSA-N 1 2 238.306 2.017 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cccc(F)c2N)[C@H](C)CO1 ZINC000156343080 385035598 /nfs/dbraw/zinc/03/55/98/385035598.db2.gz MXMONYHUSKVQCX-NXEZZACHSA-N 1 2 238.306 2.017 20 0 BEADLO Cc1noc([C@H](C)[NH2+]Cc2ccsc2)n1 ZINC000309103716 385109389 /nfs/dbraw/zinc/10/93/89/385109389.db2.gz GXUFGRWPHARIRM-ZETCQYMHSA-N 1 2 223.301 2.290 20 0 BEADLO CCC[C@@H]([NH2+][C@@H](CC)CSC)C(=O)OCC ZINC000162120626 385117639 /nfs/dbraw/zinc/11/76/39/385117639.db2.gz YYOUGBHESUAPDW-WDEREUQCSA-N 1 2 247.404 2.449 20 0 BEADLO Cc1ccc(C)c([S@@](=O)Cc2[nH+]ccn2C)c1 ZINC000129243333 385126721 /nfs/dbraw/zinc/12/67/21/385126721.db2.gz MBXOFTWGRYCATB-QGZVFWFLSA-N 1 2 248.351 2.345 20 0 BEADLO Cc1ccc([S@@](=O)Cc2[nH+]ccn2C)c(C)c1 ZINC000129244223 385127441 /nfs/dbraw/zinc/12/74/41/385127441.db2.gz ZSEGJAFLPBUYLQ-QGZVFWFLSA-N 1 2 248.351 2.345 20 0 BEADLO CC(C)(C)c1nc(C[N@@H+]2CC[C@@H](O)C2)cs1 ZINC000061708693 385135740 /nfs/dbraw/zinc/13/57/40/385135740.db2.gz OZKOFTDNBINAEL-SNVBAGLBSA-N 1 2 240.372 2.007 20 0 BEADLO CC(C)(C)c1nc(C[N@H+]2CC[C@@H](O)C2)cs1 ZINC000061708693 385135746 /nfs/dbraw/zinc/13/57/46/385135746.db2.gz OZKOFTDNBINAEL-SNVBAGLBSA-N 1 2 240.372 2.007 20 0 BEADLO CCc1nc(C)c(C[NH2+][C@@H](C)c2ncc[nH]2)o1 ZINC000291973502 385086517 /nfs/dbraw/zinc/08/65/17/385086517.db2.gz UGNWGZKXOFHPQU-VIFPVBQESA-N 1 2 234.303 2.119 20 0 BEADLO CCc1nc(C)c(CN[C@@H](C)c2[nH]cc[nH+]2)o1 ZINC000291973502 385086525 /nfs/dbraw/zinc/08/65/25/385086525.db2.gz UGNWGZKXOFHPQU-VIFPVBQESA-N 1 2 234.303 2.119 20 0 BEADLO CCc1ccc(C[NH2+][C@H]2CCCn3ncnc32)o1 ZINC000151180418 385091309 /nfs/dbraw/zinc/09/13/09/385091309.db2.gz YEHWKHXKDMVWPK-LBPRGKRZSA-N 1 2 246.314 2.058 20 0 BEADLO CC1(C(=O)Nc2ccc(N)[nH+]c2)CCCC1 ZINC000087317985 385092353 /nfs/dbraw/zinc/09/23/53/385092353.db2.gz XUQGIMPPKPXGDW-UHFFFAOYSA-N 1 2 219.288 2.183 20 0 BEADLO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1cc(C)ncn1 ZINC000644681872 385096181 /nfs/dbraw/zinc/09/61/81/385096181.db2.gz WHJKMRIIAZUXQO-SECBINFHSA-N 1 2 246.314 2.241 20 0 BEADLO C[C@@H](N[C@H](C)C(F)(F)F)c1[nH]cc[nH+]1 ZINC000287224300 385098250 /nfs/dbraw/zinc/09/82/50/385098250.db2.gz GGVMYBZYRBZHEJ-PHDIDXHHSA-N 1 2 207.199 2.011 20 0 BEADLO C[C@H](C[N@H+](C)Cc1nnc[nH]1)c1ccccc1 ZINC000177140846 385188548 /nfs/dbraw/zinc/18/85/48/385188548.db2.gz GAUVHSWXQHSKEM-LLVKDONJSA-N 1 2 230.315 2.040 20 0 BEADLO C[C@H](C[N@@H+](C)Cc1nnc[nH]1)c1ccccc1 ZINC000177140846 385188554 /nfs/dbraw/zinc/18/85/54/385188554.db2.gz GAUVHSWXQHSKEM-LLVKDONJSA-N 1 2 230.315 2.040 20 0 BEADLO COC[C@@H](Nc1cc[nH+]c(C)n1)c1ccco1 ZINC000176965280 385162245 /nfs/dbraw/zinc/16/22/45/385162245.db2.gz DUTOGZAAWYSIHW-SNVBAGLBSA-N 1 2 233.271 2.178 20 0 BEADLO CC[N@H+](Cc1ncnn1C)Cc1ccc(C)cc1 ZINC000530939179 385178382 /nfs/dbraw/zinc/17/83/82/385178382.db2.gz PXRQUCJUVWJFAB-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CC[N@@H+](Cc1ncnn1C)Cc1ccc(C)cc1 ZINC000530939179 385178386 /nfs/dbraw/zinc/17/83/86/385178386.db2.gz PXRQUCJUVWJFAB-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CC[C@H](CCO)CNc1cc(C)[nH+]c(C2CC2)n1 ZINC000152401718 385180433 /nfs/dbraw/zinc/18/04/33/385180433.db2.gz IXYJOWFUBHJEJC-LLVKDONJSA-N 1 2 249.358 2.483 20 0 BEADLO CCc1cc(N)nc(SCC[C@H](C)F)[nH+]1 ZINC000308844978 385206531 /nfs/dbraw/zinc/20/65/31/385206531.db2.gz OYRKMIPCTHDVQD-ZETCQYMHSA-N 1 2 229.324 2.461 20 0 BEADLO Cn1cncc1C[N@@H+]1CCc2sccc2C1 ZINC000177244014 385207425 /nfs/dbraw/zinc/20/74/25/385207425.db2.gz GDVDBVIUMJFOAB-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO Cn1cncc1C[N@H+]1CCc2sccc2C1 ZINC000177244014 385207432 /nfs/dbraw/zinc/20/74/32/385207432.db2.gz GDVDBVIUMJFOAB-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO Cn1c[nH+]cc1CN1CCc2sccc2C1 ZINC000177244014 385207435 /nfs/dbraw/zinc/20/74/35/385207435.db2.gz GDVDBVIUMJFOAB-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO Cc1cnc(CCN(C)c2cc[nH+]c(C)n2)s1 ZINC000166023082 385217165 /nfs/dbraw/zinc/21/71/65/385217165.db2.gz PXSACTFUXCTNHO-UHFFFAOYSA-N 1 2 248.355 2.229 20 0 BEADLO CCc1nnc(C[N@H+]2CC[C@H]2CC)s1 ZINC000644786388 385219638 /nfs/dbraw/zinc/21/96/38/385219638.db2.gz IRVSYSZAXVTYRV-MRVPVSSYSA-N 1 2 211.334 2.085 20 0 BEADLO CCc1nnc(C[N@@H+]2CC[C@H]2CC)s1 ZINC000644786388 385219643 /nfs/dbraw/zinc/21/96/43/385219643.db2.gz IRVSYSZAXVTYRV-MRVPVSSYSA-N 1 2 211.334 2.085 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@H](C)C(C)(C)C2)no1 ZINC000336396471 385247045 /nfs/dbraw/zinc/24/70/45/385247045.db2.gz LVURXGYXKNCETL-VIFPVBQESA-N 1 2 223.320 2.246 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@H](C)C(C)(C)C2)no1 ZINC000336396471 385247049 /nfs/dbraw/zinc/24/70/49/385247049.db2.gz LVURXGYXKNCETL-VIFPVBQESA-N 1 2 223.320 2.246 20 0 BEADLO Cn1cncc1C[N@@H+]1CCc2c(F)cccc2C1 ZINC000152721747 385205757 /nfs/dbraw/zinc/20/57/57/385205757.db2.gz RETKVNVZDJMBIX-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1cncc1C[N@H+]1CCc2c(F)cccc2C1 ZINC000152721747 385205761 /nfs/dbraw/zinc/20/57/61/385205761.db2.gz RETKVNVZDJMBIX-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1c[nH+]cc1CN1CCc2c(F)cccc2C1 ZINC000152721747 385205766 /nfs/dbraw/zinc/20/57/66/385205766.db2.gz RETKVNVZDJMBIX-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO COc1nccnc1C[N@H+](C)Cc1ccsc1 ZINC000648350913 385306537 /nfs/dbraw/zinc/30/65/37/385306537.db2.gz MMDOEZFENXCEQQ-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1nccnc1C[N@@H+](C)Cc1ccsc1 ZINC000648350913 385306540 /nfs/dbraw/zinc/30/65/40/385306540.db2.gz MMDOEZFENXCEQQ-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COC[C@@H](C)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000153530127 385262165 /nfs/dbraw/zinc/26/21/65/385262165.db2.gz LQMBBWZZXMPGFY-SNVBAGLBSA-N 1 2 249.289 2.458 20 0 BEADLO O=C(C1=CCCCCC1)N1CCn2c[nH+]cc2C1 ZINC000290938113 385264240 /nfs/dbraw/zinc/26/42/40/385264240.db2.gz NZMLVGDOCXLWTA-UHFFFAOYSA-N 1 2 245.326 2.116 20 0 BEADLO COC[C@H]([NH2+]Cc1ccno1)c1ccccc1 ZINC000223718596 385267882 /nfs/dbraw/zinc/26/78/82/385267882.db2.gz CCMLNSPNYYQDSO-ZDUSSCGKSA-N 1 2 232.283 2.152 20 0 BEADLO c1cn(CCCSC[C@@H]2CCCO2)c[nH+]1 ZINC000191752989 385322469 /nfs/dbraw/zinc/32/24/69/385322469.db2.gz HUSAMQAOSRVFLL-NSHDSACASA-N 1 2 226.345 2.185 20 0 BEADLO CO[C@@H](C)c1nc(Cn2cc[nH+]c2)cs1 ZINC000177644166 385269155 /nfs/dbraw/zinc/26/91/55/385269155.db2.gz MLPSZTREKREHSJ-QMMMGPOBSA-N 1 2 223.301 2.095 20 0 BEADLO Cc1csc(C[N@@H+](C)Cc2ccncc2)n1 ZINC000130631391 385270361 /nfs/dbraw/zinc/27/03/61/385270361.db2.gz HGUYAGGMJUEDKD-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1csc(C[N@H+](C)Cc2ccncc2)n1 ZINC000130631391 385270366 /nfs/dbraw/zinc/27/03/66/385270366.db2.gz HGUYAGGMJUEDKD-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cc(N2CC[C@H](O)[C@H](C)C2)nc(C(C)C)[nH+]1 ZINC000167093892 385298688 /nfs/dbraw/zinc/29/86/88/385298688.db2.gz BMGACAWZFPIHOB-PWSUYJOCSA-N 1 2 249.358 2.116 20 0 BEADLO CN(CCOCC1CC1)c1cc[nH+]c(C2CC2)n1 ZINC000154062290 385300139 /nfs/dbraw/zinc/30/01/39/385300139.db2.gz IHQWGMAVQZWBNA-UHFFFAOYSA-N 1 2 247.342 2.217 20 0 BEADLO CCc1cc(N2CCO[C@@H]3CCC[C@@H]32)nc(C)[nH+]1 ZINC000272900742 385338051 /nfs/dbraw/zinc/33/80/51/385338051.db2.gz PONUBIQILVWCIL-QWHCGFSZSA-N 1 2 247.342 2.105 20 0 BEADLO c1cc(CNc2cc(N3CCCC3)nc[nH+]2)co1 ZINC000192285385 385349167 /nfs/dbraw/zinc/34/91/67/385349167.db2.gz JTNMPPQXIAHANT-UHFFFAOYSA-N 1 2 244.298 2.282 20 0 BEADLO c1cc(CNc2cc(N3CCCC3)[nH+]cn2)co1 ZINC000192285385 385349171 /nfs/dbraw/zinc/34/91/71/385349171.db2.gz JTNMPPQXIAHANT-UHFFFAOYSA-N 1 2 244.298 2.282 20 0 BEADLO C[C@H](NC(=O)CCc1c[nH+]c[nH]1)C1CCCC1 ZINC000193265112 385389485 /nfs/dbraw/zinc/38/94/85/385389485.db2.gz JOGZNNAQEALKME-JTQLQIEISA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H](NC(=O)CCc1c[nH]c[nH+]1)C1CCCC1 ZINC000193265112 385389488 /nfs/dbraw/zinc/38/94/88/385389488.db2.gz JOGZNNAQEALKME-JTQLQIEISA-N 1 2 235.331 2.037 20 0 BEADLO COc1cc(C[NH2+]Cc2cocn2)ccc1C ZINC000192298106 385351468 /nfs/dbraw/zinc/35/14/68/385351468.db2.gz IINAOHRAPUYRAR-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)C1CCCCC1 ZINC000154846112 385360155 /nfs/dbraw/zinc/36/01/55/385360155.db2.gz ANKFKNQELVGCDI-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO C[C@@H](CNC(=O)CCCC1CC1)Cn1cc[nH+]c1 ZINC000643992444 385360333 /nfs/dbraw/zinc/36/03/33/385360333.db2.gz ANXGQBXFIACQBO-LBPRGKRZSA-N 1 2 249.358 2.216 20 0 BEADLO O=C(C=C1CCC1)NCc1ccn2cc[nH+]c2c1 ZINC000178359147 385361110 /nfs/dbraw/zinc/36/11/10/385361110.db2.gz UAWTYOZICMVDEP-UHFFFAOYSA-N 1 2 241.294 2.061 20 0 BEADLO CC[C@H]([NH2+]Cc1sccc1C)C(=O)OC ZINC000168386654 385368893 /nfs/dbraw/zinc/36/88/93/385368893.db2.gz FOIAZIYNXNIUED-VIFPVBQESA-N 1 2 227.329 2.098 20 0 BEADLO Cc1cc[nH+]c(N[C@H](C)[C@H](C)CO)c1Cl ZINC000309019115 385373358 /nfs/dbraw/zinc/37/33/58/385373358.db2.gz VXUPLFAVLNYDIR-RKDXNWHRSA-N 1 2 228.723 2.472 20 0 BEADLO CCc1ccc([C@@H](COC)[NH2+]CCF)o1 ZINC000309061546 385397471 /nfs/dbraw/zinc/39/74/71/385397471.db2.gz WZWHWUHEQWIZJT-SNVBAGLBSA-N 1 2 215.268 2.089 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[NH2+]C[C@@H](C)SC ZINC000181021791 385402747 /nfs/dbraw/zinc/40/27/47/385402747.db2.gz BEMKCFWEFQKLTG-MNOVXSKESA-N 1 2 247.404 2.305 20 0 BEADLO C=Cn1cc(C[N@@H+]2CCn3cccc3[C@H]2C)cn1 ZINC000193605271 385404389 /nfs/dbraw/zinc/40/43/89/385404389.db2.gz XKUPSWOPBPWQCE-GFCCVEGCSA-N 1 2 242.326 2.362 20 0 BEADLO C=Cn1cc(C[N@H+]2CCn3cccc3[C@H]2C)cn1 ZINC000193605271 385404391 /nfs/dbraw/zinc/40/43/91/385404391.db2.gz XKUPSWOPBPWQCE-GFCCVEGCSA-N 1 2 242.326 2.362 20 0 BEADLO Cc1ccc(NC(=O)C=Cc2c[nH]c[nH+]2)c(C)n1 ZINC000492813821 385439177 /nfs/dbraw/zinc/43/91/77/385439177.db2.gz QLWVOZIBHROHIU-XQRVVYSFSA-N 1 2 242.282 2.073 20 0 BEADLO CC[C@H](C[C@H](C)CO)Nc1cccc[nH+]1 ZINC000309164758 385445093 /nfs/dbraw/zinc/44/50/93/385445093.db2.gz IMSVGXNGKPKPKR-WDEREUQCSA-N 1 2 208.305 2.291 20 0 BEADLO CC[C@@H](C[C@H](C)CO)Nc1cccc[nH+]1 ZINC000309164757 385445245 /nfs/dbraw/zinc/44/52/45/385445245.db2.gz IMSVGXNGKPKPKR-QWRGUYRKSA-N 1 2 208.305 2.291 20 0 BEADLO COC(=O)C(C)(C)CCNc1ccc(C)[nH+]c1 ZINC000354467263 385452696 /nfs/dbraw/zinc/45/26/96/385452696.db2.gz RXTNKPFHDAXGDG-UHFFFAOYSA-N 1 2 236.315 2.391 20 0 BEADLO Cc1csc(C[N@H+]2CCO[C@@H](C)[C@@H]2C)n1 ZINC000156442553 385452776 /nfs/dbraw/zinc/45/27/76/385452776.db2.gz IBIQFNRODUTJSF-UWVGGRQHSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1csc(C[N@@H+]2CCO[C@@H](C)[C@@H]2C)n1 ZINC000156442553 385452779 /nfs/dbraw/zinc/45/27/79/385452779.db2.gz IBIQFNRODUTJSF-UWVGGRQHSA-N 1 2 226.345 2.061 20 0 BEADLO C[C@@H](Nc1cccc[nH+]1)[C@H]1CCCOC1 ZINC000309125811 385428890 /nfs/dbraw/zinc/42/88/90/385428890.db2.gz PMWXGZMNNKQNJJ-MNOVXSKESA-N 1 2 206.289 2.309 20 0 BEADLO C=Cn1cc(C[NH2+]Cc2ncc(CC)s2)cn1 ZINC000194344684 385431966 /nfs/dbraw/zinc/43/19/66/385431966.db2.gz NHQZKODTELLZLH-UHFFFAOYSA-N 1 2 248.355 2.292 20 0 BEADLO Nc1cc(CSc2ccccn2)cc[nH+]1 ZINC000052756074 385457559 /nfs/dbraw/zinc/45/75/59/385457559.db2.gz UGILZZJADDQAGN-UHFFFAOYSA-N 1 2 217.297 2.351 20 0 BEADLO Cc1nn(C)cc1C[N@@H+]1CCn2cccc2[C@@H]1C ZINC000179563803 385474268 /nfs/dbraw/zinc/47/42/68/385474268.db2.gz BDUNMNANWBBKOG-LBPRGKRZSA-N 1 2 244.342 2.107 20 0 BEADLO Cc1nn(C)cc1C[N@H+]1CCn2cccc2[C@@H]1C ZINC000179563803 385474271 /nfs/dbraw/zinc/47/42/71/385474271.db2.gz BDUNMNANWBBKOG-LBPRGKRZSA-N 1 2 244.342 2.107 20 0 BEADLO C[N@H+](Cc1nccs1)Cc1ccc(CO)cc1 ZINC000182820489 385481424 /nfs/dbraw/zinc/48/14/24/385481424.db2.gz PPBJHFMPSNSTKC-UHFFFAOYSA-N 1 2 248.351 2.267 20 0 BEADLO C[N@@H+](Cc1nccs1)Cc1ccc(CO)cc1 ZINC000182820489 385481426 /nfs/dbraw/zinc/48/14/26/385481426.db2.gz PPBJHFMPSNSTKC-UHFFFAOYSA-N 1 2 248.351 2.267 20 0 BEADLO CCC[C@H]([NH2+]CCSC(C)C)C(=O)OCC ZINC000309213514 385484060 /nfs/dbraw/zinc/48/40/60/385484060.db2.gz OPQPJZABJDOBIU-NSHDSACASA-N 1 2 247.404 2.449 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@H]1c1cccn1C ZINC000179710151 385485407 /nfs/dbraw/zinc/48/54/07/385485407.db2.gz NBYXPECUUBJOBT-AWEZNQCLSA-N 1 2 244.342 2.394 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@H]1c1cccn1C ZINC000179710151 385485409 /nfs/dbraw/zinc/48/54/09/385485409.db2.gz NBYXPECUUBJOBT-AWEZNQCLSA-N 1 2 244.342 2.394 20 0 BEADLO CC[C@@H](CC(=O)NCCn1cc[nH+]c1)C(C)C ZINC000171435700 385485770 /nfs/dbraw/zinc/48/57/70/385485770.db2.gz GUKNSMHNZDASAN-LBPRGKRZSA-N 1 2 237.347 2.072 20 0 BEADLO COC[C@H]([NH2+][C@@H](C)c1cnccn1)c1ccco1 ZINC000156620813 385462412 /nfs/dbraw/zinc/46/24/12/385462412.db2.gz TVSSMJSLDPWZRX-JQWIXIFHSA-N 1 2 247.298 2.108 20 0 BEADLO CC(C)N(C(=O)/C=C/c1[nH]cc[nH+]1)C1CCC1 ZINC000493070619 385512023 /nfs/dbraw/zinc/51/20/23/385512023.db2.gz LZLPHEJGNIENJK-VOTSOKGWSA-N 1 2 233.315 2.212 20 0 BEADLO CCC[C@](C)([NH2+]CCOC(C)(C)C)C(=O)OC ZINC000109801866 385489029 /nfs/dbraw/zinc/48/90/29/385489029.db2.gz XZZPCHXXYUYFAB-ZDUSSCGKSA-N 1 2 245.363 2.123 20 0 BEADLO CC(C)(C)CC(=O)Nc1cc[nH+]cc1O ZINC000109890443 385490086 /nfs/dbraw/zinc/49/00/86/385490086.db2.gz OSGVSYKXKQCWEN-UHFFFAOYSA-N 1 2 208.261 2.162 20 0 BEADLO C[N@H+](Cc1ncc(C(C)(C)C)o1)[C@@H]1CCOC1 ZINC000106882446 385540219 /nfs/dbraw/zinc/54/02/19/385540219.db2.gz SWJZDGDWPMXBOU-SNVBAGLBSA-N 1 2 238.331 2.193 20 0 BEADLO C[N@@H+](Cc1ncc(C(C)(C)C)o1)[C@@H]1CCOC1 ZINC000106882446 385540224 /nfs/dbraw/zinc/54/02/24/385540224.db2.gz SWJZDGDWPMXBOU-SNVBAGLBSA-N 1 2 238.331 2.193 20 0 BEADLO FC(F)c1noc(C[NH+]2CCCCCC2)n1 ZINC000335087865 385519548 /nfs/dbraw/zinc/51/95/48/385519548.db2.gz RISDNZBHPVVGSI-UHFFFAOYSA-N 1 2 231.246 2.383 20 0 BEADLO CC[C@H](N[C@H](C)c1[nH+]ccn1C)C(F)(F)F ZINC000309412578 385574337 /nfs/dbraw/zinc/57/43/37/385574337.db2.gz CACPYEXNYQVCOM-SFYZADRCSA-N 1 2 235.253 2.412 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)NC1(C(C)C)CC1 ZINC000493205814 385554897 /nfs/dbraw/zinc/55/48/97/385554897.db2.gz LIYQAXXVMQTUQE-WAYWQWQTSA-N 1 2 247.342 2.221 20 0 BEADLO CCCn1cc(C(=O)Nc2cc[nH+]cc2C)cn1 ZINC000180952609 385556399 /nfs/dbraw/zinc/55/63/99/385556399.db2.gz SFZGTMZUZPMNOZ-UHFFFAOYSA-N 1 2 244.298 2.249 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1cc(C(C)C)[nH]n1 ZINC000107286670 385562265 /nfs/dbraw/zinc/56/22/65/385562265.db2.gz TWPYNLSZXMSFOR-UHFFFAOYSA-N 1 2 244.298 2.489 20 0 BEADLO Cc1nnc(C[N@H+]2CCC[C@@H]2c2cccn2C)o1 ZINC000181083279 385562772 /nfs/dbraw/zinc/56/27/72/385562772.db2.gz XDLAHGLAZJGMKE-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC[C@@H]2c2cccn2C)o1 ZINC000181083279 385562774 /nfs/dbraw/zinc/56/27/74/385562774.db2.gz XDLAHGLAZJGMKE-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1nccn1C ZINC000181103248 385563745 /nfs/dbraw/zinc/56/37/45/385563745.db2.gz SQVDHJYESBKARW-ZDUSSCGKSA-N 1 2 244.342 2.096 20 0 BEADLO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1nccn1C ZINC000181103248 385563750 /nfs/dbraw/zinc/56/37/50/385563750.db2.gz SQVDHJYESBKARW-ZDUSSCGKSA-N 1 2 244.342 2.096 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccc3[nH]cnc3c2)no1 ZINC000518779228 385565001 /nfs/dbraw/zinc/56/50/01/385565001.db2.gz GUGAGTZCQPKDLM-UHFFFAOYSA-N 1 2 242.282 2.149 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccc3nc[nH]c3c2)no1 ZINC000518779228 385565005 /nfs/dbraw/zinc/56/50/05/385565005.db2.gz GUGAGTZCQPKDLM-UHFFFAOYSA-N 1 2 242.282 2.149 20 0 BEADLO Cc1cnc(C(C)(C)[NH2+]Cc2ccno2)s1 ZINC000273259491 385585785 /nfs/dbraw/zinc/58/57/85/385585785.db2.gz FRMUACYCPXTHHI-UHFFFAOYSA-N 1 2 237.328 2.464 20 0 BEADLO CS[C@H](C)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000280885422 385615047 /nfs/dbraw/zinc/61/50/47/385615047.db2.gz ZOBNRONFSSTESG-MRVPVSSYSA-N 1 2 235.312 2.024 20 0 BEADLO CS[C@@H](C)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000280885424 385615150 /nfs/dbraw/zinc/61/51/50/385615150.db2.gz ZOBNRONFSSTESG-QMMMGPOBSA-N 1 2 235.312 2.024 20 0 BEADLO FCCN[C@H](c1[nH]cc[nH+]1)c1ccc(F)cc1 ZINC000280878959 385615414 /nfs/dbraw/zinc/61/54/14/385615414.db2.gz AVOPQEVKNVJSOT-NSHDSACASA-N 1 2 237.253 2.197 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1nccs1 ZINC000269677816 385623358 /nfs/dbraw/zinc/62/33/58/385623358.db2.gz SKGUBCCQGILTEI-ZJUUUORDSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1nccs1 ZINC000269677816 385623363 /nfs/dbraw/zinc/62/33/63/385623363.db2.gz SKGUBCCQGILTEI-ZJUUUORDSA-N 1 2 226.345 2.142 20 0 BEADLO COC(=O)C[NH2+][C@H](c1ccc(F)cc1)C(C)C ZINC000337385029 385637216 /nfs/dbraw/zinc/63/72/16/385637216.db2.gz FJGYMTFOUFASFY-ZDUSSCGKSA-N 1 2 239.290 2.285 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)[C@@H]1CC1(C)C ZINC000269712337 385629911 /nfs/dbraw/zinc/62/99/11/385629911.db2.gz NYZOHHJGWBZHKL-VIFPVBQESA-N 1 2 233.315 2.132 20 0 BEADLO C[C@H](O)CCC[N@@H+]1CCCC[C@H]1C(F)F ZINC000337411801 385642854 /nfs/dbraw/zinc/64/28/54/385642854.db2.gz PGNOYKXGQCVWEE-UWVGGRQHSA-N 1 2 221.291 2.267 20 0 BEADLO C[C@H](O)CCC[N@H+]1CCCC[C@H]1C(F)F ZINC000337411801 385642860 /nfs/dbraw/zinc/64/28/60/385642860.db2.gz PGNOYKXGQCVWEE-UWVGGRQHSA-N 1 2 221.291 2.267 20 0 BEADLO FC(F)[C@H]1CCCC[N@@H+]1CCn1cccn1 ZINC000337417235 385644012 /nfs/dbraw/zinc/64/40/12/385644012.db2.gz SAUGNCKZSYJNSC-SNVBAGLBSA-N 1 2 229.274 2.003 20 0 BEADLO FC(F)[C@H]1CCCC[N@H+]1CCn1cccn1 ZINC000337417235 385644017 /nfs/dbraw/zinc/64/40/17/385644017.db2.gz SAUGNCKZSYJNSC-SNVBAGLBSA-N 1 2 229.274 2.003 20 0 BEADLO CC1(C)CCC[C@H](C(=O)NCc2[nH]cc[nH+]2)C1 ZINC000270037841 385662458 /nfs/dbraw/zinc/66/24/58/385662458.db2.gz INBGJXBCBLDTJH-JTQLQIEISA-N 1 2 235.331 2.242 20 0 BEADLO CC(C)[C@H]([NH2+]CCF)c1nc(C2CC2)no1 ZINC000309539605 385673168 /nfs/dbraw/zinc/67/31/68/385673168.db2.gz DNUMEVIFXLSJCH-VIFPVBQESA-N 1 2 227.283 2.203 20 0 BEADLO FC1(F)CC[N@H+](C[C@H]2CCSC2)C1 ZINC000307461636 385690976 /nfs/dbraw/zinc/69/09/76/385690976.db2.gz FWIMRQLBCFACTC-MRVPVSSYSA-N 1 2 207.289 2.081 20 0 BEADLO FC1(F)CC[N@@H+](C[C@H]2CCSC2)C1 ZINC000307461636 385690983 /nfs/dbraw/zinc/69/09/83/385690983.db2.gz FWIMRQLBCFACTC-MRVPVSSYSA-N 1 2 207.289 2.081 20 0 BEADLO Cc1cccc([C@@H](C)[NH2+]CC(F)(F)CO)c1 ZINC000184699456 385696410 /nfs/dbraw/zinc/69/64/10/385696410.db2.gz DVJSJULUMVTZTI-SNVBAGLBSA-N 1 2 229.270 2.273 20 0 BEADLO CS[C@@H](C)CC(=O)Nc1cccc2[nH+]ccn21 ZINC000270320253 385696893 /nfs/dbraw/zinc/69/68/93/385696893.db2.gz KNMUYDMGRLISHH-VIFPVBQESA-N 1 2 249.339 2.414 20 0 BEADLO CO[C@@H](C)C[N@@H+]1CCCC[C@@H]1C(F)F ZINC000337515290 385700160 /nfs/dbraw/zinc/70/01/60/385700160.db2.gz LLHSKDQHQMOGJV-DTWKUNHWSA-N 1 2 207.264 2.141 20 0 BEADLO CO[C@@H](C)C[N@H+]1CCCC[C@@H]1C(F)F ZINC000337515290 385700162 /nfs/dbraw/zinc/70/01/62/385700162.db2.gz LLHSKDQHQMOGJV-DTWKUNHWSA-N 1 2 207.264 2.141 20 0 BEADLO CCCc1noc(C[NH2+][C@H](C)c2cccnc2)n1 ZINC000182886852 385715388 /nfs/dbraw/zinc/71/53/88/385715388.db2.gz GYNZKSWGMINPIZ-SNVBAGLBSA-N 1 2 246.314 2.268 20 0 BEADLO Cc1ccc(NC(=O)c2cscn2)c(C)[nH+]1 ZINC000094666398 385727645 /nfs/dbraw/zinc/72/76/45/385727645.db2.gz BWESVNKJDUQYKN-UHFFFAOYSA-N 1 2 233.296 2.407 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2ccn(C)n2)cc1 ZINC000270824673 385749559 /nfs/dbraw/zinc/74/95/59/385749559.db2.gz RWOYPVQXRWVILM-UHFFFAOYSA-N 1 2 245.326 2.061 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2ccn(C)n2)cc1 ZINC000270824673 385749565 /nfs/dbraw/zinc/74/95/65/385749565.db2.gz RWOYPVQXRWVILM-UHFFFAOYSA-N 1 2 245.326 2.061 20 0 BEADLO Cn1ccc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)n1 ZINC000270990096 385768180 /nfs/dbraw/zinc/76/81/80/385768180.db2.gz HERZJTVCRGZTES-SECBINFHSA-N 1 2 247.264 2.194 20 0 BEADLO Cn1ccc(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)n1 ZINC000270990096 385768184 /nfs/dbraw/zinc/76/81/84/385768184.db2.gz HERZJTVCRGZTES-SECBINFHSA-N 1 2 247.264 2.194 20 0 BEADLO Cn1c[nH+]cc1CN1CCc2cc(F)ccc21 ZINC000282538863 385770898 /nfs/dbraw/zinc/77/08/98/385770898.db2.gz VWRRPNOKQXLSCW-UHFFFAOYSA-N 1 2 231.274 2.122 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@H](C)C2)cc1F ZINC000271045500 385775272 /nfs/dbraw/zinc/77/52/72/385775272.db2.gz PYFDKSWRQVTAQP-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@H](C)C2)cc1F ZINC000271045500 385775276 /nfs/dbraw/zinc/77/52/76/385775276.db2.gz PYFDKSWRQVTAQP-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1nonc1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC000271040805 385775879 /nfs/dbraw/zinc/77/58/79/385775879.db2.gz SUXQJCVBSQFKCW-CYBMUJFWSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1nonc1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000271040805 385775884 /nfs/dbraw/zinc/77/58/84/385775884.db2.gz SUXQJCVBSQFKCW-CYBMUJFWSA-N 1 2 244.298 2.110 20 0 BEADLO CCc1ccc(CC[NH2+]C(C)(C)C(=O)OC)cc1 ZINC000258907429 385777878 /nfs/dbraw/zinc/77/78/78/385777878.db2.gz YIXGQHLSEIPGDE-UHFFFAOYSA-N 1 2 249.354 2.333 20 0 BEADLO Cc1ccc(C[NH2+]Cc2ncnn2C(C)(C)C)o1 ZINC000282709019 385780649 /nfs/dbraw/zinc/78/06/49/385780649.db2.gz PKCPICGMPXFIGN-UHFFFAOYSA-N 1 2 248.330 2.224 20 0 BEADLO COC[C@@H](C)N(C)c1[nH+]c2ccccc2n1C ZINC000270565729 385719498 /nfs/dbraw/zinc/71/94/98/385719498.db2.gz LJGJQNCEOYKLQM-SNVBAGLBSA-N 1 2 233.315 2.044 20 0 BEADLO CCC1(O)CCN(c2[nH]c3ccccc3[nH+]2)CC1 ZINC000270577430 385719902 /nfs/dbraw/zinc/71/99/02/385719902.db2.gz OXYYUFFKIIDVMI-UHFFFAOYSA-N 1 2 245.326 2.304 20 0 BEADLO C[C@@H](O)C[C@@H]1CCCN1c1[nH]c2ccccc2[nH+]1 ZINC000270589913 385722433 /nfs/dbraw/zinc/72/24/33/385722433.db2.gz SKYJPDIXDXGPDL-MNOVXSKESA-N 1 2 245.326 2.303 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2nnc(C)[nH]2)s1 ZINC000271201658 385803529 /nfs/dbraw/zinc/80/35/29/385803529.db2.gz PVJROXMHFJZSAO-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2nnc(C)[nH]2)s1 ZINC000271201658 385803532 /nfs/dbraw/zinc/80/35/32/385803532.db2.gz PVJROXMHFJZSAO-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO C[C@H]([NH2+]Cc1cnn[nH]1)c1ccccc1Cl ZINC000283978845 385813837 /nfs/dbraw/zinc/81/38/37/385813837.db2.gz MGZJWBPAMTWNMK-QMMMGPOBSA-N 1 2 236.706 2.309 20 0 BEADLO CC[C@@H](C[N@H+](C)Cc1nccn1C(F)F)OC ZINC000412980624 385817052 /nfs/dbraw/zinc/81/70/52/385817052.db2.gz YDLGLAPQERPHTG-VIFPVBQESA-N 1 2 247.289 2.135 20 0 BEADLO CC[C@@H](C[N@@H+](C)Cc1nccn1C(F)F)OC ZINC000412980624 385817056 /nfs/dbraw/zinc/81/70/56/385817056.db2.gz YDLGLAPQERPHTG-VIFPVBQESA-N 1 2 247.289 2.135 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2ccccc2)s1 ZINC000271403734 385826050 /nfs/dbraw/zinc/82/60/50/385826050.db2.gz IOAFGWGENSNZHP-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2ccccc2)s1 ZINC000271403734 385826054 /nfs/dbraw/zinc/82/60/54/385826054.db2.gz IOAFGWGENSNZHP-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cnc(C[NH+]2CCSCC2)s1 ZINC000271472416 385831850 /nfs/dbraw/zinc/83/18/50/385831850.db2.gz HHVHJSLIAMVCDN-UHFFFAOYSA-N 1 2 214.359 2.000 20 0 BEADLO C[C@@H](NC(=O)C=Cc1c[nH]c[nH+]1)C1CCCC1 ZINC000283838499 385834420 /nfs/dbraw/zinc/83/44/20/385834420.db2.gz GPGSSSBZTUDKAB-VQCYPWCPSA-N 1 2 233.315 2.118 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@H]3C[C@H]32)s1 ZINC000644836585 385844349 /nfs/dbraw/zinc/84/43/49/385844349.db2.gz AKIVYUQFCODIEV-NEPJUHHUSA-N 1 2 223.341 2.284 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@H]3C[C@H]32)s1 ZINC000644836585 385844353 /nfs/dbraw/zinc/84/43/53/385844353.db2.gz AKIVYUQFCODIEV-NEPJUHHUSA-N 1 2 223.341 2.284 20 0 BEADLO CCCCC[NH2+][C@H](c1nnc[nH]1)c1cccnc1 ZINC000284035979 385847759 /nfs/dbraw/zinc/84/77/59/385847759.db2.gz JNJSWYUZTLXTKS-LBPRGKRZSA-N 1 2 245.330 2.069 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NCC(F)(F)F ZINC000232272392 385851894 /nfs/dbraw/zinc/85/18/94/385851894.db2.gz JYMDJQSPVUKLPL-UHFFFAOYSA-N 1 2 233.193 2.074 20 0 BEADLO COC(=O)[C@H]([NH2+]Cc1cccc(C)c1)C(C)C ZINC000069150225 385852826 /nfs/dbraw/zinc/85/28/26/385852826.db2.gz IVIPTDZRTDMUDQ-CYBMUJFWSA-N 1 2 235.327 2.282 20 0 BEADLO CCN(CCCn1cc[nH+]c1)CC(F)(F)F ZINC000271893385 385859016 /nfs/dbraw/zinc/85/90/16/385859016.db2.gz FFKSWNIXNAFKPA-UHFFFAOYSA-N 1 2 235.253 2.157 20 0 BEADLO Cc1c[nH+]cc(NCc2cnc(C)nc2)c1 ZINC000309683357 385789247 /nfs/dbraw/zinc/78/92/47/385789247.db2.gz GWAIFSWELVZZIS-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO Cn1ccc(C[N@@H+]2CCc3c(F)cccc3C2)n1 ZINC000271177813 385796382 /nfs/dbraw/zinc/79/63/82/385796382.db2.gz LAJHFIXBCIPJTH-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1ccc(C[N@H+]2CCc3c(F)cccc3C2)n1 ZINC000271177813 385796387 /nfs/dbraw/zinc/79/63/87/385796387.db2.gz LAJHFIXBCIPJTH-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO CC[C@@H]1CC[N@@H+]1Cc1cn2cccc(F)c2n1 ZINC000644843664 385884195 /nfs/dbraw/zinc/88/41/95/385884195.db2.gz MFQNPJQXZHLEFG-LLVKDONJSA-N 1 2 233.290 2.458 20 0 BEADLO CC[C@@H]1CC[N@H+]1Cc1cn2cccc(F)c2n1 ZINC000644843664 385884197 /nfs/dbraw/zinc/88/41/97/385884197.db2.gz MFQNPJQXZHLEFG-LLVKDONJSA-N 1 2 233.290 2.458 20 0 BEADLO Cc1ccc(F)cc1C[N@H+]1CCOC[C@@H]1C ZINC000272286129 385891181 /nfs/dbraw/zinc/89/11/81/385891181.db2.gz NMAGCVYUDHUPAU-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+]1CCOC[C@@H]1C ZINC000272286129 385891185 /nfs/dbraw/zinc/89/11/85/385891185.db2.gz NMAGCVYUDHUPAU-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO CCOc1cc(C(=O)Nc2cc[nH+]cc2C)on1 ZINC000294774646 385894597 /nfs/dbraw/zinc/89/45/97/385894597.db2.gz ZJXPKFDXQQTGHG-UHFFFAOYSA-N 1 2 247.254 2.029 20 0 BEADLO CC[C@H]1CCCCN1c1nc[nH+]c2c1OCCN2 ZINC000647844590 385895081 /nfs/dbraw/zinc/89/50/81/385895081.db2.gz LRRLHRIECUZWDS-JTQLQIEISA-N 1 2 248.330 2.050 20 0 BEADLO CC[C@H]1CCCCN1c1[nH+]cnc2c1OCCN2 ZINC000647844590 385895084 /nfs/dbraw/zinc/89/50/84/385895084.db2.gz LRRLHRIECUZWDS-JTQLQIEISA-N 1 2 248.330 2.050 20 0 BEADLO O=C(CCC1CC1)Nc1ccn2cc[nH+]c2c1 ZINC000294790192 385895945 /nfs/dbraw/zinc/89/59/45/385895945.db2.gz CLRNDXRZOQRSRU-UHFFFAOYSA-N 1 2 229.283 2.463 20 0 BEADLO CC(C)c1nnc(C[NH2+]Cc2ccsc2)[nH]1 ZINC000294807156 385897936 /nfs/dbraw/zinc/89/79/36/385897936.db2.gz NLOWKRWNPPWKCP-UHFFFAOYSA-N 1 2 236.344 2.279 20 0 BEADLO CC(C)(C)OC(=O)NCC[N@@H+]1CCC=C(F)C1 ZINC000272425470 385902096 /nfs/dbraw/zinc/90/20/96/385902096.db2.gz GZYDVIDFQRBUSC-UHFFFAOYSA-N 1 2 244.310 2.070 20 0 BEADLO CC(C)(C)OC(=O)NCC[N@H+]1CCC=C(F)C1 ZINC000272425470 385902097 /nfs/dbraw/zinc/90/20/97/385902097.db2.gz GZYDVIDFQRBUSC-UHFFFAOYSA-N 1 2 244.310 2.070 20 0 BEADLO Cc1sccc1C[NH2+]Cc1nnc(C2CC2)[nH]1 ZINC000294855082 385905841 /nfs/dbraw/zinc/90/58/41/385905841.db2.gz SLLMWFXWQGUHMS-UHFFFAOYSA-N 1 2 248.355 2.342 20 0 BEADLO CC[C@@H](C)[C@@H](C)C(=O)N(C)Cc1[nH+]ccn1C ZINC000272517047 385908123 /nfs/dbraw/zinc/90/81/23/385908123.db2.gz WXBLSUHBVQWHAP-GHMZBOCLSA-N 1 2 237.347 2.061 20 0 BEADLO Cc1cnccc1C[N@H+](C)Cc1nccs1 ZINC000294894749 385911553 /nfs/dbraw/zinc/91/15/53/385911553.db2.gz RPXCDOSWEWUEKY-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cnccc1C[N@@H+](C)Cc1nccs1 ZINC000294894749 385911560 /nfs/dbraw/zinc/91/15/60/385911560.db2.gz RPXCDOSWEWUEKY-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CC[C@@H](C)[C@@H](C)C(=O)NCCNc1cccc[nH+]1 ZINC000272579125 385914899 /nfs/dbraw/zinc/91/48/99/385914899.db2.gz OAWWRXDGGSSJCZ-VXGBXAGGSA-N 1 2 249.358 2.292 20 0 BEADLO CS[C@H]1CC[N@H+](Cc2nccn2C(F)F)C1 ZINC000294920790 385917184 /nfs/dbraw/zinc/91/71/84/385917184.db2.gz AVONLWBLRZFRMU-QMMMGPOBSA-N 1 2 247.314 2.216 20 0 BEADLO CS[C@H]1CC[N@@H+](Cc2nccn2C(F)F)C1 ZINC000294920790 385917189 /nfs/dbraw/zinc/91/71/89/385917189.db2.gz AVONLWBLRZFRMU-QMMMGPOBSA-N 1 2 247.314 2.216 20 0 BEADLO C[C@@H](O)c1cc(NCc2[nH]cc[nH+]2)ccc1F ZINC000285416510 385924254 /nfs/dbraw/zinc/92/42/54/385924254.db2.gz GGZXGNNHNCLFTH-MRVPVSSYSA-N 1 2 235.262 2.214 20 0 BEADLO CCC[C@@H]1CCC[C@H]1C(=O)NCc1[nH+]ccn1C ZINC000294503177 385859417 /nfs/dbraw/zinc/85/94/17/385859417.db2.gz HCIGBTDEPAZVNV-VXGBXAGGSA-N 1 2 249.358 2.253 20 0 BEADLO c1ccc2c(C[N@@H+]3CCO[C@H]4C[C@H]43)ccnc2c1 ZINC000644839178 385860447 /nfs/dbraw/zinc/86/04/47/385860447.db2.gz WPNLCLAXPAEZTL-CABCVRRESA-N 1 2 240.306 2.208 20 0 BEADLO c1ccc2c(C[N@H+]3CCO[C@H]4C[C@H]43)ccnc2c1 ZINC000644839178 385860451 /nfs/dbraw/zinc/86/04/51/385860451.db2.gz WPNLCLAXPAEZTL-CABCVRRESA-N 1 2 240.306 2.208 20 0 BEADLO C[N@H+](CCCCc1ccccc1)Cc1cnn[nH]1 ZINC000284341112 385863533 /nfs/dbraw/zinc/86/35/33/385863533.db2.gz REXBTFQYIQWGBD-UHFFFAOYSA-N 1 2 244.342 2.259 20 0 BEADLO C[N@@H+](CCCCc1ccccc1)Cc1cnn[nH]1 ZINC000284341112 385863537 /nfs/dbraw/zinc/86/35/37/385863537.db2.gz REXBTFQYIQWGBD-UHFFFAOYSA-N 1 2 244.342 2.259 20 0 BEADLO C[N@H+](CCCCc1ccccc1)Cc1c[nH]nn1 ZINC000284341112 385863540 /nfs/dbraw/zinc/86/35/40/385863540.db2.gz REXBTFQYIQWGBD-UHFFFAOYSA-N 1 2 244.342 2.259 20 0 BEADLO C[N@@H+](CCCCc1ccccc1)Cc1c[nH]nn1 ZINC000284341112 385863542 /nfs/dbraw/zinc/86/35/42/385863542.db2.gz REXBTFQYIQWGBD-UHFFFAOYSA-N 1 2 244.342 2.259 20 0 BEADLO C[N@H+](CCCCc1ccccc1)Cc1cn[nH]n1 ZINC000284341112 385863545 /nfs/dbraw/zinc/86/35/45/385863545.db2.gz REXBTFQYIQWGBD-UHFFFAOYSA-N 1 2 244.342 2.259 20 0 BEADLO C[N@@H+](CCCCc1ccccc1)Cc1cn[nH]n1 ZINC000284341112 385863548 /nfs/dbraw/zinc/86/35/48/385863548.db2.gz REXBTFQYIQWGBD-UHFFFAOYSA-N 1 2 244.342 2.259 20 0 BEADLO CC[C@H]1CCC[C@@H]1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000284335069 385864410 /nfs/dbraw/zinc/86/44/10/385864410.db2.gz IYNDCNVKCCJPRC-RIVSHMCHSA-N 1 2 233.315 2.118 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)CSC(F)F ZINC000294575048 385869315 /nfs/dbraw/zinc/86/93/15/385869315.db2.gz KGQXDMHQDGEIAY-UHFFFAOYSA-N 1 2 232.255 2.284 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N[C@@H]1CC12CCCCC2 ZINC000284442008 385869608 /nfs/dbraw/zinc/86/96/08/385869608.db2.gz QDSRNUJFQHVIBX-ZYOFXKKJSA-N 1 2 245.326 2.262 20 0 BEADLO CC[C@H]([NH2+]Cc1nccs1)c1ccn(C)n1 ZINC000336738400 385876180 /nfs/dbraw/zinc/87/61/80/385876180.db2.gz OFAVWQASENMEOL-VIFPVBQESA-N 1 2 236.344 2.118 20 0 BEADLO CC[C@H]([NH2+][C@@H]1CCCOCC1)C(F)(F)F ZINC000336747611 385978559 /nfs/dbraw/zinc/97/85/59/385978559.db2.gz CANWGKVINIOIRK-BDAKNGLRSA-N 1 2 225.254 2.486 20 0 BEADLO CC(C)c1nc(N[C@H]2CSC2(C)C)cc[nH+]1 ZINC000336748227 385983598 /nfs/dbraw/zinc/98/35/98/385983598.db2.gz SNKPZIWGXJIFRS-VIFPVBQESA-N 1 2 237.372 2.328 20 0 BEADLO CC(C)(C)c1nc(N[C@@H]2CC23CC3)cc[nH+]1 ZINC000644879620 385986991 /nfs/dbraw/zinc/98/69/91/385986991.db2.gz GDGTXGPWPSRQFJ-SECBINFHSA-N 1 2 217.316 2.160 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1cc[nH]c1C(C)C ZINC000286037914 385988796 /nfs/dbraw/zinc/98/87/96/385988796.db2.gz JOWJQBPIWOXAJT-UHFFFAOYSA-N 1 2 246.314 2.100 20 0 BEADLO CCOc1ncc(C)cc1NCc1[nH]cc[nH+]1 ZINC000295204774 385990933 /nfs/dbraw/zinc/99/09/33/385990933.db2.gz ZDSSSVWSCAOAJO-UHFFFAOYSA-N 1 2 232.287 2.124 20 0 BEADLO Cn1c2ccccc2[nH+]c1N1C[C@@H](F)[C@@H](F)C1 ZINC000294972824 385931940 /nfs/dbraw/zinc/93/19/40/385931940.db2.gz LEAIGAFMZMUMQC-DTORHVGOSA-N 1 2 237.253 2.070 20 0 BEADLO CC(C)n1cc(C[NH2+]Cc2ccccc2F)nn1 ZINC000289884183 385932420 /nfs/dbraw/zinc/93/24/20/385932420.db2.gz XISFMCVGVXWUOJ-UHFFFAOYSA-N 1 2 248.305 2.288 20 0 BEADLO C[C@@H]([NH2+]Cc1ccco1)c1cc2n(n1)CCC2 ZINC000414058985 385935814 /nfs/dbraw/zinc/93/58/14/385935814.db2.gz VLDNHFSSNMZHNG-SNVBAGLBSA-N 1 2 231.299 2.273 20 0 BEADLO CC[C@H]1CCC[N@@H+]1Cc1nc(C(F)F)no1 ZINC000425392462 385941677 /nfs/dbraw/zinc/94/16/77/385941677.db2.gz GWFDSONKUQXPJR-ZETCQYMHSA-N 1 2 231.246 2.382 20 0 BEADLO CC[C@H]1CCC[N@H+]1Cc1nc(C(F)F)no1 ZINC000425392462 385941679 /nfs/dbraw/zinc/94/16/79/385941679.db2.gz GWFDSONKUQXPJR-ZETCQYMHSA-N 1 2 231.246 2.382 20 0 BEADLO Cc1nnc([C@H](C)[N@H+](C)C[C@@H]2CCCO2)s1 ZINC000338292311 385944318 /nfs/dbraw/zinc/94/43/18/385944318.db2.gz ASDUASJCAMRRDL-WPRPVWTQSA-N 1 2 241.360 2.018 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+](C)C[C@@H]2CCCO2)s1 ZINC000338292311 385944321 /nfs/dbraw/zinc/94/43/21/385944321.db2.gz ASDUASJCAMRRDL-WPRPVWTQSA-N 1 2 241.360 2.018 20 0 BEADLO C[C@H](CCC1CC1)Nc1[nH+]cnc2c1cnn2C ZINC000337888338 385993524 /nfs/dbraw/zinc/99/35/24/385993524.db2.gz ZLKZJCZTNQWKKB-SECBINFHSA-N 1 2 245.330 2.354 20 0 BEADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1ncc[nH]1 ZINC000285618609 385949415 /nfs/dbraw/zinc/94/94/15/385949415.db2.gz XWJACCIKNDWZQO-UHFFFAOYSA-N 1 2 234.303 2.039 20 0 BEADLO CCN(C(=O)Cc1[nH]c[nH+]c1C)C1CCCC1 ZINC000285617290 385949502 /nfs/dbraw/zinc/94/95/02/385949502.db2.gz BGSFHZDMDKATIQ-UHFFFAOYSA-N 1 2 235.331 2.052 20 0 BEADLO Cc1ccc(NC(=O)[C@]2(C)CCCOC2)c(C)[nH+]1 ZINC000272946462 385956190 /nfs/dbraw/zinc/95/61/90/385956190.db2.gz LEWBNMZBBPFKLI-CQSZACIVSA-N 1 2 248.326 2.454 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CCCO[C@@H](C)C2)s1 ZINC000338318024 385965708 /nfs/dbraw/zinc/96/57/08/385965708.db2.gz UHJOKRZDSUFRQZ-IUCAKERBSA-N 1 2 241.360 2.018 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CCCO[C@@H](C)C2)s1 ZINC000338318024 385965713 /nfs/dbraw/zinc/96/57/13/385965713.db2.gz UHJOKRZDSUFRQZ-IUCAKERBSA-N 1 2 241.360 2.018 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CCCO[C@@H](C)C2)s1 ZINC000338318022 385968241 /nfs/dbraw/zinc/96/82/41/385968241.db2.gz UHJOKRZDSUFRQZ-DTWKUNHWSA-N 1 2 241.360 2.018 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CCCO[C@@H](C)C2)s1 ZINC000338318022 385968246 /nfs/dbraw/zinc/96/82/46/385968246.db2.gz UHJOKRZDSUFRQZ-DTWKUNHWSA-N 1 2 241.360 2.018 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2cc[nH]c2)s1 ZINC000336749099 385994501 /nfs/dbraw/zinc/99/45/01/385994501.db2.gz DUJCZZGWINYEOT-ZETCQYMHSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1noc(Cn2c[nH+]c3cc(C)c(C)cc32)n1 ZINC000073798781 386005878 /nfs/dbraw/zinc/00/58/78/386005878.db2.gz RYWRBYQKSAEAFC-UHFFFAOYSA-N 1 2 242.282 2.393 20 0 BEADLO Cc1ncc(C[N@@H+]2CCn3cccc3[C@@H]2C)cn1 ZINC000335068847 386014324 /nfs/dbraw/zinc/01/43/24/386014324.db2.gz ZNCILXSYFCVRRG-NSHDSACASA-N 1 2 242.326 2.163 20 0 BEADLO Cc1ncc(C[N@H+]2CCn3cccc3[C@@H]2C)cn1 ZINC000335068847 386014327 /nfs/dbraw/zinc/01/43/27/386014327.db2.gz ZNCILXSYFCVRRG-NSHDSACASA-N 1 2 242.326 2.163 20 0 BEADLO COC[C@H](C)[N@H+](C)Cc1c(F)ccc(O)c1F ZINC000295358595 386018368 /nfs/dbraw/zinc/01/83/68/386018368.db2.gz NONGLTIOTWUBAQ-QMMMGPOBSA-N 1 2 245.269 2.137 20 0 BEADLO COC[C@H](C)[N@@H+](C)Cc1c(F)ccc(O)c1F ZINC000295358595 386018370 /nfs/dbraw/zinc/01/83/70/386018370.db2.gz NONGLTIOTWUBAQ-QMMMGPOBSA-N 1 2 245.269 2.137 20 0 BEADLO Fc1ccccc1C[N@@H+]1CCOCC12CC2 ZINC000334433954 386056487 /nfs/dbraw/zinc/05/64/87/386056487.db2.gz DRHUXTGQRUYALF-UHFFFAOYSA-N 1 2 221.275 2.191 20 0 BEADLO Fc1ccccc1C[N@H+]1CCOCC12CC2 ZINC000334433954 386056494 /nfs/dbraw/zinc/05/64/94/386056494.db2.gz DRHUXTGQRUYALF-UHFFFAOYSA-N 1 2 221.275 2.191 20 0 BEADLO CCC[N@@H+]1CC(=O)N[C@@]12CCC[C@H](C1CC1)C2 ZINC000414177187 386021124 /nfs/dbraw/zinc/02/11/24/386021124.db2.gz FRMWHXZFEVWJMS-JSGCOSHPSA-N 1 2 236.359 2.125 20 0 BEADLO CCC[N@H+]1CC(=O)N[C@@]12CCC[C@H](C1CC1)C2 ZINC000414177187 386021128 /nfs/dbraw/zinc/02/11/28/386021128.db2.gz FRMWHXZFEVWJMS-JSGCOSHPSA-N 1 2 236.359 2.125 20 0 BEADLO c1ccc(N2CCC[C@H]2[C@H]2CCCO2)[nH+]c1 ZINC000286290338 386021237 /nfs/dbraw/zinc/02/12/37/386021237.db2.gz DAOIPICLHIIWKX-NWDGAFQWSA-N 1 2 218.300 2.229 20 0 BEADLO Cc1cc(CNC(=O)c2cscn2)cc(C)[nH+]1 ZINC000335071279 386021508 /nfs/dbraw/zinc/02/15/08/386021508.db2.gz AFSDQTITZDKPBJ-UHFFFAOYSA-N 1 2 247.323 2.085 20 0 BEADLO CCCC[N@@H+]1CC(=O)N[C@@]12CCC(C)(C)C2 ZINC000414181173 386021874 /nfs/dbraw/zinc/02/18/74/386021874.db2.gz MDOUDQDEBYWLAY-ZDUSSCGKSA-N 1 2 224.348 2.125 20 0 BEADLO CCCC[N@H+]1CC(=O)N[C@@]12CCC(C)(C)C2 ZINC000414181173 386021882 /nfs/dbraw/zinc/02/18/82/386021882.db2.gz MDOUDQDEBYWLAY-ZDUSSCGKSA-N 1 2 224.348 2.125 20 0 BEADLO Cc1cc(NC[C@@H]2CCCCC2(F)F)nc[nH+]1 ZINC000390888720 386022038 /nfs/dbraw/zinc/02/20/38/386022038.db2.gz XXJYGIAYFUOIAS-JTQLQIEISA-N 1 2 241.285 2.444 20 0 BEADLO CCC[N@@H+]1CC(=O)N[C@@]12CCC[C@H](CC)C2 ZINC000414187096 386027356 /nfs/dbraw/zinc/02/73/56/386027356.db2.gz QAMWESMZELLKIN-AAEUAGOBSA-N 1 2 224.348 2.125 20 0 BEADLO CCC[N@H+]1CC(=O)N[C@@]12CCC[C@H](CC)C2 ZINC000414187096 386027361 /nfs/dbraw/zinc/02/73/61/386027361.db2.gz QAMWESMZELLKIN-AAEUAGOBSA-N 1 2 224.348 2.125 20 0 BEADLO Fc1cc(F)cc(CN2CCn3cc[nH+]c3C2)c1 ZINC000334422643 386028767 /nfs/dbraw/zinc/02/87/67/386028767.db2.gz RFNSNVSXQPKIBA-UHFFFAOYSA-N 1 2 249.264 2.177 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+]C12CCC1(CC1)CC2 ZINC000414192213 386029733 /nfs/dbraw/zinc/02/97/33/386029733.db2.gz HHDLPSQZWXWUJT-UHFFFAOYSA-N 1 2 236.359 2.267 20 0 BEADLO C[C@@]1(CNc2cc[nH+]c3ccncc23)CCCO1 ZINC000447057807 386030778 /nfs/dbraw/zinc/03/07/78/386030778.db2.gz GKZMPCPFWNZMCN-AWEZNQCLSA-N 1 2 243.310 2.033 20 0 BEADLO Clc1cccc(C[N@H+](C2CC2)C2COC2)n1 ZINC000295462791 386037426 /nfs/dbraw/zinc/03/74/26/386037426.db2.gz QFUDZQNXSYDAIY-UHFFFAOYSA-N 1 2 238.718 2.098 20 0 BEADLO Clc1cccc(C[N@@H+](C2CC2)C2COC2)n1 ZINC000295462791 386037431 /nfs/dbraw/zinc/03/74/31/386037431.db2.gz QFUDZQNXSYDAIY-UHFFFAOYSA-N 1 2 238.718 2.098 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cn[nH]c1)c1nccs1 ZINC000222481570 386046187 /nfs/dbraw/zinc/04/61/87/386046187.db2.gz GHKSYTWQPGTCOP-JGVFFNPUSA-N 1 2 222.317 2.278 20 0 BEADLO Cc1nocc1C[N@@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000334432973 386052045 /nfs/dbraw/zinc/05/20/45/386052045.db2.gz LVZDZDFNFAJHEM-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1nocc1C[N@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000334432973 386052054 /nfs/dbraw/zinc/05/20/54/386052054.db2.gz LVZDZDFNFAJHEM-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO C[C@H]1C[N@H+](CC(=O)Nc2ccccc2F)[C@H]1C ZINC000334454002 386102221 /nfs/dbraw/zinc/10/22/21/386102221.db2.gz DWKVUPLQGPFYPP-UWVGGRQHSA-N 1 2 236.290 2.104 20 0 BEADLO C[C@H]1C[N@@H+](CC(=O)Nc2ccccc2F)[C@H]1C ZINC000334454002 386102223 /nfs/dbraw/zinc/10/22/23/386102223.db2.gz DWKVUPLQGPFYPP-UWVGGRQHSA-N 1 2 236.290 2.104 20 0 BEADLO CN(Cc1cccs1)C(=O)CCc1[nH]cc[nH+]1 ZINC000287250779 386106810 /nfs/dbraw/zinc/10/68/10/386106810.db2.gz UAIMQYKOGAHPKM-UHFFFAOYSA-N 1 2 249.339 2.062 20 0 BEADLO Cc1ccoc1C[NH2+][C@@H](CCO)c1ccco1 ZINC000274469591 386107478 /nfs/dbraw/zinc/10/74/78/386107478.db2.gz YWSNJUOIQRIATB-NSHDSACASA-N 1 2 235.283 2.394 20 0 BEADLO Cc1cc(CNc2ccc(C)[nH+]c2C)nn1C ZINC000414307435 386110881 /nfs/dbraw/zinc/11/08/81/386110881.db2.gz FDKFKLFIPIGQFH-UHFFFAOYSA-N 1 2 230.315 2.352 20 0 BEADLO CCc1cc(NCC2CCC(F)CC2)nc[nH+]1 ZINC000645390525 386112534 /nfs/dbraw/zinc/11/25/34/386112534.db2.gz SBVOQJATGVSUTP-UHFFFAOYSA-N 1 2 237.322 2.401 20 0 BEADLO Cc1ccc(CNC(=O)CCc2[nH]cc[nH+]2)s1 ZINC000287343024 386115052 /nfs/dbraw/zinc/11/50/52/386115052.db2.gz XRWFRAHFAIZWEE-UHFFFAOYSA-N 1 2 249.339 2.029 20 0 BEADLO CCC[C@](C)(CC)C(=O)NCc1c[nH+]c[nH]1 ZINC000356150138 386072788 /nfs/dbraw/zinc/07/27/88/386072788.db2.gz IDYPSNSZODSLNT-LBPRGKRZSA-N 1 2 223.320 2.242 20 0 BEADLO CCC[C@](C)(CC)C(=O)NCc1c[nH]c[nH+]1 ZINC000356150138 386072796 /nfs/dbraw/zinc/07/27/96/386072796.db2.gz IDYPSNSZODSLNT-LBPRGKRZSA-N 1 2 223.320 2.242 20 0 BEADLO CC(C)c1noc([C@@H](C)[NH2+][C@@H](C)c2cn[nH]c2)n1 ZINC000274152784 386077502 /nfs/dbraw/zinc/07/75/02/386077502.db2.gz YLYCWUYHODSYTJ-DTWKUNHWSA-N 1 2 249.318 2.328 20 0 BEADLO CC[C@H]1CCC[C@@H]1C(=O)NCc1[nH+]ccn1CC ZINC000295739222 386079596 /nfs/dbraw/zinc/07/95/96/386079596.db2.gz SMLFOEFJPFBKIR-RYUDHWBXSA-N 1 2 249.358 2.346 20 0 BEADLO CC[N@H+](C[C@@H]1CCNC(=O)CC1)c1ccccc1 ZINC000295742340 386079712 /nfs/dbraw/zinc/07/97/12/386079712.db2.gz YJVPFZSBAZGZNS-ZDUSSCGKSA-N 1 2 246.354 2.429 20 0 BEADLO CC[N@@H+](C[C@@H]1CCNC(=O)CC1)c1ccccc1 ZINC000295742340 386079717 /nfs/dbraw/zinc/07/97/17/386079717.db2.gz YJVPFZSBAZGZNS-ZDUSSCGKSA-N 1 2 246.354 2.429 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCOC[C@H]1C1CC1 ZINC000365408179 386080582 /nfs/dbraw/zinc/08/05/82/386080582.db2.gz BGFOINHCYYMIQV-AWEZNQCLSA-N 1 2 249.358 2.075 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCOC[C@H]1C1CC1 ZINC000365408179 386080585 /nfs/dbraw/zinc/08/05/85/386080585.db2.gz BGFOINHCYYMIQV-AWEZNQCLSA-N 1 2 249.358 2.075 20 0 BEADLO FC(F)(F)c1cc[nH+]c(N2CCO[C@H]3C[C@H]32)c1 ZINC000366108513 386085841 /nfs/dbraw/zinc/08/58/41/386085841.db2.gz ABTBGUJRLSAYQO-BDAKNGLRSA-N 1 2 244.216 2.078 20 0 BEADLO Cc1c(Cl)c(C[NH+]2CC(C3CC3)C2)nn1C ZINC000643293677 386088218 /nfs/dbraw/zinc/08/82/18/386088218.db2.gz XYQUIJQPMIWFSQ-UHFFFAOYSA-N 1 2 239.750 2.224 20 0 BEADLO Cc1ccsc1CNC(=O)CCc1[nH]cc[nH+]1 ZINC000287112215 386094924 /nfs/dbraw/zinc/09/49/24/386094924.db2.gz FLCYXULJXGLNLY-UHFFFAOYSA-N 1 2 249.339 2.029 20 0 BEADLO C[N@H+](Cc1nc(C(F)F)no1)[C@H]1CC1(C)C ZINC000425473559 386145618 /nfs/dbraw/zinc/14/56/18/386145618.db2.gz JFAAGAIXLUAZFP-LURJTMIESA-N 1 2 231.246 2.238 20 0 BEADLO C[N@@H+](Cc1nc(C(F)F)no1)[C@H]1CC1(C)C ZINC000425473559 386145624 /nfs/dbraw/zinc/14/56/24/386145624.db2.gz JFAAGAIXLUAZFP-LURJTMIESA-N 1 2 231.246 2.238 20 0 BEADLO c1nc(C[NH+]2CC(C3CCC3)C2)cs1 ZINC000335151309 386146105 /nfs/dbraw/zinc/14/61/05/386146105.db2.gz RIGFDKITDIWXBO-UHFFFAOYSA-N 1 2 208.330 2.375 20 0 BEADLO Cn1c2ccccc2[nH+]c1N[C@@H]1CCC[C@@H]1F ZINC000338824402 386146557 /nfs/dbraw/zinc/14/65/57/386146557.db2.gz NSDQNEMIBGLITL-VHSXEESVSA-N 1 2 233.290 2.298 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)C1=CCCCCC1 ZINC000274761768 386147024 /nfs/dbraw/zinc/14/70/24/386147024.db2.gz NOXOBXBGJMQDDN-GFCCVEGCSA-N 1 2 247.342 2.278 20 0 BEADLO C[N@@H+](Cc1ccon1)C[C@H]1CCC(C)(C)O1 ZINC000274804995 386151761 /nfs/dbraw/zinc/15/17/61/386151761.db2.gz SIPVHVBEYHMEQB-LLVKDONJSA-N 1 2 224.304 2.064 20 0 BEADLO C[N@H+](Cc1ccon1)C[C@H]1CCC(C)(C)O1 ZINC000274804995 386151768 /nfs/dbraw/zinc/15/17/68/386151768.db2.gz SIPVHVBEYHMEQB-LLVKDONJSA-N 1 2 224.304 2.064 20 0 BEADLO COc1ccncc1C[N@H+](C)Cc1cccnc1 ZINC000287889106 386153004 /nfs/dbraw/zinc/15/30/04/386153004.db2.gz UBTHLUZQJJIJMV-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1ccncc1C[N@@H+](C)Cc1cccnc1 ZINC000287889106 386153007 /nfs/dbraw/zinc/15/30/07/386153007.db2.gz UBTHLUZQJJIJMV-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ccc(C)nn2)o1 ZINC000414369039 386155185 /nfs/dbraw/zinc/15/51/85/386155185.db2.gz INWLHEWZHWJQKR-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ccc(C)nn2)o1 ZINC000414369039 386155188 /nfs/dbraw/zinc/15/51/88/386155188.db2.gz INWLHEWZHWJQKR-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CC(C)c1cnc(C[N@H+](C)[C@H]2CCOC2)s1 ZINC000346135041 386163760 /nfs/dbraw/zinc/16/37/60/386163760.db2.gz GNFMMULMUPPXQA-JTQLQIEISA-N 1 2 240.372 2.487 20 0 BEADLO CC(C)c1cnc(C[N@@H+](C)[C@H]2CCOC2)s1 ZINC000346135041 386163766 /nfs/dbraw/zinc/16/37/66/386163766.db2.gz GNFMMULMUPPXQA-JTQLQIEISA-N 1 2 240.372 2.487 20 0 BEADLO CC[C@@H]1CCC[C@H](Nc2nc(C)[nH+]c(N)n2)C1 ZINC000310214257 386165259 /nfs/dbraw/zinc/16/52/59/386165259.db2.gz FMRPRCKCABCLEO-ZJUUUORDSA-N 1 2 235.335 2.143 20 0 BEADLO CC[C@@H]1CCC[C@H](Nc2nc(N)nc(C)[nH+]2)C1 ZINC000310214257 386165263 /nfs/dbraw/zinc/16/52/63/386165263.db2.gz FMRPRCKCABCLEO-ZJUUUORDSA-N 1 2 235.335 2.143 20 0 BEADLO CC(C)(CNC(=O)CCn1cc[nH+]c1)C1CCC1 ZINC000296371522 386168758 /nfs/dbraw/zinc/16/87/58/386168758.db2.gz GYZHPZXQCSIAEK-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO CCc1ccc(C[N@H+](C)Cc2cnn(C)c2)nc1 ZINC000338884726 386174892 /nfs/dbraw/zinc/17/48/92/386174892.db2.gz UGKKMQAHHUJOQU-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO CCc1ccc(C[N@@H+](C)Cc2cnn(C)c2)nc1 ZINC000338884726 386174899 /nfs/dbraw/zinc/17/48/99/386174899.db2.gz UGKKMQAHHUJOQU-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N[C@@H]1CC12CCCCC2 ZINC000288247236 386178072 /nfs/dbraw/zinc/17/80/72/386178072.db2.gz BIQCEVNQCNLWOU-LLVKDONJSA-N 1 2 247.342 2.181 20 0 BEADLO CCc1cc(NC[C@](C)(OC)C2CC2)nc[nH+]1 ZINC000310406960 386178327 /nfs/dbraw/zinc/17/83/27/386178327.db2.gz OJSPQIZICXLQSC-ZDUSSCGKSA-N 1 2 235.331 2.266 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)[C@@H]1CC12CC2 ZINC000643305629 386178443 /nfs/dbraw/zinc/17/84/43/386178443.db2.gz BLEMOPRQPMMCPS-JTQLQIEISA-N 1 2 227.267 2.073 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)[C@]12C[C@H]1CCC2 ZINC000643305660 386179304 /nfs/dbraw/zinc/17/93/04/386179304.db2.gz HDXJAFFOWZRBTL-QMTHXVAHSA-N 1 2 241.294 2.463 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@H]2CCC(F)(F)C2)no1 ZINC000340280014 386187882 /nfs/dbraw/zinc/18/78/82/386187882.db2.gz SKSNRSVRMBOMJJ-VIFPVBQESA-N 1 2 245.273 2.245 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@H]2CCC(F)(F)C2)no1 ZINC000340280014 386187888 /nfs/dbraw/zinc/18/78/88/386187888.db2.gz SKSNRSVRMBOMJJ-VIFPVBQESA-N 1 2 245.273 2.245 20 0 BEADLO Cc1nc(CN2CCC[C@@H]2c2[nH]cc[nH+]2)oc1C ZINC000334466893 386128781 /nfs/dbraw/zinc/12/87/81/386128781.db2.gz VWQDEXNBILLCKL-LLVKDONJSA-N 1 2 246.314 2.352 20 0 BEADLO CC(C)C[C@@H](CO)N(C)c1cc[nH+]c(C2CC2)n1 ZINC000274654453 386136675 /nfs/dbraw/zinc/13/66/75/386136675.db2.gz DIHZEZVRCNZWDL-LBPRGKRZSA-N 1 2 249.358 2.197 20 0 BEADLO CCC[C@H](CC)NC(=O)CCc1[nH]cc[nH+]1 ZINC000287615072 386137540 /nfs/dbraw/zinc/13/75/40/386137540.db2.gz HOQZACKJBFXULP-JTQLQIEISA-N 1 2 223.320 2.037 20 0 BEADLO CC(=O)c1ccc(C[N@H+]2CCO[C@H](C)[C@@H]2C)cc1 ZINC000296840626 386205116 /nfs/dbraw/zinc/20/51/16/386205116.db2.gz STEGSHWCUBNVBN-WCQYABFASA-N 1 2 247.338 2.498 20 0 BEADLO CC(=O)c1ccc(C[N@@H+]2CCO[C@H](C)[C@@H]2C)cc1 ZINC000296840626 386205123 /nfs/dbraw/zinc/20/51/23/386205123.db2.gz STEGSHWCUBNVBN-WCQYABFASA-N 1 2 247.338 2.498 20 0 BEADLO Cc1cc(N[C@@H]2CC2(C)C)nc(C2CC2)[nH+]1 ZINC000336742698 386205822 /nfs/dbraw/zinc/20/58/22/386205822.db2.gz SFCIVJHGENMFAD-SNVBAGLBSA-N 1 2 217.316 2.295 20 0 BEADLO CC(=O)Nc1cccc([C@H](C)[NH+]2CCOCC2)c1 ZINC000264152062 386211562 /nfs/dbraw/zinc/21/15/62/386211562.db2.gz AKFVICKKBMXEGI-NSHDSACASA-N 1 2 248.326 2.038 20 0 BEADLO COC(C[N@H+](C)Cc1ccc(F)cc1F)OC ZINC000275544545 386221895 /nfs/dbraw/zinc/22/18/95/386221895.db2.gz HCOLRIXRKRFIHR-UHFFFAOYSA-N 1 2 245.269 2.016 20 0 BEADLO COC(C[N@@H+](C)Cc1ccc(F)cc1F)OC ZINC000275544545 386221898 /nfs/dbraw/zinc/22/18/98/386221898.db2.gz HCOLRIXRKRFIHR-UHFFFAOYSA-N 1 2 245.269 2.016 20 0 BEADLO FC(F)[C@@H]1CCC[N@@H+]1CCOC1CCC1 ZINC000347148563 386260462 /nfs/dbraw/zinc/26/04/62/386260462.db2.gz BABHWIHLBYLYRB-JTQLQIEISA-N 1 2 219.275 2.285 20 0 BEADLO FC(F)[C@@H]1CCC[N@H+]1CCOC1CCC1 ZINC000347148563 386260466 /nfs/dbraw/zinc/26/04/66/386260466.db2.gz BABHWIHLBYLYRB-JTQLQIEISA-N 1 2 219.275 2.285 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@@H](C3CC3)C2)nc1 ZINC000339090682 386241409 /nfs/dbraw/zinc/24/14/09/386241409.db2.gz KZLLXPOPXWCQTJ-OAHLLOKOSA-N 1 2 246.354 2.255 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@@H](C3CC3)C2)nc1 ZINC000339090682 386241414 /nfs/dbraw/zinc/24/14/14/386241414.db2.gz KZLLXPOPXWCQTJ-OAHLLOKOSA-N 1 2 246.354 2.255 20 0 BEADLO Cc1[nH]c(C(=O)NCC(C)(C)C(C)C)c[nH+]1 ZINC000275815155 386241677 /nfs/dbraw/zinc/24/16/77/386241677.db2.gz JCPSENMQFMKGRN-UHFFFAOYSA-N 1 2 223.320 2.130 20 0 BEADLO CC(C)C(C)(C)C(=O)NCCCn1cc[nH+]c1 ZINC000275818991 386244980 /nfs/dbraw/zinc/24/49/80/386244980.db2.gz PLQWHIHPMFPQRZ-UHFFFAOYSA-N 1 2 237.347 2.072 20 0 BEADLO CC[C@@H](NC(=O)Cc1[nH]c[nH+]c1C)[C@@H]1CC1(C)C ZINC000416279626 386256491 /nfs/dbraw/zinc/25/64/91/386256491.db2.gz URMHCOLBUNGUTA-WDEREUQCSA-N 1 2 249.358 2.202 20 0 BEADLO CC[C@@H](NC(=O)Cc1[nH+]c[nH]c1C)[C@@H]1CC1(C)C ZINC000416279626 386256497 /nfs/dbraw/zinc/25/64/97/386256497.db2.gz URMHCOLBUNGUTA-WDEREUQCSA-N 1 2 249.358 2.202 20 0 BEADLO Fc1cccc(CN2CCc3[nH+]c[nH]c3C2)c1F ZINC000647932851 386258373 /nfs/dbraw/zinc/25/83/73/386258373.db2.gz SDPHRXPVLHLOJV-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO C[N@H+](CCOc1ccccc1)Cc1cnns1 ZINC000289299223 386280724 /nfs/dbraw/zinc/28/07/24/386280724.db2.gz IARVEAMPOBZVTG-UHFFFAOYSA-N 1 2 249.339 2.049 20 0 BEADLO C[N@@H+](CCOc1ccccc1)Cc1cnns1 ZINC000289299223 386280726 /nfs/dbraw/zinc/28/07/26/386280726.db2.gz IARVEAMPOBZVTG-UHFFFAOYSA-N 1 2 249.339 2.049 20 0 BEADLO CSCC[N@H+](C)Cc1c(F)ccc(O)c1F ZINC000340585079 386285458 /nfs/dbraw/zinc/28/54/58/386285458.db2.gz ZMSHFRVZDVOUIT-UHFFFAOYSA-N 1 2 247.310 2.465 20 0 BEADLO CSCC[N@@H+](C)Cc1c(F)ccc(O)c1F ZINC000340585079 386285462 /nfs/dbraw/zinc/28/54/62/386285462.db2.gz ZMSHFRVZDVOUIT-UHFFFAOYSA-N 1 2 247.310 2.465 20 0 BEADLO CC(C)(C)C[C@H]1CC[N@H+](Cc2cn[nH]n2)C1 ZINC000452086374 386286851 /nfs/dbraw/zinc/28/68/51/386286851.db2.gz XMBNNGZQQFZJQZ-SNVBAGLBSA-N 1 2 222.336 2.063 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCC[C@H](F)C2)o1 ZINC000628326472 386289065 /nfs/dbraw/zinc/28/90/65/386289065.db2.gz ICUWDMNCSZZDNU-JTQLQIEISA-N 1 2 212.268 2.225 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCC[C@H](F)C2)o1 ZINC000628326472 386289069 /nfs/dbraw/zinc/28/90/69/386289069.db2.gz ICUWDMNCSZZDNU-JTQLQIEISA-N 1 2 212.268 2.225 20 0 BEADLO CC(C)[C@H](C)CC(=O)Nc1ccc(N)[nH+]c1 ZINC000236633512 386294589 /nfs/dbraw/zinc/29/45/89/386294589.db2.gz MWGJNVFIGKTOBV-SECBINFHSA-N 1 2 221.304 2.285 20 0 BEADLO C[C@@H]([NH2+][C@H]1/C=C/CCCCC1)c1ncn(C)n1 ZINC000334480532 386296552 /nfs/dbraw/zinc/29/65/52/386296552.db2.gz VDKZOMHBZJFHBX-OWVOXGNYSA-N 1 2 234.347 2.355 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2cnc(CC)nc2)CCO1 ZINC000414399726 386297232 /nfs/dbraw/zinc/29/72/32/386297232.db2.gz VVWDCKSADAIGMQ-ZDUSSCGKSA-N 1 2 249.358 2.040 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2cnc(CC)nc2)CCO1 ZINC000414399726 386297235 /nfs/dbraw/zinc/29/72/35/386297235.db2.gz VVWDCKSADAIGMQ-ZDUSSCGKSA-N 1 2 249.358 2.040 20 0 BEADLO CCn1c[nH+]cc1CNc1ccc(F)cn1 ZINC000416429718 386304726 /nfs/dbraw/zinc/30/47/26/386304726.db2.gz ZUMOMJKNXNSPOS-UHFFFAOYSA-N 1 2 220.251 2.049 20 0 BEADLO CC[C@@H](NC(=O)c1c[nH+]c(C)[nH]1)C(C)(C)C ZINC000339224741 386308722 /nfs/dbraw/zinc/30/87/22/386308722.db2.gz CMGXRLLEFRMALF-SNVBAGLBSA-N 1 2 223.320 2.273 20 0 BEADLO Cc1nonc1C[N@@H+](C)[C@@H](C)c1cccc(O)c1 ZINC000265132398 386309281 /nfs/dbraw/zinc/30/92/81/386309281.db2.gz NMSIDPXTVUVBDA-JTQLQIEISA-N 1 2 247.298 2.277 20 0 BEADLO Cc1nonc1C[N@H+](C)[C@@H](C)c1cccc(O)c1 ZINC000265132398 386309283 /nfs/dbraw/zinc/30/92/83/386309283.db2.gz NMSIDPXTVUVBDA-JTQLQIEISA-N 1 2 247.298 2.277 20 0 BEADLO CC[C@H](F)C[N@H+](CCOC)Cc1ccccn1 ZINC000347276039 386314240 /nfs/dbraw/zinc/31/42/40/386314240.db2.gz QQXGBVBQECMFBB-LBPRGKRZSA-N 1 2 240.322 2.278 20 0 BEADLO CC[C@H](F)C[N@@H+](CCOC)Cc1ccccn1 ZINC000347276039 386314244 /nfs/dbraw/zinc/31/42/44/386314244.db2.gz QQXGBVBQECMFBB-LBPRGKRZSA-N 1 2 240.322 2.278 20 0 BEADLO COC(=O)[C@H]([NH2+]Cc1cccc(C)c1C)C1CC1 ZINC000276407097 386316812 /nfs/dbraw/zinc/31/68/12/386316812.db2.gz DXJWOKOAGVVYAO-CQSZACIVSA-N 1 2 247.338 2.345 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)[C@@H](C)C(C)(C)C ZINC000265245722 386321683 /nfs/dbraw/zinc/32/16/83/386321683.db2.gz RFZCMSLYRAEDMK-GHMZBOCLSA-N 1 2 237.347 2.070 20 0 BEADLO COC(=O)[C@@H]([NH2+]Cc1ccc(C)c(C)c1)C1CC1 ZINC000276438256 386322973 /nfs/dbraw/zinc/32/29/73/386322973.db2.gz IHYIKZFDWROPMN-AWEZNQCLSA-N 1 2 247.338 2.345 20 0 BEADLO Cc1cc[nH+]c(NC[C@@H]2CCOC2)c1Cl ZINC000336731533 386325389 /nfs/dbraw/zinc/32/53/89/386325389.db2.gz KTVHWWVYJYITID-VIFPVBQESA-N 1 2 226.707 2.492 20 0 BEADLO CCCc1noc(Cc2ccc(C)[nH+]c2)n1 ZINC000264681860 386261717 /nfs/dbraw/zinc/26/17/17/386261717.db2.gz ZCXRWAHLXMCOAN-UHFFFAOYSA-N 1 2 217.272 2.316 20 0 BEADLO Cc1cnn(C)c1C[N@@H+]1CCn2cccc2[C@@H]1C ZINC000289115909 386262323 /nfs/dbraw/zinc/26/23/23/386262323.db2.gz NIGDQCUFOCFKCT-LBPRGKRZSA-N 1 2 244.342 2.107 20 0 BEADLO Cc1cnn(C)c1C[N@H+]1CCn2cccc2[C@@H]1C ZINC000289115909 386262326 /nfs/dbraw/zinc/26/23/26/386262326.db2.gz NIGDQCUFOCFKCT-LBPRGKRZSA-N 1 2 244.342 2.107 20 0 BEADLO Cc1cnn(C)c1C[N@H+](C)Cc1ccoc1C ZINC000289121052 386262394 /nfs/dbraw/zinc/26/23/94/386262394.db2.gz NRIRARXXOOPYIJ-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO Cc1cnn(C)c1C[N@@H+](C)Cc1ccoc1C ZINC000289121052 386262396 /nfs/dbraw/zinc/26/23/96/386262396.db2.gz NRIRARXXOOPYIJ-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO CC[C@@H](C)CN1CC[NH+](C2CCC2)CC1 ZINC000336649968 386262855 /nfs/dbraw/zinc/26/28/55/386262855.db2.gz SBEFVIUHVGLSJL-GFCCVEGCSA-N 1 2 210.365 2.203 20 0 BEADLO CCN(C[C@H]1CCCO1)c1cccc[nH+]1 ZINC000264805539 386270713 /nfs/dbraw/zinc/27/07/13/386270713.db2.gz DCXBOQOWQSGBMD-LLVKDONJSA-N 1 2 206.289 2.087 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@H]1CCOC1(C)C ZINC000297636611 386271102 /nfs/dbraw/zinc/27/11/02/386271102.db2.gz CSVHEFMXNQXSIX-NSHDSACASA-N 1 2 249.314 2.079 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cncc(F)c2)[C@@H](C)[C@@H](C)O1 ZINC000347181068 386272473 /nfs/dbraw/zinc/27/24/73/386272473.db2.gz JTVDTSWPNZCXTD-OUAUKWLOSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cncc(F)c2)[C@@H](C)[C@@H](C)O1 ZINC000347181068 386272477 /nfs/dbraw/zinc/27/24/77/386272477.db2.gz JTVDTSWPNZCXTD-OUAUKWLOSA-N 1 2 238.306 2.218 20 0 BEADLO CCC[C@H](CC)NC(=O)c1c[nH+]c(C)[nH]1 ZINC000264852278 386276119 /nfs/dbraw/zinc/27/61/19/386276119.db2.gz NFVBPZLJPAWXBI-VIFPVBQESA-N 1 2 209.293 2.027 20 0 BEADLO CCOc1nnc(C[N@H+](C)[C@@H](C)CC)s1 ZINC000336644639 386278603 /nfs/dbraw/zinc/27/86/03/386278603.db2.gz GVDPTDKCDCYBHZ-QMMMGPOBSA-N 1 2 229.349 2.167 20 0 BEADLO CCOc1nnc(C[N@@H+](C)[C@@H](C)CC)s1 ZINC000336644639 386278609 /nfs/dbraw/zinc/27/86/09/386278609.db2.gz GVDPTDKCDCYBHZ-QMMMGPOBSA-N 1 2 229.349 2.167 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ncnn2C)o1 ZINC000276535116 386340539 /nfs/dbraw/zinc/34/05/39/386340539.db2.gz DABDLHLDDAXBGK-NXEZZACHSA-N 1 2 234.303 2.128 20 0 BEADLO COC[C@H]([NH2+]Cc1conc1C)c1ccco1 ZINC000339291820 386347393 /nfs/dbraw/zinc/34/73/93/386347393.db2.gz YRNHKNLDSXSGLR-NSHDSACASA-N 1 2 236.271 2.053 20 0 BEADLO CC(C)[C@@H](NC(=O)[C@H]1[C@@H]2CCC[C@@H]21)c1[nH]cc[nH+]1 ZINC000276583236 386349538 /nfs/dbraw/zinc/34/95/38/386349538.db2.gz JPKOGSQSOOMFBC-NOOOWODRSA-N 1 2 247.342 2.269 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1)c1ncnn1C ZINC000276624738 386353727 /nfs/dbraw/zinc/35/37/27/386353727.db2.gz NFWCENJVCWHOHH-VHSXEESVSA-N 1 2 248.305 2.366 20 0 BEADLO CC(C)[C@H](NC(=O)C1CCC1)c1[nH]cc[nH+]1 ZINC000276610937 386354100 /nfs/dbraw/zinc/35/41/00/386354100.db2.gz MSYKEHBAQBZBKV-JTQLQIEISA-N 1 2 221.304 2.023 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)[C@@H]1C[C@H]1C1CC1 ZINC000334492571 386355277 /nfs/dbraw/zinc/35/52/77/386355277.db2.gz ONUKLYDXLCMYDA-WDEREUQCSA-N 1 2 241.294 2.319 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CCC[C@H]2CCC[C@@H]21 ZINC000276639140 386356100 /nfs/dbraw/zinc/35/61/00/386356100.db2.gz UPHKWSRSTCMZCO-VKYBYORPSA-N 1 2 245.326 2.214 20 0 BEADLO Cc1ccoc1C[N@@H+]1CCOC[C@H]1CC(F)F ZINC000289821782 386357776 /nfs/dbraw/zinc/35/77/76/386357776.db2.gz UAXUWHCITGRMKI-SNVBAGLBSA-N 1 2 245.269 2.444 20 0 BEADLO Cc1ccoc1C[N@H+]1CCOC[C@H]1CC(F)F ZINC000289821782 386357786 /nfs/dbraw/zinc/35/77/86/386357786.db2.gz UAXUWHCITGRMKI-SNVBAGLBSA-N 1 2 245.269 2.444 20 0 BEADLO Cc1ccc(C[NH2+][C@@]2(C)CCOC2=O)c(C)c1 ZINC000289838120 386362901 /nfs/dbraw/zinc/36/29/01/386362901.db2.gz OSBYQXCTYIVQTA-AWEZNQCLSA-N 1 2 233.311 2.099 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1cn(C(C)(C)C)nn1 ZINC000335272458 386363272 /nfs/dbraw/zinc/36/32/72/386363272.db2.gz ULYHCOURPXEJFN-NXEZZACHSA-N 1 2 222.336 2.016 20 0 BEADLO Cc1cnc(C[N@@H+](C)[C@@H](C)c2ccccn2)cn1 ZINC000336692459 386363668 /nfs/dbraw/zinc/36/36/68/386363668.db2.gz CSLPILTYRDLKQC-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cnc(C[N@H+](C)[C@@H](C)c2ccccn2)cn1 ZINC000336692459 386363670 /nfs/dbraw/zinc/36/36/70/386363670.db2.gz CSLPILTYRDLKQC-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO C[C@@H]1C[C@@H](O)C[N@@H+]1Cc1cc(F)c(F)cc1F ZINC000334495649 386375189 /nfs/dbraw/zinc/37/51/89/386375189.db2.gz SVGAPPBMFVHAGR-VXNVDRBHSA-N 1 2 245.244 2.059 20 0 BEADLO C[C@@H]1C[C@@H](O)C[N@H+]1Cc1cc(F)c(F)cc1F ZINC000334495649 386375193 /nfs/dbraw/zinc/37/51/93/386375193.db2.gz SVGAPPBMFVHAGR-VXNVDRBHSA-N 1 2 245.244 2.059 20 0 BEADLO CCCCN(CC)C(=O)C[N@@H+]1CC[C@@](C)(F)C1 ZINC000347385882 386375800 /nfs/dbraw/zinc/37/58/00/386375800.db2.gz PSPMWGUCJSTXAG-CYBMUJFWSA-N 1 2 244.354 2.069 20 0 BEADLO CCCCN(CC)C(=O)C[N@H+]1CC[C@@](C)(F)C1 ZINC000347385882 386375807 /nfs/dbraw/zinc/37/58/07/386375807.db2.gz PSPMWGUCJSTXAG-CYBMUJFWSA-N 1 2 244.354 2.069 20 0 BEADLO C[C@@H](CNC(=O)C1(C)CCCC1)Cn1cc[nH+]c1 ZINC000265822259 386375894 /nfs/dbraw/zinc/37/58/94/386375894.db2.gz OQQKELWVZKJRKV-LBPRGKRZSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1cc(NCCC(F)(F)F)nc(C2CC2)[nH+]1 ZINC000347384599 386377615 /nfs/dbraw/zinc/37/76/15/386377615.db2.gz NDBYPHYLJRQYDP-UHFFFAOYSA-N 1 2 245.248 2.449 20 0 BEADLO CCC(CC)NC(=O)[C@H](C)[N@@H+]1CC[C@](C)(F)C1 ZINC000347392795 386380110 /nfs/dbraw/zinc/38/01/10/386380110.db2.gz UUHHNLKCTGZUGK-GWCFXTLKSA-N 1 2 244.354 2.114 20 0 BEADLO CCC(CC)NC(=O)[C@H](C)[N@H+]1CC[C@](C)(F)C1 ZINC000347392795 386380112 /nfs/dbraw/zinc/38/01/12/386380112.db2.gz UUHHNLKCTGZUGK-GWCFXTLKSA-N 1 2 244.354 2.114 20 0 BEADLO COC[C@@H]1CCCN(c2cc[nH+]c(C(C)C)n2)C1 ZINC000112967453 386381813 /nfs/dbraw/zinc/38/18/13/386381813.db2.gz BSYMJVNIKCHCPV-GFCCVEGCSA-N 1 2 249.358 2.463 20 0 BEADLO CCCC[C@H](C(=O)OC)[N@@H+]1CC[C@](C)(F)C1 ZINC000347395446 386381812 /nfs/dbraw/zinc/38/18/12/386381812.db2.gz XJAUIVZTLWZQAQ-PWSUYJOCSA-N 1 2 231.311 2.152 20 0 BEADLO CCCC[C@H](C(=O)OC)[N@H+]1CC[C@](C)(F)C1 ZINC000347395446 386381815 /nfs/dbraw/zinc/38/18/15/386381815.db2.gz XJAUIVZTLWZQAQ-PWSUYJOCSA-N 1 2 231.311 2.152 20 0 BEADLO COC[C@H]1CCCN(c2cc[nH+]c(C(C)C)n2)C1 ZINC000112967451 386381899 /nfs/dbraw/zinc/38/18/99/386381899.db2.gz BSYMJVNIKCHCPV-LBPRGKRZSA-N 1 2 249.358 2.463 20 0 BEADLO C[N@H+](CC[C@@H]1CCCCO1)CC(F)F ZINC000347393916 386383192 /nfs/dbraw/zinc/38/31/92/386383192.db2.gz AUZLIKSDOYHTMJ-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO C[N@@H+](CC[C@@H]1CCCCO1)CC(F)F ZINC000347393916 386383195 /nfs/dbraw/zinc/38/31/95/386383195.db2.gz AUZLIKSDOYHTMJ-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO C[N@H+](CC(F)F)C[C@@H](O)CCc1ccccc1 ZINC000347399534 386384736 /nfs/dbraw/zinc/38/47/36/386384736.db2.gz LBLRGRQDUMZCOE-LBPRGKRZSA-N 1 2 243.297 2.177 20 0 BEADLO C[N@@H+](CC(F)F)C[C@@H](O)CCc1ccccc1 ZINC000347399534 386384742 /nfs/dbraw/zinc/38/47/42/386384742.db2.gz LBLRGRQDUMZCOE-LBPRGKRZSA-N 1 2 243.297 2.177 20 0 BEADLO C[N@H+](CC(F)F)C[C@H](O)CCc1ccccc1 ZINC000347399533 386385130 /nfs/dbraw/zinc/38/51/30/386385130.db2.gz LBLRGRQDUMZCOE-GFCCVEGCSA-N 1 2 243.297 2.177 20 0 BEADLO C[N@@H+](CC(F)F)C[C@H](O)CCc1ccccc1 ZINC000347399533 386385134 /nfs/dbraw/zinc/38/51/34/386385134.db2.gz LBLRGRQDUMZCOE-GFCCVEGCSA-N 1 2 243.297 2.177 20 0 BEADLO Cc1n[nH]cc1C[N@@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000289623835 386335708 /nfs/dbraw/zinc/33/57/08/386335708.db2.gz WMTORHAWBVICKW-ZDUSSCGKSA-N 1 2 245.330 2.168 20 0 BEADLO Cc1n[nH]cc1C[N@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000289623835 386335715 /nfs/dbraw/zinc/33/57/15/386335715.db2.gz WMTORHAWBVICKW-ZDUSSCGKSA-N 1 2 245.330 2.168 20 0 BEADLO Cc1c[nH]nc1C[N@H+](C)Cc1scnc1C ZINC000290449660 386436861 /nfs/dbraw/zinc/43/68/61/386436861.db2.gz OLOARVYCGJMYLX-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1c[nH]nc1C[N@@H+](C)Cc1scnc1C ZINC000290449660 386436866 /nfs/dbraw/zinc/43/68/66/386436866.db2.gz OLOARVYCGJMYLX-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO CN(C)c1ccccc1C[N@H+](C)Cc1ccon1 ZINC000266501158 386443083 /nfs/dbraw/zinc/44/30/83/386443083.db2.gz ANJBKWXNYQGJMC-UHFFFAOYSA-N 1 2 245.326 2.373 20 0 BEADLO CN(C)c1ccccc1C[N@@H+](C)Cc1ccon1 ZINC000266501158 386443086 /nfs/dbraw/zinc/44/30/86/386443086.db2.gz ANJBKWXNYQGJMC-UHFFFAOYSA-N 1 2 245.326 2.373 20 0 BEADLO CCc1ncc(C[N@H+](C)Cc2cccnc2)cn1 ZINC000414434488 386449074 /nfs/dbraw/zinc/44/90/74/386449074.db2.gz QWKHCAQNYFUPBI-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO CCc1ncc(C[N@@H+](C)Cc2cccnc2)cn1 ZINC000414434488 386449076 /nfs/dbraw/zinc/44/90/76/386449076.db2.gz QWKHCAQNYFUPBI-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO COC(=O)C[N@H+](C)[C@@H](C)c1ccc(C)cc1C ZINC000298838843 386388757 /nfs/dbraw/zinc/38/87/57/386388757.db2.gz DMLULQZAOVYJPJ-LBPRGKRZSA-N 1 2 235.327 2.469 20 0 BEADLO COC(=O)C[N@@H+](C)[C@@H](C)c1ccc(C)cc1C ZINC000298838843 386388759 /nfs/dbraw/zinc/38/87/59/386388759.db2.gz DMLULQZAOVYJPJ-LBPRGKRZSA-N 1 2 235.327 2.469 20 0 BEADLO CO[C@H]1CC[N@H+](Cc2ncc(C(C)(C)C)o2)C1 ZINC000336704707 386393853 /nfs/dbraw/zinc/39/38/53/386393853.db2.gz NMQDCWXMESLERI-JTQLQIEISA-N 1 2 238.331 2.193 20 0 BEADLO CO[C@H]1CC[N@@H+](Cc2ncc(C(C)(C)C)o2)C1 ZINC000336704707 386393855 /nfs/dbraw/zinc/39/38/55/386393855.db2.gz NMQDCWXMESLERI-JTQLQIEISA-N 1 2 238.331 2.193 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2cccs2)nc1 ZINC000336705436 386395780 /nfs/dbraw/zinc/39/57/80/386395780.db2.gz QJOQYVIPJIIFQJ-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2cccs2)nc1 ZINC000336705436 386395783 /nfs/dbraw/zinc/39/57/83/386395783.db2.gz QJOQYVIPJIIFQJ-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1ccc(F)cc1C ZINC000276971677 386397946 /nfs/dbraw/zinc/39/79/46/386397946.db2.gz YFVSRYJGMXLTRM-JTQLQIEISA-N 1 2 239.290 2.127 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1ccc(F)cc1C ZINC000276971677 386397949 /nfs/dbraw/zinc/39/79/49/386397949.db2.gz YFVSRYJGMXLTRM-JTQLQIEISA-N 1 2 239.290 2.127 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@@H]1CCC[C@@H](C)C1 ZINC000452570990 386400584 /nfs/dbraw/zinc/40/05/84/386400584.db2.gz NCWPKRSAMONQKO-VXGBXAGGSA-N 1 2 249.358 2.346 20 0 BEADLO COCC[C@H]([NH2+]Cc1cocn1)c1ccco1 ZINC000277084993 386404370 /nfs/dbraw/zinc/40/43/70/386404370.db2.gz UPVQZSMYTLILSN-NSHDSACASA-N 1 2 236.271 2.135 20 0 BEADLO CC[C@@H](C)C(=O)Nc1cccc2[nH+]ccn21 ZINC000266181915 386407764 /nfs/dbraw/zinc/40/77/64/386407764.db2.gz YIYNMHRRWAIBRX-SECBINFHSA-N 1 2 217.272 2.319 20 0 BEADLO CCOc1nnc(C[N@H+]2[C@H](C)CC[C@@H]2C)s1 ZINC000336707692 386413234 /nfs/dbraw/zinc/41/32/34/386413234.db2.gz TZKGFCZTOSTCKD-DTORHVGOSA-N 1 2 241.360 2.310 20 0 BEADLO CCOc1nnc(C[N@@H+]2[C@H](C)CC[C@@H]2C)s1 ZINC000336707692 386413239 /nfs/dbraw/zinc/41/32/39/386413239.db2.gz TZKGFCZTOSTCKD-DTORHVGOSA-N 1 2 241.360 2.310 20 0 BEADLO Cc1cc(NC(=O)N2C[C@H](C)[C@@H](C)[C@H]2C)cc[nH+]1 ZINC000416947582 386418900 /nfs/dbraw/zinc/41/89/00/386418900.db2.gz JFHBCBODMWTBAE-MVWJERBFSA-N 1 2 247.342 2.320 20 0 BEADLO Cc1cnc(C[N@@H+](C)[C@@H](C)c2cccnc2)nc1 ZINC000336708662 386418823 /nfs/dbraw/zinc/41/88/23/386418823.db2.gz LJAZPOPEYYSCQF-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cnc(C[N@H+](C)[C@@H](C)c2cccnc2)nc1 ZINC000336708662 386418830 /nfs/dbraw/zinc/41/88/30/386418830.db2.gz LJAZPOPEYYSCQF-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@@H]2CCCO2)c(C)s1 ZINC000336709496 386421376 /nfs/dbraw/zinc/42/13/76/386421376.db2.gz XIHHZTAFXVGTHC-NSHDSACASA-N 1 2 240.372 2.371 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@@H]2CCCO2)c(C)s1 ZINC000336709496 386421381 /nfs/dbraw/zinc/42/13/81/386421381.db2.gz XIHHZTAFXVGTHC-NSHDSACASA-N 1 2 240.372 2.371 20 0 BEADLO CCCC1(C(=O)N(C)Cc2[nH+]ccn2C)CCC1 ZINC000339433982 386425368 /nfs/dbraw/zinc/42/53/68/386425368.db2.gz VDJVLEOCLBHEAT-UHFFFAOYSA-N 1 2 249.358 2.349 20 0 BEADLO Cc1cnn(C)c1C[N@@H+](C)[C@@H](C)c1ccccn1 ZINC000290380812 386425942 /nfs/dbraw/zinc/42/59/42/386425942.db2.gz NWSMYHLFQGNPQF-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cnn(C)c1C[N@H+](C)[C@@H](C)c1ccccn1 ZINC000290380812 386425946 /nfs/dbraw/zinc/42/59/46/386425946.db2.gz NWSMYHLFQGNPQF-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1occc1C[N@@H+]1CCOC[C@H]1CC(F)F ZINC000414432749 386433506 /nfs/dbraw/zinc/43/35/06/386433506.db2.gz AETALSAOKGXENJ-LLVKDONJSA-N 1 2 245.269 2.444 20 0 BEADLO Cc1occc1C[N@H+]1CCOC[C@H]1CC(F)F ZINC000414432749 386433508 /nfs/dbraw/zinc/43/35/08/386433508.db2.gz AETALSAOKGXENJ-LLVKDONJSA-N 1 2 245.269 2.444 20 0 BEADLO CC1(C)C[C@H]1Nc1cc(N2CCCC2)nc[nH+]1 ZINC000277629139 386452457 /nfs/dbraw/zinc/45/24/57/386452457.db2.gz WXLUYTGGCYYEHC-SNVBAGLBSA-N 1 2 232.331 2.287 20 0 BEADLO CC1(C)C[C@H]1Nc1cc(N2CCCC2)[nH+]cn1 ZINC000277629139 386452466 /nfs/dbraw/zinc/45/24/66/386452466.db2.gz WXLUYTGGCYYEHC-SNVBAGLBSA-N 1 2 232.331 2.287 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1C[C@@H]1C1CC1 ZINC000340339402 386436312 /nfs/dbraw/zinc/43/63/12/386436312.db2.gz JIAAJBSDLQBZNL-VXGBXAGGSA-N 1 2 230.311 2.051 20 0 BEADLO O=C(CC1CC1)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000299570551 386467428 /nfs/dbraw/zinc/46/74/28/386467428.db2.gz BMOPASSMWKSPMB-LLVKDONJSA-N 1 2 233.315 2.263 20 0 BEADLO CC[C@H](COC)Nc1cc[nH+]c2ccncc12 ZINC000290759955 386471884 /nfs/dbraw/zinc/47/18/84/386471884.db2.gz JVMAUYNMXLXSFS-SNVBAGLBSA-N 1 2 231.299 2.467 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nnc(C3CC3)n2C2CC2)[C@H]1C ZINC000339572851 386472288 /nfs/dbraw/zinc/47/22/88/386472288.db2.gz YZZICTICTRNNLQ-ZJUUUORDSA-N 1 2 246.358 2.331 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nnc(C3CC3)n2C2CC2)[C@H]1C ZINC000339572851 386472295 /nfs/dbraw/zinc/47/22/95/386472295.db2.gz YZZICTICTRNNLQ-ZJUUUORDSA-N 1 2 246.358 2.331 20 0 BEADLO Cc1cc(N[C@@H](C)CCCO)nc(C(C)C)[nH+]1 ZINC000094944847 386472219 /nfs/dbraw/zinc/47/22/19/386472219.db2.gz NJZSCBHGMALYCY-JTQLQIEISA-N 1 2 237.347 2.481 20 0 BEADLO CCO[C@H](C)c1noc(C[N@@H+]2C[C@H](C)[C@H]2C)n1 ZINC000339578649 386472712 /nfs/dbraw/zinc/47/27/12/386472712.db2.gz CLGXUAXPMUQEDI-IVZWLZJFSA-N 1 2 239.319 2.007 20 0 BEADLO CCO[C@H](C)c1noc(C[N@H+]2C[C@H](C)[C@H]2C)n1 ZINC000339578649 386472718 /nfs/dbraw/zinc/47/27/18/386472718.db2.gz CLGXUAXPMUQEDI-IVZWLZJFSA-N 1 2 239.319 2.007 20 0 BEADLO CC[C@@H](CNc1cc(C)[nH+]c(C2CC2)n1)OC ZINC000290782024 386476334 /nfs/dbraw/zinc/47/63/34/386476334.db2.gz WLRGXDZVYYSMBG-NSHDSACASA-N 1 2 235.331 2.499 20 0 BEADLO Cc1cc(C)cc(Cc2noc(C[NH+](C)C)n2)c1 ZINC000277897904 386476385 /nfs/dbraw/zinc/47/63/85/386476385.db2.gz LSZYRAQVHPKWLC-UHFFFAOYSA-N 1 2 245.326 2.339 20 0 BEADLO CCOC(=O)[C@H]1CCC[N@@H+]1Cc1ccoc1C ZINC000414440541 386476552 /nfs/dbraw/zinc/47/65/52/386476552.db2.gz YKDUZXMDCVHMBK-GFCCVEGCSA-N 1 2 237.299 2.116 20 0 BEADLO CCOC(=O)[C@H]1CCC[N@H+]1Cc1ccoc1C ZINC000414440541 386476558 /nfs/dbraw/zinc/47/65/58/386476558.db2.gz YKDUZXMDCVHMBK-GFCCVEGCSA-N 1 2 237.299 2.116 20 0 BEADLO CCC[C@H](C)CC(=O)NCCNc1cccc[nH+]1 ZINC000299648716 386477555 /nfs/dbraw/zinc/47/75/55/386477555.db2.gz RTHRQVPIPLVUFR-LBPRGKRZSA-N 1 2 249.358 2.436 20 0 BEADLO CC(C)(C)n1cc(C[NH2+][C@@H]2CCC[C@@H]2F)nn1 ZINC000339583851 386488405 /nfs/dbraw/zinc/48/84/05/386488405.db2.gz JLRBZMHTNZCWSO-WDEREUQCSA-N 1 2 240.326 2.013 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H](C)c1cccs1 ZINC000267083630 386492535 /nfs/dbraw/zinc/49/25/35/386492535.db2.gz COYSSVJNHATTSI-QMMMGPOBSA-N 1 2 249.339 2.200 20 0 BEADLO C[NH+](C)Cc1nc(CC2=CCCCC2)no1 ZINC000278143797 386496072 /nfs/dbraw/zinc/49/60/72/386496072.db2.gz QXCSHSRFRGURRW-UHFFFAOYSA-N 1 2 221.304 2.174 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCC2(CCC2)C1 ZINC000519641448 386513997 /nfs/dbraw/zinc/51/39/97/386513997.db2.gz ATJQIFYSXLXIBY-UHFFFAOYSA-N 1 2 217.316 2.474 20 0 BEADLO CCN(C)C(=O)[C@@H]1CCc2[nH+]c(C(C)C)[nH]c2C1 ZINC000335447063 386515499 /nfs/dbraw/zinc/51/54/99/386515499.db2.gz FPRUMMBPVIHSFY-SNVBAGLBSA-N 1 2 249.358 2.116 20 0 BEADLO CCN(C)C(=O)[C@@H]1CCc2[nH]c(C(C)C)[nH+]c2C1 ZINC000335447063 386515502 /nfs/dbraw/zinc/51/55/02/386515502.db2.gz FPRUMMBPVIHSFY-SNVBAGLBSA-N 1 2 249.358 2.116 20 0 BEADLO CCOc1ccc(OC(=O)[C@H]2CCC[N@@H+]2C)cc1 ZINC000299474749 386454891 /nfs/dbraw/zinc/45/48/91/386454891.db2.gz FCJBPDOJUJDITQ-CYBMUJFWSA-N 1 2 249.310 2.085 20 0 BEADLO CCOc1ccc(OC(=O)[C@H]2CCC[N@H+]2C)cc1 ZINC000299474749 386454897 /nfs/dbraw/zinc/45/48/97/386454897.db2.gz FCJBPDOJUJDITQ-CYBMUJFWSA-N 1 2 249.310 2.085 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CCc2c(F)cccc2C1 ZINC000290578204 386455825 /nfs/dbraw/zinc/45/58/25/386455825.db2.gz ZGCGSXYPQSXEGC-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CCc2c(F)cccc2C1 ZINC000290578204 386455830 /nfs/dbraw/zinc/45/58/30/386455830.db2.gz ZGCGSXYPQSXEGC-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@@H](C)c2ccncc2)nn1C ZINC000336724356 386456978 /nfs/dbraw/zinc/45/69/78/386456978.db2.gz ZXHDVEQLTILFQZ-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cc(C[N@H+](C)[C@@H](C)c2ccncc2)nn1C ZINC000336724356 386456984 /nfs/dbraw/zinc/45/69/84/386456984.db2.gz ZXHDVEQLTILFQZ-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO CCc1ncc(C[N@@H+]2CCOC[C@]2(C)CC)cn1 ZINC000414439123 386462402 /nfs/dbraw/zinc/46/24/02/386462402.db2.gz WHJWZYFGBGHXOK-AWEZNQCLSA-N 1 2 249.358 2.040 20 0 BEADLO CCc1ncc(C[N@H+]2CCOC[C@]2(C)CC)cn1 ZINC000414439123 386462407 /nfs/dbraw/zinc/46/24/07/386462407.db2.gz WHJWZYFGBGHXOK-AWEZNQCLSA-N 1 2 249.358 2.040 20 0 BEADLO CCN(C(=O)Nc1ccn2cc[nH+]c2c1)C1CC1 ZINC000290644382 386464068 /nfs/dbraw/zinc/46/40/68/386464068.db2.gz JRJXJIIPRVNYAO-UHFFFAOYSA-N 1 2 244.298 2.351 20 0 BEADLO Cc1cnc(C[N@H+]2CCOC[C@@H]2CC(C)C)cn1 ZINC000336722667 386464134 /nfs/dbraw/zinc/46/41/34/386464134.db2.gz YPFJXHORBZAIQN-AWEZNQCLSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1cnc(C[N@@H+]2CCOC[C@@H]2CC(C)C)cn1 ZINC000336722667 386464137 /nfs/dbraw/zinc/46/41/37/386464137.db2.gz YPFJXHORBZAIQN-AWEZNQCLSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@@H](C)c2ccccn2)nn1C ZINC000336722678 386465111 /nfs/dbraw/zinc/46/51/11/386465111.db2.gz YQIMLONQURDNDT-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cc(C[N@H+](C)[C@@H](C)c2ccccn2)nn1C ZINC000336722678 386465116 /nfs/dbraw/zinc/46/51/16/386465116.db2.gz YQIMLONQURDNDT-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO CCN1CC[N@H+](Cc2ccc(C)cc2)[C@@H](C)C1=O ZINC000425913073 386574269 /nfs/dbraw/zinc/57/42/69/386574269.db2.gz FODNQXQTPINFCD-ZDUSSCGKSA-N 1 2 246.354 2.048 20 0 BEADLO CCN1CC[N@@H+](Cc2ccc(C)cc2)[C@@H](C)C1=O ZINC000425913073 386574274 /nfs/dbraw/zinc/57/42/74/386574274.db2.gz FODNQXQTPINFCD-ZDUSSCGKSA-N 1 2 246.354 2.048 20 0 BEADLO COCc1cccc(OCc2c[nH+]cn2C)c1 ZINC000267785360 386583899 /nfs/dbraw/zinc/58/38/99/386583899.db2.gz OMGOZEJSHALVJM-UHFFFAOYSA-N 1 2 232.283 2.146 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C(C)(C)CC(C)C ZINC000267807511 386586105 /nfs/dbraw/zinc/58/61/05/386586105.db2.gz LWFGEGXGGQMTAX-UHFFFAOYSA-N 1 2 237.347 2.407 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCCc2occc21)c1ncnn1C ZINC000278810377 386590528 /nfs/dbraw/zinc/59/05/28/386590528.db2.gz RXDPYHBULHCCSW-GXSJLCMTSA-N 1 2 246.314 2.136 20 0 BEADLO CS[C@@H]1CCN(c2nc(C)[nH+]c(C)c2C)C1 ZINC000335420443 386591922 /nfs/dbraw/zinc/59/19/22/386591922.db2.gz HYVKRXSVSMDJFN-LLVKDONJSA-N 1 2 237.372 2.344 20 0 BEADLO CO[C@](C)(C(=O)Nc1ccc(C)[nH+]c1C)C1CC1 ZINC000291349198 386536218 /nfs/dbraw/zinc/53/62/18/386536218.db2.gz NUJRFGPRSCABCQ-AWEZNQCLSA-N 1 2 248.326 2.452 20 0 BEADLO CC(C)c1nc(NC[C@@H]2CCSC2)cc[nH+]1 ZINC000336755695 386543076 /nfs/dbraw/zinc/54/30/76/386543076.db2.gz XWTTYSXLKAAPIC-JTQLQIEISA-N 1 2 237.372 2.187 20 0 BEADLO Cc1nnc(C[N@@H+](C)[C@@H]2CCc3ccccc32)[nH]1 ZINC000278549422 386544851 /nfs/dbraw/zinc/54/48/51/386544851.db2.gz SZYWZYRXQHVAQQ-CYBMUJFWSA-N 1 2 242.326 2.232 20 0 BEADLO Cc1nnc(C[N@H+](C)[C@@H]2CCc3ccccc32)[nH]1 ZINC000278549422 386544858 /nfs/dbraw/zinc/54/48/58/386544858.db2.gz SZYWZYRXQHVAQQ-CYBMUJFWSA-N 1 2 242.326 2.232 20 0 BEADLO C[C@H](O)CCN(C)c1cc(C(F)(F)F)cc[nH+]1 ZINC000135817684 386549421 /nfs/dbraw/zinc/54/94/21/386549421.db2.gz DCZOPKATIHNPCF-QMMMGPOBSA-N 1 2 248.248 2.308 20 0 BEADLO Cc1ccc(C[NH+]2CC(O)(c3ccccc3)C2)o1 ZINC000291517878 386553931 /nfs/dbraw/zinc/55/39/31/386553931.db2.gz IUHKUZKXKACPOV-UHFFFAOYSA-N 1 2 243.306 2.291 20 0 BEADLO C/C=C(\C)C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000267558774 386554402 /nfs/dbraw/zinc/55/44/02/386554402.db2.gz GCVPZPYUSLDVOR-XCVCLJGOSA-N 1 2 233.315 2.082 20 0 BEADLO CC(=O)c1cccc(C[N@@H+]2CC[C@@H](F)C2)c1 ZINC000335467208 386555435 /nfs/dbraw/zinc/55/54/35/386555435.db2.gz COEXJRWUZSJOTF-CYBMUJFWSA-N 1 2 221.275 2.433 20 0 BEADLO CC(=O)c1cccc(C[N@H+]2CC[C@@H](F)C2)c1 ZINC000335467208 386555442 /nfs/dbraw/zinc/55/54/42/386555442.db2.gz COEXJRWUZSJOTF-CYBMUJFWSA-N 1 2 221.275 2.433 20 0 BEADLO COC(C)(C)CN(C)c1cc[nH+]c(C2CC2)n1 ZINC000519797093 386557690 /nfs/dbraw/zinc/55/76/90/386557690.db2.gz YNJAJYWDRYKBJR-UHFFFAOYSA-N 1 2 235.331 2.215 20 0 BEADLO Cc1csc(C[NH2+]Cc2ccoc2)n1 ZINC000062103541 386565453 /nfs/dbraw/zinc/56/54/53/386565453.db2.gz RCPKSONAXPLFFR-UHFFFAOYSA-N 1 2 208.286 2.334 20 0 BEADLO Cc1ccsc1C[N@@H+]1CCn2cncc2C1 ZINC000291665757 386566472 /nfs/dbraw/zinc/56/64/72/386566472.db2.gz VWGNASIVFAQKMU-UHFFFAOYSA-N 1 2 233.340 2.269 20 0 BEADLO Cc1ccsc1C[N@H+]1CCn2cncc2C1 ZINC000291665757 386566477 /nfs/dbraw/zinc/56/64/77/386566477.db2.gz VWGNASIVFAQKMU-UHFFFAOYSA-N 1 2 233.340 2.269 20 0 BEADLO Cc1ccsc1CN1CCn2c[nH+]cc2C1 ZINC000291665757 386566483 /nfs/dbraw/zinc/56/64/83/386566483.db2.gz VWGNASIVFAQKMU-UHFFFAOYSA-N 1 2 233.340 2.269 20 0 BEADLO NC(=O)c1csc(C[N@@H+]2CC[C@@H](F)C2)c1 ZINC000335408925 386570529 /nfs/dbraw/zinc/57/05/29/386570529.db2.gz GJUSZLXLXFABNL-MRVPVSSYSA-N 1 2 228.292 2.175 20 0 BEADLO NC(=O)c1csc(C[N@H+]2CC[C@@H](F)C2)c1 ZINC000335408925 386570535 /nfs/dbraw/zinc/57/05/35/386570535.db2.gz GJUSZLXLXFABNL-MRVPVSSYSA-N 1 2 228.292 2.175 20 0 BEADLO Cc1nnc(C[N@@H+](C)[C@@H](C)c2ccccc2)[nH]1 ZINC000267669026 386572094 /nfs/dbraw/zinc/57/20/94/386572094.db2.gz VBCFPKYUEDXOEZ-JTQLQIEISA-N 1 2 230.315 2.306 20 0 BEADLO Cc1nnc(C[N@H+](C)[C@@H](C)c2ccccc2)[nH]1 ZINC000267669026 386572098 /nfs/dbraw/zinc/57/20/98/386572098.db2.gz VBCFPKYUEDXOEZ-JTQLQIEISA-N 1 2 230.315 2.306 20 0 BEADLO Cn1c[nH+]cc1C[S@](=O)C1CCCCC1 ZINC000268184723 386630283 /nfs/dbraw/zinc/63/02/83/386630283.db2.gz LWBOPNQVXIEFHY-HNNXBMFYSA-N 1 2 226.345 2.002 20 0 BEADLO CC[C@H](C)C[C@@H](CO)Nc1cccc[nH+]1 ZINC000645354667 386631228 /nfs/dbraw/zinc/63/12/28/386631228.db2.gz AVAXGFPUGMJFAI-QWRGUYRKSA-N 1 2 208.305 2.291 20 0 BEADLO Cn1ncc2c1nc[nH+]c2SCCC1CC1 ZINC000340667029 386643537 /nfs/dbraw/zinc/64/35/37/386643537.db2.gz KQOQIRHXAIZINL-UHFFFAOYSA-N 1 2 234.328 2.256 20 0 BEADLO CC(C)[C@H](C)N(C(=O)CCc1[nH]cc[nH+]1)C1CC1 ZINC000279179433 386643961 /nfs/dbraw/zinc/64/39/61/386643961.db2.gz IBJAVYCZMTYDFP-NSHDSACASA-N 1 2 249.358 2.378 20 0 BEADLO CCSCC[NH2+]C(C)(C)c1noc(CC)n1 ZINC000336782599 386648243 /nfs/dbraw/zinc/64/82/43/386648243.db2.gz YECAYKIYKVTWAB-UHFFFAOYSA-N 1 2 243.376 2.210 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)C[C@@H]1CC[C@@H](C)C1 ZINC000268432637 386650584 /nfs/dbraw/zinc/65/05/84/386650584.db2.gz NRUNEAZKLIMWAA-FRRDWIJNSA-N 1 2 249.358 2.214 20 0 BEADLO CC[N@H+](CC[C@@H]1CCOC1=O)c1ccccc1 ZINC000267952155 386602003 /nfs/dbraw/zinc/60/20/03/386602003.db2.gz KFJINPACEJXREZ-GFCCVEGCSA-N 1 2 233.311 2.466 20 0 BEADLO CC[N@@H+](CC[C@@H]1CCOC1=O)c1ccccc1 ZINC000267952155 386602012 /nfs/dbraw/zinc/60/20/12/386602012.db2.gz KFJINPACEJXREZ-GFCCVEGCSA-N 1 2 233.311 2.466 20 0 BEADLO Cc1ccc(NC(=O)C2CCOCC2)c(C)[nH+]1 ZINC000267967207 386604404 /nfs/dbraw/zinc/60/44/04/386604404.db2.gz ARDXBYJQAPTIIC-UHFFFAOYSA-N 1 2 234.299 2.064 20 0 BEADLO CC[C@H](OC)C(=O)Nc1ccc(C)[nH+]c1C ZINC000267983079 386607353 /nfs/dbraw/zinc/60/73/53/386607353.db2.gz GQAVGHFLNSVDBR-NSHDSACASA-N 1 2 222.288 2.062 20 0 BEADLO CC[C@](C)(O)CNc1cc[nH+]c2ccncc12 ZINC000267980423 386607537 /nfs/dbraw/zinc/60/75/37/386607537.db2.gz OYDCGKTVTBEMNM-ZDUSSCGKSA-N 1 2 231.299 2.203 20 0 BEADLO CC[C@H]1C[N@H+](Cc2nc(C)cs2)C[C@H](C)O1 ZINC000268020113 386610619 /nfs/dbraw/zinc/61/06/19/386610619.db2.gz JBMJCKSIGNMADT-QWRGUYRKSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2nc(C)cs2)C[C@H](C)O1 ZINC000268020113 386610627 /nfs/dbraw/zinc/61/06/27/386610627.db2.gz JBMJCKSIGNMADT-QWRGUYRKSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1ccc(NC(=O)[C@H](C)n2cccn2)c(C)[nH+]1 ZINC000268033663 386611340 /nfs/dbraw/zinc/61/13/40/386611340.db2.gz YQDFHZMYYDOUMX-NSHDSACASA-N 1 2 244.298 2.095 20 0 BEADLO CCN(CC(C)(C)C)C(=O)Cc1[nH]c[nH+]c1C ZINC000292024064 386611491 /nfs/dbraw/zinc/61/14/91/386611491.db2.gz BMWSVOPLKSCNMM-UHFFFAOYSA-N 1 2 237.347 2.155 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccnn2C(C)C)CCO1 ZINC000337127740 386616437 /nfs/dbraw/zinc/61/64/37/386616437.db2.gz HNCNHIHDSZTOCY-CYBMUJFWSA-N 1 2 237.347 2.075 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccnn2C(C)C)CCO1 ZINC000337127740 386616442 /nfs/dbraw/zinc/61/64/42/386616442.db2.gz HNCNHIHDSZTOCY-CYBMUJFWSA-N 1 2 237.347 2.075 20 0 BEADLO Cc1ccoc1C[N@H+](C)Cc1ccno1 ZINC000292060293 386617566 /nfs/dbraw/zinc/61/75/66/386617566.db2.gz BQJJRQQGPHLIFK-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO Cc1ccoc1C[N@@H+](C)Cc1ccno1 ZINC000292060293 386617573 /nfs/dbraw/zinc/61/75/73/386617573.db2.gz BQJJRQQGPHLIFK-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO CC(C)n1cncc1C[N@@H+]1CCOC[C@H]1C1CC1 ZINC000425330279 386662807 /nfs/dbraw/zinc/66/28/07/386662807.db2.gz BFMBGWSEBLZACS-AWEZNQCLSA-N 1 2 249.358 2.075 20 0 BEADLO CC(C)n1cncc1C[N@H+]1CCOC[C@H]1C1CC1 ZINC000425330279 386662811 /nfs/dbraw/zinc/66/28/11/386662811.db2.gz BFMBGWSEBLZACS-AWEZNQCLSA-N 1 2 249.358 2.075 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)c1nc2cc(F)ccc2o1 ZINC000428123887 386665425 /nfs/dbraw/zinc/66/54/25/386665425.db2.gz YGZABFBFBZASPS-UHFFFAOYSA-N 1 2 246.245 2.326 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)CC1CCOCC1 ZINC000335527079 386671386 /nfs/dbraw/zinc/67/13/86/386671386.db2.gz FLUZXRONKPBYCA-UHFFFAOYSA-N 1 2 248.326 2.454 20 0 BEADLO CCc1ccc(C[NH2+]Cc2ccn(CC)n2)o1 ZINC000414478467 386673363 /nfs/dbraw/zinc/67/33/63/386673363.db2.gz FZYPCULMVIWENV-UHFFFAOYSA-N 1 2 233.315 2.348 20 0 BEADLO COc1cc(C)[nH+]c(CN(C)CCSC)c1 ZINC000339825761 386674087 /nfs/dbraw/zinc/67/40/87/386674087.db2.gz XZGMXXMZPWVGKJ-UHFFFAOYSA-N 1 2 240.372 2.193 20 0 BEADLO CCn1nccc1C[NH+]1CC(C)(CC(F)F)C1 ZINC000648059114 386674253 /nfs/dbraw/zinc/67/42/53/386674253.db2.gz XQFBOXLMRWARSG-UHFFFAOYSA-N 1 2 243.301 2.380 20 0 BEADLO Cc1nocc1C[NH+]1CC(C)(CC(F)F)C1 ZINC000648058838 386680417 /nfs/dbraw/zinc/68/04/17/386680417.db2.gz GPNPMBMPBHEYRI-UHFFFAOYSA-N 1 2 230.258 2.460 20 0 BEADLO CC[C@H]1CCC[C@H](CNCC(F)(F)C[NH3+])C1 ZINC000414927438 386681509 /nfs/dbraw/zinc/68/15/09/386681509.db2.gz LCMCJNCCFKZXFX-QWRGUYRKSA-N 1 2 234.334 2.386 20 0 BEADLO CCc1ncc(C[NH2+][C@@H](C)C(C)(F)F)cn1 ZINC000414473372 386658900 /nfs/dbraw/zinc/65/89/00/386658900.db2.gz VFYBVZLJCAGTLV-QMMMGPOBSA-N 1 2 229.274 2.172 20 0 BEADLO CC[C@@H](NC(=O)[C@@H](C)C(C)(F)F)c1[nH]cc[nH+]1 ZINC000328534671 386684400 /nfs/dbraw/zinc/68/44/00/386684400.db2.gz ZPMTVIIPFCSALV-HTQZYQBOSA-N 1 2 245.273 2.268 20 0 BEADLO COc1ccc(C[N@@H+]2CCO[C@@H](C)C2)c(F)c1 ZINC000520593416 386698043 /nfs/dbraw/zinc/69/80/43/386698043.db2.gz UWOGGCXCMTURKA-JTQLQIEISA-N 1 2 239.290 2.055 20 0 BEADLO COc1ccc(C[N@H+]2CCO[C@@H](C)C2)c(F)c1 ZINC000520593416 386698045 /nfs/dbraw/zinc/69/80/45/386698045.db2.gz UWOGGCXCMTURKA-JTQLQIEISA-N 1 2 239.290 2.055 20 0 BEADLO c1ncc(C[NH2+][C@H]2CCCc3cn[nH]c32)s1 ZINC000269001009 386698722 /nfs/dbraw/zinc/69/87/22/386698722.db2.gz ZOWNPVPFJVMZQG-JTQLQIEISA-N 1 2 234.328 2.033 20 0 BEADLO CC(C)(C(=O)NCc1c[nH+]c[nH]1)C1CCCC1 ZINC000330480015 386730614 /nfs/dbraw/zinc/73/06/14/386730614.db2.gz ZWPZKAFABJHUMV-UHFFFAOYSA-N 1 2 235.331 2.242 20 0 BEADLO CC(C)(C(=O)NCc1c[nH]c[nH+]1)C1CCCC1 ZINC000330480015 386730618 /nfs/dbraw/zinc/73/06/18/386730618.db2.gz ZWPZKAFABJHUMV-UHFFFAOYSA-N 1 2 235.331 2.242 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@H]2C[C@H]2c2ccccc2)no1 ZINC000268978631 386730736 /nfs/dbraw/zinc/73/07/36/386730736.db2.gz QAEFURQJQKTFLM-STQMWFEESA-N 1 2 243.310 2.366 20 0 BEADLO Cc1nc(C[N@H+](C)[C@H]2C[C@H]2c2ccccc2)no1 ZINC000268978631 386730743 /nfs/dbraw/zinc/73/07/43/386730743.db2.gz QAEFURQJQKTFLM-STQMWFEESA-N 1 2 243.310 2.366 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@]3(CC[C@@H](C)C3)C2)no1 ZINC000334140557 386740675 /nfs/dbraw/zinc/74/06/75/386740675.db2.gz HFGZVYGXALLNHA-MFKMUULPSA-N 1 2 235.331 2.390 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@]3(CC[C@@H](C)C3)C2)no1 ZINC000334140557 386740678 /nfs/dbraw/zinc/74/06/78/386740678.db2.gz HFGZVYGXALLNHA-MFKMUULPSA-N 1 2 235.331 2.390 20 0 BEADLO CC[C@H]1CCC[C@H]1NC(=O)CCc1c[nH+]cn1C ZINC000279819854 386740863 /nfs/dbraw/zinc/74/08/63/386740863.db2.gz IFFBFQFFOHDDBT-WCQYABFASA-N 1 2 249.358 2.048 20 0 BEADLO C[C@@]1(O)CCC[N@H+](Cc2csc(Cl)n2)C1 ZINC000296419322 386712824 /nfs/dbraw/zinc/71/28/24/386712824.db2.gz XHXUMPQPXQDTOQ-SNVBAGLBSA-N 1 2 246.763 2.143 20 0 BEADLO C[C@@]1(O)CCC[N@@H+](Cc2csc(Cl)n2)C1 ZINC000296419322 386712829 /nfs/dbraw/zinc/71/28/29/386712829.db2.gz XHXUMPQPXQDTOQ-SNVBAGLBSA-N 1 2 246.763 2.143 20 0 BEADLO COC(=O)CC1(C[N@@H+]2CCC[C@@H]2C(F)F)CC1 ZINC000353194874 386714608 /nfs/dbraw/zinc/71/46/08/386714608.db2.gz PYWHVIWSSNFPPG-SECBINFHSA-N 1 2 247.285 2.059 20 0 BEADLO COC(=O)CC1(C[N@H+]2CCC[C@@H]2C(F)F)CC1 ZINC000353194874 386714614 /nfs/dbraw/zinc/71/46/14/386714614.db2.gz PYWHVIWSSNFPPG-SECBINFHSA-N 1 2 247.285 2.059 20 0 BEADLO FC1(C[N@@H+]2CCO[C@@H](Cc3ccccc3)C2)CC1 ZINC000526983844 386716029 /nfs/dbraw/zinc/71/60/29/386716029.db2.gz GUEGKSHBIOUOMT-AWEZNQCLSA-N 1 2 249.329 2.432 20 0 BEADLO FC1(C[N@H+]2CCO[C@@H](Cc3ccccc3)C2)CC1 ZINC000526983844 386716032 /nfs/dbraw/zinc/71/60/32/386716032.db2.gz GUEGKSHBIOUOMT-AWEZNQCLSA-N 1 2 249.329 2.432 20 0 BEADLO c1nn[nH]c1CC[N@@H+]1CCC[C@@H]1C1CCCCC1 ZINC000647959913 386719787 /nfs/dbraw/zinc/71/97/87/386719787.db2.gz UPMOHHAJIKNYED-CQSZACIVSA-N 1 2 248.374 2.392 20 0 BEADLO c1nn[nH]c1CC[N@H+]1CCC[C@@H]1C1CCCCC1 ZINC000647959913 386719794 /nfs/dbraw/zinc/71/97/94/386719794.db2.gz UPMOHHAJIKNYED-CQSZACIVSA-N 1 2 248.374 2.392 20 0 BEADLO CCC1(CC)CN(c2cc[nH+]c(C)n2)C1 ZINC000292780570 386723785 /nfs/dbraw/zinc/72/37/85/386723785.db2.gz LUDYQAGGLGAXCC-UHFFFAOYSA-N 1 2 205.305 2.411 20 0 BEADLO COc1ncncc1C[N@H+](C)Cc1ccc(C)o1 ZINC000647999560 386750182 /nfs/dbraw/zinc/75/01/82/386750182.db2.gz PFQMWUYDPDUTOU-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1ncncc1C[N@@H+](C)Cc1ccc(C)o1 ZINC000647999560 386750189 /nfs/dbraw/zinc/75/01/89/386750189.db2.gz PFQMWUYDPDUTOU-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2CC[C@@H](C)C2)cc[nH+]1 ZINC000408441657 386750357 /nfs/dbraw/zinc/75/03/57/386750357.db2.gz FWNICKSIPKKKFD-KOLCDFICSA-N 1 2 233.315 2.122 20 0 BEADLO C[C@@H]([NH2+]CCF)c1nc(Cc2ccccc2)no1 ZINC000348530605 386751138 /nfs/dbraw/zinc/75/11/38/386751138.db2.gz JDCFYZSGIQDCCM-SNVBAGLBSA-N 1 2 249.289 2.281 20 0 BEADLO Cc1ccc(Cc2nc([C@H]3C[C@@H]3C)no2)c[nH+]1 ZINC000334153006 386751491 /nfs/dbraw/zinc/75/14/91/386751491.db2.gz NEIQMCUEZAWGAF-KWQFWETISA-N 1 2 229.283 2.487 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nccn2C(F)F)[C@H]1C ZINC000292936467 386752028 /nfs/dbraw/zinc/75/20/28/386752028.db2.gz HLMNQDKIDZVXFL-SFYZADRCSA-N 1 2 215.247 2.118 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nccn2C(F)F)[C@H]1C ZINC000292936467 386752033 /nfs/dbraw/zinc/75/20/33/386752033.db2.gz HLMNQDKIDZVXFL-SFYZADRCSA-N 1 2 215.247 2.118 20 0 BEADLO CO[C@H](C(=O)Nc1ccc(C)[nH+]c1C)C1CC1 ZINC000279910410 386755122 /nfs/dbraw/zinc/75/51/22/386755122.db2.gz DXQWDRNICYAGGF-LBPRGKRZSA-N 1 2 234.299 2.062 20 0 BEADLO FC[C@H]1CCC[N@@H+]1Cc1cncc(F)c1 ZINC000292957352 386755280 /nfs/dbraw/zinc/75/52/80/386755280.db2.gz FLQCJTYYJVGRKN-LLVKDONJSA-N 1 2 212.243 2.155 20 0 BEADLO FC[C@H]1CCC[N@H+]1Cc1cncc(F)c1 ZINC000292957352 386755286 /nfs/dbraw/zinc/75/52/86/386755286.db2.gz FLQCJTYYJVGRKN-LLVKDONJSA-N 1 2 212.243 2.155 20 0 BEADLO CO[C@@H](C(=O)Nc1ccc(C)[nH+]c1C)C1CC1 ZINC000279910405 386755533 /nfs/dbraw/zinc/75/55/33/386755533.db2.gz DXQWDRNICYAGGF-GFCCVEGCSA-N 1 2 234.299 2.062 20 0 BEADLO CC(F)(F)C(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000292964039 386757344 /nfs/dbraw/zinc/75/73/44/386757344.db2.gz JRRSQADEPJWREO-QMMMGPOBSA-N 1 2 243.257 2.119 20 0 BEADLO CCc1cc(NC(=O)Cn2cc[nH+]c2)ccc1F ZINC000340751967 386765916 /nfs/dbraw/zinc/76/59/16/386765916.db2.gz MIAPXCJPMWVANP-UHFFFAOYSA-N 1 2 247.273 2.223 20 0 BEADLO Cc1ccoc1C[N@@H+](C)Cc1n[nH]cc1C ZINC000292887052 386741669 /nfs/dbraw/zinc/74/16/69/386741669.db2.gz YKZMIHXWBYHLSC-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO Cc1ccoc1C[N@H+](C)Cc1n[nH]cc1C ZINC000292887052 386741676 /nfs/dbraw/zinc/74/16/76/386741676.db2.gz YKZMIHXWBYHLSC-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO Cc1ccoc1C[N@H+](C)Cc1[nH]ncc1C ZINC000292887052 386741685 /nfs/dbraw/zinc/74/16/85/386741685.db2.gz YKZMIHXWBYHLSC-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO Cc1ccoc1C[N@@H+](C)Cc1[nH]ncc1C ZINC000292887052 386741691 /nfs/dbraw/zinc/74/16/91/386741691.db2.gz YKZMIHXWBYHLSC-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO CC1(C)SC[C@@H]1Nc1nc[nH+]c(N)c1Cl ZINC000282958830 386789793 /nfs/dbraw/zinc/78/97/93/386789793.db2.gz ZXPGUGCWIBXGGF-YFKPBYRVSA-N 1 2 244.751 2.018 20 0 BEADLO CC1(C)SC[C@@H]1Nc1[nH+]cnc(N)c1Cl ZINC000282958830 386789800 /nfs/dbraw/zinc/78/98/00/386789800.db2.gz ZXPGUGCWIBXGGF-YFKPBYRVSA-N 1 2 244.751 2.018 20 0 BEADLO CC[N@H+](C/C(Cl)=C/Cl)[C@H](C)CO ZINC000292288772 386792088 /nfs/dbraw/zinc/79/20/88/386792088.db2.gz TZUITOIKPGDYRM-UDGZVJEDSA-N 1 2 212.120 2.008 20 0 BEADLO CC[N@@H+](C/C(Cl)=C/Cl)[C@H](C)CO ZINC000292288772 386792093 /nfs/dbraw/zinc/79/20/93/386792093.db2.gz TZUITOIKPGDYRM-UDGZVJEDSA-N 1 2 212.120 2.008 20 0 BEADLO CC[C@H](NC(=O)CC(C)(C)C)c1[nH]cc[nH+]1 ZINC000125324322 386793541 /nfs/dbraw/zinc/79/35/41/386793541.db2.gz IBZVDMCJQASUMJ-VIFPVBQESA-N 1 2 223.320 2.413 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@@H+]1C[C@H](C)[C@@H]1C ZINC000293284214 386795676 /nfs/dbraw/zinc/79/56/76/386795676.db2.gz CRZZNQMPHDUCEK-QXEWZRGKSA-N 1 2 239.340 2.302 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@H+]1C[C@H](C)[C@@H]1C ZINC000293284214 386795682 /nfs/dbraw/zinc/79/56/82/386795682.db2.gz CRZZNQMPHDUCEK-QXEWZRGKSA-N 1 2 239.340 2.302 20 0 BEADLO C[C@H](CCc1ccsc1)[NH2+]CC(F)(F)CN ZINC000414932059 386773006 /nfs/dbraw/zinc/77/30/06/386773006.db2.gz RCACJKGJFLAPLR-SECBINFHSA-N 1 2 248.342 2.253 20 0 BEADLO COc1cc(C)nc(C[N@@H+]2CCC[C@@H]2CF)c1 ZINC000293114788 386778144 /nfs/dbraw/zinc/77/81/44/386778144.db2.gz RCDFXARYYYAFNP-GFCCVEGCSA-N 1 2 238.306 2.333 20 0 BEADLO COc1cc(C)nc(C[N@H+]2CCC[C@@H]2CF)c1 ZINC000293114788 386778150 /nfs/dbraw/zinc/77/81/50/386778150.db2.gz RCDFXARYYYAFNP-GFCCVEGCSA-N 1 2 238.306 2.333 20 0 BEADLO c1coc(C[NH2+]Cc2noc3c2CCCC3)c1 ZINC000269352241 386782914 /nfs/dbraw/zinc/78/29/14/386782914.db2.gz GTSOEVGTRRMKKG-UHFFFAOYSA-N 1 2 232.283 2.436 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[NH+]1CCCCC1 ZINC000280147886 386784444 /nfs/dbraw/zinc/78/44/44/386784444.db2.gz WZHFYQGYYVFRGW-NSHDSACASA-N 1 2 239.340 2.448 20 0 BEADLO CN(C[C@@H]1CCCCO1)c1cccc[nH+]1 ZINC000301083435 386816521 /nfs/dbraw/zinc/81/65/21/386816521.db2.gz LBLLNIIKISJLIX-NSHDSACASA-N 1 2 206.289 2.087 20 0 BEADLO CC(C)(C)[C@H]1C[N@H+](Cc2cncs2)CCO1 ZINC000280545760 386822017 /nfs/dbraw/zinc/82/20/17/386822017.db2.gz SWEJCOPULOSPQD-LLVKDONJSA-N 1 2 240.372 2.390 20 0 BEADLO CC(C)(C)[C@H]1C[N@@H+](Cc2cncs2)CCO1 ZINC000280545760 386822026 /nfs/dbraw/zinc/82/20/26/386822026.db2.gz SWEJCOPULOSPQD-LLVKDONJSA-N 1 2 240.372 2.390 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)CC2(C)CC2)c2[nH+]ccn21 ZINC000334770524 386822999 /nfs/dbraw/zinc/82/29/99/386822999.db2.gz QQUVJNKMWYGZTA-ZJUUUORDSA-N 1 2 233.315 2.195 20 0 BEADLO FC1(CCNc2cc[nH+]c(C3CC3)n2)CCC1 ZINC000340876715 386797019 /nfs/dbraw/zinc/79/70/19/386797019.db2.gz NLWHBERQHCNXBO-UHFFFAOYSA-N 1 2 235.306 2.470 20 0 BEADLO CC[C@H](O)CCCNc1cc[nH+]c2ccncc12 ZINC000357505209 386797402 /nfs/dbraw/zinc/79/74/02/386797402.db2.gz AFHDNNHYXGZCSF-NSHDSACASA-N 1 2 245.326 2.015 20 0 BEADLO CCCCCC(=O)NCc1c[nH+]ccc1OC ZINC000293300037 386799932 /nfs/dbraw/zinc/79/99/32/386799932.db2.gz IGVBYVGMTQQKOH-UHFFFAOYSA-N 1 2 236.315 2.287 20 0 BEADLO Cc1nocc1C[NH2+][C@@H](C)c1nnc(C(C)C)[nH]1 ZINC000293382670 386808806 /nfs/dbraw/zinc/80/88/06/386808806.db2.gz WFKBPNVHDYIZSO-VIFPVBQESA-N 1 2 249.318 2.075 20 0 BEADLO Cc1nnc(C[NH2+][C@@H](C)c2cccnc2)s1 ZINC000336671450 386809174 /nfs/dbraw/zinc/80/91/74/386809174.db2.gz GYYSFRXSRZNOAU-QMMMGPOBSA-N 1 2 234.328 2.092 20 0 BEADLO CO[C@@H]1CCC[N@H+](Cc2ncc(C3CC3)o2)C1 ZINC000340915147 386810674 /nfs/dbraw/zinc/81/06/74/386810674.db2.gz XPZUTXAOOLGMRT-LLVKDONJSA-N 1 2 236.315 2.163 20 0 BEADLO CO[C@@H]1CCC[N@@H+](Cc2ncc(C3CC3)o2)C1 ZINC000340915147 386810681 /nfs/dbraw/zinc/81/06/81/386810681.db2.gz XPZUTXAOOLGMRT-LLVKDONJSA-N 1 2 236.315 2.163 20 0 BEADLO CC[C@](C)(OC)C(=O)Nc1cccc2[nH+]ccn21 ZINC000280392063 386811996 /nfs/dbraw/zinc/81/19/96/386811996.db2.gz QNUCLPVNUATWAE-ZDUSSCGKSA-N 1 2 247.298 2.088 20 0 BEADLO CCc1ccccc1C[N@@H+]1CCn2cncc2C1 ZINC000647939179 386812227 /nfs/dbraw/zinc/81/22/27/386812227.db2.gz DUQPLHUJTOTUOI-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO CCc1ccccc1C[N@H+]1CCn2cncc2C1 ZINC000647939179 386812233 /nfs/dbraw/zinc/81/22/33/386812233.db2.gz DUQPLHUJTOTUOI-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO CCc1ccccc1CN1CCn2c[nH+]cc2C1 ZINC000647939179 386812235 /nfs/dbraw/zinc/81/22/35/386812235.db2.gz DUQPLHUJTOTUOI-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)Cc1c(F)cccc1F ZINC000293436804 386815991 /nfs/dbraw/zinc/81/59/91/386815991.db2.gz OFPKOGYKRLJPEW-UHFFFAOYSA-N 1 2 237.253 2.320 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)Cc1c(F)cccc1F ZINC000293436804 386815995 /nfs/dbraw/zinc/81/59/95/386815995.db2.gz OFPKOGYKRLJPEW-UHFFFAOYSA-N 1 2 237.253 2.320 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)CC(C)(C)C1CC1 ZINC000293491461 386825891 /nfs/dbraw/zinc/82/58/91/386825891.db2.gz NDEDZZNRXBHVMR-NSHDSACASA-N 1 2 249.358 2.214 20 0 BEADLO Cc1noc(C)c1CN(C)c1cc(C)[nH+]cn1 ZINC000301223899 386826092 /nfs/dbraw/zinc/82/60/92/386826092.db2.gz CHTWVOQJFAAXDZ-UHFFFAOYSA-N 1 2 232.287 2.026 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1CCCC12CC2 ZINC000528467268 386826991 /nfs/dbraw/zinc/82/69/91/386826991.db2.gz TVRDUSXBOADHFF-NSHDSACASA-N 1 2 230.311 2.331 20 0 BEADLO COc1ccc(C[NH2+][C@@H](C)c2csnn2)cc1 ZINC000398459577 386828111 /nfs/dbraw/zinc/82/81/11/386828111.db2.gz IJKREAURAGODKK-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO CC(C)c1nc(NC[C@H]2CCCOC2)cc[nH+]1 ZINC000301246391 386828109 /nfs/dbraw/zinc/82/81/09/386828109.db2.gz ODBAIDAJVSEEMS-LLVKDONJSA-N 1 2 235.331 2.439 20 0 BEADLO Cc1noc([C@H]2CCC[N@@H+]2Cc2conc2C)n1 ZINC000293519617 386828402 /nfs/dbraw/zinc/82/84/02/386828402.db2.gz AVUQJGMWNUEPMA-LLVKDONJSA-N 1 2 248.286 2.012 20 0 BEADLO Cc1noc([C@H]2CCC[N@H+]2Cc2conc2C)n1 ZINC000293519617 386828412 /nfs/dbraw/zinc/82/84/12/386828412.db2.gz AVUQJGMWNUEPMA-LLVKDONJSA-N 1 2 248.286 2.012 20 0 BEADLO COc1ccc(C[NH2+][C@H](C)c2csnn2)cc1 ZINC000398459576 386828750 /nfs/dbraw/zinc/82/87/50/386828750.db2.gz IJKREAURAGODKK-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO Cc1ccc(CSc2c[nH]nn2)c(C)[nH+]1 ZINC000330104955 386829338 /nfs/dbraw/zinc/82/93/38/386829338.db2.gz JHOVHBHVVSTNFW-UHFFFAOYSA-N 1 2 220.301 2.109 20 0 BEADLO Cc1ccc(CSc2cn[nH]n2)c(C)[nH+]1 ZINC000330104955 386829342 /nfs/dbraw/zinc/82/93/42/386829342.db2.gz JHOVHBHVVSTNFW-UHFFFAOYSA-N 1 2 220.301 2.109 20 0 BEADLO CSCC[C@@H](C)N(C)c1cc(C)[nH+]cn1 ZINC000301419351 386843244 /nfs/dbraw/zinc/84/32/44/386843244.db2.gz DJLLYSUUGLKFFS-SNVBAGLBSA-N 1 2 225.361 2.363 20 0 BEADLO CC(C)n1cncc1C[N@H+](C)Cc1cccnc1 ZINC000425342415 386844749 /nfs/dbraw/zinc/84/47/49/386844749.db2.gz HERKJGHIEYBDOI-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO CC(C)n1cncc1C[N@@H+](C)Cc1cccnc1 ZINC000425342415 386844759 /nfs/dbraw/zinc/84/47/59/386844759.db2.gz HERKJGHIEYBDOI-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO CC(C)n1c[nH+]cc1CN(C)Cc1cccnc1 ZINC000425342415 386844764 /nfs/dbraw/zinc/84/47/64/386844764.db2.gz HERKJGHIEYBDOI-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO C[C@@]1(CO)CCC[C@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000301454740 386846665 /nfs/dbraw/zinc/84/66/65/386846665.db2.gz MNVZUAXIZNHQLV-RISCZKNCSA-N 1 2 247.342 2.317 20 0 BEADLO COc1ncccc1CCNc1cccc[nH+]1 ZINC000357830579 386850792 /nfs/dbraw/zinc/85/07/92/386850792.db2.gz VBARFUVTGOLXPJ-UHFFFAOYSA-N 1 2 229.283 2.140 20 0 BEADLO CS[C@@H]1CC[C@@H]1[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000425344809 386855935 /nfs/dbraw/zinc/85/59/35/386855935.db2.gz UDKXHUNQBHEXND-KXUCPTDWSA-N 1 2 245.388 2.200 20 0 BEADLO CC(C)(C)c1nc(NC[C@H]2CCC[C@@H]2O)cc[nH+]1 ZINC000301579105 386856630 /nfs/dbraw/zinc/85/66/30/386856630.db2.gz NDSBSOKOBNVOSF-MNOVXSKESA-N 1 2 249.358 2.347 20 0 BEADLO CC(C)(C)c1nc(NCC2(O)CCCC2)cc[nH+]1 ZINC000301566596 386857262 /nfs/dbraw/zinc/85/72/62/386857262.db2.gz ZGMNONYIMASBMN-UHFFFAOYSA-N 1 2 249.358 2.491 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CC2(C1)CCCCC2 ZINC000334793258 386859603 /nfs/dbraw/zinc/85/96/03/386859603.db2.gz XBIOCNHKSNBDSO-UHFFFAOYSA-N 1 2 219.332 2.484 20 0 BEADLO CCC(=O)N1CC[N@H+](Cc2ccc(C)cc2C)C1 ZINC000425348403 386863015 /nfs/dbraw/zinc/86/30/15/386863015.db2.gz OEWDXHZGQLZWOO-UHFFFAOYSA-N 1 2 246.354 2.315 20 0 BEADLO CCC(=O)N1CC[N@@H+](Cc2ccc(C)cc2C)C1 ZINC000425348403 386863021 /nfs/dbraw/zinc/86/30/21/386863021.db2.gz OEWDXHZGQLZWOO-UHFFFAOYSA-N 1 2 246.354 2.315 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1cnc(Cl)s1 ZINC000293697538 386864270 /nfs/dbraw/zinc/86/42/70/386864270.db2.gz WWOOHPZOCWKQPF-ZETCQYMHSA-N 1 2 232.736 2.017 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1cnc(Cl)s1 ZINC000293697538 386864275 /nfs/dbraw/zinc/86/42/75/386864275.db2.gz WWOOHPZOCWKQPF-ZETCQYMHSA-N 1 2 232.736 2.017 20 0 BEADLO c1cc(C[N@@H+]2CCOCC23CCCCC3)no1 ZINC000334827668 386865725 /nfs/dbraw/zinc/86/57/25/386865725.db2.gz MQVACJNKBQNBPJ-UHFFFAOYSA-N 1 2 236.315 2.210 20 0 BEADLO c1cc(C[N@H+]2CCOCC23CCCCC3)no1 ZINC000334827668 386865731 /nfs/dbraw/zinc/86/57/31/386865731.db2.gz MQVACJNKBQNBPJ-UHFFFAOYSA-N 1 2 236.315 2.210 20 0 BEADLO Cn1cc[nH+]c1CN1CC=C(C(F)(F)F)CC1 ZINC000335747915 386871383 /nfs/dbraw/zinc/87/13/83/386871383.db2.gz OZQCTQJDTSUKRJ-UHFFFAOYSA-N 1 2 245.248 2.115 20 0 BEADLO Cn1c[nH+]cc1Cc1noc(/C=C\C(C)(C)C)n1 ZINC000357963363 386873813 /nfs/dbraw/zinc/87/38/13/386873813.db2.gz VBIAIFKUSDDVLA-WAYWQWQTSA-N 1 2 246.314 2.453 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000334845822 386894690 /nfs/dbraw/zinc/89/46/90/386894690.db2.gz UELOLKWQBFXFLH-IUCAKERBSA-N 1 2 247.264 2.491 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000334845822 386894694 /nfs/dbraw/zinc/89/46/94/386894694.db2.gz UELOLKWQBFXFLH-IUCAKERBSA-N 1 2 247.264 2.491 20 0 BEADLO Cc1cscc1C(=O)Nc1cc[nH+]c(C)c1 ZINC000334837246 386878476 /nfs/dbraw/zinc/87/84/76/386878476.db2.gz OVKNHABJTIOPAA-UHFFFAOYSA-N 1 2 232.308 2.434 20 0 BEADLO CCC(CC)[C@H](C)C(=O)NCc1[nH+]ccn1C ZINC000341557799 386916393 /nfs/dbraw/zinc/91/63/93/386916393.db2.gz AHYHHTZUFDOHSH-JTQLQIEISA-N 1 2 237.347 2.109 20 0 BEADLO CC(C)c1nc(N(C)C2CCC2)nc(N(C)C)[nH+]1 ZINC000302016964 386896379 /nfs/dbraw/zinc/89/63/79/386896379.db2.gz YXWWBKOLBSLOEJ-UHFFFAOYSA-N 1 2 249.362 2.050 20 0 BEADLO CC(C)c1nc(N(C)C)nc(N(C)C2CCC2)[nH+]1 ZINC000302016964 386896387 /nfs/dbraw/zinc/89/63/87/386896387.db2.gz YXWWBKOLBSLOEJ-UHFFFAOYSA-N 1 2 249.362 2.050 20 0 BEADLO C[C@H]1CC[C@@H]([N@H+](C)Cc2csnn2)C1 ZINC000334863663 386919450 /nfs/dbraw/zinc/91/94/50/386919450.db2.gz JNQFGQRKHACMFH-WCBMZHEXSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@H]1CC[C@@H]([N@@H+](C)Cc2csnn2)C1 ZINC000334863663 386919457 /nfs/dbraw/zinc/91/94/57/386919457.db2.gz JNQFGQRKHACMFH-WCBMZHEXSA-N 1 2 211.334 2.159 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@H]3C[C@H]32)cc1C ZINC000367842513 386911251 /nfs/dbraw/zinc/91/12/51/386911251.db2.gz XOQSFRZXXYQLTK-KGLIPLIRSA-N 1 2 217.312 2.277 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@H]3C[C@H]32)cc1C ZINC000367842513 386911254 /nfs/dbraw/zinc/91/12/54/386911254.db2.gz XOQSFRZXXYQLTK-KGLIPLIRSA-N 1 2 217.312 2.277 20 0 BEADLO Cc1sccc1C[N@@H+]1CCO[C@H](CF)C1 ZINC000334859014 386911394 /nfs/dbraw/zinc/91/13/94/386911394.db2.gz IFBAOEJENXJZSK-LLVKDONJSA-N 1 2 229.320 2.227 20 0 BEADLO Cc1sccc1C[N@H+]1CCO[C@H](CF)C1 ZINC000334859014 386911400 /nfs/dbraw/zinc/91/14/00/386911400.db2.gz IFBAOEJENXJZSK-LLVKDONJSA-N 1 2 229.320 2.227 20 0 BEADLO Cc1cccc(C[N@@H+]2CCO[C@H](CF)C2)c1F ZINC000334860339 386912533 /nfs/dbraw/zinc/91/25/33/386912533.db2.gz YRUBRANRBNHBGE-GFCCVEGCSA-N 1 2 241.281 2.304 20 0 BEADLO Cc1cccc(C[N@H+]2CCO[C@H](CF)C2)c1F ZINC000334860339 386912536 /nfs/dbraw/zinc/91/25/36/386912536.db2.gz YRUBRANRBNHBGE-GFCCVEGCSA-N 1 2 241.281 2.304 20 0 BEADLO Cc1occc1C[N@H+]1CCC[C@H]1c1nncn1C ZINC000334859588 386912759 /nfs/dbraw/zinc/91/27/59/386912759.db2.gz KFCCKGQTTZSLBF-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1occc1C[N@@H+]1CCC[C@H]1c1nncn1C ZINC000334859588 386912763 /nfs/dbraw/zinc/91/27/63/386912763.db2.gz KFCCKGQTTZSLBF-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc(N(C)C[C@H](C)c2nccs2)nc[nH+]1 ZINC000302189450 386913163 /nfs/dbraw/zinc/91/31/63/386913163.db2.gz VFOCQBWUKSEEJB-VIFPVBQESA-N 1 2 248.355 2.481 20 0 BEADLO CC(C)(C)c1nc(N[C@@H]2C[C@@H](O)C2(C)C)cc[nH+]1 ZINC000302403606 386922165 /nfs/dbraw/zinc/92/21/65/386922165.db2.gz KLLVHCCTSVMTGZ-NXEZZACHSA-N 1 2 249.358 2.345 20 0 BEADLO c1[nH+]c2ccccn2c1CSc1cccnn1 ZINC000358273887 386926169 /nfs/dbraw/zinc/92/61/69/386926169.db2.gz UANOLGRORJKNLH-UHFFFAOYSA-N 1 2 242.307 2.417 20 0 BEADLO CCn1ccc(CN(C)c2cc(C)[nH+]cn2)c1 ZINC000302738887 386934457 /nfs/dbraw/zinc/93/44/57/386934457.db2.gz YDESHBPKDDNPNO-UHFFFAOYSA-N 1 2 230.315 2.243 20 0 BEADLO CCc1ccc(C[N@H+](C)Cc2cn(C)nn2)cc1 ZINC000341613197 386936097 /nfs/dbraw/zinc/93/60/97/386936097.db2.gz ISHWZRKAWFUMMZ-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO CCc1ccc(C[N@@H+](C)Cc2cn(C)nn2)cc1 ZINC000341613197 386936102 /nfs/dbraw/zinc/93/61/02/386936102.db2.gz ISHWZRKAWFUMMZ-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO CO[C@H](C(=O)Nc1ccc(C)[nH+]c1C)C(C)C ZINC000330996065 386942350 /nfs/dbraw/zinc/94/23/50/386942350.db2.gz MCOGBQSIZNIEIS-LBPRGKRZSA-N 1 2 236.315 2.308 20 0 BEADLO CC(C)c1nc(N2CCC(F)(F)C2)cc[nH+]1 ZINC000334816487 386942599 /nfs/dbraw/zinc/94/25/99/386942599.db2.gz QBDCIPLFOFUDAY-UHFFFAOYSA-N 1 2 227.258 2.445 20 0 BEADLO CC[C@@H](C)CC(=O)N[C@@H](c1[nH+]ccn1C)C1CC1 ZINC000341691368 386952453 /nfs/dbraw/zinc/95/24/53/386952453.db2.gz PKZDRHLXPQQOHT-ZWNOBZJWSA-N 1 2 249.358 2.424 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](c2nncn2C)C(C)C)o1 ZINC000352903852 386956059 /nfs/dbraw/zinc/95/60/59/386956059.db2.gz SFETWPBDTAQSQT-GFCCVEGCSA-N 1 2 248.330 2.203 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CC[C@@H](C)C2)cc[nH+]1 ZINC000334886222 386957795 /nfs/dbraw/zinc/95/77/95/386957795.db2.gz OJPMPJLIEZFDES-KOLCDFICSA-N 1 2 218.300 2.187 20 0 BEADLO Cc1ccc(CNc2cc[nH+]c(C(C)C)n2)nc1 ZINC000518970307 386962469 /nfs/dbraw/zinc/96/24/69/386962469.db2.gz CYNWKVQXLNRGHF-UHFFFAOYSA-N 1 2 242.326 2.337 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+]2CC[C@](C)(F)C2)o1 ZINC000334891206 386963386 /nfs/dbraw/zinc/96/33/86/386963386.db2.gz SRRLDNAKOTVEGU-KOLCDFICSA-N 1 2 212.268 2.478 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+]2CC[C@](C)(F)C2)o1 ZINC000334891206 386963390 /nfs/dbraw/zinc/96/33/90/386963390.db2.gz SRRLDNAKOTVEGU-KOLCDFICSA-N 1 2 212.268 2.478 20 0 BEADLO c1ccc2ncc(C[N@@H+]3CCO[C@@H]4C[C@@H]43)cc2c1 ZINC000368335824 386963394 /nfs/dbraw/zinc/96/33/94/386963394.db2.gz ZUFATSQXQZIFHL-LSDHHAIUSA-N 1 2 240.306 2.208 20 0 BEADLO c1ccc2ncc(C[N@H+]3CCO[C@@H]4C[C@@H]43)cc2c1 ZINC000368335824 386963398 /nfs/dbraw/zinc/96/33/98/386963398.db2.gz ZUFATSQXQZIFHL-LSDHHAIUSA-N 1 2 240.306 2.208 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+]2CC[C@](C)(F)C2)o1 ZINC000334891211 386963402 /nfs/dbraw/zinc/96/34/02/386963402.db2.gz SRRLDNAKOTVEGU-ONGXEEELSA-N 1 2 212.268 2.478 20 0 BEADLO Cc1cnc([C@H](C)[N@H+]2CC[C@](C)(F)C2)o1 ZINC000334891211 386963406 /nfs/dbraw/zinc/96/34/06/386963406.db2.gz SRRLDNAKOTVEGU-ONGXEEELSA-N 1 2 212.268 2.478 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1ccc(C)cc1C ZINC000266970673 386992903 /nfs/dbraw/zinc/99/29/03/386992903.db2.gz LNVXZRDJERJNGG-UHFFFAOYSA-N 1 2 243.310 2.265 20 0 BEADLO Cc1ccc(CNc2ccc(CO)c[nH+]2)o1 ZINC000284091252 386994140 /nfs/dbraw/zinc/99/41/40/386994140.db2.gz OBPYMTFCWKBITC-UHFFFAOYSA-N 1 2 218.256 2.087 20 0 BEADLO C[C@@H]1C[N@H+](CCc2cnn[nH]2)[C@H]1c1ccccc1 ZINC000647966389 387004461 /nfs/dbraw/zinc/00/44/61/387004461.db2.gz QSVWZASQMRQPRD-BXUZGUMPSA-N 1 2 242.326 2.040 20 0 BEADLO C[C@@H]1C[N@@H+](CCc2cnn[nH]2)[C@H]1c1ccccc1 ZINC000647966389 387004466 /nfs/dbraw/zinc/00/44/66/387004466.db2.gz QSVWZASQMRQPRD-BXUZGUMPSA-N 1 2 242.326 2.040 20 0 BEADLO Cc1cc(CNC(=O)N[C@@H]2CC2(C)C)cc(C)[nH+]1 ZINC000334966342 387048965 /nfs/dbraw/zinc/04/89/65/387048965.db2.gz IHEGGCDWLBXYCC-GFCCVEGCSA-N 1 2 247.342 2.296 20 0 BEADLO Cc1ccccc1[C@@]1(F)CC[N@H+](CC(N)=O)C1 ZINC000334970524 387054974 /nfs/dbraw/zinc/05/49/74/387054974.db2.gz VJVNUBKFXNWULD-CYBMUJFWSA-N 1 2 236.290 2.401 20 0 BEADLO Cc1ccccc1[C@@]1(F)CC[N@@H+](CC(N)=O)C1 ZINC000334970524 387054979 /nfs/dbraw/zinc/05/49/79/387054979.db2.gz VJVNUBKFXNWULD-CYBMUJFWSA-N 1 2 236.290 2.401 20 0 BEADLO Cc1cc(NC[C@@H]2CC23CCSCC3)nc[nH+]1 ZINC000334975112 387061137 /nfs/dbraw/zinc/06/11/37/387061137.db2.gz NYPASTOJWZQSAM-NSHDSACASA-N 1 2 249.383 2.152 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1ncnn1-c1ccccc1 ZINC000334975421 387061774 /nfs/dbraw/zinc/06/17/74/387061774.db2.gz JRXBCISOYLDCCU-VXGBXAGGSA-N 1 2 242.326 2.250 20 0 BEADLO CC[C@H](NC(=O)C[C@H](C)SC)c1[nH]cc[nH+]1 ZINC000331291783 387009630 /nfs/dbraw/zinc/00/96/30/387009630.db2.gz WTYFZJRAKQPPHW-IUCAKERBSA-N 1 2 241.360 2.119 20 0 BEADLO COC(=O)[C@H]([NH2+][C@@H]1CCCC(F)(F)C1)C1CC1 ZINC000358844627 387021791 /nfs/dbraw/zinc/02/17/91/387021791.db2.gz DLYRMPWFOJPRSF-NXEZZACHSA-N 1 2 247.285 2.106 20 0 BEADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccn(C)n1 ZINC000336224745 387066126 /nfs/dbraw/zinc/06/61/26/387066126.db2.gz OMCYYCRGLSLBAF-WPRPVWTQSA-N 1 2 247.264 2.193 20 0 BEADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccn(C)n1 ZINC000336224745 387066127 /nfs/dbraw/zinc/06/61/27/387066127.db2.gz OMCYYCRGLSLBAF-WPRPVWTQSA-N 1 2 247.264 2.193 20 0 BEADLO O=C(Nc1c[nH+]c2n1CCCC2)C1=CCCC1 ZINC000334884009 387027252 /nfs/dbraw/zinc/02/72/52/387027252.db2.gz ODACVJRGMDALMJ-UHFFFAOYSA-N 1 2 231.299 2.268 20 0 BEADLO C[C@H](F)CC[N@@H+]1Cc2ccccc2NC(=O)C1 ZINC000519177007 387027895 /nfs/dbraw/zinc/02/78/95/387027895.db2.gz QJMIVRRQLUHUIH-JTQLQIEISA-N 1 2 236.290 2.189 20 0 BEADLO C[C@H](F)CC[N@H+]1Cc2ccccc2NC(=O)C1 ZINC000519177007 387027898 /nfs/dbraw/zinc/02/78/98/387027898.db2.gz QJMIVRRQLUHUIH-JTQLQIEISA-N 1 2 236.290 2.189 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)[C@]1(C)CC=CCC1 ZINC000336236333 387073004 /nfs/dbraw/zinc/07/30/04/387073004.db2.gz DHBDNWWWZGUSEP-CQSZACIVSA-N 1 2 247.342 2.125 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@]12C[C@H]1CCC2 ZINC000334986142 387074141 /nfs/dbraw/zinc/07/41/41/387074141.db2.gz ITBITAJBOVFHSG-BXUZGUMPSA-N 1 2 230.311 2.195 20 0 BEADLO Cc1cc(CNC(=O)N[C@@H]2CC[C@H]2C)cc(C)[nH+]1 ZINC000334997330 387087569 /nfs/dbraw/zinc/08/75/69/387087569.db2.gz HQHVPTXEJRVKQW-NOZJJQNGSA-N 1 2 247.342 2.296 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2ccc(F)c(C)c2)o1 ZINC000352348691 387093334 /nfs/dbraw/zinc/09/33/34/387093334.db2.gz CUIJJSFDAWDJKB-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2ccc(F)c(C)c2)o1 ZINC000352348691 387093339 /nfs/dbraw/zinc/09/33/39/387093339.db2.gz CUIJJSFDAWDJKB-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO Cc1ccc(Cl)cc1C(=O)NCc1c[nH+]c[nH]1 ZINC000228453822 387093707 /nfs/dbraw/zinc/09/37/07/387093707.db2.gz FHEGDQWXVOMNGR-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO Cc1ccc(Cl)cc1C(=O)NCc1c[nH]c[nH+]1 ZINC000228453822 387093709 /nfs/dbraw/zinc/09/37/09/387093709.db2.gz FHEGDQWXVOMNGR-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO CS[C@H]1CC[N@@H+]([C@H](C)c2csnn2)C1 ZINC000336262129 387095792 /nfs/dbraw/zinc/09/57/92/387095792.db2.gz XKTXVAVRDPBKLB-SFYZADRCSA-N 1 2 229.374 2.036 20 0 BEADLO CS[C@H]1CC[N@H+]([C@H](C)c2csnn2)C1 ZINC000336262129 387095795 /nfs/dbraw/zinc/09/57/95/387095795.db2.gz XKTXVAVRDPBKLB-SFYZADRCSA-N 1 2 229.374 2.036 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1ccnn1C(C)C ZINC000119161626 387105389 /nfs/dbraw/zinc/10/53/89/387105389.db2.gz DZVHCXXDCVTBOQ-UHFFFAOYSA-N 1 2 244.298 2.420 20 0 BEADLO CCN(CC)C(=O)C[N@H+](C)[C@@H](C)c1ccco1 ZINC000069069559 387113659 /nfs/dbraw/zinc/11/36/59/387113659.db2.gz GGXHGWSKBWPDTM-NSHDSACASA-N 1 2 238.331 2.141 20 0 BEADLO CCN(CC)C(=O)C[N@@H+](C)[C@@H](C)c1ccco1 ZINC000069069559 387113661 /nfs/dbraw/zinc/11/36/61/387113661.db2.gz GGXHGWSKBWPDTM-NSHDSACASA-N 1 2 238.331 2.141 20 0 BEADLO CC(C)CNC(=O)C[N@H+](C)[C@@H](C)c1ccco1 ZINC000069069603 387113673 /nfs/dbraw/zinc/11/36/73/387113673.db2.gz CPDZVIMZTKOSRM-NSHDSACASA-N 1 2 238.331 2.045 20 0 BEADLO CC(C)CNC(=O)C[N@@H+](C)[C@@H](C)c1ccco1 ZINC000069069603 387113675 /nfs/dbraw/zinc/11/36/75/387113675.db2.gz CPDZVIMZTKOSRM-NSHDSACASA-N 1 2 238.331 2.045 20 0 BEADLO c1coc(C[NH2+]Cc2cn3ccsc3n2)c1 ZINC000069062200 387113948 /nfs/dbraw/zinc/11/39/48/387113948.db2.gz SFCXWQICMMCJHE-UHFFFAOYSA-N 1 2 233.296 2.279 20 0 BEADLO CC1=CCC[N@@H+](Cc2nc(C(C)C)no2)C1 ZINC000335025095 387117167 /nfs/dbraw/zinc/11/71/67/387117167.db2.gz XJKBNDLBZFQGTL-UHFFFAOYSA-N 1 2 221.304 2.345 20 0 BEADLO CC1=CCC[N@H+](Cc2nc(C(C)C)no2)C1 ZINC000335025095 387117171 /nfs/dbraw/zinc/11/71/71/387117171.db2.gz XJKBNDLBZFQGTL-UHFFFAOYSA-N 1 2 221.304 2.345 20 0 BEADLO Cn1c(C[NH2+]Cc2ccco2)nc2ccccc21 ZINC000070162924 387118423 /nfs/dbraw/zinc/11/84/23/387118423.db2.gz WGSKHBOFKAOMHO-UHFFFAOYSA-N 1 2 241.294 2.456 20 0 BEADLO C[C@H]1CC=C(C(=O)N(C)Cc2[nH]cc[nH+]2)CC1 ZINC000336286831 387119788 /nfs/dbraw/zinc/11/97/88/387119788.db2.gz BJZXYEIDWKTLPJ-JTQLQIEISA-N 1 2 233.315 2.115 20 0 BEADLO Cn1cc[nH+]c1CNc1nc2ccccc2o1 ZINC000071140350 387120889 /nfs/dbraw/zinc/12/08/89/387120889.db2.gz BWZISFSVEQZEHH-UHFFFAOYSA-N 1 2 228.255 2.173 20 0 BEADLO Cc1cnc(C[N@@H+]2CCSC[C@H]2C2CC2)nc1 ZINC000336291561 387123262 /nfs/dbraw/zinc/12/32/62/387123262.db2.gz KCZSYSGKWUHART-LBPRGKRZSA-N 1 2 249.383 2.112 20 0 BEADLO Cc1cnc(C[N@H+]2CCSC[C@H]2C2CC2)nc1 ZINC000336291561 387123268 /nfs/dbraw/zinc/12/32/68/387123268.db2.gz KCZSYSGKWUHART-LBPRGKRZSA-N 1 2 249.383 2.112 20 0 BEADLO Cc1cnc(C[N@H+]2CC[C@@H](OCC(C)C)C2)o1 ZINC000120016790 387147307 /nfs/dbraw/zinc/14/73/07/387147307.db2.gz MERGWEKOILSXGS-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cnc(C[N@@H+]2CC[C@@H](OCC(C)C)C2)o1 ZINC000120016790 387147311 /nfs/dbraw/zinc/14/73/11/387147311.db2.gz MERGWEKOILSXGS-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO CC[C@@H]1CCC[C@H]1NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000571699829 387150189 /nfs/dbraw/zinc/15/01/89/387150189.db2.gz LEHJFKGPAAKXAC-DMDPSCGWSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@@H]1CCC[C@H]1NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000571699829 387150193 /nfs/dbraw/zinc/15/01/93/387150193.db2.gz LEHJFKGPAAKXAC-DMDPSCGWSA-N 1 2 249.358 2.283 20 0 BEADLO FC(F)[C@H]1CCC[N@@H+]1CCc1ccncc1 ZINC000353192854 387152816 /nfs/dbraw/zinc/15/28/16/387152816.db2.gz MKDFXIOVRMAQIQ-LLVKDONJSA-N 1 2 226.270 2.354 20 0 BEADLO FC(F)[C@H]1CCC[N@H+]1CCc1ccncc1 ZINC000353192854 387152822 /nfs/dbraw/zinc/15/28/22/387152822.db2.gz MKDFXIOVRMAQIQ-LLVKDONJSA-N 1 2 226.270 2.354 20 0 BEADLO Cc1ccc(C[NH2+]Cc2nn(C)cc2Cl)o1 ZINC000393327498 387159798 /nfs/dbraw/zinc/15/97/98/387159798.db2.gz NPFYVOHUFJXIBZ-UHFFFAOYSA-N 1 2 239.706 2.265 20 0 BEADLO FC(F)[C@H]1CCCC[N@@H+]1CC1=CCCOC1 ZINC000336335666 387161100 /nfs/dbraw/zinc/16/11/00/387161100.db2.gz JOMFDDPOWUXTGV-LLVKDONJSA-N 1 2 231.286 2.453 20 0 BEADLO FC(F)[C@H]1CCCC[N@H+]1CC1=CCCOC1 ZINC000336335666 387161104 /nfs/dbraw/zinc/16/11/04/387161104.db2.gz JOMFDDPOWUXTGV-LLVKDONJSA-N 1 2 231.286 2.453 20 0 BEADLO COC(=O)[C@@H](c1cccnc1)[N@H+](C)CC1CCC1 ZINC000120017703 387176389 /nfs/dbraw/zinc/17/63/89/387176389.db2.gz ZMBFAPSPFPWKDW-CYBMUJFWSA-N 1 2 248.326 2.028 20 0 BEADLO COC(=O)[C@@H](c1cccnc1)[N@@H+](C)CC1CCC1 ZINC000120017703 387176394 /nfs/dbraw/zinc/17/63/94/387176394.db2.gz ZMBFAPSPFPWKDW-CYBMUJFWSA-N 1 2 248.326 2.028 20 0 BEADLO CC(C)c1nc(C[N@@H+]2CC[C@@H](C)C2)no1 ZINC000336348597 387179097 /nfs/dbraw/zinc/17/90/97/387179097.db2.gz YTLDUNRSLYJUQY-SECBINFHSA-N 1 2 209.293 2.035 20 0 BEADLO CC(C)c1nc(C[N@H+]2CC[C@@H](C)C2)no1 ZINC000336348597 387179102 /nfs/dbraw/zinc/17/91/02/387179102.db2.gz YTLDUNRSLYJUQY-SECBINFHSA-N 1 2 209.293 2.035 20 0 BEADLO CC(C)c1noc(C[N@@H+]2CCCSCC2)n1 ZINC000336352170 387180164 /nfs/dbraw/zinc/18/01/64/387180164.db2.gz YPBZVRHOSRUMKG-UHFFFAOYSA-N 1 2 241.360 2.132 20 0 BEADLO CC(C)c1noc(C[N@H+]2CCCSCC2)n1 ZINC000336352170 387180167 /nfs/dbraw/zinc/18/01/67/387180167.db2.gz YPBZVRHOSRUMKG-UHFFFAOYSA-N 1 2 241.360 2.132 20 0 BEADLO CC[C@H]([NH2+]Cc1cc[nH]n1)c1ccc(F)cn1 ZINC000161324704 387191176 /nfs/dbraw/zinc/19/11/76/387191176.db2.gz CWVHKWWTDFDNTP-NSHDSACASA-N 1 2 234.278 2.185 20 0 BEADLO CC[N@H+](Cc1nc(C(C)(C)C)no1)C1CC1 ZINC000058575843 387191712 /nfs/dbraw/zinc/19/17/12/387191712.db2.gz YLOQFPLJEGWYPJ-UHFFFAOYSA-N 1 2 223.320 2.351 20 0 BEADLO CC[N@@H+](Cc1nc(C(C)(C)C)no1)C1CC1 ZINC000058575843 387191715 /nfs/dbraw/zinc/19/17/15/387191715.db2.gz YLOQFPLJEGWYPJ-UHFFFAOYSA-N 1 2 223.320 2.351 20 0 BEADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1c[nH]cn1 ZINC000336310541 387137989 /nfs/dbraw/zinc/13/79/89/387137989.db2.gz AXRZLYSWPKVWBW-VXNVDRBHSA-N 1 2 233.237 2.182 20 0 BEADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1c[nH]cn1 ZINC000336310541 387137992 /nfs/dbraw/zinc/13/79/92/387137992.db2.gz AXRZLYSWPKVWBW-VXNVDRBHSA-N 1 2 233.237 2.182 20 0 BEADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cnc[nH]1 ZINC000336310541 387138000 /nfs/dbraw/zinc/13/80/00/387138000.db2.gz AXRZLYSWPKVWBW-VXNVDRBHSA-N 1 2 233.237 2.182 20 0 BEADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cnc[nH]1 ZINC000336310541 387138004 /nfs/dbraw/zinc/13/80/04/387138004.db2.gz AXRZLYSWPKVWBW-VXNVDRBHSA-N 1 2 233.237 2.182 20 0 BEADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1c[nH]cn1 ZINC000336310538 387138727 /nfs/dbraw/zinc/13/87/27/387138727.db2.gz AXRZLYSWPKVWBW-APPZFPTMSA-N 1 2 233.237 2.182 20 0 BEADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1c[nH]cn1 ZINC000336310538 387138730 /nfs/dbraw/zinc/13/87/30/387138730.db2.gz AXRZLYSWPKVWBW-APPZFPTMSA-N 1 2 233.237 2.182 20 0 BEADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cnc[nH]1 ZINC000336310538 387138737 /nfs/dbraw/zinc/13/87/37/387138737.db2.gz AXRZLYSWPKVWBW-APPZFPTMSA-N 1 2 233.237 2.182 20 0 BEADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1cnc[nH]1 ZINC000336310538 387138740 /nfs/dbraw/zinc/13/87/40/387138740.db2.gz AXRZLYSWPKVWBW-APPZFPTMSA-N 1 2 233.237 2.182 20 0 BEADLO C[C@@H]1CC[C@@H]1[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000571955888 387207053 /nfs/dbraw/zinc/20/70/53/387207053.db2.gz BEEGMFNVDPPIBJ-KGYLQXTDSA-N 1 2 242.326 2.282 20 0 BEADLO Cc1ncc(C)c(Nc2ccc(N(C)C)[nH+]c2)n1 ZINC000571963824 387209720 /nfs/dbraw/zinc/20/97/20/387209720.db2.gz HFRMEUIKMKMDIV-UHFFFAOYSA-N 1 2 243.314 2.298 20 0 BEADLO CCOC[C@@H]1CCCC[N@@H+]1Cc1cn[nH]c1C ZINC000459676707 387210341 /nfs/dbraw/zinc/21/03/41/387210341.db2.gz ODWGLIPQIRVWMD-ZDUSSCGKSA-N 1 2 237.347 2.109 20 0 BEADLO CCOC[C@@H]1CCCC[N@H+]1Cc1cn[nH]c1C ZINC000459676707 387210347 /nfs/dbraw/zinc/21/03/47/387210347.db2.gz ODWGLIPQIRVWMD-ZDUSSCGKSA-N 1 2 237.347 2.109 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)Cc1cc(F)cc(F)c1 ZINC000353527698 387222470 /nfs/dbraw/zinc/22/24/70/387222470.db2.gz LSDDHITXJOPOBU-UHFFFAOYSA-N 1 2 237.253 2.320 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)Cc1cc(F)cc(F)c1 ZINC000353527698 387222475 /nfs/dbraw/zinc/22/24/75/387222475.db2.gz LSDDHITXJOPOBU-UHFFFAOYSA-N 1 2 237.253 2.320 20 0 BEADLO Cc1ccncc1CN(C)c1cc[nH+]c(C)n1 ZINC000360113893 387228773 /nfs/dbraw/zinc/22/87/73/387228773.db2.gz DOJQLBDJNAESEL-UHFFFAOYSA-N 1 2 228.299 2.125 20 0 BEADLO CC(C)C(C)(C)C(=O)N(C)Cc1[nH+]ccn1C ZINC000352470662 387229236 /nfs/dbraw/zinc/22/92/36/387229236.db2.gz SGLJBKDRMOZXLZ-UHFFFAOYSA-N 1 2 237.347 2.061 20 0 BEADLO Cc1ccoc1C[N@@H+](C)CC(=O)c1cccn1C ZINC000336796469 387235240 /nfs/dbraw/zinc/23/52/40/387235240.db2.gz SRGAJMKKGZCVFG-UHFFFAOYSA-N 1 2 246.310 2.241 20 0 BEADLO Cc1ccoc1C[N@H+](C)CC(=O)c1cccn1C ZINC000336796469 387235245 /nfs/dbraw/zinc/23/52/45/387235245.db2.gz SRGAJMKKGZCVFG-UHFFFAOYSA-N 1 2 246.310 2.241 20 0 BEADLO CCN(CC1CCC1)C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000571894644 387195524 /nfs/dbraw/zinc/19/55/24/387195524.db2.gz HMHAUKKCBNRXRB-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO CCN(CC1CCC1)C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000571894644 387195527 /nfs/dbraw/zinc/19/55/27/387195527.db2.gz HMHAUKKCBNRXRB-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO Cc1ccc(CS(=O)(=O)CC(C)C)c(C)[nH+]1 ZINC000187425971 387196786 /nfs/dbraw/zinc/19/67/86/387196786.db2.gz ZESNSFAMNPCDPU-UHFFFAOYSA-N 1 2 241.356 2.269 20 0 BEADLO CCCCCCC(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000371360100 387198345 /nfs/dbraw/zinc/19/83/45/387198345.db2.gz NPIDCXMXQMZGRQ-LLVKDONJSA-N 1 2 249.358 2.354 20 0 BEADLO CCCCCCC(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000371360100 387198350 /nfs/dbraw/zinc/19/83/50/387198350.db2.gz NPIDCXMXQMZGRQ-LLVKDONJSA-N 1 2 249.358 2.354 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)[C@@H]1CCCC[C@H]1C ZINC000424590347 387198985 /nfs/dbraw/zinc/19/89/85/387198985.db2.gz LCULRSXJALJWMJ-JHJVBQTASA-N 1 2 249.358 2.214 20 0 BEADLO CCCC[C@@H](C)[C@H](C)NCC(F)(F)C[NH3+] ZINC000423349643 387200962 /nfs/dbraw/zinc/20/09/62/387200962.db2.gz XGTGIQKQGSGSDK-ZJUUUORDSA-N 1 2 222.323 2.385 20 0 BEADLO CC[C@H](NCC(F)(F)C[NH3+])C1CCCC1 ZINC000423348376 387201326 /nfs/dbraw/zinc/20/13/26/387201326.db2.gz SSRIKXCBVFSKSM-JTQLQIEISA-N 1 2 220.307 2.139 20 0 BEADLO CC(C)[C@H](C)C(=O)NCc1ccc(N(C)C)[nH+]c1 ZINC000353745046 387267178 /nfs/dbraw/zinc/26/71/78/387267178.db2.gz JKPYGIDVEDHWQQ-NSHDSACASA-N 1 2 249.358 2.056 20 0 BEADLO C[C@@H]1CCC[C@@H](CNC(=O)Cn2cc[nH+]c2)[C@H]1C ZINC000360470327 387292342 /nfs/dbraw/zinc/29/23/42/387292342.db2.gz SQEZKVKLWDUHED-AGIUHOORSA-N 1 2 249.358 2.072 20 0 BEADLO C[C@@H](CC(=O)N(C)CC1CCC1)n1cc[nH+]c1 ZINC000514792308 387292541 /nfs/dbraw/zinc/29/25/41/387292541.db2.gz KVXNXBRVYKOAPA-NSHDSACASA-N 1 2 235.331 2.093 20 0 BEADLO Cc1ncncc1[C@H](C)[NH2+]CC(C)(F)F ZINC000514798853 387294652 /nfs/dbraw/zinc/29/46/52/387294652.db2.gz PXHVSZXDBYLRLW-ZETCQYMHSA-N 1 2 215.247 2.091 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cn(-c3ccccc3)nn2)[C@H]1C ZINC000336468798 387296063 /nfs/dbraw/zinc/29/60/63/387296063.db2.gz XOLHQVJNHHVQAX-NEPJUHHUSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cn(-c3ccccc3)nn2)[C@H]1C ZINC000336468798 387296067 /nfs/dbraw/zinc/29/60/67/387296067.db2.gz XOLHQVJNHHVQAX-NEPJUHHUSA-N 1 2 242.326 2.108 20 0 BEADLO Cc1cnc(C[N@@H+]2CCn3cccc3[C@H]2C)cn1 ZINC000336469375 387298433 /nfs/dbraw/zinc/29/84/33/387298433.db2.gz LJAVTWWGHPYXAY-GFCCVEGCSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1cnc(C[N@H+]2CCn3cccc3[C@H]2C)cn1 ZINC000336469375 387298436 /nfs/dbraw/zinc/29/84/36/387298436.db2.gz LJAVTWWGHPYXAY-GFCCVEGCSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CC[C@H](C2CC2)C1 ZINC000336472553 387300657 /nfs/dbraw/zinc/30/06/57/387300657.db2.gz IRECQRZDFKIJAG-LBPRGKRZSA-N 1 2 245.326 2.076 20 0 BEADLO C[C@]1(O)CCC[N@H+](Cc2ncc(Cl)s2)C1 ZINC000336533396 387356100 /nfs/dbraw/zinc/35/61/00/387356100.db2.gz XXVUKPYELNVTJS-JTQLQIEISA-N 1 2 246.763 2.143 20 0 BEADLO C[C@]1(O)CCC[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000336533396 387356104 /nfs/dbraw/zinc/35/61/04/387356104.db2.gz XXVUKPYELNVTJS-JTQLQIEISA-N 1 2 246.763 2.143 20 0 BEADLO Cc1c(F)cccc1NC(=O)CCc1[nH]cc[nH+]1 ZINC000354330525 387362090 /nfs/dbraw/zinc/36/20/90/387362090.db2.gz JJTMUFYXFLAOTK-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO Cc1cc(NC2(CCO)CC2)nc(C(C)C)[nH+]1 ZINC000431505018 387363366 /nfs/dbraw/zinc/36/33/66/387363366.db2.gz ATKJCDIMAGTLJO-UHFFFAOYSA-N 1 2 235.331 2.235 20 0 BEADLO Cc1cccc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)c1F ZINC000648592727 387363946 /nfs/dbraw/zinc/36/39/46/387363946.db2.gz WKTITKTYPCEBMF-NWDGAFQWSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1cccc(C[N@H+]2CCO[C@@H]3C[C@@H]32)c1F ZINC000648592727 387363950 /nfs/dbraw/zinc/36/39/50/387363950.db2.gz WKTITKTYPCEBMF-NWDGAFQWSA-N 1 2 221.275 2.107 20 0 BEADLO CC(=O)C[N@@H+]([C@H](C)c1ccco1)C1CC1 ZINC000639537891 387370319 /nfs/dbraw/zinc/37/03/19/387370319.db2.gz BYFONEKBTPVRHX-SNVBAGLBSA-N 1 2 207.273 2.394 20 0 BEADLO CC(=O)C[N@H+]([C@H](C)c1ccco1)C1CC1 ZINC000639537891 387370326 /nfs/dbraw/zinc/37/03/26/387370326.db2.gz BYFONEKBTPVRHX-SNVBAGLBSA-N 1 2 207.273 2.394 20 0 BEADLO Cc1cc(NC[C@@H](O)C2CCC2)nc(C(C)C)[nH+]1 ZINC000315476726 387376456 /nfs/dbraw/zinc/37/64/56/387376456.db2.gz DBKXPKLKWKZGJA-GFCCVEGCSA-N 1 2 249.358 2.481 20 0 BEADLO CC[C@H]1C[C@@H](Nc2ccc(OC)c[nH+]2)CCO1 ZINC000648481894 387381646 /nfs/dbraw/zinc/38/16/46/387381646.db2.gz QXWLHLJYVQUGAR-QWRGUYRKSA-N 1 2 236.315 2.460 20 0 BEADLO CCc1ccc(C[N@@H+]2CCOC3(CCC3)C2)nc1 ZINC000336494275 387319985 /nfs/dbraw/zinc/31/99/85/387319985.db2.gz MJLFSXQPCUYKAF-UHFFFAOYSA-N 1 2 246.354 2.399 20 0 BEADLO CCc1ccc(C[N@H+]2CCOC3(CCC3)C2)nc1 ZINC000336494275 387319986 /nfs/dbraw/zinc/31/99/86/387319986.db2.gz MJLFSXQPCUYKAF-UHFFFAOYSA-N 1 2 246.354 2.399 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1ncc(C(C)C)s1 ZINC000354058540 387321365 /nfs/dbraw/zinc/32/13/65/387321365.db2.gz IMOPPBAVSIHYEG-SNVBAGLBSA-N 1 2 240.372 2.487 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1ncc(C(C)C)s1 ZINC000354058540 387321370 /nfs/dbraw/zinc/32/13/70/387321370.db2.gz IMOPPBAVSIHYEG-SNVBAGLBSA-N 1 2 240.372 2.487 20 0 BEADLO Cn1c2cccc(F)c2[nH]c1=[NH+]CC1(C)CC1 ZINC000354131562 387333643 /nfs/dbraw/zinc/33/36/43/387333643.db2.gz JOSZBQBQLKOMBT-UHFFFAOYSA-N 1 2 233.290 2.346 20 0 BEADLO C[C@H](CF)[NH2+]Cc1cccc(O)c1Cl ZINC000292963259 387337844 /nfs/dbraw/zinc/33/78/44/387337844.db2.gz LPTCBDBIPZIRQJ-SSDOTTSWSA-N 1 2 217.671 2.493 20 0 BEADLO COc1cc(C)ccc1CNc1c[nH]c[nH+]1 ZINC000648563040 387341365 /nfs/dbraw/zinc/34/13/65/387341365.db2.gz JEWUTFKZCVKKBJ-UHFFFAOYSA-N 1 2 217.272 2.339 20 0 BEADLO COc1ncccc1C[NH2+][C@H](C)c1cscn1 ZINC000162354301 387345964 /nfs/dbraw/zinc/34/59/64/387345964.db2.gz WMMRUXLKCGQGGW-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO COc1ncccc1C[NH2+][C@@H](C)c1cscn1 ZINC000162354183 387345980 /nfs/dbraw/zinc/34/59/80/387345980.db2.gz WMMRUXLKCGQGGW-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCc2ncsc2C1 ZINC000361332526 387441132 /nfs/dbraw/zinc/44/11/32/387441132.db2.gz SSILEDTWMXWUMP-UHFFFAOYSA-N 1 2 249.339 2.306 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCc2ncsc2C1 ZINC000361332526 387441137 /nfs/dbraw/zinc/44/11/37/387441137.db2.gz SSILEDTWMXWUMP-UHFFFAOYSA-N 1 2 249.339 2.306 20 0 BEADLO CCC[C@H]([NH2+]Cc1ccc(C)cc1)C(=O)OC ZINC000354930794 387448624 /nfs/dbraw/zinc/44/86/24/387448624.db2.gz ZAWJKHFUWYTIPV-ZDUSSCGKSA-N 1 2 235.327 2.426 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ccncn1)c1cscn1 ZINC000515500519 387391262 /nfs/dbraw/zinc/39/12/62/387391262.db2.gz LQIUWNILHKWPQB-RKDXNWHRSA-N 1 2 234.328 2.345 20 0 BEADLO Cc1ccnc(C[NH2+][C@@H](C)c2cccnc2)n1 ZINC000361085136 387399660 /nfs/dbraw/zinc/39/96/60/387399660.db2.gz GLKJNAAQWOXBFJ-NSHDSACASA-N 1 2 228.299 2.031 20 0 BEADLO Cc1noc([C@@H](C)[NH2+][C@H](C)c2cccnc2)n1 ZINC000361094955 387401718 /nfs/dbraw/zinc/40/17/18/387401718.db2.gz FJMXMXCBSCCZFN-RKDXNWHRSA-N 1 2 232.287 2.185 20 0 BEADLO CC[C@@H]1C[C@H](Nc2[nH+]cccc2OC)CCO1 ZINC000648491210 387401768 /nfs/dbraw/zinc/40/17/68/387401768.db2.gz IJRWWNXLANXAJV-GHMZBOCLSA-N 1 2 236.315 2.460 20 0 BEADLO C[C@@H]([NH2+]Cc1ccn[nH]1)c1ccc(F)cc1 ZINC000036900109 387408230 /nfs/dbraw/zinc/40/82/30/387408230.db2.gz GCGRTGAAEYUKAC-SECBINFHSA-N 1 2 219.263 2.400 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1coc2ccccc12 ZINC000361182977 387412134 /nfs/dbraw/zinc/41/21/34/387412134.db2.gz LFFVZXFNJWGOKK-JTQLQIEISA-N 1 2 247.294 2.426 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1coc2ccccc12 ZINC000361182977 387412141 /nfs/dbraw/zinc/41/21/41/387412141.db2.gz LFFVZXFNJWGOKK-JTQLQIEISA-N 1 2 247.294 2.426 20 0 BEADLO CC(C)n1ccc(C[NH2+][C@H](C)c2cnn(C)c2)n1 ZINC000268972701 387417698 /nfs/dbraw/zinc/41/76/98/387417698.db2.gz AYEITWYHKCKHBQ-LLVKDONJSA-N 1 2 247.346 2.048 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1C[C@@H](C)OC2(CCCC2)C1 ZINC000648076948 387504021 /nfs/dbraw/zinc/50/40/21/387504021.db2.gz RXARZINHMIEKPN-GFCCVEGCSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1C[C@@H](C)OC2(CCCC2)C1 ZINC000648076948 387504024 /nfs/dbraw/zinc/50/40/24/387504024.db2.gz RXARZINHMIEKPN-GFCCVEGCSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1C[C@@H](C)OC2(CCCC2)C1 ZINC000648076948 387504028 /nfs/dbraw/zinc/50/40/28/387504028.db2.gz RXARZINHMIEKPN-GFCCVEGCSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1C[C@@H](C)OC2(CCCC2)C1 ZINC000648076948 387504031 /nfs/dbraw/zinc/50/40/31/387504031.db2.gz RXARZINHMIEKPN-GFCCVEGCSA-N 1 2 249.358 2.252 20 0 BEADLO FC(F)CC1CN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000425282388 387523419 /nfs/dbraw/zinc/52/34/19/387523419.db2.gz KXDTZPHMBRXQDE-UHFFFAOYSA-N 1 2 239.269 2.445 20 0 BEADLO CC(C)c1cnc(C[N@H+](C)C2CC(O)C2)s1 ZINC000355367487 387528872 /nfs/dbraw/zinc/52/88/72/387528872.db2.gz PGTGXQWFWDSMJY-UHFFFAOYSA-N 1 2 240.372 2.222 20 0 BEADLO CC(C)c1cnc(C[N@@H+](C)C2CC(O)C2)s1 ZINC000355367487 387528874 /nfs/dbraw/zinc/52/88/74/387528874.db2.gz PGTGXQWFWDSMJY-UHFFFAOYSA-N 1 2 240.372 2.222 20 0 BEADLO CCN(CC)C(=O)NCc1c[nH+]c(C)cc1C ZINC000397024649 387532143 /nfs/dbraw/zinc/53/21/43/387532143.db2.gz IUCNGVIUABVPEB-UHFFFAOYSA-N 1 2 235.331 2.250 20 0 BEADLO CCCC(=O)NCc1c[nH+]c(C)cc1C ZINC000397074739 387538955 /nfs/dbraw/zinc/53/89/55/387538955.db2.gz DCBMVZACXQOJEU-UHFFFAOYSA-N 1 2 206.289 2.115 20 0 BEADLO Cc1cnc([C@H](C)[N@H+](C)C[C@@H]2CCCO2)o1 ZINC000355057201 387472047 /nfs/dbraw/zinc/47/20/47/387472047.db2.gz JPJGZHQBAHSELN-QWRGUYRKSA-N 1 2 224.304 2.155 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+](C)C[C@@H]2CCCO2)o1 ZINC000355057201 387472050 /nfs/dbraw/zinc/47/20/50/387472050.db2.gz JPJGZHQBAHSELN-QWRGUYRKSA-N 1 2 224.304 2.155 20 0 BEADLO Cc1cn2c([nH+]1)CN(C(=O)C1CCCCC1)CC2 ZINC000374665733 387478817 /nfs/dbraw/zinc/47/88/17/387478817.db2.gz UCUSCUDHSKMBCO-UHFFFAOYSA-N 1 2 247.342 2.114 20 0 BEADLO CC[C@@H](C)[C@@H](C)C(=O)N1CCn2cc(C)[nH+]c2C1 ZINC000374673425 387480995 /nfs/dbraw/zinc/48/09/95/387480995.db2.gz AMPRRKSDWOIAFY-ZYHUDNBSSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C1CC(C)(C)C1 ZINC000336630745 387482260 /nfs/dbraw/zinc/48/22/60/387482260.db2.gz ZMNNRZSYWTWGGL-UHFFFAOYSA-N 1 2 218.300 2.187 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H]1C[C@H](c2ccccc2)[C@@H]1C ZINC000355171981 387492122 /nfs/dbraw/zinc/49/21/22/387492122.db2.gz XBLAYPWFCOLABJ-AUZPSNTRSA-N 1 2 247.338 2.330 20 0 BEADLO CC[C@@H](NCc1c[nH+]c2ccccn12)C(F)F ZINC000648619197 387582294 /nfs/dbraw/zinc/58/22/94/387582294.db2.gz ATVZREZNKBXLMW-SNVBAGLBSA-N 1 2 239.269 2.468 20 0 BEADLO CC[C@@H]([NH2+]Cc1cnc2ccccn12)C(F)F ZINC000648619197 387582297 /nfs/dbraw/zinc/58/22/97/387582297.db2.gz ATVZREZNKBXLMW-SNVBAGLBSA-N 1 2 239.269 2.468 20 0 BEADLO CCN(C(=O)NCc1cc(C)[nH+]c(C)c1)C1CC1 ZINC000422206968 387586075 /nfs/dbraw/zinc/58/60/75/387586075.db2.gz LOKPONNUKNEIAP-UHFFFAOYSA-N 1 2 247.342 2.392 20 0 BEADLO Cc1nc(C[N@H+]2CCOCC[C@@H]2C)cs1 ZINC000362232774 387587650 /nfs/dbraw/zinc/58/76/50/387587650.db2.gz CUUOQRFNNQURIC-VIFPVBQESA-N 1 2 226.345 2.062 20 0 BEADLO Cc1nc(C[N@@H+]2CCOCC[C@@H]2C)cs1 ZINC000362232774 387587653 /nfs/dbraw/zinc/58/76/53/387587653.db2.gz CUUOQRFNNQURIC-VIFPVBQESA-N 1 2 226.345 2.062 20 0 BEADLO Cc1n[nH]cc1C[NH2+][C@H](C)c1cscn1 ZINC000161762266 387591536 /nfs/dbraw/zinc/59/15/36/387591536.db2.gz DNOWGQQDFDJQNM-MRVPVSSYSA-N 1 2 222.317 2.025 20 0 BEADLO FC(F)C[NH2+]Cc1cc(-c2ccccc2)n[nH]1 ZINC000362305489 387594272 /nfs/dbraw/zinc/59/42/72/387594272.db2.gz MRIIYHWCDLVBIP-UHFFFAOYSA-N 1 2 237.253 2.431 20 0 BEADLO CCOc1cccc(C[NH+]2CC(C)(OC)C2)c1 ZINC000362308928 387595234 /nfs/dbraw/zinc/59/52/34/387595234.db2.gz MHMRJMHSTBZJES-UHFFFAOYSA-N 1 2 235.327 2.306 20 0 BEADLO Cc1cc(N[C@H]2C[C@@H]2C2CC2)nc(C2CC2)[nH+]1 ZINC000362375614 387604342 /nfs/dbraw/zinc/60/43/42/387604342.db2.gz KGPFVSCHQRMFOD-NEPJUHHUSA-N 1 2 229.327 2.295 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)CCCC(F)(F)F ZINC000356027703 387608020 /nfs/dbraw/zinc/60/80/20/387608020.db2.gz XUBYYVHXFPGSFY-UHFFFAOYSA-N 1 2 246.232 2.483 20 0 BEADLO CCCCN(CC)C(=O)[C@@H]1CCc2[nH+]ccn2C1 ZINC000376182167 387613020 /nfs/dbraw/zinc/61/30/20/387613020.db2.gz QDBCXZDMQJAUEF-GFCCVEGCSA-N 1 2 249.358 2.094 20 0 BEADLO c1snnc1C[N@@H+]1CCC2(CCCC2)C1 ZINC000124667770 387625184 /nfs/dbraw/zinc/62/51/84/387625184.db2.gz ZPPXCBXUDFHAIG-UHFFFAOYSA-N 1 2 223.345 2.304 20 0 BEADLO c1snnc1C[N@H+]1CCC2(CCCC2)C1 ZINC000124667770 387625187 /nfs/dbraw/zinc/62/51/87/387625187.db2.gz ZPPXCBXUDFHAIG-UHFFFAOYSA-N 1 2 223.345 2.304 20 0 BEADLO CCC[C@](C)(CC)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000527246440 387550200 /nfs/dbraw/zinc/55/02/00/387550200.db2.gz QAECWGYAQDLRAL-AWEZNQCLSA-N 1 2 249.358 2.483 20 0 BEADLO OCC[C@H]1CCC[N@@H+]1Cc1ncc(Cl)s1 ZINC000426251175 387551114 /nfs/dbraw/zinc/55/11/14/387551114.db2.gz JTFCZYAHRRUPHP-MRVPVSSYSA-N 1 2 246.763 2.143 20 0 BEADLO OCC[C@H]1CCC[N@H+]1Cc1ncc(Cl)s1 ZINC000426251175 387551116 /nfs/dbraw/zinc/55/11/16/387551116.db2.gz JTFCZYAHRRUPHP-MRVPVSSYSA-N 1 2 246.763 2.143 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2[C@@H]3CCCO[C@H]23)c(C)[nH+]1 ZINC000355629892 387558862 /nfs/dbraw/zinc/55/88/62/387558862.db2.gz SUYYAAHTHQKGDI-UHTWSYAYSA-N 1 2 246.310 2.062 20 0 BEADLO c1ccc2[nH+]c(NC[C@H]3COCCO3)ccc2c1 ZINC000038062149 387571806 /nfs/dbraw/zinc/57/18/06/387571806.db2.gz FIRUPPCEJQOTQM-LBPRGKRZSA-N 1 2 244.294 2.062 20 0 BEADLO CCCC[N@@H+]1CC(=O)NC12CCC1(CC1)CC2 ZINC000362606138 387639403 /nfs/dbraw/zinc/63/94/03/387639403.db2.gz LJQAYSZBTOSKJE-UHFFFAOYSA-N 1 2 236.359 2.269 20 0 BEADLO CCCC[N@H+]1CC(=O)NC12CCC1(CC1)CC2 ZINC000362606138 387639408 /nfs/dbraw/zinc/63/94/08/387639408.db2.gz LJQAYSZBTOSKJE-UHFFFAOYSA-N 1 2 236.359 2.269 20 0 BEADLO Cc1n[nH]c(C)c1CNc1c[nH+]cc(C)c1 ZINC000125083482 387642857 /nfs/dbraw/zinc/64/28/57/387642857.db2.gz OWTQPMVNXZIXQV-UHFFFAOYSA-N 1 2 216.288 2.342 20 0 BEADLO CCOc1cccc(CNc2cc[nH+]cc2F)n1 ZINC000362800897 387659633 /nfs/dbraw/zinc/65/96/33/387659633.db2.gz JRBWHZXOMIURHQ-UHFFFAOYSA-N 1 2 247.273 2.048 20 0 BEADLO C[C@H](CC(=O)Nc1ccccc1)[NH2+]CC(F)F ZINC000306063505 387675209 /nfs/dbraw/zinc/67/52/09/387675209.db2.gz XSFYRJSLWHILGK-SECBINFHSA-N 1 2 242.269 2.258 20 0 BEADLO CCCN(C)C(=O)N[C@H](C)c1[nH+]ccn1CC ZINC000451929340 387681886 /nfs/dbraw/zinc/68/18/86/387681886.db2.gz NSTPDJWCQLYOKR-SNVBAGLBSA-N 1 2 238.335 2.015 20 0 BEADLO Cc1nccc(C[NH2+][C@@H](C)c2ncccc2F)n1 ZINC000527827982 387748165 /nfs/dbraw/zinc/74/81/65/387748165.db2.gz MHTVHJCVVGXREE-VIFPVBQESA-N 1 2 246.289 2.170 20 0 BEADLO CC[C@H](F)C[N@@H+]1C[C@H](C)N(CC)C[C@H]1C ZINC000440790283 387698397 /nfs/dbraw/zinc/69/83/97/387698397.db2.gz KKWDGQLPJRDZAQ-TUAOUCFPSA-N 1 2 216.344 2.149 20 0 BEADLO CC[C@H](F)C[N@H+]1C[C@H](C)N(CC)C[C@H]1C ZINC000440790283 387698403 /nfs/dbraw/zinc/69/84/03/387698403.db2.gz KKWDGQLPJRDZAQ-TUAOUCFPSA-N 1 2 216.344 2.149 20 0 BEADLO c1cc(OCC[C@@H]2CCCCO2)cc[nH+]1 ZINC000431495244 387713019 /nfs/dbraw/zinc/71/30/19/387713019.db2.gz NTYBQZZPWRZQQS-NSHDSACASA-N 1 2 207.273 2.420 20 0 BEADLO Cc1[nH]c(CNCc2cccnc2C)[nH+]c1C ZINC000527794228 387719279 /nfs/dbraw/zinc/71/92/79/387719279.db2.gz WJGGNZVTDOBGIS-UHFFFAOYSA-N 1 2 230.315 2.020 20 0 BEADLO CC(C)c1nc(N2CC[C@]3(CCOC3)C2)cc[nH+]1 ZINC000129200796 387763305 /nfs/dbraw/zinc/76/33/05/387763305.db2.gz OOLQSFMSBCVOPG-AWEZNQCLSA-N 1 2 247.342 2.217 20 0 BEADLO COc1ccc[nH+]c1N1CC[C@@H](C)[C@H]1C ZINC000527909558 387764416 /nfs/dbraw/zinc/76/44/16/387764416.db2.gz CBCKRFMIAPAWRJ-NXEZZACHSA-N 1 2 206.289 2.325 20 0 BEADLO COC[C@@H]1CCN1c1cc(C)[nH+]c(C(C)C)n1 ZINC000432170622 387770217 /nfs/dbraw/zinc/77/02/17/387770217.db2.gz TXUUPFNBUAOCFY-NSHDSACASA-N 1 2 235.331 2.134 20 0 BEADLO CCc1ccc(CC[NH2+][C@@H](CC)C(=O)OC)cc1 ZINC000192850466 387771095 /nfs/dbraw/zinc/77/10/95/387771095.db2.gz SUSPXJZBFWAZPO-AWEZNQCLSA-N 1 2 249.354 2.333 20 0 BEADLO C(c1noc(C2CC2)n1)[N@@H+]1CC[C@@H](C2CC2)C1 ZINC000378313936 387775850 /nfs/dbraw/zinc/77/58/50/387775850.db2.gz HJABZYGPDYEUFT-LLVKDONJSA-N 1 2 233.315 2.179 20 0 BEADLO C(c1noc(C2CC2)n1)[N@H+]1CC[C@@H](C2CC2)C1 ZINC000378313936 387775855 /nfs/dbraw/zinc/77/58/55/387775855.db2.gz HJABZYGPDYEUFT-LLVKDONJSA-N 1 2 233.315 2.179 20 0 BEADLO CCN(CC1CCC1)C(=O)Nc1cc[nH+]cc1C ZINC000432262696 387780118 /nfs/dbraw/zinc/78/01/18/387780118.db2.gz CHZVUGDUVLRIDY-UHFFFAOYSA-N 1 2 247.342 2.466 20 0 BEADLO COC[C@H](Nc1[nH+]c(C)nc2[nH]ccc21)C1CC1 ZINC000441954613 387784347 /nfs/dbraw/zinc/78/43/47/387784347.db2.gz KPQTXVRLOSHIAC-NSHDSACASA-N 1 2 246.314 2.103 20 0 BEADLO CC(=O)Nc1cc(NCc2[nH]cc[nH+]2)ccc1C ZINC000049715326 387787548 /nfs/dbraw/zinc/78/75/48/387787548.db2.gz QTGWTXNSCYMRSF-UHFFFAOYSA-N 1 2 244.298 2.289 20 0 BEADLO COc1ccc[nH+]c1N1CCOC2(CCCC2)C1 ZINC000527936100 387796858 /nfs/dbraw/zinc/79/68/58/387796858.db2.gz RJCVPHZYLUHRBK-UHFFFAOYSA-N 1 2 248.326 2.240 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]Cc1cccnc1C ZINC000527986326 387804473 /nfs/dbraw/zinc/80/44/73/387804473.db2.gz KPIHXNZBYYSGJM-SNVBAGLBSA-N 1 2 230.315 2.272 20 0 BEADLO COc1ccc[nH+]c1N1C[C@@H](C)O[C@H](C2CC2)C1 ZINC000527995868 387806399 /nfs/dbraw/zinc/80/63/99/387806399.db2.gz VPCYGRPXPSUWFK-MFKMUULPSA-N 1 2 248.326 2.094 20 0 BEADLO CCC[C@H](C)[NH2+]Cc1[nH]ncc1Br ZINC000379418834 387829046 /nfs/dbraw/zinc/82/90/46/387829046.db2.gz WVDQTVSLWJIVAL-ZETCQYMHSA-N 1 2 246.152 2.450 20 0 BEADLO CC(=O)Nc1ccc(CNc2cccc[nH+]2)cn1 ZINC000432845582 387832973 /nfs/dbraw/zinc/83/29/73/387832973.db2.gz FJAFLTBLQGVRHD-UHFFFAOYSA-N 1 2 242.282 2.047 20 0 BEADLO c1ccc(NCC[C@@H]2CCCOC2)[nH+]c1 ZINC000528071435 387842739 /nfs/dbraw/zinc/84/27/39/387842739.db2.gz JUILLRZZWHDIIK-NSHDSACASA-N 1 2 206.289 2.310 20 0 BEADLO O=c1[nH]c2c(cc1CNc1cccc[nH+]1)CCC2 ZINC000528133314 387850222 /nfs/dbraw/zinc/85/02/22/387850222.db2.gz QZTWGXJFWPBOLP-UHFFFAOYSA-N 1 2 241.294 2.283 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1CCC[C@H]2OCC[C@H]21 ZINC000582576402 387850907 /nfs/dbraw/zinc/85/09/07/387850907.db2.gz LZGIGRZQNDTOLH-YNEHKIRRSA-N 1 2 247.342 2.463 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@H]1CCC(C)(C)C1 ZINC000452569309 387859948 /nfs/dbraw/zinc/85/99/48/387859948.db2.gz FRXLYXYCMUHZJH-NSHDSACASA-N 1 2 249.358 2.346 20 0 BEADLO CC1(C)OC[C@H]2C[C@]21Nc1cc[nH+]c(C2CC2)n1 ZINC000528127539 387860923 /nfs/dbraw/zinc/86/09/23/387860923.db2.gz LQEFNMRRYCLUSJ-YGRLFVJLSA-N 1 2 245.326 2.333 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C[C@@H](C)C(C)C ZINC000452576786 387862041 /nfs/dbraw/zinc/86/20/41/387862041.db2.gz VIGCOZYOAKNMRZ-LLVKDONJSA-N 1 2 237.347 2.201 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1CCOC(C)(C)C1 ZINC000528338505 387894361 /nfs/dbraw/zinc/89/43/61/387894361.db2.gz NHVKKWAONRBQLR-WTKPLQERSA-N 1 2 203.713 2.240 20 0 BEADLO C/C(Cl)=C/C[N@H+]1CCOC(C)(C)C1 ZINC000528338505 387894367 /nfs/dbraw/zinc/89/43/67/387894367.db2.gz NHVKKWAONRBQLR-WTKPLQERSA-N 1 2 203.713 2.240 20 0 BEADLO Cc1ccc(NCc2ccn(C)c2)c[nH+]1 ZINC000154259109 387897312 /nfs/dbraw/zinc/89/73/12/387897312.db2.gz MFHRAAQEMFDIRC-UHFFFAOYSA-N 1 2 201.273 2.341 20 0 BEADLO O=C(CCNc1cccc[nH+]1)N1CCCCCC1 ZINC000194848755 387897859 /nfs/dbraw/zinc/89/78/59/387897859.db2.gz MAUMKRJMGAAWPQ-UHFFFAOYSA-N 1 2 247.342 2.286 20 0 BEADLO Cc1ncccc1CNc1cc[nH+]c(C(C)C)n1 ZINC000528185482 387875283 /nfs/dbraw/zinc/87/52/83/387875283.db2.gz YMWIFIVPUOTZFS-UHFFFAOYSA-N 1 2 242.326 2.337 20 0 BEADLO CC(C)[N@H+](C)Cc1nc([C@@H]2CC[C@@H](C)O2)no1 ZINC000528248054 387876522 /nfs/dbraw/zinc/87/65/22/387876522.db2.gz GQHNTOXUOLKBAZ-ZJUUUORDSA-N 1 2 239.319 2.150 20 0 BEADLO CC(C)[N@@H+](C)Cc1nc([C@@H]2CC[C@@H](C)O2)no1 ZINC000528248054 387876530 /nfs/dbraw/zinc/87/65/30/387876530.db2.gz GQHNTOXUOLKBAZ-ZJUUUORDSA-N 1 2 239.319 2.150 20 0 BEADLO COc1cccc2c(NCC3COC3)cc[nH+]c12 ZINC000528226221 387882603 /nfs/dbraw/zinc/88/26/03/387882603.db2.gz PWIOSDKYDSRXFG-UHFFFAOYSA-N 1 2 244.294 2.302 20 0 BEADLO CO[C@H](Cc1ccc(F)cc1)Cn1cc[nH+]c1 ZINC000528404144 387887107 /nfs/dbraw/zinc/88/71/07/387887107.db2.gz OKSRCVJCRAPBCD-CYBMUJFWSA-N 1 2 234.274 2.280 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)[C@@]1(C)CC=CCC1 ZINC000448706931 387889315 /nfs/dbraw/zinc/88/93/15/387889315.db2.gz BFYHHETVXAHUJG-JSGCOSHPSA-N 1 2 247.342 2.134 20 0 BEADLO C[N@H+](Cc1ncccc1Cl)[C@H]1CCCOC1 ZINC000528502436 387907177 /nfs/dbraw/zinc/90/71/77/387907177.db2.gz ABGJCUOZTHZFIT-JTQLQIEISA-N 1 2 240.734 2.346 20 0 BEADLO C[N@@H+](Cc1ncccc1Cl)[C@H]1CCCOC1 ZINC000528502436 387907180 /nfs/dbraw/zinc/90/71/80/387907180.db2.gz ABGJCUOZTHZFIT-JTQLQIEISA-N 1 2 240.734 2.346 20 0 BEADLO C[N@@H+](Cc1ncccc1Cl)C[C@@H]1CCCO1 ZINC000528360470 387911480 /nfs/dbraw/zinc/91/14/80/387911480.db2.gz YLKUBSIIKSWPBI-JTQLQIEISA-N 1 2 240.734 2.346 20 0 BEADLO C[N@H+](Cc1ncccc1Cl)C[C@@H]1CCCO1 ZINC000528360470 387911483 /nfs/dbraw/zinc/91/14/83/387911483.db2.gz YLKUBSIIKSWPBI-JTQLQIEISA-N 1 2 240.734 2.346 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cncs2)[C@@H](C)[C@@H](C)O1 ZINC000438363938 387929440 /nfs/dbraw/zinc/92/94/40/387929440.db2.gz MOLVBLHXTZXZJW-KXUCPTDWSA-N 1 2 226.345 2.141 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cncs2)[C@@H](C)[C@@H](C)O1 ZINC000438363938 387929442 /nfs/dbraw/zinc/92/94/42/387929442.db2.gz MOLVBLHXTZXZJW-KXUCPTDWSA-N 1 2 226.345 2.141 20 0 BEADLO Cc1cc(NC(=O)c2ncccc2F)cc[nH+]1 ZINC000169930124 387930108 /nfs/dbraw/zinc/93/01/08/387930108.db2.gz QCROGGGZPNGHPZ-UHFFFAOYSA-N 1 2 231.230 2.176 20 0 BEADLO c1nc2c(s1)C[N@H+](Cc1ccncc1)CC2 ZINC000438367919 387930951 /nfs/dbraw/zinc/93/09/51/387930951.db2.gz YQTSEKMTKVVELN-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1nc2c(s1)C[N@@H+](Cc1ccncc1)CC2 ZINC000438367919 387930953 /nfs/dbraw/zinc/93/09/53/387930953.db2.gz YQTSEKMTKVVELN-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO O=C(CCn1cc[nH+]c1)NCC1CCCCCC1 ZINC000452798836 387924338 /nfs/dbraw/zinc/92/43/38/387924338.db2.gz RGXFANUJBDRABS-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO Cc1ccc(C[N@@H+]2CCc3ncsc3C2)cn1 ZINC000438344197 387926601 /nfs/dbraw/zinc/92/66/01/387926601.db2.gz FXTBTDBHULGMHL-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ccc(C[N@H+]2CCc3ncsc3C2)cn1 ZINC000438344197 387926604 /nfs/dbraw/zinc/92/66/04/387926604.db2.gz FXTBTDBHULGMHL-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cn1cccc1C[N@@H+]1CCc2ncsc2C1 ZINC000438363752 387928901 /nfs/dbraw/zinc/92/89/01/387928901.db2.gz IJDOOVUSBVGWTH-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO Cn1cccc1C[N@H+]1CCc2ncsc2C1 ZINC000438363752 387928904 /nfs/dbraw/zinc/92/89/04/387928904.db2.gz IJDOOVUSBVGWTH-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO CCCCOCC[NH2+]C(CC)(CC)C(=O)OC ZINC001645424872 1172667478 /nfs/dbraw/zinc/66/74/78/1172667478.db2.gz UNXVKPSJKPVQJA-UHFFFAOYSA-N 1 2 245.363 2.125 20 0 BEADLO Cc1ncsc1C[N@H+]1C[C@H](C)OC[C@H]1C ZINC000245546810 387959396 /nfs/dbraw/zinc/95/93/96/387959396.db2.gz VVFSMJUMUCLYKZ-BDAKNGLRSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ncsc1C[N@@H+]1C[C@H](C)OC[C@H]1C ZINC000245546810 387959399 /nfs/dbraw/zinc/95/93/99/387959399.db2.gz VVFSMJUMUCLYKZ-BDAKNGLRSA-N 1 2 226.345 2.061 20 0 BEADLO CCn1cccc1CNc1cc[nH+]cc1F ZINC000453045421 387970703 /nfs/dbraw/zinc/97/07/03/387970703.db2.gz BPANOXIUAGDLRV-UHFFFAOYSA-N 1 2 219.263 2.076 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2nnc(C)[nH]2)c(C)o1 ZINC000392343945 387957138 /nfs/dbraw/zinc/95/71/38/387957138.db2.gz DBSXMEHSSAAEFU-MRVPVSSYSA-N 1 2 234.303 2.174 20 0 BEADLO CC(C)Cn1ccnc1C[NH2+][C@H](C)c1cn[nH]c1 ZINC000438830204 387957808 /nfs/dbraw/zinc/95/78/08/387957808.db2.gz NCKZVVYLPWRYFN-LLVKDONJSA-N 1 2 247.346 2.113 20 0 BEADLO C[NH2+]Cc1noc([C@H]2C[C@H]2c2ccc(C)cc2)n1 ZINC000424342056 387981788 /nfs/dbraw/zinc/98/17/88/387981788.db2.gz WSCCLWIBEJCMIU-RYUDHWBXSA-N 1 2 243.310 2.369 20 0 BEADLO CC(C)C[N@@H+]1CC(=O)NC12C[C@@H](C)C[C@H](C)C2 ZINC000439142004 387981784 /nfs/dbraw/zinc/98/17/84/387981784.db2.gz NGJMYPMVQNJPLJ-RYUDHWBXSA-N 1 2 238.375 2.227 20 0 BEADLO CC(C)C[N@H+]1CC(=O)NC12C[C@@H](C)C[C@H](C)C2 ZINC000439142004 387981786 /nfs/dbraw/zinc/98/17/86/387981786.db2.gz NGJMYPMVQNJPLJ-RYUDHWBXSA-N 1 2 238.375 2.227 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H](C)O[C@H](C)[C@H]2C)oc1C ZINC000446071237 387993260 /nfs/dbraw/zinc/99/32/60/387993260.db2.gz IXGLHXDSITVMKB-MKPLZMMCSA-N 1 2 238.331 2.289 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H](C)O[C@H](C)[C@H]2C)oc1C ZINC000446071237 387993261 /nfs/dbraw/zinc/99/32/61/387993261.db2.gz IXGLHXDSITVMKB-MKPLZMMCSA-N 1 2 238.331 2.289 20 0 BEADLO CSCCC[N@H+](C)Cc1ncnn1C(C)C ZINC000439465715 388000665 /nfs/dbraw/zinc/00/06/65/388000665.db2.gz GGWHIAKKEYZPSZ-UHFFFAOYSA-N 1 2 242.392 2.044 20 0 BEADLO CSCCC[N@@H+](C)Cc1ncnn1C(C)C ZINC000439465715 388000669 /nfs/dbraw/zinc/00/06/69/388000669.db2.gz GGWHIAKKEYZPSZ-UHFFFAOYSA-N 1 2 242.392 2.044 20 0 BEADLO Cn1ccnc1C[NH2+]Cc1cc2ccccc2o1 ZINC000071138945 388013890 /nfs/dbraw/zinc/01/38/90/388013890.db2.gz ZUVKTAHRTFHMEA-UHFFFAOYSA-N 1 2 241.294 2.456 20 0 BEADLO CC[C@H]([NH2+][C@@H](C)c1cn[nH]c1)C(F)F ZINC000453227772 388015833 /nfs/dbraw/zinc/01/58/33/388015833.db2.gz BGDIRMPTCSRWNE-XPUUQOCRSA-N 1 2 203.236 2.104 20 0 BEADLO CO[C@H]1C[C@H](Nc2cc[nH+]c(C3CC3)n2)C1(C)C ZINC000440190216 388036116 /nfs/dbraw/zinc/03/61/16/388036116.db2.gz IYTWFYKVJIRPHH-QWRGUYRKSA-N 1 2 247.342 2.001 20 0 BEADLO Cc1nccnc1[C@H](C)[NH2+][C@@H](C)c1ccon1 ZINC000446890303 388043850 /nfs/dbraw/zinc/04/38/50/388043850.db2.gz IYIUSNLMYMBWFL-WPRPVWTQSA-N 1 2 232.287 2.185 20 0 BEADLO CC[C@H]1C[NH+](Cc2cocn2)C[C@H](CC)O1 ZINC000421392237 388029132 /nfs/dbraw/zinc/02/91/32/388029132.db2.gz QQRXVKJIXCPGFN-RYUDHWBXSA-N 1 2 224.304 2.064 20 0 BEADLO CCOC(=O)C[N@H+](C[C@H](F)CC)C1CCC1 ZINC000440532407 388052607 /nfs/dbraw/zinc/05/26/07/388052607.db2.gz OKDPZBSFDJKIPU-SNVBAGLBSA-N 1 2 231.311 2.152 20 0 BEADLO CCOC(=O)C[N@@H+](C[C@H](F)CC)C1CCC1 ZINC000440532407 388052610 /nfs/dbraw/zinc/05/26/10/388052610.db2.gz OKDPZBSFDJKIPU-SNVBAGLBSA-N 1 2 231.311 2.152 20 0 BEADLO CC[C@H](F)C[N@@H+]1CC[C@H](C)C[C@@H]1C(=O)OC ZINC000440533336 388053577 /nfs/dbraw/zinc/05/35/77/388053577.db2.gz QMWUGLOKWBALAP-GARJFASQSA-N 1 2 231.311 2.008 20 0 BEADLO CC[C@H](F)C[N@H+]1CC[C@H](C)C[C@@H]1C(=O)OC ZINC000440533336 388053580 /nfs/dbraw/zinc/05/35/80/388053580.db2.gz QMWUGLOKWBALAP-GARJFASQSA-N 1 2 231.311 2.008 20 0 BEADLO CCCC[C@H](CC)C(=O)NCc1c[nH+]c[nH]1 ZINC000084081669 388069948 /nfs/dbraw/zinc/06/99/48/388069948.db2.gz RYUBMWFMCRJZLC-JTQLQIEISA-N 1 2 223.320 2.242 20 0 BEADLO CCCC[C@H](CC)C(=O)NCc1c[nH]c[nH+]1 ZINC000084081669 388069950 /nfs/dbraw/zinc/06/99/50/388069950.db2.gz RYUBMWFMCRJZLC-JTQLQIEISA-N 1 2 223.320 2.242 20 0 BEADLO CCCn1ncnc1C[N@H+](CCC)C1CC1 ZINC000447853745 388097964 /nfs/dbraw/zinc/09/79/64/388097964.db2.gz ILSODPHJIVNYAP-UHFFFAOYSA-N 1 2 222.336 2.063 20 0 BEADLO CCCn1ncnc1C[N@@H+](CCC)C1CC1 ZINC000447853745 388097966 /nfs/dbraw/zinc/09/79/66/388097966.db2.gz ILSODPHJIVNYAP-UHFFFAOYSA-N 1 2 222.336 2.063 20 0 BEADLO CC[C@@H](C)NC(=O)N[C@@H](C)c1[nH+]ccn1CC ZINC000454185530 388104145 /nfs/dbraw/zinc/10/41/45/388104145.db2.gz IHFPTOAMTVWLFT-ZJUUUORDSA-N 1 2 238.335 2.062 20 0 BEADLO CC[C@H](CSC)Nc1cc(C)[nH+]cn1 ZINC000162139696 388116014 /nfs/dbraw/zinc/11/60/14/388116014.db2.gz FISIYHMWVNSQNR-SECBINFHSA-N 1 2 211.334 2.339 20 0 BEADLO CCOC(=O)C[N@H+](C[C@H](F)CC)C(C)C ZINC000440498956 388045933 /nfs/dbraw/zinc/04/59/33/388045933.db2.gz LUOBSZFBFUSWOK-SNVBAGLBSA-N 1 2 219.300 2.008 20 0 BEADLO CCOC(=O)C[N@@H+](C[C@H](F)CC)C(C)C ZINC000440498956 388045937 /nfs/dbraw/zinc/04/59/37/388045937.db2.gz LUOBSZFBFUSWOK-SNVBAGLBSA-N 1 2 219.300 2.008 20 0 BEADLO c1nn2ccccc2c1CNc1cccc[nH+]1 ZINC000083353382 388049276 /nfs/dbraw/zinc/04/92/76/388049276.db2.gz GRRUITVVRCNCGE-UHFFFAOYSA-N 1 2 224.267 2.341 20 0 BEADLO CC/C=C\CNC(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000455342058 388156630 /nfs/dbraw/zinc/15/66/30/388156630.db2.gz VGQLLAKALBALNJ-NRFYAWERSA-N 1 2 248.330 2.154 20 0 BEADLO OCC(F)(F)C[NH2+]Cc1cccc2ccoc21 ZINC000449248669 388162422 /nfs/dbraw/zinc/16/24/22/388162422.db2.gz JNZSSAKGWUMUOZ-UHFFFAOYSA-N 1 2 241.237 2.150 20 0 BEADLO CCC[C@@H]([NH2+][C@H](C)Cc1ccoc1)C(=O)OC ZINC000449258797 388163315 /nfs/dbraw/zinc/16/33/15/388163315.db2.gz RBXBZHKECNSXOF-ZYHUDNBSSA-N 1 2 239.315 2.142 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2ccnn2C)c1F ZINC000449293448 388168720 /nfs/dbraw/zinc/16/87/20/388168720.db2.gz HIXRHZAWFFPSBK-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2ccnn2C)c1F ZINC000449293448 388168722 /nfs/dbraw/zinc/16/87/22/388168722.db2.gz HIXRHZAWFFPSBK-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO CC(C)(C)CCC(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000646261800 388173194 /nfs/dbraw/zinc/17/31/94/388173194.db2.gz YAWFWCVCZUUFBP-UHFFFAOYSA-N 1 2 235.331 2.121 20 0 BEADLO CC(C)(C)CCC(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000646261800 388173196 /nfs/dbraw/zinc/17/31/96/388173196.db2.gz YAWFWCVCZUUFBP-UHFFFAOYSA-N 1 2 235.331 2.121 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C1=CC[C@H](C)CC1 ZINC000456096530 388177068 /nfs/dbraw/zinc/17/70/68/388177068.db2.gz IMAYNVOPBGAFGH-NSHDSACASA-N 1 2 247.342 2.266 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@@]1(C)CCC[C@H]1C ZINC000456112427 388178378 /nfs/dbraw/zinc/17/83/78/388178378.db2.gz PNBRUPXWOASXRP-RISCZKNCSA-N 1 2 249.358 2.346 20 0 BEADLO CC[C@@H]([NH2+]Cc1cccn1C)C(F)F ZINC000449361873 388182726 /nfs/dbraw/zinc/18/27/26/388182726.db2.gz LQBCNQCKOXDFFG-SECBINFHSA-N 1 2 202.248 2.158 20 0 BEADLO CCOC(=O)c1cc(C[NH+]2CC3(CC3)C2)[nH]c1C ZINC000449370717 388183949 /nfs/dbraw/zinc/18/39/49/388183949.db2.gz LWWATUQFXPRGOC-UHFFFAOYSA-N 1 2 248.326 2.096 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NCCc2[nH]cc[nH+]2)C[C@H]1C ZINC000448947992 388122486 /nfs/dbraw/zinc/12/24/86/388122486.db2.gz BFLSIFJZXIRVPF-IJLUTSLNSA-N 1 2 249.358 2.141 20 0 BEADLO CCC[C@@H]1CCC[C@@H]1C(=O)NCCc1[nH]cc[nH+]1 ZINC000448955941 388122955 /nfs/dbraw/zinc/12/29/55/388122955.db2.gz YGQSFDDNQUTROV-NEPJUHHUSA-N 1 2 249.358 2.285 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2C[C@H]2CC(C)C)cc[nH+]1 ZINC000448962156 388123423 /nfs/dbraw/zinc/12/34/23/388123423.db2.gz PCKITBIFFHYIRG-DGCLKSJQSA-N 1 2 232.327 2.433 20 0 BEADLO COC(=O)C[N@H+](C)Cc1cccc2ccoc21 ZINC000449012307 388128776 /nfs/dbraw/zinc/12/87/76/388128776.db2.gz AZSYGZYSYROKEM-UHFFFAOYSA-N 1 2 233.267 2.038 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1cccc2ccoc21 ZINC000449012307 388128779 /nfs/dbraw/zinc/12/87/79/388128779.db2.gz AZSYGZYSYROKEM-UHFFFAOYSA-N 1 2 233.267 2.038 20 0 BEADLO Cc1cc(N)nc(SCc2nccs2)[nH+]1 ZINC000162235272 388132076 /nfs/dbraw/zinc/13/20/76/388132076.db2.gz YCGOCPUOAPZDSL-UHFFFAOYSA-N 1 2 238.341 2.116 20 0 BEADLO Cc1cc(NC(=O)NC[C@@H]2C[C@H]2C(C)C)cc[nH+]1 ZINC000455043076 388146070 /nfs/dbraw/zinc/14/60/70/388146070.db2.gz OSMABYRAYOGAAC-AAEUAGOBSA-N 1 2 247.342 2.226 20 0 BEADLO COCc1nc(CNc2cccc[nH+]2)cs1 ZINC000165878625 388253949 /nfs/dbraw/zinc/25/39/49/388253949.db2.gz JTAXPOOECRAOEA-UHFFFAOYSA-N 1 2 235.312 2.297 20 0 BEADLO Cc1ccc(N[C@H](C)[C@@H]2CCOC2)c[nH+]1 ZINC000162931420 388254711 /nfs/dbraw/zinc/25/47/11/388254711.db2.gz VDRIBUMYDMWKEJ-GHMZBOCLSA-N 1 2 206.289 2.227 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)C1CCCC1 ZINC000456344546 388195235 /nfs/dbraw/zinc/19/52/35/388195235.db2.gz HGFJYNLFHBPMJQ-JTQLQIEISA-N 1 2 235.331 2.270 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@@H]1C[C@H]1C1CC1 ZINC000456356444 388196245 /nfs/dbraw/zinc/19/62/45/388196245.db2.gz OVYHROFOJNUUIO-ZMLRMANQSA-N 1 2 247.342 2.126 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)c1cc[nH]c1C ZINC000456358570 388197050 /nfs/dbraw/zinc/19/70/50/388197050.db2.gz QJBXVLYYACOCGH-SNVBAGLBSA-N 1 2 246.314 2.031 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)C1=CCCC1 ZINC000456367752 388197693 /nfs/dbraw/zinc/19/76/93/388197693.db2.gz XEQPQDXFZIKXDJ-JTQLQIEISA-N 1 2 233.315 2.191 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)CCC2CC2)c2[nH+]ccn21 ZINC000456361486 388197919 /nfs/dbraw/zinc/19/79/19/388197919.db2.gz DOJBZLPUBGYADK-MWLCHTKSSA-N 1 2 233.315 2.195 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)C[C@@H]1C=CCC1 ZINC000456375229 388198558 /nfs/dbraw/zinc/19/85/58/388198558.db2.gz GUEOXAYIWQFCFM-NWDGAFQWSA-N 1 2 247.342 2.437 20 0 BEADLO CCCCC(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456407913 388199352 /nfs/dbraw/zinc/19/93/52/388199352.db2.gz YWEWUJRULVZUCW-VHSXEESVSA-N 1 2 221.304 2.195 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)[C@@H]2CC=CCC2)c2[nH+]ccn21 ZINC000456408594 388199443 /nfs/dbraw/zinc/19/94/43/388199443.db2.gz ZEPBFELIRXKVRA-UTUOFQBUSA-N 1 2 245.326 2.361 20 0 BEADLO CC[C@@H](C)C(=O)N[C@@H](C)c1[nH+]ccn1CC ZINC000456404019 388199665 /nfs/dbraw/zinc/19/96/65/388199665.db2.gz WYOXHLWCOPASFL-ZJUUUORDSA-N 1 2 223.320 2.126 20 0 BEADLO CC(C)[C@@H]1C[C@@H]1C(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456423722 388199988 /nfs/dbraw/zinc/19/99/88/388199988.db2.gz OXOADPHCNLGVQG-RHYQMDGZSA-N 1 2 247.342 2.297 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2C2CC2)c2[nH+]ccn21 ZINC000456420418 388200368 /nfs/dbraw/zinc/20/03/68/388200368.db2.gz MNFSIMAFIOJZRY-KLHWPWHYSA-N 1 2 245.326 2.051 20 0 BEADLO C[C@@H]1C[C@@H]1CC(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456431512 388201447 /nfs/dbraw/zinc/20/14/47/388201447.db2.gz SOAXCVLHSMQMPP-LMLFDSFASA-N 1 2 233.315 2.051 20 0 BEADLO CC[N@H+](Cc1cc(F)ccc1OC)C1COC1 ZINC000449423640 388201922 /nfs/dbraw/zinc/20/19/22/388201922.db2.gz IKNNIYIDAYSKAK-UHFFFAOYSA-N 1 2 239.290 2.055 20 0 BEADLO CC[N@@H+](Cc1cc(F)ccc1OC)C1COC1 ZINC000449423640 388201924 /nfs/dbraw/zinc/20/19/24/388201924.db2.gz IKNNIYIDAYSKAK-UHFFFAOYSA-N 1 2 239.290 2.055 20 0 BEADLO CC(C)(C)n1cc(C[N@@H+]2CC[C@@H]2C2CC2)nn1 ZINC000449427759 388202466 /nfs/dbraw/zinc/20/24/66/388202466.db2.gz OTGKVKQIHYZJKR-GFCCVEGCSA-N 1 2 234.347 2.017 20 0 BEADLO CC(C)(C)n1cc(C[N@H+]2CC[C@@H]2C2CC2)nn1 ZINC000449427759 388202467 /nfs/dbraw/zinc/20/24/67/388202467.db2.gz OTGKVKQIHYZJKR-GFCCVEGCSA-N 1 2 234.347 2.017 20 0 BEADLO CC[C@H]1CCN1c1nc(C(C)C)[nH+]c(N(C)C)n1 ZINC000489037351 388203009 /nfs/dbraw/zinc/20/30/09/388203009.db2.gz JGJMOSWBMXPUAG-JTQLQIEISA-N 1 2 249.362 2.050 20 0 BEADLO CC[C@H](NC(=O)CCn1cc[nH+]c1)C1CCCC1 ZINC000456656335 388213581 /nfs/dbraw/zinc/21/35/81/388213581.db2.gz IZCCCAXNPPSYJG-ZDUSSCGKSA-N 1 2 249.358 2.358 20 0 BEADLO CO[C@H](C)c1noc(C[N@H+](C)[C@@H]2CC2(C)C)n1 ZINC000489467984 388216379 /nfs/dbraw/zinc/21/63/79/388216379.db2.gz WYTJZQUJDBXKGW-RKDXNWHRSA-N 1 2 239.319 2.007 20 0 BEADLO CO[C@H](C)c1noc(C[N@@H+](C)[C@@H]2CC2(C)C)n1 ZINC000489467984 388216381 /nfs/dbraw/zinc/21/63/81/388216381.db2.gz WYTJZQUJDBXKGW-RKDXNWHRSA-N 1 2 239.319 2.007 20 0 BEADLO Cc1cc(C)c(CNC(=O)CC(C)(F)F)c[nH+]1 ZINC000456840274 388226153 /nfs/dbraw/zinc/22/61/53/388226153.db2.gz NOBAVJVQFBHHGW-UHFFFAOYSA-N 1 2 242.269 2.360 20 0 BEADLO Cc1cc(N2CCC[C@H](OCC3CC3)C2)nc[nH+]1 ZINC000489934729 388229201 /nfs/dbraw/zinc/22/92/01/388229201.db2.gz VCVGDVNAJACEDE-ZDUSSCGKSA-N 1 2 247.342 2.180 20 0 BEADLO CC[C@H]1CN(CC)CC[N@@H+]1Cc1cccnc1C ZINC000449567095 388234747 /nfs/dbraw/zinc/23/47/47/388234747.db2.gz TZDBVPRUMXMFAP-HNNXBMFYSA-N 1 2 247.386 2.306 20 0 BEADLO CC[C@H]1CN(CC)CC[N@H+]1Cc1cccnc1C ZINC000449567095 388234749 /nfs/dbraw/zinc/23/47/49/388234749.db2.gz TZDBVPRUMXMFAP-HNNXBMFYSA-N 1 2 247.386 2.306 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@@H](CC)CSC)no1 ZINC000091099269 256576737 /nfs/dbraw/zinc/57/67/37/256576737.db2.gz VLHBSLQHVCGYLV-VIFPVBQESA-N 1 2 243.376 2.205 20 0 BEADLO CCc1nc(C[N@H+](C)[C@@H](CC)CSC)no1 ZINC000091099269 256576738 /nfs/dbraw/zinc/57/67/38/256576738.db2.gz VLHBSLQHVCGYLV-VIFPVBQESA-N 1 2 243.376 2.205 20 0 BEADLO Cc1ccc(C[N@@H+](CC(F)F)C[C@@H](C)O)cc1 ZINC000449631388 388246427 /nfs/dbraw/zinc/24/64/27/388246427.db2.gz PCMVFYSUIMEHGU-LLVKDONJSA-N 1 2 243.297 2.443 20 0 BEADLO Cc1ccc(C[N@H+](CC(F)F)C[C@@H](C)O)cc1 ZINC000449631388 388246428 /nfs/dbraw/zinc/24/64/28/388246428.db2.gz PCMVFYSUIMEHGU-LLVKDONJSA-N 1 2 243.297 2.443 20 0 BEADLO C[C@H](O)C[N@H+](CC(F)F)[C@H]1C=CCCC1 ZINC000451850081 388300798 /nfs/dbraw/zinc/30/07/98/388300798.db2.gz KFAMNMGRBYBUKD-UWVGGRQHSA-N 1 2 219.275 2.043 20 0 BEADLO C[C@H](O)C[N@@H+](CC(F)F)[C@H]1C=CCCC1 ZINC000451850081 388300799 /nfs/dbraw/zinc/30/07/99/388300799.db2.gz KFAMNMGRBYBUKD-UWVGGRQHSA-N 1 2 219.275 2.043 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)/C=C/c1ccsc1 ZINC000491625367 388305754 /nfs/dbraw/zinc/30/57/54/388305754.db2.gz BYPMPMQZOUPBQH-NSCUHMNNSA-N 1 2 247.323 2.143 20 0 BEADLO O=C(/C=C\C1CC1)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000491905512 388327175 /nfs/dbraw/zinc/32/71/75/388327175.db2.gz OMSPYLCLGHIDNC-DGMVEKRQSA-N 1 2 245.326 2.430 20 0 BEADLO O=C(/C=C/C1CC1)Nc1cccc2[nH+]ccn21 ZINC000491943872 388328872 /nfs/dbraw/zinc/32/88/72/388328872.db2.gz YFQZWDIADWRSJR-VOTSOKGWSA-N 1 2 227.267 2.239 20 0 BEADLO CC[C@@H](NC(=O)/C=C/c1ccc[nH]1)c1[nH]cc[nH+]1 ZINC000491965185 388329904 /nfs/dbraw/zinc/32/99/04/388329904.db2.gz PNJAPXAQHWPTAG-MVIFTORASA-N 1 2 244.298 2.019 20 0 BEADLO COc1ncccc1C[N@H+](C)Cc1ccccn1 ZINC000451368391 388265873 /nfs/dbraw/zinc/26/58/73/388265873.db2.gz OVEHQPCIBPCZRP-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1ncccc1C[N@@H+](C)Cc1ccccn1 ZINC000451368391 388265875 /nfs/dbraw/zinc/26/58/75/388265875.db2.gz OVEHQPCIBPCZRP-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+](C)Cc2ccccn2)cn1 ZINC000451372105 388266721 /nfs/dbraw/zinc/26/67/21/388266721.db2.gz XHHJGVNVCWFONP-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+](C)Cc2ccccn2)cn1 ZINC000451372105 388266723 /nfs/dbraw/zinc/26/67/23/388266723.db2.gz XHHJGVNVCWFONP-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO CC(C)c1nc(C[NH+]2CCC(CF)CC2)no1 ZINC000451388707 388268774 /nfs/dbraw/zinc/26/87/74/388268774.db2.gz LVVDTODXOCPIKI-UHFFFAOYSA-N 1 2 241.310 2.375 20 0 BEADLO FC(F)(F)[C@@H]1CCC[N@H+](Cc2ncccn2)C1 ZINC000191869938 388268866 /nfs/dbraw/zinc/26/88/66/388268866.db2.gz UZFPYRYQMGCDOL-SECBINFHSA-N 1 2 245.248 2.251 20 0 BEADLO FC(F)(F)[C@@H]1CCC[N@@H+](Cc2ncccn2)C1 ZINC000191869938 388268868 /nfs/dbraw/zinc/26/88/68/388268868.db2.gz UZFPYRYQMGCDOL-SECBINFHSA-N 1 2 245.248 2.251 20 0 BEADLO CCC(CC)NC(=O)/C=C\c1[nH+]ccn1CC ZINC000492298541 388340535 /nfs/dbraw/zinc/34/05/35/388340535.db2.gz KRKVDCKNKOWWMH-FPLPWBNLSA-N 1 2 235.331 2.221 20 0 BEADLO CCC(CC)CNC(=O)/C=C\c1[nH+]ccn1CC ZINC000492317611 388341292 /nfs/dbraw/zinc/34/12/92/388341292.db2.gz FUZORBMLMORORX-FPLPWBNLSA-N 1 2 249.358 2.469 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cccs1)c1ncn(C)n1 ZINC000275663337 388345137 /nfs/dbraw/zinc/34/51/37/388345137.db2.gz GFWODZBTKLHJKA-DTWKUNHWSA-N 1 2 236.344 2.288 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1)c1ncn(C)n1 ZINC000275616218 388345170 /nfs/dbraw/zinc/34/51/70/388345170.db2.gz KRURIWUTXXBYKB-UWVGGRQHSA-N 1 2 248.305 2.366 20 0 BEADLO CCC[C@@H]1C[C@H]1Nc1nc[nH+]c(N)c1Cl ZINC000233312285 388345238 /nfs/dbraw/zinc/34/52/38/388345238.db2.gz YEIQNCNOAISTEW-RNFRBKRXSA-N 1 2 226.711 2.313 20 0 BEADLO CCC[C@@H]1C[C@H]1Nc1[nH+]cnc(N)c1Cl ZINC000233312285 388345241 /nfs/dbraw/zinc/34/52/41/388345241.db2.gz YEIQNCNOAISTEW-RNFRBKRXSA-N 1 2 226.711 2.313 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccccc1)c1ncn(C)n1 ZINC000275598868 388345331 /nfs/dbraw/zinc/34/53/31/388345331.db2.gz IZRAHRFYFDTMTQ-WDEREUQCSA-N 1 2 230.315 2.227 20 0 BEADLO Cc1ccsc1C[NH2+][C@H](C)c1ncn(C)n1 ZINC000275746906 388346456 /nfs/dbraw/zinc/34/64/56/388346456.db2.gz COOKHZWIEACWRI-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ncn(C)n1)c1ccsc1 ZINC000275706003 388346535 /nfs/dbraw/zinc/34/65/35/388346535.db2.gz LPDMAPUUGVQABY-RKDXNWHRSA-N 1 2 236.344 2.288 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ncnn1C)c1ccsc1 ZINC000276620282 388350184 /nfs/dbraw/zinc/35/01/84/388350184.db2.gz MGQRGAKIVRRZMG-RKDXNWHRSA-N 1 2 236.344 2.288 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCCc2occc21)c1ncn(C)n1 ZINC000278391822 388354802 /nfs/dbraw/zinc/35/48/02/388354802.db2.gz DVHONCZLZSKZPF-MWLCHTKSSA-N 1 2 246.314 2.136 20 0 BEADLO Cc1nc(N2CC[C@@H](C)[C@H](C)C2)cc[nH+]1 ZINC000162679169 388354881 /nfs/dbraw/zinc/35/48/81/388354881.db2.gz PBAJDWJZESXJLI-NXEZZACHSA-N 1 2 205.305 2.267 20 0 BEADLO CCOc1ccc(C[N@@H+]2CC[C@@H](F)C2)nc1 ZINC000648721606 388355407 /nfs/dbraw/zinc/35/54/07/388355407.db2.gz HLVFLTDIGQRXHZ-SNVBAGLBSA-N 1 2 224.279 2.024 20 0 BEADLO CCOc1ccc(C[N@H+]2CC[C@@H](F)C2)nc1 ZINC000648721606 388355411 /nfs/dbraw/zinc/35/54/11/388355411.db2.gz HLVFLTDIGQRXHZ-SNVBAGLBSA-N 1 2 224.279 2.024 20 0 BEADLO C[C@H]([NH2+][C@H]1CCCc2occc21)c1ncn(C)n1 ZINC000278391825 388355470 /nfs/dbraw/zinc/35/54/70/388355470.db2.gz DVHONCZLZSKZPF-ONGXEEELSA-N 1 2 246.314 2.136 20 0 BEADLO CC[C@H](C)CC(=O)NCCCCn1cc[nH+]c1 ZINC000519261019 256645826 /nfs/dbraw/zinc/64/58/26/256645826.db2.gz WKEJNOYVFQSDSR-LBPRGKRZSA-N 1 2 237.347 2.216 20 0 BEADLO Nc1[nH+]cnc(NCc2ccccc2)c1Cl ZINC000227840489 388371367 /nfs/dbraw/zinc/37/13/67/388371367.db2.gz CWGVCSKYIXKSCJ-UHFFFAOYSA-N 1 2 234.690 2.324 20 0 BEADLO Nc1nc[nH+]c(NCc2ccccc2)c1Cl ZINC000227840489 388371369 /nfs/dbraw/zinc/37/13/69/388371369.db2.gz CWGVCSKYIXKSCJ-UHFFFAOYSA-N 1 2 234.690 2.324 20 0 BEADLO Nc1[nH+]cnc(N[C@@H]2CCCSC2)c1Cl ZINC000236393597 388379251 /nfs/dbraw/zinc/37/92/51/388379251.db2.gz RLDPVSBITKRPTB-ZCFIWIBFSA-N 1 2 244.751 2.020 20 0 BEADLO Nc1nc[nH+]c(N[C@@H]2CCCSC2)c1Cl ZINC000236393597 388379253 /nfs/dbraw/zinc/37/92/53/388379253.db2.gz RLDPVSBITKRPTB-ZCFIWIBFSA-N 1 2 244.751 2.020 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CCCC[C@H]1C)c1[nH]cc[nH+]1 ZINC000572854954 388381226 /nfs/dbraw/zinc/38/12/26/388381226.db2.gz SBAJCIIQILXPBK-MXWKQRLJSA-N 1 2 235.331 2.413 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CCCC[C@@H]1C)c1[nH]cc[nH+]1 ZINC000572854953 388382185 /nfs/dbraw/zinc/38/21/85/388382185.db2.gz SBAJCIIQILXPBK-HBNTYKKESA-N 1 2 235.331 2.413 20 0 BEADLO Cc1nocc1CNc1ccc[nH+]c1C ZINC000292750584 388383481 /nfs/dbraw/zinc/38/34/81/388383481.db2.gz BECWVRJOIZIAHO-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1C[C@H]1CC(C)(C)C ZINC000648806609 388390126 /nfs/dbraw/zinc/39/01/26/388390126.db2.gz QJLIRXQOVDITGH-WDEREUQCSA-N 1 2 249.358 2.407 20 0 BEADLO Cc1[nH]c(CNCc2cc(C)nc(C)c2)[nH+]c1C ZINC000572975817 388401627 /nfs/dbraw/zinc/40/16/27/388401627.db2.gz CRAFDYGBJSBHOB-UHFFFAOYSA-N 1 2 244.342 2.328 20 0 BEADLO CC[N@@H+]1CCO[C@@H](c2ccccc2F)C1 ZINC000066845521 388403359 /nfs/dbraw/zinc/40/33/59/388403359.db2.gz GMJJAPJCESLIBT-GFCCVEGCSA-N 1 2 209.264 2.219 20 0 BEADLO CC[N@H+]1CCO[C@@H](c2ccccc2F)C1 ZINC000066845521 388403363 /nfs/dbraw/zinc/40/33/63/388403363.db2.gz GMJJAPJCESLIBT-GFCCVEGCSA-N 1 2 209.264 2.219 20 0 BEADLO C/C=C(/C=C/C(=O)N1CC(n2cc[nH+]c2)C1)CC ZINC000492138845 388336188 /nfs/dbraw/zinc/33/61/88/388336188.db2.gz QOCHHQFPUJJXRF-VLLKVAHVSA-N 1 2 245.326 2.179 20 0 BEADLO CC=C(C=CC(=O)NCc1[nH]c[nH+]c1C)CC ZINC000492171503 388337271 /nfs/dbraw/zinc/33/72/71/388337271.db2.gz SGNDWDWIZXCOFW-BJNIYONUSA-N 1 2 233.315 2.247 20 0 BEADLO COCC(C)(C)CNc1ccc(N(C)C)[nH+]c1 ZINC000492260297 388339613 /nfs/dbraw/zinc/33/96/13/388339613.db2.gz RITQRADGDSMKCL-UHFFFAOYSA-N 1 2 237.347 2.232 20 0 BEADLO CO[C@@H](C)c1noc(C[NH+]2CCC(C)CC2)n1 ZINC000175062735 388439953 /nfs/dbraw/zinc/43/99/53/388439953.db2.gz ALZRTJIELKVHAF-JTQLQIEISA-N 1 2 239.319 2.009 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2cnn(C)c2)no1 ZINC000071797303 388446194 /nfs/dbraw/zinc/44/61/94/388446194.db2.gz KNSGTVCKQRWJTR-CYBMUJFWSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2cnn(C)c2)no1 ZINC000071797303 388446198 /nfs/dbraw/zinc/44/61/98/388446198.db2.gz KNSGTVCKQRWJTR-CYBMUJFWSA-N 1 2 246.314 2.054 20 0 BEADLO C/C(Cl)=C/C[NH+]1CCN(CC(F)F)CC1 ZINC000528367489 388451487 /nfs/dbraw/zinc/45/14/87/388451487.db2.gz RECYYALNVJULGM-MBXJOHMKSA-N 1 2 238.709 2.012 20 0 BEADLO O=C(/C=C/C1CCCCC1)NC1=[NH+]CCS1 ZINC000117562593 388465009 /nfs/dbraw/zinc/46/50/09/388465009.db2.gz JMWBGAHVXNMVIL-VOTSOKGWSA-N 1 2 238.356 2.342 20 0 BEADLO CC(C)(C)C[C@@H]1C[C@H]1C(=O)Nc1cc[nH+]cc1O ZINC000648843110 388466343 /nfs/dbraw/zinc/46/63/43/388466343.db2.gz XHVGALVBQRUBBQ-VHSXEESVSA-N 1 2 248.326 2.220 20 0 BEADLO COC[C@H](C)Nc1ccc(SC)c[nH+]1 ZINC000134308634 388476090 /nfs/dbraw/zinc/47/60/90/388476090.db2.gz XODVWIDDPSJSGG-QMMMGPOBSA-N 1 2 212.318 2.250 20 0 BEADLO Cc1cc(NC[C@H]2CCCC2(C)C)nc[nH+]1 ZINC000338808227 388477982 /nfs/dbraw/zinc/47/79/82/388477982.db2.gz IGOHVMIQBOUFLF-LLVKDONJSA-N 1 2 219.332 2.445 20 0 BEADLO Cc1cc(NC[C@@H]2CCCC2(C)C)nc[nH+]1 ZINC000338808229 388478278 /nfs/dbraw/zinc/47/82/78/388478278.db2.gz IGOHVMIQBOUFLF-NSHDSACASA-N 1 2 219.332 2.445 20 0 BEADLO Cc1[nH]ncc1C[NH2+]CC1=CCCCC1 ZINC000295065560 388407499 /nfs/dbraw/zinc/40/74/99/388407499.db2.gz GXHXYZQKVVMKEN-UHFFFAOYSA-N 1 2 205.305 2.308 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H](C)OC(C)(C)C2)oc1C ZINC000068474607 388409415 /nfs/dbraw/zinc/40/94/15/388409415.db2.gz PSSZFDPZFGNKGK-VIFPVBQESA-N 1 2 238.331 2.291 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H](C)OC(C)(C)C2)oc1C ZINC000068474607 388409418 /nfs/dbraw/zinc/40/94/18/388409418.db2.gz PSSZFDPZFGNKGK-VIFPVBQESA-N 1 2 238.331 2.291 20 0 BEADLO CCO[C@@H](CC)C(=O)Nc1cccc2[nH+]ccn21 ZINC000525103436 388415545 /nfs/dbraw/zinc/41/55/45/388415545.db2.gz FDSIUFJRMOUWIV-JTQLQIEISA-N 1 2 247.298 2.088 20 0 BEADLO CCC[C@@H](CC(C)C)C(=O)NCc1[nH]cc[nH+]1 ZINC000308085996 388431254 /nfs/dbraw/zinc/43/12/54/388431254.db2.gz HEEBBIKIBNJMGQ-NSHDSACASA-N 1 2 237.347 2.488 20 0 BEADLO CC[C@H](CC(C)C)C(=O)NCCc1[nH]cc[nH+]1 ZINC000308082824 388431500 /nfs/dbraw/zinc/43/15/00/388431500.db2.gz ARPGQNKNASJYNF-LLVKDONJSA-N 1 2 237.347 2.141 20 0 BEADLO C[C@@H](CC(=O)N[C@@H]1CCC[C@H]1C)n1cc[nH+]c1 ZINC000517153866 388540045 /nfs/dbraw/zinc/54/00/45/388540045.db2.gz ILPVVDGBOSJHKX-GRYCIOLGSA-N 1 2 235.331 2.139 20 0 BEADLO C[C@H](CC(=O)N1CCCC[C@H]1C)n1cc[nH+]c1 ZINC000517154938 388540086 /nfs/dbraw/zinc/54/00/86/388540086.db2.gz TZLJGLHLTAXVAP-VXGBXAGGSA-N 1 2 235.331 2.235 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)Cc1ncccc1Cl ZINC000528544215 388545701 /nfs/dbraw/zinc/54/57/01/388545701.db2.gz BJIDAWMKHYHMFX-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)Cc1ncccc1Cl ZINC000528544215 388545704 /nfs/dbraw/zinc/54/57/04/388545704.db2.gz BJIDAWMKHYHMFX-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO C[C@H]([NH2+]CC1(F)CC1)c1cscn1 ZINC000520841386 388547284 /nfs/dbraw/zinc/54/72/84/388547284.db2.gz PYVZIEQUKSSFKK-ZETCQYMHSA-N 1 2 200.282 2.296 20 0 BEADLO CCCC[C@H]([NH2+]CCC(F)(F)F)C(=O)OC ZINC000135234959 388485976 /nfs/dbraw/zinc/48/59/76/388485976.db2.gz ZZMYGNYRGGGFRT-QMMMGPOBSA-N 1 2 241.253 2.260 20 0 BEADLO CCCC[C@H]([NH2+]C[C@@H]1CCCS1)C(=O)OC ZINC000135245195 388486528 /nfs/dbraw/zinc/48/65/28/388486528.db2.gz QLGKNYREAKVHRI-QWRGUYRKSA-N 1 2 245.388 2.203 20 0 BEADLO COC(=O)[C@H](c1cccnc1)[N@H+](C)CCC1CC1 ZINC000135265169 388487505 /nfs/dbraw/zinc/48/75/05/388487505.db2.gz NFGPUDDMUAOAPH-ZDUSSCGKSA-N 1 2 248.326 2.028 20 0 BEADLO COC(=O)[C@H](c1cccnc1)[N@@H+](C)CCC1CC1 ZINC000135265169 388487506 /nfs/dbraw/zinc/48/75/06/388487506.db2.gz NFGPUDDMUAOAPH-ZDUSSCGKSA-N 1 2 248.326 2.028 20 0 BEADLO C[C@@H]([NH2+]Cc1cnn[nH]1)c1cc2ccccc2o1 ZINC000340245800 388488413 /nfs/dbraw/zinc/48/84/13/388488413.db2.gz RLEHVFOFBAFYRW-SECBINFHSA-N 1 2 242.282 2.402 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1CCOC[C@@H]1[C@H]1CCCO1 ZINC000528510271 388507090 /nfs/dbraw/zinc/50/70/90/388507090.db2.gz XWSRHNNOYDRREY-QJJZASRKSA-N 1 2 245.750 2.009 20 0 BEADLO C/C(Cl)=C/C[N@H+]1CCOC[C@@H]1[C@H]1CCCO1 ZINC000528510271 388507094 /nfs/dbraw/zinc/50/70/94/388507094.db2.gz XWSRHNNOYDRREY-QJJZASRKSA-N 1 2 245.750 2.009 20 0 BEADLO CCO[C@H](C)c1noc(C[NH+]2[C@@H](C)C[C@@H]2C)n1 ZINC000548096224 388510335 /nfs/dbraw/zinc/51/03/35/388510335.db2.gz IRXCMXUIRFZVQC-LPEHRKFASA-N 1 2 239.319 2.150 20 0 BEADLO C[C@@H](CC(=O)N[C@H]1CCC[C@H]1C)n1cc[nH+]c1 ZINC000517153869 256816845 /nfs/dbraw/zinc/81/68/45/256816845.db2.gz ILPVVDGBOSJHKX-WOPDTQHZSA-N 1 2 235.331 2.139 20 0 BEADLO C/C(Cl)=C/C[NH2+][C@@H](C)c1nnc(C)o1 ZINC000528450361 388527436 /nfs/dbraw/zinc/52/74/36/388527436.db2.gz KTIBCAMXKPIAGB-NGAMADIESA-N 1 2 215.684 2.171 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1CCO[C@@H](C2CC2)C1 ZINC000528456992 388528787 /nfs/dbraw/zinc/52/87/87/388528787.db2.gz BRKXEDKNJPYROW-KSHIFHCESA-N 1 2 215.724 2.240 20 0 BEADLO C/C(Cl)=C/C[N@H+]1CCO[C@@H](C2CC2)C1 ZINC000528456992 388528789 /nfs/dbraw/zinc/52/87/89/388528789.db2.gz BRKXEDKNJPYROW-KSHIFHCESA-N 1 2 215.724 2.240 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)NCCCCF)ccn12 ZINC000516980277 388530016 /nfs/dbraw/zinc/53/00/16/388530016.db2.gz XJGOXTQLENGLDX-UHFFFAOYSA-N 1 2 249.289 2.122 20 0 BEADLO C[C@H](CC(=O)NCCC(C)(C)C)n1cc[nH+]c1 ZINC000516973903 388530044 /nfs/dbraw/zinc/53/00/44/388530044.db2.gz KQNALTPAUDJNGJ-LLVKDONJSA-N 1 2 237.347 2.387 20 0 BEADLO C[C@@H](CC(=O)N(C)Cc1[nH]cc[nH+]1)c1ccco1 ZINC000528474001 388531005 /nfs/dbraw/zinc/53/10/05/388531005.db2.gz GDXUTGOOPMRZTL-JTQLQIEISA-N 1 2 247.298 2.155 20 0 BEADLO CC(C)n1cc(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)cn1 ZINC000245542954 388588129 /nfs/dbraw/zinc/58/81/29/388588129.db2.gz QKEUDTCHGQEEFI-NWDGAFQWSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)n1cc(C[N@H+]2C[C@@H](C)OC[C@@H]2C)cn1 ZINC000245542954 388588131 /nfs/dbraw/zinc/58/81/31/388588131.db2.gz QKEUDTCHGQEEFI-NWDGAFQWSA-N 1 2 237.347 2.073 20 0 BEADLO C[C@@H]1CCC[N@H+](Cc2csnn2)[C@H]1C ZINC000245554717 388589032 /nfs/dbraw/zinc/58/90/32/388589032.db2.gz HIDDLOUPRMNOSJ-BDAKNGLRSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]1CCC[N@@H+](Cc2csnn2)[C@H]1C ZINC000245554717 388589035 /nfs/dbraw/zinc/58/90/35/388589035.db2.gz HIDDLOUPRMNOSJ-BDAKNGLRSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2csnn2)C[C@H]1C ZINC000245762889 388603121 /nfs/dbraw/zinc/60/31/21/388603121.db2.gz QAIBKEVFFVNJFW-RKDXNWHRSA-N 1 2 211.334 2.016 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2csnn2)C[C@H]1C ZINC000245762889 388603123 /nfs/dbraw/zinc/60/31/23/388603123.db2.gz QAIBKEVFFVNJFW-RKDXNWHRSA-N 1 2 211.334 2.016 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1CCCC12CCC2 ZINC000521896045 388639560 /nfs/dbraw/zinc/63/95/60/388639560.db2.gz KMLDQRMTKKFTSD-NSHDSACASA-N 1 2 247.342 2.133 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1CCCC12CCC2 ZINC000521896045 388639563 /nfs/dbraw/zinc/63/95/63/388639563.db2.gz KMLDQRMTKKFTSD-NSHDSACASA-N 1 2 247.342 2.133 20 0 BEADLO C[C@H]1CCCC[C@H]1NC(=O)CCCn1cc[nH+]c1 ZINC000620409501 388646981 /nfs/dbraw/zinc/64/69/81/388646981.db2.gz QHWWFEHFZIMNIM-QWHCGFSZSA-N 1 2 249.358 2.358 20 0 BEADLO CCn1cc(C[N@H+](C)[C@H](C)c2ncc(C)o2)cn1 ZINC000538954858 388740880 /nfs/dbraw/zinc/74/08/80/388740880.db2.gz UZALPNYBSXFCRT-LLVKDONJSA-N 1 2 248.330 2.392 20 0 BEADLO CCn1cc(C[N@@H+](C)[C@H](C)c2ncc(C)o2)cn1 ZINC000538954858 388740882 /nfs/dbraw/zinc/74/08/82/388740882.db2.gz UZALPNYBSXFCRT-LLVKDONJSA-N 1 2 248.330 2.392 20 0 BEADLO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccoc2)[nH]1 ZINC000539063363 388745938 /nfs/dbraw/zinc/74/59/38/388745938.db2.gz BPZMXGVDYRDHQB-DTWKUNHWSA-N 1 2 234.303 2.372 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+]Cc2cncs2)o1 ZINC000227555807 388753663 /nfs/dbraw/zinc/75/36/63/388753663.db2.gz XMESZNVPNMNVAR-MRVPVSSYSA-N 1 2 223.301 2.290 20 0 BEADLO CCCCN(CC)C(=O)[C@H]1CCc2c[nH+]cn2C1 ZINC000553227061 388754247 /nfs/dbraw/zinc/75/42/47/388754247.db2.gz QCRDESNJVAGEKH-LBPRGKRZSA-N 1 2 249.358 2.094 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CC[C@H](C)C2)c(C)c[nH+]1 ZINC000538442498 388690821 /nfs/dbraw/zinc/69/08/21/388690821.db2.gz WVQVIEINUMLXMV-JOYOIKCWSA-N 1 2 232.327 2.495 20 0 BEADLO CCS[C@H](C)c1noc(C[N@H+](C)CC)n1 ZINC000126277005 388693818 /nfs/dbraw/zinc/69/38/18/388693818.db2.gz NIZHCKPHEKHLBO-MRVPVSSYSA-N 1 2 229.349 2.335 20 0 BEADLO CCS[C@H](C)c1noc(C[N@@H+](C)CC)n1 ZINC000126277005 388693819 /nfs/dbraw/zinc/69/38/19/388693819.db2.gz NIZHCKPHEKHLBO-MRVPVSSYSA-N 1 2 229.349 2.335 20 0 BEADLO CSCC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000193182398 388695377 /nfs/dbraw/zinc/69/53/77/388695377.db2.gz WOSVBLWMEQVCIS-UHFFFAOYSA-N 1 2 224.329 2.308 20 0 BEADLO COC(=O)[C@@H]([NH2+]Cc1ccc(C)s1)C1CC1 ZINC000227768737 388758757 /nfs/dbraw/zinc/75/87/57/388758757.db2.gz ZMUVKACBYVDULO-NSHDSACASA-N 1 2 239.340 2.098 20 0 BEADLO CC[C@H](C)[N@H+](C)Cc1noc(C2CC2)n1 ZINC000068451287 388787429 /nfs/dbraw/zinc/78/74/29/388787429.db2.gz GNFWWJANCRMRRS-QMMMGPOBSA-N 1 2 209.293 2.177 20 0 BEADLO CC[C@H](C)[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000068451287 388787432 /nfs/dbraw/zinc/78/74/32/388787432.db2.gz GNFWWJANCRMRRS-QMMMGPOBSA-N 1 2 209.293 2.177 20 0 BEADLO CC(C)(C)CC(C)(C)NC(=O)Cn1cc[nH+]c1 ZINC000553847611 388791153 /nfs/dbraw/zinc/79/11/53/388791153.db2.gz WMBHPYJMKZZWBG-UHFFFAOYSA-N 1 2 237.347 2.214 20 0 BEADLO CCC[C@H]1CCCCN1C(=O)Cc1c[nH+]cn1C ZINC000554597966 388823475 /nfs/dbraw/zinc/82/34/75/388823475.db2.gz CAYDUARRCRJBQB-LBPRGKRZSA-N 1 2 249.358 2.144 20 0 BEADLO CCCC[C@H]1CCC[C@H]1NC(=O)Cn1cc[nH+]c1 ZINC000555221637 388842160 /nfs/dbraw/zinc/84/21/60/388842160.db2.gz KCXBYZMGEVGUON-QWHCGFSZSA-N 1 2 249.358 2.358 20 0 BEADLO Cn1c[nH+]cc1CCNC(=O)CCC1CCCC1 ZINC000541552635 388856293 /nfs/dbraw/zinc/85/62/93/388856293.db2.gz YTOYKIGIMLCXLD-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO CCCCN(CC)c1nc[nH+]c(N)c1Cl ZINC000233000195 388861214 /nfs/dbraw/zinc/86/12/14/388861214.db2.gz UVPVLKFIPBVGHI-UHFFFAOYSA-N 1 2 228.727 2.339 20 0 BEADLO CCCCN(CC)c1[nH+]cnc(N)c1Cl ZINC000233000195 388861216 /nfs/dbraw/zinc/86/12/16/388861216.db2.gz UVPVLKFIPBVGHI-UHFFFAOYSA-N 1 2 228.727 2.339 20 0 BEADLO CC1=C[C@@H](C)CN(C(=O)C[C@H](C)n2cc[nH+]c2)C1 ZINC000565094485 388913671 /nfs/dbraw/zinc/91/36/71/388913671.db2.gz MEVFDAZMNVZWSE-YPMHNXCESA-N 1 2 247.342 2.259 20 0 BEADLO COC(=O)c1coc(C[N@@H+]2CCC[C@H](F)C2)c1 ZINC000565100197 388915403 /nfs/dbraw/zinc/91/54/03/388915403.db2.gz RAVLFCQFZVEBNG-JTQLQIEISA-N 1 2 241.262 2.000 20 0 BEADLO COC(=O)c1coc(C[N@H+]2CCC[C@H](F)C2)c1 ZINC000565100197 388915406 /nfs/dbraw/zinc/91/54/06/388915406.db2.gz RAVLFCQFZVEBNG-JTQLQIEISA-N 1 2 241.262 2.000 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)NC(C)(C)CF)ccn12 ZINC000565194333 388923980 /nfs/dbraw/zinc/92/39/80/388923980.db2.gz GXXBMNPLRXDHDB-UHFFFAOYSA-N 1 2 249.289 2.121 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000565191920 388924786 /nfs/dbraw/zinc/92/47/86/388924786.db2.gz LNALSHXVVRKKPE-NTZNESFSSA-N 1 2 249.358 2.378 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000565191920 388924783 /nfs/dbraw/zinc/92/47/83/388924783.db2.gz LNALSHXVVRKKPE-NTZNESFSSA-N 1 2 249.358 2.378 20 0 BEADLO Cc1c[nH+]c(C)nc1NC[C@H]1CCCCS1 ZINC000565228261 388930135 /nfs/dbraw/zinc/93/01/35/388930135.db2.gz DXAXCCLFBUSTFC-LLVKDONJSA-N 1 2 237.372 2.213 20 0 BEADLO CCC1(CC)CN(C(=O)C[C@H](C)n2cc[nH+]c2)C1 ZINC000565600385 388957797 /nfs/dbraw/zinc/95/77/97/388957797.db2.gz NJEBOXSEKUHQOP-LBPRGKRZSA-N 1 2 249.358 2.483 20 0 BEADLO Cn1ccc(C[NH2+][C@H]2C[C@@]2(F)c2ccccc2)n1 ZINC000566062731 388985564 /nfs/dbraw/zinc/98/55/64/388985564.db2.gz KGFLIXAGWGYUBL-UONOGXRCSA-N 1 2 245.301 2.147 20 0 BEADLO C[C@H]([NH2+]C/C(Cl)=C/Cl)c1cn[nH]c1 ZINC000275244155 389054245 /nfs/dbraw/zinc/05/42/45/389054245.db2.gz XMMUHVHGOBJHIW-UGMXDQQYSA-N 1 2 220.103 2.379 20 0 BEADLO C[C@@H]([NH2+]C/C(Cl)=C/Cl)c1cn[nH]c1 ZINC000275244158 389054438 /nfs/dbraw/zinc/05/44/38/389054438.db2.gz XMMUHVHGOBJHIW-WNGQPZJSSA-N 1 2 220.103 2.379 20 0 BEADLO C[C@@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000492814286 533638012 /nfs/dbraw/zinc/63/80/12/533638012.db2.gz UGVCPFRUHYUHQF-DOGVGXBMSA-N 1 2 233.315 2.072 20 0 BEADLO C[C@@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)[C@@H]1C ZINC000493227858 533638059 /nfs/dbraw/zinc/63/80/59/533638059.db2.gz RTNMJGXRWLKOOO-ADRPCIBZSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)OC2CCC2)c2[nH+]ccn21 ZINC000496828901 533632021 /nfs/dbraw/zinc/63/20/21/533632021.db2.gz PVYHDOOANXHNLV-PSASIEDQSA-N 1 2 235.287 2.168 20 0 BEADLO CC[C@H]1CN(c2cc[nH+]c(C3CC3)n2)C[C@@H](C)O1 ZINC000264691587 132179746 /nfs/dbraw/zinc/17/97/46/132179746.db2.gz CHUBOKQWVFJVKN-PWSUYJOCSA-N 1 2 247.342 2.358 20 0 BEADLO Cc1nc(N2CCS[C@@H](C)[C@H]2C)cc[nH+]1 ZINC000266206686 132185489 /nfs/dbraw/zinc/18/54/89/132185489.db2.gz FGYCNNNLXZIFIA-BDAKNGLRSA-N 1 2 223.345 2.115 20 0 BEADLO Cc1nc(N2C[C@H](C)C[C@H](C)C2)cc[nH+]1 ZINC000266146428 132184190 /nfs/dbraw/zinc/18/41/90/132184190.db2.gz RZBLRUVKQRJTAD-AOOOYVTPSA-N 1 2 205.305 2.267 20 0 BEADLO Cc1nc(N2CC[C@@H](C)C[C@@H]2C)cc[nH+]1 ZINC000266211903 132185048 /nfs/dbraw/zinc/18/50/48/132185048.db2.gz GGNSWWIONQYCPC-ZJUUUORDSA-N 1 2 205.305 2.410 20 0 BEADLO c1cc(N2CCO[C@H]3CCC[C@H]32)nc(C2CC2)[nH+]1 ZINC000268016839 132191145 /nfs/dbraw/zinc/19/11/45/132191145.db2.gz GTQCFVHXQVNUNH-NEPJUHHUSA-N 1 2 245.326 2.112 20 0 BEADLO C[C@@H]1OCCN(c2cc[nH+]c3ccncc32)[C@H]1C ZINC000268782814 132192995 /nfs/dbraw/zinc/19/29/95/132192995.db2.gz CQHKCARZCPKMEF-QWRGUYRKSA-N 1 2 243.310 2.243 20 0 BEADLO Cc1cc(N2CCO[C@H](C)[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000268820557 132193591 /nfs/dbraw/zinc/19/35/91/132193591.db2.gz PBUVGKSKBSGEHZ-WDEREUQCSA-N 1 2 247.342 2.276 20 0 BEADLO Cc1nc(N2CC=C(C(F)(F)F)CC2)cc[nH+]1 ZINC000270246756 132196203 /nfs/dbraw/zinc/19/62/03/132196203.db2.gz RGCHFHQVKXNYSF-UHFFFAOYSA-N 1 2 243.232 2.484 20 0 BEADLO Fc1ccc(N2CCC(n3cc[nH+]c3)CC2)nc1 ZINC000283932216 132213476 /nfs/dbraw/zinc/21/34/76/132213476.db2.gz XONMHXNBGFESAP-UHFFFAOYSA-N 1 2 246.289 2.259 20 0 BEADLO Cc1nc(N2CCCC[C@@H]2c2cc[nH]n2)cc[nH+]1 ZINC000288885115 132216457 /nfs/dbraw/zinc/21/64/57/132216457.db2.gz GZXHPQBRUUIBOE-GFCCVEGCSA-N 1 2 243.314 2.240 20 0 BEADLO CSC[C@H]1CCCN(c2cc[nH+]c(C)n2)C1 ZINC000292187247 132218925 /nfs/dbraw/zinc/21/89/25/132218925.db2.gz FWXHQYHUDGLGCY-NSHDSACASA-N 1 2 237.372 2.364 20 0 BEADLO c1ccc(N2CCC[C@@H]([C@H]3CCOC3)C2)[nH+]c1 ZINC000336549194 132248800 /nfs/dbraw/zinc/24/88/00/132248800.db2.gz PDEGGUCCEDMFCF-OLZOCXBDSA-N 1 2 232.327 2.335 20 0 BEADLO c1ccc(N2CCC([C@H]3CCCO3)CC2)[nH+]c1 ZINC000302583323 132264485 /nfs/dbraw/zinc/26/44/85/132264485.db2.gz UMVPYQZHQLWSOS-CYBMUJFWSA-N 1 2 232.327 2.477 20 0 BEADLO CCCC[N@@H+]1CCN(c2ccccc2)C(=O)C1 ZINC000360623387 132278688 /nfs/dbraw/zinc/27/86/88/132278688.db2.gz XVLLBDXNVIUNDD-UHFFFAOYSA-N 1 2 232.327 2.135 20 0 BEADLO CCCC[N@H+]1CCN(c2ccccc2)C(=O)C1 ZINC000360623387 132278693 /nfs/dbraw/zinc/27/86/93/132278693.db2.gz XVLLBDXNVIUNDD-UHFFFAOYSA-N 1 2 232.327 2.135 20 0 BEADLO C[NH2+]Cc1noc(CC2(C)CCCCC2)n1 ZINC000349908923 133925122 /nfs/dbraw/zinc/92/51/22/133925122.db2.gz KIABKDXCPUSBPK-UHFFFAOYSA-N 1 2 223.320 2.302 20 0 BEADLO C[C@@H]1c2ccccc2C[N@H+]1CC(=O)N(C)C1CC1 ZINC000335923442 134007927 /nfs/dbraw/zinc/00/79/27/134007927.db2.gz XIAFTDBJHIIIOT-LLVKDONJSA-N 1 2 244.338 2.184 20 0 BEADLO C[C@@H]1c2ccccc2C[N@@H+]1CC(=O)N(C)C1CC1 ZINC000335923442 134007928 /nfs/dbraw/zinc/00/79/28/134007928.db2.gz XIAFTDBJHIIIOT-LLVKDONJSA-N 1 2 244.338 2.184 20 0 BEADLO Cc1sccc1C[N@@H+]1CC[S@@](=O)[C@@H](C)C1 ZINC000335942415 134018480 /nfs/dbraw/zinc/01/84/80/134018480.db2.gz MZSHBQOSOUVZBX-BJOHPYRUSA-N 1 2 243.397 2.009 20 0 BEADLO Cc1sccc1C[N@H+]1CC[S@@](=O)[C@@H](C)C1 ZINC000335942415 134018481 /nfs/dbraw/zinc/01/84/81/134018481.db2.gz MZSHBQOSOUVZBX-BJOHPYRUSA-N 1 2 243.397 2.009 20 0 BEADLO C[N@H+](Cc1ncc(Cl)s1)[C@@H]1CCC[C@H]1O ZINC000335943955 134018516 /nfs/dbraw/zinc/01/85/16/134018516.db2.gz RISYMUBSYAMPIK-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO C[N@@H+](Cc1ncc(Cl)s1)[C@@H]1CCC[C@H]1O ZINC000335943955 134018517 /nfs/dbraw/zinc/01/85/17/134018517.db2.gz RISYMUBSYAMPIK-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO CCc1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)o1 ZINC000335944854 134019500 /nfs/dbraw/zinc/01/95/00/134019500.db2.gz FWFCQFWRHWOBHO-BETUJISGSA-N 1 2 221.300 2.205 20 0 BEADLO CCc1ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)o1 ZINC000335944854 134019501 /nfs/dbraw/zinc/01/95/01/134019501.db2.gz FWFCQFWRHWOBHO-BETUJISGSA-N 1 2 221.300 2.205 20 0 BEADLO Cc1cc(N(C)Cc2ccoc2)nc[nH+]1 ZINC000335959110 134024266 /nfs/dbraw/zinc/02/42/66/134024266.db2.gz JPLCAZOEDDSTRJ-UHFFFAOYSA-N 1 2 203.245 2.014 20 0 BEADLO Cc1ccc(F)cc1CN1CCn2cc[nH+]c2C1 ZINC000335968380 134028795 /nfs/dbraw/zinc/02/87/95/134028795.db2.gz VCZJLEXASUCPMO-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO Cn1nccc1CNc1c[nH+]c2c(c1)CCCC2 ZINC000335975584 134031062 /nfs/dbraw/zinc/03/10/62/134031062.db2.gz BLQWALFMCLNNDL-UHFFFAOYSA-N 1 2 242.326 2.306 20 0 BEADLO COC[C@H](C)[N@H+](C)Cc1ncc(Cl)s1 ZINC000352005937 134034404 /nfs/dbraw/zinc/03/44/04/134034404.db2.gz ZHBKWBNXDQFFDC-ZETCQYMHSA-N 1 2 234.752 2.263 20 0 BEADLO COC[C@H](C)[N@@H+](C)Cc1ncc(Cl)s1 ZINC000352005937 134034405 /nfs/dbraw/zinc/03/44/05/134034405.db2.gz ZHBKWBNXDQFFDC-ZETCQYMHSA-N 1 2 234.752 2.263 20 0 BEADLO Cc1cc(C(=O)C[N@H+]2C[C@H](C)[C@@H]2C)c(C)[nH]1 ZINC000335980135 134037491 /nfs/dbraw/zinc/03/74/91/134037491.db2.gz VSABTIZKBXWHII-KWQFWETISA-N 1 2 220.316 2.154 20 0 BEADLO Cc1cc(C(=O)C[N@@H+]2C[C@H](C)[C@@H]2C)c(C)[nH]1 ZINC000335980135 134037492 /nfs/dbraw/zinc/03/74/92/134037492.db2.gz VSABTIZKBXWHII-KWQFWETISA-N 1 2 220.316 2.154 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@@H](C)[C@H]2C)cn1 ZINC000335999411 134043610 /nfs/dbraw/zinc/04/36/10/134043610.db2.gz UFBWEUUNJKBENJ-NEPJUHHUSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@@H](C)[C@H]2C)cn1 ZINC000335999411 134043611 /nfs/dbraw/zinc/04/36/11/134043611.db2.gz UFBWEUUNJKBENJ-NEPJUHHUSA-N 1 2 234.343 2.253 20 0 BEADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccon1 ZINC000336006450 134049314 /nfs/dbraw/zinc/04/93/14/134049314.db2.gz RHFNYNWTLDUYCE-CBAPKCEASA-N 1 2 234.221 2.447 20 0 BEADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccon1 ZINC000336006450 134049315 /nfs/dbraw/zinc/04/93/15/134049315.db2.gz RHFNYNWTLDUYCE-CBAPKCEASA-N 1 2 234.221 2.447 20 0 BEADLO Cc1ccccc1C[N@@H+]1CCn2cncc2C1 ZINC000336012226 134051554 /nfs/dbraw/zinc/05/15/54/134051554.db2.gz BOMUZHLOPSUCDG-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO Cc1ccccc1C[N@H+]1CCn2cncc2C1 ZINC000336012226 134051555 /nfs/dbraw/zinc/05/15/55/134051555.db2.gz BOMUZHLOPSUCDG-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO Cc1ccccc1CN1CCn2c[nH+]cc2C1 ZINC000336012226 134051556 /nfs/dbraw/zinc/05/15/56/134051556.db2.gz BOMUZHLOPSUCDG-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO C[C@H]1C[C@@H]1CC(=O)Nc1cccc2[nH+]ccn21 ZINC000336016996 134053186 /nfs/dbraw/zinc/05/31/86/134053186.db2.gz WGABCLYIAHMDQB-VHSXEESVSA-N 1 2 229.283 2.319 20 0 BEADLO Fc1ccc2c(c1)CC[N@@H+](Cc1cnccn1)C2 ZINC000336086608 134076712 /nfs/dbraw/zinc/07/67/12/134076712.db2.gz MOUKCJFSNXHNAZ-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1ccc2c(c1)CC[N@H+](Cc1cnccn1)C2 ZINC000336086608 134076713 /nfs/dbraw/zinc/07/67/13/134076713.db2.gz MOUKCJFSNXHNAZ-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO c1n[nH]cc1CCSc1[nH+]cc2ccccn21 ZINC000352159918 134089940 /nfs/dbraw/zinc/08/99/40/134089940.db2.gz DMRKDADMGMIWDO-UHFFFAOYSA-N 1 2 244.323 2.392 20 0 BEADLO Cn1nccc1C[NH2+]C1(C(F)F)CCCCC1 ZINC000352185646 134099170 /nfs/dbraw/zinc/09/91/70/134099170.db2.gz FDDMOPYNTVKQQM-UHFFFAOYSA-N 1 2 243.301 2.478 20 0 BEADLO C[C@@H]1CCC[C@@H](c2noc(C[NH+](C)C)n2)C1 ZINC000336182557 134120083 /nfs/dbraw/zinc/12/00/83/134120083.db2.gz XXHZBCBCOGKHLI-NXEZZACHSA-N 1 2 223.320 2.425 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@]1(C)CCC[C@H]1C ZINC000336210885 134134160 /nfs/dbraw/zinc/13/41/60/134134160.db2.gz PWGZIYDPXVVIRQ-RNCFNFMXSA-N 1 2 235.331 2.161 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@]1(C)CC=CCC1 ZINC000336210814 134134397 /nfs/dbraw/zinc/13/43/97/134134397.db2.gz IMMIAAUCJPYMJA-ZDUSSCGKSA-N 1 2 233.315 2.081 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@]1(C)CCC[C@H]1C ZINC000336210884 134134419 /nfs/dbraw/zinc/13/44/19/134134419.db2.gz PWGZIYDPXVVIRQ-NOZJJQNGSA-N 1 2 235.331 2.161 20 0 BEADLO COc1cc(C)ccc1C[N@@H+]1CCO[C@H](C)C1 ZINC000336215791 134137092 /nfs/dbraw/zinc/13/70/92/134137092.db2.gz LIZXAXSUYUIIBM-GFCCVEGCSA-N 1 2 235.327 2.224 20 0 BEADLO COc1cc(C)ccc1C[N@H+]1CCO[C@H](C)C1 ZINC000336215791 134137093 /nfs/dbraw/zinc/13/70/93/134137093.db2.gz LIZXAXSUYUIIBM-GFCCVEGCSA-N 1 2 235.327 2.224 20 0 BEADLO CC(C)n1c[nH+]cc1CNc1cccnc1 ZINC000085187729 134248249 /nfs/dbraw/zinc/24/82/49/134248249.db2.gz RUKONQHTUDUBBW-UHFFFAOYSA-N 1 2 216.288 2.471 20 0 BEADLO COc1ccc(C)cc1C[N@@H+]1CCC(=O)[C@H](C)C1 ZINC000168894586 134248945 /nfs/dbraw/zinc/24/89/45/134248945.db2.gz PPNZNGKTJSLCRI-GFCCVEGCSA-N 1 2 247.338 2.415 20 0 BEADLO COc1ccc(C)cc1C[N@H+]1CCC(=O)[C@H](C)C1 ZINC000168894586 134248946 /nfs/dbraw/zinc/24/89/46/134248946.db2.gz PPNZNGKTJSLCRI-GFCCVEGCSA-N 1 2 247.338 2.415 20 0 BEADLO CC(C)n1ccnc1C[N@@H+]1CCCO[C@@H](C)C1 ZINC000170764486 134253302 /nfs/dbraw/zinc/25/33/02/134253302.db2.gz VAAPAFQYVMZVKE-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccnc1C[N@H+]1CCCO[C@@H](C)C1 ZINC000170764486 134253303 /nfs/dbraw/zinc/25/33/03/134253303.db2.gz VAAPAFQYVMZVKE-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO Cc1c(Cl)cccc1C(=O)NCc1[nH]cc[nH+]1 ZINC000219834770 134292192 /nfs/dbraw/zinc/29/21/92/134292192.db2.gz VZHWLMNIMBEBLJ-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO C[C@H]1CCC[C@@H](CC[N@H+](C)Cc2nnc[nH]2)C1 ZINC000177103022 134295362 /nfs/dbraw/zinc/29/53/62/134295362.db2.gz LJCBYCWYQBWUJE-RYUDHWBXSA-N 1 2 236.363 2.453 20 0 BEADLO C[C@H]1CCC[C@@H](CC[N@@H+](C)Cc2nnc[nH]2)C1 ZINC000177103022 134295363 /nfs/dbraw/zinc/29/53/63/134295363.db2.gz LJCBYCWYQBWUJE-RYUDHWBXSA-N 1 2 236.363 2.453 20 0 BEADLO COC1CC([NH2+]c2ccc(-n3cccn3)cc2)C1 ZINC000220387669 134306254 /nfs/dbraw/zinc/30/62/54/134306254.db2.gz LZJDSFMMTCUEGF-UHFFFAOYSA-N 1 2 243.310 2.462 20 0 BEADLO CS[C@H]1CCCC[N@H+](Cc2csnn2)C1 ZINC000180754535 134331451 /nfs/dbraw/zinc/33/14/51/134331451.db2.gz YJKNBDPKMVBGJX-JTQLQIEISA-N 1 2 243.401 2.256 20 0 BEADLO CS[C@H]1CCCC[N@@H+](Cc2csnn2)C1 ZINC000180754535 134331452 /nfs/dbraw/zinc/33/14/52/134331452.db2.gz YJKNBDPKMVBGJX-JTQLQIEISA-N 1 2 243.401 2.256 20 0 BEADLO Cc1cc(Cl)ccc1C(=O)NCc1c[nH+]c[nH]1 ZINC000223051301 134336007 /nfs/dbraw/zinc/33/60/07/134336007.db2.gz GMHVBPVYKXGBDR-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO Cc1cc(Cl)ccc1C(=O)NCc1c[nH]c[nH+]1 ZINC000223051301 134336008 /nfs/dbraw/zinc/33/60/08/134336008.db2.gz GMHVBPVYKXGBDR-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1csnc1C ZINC000181885079 134340019 /nfs/dbraw/zinc/34/00/19/134340019.db2.gz RYQWYBGKBFJMFI-UHFFFAOYSA-N 1 2 249.295 2.107 20 0 BEADLO CC(C)Cn1ncnc1C[N@H+](C(C)C)C1CC1 ZINC000182657811 134346876 /nfs/dbraw/zinc/34/68/76/134346876.db2.gz IXYGYEXHGGPCIZ-UHFFFAOYSA-N 1 2 236.363 2.307 20 0 BEADLO CC(C)Cn1ncnc1C[N@@H+](C(C)C)C1CC1 ZINC000182657811 134346877 /nfs/dbraw/zinc/34/68/77/134346877.db2.gz IXYGYEXHGGPCIZ-UHFFFAOYSA-N 1 2 236.363 2.307 20 0 BEADLO Cc1n[nH]cc1C[NH2+]Cc1ncc(Cl)s1 ZINC000225355733 134354897 /nfs/dbraw/zinc/35/48/97/134354897.db2.gz UNUAZTUGNBFCIV-UHFFFAOYSA-N 1 2 242.735 2.118 20 0 BEADLO Cc1[nH+]c2ccccn2c1CNc1nncs1 ZINC000225933006 134357667 /nfs/dbraw/zinc/35/76/67/134357667.db2.gz SGIPJEKWBVEHTQ-UHFFFAOYSA-N 1 2 245.311 2.106 20 0 BEADLO CCCCS(=O)(=O)Cc1ccc(C)[nH+]c1C ZINC000185156727 134372271 /nfs/dbraw/zinc/37/22/71/134372271.db2.gz FPFOSIQCDOEYLQ-UHFFFAOYSA-N 1 2 241.356 2.413 20 0 BEADLO Cc1c[nH+]cc(NCc2ccc(C(N)=O)cc2)c1 ZINC000227603015 134387645 /nfs/dbraw/zinc/38/76/45/134387645.db2.gz ITWXAEMJJZONJK-UHFFFAOYSA-N 1 2 241.294 2.101 20 0 BEADLO C[C@H](CO)CNc1cc(C(F)(F)F)cc[nH+]1 ZINC000085486180 134401531 /nfs/dbraw/zinc/40/15/31/134401531.db2.gz WASAHILQHVCRJL-ZETCQYMHSA-N 1 2 234.221 2.141 20 0 BEADLO Cc1ccc(NCc2ccc(C(N)=O)cc2)c[nH+]1 ZINC000149823238 134450174 /nfs/dbraw/zinc/45/01/74/134450174.db2.gz NCVALOUWKNSNLW-UHFFFAOYSA-N 1 2 241.294 2.101 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ncccn2)cc1 ZINC000191905590 134578039 /nfs/dbraw/zinc/57/80/39/134578039.db2.gz PRNRIZLDEAXQNR-UHFFFAOYSA-N 1 2 227.311 2.417 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ncccn2)cc1 ZINC000191905590 134578040 /nfs/dbraw/zinc/57/80/40/134578040.db2.gz PRNRIZLDEAXQNR-UHFFFAOYSA-N 1 2 227.311 2.417 20 0 BEADLO CC(C)[C@H](NC(=O)C[C@@H]1C[C@@H]1C)c1[nH]cc[nH+]1 ZINC000355973433 135027380 /nfs/dbraw/zinc/02/73/80/135027380.db2.gz PWLHJONPCCVBSG-NHCYSSNCSA-N 1 2 235.331 2.269 20 0 BEADLO C[C@@H]1C[C@@H]1C(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000250289825 135051829 /nfs/dbraw/zinc/05/18/29/135051829.db2.gz QBGCEAOAHJSXAP-VWYCJHECSA-N 1 2 233.315 2.119 20 0 BEADLO CC[C@@H](C)NC(=O)[C@@H](C)[N@H+](C)Cc1ccoc1 ZINC000342635428 135298655 /nfs/dbraw/zinc/29/86/55/135298655.db2.gz KMUKYNQBNLUFRY-GHMZBOCLSA-N 1 2 238.331 2.015 20 0 BEADLO CC[C@@H](C)NC(=O)[C@@H](C)[N@@H+](C)Cc1ccoc1 ZINC000342635428 135298657 /nfs/dbraw/zinc/29/86/57/135298657.db2.gz KMUKYNQBNLUFRY-GHMZBOCLSA-N 1 2 238.331 2.015 20 0 BEADLO Cc1c[nH+]c(CN2CCn3cccc3[C@H]2C)n1C ZINC000342779397 135317717 /nfs/dbraw/zinc/31/77/17/135317717.db2.gz LJVMVURBPJIPLO-GFCCVEGCSA-N 1 2 244.342 2.107 20 0 BEADLO Cc1c[nH+]c(CN(C)CCC(F)(F)F)n1C ZINC000342791523 135319646 /nfs/dbraw/zinc/31/96/46/135319646.db2.gz NZVYBAACQSMNAC-UHFFFAOYSA-N 1 2 235.253 2.113 20 0 BEADLO Cn1cnnc1C[N@H+](C)[C@H]1/C=C/CCCCC1 ZINC000334147085 135322312 /nfs/dbraw/zinc/32/23/12/135322312.db2.gz SFTPCLBMWBPNJW-WMADIVHISA-N 1 2 234.347 2.136 20 0 BEADLO Cn1cnnc1C[N@@H+](C)[C@H]1/C=C/CCCCC1 ZINC000334147085 135322313 /nfs/dbraw/zinc/32/23/13/135322313.db2.gz SFTPCLBMWBPNJW-WMADIVHISA-N 1 2 234.347 2.136 20 0 BEADLO Cn1c2ccccc2[nH+]c1N1CCOC(C)(C)C1 ZINC000334275984 135332491 /nfs/dbraw/zinc/33/24/91/135332491.db2.gz NDJVBTCDNYVPMV-UHFFFAOYSA-N 1 2 245.326 2.189 20 0 BEADLO COCc1cnc(C[N@@H+]2CCC23CCC3)s1 ZINC000342942216 135337451 /nfs/dbraw/zinc/33/74/51/135337451.db2.gz YTGRWUZOOASWGC-UHFFFAOYSA-N 1 2 238.356 2.418 20 0 BEADLO COCc1cnc(C[N@H+]2CCC23CCC3)s1 ZINC000342942216 135337452 /nfs/dbraw/zinc/33/74/52/135337452.db2.gz YTGRWUZOOASWGC-UHFFFAOYSA-N 1 2 238.356 2.418 20 0 BEADLO CC(C)c1ncc(C[N@@H+]2CCO[C@H](C)C2)s1 ZINC000334301961 135346427 /nfs/dbraw/zinc/34/64/27/135346427.db2.gz ZBJDWWIPFRUDHA-SNVBAGLBSA-N 1 2 240.372 2.487 20 0 BEADLO CC(C)c1ncc(C[N@H+]2CCO[C@H](C)C2)s1 ZINC000334301961 135346428 /nfs/dbraw/zinc/34/64/28/135346428.db2.gz ZBJDWWIPFRUDHA-SNVBAGLBSA-N 1 2 240.372 2.487 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCC(F)(F)[C@H](C)C1 ZINC000334324622 135353273 /nfs/dbraw/zinc/35/32/73/135353273.db2.gz AJBCQOFNSRSMMT-SECBINFHSA-N 1 2 229.274 2.195 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000334324622 135353274 /nfs/dbraw/zinc/35/32/74/135353274.db2.gz AJBCQOFNSRSMMT-SECBINFHSA-N 1 2 229.274 2.195 20 0 BEADLO CC1(C)CC[C@H](C(=O)N2CCn3cc[nH+]c3C2)C1 ZINC000334338585 135357026 /nfs/dbraw/zinc/35/70/26/135357026.db2.gz YTWMPDVCRRJXND-NSHDSACASA-N 1 2 247.342 2.052 20 0 BEADLO O=C1OCC[C@@H]1[NH2+][C@H]1CCC[C@@H]1c1ccccc1 ZINC000275640814 135366845 /nfs/dbraw/zinc/36/68/45/135366845.db2.gz RXOBDHXPNJRYJJ-RDBSUJKOSA-N 1 2 245.322 2.228 20 0 BEADLO OC[C@@H]1C[C@H](F)C[N@@H+]1Cc1ccc(Cl)cc1 ZINC000334356499 135369470 /nfs/dbraw/zinc/36/94/70/135369470.db2.gz NMAXHSXFGMUVNW-RYUDHWBXSA-N 1 2 243.709 2.245 20 0 BEADLO OC[C@@H]1C[C@H](F)C[N@H+]1Cc1ccc(Cl)cc1 ZINC000334356499 135369471 /nfs/dbraw/zinc/36/94/71/135369471.db2.gz NMAXHSXFGMUVNW-RYUDHWBXSA-N 1 2 243.709 2.245 20 0 BEADLO Cn1cccc1C[N@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC000334357714 135370420 /nfs/dbraw/zinc/37/04/20/135370420.db2.gz QRDRJNROPHUUFY-ZIAGYGMSSA-N 1 2 234.343 2.169 20 0 BEADLO c1nnc(CCNc2ccc3ccccc3[nH+]2)[nH]1 ZINC000080589682 135383289 /nfs/dbraw/zinc/38/32/89/135383289.db2.gz IWWLOGNVONGTQV-UHFFFAOYSA-N 1 2 239.282 2.008 20 0 BEADLO Cn1c[nH+]cc1CN(C#N)c1ccccc1F ZINC000334391761 135386168 /nfs/dbraw/zinc/38/61/68/135386168.db2.gz VXBYXDLCQUBTHQ-UHFFFAOYSA-N 1 2 230.246 2.047 20 0 BEADLO CC[C@H]1C[N@H+](CC(=O)OC(C)(C)C)CCS1 ZINC000076071936 135391371 /nfs/dbraw/zinc/39/13/71/135391371.db2.gz IAPYWKJOMXTWTB-JTQLQIEISA-N 1 2 245.388 2.156 20 0 BEADLO CC[C@H]1C[N@@H+](CC(=O)OC(C)(C)C)CCS1 ZINC000076071936 135391372 /nfs/dbraw/zinc/39/13/72/135391372.db2.gz IAPYWKJOMXTWTB-JTQLQIEISA-N 1 2 245.388 2.156 20 0 BEADLO C[C@@H](C(=O)N[C@H]1CCc2[nH+]c[nH]c2C1)C(C)(C)C ZINC000334417402 135398471 /nfs/dbraw/zinc/39/84/71/135398471.db2.gz OMIIPHLNSGDDMW-UWVGGRQHSA-N 1 2 249.358 2.065 20 0 BEADLO C[C@@H](C(=O)N[C@H]1CCc2[nH]c[nH+]c2C1)C(C)(C)C ZINC000334417402 135398473 /nfs/dbraw/zinc/39/84/73/135398473.db2.gz OMIIPHLNSGDDMW-UWVGGRQHSA-N 1 2 249.358 2.065 20 0 BEADLO C[C@@H](C(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1)C(C)(C)C ZINC000334417404 135398550 /nfs/dbraw/zinc/39/85/50/135398550.db2.gz OMIIPHLNSGDDMW-VHSXEESVSA-N 1 2 249.358 2.065 20 0 BEADLO C[C@@H](C(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1)C(C)(C)C ZINC000334417404 135398551 /nfs/dbraw/zinc/39/85/51/135398551.db2.gz OMIIPHLNSGDDMW-VHSXEESVSA-N 1 2 249.358 2.065 20 0 BEADLO CO[C@H](C)CN(C)c1cc[nH+]c(C(C)C)n1 ZINC000343818470 135700631 /nfs/dbraw/zinc/70/06/31/135700631.db2.gz VYXDVZFBKVORMJ-SNVBAGLBSA-N 1 2 223.320 2.071 20 0 BEADLO c1ncc(C[N@@H+]2CCO[C@H](C3CCC3)C2)s1 ZINC000334862224 135826474 /nfs/dbraw/zinc/82/64/74/135826474.db2.gz JERKTCKZHQPQOG-LBPRGKRZSA-N 1 2 238.356 2.144 20 0 BEADLO c1ncc(C[N@H+]2CCO[C@H](C3CCC3)C2)s1 ZINC000334862224 135826475 /nfs/dbraw/zinc/82/64/75/135826475.db2.gz JERKTCKZHQPQOG-LBPRGKRZSA-N 1 2 238.356 2.144 20 0 BEADLO Cc1cc(CNC(=O)[C@H]2[C@@H]3CCC[C@@H]32)cc(C)[nH+]1 ZINC000335071044 135885287 /nfs/dbraw/zinc/88/52/87/135885287.db2.gz ZGPCANJQUZXVFZ-WDNDVIMCSA-N 1 2 244.338 2.361 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccon1)c1c(C)nn(C)c1C ZINC000347909376 136015838 /nfs/dbraw/zinc/01/58/38/136015838.db2.gz IFBAYGDXHJJTLV-GFCCVEGCSA-N 1 2 248.330 2.266 20 0 BEADLO Cc1cc(N2CCC3(CCOCC3)[C@@H]2C)nc[nH+]1 ZINC000347876475 136017091 /nfs/dbraw/zinc/01/70/91/136017091.db2.gz KPBPBFQVYWROPC-LBPRGKRZSA-N 1 2 247.342 2.180 20 0 BEADLO FC1(F)CCN(Cc2cccc3[nH+]ccn32)C1 ZINC000335315821 136024571 /nfs/dbraw/zinc/02/45/71/136024571.db2.gz XWVKYYDBFRRECL-UHFFFAOYSA-N 1 2 237.253 2.175 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H](C(C)C)C(F)(F)F)c[nH+]1 ZINC000348065416 136025756 /nfs/dbraw/zinc/02/57/56/136025756.db2.gz ZETBKWOBMYBXLW-QMMMGPOBSA-N 1 2 249.236 2.035 20 0 BEADLO Cc1ncoc1C(=O)Nc1ccc(C)[nH+]c1C ZINC000335310115 136028465 /nfs/dbraw/zinc/02/84/65/136028465.db2.gz DUPIWEUXBKENAG-UHFFFAOYSA-N 1 2 231.255 2.247 20 0 BEADLO Cc1noc([C@H](C)NCc2[nH+]ccn2C(C)C)n1 ZINC000348095313 136035760 /nfs/dbraw/zinc/03/57/60/136035760.db2.gz ILXOAZDAEMEKMY-VIFPVBQESA-N 1 2 249.318 2.006 20 0 BEADLO CC[C@H]1C[C@H]1Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000348188179 136048949 /nfs/dbraw/zinc/04/89/49/136048949.db2.gz UXACNTHHNCOEEF-GXSJLCMTSA-N 1 2 217.316 2.295 20 0 BEADLO O=C(C1CC=CC1)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000335323248 136050393 /nfs/dbraw/zinc/05/03/93/136050393.db2.gz ANHVXUZSMHYWKZ-LLVKDONJSA-N 1 2 231.299 2.039 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)[C@@H]1CC[C@@H](C)C1 ZINC000348270669 136058799 /nfs/dbraw/zinc/05/87/99/136058799.db2.gz GWOYSCVRRFXBPI-GHMZBOCLSA-N 1 2 248.326 2.143 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)[C@H]1CC[C@@H](C)C1 ZINC000348270671 136058842 /nfs/dbraw/zinc/05/88/42/136058842.db2.gz GWOYSCVRRFXBPI-MNOVXSKESA-N 1 2 248.326 2.143 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C1CC2(CCC2)C1 ZINC000335344124 136065406 /nfs/dbraw/zinc/06/54/06/136065406.db2.gz GYIKNSMVEQMVFY-UHFFFAOYSA-N 1 2 230.311 2.331 20 0 BEADLO Cc1nnc(C[N@@H+]2C[C@@H](C)S[C@@H](C)C2)s1 ZINC000335350955 136068635 /nfs/dbraw/zinc/06/86/35/136068635.db2.gz YJABJCIIFFGTLG-OCAPTIKFSA-N 1 2 243.401 2.172 20 0 BEADLO Cc1nnc(C[N@H+]2C[C@@H](C)S[C@@H](C)C2)s1 ZINC000335350955 136068636 /nfs/dbraw/zinc/06/86/36/136068636.db2.gz YJABJCIIFFGTLG-OCAPTIKFSA-N 1 2 243.401 2.172 20 0 BEADLO Oc1ccc2c(c1)C[N@@H+](Cc1nccs1)CC2 ZINC000335352267 136069655 /nfs/dbraw/zinc/06/96/55/136069655.db2.gz DEEDVYLZIIZJNA-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO Oc1ccc2c(c1)C[N@H+](Cc1nccs1)CC2 ZINC000335352267 136069656 /nfs/dbraw/zinc/06/96/56/136069656.db2.gz DEEDVYLZIIZJNA-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO Cc1nc(N[C@@H]2CCC[C@@H](F)C2)cc[nH+]1 ZINC000335379756 136086847 /nfs/dbraw/zinc/08/68/47/136086847.db2.gz MOCITUCGSILPLB-NXEZZACHSA-N 1 2 209.268 2.478 20 0 BEADLO CC1(C(N)=O)C[NH+](Cc2cc(F)cc(F)c2)C1 ZINC000335396072 136092795 /nfs/dbraw/zinc/09/27/95/136092795.db2.gz OZRWVPUILGGGLP-UHFFFAOYSA-N 1 2 240.253 2.322 20 0 BEADLO O=C(Nc1ccsc1)[C@@H]1CCc2c[nH+]cn2C1 ZINC000335547946 136097102 /nfs/dbraw/zinc/09/71/02/136097102.db2.gz LVECJWIBKUXSGV-SECBINFHSA-N 1 2 247.323 2.146 20 0 BEADLO c1nc(C[N@@H+]2C[C@@H]3C[C@H]2CS3)oc1C1CC1 ZINC000335584662 136101187 /nfs/dbraw/zinc/10/11/87/136101187.db2.gz XHNZRCCADKGMHJ-UWVGGRQHSA-N 1 2 236.340 2.242 20 0 BEADLO c1nc(C[N@H+]2C[C@@H]3C[C@H]2CS3)oc1C1CC1 ZINC000335584662 136101188 /nfs/dbraw/zinc/10/11/88/136101188.db2.gz XHNZRCCADKGMHJ-UWVGGRQHSA-N 1 2 236.340 2.242 20 0 BEADLO Cc1cc(C)c(CNC(=O)N2[C@H](C)C[C@@H]2C)c[nH+]1 ZINC000335576065 136111274 /nfs/dbraw/zinc/11/12/74/136111274.db2.gz DADJVJHCTPWHRM-TXEJJXNPSA-N 1 2 247.342 2.391 20 0 BEADLO CC(C)OC(=O)Cn1c[nH+]c(C(C)(C)C)c1 ZINC001331890732 974852027 /nfs/dbraw/zinc/85/20/27/974852027.db2.gz KOQHGKVCVHPXLZ-UHFFFAOYSA-N 1 2 224.304 2.132 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2C[C@H]3CCCC[C@H]32)[nH]1 ZINC001647000780 1172749031 /nfs/dbraw/zinc/74/90/31/1172749031.db2.gz PTFRDKYYOGRYBW-GHMZBOCLSA-N 1 2 234.347 2.303 20 0 BEADLO CC(C)c1nnc(C[N@H+]2C[C@H]3CCCC[C@H]32)[nH]1 ZINC001647000780 1172749041 /nfs/dbraw/zinc/74/90/41/1172749041.db2.gz PTFRDKYYOGRYBW-GHMZBOCLSA-N 1 2 234.347 2.303 20 0 BEADLO CC1(C)CCC[C@H](C[N@@H+]2CCn3nccc3C2)O1 ZINC001647856635 1172772133 /nfs/dbraw/zinc/77/21/33/1172772133.db2.gz IRVFRRKLRPNKOT-CYBMUJFWSA-N 1 2 249.358 2.046 20 0 BEADLO CC1(C)CCC[C@H](C[N@H+]2CCn3nccc3C2)O1 ZINC001647856635 1172772141 /nfs/dbraw/zinc/77/21/41/1172772141.db2.gz IRVFRRKLRPNKOT-CYBMUJFWSA-N 1 2 249.358 2.046 20 0 BEADLO CC(C)c1nnc(NCc2c[nH+]cn2C)s1 ZINC000181564753 397810319 /nfs/dbraw/zinc/81/03/19/397810319.db2.gz ZPKRSIVURYRJJG-UHFFFAOYSA-N 1 2 237.332 2.007 20 0 BEADLO O=C(OC1CCCC1)c1ccc2[nH+]ccn2c1 ZINC000171516031 397828485 /nfs/dbraw/zinc/82/84/85/397828485.db2.gz ZMGZDUVQYRWKJS-UHFFFAOYSA-N 1 2 230.267 2.434 20 0 BEADLO CC(F)(F)CNCc1cn2ccccc2[nH+]1 ZINC000382346265 397883446 /nfs/dbraw/zinc/88/34/46/397883446.db2.gz FFJZMOQCMBJYJE-UHFFFAOYSA-N 1 2 225.242 2.079 20 0 BEADLO C[NH+](C)Cc1nc([C@H]2CCC(F)(F)C2)no1 ZINC000334496478 397933032 /nfs/dbraw/zinc/93/30/32/397933032.db2.gz KCYGMBQPVHNGMJ-ZETCQYMHSA-N 1 2 231.246 2.034 20 0 BEADLO Cc1nc(C)c(C[NH2+]Cc2ccc(C)cn2)o1 ZINC000382384137 397944099 /nfs/dbraw/zinc/94/40/99/397944099.db2.gz PYQMLPQBYNRVAI-UHFFFAOYSA-N 1 2 231.299 2.285 20 0 BEADLO CCc1noc(C)c1C[NH2+]Cc1nccs1 ZINC000382426606 397948810 /nfs/dbraw/zinc/94/88/10/397948810.db2.gz YMKJIEFMFCGEHT-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO CCc1cccc(C)c1NC(=O)Cn1cc[nH+]c1 ZINC000010809476 397952305 /nfs/dbraw/zinc/95/23/05/397952305.db2.gz KIUMGVQKHRFBPV-UHFFFAOYSA-N 1 2 243.310 2.393 20 0 BEADLO Cc1nc(NC[C@@H]2CCC[C@H](C)C2)nc(N)[nH+]1 ZINC000302631033 397957421 /nfs/dbraw/zinc/95/74/21/397957421.db2.gz QOAGAYHKKVIKAV-WCBMZHEXSA-N 1 2 235.335 2.000 20 0 BEADLO Cc1nc(N)nc(NC[C@@H]2CCC[C@H](C)C2)[nH+]1 ZINC000302631033 397957422 /nfs/dbraw/zinc/95/74/22/397957422.db2.gz QOAGAYHKKVIKAV-WCBMZHEXSA-N 1 2 235.335 2.000 20 0 BEADLO COc1ncc(CNc2c[nH+]cc(C)c2)s1 ZINC000380833869 397895724 /nfs/dbraw/zinc/89/57/24/397895724.db2.gz QQUGVVWGWZSQQE-UHFFFAOYSA-N 1 2 235.312 2.467 20 0 BEADLO Cc1nnsc1C[NH+]1CC2(C1)CC(F)(F)C2 ZINC000649571107 397961848 /nfs/dbraw/zinc/96/18/48/397961848.db2.gz YYXWRTPUUFCQDC-UHFFFAOYSA-N 1 2 245.298 2.078 20 0 BEADLO Cn1cc[nH+]c1[C@H](NCC(C)(F)F)C1CC1 ZINC000382170153 397916687 /nfs/dbraw/zinc/91/66/87/397916687.db2.gz WCLRBNOLSVWAEB-SECBINFHSA-N 1 2 229.274 2.116 20 0 BEADLO CCCC[N@@H+]1CC(=O)N[C@@]12C[C@H](C)C[C@H](C)C2 ZINC000439142893 397923279 /nfs/dbraw/zinc/92/32/79/397923279.db2.gz QONGPTRRBVMPST-IMRBUKKESA-N 1 2 238.375 2.371 20 0 BEADLO CCCC[N@H+]1CC(=O)N[C@@]12C[C@H](C)C[C@H](C)C2 ZINC000439142893 397923280 /nfs/dbraw/zinc/92/32/80/397923280.db2.gz QONGPTRRBVMPST-IMRBUKKESA-N 1 2 238.375 2.371 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)o1 ZINC000302735656 398000653 /nfs/dbraw/zinc/00/06/53/398000653.db2.gz DDYHATZXSPZYBA-MRVPVSSYSA-N 1 2 249.236 2.152 20 0 BEADLO Cc1nnc(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)o1 ZINC000302735656 398000654 /nfs/dbraw/zinc/00/06/54/398000654.db2.gz DDYHATZXSPZYBA-MRVPVSSYSA-N 1 2 249.236 2.152 20 0 BEADLO COCc1cc[nH+]c(NCc2cscn2)c1 ZINC000650244577 398004936 /nfs/dbraw/zinc/00/49/36/398004936.db2.gz FPAXTQMCTQOTFV-UHFFFAOYSA-N 1 2 235.312 2.297 20 0 BEADLO CCc1cc[nH+]cc1NCc1cn(C(C)C)nn1 ZINC000650242884 398005373 /nfs/dbraw/zinc/00/53/73/398005373.db2.gz ARBJBUYYRNGVCL-UHFFFAOYSA-N 1 2 245.330 2.429 20 0 BEADLO COCc1cc[nH+]c(NCc2cccn2C)c1 ZINC000650244962 398007276 /nfs/dbraw/zinc/00/72/76/398007276.db2.gz WPKVIOYEFJACCS-UHFFFAOYSA-N 1 2 231.299 2.179 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1C(=O)N(C)Cc1[nH+]ccn1C ZINC000274672769 398012066 /nfs/dbraw/zinc/01/20/66/398012066.db2.gz KBMYJNGMXNFULP-RISCZKNCSA-N 1 2 249.358 2.061 20 0 BEADLO COC(=O)[C@H]1C[C@@H](C)CC[N@@H+]1Cc1ccco1 ZINC000274969430 398017930 /nfs/dbraw/zinc/01/79/30/398017930.db2.gz VZEWQDPQOPOZLD-CMPLNLGQSA-N 1 2 237.299 2.053 20 0 BEADLO COC(=O)[C@H]1C[C@@H](C)CC[N@H+]1Cc1ccco1 ZINC000274969430 398017935 /nfs/dbraw/zinc/01/79/35/398017935.db2.gz VZEWQDPQOPOZLD-CMPLNLGQSA-N 1 2 237.299 2.053 20 0 BEADLO Fc1c[nH+]ccc1N1CCO[C@H](C2CCC2)C1 ZINC000641634330 398021305 /nfs/dbraw/zinc/02/13/05/398021305.db2.gz YUYDPSDXFPMSSX-ZDUSSCGKSA-N 1 2 236.290 2.226 20 0 BEADLO CC(=O)c1cccc(C[N@H+]2CCN(C)C[C@H]2C)c1 ZINC000334664620 398028960 /nfs/dbraw/zinc/02/89/60/398028960.db2.gz VNJRHEJPCZVUIL-GFCCVEGCSA-N 1 2 246.354 2.025 20 0 BEADLO CC(=O)c1cccc(C[N@@H+]2CCN(C)C[C@H]2C)c1 ZINC000334664620 398028962 /nfs/dbraw/zinc/02/89/62/398028962.db2.gz VNJRHEJPCZVUIL-GFCCVEGCSA-N 1 2 246.354 2.025 20 0 BEADLO CC(C)O[C@H]1CCC[N@H+](CC(F)F)C1 ZINC000649701093 398049226 /nfs/dbraw/zinc/04/92/26/398049226.db2.gz UWZPCADXUVEZLK-VIFPVBQESA-N 1 2 207.264 2.141 20 0 BEADLO CC(C)O[C@H]1CCC[N@@H+](CC(F)F)C1 ZINC000649701093 398049227 /nfs/dbraw/zinc/04/92/27/398049227.db2.gz UWZPCADXUVEZLK-VIFPVBQESA-N 1 2 207.264 2.141 20 0 BEADLO COc1cc[nH+]c(CN2CCCC(F)(F)C2)c1 ZINC000649692838 398040315 /nfs/dbraw/zinc/04/03/15/398040315.db2.gz HWSQPMFEPNCCSC-UHFFFAOYSA-N 1 2 242.269 2.321 20 0 BEADLO CCc1cc(N2CCCC[C@H]2COC)nc(C)[nH+]1 ZINC000450940771 397970378 /nfs/dbraw/zinc/97/03/78/397970378.db2.gz ROZBJGKIVPWNII-ZDUSSCGKSA-N 1 2 249.358 2.353 20 0 BEADLO CCO[C@@H]1C[C@H](N(C)c2cc[nH+]c(C)n2)C1(C)C ZINC000361042718 397971776 /nfs/dbraw/zinc/97/17/76/397971776.db2.gz CEWUYSRFQCMRMY-NWDGAFQWSA-N 1 2 249.358 2.425 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)NC1CCCCCC1 ZINC000279256457 398042133 /nfs/dbraw/zinc/04/21/33/398042133.db2.gz UKSFMVSMLVUCQM-UHFFFAOYSA-N 1 2 235.331 2.181 20 0 BEADLO CO[C@H](C[N@@H+]1CCCC(F)(F)C1)C1CC1 ZINC000649695610 398043759 /nfs/dbraw/zinc/04/37/59/398043759.db2.gz AGADPCFCJSZYEH-SNVBAGLBSA-N 1 2 219.275 2.143 20 0 BEADLO CO[C@H](C[N@H+]1CCCC(F)(F)C1)C1CC1 ZINC000649695610 398043762 /nfs/dbraw/zinc/04/37/62/398043762.db2.gz AGADPCFCJSZYEH-SNVBAGLBSA-N 1 2 219.275 2.143 20 0 BEADLO CCc1cc(NCC(CC)(CC)OC)nc[nH+]1 ZINC000384060898 398061339 /nfs/dbraw/zinc/06/13/39/398061339.db2.gz YBPKSFGFGDFWBJ-UHFFFAOYSA-N 1 2 237.347 2.078 20 0 BEADLO Cc1cc[nH+]cc1NCc1ncc(Cl)n1C ZINC000281674358 398062196 /nfs/dbraw/zinc/06/21/96/398062196.db2.gz LUWTZZHKSCNGIB-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nc(C)c(C)o2)[C@@H](C)CO1 ZINC000649731628 398071204 /nfs/dbraw/zinc/07/12/04/398071204.db2.gz KHUIUKDKFKBWOV-JOYOIKCWSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nc(C)c(C)o2)[C@@H](C)CO1 ZINC000649731628 398071210 /nfs/dbraw/zinc/07/12/10/398071210.db2.gz KHUIUKDKFKBWOV-JOYOIKCWSA-N 1 2 238.331 2.291 20 0 BEADLO CO[C@H]1C[C@@H](N(C)c2cc[nH+]c3ccncc32)C1 ZINC000286512887 398081443 /nfs/dbraw/zinc/08/14/43/398081443.db2.gz ZBNVTGVBWUGBIU-PHIMTYICSA-N 1 2 243.310 2.243 20 0 BEADLO FC1(F)CC12CC[NH+](Cc1ccon1)CC2 ZINC000649773412 398095690 /nfs/dbraw/zinc/09/56/90/398095690.db2.gz RJGKJDPYIISSOO-UHFFFAOYSA-N 1 2 228.242 2.296 20 0 BEADLO CC1(C)C[C@H](SCc2ccc[nH+]c2N)CO1 ZINC000603359376 398090477 /nfs/dbraw/zinc/09/04/77/398090477.db2.gz OBQDTICQSAFYIK-JTQLQIEISA-N 1 2 238.356 2.465 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1cccc(O)c1Cl ZINC000293678814 398117493 /nfs/dbraw/zinc/11/74/93/398117493.db2.gz PNKHDZAWOZJKHW-JTQLQIEISA-N 1 2 241.718 2.266 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1cccc(O)c1Cl ZINC000293678814 398117496 /nfs/dbraw/zinc/11/74/96/398117496.db2.gz PNKHDZAWOZJKHW-JTQLQIEISA-N 1 2 241.718 2.266 20 0 BEADLO c1csc([C@@H]([NH2+]C2CCCC2)c2nnc[nH]2)c1 ZINC000293949066 398118697 /nfs/dbraw/zinc/11/86/97/398118697.db2.gz ZEJAHLNKRNSHFX-LLVKDONJSA-N 1 2 248.355 2.488 20 0 BEADLO Cc1[nH]c(CN2CCOC[C@H]2CC2CC2)[nH+]c1C ZINC001648407668 1172829263 /nfs/dbraw/zinc/82/92/63/1172829263.db2.gz DXIAUSIGHKIHKP-CYBMUJFWSA-N 1 2 249.358 2.027 20 0 BEADLO CCCCCC(=O)N1CCc2cc[nH+]c(N)c2C1 ZINC001648427955 1172833380 /nfs/dbraw/zinc/83/33/80/1172833380.db2.gz MTBFKQCXPJHNLV-UHFFFAOYSA-N 1 2 247.342 2.129 20 0 BEADLO C/C=C\C(=O)N1CCC[C@@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001649369517 1172873646 /nfs/dbraw/zinc/87/36/46/1172873646.db2.gz IGLOOAOBEKSMFL-VLWUPBBWSA-N 1 2 233.315 2.266 20 0 BEADLO CC[N@H+](CCC(F)(F)F)Cc1cncn1C ZINC000674369984 487566625 /nfs/dbraw/zinc/56/66/25/487566625.db2.gz OZIUYDBOJLPFNC-UHFFFAOYSA-N 1 2 235.253 2.194 20 0 BEADLO CC[N@@H+](CCC(F)(F)F)Cc1cncn1C ZINC000674369984 487566628 /nfs/dbraw/zinc/56/66/28/487566628.db2.gz OZIUYDBOJLPFNC-UHFFFAOYSA-N 1 2 235.253 2.194 20 0 BEADLO CCN(CCC(F)(F)F)Cc1c[nH+]cn1C ZINC000674369984 487566631 /nfs/dbraw/zinc/56/66/31/487566631.db2.gz OZIUYDBOJLPFNC-UHFFFAOYSA-N 1 2 235.253 2.194 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1cncn1C ZINC000674370363 487566682 /nfs/dbraw/zinc/56/66/82/487566682.db2.gz YPUVIUNAWRPOCW-UHFFFAOYSA-N 1 2 219.288 2.035 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1cncn1C ZINC000674370363 487566689 /nfs/dbraw/zinc/56/66/89/487566689.db2.gz YPUVIUNAWRPOCW-UHFFFAOYSA-N 1 2 219.288 2.035 20 0 BEADLO c1n[nH]c2c1CCC[C@@H]2[NH2+]Cc1cnsc1 ZINC001650685265 1172890046 /nfs/dbraw/zinc/89/00/46/1172890046.db2.gz RXDKBFMCMNSSOJ-JTQLQIEISA-N 1 2 234.328 2.033 20 0 BEADLO c1nscc1C[NH2+][C@H]1CCCc2c[nH]nc21 ZINC001650685265 1172890055 /nfs/dbraw/zinc/89/00/55/1172890055.db2.gz RXDKBFMCMNSSOJ-JTQLQIEISA-N 1 2 234.328 2.033 20 0 BEADLO Cc1noc(C)c1[C@H](C)[NH2+]Cc1ncc(C)cn1 ZINC000680383018 487580245 /nfs/dbraw/zinc/58/02/45/487580245.db2.gz NRWMZQQDBICKBL-VIFPVBQESA-N 1 2 246.314 2.241 20 0 BEADLO CCc1nc(C[NH2+]Cc2scnc2C)co1 ZINC001651088393 1172924305 /nfs/dbraw/zinc/92/43/05/1172924305.db2.gz PXHPPLMLSDMANQ-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO C[NH2+]Cc1noc(C2CC(C(C)(C)C)C2)n1 ZINC000666572702 487583943 /nfs/dbraw/zinc/58/39/43/487583943.db2.gz ABOHLNJEJCSIIY-UHFFFAOYSA-N 1 2 223.320 2.329 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CC(C)(C)OCC1(C)C ZINC000685837541 487583688 /nfs/dbraw/zinc/58/36/88/487583688.db2.gz ITRBFFAEDDBCNZ-UHFFFAOYSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CC(C)(C)OCC1(C)C ZINC000685837541 487583694 /nfs/dbraw/zinc/58/36/94/487583694.db2.gz ITRBFFAEDDBCNZ-UHFFFAOYSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CC(C)(C)OCC1(C)C ZINC000685837541 487583696 /nfs/dbraw/zinc/58/36/96/487583696.db2.gz ITRBFFAEDDBCNZ-UHFFFAOYSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CC(C)(C)OCC1(C)C ZINC000685837541 487583701 /nfs/dbraw/zinc/58/37/01/487583701.db2.gz ITRBFFAEDDBCNZ-UHFFFAOYSA-N 1 2 237.347 2.108 20 0 BEADLO CCCN(C(=O)[C@@H](C)Cc1c[nH+]c[nH]1)C(C)C ZINC000655238828 487591214 /nfs/dbraw/zinc/59/12/14/487591214.db2.gz DHWNUPQCJDPCLC-NSHDSACASA-N 1 2 237.347 2.235 20 0 BEADLO CCCN(C(=O)[C@@H](C)Cc1c[nH]c[nH+]1)C(C)C ZINC000655238828 487591224 /nfs/dbraw/zinc/59/12/24/487591224.db2.gz DHWNUPQCJDPCLC-NSHDSACASA-N 1 2 237.347 2.235 20 0 BEADLO Fc1cc2c(cc1F)C[NH+](C[C@@H]1CCCO1)C2 ZINC000653833098 487595964 /nfs/dbraw/zinc/59/59/64/487595964.db2.gz ZXULFORTXNXHMJ-NSHDSACASA-N 1 2 239.265 2.459 20 0 BEADLO O[C@@H]1CC[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1(F)F ZINC000661411865 487597492 /nfs/dbraw/zinc/59/74/92/487597492.db2.gz BRGQGFRCMXANPO-WISYIIOYSA-N 1 2 245.313 2.125 20 0 BEADLO O[C@@H]1CC[N@@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1(F)F ZINC000661411865 487597495 /nfs/dbraw/zinc/59/74/95/487597495.db2.gz BRGQGFRCMXANPO-WISYIIOYSA-N 1 2 245.313 2.125 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2cncs2)cn1 ZINC000680478676 487603981 /nfs/dbraw/zinc/60/39/81/487603981.db2.gz DQARXJNNKNVVGB-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2cncs2)cn1 ZINC000680478676 487603982 /nfs/dbraw/zinc/60/39/82/487603982.db2.gz DQARXJNNKNVVGB-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO c1n[nH]cc1C[N@@H+]1CCO[C@H](C2CCCCC2)C1 ZINC000680487117 487605590 /nfs/dbraw/zinc/60/55/90/487605590.db2.gz RLQKDVUXAVZJEF-AWEZNQCLSA-N 1 2 249.358 2.191 20 0 BEADLO c1n[nH]cc1C[N@H+]1CCO[C@H](C2CCCCC2)C1 ZINC000680487117 487605591 /nfs/dbraw/zinc/60/55/91/487605591.db2.gz RLQKDVUXAVZJEF-AWEZNQCLSA-N 1 2 249.358 2.191 20 0 BEADLO CC(C)SCC[N@H+](C)CC(=O)OC(C)(C)C ZINC000338238669 167321480 /nfs/dbraw/zinc/32/14/80/167321480.db2.gz LXWZPSNXHZHTRJ-UHFFFAOYSA-N 1 2 247.404 2.402 20 0 BEADLO CC(C)SCC[N@@H+](C)CC(=O)OC(C)(C)C ZINC000338238669 167321483 /nfs/dbraw/zinc/32/14/83/167321483.db2.gz LXWZPSNXHZHTRJ-UHFFFAOYSA-N 1 2 247.404 2.402 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2nc(C)no2)cs1 ZINC000653887943 487608978 /nfs/dbraw/zinc/60/89/78/487608978.db2.gz CEKLPYPZQSWFHD-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2nc(C)no2)cs1 ZINC000653887943 487608981 /nfs/dbraw/zinc/60/89/81/487608981.db2.gz CEKLPYPZQSWFHD-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO C[C@@]1(C(F)F)C[N@H+](Cc2ccco2)CCO1 ZINC000668825916 487609740 /nfs/dbraw/zinc/60/97/40/487609740.db2.gz SFMWCAWOZHDMGF-NSHDSACASA-N 1 2 231.242 2.136 20 0 BEADLO C[C@@]1(C(F)F)C[N@@H+](Cc2ccco2)CCO1 ZINC000668825916 487609744 /nfs/dbraw/zinc/60/97/44/487609744.db2.gz SFMWCAWOZHDMGF-NSHDSACASA-N 1 2 231.242 2.136 20 0 BEADLO C[C@@H](CC(=O)N[C@]1(C)CC=CCC1)n1cc[nH+]c1 ZINC000650092804 409527171 /nfs/dbraw/zinc/52/71/71/409527171.db2.gz VVLSUMMDVGNHMI-GXTWGEPZSA-N 1 2 247.342 2.449 20 0 BEADLO C[C@@H](CC(=O)N[C@@]1(C)CC=CCC1)n1cc[nH+]c1 ZINC000650092805 409527213 /nfs/dbraw/zinc/52/72/13/409527213.db2.gz VVLSUMMDVGNHMI-JSGCOSHPSA-N 1 2 247.342 2.449 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1NC(=O)CCCn1cc[nH+]c1 ZINC000655266592 409770326 /nfs/dbraw/zinc/77/03/26/409770326.db2.gz JGXSPNPBQACZKY-TZMCWYRMSA-N 1 2 249.358 2.214 20 0 BEADLO C[N@@H+](Cc1noc(C2CC2)n1)C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000660812317 409779938 /nfs/dbraw/zinc/77/99/38/409779938.db2.gz NCEMPKGIYBJFQP-YHPBZONMSA-N 1 2 247.342 2.425 20 0 BEADLO C[N@H+](Cc1noc(C2CC2)n1)C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000660812317 409779947 /nfs/dbraw/zinc/77/99/47/409779947.db2.gz NCEMPKGIYBJFQP-YHPBZONMSA-N 1 2 247.342 2.425 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2coc(C)n2)[C@@H](CC)CO1 ZINC000660911630 409961122 /nfs/dbraw/zinc/96/11/22/409961122.db2.gz FHWFECSQLKMTQT-QWHCGFSZSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2coc(C)n2)[C@@H](CC)CO1 ZINC000660911630 409961126 /nfs/dbraw/zinc/96/11/26/409961126.db2.gz FHWFECSQLKMTQT-QWHCGFSZSA-N 1 2 238.331 2.372 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cncs2)C2(CCC2)CO1 ZINC000651974395 409963643 /nfs/dbraw/zinc/96/36/43/409963643.db2.gz CJPSVONVOZSYPV-SNVBAGLBSA-N 1 2 238.356 2.287 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cncs2)C2(CCC2)CO1 ZINC000651974395 409963647 /nfs/dbraw/zinc/96/36/47/409963647.db2.gz CJPSVONVOZSYPV-SNVBAGLBSA-N 1 2 238.356 2.287 20 0 BEADLO CSc1ccc[nH+]c1NCc1c(C)cnn1C ZINC000651971893 409946307 /nfs/dbraw/zinc/94/63/07/409946307.db2.gz ZEFXXWROZVZSOM-UHFFFAOYSA-N 1 2 248.355 2.458 20 0 BEADLO Cc1cc(NC(=O)c2ccncc2C)c(C)c[nH+]1 ZINC000558705083 410035709 /nfs/dbraw/zinc/03/57/09/410035709.db2.gz QTUNYNWPUAOQOP-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO CCc1cc[nH+]cc1NCc1nccnc1OC ZINC000651979897 410114426 /nfs/dbraw/zinc/11/44/26/410114426.db2.gz PFIGOSDOAFCHAY-UHFFFAOYSA-N 1 2 244.298 2.055 20 0 BEADLO O=C(CCCn1cc[nH+]c1)NC1(C2CCC2)CC1 ZINC000650663271 410284849 /nfs/dbraw/zinc/28/48/49/410284849.db2.gz GKXICMRWSGUFBM-UHFFFAOYSA-N 1 2 247.342 2.112 20 0 BEADLO CC[C@H]1CN(c2cc[nH+]c3ccncc32)CCO1 ZINC000085655302 410466135 /nfs/dbraw/zinc/46/61/35/410466135.db2.gz ZVTZWFIZCZZLNV-NSHDSACASA-N 1 2 243.310 2.245 20 0 BEADLO CO[C@@H](COCc1[nH]cc[nH+]1)C1CCCC1 ZINC000664032015 410439007 /nfs/dbraw/zinc/43/90/07/410439007.db2.gz DPKKDTDVVMQWHD-NSHDSACASA-N 1 2 224.304 2.132 20 0 BEADLO CC[C@@H](COCC1CC1)Nc1cc[nH+]c(C)n1 ZINC000664174994 410508366 /nfs/dbraw/zinc/50/83/66/410508366.db2.gz WKJVTIVUXWAQPO-LBPRGKRZSA-N 1 2 235.331 2.402 20 0 BEADLO CCc1cc(NC[C@H]2CCC[C@@H](C)O2)nc[nH+]1 ZINC000664394113 410575903 /nfs/dbraw/zinc/57/59/03/410575903.db2.gz KURGMIXFMTUYDY-ZYHUDNBSSA-N 1 2 235.331 2.409 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CC[C@@H]3C[C@@H]3C2)[nH+]1 ZINC000664525208 410593982 /nfs/dbraw/zinc/59/39/82/410593982.db2.gz NJXLDKFPWADOBR-NXEZZACHSA-N 1 2 228.299 2.113 20 0 BEADLO O[C@H]1C[C@H](Nc2[nH+]ccc3ccc(F)cc32)C1 ZINC000664642768 410613005 /nfs/dbraw/zinc/61/30/05/410613005.db2.gz DRNGODCWEKDONJ-XYPYZODXSA-N 1 2 232.258 2.309 20 0 BEADLO CC/C=C\CC[N@@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000661405464 410617561 /nfs/dbraw/zinc/61/75/61/410617561.db2.gz DLTXCUBZUKAAMC-UMBAGQNISA-N 1 2 219.275 2.045 20 0 BEADLO CC/C=C\CC[N@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000661405464 410617566 /nfs/dbraw/zinc/61/75/66/410617566.db2.gz DLTXCUBZUKAAMC-UMBAGQNISA-N 1 2 219.275 2.045 20 0 BEADLO CC(C)CCCC(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000294455845 166800363 /nfs/dbraw/zinc/80/03/63/166800363.db2.gz LJWPCMIZVBHVOH-GFCCVEGCSA-N 1 2 237.347 2.214 20 0 BEADLO CCC[C@H](C)N(C)c1cc(CO)cc[nH+]1 ZINC000040878624 410894427 /nfs/dbraw/zinc/89/44/27/410894427.db2.gz KWSJGEYAWIVLHA-JTQLQIEISA-N 1 2 208.305 2.199 20 0 BEADLO CC(C)[NH2+]c1ccc(-n2cncn2)cc1 ZINC000037768783 167143552 /nfs/dbraw/zinc/14/35/52/167143552.db2.gz MBGDWIBBNIXLHK-UHFFFAOYSA-N 1 2 202.261 2.088 20 0 BEADLO Cc1[nH+]cccc1N[C@H](C)Cc1cnccn1 ZINC000651300947 410907749 /nfs/dbraw/zinc/90/77/49/410907749.db2.gz UKIUXYGYTLUSJF-SNVBAGLBSA-N 1 2 228.299 2.223 20 0 BEADLO CC(C)OC(=O)[C@H](C)[N@H+](C)CCSC(C)C ZINC000338271180 167169909 /nfs/dbraw/zinc/16/99/09/167169909.db2.gz MFSFYYYSJNLATO-NSHDSACASA-N 1 2 247.404 2.400 20 0 BEADLO CC(C)OC(=O)[C@H](C)[N@@H+](C)CCSC(C)C ZINC000338271180 167169912 /nfs/dbraw/zinc/16/99/12/167169912.db2.gz MFSFYYYSJNLATO-NSHDSACASA-N 1 2 247.404 2.400 20 0 BEADLO CC(C)OC(=O)[C@H](c1ccccc1)[NH+](C)C ZINC000356096866 167170249 /nfs/dbraw/zinc/17/02/49/167170249.db2.gz WHPRYEDLGSSICP-LBPRGKRZSA-N 1 2 221.300 2.241 20 0 BEADLO Cc1ccc(N[C@H](C)Cc2cnccn2)c[nH+]1 ZINC000651300357 410909065 /nfs/dbraw/zinc/90/90/65/410909065.db2.gz SASZWKHGIMLKRL-LLVKDONJSA-N 1 2 228.299 2.223 20 0 BEADLO CC(C)OCC[N@@H+]1CCC[C@@H]1C(F)F ZINC000353192112 167231839 /nfs/dbraw/zinc/23/18/39/167231839.db2.gz BGVILSTWZKGLKU-SECBINFHSA-N 1 2 207.264 2.141 20 0 BEADLO CC(C)OCC[N@H+]1CCC[C@@H]1C(F)F ZINC000353192112 167231843 /nfs/dbraw/zinc/23/18/43/167231843.db2.gz BGVILSTWZKGLKU-SECBINFHSA-N 1 2 207.264 2.141 20 0 BEADLO CC(C)OCC[N@@H+]1CCOC[C@@H]1c1ccco1 ZINC000375798129 167234971 /nfs/dbraw/zinc/23/49/71/167234971.db2.gz WXLJYAHYPLUIHX-GFCCVEGCSA-N 1 2 239.315 2.078 20 0 BEADLO CC(C)OCC[N@H+]1CCOC[C@@H]1c1ccco1 ZINC000375798129 167234973 /nfs/dbraw/zinc/23/49/73/167234973.db2.gz WXLJYAHYPLUIHX-GFCCVEGCSA-N 1 2 239.315 2.078 20 0 BEADLO CC(C)OCCNc1cc[nH+]c(C(C)C)n1 ZINC000302147106 167247058 /nfs/dbraw/zinc/24/70/58/167247058.db2.gz RRVOCKOAYYGQPD-UHFFFAOYSA-N 1 2 223.320 2.437 20 0 BEADLO CC(C)Oc1cccc(C[N@@H+]2CCO[C@H]3C[C@H]32)c1 ZINC000368639539 167304142 /nfs/dbraw/zinc/30/41/42/167304142.db2.gz VYYDEUHWMUGTDH-CABCVRRESA-N 1 2 247.338 2.447 20 0 BEADLO CC(C)Oc1cccc(C[N@H+]2CCO[C@H]3C[C@H]32)c1 ZINC000368639539 167304146 /nfs/dbraw/zinc/30/41/46/167304146.db2.gz VYYDEUHWMUGTDH-CABCVRRESA-N 1 2 247.338 2.447 20 0 BEADLO CC(C)Oc1ncccc1NCc1c[nH+]cn1C ZINC000090167133 167314509 /nfs/dbraw/zinc/31/45/09/167314509.db2.gz ICUDASKJIKGCOP-UHFFFAOYSA-N 1 2 246.314 2.214 20 0 BEADLO CC(C)[C@@H](C)C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000264968035 167348813 /nfs/dbraw/zinc/34/88/13/167348813.db2.gz GHMGIAWGHCMDBS-VXGBXAGGSA-N 1 2 249.358 2.408 20 0 BEADLO CC(C)[C@@H](C)N(C)C(=O)c1ccc2[nH+]ccn2c1 ZINC000263995797 167365366 /nfs/dbraw/zinc/36/53/66/167365366.db2.gz IVRGAOMKDNWOKM-LLVKDONJSA-N 1 2 245.326 2.451 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CSC[C@H]1C ZINC000397949635 410939174 /nfs/dbraw/zinc/93/91/74/410939174.db2.gz WAAXOWTYQFMSHD-RKDXNWHRSA-N 1 2 224.329 2.254 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCCC1(F)F)c1cn[nH]c1 ZINC000398025858 410940204 /nfs/dbraw/zinc/94/02/04/410940204.db2.gz DTVMPMYXWDNFRS-IONNQARKSA-N 1 2 215.247 2.248 20 0 BEADLO CC(C)[C@@H](C)Nc1nc[nH+]c(N)c1Cl ZINC000227841444 167388096 /nfs/dbraw/zinc/38/80/96/167388096.db2.gz FTWBUHNGVCHLAX-ZCFIWIBFSA-N 1 2 214.700 2.169 20 0 BEADLO CC(C)[C@@H](NC(=O)CC1CCC1)c1[nH]cc[nH+]1 ZINC000276659792 167424393 /nfs/dbraw/zinc/42/43/93/167424393.db2.gz MKJWDWMHFPOEHR-GFCCVEGCSA-N 1 2 235.331 2.413 20 0 BEADLO CCC[C@H](C[NH2+][C@@H](C)c1cn[nH]c1C)OC ZINC000651374152 410959739 /nfs/dbraw/zinc/95/97/39/410959739.db2.gz IAOIZIUCSVYMCQ-GXSJLCMTSA-N 1 2 225.336 2.184 20 0 BEADLO Cc1nc(N2CCCC(F)(F)C2)cc[nH+]1 ZINC000651384918 410969381 /nfs/dbraw/zinc/96/93/81/410969381.db2.gz LKYYWBKBMLVCTI-UHFFFAOYSA-N 1 2 213.231 2.021 20 0 BEADLO CCc1nc(N2C[C@@H](CC)OC[C@@H]2C)cc(C)[nH+]1 ZINC000651405718 410986689 /nfs/dbraw/zinc/98/66/89/410986689.db2.gz WVOJNWZUNZKTJO-NWDGAFQWSA-N 1 2 249.358 2.351 20 0 BEADLO C[C@@H](CCO)N(C)c1cc(C(F)(F)F)cc[nH+]1 ZINC000651471372 411052606 /nfs/dbraw/zinc/05/26/06/411052606.db2.gz RQFXEEXKCGRIJC-QMMMGPOBSA-N 1 2 248.248 2.308 20 0 BEADLO CCO[C@@H]1CCC[C@H]1[NH2+][C@H](C)c1cn[nH]c1C ZINC000651478459 411060666 /nfs/dbraw/zinc/06/06/66/411060666.db2.gz QQNLNBGFUMSOLZ-OASPWFOLSA-N 1 2 237.347 2.326 20 0 BEADLO C[C@@H](COCC1CC1)Nc1cccc[nH+]1 ZINC000651458491 411041707 /nfs/dbraw/zinc/04/17/07/411041707.db2.gz HNNSDPLZXRCAFO-JTQLQIEISA-N 1 2 206.289 2.309 20 0 BEADLO C[C@@H](COCC1CC1)Nc1cc[nH+]c(C2CC2)n1 ZINC000651458577 411041777 /nfs/dbraw/zinc/04/17/77/411041777.db2.gz KJKGBNVCVYSDJJ-JTQLQIEISA-N 1 2 247.342 2.003 20 0 BEADLO CCc1cccc(C[NH+]2CC(OCCOC)C2)c1 ZINC000651749148 411140690 /nfs/dbraw/zinc/14/06/90/411140690.db2.gz MJAJLDMKEOJBHG-UHFFFAOYSA-N 1 2 249.354 2.096 20 0 BEADLO c1c2cnccc2oc1C[N@@H+]1CCOCC12CC2 ZINC000651796460 411144472 /nfs/dbraw/zinc/14/44/72/411144472.db2.gz IPOIHYTTXIYSNI-UHFFFAOYSA-N 1 2 244.294 2.193 20 0 BEADLO c1c2cnccc2oc1C[N@H+]1CCOCC12CC2 ZINC000651796460 411144473 /nfs/dbraw/zinc/14/44/73/411144473.db2.gz IPOIHYTTXIYSNI-UHFFFAOYSA-N 1 2 244.294 2.193 20 0 BEADLO CC(C)O[C@H]1CCC[N@H+](Cc2cocn2)C1 ZINC000651897946 411149521 /nfs/dbraw/zinc/14/95/21/411149521.db2.gz OTJKNMLXYZJVKW-LBPRGKRZSA-N 1 2 224.304 2.064 20 0 BEADLO CC(C)O[C@H]1CCC[N@@H+](Cc2cocn2)C1 ZINC000651897946 411149522 /nfs/dbraw/zinc/14/95/22/411149522.db2.gz OTJKNMLXYZJVKW-LBPRGKRZSA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@H]1C[N@H+](Cc2coc(C)n2)CCS1 ZINC000659972549 411152074 /nfs/dbraw/zinc/15/20/74/411152074.db2.gz ALJAUAWARVDKSA-NSHDSACASA-N 1 2 226.345 2.310 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2coc(C)n2)CCS1 ZINC000659972549 411152077 /nfs/dbraw/zinc/15/20/77/411152077.db2.gz ALJAUAWARVDKSA-NSHDSACASA-N 1 2 226.345 2.310 20 0 BEADLO COCc1cc[nH+]c(N[C@H]2CCOC[C@@H]2C)c1 ZINC000652068178 411104733 /nfs/dbraw/zinc/10/47/33/411104733.db2.gz VJSPKHOVBUZUAG-JQWIXIFHSA-N 1 2 236.315 2.065 20 0 BEADLO COCc1cc[nH+]c(N[C@H]2CCOC[C@H]2C)c1 ZINC000652068179 411104833 /nfs/dbraw/zinc/10/48/33/411104833.db2.gz VJSPKHOVBUZUAG-PWSUYJOCSA-N 1 2 236.315 2.065 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2CCO[C@H](C)C2)c1 ZINC000652068563 411104845 /nfs/dbraw/zinc/10/48/45/411104845.db2.gz HFOHYPFXTUQGDS-ZYHUDNBSSA-N 1 2 236.315 2.207 20 0 BEADLO Fc1cnccc1C[N@H+]1CCC[C@@H](F)C1 ZINC000652076128 411107687 /nfs/dbraw/zinc/10/76/87/411107687.db2.gz ONTUMYWJZDTNHO-SNVBAGLBSA-N 1 2 212.243 2.155 20 0 BEADLO Fc1cnccc1C[N@@H+]1CCC[C@@H](F)C1 ZINC000652076128 411107689 /nfs/dbraw/zinc/10/76/89/411107689.db2.gz ONTUMYWJZDTNHO-SNVBAGLBSA-N 1 2 212.243 2.155 20 0 BEADLO F[C@@H]1CCC[N@H+](Cc2cnc3ccccn23)C1 ZINC000652077486 411109245 /nfs/dbraw/zinc/10/92/45/411109245.db2.gz GIKJWHBVTOFBBN-LLVKDONJSA-N 1 2 233.290 2.268 20 0 BEADLO F[C@@H]1CCC[N@@H+](Cc2cnc3ccccn23)C1 ZINC000652077486 411109247 /nfs/dbraw/zinc/10/92/47/411109247.db2.gz GIKJWHBVTOFBBN-LLVKDONJSA-N 1 2 233.290 2.268 20 0 BEADLO CCn1cc(N[C@@H]2CCCn3cc[nH+]c32)cn1 ZINC000655748694 411161924 /nfs/dbraw/zinc/16/19/24/411161924.db2.gz GTFCQSNASQDRFB-LLVKDONJSA-N 1 2 231.303 2.047 20 0 BEADLO CCCC(C)(C)C(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000651546392 411118017 /nfs/dbraw/zinc/11/80/17/411118017.db2.gz RQHOSQIXRVPFQD-SNVBAGLBSA-N 1 2 249.358 2.210 20 0 BEADLO CCCC(C)(C)C(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000651546392 411118020 /nfs/dbraw/zinc/11/80/20/411118020.db2.gz RQHOSQIXRVPFQD-SNVBAGLBSA-N 1 2 249.358 2.210 20 0 BEADLO FC(F)C[N@@H+]1CC[C@@H](c2ccncc2)C1 ZINC000653680068 411174913 /nfs/dbraw/zinc/17/49/13/411174913.db2.gz DFYFZHCXEXISGP-SNVBAGLBSA-N 1 2 212.243 2.136 20 0 BEADLO FC(F)C[N@H+]1CC[C@@H](c2ccncc2)C1 ZINC000653680068 411174915 /nfs/dbraw/zinc/17/49/15/411174915.db2.gz DFYFZHCXEXISGP-SNVBAGLBSA-N 1 2 212.243 2.136 20 0 BEADLO COc1c(C)[nH+]cnc1NC1CCCC1 ZINC000656104043 411178901 /nfs/dbraw/zinc/17/89/01/411178901.db2.gz WWCWINCRNVDRPO-UHFFFAOYSA-N 1 2 207.277 2.148 20 0 BEADLO COc1c(C)[nH+]cnc1NCc1cccs1 ZINC000656105311 411178943 /nfs/dbraw/zinc/17/89/43/411178943.db2.gz ZPULDIYUOGMPJC-UHFFFAOYSA-N 1 2 235.312 2.467 20 0 BEADLO COc1c(C)[nH+]cnc1N(C)Cc1ccco1 ZINC000656105650 411179435 /nfs/dbraw/zinc/17/94/35/411179435.db2.gz GAKUQFYDPCRAQI-UHFFFAOYSA-N 1 2 233.271 2.023 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@H]1CC1(C)C ZINC000656111070 411180461 /nfs/dbraw/zinc/18/04/61/411180461.db2.gz CBPFJUIXADWVCU-QMMMGPOBSA-N 1 2 207.277 2.004 20 0 BEADLO Cc1noc(C[N@H+](Cc2ccccn2)C(C)C)n1 ZINC000048273239 411182591 /nfs/dbraw/zinc/18/25/91/411182591.db2.gz LXGCJPZSBZCEPT-UHFFFAOYSA-N 1 2 246.314 2.184 20 0 BEADLO Cc1noc(C[N@@H+](Cc2ccccn2)C(C)C)n1 ZINC000048273239 411182595 /nfs/dbraw/zinc/18/25/95/411182595.db2.gz LXGCJPZSBZCEPT-UHFFFAOYSA-N 1 2 246.314 2.184 20 0 BEADLO COc1c(C)[nH+]cnc1N1CCC(C)(C)C1 ZINC000656130055 411184059 /nfs/dbraw/zinc/18/40/59/411184059.db2.gz GXUDCHSWXVRSCY-UHFFFAOYSA-N 1 2 221.304 2.030 20 0 BEADLO CC[C@H]1CCN(c2nc[nH+]c(C)c2OC)C1 ZINC000656144996 411185121 /nfs/dbraw/zinc/18/51/21/411185121.db2.gz JRGRHJMLNCUWBT-JTQLQIEISA-N 1 2 221.304 2.030 20 0 BEADLO CCCCNC(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000117562658 411185198 /nfs/dbraw/zinc/18/51/98/411185198.db2.gz MFSZBDFGKYIZOQ-UHFFFAOYSA-N 1 2 243.310 2.402 20 0 BEADLO COc1c(C)[nH+]cnc1NCC1(C)CCC1 ZINC000656140352 411185283 /nfs/dbraw/zinc/18/52/83/411185283.db2.gz WQHUPKDKQBKQIM-UHFFFAOYSA-N 1 2 221.304 2.396 20 0 BEADLO COc1c(C)[nH+]cnc1N1CC[C@H](C)[C@@H]1C ZINC000656138182 411185596 /nfs/dbraw/zinc/18/55/96/411185596.db2.gz PFEXXPLUUIFOJW-WPRPVWTQSA-N 1 2 221.304 2.028 20 0 BEADLO CC[C@@]1(C)CCN(c2nc[nH+]c(C)c2OC)C1 ZINC000656146678 411186244 /nfs/dbraw/zinc/18/62/44/411186244.db2.gz JXPJXYYAUBJUFE-ZDUSSCGKSA-N 1 2 235.331 2.420 20 0 BEADLO COc1c(C)[nH+]cnc1N1C[C@H]2CCC[C@@H]2C1 ZINC000656146978 411186454 /nfs/dbraw/zinc/18/64/54/411186454.db2.gz RQPRJGVLSWTPEL-GHMZBOCLSA-N 1 2 233.315 2.030 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)C[C@H]1CCCC[C@H]1O ZINC000656152684 411186980 /nfs/dbraw/zinc/18/69/80/411186980.db2.gz CKINGXBBXUMSSP-CHWSQXEVSA-N 1 2 249.358 2.081 20 0 BEADLO FC(F)C[N@@H+]1CCC[C@H](OC2CCC2)C1 ZINC000653812239 411190063 /nfs/dbraw/zinc/19/00/63/411190063.db2.gz GIKANKJVSZUSMF-JTQLQIEISA-N 1 2 219.275 2.285 20 0 BEADLO FC(F)C[N@H+]1CCC[C@H](OC2CCC2)C1 ZINC000653812239 411190067 /nfs/dbraw/zinc/19/00/67/411190067.db2.gz GIKANKJVSZUSMF-JTQLQIEISA-N 1 2 219.275 2.285 20 0 BEADLO CC1(C)CCN(c2cc(CO)cc[nH+]2)CC1 ZINC000061821179 411191202 /nfs/dbraw/zinc/19/12/02/411191202.db2.gz RRUBIWBFNVXVIH-UHFFFAOYSA-N 1 2 220.316 2.200 20 0 BEADLO COc1c(C)[nH+]cnc1NC1CC(F)(F)C1 ZINC000656178783 411193565 /nfs/dbraw/zinc/19/35/65/411193565.db2.gz GBJBWEVTFVPKPV-UHFFFAOYSA-N 1 2 229.230 2.003 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccon1)c1ccncc1 ZINC000310002826 411194818 /nfs/dbraw/zinc/19/48/18/411194818.db2.gz FLABLFDDAOBZHJ-GFCCVEGCSA-N 1 2 217.272 2.311 20 0 BEADLO CC(C)(NC(=O)CCCn1cc[nH+]c1)C1CCC1 ZINC000653830150 411195713 /nfs/dbraw/zinc/19/57/13/411195713.db2.gz UNTWBGNLQFNJHV-UHFFFAOYSA-N 1 2 249.358 2.358 20 0 BEADLO Cc1ccc(C[N@H+]2CCOC[C@H]2C)c(F)c1 ZINC000639125921 411197112 /nfs/dbraw/zinc/19/71/12/411197112.db2.gz PPYXTEGKPMIUME-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ccc(C[N@@H+]2CCOC[C@H]2C)c(F)c1 ZINC000639125921 411197115 /nfs/dbraw/zinc/19/71/15/411197115.db2.gz PPYXTEGKPMIUME-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO COc1c(C)[nH+]cnc1N1CCC[C@@H](C2CC2)C1 ZINC000656188590 411197325 /nfs/dbraw/zinc/19/73/25/411197325.db2.gz CXFXNXWMTVMOLJ-GFCCVEGCSA-N 1 2 247.342 2.420 20 0 BEADLO CCCCOCC[N@H+](C)[C@@H](C)c1nc(C)no1 ZINC000653844250 411197746 /nfs/dbraw/zinc/19/77/46/411197746.db2.gz FGYBSBCWHWFZAJ-JTQLQIEISA-N 1 2 241.335 2.188 20 0 BEADLO CCCCOCC[N@@H+](C)[C@@H](C)c1nc(C)no1 ZINC000653844250 411197748 /nfs/dbraw/zinc/19/77/48/411197748.db2.gz FGYBSBCWHWFZAJ-JTQLQIEISA-N 1 2 241.335 2.188 20 0 BEADLO CCC[C@H](CNc1nc[nH+]c(C)c1OC)OC ZINC000656192629 411198690 /nfs/dbraw/zinc/19/86/90/411198690.db2.gz MHHYNWMVAFKAKS-SNVBAGLBSA-N 1 2 239.319 2.021 20 0 BEADLO Cc1cccnc1CCNc1nc(C)[nH+]cc1C ZINC000656196106 411200319 /nfs/dbraw/zinc/20/03/19/411200319.db2.gz ZFGYALLXNDXSEB-UHFFFAOYSA-N 1 2 242.326 2.451 20 0 BEADLO CC(C)n1ccnc1C[NH2+][C@H](C)c1cnn(C)c1 ZINC000273266178 167772445 /nfs/dbraw/zinc/77/24/45/167772445.db2.gz FOCHAJJQGMBNHV-LLVKDONJSA-N 1 2 247.346 2.048 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1C[C@H](C)n2ccnc21 ZINC000656196851 411201743 /nfs/dbraw/zinc/20/17/43/411201743.db2.gz OTXUFBQMIQIWQD-ONGXEEELSA-N 1 2 243.314 2.408 20 0 BEADLO COCc1cc[nH+]c(N[C@H](C)[C@H](C)OC)c1 ZINC000652330484 411202230 /nfs/dbraw/zinc/20/22/30/411202230.db2.gz HUJQIZFOXHZGIB-ZJUUUORDSA-N 1 2 224.304 2.063 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@H]1CS[C@@H](C)C1 ZINC000656202141 411206734 /nfs/dbraw/zinc/20/67/34/411206734.db2.gz USWKWRCESOHMLN-IONNQARKSA-N 1 2 239.344 2.100 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@H]1CCS[C@H]1C ZINC000656203592 411207502 /nfs/dbraw/zinc/20/75/02/411207502.db2.gz KNLIDEJXIWZEBX-IUCAKERBSA-N 1 2 239.344 2.100 20 0 BEADLO CCCN(c1cc(-n2cc[nH+]c2)ncn1)C(C)C ZINC000656207236 411208570 /nfs/dbraw/zinc/20/85/70/411208570.db2.gz CHPZJMDZWZPIQX-UHFFFAOYSA-N 1 2 245.330 2.287 20 0 BEADLO COc1c(C)[nH+]cnc1NCc1ccc(C)cn1 ZINC000656204200 411208622 /nfs/dbraw/zinc/20/86/22/411208622.db2.gz QXUOGJXKYMSASH-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO Cc1c[nH+]c(CCNc2cncc(C)n2)c(C)c1 ZINC000656211318 411210589 /nfs/dbraw/zinc/21/05/89/411210589.db2.gz VTTWJLRRLRFDGG-UHFFFAOYSA-N 1 2 242.326 2.451 20 0 BEADLO Cc1c[nH+]c(CCNc2nccnc2C)c(C)c1 ZINC000656210911 411210704 /nfs/dbraw/zinc/21/07/04/411210704.db2.gz KDAWULVBMAWMII-UHFFFAOYSA-N 1 2 242.326 2.451 20 0 BEADLO CCc1cc(N[C@@H](C)Cc2ccccn2)nc[nH+]1 ZINC000656221952 411213263 /nfs/dbraw/zinc/21/32/63/411213263.db2.gz YHPSFDCTGDFREY-NSHDSACASA-N 1 2 242.326 2.477 20 0 BEADLO CC1(C)CC[C@@H]1C(=O)Nc1ccc(N)[nH+]c1 ZINC000659293585 411215601 /nfs/dbraw/zinc/21/56/01/411215601.db2.gz FUVFDXVCDXBSOF-SECBINFHSA-N 1 2 219.288 2.039 20 0 BEADLO Cc1nc(C[NH2+][C@@H](C)c2cncnc2C)cs1 ZINC000655698131 411246808 /nfs/dbraw/zinc/24/68/08/411246808.db2.gz XCCXXQSAVLQDFX-QMMMGPOBSA-N 1 2 248.355 2.401 20 0 BEADLO C[C@H]([NH2+][C@H]1CCCn2ccnc21)c1ccccn1 ZINC000655684654 411226156 /nfs/dbraw/zinc/22/61/56/411226156.db2.gz UEQWWKZWNMWJPO-AAEUAGOBSA-N 1 2 242.326 2.464 20 0 BEADLO Nc1ccc(NC(=O)[C@@H]2CCC[C@@H]3C[C@@H]32)c[nH+]1 ZINC000659295763 411226851 /nfs/dbraw/zinc/22/68/51/411226851.db2.gz ZJRURTMSTHMOEB-IEBDPFPHSA-N 1 2 231.299 2.039 20 0 BEADLO CC/C=C(\C)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000360223506 167832108 /nfs/dbraw/zinc/83/21/08/167832108.db2.gz VVEXQUFPHWNDJA-YFTXEMMHSA-N 1 2 247.342 2.403 20 0 BEADLO CCc1ccc([C@H](C)[NH2+]Cc2cn(CC)nn2)o1 ZINC000658175409 411281866 /nfs/dbraw/zinc/28/18/66/411281866.db2.gz ACHJFEHBDMAZSC-JTQLQIEISA-N 1 2 248.330 2.304 20 0 BEADLO CC(=O)C[N@@H+](C)[C@H](C)c1ccccc1F ZINC000062015761 411283117 /nfs/dbraw/zinc/28/31/17/411283117.db2.gz NAOAIMRJRPIIAB-SNVBAGLBSA-N 1 2 209.264 2.408 20 0 BEADLO CC(=O)C[N@H+](C)[C@H](C)c1ccccc1F ZINC000062015761 411283118 /nfs/dbraw/zinc/28/31/18/411283118.db2.gz NAOAIMRJRPIIAB-SNVBAGLBSA-N 1 2 209.264 2.408 20 0 BEADLO Cc1nc(C[NH2+][C@H](CO)c2ccccc2)c(C)o1 ZINC000660177002 411283799 /nfs/dbraw/zinc/28/37/99/411283799.db2.gz ATPHQZBDNDHGAM-CQSZACIVSA-N 1 2 246.310 2.115 20 0 BEADLO Cc1ccc2c(c1)[C@H]([NH2+]Cc1cnccn1)CO2 ZINC000656507310 411287480 /nfs/dbraw/zinc/28/74/80/411287480.db2.gz GHYYABTXOPUJIF-CYBMUJFWSA-N 1 2 241.294 2.008 20 0 BEADLO CCc1cnc(C[NH+]2CC(C(F)F)C2)s1 ZINC000656690721 411330812 /nfs/dbraw/zinc/33/08/12/411330812.db2.gz OZNPVJWPQHJNBL-UHFFFAOYSA-N 1 2 232.299 2.402 20 0 BEADLO Cc1cn[nH]c1C[NH+]1CC(Cc2ccccc2)C1 ZINC000656651776 411316334 /nfs/dbraw/zinc/31/63/34/411316334.db2.gz WVHFUWHAUSTRBW-UHFFFAOYSA-N 1 2 241.338 2.393 20 0 BEADLO COc1cc(C)c(C)cc1[NH2+]CC[C@@H](C)O ZINC000656659656 411318477 /nfs/dbraw/zinc/31/84/77/411318477.db2.gz FZLLKLDOMWTTAY-LLVKDONJSA-N 1 2 223.316 2.495 20 0 BEADLO Cc1cc(NC(=O)NC2(C)CC=CC2)c(C)c[nH+]1 ZINC000654025808 411319551 /nfs/dbraw/zinc/31/95/51/411319551.db2.gz PKDSINSXKKMOPV-UHFFFAOYSA-N 1 2 245.326 2.351 20 0 BEADLO Fc1ccc(CC2C[NH+](Cc3cocn3)C2)cc1 ZINC000656669690 411320534 /nfs/dbraw/zinc/32/05/34/411320534.db2.gz YAFVIRAXTNUPCS-UHFFFAOYSA-N 1 2 246.285 2.488 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cccc(F)c2)CCO1 ZINC000045752501 411248804 /nfs/dbraw/zinc/24/88/04/411248804.db2.gz FEXCJIDRXFHPLL-ZDUSSCGKSA-N 1 2 223.291 2.437 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cccc(F)c2)CCO1 ZINC000045752501 411248807 /nfs/dbraw/zinc/24/88/07/411248807.db2.gz FEXCJIDRXFHPLL-ZDUSSCGKSA-N 1 2 223.291 2.437 20 0 BEADLO Cc1noc(C)c1C[NH2+][C@H]1CCCn2ccnc21 ZINC000655700506 411250660 /nfs/dbraw/zinc/25/06/60/411250660.db2.gz LKZUGOSDNQFWKV-LBPRGKRZSA-N 1 2 246.314 2.113 20 0 BEADLO CC[C@@H](N[C@@H]1CCCn2cc[nH+]c21)C(F)F ZINC000655771453 411253776 /nfs/dbraw/zinc/25/37/76/411253776.db2.gz LGGVOSWHBHXLIQ-RKDXNWHRSA-N 1 2 229.274 2.351 20 0 BEADLO COc1cc(C[N@H+](C)[C@H](C)c2ccncc2)on1 ZINC000660140174 411255774 /nfs/dbraw/zinc/25/57/74/411255774.db2.gz KBBZJWTYJPGGJG-SNVBAGLBSA-N 1 2 247.298 2.271 20 0 BEADLO COc1cc(C[N@@H+](C)[C@H](C)c2ccncc2)on1 ZINC000660140174 411255778 /nfs/dbraw/zinc/25/57/78/411255778.db2.gz KBBZJWTYJPGGJG-SNVBAGLBSA-N 1 2 247.298 2.271 20 0 BEADLO CO[C@H](C[N@H+](C)Cc1cscn1)C1CCC1 ZINC000659858884 411349943 /nfs/dbraw/zinc/34/99/43/411349943.db2.gz UQLRJJMXWRLKAK-GFCCVEGCSA-N 1 2 240.372 2.390 20 0 BEADLO CO[C@H](C[N@@H+](C)Cc1cscn1)C1CCC1 ZINC000659858884 411349945 /nfs/dbraw/zinc/34/99/45/411349945.db2.gz UQLRJJMXWRLKAK-GFCCVEGCSA-N 1 2 240.372 2.390 20 0 BEADLO Cc1cc[nH+]cc1Cc1nc([C@H]2C[C@@H]2C)no1 ZINC000656754605 411351632 /nfs/dbraw/zinc/35/16/32/411351632.db2.gz MOZQRIWBHAKNCH-ONGXEEELSA-N 1 2 229.283 2.487 20 0 BEADLO CC(C)c1cccc(C[N@@H+]2CCNC(=O)[C@@H]2C)c1 ZINC000659874166 411358834 /nfs/dbraw/zinc/35/88/34/411358834.db2.gz PTZKFTZYLPYKFW-LBPRGKRZSA-N 1 2 246.354 2.130 20 0 BEADLO CC(C)c1cccc(C[N@H+]2CCNC(=O)[C@@H]2C)c1 ZINC000659874166 411358836 /nfs/dbraw/zinc/35/88/36/411358836.db2.gz PTZKFTZYLPYKFW-LBPRGKRZSA-N 1 2 246.354 2.130 20 0 BEADLO Cc1[nH+]cccc1NCc1cc2n(n1)CCC2 ZINC000656767889 411362701 /nfs/dbraw/zinc/36/27/01/411362701.db2.gz FFGYFFDXWDCHCG-UHFFFAOYSA-N 1 2 228.299 2.145 20 0 BEADLO COc1ccc(NCc2[nH+]ccn2C(C)C)nc1 ZINC000656770758 411363665 /nfs/dbraw/zinc/36/36/65/411363665.db2.gz PNBSYPUCIADPGG-UHFFFAOYSA-N 1 2 246.314 2.480 20 0 BEADLO Cc1c[nH+]cc(NCc2cn(C3CCC3)nn2)c1 ZINC000656771643 411364168 /nfs/dbraw/zinc/36/41/68/411364168.db2.gz IZRFOJFKTBFCLW-UHFFFAOYSA-N 1 2 243.314 2.319 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1nccn1C)c1cncs1 ZINC000658337669 411344502 /nfs/dbraw/zinc/34/45/02/411344502.db2.gz VNLFIQNVAGCFFZ-IUCAKERBSA-N 1 2 236.344 2.288 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC(=O)CC23CCC3)cn1 ZINC000653765317 411345617 /nfs/dbraw/zinc/34/56/17/411345617.db2.gz OMDQCJGLCSNEDQ-UHFFFAOYSA-N 1 2 244.338 2.478 20 0 BEADLO Cc1ccc(C[N@H+]2CCC(=O)CC23CCC3)cn1 ZINC000653765317 411345620 /nfs/dbraw/zinc/34/56/20/411345620.db2.gz OMDQCJGLCSNEDQ-UHFFFAOYSA-N 1 2 244.338 2.478 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1nccn1C)c1ccc(F)cn1 ZINC000658338433 411345849 /nfs/dbraw/zinc/34/58/49/411345849.db2.gz XWKZAPOWOCJSDQ-ZJUUUORDSA-N 1 2 248.305 2.366 20 0 BEADLO CC1(CC(=O)NCc2c[nH+]c[nH]2)CCCCC1 ZINC000330386960 168017006 /nfs/dbraw/zinc/01/70/06/168017006.db2.gz AUFRELYPZNUCHS-UHFFFAOYSA-N 1 2 235.331 2.386 20 0 BEADLO CC1(CC(=O)NCc2c[nH]c[nH+]2)CCCCC1 ZINC000330386960 168017009 /nfs/dbraw/zinc/01/70/09/168017009.db2.gz AUFRELYPZNUCHS-UHFFFAOYSA-N 1 2 235.331 2.386 20 0 BEADLO CC1=CCC[N@@H+](Cc2nnc(C(C)C)[nH]2)C1 ZINC000292929218 168100355 /nfs/dbraw/zinc/10/03/55/168100355.db2.gz SXYQWECNXBXCJN-UHFFFAOYSA-N 1 2 220.320 2.080 20 0 BEADLO CC1=CCC[N@H+](Cc2nnc(C(C)C)[nH]2)C1 ZINC000292929218 168100358 /nfs/dbraw/zinc/10/03/58/168100358.db2.gz SXYQWECNXBXCJN-UHFFFAOYSA-N 1 2 220.320 2.080 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@H](C)C1CCCCC1 ZINC000425011229 411382062 /nfs/dbraw/zinc/38/20/62/411382062.db2.gz ZOESDHDZFDLWCP-SNVBAGLBSA-N 1 2 249.358 2.346 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@H](C)C1CCCCC1 ZINC000425011229 411382065 /nfs/dbraw/zinc/38/20/65/411382065.db2.gz ZOESDHDZFDLWCP-SNVBAGLBSA-N 1 2 249.358 2.346 20 0 BEADLO CCC(=CC(=O)NCCCn1cc[nH+]c1)CC ZINC000268423524 168193653 /nfs/dbraw/zinc/19/36/53/168193653.db2.gz LTJHEILRXOSVNZ-UHFFFAOYSA-N 1 2 235.331 2.136 20 0 BEADLO CCC(=O)N1CCC(CCCn2cc[nH+]c2)CC1 ZINC000341243777 168215319 /nfs/dbraw/zinc/21/53/19/168215319.db2.gz SMYOJJBITLZEAU-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO c1nn[nH]c1CC[N@@H+]1CCCC2(CCCCC2)C1 ZINC000659920816 411382585 /nfs/dbraw/zinc/38/25/85/411382585.db2.gz NHRYWKXNMFITMN-UHFFFAOYSA-N 1 2 248.374 2.394 20 0 BEADLO c1nn[nH]c1CC[N@H+]1CCCC2(CCCCC2)C1 ZINC000659920816 411382588 /nfs/dbraw/zinc/38/25/88/411382588.db2.gz NHRYWKXNMFITMN-UHFFFAOYSA-N 1 2 248.374 2.394 20 0 BEADLO CCC(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000039338893 168246632 /nfs/dbraw/zinc/24/66/32/168246632.db2.gz MBCXVWXNTBVVHB-UHFFFAOYSA-N 1 2 215.256 2.221 20 0 BEADLO CCC(=O)Oc1ccc2c(c1)[nH+]c(C)n2C ZINC000296020914 168251046 /nfs/dbraw/zinc/25/10/46/168251046.db2.gz GTFCDLRJJOSUTH-UHFFFAOYSA-N 1 2 218.256 2.197 20 0 BEADLO CCC(C)(C)C(=O)N(C)CCCn1cc[nH+]c1 ZINC000154930376 168261992 /nfs/dbraw/zinc/26/19/92/168261992.db2.gz KUGHSUFXNGJOOW-UHFFFAOYSA-N 1 2 237.347 2.168 20 0 BEADLO CO[C@H](COCc1[nH]cc[nH+]1)c1ccccc1 ZINC000282601336 411455326 /nfs/dbraw/zinc/45/53/26/411455326.db2.gz GCOGQBFJEZILAG-GFCCVEGCSA-N 1 2 232.283 2.314 20 0 BEADLO CCCn1nccc1CNc1cccc[nH+]1 ZINC000657319482 411460933 /nfs/dbraw/zinc/46/09/33/411460933.db2.gz GLYJXMFERTWHHE-UHFFFAOYSA-N 1 2 216.288 2.300 20 0 BEADLO Cc1cc(N[C@H]2CCS[C@H]2C)nc[nH+]1 ZINC000306925667 411462312 /nfs/dbraw/zinc/46/23/12/411462312.db2.gz NEAJNFCAYWGZRU-IUCAKERBSA-N 1 2 209.318 2.091 20 0 BEADLO CO[C@@H](Cn1cc[nH+]c1)C1CCCCC1 ZINC000657254960 411435600 /nfs/dbraw/zinc/43/56/00/411435600.db2.gz FZNLGZGNRILKKV-LBPRGKRZSA-N 1 2 208.305 2.478 20 0 BEADLO Cc1noc(C)c1[C@@H](C)NCc1[nH]c(C)c(C)[nH+]1 ZINC000657369118 411480386 /nfs/dbraw/zinc/48/03/86/411480386.db2.gz YTEQFXIMCGELJM-SECBINFHSA-N 1 2 248.330 2.482 20 0 BEADLO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1nc(C)c(C)[nH]1 ZINC000657369118 411480389 /nfs/dbraw/zinc/48/03/89/411480389.db2.gz YTEQFXIMCGELJM-SECBINFHSA-N 1 2 248.330 2.482 20 0 BEADLO Cc1c[nH]c(CNCc2nc(C3CC3)cs2)[nH+]1 ZINC000657399075 411495352 /nfs/dbraw/zinc/49/53/52/411495352.db2.gz HBPUDWQJXRKDLA-UHFFFAOYSA-N 1 2 248.355 2.342 20 0 BEADLO CCOc1cccc(NCc2[nH]cc(C)[nH+]2)n1 ZINC000657401587 411496498 /nfs/dbraw/zinc/49/64/98/411496498.db2.gz CVIBFARVRJPLFJ-UHFFFAOYSA-N 1 2 232.287 2.124 20 0 BEADLO CC[C@H]1C[C@H](Nc2c[nH+]cc(C)c2)CO1 ZINC000657412552 411498517 /nfs/dbraw/zinc/49/85/17/411498517.db2.gz GRYMUYWYYUFAGZ-RYUDHWBXSA-N 1 2 206.289 2.369 20 0 BEADLO Cc1[nH]c(CNc2cnccc2C)[nH+]c1C ZINC000657412288 411498600 /nfs/dbraw/zinc/49/86/00/411498600.db2.gz BEFJFSFSWSCLMY-UHFFFAOYSA-N 1 2 216.288 2.342 20 0 BEADLO CCc1nc(C)c(C[NH2+]Cc2nccs2)o1 ZINC000309487169 411498860 /nfs/dbraw/zinc/49/88/60/411498860.db2.gz VUEMXZZCPKFARI-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO C[N@H+](CC(=O)c1ccccc1F)C1CCC1 ZINC000127635364 411499212 /nfs/dbraw/zinc/49/92/12/411499212.db2.gz FLAHXNRBIYLEEO-UHFFFAOYSA-N 1 2 221.275 2.493 20 0 BEADLO C[N@@H+](CC(=O)c1ccccc1F)C1CCC1 ZINC000127635364 411499214 /nfs/dbraw/zinc/49/92/14/411499214.db2.gz FLAHXNRBIYLEEO-UHFFFAOYSA-N 1 2 221.275 2.493 20 0 BEADLO CCCn1nccc1C[NH2+]Cc1ncccc1F ZINC000657413443 411499695 /nfs/dbraw/zinc/49/96/95/411499695.db2.gz BSDNLKPDRIOPPK-UHFFFAOYSA-N 1 2 248.305 2.117 20 0 BEADLO Cc1c[nH]c(CNc2ccc3c(c2)COC3)[nH+]1 ZINC000657424116 411505293 /nfs/dbraw/zinc/50/52/93/411505293.db2.gz SXAXYBZZAPVOQK-UHFFFAOYSA-N 1 2 229.283 2.360 20 0 BEADLO COCC[C@H]([NH2+]Cc1nc(C)c[nH]1)c1ccco1 ZINC000657429152 411506571 /nfs/dbraw/zinc/50/65/71/411506571.db2.gz FKROLDPRWDKPHJ-NSHDSACASA-N 1 2 249.314 2.179 20 0 BEADLO Cc1c[nH]c(CNc2cnn([C@H](C)C3CC3)c2)[nH+]1 ZINC000657440141 411509114 /nfs/dbraw/zinc/50/91/14/411509114.db2.gz NSDMWDTYBRPFKC-SNVBAGLBSA-N 1 2 245.330 2.498 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@@H](C)S[C@@H](C)C2)co1 ZINC000659961520 411511889 /nfs/dbraw/zinc/51/18/89/411511889.db2.gz RMFHHXDRGIVNDP-DTORHVGOSA-N 1 2 226.345 2.309 20 0 BEADLO Cc1nc(C[N@H+]2C[C@@H](C)S[C@@H](C)C2)co1 ZINC000659961520 411511890 /nfs/dbraw/zinc/51/18/90/411511890.db2.gz RMFHHXDRGIVNDP-DTORHVGOSA-N 1 2 226.345 2.309 20 0 BEADLO CC(C)n1cc[nH+]c1CNC1(C(F)F)CC1 ZINC000657462918 411518122 /nfs/dbraw/zinc/51/81/22/411518122.db2.gz ZMSKWRVKMQETRO-UHFFFAOYSA-N 1 2 229.274 2.351 20 0 BEADLO Cc1c[nH]c(CNc2cccc3c2CCO3)[nH+]1 ZINC000657457010 411521188 /nfs/dbraw/zinc/52/11/88/411521188.db2.gz OPSCWCSCBXFSEF-UHFFFAOYSA-N 1 2 229.283 2.265 20 0 BEADLO Cc1[nH]c(CN[C@H]2CCCC2(F)F)[nH+]c1C ZINC000657466982 411521325 /nfs/dbraw/zinc/52/13/25/411521325.db2.gz DHGCHXPOIZWULY-VIFPVBQESA-N 1 2 229.274 2.304 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@@H]2c3ccccc3O[C@@H]2C)n1 ZINC000657469912 411522128 /nfs/dbraw/zinc/52/21/28/411522128.db2.gz XYWXQDUDNFDPKD-YGRLFVJLSA-N 1 2 243.310 2.330 20 0 BEADLO Cn1cnc(C[N@@H+]2CCC[C@@H]2c2ccccn2)c1 ZINC000659994288 411522403 /nfs/dbraw/zinc/52/24/03/411522403.db2.gz MWADFELMONSEGR-CQSZACIVSA-N 1 2 242.326 2.152 20 0 BEADLO Cn1cnc(C[N@H+]2CCC[C@@H]2c2ccccn2)c1 ZINC000659994288 411522404 /nfs/dbraw/zinc/52/24/04/411522404.db2.gz MWADFELMONSEGR-CQSZACIVSA-N 1 2 242.326 2.152 20 0 BEADLO Cn1ncc(C2CCC2)c1C[NH2+]CC(C)(F)F ZINC000657475423 411524667 /nfs/dbraw/zinc/52/46/67/411524667.db2.gz SLWOLNQJFZJPAW-UHFFFAOYSA-N 1 2 243.301 2.432 20 0 BEADLO CCc1nocc1C[N@@H+]1CCOC(C)(C)[C@H]1C ZINC000660005961 411526200 /nfs/dbraw/zinc/52/62/00/411526200.db2.gz HRGNHPVUVDNIJD-SNVBAGLBSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1nocc1C[N@H+]1CCOC(C)(C)[C@H]1C ZINC000660005961 411526202 /nfs/dbraw/zinc/52/62/02/411526202.db2.gz HRGNHPVUVDNIJD-SNVBAGLBSA-N 1 2 238.331 2.236 20 0 BEADLO Cc1[nH]c(CN[C@@H]2C[C@@H](C)n3ccnc32)[nH+]c1C ZINC000657483607 411528877 /nfs/dbraw/zinc/52/88/77/411528877.db2.gz MIZNYYPUSWIXBF-LDYMZIIASA-N 1 2 245.330 2.019 20 0 BEADLO CCOc1ccccc1C[NH2+]Cc1nc(C)c[nH]1 ZINC000657327009 411466157 /nfs/dbraw/zinc/46/61/57/411466157.db2.gz RLMOCHPAWGXIBN-UHFFFAOYSA-N 1 2 245.326 2.407 20 0 BEADLO CC[N@@H+]1C[C@H]([NH2+]CCc2ccsc2)[C@@H](C)C1 ZINC000336778779 170036024 /nfs/dbraw/zinc/03/60/24/170036024.db2.gz MIGQMSORBUHCAQ-AAEUAGOBSA-N 1 2 238.400 2.220 20 0 BEADLO CC(C)=CCC[N@@H+](C)Cc1noc(C)n1 ZINC000660217456 411555366 /nfs/dbraw/zinc/55/53/66/411555366.db2.gz WQSJMEWMMHBZHM-UHFFFAOYSA-N 1 2 209.293 2.166 20 0 BEADLO CC(C)=CCC[N@H+](C)Cc1noc(C)n1 ZINC000660217456 411555368 /nfs/dbraw/zinc/55/53/68/411555368.db2.gz WQSJMEWMMHBZHM-UHFFFAOYSA-N 1 2 209.293 2.166 20 0 BEADLO CCc1nc([C@@H](C)[NH+]2CCC3(CC3)CC2)n[nH]1 ZINC000660144556 411544888 /nfs/dbraw/zinc/54/48/88/411544888.db2.gz GQHMJMAPVJNDDI-SNVBAGLBSA-N 1 2 234.347 2.304 20 0 BEADLO CC[C@@]1(C)COCC[N@@H+]1Cc1nc(C)oc1C ZINC000660149352 411547028 /nfs/dbraw/zinc/54/70/28/411547028.db2.gz QMNXPJNMNPZRAL-ZDUSSCGKSA-N 1 2 238.331 2.292 20 0 BEADLO CC[C@@]1(C)COCC[N@H+]1Cc1nc(C)oc1C ZINC000660149352 411547029 /nfs/dbraw/zinc/54/70/29/411547029.db2.gz QMNXPJNMNPZRAL-ZDUSSCGKSA-N 1 2 238.331 2.292 20 0 BEADLO CCOC(=O)C[NH2+]C(C)(C)c1ccccc1C ZINC000292983281 170225181 /nfs/dbraw/zinc/22/51/81/170225181.db2.gz NIHJDJHRHYXEAB-UHFFFAOYSA-N 1 2 235.327 2.383 20 0 BEADLO CCOC(=O)C[NH2+][C@H](CC(F)(F)F)C(C)C ZINC000336779961 170227152 /nfs/dbraw/zinc/22/71/52/170227152.db2.gz PXXXGYOAIUIXKX-MRVPVSSYSA-N 1 2 241.253 2.116 20 0 BEADLO Cc1nc(C[NH2+][C@@H](C)c2ccccn2)co1 ZINC000660243661 411558131 /nfs/dbraw/zinc/55/81/31/411558131.db2.gz KCBBJAYRBVJQOW-VIFPVBQESA-N 1 2 217.272 2.229 20 0 BEADLO CCOC(=O)[C@@H](CC)[NH+]1Cc2ccccc2C1 ZINC000084120863 170250653 /nfs/dbraw/zinc/25/06/53/170250653.db2.gz MUBNHHJSSKMVMY-CYBMUJFWSA-N 1 2 233.311 2.344 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+](C)CCSC(C)C ZINC000338284217 170265394 /nfs/dbraw/zinc/26/53/94/170265394.db2.gz XYHMGYLDTVVDRM-JTQLQIEISA-N 1 2 233.377 2.011 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+](C)CCSC(C)C ZINC000338284217 170265396 /nfs/dbraw/zinc/26/53/96/170265396.db2.gz XYHMGYLDTVVDRM-JTQLQIEISA-N 1 2 233.377 2.011 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+]1CCc2ccsc2C1 ZINC000132576669 170267336 /nfs/dbraw/zinc/26/73/36/170267336.db2.gz STRGXBOUFQPTSG-VIFPVBQESA-N 1 2 239.340 2.058 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+]1CCc2ccsc2C1 ZINC000132576669 170267338 /nfs/dbraw/zinc/26/73/38/170267338.db2.gz STRGXBOUFQPTSG-VIFPVBQESA-N 1 2 239.340 2.058 20 0 BEADLO CCOC(=O)[C@H](CC)[N@H+](C)Cc1occc1C ZINC000271172542 170271839 /nfs/dbraw/zinc/27/18/39/170271839.db2.gz FMBXLPMONHIHMV-NSHDSACASA-N 1 2 239.315 2.362 20 0 BEADLO CCOC(=O)[C@H](CC)[N@@H+](C)Cc1occc1C ZINC000271172542 170271840 /nfs/dbraw/zinc/27/18/40/170271840.db2.gz FMBXLPMONHIHMV-NSHDSACASA-N 1 2 239.315 2.362 20 0 BEADLO CCOC(=O)[C@H]1CCCC[N@@H+]1C/C=C/Cl ZINC000071816380 170279773 /nfs/dbraw/zinc/27/97/73/170279773.db2.gz PNTLJWJZMNLNPB-BREXMAIKSA-N 1 2 231.723 2.157 20 0 BEADLO CCOC(=O)[C@H]1CCCC[N@H+]1C/C=C/Cl ZINC000071816380 170279775 /nfs/dbraw/zinc/27/97/75/170279775.db2.gz PNTLJWJZMNLNPB-BREXMAIKSA-N 1 2 231.723 2.157 20 0 BEADLO COc1ccnc(C[NH2+]Cc2ccco2)c1F ZINC000657673105 411575973 /nfs/dbraw/zinc/57/59/73/411575973.db2.gz MJNJWFZAJGOPDO-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)c(C)o1 ZINC000660373880 411574202 /nfs/dbraw/zinc/57/42/02/411574202.db2.gz CQJASJRVNQTQSW-AEJSXWLSSA-N 1 2 238.331 2.289 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)c(C)o1 ZINC000660373880 411574203 /nfs/dbraw/zinc/57/42/03/411574203.db2.gz CQJASJRVNQTQSW-AEJSXWLSSA-N 1 2 238.331 2.289 20 0 BEADLO CCOC1C[NH+](Cc2ccc(F)cc2C)C1 ZINC000297410948 170336819 /nfs/dbraw/zinc/33/68/19/170336819.db2.gz LLFNYGJEPWFEHW-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO CCOCC1(C(=O)Nc2ccc(C)[nH+]c2C)CC1 ZINC000282429113 170356918 /nfs/dbraw/zinc/35/69/18/170356918.db2.gz RFYWWXYTEWXRSJ-UHFFFAOYSA-N 1 2 248.326 2.454 20 0 BEADLO C[N@H+](CC1CC1)[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000660764346 411623120 /nfs/dbraw/zinc/62/31/20/411623120.db2.gz NGMYWTYKFAQECP-CYBMUJFWSA-N 1 2 242.326 2.236 20 0 BEADLO C[N@@H+](CC1CC1)[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000660764346 411623127 /nfs/dbraw/zinc/62/31/27/411623127.db2.gz NGMYWTYKFAQECP-CYBMUJFWSA-N 1 2 242.326 2.236 20 0 BEADLO C[N@H+](CC1CC1)[C@@H](c1nc[nH]n1)c1ccccc1 ZINC000660764346 411623130 /nfs/dbraw/zinc/62/31/30/411623130.db2.gz NGMYWTYKFAQECP-CYBMUJFWSA-N 1 2 242.326 2.236 20 0 BEADLO C[N@@H+](CC1CC1)[C@@H](c1nc[nH]n1)c1ccccc1 ZINC000660764346 411623132 /nfs/dbraw/zinc/62/31/32/411623132.db2.gz NGMYWTYKFAQECP-CYBMUJFWSA-N 1 2 242.326 2.236 20 0 BEADLO Oc1ccc2c(c1)[C@H]([NH2+]Cc1cocn1)CC2 ZINC000657693122 411580145 /nfs/dbraw/zinc/58/01/45/411580145.db2.gz JPKLRPSWQBHYAS-CYBMUJFWSA-N 1 2 230.267 2.157 20 0 BEADLO Cc1nc(C[N@H+]2CC(C)(C)OC[C@@H]2C)c(C)o1 ZINC000660407004 411580951 /nfs/dbraw/zinc/58/09/51/411580951.db2.gz LDJLRRXSXQCQME-VIFPVBQESA-N 1 2 238.331 2.291 20 0 BEADLO Cc1nc(C[N@@H+]2CC(C)(C)OC[C@@H]2C)c(C)o1 ZINC000660407004 411580952 /nfs/dbraw/zinc/58/09/52/411580952.db2.gz LDJLRRXSXQCQME-VIFPVBQESA-N 1 2 238.331 2.291 20 0 BEADLO Fc1ccc(C(F)(F)C[NH2+][C@H]2CCOC2)cc1 ZINC000657766464 411593170 /nfs/dbraw/zinc/59/31/70/411593170.db2.gz BSDMWIXWBDDQFM-NSHDSACASA-N 1 2 245.244 2.296 20 0 BEADLO Cc1ccccc1C(F)(F)C[NH2+][C@@H]1CCOC1 ZINC000657769724 411593858 /nfs/dbraw/zinc/59/38/58/411593858.db2.gz HOVAHVYDJKUFCO-LLVKDONJSA-N 1 2 241.281 2.465 20 0 BEADLO CCn1nncc1C[NH2+]CC(F)(F)C(C)(C)C ZINC000657792231 411598244 /nfs/dbraw/zinc/59/82/44/411598244.db2.gz HIKXSBBWHNBXJK-UHFFFAOYSA-N 1 2 246.305 2.069 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)co1 ZINC000660607329 411605660 /nfs/dbraw/zinc/60/56/60/411605660.db2.gz TUSSBXJMIVLMLE-MNOVXSKESA-N 1 2 242.269 2.460 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)co1 ZINC000660607329 411605661 /nfs/dbraw/zinc/60/56/61/411605661.db2.gz TUSSBXJMIVLMLE-MNOVXSKESA-N 1 2 242.269 2.460 20 0 BEADLO Cc1nc(C[NH2+][C@H]2CCCn3nccc32)cs1 ZINC000657845277 411611856 /nfs/dbraw/zinc/61/18/56/411611856.db2.gz UVYDODRAGNAXQK-NSHDSACASA-N 1 2 248.355 2.273 20 0 BEADLO CC(C)[N@H+](Cc1cc(C2CC2)no1)C1COC1 ZINC000660648144 411612323 /nfs/dbraw/zinc/61/23/23/411612323.db2.gz RFUZEWGIYAEDKD-UHFFFAOYSA-N 1 2 236.315 2.161 20 0 BEADLO CC(C)[N@@H+](Cc1cc(C2CC2)no1)C1COC1 ZINC000660648144 411612325 /nfs/dbraw/zinc/61/23/25/411612325.db2.gz RFUZEWGIYAEDKD-UHFFFAOYSA-N 1 2 236.315 2.161 20 0 BEADLO C[N@H+](CC1CC1)[C@H](c1nnc[nH]1)c1ccccc1 ZINC000660764347 411622579 /nfs/dbraw/zinc/62/25/79/411622579.db2.gz NGMYWTYKFAQECP-ZDUSSCGKSA-N 1 2 242.326 2.236 20 0 BEADLO C[N@@H+](CC1CC1)[C@H](c1nnc[nH]1)c1ccccc1 ZINC000660764347 411622580 /nfs/dbraw/zinc/62/25/80/411622580.db2.gz NGMYWTYKFAQECP-ZDUSSCGKSA-N 1 2 242.326 2.236 20 0 BEADLO C[N@H+](CC1CC1)[C@H](c1nc[nH]n1)c1ccccc1 ZINC000660764347 411622582 /nfs/dbraw/zinc/62/25/82/411622582.db2.gz NGMYWTYKFAQECP-ZDUSSCGKSA-N 1 2 242.326 2.236 20 0 BEADLO C[N@@H+](CC1CC1)[C@H](c1nc[nH]n1)c1ccccc1 ZINC000660764347 411622583 /nfs/dbraw/zinc/62/25/83/411622583.db2.gz NGMYWTYKFAQECP-ZDUSSCGKSA-N 1 2 242.326 2.236 20 0 BEADLO CC[C@@H](C)[N@H+](CC)Cc1nnn(C(C)(C)C)n1 ZINC000661102837 411707205 /nfs/dbraw/zinc/70/72/05/411707205.db2.gz AZHHGGRRLYXVFR-SNVBAGLBSA-N 1 2 239.367 2.049 20 0 BEADLO CC[C@@H](C)[N@@H+](CC)Cc1nnn(C(C)(C)C)n1 ZINC000661102837 411707208 /nfs/dbraw/zinc/70/72/08/411707208.db2.gz AZHHGGRRLYXVFR-SNVBAGLBSA-N 1 2 239.367 2.049 20 0 BEADLO CC[C@H](c1ccccc1)[N@H+](C)Cc1n[nH]c(=O)o1 ZINC000660850747 411657161 /nfs/dbraw/zinc/65/71/61/411657161.db2.gz XIIFDLOWTKWVEL-LLVKDONJSA-N 1 2 247.298 2.358 20 0 BEADLO CC[C@H](c1ccccc1)[N@@H+](C)Cc1n[nH]c(=O)o1 ZINC000660850747 411657163 /nfs/dbraw/zinc/65/71/63/411657163.db2.gz XIIFDLOWTKWVEL-LLVKDONJSA-N 1 2 247.298 2.358 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H](C)OC3(CCC3)C2)co1 ZINC000660907353 411667252 /nfs/dbraw/zinc/66/72/52/411667252.db2.gz XSXPJWWNGMCUAK-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H](C)OC3(CCC3)C2)co1 ZINC000660907353 411667255 /nfs/dbraw/zinc/66/72/55/411667255.db2.gz XSXPJWWNGMCUAK-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO CC(C)=CCC[N@H+]1CCOC[C@@H]1c1ccnn1C ZINC000660921209 411672001 /nfs/dbraw/zinc/67/20/01/411672001.db2.gz DKLYHKINYGMOTM-CQSZACIVSA-N 1 2 249.358 2.150 20 0 BEADLO CC(C)=CCC[N@@H+]1CCOC[C@@H]1c1ccnn1C ZINC000660921209 411672004 /nfs/dbraw/zinc/67/20/04/411672004.db2.gz DKLYHKINYGMOTM-CQSZACIVSA-N 1 2 249.358 2.150 20 0 BEADLO COc1ccc(F)cc1CN(C)Cc1c[nH+]c[nH]1 ZINC000661085263 411697898 /nfs/dbraw/zinc/69/78/98/411697898.db2.gz JBNWAMWOWZAJPQ-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO COCc1cccc(C[N@H+](C)Cc2cnc[nH]2)c1 ZINC000661088899 411699180 /nfs/dbraw/zinc/69/91/80/411699180.db2.gz PRWWQMYKZMAXKQ-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO COCc1cccc(C[N@@H+](C)Cc2cnc[nH]2)c1 ZINC000661088899 411699187 /nfs/dbraw/zinc/69/91/87/411699187.db2.gz PRWWQMYKZMAXKQ-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO COCc1cccc(C[N@H+](C)Cc2c[nH]cn2)c1 ZINC000661088899 411699190 /nfs/dbraw/zinc/69/91/90/411699190.db2.gz PRWWQMYKZMAXKQ-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO COCc1cccc(C[N@@H+](C)Cc2c[nH]cn2)c1 ZINC000661088899 411699196 /nfs/dbraw/zinc/69/91/96/411699196.db2.gz PRWWQMYKZMAXKQ-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO C[N@@H+](Cc1cnc[nH]1)C[C@H]1CCC2(CCCC2)O1 ZINC000661089996 411702781 /nfs/dbraw/zinc/70/27/81/411702781.db2.gz KQBHYGSXFISOQK-CYBMUJFWSA-N 1 2 249.358 2.333 20 0 BEADLO C[N@H+](Cc1cnc[nH]1)C[C@H]1CCC2(CCCC2)O1 ZINC000661089996 411702785 /nfs/dbraw/zinc/70/27/85/411702785.db2.gz KQBHYGSXFISOQK-CYBMUJFWSA-N 1 2 249.358 2.333 20 0 BEADLO C[N@@H+](Cc1c[nH]cn1)C[C@H]1CCC2(CCCC2)O1 ZINC000661089996 411702789 /nfs/dbraw/zinc/70/27/89/411702789.db2.gz KQBHYGSXFISOQK-CYBMUJFWSA-N 1 2 249.358 2.333 20 0 BEADLO C[N@H+](Cc1c[nH]cn1)C[C@H]1CCC2(CCCC2)O1 ZINC000661089996 411702791 /nfs/dbraw/zinc/70/27/91/411702791.db2.gz KQBHYGSXFISOQK-CYBMUJFWSA-N 1 2 249.358 2.333 20 0 BEADLO COC1(C)CN(c2[nH+]ccc3c(N)cccc32)C1 ZINC000663758306 411740763 /nfs/dbraw/zinc/74/07/63/411740763.db2.gz BOHTUWJEKUWJQM-UHFFFAOYSA-N 1 2 243.310 2.042 20 0 BEADLO CCOc1ccccc1NCc1c[nH+]cn1C ZINC000078780050 170595816 /nfs/dbraw/zinc/59/58/16/170595816.db2.gz ZMWQGYQPCWNWIL-UHFFFAOYSA-N 1 2 231.299 2.431 20 0 BEADLO COc1ccnc(C[NH2+][C@H](C)c2cscn2)c1 ZINC000661426314 411772870 /nfs/dbraw/zinc/77/28/70/411772870.db2.gz WTPPIFVRZGIFAX-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO Cc1cc(C[N@H+]2CC3(CCC3)OC[C@H]2C)no1 ZINC000661462816 411780075 /nfs/dbraw/zinc/78/00/75/411780075.db2.gz KOHUIMWBGOJKLH-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1cc(C[N@@H+]2CC3(CCC3)OC[C@H]2C)no1 ZINC000661462816 411780082 /nfs/dbraw/zinc/78/00/82/411780082.db2.gz KOHUIMWBGOJKLH-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO CC(C)[C@H]([NH2+]Cc1cnn[nH]1)c1ccccc1F ZINC000661482742 411785303 /nfs/dbraw/zinc/78/53/03/411785303.db2.gz CECLNBPMKKTWQS-ZDUSSCGKSA-N 1 2 248.305 2.431 20 0 BEADLO Cc1nc(N2CC[C@H]2C(F)F)c(C)c(C)[nH+]1 ZINC000663946133 411785838 /nfs/dbraw/zinc/78/58/38/411785838.db2.gz QPEQWZSJLYODGO-VIFPVBQESA-N 1 2 227.258 2.246 20 0 BEADLO CO[C@H]1CCN(c2[nH+]ccc3c(N)cccc32)C1 ZINC000663689989 411724119 /nfs/dbraw/zinc/72/41/19/411724119.db2.gz NPMLVOASPAPBTP-JTQLQIEISA-N 1 2 243.310 2.042 20 0 BEADLO C[C@]1(C2CC2)C[N@H+](Cc2nccs2)CCO1 ZINC000661167819 411726793 /nfs/dbraw/zinc/72/67/93/411726793.db2.gz KIHLMMFLHJFEEV-GFCCVEGCSA-N 1 2 238.356 2.144 20 0 BEADLO C[C@]1(C2CC2)C[N@@H+](Cc2nccs2)CCO1 ZINC000661167819 411726798 /nfs/dbraw/zinc/72/67/98/411726798.db2.gz KIHLMMFLHJFEEV-GFCCVEGCSA-N 1 2 238.356 2.144 20 0 BEADLO Cc1cnc(N[C@@H]2C[C@H](C)n3cc[nH+]c32)nc1 ZINC000663973016 411796633 /nfs/dbraw/zinc/79/66/33/411796633.db2.gz DGUPEMNKGZZGQB-VHSXEESVSA-N 1 2 229.287 2.099 20 0 BEADLO Cc1ccc(C[NH+]2C[C@@H](C)C(=O)[C@H](C)C2)c(C)n1 ZINC000661545484 411798868 /nfs/dbraw/zinc/79/88/68/411798868.db2.gz ZQDBZRKJHHXTRG-GHMZBOCLSA-N 1 2 246.354 2.355 20 0 BEADLO Cc1cccnc1C[NH+]1C[C@@H](C)C(=O)[C@H](C)C1 ZINC000661544988 411799123 /nfs/dbraw/zinc/79/91/23/411799123.db2.gz MXTUEYWORVSWRD-VXGBXAGGSA-N 1 2 232.327 2.047 20 0 BEADLO Cc1[nH+]c2cc(OCCC[C@H](C)O)ccc2n1C ZINC000664046425 411826985 /nfs/dbraw/zinc/82/69/85/411826985.db2.gz DLBVSHCWAQKGOR-JTQLQIEISA-N 1 2 248.326 2.422 20 0 BEADLO Cc1cnc(C[N@@H+](C)CC2=CCCOC2)s1 ZINC000661653176 411831011 /nfs/dbraw/zinc/83/10/11/411831011.db2.gz GKXUMNQKRMDORX-UHFFFAOYSA-N 1 2 238.356 2.230 20 0 BEADLO Cc1cnc(C[N@H+](C)CC2=CCCOC2)s1 ZINC000661653176 411831015 /nfs/dbraw/zinc/83/10/15/411831015.db2.gz GKXUMNQKRMDORX-UHFFFAOYSA-N 1 2 238.356 2.230 20 0 BEADLO COc1c(C)[nH+]cnc1N1C[C@@H]2CCCC[C@@H]21 ZINC000664080225 411843602 /nfs/dbraw/zinc/84/36/02/411843602.db2.gz OUQGYSHDBGKNLO-QWRGUYRKSA-N 1 2 233.315 2.172 20 0 BEADLO Cc1ncn(Cc2ccc(C(C)C)[nH+]c2C)n1 ZINC000664083886 411847186 /nfs/dbraw/zinc/84/71/86/411847186.db2.gz OOPZTYKHGKJZTN-UHFFFAOYSA-N 1 2 230.315 2.462 20 0 BEADLO CCc1cccc(C[N@H+](C)Cc2cn(C)nn2)c1 ZINC000661744610 411862046 /nfs/dbraw/zinc/86/20/46/411862046.db2.gz JJAFCFBTFQHITR-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO CCc1cccc(C[N@@H+](C)Cc2cn(C)nn2)c1 ZINC000661744610 411862049 /nfs/dbraw/zinc/86/20/49/411862049.db2.gz JJAFCFBTFQHITR-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO C[C@H](c1csnn1)[N@@H+]1CC[C@@H](C)O[C@@H](C)C1 ZINC000661852920 411902029 /nfs/dbraw/zinc/90/20/29/411902029.db2.gz LVAPMMCBDUTRKA-KXUCPTDWSA-N 1 2 241.360 2.098 20 0 BEADLO C[C@H](c1csnn1)[N@H+]1CC[C@@H](C)O[C@@H](C)C1 ZINC000661852920 411902030 /nfs/dbraw/zinc/90/20/30/411902030.db2.gz LVAPMMCBDUTRKA-KXUCPTDWSA-N 1 2 241.360 2.098 20 0 BEADLO CC[C@@H]([NH2+]CCF)c1nnc2n1CCCCC2 ZINC000661940275 411916911 /nfs/dbraw/zinc/91/69/11/411916911.db2.gz SFWASOXUKWIJJI-SNVBAGLBSA-N 1 2 240.326 2.015 20 0 BEADLO CC(C)(C)c1noc(C[N@@H+]2CC[C@@H]3C[C@@H]3C2)n1 ZINC000661978910 411934796 /nfs/dbraw/zinc/93/47/96/411934796.db2.gz SFVSBGKUMYNVOJ-NXEZZACHSA-N 1 2 235.331 2.209 20 0 BEADLO CC(C)(C)c1noc(C[N@H+]2CC[C@@H]3C[C@@H]3C2)n1 ZINC000661978910 411934801 /nfs/dbraw/zinc/93/48/01/411934801.db2.gz SFVSBGKUMYNVOJ-NXEZZACHSA-N 1 2 235.331 2.209 20 0 BEADLO Cc1nc(NC[C@H]2CCC[C@@H](C)O2)cc[nH+]1 ZINC000664393786 411940259 /nfs/dbraw/zinc/94/02/59/411940259.db2.gz HSNIEZBNYFYSQI-MWLCHTKSSA-N 1 2 221.304 2.155 20 0 BEADLO Cc1cc(NC[C@@H](C)c2ccccn2)nc[nH+]1 ZINC000664145933 411871874 /nfs/dbraw/zinc/87/18/74/411871874.db2.gz MJBZRVCKBMRYSD-SNVBAGLBSA-N 1 2 228.299 2.396 20 0 BEADLO Cc1cc(NC[C@H](C)c2ccccn2)nc[nH+]1 ZINC000664145931 411871918 /nfs/dbraw/zinc/87/19/18/411871918.db2.gz MJBZRVCKBMRYSD-JTQLQIEISA-N 1 2 228.299 2.396 20 0 BEADLO Cc1cc(N[C@H](CO)C2CCC2)nc(C2CC2)[nH+]1 ZINC000664170869 411877817 /nfs/dbraw/zinc/87/78/17/411877817.db2.gz JCXMVOMZWNHBBA-GFCCVEGCSA-N 1 2 247.342 2.235 20 0 BEADLO CC(C)(C)c1nc(N[C@@H](CO)C2CCC2)cc[nH+]1 ZINC000664170995 411878181 /nfs/dbraw/zinc/87/81/81/411878181.db2.gz KEMUVMXBNTWBSS-NSHDSACASA-N 1 2 249.358 2.347 20 0 BEADLO Cc1cc(N[C@@H](CO)C2CCC2)nc(C2CC2)[nH+]1 ZINC000664170870 411878211 /nfs/dbraw/zinc/87/82/11/411878211.db2.gz JCXMVOMZWNHBBA-LBPRGKRZSA-N 1 2 247.342 2.235 20 0 BEADLO C[C@]1(C2CC2)CN(c2cccc[nH+]2)CCO1 ZINC000664176017 411881659 /nfs/dbraw/zinc/88/16/59/411881659.db2.gz DLRRFUHOQRFKDK-CYBMUJFWSA-N 1 2 218.300 2.087 20 0 BEADLO Cc1nc(NC[C@@H]2C(C)(C)C2(F)F)cc[nH+]1 ZINC000664522222 411974878 /nfs/dbraw/zinc/97/48/78/411974878.db2.gz BAHVXKJKJCQHTI-MRVPVSSYSA-N 1 2 227.258 2.488 20 0 BEADLO c1ccc2[nH+]c(N3CC[C@H]4C[C@H]4C3)[nH]c2c1 ZINC000664526149 411977516 /nfs/dbraw/zinc/97/75/16/411977516.db2.gz TWSKUHZNGPDESY-UWVGGRQHSA-N 1 2 213.284 2.409 20 0 BEADLO C[C@@H]1CN(c2[nH]c3ccccc3[nH+]2)C[C@]1(C)CO ZINC000664597404 411994029 /nfs/dbraw/zinc/99/40/29/411994029.db2.gz ZZPBWYAKNQFMSF-QMTHXVAHSA-N 1 2 245.326 2.018 20 0 BEADLO Cc1cc(NC[C@H]2CCOC2(C)C)nc[nH+]1 ZINC000664601974 411995434 /nfs/dbraw/zinc/99/54/34/411995434.db2.gz DREOOCNKYZKCBB-SNVBAGLBSA-N 1 2 221.304 2.012 20 0 BEADLO COc1cccc2c1cc[nH+]c2N[C@H]1C[C@H](O)C1 ZINC000664642536 412003632 /nfs/dbraw/zinc/00/36/32/412003632.db2.gz VJKZYBUNBGWRFA-MGCOHNPYSA-N 1 2 244.294 2.179 20 0 BEADLO C[C@H]1CN(c2cccc[nH+]2)C[C@](C)(C(F)F)O1 ZINC000664691270 412010118 /nfs/dbraw/zinc/01/01/18/412010118.db2.gz WXWOVIOGUDQIMT-JOYOIKCWSA-N 1 2 242.269 2.331 20 0 BEADLO Cc1nc(N2CC3CC2(C)C3)c(C)c(C)[nH+]1 ZINC000664693789 412012151 /nfs/dbraw/zinc/01/21/51/412012151.db2.gz OWRAHOSGNJQKIH-UHFFFAOYSA-N 1 2 217.316 2.391 20 0 BEADLO CCC/C=C/c1nc(Cc2c[nH+]cn2C)no1 ZINC000664824463 412026842 /nfs/dbraw/zinc/02/68/42/412026842.db2.gz NESYAWWKSMZKMT-AATRIKPKSA-N 1 2 232.287 2.207 20 0 BEADLO Cc1cnc(C[N@@H+]2CCCc3n[nH]cc3C2)s1 ZINC000664861621 412034322 /nfs/dbraw/zinc/03/43/22/412034322.db2.gz AHTHIKNECXLAIN-UHFFFAOYSA-N 1 2 248.355 2.123 20 0 BEADLO Cc1cnc(C[N@H+]2CCCc3n[nH]cc3C2)s1 ZINC000664861621 412034327 /nfs/dbraw/zinc/03/43/27/412034327.db2.gz AHTHIKNECXLAIN-UHFFFAOYSA-N 1 2 248.355 2.123 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+](C)CC2=CCSC2)o1 ZINC000662269356 412059646 /nfs/dbraw/zinc/05/96/46/412059646.db2.gz DAJQTQOXJKZPSJ-MRVPVSSYSA-N 1 2 239.344 2.044 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+](C)CC2=CCSC2)o1 ZINC000662269356 412059650 /nfs/dbraw/zinc/05/96/50/412059650.db2.gz DAJQTQOXJKZPSJ-MRVPVSSYSA-N 1 2 239.344 2.044 20 0 BEADLO Cc1nnc(C[N@H+](C)CCCCCF)s1 ZINC000662256065 412051080 /nfs/dbraw/zinc/05/10/80/412051080.db2.gz JGQUAYMKDCVYKL-UHFFFAOYSA-N 1 2 231.340 2.418 20 0 BEADLO Cc1nnc(C[N@@H+](C)CCCCCF)s1 ZINC000662256065 412051082 /nfs/dbraw/zinc/05/10/82/412051082.db2.gz JGQUAYMKDCVYKL-UHFFFAOYSA-N 1 2 231.340 2.418 20 0 BEADLO CO[C@@H](C)c1nc(Cc2c[nH+]ccc2C)no1 ZINC000664980221 412055330 /nfs/dbraw/zinc/05/53/30/412055330.db2.gz FOHNQPQNLFYTLP-VIFPVBQESA-N 1 2 233.271 2.071 20 0 BEADLO Cc1ccc(Cc2noc(C[NH+](C)C)n2)cc1C ZINC000665014283 412058119 /nfs/dbraw/zinc/05/81/19/412058119.db2.gz CQMHQRUPKORIQA-UHFFFAOYSA-N 1 2 245.326 2.339 20 0 BEADLO CC[C@@H]1CCC[C@H]1NC(=O)c1c[nH+]c(C)[nH]1 ZINC000268270898 171000023 /nfs/dbraw/zinc/00/00/23/171000023.db2.gz SNTOWPCZNLQUHL-NXEZZACHSA-N 1 2 221.304 2.027 20 0 BEADLO CC[C@@H]1CCN(c2cc(N3CCCC3)[nH+]cn2)C1 ZINC000277273599 171014172 /nfs/dbraw/zinc/01/41/72/171014172.db2.gz AATZDABVUHNNJJ-GFCCVEGCSA-N 1 2 246.358 2.313 20 0 BEADLO CC[C@@H]1CCN(c2cc(N3CCCC3)nc[nH+]2)C1 ZINC000277273599 171014176 /nfs/dbraw/zinc/01/41/76/171014176.db2.gz AATZDABVUHNNJJ-GFCCVEGCSA-N 1 2 246.358 2.313 20 0 BEADLO CC[C@@H]1CCN1C(=O)Nc1cc[nH+]cc1C ZINC000297851396 171019863 /nfs/dbraw/zinc/01/98/63/171019863.db2.gz STMIEHAOTPDHQK-SNVBAGLBSA-N 1 2 219.288 2.406 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1C(=O)CCn1cc[nH+]c1 ZINC000357175324 171033703 /nfs/dbraw/zinc/03/37/03/171033703.db2.gz LTXNTKVOSLGASE-VXGBXAGGSA-N 1 2 235.331 2.063 20 0 BEADLO CCC[N@H+](C)Cc1nc([C@@H](CC)OCC)no1 ZINC000665037495 412062541 /nfs/dbraw/zinc/06/25/41/412062541.db2.gz AVXOBTQHCYEUKR-SNVBAGLBSA-N 1 2 241.335 2.399 20 0 BEADLO CCC[N@@H+](C)Cc1nc([C@@H](CC)OCC)no1 ZINC000665037495 412062544 /nfs/dbraw/zinc/06/25/44/412062544.db2.gz AVXOBTQHCYEUKR-SNVBAGLBSA-N 1 2 241.335 2.399 20 0 BEADLO CC[C@@H]1CN(c2cc(C)[nH+]c(C(C)C)n2)C[C@@H]1O ZINC000340574593 171097784 /nfs/dbraw/zinc/09/77/84/171097784.db2.gz PCOSISAITVMFAO-NEPJUHHUSA-N 1 2 249.358 2.116 20 0 BEADLO CC[C@@H]1CN(c2nc(C)[nH+]c(C)c2C)CCCO1 ZINC000341379031 171098114 /nfs/dbraw/zinc/09/81/14/171098114.db2.gz DOJJBUSPGHXLLK-CYBMUJFWSA-N 1 2 249.358 2.407 20 0 BEADLO CC[C@@H]1CN(c2[nH]c3ccccc3[nH+]2)CCO1 ZINC000179281324 171098164 /nfs/dbraw/zinc/09/81/64/171098164.db2.gz GFIGICFNCWDKSW-SNVBAGLBSA-N 1 2 231.299 2.178 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1ccc(C)cn1 ZINC000119843304 171105632 /nfs/dbraw/zinc/10/56/32/171105632.db2.gz GOGRJRHMQQKKIS-CYBMUJFWSA-N 1 2 220.316 2.001 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1ccc(C)cn1 ZINC000119843304 171105635 /nfs/dbraw/zinc/10/56/35/171105635.db2.gz GOGRJRHMQQKKIS-CYBMUJFWSA-N 1 2 220.316 2.001 20 0 BEADLO CC[C@@H]1C[C@H]1NC(=O)Nc1cc[nH+]cc1C ZINC000280793481 171138577 /nfs/dbraw/zinc/13/85/77/171138577.db2.gz XLVJHVLVYLVYAH-MWLCHTKSSA-N 1 2 219.288 2.310 20 0 BEADLO CCc1cn(C[C@H](COC)C(C)C)c[nH+]1 ZINC001652207989 1173043946 /nfs/dbraw/zinc/04/39/46/1173043946.db2.gz MINOVCUWRXAYER-LLVKDONJSA-N 1 2 210.321 2.364 20 0 BEADLO CC[C@@H]1[C@@H](C)CCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000283016521 171154293 /nfs/dbraw/zinc/15/42/93/171154293.db2.gz HNIKPECGYBQFLY-KOBKQOIESA-N 1 2 233.315 2.070 20 0 BEADLO CC[C@@H]1[C@@H](C)CCN1c1cc(C)[nH+]cn1 ZINC000302465125 171157474 /nfs/dbraw/zinc/15/74/74/171157474.db2.gz VTRCQWKSTWVEDB-GXSJLCMTSA-N 1 2 205.305 2.410 20 0 BEADLO CC[C@@](C)(CO)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000267738397 171171323 /nfs/dbraw/zinc/17/13/23/171171323.db2.gz VBSUQWRYKHYXES-ZDUSSCGKSA-N 1 2 235.331 2.235 20 0 BEADLO CC[C@@](C)(OC)C(=O)Nc1cccc2[nH+]ccn21 ZINC000280392060 171190954 /nfs/dbraw/zinc/19/09/54/171190954.db2.gz QNUCLPVNUATWAE-CYBMUJFWSA-N 1 2 247.298 2.088 20 0 BEADLO CC[C@@]1(C)CCN(C(=O)CCc2c[nH+]cn2C)C1 ZINC000339163459 171201350 /nfs/dbraw/zinc/20/13/50/171201350.db2.gz NYAVEQISSYRFSV-AWEZNQCLSA-N 1 2 249.358 2.001 20 0 BEADLO CC[C@H](C)C(=O)NCc1cn2cc(C)ccc2[nH+]1 ZINC000298990902 171252060 /nfs/dbraw/zinc/25/20/60/171252060.db2.gz PAAGBMHDNQWQDS-NSHDSACASA-N 1 2 245.326 2.305 20 0 BEADLO CC[C@H](C)C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000125339350 171253005 /nfs/dbraw/zinc/25/30/05/171253005.db2.gz QXMLJJMLUYPPRE-IUCAKERBSA-N 1 2 209.293 2.023 20 0 BEADLO CC(C)[C@@H](Nc1[nH+]cnc2c1cnn2C)C1CC1 ZINC000324479677 487621912 /nfs/dbraw/zinc/62/19/12/487621912.db2.gz BQQGKSSAMAVEFP-LLVKDONJSA-N 1 2 245.330 2.210 20 0 BEADLO CC[C@H](C)CCC(=O)N(C)Cc1[nH+]ccn1C ZINC000285118581 171263594 /nfs/dbraw/zinc/26/35/94/171263594.db2.gz PSLMREDMSKRTFK-NSHDSACASA-N 1 2 237.347 2.205 20 0 BEADLO CC[C@H](C)CC(=O)Nc1c[nH+]ccc1OC ZINC000190802441 171263846 /nfs/dbraw/zinc/26/38/46/171263846.db2.gz WKNADIHQMNZDPY-VIFPVBQESA-N 1 2 222.288 2.465 20 0 BEADLO CC[C@H](C)NC(=O)Nc1cc[nH+]c(C)c1 ZINC000074621726 171331152 /nfs/dbraw/zinc/33/11/52/171331152.db2.gz BHHRWKAMZLPOKR-QMMMGPOBSA-N 1 2 207.277 2.310 20 0 BEADLO CC[C@H](C)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000027987500 171350378 /nfs/dbraw/zinc/35/03/78/171350378.db2.gz FOGJYZUJUZRZHI-ZETCQYMHSA-N 1 2 204.277 2.477 20 0 BEADLO CC[C@H](C)OCC(=O)Nc1cccc2[nH+]ccn21 ZINC000269818810 171354850 /nfs/dbraw/zinc/35/48/50/171354850.db2.gz FXUATDXCMJQZNP-JTQLQIEISA-N 1 2 247.298 2.088 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)N(C)Cc1[nH+]ccn1C ZINC000272517050 171357786 /nfs/dbraw/zinc/35/77/86/171357786.db2.gz WXBLSUHBVQWHAP-WDEREUQCSA-N 1 2 237.347 2.061 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000356808146 171385453 /nfs/dbraw/zinc/38/54/53/171385453.db2.gz XJRFWGREDJTPFR-DCAQKATOSA-N 1 2 249.358 2.065 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000356808146 171385454 /nfs/dbraw/zinc/38/54/54/171385454.db2.gz XJRFWGREDJTPFR-DCAQKATOSA-N 1 2 249.358 2.065 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000330944734 171387582 /nfs/dbraw/zinc/38/75/82/171387582.db2.gz GMRYTUWBHXSLRZ-GARJFASQSA-N 1 2 249.358 2.380 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)[C@@H]1CCCc2[nH]c[nH+]c21 ZINC000330944734 171387583 /nfs/dbraw/zinc/38/75/83/171387583.db2.gz GMRYTUWBHXSLRZ-GARJFASQSA-N 1 2 249.358 2.380 20 0 BEADLO CCCOc1cncc(-c2[nH]cc[nH+]2)c1 ZINC000665188679 412123411 /nfs/dbraw/zinc/12/34/11/412123411.db2.gz WTGOFRBWHOWUAC-UHFFFAOYSA-N 1 2 203.245 2.261 20 0 BEADLO CCCOc1cncc(-c2c[nH]c[nH+]2)c1 ZINC000665187960 412123898 /nfs/dbraw/zinc/12/38/98/412123898.db2.gz MPWWYRVVSWSJMT-UHFFFAOYSA-N 1 2 203.245 2.261 20 0 BEADLO CCCn1nc(C)c(-c2c[nH]c[nH+]2)c1C ZINC000665193576 412126638 /nfs/dbraw/zinc/12/66/38/412126638.db2.gz CPCAUQREQSYMHK-UHFFFAOYSA-N 1 2 204.277 2.300 20 0 BEADLO CCCCc1nc(C[N@@H+]2CC3CC2(C)C3)no1 ZINC000662381960 412133865 /nfs/dbraw/zinc/13/38/65/412133865.db2.gz LAVUEQOOMCJIDQ-UHFFFAOYSA-N 1 2 235.331 2.397 20 0 BEADLO CCCCc1nc(C[N@H+]2CC3CC2(C)C3)no1 ZINC000662381960 412133868 /nfs/dbraw/zinc/13/38/68/412133868.db2.gz LAVUEQOOMCJIDQ-UHFFFAOYSA-N 1 2 235.331 2.397 20 0 BEADLO CCc1cn(CC(=O)c2cccs2)c[nH+]1 ZINC001652208198 1173044820 /nfs/dbraw/zinc/04/48/20/1173044820.db2.gz VSHBBMDFXFGOOX-UHFFFAOYSA-N 1 2 220.297 2.390 20 0 BEADLO CCc1cnc(C[NH+]2CC3(CC3)C2)s1 ZINC000335382911 487622814 /nfs/dbraw/zinc/62/28/14/487622814.db2.gz KRXVCFOYMAROJJ-UHFFFAOYSA-N 1 2 208.330 2.301 20 0 BEADLO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccncc2)[nH]1 ZINC000358245269 172002359 /nfs/dbraw/zinc/00/23/59/172002359.db2.gz HJSNBSHBQURGBE-VHSXEESVSA-N 1 2 245.330 2.174 20 0 BEADLO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2ccncc2)[nH]1 ZINC000358245264 172006747 /nfs/dbraw/zinc/00/67/47/172006747.db2.gz HJSNBSHBQURGBE-UWVGGRQHSA-N 1 2 245.330 2.174 20 0 BEADLO CCc1nnc([C@H](C)[NH2+][C@H](C)c2ccco2)[nH]1 ZINC000271502189 172007917 /nfs/dbraw/zinc/00/79/17/172007917.db2.gz MEPNXTWBPMTDQM-BDAKNGLRSA-N 1 2 234.303 2.372 20 0 BEADLO CCc1nnc(C[NH2+][C@H](C)c2ccccc2)o1 ZINC000182053059 172053104 /nfs/dbraw/zinc/05/31/04/172053104.db2.gz AROWQFUEANACOD-SNVBAGLBSA-N 1 2 231.299 2.483 20 0 BEADLO CCc1noc([C@H](C)[N@@H+]2C[C@@H](C)[C@H]2C)n1 ZINC000339567466 172090761 /nfs/dbraw/zinc/09/07/61/172090761.db2.gz JAPZASPBJLHXGX-HLTSFMKQSA-N 1 2 209.293 2.033 20 0 BEADLO CCc1noc([C@H](C)[N@H+]2C[C@@H](C)[C@H]2C)n1 ZINC000339567466 172090764 /nfs/dbraw/zinc/09/07/64/172090764.db2.gz JAPZASPBJLHXGX-HLTSFMKQSA-N 1 2 209.293 2.033 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1cc(C)no1 ZINC000293497674 172094236 /nfs/dbraw/zinc/09/42/36/172094236.db2.gz UESMYTFBJJXBEE-UHFFFAOYSA-N 1 2 235.287 2.165 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1cc(C)no1 ZINC000293497674 172094240 /nfs/dbraw/zinc/09/42/40/172094240.db2.gz UESMYTFBJJXBEE-UHFFFAOYSA-N 1 2 235.287 2.165 20 0 BEADLO CCn1cc(CNc2c[nH+]cc(C)c2)cn1 ZINC000119590548 172175836 /nfs/dbraw/zinc/17/58/36/172175836.db2.gz KAUSKLCDSQUZEQ-UHFFFAOYSA-N 1 2 216.288 2.219 20 0 BEADLO CCn1cc(CNc2cc[nH+]c(C3CC3)n2)cn1 ZINC000286266879 172176414 /nfs/dbraw/zinc/17/64/14/172176414.db2.gz FZZFWHHDYDDCKN-UHFFFAOYSA-N 1 2 243.314 2.183 20 0 BEADLO CCn1cc(N[C@@H](C)c2[nH+]ccn2CC)cn1 ZINC000297031598 172186873 /nfs/dbraw/zinc/18/68/73/172186873.db2.gz UTRRGKPSUYLSIH-JTQLQIEISA-N 1 2 233.319 2.293 20 0 BEADLO CCn1cc([C@@H](C)[NH2+]Cc2cc(C)on2)cn1 ZINC000044693413 172194315 /nfs/dbraw/zinc/19/43/15/172194315.db2.gz QQBJPMJTTIXPFG-SNVBAGLBSA-N 1 2 234.303 2.050 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C1(C)CCCC1 ZINC000297327616 172222710 /nfs/dbraw/zinc/22/27/10/172222710.db2.gz WNRFAWWLIBCLSY-UHFFFAOYSA-N 1 2 235.331 2.100 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)c1ccccc1C ZINC000295903777 172223228 /nfs/dbraw/zinc/22/32/28/172223228.db2.gz ZXKZHXKDAZVERQ-UHFFFAOYSA-N 1 2 243.310 2.141 20 0 BEADLO CCn1ccnc1C[NH2+][C@H](C)c1ccncc1F ZINC000337944371 172223922 /nfs/dbraw/zinc/22/39/22/172223922.db2.gz GYZOFVXFTFCQMM-SNVBAGLBSA-N 1 2 248.305 2.288 20 0 BEADLO CCn1cnnc1C[NH2+][C@@H](C)c1cc(C)oc1C ZINC000219256896 172237089 /nfs/dbraw/zinc/23/70/89/172237089.db2.gz CKHJJJYQNCTOIU-JTQLQIEISA-N 1 2 248.330 2.359 20 0 BEADLO CCn1nccc1C[N@H+](C)[C@H](C)c1ccncc1 ZINC000183713250 172263954 /nfs/dbraw/zinc/26/39/54/172263954.db2.gz BXDJKIXMAMGVEV-GFCCVEGCSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1nccc1C[N@@H+](C)[C@H](C)c1ccncc1 ZINC000183713250 172263955 /nfs/dbraw/zinc/26/39/55/172263955.db2.gz BXDJKIXMAMGVEV-GFCCVEGCSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1nccc1C[N@@H+]1CCC[C@](C)(F)C1 ZINC000296040348 172267272 /nfs/dbraw/zinc/26/72/72/172267272.db2.gz OAOVNNPSDXYNOY-LBPRGKRZSA-N 1 2 225.311 2.227 20 0 BEADLO CCn1nccc1C[N@H+]1CCC[C@](C)(F)C1 ZINC000296040348 172267275 /nfs/dbraw/zinc/26/72/75/172267275.db2.gz OAOVNNPSDXYNOY-LBPRGKRZSA-N 1 2 225.311 2.227 20 0 BEADLO CCn1ncnc1C[NH2+]Cc1ccc(C)c(F)c1 ZINC000355600314 172282536 /nfs/dbraw/zinc/28/25/36/172282536.db2.gz PMPBCYVYNJQCQB-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO CN(C)C(=O)C[C@@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000341196719 172375468 /nfs/dbraw/zinc/37/54/68/172375468.db2.gz QUVHNICHZUQPIU-GFCCVEGCSA-N 1 2 243.310 2.020 20 0 BEADLO CN(C)C(=O)[C@@H]1CCC[C@H](Nc2cccc[nH+]2)C1 ZINC000265138682 172385550 /nfs/dbraw/zinc/38/55/50/172385550.db2.gz PQIOEEWMFQENKK-NEPJUHHUSA-N 1 2 247.342 2.141 20 0 BEADLO Fc1cccc(F)c1CC[NH2+]Cc1ccn[nH]1 ZINC000066973434 1173057240 /nfs/dbraw/zinc/05/72/40/1173057240.db2.gz MTFSGIIUEOIJJC-UHFFFAOYSA-N 1 2 237.253 2.020 20 0 BEADLO C[NH2+]Cc1noc([C@H]2CCCC2(C)C)n1 ZINC000226694327 173399482 /nfs/dbraw/zinc/39/94/82/173399482.db2.gz KUZNFPSUSPFCGI-MRVPVSSYSA-N 1 2 209.293 2.083 20 0 BEADLO C[NH2+]Cc1noc(CCC2CCCCC2)n1 ZINC000051848710 173399956 /nfs/dbraw/zinc/39/99/56/173399956.db2.gz IQZVOPLGPHQWMK-UHFFFAOYSA-N 1 2 223.320 2.302 20 0 BEADLO Fc1ccccc1OCCC[NH2+]Cc1ccn[nH]1 ZINC000066972716 1173059831 /nfs/dbraw/zinc/05/98/31/1173059831.db2.gz JBHDGMWWGQPHGB-UHFFFAOYSA-N 1 2 249.289 2.108 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H](C)CCc1ccsc1 ZINC000336760317 173786624 /nfs/dbraw/zinc/78/66/24/173786624.db2.gz JOXXCHFORZBSQD-UWVGGRQHSA-N 1 2 241.356 2.220 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@H]1CS[C@@H](C(C)(C)C)C1 ZINC000309578228 173788104 /nfs/dbraw/zinc/78/81/04/173788104.db2.gz POMAPUZLIXQZPH-IVZWLZJFSA-N 1 2 245.388 2.058 20 0 BEADLO COC1C[NH+](Cc2cccc(OC(F)F)c2)C1 ZINC000358453742 174035734 /nfs/dbraw/zinc/03/57/34/174035734.db2.gz NGUUZJSNKGTDEG-UHFFFAOYSA-N 1 2 243.253 2.119 20 0 BEADLO COCC1(C(=O)Nc2ccc(C)[nH+]c2C)CC1 ZINC000352443543 174090947 /nfs/dbraw/zinc/09/09/47/174090947.db2.gz MQOCATGLONGNST-UHFFFAOYSA-N 1 2 234.299 2.064 20 0 BEADLO COCCC(C)(C)Nc1cc(C)[nH+]cn1 ZINC000309065913 174149099 /nfs/dbraw/zinc/14/90/99/174149099.db2.gz ZJBMSTMICBCVJX-UHFFFAOYSA-N 1 2 209.293 2.012 20 0 BEADLO COCCC1(CNc2cccc[nH+]2)CC1 ZINC000225373081 174158259 /nfs/dbraw/zinc/15/82/59/174158259.db2.gz ZTXHQMMRKIAIGY-UHFFFAOYSA-N 1 2 206.289 2.310 20 0 BEADLO COCCCCC(=O)Nc1ccc(C)[nH+]c1C ZINC000119052386 174174105 /nfs/dbraw/zinc/17/41/05/174174105.db2.gz GFENSUSMZIQNQN-UHFFFAOYSA-N 1 2 236.315 2.454 20 0 BEADLO COCCCC[N@@H+]1CCOC[C@@H]1c1ccco1 ZINC000363500200 174191760 /nfs/dbraw/zinc/19/17/60/174191760.db2.gz OCYJYOAQUAXVAR-GFCCVEGCSA-N 1 2 239.315 2.080 20 0 BEADLO COCCCC[N@H+]1CCOC[C@@H]1c1ccco1 ZINC000363500200 174191762 /nfs/dbraw/zinc/19/17/62/174191762.db2.gz OCYJYOAQUAXVAR-GFCCVEGCSA-N 1 2 239.315 2.080 20 0 BEADLO Cc1cccc(C)c1OCC[NH2+]Cc1ccn[nH]1 ZINC000066990341 1173063958 /nfs/dbraw/zinc/06/39/58/1173063958.db2.gz OWMZNAKMNWRWJG-UHFFFAOYSA-N 1 2 245.326 2.195 20 0 BEADLO Cc1ccc(OCCC[NH2+]Cc2ccn[nH]2)cc1 ZINC000066992167 1173063526 /nfs/dbraw/zinc/06/35/26/1173063526.db2.gz QAUSBHGJTPJCOI-UHFFFAOYSA-N 1 2 245.326 2.277 20 0 BEADLO COCCCNc1nc(C)[nH+]c2c1CCCC2 ZINC000267850683 174252138 /nfs/dbraw/zinc/25/21/38/174252138.db2.gz ALHIBGAYWMUJRU-UHFFFAOYSA-N 1 2 235.331 2.112 20 0 BEADLO COCC[N@@H+]1CCn2c(Cl)ccc2[C@@H]1C ZINC000283844243 174315448 /nfs/dbraw/zinc/31/54/48/174315448.db2.gz CNQSGPQOKSKUEA-VIFPVBQESA-N 1 2 228.723 2.165 20 0 BEADLO COCC[N@H+]1CCn2c(Cl)ccc2[C@@H]1C ZINC000283844243 174315449 /nfs/dbraw/zinc/31/54/49/174315449.db2.gz CNQSGPQOKSKUEA-VIFPVBQESA-N 1 2 228.723 2.165 20 0 BEADLO COCC[N@@H+]1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000264179690 174315617 /nfs/dbraw/zinc/31/56/17/174315617.db2.gz JZTKSOZZYOVMKC-UHFFFAOYSA-N 1 2 248.301 2.312 20 0 BEADLO COCC[N@H+]1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000264179690 174315618 /nfs/dbraw/zinc/31/56/18/174315618.db2.gz JZTKSOZZYOVMKC-UHFFFAOYSA-N 1 2 248.301 2.312 20 0 BEADLO COCCSCc1ccc(-n2cc[nH+]c2)nc1 ZINC000175942321 174376754 /nfs/dbraw/zinc/37/67/54/174376754.db2.gz WYQVJRLILNDYIC-UHFFFAOYSA-N 1 2 249.339 2.147 20 0 BEADLO COCC[C@@H](C)SCCn1cc[nH+]c1 ZINC000270506833 174387467 /nfs/dbraw/zinc/38/74/67/174387467.db2.gz NVYQIEGYRAZGIJ-SNVBAGLBSA-N 1 2 214.334 2.041 20 0 BEADLO COCc1nc(C[N@H+]2CC=C(C)CC2)cs1 ZINC000336703731 174642263 /nfs/dbraw/zinc/64/22/63/174642263.db2.gz OKQURDZJPBZJAF-UHFFFAOYSA-N 1 2 238.356 2.442 20 0 BEADLO COCc1nc(C[N@@H+]2CC=C(C)CC2)cs1 ZINC000336703731 174642265 /nfs/dbraw/zinc/64/22/65/174642265.db2.gz OKQURDZJPBZJAF-UHFFFAOYSA-N 1 2 238.356 2.442 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2cnc[nH]2)cc1 ZINC000179558001 175095453 /nfs/dbraw/zinc/09/54/53/175095453.db2.gz LQPSJWCGDZZXGF-UHFFFAOYSA-N 1 2 231.299 2.050 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2cnc[nH]2)cc1 ZINC000179558001 175095455 /nfs/dbraw/zinc/09/54/55/175095455.db2.gz LQPSJWCGDZZXGF-UHFFFAOYSA-N 1 2 231.299 2.050 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2c[nH]cn2)cc1 ZINC000179558001 175095457 /nfs/dbraw/zinc/09/54/57/175095457.db2.gz LQPSJWCGDZZXGF-UHFFFAOYSA-N 1 2 231.299 2.050 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2c[nH]cn2)cc1 ZINC000179558001 175095459 /nfs/dbraw/zinc/09/54/59/175095459.db2.gz LQPSJWCGDZZXGF-UHFFFAOYSA-N 1 2 231.299 2.050 20 0 BEADLO COc1ccc(C[N@@H+]2CCC[C@](C)(F)C2)nc1 ZINC000295313468 175099453 /nfs/dbraw/zinc/09/94/53/175099453.db2.gz GDQGFWAGVHEUEZ-ZDUSSCGKSA-N 1 2 238.306 2.414 20 0 BEADLO COc1ccc(C[N@H+]2CCC[C@](C)(F)C2)nc1 ZINC000295313468 175099455 /nfs/dbraw/zinc/09/94/55/175099455.db2.gz GDQGFWAGVHEUEZ-ZDUSSCGKSA-N 1 2 238.306 2.414 20 0 BEADLO COc1ccc(NCc2[nH]cc[nH+]2)cc1F ZINC000049714837 175153648 /nfs/dbraw/zinc/15/36/48/175153648.db2.gz DGIQHKXQWFLHJK-UHFFFAOYSA-N 1 2 221.235 2.170 20 0 BEADLO COc1ccc([C@@H](C)[NH2+]Cc2ccn[nH]2)cc1 ZINC000041014178 175176571 /nfs/dbraw/zinc/17/65/71/175176571.db2.gz LVMDGWKOBDEPCO-SNVBAGLBSA-N 1 2 231.299 2.269 20 0 BEADLO COc1ccc([C@H](C)[NH2+]Cc2nonc2C)cc1 ZINC000090340178 175189825 /nfs/dbraw/zinc/18/98/25/175189825.db2.gz KZIJVBYWDFJUIP-VIFPVBQESA-N 1 2 247.298 2.237 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2[nH]ncc2C)c1 ZINC000356101277 175254451 /nfs/dbraw/zinc/25/44/51/175254451.db2.gz QKFVQQLVVUYJAQ-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2[nH]ncc2C)c1 ZINC000356101277 175254452 /nfs/dbraw/zinc/25/44/52/175254452.db2.gz QKFVQQLVVUYJAQ-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2n[nH]cc2C)c1 ZINC000356101277 175254453 /nfs/dbraw/zinc/25/44/53/175254453.db2.gz QKFVQQLVVUYJAQ-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2n[nH]cc2C)c1 ZINC000356101277 175254455 /nfs/dbraw/zinc/25/44/55/175254455.db2.gz QKFVQQLVVUYJAQ-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2cnns2)c1 ZINC000296610284 175255168 /nfs/dbraw/zinc/25/51/68/175255168.db2.gz UCPJBFFALMFBSZ-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2cnns2)c1 ZINC000296610284 175255170 /nfs/dbraw/zinc/25/51/70/175255170.db2.gz UCPJBFFALMFBSZ-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1cccc(C[N@@H+]2CCC(=O)C[C@H]2C)c1 ZINC000049713129 175257090 /nfs/dbraw/zinc/25/70/90/175257090.db2.gz GBTNYPVEEPDRNF-LLVKDONJSA-N 1 2 233.311 2.249 20 0 BEADLO COc1cccc(C[N@H+]2CCC(=O)C[C@H]2C)c1 ZINC000049713129 175257092 /nfs/dbraw/zinc/25/70/92/175257092.db2.gz GBTNYPVEEPDRNF-LLVKDONJSA-N 1 2 233.311 2.249 20 0 BEADLO COc1cccc(C[N@@H+]2CCC[C@@H]2CF)n1 ZINC000292964230 175258316 /nfs/dbraw/zinc/25/83/16/175258316.db2.gz FXUCVVVSTYPOIH-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO COc1cccc(C[N@H+]2CCC[C@@H]2CF)n1 ZINC000292964230 175258317 /nfs/dbraw/zinc/25/83/17/175258317.db2.gz FXUCVVVSTYPOIH-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO COc1cccc(NCc2[nH+]ccn2C)c1 ZINC000034937768 175279096 /nfs/dbraw/zinc/27/90/96/175279096.db2.gz VNDXIUWUCFEZQE-UHFFFAOYSA-N 1 2 217.272 2.041 20 0 BEADLO COc1cccc([C@H](C)[NH2+]Cc2ccn[nH]2)c1 ZINC000037771543 175293084 /nfs/dbraw/zinc/29/30/84/175293084.db2.gz FGBVLUDZBZFMGK-JTQLQIEISA-N 1 2 231.299 2.269 20 0 BEADLO COc1cccc2c(N(C)C[C@H](C)O)cc[nH+]c12 ZINC000292343168 175299629 /nfs/dbraw/zinc/29/96/29/175299629.db2.gz NTQLEYXQUMDEQK-JTQLQIEISA-N 1 2 246.310 2.060 20 0 BEADLO COc1cccc2c(N(C)[C@H](C)CO)cc[nH+]c12 ZINC000193489083 175299842 /nfs/dbraw/zinc/29/98/42/175299842.db2.gz AASBGXJWQVIQQW-SNVBAGLBSA-N 1 2 246.310 2.060 20 0 BEADLO COc1ccccc1CN(C)c1cc(C)[nH+]cn1 ZINC000301270095 175325503 /nfs/dbraw/zinc/32/55/03/175325503.db2.gz VDBLRBSOYGEPOD-UHFFFAOYSA-N 1 2 243.310 2.430 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)C(C)(C)C1CC1 ZINC000294370473 175370869 /nfs/dbraw/zinc/37/08/69/175370869.db2.gz CHBARGNTZOJWFD-UHFFFAOYSA-N 1 2 248.326 2.143 20 0 BEADLO COc1ccncc1C[NH2+]Cc1ccc(C)o1 ZINC000292713326 175371911 /nfs/dbraw/zinc/37/19/11/175371911.db2.gz OSPUWDPHUVMQFU-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO COc1cc[nH+]cc1COC(=O)C[C@@H]1C=CCC1 ZINC000288750704 175372821 /nfs/dbraw/zinc/37/28/21/175372821.db2.gz HVVHBQKZBLINBT-LLVKDONJSA-N 1 2 247.294 2.490 20 0 BEADLO COc1cc[nH+]cc1COc1cccnc1C ZINC000341406550 175373281 /nfs/dbraw/zinc/37/32/81/175373281.db2.gz ZIFVKVYLOHFHCV-UHFFFAOYSA-N 1 2 230.267 2.373 20 0 BEADLO COc1cc[nH+]cc1COC(=O)[C@H]1C[C@H]1C(C)C ZINC000287120430 175373395 /nfs/dbraw/zinc/37/33/95/175373395.db2.gz XCISLIODEVNAOK-RYUDHWBXSA-N 1 2 249.310 2.426 20 0 BEADLO COc1cc[nH+]cc1CS[C@H](C)[C@H](C)O ZINC000309035468 175373451 /nfs/dbraw/zinc/37/34/51/175373451.db2.gz FRODRNYCZOYSRA-DTWKUNHWSA-N 1 2 227.329 2.093 20 0 BEADLO COc1cc[nH+]cc1COC(=O)C[C@H]1C=CCC1 ZINC000288750707 175374118 /nfs/dbraw/zinc/37/41/18/175374118.db2.gz HVVHBQKZBLINBT-NSHDSACASA-N 1 2 247.294 2.490 20 0 BEADLO COc1cc[nH+]cc1COC(=O)[C@@H]1C[C@H]1C(C)C ZINC000287120423 175374187 /nfs/dbraw/zinc/37/41/87/175374187.db2.gz XCISLIODEVNAOK-NWDGAFQWSA-N 1 2 249.310 2.426 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H]1C[C@@H]1C(C)C ZINC000185210478 175374514 /nfs/dbraw/zinc/37/45/14/175374514.db2.gz SJTTYPDNEXKVRZ-NXEZZACHSA-N 1 2 234.299 2.321 20 0 BEADLO COc1cc[nH+]cc1NCc1cnccc1C ZINC000354581646 175376086 /nfs/dbraw/zinc/37/60/86/175376086.db2.gz FKFITHISNFIBGY-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1ccccc1F ZINC000336631882 175376186 /nfs/dbraw/zinc/37/61/86/175376186.db2.gz WKHLKGQKFWFQHN-UHFFFAOYSA-N 1 2 246.241 2.482 20 0 BEADLO COc1ccsc1C[N@@H+]1CCOCC12CC2 ZINC000336625669 175378670 /nfs/dbraw/zinc/37/86/70/175378670.db2.gz RRUFXOXKBQAMGG-UHFFFAOYSA-N 1 2 239.340 2.122 20 0 BEADLO COc1ccsc1C[N@H+]1CCOCC12CC2 ZINC000336625669 175378673 /nfs/dbraw/zinc/37/86/73/175378673.db2.gz RRUFXOXKBQAMGG-UHFFFAOYSA-N 1 2 239.340 2.122 20 0 BEADLO CSCCC[N@@H+]1CCOC[C@@H]1c1ccco1 ZINC000361941489 175481356 /nfs/dbraw/zinc/48/13/56/175481356.db2.gz DRMSWBYKLOPNTM-LLVKDONJSA-N 1 2 241.356 2.406 20 0 BEADLO CSCCC[N@H+]1CCOC[C@@H]1c1ccco1 ZINC000361941489 175481359 /nfs/dbraw/zinc/48/13/59/175481359.db2.gz DRMSWBYKLOPNTM-LLVKDONJSA-N 1 2 241.356 2.406 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)Nc1ncccc1Cl ZINC000049236008 175783321 /nfs/dbraw/zinc/78/33/21/175783321.db2.gz AYJSOCZQKXRVKP-VIFPVBQESA-N 1 2 236.706 2.432 20 0 BEADLO C[C@@H]([NH2+]Cc1cc[nH]n1)c1ccccc1F ZINC000037764637 175896592 /nfs/dbraw/zinc/89/65/92/175896592.db2.gz HOMNUYBLZUKIOI-SECBINFHSA-N 1 2 219.263 2.400 20 0 BEADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1cnc[nH]1 ZINC000093315684 176019149 /nfs/dbraw/zinc/01/91/49/176019149.db2.gz DMFRNXUEDULGEY-JTQLQIEISA-N 1 2 231.299 2.308 20 0 BEADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1cnc[nH]1 ZINC000093315684 176019151 /nfs/dbraw/zinc/01/91/51/176019151.db2.gz DMFRNXUEDULGEY-JTQLQIEISA-N 1 2 231.299 2.308 20 0 BEADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1c[nH]cn1 ZINC000093315684 176019153 /nfs/dbraw/zinc/01/91/53/176019153.db2.gz DMFRNXUEDULGEY-JTQLQIEISA-N 1 2 231.299 2.308 20 0 BEADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1c[nH]cn1 ZINC000093315684 176019154 /nfs/dbraw/zinc/01/91/54/176019154.db2.gz DMFRNXUEDULGEY-JTQLQIEISA-N 1 2 231.299 2.308 20 0 BEADLO C[C@@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000276635805 176091009 /nfs/dbraw/zinc/09/10/09/176091009.db2.gz UGVCPFRUHYUHQF-SGUJLRQBSA-N 1 2 233.315 2.072 20 0 BEADLO C[C@@H]1CCC[N@@H+]1Cc1nccn1CC(F)(F)F ZINC000173984654 176109962 /nfs/dbraw/zinc/10/99/62/176109962.db2.gz VNAQPAJBGMENHJ-SECBINFHSA-N 1 2 247.264 2.430 20 0 BEADLO C[C@@H]1CCC[N@H+]1Cc1nccn1CC(F)(F)F ZINC000173984654 176109963 /nfs/dbraw/zinc/10/99/63/176109963.db2.gz VNAQPAJBGMENHJ-SECBINFHSA-N 1 2 247.264 2.430 20 0 BEADLO C[C@@H]1CCCN1c1cc(N2CCC[C@H]2C)[nH+]cn1 ZINC000267589045 176111715 /nfs/dbraw/zinc/11/17/15/176111715.db2.gz CPGRTHLBUAOCDY-VXGBXAGGSA-N 1 2 246.358 2.454 20 0 BEADLO C[C@@H]1CCC[C@@H](C(=O)N(C)Cc2[nH]cc[nH+]2)C1 ZINC000335835788 176112862 /nfs/dbraw/zinc/11/28/62/176112862.db2.gz WXPFQDDIGSINPR-GHMZBOCLSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@@H]1CCC[C@@H](CNc2ccc(CO)c[nH+]2)C1 ZINC000356311109 176118406 /nfs/dbraw/zinc/11/84/06/176118406.db2.gz WAEIDMRLLHFEBM-VXGBXAGGSA-N 1 2 234.343 2.234 20 0 BEADLO C[C@@H]1CCC[C@@H](N(C)C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000283600913 176120068 /nfs/dbraw/zinc/12/00/68/176120068.db2.gz YJSRCLNRQJTJPT-BKVNPXPRSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)CCc2c[nH+]c[nH]2)[C@@H]1C ZINC000188420727 176121925 /nfs/dbraw/zinc/12/19/25/176121925.db2.gz CZRNERWZZRERPQ-NQBHXWOUSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)CCc2c[nH]c[nH+]2)[C@@H]1C ZINC000188420727 176121927 /nfs/dbraw/zinc/12/19/27/176121927.db2.gz CZRNERWZZRERPQ-NQBHXWOUSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CCC[C@H](CC(=O)NCc2[nH]cc[nH+]2)C1 ZINC000114335521 176136488 /nfs/dbraw/zinc/13/64/88/176136488.db2.gz IHWNKGJJVBFPSL-MNOVXSKESA-N 1 2 235.331 2.242 20 0 BEADLO C[C@@H]1CCC[C@H]1CC(=O)NCCCn1cc[nH+]c1 ZINC000185864682 176147499 /nfs/dbraw/zinc/14/74/99/176147499.db2.gz QOGFFTWEUIPSHD-OLZOCXBDSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@@H]1CCN(C(=O)C=Cc2c[nH]c[nH+]2)[C@H](C)C1 ZINC000283834281 176153706 /nfs/dbraw/zinc/15/37/06/176153706.db2.gz GLZDROKQMCAFTG-YIZUVKHSSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@@H]1CCN(c2cc(NCC3CC3)[nH+]cn2)C1 ZINC000270229910 176181951 /nfs/dbraw/zinc/18/19/51/176181951.db2.gz FBPNFEGYHNHTJU-SNVBAGLBSA-N 1 2 232.331 2.145 20 0 BEADLO C[C@@H]1CCN(c2cc(NCC3CC3)nc[nH+]2)C1 ZINC000270229910 176181954 /nfs/dbraw/zinc/18/19/54/176181954.db2.gz FBPNFEGYHNHTJU-SNVBAGLBSA-N 1 2 232.331 2.145 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)CCc2c[nH+]c[nH]2)[C@H](C)C1 ZINC000193254714 176231166 /nfs/dbraw/zinc/23/11/66/176231166.db2.gz VAJRNFSZXOTYIM-WZRBSPASSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)CCc2c[nH]c[nH+]2)[C@H](C)C1 ZINC000193254714 176231168 /nfs/dbraw/zinc/23/11/68/176231168.db2.gz VAJRNFSZXOTYIM-WZRBSPASSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CC[S@@](=O)CC[N@@H+]1Cc1ccsc1 ZINC000336348269 176238774 /nfs/dbraw/zinc/23/87/74/176238774.db2.gz FSOAMWFTRSLZBN-MEBBXXQBSA-N 1 2 243.397 2.091 20 0 BEADLO C[C@@H]1CC[S@@](=O)CC[N@H+]1Cc1ccsc1 ZINC000336348269 176238775 /nfs/dbraw/zinc/23/87/75/176238775.db2.gz FSOAMWFTRSLZBN-MEBBXXQBSA-N 1 2 243.397 2.091 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc(F)ncc2F)CCS1 ZINC000294668262 176301129 /nfs/dbraw/zinc/30/11/29/176301129.db2.gz CMHUTHXAQSMPKJ-MRVPVSSYSA-N 1 2 244.310 2.297 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc(F)ncc2F)CCS1 ZINC000294668262 176301130 /nfs/dbraw/zinc/30/11/30/176301130.db2.gz CMHUTHXAQSMPKJ-MRVPVSSYSA-N 1 2 244.310 2.297 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccncc2F)CC(C)(C)O1 ZINC000336221210 176309265 /nfs/dbraw/zinc/30/92/65/176309265.db2.gz QTEZZBUTZJRTSR-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccncc2F)CC(C)(C)O1 ZINC000336221210 176309266 /nfs/dbraw/zinc/30/92/66/176309266.db2.gz QTEZZBUTZJRTSR-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H]1COCC[C@@H]1CNc1cccc[nH+]1 ZINC000309117035 176339371 /nfs/dbraw/zinc/33/93/71/176339371.db2.gz LYHQJNOSCXXUIG-GHMZBOCLSA-N 1 2 206.289 2.166 20 0 BEADLO C[C@@H]1COCC[C@@H]1[NH2+]c1ccc2c(c1)CCO2 ZINC000192584154 176342134 /nfs/dbraw/zinc/34/21/34/176342134.db2.gz RNMJCAUNAPLDLB-MFKMUULPSA-N 1 2 233.311 2.458 20 0 BEADLO C[C@@H]1C[C@@H](C)[C@@H](C)N(C(=O)CCn2cc[nH+]c2)C1 ZINC000354702855 176365951 /nfs/dbraw/zinc/36/59/51/176365951.db2.gz GKUSGJSXLJBYGG-JHJVBQTASA-N 1 2 249.358 2.166 20 0 BEADLO C[C@@H]1C[C@@H]([NH2+]CC(F)(F)CO)c2ccccc21 ZINC000290380468 176375383 /nfs/dbraw/zinc/37/53/83/176375383.db2.gz RSLWTELGVQBSCE-BXKDBHETSA-N 1 2 241.281 2.452 20 0 BEADLO C[C@@H]1C[C@@H]([NH2+]Cc2ccoc2)c2nccn21 ZINC000293853264 176377858 /nfs/dbraw/zinc/37/78/58/176377858.db2.gz CVCOGGMHUDVCEZ-MWLCHTKSSA-N 1 2 217.272 2.272 20 0 BEADLO C[C@@H]1C[C@@H](O)CN1c1cc(C(F)(F)F)cc[nH+]1 ZINC000335797210 176382546 /nfs/dbraw/zinc/38/25/46/176382546.db2.gz PENNFYGDPRIVJF-VXNVDRBHSA-N 1 2 246.232 2.060 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)C=Cc2c[nH]c[nH+]2)[C@H]1C ZINC000276567268 176494553 /nfs/dbraw/zinc/49/45/53/176494553.db2.gz KUPIRCTWBQHRLC-ULFLLRBLSA-N 1 2 247.342 2.364 20 0 BEADLO Cc1ccc(NC(=O)NCc2cocn2)c(C)[nH+]1 ZINC000674858255 487635512 /nfs/dbraw/zinc/63/55/12/487635512.db2.gz XQPHZUAOUIRERG-UHFFFAOYSA-N 1 2 246.270 2.008 20 0 BEADLO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1ncnn1C ZINC000157494590 177033750 /nfs/dbraw/zinc/03/37/50/177033750.db2.gz UNQXRSZZHHTGNJ-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1ncnn1C ZINC000157494590 177033752 /nfs/dbraw/zinc/03/37/52/177033752.db2.gz UNQXRSZZHHTGNJ-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO C[C@H](c1ccccc1F)[N@H+](C)CC1OCCO1 ZINC000122207517 177042115 /nfs/dbraw/zinc/04/21/15/177042115.db2.gz KRZJQPJCZBJRDX-SNVBAGLBSA-N 1 2 239.290 2.191 20 0 BEADLO C[C@H](c1ccccc1F)[N@@H+](C)CC1OCCO1 ZINC000122207517 177042118 /nfs/dbraw/zinc/04/21/18/177042118.db2.gz KRZJQPJCZBJRDX-SNVBAGLBSA-N 1 2 239.290 2.191 20 0 BEADLO C[C@H](c1ccccn1)[N@H+](C)Cc1ccon1 ZINC000177267180 177042643 /nfs/dbraw/zinc/04/26/43/177042643.db2.gz QKOJWMVYPJBALI-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1ccon1 ZINC000177267180 177042644 /nfs/dbraw/zinc/04/26/44/177042644.db2.gz QKOJWMVYPJBALI-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H](c1cccnc1)[N@H+](C)Cc1cnns1 ZINC000336668557 177045325 /nfs/dbraw/zinc/04/53/25/177045325.db2.gz MNZWFPIMICJXME-SECBINFHSA-N 1 2 234.328 2.126 20 0 BEADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1cnns1 ZINC000336668557 177045326 /nfs/dbraw/zinc/04/53/26/177045326.db2.gz MNZWFPIMICJXME-SECBINFHSA-N 1 2 234.328 2.126 20 0 BEADLO C[C@H](c1cccs1)[N@H+](C)Cc1ncnn1C ZINC000177032368 177048939 /nfs/dbraw/zinc/04/89/39/177048939.db2.gz OTZVEXPHWRUAQO-SECBINFHSA-N 1 2 236.344 2.070 20 0 BEADLO C[C@H](c1cccs1)[N@@H+](C)Cc1ncnn1C ZINC000177032368 177048940 /nfs/dbraw/zinc/04/89/40/177048940.db2.gz OTZVEXPHWRUAQO-SECBINFHSA-N 1 2 236.344 2.070 20 0 BEADLO C[C@H](c1ccncc1)[N@H+](C)Cc1ccon1 ZINC000172653878 177050262 /nfs/dbraw/zinc/05/02/62/177050262.db2.gz AWEOJTUBSLIIPS-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1ccon1 ZINC000172653878 177050263 /nfs/dbraw/zinc/05/02/63/177050263.db2.gz AWEOJTUBSLIIPS-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H]1CCCCN1C(=O)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000336221851 177072798 /nfs/dbraw/zinc/07/27/98/177072798.db2.gz YOLJBYCJCXEWNB-QWRGUYRKSA-N 1 2 247.342 2.231 20 0 BEADLO C[C@H]1CCCC[C@H]1CNC(=O)CCn1cc[nH+]c1 ZINC000299657330 177086248 /nfs/dbraw/zinc/08/62/48/177086248.db2.gz MLFALFBDXYWDIH-STQMWFEESA-N 1 2 249.358 2.216 20 0 BEADLO C[C@H]1CCCC[C@H]1NC(=O)CCc1[nH]cc[nH+]1 ZINC000279265932 177088009 /nfs/dbraw/zinc/08/80/09/177088009.db2.gz VOJCUYAOJDJVDO-WDEREUQCSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H]1CCCN(C(=O)CCc2c[nH+]cn2C)CC1 ZINC000276588689 177092073 /nfs/dbraw/zinc/09/20/73/177092073.db2.gz MSPLSXJDHRPIOI-LBPRGKRZSA-N 1 2 249.358 2.001 20 0 BEADLO C[C@@H]1CCC[C@H](C)[C@H]1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000283965700 177116876 /nfs/dbraw/zinc/11/68/76/177116876.db2.gz MBAQQRWNEHEALJ-FIYMAEDHSA-N 1 2 247.342 2.364 20 0 BEADLO C[C@H]1CCC[C@H](NC(=O)CCc2[nH]cc[nH+]2)C1 ZINC000279289517 177134962 /nfs/dbraw/zinc/13/49/62/177134962.db2.gz YNCXMXCWEUWYMQ-QWRGUYRKSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H]1CC[C@@H](Nc2nc[nH+]c(N)c2Cl)C1 ZINC000235639846 177193962 /nfs/dbraw/zinc/19/39/62/177193962.db2.gz JFPPLNDDPYQPQG-NKWVEPMBSA-N 1 2 226.711 2.313 20 0 BEADLO C[C@H]1CC[C@@H](Nc2[nH+]cnc(N)c2Cl)C1 ZINC000235639846 177193964 /nfs/dbraw/zinc/19/39/64/177193964.db2.gz JFPPLNDDPYQPQG-NKWVEPMBSA-N 1 2 226.711 2.313 20 0 BEADLO C[C@H]1C[N@H+](C/C=C/c2ccccc2)CC[S@@]1=O ZINC000336413374 177241412 /nfs/dbraw/zinc/24/14/12/177241412.db2.gz VLTUBPJDDGOVAV-HHKHWZMTSA-N 1 2 249.379 2.153 20 0 BEADLO C[C@H]1C[N@@H+](C/C=C/c2ccccc2)CC[S@@]1=O ZINC000336413374 177241415 /nfs/dbraw/zinc/24/14/15/177241415.db2.gz VLTUBPJDDGOVAV-HHKHWZMTSA-N 1 2 249.379 2.153 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccccc2F)[C@@H](C)CO1 ZINC000253603086 177266603 /nfs/dbraw/zinc/26/66/03/177266603.db2.gz AADZLNBJILBKLJ-QWRGUYRKSA-N 1 2 223.291 2.435 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccccc2F)[C@@H](C)CO1 ZINC000253603086 177266604 /nfs/dbraw/zinc/26/66/04/177266604.db2.gz AADZLNBJILBKLJ-QWRGUYRKSA-N 1 2 223.291 2.435 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cccs2)C[C@H](C)[S@@]1=O ZINC000336462217 177267887 /nfs/dbraw/zinc/26/78/87/177267887.db2.gz NEKZVWUPLJRJMI-KEODLESXSA-N 1 2 243.397 2.089 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cccs2)C[C@H](C)[S@@]1=O ZINC000336462217 177267888 /nfs/dbraw/zinc/26/78/88/177267888.db2.gz NEKZVWUPLJRJMI-KEODLESXSA-N 1 2 243.397 2.089 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1nnc(C2CC2)n1C1CC1 ZINC000339572850 177271495 /nfs/dbraw/zinc/27/14/95/177271495.db2.gz YZZICTICTRNNLQ-VHSXEESVSA-N 1 2 246.358 2.331 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1nnc(C2CC2)n1C1CC1 ZINC000339572850 177271496 /nfs/dbraw/zinc/27/14/96/177271496.db2.gz YZZICTICTRNNLQ-VHSXEESVSA-N 1 2 246.358 2.331 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1ncn(-c2ccccc2)n1 ZINC000293425387 177272473 /nfs/dbraw/zinc/27/24/73/177272473.db2.gz NJJSPCNWGDAQQJ-NWDGAFQWSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1ncn(-c2ccccc2)n1 ZINC000293425387 177272474 /nfs/dbraw/zinc/27/24/74/177272474.db2.gz NJJSPCNWGDAQQJ-NWDGAFQWSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@H]1CN(c2[nH]c3ccccc3[nH+]2)CCCO1 ZINC000179289855 177277896 /nfs/dbraw/zinc/27/78/96/177277896.db2.gz WOAREHZELVVXJH-JTQLQIEISA-N 1 2 231.299 2.178 20 0 BEADLO C[C@H]1COCC[C@@H]1CNc1cccc[nH+]1 ZINC000309117038 177294391 /nfs/dbraw/zinc/29/43/91/177294391.db2.gz LYHQJNOSCXXUIG-WDEREUQCSA-N 1 2 206.289 2.166 20 0 BEADLO C[C@@H]1C[C@H](C)CN(C(=O)CCCn2cc[nH+]c2)C1 ZINC000125288052 177310069 /nfs/dbraw/zinc/31/00/69/177310069.db2.gz FSWRHKLCFYSWFT-BETUJISGSA-N 1 2 249.358 2.168 20 0 BEADLO C[C@@H]1C[C@H](C)CN(C(=O)C(C)(C)c2c[nH+]c[nH]2)C1 ZINC000336404338 177310577 /nfs/dbraw/zinc/31/05/77/177310577.db2.gz ZOSYUYZXXSIBGB-PHIMTYICSA-N 1 2 249.358 2.192 20 0 BEADLO C[C@H]1C[C@@H]1CC(=O)N(C)c1ccc[nH+]c1N(C)C ZINC000361882579 177341587 /nfs/dbraw/zinc/34/15/87/177341587.db2.gz IVZBEHJVSKRDHQ-WDEREUQCSA-N 1 2 247.342 2.157 20 0 BEADLO C[C@H]1C[C@H]1C[NH+]=c1[nH]c2cccc(F)c2n1C ZINC000357319031 177379651 /nfs/dbraw/zinc/37/96/51/177379651.db2.gz UDUHHMCKDGFUTH-IUCAKERBSA-N 1 2 233.290 2.202 20 0 BEADLO C[C@H]1Cc2ccccc2[C@H]1[NH2+]CC(F)(F)CO ZINC000184713791 177391635 /nfs/dbraw/zinc/39/16/35/177391635.db2.gz GVPRFYPLZUSAKU-CABZTGNLSA-N 1 2 241.281 2.137 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2cccc3c2OCO3)[C@@H]1C ZINC000093417973 177399350 /nfs/dbraw/zinc/39/93/50/177399350.db2.gz RQZBXNASQJACQK-GHMZBOCLSA-N 1 2 249.310 2.025 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2cccc3c2OCO3)[C@@H]1C ZINC000093417973 177399351 /nfs/dbraw/zinc/39/93/51/177399351.db2.gz RQZBXNASQJACQK-GHMZBOCLSA-N 1 2 249.310 2.025 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N1CC[C@@H]2CCCC[C@@H]21 ZINC000335519216 487639657 /nfs/dbraw/zinc/63/96/57/487639657.db2.gz YAQHLRQAHLHVJD-AAEUAGOBSA-N 1 2 247.342 2.133 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N1CC[C@@H]2CCCC[C@@H]21 ZINC000335519216 487639660 /nfs/dbraw/zinc/63/96/60/487639660.db2.gz YAQHLRQAHLHVJD-AAEUAGOBSA-N 1 2 247.342 2.133 20 0 BEADLO CCc1[nH]c(CNC(=O)c2ccccc2F)c[nH+]1 ZINC001652460458 1173085879 /nfs/dbraw/zinc/08/58/79/1173085879.db2.gz AJDHHWZTLGKRLF-UHFFFAOYSA-N 1 2 247.273 2.041 20 0 BEADLO CCc1[nH]cc(CNC(=O)c2ccccc2F)[nH+]1 ZINC001652460458 1173085886 /nfs/dbraw/zinc/08/58/86/1173085886.db2.gz AJDHHWZTLGKRLF-UHFFFAOYSA-N 1 2 247.273 2.041 20 0 BEADLO CN(CC1CCCC1)c1cc(CO)cc[nH+]1 ZINC000082492608 487642120 /nfs/dbraw/zinc/64/21/20/487642120.db2.gz PVIPTZNZJAHJBQ-UHFFFAOYSA-N 1 2 220.316 2.200 20 0 BEADLO CN(CCO)c1ccc(NCC2(C)CCC2)[nH+]c1 ZINC000683436027 487647393 /nfs/dbraw/zinc/64/73/93/487647393.db2.gz LYOKELFVHVTTGS-UHFFFAOYSA-N 1 2 249.358 2.112 20 0 BEADLO CCO[C@@H]1C[C@@H](Nc2cccc[nH+]2)[C@@]12CCCO2 ZINC000272669830 487648521 /nfs/dbraw/zinc/64/85/21/487648521.db2.gz KDKVYUSQQRVWNJ-BZPMIXESSA-N 1 2 248.326 2.220 20 0 BEADLO C[C@H]1CC(NC(=O)C=Cc2c[nH]c[nH+]2)C[C@H](C)C1 ZINC000492775471 226050411 /nfs/dbraw/zinc/05/04/11/226050411.db2.gz XVKDBZJRDJEBBY-ANDSXOESSA-N 1 2 247.342 2.364 20 0 BEADLO C[C@@H]1C[C@H](C)CCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492856571 226066799 /nfs/dbraw/zinc/06/67/99/226066799.db2.gz BYMVNYWLHHYFRJ-OPVGQWETSA-N 1 2 247.342 2.318 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)NCC1(C2CC2)CCC1 ZINC000492870594 226071426 /nfs/dbraw/zinc/07/14/26/226071426.db2.gz WDSUOGVKDWHGMJ-PLNGDYQASA-N 1 2 245.326 2.119 20 0 BEADLO C[C@H]1CC(NC(=O)/C=C/c2[nH]cc[nH+]2)C[C@H](C)C1 ZINC000493075684 226119949 /nfs/dbraw/zinc/11/99/49/226119949.db2.gz WTTCDTSKXOBWCN-YIZUVKHSSA-N 1 2 247.342 2.364 20 0 BEADLO Cc1ccc(NC(=O)/C=C\[C@@H]2CCOC2)c(C)[nH+]1 ZINC000493111986 226129339 /nfs/dbraw/zinc/12/93/39/226129339.db2.gz CUULOAVDVNXVLD-TXNVCOODSA-N 1 2 246.310 2.230 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)Nc1ccc(Cl)nc1 ZINC000493364358 226196198 /nfs/dbraw/zinc/19/61/98/226196198.db2.gz DEZXRAJSCYRFDL-DUXPYHPUSA-N 1 2 248.673 2.110 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1C[C@@H]2CCCC[C@@H]2C1 ZINC000493517213 226238007 /nfs/dbraw/zinc/23/80/07/226238007.db2.gz FQAFDDGKRUXJQD-MTJJXUSZSA-N 1 2 245.326 2.072 20 0 BEADLO c1ccc(N[C@H]2CCOC3(CCOCC3)C2)[nH+]c1 ZINC000493525746 226239377 /nfs/dbraw/zinc/23/93/77/226239377.db2.gz MRHCAKVMPMSRIN-LBPRGKRZSA-N 1 2 248.326 2.222 20 0 BEADLO C[C@@H]1CCCCCN1C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493609635 226245725 /nfs/dbraw/zinc/24/57/25/226245725.db2.gz IBZBBZHQZAEQDZ-XUIVZRPNSA-N 1 2 233.315 2.214 20 0 BEADLO O=C(/C=C\c1[nH]cc[nH+]1)NC1(C2CCC2)CCC1 ZINC000493729461 226251435 /nfs/dbraw/zinc/25/14/35/226251435.db2.gz UOCDLGYSDYYINT-WAYWQWQTSA-N 1 2 245.326 2.262 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1C[C@@H]2CCCC[C@H]2C1 ZINC000493750361 226252265 /nfs/dbraw/zinc/25/22/65/226252265.db2.gz FQAFDDGKRUXJQD-YGABWQLJSA-N 1 2 245.326 2.072 20 0 BEADLO C[C@@H]1CCCCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493785528 226254001 /nfs/dbraw/zinc/25/40/01/226254001.db2.gz HXOOQBOJNYUXAE-JMEBYUIHSA-N 1 2 233.315 2.214 20 0 BEADLO C[C@@H]1CCCC[C@@H]1N(C)C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493818308 226255455 /nfs/dbraw/zinc/25/54/55/226255455.db2.gz SKHZMYIFKULPAT-LASXONHFSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@H]1CC[N@H+](CCOCC2CC2)CC1(F)F ZINC000494279736 226263491 /nfs/dbraw/zinc/26/34/91/226263491.db2.gz NOPUZZVUEKLGNB-JTQLQIEISA-N 1 2 233.302 2.390 20 0 BEADLO C[C@H]1CC[N@@H+](CCOCC2CC2)CC1(F)F ZINC000494279736 226263492 /nfs/dbraw/zinc/26/34/92/226263492.db2.gz NOPUZZVUEKLGNB-JTQLQIEISA-N 1 2 233.302 2.390 20 0 BEADLO Cc1cc(N2C[C@H](C)C[C@@H](O)C2)nc(C(C)C)[nH+]1 ZINC000401889787 226362825 /nfs/dbraw/zinc/36/28/25/226362825.db2.gz GSUKQPNWAPFZTQ-ZYHUDNBSSA-N 1 2 249.358 2.116 20 0 BEADLO Cn1cc[nH+]c1[C@@H](NC(=O)OCC1CC1)C1CC1 ZINC000496234165 226299790 /nfs/dbraw/zinc/29/97/90/226299790.db2.gz OZOVFOZPUQXDGG-NSHDSACASA-N 1 2 249.314 2.007 20 0 BEADLO C[C@H]([NH2+]Cc1ccc2c(c1)OCCO2)C(F)F ZINC000228482519 487656816 /nfs/dbraw/zinc/65/68/16/487656816.db2.gz HVGWCMYEQQVNBV-QMMMGPOBSA-N 1 2 243.253 2.201 20 0 BEADLO CN(Cc1[nH+]ccn1C)c1ccsc1 ZINC000653462980 487658022 /nfs/dbraw/zinc/65/80/22/487658022.db2.gz VUJNESXCMXUNDC-UHFFFAOYSA-N 1 2 207.302 2.118 20 0 BEADLO Cc1ncc(C[NH2+]C2(C(F)F)CCCC2)cn1 ZINC000674135424 487668890 /nfs/dbraw/zinc/66/88/90/487668890.db2.gz RCDRWDQUTATGLT-UHFFFAOYSA-N 1 2 241.285 2.453 20 0 BEADLO CCc1cc(N[C@H]2CCO[C@@H](C3CC3)C2)nc[nH+]1 ZINC000680899435 487670106 /nfs/dbraw/zinc/67/01/06/487670106.db2.gz MVNIWNJAHHXDOQ-QWHCGFSZSA-N 1 2 247.342 2.409 20 0 BEADLO CCc1cc(N(C)CCC2CCOCC2)nc[nH+]1 ZINC000675114128 487670558 /nfs/dbraw/zinc/67/05/58/487670558.db2.gz GKPGZJLNHYJGNQ-UHFFFAOYSA-N 1 2 249.358 2.292 20 0 BEADLO C[C@@H]1C[N@H+](CCCCF)C[C@@H](C(F)(F)F)O1 ZINC000671683132 487688490 /nfs/dbraw/zinc/68/84/90/487688490.db2.gz DKSXMNVPVJKGRF-BDAKNGLRSA-N 1 2 243.244 2.388 20 0 BEADLO C[C@@H]1C[N@@H+](CCCCF)C[C@@H](C(F)(F)F)O1 ZINC000671683132 487688494 /nfs/dbraw/zinc/68/84/94/487688494.db2.gz DKSXMNVPVJKGRF-BDAKNGLRSA-N 1 2 243.244 2.388 20 0 BEADLO Fc1cnccc1C[NH+]1CC2(CCC2(F)F)C1 ZINC000336229219 487692950 /nfs/dbraw/zinc/69/29/50/487692950.db2.gz QGMWPUGYHMFYPC-UHFFFAOYSA-N 1 2 242.244 2.452 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccnc(C)c2)s1 ZINC000527540416 262856716 /nfs/dbraw/zinc/85/67/16/262856716.db2.gz YILARFOZUPTQMW-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO CCC[C@@H](CNc1cc[nH+]c(C2CC2)n1)OCC ZINC000528084030 262904821 /nfs/dbraw/zinc/90/48/21/262904821.db2.gz REOCJAGWZZXNFI-LBPRGKRZSA-N 1 2 249.358 2.393 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C[C@@H](C)n1cccc1 ZINC000523653157 262918395 /nfs/dbraw/zinc/91/83/95/262918395.db2.gz UXSQYHVYNBTFJG-GFCCVEGCSA-N 1 2 243.310 2.203 20 0 BEADLO c1nc(N2CCCCCC2)cc(NC2CC2)[nH+]1 ZINC000242910896 262926202 /nfs/dbraw/zinc/92/62/02/262926202.db2.gz GTDLCMPWBJRPRX-UHFFFAOYSA-N 1 2 232.331 2.431 20 0 BEADLO c1nc(NC2CC2)cc(N2CCCCCC2)[nH+]1 ZINC000242910896 262926203 /nfs/dbraw/zinc/92/62/03/262926203.db2.gz GTDLCMPWBJRPRX-UHFFFAOYSA-N 1 2 232.331 2.431 20 0 BEADLO c1nonc1C[NH2+][C@@H](c1ccccn1)C1CCC1 ZINC000528649956 262964239 /nfs/dbraw/zinc/96/42/39/262964239.db2.gz BFAWRRDURVYJCJ-CYBMUJFWSA-N 1 2 244.298 2.096 20 0 BEADLO CN(C(=O)CCCn1cc[nH+]c1)C1(C)CCCC1 ZINC000683812649 487701278 /nfs/dbraw/zinc/70/12/78/487701278.db2.gz HJHBMNCPYUEVRT-UHFFFAOYSA-N 1 2 249.358 2.454 20 0 BEADLO CCC[N@@H+]1C[C@H](C(F)(F)F)OC[C@H]1C ZINC000671714122 487704811 /nfs/dbraw/zinc/70/48/11/487704811.db2.gz NEZYHUCOQSAECT-HTQZYQBOSA-N 1 2 211.227 2.048 20 0 BEADLO CCC[N@H+]1C[C@H](C(F)(F)F)OC[C@H]1C ZINC000671714122 487704813 /nfs/dbraw/zinc/70/48/13/487704813.db2.gz NEZYHUCOQSAECT-HTQZYQBOSA-N 1 2 211.227 2.048 20 0 BEADLO CCC(C)(CC)C(=O)NCc1[nH]c[nH+]c1C ZINC000681053288 487708238 /nfs/dbraw/zinc/70/82/38/487708238.db2.gz UAEHNKZVQXCIEN-UHFFFAOYSA-N 1 2 223.320 2.161 20 0 BEADLO CC(C)CCO[C@@H]1CC[N@H+](Cc2ncccn2)C1 ZINC000192063991 487714824 /nfs/dbraw/zinc/71/48/24/487714824.db2.gz LGXNFLLMASVAFC-CYBMUJFWSA-N 1 2 249.358 2.114 20 0 BEADLO CC(C)CCO[C@@H]1CC[N@@H+](Cc2ncccn2)C1 ZINC000192063991 487714827 /nfs/dbraw/zinc/71/48/27/487714827.db2.gz LGXNFLLMASVAFC-CYBMUJFWSA-N 1 2 249.358 2.114 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CC(C)(C)C2)[nH+]1 ZINC000683939010 487719212 /nfs/dbraw/zinc/71/92/12/487719212.db2.gz BZJWTDHWGDDSQO-UHFFFAOYSA-N 1 2 216.288 2.113 20 0 BEADLO CCc1cc(N[C@@H](CCO)c2ccco2)nc[nH+]1 ZINC000681093309 487719499 /nfs/dbraw/zinc/71/94/99/487719499.db2.gz UATDZBKDKULVCQ-NSHDSACASA-N 1 2 247.298 2.168 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)Cc1cnc(C2CC2)s1 ZINC000668422086 487725548 /nfs/dbraw/zinc/72/55/48/487725548.db2.gz POSPHUISWNKKME-UHFFFAOYSA-N 1 2 248.355 2.376 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cnc[nH]2)cc(C)c1O ZINC000668422316 487727002 /nfs/dbraw/zinc/72/70/02/487727002.db2.gz YAYKVPQCKQKUGB-UHFFFAOYSA-N 1 2 245.326 2.364 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cnc[nH]2)cc(C)c1O ZINC000668422316 487727006 /nfs/dbraw/zinc/72/70/06/487727006.db2.gz YAYKVPQCKQKUGB-UHFFFAOYSA-N 1 2 245.326 2.364 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2c[nH]cn2)cc(C)c1O ZINC000668422316 487727011 /nfs/dbraw/zinc/72/70/11/487727011.db2.gz YAYKVPQCKQKUGB-UHFFFAOYSA-N 1 2 245.326 2.364 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2c[nH]cn2)cc(C)c1O ZINC000668422316 487727015 /nfs/dbraw/zinc/72/70/15/487727015.db2.gz YAYKVPQCKQKUGB-UHFFFAOYSA-N 1 2 245.326 2.364 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)C1=CCCC1 ZINC000675453550 487733926 /nfs/dbraw/zinc/73/39/26/487733926.db2.gz VVIQKWHTOQJUGG-UHFFFAOYSA-N 1 2 227.267 2.383 20 0 BEADLO O=C(C1=CCCC1)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000675452397 487734053 /nfs/dbraw/zinc/73/40/53/487734053.db2.gz HZJWIVSASKGJKK-CYBMUJFWSA-N 1 2 245.326 2.157 20 0 BEADLO CCc1cc(NC[C@@H]2C[C@@H](C)O[C@H]2C)nc[nH+]1 ZINC000665747393 487749249 /nfs/dbraw/zinc/74/92/49/487749249.db2.gz OFBJQJLZXMQUDM-VWYCJHECSA-N 1 2 235.331 2.264 20 0 BEADLO CCc1cc(N[C@@H](CC)[C@H](O)C(C)C)nc[nH+]1 ZINC000665749169 487755102 /nfs/dbraw/zinc/75/51/02/487755102.db2.gz TXOXHPZCEPVNAM-WCQYABFASA-N 1 2 237.347 2.246 20 0 BEADLO CC(C)CC1(C(=O)N2CC(n3cc[nH+]c3)C2)CC1 ZINC000669604995 487756395 /nfs/dbraw/zinc/75/63/95/487756395.db2.gz ZMIIUQHPDVSTQL-UHFFFAOYSA-N 1 2 247.342 2.093 20 0 BEADLO CCc1cc(N[C@H](C)C2(OC)CCC2)nc[nH+]1 ZINC000665750764 487759089 /nfs/dbraw/zinc/75/90/89/487759089.db2.gz WNJWWADCDZCJJS-SNVBAGLBSA-N 1 2 235.331 2.409 20 0 BEADLO C[C@H]1[C@@H](C)N(C(=O)CCCn2cc[nH+]c2)C[C@H]1C ZINC000667912483 487760405 /nfs/dbraw/zinc/76/04/05/487760405.db2.gz BZMKLMDKAUKGOH-JHJVBQTASA-N 1 2 249.358 2.166 20 0 BEADLO c1nc(NC2CC2)cc(NCCC2CC2)[nH+]1 ZINC000413170704 487769969 /nfs/dbraw/zinc/76/99/69/487769969.db2.gz PESWEALAIKAFEL-UHFFFAOYSA-N 1 2 218.304 2.263 20 0 BEADLO c1nc(NCCC2CC2)cc(NC2CC2)[nH+]1 ZINC000413170704 487769973 /nfs/dbraw/zinc/76/99/73/487769973.db2.gz PESWEALAIKAFEL-UHFFFAOYSA-N 1 2 218.304 2.263 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2cnc(C)nc2C)no1 ZINC000675770981 487776596 /nfs/dbraw/zinc/77/65/96/487776596.db2.gz CHABFOQAPLLMLG-VIFPVBQESA-N 1 2 246.314 2.241 20 0 BEADLO CC(C)(C)CCNC(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000666308343 487783169 /nfs/dbraw/zinc/78/31/69/487783169.db2.gz QSYXKCLADIZEIP-JTQLQIEISA-N 1 2 249.358 2.067 20 0 BEADLO CC(C)(C)CCNC(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000666308343 487783174 /nfs/dbraw/zinc/78/31/74/487783174.db2.gz QSYXKCLADIZEIP-JTQLQIEISA-N 1 2 249.358 2.067 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)c1ccnc(C(C)(C)C)n1 ZINC000674296773 487788363 /nfs/dbraw/zinc/78/83/63/487788363.db2.gz PCZLZJWETSBYRM-UHFFFAOYSA-N 1 2 245.330 2.134 20 0 BEADLO c1c[nH+]c([C@@H]2CCCCN2Cc2ccon2)[nH]1 ZINC000675894053 487788723 /nfs/dbraw/zinc/78/87/23/487788723.db2.gz ZQOBEBOFQUGZRH-NSHDSACASA-N 1 2 232.287 2.125 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000666351493 487791093 /nfs/dbraw/zinc/79/10/93/487791093.db2.gz GKIAVOZFCQLEQD-IJLUTSLNSA-N 1 2 249.358 2.171 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1nc2ccccc2c(=O)[nH]1 ZINC000684208361 487792629 /nfs/dbraw/zinc/79/26/29/487792629.db2.gz LQLVTRZZGGDTCF-NXEZZACHSA-N 1 2 243.310 2.318 20 0 BEADLO CCc1ncc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)cn1 ZINC000666353544 487793159 /nfs/dbraw/zinc/79/31/59/487793159.db2.gz BAADCMFQOIQWLO-ZYHUDNBSSA-N 1 2 237.322 2.219 20 0 BEADLO CCc1ncc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)cn1 ZINC000666353544 487793166 /nfs/dbraw/zinc/79/31/66/487793166.db2.gz BAADCMFQOIQWLO-ZYHUDNBSSA-N 1 2 237.322 2.219 20 0 BEADLO Cc1cn2c([nH+]1)CN(Cc1ccoc1C)CC2 ZINC000666356145 487793319 /nfs/dbraw/zinc/79/33/19/487793319.db2.gz UUBZMTYFRZWRJQ-UHFFFAOYSA-N 1 2 231.299 2.109 20 0 BEADLO FC[C@H]1C[N@H+](Cc2cc3ccccc3[nH]2)CCO1 ZINC000666399587 487798393 /nfs/dbraw/zinc/79/83/93/487798393.db2.gz KRACYMSNUZYDDR-ZDUSSCGKSA-N 1 2 248.301 2.338 20 0 BEADLO FC[C@H]1C[N@@H+](Cc2cc3ccccc3[nH]2)CCO1 ZINC000666399587 487798399 /nfs/dbraw/zinc/79/83/99/487798399.db2.gz KRACYMSNUZYDDR-ZDUSSCGKSA-N 1 2 248.301 2.338 20 0 BEADLO Cc1nnc([C@H](C)[N@H+](C)CCOC(C)(C)C)o1 ZINC000676042642 487804545 /nfs/dbraw/zinc/80/45/45/487804545.db2.gz AKKGAHDJXHQUQD-VIFPVBQESA-N 1 2 241.335 2.186 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+](C)CCOC(C)(C)C)o1 ZINC000676042642 487804549 /nfs/dbraw/zinc/80/45/49/487804549.db2.gz AKKGAHDJXHQUQD-VIFPVBQESA-N 1 2 241.335 2.186 20 0 BEADLO CCN(CCC1CC1)c1cc(CO)cc[nH+]1 ZINC000385355854 487811148 /nfs/dbraw/zinc/81/11/48/487811148.db2.gz WDJZADYFDCLSTC-UHFFFAOYSA-N 1 2 220.316 2.200 20 0 BEADLO Cc1cc(NC(=O)NC2CC(C)(C)C2)cc[nH+]1 ZINC000666489181 487815091 /nfs/dbraw/zinc/81/50/91/487815091.db2.gz CERNPIAENKWPRM-UHFFFAOYSA-N 1 2 233.315 2.122 20 0 BEADLO CCCn1cc(CNc2ccc(OC)c[nH+]2)cn1 ZINC000676201099 487819550 /nfs/dbraw/zinc/81/95/50/487819550.db2.gz HSHUBWJRZZUVBO-UHFFFAOYSA-N 1 2 246.314 2.309 20 0 BEADLO CC[C@@H](C)CCNC(=O)Nc1cc[nH+]cc1C ZINC000666494895 487821692 /nfs/dbraw/zinc/82/16/92/487821692.db2.gz YLXRISWYWSMONY-SNVBAGLBSA-N 1 2 235.331 2.370 20 0 BEADLO Cc1cc(NC(=O)N[C@@]23C[C@@H]2CCC3)c(C)c[nH+]1 ZINC000666496938 487822189 /nfs/dbraw/zinc/82/21/89/487822189.db2.gz XCTCRVSRKBSLDO-FZMZJTMJSA-N 1 2 245.326 2.184 20 0 BEADLO Cc1cn2cc(NC(=O)NC(C)C)ccc2[nH+]1 ZINC000074904712 487823910 /nfs/dbraw/zinc/82/39/10/487823910.db2.gz YIOAWGBJELBGDL-UHFFFAOYSA-N 1 2 232.287 2.173 20 0 BEADLO Cc1cc(C[NH2+]C(CF)CF)cc(Cl)n1 ZINC000824554602 587275993 /nfs/dbraw/zinc/27/59/93/587275993.db2.gz IBXJMOQEQGWCNY-UHFFFAOYSA-N 1 2 234.677 2.441 20 0 BEADLO CC1(C)CCC[N@H+](Cc2cnsn2)C1 ZINC000846805055 588289655 /nfs/dbraw/zinc/28/96/55/588289655.db2.gz UCCYJWWQZVNUOJ-UHFFFAOYSA-N 1 2 211.334 2.160 20 0 BEADLO CC1(C)CCC[N@@H+](Cc2cnsn2)C1 ZINC000846805055 588289656 /nfs/dbraw/zinc/28/96/56/588289656.db2.gz UCCYJWWQZVNUOJ-UHFFFAOYSA-N 1 2 211.334 2.160 20 0 BEADLO Cc1ccc(C[N@@H+](Cc2cn(C)cn2)C2CC2)o1 ZINC000659843754 487845393 /nfs/dbraw/zinc/84/53/93/487845393.db2.gz CJQIPOCNPJYOOW-UHFFFAOYSA-N 1 2 245.326 2.486 20 0 BEADLO Cc1ccc(C[N@H+](Cc2cn(C)cn2)C2CC2)o1 ZINC000659843754 487845397 /nfs/dbraw/zinc/84/53/97/487845397.db2.gz CJQIPOCNPJYOOW-UHFFFAOYSA-N 1 2 245.326 2.486 20 0 BEADLO Cc1ccc(CN(Cc2cn(C)c[nH+]2)C2CC2)o1 ZINC000659843754 487845407 /nfs/dbraw/zinc/84/54/07/487845407.db2.gz CJQIPOCNPJYOOW-UHFFFAOYSA-N 1 2 245.326 2.486 20 0 BEADLO O=C(CCCn1cc[nH+]c1)N1CC[C@H]2CCC[C@@H]21 ZINC000681747363 487852099 /nfs/dbraw/zinc/85/20/99/487852099.db2.gz JRGSBOROWPKWHA-OLZOCXBDSA-N 1 2 247.342 2.064 20 0 BEADLO COc1ccc(NC2CC(OC(C)C)C2)[nH+]c1 ZINC000681751073 487853323 /nfs/dbraw/zinc/85/33/23/487853323.db2.gz KVDCCHKFUNCYSS-UHFFFAOYSA-N 1 2 236.315 2.458 20 0 BEADLO CCC[C@@H](C)C[N@@H+]1CC[C@H](O)C(F)(F)C1 ZINC000668499835 487856328 /nfs/dbraw/zinc/85/63/28/487856328.db2.gz MSDFRIVYWZKKLY-ZJUUUORDSA-N 1 2 221.291 2.125 20 0 BEADLO CCC[C@@H](C)C[N@H+]1CC[C@H](O)C(F)(F)C1 ZINC000668499835 487856334 /nfs/dbraw/zinc/85/63/34/487856334.db2.gz MSDFRIVYWZKKLY-ZJUUUORDSA-N 1 2 221.291 2.125 20 0 BEADLO CCCc1csc(Cn2cc[nH+]c2)n1 ZINC000395555441 487862582 /nfs/dbraw/zinc/86/25/82/487862582.db2.gz DACNWADCNPCXAE-UHFFFAOYSA-N 1 2 207.302 2.340 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cncs2)[C@H](C)CO1 ZINC000651930988 487869202 /nfs/dbraw/zinc/86/92/02/487869202.db2.gz IRMCUMMVBZWEFG-NXEZZACHSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cncs2)[C@H](C)CO1 ZINC000651930988 487869213 /nfs/dbraw/zinc/86/92/13/487869213.db2.gz IRMCUMMVBZWEFG-NXEZZACHSA-N 1 2 226.345 2.142 20 0 BEADLO COc1ccc(C[NH2+]CC(C)(F)F)c(OC)c1 ZINC000559324071 322963023 /nfs/dbraw/zinc/96/30/23/322963023.db2.gz NUCPRJVEYUEJBM-UHFFFAOYSA-N 1 2 245.269 2.449 20 0 BEADLO C[C@H](CNC(=O)[C@@H]1CCC1(C)C)Cn1cc[nH+]c1 ZINC000669018886 487879522 /nfs/dbraw/zinc/87/95/22/487879522.db2.gz QVMLCYURILVESS-NEPJUHHUSA-N 1 2 249.358 2.072 20 0 BEADLO CC[C@H](NC(=O)[C@H](C)c1ccco1)c1[nH]cc[nH+]1 ZINC000682040957 487887692 /nfs/dbraw/zinc/88/76/92/487887692.db2.gz BTNLRHMNBCCGBI-ZJUUUORDSA-N 1 2 247.298 2.374 20 0 BEADLO CC[C@@H](NC(=O)[C@@H]1CC12CCC2)c1[nH]cc[nH+]1 ZINC000682041453 487888479 /nfs/dbraw/zinc/88/84/79/487888479.db2.gz QVOIFWDDZQNQSC-VHSXEESVSA-N 1 2 233.315 2.167 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@H]1C[C@H]1CC(C)(C)C ZINC000652757969 487892253 /nfs/dbraw/zinc/89/22/53/487892253.db2.gz COSXHXFKRNYZFW-CMPLNLGQSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@@H]1C[C@H]1CC(C)(C)C ZINC000652757969 487892257 /nfs/dbraw/zinc/89/22/57/487892257.db2.gz COSXHXFKRNYZFW-CMPLNLGQSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1ncc([C@H](C)[N@H+](C)Cc2cn[nH]c2)c(C)n1 ZINC000682071393 487893166 /nfs/dbraw/zinc/89/31/66/487893166.db2.gz HTLBTIYAWXDRJW-JTQLQIEISA-N 1 2 245.330 2.010 20 0 BEADLO Cc1ncc([C@H](C)[N@@H+](C)Cc2cn[nH]c2)c(C)n1 ZINC000682071393 487893168 /nfs/dbraw/zinc/89/31/68/487893168.db2.gz HTLBTIYAWXDRJW-JTQLQIEISA-N 1 2 245.330 2.010 20 0 BEADLO C[C@@H](NC(=O)CCn1cc[nH+]c1)c1ccsc1 ZINC000669861911 487894481 /nfs/dbraw/zinc/89/44/81/487894481.db2.gz UEFHTCPVFPHFPF-SNVBAGLBSA-N 1 2 249.339 2.212 20 0 BEADLO CC(C)CCc1noc(C[N@H+]2CC=CCC2)n1 ZINC000679323489 487903575 /nfs/dbraw/zinc/90/35/75/487903575.db2.gz YBFDGVCPULOVAZ-UHFFFAOYSA-N 1 2 235.331 2.420 20 0 BEADLO CC(C)CCc1noc(C[N@@H+]2CC=CCC2)n1 ZINC000679323489 487903580 /nfs/dbraw/zinc/90/35/80/487903580.db2.gz YBFDGVCPULOVAZ-UHFFFAOYSA-N 1 2 235.331 2.420 20 0 BEADLO Cn1cc[nH+]c1CN1CCCOc2ccccc21 ZINC000676721442 487905351 /nfs/dbraw/zinc/90/53/51/487905351.db2.gz ZEMNGQCAZMKING-UHFFFAOYSA-N 1 2 243.310 2.209 20 0 BEADLO Cc1nc(N2CCC[C@@H]3C[C@@H]32)c(C)c(C)[nH+]1 ZINC000672323848 487919283 /nfs/dbraw/zinc/91/92/83/487919283.db2.gz UFAMJFLMBJOSJE-NEPJUHHUSA-N 1 2 217.316 2.391 20 0 BEADLO COCc1cc[nH+]c(N[C@H](C)c2ccn(C)n2)c1 ZINC000652331324 487921315 /nfs/dbraw/zinc/92/13/15/487921315.db2.gz DEEJNFPEEZYLDZ-SNVBAGLBSA-N 1 2 246.314 2.135 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](C)[C@H]2CCCO2)c1 ZINC000652331182 487920876 /nfs/dbraw/zinc/92/08/76/487920876.db2.gz ZXUCJOKVWVUKSE-CMPLNLGQSA-N 1 2 236.315 2.207 20 0 BEADLO Cc1ccc(C[N@@H+]2CCc3cn[nH]c3C2)cc1 ZINC000676792307 487929258 /nfs/dbraw/zinc/92/92/58/487929258.db2.gz BBDYNBUMJGOLIQ-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1ccc(C[N@H+]2CCc3cn[nH]c3C2)cc1 ZINC000676792307 487929261 /nfs/dbraw/zinc/92/92/61/487929261.db2.gz BBDYNBUMJGOLIQ-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1ccc(C[N@@H+]2CCc3c[nH]nc3C2)cc1 ZINC000676792307 487929266 /nfs/dbraw/zinc/92/92/66/487929266.db2.gz BBDYNBUMJGOLIQ-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1ccc(C[N@H+]2CCc3c[nH]nc3C2)cc1 ZINC000676792307 487929269 /nfs/dbraw/zinc/92/92/69/487929269.db2.gz BBDYNBUMJGOLIQ-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CC=CCC2)s1 ZINC000669932861 487936714 /nfs/dbraw/zinc/93/67/14/487936714.db2.gz PTHMREUALGEQHZ-QMMMGPOBSA-N 1 2 209.318 2.169 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CC=CCC2)s1 ZINC000669932861 487936722 /nfs/dbraw/zinc/93/67/22/487936722.db2.gz PTHMREUALGEQHZ-QMMMGPOBSA-N 1 2 209.318 2.169 20 0 BEADLO CC[C@@H](C)CN(C)C(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000668565962 487941929 /nfs/dbraw/zinc/94/19/29/487941929.db2.gz PASRIDOODYGYSC-GHMZBOCLSA-N 1 2 249.358 2.019 20 0 BEADLO CC[C@@H](C)CN(C)C(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000668565962 487941934 /nfs/dbraw/zinc/94/19/34/487941934.db2.gz PASRIDOODYGYSC-GHMZBOCLSA-N 1 2 249.358 2.019 20 0 BEADLO CC[C@H](C)CN(C)C(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000668565964 487941950 /nfs/dbraw/zinc/94/19/50/487941950.db2.gz PASRIDOODYGYSC-QWRGUYRKSA-N 1 2 249.358 2.019 20 0 BEADLO CC[C@H](C)CN(C)C(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000668565964 487941953 /nfs/dbraw/zinc/94/19/53/487941953.db2.gz PASRIDOODYGYSC-QWRGUYRKSA-N 1 2 249.358 2.019 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000667142213 487946423 /nfs/dbraw/zinc/94/64/23/487946423.db2.gz ORZSFVXGBCAYER-DCAQKATOSA-N 1 2 249.358 2.065 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000667142213 487946427 /nfs/dbraw/zinc/94/64/27/487946427.db2.gz ORZSFVXGBCAYER-DCAQKATOSA-N 1 2 249.358 2.065 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cnc[nH]2)cc1F ZINC000684620696 487948150 /nfs/dbraw/zinc/94/81/50/487948150.db2.gz UZPOQIHOFWMKDR-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cnc[nH]2)cc1F ZINC000684620696 487948156 /nfs/dbraw/zinc/94/81/56/487948156.db2.gz UZPOQIHOFWMKDR-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2c[nH]cn2)cc1F ZINC000684620696 487948162 /nfs/dbraw/zinc/94/81/62/487948162.db2.gz UZPOQIHOFWMKDR-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2c[nH]cn2)cc1F ZINC000684620696 487948166 /nfs/dbraw/zinc/94/81/66/487948166.db2.gz UZPOQIHOFWMKDR-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000666351926 487956167 /nfs/dbraw/zinc/95/61/67/487956167.db2.gz LRSCKOOCCHFFCJ-MNOVXSKESA-N 1 2 249.358 2.162 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000666351926 487956169 /nfs/dbraw/zinc/95/61/69/487956169.db2.gz LRSCKOOCCHFFCJ-MNOVXSKESA-N 1 2 249.358 2.162 20 0 BEADLO Cc1cc(NC(=O)N2CCC=C(C)C2)c(C)c[nH+]1 ZINC000559625503 322978796 /nfs/dbraw/zinc/97/87/96/322978796.db2.gz IHFMGWVMFQPQSI-UHFFFAOYSA-N 1 2 245.326 2.304 20 0 BEADLO Cc1cccnc1NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000560342623 322985775 /nfs/dbraw/zinc/98/57/75/322985775.db2.gz ZVGKQMCRNGWHGP-LLVKDONJSA-N 1 2 244.298 2.176 20 0 BEADLO CCCCCOC1C[NH+](CC2(F)CC2)C1 ZINC000564711022 323001913 /nfs/dbraw/zinc/00/19/13/323001913.db2.gz NNKSCCUNSRQMEG-UHFFFAOYSA-N 1 2 215.312 2.380 20 0 BEADLO Cc1ncccc1CNc1ccc(N(C)C)c[nH+]1 ZINC000150910532 323002627 /nfs/dbraw/zinc/00/26/27/323002627.db2.gz RSUDMMPZKGCTNE-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO Cc1noc([C@H]2CCC[N@@H+]2CC2(F)CC2)n1 ZINC000561967170 323009544 /nfs/dbraw/zinc/00/95/44/323009544.db2.gz IPBPNAHKUDKEFG-SECBINFHSA-N 1 2 225.267 2.017 20 0 BEADLO Cc1noc([C@H]2CCC[N@H+]2CC2(F)CC2)n1 ZINC000561967170 323009545 /nfs/dbraw/zinc/00/95/45/323009545.db2.gz IPBPNAHKUDKEFG-SECBINFHSA-N 1 2 225.267 2.017 20 0 BEADLO CC(C)c1nnc(C[NH+]2C3CCC2CC3)[nH]1 ZINC000562377357 323018450 /nfs/dbraw/zinc/01/84/50/323018450.db2.gz FTLYSQFEQYTBOW-UHFFFAOYSA-N 1 2 220.320 2.055 20 0 BEADLO CC(C)OC1CC[NH+](Cc2cocn2)CC1 ZINC000562418583 323019330 /nfs/dbraw/zinc/01/93/30/323019330.db2.gz MQROUSGRLVIGRE-UHFFFAOYSA-N 1 2 224.304 2.064 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1NC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000562657565 323026681 /nfs/dbraw/zinc/02/66/81/323026681.db2.gz GHYUTOFXLWGZPR-QMTHXVAHSA-N 1 2 249.358 2.238 20 0 BEADLO C[C@H]1C[C@H](NCC(C)(F)F)c2[nH+]ccn21 ZINC000562794103 323030810 /nfs/dbraw/zinc/03/08/10/323030810.db2.gz BMYNCUAVSGWGJN-YUMQZZPRSA-N 1 2 215.247 2.134 20 0 BEADLO CCC1(NC(=O)Nc2cc(C)[nH+]cc2C)CC1 ZINC000569665583 323036093 /nfs/dbraw/zinc/03/60/93/323036093.db2.gz ATFWHJLBUJVYJS-UHFFFAOYSA-N 1 2 233.315 2.184 20 0 BEADLO COc1ccc(CNc2c[nH]c[nH+]2)c(C)c1OC ZINC000569677050 323036640 /nfs/dbraw/zinc/03/66/40/323036640.db2.gz BIPLPNPROHFMCB-UHFFFAOYSA-N 1 2 247.298 2.347 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)CC(F)(F)F)[nH+]1 ZINC000569732633 323039069 /nfs/dbraw/zinc/03/90/69/323039069.db2.gz FUGXDWQDNAZRQG-UHFFFAOYSA-N 1 2 249.236 2.022 20 0 BEADLO CC(C)[C@@H](C)N(C)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000569814437 323041286 /nfs/dbraw/zinc/04/12/86/323041286.db2.gz XEWYYMDDFKINCK-VXGBXAGGSA-N 1 2 237.347 2.337 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)Cc1cscn1 ZINC000570012674 323047342 /nfs/dbraw/zinc/04/73/42/323047342.db2.gz QIYJCZFWLSXOPP-UHFFFAOYSA-N 1 2 234.328 2.186 20 0 BEADLO CC1=C(C)CN(C(=O)[C@H](C)Cc2c[nH+]c[nH]2)CC1 ZINC000570107684 323050285 /nfs/dbraw/zinc/05/02/85/323050285.db2.gz TVCASYKJFIYVFS-LLVKDONJSA-N 1 2 247.342 2.157 20 0 BEADLO CC1=C(C)CN(C(=O)[C@H](C)Cc2c[nH]c[nH+]2)CC1 ZINC000570107684 323050286 /nfs/dbraw/zinc/05/02/86/323050286.db2.gz TVCASYKJFIYVFS-LLVKDONJSA-N 1 2 247.342 2.157 20 0 BEADLO CCSCC[N@@H+]1Cc2cccnc2C1 ZINC000570325598 323056378 /nfs/dbraw/zinc/05/63/78/323056378.db2.gz FQXNQCSMPUSEPX-UHFFFAOYSA-N 1 2 208.330 2.150 20 0 BEADLO CCSCC[N@H+]1Cc2cccnc2C1 ZINC000570325598 323056379 /nfs/dbraw/zinc/05/63/79/323056379.db2.gz FQXNQCSMPUSEPX-UHFFFAOYSA-N 1 2 208.330 2.150 20 0 BEADLO C[C@H](CC(=O)NC[C@@H]1CC[C@@H](C)C1)n1cc[nH+]c1 ZINC000572648480 323062583 /nfs/dbraw/zinc/06/25/83/323062583.db2.gz FUUFZTORPGGHCC-JHJVBQTASA-N 1 2 249.358 2.387 20 0 BEADLO C[C@@H](NC(=O)C[C@H]1CC[C@H](C)C1)c1[nH]cc[nH+]1 ZINC000570647967 323066055 /nfs/dbraw/zinc/06/60/55/323066055.db2.gz JUKXAQMYAXRLHX-AXFHLTTASA-N 1 2 235.331 2.413 20 0 BEADLO CCC1(NC(=O)Cc2c[nH+]cn2C)CCCCC1 ZINC000570674846 323066771 /nfs/dbraw/zinc/06/67/71/323066771.db2.gz WVLUEBLCVJXMTE-UHFFFAOYSA-N 1 2 249.358 2.192 20 0 BEADLO CCC[C@H]([NH2+][C@@H]1CS[C@H](C)C1)C(=O)OCC ZINC000397941784 323103325 /nfs/dbraw/zinc/10/33/25/323103325.db2.gz QMRKQSIRMDUPQF-VWYCJHECSA-N 1 2 245.388 2.202 20 0 BEADLO C[NH2+]Cc1noc([C@H]2CC[C@H](C)CC2)n1 ZINC000563226329 323105054 /nfs/dbraw/zinc/10/50/54/323105054.db2.gz VCZIVUQJPUGFQN-KYZUINATSA-N 1 2 209.293 2.083 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)c1cccs1 ZINC000047976246 323113012 /nfs/dbraw/zinc/11/30/12/323113012.db2.gz ZZSPQLFFWRDMHO-UHFFFAOYSA-N 1 2 247.323 2.461 20 0 BEADLO CCC(CC)C(=O)Nc1cc(C)[nH+]cc1C ZINC000534300105 323115843 /nfs/dbraw/zinc/11/58/43/323115843.db2.gz QMMCXDXYXQPADQ-UHFFFAOYSA-N 1 2 220.316 2.495 20 0 BEADLO C[C@@H]([NH2+]Cc1ccccc1CO)c1cscn1 ZINC000534328502 323116875 /nfs/dbraw/zinc/11/68/75/323116875.db2.gz OQIWHUGRQYRTTI-SNVBAGLBSA-N 1 2 248.351 2.486 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N(C)C1CCCCC1 ZINC000563367200 323121423 /nfs/dbraw/zinc/12/14/23/323121423.db2.gz DOLNIZZBXSABLO-NSHDSACASA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N(C)C1CCCCC1 ZINC000563367200 323121424 /nfs/dbraw/zinc/12/14/24/323121424.db2.gz DOLNIZZBXSABLO-NSHDSACASA-N 1 2 249.358 2.379 20 0 BEADLO CC(C)(O)CCSCCCn1cc[nH+]c1 ZINC000563413036 323124968 /nfs/dbraw/zinc/12/49/68/323124968.db2.gz KPAJFQVZLBZYON-UHFFFAOYSA-N 1 2 228.361 2.167 20 0 BEADLO CC[C@](C)(NCc1c[nH+]cn1C)C(F)(F)F ZINC000310040958 323127114 /nfs/dbraw/zinc/12/71/14/323127114.db2.gz YANOEISCPJCTKK-VIFPVBQESA-N 1 2 235.253 2.241 20 0 BEADLO COc1ccc[nH+]c1NCC1(OC)CCCC1 ZINC000310447468 323131858 /nfs/dbraw/zinc/13/18/58/323131858.db2.gz YXHDJLKCASNRRW-UHFFFAOYSA-N 1 2 236.315 2.461 20 0 BEADLO CC1(C)C[NH+](CC(=O)Nc2ccsc2)C1 ZINC000571295847 323140665 /nfs/dbraw/zinc/14/06/65/323140665.db2.gz CPMVYDVKFGOXST-UHFFFAOYSA-N 1 2 224.329 2.028 20 0 BEADLO CC1(C)CC(Cc2noc(Cn3cc[nH+]c3)n2)C1 ZINC000572810808 323143121 /nfs/dbraw/zinc/14/31/21/323143121.db2.gz VBLOPCRRUHTHRH-UHFFFAOYSA-N 1 2 246.314 2.293 20 0 BEADLO C/C=C/C=C\C(=O)Nc1ccc[nH+]c1N(C)C ZINC000048990426 323156378 /nfs/dbraw/zinc/15/63/78/323156378.db2.gz AHJAXVKWSYXPQI-WEHQGULRSA-N 1 2 231.299 2.218 20 0 BEADLO COc1ccc(CNc2cc(C)[nH+]cn2)c(C)c1 ZINC000531961851 323157623 /nfs/dbraw/zinc/15/76/23/323157623.db2.gz SCWMIDXDYLTFNE-UHFFFAOYSA-N 1 2 243.310 2.136 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2cccc(O)c2)nc1 ZINC000534843354 323161187 /nfs/dbraw/zinc/16/11/87/323161187.db2.gz RJQHJBGJJAGPPU-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2cccc(O)c2)nc1 ZINC000534843354 323161188 /nfs/dbraw/zinc/16/11/88/323161188.db2.gz RJQHJBGJJAGPPU-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO Cc1cc(NC(=O)c2ccccc2)c(C)c[nH+]1 ZINC000535035528 323164231 /nfs/dbraw/zinc/16/42/31/323164231.db2.gz AOHYGIIGBGXMNG-UHFFFAOYSA-N 1 2 226.279 2.373 20 0 BEADLO CCN(C(=O)Nc1cc(C)[nH+]cc1C)C(C)C ZINC000535060027 323164811 /nfs/dbraw/zinc/16/48/11/323164811.db2.gz ZGEPFKFECNOVNU-UHFFFAOYSA-N 1 2 235.331 2.383 20 0 BEADLO CC[C@H](C)N(C)C(=O)Nc1cc(C)[nH+]cc1C ZINC000535061473 323164858 /nfs/dbraw/zinc/16/48/58/323164858.db2.gz ZIBHLWXVYMSQHU-NSHDSACASA-N 1 2 235.331 2.383 20 0 BEADLO CC[C@@]1(C)C[C@@H]1C(=O)NCCCCn1cc[nH+]c1 ZINC000532069485 323171391 /nfs/dbraw/zinc/17/13/91/323171391.db2.gz HJQXOIXYHDGMLF-OCCSQVGLSA-N 1 2 249.358 2.216 20 0 BEADLO CCCCN(C(=O)Cn1cc[nH+]c1)[C@H](C)CC ZINC000563699649 323174187 /nfs/dbraw/zinc/17/41/87/323174187.db2.gz YNHFZUGMOHHNSQ-GFCCVEGCSA-N 1 2 237.347 2.310 20 0 BEADLO C[C@H](CC(=O)NCC1=CCCCC1)n1cc[nH+]c1 ZINC000563716025 323175222 /nfs/dbraw/zinc/17/52/22/323175222.db2.gz MPIHPANDAXLWRB-GFCCVEGCSA-N 1 2 247.342 2.451 20 0 BEADLO CC1(C)CCC[C@@H]1CCNC(=O)Cn1cc[nH+]c1 ZINC000529565732 323184243 /nfs/dbraw/zinc/18/42/43/323184243.db2.gz VRYPTNYWLDIWFN-GFCCVEGCSA-N 1 2 249.358 2.216 20 0 BEADLO CCn1cc[nH+]c1CNc1ccc(CCO)cc1 ZINC000051924058 323191874 /nfs/dbraw/zinc/19/18/74/323191874.db2.gz OEECLNKSUGWHMP-UHFFFAOYSA-N 1 2 245.326 2.050 20 0 BEADLO C[C@@H]1CC[C@H](CC(=O)N2CC(n3cc[nH+]c3)C2)C1 ZINC000532092070 323200628 /nfs/dbraw/zinc/20/06/28/323200628.db2.gz DKQYNMQJIGCWEK-NEPJUHHUSA-N 1 2 247.342 2.093 20 0 BEADLO COc1ccc[nH+]c1N1CCC[C@@H](F)C1 ZINC000527996189 323733785 /nfs/dbraw/zinc/73/37/85/323733785.db2.gz CSKIOHUVPNRINT-SECBINFHSA-N 1 2 210.252 2.029 20 0 BEADLO CC(C)c1nc(N[C@H]2[C@@H](C)[C@@H](C)O[C@H]2C)cc[nH+]1 ZINC000528204669 323780443 /nfs/dbraw/zinc/78/04/43/323780443.db2.gz IPTYNTPQDIGINW-NOHGZBONSA-N 1 2 249.358 2.246 20 0 BEADLO C[C@@H](O)C[N@H+](C)Cc1c(F)ccc(F)c1Cl ZINC000529574712 324348104 /nfs/dbraw/zinc/34/81/04/324348104.db2.gz QTARIDCQMKDEAB-SSDOTTSWSA-N 1 2 249.688 2.431 20 0 BEADLO C[C@@H](O)C[N@@H+](C)Cc1c(F)ccc(F)c1Cl ZINC000529574712 324348108 /nfs/dbraw/zinc/34/81/08/324348108.db2.gz QTARIDCQMKDEAB-SSDOTTSWSA-N 1 2 249.688 2.431 20 0 BEADLO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(F)cn2)c2nccn21 ZINC000529594659 324357481 /nfs/dbraw/zinc/35/74/81/324357481.db2.gz FGGISTXTAFRXJM-BXKDBHETSA-N 1 2 246.289 2.213 20 0 BEADLO Cc1ncc([C@@H](C)[N@H+]2C[C@H]3CC[C@@H](C2)O3)c(C)n1 ZINC000682439016 487964585 /nfs/dbraw/zinc/96/45/85/487964585.db2.gz VXDNLCSTXFBITH-RTXFEEFZSA-N 1 2 247.342 2.018 20 0 BEADLO Cc1ncc([C@@H](C)[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c(C)n1 ZINC000682439016 487964587 /nfs/dbraw/zinc/96/45/87/487964587.db2.gz VXDNLCSTXFBITH-RTXFEEFZSA-N 1 2 247.342 2.018 20 0 BEADLO CC(C)CCn1ccc(NCc2[nH]cc[nH+]2)n1 ZINC000130128242 325016475 /nfs/dbraw/zinc/01/64/75/325016475.db2.gz HAUUKZNFSMWZOH-UHFFFAOYSA-N 1 2 233.319 2.264 20 0 BEADLO Cc1ccccc1/C=C/C(=O)NCc1[nH]cc[nH+]1 ZINC000070991324 325048960 /nfs/dbraw/zinc/04/89/60/325048960.db2.gz OEUFRDRSVUEHLB-VOTSOKGWSA-N 1 2 241.294 2.048 20 0 BEADLO CCc1cccnc1[C@H](C)[NH2+]Cc1cc[nH]n1 ZINC000543740691 325107717 /nfs/dbraw/zinc/10/77/17/325107717.db2.gz UIGBXXSKYDIZNA-JTQLQIEISA-N 1 2 230.315 2.218 20 0 BEADLO Cn1cncc1C[NH2+]Cc1nc(C2CC2)cs1 ZINC000131144021 325121382 /nfs/dbraw/zinc/12/13/82/325121382.db2.gz QZBGCLZZIWXKAV-UHFFFAOYSA-N 1 2 248.355 2.044 20 0 BEADLO CCC[C@@H]1C[N@H+](CCC(F)(F)F)CCO1 ZINC000131415735 325147821 /nfs/dbraw/zinc/14/78/21/325147821.db2.gz ATYPFIUZQSZIDN-SECBINFHSA-N 1 2 225.254 2.440 20 0 BEADLO CCC[C@@H]1C[N@@H+](CCC(F)(F)F)CCO1 ZINC000131415735 325147822 /nfs/dbraw/zinc/14/78/22/325147822.db2.gz ATYPFIUZQSZIDN-SECBINFHSA-N 1 2 225.254 2.440 20 0 BEADLO COC(=O)[C@@H](c1cccnc1)[NH+]1CCCCCC1 ZINC000132430946 325215995 /nfs/dbraw/zinc/21/59/95/325215995.db2.gz YKXHWTBPBVIHSG-CYBMUJFWSA-N 1 2 248.326 2.172 20 0 BEADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1ncccc1O ZINC000564294240 325237928 /nfs/dbraw/zinc/23/79/28/325237928.db2.gz YZQMWKFJITUOQF-LLVKDONJSA-N 1 2 243.310 2.166 20 0 BEADLO CC[N@H+](Cc1nc([C@H]2C[C@@H]2C)no1)C1CC1 ZINC000546481366 325284053 /nfs/dbraw/zinc/28/40/53/325284053.db2.gz NRYISPIAOJGLPG-WPRPVWTQSA-N 1 2 221.304 2.177 20 0 BEADLO CC[N@@H+](Cc1nc([C@H]2C[C@@H]2C)no1)C1CC1 ZINC000546481366 325284058 /nfs/dbraw/zinc/28/40/58/325284058.db2.gz NRYISPIAOJGLPG-WPRPVWTQSA-N 1 2 221.304 2.177 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nccn2CC)CCS1 ZINC000076072379 325328755 /nfs/dbraw/zinc/32/87/55/325328755.db2.gz HHRIPTAEIWVBJO-LLVKDONJSA-N 1 2 239.388 2.230 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nccn2CC)CCS1 ZINC000076072379 325328757 /nfs/dbraw/zinc/32/87/57/325328757.db2.gz HHRIPTAEIWVBJO-LLVKDONJSA-N 1 2 239.388 2.230 20 0 BEADLO C[C@H]1CC[C@@H](c2nc(Cc3c[nH+]cn3C)no2)C1 ZINC000547257104 325334263 /nfs/dbraw/zinc/33/42/63/325334263.db2.gz KHVGBYPXCMTGJI-VHSXEESVSA-N 1 2 246.314 2.298 20 0 BEADLO C[C@@H]1CCC[C@H]1CC(=O)N1CC(n2cc[nH+]c2)C1 ZINC000547424659 325353309 /nfs/dbraw/zinc/35/33/09/325353309.db2.gz IRLLPFAYHVIYFN-NEPJUHHUSA-N 1 2 247.342 2.093 20 0 BEADLO Cc1c[nH+]cc(N[C@@H](C)[C@H]2CCOC2)c1 ZINC000134342687 325354281 /nfs/dbraw/zinc/35/42/81/325354281.db2.gz IXYGSTPDKSFWPZ-QWRGUYRKSA-N 1 2 206.289 2.227 20 0 BEADLO C[C@@H](CC(C)(C)C)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000548128832 325433279 /nfs/dbraw/zinc/43/32/79/325433279.db2.gz MYBVTRYUBJMDLH-NSHDSACASA-N 1 2 249.358 2.339 20 0 BEADLO CCc1noc([C@H](C)[NH+]2[C@@H](C)C[C@@H]2C)n1 ZINC000548424814 325456110 /nfs/dbraw/zinc/45/61/10/325456110.db2.gz XAYXOJYEPPKIBM-CIUDSAMLSA-N 1 2 209.293 2.176 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CC3CCC2CC3)c[nH+]1 ZINC000550153820 325524652 /nfs/dbraw/zinc/52/46/52/325524652.db2.gz ZMQDVIZPSRCQLX-VQXHTEKXSA-N 1 2 233.315 2.027 20 0 BEADLO Cc1ccccc1NC(=O)C[NH+]1CC(C)(C)C1 ZINC000552814587 325666308 /nfs/dbraw/zinc/66/63/08/325666308.db2.gz YYYHAWCBXUTAAP-UHFFFAOYSA-N 1 2 232.327 2.275 20 0 BEADLO CC1(C)C[NH+](CC(=O)N[C@@H]2CCCC2(C)C)C1 ZINC000553497940 325694086 /nfs/dbraw/zinc/69/40/86/325694086.db2.gz IUSMLDYIQVDCPJ-LLVKDONJSA-N 1 2 238.375 2.023 20 0 BEADLO CC(C)(C(=O)NCCCCn1cc[nH+]c1)C1CC1 ZINC000554403203 325719069 /nfs/dbraw/zinc/71/90/69/325719069.db2.gz CYEXEEXPEDWLIT-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO CCCC[C@@H]1CCC[C@H]1NC(=O)Cn1cc[nH+]c1 ZINC000555221633 325750010 /nfs/dbraw/zinc/75/00/10/325750010.db2.gz KCXBYZMGEVGUON-CHWSQXEVSA-N 1 2 249.358 2.358 20 0 BEADLO COC(=O)[C@](C)([NH2+]CC1=CCCCC1)C1CC1 ZINC000556249300 325787308 /nfs/dbraw/zinc/78/73/08/325787308.db2.gz ZKPICQNBEDLKPT-CQSZACIVSA-N 1 2 237.343 2.418 20 0 BEADLO CCC[C@]1(CO)CCN(c2nc(C)[nH+]cc2C)C1 ZINC000564668608 325802837 /nfs/dbraw/zinc/80/28/37/325802837.db2.gz VEJNUJRIEYDDBQ-AWEZNQCLSA-N 1 2 249.358 2.082 20 0 BEADLO Cc1cc(NC[C@@H]2CC[C@H]3C[C@H]3C2)nc[nH+]1 ZINC000403508148 325808193 /nfs/dbraw/zinc/80/81/93/325808193.db2.gz AMRHXBXESNQWCJ-GRYCIOLGSA-N 1 2 217.316 2.055 20 0 BEADLO C[C@H](CC(=O)N1CCCC(C)(C)C1)n1cc[nH+]c1 ZINC000566328345 326033825 /nfs/dbraw/zinc/03/38/25/326033825.db2.gz NJIIXTHMNIEKIL-GFCCVEGCSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1[nH]nc2ncc(C[N@@H+]3CCC[C@H](F)C3)cc12 ZINC000566352900 326036307 /nfs/dbraw/zinc/03/63/07/326036307.db2.gz AWVFJJYQPYHMFH-NSHDSACASA-N 1 2 248.305 2.200 20 0 BEADLO Cc1[nH]nc2ncc(C[N@H+]3CCC[C@H](F)C3)cc12 ZINC000566352900 326036308 /nfs/dbraw/zinc/03/63/08/326036308.db2.gz AWVFJJYQPYHMFH-NSHDSACASA-N 1 2 248.305 2.200 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)c2cccs2)[nH+]1 ZINC000566364305 326037563 /nfs/dbraw/zinc/03/75/63/326037563.db2.gz LSYGNKDTBMMFSI-UHFFFAOYSA-N 1 2 249.339 2.445 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N[C@H]1CCC[C@@H](C)C1 ZINC000566432742 326046339 /nfs/dbraw/zinc/04/63/39/326046339.db2.gz IFTSMDJXQQCSJU-WOPDTQHZSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N[C@H]1CCC[C@@H](C)C1 ZINC000566432742 326046342 /nfs/dbraw/zinc/04/63/42/326046342.db2.gz IFTSMDJXQQCSJU-WOPDTQHZSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1CCCC[C@H](C)C1 ZINC000566452546 326050306 /nfs/dbraw/zinc/05/03/06/326050306.db2.gz ZGRKUFMCTDCYDV-RYUDHWBXSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1CCCC[C@H](C)C1 ZINC000566452546 326050307 /nfs/dbraw/zinc/05/03/07/326050307.db2.gz ZGRKUFMCTDCYDV-RYUDHWBXSA-N 1 2 249.358 2.237 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000566467581 326052059 /nfs/dbraw/zinc/05/20/59/326052059.db2.gz VUWPBZJMOGYFCQ-DMDPSCGWSA-N 1 2 249.358 2.139 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000566467581 326052061 /nfs/dbraw/zinc/05/20/61/326052061.db2.gz VUWPBZJMOGYFCQ-DMDPSCGWSA-N 1 2 249.358 2.139 20 0 BEADLO COc1cc(C[NH2+]Cc2ncccn2)ccc1C ZINC000566500070 326059541 /nfs/dbraw/zinc/05/95/41/326059541.db2.gz HYWRYUXIUFBTKC-UHFFFAOYSA-N 1 2 243.310 2.083 20 0 BEADLO c1nnc([C@H]([NH2+][C@H]2CC23CC3)c2ccccc2)[nH]1 ZINC000566614719 326067819 /nfs/dbraw/zinc/06/78/19/326067819.db2.gz KTDFIDALVMHCEA-NWDGAFQWSA-N 1 2 240.310 2.036 20 0 BEADLO c1nnc([C@H]([NH2+][C@@H]2CC23CC3)c2ccccc2)[nH]1 ZINC000566614721 326067918 /nfs/dbraw/zinc/06/79/18/326067918.db2.gz KTDFIDALVMHCEA-VXGBXAGGSA-N 1 2 240.310 2.036 20 0 BEADLO CCC(C)(C)CNC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000566858097 326088679 /nfs/dbraw/zinc/08/86/79/326088679.db2.gz KIUTVXVKBXQYMU-NSHDSACASA-N 1 2 237.347 2.387 20 0 BEADLO CC[C@@]1(C)C[C@@H]1C(=O)N(C)CCCn1cc[nH+]c1 ZINC000154960861 326174817 /nfs/dbraw/zinc/17/48/17/326174817.db2.gz FONIDXSMKOLSNA-OCCSQVGLSA-N 1 2 249.358 2.168 20 0 BEADLO c1nnc(SCc2c[nH+]c3ccccn23)s1 ZINC000155889431 326213515 /nfs/dbraw/zinc/21/35/15/326213515.db2.gz YQFWHCLVOQKZOG-UHFFFAOYSA-N 1 2 248.336 2.478 20 0 BEADLO CCc1nc(C(=O)Nc2cc[nH+]cc2C)co1 ZINC000155870133 326213753 /nfs/dbraw/zinc/21/37/53/326213753.db2.gz WDKZPIULUJVAMW-UHFFFAOYSA-N 1 2 231.255 2.193 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccc(C)cn2)CCO1 ZINC000156078419 326218466 /nfs/dbraw/zinc/21/84/66/326218466.db2.gz QDFBJIDQXVBUBD-ZDUSSCGKSA-N 1 2 220.316 2.001 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccc(C)cn2)CCO1 ZINC000156078419 326218468 /nfs/dbraw/zinc/21/84/68/326218468.db2.gz QDFBJIDQXVBUBD-ZDUSSCGKSA-N 1 2 220.316 2.001 20 0 BEADLO C[C@@H](CC(=O)NC(C)(C)C1CC1)n1cc[nH+]c1 ZINC000567993849 326293521 /nfs/dbraw/zinc/29/35/21/326293521.db2.gz XQSXMYINFZCOPV-JTQLQIEISA-N 1 2 235.331 2.139 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCC(C)(C)C ZINC000568107798 326309396 /nfs/dbraw/zinc/30/93/96/326309396.db2.gz YVQUWWBTAMNRRU-UHFFFAOYSA-N 1 2 207.321 2.363 20 0 BEADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1ncccn1)CC2 ZINC000568276946 326340069 /nfs/dbraw/zinc/34/00/69/326340069.db2.gz RKRJCBYNMQSKME-CYBMUJFWSA-N 1 2 243.285 2.393 20 0 BEADLO CCn1nc(CNc2c[nH]c[nH+]2)c2ccccc21 ZINC000568338548 326345414 /nfs/dbraw/zinc/34/54/14/326345414.db2.gz OJZQWODGPNZRIM-UHFFFAOYSA-N 1 2 241.298 2.391 20 0 BEADLO C[C@@H]1C[C@H](C)N1C(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000568363258 326349663 /nfs/dbraw/zinc/34/96/63/326349663.db2.gz CNDWZUBAZGGBCE-MMWGEVLESA-N 1 2 248.330 2.081 20 0 BEADLO Cc1noc(C)c1NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000568752249 326375041 /nfs/dbraw/zinc/37/50/41/326375041.db2.gz CTSSDIARAXNRPC-MRVPVSSYSA-N 1 2 248.286 2.078 20 0 BEADLO C[C@H](NC(=O)Cn1cc[nH+]c1)[C@H]1CCC[C@H](C)C1 ZINC000568956343 326383498 /nfs/dbraw/zinc/38/34/98/326383498.db2.gz BXQUSMSMRNBAJT-AVGNSLFASA-N 1 2 249.358 2.214 20 0 BEADLO C[C@H](NC(=O)Cn1cc[nH+]c1)[C@@H]1CCC[C@H](C)C1 ZINC000568956345 326383512 /nfs/dbraw/zinc/38/35/12/326383512.db2.gz BXQUSMSMRNBAJT-RWMBFGLXSA-N 1 2 249.358 2.214 20 0 BEADLO c1nc(C2CC2)c(C[NH2+]Cc2ncccn2)s1 ZINC000573221520 326436642 /nfs/dbraw/zinc/43/66/42/326436642.db2.gz GCXMTQKFRIQPPJ-UHFFFAOYSA-N 1 2 246.339 2.100 20 0 BEADLO Cc1nc(N2CC3(CC(F)C3)C2)c(C)c(C)[nH+]1 ZINC000677124931 487976025 /nfs/dbraw/zinc/97/60/25/487976025.db2.gz ZJWKZWIWIGEFAB-UHFFFAOYSA-N 1 2 235.306 2.340 20 0 BEADLO CC(C)[C@@H](C)N(C)C(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000666027313 487986363 /nfs/dbraw/zinc/98/63/63/487986363.db2.gz PXYWFPBGPKTWPF-IJLUTSLNSA-N 1 2 249.358 2.027 20 0 BEADLO CCN1CC[N@@H+]([C@H](C)c2cccnc2)C[C@@H]1C ZINC000677195627 487999034 /nfs/dbraw/zinc/99/90/34/487999034.db2.gz PIMSUFVODWSHMK-QWHCGFSZSA-N 1 2 233.359 2.169 20 0 BEADLO CCN1CC[N@H+]([C@H](C)c2cccnc2)C[C@@H]1C ZINC000677195627 487999039 /nfs/dbraw/zinc/99/90/39/487999039.db2.gz PIMSUFVODWSHMK-QWHCGFSZSA-N 1 2 233.359 2.169 20 0 BEADLO CCC[C@@H](CC)NC(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000667423347 488000945 /nfs/dbraw/zinc/00/09/45/488000945.db2.gz MQQUZTJWSGWNHO-IJLUTSLNSA-N 1 2 249.358 2.219 20 0 BEADLO Oc1ccc2c(c1)[C@H]([NH2+]Cc1csnn1)CC2 ZINC000668615266 488008721 /nfs/dbraw/zinc/00/87/21/488008721.db2.gz LFBBYBPMZLFEOP-GFCCVEGCSA-N 1 2 247.323 2.021 20 0 BEADLO CC(C)[C@H]1CCCN1c1cc(CO)cc[nH+]1 ZINC000084126803 488008745 /nfs/dbraw/zinc/00/87/45/488008745.db2.gz ZWTQHGCXVNQMGF-GFCCVEGCSA-N 1 2 220.316 2.199 20 0 BEADLO Cc1nc2[nH]ccc2c(N(C)[C@@H]2CCSC2)[nH+]1 ZINC000677310475 488011592 /nfs/dbraw/zinc/01/15/92/488011592.db2.gz MUVZRKQMOOTVDA-SECBINFHSA-N 1 2 248.355 2.208 20 0 BEADLO c1c2ccncc2sc1C[NH+]1CCOCC1 ZINC000667461503 488012989 /nfs/dbraw/zinc/01/29/89/488012989.db2.gz DDQUNFNJNSTTSU-UHFFFAOYSA-N 1 2 234.324 2.129 20 0 BEADLO Fc1cccn2cc(C[NH2+]Cc3ccoc3)nc12 ZINC000677320489 488016750 /nfs/dbraw/zinc/01/67/50/488016750.db2.gz ZYYPOUCEYARHNW-UHFFFAOYSA-N 1 2 245.257 2.356 20 0 BEADLO O[C@H]1CCC[N@H+](Cc2ccc(F)c(F)c2F)C1 ZINC000667472257 488017266 /nfs/dbraw/zinc/01/72/66/488017266.db2.gz AEIRVCIZGDKLNP-VIFPVBQESA-N 1 2 245.244 2.061 20 0 BEADLO O[C@H]1CCC[N@@H+](Cc2ccc(F)c(F)c2F)C1 ZINC000667472257 488017269 /nfs/dbraw/zinc/01/72/69/488017269.db2.gz AEIRVCIZGDKLNP-VIFPVBQESA-N 1 2 245.244 2.061 20 0 BEADLO Cc1cc(NC(=O)N(C)C[C@H]2CC2(C)C)cc[nH+]1 ZINC000666489099 488026006 /nfs/dbraw/zinc/02/60/06/488026006.db2.gz AACFWBDAAQUIEV-LLVKDONJSA-N 1 2 247.342 2.322 20 0 BEADLO CCc1ccc(C[NH2+]Cc2cc(C)ncn2)o1 ZINC000677425614 488034283 /nfs/dbraw/zinc/03/42/83/488034283.db2.gz XNXCREGMDXEYPI-UHFFFAOYSA-N 1 2 231.299 2.230 20 0 BEADLO CCc1noc(C[N@@H+](C)Cc2ccn(CC)c2)n1 ZINC000682779520 488040704 /nfs/dbraw/zinc/04/07/04/488040704.db2.gz KUDWLBRBGVJZES-UHFFFAOYSA-N 1 2 248.330 2.085 20 0 BEADLO CCc1noc(C[N@H+](C)Cc2ccn(CC)c2)n1 ZINC000682779520 488040708 /nfs/dbraw/zinc/04/07/08/488040708.db2.gz KUDWLBRBGVJZES-UHFFFAOYSA-N 1 2 248.330 2.085 20 0 BEADLO FC[C@@H]1C[N@H+](CCc2ccccc2F)CCO1 ZINC000411855962 488076737 /nfs/dbraw/zinc/07/67/37/488076737.db2.gz ZSDLUSZUMXUWFN-GFCCVEGCSA-N 1 2 241.281 2.039 20 0 BEADLO FC[C@@H]1C[N@@H+](CCc2ccccc2F)CCO1 ZINC000411855962 488076741 /nfs/dbraw/zinc/07/67/41/488076741.db2.gz ZSDLUSZUMXUWFN-GFCCVEGCSA-N 1 2 241.281 2.039 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2oc(C)nc2C)CCO1 ZINC000685569278 488077575 /nfs/dbraw/zinc/07/75/75/488077575.db2.gz AIFGRPOTYCBTRJ-LBPRGKRZSA-N 1 2 238.331 2.292 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2oc(C)nc2C)CCO1 ZINC000685569278 488077579 /nfs/dbraw/zinc/07/75/79/488077579.db2.gz AIFGRPOTYCBTRJ-LBPRGKRZSA-N 1 2 238.331 2.292 20 0 BEADLO CCCn1nccc1C[N@H+](C)Cc1cccn1C ZINC000667659709 488077915 /nfs/dbraw/zinc/07/79/15/488077915.db2.gz QGURPVARNRSDQN-UHFFFAOYSA-N 1 2 246.358 2.264 20 0 BEADLO CCCn1nccc1C[N@@H+](C)Cc1cccn1C ZINC000667659709 488077918 /nfs/dbraw/zinc/07/79/18/488077918.db2.gz QGURPVARNRSDQN-UHFFFAOYSA-N 1 2 246.358 2.264 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@H]1CCC1(C)C ZINC000667679493 488084739 /nfs/dbraw/zinc/08/47/39/488084739.db2.gz GNGVBIDSUTZCTQ-SECBINFHSA-N 1 2 234.299 2.465 20 0 BEADLO Cc1ccnc(C[NH+](C)[C@H]2CC[N@H+](C)[C@H](C)C2)c1 ZINC000683010616 488090614 /nfs/dbraw/zinc/09/06/14/488090614.db2.gz CIFDNNGOQCENOW-HIFRSBDPSA-N 1 2 247.386 2.305 20 0 BEADLO Cc1ccnc(C[NH+](C)[C@H]2CC[N@@H+](C)[C@H](C)C2)c1 ZINC000683010616 488090617 /nfs/dbraw/zinc/09/06/17/488090617.db2.gz CIFDNNGOQCENOW-HIFRSBDPSA-N 1 2 247.386 2.305 20 0 BEADLO Cc1cnc(C[N@@H+]2CC(C)(C)OCC2(C)C)nc1 ZINC000677686421 488093012 /nfs/dbraw/zinc/09/30/12/488093012.db2.gz XNTUMSYODWGIPY-UHFFFAOYSA-N 1 2 249.358 2.174 20 0 BEADLO Cc1cnc(C[N@H+]2CC(C)(C)OCC2(C)C)nc1 ZINC000677686421 488093013 /nfs/dbraw/zinc/09/30/13/488093013.db2.gz XNTUMSYODWGIPY-UHFFFAOYSA-N 1 2 249.358 2.174 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2cc(C)ccn2)CCO1 ZINC000683019270 488094611 /nfs/dbraw/zinc/09/46/11/488094611.db2.gz NRIPKRSZMRMRGZ-AWEZNQCLSA-N 1 2 234.343 2.391 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2cc(C)ccn2)CCO1 ZINC000683019270 488094615 /nfs/dbraw/zinc/09/46/15/488094615.db2.gz NRIPKRSZMRMRGZ-AWEZNQCLSA-N 1 2 234.343 2.391 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCO[C@H](C3CC3)C2)c1 ZINC000683022980 488098281 /nfs/dbraw/zinc/09/82/81/488098281.db2.gz GIVZWKWTRUIRTK-AWEZNQCLSA-N 1 2 232.327 2.001 20 0 BEADLO Cc1ccnc(C[N@H+]2CCO[C@H](C3CC3)C2)c1 ZINC000683022980 488098284 /nfs/dbraw/zinc/09/82/84/488098284.db2.gz GIVZWKWTRUIRTK-AWEZNQCLSA-N 1 2 232.327 2.001 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCc3ncsc3C2)c1 ZINC000683027723 488100016 /nfs/dbraw/zinc/10/00/16/488100016.db2.gz RHHHXXJOEKGFMY-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ccnc(C[N@H+]2CCc3ncsc3C2)c1 ZINC000683027723 488100021 /nfs/dbraw/zinc/10/00/21/488100021.db2.gz RHHHXXJOEKGFMY-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO CCn1ccc(C[N@H+](C)Cc2ncc(C)cn2)c1 ZINC000683030085 488100682 /nfs/dbraw/zinc/10/06/82/488100682.db2.gz SKWYYRWHXMSDSF-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1ccc(C[N@@H+](C)Cc2ncc(C)cn2)c1 ZINC000683030085 488100683 /nfs/dbraw/zinc/10/06/83/488100683.db2.gz SKWYYRWHXMSDSF-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO Cc1cnc(N2CCCC[C@@H]2c2[nH]cc[nH+]2)nc1 ZINC000677508049 488115237 /nfs/dbraw/zinc/11/52/37/488115237.db2.gz RUQKXGDDUWNWOB-LLVKDONJSA-N 1 2 243.314 2.240 20 0 BEADLO FC(F)[C@@H]1CCC[N@@H+]1C[C@@H]1CCCCO1 ZINC000677737512 488115962 /nfs/dbraw/zinc/11/59/62/488115962.db2.gz HBEJQOOHXBMYQC-UWVGGRQHSA-N 1 2 219.275 2.285 20 0 BEADLO FC(F)[C@@H]1CCC[N@H+]1C[C@@H]1CCCCO1 ZINC000677737512 488115967 /nfs/dbraw/zinc/11/59/67/488115967.db2.gz HBEJQOOHXBMYQC-UWVGGRQHSA-N 1 2 219.275 2.285 20 0 BEADLO C[C@H](c1cccc(F)c1)[N@H+](C)Cc1cn(C)nn1 ZINC000677761595 488119422 /nfs/dbraw/zinc/11/94/22/488119422.db2.gz PUNWBWPDHAADOM-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO C[C@H](c1cccc(F)c1)[N@@H+](C)Cc1cn(C)nn1 ZINC000677761595 488119428 /nfs/dbraw/zinc/11/94/28/488119428.db2.gz PUNWBWPDHAADOM-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO Cn1c[nH+]cc1CN1CCCOc2ccccc21 ZINC000677764109 488120011 /nfs/dbraw/zinc/12/00/11/488120011.db2.gz KZRFFFPCYCUMCE-UHFFFAOYSA-N 1 2 243.310 2.209 20 0 BEADLO CCC(C)(C)CNC(=O)CCCn1cc[nH+]c1 ZINC000683219125 488132825 /nfs/dbraw/zinc/13/28/25/488132825.db2.gz VTPJHRZSURUUJH-UHFFFAOYSA-N 1 2 237.347 2.216 20 0 BEADLO C[C@H]([NH2+]Cc1csnn1)c1ccsc1 ZINC000061361397 487472124 /nfs/dbraw/zinc/47/21/24/487472124.db2.gz ZKARZMFZNAJVDJ-ZETCQYMHSA-N 1 2 225.342 2.450 20 0 BEADLO Cc1cn2c([nH+]1)CN([C@H](C)c1ccccn1)CC2 ZINC000679867519 487477242 /nfs/dbraw/zinc/47/72/42/487477242.db2.gz GHJJTYILIAWUCR-GFCCVEGCSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1nc(N[C@H](C)C[C@H](C)O)c2c([nH+]1)CCCC2 ZINC000679932676 487495855 /nfs/dbraw/zinc/49/58/55/487495855.db2.gz MMXOJPVPPGHGRX-ZJUUUORDSA-N 1 2 249.358 2.235 20 0 BEADLO Cc1cc(N[C@H](C)C[C@H](C)O)nc(C2CC2)[nH+]1 ZINC000679934100 487497033 /nfs/dbraw/zinc/49/70/33/487497033.db2.gz YDMPIJPPMBPTHU-SCZZXKLOSA-N 1 2 235.331 2.234 20 0 BEADLO Cc1noc(C[NH2+][C@@H](C)c2ccsc2)n1 ZINC000050344212 487497309 /nfs/dbraw/zinc/49/73/09/487497309.db2.gz PCKFEERJPBCVFS-ZETCQYMHSA-N 1 2 223.301 2.290 20 0 BEADLO CCc1noc(C[NH2+][C@H](C)c2cnccc2C)n1 ZINC000679942008 487500159 /nfs/dbraw/zinc/50/01/59/487500159.db2.gz JSDIGUZDDGRZIH-SNVBAGLBSA-N 1 2 246.314 2.186 20 0 BEADLO CCCn1nccc1C[NH+]1CC2(CC(F)C2)C1 ZINC000668232467 487501119 /nfs/dbraw/zinc/50/11/19/487501119.db2.gz SDGBSZXBCTVDBK-UHFFFAOYSA-N 1 2 237.322 2.227 20 0 BEADLO Cc1nc(NC[C@@H](C)c2ccncc2)cc[nH+]1 ZINC000674066435 487508678 /nfs/dbraw/zinc/50/86/78/487508678.db2.gz MEYWVUGMVARWSQ-SNVBAGLBSA-N 1 2 228.299 2.396 20 0 BEADLO CCC1(C)C[NH+](Cc2cc3n(n2)CCC3)C1 ZINC000668234011 487509494 /nfs/dbraw/zinc/50/94/94/487509494.db2.gz WONGRDNDUSBABD-UHFFFAOYSA-N 1 2 219.332 2.061 20 0 BEADLO CC[C@@H](C)CN(CC)c1cc(CO)cc[nH+]1 ZINC000086438249 487509879 /nfs/dbraw/zinc/50/98/79/487509879.db2.gz VVKFVSLHYCCJAE-LLVKDONJSA-N 1 2 222.332 2.446 20 0 BEADLO O=C(CCCn1cc[nH+]c1)N1CC[C@@H]2CCC[C@@H]21 ZINC000681747368 487525963 /nfs/dbraw/zinc/52/59/63/487525963.db2.gz JRGSBOROWPKWHA-STQMWFEESA-N 1 2 247.342 2.064 20 0 BEADLO O=C(CCCn1cc[nH+]c1)N1CC[C@@H]2CCC[C@H]21 ZINC000681747364 487526008 /nfs/dbraw/zinc/52/60/08/487526008.db2.gz JRGSBOROWPKWHA-QWHCGFSZSA-N 1 2 247.342 2.064 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+]2CCC(F)(F)[C@@H](C)C2)n1 ZINC000685590960 487560361 /nfs/dbraw/zinc/56/03/61/487560361.db2.gz CXYBUCXDTYAGQX-JGVFFNPUSA-N 1 2 245.273 2.416 20 0 BEADLO Cc1noc([C@@H](C)[N@H+]2CCC(F)(F)[C@@H](C)C2)n1 ZINC000685590960 487560366 /nfs/dbraw/zinc/56/03/66/487560366.db2.gz CXYBUCXDTYAGQX-JGVFFNPUSA-N 1 2 245.273 2.416 20 0 BEADLO CC1(C)CN(C(=O)Nc2ccn3cc[nH+]c3c2)C1 ZINC000685651545 487571061 /nfs/dbraw/zinc/57/10/61/487571061.db2.gz BSUDLZYVJUAUEL-UHFFFAOYSA-N 1 2 244.298 2.208 20 0 BEADLO C[C@@H](Cc1nc(-c2ccco2)no1)n1cc[nH+]c1 ZINC000351425841 487660521 /nfs/dbraw/zinc/66/05/21/487660521.db2.gz XORBUCCDPHPCBR-VIFPVBQESA-N 1 2 244.254 2.330 20 0 BEADLO C[C@H](O)C(C)(C)Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000677810910 488128993 /nfs/dbraw/zinc/12/89/93/488128993.db2.gz YWQQDOOQPDPEJO-VIFPVBQESA-N 1 2 237.347 2.345 20 0 BEADLO CCC(C)(CC)NC(=O)[C@H]1CCc2c[nH+]cn2C1 ZINC000668705543 488144316 /nfs/dbraw/zinc/14/43/16/488144316.db2.gz KIHJRQFAMXXTSG-NSHDSACASA-N 1 2 249.358 2.140 20 0 BEADLO CCOC1(C)C[NH+](Cc2ccc(C)nc2)C1 ZINC000459620642 488145367 /nfs/dbraw/zinc/14/53/67/488145367.db2.gz MFAOALSDSSQOHG-UHFFFAOYSA-N 1 2 220.316 2.001 20 0 BEADLO CCC(C)(CC)NC(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000668706712 488147253 /nfs/dbraw/zinc/14/72/53/488147253.db2.gz WEGBKLJMNVSYMU-JTQLQIEISA-N 1 2 249.358 2.210 20 0 BEADLO CCC(C)(CC)NC(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000668706712 488147258 /nfs/dbraw/zinc/14/72/58/488147258.db2.gz WEGBKLJMNVSYMU-JTQLQIEISA-N 1 2 249.358 2.210 20 0 BEADLO CCc1cc(N[C@@H]2CS[C@@H](C)C2)nc[nH+]1 ZINC000397794604 488150054 /nfs/dbraw/zinc/15/00/54/488150054.db2.gz FPTBJOZYZZDHJX-WPRPVWTQSA-N 1 2 223.345 2.345 20 0 BEADLO CC[N@H+](Cc1ccccn1)[C@H](C)c1nc(C)no1 ZINC000677892946 488150708 /nfs/dbraw/zinc/15/07/08/488150708.db2.gz ZVRQTKDNWPAAEN-SNVBAGLBSA-N 1 2 246.314 2.356 20 0 BEADLO CC[N@@H+](Cc1ccccn1)[C@H](C)c1nc(C)no1 ZINC000677892946 488150710 /nfs/dbraw/zinc/15/07/10/488150710.db2.gz ZVRQTKDNWPAAEN-SNVBAGLBSA-N 1 2 246.314 2.356 20 0 BEADLO CC[N@H+](CCC(F)(F)F)Cc1cocn1 ZINC000683353028 488151105 /nfs/dbraw/zinc/15/11/05/488151105.db2.gz RCOIBGVNDWRZFF-UHFFFAOYSA-N 1 2 222.210 2.449 20 0 BEADLO CC[N@@H+](CCC(F)(F)F)Cc1cocn1 ZINC000683353028 488151108 /nfs/dbraw/zinc/15/11/08/488151108.db2.gz RCOIBGVNDWRZFF-UHFFFAOYSA-N 1 2 222.210 2.449 20 0 BEADLO Cc1ccc(N[C@@H]2CO[C@@H](C3CC3)C2)c[nH+]1 ZINC000667909620 488153767 /nfs/dbraw/zinc/15/37/67/488153767.db2.gz YLQDLKIYHXETMK-QWHCGFSZSA-N 1 2 218.300 2.369 20 0 BEADLO C[C@@H]1CCN(Cc2c[nH+]c3n2CCC3)C[C@@H]1F ZINC000667943713 488162895 /nfs/dbraw/zinc/16/28/95/488162895.db2.gz YLVSAPRQEBMQET-PWSUYJOCSA-N 1 2 237.322 2.009 20 0 BEADLO Cc1cccn2c(NC(=O)N(C)C3CC3)c[nH+]c12 ZINC000667951133 488167153 /nfs/dbraw/zinc/16/71/53/488167153.db2.gz ZXIUWBJPMQCENH-UHFFFAOYSA-N 1 2 244.298 2.269 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)c1nccs1 ZINC000683549637 488192944 /nfs/dbraw/zinc/19/29/44/488192944.db2.gz MORXEZDPAXMWHF-UHFFFAOYSA-N 1 2 244.279 2.043 20 0 BEADLO CCC[C@H](C)NC(=O)Nc1cc(C)[nH+]cc1C ZINC000678097914 488197290 /nfs/dbraw/zinc/19/72/90/488197290.db2.gz CHLUJIVJLVIEDQ-JTQLQIEISA-N 1 2 235.331 2.430 20 0 BEADLO COCc1csc(C[N@@H+]2CCOC[C@H]2C)c1 ZINC000668069442 488198101 /nfs/dbraw/zinc/19/81/01/488198101.db2.gz QUNVNUTWSGKUIX-SNVBAGLBSA-N 1 2 241.356 2.115 20 0 BEADLO COCc1csc(C[N@H+]2CCOC[C@H]2C)c1 ZINC000668069442 488198104 /nfs/dbraw/zinc/19/81/04/488198104.db2.gz QUNVNUTWSGKUIX-SNVBAGLBSA-N 1 2 241.356 2.115 20 0 BEADLO OC1(Cn2cc[nH+]c2-c2cccnc2)CCCC1 ZINC000678107861 488198271 /nfs/dbraw/zinc/19/82/71/488198271.db2.gz GBLFOPHTTGCSEJ-UHFFFAOYSA-N 1 2 243.310 2.250 20 0 BEADLO CC[C@](C)(CNc1ccc(OC)c[nH+]1)OC ZINC000323040065 488201291 /nfs/dbraw/zinc/20/12/91/488201291.db2.gz ATHFNQCIUKMIBK-GFCCVEGCSA-N 1 2 224.304 2.317 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)[C@H]1CCCC2(CC2)C1 ZINC000668194006 488219722 /nfs/dbraw/zinc/21/97/22/488219722.db2.gz WRZXIODSYLYQRH-NSHDSACASA-N 1 2 247.342 2.007 20 0 BEADLO COc1ncccc1C[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000683787073 488222165 /nfs/dbraw/zinc/22/21/65/488222165.db2.gz YRCQTKDOKQZTOZ-ZYHUDNBSSA-N 1 2 238.306 2.270 20 0 BEADLO COc1ncccc1C[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000683787073 488222166 /nfs/dbraw/zinc/22/21/66/488222166.db2.gz YRCQTKDOKQZTOZ-ZYHUDNBSSA-N 1 2 238.306 2.270 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1CCC[C@H]2C[C@H]21 ZINC000668746737 488225477 /nfs/dbraw/zinc/22/54/77/488225477.db2.gz UHAZLGKEFXGJAX-YNEHKIRRSA-N 1 2 244.338 2.441 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@@H+]1Cc1[nH]nc2ccccc21 ZINC000678267367 488230830 /nfs/dbraw/zinc/23/08/30/488230830.db2.gz PQBAHEAGJSFAIH-MNOVXSKESA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1[nH]nc2ccccc21 ZINC000678267367 488230832 /nfs/dbraw/zinc/23/08/32/488230832.db2.gz PQBAHEAGJSFAIH-MNOVXSKESA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@@H+]1Cc1n[nH]c2ccccc21 ZINC000678267367 488230834 /nfs/dbraw/zinc/23/08/34/488230834.db2.gz PQBAHEAGJSFAIH-MNOVXSKESA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1n[nH]c2ccccc21 ZINC000678267367 488230835 /nfs/dbraw/zinc/23/08/35/488230835.db2.gz PQBAHEAGJSFAIH-MNOVXSKESA-N 1 2 245.326 2.172 20 0 BEADLO Fc1cccc([C@@H]2CC[N@@H+]2Cc2cc[nH]n2)c1 ZINC000678283267 488237251 /nfs/dbraw/zinc/23/72/51/488237251.db2.gz HEOCFVNKEMUWHH-ZDUSSCGKSA-N 1 2 231.274 2.496 20 0 BEADLO Fc1cccc([C@@H]2CC[N@H+]2Cc2cc[nH]n2)c1 ZINC000678283267 488237253 /nfs/dbraw/zinc/23/72/53/488237253.db2.gz HEOCFVNKEMUWHH-ZDUSSCGKSA-N 1 2 231.274 2.496 20 0 BEADLO CCC(C)(C)CC(=O)N[C@H]1CCc2c[nH+]cn2C1 ZINC000672153853 488242756 /nfs/dbraw/zinc/24/27/56/488242756.db2.gz CFFGNVAOOOQZEY-NSHDSACASA-N 1 2 249.358 2.140 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CCC3(CC3)C2)[nH+]1 ZINC000672274893 488249435 /nfs/dbraw/zinc/24/94/35/488249435.db2.gz NYVLPZFTYJQGDB-UHFFFAOYSA-N 1 2 228.299 2.257 20 0 BEADLO FC(F)[C@@H]1CCN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000672275048 488249482 /nfs/dbraw/zinc/24/94/82/488249482.db2.gz FNFDFVIUOHUQRM-SECBINFHSA-N 1 2 239.269 2.445 20 0 BEADLO Cc1cc(NC(=O)N2CCC[C@@H]3C[C@@H]32)c(C)c[nH+]1 ZINC000672712840 488264655 /nfs/dbraw/zinc/26/46/55/488264655.db2.gz DECUJKORFSADLH-YPMHNXCESA-N 1 2 245.326 2.137 20 0 BEADLO CC(C)(C)c1nc(NCCCCCO)cc[nH+]1 ZINC000684090668 488265316 /nfs/dbraw/zinc/26/53/16/488265316.db2.gz MJXXJAXGKOPDIY-UHFFFAOYSA-N 1 2 237.347 2.349 20 0 BEADLO O=C(Cn1cc[nH+]c1)Nc1ccc(C2CC2)cc1 ZINC000678573387 488267635 /nfs/dbraw/zinc/26/76/35/488267635.db2.gz QWYHEBCNZWRAEN-UHFFFAOYSA-N 1 2 241.294 2.399 20 0 BEADLO CC[C@@H]1CCC[C@@H](NC(=O)Cc2c[nH+]cn2C)C1 ZINC000672918931 488268869 /nfs/dbraw/zinc/26/88/69/488268869.db2.gz BCHMNQNMPJJCNR-VXGBXAGGSA-N 1 2 249.358 2.048 20 0 BEADLO FC(F)C[N@@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000678637152 488275049 /nfs/dbraw/zinc/27/50/49/488275049.db2.gz BOISTYOXHJAIOD-GHMZBOCLSA-N 1 2 233.302 2.390 20 0 BEADLO FC(F)C[N@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000678637152 488275051 /nfs/dbraw/zinc/27/50/51/488275051.db2.gz BOISTYOXHJAIOD-GHMZBOCLSA-N 1 2 233.302 2.390 20 0 BEADLO Cc1ccc(OCCNc2cc[nH+]cc2F)cc1 ZINC000678789217 488283275 /nfs/dbraw/zinc/28/32/75/488283275.db2.gz UNELIZVMBPMQAJ-UHFFFAOYSA-N 1 2 246.285 2.442 20 0 BEADLO COc1ccccc1CCNc1cc[nH+]cc1F ZINC000678789271 488283642 /nfs/dbraw/zinc/28/36/42/488283642.db2.gz WHLYXAILVQDISG-UHFFFAOYSA-N 1 2 246.285 2.306 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2c(C)noc2C)no1 ZINC000678804730 488285158 /nfs/dbraw/zinc/28/51/58/488285158.db2.gz RPMFWTOTTXLQIR-QMMMGPOBSA-N 1 2 235.287 2.439 20 0 BEADLO c1ccc(-c2noc(C[N@H+]3CC=CCC3)n2)cc1 ZINC000679321557 488336031 /nfs/dbraw/zinc/33/60/31/488336031.db2.gz IAMMHJPMDRMRMI-UHFFFAOYSA-N 1 2 241.294 2.499 20 0 BEADLO c1ccc(-c2noc(C[N@@H+]3CC=CCC3)n2)cc1 ZINC000679321557 488336032 /nfs/dbraw/zinc/33/60/32/488336032.db2.gz IAMMHJPMDRMRMI-UHFFFAOYSA-N 1 2 241.294 2.499 20 0 BEADLO COc1ccc[nH+]c1NC1C[C@H](C)O[C@@H](C)C1 ZINC000678941951 488296912 /nfs/dbraw/zinc/29/69/12/488296912.db2.gz ZDYHLZKVQWOBLC-UWVGGRQHSA-N 1 2 236.315 2.458 20 0 BEADLO CN(Cc1ccsc1)C(=O)CCc1c[nH+]c[nH]1 ZINC000684363300 488301281 /nfs/dbraw/zinc/30/12/81/488301281.db2.gz NWVLUKHVICCLHI-UHFFFAOYSA-N 1 2 249.339 2.062 20 0 BEADLO CN(Cc1ccsc1)C(=O)CCc1c[nH]c[nH+]1 ZINC000684363300 488301283 /nfs/dbraw/zinc/30/12/83/488301283.db2.gz NWVLUKHVICCLHI-UHFFFAOYSA-N 1 2 249.339 2.062 20 0 BEADLO COc1ccc(N[C@@H](C)c2cnccn2)[nH+]c1 ZINC000679068910 488304475 /nfs/dbraw/zinc/30/44/75/488304475.db2.gz SOKUJRPCDDNNLU-VIFPVBQESA-N 1 2 230.271 2.053 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CCC[C@H](OC)C1 ZINC000684391632 488304538 /nfs/dbraw/zinc/30/45/38/488304538.db2.gz CTDVXQBAHWNMRC-QWRGUYRKSA-N 1 2 236.315 2.460 20 0 BEADLO CCn1cc[nH+]c1CN[C@H](C1CC1)C(F)(F)F ZINC000673722644 488306164 /nfs/dbraw/zinc/30/61/64/488306164.db2.gz KDKFSLSGBJPSSX-SNVBAGLBSA-N 1 2 247.264 2.334 20 0 BEADLO COc1cccc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)n1 ZINC000679219249 488316989 /nfs/dbraw/zinc/31/69/89/488316989.db2.gz FNYQUDOGHNOLMJ-CMPLNLGQSA-N 1 2 238.306 2.270 20 0 BEADLO COc1cccc(C[N@H+]2CC[C@H](C)[C@H](F)C2)n1 ZINC000679219249 488316990 /nfs/dbraw/zinc/31/69/90/488316990.db2.gz FNYQUDOGHNOLMJ-CMPLNLGQSA-N 1 2 238.306 2.270 20 0 BEADLO COc1cc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)ccn1 ZINC000679223576 488320371 /nfs/dbraw/zinc/32/03/71/488320371.db2.gz QSCXSNBICZDTFQ-ZYHUDNBSSA-N 1 2 238.306 2.270 20 0 BEADLO COc1cc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)ccn1 ZINC000679223576 488320373 /nfs/dbraw/zinc/32/03/73/488320373.db2.gz QSCXSNBICZDTFQ-ZYHUDNBSSA-N 1 2 238.306 2.270 20 0 BEADLO COc1ccnc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)c1 ZINC000679223602 488320465 /nfs/dbraw/zinc/32/04/65/488320465.db2.gz QZNBAOLXWZZGDW-GWCFXTLKSA-N 1 2 238.306 2.270 20 0 BEADLO COc1ccnc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)c1 ZINC000679223602 488320466 /nfs/dbraw/zinc/32/04/66/488320466.db2.gz QZNBAOLXWZZGDW-GWCFXTLKSA-N 1 2 238.306 2.270 20 0 BEADLO COc1cc[nH+]c(CN2CC[C@H](C)[C@@H](F)C2)c1 ZINC000679223602 488320468 /nfs/dbraw/zinc/32/04/68/488320468.db2.gz QZNBAOLXWZZGDW-GWCFXTLKSA-N 1 2 238.306 2.270 20 0 BEADLO Cc1nc(N2CC(Cc3ccccc3)C2)cc[nH+]1 ZINC000679282220 488329065 /nfs/dbraw/zinc/32/90/65/488329065.db2.gz LTTJJVPOGAXRBA-UHFFFAOYSA-N 1 2 239.322 2.464 20 0 BEADLO c1ccc(-c2nnc(C[N@H+]3CC=CCC3)o2)cc1 ZINC000679324582 488337651 /nfs/dbraw/zinc/33/76/51/488337651.db2.gz XOXWZHYBBHIQIA-UHFFFAOYSA-N 1 2 241.294 2.499 20 0 BEADLO c1ccc(-c2nnc(C[N@@H+]3CC=CCC3)o2)cc1 ZINC000679324582 488337653 /nfs/dbraw/zinc/33/76/53/488337653.db2.gz XOXWZHYBBHIQIA-UHFFFAOYSA-N 1 2 241.294 2.499 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]Cc1cccc(CO)c1 ZINC000679341032 488341841 /nfs/dbraw/zinc/34/18/41/488341841.db2.gz WBSAUJSYENUNDX-JTQLQIEISA-N 1 2 245.326 2.061 20 0 BEADLO C[C@H]1CC[N@H+](Cc2cncs2)C[C@@H]1F ZINC000679357697 488344264 /nfs/dbraw/zinc/34/42/64/488344264.db2.gz DGDHGAFBVYKYTA-WPRPVWTQSA-N 1 2 214.309 2.323 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2cncs2)C[C@@H]1F ZINC000679357697 488344267 /nfs/dbraw/zinc/34/42/67/488344267.db2.gz DGDHGAFBVYKYTA-WPRPVWTQSA-N 1 2 214.309 2.323 20 0 BEADLO C[C@H]1CC[N@H+](Cc2cncs2)C[C@H]1F ZINC000679357696 488344368 /nfs/dbraw/zinc/34/43/68/488344368.db2.gz DGDHGAFBVYKYTA-WCBMZHEXSA-N 1 2 214.309 2.323 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2cncs2)C[C@H]1F ZINC000679357696 488344369 /nfs/dbraw/zinc/34/43/69/488344369.db2.gz DGDHGAFBVYKYTA-WCBMZHEXSA-N 1 2 214.309 2.323 20 0 BEADLO Cc1nn2c(C[N@H+]3CC=CCC3)c(C)nc2s1 ZINC000679357405 488344575 /nfs/dbraw/zinc/34/45/75/488344575.db2.gz NDSFZDJRJJROHZ-UHFFFAOYSA-N 1 2 248.355 2.170 20 0 BEADLO Cc1nn2c(C[N@@H+]3CC=CCC3)c(C)nc2s1 ZINC000679357405 488344577 /nfs/dbraw/zinc/34/45/77/488344577.db2.gz NDSFZDJRJJROHZ-UHFFFAOYSA-N 1 2 248.355 2.170 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)[C@H]1[C@@H]2CCC[C@@H]21 ZINC000684820790 488346167 /nfs/dbraw/zinc/34/61/67/488346167.db2.gz OFTCCWRDOVCJAF-PJXYFTJBSA-N 1 2 241.294 2.319 20 0 BEADLO Fc1cncc(NCc2c[nH+]c3ccccn23)c1 ZINC000684904468 488351696 /nfs/dbraw/zinc/35/16/96/488351696.db2.gz QPWFQCKEPNJAOW-UHFFFAOYSA-N 1 2 242.257 2.481 20 0 BEADLO FC(F)O[C@H]1CCCN(c2cccc[nH+]2)C1 ZINC000679709524 488363553 /nfs/dbraw/zinc/36/35/53/488363553.db2.gz DTLHJZGGGPONTJ-VIFPVBQESA-N 1 2 228.242 2.290 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@H](OC(F)F)C2)no1 ZINC000679682819 488364447 /nfs/dbraw/zinc/36/44/47/488364447.db2.gz JUMJFLZJWMFOBF-JTQLQIEISA-N 1 2 246.257 2.187 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@H](OC(F)F)C2)no1 ZINC000679682819 488364448 /nfs/dbraw/zinc/36/44/48/488364448.db2.gz JUMJFLZJWMFOBF-JTQLQIEISA-N 1 2 246.257 2.187 20 0 BEADLO C[C@@H]1CCCC[C@@]1(C)NC(=O)CCc1c[nH+]c[nH]1 ZINC000457293239 490117338 /nfs/dbraw/zinc/11/73/38/490117338.db2.gz PVNMDLRMNYAHJL-BXUZGUMPSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@@H]1CCCC[C@@]1(C)NC(=O)CCc1c[nH]c[nH+]1 ZINC000457293239 490117342 /nfs/dbraw/zinc/11/73/42/490117342.db2.gz PVNMDLRMNYAHJL-BXUZGUMPSA-N 1 2 249.358 2.427 20 0 BEADLO FC(F)C[NH2+]Cc1cc2cnccc2o1 ZINC000651806183 490142124 /nfs/dbraw/zinc/14/21/24/490142124.db2.gz WGMARVQCMMYGDV-UHFFFAOYSA-N 1 2 212.199 2.183 20 0 BEADLO CCc1cc(N[C@H]2CCCC[C@@H]2OC)nc[nH+]1 ZINC000078427182 490171715 /nfs/dbraw/zinc/17/17/15/490171715.db2.gz WFFOSEGQWOYYQC-RYUDHWBXSA-N 1 2 235.331 2.409 20 0 BEADLO Cc1cc(NC(=O)CCc2cccnc2)cc[nH+]1 ZINC000070890733 490245835 /nfs/dbraw/zinc/24/58/35/490245835.db2.gz MBXAUSYXXQYXLN-UHFFFAOYSA-N 1 2 241.294 2.356 20 0 BEADLO Cc1cc(N(CCCO)C2CC2)nc(C2CC2)[nH+]1 ZINC000674747366 490253695 /nfs/dbraw/zinc/25/36/95/490253695.db2.gz RUSJBXCZKKWOSH-UHFFFAOYSA-N 1 2 247.342 2.014 20 0 BEADLO COc1ccc(C[NH2+]Cc2ccon2)c(C)c1 ZINC000634969792 490510349 /nfs/dbraw/zinc/51/03/49/490510349.db2.gz YLAWBEWCNFGHHM-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO Cc1ccc(Cn2nnc3c2CCCC3)c(C)[nH+]1 ZINC000664141333 490571077 /nfs/dbraw/zinc/57/10/77/490571077.db2.gz QGHRQXYVSHVMMG-UHFFFAOYSA-N 1 2 242.326 2.217 20 0 BEADLO CCc1cc(N[C@H]2CCCSC2)nc[nH+]1 ZINC000129216222 490608279 /nfs/dbraw/zinc/60/82/79/490608279.db2.gz YGLNYHMEDQZLIO-JTQLQIEISA-N 1 2 223.345 2.347 20 0 BEADLO Cc1ccc(C[NH2+]Cc2ncc(C)o2)o1 ZINC000227083809 491055005 /nfs/dbraw/zinc/05/50/05/491055005.db2.gz JEKQKYQCGVQHES-UHFFFAOYSA-N 1 2 206.245 2.174 20 0 BEADLO Cc1cnc(C[NH2+]Cc2ccccc2F)o1 ZINC000227084286 491054973 /nfs/dbraw/zinc/05/49/73/491054973.db2.gz OBNOYUQSKOQFCU-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO CS[C@H](C)C(=O)Nc1c[nH+]c2c(C)cccn12 ZINC000598263444 491083805 /nfs/dbraw/zinc/08/38/05/491083805.db2.gz TURVPJBSFLRVDF-SECBINFHSA-N 1 2 249.339 2.333 20 0 BEADLO CC(C)n1ccnc1C[NH+]1CC2(C1)CCCOC2 ZINC000668232540 491084757 /nfs/dbraw/zinc/08/47/57/491084757.db2.gz VYTNODDNVWSRAL-UHFFFAOYSA-N 1 2 249.358 2.076 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+]2CCSC(C)(C)C2)n1 ZINC000083415869 491097103 /nfs/dbraw/zinc/09/71/03/491097103.db2.gz JFODMKLJWGOWHB-MRVPVSSYSA-N 1 2 241.360 2.266 20 0 BEADLO CC1(O)C[NH+](Cc2ccccc2C(F)(F)F)C1 ZINC000089647316 491117013 /nfs/dbraw/zinc/11/70/13/491117013.db2.gz CKIVMZIYIVQTDA-UHFFFAOYSA-N 1 2 245.244 2.272 20 0 BEADLO Cc1nc(NCCc2cn(C)c[nH+]2)sc1C ZINC000313481914 491125948 /nfs/dbraw/zinc/12/59/48/491125948.db2.gz IZNXDBJJGYSQRA-UHFFFAOYSA-N 1 2 236.344 2.148 20 0 BEADLO Cc1ncc([C@@H](C)[NH2+]Cc2ccon2)s1 ZINC000090418700 491126747 /nfs/dbraw/zinc/12/67/47/491126747.db2.gz VOHOWTXNPWULNI-SSDOTTSWSA-N 1 2 223.301 2.290 20 0 BEADLO CCn1nc(C)c(C[NH2+][C@@H](C)c2ncc[nH]2)c1C ZINC000307969696 491134874 /nfs/dbraw/zinc/13/48/74/491134874.db2.gz MATDEDIEEGOKKD-JTQLQIEISA-N 1 2 247.346 2.094 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CCS[C@H]1C ZINC000308963704 491141380 /nfs/dbraw/zinc/14/13/80/491141380.db2.gz TXEMZEYFERNBSS-IUCAKERBSA-N 1 2 224.329 2.396 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2cn(C)cn2)o1 ZINC000309250970 491146483 /nfs/dbraw/zinc/14/64/83/491146483.db2.gz DXMKENCBDZXJKN-SNVBAGLBSA-N 1 2 219.288 2.172 20 0 BEADLO CC(C)c1nc(N[C@H](C)C[C@@H](C)O)cc[nH+]1 ZINC000309370814 491147610 /nfs/dbraw/zinc/14/76/10/491147610.db2.gz QKXYKWFOMBPVDH-NXEZZACHSA-N 1 2 223.320 2.171 20 0 BEADLO Cc1occc1C[NH2+][C@H](C)c1nccn1C ZINC000309774161 491156160 /nfs/dbraw/zinc/15/61/60/491156160.db2.gz LGVPSBNSRHWLKB-SECBINFHSA-N 1 2 219.288 2.172 20 0 BEADLO C[C@@H]1CCC[C@@H](CNC(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493481530 533746653 /nfs/dbraw/zinc/74/66/53/533746653.db2.gz MAESXFMDGBIOQB-IEVRTODYSA-N 1 2 247.342 2.365 20 0 BEADLO C[C@@H]1CCC[C@@H](N(C)C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492904994 533757928 /nfs/dbraw/zinc/75/79/28/533757928.db2.gz YJSRCLNRQJTJPT-GGCNOCFKSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@@H]1CCC[C@H](C)C1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492812140 533819569 /nfs/dbraw/zinc/81/95/69/533819569.db2.gz MBAQQRWNEHEALJ-VBXNIUMYSA-N 1 2 247.342 2.364 20 0 BEADLO C[C@H](O)CCC[N@@H+]1CC[C@H](C)C(F)(F)C1 ZINC000494229614 534055240 /nfs/dbraw/zinc/05/52/40/534055240.db2.gz DNHBZKXOEJUNOS-UWVGGRQHSA-N 1 2 221.291 2.125 20 0 BEADLO C[C@H](O)CCC[N@H+]1CC[C@H](C)C(F)(F)C1 ZINC000494229614 534055246 /nfs/dbraw/zinc/05/52/46/534055246.db2.gz DNHBZKXOEJUNOS-UWVGGRQHSA-N 1 2 221.291 2.125 20 0 BEADLO COC[C@@H](C)Nc1cc(C)[nH+]c(C2CCC2)n1 ZINC000891438553 582685477 /nfs/dbraw/zinc/68/54/77/582685477.db2.gz OWNNMMUHAKKSSQ-SNVBAGLBSA-N 1 2 235.331 2.499 20 0 BEADLO CC[C@@H](NCc1[nH+]ccn1C)c1nccs1 ZINC000070717153 535806631 /nfs/dbraw/zinc/80/66/31/535806631.db2.gz MMQKZOYEFHVDPM-SECBINFHSA-N 1 2 236.344 2.118 20 0 BEADLO CC[C@@H]([NH2+]Cc1nccn1C)c1nccs1 ZINC000070717153 535806632 /nfs/dbraw/zinc/80/66/32/535806632.db2.gz MMQKZOYEFHVDPM-SECBINFHSA-N 1 2 236.344 2.118 20 0 BEADLO CC[N@H+](CCOC)Cc1nc(C(C)(C)C)co1 ZINC000891584053 582700060 /nfs/dbraw/zinc/70/00/60/582700060.db2.gz NNIKZOLVPKVQBT-UHFFFAOYSA-N 1 2 240.347 2.440 20 0 BEADLO CC[N@@H+](CCOC)Cc1nc(C(C)(C)C)co1 ZINC000891584053 582700065 /nfs/dbraw/zinc/70/00/65/582700065.db2.gz NNIKZOLVPKVQBT-UHFFFAOYSA-N 1 2 240.347 2.440 20 0 BEADLO C[C@@H]1CC2(CCC2)CN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492856265 534153285 /nfs/dbraw/zinc/15/32/85/534153285.db2.gz BLBCSHZLKITXSD-PGLGOXFNSA-N 1 2 245.326 2.214 20 0 BEADLO Oc1cc(Cl)cc(C[N@@H+]2CCCOCC2)c1 ZINC000891720080 582713937 /nfs/dbraw/zinc/71/39/37/582713937.db2.gz KEHBECSTOWGYCI-UHFFFAOYSA-N 1 2 241.718 2.268 20 0 BEADLO Oc1cc(Cl)cc(C[N@H+]2CCCOCC2)c1 ZINC000891720080 582713939 /nfs/dbraw/zinc/71/39/39/582713939.db2.gz KEHBECSTOWGYCI-UHFFFAOYSA-N 1 2 241.718 2.268 20 0 BEADLO C[C@@H](F)CCSc1[nH+]cnc2c1cnn2C ZINC000505690697 534280240 /nfs/dbraw/zinc/28/02/40/534280240.db2.gz VDRWBDJKMCJENM-SSDOTTSWSA-N 1 2 240.307 2.204 20 0 BEADLO CCc1nc(N2C[C@H](C)O[C@@H](CC)C2)cc(C)[nH+]1 ZINC000342228242 536126303 /nfs/dbraw/zinc/12/63/03/536126303.db2.gz WRHGWJVIIRMCJS-RYUDHWBXSA-N 1 2 249.358 2.351 20 0 BEADLO C[C@@H](O)c1cccc(NCc2ccoc2)[nH+]1 ZINC000891995775 582757355 /nfs/dbraw/zinc/75/73/55/582757355.db2.gz MAQCHNMSBIFVFG-SECBINFHSA-N 1 2 218.256 2.340 20 0 BEADLO CCc1ccc(C[N@H+]2CCOC[C@H]2CC)cn1 ZINC000347659802 536177602 /nfs/dbraw/zinc/17/76/02/536177602.db2.gz XLJAPEMRTTUWOQ-CQSZACIVSA-N 1 2 234.343 2.255 20 0 BEADLO CCc1ccc(C[N@@H+]2CCOC[C@H]2CC)cn1 ZINC000347659802 536177607 /nfs/dbraw/zinc/17/76/07/536177607.db2.gz XLJAPEMRTTUWOQ-CQSZACIVSA-N 1 2 234.343 2.255 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)/C=C/[C@@H]1CCOC1 ZINC000493136247 534386625 /nfs/dbraw/zinc/38/66/25/534386625.db2.gz DBDSXUVWWPDIST-AAOUONPWSA-N 1 2 246.310 2.230 20 0 BEADLO Cc1nc(NC(=O)C=Cc2c[nH]c[nH+]2)sc1C ZINC000492774224 534454104 /nfs/dbraw/zinc/45/41/04/534454104.db2.gz WSVWNLHWYZZIBM-ARJAWSKDSA-N 1 2 248.311 2.135 20 0 BEADLO CCc1nn(C[N@@H+]2CC[C@H](C)[C@@H]2C)c(=S)o1 ZINC001332125897 974954804 /nfs/dbraw/zinc/95/48/04/974954804.db2.gz QKBRERINDFOYBS-IUCAKERBSA-N 1 2 241.360 2.456 20 0 BEADLO CCc1nn(C[N@H+]2CC[C@H](C)[C@@H]2C)c(=S)o1 ZINC001332125897 974954809 /nfs/dbraw/zinc/95/48/09/974954809.db2.gz QKBRERINDFOYBS-IUCAKERBSA-N 1 2 241.360 2.456 20 0 BEADLO COC(=O)[C@H](c1ccc(Cl)cc1)[NH+](C)C ZINC000095532608 523938476 /nfs/dbraw/zinc/93/84/76/523938476.db2.gz MCQRFSDDLXZPSV-JTQLQIEISA-N 1 2 227.691 2.116 20 0 BEADLO COC(=O)[C@H](c1cccc(Cl)c1)[NH+](C)C ZINC000095532606 523939512 /nfs/dbraw/zinc/93/95/12/523939512.db2.gz DYRGKXWOHAXGIO-JTQLQIEISA-N 1 2 227.691 2.116 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)Nc1cccc(F)c1F ZINC000492766469 534805518 /nfs/dbraw/zinc/80/55/18/534805518.db2.gz MTGMWXAHXGWYCC-PLNGDYQASA-N 1 2 249.220 2.340 20 0 BEADLO CC(C)c1nc(N2CC[C@H]3OCC[C@H]3C2)cc[nH+]1 ZINC000376043046 534908937 /nfs/dbraw/zinc/90/89/37/534908937.db2.gz OKXJPJBSUYNSLJ-NWDGAFQWSA-N 1 2 247.342 2.215 20 0 BEADLO CC(C)c1nc(N2CCCC[C@@H]2CCO)cc[nH+]1 ZINC000120539763 534907128 /nfs/dbraw/zinc/90/71/28/534907128.db2.gz ILWCGVJZSVZLJA-GFCCVEGCSA-N 1 2 249.358 2.341 20 0 BEADLO CC(C)(C)[C@H]1CCCN1C(=O)/C=C\c1[nH]cc[nH+]1 ZINC000493340975 526722021 /nfs/dbraw/zinc/72/20/21/526722021.db2.gz WACFISMTSNXVMI-JMEBYUIHSA-N 1 2 247.342 2.460 20 0 BEADLO C/C=C(/C=C/C(=O)NCCCn1cc[nH+]c1)CC ZINC000493478651 527551778 /nfs/dbraw/zinc/55/17/78/527551778.db2.gz HQJPBZOKMFQOPG-ORXUOFMQSA-N 1 2 247.342 2.302 20 0 BEADLO C/C=C/C=C/C(=O)N[C@H](C)c1[nH+]ccn1CC ZINC000493424393 527585329 /nfs/dbraw/zinc/58/53/29/527585329.db2.gz SIFPVUYPSPCTSS-PANRBZMGSA-N 1 2 233.315 2.213 20 0 BEADLO C/C=C/C=C\C(=O)N[C@@H](C)c1[nH+]ccn1CC ZINC000493424397 527607559 /nfs/dbraw/zinc/60/75/59/527607559.db2.gz SIFPVUYPSPCTSS-WRTVOVOXSA-N 1 2 233.315 2.213 20 0 BEADLO C/C=C/C=C\C(=O)N[C@H](c1[nH+]ccn1C)C1CC1 ZINC000492879988 527610675 /nfs/dbraw/zinc/61/06/75/527610675.db2.gz IFVAIHIJWDNSLO-RWBQKKIYSA-N 1 2 245.326 2.120 20 0 BEADLO CC(C)C1CCN(C(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000492904966 527645921 /nfs/dbraw/zinc/64/59/21/527645921.db2.gz YIDUEIPNAVWJOE-ARJAWSKDSA-N 1 2 247.342 2.318 20 0 BEADLO CCCN(C(=O)/C=C\c1[nH]cc[nH+]1)C(C)C ZINC000493204939 527719873 /nfs/dbraw/zinc/71/98/73/527719873.db2.gz JUOFDCMXRHJYMY-WAYWQWQTSA-N 1 2 221.304 2.070 20 0 BEADLO CC(C)CN(C(=O)C=Cc1c[nH]c[nH+]1)C1CC1 ZINC000493671722 527889879 /nfs/dbraw/zinc/88/98/79/527889879.db2.gz CATJQZBBKXPVRU-UTCJRWHESA-N 1 2 233.315 2.070 20 0 BEADLO CCCN(CC1CC1)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493718473 528014874 /nfs/dbraw/zinc/01/48/74/528014874.db2.gz ODWCMSSOFIJKEI-WAYWQWQTSA-N 1 2 233.315 2.072 20 0 BEADLO CCC[C@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493613341 528369487 /nfs/dbraw/zinc/36/94/87/528369487.db2.gz OTVLDZVOARSDRI-DGMVEKRQSA-N 1 2 247.342 2.462 20 0 BEADLO CCO/C=C/C(=O)Nc1c(C)cc[nH+]c1C ZINC000493098718 528497193 /nfs/dbraw/zinc/49/71/93/528497193.db2.gz SDGVQLLPATYBPK-SOFGYWHQSA-N 1 2 220.272 2.187 20 0 BEADLO CC(C)C[C@H]1CCCN1C(=O)/C=C\c1[nH]cc[nH+]1 ZINC000493157154 528589071 /nfs/dbraw/zinc/58/90/71/528589071.db2.gz PZELDZZUPCXMKI-FOQNGQEVSA-N 1 2 247.342 2.460 20 0 BEADLO CC(C)C[C@H]1CCN(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493108565 528592504 /nfs/dbraw/zinc/59/25/04/528592504.db2.gz SLOYJROVWHYYOC-AAOUONPWSA-N 1 2 247.342 2.318 20 0 BEADLO CCCc1nc(C)c(CNc2cc(C)[nH+]cn2)o1 ZINC000488739060 528725635 /nfs/dbraw/zinc/72/56/35/528725635.db2.gz WPOIKKTZNNYDBY-UHFFFAOYSA-N 1 2 246.314 2.068 20 0 BEADLO CCOCC[N@@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000494210907 528758499 /nfs/dbraw/zinc/75/84/99/528758499.db2.gz CFPBXHBCPGFQIU-SECBINFHSA-N 1 2 207.264 2.000 20 0 BEADLO CCOCC[N@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000494210907 528758501 /nfs/dbraw/zinc/75/85/01/528758501.db2.gz CFPBXHBCPGFQIU-SECBINFHSA-N 1 2 207.264 2.000 20 0 BEADLO CCC(CC)N(CC)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493270732 528771700 /nfs/dbraw/zinc/77/17/00/528771700.db2.gz LMQGRHFQTOVXPM-FPLPWBNLSA-N 1 2 235.331 2.460 20 0 BEADLO CC(C)[C@@H]1N(C(=O)/C=C\c2[nH]cc[nH+]2)CC1(C)C ZINC000493404530 528804346 /nfs/dbraw/zinc/80/43/46/528804346.db2.gz WDSKALMPACPMQS-SZZPACECSA-N 1 2 247.342 2.316 20 0 BEADLO CC1(C)C(CNC(=O)C=Cc2c[nH]c[nH+]2)C1(C)C ZINC000492812423 528871175 /nfs/dbraw/zinc/87/11/75/528871175.db2.gz MODHQQJQGLKELM-WAYWQWQTSA-N 1 2 247.342 2.221 20 0 BEADLO CC(C)N(CC1CCC1)C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493124546 528871186 /nfs/dbraw/zinc/87/11/86/528871186.db2.gz WPPRRHLGIZTPKN-VOTSOKGWSA-N 1 2 247.342 2.460 20 0 BEADLO CCC[C@@H](CC)NC(=O)/C=C\c1[nH]cc[nH+]1 ZINC000493085901 528914808 /nfs/dbraw/zinc/91/48/08/528914808.db2.gz DEBNYTJFBGMNMX-JYESYGNLSA-N 1 2 221.304 2.118 20 0 BEADLO CC1(C)CN(C(=O)/C=C/c2[nH]cc[nH+]2)[C@H]1C1CC1 ZINC000493646066 529061216 /nfs/dbraw/zinc/06/12/16/529061216.db2.gz FOHAUVGCHSJMDT-GFUIURDCSA-N 1 2 245.326 2.070 20 0 BEADLO CC[C@H]1CCCCN1C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493391798 529196657 /nfs/dbraw/zinc/19/66/57/529196657.db2.gz AISQUFPRUFYAJY-MLRMMBSGSA-N 1 2 233.315 2.214 20 0 BEADLO CC[C@H]1CCCN(C(=O)/C=C/c2[nH]cc[nH+]2)CC1 ZINC000493778349 529211762 /nfs/dbraw/zinc/21/17/62/529211762.db2.gz BIWDIOREPUTMHG-FYJFLYSWSA-N 1 2 247.342 2.462 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CCOC[C@@H]2C2CC2)cn1 ZINC000179908145 535060187 /nfs/dbraw/zinc/06/01/87/535060187.db2.gz TTXMDZHFKOFUCY-CQSZACIVSA-N 1 2 249.358 2.075 20 0 BEADLO CC(C)n1cc(C[N@H+]2CCOC[C@@H]2C2CC2)cn1 ZINC000179908145 535060192 /nfs/dbraw/zinc/06/01/92/535060192.db2.gz TTXMDZHFKOFUCY-CQSZACIVSA-N 1 2 249.358 2.075 20 0 BEADLO CC1(C)CCCCN(C(=O)CCn2cc[nH+]c2)C1 ZINC000336063679 535293038 /nfs/dbraw/zinc/29/30/38/535293038.db2.gz KOXFRLMQDVKDND-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO CC(C)C[C@@H]1OCCC[C@H]1[NH2+]Cc1ccn[nH]1 ZINC000185197701 535294894 /nfs/dbraw/zinc/29/48/94/535294894.db2.gz DMLCWVVDWDAWLE-OLZOCXBDSA-N 1 2 237.347 2.093 20 0 BEADLO CC(C)[C@]1(CO)CCCN(c2cccc[nH+]2)C1 ZINC000294040048 535310187 /nfs/dbraw/zinc/31/01/87/535310187.db2.gz LRPIZICNIKJLKA-CQSZACIVSA-N 1 2 234.343 2.317 20 0 BEADLO CC(C)c1cc(N[C@H](C)Cn2cc[nH+]c2)ncn1 ZINC000049235902 535369992 /nfs/dbraw/zinc/36/99/92/535369992.db2.gz AFWONZMCFDQWCD-LLVKDONJSA-N 1 2 245.330 2.297 20 0 BEADLO CCN(Cc1[nH+]ccn1C)c1ccccc1OC ZINC000342608872 535392203 /nfs/dbraw/zinc/39/22/03/535392203.db2.gz YVLQVHJFNSPYQK-UHFFFAOYSA-N 1 2 245.326 2.455 20 0 BEADLO CC[N@H+](Cc1nnc(C2CCC2)n1C)C1CC1 ZINC000181089114 535395721 /nfs/dbraw/zinc/39/57/21/535395721.db2.gz WAVGJOQSIZHGEG-UHFFFAOYSA-N 1 2 234.347 2.067 20 0 BEADLO CC[N@@H+](Cc1nnc(C2CCC2)n1C)C1CC1 ZINC000181089114 535395722 /nfs/dbraw/zinc/39/57/22/535395722.db2.gz WAVGJOQSIZHGEG-UHFFFAOYSA-N 1 2 234.347 2.067 20 0 BEADLO CCOC1CCN(c2cccc[nH+]2)CC1 ZINC000301063749 535400910 /nfs/dbraw/zinc/40/09/10/535400910.db2.gz DAXJMRJEYOJURQ-UHFFFAOYSA-N 1 2 206.289 2.087 20 0 BEADLO CCCc1nc(C[N@@H+]2CC[C@@H](C)[C@@H]2C)no1 ZINC000177887061 535527869 /nfs/dbraw/zinc/52/78/69/535527869.db2.gz DPFCDRJOFYYQGA-ZJUUUORDSA-N 1 2 223.320 2.252 20 0 BEADLO CCCc1nc(C[N@H+]2CC[C@@H](C)[C@@H]2C)no1 ZINC000177887061 535527872 /nfs/dbraw/zinc/52/78/72/535527872.db2.gz DPFCDRJOFYYQGA-ZJUUUORDSA-N 1 2 223.320 2.252 20 0 BEADLO CCCc1[nH+]c2ccccc2n1CCC(=O)NC ZINC000162918686 535539467 /nfs/dbraw/zinc/53/94/67/535539467.db2.gz XHCBZXAMAWQZSL-UHFFFAOYSA-N 1 2 245.326 2.125 20 0 BEADLO CCO[C@H]1CCCN(c2cccc[nH+]2)C1 ZINC000301110415 535622065 /nfs/dbraw/zinc/62/20/65/535622065.db2.gz KPUJFGVHVXSRDX-NSHDSACASA-N 1 2 206.289 2.087 20 0 BEADLO CC[C@@H](NC(=O)c1[nH]c(C)cc1C)c1[nH]cc[nH+]1 ZINC000347977967 535799041 /nfs/dbraw/zinc/79/90/41/535799041.db2.gz XVTYSTAXMURLFM-SNVBAGLBSA-N 1 2 246.314 2.236 20 0 BEADLO CC[C@@H](NC(=O)c1ccc(F)cc1)c1[nH]cc[nH+]1 ZINC000139427091 535800485 /nfs/dbraw/zinc/80/04/85/535800485.db2.gz CIOXOJQDDJEVCL-LLVKDONJSA-N 1 2 247.273 2.430 20 0 BEADLO CC[C@@H](NC(=O)c1ccccc1F)c1[nH]cc[nH+]1 ZINC000139425805 535800947 /nfs/dbraw/zinc/80/09/47/535800947.db2.gz HWZUXIKCAKCSTF-LLVKDONJSA-N 1 2 247.273 2.430 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1ccncc1F ZINC000336217619 535853068 /nfs/dbraw/zinc/85/30/68/535853068.db2.gz RQVSHFWQXMXTPS-ZYHUDNBSSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1ccncc1F ZINC000336217619 535853076 /nfs/dbraw/zinc/85/30/76/535853076.db2.gz RQVSHFWQXMXTPS-ZYHUDNBSSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@]1(CO)CCCN(c2cccc[nH+]2)C1 ZINC000275010506 535950996 /nfs/dbraw/zinc/95/09/96/535950996.db2.gz IZPGTVICFHLFOZ-ZDUSSCGKSA-N 1 2 220.316 2.071 20 0 BEADLO CC[C@@]1(C)CN(c2cc[nH+]c(C3CC3)n2)CCO1 ZINC000302626258 536060166 /nfs/dbraw/zinc/06/01/66/536060166.db2.gz FNNCMBHJEQUOGR-AWEZNQCLSA-N 1 2 247.342 2.359 20 0 BEADLO CCc1ccc(C[N@@H+]2C[C@H](C)OC[C@@H]2C)nc1 ZINC000335930000 536179489 /nfs/dbraw/zinc/17/94/89/536179489.db2.gz ATXVKSXJHREOBZ-RYUDHWBXSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1ccc(C[N@H+]2C[C@H](C)OC[C@@H]2C)nc1 ZINC000335930000 536179492 /nfs/dbraw/zinc/17/94/92/536179492.db2.gz ATXVKSXJHREOBZ-RYUDHWBXSA-N 1 2 234.343 2.253 20 0 BEADLO COc1cc(C)[nH+]c(CN[C@@H](C)c2ccon2)c1 ZINC000351577839 536694919 /nfs/dbraw/zinc/69/49/19/536694919.db2.gz GSNWCSWHYIZYPA-JTQLQIEISA-N 1 2 247.298 2.237 20 0 BEADLO COCC[N@H+](CC(F)F)CC1(SC)CC1 ZINC000347793037 536831584 /nfs/dbraw/zinc/83/15/84/536831584.db2.gz VRZQBLFUOMOFBR-UHFFFAOYSA-N 1 2 239.331 2.096 20 0 BEADLO COCC[N@@H+](CC(F)F)CC1(SC)CC1 ZINC000347793037 536831587 /nfs/dbraw/zinc/83/15/87/536831587.db2.gz VRZQBLFUOMOFBR-UHFFFAOYSA-N 1 2 239.331 2.096 20 0 BEADLO Cc1cnc(C[NH2+]Cc2occc2C)o1 ZINC000235958538 537907987 /nfs/dbraw/zinc/90/79/87/537907987.db2.gz WOKIJVAAOKRZKR-UHFFFAOYSA-N 1 2 206.245 2.174 20 0 BEADLO Cc1cnc(C[NH2+]Cc2scnc2C)o1 ZINC000235958621 537908575 /nfs/dbraw/zinc/90/85/75/537908575.db2.gz AQNMLXKPLCLFJW-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO C[C@H](CCO)Nc1cc2ccccc2c[nH+]1 ZINC000631124091 538457862 /nfs/dbraw/zinc/45/78/62/538457862.db2.gz FUEJWQRIDLFJKC-SNVBAGLBSA-N 1 2 216.284 2.418 20 0 BEADLO CN(C)c1ccc(NCc2nccs2)[nH+]c1 ZINC000381201090 566299898 /nfs/dbraw/zinc/29/98/98/566299898.db2.gz CDOVHNFWKNQYGG-UHFFFAOYSA-N 1 2 234.328 2.216 20 0 BEADLO COc1ccc(N[C@@H](C)[C@H]2CCCO2)[nH+]c1 ZINC000230404777 566311805 /nfs/dbraw/zinc/31/18/05/566311805.db2.gz VHTZCWIOBYNYQY-GXSJLCMTSA-N 1 2 222.288 2.070 20 0 BEADLO C[C@H]1CCCCCN1C(=O)CCc1c[nH+]c[nH]1 ZINC000334379469 566394676 /nfs/dbraw/zinc/39/46/76/566394676.db2.gz YOVKQDBNERAEEH-NSHDSACASA-N 1 2 235.331 2.133 20 0 BEADLO C[C@H]1CCCCCN1C(=O)CCc1c[nH]c[nH+]1 ZINC000334379469 566394680 /nfs/dbraw/zinc/39/46/80/566394680.db2.gz YOVKQDBNERAEEH-NSHDSACASA-N 1 2 235.331 2.133 20 0 BEADLO CCCN(Cc1c(C)cc[nH+]c1N)CC(F)F ZINC000893987442 583269981 /nfs/dbraw/zinc/26/99/81/583269981.db2.gz RJCKFNHTXUCZON-UHFFFAOYSA-N 1 2 243.301 2.449 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2CCOC(C)(C)[C@@H]2C)c1C ZINC000894035117 583279949 /nfs/dbraw/zinc/27/99/49/583279949.db2.gz DPEHDUKRHGOFES-NSHDSACASA-N 1 2 237.347 2.026 20 0 BEADLO Cc1n[nH]c(C[N@H+]2CCOC(C)(C)[C@@H]2C)c1C ZINC000894035117 583279951 /nfs/dbraw/zinc/27/99/51/583279951.db2.gz DPEHDUKRHGOFES-NSHDSACASA-N 1 2 237.347 2.026 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OCC12CCC(CC1)C2 ZINC000853674452 588754765 /nfs/dbraw/zinc/75/47/65/588754765.db2.gz ZIWIYCGIKZCLTL-BMQDGWLCSA-N 1 2 226.320 2.100 20 0 BEADLO CCC(C)(C)CCO[NH+]=C(N)[C@H](C)OC ZINC000853674432 588754846 /nfs/dbraw/zinc/75/48/46/588754846.db2.gz YYHGLZQUQYDOFN-VIFPVBQESA-N 1 2 216.325 2.346 20 0 BEADLO CC[C@@H](CO[NH+]=C(N)[C@@H](C)OC)CC(F)F ZINC000853674339 588754960 /nfs/dbraw/zinc/75/49/60/588754960.db2.gz WQXNGSCIRYONQO-HTQZYQBOSA-N 1 2 238.278 2.201 20 0 BEADLO Cc1cc(CNc2cc(F)ncn2)cc(C)[nH+]1 ZINC000853695845 588757237 /nfs/dbraw/zinc/75/72/37/588757237.db2.gz PTRTUOLJMXYELP-UHFFFAOYSA-N 1 2 232.262 2.240 20 0 BEADLO CC(C)c1nc(N[C@@H](CO)C2CCC2)cc[nH+]1 ZINC000853761047 588762003 /nfs/dbraw/zinc/76/20/03/588762003.db2.gz MCIHYIWOPUNSCS-NSHDSACASA-N 1 2 235.331 2.173 20 0 BEADLO Cc1cc(N[C@H]2C[C@H](O)c3ccccc32)nc[nH+]1 ZINC000853836659 588765392 /nfs/dbraw/zinc/76/53/92/588765392.db2.gz DAULWUDOSISENE-STQMWFEESA-N 1 2 241.294 2.375 20 0 BEADLO CC(C)c1nc(N2CC[C@@H]3COC[C@H]3C2)cc[nH+]1 ZINC000853934495 588769637 /nfs/dbraw/zinc/76/96/37/588769637.db2.gz RHJDKORWFYMUHZ-VXGBXAGGSA-N 1 2 247.342 2.073 20 0 BEADLO CSc1cnc(N[C@@H](C)c2[nH+]ccn2C)nc1 ZINC000853966397 588770450 /nfs/dbraw/zinc/77/04/50/588770450.db2.gz CAZPWGPCBNGGRG-QMMMGPOBSA-N 1 2 249.343 2.105 20 0 BEADLO CC(C)c1nc(N2C[C@@H](C)[C@](C)(CO)C2)cc[nH+]1 ZINC000853965217 588770588 /nfs/dbraw/zinc/77/05/88/588770588.db2.gz VMHVZRTVSCWFEG-RISCZKNCSA-N 1 2 249.358 2.055 20 0 BEADLO CC1(C)C[N@H+](CCF)[C@H]1c1cccnc1 ZINC000854042118 588772281 /nfs/dbraw/zinc/77/22/81/588772281.db2.gz UWIOJYXHFUYXKO-NSHDSACASA-N 1 2 208.280 2.434 20 0 BEADLO CC1(C)C[N@@H+](CCF)[C@H]1c1cccnc1 ZINC000854042118 588772282 /nfs/dbraw/zinc/77/22/82/588772282.db2.gz UWIOJYXHFUYXKO-NSHDSACASA-N 1 2 208.280 2.434 20 0 BEADLO Nc1cccc(C[NH2+][C@H]2CCCc3[nH]ncc32)c1 ZINC000854215796 588779738 /nfs/dbraw/zinc/77/97/38/588779738.db2.gz NMKKPKFQXGCZQW-ZDUSSCGKSA-N 1 2 242.326 2.159 20 0 BEADLO CC1=CC[C@](C)(C(=O)NC2=[NH+]CCS2)CC1 ZINC000854292458 588782645 /nfs/dbraw/zinc/78/26/45/588782645.db2.gz FNSMTJWTAHSPMH-LBPRGKRZSA-N 1 2 238.356 2.342 20 0 BEADLO C[C@H](C1CCCCC1)N(C)C(=O)Cc1[nH]cc[nH+]1 ZINC000854376361 588785384 /nfs/dbraw/zinc/78/53/84/588785384.db2.gz WAZSKUODYPQERK-LLVKDONJSA-N 1 2 249.358 2.379 20 0 BEADLO CC(C)c1nc(NC[C@@H](O)C(C)(C)C)cc[nH+]1 ZINC000112334673 588794164 /nfs/dbraw/zinc/79/41/64/588794164.db2.gz KHABRNIPXJFKJA-SNVBAGLBSA-N 1 2 237.347 2.419 20 0 BEADLO CC(C)[C@H]1CN(C(=O)Cc2[nH]cc[nH+]2)[C@H]1C(C)C ZINC000854827284 588812318 /nfs/dbraw/zinc/81/23/18/588812318.db2.gz IAKFPKPFVXETOA-RISCZKNCSA-N 1 2 249.358 2.091 20 0 BEADLO C[C@H](NC(=O)Cc1[nH]cc[nH+]1)[C@@H]1CCC[C@H](C)C1 ZINC000854895537 588815564 /nfs/dbraw/zinc/81/55/64/588815564.db2.gz WQNUPGZMPUDOAV-SDDRHHMPSA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)(C)[C@H]1CCC[C@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000854942527 588817640 /nfs/dbraw/zinc/81/76/40/588817640.db2.gz VKOZELSLEWIVKG-WDEREUQCSA-N 1 2 249.358 2.283 20 0 BEADLO CCC/C(C)=C/C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000855134417 588822740 /nfs/dbraw/zinc/82/27/40/588822740.db2.gz NSRDYYTZLORZPF-UXBLZVDNSA-N 1 2 221.304 2.115 20 0 BEADLO CCC/C(C)=C/C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000855134417 588822741 /nfs/dbraw/zinc/82/27/41/588822741.db2.gz NSRDYYTZLORZPF-UXBLZVDNSA-N 1 2 221.304 2.115 20 0 BEADLO Cc1ccc([C@H](C)C(=O)N(C)Cc2c[nH+]c[nH]2)o1 ZINC000855134398 588822885 /nfs/dbraw/zinc/82/28/85/588822885.db2.gz MWTYITICOWKJQE-JTQLQIEISA-N 1 2 247.298 2.073 20 0 BEADLO Cc1ccc([C@H](C)C(=O)N(C)Cc2c[nH]c[nH+]2)o1 ZINC000855134398 588822886 /nfs/dbraw/zinc/82/28/86/588822886.db2.gz MWTYITICOWKJQE-JTQLQIEISA-N 1 2 247.298 2.073 20 0 BEADLO CC/C(C)=C(/C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000855136711 588823098 /nfs/dbraw/zinc/82/30/98/588823098.db2.gz RKJYCELVWJFUNH-KTKRTIGZSA-N 1 2 221.304 2.115 20 0 BEADLO CC/C(C)=C(/C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000855136711 588823099 /nfs/dbraw/zinc/82/30/99/588823099.db2.gz RKJYCELVWJFUNH-KTKRTIGZSA-N 1 2 221.304 2.115 20 0 BEADLO COc1ccc(CNc2ccc(OC)c[nH+]2)nc1 ZINC000804656939 582460965 /nfs/dbraw/zinc/46/09/65/582460965.db2.gz KRGAIPOMJVFGLD-UHFFFAOYSA-N 1 2 245.282 2.106 20 0 BEADLO c1nsnc1C[N@@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000859544606 582489706 /nfs/dbraw/zinc/48/97/06/582489706.db2.gz GLNKFXQLZFSCCT-ZJUUUORDSA-N 1 2 241.385 2.008 20 0 BEADLO c1nsnc1C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000859544606 582489707 /nfs/dbraw/zinc/48/97/07/582489707.db2.gz GLNKFXQLZFSCCT-ZJUUUORDSA-N 1 2 241.385 2.008 20 0 BEADLO Cc1nc(N2CC[C@@H]3C[C@@H]32)c2c([nH+]1)CCCC2 ZINC000804689270 582526541 /nfs/dbraw/zinc/52/65/41/582526541.db2.gz MIBHKGXBJXTXOP-MFKMUULPSA-N 1 2 229.327 2.262 20 0 BEADLO C[C@@H](Nc1cc(N(C)C)nc[nH+]1)c1ccccn1 ZINC000891491885 582691902 /nfs/dbraw/zinc/69/19/02/582691902.db2.gz CRNRAISXSSLZAZ-SNVBAGLBSA-N 1 2 243.314 2.111 20 0 BEADLO C[C@@H](Nc1cc(N(C)C)[nH+]cn1)c1ccccn1 ZINC000891491885 582691903 /nfs/dbraw/zinc/69/19/03/582691903.db2.gz CRNRAISXSSLZAZ-SNVBAGLBSA-N 1 2 243.314 2.111 20 0 BEADLO CCc1cc(N2C[C@@H](C)OC[C@@H]2C)nc(CC)[nH+]1 ZINC000891734859 582715563 /nfs/dbraw/zinc/71/55/63/582715563.db2.gz YLVJOUPBQMQVTH-WDEREUQCSA-N 1 2 249.358 2.215 20 0 BEADLO Cc1cc(N2CCOC[C@@H]2C)nc(C2CCC2)[nH+]1 ZINC000891753713 582717018 /nfs/dbraw/zinc/71/70/18/582717018.db2.gz FJGVISDCMMIBNY-NSHDSACASA-N 1 2 247.342 2.278 20 0 BEADLO CC1(C)COCC[N@@H+]1Cc1cnn(C2CCC2)c1 ZINC000891778455 582719495 /nfs/dbraw/zinc/71/94/95/582719495.db2.gz OPMVVPLDPAJAQP-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO CC1(C)COCC[N@H+]1Cc1cnn(C2CCC2)c1 ZINC000891778455 582719497 /nfs/dbraw/zinc/71/94/97/582719497.db2.gz OPMVVPLDPAJAQP-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO CC1(C)COCC[N@@H+]1Cc1ccnn1C1CCC1 ZINC000891781227 582720562 /nfs/dbraw/zinc/72/05/62/582720562.db2.gz HDISCRCNVHILTB-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO CC1(C)COCC[N@H+]1Cc1ccnn1C1CCC1 ZINC000891781227 582720563 /nfs/dbraw/zinc/72/05/63/582720563.db2.gz HDISCRCNVHILTB-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO CC[N@@H+](Cc1nccn1C1CC1)C[C@@H]1CCCO1 ZINC000891783396 582720664 /nfs/dbraw/zinc/72/06/64/582720664.db2.gz GBGUWMQDPGLOPQ-ZDUSSCGKSA-N 1 2 249.358 2.219 20 0 BEADLO CC[N@H+](Cc1nccn1C1CC1)C[C@@H]1CCCO1 ZINC000891783396 582720665 /nfs/dbraw/zinc/72/06/65/582720665.db2.gz GBGUWMQDPGLOPQ-ZDUSSCGKSA-N 1 2 249.358 2.219 20 0 BEADLO C[C@H](O)c1cccc(NC[C@@H]2C[C@H]2C)[nH+]1 ZINC000891824414 582726624 /nfs/dbraw/zinc/72/66/24/582726624.db2.gz BVLVNPYBKBKYSN-UTLUCORTSA-N 1 2 206.289 2.203 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nccn2C2CC2)CCS1 ZINC000891926227 582738721 /nfs/dbraw/zinc/73/87/21/582738721.db2.gz VLIGCIWUTSNLCB-SNVBAGLBSA-N 1 2 237.372 2.155 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nccn2C2CC2)CCS1 ZINC000891926227 582738726 /nfs/dbraw/zinc/73/87/26/582738726.db2.gz VLIGCIWUTSNLCB-SNVBAGLBSA-N 1 2 237.372 2.155 20 0 BEADLO C[N@H+](Cc1nc(C(C)(C)C)co1)[C@H]1CCOC1 ZINC000891934648 582740553 /nfs/dbraw/zinc/74/05/53/582740553.db2.gz ITHUNEVBDBGJNY-JTQLQIEISA-N 1 2 238.331 2.193 20 0 BEADLO C[N@@H+](Cc1nc(C(C)(C)C)co1)[C@H]1CCOC1 ZINC000891934648 582740554 /nfs/dbraw/zinc/74/05/54/582740554.db2.gz ITHUNEVBDBGJNY-JTQLQIEISA-N 1 2 238.331 2.193 20 0 BEADLO Cc1occc1CNc1cc(N(C)C)nc[nH+]1 ZINC000891964875 582749077 /nfs/dbraw/zinc/74/90/77/582749077.db2.gz HFZKWTNJRMFWPG-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO Cc1occc1CNc1cc(N(C)C)[nH+]cn1 ZINC000891964875 582749078 /nfs/dbraw/zinc/74/90/78/582749078.db2.gz HFZKWTNJRMFWPG-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO C[C@@H](O)CN(C)c1cc(C2CC2)[nH+]c(C2CC2)n1 ZINC000892004636 582759821 /nfs/dbraw/zinc/75/98/21/582759821.db2.gz JZVXAFQEHINYIE-SECBINFHSA-N 1 2 247.342 2.048 20 0 BEADLO CC(C)[C@@H]1CCCN1c1cc(N(C)C)[nH+]cn1 ZINC000892009609 582760358 /nfs/dbraw/zinc/76/03/58/582760358.db2.gz LLFGIUGMDQTPQH-NSHDSACASA-N 1 2 234.347 2.167 20 0 BEADLO CC(C)[C@@H]1CCCN1c1cc(N(C)C)nc[nH+]1 ZINC000892009609 582760361 /nfs/dbraw/zinc/76/03/61/582760361.db2.gz LLFGIUGMDQTPQH-NSHDSACASA-N 1 2 234.347 2.167 20 0 BEADLO Cc1cc(F)ncc1C[N@H+]1CCO[C@@H](C)[C@H]1C ZINC000892049497 582774081 /nfs/dbraw/zinc/77/40/81/582774081.db2.gz QZBWVDLKIBBEEL-MNOVXSKESA-N 1 2 238.306 2.138 20 0 BEADLO Cc1cc(F)ncc1C[N@@H+]1CCO[C@@H](C)[C@H]1C ZINC000892049497 582774083 /nfs/dbraw/zinc/77/40/83/582774083.db2.gz QZBWVDLKIBBEEL-MNOVXSKESA-N 1 2 238.306 2.138 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@@H+]1Cc1ccnn1C1CCC1 ZINC000892050515 582775908 /nfs/dbraw/zinc/77/59/08/582775908.db2.gz ZMJQQUKSARFGGG-NEPJUHHUSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1ccnn1C1CCC1 ZINC000892050515 582775910 /nfs/dbraw/zinc/77/59/10/582775910.db2.gz ZMJQQUKSARFGGG-NEPJUHHUSA-N 1 2 249.358 2.217 20 0 BEADLO COc1nccc(C[N@H+]2CC=C(C)CC2)c1F ZINC000892069414 582784249 /nfs/dbraw/zinc/78/42/49/582784249.db2.gz KCDJYOHBTKAFJP-UHFFFAOYSA-N 1 2 236.290 2.381 20 0 BEADLO COc1nccc(C[N@@H+]2CC=C(C)CC2)c1F ZINC000892069414 582784250 /nfs/dbraw/zinc/78/42/50/582784250.db2.gz KCDJYOHBTKAFJP-UHFFFAOYSA-N 1 2 236.290 2.381 20 0 BEADLO C[C@H](O)c1cccc(NCCc2nccs2)[nH+]1 ZINC000892153616 582802128 /nfs/dbraw/zinc/80/21/28/582802128.db2.gz QYUKUTWUIUZFFF-VIFPVBQESA-N 1 2 249.339 2.246 20 0 BEADLO CCCCC1(NC(=O)Cc2[nH]cc(CC)[nH+]2)CC1 ZINC000889525194 582815470 /nfs/dbraw/zinc/81/54/70/582815470.db2.gz LDAPKPLJGIGRGM-UHFFFAOYSA-N 1 2 249.358 2.354 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)CCn1cccc1 ZINC000073472049 582825344 /nfs/dbraw/zinc/82/53/44/582825344.db2.gz GBVLKAFXSAGTGY-UHFFFAOYSA-N 1 2 229.283 2.220 20 0 BEADLO CN(CC(C)(C)C)c1nccn2c[nH+]cc12 ZINC000892278334 582825650 /nfs/dbraw/zinc/82/56/50/582825650.db2.gz PHVMTXLCIDHHJO-UHFFFAOYSA-N 1 2 218.304 2.212 20 0 BEADLO CCc1cc(N2CCCO[C@@H](C)C2)nc(CC)[nH+]1 ZINC000892295497 582829678 /nfs/dbraw/zinc/82/96/78/582829678.db2.gz LQJXNHXMAHNARV-NSHDSACASA-N 1 2 249.358 2.217 20 0 BEADLO C[C@H]1CC[N@H+](Cn2ncn(C3CC3)c2=S)C1 ZINC000725777694 582848376 /nfs/dbraw/zinc/84/83/76/582848376.db2.gz HMMFQHYYUVRDSJ-VIFPVBQESA-N 1 2 238.360 2.048 20 0 BEADLO C[C@H]1CC[N@@H+](Cn2ncn(C3CC3)c2=S)C1 ZINC000725777694 582848377 /nfs/dbraw/zinc/84/83/77/582848377.db2.gz HMMFQHYYUVRDSJ-VIFPVBQESA-N 1 2 238.360 2.048 20 0 BEADLO Cc1noc(C)c1[C@H](C)[NH2+][C@H](C)c1cnccn1 ZINC000092327004 582855513 /nfs/dbraw/zinc/85/55/13/582855513.db2.gz GTYOFTDVPOUYLG-BDAKNGLRSA-N 1 2 246.314 2.493 20 0 BEADLO C[C@@H]1CCC[C@@H]1Nc1cc(N(C)C)nc[nH+]1 ZINC000892341670 582861702 /nfs/dbraw/zinc/86/17/02/582861702.db2.gz DFKQYGBMYARQCB-ZJUUUORDSA-N 1 2 220.320 2.143 20 0 BEADLO C[C@@H]1CCC[C@@H]1Nc1cc(N(C)C)[nH+]cn1 ZINC000892341670 582861703 /nfs/dbraw/zinc/86/17/03/582861703.db2.gz DFKQYGBMYARQCB-ZJUUUORDSA-N 1 2 220.320 2.143 20 0 BEADLO CCOc1cccc(C[NH2+]Cc2ccon2)c1 ZINC000093305895 582875779 /nfs/dbraw/zinc/87/57/79/582875779.db2.gz PVJAMFCUVMVDMJ-UHFFFAOYSA-N 1 2 232.283 2.363 20 0 BEADLO CCc1cc(CNCc2[nH+]ccn2C2CC2)on1 ZINC000892398262 582875828 /nfs/dbraw/zinc/87/58/28/582875828.db2.gz YTCHFJFKJUWJGY-UHFFFAOYSA-N 1 2 246.314 2.058 20 0 BEADLO CCc1cc(C[NH2+]Cc2nccn2C2CC2)on1 ZINC000892398262 582875830 /nfs/dbraw/zinc/87/58/30/582875830.db2.gz YTCHFJFKJUWJGY-UHFFFAOYSA-N 1 2 246.314 2.058 20 0 BEADLO COCc1cccc(C[NH2+]Cc2ccon2)c1 ZINC000093305880 582875845 /nfs/dbraw/zinc/87/58/45/582875845.db2.gz KVVVBGMHHODDMK-UHFFFAOYSA-N 1 2 232.283 2.111 20 0 BEADLO CNc1cc(N[C@@H]2CC=CCC2)[nH+]cn1 ZINC000892605200 582927670 /nfs/dbraw/zinc/92/76/70/582927670.db2.gz MLCDVGPOIQODTJ-SECBINFHSA-N 1 2 204.277 2.039 20 0 BEADLO Cc1cc(NC[C@H](O)C(C)C)nc(C2CCC2)[nH+]1 ZINC000892642390 582936646 /nfs/dbraw/zinc/93/66/46/582936646.db2.gz SKUZBYBDFZSRMO-LBPRGKRZSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@H](NC(=O)/C=C\C(C)(C)C)c1[nH+]ccn1C ZINC000856278039 588866533 /nfs/dbraw/zinc/86/65/33/588866533.db2.gz WFZRBGRTZUEXGN-GFVADAIESA-N 1 2 235.331 2.200 20 0 BEADLO C[C@H](NC(=O)/C=C1/CC[C@@H](C)C1)c1[nH+]ccn1C ZINC000856277646 588866644 /nfs/dbraw/zinc/86/66/44/588866644.db2.gz NMWHNVJKXOHBBA-PPECIPICSA-N 1 2 247.342 2.344 20 0 BEADLO C[C@@H](NC(=O)/C=C1\CC[C@@H](C)C1)c1[nH+]ccn1C ZINC000856277647 588866651 /nfs/dbraw/zinc/86/66/51/588866651.db2.gz NMWHNVJKXOHBBA-SHEYXZMNSA-N 1 2 247.342 2.344 20 0 BEADLO CN(C)c1cc(NCCCC(F)(F)F)[nH+]cn1 ZINC000892740711 582974097 /nfs/dbraw/zinc/97/40/97/582974097.db2.gz LZAHITDRCURXRF-UHFFFAOYSA-N 1 2 248.252 2.297 20 0 BEADLO CN(C)c1cc(NCCCC(F)(F)F)nc[nH+]1 ZINC000892740711 582974099 /nfs/dbraw/zinc/97/40/99/582974099.db2.gz LZAHITDRCURXRF-UHFFFAOYSA-N 1 2 248.252 2.297 20 0 BEADLO C[C@@H](NC(=O)C(F)=C1CCC1)c1[nH+]ccn1C ZINC000856279480 588867012 /nfs/dbraw/zinc/86/70/12/588867012.db2.gz GMRAWCMBWKBWEW-MRVPVSSYSA-N 1 2 237.278 2.005 20 0 BEADLO C[C@@H](NC(=O)/C=C\C1CCCC1)c1[nH+]ccn1C ZINC000856280911 588867063 /nfs/dbraw/zinc/86/70/63/588867063.db2.gz ZRFVIRHRWAYVEM-SKVAFPRGSA-N 1 2 247.342 2.344 20 0 BEADLO C[C@H](O)c1cccc(N[C@H]2CCCSC2)[nH+]1 ZINC000892814520 582987856 /nfs/dbraw/zinc/98/78/56/582987856.db2.gz ZRFZHYFQILAQAF-UWVGGRQHSA-N 1 2 238.356 2.442 20 0 BEADLO Cc1ccc(COC(=O)[C@H]2CO[C@H](C)C2)c(C)[nH+]1 ZINC000784271945 583000897 /nfs/dbraw/zinc/00/08/97/583000897.db2.gz OHORXPJNMGJVRT-ZWNOBZJWSA-N 1 2 249.310 2.167 20 0 BEADLO CN(C)c1cc(N[C@H]2CCC(F)(F)C2)[nH+]cn1 ZINC000892938330 583013090 /nfs/dbraw/zinc/01/30/90/583013090.db2.gz LKJVOABMLDPNSW-QMMMGPOBSA-N 1 2 242.273 2.142 20 0 BEADLO CN(C)c1cc(N[C@H]2CCC(F)(F)C2)nc[nH+]1 ZINC000892938330 583013093 /nfs/dbraw/zinc/01/30/93/583013093.db2.gz LKJVOABMLDPNSW-QMMMGPOBSA-N 1 2 242.273 2.142 20 0 BEADLO CCc1cc(N2CC(C(F)F)C2)nc(CC)[nH+]1 ZINC000892943402 583014328 /nfs/dbraw/zinc/01/43/28/583014328.db2.gz FWABUZKSCYLIOR-UHFFFAOYSA-N 1 2 241.285 2.303 20 0 BEADLO CC[C@@H]([NH2+]Cc1cnccn1)c1nc(C)cs1 ZINC000856769131 588876794 /nfs/dbraw/zinc/87/67/94/588876794.db2.gz HSMDGDGYKIYKLG-LLVKDONJSA-N 1 2 248.355 2.482 20 0 BEADLO CCc1cc(N[C@H](COC)C2CC2)nc(CC)[nH+]1 ZINC000892951717 583017515 /nfs/dbraw/zinc/01/75/15/583017515.db2.gz VVGSTTOTNFTUKG-GFCCVEGCSA-N 1 2 249.358 2.438 20 0 BEADLO c1cc(-c2ccc(N[C@@H]3CCOC3)[nH+]c2)ccn1 ZINC000892953929 583018608 /nfs/dbraw/zinc/01/86/08/583018608.db2.gz OHHJNYQEVPNVNP-CYBMUJFWSA-N 1 2 241.294 2.344 20 0 BEADLO C[C@@H]1CCN(c2cc(N(C)C)[nH+]cn2)C[C@H]1C ZINC000893055484 583038472 /nfs/dbraw/zinc/03/84/72/583038472.db2.gz FCTAZIREGCACLP-GHMZBOCLSA-N 1 2 234.347 2.025 20 0 BEADLO C[C@@H]1CCN(c2cc(N(C)C)nc[nH+]2)C[C@H]1C ZINC000893055484 583038473 /nfs/dbraw/zinc/03/84/73/583038473.db2.gz FCTAZIREGCACLP-GHMZBOCLSA-N 1 2 234.347 2.025 20 0 BEADLO CN(C)c1cc(N2CC[C@H](C(C)(C)C)C2)nc[nH+]1 ZINC000893146721 583056870 /nfs/dbraw/zinc/05/68/70/583056870.db2.gz PABDQQCKCRYKKL-NSHDSACASA-N 1 2 248.374 2.415 20 0 BEADLO CN(C)c1cc(N2CC[C@H](C(C)(C)C)C2)[nH+]cn1 ZINC000893146721 583056873 /nfs/dbraw/zinc/05/68/73/583056873.db2.gz PABDQQCKCRYKKL-NSHDSACASA-N 1 2 248.374 2.415 20 0 BEADLO CN(C)c1cc(N2CC[C@@H](C(C)(C)C)C2)nc[nH+]1 ZINC000893146720 583056977 /nfs/dbraw/zinc/05/69/77/583056977.db2.gz PABDQQCKCRYKKL-LLVKDONJSA-N 1 2 248.374 2.415 20 0 BEADLO CN(C)c1cc(N2CC[C@@H](C(C)(C)C)C2)[nH+]cn1 ZINC000893146720 583056980 /nfs/dbraw/zinc/05/69/80/583056980.db2.gz PABDQQCKCRYKKL-LLVKDONJSA-N 1 2 248.374 2.415 20 0 BEADLO COc1ccc(C[NH2+]Cc2ccc(F)cn2)o1 ZINC000893153039 583058362 /nfs/dbraw/zinc/05/83/62/583058362.db2.gz YXUVFUOENBWRHY-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO CCc1onc(C)c1C[NH2+]Cc1ncccc1F ZINC000893184872 583066133 /nfs/dbraw/zinc/06/61/33/583066133.db2.gz YXESZIABXQTEPO-UHFFFAOYSA-N 1 2 249.289 2.369 20 0 BEADLO CCc1nnc(CNc2ccc[nH+]c2C)s1 ZINC000893198187 583069312 /nfs/dbraw/zinc/06/93/12/583069312.db2.gz LBNOTHCXEXOINL-UHFFFAOYSA-N 1 2 234.328 2.416 20 0 BEADLO Cc1nc(C[NH+]2C[C@@H](C)O[C@H](C)C2)sc1C ZINC000081643078 583083386 /nfs/dbraw/zinc/08/33/86/583083386.db2.gz PUTIIVXAWNMMPJ-RKDXNWHRSA-N 1 2 240.372 2.369 20 0 BEADLO CC(C)c1csc(C[NH2+]Cc2cnccn2)n1 ZINC000856773564 588877317 /nfs/dbraw/zinc/87/73/17/588877317.db2.gz KNRRGHCHGWSVKD-UHFFFAOYSA-N 1 2 248.355 2.346 20 0 BEADLO COc1ccc(C[N@@H+]2CCO[C@@H](C(C)C)C2)o1 ZINC000893400641 583136973 /nfs/dbraw/zinc/13/69/73/583136973.db2.gz GMQSDNOLUICMBY-GFCCVEGCSA-N 1 2 239.315 2.145 20 0 BEADLO COc1ccc(C[N@H+]2CCO[C@@H](C(C)C)C2)o1 ZINC000893400641 583136974 /nfs/dbraw/zinc/13/69/74/583136974.db2.gz GMQSDNOLUICMBY-GFCCVEGCSA-N 1 2 239.315 2.145 20 0 BEADLO Cc1cc(N2C[C@H](O)C[C@@H]2C)nc(C2CCC2)[nH+]1 ZINC000893428092 583141759 /nfs/dbraw/zinc/14/17/59/583141759.db2.gz REZFRTOHBOOJSJ-CMPLNLGQSA-N 1 2 247.342 2.012 20 0 BEADLO Cc1c[nH+]c2n1CC[C@H]2OC(=O)[C@H]1CC12CCC2 ZINC000893523606 583156764 /nfs/dbraw/zinc/15/67/64/583156764.db2.gz DYNCMSAJLFFOHA-GHMZBOCLSA-N 1 2 246.310 2.370 20 0 BEADLO FC1CN(Cc2[nH+]ccc3c2CCCC3)C1 ZINC000893522514 583156964 /nfs/dbraw/zinc/15/69/64/583156964.db2.gz UHYLAOGJXGFJAP-UHFFFAOYSA-N 1 2 220.291 2.114 20 0 BEADLO CS/C=C\C(=O)O[C@H]1CCn2c(C)c[nH+]c21 ZINC000893524755 583157496 /nfs/dbraw/zinc/15/74/96/583157496.db2.gz LHGLDIPCJBPSFL-RNEXMXFGSA-N 1 2 238.312 2.056 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2nncn2C)cc1F ZINC000094837549 583169937 /nfs/dbraw/zinc/16/99/37/583169937.db2.gz QEMDAIXVDDBXBF-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO CC[C@@]1(C)COCC[N@@H+]1Cc1ccc(OC)o1 ZINC000893664450 583191751 /nfs/dbraw/zinc/19/17/51/583191751.db2.gz BPGRSQOSSSTYGJ-ZDUSSCGKSA-N 1 2 239.315 2.289 20 0 BEADLO CC[C@@]1(C)COCC[N@H+]1Cc1ccc(OC)o1 ZINC000893664450 583191754 /nfs/dbraw/zinc/19/17/54/583191754.db2.gz BPGRSQOSSSTYGJ-ZDUSSCGKSA-N 1 2 239.315 2.289 20 0 BEADLO CCc1cc(NC2(COC)CC2)nc(CC)[nH+]1 ZINC000893679785 583197827 /nfs/dbraw/zinc/19/78/27/583197827.db2.gz ARNQLBRHFQYIIJ-UHFFFAOYSA-N 1 2 235.331 2.192 20 0 BEADLO CCc1cc(N2CC[C@@H]3C[C@@H]32)nc(CC)[nH+]1 ZINC000893680160 583198209 /nfs/dbraw/zinc/19/82/09/583198209.db2.gz HOBQIMOXDRQJLF-KOLCDFICSA-N 1 2 217.316 2.200 20 0 BEADLO C[C@H](O)c1cccc(N[C@@H]2CSC2(C)C)[nH+]1 ZINC000893728810 583215665 /nfs/dbraw/zinc/21/56/65/583215665.db2.gz WEIGOUZUXJXPAS-WCBMZHEXSA-N 1 2 238.356 2.441 20 0 BEADLO C[C@@H]1CN(Cc2[nH+]ccn2C2CC2)[C@H](C)[C@H](C)O1 ZINC000893888423 583243659 /nfs/dbraw/zinc/24/36/59/583243659.db2.gz IYDOIQJTMXRXML-UTUOFQBUSA-N 1 2 249.358 2.216 20 0 BEADLO COc1ccc(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)o1 ZINC000893889050 583243848 /nfs/dbraw/zinc/24/38/48/583243848.db2.gz SRAFCRDXJCPWIV-AXFHLTTASA-N 1 2 239.315 2.286 20 0 BEADLO COc1ccc(C[N@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)o1 ZINC000893889050 583243850 /nfs/dbraw/zinc/24/38/50/583243850.db2.gz SRAFCRDXJCPWIV-AXFHLTTASA-N 1 2 239.315 2.286 20 0 BEADLO CC[C@@]1(C)CN(Cc2[nH+]ccn2C2CC2)CCO1 ZINC000893907161 583244244 /nfs/dbraw/zinc/24/42/44/583244244.db2.gz HKHNFGDEWOZSLV-AWEZNQCLSA-N 1 2 249.358 2.219 20 0 BEADLO C=C=CCNc1cc(CC)[nH+]c(CC)n1 ZINC000893942383 583256339 /nfs/dbraw/zinc/25/63/39/583256339.db2.gz GGYVXFDXAIWFFO-UHFFFAOYSA-N 1 2 203.289 2.354 20 0 BEADLO COCC(C)(C)CNc1cccc([C@H](C)O)[nH+]1 ZINC000893952248 583260040 /nfs/dbraw/zinc/26/00/40/583260040.db2.gz WDQCZPGQMMDSPK-JTQLQIEISA-N 1 2 238.331 2.219 20 0 BEADLO CC[C@H]1C[N@H+](Cc2[nH]nc(C)c2C)C[C@@H](C)O1 ZINC000893976053 583265177 /nfs/dbraw/zinc/26/51/77/583265177.db2.gz LYJGHEBDMDGVSL-SKDRFNHKSA-N 1 2 237.347 2.026 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2[nH]nc(C)c2C)C[C@@H](C)O1 ZINC000893976053 583265180 /nfs/dbraw/zinc/26/51/80/583265180.db2.gz LYJGHEBDMDGVSL-SKDRFNHKSA-N 1 2 237.347 2.026 20 0 BEADLO Cc1ncoc1C[N@@H+]1CCC[C@H](c2ccn[nH]2)C1 ZINC000893994392 583267971 /nfs/dbraw/zinc/26/79/71/583267971.db2.gz FTIUFHUEEFMALQ-NSHDSACASA-N 1 2 246.314 2.086 20 0 BEADLO Cc1ncoc1C[N@H+]1CCC[C@H](c2ccn[nH]2)C1 ZINC000893994392 583267972 /nfs/dbraw/zinc/26/79/72/583267972.db2.gz FTIUFHUEEFMALQ-NSHDSACASA-N 1 2 246.314 2.086 20 0 BEADLO Cc1ncoc1C[N@@H+](C)Cc1scnc1C ZINC000894000020 583271578 /nfs/dbraw/zinc/27/15/78/583271578.db2.gz FDDAYQDEDVSABJ-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1ncoc1C[N@H+](C)Cc1scnc1C ZINC000894000020 583271580 /nfs/dbraw/zinc/27/15/80/583271580.db2.gz FDDAYQDEDVSABJ-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1[nH]nc(C[NH+]2C[C@@H](C)[C@H](C)C2)c1C ZINC000894034298 583278934 /nfs/dbraw/zinc/27/89/34/583278934.db2.gz PBALZDOQUJWZRS-RKDXNWHRSA-N 1 2 207.321 2.114 20 0 BEADLO Cc1[nH]nc(C[N@H+]2C[C@@H]3[C@H](C2)C3(C)C)c1C ZINC000894051661 583289308 /nfs/dbraw/zinc/28/93/08/583289308.db2.gz AAHBXERIIJXELM-PHIMTYICSA-N 1 2 219.332 2.114 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2C[C@@H]3[C@H](C2)C3(C)C)c1C ZINC000894051661 583289310 /nfs/dbraw/zinc/28/93/10/583289310.db2.gz AAHBXERIIJXELM-PHIMTYICSA-N 1 2 219.332 2.114 20 0 BEADLO C[C@@H](O)c1cccc(N[C@@H]2CC23CCOCC3)[nH+]1 ZINC000894081507 583294267 /nfs/dbraw/zinc/29/42/67/583294267.db2.gz ZKBVZYDXIODYME-ZYHUDNBSSA-N 1 2 248.326 2.116 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2ncc[nH]2)c(C)c1 ZINC000894091897 583299305 /nfs/dbraw/zinc/29/93/05/583299305.db2.gz VLBLFDWVFAHPCX-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2ncc[nH]2)c(C)c1 ZINC000894091897 583299309 /nfs/dbraw/zinc/29/93/09/583299309.db2.gz VLBLFDWVFAHPCX-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO CCc1ncc(CNc2cccc([C@H](C)O)[nH+]2)o1 ZINC000894100021 583304432 /nfs/dbraw/zinc/30/44/32/583304432.db2.gz UNFGHCKRUMKXNS-VIFPVBQESA-N 1 2 247.298 2.297 20 0 BEADLO Cc1cc(N2CC[C@@H](O)[C@H]2C)nc(C2CCC2)[nH+]1 ZINC000894104468 583306202 /nfs/dbraw/zinc/30/62/02/583306202.db2.gz CLEQRSASMGTLOU-ZYHUDNBSSA-N 1 2 247.342 2.012 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CC[C@@H]2C(C)C)c1C ZINC000894136671 583313939 /nfs/dbraw/zinc/31/39/39/583313939.db2.gz ANNOOBRTFSNKSR-GFCCVEGCSA-N 1 2 207.321 2.257 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CC[C@@H]2C(C)C)c1C ZINC000894136671 583313940 /nfs/dbraw/zinc/31/39/40/583313940.db2.gz ANNOOBRTFSNKSR-GFCCVEGCSA-N 1 2 207.321 2.257 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CC[C@H]2C(C)C)c1C ZINC000894136672 583314405 /nfs/dbraw/zinc/31/44/05/583314405.db2.gz ANNOOBRTFSNKSR-LBPRGKRZSA-N 1 2 207.321 2.257 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CC[C@H]2C(C)C)c1C ZINC000894136672 583314406 /nfs/dbraw/zinc/31/44/06/583314406.db2.gz ANNOOBRTFSNKSR-LBPRGKRZSA-N 1 2 207.321 2.257 20 0 BEADLO Cc1nn(C)c(C[NH+]2[C@H](C)C[C@H]2C)c1Cl ZINC000894138538 583315462 /nfs/dbraw/zinc/31/54/62/583315462.db2.gz FZLKFNPKICMXMA-HTQZYQBOSA-N 1 2 227.739 2.365 20 0 BEADLO CCc1cc(NCc2ncccn2)nc(CC)[nH+]1 ZINC000894153459 583318940 /nfs/dbraw/zinc/31/89/40/583318940.db2.gz RRYTYNCFAWNCNG-UHFFFAOYSA-N 1 2 243.314 2.004 20 0 BEADLO C[C@@H]1[C@@H](C)[C@H](C)CN1c1nccn2c[nH+]cc12 ZINC000894234410 583385259 /nfs/dbraw/zinc/38/52/59/583385259.db2.gz IMBRPNPNRUDBTB-OUAUKWLOSA-N 1 2 230.315 2.210 20 0 BEADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1c[nH]cn1)CC2 ZINC000894240457 583387450 /nfs/dbraw/zinc/38/74/50/583387450.db2.gz SUJHPECIYYKIOQ-CYBMUJFWSA-N 1 2 231.274 2.326 20 0 BEADLO Cn1c[nH+]cc1COC(=O)CC1CCCC1 ZINC000747778991 583388156 /nfs/dbraw/zinc/38/81/56/583388156.db2.gz AATJRPANAAQUJV-UHFFFAOYSA-N 1 2 222.288 2.044 20 0 BEADLO CC1(C)C[N@H+](CN2CCC2=O)[C@H]1c1ccccc1 ZINC000857231737 588897363 /nfs/dbraw/zinc/89/73/63/588897363.db2.gz QOVZUBNQJLFEKO-AWEZNQCLSA-N 1 2 244.338 2.259 20 0 BEADLO CC1(C)C[N@@H+](CN2CCC2=O)[C@H]1c1ccccc1 ZINC000857231737 588897364 /nfs/dbraw/zinc/89/73/64/588897364.db2.gz QOVZUBNQJLFEKO-AWEZNQCLSA-N 1 2 244.338 2.259 20 0 BEADLO COC[C@H]([NH2+]Cc1ocnc1C)c1ccco1 ZINC000894328869 583424397 /nfs/dbraw/zinc/42/43/97/583424397.db2.gz NUGZBXXIQGJRLJ-JTQLQIEISA-N 1 2 236.271 2.053 20 0 BEADLO c1[nH+]cn2ccnc(N3CC[C@H]4CCCC[C@H]43)c12 ZINC000894343078 583429348 /nfs/dbraw/zinc/42/93/48/583429348.db2.gz OZIGMDLHGJVUMR-VXGBXAGGSA-N 1 2 242.326 2.498 20 0 BEADLO CCc1noc(CC)c1C[NH2+]Cc1ocnc1C ZINC000894352867 583433590 /nfs/dbraw/zinc/43/35/90/583433590.db2.gz WREPZYGCPRXZBL-UHFFFAOYSA-N 1 2 249.314 2.386 20 0 BEADLO CC(C)Oc1ccc(NCc2c[nH+]c[nH]2)cn1 ZINC000894358498 583436471 /nfs/dbraw/zinc/43/64/71/583436471.db2.gz GXAPCGHQJKGJIF-UHFFFAOYSA-N 1 2 232.287 2.204 20 0 BEADLO CC(C)Oc1ccc(NCc2c[nH]c[nH+]2)cn1 ZINC000894358498 583436472 /nfs/dbraw/zinc/43/64/72/583436472.db2.gz GXAPCGHQJKGJIF-UHFFFAOYSA-N 1 2 232.287 2.204 20 0 BEADLO CO[C@H]1CCC[N@H+](Cc2n[nH]c(C)c2C)CC1 ZINC000894441579 583457939 /nfs/dbraw/zinc/45/79/39/583457939.db2.gz PGGKTCXKYMKVRJ-LBPRGKRZSA-N 1 2 237.347 2.027 20 0 BEADLO CO[C@H]1CCC[N@@H+](Cc2n[nH]c(C)c2C)CC1 ZINC000894441579 583457942 /nfs/dbraw/zinc/45/79/42/583457942.db2.gz PGGKTCXKYMKVRJ-LBPRGKRZSA-N 1 2 237.347 2.027 20 0 BEADLO Cc1cc2c(cc1NCc1c[nH+]c[nH]1)OCO2 ZINC000894434008 583458959 /nfs/dbraw/zinc/45/89/59/583458959.db2.gz KKSIYOLHJNTKSB-UHFFFAOYSA-N 1 2 231.255 2.059 20 0 BEADLO Cc1cc2c(cc1NCc1c[nH]c[nH+]1)OCO2 ZINC000894434008 583458962 /nfs/dbraw/zinc/45/89/62/583458962.db2.gz KKSIYOLHJNTKSB-UHFFFAOYSA-N 1 2 231.255 2.059 20 0 BEADLO Cn1nc(C2CCCC2)cc1NCc1c[nH+]c[nH]1 ZINC000894439889 583460231 /nfs/dbraw/zinc/46/02/31/583460231.db2.gz PYTLWJOSVSQFTA-UHFFFAOYSA-N 1 2 245.330 2.413 20 0 BEADLO Cn1nc(C2CCCC2)cc1NCc1c[nH]c[nH+]1 ZINC000894439889 583460234 /nfs/dbraw/zinc/46/02/34/583460234.db2.gz PYTLWJOSVSQFTA-UHFFFAOYSA-N 1 2 245.330 2.413 20 0 BEADLO Cc1n[nH]c(C[N@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)c1C ZINC000894532708 583478721 /nfs/dbraw/zinc/47/87/21/583478721.db2.gz DVQZDDLCJOAQBG-UWJYBYFXSA-N 1 2 237.347 2.024 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)c1C ZINC000894532708 583478723 /nfs/dbraw/zinc/47/87/23/583478723.db2.gz DVQZDDLCJOAQBG-UWJYBYFXSA-N 1 2 237.347 2.024 20 0 BEADLO Cc1nnc(C[N@@H+]2CC(C)(C)[C@H]2C2CC2)s1 ZINC000894544808 583481972 /nfs/dbraw/zinc/48/19/72/583481972.db2.gz PHGNCYWNVDKRBJ-LLVKDONJSA-N 1 2 237.372 2.467 20 0 BEADLO Cc1nnc(C[N@H+]2CC(C)(C)[C@H]2C2CC2)s1 ZINC000894544808 583481974 /nfs/dbraw/zinc/48/19/74/583481974.db2.gz PHGNCYWNVDKRBJ-LLVKDONJSA-N 1 2 237.372 2.467 20 0 BEADLO Cc1n[nH]c(C[N@H+]2CC(C)(C)OC[C@@H]2C)c1C ZINC000894560306 583482730 /nfs/dbraw/zinc/48/27/30/583482730.db2.gz XOWNZTUMEOXOMR-VIFPVBQESA-N 1 2 237.347 2.026 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2CC(C)(C)OC[C@@H]2C)c1C ZINC000894560306 583482732 /nfs/dbraw/zinc/48/27/32/583482732.db2.gz XOWNZTUMEOXOMR-VIFPVBQESA-N 1 2 237.347 2.026 20 0 BEADLO CC[C@H](C)n1ncc(NCc2c[nH+]c[nH]2)c1C ZINC000894553512 583483311 /nfs/dbraw/zinc/48/33/11/583483311.db2.gz LAHWWXJWRRICOZ-VIFPVBQESA-N 1 2 233.319 2.498 20 0 BEADLO CC[C@H](C)n1ncc(NCc2c[nH]c[nH+]2)c1C ZINC000894553512 583483312 /nfs/dbraw/zinc/48/33/12/583483312.db2.gz LAHWWXJWRRICOZ-VIFPVBQESA-N 1 2 233.319 2.498 20 0 BEADLO CSc1ccc(CN(C)Cc2[nH]cc[nH+]2)o1 ZINC000894587112 583490354 /nfs/dbraw/zinc/49/03/54/583490354.db2.gz QFCFYIUJFSDVFW-UHFFFAOYSA-N 1 2 237.328 2.357 20 0 BEADLO Cc1ncoc1C[N@@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000894595535 583493067 /nfs/dbraw/zinc/49/30/67/583493067.db2.gz HPPOUJCHSKRDAD-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1ncoc1C[N@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000894595535 583493069 /nfs/dbraw/zinc/49/30/69/583493069.db2.gz HPPOUJCHSKRDAD-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2C[C@@H](C3CC3)O[C@@H](C)C2)c1C ZINC000894598240 583493706 /nfs/dbraw/zinc/49/37/06/583493706.db2.gz XKXPTDFUHKBCBZ-XPTSAGLGSA-N 1 2 249.358 2.026 20 0 BEADLO Cc1n[nH]c(C[N@H+]2C[C@@H](C3CC3)O[C@@H](C)C2)c1C ZINC000894598240 583493707 /nfs/dbraw/zinc/49/37/07/583493707.db2.gz XKXPTDFUHKBCBZ-XPTSAGLGSA-N 1 2 249.358 2.026 20 0 BEADLO Cc1cc(F)ncc1C[NH2+]CC(C)(F)F ZINC000894623066 583496038 /nfs/dbraw/zinc/49/60/38/583496038.db2.gz CRWMLDMZAYHOFY-UHFFFAOYSA-N 1 2 218.222 2.274 20 0 BEADLO Cc1nn(C)c(C[N@H+]2C[C@@H](C)[C@H]2C)c1Cl ZINC000894629164 583497508 /nfs/dbraw/zinc/49/75/08/583497508.db2.gz UOFPRKCYTIKAGK-VXNVDRBHSA-N 1 2 227.739 2.222 20 0 BEADLO Cc1nn(C)c(C[N@@H+]2C[C@@H](C)[C@H]2C)c1Cl ZINC000894629164 583497510 /nfs/dbraw/zinc/49/75/10/583497510.db2.gz UOFPRKCYTIKAGK-VXNVDRBHSA-N 1 2 227.739 2.222 20 0 BEADLO CCOc1ccc(C[NH2+][C@H]2CCn3ccnc32)o1 ZINC000894667583 583502330 /nfs/dbraw/zinc/50/23/30/583502330.db2.gz IBLHEEIJKBBRSR-NSHDSACASA-N 1 2 247.298 2.109 20 0 BEADLO O=c1[nH]c2cccc(C[N@H+]3CC[C@H](F)C3)c2o1 ZINC000894670456 583502856 /nfs/dbraw/zinc/50/28/56/583502856.db2.gz HWBXOLCRKAJWGB-VIFPVBQESA-N 1 2 236.246 2.077 20 0 BEADLO O=c1[nH]c2cccc(C[N@@H+]3CC[C@H](F)C3)c2o1 ZINC000894670456 583502858 /nfs/dbraw/zinc/50/28/58/583502858.db2.gz HWBXOLCRKAJWGB-VIFPVBQESA-N 1 2 236.246 2.077 20 0 BEADLO O=c1[nH]c2cccc(C[N@H+]3CC[C@@H](F)C3)c2o1 ZINC000894670455 583503255 /nfs/dbraw/zinc/50/32/55/583503255.db2.gz HWBXOLCRKAJWGB-SECBINFHSA-N 1 2 236.246 2.077 20 0 BEADLO O=c1[nH]c2cccc(C[N@@H+]3CC[C@@H](F)C3)c2o1 ZINC000894670455 583503258 /nfs/dbraw/zinc/50/32/58/583503258.db2.gz HWBXOLCRKAJWGB-SECBINFHSA-N 1 2 236.246 2.077 20 0 BEADLO CCOc1ccc(C[N@@H+]2CC[C@@H](F)C2)o1 ZINC000894673205 583504082 /nfs/dbraw/zinc/50/40/82/583504082.db2.gz YGECDTYHAHFZOX-SECBINFHSA-N 1 2 213.252 2.222 20 0 BEADLO CCOc1ccc(C[N@H+]2CC[C@@H](F)C2)o1 ZINC000894673205 583504084 /nfs/dbraw/zinc/50/40/84/583504084.db2.gz YGECDTYHAHFZOX-SECBINFHSA-N 1 2 213.252 2.222 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)c1ccccc1C ZINC000857746174 588907533 /nfs/dbraw/zinc/90/75/33/588907533.db2.gz YEMDQOVBCZKCJT-UHFFFAOYSA-N 1 2 243.310 2.232 20 0 BEADLO CCc1nc(C[NH2+]Cc2cnc(F)c(C)c2)co1 ZINC000894746508 583515250 /nfs/dbraw/zinc/51/52/50/583515250.db2.gz ZFRKNAKHDOKKJO-UHFFFAOYSA-N 1 2 249.289 2.369 20 0 BEADLO CCc1nc(C[NH2+]Cc2c(C)noc2CC)co1 ZINC000894746480 583515419 /nfs/dbraw/zinc/51/54/19/583515419.db2.gz YQAQNHCYXBBQIB-UHFFFAOYSA-N 1 2 249.314 2.386 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2nnc(C)[nH]2)c(C)o1 ZINC000894772159 583516922 /nfs/dbraw/zinc/51/69/22/583516922.db2.gz GKFUHOMIFMBXTR-QMMMGPOBSA-N 1 2 234.303 2.174 20 0 BEADLO C[C@@H](Nc1cc(N(C)C)nc[nH+]1)c1ccns1 ZINC000894815222 583524006 /nfs/dbraw/zinc/52/40/06/583524006.db2.gz IREYZZQANYLSFE-MRVPVSSYSA-N 1 2 249.343 2.172 20 0 BEADLO C[C@@H](Nc1cc(N(C)C)[nH+]cn1)c1ccns1 ZINC000894815222 583524007 /nfs/dbraw/zinc/52/40/07/583524007.db2.gz IREYZZQANYLSFE-MRVPVSSYSA-N 1 2 249.343 2.172 20 0 BEADLO C[C@H](Nc1cc(N(C)C)nc[nH+]1)c1ccns1 ZINC000894815224 583524400 /nfs/dbraw/zinc/52/44/00/583524400.db2.gz IREYZZQANYLSFE-QMMMGPOBSA-N 1 2 249.343 2.172 20 0 BEADLO C[C@H](Nc1cc(N(C)C)[nH+]cn1)c1ccns1 ZINC000894815224 583524401 /nfs/dbraw/zinc/52/44/01/583524401.db2.gz IREYZZQANYLSFE-QMMMGPOBSA-N 1 2 249.343 2.172 20 0 BEADLO CCOC1C[NH+](Cc2ccc3c(c2)C[C@H](C)O3)C1 ZINC000894819758 583525078 /nfs/dbraw/zinc/52/50/78/583525078.db2.gz QDLCFCLAKOATAX-NSHDSACASA-N 1 2 247.338 2.231 20 0 BEADLO CCn1cc(C[NH+]2CC(C3CCCCC3)C2)nn1 ZINC000894826209 583526731 /nfs/dbraw/zinc/52/67/31/583526731.db2.gz UMUUTEXCWLGFCV-UHFFFAOYSA-N 1 2 248.374 2.310 20 0 BEADLO C[C@@H]1C[N@H+](Cc2c(C(F)(F)F)cnn2C)[C@@H]1C ZINC000894861465 583536441 /nfs/dbraw/zinc/53/64/41/583536441.db2.gz HTEMXIBJXXMUSE-HTQZYQBOSA-N 1 2 247.264 2.279 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2c(C(F)(F)F)cnn2C)[C@@H]1C ZINC000894861465 583536443 /nfs/dbraw/zinc/53/64/43/583536443.db2.gz HTEMXIBJXXMUSE-HTQZYQBOSA-N 1 2 247.264 2.279 20 0 BEADLO CSc1ccc(C[N@H+](C2CC2)C2COC2)o1 ZINC000894869404 583539675 /nfs/dbraw/zinc/53/96/75/583539675.db2.gz UZNYBZBGOUEXEL-UHFFFAOYSA-N 1 2 239.340 2.365 20 0 BEADLO CSc1ccc(C[N@@H+](C2CC2)C2COC2)o1 ZINC000894869404 583539676 /nfs/dbraw/zinc/53/96/76/583539676.db2.gz UZNYBZBGOUEXEL-UHFFFAOYSA-N 1 2 239.340 2.365 20 0 BEADLO CCNc1cc(CNc2ncc(C)cn2)cc[nH+]1 ZINC000894873365 583540235 /nfs/dbraw/zinc/54/02/35/583540235.db2.gz RLGPVKAXSXBOFS-UHFFFAOYSA-N 1 2 243.314 2.224 20 0 BEADLO Cc1nc2c(s1)CN(c1cc(C)[nH+]cn1)C2 ZINC000894904062 583552895 /nfs/dbraw/zinc/55/28/95/583552895.db2.gz YWDCASOLEZHHDG-UHFFFAOYSA-N 1 2 232.312 2.070 20 0 BEADLO CNc1cc(N[C@@H](C)c2cnc(C)s2)nc[nH+]1 ZINC000894923752 583556814 /nfs/dbraw/zinc/55/68/14/583556814.db2.gz LQACLBGOHCSQNM-ZETCQYMHSA-N 1 2 249.343 2.456 20 0 BEADLO CNc1cc(N[C@@H](C)c2cnc(C)s2)[nH+]cn1 ZINC000894923752 583556815 /nfs/dbraw/zinc/55/68/15/583556815.db2.gz LQACLBGOHCSQNM-ZETCQYMHSA-N 1 2 249.343 2.456 20 0 BEADLO COC[C@H]1CCCC[N@@H+]1Cc1n[nH]c(C)c1C ZINC000894949309 583558985 /nfs/dbraw/zinc/55/89/85/583558985.db2.gz VBHCEXSDOVKULV-GFCCVEGCSA-N 1 2 237.347 2.027 20 0 BEADLO COC[C@H]1CCCC[N@H+]1Cc1n[nH]c(C)c1C ZINC000894949309 583558987 /nfs/dbraw/zinc/55/89/87/583558987.db2.gz VBHCEXSDOVKULV-GFCCVEGCSA-N 1 2 237.347 2.027 20 0 BEADLO COC[C@@H]1CCCC[N@@H+]1Cc1n[nH]c(C)c1C ZINC000894949310 583559254 /nfs/dbraw/zinc/55/92/54/583559254.db2.gz VBHCEXSDOVKULV-LBPRGKRZSA-N 1 2 237.347 2.027 20 0 BEADLO COC[C@@H]1CCCC[N@H+]1Cc1n[nH]c(C)c1C ZINC000894949310 583559256 /nfs/dbraw/zinc/55/92/56/583559256.db2.gz VBHCEXSDOVKULV-LBPRGKRZSA-N 1 2 237.347 2.027 20 0 BEADLO Cc1nc(N2CC(OC(C)C)C2)c(C)c(C)[nH+]1 ZINC000894968451 583560798 /nfs/dbraw/zinc/56/07/98/583560798.db2.gz YZGAVMFTNBXLKO-UHFFFAOYSA-N 1 2 235.331 2.015 20 0 BEADLO Cc1ccccc1CC1C[NH+](Cc2cnc[nH]2)C1 ZINC000894970698 583561183 /nfs/dbraw/zinc/56/11/83/583561183.db2.gz LACLBRUJSTXVHL-UHFFFAOYSA-N 1 2 241.338 2.393 20 0 BEADLO CCc1cc(N2CC(OC(C)C)C2)nc(CC)[nH+]1 ZINC000894975698 583561768 /nfs/dbraw/zinc/56/17/68/583561768.db2.gz OACZHWOPCKTRKX-UHFFFAOYSA-N 1 2 249.358 2.215 20 0 BEADLO COC(C)(C)CCNc1cccc([C@@H](C)O)[nH+]1 ZINC000895001087 583565139 /nfs/dbraw/zinc/56/51/39/583565139.db2.gz WFWMTCBVQXVZRP-SNVBAGLBSA-N 1 2 238.331 2.362 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CC[C@@H](OC(C)C)C2)c1C ZINC000895074065 583580332 /nfs/dbraw/zinc/58/03/32/583580332.db2.gz LHSSTWHYVOWHQV-GFCCVEGCSA-N 1 2 237.347 2.026 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CC[C@@H](OC(C)C)C2)c1C ZINC000895074065 583580333 /nfs/dbraw/zinc/58/03/33/583580333.db2.gz LHSSTWHYVOWHQV-GFCCVEGCSA-N 1 2 237.347 2.026 20 0 BEADLO CCc1cc(C[NH2+][C@H]2CCCc3cn[nH]c32)on1 ZINC000857855654 588913562 /nfs/dbraw/zinc/91/35/62/588913562.db2.gz VPWBPEZQWHGBLE-LBPRGKRZSA-N 1 2 246.314 2.127 20 0 BEADLO CCc1cc(C[NH2+][C@H]2CCCc3c[nH]nc32)on1 ZINC000857855654 588913564 /nfs/dbraw/zinc/91/35/64/588913564.db2.gz VPWBPEZQWHGBLE-LBPRGKRZSA-N 1 2 246.314 2.127 20 0 BEADLO C[C@H](O)c1cccc(N[C@@H]2CC23CCC3)[nH+]1 ZINC000895090357 583586269 /nfs/dbraw/zinc/58/62/69/583586269.db2.gz MLSDJAQRRDCMFU-GXSJLCMTSA-N 1 2 218.300 2.489 20 0 BEADLO Cc1nc(N2CC3(CC3)C2)c2c([nH+]1)CCCC2 ZINC000334792614 583589834 /nfs/dbraw/zinc/58/98/34/583589834.db2.gz HJMJVHNMMRBCMH-UHFFFAOYSA-N 1 2 229.327 2.264 20 0 BEADLO Cc1ncoc1C[N@H+]1C[C@H](C)OCC12CCC2 ZINC000895142598 583603385 /nfs/dbraw/zinc/60/33/85/583603385.db2.gz RAZDKXIRFLCYDY-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO Cc1ncoc1C[N@@H+]1C[C@H](C)OCC12CCC2 ZINC000895142598 583603387 /nfs/dbraw/zinc/60/33/87/583603387.db2.gz RAZDKXIRFLCYDY-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO CCc1cc[nH+]cc1N[C@H]1CC[C@@H](C(=O)OC)C1 ZINC000895142954 583603549 /nfs/dbraw/zinc/60/35/49/583603549.db2.gz YKRHEPKMCBKCTG-NEPJUHHUSA-N 1 2 248.326 2.398 20 0 BEADLO CC[C@@H]1CN(Cc2[nH+]ccn2C2CC2)[C@@H](C)CO1 ZINC000895148706 583605515 /nfs/dbraw/zinc/60/55/15/583605515.db2.gz XCAWQZIUFIBAQW-WCQYABFASA-N 1 2 249.358 2.217 20 0 BEADLO Cc1noc2ncc(C[N@@H+]3CCC[C@@H](F)C3)cc12 ZINC000895150670 583606511 /nfs/dbraw/zinc/60/65/11/583606511.db2.gz NRBQYHZBJUSJJQ-LLVKDONJSA-N 1 2 249.289 2.465 20 0 BEADLO Cc1noc2ncc(C[N@H+]3CCC[C@@H](F)C3)cc12 ZINC000895150670 583606512 /nfs/dbraw/zinc/60/65/12/583606512.db2.gz NRBQYHZBJUSJJQ-LLVKDONJSA-N 1 2 249.289 2.465 20 0 BEADLO Cc1ncoc1C[NH2+]Cc1cnc(Cl)s1 ZINC000895152368 583606701 /nfs/dbraw/zinc/60/67/01/583606701.db2.gz SVHVBPNGBDRLCG-UHFFFAOYSA-N 1 2 243.719 2.383 20 0 BEADLO Cc1[nH+]cnc(NC[C@@]2(O)CCC[C@@H]2C)c1C ZINC000882402988 583615165 /nfs/dbraw/zinc/61/51/65/583615165.db2.gz DDPNOBAFEBGDPS-ZANVPECISA-N 1 2 235.331 2.056 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@H](F)C2)cnc1F ZINC000895190850 583620566 /nfs/dbraw/zinc/62/05/66/583620566.db2.gz DAYZOELTGCAOOD-LLVKDONJSA-N 1 2 226.270 2.463 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@H](F)C2)cnc1F ZINC000895190850 583620567 /nfs/dbraw/zinc/62/05/67/583620567.db2.gz DAYZOELTGCAOOD-LLVKDONJSA-N 1 2 226.270 2.463 20 0 BEADLO c1[nH]c(CNc2ccc3c(c2)CCOC3)c[nH+]1 ZINC000895277588 583635925 /nfs/dbraw/zinc/63/59/25/583635925.db2.gz IWVOIACIHUBMOZ-UHFFFAOYSA-N 1 2 229.283 2.095 20 0 BEADLO c1[nH]cc(CNc2ccc3c(c2)CCOC3)[nH+]1 ZINC000895277588 583635927 /nfs/dbraw/zinc/63/59/27/583635927.db2.gz IWVOIACIHUBMOZ-UHFFFAOYSA-N 1 2 229.283 2.095 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CCC(F)CC2)[nH+]1 ZINC000882806550 583640415 /nfs/dbraw/zinc/64/04/15/583640415.db2.gz GBGCBIJHTNNQGO-UHFFFAOYSA-N 1 2 234.278 2.205 20 0 BEADLO Cc1nc(N2CC[C@@H](CF)C2)c2c([nH+]1)CCCC2 ZINC000882841502 583643824 /nfs/dbraw/zinc/64/38/24/583643824.db2.gz XZZTWSRWTLXBIL-NSHDSACASA-N 1 2 249.333 2.460 20 0 BEADLO CCOc1ccc(CN(C)Cc2c[nH+]c[nH]2)o1 ZINC000895303912 583645455 /nfs/dbraw/zinc/64/54/55/583645455.db2.gz YQGAVKCIJDJDQY-UHFFFAOYSA-N 1 2 235.287 2.033 20 0 BEADLO CC(C)CC[C@H](O)C[N@@H+]1Cc2ccncc2C1 ZINC000857879526 588919568 /nfs/dbraw/zinc/91/95/68/588919568.db2.gz HMDTZDNBHDWMNI-AWEZNQCLSA-N 1 2 234.343 2.194 20 0 BEADLO CC(C)CC[C@H](O)C[N@H+]1Cc2ccncc2C1 ZINC000857879526 588919569 /nfs/dbraw/zinc/91/95/69/588919569.db2.gz HMDTZDNBHDWMNI-AWEZNQCLSA-N 1 2 234.343 2.194 20 0 BEADLO CCCOc1cncc(NCc2c[nH+]c[nH]2)c1 ZINC000895393964 583664548 /nfs/dbraw/zinc/66/45/48/583664548.db2.gz QZNWIMOXJSLCRS-UHFFFAOYSA-N 1 2 232.287 2.206 20 0 BEADLO CCCOc1cncc(NCc2c[nH]c[nH+]2)c1 ZINC000895393964 583664549 /nfs/dbraw/zinc/66/45/49/583664549.db2.gz QZNWIMOXJSLCRS-UHFFFAOYSA-N 1 2 232.287 2.206 20 0 BEADLO CC(C)c1c[nH]c(CN2CC[C@H]2C(F)F)[nH+]1 ZINC000895431952 583670542 /nfs/dbraw/zinc/67/05/42/583670542.db2.gz YFAQYNROKYLHLX-VIFPVBQESA-N 1 2 229.274 2.373 20 0 BEADLO CO[C@@](C)(C[N@@H+]1CC[C@H]1C(F)F)C1CC1 ZINC000895432058 583670874 /nfs/dbraw/zinc/67/08/74/583670874.db2.gz UATMGBUZMNSZSA-ONGXEEELSA-N 1 2 219.275 2.141 20 0 BEADLO CO[C@@](C)(C[N@H+]1CC[C@H]1C(F)F)C1CC1 ZINC000895432058 583670875 /nfs/dbraw/zinc/67/08/75/583670875.db2.gz UATMGBUZMNSZSA-ONGXEEELSA-N 1 2 219.275 2.141 20 0 BEADLO C[C@@H]1C[C@@H](C[N@@H+]2CC[C@@H]2C(F)F)CCO1 ZINC000895432793 583671341 /nfs/dbraw/zinc/67/13/41/583671341.db2.gz PXPOPNLHHHVGFE-KXUCPTDWSA-N 1 2 219.275 2.141 20 0 BEADLO C[C@@H]1C[C@@H](C[N@H+]2CC[C@@H]2C(F)F)CCO1 ZINC000895432793 583671343 /nfs/dbraw/zinc/67/13/43/583671343.db2.gz PXPOPNLHHHVGFE-KXUCPTDWSA-N 1 2 219.275 2.141 20 0 BEADLO COC1(C[N@@H+]2CC[C@H]2C(F)F)CCCC1 ZINC000895432880 583671429 /nfs/dbraw/zinc/67/14/29/583671429.db2.gz RBPOQHYOCNGNDJ-VIFPVBQESA-N 1 2 219.275 2.285 20 0 BEADLO COC1(C[N@H+]2CC[C@H]2C(F)F)CCCC1 ZINC000895432880 583671430 /nfs/dbraw/zinc/67/14/30/583671430.db2.gz RBPOQHYOCNGNDJ-VIFPVBQESA-N 1 2 219.275 2.285 20 0 BEADLO Cc1cc(N[C@@H]2C[C@H]2[C@@H]2C[C@H]2C)nc[nH+]1 ZINC000895538216 583687495 /nfs/dbraw/zinc/68/74/95/583687495.db2.gz ZNWKFCRZAQNCOA-CZULRBLNSA-N 1 2 203.289 2.241 20 0 BEADLO Cn1ccc([C@@H]2CCCN(c3cccc[nH+]3)C2)n1 ZINC000895632055 583698600 /nfs/dbraw/zinc/69/86/00/583698600.db2.gz LZJXDVVXTLWWFI-GFCCVEGCSA-N 1 2 242.326 2.199 20 0 BEADLO Cc1cnc(Cl)c(CNCc2[nH]cc[nH+]2)c1 ZINC000895703436 583709470 /nfs/dbraw/zinc/70/94/70/583709470.db2.gz BQZBXWCNTHYYAK-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO Cc1cnc(Cl)c(C[NH2+]Cc2ncc[nH]2)c1 ZINC000895703436 583709471 /nfs/dbraw/zinc/70/94/71/583709471.db2.gz BQZBXWCNTHYYAK-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO C[C@H]([NH2+]Cc1cc(C2CC2)nn1C)c1ncco1 ZINC000895765468 583723171 /nfs/dbraw/zinc/72/31/71/583723171.db2.gz NGIVJCKELLZDEL-VIFPVBQESA-N 1 2 246.314 2.136 20 0 BEADLO C[C@@H]([NH2+]Cc1cc(C2CC2)nn1C)c1ncco1 ZINC000895765467 583723205 /nfs/dbraw/zinc/72/32/05/583723205.db2.gz NGIVJCKELLZDEL-SECBINFHSA-N 1 2 246.314 2.136 20 0 BEADLO O=C1OCC[C@@H]1[NH2+]C1CC2(C1)CCCCC2 ZINC000895809225 583730187 /nfs/dbraw/zinc/73/01/87/583730187.db2.gz RJPZHMQPWPWRJQ-NSHDSACASA-N 1 2 223.316 2.004 20 0 BEADLO O=C1OCC[C@@H]1[NH2+]Cc1cc2ccccc2s1 ZINC000895801359 583731173 /nfs/dbraw/zinc/73/11/73/583731173.db2.gz ILOHWQBFVQNBSG-NSHDSACASA-N 1 2 247.319 2.306 20 0 BEADLO O=C1OCC[C@@H]1[NH2+][C@H]1CC[C@@H](c2ccccc2)C1 ZINC000895803034 583731360 /nfs/dbraw/zinc/73/13/60/583731360.db2.gz AIQQJDRCOHTGII-RDBSUJKOSA-N 1 2 245.322 2.228 20 0 BEADLO C[C@H](CC[NH2+][C@H]1CCOC1=O)c1ccccc1 ZINC000895804397 583731504 /nfs/dbraw/zinc/73/15/04/583731504.db2.gz RGWCTQMVKYGFBZ-YPMHNXCESA-N 1 2 233.311 2.085 20 0 BEADLO Cc1nn(C)c(C[NH+]2CC(C)(C)C2)c1Cl ZINC000895826102 583733162 /nfs/dbraw/zinc/73/31/62/583733162.db2.gz QSXXVHSNCDFTCA-UHFFFAOYSA-N 1 2 227.739 2.224 20 0 BEADLO COc1nccc(C[NH+]2CC(C)(C)C2)c1F ZINC000895826085 583733227 /nfs/dbraw/zinc/73/32/27/583733227.db2.gz QHXMOXAWULKAEY-UHFFFAOYSA-N 1 2 224.279 2.071 20 0 BEADLO CC(C)c1nc(N[C@@H]2COC[C@H]2C)cc[nH+]1 ZINC000895905058 583742879 /nfs/dbraw/zinc/74/28/79/583742879.db2.gz HOHGRGPPMXXOQC-NXEZZACHSA-N 1 2 221.304 2.047 20 0 BEADLO C[C@H]1COC[C@@H]1Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000895904300 583743099 /nfs/dbraw/zinc/74/30/99/583743099.db2.gz BHWOVDYCEKXZEN-UWVGGRQHSA-N 1 2 235.331 2.221 20 0 BEADLO CCc1cc(N[C@H]2COC[C@@H]2C)nc(CC)[nH+]1 ZINC000895909599 583745402 /nfs/dbraw/zinc/74/54/02/583745402.db2.gz PPIQGQRRHZOKFX-ONGXEEELSA-N 1 2 235.331 2.048 20 0 BEADLO C[C@H]1CC[C@H](C(=O)N[C@H]2CCn3c[nH+]cc32)CC1 ZINC000857976108 588926065 /nfs/dbraw/zinc/92/60/65/588926065.db2.gz XRXWPMKPAMSESH-SRVKXCTJSA-N 1 2 247.342 2.270 20 0 BEADLO CC(C)OC1C[NH+](Cc2cccc(F)c2)C1 ZINC000895952426 583751584 /nfs/dbraw/zinc/75/15/84/583751584.db2.gz NHCXMYKKMSPPRH-UHFFFAOYSA-N 1 2 223.291 2.435 20 0 BEADLO Cc1ncc(C[NH+]2CC(OC(C)C)C2)s1 ZINC000895952872 583751636 /nfs/dbraw/zinc/75/16/36/583751636.db2.gz RMLWUGZTSCUSSC-UHFFFAOYSA-N 1 2 226.345 2.061 20 0 BEADLO CC(C)OC1C[NH+](Cc2cccc3c2OCO3)C1 ZINC000895953608 583752291 /nfs/dbraw/zinc/75/22/91/583752291.db2.gz ZGKDMEPDRXIDTI-UHFFFAOYSA-N 1 2 249.310 2.025 20 0 BEADLO Cc1coc(C[NH+]2CC(OC(C)C)C2)c1 ZINC000895956563 583752694 /nfs/dbraw/zinc/75/26/94/583752694.db2.gz NSVFGVCDOCQBJG-UHFFFAOYSA-N 1 2 209.289 2.197 20 0 BEADLO CO[C@@H]1C[N@H+](Cc2coc3ccccc23)CCO1 ZINC000895968498 583755081 /nfs/dbraw/zinc/75/50/81/583755081.db2.gz OOYOYCPVKNXFCK-AWEZNQCLSA-N 1 2 247.294 2.238 20 0 BEADLO CO[C@@H]1C[N@@H+](Cc2coc3ccccc23)CCO1 ZINC000895968498 583755083 /nfs/dbraw/zinc/75/50/83/583755083.db2.gz OOYOYCPVKNXFCK-AWEZNQCLSA-N 1 2 247.294 2.238 20 0 BEADLO COCC1C[NH+](Cc2csc(C3CC3)n2)C1 ZINC000895971507 583756347 /nfs/dbraw/zinc/75/63/47/583756347.db2.gz ROQBGHATGINICM-UHFFFAOYSA-N 1 2 238.356 2.099 20 0 BEADLO CC(C)(C(=O)N[C@@H]1CCn2c[nH+]cc21)C1CCC1 ZINC000857977685 588926976 /nfs/dbraw/zinc/92/69/76/588926976.db2.gz XRBCGNYIIWQIPQ-LLVKDONJSA-N 1 2 247.342 2.270 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857978880 588927317 /nfs/dbraw/zinc/92/73/17/588927317.db2.gz RKLJAGGUYYTGPL-IJLUTSLNSA-N 1 2 247.342 2.270 20 0 BEADLO C[C@@H]1CCC[C@]1(C)C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857979598 588927527 /nfs/dbraw/zinc/92/75/27/588927527.db2.gz WUJOAFJXPGMBMB-GYSYKLTISA-N 1 2 247.342 2.270 20 0 BEADLO CC1(C)CC[C@@H](C(=O)N[C@H]2CCn3c[nH+]cc32)C1 ZINC000857981957 588927801 /nfs/dbraw/zinc/92/78/01/588927801.db2.gz KIGNJDFOHFPPRB-MNOVXSKESA-N 1 2 247.342 2.270 20 0 BEADLO Fc1c[nH+]ccc1NC[C@@H]1C[C@H]1C(F)(F)F ZINC000896087107 583769236 /nfs/dbraw/zinc/76/92/36/583769236.db2.gz GQEBHWOXEBNTCE-NKWVEPMBSA-N 1 2 234.196 2.253 20 0 BEADLO c1ccc(NC[C@@H]2C=C[C@H]3C[C@@H]2CO3)[nH+]c1 ZINC000896082124 583769686 /nfs/dbraw/zinc/76/96/86/583769686.db2.gz KNXFXWDRVJUMRJ-TUAOUCFPSA-N 1 2 216.284 2.085 20 0 BEADLO O=C(C[C@@H]1C=CCCC1)N[C@@H]1CCn2c[nH+]cc21 ZINC000857981124 588927997 /nfs/dbraw/zinc/92/79/97/588927997.db2.gz ACBZNPGYURUWSO-VXGBXAGGSA-N 1 2 245.326 2.191 20 0 BEADLO CC(C)C[C@H](C)C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857982589 588928080 /nfs/dbraw/zinc/92/80/80/588928080.db2.gz QMZYSIPIFVDYJA-QWRGUYRKSA-N 1 2 235.331 2.126 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857981826 588928151 /nfs/dbraw/zinc/92/81/51/588928151.db2.gz JNCAYWUKAKHRJF-HBNTYKKESA-N 1 2 235.331 2.126 20 0 BEADLO C[C@@H](c1noc(C2([NH+](C)C)CC2)n1)C1CC1 ZINC000896148032 583776312 /nfs/dbraw/zinc/77/63/12/583776312.db2.gz FACCJLCYCGOFNM-MRVPVSSYSA-N 1 2 221.304 2.134 20 0 BEADLO CCC[N@H+](CC)Cn1ncn(CC)c1=S ZINC000727820905 583777963 /nfs/dbraw/zinc/77/79/63/583777963.db2.gz RFTQVOCURPHZRX-UHFFFAOYSA-N 1 2 228.365 2.123 20 0 BEADLO CCC[N@@H+](CC)Cn1ncn(CC)c1=S ZINC000727820905 583777966 /nfs/dbraw/zinc/77/79/66/583777966.db2.gz RFTQVOCURPHZRX-UHFFFAOYSA-N 1 2 228.365 2.123 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857983238 588928680 /nfs/dbraw/zinc/92/86/80/588928680.db2.gz YFXALINFHYNFTI-MJVIPROJSA-N 1 2 247.342 2.126 20 0 BEADLO CCC[C@H](C)CC(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857983548 588928685 /nfs/dbraw/zinc/92/86/85/588928685.db2.gz BMGBVXDMWGGXKF-WDEREUQCSA-N 1 2 235.331 2.270 20 0 BEADLO O=C(CCC1CCC1)N[C@H]1CCn2c[nH+]cc21 ZINC000857984139 588928825 /nfs/dbraw/zinc/92/88/25/588928825.db2.gz YFLHNNCWNFKSMR-NSHDSACASA-N 1 2 233.315 2.024 20 0 BEADLO CCC(C)(C)CC(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857983814 588928852 /nfs/dbraw/zinc/92/88/52/588928852.db2.gz VRNBJXFHFWMWFR-SNVBAGLBSA-N 1 2 235.331 2.270 20 0 BEADLO CCC[C@H](O)CCNc1cc[nH+]c2ccncc12 ZINC000896186744 583781230 /nfs/dbraw/zinc/78/12/30/583781230.db2.gz KWBAXDYOMPNDAC-NSHDSACASA-N 1 2 245.326 2.015 20 0 BEADLO Cc1cc(N[C@H]2CCS[C@H](C)C2)nc[nH+]1 ZINC000896245262 583784797 /nfs/dbraw/zinc/78/47/97/583784797.db2.gz LHHUMARNQHLJKO-ZJUUUORDSA-N 1 2 223.345 2.481 20 0 BEADLO CC(C(=O)N[C@H]1CCn2c[nH+]cc21)=C1CCCC1 ZINC000857987308 588929209 /nfs/dbraw/zinc/92/92/09/588929209.db2.gz TXQGPNZWXCBMPS-LBPRGKRZSA-N 1 2 245.326 2.335 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@H](C)C(F)F)n(C)n1 ZINC000883400931 583794824 /nfs/dbraw/zinc/79/48/24/583794824.db2.gz YJGYYNKLZSMCQY-HTQZYQBOSA-N 1 2 217.263 2.033 20 0 BEADLO Cc1nc(N[C@@H](c2cnn(C)c2)C(C)C)cc[nH+]1 ZINC000896429222 583802117 /nfs/dbraw/zinc/80/21/17/583802117.db2.gz ZZWJDAUHHYWREE-CYBMUJFWSA-N 1 2 245.330 2.328 20 0 BEADLO CCC1(C(=O)N2CCNc3[nH+]cc(C)cc32)CC1 ZINC000857998137 588930434 /nfs/dbraw/zinc/93/04/34/588930434.db2.gz YVLSQUJVIYXTRS-UHFFFAOYSA-N 1 2 245.326 2.339 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)N1CCNc2[nH+]cc(C)cc21 ZINC000858000448 588930477 /nfs/dbraw/zinc/93/04/77/588930477.db2.gz GLTWHPXXTKAZHB-GHMZBOCLSA-N 1 2 245.326 2.195 20 0 BEADLO Cc1ccoc1C[N@@H+]1CCn2cccc2C1 ZINC000896761337 583831190 /nfs/dbraw/zinc/83/11/90/583831190.db2.gz QZQYZPOXFLQRLB-UHFFFAOYSA-N 1 2 216.284 2.405 20 0 BEADLO Cc1ccoc1C[N@H+]1CCn2cccc2C1 ZINC000896761337 583831191 /nfs/dbraw/zinc/83/11/91/583831191.db2.gz QZQYZPOXFLQRLB-UHFFFAOYSA-N 1 2 216.284 2.405 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2CC[C@@H](C3CC3)O2)c1C ZINC000896801294 583834888 /nfs/dbraw/zinc/83/48/88/583834888.db2.gz MGOUCBRTVZTZOR-STQMWFEESA-N 1 2 247.342 2.463 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N2CC[C@H](C)[C@@H]2C)c[nH+]1 ZINC000896837467 583838867 /nfs/dbraw/zinc/83/88/67/583838867.db2.gz DTAAZFNIBIEVRI-JQWIXIFHSA-N 1 2 249.358 2.184 20 0 BEADLO CCC1(CNC(=O)C(C)(C)n2c[nH+]c(C)c2)CC1 ZINC000896865978 583842562 /nfs/dbraw/zinc/84/25/62/583842562.db2.gz GLGXALQFXVZIHL-UHFFFAOYSA-N 1 2 249.358 2.233 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H]2CCCC23CC3)[nH+]c1C ZINC000896905906 583851248 /nfs/dbraw/zinc/85/12/48/583851248.db2.gz NXMKOMJXEHVIMR-NSHDSACASA-N 1 2 247.342 2.223 20 0 BEADLO Cc1[nH]c(CNC(=O)C2=CC[C@@H](C)CC2)[nH+]c1C ZINC000896909125 583852298 /nfs/dbraw/zinc/85/22/98/583852298.db2.gz BCNNKIJTBQAUEV-SECBINFHSA-N 1 2 247.342 2.389 20 0 BEADLO Cc1[nH]c(CNC(=O)c2ccsc2C)[nH+]c1C ZINC000896909134 583852416 /nfs/dbraw/zinc/85/24/16/583852416.db2.gz BJBLIYJYVZLASG-UHFFFAOYSA-N 1 2 249.339 2.326 20 0 BEADLO Cc1[nH]c(CNC(=O)C(C)(C)C(C)C)[nH+]c1C ZINC000896911452 583853209 /nfs/dbraw/zinc/85/32/09/583853209.db2.gz UKGKKLWMDDHACO-UHFFFAOYSA-N 1 2 237.347 2.325 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H]2CCC(C)(C)C2)[nH+]c1C ZINC000896913413 583853867 /nfs/dbraw/zinc/85/38/67/583853867.db2.gz SUGYQTVLMYXCID-LLVKDONJSA-N 1 2 249.358 2.469 20 0 BEADLO CCCC(C)=CC(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000896916347 583854801 /nfs/dbraw/zinc/85/48/01/583854801.db2.gz CWHOAKZZCOGXNX-VQHVLOKHSA-N 1 2 235.331 2.389 20 0 BEADLO CCC/C(C)=C/C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000896916347 583854802 /nfs/dbraw/zinc/85/48/02/583854802.db2.gz CWHOAKZZCOGXNX-VQHVLOKHSA-N 1 2 235.331 2.389 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H](C)C(C)(C)C)[nH+]c1C ZINC000896918698 583856152 /nfs/dbraw/zinc/85/61/52/583856152.db2.gz FFCTXNUFYGNDMJ-MRVPVSSYSA-N 1 2 237.347 2.325 20 0 BEADLO CCC[C@@H](C)CC(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000896922211 583856768 /nfs/dbraw/zinc/85/67/68/583856768.db2.gz YHEXNXRRFPNRIK-SECBINFHSA-N 1 2 237.347 2.469 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1C[C@H]2CCC[C@H]21 ZINC000897177231 583889839 /nfs/dbraw/zinc/88/98/39/583889839.db2.gz LVUSDWRDDRPCKG-GMTAPVOTSA-N 1 2 233.315 2.394 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1C[C@@H]2CCC[C@H]12 ZINC000897177230 583890097 /nfs/dbraw/zinc/89/00/97/583890097.db2.gz LVUSDWRDDRPCKG-GARJFASQSA-N 1 2 233.315 2.394 20 0 BEADLO Nc1[nH+]cnc(N[C@@H]2C[C@@H]3CCC[C@@H]23)c1Cl ZINC000897179713 583891097 /nfs/dbraw/zinc/89/10/97/583891097.db2.gz JUZNCGIBWWBFSS-XLPZGREQSA-N 1 2 238.722 2.313 20 0 BEADLO Nc1nc[nH+]c(N[C@@H]2C[C@@H]3CCC[C@@H]23)c1Cl ZINC000897179713 583891098 /nfs/dbraw/zinc/89/10/98/583891098.db2.gz JUZNCGIBWWBFSS-XLPZGREQSA-N 1 2 238.722 2.313 20 0 BEADLO Cc1nc(N[C@@H](C)Cc2cccnc2)cc[nH+]1 ZINC000897194962 583893519 /nfs/dbraw/zinc/89/35/19/583893519.db2.gz NCIMSMQDFJQHKV-JTQLQIEISA-N 1 2 228.299 2.223 20 0 BEADLO CC(C)=CC(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000728543356 583896663 /nfs/dbraw/zinc/89/66/63/583896663.db2.gz WOVPXNZRQPKLLX-LBPRGKRZSA-N 1 2 233.315 2.013 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N2CC=C(C)CC2)c[nH+]1 ZINC000897217658 583897205 /nfs/dbraw/zinc/89/72/05/583897205.db2.gz TWQFCYQEOAJYRM-UHFFFAOYSA-N 1 2 247.342 2.105 20 0 BEADLO CC(C)Cc1cc(NC2CC(CCO)C2)nc[nH+]1 ZINC000897236802 583900004 /nfs/dbraw/zinc/90/00/04/583900004.db2.gz VJWVBAPQVJUHQW-UHFFFAOYSA-N 1 2 249.358 2.248 20 0 BEADLO Cc1cc(NC[C@]23C[C@H]2COC32CCC2)nc[nH+]1 ZINC000897259582 583904964 /nfs/dbraw/zinc/90/49/64/583904964.db2.gz SECPLXCAFHDPBH-WCQYABFASA-N 1 2 245.326 2.156 20 0 BEADLO c1ccc(NC[C@]23C[C@H]2COC32CCC2)[nH+]c1 ZINC000897268395 583906139 /nfs/dbraw/zinc/90/61/39/583906139.db2.gz YQXVERLMWQJMTG-WCQYABFASA-N 1 2 230.311 2.453 20 0 BEADLO CCn1c[nH+]c2c1CCN(Cc1ccc(C)o1)C2 ZINC000897336641 583924628 /nfs/dbraw/zinc/92/46/28/583924628.db2.gz JQJSFYYZDTVAEY-UHFFFAOYSA-N 1 2 245.326 2.363 20 0 BEADLO Cc1nc(N2CC(Cc3ccoc3)C2)cc[nH+]1 ZINC000897350699 583928912 /nfs/dbraw/zinc/92/89/12/583928912.db2.gz JLTHHAIUTWKLGC-UHFFFAOYSA-N 1 2 229.283 2.057 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2cccc(=O)[nH]2)o1 ZINC000897391380 583948361 /nfs/dbraw/zinc/94/83/61/583948361.db2.gz NMSUFCGCRFLTAK-UHFFFAOYSA-N 1 2 248.282 2.021 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2cccc(=O)[nH]2)o1 ZINC000897391380 583948364 /nfs/dbraw/zinc/94/83/64/583948364.db2.gz NMSUFCGCRFLTAK-UHFFFAOYSA-N 1 2 248.282 2.021 20 0 BEADLO c1cc(N[C@H]2COC[C@H]2C2CC2)nc(C2CC2)[nH+]1 ZINC000897448812 583987093 /nfs/dbraw/zinc/98/70/93/583987093.db2.gz YDKHNLHYYJNSCK-RYUDHWBXSA-N 1 2 245.326 2.191 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1cn(C2CC2)cn1 ZINC000865577015 584024080 /nfs/dbraw/zinc/02/40/80/584024080.db2.gz CSXXMMQXGXVDBV-UHFFFAOYSA-N 1 2 231.299 2.409 20 0 BEADLO Cn1ccc(C[NH2+][C@@H]2CCCc3scnc32)n1 ZINC000858384772 588950231 /nfs/dbraw/zinc/95/02/31/588950231.db2.gz VMBLSJCSLQAQTB-SNVBAGLBSA-N 1 2 248.355 2.044 20 0 BEADLO CC(C)c1c[nH+]cc(N[C@H](C)CCO)c1 ZINC000897706641 584041390 /nfs/dbraw/zinc/04/13/90/584041390.db2.gz QLYWAGQUZIWSHN-SNVBAGLBSA-N 1 2 208.305 2.388 20 0 BEADLO c1c[nH]c(CNc2ccc(C3CC3)c[nH+]2)n1 ZINC000897713131 584043023 /nfs/dbraw/zinc/04/30/23/584043023.db2.gz YADFTAVOCRMZIZ-UHFFFAOYSA-N 1 2 214.272 2.294 20 0 BEADLO CCCSC[C@H](C)[NH2+][C@H](CCC)C(=O)OC ZINC000897833515 584052908 /nfs/dbraw/zinc/05/29/08/584052908.db2.gz NIGULHWSUJRROI-WDEREUQCSA-N 1 2 247.404 2.449 20 0 BEADLO CCn1ccnc1C[NH+]1CC(Cc2ccoc2)C1 ZINC000898160611 584087596 /nfs/dbraw/zinc/08/75/96/584087596.db2.gz LTZOWTHXRSQLOK-UHFFFAOYSA-N 1 2 245.326 2.171 20 0 BEADLO O[C@H]1CC[N@H+](Cc2cc3ccccc3[nH]2)C[C@@H]1F ZINC000898186099 584093024 /nfs/dbraw/zinc/09/30/24/584093024.db2.gz AYQUUXBXUDFJBE-JSGCOSHPSA-N 1 2 248.301 2.073 20 0 BEADLO O[C@H]1CC[N@@H+](Cc2cc3ccccc3[nH]2)C[C@@H]1F ZINC000898186099 584093026 /nfs/dbraw/zinc/09/30/26/584093026.db2.gz AYQUUXBXUDFJBE-JSGCOSHPSA-N 1 2 248.301 2.073 20 0 BEADLO O[C@@H]1CC[N@H+](Cc2cc3ccccc3[nH]2)C[C@@H]1F ZINC000898186098 584093164 /nfs/dbraw/zinc/09/31/64/584093164.db2.gz AYQUUXBXUDFJBE-GXTWGEPZSA-N 1 2 248.301 2.073 20 0 BEADLO O[C@@H]1CC[N@@H+](Cc2cc3ccccc3[nH]2)C[C@@H]1F ZINC000898186098 584093165 /nfs/dbraw/zinc/09/31/65/584093165.db2.gz AYQUUXBXUDFJBE-GXTWGEPZSA-N 1 2 248.301 2.073 20 0 BEADLO O[C@H]1CC[N@H+](Cc2ccc3occc3c2)C[C@H]1F ZINC000898187553 584093739 /nfs/dbraw/zinc/09/37/39/584093739.db2.gz GVQBUEOSCKIMSQ-OLZOCXBDSA-N 1 2 249.285 2.338 20 0 BEADLO O[C@H]1CC[N@@H+](Cc2ccc3occc3c2)C[C@H]1F ZINC000898187553 584093741 /nfs/dbraw/zinc/09/37/41/584093741.db2.gz GVQBUEOSCKIMSQ-OLZOCXBDSA-N 1 2 249.285 2.338 20 0 BEADLO CCc1cc(N2C[C@@H](OC)CC[C@H]2C)nc(C)[nH+]1 ZINC000866073307 584111950 /nfs/dbraw/zinc/11/19/50/584111950.db2.gz YSPFNAPTFMULGT-MFKMUULPSA-N 1 2 249.358 2.351 20 0 BEADLO CCC(F)(F)CN[C@@H](C)c1[nH]cc[nH+]1 ZINC000858507071 588961378 /nfs/dbraw/zinc/96/13/78/588961378.db2.gz KYXXUVGWFVEFJY-ZETCQYMHSA-N 1 2 203.236 2.106 20 0 BEADLO COc1ccc([NH2+]CC[C@@H]2CCOC2)cc1N ZINC000841040415 584116523 /nfs/dbraw/zinc/11/65/23/584116523.db2.gz LWHKAHABCDLCBN-SNVBAGLBSA-N 1 2 236.315 2.116 20 0 BEADLO Cl/C=C/C[NH2+]Cc1nnc(C2CC2)s1 ZINC000898428890 584132952 /nfs/dbraw/zinc/13/29/52/584132952.db2.gz KCXCNKSBEXAYIA-DAFODLJHSA-N 1 2 229.736 2.258 20 0 BEADLO CCC/C(C)=C\C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000898904531 584165153 /nfs/dbraw/zinc/16/51/53/584165153.db2.gz HAYPDMVOTYXJTQ-XFXZXTDPSA-N 1 2 249.358 2.481 20 0 BEADLO CCCC1(C(=O)NCC(C)(C)n2cc[nH+]c2)CC1 ZINC000898904236 584165167 /nfs/dbraw/zinc/16/51/67/584165167.db2.gz FGZLKHFBQOSNDW-UHFFFAOYSA-N 1 2 249.358 2.315 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ccns1)c1ccn(C)n1 ZINC000858577926 588968161 /nfs/dbraw/zinc/96/81/61/588968161.db2.gz VWWVVVNDWIUCJD-IUCAKERBSA-N 1 2 236.344 2.288 20 0 BEADLO CCC[C@H](C)CCNC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000899203775 584181403 /nfs/dbraw/zinc/18/14/03/584181403.db2.gz SYTPAVTXMZDNNG-QJPTWQEYSA-N 1 2 249.358 2.456 20 0 BEADLO CCC[C@H](C)CCNC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000899203775 584181404 /nfs/dbraw/zinc/18/14/04/584181404.db2.gz SYTPAVTXMZDNNG-QJPTWQEYSA-N 1 2 249.358 2.456 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ccns1)c1ncc[nH]1 ZINC000858578037 588968106 /nfs/dbraw/zinc/96/81/06/588968106.db2.gz XAIPXHUJKMYHBB-YUMQZZPRSA-N 1 2 222.317 2.278 20 0 BEADLO Cc1[nH]c2ccc(NC(=O)CCF)cc2[nH+]1 ZINC000900049506 584268748 /nfs/dbraw/zinc/26/87/48/584268748.db2.gz OOFPESDWIINLFY-UHFFFAOYSA-N 1 2 221.235 2.169 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N(C)[C@@H](C)C2CC2)c[nH+]1 ZINC000900074201 584269365 /nfs/dbraw/zinc/26/93/65/584269365.db2.gz VAOVXYGYNMYAOA-NSHDSACASA-N 1 2 249.358 2.184 20 0 BEADLO CC[C@H](NC(=O)Cc1c[nH]c[nH+]1)c1ccccc1 ZINC000900124091 584275951 /nfs/dbraw/zinc/27/59/51/584275951.db2.gz NWPLRHIFJLLGDT-ZDUSSCGKSA-N 1 2 243.310 2.220 20 0 BEADLO CC[C@H](NC(=O)Cc1c[nH+]c[nH]1)c1ccccc1 ZINC000900124091 584275952 /nfs/dbraw/zinc/27/59/52/584275952.db2.gz NWPLRHIFJLLGDT-ZDUSSCGKSA-N 1 2 243.310 2.220 20 0 BEADLO CCCCC[C@H](C)NC(=O)Cc1c[nH]c[nH+]1 ZINC000900111512 584276440 /nfs/dbraw/zinc/27/64/40/584276440.db2.gz YADFUXXEKLGNCK-JTQLQIEISA-N 1 2 223.320 2.037 20 0 BEADLO CCCCC[C@H](C)NC(=O)Cc1c[nH+]c[nH]1 ZINC000900111512 584276442 /nfs/dbraw/zinc/27/64/42/584276442.db2.gz YADFUXXEKLGNCK-JTQLQIEISA-N 1 2 223.320 2.037 20 0 BEADLO CCN(C(=O)CNc1cccc[nH+]1)C1CCCC1 ZINC000900233459 584287939 /nfs/dbraw/zinc/28/79/39/584287939.db2.gz JSTIKLCBZQROHJ-UHFFFAOYSA-N 1 2 247.342 2.285 20 0 BEADLO CCC[C@@H](CC)NC(=O)CNc1cccc[nH+]1 ZINC000900419833 584306970 /nfs/dbraw/zinc/30/69/70/584306970.db2.gz ZOZMOIUBDHAGOO-LLVKDONJSA-N 1 2 235.331 2.188 20 0 BEADLO Cc1cc(Cn2cc(C3CCC3)nn2)cc[nH+]1 ZINC000900553176 584322568 /nfs/dbraw/zinc/32/25/68/584322568.db2.gz PEDHUYNLUDYWMB-UHFFFAOYSA-N 1 2 228.299 2.297 20 0 BEADLO CC(=C(F)C(=O)Nc1cc[nH+]cc1C)C1CC1 ZINC000900619350 584333128 /nfs/dbraw/zinc/33/31/28/584333128.db2.gz QQRLGOKOYNXZMN-XFXZXTDPSA-N 1 2 234.274 2.404 20 0 BEADLO CNc1[nH+]c(C)ccc1C(=O)N[C@H]1CC=CCC1 ZINC000900762375 584346527 /nfs/dbraw/zinc/34/65/27/584346527.db2.gz AMLOAPNRMZGZQT-NSHDSACASA-N 1 2 245.326 2.270 20 0 BEADLO CNc1[nH+]c(C)ccc1C(=O)N[C@@H]1CC=CCC1 ZINC000900762372 584346734 /nfs/dbraw/zinc/34/67/34/584346734.db2.gz AMLOAPNRMZGZQT-LLVKDONJSA-N 1 2 245.326 2.270 20 0 BEADLO C[C@@H]1CCCN(C(=O)CNc2cccc[nH+]2)[C@H]1C ZINC000900829082 584354712 /nfs/dbraw/zinc/35/47/12/584354712.db2.gz NDSRATNJXSWFJJ-NEPJUHHUSA-N 1 2 247.342 2.141 20 0 BEADLO CC[C@H](C)C[C@@H](C)NC(=O)CNc1cccc[nH+]1 ZINC000900861687 584358337 /nfs/dbraw/zinc/35/83/37/584358337.db2.gz DJMXDFUBSXWIKI-NWDGAFQWSA-N 1 2 249.358 2.434 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)NCCCCC1CCCC1 ZINC000900880909 584360907 /nfs/dbraw/zinc/36/09/07/584360907.db2.gz KMURXEYZRBMHPF-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)NCCCCC1CCCC1 ZINC000900880909 584360908 /nfs/dbraw/zinc/36/09/08/584360908.db2.gz KMURXEYZRBMHPF-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO CCC[C@@]1(C)CCCN(C(=O)Cc2c[nH+]c[nH]2)C1 ZINC000900897094 584362523 /nfs/dbraw/zinc/36/25/23/584362523.db2.gz KHHXOLWUSQRBHR-AWEZNQCLSA-N 1 2 249.358 2.381 20 0 BEADLO Cc1[nH]c(CNC(=O)/C=C/C(C)(C)C)[nH+]c1C ZINC000900997982 584375070 /nfs/dbraw/zinc/37/50/70/584375070.db2.gz QDMBYLYGLGBWNN-VOTSOKGWSA-N 1 2 235.331 2.245 20 0 BEADLO Cc1[nH]c(CNC(=O)C=CC(C)(C)C)[nH+]c1C ZINC000900997982 584375071 /nfs/dbraw/zinc/37/50/71/584375071.db2.gz QDMBYLYGLGBWNN-VOTSOKGWSA-N 1 2 235.331 2.245 20 0 BEADLO CCCC[C@H](NC(=O)Cc1c[nH]c[nH+]1)C1CCC1 ZINC000901021474 584377436 /nfs/dbraw/zinc/37/74/36/584377436.db2.gz JQIHAHGAKZPJGW-ZDUSSCGKSA-N 1 2 249.358 2.427 20 0 BEADLO CCCC[C@H](NC(=O)Cc1c[nH+]c[nH]1)C1CCC1 ZINC000901021474 584377437 /nfs/dbraw/zinc/37/74/37/584377437.db2.gz JQIHAHGAKZPJGW-ZDUSSCGKSA-N 1 2 249.358 2.427 20 0 BEADLO CC(C)(CNC(=O)Cc1c[nH]c[nH+]1)C1CCCC1 ZINC000901192971 584396957 /nfs/dbraw/zinc/39/69/57/584396957.db2.gz UNPXPXYJNUBLLO-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO CC(C)(CNC(=O)Cc1c[nH+]c[nH]1)C1CCCC1 ZINC000901192971 584396958 /nfs/dbraw/zinc/39/69/58/584396958.db2.gz UNPXPXYJNUBLLO-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1C(=O)CNc1cccc[nH+]1 ZINC000901299869 584419034 /nfs/dbraw/zinc/41/90/34/584419034.db2.gz CXLRCQXRFLDNOP-NEPJUHHUSA-N 1 2 247.342 2.283 20 0 BEADLO CC1(C)CC[C@H](NC(=O)CNc2cccc[nH+]2)C1 ZINC000901286037 584421892 /nfs/dbraw/zinc/42/18/92/584421892.db2.gz ICPOWANMRZLTHY-NSHDSACASA-N 1 2 247.342 2.188 20 0 BEADLO CNc1[nH+]c(C)ccc1C(=O)N1CC[C@H]1C(C)C ZINC000901329157 584423705 /nfs/dbraw/zinc/42/37/05/584423705.db2.gz BXKIDGBDTYWCBO-LBPRGKRZSA-N 1 2 247.342 2.302 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N2CC[C@H]2C(C)C)c[nH+]1 ZINC000901329777 584424411 /nfs/dbraw/zinc/42/44/11/584424411.db2.gz HARIMIZJBNJFGU-LBPRGKRZSA-N 1 2 249.358 2.184 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N2CC[C@@H]2C(C)C)c[nH+]1 ZINC000901329770 584424418 /nfs/dbraw/zinc/42/44/18/584424418.db2.gz HARIMIZJBNJFGU-GFCCVEGCSA-N 1 2 249.358 2.184 20 0 BEADLO CC(C)c1c[nH]c(C=Cc2nccc(=O)[nH]2)[nH+]1 ZINC000901477626 584449044 /nfs/dbraw/zinc/44/90/44/584449044.db2.gz QIJZVGVAPUQBRU-ARJAWSKDSA-N 1 2 230.271 2.199 20 0 BEADLO CC(C)c1c[nH]c(C=Cc2cnccn2)[nH+]1 ZINC000901462482 584451160 /nfs/dbraw/zinc/45/11/60/584451160.db2.gz VTDVJNNRIUWNBD-ONEGZZNKSA-N 1 2 214.272 2.494 20 0 BEADLO Cc1[nH]c(C=Cc2nc(C)cc(=O)[nH]2)[nH+]c1C ZINC000901503621 584454944 /nfs/dbraw/zinc/45/49/44/584454944.db2.gz FMDXGZLPANZAPM-PLNGDYQASA-N 1 2 230.271 2.001 20 0 BEADLO Cc1cn(C)nc1Cn1c[nH+]c(C(C)(C)C)c1 ZINC000901586677 584465345 /nfs/dbraw/zinc/46/53/45/584465345.db2.gz IBMSEGQDMBGRPN-UHFFFAOYSA-N 1 2 232.331 2.271 20 0 BEADLO Cc1ccc2[nH+]c(CSC3COC3)cn2c1 ZINC000901642050 584473705 /nfs/dbraw/zinc/47/37/05/584473705.db2.gz LOXCXERHXJQOPR-UHFFFAOYSA-N 1 2 234.324 2.275 20 0 BEADLO Cc1cc(CSCc2ccc[nH+]c2N)no1 ZINC000901712892 584487106 /nfs/dbraw/zinc/48/71/06/584487106.db2.gz UHUMWOIKWDRUII-UHFFFAOYSA-N 1 2 235.312 2.394 20 0 BEADLO Cc1cc(CSCc2cn(C)c[nH+]2)no1 ZINC000901711791 584487290 /nfs/dbraw/zinc/48/72/90/584487290.db2.gz MRZNNSUBYMCWJK-UHFFFAOYSA-N 1 2 223.301 2.150 20 0 BEADLO CCn1cnc(C[NH2+]Cc2ccccc2OC)c1 ZINC000902026032 584513242 /nfs/dbraw/zinc/51/32/42/584513242.db2.gz MKLWGTZNNKGIOB-UHFFFAOYSA-N 1 2 245.326 2.201 20 0 BEADLO Cc1[nH]c(CNc2nnc(CC(C)C)o2)[nH+]c1C ZINC000902042971 584515391 /nfs/dbraw/zinc/51/53/91/584515391.db2.gz VMTXWIJADAADMN-UHFFFAOYSA-N 1 2 249.318 2.220 20 0 BEADLO CCNc1ccccc1C[NH2+]Cc1cn[nH]c1C ZINC000902063940 584522702 /nfs/dbraw/zinc/52/27/02/584522702.db2.gz NIOZXZSYXVMRGJ-UHFFFAOYSA-N 1 2 244.342 2.440 20 0 BEADLO Cc1[nH]c(CNc2ncccc2F)[nH+]c1C ZINC000902066245 584523020 /nfs/dbraw/zinc/52/30/20/584523020.db2.gz PBCVXSCBBKSPLW-UHFFFAOYSA-N 1 2 220.251 2.173 20 0 BEADLO CCn1cnc(C[NH2+]Cc2ccoc2C)c1 ZINC000902090524 584524478 /nfs/dbraw/zinc/52/44/78/584524478.db2.gz UHVWDNXGFXBCLR-UHFFFAOYSA-N 1 2 219.288 2.094 20 0 BEADLO Cc1cc(CNc2cc[nH+]c(C)n2)cnc1F ZINC000902127488 584529321 /nfs/dbraw/zinc/52/93/21/584529321.db2.gz SVVPQMWAZSETKB-UHFFFAOYSA-N 1 2 232.262 2.240 20 0 BEADLO Cc1[nH]c(CNc2cncc(Cl)n2)[nH+]c1C ZINC000902145228 584530678 /nfs/dbraw/zinc/53/06/78/584530678.db2.gz BCRMHWIDVFNYLT-UHFFFAOYSA-N 1 2 237.694 2.082 20 0 BEADLO Cc1[nH]c(CNc2nnc(C3CCC3)o2)[nH+]c1C ZINC000902156802 584532166 /nfs/dbraw/zinc/53/21/66/584532166.db2.gz LOZZPIYSJVDOSE-UHFFFAOYSA-N 1 2 247.302 2.289 20 0 BEADLO CCn1c[nH+]cc1CNc1nccnc1C1CC1 ZINC000902166453 584533359 /nfs/dbraw/zinc/53/33/59/584533359.db2.gz MKYLHGCRGHZARM-UHFFFAOYSA-N 1 2 243.314 2.183 20 0 BEADLO Cc1cc(NCc2cnn(C3CCC3)c2)nc[nH+]1 ZINC000902196880 584536679 /nfs/dbraw/zinc/53/66/79/584536679.db2.gz XMRZUGBTDYOARU-UHFFFAOYSA-N 1 2 243.314 2.319 20 0 BEADLO CCOc1cncc(CNc2cc(C)[nH+]cn2)c1 ZINC000902196622 584536952 /nfs/dbraw/zinc/53/69/52/584536952.db2.gz WCWRLSKQKZDTMN-UHFFFAOYSA-N 1 2 244.298 2.191 20 0 BEADLO CCNc1ccccc1C[NH2+]Cc1cocn1 ZINC000902216373 584538855 /nfs/dbraw/zinc/53/88/55/584538855.db2.gz CBXYNULSACCDNX-UHFFFAOYSA-N 1 2 231.299 2.396 20 0 BEADLO CCn1c[nH+]cc1CNc1cnc(C(C)C)nc1 ZINC000902248856 584546722 /nfs/dbraw/zinc/54/67/22/584546722.db2.gz KJNNXQUNWIXSAU-UHFFFAOYSA-N 1 2 245.330 2.429 20 0 BEADLO CCn1c[nH+]cc1CNc1cnc(F)c(F)c1 ZINC000902285262 584547548 /nfs/dbraw/zinc/54/75/48/584547548.db2.gz JEPKKLVCIKQZQA-UHFFFAOYSA-N 1 2 238.241 2.188 20 0 BEADLO Cc1ncccc1OCc1ccc(N(C)C)[nH+]c1 ZINC000902295332 584552810 /nfs/dbraw/zinc/55/28/10/584552810.db2.gz CIBLMDFTWXGHID-UHFFFAOYSA-N 1 2 243.310 2.430 20 0 BEADLO CCCOC(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000859058213 588995036 /nfs/dbraw/zinc/99/50/36/588995036.db2.gz QLPMWLPZAHWHIO-JTQLQIEISA-N 1 2 237.303 2.136 20 0 BEADLO CCCOC(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000859055334 588995084 /nfs/dbraw/zinc/99/50/84/588995084.db2.gz DYFZSORTACJZFH-UHFFFAOYSA-N 1 2 237.303 2.136 20 0 BEADLO c1c[nH+]c(COCC[C@@H]2C[C@H]2C2CC2)[nH]1 ZINC000902397531 584585650 /nfs/dbraw/zinc/58/56/50/584585650.db2.gz PWJCQFGHBBGJQV-MNOVXSKESA-N 1 2 206.289 2.363 20 0 BEADLO CCn1c[nH+]c(CNc2c(C)nn(CC)c2C)c1 ZINC000902402243 584587407 /nfs/dbraw/zinc/58/74/07/584587407.db2.gz JLPOGXAVMBAYEV-UHFFFAOYSA-N 1 2 247.346 2.348 20 0 BEADLO CCn1c[nH+]c(CNc2cccc3c2OCO3)c1 ZINC000902473118 584601601 /nfs/dbraw/zinc/60/16/01/584601601.db2.gz RJBKWSWRNOZVQG-UHFFFAOYSA-N 1 2 245.282 2.244 20 0 BEADLO CCn1c[nH+]c(CNc2cccc3c2CCO3)c1 ZINC000902533510 584634105 /nfs/dbraw/zinc/63/41/05/584634105.db2.gz YMIQADSXIROQEQ-UHFFFAOYSA-N 1 2 243.310 2.450 20 0 BEADLO CCn1c[nH+]c(CNc2cn(C)nc2C2CC2)c1 ZINC000902571399 584636251 /nfs/dbraw/zinc/63/62/51/584636251.db2.gz IAIDHKUHTYCCSV-UHFFFAOYSA-N 1 2 245.330 2.126 20 0 BEADLO CCn1c[nH+]c(CNc2cccc(CCO)c2)c1 ZINC000902587111 584639851 /nfs/dbraw/zinc/63/98/51/584639851.db2.gz ZBNHXLNRSHJYFC-UHFFFAOYSA-N 1 2 245.326 2.050 20 0 BEADLO CNc1ccccc1C[NH2+][C@H](C)c1csnn1 ZINC000902609379 584643082 /nfs/dbraw/zinc/64/30/82/584643082.db2.gz QLICPDCKKGEVPS-SECBINFHSA-N 1 2 248.355 2.431 20 0 BEADLO CCCOC(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000859100784 589002116 /nfs/dbraw/zinc/00/21/16/589002116.db2.gz IVIJCNLGNDMUGR-SECBINFHSA-N 1 2 223.276 2.093 20 0 BEADLO COC/C(C)=C\CO[NH+]=C(N)c1ccccc1C ZINC000902685160 584655977 /nfs/dbraw/zinc/65/59/77/584655977.db2.gz FGRRYWMXWFQNDR-FLIBITNWSA-N 1 2 248.326 2.434 20 0 BEADLO CCn1cnc(C[NH2+][C@H](C)c2cncs2)c1 ZINC000902689656 584656330 /nfs/dbraw/zinc/65/63/30/584656330.db2.gz MTHYLWQYHTUYBK-SECBINFHSA-N 1 2 236.344 2.210 20 0 BEADLO CO[C@H](C)C(N)=[NH+]O[C@H](C)c1ccccc1 ZINC000902717195 584657947 /nfs/dbraw/zinc/65/79/47/584657947.db2.gz MMZMCRCJZYEURE-NXEZZACHSA-N 1 2 222.288 2.281 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)Cc1ccnc(F)c1 ZINC000859072476 588997236 /nfs/dbraw/zinc/99/72/36/588997236.db2.gz FRAWWJQSANMPDX-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)Cc1ccnc(F)c1 ZINC000859072476 588997237 /nfs/dbraw/zinc/99/72/37/588997237.db2.gz FRAWWJQSANMPDX-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CC[C@@H]2[C@H]3OCC[C@H]3[C@@H]21)C(F)(F)F ZINC000902995212 584708988 /nfs/dbraw/zinc/70/89/88/584708988.db2.gz WWJYBPVRWQCRCZ-FSKPYACHSA-N 1 2 249.276 2.340 20 0 BEADLO CC[C@H](C)[C@@H](C(=O)OC)[N@@H+]1CCC[C@H](F)C1 ZINC000902990387 584709310 /nfs/dbraw/zinc/70/93/10/584709310.db2.gz BAGLTHQMFHDFPI-DCAQKATOSA-N 1 2 231.311 2.008 20 0 BEADLO CC[C@H](C)[C@@H](C(=O)OC)[N@H+]1CCC[C@H](F)C1 ZINC000902990387 584709312 /nfs/dbraw/zinc/70/93/12/584709312.db2.gz BAGLTHQMFHDFPI-DCAQKATOSA-N 1 2 231.311 2.008 20 0 BEADLO CC[C@H](C)[C@H](C(=O)OC)[N@@H+]1CCC[C@H](F)C1 ZINC000902990388 584709408 /nfs/dbraw/zinc/70/94/08/584709408.db2.gz BAGLTHQMFHDFPI-GARJFASQSA-N 1 2 231.311 2.008 20 0 BEADLO CC[C@H](C)[C@H](C(=O)OC)[N@H+]1CCC[C@H](F)C1 ZINC000902990388 584709409 /nfs/dbraw/zinc/70/94/09/584709409.db2.gz BAGLTHQMFHDFPI-GARJFASQSA-N 1 2 231.311 2.008 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@H](F)C2)c(C)nn1 ZINC000902991720 584710463 /nfs/dbraw/zinc/71/04/63/584710463.db2.gz ZPWIXBSEFIXLSF-GFCCVEGCSA-N 1 2 223.295 2.027 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@H](F)C2)c(C)nn1 ZINC000902991720 584710464 /nfs/dbraw/zinc/71/04/64/584710464.db2.gz ZPWIXBSEFIXLSF-GFCCVEGCSA-N 1 2 223.295 2.027 20 0 BEADLO CC(C)N(C(=O)C[N@@H+]1CCC[C@@H](F)C1)C(C)C ZINC000903002917 584716059 /nfs/dbraw/zinc/71/60/59/584716059.db2.gz ICBHQSSANONJHS-GFCCVEGCSA-N 1 2 244.354 2.066 20 0 BEADLO CC(C)N(C(=O)C[N@H+]1CCC[C@@H](F)C1)C(C)C ZINC000903002917 584716061 /nfs/dbraw/zinc/71/60/61/584716061.db2.gz ICBHQSSANONJHS-GFCCVEGCSA-N 1 2 244.354 2.066 20 0 BEADLO CC(C)[C@@H]([NH2+][C@@H](C)c1ccco1)c1nncn1C ZINC000903061234 584722684 /nfs/dbraw/zinc/72/26/84/584722684.db2.gz LQCFGAVSMVAPRO-CMPLNLGQSA-N 1 2 248.330 2.456 20 0 BEADLO Cc1cc(N[C@H](C)c2cn(C)nn2)c[nH+]c1C ZINC000903087337 584725311 /nfs/dbraw/zinc/72/53/11/584725311.db2.gz FRHGQQUMDKXOFD-SNVBAGLBSA-N 1 2 231.303 2.000 20 0 BEADLO CCc1noc(C)c1[C@@H](C)[NH2+]Cc1cn(C)cn1 ZINC000903351227 584755437 /nfs/dbraw/zinc/75/54/37/584755437.db2.gz IBSOFVZUJGUHSL-SECBINFHSA-N 1 2 248.330 2.130 20 0 BEADLO CC(C)n1cc([C@@H](C)[NH2+]C/C=C\Cl)nn1 ZINC000903446569 584770260 /nfs/dbraw/zinc/77/02/60/584770260.db2.gz YLVVESSIVVHFGK-XRVBUDJMSA-N 1 2 228.727 2.262 20 0 BEADLO FC1(F)CCC[C@@H]1CCN1CC=CC[NH2+]1 ZINC000903491050 584780749 /nfs/dbraw/zinc/78/07/49/584780749.db2.gz SPKJYTBPSKBJGG-SNVBAGLBSA-N 1 2 216.275 2.188 20 0 BEADLO FC1(F)CCC[C@H]1CCN1CC=CC[NH2+]1 ZINC000903491049 584780896 /nfs/dbraw/zinc/78/08/96/584780896.db2.gz SPKJYTBPSKBJGG-JTQLQIEISA-N 1 2 216.275 2.188 20 0 BEADLO C/C=C(/C)c1nc(-c2ccc(N)[nH+]c2C)no1 ZINC000904261625 584859268 /nfs/dbraw/zinc/85/92/68/584859268.db2.gz IBHLNBMTACFVGG-DAXSKMNVSA-N 1 2 230.271 2.445 20 0 BEADLO CC(C)(F)CNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000827806451 584900895 /nfs/dbraw/zinc/90/08/95/584900895.db2.gz PYRXGNRCMHJZBH-UHFFFAOYSA-N 1 2 235.262 2.041 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)C=C1CCCCC1 ZINC000732092299 584933894 /nfs/dbraw/zinc/93/38/94/584933894.db2.gz BCDRCBDQVKNRLM-UHFFFAOYSA-N 1 2 233.315 2.259 20 0 BEADLO CC(C)c1cnc(C[N@H+](C)C[C@H]2CCCO2)o1 ZINC000733309257 584946714 /nfs/dbraw/zinc/94/67/14/584946714.db2.gz HMWJPVVATUIBFF-LLVKDONJSA-N 1 2 238.331 2.409 20 0 BEADLO CC(C)c1cnc(C[N@@H+](C)C[C@H]2CCCO2)o1 ZINC000733309257 584946715 /nfs/dbraw/zinc/94/67/15/584946715.db2.gz HMWJPVVATUIBFF-LLVKDONJSA-N 1 2 238.331 2.409 20 0 BEADLO Cc1nonc1C[N@H+](C)Cc1ccsc1 ZINC000734146423 584957449 /nfs/dbraw/zinc/95/74/49/584957449.db2.gz AFUAEUJREHAFQR-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO Cc1nonc1C[N@@H+](C)Cc1ccsc1 ZINC000734146423 584957450 /nfs/dbraw/zinc/95/74/50/584957450.db2.gz AFUAEUJREHAFQR-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO CCCC[C@@](C)(CO)Nc1cc[nH+]c(CC)n1 ZINC000884542786 584958980 /nfs/dbraw/zinc/95/89/80/584958980.db2.gz MNTPQSIZTDZEMP-ZDUSSCGKSA-N 1 2 237.347 2.392 20 0 BEADLO C[C@@H](CNC(=O)CCn1cc[nH+]c1)C(C)(C)C ZINC000734340966 584960845 /nfs/dbraw/zinc/96/08/45/584960845.db2.gz REOPQPQOTPXXQH-NSHDSACASA-N 1 2 237.347 2.072 20 0 BEADLO CC1=C(C)C[C@@H](C(=O)NCc2cn(C)c[nH+]2)CC1 ZINC000890105132 585023434 /nfs/dbraw/zinc/02/34/34/585023434.db2.gz XBKDOTOQYGHEGP-LBPRGKRZSA-N 1 2 247.342 2.173 20 0 BEADLO C[C@H]1CC=C(C(=O)OCc2cc[nH+]c(N)c2)CC1 ZINC000838348671 585054190 /nfs/dbraw/zinc/05/41/90/585054190.db2.gz IAZYQWUIJYDYGC-JTQLQIEISA-N 1 2 246.310 2.453 20 0 BEADLO CN(C)c1[nH+]cccc1COC(=O)C1=CCCC1 ZINC000838957922 585080867 /nfs/dbraw/zinc/08/08/67/585080867.db2.gz RGKKJSCCBPVPTR-UHFFFAOYSA-N 1 2 246.310 2.301 20 0 BEADLO CN(C)c1[nH+]cccc1COC(=O)C1(C)CCC1 ZINC000838953864 585080901 /nfs/dbraw/zinc/08/09/01/585080901.db2.gz PDKTZPISGNRVPI-UHFFFAOYSA-N 1 2 248.326 2.381 20 0 BEADLO CCn1ncc(C[NH2+][C@@H](C)c2ccsc2)n1 ZINC000839075973 585089911 /nfs/dbraw/zinc/08/99/11/585089911.db2.gz OJGWJDMXTVFZMP-VIFPVBQESA-N 1 2 236.344 2.210 20 0 BEADLO CCn1nc(C)c(C[NH+]2CC3(C2)CCCCC3)n1 ZINC000839131849 585094238 /nfs/dbraw/zinc/09/42/38/585094238.db2.gz FAILTTQBDOCMQD-UHFFFAOYSA-N 1 2 248.374 2.373 20 0 BEADLO CC(C)(C)CCCC(=O)NC1=[NH+]CCS1 ZINC000103356477 585096835 /nfs/dbraw/zinc/09/68/35/585096835.db2.gz UYGGYCCJYYPGGN-UHFFFAOYSA-N 1 2 228.361 2.422 20 0 BEADLO C[C@H]([NH2+]C/C(Cl)=C\Cl)c1ccn(C)n1 ZINC000839195753 585098513 /nfs/dbraw/zinc/09/85/13/585098513.db2.gz GSSJAFADFYRIBG-QAZRXNLGSA-N 1 2 234.130 2.390 20 0 BEADLO C[C@@H](CNC(=O)C[C@H](C)C1CC1)Cn1cc[nH+]c1 ZINC000740727505 585106064 /nfs/dbraw/zinc/10/60/64/585106064.db2.gz RGQHPLBMHSOZLD-RYUDHWBXSA-N 1 2 249.358 2.072 20 0 BEADLO CCCOC(=O)[C@H](C)[N@@H+]1CCS[C@@H](C)[C@H]1C ZINC000741796482 585119516 /nfs/dbraw/zinc/11/95/16/585119516.db2.gz GARYZDVFRSQOKG-VWYCJHECSA-N 1 2 245.388 2.154 20 0 BEADLO CCCOC(=O)[C@H](C)[N@H+]1CCS[C@@H](C)[C@H]1C ZINC000741796482 585119517 /nfs/dbraw/zinc/11/95/17/585119517.db2.gz GARYZDVFRSQOKG-VWYCJHECSA-N 1 2 245.388 2.154 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)C[C@@H]1CC1(Cl)Cl ZINC000741806518 585119620 /nfs/dbraw/zinc/11/96/20/585119620.db2.gz SUQXOVQTTZRZGB-ZETCQYMHSA-N 1 2 234.130 2.035 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)C[C@@H]1CC1(Cl)Cl ZINC000741806518 585119621 /nfs/dbraw/zinc/11/96/21/585119621.db2.gz SUQXOVQTTZRZGB-ZETCQYMHSA-N 1 2 234.130 2.035 20 0 BEADLO CC(C)=CC(=O)Nc1cccc2[nH+]ccn21 ZINC000741969825 585121333 /nfs/dbraw/zinc/12/13/33/585121333.db2.gz MJHMAVWDBPBWGI-UHFFFAOYSA-N 1 2 215.256 2.239 20 0 BEADLO CC(=CC(=O)NCc1c[nH+]c[nH]1)c1ccccc1 ZINC000742178993 585122564 /nfs/dbraw/zinc/12/25/64/585122564.db2.gz PSVNSIGUOSTRLS-YRNVUSSQSA-N 1 2 241.294 2.129 20 0 BEADLO CC(=CC(=O)NCc1c[nH]c[nH+]1)c1ccccc1 ZINC000742178993 585122565 /nfs/dbraw/zinc/12/25/65/585122565.db2.gz PSVNSIGUOSTRLS-YRNVUSSQSA-N 1 2 241.294 2.129 20 0 BEADLO Cc1nn(C[N@@H+](C)C2CCC2)c(=S)s1 ZINC000742173324 585122731 /nfs/dbraw/zinc/12/27/31/585122731.db2.gz PBAUEFCPWYLSJV-UHFFFAOYSA-N 1 2 229.374 2.424 20 0 BEADLO Cc1nn(C[N@H+](C)C2CCC2)c(=S)s1 ZINC000742173324 585122732 /nfs/dbraw/zinc/12/27/32/585122732.db2.gz PBAUEFCPWYLSJV-UHFFFAOYSA-N 1 2 229.374 2.424 20 0 BEADLO Cc1cccc(F)c1C[NH2+]Cc1nccn1C ZINC000742380395 585125357 /nfs/dbraw/zinc/12/53/57/585125357.db2.gz CZZHBRBOCPCFJF-UHFFFAOYSA-N 1 2 233.290 2.157 20 0 BEADLO Cc1nc(NC[C@@H](O)c2cccc(F)c2)cc[nH+]1 ZINC000742397169 585125754 /nfs/dbraw/zinc/12/57/54/585125754.db2.gz MRZOWGSIGWUJQA-GFCCVEGCSA-N 1 2 247.273 2.070 20 0 BEADLO Cc1nc(NC[C@H](O)c2cccc(F)c2)cc[nH+]1 ZINC000742397170 585125816 /nfs/dbraw/zinc/12/58/16/585125816.db2.gz MRZOWGSIGWUJQA-LBPRGKRZSA-N 1 2 247.273 2.070 20 0 BEADLO O=C(/C=C\C1CC1)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000742633746 585129132 /nfs/dbraw/zinc/12/91/32/585129132.db2.gz HFEKGYFYXONLSA-CFHLNLSMSA-N 1 2 245.326 2.013 20 0 BEADLO Cc1ccc([C@@H](C)C(=O)Nc2cc[nH+]cc2C)o1 ZINC000742647308 585129372 /nfs/dbraw/zinc/12/93/72/585129372.db2.gz KNXPBOPLENPJFL-LLVKDONJSA-N 1 2 244.294 2.456 20 0 BEADLO CNc1[nH+]c(C)ccc1C(=O)OCC1CCC1 ZINC000744739928 585152665 /nfs/dbraw/zinc/15/26/65/585152665.db2.gz PLDJZBAOJLALFD-UHFFFAOYSA-N 1 2 234.299 2.389 20 0 BEADLO C[C@H]1C[N@H+](CCF)C[C@@H](c2ccccc2)O1 ZINC000746503908 585169412 /nfs/dbraw/zinc/16/94/12/585169412.db2.gz PMMSYVULLVRROE-AAEUAGOBSA-N 1 2 223.291 2.418 20 0 BEADLO C[C@H]1C[N@@H+](CCF)C[C@@H](c2ccccc2)O1 ZINC000746503908 585169413 /nfs/dbraw/zinc/16/94/13/585169413.db2.gz PMMSYVULLVRROE-AAEUAGOBSA-N 1 2 223.291 2.418 20 0 BEADLO CC[N@@H+](Cc1ccccc1)Cn1ccsc1=O ZINC000746605203 585170805 /nfs/dbraw/zinc/17/08/05/585170805.db2.gz PZWPIWBJDVKAGH-UHFFFAOYSA-N 1 2 248.351 2.389 20 0 BEADLO CC[N@H+](Cc1ccccc1)Cn1ccsc1=O ZINC000746605203 585170806 /nfs/dbraw/zinc/17/08/06/585170806.db2.gz PZWPIWBJDVKAGH-UHFFFAOYSA-N 1 2 248.351 2.389 20 0 BEADLO C[C@H]1CN(C(=O)CCCn2cc[nH+]c2)C(C)(C)C1 ZINC000746656709 585172023 /nfs/dbraw/zinc/17/20/23/585172023.db2.gz JROXDOZZVQXAOL-GFCCVEGCSA-N 1 2 249.358 2.310 20 0 BEADLO Fc1cc(C[NH+]2CC3(C2)CC(F)(F)C3)ccn1 ZINC000859216777 589019844 /nfs/dbraw/zinc/01/98/44/589019844.db2.gz DXLMYCYJCZVWBN-UHFFFAOYSA-N 1 2 242.244 2.452 20 0 BEADLO Cc1cccc(C(=O)OCc2c[nH+]cn2C)c1C ZINC000747780756 585184213 /nfs/dbraw/zinc/18/42/13/585184213.db2.gz IQJJBQUOWWMLRX-UHFFFAOYSA-N 1 2 244.294 2.394 20 0 BEADLO CCc1ccc(C(=O)OCc2c[nH+]cn2C)cc1 ZINC000747784358 585184401 /nfs/dbraw/zinc/18/44/01/585184401.db2.gz ZOCOITMYWWSSTA-UHFFFAOYSA-N 1 2 244.294 2.340 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C[C@H](C)C1CC1 ZINC000748207105 585189110 /nfs/dbraw/zinc/18/91/10/585189110.db2.gz DJSLYYPEQLFKRG-VIFPVBQESA-N 1 2 234.299 2.465 20 0 BEADLO O=C(CCCn1cc[nH+]c1)Oc1cccc(F)c1 ZINC000748598016 585194225 /nfs/dbraw/zinc/19/42/25/585194225.db2.gz NICZYIZPOFDBMW-UHFFFAOYSA-N 1 2 248.257 2.408 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2cccc(O)c2)cn1 ZINC000748816598 585196514 /nfs/dbraw/zinc/19/65/14/585196514.db2.gz IFXWGWDMHNCKEJ-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2cccc(O)c2)cn1 ZINC000748816598 585196515 /nfs/dbraw/zinc/19/65/15/585196515.db2.gz IFXWGWDMHNCKEJ-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO C[N@@H+](Cc1cnccn1)C[C@@H]1CC1(Cl)Cl ZINC000750185482 585211984 /nfs/dbraw/zinc/21/19/84/585211984.db2.gz PVWKYOPZTMWPJP-QMMMGPOBSA-N 1 2 246.141 2.102 20 0 BEADLO C[N@H+](Cc1cnccn1)C[C@@H]1CC1(Cl)Cl ZINC000750185482 585211985 /nfs/dbraw/zinc/21/19/85/585211985.db2.gz PVWKYOPZTMWPJP-QMMMGPOBSA-N 1 2 246.141 2.102 20 0 BEADLO C/C=C(/C)C(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000751360581 585227266 /nfs/dbraw/zinc/22/72/66/585227266.db2.gz MGYLYXRXIVIBPR-DSDFTUOUSA-N 1 2 249.358 2.380 20 0 BEADLO C/C=C(\C)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000751378233 585228444 /nfs/dbraw/zinc/22/84/44/585228444.db2.gz FPAUEQGHLFZALY-YCRREMRBSA-N 1 2 215.256 2.239 20 0 BEADLO CC(C)=C(C)C(=O)Nc1cc[nH+]c(C)c1 ZINC000751377938 585228477 /nfs/dbraw/zinc/22/84/77/585228477.db2.gz BQNIMLRKHAUFIB-UHFFFAOYSA-N 1 2 204.273 2.107 20 0 BEADLO Cc1nonc1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC000751479374 585231515 /nfs/dbraw/zinc/23/15/15/585231515.db2.gz OJMMBBVGFREZKJ-CYBMUJFWSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1nonc1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000751479374 585231516 /nfs/dbraw/zinc/23/15/16/585231516.db2.gz OJMMBBVGFREZKJ-CYBMUJFWSA-N 1 2 244.298 2.110 20 0 BEADLO CS/C=C\C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000751572229 585233199 /nfs/dbraw/zinc/23/31/99/585233199.db2.gz QOLCUSHAWNTOSP-WAYWQWQTSA-N 1 2 247.323 2.458 20 0 BEADLO CC1(C)C[C@H]1C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000751882166 585238255 /nfs/dbraw/zinc/23/82/55/585238255.db2.gz BZUQNUFDQSWBIS-RYUDHWBXSA-N 1 2 247.342 2.093 20 0 BEADLO CCn1cnn(C[N@@H+]2CC[C@H](C)[C@H]2C)c1=S ZINC000751940301 585239495 /nfs/dbraw/zinc/23/94/95/585239495.db2.gz HIQRNMGLIMEPOL-VHSXEESVSA-N 1 2 240.376 2.122 20 0 BEADLO CCn1cnn(C[N@H+]2CC[C@H](C)[C@H]2C)c1=S ZINC000751940301 585239496 /nfs/dbraw/zinc/23/94/96/585239496.db2.gz HIQRNMGLIMEPOL-VHSXEESVSA-N 1 2 240.376 2.122 20 0 BEADLO COC[C@@H]1CCCN1c1cc[nH+]c(C(C)C)n1 ZINC000751965353 585239850 /nfs/dbraw/zinc/23/98/50/585239850.db2.gz HLNJQPWBWYWBHV-NSHDSACASA-N 1 2 235.331 2.215 20 0 BEADLO O=C(OCCn1cc[nH+]c1)C12CCC(CC1)C2 ZINC000752124279 585242680 /nfs/dbraw/zinc/24/26/80/585242680.db2.gz UFTLUCZRBNGJMO-UHFFFAOYSA-N 1 2 234.299 2.007 20 0 BEADLO CC(C)C[C@H](C)NC(=O)c1cccc2[nH+]ccn21 ZINC000752226929 585243703 /nfs/dbraw/zinc/24/37/03/585243703.db2.gz QNVNHYVNYRHPJH-NSHDSACASA-N 1 2 245.326 2.499 20 0 BEADLO Cc1ccc(NC(=O)c2ccnnc2C)c(C)[nH+]1 ZINC000753115473 585253942 /nfs/dbraw/zinc/25/39/42/585253942.db2.gz UFUSAFPTEFGFBU-UHFFFAOYSA-N 1 2 242.282 2.049 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1ccc(C)cn1 ZINC000753147664 585254393 /nfs/dbraw/zinc/25/43/93/585254393.db2.gz BIWAJFUOPNRTEE-UHFFFAOYSA-N 1 2 241.294 2.022 20 0 BEADLO FCC[N@@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000753273650 585256285 /nfs/dbraw/zinc/25/62/85/585256285.db2.gz HSUMXGIXRZLFDD-CQSZACIVSA-N 1 2 235.302 2.130 20 0 BEADLO FCC[N@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000753273650 585256286 /nfs/dbraw/zinc/25/62/86/585256286.db2.gz HSUMXGIXRZLFDD-CQSZACIVSA-N 1 2 235.302 2.130 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)/C=C1/CC[C@@H](C)C1 ZINC000753585345 585262813 /nfs/dbraw/zinc/26/28/13/585262813.db2.gz VECDPQKXXLATSI-IMQMQEMRSA-N 1 2 247.342 2.134 20 0 BEADLO C[C@H]1CC/C(=C/C(=O)N2CC(n3cc[nH+]c3)C2)C1 ZINC000753616147 585264193 /nfs/dbraw/zinc/26/41/93/585264193.db2.gz FOVQRTMPXLKBQU-ZWIPKHHJSA-N 1 2 245.326 2.013 20 0 BEADLO C[C@@H]1CC/C(=C\C(=O)OCc2c[nH+]cn2C)C1 ZINC000754682773 585289079 /nfs/dbraw/zinc/28/90/79/585289079.db2.gz BZKHDHVWOPAKFS-VUUNSECVSA-N 1 2 234.299 2.210 20 0 BEADLO C/C(=C\c1ccccc1)C[N@@H+](C)[C@H]1CCOC1=O ZINC000755192438 585295923 /nfs/dbraw/zinc/29/59/23/585295923.db2.gz BUJIELDZSASPOY-WONIAPNHSA-N 1 2 245.322 2.337 20 0 BEADLO C/C(=C\c1ccccc1)C[N@H+](C)[C@H]1CCOC1=O ZINC000755192438 585295924 /nfs/dbraw/zinc/29/59/24/585295924.db2.gz BUJIELDZSASPOY-WONIAPNHSA-N 1 2 245.322 2.337 20 0 BEADLO C/C=C(/C)C(=O)OCc1cc[nH+]c(N(C)C)c1 ZINC000755895654 585309524 /nfs/dbraw/zinc/30/95/24/585309524.db2.gz YHQRTCNGDOLBEU-YHYXMXQVSA-N 1 2 234.299 2.157 20 0 BEADLO C[C@@H](C(=O)OCc1cc[nH+]c(N(C)C)c1)C1CC1 ZINC000755915592 585310503 /nfs/dbraw/zinc/31/05/03/585310503.db2.gz YFZGGMRGRBQEKS-SNVBAGLBSA-N 1 2 248.326 2.237 20 0 BEADLO CC(C)=C(C)C(=O)N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000756129176 585314904 /nfs/dbraw/zinc/31/49/04/585314904.db2.gz BBJZGNBYPVCSTL-LBPRGKRZSA-N 1 2 247.342 2.092 20 0 BEADLO C[C@@H]1C[N@H+](C/C=C/c2ccccc2)CCN1C ZINC000839533956 585328989 /nfs/dbraw/zinc/32/89/89/585328989.db2.gz PTYKIVWMIVPZQA-VIIAAUOXSA-N 1 2 230.355 2.336 20 0 BEADLO C[C@@H]1C[N@@H+](C/C=C/c2ccccc2)CCN1C ZINC000839533956 585328990 /nfs/dbraw/zinc/32/89/90/585328990.db2.gz PTYKIVWMIVPZQA-VIIAAUOXSA-N 1 2 230.355 2.336 20 0 BEADLO Cl/C=C\C[N@@H+]1CCO[C@H](C2CCC2)C1 ZINC000839623821 585332837 /nfs/dbraw/zinc/33/28/37/585332837.db2.gz UUXNRLALELMNBG-SROOVFNMSA-N 1 2 215.724 2.240 20 0 BEADLO Cl/C=C\C[N@H+]1CCO[C@H](C2CCC2)C1 ZINC000839623821 585332838 /nfs/dbraw/zinc/33/28/38/585332838.db2.gz UUXNRLALELMNBG-SROOVFNMSA-N 1 2 215.724 2.240 20 0 BEADLO FCC[N@@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000759330826 585368008 /nfs/dbraw/zinc/36/80/08/585368008.db2.gz SQXXJWYJEQWZIT-GFCCVEGCSA-N 1 2 227.279 2.230 20 0 BEADLO FCC[N@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000759330826 585368009 /nfs/dbraw/zinc/36/80/09/585368009.db2.gz SQXXJWYJEQWZIT-GFCCVEGCSA-N 1 2 227.279 2.230 20 0 BEADLO COc1ccc2c(c1)C[N@@H+](CCF)CC2 ZINC000759330139 585368063 /nfs/dbraw/zinc/36/80/63/585368063.db2.gz DXDHPWDTWWAJLY-UHFFFAOYSA-N 1 2 209.264 2.023 20 0 BEADLO COc1ccc2c(c1)C[N@H+](CCF)CC2 ZINC000759330139 585368064 /nfs/dbraw/zinc/36/80/64/585368064.db2.gz DXDHPWDTWWAJLY-UHFFFAOYSA-N 1 2 209.264 2.023 20 0 BEADLO C[C@H](c1ccc([S@](C)=O)cc1)[N@H+](C)CCF ZINC000759345651 585369878 /nfs/dbraw/zinc/36/98/78/585369878.db2.gz JYGRNOAFXMZFPE-HWPZZCPQSA-N 1 2 243.347 2.386 20 0 BEADLO C[C@H](c1ccc([S@](C)=O)cc1)[N@@H+](C)CCF ZINC000759345651 585369879 /nfs/dbraw/zinc/36/98/79/585369879.db2.gz JYGRNOAFXMZFPE-HWPZZCPQSA-N 1 2 243.347 2.386 20 0 BEADLO C[C@@H](c1ccc([S@](C)=O)cc1)[N@H+](C)CCF ZINC000759345653 585370278 /nfs/dbraw/zinc/37/02/78/585370278.db2.gz JYGRNOAFXMZFPE-QFYYESIMSA-N 1 2 243.347 2.386 20 0 BEADLO C[C@@H](c1ccc([S@](C)=O)cc1)[N@@H+](C)CCF ZINC000759345653 585370279 /nfs/dbraw/zinc/37/02/79/585370279.db2.gz JYGRNOAFXMZFPE-QFYYESIMSA-N 1 2 243.347 2.386 20 0 BEADLO O=C(NCc1c[nH+]c[nH]1)c1cc(Cl)cs1 ZINC000760350151 585391089 /nfs/dbraw/zinc/39/10/89/585391089.db2.gz AOGVHXBINLPPDM-UHFFFAOYSA-N 1 2 241.703 2.055 20 0 BEADLO O=C(NCc1c[nH]c[nH+]1)c1cc(Cl)cs1 ZINC000760350151 585391090 /nfs/dbraw/zinc/39/10/90/585391090.db2.gz AOGVHXBINLPPDM-UHFFFAOYSA-N 1 2 241.703 2.055 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@H](C(F)(F)F)C2)no1 ZINC000761043049 585403677 /nfs/dbraw/zinc/40/36/77/585403677.db2.gz SQWFYOXPVWDEDK-QMMMGPOBSA-N 1 2 234.221 2.367 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@H](C(F)(F)F)C2)no1 ZINC000761043049 585403678 /nfs/dbraw/zinc/40/36/78/585403678.db2.gz SQWFYOXPVWDEDK-QMMMGPOBSA-N 1 2 234.221 2.367 20 0 BEADLO CC(C)CCc1noc(C[N@@H+]2CC[C@@H]3C[C@@H]32)n1 ZINC000761086064 585407359 /nfs/dbraw/zinc/40/73/59/585407359.db2.gz BWOFTJQLYQDUHZ-MNOVXSKESA-N 1 2 235.331 2.252 20 0 BEADLO CC(C)CCc1noc(C[N@H+]2CC[C@@H]3C[C@@H]32)n1 ZINC000761086064 585407360 /nfs/dbraw/zinc/40/73/60/585407360.db2.gz BWOFTJQLYQDUHZ-MNOVXSKESA-N 1 2 235.331 2.252 20 0 BEADLO CO[C@H](C)c1nc(C[N@@H+]2CC[C@H]3C[C@H]32)cs1 ZINC000761102378 585409516 /nfs/dbraw/zinc/40/95/16/585409516.db2.gz YSDIUWNGDJDIQE-WCABBAIRSA-N 1 2 238.356 2.445 20 0 BEADLO CO[C@H](C)c1nc(C[N@H+]2CC[C@H]3C[C@H]32)cs1 ZINC000761102378 585409517 /nfs/dbraw/zinc/40/95/17/585409517.db2.gz YSDIUWNGDJDIQE-WCABBAIRSA-N 1 2 238.356 2.445 20 0 BEADLO Cn1c(Cl)cnc1C[N@@H+]1CC[C@H](C(F)F)C1 ZINC000761107883 585409952 /nfs/dbraw/zinc/40/99/52/585409952.db2.gz JBESLUFIJCDSLV-ZETCQYMHSA-N 1 2 249.692 2.161 20 0 BEADLO Cn1c(Cl)cnc1C[N@H+]1CC[C@H](C(F)F)C1 ZINC000761107883 585409953 /nfs/dbraw/zinc/40/99/53/585409953.db2.gz JBESLUFIJCDSLV-ZETCQYMHSA-N 1 2 249.692 2.161 20 0 BEADLO CN(C)c1cc(CSc2cccnn2)cc[nH+]1 ZINC000762476962 585432950 /nfs/dbraw/zinc/43/29/50/585432950.db2.gz JEJOTQAZOHBKRZ-UHFFFAOYSA-N 1 2 246.339 2.230 20 0 BEADLO CCCC[C@H]([NH2+][C@H](C)c1ccc[nH]1)C(=O)OC ZINC000762557347 585434193 /nfs/dbraw/zinc/43/41/93/585434193.db2.gz DHQPXIOQVZCGDP-PWSUYJOCSA-N 1 2 238.331 2.397 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)c1cccc(F)c1 ZINC000763289124 585445989 /nfs/dbraw/zinc/44/59/89/585445989.db2.gz ZOTMWMKKFSHVEK-UHFFFAOYSA-N 1 2 248.257 2.269 20 0 BEADLO COc1ccc(C[N@H+](C)C/C=C\Cl)cn1 ZINC000764374811 585464094 /nfs/dbraw/zinc/46/40/94/585464094.db2.gz ZPHMAFGNJLXXFO-UTCJRWHESA-N 1 2 226.707 2.275 20 0 BEADLO COc1ccc(C[N@@H+](C)C/C=C\Cl)cn1 ZINC000764374811 585464095 /nfs/dbraw/zinc/46/40/95/585464095.db2.gz ZPHMAFGNJLXXFO-UTCJRWHESA-N 1 2 226.707 2.275 20 0 BEADLO CC[C@H](C)N(OC)C(=O)c1cccc2[nH+]ccn21 ZINC000764821336 585474892 /nfs/dbraw/zinc/47/48/92/585474892.db2.gz LIMZNRBCJHBFSN-JTQLQIEISA-N 1 2 247.298 2.136 20 0 BEADLO CC[C@@H](C)N(OC)C(=O)c1cccc2[nH+]ccn21 ZINC000764821337 585474948 /nfs/dbraw/zinc/47/49/48/585474948.db2.gz LIMZNRBCJHBFSN-SNVBAGLBSA-N 1 2 247.298 2.136 20 0 BEADLO FC(F)C1CC[NH+](Cn2cc[nH]c2=S)CC1 ZINC000765148323 585482077 /nfs/dbraw/zinc/48/20/77/585482077.db2.gz VYPOCKVAPGONAE-UHFFFAOYSA-N 1 2 247.314 2.106 20 0 BEADLO COc1ccc(C[NH2+]Cc2ccn[nH]2)c(C)c1 ZINC000765262762 585483294 /nfs/dbraw/zinc/48/32/94/585483294.db2.gz SOGWOMJRTOVKRC-UHFFFAOYSA-N 1 2 231.299 2.017 20 0 BEADLO CC(C)C[C@@H](C)C(=O)OCc1c[nH+]cn1C ZINC000765610938 585491417 /nfs/dbraw/zinc/49/14/17/585491417.db2.gz MGRQEZGJAUFLMO-SNVBAGLBSA-N 1 2 224.304 2.146 20 0 BEADLO C[C@H]1CC[N@H+](Cc2ccnc(F)c2)C[C@H]1F ZINC000859240149 589022969 /nfs/dbraw/zinc/02/29/69/589022969.db2.gz UMNPDLGHJAMSDC-GXSJLCMTSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2ccnc(F)c2)C[C@H]1F ZINC000859240149 589022971 /nfs/dbraw/zinc/02/29/71/589022971.db2.gz UMNPDLGHJAMSDC-GXSJLCMTSA-N 1 2 226.270 2.401 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OCc1cc2ccccc2o1 ZINC000767826528 585526516 /nfs/dbraw/zinc/52/65/16/585526516.db2.gz FAGORQQVEMDBDQ-VIFPVBQESA-N 1 2 248.282 2.466 20 0 BEADLO COC[C@H](C)SCc1cc[nH+]c(N(C)C)c1 ZINC000767868460 585527078 /nfs/dbraw/zinc/52/70/78/585527078.db2.gz WDZPFWJXEFWUDY-JTQLQIEISA-N 1 2 240.372 2.416 20 0 BEADLO CC(C)OCC(N)=[NH+]OCCc1ccccc1 ZINC000767933322 585528586 /nfs/dbraw/zinc/52/85/86/585528586.db2.gz IETBSLDLCXEIRI-UHFFFAOYSA-N 1 2 236.315 2.153 20 0 BEADLO C/C=C(\C)C(=O)N1CCC[C@@H](c2[nH+]ccn2C)C1 ZINC000768132408 585532367 /nfs/dbraw/zinc/53/23/67/585532367.db2.gz HRGOLQQAILLITI-KBVBDRTLSA-N 1 2 247.342 2.092 20 0 BEADLO Cc1ccc2[nH+]c(CNC(=O)C(C)(C)F)cn2c1 ZINC000768335652 585535621 /nfs/dbraw/zinc/53/56/21/585535621.db2.gz ZIKVFQNRHCWQPV-UHFFFAOYSA-N 1 2 249.289 2.007 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)C=C1CCCC1 ZINC000768322717 585535797 /nfs/dbraw/zinc/53/57/97/585535797.db2.gz BSTCLRAUIMMDBH-UHFFFAOYSA-N 1 2 247.342 2.232 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)Cc1cncc(F)c1 ZINC000768514100 585539529 /nfs/dbraw/zinc/53/95/29/585539529.db2.gz RTVWPWZDPDBMPZ-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)Cc1cncc(F)c1 ZINC000768514100 585539530 /nfs/dbraw/zinc/53/95/30/585539530.db2.gz RTVWPWZDPDBMPZ-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO CO[C@H]1CCC[N@H+](Cc2coc(C3CC3)n2)C1 ZINC000768752032 585542447 /nfs/dbraw/zinc/54/24/47/585542447.db2.gz BPTAZXVZZYYHHL-LBPRGKRZSA-N 1 2 236.315 2.163 20 0 BEADLO CO[C@H]1CCC[N@@H+](Cc2coc(C3CC3)n2)C1 ZINC000768752032 585542448 /nfs/dbraw/zinc/54/24/48/585542448.db2.gz BPTAZXVZZYYHHL-LBPRGKRZSA-N 1 2 236.315 2.163 20 0 BEADLO Cc1cc(C[N@@H+]2CCCOCC2)cnc1Cl ZINC000768888033 585545475 /nfs/dbraw/zinc/54/54/75/585545475.db2.gz JLSNZYFQIGDAMO-UHFFFAOYSA-N 1 2 240.734 2.266 20 0 BEADLO Cc1cc(C[N@H+]2CCCOCC2)cnc1Cl ZINC000768888033 585545476 /nfs/dbraw/zinc/54/54/76/585545476.db2.gz JLSNZYFQIGDAMO-UHFFFAOYSA-N 1 2 240.734 2.266 20 0 BEADLO CC/C=C\CCO[NH+]=C(N)Cc1cccnc1 ZINC000768922436 585546215 /nfs/dbraw/zinc/54/62/15/585546215.db2.gz NQYHERCKEAWYGE-ARJAWSKDSA-N 1 2 233.315 2.479 20 0 BEADLO C[C@@H]1C[N@H+](Cc2coc(C3CC3)n2)CCCO1 ZINC000769319717 585553778 /nfs/dbraw/zinc/55/37/78/585553778.db2.gz XXERMOLARZCPCX-SNVBAGLBSA-N 1 2 236.315 2.163 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2coc(C3CC3)n2)CCCO1 ZINC000769319717 585553779 /nfs/dbraw/zinc/55/37/79/585553779.db2.gz XXERMOLARZCPCX-SNVBAGLBSA-N 1 2 236.315 2.163 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)Cc1ccc2c(c1)COC2 ZINC000769382959 585555058 /nfs/dbraw/zinc/55/50/58/585555058.db2.gz DFGVHYWLFBYUKG-UHFFFAOYSA-N 1 2 243.310 2.072 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)Cc1ccc2c(c1)COC2 ZINC000769382959 585555059 /nfs/dbraw/zinc/55/50/59/585555059.db2.gz DFGVHYWLFBYUKG-UHFFFAOYSA-N 1 2 243.310 2.072 20 0 BEADLO Cc1cc(NC(=O)[C@@H](F)c2ccccc2)cc[nH+]1 ZINC000769470827 585558126 /nfs/dbraw/zinc/55/81/26/585558126.db2.gz BGUXANJNIKKXIL-ZDUSSCGKSA-N 1 2 244.269 2.461 20 0 BEADLO CC(C)[C@H](C)NC(=O)c1cccc2[nH+]ccn21 ZINC000770054880 585570279 /nfs/dbraw/zinc/57/02/79/585570279.db2.gz KZWIOEBPZWPTNE-JTQLQIEISA-N 1 2 231.299 2.109 20 0 BEADLO C[C@H](C1CC1)N(C)C(=O)c1cccc2[nH+]ccn21 ZINC000770402688 585573783 /nfs/dbraw/zinc/57/37/83/585573783.db2.gz QWZJVCHNIIERJT-SNVBAGLBSA-N 1 2 243.310 2.205 20 0 BEADLO C[C@@H]1CCC[C@H]1NC(=O)c1cccc2[nH+]ccn21 ZINC000770417787 585574030 /nfs/dbraw/zinc/57/40/30/585574030.db2.gz NZEPYSUYWSZSHM-GHMZBOCLSA-N 1 2 243.310 2.253 20 0 BEADLO Cc1ncc(CNc2ccc([NH+](C)C)cc2)cn1 ZINC000770505140 585575003 /nfs/dbraw/zinc/57/50/03/585575003.db2.gz WAGORRAULYGTGE-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO O=C(OCc1cccc2[nH+]ccn21)c1ccco1 ZINC000770733664 585580825 /nfs/dbraw/zinc/58/08/25/585580825.db2.gz OMLHBBKJLZDEAK-UHFFFAOYSA-N 1 2 242.234 2.284 20 0 BEADLO C[C@@H](C(=O)OCc1cccc2[nH+]ccn21)C1CC1 ZINC000770925923 585584351 /nfs/dbraw/zinc/58/43/51/585584351.db2.gz PMFBIQREAHIDFV-SNVBAGLBSA-N 1 2 244.294 2.424 20 0 BEADLO Cc1ccc(COC(=O)[C@H]2C[C@@H]2C)c(C)[nH+]1 ZINC000771889437 585603795 /nfs/dbraw/zinc/60/37/95/585603795.db2.gz JHFMROQCCNOTKZ-UFBFGSQYSA-N 1 2 219.284 2.398 20 0 BEADLO O=C(OCCn1cc[nH+]c1)C1CCCCCC1 ZINC000771952500 585605450 /nfs/dbraw/zinc/60/54/50/585605450.db2.gz UGJWVOICOQKLOD-UHFFFAOYSA-N 1 2 236.315 2.397 20 0 BEADLO CC(C)(C)/C=C/C(=O)OCCn1cc[nH+]c1 ZINC000771974582 585605841 /nfs/dbraw/zinc/60/58/41/585605841.db2.gz YUQNIOBCCSPSEU-SNAWJCMRSA-N 1 2 222.288 2.029 20 0 BEADLO CC1(C)C(C(=O)OCCn2cc[nH+]c2)C1(C)C ZINC000771983092 585606123 /nfs/dbraw/zinc/60/61/23/585606123.db2.gz AGPXXBPMWUYNAN-UHFFFAOYSA-N 1 2 236.315 2.109 20 0 BEADLO CCC1(C(=O)OCCn2cc[nH+]c2)CCC1 ZINC000771993037 585606364 /nfs/dbraw/zinc/60/63/64/585606364.db2.gz GYXQBBIRLDBHMV-UHFFFAOYSA-N 1 2 222.288 2.007 20 0 BEADLO C[C@H]1CC/C(=C/C(=O)OCCn2cc[nH+]c2)C1 ZINC000771999727 585606685 /nfs/dbraw/zinc/60/66/85/585606685.db2.gz GWPYMGWSUUPZQQ-AWPPVZKDSA-N 1 2 234.299 2.173 20 0 BEADLO Cc1ccc(COC(=O)C[C@H]2CCCO2)c(C)[nH+]1 ZINC000772016906 585606802 /nfs/dbraw/zinc/60/68/02/585606802.db2.gz SJXCTUJAIZIKNT-CYBMUJFWSA-N 1 2 249.310 2.311 20 0 BEADLO COCCCC(=O)OCc1ccc(C)[nH+]c1C ZINC000772024172 585607094 /nfs/dbraw/zinc/60/70/94/585607094.db2.gz UVMTWDYUCAMTKQ-UHFFFAOYSA-N 1 2 237.299 2.168 20 0 BEADLO CCc1ccccc1C(=O)OCCn1cc[nH+]c1 ZINC000772020075 585607198 /nfs/dbraw/zinc/60/71/98/585607198.db2.gz UBZNGSALGQHPQB-UHFFFAOYSA-N 1 2 244.294 2.303 20 0 BEADLO Cc1ccc(COC(=O)C[C@@H]2CCOC2)c(C)[nH+]1 ZINC000772143650 585609033 /nfs/dbraw/zinc/60/90/33/585609033.db2.gz QUVZTXDFEFGYDN-LBPRGKRZSA-N 1 2 249.310 2.168 20 0 BEADLO C/C(=C/C(C)(C)C)C(=O)OCCn1cc[nH+]c1 ZINC000772812936 585624829 /nfs/dbraw/zinc/62/48/29/585624829.db2.gz JZSZLJHZKZWKLN-LUAWRHEFSA-N 1 2 236.315 2.419 20 0 BEADLO CCC1(C(=O)OCc2c[nH+]ccc2OC)CC1 ZINC000805485617 585638181 /nfs/dbraw/zinc/63/81/81/585638181.db2.gz MAOZXZDPDRKGEQ-UHFFFAOYSA-N 1 2 235.283 2.324 20 0 BEADLO C[C@H](C(=O)OCc1c[nH+]cn1C)c1ccccc1 ZINC000774140113 585651576 /nfs/dbraw/zinc/65/15/76/585651576.db2.gz SEUWEKCRQOUNLX-NSHDSACASA-N 1 2 244.294 2.267 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1C(=O)OCCn1cc[nH+]c1 ZINC000775085553 585671909 /nfs/dbraw/zinc/67/19/09/585671909.db2.gz XXSBERFNGVRKBD-AAEUAGOBSA-N 1 2 236.315 2.109 20 0 BEADLO CC(C)=CCOC(=O)Cc1cn2ccccc2[nH+]1 ZINC000775278343 585674856 /nfs/dbraw/zinc/67/48/56/585674856.db2.gz GZNWIFQLYLLXFT-UHFFFAOYSA-N 1 2 244.294 2.386 20 0 BEADLO Cc1nonc1C[NH2+][C@H](c1ccccn1)C(C)C ZINC000775447102 585678048 /nfs/dbraw/zinc/67/80/48/585678048.db2.gz XGSPGGUSXCDUMZ-ZDUSSCGKSA-N 1 2 246.314 2.260 20 0 BEADLO COc1cc[nH+]cc1COC(=O)c1[nH]ccc1C ZINC000805554985 585688221 /nfs/dbraw/zinc/68/82/21/585688221.db2.gz JFUKWJOSELGYDZ-UHFFFAOYSA-N 1 2 246.266 2.084 20 0 BEADLO CC(C)[C@H]1CCN1C(=O)c1cccc2[nH+]ccn21 ZINC000775978014 585688456 /nfs/dbraw/zinc/68/84/56/585688456.db2.gz QFSCPMMBHLZSDG-LLVKDONJSA-N 1 2 243.310 2.205 20 0 BEADLO Cn1nc(C[N@@H+]2CCCC3(CC3)C2)cc1Cl ZINC000859254704 589024413 /nfs/dbraw/zinc/02/44/13/589024413.db2.gz BPGOETOGGFWDLA-UHFFFAOYSA-N 1 2 239.750 2.450 20 0 BEADLO Cn1nc(C[N@H+]2CCCC3(CC3)C2)cc1Cl ZINC000859254704 589024414 /nfs/dbraw/zinc/02/44/14/589024414.db2.gz BPGOETOGGFWDLA-UHFFFAOYSA-N 1 2 239.750 2.450 20 0 BEADLO C[C@@H]1CCN(C(=O)c2cccc3[nH+]ccn32)[C@@H]1C ZINC000776982265 585707191 /nfs/dbraw/zinc/70/71/91/585707191.db2.gz FJGNNKRDZGNKKP-GHMZBOCLSA-N 1 2 243.310 2.205 20 0 BEADLO CCc1noc(C)c1[C@H](C)[NH2+]Cc1cocn1 ZINC000777034809 585707420 /nfs/dbraw/zinc/70/74/20/585707420.db2.gz AIWAZMGHZIGIBI-QMMMGPOBSA-N 1 2 235.287 2.384 20 0 BEADLO O=C([C@@H]1CC12CCC2)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000777455192 585712370 /nfs/dbraw/zinc/71/23/70/585712370.db2.gz NLWXDKJRSDJEHG-WDEREUQCSA-N 1 2 245.326 2.263 20 0 BEADLO C/C=C/C=C\C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000777454159 585712386 /nfs/dbraw/zinc/71/23/86/585712386.db2.gz UTKSTDKCNLEJSZ-XPILNJTPSA-N 1 2 231.299 2.206 20 0 BEADLO C/C(=C/C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1)C1CC1 ZINC000777454100 585712461 /nfs/dbraw/zinc/71/24/61/585712461.db2.gz RYMNWBGDEGWYFN-ZWLSGLHFSA-N 1 2 245.326 2.430 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc(F)nc1 ZINC000779147776 585745791 /nfs/dbraw/zinc/74/57/91/585745791.db2.gz KYMHQQBTNSEEKS-CMPLNLGQSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(F)nc1 ZINC000779147776 585745792 /nfs/dbraw/zinc/74/57/92/585745792.db2.gz KYMHQQBTNSEEKS-CMPLNLGQSA-N 1 2 238.306 2.220 20 0 BEADLO CC/C(C)=C(/C)C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000780893100 585785856 /nfs/dbraw/zinc/78/58/56/585785856.db2.gz TWLGCJSONMHUPJ-JPQYHBGPSA-N 1 2 235.331 2.134 20 0 BEADLO COC(=O)[C@H]1CCCCC[N@@H+]1C/C=C\Cl ZINC000781348043 585794966 /nfs/dbraw/zinc/79/49/66/585794966.db2.gz YZSCJELCCNNABD-ONRRBMGISA-N 1 2 231.723 2.157 20 0 BEADLO COC(=O)[C@H]1CCCCC[N@H+]1C/C=C\Cl ZINC000781348043 585794967 /nfs/dbraw/zinc/79/49/67/585794967.db2.gz YZSCJELCCNNABD-ONRRBMGISA-N 1 2 231.723 2.157 20 0 BEADLO CC1(C)CC[C@@H](C(=O)OCCn2cc[nH+]c2)C1 ZINC000781696388 585801996 /nfs/dbraw/zinc/80/19/96/585801996.db2.gz CUSXNJALPFRHDY-LLVKDONJSA-N 1 2 236.315 2.253 20 0 BEADLO CC(C)=CC(=O)OCc1cc[nH+]c(N(C)C)c1 ZINC000782147287 585808526 /nfs/dbraw/zinc/80/85/26/585808526.db2.gz QFJSIFOOHUIZJX-UHFFFAOYSA-N 1 2 234.299 2.157 20 0 BEADLO C[C@@H](CC(=O)OCCCn1cc[nH+]c1)C1CC1 ZINC000783197686 585830110 /nfs/dbraw/zinc/83/01/10/585830110.db2.gz CDLZDXUOBDMXHU-NSHDSACASA-N 1 2 236.315 2.253 20 0 BEADLO Fc1ccc(C[N@@H+]2CCc3ncsc3C2)cn1 ZINC000783743121 585842000 /nfs/dbraw/zinc/84/20/00/585842000.db2.gz GHZSYKBBZUSGID-UHFFFAOYSA-N 1 2 249.314 2.236 20 0 BEADLO Fc1ccc(C[N@H+]2CCc3ncsc3C2)cn1 ZINC000783743121 585842001 /nfs/dbraw/zinc/84/20/01/585842001.db2.gz GHZSYKBBZUSGID-UHFFFAOYSA-N 1 2 249.314 2.236 20 0 BEADLO C[C@H](C(=O)OCCCn1cc[nH+]c1)c1ccco1 ZINC000783837713 585844478 /nfs/dbraw/zinc/84/44/78/585844478.db2.gz FVOFQGVOLTXXGG-NSHDSACASA-N 1 2 248.282 2.213 20 0 BEADLO CC(C)=C(C)C(=O)OCCCn1cc[nH+]c1 ZINC000784038610 585847741 /nfs/dbraw/zinc/84/77/41/585847741.db2.gz LGUQDXSZXZXUNX-UHFFFAOYSA-N 1 2 222.288 2.173 20 0 BEADLO CC(C)[C@H]1C[C@@H]1C(=O)OCCCn1cc[nH+]c1 ZINC000784785918 585866086 /nfs/dbraw/zinc/86/60/86/585866086.db2.gz HGSZKSFORHLSEM-NEPJUHHUSA-N 1 2 236.315 2.109 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)C1(F)CCCC1 ZINC000784800779 585866321 /nfs/dbraw/zinc/86/63/21/585866321.db2.gz MYZTYMPUMWYDCT-UHFFFAOYSA-N 1 2 240.278 2.099 20 0 BEADLO Cn1c[nH+]cc1COC(=O)C12CCC(CC1)C2 ZINC000784881821 585867703 /nfs/dbraw/zinc/86/77/03/585867703.db2.gz ACXRGBCRRVABOZ-UHFFFAOYSA-N 1 2 234.299 2.044 20 0 BEADLO C/C=C(/CC)C(=O)OCCCn1cc[nH+]c1 ZINC000784903311 585868410 /nfs/dbraw/zinc/86/84/10/585868410.db2.gz DOCDFFTWKUMTJT-JYOAFUTRSA-N 1 2 222.288 2.173 20 0 BEADLO CC1(CC(=O)OCCCn2cc[nH+]c2)CC1 ZINC000784968514 585869146 /nfs/dbraw/zinc/86/91/46/585869146.db2.gz FZRURKUARKIVIX-UHFFFAOYSA-N 1 2 222.288 2.007 20 0 BEADLO Cc1nc(F)ccc1C[N@@H+]1CCOC(C)(C)C1 ZINC000787114358 585901408 /nfs/dbraw/zinc/90/14/08/585901408.db2.gz YWTYKTXSXJKONJ-UHFFFAOYSA-N 1 2 238.306 2.140 20 0 BEADLO Cc1nc(F)ccc1C[N@H+]1CCOC(C)(C)C1 ZINC000787114358 585901409 /nfs/dbraw/zinc/90/14/09/585901409.db2.gz YWTYKTXSXJKONJ-UHFFFAOYSA-N 1 2 238.306 2.140 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2ccc(F)cn2)C[C@H]1F ZINC000787279162 585904747 /nfs/dbraw/zinc/90/47/47/585904747.db2.gz HVEJQSSOJXMLNB-BXKDBHETSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2ccc(F)cn2)C[C@H]1F ZINC000787279162 585904748 /nfs/dbraw/zinc/90/47/48/585904748.db2.gz HVEJQSSOJXMLNB-BXKDBHETSA-N 1 2 226.270 2.401 20 0 BEADLO Nc1cc(COC(=O)c2cccc(F)c2)cc[nH+]1 ZINC000787578922 585912100 /nfs/dbraw/zinc/91/21/00/585912100.db2.gz NTRGLXJBXGERLW-UHFFFAOYSA-N 1 2 246.241 2.160 20 0 BEADLO Nc1cc(COC(=O)c2ccccc2F)cc[nH+]1 ZINC000787596725 585912637 /nfs/dbraw/zinc/91/26/37/585912637.db2.gz ARLUPMBJBUXZKT-UHFFFAOYSA-N 1 2 246.241 2.160 20 0 BEADLO NC(Cc1cccnc1)=[NH+]OCCCCCF ZINC000789598358 585945442 /nfs/dbraw/zinc/94/54/42/585945442.db2.gz YMCAQZZDGPKZNX-UHFFFAOYSA-N 1 2 239.294 2.262 20 0 BEADLO CC(C)C[C@H](C)CO[NH+]=C(N)[C@@H]1CCCO1 ZINC000789608700 585946479 /nfs/dbraw/zinc/94/64/79/585946479.db2.gz LDUGSNBDIOHMCZ-QWRGUYRKSA-N 1 2 228.336 2.346 20 0 BEADLO NC(=[NH+]OCC1CCCCC1)[C@H]1CCCO1 ZINC000789613807 585946777 /nfs/dbraw/zinc/94/67/77/585946777.db2.gz VVTNWSYPBIMNJB-LLVKDONJSA-N 1 2 226.320 2.244 20 0 BEADLO Cc1ccc(C(=O)OCCCc2[nH+]ccn2C)o1 ZINC000789792421 585950371 /nfs/dbraw/zinc/95/03/71/585950371.db2.gz UENTYAYPNADLQW-UHFFFAOYSA-N 1 2 248.282 2.111 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1ncc(Cl)n1C ZINC000791567740 585984503 /nfs/dbraw/zinc/98/45/03/585984503.db2.gz KPVWWEUNXYBAGH-YUMQZZPRSA-N 1 2 213.712 2.056 20 0 BEADLO Cc1nonc1C[N@H+]1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000791583187 585984639 /nfs/dbraw/zinc/98/46/39/585984639.db2.gz MRCFNHIMXAPFLY-YUMQZZPRSA-N 1 2 249.236 2.151 20 0 BEADLO Cc1nonc1C[N@@H+]1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000791583187 585984640 /nfs/dbraw/zinc/98/46/40/585984640.db2.gz MRCFNHIMXAPFLY-YUMQZZPRSA-N 1 2 249.236 2.151 20 0 BEADLO Nc1cc(COC(=O)CCC(F)(F)F)cc[nH+]1 ZINC000791971395 585992734 /nfs/dbraw/zinc/99/27/34/585992734.db2.gz RCOXTNIDXMBRKE-UHFFFAOYSA-N 1 2 248.204 2.050 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](Cc1ccoc1)C1CCC1 ZINC000792185358 585997120 /nfs/dbraw/zinc/99/71/20/585997120.db2.gz JXGBEDFFUZPFPA-SNVBAGLBSA-N 1 2 237.299 2.196 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](Cc1ccoc1)C1CCC1 ZINC000792185358 585997121 /nfs/dbraw/zinc/99/71/21/585997121.db2.gz JXGBEDFFUZPFPA-SNVBAGLBSA-N 1 2 237.299 2.196 20 0 BEADLO CCc1occc1C(=O)OCc1cc[nH+]c(N)c1 ZINC000792282372 585998948 /nfs/dbraw/zinc/99/89/48/585998948.db2.gz RUEUBPJXKQNBTI-UHFFFAOYSA-N 1 2 246.266 2.176 20 0 BEADLO CCC(CC)CC(=O)OCCc1c[nH+]cn1C ZINC000793251539 586014943 /nfs/dbraw/zinc/01/49/43/586014943.db2.gz GAWTVZSFILIYAD-UHFFFAOYSA-N 1 2 238.331 2.332 20 0 BEADLO CCCC[C@H](C)C(=O)OCCc1c[nH+]cn1C ZINC000793251439 586015112 /nfs/dbraw/zinc/01/51/12/586015112.db2.gz RLXUQBCCHACMBO-NSHDSACASA-N 1 2 238.331 2.332 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)OCCc1c[nH+]cn1C ZINC000793253878 586015199 /nfs/dbraw/zinc/01/51/99/586015199.db2.gz UHJCBGSKKHWPGH-QWRGUYRKSA-N 1 2 238.331 2.188 20 0 BEADLO C[C@H](C(=O)OCCc1c[nH+]cn1C)C(C)(C)C ZINC000793256865 586015319 /nfs/dbraw/zinc/01/53/19/586015319.db2.gz DVJVWLCJOFEKHV-SNVBAGLBSA-N 1 2 238.331 2.188 20 0 BEADLO Cc1ncc(C[NH+]2CCC(F)(F)CC2)cn1 ZINC000793353708 586017312 /nfs/dbraw/zinc/01/73/12/586017312.db2.gz UJHVKWFSHFYFIZ-UHFFFAOYSA-N 1 2 227.258 2.016 20 0 BEADLO CC[C@@H]1CC[N@@H+]1Cn1ncc(Cl)c1C ZINC000793820491 586027336 /nfs/dbraw/zinc/02/73/36/586027336.db2.gz LXKXFMFOJMEXQJ-SECBINFHSA-N 1 2 213.712 2.287 20 0 BEADLO CC[C@@H]1CC[N@H+]1Cn1ncc(Cl)c1C ZINC000793820491 586027337 /nfs/dbraw/zinc/02/73/37/586027337.db2.gz LXKXFMFOJMEXQJ-SECBINFHSA-N 1 2 213.712 2.287 20 0 BEADLO Cc1nnc(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)[nH]1 ZINC000794270376 586036511 /nfs/dbraw/zinc/03/65/11/586036511.db2.gz DPHXMRHNHONJES-JTQLQIEISA-N 1 2 242.326 2.232 20 0 BEADLO Cc1nnc(C[N@H+]2Cc3ccccc3[C@@H](C)C2)[nH]1 ZINC000794270376 586036512 /nfs/dbraw/zinc/03/65/12/586036512.db2.gz DPHXMRHNHONJES-JTQLQIEISA-N 1 2 242.326 2.232 20 0 BEADLO CC1=C[C@H](C)C[N@H+](Cc2cc(Cl)n(C)n2)C1 ZINC000859289557 589027738 /nfs/dbraw/zinc/02/77/38/589027738.db2.gz FPBVTXABXSMWAV-VIFPVBQESA-N 1 2 239.750 2.472 20 0 BEADLO FC1(F)CC[NH+](Cn2cccnc2=S)CC1 ZINC000794687088 586046860 /nfs/dbraw/zinc/04/68/60/586046860.db2.gz UKQZCFKVMFNRJD-UHFFFAOYSA-N 1 2 245.298 2.301 20 0 BEADLO CC1=C[C@H](C)C[N@@H+](Cc2cc(Cl)n(C)n2)C1 ZINC000859289557 589027739 /nfs/dbraw/zinc/02/77/39/589027739.db2.gz FPBVTXABXSMWAV-VIFPVBQESA-N 1 2 239.750 2.472 20 0 BEADLO Fc1cc(C[N@@H+]2CCC[C@H]2c2cc[nH]n2)ccn1 ZINC000859282884 589027975 /nfs/dbraw/zinc/02/79/75/589027975.db2.gz XVRRZQMYWGUOEX-LBPRGKRZSA-N 1 2 246.289 2.281 20 0 BEADLO Fc1cc(C[N@H+]2CCC[C@H]2c2cc[nH]n2)ccn1 ZINC000859282884 589027977 /nfs/dbraw/zinc/02/79/77/589027977.db2.gz XVRRZQMYWGUOEX-LBPRGKRZSA-N 1 2 246.289 2.281 20 0 BEADLO Clc1cccc(CN2CCc3[nH+]c[nH]c3C2)n1 ZINC000859308840 589029866 /nfs/dbraw/zinc/02/98/66/589029866.db2.gz VFFNKLJAKITUMR-UHFFFAOYSA-N 1 2 248.717 2.016 20 0 BEADLO CCc1cnc(C[NH+]2CCC(F)(F)CC2)o1 ZINC000796541777 586106412 /nfs/dbraw/zinc/10/64/12/586106412.db2.gz ZRGYDACJBBSKOV-UHFFFAOYSA-N 1 2 230.258 2.468 20 0 BEADLO Cc1ccc(C[N@@H+](C/C=C\Cl)CCO)o1 ZINC000796558085 586106698 /nfs/dbraw/zinc/10/66/98/586106698.db2.gz CFBUEWKNJPSSMG-DJWKRKHSSA-N 1 2 229.707 2.135 20 0 BEADLO Cc1ccc(C[N@H+](C/C=C\Cl)CCO)o1 ZINC000796558085 586106699 /nfs/dbraw/zinc/10/66/99/586106699.db2.gz CFBUEWKNJPSSMG-DJWKRKHSSA-N 1 2 229.707 2.135 20 0 BEADLO CCCOC(=O)[C@H](C)[NH+]1CCC(F)(F)CC1 ZINC000796548118 586106862 /nfs/dbraw/zinc/10/68/62/586106862.db2.gz AKFJCOWWIDSXCW-VIFPVBQESA-N 1 2 235.274 2.059 20 0 BEADLO CO[C@@H](C)C[N@H+](C)Cc1ncc(C(C)C)o1 ZINC000796642985 586109295 /nfs/dbraw/zinc/10/92/95/586109295.db2.gz VJQVRVMBVFMDPU-JTQLQIEISA-N 1 2 226.320 2.265 20 0 BEADLO CO[C@@H](C)C[N@@H+](C)Cc1ncc(C(C)C)o1 ZINC000796642985 586109296 /nfs/dbraw/zinc/10/92/96/586109296.db2.gz VJQVRVMBVFMDPU-JTQLQIEISA-N 1 2 226.320 2.265 20 0 BEADLO C[C@@H](Nc1cnn(CC2CC2)c1)c1[nH]cc[nH+]1 ZINC000796894904 586116380 /nfs/dbraw/zinc/11/63/80/586116380.db2.gz ZFBGXBYCAYDBQN-SECBINFHSA-N 1 2 231.303 2.189 20 0 BEADLO CC[C@@H]1OCC[C@H]1C(=O)Nc1ccc(C)[nH+]c1C ZINC000797113914 586120634 /nfs/dbraw/zinc/12/06/34/586120634.db2.gz MRYLWUZZMOMTIV-YPMHNXCESA-N 1 2 248.326 2.452 20 0 BEADLO C[C@@H]([NH2+]Cc1cnc(Cl)cn1)c1ccccn1 ZINC000799162807 586163354 /nfs/dbraw/zinc/16/33/54/586163354.db2.gz BEXXGIQQPAXPJV-SECBINFHSA-N 1 2 248.717 2.376 20 0 BEADLO CC1=CCC[N@H+](Cc2cnc(Cl)cn2)C1 ZINC000799169962 586164834 /nfs/dbraw/zinc/16/48/34/586164834.db2.gz QQXCWRAMECRXSO-UHFFFAOYSA-N 1 2 223.707 2.282 20 0 BEADLO CC1=CCC[N@@H+](Cc2cnc(Cl)cn2)C1 ZINC000799169962 586164836 /nfs/dbraw/zinc/16/48/36/586164836.db2.gz QQXCWRAMECRXSO-UHFFFAOYSA-N 1 2 223.707 2.282 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OC[C@H](C)CC(C)C ZINC000799175877 586164854 /nfs/dbraw/zinc/16/48/54/586164854.db2.gz UNXSWKBUDLTVSH-ZJUUUORDSA-N 1 2 216.325 2.202 20 0 BEADLO CCCC[C@H](C)C(=O)NC1=[NH+]CCS1 ZINC000799872234 586198870 /nfs/dbraw/zinc/19/88/70/586198870.db2.gz OIFSMKJUUUZMRP-QMMMGPOBSA-N 1 2 214.334 2.032 20 0 BEADLO Cn1nc(C[N@@H+]2CC3CC2(C)C3)cc1Cl ZINC000859362427 589034006 /nfs/dbraw/zinc/03/40/06/589034006.db2.gz XBKHBBCFTLSYAK-UHFFFAOYSA-N 1 2 225.723 2.058 20 0 BEADLO Cn1nc(C[N@H+]2CC3CC2(C)C3)cc1Cl ZINC000859362427 589034008 /nfs/dbraw/zinc/03/40/08/589034008.db2.gz XBKHBBCFTLSYAK-UHFFFAOYSA-N 1 2 225.723 2.058 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccnn2C)no1 ZINC000800502991 586223552 /nfs/dbraw/zinc/22/35/52/586223552.db2.gz KCBLZNXRRSRQGP-NXEZZACHSA-N 1 2 234.303 2.128 20 0 BEADLO Cn1c[nH+]c(/C=C2/C(=O)Nc3ccc(F)cc32)c1 ZINC000800795117 586229161 /nfs/dbraw/zinc/22/91/61/586229161.db2.gz YYVGMMMFLRABAN-VZUCSPMQSA-N 1 2 243.241 2.052 20 0 BEADLO Cc1cc(C)nc(C(=O)Nc2cc[nH+]cc2C)c1 ZINC000800884458 586235680 /nfs/dbraw/zinc/23/56/80/586235680.db2.gz GWGSTFKYQQUDFY-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO Cc1cccc(C[N@@H+]2CCO[C@@H](C(F)F)C2)c1 ZINC000801561712 586262651 /nfs/dbraw/zinc/26/26/51/586262651.db2.gz STKKSKZZPHVXRL-GFCCVEGCSA-N 1 2 241.281 2.461 20 0 BEADLO Cc1cccc(C[N@H+]2CCO[C@@H](C(F)F)C2)c1 ZINC000801561712 586262653 /nfs/dbraw/zinc/26/26/53/586262653.db2.gz STKKSKZZPHVXRL-GFCCVEGCSA-N 1 2 241.281 2.461 20 0 BEADLO C[C@@H](c1cccnc1)[N@@H+]1CCO[C@@H](C(F)F)C1 ZINC000801566624 586264070 /nfs/dbraw/zinc/26/40/70/586264070.db2.gz DHZSSZQZROALAI-GXSJLCMTSA-N 1 2 242.269 2.109 20 0 BEADLO C[C@@H](c1cccnc1)[N@H+]1CCO[C@@H](C(F)F)C1 ZINC000801566624 586264071 /nfs/dbraw/zinc/26/40/71/586264071.db2.gz DHZSSZQZROALAI-GXSJLCMTSA-N 1 2 242.269 2.109 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@@H](C(F)F)C2)cc1 ZINC000801566421 586264750 /nfs/dbraw/zinc/26/47/50/586264750.db2.gz NLQLOQZCYFPPRU-GFCCVEGCSA-N 1 2 241.281 2.461 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@@H](C(F)F)C2)cc1 ZINC000801566421 586264752 /nfs/dbraw/zinc/26/47/52/586264752.db2.gz NLQLOQZCYFPPRU-GFCCVEGCSA-N 1 2 241.281 2.461 20 0 BEADLO C[C@H]1C[N@H+](C[C@H]2CC2(Cl)Cl)CCC1=O ZINC000801944658 586281312 /nfs/dbraw/zinc/28/13/12/586281312.db2.gz HBCDLKUVVLYKSA-JGVFFNPUSA-N 1 2 236.142 2.091 20 0 BEADLO C[C@H]1C[N@@H+](C[C@H]2CC2(Cl)Cl)CCC1=O ZINC000801944658 586281315 /nfs/dbraw/zinc/28/13/15/586281315.db2.gz HBCDLKUVVLYKSA-JGVFFNPUSA-N 1 2 236.142 2.091 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)O[C@@H]1CC[N@H+](CCF)C1 ZINC000802238974 586298772 /nfs/dbraw/zinc/29/87/72/586298772.db2.gz LUCXYMPITNUTAP-SDDRHHMPSA-N 1 2 245.338 2.256 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)O[C@@H]1CC[N@@H+](CCF)C1 ZINC000802238974 586298773 /nfs/dbraw/zinc/29/87/73/586298773.db2.gz LUCXYMPITNUTAP-SDDRHHMPSA-N 1 2 245.338 2.256 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OCCSC(C)(C)C ZINC000802731457 586311270 /nfs/dbraw/zinc/31/12/70/586311270.db2.gz PURCGLHGSNLTJP-QMMMGPOBSA-N 1 2 234.365 2.051 20 0 BEADLO CC(C)[C@H](C)C(=O)OCCCc1[nH+]ccn1C ZINC000802790011 586314956 /nfs/dbraw/zinc/31/49/56/586314956.db2.gz PKWWVHGEVBTCQN-NSHDSACASA-N 1 2 238.331 2.188 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCCC(F)(F)CC2)n1 ZINC000859537984 589043329 /nfs/dbraw/zinc/04/33/29/589043329.db2.gz VLRHNDJKHFIPPL-UHFFFAOYSA-N 1 2 241.285 2.406 20 0 BEADLO Cc1ccnc(C[N@H+]2CCCC(F)(F)CC2)n1 ZINC000859537984 589043331 /nfs/dbraw/zinc/04/33/31/589043331.db2.gz VLRHNDJKHFIPPL-UHFFFAOYSA-N 1 2 241.285 2.406 20 0 BEADLO C[C@@H]1C[C@@H]1COC(=O)c1ccc2[nH+]ccn2c1 ZINC000859551824 589044330 /nfs/dbraw/zinc/04/43/30/589044330.db2.gz HIXKBFIAVJISHI-MWLCHTKSSA-N 1 2 230.267 2.147 20 0 BEADLO C[C@H]1CN(C[NH+]2Cc3ccccc3C2)C(=O)[C@@H]1C ZINC000839991248 586333775 /nfs/dbraw/zinc/33/37/75/586333775.db2.gz NERYBTCOLTYUCH-NWDGAFQWSA-N 1 2 244.338 2.074 20 0 BEADLO CC(C)SCCOC(=O)[C@@H]1CCCC[N@@H+]1C ZINC000803360398 586347224 /nfs/dbraw/zinc/34/72/24/586347224.db2.gz AIJVWVLCATXJEQ-NSHDSACASA-N 1 2 245.388 2.156 20 0 BEADLO CC(C)SCCOC(=O)[C@@H]1CCCC[N@H+]1C ZINC000803360398 586347227 /nfs/dbraw/zinc/34/72/27/586347227.db2.gz AIJVWVLCATXJEQ-NSHDSACASA-N 1 2 245.388 2.156 20 0 BEADLO CC1(C)CC(C(=O)OCCCn2cc[nH+]c2)C1 ZINC000803755635 586372237 /nfs/dbraw/zinc/37/22/37/586372237.db2.gz HDIDSTUGDFUAJF-UHFFFAOYSA-N 1 2 236.315 2.253 20 0 BEADLO CCC(=CC(=O)N[C@H]1CCc2c[nH+]cn2C1)CC ZINC000804335064 586391079 /nfs/dbraw/zinc/39/10/79/586391079.db2.gz QHZJYBZKHRMDRR-LBPRGKRZSA-N 1 2 247.342 2.061 20 0 BEADLO CC/C(C)=C(\C)C(=O)N[C@@H]1CCc2c[nH+]cn2C1 ZINC000804331884 586391405 /nfs/dbraw/zinc/39/14/05/586391405.db2.gz FEZHEBGVYMZGJW-HCRIHEDKSA-N 1 2 247.342 2.061 20 0 BEADLO CC[NH2+]Cc1noc(C[C@H]2CC[C@H](C)C2)n1 ZINC000843144986 586436703 /nfs/dbraw/zinc/43/67/03/586436703.db2.gz RBQSUFDDWDZORE-UWVGGRQHSA-N 1 2 223.320 2.158 20 0 BEADLO CC[NH2+]Cc1noc(CSCCC(C)C)n1 ZINC000843145093 586444261 /nfs/dbraw/zinc/44/42/61/586444261.db2.gz CTYVCCDVWPWNBG-UHFFFAOYSA-N 1 2 243.376 2.458 20 0 BEADLO CC1(C)CCC(=O)N1C[N@@H+]1CCC[C@](C)(F)C1 ZINC000840100700 586445605 /nfs/dbraw/zinc/44/56/05/586445605.db2.gz WJFOFVDHOYAHIK-ZDUSSCGKSA-N 1 2 242.338 2.169 20 0 BEADLO CC1(C)CCC(=O)N1C[N@H+]1CCC[C@](C)(F)C1 ZINC000840100700 586445607 /nfs/dbraw/zinc/44/56/07/586445607.db2.gz WJFOFVDHOYAHIK-ZDUSSCGKSA-N 1 2 242.338 2.169 20 0 BEADLO CC[C@H]1CC(=O)N(C[N@@H+]2CCC[C@](C)(F)C2)C1 ZINC000840097949 586445636 /nfs/dbraw/zinc/44/56/36/586445636.db2.gz BFTKMINAKUXOKR-AAEUAGOBSA-N 1 2 242.338 2.026 20 0 BEADLO CC[C@H]1CC(=O)N(C[N@H+]2CCC[C@](C)(F)C2)C1 ZINC000840097949 586445637 /nfs/dbraw/zinc/44/56/37/586445637.db2.gz BFTKMINAKUXOKR-AAEUAGOBSA-N 1 2 242.338 2.026 20 0 BEADLO C[C@]1(F)CCC[N@H+](CN2CCSC2=S)C1 ZINC000840100995 586445776 /nfs/dbraw/zinc/44/57/76/586445776.db2.gz QSFWFASZJOTWNF-JTQLQIEISA-N 1 2 248.392 2.102 20 0 BEADLO C[C@]1(F)CCC[N@@H+](CN2CCSC2=S)C1 ZINC000840100995 586445777 /nfs/dbraw/zinc/44/57/77/586445777.db2.gz QSFWFASZJOTWNF-JTQLQIEISA-N 1 2 248.392 2.102 20 0 BEADLO CCOc1cc[nH+]c(C2=CCOCC2)c1 ZINC000757571049 586462364 /nfs/dbraw/zinc/46/23/64/586462364.db2.gz IVCHPZNSZDAFNM-UHFFFAOYSA-N 1 2 205.257 2.284 20 0 BEADLO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1cn(C)cn1 ZINC000808444764 586472955 /nfs/dbraw/zinc/47/29/55/586472955.db2.gz PQHHETLTHAMJHH-HZMBPMFUSA-N 1 2 243.310 2.032 20 0 BEADLO CSc1ccc(C[NH2+]Cc2nonc2C)cc1 ZINC000809743726 586516133 /nfs/dbraw/zinc/51/61/33/586516133.db2.gz BILKNRJCMZKNGZ-UHFFFAOYSA-N 1 2 249.339 2.390 20 0 BEADLO Cc1nonc1C[NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000809744255 586516565 /nfs/dbraw/zinc/51/65/65/586516565.db2.gz CSRVVAHQKADBLN-KWQFWETISA-N 1 2 247.298 2.384 20 0 BEADLO CC1(C[NH+]2CC(O)(c3ccc(F)cc3)C2)CC1 ZINC000811503442 586559991 /nfs/dbraw/zinc/55/99/91/586559991.db2.gz MYDCRIBNGPJCFS-UHFFFAOYSA-N 1 2 235.302 2.129 20 0 BEADLO O=C(NC1=[NH+]CCS1)[C@H]1CC2CCC1CC2 ZINC000814255854 586620712 /nfs/dbraw/zinc/62/07/12/586620712.db2.gz BMWFBVQSMPBGES-RTBKNWGFSA-N 1 2 238.356 2.032 20 0 BEADLO NC(COc1ccc(F)cc1)=[NH+]OC1CCC1 ZINC000814265493 586620907 /nfs/dbraw/zinc/62/09/07/586620907.db2.gz TWXXTCVRTPLTKO-UHFFFAOYSA-N 1 2 238.262 2.255 20 0 BEADLO C[C@]1(C(=O)OCCCn2cc[nH+]c2)C[C@H]2C[C@H]2C1 ZINC000815366212 586680986 /nfs/dbraw/zinc/68/09/86/586680986.db2.gz STZBDHNVNLXNQW-IMRBUKKESA-N 1 2 248.326 2.253 20 0 BEADLO Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1ncn(C)n1 ZINC000815599901 586688748 /nfs/dbraw/zinc/68/87/48/586688748.db2.gz FQMZDZMDINTOIY-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO Cc1cc(C[N@H+](C)CCF)cnc1Cl ZINC000816640235 586746211 /nfs/dbraw/zinc/74/62/11/586746211.db2.gz ZUDHJYDGPIVWJU-UHFFFAOYSA-N 1 2 216.687 2.445 20 0 BEADLO Cc1cc(C[N@@H+](C)CCF)cnc1Cl ZINC000816640235 586746214 /nfs/dbraw/zinc/74/62/14/586746214.db2.gz ZUDHJYDGPIVWJU-UHFFFAOYSA-N 1 2 216.687 2.445 20 0 BEADLO C[C@H]1C[N@H+](Cc2coc(C3CC3)n2)[C@H]1C ZINC000816648141 586750727 /nfs/dbraw/zinc/75/07/27/586750727.db2.gz FVHUZTWQXBTQMR-IUCAKERBSA-N 1 2 206.289 2.392 20 0 BEADLO C[C@H]1C[N@@H+](Cc2coc(C3CC3)n2)[C@H]1C ZINC000816648141 586750730 /nfs/dbraw/zinc/75/07/30/586750730.db2.gz FVHUZTWQXBTQMR-IUCAKERBSA-N 1 2 206.289 2.392 20 0 BEADLO C[C@@H]1CC/C(=C\C(=O)N2CCc3[nH]c[nH+]c3C2)C1 ZINC000816651350 586752718 /nfs/dbraw/zinc/75/27/18/586752718.db2.gz DFAHASBXLQJSPO-UEUZTHOGSA-N 1 2 245.326 2.041 20 0 BEADLO C[C@@H]1CC/C(=C\C(=O)N2CCc3[nH+]c[nH]c3C2)C1 ZINC000816651350 586752720 /nfs/dbraw/zinc/75/27/20/586752720.db2.gz DFAHASBXLQJSPO-UEUZTHOGSA-N 1 2 245.326 2.041 20 0 BEADLO CC(C)CCC[C@H](C)NC(=O)Cc1[nH]cc[nH+]1 ZINC000816839755 586767879 /nfs/dbraw/zinc/76/78/79/586767879.db2.gz OWMOGEPTRBSJQM-NSHDSACASA-N 1 2 237.347 2.283 20 0 BEADLO Cc1ccc(F)c(NC(=O)Cc2[nH]cc[nH+]2)c1 ZINC000816840152 586767939 /nfs/dbraw/zinc/76/79/39/586767939.db2.gz CRUXRYGPOFAKPT-UHFFFAOYSA-N 1 2 233.246 2.038 20 0 BEADLO C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)Cc1[nH]cc[nH+]1 ZINC000816926768 586771787 /nfs/dbraw/zinc/77/17/87/586771787.db2.gz GYUULNFJLNFCBC-IJLUTSLNSA-N 1 2 247.342 2.132 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)[C@H]2CC23CC3)c1 ZINC000817231654 586787472 /nfs/dbraw/zinc/78/74/72/586787472.db2.gz WIDORVOBCQVLHL-GFCCVEGCSA-N 1 2 247.294 2.242 20 0 BEADLO CC(C)CC(=O)CC[N@@H+]1CCO[C@H](CCF)C1 ZINC000859908311 589069763 /nfs/dbraw/zinc/06/97/63/589069763.db2.gz FYCRKVPIKGOWRF-CYBMUJFWSA-N 1 2 245.338 2.052 20 0 BEADLO CC(C)CC(=O)CC[N@H+]1CCO[C@H](CCF)C1 ZINC000859908311 589069764 /nfs/dbraw/zinc/06/97/64/589069764.db2.gz FYCRKVPIKGOWRF-CYBMUJFWSA-N 1 2 245.338 2.052 20 0 BEADLO CC(C)C1(NC(=O)c2cccc3[nH+]ccn32)CC1 ZINC000818359354 586889303 /nfs/dbraw/zinc/88/93/03/586889303.db2.gz JLGXRIIIIWFJTH-UHFFFAOYSA-N 1 2 243.310 2.253 20 0 BEADLO Cc1cc(NCC2(O)CCC2)ccc1[NH+](C)C ZINC000819407798 586961718 /nfs/dbraw/zinc/96/17/18/586961718.db2.gz BSRVOFKZGPKMTM-UHFFFAOYSA-N 1 2 234.343 2.388 20 0 BEADLO CCC(CC)C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819763933 586990883 /nfs/dbraw/zinc/99/08/83/586990883.db2.gz IUFBPTGLQZGEEU-SSDOTTSWSA-N 1 2 214.334 2.030 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)C[C@@H]2CCC[C@H]2C)S1 ZINC000819775810 586992404 /nfs/dbraw/zinc/99/24/04/586992404.db2.gz JNOWCEHMULUONU-BBBLOLIVSA-N 1 2 240.372 2.420 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)[C@@H]2CCCC2(C)C)S1 ZINC000819781191 586993825 /nfs/dbraw/zinc/99/38/25/586993825.db2.gz JIWWIGSCVFVMGE-BDAKNGLRSA-N 1 2 240.372 2.420 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)CCC1(C)CC1 ZINC000820421318 587047615 /nfs/dbraw/zinc/04/76/15/587047615.db2.gz MGJGFLOATMWFBY-UHFFFAOYSA-N 1 2 248.326 2.287 20 0 BEADLO CCc1c[nH]c(CC(=O)NC2C(C)(C)C2(C)C)[nH+]1 ZINC000820590139 587056704 /nfs/dbraw/zinc/05/67/04/587056704.db2.gz XHJNOGNAPIDFJF-UHFFFAOYSA-N 1 2 249.358 2.065 20 0 BEADLO Clc1ccc2c(n1)[C@@H]([NH2+]Cc1cc[nH]n1)CC2 ZINC000820810163 587074106 /nfs/dbraw/zinc/07/41/06/587074106.db2.gz QPTMPIHVIABZPA-JTQLQIEISA-N 1 2 248.717 2.235 20 0 BEADLO CCCCC1(C(=O)N[C@H]2CCn3cc[nH+]c32)CC1 ZINC000820948275 587083986 /nfs/dbraw/zinc/08/39/86/587083986.db2.gz QZQPATYJDMVHIY-NSHDSACASA-N 1 2 247.342 2.415 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@]1(C)C=CCC1 ZINC000821309347 587106535 /nfs/dbraw/zinc/10/65/35/587106535.db2.gz RUDQTTJBUAIGPS-SMDDNHRTSA-N 1 2 247.342 2.437 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)[C@H]1CCCC12CC2 ZINC000860173614 589086081 /nfs/dbraw/zinc/08/60/81/589086081.db2.gz FMMZMARAKJUMJQ-GFCCVEGCSA-N 1 2 248.326 2.397 20 0 BEADLO Cn1c[nH+]c(/C=C/C(=O)NC(C)(C)C2CCC2)c1 ZINC000821488863 587122461 /nfs/dbraw/zinc/12/24/61/587122461.db2.gz JSLANNWFJOGHLO-BQYQJAHWSA-N 1 2 247.342 2.128 20 0 BEADLO Nc1cc(COC(=O)[C@@H]2CCCC23CC3)cc[nH+]1 ZINC000860174028 589086453 /nfs/dbraw/zinc/08/64/53/589086453.db2.gz LJYSNMMUIUZPEA-NSHDSACASA-N 1 2 246.310 2.287 20 0 BEADLO CC[C@@H](C)C(=O)OCCc1cn2ccccc2[nH+]1 ZINC000821594193 587131594 /nfs/dbraw/zinc/13/15/94/587131594.db2.gz CGEDLLFLJKYPTO-LLVKDONJSA-N 1 2 246.310 2.466 20 0 BEADLO CN(C)c1[nH+]cccc1COC(=O)c1ccoc1 ZINC000821608119 587132269 /nfs/dbraw/zinc/13/22/69/587132269.db2.gz SMNZXHMOCGHOAB-UHFFFAOYSA-N 1 2 246.266 2.098 20 0 BEADLO CN(C)c1[nH+]cccc1COC(=O)C(C)(C)C ZINC000821608021 587132583 /nfs/dbraw/zinc/13/25/83/587132583.db2.gz PAJPIAYTMLDOMT-UHFFFAOYSA-N 1 2 236.315 2.237 20 0 BEADLO CCCCC(=O)OCc1ccc[nH+]c1N(C)C ZINC000821607972 587132596 /nfs/dbraw/zinc/13/25/96/587132596.db2.gz MWEPIEOSCKRHSE-UHFFFAOYSA-N 1 2 236.315 2.381 20 0 BEADLO CN(C)c1[nH+]cccc1COC(=O)C1CCCC1 ZINC000821608013 587132612 /nfs/dbraw/zinc/13/26/12/587132612.db2.gz OSOWGAAUYQMUSY-UHFFFAOYSA-N 1 2 248.326 2.381 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)C2(C)CC=CC2)c2[nH+]ccn21 ZINC000821787319 587137791 /nfs/dbraw/zinc/13/77/91/587137791.db2.gz SIKIPQXBJCHVES-WDEREUQCSA-N 1 2 245.326 2.361 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)[C@]2(C)C=CCC2)c2[nH+]ccn21 ZINC000821786948 587137906 /nfs/dbraw/zinc/13/79/06/587137906.db2.gz PJNURRMEIMXTRH-UHIISALHSA-N 1 2 245.326 2.361 20 0 BEADLO CC[C@H]1CCCC[C@@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000821830658 587141479 /nfs/dbraw/zinc/14/14/79/587141479.db2.gz NWNGJPAAERFDLV-QWRGUYRKSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H](NC(=O)/C=C/c1cn(C)c[nH+]1)C1CCCC1 ZINC000821980255 587148733 /nfs/dbraw/zinc/14/87/33/587148733.db2.gz MAZDKCAPZKXQIK-WSKFYRRCSA-N 1 2 247.342 2.128 20 0 BEADLO CCC[C@H]1CCC[C@@H]1C(=O)NC1=[NH+]CCS1 ZINC000822234363 587158917 /nfs/dbraw/zinc/15/89/17/587158917.db2.gz PVQPDHMFTCYTAN-UWVGGRQHSA-N 1 2 240.372 2.422 20 0 BEADLO O=C([C@@H]1C[C@H]1c1c[nH+]c[nH]1)N1CCCC12CCC2 ZINC000822473567 587170626 /nfs/dbraw/zinc/17/06/26/587170626.db2.gz ZZUOICCURAUDDJ-GHMZBOCLSA-N 1 2 245.326 2.058 20 0 BEADLO O=C([C@@H]1C[C@H]1c1c[nH]c[nH+]1)N1CCCC12CCC2 ZINC000822473567 587170628 /nfs/dbraw/zinc/17/06/28/587170628.db2.gz ZZUOICCURAUDDJ-GHMZBOCLSA-N 1 2 245.326 2.058 20 0 BEADLO CC/C(C)=C/C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000823088245 587201887 /nfs/dbraw/zinc/20/18/87/587201887.db2.gz KQHZYSWPXHQHLY-CNELAYHGSA-N 1 2 247.342 2.403 20 0 BEADLO CC/C(C)=C\C(=O)NCCCCn1cc[nH+]c1 ZINC000823310035 587215396 /nfs/dbraw/zinc/21/53/96/587215396.db2.gz GTADSADJTBNVOA-BENRWUELSA-N 1 2 235.331 2.136 20 0 BEADLO Fc1c(C[N@@H+]2CCCOCC2)ccnc1Cl ZINC000823414572 587220838 /nfs/dbraw/zinc/22/08/38/587220838.db2.gz VCHJCRXCNNUSNB-UHFFFAOYSA-N 1 2 244.697 2.096 20 0 BEADLO Fc1c(C[N@H+]2CCCOCC2)ccnc1Cl ZINC000823414572 587220839 /nfs/dbraw/zinc/22/08/39/587220839.db2.gz VCHJCRXCNNUSNB-UHFFFAOYSA-N 1 2 244.697 2.096 20 0 BEADLO CC[C@H](CC(C)C)C(=O)NC1=[NH+]CCS1 ZINC000823671934 587235963 /nfs/dbraw/zinc/23/59/63/587235963.db2.gz XYQWUFSKZUWOQC-SECBINFHSA-N 1 2 228.361 2.278 20 0 BEADLO CCc1cc(C[NH2+]Cc2ncc(C)s2)[nH]n1 ZINC000823860802 587244337 /nfs/dbraw/zinc/24/43/37/587244337.db2.gz MLIMXRNGHLCKPS-UHFFFAOYSA-N 1 2 236.344 2.027 20 0 BEADLO CCC[C@@H](CC)C(=O)N[C@@H]1CCn2c[nH+]cc2C1 ZINC000824046123 587251369 /nfs/dbraw/zinc/25/13/69/587251369.db2.gz JDAANBUPZXNNAH-VXGBXAGGSA-N 1 2 249.358 2.140 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1ccnc(Cl)c1F ZINC000824434880 587270435 /nfs/dbraw/zinc/27/04/35/587270435.db2.gz TYEXNVMPMUATHY-VIFPVBQESA-N 1 2 244.697 2.095 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1ccnc(Cl)c1F ZINC000824434880 587270434 /nfs/dbraw/zinc/27/04/34/587270434.db2.gz TYEXNVMPMUATHY-VIFPVBQESA-N 1 2 244.697 2.095 20 0 BEADLO C(c1nc2c(s1)CCC2)[NH+]1CC2(CC2)C1 ZINC000824533972 587274588 /nfs/dbraw/zinc/27/45/88/587274588.db2.gz VFYLLCCNJPBWAZ-UHFFFAOYSA-N 1 2 220.341 2.228 20 0 BEADLO CCC[C@H](CC)C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000824625727 587279964 /nfs/dbraw/zinc/27/99/64/587279964.db2.gz JLYVZZUWVMKWEU-MNOVXSKESA-N 1 2 237.347 2.424 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)C1(C)C(C)(C)C1(C)C ZINC000824629310 587280238 /nfs/dbraw/zinc/28/02/38/587280238.db2.gz SJZSDSCGRSGTCH-UHFFFAOYSA-N 1 2 249.358 2.440 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)C1(C)C(C)(C)C1(C)C ZINC000824629310 587280239 /nfs/dbraw/zinc/28/02/39/587280239.db2.gz SJZSDSCGRSGTCH-UHFFFAOYSA-N 1 2 249.358 2.440 20 0 BEADLO CCC(C)(C)[C@@H](C)NC(=O)/C=C/c1cn(C)c[nH+]1 ZINC000824840529 587289713 /nfs/dbraw/zinc/28/97/13/587289713.db2.gz AUNBIOFSWMOKCB-WSKFYRRCSA-N 1 2 249.358 2.374 20 0 BEADLO CCC(F)(F)C(=O)Nc1c[nH+]ccc1OC ZINC000824894976 587292074 /nfs/dbraw/zinc/29/20/74/587292074.db2.gz NITQVDDIVSZREB-UHFFFAOYSA-N 1 2 230.214 2.074 20 0 BEADLO CC[C@@H](NC(=O)Cc1[nH]cc[nH+]1)C1CCCCC1 ZINC000825240735 587310909 /nfs/dbraw/zinc/31/09/09/587310909.db2.gz IZZPYDCATWFWIT-GFCCVEGCSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@H](NC(=O)CCC1(C)CC1)c1[nH+]ccn1C ZINC000825545717 587324558 /nfs/dbraw/zinc/32/45/58/587324558.db2.gz XKQWDRLLHLVLED-JTQLQIEISA-N 1 2 235.331 2.178 20 0 BEADLO CC(C(=O)NCCCCn1cc[nH+]c1)=C1CCC1 ZINC000825891909 587344217 /nfs/dbraw/zinc/34/42/17/587344217.db2.gz XGEVOIVBCBDHSP-UHFFFAOYSA-N 1 2 247.342 2.280 20 0 BEADLO COC(=O)c1ccc(C[N@H+](C)CCF)cc1F ZINC000826013486 587348576 /nfs/dbraw/zinc/34/85/76/587348576.db2.gz VGZYXEAWELAMAR-UHFFFAOYSA-N 1 2 243.253 2.014 20 0 BEADLO COC(=O)c1ccc(C[N@@H+](C)CCF)cc1F ZINC000826013486 587348577 /nfs/dbraw/zinc/34/85/77/587348577.db2.gz VGZYXEAWELAMAR-UHFFFAOYSA-N 1 2 243.253 2.014 20 0 BEADLO C[C@]1(F)CCCN(Cc2c[nH+]c3n2CCC3)C1 ZINC000826029446 587348778 /nfs/dbraw/zinc/34/87/78/587348778.db2.gz FRJRIILWKAIEGI-ZDUSSCGKSA-N 1 2 237.322 2.153 20 0 BEADLO CC(C)(C)CCCCNC(=O)Cc1[nH]cc[nH+]1 ZINC000826135889 587351360 /nfs/dbraw/zinc/35/13/60/587351360.db2.gz VCDMAAXVFLLLOP-UHFFFAOYSA-N 1 2 237.347 2.285 20 0 BEADLO Cc1cc(NC(=O)CSC(F)F)c(C)c[nH+]1 ZINC000827166417 587371542 /nfs/dbraw/zinc/37/15/42/587371542.db2.gz OGZDYCYSZJYQBW-UHFFFAOYSA-N 1 2 246.282 2.015 20 0 BEADLO Cc1cc(C[NH2+][C@@H]2C[C@@H](O)c3ccccc32)no1 ZINC000827170361 587371781 /nfs/dbraw/zinc/37/17/81/587371781.db2.gz IDFSGBFELRIGSA-ZIAGYGMSSA-N 1 2 244.294 2.251 20 0 BEADLO CC/C(C)=C\C(=O)N(C)CCCn1cc[nH+]c1 ZINC000827256450 587374414 /nfs/dbraw/zinc/37/44/14/587374414.db2.gz YYYOAGQNXZPPLR-BENRWUELSA-N 1 2 235.331 2.088 20 0 BEADLO Cc1c[nH]c(CNC(=O)C[C@@H]2CC=CCC2)[nH+]1 ZINC000827582744 587390449 /nfs/dbraw/zinc/39/04/49/587390449.db2.gz WXSYZCOFRHYOAL-LLVKDONJSA-N 1 2 233.315 2.081 20 0 BEADLO CC[C@H](C)[C@H]1CCCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC000828276424 587430545 /nfs/dbraw/zinc/43/05/45/587430545.db2.gz KLVRWFZPNQUCHD-NWDGAFQWSA-N 1 2 249.358 2.379 20 0 BEADLO Cc1nc(N[C@H]2CCn3ccnc32)c(C)c(C)[nH+]1 ZINC000828358428 587438025 /nfs/dbraw/zinc/43/80/25/587438025.db2.gz QRSAGOYFMZSZJM-NSHDSACASA-N 1 2 243.314 2.155 20 0 BEADLO O=C(N[C@H]1CC12CCC2)c1cc2c[nH+]ccc2[nH]1 ZINC000828943593 587474141 /nfs/dbraw/zinc/47/41/41/587474141.db2.gz DFBGQCJOQOOPIS-LBPRGKRZSA-N 1 2 241.294 2.235 20 0 BEADLO C/C=C(\C)C(=O)N1CCc2[nH]c[nH+]c2C12CCC2 ZINC000829079131 587482519 /nfs/dbraw/zinc/48/25/19/587482519.db2.gz MDRZLMWFAAFPRC-XCVCLJGOSA-N 1 2 245.326 2.140 20 0 BEADLO CCC[C@H](C)CCNC(=O)/C=C/c1cn(C)c[nH+]1 ZINC000829165416 587485771 /nfs/dbraw/zinc/48/57/71/587485771.db2.gz QIIBFQWVLCOJMJ-SYTKJHMZSA-N 1 2 249.358 2.376 20 0 BEADLO O=C(c1cc2c[nH+]ccc2[nH]1)N1CCC(F)CC1 ZINC000829205731 587488084 /nfs/dbraw/zinc/48/80/84/587488084.db2.gz LQPFYJSSMMEVPS-UHFFFAOYSA-N 1 2 247.273 2.137 20 0 BEADLO CC[C@@H](NC(=O)C(C)=C1CCC1)c1[nH]cc[nH+]1 ZINC000829542345 587502751 /nfs/dbraw/zinc/50/27/51/587502751.db2.gz MVHXLQZTFCCDOI-LLVKDONJSA-N 1 2 233.315 2.477 20 0 BEADLO CC[C@H](NC(=O)C(C)=C1CCC1)c1[nH]cc[nH+]1 ZINC000829542347 587503033 /nfs/dbraw/zinc/50/30/33/587503033.db2.gz MVHXLQZTFCCDOI-NSHDSACASA-N 1 2 233.315 2.477 20 0 BEADLO Cn1c[nH+]c(/C=C/C(=O)NC2CCC=CCC2)c1 ZINC000829782436 587515698 /nfs/dbraw/zinc/51/56/98/587515698.db2.gz GXTRCDQTHGUXPD-CMDGGOBGSA-N 1 2 245.326 2.048 20 0 BEADLO C[C@]1([NH2+]C[C@@H]2CCCCC2(F)F)CCOC1=O ZINC000829962842 587528638 /nfs/dbraw/zinc/52/86/38/587528638.db2.gz UULAUIQTRRHCOX-ONGXEEELSA-N 1 2 247.285 2.107 20 0 BEADLO CC1(C)CCCC[C@@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000830010726 587532143 /nfs/dbraw/zinc/53/21/43/587532143.db2.gz ZQVUDINBHBVNNH-JTQLQIEISA-N 1 2 235.331 2.037 20 0 BEADLO Cn1c[nH+]c(CNc2ccccc2OCCF)c1 ZINC000830445183 587551641 /nfs/dbraw/zinc/55/16/41/587551641.db2.gz HVNYHXOGSHOIEB-UHFFFAOYSA-N 1 2 249.289 2.381 20 0 BEADLO O[C@@H](C[N@@H+]1CC[C@H](F)C1)c1ccc(F)c(F)c1 ZINC000830467363 587552384 /nfs/dbraw/zinc/55/23/84/587552384.db2.gz KIAQXVVULFAHQW-CABZTGNLSA-N 1 2 245.244 2.042 20 0 BEADLO O[C@@H](C[N@H+]1CC[C@H](F)C1)c1ccc(F)c(F)c1 ZINC000830467363 587552385 /nfs/dbraw/zinc/55/23/85/587552385.db2.gz KIAQXVVULFAHQW-CABZTGNLSA-N 1 2 245.244 2.042 20 0 BEADLO C[C@@H](CC(=O)NCCC1CC=CC1)n1cc[nH+]c1 ZINC000831423469 587605762 /nfs/dbraw/zinc/60/57/62/587605762.db2.gz RAVCKUCOBLOBMQ-LBPRGKRZSA-N 1 2 247.342 2.307 20 0 BEADLO CO[C@H]1CC[N@H+](CC(F)(F)C(F)F)C[C@H]1C ZINC000831528339 587616695 /nfs/dbraw/zinc/61/66/95/587616695.db2.gz NTLYEALVAGHAIA-SFYZADRCSA-N 1 2 243.244 2.244 20 0 BEADLO CO[C@H]1CC[N@@H+](CC(F)(F)C(F)F)C[C@H]1C ZINC000831528339 587616697 /nfs/dbraw/zinc/61/66/97/587616697.db2.gz NTLYEALVAGHAIA-SFYZADRCSA-N 1 2 243.244 2.244 20 0 BEADLO CCO[C@@H]1CCC[C@H]1[NH2+]CC(F)(F)C(F)F ZINC000832570916 587667124 /nfs/dbraw/zinc/66/71/24/587667124.db2.gz VEJXHTGUMUKIQA-HTQZYQBOSA-N 1 2 243.244 2.434 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)Cc2[nH]cc[nH+]2)CC1 ZINC000832760823 587685616 /nfs/dbraw/zinc/68/56/16/587685616.db2.gz VIGYIPVTGGIRGT-MNOVXSKESA-N 1 2 235.331 2.037 20 0 BEADLO O=C(OC1CCCCC1)N1CC(n2cc[nH+]c2)C1 ZINC000867080868 587694001 /nfs/dbraw/zinc/69/40/01/587694001.db2.gz FSNBBSSTHYADKZ-UHFFFAOYSA-N 1 2 249.314 2.209 20 0 BEADLO CC(C)C(C)(C)C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833278188 587703266 /nfs/dbraw/zinc/70/32/66/587703266.db2.gz OVYZKRDMNZJBMA-JTQLQIEISA-N 1 2 235.331 2.126 20 0 BEADLO CC(C)C[C@@H](C)C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833278035 587703535 /nfs/dbraw/zinc/70/35/35/587703535.db2.gz LZTZEPKSCASIME-MNOVXSKESA-N 1 2 235.331 2.126 20 0 BEADLO CC[C@@H](C)CCC(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833271634 587703762 /nfs/dbraw/zinc/70/37/62/587703762.db2.gz IMUXTZYRAMKXCK-GHMZBOCLSA-N 1 2 235.331 2.270 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833272546 587703956 /nfs/dbraw/zinc/70/39/56/587703956.db2.gz PIUKWPCXEGEVHC-WOPDTQHZSA-N 1 2 247.342 2.270 20 0 BEADLO CC1(CC(=O)N[C@H]2CCn3cc[nH+]c32)CCCC1 ZINC000833272542 587703962 /nfs/dbraw/zinc/70/39/62/587703962.db2.gz PHWGITZVDLRWMI-NSHDSACASA-N 1 2 247.342 2.415 20 0 BEADLO O=C(N[C@@H]1CCn2cc[nH+]c21)[C@@H]1CC12CCCC2 ZINC000833284495 587704561 /nfs/dbraw/zinc/70/45/61/587704561.db2.gz JKMRQYRIZIKBFE-WDEREUQCSA-N 1 2 245.326 2.024 20 0 BEADLO C[C@@H]1CC[C@@H](CC(=O)N[C@H]2CCn3cc[nH+]c32)C1 ZINC000833283223 587704730 /nfs/dbraw/zinc/70/47/30/587704730.db2.gz ASOXLRSIBUSKEP-UTUOFQBUSA-N 1 2 247.342 2.270 20 0 BEADLO O=C(CCC1CCCC1)N[C@H]1CCn2cc[nH+]c21 ZINC000833304801 587705430 /nfs/dbraw/zinc/70/54/30/587705430.db2.gz IJOMITUKPCMMTH-LBPRGKRZSA-N 1 2 247.342 2.415 20 0 BEADLO C=CC(=O)N1CCCC[C@H]1c1c[nH+]cn1CC ZINC000834395116 587754191 /nfs/dbraw/zinc/75/41/91/587754191.db2.gz MAJIVHNXTZFIKE-NSHDSACASA-N 1 2 233.315 2.143 20 0 BEADLO CCC(F)(F)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000834836404 587768506 /nfs/dbraw/zinc/76/85/06/587768506.db2.gz MJZVIXSBXCSRDI-UHFFFAOYSA-N 1 2 239.225 2.318 20 0 BEADLO C[C@H]1CC=C(C(=O)OCCn2cc[nH+]c2)CC1 ZINC000835349381 587797876 /nfs/dbraw/zinc/79/78/76/587797876.db2.gz GNNVXAOGOWGHTR-NSHDSACASA-N 1 2 234.299 2.173 20 0 BEADLO CCn1c(C)nn(C[N@H+](C)CC2CC2)c1=S ZINC000102390692 587829610 /nfs/dbraw/zinc/82/96/10/587829610.db2.gz ILLBWQTXPBFPJD-UHFFFAOYSA-N 1 2 240.376 2.042 20 0 BEADLO CCn1c(C)nn(C[N@@H+](C)CC2CC2)c1=S ZINC000102390692 587829611 /nfs/dbraw/zinc/82/96/11/587829611.db2.gz ILLBWQTXPBFPJD-UHFFFAOYSA-N 1 2 240.376 2.042 20 0 BEADLO C[C@H](CC(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21)C1CC1 ZINC000836954571 587843416 /nfs/dbraw/zinc/84/34/16/587843416.db2.gz LYPXJPYEQYPAGC-FOGDFJRCSA-N 1 2 247.342 2.441 20 0 BEADLO C[C@H](CC(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21)C1CC1 ZINC000836954572 587843627 /nfs/dbraw/zinc/84/36/27/587843627.db2.gz LYPXJPYEQYPAGC-JFGNBEQYSA-N 1 2 247.342 2.441 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)C=C1CCC1 ZINC000836949710 587843726 /nfs/dbraw/zinc/84/37/26/587843726.db2.gz MMBYXPDLBGFNTH-SNVBAGLBSA-N 1 2 233.315 2.191 20 0 BEADLO CC(C)=C(C)C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000836953716 587843731 /nfs/dbraw/zinc/84/37/31/587843731.db2.gz HEOIMDJXANFQDE-MWLCHTKSSA-N 1 2 233.315 2.361 20 0 BEADLO CC/C=C(\C)C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000836953678 587843814 /nfs/dbraw/zinc/84/38/14/587843814.db2.gz GWXGOBMAVZWVIE-WJHWTWHCSA-N 1 2 233.315 2.361 20 0 BEADLO CC(C)=C(C)C(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000836953715 587843823 /nfs/dbraw/zinc/84/38/23/587843823.db2.gz HEOIMDJXANFQDE-KOLCDFICSA-N 1 2 233.315 2.361 20 0 BEADLO CS/C=C\C(=O)NCc1c[nH+]c(C)cc1C ZINC000837105225 587854386 /nfs/dbraw/zinc/85/43/86/587854386.db2.gz RUZUFOKVNRLNMN-PLNGDYQASA-N 1 2 236.340 2.191 20 0 BEADLO CC(C)CCCCC(=O)NC1=[NH+]CCS1 ZINC000837317862 587865951 /nfs/dbraw/zinc/86/59/51/587865951.db2.gz WYNUKSWRHZCFRP-UHFFFAOYSA-N 1 2 228.361 2.422 20 0 BEADLO C/C(=C/C(C)(C)C)C(=O)NCCc1cn(C)c[nH+]1 ZINC000837717637 587892383 /nfs/dbraw/zinc/89/23/83/587892383.db2.gz HVHCZZCOGGSUSU-FLIBITNWSA-N 1 2 249.358 2.071 20 0 BEADLO Cc1cc(C[NH2+]Cc2c(C)cccc2F)nn1C ZINC000840903388 587929007 /nfs/dbraw/zinc/92/90/07/587929007.db2.gz BYFRELVLDBYMBK-UHFFFAOYSA-N 1 2 247.317 2.466 20 0 BEADLO CCc1nc(C[NH2+]Cc2ccoc2C)co1 ZINC000840951350 587931596 /nfs/dbraw/zinc/93/15/96/587931596.db2.gz WOLKFICZGXKNSI-UHFFFAOYSA-N 1 2 220.272 2.428 20 0 BEADLO O=C(OCCCF)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000841510608 587957124 /nfs/dbraw/zinc/95/71/24/587957124.db2.gz HGXGEVNEEWVNOD-VIFPVBQESA-N 1 2 241.266 2.043 20 0 BEADLO Cc1ccc(CO[NH+]=C(N)[C@@H]2CCCO2)c(C)c1 ZINC000842047472 587992978 /nfs/dbraw/zinc/99/29/78/587992978.db2.gz OMJCCXLAXJNPKF-ZDUSSCGKSA-N 1 2 248.326 2.481 20 0 BEADLO C/C=C(\C)C(=O)OCC1CN(c2cccc[nH+]2)C1 ZINC000842889307 588071061 /nfs/dbraw/zinc/07/10/61/588071061.db2.gz YKLCHDSDHYDGNO-QDEBKDIKSA-N 1 2 246.310 2.027 20 0 BEADLO CC[NH2+]Cc1noc([C@H](C)c2cccs2)n1 ZINC000843145026 588083278 /nfs/dbraw/zinc/08/32/78/588083278.db2.gz RVHOXMFFQPMQPJ-MRVPVSSYSA-N 1 2 237.328 2.392 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2CC23CCCC3)n1 ZINC000843144635 588085930 /nfs/dbraw/zinc/08/59/30/588085930.db2.gz FKUQNIYQFALTLT-VIFPVBQESA-N 1 2 221.304 2.227 20 0 BEADLO CC[NH2+]Cc1noc(/C=C/c2ccc(C)nc2)n1 ZINC000843140776 588086245 /nfs/dbraw/zinc/08/62/45/588086245.db2.gz DCWCIVGZQCSTJY-VOTSOKGWSA-N 1 2 244.298 2.053 20 0 BEADLO O=C(/C=C\C1CCCC1)N[C@H]1CCn2cc[nH+]c21 ZINC000843600368 588128171 /nfs/dbraw/zinc/12/81/71/588128171.db2.gz BZBMUIITZGJIHF-FJOGCWAESA-N 1 2 245.326 2.191 20 0 BEADLO C[C@H]1Cc2cc(-c3c[nH+]cn3C)ccc2O1 ZINC000844227591 588174593 /nfs/dbraw/zinc/17/45/93/588174593.db2.gz PHNVTYCPQDXTNZ-VIFPVBQESA-N 1 2 214.268 2.411 20 0 BEADLO CCCC(C)(C)C(=O)NC1=[NH+]CCS1 ZINC000844318228 588184017 /nfs/dbraw/zinc/18/40/17/588184017.db2.gz UPGNHXQGGGZBJA-UHFFFAOYSA-N 1 2 214.334 2.032 20 0 BEADLO C[C@H]1CC[C@H](C(=O)NC2=[NH+]CCS2)CC1 ZINC000844316709 588184476 /nfs/dbraw/zinc/18/44/76/588184476.db2.gz OFKWKLANVQEDFJ-KYZUINATSA-N 1 2 226.345 2.032 20 0 BEADLO CC[C@@H]1C[N@H+](C/C=C\Cl)[C@H](C)CO1 ZINC000844390469 588188643 /nfs/dbraw/zinc/18/86/43/588188643.db2.gz XOZPSIWHBRHXFT-BYIQDMNASA-N 1 2 203.713 2.238 20 0 BEADLO CC[C@@H]1C[N@@H+](C/C=C\Cl)[C@H](C)CO1 ZINC000844390469 588188644 /nfs/dbraw/zinc/18/86/44/588188644.db2.gz XOZPSIWHBRHXFT-BYIQDMNASA-N 1 2 203.713 2.238 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@@H+]1Cc1nccc(C)n1 ZINC000844388362 588188859 /nfs/dbraw/zinc/18/88/59/588188859.db2.gz XWNQYJQKBYRPIR-GFCCVEGCSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@H+]1Cc1nccc(C)n1 ZINC000844388362 588188860 /nfs/dbraw/zinc/18/88/60/588188860.db2.gz XWNQYJQKBYRPIR-GFCCVEGCSA-N 1 2 249.358 2.174 20 0 BEADLO COC/C(C)=C/C(=O)Nc1ccc(C)[nH+]c1C ZINC000844421616 588191746 /nfs/dbraw/zinc/19/17/46/588191746.db2.gz GPFSMIZOCWUZFV-VQHVLOKHSA-N 1 2 234.299 2.230 20 0 BEADLO C[C@@H](NC(=O)C[C@H](C)n1cc[nH+]c1)c1ccc[nH]1 ZINC000844453900 588195965 /nfs/dbraw/zinc/19/59/65/588195965.db2.gz IMEFSMACTRICLK-WDEREUQCSA-N 1 2 246.314 2.040 20 0 BEADLO C[C@@H](CC(=O)NC12CCC(CC1)C2)n1cc[nH+]c1 ZINC000844475291 588198471 /nfs/dbraw/zinc/19/84/71/588198471.db2.gz ZVVRGGPTBZOUBT-DCBWTQNWSA-N 1 2 247.342 2.283 20 0 BEADLO C[C@@H](CC(=O)Nc1cccc(F)n1)n1cc[nH+]c1 ZINC000844484252 588198963 /nfs/dbraw/zinc/19/89/63/588198963.db2.gz YSEABAYYQVEHMA-VIFPVBQESA-N 1 2 248.261 2.007 20 0 BEADLO C[C@H]1CC[C@H](C(=O)N[C@@H]2CCn3cc[nH+]c32)CC1 ZINC000844553718 588202004 /nfs/dbraw/zinc/20/20/04/588202004.db2.gz WFFPAEQZDIPDKO-IJLUTSLNSA-N 1 2 247.342 2.270 20 0 BEADLO CC[NH2+]Cc1noc([C@H]2CC[C@H](C)CC2)n1 ZINC000844906547 588218938 /nfs/dbraw/zinc/21/89/38/588218938.db2.gz QUVJRWSJLNZDAS-MGCOHNPYSA-N 1 2 223.320 2.473 20 0 BEADLO C[C@H](CC(=O)OCC1CCC1)n1cc[nH+]c1 ZINC000845280767 588225498 /nfs/dbraw/zinc/22/54/98/588225498.db2.gz DQLXYEUWPSXGET-SNVBAGLBSA-N 1 2 222.288 2.178 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@H]1C[C@H]1C1CCCC1 ZINC000845479531 588229932 /nfs/dbraw/zinc/22/99/32/588229932.db2.gz POBVPBOEIQSIEY-STQMWFEESA-N 1 2 248.326 2.290 20 0 BEADLO CC(C)[C@@H](C)OC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000845497120 588230895 /nfs/dbraw/zinc/23/08/95/588230895.db2.gz YMXIZAVFTMYKEM-GHMZBOCLSA-N 1 2 224.304 2.422 20 0 BEADLO C[C@@H](CC(=O)O[C@@H]1C=CCC1)n1cc[nH+]c1 ZINC000845508466 588231302 /nfs/dbraw/zinc/23/13/02/588231302.db2.gz HIOKWFMDQRFIBK-WDEREUQCSA-N 1 2 220.272 2.096 20 0 BEADLO O=C(Cc1cn2c([nH+]1)CCCC2)O[C@H]1C=CCC1 ZINC000845508917 588231378 /nfs/dbraw/zinc/23/13/78/588231378.db2.gz LELABJOVBICOQQ-LBPRGKRZSA-N 1 2 246.310 2.024 20 0 BEADLO C[C@@H](CC(=O)OC[C@H]1CC1(F)F)n1cc[nH+]c1 ZINC000845581165 588233779 /nfs/dbraw/zinc/23/37/79/588233779.db2.gz FOLHCXKSQUSUEV-DTWKUNHWSA-N 1 2 244.241 2.033 20 0 BEADLO Fc1cc(C[N@@H+]2C[C@H]3[C@@H](C2)C3(F)F)c(F)cn1 ZINC000846113499 588257502 /nfs/dbraw/zinc/25/75/02/588257502.db2.gz MBJBDYPSOLOGTF-OCAPTIKFSA-N 1 2 246.207 2.057 20 0 BEADLO Fc1cc(C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)c(F)cn1 ZINC000846113499 588257503 /nfs/dbraw/zinc/25/75/03/588257503.db2.gz MBJBDYPSOLOGTF-OCAPTIKFSA-N 1 2 246.207 2.057 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2CC[C@H]2C)c1 ZINC000846117247 588257689 /nfs/dbraw/zinc/25/76/89/588257689.db2.gz LGJUZGATJSGCGG-MWLCHTKSSA-N 1 2 206.289 2.438 20 0 BEADLO CN(C)c1ccc(C[N@@H+]2CCC[C@@H](F)C2)cn1 ZINC000846120340 588258052 /nfs/dbraw/zinc/25/80/52/588258052.db2.gz OJCZAMKIOVYMBQ-GFCCVEGCSA-N 1 2 237.322 2.082 20 0 BEADLO CN(C)c1ccc(C[N@H+]2CCC[C@@H](F)C2)cn1 ZINC000846120340 588258053 /nfs/dbraw/zinc/25/80/53/588258053.db2.gz OJCZAMKIOVYMBQ-GFCCVEGCSA-N 1 2 237.322 2.082 20 0 BEADLO CC(C)=C(C)C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000846244697 588262658 /nfs/dbraw/zinc/26/26/58/588262658.db2.gz NHLOIHRPRFDXPF-UHFFFAOYSA-N 1 2 221.304 2.117 20 0 BEADLO Cn1c[nH+]cc1CNc1cncc(C(F)F)c1 ZINC000846750600 588285258 /nfs/dbraw/zinc/28/52/58/588285258.db2.gz WWRHOZDCKZWDAF-UHFFFAOYSA-N 1 2 238.241 2.365 20 0 BEADLO c1nsnc1C[NH+]1C2CCCC1CCC2 ZINC000846805097 588289493 /nfs/dbraw/zinc/28/94/93/588289493.db2.gz CJUSQNVEHHJMOG-UHFFFAOYSA-N 1 2 223.345 2.445 20 0 BEADLO C[N@H+](CCc1cccs1)Cc1cnsn1 ZINC000846808823 588290123 /nfs/dbraw/zinc/29/01/23/588290123.db2.gz JXEHPQXBVPZZGC-UHFFFAOYSA-N 1 2 239.369 2.274 20 0 BEADLO C[N@@H+](CCc1cccs1)Cc1cnsn1 ZINC000846808823 588290124 /nfs/dbraw/zinc/29/01/24/588290124.db2.gz JXEHPQXBVPZZGC-UHFFFAOYSA-N 1 2 239.369 2.274 20 0 BEADLO CSCC[C@H](C)[N@H+](C)Cc1cnsn1 ZINC000846825372 588291206 /nfs/dbraw/zinc/29/12/06/588291206.db2.gz JKPQSJGGLBSKSJ-QMMMGPOBSA-N 1 2 231.390 2.112 20 0 BEADLO CSCC[C@H](C)[N@@H+](C)Cc1cnsn1 ZINC000846825372 588291207 /nfs/dbraw/zinc/29/12/07/588291207.db2.gz JKPQSJGGLBSKSJ-QMMMGPOBSA-N 1 2 231.390 2.112 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cnsn2)C[C@H]1C ZINC000846841470 588292155 /nfs/dbraw/zinc/29/21/55/588292155.db2.gz OEVYOQSYDYFSKQ-RKDXNWHRSA-N 1 2 211.334 2.016 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cnsn2)C[C@H]1C ZINC000846841470 588292156 /nfs/dbraw/zinc/29/21/56/588292156.db2.gz OEVYOQSYDYFSKQ-RKDXNWHRSA-N 1 2 211.334 2.016 20 0 BEADLO CC(C)[C@H]1CCC[N@H+](Cc2cnsn2)C1 ZINC000846868428 588294485 /nfs/dbraw/zinc/29/44/85/588294485.db2.gz OYLDDVMJHQNDRL-JTQLQIEISA-N 1 2 225.361 2.406 20 0 BEADLO CC(C)[C@H]1CCC[N@@H+](Cc2cnsn2)C1 ZINC000846868428 588294486 /nfs/dbraw/zinc/29/44/86/588294486.db2.gz OYLDDVMJHQNDRL-JTQLQIEISA-N 1 2 225.361 2.406 20 0 BEADLO CC[N@H+](Cc1cnsn1)CC(C)(C)C ZINC000846915598 588296615 /nfs/dbraw/zinc/29/66/15/588296615.db2.gz XBOSAYOZIHSEGX-UHFFFAOYSA-N 1 2 213.350 2.406 20 0 BEADLO CC[N@@H+](Cc1cnsn1)CC(C)(C)C ZINC000846915598 588296616 /nfs/dbraw/zinc/29/66/16/588296616.db2.gz XBOSAYOZIHSEGX-UHFFFAOYSA-N 1 2 213.350 2.406 20 0 BEADLO c1nsnc1C[NH+](C1CCC1)C1CCC1 ZINC000846918224 588296933 /nfs/dbraw/zinc/29/69/33/588296933.db2.gz IZYGPJMDEHJIPS-UHFFFAOYSA-N 1 2 223.345 2.445 20 0 BEADLO CCCOC(=O)[C@H](C)[NH2+][C@H]1CCC1(C)C ZINC000846959466 588298615 /nfs/dbraw/zinc/29/86/15/588298615.db2.gz IRVMPSMNISCPDK-UWVGGRQHSA-N 1 2 213.321 2.106 20 0 BEADLO CCCOC(=O)[C@@H](C)[NH2+][C@@H]1CCC1(C)C ZINC000846959464 588298697 /nfs/dbraw/zinc/29/86/97/588298697.db2.gz IRVMPSMNISCPDK-NXEZZACHSA-N 1 2 213.321 2.106 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCC(=O)CC23CCC3)o1 ZINC000846995828 588300994 /nfs/dbraw/zinc/30/09/94/588300994.db2.gz HGCHLNORBFJHML-UHFFFAOYSA-N 1 2 248.326 2.379 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCC(=O)CC23CCC3)o1 ZINC000846995828 588300995 /nfs/dbraw/zinc/30/09/95/588300995.db2.gz HGCHLNORBFJHML-UHFFFAOYSA-N 1 2 248.326 2.379 20 0 BEADLO C[C@@H]1CC(C)(C)C[N@@H+]1Cc1cnsn1 ZINC000846996901 588301125 /nfs/dbraw/zinc/30/11/25/588301125.db2.gz RSBVRKASLLWQIZ-MRVPVSSYSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]1CC(C)(C)C[N@H+]1Cc1cnsn1 ZINC000846996901 588301126 /nfs/dbraw/zinc/30/11/26/588301126.db2.gz RSBVRKASLLWQIZ-MRVPVSSYSA-N 1 2 211.334 2.159 20 0 BEADLO CCCCOC(=O)C(C)(C)[NH2+]CCCF ZINC000847062306 588305469 /nfs/dbraw/zinc/30/54/69/588305469.db2.gz QETUZZGSOFOAKC-UHFFFAOYSA-N 1 2 219.300 2.058 20 0 BEADLO CCCCOC(=O)C(C)(C)[NH2+]CCSCC ZINC000847058869 588305541 /nfs/dbraw/zinc/30/55/41/588305541.db2.gz VDYONYZOMZRIBL-UHFFFAOYSA-N 1 2 247.404 2.451 20 0 BEADLO Cc1nc(CC(=O)Nc2cc[nH+]cc2C)cs1 ZINC000107287782 588346181 /nfs/dbraw/zinc/34/61/81/588346181.db2.gz IKOPZLOZQHFKJQ-UHFFFAOYSA-N 1 2 247.323 2.336 20 0 BEADLO CC(C)c1ocnc1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000848387211 588375726 /nfs/dbraw/zinc/37/57/26/588375726.db2.gz OGPQEJHJOLIYGX-MRVPVSSYSA-N 1 2 248.286 2.012 20 0 BEADLO CC[C@H]([NH2+]Cc1cnc(Cl)n1C)C(F)F ZINC000848552749 588393391 /nfs/dbraw/zinc/39/33/91/588393391.db2.gz DWRVPUPBSGJLDS-ZETCQYMHSA-N 1 2 237.681 2.207 20 0 BEADLO Cn1c(C[N@@H+]2CCC[C@](C)(F)C2)cnc1Cl ZINC000848914025 588420025 /nfs/dbraw/zinc/42/00/25/588420025.db2.gz GRSSMSFLVSDZBC-NSHDSACASA-N 1 2 245.729 2.398 20 0 BEADLO Cn1c(C[N@H+]2CCC[C@](C)(F)C2)cnc1Cl ZINC000848914025 588420026 /nfs/dbraw/zinc/42/00/26/588420026.db2.gz GRSSMSFLVSDZBC-NSHDSACASA-N 1 2 245.729 2.398 20 0 BEADLO Cn1c(C[NH+]2CC(CC(F)F)C2)cnc1Cl ZINC000848918453 588421125 /nfs/dbraw/zinc/42/11/25/588421125.db2.gz ZSMMGUSSVLDDTG-UHFFFAOYSA-N 1 2 249.692 2.161 20 0 BEADLO Nc1ccc(CCC(=O)OCC2CC=CC2)c[nH+]1 ZINC000849746867 588493047 /nfs/dbraw/zinc/49/30/47/588493047.db2.gz DCYGXQOLYZAJMT-UHFFFAOYSA-N 1 2 246.310 2.106 20 0 BEADLO CC1(C)CC[C@H]1C(=O)OCc1cc[nH+]c(N)c1 ZINC000850071984 588518138 /nfs/dbraw/zinc/51/81/38/588518138.db2.gz YQRJXOXXSGVHQL-JTQLQIEISA-N 1 2 234.299 2.143 20 0 BEADLO CCc1cc(C[NH2+]Cc2nccn2C(C)C)[nH]n1 ZINC000850137125 588521144 /nfs/dbraw/zinc/52/11/44/588521144.db2.gz JGOPUIYPTGFOEX-UHFFFAOYSA-N 1 2 247.346 2.039 20 0 BEADLO Cc1c[nH]c(CNc2cccc3c2OCO3)[nH+]1 ZINC000850243105 588531330 /nfs/dbraw/zinc/53/13/30/588531330.db2.gz SAOMKSCUSAXAJT-UHFFFAOYSA-N 1 2 231.255 2.059 20 0 BEADLO O[C@H]1C[C@H]([NH2+]Cc2cscn2)c2ccccc21 ZINC000850371777 588541177 /nfs/dbraw/zinc/54/11/77/588541177.db2.gz LVNJYHKJUUHBNX-STQMWFEESA-N 1 2 246.335 2.411 20 0 BEADLO O[C@H]1C[C@@H]([NH2+]Cc2cscn2)c2ccccc21 ZINC000850371775 588541186 /nfs/dbraw/zinc/54/11/86/588541186.db2.gz LVNJYHKJUUHBNX-OLZOCXBDSA-N 1 2 246.335 2.411 20 0 BEADLO O[C@H]1C[C@H]([NH2+]Cc2nccs2)c2ccccc21 ZINC000850372830 588541635 /nfs/dbraw/zinc/54/16/35/588541635.db2.gz ZPONVCNDGBIWRR-RYUDHWBXSA-N 1 2 246.335 2.411 20 0 BEADLO Cc1ccccc1C(F)(F)C[NH2+][C@H](C)CCO ZINC000850562458 588560637 /nfs/dbraw/zinc/56/06/37/588560637.db2.gz VIIHFXWZHGWCNZ-LLVKDONJSA-N 1 2 243.297 2.447 20 0 BEADLO c1cc([NH+]2CCCC2)ccc1N[C@@H]1CCOC1 ZINC000109430587 588562165 /nfs/dbraw/zinc/56/21/65/588562165.db2.gz MXKXPVXONGYVQZ-CYBMUJFWSA-N 1 2 232.327 2.488 20 0 BEADLO O=C(CCCF)OCc1cccc2[nH+]ccn21 ZINC000850898695 588574953 /nfs/dbraw/zinc/57/49/53/588574953.db2.gz BRIIOUJGDWOFLM-UHFFFAOYSA-N 1 2 236.246 2.127 20 0 BEADLO CC1(C)CC[C@@H]1C(=O)O[C@@H]1CC[N@H+](CCF)C1 ZINC000850997352 588582903 /nfs/dbraw/zinc/58/29/03/588582903.db2.gz DUTVXKRHWGAPKP-GHMZBOCLSA-N 1 2 243.322 2.010 20 0 BEADLO CC1(C)CC[C@@H]1C(=O)O[C@@H]1CC[N@@H+](CCF)C1 ZINC000850997352 588582904 /nfs/dbraw/zinc/58/29/04/588582904.db2.gz DUTVXKRHWGAPKP-GHMZBOCLSA-N 1 2 243.322 2.010 20 0 BEADLO C[C@H](CC(=O)OC[C@H]1C[C@H]2C[C@H]2C1)n1cc[nH+]c1 ZINC000851419172 588604408 /nfs/dbraw/zinc/60/44/08/588604408.db2.gz XYUXRBRMPYCRRT-LPWJVIDDSA-N 1 2 248.326 2.424 20 0 BEADLO C[N@H+](Cc1ccoc1)Cc1cccc(F)n1 ZINC000851734450 588620512 /nfs/dbraw/zinc/62/05/12/588620512.db2.gz RZZIFTAHOGHICJ-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO C[N@@H+](Cc1ccoc1)Cc1cccc(F)n1 ZINC000851734450 588620513 /nfs/dbraw/zinc/62/05/13/588620513.db2.gz RZZIFTAHOGHICJ-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO CCC[N@H+](CC(F)F)C[C@@H]1COC(C)(C)O1 ZINC000851744908 588621812 /nfs/dbraw/zinc/62/18/12/588621812.db2.gz ROPJMYVVMJSSOH-SECBINFHSA-N 1 2 237.290 2.115 20 0 BEADLO CCC[N@@H+](CC(F)F)C[C@@H]1COC(C)(C)O1 ZINC000851744908 588621813 /nfs/dbraw/zinc/62/18/13/588621813.db2.gz ROPJMYVVMJSSOH-SECBINFHSA-N 1 2 237.290 2.115 20 0 BEADLO CC(C)c1nc(NC[C@H](O)c2ccco2)cc[nH+]1 ZINC000110199389 588624018 /nfs/dbraw/zinc/62/40/18/588624018.db2.gz NPPLJTWKERTKLU-JTQLQIEISA-N 1 2 247.298 2.339 20 0 BEADLO CC1(C)OC[C@H](CC[N@H+](CC(F)F)C2CC2)O1 ZINC000851762365 588624588 /nfs/dbraw/zinc/62/45/88/588624588.db2.gz OHQKQKWYBPTVMC-JTQLQIEISA-N 1 2 249.301 2.258 20 0 BEADLO CC1(C)OC[C@H](CC[N@@H+](CC(F)F)C2CC2)O1 ZINC000851762365 588624589 /nfs/dbraw/zinc/62/45/89/588624589.db2.gz OHQKQKWYBPTVMC-JTQLQIEISA-N 1 2 249.301 2.258 20 0 BEADLO C[N@@H+](CC=C(Cl)Cl)CCn1cccn1 ZINC000851770742 588625278 /nfs/dbraw/zinc/62/52/78/588625278.db2.gz SDWVYDCDHJMUMH-UHFFFAOYSA-N 1 2 234.130 2.134 20 0 BEADLO C[N@H+](CC=C(Cl)Cl)CCn1cccn1 ZINC000851770742 588625279 /nfs/dbraw/zinc/62/52/79/588625279.db2.gz SDWVYDCDHJMUMH-UHFFFAOYSA-N 1 2 234.130 2.134 20 0 BEADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1cnon1 ZINC000851784919 588628355 /nfs/dbraw/zinc/62/83/55/588628355.db2.gz XFYUKGKOEQYCLF-JTQLQIEISA-N 1 2 229.283 2.016 20 0 BEADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1cnon1 ZINC000851784919 588628356 /nfs/dbraw/zinc/62/83/56/588628356.db2.gz XFYUKGKOEQYCLF-JTQLQIEISA-N 1 2 229.283 2.016 20 0 BEADLO O=C1CC[C@H](C[N@H+](CC(F)F)CC2CCC2)O1 ZINC000851880489 588639175 /nfs/dbraw/zinc/63/91/75/588639175.db2.gz ARWIJPNBUXNNFI-SNVBAGLBSA-N 1 2 247.285 2.059 20 0 BEADLO O=C1CC[C@H](C[N@@H+](CC(F)F)CC2CCC2)O1 ZINC000851880489 588639176 /nfs/dbraw/zinc/63/91/76/588639176.db2.gz ARWIJPNBUXNNFI-SNVBAGLBSA-N 1 2 247.285 2.059 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cccc(F)n2)C[C@@H]1F ZINC000851909312 588642673 /nfs/dbraw/zinc/64/26/73/588642673.db2.gz BAOILEGSRJRBBZ-KOLCDFICSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cccc(F)n2)C[C@@H]1F ZINC000851909312 588642674 /nfs/dbraw/zinc/64/26/74/588642674.db2.gz BAOILEGSRJRBBZ-KOLCDFICSA-N 1 2 226.270 2.401 20 0 BEADLO Cc1cc(NC[C@H](O)c2cccc(F)c2)nc[nH+]1 ZINC000110306305 588645317 /nfs/dbraw/zinc/64/53/17/588645317.db2.gz NPTBRIHPPCJTFJ-LBPRGKRZSA-N 1 2 247.273 2.070 20 0 BEADLO C[C@@H]1C[C@H](c2cccnc2)[N@H+](Cc2cnon2)C1 ZINC000851934197 588645449 /nfs/dbraw/zinc/64/54/49/588645449.db2.gz GCTBLZZCMBRUFZ-ZWNOBZJWSA-N 1 2 244.298 2.048 20 0 BEADLO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2cnon2)C1 ZINC000851934197 588645450 /nfs/dbraw/zinc/64/54/50/588645450.db2.gz GCTBLZZCMBRUFZ-ZWNOBZJWSA-N 1 2 244.298 2.048 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cccc(F)n2)[C@@H](C)[C@H](C)O1 ZINC000851967773 588648587 /nfs/dbraw/zinc/64/85/87/588648587.db2.gz FINPGGJLFVBPDM-VWYCJHECSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cccc(F)n2)[C@@H](C)[C@H](C)O1 ZINC000851967773 588648588 /nfs/dbraw/zinc/64/85/88/588648588.db2.gz FINPGGJLFVBPDM-VWYCJHECSA-N 1 2 238.306 2.218 20 0 BEADLO CC[C@@]1(C)C[N@H+](Cc2cccc(F)n2)CCO1 ZINC000851971075 588649674 /nfs/dbraw/zinc/64/96/74/588649674.db2.gz FNOQQQDXZNJXQU-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO CC[C@@]1(C)C[N@@H+](Cc2cccc(F)n2)CCO1 ZINC000851971075 588649675 /nfs/dbraw/zinc/64/96/75/588649675.db2.gz FNOQQQDXZNJXQU-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO CC[C@]1(C)C[N@H+](Cc2cccc(F)n2)CCO1 ZINC000851971074 588649747 /nfs/dbraw/zinc/64/97/47/588649747.db2.gz FNOQQQDXZNJXQU-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO CC[C@]1(C)C[N@@H+](Cc2cccc(F)n2)CCO1 ZINC000851971074 588649748 /nfs/dbraw/zinc/64/97/48/588649748.db2.gz FNOQQQDXZNJXQU-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1Cc1cnon1 ZINC000851974799 588649905 /nfs/dbraw/zinc/64/99/05/588649905.db2.gz IXUXFSAXANLTKU-MRVPVSSYSA-N 1 2 249.236 2.232 20 0 BEADLO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1Cc1cnon1 ZINC000851974799 588649906 /nfs/dbraw/zinc/64/99/06/588649906.db2.gz IXUXFSAXANLTKU-MRVPVSSYSA-N 1 2 249.236 2.232 20 0 BEADLO Cc1ccccc1C1([NH2+]Cc2cnon2)CC1 ZINC000852207130 588672274 /nfs/dbraw/zinc/67/22/74/588672274.db2.gz ZRYMWVQUPGVTAZ-UHFFFAOYSA-N 1 2 229.283 2.157 20 0 BEADLO CC[C@@H]([NH2+]Cc1cnon1)c1ccccc1F ZINC000852216739 588673699 /nfs/dbraw/zinc/67/36/99/588673699.db2.gz LZOCPJBQYYBMSY-GFCCVEGCSA-N 1 2 235.262 2.450 20 0 BEADLO Cc1oncc1C[NH2+][C@H](C)c1cscn1 ZINC000852417750 588681582 /nfs/dbraw/zinc/68/15/82/588681582.db2.gz XGFZXDAYMBDXOS-SSDOTTSWSA-N 1 2 223.301 2.290 20 0 BEADLO COC(=O)[C@@]1([NH2+]C/C=C/Cl)CC[C@@H](C)CC1 ZINC000852471658 588683251 /nfs/dbraw/zinc/68/32/51/588683251.db2.gz BKWBYHQQIVNXJX-RHMDKNISSA-N 1 2 245.750 2.450 20 0 BEADLO COCC[N@H+](CCF)Cc1c(C)nsc1C ZINC000852480231 588683835 /nfs/dbraw/zinc/68/38/35/588683835.db2.gz ROHVURDIKHHYIF-UHFFFAOYSA-N 1 2 246.351 2.178 20 0 BEADLO COCC[N@@H+](CCF)Cc1c(C)nsc1C ZINC000852480231 588683836 /nfs/dbraw/zinc/68/38/36/588683836.db2.gz ROHVURDIKHHYIF-UHFFFAOYSA-N 1 2 246.351 2.178 20 0 BEADLO Cn1c(Cl)cnc1C[N@@H+]1CC2CC1(C)C2 ZINC000852785986 588702074 /nfs/dbraw/zinc/70/20/74/588702074.db2.gz SFJPRIIHXNYLBL-UHFFFAOYSA-N 1 2 225.723 2.058 20 0 BEADLO Cn1c(Cl)cnc1C[N@H+]1CC2CC1(C)C2 ZINC000852785986 588702075 /nfs/dbraw/zinc/70/20/75/588702075.db2.gz SFJPRIIHXNYLBL-UHFFFAOYSA-N 1 2 225.723 2.058 20 0 BEADLO Cc1cocc1C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000860553294 589105885 /nfs/dbraw/zinc/10/58/85/589105885.db2.gz IMURGNUPRUVHJE-LLVKDONJSA-N 1 2 245.282 2.288 20 0 BEADLO C[C@@H]1[C@H](C)SCC[N@@H+]1Cn1cc(Cl)cn1 ZINC000118382470 589169452 /nfs/dbraw/zinc/16/94/52/589169452.db2.gz WQKZQIYAPQGZGQ-BDAKNGLRSA-N 1 2 245.779 2.320 20 0 BEADLO C[C@@H]1[C@H](C)SCC[N@H+]1Cn1cc(Cl)cn1 ZINC000118382470 589169454 /nfs/dbraw/zinc/16/94/54/589169454.db2.gz WQKZQIYAPQGZGQ-BDAKNGLRSA-N 1 2 245.779 2.320 20 0 BEADLO CCC/C(C)=C\C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000861760091 589177044 /nfs/dbraw/zinc/17/70/44/589177044.db2.gz TYBLYCQHZYASQF-YFHOEESVSA-N 1 2 233.315 2.041 20 0 BEADLO CCC/C(C)=C\C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000861760091 589177046 /nfs/dbraw/zinc/17/70/46/589177046.db2.gz TYBLYCQHZYASQF-YFHOEESVSA-N 1 2 233.315 2.041 20 0 BEADLO Fc1ncccc1C[NH2+]Cc1cnc(C2CC2)o1 ZINC000862350737 589201869 /nfs/dbraw/zinc/20/18/69/589201869.db2.gz HDEVLYUWNFGHCW-UHFFFAOYSA-N 1 2 247.273 2.376 20 0 BEADLO Cc1[nH]c(CN2CCC[C@@](C)(F)C2)[nH+]c1C ZINC000862382611 589206740 /nfs/dbraw/zinc/20/67/40/589206740.db2.gz WMYSDEFQVLQUFJ-GFCCVEGCSA-N 1 2 225.311 2.351 20 0 BEADLO Fc1cc(C[NH+]2CC3(CC3(F)F)C2)ccn1 ZINC000862402575 589207337 /nfs/dbraw/zinc/20/73/37/589207337.db2.gz PJPQWPWYHZVXJX-UHFFFAOYSA-N 1 2 228.217 2.062 20 0 BEADLO CCCOCSc1nc(N)cc(CC)[nH+]1 ZINC000863328105 589280193 /nfs/dbraw/zinc/28/01/93/589280193.db2.gz ILLXQFFJXRWYEQ-UHFFFAOYSA-N 1 2 227.333 2.097 20 0 BEADLO CC(C)SCSC[C@H]1C[N@H+](C)CCO1 ZINC000863349020 589281070 /nfs/dbraw/zinc/28/10/70/589281070.db2.gz XDHBANWHDLLAPA-SNVBAGLBSA-N 1 2 235.418 2.149 20 0 BEADLO CC(C)SCSC[C@H]1C[N@@H+](C)CCO1 ZINC000863349020 589281071 /nfs/dbraw/zinc/28/10/71/589281071.db2.gz XDHBANWHDLLAPA-SNVBAGLBSA-N 1 2 235.418 2.149 20 0 BEADLO C[C@H]1C[C@H]1CO[NH+]=C(N)Cc1cccs1 ZINC000863457280 589288150 /nfs/dbraw/zinc/28/81/50/589288150.db2.gz RCZVUVBSXCAWIR-IUCAKERBSA-N 1 2 224.329 2.445 20 0 BEADLO CCO[C@H](CO[NH+]=C(N)c1ccccc1)C1CC1 ZINC000863451605 589288616 /nfs/dbraw/zinc/28/86/16/589288616.db2.gz FJEZXZOYXZTFRO-CYBMUJFWSA-N 1 2 248.326 2.348 20 0 BEADLO C[C@H]1C[C@H]1CO[NH+]=C(N)COc1ccccc1 ZINC000863453029 589288892 /nfs/dbraw/zinc/28/88/92/589288892.db2.gz AOWVERGEQWHNLU-QWRGUYRKSA-N 1 2 234.299 2.220 20 0 BEADLO CCOC1CC(O[NH+]=C(N)Cc2ccccc2)C1 ZINC000863453764 589289175 /nfs/dbraw/zinc/28/91/75/589289175.db2.gz NTEUVIOGVUUSCL-UHFFFAOYSA-N 1 2 248.326 2.295 20 0 BEADLO CC(C)CO[C@H](C)C(N)=[NH+]OC[C@@H]1C[C@H]1C ZINC000863456947 589289300 /nfs/dbraw/zinc/28/93/00/589289300.db2.gz ABDFPKQWRYVFSP-MXWKQRLJSA-N 1 2 228.336 2.202 20 0 BEADLO CC[C@@H](C)CO[NH+]=C(N)C1(OC)CCCC1 ZINC000863477937 589292062 /nfs/dbraw/zinc/29/20/62/589292062.db2.gz CPFMXWZRDTZJEF-SNVBAGLBSA-N 1 2 228.336 2.490 20 0 BEADLO CCCOc1ccc([NH2+]CCC(N)=O)cc1C ZINC000863585856 589302350 /nfs/dbraw/zinc/30/23/50/589302350.db2.gz NJESMUABOHLRNY-UHFFFAOYSA-N 1 2 236.315 2.071 20 0 BEADLO Cc1[nH]cc(-c2scc3c2OCCO3)[nH+]1 ZINC000863724437 589313237 /nfs/dbraw/zinc/31/32/37/589313237.db2.gz PJKFNKXDNLREHM-UHFFFAOYSA-N 1 2 222.269 2.218 20 0 BEADLO C/C=C/C[C@H]1CCCN(C(=O)Cc2[nH]cc[nH+]2)C1 ZINC000863817300 589321284 /nfs/dbraw/zinc/32/12/84/589321284.db2.gz JVPVBNJORAVJOG-JDGPPOGSSA-N 1 2 247.342 2.157 20 0 BEADLO C/C=C\C[C@H]1CCCN(C(=O)Cc2[nH]cc[nH+]2)C1 ZINC000863817299 589321495 /nfs/dbraw/zinc/32/14/95/589321495.db2.gz JVPVBNJORAVJOG-DLGQBQFBSA-N 1 2 247.342 2.157 20 0 BEADLO CC1(C)CCC(C)(NC(=O)Cc2c[nH]c[nH+]2)CC1 ZINC000864064363 589337388 /nfs/dbraw/zinc/33/73/88/589337388.db2.gz UKZHLBCCPIGGKG-UHFFFAOYSA-N 1 2 249.358 2.427 20 0 BEADLO CC1(C)CCC(C)(NC(=O)Cc2c[nH+]c[nH]2)CC1 ZINC000864064363 589337389 /nfs/dbraw/zinc/33/73/89/589337389.db2.gz UKZHLBCCPIGGKG-UHFFFAOYSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@H]1C[C@H](CNC(=O)Cc2c[nH]c[nH+]2)C[C@@H](C)C1 ZINC000864066940 589338204 /nfs/dbraw/zinc/33/82/04/589338204.db2.gz DFVPHLWLYQXBBE-GDNZZTSVSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@H]1C[C@H](CNC(=O)Cc2c[nH+]c[nH]2)C[C@@H](C)C1 ZINC000864066940 589338206 /nfs/dbraw/zinc/33/82/06/589338206.db2.gz DFVPHLWLYQXBBE-GDNZZTSVSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@H]1CC(CNC(=O)Cc2c[nH]c[nH+]2)C[C@H](C)C1 ZINC000864066941 589338423 /nfs/dbraw/zinc/33/84/23/589338423.db2.gz DFVPHLWLYQXBBE-GHMZBOCLSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@H]1CC(CNC(=O)Cc2c[nH+]c[nH]2)C[C@H](C)C1 ZINC000864066941 589338425 /nfs/dbraw/zinc/33/84/25/589338425.db2.gz DFVPHLWLYQXBBE-GHMZBOCLSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@H](O)c1cccc(N[C@H]2CO[C@@H](C3CC3)C2)[nH+]1 ZINC000864090604 589343295 /nfs/dbraw/zinc/34/32/95/589343295.db2.gz GTYUFZNTFUFCME-UFGOTCBOSA-N 1 2 248.326 2.114 20 0 BEADLO C[C@@H](C[S@@](=O)Cc1c[nH+]cn1C)C(C)(C)C ZINC000864472040 589373168 /nfs/dbraw/zinc/37/31/68/589373168.db2.gz HPKSBNLUXJVNSS-MGPLVRAMSA-N 1 2 242.388 2.351 20 0 BEADLO CC(C)(C)c1cn(CC(=O)c2ccc[nH]2)c[nH+]1 ZINC000865375480 589428042 /nfs/dbraw/zinc/42/80/42/589428042.db2.gz WISOCKBFCBAECC-UHFFFAOYSA-N 1 2 231.299 2.392 20 0 BEADLO CC(C)(C)c1cn(Cc2cc3n(n2)CCC3)c[nH+]1 ZINC000865376224 589428117 /nfs/dbraw/zinc/42/81/17/589428117.db2.gz FCJIIBVSMNQLSL-UHFFFAOYSA-N 1 2 244.342 2.372 20 0 BEADLO CC(C)(C)c1cn(C[C@H]2CCNC(=O)CC2)c[nH+]1 ZINC000865376274 589428467 /nfs/dbraw/zinc/42/84/67/589428467.db2.gz HDXLXIIYMXIKFY-LLVKDONJSA-N 1 2 249.358 2.097 20 0 BEADLO CC(C)(C)c1cn(C[C@@H]2CCCO2)c[nH+]1 ZINC000865374774 589428486 /nfs/dbraw/zinc/42/84/86/589428486.db2.gz KFHXVFFKPPMYIQ-JTQLQIEISA-N 1 2 208.305 2.360 20 0 BEADLO CCOC(=O)/C=C\Cn1c[nH+]c(C(C)(C)C)c1 ZINC000865376579 589428737 /nfs/dbraw/zinc/42/87/37/589428737.db2.gz UYDKERWPDAHLSP-SREVYHEPSA-N 1 2 236.315 2.300 20 0 BEADLO CON(C)c1cc[nH+]cc1C(F)(F)F ZINC000865408398 589433895 /nfs/dbraw/zinc/43/38/95/589433895.db2.gz XFEZEXFUGPAOTI-UHFFFAOYSA-N 1 2 206.167 2.098 20 0 BEADLO Cc1occc1C[NH2+]Cc1cn(C2CC2)cn1 ZINC000865426536 589434992 /nfs/dbraw/zinc/43/49/92/589434992.db2.gz TUPJODJNCAGALF-UHFFFAOYSA-N 1 2 231.299 2.409 20 0 BEADLO CCOCCNc1cc(CC(C)C)[nH+]cn1 ZINC000865448808 589436350 /nfs/dbraw/zinc/43/63/50/589436350.db2.gz MWMNRHXTRMIXGS-UHFFFAOYSA-N 1 2 223.320 2.124 20 0 BEADLO CC(C)Cc1cc(N[C@H]2CCC[C@@H](O)C2)nc[nH+]1 ZINC000865448290 589436438 /nfs/dbraw/zinc/43/64/38/589436438.db2.gz CTJXMXJVWIZGQX-WCQYABFASA-N 1 2 249.358 2.391 20 0 BEADLO C[C@H]1C[C@H]1CNc1nc(N)[nH+]c(C2CCCC2)n1 ZINC000865443041 589436544 /nfs/dbraw/zinc/43/65/44/589436544.db2.gz WKSTXEDNYMYLHC-WPRPVWTQSA-N 1 2 247.346 2.179 20 0 BEADLO C[C@H]1C[C@H]1CNc1nc(N)nc(C2CCCC2)[nH+]1 ZINC000865443041 589436546 /nfs/dbraw/zinc/43/65/46/589436546.db2.gz WKSTXEDNYMYLHC-WPRPVWTQSA-N 1 2 247.346 2.179 20 0 BEADLO CC(C)Cc1cc(NC2CCOCC2)nc[nH+]1 ZINC000865453630 589437171 /nfs/dbraw/zinc/43/71/71/589437171.db2.gz LQKSYOZLMYOHQU-UHFFFAOYSA-N 1 2 235.331 2.266 20 0 BEADLO C[C@H]1CCN1c1[nH+]cnc2[nH]c(Cl)cc21 ZINC000865463863 589438011 /nfs/dbraw/zinc/43/80/11/589438011.db2.gz FATFNJASXAJBOG-LURJTMIESA-N 1 2 222.679 2.162 20 0 BEADLO CC(C)CN(C)c1nc(N)[nH+]c(C2CCCC2)n1 ZINC000865476140 589439364 /nfs/dbraw/zinc/43/93/64/589439364.db2.gz AXEVUUWJKNUXNP-UHFFFAOYSA-N 1 2 249.362 2.204 20 0 BEADLO CC(C)CN(C)c1nc(N)nc(C2CCCC2)[nH+]1 ZINC000865476140 589439365 /nfs/dbraw/zinc/43/93/65/589439365.db2.gz AXEVUUWJKNUXNP-UHFFFAOYSA-N 1 2 249.362 2.204 20 0 BEADLO CC(C)Cc1cc(NCC2(C)COC2)nc[nH+]1 ZINC000865536682 589444265 /nfs/dbraw/zinc/44/42/65/589444265.db2.gz HSJYBQMLZLXYST-UHFFFAOYSA-N 1 2 235.331 2.124 20 0 BEADLO CC(C)Cc1cc(N(C)Cc2[nH]cc[nH+]2)ncn1 ZINC000865543087 589444851 /nfs/dbraw/zinc/44/48/51/589444851.db2.gz YTVPJUSXAITVLZ-UHFFFAOYSA-N 1 2 245.330 2.035 20 0 BEADLO CC(C)Cc1cc(N[C@H](CCO)C2CC2)nc[nH+]1 ZINC000865554298 589446013 /nfs/dbraw/zinc/44/60/13/589446013.db2.gz WOYGACAOBQDHED-CYBMUJFWSA-N 1 2 249.358 2.248 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@]12C[C@H]1CCCC2 ZINC000865574788 589447795 /nfs/dbraw/zinc/44/77/95/589447795.db2.gz DJPDSLKATCQHEM-BXUZGUMPSA-N 1 2 230.311 2.331 20 0 BEADLO CC[C@@H](O)CCNc1cc(CC(C)C)[nH+]cn1 ZINC000865617287 589451456 /nfs/dbraw/zinc/45/14/56/589451456.db2.gz QOLSDJQPPFPYAQ-GFCCVEGCSA-N 1 2 237.347 2.248 20 0 BEADLO CCn1ncc(C[NH2+]Cc2ccc(C)cc2F)n1 ZINC000865639333 589453773 /nfs/dbraw/zinc/45/37/73/589453773.db2.gz RKIPCLXLTZIDKA-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO CC(C)Cc1cc(NCC2(CCO)CC2)nc[nH+]1 ZINC000865694331 589456707 /nfs/dbraw/zinc/45/67/07/589456707.db2.gz JXYHSAAQGDDSSM-UHFFFAOYSA-N 1 2 249.358 2.250 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cn(C)nc2Cl)o1 ZINC000865723232 589458450 /nfs/dbraw/zinc/45/84/50/589458450.db2.gz IKINTRUTUZJMLY-UHFFFAOYSA-N 1 2 239.706 2.265 20 0 BEADLO Clc1cc2c(nc[nH+]c2N2CC[C@H]3C[C@H]32)[nH]1 ZINC000865756560 589461353 /nfs/dbraw/zinc/46/13/53/589461353.db2.gz SPKKDRQZAKNWQT-POYBYMJQSA-N 1 2 234.690 2.162 20 0 BEADLO C[C@H](O)c1ccc(N2CCC[C@@H]3C[C@@H]32)[nH+]c1 ZINC000865794074 589462084 /nfs/dbraw/zinc/46/20/84/589462084.db2.gz JUQJFIVJFJQJDT-UMNHJUIQSA-N 1 2 218.300 2.124 20 0 BEADLO C=C=CCNc1cc(CC(C)C)[nH+]cn1 ZINC000865823529 589462708 /nfs/dbraw/zinc/46/27/08/589462708.db2.gz VSJXOPLBVWPNEQ-UHFFFAOYSA-N 1 2 203.289 2.428 20 0 BEADLO CCn1cc[nH+]c1CNc1cccc(C(C)=O)n1 ZINC000865848322 589465004 /nfs/dbraw/zinc/46/50/04/589465004.db2.gz MWLLPZPGVDTUIW-UHFFFAOYSA-N 1 2 244.298 2.113 20 0 BEADLO CCO[C@H]1C[C@@H](Nc2ccc([C@H](C)O)c[nH+]2)C1 ZINC000865869478 589466045 /nfs/dbraw/zinc/46/60/45/589466045.db2.gz HKEJPCOOJOJLNP-ZMLRMANQSA-N 1 2 236.315 2.114 20 0 BEADLO Clc1cc2c(nc[nH+]c2N2CC[C@H]3C[C@H]3C2)[nH]1 ZINC000865948215 589469978 /nfs/dbraw/zinc/46/99/78/589469978.db2.gz BRHMGZAWZXQBBJ-YUMQZZPRSA-N 1 2 248.717 2.409 20 0 BEADLO CC1(C)CC[C@@H](O)[C@H](Nc2cccc[nH+]2)C1 ZINC000866049369 589474212 /nfs/dbraw/zinc/47/42/12/589474212.db2.gz JNAWMRUGIXQMKS-GHMZBOCLSA-N 1 2 220.316 2.433 20 0 BEADLO c1ccc(NC[C@@H]2CC3(CO2)CCOCC3)[nH+]c1 ZINC000866178505 589479039 /nfs/dbraw/zinc/47/90/39/589479039.db2.gz ULOTVVIYGAUOGE-LBPRGKRZSA-N 1 2 248.326 2.079 20 0 BEADLO OCCC1C[C@H]2CC[C@@H](C1)N2c1cccc[nH+]1 ZINC000866290659 589484329 /nfs/dbraw/zinc/48/43/29/589484329.db2.gz WDRMOZWQPPPDLX-YHWZYXNKSA-N 1 2 232.327 2.211 20 0 BEADLO CCn1ccnc1[C@H](C)[NH2+][C@H](C)c1ccnn1C ZINC000866613993 589505152 /nfs/dbraw/zinc/50/51/52/589505152.db2.gz KRCOZYAREUSMNQ-MNOVXSKESA-N 1 2 247.346 2.048 20 0 BEADLO C[C@@H](NC(=O)[C@]12C[C@H]1CCCC2)c1[nH]cc[nH+]1 ZINC000868507253 589561486 /nfs/dbraw/zinc/56/14/86/589561486.db2.gz TVBHTDLHDXWDCU-GIPNMCIBSA-N 1 2 233.315 2.167 20 0 BEADLO CC(C)(C)[C@@H]1C[C@H]1C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000868620643 589568455 /nfs/dbraw/zinc/56/84/55/589568455.db2.gz DHUSEFFHWYEHEL-GMTAPVOTSA-N 1 2 247.342 2.126 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)[C@@H]2C[C@H]2C(C)(C)C)S1 ZINC000868970601 589584295 /nfs/dbraw/zinc/58/42/95/589584295.db2.gz SMWHYZXHLZGAED-IWSPIJDZSA-N 1 2 240.372 2.276 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1C[C@H]1C(C)(C)C)c1[nH+]ccn1C ZINC000869302288 589597284 /nfs/dbraw/zinc/59/72/84/589597284.db2.gz UGGUFFGJYXGASS-GMTAPVOTSA-N 1 2 249.358 2.280 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)[C@@]12C[C@@H]1CCCC2 ZINC000869704273 589623622 /nfs/dbraw/zinc/62/36/22/589623622.db2.gz PRJORSQKSFLKGY-JSGCOSHPSA-N 1 2 248.326 2.397 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)[C@]12C[C@H]1CCCC2 ZINC000869704275 589623681 /nfs/dbraw/zinc/62/36/81/589623681.db2.gz PRJORSQKSFLKGY-TZMCWYRMSA-N 1 2 248.326 2.397 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)CC2CC2)c1 ZINC000122734376 589625297 /nfs/dbraw/zinc/62/52/97/589625297.db2.gz SFMSNHALOOQRPK-UHFFFAOYSA-N 1 2 235.283 2.242 20 0 BEADLO CC(C)(C)OCC(N)=[NH+]OCCCC1CC1 ZINC000871742855 589802629 /nfs/dbraw/zinc/80/26/29/589802629.db2.gz TXNVMCBJFHJCNB-UHFFFAOYSA-N 1 2 228.336 2.490 20 0 BEADLO Cc1ccc(CNc2ccn(CCF)n2)c(C)[nH+]1 ZINC000871862086 589827124 /nfs/dbraw/zinc/82/71/24/589827124.db2.gz KCWJMWGKZLKZBE-UHFFFAOYSA-N 1 2 248.305 2.477 20 0 BEADLO CCC[C@@H]([NH2+][C@H]1C[C@H](SC)C1)C(=O)OCC ZINC000871916460 589831950 /nfs/dbraw/zinc/83/19/50/589831950.db2.gz MCAAWFINODPVTF-GMTAPVOTSA-N 1 2 245.388 2.202 20 0 BEADLO CC(C)(C)c1cn(C[C@@H](O)C(F)(F)F)c[nH+]1 ZINC000871988479 589853949 /nfs/dbraw/zinc/85/39/49/589853949.db2.gz DEMSGBVGEKLETD-MRVPVSSYSA-N 1 2 236.237 2.104 20 0 BEADLO C[C@H]([NH2+]Cc1nccn1C)c1cccc(O)c1F ZINC000872031228 589857441 /nfs/dbraw/zinc/85/74/41/589857441.db2.gz IBPDESNSGKLVDL-VIFPVBQESA-N 1 2 249.289 2.116 20 0 BEADLO C[C@H](NCc1[nH+]ccn1C)c1cccc(O)c1F ZINC000872031228 589857445 /nfs/dbraw/zinc/85/74/45/589857445.db2.gz IBPDESNSGKLVDL-VIFPVBQESA-N 1 2 249.289 2.116 20 0 BEADLO CCc1ccc([C@@H](C)[NH2+]Cc2nonc2C)o1 ZINC000872135966 589879035 /nfs/dbraw/zinc/87/90/35/589879035.db2.gz JSWWOCSRLHAEQK-SECBINFHSA-N 1 2 235.287 2.384 20 0 BEADLO CCn1ncc(N[C@@H](C)c2[nH+]ccn2C)c1C ZINC000872137608 589879940 /nfs/dbraw/zinc/87/99/40/589879940.db2.gz MVDJCTCARAYFKD-VIFPVBQESA-N 1 2 233.319 2.118 20 0 BEADLO CCC[C@@H](CC)c1nc(C[NH2+]CC)no1 ZINC000872172172 589888016 /nfs/dbraw/zinc/88/80/16/589888016.db2.gz ZPDHTDUXDDRWJZ-SECBINFHSA-N 1 2 211.309 2.473 20 0 BEADLO CSC1CC[NH+](Cn2cc(Cl)cn2)CC1 ZINC000872628355 589957563 /nfs/dbraw/zinc/95/75/63/589957563.db2.gz VDGUNSLHDQWSGH-UHFFFAOYSA-N 1 2 245.779 2.321 20 0 BEADLO CCc1cc(NC[C@@H]2C[C@@H]3CCC[C@@H]3O2)nc[nH+]1 ZINC000872696307 589962340 /nfs/dbraw/zinc/96/23/40/589962340.db2.gz PXCKMARFVHLHIF-DRZSPHRISA-N 1 2 247.342 2.409 20 0 BEADLO Cc1cc(NC[C@@H]2C[C@H]3CCC[C@H]3O2)nc[nH+]1 ZINC000872694761 589962607 /nfs/dbraw/zinc/96/26/07/589962607.db2.gz AZOXPCFENMZHPX-GRYCIOLGSA-N 1 2 233.315 2.155 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1CC12CCC2 ZINC000872775302 589968215 /nfs/dbraw/zinc/96/82/15/589968215.db2.gz RKJIUAXRUGRMSJ-SECBINFHSA-N 1 2 219.288 2.148 20 0 BEADLO c1nc(N2CCCC2)cc(N[C@@H]2CC23CCC3)[nH+]1 ZINC000872775295 589968387 /nfs/dbraw/zinc/96/83/87/589968387.db2.gz RCQCDBFHVFIKEG-LLVKDONJSA-N 1 2 244.342 2.431 20 0 BEADLO c1nc(N[C@@H]2CC23CCC3)cc(N2CCCC2)[nH+]1 ZINC000872775295 589968390 /nfs/dbraw/zinc/96/83/90/589968390.db2.gz RCQCDBFHVFIKEG-LLVKDONJSA-N 1 2 244.342 2.431 20 0 BEADLO COCC[C@@H](C)[NH2+]c1ccc(OC)c(CO)c1 ZINC000124308399 589974319 /nfs/dbraw/zinc/97/43/19/589974319.db2.gz GYHBGIVZAYOGRS-SNVBAGLBSA-N 1 2 239.315 2.024 20 0 BEADLO Cc1nonc1C[NH2+]Cc1ccc(C)cc1F ZINC000873196470 589991463 /nfs/dbraw/zinc/99/14/63/589991463.db2.gz NKQMNDDFIFWNPZ-UHFFFAOYSA-N 1 2 235.262 2.115 20 0 BEADLO CCC[C@@H](CC)C(=O)OCCn1cc[nH+]c1 ZINC000873422619 590042908 /nfs/dbraw/zinc/04/29/08/590042908.db2.gz ZTIYYLYDWFYQMB-LLVKDONJSA-N 1 2 224.304 2.253 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ccccn1)c1ncc[nH]1 ZINC000124672765 590072229 /nfs/dbraw/zinc/07/22/29/590072229.db2.gz DWYOTHJMNINHTP-NXEZZACHSA-N 1 2 216.288 2.217 20 0 BEADLO CCn1ccc(C(=O)Nc2cc[nH+]c(C)c2)c1C ZINC000874461715 590112679 /nfs/dbraw/zinc/11/26/79/590112679.db2.gz QMOVIOFEQTZRMA-UHFFFAOYSA-N 1 2 243.310 2.194 20 0 BEADLO CC(C)(C)c1noc([C@H]([NH3+])c2ccccc2)n1 ZINC000020556902 590121327 /nfs/dbraw/zinc/12/13/27/590121327.db2.gz BGLIERZEGBHYCC-SNVBAGLBSA-N 1 2 231.299 2.415 20 0 BEADLO OC[C@@H]1CCC[N@H+](Cc2nc(Cl)cs2)C1 ZINC000876509770 590201930 /nfs/dbraw/zinc/20/19/30/590201930.db2.gz JIIIEXACANSNBE-MRVPVSSYSA-N 1 2 246.763 2.001 20 0 BEADLO OC[C@@H]1CCC[N@@H+](Cc2nc(Cl)cs2)C1 ZINC000876509770 590201932 /nfs/dbraw/zinc/20/19/32/590201932.db2.gz JIIIEXACANSNBE-MRVPVSSYSA-N 1 2 246.763 2.001 20 0 BEADLO Cc1c(Cl)cccc1C[NH+]1CCOCC1 ZINC000876509531 590205071 /nfs/dbraw/zinc/20/50/71/590205071.db2.gz IIMXFZPXKLASIA-UHFFFAOYSA-N 1 2 225.719 2.481 20 0 BEADLO C[N@@H+](Cc1nc(Cl)cs1)C[C@H]1CCCO1 ZINC000876566679 590216812 /nfs/dbraw/zinc/21/68/12/590216812.db2.gz QAYINADEDQEOJN-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO C[N@H+](Cc1nc(Cl)cs1)C[C@H]1CCCO1 ZINC000876566679 590216814 /nfs/dbraw/zinc/21/68/14/590216814.db2.gz QAYINADEDQEOJN-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@H]1C[N@H+](Cc2nc(Cl)cs2)CCCO1 ZINC000876685015 590230440 /nfs/dbraw/zinc/23/04/40/590230440.db2.gz WEDVEAHMMTWLAC-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nc(Cl)cs2)CCCO1 ZINC000876685015 590230442 /nfs/dbraw/zinc/23/04/42/590230442.db2.gz WEDVEAHMMTWLAC-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO OCCC[N@H+](Cc1nc(Cl)cs1)C1CC1 ZINC000876731344 590234236 /nfs/dbraw/zinc/23/42/36/590234236.db2.gz IQOXDOASMCNRGF-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO OCCC[N@@H+](Cc1nc(Cl)cs1)C1CC1 ZINC000876731344 590234237 /nfs/dbraw/zinc/23/42/37/590234237.db2.gz IQOXDOASMCNRGF-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO Cc1cnc(C[NH2+]Cc2ccc([C@H](C)O)cc2)o1 ZINC000876967711 590262508 /nfs/dbraw/zinc/26/25/08/590262508.db2.gz LQFHEUSIEUQDIO-NSHDSACASA-N 1 2 246.310 2.326 20 0 BEADLO C[C@H](O)C[N@H+](C)Cc1c(Cl)cncc1Cl ZINC000877320770 590315105 /nfs/dbraw/zinc/31/51/05/590315105.db2.gz UZIOFMXOCKNXNK-ZETCQYMHSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@H](O)C[N@@H+](C)Cc1c(Cl)cncc1Cl ZINC000877320770 590315109 /nfs/dbraw/zinc/31/51/09/590315109.db2.gz UZIOFMXOCKNXNK-ZETCQYMHSA-N 1 2 249.141 2.201 20 0 BEADLO Cc1cc(C)cc(CC[NH2+]CC(F)(F)CO)c1 ZINC000877393245 590322290 /nfs/dbraw/zinc/32/22/90/590322290.db2.gz KKPKUTSIJPJFPU-UHFFFAOYSA-N 1 2 243.297 2.063 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+][C@@H](C)Cc1cccc(C)c1 ZINC000877471220 590334647 /nfs/dbraw/zinc/33/46/47/590334647.db2.gz QGMIZONDVBMZLU-QWHCGFSZSA-N 1 2 249.354 2.467 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1ccc(Cl)nn1 ZINC000877545480 590353270 /nfs/dbraw/zinc/35/32/70/590353270.db2.gz BVCJQUHNLJOGQY-UHFFFAOYSA-N 1 2 237.690 2.321 20 0 BEADLO CO[C@@H](C[NH2+]C(CF)CF)Cc1ccccc1 ZINC000877556054 590356771 /nfs/dbraw/zinc/35/67/71/590356771.db2.gz KGJUTZRYERHBFC-CYBMUJFWSA-N 1 2 243.297 2.141 20 0 BEADLO c1ccc2oc(C[NH+]3CC4(CC4)C3)nc2c1 ZINC000877557419 590357649 /nfs/dbraw/zinc/35/76/49/590357649.db2.gz QUWCDVUPSGCSTE-UHFFFAOYSA-N 1 2 214.268 2.424 20 0 BEADLO CSC(C)(C)CC[N@@H+]1Cc2cnn(C)c2C1 ZINC000877632996 590378678 /nfs/dbraw/zinc/37/86/78/590378678.db2.gz VGYYHMNFBYNAGL-UHFFFAOYSA-N 1 2 239.388 2.267 20 0 BEADLO CSC(C)(C)CC[N@H+]1Cc2cnn(C)c2C1 ZINC000877632996 590378681 /nfs/dbraw/zinc/37/86/81/590378681.db2.gz VGYYHMNFBYNAGL-UHFFFAOYSA-N 1 2 239.388 2.267 20 0 BEADLO C[C@H](C[C@@H]1CCOC1)Nc1c[nH+]cc(N(C)C)c1 ZINC000877668866 590389078 /nfs/dbraw/zinc/38/90/78/590389078.db2.gz VKXMCWLRPINXSV-NEPJUHHUSA-N 1 2 249.358 2.375 20 0 BEADLO C[C@@H]1CC[C@@H]1Nc1c[nH+]cc(N(C)C)c1 ZINC000877667157 590389693 /nfs/dbraw/zinc/38/96/93/590389693.db2.gz DSUOFFOJQBALMH-SKDRFNHKSA-N 1 2 205.305 2.358 20 0 BEADLO Cc1cc(C[NH+]2CC(OC(C)(C)C)C2)sn1 ZINC000877769832 590421236 /nfs/dbraw/zinc/42/12/36/590421236.db2.gz KTKGFVRBKBGASK-UHFFFAOYSA-N 1 2 240.372 2.451 20 0 BEADLO CC(C)(C)OC1C[NH+](Cc2cccnc2)C1 ZINC000877772054 590421983 /nfs/dbraw/zinc/42/19/83/590421983.db2.gz LHNXDIDUSIIPKT-UHFFFAOYSA-N 1 2 220.316 2.081 20 0 BEADLO CC(C)(C)OC1C[NH+](Cc2ccccn2)C1 ZINC000877772157 590422000 /nfs/dbraw/zinc/42/20/00/590422000.db2.gz QNGVYNZLXITHEA-UHFFFAOYSA-N 1 2 220.316 2.081 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CC[C@](C)(C(F)(F)F)C1 ZINC000877811854 590427285 /nfs/dbraw/zinc/42/72/85/590427285.db2.gz ADYLXGMPGUYCCN-JTQLQIEISA-N 1 2 247.264 2.492 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CC[C@](C)(C(F)(F)F)C1 ZINC000877811854 590427287 /nfs/dbraw/zinc/42/72/87/590427287.db2.gz ADYLXGMPGUYCCN-JTQLQIEISA-N 1 2 247.264 2.492 20 0 BEADLO C[C@]1(C(F)(F)F)CC[N@H+](Cc2cocn2)C1 ZINC000877813065 590427365 /nfs/dbraw/zinc/42/73/65/590427365.db2.gz VVANLWRTUMFMCN-VIFPVBQESA-N 1 2 234.221 2.449 20 0 BEADLO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2cocn2)C1 ZINC000877813065 590427367 /nfs/dbraw/zinc/42/73/67/590427367.db2.gz VVANLWRTUMFMCN-VIFPVBQESA-N 1 2 234.221 2.449 20 0 BEADLO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2ccon2)C1 ZINC000877812410 590427590 /nfs/dbraw/zinc/42/75/90/590427590.db2.gz PDMKUGSEKQZRTA-SECBINFHSA-N 1 2 234.221 2.449 20 0 BEADLO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccon2)C1 ZINC000877812410 590427591 /nfs/dbraw/zinc/42/75/91/590427591.db2.gz PDMKUGSEKQZRTA-SECBINFHSA-N 1 2 234.221 2.449 20 0 BEADLO C[C@@H]1CCC[N@H+](Cc2nccn2CC(F)F)C1 ZINC000877934084 590450949 /nfs/dbraw/zinc/45/09/49/590450949.db2.gz AUSKEDBTHXLJPJ-SNVBAGLBSA-N 1 2 243.301 2.380 20 0 BEADLO C[C@@H]1CCC[N@@H+](Cc2nccn2CC(F)F)C1 ZINC000877934084 590450952 /nfs/dbraw/zinc/45/09/52/590450952.db2.gz AUSKEDBTHXLJPJ-SNVBAGLBSA-N 1 2 243.301 2.380 20 0 BEADLO Cc1conc1C[N@@H+]1CC(C)(C)OCC1(C)C ZINC000878108792 590496026 /nfs/dbraw/zinc/49/60/26/590496026.db2.gz JTYBODLGRNOVDO-UHFFFAOYSA-N 1 2 238.331 2.372 20 0 BEADLO Cc1conc1C[N@H+]1CC(C)(C)OCC1(C)C ZINC000878108792 590496028 /nfs/dbraw/zinc/49/60/28/590496028.db2.gz JTYBODLGRNOVDO-UHFFFAOYSA-N 1 2 238.331 2.372 20 0 BEADLO C[N@@H+](Cc1ccon1)C[C@@H]1CCC2(CCC2)O1 ZINC000878124090 590499933 /nfs/dbraw/zinc/49/99/33/590499933.db2.gz GDOKXUBFFCHHQM-LBPRGKRZSA-N 1 2 236.315 2.208 20 0 BEADLO C[N@H+](Cc1ccon1)C[C@@H]1CCC2(CCC2)O1 ZINC000878124090 590499934 /nfs/dbraw/zinc/49/99/34/590499934.db2.gz GDOKXUBFFCHHQM-LBPRGKRZSA-N 1 2 236.315 2.208 20 0 BEADLO Cc1conc1C[N@@H+]1CC[C@H](C(F)(F)F)C1 ZINC000878315112 590541891 /nfs/dbraw/zinc/54/18/91/590541891.db2.gz GHPIJDQPRSTKMZ-QMMMGPOBSA-N 1 2 234.221 2.367 20 0 BEADLO Cc1conc1C[N@H+]1CC[C@H](C(F)(F)F)C1 ZINC000878315112 590541893 /nfs/dbraw/zinc/54/18/93/590541893.db2.gz GHPIJDQPRSTKMZ-QMMMGPOBSA-N 1 2 234.221 2.367 20 0 BEADLO C[N@@H+](Cc1ncc[nH]1)C[C@H]1CCCC(C)(C)O1 ZINC000878315526 590541965 /nfs/dbraw/zinc/54/19/65/590541965.db2.gz QKPONFBMACZTOC-LLVKDONJSA-N 1 2 237.347 2.189 20 0 BEADLO C[N@H+](Cc1ncc[nH]1)C[C@H]1CCCC(C)(C)O1 ZINC000878315526 590541968 /nfs/dbraw/zinc/54/19/68/590541968.db2.gz QKPONFBMACZTOC-LLVKDONJSA-N 1 2 237.347 2.189 20 0 BEADLO FC1(F)CC[N@H+](C[C@H]2CC3(CCC3)CO2)C1 ZINC000878379111 590556872 /nfs/dbraw/zinc/55/68/72/590556872.db2.gz HBLMCXKOBILEIO-SNVBAGLBSA-N 1 2 231.286 2.287 20 0 BEADLO FC1(F)CC[N@@H+](C[C@H]2CC3(CCC3)CO2)C1 ZINC000878379111 590556873 /nfs/dbraw/zinc/55/68/73/590556873.db2.gz HBLMCXKOBILEIO-SNVBAGLBSA-N 1 2 231.286 2.287 20 0 BEADLO Cc1conc1C[N@@H+]1CCC[C@@H](OC(F)F)C1 ZINC000878394429 590558856 /nfs/dbraw/zinc/55/88/56/590558856.db2.gz WBAIOURKNHIALG-SECBINFHSA-N 1 2 246.257 2.187 20 0 BEADLO Cc1conc1C[N@H+]1CCC[C@@H](OC(F)F)C1 ZINC000878394429 590558858 /nfs/dbraw/zinc/55/88/58/590558858.db2.gz WBAIOURKNHIALG-SECBINFHSA-N 1 2 246.257 2.187 20 0 BEADLO CC(=O)C[N@@H+]1CCc2cc(F)cc(C)c2C1 ZINC000878559529 590592148 /nfs/dbraw/zinc/59/21/48/590592148.db2.gz JNQGWNHWQVWZLQ-UHFFFAOYSA-N 1 2 221.275 2.081 20 0 BEADLO CC(=O)C[N@H+]1CCc2cc(F)cc(C)c2C1 ZINC000878559529 590592149 /nfs/dbraw/zinc/59/21/49/590592149.db2.gz JNQGWNHWQVWZLQ-UHFFFAOYSA-N 1 2 221.275 2.081 20 0 BEADLO c1cc2c(cn1)C[N@H+](C[C@@H]1C[C@H]3CCC[C@@H]3O1)C2 ZINC000878609316 590595861 /nfs/dbraw/zinc/59/58/61/590595861.db2.gz XBPOJYAAMCCKKO-UGFHNGPFSA-N 1 2 244.338 2.355 20 0 BEADLO c1cc2c(cn1)C[N@@H+](C[C@@H]1C[C@H]3CCC[C@@H]3O1)C2 ZINC000878609316 590595863 /nfs/dbraw/zinc/59/58/63/590595863.db2.gz XBPOJYAAMCCKKO-UGFHNGPFSA-N 1 2 244.338 2.355 20 0 BEADLO c1cc2c(cn1)C[N@H+](C[C@@H]1C[C@H]3CCC[C@H]3O1)C2 ZINC000878609313 590595958 /nfs/dbraw/zinc/59/59/58/590595958.db2.gz XBPOJYAAMCCKKO-BYCMXARLSA-N 1 2 244.338 2.355 20 0 BEADLO c1cc2c(cn1)C[N@@H+](C[C@@H]1C[C@H]3CCC[C@H]3O1)C2 ZINC000878609313 590595960 /nfs/dbraw/zinc/59/59/60/590595960.db2.gz XBPOJYAAMCCKKO-BYCMXARLSA-N 1 2 244.338 2.355 20 0 BEADLO C[N@H+](Cc1scnc1Cl)CC(C)(C)CO ZINC000878664390 590604449 /nfs/dbraw/zinc/60/44/49/590604449.db2.gz GUTHXGIDPREBKI-UHFFFAOYSA-N 1 2 248.779 2.247 20 0 BEADLO C[N@@H+](Cc1scnc1Cl)CC(C)(C)CO ZINC000878664390 590604450 /nfs/dbraw/zinc/60/44/50/590604450.db2.gz GUTHXGIDPREBKI-UHFFFAOYSA-N 1 2 248.779 2.247 20 0 BEADLO Cc1conc1C[N@H+]1C[C@H](C)OC2(CCC2)C1 ZINC000878770936 590620499 /nfs/dbraw/zinc/62/04/99/590620499.db2.gz YLONFXYQRMJGNE-NSHDSACASA-N 1 2 236.315 2.126 20 0 BEADLO Cc1conc1C[N@@H+]1C[C@H](C)OC2(CCC2)C1 ZINC000878770936 590620501 /nfs/dbraw/zinc/62/05/01/590620501.db2.gz YLONFXYQRMJGNE-NSHDSACASA-N 1 2 236.315 2.126 20 0 BEADLO CO[C@H]1C[C@@H](C[N@@H+]2CCCC(F)(F)C2)C1 ZINC000878802778 590624954 /nfs/dbraw/zinc/62/49/54/590624954.db2.gz PHWKIYSMLGDYHX-AOOOYVTPSA-N 1 2 219.275 2.143 20 0 BEADLO CO[C@H]1C[C@@H](C[N@H+]2CCCC(F)(F)C2)C1 ZINC000878802778 590624956 /nfs/dbraw/zinc/62/49/56/590624956.db2.gz PHWKIYSMLGDYHX-AOOOYVTPSA-N 1 2 219.275 2.143 20 0 BEADLO C[C@H]([NH2+]Cc1cnon1)c1cc2cnccc2o1 ZINC000879713530 590853306 /nfs/dbraw/zinc/85/33/06/590853306.db2.gz ARRXKHGNLOCURC-QMMMGPOBSA-N 1 2 244.254 2.062 20 0 BEADLO C[C@@H]([NH2+]Cc1cnon1)c1cc2cnccc2o1 ZINC000879713528 590854116 /nfs/dbraw/zinc/85/41/16/590854116.db2.gz ARRXKHGNLOCURC-MRVPVSSYSA-N 1 2 244.254 2.062 20 0 BEADLO Cc1nnc(C[N@@H+]2CC[C@](C)(C(F)(F)F)C2)o1 ZINC000879999072 590906851 /nfs/dbraw/zinc/90/68/51/590906851.db2.gz HHILFLQAULFQKL-VIFPVBQESA-N 1 2 249.236 2.152 20 0 BEADLO Cc1nnc(C[N@H+]2CC[C@](C)(C(F)(F)F)C2)o1 ZINC000879999072 590906855 /nfs/dbraw/zinc/90/68/55/590906855.db2.gz HHILFLQAULFQKL-VIFPVBQESA-N 1 2 249.236 2.152 20 0 BEADLO CCCc1nc(C[N@@H+]2CCC[C@@H](CF)C2)no1 ZINC000880232015 590961408 /nfs/dbraw/zinc/96/14/08/590961408.db2.gz DRWDGXZLPCLGHX-JTQLQIEISA-N 1 2 241.310 2.204 20 0 BEADLO CCCc1nc(C[N@H+]2CCC[C@@H](CF)C2)no1 ZINC000880232015 590961410 /nfs/dbraw/zinc/96/14/10/590961410.db2.gz DRWDGXZLPCLGHX-JTQLQIEISA-N 1 2 241.310 2.204 20 0 BEADLO CC(C)c1nc(C[N@@H+]2CCC[C@@H](CF)C2)no1 ZINC000880232124 590962654 /nfs/dbraw/zinc/96/26/54/590962654.db2.gz HAPIWHDNBFIVSB-JTQLQIEISA-N 1 2 241.310 2.375 20 0 BEADLO CC(C)c1nc(C[N@H+]2CCC[C@@H](CF)C2)no1 ZINC000880232124 590962657 /nfs/dbraw/zinc/96/26/57/590962657.db2.gz HAPIWHDNBFIVSB-JTQLQIEISA-N 1 2 241.310 2.375 20 0 BEADLO FC1CC[NH+](Cc2coc(C3CC3)n2)CC1 ZINC000880238994 590970986 /nfs/dbraw/zinc/97/09/86/590970986.db2.gz QIHIGLLFTMOMCY-UHFFFAOYSA-N 1 2 224.279 2.486 20 0 BEADLO FC(F)Cn1ccnc1C[NH+]1CCC(F)CC1 ZINC000880238660 590971066 /nfs/dbraw/zinc/97/10/66/590971066.db2.gz KHCCRJKVEXBHJI-UHFFFAOYSA-N 1 2 247.264 2.082 20 0 BEADLO FC(F)Cn1cc[nH+]c1CN1CCC(F)CC1 ZINC000880238660 590971069 /nfs/dbraw/zinc/97/10/69/590971069.db2.gz KHCCRJKVEXBHJI-UHFFFAOYSA-N 1 2 247.264 2.082 20 0 BEADLO C[C@H](c1csnn1)[N@@H+]1CCC[C@@H](CF)C1 ZINC000880238899 590971169 /nfs/dbraw/zinc/97/11/69/590971169.db2.gz YWBJVAXPWBCMRQ-BDAKNGLRSA-N 1 2 229.324 2.281 20 0 BEADLO C[C@H](c1csnn1)[N@H+]1CCC[C@@H](CF)C1 ZINC000880238899 590971171 /nfs/dbraw/zinc/97/11/71/590971171.db2.gz YWBJVAXPWBCMRQ-BDAKNGLRSA-N 1 2 229.324 2.281 20 0 BEADLO OC[C@@H]1C=CC[N@@H+]1Cc1cc(F)ccc1Cl ZINC000880488531 591062740 /nfs/dbraw/zinc/06/27/40/591062740.db2.gz GZYXYRBVKLFRRB-NSHDSACASA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@@H]1C=CC[N@H+]1Cc1cc(F)ccc1Cl ZINC000880488531 591062744 /nfs/dbraw/zinc/06/27/44/591062744.db2.gz GZYXYRBVKLFRRB-NSHDSACASA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@H]1C=CC[N@@H+]1Cc1ccc(Cl)c(F)c1 ZINC000880489316 591065257 /nfs/dbraw/zinc/06/52/57/591065257.db2.gz SINZZDOSFUXSEP-SNVBAGLBSA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@H]1C=CC[N@H+]1Cc1ccc(Cl)c(F)c1 ZINC000880489316 591065260 /nfs/dbraw/zinc/06/52/60/591065260.db2.gz SINZZDOSFUXSEP-SNVBAGLBSA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@@H]1C=CC[N@@H+]1Cc1cccc(Cl)c1F ZINC000880490829 591067746 /nfs/dbraw/zinc/06/77/46/591067746.db2.gz DRTTYKJZYKPXFS-JTQLQIEISA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@@H]1C=CC[N@H+]1Cc1cccc(Cl)c1F ZINC000880490829 591067750 /nfs/dbraw/zinc/06/77/50/591067750.db2.gz DRTTYKJZYKPXFS-JTQLQIEISA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@H]1C=CC[N@@H+]1Cc1cc(C(F)(F)F)co1 ZINC000880493306 591070131 /nfs/dbraw/zinc/07/01/31/591070131.db2.gz ANSUPWURJQHXNB-SECBINFHSA-N 1 2 247.216 2.031 20 0 BEADLO OC[C@H]1C=CC[N@H+]1Cc1cc(C(F)(F)F)co1 ZINC000880493306 591070134 /nfs/dbraw/zinc/07/01/34/591070134.db2.gz ANSUPWURJQHXNB-SECBINFHSA-N 1 2 247.216 2.031 20 0 BEADLO CC1(C)C[C@]1(C)CNC(=O)CCCn1cc[nH+]c1 ZINC000881542997 591235573 /nfs/dbraw/zinc/23/55/73/591235573.db2.gz TXMDIBGXQXWPQT-CQSZACIVSA-N 1 2 249.358 2.216 20 0 BEADLO COc1cc(CNc2nc[nH+]c(C)c2C)ccn1 ZINC000881788330 591270968 /nfs/dbraw/zinc/27/09/68/591270968.db2.gz YQTDOOMQMIEZCQ-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO CCCCOCCNc1nc[nH+]c(C)c1C ZINC000881855854 591274878 /nfs/dbraw/zinc/27/48/78/591274878.db2.gz AEELSDZMSVUFPR-UHFFFAOYSA-N 1 2 223.320 2.322 20 0 BEADLO Cc1cc(CNc2cc(CO)cc[nH+]2)c(C)o1 ZINC000881984293 591285723 /nfs/dbraw/zinc/28/57/23/591285723.db2.gz KMBHYOKGYXDGMB-UHFFFAOYSA-N 1 2 232.283 2.396 20 0 BEADLO Cc1[nH+]cnc(NCc2ccn(C(C)C)n2)c1C ZINC000882001017 591287067 /nfs/dbraw/zinc/28/70/67/591287067.db2.gz JEXFTLZVKXFRKS-UHFFFAOYSA-N 1 2 245.330 2.483 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2CCSC2)c1C ZINC000882029368 591288762 /nfs/dbraw/zinc/28/87/62/591288762.db2.gz DKKXFQFBWUSMNT-VIFPVBQESA-N 1 2 209.318 2.011 20 0 BEADLO CCN(CC)C(=S)SCc1cn(C)c[nH+]1 ZINC000882037590 591290731 /nfs/dbraw/zinc/29/07/31/591290731.db2.gz HUKQOPSVPLNLPK-UHFFFAOYSA-N 1 2 243.401 2.280 20 0 BEADLO CO[C@H]1C[C@@H](Nc2nc[nH+]c(C)c2C)C1(C)C ZINC000882071301 591293797 /nfs/dbraw/zinc/29/37/97/591293797.db2.gz BNWCZLHBXLAWMT-MNOVXSKESA-N 1 2 235.331 2.319 20 0 BEADLO Cc1[nH+]cnc(NC[C@@]2(C)CCCO2)c1C ZINC000882077153 591294693 /nfs/dbraw/zinc/29/46/93/591294693.db2.gz ARPOYYMDMWONED-GFCCVEGCSA-N 1 2 221.304 2.074 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2CC[C@H](CO)CC2)c1C ZINC000882087229 591295324 /nfs/dbraw/zinc/29/53/24/591295324.db2.gz KUVBQZKYCODRNI-HAQNSBGRSA-N 1 2 235.331 2.056 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2C[C@@H](C)O[C@@H](C)C2)c1C ZINC000882148617 591305973 /nfs/dbraw/zinc/30/59/73/591305973.db2.gz FQNRSNCSZXGKTJ-BZBKMWRSSA-N 1 2 235.331 2.461 20 0 BEADLO CO[C@H]1CCC[C@H]1CNc1nc[nH+]c(C)c1C ZINC000882159550 591309208 /nfs/dbraw/zinc/30/92/08/591309208.db2.gz CBBKHKCWOPUHPT-RYUDHWBXSA-N 1 2 235.331 2.320 20 0 BEADLO Cc1[nH+]cnc(NCCCCCCO)c1C ZINC000882162312 591309806 /nfs/dbraw/zinc/30/98/06/591309806.db2.gz VANKPHWVGJQFBT-UHFFFAOYSA-N 1 2 223.320 2.058 20 0 BEADLO CO[C@H]1CCCN(c2nc[nH+]c(C)c2C)CC1 ZINC000882175838 591310926 /nfs/dbraw/zinc/31/09/26/591310926.db2.gz WPGRRFHISZJLHC-LBPRGKRZSA-N 1 2 235.331 2.099 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2CCO[C@@H](C3CC3)C2)c1C ZINC000882192438 591314757 /nfs/dbraw/zinc/31/47/57/591314757.db2.gz BODFTJZQBGOHQU-CHWSQXEVSA-N 1 2 247.342 2.463 20 0 BEADLO CC[C@@]1(CO)CCCN(c2nc[nH+]c(C)c2C)C1 ZINC000882212088 591316587 /nfs/dbraw/zinc/31/65/87/591316587.db2.gz MLRJARRCMKYLCS-CQSZACIVSA-N 1 2 249.358 2.082 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2[C@@H]3CCC[C@@H]32)c1C ZINC000882274942 591323760 /nfs/dbraw/zinc/32/37/60/591323760.db2.gz HTLIWHYHRZUSDP-JGPRNRPPSA-N 1 2 203.289 2.304 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2[C@@H]3CCC[C@@H]32)c1C ZINC000882274943 591324102 /nfs/dbraw/zinc/32/41/02/591324102.db2.gz HTLIWHYHRZUSDP-URLYPYJESA-N 1 2 203.289 2.304 20 0 BEADLO Cc1[nH+]cnc(N2CCC(F)(F)CC2)c1C ZINC000882289985 591326541 /nfs/dbraw/zinc/32/65/41/591326541.db2.gz CMBCSOQXBKIDHU-UHFFFAOYSA-N 1 2 227.258 2.329 20 0 BEADLO CO[C@]1(C)CCCN(c2nc[nH+]c(C)c2C)CC1 ZINC000882289377 591326624 /nfs/dbraw/zinc/32/66/24/591326624.db2.gz ZCYSKTODRJQAQP-CQSZACIVSA-N 1 2 249.358 2.489 20 0 BEADLO Cc1[nH+]cnc(N2CC[C@@H](C(F)F)C2)c1C ZINC000882311342 591327646 /nfs/dbraw/zinc/32/76/46/591327646.db2.gz LFFFZDFPLDTESR-SECBINFHSA-N 1 2 227.258 2.185 20 0 BEADLO COCC(C)(C)CNc1nc[nH+]c(C)c1C ZINC000882394074 591342314 /nfs/dbraw/zinc/34/23/14/591342314.db2.gz ONCAYUFDPBCXGW-UHFFFAOYSA-N 1 2 223.320 2.178 20 0 BEADLO CCC[C@H](CNc1nc[nH+]c(C)c1C)OC ZINC000882407281 591344285 /nfs/dbraw/zinc/34/42/85/591344285.db2.gz LEWXTIXNLKBMMV-LLVKDONJSA-N 1 2 223.320 2.320 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)Nc1ncnc(C)c1C ZINC000882426551 591346558 /nfs/dbraw/zinc/34/65/58/591346558.db2.gz LWSXTAFAPHWCFR-LLVKDONJSA-N 1 2 245.330 2.483 20 0 BEADLO Cc1[nH+]cnc(NCC(C)(C)C(C)(C)O)c1C ZINC000882431368 591347321 /nfs/dbraw/zinc/34/73/21/591347321.db2.gz OFLWUZOBXMOWDL-UHFFFAOYSA-N 1 2 237.347 2.302 20 0 BEADLO Cc1[nH+]cnc(NCCC[C@@H]2CCOC2)c1C ZINC000882430946 591347763 /nfs/dbraw/zinc/34/77/63/591347763.db2.gz SLHUEMDURGWOSU-GFCCVEGCSA-N 1 2 235.331 2.322 20 0 BEADLO CO[C@H]1C[C@@H](Nc2nc[nH+]c(C)c2C)C12CCC2 ZINC000882443117 591349835 /nfs/dbraw/zinc/34/98/35/591349835.db2.gz QMQLJSSZIJXOFM-NEPJUHHUSA-N 1 2 247.342 2.463 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2CS[C@@H](C)C2)c1C ZINC000882456336 591351535 /nfs/dbraw/zinc/35/15/35/591351535.db2.gz JOPSHOSZLCGCQS-OIBJUYFYSA-N 1 2 223.345 2.399 20 0 BEADLO Cc1ccnc([C@@H](C)Nc2nc[nH+]c(C)c2C)n1 ZINC000882469918 591353050 /nfs/dbraw/zinc/35/30/50/591353050.db2.gz VXEBMUGYUFSIGU-LLVKDONJSA-N 1 2 243.314 2.365 20 0 BEADLO Cc1[nH+]cnc(NCCCC2(O)CCC2)c1C ZINC000882472228 591353932 /nfs/dbraw/zinc/35/39/32/591353932.db2.gz NGRMCYLRZZSUCA-UHFFFAOYSA-N 1 2 235.331 2.201 20 0 BEADLO Cc1cnc(C)c(N[C@H](C)c2[nH+]ccn2C)n1 ZINC000882626078 591402194 /nfs/dbraw/zinc/40/21/94/591402194.db2.gz SWMRADVKCOQQNE-SNVBAGLBSA-N 1 2 231.303 2.000 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2CO[C@@H](C3CC3)C2)c1C ZINC000882662906 591408126 /nfs/dbraw/zinc/40/81/26/591408126.db2.gz HERWBTOBRMRZSI-NWDGAFQWSA-N 1 2 233.315 2.073 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2C[C@@H](C)O[C@@H]2C)c1C ZINC000882682118 591410922 /nfs/dbraw/zinc/41/09/22/591410922.db2.gz VSQHNKAVGUAJBX-AVPPRXQKSA-N 1 2 221.304 2.071 20 0 BEADLO CO[C@@H]1CC[C@H](C)N(c2cc[nH+]cc2F)C1 ZINC000882683015 591411097 /nfs/dbraw/zinc/41/10/97/591411097.db2.gz PAEIUDDNRDSNIO-VHSXEESVSA-N 1 2 224.279 2.224 20 0 BEADLO Cc1[nH+]cnc(NCC[C@H](O)C2CCCC2)c1C ZINC000882708201 591415837 /nfs/dbraw/zinc/41/58/37/591415837.db2.gz VSYWQFXRCLBJPJ-ZDUSSCGKSA-N 1 2 249.358 2.447 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2CC23CCC3)c1C ZINC000882720525 591420529 /nfs/dbraw/zinc/42/05/29/591420529.db2.gz ZTRWSGBJLXFWNY-JTQLQIEISA-N 1 2 203.289 2.448 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2C=CCC2)c1C ZINC000882756051 591430748 /nfs/dbraw/zinc/43/07/48/591430748.db2.gz LKRVJGJZOOQMTH-LLVKDONJSA-N 1 2 203.289 2.472 20 0 BEADLO CC1(C)C[C@]1(C)CNc1cc(CO)cc[nH+]1 ZINC000882784096 591439347 /nfs/dbraw/zinc/43/93/47/591439347.db2.gz STXMDIAEVGJILM-CYBMUJFWSA-N 1 2 220.316 2.422 20 0 BEADLO Nc1nc(N2CC[C@@H](CF)C2)[nH+]c2ccccc12 ZINC000882840632 591451646 /nfs/dbraw/zinc/45/16/46/591451646.db2.gz AEUAQAARAUHXNR-VIFPVBQESA-N 1 2 246.289 2.008 20 0 BEADLO CC(C)c1c[nH]c(C[NH2+]Cc2ccco2)n1 ZINC000882879122 591459888 /nfs/dbraw/zinc/45/98/88/591459888.db2.gz HXZFEQMJZLRSGK-UHFFFAOYSA-N 1 2 219.288 2.416 20 0 BEADLO COC[C@H]1C[C@@H](Nc2cc[nH+]c(C3CC3)n2)C1 ZINC000882906155 591472700 /nfs/dbraw/zinc/47/27/00/591472700.db2.gz ORMQRPOWQYMTHX-JGZJWPJOSA-N 1 2 233.315 2.191 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccc([C@@H](C)O)cc2)no1 ZINC000882917440 591474800 /nfs/dbraw/zinc/47/48/00/591474800.db2.gz MGVWRZLAYOPTRU-LLVKDONJSA-N 1 2 246.310 2.326 20 0 BEADLO CC(C)(C)C1CCC(CO[NH+]=C(N)CO)CC1 ZINC000883012270 591512790 /nfs/dbraw/zinc/51/27/90/591512790.db2.gz ZVNORAHZSAHFGR-UHFFFAOYSA-N 1 2 242.363 2.330 20 0 BEADLO CCOC1CC(O[NH+]=C(N)c2ccccc2)C1 ZINC000883048760 591528588 /nfs/dbraw/zinc/52/85/88/591528588.db2.gz VUHCCFJNYWEKRP-UHFFFAOYSA-N 1 2 234.299 2.101 20 0 BEADLO COC1CC(O[NH+]=C(N)c2ccccc2C)C1 ZINC000883059015 591531573 /nfs/dbraw/zinc/53/15/73/591531573.db2.gz JMJOJZQEFSXQDE-UHFFFAOYSA-N 1 2 234.299 2.019 20 0 BEADLO Cc1c(NCc2[nH]cc(C(C)C)[nH+]2)cnn1C ZINC000883082752 591536863 /nfs/dbraw/zinc/53/68/63/591536863.db2.gz PNHDKLQVSJZKFS-UHFFFAOYSA-N 1 2 233.319 2.187 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cocn2)c(Cl)n1 ZINC000883293127 591609961 /nfs/dbraw/zinc/60/99/61/591609961.db2.gz KMPMTKAXKSRRFG-UHFFFAOYSA-N 1 2 237.690 2.321 20 0 BEADLO COC(=O)[C@@H]1C[C@@H]1[C@H](C)Nc1c[nH+]c(C)c(C)c1 ZINC000883341450 591620080 /nfs/dbraw/zinc/62/00/80/591620080.db2.gz QGRYUXIFSIXMPH-CYZMBNFOSA-N 1 2 248.326 2.308 20 0 BEADLO Cc1ccc(CNc2c[nH+]c(C)c(C)c2)nn1 ZINC000883341659 591620476 /nfs/dbraw/zinc/62/04/76/591620476.db2.gz WXBBCUKLORCQFC-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO Cc1cc(N[C@@H]2CCn3ccnc32)c[nH+]c1C ZINC000883342511 591621637 /nfs/dbraw/zinc/62/16/37/591621637.db2.gz AXEOGIMJSCKKLP-GFCCVEGCSA-N 1 2 228.299 2.452 20 0 BEADLO Cc1cc(NCc2cncnc2)c[nH+]c1C ZINC000883342186 591621763 /nfs/dbraw/zinc/62/17/63/591621763.db2.gz NNQYIWIXKNMLSD-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO Cc1cc(NCc2ccn(C)n2)c[nH+]c1C ZINC000883342187 591622003 /nfs/dbraw/zinc/62/20/03/591622003.db2.gz NPWMPFFHZBCWBW-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO COc1ccc([NH2+]CC[C@@H](C)O)c(C)c1 ZINC000133616112 591841874 /nfs/dbraw/zinc/84/18/74/591841874.db2.gz RLFQNIDRPMCDNF-SNVBAGLBSA-N 1 2 209.289 2.186 20 0 BEADLO CCc1nc(N2CCCC[C@@H]2C[C@@H](C)O)cc[nH+]1 ZINC000884490984 591955351 /nfs/dbraw/zinc/95/53/51/591955351.db2.gz KPLIFPXMZHHNQZ-VXGBXAGGSA-N 1 2 249.358 2.169 20 0 BEADLO CCc1nc(N2C[C@@H](C)O[C@H](C3CC3)C2)cc[nH+]1 ZINC000884492177 591956051 /nfs/dbraw/zinc/95/60/51/591956051.db2.gz OMBMYJBZRTWLHW-PWSUYJOCSA-N 1 2 247.342 2.043 20 0 BEADLO CCc1nc(N2CC[C@@H](OC)C[C@H]2C)cc[nH+]1 ZINC000884497299 591957044 /nfs/dbraw/zinc/95/70/44/591957044.db2.gz UOGOKHQBXATLHJ-GHMZBOCLSA-N 1 2 235.331 2.043 20 0 BEADLO CCc1nc(NC[C@H]2CCOC[C@H]2C)cc[nH+]1 ZINC000884506772 591960382 /nfs/dbraw/zinc/96/03/82/591960382.db2.gz MRBCZDVQGGIYPJ-GHMZBOCLSA-N 1 2 235.331 2.124 20 0 BEADLO CCc1nc(N[C@@H](CC)C(C)(C)O)cc[nH+]1 ZINC000884516603 591962950 /nfs/dbraw/zinc/96/29/50/591962950.db2.gz OMPXGTAEXHLSKT-VIFPVBQESA-N 1 2 223.320 2.000 20 0 BEADLO CCc1nc(NC[C@]2(O)CCCC2(C)C)cc[nH+]1 ZINC000884516639 591963321 /nfs/dbraw/zinc/96/33/21/591963321.db2.gz PLXXQJQTMZWHBB-CQSZACIVSA-N 1 2 249.358 2.392 20 0 BEADLO CCc1nc(NCC2(OC)CCCC2)cc[nH+]1 ZINC000884517216 591964117 /nfs/dbraw/zinc/96/41/17/591964117.db2.gz HRWOEALQPZPKOT-UHFFFAOYSA-N 1 2 235.331 2.410 20 0 BEADLO CCc1nc(NCCC[C@@H]2CCOC2)cc[nH+]1 ZINC000884523807 591965482 /nfs/dbraw/zinc/96/54/82/591965482.db2.gz GPXQGLXQLNNVAF-LLVKDONJSA-N 1 2 235.331 2.268 20 0 BEADLO CCc1nc(NCCc2c(C)n[nH]c2C)cc[nH+]1 ZINC000884524356 591965955 /nfs/dbraw/zinc/96/59/55/591965955.db2.gz VTQQAXQGRHRAGL-UHFFFAOYSA-N 1 2 245.330 2.034 20 0 BEADLO CCOC[C@H]1CCCCN1c1cc[nH+]c(CC)n1 ZINC000884528543 591967550 /nfs/dbraw/zinc/96/75/50/591967550.db2.gz RZZPVRXAOGABGQ-GFCCVEGCSA-N 1 2 249.358 2.434 20 0 BEADLO CCc1nc(N2CCC[C@H](CCO)CC2)cc[nH+]1 ZINC000884534538 591970211 /nfs/dbraw/zinc/97/02/11/591970211.db2.gz IVNUWPWLUJRBJJ-LBPRGKRZSA-N 1 2 249.358 2.028 20 0 BEADLO CCc1nc(N[C@H](CO)C[C@@H](C)CC)cc[nH+]1 ZINC000884542666 591972586 /nfs/dbraw/zinc/97/25/86/591972586.db2.gz KJPWBAVAGZBIMK-QWRGUYRKSA-N 1 2 237.347 2.248 20 0 BEADLO CCc1nc(N2CCOC[C@H]2C2CCC2)cc[nH+]1 ZINC000884543186 591973551 /nfs/dbraw/zinc/97/35/51/591973551.db2.gz XKBHLOWJUBPDFA-LBPRGKRZSA-N 1 2 247.342 2.044 20 0 BEADLO CCc1nc(N(CC)[C@@H]2CCCOC2)cc[nH+]1 ZINC000884545061 591974022 /nfs/dbraw/zinc/97/40/22/591974022.db2.gz XPASUMDVILGKNI-LLVKDONJSA-N 1 2 235.331 2.044 20 0 BEADLO CCc1nc(NCC2SCCS2)cc[nH+]1 ZINC000884558982 591979182 /nfs/dbraw/zinc/97/91/82/591979182.db2.gz JPOOESUXQZNLNW-UHFFFAOYSA-N 1 2 241.385 2.257 20 0 BEADLO CCc1nc(NCC2CCC(O)CC2)cc[nH+]1 ZINC000884559434 591979207 /nfs/dbraw/zinc/97/92/07/591979207.db2.gz UWMXPSSFHUBSQS-UHFFFAOYSA-N 1 2 235.331 2.002 20 0 BEADLO CCc1nc(NCc2cncc(OC)c2)cc[nH+]1 ZINC000884558783 591979815 /nfs/dbraw/zinc/97/98/15/591979815.db2.gz DOVCXZGIUWCBAK-UHFFFAOYSA-N 1 2 244.298 2.055 20 0 BEADLO CCc1nc(N2C[C@@H](OC)CC[C@@H]2C)cc[nH+]1 ZINC000884571024 591984393 /nfs/dbraw/zinc/98/43/93/591984393.db2.gz FJROHGYONPDMBA-QWRGUYRKSA-N 1 2 235.331 2.043 20 0 BEADLO CCc1nc(NCc2ccnc(F)c2)cc[nH+]1 ZINC000884571863 591984537 /nfs/dbraw/zinc/98/45/37/591984537.db2.gz ZYSDYUOHMCWGEX-UHFFFAOYSA-N 1 2 232.262 2.185 20 0 BEADLO CCc1nc(NCC[C@H](O)C2CCCC2)cc[nH+]1 ZINC000884575152 591985409 /nfs/dbraw/zinc/98/54/09/591985409.db2.gz CTIWEEDWQMTHBH-LBPRGKRZSA-N 1 2 249.358 2.392 20 0 BEADLO Cc1cc(N2C[C@@H]3C[C@@H]3C2)nc(C2CC2)[nH+]1 ZINC000884588258 591988500 /nfs/dbraw/zinc/98/85/00/591988500.db2.gz BXBCSACPEVLOTD-PHIMTYICSA-N 1 2 215.300 2.119 20 0 BEADLO CC(C)c1nc(N2C[C@@H]3C[C@@H]3C2)cc[nH+]1 ZINC000884589134 591989194 /nfs/dbraw/zinc/98/91/94/591989194.db2.gz UGXNUUMHPGLPQE-AOOOYVTPSA-N 1 2 203.289 2.056 20 0 BEADLO Cc1cc(NC[C@@H]2CC3(CCC3)CO2)nc[nH+]1 ZINC000884661010 592007006 /nfs/dbraw/zinc/00/70/06/592007006.db2.gz JEZZWYKIHHNQPS-NSHDSACASA-N 1 2 233.315 2.156 20 0 BEADLO CC/C=C(/C)C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000135388854 592010832 /nfs/dbraw/zinc/01/08/32/592010832.db2.gz BHSOAMWBZNCVQW-MBACFSSFSA-N 1 2 221.304 2.333 20 0 BEADLO CCC=C(C)C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000135388854 592010835 /nfs/dbraw/zinc/01/08/35/592010835.db2.gz BHSOAMWBZNCVQW-MBACFSSFSA-N 1 2 221.304 2.333 20 0 BEADLO COc1ccc[nH+]c1N1CC[C@@H]([C@@H]2CCCO2)C1 ZINC000884742665 592016284 /nfs/dbraw/zinc/01/62/84/592016284.db2.gz UMSQYHNGJXZAAO-NEPJUHHUSA-N 1 2 248.326 2.096 20 0 BEADLO Cc1cc(NCC2(C3(O)CCC3)CCC2)nc[nH+]1 ZINC000884806613 592017813 /nfs/dbraw/zinc/01/78/13/592017813.db2.gz BGOYIDDAHYAKIW-UHFFFAOYSA-N 1 2 247.342 2.282 20 0 BEADLO CC[C@@H]1C[N@H+](CCSC(F)(F)F)CCO1 ZINC000885951594 592114243 /nfs/dbraw/zinc/11/42/43/592114243.db2.gz LIVQHMBYTYGUJK-MRVPVSSYSA-N 1 2 243.294 2.350 20 0 BEADLO CC[C@@H]1C[N@@H+](CCSC(F)(F)F)CCO1 ZINC000885951594 592114245 /nfs/dbraw/zinc/11/42/45/592114245.db2.gz LIVQHMBYTYGUJK-MRVPVSSYSA-N 1 2 243.294 2.350 20 0 BEADLO CCc1cc(C[NH2+]Cc2cc(C)co2)on1 ZINC000885996031 592125679 /nfs/dbraw/zinc/12/56/79/592125679.db2.gz FBTFDOJCAUJSHM-UHFFFAOYSA-N 1 2 220.272 2.428 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)C[C@H]1CCC2(CCC2)CO1 ZINC000886008527 592130193 /nfs/dbraw/zinc/13/01/93/592130193.db2.gz OPOBXJUWCTVSAX-CYBMUJFWSA-N 1 2 249.358 2.191 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)C[C@H]1CCC2(CCC2)CO1 ZINC000886008527 592130194 /nfs/dbraw/zinc/13/01/94/592130194.db2.gz OPOBXJUWCTVSAX-CYBMUJFWSA-N 1 2 249.358 2.191 20 0 BEADLO Cc1[nH]c(C(=O)NCC2CCC=CCC2)c[nH+]1 ZINC000886022032 592133614 /nfs/dbraw/zinc/13/36/14/592133614.db2.gz PPVDYJXBTYOPMG-UHFFFAOYSA-N 1 2 233.315 2.194 20 0 BEADLO Cc1coc(C[NH2+]Cc2ncccc2F)c1 ZINC000886044422 592140134 /nfs/dbraw/zinc/14/01/34/592140134.db2.gz WKYHMBJTTUVAEA-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO Cc1c[nH]nc1C[N@H+](Cc1ccncc1)C1CC1 ZINC000886089801 592146169 /nfs/dbraw/zinc/14/61/69/592146169.db2.gz JTBYCSLORHKQMN-UHFFFAOYSA-N 1 2 242.326 2.278 20 0 BEADLO Cc1c[nH]nc1C[N@@H+](Cc1ccncc1)C1CC1 ZINC000886089801 592146172 /nfs/dbraw/zinc/14/61/72/592146172.db2.gz JTBYCSLORHKQMN-UHFFFAOYSA-N 1 2 242.326 2.278 20 0 BEADLO Cc1cn[nH]c1C[N@H+](Cc1ccncc1)C1CC1 ZINC000886089801 592146175 /nfs/dbraw/zinc/14/61/75/592146175.db2.gz JTBYCSLORHKQMN-UHFFFAOYSA-N 1 2 242.326 2.278 20 0 BEADLO Cc1cn[nH]c1C[N@@H+](Cc1ccncc1)C1CC1 ZINC000886089801 592146176 /nfs/dbraw/zinc/14/61/76/592146176.db2.gz JTBYCSLORHKQMN-UHFFFAOYSA-N 1 2 242.326 2.278 20 0 BEADLO Cc1coc(C[NH2+][C@@H](C)c2ccn(C)n2)c1 ZINC000886142651 592162784 /nfs/dbraw/zinc/16/27/84/592162784.db2.gz HMQHSBAEKMJNNP-JTQLQIEISA-N 1 2 219.288 2.172 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ncco2)ccn1 ZINC000886272066 592192714 /nfs/dbraw/zinc/19/27/14/592192714.db2.gz GFIWNQLEUSATPU-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO Cc1occc1C[NH2+][C@@H](C)c1ncco1 ZINC000886272035 592192778 /nfs/dbraw/zinc/19/27/78/592192778.db2.gz FINOBXIYTXEXSE-QMMMGPOBSA-N 1 2 206.245 2.427 20 0 BEADLO C[C@H]([NH2+]Cc1ccnc(F)c1)c1ncco1 ZINC000886271915 592193047 /nfs/dbraw/zinc/19/30/47/592193047.db2.gz APLYSSMEHRVJRP-QMMMGPOBSA-N 1 2 221.235 2.060 20 0 BEADLO C[C@@H]([NH2+]Cc1cccc(O)c1)c1ncco1 ZINC000886275791 592195313 /nfs/dbraw/zinc/19/53/13/592195313.db2.gz MGPJHNSRYIHBGH-SECBINFHSA-N 1 2 218.256 2.231 20 0 BEADLO COc1cccc(NCc2[nH+]ccn2C)c1OC ZINC000886276148 592195743 /nfs/dbraw/zinc/19/57/43/592195743.db2.gz YIUSCKBRHLOPPH-UHFFFAOYSA-N 1 2 247.298 2.049 20 0 BEADLO COc1ccc(C[NH2+][C@@H](C)c2ncco2)cc1O ZINC000886275526 592195889 /nfs/dbraw/zinc/19/58/89/592195889.db2.gz CCDKXSGWFNMBJN-VIFPVBQESA-N 1 2 248.282 2.240 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ncco1)c1cccnc1 ZINC000886530014 592247033 /nfs/dbraw/zinc/24/70/33/592247033.db2.gz BJIWYNQLUIFOPL-ZJUUUORDSA-N 1 2 217.272 2.481 20 0 BEADLO CCc1noc(C)c1C[NH2+][C@H](C)c1ncco1 ZINC000886533220 592248941 /nfs/dbraw/zinc/24/89/41/592248941.db2.gz XAXOKASLVFLHQH-MRVPVSSYSA-N 1 2 235.287 2.384 20 0 BEADLO Cc1cncc(C[NH2+][C@@H](C)c2ncco2)c1 ZINC000886538582 592252025 /nfs/dbraw/zinc/25/20/25/592252025.db2.gz KQRABNCDJDDBNZ-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO COC(=O)[C@@H]1CC[C@@H]([NH2+]c2ccc(OC)cc2)C1 ZINC000886564230 592261749 /nfs/dbraw/zinc/26/17/49/592261749.db2.gz QLWKKMFWOKQQMT-ZYHUDNBSSA-N 1 2 249.310 2.449 20 0 BEADLO CC[C@@H](C)CC(=O)N1CCc2c([nH+]cn2CC)C1 ZINC000886614744 592275974 /nfs/dbraw/zinc/27/59/74/592275974.db2.gz IWMFKZUQBGZKGW-LLVKDONJSA-N 1 2 249.358 2.224 20 0 BEADLO CCc1ncc(C[NH2+][C@@H]2CCc3cccnc32)o1 ZINC000886620406 592278366 /nfs/dbraw/zinc/27/83/66/592278366.db2.gz JFCCFYRANVZPMW-GFCCVEGCSA-N 1 2 243.310 2.409 20 0 BEADLO C[C@@H]([NH2+]Cc1cc(C2CC2)no1)c1cnccn1 ZINC000886683004 592302538 /nfs/dbraw/zinc/30/25/38/592302538.db2.gz VDUPRMQCKVOTIS-SECBINFHSA-N 1 2 244.298 2.193 20 0 BEADLO COC(=O)[C@@H]1CSCC[N@@H+]1CCCC(C)C ZINC000887077438 592435585 /nfs/dbraw/zinc/43/55/85/592435585.db2.gz MBRYYFKRESIXJO-NSHDSACASA-N 1 2 245.388 2.013 20 0 BEADLO COC(=O)[C@@H]1CSCC[N@H+]1CCCC(C)C ZINC000887077438 592435587 /nfs/dbraw/zinc/43/55/87/592435587.db2.gz MBRYYFKRESIXJO-NSHDSACASA-N 1 2 245.388 2.013 20 0 BEADLO FC(F)C[N@H+](CCn1cccn1)C1CCC1 ZINC000887098785 592441445 /nfs/dbraw/zinc/44/14/45/592441445.db2.gz BORWUACVEZBBGF-UHFFFAOYSA-N 1 2 229.274 2.003 20 0 BEADLO FC(F)C[N@@H+](CCn1cccn1)C1CCC1 ZINC000887098785 592441446 /nfs/dbraw/zinc/44/14/46/592441446.db2.gz BORWUACVEZBBGF-UHFFFAOYSA-N 1 2 229.274 2.003 20 0 BEADLO CCC[C@@H](O)C[N@H+](CC(F)F)C1CCC1 ZINC000887102135 592443410 /nfs/dbraw/zinc/44/34/10/592443410.db2.gz DMPLNEGDCTXZIR-SNVBAGLBSA-N 1 2 221.291 2.267 20 0 BEADLO CCC[C@@H](O)C[N@@H+](CC(F)F)C1CCC1 ZINC000887102135 592443413 /nfs/dbraw/zinc/44/34/13/592443413.db2.gz DMPLNEGDCTXZIR-SNVBAGLBSA-N 1 2 221.291 2.267 20 0 BEADLO C[N@H+](CCCF)Cc1ncn(-c2ccccc2)n1 ZINC000887141488 592454574 /nfs/dbraw/zinc/45/45/74/592454574.db2.gz WKUQEMPKBVVVMI-UHFFFAOYSA-N 1 2 248.305 2.059 20 0 BEADLO C[N@@H+](CCCF)Cc1ncn(-c2ccccc2)n1 ZINC000887141488 592454577 /nfs/dbraw/zinc/45/45/77/592454577.db2.gz WKUQEMPKBVVVMI-UHFFFAOYSA-N 1 2 248.305 2.059 20 0 BEADLO COCc1nc(C[N@H+](C)CCCF)cs1 ZINC000887139004 592455571 /nfs/dbraw/zinc/45/55/71/592455571.db2.gz VXSQLANJRCIGCK-UHFFFAOYSA-N 1 2 232.324 2.081 20 0 BEADLO COCc1nc(C[N@@H+](C)CCCF)cs1 ZINC000887139004 592455575 /nfs/dbraw/zinc/45/55/75/592455575.db2.gz VXSQLANJRCIGCK-UHFFFAOYSA-N 1 2 232.324 2.081 20 0 BEADLO CC(C)c1nnc(C[N@H+](C)CCCF)s1 ZINC000887142754 592459139 /nfs/dbraw/zinc/45/91/39/592459139.db2.gz YRGRYNNQPJEZOP-UHFFFAOYSA-N 1 2 231.340 2.453 20 0 BEADLO CC(C)c1nnc(C[N@@H+](C)CCCF)s1 ZINC000887142754 592459140 /nfs/dbraw/zinc/45/91/40/592459140.db2.gz YRGRYNNQPJEZOP-UHFFFAOYSA-N 1 2 231.340 2.453 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@]12C[C@@H]1CC[C@@H](C1)C2 ZINC000887330038 592481801 /nfs/dbraw/zinc/48/18/01/592481801.db2.gz WRAUFORZLUKSLT-GNXNZQSNSA-N 1 2 236.359 2.123 20 0 BEADLO C[C@H]1CN(C(=O)Nc2ccc3[nH+]ccn3c2)[C@H]1C ZINC000887801673 592553400 /nfs/dbraw/zinc/55/34/00/592553400.db2.gz QJRHDSZUIHBQCL-UWVGGRQHSA-N 1 2 244.298 2.206 20 0 BEADLO CCCCC1(NC(=O)CNc2cccc[nH+]2)CC1 ZINC000889525739 592617564 /nfs/dbraw/zinc/61/75/64/592617564.db2.gz WKGKNRDKSNLHRJ-UHFFFAOYSA-N 1 2 247.342 2.333 20 0 BEADLO CCC[C@H]1CCC[C@@H]1C(=O)NCc1cn(C)c[nH+]1 ZINC000890107806 592683381 /nfs/dbraw/zinc/68/33/81/592683381.db2.gz QXUPZRKDWHRIBQ-AAEUAGOBSA-N 1 2 249.358 2.253 20 0 BEADLO C[C@@H](CC1CCCC1)C(=O)NCc1cn(C)c[nH+]1 ZINC000890113378 592683629 /nfs/dbraw/zinc/68/36/29/592683629.db2.gz BBAMBOWJPJBWQP-NSHDSACASA-N 1 2 249.358 2.253 20 0 BEADLO CCC(CC)(CC)C(=O)NCc1cn(C)c[nH+]1 ZINC000890110784 592684379 /nfs/dbraw/zinc/68/43/79/592684379.db2.gz UWUNBVAFZWGOGR-UHFFFAOYSA-N 1 2 237.347 2.253 20 0 BEADLO Cn1c[nH+]c(CNC(=O)CC2CCCCC2)c1 ZINC000890119627 592685525 /nfs/dbraw/zinc/68/55/25/592685525.db2.gz LRACBFXCUNPHCW-UHFFFAOYSA-N 1 2 235.331 2.007 20 0 BEADLO CCCCCCC(=O)NCc1cn(C)c[nH+]1 ZINC000890117238 592685934 /nfs/dbraw/zinc/68/59/34/592685934.db2.gz NSPNKEITALHLTA-UHFFFAOYSA-N 1 2 223.320 2.007 20 0 BEADLO C[C@@H]([NH2+]C[C@H]1CC1(Cl)Cl)C(F)F ZINC000895726085 636175410 /nfs/dbraw/zinc/17/54/10/636175410.db2.gz ZRYNXHVOJMZYRK-RFZPGFLSSA-N 1 2 218.074 2.423 20 0 BEADLO Nc1cc(COC(=O)C[C@H]2CC=CCC2)cc[nH+]1 ZINC000924243863 635532537 /nfs/dbraw/zinc/53/25/37/635532537.db2.gz ACDGMFKJVUGUQY-NSHDSACASA-N 1 2 246.310 2.453 20 0 BEADLO O=C(C1CCCC1)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000075556040 631266102 /nfs/dbraw/zinc/26/61/02/631266102.db2.gz XHZUSSDXRYJISF-GFCCVEGCSA-N 1 2 247.342 2.306 20 0 BEADLO COC[C@H]1COCC[N@@H+]1C/C=C/c1ccccc1 ZINC000933334149 631269994 /nfs/dbraw/zinc/26/99/94/631269994.db2.gz DYYUJSXECBZVER-PXTSUWAFSA-N 1 2 247.338 2.047 20 0 BEADLO COC[C@H]1COCC[N@H+]1C/C=C/c1ccccc1 ZINC000933334149 631269999 /nfs/dbraw/zinc/26/99/99/631269999.db2.gz DYYUJSXECBZVER-PXTSUWAFSA-N 1 2 247.338 2.047 20 0 BEADLO COCC[N@H+](C)Cc1occc1Br ZINC000308368284 631304918 /nfs/dbraw/zinc/30/49/18/631304918.db2.gz OZVCBXPANUADLR-UHFFFAOYSA-N 1 2 248.120 2.120 20 0 BEADLO COCC[N@@H+](C)Cc1occc1Br ZINC000308368284 631304921 /nfs/dbraw/zinc/30/49/21/631304921.db2.gz OZVCBXPANUADLR-UHFFFAOYSA-N 1 2 248.120 2.120 20 0 BEADLO Cc1ncsc1C[N@@H+](C)Cc1cccc(=O)[nH]1 ZINC000933402307 631363892 /nfs/dbraw/zinc/36/38/92/631363892.db2.gz SEHZMVWHNHJDBC-UHFFFAOYSA-N 1 2 249.339 2.184 20 0 BEADLO Cc1ncsc1C[N@H+](C)Cc1cccc(=O)[nH]1 ZINC000933402307 631363897 /nfs/dbraw/zinc/36/38/97/631363897.db2.gz SEHZMVWHNHJDBC-UHFFFAOYSA-N 1 2 249.339 2.184 20 0 BEADLO C[C@H]1Cc2cc(C[N@@H+]3CCOC[C@@H]3C)ccc2O1 ZINC000891696881 631451818 /nfs/dbraw/zinc/45/18/18/631451818.db2.gz ZCTGAOKSSZBGKM-RYUDHWBXSA-N 1 2 247.338 2.231 20 0 BEADLO C[C@H]1Cc2cc(C[N@H+]3CCOC[C@@H]3C)ccc2O1 ZINC000891696881 631451823 /nfs/dbraw/zinc/45/18/23/631451823.db2.gz ZCTGAOKSSZBGKM-RYUDHWBXSA-N 1 2 247.338 2.231 20 0 BEADLO CNc1cc(N[C@H]2CC[C@@H](SC)C2)[nH+]cn1 ZINC000234535163 631568009 /nfs/dbraw/zinc/56/80/09/631568009.db2.gz BAUBUIUXQNCDFA-DTWKUNHWSA-N 1 2 238.360 2.214 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1[nH]nc(C)c1C ZINC000893897205 635639815 /nfs/dbraw/zinc/63/98/15/635639815.db2.gz PNDPZOASNOKBQY-SKDRFNHKSA-N 1 2 237.347 2.026 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1[nH]nc(C)c1C ZINC000893897205 635639820 /nfs/dbraw/zinc/63/98/20/635639820.db2.gz PNDPZOASNOKBQY-SKDRFNHKSA-N 1 2 237.347 2.026 20 0 BEADLO C[C@H](c1c(F)cccc1F)[N@@H+]1CC[C@@H]1CO ZINC000934024774 631599761 /nfs/dbraw/zinc/59/97/61/631599761.db2.gz ABLNJBSVTNJYBT-RKDXNWHRSA-N 1 2 227.254 2.092 20 0 BEADLO C[C@H](c1c(F)cccc1F)[N@H+]1CC[C@@H]1CO ZINC000934024774 631599763 /nfs/dbraw/zinc/59/97/63/631599763.db2.gz ABLNJBSVTNJYBT-RKDXNWHRSA-N 1 2 227.254 2.092 20 0 BEADLO OC[C@@H]1CC[N@@H+]1Cc1ccc(F)cc1Cl ZINC000934016023 631610502 /nfs/dbraw/zinc/61/05/02/631610502.db2.gz JNHRUUWRQIYKAN-JTQLQIEISA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@@H]1CC[N@H+]1Cc1ccc(F)cc1Cl ZINC000934016023 631610503 /nfs/dbraw/zinc/61/05/03/631610503.db2.gz JNHRUUWRQIYKAN-JTQLQIEISA-N 1 2 229.682 2.046 20 0 BEADLO CC/C=C(/C)C(=O)NCc1ccn2cc[nH+]c2c1 ZINC000255516732 631910228 /nfs/dbraw/zinc/91/02/28/631910228.db2.gz TVSXJRQILKDYFZ-WCIBSUBMSA-N 1 2 243.310 2.307 20 0 BEADLO Cc1ccc(C[N@@H+]2CC[C@@H](O)[C@H](F)C2)cc1F ZINC000934569433 631940823 /nfs/dbraw/zinc/94/08/23/631940823.db2.gz YEEKVLLYJRNLEZ-CHWSQXEVSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1ccc(C[N@H+]2CC[C@@H](O)[C@H](F)C2)cc1F ZINC000934569433 631940827 /nfs/dbraw/zinc/94/08/27/631940827.db2.gz YEEKVLLYJRNLEZ-CHWSQXEVSA-N 1 2 241.281 2.039 20 0 BEADLO CC[NH2+]Cc1noc(Cc2ccccc2C)n1 ZINC000051860534 631970972 /nfs/dbraw/zinc/97/09/72/631970972.db2.gz APEGQJHTRPOWRI-UHFFFAOYSA-N 1 2 231.299 2.078 20 0 BEADLO CN(c1nccn2c[nH+]cc12)C1CC(C)(C)C1 ZINC000894167978 635728276 /nfs/dbraw/zinc/72/82/76/635728276.db2.gz RGKQXFBDWPPGCL-UHFFFAOYSA-N 1 2 230.315 2.354 20 0 BEADLO CCOC(=O)/C=C/C[NH+]1Cc2ccccc2C1 ZINC000131129590 632452655 /nfs/dbraw/zinc/45/26/55/632452655.db2.gz WFBLWXXKATUUKK-VMPITWQZSA-N 1 2 231.295 2.122 20 0 BEADLO c1cc(C[NH2+][C@H]2CCCc3cn[nH]c32)co1 ZINC000309537225 632475900 /nfs/dbraw/zinc/47/59/00/632475900.db2.gz CZTTZFFTUWXPRB-NSHDSACASA-N 1 2 217.272 2.170 20 0 BEADLO c1cc(C[NH2+][C@H]2CCCc3c[nH]nc32)co1 ZINC000309537225 632475904 /nfs/dbraw/zinc/47/59/04/632475904.db2.gz CZTTZFFTUWXPRB-NSHDSACASA-N 1 2 217.272 2.170 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCCC[C@H]1F)c1cc(CO)on1 ZINC000926587798 632595998 /nfs/dbraw/zinc/59/59/98/632595998.db2.gz QDYKPAIYQHLWIR-JMJZKYOTSA-N 1 2 242.294 2.098 20 0 BEADLO c1nc(C[NH2+][C@H]2CCCc3n[nH]cc32)cs1 ZINC000309712645 632655744 /nfs/dbraw/zinc/65/57/44/632655744.db2.gz XPRDELUPFKOQEL-JTQLQIEISA-N 1 2 234.328 2.033 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@@H]1CS[C@H](C(C)C)C1 ZINC000309960293 632687602 /nfs/dbraw/zinc/68/76/02/632687602.db2.gz KRYJDAHGKVUAOA-DCAQKATOSA-N 1 2 245.388 2.058 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](C)c2nonc2C)c1 ZINC000926659256 632783541 /nfs/dbraw/zinc/78/35/41/632783541.db2.gz GBVDJUOSVSSKSU-QMMMGPOBSA-N 1 2 248.286 2.093 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2CO[C@H](C)[C@@H]2C)c1 ZINC000926664223 632791295 /nfs/dbraw/zinc/79/12/95/632791295.db2.gz XIEIDXZFRIARMO-HOSYDEDBSA-N 1 2 236.315 2.063 20 0 BEADLO CCc1noc([C@@H](CC(C)C)n2cc[nH+]c2)n1 ZINC000923778270 632804819 /nfs/dbraw/zinc/80/48/19/632804819.db2.gz XRELVAUCJRQLPS-SNVBAGLBSA-N 1 2 234.303 2.464 20 0 BEADLO CC[C@H](CSC)[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000162113206 633021831 /nfs/dbraw/zinc/02/18/31/633021831.db2.gz ZLUSYXKACHVPAI-VHSXEESVSA-N 1 2 247.404 2.448 20 0 BEADLO C[N@H+](Cc1cnon1)[C@@H]1CCc2ccccc21 ZINC000851724890 633169869 /nfs/dbraw/zinc/16/98/69/633169869.db2.gz LLDVORBDZJVCCM-CYBMUJFWSA-N 1 2 229.283 2.189 20 0 BEADLO C[N@@H+](Cc1cnon1)[C@@H]1CCc2ccccc21 ZINC000851724890 633169872 /nfs/dbraw/zinc/16/98/72/633169872.db2.gz LLDVORBDZJVCCM-CYBMUJFWSA-N 1 2 229.283 2.189 20 0 BEADLO CCc1cc(NC[C@@H](C)CCO)nc(CC)[nH+]1 ZINC000892729976 633204177 /nfs/dbraw/zinc/20/41/77/633204177.db2.gz DNEBUQVIFILXLE-JTQLQIEISA-N 1 2 237.347 2.032 20 0 BEADLO Cc1cccc([C@H](C)NC(=O)Cc2c[nH]c[nH+]2)c1 ZINC000909424214 636030612 /nfs/dbraw/zinc/03/06/12/636030612.db2.gz MTNUIEFSUAHKFZ-NSHDSACASA-N 1 2 243.310 2.138 20 0 BEADLO CC[NH2+]Cc1noc(Cc2cc(C)ccc2C)n1 ZINC000053145807 633766385 /nfs/dbraw/zinc/76/63/85/633766385.db2.gz LMKJJQOYEIYPIW-UHFFFAOYSA-N 1 2 245.326 2.387 20 0 BEADLO CN(C)c1cc(NCc2cccs2)[nH+]cn1 ZINC000309473282 635467001 /nfs/dbraw/zinc/46/70/01/635467001.db2.gz RDYMTRROJMTJDJ-UHFFFAOYSA-N 1 2 234.328 2.216 20 0 BEADLO CN(C)c1cc(NCc2cccs2)nc[nH+]1 ZINC000309473282 635467006 /nfs/dbraw/zinc/46/70/06/635467006.db2.gz RDYMTRROJMTJDJ-UHFFFAOYSA-N 1 2 234.328 2.216 20 0 BEADLO CCc1cc(N2C[C@@H]3C[C@H]2CS3)nc(CC)[nH+]1 ZINC000894172126 635737472 /nfs/dbraw/zinc/73/74/72/635737472.db2.gz QAKHQJPQNVZBHM-QWRGUYRKSA-N 1 2 249.383 2.296 20 0 BEADLO C[C@@H]1[C@@H](C)[C@H](C)CN1c1cc(N(C)C)[nH+]cn1 ZINC000894235690 635762051 /nfs/dbraw/zinc/76/20/51/635762051.db2.gz OXIOWVXDTXYFRK-OUAUKWLOSA-N 1 2 234.347 2.023 20 0 BEADLO C[C@@H]1[C@@H](C)[C@H](C)CN1c1cc(N(C)C)nc[nH+]1 ZINC000894235690 635762057 /nfs/dbraw/zinc/76/20/57/635762057.db2.gz OXIOWVXDTXYFRK-OUAUKWLOSA-N 1 2 234.347 2.023 20 0 BEADLO CCC1CN(C(=O)c2c(C)cc(C)[nH+]c2C)C1 ZINC000909573156 636264269 /nfs/dbraw/zinc/26/42/69/636264269.db2.gz MNKDZOWLAVJDEZ-UHFFFAOYSA-N 1 2 232.327 2.489 20 0 BEADLO CC(C)(O)c1ccc(C[NH2+]Cc2ccon2)cc1 ZINC000310644509 636269802 /nfs/dbraw/zinc/26/98/02/636269802.db2.gz VEGRTVDQZNNYCA-UHFFFAOYSA-N 1 2 246.310 2.192 20 0 BEADLO CCc1cc(N[C@@H](C)C(C)(C)O)nc(CC)[nH+]1 ZINC000897328596 636341259 /nfs/dbraw/zinc/34/12/59/636341259.db2.gz QZXAWNSXIBWRJA-VIFPVBQESA-N 1 2 237.347 2.173 20 0 BEADLO C[C@@H](c1nc([C@@H]2CCCS2)no1)[NH+](C)C ZINC000350610305 636434289 /nfs/dbraw/zinc/43/42/89/636434289.db2.gz YTJVGYMQSOHOMB-YUMQZZPRSA-N 1 2 227.333 2.260 20 0 BEADLO C[C@]12CSC[C@H]1CN(c1cc[nH+]cc1F)C2 ZINC000897486917 636716859 /nfs/dbraw/zinc/71/68/59/636716859.db2.gz UQQHNYGVSGNXFO-SKDRFNHKSA-N 1 2 238.331 2.410 20 0 BEADLO Cl/C=C\CNc1cc(NCC2CC2)[nH+]cn1 ZINC000897506241 636731074 /nfs/dbraw/zinc/73/10/74/636731074.db2.gz XAQBADUMUFTHNM-RJRFIUFISA-N 1 2 238.722 2.463 20 0 BEADLO Cl/C=C\CNc1cc(NCC2CC2)nc[nH+]1 ZINC000897506241 636731081 /nfs/dbraw/zinc/73/10/81/636731081.db2.gz XAQBADUMUFTHNM-RJRFIUFISA-N 1 2 238.722 2.463 20 0 BEADLO O=C1c2ccccc2OC/C1=C\c1[nH]cc[nH+]1 ZINC000067647723 636758049 /nfs/dbraw/zinc/75/80/49/636758049.db2.gz PVMOLDJCCQLOPM-VQHVLOKHSA-N 1 2 226.235 2.068 20 0 BEADLO COc1ccc(C(=O)/C=C/c2[nH]cc[nH+]2)cc1F ZINC000067647865 636758718 /nfs/dbraw/zinc/75/87/18/636758718.db2.gz RYJNBCWWSXBTCN-HWKANZROSA-N 1 2 246.241 2.454 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccon2)cc(C)c1O ZINC000148734831 636833699 /nfs/dbraw/zinc/83/36/99/636833699.db2.gz CFSQUQDWPOATKP-UHFFFAOYSA-N 1 2 232.283 2.287 20 0 BEADLO CNc1cc(N[C@@H]2CC[C@H](C)C2)[nH+]cn1 ZINC000128149118 637009382 /nfs/dbraw/zinc/00/93/82/637009382.db2.gz QOWXHBNGAGUWHI-DTWKUNHWSA-N 1 2 206.293 2.119 20 0 BEADLO CC(C)(CNC(=O)C(C)(C)C1CC1)n1cc[nH+]c1 ZINC000898910127 637064193 /nfs/dbraw/zinc/06/41/93/637064193.db2.gz ZOWMUWKJYOZUFQ-UHFFFAOYSA-N 1 2 249.358 2.171 20 0 BEADLO C[C@H](c1nc([C@H]2CC2(C)C)no1)[NH+](C)C ZINC000923812537 637079023 /nfs/dbraw/zinc/07/90/23/637079023.db2.gz CFDSIQXEYNQYID-HTQZYQBOSA-N 1 2 209.293 2.206 20 0 BEADLO CCC1CCC(N(C)C(=O)Cc2c[nH+]c[nH]2)CC1 ZINC000900139680 637171696 /nfs/dbraw/zinc/17/16/96/637171696.db2.gz BKLDKRRFPIWNFT-UHFFFAOYSA-N 1 2 249.358 2.379 20 0 BEADLO CC(C)(C)c1ccn(Cc2ccc(N)[nH+]c2)n1 ZINC000902419796 637303981 /nfs/dbraw/zinc/30/39/81/637303981.db2.gz VWWSNKOIGKGNEL-UHFFFAOYSA-N 1 2 230.315 2.206 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1noc([C@@H]2CC23CC3)n1 ZINC000904268585 637395501 /nfs/dbraw/zinc/39/55/01/637395501.db2.gz VXHPRQMDIXTJMQ-VIFPVBQESA-N 1 2 242.282 2.290 20 0 BEADLO CC[NH2+]Cc1noc(C[C@H]2CC=CCC2)n1 ZINC000904493342 637420133 /nfs/dbraw/zinc/42/01/33/637420133.db2.gz BOKFZUHCTWHPDW-JTQLQIEISA-N 1 2 221.304 2.078 20 0 BEADLO Cc1[nH]cc(-c2ccc3c(c2)OCC3)[nH+]1 ZINC000904899467 637527686 /nfs/dbraw/zinc/52/76/86/637527686.db2.gz PTOASPDLTNQCGE-UHFFFAOYSA-N 1 2 200.241 2.320 20 0 BEADLO CSCCNC(=O)c1c(C)cc(C)[nH+]c1C ZINC000905259428 637716147 /nfs/dbraw/zinc/71/61/47/637716147.db2.gz TXXNBAWDOJRMAY-UHFFFAOYSA-N 1 2 238.356 2.100 20 0 BEADLO CC[C@H](C)[C@@H]([NH2+][C@H]1CSC1(C)C)C(=O)OC ZINC000905767255 637923818 /nfs/dbraw/zinc/92/38/18/637923818.db2.gz JQUOOPJGTDNAGY-LPEHRKFASA-N 1 2 245.388 2.058 20 0 BEADLO Cc1cc(C)c(C(=O)NC[C@@H]2C[C@@H]2C)c(C)[nH+]1 ZINC000906165004 638079638 /nfs/dbraw/zinc/07/96/38/638079638.db2.gz YMXIDXIKHRXDPM-UFBFGSQYSA-N 1 2 232.327 2.393 20 0 BEADLO OCc1ccccc1-c1c[nH+]c2c(c1)CCCN2 ZINC000906177671 638087056 /nfs/dbraw/zinc/08/70/56/638087056.db2.gz ILDXRWXPKHVQLC-UHFFFAOYSA-N 1 2 240.306 2.242 20 0 BEADLO Cc1[nH+]cc(-c2cncc(OC(F)F)c2)n1C ZINC000906207930 638105906 /nfs/dbraw/zinc/10/59/06/638105906.db2.gz NKFXSOHVJHHWHB-UHFFFAOYSA-N 1 2 239.225 2.392 20 0 BEADLO CC(=O)C[C@H](C)NC(=O)c1c(C)cc(C)[nH+]c1C ZINC000907102038 638300477 /nfs/dbraw/zinc/30/04/77/638300477.db2.gz QPZBZEWIIMORDL-JTQLQIEISA-N 1 2 248.326 2.104 20 0 BEADLO C[C@@H]1CCC[C@@H]1CNC(=O)CNc1cccc[nH+]1 ZINC000907973650 638529985 /nfs/dbraw/zinc/52/99/85/638529985.db2.gz MVNKHDMNRBTUMX-VXGBXAGGSA-N 1 2 247.342 2.046 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)NC(C1CCC1)C1CCC1 ZINC000908171452 638586014 /nfs/dbraw/zinc/58/60/14/638586014.db2.gz YIEDOLRSCBUJIU-UHFFFAOYSA-N 1 2 247.342 2.037 20 0 BEADLO Cc1cc(C)c(C(=O)N2C[C@H](C)[C@H]2C)c(C)[nH+]1 ZINC000908437076 638713576 /nfs/dbraw/zinc/71/35/76/638713576.db2.gz YSJVGGMYFKJLJA-JOYOIKCWSA-N 1 2 232.327 2.487 20 0 BEADLO c1cc(C2CC[NH+](Cc3cocn3)CC2)no1 ZINC000668714227 639044404 /nfs/dbraw/zinc/04/44/04/639044404.db2.gz OORHPMNWUJTXTD-UHFFFAOYSA-N 1 2 233.271 2.042 20 0 BEADLO CC(C)[C@@H]1[C@@H](C(C)C)CN1C(=O)Cc1c[nH+]c[nH]1 ZINC000909052760 639132244 /nfs/dbraw/zinc/13/22/44/639132244.db2.gz SMKCWSGDAHODBE-TZMCWYRMSA-N 1 2 249.358 2.091 20 0 BEADLO C[C@@H]1C[C@@H]2C[C@@H]2C[C@@H]1C(=O)OCCn1cc[nH+]c1 ZINC000910076196 639365980 /nfs/dbraw/zinc/36/59/80/639365980.db2.gz KZPOICICEDFWLR-LPWJVIDDSA-N 1 2 248.326 2.109 20 0 BEADLO CC(C)(C)[C@H]1CCC[C@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000910470520 639462744 /nfs/dbraw/zinc/46/27/44/639462744.db2.gz SEFWNOMBQOPQPD-NWDGAFQWSA-N 1 2 249.358 2.283 20 0 BEADLO CCc1ncc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)o1 ZINC000930243773 639653221 /nfs/dbraw/zinc/65/32/21/639653221.db2.gz IJCCSAFDTGXAHW-GXSJLCMTSA-N 1 2 226.295 2.417 20 0 BEADLO CCc1ncc(C[N@H+]2CC[C@H](C)[C@H](F)C2)o1 ZINC000930243773 639653232 /nfs/dbraw/zinc/65/32/32/639653232.db2.gz IJCCSAFDTGXAHW-GXSJLCMTSA-N 1 2 226.295 2.417 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)N1CCCC[C@H]1C1CCC1 ZINC000911606903 639675148 /nfs/dbraw/zinc/67/51/48/639675148.db2.gz UVSRGSFHBZIPHO-ZDUSSCGKSA-N 1 2 247.342 2.133 20 0 BEADLO CC[N@@H+](Cc1nnc(OC)s1)CC1CCC1 ZINC000930293466 639684531 /nfs/dbraw/zinc/68/45/31/639684531.db2.gz SRVSMCRRZBXSRU-UHFFFAOYSA-N 1 2 241.360 2.169 20 0 BEADLO CC[N@H+](Cc1nnc(OC)s1)CC1CCC1 ZINC000930293466 639684538 /nfs/dbraw/zinc/68/45/38/639684538.db2.gz SRVSMCRRZBXSRU-UHFFFAOYSA-N 1 2 241.360 2.169 20 0 BEADLO FCc1ccccc1C[N@@H+]1CCc2nc[nH]c2C1 ZINC000930515874 639793854 /nfs/dbraw/zinc/79/38/54/639793854.db2.gz ROHZWKWIPDGIED-UHFFFAOYSA-N 1 2 245.301 2.438 20 0 BEADLO FCc1ccccc1C[N@H+]1CCc2nc[nH]c2C1 ZINC000930515874 639793860 /nfs/dbraw/zinc/79/38/60/639793860.db2.gz ROHZWKWIPDGIED-UHFFFAOYSA-N 1 2 245.301 2.438 20 0 BEADLO C[C@H](c1ccc(F)nc1)[N@@H+]1CC[C@H](F)C1 ZINC000930603025 639817273 /nfs/dbraw/zinc/81/72/73/639817273.db2.gz HAEXDHYIXUJQLA-SCZZXKLOSA-N 1 2 212.243 2.326 20 0 BEADLO C[C@H](c1ccc(F)nc1)[N@H+]1CC[C@H](F)C1 ZINC000930603025 639817274 /nfs/dbraw/zinc/81/72/74/639817274.db2.gz HAEXDHYIXUJQLA-SCZZXKLOSA-N 1 2 212.243 2.326 20 0 BEADLO CC1CC(C[N@H+](C)Cc2noc(C3CC3)n2)C1 ZINC000930738839 639887571 /nfs/dbraw/zinc/88/75/71/639887571.db2.gz XXPCLBRZAMUKSL-UHFFFAOYSA-N 1 2 235.331 2.425 20 0 BEADLO CC1CC(C[N@@H+](C)Cc2noc(C3CC3)n2)C1 ZINC000930738839 639887576 /nfs/dbraw/zinc/88/75/76/639887576.db2.gz XXPCLBRZAMUKSL-UHFFFAOYSA-N 1 2 235.331 2.425 20 0 BEADLO CC/C=C\CC[NH2+][C@]1(C)CC(C)(C)OC1=O ZINC000930873692 639964125 /nfs/dbraw/zinc/96/41/25/639964125.db2.gz AUHQHYLTDRDQJY-FMFIFOJESA-N 1 2 225.332 2.417 20 0 BEADLO CC/C=C\CC[NH2+][C@@]1(C)CC(C)(C)OC1=O ZINC000930873693 639965664 /nfs/dbraw/zinc/96/56/64/639965664.db2.gz AUHQHYLTDRDQJY-FWWRYZNZSA-N 1 2 225.332 2.417 20 0 BEADLO CC1(C)C[C@@](C)([NH2+]CCc2ccccc2)C(=O)O1 ZINC000930874195 639965940 /nfs/dbraw/zinc/96/59/40/639965940.db2.gz FPVURXHVLGDKQZ-OAHLLOKOSA-N 1 2 247.338 2.303 20 0 BEADLO C[N@@H+](Cc1cnc[nH]1)C[C@@H]1CCCC2(CCC2)O1 ZINC000930914471 639985192 /nfs/dbraw/zinc/98/51/92/639985192.db2.gz FCRRUFYBIDKIJY-ZDUSSCGKSA-N 1 2 249.358 2.333 20 0 BEADLO C[N@H+](Cc1cnc[nH]1)C[C@@H]1CCCC2(CCC2)O1 ZINC000930914471 639985196 /nfs/dbraw/zinc/98/51/96/639985196.db2.gz FCRRUFYBIDKIJY-ZDUSSCGKSA-N 1 2 249.358 2.333 20 0 BEADLO C[N@@H+](Cc1c[nH]cn1)C[C@@H]1CCCC2(CCC2)O1 ZINC000930914471 639985200 /nfs/dbraw/zinc/98/52/00/639985200.db2.gz FCRRUFYBIDKIJY-ZDUSSCGKSA-N 1 2 249.358 2.333 20 0 BEADLO C[N@H+](Cc1c[nH]cn1)C[C@@H]1CCCC2(CCC2)O1 ZINC000930914471 639985204 /nfs/dbraw/zinc/98/52/04/639985204.db2.gz FCRRUFYBIDKIJY-ZDUSSCGKSA-N 1 2 249.358 2.333 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2cscn2)c(C)nn1 ZINC000930963594 640002129 /nfs/dbraw/zinc/00/21/29/640002129.db2.gz KJAQQZAEYRSGCC-JTQLQIEISA-N 1 2 248.355 2.401 20 0 BEADLO c1nc([C@@H]2CCC[N@H+]2C[C@@H]2CC[C@@H]3C[C@@H]3C2)n[nH]1 ZINC000931140910 640074857 /nfs/dbraw/zinc/07/48/57/640074857.db2.gz AIEGRCAJXYDZHF-NDBYEHHHSA-N 1 2 246.358 2.378 20 0 BEADLO c1nc([C@@H]2CCC[N@@H+]2C[C@@H]2CC[C@@H]3C[C@@H]3C2)n[nH]1 ZINC000931140910 640074865 /nfs/dbraw/zinc/07/48/65/640074865.db2.gz AIEGRCAJXYDZHF-NDBYEHHHSA-N 1 2 246.358 2.378 20 0 BEADLO CC/C(C)=C\C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000912613944 640136505 /nfs/dbraw/zinc/13/65/05/640136505.db2.gz DOCGUCUPCRHRCO-FLIBITNWSA-N 1 2 235.331 2.091 20 0 BEADLO C[C@]12CCCC[C@H]1C[N@@H+]2Cc1nncs1 ZINC000931331948 640160081 /nfs/dbraw/zinc/16/00/81/640160081.db2.gz KDJSGNHNFAFDHX-ONGXEEELSA-N 1 2 223.345 2.303 20 0 BEADLO C[C@]12CCCC[C@H]1C[N@H+]2Cc1nncs1 ZINC000931331948 640160082 /nfs/dbraw/zinc/16/00/82/640160082.db2.gz KDJSGNHNFAFDHX-ONGXEEELSA-N 1 2 223.345 2.303 20 0 BEADLO CC(C)CC1(NC(=O)CNc2cccc[nH+]2)CC1 ZINC000912705986 640170580 /nfs/dbraw/zinc/17/05/80/640170580.db2.gz MQGPHHYATQYUAW-UHFFFAOYSA-N 1 2 247.342 2.188 20 0 BEADLO CC[C@@H]1CCC[C@H](C)N1C(=O)Cc1c[nH+]c[nH]1 ZINC000912716440 640174877 /nfs/dbraw/zinc/17/48/77/640174877.db2.gz GXPBWEREQHNZOO-CMPLNLGQSA-N 1 2 235.331 2.132 20 0 BEADLO Cc1ccc(C[N@@H+]2Cc3c[nH]nc3[C@@H](C)C2)nc1 ZINC000931461611 640218973 /nfs/dbraw/zinc/21/89/73/640218973.db2.gz WCRNDNBUKOBRSY-NSHDSACASA-N 1 2 242.326 2.232 20 0 BEADLO Cc1ccc(C[N@H+]2Cc3c[nH]nc3[C@@H](C)C2)nc1 ZINC000931461611 640218976 /nfs/dbraw/zinc/21/89/76/640218976.db2.gz WCRNDNBUKOBRSY-NSHDSACASA-N 1 2 242.326 2.232 20 0 BEADLO CCC(F)(F)C[N@H+]1Cc2c[nH]nc2[C@@H](C)C1 ZINC000931467163 640226800 /nfs/dbraw/zinc/22/68/00/640226800.db2.gz MUSBLWWQRMUEBK-QMMMGPOBSA-N 1 2 229.274 2.374 20 0 BEADLO CCC(F)(F)C[N@@H+]1Cc2c[nH]nc2[C@@H](C)C1 ZINC000931467163 640226805 /nfs/dbraw/zinc/22/68/05/640226805.db2.gz MUSBLWWQRMUEBK-QMMMGPOBSA-N 1 2 229.274 2.374 20 0 BEADLO C/C=C\CNC(=O)c1c(C)cc(C)[nH+]c1C ZINC000913165979 640315137 /nfs/dbraw/zinc/31/51/37/640315137.db2.gz FNKLBVVDWMPGMF-WAYWQWQTSA-N 1 2 218.300 2.313 20 0 BEADLO CC(C)c1nsc(C[N@@H+]2CC[C@H](CF)C2)n1 ZINC000931687691 640315453 /nfs/dbraw/zinc/31/54/53/640315453.db2.gz ZICAIFQKWUVDBP-SECBINFHSA-N 1 2 243.351 2.453 20 0 BEADLO CC(C)c1nsc(C[N@H+]2CC[C@H](CF)C2)n1 ZINC000931687691 640315461 /nfs/dbraw/zinc/31/54/61/640315461.db2.gz ZICAIFQKWUVDBP-SECBINFHSA-N 1 2 243.351 2.453 20 0 BEADLO C[C@@H]([NH2+]Cc1c[nH]cn1)c1cccs1 ZINC000054763757 640405074 /nfs/dbraw/zinc/40/50/74/640405074.db2.gz DEEIZVUJIFQZIT-MRVPVSSYSA-N 1 2 207.302 2.322 20 0 BEADLO C[C@@H]1CCC[C@H]1NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000932058644 640420119 /nfs/dbraw/zinc/42/01/19/640420119.db2.gz RAYCRBHXYDZODI-MWLCHTKSSA-N 1 2 243.310 2.481 20 0 BEADLO C[N@@H+](C/C(Cl)=C/Cl)C[C@@H](O)C1CC1 ZINC000156629516 640476206 /nfs/dbraw/zinc/47/62/06/640476206.db2.gz WHBGRCGZNXTSPX-USYJTPIQSA-N 1 2 224.131 2.008 20 0 BEADLO C[N@H+](C/C(Cl)=C/Cl)C[C@@H](O)C1CC1 ZINC000156629516 640476209 /nfs/dbraw/zinc/47/62/09/640476209.db2.gz WHBGRCGZNXTSPX-USYJTPIQSA-N 1 2 224.131 2.008 20 0 BEADLO Cc1nc(C[N@@H+]2CCO[C@@H](C)CC2)cs1 ZINC000932347201 640490192 /nfs/dbraw/zinc/49/01/92/640490192.db2.gz MQFNYHUYFKSXOY-VIFPVBQESA-N 1 2 226.345 2.062 20 0 BEADLO Cc1nc(C[N@H+]2CCO[C@@H](C)CC2)cs1 ZINC000932347201 640490198 /nfs/dbraw/zinc/49/01/98/640490198.db2.gz MQFNYHUYFKSXOY-VIFPVBQESA-N 1 2 226.345 2.062 20 0 BEADLO c1cc(C[NH2+][C@H](c2ccccn2)C2CC2)no1 ZINC000932378058 640505835 /nfs/dbraw/zinc/50/58/35/640505835.db2.gz KTDYGLYFKLREBP-ZDUSSCGKSA-N 1 2 229.283 2.311 20 0 BEADLO CNc1cc(N[C@@H](C)c2c(C)noc2C)nc[nH+]1 ZINC000156818471 640508556 /nfs/dbraw/zinc/50/85/56/640508556.db2.gz KECHFGFJAPJAGT-ZETCQYMHSA-N 1 2 247.302 2.296 20 0 BEADLO CNc1cc(N[C@@H](C)c2c(C)noc2C)[nH+]cn1 ZINC000156818471 640508573 /nfs/dbraw/zinc/50/85/73/640508573.db2.gz KECHFGFJAPJAGT-ZETCQYMHSA-N 1 2 247.302 2.296 20 0 BEADLO CSCC1CC[NH+](Cc2nncs2)CC1 ZINC000932591336 640581260 /nfs/dbraw/zinc/58/12/60/640581260.db2.gz XSACXSYFPADDRX-UHFFFAOYSA-N 1 2 243.401 2.113 20 0 BEADLO C[C@@H]1C(=O)CCC[N@H+]1CCCc1ccncc1 ZINC000932849073 640623162 /nfs/dbraw/zinc/62/31/62/640623162.db2.gz YWMLQBYVTXURMU-GFCCVEGCSA-N 1 2 232.327 2.068 20 0 BEADLO C[C@@H]1C(=O)CCC[N@@H+]1CCCc1ccncc1 ZINC000932849073 640623168 /nfs/dbraw/zinc/62/31/68/640623168.db2.gz YWMLQBYVTXURMU-GFCCVEGCSA-N 1 2 232.327 2.068 20 0 BEADLO C[C@@H]1C(=O)CCC[N@H+]1CCc1cccs1 ZINC000932858191 640626383 /nfs/dbraw/zinc/62/63/83/640626383.db2.gz CDYMQTCZXUOGPR-SNVBAGLBSA-N 1 2 223.341 2.344 20 0 BEADLO C[C@@H]1C(=O)CCC[N@@H+]1CCc1cccs1 ZINC000932858191 640626389 /nfs/dbraw/zinc/62/63/89/640626389.db2.gz CDYMQTCZXUOGPR-SNVBAGLBSA-N 1 2 223.341 2.344 20 0 BEADLO C[N@H+](Cc1ccncc1)Cc1ccc(Cl)nn1 ZINC000167228878 640707670 /nfs/dbraw/zinc/70/76/70/640707670.db2.gz ASVZRNCIQPXQPM-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[N@@H+](Cc1ccncc1)Cc1ccc(Cl)nn1 ZINC000167228878 640707675 /nfs/dbraw/zinc/70/76/75/640707675.db2.gz ASVZRNCIQPXQPM-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[C@@H]([NH2+][C@H]1COCc2ccccc21)c1ncc[nH]1 ZINC000226011293 640721952 /nfs/dbraw/zinc/72/19/52/640721952.db2.gz IVVPZYUGWZHOKB-MFKMUULPSA-N 1 2 243.310 2.332 20 0 BEADLO c1csc(C[NH2+][C@H]2CCc3cccnc32)n1 ZINC000226816606 640794618 /nfs/dbraw/zinc/79/46/18/640794618.db2.gz WMOZOHHFZBMFAX-JTQLQIEISA-N 1 2 231.324 2.315 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C1(C)C(C)(C)C1(C)C ZINC000933992182 640802554 /nfs/dbraw/zinc/80/25/54/640802554.db2.gz CTJWNPMHAUTFCN-UHFFFAOYSA-N 1 2 249.358 2.407 20 0 BEADLO C[N@H+](C/C(Cl)=C\Cl)C(C)(C)CO ZINC000228224724 640866928 /nfs/dbraw/zinc/86/69/28/640866928.db2.gz CXPLPPJOXVTNHG-QPJJXVBHSA-N 1 2 212.120 2.008 20 0 BEADLO C[N@@H+](C/C(Cl)=C\Cl)C(C)(C)CO ZINC000228224724 640866930 /nfs/dbraw/zinc/86/69/30/640866930.db2.gz CXPLPPJOXVTNHG-QPJJXVBHSA-N 1 2 212.120 2.008 20 0 BEADLO C[C@H]([NH2+]C1(C)CCC1)C(=O)OC(C)(C)C ZINC000228851459 640899464 /nfs/dbraw/zinc/89/94/64/640899464.db2.gz FRAJTDDCAZSLQJ-VIFPVBQESA-N 1 2 213.321 2.249 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+]1CCc2c(C)cccc2C1 ZINC000171609112 640995141 /nfs/dbraw/zinc/99/51/41/640995141.db2.gz WCHFBJXWPVJGOG-GFCCVEGCSA-N 1 2 247.338 2.305 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+]1CCc2c(C)cccc2C1 ZINC000171609112 640995147 /nfs/dbraw/zinc/99/51/47/640995147.db2.gz WCHFBJXWPVJGOG-GFCCVEGCSA-N 1 2 247.338 2.305 20 0 BEADLO CO[C@H]1CC[C@@H]1[N@H+](C)Cc1ncc(C(C)C)o1 ZINC000934111033 641074541 /nfs/dbraw/zinc/07/45/41/641074541.db2.gz QHPQLZWYUMRAPU-QWRGUYRKSA-N 1 2 238.331 2.407 20 0 BEADLO CO[C@H]1CC[C@@H]1[N@@H+](C)Cc1ncc(C(C)C)o1 ZINC000934111033 641074545 /nfs/dbraw/zinc/07/45/45/641074545.db2.gz QHPQLZWYUMRAPU-QWRGUYRKSA-N 1 2 238.331 2.407 20 0 BEADLO CO[C@H]1CC[C@H]1[N@H+](C)Cc1ncc(C2CC2)o1 ZINC000934114638 641080173 /nfs/dbraw/zinc/08/01/73/641080173.db2.gz KTEOGPOZBKRJTO-MNOVXSKESA-N 1 2 236.315 2.161 20 0 BEADLO CO[C@H]1CC[C@H]1[N@@H+](C)Cc1ncc(C2CC2)o1 ZINC000934114638 641080174 /nfs/dbraw/zinc/08/01/74/641080174.db2.gz KTEOGPOZBKRJTO-MNOVXSKESA-N 1 2 236.315 2.161 20 0 BEADLO CO[C@H]1CC[C@H]1[N@H+](C)Cc1ncc(Cl)s1 ZINC000934114293 641080603 /nfs/dbraw/zinc/08/06/03/641080603.db2.gz SAHSUMUKOULBKK-SFYZADRCSA-N 1 2 246.763 2.406 20 0 BEADLO CO[C@H]1CC[C@H]1[N@@H+](C)Cc1ncc(Cl)s1 ZINC000934114293 641080609 /nfs/dbraw/zinc/08/06/09/641080609.db2.gz SAHSUMUKOULBKK-SFYZADRCSA-N 1 2 246.763 2.406 20 0 BEADLO CN(C)c1ccc(NCc2ccoc2)c[nH+]1 ZINC000063047092 641122591 /nfs/dbraw/zinc/12/25/91/641122591.db2.gz NVJFEVNXCZZWTH-UHFFFAOYSA-N 1 2 217.272 2.353 20 0 BEADLO COc1c(C)c[nH+]c(CNC(=O)C=C(C)C)c1C ZINC000050448479 641149084 /nfs/dbraw/zinc/14/90/84/641149084.db2.gz SGBUQRCTBPWVHE-UHFFFAOYSA-N 1 2 248.326 2.289 20 0 BEADLO CSCC(C)(C)[NH2+]Cc1noc(C(C)C)n1 ZINC000934673038 641242798 /nfs/dbraw/zinc/24/27/98/641242798.db2.gz DPURAFMMIFXERG-UHFFFAOYSA-N 1 2 243.376 2.424 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc(O)c(F)c2)[C@@H](C)CO1 ZINC000232449653 641272830 /nfs/dbraw/zinc/27/28/30/641272830.db2.gz BNYJRGICVCEFDK-VHSXEESVSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc(O)c(F)c2)[C@@H](C)CO1 ZINC000232449653 641272855 /nfs/dbraw/zinc/27/28/55/641272855.db2.gz BNYJRGICVCEFDK-VHSXEESVSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccc(O)c(F)c2)[C@@H](C)CO1 ZINC000232449655 641274331 /nfs/dbraw/zinc/27/43/31/641274331.db2.gz BNYJRGICVCEFDK-UWVGGRQHSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccc(O)c(F)c2)[C@@H](C)CO1 ZINC000232449655 641274337 /nfs/dbraw/zinc/27/43/37/641274337.db2.gz BNYJRGICVCEFDK-UWVGGRQHSA-N 1 2 239.290 2.141 20 0 BEADLO COC(C)(C)CC[NH2+]C(C)(C)C(=O)OC(C)C ZINC000934819744 641279080 /nfs/dbraw/zinc/27/90/80/641279080.db2.gz JESGCHQLCIYZJM-UHFFFAOYSA-N 1 2 245.363 2.121 20 0 BEADLO Cc1cc(NC(=O)[C@]2(C)C=CCC2)c(C)c[nH+]1 ZINC000935015960 641319673 /nfs/dbraw/zinc/31/96/73/641319673.db2.gz MGWYSAOFPJBPOM-CQSZACIVSA-N 1 2 230.311 2.415 20 0 BEADLO CCCNc1cc(N2CCC(F)(F)C2)nc[nH+]1 ZINC000313309375 641555748 /nfs/dbraw/zinc/55/57/48/641555748.db2.gz FNOAXHYCKMOYSQ-UHFFFAOYSA-N 1 2 242.273 2.144 20 0 BEADLO CCCNc1cc(N2CCC(F)(F)C2)[nH+]cn1 ZINC000313309375 641555749 /nfs/dbraw/zinc/55/57/49/641555749.db2.gz FNOAXHYCKMOYSQ-UHFFFAOYSA-N 1 2 242.273 2.144 20 0 BEADLO CCC1(CNC(=O)/C=C/c2[nH]cc[nH+]2)CCC1 ZINC000493342319 641613256 /nfs/dbraw/zinc/61/32/56/641613256.db2.gz ZFMLALINNWDBBJ-SNAWJCMRSA-N 1 2 233.315 2.119 20 0 BEADLO CCCCSCC(=O)Nc1cc[nH+]c(C)c1 ZINC000914462366 641716681 /nfs/dbraw/zinc/71/66/81/641716681.db2.gz NGHVOJCYYAUUMV-UHFFFAOYSA-N 1 2 238.356 2.284 20 0 BEADLO Fc1ccc(CNc2cccc[nH+]2)cn1 ZINC000188539222 641758439 /nfs/dbraw/zinc/75/84/39/641758439.db2.gz OSPQMNHTFWOCJC-UHFFFAOYSA-N 1 2 203.220 2.228 20 0 BEADLO COC[C@H](C)C[NH2+]c1ccc(N(C)C)cc1 ZINC000153353665 641763754 /nfs/dbraw/zinc/76/37/54/641763754.db2.gz JWMOAVKFTVFACB-LLVKDONJSA-N 1 2 222.332 2.447 20 0 BEADLO COC[C@H](C)CNc1ccc([NH+](C)C)cc1 ZINC000153353665 641763758 /nfs/dbraw/zinc/76/37/58/641763758.db2.gz JWMOAVKFTVFACB-LLVKDONJSA-N 1 2 222.332 2.447 20 0 BEADLO CCCC[N@H+](Cn1ncn(C)c1=S)C1CC1 ZINC000914784673 641764936 /nfs/dbraw/zinc/76/49/36/641764936.db2.gz AUVRTMPVAYGJGM-UHFFFAOYSA-N 1 2 240.376 2.173 20 0 BEADLO CCCC[N@@H+](Cn1ncn(C)c1=S)C1CC1 ZINC000914784673 641764938 /nfs/dbraw/zinc/76/49/38/641764938.db2.gz AUVRTMPVAYGJGM-UHFFFAOYSA-N 1 2 240.376 2.173 20 0 BEADLO CC[C@H]1CCCC[C@H]1C(=O)NC1C[NH+](CC)C1 ZINC001031173187 641772001 /nfs/dbraw/zinc/77/20/01/641772001.db2.gz SCCWRMZREVLAOA-WCQYABFASA-N 1 2 238.375 2.023 20 0 BEADLO C[N@H+](Cc1ccco1)Cc1ccc(F)nc1 ZINC000189284620 641799765 /nfs/dbraw/zinc/79/97/65/641799765.db2.gz RWBKEUYBPWSFDW-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO C[N@@H+](Cc1ccco1)Cc1ccc(F)nc1 ZINC000189284620 641799768 /nfs/dbraw/zinc/79/97/68/641799768.db2.gz RWBKEUYBPWSFDW-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO CCC/C=C\C(=O)N1CC(Oc2cc[nH+]cc2)C1 ZINC000732760503 641867035 /nfs/dbraw/zinc/86/70/35/641867035.db2.gz AUXIZSKKUGMPKM-PLNGDYQASA-N 1 2 246.310 2.028 20 0 BEADLO Cc1cc(NC(=O)C=C(C2CC2)C2CC2)cc[nH+]1 ZINC000732767681 641869124 /nfs/dbraw/zinc/86/91/24/641869124.db2.gz QRAWXLRYYPCNNO-UHFFFAOYSA-N 1 2 242.322 2.497 20 0 BEADLO CCc1ccccc1C[NH2+]Cc1c[nH]cn1 ZINC000077901813 641887919 /nfs/dbraw/zinc/88/79/19/641887919.db2.gz VPIIEGGWTQFXLD-UHFFFAOYSA-N 1 2 215.300 2.262 20 0 BEADLO Cc1nc(N[C@H](CCO)c2cccs2)cc[nH+]1 ZINC000078301374 641912719 /nfs/dbraw/zinc/91/27/19/641912719.db2.gz KFGYKCOSNNZEJN-SNVBAGLBSA-N 1 2 249.339 2.382 20 0 BEADLO CS[C@@H]1CC[C@@H](Nc2cc[nH+]c(C)n2)C1 ZINC000078477655 641927117 /nfs/dbraw/zinc/92/71/17/641927117.db2.gz DWYAZYBNPNICAD-NXEZZACHSA-N 1 2 223.345 2.481 20 0 BEADLO CC[NH+]1CC(NC(=O)c2c(C)cc(C)cc2C)C1 ZINC001031357569 641994802 /nfs/dbraw/zinc/99/48/02/641994802.db2.gz QNDVVRNYSCBDCI-UHFFFAOYSA-N 1 2 246.354 2.046 20 0 BEADLO C[C@@H]1Cc2[nH+]cn(COC(=O)C3CC3)c2C[C@H]1C ZINC000917788711 642123952 /nfs/dbraw/zinc/12/39/52/642123952.db2.gz FAXPYFPDFZQMGP-NXEZZACHSA-N 1 2 248.326 2.165 20 0 BEADLO CC[NH+]1CC(NC(=O)[C@@H]2CCCC(C)(C)C2)C1 ZINC001031452510 642170873 /nfs/dbraw/zinc/17/08/73/642170873.db2.gz JNCUBHBQQUQMLV-LLVKDONJSA-N 1 2 238.375 2.023 20 0 BEADLO C[C@H](CNC(=O)CCC1(C)CC1)Cn1cc[nH+]c1 ZINC000933298587 642518244 /nfs/dbraw/zinc/51/82/44/642518244.db2.gz HILDWHFKEKXLPW-GFCCVEGCSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@@H](CNC(=O)CCC1(C)CC1)Cn1cc[nH+]c1 ZINC000933298589 642518979 /nfs/dbraw/zinc/51/89/79/642518979.db2.gz HILDWHFKEKXLPW-LBPRGKRZSA-N 1 2 249.358 2.216 20 0 BEADLO CCC[C@@H]1C[C@H]1Nc1cc(NC)nc[nH+]1 ZINC000233310674 642661084 /nfs/dbraw/zinc/66/10/84/642661084.db2.gz NUXQBZQNDXVBMX-RKDXNWHRSA-N 1 2 206.293 2.119 20 0 BEADLO C/C=C/COC(=O)[C@@H](c1ccccc1)[NH+](C)C ZINC000181972752 642931914 /nfs/dbraw/zinc/93/19/14/642931914.db2.gz KDYNSSDEISLNCO-MUBLQREKSA-N 1 2 233.311 2.409 20 0 BEADLO Cc1nonc1C[NH2+][C@@H]1CCc2ccccc21 ZINC000070261672 643008269 /nfs/dbraw/zinc/00/82/69/643008269.db2.gz YPMAWPZLURUTTJ-GFCCVEGCSA-N 1 2 229.283 2.155 20 0 BEADLO Cc1ccccc1OCC[N@@H+](C)C[C@H](C)C#N ZINC000070869710 643076590 /nfs/dbraw/zinc/07/65/90/643076590.db2.gz BVGYOIVUDQXUQH-GFCCVEGCSA-N 1 2 232.327 2.465 20 0 BEADLO Cc1ccccc1OCC[N@H+](C)C[C@H](C)C#N ZINC000070869710 643076596 /nfs/dbraw/zinc/07/65/96/643076596.db2.gz BVGYOIVUDQXUQH-GFCCVEGCSA-N 1 2 232.327 2.465 20 0 BEADLO CC(C)n1ccc(C[N@@H+]2CCO[C@@H](C)CC2)n1 ZINC000932345682 643156113 /nfs/dbraw/zinc/15/61/13/643156113.db2.gz OCCKYDDQWJMKDR-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccc(C[N@H+]2CCO[C@@H](C)CC2)n1 ZINC000932345682 643156118 /nfs/dbraw/zinc/15/61/18/643156118.db2.gz OCCKYDDQWJMKDR-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO C[C@H]1CCOCC[N@@H+]1C/C(Cl)=C/Cl ZINC000306574036 643186163 /nfs/dbraw/zinc/18/61/63/643186163.db2.gz QVFDCXMGXPJTNG-HWPCKVLBSA-N 1 2 224.131 2.416 20 0 BEADLO C[C@H]1CCOCC[N@H+]1C/C(Cl)=C/Cl ZINC000306574036 643186167 /nfs/dbraw/zinc/18/61/67/643186167.db2.gz QVFDCXMGXPJTNG-HWPCKVLBSA-N 1 2 224.131 2.416 20 0 BEADLO CC/C=C(/C)C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000075532251 643250714 /nfs/dbraw/zinc/25/07/14/643250714.db2.gz GIYNZTASIIHPIH-QJGQKNTRSA-N 1 2 247.342 2.472 20 0 BEADLO Cc1nc(N[C@@H](CCO)c2cccs2)cc[nH+]1 ZINC000078301367 643272774 /nfs/dbraw/zinc/27/27/74/643272774.db2.gz KFGYKCOSNNZEJN-JTQLQIEISA-N 1 2 249.339 2.382 20 0 BEADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cnc[nH]2)o1 ZINC000112341593 643332037 /nfs/dbraw/zinc/33/20/37/643332037.db2.gz IPFZWJANYPHAGT-SKDRFNHKSA-N 1 2 231.299 2.416 20 0 BEADLO CC1(C(=O)NCCCCn2cc[nH+]c2)CC=CC1 ZINC000932717523 643418551 /nfs/dbraw/zinc/41/85/51/643418551.db2.gz ABPKEVFGJRSYFF-UHFFFAOYSA-N 1 2 247.342 2.136 20 0 BEADLO CCCCOC(=O)C[N@@H+]1CCS[C@@H](CC)C1 ZINC000076072186 643477623 /nfs/dbraw/zinc/47/76/23/643477623.db2.gz NNLMBBOBLKMHLP-NSHDSACASA-N 1 2 245.388 2.157 20 0 BEADLO CCCCOC(=O)C[N@H+]1CCS[C@@H](CC)C1 ZINC000076072186 643477626 /nfs/dbraw/zinc/47/76/26/643477626.db2.gz NNLMBBOBLKMHLP-NSHDSACASA-N 1 2 245.388 2.157 20 0 BEADLO CSCCC[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000082784079 643525316 /nfs/dbraw/zinc/52/53/16/643525316.db2.gz OYMDJZDXDLWPMT-VIFPVBQESA-N 1 2 233.377 2.059 20 0 BEADLO CC(F)(F)CCC(=O)OCc1ccc(N)[nH+]c1 ZINC000922354164 643977815 /nfs/dbraw/zinc/97/78/15/643977815.db2.gz FRUIIKIWWYRCHB-UHFFFAOYSA-N 1 2 244.241 2.142 20 0 BEADLO CCC/C=C/C(=O)OCc1ccc(N)[nH+]c1 ZINC000922352974 643980131 /nfs/dbraw/zinc/98/01/31/643980131.db2.gz WVVNVVQUERDOOW-SNAWJCMRSA-N 1 2 220.272 2.063 20 0 BEADLO C/C(=C/C(=O)OCc1ccc[nH+]c1N)C1CC1 ZINC000922371080 643982080 /nfs/dbraw/zinc/98/20/80/643982080.db2.gz UWTYCTIWVKLWJM-CLFYSBASSA-N 1 2 232.283 2.063 20 0 BEADLO C[C@@H](CC(=O)OCc1ccc[nH+]c1N)C1CC1 ZINC000922387959 643983939 /nfs/dbraw/zinc/98/39/39/643983939.db2.gz YJBAUGJFYGABRB-VIFPVBQESA-N 1 2 234.299 2.143 20 0 BEADLO C[C@@H]1CC/C(=C/C(=O)OCc2ccc[nH+]c2N)C1 ZINC000922516392 644006571 /nfs/dbraw/zinc/00/65/71/644006571.db2.gz GEFCEIZEIPBPHQ-UBYNWHESSA-N 1 2 246.310 2.453 20 0 BEADLO C[C@H]1CC/C(=C\C(=O)OCc2ccc(N)[nH+]c2)C1 ZINC000922516448 644007107 /nfs/dbraw/zinc/00/71/07/644007107.db2.gz HQFMYNFDJLTWBO-VUBLIPMDSA-N 1 2 246.310 2.453 20 0 BEADLO CCC1(C(=O)OCc2ccc(N)[nH+]c2)CCC1 ZINC000922514962 644011037 /nfs/dbraw/zinc/01/10/37/644011037.db2.gz RORNXSUEDDWCSK-UHFFFAOYSA-N 1 2 234.299 2.287 20 0 BEADLO CCC(=CC(=O)OCc1ccc[nH+]c1N)CC ZINC000922527304 644014724 /nfs/dbraw/zinc/01/47/24/644014724.db2.gz QNBPGIAHFQYQAK-UHFFFAOYSA-N 1 2 234.299 2.453 20 0 BEADLO c1cnc([C@@H]([NH2+]Cc2cccnc2)C2CC2)nc1 ZINC000922581304 644032064 /nfs/dbraw/zinc/03/20/64/644032064.db2.gz HBCKFZXTYOFLQM-ZDUSSCGKSA-N 1 2 240.310 2.113 20 0 BEADLO c1c[nH]c(C[NH2+][C@@H](c2ccccn2)C2CC2)n1 ZINC000922586866 644036803 /nfs/dbraw/zinc/03/68/03/644036803.db2.gz SBOWCLMOAXCMEV-CYBMUJFWSA-N 1 2 228.299 2.046 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1C(=O)OCc1ccc[nH+]c1N ZINC000922625390 644045680 /nfs/dbraw/zinc/04/56/80/644045680.db2.gz ZQWYTNBNKDBGDB-FZMZJTMJSA-N 1 2 248.326 2.389 20 0 BEADLO C/C=C(\CC)C(=O)OCc1ccc[nH+]c1N ZINC000922640681 644054822 /nfs/dbraw/zinc/05/48/22/644054822.db2.gz VFFPNOYLEVKJGD-YCRREMRBSA-N 1 2 220.272 2.063 20 0 BEADLO Cc1cn[nH]c1C[NH2+]Cc1ncc(C)cc1C ZINC000922741662 644081684 /nfs/dbraw/zinc/08/16/84/644081684.db2.gz PGBRHLJGACCLNP-UHFFFAOYSA-N 1 2 230.315 2.020 20 0 BEADLO Cc1c[nH]nc1C[NH2+]Cc1ncc(C)cc1C ZINC000922741662 644081687 /nfs/dbraw/zinc/08/16/87/644081687.db2.gz PGBRHLJGACCLNP-UHFFFAOYSA-N 1 2 230.315 2.020 20 0 BEADLO CCC[NH+](CCC)Cn1ncn(C)c1=S ZINC000073753283 644099349 /nfs/dbraw/zinc/09/93/49/644099349.db2.gz BSYFDNLTUMSAOS-UHFFFAOYSA-N 1 2 228.365 2.031 20 0 BEADLO Cc1[nH]ncc1C[NH2+]C[C@@H]1CCCC2(CCC2)O1 ZINC000922813909 644100073 /nfs/dbraw/zinc/10/00/73/644100073.db2.gz SLFDNYNYLXXIMO-ZDUSSCGKSA-N 1 2 249.358 2.300 20 0 BEADLO Nc1[nH+]cccc1COC(=O)[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000922854277 644119004 /nfs/dbraw/zinc/11/90/04/644119004.db2.gz LTMWQBWVQKTFCQ-JLLWLGSASA-N 1 2 246.310 2.143 20 0 BEADLO C[C@@H]1CSCC[N@H+](Cn2cc(Cl)cn2)C1 ZINC000192179885 644134601 /nfs/dbraw/zinc/13/46/01/644134601.db2.gz YJZBGXOIQVTYOJ-VIFPVBQESA-N 1 2 245.779 2.179 20 0 BEADLO C[C@@H]1CSCC[N@@H+](Cn2cc(Cl)cn2)C1 ZINC000192179885 644134604 /nfs/dbraw/zinc/13/46/04/644134604.db2.gz YJZBGXOIQVTYOJ-VIFPVBQESA-N 1 2 245.779 2.179 20 0 BEADLO Nc1[nH+]cccc1COC(=O)[C@@H]1CCCC12CC2 ZINC000922899646 644186255 /nfs/dbraw/zinc/18/62/55/644186255.db2.gz ZNZCFIWCLPOHIV-NSHDSACASA-N 1 2 246.310 2.287 20 0 BEADLO Nc1ccc(COC(=O)[C@@]23C[C@@H]2CCCC3)c[nH+]1 ZINC000922911284 644187600 /nfs/dbraw/zinc/18/76/00/644187600.db2.gz DKEWBCWTHUKQQY-FZMZJTMJSA-N 1 2 246.310 2.287 20 0 BEADLO CCc1onc(C)c1CNCc1[nH]c(C)c(C)[nH+]1 ZINC000922982530 644209147 /nfs/dbraw/zinc/20/91/47/644209147.db2.gz RJZQVBAJMHFLFM-UHFFFAOYSA-N 1 2 248.330 2.175 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H](C)CSC(C)(C)C ZINC000193093473 644213104 /nfs/dbraw/zinc/21/31/04/644213104.db2.gz HXBZAHZGOBZVSO-DTWKUNHWSA-N 1 2 233.377 2.058 20 0 BEADLO COc1ccccc1[C@@H](O)CNc1cccc[nH+]1 ZINC000193913248 644288661 /nfs/dbraw/zinc/28/86/61/644288661.db2.gz GQNTVPJMMHILGW-LBPRGKRZSA-N 1 2 244.294 2.236 20 0 BEADLO CC[C@H](C)[C@H]([NH2+][C@H]1CS[C@@H](C)C1)C(=O)OC ZINC000086935107 644296155 /nfs/dbraw/zinc/29/61/55/644296155.db2.gz RRJPEPMQXZPOFS-MMWGEVLESA-N 1 2 245.388 2.058 20 0 BEADLO Cc1[nH]ncc1C[NH2+]CCSC(F)(F)F ZINC000194362403 644314772 /nfs/dbraw/zinc/31/47/72/644314772.db2.gz NQWHTMATDTYUJW-UHFFFAOYSA-N 1 2 239.266 2.061 20 0 BEADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)C(F)F ZINC000194494635 644322436 /nfs/dbraw/zinc/32/24/36/644322436.db2.gz MUQPUDZQKQKBRD-UHFFFAOYSA-N 1 2 237.209 2.280 20 0 BEADLO Nc1ccc(COC(=O)C2(C3CC3)CCC2)c[nH+]1 ZINC000923337311 644359137 /nfs/dbraw/zinc/35/91/37/644359137.db2.gz OKOWGEHKCVIRJZ-UHFFFAOYSA-N 1 2 246.310 2.287 20 0 BEADLO OC[C@H]1CCC[N@H+](C/C(Cl)=C/Cl)C1 ZINC000086001401 644453465 /nfs/dbraw/zinc/45/34/65/644453465.db2.gz LJJCDSSTSBJTKP-ZKUGPGMGSA-N 1 2 224.131 2.010 20 0 BEADLO OC[C@H]1CCC[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000086001401 644453469 /nfs/dbraw/zinc/45/34/69/644453469.db2.gz LJJCDSSTSBJTKP-ZKUGPGMGSA-N 1 2 224.131 2.010 20 0 BEADLO CCCCOC(=O)C[N@@H+]1CCS[C@@H](C)[C@H]1C ZINC000246340124 644581756 /nfs/dbraw/zinc/58/17/56/644581756.db2.gz IZYBAPIRTRKPGS-MNOVXSKESA-N 1 2 245.388 2.156 20 0 BEADLO CCCCOC(=O)C[N@H+]1CCS[C@@H](C)[C@H]1C ZINC000246340124 644581763 /nfs/dbraw/zinc/58/17/63/644581763.db2.gz IZYBAPIRTRKPGS-MNOVXSKESA-N 1 2 245.388 2.156 20 0 BEADLO CCCCOC(=O)[C@@H](C)[N@@H+]1CCSC[C@H]1C ZINC000246649966 644600560 /nfs/dbraw/zinc/60/05/60/644600560.db2.gz IOGSDZOTLTVOCH-GHMZBOCLSA-N 1 2 245.388 2.156 20 0 BEADLO CCCCOC(=O)[C@@H](C)[N@H+]1CCSC[C@H]1C ZINC000246649966 644600567 /nfs/dbraw/zinc/60/05/67/644600567.db2.gz IOGSDZOTLTVOCH-GHMZBOCLSA-N 1 2 245.388 2.156 20 0 BEADLO CC[C@@H](C)CCC(=O)OCc1c[nH+]cn1C ZINC000797107161 644817866 /nfs/dbraw/zinc/81/78/66/644817866.db2.gz ZRPPLBQFDHPEJP-SNVBAGLBSA-N 1 2 224.304 2.290 20 0 BEADLO Cc1cc(F)ccc1[C@@H](O)Cn1cc[nH+]c1 ZINC000304482377 644910452 /nfs/dbraw/zinc/91/04/52/644910452.db2.gz BBIFPRSMYWCYSY-LBPRGKRZSA-N 1 2 220.247 2.064 20 0 BEADLO Cc1cc(CNC(=O)C(C)(C)F)cc(C)[nH+]1 ZINC000817458396 644984044 /nfs/dbraw/zinc/98/40/44/644984044.db2.gz GKYFUIUMDWXTHU-UHFFFAOYSA-N 1 2 224.279 2.063 20 0 BEADLO Cc1cc(CNC(=S)NC(C)C)cc(C)[nH+]1 ZINC000817560075 644988477 /nfs/dbraw/zinc/98/84/77/644988477.db2.gz JGNSWDUJBFAAJX-UHFFFAOYSA-N 1 2 237.372 2.071 20 0 BEADLO CCC1CCC(N(C)C(=O)Cc2[nH]cc[nH+]2)CC1 ZINC000821281956 645033992 /nfs/dbraw/zinc/03/39/92/645033992.db2.gz VTYUBBWZFQEGSN-UHFFFAOYSA-N 1 2 249.358 2.379 20 0 BEADLO CC(C)Cn1nccc1C[NH+]1CC2(CC2)C1 ZINC000843411358 645290736 /nfs/dbraw/zinc/29/07/36/645290736.db2.gz LXCSTOGKGJSARM-UHFFFAOYSA-N 1 2 219.332 2.135 20 0 BEADLO C[C@@H](OC(=O)Cc1cn2c([nH+]1)CCCC2)C1CC1 ZINC000845447235 645360964 /nfs/dbraw/zinc/36/09/64/645360964.db2.gz BDHWLIOGBPUVBY-SNVBAGLBSA-N 1 2 248.326 2.104 20 0 BEADLO CC/C=C\COC(=O)Cc1cn2c([nH+]1)CCCC2 ZINC000845449629 645361870 /nfs/dbraw/zinc/36/18/70/645361870.db2.gz RIUMCNTUGJMUTD-UTCJRWHESA-N 1 2 248.326 2.271 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cnsn2)[C@H](C)C1 ZINC000847004790 645413712 /nfs/dbraw/zinc/41/37/12/645413712.db2.gz UMAZWOWFXXESKL-RKDXNWHRSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cnsn2)[C@H](C)C1 ZINC000847004790 645413705 /nfs/dbraw/zinc/41/37/05/645413705.db2.gz UMAZWOWFXXESKL-RKDXNWHRSA-N 1 2 211.334 2.159 20 0 BEADLO Cc1nonc1[C@@H](C)[NH2+][C@@H]1CCCC[C@@H]1F ZINC000926785185 645430431 /nfs/dbraw/zinc/43/04/31/645430431.db2.gz JIDJNPLHTSPRAD-FKTZTGRPSA-N 1 2 227.283 2.309 20 0 BEADLO Cc1cc(N[C@@H]2COC[C@@H]2C)c[nH+]c1C ZINC000926854616 645457834 /nfs/dbraw/zinc/45/78/34/645457834.db2.gz DGMGBWROZDEETD-JOYOIKCWSA-N 1 2 206.289 2.145 20 0 BEADLO Cc1nnc(C[N@H+](C)CCSC(C)(C)C)o1 ZINC000852470833 645485165 /nfs/dbraw/zinc/48/51/65/645485165.db2.gz DFCNPLKSZBZTIC-UHFFFAOYSA-N 1 2 243.376 2.342 20 0 BEADLO Cc1nnc(C[N@@H+](C)CCSC(C)(C)C)o1 ZINC000852470833 645485167 /nfs/dbraw/zinc/48/51/67/645485167.db2.gz DFCNPLKSZBZTIC-UHFFFAOYSA-N 1 2 243.376 2.342 20 0 BEADLO Cc1noc(C[N@@H+]2Cc3ccccc3[C@H](C)C2)n1 ZINC000857200122 645540336 /nfs/dbraw/zinc/54/03/36/645540336.db2.gz GPLXMZSTXBMBAX-SNVBAGLBSA-N 1 2 243.310 2.497 20 0 BEADLO Cc1noc(C[N@H+]2Cc3ccccc3[C@H](C)C2)n1 ZINC000857200122 645540346 /nfs/dbraw/zinc/54/03/46/645540346.db2.gz GPLXMZSTXBMBAX-SNVBAGLBSA-N 1 2 243.310 2.497 20 0 BEADLO CCc1onc(C)c1C[NH2+][C@@H](C)c1cnccn1 ZINC000927139394 645567370 /nfs/dbraw/zinc/56/73/70/645567370.db2.gz IIQBFJVYLGMIDB-JTQLQIEISA-N 1 2 246.314 2.186 20 0 BEADLO C[C@H]1CC[C@H](C(=O)NCc2ccc(N)[nH+]c2)CC1 ZINC000927776440 645655342 /nfs/dbraw/zinc/65/53/42/645655342.db2.gz CGXZPKDTKAFCEB-UMSPYCQHSA-N 1 2 247.342 2.106 20 0 BEADLO CCC(CC)[C@H](C)C(=O)NCc1ccc(N)[nH+]c1 ZINC000927777846 645655375 /nfs/dbraw/zinc/65/53/75/645655375.db2.gz PGDULCCROKLADZ-JTQLQIEISA-N 1 2 249.358 2.352 20 0 BEADLO CCC[C@@H](C(=O)NCc1ccc(N)[nH+]c1)C(C)C ZINC000927778734 645656467 /nfs/dbraw/zinc/65/64/67/645656467.db2.gz ZGXIVGLSOHUQKN-GFCCVEGCSA-N 1 2 249.358 2.352 20 0 BEADLO CCCCC1(C(=O)NCc2ccc(N)[nH+]c2)CC1 ZINC000927778712 645656866 /nfs/dbraw/zinc/65/68/66/645656866.db2.gz YFJZESZCZMBHLB-UHFFFAOYSA-N 1 2 247.342 2.250 20 0 BEADLO C/C(=C/C(=O)NCc1ccc(N)[nH+]c1)C(C)(C)C ZINC000927780802 645659226 /nfs/dbraw/zinc/65/92/26/645659226.db2.gz NSTFXPBGMWNJHV-YFHOEESVSA-N 1 2 247.342 2.272 20 0 BEADLO F[C@H]1CC[N@H+](CCSC(F)(F)F)C1 ZINC000886222854 645884027 /nfs/dbraw/zinc/88/40/27/645884027.db2.gz CACYIUMKMWHBEH-LURJTMIESA-N 1 2 217.231 2.283 20 0 BEADLO F[C@H]1CC[N@@H+](CCSC(F)(F)F)C1 ZINC000886222854 645884031 /nfs/dbraw/zinc/88/40/31/645884031.db2.gz CACYIUMKMWHBEH-LURJTMIESA-N 1 2 217.231 2.283 20 0 BEADLO CC[C@@H](C)[C@H](C(=O)OC)[N@H+](C)Cc1ccco1 ZINC000929137693 645965627 /nfs/dbraw/zinc/96/56/27/645965627.db2.gz GXQQTZHUGPSKNX-ZYHUDNBSSA-N 1 2 239.315 2.299 20 0 BEADLO CC[C@@H](C)[C@H](C(=O)OC)[N@@H+](C)Cc1ccco1 ZINC000929137693 645965630 /nfs/dbraw/zinc/96/56/30/645965630.db2.gz GXQQTZHUGPSKNX-ZYHUDNBSSA-N 1 2 239.315 2.299 20 0 BEADLO CC[C@@H](C)[C@@H](C(=O)OC)[N@H+](C)Cc1ccco1 ZINC000929137692 645966457 /nfs/dbraw/zinc/96/64/57/645966457.db2.gz GXQQTZHUGPSKNX-PWSUYJOCSA-N 1 2 239.315 2.299 20 0 BEADLO CC[C@@H](C)[C@@H](C(=O)OC)[N@@H+](C)Cc1ccco1 ZINC000929137692 645966459 /nfs/dbraw/zinc/96/64/59/645966459.db2.gz GXQQTZHUGPSKNX-PWSUYJOCSA-N 1 2 239.315 2.299 20 0 BEADLO CCCCNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000929149302 645973224 /nfs/dbraw/zinc/97/32/24/645973224.db2.gz DLHHPSYIFXCLDN-UHFFFAOYSA-N 1 2 217.272 2.093 20 0 BEADLO Cc1cc(C)nc(C[N@H+]2C[C@H](C)OC[C@@H]2C)c1 ZINC000929181784 645988810 /nfs/dbraw/zinc/98/88/10/645988810.db2.gz HFTGGYUOAIBEMP-STQMWFEESA-N 1 2 234.343 2.308 20 0 BEADLO Cc1cc(C)nc(C[N@@H+]2C[C@H](C)OC[C@@H]2C)c1 ZINC000929181784 645988821 /nfs/dbraw/zinc/98/88/21/645988821.db2.gz HFTGGYUOAIBEMP-STQMWFEESA-N 1 2 234.343 2.308 20 0 BEADLO CSCCCCc1noc([C@@H](C)[NH+](C)C)n1 ZINC000924175383 646002144 /nfs/dbraw/zinc/00/21/44/646002144.db2.gz PDKLUDLGAUKDOX-SECBINFHSA-N 1 2 243.376 2.378 20 0 BEADLO CCCCC1(C(=O)OCCn2cc[nH+]c2)CC1 ZINC000924425968 646036184 /nfs/dbraw/zinc/03/61/84/646036184.db2.gz UHQJNSIDDORBCQ-UHFFFAOYSA-N 1 2 236.315 2.397 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@@H](C)OC[C@@H]2CC)o1 ZINC000929268172 646048094 /nfs/dbraw/zinc/04/80/94/646048094.db2.gz GUQFUVSHVXFEOJ-MNOVXSKESA-N 1 2 238.331 2.236 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@@H](C)OC[C@@H]2CC)o1 ZINC000929268172 646048097 /nfs/dbraw/zinc/04/80/97/646048097.db2.gz GUQFUVSHVXFEOJ-MNOVXSKESA-N 1 2 238.331 2.236 20 0 BEADLO Cc1nonc1[C@@H](C)[NH2+][C@@H](C)c1cccnc1 ZINC000924564386 646069288 /nfs/dbraw/zinc/06/92/88/646069288.db2.gz MWVITIYRXASOIK-DTWKUNHWSA-N 1 2 232.287 2.185 20 0 BEADLO Cc1nonc1[C@H](C)[NH2+][C@@H](C)c1cccnc1 ZINC000924564388 646071512 /nfs/dbraw/zinc/07/15/12/646071512.db2.gz MWVITIYRXASOIK-IUCAKERBSA-N 1 2 232.287 2.185 20 0 BEADLO COc1cc([C@@H](C)[NH2+]Cc2ccoc2C)on1 ZINC000924824994 646112992 /nfs/dbraw/zinc/11/29/92/646112992.db2.gz KPVLLBNHDZMFDC-MRVPVSSYSA-N 1 2 236.271 2.435 20 0 BEADLO COc1cc([C@H](C)[NH2+]Cc2cccc(O)c2)on1 ZINC000924901498 646128482 /nfs/dbraw/zinc/12/84/82/646128482.db2.gz XMFJNWDUGQMZJM-VIFPVBQESA-N 1 2 248.282 2.240 20 0 BEADLO C[C@@H]([NH2+]Cc1cc[nH]n1)c1cnn(C2CCC2)c1 ZINC000924987770 646149357 /nfs/dbraw/zinc/14/93/57/646149357.db2.gz AFXDRSOCIDNIDR-SNVBAGLBSA-N 1 2 245.330 2.182 20 0 BEADLO Clc1ccnc2c1CC[C@H]2[NH2+]Cc1cc[nH]n1 ZINC000924993174 646152127 /nfs/dbraw/zinc/15/21/27/646152127.db2.gz PIYUQRZASGLSJV-LLVKDONJSA-N 1 2 248.717 2.235 20 0 BEADLO COC[C@H](C[N@H+](C)CC(F)F)C(C)C ZINC000929515484 646164746 /nfs/dbraw/zinc/16/47/46/646164746.db2.gz KTUJOHSWJLXBJY-VIFPVBQESA-N 1 2 209.280 2.102 20 0 BEADLO COC[C@H](C[N@@H+](C)CC(F)F)C(C)C ZINC000929515484 646164750 /nfs/dbraw/zinc/16/47/50/646164750.db2.gz KTUJOHSWJLXBJY-VIFPVBQESA-N 1 2 209.280 2.102 20 0 BEADLO CC(C)c1cc(C[NH2+][C@@H](C)c2ccnnc2)on1 ZINC000925068150 646174729 /nfs/dbraw/zinc/17/47/29/646174729.db2.gz TZRQNJLKVLIVLX-JTQLQIEISA-N 1 2 246.314 2.439 20 0 BEADLO Cc1cc(C[NH2+][C@H]2CCCc3oc(C)nc32)[nH]n1 ZINC000925104122 646186347 /nfs/dbraw/zinc/18/63/47/646186347.db2.gz RVDGYCFETJMYAE-NSHDSACASA-N 1 2 246.314 2.182 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)C[C@H]1CCCC2(CCC2)O1 ZINC000929624118 646206283 /nfs/dbraw/zinc/20/62/83/646206283.db2.gz HGCVZLFSTDMMRZ-CYBMUJFWSA-N 1 2 249.358 2.333 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)C[C@H]1CCCC2(CCC2)O1 ZINC000929624118 646206287 /nfs/dbraw/zinc/20/62/87/646206287.db2.gz HGCVZLFSTDMMRZ-CYBMUJFWSA-N 1 2 249.358 2.333 20 0 BEADLO COc1nnc(C[N@@H+]2CCCCC[C@@H]2C)s1 ZINC000929651581 646222106 /nfs/dbraw/zinc/22/21/06/646222106.db2.gz ZIYMUCMCJXUXLZ-VIFPVBQESA-N 1 2 241.360 2.311 20 0 BEADLO COc1nnc(C[N@H+]2CCCCC[C@@H]2C)s1 ZINC000929651581 646222113 /nfs/dbraw/zinc/22/21/13/646222113.db2.gz ZIYMUCMCJXUXLZ-VIFPVBQESA-N 1 2 241.360 2.311 20 0 BEADLO COc1nnc(C[N@@H+]2CCC[C@H](C)[C@H]2C)s1 ZINC000929703372 646259689 /nfs/dbraw/zinc/25/96/89/646259689.db2.gz MEIXGXWYONVYCK-DTWKUNHWSA-N 1 2 241.360 2.167 20 0 BEADLO COc1nnc(C[N@H+]2CCC[C@H](C)[C@H]2C)s1 ZINC000929703372 646259694 /nfs/dbraw/zinc/25/96/94/646259694.db2.gz MEIXGXWYONVYCK-DTWKUNHWSA-N 1 2 241.360 2.167 20 0 BEADLO C[C@@H]1CCC[N@@H+]1Cc1cc(C(F)(F)F)n(C)n1 ZINC000929755197 646286823 /nfs/dbraw/zinc/28/68/23/646286823.db2.gz KMLCBVJGCVLJJF-MRVPVSSYSA-N 1 2 247.264 2.423 20 0 BEADLO C[C@@H]1CCC[N@H+]1Cc1cc(C(F)(F)F)n(C)n1 ZINC000929755197 646286829 /nfs/dbraw/zinc/28/68/29/646286829.db2.gz KMLCBVJGCVLJJF-MRVPVSSYSA-N 1 2 247.264 2.423 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)CC1CCC2(CC2)CC1 ZINC000929812340 646331270 /nfs/dbraw/zinc/33/12/70/646331270.db2.gz SQXGLLDZDXONOI-UHFFFAOYSA-N 1 2 234.347 2.207 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)CC1CCC2(CC2)CC1 ZINC000929812340 646331277 /nfs/dbraw/zinc/33/12/77/646331277.db2.gz SQXGLLDZDXONOI-UHFFFAOYSA-N 1 2 234.347 2.207 20 0 BEADLO CCOC(=O)[C@@H]1C[C@H]1C[N@H+](CC(F)F)C(C)C ZINC000929855330 646360225 /nfs/dbraw/zinc/36/02/25/646360225.db2.gz QKIHFOOZMZIZSC-VHSXEESVSA-N 1 2 249.301 2.161 20 0 BEADLO CCOC(=O)[C@@H]1C[C@H]1C[N@@H+](CC(F)F)C(C)C ZINC000929855330 646360227 /nfs/dbraw/zinc/36/02/27/646360227.db2.gz QKIHFOOZMZIZSC-VHSXEESVSA-N 1 2 249.301 2.161 20 0 BEADLO CSCC[C@H](C)[N@H+](C)Cc1nncs1 ZINC000929986602 646385615 /nfs/dbraw/zinc/38/56/15/646385615.db2.gz LXPBEMBRYKBUAF-QMMMGPOBSA-N 1 2 231.390 2.112 20 0 BEADLO CSCC[C@H](C)[N@@H+](C)Cc1nncs1 ZINC000929986602 646385617 /nfs/dbraw/zinc/38/56/17/646385617.db2.gz LXPBEMBRYKBUAF-QMMMGPOBSA-N 1 2 231.390 2.112 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ncco1)c1ccc[nH]1 ZINC000925646632 646387834 /nfs/dbraw/zinc/38/78/34/646387834.db2.gz VSYAIGIUOQZJNG-RKDXNWHRSA-N 1 2 205.261 2.415 20 0 BEADLO CC(C)CN(C)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000930028065 646401416 /nfs/dbraw/zinc/40/14/16/646401416.db2.gz GDWKWDKDHXVHER-UHFFFAOYSA-N 1 2 231.299 2.291 20 0 BEADLO COc1nnc(C[N@@H+]2CC[C@H](C)[C@H](C)C2)s1 ZINC000930144877 646456847 /nfs/dbraw/zinc/45/68/47/646456847.db2.gz HFFALROBLKOJCI-DTWKUNHWSA-N 1 2 241.360 2.025 20 0 BEADLO COc1nnc(C[N@H+]2CC[C@H](C)[C@H](C)C2)s1 ZINC000930144877 646456849 /nfs/dbraw/zinc/45/68/49/646456849.db2.gz HFFALROBLKOJCI-DTWKUNHWSA-N 1 2 241.360 2.025 20 0 BEADLO C[C@@H](Nc1ccc([NH+](C)C)cc1)c1cnnn1C ZINC000926027648 646562094 /nfs/dbraw/zinc/56/20/94/646562094.db2.gz PKEIHMGDUCCLNC-SNVBAGLBSA-N 1 2 245.330 2.054 20 0 BEADLO C[C@@H](Cc1ccccn1)[NH2+]C1(C(F)F)CC1 ZINC000926366394 646626985 /nfs/dbraw/zinc/62/69/85/646626985.db2.gz CMTUYTWEMOVONN-VIFPVBQESA-N 1 2 226.270 2.400 20 0 BEADLO COc1cc([C@@H](C)[NH2+]Cc2occc2C)on1 ZINC000926471917 646652265 /nfs/dbraw/zinc/65/22/65/646652265.db2.gz STKQEGZSKUNOSL-SECBINFHSA-N 1 2 236.271 2.435 20 0 BEADLO C[C@@H]([NH2+]CC(C)(F)F)c1cc[nH]c(=O)c1 ZINC000926485288 646657711 /nfs/dbraw/zinc/65/77/11/646657711.db2.gz DEJPDAZMJCAXDM-SSDOTTSWSA-N 1 2 216.231 2.093 20 0 BEADLO Cc1cc(F)ccc1NC(=O)C[C@@H]([NH3+])C(F)F ZINC000724737376 711609680 /nfs/dbraw/zinc/60/96/80/711609680.db2.gz BHXQATJVJCPYEO-MRVPVSSYSA-N 1 2 246.232 2.055 20 0 BEADLO CN(C(=O)C[C@@H]([NH3+])C(F)F)C1CCCCCC1 ZINC000724760031 711610690 /nfs/dbraw/zinc/61/06/90/711610690.db2.gz UIYPNHYTLHLOCC-SNVBAGLBSA-N 1 2 248.317 2.150 20 0 BEADLO CN(C)c1cc(NCCC2(C)CC2)[nH+]cn1 ZINC000893587927 711740428 /nfs/dbraw/zinc/74/04/28/711740428.db2.gz MOMVKZBDNLLXTM-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO CN(C)c1cc(NCCC2(C)CC2)nc[nH+]1 ZINC000893587927 711740430 /nfs/dbraw/zinc/74/04/30/711740430.db2.gz MOMVKZBDNLLXTM-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1c1cc(NC)[nH+]cn1 ZINC000136785636 711744241 /nfs/dbraw/zinc/74/42/41/711744241.db2.gz DFCIPNRCBPARFM-ZJUUUORDSA-N 1 2 220.320 2.286 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1c1cc(NC)nc[nH+]1 ZINC000136785636 711744243 /nfs/dbraw/zinc/74/42/43/711744243.db2.gz DFCIPNRCBPARFM-ZJUUUORDSA-N 1 2 220.320 2.286 20 0 BEADLO CC1(C)CCC[C@H](C[N@@H+]2CCCC[C@@H]2C[NH3+])O1 ZINC000714321995 712482010 /nfs/dbraw/zinc/48/20/10/712482010.db2.gz XOONDTDWMVOKRK-CHWSQXEVSA-N 1 2 240.391 2.147 20 0 BEADLO CC1(C)CCC[C@H](C[N@H+]2CCCC[C@@H]2C[NH3+])O1 ZINC000714321995 712482011 /nfs/dbraw/zinc/48/20/11/712482011.db2.gz XOONDTDWMVOKRK-CHWSQXEVSA-N 1 2 240.391 2.147 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ccns2)nn1C ZINC000715937377 712544267 /nfs/dbraw/zinc/54/42/67/712544267.db2.gz AETIQCIQINYEPA-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO CCC[C@@H]([NH2+]C[C@@H]1CCC=CO1)C(=O)OCC ZINC000379919827 712626915 /nfs/dbraw/zinc/62/69/15/712626915.db2.gz QCOKUEZLKWHZFK-NWDGAFQWSA-N 1 2 241.331 2.001 20 0 BEADLO Cc1coc(C[NH2+]Cc2nccs2)c1 ZINC000718142285 712748104 /nfs/dbraw/zinc/74/81/04/712748104.db2.gz AFNNHEFPTPJMIE-UHFFFAOYSA-N 1 2 208.286 2.334 20 0 BEADLO Cn1ncc2cc(-c3nc4[nH]ccc4c[nH+]3)ccc21 ZINC001241435706 1169722551 /nfs/dbraw/zinc/72/25/51/1169722551.db2.gz NDGRQMVTUPMZHI-UHFFFAOYSA-N 1 2 249.277 2.463 20 0 BEADLO c1cn2c(cccc2-c2cnc3nccnc3c2)[nH+]1 ZINC001244044407 1169766505 /nfs/dbraw/zinc/76/65/05/1169766505.db2.gz SJELSCJMVFXNAE-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO CCc1cc(C[NH2+][C@@H](C)c2nccs2)[nH]n1 ZINC000381313440 710619878 /nfs/dbraw/zinc/61/98/78/710619878.db2.gz MFIBRQNFLDVPRV-QMMMGPOBSA-N 1 2 236.344 2.279 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]C[C@@H]1CCC=CO1 ZINC000381475116 710642075 /nfs/dbraw/zinc/64/20/75/710642075.db2.gz QGLXDRVRMAOWMO-KOLCDFICSA-N 1 2 221.304 2.061 20 0 BEADLO CCCn1cc(NCc2[nH]c(C)c(C)[nH+]2)cn1 ZINC000722372317 710712178 /nfs/dbraw/zinc/71/21/78/710712178.db2.gz QKTGGFZNCYVZQP-UHFFFAOYSA-N 1 2 233.319 2.245 20 0 BEADLO Cc1ccc(NC(=O)C[C@H]([NH3+])C(F)F)cc1C ZINC000724763627 710745763 /nfs/dbraw/zinc/74/57/63/710745763.db2.gz ZGGUGFQWSKXFFM-JTQLQIEISA-N 1 2 242.269 2.224 20 0 BEADLO Cc1nc(C)c(C[NH2+][C@@H](C)c2nccnc2C)o1 ZINC000385539887 711015395 /nfs/dbraw/zinc/01/53/95/711015395.db2.gz UFSNSPFDHHJUOT-JTQLQIEISA-N 1 2 246.314 2.241 20 0 BEADLO Cc1ccncc1C[NH2+]Cc1nc(C#N)cs1 ZINC000386125441 711023337 /nfs/dbraw/zinc/02/33/37/711023337.db2.gz MZDRGRGXZXRURK-UHFFFAOYSA-N 1 2 244.323 2.008 20 0 BEADLO C[C@@H]([NH2+]Cc1nc(C#N)cs1)c1ccncc1 ZINC000386130651 711023954 /nfs/dbraw/zinc/02/39/54/711023954.db2.gz OGEGBHIKTMPOIX-SECBINFHSA-N 1 2 244.323 2.261 20 0 BEADLO C[C@@H]1CSC[C@H]1[NH2+]CC(F)(F)C(F)F ZINC000388939484 711070675 /nfs/dbraw/zinc/07/06/75/711070675.db2.gz WUXHUNLVKWQGEI-PHDIDXHHSA-N 1 2 231.258 2.228 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2cnn(C)n2)cs1 ZINC000389848008 711093069 /nfs/dbraw/zinc/09/30/69/711093069.db2.gz QIWOXZWFWWTBDY-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cccnc2F)o1 ZINC000390437175 711117437 /nfs/dbraw/zinc/11/74/37/711117437.db2.gz SUALUHRBRQVOMN-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO OC[C@@H]([NH2+]CC(F)(F)C(F)F)C1CCCC1 ZINC000390749955 711132399 /nfs/dbraw/zinc/13/23/99/711132399.db2.gz CNQBFCJSZOJIIT-MRVPVSSYSA-N 1 2 243.244 2.028 20 0 BEADLO Oc1ccc(C[NH2+]Cc2cocn2)cc1Cl ZINC000390781110 711135132 /nfs/dbraw/zinc/13/51/32/711135132.db2.gz JXASZSDFYXSABD-UHFFFAOYSA-N 1 2 238.674 2.323 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2cccc(F)c2)[nH]1 ZINC000392442898 711147141 /nfs/dbraw/zinc/14/71/41/711147141.db2.gz BWWXDOBWDBCEMJ-MRVPVSSYSA-N 1 2 234.278 2.103 20 0 BEADLO CC[C@H](Nc1cc[nH+]cc1F)[C@@H]1CCCOC1 ZINC000723843893 711538604 /nfs/dbraw/zinc/53/86/04/711538604.db2.gz VEBDQDMHESMOHK-PWSUYJOCSA-N 1 2 238.306 2.260 20 0 BEADLO CC[C@@H](Nc1cc[nH+]c(C)n1)[C@@H]1CCCOC1 ZINC000723865714 711540546 /nfs/dbraw/zinc/54/05/46/711540546.db2.gz VOPNBYFKFUJJRD-VXGBXAGGSA-N 1 2 235.331 2.402 20 0 BEADLO C[C@@H](O)CC[N@@H+](C)Cc1nc(C(C)(C)C)co1 ZINC000724412101 711578629 /nfs/dbraw/zinc/57/86/29/711578629.db2.gz CJUZMFDTCJSRSJ-SNVBAGLBSA-N 1 2 240.347 2.175 20 0 BEADLO C[C@@H](O)CC[N@H+](C)Cc1nc(C(C)(C)C)co1 ZINC000724412101 711578627 /nfs/dbraw/zinc/57/86/27/711578627.db2.gz CJUZMFDTCJSRSJ-SNVBAGLBSA-N 1 2 240.347 2.175 20 0 BEADLO c1[nH+]cn2ccnc(N3CCCC4(CC4)C3)c12 ZINC000893238054 711699257 /nfs/dbraw/zinc/69/92/57/711699257.db2.gz KRCLCDKPLMDJGB-UHFFFAOYSA-N 1 2 228.299 2.110 20 0 BEADLO Cn1c[nH+]c(CCNc2ccnc(Cl)c2)c1 ZINC000313342469 711718678 /nfs/dbraw/zinc/71/86/78/711718678.db2.gz AOGVWGRSGPFZQP-UHFFFAOYSA-N 1 2 236.706 2.123 20 0 BEADLO CCn1cc(C[N@@H+]2CCC[C@@H](F)C2)c(C)n1 ZINC000895191357 711779852 /nfs/dbraw/zinc/77/98/52/711779852.db2.gz OKEUIYUBLVKCBY-GFCCVEGCSA-N 1 2 225.311 2.145 20 0 BEADLO CCn1cc(C[N@H+]2CCC[C@@H](F)C2)c(C)n1 ZINC000895191357 711779853 /nfs/dbraw/zinc/77/98/53/711779853.db2.gz OKEUIYUBLVKCBY-GFCCVEGCSA-N 1 2 225.311 2.145 20 0 BEADLO C[C@@H]([NH2+][C@H]1C[C@@H](C)N(C2CC2)C1)C(C)(F)F ZINC000389480475 711793397 /nfs/dbraw/zinc/79/33/97/711793397.db2.gz FIZTZDAVBNZPMT-BBBLOLIVSA-N 1 2 232.318 2.245 20 0 BEADLO C[C@@H](CCO)[NH2+]CC(F)(F)c1ccccc1 ZINC000161174286 711810955 /nfs/dbraw/zinc/81/09/55/711810955.db2.gz HTBDPGIZZXXSEV-JTQLQIEISA-N 1 2 229.270 2.139 20 0 BEADLO C/C=C\C[C@H]1CCCN(C(=O)Cc2c[nH+]c[nH]2)C1 ZINC000913354048 711821855 /nfs/dbraw/zinc/82/18/55/711821855.db2.gz YVKQFQOYLRIMEJ-DLGQBQFBSA-N 1 2 247.342 2.157 20 0 BEADLO COC(=O)/C(C)=C/C[NH+]1Cc2ccccc2C1 ZINC000088630652 711844027 /nfs/dbraw/zinc/84/40/27/711844027.db2.gz ZTPLZWLITXZKLE-YRNVUSSQSA-N 1 2 231.295 2.122 20 0 BEADLO C[C@@H]1C[N@H+](C/C(Cl)=C\Cl)CC[C@H]1O ZINC000253284285 711928050 /nfs/dbraw/zinc/92/80/50/711928050.db2.gz MTEACHRVVGCXFZ-YEPVEMNMSA-N 1 2 224.131 2.008 20 0 BEADLO C[C@@H]1C[N@@H+](C/C(Cl)=C\Cl)CC[C@H]1O ZINC000253284285 711928052 /nfs/dbraw/zinc/92/80/52/711928052.db2.gz MTEACHRVVGCXFZ-YEPVEMNMSA-N 1 2 224.131 2.008 20 0 BEADLO C[C@@H]1CC=C(C(=O)OCc2ccc(N)[nH+]c2)CC1 ZINC000922793079 711976694 /nfs/dbraw/zinc/97/66/94/711976694.db2.gz ATHJDWMAOCKXDY-SNVBAGLBSA-N 1 2 246.310 2.453 20 0 BEADLO CSC1CC([NH2+][C@@H](C)C(=O)OC(C)(C)C)C1 ZINC000706887766 712158843 /nfs/dbraw/zinc/15/88/43/712158843.db2.gz MEYWHGPFOYUNEM-IDKOKCKLSA-N 1 2 245.388 2.200 20 0 BEADLO CCCC[C@H]([NH2+]C1CC(SC)C1)C(=O)OC ZINC000707021234 712164326 /nfs/dbraw/zinc/16/43/26/712164326.db2.gz JJDFKDDSIMEHOZ-ILDUYXDCSA-N 1 2 245.388 2.202 20 0 BEADLO CCn1cc([C@H](C)[NH2+]Cc2nocc2C)cn1 ZINC000708257239 712184560 /nfs/dbraw/zinc/18/45/60/712184560.db2.gz QCAAMYBNTKJFGK-JTQLQIEISA-N 1 2 234.303 2.050 20 0 BEADLO COc1ccc[nH+]c1NC1CC(SC)C1 ZINC000708292565 712185824 /nfs/dbraw/zinc/18/58/24/712185824.db2.gz ZXRKPDKMZUJLLA-UHFFFAOYSA-N 1 2 224.329 2.396 20 0 BEADLO Cc1[nH]c(CNc2ccc3c(c2)OCO3)[nH+]c1C ZINC000709065410 712206569 /nfs/dbraw/zinc/20/65/69/712206569.db2.gz AUGABDCUTLJUAM-UHFFFAOYSA-N 1 2 245.282 2.367 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2cn(C)cn2)nc1C ZINC000709975273 712236685 /nfs/dbraw/zinc/23/66/85/712236685.db2.gz FKDKSJXPPGOWSX-GFCCVEGCSA-N 1 2 244.342 2.283 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ccccn1)c1cn(C)cn1 ZINC000710004547 712239374 /nfs/dbraw/zinc/23/93/74/712239374.db2.gz BMLGPVMOFDXWDV-GHMZBOCLSA-N 1 2 230.315 2.227 20 0 BEADLO Cc1noc(C)c1[C@H](C)[NH2+][C@H](C)c1cn(C)cn1 ZINC000710022228 712241619 /nfs/dbraw/zinc/24/16/19/712241619.db2.gz BPCLZXRASSZCQM-BDAKNGLRSA-N 1 2 248.330 2.437 20 0 BEADLO Cc1cccc(C[NH2+]Cc2nccn2C2CC2)n1 ZINC000711725247 712322086 /nfs/dbraw/zinc/32/20/86/712322086.db2.gz HYBYILVVBNYTAV-UHFFFAOYSA-N 1 2 242.326 2.211 20 0 BEADLO COc1ccc[nH+]c1NCCC(C)(C)OC ZINC000711898867 712338853 /nfs/dbraw/zinc/33/88/53/712338853.db2.gz ZPZBXYGXFYRMEM-UHFFFAOYSA-N 1 2 224.304 2.317 20 0 BEADLO CCSCSc1nc(N)cc(C)[nH+]1 ZINC000379392769 712381579 /nfs/dbraw/zinc/38/15/79/712381579.db2.gz SQMGMEKAPOKPLT-UHFFFAOYSA-N 1 2 215.347 2.000 20 0 BEADLO Clc1cscc1C[NH2+]Cc1cc[nH]n1 ZINC000379579102 712388580 /nfs/dbraw/zinc/38/85/80/712388580.db2.gz VYKXDRKNDLRZOT-UHFFFAOYSA-N 1 2 227.720 2.414 20 0 BEADLO CC[NH+](CC)Cc1cn(C)nc1Br ZINC000714089702 712477694 /nfs/dbraw/zinc/47/76/94/712477694.db2.gz USQWGMZGCBROBF-UHFFFAOYSA-N 1 2 246.152 2.024 20 0 BEADLO C[C@@H]1CCCC[C@H]1C(=O)NCc1ccc(N)[nH+]c1 ZINC000714404290 712485095 /nfs/dbraw/zinc/48/50/95/712485095.db2.gz LBTNWJXSGXPDIA-ZYHUDNBSSA-N 1 2 247.342 2.106 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2cc[nH]n2)o1 ZINC000036960564 712517794 /nfs/dbraw/zinc/51/77/94/712517794.db2.gz NVBCDNXGLOPXTA-VIFPVBQESA-N 1 2 205.261 2.162 20 0 BEADLO Cc1n[nH]c(C[NH2+][C@H]2C[C@H](C)n3ccnc32)c1C ZINC000716465320 712563016 /nfs/dbraw/zinc/56/30/16/712563016.db2.gz LDNKAABLYZGDQV-KWQFWETISA-N 1 2 245.330 2.019 20 0 BEADLO Cc1[nH]ncc1C[NH2+]C[C@@H]1CCC2(CCC2)CO1 ZINC000716592871 712564571 /nfs/dbraw/zinc/56/45/71/712564571.db2.gz GROAZLKXZTVRSM-ZDUSSCGKSA-N 1 2 249.358 2.157 20 0 BEADLO Cc1nc(NC[C@@H]2C[C@@H]2[C@@H]2C[C@H]2C)cc[nH+]1 ZINC000716591643 712564624 /nfs/dbraw/zinc/56/46/24/712564624.db2.gz LNUYBWXFEDNNGG-KLHWPWHYSA-N 1 2 217.316 2.489 20 0 BEADLO CC[C@@H](C[C@H](C)O)Nc1[nH+]cccc1OC ZINC000716879624 712580153 /nfs/dbraw/zinc/58/01/53/712580153.db2.gz KXYWRDBISBWXBC-UWVGGRQHSA-N 1 2 224.304 2.052 20 0 BEADLO C[C@@H]1C[N@H+](CC[C@H]2CC2(Cl)Cl)CCO1 ZINC000822564893 712591276 /nfs/dbraw/zinc/59/12/76/712591276.db2.gz YXTMMVASHINSJH-BDAKNGLRSA-N 1 2 238.158 2.291 20 0 BEADLO C[C@@H]1C[N@@H+](CC[C@H]2CC2(Cl)Cl)CCO1 ZINC000822564893 712591277 /nfs/dbraw/zinc/59/12/77/712591277.db2.gz YXTMMVASHINSJH-BDAKNGLRSA-N 1 2 238.158 2.291 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)NC(C1CCC1)C1CCC1 ZINC000854440640 712614154 /nfs/dbraw/zinc/61/41/54/712614154.db2.gz BJEYDQDZTZETQZ-UHFFFAOYSA-N 1 2 247.342 2.037 20 0 BEADLO FC1=CCC[N@H+](CCc2ccns2)C1 ZINC000930175771 712635707 /nfs/dbraw/zinc/63/57/07/712635707.db2.gz VLQPRBWKWOJGRL-UHFFFAOYSA-N 1 2 212.293 2.245 20 0 BEADLO FC1=CCC[N@@H+](CCc2ccns2)C1 ZINC000930175771 712635708 /nfs/dbraw/zinc/63/57/08/712635708.db2.gz VLQPRBWKWOJGRL-UHFFFAOYSA-N 1 2 212.293 2.245 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+][C@H](C)CCc1ccco1 ZINC000042322098 712720414 /nfs/dbraw/zinc/72/04/14/712720414.db2.gz NUINMPQUYGZFCI-GHMZBOCLSA-N 1 2 239.315 2.142 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1CCC=CCCC1 ZINC000719042253 712794072 /nfs/dbraw/zinc/79/40/72/712794072.db2.gz UESUKSULSLNJTD-GFCCVEGCSA-N 1 2 247.342 2.471 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCC[C@@H](C2OCCO2)C1 ZINC000719028174 712794116 /nfs/dbraw/zinc/79/41/16/712794116.db2.gz AXJFNXDZYSZFOE-SNVBAGLBSA-N 1 2 249.301 2.117 20 0 BEADLO CCC(F)(F)C[N@H+]1CCC[C@@H](C2OCCO2)C1 ZINC000719028174 712794117 /nfs/dbraw/zinc/79/41/17/712794117.db2.gz AXJFNXDZYSZFOE-SNVBAGLBSA-N 1 2 249.301 2.117 20 0 BEADLO C[C@H]1Cc2cc(C[NH2+]Cc3cocn3)ccc2O1 ZINC000720820410 712869106 /nfs/dbraw/zinc/86/91/06/712869106.db2.gz HLWIEJMBIZBVKI-JTQLQIEISA-N 1 2 244.294 2.288 20 0 BEADLO C[N@H+](Cc1ncco1)Cc1ccccc1 ZINC001141005462 960805577 /nfs/dbraw/zinc/80/55/77/960805577.db2.gz IYASWDSICALRGV-UHFFFAOYSA-N 1 2 202.257 2.307 20 0 BEADLO C[N@@H+](Cc1ncco1)Cc1ccccc1 ZINC001141005462 960805579 /nfs/dbraw/zinc/80/55/79/960805579.db2.gz IYASWDSICALRGV-UHFFFAOYSA-N 1 2 202.257 2.307 20 0 BEADLO FC(F)(F)c1n[nH]cc1C[NH+]1CC2(CCC2)C1 ZINC001141011558 960816484 /nfs/dbraw/zinc/81/64/84/960816484.db2.gz IGZRLGLRRHIXCX-UHFFFAOYSA-N 1 2 245.248 2.414 20 0 BEADLO CCCCc1[nH]cc(CN2CC(C(F)F)C2)[nH+]1 ZINC001141074379 960863199 /nfs/dbraw/zinc/86/31/99/960863199.db2.gz GVLDZQFWCVKHMX-UHFFFAOYSA-N 1 2 243.301 2.449 20 0 BEADLO CCCCc1[nH]c(CN2CC(C(F)F)C2)c[nH+]1 ZINC001141074379 960863206 /nfs/dbraw/zinc/86/32/06/960863206.db2.gz GVLDZQFWCVKHMX-UHFFFAOYSA-N 1 2 243.301 2.449 20 0 BEADLO CCC1(CNc2[nH+]ccc(F)c2C)COC1 ZINC001157542868 963656715 /nfs/dbraw/zinc/65/67/15/963656715.db2.gz YWGWFPWBCQCZHP-UHFFFAOYSA-N 1 2 224.279 2.368 20 0 BEADLO CCSc1cc[nH+]c(N2CC[C@@](C)(O)C2)c1 ZINC001165231084 965998239 /nfs/dbraw/zinc/99/82/39/965998239.db2.gz DVAZAMKIZLKPAY-GFCCVEGCSA-N 1 2 238.356 2.155 20 0 BEADLO C[N@H+](Cc1cc(F)cc(F)c1)C1(C)COC1 ZINC001204231107 966936486 /nfs/dbraw/zinc/93/64/86/966936486.db2.gz QEXYPZDXJZXNGD-UHFFFAOYSA-N 1 2 227.254 2.186 20 0 BEADLO C[N@@H+](Cc1cc(F)cc(F)c1)C1(C)COC1 ZINC001204231107 966936489 /nfs/dbraw/zinc/93/64/89/966936489.db2.gz QEXYPZDXJZXNGD-UHFFFAOYSA-N 1 2 227.254 2.186 20 0 BEADLO CO[C@H]1C[N@@H+](Cc2cccc(F)c2C)C[C@@H]1F ZINC001204507429 967010845 /nfs/dbraw/zinc/01/08/45/967010845.db2.gz YMRXWTBJVWCFOT-STQMWFEESA-N 1 2 241.281 2.303 20 0 BEADLO Cc1cc(C[N@H+]2CCOC[C@@H]2C)oc1C ZINC001204537014 967034629 /nfs/dbraw/zinc/03/46/29/967034629.db2.gz QTTCNWXIJXQTIW-JTQLQIEISA-N 1 2 209.289 2.117 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC[C@@H]2C)oc1C ZINC001204537014 967034638 /nfs/dbraw/zinc/03/46/38/967034638.db2.gz QTTCNWXIJXQTIW-JTQLQIEISA-N 1 2 209.289 2.117 20 0 BEADLO COc1cc(C[N@H+]2CC[C@@H](F)C2)ccc1F ZINC001204557221 967049926 /nfs/dbraw/zinc/04/99/26/967049926.db2.gz PWLSGNONGYLXSP-SNVBAGLBSA-N 1 2 227.254 2.378 20 0 BEADLO CC(C)[C@@H]1CC[N@@H+]1Cc1nn(C)cc1Cl ZINC001204975092 967269097 /nfs/dbraw/zinc/26/90/97/967269097.db2.gz FXDJJFIYWBMNBB-NSHDSACASA-N 1 2 227.739 2.304 20 0 BEADLO CC(C)[C@@H]1CC[N@H+]1Cc1nn(C)cc1Cl ZINC001204975092 967269100 /nfs/dbraw/zinc/26/91/00/967269100.db2.gz FXDJJFIYWBMNBB-NSHDSACASA-N 1 2 227.739 2.304 20 0 BEADLO Cc1ncccc1C[N@H+](C)Cc1cnoc1 ZINC001205732251 967805867 /nfs/dbraw/zinc/80/58/67/967805867.db2.gz PRMCZLFOROKSBC-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ncccc1C[N@@H+](C)Cc1cnoc1 ZINC001205732251 967805870 /nfs/dbraw/zinc/80/58/70/967805870.db2.gz PRMCZLFOROKSBC-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO COCCc1[nH]c2cc(C)c(OC)cc2[nH+]1 ZINC001250594687 968125465 /nfs/dbraw/zinc/12/54/65/968125465.db2.gz IZWWKGGBUIOUPY-UHFFFAOYSA-N 1 2 220.272 2.069 20 0 BEADLO CCCc1ncc(C[NH2+]Cc2cncn2CC)o1 ZINC001656243965 1165975846 /nfs/dbraw/zinc/97/58/46/1165975846.db2.gz AWBOCSRJJGXSLU-UHFFFAOYSA-N 1 2 248.330 2.133 20 0 BEADLO Cc1cc(-c2cccc3[nH+]ccn32)cnc1N ZINC000128044275 1166056227 /nfs/dbraw/zinc/05/62/27/1166056227.db2.gz JSWPDRYCUAVURM-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO Cc1cc(-c2cccc3nccn32)c[nH+]c1N ZINC000128044275 1166056232 /nfs/dbraw/zinc/05/62/32/1166056232.db2.gz JSWPDRYCUAVURM-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO CC(=O)[C@H]1CCCC[N@@H+]1Cc1ccccn1 ZINC000082645126 1166067513 /nfs/dbraw/zinc/06/75/13/1166067513.db2.gz QEPMRICNSBLJBB-CYBMUJFWSA-N 1 2 218.300 2.025 20 0 BEADLO CC(=O)[C@H]1CCCC[N@H+]1Cc1ccccn1 ZINC000082645126 1166067518 /nfs/dbraw/zinc/06/75/18/1166067518.db2.gz QEPMRICNSBLJBB-CYBMUJFWSA-N 1 2 218.300 2.025 20 0 BEADLO Nc1[nH+]cccc1CNc1ccc(Cl)cn1 ZINC000083361720 1166103903 /nfs/dbraw/zinc/10/39/03/1166103903.db2.gz VEVBMLBQCNOPHF-UHFFFAOYSA-N 1 2 234.690 2.324 20 0 BEADLO CCC1(CNC(=O)[C@H](C)n2cc[nH+]c2)CCC1 ZINC000084282803 1166170648 /nfs/dbraw/zinc/17/06/48/1166170648.db2.gz CMXDLMQAUJQBSX-NSHDSACASA-N 1 2 235.331 2.141 20 0 BEADLO CCC1(CNC(=O)[C@@H](C)n2cc[nH+]c2)CCC1 ZINC000084282801 1166172070 /nfs/dbraw/zinc/17/20/70/1166172070.db2.gz CMXDLMQAUJQBSX-LLVKDONJSA-N 1 2 235.331 2.141 20 0 BEADLO c1n[nH]c(C[NH2+]C2CCC3(CCCC3)CC2)n1 ZINC000129333585 1166173134 /nfs/dbraw/zinc/17/31/34/1166173134.db2.gz HVTUQMZPEHDRCS-UHFFFAOYSA-N 1 2 234.347 2.397 20 0 BEADLO CS[C@H](C)CC[N@@H+]1CCCC(=O)[C@H](F)C1 ZINC001208138994 969053611 /nfs/dbraw/zinc/05/36/11/969053611.db2.gz OGSYBEMGBDJTIX-NXEZZACHSA-N 1 2 233.352 2.131 20 0 BEADLO CS[C@H](C)CC[N@H+]1CCCC(=O)[C@H](F)C1 ZINC001208138994 969053623 /nfs/dbraw/zinc/05/36/23/969053623.db2.gz OGSYBEMGBDJTIX-NXEZZACHSA-N 1 2 233.352 2.131 20 0 BEADLO C[C@@H]([NH2+]Cc1cnsn1)c1cccs1 ZINC000399801538 1166257308 /nfs/dbraw/zinc/25/73/08/1166257308.db2.gz VYIUIHYPKBQLAJ-SSDOTTSWSA-N 1 2 225.342 2.450 20 0 BEADLO CCNC(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000148209523 1166262485 /nfs/dbraw/zinc/26/24/85/1166262485.db2.gz USFGYBLYOSOSIT-UHFFFAOYSA-N 1 2 230.271 2.014 20 0 BEADLO CC(C)CCC[N@@H+]1CCC[C@@H](F)C(=O)C1 ZINC001208734440 969224226 /nfs/dbraw/zinc/22/42/26/969224226.db2.gz YIZMULBTHHHGTL-LLVKDONJSA-N 1 2 215.312 2.426 20 0 BEADLO CC(C)CCC[N@H+]1CCC[C@@H](F)C(=O)C1 ZINC001208734440 969224232 /nfs/dbraw/zinc/22/42/32/969224232.db2.gz YIZMULBTHHHGTL-LLVKDONJSA-N 1 2 215.312 2.426 20 0 BEADLO NC(=O)c1cccc(-c2ccc3[nH+]ccn3c2)c1 ZINC000224672300 1166294510 /nfs/dbraw/zinc/29/45/10/1166294510.db2.gz IYPGBSUHWKIASB-UHFFFAOYSA-N 1 2 237.262 2.100 20 0 BEADLO C(c1nnc(C2CCC2)o1)[NH+]1CCCCC1 ZINC000110104151 1166304703 /nfs/dbraw/zinc/30/47/03/1166304703.db2.gz RDYBPWVQZDFTQT-UHFFFAOYSA-N 1 2 221.304 2.323 20 0 BEADLO Cc1cnn(-c2ccc(-c3[nH]cc[nH+]3)cc2)c1N ZINC001213085798 1166313671 /nfs/dbraw/zinc/31/36/71/1166313671.db2.gz XMUURPNYPCMFNG-UHFFFAOYSA-N 1 2 239.282 2.153 20 0 BEADLO C[N@@H+]1CCCC[C@H]1CN[C@H]1CCc2cccnc21 ZINC000299928756 1166336025 /nfs/dbraw/zinc/33/60/25/1166336025.db2.gz KCWKYPBKLHGPFF-KBPBESRZSA-N 1 2 245.370 2.143 20 0 BEADLO C[N@H+]1CCCC[C@H]1CN[C@H]1CCc2cccnc21 ZINC000299928756 1166336030 /nfs/dbraw/zinc/33/60/30/1166336030.db2.gz KCWKYPBKLHGPFF-KBPBESRZSA-N 1 2 245.370 2.143 20 0 BEADLO C[C@H](COC1C[NH+](C)C1)c1ccccc1 ZINC001205999946 969408816 /nfs/dbraw/zinc/40/88/16/969408816.db2.gz JGJWGCWCEIWSGH-LLVKDONJSA-N 1 2 205.301 2.121 20 0 BEADLO Sc1ccc(O[C@H]2CCCC[NH2+]C2)cc1 ZINC001217969279 1166501617 /nfs/dbraw/zinc/50/16/17/1166501617.db2.gz URJORGHQJCKXJV-NSHDSACASA-N 1 2 223.341 2.496 20 0 BEADLO Cc1[nH+]cc(Nc2cnc(Cl)nc2)cc1N ZINC001210286118 969853084 /nfs/dbraw/zinc/85/30/84/969853084.db2.gz VSNDLXUNAKXMTL-UHFFFAOYSA-N 1 2 235.678 2.159 20 0 BEADLO FC[C@@H]1CC[N@@H+](C2CCOCC2)CC1(F)F ZINC001255039000 969860797 /nfs/dbraw/zinc/86/07/97/969860797.db2.gz QWOHGGPBQZRMJB-VIFPVBQESA-N 1 2 237.265 2.092 20 0 BEADLO FC[C@@H]1CC[N@H+](C2CCOCC2)CC1(F)F ZINC001255039000 969860798 /nfs/dbraw/zinc/86/07/98/969860798.db2.gz QWOHGGPBQZRMJB-VIFPVBQESA-N 1 2 237.265 2.092 20 0 BEADLO CC[NH2+]Cc1noc(Cc2ccc(C)c(C)c2)n1 ZINC000053140979 1166568734 /nfs/dbraw/zinc/56/87/34/1166568734.db2.gz GZNFAHLSTHSLQB-UHFFFAOYSA-N 1 2 245.326 2.387 20 0 BEADLO Cc1nccn1CCNc1[nH+]cc(C)cc1C ZINC000394749318 1166592560 /nfs/dbraw/zinc/59/25/60/1166592560.db2.gz RNDCWXPIZVJJJQ-UHFFFAOYSA-N 1 2 230.315 2.315 20 0 BEADLO c1cn(Cc2cccc3ncccc23)c[nH+]1 ZINC001167729168 1166630853 /nfs/dbraw/zinc/63/08/53/1166630853.db2.gz ZMYYPEMHUFZKOK-UHFFFAOYSA-N 1 2 209.252 2.480 20 0 BEADLO COc1ccc(C[NH2+][C@@H]2CCCc3cn[nH]c32)o1 ZINC000893171998 1166633118 /nfs/dbraw/zinc/63/31/18/1166633118.db2.gz BLZIZYAWVKUXKA-LLVKDONJSA-N 1 2 247.298 2.179 20 0 BEADLO COc1ccc(C[NH2+][C@@H]2CCCc3c[nH]nc32)o1 ZINC000893171998 1166633124 /nfs/dbraw/zinc/63/31/24/1166633124.db2.gz BLZIZYAWVKUXKA-LLVKDONJSA-N 1 2 247.298 2.179 20 0 BEADLO Nc1ccc(Nc2ccc(O)cc2)c[nH+]1 ZINC000019952514 1166651796 /nfs/dbraw/zinc/65/17/96/1166651796.db2.gz GRPNCNWMUVGSLH-UHFFFAOYSA-N 1 2 201.229 2.113 20 0 BEADLO Cc1cc(-c2ccc(F)c(O)c2)c[nH+]c1N ZINC001243052064 970206505 /nfs/dbraw/zinc/20/65/05/970206505.db2.gz UUBRBQFDHJSHLF-UHFFFAOYSA-N 1 2 218.231 2.484 20 0 BEADLO C[C@@H]([NH2+]CCC(F)(F)F)c1csnn1 ZINC000398323760 1166718767 /nfs/dbraw/zinc/71/87/67/1166718767.db2.gz JZDUINIFLZZFAA-RXMQYKEDSA-N 1 2 225.239 2.141 20 0 BEADLO C[C@H](CC(F)(F)F)[N@@H+]1CCOCC12CC2 ZINC001255660705 970444695 /nfs/dbraw/zinc/44/46/95/970444695.db2.gz KVMOEFIWGHVMEP-MRVPVSSYSA-N 1 2 223.238 2.192 20 0 BEADLO C[C@H](CC(F)(F)F)[N@H+]1CCOCC12CC2 ZINC001255660705 970444706 /nfs/dbraw/zinc/44/47/06/970444706.db2.gz KVMOEFIWGHVMEP-MRVPVSSYSA-N 1 2 223.238 2.192 20 0 BEADLO Cc1ccc(NC2CCC(O)CC2)c(C)[nH+]1 ZINC000235884594 1166795058 /nfs/dbraw/zinc/79/50/58/1166795058.db2.gz MALWOMQWNFZOES-UHFFFAOYSA-N 1 2 220.316 2.414 20 0 BEADLO CCCC[C@@H](C)N(C)c1cc(N)nc[nH+]1 ZINC000379861413 1166803344 /nfs/dbraw/zinc/80/33/44/1166803344.db2.gz MCOUSLNUBLPTCM-SECBINFHSA-N 1 2 208.309 2.074 20 0 BEADLO Cc1cc(N(C)[C@H](C)CO)[nH+]c2ccccc12 ZINC000379864786 1166804783 /nfs/dbraw/zinc/80/47/83/1166804783.db2.gz MAWBLNFPEZOOJT-LLVKDONJSA-N 1 2 230.311 2.360 20 0 BEADLO CC[NH+](CC)CC[C@@H](C)[NH2+]C1=CC=C[CH]1 ZINC001255951016 970583957 /nfs/dbraw/zinc/58/39/57/970583957.db2.gz LPTBJAILUZADET-GFCCVEGCSA-N 1 2 207.341 2.354 20 0 BEADLO Cc1noc([C@H]([NH2+]C/C=C\Cl)C(C)C)n1 ZINC000380078142 1166825583 /nfs/dbraw/zinc/82/55/83/1166825583.db2.gz FWKCJQBDVIIJEF-XRVBUDJMSA-N 1 2 229.711 2.417 20 0 BEADLO Cc1nc(C[NH2+][C@H](C)c2ccnn2C)cs1 ZINC000235197450 1166859982 /nfs/dbraw/zinc/85/99/82/1166859982.db2.gz OTGCOYDMVOZNQI-MRVPVSSYSA-N 1 2 236.344 2.036 20 0 BEADLO CCCNC(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000039338986 1166988655 /nfs/dbraw/zinc/98/86/55/1166988655.db2.gz YYRSZSHGKHGOPE-UHFFFAOYSA-N 1 2 244.298 2.404 20 0 BEADLO Cc1cc(N2CC(F)(F)C2)nc(C2CC2)[nH+]1 ZINC000585380335 1167034168 /nfs/dbraw/zinc/03/41/68/1167034168.db2.gz MNIOCIYXPWRNRB-UHFFFAOYSA-N 1 2 225.242 2.118 20 0 BEADLO CCSC[C@@H](C)[NH+]1C[C@@H](F)[C@H](F)C1 ZINC001173301722 975198443 /nfs/dbraw/zinc/19/84/43/975198443.db2.gz YVPGBVXPLZFZPL-IWSPIJDZSA-N 1 2 209.305 2.120 20 0 BEADLO CCCc1ccc(O)cc1OC1C[NH+](C)C1 ZINC001227148192 975293426 /nfs/dbraw/zinc/29/34/26/975293426.db2.gz HDKOEBJHTQZYHR-UHFFFAOYSA-N 1 2 221.300 2.038 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]C/C=C/C1CC1 ZINC000382160938 1167090324 /nfs/dbraw/zinc/09/03/24/1167090324.db2.gz SQQNSKPRSZALHG-CDAZIORVSA-N 1 2 205.305 2.335 20 0 BEADLO Cc1ccc2[nH+]c(CCCO)[nH]c2c1C ZINC000308783667 1167197862 /nfs/dbraw/zinc/19/78/62/1167197862.db2.gz WDNTWMPFASEKBQ-UHFFFAOYSA-N 1 2 204.273 2.105 20 0 BEADLO Cc1cc(N2CCCC[C@@H]2CO)nc(C(C)C)[nH+]1 ZINC000040433437 1167281372 /nfs/dbraw/zinc/28/13/72/1167281372.db2.gz LNCDNIFKRZFEJZ-GFCCVEGCSA-N 1 2 249.358 2.260 20 0 BEADLO Cc1cccc(C[NH2+][C@H](C)c2nncn2C)c1F ZINC000384402033 1167306709 /nfs/dbraw/zinc/30/67/09/1167306709.db2.gz CSWSSUAQDDCDGW-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO Cc1cc(F)cc(N2CCSC[C@H]2C)[nH+]1 ZINC001336527175 977749135 /nfs/dbraw/zinc/74/91/35/977749135.db2.gz CYGPECMEEPOIGW-SECBINFHSA-N 1 2 226.320 2.471 20 0 BEADLO C[N@H+](Cc1cc(Cl)cnc1F)C1CC1 ZINC001231991965 977828429 /nfs/dbraw/zinc/82/84/29/977828429.db2.gz JWPSULLJEZSXGM-UHFFFAOYSA-N 1 2 214.671 2.468 20 0 BEADLO C[N@@H+](Cc1cc(Cl)cnc1F)C1CC1 ZINC001231991965 977828433 /nfs/dbraw/zinc/82/84/33/977828433.db2.gz JWPSULLJEZSXGM-UHFFFAOYSA-N 1 2 214.671 2.468 20 0 BEADLO FC[C@H]1CCC[N@@H+]1Cc1cnsc1 ZINC001232232913 977968772 /nfs/dbraw/zinc/96/87/72/977968772.db2.gz ZKYQIVPQRQDQHP-SECBINFHSA-N 1 2 200.282 2.077 20 0 BEADLO FC[C@H]1CCC[N@H+]1Cc1cnsc1 ZINC001232232913 977968779 /nfs/dbraw/zinc/96/87/79/977968779.db2.gz ZKYQIVPQRQDQHP-SECBINFHSA-N 1 2 200.282 2.077 20 0 BEADLO CC=C(CC)C(=O)Nc1c(C)c[nH+]cc1C ZINC001337508712 978380241 /nfs/dbraw/zinc/38/02/41/978380241.db2.gz FCZCUHOKYHOTGR-VZUCSPMQSA-N 1 2 218.300 2.415 20 0 BEADLO Cc1ccc(Cl)cc1C[N@@H+]1C[C@@H](O)[C@@H](F)C1 ZINC001233247912 978509995 /nfs/dbraw/zinc/50/99/95/978509995.db2.gz OQPWFXVOAIHUAL-NWDGAFQWSA-N 1 2 243.709 2.163 20 0 BEADLO Cc1ccc(Cl)cc1C[N@H+]1C[C@@H](O)[C@@H](F)C1 ZINC001233247912 978510003 /nfs/dbraw/zinc/51/00/03/978510003.db2.gz OQPWFXVOAIHUAL-NWDGAFQWSA-N 1 2 243.709 2.163 20 0 BEADLO Cc1cnsc1C[N@@H+](C)Cc1cccnc1 ZINC001233317801 978546989 /nfs/dbraw/zinc/54/69/89/978546989.db2.gz DNYBKVAXZSWAPC-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cnsc1C[N@H+](C)Cc1cccnc1 ZINC001233317801 978546995 /nfs/dbraw/zinc/54/69/95/978546995.db2.gz DNYBKVAXZSWAPC-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cc(F)cc(N(C)[C@H](CO)CC(C)C)[nH+]1 ZINC001337941568 978570817 /nfs/dbraw/zinc/57/08/17/978570817.db2.gz YNDGJVNKNBHLAN-LBPRGKRZSA-N 1 2 240.322 2.372 20 0 BEADLO COc1ccc(C[NH+]2CC=CC2)c(Cl)c1O ZINC001233397539 978600049 /nfs/dbraw/zinc/60/00/49/978600049.db2.gz DPTCVCHNXYGTQE-UHFFFAOYSA-N 1 2 239.702 2.426 20 0 BEADLO CC1(F)CC[NH+](Cc2cncc(Cl)n2)CC1 ZINC001233446875 978603828 /nfs/dbraw/zinc/60/38/28/978603828.db2.gz MGRKGEWTPJXYOE-UHFFFAOYSA-N 1 2 243.713 2.454 20 0 BEADLO FC(F)CCNc1cc(N2CCCC2)nc[nH+]1 ZINC001338299720 978656420 /nfs/dbraw/zinc/65/64/20/978656420.db2.gz VSHRZWSHPFKPEN-UHFFFAOYSA-N 1 2 242.273 2.144 20 0 BEADLO FC(F)CCNc1cc(N2CCCC2)[nH+]cn1 ZINC001338299720 978656426 /nfs/dbraw/zinc/65/64/26/978656426.db2.gz VSHRZWSHPFKPEN-UHFFFAOYSA-N 1 2 242.273 2.144 20 0 BEADLO CC[C@H]1CN(c2cc(F)cc(C)[nH+]2)CCO1 ZINC001339522944 978862595 /nfs/dbraw/zinc/86/25/95/978862595.db2.gz QQSGIISATDDWTP-NSHDSACASA-N 1 2 224.279 2.144 20 0 BEADLO Cn1c[nH+]c2cc(Nc3cc[nH]c(=O)c3)ccc21 ZINC001212276578 1168226326 /nfs/dbraw/zinc/22/63/26/1168226326.db2.gz ZRMOZNMOQAKGDX-UHFFFAOYSA-N 1 2 240.266 2.418 20 0 BEADLO Cc1cc(Cl)cc(C[N@@H+]2CCCOCC2)n1 ZINC001236637290 979684280 /nfs/dbraw/zinc/68/42/80/979684280.db2.gz XLOPYQLKMZYJTR-UHFFFAOYSA-N 1 2 240.734 2.266 20 0 BEADLO Cc1cc(Cl)cc(C[N@H+]2CCCOCC2)n1 ZINC001236637290 979684286 /nfs/dbraw/zinc/68/42/86/979684286.db2.gz XLOPYQLKMZYJTR-UHFFFAOYSA-N 1 2 240.734 2.266 20 0 BEADLO Oc1cc(C[N@@H+]2CCC[C@@H]2CF)ccc1F ZINC001236715277 979701422 /nfs/dbraw/zinc/70/14/22/979701422.db2.gz WOASXCYOJBDXDX-SNVBAGLBSA-N 1 2 227.254 2.465 20 0 BEADLO Oc1cc(C[N@H+]2CCC[C@@H]2CF)ccc1F ZINC001236715277 979701427 /nfs/dbraw/zinc/70/14/27/979701427.db2.gz WOASXCYOJBDXDX-SNVBAGLBSA-N 1 2 227.254 2.465 20 0 BEADLO C[C@@H]1C[N@H+](C)[C@@H](C)CN1CC1OC=CC1=S ZINC001237178755 979829513 /nfs/dbraw/zinc/82/95/13/979829513.db2.gz ZRQGVBITMJHFGX-VHSXEESVSA-N 1 2 240.372 2.093 20 0 BEADLO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1CC1OC=CC1=S ZINC001237178755 979829517 /nfs/dbraw/zinc/82/95/17/979829517.db2.gz ZRQGVBITMJHFGX-VHSXEESVSA-N 1 2 240.372 2.093 20 0 BEADLO C[NH+](C)[C@@H]1CCCN(CC2OC=CC2=S)C1 ZINC001237177809 979829105 /nfs/dbraw/zinc/82/91/05/979829105.db2.gz GLXVRBHLPOYOHU-SNVBAGLBSA-N 1 2 240.372 2.094 20 0 BEADLO CN(C)[C@@H]1CCC[N@H+](CC2OC=CC2=S)C1 ZINC001237177809 979829111 /nfs/dbraw/zinc/82/91/11/979829111.db2.gz GLXVRBHLPOYOHU-SNVBAGLBSA-N 1 2 240.372 2.094 20 0 BEADLO CN(C)[C@@H]1CCC[N@@H+](CC2OC=CC2=S)C1 ZINC001237177809 979829138 /nfs/dbraw/zinc/82/91/38/979829138.db2.gz GLXVRBHLPOYOHU-SNVBAGLBSA-N 1 2 240.372 2.094 20 0 BEADLO COC1C[NH+](Cc2c(C)cc(F)cc2C)C1 ZINC001237316583 979864009 /nfs/dbraw/zinc/86/40/09/979864009.db2.gz FJUJRMFUDRGWHT-UHFFFAOYSA-N 1 2 223.291 2.273 20 0 BEADLO Fc1c[nH+]ccc1NC[C@@H]1CCC2(CCC2)O1 ZINC000711481244 1168405752 /nfs/dbraw/zinc/40/57/52/1168405752.db2.gz KWEQNQAKZFMQEM-JTQLQIEISA-N 1 2 236.290 2.156 20 0 BEADLO COc1ccoc1C[N@@H+]1CCOC[C@@H]1C(C)C ZINC001237871183 980104822 /nfs/dbraw/zinc/10/48/22/980104822.db2.gz UUQSUIIHJGZMBE-LLVKDONJSA-N 1 2 239.315 2.145 20 0 BEADLO COc1ccoc1C[N@H+]1CCOC[C@@H]1C(C)C ZINC001237871183 980104827 /nfs/dbraw/zinc/10/48/27/980104827.db2.gz UUQSUIIHJGZMBE-LLVKDONJSA-N 1 2 239.315 2.145 20 0 BEADLO CC[N@@H+](Cc1ccsc1C)[C@@H](C)C(=O)OC ZINC001237977118 980121989 /nfs/dbraw/zinc/12/19/89/980121989.db2.gz WNHBVHAOFICVHB-VIFPVBQESA-N 1 2 241.356 2.440 20 0 BEADLO CCOc1cc(C[NH+]2CC(OC)C2)ccc1C ZINC001238068951 980139197 /nfs/dbraw/zinc/13/91/97/980139197.db2.gz JBWFMAYINFAGNM-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO Cn1c[nH+]c2ccc(N[C@H]3CCCOC3)cc21 ZINC001169662207 1168498887 /nfs/dbraw/zinc/49/88/87/1168498887.db2.gz CSNZOHBRFRUUBG-NSHDSACASA-N 1 2 231.299 2.164 20 0 BEADLO COCCCc1ccc2[nH]c(C)[nH+]c2c1 ZINC001250302976 980716338 /nfs/dbraw/zinc/71/63/38/980716338.db2.gz OMWRGVQFODAAPA-UHFFFAOYSA-N 1 2 204.273 2.450 20 0 BEADLO CCCCCCC(=O)NCCc1[nH+]ccn1C ZINC001348074579 981273800 /nfs/dbraw/zinc/27/38/00/981273800.db2.gz BEQBWFYDCIYUAM-UHFFFAOYSA-N 1 2 237.347 2.049 20 0 BEADLO Fc1cccc2c1CC[C@H]([N@@H+]1CCO[C@H]3C[C@H]31)C2 ZINC001171442918 1168671900 /nfs/dbraw/zinc/67/19/00/1168671900.db2.gz USGHRYDPYIXYPH-GLQYFDAESA-N 1 2 247.313 2.156 20 0 BEADLO Fc1cccc2c1CC[C@H]([N@H+]1CCO[C@H]3C[C@H]31)C2 ZINC001171442918 1168671904 /nfs/dbraw/zinc/67/19/04/1168671904.db2.gz USGHRYDPYIXYPH-GLQYFDAESA-N 1 2 247.313 2.156 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](COC)C(C)C)c1 ZINC001349581081 981584712 /nfs/dbraw/zinc/58/47/12/981584712.db2.gz KMLZFCZPRBSDQH-LBPRGKRZSA-N 1 2 238.331 2.311 20 0 BEADLO CCC[C@H](C)CCNC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001350847083 982100148 /nfs/dbraw/zinc/10/01/48/982100148.db2.gz GNNGOFGHKISKHK-NWDGAFQWSA-N 1 2 237.347 2.387 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001351044319 982185130 /nfs/dbraw/zinc/18/51/30/982185130.db2.gz LBCFPIOCQQDOTM-GHMZBOCLSA-N 1 2 223.320 2.091 20 0 BEADLO CC(C)Oc1ccc[nH+]c1N[C@@H](C)CCO ZINC000159484046 982247696 /nfs/dbraw/zinc/24/76/96/982247696.db2.gz ALSVJXBIVYUOEP-JTQLQIEISA-N 1 2 224.304 2.052 20 0 BEADLO CSc1ccc(-c2ccc[nH+]c2N)cn1 ZINC001241634183 982870820 /nfs/dbraw/zinc/87/08/20/982870820.db2.gz PMLMBOUBJLKXMY-UHFFFAOYSA-N 1 2 217.297 2.448 20 0 BEADLO CCc1cc(NC(=S)NC(C)(C)C)cc[nH+]1 ZINC001200900372 983118028 /nfs/dbraw/zinc/11/80/28/983118028.db2.gz MDEXIKQMLIKEDQ-UHFFFAOYSA-N 1 2 237.372 2.151 20 0 BEADLO CC(C)CC[N@@H+]1CC(F)(F)CC[C@@H]1CO ZINC001201613652 983379422 /nfs/dbraw/zinc/37/94/22/983379422.db2.gz XFFILJOXAPHARY-SNVBAGLBSA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)CC[N@H+]1CC(F)(F)CC[C@@H]1CO ZINC001201613652 983379427 /nfs/dbraw/zinc/37/94/27/983379427.db2.gz XFFILJOXAPHARY-SNVBAGLBSA-N 1 2 221.291 2.125 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C=Cc1cccs1 ZINC000380188041 1169070092 /nfs/dbraw/zinc/07/00/92/1169070092.db2.gz VGVBHDRCTRUYMS-PLNGDYQASA-N 1 2 247.323 2.109 20 0 BEADLO O=C1CC[N@@H+](CCCC(F)(F)F)CC[C@@H]1F ZINC001202377548 983639672 /nfs/dbraw/zinc/63/96/72/983639672.db2.gz JAEAHAJIKJRPLR-QMMMGPOBSA-N 1 2 241.228 2.332 20 0 BEADLO O=C1CC[N@H+](CCCC(F)(F)F)CC[C@@H]1F ZINC001202377548 983639681 /nfs/dbraw/zinc/63/96/81/983639681.db2.gz JAEAHAJIKJRPLR-QMMMGPOBSA-N 1 2 241.228 2.332 20 0 BEADLO COc1c(F)cc(C[NH+]2CC=CC2)cc1F ZINC001138422148 1169130352 /nfs/dbraw/zinc/13/03/52/1169130352.db2.gz ZSXWMYNUVZETMO-UHFFFAOYSA-N 1 2 225.238 2.345 20 0 BEADLO CC[C@H](CC(C)C)[NH+]1CC(O)(C(F)(F)F)C1 ZINC001172399008 974757507 /nfs/dbraw/zinc/75/75/07/974757507.db2.gz WKCPTPLXNMVASY-SECBINFHSA-N 1 2 239.281 2.420 20 0 BEADLO CC(C)OCC[C@@H](C)[N@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001172441607 974797552 /nfs/dbraw/zinc/79/75/52/974797552.db2.gz BLBUAUNVHWNEAM-MXWKQRLJSA-N 1 2 221.291 2.182 20 0 BEADLO CC(C)OCC[C@@H](C)[N@@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001172441607 974797554 /nfs/dbraw/zinc/79/75/54/974797554.db2.gz BLBUAUNVHWNEAM-MXWKQRLJSA-N 1 2 221.291 2.182 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2ncccc2O)C[C@@H]1F ZINC001138390555 1169356464 /nfs/dbraw/zinc/35/64/64/1169356464.db2.gz ANDAWUWBNSOOTO-NWDGAFQWSA-N 1 2 242.269 2.059 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2ncccc2O)C[C@@H]1F ZINC001138390555 1169356472 /nfs/dbraw/zinc/35/64/72/1169356472.db2.gz ANDAWUWBNSOOTO-NWDGAFQWSA-N 1 2 242.269 2.059 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2ncccc2O)C[C@H]1F ZINC001138390558 1169356600 /nfs/dbraw/zinc/35/66/00/1169356600.db2.gz ANDAWUWBNSOOTO-VXGBXAGGSA-N 1 2 242.269 2.059 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2ncccc2O)C[C@H]1F ZINC001138390558 1169356610 /nfs/dbraw/zinc/35/66/10/1169356610.db2.gz ANDAWUWBNSOOTO-VXGBXAGGSA-N 1 2 242.269 2.059 20 0 BEADLO FC1CN(Cc2c[nH+]cn2Cc2ccccc2)C1 ZINC001138560635 1169360555 /nfs/dbraw/zinc/36/05/55/1169360555.db2.gz DQUKKVDNYVMPKA-UHFFFAOYSA-N 1 2 245.301 2.085 20 0 BEADLO CC[N@H+](CCOC)Cc1cc(F)c(O)cc1F ZINC001144646895 972911281 /nfs/dbraw/zinc/91/12/81/972911281.db2.gz PDGDXYIGIOJBPR-UHFFFAOYSA-N 1 2 245.269 2.139 20 0 BEADLO CC[N@@H+](CCOC)Cc1cc(F)c(O)cc1F ZINC001144646895 972911289 /nfs/dbraw/zinc/91/12/89/972911289.db2.gz PDGDXYIGIOJBPR-UHFFFAOYSA-N 1 2 245.269 2.139 20 0 BEADLO C[NH+]1CC(O[C@@H]2CCc3ccccc32)C1 ZINC001223415580 973044880 /nfs/dbraw/zinc/04/48/80/973044880.db2.gz HWQSVRCIGNRXCB-CYBMUJFWSA-N 1 2 203.285 2.005 20 0 BEADLO Nc1[nH+]cccc1-c1cnc2c(c1)CCC2 ZINC001243474751 970767239 /nfs/dbraw/zinc/76/72/39/970767239.db2.gz QQBPTPFYSQYJKL-UHFFFAOYSA-N 1 2 211.268 2.215 20 0 BEADLO CC(C)(C)[NH+]1CCC([NH2+]C2=CC=C[CH]2)CC1 ZINC001256564113 970863243 /nfs/dbraw/zinc/86/32/43/970863243.db2.gz RYMLATYIWGVBFQ-UHFFFAOYSA-N 1 2 219.352 2.497 20 0 BEADLO Cc1cc(O)c[nH+]c1Nc1ccc(O)c(CO)c1 ZINC001216136464 970950197 /nfs/dbraw/zinc/95/01/97/970950197.db2.gz RTVRFTJVGBQWBG-UHFFFAOYSA-N 1 2 246.266 2.037 20 0 BEADLO Cc1ccc(O)c(Nc2ccc(O)c(CO)c2)[nH+]1 ZINC001216137988 970951169 /nfs/dbraw/zinc/95/11/69/970951169.db2.gz WRGKASAGNJDXDM-UHFFFAOYSA-N 1 2 246.266 2.037 20 0 BEADLO Cc1cc(Cl)c(C)c(N[C@H]2COC(=O)C2)[nH+]1 ZINC001158244579 971140494 /nfs/dbraw/zinc/14/04/94/971140494.db2.gz UYCBPRZRYOENFA-MRVPVSSYSA-N 1 2 240.690 2.079 20 0 BEADLO Nc1cncc(Nc2cccn3cc[nH+]c23)c1 ZINC001210438066 1169525733 /nfs/dbraw/zinc/52/57/33/1169525733.db2.gz SSQMVNOJSBQOOJ-UHFFFAOYSA-N 1 2 225.255 2.055 20 0 BEADLO Cc1cc(NCc2ccns2)nc(C(C)C)[nH+]1 ZINC000404304697 971153082 /nfs/dbraw/zinc/15/30/82/971153082.db2.gz REHDQXWHDKXBDD-UHFFFAOYSA-N 1 2 248.355 2.399 20 0 BEADLO Cc1ccc(CN2CC[NH2+]CC(F)(F)C2)cc1 ZINC001210814460 1169530020 /nfs/dbraw/zinc/53/00/20/1169530020.db2.gz DBKBUZMZFICWRT-UHFFFAOYSA-N 1 2 240.297 2.036 20 0 BEADLO CCCC[C@@H](CC)N1CC[NH2+]CC(F)(F)C1 ZINC001257419182 971315734 /nfs/dbraw/zinc/31/57/34/971315734.db2.gz SXZBKCFITDKRJV-LLVKDONJSA-N 1 2 234.334 2.496 20 0 BEADLO CCCc1nnc([C@H]([NH3+])[C@@H](C)OC(C)(C)C)o1 ZINC001217700987 971338884 /nfs/dbraw/zinc/33/88/84/971338884.db2.gz PCGRWQHKUSQBCP-PSASIEDQSA-N 1 2 241.335 2.226 20 0 BEADLO CCCCC[C@@H](C)[NH2+]C1(C(=O)OC)CC1 ZINC001257500496 971417682 /nfs/dbraw/zinc/41/76/82/971417682.db2.gz QVPSDHRKNDODJH-SNVBAGLBSA-N 1 2 213.321 2.250 20 0 BEADLO CCCNC(=S)Nc1cccc2[nH+]c(C)cn21 ZINC001244832448 971443013 /nfs/dbraw/zinc/44/30/13/971443013.db2.gz PTTJWBRWEZIVRY-UHFFFAOYSA-N 1 2 248.355 2.339 20 0 BEADLO CCC(CC)CO[C@H]1C[NH2+]CC(F)(F)C1 ZINC001217856302 971448304 /nfs/dbraw/zinc/44/83/04/971448304.db2.gz JTXQTWUDPIYFNR-SNVBAGLBSA-N 1 2 221.291 2.436 20 0 BEADLO CC(C)(C)Cc1nnc(CCc2c[nH]c[nH+]2)o1 ZINC001257852682 971505498 /nfs/dbraw/zinc/50/54/98/971505498.db2.gz KAWVVDQIOOBYJO-UHFFFAOYSA-N 1 2 234.303 2.167 20 0 BEADLO C[C@@H](c1nnc(CC(C)(C)C)o1)[NH+](C)C ZINC001257860927 971508448 /nfs/dbraw/zinc/50/84/48/971508448.db2.gz BLEIKQUGWMBSFW-QMMMGPOBSA-N 1 2 211.309 2.281 20 0 BEADLO CC(C)OC1CCC([NH+]2CC(F)C2)CC1 ZINC001257878119 971516466 /nfs/dbraw/zinc/51/64/66/971516466.db2.gz LMJUQJFOXVGVQG-UHFFFAOYSA-N 1 2 215.312 2.376 20 0 BEADLO Cc1cccc(O[C@@H]2CC[NH2+]CC2(F)F)c1 ZINC001218006676 971568510 /nfs/dbraw/zinc/56/85/10/971568510.db2.gz RFVRLRAXYMLSMK-LLVKDONJSA-N 1 2 227.254 2.371 20 0 BEADLO CNc1cc(-c2cnc3c(c2)CCCN3)cc[nH+]1 ZINC001244976638 971576589 /nfs/dbraw/zinc/57/65/89/971576589.db2.gz DYQJCLNVWRCNCK-UHFFFAOYSA-N 1 2 240.310 2.186 20 0 BEADLO CNc1cc(-c2c[nH+]c3c(c2)CCCN3)ccn1 ZINC001244976638 971576596 /nfs/dbraw/zinc/57/65/96/971576596.db2.gz DYQJCLNVWRCNCK-UHFFFAOYSA-N 1 2 240.310 2.186 20 0 BEADLO Cc1cc(Cl)cnc1O[C@H]1C[NH2+]CC1(F)F ZINC001218234394 971647730 /nfs/dbraw/zinc/64/77/30/971647730.db2.gz UYXISBIIOKDFBN-QMMMGPOBSA-N 1 2 248.660 2.029 20 0 BEADLO Cc1cc(O[C@@H]2C[NH2+]CC2(F)F)ncc1Cl ZINC001218237516 971648560 /nfs/dbraw/zinc/64/85/60/971648560.db2.gz VEFUNXQCUPIQOQ-MRVPVSSYSA-N 1 2 248.660 2.029 20 0 BEADLO Oc1cccc(CCNc2cccc[nH+]2)c1 ZINC000309544437 971653848 /nfs/dbraw/zinc/65/38/48/971653848.db2.gz ZCVOJDZFPVAWSR-UHFFFAOYSA-N 1 2 214.268 2.442 20 0 BEADLO C[C@@H]([NH2+]CC(F)(F)c1cccc(F)c1)[C@H](C)O ZINC001330608277 974356828 /nfs/dbraw/zinc/35/68/28/974356828.db2.gz FBRDAYHYFRFQSZ-BDAKNGLRSA-N 1 2 247.260 2.276 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)Oc1cc[nH+]cc1 ZINC001225290635 974362043 /nfs/dbraw/zinc/36/20/43/974362043.db2.gz DGGYHNVDMMZMHC-GFCCVEGCSA-N 1 2 237.299 2.438 20 0 BEADLO Cc1cc[nH+]c(C)c1OC1CCC(O)CC1 ZINC001218366067 971750267 /nfs/dbraw/zinc/75/02/67/971750267.db2.gz JCLSBTMPMWJXOR-UHFFFAOYSA-N 1 2 221.300 2.381 20 0 BEADLO CC[NH+]1CC(Oc2cc(Cl)c(Cl)cn2)C1 ZINC001229221972 1169653661 /nfs/dbraw/zinc/65/36/61/1169653661.db2.gz ZGTFIFRZIVNVQF-UHFFFAOYSA-N 1 2 247.125 2.471 20 0 BEADLO O[C@H]1C[C@H](COc2ccc(-n3cc[nH+]c3)cc2)C1 ZINC001218427681 971805350 /nfs/dbraw/zinc/80/53/50/971805350.db2.gz BLWOSBVMIPQWHJ-AULYBMBSSA-N 1 2 244.294 2.022 20 0 BEADLO Nc1cc[nH+]c(O[C@@H]2C[C@@H]3CC[C@H]2C3)c1 ZINC001218440965 971818562 /nfs/dbraw/zinc/81/85/62/971818562.db2.gz QMACBKWGACJROC-WCABBAIRSA-N 1 2 204.273 2.231 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccc3c(c2)CCO3)CCC1=O ZINC000720697166 971825555 /nfs/dbraw/zinc/82/55/55/971825555.db2.gz IPRUKUHUMKNXEZ-NSHDSACASA-N 1 2 245.322 2.032 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccc3c(c2)CCO3)CCC1=O ZINC000720697166 971825560 /nfs/dbraw/zinc/82/55/60/971825560.db2.gz IPRUKUHUMKNXEZ-NSHDSACASA-N 1 2 245.322 2.032 20 0 BEADLO C[C@@H]1CC[NH2+]C[C@@H]1Oc1ccc(S)cc1 ZINC001218480508 971827913 /nfs/dbraw/zinc/82/79/13/971827913.db2.gz CRDNVEGWAUVFIS-SKDRFNHKSA-N 1 2 223.341 2.352 20 0 BEADLO Cc1cc(-c2nccc(F)c2C)c[nH+]c1N ZINC001245535692 971850682 /nfs/dbraw/zinc/85/06/82/971850682.db2.gz NDVXQUGEPSWYMJ-UHFFFAOYSA-N 1 2 217.247 2.482 20 0 BEADLO CNC(=O)[C@H](C)Nc1cc(C)c2ccccc2[nH+]1 ZINC000310624695 971980852 /nfs/dbraw/zinc/98/08/52/971980852.db2.gz CLWSUVMNXIUIQU-JTQLQIEISA-N 1 2 243.310 2.090 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1ccc(OC)cc1C ZINC001136600714 972211340 /nfs/dbraw/zinc/21/13/40/972211340.db2.gz CHVGLQIIHLOMDK-ZDUSSCGKSA-N 1 2 248.326 2.036 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1ccc(OC)cc1C ZINC001136600714 972211350 /nfs/dbraw/zinc/21/13/50/972211350.db2.gz CHVGLQIIHLOMDK-ZDUSSCGKSA-N 1 2 248.326 2.036 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1ccc(F)c(C)c1 ZINC001136609476 972215419 /nfs/dbraw/zinc/21/54/19/972215419.db2.gz MQHVQYPYIACEIT-GFCCVEGCSA-N 1 2 236.290 2.167 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1ccc(F)c(C)c1 ZINC001136609476 972215425 /nfs/dbraw/zinc/21/54/25/972215425.db2.gz MQHVQYPYIACEIT-GFCCVEGCSA-N 1 2 236.290 2.167 20 0 BEADLO Cc1cc(N2CC[C@@H](O)C[C@H]2C)nc(C(C)C)[nH+]1 ZINC000705354664 957162147 /nfs/dbraw/zinc/16/21/47/957162147.db2.gz QMQGGFAQVYOIEE-VXGBXAGGSA-N 1 2 249.358 2.258 20 0 BEADLO CC1(C[N@@H+]2CCn3cnnc3C2)CCCCC1 ZINC001208898455 957232077 /nfs/dbraw/zinc/23/20/77/957232077.db2.gz SRVLGWCTNWSCFP-UHFFFAOYSA-N 1 2 234.347 2.064 20 0 BEADLO CC1(C[N@H+]2CCn3cnnc3C2)CCCCC1 ZINC001208898455 957232087 /nfs/dbraw/zinc/23/20/87/957232087.db2.gz SRVLGWCTNWSCFP-UHFFFAOYSA-N 1 2 234.347 2.064 20 0 BEADLO CC1(F)CC[NH+](Cc2cnc(Cl)nc2)CC1 ZINC001139988078 957309060 /nfs/dbraw/zinc/30/90/60/957309060.db2.gz OEIOFZSRYJRIOG-UHFFFAOYSA-N 1 2 243.713 2.454 20 0 BEADLO CSc1cc(Nc2ccnnc2)cc[nH+]1 ZINC001209959340 957577997 /nfs/dbraw/zinc/57/79/97/957577997.db2.gz QJNANBYLLJNETN-UHFFFAOYSA-N 1 2 218.285 2.337 20 0 BEADLO Cc1cc2[nH]ncc2cc1Nc1[nH+]ccn1C ZINC001210100204 957639098 /nfs/dbraw/zinc/63/90/98/957639098.db2.gz IXEOYONVFGFWEE-UHFFFAOYSA-N 1 2 227.271 2.348 20 0 BEADLO Cc1[nH+]cc(Nc2ccc(N(C)C)nc2)cc1N ZINC001210285285 957714544 /nfs/dbraw/zinc/71/45/44/957714544.db2.gz NBXCPTGNUFCBSD-UHFFFAOYSA-N 1 2 243.314 2.177 20 0 BEADLO Cc1noc(C)c1Nc1c[nH+]c(C)c(N)c1 ZINC001210286708 957715888 /nfs/dbraw/zinc/71/58/88/957715888.db2.gz DZSSLVTZQXLPAW-UHFFFAOYSA-N 1 2 218.260 2.321 20 0 BEADLO CO[C@@H]1CC[N@H+](C/C(Cl)=C/Cl)C1 ZINC000307516889 957770184 /nfs/dbraw/zinc/77/01/84/957770184.db2.gz HWAMSSAVXIJASJ-RBMBQVQZSA-N 1 2 210.104 2.026 20 0 BEADLO CO[C@@H]1CC[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000307516889 957770187 /nfs/dbraw/zinc/77/01/87/957770187.db2.gz HWAMSSAVXIJASJ-RBMBQVQZSA-N 1 2 210.104 2.026 20 0 BEADLO C[C@H]1C[C@@H](CF)[N@H+](Cc2ncccc2F)C1 ZINC001207027285 957785708 /nfs/dbraw/zinc/78/57/08/957785708.db2.gz ZUZRDKZALDJMOI-UWVGGRQHSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@H]1C[C@@H](CF)[N@@H+](Cc2ncccc2F)C1 ZINC001207027285 957785712 /nfs/dbraw/zinc/78/57/12/957785712.db2.gz ZUZRDKZALDJMOI-UWVGGRQHSA-N 1 2 226.270 2.401 20 0 BEADLO Cc1cc2cc(NC3CC(=O)C3)[nH+]cc2[nH]1 ZINC001167335966 957789625 /nfs/dbraw/zinc/78/96/25/957789625.db2.gz MLAJJPBLUPHXDA-UHFFFAOYSA-N 1 2 215.256 2.015 20 0 BEADLO COc1cc(Nc2c(N)cccc2O)cc(C)[nH+]1 ZINC001210781060 957879747 /nfs/dbraw/zinc/87/97/47/957879747.db2.gz WIXMJDYUYYAOJD-UHFFFAOYSA-N 1 2 245.282 2.430 20 0 BEADLO Cc1cc(NC[C@H](C)O)[nH+]c2ccccc12 ZINC000072112207 957913131 /nfs/dbraw/zinc/91/31/31/957913131.db2.gz AXXXVHCHAXOOME-JTQLQIEISA-N 1 2 216.284 2.336 20 0 BEADLO Cc1cn2cccc(Nc3ccncn3)c2[nH+]1 ZINC001211024484 957991358 /nfs/dbraw/zinc/99/13/58/957991358.db2.gz SFVISKWOZVFGER-UHFFFAOYSA-N 1 2 225.255 2.176 20 0 BEADLO Cc1cc[nH+]c(C)c1N[C@](C)(C(N)=O)C(C)C ZINC001167415637 958045997 /nfs/dbraw/zinc/04/59/97/958045997.db2.gz WRBGIMOYBKZBHH-ZDUSSCGKSA-N 1 2 235.331 2.010 20 0 BEADLO COc1ccc(Nc2c[nH+]cc(C)c2C)nn1 ZINC001213523209 958200285 /nfs/dbraw/zinc/20/02/85/958200285.db2.gz NIPURPOMGZFKFQ-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO Cc1c[nH+]cc(Nc2cnccn2)c1C ZINC001213523205 958201112 /nfs/dbraw/zinc/20/11/12/958201112.db2.gz NHLWSGSBMGRYGC-UHFFFAOYSA-N 1 2 200.245 2.232 20 0 BEADLO Cc1c[nH+]cc(Nc2ccc(CO)nc2)c1C ZINC001213527621 958210915 /nfs/dbraw/zinc/21/09/15/958210915.db2.gz WFQDCMREJRBVMG-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO COc1cc(F)c(F)cc1C[NH+]1CCC1 ZINC001143387498 958212374 /nfs/dbraw/zinc/21/23/74/958212374.db2.gz KDQHGQBFFROWJL-UHFFFAOYSA-N 1 2 213.227 2.179 20 0 BEADLO Cc1cccc(C[NH2+]Cc2csnn2)c1C ZINC000398482044 958278764 /nfs/dbraw/zinc/27/87/64/958278764.db2.gz RYWPQJXMNMAKHI-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO CC1(C)CCC[C@@H](N[C@@H]2C[NH2+]CC2(F)F)C1 ZINC001246461257 972337952 /nfs/dbraw/zinc/33/79/52/972337952.db2.gz OHFWEWUVBSONMV-NXEZZACHSA-N 1 2 232.318 2.152 20 0 BEADLO C[C@H]1CC(=O)CC[N@@H+]1Cc1ccc2[nH]cnc2c1 ZINC001137041118 972340886 /nfs/dbraw/zinc/34/08/86/972340886.db2.gz LRMKXFBPXBBCAD-JTQLQIEISA-N 1 2 243.310 2.116 20 0 BEADLO C[C@H]1CC(=O)CC[N@H+]1Cc1ccc2[nH]cnc2c1 ZINC001137041118 972340889 /nfs/dbraw/zinc/34/08/89/972340889.db2.gz LRMKXFBPXBBCAD-JTQLQIEISA-N 1 2 243.310 2.116 20 0 BEADLO c1[nH+]cn2ccnc(N3CCCCCCC3)c12 ZINC000891441775 958389655 /nfs/dbraw/zinc/38/96/55/958389655.db2.gz IYIRCLPYAIBVCV-UHFFFAOYSA-N 1 2 230.315 2.500 20 0 BEADLO C[C@H](CN(C)c1cc(N)nc[nH+]1)C(C)(C)C ZINC000399488135 958751076 /nfs/dbraw/zinc/75/10/76/958751076.db2.gz GYDVYQXORNFDFG-SECBINFHSA-N 1 2 222.336 2.177 20 0 BEADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)[C@H]1C[C@@H]1F ZINC001143429924 958803909 /nfs/dbraw/zinc/80/39/09/958803909.db2.gz DGMYHIWXMUVMMB-RYUDHWBXSA-N 1 2 245.257 2.169 20 0 BEADLO c1cn(CCO[C@@H]2CC3CCC2CC3)c[nH+]1 ZINC001222135330 972384250 /nfs/dbraw/zinc/38/42/50/972384250.db2.gz YAALVTPNBJBXMC-WXRRBKDZSA-N 1 2 220.316 2.478 20 0 BEADLO COc1cc[nH+]cc1Nc1cnc(F)c(OC)c1 ZINC001216420204 958889197 /nfs/dbraw/zinc/88/91/97/958889197.db2.gz XRLSKXCMTAJMTI-UHFFFAOYSA-N 1 2 249.245 2.377 20 0 BEADLO F[C@H]1CCCC[C@H]1OCCn1cc[nH+]c1 ZINC001222138524 972386997 /nfs/dbraw/zinc/38/69/97/972386997.db2.gz GCAIQIGLQMMTAD-WDEREUQCSA-N 1 2 212.268 2.180 20 0 BEADLO C[C@@H](OCCn1cc[nH+]c1)C1CCCC1 ZINC001222139698 972388080 /nfs/dbraw/zinc/38/80/80/972388080.db2.gz URDRXUGGFMHKJY-LLVKDONJSA-N 1 2 208.305 2.478 20 0 BEADLO CO[C@H]1C[N@H+](Cc2cc(F)ccc2C)C[C@@H]1F ZINC001140589761 959043655 /nfs/dbraw/zinc/04/36/55/959043655.db2.gz MJMLKHULCBJOAU-STQMWFEESA-N 1 2 241.281 2.303 20 0 BEADLO CO[C@H]1C[N@@H+](Cc2cc(F)ccc2C)C[C@@H]1F ZINC001140589761 959043674 /nfs/dbraw/zinc/04/36/74/959043674.db2.gz MJMLKHULCBJOAU-STQMWFEESA-N 1 2 241.281 2.303 20 0 BEADLO Cc1c(Cl)ncnc1NCc1cc[nH+]c(N)c1 ZINC001167611729 959057458 /nfs/dbraw/zinc/05/74/58/959057458.db2.gz BBNUDYQRJPHXGA-UHFFFAOYSA-N 1 2 249.705 2.028 20 0 BEADLO Nc1cc(CNc2ccc3c(c2)CCO3)cc[nH+]1 ZINC001167617818 959092946 /nfs/dbraw/zinc/09/29/46/959092946.db2.gz VYSWDDZOXMGRDP-UHFFFAOYSA-N 1 2 241.294 2.211 20 0 BEADLO Nc1cc(CSc2nccn2C2CC2)cc[nH+]1 ZINC000689854151 959347192 /nfs/dbraw/zinc/34/71/92/959347192.db2.gz LVJRMSVLDJZXHT-UHFFFAOYSA-N 1 2 246.339 2.488 20 0 BEADLO C/C=C/C=C/C(=O)NCc1c[nH+]cn1C1CCC1 ZINC001144008568 972456361 /nfs/dbraw/zinc/45/63/61/972456361.db2.gz MEMOKBJDHCGHKY-CRBCFSCISA-N 1 2 245.326 2.357 20 0 BEADLO CCOCC[C@H](C)[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC001172409499 974671502 /nfs/dbraw/zinc/67/15/02/974671502.db2.gz VMNIBYZHQAOAOL-QWRGUYRKSA-N 1 2 245.363 2.121 20 0 BEADLO COc1ccc2c(c1)C[N@@H+](Cc1cnco1)CC2 ZINC001140927396 960090770 /nfs/dbraw/zinc/09/07/70/960090770.db2.gz QDIMEVOXMFYJIN-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1ccc2c(c1)C[N@H+](Cc1cnco1)CC2 ZINC001140927396 960090780 /nfs/dbraw/zinc/09/07/80/960090780.db2.gz QDIMEVOXMFYJIN-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO C=C/C(C)=C/CC(=O)NC1C[NH+](CC=C(C)C)C1 ZINC001267654498 960175593 /nfs/dbraw/zinc/17/55/93/960175593.db2.gz ABOBAVGGHXUYGM-AWNIVKPZSA-N 1 2 248.370 2.275 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001140593316 960448088 /nfs/dbraw/zinc/44/80/88/960448088.db2.gz CMXCNHYEEHGPCT-ZIAGYGMSSA-N 1 2 235.302 2.497 20 0 BEADLO Cc1ccc(F)cc1C[N@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001140593316 960448101 /nfs/dbraw/zinc/44/81/01/960448101.db2.gz CMXCNHYEEHGPCT-ZIAGYGMSSA-N 1 2 235.302 2.497 20 0 BEADLO OCc1ccc(C[NH+]2CC3(C2)CC(F)(F)C3)o1 ZINC001140680770 960490119 /nfs/dbraw/zinc/49/01/19/960490119.db2.gz UXYAPEXXHVRVGC-UHFFFAOYSA-N 1 2 243.253 2.003 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2ccc(CO)o2)C[C@H]1F ZINC001140679027 960491935 /nfs/dbraw/zinc/49/19/35/960491935.db2.gz NXAMDKSEFOJERI-VXGBXAGGSA-N 1 2 245.269 2.044 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2ccc(CO)o2)C[C@H]1F ZINC001140679027 960491940 /nfs/dbraw/zinc/49/19/40/960491940.db2.gz NXAMDKSEFOJERI-VXGBXAGGSA-N 1 2 245.269 2.044 20 0 BEADLO CC[C@H](C)NC(=S)Nc1ccc2[nH+]ccn2c1 ZINC001200468174 960506415 /nfs/dbraw/zinc/50/64/15/960506415.db2.gz CYYGCVZQTSKIKW-VIFPVBQESA-N 1 2 248.355 2.419 20 0 BEADLO c1cc(C[NH+]2CC(Oc3ccccc3)C2)c[nH]1 ZINC001140707423 960518005 /nfs/dbraw/zinc/51/80/05/960518005.db2.gz JRWYYHPCCGQPJR-UHFFFAOYSA-N 1 2 228.295 2.278 20 0 BEADLO CC(=O)[C@@H]1CCC[N@@H+]1Cc1c[nH]c2ccncc12 ZINC001140806516 960604916 /nfs/dbraw/zinc/60/49/16/960604916.db2.gz LPFLSCZDOHBNDR-AWEZNQCLSA-N 1 2 243.310 2.116 20 0 BEADLO CC(=O)[C@@H]1CCC[N@H+]1Cc1c[nH]c2ccncc12 ZINC001140806516 960604926 /nfs/dbraw/zinc/60/49/26/960604926.db2.gz LPFLSCZDOHBNDR-AWEZNQCLSA-N 1 2 243.310 2.116 20 0 BEADLO Cc1cc(C[N@@H+]2CCCC(F)(F)CC2)n[nH]1 ZINC001203070125 960626880 /nfs/dbraw/zinc/62/68/80/960626880.db2.gz ICOZUILAHIVYDL-UHFFFAOYSA-N 1 2 229.274 2.339 20 0 BEADLO Cc1cc(C[N@H+]2CCCC(F)(F)CC2)n[nH]1 ZINC001203070125 960626890 /nfs/dbraw/zinc/62/68/90/960626890.db2.gz ICOZUILAHIVYDL-UHFFFAOYSA-N 1 2 229.274 2.339 20 0 BEADLO CCCOC1C[NH+](Cc2[nH]cc(C)c2C)C1 ZINC001140860027 960633013 /nfs/dbraw/zinc/63/30/13/960633013.db2.gz KKZZJJLLXBLXNZ-UHFFFAOYSA-N 1 2 222.332 2.242 20 0 BEADLO Oc1ccc(C[NH+]2CCCC2)c(F)c1F ZINC001140889480 960672236 /nfs/dbraw/zinc/67/22/36/960672236.db2.gz HHKJJWILCFJFHX-UHFFFAOYSA-N 1 2 213.227 2.266 20 0 BEADLO CC[N@H+](Cc1cnco1)Cc1ccccn1 ZINC001140932342 960708848 /nfs/dbraw/zinc/70/88/48/960708848.db2.gz KNFKWYLNAGDDQB-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO CC[N@@H+](Cc1cnco1)Cc1ccccn1 ZINC001140932342 960708871 /nfs/dbraw/zinc/70/88/71/960708871.db2.gz KNFKWYLNAGDDQB-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO Cn1c[nH+]cc1COC(C1CC1)C1CC1 ZINC001222595115 960722370 /nfs/dbraw/zinc/72/23/70/960722370.db2.gz PFUOEISRYFPSBN-UHFFFAOYSA-N 1 2 206.289 2.125 20 0 BEADLO C[C@@]1(F)CCCC[N@H+](Cc2ncco2)C1 ZINC001141005098 960804406 /nfs/dbraw/zinc/80/44/06/960804406.db2.gz UAPGLVZUQQMFON-LLVKDONJSA-N 1 2 212.268 2.389 20 0 BEADLO C[C@@]1(F)CCCC[N@@H+](Cc2ncco2)C1 ZINC001141005098 960804407 /nfs/dbraw/zinc/80/44/07/960804407.db2.gz UAPGLVZUQQMFON-LLVKDONJSA-N 1 2 212.268 2.389 20 0 BEADLO F[C@H]1CC[N@H+](Cc2cocn2)CCC1(F)F ZINC001141126088 960872291 /nfs/dbraw/zinc/87/22/91/960872291.db2.gz JRDGLDMSLZQYKQ-VIFPVBQESA-N 1 2 234.221 2.244 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2cocn2)CCC1(F)F ZINC001141126088 960872302 /nfs/dbraw/zinc/87/23/02/960872302.db2.gz JRDGLDMSLZQYKQ-VIFPVBQESA-N 1 2 234.221 2.244 20 0 BEADLO Cc1ncc(C[N@@H+]2CCCC[C@H](F)C2)cn1 ZINC001203102615 960946919 /nfs/dbraw/zinc/94/69/19/960946919.db2.gz IDLITZZLNBFIAU-LBPRGKRZSA-N 1 2 223.295 2.109 20 0 BEADLO Cc1ncc(C[N@H+]2CCCC[C@H](F)C2)cn1 ZINC001203102615 960946961 /nfs/dbraw/zinc/94/69/61/960946961.db2.gz IDLITZZLNBFIAU-LBPRGKRZSA-N 1 2 223.295 2.109 20 0 BEADLO CCc1ccccc1C[N@@H+]1CCn2nccc2C1 ZINC001141230069 960982623 /nfs/dbraw/zinc/98/26/23/960982623.db2.gz WGPNDLIZNCBMOJ-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO CCc1ccccc1C[N@H+]1CCn2nccc2C1 ZINC001141230069 960982675 /nfs/dbraw/zinc/98/26/75/960982675.db2.gz WGPNDLIZNCBMOJ-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO OCC1(Nc2cc3cc[nH]c3c[nH+]2)CCCC1 ZINC001167802079 961029208 /nfs/dbraw/zinc/02/92/08/961029208.db2.gz KQQQFSZIFJBYPJ-UHFFFAOYSA-N 1 2 231.299 2.280 20 0 BEADLO C[C@@H]1C[C@H](O)C[N@H+](C/C(Cl)=C\Cl)C1 ZINC000401774705 961123140 /nfs/dbraw/zinc/12/31/40/961123140.db2.gz YJPAFWVNEZKAKQ-DNJSMNHWSA-N 1 2 224.131 2.008 20 0 BEADLO C[C@@H]1C[C@H](O)C[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000401774705 961123149 /nfs/dbraw/zinc/12/31/49/961123149.db2.gz YJPAFWVNEZKAKQ-DNJSMNHWSA-N 1 2 224.131 2.008 20 0 BEADLO CSc1ccc(C[N@H+](C)C2COC2)s1 ZINC001142027771 961222987 /nfs/dbraw/zinc/22/29/87/961222987.db2.gz LFFORIMANBNXJU-UHFFFAOYSA-N 1 2 229.370 2.301 20 0 BEADLO CSc1ccc(C[N@@H+](C)C2COC2)s1 ZINC001142027771 961223001 /nfs/dbraw/zinc/22/30/01/961223001.db2.gz LFFORIMANBNXJU-UHFFFAOYSA-N 1 2 229.370 2.301 20 0 BEADLO Cc1occc1C[NH+]1CC(O)(c2ccccc2)C1 ZINC000840947685 961236050 /nfs/dbraw/zinc/23/60/50/961236050.db2.gz ZYNVADXRRQIGTH-UHFFFAOYSA-N 1 2 243.306 2.291 20 0 BEADLO Cc1nc(-c2cccnc2)nc(NC=[NH2+])c1C ZINC001167866152 961346468 /nfs/dbraw/zinc/34/64/68/961346468.db2.gz ZNTLQBGZKWFNJG-UHFFFAOYSA-N 1 2 227.271 2.174 20 0 BEADLO Cc1cncc(C[NH+]2CC3(C2)CC(F)(F)C3)n1 ZINC001203161814 961357445 /nfs/dbraw/zinc/35/74/45/961357445.db2.gz NRJUAYDMQOJRSM-UHFFFAOYSA-N 1 2 239.269 2.016 20 0 BEADLO Cc1nc(N2C[C@H](O)CC[C@H]2C)cc(C(C)C)[nH+]1 ZINC000709792380 961579401 /nfs/dbraw/zinc/57/94/01/961579401.db2.gz NGUIEXINIPJPCI-ZYHUDNBSSA-N 1 2 249.358 2.258 20 0 BEADLO C[N@H+](Cc1ccon1)Cc1ccnc2[nH]ccc21 ZINC001142879490 961810211 /nfs/dbraw/zinc/81/02/11/961810211.db2.gz VVSPKRFUTDPRDH-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO C[N@@H+](Cc1ccon1)Cc1ccnc2[nH]ccc21 ZINC001142879490 961810212 /nfs/dbraw/zinc/81/02/12/961810212.db2.gz VVSPKRFUTDPRDH-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO FC1(C2CC2)CN(Cc2ccc3[nH+]ccn3c2)C1 ZINC001143017987 961866399 /nfs/dbraw/zinc/86/63/99/961866399.db2.gz DBVLPEOKYLADSC-UHFFFAOYSA-N 1 2 245.301 2.268 20 0 BEADLO CC[C@H](CO)Nc1cc(CSC)cc[nH+]1 ZINC000092826493 961892830 /nfs/dbraw/zinc/89/28/30/961892830.db2.gz GTZVGVMFXYUOFT-SNVBAGLBSA-N 1 2 226.345 2.127 20 0 BEADLO CCc1ccc(C[NH2+]Cc2csnn2)cc1 ZINC000132625828 962465161 /nfs/dbraw/zinc/46/51/61/962465161.db2.gz RTXFLKVGBYNMCS-UHFFFAOYSA-N 1 2 233.340 2.390 20 0 BEADLO Nc1ccc(N2CCC[C@H]2c2nccs2)[nH+]c1 ZINC000710788766 962473208 /nfs/dbraw/zinc/47/32/08/962473208.db2.gz WWOUDCRJNSTCSC-JTQLQIEISA-N 1 2 246.339 2.462 20 0 BEADLO CCN(CC)C(=O)c1c[nH]c2cc[nH+]cc21 ZINC001152969329 962500322 /nfs/dbraw/zinc/50/03/22/962500322.db2.gz KQHCWHQQABFYEG-UHFFFAOYSA-N 1 2 217.272 2.045 20 0 BEADLO Cc1ncc(-c2c[nH+]c(N)c(C)c2)s1 ZINC000710895278 962533307 /nfs/dbraw/zinc/53/33/07/962533307.db2.gz MZKZORQECMMPQV-UHFFFAOYSA-N 1 2 205.286 2.404 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc(O)c(F)c2)[C@H](C)CO1 ZINC000300434932 962543196 /nfs/dbraw/zinc/54/31/96/962543196.db2.gz BNYJRGICVCEFDK-NXEZZACHSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc(O)c(F)c2)[C@H](C)CO1 ZINC000300434932 962543203 /nfs/dbraw/zinc/54/32/03/962543203.db2.gz BNYJRGICVCEFDK-NXEZZACHSA-N 1 2 239.290 2.141 20 0 BEADLO Cc1cc(C)n(CCNc2[nH+]ccc(F)c2C)n1 ZINC001154786624 962848198 /nfs/dbraw/zinc/84/81/98/962848198.db2.gz QRUQHQYXENOQOV-UHFFFAOYSA-N 1 2 248.305 2.455 20 0 BEADLO CCOc1ccc[nH+]c1NC1CC(F)C1 ZINC001154843477 962866844 /nfs/dbraw/zinc/86/68/44/962866844.db2.gz LLMRQIACOCYXLX-UHFFFAOYSA-N 1 2 210.252 2.393 20 0 BEADLO Cn1cccc1CNc1cc(N)cc(Cl)[nH+]1 ZINC001155210229 963023452 /nfs/dbraw/zinc/02/34/52/963023452.db2.gz FWPPQUZPYITVSG-UHFFFAOYSA-N 1 2 236.706 2.268 20 0 BEADLO Nc1ccc2cnn(-c3ccn4cc[nH+]c4c3)c2c1 ZINC001204970933 963132266 /nfs/dbraw/zinc/13/22/66/963132266.db2.gz CBPCULOHQMHBGM-UHFFFAOYSA-N 1 2 249.277 2.255 20 0 BEADLO Cc1cc(F)cc(C[N@@H+]2C[C@H](F)C[C@H]2CO)c1 ZINC001143580373 963156766 /nfs/dbraw/zinc/15/67/66/963156766.db2.gz HQCSYIFDBBAYEO-OLZOCXBDSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cc(F)cc(C[N@H+]2C[C@H](F)C[C@H]2CO)c1 ZINC001143580373 963156773 /nfs/dbraw/zinc/15/67/73/963156773.db2.gz HQCSYIFDBBAYEO-OLZOCXBDSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cc(F)cc(C[N@H+]2CCOC[C@H]2C)c1 ZINC001143580607 963167476 /nfs/dbraw/zinc/16/74/76/963167476.db2.gz PLOQUPFRMAQLFD-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cc(F)cc(C[N@@H+]2CCOC[C@H]2C)c1 ZINC001143580607 963167493 /nfs/dbraw/zinc/16/74/93/963167493.db2.gz PLOQUPFRMAQLFD-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ccc(C)c(Nc2cnc3ccnn3c2)[nH+]1 ZINC001204780961 963525663 /nfs/dbraw/zinc/52/56/63/963525663.db2.gz LNIAIXAUFHCMLV-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO CCc1nc(Cl)nc(Cl)c1NC=[NH2+] ZINC001157080298 963526286 /nfs/dbraw/zinc/52/62/86/963526286.db2.gz RQDIXPKSDHBYCB-UHFFFAOYSA-N 1 2 219.075 2.365 20 0 BEADLO Cc1nc(N2CCC[C@@H]3C[C@@H]32)c2c([nH+]1)CCC2 ZINC001157143856 963545915 /nfs/dbraw/zinc/54/59/15/963545915.db2.gz OFPNYEOETNOWBD-MFKMUULPSA-N 1 2 229.327 2.262 20 0 BEADLO COc1ccc[nH+]c1NCC1(F)CCOCC1 ZINC001157349707 963579688 /nfs/dbraw/zinc/57/96/88/963579688.db2.gz ITJFLIUKYWOTDN-UHFFFAOYSA-N 1 2 240.278 2.021 20 0 BEADLO Cc1c(F)cc[nH+]c1N(C)Cc1ccno1 ZINC001157353376 963583016 /nfs/dbraw/zinc/58/30/16/963583016.db2.gz KBEJTSYRHGSBLG-UHFFFAOYSA-N 1 2 221.235 2.154 20 0 BEADLO C[C@@H]1C[C@H]([NH2+]CC(F)(F)C(F)(F)F)CCO1 ZINC001168072664 963600259 /nfs/dbraw/zinc/60/02/59/963600259.db2.gz VXDKRICAZSCEND-RNFRBKRXSA-N 1 2 247.207 2.341 20 0 BEADLO CSCc1ccc(NCC2CC(=O)C2)[nH+]c1 ZINC001157611218 963679170 /nfs/dbraw/zinc/67/91/70/963679170.db2.gz LVEKTDDTHURMHT-UHFFFAOYSA-N 1 2 236.340 2.336 20 0 BEADLO Cc1nc2[nH]ccc2c(NC[C@@H]2CC(C)(C)O2)[nH+]1 ZINC001157663685 963695471 /nfs/dbraw/zinc/69/54/71/963695471.db2.gz WXHKRMRVZNRWLD-VIFPVBQESA-N 1 2 246.314 2.246 20 0 BEADLO COc1cc[nH+]cc1NCC1(F)CCOCC1 ZINC001168124116 963794332 /nfs/dbraw/zinc/79/43/32/963794332.db2.gz PFMYAWFZVSXFKL-UHFFFAOYSA-N 1 2 240.278 2.021 20 0 BEADLO CCCNc1[nH+]cc(OC)c2cc[nH]c21 ZINC001168131017 963817216 /nfs/dbraw/zinc/81/72/16/963817216.db2.gz WUZNNZJUAJRGPA-UHFFFAOYSA-N 1 2 205.261 2.393 20 0 BEADLO Cc1ccccc1NC(=O)[C@H](C)n1cc[nH+]c1 ZINC000053898592 963844056 /nfs/dbraw/zinc/84/40/56/963844056.db2.gz UTYUBARPGXZDKU-NSHDSACASA-N 1 2 229.283 2.391 20 0 BEADLO c1nc(C[N@@H+]2CC[C@H]3CCCO[C@H]3C2)cs1 ZINC001137592682 963880470 /nfs/dbraw/zinc/88/04/70/963880470.db2.gz YZERJLBQTRNQIP-PWSUYJOCSA-N 1 2 238.356 2.144 20 0 BEADLO c1nc(C[N@H+]2CC[C@H]3CCCO[C@H]3C2)cs1 ZINC001137592682 963880473 /nfs/dbraw/zinc/88/04/73/963880473.db2.gz YZERJLBQTRNQIP-PWSUYJOCSA-N 1 2 238.356 2.144 20 0 BEADLO COc1cc[nH+]cc1NCCOC(F)(F)F ZINC001168167203 963894759 /nfs/dbraw/zinc/89/47/59/963894759.db2.gz SXQZVIVPGBVUCZ-UHFFFAOYSA-N 1 2 236.193 2.039 20 0 BEADLO CC(=O)[C@@H]1CCCN1c1[nH+]ccc2[nH]ccc21 ZINC001158835497 963938703 /nfs/dbraw/zinc/93/87/03/963938703.db2.gz DZBFUMLVBKZRJF-LBPRGKRZSA-N 1 2 229.283 2.121 20 0 BEADLO CC[NH+]1CC(Oc2ncc(O)c3ccccc32)C1 ZINC001229141196 964064782 /nfs/dbraw/zinc/06/47/82/964064782.db2.gz LXDIXHXRCSGLDF-UHFFFAOYSA-N 1 2 244.294 2.023 20 0 BEADLO COC(C)(CNc1cc(SC)cc[nH+]1)OC ZINC001159382866 964075857 /nfs/dbraw/zinc/07/58/57/964075857.db2.gz RKXQXGVWUNWVNT-UHFFFAOYSA-N 1 2 242.344 2.224 20 0 BEADLO Cc1ccc(-c2noc(C[NH+]3CCC3)n2)cc1F ZINC001212093430 964254407 /nfs/dbraw/zinc/25/44/07/964254407.db2.gz VSQSKZCLEYSRQE-UHFFFAOYSA-N 1 2 247.273 2.390 20 0 BEADLO O=c1[nH]cccc1Nc1cccc2[nH+]c[nH]c21 ZINC001213027160 964436314 /nfs/dbraw/zinc/43/63/14/964436314.db2.gz MCGSVUJGRSPDOU-UHFFFAOYSA-N 1 2 226.239 2.407 20 0 BEADLO CCOC(=O)[C@@H](C)CNc1[nH+]ccc(F)c1C ZINC001160890908 964437293 /nfs/dbraw/zinc/43/72/93/964437293.db2.gz ZCAGSCZLEKIXDY-QMMMGPOBSA-N 1 2 240.278 2.140 20 0 BEADLO c1[nH+]cn(CC2CCC2)c1CNc1cnccn1 ZINC001161529909 964622975 /nfs/dbraw/zinc/62/29/75/964622975.db2.gz OZYROQQWHXOKJS-UHFFFAOYSA-N 1 2 243.314 2.085 20 0 BEADLO CCc1cnc(NCc2c[nH+]cn2C(C)C)nc1 ZINC001161562792 964642096 /nfs/dbraw/zinc/64/20/96/964642096.db2.gz GBRRMSHACJSDCV-UHFFFAOYSA-N 1 2 245.330 2.429 20 0 BEADLO CCc1nccnc1NCc1c[nH+]cn1C(C)C ZINC001161564903 964645448 /nfs/dbraw/zinc/64/54/48/964645448.db2.gz GLAWEVNCNQZKJO-UHFFFAOYSA-N 1 2 245.330 2.429 20 0 BEADLO Cc1ncccc1NCCCn1cc[nH+]c1 ZINC001161684727 964685019 /nfs/dbraw/zinc/68/50/19/964685019.db2.gz LGZGQINYAFGPMJ-UHFFFAOYSA-N 1 2 216.288 2.089 20 0 BEADLO CC(C)c1ncc(NCCCn2cc[nH+]c2)cn1 ZINC001161688950 964686902 /nfs/dbraw/zinc/68/69/02/964686902.db2.gz DCNBZNVRBPDQIA-UHFFFAOYSA-N 1 2 245.330 2.299 20 0 BEADLO COc1nc(C)ccc1NCCCn1cc[nH+]c1 ZINC001161687741 964687592 /nfs/dbraw/zinc/68/75/92/964687592.db2.gz AMUUFBDQHSWLTC-UHFFFAOYSA-N 1 2 246.314 2.097 20 0 BEADLO C[C@@H](O)c1ccc(-c2c[nH+]cn2C)cc1 ZINC000697922455 964689031 /nfs/dbraw/zinc/68/90/31/964689031.db2.gz OTJQCNROTHLZRM-SECBINFHSA-N 1 2 202.257 2.140 20 0 BEADLO CSc1cc[nH+]c(NCc2nnc(C)o2)c1 ZINC001161713445 964702389 /nfs/dbraw/zinc/70/23/89/964702389.db2.gz RVBAKFKTGJLGEG-UHFFFAOYSA-N 1 2 236.300 2.107 20 0 BEADLO CCC[C@H](C)Nc1[nH+]ccc(C)c1C(N)=O ZINC001161716713 964705940 /nfs/dbraw/zinc/70/59/40/964705940.db2.gz JYNLNVWYFOCLRB-VIFPVBQESA-N 1 2 221.304 2.089 20 0 BEADLO CC(C)[C@H](CO)Nc1ccc2[nH+]cn(C)c2c1 ZINC001161740406 964725721 /nfs/dbraw/zinc/72/57/21/964725721.db2.gz FDBSVYVHCPWRRV-LBPRGKRZSA-N 1 2 233.315 2.002 20 0 BEADLO CC[N@H+](Cc1cc(C)c(F)c(F)c1)C1COC1 ZINC001143607652 964735973 /nfs/dbraw/zinc/73/59/73/964735973.db2.gz UHXDLNBKIYRAEB-UHFFFAOYSA-N 1 2 241.281 2.494 20 0 BEADLO CC[N@@H+](Cc1cc(C)c(F)c(F)c1)C1COC1 ZINC001143607652 964735984 /nfs/dbraw/zinc/73/59/84/964735984.db2.gz UHXDLNBKIYRAEB-UHFFFAOYSA-N 1 2 241.281 2.494 20 0 BEADLO Cc1cc[nH+]c(N[C@@H]2CC=CCC2)c1C(N)=O ZINC001161752891 964736124 /nfs/dbraw/zinc/73/61/24/964736124.db2.gz VWKWWQQQKHZFIU-SNVBAGLBSA-N 1 2 231.299 2.010 20 0 BEADLO CSc1cc(NCCOC(C)C)nc(C)[nH+]1 ZINC001161788257 964757512 /nfs/dbraw/zinc/75/75/12/964757512.db2.gz NPKPSBKVPZUKLJ-UHFFFAOYSA-N 1 2 241.360 2.344 20 0 BEADLO Cc1c[nH+]cc(NCCN2CCCCC2=O)c1C ZINC001161940699 964827107 /nfs/dbraw/zinc/82/71/07/964827107.db2.gz BTKBXYDJQLCCRK-UHFFFAOYSA-N 1 2 247.342 2.123 20 0 BEADLO COc1cccc2[nH+]c(NCC3COC3)ccc21 ZINC001161945557 964829373 /nfs/dbraw/zinc/82/93/73/964829373.db2.gz FJJJVGLHPVYLKN-UHFFFAOYSA-N 1 2 244.294 2.302 20 0 BEADLO COc1ccc2cc(NCC3COC3)[nH+]cc2c1 ZINC001161945776 964829630 /nfs/dbraw/zinc/82/96/30/964829630.db2.gz HHVFALYAOZUMTJ-UHFFFAOYSA-N 1 2 244.294 2.302 20 0 BEADLO Cc1nc2c(ccn2C)c(NC2CC(F)C2)[nH+]1 ZINC001162209197 964870621 /nfs/dbraw/zinc/87/06/21/964870621.db2.gz DVUVGRUHFOGMEE-UHFFFAOYSA-N 1 2 234.278 2.189 20 0 BEADLO CC(F)(F)CNc1ccn2cc[nH+]c2c1 ZINC001162230797 964887050 /nfs/dbraw/zinc/88/70/50/964887050.db2.gz SXMSREAQSUKICO-UHFFFAOYSA-N 1 2 211.215 2.401 20 0 BEADLO Cc1cnc(CCNc2c[nH+]ccc2C)nc1 ZINC001162246448 964890738 /nfs/dbraw/zinc/89/07/38/964890738.db2.gz XGOJAURZEKXUQC-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO Cc1c(F)cc[nH+]c1N[C@@H]1CCOC[C@@H]1F ZINC001162346084 964939375 /nfs/dbraw/zinc/93/93/75/964939375.db2.gz UBBLAMVNELCRTF-VHSXEESVSA-N 1 2 228.242 2.068 20 0 BEADLO Cc1ccc2c(c1)[C@@H](Nc1cccc[nH+]1)C(=O)N2 ZINC001162562659 965053967 /nfs/dbraw/zinc/05/39/67/965053967.db2.gz LABBDFAJVXOMAL-CYBMUJFWSA-N 1 2 239.278 2.495 20 0 BEADLO COc1cc[nH+]c(Nc2ccncc2Cl)c1 ZINC001212146615 965078783 /nfs/dbraw/zinc/07/87/83/965078783.db2.gz IABZWXPCEWMCEU-UHFFFAOYSA-N 1 2 235.674 2.304 20 0 BEADLO COc1c[nH+]c(NCC2CC(OC)C2)c(C)c1 ZINC001162991774 965223645 /nfs/dbraw/zinc/22/36/45/965223645.db2.gz QNVXSYJQJGZGAH-UHFFFAOYSA-N 1 2 236.315 2.236 20 0 BEADLO CC(C)[C@H](Nc1cc(N)nc[nH+]1)c1cccnc1 ZINC001163060506 965245510 /nfs/dbraw/zinc/24/55/10/965245510.db2.gz LKDIRQYNABBTAU-ZDUSSCGKSA-N 1 2 243.314 2.263 20 0 BEADLO C[C@H](Nc1cc(N)cc(Cl)[nH+]1)c1ccno1 ZINC001163208292 965303187 /nfs/dbraw/zinc/30/31/87/965303187.db2.gz ISBZBJWMZMLFRZ-LURJTMIESA-N 1 2 238.678 2.478 20 0 BEADLO C[C@H](Nc1ccc(Cl)c(N)[nH+]1)[C@@H]1CCCO1 ZINC001163482595 965418841 /nfs/dbraw/zinc/41/88/41/965418841.db2.gz ONLDWPWRIDTNLO-CBAPKCEASA-N 1 2 241.722 2.297 20 0 BEADLO O=c1ccc2c([nH]1)CC[C@@H](Nc1cccc[nH+]1)C2 ZINC001163547870 965444524 /nfs/dbraw/zinc/44/45/24/965444524.db2.gz QBBKMMWPLJVYNU-LLVKDONJSA-N 1 2 241.294 2.152 20 0 BEADLO COc1cc2ccc(N(C)C)[nH+]c2cc1OC ZINC001163569603 965447401 /nfs/dbraw/zinc/44/74/01/965447401.db2.gz VCKHDFYGOCCXCS-UHFFFAOYSA-N 1 2 232.283 2.318 20 0 BEADLO CSc1cc[nH+]c(N2CCCC[C@@H]2CO)c1 ZINC001163559278 965452796 /nfs/dbraw/zinc/45/27/96/965452796.db2.gz OOLHZMIJFHXCKS-SNVBAGLBSA-N 1 2 238.356 2.155 20 0 BEADLO Cc1cc(C)c(C[N@@H+]2CCOCC23CC3)cn1 ZINC001233013726 965453543 /nfs/dbraw/zinc/45/35/43/965453543.db2.gz VTIGYXOPYMFNFG-UHFFFAOYSA-N 1 2 232.327 2.063 20 0 BEADLO Cc1cc(C)c(C[N@H+]2CCOCC23CC3)cn1 ZINC001233013726 965453554 /nfs/dbraw/zinc/45/35/54/965453554.db2.gz VTIGYXOPYMFNFG-UHFFFAOYSA-N 1 2 232.327 2.063 20 0 BEADLO CC(=O)Nc1c(C)cc[nH+]c1N(C)C(C)C ZINC001163622031 965483967 /nfs/dbraw/zinc/48/39/67/965483967.db2.gz UQYJVYABNGVELN-UHFFFAOYSA-N 1 2 221.304 2.193 20 0 BEADLO CCN(CC)c1cc(N(C)C(C)C)nc[nH+]1 ZINC001163621539 965484182 /nfs/dbraw/zinc/48/41/82/965484182.db2.gz HXIFVXMDRLQUFR-UHFFFAOYSA-N 1 2 222.336 2.167 20 0 BEADLO CCN(CC)c1cc(N(C)C(C)C)[nH+]cn1 ZINC001163621539 965484191 /nfs/dbraw/zinc/48/41/91/965484191.db2.gz HXIFVXMDRLQUFR-UHFFFAOYSA-N 1 2 222.336 2.167 20 0 BEADLO Cc1cnsc1C[N@@H+]1CCOC[C@H]1C1CC1 ZINC001233321846 965492516 /nfs/dbraw/zinc/49/25/16/965492516.db2.gz GKAVIYKMUAETOX-NSHDSACASA-N 1 2 238.356 2.062 20 0 BEADLO Cc1cnsc1C[N@H+]1CCOC[C@H]1C1CC1 ZINC001233321846 965492529 /nfs/dbraw/zinc/49/25/29/965492529.db2.gz GKAVIYKMUAETOX-NSHDSACASA-N 1 2 238.356 2.062 20 0 BEADLO CNc1ccc(Nc2cnncc2Cl)c[nH+]1 ZINC001203449878 965502500 /nfs/dbraw/zinc/50/25/00/965502500.db2.gz NVEZGYFZJZALKZ-UHFFFAOYSA-N 1 2 235.678 2.310 20 0 BEADLO COc1cc(C)c[nH+]c1N(C)CC(F)(F)F ZINC001163709719 965529769 /nfs/dbraw/zinc/52/97/69/965529769.db2.gz IKVYRDNRUNVWLO-UHFFFAOYSA-N 1 2 234.221 2.397 20 0 BEADLO CC(C)(C)c1ccc(N2CC3(CC(O)C3)C2)[nH+]c1 ZINC001163742573 965563688 /nfs/dbraw/zinc/56/36/88/965563688.db2.gz BFUPEFMLHYIOHR-UHFFFAOYSA-N 1 2 246.354 2.340 20 0 BEADLO CSc1cc[nH+]c(N2CCCO[C@H](C)C2)c1 ZINC001163963210 965666334 /nfs/dbraw/zinc/66/63/34/965666334.db2.gz YNTBIYORGKTOQW-SNVBAGLBSA-N 1 2 238.356 2.419 20 0 BEADLO Cc1nc(N2CC(F)(C3CC3)C2)c2c([nH+]1)CCC2 ZINC001163968991 965666926 /nfs/dbraw/zinc/66/69/26/965666926.db2.gz HFTHEEHJUZTGAD-UHFFFAOYSA-N 1 2 247.317 2.212 20 0 BEADLO C[C@@H]1[C@H](CO)CCN1c1cc2ccccc2c[nH+]1 ZINC001164047621 965714828 /nfs/dbraw/zinc/71/48/28/965714828.db2.gz CYUNAZYTLRNYSQ-RISCZKNCSA-N 1 2 242.322 2.442 20 0 BEADLO O=C1CCCN(c2cccc(C3CC3)[nH+]2)C[C@@H]1F ZINC001164136633 965751357 /nfs/dbraw/zinc/75/13/57/965751357.db2.gz JKWDICLRXNKDOU-NSHDSACASA-N 1 2 248.301 2.466 20 0 BEADLO c1ccc(NCc2ccc3nonc3c2)[nH+]c1 ZINC001164336306 965849063 /nfs/dbraw/zinc/84/90/63/965849063.db2.gz XIJYWZUAPJGRFB-UHFFFAOYSA-N 1 2 226.239 2.230 20 0 BEADLO COc1ncc(Nc2c[nH+]c(C)cc2C)cc1N ZINC001203502628 965849930 /nfs/dbraw/zinc/84/99/30/965849930.db2.gz ZQXPVXXHWBMTLF-UHFFFAOYSA-N 1 2 244.298 2.428 20 0 BEADLO CCN(CC)C(=O)[C@@H](C)Nc1c[nH+]cc(C)c1C ZINC001164625140 965935171 /nfs/dbraw/zinc/93/51/71/965935171.db2.gz STFAMVFGTPTENV-GFCCVEGCSA-N 1 2 249.358 2.367 20 0 BEADLO CCc1ccc(C[N@@H+]2CCc3c(cnn3C)C2)o1 ZINC001204395656 965987437 /nfs/dbraw/zinc/98/74/37/965987437.db2.gz XJLGBVQRGHWJBC-UHFFFAOYSA-N 1 2 245.326 2.134 20 0 BEADLO CCc1ccc(C[N@H+]2CCc3c(cnn3C)C2)o1 ZINC001204395656 965987454 /nfs/dbraw/zinc/98/74/54/965987454.db2.gz XJLGBVQRGHWJBC-UHFFFAOYSA-N 1 2 245.326 2.134 20 0 BEADLO COc1cc[nH+]cc1NC[C@@H]1CCCCO1 ZINC001165229308 965993667 /nfs/dbraw/zinc/99/36/67/965993667.db2.gz GWOKXFUHPQODCM-JTQLQIEISA-N 1 2 222.288 2.071 20 0 BEADLO CN(C)c1ccc(NC[C@H]2CCCCO2)[nH+]c1 ZINC001165239168 966000826 /nfs/dbraw/zinc/00/08/26/966000826.db2.gz BPDBNYPRALNVOI-GFCCVEGCSA-N 1 2 235.331 2.129 20 0 BEADLO C[C@@H](Cc1cccc(F)c1)[NH+]1CC2(CCO2)C1 ZINC001168494821 966040029 /nfs/dbraw/zinc/04/00/29/966040029.db2.gz DEIJPODSZZSXFH-NSHDSACASA-N 1 2 235.302 2.231 20 0 BEADLO COc1cc(C)c[nH+]c1N1C[C@@H]2C[C@@H]2[C@H](F)C1 ZINC001165367259 966064653 /nfs/dbraw/zinc/06/46/53/966064653.db2.gz UQNNVKAHSHWEHI-GARJFASQSA-N 1 2 236.290 2.193 20 0 BEADLO COc1ccc(C)[nH+]c1N1C[C@@H]2C[C@@H]2[C@H](F)C1 ZINC001165367400 966065934 /nfs/dbraw/zinc/06/59/34/966065934.db2.gz WNKXAHDWTWRQDL-GARJFASQSA-N 1 2 236.290 2.193 20 0 BEADLO C[C@H](CCO)Nc1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001165967314 966213665 /nfs/dbraw/zinc/21/36/65/966213665.db2.gz STXSUNZNXGQEMA-SNVBAGLBSA-N 1 2 249.289 2.194 20 0 BEADLO C[C@@H](CCO)Nc1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001165967312 966217302 /nfs/dbraw/zinc/21/73/02/966217302.db2.gz STXSUNZNXGQEMA-JTQLQIEISA-N 1 2 249.289 2.194 20 0 BEADLO CC(C)c1ccc(N2CCC3(C2)OCCO3)[nH+]c1 ZINC001166588102 966311064 /nfs/dbraw/zinc/31/10/64/966311064.db2.gz KNWCTINGALHCRB-UHFFFAOYSA-N 1 2 248.326 2.158 20 0 BEADLO Cc1nc(N2CCn3cccc3C2)c(C)c(C)[nH+]1 ZINC001166603909 966325337 /nfs/dbraw/zinc/32/53/37/966325337.db2.gz HXXLLHBDOVHPTJ-UHFFFAOYSA-N 1 2 242.326 2.224 20 0 BEADLO CC(C)c1ccc(N2Cc3cnn(C)c3C2)[nH+]c1 ZINC001166762286 966399407 /nfs/dbraw/zinc/39/94/07/966399407.db2.gz LDQMLUCKWWAAOQ-UHFFFAOYSA-N 1 2 242.326 2.459 20 0 BEADLO CCc1cn(Cc2nc(-c3ccco3)no2)c[nH+]1 ZINC001166821651 966421160 /nfs/dbraw/zinc/42/11/60/966421160.db2.gz BVGDKEONTBJTCG-UHFFFAOYSA-N 1 2 244.254 2.137 20 0 BEADLO CCc1cn(Cc2cc(C)ccn2)c[nH+]1 ZINC001166822367 966423326 /nfs/dbraw/zinc/42/33/26/966423326.db2.gz KPHSAXHMRXLMOI-UHFFFAOYSA-N 1 2 201.273 2.197 20 0 BEADLO COc1cc(NC=CC(C)(C)O)cc(C)[nH+]1 ZINC001203215113 966558945 /nfs/dbraw/zinc/55/89/45/966558945.db2.gz RHWGVLJHMORJNQ-AATRIKPKSA-N 1 2 222.288 2.095 20 0 BEADLO Cc1ccc(Nc2cccnn2)c(C)[nH+]1 ZINC001203362662 966612397 /nfs/dbraw/zinc/61/23/97/966612397.db2.gz DBSWPFFYLPIOFU-UHFFFAOYSA-N 1 2 200.245 2.232 20 0 BEADLO Cc1ccc(Nc2c(N)ncnc2Cl)c(C)[nH+]1 ZINC001203363740 966613210 /nfs/dbraw/zinc/61/32/10/966613210.db2.gz WPUOBFMRZXWLBX-UHFFFAOYSA-N 1 2 249.705 2.468 20 0 BEADLO CNc1ccc(Nc2ccc(F)nc2)c[nH+]1 ZINC001203449069 966648645 /nfs/dbraw/zinc/64/86/45/966648645.db2.gz YMWDOSWUIWWJOX-UHFFFAOYSA-N 1 2 218.235 2.401 20 0 BEADLO CNc1ccc(Nc2ccc(CCO)cc2)c[nH+]1 ZINC001203454334 966654711 /nfs/dbraw/zinc/65/47/11/966654711.db2.gz BNASJTNVAOMAAJ-UHFFFAOYSA-N 1 2 243.310 2.402 20 0 BEADLO CNc1ccc(Nc2ccc(O)cc2O)c[nH+]1 ZINC001203455822 966655636 /nfs/dbraw/zinc/65/56/36/966655636.db2.gz WBHBARQCKBZJKL-UHFFFAOYSA-N 1 2 231.255 2.278 20 0 BEADLO Cc1cc(C)nc(-c2c[nH+]c(N)cc2C)n1 ZINC000715393644 966704357 /nfs/dbraw/zinc/70/43/57/966704357.db2.gz LBLBSTRBTUAKIU-UHFFFAOYSA-N 1 2 214.272 2.046 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2nccnc2N(C)C)c1 ZINC001203656195 966720792 /nfs/dbraw/zinc/72/07/92/966720792.db2.gz LZUQEEIBYNPVGM-UHFFFAOYSA-N 1 2 243.314 2.298 20 0 BEADLO Cc1cnn(C)c1Nc1cc(C)c[nH+]c1C ZINC001203656387 966722297 /nfs/dbraw/zinc/72/22/97/966722297.db2.gz PTUSUCGWCRZKPO-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO COc1cc(Nc2cc(C)c[nH+]c2C)no1 ZINC001203656408 966723053 /nfs/dbraw/zinc/72/30/53/966723053.db2.gz QYLXXZHFJDPFFH-UHFFFAOYSA-N 1 2 219.244 2.439 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2cnn3c2OCCC3)c1 ZINC001203661211 966724809 /nfs/dbraw/zinc/72/48/09/966724809.db2.gz SLKXTFFFVVVRCO-UHFFFAOYSA-N 1 2 244.298 2.421 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2ccn3cnnc3c2)c1 ZINC001203658017 966731017 /nfs/dbraw/zinc/73/10/17/966731017.db2.gz URQZLXNXMSBBDE-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2cc(N)c(O)cc2O)c1 ZINC001203667928 966734368 /nfs/dbraw/zinc/73/43/68/966734368.db2.gz QHZYDLKEIIHOPL-UHFFFAOYSA-N 1 2 245.282 2.435 20 0 BEADLO COC(=O)[C@@H]1CC[N@@H+]1Cc1ccc(C)cc1C ZINC001203728833 966758567 /nfs/dbraw/zinc/75/85/67/966758567.db2.gz DGLDYEXNWRPJHZ-ZDUSSCGKSA-N 1 2 233.311 2.051 20 0 BEADLO COC(=O)[C@@H]1CC[N@H+]1Cc1ccc(C)cc1C ZINC001203728833 966758576 /nfs/dbraw/zinc/75/85/76/966758576.db2.gz DGLDYEXNWRPJHZ-ZDUSSCGKSA-N 1 2 233.311 2.051 20 0 BEADLO COc1cc(C)c(C[NH+]2CC(OC)C2)cc1C ZINC001203751862 966771741 /nfs/dbraw/zinc/77/17/41/966771741.db2.gz ICOGVXDAFJVWLZ-UHFFFAOYSA-N 1 2 235.327 2.143 20 0 BEADLO Cn1cc2c(n1)CC[N@@H+](Cc1cccc(F)c1)C2 ZINC001203787324 966778227 /nfs/dbraw/zinc/77/82/27/966778227.db2.gz ZJTYYGASPDZPIP-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1cc2c(n1)CC[N@H+](Cc1cccc(F)c1)C2 ZINC001203787324 966778234 /nfs/dbraw/zinc/77/82/34/966778234.db2.gz ZJTYYGASPDZPIP-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO COc1ccc(C[N@@H+]2CCC(=O)[C@@H](C)C2)cc1C ZINC001203895067 966813298 /nfs/dbraw/zinc/81/32/98/966813298.db2.gz OSENXWHEPXHGCN-LBPRGKRZSA-N 1 2 247.338 2.415 20 0 BEADLO COc1ccc(C[N@H+]2CCC(=O)[C@@H](C)C2)cc1C ZINC001203895067 966813300 /nfs/dbraw/zinc/81/33/00/966813300.db2.gz OSENXWHEPXHGCN-LBPRGKRZSA-N 1 2 247.338 2.415 20 0 BEADLO COc1cc2[nH+]ccn2cc1/C=C/C(C)(C)O ZINC001239158138 966831562 /nfs/dbraw/zinc/83/15/62/966831562.db2.gz RYHLFKZFCOGYOV-SNAWJCMRSA-N 1 2 232.283 2.127 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCC23COC3)cc1 ZINC001203967315 966833170 /nfs/dbraw/zinc/83/31/70/966833170.db2.gz HZRKLPIRFJLEAX-UHFFFAOYSA-N 1 2 233.311 2.060 20 0 BEADLO CCOc1ccc(C[N@H+]2CCC23COC3)cc1 ZINC001203967315 966833174 /nfs/dbraw/zinc/83/31/74/966833174.db2.gz HZRKLPIRFJLEAX-UHFFFAOYSA-N 1 2 233.311 2.060 20 0 BEADLO O=C1CC[N@@H+](Cc2cccs2)CC[C@H]1F ZINC001204014027 966851592 /nfs/dbraw/zinc/85/15/92/966851592.db2.gz DNBZBFPOBDBNGD-SNVBAGLBSA-N 1 2 227.304 2.251 20 0 BEADLO O=C1CC[N@H+](Cc2cccs2)CC[C@H]1F ZINC001204014027 966851597 /nfs/dbraw/zinc/85/15/97/966851597.db2.gz DNBZBFPOBDBNGD-SNVBAGLBSA-N 1 2 227.304 2.251 20 0 BEADLO c1cc(C[N@@H+]2CCc3ccncc3C2)co1 ZINC001204245896 966944369 /nfs/dbraw/zinc/94/43/69/966944369.db2.gz YEDWTWBRPIFDNG-UHFFFAOYSA-N 1 2 214.268 2.233 20 0 BEADLO c1cc(C[N@H+]2CCc3ccncc3C2)co1 ZINC001204245896 966944377 /nfs/dbraw/zinc/94/43/77/966944377.db2.gz YEDWTWBRPIFDNG-UHFFFAOYSA-N 1 2 214.268 2.233 20 0 BEADLO Clc1ccc(C[NH+]2CC3(COC3)C2)s1 ZINC001204437600 966997194 /nfs/dbraw/zinc/99/71/94/966997194.db2.gz DBUFMKUQMVAORZ-UHFFFAOYSA-N 1 2 229.732 2.234 20 0 BEADLO CCc1ccc(C[N@H+](C)Cc2ccncn2)o1 ZINC001204394945 966993238 /nfs/dbraw/zinc/99/32/38/966993238.db2.gz WJXJZTHDISQSNM-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1ccc(C[N@@H+](C)Cc2ccncn2)o1 ZINC001204394945 966993243 /nfs/dbraw/zinc/99/32/43/966993243.db2.gz WJXJZTHDISQSNM-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CO[C@H]1C[N@H+](Cc2cccc(F)c2C)C[C@@H]1F ZINC001204507429 967010837 /nfs/dbraw/zinc/01/08/37/967010837.db2.gz YMRXWTBJVWCFOT-STQMWFEESA-N 1 2 241.281 2.303 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1cccc(F)c1C ZINC001204509436 967011863 /nfs/dbraw/zinc/01/18/63/967011863.db2.gz CXCMEFFYJBLRRT-JTQLQIEISA-N 1 2 239.290 2.127 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1cccc(F)c1C ZINC001204509436 967011871 /nfs/dbraw/zinc/01/18/71/967011871.db2.gz CXCMEFFYJBLRRT-JTQLQIEISA-N 1 2 239.290 2.127 20 0 BEADLO Cc1c(F)cccc1C[N@@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001204513463 967018032 /nfs/dbraw/zinc/01/80/32/967018032.db2.gz GQIJMMPNSXPQLU-CHWSQXEVSA-N 1 2 235.302 2.497 20 0 BEADLO Cc1c(F)cccc1C[N@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001204513463 967018039 /nfs/dbraw/zinc/01/80/39/967018039.db2.gz GQIJMMPNSXPQLU-CHWSQXEVSA-N 1 2 235.302 2.497 20 0 BEADLO CO[C@H]1C[N@H+](Cc2cc(C)c(C)o2)C[C@@H]1F ZINC001204536214 967036844 /nfs/dbraw/zinc/03/68/44/967036844.db2.gz DKFSVMPSPPWQKL-RYUDHWBXSA-N 1 2 227.279 2.065 20 0 BEADLO CO[C@H]1C[N@@H+](Cc2cc(C)c(C)o2)C[C@@H]1F ZINC001204536214 967036852 /nfs/dbraw/zinc/03/68/52/967036852.db2.gz DKFSVMPSPPWQKL-RYUDHWBXSA-N 1 2 227.279 2.065 20 0 BEADLO CCOc1cc[nH+]cc1Nc1cnc(N)c(F)c1 ZINC001249756462 967042415 /nfs/dbraw/zinc/04/24/15/967042415.db2.gz XRVZWDONZUBBQM-UHFFFAOYSA-N 1 2 248.261 2.340 20 0 BEADLO CCN(Cc1cc(C)c(C)o1)C1C[NH+](C)C1 ZINC001204538656 967043421 /nfs/dbraw/zinc/04/34/21/967043421.db2.gz GSSKNAVBTDWESN-UHFFFAOYSA-N 1 2 222.332 2.032 20 0 BEADLO COc1cc(C[N@@H+]2CC[C@@H](F)C2)ccc1F ZINC001204557221 967049918 /nfs/dbraw/zinc/04/99/18/967049918.db2.gz PWLSGNONGYLXSP-SNVBAGLBSA-N 1 2 227.254 2.378 20 0 BEADLO C[C@H](C(=O)N[C@H]1C[C@H](C)C[C@H](C)C1)n1cc[nH+]c1 ZINC001116115614 967073211 /nfs/dbraw/zinc/07/32/11/967073211.db2.gz OHCGCSFWRJJZRG-XQHKEYJVSA-N 1 2 249.358 2.385 20 0 BEADLO COc1ccccc1C[N@H+](C)Cc1[nH]cnc1C ZINC001204589531 967081876 /nfs/dbraw/zinc/08/18/76/967081876.db2.gz VSNHODYQIRNVCU-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1ccccc1C[N@@H+](C)Cc1[nH]cnc1C ZINC001204589531 967081888 /nfs/dbraw/zinc/08/18/88/967081888.db2.gz VSNHODYQIRNVCU-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO C[C@H]1CC[N@@H+]1Cc1nc2ccccc2[nH]1 ZINC001204751657 967147968 /nfs/dbraw/zinc/14/79/68/967147968.db2.gz MFYWFRNWJJAVII-VIFPVBQESA-N 1 2 201.273 2.157 20 0 BEADLO C[C@H]1CC[N@H+]1Cc1nc2ccccc2[nH]1 ZINC001204751657 967147979 /nfs/dbraw/zinc/14/79/79/967147979.db2.gz MFYWFRNWJJAVII-VIFPVBQESA-N 1 2 201.273 2.157 20 0 BEADLO COc1cc(C[N@@H+]2CC[C@H]2C)cnc1Cl ZINC001249917351 967156917 /nfs/dbraw/zinc/15/69/17/967156917.db2.gz MXJYVFCIDMJCAW-MRVPVSSYSA-N 1 2 226.707 2.338 20 0 BEADLO COc1cc(C[N@H+]2CC[C@H]2C)cnc1Cl ZINC001249917351 967156920 /nfs/dbraw/zinc/15/69/20/967156920.db2.gz MXJYVFCIDMJCAW-MRVPVSSYSA-N 1 2 226.707 2.338 20 0 BEADLO COc1cc(C[N@H+](C)CCF)cnc1Cl ZINC001249936326 967175044 /nfs/dbraw/zinc/17/50/44/967175044.db2.gz ZGBYKFWOQTWNMP-UHFFFAOYSA-N 1 2 232.686 2.145 20 0 BEADLO COc1cc(C[N@@H+](C)CCF)cnc1Cl ZINC001249936326 967175051 /nfs/dbraw/zinc/17/50/51/967175051.db2.gz ZGBYKFWOQTWNMP-UHFFFAOYSA-N 1 2 232.686 2.145 20 0 BEADLO COc1cc(CO)ccc1/C(C)=C/C=C/[NH3+] ZINC001204795489 967177097 /nfs/dbraw/zinc/17/70/97/967177097.db2.gz LMBSJHXGNQSMBR-DROBUMMNSA-N 1 2 219.284 2.063 20 0 BEADLO CN(c1ccn2cc[nH+]c2c1)c1ncccc1N ZINC001204950937 967252011 /nfs/dbraw/zinc/25/20/11/967252011.db2.gz IKQOHVMDAIZMHJ-UHFFFAOYSA-N 1 2 239.282 2.079 20 0 BEADLO Cc1c(C)c(-c2ccc[nH+]c2N)ccc1CO ZINC001204962663 967259846 /nfs/dbraw/zinc/25/98/46/967259846.db2.gz OSRGKVVVHFONFM-UHFFFAOYSA-N 1 2 228.295 2.440 20 0 BEADLO COCCOCc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001250002942 967265349 /nfs/dbraw/zinc/26/53/49/967265349.db2.gz KFRHKJXXBHONEK-UHFFFAOYSA-N 1 2 232.283 2.240 20 0 BEADLO FCCn1cnc(Nc2ccn3cc[nH+]c3c2)c1 ZINC001204972097 967270037 /nfs/dbraw/zinc/27/00/37/967270037.db2.gz XBQXLXRLHAHUIU-UHFFFAOYSA-N 1 2 245.261 2.244 20 0 BEADLO Nc1cccc2cn(-c3ccn4cc[nH+]c4c3)nc21 ZINC001204977128 967271508 /nfs/dbraw/zinc/27/15/08/967271508.db2.gz BYADZBJHRPWTKV-UHFFFAOYSA-N 1 2 249.277 2.255 20 0 BEADLO Cc1cn2c(cccc2-c2cnn(C)c2)[nH+]1 ZINC001240296246 967497127 /nfs/dbraw/zinc/49/71/27/967497127.db2.gz WJMPUOQHNVWERD-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO COc1cc[nH+]cc1CC(=O)Oc1ccccc1 ZINC001250255220 967558928 /nfs/dbraw/zinc/55/89/28/967558928.db2.gz ALVFBQFGLQRYFQ-UHFFFAOYSA-N 1 2 243.262 2.238 20 0 BEADLO COc1cc(CCn2cc[nH+]c2)cc(OC)c1 ZINC001250316121 967676517 /nfs/dbraw/zinc/67/65/17/967676517.db2.gz BLPYFGYACLLSHS-UHFFFAOYSA-N 1 2 232.283 2.143 20 0 BEADLO CN(C)c1ccc(CCn2cc[nH+]c2)cc1 ZINC001250316340 967681085 /nfs/dbraw/zinc/68/10/85/967681085.db2.gz JVATYZOKJYQVPF-UHFFFAOYSA-N 1 2 215.300 2.192 20 0 BEADLO Cn1ncc2c1cccc2CCn1cc[nH+]c1 ZINC001250316739 967690648 /nfs/dbraw/zinc/69/06/48/967690648.db2.gz VKQLJIDJELRVRF-UHFFFAOYSA-N 1 2 226.283 2.013 20 0 BEADLO COc1cc(CCn2cc[nH+]c2)ccc1C ZINC001250316649 967690755 /nfs/dbraw/zinc/69/07/55/967690755.db2.gz QREFZBBTORGJIX-UHFFFAOYSA-N 1 2 216.284 2.443 20 0 BEADLO COc1cc(F)c(CCn2cc[nH+]c2)cc1F ZINC001250316776 967691052 /nfs/dbraw/zinc/69/10/52/967691052.db2.gz XNGAGGDCGIPVQH-UHFFFAOYSA-N 1 2 238.237 2.413 20 0 BEADLO CO[C@@H]1CC=C(CCn2cc[nH+]c2)CC1 ZINC001250320225 967696194 /nfs/dbraw/zinc/69/61/94/967696194.db2.gz ZUHHDOZNZRACFB-GFCCVEGCSA-N 1 2 206.289 2.399 20 0 BEADLO COc1ncc(CCn2cc[nH+]c2)cc1Cl ZINC001250320074 967697074 /nfs/dbraw/zinc/69/70/74/967697074.db2.gz XOXDJQJMXFYUHD-UHFFFAOYSA-N 1 2 237.690 2.183 20 0 BEADLO CC(=O)c1cccc(CCn2cc[nH+]c2)c1F ZINC001250320320 967697755 /nfs/dbraw/zinc/69/77/55/967697755.db2.gz KQXFXJVKJCNWCQ-UHFFFAOYSA-N 1 2 232.258 2.468 20 0 BEADLO COCOc1ccc(CCn2cc[nH+]c2)cc1 ZINC001250320059 967697989 /nfs/dbraw/zinc/69/79/89/967697989.db2.gz XDKWNYTWAHASST-UHFFFAOYSA-N 1 2 232.283 2.109 20 0 BEADLO COC(=O)c1cccc(CCn2cc[nH+]c2)c1F ZINC001250320870 967699866 /nfs/dbraw/zinc/69/98/66/967699866.db2.gz RNEFVWKVUZVOHF-UHFFFAOYSA-N 1 2 248.257 2.052 20 0 BEADLO Cc1cc(F)cc(C[N@@H+]2CCOC3(CC3)C2)c1 ZINC001143618663 967700361 /nfs/dbraw/zinc/70/03/61/967700361.db2.gz CFAGRIOWDJCYOT-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1cc(F)cc(C[N@H+]2CCOC3(CC3)C2)c1 ZINC001143618663 967700366 /nfs/dbraw/zinc/70/03/66/967700366.db2.gz CFAGRIOWDJCYOT-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO CNc1ccc(CCC(=O)OC(C)(C)C)c[nH+]1 ZINC001250329050 967716733 /nfs/dbraw/zinc/71/67/33/967716733.db2.gz DPOVGFXCNMIQMS-UHFFFAOYSA-N 1 2 236.315 2.398 20 0 BEADLO CCCCNc1cc[nH+]c(OCCOC)c1 ZINC001162205378 967739501 /nfs/dbraw/zinc/73/95/01/967739501.db2.gz IOTCFJMSHXZZQK-UHFFFAOYSA-N 1 2 224.304 2.319 20 0 BEADLO Fc1c[nH]c2nc[nH+]c(NC3CC(F)C3)c12 ZINC001162207636 967740201 /nfs/dbraw/zinc/74/02/01/967740201.db2.gz KVANXHAAMVTXRG-UHFFFAOYSA-N 1 2 224.214 2.009 20 0 BEADLO c1cc(C[N@@H+]2CCc3c[nH]nc3C2)n(C2CC2)c1 ZINC001117783287 967776274 /nfs/dbraw/zinc/77/62/74/967776274.db2.gz FTPWZGGJCUOECF-UHFFFAOYSA-N 1 2 242.326 2.104 20 0 BEADLO c1cc(C[N@H+]2CCc3c[nH]nc3C2)n(C2CC2)c1 ZINC001117783287 967776280 /nfs/dbraw/zinc/77/62/80/967776280.db2.gz FTPWZGGJCUOECF-UHFFFAOYSA-N 1 2 242.326 2.104 20 0 BEADLO c1c[nH+]c(N2CCCC2)c(Cc2cnccn2)c1 ZINC001250372780 967784742 /nfs/dbraw/zinc/78/47/42/967784742.db2.gz CBNXTYTWSDKHOY-UHFFFAOYSA-N 1 2 240.310 2.063 20 0 BEADLO Cc1cccnc1C[N@@H+]1CCn2cccc2C1 ZINC001205792844 967824146 /nfs/dbraw/zinc/82/41/46/967824146.db2.gz BWIVKRUKOBRJJJ-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO Cc1cccnc1C[N@H+]1CCn2cccc2C1 ZINC001205792844 967824148 /nfs/dbraw/zinc/82/41/48/967824148.db2.gz BWIVKRUKOBRJJJ-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO Cc1cccnc1C[N@H+](C)Cc1ccno1 ZINC001205813794 967832673 /nfs/dbraw/zinc/83/26/73/967832673.db2.gz JCRQUTXEHKQFJO-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1cccnc1C[N@@H+](C)Cc1ccno1 ZINC001205813794 967832674 /nfs/dbraw/zinc/83/26/74/967832674.db2.gz JCRQUTXEHKQFJO-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO FCC(CF)[NH2+]Cc1cccn1C(F)F ZINC001205952855 967900748 /nfs/dbraw/zinc/90/07/48/967900748.db2.gz XDGZELOADTVSOP-UHFFFAOYSA-N 1 2 224.201 2.280 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@@H](C)C[C@H]2CF)co1 ZINC001206040419 968004053 /nfs/dbraw/zinc/00/40/53/968004053.db2.gz DNAAOJJTAJCTAR-KWQFWETISA-N 1 2 212.268 2.163 20 0 BEADLO Cc1nc(C[N@H+]2C[C@@H](C)C[C@H]2CF)co1 ZINC001206040419 968004063 /nfs/dbraw/zinc/00/40/63/968004063.db2.gz DNAAOJJTAJCTAR-KWQFWETISA-N 1 2 212.268 2.163 20 0 BEADLO C[NH+](C)Cc1nc2ccc(N3CCCC3)cc2[nH]1 ZINC001250565842 968077721 /nfs/dbraw/zinc/07/77/21/968077721.db2.gz WAVBRFXXFQQRBU-UHFFFAOYSA-N 1 2 244.342 2.225 20 0 BEADLO O=C1Cc2cc(-c3cccc4[nH+]ccn43)ccc2N1 ZINC001206208779 968141064 /nfs/dbraw/zinc/14/10/64/968141064.db2.gz NYGAVLYOEOHEIU-UHFFFAOYSA-N 1 2 249.273 2.496 20 0 BEADLO COCCCc1[nH+]c2c(cccc2C)n1C ZINC001250601897 968142482 /nfs/dbraw/zinc/14/24/82/968142482.db2.gz ASNWUSFUHDQMED-UHFFFAOYSA-N 1 2 218.300 2.461 20 0 BEADLO COc1cc(C)c[nH+]c1N1CCCO[C@H](C)C1 ZINC001163961927 968147479 /nfs/dbraw/zinc/14/74/79/968147479.db2.gz CGBQBTPAPKGIMY-LLVKDONJSA-N 1 2 236.315 2.014 20 0 BEADLO CCc1cc(NCC(=O)C(C)(C)C)cc[nH+]1 ZINC001164005661 968150388 /nfs/dbraw/zinc/15/03/88/968150388.db2.gz ZKIPXOPDAASFEZ-UHFFFAOYSA-N 1 2 220.316 2.093 20 0 BEADLO CC1(Nc2cc(N3CCCC3)nc[nH+]2)CCC1 ZINC001164025681 968160111 /nfs/dbraw/zinc/16/01/11/968160111.db2.gz YOHUHXRWIWWHDA-UHFFFAOYSA-N 1 2 232.331 2.431 20 0 BEADLO CC1(Nc2cc(N3CCCC3)[nH+]cn2)CCC1 ZINC001164025681 968160121 /nfs/dbraw/zinc/16/01/21/968160121.db2.gz YOHUHXRWIWWHDA-UHFFFAOYSA-N 1 2 232.331 2.431 20 0 BEADLO CC1(Nc2ccc(N3CCOCC3)c[nH+]2)CCC1 ZINC001164025472 968160257 /nfs/dbraw/zinc/16/02/57/968160257.db2.gz SJMZOROCTACHDL-UHFFFAOYSA-N 1 2 247.342 2.273 20 0 BEADLO Cc1cc(C)c(NC[C@H](O)C(F)(F)F)c[nH+]1 ZINC001250961598 968218717 /nfs/dbraw/zinc/21/87/17/968218717.db2.gz MMNJSVSXSVRMPC-VIFPVBQESA-N 1 2 234.221 2.034 20 0 BEADLO CCc1[nH+]ccc(C)c1NC[C@@H](O)C(F)(F)F ZINC001250964255 968222248 /nfs/dbraw/zinc/22/22/48/968222248.db2.gz HRZLDKOBAAANAV-SECBINFHSA-N 1 2 248.248 2.288 20 0 BEADLO C[C@@H](c1nnc(Cc2ccc(F)cc2)o1)[NH+](C)C ZINC001251901103 968386282 /nfs/dbraw/zinc/38/62/82/968386282.db2.gz CKNBHAGTIOQNMC-VIFPVBQESA-N 1 2 249.289 2.422 20 0 BEADLO C[NH+]1CC(Oc2ccc(N=O)c3cccnc23)C1 ZINC001229951249 968425550 /nfs/dbraw/zinc/42/55/50/968425550.db2.gz PIOCVIDZIPCPND-UHFFFAOYSA-N 1 2 243.266 2.326 20 0 BEADLO CCCC[C@H](O)CNc1c[nH+]ccc1OCC ZINC001252080314 968498149 /nfs/dbraw/zinc/49/81/49/968498149.db2.gz VVBQESWOHHLETC-NSHDSACASA-N 1 2 238.331 2.443 20 0 BEADLO Cc1ccnc(C[N@@H+](C)Cc2cncs2)c1 ZINC001206853951 968500701 /nfs/dbraw/zinc/50/07/01/968500701.db2.gz JWGYDBORHRUJTN-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ccnc(C[N@H+](C)Cc2cncs2)c1 ZINC001206853951 968500697 /nfs/dbraw/zinc/50/06/97/968500697.db2.gz JWGYDBORHRUJTN-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Fc1cncc(F)c1C[N@H+]1C[C@@H]2C[C@H]1C[C@H]2F ZINC001206858759 968503097 /nfs/dbraw/zinc/50/30/97/968503097.db2.gz LCZVTBUQYJCNKX-OYNCUSHFSA-N 1 2 242.244 2.292 20 0 BEADLO Fc1cncc(F)c1C[N@@H+]1C[C@@H]2C[C@H]1C[C@H]2F ZINC001206858759 968503103 /nfs/dbraw/zinc/50/31/03/968503103.db2.gz LCZVTBUQYJCNKX-OYNCUSHFSA-N 1 2 242.244 2.292 20 0 BEADLO Fc1cncc(F)c1C[N@@H+]1CCCC12CC2 ZINC001206856423 968503537 /nfs/dbraw/zinc/50/35/37/968503537.db2.gz WAKJHFWPGCPSGC-UHFFFAOYSA-N 1 2 224.254 2.488 20 0 BEADLO Fc1cncc(F)c1C[N@H+]1CCCC12CC2 ZINC001206856423 968503541 /nfs/dbraw/zinc/50/35/41/968503541.db2.gz WAKJHFWPGCPSGC-UHFFFAOYSA-N 1 2 224.254 2.488 20 0 BEADLO Cc1ncsc1C[N@@H+]1CCc2ccncc2C1 ZINC001206986896 968529410 /nfs/dbraw/zinc/52/94/10/968529410.db2.gz IXIHORNXAGLWTE-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ncsc1C[N@H+]1CCc2ccncc2C1 ZINC001206986896 968529419 /nfs/dbraw/zinc/52/94/19/968529419.db2.gz IXIHORNXAGLWTE-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO c1[nH+]c(CN2C3CCC2CC3)n2ccccc12 ZINC001207052912 968586364 /nfs/dbraw/zinc/58/63/64/968586364.db2.gz GTGUMCXUACTZDC-UHFFFAOYSA-N 1 2 227.311 2.461 20 0 BEADLO Cc1ncc(C[N@@H+]2CCc3cccnc3C2)s1 ZINC001207062016 968590331 /nfs/dbraw/zinc/59/03/31/968590331.db2.gz VMHXINYVQZNSCM-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ncc(C[N@H+]2CCc3cccnc3C2)s1 ZINC001207062016 968590334 /nfs/dbraw/zinc/59/03/34/968590334.db2.gz VMHXINYVQZNSCM-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1[nH]c(CNC(=O)C23CCC(CC2)C3)[nH+]c1C ZINC000825106569 968634028 /nfs/dbraw/zinc/63/40/28/968634028.db2.gz WNWPYGHTDYMYDA-UHFFFAOYSA-N 1 2 247.342 2.223 20 0 BEADLO O=c1cc(C[N@H+]2Cc3ccc(F)cc3C2)cc[nH]1 ZINC001207124262 968642975 /nfs/dbraw/zinc/64/29/75/968642975.db2.gz VSYWGSXQYUUESF-UHFFFAOYSA-N 1 2 244.269 2.442 20 0 BEADLO O=c1cc(C[N@@H+]2Cc3ccc(F)cc3C2)cc[nH]1 ZINC001207124262 968642979 /nfs/dbraw/zinc/64/29/79/968642979.db2.gz VSYWGSXQYUUESF-UHFFFAOYSA-N 1 2 244.269 2.442 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1C[C@H](F)C[C@H]1C ZINC001207171226 968677977 /nfs/dbraw/zinc/67/79/77/968677977.db2.gz ZGGFWIFODRHENY-GHMZBOCLSA-N 1 2 225.311 2.396 20 0 BEADLO CC(C)n1nccc1C[N@H+]1C[C@H](F)C[C@H]1C ZINC001207171226 968677981 /nfs/dbraw/zinc/67/79/81/968677981.db2.gz ZGGFWIFODRHENY-GHMZBOCLSA-N 1 2 225.311 2.396 20 0 BEADLO CC(C)OC1C[NH+](CCOCc2ccccc2)C1 ZINC001207236764 968688240 /nfs/dbraw/zinc/68/82/40/968688240.db2.gz WHACIBFHRKZMPX-UHFFFAOYSA-N 1 2 249.354 2.312 20 0 BEADLO CCOC(=O)C[NH+]1CCC2(CC(F)(F)C2)CC1 ZINC001207409405 968754158 /nfs/dbraw/zinc/75/41/58/968754158.db2.gz XSZFCJXXXUEYMJ-UHFFFAOYSA-N 1 2 247.285 2.061 20 0 BEADLO O[C@@H](C[N@@H+]1CCC=C(Cl)C1)CC(F)(F)F ZINC000404406071 968883741 /nfs/dbraw/zinc/88/37/41/968883741.db2.gz WVHYGTKWAITEKM-MRVPVSSYSA-N 1 2 243.656 2.128 20 0 BEADLO O[C@@H](C[N@H+]1CCC=C(Cl)C1)CC(F)(F)F ZINC000404406071 968883747 /nfs/dbraw/zinc/88/37/47/968883747.db2.gz WVHYGTKWAITEKM-MRVPVSSYSA-N 1 2 243.656 2.128 20 0 BEADLO CCC[C@@H](O)CNc1cccc2[nH+]c(C)cn21 ZINC001252773466 968942149 /nfs/dbraw/zinc/94/21/49/968942149.db2.gz YGZLNCLICWRXEP-LLVKDONJSA-N 1 2 233.315 2.216 20 0 BEADLO Cc1cn2cc(-c3cc[nH+]c(N)c3)ccc2n1 ZINC001241163765 968943346 /nfs/dbraw/zinc/94/33/46/968943346.db2.gz ZRDVVYGGEIRJNW-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO CCc1cnc(CO[NH+]=C(N)c2ccccc2)o1 ZINC000742348322 968948389 /nfs/dbraw/zinc/94/83/89/968948389.db2.gz BCHHQQQORJBMLJ-UHFFFAOYSA-N 1 2 245.282 2.284 20 0 BEADLO Cn1ncc2cc(-c3cc[nH+]c(N)c3)ccc21 ZINC001241439280 969002828 /nfs/dbraw/zinc/00/28/28/969002828.db2.gz WMYMZRNZBBQUAP-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO O=C1CCCN1c1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001242016277 969168521 /nfs/dbraw/zinc/16/85/21/969168521.db2.gz YUVHLJIKYUIAAX-UHFFFAOYSA-N 1 2 227.267 2.204 20 0 BEADLO c1cnc2c(c1)C[N@@H+](C[C@H]1CCC=CO1)C2 ZINC001208873552 969259455 /nfs/dbraw/zinc/25/94/55/969259455.db2.gz GWEKAQWPCHEWJR-GFCCVEGCSA-N 1 2 216.284 2.090 20 0 BEADLO c1cnc2c(c1)C[N@H+](C[C@H]1CCC=CO1)C2 ZINC001208873552 969259461 /nfs/dbraw/zinc/25/94/61/969259461.db2.gz GWEKAQWPCHEWJR-GFCCVEGCSA-N 1 2 216.284 2.090 20 0 BEADLO Nc1[nH+]cccc1-c1ccc(F)cc1O ZINC001242217752 969320144 /nfs/dbraw/zinc/32/01/44/969320144.db2.gz KSVZQUZAICJGQI-UHFFFAOYSA-N 1 2 204.204 2.176 20 0 BEADLO Cc1cn2c(cccc2NC[C@@H](O)C(C)C)[nH+]1 ZINC001253748233 969364423 /nfs/dbraw/zinc/36/44/23/969364423.db2.gz DGHGEHHCMOGAMJ-LLVKDONJSA-N 1 2 233.315 2.072 20 0 BEADLO Cc1ccc2cc(NCC3OCCO3)[nH+]cc2c1 ZINC001169060790 969374889 /nfs/dbraw/zinc/37/48/89/969374889.db2.gz XVQOEQCUIJYCAK-UHFFFAOYSA-N 1 2 244.294 2.328 20 0 BEADLO CCCc1nnc([C@H]2CC3CC[NH+]2CC3)o1 ZINC001253929998 969422824 /nfs/dbraw/zinc/42/28/24/969422824.db2.gz RGXDWVWBTWLPBI-SNVBAGLBSA-N 1 2 221.304 2.179 20 0 BEADLO Cc1cccc2c(C[N@@H+]3CCO[C@@H]4C[C@@H]43)c[nH]c21 ZINC001209494176 969526512 /nfs/dbraw/zinc/52/65/12/969526512.db2.gz NSDOPEYHFPMMJE-UONOGXRCSA-N 1 2 242.322 2.449 20 0 BEADLO Cc1cccc2c(C[N@H+]3CCO[C@@H]4C[C@@H]43)c[nH]c21 ZINC001209494176 969526516 /nfs/dbraw/zinc/52/65/16/969526516.db2.gz NSDOPEYHFPMMJE-UONOGXRCSA-N 1 2 242.322 2.449 20 0 BEADLO F[C@H]1CSC2(C[NH+](Cc3cncs3)C2)C1 ZINC001209550013 969539947 /nfs/dbraw/zinc/53/99/47/969539947.db2.gz ZBLJTVPRCJGGML-MRVPVSSYSA-N 1 2 244.360 2.173 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@@H](F)CC1 ZINC001209555297 969542421 /nfs/dbraw/zinc/54/24/21/969542421.db2.gz ZGKLWNQAICHRLM-LLVKDONJSA-N 1 2 211.284 2.042 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@@H](F)CC1 ZINC001209555297 969542423 /nfs/dbraw/zinc/54/24/23/969542423.db2.gz ZGKLWNQAICHRLM-LLVKDONJSA-N 1 2 211.284 2.042 20 0 BEADLO Cc1ccnn1C1CC[NH+](Cc2ccon2)CC1 ZINC001209570172 969554449 /nfs/dbraw/zinc/55/44/49/969554449.db2.gz OMXUTVJIZRYOQT-UHFFFAOYSA-N 1 2 246.314 2.017 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nn(C)c3ccccc23)C[C@@H]1F ZINC001209578567 969560146 /nfs/dbraw/zinc/56/01/46/969560146.db2.gz IQKVXFTTYQDSPL-PWSUYJOCSA-N 1 2 247.317 2.363 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nn(C)c3ccccc23)C[C@@H]1F ZINC001209578567 969560153 /nfs/dbraw/zinc/56/01/53/969560153.db2.gz IQKVXFTTYQDSPL-PWSUYJOCSA-N 1 2 247.317 2.363 20 0 BEADLO COc1cc(C[N@@H+]2CCCC[C@H]2C(C)=O)ccn1 ZINC001209640567 969569850 /nfs/dbraw/zinc/56/98/50/969569850.db2.gz GRMKVESYAUGGJZ-ZDUSSCGKSA-N 1 2 248.326 2.034 20 0 BEADLO COc1cc(C[N@H+]2CCCC[C@H]2C(C)=O)ccn1 ZINC001209640567 969569855 /nfs/dbraw/zinc/56/98/55/969569855.db2.gz GRMKVESYAUGGJZ-ZDUSSCGKSA-N 1 2 248.326 2.034 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CC(C)(C)C2(C)C)[nH]1 ZINC001325221655 1169937503 /nfs/dbraw/zinc/93/75/03/1169937503.db2.gz FBOITGHRMSVSRB-MRVPVSSYSA-N 1 2 222.336 2.295 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CC(C)(C)C2(C)C)[nH]1 ZINC001325221655 1169937507 /nfs/dbraw/zinc/93/75/07/1169937507.db2.gz FBOITGHRMSVSRB-MRVPVSSYSA-N 1 2 222.336 2.295 20 0 BEADLO Cc1nc(Nc2ccc3[nH]c[nH+]c3c2)cc(=O)[nH]1 ZINC001209842608 969653921 /nfs/dbraw/zinc/65/39/21/969653921.db2.gz NDYHEGNZXARSDJ-UHFFFAOYSA-N 1 2 241.254 2.111 20 0 BEADLO c1cc(Nc2ccc3[nH]c[nH+]c3c2)on1 ZINC001209842095 969656190 /nfs/dbraw/zinc/65/61/90/969656190.db2.gz BVROASVFXORFTK-UHFFFAOYSA-N 1 2 200.201 2.295 20 0 BEADLO Cc1cc(O)c[nH+]c1Nc1ccc(F)c(CO)c1 ZINC001209872327 969671438 /nfs/dbraw/zinc/67/14/38/969671438.db2.gz AOJTYSJPFITFON-UHFFFAOYSA-N 1 2 248.257 2.471 20 0 BEADLO Cc1cc(C)c(Nc2ccnnc2)c[nH+]1 ZINC001209957645 969716044 /nfs/dbraw/zinc/71/60/44/969716044.db2.gz PAHCYVMLDMPUEH-UHFFFAOYSA-N 1 2 200.245 2.232 20 0 BEADLO COc1cc[nH+]cc1N[C@@H](C)c1cnccn1 ZINC001169530069 969717239 /nfs/dbraw/zinc/71/72/39/969717239.db2.gz XFMAQSOMJKEOLY-VIFPVBQESA-N 1 2 230.271 2.053 20 0 BEADLO Cc1cc(N(C)c2[nH+]cccc2N)ccc1O ZINC001209972183 969739541 /nfs/dbraw/zinc/73/95/41/969739541.db2.gz HFNZSCACJHBZDI-UHFFFAOYSA-N 1 2 229.283 2.446 20 0 BEADLO Cc1cc(C)c(NC[C@H]2COCC[N@H+]2C)c(C)c1 ZINC001169653727 969800748 /nfs/dbraw/zinc/80/07/48/969800748.db2.gz KEQKKRMXBYNPQM-AWEZNQCLSA-N 1 2 248.370 2.354 20 0 BEADLO Cc1cc(C)c(NC[C@H]2COCC[N@@H+]2C)c(C)c1 ZINC001169653727 969800753 /nfs/dbraw/zinc/80/07/53/969800753.db2.gz KEQKKRMXBYNPQM-AWEZNQCLSA-N 1 2 248.370 2.354 20 0 BEADLO O=C1C[C@@H]2CC([N@@H+]3CCCC(F)(F)C3)C[C@H]2C1 ZINC001254946431 969831439 /nfs/dbraw/zinc/83/14/39/969831439.db2.gz NVAJFSGMLMFKLW-UWVGGRQHSA-N 1 2 243.297 2.475 20 0 BEADLO O=C1C[C@@H]2CC([N@H+]3CCCC(F)(F)C3)C[C@H]2C1 ZINC001254946431 969831440 /nfs/dbraw/zinc/83/14/40/969831440.db2.gz NVAJFSGMLMFKLW-UWVGGRQHSA-N 1 2 243.297 2.475 20 0 BEADLO C[C@@H]1CC[C@H](C)[C@@H](OCC[NH+]2CCOCC2)C1 ZINC001210209035 969832752 /nfs/dbraw/zinc/83/27/52/969832752.db2.gz YAVJOHIJCGYRDB-RDBSUJKOSA-N 1 2 241.375 2.160 20 0 BEADLO Cn1nncc1Nc1cccc2cc[nH+]cc21 ZINC001210225573 969838512 /nfs/dbraw/zinc/83/85/12/969838512.db2.gz JTALHTKAPKFGMM-UHFFFAOYSA-N 1 2 225.255 2.107 20 0 BEADLO Cc1ncc(Nc2cccn3cc[nH+]c23)cc1N ZINC001210287569 969854327 /nfs/dbraw/zinc/85/43/27/969854327.db2.gz XHWWWFZFSQBBDM-UHFFFAOYSA-N 1 2 239.282 2.364 20 0 BEADLO Cc1ncc(Nc2c[nH+]c(C)c(N)c2)s1 ZINC001210286973 969854822 /nfs/dbraw/zinc/85/48/22/969854822.db2.gz HOALDQNPYKENAM-UHFFFAOYSA-N 1 2 220.301 2.481 20 0 BEADLO Cc1cc(Nc2c[nH+]c(C)c(N)c2)sn1 ZINC001210287209 969854868 /nfs/dbraw/zinc/85/48/68/969854868.db2.gz OATPVMISZGJASP-UHFFFAOYSA-N 1 2 220.301 2.481 20 0 BEADLO CCOc1cc(Nc2c[nH+]c(C)c(N)c2)no1 ZINC001210289178 969855797 /nfs/dbraw/zinc/85/57/97/969855797.db2.gz XPMKCEPARRVNRN-UHFFFAOYSA-N 1 2 234.259 2.103 20 0 BEADLO Cc1[nH+]cc(Nc2ccc(O)cc2)cc1N ZINC001210288350 969856054 /nfs/dbraw/zinc/85/60/54/969856054.db2.gz NMGKFRGJVRWBAV-UHFFFAOYSA-N 1 2 215.256 2.421 20 0 BEADLO Cc1[nH+]cc(Nc2cc([C@@H](C)O)ccn2)cc1N ZINC001210288010 969857284 /nfs/dbraw/zinc/85/72/84/969857284.db2.gz GYZLMRKIKALOQN-SECBINFHSA-N 1 2 244.298 2.164 20 0 BEADLO Cc1[nH+]cc(Nc2cn(C(C)C)cn2)cc1N ZINC001210289038 969857962 /nfs/dbraw/zinc/85/79/62/969857962.db2.gz RKNOFTWQGANQJM-UHFFFAOYSA-N 1 2 231.303 2.493 20 0 BEADLO CC1(C)CC([NH2+][C@@H]2CC2(F)F)CC(C)(C)N1O ZINC001169968312 969888518 /nfs/dbraw/zinc/88/85/18/969888518.db2.gz XUAYXWLSSMLLDV-SECBINFHSA-N 1 2 248.317 2.394 20 0 BEADLO CC/C=C\CNC(=O)c1cccc2[nH+]ccn21 ZINC001129353963 969892830 /nfs/dbraw/zinc/89/28/30/969892830.db2.gz FQSAZDJLSWZYJR-ARJAWSKDSA-N 1 2 229.283 2.030 20 0 BEADLO Cn1ccc(-c2ccc(-n3cc[nH+]c3)cc2)n1 ZINC001242458721 969952350 /nfs/dbraw/zinc/95/23/50/969952350.db2.gz AIDARILZRUPWCQ-UHFFFAOYSA-N 1 2 224.267 2.273 20 0 BEADLO C1CC(c2nnc([C@@H]3CC4CC[NH+]3CC4)o2)C1 ZINC001255150886 969955836 /nfs/dbraw/zinc/95/58/36/969955836.db2.gz UMVKMOYOMFTBQY-NSHDSACASA-N 1 2 233.315 2.494 20 0 BEADLO Cc1ccc(CO)cc1N(C)c1[nH+]cccc1N ZINC001210677673 969996746 /nfs/dbraw/zinc/99/67/46/969996746.db2.gz KYTBUNGNNZSVML-UHFFFAOYSA-N 1 2 243.310 2.232 20 0 BEADLO C1=[NH+]c2nccc(=C3NN=C(C4CCC4)O3)c2=C1 ZINC001255209508 970006144 /nfs/dbraw/zinc/00/61/44/970006144.db2.gz JZYZGHHRZGNWGH-SNVBAGLBSA-N 1 2 240.266 2.357 20 0 BEADLO COc1cc(Nc2[nH+]cc(C)cc2N)cc(C)n1 ZINC001210773642 970025699 /nfs/dbraw/zinc/02/56/99/970025699.db2.gz CHZHNSPPRAMYFT-UHFFFAOYSA-N 1 2 244.298 2.428 20 0 BEADLO O=C(CCNc1cc[nH+]cc1F)c1ccccc1 ZINC001170020569 970026442 /nfs/dbraw/zinc/02/64/42/970026442.db2.gz QRUXUBUIARDUEI-UHFFFAOYSA-N 1 2 244.269 2.328 20 0 BEADLO COc1cc(Nc2c(C)cnn2C)cc(C)[nH+]1 ZINC001210775232 970027635 /nfs/dbraw/zinc/02/76/35/970027635.db2.gz ULCCTHRDGDYIGQ-UHFFFAOYSA-N 1 2 232.287 2.184 20 0 BEADLO FC(F)(C[NH2+][C@@H]1CCSC1)c1ccccn1 ZINC001255276940 970028083 /nfs/dbraw/zinc/02/80/83/970028083.db2.gz NCSNOZZRBOHEGB-SECBINFHSA-N 1 2 244.310 2.269 20 0 BEADLO C[C@@H]1CC[C@H]([N@@H+]2CCOCC(F)(F)C2)C1 ZINC000339205770 970028138 /nfs/dbraw/zinc/02/81/38/970028138.db2.gz OYLPVKMVHLYWBH-ZJUUUORDSA-N 1 2 219.275 2.143 20 0 BEADLO C[C@@H]1CC[C@H]([N@H+]2CCOCC(F)(F)C2)C1 ZINC000339205770 970028145 /nfs/dbraw/zinc/02/81/45/970028145.db2.gz OYLPVKMVHLYWBH-ZJUUUORDSA-N 1 2 219.275 2.143 20 0 BEADLO C/C=C(\C)c1ccc([C@H]([NH3+])C(=O)OC)cc1 ZINC001242759762 970054345 /nfs/dbraw/zinc/05/43/45/970054345.db2.gz FHJGPYYTTDIZEZ-KFRNIWOLSA-N 1 2 219.284 2.283 20 0 BEADLO CCCC[C@@H](C)[NH2+]C1(C(=O)OCC)CC1 ZINC001255312279 970082502 /nfs/dbraw/zinc/08/25/02/970082502.db2.gz OCZMECLCWIOSNO-SNVBAGLBSA-N 1 2 213.321 2.250 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(C2(C)COC2)cc1 ZINC001243066821 970254638 /nfs/dbraw/zinc/25/46/38/970254638.db2.gz AXBWKAROACOABF-UHFFFAOYSA-N 1 2 228.295 2.375 20 0 BEADLO C[C@@H]1C(=O)Nc2ccc(-c3c[nH+]cn3C)cc21 ZINC001243069735 970260939 /nfs/dbraw/zinc/26/09/39/970260939.db2.gz YBBKCLKIJYYAOC-QMMMGPOBSA-N 1 2 227.267 2.143 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2c(c1)COC2 ZINC001243068991 970261277 /nfs/dbraw/zinc/26/12/77/970261277.db2.gz LYRHSZGPQMIVQK-UHFFFAOYSA-N 1 2 200.241 2.117 20 0 BEADLO C[C@H]1C(=O)Nc2ccc(-c3c[nH+]cn3C)cc21 ZINC001243069734 970264399 /nfs/dbraw/zinc/26/43/99/970264399.db2.gz YBBKCLKIJYYAOC-MRVPVSSYSA-N 1 2 227.267 2.143 20 0 BEADLO C[C@H](CC(F)(F)F)[NH2+]Cc1ncc(F)cn1 ZINC001255632775 970405855 /nfs/dbraw/zinc/40/58/55/970405855.db2.gz DTEMLCJAOBBXOO-ZCFIWIBFSA-N 1 2 237.200 2.046 20 0 BEADLO CCOc1ccc[nH+]c1N[C@@H]1CCOC[C@@H]1C ZINC000302444327 970438308 /nfs/dbraw/zinc/43/83/08/970438308.db2.gz UKHWSGAGEYDECT-WDEREUQCSA-N 1 2 236.315 2.317 20 0 BEADLO CCCOC1C[NH+]([C@@H](C)CC(F)(F)F)C1 ZINC001255658659 970438740 /nfs/dbraw/zinc/43/87/40/970438740.db2.gz UDBBOLHOAVZHNS-QMMMGPOBSA-N 1 2 225.254 2.438 20 0 BEADLO CCOc1ccc[nH+]c1N[C@H]1CCOC[C@H]1C ZINC000302444325 970440257 /nfs/dbraw/zinc/44/02/57/970440257.db2.gz UKHWSGAGEYDECT-MNOVXSKESA-N 1 2 236.315 2.317 20 0 BEADLO CC[C@@H]([NH2+][C@@H](C)Cc1ccc(C)cc1)C(=O)OC ZINC001255773881 970479440 /nfs/dbraw/zinc/47/94/40/970479440.db2.gz RJHHNEONJFACSG-GXTWGEPZSA-N 1 2 249.354 2.467 20 0 BEADLO CC[N@H+](Cc1ccc(C)s1)[C@@H](C)C(=O)OC ZINC001204034601 970490009 /nfs/dbraw/zinc/49/00/09/970490009.db2.gz NVLHHTRZKQYNJR-JTQLQIEISA-N 1 2 241.356 2.440 20 0 BEADLO CC[N@@H+](Cc1ccc(C)s1)[C@@H](C)C(=O)OC ZINC001204034601 970490016 /nfs/dbraw/zinc/49/00/16/970490016.db2.gz NVLHHTRZKQYNJR-JTQLQIEISA-N 1 2 241.356 2.440 20 0 BEADLO C[C@H](Cc1ccccc1F)[N@@H+]1CCC12COC2 ZINC001255851438 970514985 /nfs/dbraw/zinc/51/49/85/970514985.db2.gz OKKSPKJZFSKAIK-LLVKDONJSA-N 1 2 235.302 2.231 20 0 BEADLO C[C@H](Cc1ccccc1F)[N@H+]1CCC12COC2 ZINC001255851438 970514994 /nfs/dbraw/zinc/51/49/94/970514994.db2.gz OKKSPKJZFSKAIK-LLVKDONJSA-N 1 2 235.302 2.231 20 0 BEADLO Clc1cnccc1-c1cc[nH+]c2c1CCN2 ZINC001243387794 970529673 /nfs/dbraw/zinc/52/96/73/970529673.db2.gz GBHZGSRPTXEPOC-UHFFFAOYSA-N 1 2 231.686 2.408 20 0 BEADLO CCCCCc1nnc(Cn2cc[nH+]c2)o1 ZINC001256068239 970634147 /nfs/dbraw/zinc/63/41/47/970634147.db2.gz NJXNSKDEQPMMIY-UHFFFAOYSA-N 1 2 220.276 2.047 20 0 BEADLO CN(C)c1ccc(Nc2ncc(F)cc2N)c[nH+]1 ZINC000401210510 970670216 /nfs/dbraw/zinc/67/02/16/970670216.db2.gz MXBHNXOJHJQWNR-UHFFFAOYSA-N 1 2 247.277 2.008 20 0 BEADLO C[C@H](COC(C)(C)C)OCc1c[nH+]cn1C ZINC001222588019 972587962 /nfs/dbraw/zinc/58/79/62/972587962.db2.gz VOMGUYBCUWSJAS-SNVBAGLBSA-N 1 2 226.320 2.140 20 0 BEADLO CCCCOC[C@H](C)OCc1c[nH+]cn1C ZINC001222594620 972591625 /nfs/dbraw/zinc/59/16/25/972591625.db2.gz HUFVKLBZVWFKPM-NSHDSACASA-N 1 2 226.320 2.142 20 0 BEADLO Cn1c[nH+]cc1CO[C@@H](c1cccnc1)C1CC1 ZINC001222600135 972597646 /nfs/dbraw/zinc/59/76/46/972597646.db2.gz KWAIOXBFIWFTJR-CQSZACIVSA-N 1 2 243.310 2.483 20 0 BEADLO C[C@@H](C1CCCCC1)[N@H+](C)Cc1nnc[nH]1 ZINC001327526145 972615727 /nfs/dbraw/zinc/61/57/27/972615727.db2.gz SPQDEZPORSKUKD-JTQLQIEISA-N 1 2 222.336 2.205 20 0 BEADLO C[C@@H](C1CCCCC1)[N@@H+](C)Cc1nnc[nH]1 ZINC001327526145 972615733 /nfs/dbraw/zinc/61/57/33/972615733.db2.gz SPQDEZPORSKUKD-JTQLQIEISA-N 1 2 222.336 2.205 20 0 BEADLO C[C@@]1(F)CCC[N@H+](Cc2ccc(O)cn2)C1 ZINC001144253079 972716207 /nfs/dbraw/zinc/71/62/07/972716207.db2.gz GTVMHZKXEGIKER-GFCCVEGCSA-N 1 2 224.279 2.111 20 0 BEADLO C[C@@]1(F)CCC[N@@H+](Cc2ccc(O)cn2)C1 ZINC001144253079 972716214 /nfs/dbraw/zinc/71/62/14/972716214.db2.gz GTVMHZKXEGIKER-GFCCVEGCSA-N 1 2 224.279 2.111 20 0 BEADLO CC[NH+]1CC(OCc2nc3ccc(C)cc3o2)C1 ZINC001222899494 972736029 /nfs/dbraw/zinc/73/60/29/972736029.db2.gz MMJPKAVLYWTNSR-UHFFFAOYSA-N 1 2 246.310 2.357 20 0 BEADLO CCc1cccc(C[NH+]2CC3(CCO3)C2)c1 ZINC001144324198 972759118 /nfs/dbraw/zinc/75/91/18/972759118.db2.gz ZREWWPXGPVOGSY-UHFFFAOYSA-N 1 2 217.312 2.224 20 0 BEADLO C[C@H]1CCC[C@@H]1Cc1nnc(C[NH+](C)C)o1 ZINC001327865214 972770345 /nfs/dbraw/zinc/77/03/45/972770345.db2.gz MHBJXHZGCPKSFU-VHSXEESVSA-N 1 2 223.320 2.110 20 0 BEADLO COc1ccc(C[N@@H+]2CCCC[C@@H]2C(C)=O)nc1 ZINC001144430352 972815060 /nfs/dbraw/zinc/81/50/60/972815060.db2.gz FCLRWHLMUFGSRA-CQSZACIVSA-N 1 2 248.326 2.034 20 0 BEADLO COc1ccc(C[N@H+]2CCCC[C@@H]2C(C)=O)nc1 ZINC001144430352 972815069 /nfs/dbraw/zinc/81/50/69/972815069.db2.gz FCLRWHLMUFGSRA-CQSZACIVSA-N 1 2 248.326 2.034 20 0 BEADLO CC[N@H+](CCOC)Cc1c(F)cc(O)cc1F ZINC001144541408 972862496 /nfs/dbraw/zinc/86/24/96/972862496.db2.gz FFHAJRBCKHZEPC-UHFFFAOYSA-N 1 2 245.269 2.139 20 0 BEADLO CC[N@@H+](CCOC)Cc1c(F)cc(O)cc1F ZINC001144541408 972862500 /nfs/dbraw/zinc/86/25/00/972862500.db2.gz FFHAJRBCKHZEPC-UHFFFAOYSA-N 1 2 245.269 2.139 20 0 BEADLO CCOC[C@@H]1CCCC[N@@H+]1Cc1cc(C)[nH]n1 ZINC001328218764 972909043 /nfs/dbraw/zinc/90/90/43/972909043.db2.gz AUHZJNLBXJIQIJ-ZDUSSCGKSA-N 1 2 237.347 2.109 20 0 BEADLO CCOC[C@@H]1CCCC[N@H+]1Cc1cc(C)[nH]n1 ZINC001328218764 972909058 /nfs/dbraw/zinc/90/90/58/972909058.db2.gz AUHZJNLBXJIQIJ-ZDUSSCGKSA-N 1 2 237.347 2.109 20 0 BEADLO C[C@H]1CC[C@H](Cc2nnc(C[NH+](C)C)o2)C1 ZINC001328433439 973060211 /nfs/dbraw/zinc/06/02/11/973060211.db2.gz MNXDNSICQWMKDJ-UWVGGRQHSA-N 1 2 223.320 2.110 20 0 BEADLO CC(C)[NH+]1CC(O[C@@H](C)c2nccs2)C1 ZINC001224004570 973397462 /nfs/dbraw/zinc/39/74/62/973397462.db2.gz VKUJWQOBNSOOTA-VIFPVBQESA-N 1 2 226.345 2.313 20 0 BEADLO CCOc1ccc2c(c1)C[N@@H+](CC(C)=O)CC2 ZINC001331756854 1169963874 /nfs/dbraw/zinc/96/38/74/1169963874.db2.gz KSUGLLQDWAJDQJ-UHFFFAOYSA-N 1 2 233.311 2.032 20 0 BEADLO CCOc1ccc2c(c1)C[N@H+](CC(C)=O)CC2 ZINC001331756854 1169963881 /nfs/dbraw/zinc/96/38/81/1169963881.db2.gz KSUGLLQDWAJDQJ-UHFFFAOYSA-N 1 2 233.311 2.032 20 0 BEADLO COc1cc([NH2+]CC[C@H]2CCOC2)ccc1N ZINC000234904282 973786832 /nfs/dbraw/zinc/78/68/32/973786832.db2.gz RLDLIKYLIYFQJR-JTQLQIEISA-N 1 2 236.315 2.116 20 0 BEADLO Cn1ccc(C2CCN(c3cccc[nH+]3)CC2)n1 ZINC000585381410 973911532 /nfs/dbraw/zinc/91/15/32/973911532.db2.gz ZJCZXKXCBWNXHH-UHFFFAOYSA-N 1 2 242.326 2.199 20 0 BEADLO CN(C)c1cc(NCCc2cccs2)[nH+]cn1 ZINC000585415018 973912899 /nfs/dbraw/zinc/91/28/99/973912899.db2.gz IHBMGVNJQZMRPZ-UHFFFAOYSA-N 1 2 248.355 2.259 20 0 BEADLO CN(C)c1cc(NCCc2cccs2)nc[nH+]1 ZINC000585415018 973912914 /nfs/dbraw/zinc/91/29/14/973912914.db2.gz IHBMGVNJQZMRPZ-UHFFFAOYSA-N 1 2 248.355 2.259 20 0 BEADLO Cc1cnc(C[NH+]2CCC(c3ncco3)CC2)o1 ZINC000585577341 973927906 /nfs/dbraw/zinc/92/79/06/973927906.db2.gz SDOXRAOTPWAQQA-UHFFFAOYSA-N 1 2 247.298 2.351 20 0 BEADLO CC(=O)CC(C)(C)Nc1ccc(N(C)C)c[nH+]1 ZINC001171498873 974082150 /nfs/dbraw/zinc/08/21/50/974082150.db2.gz IGCNPZIAGGEDEQ-UHFFFAOYSA-N 1 2 235.331 2.317 20 0 BEADLO C[C@H](COCc1ccccc1)COC1C[NH+](C)C1 ZINC001225009405 974139602 /nfs/dbraw/zinc/13/96/02/974139602.db2.gz YZNAMOKTZVQFLN-CYBMUJFWSA-N 1 2 249.354 2.170 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2ccnc(F)c2)no1 ZINC001330322365 974234186 /nfs/dbraw/zinc/23/41/86/974234186.db2.gz CIJSGVMJQCNCNU-SECBINFHSA-N 1 2 235.262 2.368 20 0 BEADLO CCCOc1ccc(OC2C[NH+](C)C2)cc1 ZINC001225256236 974318211 /nfs/dbraw/zinc/31/82/11/974318211.db2.gz WJAGZLCTMWWSBF-UHFFFAOYSA-N 1 2 221.300 2.168 20 0 BEADLO CC(C)[NH+]1CC(Oc2cncc(Cl)c2)C1 ZINC001225287307 974357643 /nfs/dbraw/zinc/35/76/43/974357643.db2.gz OTPPGXSGEFVSIP-UHFFFAOYSA-N 1 2 226.707 2.206 20 0 BEADLO C[C@@H](O)[C@@H](C)[NH2+]CC(F)(F)c1cccc(F)c1 ZINC001330608285 974359964 /nfs/dbraw/zinc/35/99/64/974359964.db2.gz FBRDAYHYFRFQSZ-RKDXNWHRSA-N 1 2 247.260 2.276 20 0 BEADLO c1scc2c1OC[C@@H](COc1cc[nH+]cc1)O2 ZINC001225296596 974372174 /nfs/dbraw/zinc/37/21/74/974372174.db2.gz ZSBAMAKXDSZSJH-SNVBAGLBSA-N 1 2 249.291 2.362 20 0 BEADLO c1cc(O[C@H]2CCCC3(C2)OCCO3)cc[nH+]1 ZINC001225296213 974373580 /nfs/dbraw/zinc/37/35/80/974373580.db2.gz RAEAXIRYVDXWMP-LBPRGKRZSA-N 1 2 235.283 2.146 20 0 BEADLO Cc1ccc2[nH]ccc2c1OC1C[NH+](C)C1 ZINC001225435019 974488828 /nfs/dbraw/zinc/48/88/28/974488828.db2.gz PGYMFYVNOVWOSD-UHFFFAOYSA-N 1 2 216.284 2.169 20 0 BEADLO CC(C)CC1(NC(=O)[C@H](C)n2cc[nH+]c2)CC1 ZINC001330968150 974545538 /nfs/dbraw/zinc/54/55/38/974545538.db2.gz CDOGZDYAARGCIO-NSHDSACASA-N 1 2 235.331 2.139 20 0 BEADLO CC[NH+]1CC(Oc2cc(Cl)nc(Cl)c2)C1 ZINC001225611421 974594108 /nfs/dbraw/zinc/59/41/08/974594108.db2.gz WIMBGWYYJJSVBN-UHFFFAOYSA-N 1 2 247.125 2.471 20 0 BEADLO Cc1cnc(NCCCNc2cccc[nH+]2)o1 ZINC001331535501 974752383 /nfs/dbraw/zinc/75/23/83/974752383.db2.gz HBDGFZBXSFVZSE-UHFFFAOYSA-N 1 2 232.287 2.292 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2[nH]nc(C)c2C)[C@H](C)CO1 ZINC001331548630 974757271 /nfs/dbraw/zinc/75/72/71/974757271.db2.gz MJUBDVGPNQHSSS-BXKDBHETSA-N 1 2 237.347 2.026 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2[nH]nc(C)c2C)[C@H](C)CO1 ZINC001331548630 974757273 /nfs/dbraw/zinc/75/72/73/974757273.db2.gz MJUBDVGPNQHSSS-BXKDBHETSA-N 1 2 237.347 2.026 20 0 BEADLO CC(C)COCC[C@H](C)[N@@H+]1CCCC(=O)C1 ZINC001172476444 974773312 /nfs/dbraw/zinc/77/33/12/974773312.db2.gz QBADBJHXZYLGBL-LBPRGKRZSA-N 1 2 227.348 2.103 20 0 BEADLO CC(C)COCC[C@H](C)[N@H+]1CCCC(=O)C1 ZINC001172476444 974773317 /nfs/dbraw/zinc/77/33/17/974773317.db2.gz QBADBJHXZYLGBL-LBPRGKRZSA-N 1 2 227.348 2.103 20 0 BEADLO C[C@H]1CC[N@H+](Cc2nnc[nH]2)[C@H]1c1ccccc1 ZINC001331703346 974795109 /nfs/dbraw/zinc/79/51/09/974795109.db2.gz QZKFTRKANQSLEF-SMDDNHRTSA-N 1 2 242.326 2.388 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2nnc[nH]2)[C@H]1c1ccccc1 ZINC001331703346 974795116 /nfs/dbraw/zinc/79/51/16/974795116.db2.gz QZKFTRKANQSLEF-SMDDNHRTSA-N 1 2 242.326 2.388 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nnc[nH]2)[C@H]1c1ccccc1 ZINC001331703341 974795749 /nfs/dbraw/zinc/79/57/49/974795749.db2.gz QZKFTRKANQSLEF-BXUZGUMPSA-N 1 2 242.326 2.388 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nnc[nH]2)[C@H]1c1ccccc1 ZINC001331703341 974795754 /nfs/dbraw/zinc/79/57/54/974795754.db2.gz QZKFTRKANQSLEF-BXUZGUMPSA-N 1 2 242.326 2.388 20 0 BEADLO CC[NH+]1CC(Oc2cc(=O)[nH]c3ccccc32)C1 ZINC001226492913 974928786 /nfs/dbraw/zinc/92/87/86/974928786.db2.gz QUVWKMARKLUPBU-UHFFFAOYSA-N 1 2 244.294 2.023 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@H]1CCc2ccc(C)cc2C1 ZINC001172833925 974954267 /nfs/dbraw/zinc/95/42/67/974954267.db2.gz CNABKEMQVBGJNR-FZMZJTMJSA-N 1 2 247.338 2.003 20 0 BEADLO CC[NH+]1CC(Oc2cnc3ccccc3c2)C1 ZINC001226660057 975004847 /nfs/dbraw/zinc/00/48/47/975004847.db2.gz XRRYWMGVFUUACS-UHFFFAOYSA-N 1 2 228.295 2.318 20 0 BEADLO O=C1CC[N@@H+](C2CCC3(CCOCC3)CC2)C1 ZINC001173049879 975016557 /nfs/dbraw/zinc/01/65/57/975016557.db2.gz KBSJYQBHKNTNKJ-UHFFFAOYSA-N 1 2 237.343 2.001 20 0 BEADLO O=C1CC[N@H+](C2CCC3(CCOCC3)CC2)C1 ZINC001173049879 975016562 /nfs/dbraw/zinc/01/65/62/975016562.db2.gz KBSJYQBHKNTNKJ-UHFFFAOYSA-N 1 2 237.343 2.001 20 0 BEADLO CC[C@H]1CC[C@@H]([NH+]2CC(O)(C(F)(F)F)C2)C1 ZINC001173271815 975144578 /nfs/dbraw/zinc/14/45/78/975144578.db2.gz GQANHZKVKODYNG-DTWKUNHWSA-N 1 2 237.265 2.174 20 0 BEADLO CC[C@@H]1CC[C@@H](N2CC[NH2+]CC(F)(F)C2)C1 ZINC001173272923 975149515 /nfs/dbraw/zinc/14/95/15/975149515.db2.gz LKLFJBICKDGKDV-GHMZBOCLSA-N 1 2 232.318 2.106 20 0 BEADLO CC(C)(C)[NH+]1CC(Oc2ccc3nc[nH]c3c2)C1 ZINC001226929070 975157229 /nfs/dbraw/zinc/15/72/29/975157229.db2.gz XVXTXLHCQQGVKS-UHFFFAOYSA-N 1 2 245.326 2.424 20 0 BEADLO CC[C@@H]1CC[C@@H]([N@@H+]2C[C@@H](F)C[C@H]2C(=O)OC)C1 ZINC001173280302 975236565 /nfs/dbraw/zinc/23/65/65/975236565.db2.gz LMPNYZJSFHQFPH-KXNHARMFSA-N 1 2 243.322 2.151 20 0 BEADLO CC[C@@H]1CC[C@@H]([N@H+]2C[C@@H](F)C[C@H]2C(=O)OC)C1 ZINC001173280302 975236571 /nfs/dbraw/zinc/23/65/71/975236571.db2.gz LMPNYZJSFHQFPH-KXNHARMFSA-N 1 2 243.322 2.151 20 0 BEADLO CC[NH+]1CC(Oc2ccc(OC)cc2C)C1 ZINC001227131900 975289176 /nfs/dbraw/zinc/28/91/76/975289176.db2.gz PZMOCNLDJIFHFO-UHFFFAOYSA-N 1 2 221.300 2.087 20 0 BEADLO COC(C[C@H](C)Oc1c(C)cc[nH+]c1C)OC ZINC001227262988 975339757 /nfs/dbraw/zinc/33/97/57/975339757.db2.gz AZLKTWHPBFJBAL-JTQLQIEISA-N 1 2 239.315 2.475 20 0 BEADLO CCC/C(C)=C/c1nnc(C[NH+](C)C)o1 ZINC001333079681 975401703 /nfs/dbraw/zinc/40/17/03/975401703.db2.gz XXAIAJUCBYBNHU-VQHVLOKHSA-N 1 2 209.293 2.335 20 0 BEADLO COc1cc[nH+]cc1Nc1cc(F)cc(CO)c1 ZINC001212743685 975426012 /nfs/dbraw/zinc/42/60/12/975426012.db2.gz NQSVVGQYIUCAOA-UHFFFAOYSA-N 1 2 248.257 2.465 20 0 BEADLO CC(C)(C)[NH+]1CC(Oc2ccsn2)C1 ZINC001227732501 975656993 /nfs/dbraw/zinc/65/69/93/975656993.db2.gz XXJICUAORCCRLM-UHFFFAOYSA-N 1 2 212.318 2.005 20 0 BEADLO Cn1c[nH+]cc1CCCOC(=O)C=C1CCC1 ZINC001343738862 1169992491 /nfs/dbraw/zinc/99/24/91/1169992491.db2.gz MIKLRCPRSFKRPM-UHFFFAOYSA-N 1 2 234.299 2.006 20 0 BEADLO COc1ccc(Nc2cccc3[nH+]ccn32)cn1 ZINC001173957986 976000856 /nfs/dbraw/zinc/00/08/56/976000856.db2.gz PVNZDJXPCVUJGY-UHFFFAOYSA-N 1 2 240.266 2.482 20 0 BEADLO Cc1[nH]c2ccc(O[C@H]3CCCOC3)cc2[nH+]1 ZINC001228326083 976118735 /nfs/dbraw/zinc/11/87/35/976118735.db2.gz DVALETMVOQRSTJ-NSHDSACASA-N 1 2 232.283 2.429 20 0 BEADLO CCOC(=O)[C@H](C)Oc1ccc2[nH]c(C)[nH+]c2c1 ZINC001228326070 976119857 /nfs/dbraw/zinc/11/98/57/976119857.db2.gz DPCQHCFZNKOIDI-QMMMGPOBSA-N 1 2 248.282 2.202 20 0 BEADLO Cc1[nH]c2ccc(OC3CCOCC3)cc2[nH+]1 ZINC001228326071 976125109 /nfs/dbraw/zinc/12/51/09/976125109.db2.gz DQKKPTPKELOCPS-UHFFFAOYSA-N 1 2 232.283 2.429 20 0 BEADLO COCc1ccc(-c2c[nH+]cn2C)cc1F ZINC001334086973 976288540 /nfs/dbraw/zinc/28/85/40/976288540.db2.gz KFSROMZAHRXFAO-UHFFFAOYSA-N 1 2 220.247 2.373 20 0 BEADLO Cc1ccc(OC(C)C)cc1OC1C[NH+](C)C1 ZINC001228727437 976460865 /nfs/dbraw/zinc/46/08/65/976460865.db2.gz MMEPXYSKJIDTJO-UHFFFAOYSA-N 1 2 235.327 2.475 20 0 BEADLO Clc1cc(Nc2cn[nH]c2)cn2cc[nH+]c12 ZINC001174295449 976477934 /nfs/dbraw/zinc/47/79/34/976477934.db2.gz CGVKNNQBXPDNRV-UHFFFAOYSA-N 1 2 233.662 2.454 20 0 BEADLO c1cn(Cc2cccc(Nc3cn[nH]c3)c2)c[nH+]1 ZINC001174296215 976481691 /nfs/dbraw/zinc/48/16/91/976481691.db2.gz QQZNSQONIGXIFM-UHFFFAOYSA-N 1 2 239.282 2.398 20 0 BEADLO COc1cc(Nc2ccn3cc[nH+]c3c2)ccn1 ZINC001174305658 976516127 /nfs/dbraw/zinc/51/61/27/976516127.db2.gz HHFWNXKEERTCOT-UHFFFAOYSA-N 1 2 240.266 2.482 20 0 BEADLO Cc1cn(C(C)(C)C(=O)NC/C=C\C2CC2)c[nH+]1 ZINC001334514644 976546142 /nfs/dbraw/zinc/54/61/42/976546142.db2.gz MPZVDEUSYSYPLY-PLNGDYQASA-N 1 2 247.342 2.009 20 0 BEADLO Cc1nn(C)cc1Nc1c[nH+]c(C)cc1C ZINC001174333652 976548993 /nfs/dbraw/zinc/54/89/93/976548993.db2.gz UZEKUSSSMNZGHD-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO Cn1ncc2ccc(Nc3[nH+]cccc3N)cc21 ZINC001174337286 976558288 /nfs/dbraw/zinc/55/82/88/976558288.db2.gz MWEGQZWELJKRBZ-UHFFFAOYSA-N 1 2 239.282 2.294 20 0 BEADLO Cc1ccc(Nc2ccc(=O)n(C)c2)c(C)[nH+]1 ZINC001174354442 976577432 /nfs/dbraw/zinc/57/74/32/976577432.db2.gz WPYIADFOPGXBPV-UHFFFAOYSA-N 1 2 229.283 2.141 20 0 BEADLO Cc1cn2c(cccc2Nc2cnn(C)c2C)[nH+]1 ZINC001174389618 976647025 /nfs/dbraw/zinc/64/70/25/976647025.db2.gz JIECEQXJFJBEJF-UHFFFAOYSA-N 1 2 241.298 2.428 20 0 BEADLO CCN(C)c1ccc(Nc2cnn(C)c2C)c[nH+]1 ZINC001174391064 976654169 /nfs/dbraw/zinc/65/41/69/976654169.db2.gz BEBIAQBJVWANDK-UHFFFAOYSA-N 1 2 245.330 2.323 20 0 BEADLO Cc1n[nH]cc1Nc1[nH+]c(C)ccc1C ZINC001174470911 976776885 /nfs/dbraw/zinc/77/68/85/976776885.db2.gz XZBSDHCVXVVBGM-UHFFFAOYSA-N 1 2 202.261 2.474 20 0 BEADLO Cc1cc(Nc2c[nH]c(Cl)cc2=O)cc[nH+]1 ZINC001174653461 976938612 /nfs/dbraw/zinc/93/86/12/976938612.db2.gz FLJJTNLMKIMGGP-UHFFFAOYSA-N 1 2 235.674 2.310 20 0 BEADLO C[NH+]1CC(Oc2ccc(C(F)F)cc2)C1 ZINC001229705728 976954819 /nfs/dbraw/zinc/95/48/19/976954819.db2.gz WKIMHTOCFMXQIG-UHFFFAOYSA-N 1 2 213.227 2.317 20 0 BEADLO C[C@@H](C(=O)NC(C)(C)/C=C\Cl)n1cc[nH+]c1 ZINC001335323985 976962106 /nfs/dbraw/zinc/96/21/06/976962106.db2.gz LUNFLYPCLBRSHH-WBSSQXGSSA-N 1 2 241.722 2.091 20 0 BEADLO CC[NH+]1CC(Oc2c(C)cc(O)c(C)c2C)C1 ZINC001229767972 976985939 /nfs/dbraw/zinc/98/59/39/976985939.db2.gz HBARGMODJLAETI-UHFFFAOYSA-N 1 2 235.327 2.400 20 0 BEADLO c1cn(-c2ccc(OC[C@H]3CCCO3)cc2)c[nH+]1 ZINC001229952004 977032805 /nfs/dbraw/zinc/03/28/05/977032805.db2.gz XBOTWLKGCVKIPY-CQSZACIVSA-N 1 2 244.294 2.430 20 0 BEADLO c1cn(-c2ccc(O[C@@H]3CCCOC3)cc2)c[nH+]1 ZINC001229949817 977033384 /nfs/dbraw/zinc/03/33/84/977033384.db2.gz GQWCRXBWVSOBHW-CQSZACIVSA-N 1 2 244.294 2.430 20 0 BEADLO c1cn(-c2ccc(OC[C@@H]3CCO3)cc2)c[nH+]1 ZINC001229951978 977034169 /nfs/dbraw/zinc/03/41/69/977034169.db2.gz WUAMNMHBZPESDT-ZDUSSCGKSA-N 1 2 230.267 2.040 20 0 BEADLO CCc1cccc(O)c1OC1C[NH+](C(C)C)C1 ZINC001230371450 977195615 /nfs/dbraw/zinc/19/56/15/977195615.db2.gz FZKFVSZPTVGRTR-UHFFFAOYSA-N 1 2 235.327 2.426 20 0 BEADLO OCCc1ccc[nH+]c1Nc1ccc(O)cc1 ZINC001175044162 977238965 /nfs/dbraw/zinc/23/89/65/977238965.db2.gz OVWIYDYTQCJEER-UHFFFAOYSA-N 1 2 230.267 2.066 20 0 BEADLO CCCC(=O)N(C)C[C@@H]1CC[N@@H+]1C/C=C/Cl ZINC001230633907 977280490 /nfs/dbraw/zinc/28/04/90/977280490.db2.gz MJHLCQHLIGEXQX-ZPMKCOPCSA-N 1 2 244.766 2.072 20 0 BEADLO CCCC(=O)N(C)C[C@@H]1CC[N@H+]1C/C=C/Cl ZINC001230633907 977280498 /nfs/dbraw/zinc/28/04/98/977280498.db2.gz MJHLCQHLIGEXQX-ZPMKCOPCSA-N 1 2 244.766 2.072 20 0 BEADLO Cc1cn2cccc(Nc3ccncc3F)c2[nH+]1 ZINC001175197001 977291750 /nfs/dbraw/zinc/29/17/50/977291750.db2.gz IPZIMSGSALVGRR-UHFFFAOYSA-N 1 2 242.257 2.342 20 0 BEADLO CCOc1cc(Nc2ccc(N(C)C)[nH+]c2)no1 ZINC001175341352 977360733 /nfs/dbraw/zinc/36/07/33/977360733.db2.gz HHDBEBAPDJWQBP-UHFFFAOYSA-N 1 2 248.286 2.278 20 0 BEADLO CN(C)c1ccc(Nc2cccc(N)c2O)c[nH+]1 ZINC001175344742 977364946 /nfs/dbraw/zinc/36/49/46/977364946.db2.gz YWGXEGQWVNBXMC-UHFFFAOYSA-N 1 2 244.298 2.179 20 0 BEADLO CN(C)c1ccc(Nc2cccc(CO)c2)c[nH+]1 ZINC001175343095 977365977 /nfs/dbraw/zinc/36/59/77/977365977.db2.gz GBRSSJACQRJTSW-UHFFFAOYSA-N 1 2 243.310 2.384 20 0 BEADLO CCO[C@@H](C)COc1cc2c(cc1O)C=[NH+]CC2 ZINC001230921764 977382248 /nfs/dbraw/zinc/38/22/48/977382248.db2.gz RURBEWBLYLHNSW-JTQLQIEISA-N 1 2 249.310 2.171 20 0 BEADLO CCc1cc(Nc2ccc(N(C)C)[nH+]c2)on1 ZINC001175340127 977386178 /nfs/dbraw/zinc/38/61/78/977386178.db2.gz AWNVTTWBXPIIIE-UHFFFAOYSA-N 1 2 232.287 2.442 20 0 BEADLO CO[C@H](C)COc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001231081501 977467443 /nfs/dbraw/zinc/46/74/43/977467443.db2.gz MDOFHFGYOLBESE-SNVBAGLBSA-N 1 2 232.283 2.490 20 0 BEADLO CC[NH+]1CC(Oc2ccc(-c3ncc[nH]3)cc2)C1 ZINC001231083635 977474709 /nfs/dbraw/zinc/47/47/09/977474709.db2.gz MEXXGFLGHGHNRP-UHFFFAOYSA-N 1 2 243.310 2.160 20 0 BEADLO CCC[C@@H]1CCCN1C(=O)[C@H](C)n1cc[nH+]c1 ZINC001336161618 977545322 /nfs/dbraw/zinc/54/53/22/977545322.db2.gz BJMSQLMHOKOXBB-NWDGAFQWSA-N 1 2 235.331 2.235 20 0 BEADLO CC[NH+]1CC(Oc2cc(N(C)C)ccc2N=O)C1 ZINC001231288777 977547403 /nfs/dbraw/zinc/54/74/03/977547403.db2.gz DQGLJDVTVBQNEV-UHFFFAOYSA-N 1 2 249.314 2.233 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1ccc(F)c(C)c1F ZINC001231480614 977602032 /nfs/dbraw/zinc/60/20/32/977602032.db2.gz ZTUDCPHJJZISMR-NSHDSACASA-N 1 2 241.281 2.494 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1ccc(F)c(C)c1F ZINC001231480614 977602041 /nfs/dbraw/zinc/60/20/41/977602041.db2.gz ZTUDCPHJJZISMR-NSHDSACASA-N 1 2 241.281 2.494 20 0 BEADLO C[N@H+](Cc1ccon1)Cc1c[nH]c2cnccc12 ZINC001231520713 977626762 /nfs/dbraw/zinc/62/67/62/977626762.db2.gz CKWGCVMPIVZLMP-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO C[N@@H+](Cc1ccon1)Cc1c[nH]c2cnccc12 ZINC001231520713 977626773 /nfs/dbraw/zinc/62/67/73/977626773.db2.gz CKWGCVMPIVZLMP-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO CC(C)Oc1ccc(C[N@@H+]2CC[C@@H](F)C2)cn1 ZINC001231532239 977626965 /nfs/dbraw/zinc/62/69/65/977626965.db2.gz SBSSCPFLDZQIGT-GFCCVEGCSA-N 1 2 238.306 2.413 20 0 BEADLO CC(C)Oc1ccc(C[N@H+]2CC[C@@H](F)C2)cn1 ZINC001231532239 977626973 /nfs/dbraw/zinc/62/69/73/977626973.db2.gz SBSSCPFLDZQIGT-GFCCVEGCSA-N 1 2 238.306 2.413 20 0 BEADLO CSc1cc(Nc2cnc(N)nc2C)cc[nH+]1 ZINC001175664637 977639571 /nfs/dbraw/zinc/63/95/71/977639571.db2.gz GNGSNQYCBVAVRS-UHFFFAOYSA-N 1 2 247.327 2.228 20 0 BEADLO Cc1cc(C)c(Nc2cnc(N)nc2C)c[nH+]1 ZINC001175665113 977645320 /nfs/dbraw/zinc/64/53/20/977645320.db2.gz CZPCMQZYVJLINC-UHFFFAOYSA-N 1 2 229.287 2.123 20 0 BEADLO CCc1ccc(C[N@@H+]2CCCC(=O)[C@@H](C)C2)nc1 ZINC001231637898 977652513 /nfs/dbraw/zinc/65/25/13/977652513.db2.gz QBJAJWVGAAANMA-LBPRGKRZSA-N 1 2 246.354 2.445 20 0 BEADLO CCc1ccc(C[N@H+]2CCCC(=O)[C@@H](C)C2)nc1 ZINC001231637898 977652525 /nfs/dbraw/zinc/65/25/25/977652525.db2.gz QBJAJWVGAAANMA-LBPRGKRZSA-N 1 2 246.354 2.445 20 0 BEADLO CCc1ccc(C[N@H+](C)Cc2ccno2)nc1 ZINC001231642471 977658477 /nfs/dbraw/zinc/65/84/77/977658477.db2.gz BLSYFELENNVVMT-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1ccc(C[N@@H+](C)Cc2ccno2)nc1 ZINC001231642471 977658482 /nfs/dbraw/zinc/65/84/82/977658482.db2.gz BLSYFELENNVVMT-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1ccc(C[N@H+](C)Cc2ccncn2)nc1 ZINC001231646679 977661262 /nfs/dbraw/zinc/66/12/62/977661262.db2.gz MKDAEVCYPIQDJT-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO CCc1ccc(C[N@@H+](C)Cc2ccncn2)nc1 ZINC001231646679 977661268 /nfs/dbraw/zinc/66/12/68/977661268.db2.gz MKDAEVCYPIQDJT-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO CCOc1ccc(C[N@@H+]2C[C@H](F)C[C@H]2C)cn1 ZINC001231650305 977669039 /nfs/dbraw/zinc/66/90/39/977669039.db2.gz XXOJQDFBZSICMB-ZYHUDNBSSA-N 1 2 238.306 2.413 20 0 BEADLO CCOc1ccc(C[N@H+]2C[C@H](F)C[C@H]2C)cn1 ZINC001231650305 977669051 /nfs/dbraw/zinc/66/90/51/977669051.db2.gz XXOJQDFBZSICMB-ZYHUDNBSSA-N 1 2 238.306 2.413 20 0 BEADLO COCc1ccc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)o1 ZINC001231689973 977690265 /nfs/dbraw/zinc/69/02/65/977690265.db2.gz ZFVQSGUVRFVQPO-XDTLVQLUSA-N 1 2 239.290 2.216 20 0 BEADLO COCc1ccc(C[N@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)o1 ZINC001231689973 977690273 /nfs/dbraw/zinc/69/02/73/977690273.db2.gz ZFVQSGUVRFVQPO-XDTLVQLUSA-N 1 2 239.290 2.216 20 0 BEADLO COc1cc(Cl)c(C[NH+](C)C)c(OC)c1 ZINC001231694466 977696458 /nfs/dbraw/zinc/69/64/58/977696458.db2.gz PXSUPGFNIYYSBR-UHFFFAOYSA-N 1 2 229.707 2.419 20 0 BEADLO CC1C[NH+](Cc2ccc(Cl)c(O)c2)C1 ZINC001231732454 977714173 /nfs/dbraw/zinc/71/41/73/977714173.db2.gz CNJGBIFZOZBFKZ-UHFFFAOYSA-N 1 2 211.692 2.497 20 0 BEADLO CSc1ccccc1C[N@H+](C)C1COC1 ZINC001231785431 977748496 /nfs/dbraw/zinc/74/84/96/977748496.db2.gz NMLBORQZVUWLAL-UHFFFAOYSA-N 1 2 223.341 2.239 20 0 BEADLO CSc1ccccc1C[N@@H+](C)C1COC1 ZINC001231785431 977748510 /nfs/dbraw/zinc/74/85/10/977748510.db2.gz NMLBORQZVUWLAL-UHFFFAOYSA-N 1 2 223.341 2.239 20 0 BEADLO C[N@H+](Cc1cc(Cl)cnc1F)[C@H]1CCOC1 ZINC001231993913 977826680 /nfs/dbraw/zinc/82/66/80/977826680.db2.gz YNYPXFLTKKTGTE-JTQLQIEISA-N 1 2 244.697 2.095 20 0 BEADLO C[N@@H+](Cc1cc(Cl)cnc1F)[C@H]1CCOC1 ZINC001231993913 977826683 /nfs/dbraw/zinc/82/66/83/977826683.db2.gz YNYPXFLTKKTGTE-JTQLQIEISA-N 1 2 244.697 2.095 20 0 BEADLO Cc1cc(C[N@@H+]2CCCC(=O)CC2)cc(C)n1 ZINC001231996419 977831313 /nfs/dbraw/zinc/83/13/13/977831313.db2.gz CSMDVFRILXOMDG-UHFFFAOYSA-N 1 2 232.327 2.253 20 0 BEADLO Cc1cc(C[N@H+]2CCCC(=O)CC2)cc(C)n1 ZINC001231996419 977831317 /nfs/dbraw/zinc/83/13/17/977831317.db2.gz CSMDVFRILXOMDG-UHFFFAOYSA-N 1 2 232.327 2.253 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H]3CC[C@@H]2CO3)cc(C)n1 ZINC001232004086 977834678 /nfs/dbraw/zinc/83/46/78/977834678.db2.gz JZRXDJIEJFPILL-ZIAGYGMSSA-N 1 2 232.327 2.062 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H]3CC[C@@H]2CO3)cc(C)n1 ZINC001232004086 977834685 /nfs/dbraw/zinc/83/46/85/977834685.db2.gz JZRXDJIEJFPILL-ZIAGYGMSSA-N 1 2 232.327 2.062 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1cc2ncccc2[nH]1 ZINC001232065283 977876772 /nfs/dbraw/zinc/87/67/72/977876772.db2.gz QYFTWVNVCKWVLO-GFCCVEGCSA-N 1 2 245.326 2.174 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1cc2ncccc2[nH]1 ZINC001232065283 977876778 /nfs/dbraw/zinc/87/67/78/977876778.db2.gz QYFTWVNVCKWVLO-GFCCVEGCSA-N 1 2 245.326 2.174 20 0 BEADLO F[C@@H]1CCC[N@H+](Cc2cc3ncccc3[nH]2)C1 ZINC001232070458 977882346 /nfs/dbraw/zinc/88/23/46/977882346.db2.gz SZPQDXVUCAELDN-SNVBAGLBSA-N 1 2 233.290 2.497 20 0 BEADLO F[C@@H]1CCC[N@@H+](Cc2cc3ncccc3[nH]2)C1 ZINC001232070458 977882348 /nfs/dbraw/zinc/88/23/48/977882348.db2.gz SZPQDXVUCAELDN-SNVBAGLBSA-N 1 2 233.290 2.497 20 0 BEADLO Nc1cc2ccn(-c3[nH]cc[nH+]3)c2cc1F ZINC001176090303 977890497 /nfs/dbraw/zinc/89/04/97/977890497.db2.gz BIEUEMHNDLWMTB-UHFFFAOYSA-N 1 2 216.219 2.075 20 0 BEADLO C[C@H]1CC[N@@H+]1Cc1cn(C)nc1C(F)(F)F ZINC001232086434 977890590 /nfs/dbraw/zinc/89/05/90/977890590.db2.gz QOTMPTPGKHWUGQ-ZETCQYMHSA-N 1 2 233.237 2.033 20 0 BEADLO C[C@H]1CC[N@H+]1Cc1cn(C)nc1C(F)(F)F ZINC001232086434 977890594 /nfs/dbraw/zinc/89/05/94/977890594.db2.gz QOTMPTPGKHWUGQ-ZETCQYMHSA-N 1 2 233.237 2.033 20 0 BEADLO c1cn2cccc(NC3=CCOCC3)c2[nH+]1 ZINC001176140604 977923598 /nfs/dbraw/zinc/92/35/98/977923598.db2.gz XCOQSUJWNFFHBH-UHFFFAOYSA-N 1 2 215.256 2.050 20 0 BEADLO COc1cc[nH+]cc1Nc1cc(F)ccn1 ZINC001176118414 977943808 /nfs/dbraw/zinc/94/38/08/977943808.db2.gz FHECQCLCRPGVQG-UHFFFAOYSA-N 1 2 219.219 2.368 20 0 BEADLO COc1cc[nH+]cc1Nc1nc(C)co1 ZINC001176116351 977943919 /nfs/dbraw/zinc/94/39/19/977943919.db2.gz ALAIJPQEUKTXML-UHFFFAOYSA-N 1 2 205.217 2.130 20 0 BEADLO Oc1ccc2c(c1)CC[N@@H+](Cc1cnsc1)C2 ZINC001232225766 977949199 /nfs/dbraw/zinc/94/91/99/977949199.db2.gz GSPIPOZRJAFWES-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO Oc1ccc2c(c1)CC[N@H+](Cc1cnsc1)C2 ZINC001232225766 977949208 /nfs/dbraw/zinc/94/92/08/977949208.db2.gz GSPIPOZRJAFWES-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO COc1cc[nH+]cc1Nc1cnccc1C(C)=O ZINC001176119329 977949521 /nfs/dbraw/zinc/94/95/21/977949521.db2.gz WGGXHUWHUVKZLS-UHFFFAOYSA-N 1 2 243.266 2.431 20 0 BEADLO COc1cc[nH+]cc1Nc1ccc(Cl)nn1 ZINC001176118777 977949776 /nfs/dbraw/zinc/94/97/76/977949776.db2.gz HGXGAZBKGPQBOD-UHFFFAOYSA-N 1 2 236.662 2.277 20 0 BEADLO COc1cc[nH+]cc1Nc1cnn(C(F)F)c1 ZINC001176120910 977951286 /nfs/dbraw/zinc/95/12/86/977951286.db2.gz ASIDYPBQZHFPPV-UHFFFAOYSA-N 1 2 240.213 2.425 20 0 BEADLO COc1cc[nH+]cc1Nc1nc(C)cnc1C ZINC001176119177 977952133 /nfs/dbraw/zinc/95/21/33/977952133.db2.gz MOSYXYJQQVRMCH-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO COc1cc[nH+]cc1N(C)c1ccccc1N ZINC001176121138 977952317 /nfs/dbraw/zinc/95/23/17/977952317.db2.gz PHONSQFAQJXKTR-UHFFFAOYSA-N 1 2 229.283 2.440 20 0 BEADLO Cc1cc[nH+]c(Nc2ccc(=O)[nH]c2)c1 ZINC001176124826 977958377 /nfs/dbraw/zinc/95/83/77/977958377.db2.gz RYJPRGAMFBDBNN-UHFFFAOYSA-N 1 2 201.229 2.234 20 0 BEADLO c1ccc2c(c1)ccnc2C[NH+]1CC2(CCO2)C1 ZINC001232248511 977977711 /nfs/dbraw/zinc/97/77/11/977977711.db2.gz JLRBIKWUDCMSIN-UHFFFAOYSA-N 1 2 240.306 2.210 20 0 BEADLO c1ccc2c(c1)ccnc2C[N@@H+]1CCO[C@H]2C[C@H]21 ZINC001232249210 977978011 /nfs/dbraw/zinc/97/80/11/977978011.db2.gz JEWHFMOAISVTTR-CABCVRRESA-N 1 2 240.306 2.208 20 0 BEADLO c1ccc2c(c1)ccnc2C[N@H+]1CCO[C@H]2C[C@H]21 ZINC001232249210 977978022 /nfs/dbraw/zinc/97/80/22/977978022.db2.gz JEWHFMOAISVTTR-CABCVRRESA-N 1 2 240.306 2.208 20 0 BEADLO CC(C)OC(=O)C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC001336818744 977981795 /nfs/dbraw/zinc/98/17/95/977981795.db2.gz DQMGNEVGZGKPRO-CYBMUJFWSA-N 1 2 248.326 2.170 20 0 BEADLO CC(C)OC(=O)C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC001336818744 977981810 /nfs/dbraw/zinc/98/18/10/977981810.db2.gz DQMGNEVGZGKPRO-CYBMUJFWSA-N 1 2 248.326 2.170 20 0 BEADLO Fc1c[nH+]ccc1NCCCC(F)F ZINC001336823506 977985133 /nfs/dbraw/zinc/98/51/33/977985133.db2.gz DPRFLKZJIGZRCD-UHFFFAOYSA-N 1 2 204.195 2.100 20 0 BEADLO COc1ccc(N(C)c2[nH+]cccc2N)cc1O ZINC001176253795 978014906 /nfs/dbraw/zinc/01/49/06/978014906.db2.gz IFPOXMRFBBSIRI-UHFFFAOYSA-N 1 2 245.282 2.146 20 0 BEADLO Cc1cc(O)c[nH+]c1Nc1ccc2nonc2c1 ZINC001176321105 978040757 /nfs/dbraw/zinc/04/07/57/978040757.db2.gz OBLHRPARQCDPOO-UHFFFAOYSA-N 1 2 242.238 2.375 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@H]2CCCOC2)ns1 ZINC001249589988 978047279 /nfs/dbraw/zinc/04/72/79/978047279.db2.gz GJFZGGVIDQCSHK-NSHDSACASA-N 1 2 226.345 2.062 20 0 BEADLO Cc1cc(C[N@H+](C)[C@H]2CCCOC2)ns1 ZINC001249589988 978047291 /nfs/dbraw/zinc/04/72/91/978047291.db2.gz GJFZGGVIDQCSHK-NSHDSACASA-N 1 2 226.345 2.062 20 0 BEADLO Cc1[nH]c(CN2CCC(=O)[C@@H]3CCCC[C@@H]32)c[nH+]1 ZINC001232458661 978089927 /nfs/dbraw/zinc/08/99/27/978089927.db2.gz PTQDAMWKUVHQHN-OLZOCXBDSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1[nH]cc(CN2CCC(=O)[C@@H]3CCCC[C@@H]32)[nH+]1 ZINC001232458661 978089938 /nfs/dbraw/zinc/08/99/38/978089938.db2.gz PTQDAMWKUVHQHN-OLZOCXBDSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1[nH]c(CN2CCC[C@@](C)(F)C2)c[nH+]1 ZINC001232460430 978100728 /nfs/dbraw/zinc/10/07/28/978100728.db2.gz QHYSOGLXACAHCV-LLVKDONJSA-N 1 2 211.284 2.042 20 0 BEADLO Cc1[nH]c(CN2CCn3cccc3[C@@H]2C)c[nH+]1 ZINC001232465205 978106273 /nfs/dbraw/zinc/10/62/73/978106273.db2.gz YHZWRLQBPUNFNM-JTQLQIEISA-N 1 2 230.315 2.096 20 0 BEADLO Cc1cccc(F)c1C[N@@H+](C)Cc1cnn(C)c1 ZINC001232482163 978134386 /nfs/dbraw/zinc/13/43/86/978134386.db2.gz OSPJMMLTRBEIAI-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1cccc(F)c1C[N@H+](C)Cc1cnn(C)c1 ZINC001232482163 978134390 /nfs/dbraw/zinc/13/43/90/978134390.db2.gz OSPJMMLTRBEIAI-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO COc1cncc(OC)c1C[NH+]1CC2(CCC2)C1 ZINC001232503142 978157653 /nfs/dbraw/zinc/15/76/53/978157653.db2.gz ZHFPZXLEGRMTHW-UHFFFAOYSA-N 1 2 248.326 2.085 20 0 BEADLO Cc1c(Br)cncc1C[NH+]1CCC1 ZINC001232527674 978161243 /nfs/dbraw/zinc/16/12/43/978161243.db2.gz MNPSTFGALOUDMY-UHFFFAOYSA-N 1 2 241.132 2.358 20 0 BEADLO c1cc(Nc2ccc[nH+]c2N2CCCC2)no1 ZINC001176743829 978169695 /nfs/dbraw/zinc/16/96/95/978169695.db2.gz OBLAQRDNHJPQFH-UHFFFAOYSA-N 1 2 230.271 2.413 20 0 BEADLO c1nnsc1Nc1ccc[nH+]c1N1CCCC1 ZINC001176749298 978171432 /nfs/dbraw/zinc/17/14/32/978171432.db2.gz ANZWFPLGELCOEC-UHFFFAOYSA-N 1 2 247.327 2.277 20 0 BEADLO C[C@H]1C[NH+](Cc2cc3ccoc3cn2)C[C@H](C)O1 ZINC001232550608 978176016 /nfs/dbraw/zinc/17/60/16/978176016.db2.gz FCVJTBWDYJQJES-QWRGUYRKSA-N 1 2 246.310 2.437 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2cc3ccoc3cn2)C1 ZINC001232550549 978176422 /nfs/dbraw/zinc/17/64/22/978176422.db2.gz YQDIPDKWHWUBEO-SNVBAGLBSA-N 1 2 220.247 2.372 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2cc3ccoc3cn2)C1 ZINC001232550549 978176423 /nfs/dbraw/zinc/17/64/23/978176423.db2.gz YQDIPDKWHWUBEO-SNVBAGLBSA-N 1 2 220.247 2.372 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc3ccoc3cn2)[C@@H](C)CO1 ZINC001232554764 978180724 /nfs/dbraw/zinc/18/07/24/978180724.db2.gz JXNYRXQJQHEHPP-WDEREUQCSA-N 1 2 246.310 2.437 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc3ccoc3cn2)[C@@H](C)CO1 ZINC001232554764 978180730 /nfs/dbraw/zinc/18/07/30/978180730.db2.gz JXNYRXQJQHEHPP-WDEREUQCSA-N 1 2 246.310 2.437 20 0 BEADLO c1nc2cccc(C[N@@H+]3CCO[C@@H]4C[C@@H]43)c2s1 ZINC001232736955 978254106 /nfs/dbraw/zinc/25/41/06/978254106.db2.gz TVCKHGLHSXQDOD-NWDGAFQWSA-N 1 2 246.335 2.269 20 0 BEADLO c1nc2cccc(C[N@H+]3CCO[C@@H]4C[C@@H]43)c2s1 ZINC001232736955 978254112 /nfs/dbraw/zinc/25/41/12/978254112.db2.gz TVCKHGLHSXQDOD-NWDGAFQWSA-N 1 2 246.335 2.269 20 0 BEADLO Fc1cc(F)c2c(c1)CC[N@H+]([C@H]1CCOC1)C2 ZINC001177027397 978275050 /nfs/dbraw/zinc/27/50/50/978275050.db2.gz JMSJTBVGPGMYLT-NSHDSACASA-N 1 2 239.265 2.112 20 0 BEADLO Fc1cc(F)c2c(c1)CC[N@@H+]([C@H]1CCOC1)C2 ZINC001177027397 978275055 /nfs/dbraw/zinc/27/50/55/978275055.db2.gz JMSJTBVGPGMYLT-NSHDSACASA-N 1 2 239.265 2.112 20 0 BEADLO CN(CC1CCC1)C(=O)c1cccc2[nH+]ccn21 ZINC001337312129 978281933 /nfs/dbraw/zinc/28/19/33/978281933.db2.gz FXBIGYTUHLUUTA-UHFFFAOYSA-N 1 2 243.310 2.206 20 0 BEADLO COc1cc(O)cc(C[N@@H+]2CCC[C@@H](F)C2)c1 ZINC001232804359 978298172 /nfs/dbraw/zinc/29/81/72/978298172.db2.gz XQQBELZEJIICMN-LLVKDONJSA-N 1 2 239.290 2.335 20 0 BEADLO COc1cc(O)cc(C[N@H+]2CCC[C@@H](F)C2)c1 ZINC001232804359 978298187 /nfs/dbraw/zinc/29/81/87/978298187.db2.gz XQQBELZEJIICMN-LLVKDONJSA-N 1 2 239.290 2.335 20 0 BEADLO CCc1[nH]c(CNC(=O)C2=CC[C@H](C)CC2)c[nH+]1 ZINC001597258098 978307090 /nfs/dbraw/zinc/30/70/90/978307090.db2.gz UZCQKCBSSQJMFQ-JTQLQIEISA-N 1 2 247.342 2.335 20 0 BEADLO CCc1[nH]cc(CNC(=O)C2=CC[C@H](C)CC2)[nH+]1 ZINC001597258098 978307098 /nfs/dbraw/zinc/30/70/98/978307098.db2.gz UZCQKCBSSQJMFQ-JTQLQIEISA-N 1 2 247.342 2.335 20 0 BEADLO Cc1cc(O)cc(C[N@H+](C)Cc2ccno2)c1 ZINC001232881658 978319105 /nfs/dbraw/zinc/31/91/05/978319105.db2.gz HKQKKXPJARJCJA-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO Cc1cc(O)cc(C[N@@H+](C)Cc2ccno2)c1 ZINC001232881658 978319112 /nfs/dbraw/zinc/31/91/12/978319112.db2.gz HKQKKXPJARJCJA-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO Oc1c(F)ccc(C[NH+]2CCCC2)c1F ZINC001232934036 978329537 /nfs/dbraw/zinc/32/95/37/978329537.db2.gz WFZOHDLBAHYXTH-UHFFFAOYSA-N 1 2 213.227 2.266 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccc3ncoc3c2)CCO1 ZINC001232938810 978349734 /nfs/dbraw/zinc/34/97/34/978349734.db2.gz ZUUFIOHPZZXCDE-JTQLQIEISA-N 1 2 232.283 2.049 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccc3ncoc3c2)CCO1 ZINC001232938810 978349747 /nfs/dbraw/zinc/34/97/47/978349747.db2.gz ZUUFIOHPZZXCDE-JTQLQIEISA-N 1 2 232.283 2.049 20 0 BEADLO Cc1cncc(C(=O)Nc2c(C)c[nH+]cc2C)c1 ZINC001597677179 978351762 /nfs/dbraw/zinc/35/17/62/978351762.db2.gz RBEWQOTWIWXMQG-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO CC(C)N(C(=O)CN(C)c1cccc[nH+]1)C(C)C ZINC001177408272 978354738 /nfs/dbraw/zinc/35/47/38/978354738.db2.gz AKJIMZYBDUCENH-UHFFFAOYSA-N 1 2 249.358 2.163 20 0 BEADLO N#CN1CC[NH+](Cc2ccc(C3CC3)cc2)CC1 ZINC001232985940 978383528 /nfs/dbraw/zinc/38/35/28/978383528.db2.gz CRJARTHRQYQENU-UHFFFAOYSA-N 1 2 241.338 2.163 20 0 BEADLO Cc1ncc(F)cc1C[N@H+]1C[C@H](F)C[C@H]1C ZINC001232986995 978390522 /nfs/dbraw/zinc/39/05/22/978390522.db2.gz XWFUNUVZYNSJGF-PRHODGIISA-N 1 2 226.270 2.461 20 0 BEADLO Cc1ncc(F)cc1C[N@@H+]1C[C@H](F)C[C@H]1C ZINC001232986995 978390532 /nfs/dbraw/zinc/39/05/32/978390532.db2.gz XWFUNUVZYNSJGF-PRHODGIISA-N 1 2 226.270 2.461 20 0 BEADLO Oc1cnc(Cl)cc1C[N@@H+]1CCC[C@@H]1CF ZINC001233041062 978421830 /nfs/dbraw/zinc/42/18/30/978421830.db2.gz QKDMMXONEWSTNL-SECBINFHSA-N 1 2 244.697 2.375 20 0 BEADLO Oc1cnc(Cl)cc1C[N@H+]1CCC[C@@H]1CF ZINC001233041062 978421834 /nfs/dbraw/zinc/42/18/34/978421834.db2.gz QKDMMXONEWSTNL-SECBINFHSA-N 1 2 244.697 2.375 20 0 BEADLO Cc1cc(C(=O)Nc2c(C)c[nH+]cc2C)ns1 ZINC001337638025 978440059 /nfs/dbraw/zinc/44/00/59/978440059.db2.gz ADDFXZAFPPFUGN-UHFFFAOYSA-N 1 2 247.323 2.138 20 0 BEADLO Oc1cccc(C[NH+]2CC3(CSC3)C2)c1F ZINC001233054186 978446206 /nfs/dbraw/zinc/44/62/06/978446206.db2.gz FDFCVUTUTLUUMO-UHFFFAOYSA-N 1 2 239.315 2.080 20 0 BEADLO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1nc2ccccn2n1 ZINC001233068495 978455121 /nfs/dbraw/zinc/45/51/21/978455121.db2.gz WTHNUPRTRPGDIS-VXGBXAGGSA-N 1 2 244.342 2.492 20 0 BEADLO c1ccn2nc(C[N@@H+]3CCC34CCCC4)nc2c1 ZINC001233070284 978457847 /nfs/dbraw/zinc/45/78/47/978457847.db2.gz HDOAPGCYGBHJLC-UHFFFAOYSA-N 1 2 242.326 2.248 20 0 BEADLO c1ccn2nc(C[N@H+]3CCC34CCCC4)nc2c1 ZINC001233070284 978457853 /nfs/dbraw/zinc/45/78/53/978457853.db2.gz HDOAPGCYGBHJLC-UHFFFAOYSA-N 1 2 242.326 2.248 20 0 BEADLO C[C@@H]1CCC[N@H+](Cc2nc3ccccn3n2)[C@H]1C ZINC001233070190 978458364 /nfs/dbraw/zinc/45/83/64/978458364.db2.gz LTDBLIPCPDTFAU-NEPJUHHUSA-N 1 2 244.342 2.350 20 0 BEADLO C[C@@H]1CCC[N@@H+](Cc2nc3ccccn3n2)[C@H]1C ZINC001233070190 978458374 /nfs/dbraw/zinc/45/83/74/978458374.db2.gz LTDBLIPCPDTFAU-NEPJUHHUSA-N 1 2 244.342 2.350 20 0 BEADLO Fc1ccc2c(c1)n[nH]c2C[N@H+]1CC[C@@H](F)C1 ZINC001233120060 978469795 /nfs/dbraw/zinc/46/97/95/978469795.db2.gz UJMXMNOIUVRCNW-SECBINFHSA-N 1 2 237.253 2.246 20 0 BEADLO Fc1ccc2c(c1)n[nH]c2C[N@@H+]1CC[C@@H](F)C1 ZINC001233120060 978469799 /nfs/dbraw/zinc/46/97/99/978469799.db2.gz UJMXMNOIUVRCNW-SECBINFHSA-N 1 2 237.253 2.246 20 0 BEADLO C[C@H](C(=O)N1CCCC[C@H](C)C1)n1cc[nH+]c1 ZINC001177923030 978471867 /nfs/dbraw/zinc/47/18/67/978471867.db2.gz UDSFGIUSOJFEFY-NWDGAFQWSA-N 1 2 235.331 2.093 20 0 BEADLO C[C@H](C(=O)N1CCCC[C@@H](C)C1)n1cc[nH+]c1 ZINC001177923032 978475132 /nfs/dbraw/zinc/47/51/32/978475132.db2.gz UDSFGIUSOJFEFY-VXGBXAGGSA-N 1 2 235.331 2.093 20 0 BEADLO Cc1cc(C[N@@H+]2CCOCC2(C)C)cnc1C ZINC001233161673 978481618 /nfs/dbraw/zinc/48/16/18/978481618.db2.gz HMFSMVVRSXBFLI-UHFFFAOYSA-N 1 2 234.343 2.309 20 0 BEADLO Cc1cc(C[N@H+]2CCOCC2(C)C)cnc1C ZINC001233161673 978481626 /nfs/dbraw/zinc/48/16/26/978481626.db2.gz HMFSMVVRSXBFLI-UHFFFAOYSA-N 1 2 234.343 2.309 20 0 BEADLO Cc1cc(C[N@H+](C2CC2)C2COC2)cnc1C ZINC001233162162 978482697 /nfs/dbraw/zinc/48/26/97/978482697.db2.gz VBEDZLABKRKXJF-UHFFFAOYSA-N 1 2 232.327 2.062 20 0 BEADLO Cc1cc(C[N@@H+](C2CC2)C2COC2)cnc1C ZINC001233162162 978482703 /nfs/dbraw/zinc/48/27/03/978482703.db2.gz VBEDZLABKRKXJF-UHFFFAOYSA-N 1 2 232.327 2.062 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(=O)C(C)(C)C2)cnc1C ZINC001233161583 978483051 /nfs/dbraw/zinc/48/30/51/978483051.db2.gz FJCSTEKMSNYIMO-UHFFFAOYSA-N 1 2 246.354 2.499 20 0 BEADLO Cc1cc(C[N@H+]2CCC(=O)C(C)(C)C2)cnc1C ZINC001233161583 978483061 /nfs/dbraw/zinc/48/30/61/978483061.db2.gz FJCSTEKMSNYIMO-UHFFFAOYSA-N 1 2 246.354 2.499 20 0 BEADLO CC(C)N(C(=O)[C@@H]1CCc2[nH+]ccn2C1)C(C)C ZINC001178101548 978503689 /nfs/dbraw/zinc/50/36/89/978503689.db2.gz ZYBWEWIASBIDKJ-GFCCVEGCSA-N 1 2 249.358 2.091 20 0 BEADLO C[C@H]1CC(=O)CC[N@@H+]1Cc1cccc2c1CCO2 ZINC001233274663 978524217 /nfs/dbraw/zinc/52/42/17/978524217.db2.gz XVWYPSATMHIHFJ-NSHDSACASA-N 1 2 245.322 2.175 20 0 BEADLO C[C@H]1CC(=O)CC[N@H+]1Cc1cccc2c1CCO2 ZINC001233274663 978524223 /nfs/dbraw/zinc/52/42/23/978524223.db2.gz XVWYPSATMHIHFJ-NSHDSACASA-N 1 2 245.322 2.175 20 0 BEADLO Nc1cc(N2CCCc3sccc3C2)[nH+]cn1 ZINC001337851765 978527037 /nfs/dbraw/zinc/52/70/37/978527037.db2.gz RGIALAOWZVAYIC-UHFFFAOYSA-N 1 2 246.339 2.073 20 0 BEADLO CS[C@H]1CCN(c2cc(F)cc(C)[nH+]2)C1 ZINC001337896647 978555121 /nfs/dbraw/zinc/55/51/21/978555121.db2.gz ZCWMXBUPQITDFK-JTQLQIEISA-N 1 2 226.320 2.471 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@H](CO)[C@H]2C)[nH+]1 ZINC001337909541 978559477 /nfs/dbraw/zinc/55/94/77/978559477.db2.gz IIHUIOLGTDSXLT-GHMZBOCLSA-N 1 2 238.306 2.126 20 0 BEADLO CCOC(=O)c1ccnc(C[NH+]2CC(C)(C)C2)c1 ZINC001233323094 978562683 /nfs/dbraw/zinc/56/26/83/978562683.db2.gz FXMIRKZRSCTQSB-UHFFFAOYSA-N 1 2 248.326 2.100 20 0 BEADLO CN(C)c1ccc[nH+]c1Nc1ccccc1N ZINC001206331029 978571855 /nfs/dbraw/zinc/57/18/55/978571855.db2.gz HPZPJRDWFRXTLH-UHFFFAOYSA-N 1 2 228.299 2.473 20 0 BEADLO Cc1cc(F)cc(N2CC[C@@H](C(C)(C)O)C2)[nH+]1 ZINC001337953576 978574341 /nfs/dbraw/zinc/57/43/41/978574341.db2.gz AHYVHIGRKWVWHK-SNVBAGLBSA-N 1 2 238.306 2.126 20 0 BEADLO Cc1ncc(C[N@@H+]2CCC[C@H]2c2cnccn2)o1 ZINC001233367062 978578984 /nfs/dbraw/zinc/57/89/84/978578984.db2.gz IFTAYZIFIFDQQU-ZDUSSCGKSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1ncc(C[N@H+]2CCC[C@H]2c2cnccn2)o1 ZINC001233367062 978578990 /nfs/dbraw/zinc/57/89/90/978578990.db2.gz IFTAYZIFIFDQQU-ZDUSSCGKSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2cccnc2C)o1 ZINC001233368148 978579272 /nfs/dbraw/zinc/57/92/72/978579272.db2.gz ZQVYTDDADVOIDP-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2cccnc2C)o1 ZINC001233368148 978579277 /nfs/dbraw/zinc/57/92/77/978579277.db2.gz ZQVYTDDADVOIDP-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Nc1cccc(CN2Cc3ccc(F)cc3C2)[nH+]1 ZINC001233371988 978586331 /nfs/dbraw/zinc/58/63/31/978586331.db2.gz RHTRSQDFSZZAHW-UHFFFAOYSA-N 1 2 243.285 2.319 20 0 BEADLO C[N@H+](CCF)Cc1ccc(N)cc1Cl ZINC001233377593 978587017 /nfs/dbraw/zinc/58/70/17/978587017.db2.gz KYBZFOQFDXMMQR-UHFFFAOYSA-N 1 2 216.687 2.324 20 0 BEADLO C[N@@H+](CCF)Cc1ccc(N)cc1Cl ZINC001233377593 978587023 /nfs/dbraw/zinc/58/70/23/978587023.db2.gz KYBZFOQFDXMMQR-UHFFFAOYSA-N 1 2 216.687 2.324 20 0 BEADLO CCc1ccc(N2CCC([C@H](C)O)CC2)[nH+]c1 ZINC001338065163 978602571 /nfs/dbraw/zinc/60/25/71/978602571.db2.gz ZRFPQTLPMVXDNN-NSHDSACASA-N 1 2 234.343 2.241 20 0 BEADLO CCc1nc(C[NH2+]Cc2ccncc2C)co1 ZINC001178737548 978625685 /nfs/dbraw/zinc/62/56/85/978625685.db2.gz UNJWCLAKDPLMPM-UHFFFAOYSA-N 1 2 231.299 2.230 20 0 BEADLO COc1ccc(C[NH2+]Cc2cc(C)ccn2)o1 ZINC001179479715 978709555 /nfs/dbraw/zinc/70/95/55/978709555.db2.gz RKUNFALMDMORLE-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)C[C@H]1CCCCO1 ZINC001338993827 978768266 /nfs/dbraw/zinc/76/82/66/978768266.db2.gz XTIRMWIJRRVPHY-GFCCVEGCSA-N 1 2 248.326 2.018 20 0 BEADLO COC1(CC(=O)Nc2c(C)c[nH+]cc2C)CCC1 ZINC001339104088 978793995 /nfs/dbraw/zinc/79/39/95/978793995.db2.gz WPJSUYXMAOCHHK-UHFFFAOYSA-N 1 2 248.326 2.018 20 0 BEADLO CC(C)[C@H]1CCCCN1C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001339187444 978813718 /nfs/dbraw/zinc/81/37/18/978813718.db2.gz DYWPFKBMEZMAAR-CHWSQXEVSA-N 1 2 249.358 2.481 20 0 BEADLO CCc1ccc(N(C)Cc2cc[nH]n2)[nH+]c1 ZINC001339577248 978874220 /nfs/dbraw/zinc/87/42/20/978874220.db2.gz BBOIWVYXFJIMJC-UHFFFAOYSA-N 1 2 216.288 2.004 20 0 BEADLO Cc1cn2cccc(Nc3ccc[nH]c3=O)c2[nH+]1 ZINC001206423672 978904710 /nfs/dbraw/zinc/90/47/10/978904710.db2.gz ZKONZTMSOWXGRF-UHFFFAOYSA-N 1 2 240.266 2.487 20 0 BEADLO CCCn1c[nH+]cc1CN1CCC=C(F)C1 ZINC001180731756 978942649 /nfs/dbraw/zinc/94/26/49/978942649.db2.gz BQVMFSSUWIZJAU-UHFFFAOYSA-N 1 2 223.295 2.352 20 0 BEADLO Nc1cc(N2CCC[C@@H](C3CCCC3)C2)[nH+]cn1 ZINC001340014405 978956642 /nfs/dbraw/zinc/95/66/42/978956642.db2.gz AWCBWOWVAHAKTR-GFCCVEGCSA-N 1 2 246.358 2.465 20 0 BEADLO CCc1cc(N[C@@H]2C[C@@H]3CC[C@H]2O3)nc(CC)[nH+]1 ZINC001340129464 978973677 /nfs/dbraw/zinc/97/36/77/978973677.db2.gz WSZJWXVFUIXKOF-QJPTWQEYSA-N 1 2 247.342 2.333 20 0 BEADLO CCc1cccc(C[N@@H+]2CCOCC2(C)C)n1 ZINC001235259266 979009023 /nfs/dbraw/zinc/00/90/23/979009023.db2.gz WHSKWMUJODNHSQ-UHFFFAOYSA-N 1 2 234.343 2.255 20 0 BEADLO CCc1cccc(C[N@H+]2CCOCC2(C)C)n1 ZINC001235259266 979009025 /nfs/dbraw/zinc/00/90/25/979009025.db2.gz WHSKWMUJODNHSQ-UHFFFAOYSA-N 1 2 234.343 2.255 20 0 BEADLO CC[C@@H](C)C[C@@H](C)NC(=O)Cc1cc[nH+]c(N)c1 ZINC001181265711 979029737 /nfs/dbraw/zinc/02/97/37/979029737.db2.gz RQPLUXJFEZDHMS-GHMZBOCLSA-N 1 2 249.358 2.147 20 0 BEADLO CO[C@@H]1CC[N@H+](Cc2cncc(F)c2Cl)C1 ZINC001235488157 979053192 /nfs/dbraw/zinc/05/31/92/979053192.db2.gz IXTFVARXESFZDT-SECBINFHSA-N 1 2 244.697 2.095 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2cncc(F)c2Cl)C1 ZINC001235488157 979053201 /nfs/dbraw/zinc/05/32/01/979053201.db2.gz IXTFVARXESFZDT-SECBINFHSA-N 1 2 244.697 2.095 20 0 BEADLO Cc1ncn(C)c1C[N@@H+]1CCn2cccc2[C@H]1C ZINC001235550796 979091968 /nfs/dbraw/zinc/09/19/68/979091968.db2.gz YGYHKRMBZSCWBX-GFCCVEGCSA-N 1 2 244.342 2.107 20 0 BEADLO Cc1ncn(C)c1C[N@H+]1CCn2cccc2[C@H]1C ZINC001235550796 979091978 /nfs/dbraw/zinc/09/19/78/979091978.db2.gz YGYHKRMBZSCWBX-GFCCVEGCSA-N 1 2 244.342 2.107 20 0 BEADLO Cn1c[nH+]cc1COc1cnc(F)cc1Cl ZINC001340948776 979172071 /nfs/dbraw/zinc/17/20/71/979172071.db2.gz OMJFJCGXBPDORG-UHFFFAOYSA-N 1 2 241.653 2.187 20 0 BEADLO CCOc1cc(/C(C)=C/C=C/[NH3+])c(F)cn1 ZINC001235872501 979174483 /nfs/dbraw/zinc/17/44/83/979174483.db2.gz FHSGPTBHGQFNJL-REZHQCRGSA-N 1 2 222.263 2.495 20 0 BEADLO C[C@H]1CN(Cc2ccc(S)cc2)[C@@H](C)C[NH2+]1 ZINC001236078276 979364631 /nfs/dbraw/zinc/36/46/31/979364631.db2.gz AOFHADDGQNLZIT-QWRGUYRKSA-N 1 2 236.384 2.158 20 0 BEADLO Sc1ccc(CN2C[C@H]3CCC[C@@H](C2)[NH2+]3)cc1 ZINC001236093057 979384628 /nfs/dbraw/zinc/38/46/28/979384628.db2.gz MKHWQPZPCGNJGN-BETUJISGSA-N 1 2 248.395 2.302 20 0 BEADLO Cc1cnn(C)c1Nc1ccc(C)[nH+]c1C ZINC001203370663 979473746 /nfs/dbraw/zinc/47/37/46/979473746.db2.gz RZBZNBMPKXWDOE-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO Nc1ccc(-c2ccc3c(c2)CCC(=O)N3)c[nH+]1 ZINC001236312400 979517444 /nfs/dbraw/zinc/51/74/44/979517444.db2.gz OVVOUURDSFWOBY-UHFFFAOYSA-N 1 2 239.278 2.216 20 0 BEADLO Nc1ccc(-c2cccc(-c3nc[nH]n3)c2)c[nH+]1 ZINC001236313119 979519718 /nfs/dbraw/zinc/51/97/18/979519718.db2.gz GYPBFZIQYOVKMS-UHFFFAOYSA-N 1 2 237.266 2.116 20 0 BEADLO Nc1ccc(-c2ccc3c(c2)COC3=O)c[nH+]1 ZINC001236313337 979520911 /nfs/dbraw/zinc/52/09/11/979520911.db2.gz OMSGGYOBHJOSCB-UHFFFAOYSA-N 1 2 226.235 2.001 20 0 BEADLO c1cc2c[nH+]c(C3=CCSCC3)nc2[nH]1 ZINC001236357596 979554122 /nfs/dbraw/zinc/55/41/22/979554122.db2.gz DLIJNYPNEUTMLE-UHFFFAOYSA-N 1 2 217.297 2.430 20 0 BEADLO Nc1cn2ccc(C3=CCSCC3)cc2[nH+]1 ZINC001236368695 979565478 /nfs/dbraw/zinc/56/54/78/979565478.db2.gz YDDJBNOKWZTFRB-UHFFFAOYSA-N 1 2 231.324 2.437 20 0 BEADLO Cc1cccc(O)c1NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001341944752 979599238 /nfs/dbraw/zinc/59/92/38/979599238.db2.gz IWNNIEANORJWTG-SNVBAGLBSA-N 1 2 245.282 2.097 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1cncc(O)c1 ZINC001236581366 979658752 /nfs/dbraw/zinc/65/87/52/979658752.db2.gz VONMHOSJFNDWLJ-UHFFFAOYSA-N 1 2 229.283 2.224 20 0 BEADLO COc1ccc2sc(C[NH+]3CC(O)C3)cc2c1 ZINC001236656210 979689599 /nfs/dbraw/zinc/68/95/99/979689599.db2.gz PPHBKWWJYAAKKE-UHFFFAOYSA-N 1 2 249.335 2.086 20 0 BEADLO CCOc1ncc(C[N@@H+]2CC[C@@H]2C)cc1F ZINC001236694005 979691290 /nfs/dbraw/zinc/69/12/90/979691290.db2.gz XIZASLLQRTVXTA-VIFPVBQESA-N 1 2 224.279 2.214 20 0 BEADLO CCOc1ncc(C[N@H+]2CC[C@@H]2C)cc1F ZINC001236694005 979691298 /nfs/dbraw/zinc/69/12/98/979691298.db2.gz XIZASLLQRTVXTA-VIFPVBQESA-N 1 2 224.279 2.214 20 0 BEADLO N#CN1CC[NH+](Cc2cccc3occc32)CC1 ZINC001236747652 979720946 /nfs/dbraw/zinc/72/09/46/979720946.db2.gz ZDJCQJABOCKRBS-UHFFFAOYSA-N 1 2 241.294 2.031 20 0 BEADLO FC[C@@H]1C[C@H](F)C[N@@H+]1CC1OC=CC1=S ZINC001237182820 979831296 /nfs/dbraw/zinc/83/12/96/979831296.db2.gz UPPLEPANFANYMU-YUMQZZPRSA-N 1 2 233.283 2.450 20 0 BEADLO FC[C@@H]1C[C@H](F)C[N@H+]1CC1OC=CC1=S ZINC001237182820 979831298 /nfs/dbraw/zinc/83/12/98/979831298.db2.gz UPPLEPANFANYMU-YUMQZZPRSA-N 1 2 233.283 2.450 20 0 BEADLO C[C@H]1CC(=O)CC[N@@H+]1CC1OC=CC1=S ZINC001237181012 979832185 /nfs/dbraw/zinc/83/21/85/979832185.db2.gz LGFZUDMVLOVFEP-QMMMGPOBSA-N 1 2 225.313 2.122 20 0 BEADLO C[C@H]1CC(=O)CC[N@H+]1CC1OC=CC1=S ZINC001237181012 979832190 /nfs/dbraw/zinc/83/21/90/979832190.db2.gz LGFZUDMVLOVFEP-QMMMGPOBSA-N 1 2 225.313 2.122 20 0 BEADLO CC1C[NH+](Cc2cnccc2Br)C1 ZINC001237384559 979880536 /nfs/dbraw/zinc/88/05/36/979880536.db2.gz IENVQUUNNQQDRU-UHFFFAOYSA-N 1 2 241.132 2.296 20 0 BEADLO C[C@@H]1C[C@@H]2C[C@@H]2C[C@H]1C(=O)OCc1c[nH+]cn1C ZINC001342801872 979899114 /nfs/dbraw/zinc/89/91/14/979899114.db2.gz DJHAIORXLYKPLW-PRULPYPASA-N 1 2 248.326 2.146 20 0 BEADLO CC(C)c1cccc(C[NH+]2CCN(C#N)CC2)c1 ZINC001237458491 979902370 /nfs/dbraw/zinc/90/23/70/979902370.db2.gz BWHQJKODENYLFR-UHFFFAOYSA-N 1 2 243.354 2.409 20 0 BEADLO COc1c(C)cccc1C[N@@H+]1CCC(=O)[C@@H](C)C1 ZINC001237500336 979922230 /nfs/dbraw/zinc/92/22/30/979922230.db2.gz JIHVQSJMMZUZPL-LBPRGKRZSA-N 1 2 247.338 2.415 20 0 BEADLO COc1c(C)cccc1C[N@H+]1CCC(=O)[C@@H](C)C1 ZINC001237500336 979922245 /nfs/dbraw/zinc/92/22/45/979922245.db2.gz JIHVQSJMMZUZPL-LBPRGKRZSA-N 1 2 247.338 2.415 20 0 BEADLO CC(C)[C@@H]1CCN(c2nccn3c[nH+]cc23)C1 ZINC001342913705 979938205 /nfs/dbraw/zinc/93/82/05/979938205.db2.gz IMELZGJJJAPPOQ-LLVKDONJSA-N 1 2 230.315 2.212 20 0 BEADLO CCn1c[nH+]cc1CN1CC[C@@](C)(F)[C@H](F)C1 ZINC001237587714 979943980 /nfs/dbraw/zinc/94/39/80/979943980.db2.gz HWISBLPRUYOJDX-VXGBXAGGSA-N 1 2 243.301 2.175 20 0 BEADLO Cc1ccccc1[C@H]1CCC[N@@H+]1Cc1nnc[nH]1 ZINC001237600803 979955007 /nfs/dbraw/zinc/95/50/07/979955007.db2.gz TWJBLIKJYJSLPX-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1nnc[nH]1 ZINC001237600803 979955009 /nfs/dbraw/zinc/95/50/09/979955009.db2.gz TWJBLIKJYJSLPX-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1coc(C[NH+]2CCC(C(F)F)CC2)n1 ZINC001237648371 979998002 /nfs/dbraw/zinc/99/80/02/979998002.db2.gz GRQHUFUHXWAAAN-UHFFFAOYSA-N 1 2 230.258 2.460 20 0 BEADLO Cc1c(Cl)cccc1C[N@@H+]1C[C@@H](O)[C@@H](F)C1 ZINC001237728186 980039434 /nfs/dbraw/zinc/03/94/34/980039434.db2.gz GFRDINSRRHHNMD-NWDGAFQWSA-N 1 2 243.709 2.163 20 0 BEADLO Cc1c(Cl)cccc1C[N@H+]1C[C@@H](O)[C@@H](F)C1 ZINC001237728186 980039443 /nfs/dbraw/zinc/03/94/43/980039443.db2.gz GFRDINSRRHHNMD-NWDGAFQWSA-N 1 2 243.709 2.163 20 0 BEADLO COC(=O)CCCc1c[nH+]c(C)cc1C ZINC001250146864 980046388 /nfs/dbraw/zinc/04/63/88/980046388.db2.gz HXKSXKXWJQOLCS-UHFFFAOYSA-N 1 2 207.273 2.194 20 0 BEADLO COc1ccc(C[NH+]2CC(C)C2)c(Cl)n1 ZINC001237792477 980048163 /nfs/dbraw/zinc/04/81/63/980048163.db2.gz RETNYLRIUDLQEW-UHFFFAOYSA-N 1 2 226.707 2.195 20 0 BEADLO CCc1nc(OC)ccc1Nc1[nH+]cccc1N ZINC001203587084 980066446 /nfs/dbraw/zinc/06/64/46/980066446.db2.gz RHBXHUOVGRCRET-UHFFFAOYSA-N 1 2 244.298 2.373 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)s1 ZINC001237822677 980073991 /nfs/dbraw/zinc/07/39/91/980073991.db2.gz FLKDMOBBHJYQGX-INTQDDNPSA-N 1 2 240.347 2.495 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)s1 ZINC001237822677 980074001 /nfs/dbraw/zinc/07/40/01/980074001.db2.gz FLKDMOBBHJYQGX-INTQDDNPSA-N 1 2 240.347 2.495 20 0 BEADLO Cc1cc(C[N@@H+]2CCCc3occc3C2)[nH]n1 ZINC001343364090 980082301 /nfs/dbraw/zinc/08/23/01/980082301.db2.gz BNQLURAPQYMGIR-UHFFFAOYSA-N 1 2 231.299 2.260 20 0 BEADLO Cc1cc(C[N@H+]2CCCc3occc3C2)[nH]n1 ZINC001343364090 980082310 /nfs/dbraw/zinc/08/23/10/980082310.db2.gz BNQLURAPQYMGIR-UHFFFAOYSA-N 1 2 231.299 2.260 20 0 BEADLO CC[N@H+](Cc1ccsc1C)[C@@H](C)C(=O)OC ZINC001237977118 980121982 /nfs/dbraw/zinc/12/19/82/980121982.db2.gz WNHBVHAOFICVHB-VIFPVBQESA-N 1 2 241.356 2.440 20 0 BEADLO Cc1ccc(O)cc1C[N@H+]1CCC(=O)C[C@H]1C ZINC001238096353 980147580 /nfs/dbraw/zinc/14/75/80/980147580.db2.gz RRGRWEYLQPDUQA-LLVKDONJSA-N 1 2 233.311 2.254 20 0 BEADLO Cc1ccc(O)cc1C[N@@H+]1CCC(=O)C[C@H]1C ZINC001238096353 980147584 /nfs/dbraw/zinc/14/75/84/980147584.db2.gz RRGRWEYLQPDUQA-LLVKDONJSA-N 1 2 233.311 2.254 20 0 BEADLO Cn1c[nH+]cc1CCCOC(=O)[C@H]1CC=CCC1 ZINC001343723747 980221300 /nfs/dbraw/zinc/22/13/00/980221300.db2.gz AMTFEJAGUSGZLM-LBPRGKRZSA-N 1 2 248.326 2.252 20 0 BEADLO Cc1ccc(C[C@H]2COC(C)(C)O2)c(C)[nH+]1 ZINC001250186106 980226985 /nfs/dbraw/zinc/22/69/85/980226985.db2.gz OUMBZKYYPKAZRM-LBPRGKRZSA-N 1 2 221.300 2.392 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2cnccn2)c(C)c1 ZINC001238434065 980261463 /nfs/dbraw/zinc/26/14/63/980261463.db2.gz ZHEGZMUAANDHOQ-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2cnccn2)c(C)c1 ZINC001238434065 980261470 /nfs/dbraw/zinc/26/14/70/980261470.db2.gz ZHEGZMUAANDHOQ-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cnc(C[N@H+](C2CC2)C2COC2)c(C)c1 ZINC001238440930 980265008 /nfs/dbraw/zinc/26/50/08/980265008.db2.gz MIGOUFGANFCCQZ-UHFFFAOYSA-N 1 2 232.327 2.062 20 0 BEADLO Cc1cnc(C[N@@H+](C2CC2)C2COC2)c(C)c1 ZINC001238440930 980265022 /nfs/dbraw/zinc/26/50/22/980265022.db2.gz MIGOUFGANFCCQZ-UHFFFAOYSA-N 1 2 232.327 2.062 20 0 BEADLO COc1c(C[NH+]2CCC2)ccc(F)c1F ZINC001238472879 980274928 /nfs/dbraw/zinc/27/49/28/980274928.db2.gz CJDMCIXXKKROOA-UHFFFAOYSA-N 1 2 213.227 2.179 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1cnc(C2CC2)c(C)c1 ZINC001238619866 980302712 /nfs/dbraw/zinc/30/27/12/980302712.db2.gz KWTSSBHLVOXQRJ-UHFFFAOYSA-N 1 2 232.327 2.288 20 0 BEADLO CC(=O)C[N@H+](C)Cc1cnc(C2CC2)c(C)c1 ZINC001238619866 980302719 /nfs/dbraw/zinc/30/27/19/980302719.db2.gz KWTSSBHLVOXQRJ-UHFFFAOYSA-N 1 2 232.327 2.288 20 0 BEADLO CC(C)[C@@H]1N(C(=O)[C@@H](C)n2cc[nH+]c2)CC1(C)C ZINC001343998054 980308520 /nfs/dbraw/zinc/30/85/20/980308520.db2.gz PWXICBKEUQRIPF-NEPJUHHUSA-N 1 2 249.358 2.337 20 0 BEADLO Cc1c(/C=C/C(C)(C)O)ccc2[nH+]ccn21 ZINC001239162163 980477052 /nfs/dbraw/zinc/47/70/52/980477052.db2.gz ZGWGXPVXOMSEQG-VOTSOKGWSA-N 1 2 216.284 2.427 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2cccc(CO)n2)c1 ZINC001203656989 980491970 /nfs/dbraw/zinc/49/19/70/980491970.db2.gz GCEBUUAVRIWOLQ-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO CCn1c[nH+]cc1COC(=O)C[C@H](C)C1CC1 ZINC001344971232 980510737 /nfs/dbraw/zinc/51/07/37/980510737.db2.gz HUWHRUYKWNQMQY-JTQLQIEISA-N 1 2 236.315 2.382 20 0 BEADLO C[C@@H](C[N@@H+]1CCC(=O)[C@@H](C)C1)C(F)(F)F ZINC000335059021 980526493 /nfs/dbraw/zinc/52/64/93/980526493.db2.gz BAYPJQMPOBSGBC-YUMQZZPRSA-N 1 2 223.238 2.096 20 0 BEADLO C[C@@H](C[N@H+]1CCC(=O)[C@@H](C)C1)C(F)(F)F ZINC000335059021 980526501 /nfs/dbraw/zinc/52/65/01/980526501.db2.gz BAYPJQMPOBSGBC-YUMQZZPRSA-N 1 2 223.238 2.096 20 0 BEADLO CCC[N@@H+]1CCCC[C@@H]1C(=O)OCC(C)(F)F ZINC001345066151 980537158 /nfs/dbraw/zinc/53/71/58/980537158.db2.gz HEKAVDUUFMXPSW-SNVBAGLBSA-N 1 2 249.301 2.449 20 0 BEADLO CCC[N@H+]1CCCC[C@@H]1C(=O)OCC(C)(F)F ZINC001345066151 980537162 /nfs/dbraw/zinc/53/71/62/980537162.db2.gz HEKAVDUUFMXPSW-SNVBAGLBSA-N 1 2 249.301 2.449 20 0 BEADLO Cc1c[nH]cc1C(=O)Nc1cccc2[nH+]ccn21 ZINC001187792690 980551449 /nfs/dbraw/zinc/55/14/49/980551449.db2.gz KQQPILWRZXMRAV-UHFFFAOYSA-N 1 2 240.266 2.223 20 0 BEADLO c1cn2cccc(Nc3cnoc3)c2[nH+]1 ZINC001203233225 980575564 /nfs/dbraw/zinc/57/55/64/980575564.db2.gz UTFRAHOTRKWDRZ-UHFFFAOYSA-N 1 2 200.201 2.066 20 0 BEADLO C[C@H](C(=O)OCC(C)(C)n1cc[nH+]c1)C1CC1 ZINC001345250574 980590883 /nfs/dbraw/zinc/59/08/83/980590883.db2.gz DFRIBACQMHCCRR-JTQLQIEISA-N 1 2 236.315 2.208 20 0 BEADLO COc1cc(-n2cc[nH+]c2)ccc1C1=CCOC1 ZINC001239495343 980655199 /nfs/dbraw/zinc/65/51/99/980655199.db2.gz ROOXVRAYBMTFRK-UHFFFAOYSA-N 1 2 242.278 2.295 20 0 BEADLO COc1ncc(/C(C)=C/C=C/[NH3+])cc1F ZINC001239512744 980683987 /nfs/dbraw/zinc/68/39/87/980683987.db2.gz QKVLIVPCJBFSRQ-MSLMYCKWSA-N 1 2 208.236 2.105 20 0 BEADLO CC(=O)Nc1cccc(-c2c[nH+]cn2C)c1 ZINC001239528660 980702683 /nfs/dbraw/zinc/70/26/83/980702683.db2.gz OSQRMSOXKHOCSG-UHFFFAOYSA-N 1 2 215.256 2.046 20 0 BEADLO C[C@@H](c1nnc(C[NH+](C)C)o1)C(C)(C)C ZINC001345940931 980713730 /nfs/dbraw/zinc/71/37/30/980713730.db2.gz HLTWIMIZPFQAIM-QMMMGPOBSA-N 1 2 211.309 2.281 20 0 BEADLO COc1ccc(CCn2cc[nH+]c2)cc1C ZINC001250315502 980752766 /nfs/dbraw/zinc/75/27/66/980752766.db2.gz NVTISNDWOSPBRN-UHFFFAOYSA-N 1 2 216.284 2.443 20 0 BEADLO Cn1cc2ccc(CCn3cc[nH+]c3)cc2n1 ZINC001250316806 980759016 /nfs/dbraw/zinc/75/90/16/980759016.db2.gz ZBNVUPYHEFVHSK-UHFFFAOYSA-N 1 2 226.283 2.013 20 0 BEADLO Nc1ccc(CCn2cc[nH+]c2)c(Cl)c1 ZINC001250320822 980763007 /nfs/dbraw/zinc/76/30/07/980763007.db2.gz QELQCSSTSMQBMV-UHFFFAOYSA-N 1 2 221.691 2.361 20 0 BEADLO Cc1ccc(CCn2cc[nH+]c2)c2c[nH]nc21 ZINC001250320825 980763166 /nfs/dbraw/zinc/76/31/66/980763166.db2.gz QGYBETOWNIZLRQ-UHFFFAOYSA-N 1 2 226.283 2.311 20 0 BEADLO CN(c1ccc2c(c1)OCO2)c1[nH+]cccc1N ZINC000077392457 980870461 /nfs/dbraw/zinc/87/04/61/980870461.db2.gz YFKGSOXQWXYDTP-UHFFFAOYSA-N 1 2 243.266 2.160 20 0 BEADLO CCC/C=C/C(=O)OCc1c[nH+]cn1CC ZINC001346746901 980898370 /nfs/dbraw/zinc/89/83/70/980898370.db2.gz HVNKEKCHHBIOIV-VOTSOKGWSA-N 1 2 222.288 2.303 20 0 BEADLO COc1ncc(-c2cc(C)cn3cc[nH+]c23)cn1 ZINC001239846756 980985550 /nfs/dbraw/zinc/98/55/50/980985550.db2.gz VJUHIRGNNDAFKD-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO COc1ncc(-c2ccc3[nH+]ccn3c2C)cn1 ZINC001239849492 980989555 /nfs/dbraw/zinc/98/95/55/980989555.db2.gz JNWZVGHRLLWCIJ-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO Cc1cc(-c2ccc(C(N)=O)cc2)cc(C)[nH+]1 ZINC001239870450 981010015 /nfs/dbraw/zinc/01/00/15/981010015.db2.gz GYJJYPORAVJMEV-UHFFFAOYSA-N 1 2 226.279 2.464 20 0 BEADLO NC(=O)c1ccc(-c2ccc3[nH+]ccn3c2)cc1 ZINC001239870858 981012374 /nfs/dbraw/zinc/01/23/74/981012374.db2.gz CETPQISGNAFZNL-UHFFFAOYSA-N 1 2 237.262 2.100 20 0 BEADLO CC1(NC(=O)Nc2ccc3[nH+]ccn3c2)CC1 ZINC001347323606 981046656 /nfs/dbraw/zinc/04/66/56/981046656.db2.gz RFZGUDYXNZQHGY-UHFFFAOYSA-N 1 2 230.271 2.008 20 0 BEADLO CCCCc1[nH]c2cc3c(cc2[nH+]1)OCC(=O)N3 ZINC001250427025 981064233 /nfs/dbraw/zinc/06/42/33/981064233.db2.gz LJERACGUSXWEIW-UHFFFAOYSA-N 1 2 245.282 2.236 20 0 BEADLO c1c2c(cc3[nH+]c([C@@H]4CCOC4)[nH]c13)OCC2 ZINC001250432807 981078851 /nfs/dbraw/zinc/07/88/51/981078851.db2.gz AJVFAWGPPDVTGC-SECBINFHSA-N 1 2 230.267 2.002 20 0 BEADLO Cc1ccncc1-c1cc[nH+]c2c1CCN2 ZINC001239977244 981083635 /nfs/dbraw/zinc/08/36/35/981083635.db2.gz RPRAKDKEQVVOHX-UHFFFAOYSA-N 1 2 211.268 2.420 20 0 BEADLO Nc1cn2ccc(-c3ccc4n[nH]cc4c3)cc2[nH+]1 ZINC001240208698 981155363 /nfs/dbraw/zinc/15/53/63/981155363.db2.gz CMWSWNXQSQFRMA-UHFFFAOYSA-N 1 2 249.277 2.460 20 0 BEADLO Cc1cncnc1-c1ccc2[nH+]ccn2c1 ZINC001240213736 981161341 /nfs/dbraw/zinc/16/13/41/981161341.db2.gz CUVBTMYIHSGPDP-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO Cc1cc(-c2ccc3[nH+]ccn3c2)n(C)n1 ZINC001240217799 981168116 /nfs/dbraw/zinc/16/81/16/981168116.db2.gz WVFLZRHXIQUAIF-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO Cc1cc(-c2ccc3[nH+]ccn3c2)cc(=O)o1 ZINC001240218773 981170355 /nfs/dbraw/zinc/17/03/55/981170355.db2.gz YULKJVOJYAIWOC-UHFFFAOYSA-N 1 2 226.235 2.263 20 0 BEADLO COc1cnccc1-c1ccc2[nH+]ccn2c1 ZINC001240219408 981171030 /nfs/dbraw/zinc/17/10/30/981171030.db2.gz LAGQMKPTBYWGJU-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO CNc1cc(-c2ccc3[nH+]ccn3c2)ccn1 ZINC001240219079 981171627 /nfs/dbraw/zinc/17/16/27/981171627.db2.gz YAGBLSUNLJAZAJ-UHFFFAOYSA-N 1 2 224.267 2.438 20 0 BEADLO CCOc1cnc(-c2ccc3[nH+]ccn3c2)cn1 ZINC001240219041 981171750 /nfs/dbraw/zinc/17/17/50/981171750.db2.gz WDPVREUZXONDMP-UHFFFAOYSA-N 1 2 240.266 2.190 20 0 BEADLO C[NH+](C)Cc1c(F)cc(-c2cn[nH]c2)cc1F ZINC001240243604 981219362 /nfs/dbraw/zinc/21/93/62/981219362.db2.gz LVGKAACXGDDHMI-UHFFFAOYSA-N 1 2 237.253 2.417 20 0 BEADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cn[nH]c1 ZINC001240243346 981221292 /nfs/dbraw/zinc/22/12/92/981221292.db2.gz GDKPTDUWHSZORT-UHFFFAOYSA-N 1 2 240.266 2.271 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1cnn(C)c1 ZINC001240295470 981245675 /nfs/dbraw/zinc/24/56/75/981245675.db2.gz VLVBIOLJGRHZCS-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO CCc1ccc(N2CCO[C@@H](C)[C@@H]2C)[nH+]c1 ZINC001348041692 981259035 /nfs/dbraw/zinc/25/90/35/981259035.db2.gz CGGKIOFVJXXAQN-QWRGUYRKSA-N 1 2 220.316 2.258 20 0 BEADLO Cc1nn(C)cc1-c1cccc2[nH+]ccn21 ZINC001240300663 981260547 /nfs/dbraw/zinc/26/05/47/981260547.db2.gz PKBYMGXOUHZJQY-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO Cc1nn(C)cc1-c1cn2cc[nH+]c2cc1C ZINC001240302462 981267987 /nfs/dbraw/zinc/26/79/87/981267987.db2.gz KCUMCVRIOCJLON-UHFFFAOYSA-N 1 2 226.283 2.352 20 0 BEADLO C[C@@H]1CN(c2cc(N)nc[nH+]2)[C@H]2CCCC[C@@H]12 ZINC001348084417 981275429 /nfs/dbraw/zinc/27/54/29/981275429.db2.gz OJFIMZGRCOGLTM-VWYCJHECSA-N 1 2 232.331 2.074 20 0 BEADLO Cn1cc[nH+]c1CCCOC(=O)[C@@]1(C)C=CCC1 ZINC001348127640 981290464 /nfs/dbraw/zinc/29/04/64/981290464.db2.gz HYLGAFLEOZTKTP-AWEZNQCLSA-N 1 2 248.326 2.252 20 0 BEADLO Cn1cnc2ccc(-c3ccc[nH+]c3N)cc21 ZINC001240318800 981290568 /nfs/dbraw/zinc/29/05/68/981290568.db2.gz MPKNVHDITBVBLY-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO Cc1cn2c(cccc2-c2cncnc2)[nH+]1 ZINC001240374571 981321204 /nfs/dbraw/zinc/32/12/04/981321204.db2.gz VJJBAUBTEZALKP-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO Cc1[nH]c(CNc2ncc(Cl)cn2)[nH+]c1C ZINC001348312656 981331287 /nfs/dbraw/zinc/33/12/87/981331287.db2.gz SBTMYCSMDAYENZ-UHFFFAOYSA-N 1 2 237.694 2.082 20 0 BEADLO Cc1cc(NCC(C)(C)[C@H](C)O)nc(C2CC2)[nH+]1 ZINC001348388012 981352071 /nfs/dbraw/zinc/35/20/71/981352071.db2.gz QPSKIAGNUADFDI-JTQLQIEISA-N 1 2 249.358 2.481 20 0 BEADLO C[NH+](C)Cc1nnc([C@H]2CCCC23CC3)o1 ZINC001348437669 981364359 /nfs/dbraw/zinc/36/43/59/981364359.db2.gz YPBQXAULQYQKRF-SECBINFHSA-N 1 2 221.304 2.179 20 0 BEADLO c1cc2ncc(-c3ccc4[nH+]ccn4c3)cn2n1 ZINC001240429183 981379791 /nfs/dbraw/zinc/37/97/91/981379791.db2.gz PJIRROKTVYXZRU-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO Cc1cn2c(cccc2-c2cnc3ccnn3c2)[nH+]1 ZINC001240429589 981381038 /nfs/dbraw/zinc/38/10/38/981381038.db2.gz SKSHJPIUTFEDJP-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO Cc1cc(-c2ccn3cc[nH+]c3c2)nc(C)n1 ZINC001240495878 981415328 /nfs/dbraw/zinc/41/53/28/981415328.db2.gz AXPFPKFSIQYWFQ-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO c1cn2ccc(-c3cc4cncnc4cn3)cc2[nH+]1 ZINC001240497236 981418595 /nfs/dbraw/zinc/41/85/95/981418595.db2.gz OGODYUWUZKMEBX-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO Cc1ncc(-c2ccn3cc[nH+]c3c2)nc1C ZINC001240496401 981419064 /nfs/dbraw/zinc/41/90/64/981419064.db2.gz NJDWFQOZVQWEBX-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO C[C@H](NC(=O)CCc1[nH+]ccn1C)C1CCCC1 ZINC001348717736 981426645 /nfs/dbraw/zinc/42/66/45/981426645.db2.gz SEOAHQMPFOLJMA-NSHDSACASA-N 1 2 249.358 2.048 20 0 BEADLO c1cn2ccnc(-c3ccn4cc[nH+]c4c3)c2n1 ZINC001240510106 981433012 /nfs/dbraw/zinc/43/30/12/981433012.db2.gz BKFHGXAUXHSWKW-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO Cn1ccc2nc(-c3ccn4cc[nH+]c4c3)cnc21 ZINC001240508874 981433284 /nfs/dbraw/zinc/43/32/84/981433284.db2.gz NSNLMJPBDQZAMU-UHFFFAOYSA-N 1 2 249.277 2.283 20 0 BEADLO Nc1cn2ccc(-c3ccn4ccnc4c3)cc2[nH+]1 ZINC001240508618 981433292 /nfs/dbraw/zinc/43/32/92/981433292.db2.gz FUEXRZOFRFESBK-UHFFFAOYSA-N 1 2 249.277 2.231 20 0 BEADLO c1cn2nc(-c3ccn4cc[nH+]c4c3)ccc2n1 ZINC001240509137 981434995 /nfs/dbraw/zinc/43/49/95/981434995.db2.gz SDAJSRDPVFSEAN-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO Nc1ccc(-c2cc[nH+]c3c2CCN3)c(F)c1 ZINC001240529547 981467631 /nfs/dbraw/zinc/46/76/31/981467631.db2.gz DEPYCRHFXLWUHH-UHFFFAOYSA-N 1 2 229.258 2.081 20 0 BEADLO c1cc2c[nH+]c(-c3ccc4c[nH]nc4c3)nc2[nH]1 ZINC001240553298 981470268 /nfs/dbraw/zinc/47/02/68/981470268.db2.gz QQQFTWMSZLNPLL-UHFFFAOYSA-N 1 2 235.250 2.453 20 0 BEADLO Nc1cn2ccc(-c3ccc4c[nH]nc4c3)cc2[nH+]1 ZINC001240557049 981478278 /nfs/dbraw/zinc/47/82/78/981478278.db2.gz LDMKFEXRTGBQND-UHFFFAOYSA-N 1 2 249.277 2.460 20 0 BEADLO CC(C)(COC(=O)CC1(C)CC1)n1cc[nH+]c1 ZINC001349024494 981497702 /nfs/dbraw/zinc/49/77/02/981497702.db2.gz UUXWBIFPTWLHMS-UHFFFAOYSA-N 1 2 236.315 2.352 20 0 BEADLO COc1cc(/C(C)=C/C=C/[NH3+])ccc1O ZINC001240614104 981512985 /nfs/dbraw/zinc/51/29/85/981512985.db2.gz HTSIUQKJWDKUPN-DDEWIXKASA-N 1 2 205.257 2.277 20 0 BEADLO C[C@@H](CCC1CC1)NC(=O)CCc1[nH+]ccn1C ZINC001349445420 981558656 /nfs/dbraw/zinc/55/86/56/981558656.db2.gz ZBRQWWQXURGFHU-NSHDSACASA-N 1 2 249.358 2.048 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cncc(C(C)(C)O)c1 ZINC001240667671 981569496 /nfs/dbraw/zinc/56/94/96/981569496.db2.gz CXKIJTBXGWNTDD-GQYICFGZSA-N 1 2 218.300 2.185 20 0 BEADLO Nc1[nH+]cccc1-c1cnn([C@H]2CCCCO2)c1 ZINC001240674664 981582501 /nfs/dbraw/zinc/58/25/01/981582501.db2.gz GZUCZBLRPDQHCD-GFCCVEGCSA-N 1 2 244.298 2.226 20 0 BEADLO C[NH+](C)Cc1nnc(CC2(C)CCCC2)o1 ZINC001349984500 981836916 /nfs/dbraw/zinc/83/69/16/981836916.db2.gz BDUIWLCKJPPAIW-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO Cc1cc(CNC(=O)c2cccnc2)cc(C)[nH+]1 ZINC001584183465 981857770 /nfs/dbraw/zinc/85/77/70/981857770.db2.gz GRBDXWJXQKWOEP-UHFFFAOYSA-N 1 2 241.294 2.023 20 0 BEADLO Cc1cc(-c2cc(C)cn3cc[nH+]c23)n(C)n1 ZINC001240858390 981895555 /nfs/dbraw/zinc/89/55/55/981895555.db2.gz KGXYKNTVQMYCMS-UHFFFAOYSA-N 1 2 226.283 2.352 20 0 BEADLO Cc1cc(-c2ccc3[nH+]c(C)cn3c2)n(C)n1 ZINC001240858635 981897178 /nfs/dbraw/zinc/89/71/78/981897178.db2.gz SEVOGRIAGHWKRB-UHFFFAOYSA-N 1 2 226.283 2.352 20 0 BEADLO c1cc2c[nH+]c(-c3ccc4c(c3)OCO4)nc2[nH]1 ZINC001240896671 981945939 /nfs/dbraw/zinc/94/59/39/981945939.db2.gz PUSGHNNPFJGTCS-UHFFFAOYSA-N 1 2 239.234 2.305 20 0 BEADLO C[C@H](Cc1cccc(F)c1)[N@H+](C)Cc1nnc[nH]1 ZINC001350376740 981953979 /nfs/dbraw/zinc/95/39/79/981953979.db2.gz LPNSPHKFDIZCSN-SNVBAGLBSA-N 1 2 248.305 2.007 20 0 BEADLO C[C@H](Cc1cccc(F)c1)[N@@H+](C)Cc1nnc[nH]1 ZINC001350376740 981953986 /nfs/dbraw/zinc/95/39/86/981953986.db2.gz LPNSPHKFDIZCSN-SNVBAGLBSA-N 1 2 248.305 2.007 20 0 BEADLO CC(C)[C@@H]1CCCCN1C(=O)CCc1[nH]cc[nH+]1 ZINC001586091411 981966371 /nfs/dbraw/zinc/96/63/71/981966371.db2.gz PHJZHGIIIOMQQQ-LBPRGKRZSA-N 1 2 249.358 2.379 20 0 BEADLO CNc1cc(-c2cccc(O)c2)cc[nH+]1 ZINC001240927410 981999707 /nfs/dbraw/zinc/99/97/07/981999707.db2.gz QUDUCLCMWRCNSW-UHFFFAOYSA-N 1 2 200.241 2.496 20 0 BEADLO CC(C)CCCCNC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC001586613276 982005157 /nfs/dbraw/zinc/00/51/57/982005157.db2.gz ARCGXBGFWAWGGF-VXGBXAGGSA-N 1 2 249.358 2.456 20 0 BEADLO CC(C)CCCCNC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC001586613276 982005164 /nfs/dbraw/zinc/00/51/64/982005164.db2.gz ARCGXBGFWAWGGF-VXGBXAGGSA-N 1 2 249.358 2.456 20 0 BEADLO CC[C@@H](C)C[C@@H](C)NC(=O)Cc1[nH]c[nH+]c1C ZINC001586816086 982025860 /nfs/dbraw/zinc/02/58/60/982025860.db2.gz JEXFPELXZJRCRL-NXEZZACHSA-N 1 2 237.347 2.202 20 0 BEADLO CCCC1CCN(C(=O)Cc2[nH]c[nH+]c2C)CC1 ZINC001587269374 982062993 /nfs/dbraw/zinc/06/29/93/982062993.db2.gz XULLSCLVQUKKBG-UHFFFAOYSA-N 1 2 249.358 2.299 20 0 BEADLO Nc1cc(-c2ccc3cnoc3c2)cc[nH+]1 ZINC001241163249 982301408 /nfs/dbraw/zinc/30/14/08/982301408.db2.gz SBAZWIDKFDFJBB-UHFFFAOYSA-N 1 2 211.224 2.472 20 0 BEADLO Nc1cc(-c2cccc3ncncc32)cc[nH+]1 ZINC001241162892 982302175 /nfs/dbraw/zinc/30/21/75/982302175.db2.gz OPPZOIKQCQFBMN-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO Nc1cc(-c2ccc3[nH]cnc3c2)cc[nH+]1 ZINC001241162949 982302356 /nfs/dbraw/zinc/30/23/56/982302356.db2.gz PEIJFKHMRMCWBF-UHFFFAOYSA-N 1 2 210.240 2.207 20 0 BEADLO COC(=O)c1ccc(C)c(-c2cc[nH+]c(N)c2)c1 ZINC001241162851 982304391 /nfs/dbraw/zinc/30/43/91/982304391.db2.gz NOBJYEISUSUGGP-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO Nc1cc(-c2cnc3occc3c2)cc[nH+]1 ZINC001241163669 982308023 /nfs/dbraw/zinc/30/80/23/982308023.db2.gz YBOMSSGMKJOQPT-UHFFFAOYSA-N 1 2 211.224 2.472 20 0 BEADLO Nc1cc(-c2ccc3[nH]c(=S)[nH]c3c2)cc[nH+]1 ZINC001241169566 982315047 /nfs/dbraw/zinc/31/50/47/982315047.db2.gz FRMGNGRHSZEIQW-UHFFFAOYSA-N 1 2 242.307 2.496 20 0 BEADLO Cc1ccc(O)cc1-c1cc[nH+]c(N)c1 ZINC001241170475 982318492 /nfs/dbraw/zinc/31/84/92/982318492.db2.gz KCXMDFAIWBSKBS-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO Nc1cc(-c2cccc(-c3nc[nH]n3)c2)cc[nH+]1 ZINC001241170511 982319512 /nfs/dbraw/zinc/31/95/12/982319512.db2.gz LVANVNNPOKSEHH-UHFFFAOYSA-N 1 2 237.266 2.116 20 0 BEADLO Nc1cc(-c2cccc3c2NC(=O)CC3)cc[nH+]1 ZINC001241170678 982319783 /nfs/dbraw/zinc/31/97/83/982319783.db2.gz OYTZHFUQZWVPCK-UHFFFAOYSA-N 1 2 239.278 2.216 20 0 BEADLO Cn1cnc2cccc(-c3cc[nH+]c(N)c3)c21 ZINC001241175478 982323889 /nfs/dbraw/zinc/32/38/89/982323889.db2.gz CYKXVQCQTNQLDJ-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO Cc1nc2c(ncc(-c3cc[nH+]c(N)c3)c2C)[nH]1 ZINC001241176215 982325994 /nfs/dbraw/zinc/32/59/94/982325994.db2.gz VQELQOJQHGEFJV-UHFFFAOYSA-N 1 2 239.282 2.219 20 0 BEADLO CSc1cnccc1-c1cc[nH+]c(N)c1 ZINC001241176280 982327626 /nfs/dbraw/zinc/32/76/26/982327626.db2.gz YGOPKTOJUURQIF-UHFFFAOYSA-N 1 2 217.297 2.448 20 0 BEADLO Cc1cc(C)c(NC(=O)c2ncccn2)c(C)[nH+]1 ZINC001351555295 982327924 /nfs/dbraw/zinc/32/79/24/982327924.db2.gz RFECTUHFYOAYNA-UHFFFAOYSA-N 1 2 242.282 2.049 20 0 BEADLO COc1c(F)ccc(-c2cc[nH+]c(N)c2)c1OC ZINC001241176070 982328353 /nfs/dbraw/zinc/32/83/53/982328353.db2.gz TVYFBCLKAAVWTI-UHFFFAOYSA-N 1 2 248.257 2.487 20 0 BEADLO Cc1[nH]c(CN2CC3(CCC3)OC[C@H]2C)[nH+]c1C ZINC001195885474 982370618 /nfs/dbraw/zinc/37/06/18/982370618.db2.gz XRKXMIIABOBJAL-SNVBAGLBSA-N 1 2 249.358 2.170 20 0 BEADLO CCc1nccc(-c2c[nH+]c(N(C)C)cc2C)n1 ZINC001241233228 982386837 /nfs/dbraw/zinc/38/68/37/982386837.db2.gz JSVVEVXBWLSUPL-UHFFFAOYSA-N 1 2 242.326 2.475 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1cccoc1=O ZINC001241248340 982389258 /nfs/dbraw/zinc/38/92/58/982389258.db2.gz FSWOHDNDQILTRB-UHFFFAOYSA-N 1 2 230.267 2.076 20 0 BEADLO CC(C)OC(=O)[C@H](C)[NH2+]CCCC(F)(F)F ZINC001352064877 982451695 /nfs/dbraw/zinc/45/16/95/982451695.db2.gz LYXPGXNTMLCENL-QMMMGPOBSA-N 1 2 241.253 2.259 20 0 BEADLO Cc1ccc(-c2ccc(N(C)C)nc2)[nH+]c1N ZINC001241368549 982529217 /nfs/dbraw/zinc/52/92/17/982529217.db2.gz LJMJCGUYBLZGPA-UHFFFAOYSA-N 1 2 228.299 2.100 20 0 BEADLO CNc1cc(-c2ccc(N(C)C)nc2)cc[nH+]1 ZINC001241371372 982533372 /nfs/dbraw/zinc/53/33/72/982533372.db2.gz UNNVYKIZAMINEE-UHFFFAOYSA-N 1 2 228.299 2.251 20 0 BEADLO c1cn2c(cccc2-c2cnc3n[nH]cc3c2)[nH+]1 ZINC001241425108 982577655 /nfs/dbraw/zinc/57/76/55/982577655.db2.gz WEILXPAZTQTHLD-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO CC[C@@H](C)CNC(=S)Nc1cc[nH+]cc1C ZINC001200243425 982739052 /nfs/dbraw/zinc/73/90/52/982739052.db2.gz ZLNMXOUOTDGFCS-SECBINFHSA-N 1 2 237.372 2.144 20 0 BEADLO CSc1ncc(F)c(C2=CCC[N@H+](C)C2)n1 ZINC001241565301 982806487 /nfs/dbraw/zinc/80/64/87/982806487.db2.gz JKAJTGCEAVGCDN-UHFFFAOYSA-N 1 2 239.319 2.057 20 0 BEADLO CSc1ncc(F)c(C2=CCC[N@@H+](C)C2)n1 ZINC001241565301 982806488 /nfs/dbraw/zinc/80/64/88/982806488.db2.gz JKAJTGCEAVGCDN-UHFFFAOYSA-N 1 2 239.319 2.057 20 0 BEADLO C[N@@H+]1CCC=C(c2nc(F)ccc2F)C1 ZINC001241570822 982824386 /nfs/dbraw/zinc/82/43/86/982824386.db2.gz OALLRRGYUURNEQ-UHFFFAOYSA-N 1 2 210.227 2.079 20 0 BEADLO C[N@H+]1CCC=C(c2nc(F)ccc2F)C1 ZINC001241570822 982824388 /nfs/dbraw/zinc/82/43/88/982824388.db2.gz OALLRRGYUURNEQ-UHFFFAOYSA-N 1 2 210.227 2.079 20 0 BEADLO Cn1cc2c(cccc2-c2ccc[nH+]c2N)n1 ZINC001241584539 982830890 /nfs/dbraw/zinc/83/08/90/982830890.db2.gz YOIQYQRFCLBPTO-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO CCNC(=O)c1ccc(-c2ccc(N)[nH+]c2)cc1 ZINC001241617376 982851339 /nfs/dbraw/zinc/85/13/39/982851339.db2.gz TXVRPYRMCBABQJ-UHFFFAOYSA-N 1 2 241.294 2.081 20 0 BEADLO COc1ccc(C)c(-c2c[nH+]cn2C)c1 ZINC001241670509 982909862 /nfs/dbraw/zinc/90/98/62/982909862.db2.gz NGOIKDUJJUAZPX-UHFFFAOYSA-N 1 2 202.257 2.404 20 0 BEADLO CCCCNC(=S)Nc1cc[nH+]c2c1CCC2 ZINC001200446346 983004380 /nfs/dbraw/zinc/00/43/80/983004380.db2.gz PYXOXOHHNYZRID-UHFFFAOYSA-N 1 2 249.383 2.079 20 0 BEADLO Fc1ccc(-c2cc(-n3cc[nH+]c3)ccn2)nc1 ZINC001241806827 983062120 /nfs/dbraw/zinc/06/21/20/983062120.db2.gz NPBDJXZDNKGPHY-UHFFFAOYSA-N 1 2 240.241 2.468 20 0 BEADLO c1cn2c(cccc2-c2cscn2)[nH+]1 ZINC001241890707 983107597 /nfs/dbraw/zinc/10/75/97/983107597.db2.gz NTXDLRPSEMJWBI-UHFFFAOYSA-N 1 2 201.254 2.458 20 0 BEADLO CC(C)(C)c1nccc(Nc2ccc(N)[nH+]c2)n1 ZINC001201279708 983156327 /nfs/dbraw/zinc/15/63/27/983156327.db2.gz UJUYDYCYACWPQO-UHFFFAOYSA-N 1 2 243.314 2.495 20 0 BEADLO Nc1ccc(Nc2cnn3cccc(F)c23)c[nH+]1 ZINC001201284604 983156673 /nfs/dbraw/zinc/15/66/73/983156673.db2.gz UFGNJMOLENYBMH-UHFFFAOYSA-N 1 2 243.245 2.194 20 0 BEADLO Cn1cc2cc(Nc3ccc(N)[nH+]c3)ccc2n1 ZINC001201284169 983158123 /nfs/dbraw/zinc/15/81/23/983158123.db2.gz LMANMDRNSBGDII-UHFFFAOYSA-N 1 2 239.282 2.294 20 0 BEADLO Nc1ccc(Nc2cccc3cnncc32)c[nH+]1 ZINC001201286815 983164377 /nfs/dbraw/zinc/16/43/77/983164377.db2.gz BLZLTUXIEWXYHJ-UHFFFAOYSA-N 1 2 237.266 2.351 20 0 BEADLO COc1cc(Nc2ccc(N)[nH+]c2)ccc1O ZINC001201287053 983166373 /nfs/dbraw/zinc/16/63/73/983166373.db2.gz QQPIWMIOVODVEZ-UHFFFAOYSA-N 1 2 231.255 2.122 20 0 BEADLO C[C@H](O)c1ccc(Nc2ccc(N)[nH+]c2)cc1 ZINC001201287093 983166901 /nfs/dbraw/zinc/16/69/01/983166901.db2.gz SRDGROSKBSEDBP-VIFPVBQESA-N 1 2 229.283 2.461 20 0 BEADLO CC(=O)c1cccc(O)c1Nc1ccc(N)[nH+]c1 ZINC001201292245 983169171 /nfs/dbraw/zinc/16/91/71/983169171.db2.gz MCWBTYYIGGFCFD-UHFFFAOYSA-N 1 2 243.266 2.316 20 0 BEADLO Nc1ccc(Nc2ncnc3sccc32)c[nH+]1 ZINC001201272579 983171516 /nfs/dbraw/zinc/17/15/16/983171516.db2.gz QRTUVHVARLWKCD-UHFFFAOYSA-N 1 2 243.295 2.412 20 0 BEADLO CC(C)(C)c1nc(Nc2ccc(N)[nH+]c2)no1 ZINC001201271750 983173059 /nfs/dbraw/zinc/17/30/59/983173059.db2.gz AGQUNSMOBWXYFF-UHFFFAOYSA-N 1 2 233.275 2.088 20 0 BEADLO Cc1ccc(Nc2ccc(N)[nH+]c2)cn1 ZINC001201272379 983173343 /nfs/dbraw/zinc/17/33/43/983173343.db2.gz MGRIFNJCCUFVSE-UHFFFAOYSA-N 1 2 200.245 2.111 20 0 BEADLO Nc1ccc(Nc2c(N)ccnc2Cl)c[nH+]1 ZINC001201275684 983174994 /nfs/dbraw/zinc/17/49/94/983174994.db2.gz IKRLNFRGVSUWEA-UHFFFAOYSA-N 1 2 235.678 2.038 20 0 BEADLO COc1nc(C)ccc1Nc1ccc(N)[nH+]c1 ZINC001201276344 983175508 /nfs/dbraw/zinc/17/55/08/983175508.db2.gz UMFBMPIPPCIOSA-UHFFFAOYSA-N 1 2 230.271 2.119 20 0 BEADLO COC(=O)c1cscc1Nc1ccc(N)[nH+]c1 ZINC001201275966 983175759 /nfs/dbraw/zinc/17/57/59/983175759.db2.gz NNZADVZMWSQZBM-UHFFFAOYSA-N 1 2 249.295 2.256 20 0 BEADLO CC(=O)N1CC=C(c2cc[nH+]c(C)c2C)CC1 ZINC001241968422 983175744 /nfs/dbraw/zinc/17/57/44/983175744.db2.gz HQSYRILBSVCCNE-UHFFFAOYSA-N 1 2 230.311 2.334 20 0 BEADLO Nc1ccc(Nc2cn(CC3CC3)cn2)c[nH+]1 ZINC001201278795 983177914 /nfs/dbraw/zinc/17/79/14/983177914.db2.gz GPPZYZMQWOFFCU-UHFFFAOYSA-N 1 2 229.287 2.014 20 0 BEADLO CCOC(=O)c1occc1Nc1ccc(N)[nH+]c1 ZINC001201278462 983178505 /nfs/dbraw/zinc/17/85/05/983178505.db2.gz JPEMNZBUUMYVIP-UHFFFAOYSA-N 1 2 247.254 2.177 20 0 BEADLO Nc1ccc(Nc2cc[nH]c(=O)c2Cl)c[nH+]1 ZINC001201278287 983178545 /nfs/dbraw/zinc/17/85/45/983178545.db2.gz ADSPVRTUYCCRFW-UHFFFAOYSA-N 1 2 236.662 2.161 20 0 BEADLO Cc1ccc(F)c(Nc2ccc(N)[nH+]c2)n1 ZINC001201278366 983178856 /nfs/dbraw/zinc/17/88/56/983178856.db2.gz APJMPFLEQHYCAU-UHFFFAOYSA-N 1 2 218.235 2.250 20 0 BEADLO CCc1cccc(Nc2ccc(N)[nH+]c2)n1 ZINC001201278460 983179035 /nfs/dbraw/zinc/17/90/35/983179035.db2.gz JNUVDPQVCVVKQP-UHFFFAOYSA-N 1 2 214.272 2.365 20 0 BEADLO Nc1ccc(-n2ccc3cc(N)c(F)cc32)c[nH+]1 ZINC001201300417 983180956 /nfs/dbraw/zinc/18/09/56/983180956.db2.gz QCTAHOUJZJTHES-UHFFFAOYSA-N 1 2 242.257 2.329 20 0 BEADLO CN1CCc2cc(Nc3ccc(N)[nH+]c3)ccc21 ZINC001201294905 983181163 /nfs/dbraw/zinc/18/11/63/983181163.db2.gz KKICHSYSLJRZNA-UHFFFAOYSA-N 1 2 240.310 2.400 20 0 BEADLO Cc1cc(-c2ccccc2CC(N)=O)cc(C)[nH+]1 ZINC001241994511 983189154 /nfs/dbraw/zinc/18/91/54/983189154.db2.gz VMQNALXOHSOVAD-UHFFFAOYSA-N 1 2 240.306 2.393 20 0 BEADLO Cc1cc(-c2c[nH]c3coc(=O)c-3c2)cc(C)[nH+]1 ZINC001241996638 983190055 /nfs/dbraw/zinc/19/00/55/983190055.db2.gz XLJCRFDZIVCGEW-UHFFFAOYSA-N 1 2 240.262 2.431 20 0 BEADLO Cc1ccc(N[C@@H]2C[C@@H](C)n3ncnc32)c(C)[nH+]1 ZINC001354234741 983215832 /nfs/dbraw/zinc/21/58/32/983215832.db2.gz JCMUDJLMFRVCED-BXKDBHETSA-N 1 2 243.314 2.408 20 0 BEADLO OC1(C(F)(F)F)C[NH+](CC2CCCCC2)C1 ZINC001201391045 983217083 /nfs/dbraw/zinc/21/70/83/983217083.db2.gz VERZMWANCAUSAO-UHFFFAOYSA-N 1 2 237.265 2.176 20 0 BEADLO CCOC(=[NH2+])c1ccc(-c2ncc[nH]2)cc1 ZINC001242018750 983221903 /nfs/dbraw/zinc/22/19/03/983221903.db2.gz QHZATPQFMYOYPH-UHFFFAOYSA-N 1 2 215.256 2.439 20 0 BEADLO Cn1c[nH+]cc1-c1cccc(-c2ncc[nH]2)c1 ZINC001242019065 983224736 /nfs/dbraw/zinc/22/47/36/983224736.db2.gz XXMKERTWUJWEKF-UHFFFAOYSA-N 1 2 224.267 2.477 20 0 BEADLO C=CC(=O)Oc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001242020147 983228243 /nfs/dbraw/zinc/22/82/43/983228243.db2.gz QZFQIDNXEWTAPI-UHFFFAOYSA-N 1 2 214.224 2.168 20 0 BEADLO COc1cc(CN(C)c2cccc[nH+]2)sn1 ZINC001354277922 983245489 /nfs/dbraw/zinc/24/54/89/983245489.db2.gz DQAYUTDLPJBGKU-UHFFFAOYSA-N 1 2 235.312 2.183 20 0 BEADLO COC(=[NH2+])c1cccc(-c2ccc(=O)[nH]c2)c1 ZINC001242064077 983284063 /nfs/dbraw/zinc/28/40/63/983284063.db2.gz LRKKFTXBCWJHHT-UHFFFAOYSA-N 1 2 228.251 2.426 20 0 BEADLO C[NH+](C)Cc1c(F)cc(-c2ccnnc2)cc1F ZINC001242067455 983294855 /nfs/dbraw/zinc/29/48/55/983294855.db2.gz CUNQGCUDKWLYPJ-UHFFFAOYSA-N 1 2 249.264 2.483 20 0 BEADLO CNc1ccc(-c2cccc3[nH+]ccn32)cn1 ZINC001242069400 983298541 /nfs/dbraw/zinc/29/85/41/983298541.db2.gz HLKXVWGOUYHZCQ-UHFFFAOYSA-N 1 2 224.267 2.438 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1ncnc2scnc21 ZINC001242070988 983304937 /nfs/dbraw/zinc/30/49/37/983304937.db2.gz QBYQNLXRYCJJHJ-UHFFFAOYSA-N 1 2 243.295 2.039 20 0 BEADLO CSc1cc(C)nc(-c2c[nH+]c(N)cc2C)n1 ZINC001242072386 983308197 /nfs/dbraw/zinc/30/81/97/983308197.db2.gz KOKSDDVQXIDEGB-UHFFFAOYSA-N 1 2 246.339 2.460 20 0 BEADLO c1cn(Cc2ccc(C3=CCOCC3)nc2)c[nH+]1 ZINC001242074299 983316507 /nfs/dbraw/zinc/31/65/07/983316507.db2.gz KWSWJNHZDBYOBF-UHFFFAOYSA-N 1 2 241.294 2.130 20 0 BEADLO CCCc1nccnc1-c1c[nH+]c(N)cc1C ZINC001242078219 983324648 /nfs/dbraw/zinc/32/46/48/983324648.db2.gz UUYBRKYSIODORT-UHFFFAOYSA-N 1 2 228.299 2.382 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1nncc2ccoc21 ZINC001242077966 983324826 /nfs/dbraw/zinc/32/48/26/983324826.db2.gz MWXRGWUZICVDBI-UHFFFAOYSA-N 1 2 226.239 2.175 20 0 BEADLO COc1cc(C)cnc1-c1c[nH+]c(N)cc1C ZINC001242078745 983328355 /nfs/dbraw/zinc/32/83/55/983328355.db2.gz PKMOSEPUNDNCDO-UHFFFAOYSA-N 1 2 229.283 2.351 20 0 BEADLO COc1ccc(F)nc1-c1c[nH+]c(N)cc1C ZINC001242096116 983339003 /nfs/dbraw/zinc/33/90/03/983339003.db2.gz AOAIPXSRGCDKBF-UHFFFAOYSA-N 1 2 233.246 2.182 20 0 BEADLO COc1cc(Nc2cncc(O)c2)cc(C)[nH+]1 ZINC001201633957 983362562 /nfs/dbraw/zinc/36/25/62/983362562.db2.gz MRNQHVRVTXPPCH-UHFFFAOYSA-N 1 2 231.255 2.243 20 0 BEADLO CC(C)(C)[C@@H]1CSCC[N@@H+]1Cc1cnon1 ZINC001354889126 983381366 /nfs/dbraw/zinc/38/13/66/983381366.db2.gz TUVICNMESSOSOP-JTQLQIEISA-N 1 2 241.360 2.033 20 0 BEADLO CC(C)(C)[C@@H]1CSCC[N@H+]1Cc1cnon1 ZINC001354889126 983381374 /nfs/dbraw/zinc/38/13/74/983381374.db2.gz TUVICNMESSOSOP-JTQLQIEISA-N 1 2 241.360 2.033 20 0 BEADLO Cc1cn2c(cccc2Nc2cncc(O)c2)[nH+]1 ZINC001201628877 983386633 /nfs/dbraw/zinc/38/66/33/983386633.db2.gz KIJOVCHAIAWZTM-UHFFFAOYSA-N 1 2 240.266 2.487 20 0 BEADLO CCCN1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccccc1 ZINC001201643286 983399016 /nfs/dbraw/zinc/39/90/16/983399016.db2.gz CNPYEIBDINHHDC-GJZGRUSLSA-N 1 2 230.355 2.355 20 0 BEADLO CCCN1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccccc1 ZINC001201643286 983399022 /nfs/dbraw/zinc/39/90/22/983399022.db2.gz CNPYEIBDINHHDC-GJZGRUSLSA-N 1 2 230.355 2.355 20 0 BEADLO Cc1c(N)cc[nH+]c1-c1ccc(F)cc1O ZINC001242215970 983412242 /nfs/dbraw/zinc/41/22/42/983412242.db2.gz LFVBOQMKLLTCIV-UHFFFAOYSA-N 1 2 218.231 2.484 20 0 BEADLO CCCC[C@H](O)CNc1cc([C@@H](C)O)cc[nH+]1 ZINC001252083328 983441625 /nfs/dbraw/zinc/44/16/25/983441625.db2.gz NVISUYFMZDOETB-PWSUYJOCSA-N 1 2 238.331 2.098 20 0 BEADLO CCN(C(=O)Nc1ccccc1C)C1C[NH+](C)C1 ZINC001202182976 983588576 /nfs/dbraw/zinc/58/85/76/983588576.db2.gz DTIHUHZQWUABNZ-UHFFFAOYSA-N 1 2 247.342 2.163 20 0 BEADLO C[NH2+]Cc1cc(-c2cccc(Cl)c2O)ncn1 ZINC001242365538 983659839 /nfs/dbraw/zinc/65/98/39/983659839.db2.gz WMSKGRIWERPNOM-UHFFFAOYSA-N 1 2 249.701 2.222 20 0 BEADLO Cc1ccc(-c2ccc(C)c(CO)c2)[nH+]c1N ZINC001242384776 983674388 /nfs/dbraw/zinc/67/43/88/983674388.db2.gz TUXXZKYSPGIEGO-UHFFFAOYSA-N 1 2 228.295 2.440 20 0 BEADLO CC(C)(O)CNc1ccccc1-n1cc[nH+]c1 ZINC001252345708 983740314 /nfs/dbraw/zinc/74/03/14/983740314.db2.gz BSZSROWVRCHLJI-UHFFFAOYSA-N 1 2 231.299 2.055 20 0 BEADLO CC(C)(O)CNc1cc(Cl)c2[nH+]ccn2c1 ZINC001252349494 983743239 /nfs/dbraw/zinc/74/32/39/983743239.db2.gz CXNHWIIEQWGIEW-UHFFFAOYSA-N 1 2 239.706 2.171 20 0 BEADLO CCC1(CNC(=O)c2cccc3[nH+]ccn32)CC1 ZINC000776995596 983800833 /nfs/dbraw/zinc/80/08/33/983800833.db2.gz KHJXEFGSMWYNPI-UHFFFAOYSA-N 1 2 243.310 2.254 20 0 BEADLO CC(C)n1cc(C[N@@H+]2C[C@@H](F)C[C@H]2C)cn1 ZINC001137072771 983908032 /nfs/dbraw/zinc/90/80/32/983908032.db2.gz FZFNGVYAZDYCON-PWSUYJOCSA-N 1 2 225.311 2.396 20 0 BEADLO CC(C)n1cc(C[N@H+]2C[C@@H](F)C[C@H]2C)cn1 ZINC001137072771 983908049 /nfs/dbraw/zinc/90/80/49/983908049.db2.gz FZFNGVYAZDYCON-PWSUYJOCSA-N 1 2 225.311 2.396 20 0 BEADLO Cc1ccccc1C[N@@H+](C)CC(=O)OC(C)C ZINC000049801890 983936583 /nfs/dbraw/zinc/93/65/83/983936583.db2.gz FWIQFYOSOPTYCN-UHFFFAOYSA-N 1 2 235.327 2.378 20 0 BEADLO Cc1ccccc1C[N@H+](C)CC(=O)OC(C)C ZINC000049801890 983936587 /nfs/dbraw/zinc/93/65/87/983936587.db2.gz FWIQFYOSOPTYCN-UHFFFAOYSA-N 1 2 235.327 2.378 20 0 BEADLO CC(=O)c1cc(-c2cc[nH+]c3c2CCN3)ccn1 ZINC001242611812 983980221 /nfs/dbraw/zinc/98/02/21/983980221.db2.gz ACMFUMNMSHBXKB-UHFFFAOYSA-N 1 2 239.278 2.314 20 0 BEADLO CCOC1C[NH+](Cc2cc(C)cs2)C1 ZINC001137152966 983992156 /nfs/dbraw/zinc/99/21/56/983992156.db2.gz KPOIXLIVXVYQHI-UHFFFAOYSA-N 1 2 211.330 2.277 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cnc(C(F)(F)F)nc1 ZINC001242663666 984031263 /nfs/dbraw/zinc/03/12/63/984031263.db2.gz GSAMQPCXJDWDLA-JKEDICHKSA-N 1 2 229.205 2.371 20 0 BEADLO Cc1ccc2c(Nc3cn(C)nn3)cccc2[nH+]1 ZINC001212795929 984047949 /nfs/dbraw/zinc/04/79/49/984047949.db2.gz JMCVMLIUWGADCJ-UHFFFAOYSA-N 1 2 239.282 2.415 20 0 BEADLO Nc1cn2ccc(-c3cc(O)ccc3F)cc2[nH+]1 ZINC001242763693 984133004 /nfs/dbraw/zinc/13/30/04/984133004.db2.gz XCGMKTOTRSAWJT-UHFFFAOYSA-N 1 2 243.241 2.428 20 0 BEADLO [NH3+]Cc1cccc(-c2cccc(S)c2)n1 ZINC001242865345 984210047 /nfs/dbraw/zinc/21/00/47/984210047.db2.gz APVKSFRSSBYCIM-UHFFFAOYSA-N 1 2 216.309 2.496 20 0 BEADLO [NH3+]Cc1cc(-c2cccc(S)c2)ccn1 ZINC001242868344 984215254 /nfs/dbraw/zinc/21/52/54/984215254.db2.gz PDXSFQNYXLUDJO-UHFFFAOYSA-N 1 2 216.309 2.496 20 0 BEADLO COc1nccc(-c2c[nH+]c(N)c(C)c2)c1OC ZINC001242959936 984320401 /nfs/dbraw/zinc/32/04/01/984320401.db2.gz WHMPIGCGKUCZEZ-UHFFFAOYSA-N 1 2 245.282 2.051 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cccc(CO)c1C ZINC001243015109 984369751 /nfs/dbraw/zinc/36/97/51/984369751.db2.gz GSJWSCOGWPDMEV-DXNUHORPSA-N 1 2 203.285 2.363 20 0 BEADLO Cc1cc(-c2cncn2C)cn2cc[nH+]c12 ZINC001243067340 984484344 /nfs/dbraw/zinc/48/43/44/984484344.db2.gz IWNJZUHJGMXRTQ-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO Cn1c[nH+]cc1-c1cccc2c1C1(CC1)C(=O)N2 ZINC001243069659 984486672 /nfs/dbraw/zinc/48/66/72/984486672.db2.gz JEELKQXXVIVDGR-UHFFFAOYSA-N 1 2 239.278 2.071 20 0 BEADLO Cn1c[nH+]cc1-c1ccc([S@](C)(=N)=O)cc1 ZINC001243069927 984492073 /nfs/dbraw/zinc/49/20/73/984492073.db2.gz BWAPRVNPCSQYOZ-MRXNPFEDSA-N 1 2 235.312 2.123 20 0 BEADLO CN(C)c1cc(F)cc(-c2c[nH+]cn2C)c1 ZINC001243069721 984492713 /nfs/dbraw/zinc/49/27/13/984492713.db2.gz XKAYUVURRUXJQR-UHFFFAOYSA-N 1 2 219.263 2.292 20 0 BEADLO COc1ccc(-c2c[nH+]cn2C)cc1NC(C)=O ZINC001243070617 984494412 /nfs/dbraw/zinc/49/44/12/984494412.db2.gz IEBSKLFRUHTZHD-UHFFFAOYSA-N 1 2 245.282 2.054 20 0 BEADLO CCOC(=O)c1cc(-c2c[nH+]cn2C)ccc1F ZINC001243071684 984501048 /nfs/dbraw/zinc/50/10/48/984501048.db2.gz XRJPHPAVIWAZEL-UHFFFAOYSA-N 1 2 248.257 2.403 20 0 BEADLO Cc1c(-c2cncn2C)ccc2[nH+]ccn21 ZINC001243072644 984506236 /nfs/dbraw/zinc/50/62/36/984506236.db2.gz SWNKYTHCWXSDSS-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO Cn1c[nH+]cc1-c1cccc2c1CCCO2 ZINC001243073048 984507280 /nfs/dbraw/zinc/50/72/80/984507280.db2.gz XFQQRQUQVFMPIC-UHFFFAOYSA-N 1 2 214.268 2.412 20 0 BEADLO COc1cnccc1-c1c[nH+]c2c(c1)CCCN2 ZINC001243075940 984516951 /nfs/dbraw/zinc/51/69/51/984516951.db2.gz XNWABOAVFLTGSX-UHFFFAOYSA-N 1 2 241.294 2.153 20 0 BEADLO C=C/C=C/CC(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC001443386650 984521919 /nfs/dbraw/zinc/52/19/19/984521919.db2.gz ITFPCNIQAQZUPG-ITDFMYJTSA-N 1 2 245.326 2.179 20 0 BEADLO COc1ccc(CO)cc1/C(C)=C/C=C/[NH3+] ZINC001243171794 984630892 /nfs/dbraw/zinc/63/08/92/984630892.db2.gz ITJUMHUFFHLHDH-DROBUMMNSA-N 1 2 219.284 2.063 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NCC(C)(C)C(C)C ZINC001447854972 984792109 /nfs/dbraw/zinc/79/21/09/984792109.db2.gz HCFSFZCEHKBUIW-UHFFFAOYSA-N 1 2 237.347 2.059 20 0 BEADLO Nc1cc[nH+]c(-c2ccc(O)c(F)c2F)c1 ZINC001243340262 984829749 /nfs/dbraw/zinc/82/97/49/984829749.db2.gz ZYUYPSSSLFRQFD-UHFFFAOYSA-N 1 2 222.194 2.315 20 0 BEADLO CC(=O)Oc1ccc(/C(C)=C/C=C/[NH3+])cc1 ZINC001243361907 984843165 /nfs/dbraw/zinc/84/31/65/984843165.db2.gz CXMMBGWKVFIMFM-LQIBPGRFSA-N 1 2 217.268 2.488 20 0 BEADLO Cc1cn(C)nc1C[N@@H+](C)[C@@H](C)c1ccncc1 ZINC000930119739 984945092 /nfs/dbraw/zinc/94/50/92/984945092.db2.gz RHTZBSQXXVPYOF-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cn(C)nc1C[N@H+](C)[C@@H](C)c1ccncc1 ZINC000930119739 984945108 /nfs/dbraw/zinc/94/51/08/984945108.db2.gz RHTZBSQXXVPYOF-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Nc1cc(-c2ccc[nH+]c2N)ccc1F ZINC001243454505 984964879 /nfs/dbraw/zinc/96/48/79/984964879.db2.gz VHHCEFCFYOLZGA-UHFFFAOYSA-N 1 2 203.220 2.052 20 0 BEADLO CCOC(=O)[C@H](CC(C)(C)F)[NH2+][C@H](C)CC ZINC001257433427 985006931 /nfs/dbraw/zinc/00/69/31/985006931.db2.gz OHAJOFFPRXCPPD-ZJUUUORDSA-N 1 2 233.327 2.444 20 0 BEADLO CCOCc1cncc(-c2ccc[nH+]c2N)c1 ZINC001243477309 985037360 /nfs/dbraw/zinc/03/73/60/985037360.db2.gz KBHISTXGPQVHPY-UHFFFAOYSA-N 1 2 229.283 2.262 20 0 BEADLO C[N@H+](CCSC(C)(C)C)Cc1ncc[nH]1 ZINC000686009603 985040983 /nfs/dbraw/zinc/04/09/83/985040983.db2.gz KSXGWWIPDUFNEU-UHFFFAOYSA-N 1 2 227.377 2.373 20 0 BEADLO C[N@@H+](CCSC(C)(C)C)Cc1ncc[nH]1 ZINC000686009603 985040992 /nfs/dbraw/zinc/04/09/92/985040992.db2.gz KSXGWWIPDUFNEU-UHFFFAOYSA-N 1 2 227.377 2.373 20 0 BEADLO CC(C)(C)c1ncncc1-c1ccc[nH+]c1N ZINC001243478086 985041219 /nfs/dbraw/zinc/04/12/19/985041219.db2.gz YXAKSNFWFMUXLV-UHFFFAOYSA-N 1 2 228.299 2.418 20 0 BEADLO O[C@H]1CC[N@@H+](C2CCCCC2)CC1(F)F ZINC001257458947 985060941 /nfs/dbraw/zinc/06/09/41/985060941.db2.gz ISMIGSIEINALJN-JTQLQIEISA-N 1 2 219.275 2.021 20 0 BEADLO O[C@H]1CC[N@H+](C2CCCCC2)CC1(F)F ZINC001257458947 985060953 /nfs/dbraw/zinc/06/09/53/985060953.db2.gz ISMIGSIEINALJN-JTQLQIEISA-N 1 2 219.275 2.021 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H](C)C2CCCC2)c[nH+]1 ZINC001456144764 985113815 /nfs/dbraw/zinc/11/38/15/985113815.db2.gz XQPIBGRCLJZOHP-JTQLQIEISA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H](C)C2CCCC2)[nH+]1 ZINC001456144764 985113823 /nfs/dbraw/zinc/11/38/23/985113823.db2.gz XQPIBGRCLJZOHP-JTQLQIEISA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]c(CNC(=O)/C=C2\CC[C@@H](C)C2)c[nH+]1 ZINC001456144747 985119501 /nfs/dbraw/zinc/11/95/01/985119501.db2.gz XPAVEMQICFXJHN-UEUZTHOGSA-N 1 2 247.342 2.335 20 0 BEADLO CCc1[nH]cc(CNC(=O)C=C2CC[C@@H](C)C2)[nH+]1 ZINC001456144747 985119509 /nfs/dbraw/zinc/11/95/09/985119509.db2.gz XPAVEMQICFXJHN-UEUZTHOGSA-N 1 2 247.342 2.335 20 0 BEADLO CC(C)c1cnc(C[NH+]2CCC(CO)CC2)o1 ZINC000686607148 985157324 /nfs/dbraw/zinc/15/73/24/985157324.db2.gz BZNAKEWIASBYCQ-UHFFFAOYSA-N 1 2 238.331 2.002 20 0 BEADLO Cc1nocc1-c1cc(-n2cc[nH+]c2)ccn1 ZINC001243672658 985160674 /nfs/dbraw/zinc/16/06/74/985160674.db2.gz UGMAPPDMDXKPDK-UHFFFAOYSA-N 1 2 226.239 2.231 20 0 BEADLO CNc1cc(-c2cc(F)cc(CO)c2)cc[nH+]1 ZINC001243694792 985217507 /nfs/dbraw/zinc/21/75/07/985217507.db2.gz KGQKADWTAXQOIB-UHFFFAOYSA-N 1 2 232.258 2.422 20 0 BEADLO Cc1cc(NC(=O)c2ccc(C)c(C)n2)cc[nH+]1 ZINC001458481364 985316313 /nfs/dbraw/zinc/31/63/13/985316313.db2.gz YMKZBATWTFGHAR-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO CCc1cn(Cc2ncc(CC)o2)c[nH+]1 ZINC001459265691 985428008 /nfs/dbraw/zinc/42/80/08/985428008.db2.gz YONYWNWOVHXWOW-UHFFFAOYSA-N 1 2 205.261 2.044 20 0 BEADLO CCOC(=O)C1([NH2+]C2C[C@H](C)C[C@@H](C)C2)CC1 ZINC001258152416 985474587 /nfs/dbraw/zinc/47/45/87/985474587.db2.gz WMJZLUGSNJFYJL-GHMZBOCLSA-N 1 2 239.359 2.496 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1COC2(CCC2)C1 ZINC000688267357 985597876 /nfs/dbraw/zinc/59/78/76/985597876.db2.gz LRPAMPSLIWVVKK-JTQLQIEISA-N 1 2 234.299 2.214 20 0 BEADLO Nc1cn2ccc(-c3cccc4[nH]cnc43)cc2[nH+]1 ZINC001243932867 985609501 /nfs/dbraw/zinc/60/95/01/985609501.db2.gz PUMOZJCKGCSLRP-UHFFFAOYSA-N 1 2 249.277 2.460 20 0 BEADLO CCCc1cc(C2=C[NH2+]CCC2)ncn1 ZINC001243948533 985630072 /nfs/dbraw/zinc/63/00/72/985630072.db2.gz GJFNMFOMZPIDNC-UHFFFAOYSA-N 1 2 203.289 2.153 20 0 BEADLO c1nc(C2=C[NH2+]CCC2)cc(N2CCCCC2)n1 ZINC001243948559 985631136 /nfs/dbraw/zinc/63/11/36/985631136.db2.gz HKGQXTCEOBPZQJ-UHFFFAOYSA-N 1 2 244.342 2.191 20 0 BEADLO CC(C)(C)c1ccc(C2=C[NH2+]CCC2)nn1 ZINC001243949180 985633622 /nfs/dbraw/zinc/63/36/22/985633622.db2.gz SZRSLBQZLJQEGR-UHFFFAOYSA-N 1 2 217.316 2.498 20 0 BEADLO Nc1cc(-c2cc(F)c(F)c(F)c2N)cc[nH+]1 ZINC001244168778 985875656 /nfs/dbraw/zinc/87/56/56/985875656.db2.gz DUZOQGIRNSFWDG-UHFFFAOYSA-N 1 2 239.200 2.330 20 0 BEADLO CCn1cc(Nc2c[nH+]ccc2OC)ccc1=O ZINC001212909110 985913665 /nfs/dbraw/zinc/91/36/65/985913665.db2.gz XGQZNHCHUSVHOJ-UHFFFAOYSA-N 1 2 245.282 2.015 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCCC[C@@](C)(F)C2)n1 ZINC001138935037 986031157 /nfs/dbraw/zinc/03/11/57/986031157.db2.gz ALEKXXCMVHZSLP-GFCCVEGCSA-N 1 2 225.311 2.432 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCCC[C@@](C)(F)C2)n1 ZINC001138935037 986031178 /nfs/dbraw/zinc/03/11/78/986031178.db2.gz ALEKXXCMVHZSLP-GFCCVEGCSA-N 1 2 225.311 2.432 20 0 BEADLO Cc1ccc(-c2ccn3cc(N)[nH+]c3c2)c(N)c1 ZINC001244393151 986037485 /nfs/dbraw/zinc/03/74/85/986037485.db2.gz ZIYOISGEPGTBIM-UHFFFAOYSA-N 1 2 238.294 2.474 20 0 BEADLO Cc1cc(-c2cc(F)ccc2N)c[nH+]c1N ZINC001244397906 986055317 /nfs/dbraw/zinc/05/53/17/986055317.db2.gz SIGRVXRRTQAWEX-UHFFFAOYSA-N 1 2 217.247 2.361 20 0 BEADLO Nc1[nH+]cccc1CN1CCOc2ccccc21 ZINC001462063374 986276187 /nfs/dbraw/zinc/27/61/87/986276187.db2.gz CTOYPAOVKGGBMJ-UHFFFAOYSA-N 1 2 241.294 2.063 20 0 BEADLO COc1cc(-c2ccc(C)c(N)[nH+]2)ccc1CO ZINC001244656607 986297776 /nfs/dbraw/zinc/29/77/76/986297776.db2.gz FZYPDVCAHDLKSW-UHFFFAOYSA-N 1 2 244.294 2.140 20 0 BEADLO OCc1cc(-c2ccn3cc[nH+]c3c2)ccc1O ZINC001244776263 986336519 /nfs/dbraw/zinc/33/65/19/986336519.db2.gz VMVHQDPPKZOVTI-UHFFFAOYSA-N 1 2 240.262 2.199 20 0 BEADLO OCc1cc(-c2ccc3[nH+]ccn3c2)ccc1O ZINC001244775337 986340309 /nfs/dbraw/zinc/34/03/09/986340309.db2.gz PNRJNZVPSHXJKL-UHFFFAOYSA-N 1 2 240.262 2.199 20 0 BEADLO C[N@@H+](CC(=O)c1ccccc1)C[C@H](O)C(C)(C)C ZINC001253729699 986342751 /nfs/dbraw/zinc/34/27/51/986342751.db2.gz KQMGNXRBPCIJKQ-AWEZNQCLSA-N 1 2 249.354 2.208 20 0 BEADLO C[N@H+](CC(=O)c1ccccc1)C[C@H](O)C(C)(C)C ZINC001253729699 986342764 /nfs/dbraw/zinc/34/27/64/986342764.db2.gz KQMGNXRBPCIJKQ-AWEZNQCLSA-N 1 2 249.354 2.208 20 0 BEADLO C[C@@H](CF)[NH2+]Cc1ccc(O)c(F)c1F ZINC001462284023 986342531 /nfs/dbraw/zinc/34/25/31/986342531.db2.gz KKHACSZUYUHWJS-LURJTMIESA-N 1 2 219.206 2.118 20 0 BEADLO CCN(Cc1ccc[nH+]c1N)c1cccc(O)c1 ZINC001462422774 986381174 /nfs/dbraw/zinc/38/11/74/986381174.db2.gz BFWJZWQQOYBGQA-UHFFFAOYSA-N 1 2 243.310 2.396 20 0 BEADLO CNc1cc(-c2ccc(OC)c(N)c2)cc[nH+]1 ZINC001244896612 986431084 /nfs/dbraw/zinc/43/10/84/986431084.db2.gz DVDKIWOPGOIIFR-UHFFFAOYSA-N 1 2 229.283 2.381 20 0 BEADLO CNc1cc(-c2ccc(NC(N)=O)cc2)cc[nH+]1 ZINC001244975208 986557834 /nfs/dbraw/zinc/55/78/34/986557834.db2.gz GGYVYKLHUUYHAF-UHFFFAOYSA-N 1 2 242.282 2.281 20 0 BEADLO CNc1cc(-c2cc(C)oc(=O)c2)cc[nH+]1 ZINC001244975181 986558170 /nfs/dbraw/zinc/55/81/70/986558170.db2.gz CYRYBMLSOANJGI-UHFFFAOYSA-N 1 2 216.240 2.052 20 0 BEADLO COc1c(O)cccc1-c1ccc[nH+]c1N ZINC001244987801 986582248 /nfs/dbraw/zinc/58/22/48/986582248.db2.gz IFGWDXKWVPYALM-UHFFFAOYSA-N 1 2 216.240 2.045 20 0 BEADLO COC(=O)[C@H](CC(C)C)[N@@H+]1CCC[C@H](F)C1 ZINC000689423642 986582587 /nfs/dbraw/zinc/58/25/87/986582587.db2.gz CUOFZGSRUGYFIZ-QWRGUYRKSA-N 1 2 231.311 2.008 20 0 BEADLO COC(=O)[C@H](CC(C)C)[N@H+]1CCC[C@H](F)C1 ZINC000689423642 986582599 /nfs/dbraw/zinc/58/25/99/986582599.db2.gz CUOFZGSRUGYFIZ-QWRGUYRKSA-N 1 2 231.311 2.008 20 0 BEADLO CSc1ccccc1NC(=O)Cc1[nH]cc[nH+]1 ZINC001463896746 986589540 /nfs/dbraw/zinc/58/95/40/986589540.db2.gz PLVGAHQSNAAPFF-UHFFFAOYSA-N 1 2 247.323 2.313 20 0 BEADLO O[C@H](C[N@@H+]1CCC[C@@H](F)C1)c1ccccc1F ZINC000689439233 986610192 /nfs/dbraw/zinc/61/01/92/986610192.db2.gz XPUSHVBTTUEDIM-ZWNOBZJWSA-N 1 2 241.281 2.293 20 0 BEADLO O[C@H](C[N@H+]1CCC[C@@H](F)C1)c1ccccc1F ZINC000689439233 986610197 /nfs/dbraw/zinc/61/01/97/986610197.db2.gz XPUSHVBTTUEDIM-ZWNOBZJWSA-N 1 2 241.281 2.293 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1cnc2ccccc2c1 ZINC001137277037 986711547 /nfs/dbraw/zinc/71/15/47/986711547.db2.gz KMTDWRFULVLSQW-UHFFFAOYSA-N 1 2 228.295 2.256 20 0 BEADLO CC(=O)C[N@H+](C)Cc1cnc2ccccc2c1 ZINC001137277037 986711556 /nfs/dbraw/zinc/71/15/56/986711556.db2.gz KMTDWRFULVLSQW-UHFFFAOYSA-N 1 2 228.295 2.256 20 0 BEADLO COCn1cc(-c2cc(C)c3[nH+]ccn3c2)cn1 ZINC001245220065 986740804 /nfs/dbraw/zinc/74/08/04/986740804.db2.gz ARQLKSUFCJNERH-UHFFFAOYSA-N 1 2 242.282 2.110 20 0 BEADLO c1c2ccccc2[nH]c1C[N@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001137319987 986760331 /nfs/dbraw/zinc/76/03/31/986760331.db2.gz SQESVHHIBLZXKP-BETUJISGSA-N 1 2 228.295 2.141 20 0 BEADLO c1c2ccccc2[nH]c1C[N@@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001137319987 986760337 /nfs/dbraw/zinc/76/03/37/986760337.db2.gz SQESVHHIBLZXKP-BETUJISGSA-N 1 2 228.295 2.141 20 0 BEADLO Cc1c(N)c(F)ccc1-c1ccc[nH+]c1N ZINC001245460028 986854281 /nfs/dbraw/zinc/85/42/81/986854281.db2.gz DWUKSJJYEMFKID-UHFFFAOYSA-N 1 2 217.247 2.361 20 0 BEADLO FC1(F)CCC[N@H+]([C@H]2CCSC2)C1 ZINC001255278806 986883151 /nfs/dbraw/zinc/88/31/51/986883151.db2.gz BTSIXEIAIPIKDC-QMMMGPOBSA-N 1 2 207.289 2.223 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)Nc1ccc2cc[nH]c2c1 ZINC001467549492 986856956 /nfs/dbraw/zinc/85/69/56/986856956.db2.gz LMXXXEUYPSEBIT-UHFFFAOYSA-N 1 2 240.266 2.072 20 0 BEADLO Cn1ncc2cc(-c3cccc4[nH+]ccn43)cnc21 ZINC001245470802 986863605 /nfs/dbraw/zinc/86/36/05/986863605.db2.gz ARTYHAXQLNKKPS-UHFFFAOYSA-N 1 2 249.277 2.283 20 0 BEADLO FC1(F)CCC[N@@H+]([C@H]2CCSC2)C1 ZINC001255278806 986883145 /nfs/dbraw/zinc/88/31/45/986883145.db2.gz BTSIXEIAIPIKDC-QMMMGPOBSA-N 1 2 207.289 2.223 20 0 BEADLO Cc1cnc(Cl)c(C[NH+]2CC=CC2)c1 ZINC001139590058 986883243 /nfs/dbraw/zinc/88/32/43/986883243.db2.gz VZIOTWNKIPSUBH-UHFFFAOYSA-N 1 2 208.692 2.415 20 0 BEADLO Clc1ncccc1C[N@@H+]1CC[C@@]12CCOC2 ZINC001137428369 986894293 /nfs/dbraw/zinc/89/42/93/986894293.db2.gz AJBMWDQDJJPVLI-LBPRGKRZSA-N 1 2 238.718 2.100 20 0 BEADLO Clc1ncccc1C[N@H+]1CC[C@@]12CCOC2 ZINC001137428369 986894297 /nfs/dbraw/zinc/89/42/97/986894297.db2.gz AJBMWDQDJJPVLI-LBPRGKRZSA-N 1 2 238.718 2.100 20 0 BEADLO Cc1c(-c2cnc(N)c(F)c2)ccc2[nH+]ccn21 ZINC001245523173 986905818 /nfs/dbraw/zinc/90/58/18/986905818.db2.gz YGDXESOBMQHDIV-UHFFFAOYSA-N 1 2 242.257 2.426 20 0 BEADLO Cc1cc(-c2cc(F)ccn2)c[nH+]c1N ZINC001245535856 986911270 /nfs/dbraw/zinc/91/12/70/986911270.db2.gz GTBGUNCKNGEANU-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO Cc1cc(-c2cnc(C)c(C)n2)c[nH+]c1N ZINC001245536110 986915366 /nfs/dbraw/zinc/91/53/66/986915366.db2.gz LNFZKMNWYWIVDP-UHFFFAOYSA-N 1 2 214.272 2.046 20 0 BEADLO Cc1cc(-c2ccc(N(C)C)cn2)c[nH+]c1N ZINC001245536757 986915674 /nfs/dbraw/zinc/91/56/74/986915674.db2.gz YYYLSHWTTUHCOO-UHFFFAOYSA-N 1 2 228.299 2.100 20 0 BEADLO Cc1cc(-c2cnc3[nH]cnc3c2C)c[nH+]c1N ZINC001245538520 986917061 /nfs/dbraw/zinc/91/70/61/986917061.db2.gz NGZSAZQYFXTGIH-UHFFFAOYSA-N 1 2 239.282 2.219 20 0 BEADLO COc1cnc(-c2c[nH+]c(N)c(C)c2)cc1C ZINC001245537276 986917776 /nfs/dbraw/zinc/91/77/76/986917776.db2.gz IDGAAQOZPNCYCE-UHFFFAOYSA-N 1 2 229.283 2.351 20 0 BEADLO COc1ncc(F)cc1-c1c[nH+]c(N)c(C)c1 ZINC001245538487 986921194 /nfs/dbraw/zinc/92/11/94/986921194.db2.gz LJTDWRFCTBETKZ-UHFFFAOYSA-N 1 2 233.246 2.182 20 0 BEADLO COc1ccc(-c2c[nH+]c(N)c(C)c2)nc1F ZINC001245537279 986921821 /nfs/dbraw/zinc/92/18/21/986921821.db2.gz AKXDNTSPPUXRIN-UHFFFAOYSA-N 1 2 233.246 2.182 20 0 BEADLO Cc1cc(-c2ccc3c(N)noc3c2)c[nH+]c1N ZINC001245538391 986922125 /nfs/dbraw/zinc/92/21/25/986922125.db2.gz DEZFCSUZVURWEZ-UHFFFAOYSA-N 1 2 240.266 2.363 20 0 BEADLO Cc1nc2ccc(-c3c[nH+]c(N)c(C)c3)nc2[nH]1 ZINC001245537119 986922518 /nfs/dbraw/zinc/92/25/18/986922518.db2.gz YHVVBMRMRJZTFV-UHFFFAOYSA-N 1 2 239.282 2.219 20 0 BEADLO CCCC[C@H](C)[N@@H+]1CCNCC(F)(F)C1 ZINC001255323798 986925640 /nfs/dbraw/zinc/92/56/40/986925640.db2.gz VLBONJHRYIONML-JTQLQIEISA-N 1 2 220.307 2.106 20 0 BEADLO CCCC[C@H](C)[N@H+]1CCNCC(F)(F)C1 ZINC001255323798 986925647 /nfs/dbraw/zinc/92/56/47/986925647.db2.gz VLBONJHRYIONML-JTQLQIEISA-N 1 2 220.307 2.106 20 0 BEADLO CCCC[C@H](C)N1CC[NH2+]CC(F)(F)C1 ZINC001255323798 986925656 /nfs/dbraw/zinc/92/56/56/986925656.db2.gz VLBONJHRYIONML-JTQLQIEISA-N 1 2 220.307 2.106 20 0 BEADLO COc1nc(C)ccc1-c1c[nH+]c(N)c(C)c1 ZINC001245538855 986926388 /nfs/dbraw/zinc/92/63/88/986926388.db2.gz IRPUBOZNEXEJKY-UHFFFAOYSA-N 1 2 229.283 2.351 20 0 BEADLO Cc1cc(-c2c(F)ccnc2F)c[nH+]c1N ZINC001245540061 986926479 /nfs/dbraw/zinc/92/64/79/986926479.db2.gz QAHHFSCEXWUMTJ-UHFFFAOYSA-N 1 2 221.210 2.312 20 0 BEADLO [NH3+]Cc1cnccc1-c1ccccc1S ZINC001245558660 986949590 /nfs/dbraw/zinc/94/95/90/986949590.db2.gz RMSIKPWGAFQKFU-UHFFFAOYSA-N 1 2 216.309 2.496 20 0 BEADLO CN1CCC[C@H]([N@@H+]2Cc3cccc(F)c3C2)C1 ZINC001255489541 986990615 /nfs/dbraw/zinc/99/06/15/986990615.db2.gz PAAGYIDPYWHQSP-LBPRGKRZSA-N 1 2 234.318 2.236 20 0 BEADLO CN1CCC[C@H]([N@H+]2Cc3cccc(F)c3C2)C1 ZINC001255489541 986990628 /nfs/dbraw/zinc/99/06/28/986990628.db2.gz PAAGYIDPYWHQSP-LBPRGKRZSA-N 1 2 234.318 2.236 20 0 BEADLO Cc1cc(-c2ccc(N)[nH+]c2)c(C)cc1CO ZINC001245698877 987068774 /nfs/dbraw/zinc/06/87/74/987068774.db2.gz OQMRRQSMMMHGTM-UHFFFAOYSA-N 1 2 228.295 2.440 20 0 BEADLO C[C@H](Cc1ccccc1F)[NH+]1CCC(=O)CC1 ZINC001255842160 987073168 /nfs/dbraw/zinc/07/31/68/987073168.db2.gz PEKGGIJSIBUSQF-LLVKDONJSA-N 1 2 235.302 2.422 20 0 BEADLO C[C@H](Cc1ccccc1F)[NH+]1CC2(CCO2)C1 ZINC001255851031 987074198 /nfs/dbraw/zinc/07/41/98/987074198.db2.gz JRFHEPWMZYOHOH-LLVKDONJSA-N 1 2 235.302 2.231 20 0 BEADLO COc1ccc(-c2ccc[nH+]c2N)c(Cl)n1 ZINC001245874156 987098435 /nfs/dbraw/zinc/09/84/35/987098435.db2.gz SDBIAUKZNVMEIE-UHFFFAOYSA-N 1 2 235.674 2.388 20 0 BEADLO C[C@@H]1CCC[C@H]1N1N=C(C2CC[NH2+]CC2)CC1=O ZINC001245918078 987147697 /nfs/dbraw/zinc/14/76/97/987147697.db2.gz VHWRRRCOXJBUIQ-ZWNOBZJWSA-N 1 2 249.358 2.417 20 0 BEADLO CCC(CC)N1N=C(C2CC[NH2+]CC2)CC1=O ZINC001245918261 987149815 /nfs/dbraw/zinc/14/98/15/987149815.db2.gz SQLKMVXIGOSFIM-UHFFFAOYSA-N 1 2 237.347 2.417 20 0 BEADLO C[C@H]1C[C@@H]1c1nnc(CN(C)c2cccc[nH+]2)o1 ZINC001256659975 987265126 /nfs/dbraw/zinc/26/51/26/987265126.db2.gz UQIDCRTXBCUJDT-UWVGGRQHSA-N 1 2 244.298 2.224 20 0 BEADLO CCCCCC(=O)OCCCn1cc[nH+]c1 ZINC000781987661 987295638 /nfs/dbraw/zinc/29/56/38/987295638.db2.gz JJIQWRHTLNNACE-UHFFFAOYSA-N 1 2 224.304 2.397 20 0 BEADLO Cc1nsc(NCc2[nH]c3c([nH+]2)CCCC3)n1 ZINC001472887162 987299414 /nfs/dbraw/zinc/29/94/14/987299414.db2.gz ODIGDYCZYUBERU-UHFFFAOYSA-N 1 2 249.343 2.061 20 0 BEADLO CCOCC[N@H+](CC)Cc1csnc1OC ZINC001473153424 987350279 /nfs/dbraw/zinc/35/02/79/987350279.db2.gz AOZLKVSMWSJKKU-UHFFFAOYSA-N 1 2 244.360 2.010 20 0 BEADLO CCOCC[N@@H+](CC)Cc1csnc1OC ZINC001473153424 987350283 /nfs/dbraw/zinc/35/02/83/987350283.db2.gz AOZLKVSMWSJKKU-UHFFFAOYSA-N 1 2 244.360 2.010 20 0 BEADLO C[C@H](C(=O)N1CCC[C@@H]2CCC[C@H]21)n1cc[nH+]c1 ZINC001116127966 987452202 /nfs/dbraw/zinc/45/22/02/987452202.db2.gz VPYDDAHMABZTOJ-FRRDWIJNSA-N 1 2 247.342 2.235 20 0 BEADLO Cc1cc(CNc2ccc([NH+](C)C)cc2)[nH]n1 ZINC001116319671 987517525 /nfs/dbraw/zinc/51/75/25/987517525.db2.gz UTLHBSVWGGAZQD-UHFFFAOYSA-N 1 2 230.315 2.396 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1C(=O)[C@H](C)n1cc[nH+]c1 ZINC001116464201 987590473 /nfs/dbraw/zinc/59/04/73/987590473.db2.gz TYLPUJOIPHAJJM-GRYCIOLGSA-N 1 2 235.331 2.234 20 0 BEADLO CSCC[N@@H+]1CC(F)(F)CC[C@@H]1C ZINC001473880099 987603262 /nfs/dbraw/zinc/60/32/62/987603262.db2.gz RGXWFCJDOYOYBT-QMMMGPOBSA-N 1 2 209.305 2.469 20 0 BEADLO CSCC[N@H+]1CC(F)(F)CC[C@@H]1C ZINC001473880099 987603267 /nfs/dbraw/zinc/60/32/67/987603267.db2.gz RGXWFCJDOYOYBT-QMMMGPOBSA-N 1 2 209.305 2.469 20 0 BEADLO C[C@@H]1C[C@@H](N[C@H]2C[NH2+]CC[C@H]2F)CC(C)(C)C1 ZINC001246219216 987616247 /nfs/dbraw/zinc/61/62/47/987616247.db2.gz YMLFYWLJQZYLPW-LPWJVIDDSA-N 1 2 242.382 2.491 20 0 BEADLO C[C@@H]1C[C@@H]([NH2+][C@H]2CNCC[C@H]2F)CC(C)(C)C1 ZINC001246219216 987616250 /nfs/dbraw/zinc/61/62/50/987616250.db2.gz YMLFYWLJQZYLPW-LPWJVIDDSA-N 1 2 242.382 2.491 20 0 BEADLO CCCCC[C@@H](CC)[NH2+][C@@H]1CCNC[C@H]1OC ZINC001246218915 987616671 /nfs/dbraw/zinc/61/66/71/987616671.db2.gz WBCPCKPBTPZJMZ-MGPQQGTHSA-N 1 2 242.407 2.312 20 0 BEADLO Cc1c(Cl)cccc1C[NH2+]Cc1nnc[nH]1 ZINC001474307019 987684924 /nfs/dbraw/zinc/68/49/24/987684924.db2.gz YZDUHACQOMVIDH-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+][C@@H](C)Cc1ccc(C)cc1 ZINC001116776163 987703919 /nfs/dbraw/zinc/70/39/19/987703919.db2.gz VJKWGUQYTSBGCD-QWHCGFSZSA-N 1 2 249.354 2.467 20 0 BEADLO c1[nH+]cc(N[C@H]2C[C@@H]3COC[C@@H]32)c2c1CCCC2 ZINC001474624209 987783454 /nfs/dbraw/zinc/78/34/54/987783454.db2.gz NPWSAJRTOGNPQQ-XBFCOCLRSA-N 1 2 244.338 2.407 20 0 BEADLO CC1([NH2+]Cc2cncc(Cl)c2Cl)COC1 ZINC001474661945 987795178 /nfs/dbraw/zinc/79/51/78/987795178.db2.gz OEOYUISLVJIEGQ-UHFFFAOYSA-N 1 2 247.125 2.267 20 0 BEADLO CC[C@H](C)C[C@H](CC)N[C@H]1C[NH2+]CC1(F)F ZINC001246460316 987820501 /nfs/dbraw/zinc/82/05/01/987820501.db2.gz LPPBOCPTJBNVJT-DCAQKATOSA-N 1 2 234.334 2.398 20 0 BEADLO CC[C@H](C[C@@H](C)CC)N[C@H]1C[NH2+]CC1(F)F ZINC001246460315 987821119 /nfs/dbraw/zinc/82/11/19/987821119.db2.gz LPPBOCPTJBNVJT-AXFHLTTASA-N 1 2 234.334 2.398 20 0 BEADLO C[C@H](c1cccs1)c1nnc(C[NH+](C)C)o1 ZINC001322340772 988214443 /nfs/dbraw/zinc/21/44/43/988214443.db2.gz UZXUITRWVQQBJX-MRVPVSSYSA-N 1 2 237.328 2.345 20 0 BEADLO C[C@H](c1ccsc1)c1nnc(C[NH+](C)C)o1 ZINC001322401664 988247677 /nfs/dbraw/zinc/24/76/77/988247677.db2.gz VQNNJLZCGOYJHF-MRVPVSSYSA-N 1 2 237.328 2.345 20 0 BEADLO Cc1cccc(C(C)(C)[NH2+]Cc2nnc[nH]2)c1 ZINC001118557607 988436016 /nfs/dbraw/zinc/43/60/16/988436016.db2.gz HRRHBZAWGURRQZ-UHFFFAOYSA-N 1 2 230.315 2.138 20 0 BEADLO C[C@@H](C(=O)N1CCC[C@@H](C)[C@H]1C)n1cc[nH+]c1 ZINC001323146511 988458639 /nfs/dbraw/zinc/45/86/39/988458639.db2.gz QDDPVDAGJGGBAZ-UTUOFQBUSA-N 1 2 235.331 2.091 20 0 BEADLO C[C@@H]1CC[C@H]([N@@H+]2CC[C@H](N)C(F)(F)C2)C[C@@H]1C ZINC001246839883 988547588 /nfs/dbraw/zinc/54/75/88/988547588.db2.gz ZWSAGFYHCGDJNC-RHYQMDGZSA-N 1 2 246.345 2.479 20 0 BEADLO C[C@@H]1CC[C@H]([N@H+]2CC[C@H](N)C(F)(F)C2)C[C@@H]1C ZINC001246839883 988547592 /nfs/dbraw/zinc/54/75/92/988547592.db2.gz ZWSAGFYHCGDJNC-RHYQMDGZSA-N 1 2 246.345 2.479 20 0 BEADLO Cc1c[nH+]c2c(c1)N(C(=O)CC1CCC1)CCN2 ZINC001118792591 988598273 /nfs/dbraw/zinc/59/82/73/988598273.db2.gz DYHUOMNHNYZBJL-UHFFFAOYSA-N 1 2 245.326 2.339 20 0 BEADLO COC[C@H](CC(C)C)[NH2+][C@@H](C)c1noc(C)n1 ZINC001324047804 988679172 /nfs/dbraw/zinc/67/91/72/988679172.db2.gz SWYXWBZDXSTEDY-ONGXEEELSA-N 1 2 241.335 2.090 20 0 BEADLO C[C@H](c1nnc(C[NH+](C)C)o1)c1ccccc1 ZINC001324271296 988775743 /nfs/dbraw/zinc/77/57/43/988775743.db2.gz OFGRPJAQOPJOHM-JTQLQIEISA-N 1 2 231.299 2.283 20 0 BEADLO CCOc1ccc2[nH+]c(CCCCO)n(C)c2c1 ZINC001247042740 988846836 /nfs/dbraw/zinc/84/68/36/988846836.db2.gz MBMVJNDXPZATRZ-UHFFFAOYSA-N 1 2 248.326 2.287 20 0 BEADLO c1cc(CNCC[NH+]2CCCCC2)n(C2CC2)c1 ZINC001119282800 988883392 /nfs/dbraw/zinc/88/33/92/988883392.db2.gz LFTVJOPZCASZKU-UHFFFAOYSA-N 1 2 247.386 2.399 20 0 BEADLO Cc1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001247428046 988886239 /nfs/dbraw/zinc/88/62/39/988886239.db2.gz ZDJVJLXHSTVQRC-UHFFFAOYSA-N 1 2 226.239 2.231 20 0 BEADLO C[C@]1(c2ccccc2)CCC[N@@H+]1Cc1nnc[nH]1 ZINC001119325538 988943945 /nfs/dbraw/zinc/94/39/45/988943945.db2.gz NKCNQHLNQKKNTQ-CQSZACIVSA-N 1 2 242.326 2.316 20 0 BEADLO C[C@]1(c2ccccc2)CCC[N@H+]1Cc1nnc[nH]1 ZINC001119325538 988943956 /nfs/dbraw/zinc/94/39/56/988943956.db2.gz NKCNQHLNQKKNTQ-CQSZACIVSA-N 1 2 242.326 2.316 20 0 BEADLO Cc1ccoc1C(=O)OCCCc1c[nH+]cn1C ZINC001515334153 989025673 /nfs/dbraw/zinc/02/56/73/989025673.db2.gz BHWGIDQMQUUYOO-UHFFFAOYSA-N 1 2 248.282 2.111 20 0 BEADLO FC[C@H]1CCC[N@H+](Cn2cc(Cl)cn2)C1 ZINC001119387528 989029184 /nfs/dbraw/zinc/02/91/84/989029184.db2.gz AJYWAZJENRNIFS-SECBINFHSA-N 1 2 231.702 2.176 20 0 BEADLO FC[C@H]1CCC[N@@H+](Cn2cc(Cl)cn2)C1 ZINC001119387528 989029197 /nfs/dbraw/zinc/02/91/97/989029197.db2.gz AJYWAZJENRNIFS-SECBINFHSA-N 1 2 231.702 2.176 20 0 BEADLO CC(C)[C@@H](Cc1ccccc1)[NH2+]Cc1ncn[nH]1 ZINC001119435201 989068095 /nfs/dbraw/zinc/06/80/95/989068095.db2.gz MVHLWOWGKAZDAG-CYBMUJFWSA-N 1 2 244.342 2.162 20 0 BEADLO CCc1ccc(N2CCC[C@H]2C[C@H](C)O)[nH+]c1 ZINC001515582723 989068356 /nfs/dbraw/zinc/06/83/56/989068356.db2.gz SXDALFBAPVACBN-AAEUAGOBSA-N 1 2 234.343 2.384 20 0 BEADLO CCc1ccc(N2CCC[C@H]2C[C@@H](C)O)[nH+]c1 ZINC001515582726 989071399 /nfs/dbraw/zinc/07/13/99/989071399.db2.gz SXDALFBAPVACBN-YPMHNXCESA-N 1 2 234.343 2.384 20 0 BEADLO Cc1cc(F)cc(N2C[C@@H](C)O[C@@H](C)C2)[nH+]1 ZINC001515604042 989075296 /nfs/dbraw/zinc/07/52/96/989075296.db2.gz BHEUGFBIGXPTGK-AOOOYVTPSA-N 1 2 224.279 2.143 20 0 BEADLO Cc1ncoc1C[NH2+]Cc1ccc(Cl)cn1 ZINC001119444824 989081002 /nfs/dbraw/zinc/08/10/02/989081002.db2.gz CRJWWLQTTCJECN-UHFFFAOYSA-N 1 2 237.690 2.321 20 0 BEADLO C[C@@H]1CC[N@@H+]1Cc1ccc(Br)n1C ZINC001248773218 989146101 /nfs/dbraw/zinc/14/61/01/989146101.db2.gz CRFRATXEDHAWQX-MRVPVSSYSA-N 1 2 243.148 2.382 20 0 BEADLO Cc1cc[nH+]c(N)c1CN(C)Cc1cscn1 ZINC001119508055 989117822 /nfs/dbraw/zinc/11/78/22/989117822.db2.gz VEZUFPOFLIQGOQ-UHFFFAOYSA-N 1 2 248.355 2.061 20 0 BEADLO C[C@@H]1CC[N@H+]1Cc1ccc(Br)n1C ZINC001248773218 989146104 /nfs/dbraw/zinc/14/61/04/989146104.db2.gz CRFRATXEDHAWQX-MRVPVSSYSA-N 1 2 243.148 2.382 20 0 BEADLO COC1C[NH+](Cc2ccc(F)c3cc[nH]c32)C1 ZINC001248814698 989172027 /nfs/dbraw/zinc/17/20/27/989172027.db2.gz YESPCZZPBYEGHR-UHFFFAOYSA-N 1 2 234.274 2.138 20 0 BEADLO Cc1ccc2[nH]c(C[NH+]3CC=CC3)nc2c1 ZINC001248839228 989186589 /nfs/dbraw/zinc/18/65/89/989186589.db2.gz AFWFFFHFSZAWRG-UHFFFAOYSA-N 1 2 213.284 2.243 20 0 BEADLO FC(F)(F)c1c[nH+]ccc1Nc1cnccn1 ZINC001249584083 989315014 /nfs/dbraw/zinc/31/50/14/989315014.db2.gz PZGFYOCMTOVOOV-UHFFFAOYSA-N 1 2 240.188 2.056 20 0 BEADLO FC(F)(F)c1c[nH+]ccc1Nc1ccon1 ZINC001249583400 989320335 /nfs/dbraw/zinc/32/03/35/989320335.db2.gz HWZNBLJRVYWPHI-UHFFFAOYSA-N 1 2 229.161 2.254 20 0 BEADLO Cc1cc[nH+]c(Nc2ccccc2CC(N)=O)c1 ZINC001249597077 989323041 /nfs/dbraw/zinc/32/30/41/989323041.db2.gz FGZXJYRCBQUPFA-UHFFFAOYSA-N 1 2 241.294 2.161 20 0 BEADLO CC[C@@H](C)[C@H](C)c1nnc(C[NH+](C)C)o1 ZINC001326084872 989370822 /nfs/dbraw/zinc/37/08/22/989370822.db2.gz UOAWBAYKNXASIR-BDAKNGLRSA-N 1 2 211.309 2.281 20 0 BEADLO Cn1cc[nH+]c1CCC(=O)Nc1ccsc1 ZINC001519472648 989422445 /nfs/dbraw/zinc/42/24/45/989422445.db2.gz CIOXHDGUYABTLI-UHFFFAOYSA-N 1 2 235.312 2.053 20 0 BEADLO CC(C)(COC(=O)C1=CCCC1)n1cc[nH+]c1 ZINC001519583131 989434456 /nfs/dbraw/zinc/43/44/56/989434456.db2.gz CXVKQSAZXHZZOE-UHFFFAOYSA-N 1 2 234.299 2.272 20 0 BEADLO C[C@H](CC(=O)N1CC(C)(C)C1(C)C)n1cc[nH+]c1 ZINC001326451321 989565398 /nfs/dbraw/zinc/56/53/98/989565398.db2.gz BNCUPPISYKBYJL-LLVKDONJSA-N 1 2 249.358 2.481 20 0 BEADLO CN(CCC1CCCCC1)c1cc(N)nc[nH+]1 ZINC001326514277 989591794 /nfs/dbraw/zinc/59/17/94/989591794.db2.gz KWZWTYLZEYFERL-UHFFFAOYSA-N 1 2 234.347 2.465 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@H](OC(C)C)C2)n[nH]1 ZINC001326519055 989597021 /nfs/dbraw/zinc/59/70/21/989597021.db2.gz MFKSMCICJFBVOC-CYBMUJFWSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@H](OC(C)C)C2)n[nH]1 ZINC001326519055 989597027 /nfs/dbraw/zinc/59/70/27/989597027.db2.gz MFKSMCICJFBVOC-CYBMUJFWSA-N 1 2 237.347 2.108 20 0 BEADLO C[C@H](C(=O)N[C@@]1(C)CC=CCC1)n1cc[nH+]c1 ZINC001326764905 989690618 /nfs/dbraw/zinc/69/06/18/989690618.db2.gz XAJFASBADWDSHA-YPMHNXCESA-N 1 2 233.315 2.059 20 0 BEADLO CCN(C(=O)[C@@H](C)n1cc[nH+]c1)[C@H](C)C(C)C ZINC001326800667 989722743 /nfs/dbraw/zinc/72/27/43/989722743.db2.gz SBHNAKZXMAYLRS-VXGBXAGGSA-N 1 2 237.347 2.337 20 0 BEADLO C[NH+](C)Cc1nnc([C@@H]2CC[C@@H]3C[C@@H]3C2)o1 ZINC001326987032 989801502 /nfs/dbraw/zinc/80/15/02/989801502.db2.gz GBSYXDQMWLJKLJ-OPRDCNLKSA-N 1 2 221.304 2.035 20 0 BEADLO Cn1cc[nH+]c1CCNC(=O)CC1(C)CCCC1 ZINC001522019304 989823177 /nfs/dbraw/zinc/82/31/77/989823177.db2.gz MJJZOIIGXCANEX-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO CCC[C@H]1CCCN1C(=O)CCc1[nH]cc[nH+]1 ZINC001120790427 989883360 /nfs/dbraw/zinc/88/33/60/989883360.db2.gz DDVWPBZHNVIGAC-NSHDSACASA-N 1 2 235.331 2.133 20 0 BEADLO CC[C@@H]1CCN(C(=O)CCCn2cc[nH+]c2)[C@H]1C ZINC001523409333 989909995 /nfs/dbraw/zinc/90/99/95/989909995.db2.gz DYEOXHHGUJOVAO-QWHCGFSZSA-N 1 2 249.358 2.310 20 0 BEADLO CCc1cc(N2C[C@@H](C)OCC[C@H]2C)nc(C)[nH+]1 ZINC001120903666 989959146 /nfs/dbraw/zinc/95/91/46/989959146.db2.gz COZIETXXEZIBMJ-GHMZBOCLSA-N 1 2 249.358 2.351 20 0 BEADLO CCc1ccc(N(C)CC2=CCCOC2)[nH+]c1 ZINC001120946042 989980880 /nfs/dbraw/zinc/98/08/80/989980880.db2.gz KPMTYABFOAQCNA-UHFFFAOYSA-N 1 2 232.327 2.427 20 0 BEADLO CO[C@@H]1CC[C@H]1N(C)c1cc(F)cc(C)[nH+]1 ZINC001120965213 989989491 /nfs/dbraw/zinc/98/94/91/989989491.db2.gz FMBDFJQIWAVRAU-GHMZBOCLSA-N 1 2 224.279 2.143 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C ZINC001121231221 990054070 /nfs/dbraw/zinc/05/40/70/990054070.db2.gz JOGLEDQJZREQOA-BXGBBSSXSA-N 1 2 244.338 2.351 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H](C)C1CC1 ZINC001121232020 990054237 /nfs/dbraw/zinc/05/42/37/990054237.db2.gz TZUJDMQXMCFPGU-SNVBAGLBSA-N 1 2 218.300 2.105 20 0 BEADLO CC[C@@]1(C)CCCN(C(=O)C[C@@H]([NH3+])C(F)F)C1 ZINC001121880302 990107970 /nfs/dbraw/zinc/10/79/70/990107970.db2.gz JXGGBPMIBULPKS-SKDRFNHKSA-N 1 2 248.317 2.008 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@H]1C[C@H]1C(C)C ZINC001527012041 990200319 /nfs/dbraw/zinc/20/03/19/990200319.db2.gz OXEKPFJLKMYJDT-RYUDHWBXSA-N 1 2 236.315 2.238 20 0 BEADLO CN(C(=O)CCc1[nH+]ccn1C)C1CCCCC1 ZINC001527415085 990218525 /nfs/dbraw/zinc/21/85/25/990218525.db2.gz SPRHLOAHZCGEMN-UHFFFAOYSA-N 1 2 249.358 2.144 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)c1ccsn1 ZINC001538058085 990521139 /nfs/dbraw/zinc/52/11/39/990521139.db2.gz GUTHPUNNAMXVMN-UHFFFAOYSA-N 1 2 244.279 2.043 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1C(=O)CCc1[nH+]ccn1C ZINC001123782049 990667932 /nfs/dbraw/zinc/66/79/32/990667932.db2.gz DGLBRJXDHLUSFG-NWDGAFQWSA-N 1 2 249.358 2.142 20 0 BEADLO CCC1(CC)CN(C(=O)CCc2[nH+]ccn2C)C1 ZINC001123797218 990670644 /nfs/dbraw/zinc/67/06/44/990670644.db2.gz XNVQWLQCZBFXCM-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO CCCCC1(C(=O)NCCc2[nH+]ccn2C)CC1 ZINC001123928393 990705285 /nfs/dbraw/zinc/70/52/85/990705285.db2.gz FKYOPRUVWZCRBC-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1cccc(F)c1C ZINC001544584077 990729154 /nfs/dbraw/zinc/72/91/54/990729154.db2.gz UVZFQBNXEVUIDU-LBPRGKRZSA-N 1 2 236.290 2.167 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1cccc(F)c1C ZINC001544584077 990729160 /nfs/dbraw/zinc/72/91/60/990729160.db2.gz UVZFQBNXEVUIDU-LBPRGKRZSA-N 1 2 236.290 2.167 20 0 BEADLO C[C@@H]1CC[N@@H+]1Cc1cccnc1Br ZINC001137793068 990850133 /nfs/dbraw/zinc/85/01/33/990850133.db2.gz AQWJPYYDHCHLGS-MRVPVSSYSA-N 1 2 241.132 2.438 20 0 BEADLO C[C@@H]1CC[N@H+]1Cc1cccnc1Br ZINC001137793068 990850135 /nfs/dbraw/zinc/85/01/35/990850135.db2.gz AQWJPYYDHCHLGS-MRVPVSSYSA-N 1 2 241.132 2.438 20 0 BEADLO C[C@H]1CC[N@@H+]1Cc1cccnc1Br ZINC001137793069 990850924 /nfs/dbraw/zinc/85/09/24/990850924.db2.gz AQWJPYYDHCHLGS-QMMMGPOBSA-N 1 2 241.132 2.438 20 0 BEADLO C[C@H]1CC[N@H+]1Cc1cccnc1Br ZINC001137793069 990850927 /nfs/dbraw/zinc/85/09/27/990850927.db2.gz AQWJPYYDHCHLGS-QMMMGPOBSA-N 1 2 241.132 2.438 20 0 BEADLO Clc1ncsc1C[N@@H+]1CC[C@H]2OCC[C@H]21 ZINC001137818369 990851532 /nfs/dbraw/zinc/85/15/32/990851532.db2.gz GQNUPYCSCDAOOC-HTQZYQBOSA-N 1 2 244.747 2.160 20 0 BEADLO Clc1ncsc1C[N@H+]1CC[C@H]2OCC[C@H]21 ZINC001137818369 990851533 /nfs/dbraw/zinc/85/15/33/990851533.db2.gz GQNUPYCSCDAOOC-HTQZYQBOSA-N 1 2 244.747 2.160 20 0 BEADLO C[C@]1(O)CC[N@H+](Cc2cc(F)cc(F)c2F)C1 ZINC001137868834 990862118 /nfs/dbraw/zinc/86/21/18/990862118.db2.gz TTYZRQNQNBOIKA-LBPRGKRZSA-N 1 2 245.244 2.061 20 0 BEADLO C[C@]1(O)CC[N@@H+](Cc2cc(F)cc(F)c2F)C1 ZINC001137868834 990862122 /nfs/dbraw/zinc/86/21/22/990862122.db2.gz TTYZRQNQNBOIKA-LBPRGKRZSA-N 1 2 245.244 2.061 20 0 BEADLO FC1(F)Oc2cccc(C[NH+]3CCC3)c2O1 ZINC001138063696 990881042 /nfs/dbraw/zinc/88/10/42/990881042.db2.gz CPIVPKVDOKLCSS-UHFFFAOYSA-N 1 2 227.210 2.214 20 0 BEADLO COc1c(C)cc(C[NH+]2CC3(CCO3)C2)cc1C ZINC001138428456 990945552 /nfs/dbraw/zinc/94/55/52/990945552.db2.gz JNZVNQNVUVXUCO-UHFFFAOYSA-N 1 2 247.338 2.287 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H]2CCCC[C@H]2C)c[nH+]1 ZINC001558497332 990947948 /nfs/dbraw/zinc/94/79/48/990947948.db2.gz KDSKOXBRNUFTEC-ZYHUDNBSSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H]2CCCC[C@H]2C)[nH+]1 ZINC001558497332 990947955 /nfs/dbraw/zinc/94/79/55/990947955.db2.gz KDSKOXBRNUFTEC-ZYHUDNBSSA-N 1 2 249.358 2.415 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCC23COC3)c(C)c1 ZINC001138434583 990948341 /nfs/dbraw/zinc/94/83/41/990948341.db2.gz SXJBDZQIDJZQLM-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO CCOc1ccc(C[N@H+]2CCC23COC3)c(C)c1 ZINC001138434583 990948349 /nfs/dbraw/zinc/94/83/49/990948349.db2.gz SXJBDZQIDJZQLM-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO Cc1ccc(O[C@H](C)C[NH2+]Cc2ccn[nH]2)cc1 ZINC001308285725 990959470 /nfs/dbraw/zinc/95/94/70/990959470.db2.gz JQYFKVXVVGBFFP-GFCCVEGCSA-N 1 2 245.326 2.275 20 0 BEADLO CCCc1ccc(C[NH+]2CCN(C#N)CC2)s1 ZINC001138529153 990970114 /nfs/dbraw/zinc/97/01/14/990970114.db2.gz PNUXGGJTFYVWAZ-UHFFFAOYSA-N 1 2 249.383 2.299 20 0 BEADLO CC(C)(C)c1n[nH]cc1C[N@@H+]1CCCC(=O)CC1 ZINC001138577253 990973054 /nfs/dbraw/zinc/97/30/54/990973054.db2.gz VSOIRXVUPWXDRK-UHFFFAOYSA-N 1 2 249.358 2.262 20 0 BEADLO CC(C)(C)c1n[nH]cc1C[N@H+]1CCCC(=O)CC1 ZINC001138577253 990973061 /nfs/dbraw/zinc/97/30/61/990973061.db2.gz VSOIRXVUPWXDRK-UHFFFAOYSA-N 1 2 249.358 2.262 20 0 BEADLO CC(C)C[C@H](C)C[C@@H](C)[N@@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001258075097 990975065 /nfs/dbraw/zinc/97/50/65/990975065.db2.gz RCTMZUPEDLDRRA-RNJOBUHISA-N 1 2 239.359 2.447 20 0 BEADLO CC(C)C[C@H](C)C[C@@H](C)[N@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001258075097 990975076 /nfs/dbraw/zinc/97/50/76/990975076.db2.gz RCTMZUPEDLDRRA-RNJOBUHISA-N 1 2 239.359 2.447 20 0 BEADLO CCn1ccc(C[NH2+]Cc2ccc(F)nc2C)n1 ZINC001308435402 990993189 /nfs/dbraw/zinc/99/31/89/990993189.db2.gz BTJKANWUUAUEQE-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO CCSc1ncc(C[N@@H+]2CC[C@H]2C)cn1 ZINC001138650418 990999589 /nfs/dbraw/zinc/99/95/89/990999589.db2.gz UZMNIDCEWOZCBD-SECBINFHSA-N 1 2 223.345 2.183 20 0 BEADLO CCSc1ncc(C[N@H+]2CC[C@H]2C)cn1 ZINC001138650418 990999602 /nfs/dbraw/zinc/99/96/02/990999602.db2.gz UZMNIDCEWOZCBD-SECBINFHSA-N 1 2 223.345 2.183 20 0 BEADLO Cc1cc(NCc2nc(CO)cs2)c[nH+]c1C ZINC001308503475 991008864 /nfs/dbraw/zinc/00/88/64/991008864.db2.gz NHNHHQZESWSKOD-UHFFFAOYSA-N 1 2 249.339 2.259 20 0 BEADLO Cl/C=C/C[NH2+]Cc1cnn(-c2ccccc2)n1 ZINC001308544191 991026337 /nfs/dbraw/zinc/02/63/37/991026337.db2.gz OYALMOSHSYOXHY-QPJJXVBHSA-N 1 2 248.717 2.109 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1cccc2ccnn21 ZINC001138804595 991064002 /nfs/dbraw/zinc/06/40/02/991064002.db2.gz OOFCQJYUQPRDCQ-MNOVXSKESA-N 1 2 233.290 2.267 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1cccc2ccnn21 ZINC001138804595 991064014 /nfs/dbraw/zinc/06/40/14/991064014.db2.gz OOFCQJYUQPRDCQ-MNOVXSKESA-N 1 2 233.290 2.267 20 0 BEADLO Cc1cc(C[N@@H+]2CCCC[C@](C)(F)C2)nn1C ZINC001138826666 991081192 /nfs/dbraw/zinc/08/11/92/991081192.db2.gz NOZAKEXGYGYWKB-ZDUSSCGKSA-N 1 2 239.338 2.443 20 0 BEADLO Cc1cc(C[N@H+]2CCCC[C@](C)(F)C2)nn1C ZINC001138826666 991081204 /nfs/dbraw/zinc/08/12/04/991081204.db2.gz NOZAKEXGYGYWKB-ZDUSSCGKSA-N 1 2 239.338 2.443 20 0 BEADLO CCCN(CCC)C(=O)Cn1c[nH+]c(CC)c1 ZINC001559465897 991113041 /nfs/dbraw/zinc/11/30/41/991113041.db2.gz FSFCGLJCSBDZAG-UHFFFAOYSA-N 1 2 237.347 2.094 20 0 BEADLO CSCC[C@H](C)[NH2+][C@@H](C)C(=O)OC(C)C ZINC001258199010 991115770 /nfs/dbraw/zinc/11/57/70/991115770.db2.gz AZIGQQHMSNKBTP-UWVGGRQHSA-N 1 2 233.377 2.058 20 0 BEADLO CCCOc1ccccc1C[NH+]1CC(C)(O)C1 ZINC001138994878 991121100 /nfs/dbraw/zinc/12/11/00/991121100.db2.gz AZKHTAMVBVNMBY-UHFFFAOYSA-N 1 2 235.327 2.042 20 0 BEADLO Clc1cc(C[NH+]2CC=CC2)cc2c1OCO2 ZINC001139073099 991135803 /nfs/dbraw/zinc/13/58/03/991135803.db2.gz ZIPLRHLTGOXNSE-UHFFFAOYSA-N 1 2 237.686 2.441 20 0 BEADLO CC(C)CCc1nnc([C@@H](C)n2cc[nH+]c2)o1 ZINC001258290990 991230637 /nfs/dbraw/zinc/23/06/37/991230637.db2.gz ZKRDPBFQDYTEGX-SNVBAGLBSA-N 1 2 234.303 2.464 20 0 BEADLO CC[C@H]([NH2+]C/C=C(/C)COC)c1noc(C)n1 ZINC001559737960 991232720 /nfs/dbraw/zinc/23/27/20/991232720.db2.gz RPUYLBMHUJQFEP-WDDYJBPVSA-N 1 2 239.319 2.011 20 0 BEADLO CCOc1ccc(C)cc1C[NH+]1CCN(C)CC1 ZINC001139602890 991287138 /nfs/dbraw/zinc/28/71/38/991287138.db2.gz YOQWCEHNQHXWQI-UHFFFAOYSA-N 1 2 248.370 2.141 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2cnc3cccnc3c2)C1 ZINC001139737897 991350751 /nfs/dbraw/zinc/35/07/51/991350751.db2.gz CGMPHGVSKLJSSU-LLVKDONJSA-N 1 2 231.274 2.174 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2cnc3cccnc3c2)C1 ZINC001139737897 991350755 /nfs/dbraw/zinc/35/07/55/991350755.db2.gz CGMPHGVSKLJSSU-LLVKDONJSA-N 1 2 231.274 2.174 20 0 BEADLO COCc1ccc(C[N@@H+]2CCO[C@@H](C)C2)s1 ZINC001139826259 991384810 /nfs/dbraw/zinc/38/48/10/991384810.db2.gz UBCYLCVJFZGTIS-JTQLQIEISA-N 1 2 241.356 2.115 20 0 BEADLO COCc1ccc(C[N@H+]2CCO[C@@H](C)C2)s1 ZINC001139826259 991384819 /nfs/dbraw/zinc/38/48/19/991384819.db2.gz UBCYLCVJFZGTIS-JTQLQIEISA-N 1 2 241.356 2.115 20 0 BEADLO C[C@H](C(=O)N1[C@@H](C)CCC1(C)C)n1cc[nH+]c1 ZINC001328408158 991390676 /nfs/dbraw/zinc/39/06/76/991390676.db2.gz WTGAGFGPDJXZKI-WDEREUQCSA-N 1 2 235.331 2.234 20 0 BEADLO C[C@@H](C(=O)N1[C@H](C)CCC1(C)C)n1cc[nH+]c1 ZINC001328408153 991392275 /nfs/dbraw/zinc/39/22/75/991392275.db2.gz WTGAGFGPDJXZKI-MNOVXSKESA-N 1 2 235.331 2.234 20 0 BEADLO CC(=O)[C@H]1CCCC[N@@H+]1Cc1ccc(C)cn1 ZINC001139842202 991398236 /nfs/dbraw/zinc/39/82/36/991398236.db2.gz AJXHCNZCUZWBRQ-CQSZACIVSA-N 1 2 232.327 2.334 20 0 BEADLO CC(=O)[C@H]1CCCC[N@H+]1Cc1ccc(C)cn1 ZINC001139842202 991398241 /nfs/dbraw/zinc/39/82/41/991398241.db2.gz AJXHCNZCUZWBRQ-CQSZACIVSA-N 1 2 232.327 2.334 20 0 BEADLO C[C@@H](CC1CC1)[N@@H+]1CCOCC(F)(F)C1 ZINC001258460158 991412667 /nfs/dbraw/zinc/41/26/67/991412667.db2.gz AFMRSWZNZZFFDC-VIFPVBQESA-N 1 2 219.275 2.143 20 0 BEADLO C[C@@H](CC1CC1)[N@H+]1CCOCC(F)(F)C1 ZINC001258460158 991412678 /nfs/dbraw/zinc/41/26/78/991412678.db2.gz AFMRSWZNZZFFDC-VIFPVBQESA-N 1 2 219.275 2.143 20 0 BEADLO COc1cc(C[NH2+][C@@H](C)c2ncccc2C)on1 ZINC001560221304 991425085 /nfs/dbraw/zinc/42/50/85/991425085.db2.gz RGXCIZWGNRTJTG-JTQLQIEISA-N 1 2 247.298 2.237 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ccno2)cn1 ZINC001139934260 991426127 /nfs/dbraw/zinc/42/61/27/991426127.db2.gz KMRZMOBBJQGTDE-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ccno2)cn1 ZINC001139934260 991426132 /nfs/dbraw/zinc/42/61/32/991426132.db2.gz KMRZMOBBJQGTDE-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1n[nH]cc1C[NH2+]Cc1nc2ccccc2o1 ZINC001560262636 991444441 /nfs/dbraw/zinc/44/44/41/991444441.db2.gz KUTGFCCWUCFBAH-UHFFFAOYSA-N 1 2 242.282 2.149 20 0 BEADLO COc1ccccc1C[N@H+](C)Cc1cccnn1 ZINC001139972753 991444462 /nfs/dbraw/zinc/44/44/62/991444462.db2.gz FEDIKJREOFYGIN-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1ccccc1C[N@@H+](C)Cc1cccnn1 ZINC001139972753 991444466 /nfs/dbraw/zinc/44/44/66/991444466.db2.gz FEDIKJREOFYGIN-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO C[N@H+](Cc1ccncc1)Cc1cnc(Cl)nc1 ZINC001139988167 991469752 /nfs/dbraw/zinc/46/97/52/991469752.db2.gz QSCLXYFJUVWGPX-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[N@@H+](Cc1ccncc1)Cc1cnc(Cl)nc1 ZINC001139988167 991469757 /nfs/dbraw/zinc/46/97/57/991469757.db2.gz QSCLXYFJUVWGPX-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO Nc1nccnc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC001140011879 991481123 /nfs/dbraw/zinc/48/11/23/991481123.db2.gz JAILKVRQKAQJMS-ZDUSSCGKSA-N 1 2 240.310 2.006 20 0 BEADLO Nc1nccnc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC001140011879 991481130 /nfs/dbraw/zinc/48/11/30/991481130.db2.gz JAILKVRQKAQJMS-ZDUSSCGKSA-N 1 2 240.310 2.006 20 0 BEADLO CC1(C)CC[C@H]([N@@H+]2CC[C@@H](O)C(F)(F)C2)C1 ZINC001258604419 991513308 /nfs/dbraw/zinc/51/33/08/991513308.db2.gz CQZSZTHWFUVUHL-VHSXEESVSA-N 1 2 233.302 2.267 20 0 BEADLO CC1(C)CC[C@H]([N@H+]2CC[C@@H](O)C(F)(F)C2)C1 ZINC001258604419 991513319 /nfs/dbraw/zinc/51/33/19/991513319.db2.gz CQZSZTHWFUVUHL-VHSXEESVSA-N 1 2 233.302 2.267 20 0 BEADLO CC1(C)CC[C@H](N2CC[NH2+]CC(F)(F)C2)C1 ZINC001258603063 991516660 /nfs/dbraw/zinc/51/66/60/991516660.db2.gz SSBMNRXECXSVSQ-JTQLQIEISA-N 1 2 232.318 2.106 20 0 BEADLO C[C@@H](Cc1cccnc1)[NH2+][C@H]1CC1(F)F ZINC001258608869 991524075 /nfs/dbraw/zinc/52/40/75/991524075.db2.gz GMFWSEFAHHMDHL-WPRPVWTQSA-N 1 2 212.243 2.010 20 0 BEADLO C[C@@H](CCc1ccccc1)C[NH2+]Cc1ncn[nH]1 ZINC001560626754 991528496 /nfs/dbraw/zinc/52/84/96/991528496.db2.gz ZPJBICCXVRIWDV-LBPRGKRZSA-N 1 2 244.342 2.163 20 0 BEADLO Cc1cc(C[NH+]2CC3(C2)CCCO3)c(C)cc1O ZINC001140199083 991564434 /nfs/dbraw/zinc/56/44/34/991564434.db2.gz FIPMEUUJYKGBGJ-UHFFFAOYSA-N 1 2 247.338 2.374 20 0 BEADLO c1[nH]cc(Cc2nnc(CC3CCCC3)o2)[nH+]1 ZINC001258627398 991565677 /nfs/dbraw/zinc/56/56/77/991565677.db2.gz FXXOGXJSPNFMME-UHFFFAOYSA-N 1 2 232.287 2.116 20 0 BEADLO c1[nH]cc(CCc2nnc(CC3CCCC3)o2)[nH+]1 ZINC001258627996 991566236 /nfs/dbraw/zinc/56/62/36/991566236.db2.gz NVICCGFGUMQUSL-UHFFFAOYSA-N 1 2 246.314 2.311 20 0 BEADLO C[C@@H](c1nnc(CC2CCCC2)o1)[NH+](C)C ZINC001258640962 991582720 /nfs/dbraw/zinc/58/27/20/991582720.db2.gz XZFIBSDGSFWQMQ-VIFPVBQESA-N 1 2 223.320 2.425 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@H]3CCCC[C@H]3C2)no1 ZINC001317881943 991597000 /nfs/dbraw/zinc/59/70/00/991597000.db2.gz YFYIYGFFMCHDRR-RYUDHWBXSA-N 1 2 235.331 2.390 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@H]3CCCC[C@H]3C2)no1 ZINC001317881943 991597012 /nfs/dbraw/zinc/59/70/12/991597012.db2.gz YFYIYGFFMCHDRR-RYUDHWBXSA-N 1 2 235.331 2.390 20 0 BEADLO Cc1ccc2n[nH]c(C[N@@H+]3CC[C@H](F)C3)c2c1 ZINC001140328836 991604889 /nfs/dbraw/zinc/60/48/89/991604889.db2.gz MMWKEDAMJIKXET-JTQLQIEISA-N 1 2 233.290 2.415 20 0 BEADLO Cc1ccc2n[nH]c(C[N@H+]3CC[C@H](F)C3)c2c1 ZINC001140328836 991604894 /nfs/dbraw/zinc/60/48/94/991604894.db2.gz MMWKEDAMJIKXET-JTQLQIEISA-N 1 2 233.290 2.415 20 0 BEADLO CCCC(=O)NC1C[NH+](Cc2ccc(C)cc2)C1 ZINC001317995701 991605601 /nfs/dbraw/zinc/60/56/01/991605601.db2.gz UBZMHUBEUMPYRB-UHFFFAOYSA-N 1 2 246.354 2.096 20 0 BEADLO C[C@H](C(=O)N(C)[C@H](C)C(C)(C)C)n1cc[nH+]c1 ZINC001317998778 991607904 /nfs/dbraw/zinc/60/79/04/991607904.db2.gz OQHBWIUSZXDGPQ-GHMZBOCLSA-N 1 2 237.347 2.337 20 0 BEADLO CCCC(C)(C)NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001318071458 991616489 /nfs/dbraw/zinc/61/64/89/991616489.db2.gz TVTZZCVCZJIMBD-JTQLQIEISA-N 1 2 223.320 2.139 20 0 BEADLO C[C@H](C(=O)N[C@H]1CCC[C@@H](C)[C@@H]1C)n1cc[nH+]c1 ZINC001318097230 991624204 /nfs/dbraw/zinc/62/42/04/991624204.db2.gz QQAWQRPCDZEROO-XQHKEYJVSA-N 1 2 249.358 2.385 20 0 BEADLO c1coc(C[N@H+](Cc2ccncn2)C2CC2)c1 ZINC001140350625 991627852 /nfs/dbraw/zinc/62/78/52/991627852.db2.gz NVWBIDZXZXIODB-UHFFFAOYSA-N 1 2 229.283 2.234 20 0 BEADLO c1coc(C[N@@H+](Cc2ccncn2)C2CC2)c1 ZINC001140350625 991627855 /nfs/dbraw/zinc/62/78/55/991627855.db2.gz NVWBIDZXZXIODB-UHFFFAOYSA-N 1 2 229.283 2.234 20 0 BEADLO c1cc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)cc2c1CCC2 ZINC001203035259 991638263 /nfs/dbraw/zinc/63/82/63/991638263.db2.gz XHHICEHGJGMLDR-LSDHHAIUSA-N 1 2 229.323 2.148 20 0 BEADLO c1cc(C[N@H+]2CCO[C@@H]3C[C@@H]32)cc2c1CCC2 ZINC001203035259 991638266 /nfs/dbraw/zinc/63/82/66/991638266.db2.gz XHHICEHGJGMLDR-LSDHHAIUSA-N 1 2 229.323 2.148 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1nc(Cl)ccc1C ZINC001140448760 991640435 /nfs/dbraw/zinc/64/04/35/991640435.db2.gz QBQJIVMGVSWVKL-SNVBAGLBSA-N 1 2 240.734 2.264 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1nc(Cl)ccc1C ZINC001140448760 991640443 /nfs/dbraw/zinc/64/04/43/991640443.db2.gz QBQJIVMGVSWVKL-SNVBAGLBSA-N 1 2 240.734 2.264 20 0 BEADLO C[C@H](CCO)[N@H+](C)Cc1c(Cl)ccnc1F ZINC001560912519 991648672 /nfs/dbraw/zinc/64/86/72/991648672.db2.gz JDGCIZBOALGXNA-MRVPVSSYSA-N 1 2 246.713 2.077 20 0 BEADLO C[C@H](CCO)[N@@H+](C)Cc1c(Cl)ccnc1F ZINC001560912519 991648677 /nfs/dbraw/zinc/64/86/77/991648677.db2.gz JDGCIZBOALGXNA-MRVPVSSYSA-N 1 2 246.713 2.077 20 0 BEADLO CO[C@@H]1CC[N@H+](Cc2c(F)cc(F)cc2F)C1 ZINC001140529823 991662465 /nfs/dbraw/zinc/66/24/65/991662465.db2.gz IZRCFVIDAZKPMG-SECBINFHSA-N 1 2 245.244 2.325 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2c(F)cc(F)cc2F)C1 ZINC001140529823 991662467 /nfs/dbraw/zinc/66/24/67/991662467.db2.gz IZRCFVIDAZKPMG-SECBINFHSA-N 1 2 245.244 2.325 20 0 BEADLO OC[C@H]1CCC[N@@H+]1Cc1c(F)cc(F)cc1F ZINC001140530000 991662599 /nfs/dbraw/zinc/66/25/99/991662599.db2.gz LPBRZASEHJAZAT-SECBINFHSA-N 1 2 245.244 2.061 20 0 BEADLO OC[C@H]1CCC[N@H+]1Cc1c(F)cc(F)cc1F ZINC001140530000 991662601 /nfs/dbraw/zinc/66/26/01/991662601.db2.gz LPBRZASEHJAZAT-SECBINFHSA-N 1 2 245.244 2.061 20 0 BEADLO Nc1cc(N[C@@H]2CCc3cc(F)ccc32)[nH+]cn1 ZINC001318519232 991670762 /nfs/dbraw/zinc/67/07/62/991670762.db2.gz MUJLRANBLZPCKN-LLVKDONJSA-N 1 2 244.273 2.297 20 0 BEADLO CC[C@H]1CCCN(C(=O)[C@@H](C)n2cc[nH+]c2)CC1 ZINC001318898377 991728898 /nfs/dbraw/zinc/72/88/98/991728898.db2.gz VFIXUOJARBUJPQ-OLZOCXBDSA-N 1 2 249.358 2.483 20 0 BEADLO CC[C@H](C)C[C@H](CC)[NH2+]C1(C(=O)OC)CC1 ZINC001258779139 991743204 /nfs/dbraw/zinc/74/32/04/991743204.db2.gz UMYAGQWAFXJSAH-QWRGUYRKSA-N 1 2 227.348 2.496 20 0 BEADLO CC[C@H](C)C[C@H](CC)[N@H+]1CCOC(=O)C1 ZINC001258798087 991792241 /nfs/dbraw/zinc/79/22/41/991792241.db2.gz QPFPBTIMXJFGJO-QWRGUYRKSA-N 1 2 213.321 2.060 20 0 BEADLO CC[C@H](C)C[C@H](CC)[N@@H+]1CCOC(=O)C1 ZINC001258798087 991792228 /nfs/dbraw/zinc/79/22/28/991792228.db2.gz QPFPBTIMXJFGJO-QWRGUYRKSA-N 1 2 213.321 2.060 20 0 BEADLO CC[C@@]1(C)CCCN(C(=O)Cc2[nH]c[nH+]c2C)C1 ZINC001566003062 991821351 /nfs/dbraw/zinc/82/13/51/991821351.db2.gz PKMJZDWWIIGBNO-AWEZNQCLSA-N 1 2 249.358 2.299 20 0 BEADLO CC(C)CC1(CNC(=O)[C@@H](C)n2cc[nH+]c2)CC1 ZINC001319246163 991825268 /nfs/dbraw/zinc/82/52/68/991825268.db2.gz SPDXRHQVZNZAAN-GFCCVEGCSA-N 1 2 249.358 2.387 20 0 BEADLO Cc1[nH]c(CNC(=O)c2ccc(F)cc2)[nH+]c1C ZINC001566257362 991834722 /nfs/dbraw/zinc/83/47/22/991834722.db2.gz QJBUCWYYIJVQFJ-UHFFFAOYSA-N 1 2 247.273 2.096 20 0 BEADLO Cc1ccnc(C[N@@H+]2CC(C)(C)C2(C)C)n1 ZINC001319599010 991904256 /nfs/dbraw/zinc/90/42/56/991904256.db2.gz GOXZUNGIMMIRMZ-UHFFFAOYSA-N 1 2 219.332 2.405 20 0 BEADLO Cc1ccnc(C[N@H+]2CC(C)(C)C2(C)C)n1 ZINC001319599010 991904265 /nfs/dbraw/zinc/90/42/65/991904265.db2.gz GOXZUNGIMMIRMZ-UHFFFAOYSA-N 1 2 219.332 2.405 20 0 BEADLO CC(C)c1ocnc1C[NH2+][C@@H](C)c1cnn(C)c1 ZINC001320088002 992098920 /nfs/dbraw/zinc/09/89/20/992098920.db2.gz GATUGKYQOSNFNQ-JTQLQIEISA-N 1 2 248.330 2.382 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@@H](C)c2cccnc2)[nH]n1 ZINC001320138823 992112528 /nfs/dbraw/zinc/11/25/28/992112528.db2.gz YNFGEGNEQULSIP-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO Cc1cc(C[N@H+](C)[C@@H](C)c2cccnc2)[nH]n1 ZINC001320138823 992112529 /nfs/dbraw/zinc/11/25/29/992112529.db2.gz YNFGEGNEQULSIP-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO C[C@H](C(=O)N1CCC2(CCC2)CC1)n1cc[nH+]c1 ZINC001261115656 992179654 /nfs/dbraw/zinc/17/96/54/992179654.db2.gz IKQUBNAVUIISLB-GFCCVEGCSA-N 1 2 247.342 2.237 20 0 BEADLO CCc1cc(NC(=O)Cc2c[nH]c[nH+]2)ccc1F ZINC001568800623 992219163 /nfs/dbraw/zinc/21/91/63/992219163.db2.gz FMWJTJHHSGLSRU-UHFFFAOYSA-N 1 2 247.273 2.292 20 0 BEADLO C[C@@H]1CC=CC[C@H]1COC(=O)[C@@H]1CCCC[NH2+]1 ZINC001573633773 992661420 /nfs/dbraw/zinc/66/14/20/992661420.db2.gz BBKBOMLGSVSCEX-AGIUHOORSA-N 1 2 237.343 2.274 20 0 BEADLO CC[C@H](OC(=O)C[NH2+]C)c1ccc(F)cc1F ZINC001573709836 992682096 /nfs/dbraw/zinc/68/20/96/992682096.db2.gz QOVGYIYZZGOESQ-NSHDSACASA-N 1 2 243.253 2.179 20 0 BEADLO CC[C@@H](OC(=O)C[NH2+]C)c1ccc(F)cc1F ZINC001573709835 992683032 /nfs/dbraw/zinc/68/30/32/992683032.db2.gz QOVGYIYZZGOESQ-LLVKDONJSA-N 1 2 243.253 2.179 20 0 BEADLO Cc1ncccc1[C@H](C)OC(=O)[C@H]1CCCC[NH2+]1 ZINC001574192091 992820293 /nfs/dbraw/zinc/82/02/93/992820293.db2.gz OPYSRPNJLDHYKG-WCQYABFASA-N 1 2 248.326 2.136 20 0 BEADLO C[C@H](C(=O)N[C@H]1CCCC2(CC2)C1)n1cc[nH+]c1 ZINC001262347576 992849215 /nfs/dbraw/zinc/84/92/15/992849215.db2.gz JBRAOFBCZCAWEY-NEPJUHHUSA-N 1 2 247.342 2.283 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1noc(CC2(C)CC2)n1 ZINC001262487162 992890796 /nfs/dbraw/zinc/89/07/96/992890796.db2.gz MGIXVHAVZVXWNE-UHFFFAOYSA-N 1 2 244.298 2.365 20 0 BEADLO Cc1nc(NCC2(Br)CC2)cc[nH+]1 ZINC001262706946 993045839 /nfs/dbraw/zinc/04/58/39/993045839.db2.gz CZADUUCATOTODE-UHFFFAOYSA-N 1 2 242.120 2.124 20 0 BEADLO CC(C)CCC(=O)OCCCc1c[nH+]cn1C ZINC001263509907 993351178 /nfs/dbraw/zinc/35/11/78/993351178.db2.gz LNWDELMNYHVGME-UHFFFAOYSA-N 1 2 238.331 2.332 20 0 BEADLO CCCCCOC(=O)NCCCn1cc[nH+]c1 ZINC000586475427 993373652 /nfs/dbraw/zinc/37/36/52/993373652.db2.gz QUGNWLDVNCWMKW-UHFFFAOYSA-N 1 2 239.319 2.190 20 0 BEADLO COc1cc2[nH+]c([C@H]3CCOC3)[nH]c2cc1C ZINC000586912835 993417196 /nfs/dbraw/zinc/41/71/96/993417196.db2.gz WUDFSJTUFNGQOR-VIFPVBQESA-N 1 2 232.283 2.384 20 0 BEADLO C[N@@H+](Cc1cn[nH]n1)C[C@H]1CC2CCC1CC2 ZINC001576860657 993440064 /nfs/dbraw/zinc/44/00/64/993440064.db2.gz YKYLAJJZEUOWGL-HTAVTVPLSA-N 1 2 234.347 2.063 20 0 BEADLO C[N@H+](Cc1cn[nH]n1)C[C@H]1CC2CCC1CC2 ZINC001576860657 993440070 /nfs/dbraw/zinc/44/00/70/993440070.db2.gz YKYLAJJZEUOWGL-HTAVTVPLSA-N 1 2 234.347 2.063 20 0 BEADLO CCn1cccc1C(=O)OCc1c[nH+]cn1CC ZINC001263663219 993454936 /nfs/dbraw/zinc/45/49/36/993454936.db2.gz XRRUPCHAGWJJDX-UHFFFAOYSA-N 1 2 247.298 2.081 20 0 BEADLO COc1cc(-c2ccc[nH+]c2N)ccc1O ZINC000390080912 993776802 /nfs/dbraw/zinc/77/68/02/993776802.db2.gz BRJMYASMXFHTNT-UHFFFAOYSA-N 1 2 216.240 2.045 20 0 BEADLO C[N@H+](Cc1ccc(Cl)nc1)Cc1cccnn1 ZINC000700704586 993846203 /nfs/dbraw/zinc/84/62/03/993846203.db2.gz DFPHBTCZTBWDTB-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[N@@H+](Cc1ccc(Cl)nc1)Cc1cccnn1 ZINC000700704586 993846204 /nfs/dbraw/zinc/84/62/04/993846204.db2.gz DFPHBTCZTBWDTB-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO Fc1ncccc1C[NH+]1CCC(F)(F)CC1 ZINC000725377944 994100822 /nfs/dbraw/zinc/10/08/22/994100822.db2.gz IYDTZFYNODUPIU-UHFFFAOYSA-N 1 2 230.233 2.452 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1cccc(C)c1C ZINC001290430276 994540787 /nfs/dbraw/zinc/54/07/87/994540787.db2.gz ZHDYATZVWGNKRA-ZDUSSCGKSA-N 1 2 232.327 2.336 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1cccc(C)c1C ZINC001290430276 994540804 /nfs/dbraw/zinc/54/08/04/994540804.db2.gz ZHDYATZVWGNKRA-ZDUSSCGKSA-N 1 2 232.327 2.336 20 0 BEADLO C=C/C=C/CC(=O)NCCCNc1cccc[nH+]1 ZINC001293928265 994675057 /nfs/dbraw/zinc/67/50/57/994675057.db2.gz DILUWNMYBJGMRE-ONEGZZNKSA-N 1 2 245.326 2.132 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)[C@H]2C[C@H]2C(C)C)[nH+]1 ZINC001304108353 995188209 /nfs/dbraw/zinc/18/82/09/995188209.db2.gz UGRYTYBKDYBLAN-RYUDHWBXSA-N 1 2 249.358 2.441 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)[C@H]2C[C@H]2C(C)C)c[nH+]1 ZINC001304108353 995188225 /nfs/dbraw/zinc/18/82/25/995188225.db2.gz UGRYTYBKDYBLAN-RYUDHWBXSA-N 1 2 249.358 2.441 20 0 BEADLO CCNc1ccc(Nc2cnc(F)cn2)c[nH+]1 ZINC001307234877 995306491 /nfs/dbraw/zinc/30/64/91/995306491.db2.gz QAHLPAGOKWFNDB-UHFFFAOYSA-N 1 2 233.250 2.186 20 0 BEADLO CCO[C@H](Cn1c[nH+]c(CC)c1)C1CC1 ZINC001307397828 995342684 /nfs/dbraw/zinc/34/26/84/995342684.db2.gz WAYXZKNFKSVSFI-GFCCVEGCSA-N 1 2 208.305 2.261 20 0 BEADLO Cc1ccccc1[C@H](CO)[NH2+]Cc1nccs1 ZINC001307678110 995431828 /nfs/dbraw/zinc/43/18/28/995431828.db2.gz FIJOUIUFTNQVPZ-LBPRGKRZSA-N 1 2 248.351 2.275 20 0 BEADLO CCOc1cncc(CNc2cccc[nH+]2)c1 ZINC001308212197 995597853 /nfs/dbraw/zinc/59/78/53/995597853.db2.gz TXUKWUPJDAFYLO-UHFFFAOYSA-N 1 2 229.283 2.487 20 0 BEADLO Nc1ccc(Nc2ccc3c(c2)OCCO3)c[nH+]1 ZINC000020585445 1170127052 /nfs/dbraw/zinc/12/70/52/1170127052.db2.gz TZLRJKFVWSTIAR-UHFFFAOYSA-N 1 2 243.266 2.179 20 0 BEADLO CCCCCC[C@@H](C)[NH2+]CC(=O)OC ZINC000020359850 1170153445 /nfs/dbraw/zinc/15/34/45/1170153445.db2.gz PNACULLZQVYZME-SNVBAGLBSA-N 1 2 201.310 2.108 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@H]1CC[C@@H](C)[C@@H](C)C1 ZINC001611259768 1170432887 /nfs/dbraw/zinc/43/28/87/1170432887.db2.gz CWWXCJUCJXNDMS-JFGNBEQYSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@H]1CC[C@@H](C)[C@H](C)C1 ZINC001611259765 1170433223 /nfs/dbraw/zinc/43/32/23/1170433223.db2.gz CWWXCJUCJXNDMS-CKYFFXLPSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@H]1CC[C@H](C)[C@H](C)C1 ZINC001611259766 1170433154 /nfs/dbraw/zinc/43/31/54/1170433154.db2.gz CWWXCJUCJXNDMS-HOSYDEDBSA-N 1 2 249.358 2.202 20 0 BEADLO CC[C@@H]1CCN(C(=O)[C@@H](C)Cc2c[nH]c[nH+]2)[C@H]1C ZINC001616974296 1170573725 /nfs/dbraw/zinc/57/37/25/1170573725.db2.gz LCWLXNQAAQNFNE-SDDRHHMPSA-N 1 2 249.358 2.235 20 0 BEADLO CC[C@@H]1CCN(C(=O)[C@@H](C)Cc2c[nH+]c[nH]2)[C@H]1C ZINC001616974296 1170573729 /nfs/dbraw/zinc/57/37/29/1170573729.db2.gz LCWLXNQAAQNFNE-SDDRHHMPSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H](O)CCC[N@@H+]1CC(F)(F)CC[C@H]1C ZINC001620664310 1170698968 /nfs/dbraw/zinc/69/89/68/1170698968.db2.gz CMDXKTQYZPCODZ-NXEZZACHSA-N 1 2 221.291 2.267 20 0 BEADLO C[C@@H](O)CCC[N@H+]1CC(F)(F)CC[C@H]1C ZINC001620664310 1170698972 /nfs/dbraw/zinc/69/89/72/1170698972.db2.gz CMDXKTQYZPCODZ-NXEZZACHSA-N 1 2 221.291 2.267 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)OC2CCC2)[nH+]1 ZINC001622611165 1170896458 /nfs/dbraw/zinc/89/64/58/1170896458.db2.gz BLWKNDYHNHJTMY-UHFFFAOYSA-N 1 2 237.303 2.312 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)OC2CCC2)c[nH+]1 ZINC001622611165 1170896469 /nfs/dbraw/zinc/89/64/69/1170896469.db2.gz BLWKNDYHNHJTMY-UHFFFAOYSA-N 1 2 237.303 2.312 20 0 BEADLO CCCCCC[C@H](C)[NH2+]CC(=O)OCC ZINC000037394144 1170941093 /nfs/dbraw/zinc/94/10/93/1170941093.db2.gz FSWDOCSDAMVSDR-NSHDSACASA-N 1 2 215.337 2.498 20 0 BEADLO Cc1cccc(NC(=O)Cc2[nH]cc[nH+]2)c1C ZINC001623660994 1170965569 /nfs/dbraw/zinc/96/55/69/1170965569.db2.gz UHHMSWANFVXISU-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO CSc1ccccc1NC(=O)Cc1c[nH]c[nH+]1 ZINC001623799813 1170974212 /nfs/dbraw/zinc/97/42/12/1170974212.db2.gz VLTWMIRXJMGLDE-UHFFFAOYSA-N 1 2 247.323 2.313 20 0 BEADLO Cc1cccc(F)c1NC(=O)Cc1[nH]cc[nH+]1 ZINC001624112005 1171012449 /nfs/dbraw/zinc/01/24/49/1171012449.db2.gz PWDYXZZSWHBIRB-UHFFFAOYSA-N 1 2 233.246 2.038 20 0 BEADLO CC(C)c1coc(NC(=O)[C@H](C)n2cc[nH+]c2)n1 ZINC001627978698 1171197549 /nfs/dbraw/zinc/19/75/49/1171197549.db2.gz LRPBDPDFBGZUNJ-VIFPVBQESA-N 1 2 248.286 2.194 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1C[C@H](C)CCC[C@@H]1C ZINC001628176236 1171213063 /nfs/dbraw/zinc/21/30/63/1171213063.db2.gz WYJDXLYWBAANCM-MNOVXSKESA-N 1 2 249.358 2.298 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C1CC1)C1CCCC1 ZINC001628461718 1171243185 /nfs/dbraw/zinc/24/31/85/1171243185.db2.gz MDFDBYFPHBHKCP-UHFFFAOYSA-N 1 2 247.342 2.194 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@H]1C[C@H](C)C[C@H](C)C1 ZINC001629577828 1171329022 /nfs/dbraw/zinc/32/90/22/1171329022.db2.gz RFOVLCXHLWGWIN-IAZYJMLFSA-N 1 2 249.358 2.202 20 0 BEADLO CC[C@@H](CC(F)F)C(=O)NCc1[nH]c[nH+]c1C ZINC001630479672 1171396668 /nfs/dbraw/zinc/39/66/68/1171396668.db2.gz CUSGPWZBTXFQBV-QMMMGPOBSA-N 1 2 245.273 2.016 20 0 BEADLO C[C@@H](C(=O)N1CCCCCCC1)n1cc[nH+]c1 ZINC000044874231 1171421553 /nfs/dbraw/zinc/42/15/53/1171421553.db2.gz PMCPTHXNPKWCPC-LBPRGKRZSA-N 1 2 235.331 2.237 20 0 BEADLO C[C@@H](C(=O)N(C)Cc1ccsc1)n1cc[nH+]c1 ZINC000044946225 1171425740 /nfs/dbraw/zinc/42/57/40/1171425740.db2.gz VTMVLJPUMXCBSY-JTQLQIEISA-N 1 2 249.339 2.164 20 0 BEADLO CCCCN(CC)C(=O)[C@H](C)n1cc[nH+]c1 ZINC000044983699 1171430962 /nfs/dbraw/zinc/43/09/62/1171430962.db2.gz BEIJWMFBAABVTN-NSHDSACASA-N 1 2 223.320 2.093 20 0 BEADLO COC(=O)CCc1c[nH+]cn1Cc1ccccc1 ZINC000045390651 1171445097 /nfs/dbraw/zinc/44/50/97/1171445097.db2.gz FEWHBUJYQHXFMV-UHFFFAOYSA-N 1 2 244.294 2.037 20 0 in-vivo BEADLO Cc1ccsc1CNC(=O)[C@@H](C)n1cc[nH+]c1 ZINC000045883692 1171464848 /nfs/dbraw/zinc/46/48/48/1171464848.db2.gz LUESCNRJWXPWRH-SNVBAGLBSA-N 1 2 249.339 2.130 20 0 BEADLO CC(C)CC[C@H](C)NC(=O)[C@H](C)n1cc[nH+]c1 ZINC000045879006 1171466868 /nfs/dbraw/zinc/46/68/68/1171466868.db2.gz CJYUHUPCWVXQFO-RYUDHWBXSA-N 1 2 237.347 2.385 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@H]3CCCC[C@@H]3C2)no1 ZINC000045914744 1171467159 /nfs/dbraw/zinc/46/71/59/1171467159.db2.gz YFYIYGFFMCHDRR-VXGBXAGGSA-N 1 2 235.331 2.390 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@H]3CCCC[C@@H]3C2)no1 ZINC000045914744 1171467161 /nfs/dbraw/zinc/46/71/61/1171467161.db2.gz YFYIYGFFMCHDRR-VXGBXAGGSA-N 1 2 235.331 2.390 20 0 BEADLO C[C@@H](NC(=O)Cc1[nH]cc[nH+]1)C1CCCCCC1 ZINC001633719287 1171599144 /nfs/dbraw/zinc/59/91/44/1171599144.db2.gz AXGUOODMMYODKQ-LLVKDONJSA-N 1 2 249.358 2.427 20 0 BEADLO Cc1ccc(NC(=O)[C@@H](C)n2cc[nH+]c2)cc1 ZINC000048481980 1171617540 /nfs/dbraw/zinc/61/75/40/1171617540.db2.gz WZEGMQPLDCAPST-LLVKDONJSA-N 1 2 229.283 2.391 20 0 BEADLO Cc1cccc(CNC(=O)[C@@H](C)n2cc[nH+]c2)c1 ZINC000048560963 1171623122 /nfs/dbraw/zinc/62/31/22/1171623122.db2.gz RGQNVNCTFDQHQY-GFCCVEGCSA-N 1 2 243.310 2.069 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@H](C)CC(C)C)c[nH+]1 ZINC001635610168 1171741629 /nfs/dbraw/zinc/74/16/29/1171741629.db2.gz DKVXKQQCCKSRRL-SNVBAGLBSA-N 1 2 237.347 2.271 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@H](C)CC(C)C)[nH+]1 ZINC001635610168 1171741639 /nfs/dbraw/zinc/74/16/39/1171741639.db2.gz DKVXKQQCCKSRRL-SNVBAGLBSA-N 1 2 237.347 2.271 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@H](C)[C@H](C)CC)c[nH+]1 ZINC001635610302 1171739825 /nfs/dbraw/zinc/73/98/25/1171739825.db2.gz GTTRTZRBPIGHBQ-NXEZZACHSA-N 1 2 237.347 2.271 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@H](C)[C@H](C)CC)[nH+]1 ZINC001635610302 1171739838 /nfs/dbraw/zinc/73/98/38/1171739838.db2.gz GTTRTZRBPIGHBQ-NXEZZACHSA-N 1 2 237.347 2.271 20 0 BEADLO CCc1[nH]c(CNC(=O)c2c(C)coc2C)c[nH+]1 ZINC001635610963 1171743493 /nfs/dbraw/zinc/74/34/93/1171743493.db2.gz YMUPZFVOAVONON-UHFFFAOYSA-N 1 2 247.298 2.112 20 0 BEADLO CCc1[nH]cc(CNC(=O)c2c(C)coc2C)[nH+]1 ZINC001635610963 1171743497 /nfs/dbraw/zinc/74/34/97/1171743497.db2.gz YMUPZFVOAVONON-UHFFFAOYSA-N 1 2 247.298 2.112 20 0 BEADLO C[C@@H](C(=O)N(C)C(C1CC1)C1CC1)n1cc[nH+]c1 ZINC000050681711 1171825086 /nfs/dbraw/zinc/82/50/86/1171825086.db2.gz FBOFAAGGYYTTBM-JTQLQIEISA-N 1 2 247.342 2.091 20 0 BEADLO CC(C)[C@H]1CCCCCN1C(=O)Cn1cc[nH+]c1 ZINC001637378264 1171924304 /nfs/dbraw/zinc/92/43/04/1171924304.db2.gz LNVSQODRSRXUFV-CYBMUJFWSA-N 1 2 249.358 2.310 20 0 BEADLO Cc1c(Cl)c(C[NH2+][C@H]2C[C@@H]2C(F)F)nn1C ZINC000421356841 192321304 /nfs/dbraw/zinc/32/13/04/192321304.db2.gz MDTORGWPZAZUCQ-BQBZGAKWSA-N 1 2 249.692 2.125 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccco1)c1ccn(C)n1 ZINC000336742720 398143857 /nfs/dbraw/zinc/14/38/57/398143857.db2.gz SGOBREMOPHUVMN-LLVKDONJSA-N 1 2 219.288 2.254 20 0 BEADLO C[C@H]1CC[C@@H](CNC(=O)C(C)(C)c2c[nH]c[nH+]2)C1 ZINC000621987460 370645078 /nfs/dbraw/zinc/64/50/78/370645078.db2.gz WDJOPDRWIZRKOD-WDEREUQCSA-N 1 2 249.358 2.240 20 0 BEADLO C[C@H](CC(=O)N[C@@H](C)C1CCC1)n1cc[nH+]c1 ZINC000649865338 398146326 /nfs/dbraw/zinc/14/63/26/398146326.db2.gz UHOARQODSNWBKC-MNOVXSKESA-N 1 2 235.331 2.139 20 0 BEADLO Cc1nc(C[N@@H+]2CCCC(C)(C)C2)no1 ZINC000112702762 398147649 /nfs/dbraw/zinc/14/76/49/398147649.db2.gz HDSKJFGJHZFQGM-UHFFFAOYSA-N 1 2 209.293 2.000 20 0 BEADLO Cc1nc(C[N@H+]2CCCC(C)(C)C2)no1 ZINC000112702762 398147652 /nfs/dbraw/zinc/14/76/52/398147652.db2.gz HDSKJFGJHZFQGM-UHFFFAOYSA-N 1 2 209.293 2.000 20 0 BEADLO Cc1cc(N2CCC[C@@](C)(O)C2)nc(C(C)C)[nH+]1 ZINC000161635483 349479108 /nfs/dbraw/zinc/47/91/08/349479108.db2.gz RTIGVBOSIQOMDX-CQSZACIVSA-N 1 2 249.358 2.260 20 0 BEADLO C[C@@H]1CC[C@H](C)N1C(=O)CCCn1cc[nH+]c1 ZINC000161789761 538918553 /nfs/dbraw/zinc/91/85/53/538918553.db2.gz AKXNNVYQAUGPEA-TXEJJXNPSA-N 1 2 235.331 2.063 20 0 BEADLO CCn1cc([C@H](C)[NH2+][C@@H](C)C(F)F)cn1 ZINC000389925551 398149474 /nfs/dbraw/zinc/14/94/74/398149474.db2.gz VVHHDNMZJDTQCD-YUMQZZPRSA-N 1 2 217.263 2.207 20 0 BEADLO CCn1cc([C@@H](C)[NH2+][C@H](C)C(F)F)cn1 ZINC000389925548 398149549 /nfs/dbraw/zinc/14/95/49/398149549.db2.gz VVHHDNMZJDTQCD-HTQZYQBOSA-N 1 2 217.263 2.207 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)no1 ZINC000298433787 178000666 /nfs/dbraw/zinc/00/06/66/178000666.db2.gz YQBPKBGSNSZUJO-MNOVXSKESA-N 1 2 242.269 2.460 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)no1 ZINC000298433787 178000669 /nfs/dbraw/zinc/00/06/69/178000669.db2.gz YQBPKBGSNSZUJO-MNOVXSKESA-N 1 2 242.269 2.460 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@@H](OCC(C)C)C2)no1 ZINC000119681533 178001297 /nfs/dbraw/zinc/00/12/97/178001297.db2.gz OGRHRKCPNINKPQ-CYBMUJFWSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@@H](OCC(C)C)C2)no1 ZINC000119681533 178001299 /nfs/dbraw/zinc/00/12/99/178001299.db2.gz OGRHRKCPNINKPQ-CYBMUJFWSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cc(CN2CCn3c[nH+]cc3C2)ccc1F ZINC000290994665 178004837 /nfs/dbraw/zinc/00/48/37/178004837.db2.gz AGYNMXTUMOQODK-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccc(C)o2)on1 ZINC000044985478 178026654 /nfs/dbraw/zinc/02/66/54/178026654.db2.gz LUNJJJLJMSRTIL-UHFFFAOYSA-N 1 2 206.245 2.174 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccc(C)cn2)on1 ZINC000649898817 398169748 /nfs/dbraw/zinc/16/97/48/398169748.db2.gz ASQZSEQSQFPBHV-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccc(C)cn2)on1 ZINC000649898817 398169749 /nfs/dbraw/zinc/16/97/49/398169749.db2.gz ASQZSEQSQFPBHV-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1csc(C[NH2+]Cc2cc(C)no2)n1 ZINC000082725467 178029733 /nfs/dbraw/zinc/02/97/33/178029733.db2.gz VLRVLBNLECAGFJ-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO Cc1cnc([C@H](C)[NH2+]Cc2cc(C)ncn2)s1 ZINC000293023409 178030556 /nfs/dbraw/zinc/03/05/56/178030556.db2.gz CNITYEUATKIQDK-JTQLQIEISA-N 1 2 248.355 2.401 20 0 BEADLO O=C(Nc1cc[nH+]cc1O)C1CCCCC1 ZINC000109890419 136215469 /nfs/dbraw/zinc/21/54/69/136215469.db2.gz YKFSPGDCMQQFAC-UHFFFAOYSA-N 1 2 220.272 2.306 20 0 BEADLO CCCC[C@@H](COC)[NH2+]Cc1cn[nH]c1C ZINC000265455125 398173350 /nfs/dbraw/zinc/17/33/50/398173350.db2.gz BMCKFLNXSWLXEL-LBPRGKRZSA-N 1 2 225.336 2.013 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2nccs2)on1 ZINC000083143235 178038215 /nfs/dbraw/zinc/03/82/15/178038215.db2.gz CZMLIHFYRBSVED-MRVPVSSYSA-N 1 2 223.301 2.290 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2ccncc2F)nn1C ZINC000338338523 178038297 /nfs/dbraw/zinc/03/82/97/178038297.db2.gz BABXVHPPXULEPG-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cc(C)ncn2)nc1 ZINC000649904044 398174249 /nfs/dbraw/zinc/17/42/49/398174249.db2.gz KATRRIVPCHVUOK-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cc(C)ncn2)nc1 ZINC000649904044 398174253 /nfs/dbraw/zinc/17/42/53/398174253.db2.gz KATRRIVPCHVUOK-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cccc(CCNc2c[nH]c[nH+]2)c1 ZINC000519581911 398174534 /nfs/dbraw/zinc/17/45/34/398174534.db2.gz BIIZJEXFULYXNL-UHFFFAOYSA-N 1 2 201.273 2.373 20 0 BEADLO Cc1cc(C[NH2+][C@](C)(C(N)=O)C(C)C)no1 ZINC000330364214 178041642 /nfs/dbraw/zinc/04/16/42/178041642.db2.gz HGJLDHXBWWIJRU-NSHDSACASA-N 1 2 225.292 2.023 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2CC[C@@]3(CC3(F)F)C2)no1 ZINC000649908309 398184006 /nfs/dbraw/zinc/18/40/06/398184006.db2.gz LNIRGMJJHUKDPI-OIBJUYFYSA-N 1 2 243.257 2.170 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2CC[C@@]3(CC3(F)F)C2)no1 ZINC000649908309 398184008 /nfs/dbraw/zinc/18/40/08/398184008.db2.gz LNIRGMJJHUKDPI-OIBJUYFYSA-N 1 2 243.257 2.170 20 0 BEADLO CC(C)(C)c1nc(NCCCCF)cc[nH+]1 ZINC000390244939 398165131 /nfs/dbraw/zinc/16/51/31/398165131.db2.gz IVHJORJCPXFWPM-UHFFFAOYSA-N 1 2 225.311 2.358 20 0 BEADLO Cc1cc(F)ccc1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000135348224 178082475 /nfs/dbraw/zinc/08/24/75/178082475.db2.gz UKKCNWQVUSRVIE-UHFFFAOYSA-N 1 2 247.273 2.129 20 0 BEADLO Cc1cc(N(C)C(C2CC2)C2CC2)nc[nH+]1 ZINC000112965618 178093670 /nfs/dbraw/zinc/09/36/70/178093670.db2.gz FLEATWCRRKZWFO-UHFFFAOYSA-N 1 2 217.316 2.410 20 0 BEADLO Cc1cc([NH+](C)C)ccc1NCc1ncc[nH]1 ZINC000058930807 178094855 /nfs/dbraw/zinc/09/48/55/178094855.db2.gz OPOKKEUSCAXZNO-UHFFFAOYSA-N 1 2 230.315 2.396 20 0 BEADLO Cc1cc([NH+](C)C)ccc1N[C@@H]1CCOC1 ZINC000070965831 178095025 /nfs/dbraw/zinc/09/50/25/178095025.db2.gz DNNXRGQXJXMHMK-LLVKDONJSA-N 1 2 220.316 2.262 20 0 BEADLO Cc1cccn2cc(CN3CC[C@@H](F)C3)[nH+]c12 ZINC000649943029 398193278 /nfs/dbraw/zinc/19/32/78/398193278.db2.gz XVGIOQYVYQYNEH-LLVKDONJSA-N 1 2 233.290 2.187 20 0 BEADLO Cc1cccn2cc(C[N@@H+]3CC[C@@H](F)C3)nc12 ZINC000649943029 398193281 /nfs/dbraw/zinc/19/32/81/398193281.db2.gz XVGIOQYVYQYNEH-LLVKDONJSA-N 1 2 233.290 2.187 20 0 BEADLO Cc1cccn2cc(C[N@H+]3CC[C@@H](F)C3)nc12 ZINC000649943029 398193286 /nfs/dbraw/zinc/19/32/86/398193286.db2.gz XVGIOQYVYQYNEH-LLVKDONJSA-N 1 2 233.290 2.187 20 0 BEADLO Cc1cc(N(CCO)CC2CC2)nc(C(C)C)[nH+]1 ZINC000301690594 178102613 /nfs/dbraw/zinc/10/26/13/178102613.db2.gz YJDMPLXMKRDDGC-UHFFFAOYSA-N 1 2 249.358 2.117 20 0 BEADLO Cc1cc(N)nc(SC[C@H]2CC[C@H](C)O2)[nH+]1 ZINC000188525279 178108919 /nfs/dbraw/zinc/10/89/19/178108919.db2.gz XLJYUMLFRAYKJM-DTWKUNHWSA-N 1 2 239.344 2.027 20 0 BEADLO Cc1cc(N2CC(C)C2)nc(-c2ccncc2)[nH+]1 ZINC000356112240 178113070 /nfs/dbraw/zinc/11/30/70/178113070.db2.gz GEKCBTBZTBBSKI-UHFFFAOYSA-N 1 2 240.310 2.303 20 0 BEADLO Cc1cc(N2CCOC[C@H](C)C2)nc(C(C)C)[nH+]1 ZINC000338260099 178116146 /nfs/dbraw/zinc/11/61/46/178116146.db2.gz FGCYCSVZNMWYOG-LLVKDONJSA-N 1 2 249.358 2.381 20 0 BEADLO C[C@@H]1OCC[N@H+](Cc2cccc(F)c2N)[C@H]1C ZINC000380586048 398201237 /nfs/dbraw/zinc/20/12/37/398201237.db2.gz QSBKJKVSVHDJFC-UWVGGRQHSA-N 1 2 238.306 2.017 20 0 BEADLO C[C@@H]1OCC[N@@H+](Cc2cccc(F)c2N)[C@H]1C ZINC000380586048 398201240 /nfs/dbraw/zinc/20/12/40/398201240.db2.gz QSBKJKVSVHDJFC-UWVGGRQHSA-N 1 2 238.306 2.017 20 0 BEADLO C[C@@H](c1csnn1)[NH+]1CCC2(CC2)CC1 ZINC000649399977 398202250 /nfs/dbraw/zinc/20/22/50/398202250.db2.gz FAWFKDABGIRZFZ-VIFPVBQESA-N 1 2 223.345 2.475 20 0 BEADLO Cc1cc(N2C[C@@H]3CCCC[C@H]3C2)nc[nH+]1 ZINC000301547640 178120955 /nfs/dbraw/zinc/12/09/55/178120955.db2.gz LNLHODSUOWZCJD-RYUDHWBXSA-N 1 2 217.316 2.411 20 0 BEADLO CCc1cc(N2C[C@@H](C)OC[C@H]2CC)nc(C)[nH+]1 ZINC000272811272 538926680 /nfs/dbraw/zinc/92/66/80/538926680.db2.gz COBBIAYFYPKFOH-ZWNOBZJWSA-N 1 2 249.358 2.351 20 0 BEADLO Cc1cc(N2C[C@H]3CCC[C@@H]3C2)nc[nH+]1 ZINC000301587040 178122501 /nfs/dbraw/zinc/12/25/01/178122501.db2.gz BOLMYUQMTZWCOB-GHMZBOCLSA-N 1 2 203.289 2.021 20 0 BEADLO Cc1noc(C)c1CC(=O)Nc1cc[nH+]c(C)c1 ZINC000074643303 178134811 /nfs/dbraw/zinc/13/48/11/178134811.db2.gz HFUSZHVBFCGJTG-UHFFFAOYSA-N 1 2 245.282 2.176 20 0 BEADLO Cc1cc(NC(=O)C[C@@H]2CCC(=O)[C@H]2C)cc[nH+]1 ZINC000280629144 178134918 /nfs/dbraw/zinc/13/49/18/178134918.db2.gz XDBKIMDFRULIHV-QWRGUYRKSA-N 1 2 246.310 2.334 20 0 BEADLO Cc1cc(NC(=O)NC2(C)CCOCC2)cc[nH+]1 ZINC000182641758 178137188 /nfs/dbraw/zinc/13/71/88/178137188.db2.gz CADOMHAOTNBGNM-UHFFFAOYSA-N 1 2 249.314 2.081 20 0 BEADLO Cc1cc(NC(=O)N2CC[C@@H](C)C2)cc[nH+]1 ZINC000271086977 178137407 /nfs/dbraw/zinc/13/74/07/178137407.db2.gz SWTYVANSTMQDGI-SECBINFHSA-N 1 2 219.288 2.264 20 0 BEADLO Cc1cc(NC(=O)NC[C@H]2C[C@@H]2C)cc[nH+]1 ZINC000271079480 178140445 /nfs/dbraw/zinc/14/04/45/178140445.db2.gz QGQGXSXUXUEYNW-WCBMZHEXSA-N 1 2 219.288 2.168 20 0 BEADLO Cc1cc(NC(=O)NOC2CCCC2)cc[nH+]1 ZINC000271857013 178141249 /nfs/dbraw/zinc/14/12/49/178141249.db2.gz SQGALTGBQUJLLE-UHFFFAOYSA-N 1 2 235.287 2.386 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2CCSC2)cc[nH+]1 ZINC000271132116 178142073 /nfs/dbraw/zinc/14/20/73/178142073.db2.gz NFHYGAMIISEBNK-JTQLQIEISA-N 1 2 237.328 2.017 20 0 BEADLO Cc1noc(C)c1C(=O)Nc1cc[nH+]c(C)c1 ZINC000073053859 178148533 /nfs/dbraw/zinc/14/85/33/178148533.db2.gz SAAHLNHAKKHTAP-UHFFFAOYSA-N 1 2 231.255 2.247 20 0 BEADLO Cc1cc(NC(=O)c2ccnn2C(C)C)cc[nH+]1 ZINC000127171397 178151955 /nfs/dbraw/zinc/15/19/55/178151955.db2.gz DIYDNAVQOAJRJH-UHFFFAOYSA-N 1 2 244.298 2.420 20 0 BEADLO Cc1cc([NH2+]C2CCOCC2)ccc1N ZINC000036319224 178154171 /nfs/dbraw/zinc/15/41/71/178154171.db2.gz CMGPOIIAHVAQMX-UHFFFAOYSA-N 1 2 206.289 2.168 20 0 BEADLO Cc1cc(NC2C[C@H](C)O[C@@H](C)C2)nc[nH+]1 ZINC000301971779 178154714 /nfs/dbraw/zinc/15/47/14/178154714.db2.gz SRICIJWMYXIJNY-UWVGGRQHSA-N 1 2 221.304 2.153 20 0 BEADLO Cc1cc(NCCC(C)(F)F)nc[nH+]1 ZINC000306413423 178158302 /nfs/dbraw/zinc/15/83/02/178158302.db2.gz NDTZPHLTAVWZNB-UHFFFAOYSA-N 1 2 201.220 2.242 20 0 BEADLO Cc1cc(NCCCOCC2CC2)nc[nH+]1 ZINC000225692716 178159389 /nfs/dbraw/zinc/15/93/89/178159389.db2.gz HQHNFOLIOMCROC-UHFFFAOYSA-N 1 2 221.304 2.014 20 0 BEADLO Cc1cc(NCCOCCC(C)C)nc[nH+]1 ZINC000045108098 178162129 /nfs/dbraw/zinc/16/21/29/178162129.db2.gz YMLWZRJPBSIUFZ-UHFFFAOYSA-N 1 2 223.320 2.260 20 0 BEADLO Cc1cc(NCC[C@H]2CCCCO2)nc[nH+]1 ZINC000227316396 178163480 /nfs/dbraw/zinc/16/34/80/178163480.db2.gz BLZINSACCFFGLK-LLVKDONJSA-N 1 2 221.304 2.156 20 0 BEADLO CCc1cc(N[C@@H]2CC23CCOCC3)nc[nH+]1 ZINC000386971132 398224723 /nfs/dbraw/zinc/22/47/23/398224723.db2.gz BPEXNQWFBYCSCP-LLVKDONJSA-N 1 2 233.315 2.020 20 0 BEADLO Cc1cc(NC[C@@H]2CC[C@@H](O)C2)nc(C2CC2)[nH+]1 ZINC000191638643 178167457 /nfs/dbraw/zinc/16/74/57/178167457.db2.gz BAYXIRGSERGIFY-ZYHUDNBSSA-N 1 2 247.342 2.235 20 0 BEADLO Cc1cc(NC[C@H](C)O)c2cccc(F)c2[nH+]1 ZINC000119751996 178168775 /nfs/dbraw/zinc/16/87/75/178168775.db2.gz FETYZNCZTLWBGG-VIFPVBQESA-N 1 2 234.274 2.475 20 0 BEADLO Cc1cc(NC[C@](C)(O)c2cccs2)nc[nH+]1 ZINC000301345545 178170463 /nfs/dbraw/zinc/17/04/63/178170463.db2.gz ICCJSCYSQZNEHC-LBPRGKRZSA-N 1 2 249.339 2.166 20 0 BEADLO Cc1cc(NCc2cncn2C)ccc1[NH+](C)C ZINC000120183211 178175634 /nfs/dbraw/zinc/17/56/34/178175634.db2.gz IWBZESZZDXNFIH-UHFFFAOYSA-N 1 2 244.342 2.407 20 0 BEADLO Cc1ncsc1CNc1cc(C)[nH+]cn1 ZINC000070837203 178177061 /nfs/dbraw/zinc/17/70/61/178177061.db2.gz DMBUKVHQUICZOI-UHFFFAOYSA-N 1 2 220.301 2.162 20 0 BEADLO CC[C@H](C)[C@H](CNc1ccc(CO)c[nH+]1)OC ZINC000381120020 398222239 /nfs/dbraw/zinc/22/22/39/398222239.db2.gz FADDMKDJWLWIMC-JQWIXIFHSA-N 1 2 238.331 2.047 20 0 BEADLO CCc1ccc(C[N@H+](C)[C@H](C)C(=O)OC)cc1 ZINC000073261449 343986150 /nfs/dbraw/zinc/98/61/50/343986150.db2.gz WWCKLDCVAGAUDI-LLVKDONJSA-N 1 2 235.327 2.242 20 0 BEADLO CCc1ccc(C[N@@H+](C)[C@H](C)C(=O)OC)cc1 ZINC000073261449 343986151 /nfs/dbraw/zinc/98/61/51/343986151.db2.gz WWCKLDCVAGAUDI-LLVKDONJSA-N 1 2 235.327 2.242 20 0 BEADLO Cc1nc(C)c(CNc2cc(C)[nH+]cn2)s1 ZINC000301437709 178177296 /nfs/dbraw/zinc/17/72/96/178177296.db2.gz HTNGVOVKJAUFDA-UHFFFAOYSA-N 1 2 234.328 2.470 20 0 BEADLO Cc1cc(N[C@@H](C)[C@@H]2CCCOC2)nc[nH+]1 ZINC000336777811 178178282 /nfs/dbraw/zinc/17/82/82/178178282.db2.gz JPKXEWDCKUCORF-WDEREUQCSA-N 1 2 221.304 2.012 20 0 BEADLO Cc1cc(N[C@H](C)[C@@H]2CCCCO2)nc[nH+]1 ZINC000309762502 178185304 /nfs/dbraw/zinc/18/53/04/178185304.db2.gz IZEPDTRYCQKQNL-MNOVXSKESA-N 1 2 221.304 2.155 20 0 BEADLO Cc1noc(C)c1C[C@@H](C)Nc1cc(C)[nH+]cn1 ZINC000301389134 178185390 /nfs/dbraw/zinc/18/53/90/178185390.db2.gz XVVCAHPASJRNIL-SECBINFHSA-N 1 2 246.314 2.433 20 0 BEADLO Cc1cc(N[C@H](C)C[C@H](C)O)nc(C(C)C)[nH+]1 ZINC000126932085 178185921 /nfs/dbraw/zinc/18/59/21/178185921.db2.gz GGKBLEOPLYBESA-KOLCDFICSA-N 1 2 237.347 2.480 20 0 BEADLO Cc1cc(N[C@H](C)[C@@H]2CCOC2)nc(C2CC2)[nH+]1 ZINC000266287725 178186005 /nfs/dbraw/zinc/18/60/05/178186005.db2.gz VVWPSNRPBUDVBO-ZYHUDNBSSA-N 1 2 247.342 2.499 20 0 BEADLO Cc1cc(N[C@H](CO)c2cccc(F)c2)nc[nH+]1 ZINC000341510181 178186735 /nfs/dbraw/zinc/18/67/35/178186735.db2.gz YNSCSVNSDKWSNS-GFCCVEGCSA-N 1 2 247.273 2.070 20 0 BEADLO Cc1cc(N[C@H]2CCCC[C@H]2O)nc(C2CC2)[nH+]1 ZINC000264674381 178189381 /nfs/dbraw/zinc/18/93/81/178189381.db2.gz VCKYLNYOUAWSJG-NWDGAFQWSA-N 1 2 247.342 2.378 20 0 BEADLO CN(CC1(C)COC1)c1[nH+]c2ccccc2n1C ZINC000624528445 343987561 /nfs/dbraw/zinc/98/75/61/343987561.db2.gz WNXRYCNVHZWBPG-UHFFFAOYSA-N 1 2 245.326 2.046 20 0 BEADLO Nc1[nH+]cnc(N[C@H]2CCC[C@@H](F)C2)c1Cl ZINC000521037912 259302539 /nfs/dbraw/zinc/30/25/39/259302539.db2.gz VZCUKASTOZJNMA-RQJHMYQMSA-N 1 2 244.701 2.405 20 0 BEADLO Nc1nc[nH+]c(N[C@H]2CCC[C@@H](F)C2)c1Cl ZINC000521037912 259302541 /nfs/dbraw/zinc/30/25/41/259302541.db2.gz VZCUKASTOZJNMA-RQJHMYQMSA-N 1 2 244.701 2.405 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccc(C)nn2)C[C@H](CC)O1 ZINC000421390253 192327860 /nfs/dbraw/zinc/32/78/60/192327860.db2.gz NRKGVXQUGCDIQO-OKILXGFUSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccc(C)nn2)C[C@H](CC)O1 ZINC000421390253 192327861 /nfs/dbraw/zinc/32/78/61/192327861.db2.gz NRKGVXQUGCDIQO-OKILXGFUSA-N 1 2 249.358 2.174 20 0 BEADLO CC(C)CC[C@H](C)NC(=O)CCc1c[nH+]c[nH]1 ZINC000276672175 538932756 /nfs/dbraw/zinc/93/27/56/538932756.db2.gz UZJVAMNFCHURPX-NSHDSACASA-N 1 2 237.347 2.283 20 0 BEADLO CC(C)CC[C@H](C)NC(=O)CCc1c[nH]c[nH+]1 ZINC000276672175 538932758 /nfs/dbraw/zinc/93/27/58/538932758.db2.gz UZJVAMNFCHURPX-NSHDSACASA-N 1 2 237.347 2.283 20 0 BEADLO CCC(CC)(CC)NC(=O)CCc1c[nH+]c[nH]1 ZINC000276506742 538932905 /nfs/dbraw/zinc/93/29/05/538932905.db2.gz APGFIFDMEOUQHR-UHFFFAOYSA-N 1 2 237.347 2.427 20 0 BEADLO CCC(CC)(CC)NC(=O)CCc1c[nH]c[nH+]1 ZINC000276506742 538932908 /nfs/dbraw/zinc/93/29/08/538932908.db2.gz APGFIFDMEOUQHR-UHFFFAOYSA-N 1 2 237.347 2.427 20 0 BEADLO CC[C@H](C)CN(CC)C(=O)CCc1c[nH+]c[nH]1 ZINC000280100041 538936724 /nfs/dbraw/zinc/93/67/24/538936724.db2.gz ZQPQXKKTKTXLHF-NSHDSACASA-N 1 2 237.347 2.237 20 0 BEADLO CC[C@H](C)CN(CC)C(=O)CCc1c[nH]c[nH+]1 ZINC000280100041 538936726 /nfs/dbraw/zinc/93/67/26/538936726.db2.gz ZQPQXKKTKTXLHF-NSHDSACASA-N 1 2 237.347 2.237 20 0 BEADLO C[C@@H]1CCC[N@@H+]1Cc1ccc(-c2nnc[nH]2)cc1 ZINC000649432688 398236774 /nfs/dbraw/zinc/23/67/74/398236774.db2.gz QJUGQCZHTWMSFZ-LLVKDONJSA-N 1 2 242.326 2.456 20 0 BEADLO C[C@@H]1CCC[N@H+]1Cc1ccc(-c2nnc[nH]2)cc1 ZINC000649432688 398236776 /nfs/dbraw/zinc/23/67/76/398236776.db2.gz QJUGQCZHTWMSFZ-LLVKDONJSA-N 1 2 242.326 2.456 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@@H](C)c2nncn2C)oc1C ZINC000282078832 178253532 /nfs/dbraw/zinc/25/35/32/178253532.db2.gz HMTIWLXIWRXQEU-UWVGGRQHSA-N 1 2 248.330 2.437 20 0 BEADLO COCCOc1ccc(-c2c[nH+]cn2C)cc1 ZINC000649431092 398233509 /nfs/dbraw/zinc/23/35/09/398233509.db2.gz FRDAFKLJBUXXMS-UHFFFAOYSA-N 1 2 232.283 2.112 20 0 BEADLO Cc1cc([C@H](C)[NH2+]CCN2CCCCC2)no1 ZINC000337386923 178246885 /nfs/dbraw/zinc/24/68/85/178246885.db2.gz GADVSCFSPWTNMD-LBPRGKRZSA-N 1 2 237.347 2.120 20 0 BEADLO COC[C@H](N[C@H](C)c1[nH]cc[nH+]1)c1ccc(C)o1 ZINC000279104064 538935686 /nfs/dbraw/zinc/93/56/86/538935686.db2.gz VNOYMLQWWMHRLG-MNOVXSKESA-N 1 2 249.314 2.349 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@@H](C)c2cnn(C)c2C)no1 ZINC000337533630 178254038 /nfs/dbraw/zinc/25/40/38/178254038.db2.gz FCDJXJFRDXKBJW-UWVGGRQHSA-N 1 2 248.330 2.437 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2ncnn2C)ccc1F ZINC000269011598 178252020 /nfs/dbraw/zinc/25/20/20/178252020.db2.gz XPQDUEHAGPCXSZ-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2nnc(C)n2C)c(C)o1 ZINC000044730374 178252510 /nfs/dbraw/zinc/25/25/10/178252510.db2.gz BHTHCKOFQCFWGR-VIFPVBQESA-N 1 2 248.330 2.184 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@@H](C)c2ncnn2C)c(C)o1 ZINC000278150361 178254450 /nfs/dbraw/zinc/25/44/50/178254450.db2.gz ACEDXLUIIVJUCD-UWVGGRQHSA-N 1 2 248.330 2.437 20 0 BEADLO COc1cccc(OC)c1-c1c[nH+]cn1C ZINC000649439404 398238259 /nfs/dbraw/zinc/23/82/59/398238259.db2.gz XGNWZOGNBNMKDP-UHFFFAOYSA-N 1 2 218.256 2.104 20 0 BEADLO CC[C@H]1CC[C@H](C)N1C(=O)CCc1c[nH+]c[nH]1 ZINC000281355077 538938633 /nfs/dbraw/zinc/93/86/33/538938633.db2.gz XAESVYTZFGWRPP-JQWIXIFHSA-N 1 2 235.331 2.132 20 0 BEADLO CC[C@H]1CC[C@H](C)N1C(=O)CCc1c[nH]c[nH+]1 ZINC000281355077 538938634 /nfs/dbraw/zinc/93/86/34/538938634.db2.gz XAESVYTZFGWRPP-JQWIXIFHSA-N 1 2 235.331 2.132 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1C(=O)CCc1c[nH+]c[nH]1 ZINC000281355083 538938816 /nfs/dbraw/zinc/93/88/16/538938816.db2.gz XAESVYTZFGWRPP-ZYHUDNBSSA-N 1 2 235.331 2.132 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1C(=O)CCc1c[nH]c[nH+]1 ZINC000281355083 538938818 /nfs/dbraw/zinc/93/88/18/538938818.db2.gz XAESVYTZFGWRPP-ZYHUDNBSSA-N 1 2 235.331 2.132 20 0 BEADLO CC[C@H](C)[C@H](CNc1cc(CO)cc[nH+]1)OC ZINC000381155491 398242435 /nfs/dbraw/zinc/24/24/35/398242435.db2.gz MKUBOGBZFVDYJD-JQWIXIFHSA-N 1 2 238.331 2.047 20 0 BEADLO COCC[C@@H]([NH2+][C@@H](C)c1ncc[nH]1)c1ccco1 ZINC000285496672 538941212 /nfs/dbraw/zinc/94/12/12/538941212.db2.gz APXPHUGUCGLFSG-WDEREUQCSA-N 1 2 249.314 2.431 20 0 BEADLO Cc1cc2n[nH]cc2cc1NCc1[nH+]ccn1C ZINC000359799981 178300002 /nfs/dbraw/zinc/30/00/02/178300002.db2.gz OLDIARHROQOYDR-UHFFFAOYSA-N 1 2 241.298 2.217 20 0 BEADLO C[C@H](Nc1ccc(CCO)cc1)c1[nH]cc[nH+]1 ZINC000286160921 538943380 /nfs/dbraw/zinc/94/33/80/538943380.db2.gz PIDFPALNJMNHRU-JTQLQIEISA-N 1 2 231.299 2.118 20 0 BEADLO Cc1cc2n[nH]cc2cc1NCc1c[nH+]cn1C ZINC000359820765 178300319 /nfs/dbraw/zinc/30/03/19/178300319.db2.gz VCBSCXPTIDHJJK-UHFFFAOYSA-N 1 2 241.298 2.217 20 0 BEADLO CCc1cnc(CN[C@@H](C)c2[nH]cc[nH+]2)s1 ZINC000286148359 538943211 /nfs/dbraw/zinc/94/32/11/538943211.db2.gz PGWIKZFCTVXIEF-QMMMGPOBSA-N 1 2 236.344 2.279 20 0 BEADLO Cc1cc(N2C[C@H](C)OC3(CCCC3)C2)nc[nH+]1 ZINC000645407148 398246435 /nfs/dbraw/zinc/24/64/35/398246435.db2.gz YSTOWNDEJJFLJX-LBPRGKRZSA-N 1 2 247.342 2.323 20 0 BEADLO CC[C@@](C)(CNc1cc[nH+]c(C)n1)OC ZINC000322996851 259308984 /nfs/dbraw/zinc/30/89/84/259308984.db2.gz JMHVEVOZCOQHCE-NSHDSACASA-N 1 2 209.293 2.012 20 0 BEADLO CC[C@@](C)(CNc1cc(C)[nH+]cn1)OC ZINC000323017308 259309421 /nfs/dbraw/zinc/30/94/21/259309421.db2.gz QBAHLZIBZRKSMP-NSHDSACASA-N 1 2 209.293 2.012 20 0 BEADLO CC[C@](C)(CNc1cc(C)[nH+]cn1)OC ZINC000323017307 259309510 /nfs/dbraw/zinc/30/95/10/259309510.db2.gz QBAHLZIBZRKSMP-LLVKDONJSA-N 1 2 209.293 2.012 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(=O)[C@@H](C)C2)cs1 ZINC000306203820 398253435 /nfs/dbraw/zinc/25/34/35/398253435.db2.gz SSIIZELWCVWFII-VIFPVBQESA-N 1 2 223.341 2.467 20 0 BEADLO Cc1cc(C[N@H+]2CCC(=O)[C@@H](C)C2)cs1 ZINC000306203820 398253439 /nfs/dbraw/zinc/25/34/39/398253439.db2.gz SSIIZELWCVWFII-VIFPVBQESA-N 1 2 223.341 2.467 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)CCC1CCCCC1 ZINC000291386261 538947203 /nfs/dbraw/zinc/94/72/03/538947203.db2.gz HIUWUVVWJXBHFM-UHFFFAOYSA-N 1 2 249.358 2.397 20 0 BEADLO CC(C)C[C@@H](C)CC(=O)NCc1c[nH+]cn1C ZINC000291402161 538947227 /nfs/dbraw/zinc/94/72/27/538947227.db2.gz ISSRPQWEOAWXPL-LLVKDONJSA-N 1 2 237.347 2.109 20 0 BEADLO C[C@H]1CC(C(=O)NCc2c[nH+]cn2C)C[C@H](C)C1 ZINC000291473914 538948176 /nfs/dbraw/zinc/94/81/76/538948176.db2.gz PLBXVFZHNNDVGM-GHMZBOCLSA-N 1 2 249.358 2.109 20 0 BEADLO CCC(CC)N(CC)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000292130308 168370511 /nfs/dbraw/zinc/37/05/11/168370511.db2.gz LMQGRHFQTOVXPM-BQYQJAHWSA-N 1 2 235.331 2.460 20 0 BEADLO CCC(CC)N(CC)C(=O)Cc1[nH]c[nH+]c1C ZINC000292353879 168370560 /nfs/dbraw/zinc/37/05/60/168370560.db2.gz YKOWSKUYNRCXGJ-UHFFFAOYSA-N 1 2 237.347 2.298 20 0 BEADLO COC[C@@H](Cc1ccccc1)Nc1c[nH]c[nH+]1 ZINC000576772315 365681964 /nfs/dbraw/zinc/68/19/64/365681964.db2.gz HDQOQCSRQBVOFK-GFCCVEGCSA-N 1 2 231.299 2.079 20 0 BEADLO CC(F)(F)CNCc1cccc2[nH+]ccn21 ZINC000378731039 346819950 /nfs/dbraw/zinc/81/99/50/346819950.db2.gz ASSCWWVJOQZYOU-UHFFFAOYSA-N 1 2 225.242 2.079 20 0 BEADLO Fc1cccc(CNc2c[nH]c[nH+]2)c1F ZINC000379916338 365683800 /nfs/dbraw/zinc/68/38/00/365683800.db2.gz CKNPRYQMYVIYLQ-UHFFFAOYSA-N 1 2 209.199 2.300 20 0 BEADLO CCc1nocc1C[N@@H+]1C[C@@H](C)OC(C)(C)C1 ZINC000335084958 136232698 /nfs/dbraw/zinc/23/26/98/136232698.db2.gz PLNMEOUEFDMXED-SNVBAGLBSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1nocc1C[N@H+]1C[C@@H](C)OC(C)(C)C1 ZINC000335084958 136232699 /nfs/dbraw/zinc/23/26/99/136232699.db2.gz PLNMEOUEFDMXED-SNVBAGLBSA-N 1 2 238.331 2.236 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)c2cccs2)c2[nH+]ccn21 ZINC000334745061 136232337 /nfs/dbraw/zinc/23/23/37/136232337.db2.gz WNBAJMISQPPDSH-BDAKNGLRSA-N 1 2 247.323 2.380 20 0 BEADLO Cc1n[nH]cc1[C@@H](C)[NH2+]Cc1nccs1 ZINC000180181326 538957479 /nfs/dbraw/zinc/95/74/79/538957479.db2.gz RSLXVGPKQQCZGZ-SSDOTTSWSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]CCOC1CCCC1 ZINC000180317420 538957869 /nfs/dbraw/zinc/95/78/69/538957869.db2.gz OGKCQBBECRCINX-JTQLQIEISA-N 1 2 237.347 2.328 20 0 BEADLO Cc1ccc(C(=O)NCc2[nH]c[nH+]c2C)s1 ZINC000266993046 178417216 /nfs/dbraw/zinc/41/72/16/178417216.db2.gz VWHPBOJCDLIATQ-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO CC(C)C[C@H](C)[N@@H+]1C[C@H](O)CC(F)(F)C1 ZINC000649473941 398272577 /nfs/dbraw/zinc/27/25/77/398272577.db2.gz URPYRWINXXBKCT-VHSXEESVSA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)C[C@H](C)[N@H+]1C[C@H](O)CC(F)(F)C1 ZINC000649473941 398272580 /nfs/dbraw/zinc/27/25/80/398272580.db2.gz URPYRWINXXBKCT-VHSXEESVSA-N 1 2 221.291 2.123 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]C[C@@H](O)CC(C)(C)C ZINC000180566629 538958606 /nfs/dbraw/zinc/95/86/06/538958606.db2.gz QDJASVHGCIQNCO-KOLCDFICSA-N 1 2 239.363 2.166 20 0 BEADLO CSCCCN(C)Cc1[nH]c(C)c(C)[nH+]1 ZINC000600158759 342693089 /nfs/dbraw/zinc/69/30/89/342693089.db2.gz MNPOVMKGNBGVKW-UHFFFAOYSA-N 1 2 227.377 2.211 20 0 BEADLO Cc1cc(C[NH2+]CC(F)(F)CO)c(C)s1 ZINC000231776770 342693132 /nfs/dbraw/zinc/69/31/32/342693132.db2.gz LEESZWRHUWNGFD-UHFFFAOYSA-N 1 2 235.299 2.082 20 0 BEADLO Cc1cc[nH]c1C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000335610423 136236606 /nfs/dbraw/zinc/23/66/06/136236606.db2.gz DRSIYARKBMOSMQ-UHFFFAOYSA-N 1 2 243.310 2.265 20 0 BEADLO CC[C@]1(C(C)C)C[C@@H]1NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493422281 529388283 /nfs/dbraw/zinc/38/82/83/529388283.db2.gz MNBIHGOGZZOOGB-YNVXZPTESA-N 1 2 247.342 2.364 20 0 BEADLO COC(=O)[C@H](CC(C)(C)C)[NH2+][C@H]1CCSC1 ZINC000309657313 342776763 /nfs/dbraw/zinc/77/67/63/342776763.db2.gz QIRRZGMREZTRDL-UWVGGRQHSA-N 1 2 245.388 2.059 20 0 BEADLO CC(C)c1noc(C[N@@H+]2CCSC[C@H]2C)n1 ZINC000172590163 346862086 /nfs/dbraw/zinc/86/20/86/346862086.db2.gz ILBINPVSZIABAK-SECBINFHSA-N 1 2 241.360 2.130 20 0 BEADLO CC(C)c1noc(C[N@H+]2CCSC[C@H]2C)n1 ZINC000172590163 346862090 /nfs/dbraw/zinc/86/20/90/346862090.db2.gz ILBINPVSZIABAK-SECBINFHSA-N 1 2 241.360 2.130 20 0 BEADLO CCCc1ncc(CNc2cc(CC)[nH+]cn2)o1 ZINC000649491066 398287591 /nfs/dbraw/zinc/28/75/91/398287591.db2.gz LHRNVVGCLCRANO-UHFFFAOYSA-N 1 2 246.314 2.014 20 0 BEADLO CC1(C(=O)NCCc2[nH]cc[nH+]2)CCCCC1 ZINC000232222318 342799117 /nfs/dbraw/zinc/79/91/17/342799117.db2.gz ZIANKVBSIVAJAW-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO C/C=C/CNc1cc(N2CCCC2)nc[nH+]1 ZINC000624655211 342809589 /nfs/dbraw/zinc/80/95/89/342809589.db2.gz MVDGOUPXVXIZDK-NSCUHMNNSA-N 1 2 218.304 2.065 20 0 BEADLO C/C=C/CNc1cc(N2CCCC2)[nH+]cn1 ZINC000624655211 342809591 /nfs/dbraw/zinc/80/95/91/342809591.db2.gz MVDGOUPXVXIZDK-NSCUHMNNSA-N 1 2 218.304 2.065 20 0 BEADLO C/C=C/CNc1nc(C)[nH+]c2c1CCCC2 ZINC000624656081 342809952 /nfs/dbraw/zinc/80/99/52/342809952.db2.gz FOGOBDRPEVUFHG-ONEGZZNKSA-N 1 2 217.316 2.074 20 0 BEADLO C/C=C/CNc1cc(NC2CC2)[nH+]cn1 ZINC000624656668 342810393 /nfs/dbraw/zinc/81/03/93/342810393.db2.gz YAPJXEBTROHZCC-NSCUHMNNSA-N 1 2 204.277 2.039 20 0 BEADLO C/C=C/CNc1cc(NC2CC2)nc[nH+]1 ZINC000624656668 342810395 /nfs/dbraw/zinc/81/03/95/342810395.db2.gz YAPJXEBTROHZCC-NSCUHMNNSA-N 1 2 204.277 2.039 20 0 BEADLO CCc1cc(NCc2ccncc2)nc[nH+]1 ZINC000040765071 538972841 /nfs/dbraw/zinc/97/28/41/538972841.db2.gz MUOWZAPEEIFZEM-UHFFFAOYSA-N 1 2 214.272 2.046 20 0 BEADLO c1ccc(N[C@@H]2CO[C@@H](C3CC3)C2)[nH+]c1 ZINC000624672328 342816401 /nfs/dbraw/zinc/81/64/01/342816401.db2.gz ISGMSUYCRQYALN-WDEREUQCSA-N 1 2 204.273 2.061 20 0 BEADLO C[C@@H]1CCCC[C@@H]1N(C)C(=O)CCc1c[nH+]c[nH]1 ZINC000188566331 538979438 /nfs/dbraw/zinc/97/94/38/538979438.db2.gz DMUAXHUOXBAGJV-YPMHNXCESA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H]1CCCC[C@@H]1N(C)C(=O)CCc1c[nH]c[nH+]1 ZINC000188566331 538979440 /nfs/dbraw/zinc/97/94/40/538979440.db2.gz DMUAXHUOXBAGJV-YPMHNXCESA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H]1CC[S@@](=O)CC[N@@H+]1Cc1cccs1 ZINC000335464481 398289625 /nfs/dbraw/zinc/28/96/25/398289625.db2.gz LFZJMARYXLBYBF-ZUZCIYMTSA-N 1 2 243.397 2.091 20 0 BEADLO C[C@H]1CC[S@@](=O)CC[N@H+]1Cc1cccs1 ZINC000335464481 398289627 /nfs/dbraw/zinc/28/96/27/398289627.db2.gz LFZJMARYXLBYBF-ZUZCIYMTSA-N 1 2 243.397 2.091 20 0 BEADLO CO[C@H]1C[C@@H](CNc2cc[nH+]c(C(C)(C)C)n2)C1 ZINC000624755040 342825103 /nfs/dbraw/zinc/82/51/03/342825103.db2.gz NTNCXYDXGYBSHO-PHIMTYICSA-N 1 2 249.358 2.033 20 0 BEADLO CCc1cc(NCCC=C(C)C)nc[nH+]1 ZINC000380160476 538986516 /nfs/dbraw/zinc/98/65/16/538986516.db2.gz BAIDFXLOJMFMJS-UHFFFAOYSA-N 1 2 205.305 2.229 20 0 BEADLO Cc1cc[nH+]c(NCC2(CO)CC2)c1Cl ZINC000380198107 538987371 /nfs/dbraw/zinc/98/73/71/538987371.db2.gz ROMQDWCFYQSPIN-UHFFFAOYSA-N 1 2 226.707 2.228 20 0 BEADLO CC(C)C[C@@H]1CCN(C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000189179378 538980808 /nfs/dbraw/zinc/98/08/08/538980808.db2.gz TXKSVKYAEYCUMX-LBPRGKRZSA-N 1 2 249.358 2.237 20 0 BEADLO CC(C)C[C@@H]1CCN(C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000189179378 538980810 /nfs/dbraw/zinc/98/08/10/538980810.db2.gz TXKSVKYAEYCUMX-LBPRGKRZSA-N 1 2 249.358 2.237 20 0 BEADLO CCCC1(CNC(=O)CCc2c[nH+]c[nH]2)CCC1 ZINC000189503767 538983360 /nfs/dbraw/zinc/98/33/60/538983360.db2.gz ZWHGPAXTMBRQQF-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO CCCC1(CNC(=O)CCc2c[nH]c[nH+]2)CCC1 ZINC000189503767 538983361 /nfs/dbraw/zinc/98/33/61/538983361.db2.gz ZWHGPAXTMBRQQF-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO CO[C@H](C[NH2+][C@H](C)c1cn[nH]c1C)C(C)C ZINC000381480439 539001748 /nfs/dbraw/zinc/00/17/48/539001748.db2.gz SMTSFVXBOVVPFU-BXKDBHETSA-N 1 2 225.336 2.040 20 0 BEADLO C[C@@H]([NH2+]Cc1cocn1)c1ccc(F)cn1 ZINC000381519573 539002966 /nfs/dbraw/zinc/00/29/66/539002966.db2.gz UAXTVAXAAOJHEQ-MRVPVSSYSA-N 1 2 221.235 2.060 20 0 BEADLO Cc1cnn(C)c1C[NH2+][C@@H]1CCCC1(F)F ZINC000381542004 539003896 /nfs/dbraw/zinc/00/38/96/539003896.db2.gz IHIUMASZKAQZFH-SNVBAGLBSA-N 1 2 229.274 2.006 20 0 BEADLO CC[C@]1(C)CCCN(C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000193386894 539005298 /nfs/dbraw/zinc/00/52/98/539005298.db2.gz YMRMBWNAAJTKSI-CQSZACIVSA-N 1 2 249.358 2.381 20 0 BEADLO CC[C@]1(C)CCCN(C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000193386894 539005299 /nfs/dbraw/zinc/00/52/99/539005299.db2.gz YMRMBWNAAJTKSI-CQSZACIVSA-N 1 2 249.358 2.381 20 0 BEADLO Cc1cc(F)cc(NC(=O)CCc2c[nH+]c[nH]2)c1 ZINC000193607731 539007013 /nfs/dbraw/zinc/00/70/13/539007013.db2.gz JQSVBZGNBUHDNW-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO Cc1cc(F)cc(NC(=O)CCc2c[nH]c[nH+]2)c1 ZINC000193607731 539007014 /nfs/dbraw/zinc/00/70/14/539007014.db2.gz JQSVBZGNBUHDNW-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO C[C@@H]1C[C@H](C)CCN(C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000193664386 539007818 /nfs/dbraw/zinc/00/78/18/539007818.db2.gz AWCROZICEUCHHA-VXGBXAGGSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H]1C[C@H](C)CCN(C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000193664386 539007819 /nfs/dbraw/zinc/00/78/19/539007819.db2.gz AWCROZICEUCHHA-VXGBXAGGSA-N 1 2 249.358 2.237 20 0 BEADLO Cc1c(C(=O)Nc2cc[nH+]c(C)c2)ccn1C ZINC000195257985 539010056 /nfs/dbraw/zinc/01/00/56/539010056.db2.gz JSBOHUMCNOUJRJ-UHFFFAOYSA-N 1 2 229.283 2.289 20 0 BEADLO Cc1cc(N)nc(SCc2cccnc2C)[nH+]1 ZINC000384067247 539012203 /nfs/dbraw/zinc/01/22/03/539012203.db2.gz QKRDYPSEHGPXBR-UHFFFAOYSA-N 1 2 246.339 2.193 20 0 BEADLO Cc1cc(NC(=O)CCn2cc[nH+]c2)cs1 ZINC000634425045 361948803 /nfs/dbraw/zinc/94/88/03/361948803.db2.gz UGGCJRZWIHUFFW-UHFFFAOYSA-N 1 2 235.312 2.282 20 0 BEADLO CC(C)n1ccnc1C[NH2+]Cc1ccco1 ZINC000381444205 539000512 /nfs/dbraw/zinc/00/05/12/539000512.db2.gz FKKXCPKBATXCHC-UHFFFAOYSA-N 1 2 219.288 2.347 20 0 BEADLO C[C@@H](c1ccccc1)[C@@H](CO)[NH2+]CC(F)F ZINC000390211313 539020532 /nfs/dbraw/zinc/02/05/32/539020532.db2.gz VJPIACAYWGLTEN-GXSJLCMTSA-N 1 2 229.270 2.006 20 0 BEADLO C[C@@H]1CC[C@@H]1Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000390455545 539021977 /nfs/dbraw/zinc/02/19/77/539021977.db2.gz CPINFRDLXWOGAN-ZJUUUORDSA-N 1 2 219.332 2.406 20 0 BEADLO C[C@H]1CC[C@@H]1Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000390455541 539022004 /nfs/dbraw/zinc/02/20/04/539022004.db2.gz CPINFRDLXWOGAN-UWVGGRQHSA-N 1 2 219.332 2.406 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccc(C)nc2)s1 ZINC000391863865 539027918 /nfs/dbraw/zinc/02/79/18/539027918.db2.gz RPAIIUHBJKCBJX-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO Cc1cc2ccccc2[nH+]c1N1C[C@@H](C)[C@@H](O)C1 ZINC000388110776 539014404 /nfs/dbraw/zinc/01/44/04/539014404.db2.gz XEVKQVYNGWTJMZ-RISCZKNCSA-N 1 2 242.322 2.360 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1cc2n(n1)CCC2 ZINC000649505711 398300103 /nfs/dbraw/zinc/30/01/03/398300103.db2.gz RUGUIZUCBXJGCT-UHFFFAOYSA-N 1 2 245.326 2.444 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1cc2n(n1)CCC2 ZINC000649505711 398300106 /nfs/dbraw/zinc/30/01/06/398300106.db2.gz RUGUIZUCBXJGCT-UHFFFAOYSA-N 1 2 245.326 2.444 20 0 BEADLO COc1ccc(F)c(NCc2[nH]cc[nH+]2)c1 ZINC000087286974 536609516 /nfs/dbraw/zinc/60/95/16/536609516.db2.gz FVQWNVNZTNFGPJ-UHFFFAOYSA-N 1 2 221.235 2.170 20 0 BEADLO C[C@@H](c1ccccc1)[N@H+](C)Cc1nccc(N)n1 ZINC000351334008 136244192 /nfs/dbraw/zinc/24/41/92/136244192.db2.gz DCSJKCMIMXDUSY-NSHDSACASA-N 1 2 242.326 2.082 20 0 BEADLO C[C@@H](c1ccccc1)[N@@H+](C)Cc1nccc(N)n1 ZINC000351334008 136244193 /nfs/dbraw/zinc/24/41/93/136244193.db2.gz DCSJKCMIMXDUSY-NSHDSACASA-N 1 2 242.326 2.082 20 0 BEADLO CCc1cc(N[C@@H](C)c2cnn(CC)c2)nc[nH+]1 ZINC000649514493 398305154 /nfs/dbraw/zinc/30/51/54/398305154.db2.gz HZZXFXQZQAKJHG-JTQLQIEISA-N 1 2 245.330 2.429 20 0 BEADLO CCc1cc(N[C@@H](CC)C(C)(C)O)nc[nH+]1 ZINC000382115706 398305870 /nfs/dbraw/zinc/30/58/70/398305870.db2.gz LZWBFLRZDJRCPV-JTQLQIEISA-N 1 2 223.320 2.000 20 0 BEADLO C[C@H](CC(=O)N(C)Cc1ccco1)n1cc[nH+]c1 ZINC000649518932 398307110 /nfs/dbraw/zinc/30/71/10/398307110.db2.gz NSCZSSIVKMNKMO-LLVKDONJSA-N 1 2 247.298 2.086 20 0 BEADLO CCO[C@@H](C[N@H+](C)Cc1cscn1)C1CC1 ZINC000625104001 342858123 /nfs/dbraw/zinc/85/81/23/342858123.db2.gz NXOIRIHZWMXBFG-LBPRGKRZSA-N 1 2 240.372 2.390 20 0 BEADLO CCO[C@@H](C[N@@H+](C)Cc1cscn1)C1CC1 ZINC000625104001 342858125 /nfs/dbraw/zinc/85/81/25/342858125.db2.gz NXOIRIHZWMXBFG-LBPRGKRZSA-N 1 2 240.372 2.390 20 0 BEADLO CCc1[nH+]c(C)ccc1OCCC[C@H](C)O ZINC000309738970 398322355 /nfs/dbraw/zinc/32/23/55/398322355.db2.gz HGMWHSOFIJMJOV-NSHDSACASA-N 1 2 223.316 2.492 20 0 BEADLO C[C@H]1C[N@H+](Cc2noc(C3CCC3)n2)C[C@H]1C ZINC000625197509 342908242 /nfs/dbraw/zinc/90/82/42/342908242.db2.gz KXLVVQPNCFNZOM-AOOOYVTPSA-N 1 2 235.331 2.425 20 0 BEADLO C[C@H]1C[N@@H+](Cc2noc(C3CCC3)n2)C[C@H]1C ZINC000625197509 342908243 /nfs/dbraw/zinc/90/82/43/342908243.db2.gz KXLVVQPNCFNZOM-AOOOYVTPSA-N 1 2 235.331 2.425 20 0 BEADLO Cc1ccc(C[NH2+]Cc2ccn[nH]2)cc1 ZINC000036900082 342913039 /nfs/dbraw/zinc/91/30/39/342913039.db2.gz AUKXOVUERSRDEH-UHFFFAOYSA-N 1 2 201.273 2.008 20 0 BEADLO CCc1ccc(CNc2cccc(CO)[nH+]2)cn1 ZINC000351570136 136246925 /nfs/dbraw/zinc/24/69/25/136246925.db2.gz YTKJIQQORHPETE-UHFFFAOYSA-N 1 2 243.310 2.143 20 0 BEADLO CC[C@H](N[C@H](C)c1[nH]cc[nH+]1)C(F)F ZINC000453247066 488186568 /nfs/dbraw/zinc/18/65/68/488186568.db2.gz NTFNYMGXFSINMA-RQJHMYQMSA-N 1 2 203.236 2.104 20 0 BEADLO Cc1cc(N2CC(Oc3ccccc3)C2)nc[nH+]1 ZINC000602601081 349647325 /nfs/dbraw/zinc/64/73/25/349647325.db2.gz QKRWIBCODTZONM-UHFFFAOYSA-N 1 2 241.294 2.053 20 0 BEADLO CC1(C)COCC[N@@H+]1Cc1nc2ccccc2o1 ZINC000064247661 349649845 /nfs/dbraw/zinc/64/98/45/349649845.db2.gz JXSCFOKUMLAAGE-UHFFFAOYSA-N 1 2 246.310 2.439 20 0 BEADLO CC1(C)COCC[N@H+]1Cc1nc2ccccc2o1 ZINC000064247661 349649847 /nfs/dbraw/zinc/64/98/47/349649847.db2.gz JXSCFOKUMLAAGE-UHFFFAOYSA-N 1 2 246.310 2.439 20 0 BEADLO Cc1cccc(C[NH2+][C@@H]2C[C@@H](C)n3ccnc32)n1 ZINC000379013714 346885174 /nfs/dbraw/zinc/88/51/74/346885174.db2.gz PMZRHDDNPBGRLP-DGCLKSJQSA-N 1 2 242.326 2.382 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCCc2occc21)c1nncn1C ZINC000123951904 398338651 /nfs/dbraw/zinc/33/86/51/398338651.db2.gz GJXUTFYPLLRHTM-KOLCDFICSA-N 1 2 246.314 2.136 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2CCCC[C@@H]2C2CC2)n1 ZINC000564958321 398331395 /nfs/dbraw/zinc/33/13/95/398331395.db2.gz ZXZMKJXPVZYGPL-GHMZBOCLSA-N 1 2 235.331 2.473 20 0 BEADLO FC(F)CN1CC[NH+](Cc2ccsc2)CC1 ZINC000112976103 398332558 /nfs/dbraw/zinc/33/25/58/398332558.db2.gz MZIKNZITPPROMX-UHFFFAOYSA-N 1 2 246.326 2.131 20 0 BEADLO Cc1nnc(C[N@@H+]2CCS[C@H](C)CC2)s1 ZINC000336490975 398332991 /nfs/dbraw/zinc/33/29/91/398332991.db2.gz AKXLSZGJGJSOKR-MRVPVSSYSA-N 1 2 243.401 2.174 20 0 BEADLO Cc1nnc(C[N@H+]2CCS[C@H](C)CC2)s1 ZINC000336490975 398332992 /nfs/dbraw/zinc/33/29/92/398332992.db2.gz AKXLSZGJGJSOKR-MRVPVSSYSA-N 1 2 243.401 2.174 20 0 BEADLO Cc1nnc(C[N@@H+]2CCS[C@@H](C)CC2)s1 ZINC000336490976 398333020 /nfs/dbraw/zinc/33/30/20/398333020.db2.gz AKXLSZGJGJSOKR-QMMMGPOBSA-N 1 2 243.401 2.174 20 0 BEADLO Cc1nnc(C[N@H+]2CCS[C@@H](C)CC2)s1 ZINC000336490976 398333021 /nfs/dbraw/zinc/33/30/21/398333021.db2.gz AKXLSZGJGJSOKR-QMMMGPOBSA-N 1 2 243.401 2.174 20 0 BEADLO c1cnc2c(c1)cccc2C[N@@H+]1CCO[C@H]2C[C@H]21 ZINC000368327579 398343572 /nfs/dbraw/zinc/34/35/72/398343572.db2.gz GIMVXHSUGUBVLA-KGLIPLIRSA-N 1 2 240.306 2.208 20 0 BEADLO c1cnc2c(c1)cccc2C[N@H+]1CCO[C@H]2C[C@H]21 ZINC000368327579 398343573 /nfs/dbraw/zinc/34/35/73/398343573.db2.gz GIMVXHSUGUBVLA-KGLIPLIRSA-N 1 2 240.306 2.208 20 0 BEADLO CCc1c[nH]c(CC(=O)N(C)[C@H](C)C2(C)CC2)[nH+]1 ZINC000635661107 398344363 /nfs/dbraw/zinc/34/43/63/398344363.db2.gz LOUDGMXRUYWUKU-SNVBAGLBSA-N 1 2 249.358 2.162 20 0 BEADLO CC[C@@H](C)[C@](C)(O)CNc1[nH+]cccc1OC ZINC000527892905 262891921 /nfs/dbraw/zinc/89/19/21/262891921.db2.gz LSVWXTZQWAOWDH-ZWNOBZJWSA-N 1 2 238.331 2.299 20 0 BEADLO CCc1cnc(C[N@H+](C)C[C@H]2CCCO2)s1 ZINC000175522103 346897788 /nfs/dbraw/zinc/89/77/88/346897788.db2.gz WVBDILAQFDAFKH-SNVBAGLBSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1cnc(C[N@@H+](C)C[C@H]2CCCO2)s1 ZINC000175522103 346897792 /nfs/dbraw/zinc/89/77/92/346897792.db2.gz WVBDILAQFDAFKH-SNVBAGLBSA-N 1 2 240.372 2.316 20 0 BEADLO CC(C)[C@H](C)CC(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000347503247 534928619 /nfs/dbraw/zinc/92/86/19/534928619.db2.gz RUWVPXBSRIFORF-SNVBAGLBSA-N 1 2 223.320 2.050 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N[C@@H]1C[C@H]1C(C)C ZINC000493030462 529555412 /nfs/dbraw/zinc/55/54/12/529555412.db2.gz WFTVGEXFEXTGJZ-CYLBZQBVSA-N 1 2 247.342 2.077 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N[C@H]1CCC1(C)C ZINC000492917415 529556012 /nfs/dbraw/zinc/55/60/12/529556012.db2.gz CFYPBJWNVYPNTL-QRGHLMKCSA-N 1 2 247.342 2.221 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N[C@H](C)CC(C)C ZINC000492494978 529556424 /nfs/dbraw/zinc/55/64/24/529556424.db2.gz UOCREUKISSMPIW-NNNHXZLVSA-N 1 2 249.358 2.467 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N(C)[C@H](C)C(C)C ZINC000493199220 529556895 /nfs/dbraw/zinc/55/68/95/529556895.db2.gz CKYZNYUKLSBBDA-QDZRJHCZSA-N 1 2 249.358 2.419 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N1C2CCC1CC2 ZINC000492535556 529557164 /nfs/dbraw/zinc/55/71/64/529557164.db2.gz OAGPRBASNBVBJT-FPLPWBNLSA-N 1 2 245.326 2.070 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N1C[C@H](C)[C@@H](C)C1 ZINC000492529775 529558260 /nfs/dbraw/zinc/55/82/60/529558260.db2.gz GTRDHPBTYMDQJK-YGABWQLJSA-N 1 2 247.342 2.031 20 0 BEADLO CC[C@@H](NC(=O)C=Cc1c[nH]c[nH+]1)C(C)(C)C ZINC000493454381 529572746 /nfs/dbraw/zinc/57/27/46/529572746.db2.gz GPUUIFRBVFWBKQ-XUIVZRPNSA-N 1 2 235.331 2.364 20 0 BEADLO COC(=O)c1coc([C@@H](C)[NH+]2CCCCC2)n1 ZINC000602765088 349722039 /nfs/dbraw/zinc/72/20/39/349722039.db2.gz BTEVOARHNGZSGM-SECBINFHSA-N 1 2 238.287 2.008 20 0 BEADLO CSC1CC[NH+](Cc2cn[nH]c2C)CC1 ZINC000602726341 349715687 /nfs/dbraw/zinc/71/56/87/349715687.db2.gz QWCVFONNXVBKFG-UHFFFAOYSA-N 1 2 225.361 2.046 20 0 BEADLO CCc1cnc(CN(C)c2cc[nH+]c(C)n2)s1 ZINC000176743017 346916382 /nfs/dbraw/zinc/91/63/82/346916382.db2.gz HTBOBJXBCAHGDR-UHFFFAOYSA-N 1 2 248.355 2.440 20 0 BEADLO CCC(F)(F)C[N@@H+]1CC[C@H](SC)C1 ZINC000602837072 349776376 /nfs/dbraw/zinc/77/63/76/349776376.db2.gz SZQOMYFIZBLXMU-QMMMGPOBSA-N 1 2 209.305 2.469 20 0 BEADLO CCC(F)(F)C[N@H+]1CC[C@H](SC)C1 ZINC000602837072 349776380 /nfs/dbraw/zinc/77/63/80/349776380.db2.gz SZQOMYFIZBLXMU-QMMMGPOBSA-N 1 2 209.305 2.469 20 0 BEADLO C[C@H]1C[NH+](Cc2ncc[nH]2)C[C@H](C)C1(F)F ZINC000625648562 344024892 /nfs/dbraw/zinc/02/48/92/344024892.db2.gz IIQDKOSSQWVVSH-IUCAKERBSA-N 1 2 229.274 2.133 20 0 BEADLO CC[C@H](C)C(=O)Nc1ccc(-n2cc[nH+]c2)nc1 ZINC000024906059 343079222 /nfs/dbraw/zinc/07/92/22/343079222.db2.gz SYYIPFWOKYJLRU-JTQLQIEISA-N 1 2 244.298 2.252 20 0 BEADLO CC[C@H](Nc1nc(C)ns1)c1[nH]cc[nH+]1 ZINC000125224590 343165234 /nfs/dbraw/zinc/16/52/34/343165234.db2.gz KVLMHMGLFJVEJV-ZETCQYMHSA-N 1 2 223.305 2.133 20 0 BEADLO COC(=O)C[NH2+][C@H](c1ccccc1)C(C)C ZINC000035037917 343283396 /nfs/dbraw/zinc/28/33/96/343283396.db2.gz WDBUGXGXSOHRCS-ZDUSSCGKSA-N 1 2 221.300 2.146 20 0 BEADLO COC(=O)[C@H](C)[NH2+]Cc1cccc2ccccc21 ZINC000035041626 343283539 /nfs/dbraw/zinc/28/35/39/343283539.db2.gz QNAQTANVECIVRZ-NSHDSACASA-N 1 2 243.306 2.491 20 0 BEADLO CC1(C)CC(C[N@@H+]2C[C@@H](O)CC(F)(F)C2)C1 ZINC000625365159 343259208 /nfs/dbraw/zinc/25/92/08/343259208.db2.gz CSCAQUIIHNYRQT-JTQLQIEISA-N 1 2 233.302 2.125 20 0 BEADLO CC1(C)CC(C[N@H+]2C[C@@H](O)CC(F)(F)C2)C1 ZINC000625365159 343259210 /nfs/dbraw/zinc/25/92/10/343259210.db2.gz CSCAQUIIHNYRQT-JTQLQIEISA-N 1 2 233.302 2.125 20 0 BEADLO Clc1ccc(C[NH2+]Cc2csnn2)cc1 ZINC000036902157 343327085 /nfs/dbraw/zinc/32/70/85/343327085.db2.gz RJQHJMDVFXYFOD-UHFFFAOYSA-N 1 2 239.731 2.481 20 0 BEADLO CN(C)c1ccc(NCc2ccco2)c[nH+]1 ZINC000036988864 343329805 /nfs/dbraw/zinc/32/98/05/343329805.db2.gz AOHZGPNNUVPCJZ-UHFFFAOYSA-N 1 2 217.272 2.353 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccccc1F)c1nncn1C ZINC000037017272 343330680 /nfs/dbraw/zinc/33/06/80/343330680.db2.gz LTPWSPLAXJRVGG-VHSXEESVSA-N 1 2 248.305 2.366 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)NCCCC1CCC1 ZINC000618614073 343312187 /nfs/dbraw/zinc/31/21/87/343312187.db2.gz IPIZBROPOHBLAH-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO C[C@@H](NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1)C1CCCC1 ZINC000584063270 343312212 /nfs/dbraw/zinc/31/22/12/343312212.db2.gz MPPGWPUXBUMDGT-WDEREUQCSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H](NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1)C1CCCC1 ZINC000584063270 343312213 /nfs/dbraw/zinc/31/22/13/343312213.db2.gz MPPGWPUXBUMDGT-WDEREUQCSA-N 1 2 249.358 2.283 20 0 BEADLO COC[C@@H](C)CNc1cc[nH+]c(C(C)C)n1 ZINC000171865419 259358474 /nfs/dbraw/zinc/35/84/74/259358474.db2.gz GUXSGXMGCGTJCN-JTQLQIEISA-N 1 2 223.320 2.294 20 0 BEADLO c1cc(C[N@@H+]2CCCc3occc3C2)no1 ZINC000335672581 136316756 /nfs/dbraw/zinc/31/67/56/136316756.db2.gz GVXQLWFFROCVFB-UHFFFAOYSA-N 1 2 218.256 2.216 20 0 BEADLO c1cc(C[N@H+]2CCCc3occc3C2)no1 ZINC000335672581 136316757 /nfs/dbraw/zinc/31/67/57/136316757.db2.gz GVXQLWFFROCVFB-UHFFFAOYSA-N 1 2 218.256 2.216 20 0 BEADLO Cc1cc(NC(=O)N2CC(C)=C[C@@H](C)C2)cc[nH+]1 ZINC000335697713 136327272 /nfs/dbraw/zinc/32/72/72/136327272.db2.gz GKORDNUUBKDSCW-SNVBAGLBSA-N 1 2 245.326 2.242 20 0 BEADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1ccccn1)CO2 ZINC000335699660 136328186 /nfs/dbraw/zinc/32/81/86/136328186.db2.gz CIWICCIRMSLYNX-ZDUSSCGKSA-N 1 2 244.269 2.444 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@]12C[C@H]1CCC2 ZINC000421559504 192361658 /nfs/dbraw/zinc/36/16/58/192361658.db2.gz UPAZKOUNVBFQKF-MISXGVKJSA-N 1 2 247.342 2.270 20 0 BEADLO FC(F)n1ccc(C[N@@H+]2CCCSCC2)n1 ZINC000349062714 136321302 /nfs/dbraw/zinc/32/13/02/136321302.db2.gz NSCSTDFYVHBEIK-UHFFFAOYSA-N 1 2 247.314 2.217 20 0 BEADLO FC(F)n1ccc(C[N@H+]2CCCSCC2)n1 ZINC000349062714 136321303 /nfs/dbraw/zinc/32/13/03/136321303.db2.gz NSCSTDFYVHBEIK-UHFFFAOYSA-N 1 2 247.314 2.217 20 0 BEADLO CCc1cnc(C[N@H+](C)CCC(C)=O)s1 ZINC000177777369 346938984 /nfs/dbraw/zinc/93/89/84/346938984.db2.gz KCCHGIGUFGYGDU-UHFFFAOYSA-N 1 2 226.345 2.116 20 0 BEADLO CCc1cnc(C[N@@H+](C)CCC(C)=O)s1 ZINC000177777369 346938988 /nfs/dbraw/zinc/93/89/88/346938988.db2.gz KCCHGIGUFGYGDU-UHFFFAOYSA-N 1 2 226.345 2.116 20 0 BEADLO C[C@H]1CC[N@H+](CCC(C)(C)O)CC1(F)F ZINC000335724841 136347143 /nfs/dbraw/zinc/34/71/43/136347143.db2.gz DGFZHEYAYUZVBX-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO C[C@H]1CC[N@@H+](CCC(C)(C)O)CC1(F)F ZINC000335724841 136347144 /nfs/dbraw/zinc/34/71/44/136347144.db2.gz DGFZHEYAYUZVBX-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@H](n3cccn3)C2)no1 ZINC000335737816 136351134 /nfs/dbraw/zinc/35/11/34/136351134.db2.gz ZCIJZVPWAGHAAC-ZDUSSCGKSA-N 1 2 246.314 2.017 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@H](n3cccn3)C2)no1 ZINC000335737816 136351135 /nfs/dbraw/zinc/35/11/35/136351135.db2.gz ZCIJZVPWAGHAAC-ZDUSSCGKSA-N 1 2 246.314 2.017 20 0 BEADLO C[C@@H]1CC[N@H+](C[C@H]2CCCO2)CC1(F)F ZINC000335681421 136328957 /nfs/dbraw/zinc/32/89/57/136328957.db2.gz AAWMWNROBUVPER-NXEZZACHSA-N 1 2 219.275 2.143 20 0 BEADLO C[C@@H]1CC[N@@H+](C[C@H]2CCCO2)CC1(F)F ZINC000335681421 136328958 /nfs/dbraw/zinc/32/89/58/136328958.db2.gz AAWMWNROBUVPER-NXEZZACHSA-N 1 2 219.275 2.143 20 0 BEADLO CCC1(C)CCN(C(=O)CCc2[nH]cc[nH+]2)CC1 ZINC000287422624 168444103 /nfs/dbraw/zinc/44/41/03/168444103.db2.gz OBQZVUOZJZXLQE-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO Cc1cccn2c(CN(C)CC(F)F)c[nH+]c12 ZINC000092509080 136376502 /nfs/dbraw/zinc/37/65/02/136376502.db2.gz FWHLBIJZNDRFEJ-UHFFFAOYSA-N 1 2 239.269 2.340 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)/C=C/c1ccc[nH]1 ZINC000187812915 259363279 /nfs/dbraw/zinc/36/32/79/259363279.db2.gz DLCQJPBXNSEAOH-SNAWJCMRSA-N 1 2 227.267 2.370 20 0 BEADLO Cc1noc(C[N@@H+](C)Cc2ccccc2)n1 ZINC000042243203 343541021 /nfs/dbraw/zinc/54/10/21/343541021.db2.gz IJSUGPYFYZWKAX-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1noc(C[N@H+](C)Cc2ccccc2)n1 ZINC000042243203 343541023 /nfs/dbraw/zinc/54/10/23/343541023.db2.gz IJSUGPYFYZWKAX-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO CCCN(C(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C)C(C)C ZINC000616695846 343541497 /nfs/dbraw/zinc/54/14/97/343541497.db2.gz MNUBGWJPWGPNOC-VXGBXAGGSA-N 1 2 249.358 2.171 20 0 BEADLO CC[C@H]([NH2+][C@H]1C[C@]1(C)c1ccccc1)C(=O)OC ZINC000619183042 343544509 /nfs/dbraw/zinc/54/45/09/343544509.db2.gz MZBFKUJETBXYJH-KCQAQPDRSA-N 1 2 247.338 2.258 20 0 BEADLO c1c[nH]c(C[NH2+][C@H]2CSCc3ccccc32)n1 ZINC000070939369 343574184 /nfs/dbraw/zinc/57/41/84/343574184.db2.gz WDFNYMWFTXJAJV-LBPRGKRZSA-N 1 2 245.351 2.487 20 0 BEADLO Cc1sccc1CC(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000580570332 365775426 /nfs/dbraw/zinc/77/54/26/365775426.db2.gz VGEWAQXMZGSOGP-MRVPVSSYSA-N 1 2 249.339 2.200 20 0 BEADLO Clc1sccc1C[NH2+]Cc1cc[nH]n1 ZINC000379593659 343580614 /nfs/dbraw/zinc/58/06/14/343580614.db2.gz BXYRHYSNVUCJTN-UHFFFAOYSA-N 1 2 227.720 2.414 20 0 BEADLO Cc1ccc(F)cc1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000622745711 343605552 /nfs/dbraw/zinc/60/55/52/343605552.db2.gz UFNFGFVNRXPNJK-UHFFFAOYSA-N 1 2 247.273 2.129 20 0 BEADLO Cc1ccc(F)cc1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000622745711 343605553 /nfs/dbraw/zinc/60/55/53/343605553.db2.gz UFNFGFVNRXPNJK-UHFFFAOYSA-N 1 2 247.273 2.129 20 0 BEADLO CSC1CC[NH+](Cc2nnc(C)s2)CC1 ZINC000602924478 349820593 /nfs/dbraw/zinc/82/05/93/349820593.db2.gz WORBZSLESSJYSF-UHFFFAOYSA-N 1 2 243.401 2.174 20 0 BEADLO CCCC[C@H]([NH2+][C@H]1CCC(F)(F)C1)C(=O)OC ZINC000379907989 343653837 /nfs/dbraw/zinc/65/38/37/343653837.db2.gz LCYBQOYGXRJGTK-UWVGGRQHSA-N 1 2 249.301 2.496 20 0 BEADLO CCCC[C@@H]([NH2+][C@H]1CCC(F)(F)C1)C(=O)OC ZINC000379907990 343654287 /nfs/dbraw/zinc/65/42/87/343654287.db2.gz LCYBQOYGXRJGTK-VHSXEESVSA-N 1 2 249.301 2.496 20 0 BEADLO Cc1cc(NCc2ccc(Cl)o2)nc[nH+]1 ZINC000380170144 343686067 /nfs/dbraw/zinc/68/60/67/343686067.db2.gz GWSOGUDXMNNFHV-UHFFFAOYSA-N 1 2 223.663 2.065 20 0 BEADLO c1nc(C2CC2)sc1CNc1c[nH]c[nH+]1 ZINC000309080217 349856077 /nfs/dbraw/zinc/85/60/77/349856077.db2.gz OKKWEBJQFHBCBI-UHFFFAOYSA-N 1 2 220.301 2.356 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NCC1CCCCC1 ZINC000584122120 343762471 /nfs/dbraw/zinc/76/24/71/343762471.db2.gz IUCWJRZGHLRAMR-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NCC1CCCCC1 ZINC000584122120 343762473 /nfs/dbraw/zinc/76/24/73/343762473.db2.gz IUCWJRZGHLRAMR-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO CC[C@H]1C[N@H+](Cc2c(C)nsc2C)CCO1 ZINC000584151177 343765607 /nfs/dbraw/zinc/76/56/07/343765607.db2.gz GVITTZNZUHGHAA-NSHDSACASA-N 1 2 240.372 2.371 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2c(C)nsc2C)CCO1 ZINC000584151177 343765609 /nfs/dbraw/zinc/76/56/09/343765609.db2.gz GVITTZNZUHGHAA-NSHDSACASA-N 1 2 240.372 2.371 20 0 BEADLO CC[N@@H+](Cc1cc[nH]n1)Cc1cccs1 ZINC000179721348 346994215 /nfs/dbraw/zinc/99/42/15/346994215.db2.gz YGZUJRBQNIIHFV-UHFFFAOYSA-N 1 2 221.329 2.493 20 0 BEADLO CC[N@H+](Cc1cc[nH]n1)Cc1cccs1 ZINC000179721348 346994216 /nfs/dbraw/zinc/99/42/16/346994216.db2.gz YGZUJRBQNIIHFV-UHFFFAOYSA-N 1 2 221.329 2.493 20 0 BEADLO C[C@H]1COCC[N@@H+]1Cc1cc2cnccc2o1 ZINC000651818844 537823715 /nfs/dbraw/zinc/82/37/15/537823715.db2.gz HVDWMMNDGKWRBE-JTQLQIEISA-N 1 2 232.283 2.049 20 0 BEADLO C[C@H]1COCC[N@H+]1Cc1cc2cnccc2o1 ZINC000651818844 537823722 /nfs/dbraw/zinc/82/37/22/537823722.db2.gz HVDWMMNDGKWRBE-JTQLQIEISA-N 1 2 232.283 2.049 20 0 BEADLO COc1c(C)[nH+]cnc1NC[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000624430081 343841780 /nfs/dbraw/zinc/84/17/80/343841780.db2.gz RDZHCLFQIWOFTC-UTUOFQBUSA-N 1 2 247.342 2.064 20 0 BEADLO C[C@H]1C[C@@H]1C[N@H+](C)Cc1noc(C2CC2)n1 ZINC000625470406 343874618 /nfs/dbraw/zinc/87/46/18/343874618.db2.gz FSFZFGBJPIALAZ-WCBMZHEXSA-N 1 2 221.304 2.035 20 0 BEADLO C[C@H]1C[C@@H]1C[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000625470406 343874620 /nfs/dbraw/zinc/87/46/20/343874620.db2.gz FSFZFGBJPIALAZ-WCBMZHEXSA-N 1 2 221.304 2.035 20 0 BEADLO CC(C)CC1(NC(=O)[C@@H](C)Cc2c[nH+]c[nH]2)CC1 ZINC000620286967 343889754 /nfs/dbraw/zinc/88/97/54/343889754.db2.gz VZSDAFIQVFFRCN-NSHDSACASA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)CC1(NC(=O)[C@@H](C)Cc2c[nH]c[nH+]2)CC1 ZINC000620286967 343889756 /nfs/dbraw/zinc/88/97/56/343889756.db2.gz VZSDAFIQVFFRCN-NSHDSACASA-N 1 2 249.358 2.283 20 0 BEADLO CCCC[C@@H](C(=O)OC)[N@H+](C)Cc1ccco1 ZINC000067226588 343890769 /nfs/dbraw/zinc/89/07/69/343890769.db2.gz XGNFJSVJHDJMOA-LBPRGKRZSA-N 1 2 239.315 2.443 20 0 BEADLO CCCC[C@@H](C(=O)OC)[N@@H+](C)Cc1ccco1 ZINC000067226588 343890773 /nfs/dbraw/zinc/89/07/73/343890773.db2.gz XGNFJSVJHDJMOA-LBPRGKRZSA-N 1 2 239.315 2.443 20 0 BEADLO CCc1nc(CN[C@@H]2CCn3cc[nH+]c32)cs1 ZINC000345358209 343907750 /nfs/dbraw/zinc/90/77/50/343907750.db2.gz WGUSHDASJJTSLR-SNVBAGLBSA-N 1 2 248.355 2.137 20 0 BEADLO Cc1ncc(C[N@@H+]2CCn3cccc3[C@H]2C)o1 ZINC000628119460 343971386 /nfs/dbraw/zinc/97/13/86/343971386.db2.gz UECXGFQMXFVSNT-SNVBAGLBSA-N 1 2 231.299 2.361 20 0 BEADLO Cc1ncc(C[N@H+]2CCn3cccc3[C@H]2C)o1 ZINC000628119460 343971387 /nfs/dbraw/zinc/97/13/87/343971387.db2.gz UECXGFQMXFVSNT-SNVBAGLBSA-N 1 2 231.299 2.361 20 0 BEADLO CN(C)c1ccc(NCc2cscn2)[nH+]c1 ZINC000124571985 343974096 /nfs/dbraw/zinc/97/40/96/343974096.db2.gz ACKMGIAQPSYUEI-UHFFFAOYSA-N 1 2 234.328 2.216 20 0 BEADLO CCCC[C@H](CC)C(=O)NCc1[nH]cc[nH+]1 ZINC000070651452 343953322 /nfs/dbraw/zinc/95/33/22/343953322.db2.gz MSLJCXKWZRDLLV-JTQLQIEISA-N 1 2 223.320 2.242 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)n1 ZINC000628117297 343966365 /nfs/dbraw/zinc/96/63/65/343966365.db2.gz BAGWFEYTTXPJOG-LBPRGKRZSA-N 1 2 230.315 2.383 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC[C@H]2c2ccc[nH]2)n1 ZINC000628117297 343966367 /nfs/dbraw/zinc/96/63/67/343966367.db2.gz BAGWFEYTTXPJOG-LBPRGKRZSA-N 1 2 230.315 2.383 20 0 BEADLO Cc1c[nH]c(C[N@@H+](C)Cc2cccs2)n1 ZINC000628119669 343968020 /nfs/dbraw/zinc/96/80/20/343968020.db2.gz FVRWRMGVINIBPM-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1c[nH]c(C[N@H+](C)Cc2cccs2)n1 ZINC000628119669 343968022 /nfs/dbraw/zinc/96/80/22/343968022.db2.gz FVRWRMGVINIBPM-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO CC[C@H]1CO[C@@H](C)CN1Cc1[nH]c(C)c(C)[nH+]1 ZINC000628119818 343968057 /nfs/dbraw/zinc/96/80/57/343968057.db2.gz LXZNVSKNNMWHMU-CABZTGNLSA-N 1 2 237.347 2.026 20 0 BEADLO CC1(C)CN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000683939511 488248689 /nfs/dbraw/zinc/24/86/89/488248689.db2.gz YOHIJBKWWAXQDP-UHFFFAOYSA-N 1 2 203.289 2.200 20 0 BEADLO Oc1ccc2c(c1)C[N@@H+](CCc1cscn1)C2 ZINC000625727923 344059426 /nfs/dbraw/zinc/05/94/26/344059426.db2.gz RAGXKOGYTQRAGZ-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO Oc1ccc2c(c1)C[N@H+](CCc1cscn1)C2 ZINC000625727923 344059427 /nfs/dbraw/zinc/05/94/27/344059427.db2.gz RAGXKOGYTQRAGZ-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO CC(C)C[C@H](C(=O)N1CC[C@@H]1C)n1cc[nH+]c1 ZINC000641247388 362326823 /nfs/dbraw/zinc/32/68/23/362326823.db2.gz RAPATEIRJAUGLZ-NWDGAFQWSA-N 1 2 235.331 2.091 20 0 BEADLO CCc1nc(CN[C@@H](C)c2[nH]cc[nH+]2)cs1 ZINC000336751612 537839647 /nfs/dbraw/zinc/83/96/47/537839647.db2.gz CJPHZEZHWJDSPU-QMMMGPOBSA-N 1 2 236.344 2.279 20 0 BEADLO FC(F)n1ccnc1C[NH+](C1CC1)C1CC1 ZINC000625836556 344089286 /nfs/dbraw/zinc/08/92/86/344089286.db2.gz AZRCBOUJEDXNQZ-UHFFFAOYSA-N 1 2 227.258 2.405 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCC[C@@](C)(F)C1 ZINC000573338793 344101837 /nfs/dbraw/zinc/10/18/37/344101837.db2.gz YYURFZQNZGUIOS-GFCCVEGCSA-N 1 2 223.295 2.422 20 0 BEADLO CCc1nsc(NCCNc2cccc[nH+]2)n1 ZINC000080764557 344133153 /nfs/dbraw/zinc/13/31/53/344133153.db2.gz UIFQNVNCXDPNCP-UHFFFAOYSA-N 1 2 249.343 2.020 20 0 BEADLO CCn1cccc1C[NH2+]Cc1cc(C)on1 ZINC000085609298 344207122 /nfs/dbraw/zinc/20/71/22/344207122.db2.gz VOBLRAWWWMZJJU-UHFFFAOYSA-N 1 2 219.288 2.094 20 0 BEADLO Cc1nc(N2CC(c3ccccc3)C2)cc[nH+]1 ZINC000631423128 344239077 /nfs/dbraw/zinc/23/90/77/344239077.db2.gz NFPUGMQUCYXQIG-UHFFFAOYSA-N 1 2 225.295 2.389 20 0 BEADLO CC[C@@H]([NH2+][C@H](C)c1cccs1)C(=O)OC ZINC000130906637 344226528 /nfs/dbraw/zinc/22/65/28/344226528.db2.gz FHAHAASGVKJEDP-RKDXNWHRSA-N 1 2 227.329 2.350 20 0 BEADLO C[C@H]1CCC[C@@H]1Nc1cc(CO)cc[nH+]1 ZINC000641348433 362373742 /nfs/dbraw/zinc/37/37/42/362373742.db2.gz XOPHKMDYFURTQC-ONGXEEELSA-N 1 2 206.289 2.174 20 0 BEADLO C[C@H]1CCC[C@H]1Nc1cc(CO)cc[nH+]1 ZINC000641348428 362373927 /nfs/dbraw/zinc/37/39/27/362373927.db2.gz XOPHKMDYFURTQC-GXSJLCMTSA-N 1 2 206.289 2.174 20 0 BEADLO CC(C)COC1CC[NH+](CC(F)F)CC1 ZINC000171990864 344271598 /nfs/dbraw/zinc/27/15/98/344271598.db2.gz LQXRILQQAPPVDV-UHFFFAOYSA-N 1 2 221.291 2.389 20 0 BEADLO Cc1cc2ccccc2[nH+]c1N[C@H]1C[C@@H](CO)C1 ZINC000631428277 344293674 /nfs/dbraw/zinc/29/36/74/344293674.db2.gz USUNGFLUBFGAHI-BJHJDKERSA-N 1 2 242.322 2.148 20 0 BEADLO CCc1cc(N[C@@H]2C[C@@H](C)O[C@H]2C)nc[nH+]1 ZINC000385090278 344322980 /nfs/dbraw/zinc/32/29/80/344322980.db2.gz GDLUUQPHXVXKLS-WCABBAIRSA-N 1 2 221.304 2.017 20 0 BEADLO CC[C@@H]1CN(c2cc[nH+]cc2F)C[C@H](C)O1 ZINC000641368723 362380016 /nfs/dbraw/zinc/38/00/16/362380016.db2.gz XXJVKUMXIADUAO-VHSXEESVSA-N 1 2 224.279 2.224 20 0 BEADLO C[N@H+](CC(F)F)C1Cc2ccccc2C1 ZINC000600641404 344349570 /nfs/dbraw/zinc/34/95/70/344349570.db2.gz QGFOYICSKLIDOU-UHFFFAOYSA-N 1 2 211.255 2.351 20 0 BEADLO C[N@@H+](CC(F)F)C1Cc2ccccc2C1 ZINC000600641404 344349574 /nfs/dbraw/zinc/34/95/74/344349574.db2.gz QGFOYICSKLIDOU-UHFFFAOYSA-N 1 2 211.255 2.351 20 0 BEADLO CC(C)CCCC(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620607993 344358197 /nfs/dbraw/zinc/35/81/97/344358197.db2.gz LQHSPHAIPCELEI-NSHDSACASA-N 1 2 237.347 2.424 20 0 BEADLO C[C@@H]1CSCCN1c1cc[nH+]cc1F ZINC000641386916 362386634 /nfs/dbraw/zinc/38/66/34/362386634.db2.gz NBUGVNGLFRGLQN-MRVPVSSYSA-N 1 2 212.293 2.162 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)CCCF ZINC000622866860 344436012 /nfs/dbraw/zinc/43/60/12/344436012.db2.gz VKDVKIGSKNIRCU-UHFFFAOYSA-N 1 2 210.252 2.387 20 0 BEADLO C[C@@H]([NH2+]Cc1nccs1)c1cccnc1 ZINC000041011704 344411724 /nfs/dbraw/zinc/41/17/24/344411724.db2.gz ZGNNPBMJBZRIMP-SECBINFHSA-N 1 2 219.313 2.389 20 0 BEADLO CCc1cc(NC[C@@H]2CC=CCC2)nc[nH+]1 ZINC000381306213 344493605 /nfs/dbraw/zinc/49/36/05/344493605.db2.gz JWOPJBRDUMVESZ-LLVKDONJSA-N 1 2 217.316 2.229 20 0 BEADLO Fc1c[nH+]ccc1N[C@H]1CCC(F)(F)C1 ZINC000641437955 362419103 /nfs/dbraw/zinc/41/91/03/362419103.db2.gz ALUYKZUOYSSHKR-ZETCQYMHSA-N 1 2 216.206 2.242 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC(C)(F)C1 ZINC000672765337 488265841 /nfs/dbraw/zinc/26/58/41/488265841.db2.gz GKEJPDIHLIMIPF-UHFFFAOYSA-N 1 2 237.278 2.274 20 0 BEADLO C[C@@H]1C[C@H](C)CCN(c2cc(CO)cc[nH+]2)C1 ZINC000641456547 362429807 /nfs/dbraw/zinc/42/98/07/362429807.db2.gz QKCGJIYBPDCIQT-VXGBXAGGSA-N 1 2 234.343 2.446 20 0 BEADLO C[N@@H+](Cc1ccccc1)CN1CC(C)(C)OC1=O ZINC000494001359 529999985 /nfs/dbraw/zinc/99/99/85/529999985.db2.gz AKVXOEBGKGLKKD-UHFFFAOYSA-N 1 2 248.326 2.307 20 0 BEADLO C[N@H+](Cc1ccccc1)CN1CC(C)(C)OC1=O ZINC000494001359 529999986 /nfs/dbraw/zinc/99/99/86/529999986.db2.gz AKVXOEBGKGLKKD-UHFFFAOYSA-N 1 2 248.326 2.307 20 0 BEADLO CCc1nc(C[NH2+][C@@H](C)c2ccccc2)no1 ZINC000181356109 347056318 /nfs/dbraw/zinc/05/63/18/347056318.db2.gz KHGDWXDFWPDNOM-JTQLQIEISA-N 1 2 231.299 2.483 20 0 BEADLO OCc1cc[nH+]c(NCCCc2cccs2)c1 ZINC000641475046 362444011 /nfs/dbraw/zinc/44/40/11/362444011.db2.gz CDJADWPRZBKWQD-UHFFFAOYSA-N 1 2 248.351 2.102 20 0 BEADLO CC[N@H+](Cc1ncc[nH]1)Cc1ccc(OC)cc1 ZINC000111202905 344583614 /nfs/dbraw/zinc/58/36/14/344583614.db2.gz YULQVMACJXUVNG-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO CC[N@@H+](Cc1ncc[nH]1)Cc1ccc(OC)cc1 ZINC000111202905 344583619 /nfs/dbraw/zinc/58/36/19/344583619.db2.gz YULQVMACJXUVNG-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO Fc1c[nH+]ccc1N1CCC(F)(F)C1 ZINC000641479010 362447507 /nfs/dbraw/zinc/44/75/07/362447507.db2.gz CVCMTZLDJJFIDA-UHFFFAOYSA-N 1 2 202.179 2.066 20 0 BEADLO Fc1c[nH+]ccc1N1CCC[C@H](OC(F)F)C1 ZINC000641485077 362453690 /nfs/dbraw/zinc/45/36/90/362453690.db2.gz IOMBOMNGWDGVPA-QMMMGPOBSA-N 1 2 246.232 2.429 20 0 BEADLO CC(C)(C)[C@H]1CN(c2cc[nH+]cc2F)CCO1 ZINC000641544588 362492435 /nfs/dbraw/zinc/49/24/35/362492435.db2.gz ZGJYIZNDZDNFQE-GFCCVEGCSA-N 1 2 238.306 2.472 20 0 BEADLO C[C@H]1C[C@H](CCNc2cc[nH+]cc2F)CCO1 ZINC000641487911 362456153 /nfs/dbraw/zinc/45/61/53/362456153.db2.gz XBAJWZDATBBDAX-WDEREUQCSA-N 1 2 238.306 2.260 20 0 BEADLO Fc1c[nH+]ccc1N[C@H]1CCO[C@H](C2CC2)C1 ZINC000641491428 362460005 /nfs/dbraw/zinc/46/00/05/362460005.db2.gz PFRKFHALLAOEGJ-GWCFXTLKSA-N 1 2 236.290 2.012 20 0 BEADLO COC[C@@H]1CCCCN(c2cc[nH+]cc2F)C1 ZINC000641497336 362462790 /nfs/dbraw/zinc/46/27/90/362462790.db2.gz SOBRHUJFVBLMPP-LLVKDONJSA-N 1 2 238.306 2.474 20 0 BEADLO CCO[C@H](C(=O)Nc1ccc(C)[nH+]c1C)C1CC1 ZINC000626060847 344707410 /nfs/dbraw/zinc/70/74/10/344707410.db2.gz MZXNSTGIDFZTMS-ZDUSSCGKSA-N 1 2 248.326 2.452 20 0 BEADLO COC1CC(C(=O)Nc2ccc(C)[nH+]c2C)C1 ZINC000626060850 344707428 /nfs/dbraw/zinc/70/74/28/344707428.db2.gz NEEPBGHKHVRSNL-UHFFFAOYSA-N 1 2 234.299 2.062 20 0 BEADLO Cc1ccc(C(=O)N[C@@H](C)c2[nH+]ccn2C)cc1 ZINC000082281444 344714157 /nfs/dbraw/zinc/71/41/57/344714157.db2.gz UMFPDZMALLGFTQ-NSHDSACASA-N 1 2 243.310 2.220 20 0 BEADLO OCc1cc[nH+]c(NC[C@H]2CCC(F)(F)C2)c1 ZINC000641547555 362494946 /nfs/dbraw/zinc/49/49/46/362494946.db2.gz BNYPXJSDYHUTBF-JTQLQIEISA-N 1 2 242.269 2.421 20 0 BEADLO CC[C@H](C)C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000075552090 344779167 /nfs/dbraw/zinc/77/91/67/344779167.db2.gz PHFPYZSOJXHNMY-WDEREUQCSA-N 1 2 235.331 2.162 20 0 BEADLO O=C(c1ccoc1)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000075553604 344779268 /nfs/dbraw/zinc/77/92/68/344779268.db2.gz YUJJCSBJYAGXCW-SNVBAGLBSA-N 1 2 245.282 2.023 20 0 BEADLO CC(C)[C@H](C)CC(=O)NCCNc1cccc[nH+]1 ZINC000075988141 344789840 /nfs/dbraw/zinc/78/98/40/344789840.db2.gz KOTZLWWHJBQNRN-GFCCVEGCSA-N 1 2 249.358 2.292 20 0 BEADLO CC(C)C[N@@H+]1CC(=O)NC12CCC(C)(C)CC2 ZINC000076330416 344800692 /nfs/dbraw/zinc/80/06/92/344800692.db2.gz FKKMEOUALKAFCM-UHFFFAOYSA-N 1 2 238.375 2.371 20 0 BEADLO CC(C)C[N@H+]1CC(=O)NC12CCC(C)(C)CC2 ZINC000076330416 344800693 /nfs/dbraw/zinc/80/06/93/344800693.db2.gz FKKMEOUALKAFCM-UHFFFAOYSA-N 1 2 238.375 2.371 20 0 BEADLO C[C@H](NC(=O)[C@@H]1CCCC12CC2)c1[nH+]ccn1C ZINC000628148859 344835390 /nfs/dbraw/zinc/83/53/90/344835390.db2.gz CDIRXGOOGZDPDR-QWRGUYRKSA-N 1 2 247.342 2.178 20 0 BEADLO Cc1ncc(C[N@@H+]2CCC[C@H](c3ccn[nH]3)C2)o1 ZINC000628147887 344831963 /nfs/dbraw/zinc/83/19/63/344831963.db2.gz ZSNZNRLBHFKXNC-NSHDSACASA-N 1 2 246.314 2.086 20 0 BEADLO Cc1ncc(C[N@H+]2CCC[C@H](c3ccn[nH]3)C2)o1 ZINC000628147887 344831965 /nfs/dbraw/zinc/83/19/65/344831965.db2.gz ZSNZNRLBHFKXNC-NSHDSACASA-N 1 2 246.314 2.086 20 0 BEADLO Cc1c[nH]c(C[NH+]2C[C@@H](C)S[C@H](C)C2)n1 ZINC000628156356 344848734 /nfs/dbraw/zinc/84/87/34/344848734.db2.gz MEHNMQPEUQFRMF-NXEZZACHSA-N 1 2 225.361 2.044 20 0 BEADLO Cc1c[nH]c(CN(C)Cc2ccoc2C)[nH+]1 ZINC000628153297 344843334 /nfs/dbraw/zinc/84/33/34/344843334.db2.gz IYOZUMIROPGSML-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO Cc1ccc(NC(=O)[C@]2(C)CCCO2)c(C)[nH+]1 ZINC000268023515 178750702 /nfs/dbraw/zinc/75/07/02/178750702.db2.gz ULQAWGSIMMCRKE-ZDUSSCGKSA-N 1 2 234.299 2.206 20 0 BEADLO C[C@@H]1CN(c2cccc[nH+]2)C[C@@H](C)S1 ZINC000078495633 344876251 /nfs/dbraw/zinc/87/62/51/344876251.db2.gz APAUQFWIEKRTMM-NXEZZACHSA-N 1 2 208.330 2.412 20 0 BEADLO CCc1ccnc(CNc2cc(CO)cc[nH+]2)c1 ZINC000641550373 362496199 /nfs/dbraw/zinc/49/61/99/362496199.db2.gz TVBOQRZRBBTCET-UHFFFAOYSA-N 1 2 243.310 2.143 20 0 BEADLO CC[N@H+](Cc1cnc(C)o1)Cc1ccccn1 ZINC000628171813 344891734 /nfs/dbraw/zinc/89/17/34/344891734.db2.gz NNKJEGISBMSASM-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1cnc(C)o1)Cc1ccccn1 ZINC000628171813 344891736 /nfs/dbraw/zinc/89/17/36/344891736.db2.gz NNKJEGISBMSASM-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CCC[C@@H]1CN(Cc2[nH]c(C)c(C)[nH+]2)CCO1 ZINC000628178796 344913433 /nfs/dbraw/zinc/91/34/33/344913433.db2.gz CLBIBSGZIPQJPS-GFCCVEGCSA-N 1 2 237.347 2.027 20 0 BEADLO Cc1ncc(CNc2ccc(N(C)C)[nH+]c2)o1 ZINC000628198988 344965747 /nfs/dbraw/zinc/96/57/47/344965747.db2.gz VHVCHXAJMLMLCU-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO Cc1[nH+]c2ccccn2c1CS[C@H](C)CO ZINC000079105629 344939169 /nfs/dbraw/zinc/93/91/69/344939169.db2.gz YYPZQBIVQIXEOV-SECBINFHSA-N 1 2 236.340 2.257 20 0 BEADLO Cc1ncc(C[N@@H+]2CCOCC23CCCC3)o1 ZINC000628187944 344940798 /nfs/dbraw/zinc/94/07/98/344940798.db2.gz HJPJTDKKMOWFSU-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO Cc1ncc(C[N@H+]2CCOCC23CCCC3)o1 ZINC000628187944 344940799 /nfs/dbraw/zinc/94/07/99/344940799.db2.gz HJPJTDKKMOWFSU-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO COC(=O)C[N@H+](Cc1c(C)cccc1C)C1CC1 ZINC000079500048 344981376 /nfs/dbraw/zinc/98/13/76/344981376.db2.gz JMGLOCPDUAEABO-UHFFFAOYSA-N 1 2 247.338 2.441 20 0 BEADLO COC(=O)C[N@@H+](Cc1c(C)cccc1C)C1CC1 ZINC000079500048 344981378 /nfs/dbraw/zinc/98/13/78/344981378.db2.gz JMGLOCPDUAEABO-UHFFFAOYSA-N 1 2 247.338 2.441 20 0 BEADLO Cc1ccc(NC(=O)N2CC(C)(F)C2)c(C)[nH+]1 ZINC000684231380 488279991 /nfs/dbraw/zinc/27/99/91/488279991.db2.gz CMXBYJFROREWJN-UHFFFAOYSA-N 1 2 237.278 2.274 20 0 BEADLO Nc1[nH+]cccc1CS[C@@H]1CCCOC1 ZINC000603322606 349922355 /nfs/dbraw/zinc/92/23/55/349922355.db2.gz JXTJHMHICXHESY-SNVBAGLBSA-N 1 2 224.329 2.076 20 0 BEADLO Cc1cc(CNc2cccc[nH+]2)sn1 ZINC000238527571 345070542 /nfs/dbraw/zinc/07/05/42/345070542.db2.gz KZOPFHJAVDAWSS-UHFFFAOYSA-N 1 2 205.286 2.459 20 0 BEADLO Cc1ncsc1CCNc1cc[nH+]cc1F ZINC000641617371 362549953 /nfs/dbraw/zinc/54/99/53/362549953.db2.gz GLKMOCYNODQXRC-UHFFFAOYSA-N 1 2 237.303 2.062 20 0 BEADLO C[C@H]1CN(c2cc(CO)cc[nH+]2)CCC1(F)F ZINC000641602630 362540495 /nfs/dbraw/zinc/54/04/95/362540495.db2.gz XRMGJEZIXMPRTF-VIFPVBQESA-N 1 2 242.269 2.055 20 0 BEADLO CC(C)[C@H]1CN(c2cc[nH+]cc2F)CCCO1 ZINC000641612485 362544155 /nfs/dbraw/zinc/54/41/55/362544155.db2.gz GICHTIMIQDBXJI-CYBMUJFWSA-N 1 2 238.306 2.472 20 0 BEADLO COCC1(CCNc2cc[nH+]cc2F)CCC1 ZINC000641610966 362546056 /nfs/dbraw/zinc/54/60/56/362546056.db2.gz IPIYIRBJJMXLCN-UHFFFAOYSA-N 1 2 238.306 2.261 20 0 BEADLO COC1(CCNc2cc[nH+]cc2F)CCC1 ZINC000641611202 362546474 /nfs/dbraw/zinc/54/64/74/362546474.db2.gz MHXCNPDBQPLFFE-UHFFFAOYSA-N 1 2 224.279 2.014 20 0 BEADLO C[C@H](CO)C1CCN(c2cc[nH+]cc2F)CC1 ZINC000641650410 362574623 /nfs/dbraw/zinc/57/46/23/362574623.db2.gz UHRVHGVPGIRBMY-SNVBAGLBSA-N 1 2 238.306 2.066 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000641648884 362575828 /nfs/dbraw/zinc/57/58/28/362575828.db2.gz RSYOAJAODPOLTK-OPRDCNLKSA-N 1 2 206.264 2.243 20 0 BEADLO CC(C)(F)CCNc1cc(CO)cc[nH+]1 ZINC000641658114 362582300 /nfs/dbraw/zinc/58/23/00/362582300.db2.gz BRNFKWGZNKKBKJ-UHFFFAOYSA-N 1 2 212.268 2.124 20 0 BEADLO CC[C@@H](Nc1cc[nH+]cc1F)[C@@H]1CCCCO1 ZINC000641655099 362578817 /nfs/dbraw/zinc/57/88/17/362578817.db2.gz CLPMGQCSCWRRLV-YPMHNXCESA-N 1 2 238.306 2.402 20 0 BEADLO CCCCN(CC)C(=O)[C@@H]1CCn2cc[nH+]c2C1 ZINC000155869725 345109383 /nfs/dbraw/zinc/10/93/83/345109383.db2.gz ZZUQODIAWQKFFD-GFCCVEGCSA-N 1 2 249.358 2.094 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1Nc1cc(CO)cc[nH+]1 ZINC000641631055 362562733 /nfs/dbraw/zinc/56/27/33/362562733.db2.gz XHKQGDDAYLEOON-YPMHNXCESA-N 1 2 220.316 2.420 20 0 BEADLO CC(C)(CNc1cc[nH+]cc1F)c1cccnc1 ZINC000641637510 362565198 /nfs/dbraw/zinc/56/51/98/362565198.db2.gz ZGCMJDYPCMSCQX-UHFFFAOYSA-N 1 2 245.301 2.427 20 0 BEADLO C[C@@]1(C2CC2)CN(c2cc[nH+]cc2F)CCO1 ZINC000641657844 362581901 /nfs/dbraw/zinc/58/19/01/362581901.db2.gz XXAAHQMDWLCXHE-ZDUSSCGKSA-N 1 2 236.290 2.226 20 0 BEADLO OCc1cc[nH+]c(N2CC[C@H](C3CCC3)C2)c1 ZINC000641639144 362566785 /nfs/dbraw/zinc/56/67/85/362566785.db2.gz UJFWVBPTHOIAAO-ZDUSSCGKSA-N 1 2 232.327 2.200 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CCCc2[nH+]c[nH]c21)C(C)(C)C ZINC000582129245 345145082 /nfs/dbraw/zinc/14/50/82/345145082.db2.gz OZSRLPRWWCDHIL-ZJUUUORDSA-N 1 2 249.358 2.380 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CCCc2[nH]c[nH+]c21)C(C)(C)C ZINC000582129245 345145083 /nfs/dbraw/zinc/14/50/83/345145083.db2.gz OZSRLPRWWCDHIL-ZJUUUORDSA-N 1 2 249.358 2.380 20 0 BEADLO CC[C@H](O)Cn1c[nH+]c2cc(F)c(F)cc21 ZINC000156341582 345147910 /nfs/dbraw/zinc/14/79/10/345147910.db2.gz NNYJVFFGQVCQEF-ZETCQYMHSA-N 1 2 226.226 2.085 20 0 BEADLO CCSc1cc(C[NH2+]Cc2ccon2)ccn1 ZINC000634977252 345153562 /nfs/dbraw/zinc/15/35/62/345153562.db2.gz UWTKGEPHXANCGE-UHFFFAOYSA-N 1 2 249.339 2.471 20 0 BEADLO Fc1cccc2c1OCC[C@@H]2[NH2+]Cc1ccon1 ZINC000634977811 345154847 /nfs/dbraw/zinc/15/48/47/345154847.db2.gz LENHSMJBMJQOEC-LBPRGKRZSA-N 1 2 248.257 2.427 20 0 BEADLO CCCN(CCC)C(=O)Cc1[nH]cc(CC)[nH+]1 ZINC000635065473 345237410 /nfs/dbraw/zinc/23/74/10/345237410.db2.gz KJBSGJAOGCFUPK-UHFFFAOYSA-N 1 2 237.347 2.163 20 0 BEADLO CCc1c[nH]c(CC(=O)NC2CCCCCC2)[nH+]1 ZINC000635073917 345240010 /nfs/dbraw/zinc/24/00/10/345240010.db2.gz NMGQBFVOSAXDMU-UHFFFAOYSA-N 1 2 249.358 2.354 20 0 BEADLO CCCN(CC1CC1)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635081566 345241994 /nfs/dbraw/zinc/24/19/94/345241994.db2.gz AOZOLWUHGSBHTE-VXGBXAGGSA-N 1 2 247.342 2.162 20 0 BEADLO CCCN(CC1CC1)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635081566 345241999 /nfs/dbraw/zinc/24/19/99/345241999.db2.gz AOZOLWUHGSBHTE-VXGBXAGGSA-N 1 2 247.342 2.162 20 0 BEADLO C[C@H]1CCCC[C@@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635077886 345242371 /nfs/dbraw/zinc/24/23/71/345242371.db2.gz JTAVVZDDTQJRPI-QCNOEVLYSA-N 1 2 247.342 2.208 20 0 BEADLO C[C@H]1CCCC[C@@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635077886 345242372 /nfs/dbraw/zinc/24/23/72/345242372.db2.gz JTAVVZDDTQJRPI-QCNOEVLYSA-N 1 2 247.342 2.208 20 0 BEADLO CC(C)C[C@H](C(=O)N[C@H](C)C1CC1)n1cc[nH+]c1 ZINC000635126284 345252462 /nfs/dbraw/zinc/25/24/62/345252462.db2.gz ZBYFGHAFJFDVSN-DGCLKSJQSA-N 1 2 249.358 2.385 20 0 BEADLO c1[nH]nnc1C[NH2+][C@@H]1CCCC12CCCC2 ZINC000398346370 345273511 /nfs/dbraw/zinc/27/35/11/345273511.db2.gz MXMMBDZLONCDJL-LLVKDONJSA-N 1 2 220.320 2.007 20 0 BEADLO c1n[nH]nc1C[NH2+][C@@H]1CCCC12CCCC2 ZINC000398346370 345273513 /nfs/dbraw/zinc/27/35/13/345273513.db2.gz MXMMBDZLONCDJL-LLVKDONJSA-N 1 2 220.320 2.007 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@H]2CCC[C@@H](C)C2)[nH+]1 ZINC000635230077 345278912 /nfs/dbraw/zinc/27/89/12/345278912.db2.gz VQELGVFNOAMCLY-PWSUYJOCSA-N 1 2 249.358 2.210 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@@H]2CCC[C@H](C)C2)[nH+]1 ZINC000635230072 345279115 /nfs/dbraw/zinc/27/91/15/345279115.db2.gz VQELGVFNOAMCLY-CMPLNLGQSA-N 1 2 249.358 2.210 20 0 BEADLO CCCCN(C(=O)Cc1[nH]cc(CC)[nH+]1)C1CC1 ZINC000635232890 345281041 /nfs/dbraw/zinc/28/10/41/345281041.db2.gz OOJLBYONAPVPCI-UHFFFAOYSA-N 1 2 249.358 2.306 20 0 BEADLO CC(C)[C@@H](C)N(C)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635236641 345281052 /nfs/dbraw/zinc/28/10/52/345281052.db2.gz WVGQWBOGLYAVDK-GMTAPVOTSA-N 1 2 235.331 2.016 20 0 BEADLO CC(C)[C@@H](C)N(C)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635236641 345281056 /nfs/dbraw/zinc/28/10/56/345281056.db2.gz WVGQWBOGLYAVDK-GMTAPVOTSA-N 1 2 235.331 2.016 20 0 BEADLO CC(C)CCCNC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635240222 345282000 /nfs/dbraw/zinc/28/20/00/345282000.db2.gz MSDOZNRBCZQOLX-GHMZBOCLSA-N 1 2 235.331 2.066 20 0 BEADLO CC(C)CCCNC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635240222 345282001 /nfs/dbraw/zinc/28/20/01/345282001.db2.gz MSDOZNRBCZQOLX-GHMZBOCLSA-N 1 2 235.331 2.066 20 0 BEADLO CCCN(CC(C)C)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635248355 345284910 /nfs/dbraw/zinc/28/49/10/345284910.db2.gz HDIPXKLIEVCLLJ-VXGBXAGGSA-N 1 2 249.358 2.408 20 0 BEADLO CCCN(CC(C)C)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635248355 345284912 /nfs/dbraw/zinc/28/49/12/345284912.db2.gz HDIPXKLIEVCLLJ-VXGBXAGGSA-N 1 2 249.358 2.408 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CCC(CC)CC2)[nH+]1 ZINC000635394048 345341150 /nfs/dbraw/zinc/34/11/50/345341150.db2.gz PXSSQMOHEURAAG-UHFFFAOYSA-N 1 2 249.358 2.163 20 0 BEADLO Cc1cn2ccc(C(=O)N[C@H]3CC3(C)C)cc2[nH+]1 ZINC000635407304 345351266 /nfs/dbraw/zinc/35/12/66/345351266.db2.gz SVPHDBIFPPKJOR-NSHDSACASA-N 1 2 243.310 2.171 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@@H](C)[C@H](C)CC)[nH+]1 ZINC000635419792 345359833 /nfs/dbraw/zinc/35/98/33/345359833.db2.gz GXEFZSAHEVLCLD-ZJUUUORDSA-N 1 2 237.347 2.065 20 0 BEADLO CCC[C@@H](CC)NC(=O)Cc1[nH]cc(CC)[nH+]1 ZINC000635444348 345374521 /nfs/dbraw/zinc/37/45/21/345374521.db2.gz PTTBPQAQCPKVJZ-SNVBAGLBSA-N 1 2 237.347 2.210 20 0 BEADLO CCCN(C)C(=O)c1ccn2cc(C)[nH+]c2c1 ZINC000635449108 345376141 /nfs/dbraw/zinc/37/61/41/345376141.db2.gz QMKVTULAKOUIBF-UHFFFAOYSA-N 1 2 231.299 2.125 20 0 BEADLO CC(C)C[C@H](C(=O)N1CC[C@@H](C)C1)n1cc[nH+]c1 ZINC000635464806 345382688 /nfs/dbraw/zinc/38/26/88/345382688.db2.gz CPCFRZUDOLOJOY-CHWSQXEVSA-N 1 2 249.358 2.339 20 0 BEADLO CC(C)C[C@H](C(=O)N1CC[C@H](C)C1)n1cc[nH+]c1 ZINC000635464808 345382874 /nfs/dbraw/zinc/38/28/74/345382874.db2.gz CPCFRZUDOLOJOY-QWHCGFSZSA-N 1 2 249.358 2.339 20 0 BEADLO CC(C)C[C@H](C(=O)N(C)CC1CC1)n1cc[nH+]c1 ZINC000635378072 345333849 /nfs/dbraw/zinc/33/38/49/345333849.db2.gz SHAHAQYCXUBPCV-CYBMUJFWSA-N 1 2 249.358 2.339 20 0 BEADLO CCc1c[nH]c(CC(=O)N2[C@H](C)CCC[C@@H]2C)[nH+]1 ZINC000635514032 345407604 /nfs/dbraw/zinc/40/76/04/345407604.db2.gz YTWNSXAKXKYMFV-PHIMTYICSA-N 1 2 249.358 2.304 20 0 BEADLO Cc1nc2[nH]ccc2c(N(C)Cc2ccco2)[nH+]1 ZINC000080763673 345450037 /nfs/dbraw/zinc/45/00/37/345450037.db2.gz PBKONPVQIPGADZ-UHFFFAOYSA-N 1 2 242.282 2.496 20 0 BEADLO Cc1cc(CNc2[nH+]c(C)nc3[nH]ccc32)on1 ZINC000080970153 345456138 /nfs/dbraw/zinc/45/61/38/345456138.db2.gz DBPVQNCRMNYPHF-UHFFFAOYSA-N 1 2 243.270 2.175 20 0 BEADLO COCCCCCNc1[nH+]c(C)nc2[nH]ccc21 ZINC000080970899 345456308 /nfs/dbraw/zinc/45/63/08/345456308.db2.gz OVUDMXKOWCMNBD-UHFFFAOYSA-N 1 2 248.330 2.495 20 0 BEADLO O=C(Cn1cc[nH+]c1)NCCCCC1CCCC1 ZINC000081481444 345471980 /nfs/dbraw/zinc/47/19/80/345471980.db2.gz RJOGXPGYBYZMGI-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO CC[C@H](C)[C@H](O)CNc1cc[nH+]c2ccncc12 ZINC000085686787 345528666 /nfs/dbraw/zinc/52/86/66/345528666.db2.gz GTKXLNHWGGEJHP-IINYFYTJSA-N 1 2 245.326 2.449 20 0 BEADLO C[C@@H](CO)[C@@H](C)Nc1cc[nH+]c2ccncc12 ZINC000085687881 345528703 /nfs/dbraw/zinc/52/87/03/345528703.db2.gz PVOZCMDEKXEQFT-VHSXEESVSA-N 1 2 231.299 2.059 20 0 BEADLO O=C(C=C1CCC1)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000087275906 345541046 /nfs/dbraw/zinc/54/10/46/345541046.db2.gz JYDZLKOABURHOH-GFCCVEGCSA-N 1 2 245.326 2.226 20 0 BEADLO C[C@@H](CCCO)Nc1cc[nH+]c2ccncc12 ZINC000088758382 345545176 /nfs/dbraw/zinc/54/51/76/345545176.db2.gz PSPSTNYYHIYTCP-JTQLQIEISA-N 1 2 231.299 2.203 20 0 BEADLO Cc1cc(N2CCOCC[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000089269499 345552667 /nfs/dbraw/zinc/55/26/67/345552667.db2.gz ZJXLGGHVJVIWOB-NSHDSACASA-N 1 2 247.342 2.278 20 0 BEADLO CC(C)c1cc(NCCO)nc(C(C)C)[nH+]1 ZINC000090065193 345564060 /nfs/dbraw/zinc/56/40/60/345564060.db2.gz YPTZLAOPNILARL-UHFFFAOYSA-N 1 2 223.320 2.128 20 0 BEADLO CC(C)c1cc(N(C)CCO)nc(C(C)C)[nH+]1 ZINC000090065150 345564176 /nfs/dbraw/zinc/56/41/76/345564176.db2.gz MVDPOTQWGSEIKZ-UHFFFAOYSA-N 1 2 237.347 2.152 20 0 BEADLO CN(CCCNc1cccc[nH+]1)CC(F)(F)F ZINC000091431960 345592856 /nfs/dbraw/zinc/59/28/56/345592856.db2.gz KXUPIFXREJAVAL-UHFFFAOYSA-N 1 2 247.264 2.378 20 0 BEADLO COCc1cc(C[NH2+][C@H](C)c2ccccn2)no1 ZINC000641701263 362614284 /nfs/dbraw/zinc/61/42/84/362614284.db2.gz RBGIHRMIKIATLB-SNVBAGLBSA-N 1 2 247.298 2.067 20 0 BEADLO Cc1ccoc1C[N@@H+](C)Cc1cnccn1 ZINC000092591524 345640663 /nfs/dbraw/zinc/64/06/63/345640663.db2.gz FDHNTJUGIGCPEH-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ccoc1C[N@H+](C)Cc1cnccn1 ZINC000092591524 345640666 /nfs/dbraw/zinc/64/06/66/345640666.db2.gz FDHNTJUGIGCPEH-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO CCOCCN(C)c1cc[nH+]c(C(C)C)n1 ZINC000092963068 345649013 /nfs/dbraw/zinc/64/90/13/345649013.db2.gz UHQHPTWDBDBZKW-UHFFFAOYSA-N 1 2 223.320 2.073 20 0 BEADLO CCC(O)(CC)CN(C)c1cc[nH+]cc1F ZINC000641679003 362601084 /nfs/dbraw/zinc/60/10/84/362601084.db2.gz ABBTUQUJYJWNGH-UHFFFAOYSA-N 1 2 226.295 2.208 20 0 BEADLO Cc1ccc(CNc2cc(CO)cc[nH+]2)o1 ZINC000641684014 362602728 /nfs/dbraw/zinc/60/27/28/362602728.db2.gz UEMCPYUNIORQAJ-UHFFFAOYSA-N 1 2 218.256 2.087 20 0 BEADLO CCOc1ccn(Cc2ccc(C)[nH+]c2)n1 ZINC000641729612 362644646 /nfs/dbraw/zinc/64/46/46/362644646.db2.gz JCPAQYJGUFAXIO-UHFFFAOYSA-N 1 2 217.272 2.034 20 0 BEADLO CCc1ncc(C[N@@H+]2CCO[C@@H](C)[C@@H]2C)s1 ZINC000093417685 345670564 /nfs/dbraw/zinc/67/05/64/345670564.db2.gz SDAPQPGCDQMRDZ-UWVGGRQHSA-N 1 2 240.372 2.315 20 0 BEADLO CCc1ncc(C[N@H+]2CCO[C@@H](C)[C@@H]2C)s1 ZINC000093417685 345670566 /nfs/dbraw/zinc/67/05/66/345670566.db2.gz SDAPQPGCDQMRDZ-UWVGGRQHSA-N 1 2 240.372 2.315 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+]Cc2ccncc2N)s1 ZINC000641733455 362654962 /nfs/dbraw/zinc/65/49/62/362654962.db2.gz PZAZFRBJXJYISO-SECBINFHSA-N 1 2 248.355 2.280 20 0 BEADLO O[C@@H](CNc1cccc[nH+]1)Cc1ccccc1 ZINC000144096638 345708207 /nfs/dbraw/zinc/70/82/07/345708207.db2.gz LLSVDYUMOIPLSZ-CYBMUJFWSA-N 1 2 228.295 2.097 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CCCC(C)(C)C2)[nH+]1 ZINC000635557212 345714188 /nfs/dbraw/zinc/71/41/88/345714188.db2.gz OBDIMSYIDNRRJX-UHFFFAOYSA-N 1 2 249.358 2.163 20 0 BEADLO CCOC(=O)Cc1c[nH+]cn1Cc1ccccc1 ZINC000146638698 345714629 /nfs/dbraw/zinc/71/46/29/345714629.db2.gz XOIYZRSODUQQBD-UHFFFAOYSA-N 1 2 244.294 2.037 20 0 BEADLO CC[C@H]1C[N@H+](CCC(F)(F)F)CCO1 ZINC000148566105 345719266 /nfs/dbraw/zinc/71/92/66/345719266.db2.gz SVWPXTGGSXKBAX-QMMMGPOBSA-N 1 2 211.227 2.050 20 0 BEADLO CC[C@H]1C[N@@H+](CCC(F)(F)F)CCO1 ZINC000148566105 345719270 /nfs/dbraw/zinc/71/92/70/345719270.db2.gz SVWPXTGGSXKBAX-QMMMGPOBSA-N 1 2 211.227 2.050 20 0 BEADLO CCCCCCNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000209383559 345736795 /nfs/dbraw/zinc/73/67/95/345736795.db2.gz VDLMLGGXSKULHH-SREVYHEPSA-N 1 2 221.304 2.119 20 0 BEADLO Cc1cc(N[C@H]2COCc3ccccc32)nc[nH+]1 ZINC000418982601 192090840 /nfs/dbraw/zinc/09/08/40/192090840.db2.gz CFQQSLIGJXRHDQ-ZDUSSCGKSA-N 1 2 241.294 2.468 20 0 BEADLO Cc1cc(N[C@@H]2C[C@H](C)O[C@H]2C)nc(C2CC2)[nH+]1 ZINC000631463189 345775719 /nfs/dbraw/zinc/77/57/19/345775719.db2.gz ATQMZZOHCNGQHW-JBLDHEPKSA-N 1 2 247.342 2.062 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H](C)Cc1ccco1 ZINC000668420250 537912400 /nfs/dbraw/zinc/91/24/00/537912400.db2.gz YSCUFABTUPOCGC-SNVBAGLBSA-N 1 2 244.294 2.222 20 0 BEADLO Cc1nc(NCCCc2cccs2)cc[nH+]1 ZINC000381393218 345795007 /nfs/dbraw/zinc/79/50/07/345795007.db2.gz OTYWLBDNGWUZTM-UHFFFAOYSA-N 1 2 233.340 2.313 20 0 BEADLO c1cc(OCc2nnc(C3CC3)s2)cc[nH+]1 ZINC000418952779 192092251 /nfs/dbraw/zinc/09/22/51/192092251.db2.gz KOMHQXJUSLTCDH-UHFFFAOYSA-N 1 2 233.296 2.390 20 0 BEADLO C[C@@H]1C[C@H](Nc2cc[nH+]c(C(C)(C)C)n2)[C@@H](C)O1 ZINC000631466001 345853929 /nfs/dbraw/zinc/85/39/29/345853929.db2.gz UCFUWQDOYAPUNO-MXWKQRLJSA-N 1 2 249.358 2.174 20 0 BEADLO C[C@@H](NC(=O)CCc1cccs1)c1[nH]cc[nH+]1 ZINC000140875643 345824470 /nfs/dbraw/zinc/82/44/70/345824470.db2.gz ZUEAXTKXAIZXKW-SECBINFHSA-N 1 2 249.339 2.281 20 0 BEADLO CC[C@H](C)C[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635614742 345893669 /nfs/dbraw/zinc/89/36/69/345893669.db2.gz FHJKIRMOGMZQRQ-IRCOFANPSA-N 1 2 249.358 2.454 20 0 BEADLO CC[C@H](C)C[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635614742 345893671 /nfs/dbraw/zinc/89/36/71/345893671.db2.gz FHJKIRMOGMZQRQ-IRCOFANPSA-N 1 2 249.358 2.454 20 0 BEADLO Cc1cn2ccc(C(=O)N(C)C3CCC3)cc2[nH+]1 ZINC000635614169 345893841 /nfs/dbraw/zinc/89/38/41/345893841.db2.gz LCUCKWCKVJXGGA-UHFFFAOYSA-N 1 2 243.310 2.267 20 0 BEADLO CC(C)=C(C)CC(=O)NC[C@H](C)Cn1cc[nH+]c1 ZINC000635591777 345884755 /nfs/dbraw/zinc/88/47/55/345884755.db2.gz GUTZEMFRARBZAO-LBPRGKRZSA-N 1 2 249.358 2.382 20 0 BEADLO CCc1c[nH]c(CC(=O)N2C[C@H](C)CC[C@H]2C)[nH+]1 ZINC000635633289 345911799 /nfs/dbraw/zinc/91/17/99/345911799.db2.gz YZTZDUZINKOWNX-GHMZBOCLSA-N 1 2 249.358 2.162 20 0 BEADLO Cc1ncc(C[NH2+]C(C)(C)c2nccs2)o1 ZINC000628216686 345922602 /nfs/dbraw/zinc/92/26/02/345922602.db2.gz XDFOVFVXUKUWBM-UHFFFAOYSA-N 1 2 237.328 2.464 20 0 BEADLO CC(C)C[C@@H](C(=O)NCC1(C)CC1)n1cc[nH+]c1 ZINC000635646261 345922938 /nfs/dbraw/zinc/92/29/38/345922938.db2.gz MLZTWNIQWCCVGO-LBPRGKRZSA-N 1 2 249.358 2.387 20 0 BEADLO CC[C@@H](C)CN(CC)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635647842 345924230 /nfs/dbraw/zinc/92/42/30/345924230.db2.gz KJWGGBFAUTVOTD-IJLUTSLNSA-N 1 2 249.358 2.408 20 0 BEADLO CC[C@@H](C)CN(CC)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635647842 345924234 /nfs/dbraw/zinc/92/42/34/345924234.db2.gz KJWGGBFAUTVOTD-IJLUTSLNSA-N 1 2 249.358 2.408 20 0 BEADLO Cc1ncc(C[NH2+][C@H](C)c2c(C)noc2C)o1 ZINC000628217603 345944269 /nfs/dbraw/zinc/94/42/69/345944269.db2.gz DCGPUSBHIDFWDX-SSDOTTSWSA-N 1 2 235.287 2.439 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@H]2CCC[C@H]2CC)[nH+]1 ZINC000635676942 345972674 /nfs/dbraw/zinc/97/26/74/345972674.db2.gz OQQZNZUUHZVPDD-PWSUYJOCSA-N 1 2 249.358 2.210 20 0 BEADLO Cc1cn2ccc(C(=O)NC3CC=CC3)cc2[nH+]1 ZINC000635683214 345976954 /nfs/dbraw/zinc/97/69/54/345976954.db2.gz RFWUANCYCLCBIZ-UHFFFAOYSA-N 1 2 241.294 2.091 20 0 BEADLO Cc1csc([C@@H](C)[NH2+]Cc2ccno2)n1 ZINC000380305367 345981152 /nfs/dbraw/zinc/98/11/52/345981152.db2.gz FLMVFYKJRHIDDQ-MRVPVSSYSA-N 1 2 223.301 2.290 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@@H]2CCC(C)(C)C2)[nH+]1 ZINC000635757534 346051693 /nfs/dbraw/zinc/05/16/93/346051693.db2.gz HKAVEWJTLRKGGH-LLVKDONJSA-N 1 2 249.358 2.210 20 0 BEADLO Cc1cn2ccc(C(=O)N3CC=CCC3)cc2[nH+]1 ZINC000635781040 346055719 /nfs/dbraw/zinc/05/57/19/346055719.db2.gz WBVNPZXMKNJAMW-UHFFFAOYSA-N 1 2 241.294 2.045 20 0 BEADLO CCCN(C)C(=O)Cc1cn2cccc(C)c2[nH+]1 ZINC000586756495 346056387 /nfs/dbraw/zinc/05/63/87/346056387.db2.gz HWLSZLKAZTVNQM-UHFFFAOYSA-N 1 2 245.326 2.054 20 0 BEADLO O=C(NCCC1=CCCC1)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635731043 346042924 /nfs/dbraw/zinc/04/29/24/346042924.db2.gz NTXJQOCPEZDYTD-VXGBXAGGSA-N 1 2 245.326 2.130 20 0 BEADLO O=C(NCCC1=CCCC1)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635731043 346042927 /nfs/dbraw/zinc/04/29/27/346042927.db2.gz NTXJQOCPEZDYTD-VXGBXAGGSA-N 1 2 245.326 2.130 20 0 BEADLO C[C@H]1CCCCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635813578 346075492 /nfs/dbraw/zinc/07/54/92/346075492.db2.gz DIODPXDPYIHDRP-QJPTWQEYSA-N 1 2 247.342 2.162 20 0 BEADLO C[C@H]1CCCCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635813578 346075494 /nfs/dbraw/zinc/07/54/94/346075494.db2.gz DIODPXDPYIHDRP-QJPTWQEYSA-N 1 2 247.342 2.162 20 0 BEADLO CCC(C)(C)CNC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635853742 346091246 /nfs/dbraw/zinc/09/12/46/346091246.db2.gz KPCJDDWIEMOWRQ-NXEZZACHSA-N 1 2 235.331 2.066 20 0 BEADLO CCC(C)(C)CNC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635853742 346091247 /nfs/dbraw/zinc/09/12/47/346091247.db2.gz KPCJDDWIEMOWRQ-NXEZZACHSA-N 1 2 235.331 2.066 20 0 BEADLO Cc1cn2ccc(C(=O)N3[C@H](C)C[C@H]3C)cc2[nH+]1 ZINC000635875806 346096088 /nfs/dbraw/zinc/09/60/88/346096088.db2.gz PURBCVMFDURGKT-GHMZBOCLSA-N 1 2 243.310 2.266 20 0 BEADLO C[C@H]1CC[C@H](CNC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635882263 346100883 /nfs/dbraw/zinc/10/08/83/346100883.db2.gz VRGSXBNRMUONFI-NNYUYHANSA-N 1 2 247.342 2.066 20 0 BEADLO C[C@H]1CC[C@H](CNC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635882263 346100887 /nfs/dbraw/zinc/10/08/87/346100887.db2.gz VRGSXBNRMUONFI-NNYUYHANSA-N 1 2 247.342 2.066 20 0 BEADLO C[C@@H]1CC[C@H](CNC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635882264 346101063 /nfs/dbraw/zinc/10/10/63/346101063.db2.gz VRGSXBNRMUONFI-WRWGMCAJSA-N 1 2 247.342 2.066 20 0 BEADLO C[C@@H]1CC[C@H](CNC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635882264 346101066 /nfs/dbraw/zinc/10/10/66/346101066.db2.gz VRGSXBNRMUONFI-WRWGMCAJSA-N 1 2 247.342 2.066 20 0 BEADLO COc1cc[nH+]cc1COc1c(C)c(C)nn1C ZINC000418998503 192096782 /nfs/dbraw/zinc/09/67/82/192096782.db2.gz PRJVIRUGBKHDBV-UHFFFAOYSA-N 1 2 247.298 2.020 20 0 BEADLO CO[C@@H](CNc1cc[nH+]c(C2CC2)n1)CC(C)C ZINC000419000815 192096955 /nfs/dbraw/zinc/09/69/55/192096955.db2.gz YLSAKEVQGDUKAT-GFCCVEGCSA-N 1 2 249.358 2.249 20 0 BEADLO CC(C)C[C@H](C(=O)N1C[C@H](C)[C@H]1C)n1cc[nH+]c1 ZINC000635966533 346125877 /nfs/dbraw/zinc/12/58/77/346125877.db2.gz QYPICUVDMXHHSS-YNEHKIRRSA-N 1 2 249.358 2.337 20 0 BEADLO CC[C@@H]1CCN1C(=O)c1ccn2cc(C)[nH+]c2c1 ZINC000635957053 346131629 /nfs/dbraw/zinc/13/16/29/346131629.db2.gz DFQPLSBIYCJHBC-GFCCVEGCSA-N 1 2 243.310 2.267 20 0 BEADLO CC/C=C/CNC(=O)c1ccn2cc(C)[nH+]c2c1 ZINC000635983400 346136917 /nfs/dbraw/zinc/13/69/17/346136917.db2.gz LJVXSTHGLCMUEE-SNAWJCMRSA-N 1 2 243.310 2.339 20 0 BEADLO CCc1c[nH]c(CC(=O)N2C[C@H](C)[C@@H](C)[C@H]2C)[nH+]1 ZINC000636033737 346169795 /nfs/dbraw/zinc/16/97/95/346169795.db2.gz DJSNFWCQGKBDNS-HBNTYKKESA-N 1 2 249.358 2.018 20 0 BEADLO CCc1c[nH]c(CC(=O)N2C[C@H](C)[C@@H](C)[C@@H]2C)[nH+]1 ZINC000636033733 346170035 /nfs/dbraw/zinc/17/00/35/346170035.db2.gz DJSNFWCQGKBDNS-AXFHLTTASA-N 1 2 249.358 2.018 20 0 BEADLO CCC1CN(C(=O)c2ccn3cc(C)[nH+]c3c2)C1 ZINC000636015755 346156727 /nfs/dbraw/zinc/15/67/27/346156727.db2.gz PDWKMBAUXJZLKH-UHFFFAOYSA-N 1 2 243.310 2.125 20 0 BEADLO CC[C@]1(C)COCCN1Cc1[nH]c(C)c(C)[nH+]1 ZINC000628240659 346203498 /nfs/dbraw/zinc/20/34/98/346203498.db2.gz NXZZMHPODOZMTH-CYBMUJFWSA-N 1 2 237.347 2.027 20 0 BEADLO c1nc(C2CC2)oc1C[N@@H+]1CCO[C@@H](C2CC2)C1 ZINC000628241181 346203774 /nfs/dbraw/zinc/20/37/74/346203774.db2.gz LNYRHTMXEXVOSL-CYBMUJFWSA-N 1 2 248.326 2.163 20 0 BEADLO c1nc(C2CC2)oc1C[N@H+]1CCO[C@@H](C2CC2)C1 ZINC000628241181 346203775 /nfs/dbraw/zinc/20/37/75/346203775.db2.gz LNYRHTMXEXVOSL-CYBMUJFWSA-N 1 2 248.326 2.163 20 0 BEADLO Cc1[nH]c(CN2C[C@H](C)O[C@@H](C)[C@H]2C)[nH+]c1C ZINC000628244679 346209420 /nfs/dbraw/zinc/20/94/20/346209420.db2.gz RSPLSDAMPUVPHY-AXTRIDKLSA-N 1 2 237.347 2.024 20 0 BEADLO CCCCc1cc(N[C@H](CO)C(C)C)nc[nH+]1 ZINC000631152748 346212005 /nfs/dbraw/zinc/21/20/05/346212005.db2.gz LEAUQHCIJZKJDM-GFCCVEGCSA-N 1 2 237.347 2.248 20 0 BEADLO Cc1c[nH]c(CN2CCc3cc(F)ccc3C2)[nH+]1 ZINC000628235621 346188918 /nfs/dbraw/zinc/18/89/18/346188918.db2.gz VKEFERPFRPKYSM-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1[nH]c(CN2CC(C(C)C)C2)[nH+]c1C ZINC000628254734 346237403 /nfs/dbraw/zinc/23/74/03/346237403.db2.gz NICFFNPDBFQLLM-UHFFFAOYSA-N 1 2 207.321 2.114 20 0 BEADLO CCCCc1cc(N[C@@H]2CO[C@@H](C)C2)nc[nH+]1 ZINC000631331513 346261082 /nfs/dbraw/zinc/26/10/82/346261082.db2.gz WFZQVAQKSBVCOP-JQWIXIFHSA-N 1 2 235.331 2.409 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1cccc(C)c1F ZINC000334839338 179019802 /nfs/dbraw/zinc/01/98/02/179019802.db2.gz KHEFIASXSCVCKN-UHFFFAOYSA-N 1 2 247.273 2.096 20 0 BEADLO Cc1ncc(C[NH2+]Cc2noc3c2CCCC3)o1 ZINC000628282423 346294402 /nfs/dbraw/zinc/29/44/02/346294402.db2.gz FAIFPFOLKUXATC-UHFFFAOYSA-N 1 2 247.298 2.140 20 0 BEADLO C[C@H](NC(=O)C1CCC=CCC1)c1[nH+]ccn1C ZINC000636211608 346355630 /nfs/dbraw/zinc/35/56/30/346355630.db2.gz LRVRBMRUOJLTFR-NSHDSACASA-N 1 2 247.342 2.344 20 0 BEADLO Cc1cccc(C[N@@H+](C)[C@H](C)c2nncn2C)c1 ZINC000286690060 179069075 /nfs/dbraw/zinc/06/90/75/179069075.db2.gz BNTSBQQRLCOIBJ-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cccc(C[N@H+](C)[C@H](C)c2nncn2C)c1 ZINC000286690060 179069076 /nfs/dbraw/zinc/06/90/76/179069076.db2.gz BNTSBQQRLCOIBJ-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@H](C)CC2CCC2)[nH+]1 ZINC000636330605 346399414 /nfs/dbraw/zinc/39/94/14/346399414.db2.gz QHICFGIXMJXNRG-SNVBAGLBSA-N 1 2 249.358 2.210 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2cncs2)n1 ZINC000353747900 179069337 /nfs/dbraw/zinc/06/93/37/179069337.db2.gz QQIPZTZWRCGDKZ-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2cncs2)n1 ZINC000353747900 179069341 /nfs/dbraw/zinc/06/93/41/179069341.db2.gz QQIPZTZWRCGDKZ-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2ncc[nH]2)c1 ZINC000264705838 179069659 /nfs/dbraw/zinc/06/96/59/179069659.db2.gz KWCOPVYQAJDUQO-UHFFFAOYSA-N 1 2 215.300 2.350 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2ncc[nH]2)c1 ZINC000264705838 179069661 /nfs/dbraw/zinc/06/96/61/179069661.db2.gz KWCOPVYQAJDUQO-UHFFFAOYSA-N 1 2 215.300 2.350 20 0 BEADLO Cc1c[nH]nc1C[N@@H+](C)Cc1cccc(C)n1 ZINC000356141356 179069717 /nfs/dbraw/zinc/06/97/17/179069717.db2.gz VOFQXDVPUPESHB-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1c[nH]nc1C[N@H+](C)Cc1cccc(C)n1 ZINC000356141356 179069720 /nfs/dbraw/zinc/06/97/20/179069720.db2.gz VOFQXDVPUPESHB-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO CCCC[C@H](C)C(=O)NCc1[nH]c[nH+]c1C ZINC000282492452 346406135 /nfs/dbraw/zinc/40/61/35/346406135.db2.gz NBHTYKQLVMGGKZ-VIFPVBQESA-N 1 2 223.320 2.161 20 0 BEADLO CCc1nc(C)c(C[NH2+]Cc2ccco2)o1 ZINC000291657685 346406452 /nfs/dbraw/zinc/40/64/52/346406452.db2.gz DPGRUEPRFFKBNW-UHFFFAOYSA-N 1 2 220.272 2.428 20 0 BEADLO Cc1cccc(C[N@H+]2CCN(C(C)C)C(=O)C2)c1 ZINC000356342458 179077041 /nfs/dbraw/zinc/07/70/41/179077041.db2.gz JJAGOJPQJLBOCI-UHFFFAOYSA-N 1 2 246.354 2.048 20 0 BEADLO Cc1cccc(C[N@@H+]2CCN(C(C)C)C(=O)C2)c1 ZINC000356342458 179077043 /nfs/dbraw/zinc/07/70/43/179077043.db2.gz JJAGOJPQJLBOCI-UHFFFAOYSA-N 1 2 246.354 2.048 20 0 BEADLO Cc1ncc([C@H](C)[NH2+][C@H](C)C(F)F)c(C)n1 ZINC000641792437 362727564 /nfs/dbraw/zinc/72/75/64/362727564.db2.gz VEQZAMMAIWIPNW-POYBYMJQSA-N 1 2 229.274 2.398 20 0 BEADLO Cc1ncc([C@H](C)[NH2+][C@@H](C)C(F)F)c(C)n1 ZINC000641792439 362727687 /nfs/dbraw/zinc/72/76/87/362727687.db2.gz VEQZAMMAIWIPNW-XPUUQOCRSA-N 1 2 229.274 2.398 20 0 BEADLO C[C@@H](NCc1c[nH+]c2ccccn12)C(F)F ZINC000641793014 362728900 /nfs/dbraw/zinc/72/89/00/362728900.db2.gz ALQFFUMDLYVFTG-MRVPVSSYSA-N 1 2 225.242 2.078 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CC[C@H]3CCC[C@H]3C2)c[nH+]1 ZINC000332747596 346429201 /nfs/dbraw/zinc/42/92/01/346429201.db2.gz OEBJCAHXFVNXJN-GRYCIOLGSA-N 1 2 247.342 2.417 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)N[C@H](C)C(F)F ZINC000641791633 362731435 /nfs/dbraw/zinc/73/14/35/362731435.db2.gz LKERPIWVMJURMS-HTQZYQBOSA-N 1 2 217.263 2.207 20 0 BEADLO CC[C@@H](CSC)N(C)c1cc(CO)cc[nH+]1 ZINC000167667715 346463743 /nfs/dbraw/zinc/46/37/43/346463743.db2.gz IXWNESGZEVRWKC-NSHDSACASA-N 1 2 240.372 2.152 20 0 BEADLO Cc1cccc(C[NH2+][C@@]2(C)CCOC2=O)c1C ZINC000289410942 179099196 /nfs/dbraw/zinc/09/91/96/179099196.db2.gz AFMXCOAHICJFOQ-AWEZNQCLSA-N 1 2 233.311 2.099 20 0 BEADLO Cc1cnccc1C[N@@H+]1[C@H](C)[C@H](C)CC[C@H]1C[NH3+] ZINC000641806382 362764736 /nfs/dbraw/zinc/76/47/36/362764736.db2.gz RIPAHFCEZSMLRI-KYOSRNDESA-N 1 2 247.386 2.338 20 0 BEADLO Cc1cnccc1C[N@H+]1[C@H](C)[C@H](C)CC[C@H]1C[NH3+] ZINC000641806382 362764741 /nfs/dbraw/zinc/76/47/41/362764741.db2.gz RIPAHFCEZSMLRI-KYOSRNDESA-N 1 2 247.386 2.338 20 0 BEADLO Cc1cccc(N(C)C(=O)CCn2cc[nH+]c2)c1 ZINC000263841968 179113181 /nfs/dbraw/zinc/11/31/81/179113181.db2.gz CYCBOIHYIRQWHP-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1cccc([N@H+](C)C[C@@H]2CCNC(=O)CC2)c1 ZINC000297133547 179115827 /nfs/dbraw/zinc/11/58/27/179115827.db2.gz NESCISLNXYITMY-ZDUSSCGKSA-N 1 2 246.354 2.348 20 0 BEADLO Cc1cccc([N@@H+](C)C[C@@H]2CCNC(=O)CC2)c1 ZINC000297133547 179115828 /nfs/dbraw/zinc/11/58/28/179115828.db2.gz NESCISLNXYITMY-ZDUSSCGKSA-N 1 2 246.354 2.348 20 0 BEADLO CCc1ccc(NC(=O)Cc2c[nH+]cn2C)cc1 ZINC000186777313 346536826 /nfs/dbraw/zinc/53/68/26/346536826.db2.gz VPZXHWSZKLCDEC-UHFFFAOYSA-N 1 2 243.310 2.164 20 0 BEADLO c1[nH]cc(NCC2=Cc3ccccc3OC2)[nH+]1 ZINC000577112059 365821366 /nfs/dbraw/zinc/82/13/66/365821366.db2.gz XEFYBTVAZJXHRM-UHFFFAOYSA-N 1 2 227.267 2.298 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C=Cc1ccccc1 ZINC000380195379 346571498 /nfs/dbraw/zinc/57/14/98/346571498.db2.gz YWOKLUJNSZCITC-FPLPWBNLSA-N 1 2 241.294 2.048 20 0 BEADLO CCc1nc(CNc2cc(C)[nH+]cn2)cs1 ZINC000301259851 346578500 /nfs/dbraw/zinc/57/85/00/346578500.db2.gz UUNYCLOPFMDOFA-UHFFFAOYSA-N 1 2 234.328 2.416 20 0 BEADLO Cc1cccc(NC(=O)NCc2[nH]cc[nH+]2)c1C ZINC000119119073 179134345 /nfs/dbraw/zinc/13/43/45/179134345.db2.gz JLAVXXDMHKZZNG-UHFFFAOYSA-N 1 2 244.298 2.348 20 0 BEADLO CC[N@H+](CC(=O)c1cccn1C)Cc1ccoc1 ZINC000588169296 346644894 /nfs/dbraw/zinc/64/48/94/346644894.db2.gz OFKLYEUFRVWPFL-UHFFFAOYSA-N 1 2 246.310 2.323 20 0 BEADLO CC[N@@H+](CC(=O)c1cccn1C)Cc1ccoc1 ZINC000588169296 346644895 /nfs/dbraw/zinc/64/48/95/346644895.db2.gz OFKLYEUFRVWPFL-UHFFFAOYSA-N 1 2 246.310 2.323 20 0 BEADLO CC[C@@H](C)[C@H]([NH2+]Cc1ccsc1)C(=O)OC ZINC000037102724 346675270 /nfs/dbraw/zinc/67/52/70/346675270.db2.gz ILVDZUSDPCWOLX-KOLCDFICSA-N 1 2 241.356 2.425 20 0 BEADLO Cc1ccnc([C@@H](C)[NH2+]Cc2ncccn2)c1 ZINC000580213615 346691457 /nfs/dbraw/zinc/69/14/57/346691457.db2.gz BPUVNJXKHUIYBI-LLVKDONJSA-N 1 2 228.299 2.031 20 0 BEADLO C[C@H]1CCC[C@H]1CNC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000621993638 370650395 /nfs/dbraw/zinc/65/03/95/370650395.db2.gz PGIWOFKTHSYZES-QWRGUYRKSA-N 1 2 249.358 2.240 20 0 BEADLO CC(C)C[C@@H]1CCCN(C(=O)Cn2cc[nH+]c2)C1 ZINC000580258443 346800094 /nfs/dbraw/zinc/80/00/94/346800094.db2.gz QOIFAPDMKSXXPS-ZDUSSCGKSA-N 1 2 249.358 2.168 20 0 BEADLO CCOC(=O)C1(C)CC([NH2+][C@@H](CC)C(F)F)C1 ZINC000601278998 347141920 /nfs/dbraw/zinc/14/19/20/347141920.db2.gz NJXMCGMTMPRBPR-XEVUQIKYSA-N 1 2 249.301 2.352 20 0 BEADLO CC(F)(F)C[NH2+]Cc1c[nH]nc1C(C)(C)C ZINC000382274327 347255013 /nfs/dbraw/zinc/25/50/13/347255013.db2.gz HTZHLKYIZPSXQV-UHFFFAOYSA-N 1 2 231.290 2.452 20 0 BEADLO CCC(F)(F)C[NH2+][C@@H]1CCCn2nccc21 ZINC000624148870 347280254 /nfs/dbraw/zinc/28/02/54/347280254.db2.gz PZYLOAKCANYPNA-SECBINFHSA-N 1 2 229.274 2.353 20 0 BEADLO CN(C[C@@H](O)C1CC1)c1[nH+]ccc2ccccc21 ZINC000624025057 347351140 /nfs/dbraw/zinc/35/11/40/347351140.db2.gz KNCNIQAQMXDPKY-CQSZACIVSA-N 1 2 242.322 2.442 20 0 BEADLO CCn1nccc1C[N@H+]1CC[C@H](C)[C@H](F)C1 ZINC000679359478 488344953 /nfs/dbraw/zinc/34/49/53/488344953.db2.gz QEWXFFPTRJWYIU-CMPLNLGQSA-N 1 2 225.311 2.083 20 0 BEADLO COc1ccncc1-c1c[nH+]ccc1OC ZINC000196311446 347408985 /nfs/dbraw/zinc/40/89/85/347408985.db2.gz LQJQXJUQWGWJOY-UHFFFAOYSA-N 1 2 216.240 2.161 20 0 BEADLO C[C@@H]1CCCC[C@H]1C[N@H+](CCO)CC(F)F ZINC000193024931 347388292 /nfs/dbraw/zinc/38/82/92/347388292.db2.gz FCFSPRBFKOCQDB-MNOVXSKESA-N 1 2 235.318 2.372 20 0 BEADLO C[C@@H]1CCCC[C@H]1C[N@@H+](CCO)CC(F)F ZINC000193024931 347388295 /nfs/dbraw/zinc/38/82/95/347388295.db2.gz FCFSPRBFKOCQDB-MNOVXSKESA-N 1 2 235.318 2.372 20 0 BEADLO Cc1cccc2nc(C[N@@H+]3CC[C@H](F)C3)cn21 ZINC000336259743 179230592 /nfs/dbraw/zinc/23/05/92/179230592.db2.gz RADWRBDGZCPRCA-NSHDSACASA-N 1 2 233.290 2.187 20 0 BEADLO Cc1cccc2nc(C[N@H+]3CC[C@H](F)C3)cn21 ZINC000336259743 179230594 /nfs/dbraw/zinc/23/05/94/179230594.db2.gz RADWRBDGZCPRCA-NSHDSACASA-N 1 2 233.290 2.187 20 0 BEADLO Cc1cccc2[nH+]c(CN3CC[C@H](F)C3)cn21 ZINC000336259743 179230596 /nfs/dbraw/zinc/23/05/96/179230596.db2.gz RADWRBDGZCPRCA-NSHDSACASA-N 1 2 233.290 2.187 20 0 BEADLO Cc1sccc1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616922286 347452722 /nfs/dbraw/zinc/45/27/22/347452722.db2.gz WSRKMUUPNXNLSD-UHFFFAOYSA-N 1 2 235.312 2.052 20 0 BEADLO Cc1sccc1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616922286 347452724 /nfs/dbraw/zinc/45/27/24/347452724.db2.gz WSRKMUUPNXNLSD-UHFFFAOYSA-N 1 2 235.312 2.052 20 0 BEADLO CC[C@H](CC(=O)N(C)Cc1c[nH+]c[nH]1)C(C)C ZINC000616924391 347455093 /nfs/dbraw/zinc/45/50/93/347455093.db2.gz HUOARYKORXSGPW-LLVKDONJSA-N 1 2 237.347 2.440 20 0 BEADLO CC[C@H](CC(=O)N(C)Cc1c[nH]c[nH+]1)C(C)C ZINC000616924391 347455094 /nfs/dbraw/zinc/45/50/94/347455094.db2.gz HUOARYKORXSGPW-LLVKDONJSA-N 1 2 237.347 2.440 20 0 BEADLO Cc1cccc2ncnc(-n3cc[nH+]c3)c12 ZINC000301493138 179232180 /nfs/dbraw/zinc/23/21/80/179232180.db2.gz QCQQFKLSBLYHJD-UHFFFAOYSA-N 1 2 210.240 2.124 20 0 BEADLO C[C@H](C(=O)N(C)Cc1c[nH+]c[nH]1)C1CCCC1 ZINC000616925703 347457013 /nfs/dbraw/zinc/45/70/13/347457013.db2.gz NOESUYUBKHDXIB-JTQLQIEISA-N 1 2 235.331 2.194 20 0 BEADLO C[C@H](C(=O)N(C)Cc1c[nH]c[nH+]1)C1CCCC1 ZINC000616925703 347457015 /nfs/dbraw/zinc/45/70/15/347457015.db2.gz NOESUYUBKHDXIB-JTQLQIEISA-N 1 2 235.331 2.194 20 0 BEADLO C[C@@H](C(=O)N(C)Cc1c[nH+]c[nH]1)C(C)(C)C ZINC000616925784 347457092 /nfs/dbraw/zinc/45/70/92/347457092.db2.gz QABSQYGNAWYDLV-VIFPVBQESA-N 1 2 223.320 2.050 20 0 BEADLO C[C@@H](C(=O)N(C)Cc1c[nH]c[nH+]1)C(C)(C)C ZINC000616925784 347457095 /nfs/dbraw/zinc/45/70/95/347457095.db2.gz QABSQYGNAWYDLV-VIFPVBQESA-N 1 2 223.320 2.050 20 0 BEADLO Cc1cccc2[nH+]c(CNC(=O)CC3CC3)cn21 ZINC000264541799 179229155 /nfs/dbraw/zinc/22/91/55/179229155.db2.gz NOJVUFNGTSCRNC-UHFFFAOYSA-N 1 2 243.310 2.059 20 0 BEADLO Cc1nc(N(C)[C@H](C)C2CCC2)cc[nH+]1 ZINC000356772452 187377067 /nfs/dbraw/zinc/37/70/67/187377067.db2.gz BBJDJKMBGHTBBG-SECBINFHSA-N 1 2 205.305 2.410 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)N(C)Cc2c[nH+]c[nH]2)C[C@@H]1C ZINC000616928729 347494949 /nfs/dbraw/zinc/49/49/49/347494949.db2.gz KCAPNHPHXPHOOH-GRYCIOLGSA-N 1 2 249.358 2.440 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)N(C)Cc2c[nH]c[nH+]2)C[C@@H]1C ZINC000616928729 347494951 /nfs/dbraw/zinc/49/49/51/347494951.db2.gz KCAPNHPHXPHOOH-GRYCIOLGSA-N 1 2 249.358 2.440 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)[C@H]1CC2CCC1CC2 ZINC000616929329 347497378 /nfs/dbraw/zinc/49/73/78/347497378.db2.gz YJJAOWUWTWDQHA-XIVSLSHWSA-N 1 2 247.342 2.194 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)[C@H]1CC2CCC1CC2 ZINC000616929329 347497379 /nfs/dbraw/zinc/49/73/79/347497379.db2.gz YJJAOWUWTWDQHA-XIVSLSHWSA-N 1 2 247.342 2.194 20 0 BEADLO CCC(CC)[C@H](C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616926948 347459453 /nfs/dbraw/zinc/45/94/53/347459453.db2.gz WGSSIXZXEIEKEQ-JTQLQIEISA-N 1 2 237.347 2.440 20 0 BEADLO CCC(CC)[C@H](C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616926948 347459455 /nfs/dbraw/zinc/45/94/55/347459455.db2.gz WGSSIXZXEIEKEQ-JTQLQIEISA-N 1 2 237.347 2.440 20 0 BEADLO CCc1nnc(C[N@@H+]2CC[C@@H](SC)C2)s1 ZINC000590749919 347503730 /nfs/dbraw/zinc/50/37/30/347503730.db2.gz DKFLAPWDCDGZHB-MRVPVSSYSA-N 1 2 243.401 2.038 20 0 BEADLO CCc1nnc(C[N@H+]2CC[C@@H](SC)C2)s1 ZINC000590749919 347503733 /nfs/dbraw/zinc/50/37/33/347503733.db2.gz DKFLAPWDCDGZHB-MRVPVSSYSA-N 1 2 243.401 2.038 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000616973862 347544923 /nfs/dbraw/zinc/54/49/23/347544923.db2.gz FCANZJBJJQZNSR-WDEREUQCSA-N 1 2 237.347 2.235 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000616973862 347544924 /nfs/dbraw/zinc/54/49/24/347544924.db2.gz FCANZJBJJQZNSR-WDEREUQCSA-N 1 2 237.347 2.235 20 0 BEADLO C[C@@H]1CCCC[C@H]1CC(=O)NCc1[nH+]ccn1C ZINC000590736970 347501725 /nfs/dbraw/zinc/50/17/25/347501725.db2.gz UJESCPBTZKSPBM-NEPJUHHUSA-N 1 2 249.358 2.253 20 0 BEADLO CC[C@H](C)N(CC)C(=O)CCCn1cc[nH+]c1 ZINC000616981303 347563265 /nfs/dbraw/zinc/56/32/65/347563265.db2.gz YYDGCWKNFPGSCY-LBPRGKRZSA-N 1 2 237.347 2.310 20 0 BEADLO CCCN(C(=O)CCCn1cc[nH+]c1)C1CC1 ZINC000590892766 347582430 /nfs/dbraw/zinc/58/24/30/347582430.db2.gz NROYKAMWWAJGOD-UHFFFAOYSA-N 1 2 235.331 2.064 20 0 BEADLO CC[C@H](C)N(CC)C(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000616975358 347546446 /nfs/dbraw/zinc/54/64/46/347546446.db2.gz BOCXQGUHVJGTDN-QWRGUYRKSA-N 1 2 249.358 2.162 20 0 BEADLO CC[C@H](C)N(CC)C(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000616975358 347546447 /nfs/dbraw/zinc/54/64/47/347546447.db2.gz BOCXQGUHVJGTDN-QWRGUYRKSA-N 1 2 249.358 2.162 20 0 BEADLO CC[C@H](C)N(CC)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000616975023 347546917 /nfs/dbraw/zinc/54/69/17/347546917.db2.gz XMRVGNNDECIUHB-RYUDHWBXSA-N 1 2 237.347 2.481 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000616975913 347548107 /nfs/dbraw/zinc/54/81/07/347548107.db2.gz JZXBICNDXTWSRQ-IJLUTSLNSA-N 1 2 249.358 2.171 20 0 BEADLO CC[N@H+](Cc1ncccc1Cl)[C@@H]1CCOC1 ZINC000528508396 323150826 /nfs/dbraw/zinc/15/08/26/323150826.db2.gz IAHBNJRPZUXVJJ-SNVBAGLBSA-N 1 2 240.734 2.346 20 0 BEADLO CC[N@@H+](Cc1ncccc1Cl)[C@@H]1CCOC1 ZINC000528508396 323150827 /nfs/dbraw/zinc/15/08/27/323150827.db2.gz IAHBNJRPZUXVJJ-SNVBAGLBSA-N 1 2 240.734 2.346 20 0 BEADLO Cc1ccccc1CNc1ccc(CO)c[nH+]1 ZINC000340562494 179285478 /nfs/dbraw/zinc/28/54/78/179285478.db2.gz QXXFWOORVPYDAB-UHFFFAOYSA-N 1 2 228.295 2.494 20 0 BEADLO CC[C@](C)([NH2+]CC1=CCCC1)C(=O)OC ZINC000592089182 347731253 /nfs/dbraw/zinc/73/12/53/347731253.db2.gz GDSPHOWOGYZYJA-LBPRGKRZSA-N 1 2 211.305 2.028 20 0 BEADLO Cc1ccccc1NC(=O)COc1cc[nH+]cc1 ZINC000356104029 179298315 /nfs/dbraw/zinc/29/83/15/179298315.db2.gz ZTUALFFVYCFPQW-UHFFFAOYSA-N 1 2 242.278 2.408 20 0 BEADLO C[C@@H]1CC(C)(C)CN1c1nc[nH+]c(N)c1Cl ZINC000577350723 365931102 /nfs/dbraw/zinc/93/11/02/365931102.db2.gz GPKSQNLQXKIMCB-SSDOTTSWSA-N 1 2 240.738 2.337 20 0 BEADLO C[C@@H]1CC(C)(C)CN1c1[nH+]cnc(N)c1Cl ZINC000577350723 365931109 /nfs/dbraw/zinc/93/11/09/365931109.db2.gz GPKSQNLQXKIMCB-SSDOTTSWSA-N 1 2 240.738 2.337 20 0 BEADLO CCN(C)c1ccc(CNc2cnoc2C)c[nH+]1 ZINC000361590191 187381949 /nfs/dbraw/zinc/38/19/49/187381949.db2.gz YBEFDUWSHFRLPH-UHFFFAOYSA-N 1 2 246.314 2.446 20 0 BEADLO Cc1ccccc1OCC[N@@H+](C)Cc1cocn1 ZINC000191923458 179311648 /nfs/dbraw/zinc/31/16/48/179311648.db2.gz WAXKXYQGQOBFTR-UHFFFAOYSA-N 1 2 246.310 2.494 20 0 BEADLO Cc1ccccc1OCC[N@H+](C)Cc1cocn1 ZINC000191923458 179311651 /nfs/dbraw/zinc/31/16/51/179311651.db2.gz WAXKXYQGQOBFTR-UHFFFAOYSA-N 1 2 246.310 2.494 20 0 BEADLO C[C@H]1CC[C@H](C)N1C(=O)c1ccc2[nH+]ccn2c1 ZINC000176934835 365932111 /nfs/dbraw/zinc/93/21/11/365932111.db2.gz VFANWZDKBPUERB-QWRGUYRKSA-N 1 2 243.310 2.347 20 0 BEADLO Cc1ccccc1[C@@H](C)[N@H+](C)Cc1nncn1C ZINC000340680490 179317635 /nfs/dbraw/zinc/31/76/35/179317635.db2.gz XVXRDSQVMGYOPY-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1ccccc1[C@@H](C)[N@@H+](C)Cc1nncn1C ZINC000340680490 179317637 /nfs/dbraw/zinc/31/76/37/179317637.db2.gz XVXRDSQVMGYOPY-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1ccccc1[C@@H](C)[NH2+]CC(F)(F)CO ZINC000184688847 179319199 /nfs/dbraw/zinc/31/91/99/179319199.db2.gz YFAPTVDJKNBNCV-SNVBAGLBSA-N 1 2 229.270 2.273 20 0 BEADLO C1=C[C@H]2CC[C@@H](C1)[N@H+]2Cc1nc(C2CC2)no1 ZINC000372730094 187386289 /nfs/dbraw/zinc/38/62/89/187386289.db2.gz OAYCIYXJSCGTBV-WDEREUQCSA-N 1 2 231.299 2.240 20 0 BEADLO C1=C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1nc(C2CC2)no1 ZINC000372730094 187386290 /nfs/dbraw/zinc/38/62/90/187386290.db2.gz OAYCIYXJSCGTBV-WDEREUQCSA-N 1 2 231.299 2.240 20 0 BEADLO CCCC[C@H]([NH2+]CCc1ccoc1)C(=O)OC ZINC000594726568 348112825 /nfs/dbraw/zinc/11/28/25/348112825.db2.gz MPPCTEIUMBLYQI-LBPRGKRZSA-N 1 2 239.315 2.144 20 0 BEADLO Cc1ccccc1[S@](=O)Cc1c[nH+]cn1C ZINC000268213686 179352985 /nfs/dbraw/zinc/35/29/85/179352985.db2.gz QZNBMRBJWWVTRF-MRXNPFEDSA-N 1 2 234.324 2.036 20 0 BEADLO C[C@H](CSCCF)[NH2+]C1(C(F)F)CC1 ZINC000595037569 348176381 /nfs/dbraw/zinc/17/63/81/348176381.db2.gz BOSSQEWENPARNG-SSDOTTSWSA-N 1 2 227.295 2.465 20 0 BEADLO CCN1CC[N@H+](Cc2ccoc2C)C[C@H]1C ZINC000666308247 490137030 /nfs/dbraw/zinc/13/70/30/490137030.db2.gz TVYUTEOAQCUWLG-LLVKDONJSA-N 1 2 222.332 2.114 20 0 BEADLO CCN1CC[N@@H+](Cc2ccoc2C)C[C@H]1C ZINC000666308247 490137034 /nfs/dbraw/zinc/13/70/34/490137034.db2.gz TVYUTEOAQCUWLG-LLVKDONJSA-N 1 2 222.332 2.114 20 0 BEADLO CC[N@H+](CCOC)Cc1noc2c1CCCC2 ZINC000595564155 348282345 /nfs/dbraw/zinc/28/23/45/348282345.db2.gz IYTUCWWRRXXHPK-UHFFFAOYSA-N 1 2 238.331 2.022 20 0 BEADLO CC[N@@H+](CCOC)Cc1noc2c1CCCC2 ZINC000595564155 348282348 /nfs/dbraw/zinc/28/23/48/348282348.db2.gz IYTUCWWRRXXHPK-UHFFFAOYSA-N 1 2 238.331 2.022 20 0 BEADLO COC(=O)[C@H]([NH2+]C[C@@H]1CC12CC2)c1ccccc1 ZINC000419333216 192124808 /nfs/dbraw/zinc/12/48/08/192124808.db2.gz FEEFRUUPIXMAGV-QWHCGFSZSA-N 1 2 245.322 2.290 20 0 BEADLO CCC[C@@H]([NH2+][C@@H]1C[C@H]1C(C)C)C(=O)OCC ZINC000419329159 192128879 /nfs/dbraw/zinc/12/88/79/192128879.db2.gz OPUSIMSGSXGZPS-QJPTWQEYSA-N 1 2 227.348 2.352 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@@H]2CCC[C@@H]2C)c1 ZINC000596115283 348442264 /nfs/dbraw/zinc/44/22/64/348442264.db2.gz UDPVGJWTZARHIS-CMPLNLGQSA-N 1 2 248.326 2.398 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N2CCC(C)(C)C2)c1 ZINC000596143504 348450087 /nfs/dbraw/zinc/45/00/87/348450087.db2.gz UAGFZRCFFDAZKD-UHFFFAOYSA-N 1 2 248.326 2.033 20 0 BEADLO c1cn(CCSCC[C@H]2CCOC2)c[nH+]1 ZINC000419543112 192141485 /nfs/dbraw/zinc/14/14/85/192141485.db2.gz TXUNNIVKPBMCPY-LLVKDONJSA-N 1 2 226.345 2.043 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@@H]2CC[C@@H]2C)c1 ZINC000596231399 348463101 /nfs/dbraw/zinc/46/31/01/348463101.db2.gz LPTBRZJNFNZPLS-GXSJLCMTSA-N 1 2 234.299 2.008 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@H]2CC[C@@H]2C)c1 ZINC000596231402 348463196 /nfs/dbraw/zinc/46/31/96/348463196.db2.gz LPTBRZJNFNZPLS-ONGXEEELSA-N 1 2 234.299 2.008 20 0 BEADLO CSCC1(CCNc2cc(C)[nH+]cn2)CC1 ZINC000596419665 348541786 /nfs/dbraw/zinc/54/17/86/348541786.db2.gz PJWYAMFWMKJBBX-UHFFFAOYSA-N 1 2 237.372 2.152 20 0 BEADLO CCC(C)(C)C(=O)Nc1cc(C)[nH+]cc1C ZINC000536575436 323198109 /nfs/dbraw/zinc/19/81/09/323198109.db2.gz SVNNBXZYTLTXDJ-UHFFFAOYSA-N 1 2 220.316 2.495 20 0 BEADLO Cc1c[nH+]ccc1CCNc1cncc(Cl)n1 ZINC000269944085 179696781 /nfs/dbraw/zinc/69/67/81/179696781.db2.gz GDPVRGYKZVWNPR-UHFFFAOYSA-N 1 2 248.717 2.488 20 0 BEADLO Fc1ccc(CNc2c[nH]c[nH+]2)cc1F ZINC000308853269 348908386 /nfs/dbraw/zinc/90/83/86/348908386.db2.gz HTQUXBACYPDUCW-UHFFFAOYSA-N 1 2 209.199 2.300 20 0 BEADLO Fc1cc(F)cc(CNc2c[nH]c[nH+]2)c1 ZINC000308878265 349016494 /nfs/dbraw/zinc/01/64/94/349016494.db2.gz OMUFRUCEFAEATP-UHFFFAOYSA-N 1 2 209.199 2.300 20 0 BEADLO CC(C)(C)[C@H]1CCCC[C@@H]1[NH2+]Cc1ncn[nH]1 ZINC000037919137 187425436 /nfs/dbraw/zinc/42/54/36/187425436.db2.gz XWMIEKQERYGZCO-QWRGUYRKSA-N 1 2 236.363 2.499 20 0 BEADLO CC(C)[C@H]1C[C@@H](Nc2c[nH]c[nH+]2)CCO1 ZINC000308886362 349024473 /nfs/dbraw/zinc/02/44/73/349024473.db2.gz VXXHGOWDGZKVHR-VHSXEESVSA-N 1 2 209.293 2.025 20 0 BEADLO CCN(CCSC)c1[nH+]cccc1OC ZINC000599091543 349091188 /nfs/dbraw/zinc/09/11/88/349091188.db2.gz CCISMOVOZUBVFN-UHFFFAOYSA-N 1 2 226.345 2.280 20 0 BEADLO COC(=O)CCCC[N@H+](CC(F)F)C1CC1 ZINC000599295331 349149894 /nfs/dbraw/zinc/14/98/94/349149894.db2.gz KKNHYZYZZXZYIR-UHFFFAOYSA-N 1 2 235.274 2.059 20 0 BEADLO COC(=O)CCCC[N@@H+](CC(F)F)C1CC1 ZINC000599295331 349149897 /nfs/dbraw/zinc/14/98/97/349149897.db2.gz KKNHYZYZZXZYIR-UHFFFAOYSA-N 1 2 235.274 2.059 20 0 BEADLO Cc1cc(N2CCOc3ccccc3C2)nc[nH+]1 ZINC000599534947 349212075 /nfs/dbraw/zinc/21/20/75/349212075.db2.gz SJFIXLZJBLQANJ-UHFFFAOYSA-N 1 2 241.294 2.184 20 0 BEADLO c1cc(N2C3CCC2CC3)nc(C2CC2)[nH+]1 ZINC000599453415 349198894 /nfs/dbraw/zinc/19/88/94/349198894.db2.gz KQAACOWATGGUAA-UHFFFAOYSA-N 1 2 215.300 2.485 20 0 BEADLO CC[C@@H]1C[C@@H](CNc2c[nH]c[nH+]2)CCO1 ZINC000308960383 349202744 /nfs/dbraw/zinc/20/27/44/349202744.db2.gz RTVIYUMQJHGQPJ-VHSXEESVSA-N 1 2 209.293 2.027 20 0 BEADLO c1ccc2cc(N3CCO[C@@H]4C[C@@H]43)[nH+]cc2c1 ZINC000631280822 349337105 /nfs/dbraw/zinc/33/71/05/349337105.db2.gz XFAQJXTWYKYNJE-QWHCGFSZSA-N 1 2 226.279 2.212 20 0 BEADLO CCOCCCC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000603785511 350032760 /nfs/dbraw/zinc/03/27/60/350032760.db2.gz SDNXBSBHZVZGFP-UHFFFAOYSA-N 1 2 247.298 2.090 20 0 BEADLO CCC[C@H]([NH2+][C@H]1CCS[C@@H]1C)C(=O)OCC ZINC000390748163 362948363 /nfs/dbraw/zinc/94/83/63/362948363.db2.gz BHAZSWAWRMCPGH-VWYCJHECSA-N 1 2 245.388 2.202 20 0 BEADLO COC1C[NH+](Cc2cc(C)sc2C)C1 ZINC000603935079 350059671 /nfs/dbraw/zinc/05/96/71/350059671.db2.gz XYWDWKKDUCRPNL-UHFFFAOYSA-N 1 2 211.330 2.196 20 0 BEADLO Cc1nc2[nH]ccc2c(N2C[C@H](C)[C@H](C)C2)[nH+]1 ZINC000336541631 180003457 /nfs/dbraw/zinc/00/34/57/180003457.db2.gz DXZIGQQPPUWQCP-DTORHVGOSA-N 1 2 230.315 2.359 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CC[C@](C)(F)C2)[nH+]1 ZINC000336326294 180004053 /nfs/dbraw/zinc/00/40/53/180004053.db2.gz CAGDPFFIAJBQKB-LBPRGKRZSA-N 1 2 234.278 2.205 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2C[C@H]3CCCC[C@H]32)no1 ZINC000368099057 180046778 /nfs/dbraw/zinc/04/67/78/180046778.db2.gz LTOJSSUZWFDOEO-JMJZKYOTSA-N 1 2 221.304 2.313 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2C[C@H]3CCCC[C@H]32)no1 ZINC000368099057 180046780 /nfs/dbraw/zinc/04/67/80/180046780.db2.gz LTOJSSUZWFDOEO-JMJZKYOTSA-N 1 2 221.304 2.313 20 0 BEADLO Cc1nc([C@H](C)[N@H+](C)CCc2ccncc2)no1 ZINC000278625627 180046965 /nfs/dbraw/zinc/04/69/65/180046965.db2.gz NQTZSNZDLOAZHB-JTQLQIEISA-N 1 2 246.314 2.009 20 0 BEADLO Cc1nc([C@H](C)[N@@H+](C)CCc2ccncc2)no1 ZINC000278625627 180046967 /nfs/dbraw/zinc/04/69/67/180046967.db2.gz NQTZSNZDLOAZHB-JTQLQIEISA-N 1 2 246.314 2.009 20 0 BEADLO Cc1[nH+]c2ccc(C(=O)NC(C)C)cc2n1C ZINC000336451566 180089288 /nfs/dbraw/zinc/08/92/88/180089288.db2.gz PALZLEQPUSQYDW-UHFFFAOYSA-N 1 2 231.299 2.020 20 0 BEADLO Cc1nc(N(C)C2CC2)c2c([nH+]1)CCCC2 ZINC000180427251 180068921 /nfs/dbraw/zinc/06/89/21/180068921.db2.gz CMVBBXMNHDKRKA-UHFFFAOYSA-N 1 2 217.316 2.262 20 0 BEADLO Cc1nc(NC[C@@H](C)CCO)c2c([nH+]1)CCCC2 ZINC000302115952 180069825 /nfs/dbraw/zinc/06/98/25/180069825.db2.gz WCFVBEPBRYAAHK-JTQLQIEISA-N 1 2 249.358 2.094 20 0 BEADLO Cc1nc2n(n1)CC[N@@H+]([C@H]1/C=C/CCCCC1)C2 ZINC000336368871 180112186 /nfs/dbraw/zinc/11/21/86/180112186.db2.gz PGTJJFACTHFTMU-IYNGYCSASA-N 1 2 246.358 2.291 20 0 BEADLO Cc1nc2n(n1)CC[N@H+]([C@H]1/C=C/CCCCC1)C2 ZINC000336368871 180112187 /nfs/dbraw/zinc/11/21/87/180112187.db2.gz PGTJJFACTHFTMU-IYNGYCSASA-N 1 2 246.358 2.291 20 0 BEADLO Cc1nc2n(n1)CC[N@@H+]([C@@H]1C=CCCCCC1)C2 ZINC000292837379 180113041 /nfs/dbraw/zinc/11/30/41/180113041.db2.gz PGTJJFACTHFTMU-CYBMUJFWSA-N 1 2 246.358 2.291 20 0 BEADLO Cc1nc2n(n1)CC[N@H+]([C@@H]1C=CCCCCC1)C2 ZINC000292837379 180113042 /nfs/dbraw/zinc/11/30/42/180113042.db2.gz PGTJJFACTHFTMU-CYBMUJFWSA-N 1 2 246.358 2.291 20 0 BEADLO C[C@H]([NH2+][C@@H]1COc2ccc(F)cc21)c1ncc[nH]1 ZINC000334358117 538066769 /nfs/dbraw/zinc/06/67/69/538066769.db2.gz RVRSPDJAPWSDGR-GZMMTYOYSA-N 1 2 247.273 2.333 20 0 BEADLO Cc1[nH]c(C(=O)NCC=Cc2ccccc2)c[nH+]1 ZINC000339237421 180129038 /nfs/dbraw/zinc/12/90/38/180129038.db2.gz XFHUWTPHXUDPMD-YVMONPNESA-N 1 2 241.294 2.161 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)C[C@H]1C=CCCC1 ZINC000427011321 191050046 /nfs/dbraw/zinc/05/00/46/191050046.db2.gz FAONAUHLDCIYCZ-NSHDSACASA-N 1 2 233.315 2.115 20 0 BEADLO CCCC(C)(C)CC(=O)Nc1cc[nH+]cc1O ZINC000426964307 191050200 /nfs/dbraw/zinc/05/02/00/191050200.db2.gz LCUBJPCGWMLMIX-UHFFFAOYSA-N 1 2 236.315 2.364 20 0 BEADLO Cc1[nH]c(C(=O)NCC2CCC(C)CC2)c[nH+]1 ZINC000339232555 180130637 /nfs/dbraw/zinc/13/06/37/180130637.db2.gz UAJWHWIQXAHFKY-UHFFFAOYSA-N 1 2 235.331 2.274 20 0 BEADLO C[C@H](N[C@@H]1COc2ccc(F)cc21)c1[nH]cc[nH+]1 ZINC000334358117 538066773 /nfs/dbraw/zinc/06/67/73/538066773.db2.gz RVRSPDJAPWSDGR-GZMMTYOYSA-N 1 2 247.273 2.333 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H](C)C(C)(C)C ZINC000331113244 180118648 /nfs/dbraw/zinc/11/86/48/180118648.db2.gz ULKKUSSCDMSNRV-MRVPVSSYSA-N 1 2 223.320 2.017 20 0 BEADLO Cc1ncc(CNc2cccc[nH+]2)s1 ZINC000040444148 180160002 /nfs/dbraw/zinc/16/00/02/180160002.db2.gz HQHHSTSTECVQFC-UHFFFAOYSA-N 1 2 205.286 2.459 20 0 BEADLO Cc1ncc(C[N@H+]2C[C@H](C)OC[C@@H]2C)s1 ZINC000098132586 180144951 /nfs/dbraw/zinc/14/49/51/180144951.db2.gz SVBKLHFXSGFWPN-IUCAKERBSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ncc(C[N@@H+]2C[C@H](C)OC[C@@H]2C)s1 ZINC000098132586 180144953 /nfs/dbraw/zinc/14/49/53/180144953.db2.gz SVBKLHFXSGFWPN-IUCAKERBSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1cc(NCCOC(C)(C)C)nc(C2CC2)[nH+]1 ZINC000604756837 350187363 /nfs/dbraw/zinc/18/73/63/350187363.db2.gz IUMVCHRRHUDJEY-UHFFFAOYSA-N 1 2 249.358 2.311 20 0 BEADLO Cc1nc(N2CC[C@H](C3CCOCC3)C2)cc[nH+]1 ZINC000371370700 180195066 /nfs/dbraw/zinc/19/50/66/180195066.db2.gz OVARUMSWJMDYOT-ZDUSSCGKSA-N 1 2 247.342 2.038 20 0 BEADLO Cc1nc(N2CCSCC[C@H]2C)cc[nH+]1 ZINC000189752698 180195113 /nfs/dbraw/zinc/19/51/13/180195113.db2.gz PYNCPIMCFHSKCT-SECBINFHSA-N 1 2 223.345 2.117 20 0 BEADLO Cc1nc(NCC[C@@H]2CCCCO2)cc[nH+]1 ZINC000227315783 180197525 /nfs/dbraw/zinc/19/75/25/180197525.db2.gz GEBIBLOBAHZZTF-NSHDSACASA-N 1 2 221.304 2.156 20 0 BEADLO Cc1nc(NCCOCCC(C)C)cc[nH+]1 ZINC000054936408 180197761 /nfs/dbraw/zinc/19/77/61/180197761.db2.gz VXNQRNPAXSFKJK-UHFFFAOYSA-N 1 2 223.320 2.260 20 0 BEADLO Cc1nc(NCCCCOC(C)C)cc[nH+]1 ZINC000228562430 180198666 /nfs/dbraw/zinc/19/86/66/180198666.db2.gz AFBZXKWIIRAKNM-UHFFFAOYSA-N 1 2 223.320 2.402 20 0 BEADLO Cc1nccc(NCCCNc2cccc[nH+]2)n1 ZINC000266455135 180199156 /nfs/dbraw/zinc/19/91/56/180199156.db2.gz XXITWJPCKYHPQB-UHFFFAOYSA-N 1 2 243.314 2.094 20 0 BEADLO Cc1nc(NC[C@H]2CCCSC2)cc[nH+]1 ZINC000288534990 180200243 /nfs/dbraw/zinc/20/02/43/180200243.db2.gz OMNZSQZCNGGUDL-SNVBAGLBSA-N 1 2 223.345 2.340 20 0 BEADLO Cc1nc(NC[C@]2(C)CCCC[C@H]2O)cc[nH+]1 ZINC000175060155 180200887 /nfs/dbraw/zinc/20/08/87/180200887.db2.gz ZUZAMDRLRRTMGK-YPMHNXCESA-N 1 2 235.331 2.138 20 0 BEADLO Cc1nc(N[C@@H](CCO)c2ccccc2)cc[nH+]1 ZINC000361056464 180202271 /nfs/dbraw/zinc/20/22/71/180202271.db2.gz YZFJRBPINMBDTE-ZDUSSCGKSA-N 1 2 243.310 2.321 20 0 BEADLO Cc1nc(N[C@@H](C)C2CCOCC2)cc[nH+]1 ZINC000131884847 180203137 /nfs/dbraw/zinc/20/31/37/180203137.db2.gz WBFQULQGYWGDGA-VIFPVBQESA-N 1 2 221.304 2.012 20 0 BEADLO Cc1nc(N[C@@H]2CCO[C@H](C3CC3)C2)cc[nH+]1 ZINC000185425471 180203629 /nfs/dbraw/zinc/20/36/29/180203629.db2.gz GCWXBCKMRLYABA-NEPJUHHUSA-N 1 2 233.315 2.155 20 0 BEADLO Cc1nc(N[C@@H](C)COCC(F)(F)F)cc[nH+]1 ZINC000266357302 180203654 /nfs/dbraw/zinc/20/36/54/180203654.db2.gz KFNRMWWVBSUZHY-ZETCQYMHSA-N 1 2 249.236 2.164 20 0 BEADLO Cc1nc(N[C@H](C)[C@@H](O)c2ccccc2)cc[nH+]1 ZINC000288183465 180205258 /nfs/dbraw/zinc/20/52/58/180205258.db2.gz JGLINDJHXXDOOF-QMTHXVAHSA-N 1 2 243.310 2.319 20 0 BEADLO Cc1nc(N[C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)cc[nH+]1 ZINC000361118370 180206467 /nfs/dbraw/zinc/20/64/67/180206467.db2.gz UWPITSMUEXIING-CYZMBNFOSA-N 1 2 247.342 2.401 20 0 BEADLO Cc1nc(N[C@H]2CCO[C@@H](C3CC3)C2)cc[nH+]1 ZINC000185425523 180207619 /nfs/dbraw/zinc/20/76/19/180207619.db2.gz GCWXBCKMRLYABA-NWDGAFQWSA-N 1 2 233.315 2.155 20 0 BEADLO Cc1ncc2n1CC[N@@H+](Cc1ccccc1)C2 ZINC000089195611 180178563 /nfs/dbraw/zinc/17/85/63/180178563.db2.gz MLOVBCJPCWOBRJ-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO Cc1ncc2n1CC[N@H+](Cc1ccccc1)C2 ZINC000089195611 180178564 /nfs/dbraw/zinc/17/85/64/180178564.db2.gz MLOVBCJPCWOBRJ-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO Cc1nc(NC[C@@H]2CCCC2(C)C)cc[nH+]1 ZINC000338812328 180181761 /nfs/dbraw/zinc/18/17/61/180181761.db2.gz QDFILUAIANNLCO-NSHDSACASA-N 1 2 219.332 2.445 20 0 BEADLO Cc1nccc(C[N@@H+]2CCO[C@H](C(C)(C)C)C2)n1 ZINC000353251257 180183984 /nfs/dbraw/zinc/18/39/84/180183984.db2.gz FNHWYHJAQOZFBP-ZDUSSCGKSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1nccc(C[N@H+]2CCO[C@H](C(C)(C)C)C2)n1 ZINC000353251257 180183985 /nfs/dbraw/zinc/18/39/85/180183985.db2.gz FNHWYHJAQOZFBP-ZDUSSCGKSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1ncccc1C[NH2+][C@H](C)c1ccon1 ZINC000309814609 180222210 /nfs/dbraw/zinc/22/22/10/180222210.db2.gz VAPJECUICJXLAM-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO Cc1ncccc1C[NH2+][C@@H](C)c1ccon1 ZINC000309814607 180223439 /nfs/dbraw/zinc/22/34/39/180223439.db2.gz VAPJECUICJXLAM-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO Cc1[nH+]cccc1NCc1ncc(Cl)n1C ZINC000281608128 180226367 /nfs/dbraw/zinc/22/63/67/180226367.db2.gz GJOQUULHKCUGNS-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@H](C)c2cccnc2)ncn1 ZINC000428311304 191082418 /nfs/dbraw/zinc/08/24/18/191082418.db2.gz QLCVGUKOYLNYLM-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cc(C[N@H+](C)[C@H](C)c2cccnc2)ncn1 ZINC000428311304 191082421 /nfs/dbraw/zinc/08/24/21/191082421.db2.gz QLCVGUKOYLNYLM-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1C[C@H](C)O[C@H]1C ZINC000637243782 350342042 /nfs/dbraw/zinc/34/20/42/350342042.db2.gz WYWUFQKXORRAKR-ZMLRMANQSA-N 1 2 248.326 2.450 20 0 BEADLO C[C@@H]1C[C@H]1CNC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606581125 350374467 /nfs/dbraw/zinc/37/44/67/350374467.db2.gz RCLJKWHTEDMKEO-ZJUUUORDSA-N 1 2 244.298 2.112 20 0 BEADLO Cc1ncsc1C[N@@H+](C)[C@H](C)c1cnccn1 ZINC000184541647 180317079 /nfs/dbraw/zinc/31/70/79/180317079.db2.gz IJILGAMOENNVKD-SNVBAGLBSA-N 1 2 248.355 2.435 20 0 BEADLO Cc1ncsc1C[N@H+](C)[C@H](C)c1cnccn1 ZINC000184541647 180317080 /nfs/dbraw/zinc/31/70/80/180317080.db2.gz IJILGAMOENNVKD-SNVBAGLBSA-N 1 2 248.355 2.435 20 0 BEADLO CCc1cc(NCc2ccccn2)nc[nH+]1 ZINC000040765058 350394599 /nfs/dbraw/zinc/39/45/99/350394599.db2.gz HYIUNZKFSLXHRY-UHFFFAOYSA-N 1 2 214.272 2.046 20 0 BEADLO Cc1ncsc1C[NH2+][C@@H](C)c1ncc[nH]1 ZINC000124703480 180321541 /nfs/dbraw/zinc/32/15/41/180321541.db2.gz SBVCSRTXYOFKQU-QMMMGPOBSA-N 1 2 222.317 2.025 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@@H](C)c2cnc(C)cn2)C[C@@H](C)O1 ZINC000428218435 191101600 /nfs/dbraw/zinc/10/16/00/191101600.db2.gz BMMVDYGKOGQTBJ-FRRDWIJNSA-N 1 2 249.358 2.345 20 0 BEADLO CC[C@@H]1C[N@H+]([C@@H](C)c2cnc(C)cn2)C[C@@H](C)O1 ZINC000428218435 191101603 /nfs/dbraw/zinc/10/16/03/191101603.db2.gz BMMVDYGKOGQTBJ-FRRDWIJNSA-N 1 2 249.358 2.345 20 0 BEADLO CCOCC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000162700127 350416802 /nfs/dbraw/zinc/41/68/02/350416802.db2.gz QJRGWKLDHXKFHG-UHFFFAOYSA-N 1 2 245.282 2.052 20 0 BEADLO Cc1c[nH]c(CN2CC(CC(F)(F)F)C2)[nH+]1 ZINC000628307031 350442598 /nfs/dbraw/zinc/44/25/98/350442598.db2.gz JSHMKSHRVKYRGZ-UHFFFAOYSA-N 1 2 233.237 2.102 20 0 BEADLO CC[N@H+](Cc1cc(C)n(C)n1)Cc1ccccn1 ZINC000336722671 350483140 /nfs/dbraw/zinc/48/31/40/350483140.db2.gz YPXOKUGEFWUEBJ-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CC[N@@H+](Cc1cc(C)n(C)n1)Cc1ccccn1 ZINC000336722671 350483143 /nfs/dbraw/zinc/48/31/43/350483143.db2.gz YPXOKUGEFWUEBJ-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CCC[C@H](C)CC(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000564006734 323348023 /nfs/dbraw/zinc/34/80/23/323348023.db2.gz QYKVRFZOAHGWNW-VHSXEESVSA-N 1 2 223.320 2.413 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+](C)Cc1sccc1C ZINC000065208862 350577146 /nfs/dbraw/zinc/57/71/46/350577146.db2.gz GJDPHAYVRPUDBL-SNVBAGLBSA-N 1 2 241.356 2.440 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+](C)Cc1sccc1C ZINC000065208862 350577149 /nfs/dbraw/zinc/57/71/49/350577149.db2.gz GJDPHAYVRPUDBL-SNVBAGLBSA-N 1 2 241.356 2.440 20 0 BEADLO FC(F)(F)[C@@H]1C[N@@H+]([C@@H]2C=CCCC2)CCO1 ZINC000606902074 350627342 /nfs/dbraw/zinc/62/73/42/350627342.db2.gz WKMSUSGGXOTWGI-ZJUUUORDSA-N 1 2 235.249 2.358 20 0 BEADLO FC(F)(F)[C@@H]1C[N@H+]([C@@H]2C=CCCC2)CCO1 ZINC000606902074 350627345 /nfs/dbraw/zinc/62/73/45/350627345.db2.gz WKMSUSGGXOTWGI-ZJUUUORDSA-N 1 2 235.249 2.358 20 0 BEADLO CCc1cnc(C[NH2+]Cc2cncs2)s1 ZINC000124339711 350689870 /nfs/dbraw/zinc/68/98/70/350689870.db2.gz RIHZYHZQRUQRJI-UHFFFAOYSA-N 1 2 239.369 2.452 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@@H](F)C2)s1 ZINC000563273212 350749032 /nfs/dbraw/zinc/74/90/32/350749032.db2.gz MCWVMRDKOQYREF-SECBINFHSA-N 1 2 214.309 2.385 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@@H](F)C2)s1 ZINC000563273212 350749035 /nfs/dbraw/zinc/74/90/35/350749035.db2.gz MCWVMRDKOQYREF-SECBINFHSA-N 1 2 214.309 2.385 20 0 BEADLO CCc1nc(C)c(C[NH2+]Cc2conc2CC)o1 ZINC000339407786 350754577 /nfs/dbraw/zinc/75/45/77/350754577.db2.gz NMQFBYRGLYKBOH-UHFFFAOYSA-N 1 2 249.314 2.386 20 0 BEADLO c1nnc([C@@H]2CCC[N@H+]2Cc2ccccc2)[nH]1 ZINC000616607077 350800439 /nfs/dbraw/zinc/80/04/39/350800439.db2.gz IZASERADKSPDGF-LBPRGKRZSA-N 1 2 228.299 2.142 20 0 BEADLO c1nnc([C@@H]2CCC[N@@H+]2Cc2ccccc2)[nH]1 ZINC000616607077 350800440 /nfs/dbraw/zinc/80/04/40/350800440.db2.gz IZASERADKSPDGF-LBPRGKRZSA-N 1 2 228.299 2.142 20 0 BEADLO CC[C@@H](C)CN(C)c1cc(-n2cc[nH+]c2)ncn1 ZINC000607145697 350944198 /nfs/dbraw/zinc/94/41/98/350944198.db2.gz SZDKSVTVAZGTMT-LLVKDONJSA-N 1 2 245.330 2.145 20 0 BEADLO C/C=C\C[NH2+]Cc1nn(C)c(C)c1Cl ZINC000623739918 351049640 /nfs/dbraw/zinc/04/96/40/351049640.db2.gz JTPUMLKKBQPWCK-PLNGDYQASA-N 1 2 213.712 2.048 20 0 BEADLO CC[N@H+](CCC(F)(F)F)Cc1nnc(C)o1 ZINC000623121990 351053748 /nfs/dbraw/zinc/05/37/48/351053748.db2.gz YTBJLRWJKYOZIG-UHFFFAOYSA-N 1 2 237.225 2.152 20 0 BEADLO CC[N@@H+](CCC(F)(F)F)Cc1nnc(C)o1 ZINC000623121990 351053749 /nfs/dbraw/zinc/05/37/49/351053749.db2.gz YTBJLRWJKYOZIG-UHFFFAOYSA-N 1 2 237.225 2.152 20 0 BEADLO CC(C)[C@@H]1CC[C@@H]([NH2+]Cc2c[nH]nn2)C[C@@H]1C ZINC000623577864 363010152 /nfs/dbraw/zinc/01/01/52/363010152.db2.gz JKCIJJODUJDQFY-LOWVWBTDSA-N 1 2 236.363 2.355 20 0 BEADLO CC(C)[C@@H]1CC[C@@H]([NH2+]Cc2cn[nH]n2)C[C@@H]1C ZINC000623577864 363010155 /nfs/dbraw/zinc/01/01/55/363010155.db2.gz JKCIJJODUJDQFY-LOWVWBTDSA-N 1 2 236.363 2.355 20 0 BEADLO CC1(C)CCC[C@H](C[NH2+]Cc2c[nH]nn2)C1 ZINC000623578153 363010232 /nfs/dbraw/zinc/01/02/32/363010232.db2.gz XAYPGTWCKADVED-JTQLQIEISA-N 1 2 222.336 2.111 20 0 BEADLO CC1(C)CCC[C@H](C[NH2+]Cc2cn[nH]n2)C1 ZINC000623578153 363010235 /nfs/dbraw/zinc/01/02/35/363010235.db2.gz XAYPGTWCKADVED-JTQLQIEISA-N 1 2 222.336 2.111 20 0 BEADLO C[C@@H]1C[C@H]1Nc1[nH+]c(C2CC2)nc2[nH]ccc21 ZINC000631096111 351074184 /nfs/dbraw/zinc/07/41/84/351074184.db2.gz AHEGCOIKVYGSRY-GMSGAONNSA-N 1 2 228.299 2.078 20 0 BEADLO CC(C)C[C@H]1CCC[C@H]([NH2+]Cc2c[nH]nn2)C1 ZINC000398423243 351150613 /nfs/dbraw/zinc/15/06/13/351150613.db2.gz ZODKSRLTJASWCL-NEPJUHHUSA-N 1 2 236.363 2.499 20 0 BEADLO CC(C)C[C@H]1CCC[C@H]([NH2+]Cc2cn[nH]n2)C1 ZINC000398423243 351150617 /nfs/dbraw/zinc/15/06/17/351150617.db2.gz ZODKSRLTJASWCL-NEPJUHHUSA-N 1 2 236.363 2.499 20 0 BEADLO CC[C@@H]1CCC[C@@H](C[NH2+]Cc2c[nH]nn2)C1 ZINC000398388075 351128111 /nfs/dbraw/zinc/12/81/11/351128111.db2.gz JMAXQJFXERURNL-GHMZBOCLSA-N 1 2 222.336 2.111 20 0 BEADLO CC[C@@H]1CCC[C@@H](C[NH2+]Cc2cn[nH]n2)C1 ZINC000398388075 351128116 /nfs/dbraw/zinc/12/81/16/351128116.db2.gz JMAXQJFXERURNL-GHMZBOCLSA-N 1 2 222.336 2.111 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cnn[nH]2)cc1Cl ZINC000398391868 351130678 /nfs/dbraw/zinc/13/06/78/351130678.db2.gz KJBDJLCXEKWVOY-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO Cc1ccc(C[NH2+]Cc2c[nH]nn2)cc1Cl ZINC000398391868 351130681 /nfs/dbraw/zinc/13/06/81/351130681.db2.gz KJBDJLCXEKWVOY-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@@H+]1Cc1nc(C)c[nH]1 ZINC000628324162 351236007 /nfs/dbraw/zinc/23/60/07/351236007.db2.gz GZURBBGPGRZEAA-LLVKDONJSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@H+]1Cc1nc(C)c[nH]1 ZINC000628324162 351236008 /nfs/dbraw/zinc/23/60/08/351236008.db2.gz GZURBBGPGRZEAA-LLVKDONJSA-N 1 2 237.347 2.108 20 0 BEADLO CCOC(C)(C)CNc1cc(CC)[nH+]cn1 ZINC000167065358 538100146 /nfs/dbraw/zinc/10/01/46/538100146.db2.gz RAWUOLLXASNJGV-UHFFFAOYSA-N 1 2 223.320 2.266 20 0 BEADLO CC(C)CCc1noc(CCn2cc[nH+]c2)n1 ZINC000265054707 351261761 /nfs/dbraw/zinc/26/17/61/351261761.db2.gz UEAKQJDIQFIGSD-UHFFFAOYSA-N 1 2 234.303 2.097 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H](CC)OC ZINC000265206927 351265140 /nfs/dbraw/zinc/26/51/40/351265140.db2.gz KYYDXSUIGHRSRL-NSHDSACASA-N 1 2 222.288 2.008 20 0 BEADLO Cc1ccc(CNCc2[nH]c(C)c(C)[nH+]2)o1 ZINC000631242381 351308038 /nfs/dbraw/zinc/30/80/38/351308038.db2.gz IEMBKZTZNXGBIV-UHFFFAOYSA-N 1 2 219.288 2.218 20 0 BEADLO Cc1ccc(C[NH2+]Cc2nc(C)c(C)[nH]2)o1 ZINC000631242381 351308041 /nfs/dbraw/zinc/30/80/41/351308041.db2.gz IEMBKZTZNXGBIV-UHFFFAOYSA-N 1 2 219.288 2.218 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C(F)(F)F ZINC000265236474 351266179 /nfs/dbraw/zinc/26/61/79/351266179.db2.gz QGSDFMVNRQXHSG-UHFFFAOYSA-N 1 2 218.178 2.145 20 0 BEADLO CC[C@@H]1CCC[C@@H](NC(=O)CCn2cc[nH+]c2)C1 ZINC000265826979 351275976 /nfs/dbraw/zinc/27/59/76/351275976.db2.gz VKNDRQYSPRRVDK-CHWSQXEVSA-N 1 2 249.358 2.358 20 0 BEADLO CC1(C)C[N@@H+]([C@H]2CCOC2=O)Cc2ccccc21 ZINC000270364985 351378440 /nfs/dbraw/zinc/37/84/40/351378440.db2.gz LJCNLSNSVFKJLC-ZDUSSCGKSA-N 1 2 245.322 2.095 20 0 BEADLO CC1(C)C[N@H+]([C@H]2CCOC2=O)Cc2ccccc21 ZINC000270364985 351378445 /nfs/dbraw/zinc/37/84/45/351378445.db2.gz LJCNLSNSVFKJLC-ZDUSSCGKSA-N 1 2 245.322 2.095 20 0 BEADLO C[C@@H]([NH2+]Cc1ccns1)c1cscn1 ZINC000404349613 351389000 /nfs/dbraw/zinc/38/90/00/351389000.db2.gz KCVHXPBUJMVNKE-SSDOTTSWSA-N 1 2 225.342 2.450 20 0 BEADLO CCC[C@@H](C[NH2+]Cc1cn[nH]c1C)OCC ZINC000623597766 363033673 /nfs/dbraw/zinc/03/36/73/363033673.db2.gz AZDUFRSICNDPLO-LBPRGKRZSA-N 1 2 225.336 2.013 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H]1CCO[C@@H](C)C1 ZINC000271867804 351441895 /nfs/dbraw/zinc/44/18/95/351441895.db2.gz FYMQNHZEBJUQPU-JQWIXIFHSA-N 1 2 248.326 2.398 20 0 BEADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1nonc1C ZINC000271448321 351418139 /nfs/dbraw/zinc/41/81/39/351418139.db2.gz WSJRFIOFKACKOA-ZDUSSCGKSA-N 1 2 246.314 2.356 20 0 BEADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1nonc1C ZINC000271448321 351418143 /nfs/dbraw/zinc/41/81/43/351418143.db2.gz WSJRFIOFKACKOA-ZDUSSCGKSA-N 1 2 246.314 2.356 20 0 BEADLO OCC[C@H]1CCC[C@@H]1[NH2+]C1Cc2ccccc2C1 ZINC000188020902 187486264 /nfs/dbraw/zinc/48/62/64/187486264.db2.gz TYNFJRHMLXSKPB-WBMJQRKESA-N 1 2 245.366 2.295 20 0 BEADLO C[C@@H]([NH2+]CC(F)(F)c1ccccc1)[C@H](C)O ZINC000386876250 363054851 /nfs/dbraw/zinc/05/48/51/363054851.db2.gz HRXWNRFPTAIMDS-ZJUUUORDSA-N 1 2 229.270 2.137 20 0 BEADLO CCCC[N@@H+]1CCNC(=O)[C@H]1c1cccs1 ZINC000072799048 351577546 /nfs/dbraw/zinc/57/75/46/351577546.db2.gz GRJSOJBLQYELAX-LLVKDONJSA-N 1 2 238.356 2.021 20 0 BEADLO CCCC[N@H+]1CCNC(=O)[C@H]1c1cccs1 ZINC000072799048 351577547 /nfs/dbraw/zinc/57/75/47/351577547.db2.gz GRJSOJBLQYELAX-LLVKDONJSA-N 1 2 238.356 2.021 20 0 BEADLO CC[C@@H](OC)c1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000274019933 351557655 /nfs/dbraw/zinc/55/76/55/351557655.db2.gz XESICTUJLBTNKZ-LLVKDONJSA-N 1 2 247.298 2.461 20 0 BEADLO CC1(C)C[NH+](Cc2cocn2)CC(C)(C)O1 ZINC000277810925 351727484 /nfs/dbraw/zinc/72/74/84/351727484.db2.gz YGGYASSJWIQVKO-UHFFFAOYSA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1cc(C)ns1 ZINC000637853158 351708726 /nfs/dbraw/zinc/70/87/26/351708726.db2.gz RHGVUFSSKQKOHY-MNOVXSKESA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1cc(C)ns1 ZINC000637853158 351708727 /nfs/dbraw/zinc/70/87/27/351708727.db2.gz RHGVUFSSKQKOHY-MNOVXSKESA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C)ns2)CCO1 ZINC000637890105 351759786 /nfs/dbraw/zinc/75/97/86/351759786.db2.gz SSNRCXRJQNDNLT-SNVBAGLBSA-N 1 2 226.345 2.062 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C)ns2)CCO1 ZINC000637890105 351759789 /nfs/dbraw/zinc/75/97/89/351759789.db2.gz SSNRCXRJQNDNLT-SNVBAGLBSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC(C)(C)C2)sn1 ZINC000637944999 351820742 /nfs/dbraw/zinc/82/07/42/351820742.db2.gz PSAXWXLUAHDEEC-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1cc(C[N@H+]2CCOC(C)(C)C2)sn1 ZINC000637944999 351820745 /nfs/dbraw/zinc/82/07/45/351820745.db2.gz PSAXWXLUAHDEEC-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H](C)c1ccco1 ZINC000607650302 351823867 /nfs/dbraw/zinc/82/38/67/351823867.db2.gz KEWWKKRUEDXQJE-JTQLQIEISA-N 1 2 244.294 2.401 20 0 BEADLO CC[C@H](NC(=O)CCc1c[nH+]c[nH]1)[C@@H]1CC1(C)C ZINC000577840448 366079225 /nfs/dbraw/zinc/07/92/25/366079225.db2.gz XMFMCXLBUBWTTD-RYUDHWBXSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@H](NC(=O)CCc1c[nH]c[nH+]1)[C@@H]1CC1(C)C ZINC000577840448 366079231 /nfs/dbraw/zinc/07/92/31/366079231.db2.gz XMFMCXLBUBWTTD-RYUDHWBXSA-N 1 2 249.358 2.283 20 0 BEADLO Cc1nc(NC[C@@H]2CC2(Cl)Cl)cc[nH+]1 ZINC000307288452 351854219 /nfs/dbraw/zinc/85/42/19/351854219.db2.gz WZPUIDZCWYQAJH-ZETCQYMHSA-N 1 2 232.114 2.391 20 0 BEADLO CC(C)CC[C@H](O)C[N@H+](C)Cc1cscn1 ZINC000280333791 351840580 /nfs/dbraw/zinc/84/05/80/351840580.db2.gz QPFMPSSASFPACC-LBPRGKRZSA-N 1 2 242.388 2.372 20 0 BEADLO CC(C)CC[C@H](O)C[N@@H+](C)Cc1cscn1 ZINC000280333791 351840584 /nfs/dbraw/zinc/84/05/84/351840584.db2.gz QPFMPSSASFPACC-LBPRGKRZSA-N 1 2 242.388 2.372 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C)ns2)C[C@H](C)O1 ZINC000637970043 351845136 /nfs/dbraw/zinc/84/51/36/351845136.db2.gz APAKXFZBVCOMCT-WDEREUQCSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C)ns2)C[C@H](C)O1 ZINC000637970043 351845137 /nfs/dbraw/zinc/84/51/37/351845137.db2.gz APAKXFZBVCOMCT-WDEREUQCSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccns2)C[C@H](C)O1 ZINC000637973596 351848785 /nfs/dbraw/zinc/84/87/85/351848785.db2.gz XLPXLTGEFOTDLE-VHSXEESVSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccns2)C[C@H](C)O1 ZINC000637973596 351848786 /nfs/dbraw/zinc/84/87/86/351848786.db2.gz XLPXLTGEFOTDLE-VHSXEESVSA-N 1 2 226.345 2.142 20 0 BEADLO CCC[C@H](C[N@H+](C)Cc1cscn1)OC ZINC000637974345 351849966 /nfs/dbraw/zinc/84/99/66/351849966.db2.gz SWMAQDGWCQRLFQ-LLVKDONJSA-N 1 2 228.361 2.390 20 0 BEADLO CCC[C@H](C[N@@H+](C)Cc1cscn1)OC ZINC000637974345 351849967 /nfs/dbraw/zinc/84/99/67/351849967.db2.gz SWMAQDGWCQRLFQ-LLVKDONJSA-N 1 2 228.361 2.390 20 0 BEADLO CC(C)CNC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000280933251 351866010 /nfs/dbraw/zinc/86/60/10/351866010.db2.gz HGTCBQRNMSLJMO-UHFFFAOYSA-N 1 2 232.287 2.112 20 0 BEADLO CCCC[C@@H](C)C(=O)NCCNc1cccc[nH+]1 ZINC000282146132 351924569 /nfs/dbraw/zinc/92/45/69/351924569.db2.gz LKSYQCLISJQBTC-GFCCVEGCSA-N 1 2 249.358 2.436 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@@H](C)[C@@H]2C)sn1 ZINC000638085602 351961967 /nfs/dbraw/zinc/96/19/67/351961967.db2.gz SAQAJRDAIWQAML-UWVGGRQHSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@@H](C)[C@@H]2C)sn1 ZINC000638085602 351961969 /nfs/dbraw/zinc/96/19/69/351961969.db2.gz SAQAJRDAIWQAML-UWVGGRQHSA-N 1 2 226.345 2.061 20 0 BEADLO CC[N@H+](Cc1nnc(C)[nH]1)Cc1ccccc1C ZINC000292213319 352307673 /nfs/dbraw/zinc/30/76/73/352307673.db2.gz PYLQHLPFHBJARP-UHFFFAOYSA-N 1 2 244.342 2.444 20 0 BEADLO CC[N@@H+](Cc1nnc(C)[nH]1)Cc1ccccc1C ZINC000292213319 352307675 /nfs/dbraw/zinc/30/76/75/352307675.db2.gz PYLQHLPFHBJARP-UHFFFAOYSA-N 1 2 244.342 2.444 20 0 BEADLO CC[C@@H]1CCC[C@@H](CNCC(F)(F)C[NH3+])C1 ZINC000414927435 352323034 /nfs/dbraw/zinc/32/30/34/352323034.db2.gz LCMCJNCCFKZXFX-GHMZBOCLSA-N 1 2 234.334 2.386 20 0 BEADLO CC1(C)CCC[C@H]1CNC(=O)CCc1[nH]cc[nH+]1 ZINC000294199335 352371958 /nfs/dbraw/zinc/37/19/58/352371958.db2.gz PIZHMLPHRZTVAT-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000294371476 352376461 /nfs/dbraw/zinc/37/64/61/352376461.db2.gz GUTHRILTEKPLHG-UPJWGTAASA-N 1 2 249.358 2.214 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)NCc1[nH]c[nH+]c1C ZINC000295411119 352411524 /nfs/dbraw/zinc/41/15/24/352411524.db2.gz VFWZDAUIMNDDNH-MNOVXSKESA-N 1 2 235.331 2.161 20 0 BEADLO C[C@@H](O)CC[NH2+][C@H](c1ccccc1)C(F)F ZINC000411761133 191208746 /nfs/dbraw/zinc/20/87/46/191208746.db2.gz UCWFIRCSFMHOTP-MWLCHTKSSA-N 1 2 229.270 2.353 20 0 BEADLO Cc1cccc(NC(=O)NCc2c[nH+]cn2C)c1 ZINC000336180469 538103863 /nfs/dbraw/zinc/10/38/63/538103863.db2.gz ZHOJTRWLGCUAJB-UHFFFAOYSA-N 1 2 244.298 2.050 20 0 BEADLO COC[C@H]([NH2+]Cc1ccns1)c1ccco1 ZINC000638721766 352572990 /nfs/dbraw/zinc/57/29/90/352572990.db2.gz RJMPVNVHTSCDEI-JTQLQIEISA-N 1 2 238.312 2.213 20 0 BEADLO CC(C)C[N@@H+]1CC(=O)N[C@@H]1[C@H]1CCCC[C@@H]1C ZINC000342249077 352739855 /nfs/dbraw/zinc/73/98/55/352739855.db2.gz DSYPEERTJMXXRH-OBJOEFQTSA-N 1 2 238.375 2.227 20 0 BEADLO CC(C)C[N@H+]1CC(=O)N[C@@H]1[C@H]1CCCC[C@@H]1C ZINC000342249077 352739857 /nfs/dbraw/zinc/73/98/57/352739857.db2.gz DSYPEERTJMXXRH-OBJOEFQTSA-N 1 2 238.375 2.227 20 0 BEADLO CN(c1cc(C(F)(F)F)cc[nH+]1)C1CC(O)C1 ZINC000334214736 352813112 /nfs/dbraw/zinc/81/31/12/352813112.db2.gz BKNMDLFNYFHKES-UHFFFAOYSA-N 1 2 246.232 2.060 20 0 BEADLO CC[N@H+](Cc1nnc(C)o1)Cc1occc1C ZINC000412041621 191249789 /nfs/dbraw/zinc/24/97/89/191249789.db2.gz NGPKZFBFDLBZHE-UHFFFAOYSA-N 1 2 235.287 2.302 20 0 BEADLO CC[N@@H+](Cc1nnc(C)o1)Cc1occc1C ZINC000412041621 191249794 /nfs/dbraw/zinc/24/97/94/191249794.db2.gz NGPKZFBFDLBZHE-UHFFFAOYSA-N 1 2 235.287 2.302 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CCCC(F)(F)C2)c[nH+]1 ZINC000334193758 352785195 /nfs/dbraw/zinc/78/51/95/352785195.db2.gz JJONGWWZTKPVEL-MRVPVSSYSA-N 1 2 243.257 2.026 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1cccs1 ZINC000334234465 352850938 /nfs/dbraw/zinc/85/09/38/352850938.db2.gz PZGSMRVBSTWULX-UHFFFAOYSA-N 1 2 232.308 2.380 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)n1C ZINC000342809812 352860995 /nfs/dbraw/zinc/86/09/95/352860995.db2.gz UNWBKUUWTYHBPD-CYBMUJFWSA-N 1 2 244.342 2.394 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)n1C ZINC000342809812 352860999 /nfs/dbraw/zinc/86/09/99/352860999.db2.gz UNWBKUUWTYHBPD-CYBMUJFWSA-N 1 2 244.342 2.394 20 0 BEADLO Cc1c[nH+]c(CN2CCC[C@@H]2c2ccc[nH]2)n1C ZINC000342809812 352861002 /nfs/dbraw/zinc/86/10/02/352861002.db2.gz UNWBKUUWTYHBPD-CYBMUJFWSA-N 1 2 244.342 2.394 20 0 BEADLO O=C(C[C@H]1C=CCC1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000334248027 352840137 /nfs/dbraw/zinc/84/01/37/352840137.db2.gz OKWALANASWPOHD-RYUDHWBXSA-N 1 2 245.326 2.430 20 0 BEADLO CC1(CC(=O)N2CCC[C@@H]2c2[nH]cc[nH+]2)CC1 ZINC000334248637 352841060 /nfs/dbraw/zinc/84/10/60/352841060.db2.gz QMMCRWFCTADWII-SNVBAGLBSA-N 1 2 233.315 2.263 20 0 BEADLO CCc1nc(N2[C@H](C)C[C@H]2C)cc(C)[nH+]1 ZINC000334251631 352887959 /nfs/dbraw/zinc/88/79/59/352887959.db2.gz VMGLIULPIKUIMD-NXEZZACHSA-N 1 2 205.305 2.335 20 0 BEADLO Cc1[nH+]c(C(C)C)ccc1CN1C(=O)CCC1=O ZINC000334263256 352897453 /nfs/dbraw/zinc/89/74/53/352897453.db2.gz JKIPQQZOUZRVSP-UHFFFAOYSA-N 1 2 246.310 2.162 20 0 BEADLO COc1ccc[nH+]c1NC1CC(n2cccn2)C1 ZINC000638824982 353006085 /nfs/dbraw/zinc/00/60/85/353006085.db2.gz WNBITYKZDISRAH-UHFFFAOYSA-N 1 2 244.298 2.102 20 0 BEADLO CC[N@H+](CCC(F)(F)F)Cc1ccnn1C ZINC000092753831 538107649 /nfs/dbraw/zinc/10/76/49/538107649.db2.gz WRQLDTOSRFVMGD-UHFFFAOYSA-N 1 2 235.253 2.194 20 0 BEADLO CC[N@@H+](CCC(F)(F)F)Cc1ccnn1C ZINC000092753831 538107650 /nfs/dbraw/zinc/10/76/50/538107650.db2.gz WRQLDTOSRFVMGD-UHFFFAOYSA-N 1 2 235.253 2.194 20 0 BEADLO C[C@H]1CC[N@H+](Cc2ccns2)C[C@H]1F ZINC000638910917 353075513 /nfs/dbraw/zinc/07/55/13/353075513.db2.gz WCECPHQDAVVUAV-WCBMZHEXSA-N 1 2 214.309 2.323 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2ccns2)C[C@H]1F ZINC000638910917 353075514 /nfs/dbraw/zinc/07/55/14/353075514.db2.gz WCECPHQDAVVUAV-WCBMZHEXSA-N 1 2 214.309 2.323 20 0 BEADLO Cn1ccc(C[NH2+]C(C)(C)C(F)F)c1 ZINC000379577591 538107451 /nfs/dbraw/zinc/10/74/51/538107451.db2.gz RHQUBFYKVYTESL-UHFFFAOYSA-N 1 2 202.248 2.158 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)nc1 ZINC000334430544 353105760 /nfs/dbraw/zinc/10/57/60/353105760.db2.gz VGVJAXXDKXLXQO-JTQLQIEISA-N 1 2 241.285 2.262 20 0 BEADLO Cc1cnc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)nc1 ZINC000334430544 353105762 /nfs/dbraw/zinc/10/57/62/353105762.db2.gz VGVJAXXDKXLXQO-JTQLQIEISA-N 1 2 241.285 2.262 20 0 BEADLO Cn1cc[nH+]c1[C@@H](C1CC1)N1CCC=C(F)C1 ZINC000638935716 353099925 /nfs/dbraw/zinc/09/99/25/353099925.db2.gz BGYRPLYOHLSKDW-GFCCVEGCSA-N 1 2 235.306 2.430 20 0 BEADLO CC(C)c1nc(N2CCOCC[C@@H]2C)cc[nH+]1 ZINC000302006339 188059767 /nfs/dbraw/zinc/05/97/67/188059767.db2.gz VUGYLNUHKKQJEF-NSHDSACASA-N 1 2 235.331 2.215 20 0 BEADLO CC(C)Cn1cc[nH+]c1CNC(=O)C[C@H]1C[C@@H]1C ZINC000354706891 188062907 /nfs/dbraw/zinc/06/29/07/188062907.db2.gz HQHCBZNVKZAXTA-NWDGAFQWSA-N 1 2 249.358 2.201 20 0 BEADLO COc1ccc(CNc2cccc[nH+]2)c(OC)n1 ZINC000357827878 188067009 /nfs/dbraw/zinc/06/70/09/188067009.db2.gz OZYCLMAWYUICHZ-UHFFFAOYSA-N 1 2 245.282 2.106 20 0 BEADLO CC(C)(O)CC[NH2+]c1ccc(-n2cccn2)cc1 ZINC000361419958 188070233 /nfs/dbraw/zinc/07/02/33/188070233.db2.gz JIFWAOUUGFKMCU-UHFFFAOYSA-N 1 2 245.326 2.445 20 0 BEADLO c1cnn(C2CC[NH+](Cc3cscn3)CC2)c1 ZINC000369120171 188074248 /nfs/dbraw/zinc/07/42/48/188074248.db2.gz PIAVDYUYHNEGGA-UHFFFAOYSA-N 1 2 248.355 2.177 20 0 BEADLO Cc1csc(C(=O)N(C)Cc2[nH]cc[nH+]2)c1 ZINC000334843788 188082756 /nfs/dbraw/zinc/08/27/56/188082756.db2.gz YLGOGYDEGAQLPT-UHFFFAOYSA-N 1 2 235.312 2.052 20 0 BEADLO COc1ccc(Nc2[nH+]cccc2N)cc1OC ZINC000020317762 188108602 /nfs/dbraw/zinc/10/86/02/188108602.db2.gz GYBCWRKRFZRUIM-UHFFFAOYSA-N 1 2 245.282 2.425 20 0 BEADLO Cc1cn2c(n1)C[N@H+](CC1(C(C)C)CC1)CC2 ZINC000638974228 353180030 /nfs/dbraw/zinc/18/00/30/353180030.db2.gz MGQJXERXOLFWKI-UHFFFAOYSA-N 1 2 233.359 2.443 20 0 BEADLO Cc1cn2c(n1)C[N@@H+](CC1(C(C)C)CC1)CC2 ZINC000638974228 353180034 /nfs/dbraw/zinc/18/00/34/353180034.db2.gz MGQJXERXOLFWKI-UHFFFAOYSA-N 1 2 233.359 2.443 20 0 BEADLO COc1cc(C)ccc1-c1c[nH+]cn1C ZINC000623171076 353217980 /nfs/dbraw/zinc/21/79/80/353217980.db2.gz LRQBYTTXCBCMKP-UHFFFAOYSA-N 1 2 202.257 2.404 20 0 BEADLO CCN(CC)c1ccc(CNC(=O)C(C)C)c[nH+]1 ZINC000057518373 188127312 /nfs/dbraw/zinc/12/73/12/188127312.db2.gz BFCOKXHPIBNDSZ-UHFFFAOYSA-N 1 2 249.358 2.200 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+]1CCc2sccc2C1 ZINC000043638463 188153053 /nfs/dbraw/zinc/15/30/53/188153053.db2.gz FBYWTBCDQQVJTN-SECBINFHSA-N 1 2 239.340 2.058 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+]1CCc2sccc2C1 ZINC000043638463 188153054 /nfs/dbraw/zinc/15/30/54/188153054.db2.gz FBYWTBCDQQVJTN-SECBINFHSA-N 1 2 239.340 2.058 20 0 BEADLO C/C=C/C=C/C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000169812697 188161591 /nfs/dbraw/zinc/16/15/91/188161591.db2.gz FIUBIOAHEJUWFF-FDIIFSBFSA-N 1 2 245.326 2.248 20 0 BEADLO CC(C)(C)[C@H](O)C[N@H+](CC(F)F)C1CC1 ZINC000336663725 188163492 /nfs/dbraw/zinc/16/34/92/188163492.db2.gz CVHNVEBEMVEVSI-SECBINFHSA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)(C)[C@H](O)C[N@@H+](CC(F)F)C1CC1 ZINC000336663725 188163495 /nfs/dbraw/zinc/16/34/95/188163495.db2.gz CVHNVEBEMVEVSI-SECBINFHSA-N 1 2 221.291 2.123 20 0 BEADLO Cc1ccc(NC(=O)C[C@@H]2CCCO2)c(C)[nH+]1 ZINC000176186011 188164083 /nfs/dbraw/zinc/16/40/83/188164083.db2.gz OWBMWSWTXSQMNQ-NSHDSACASA-N 1 2 234.299 2.206 20 0 BEADLO CC(C)C[C@H](C)CC(=O)NCc1[nH+]ccn1C ZINC000264305897 188194774 /nfs/dbraw/zinc/19/47/74/188194774.db2.gz MSBYCXZDWYZOJS-NSHDSACASA-N 1 2 237.347 2.109 20 0 BEADLO O=C(CC1CCC1)NCc1cn2ccccc2[nH+]1 ZINC000266249981 188195732 /nfs/dbraw/zinc/19/57/32/188195732.db2.gz RUXTWFMHAWTWCP-UHFFFAOYSA-N 1 2 243.310 2.141 20 0 BEADLO C/C=C(\C)C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000267558737 188196248 /nfs/dbraw/zinc/19/62/48/188196248.db2.gz FXHCUNNKUNEWMD-LFJXOHPOSA-N 1 2 233.315 2.082 20 0 BEADLO C/C=C(\C)C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000267558736 188196573 /nfs/dbraw/zinc/19/65/73/188196573.db2.gz FXHCUNNKUNEWMD-JNZVDCKRSA-N 1 2 233.315 2.082 20 0 BEADLO CC(C)[C@H](NC(=O)Cc1ccoc1)c1[nH]cc[nH+]1 ZINC000338882177 188189449 /nfs/dbraw/zinc/18/94/49/188189449.db2.gz YEQNKBDSPYWLKR-LBPRGKRZSA-N 1 2 247.298 2.059 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)CCOC(C)C ZINC000331232752 188220546 /nfs/dbraw/zinc/22/05/46/188220546.db2.gz AUNJWMGOQIIANX-UHFFFAOYSA-N 1 2 236.315 2.452 20 0 BEADLO CC(=O)CCCC(=O)Nc1cc[nH+]cc1C ZINC000274809438 188201516 /nfs/dbraw/zinc/20/15/16/188201516.db2.gz SSLHRZVFDLJLHV-UHFFFAOYSA-N 1 2 220.272 2.088 20 0 BEADLO C/C=C(\CC)C(=O)NCc1cn2ccccc2[nH+]1 ZINC000276638617 188202643 /nfs/dbraw/zinc/20/26/43/188202643.db2.gz VZVARTNUFDSKJA-QDEBKDIKSA-N 1 2 243.310 2.307 20 0 BEADLO CC[C@H]1CCCC[C@@H]1C(=O)NCc1[nH]cc[nH+]1 ZINC000280475369 188205185 /nfs/dbraw/zinc/20/51/85/188205185.db2.gz IQDZBBJPXYUHHY-QWRGUYRKSA-N 1 2 235.331 2.242 20 0 BEADLO CC(C)(C)[C@@H]1C[N@H+](Cc2nccs2)CCO1 ZINC000279706956 188205251 /nfs/dbraw/zinc/20/52/51/188205251.db2.gz HPSYXHJOQYVXNF-JTQLQIEISA-N 1 2 240.372 2.390 20 0 BEADLO CC(C)(C)[C@@H]1C[N@@H+](Cc2nccs2)CCO1 ZINC000279706956 188205253 /nfs/dbraw/zinc/20/52/53/188205253.db2.gz HPSYXHJOQYVXNF-JTQLQIEISA-N 1 2 240.372 2.390 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H](C)CF ZINC000287508409 188209147 /nfs/dbraw/zinc/20/91/47/188209147.db2.gz LZQPDVZXGIRMAN-QMMMGPOBSA-N 1 2 225.267 2.178 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)NOCC(C)C ZINC000287558125 188209801 /nfs/dbraw/zinc/20/98/01/188209801.db2.gz PIEXXUXCOUESIU-UHFFFAOYSA-N 1 2 237.303 2.408 20 0 BEADLO CC(C)(C)c1cc(Cn2cc[nH+]c2)no1 ZINC000289341977 188211101 /nfs/dbraw/zinc/21/11/01/188211101.db2.gz JJXFMDNWDNQJLI-UHFFFAOYSA-N 1 2 205.261 2.217 20 0 BEADLO Cc1ccc2c(c1)CC[N@@H+](Cc1c[nH]cn1)C2 ZINC000336310719 188229550 /nfs/dbraw/zinc/22/95/50/188229550.db2.gz RVBIKOWPYAGNGM-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1ccc2c(c1)CC[N@H+](Cc1c[nH]cn1)C2 ZINC000336310719 188229552 /nfs/dbraw/zinc/22/95/52/188229552.db2.gz RVBIKOWPYAGNGM-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1ccc2c(c1)CC[N@@H+](Cc1cnc[nH]1)C2 ZINC000336310719 188229553 /nfs/dbraw/zinc/22/95/53/188229553.db2.gz RVBIKOWPYAGNGM-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1ccc2c(c1)CC[N@H+](Cc1cnc[nH]1)C2 ZINC000336310719 188229555 /nfs/dbraw/zinc/22/95/55/188229555.db2.gz RVBIKOWPYAGNGM-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO CC(C)N(C)C(=O)C[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000336535242 188230852 /nfs/dbraw/zinc/23/08/52/188230852.db2.gz GMSDSGAGEUMQBG-LBPRGKRZSA-N 1 2 246.354 2.430 20 0 BEADLO CC(C)N(C)C(=O)C[N@H+]1Cc2ccccc2[C@@H]1C ZINC000336535242 188230854 /nfs/dbraw/zinc/23/08/54/188230854.db2.gz GMSDSGAGEUMQBG-LBPRGKRZSA-N 1 2 246.354 2.430 20 0 BEADLO Cc1nc([C@H](C)[NH2+]CCF)c(C)s1 ZINC000308177667 538115389 /nfs/dbraw/zinc/11/53/89/538115389.db2.gz GAICQDJGYQFMIH-LURJTMIESA-N 1 2 202.298 2.380 20 0 BEADLO FC1C[NH+](C[C@H]2CCc3ccccc3C2)C1 ZINC000639039847 353320582 /nfs/dbraw/zinc/32/05/82/353320582.db2.gz XSJNOJGYGHFDMN-NSHDSACASA-N 1 2 219.303 2.445 20 0 BEADLO CC[N@H+](CC(F)F)C[C@](C)(CC)OC ZINC000639059375 353363953 /nfs/dbraw/zinc/36/39/53/353363953.db2.gz JVLJCJDXCYKUNV-JTQLQIEISA-N 1 2 209.280 2.389 20 0 BEADLO CC[N@@H+](CC(F)F)C[C@](C)(CC)OC ZINC000639059375 353363955 /nfs/dbraw/zinc/36/39/55/353363955.db2.gz JVLJCJDXCYKUNV-JTQLQIEISA-N 1 2 209.280 2.389 20 0 BEADLO F[C@H]1CC[N@H+](Cc2ccc(Cl)o2)C1 ZINC000336222851 180944948 /nfs/dbraw/zinc/94/49/48/180944948.db2.gz PGYSLDXPAXPQOZ-ZETCQYMHSA-N 1 2 203.644 2.477 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2ccc(Cl)o2)C1 ZINC000336222851 180944950 /nfs/dbraw/zinc/94/49/50/180944950.db2.gz PGYSLDXPAXPQOZ-ZETCQYMHSA-N 1 2 203.644 2.477 20 0 BEADLO CC1=C(C)C[C@@H](C(=O)NCc2[nH]cc[nH+]2)CC1 ZINC000335361066 535237803 /nfs/dbraw/zinc/23/78/03/535237803.db2.gz VVGVWSJUIRRTCP-NSHDSACASA-N 1 2 233.315 2.162 20 0 BEADLO CC1(C)CCC(NC(=O)CCc2c[nH+]c[nH]2)CC1 ZINC000193340628 353584700 /nfs/dbraw/zinc/58/47/00/353584700.db2.gz JIRARCDQLHINHC-UHFFFAOYSA-N 1 2 249.358 2.427 20 0 BEADLO CC1(C)CCC(NC(=O)CCc2c[nH]c[nH+]2)CC1 ZINC000193340628 353584704 /nfs/dbraw/zinc/58/47/04/353584704.db2.gz JIRARCDQLHINHC-UHFFFAOYSA-N 1 2 249.358 2.427 20 0 BEADLO COc1ccc(CNc2cc[nH+]c(C)n2)cc1 ZINC000054935680 188441350 /nfs/dbraw/zinc/44/13/50/188441350.db2.gz NIRMUYDOPBIQCN-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO Fc1cccc(OCCOCc2[nH]cc[nH+]2)c1 ZINC000123747146 181002508 /nfs/dbraw/zinc/00/25/08/181002508.db2.gz IMGXYIXJAYDRIZ-UHFFFAOYSA-N 1 2 236.246 2.144 20 0 BEADLO Cc1cc(NC[C@H]2CC[C@@H](O)C2)nc(C(C)C)[nH+]1 ZINC000232764415 353760492 /nfs/dbraw/zinc/76/04/92/353760492.db2.gz RDEQILBKHIMRNN-NWDGAFQWSA-N 1 2 249.358 2.481 20 0 BEADLO CC[N@H+](CCO)Cc1ccc(Cl)nc1Cl ZINC000233465983 353821689 /nfs/dbraw/zinc/82/16/89/353821689.db2.gz TWTBEANAOFXXMN-UHFFFAOYSA-N 1 2 249.141 2.203 20 0 BEADLO CC[N@@H+](CCO)Cc1ccc(Cl)nc1Cl ZINC000233465983 353821690 /nfs/dbraw/zinc/82/16/90/353821690.db2.gz TWTBEANAOFXXMN-UHFFFAOYSA-N 1 2 249.141 2.203 20 0 BEADLO C[C@@H]1COCC[N@@H+]1Cc1cc2ccccc2n1C ZINC000639128986 353834414 /nfs/dbraw/zinc/83/44/14/353834414.db2.gz XDJKUCFRADFTHA-GFCCVEGCSA-N 1 2 244.338 2.399 20 0 BEADLO C[C@@H]1COCC[N@H+]1Cc1cc2ccccc2n1C ZINC000639128986 353834418 /nfs/dbraw/zinc/83/44/18/353834418.db2.gz XDJKUCFRADFTHA-GFCCVEGCSA-N 1 2 244.338 2.399 20 0 BEADLO Cc1ccncc1C[N@H+](C)Cc1ccns1 ZINC000639123449 353788083 /nfs/dbraw/zinc/78/80/83/353788083.db2.gz AYMYMOFNDKLYJN-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ccncc1C[N@@H+](C)Cc1ccns1 ZINC000639123449 353788088 /nfs/dbraw/zinc/78/80/88/353788088.db2.gz AYMYMOFNDKLYJN-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CC1(CNc2nc[nH+]c(N)c2Cl)CCC1 ZINC000232842490 353792505 /nfs/dbraw/zinc/79/25/05/353792505.db2.gz PFVZVUDLOOSWNQ-UHFFFAOYSA-N 1 2 226.711 2.314 20 0 BEADLO CC1(CNc2[nH+]cnc(N)c2Cl)CCC1 ZINC000232842490 353792506 /nfs/dbraw/zinc/79/25/06/353792506.db2.gz PFVZVUDLOOSWNQ-UHFFFAOYSA-N 1 2 226.711 2.314 20 0 BEADLO c1cc(CNc2ccc(N3CCCC3)c[nH+]2)c[nH]1 ZINC000343349044 353853156 /nfs/dbraw/zinc/85/31/56/353853156.db2.gz ZPCSWKLBPKJPBC-UHFFFAOYSA-N 1 2 242.326 2.044 20 0 BEADLO CC[C@@H](C)[C@H](C[NH2+]C1(C(F)F)CC1)OC ZINC000639139595 353856146 /nfs/dbraw/zinc/85/61/46/353856146.db2.gz MTYIWRKNRLAESC-BDAKNGLRSA-N 1 2 221.291 2.435 20 0 BEADLO CC[C@]1(C)C[C@H]1C(=O)NCCNc1cccc[nH+]1 ZINC000343599103 353930084 /nfs/dbraw/zinc/93/00/84/353930084.db2.gz HFICLUXVOFOCHW-SMDDNHRTSA-N 1 2 247.342 2.046 20 0 BEADLO Cc1cc(NCC2Cc3ccccc3C2)nc[nH+]1 ZINC000343733036 353988996 /nfs/dbraw/zinc/98/89/96/353988996.db2.gz WNERVERREHMUBG-UHFFFAOYSA-N 1 2 239.322 2.034 20 0 BEADLO CCCn1c(C)nnc1C[N@@H+]1CCC12CCC2 ZINC000343723034 353958900 /nfs/dbraw/zinc/95/89/00/353958900.db2.gz SZFUVEKKPDAVNH-UHFFFAOYSA-N 1 2 234.347 2.125 20 0 BEADLO CCCn1c(C)nnc1C[N@H+]1CCC12CCC2 ZINC000343723034 353958903 /nfs/dbraw/zinc/95/89/03/353958903.db2.gz SZFUVEKKPDAVNH-UHFFFAOYSA-N 1 2 234.347 2.125 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2cnc(C3CC3)nc2)C1 ZINC000334559174 354008584 /nfs/dbraw/zinc/00/85/84/354008584.db2.gz MNEUUGZFYXSIDE-CYBMUJFWSA-N 1 2 235.306 2.288 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2cnc(C3CC3)nc2)C1 ZINC000334559174 354008586 /nfs/dbraw/zinc/00/85/86/354008586.db2.gz MNEUUGZFYXSIDE-CYBMUJFWSA-N 1 2 235.306 2.288 20 0 BEADLO CCn1nncc1C[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000334559360 354009173 /nfs/dbraw/zinc/00/91/73/354009173.db2.gz NLKKKTXRCPCGFS-NSHDSACASA-N 1 2 242.326 2.375 20 0 BEADLO CCn1nncc1C[N@H+]1Cc2ccccc2[C@@H]1C ZINC000334559360 354009175 /nfs/dbraw/zinc/00/91/75/354009175.db2.gz NLKKKTXRCPCGFS-NSHDSACASA-N 1 2 242.326 2.375 20 0 BEADLO C[C@@H]1CC[C@@H]1[NH+]=c1[nH]c2cccc(F)c2n1C ZINC000343807574 354010353 /nfs/dbraw/zinc/01/03/53/354010353.db2.gz LPAIPLOVKKVILF-SCZZXKLOSA-N 1 2 233.290 2.345 20 0 BEADLO COc1cc[nH+]cc1CSc1ncccn1 ZINC000343815210 354013156 /nfs/dbraw/zinc/01/31/56/354013156.db2.gz XYJVWPMVCYCWNU-UHFFFAOYSA-N 1 2 233.296 2.173 20 0 BEADLO Cc1cc(N[C@@H]2C[C@@H]2C(F)F)nc(C(C)C)[nH+]1 ZINC000343782306 354017623 /nfs/dbraw/zinc/01/76/23/354017623.db2.gz NSWWJZJEYKQKAA-DTWKUNHWSA-N 1 2 241.285 2.396 20 0 BEADLO Cc1cc(N[C@H]2C[C@@H]2C(F)F)nc(C(C)C)[nH+]1 ZINC000343782307 354017681 /nfs/dbraw/zinc/01/76/81/354017681.db2.gz NSWWJZJEYKQKAA-IUCAKERBSA-N 1 2 241.285 2.396 20 0 BEADLO CC1(COc2cccc(-n3cc[nH+]c3)c2)COC1 ZINC000343843565 354020279 /nfs/dbraw/zinc/02/02/79/354020279.db2.gz FVWIXLIZIKNEMW-UHFFFAOYSA-N 1 2 244.294 2.288 20 0 BEADLO COc1cc[nH+]cc1CSc1nncs1 ZINC000343839281 354035794 /nfs/dbraw/zinc/03/57/94/354035794.db2.gz ZYKDNWQFNIWNOO-UHFFFAOYSA-N 1 2 239.325 2.234 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@@H]2CC=CCC2)no1 ZINC000344072955 354132759 /nfs/dbraw/zinc/13/27/59/354132759.db2.gz SNROVWXBIBTDQG-LLVKDONJSA-N 1 2 221.304 2.166 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@@H]2CC=CCC2)no1 ZINC000344072955 354132760 /nfs/dbraw/zinc/13/27/60/354132760.db2.gz SNROVWXBIBTDQG-LLVKDONJSA-N 1 2 221.304 2.166 20 0 BEADLO CC(C)[C@H]1C[N@H+](Cc2ccco2)CCN1C ZINC000334569738 354095505 /nfs/dbraw/zinc/09/55/05/354095505.db2.gz AEWZZAOIGUSBHC-CYBMUJFWSA-N 1 2 222.332 2.052 20 0 BEADLO CC(C)[C@H]1C[N@@H+](Cc2ccco2)CCN1C ZINC000334569738 354095507 /nfs/dbraw/zinc/09/55/07/354095507.db2.gz AEWZZAOIGUSBHC-CYBMUJFWSA-N 1 2 222.332 2.052 20 0 BEADLO CCC1CN(c2[nH+]c(C)nc3[nH]ccc32)C1 ZINC000334577511 354120533 /nfs/dbraw/zinc/12/05/33/354120533.db2.gz OQBZLWXDMMHUAE-UHFFFAOYSA-N 1 2 216.288 2.113 20 0 BEADLO Cc1cc(N2CC(CF)C2)nc(C(C)C)[nH+]1 ZINC000334578992 354125308 /nfs/dbraw/zinc/12/53/08/354125308.db2.gz IXRUTICMHCATBM-UHFFFAOYSA-N 1 2 223.295 2.314 20 0 BEADLO COc1ccc(CNc2cccc[nH+]2)cn1 ZINC000060205796 188580982 /nfs/dbraw/zinc/58/09/82/188580982.db2.gz OZJRVMROGDOBLJ-UHFFFAOYSA-N 1 2 215.256 2.097 20 0 BEADLO FC1(F)COCC[N@H+](CC2CCCC2)C1 ZINC000344116937 354142757 /nfs/dbraw/zinc/14/27/57/354142757.db2.gz OJRMTCCIIHCCKV-UHFFFAOYSA-N 1 2 219.275 2.144 20 0 BEADLO FC1(F)COCC[N@@H+](CC2CCCC2)C1 ZINC000344116937 354142759 /nfs/dbraw/zinc/14/27/59/354142759.db2.gz OJRMTCCIIHCCKV-UHFFFAOYSA-N 1 2 219.275 2.144 20 0 BEADLO CN(C(=O)CCc1[nH]cc[nH+]1)C1CCCCC1 ZINC000344128477 354146764 /nfs/dbraw/zinc/14/67/64/354146764.db2.gz OBJMKACNDVBOQR-UHFFFAOYSA-N 1 2 235.331 2.133 20 0 BEADLO Cc1cnc(C[N@H+](C)CCc2ccccc2O)o1 ZINC000344157197 354157501 /nfs/dbraw/zinc/15/75/01/354157501.db2.gz CFUJDKFKBPHZCF-UHFFFAOYSA-N 1 2 246.310 2.363 20 0 BEADLO Cc1cnc(C[N@@H+](C)CCc2ccccc2O)o1 ZINC000344157197 354157505 /nfs/dbraw/zinc/15/75/05/354157505.db2.gz CFUJDKFKBPHZCF-UHFFFAOYSA-N 1 2 246.310 2.363 20 0 BEADLO FC1C[NH+](Cc2cccc3[nH]ccc32)C1 ZINC000334587984 354214136 /nfs/dbraw/zinc/21/41/36/354214136.db2.gz IXEGPQBHNJAQBW-UHFFFAOYSA-N 1 2 204.248 2.322 20 0 BEADLO CC(C)(C)Cc1csc([C@H]2COCC[NH2+]2)n1 ZINC000334601480 354279980 /nfs/dbraw/zinc/27/99/80/354279980.db2.gz IJVXTNPLVMCVOI-SNVBAGLBSA-N 1 2 240.372 2.393 20 0 BEADLO C[C@H](c1csnn1)[N@@H+]1CCS[C@H](C)CC1 ZINC000334620367 354357452 /nfs/dbraw/zinc/35/74/52/354357452.db2.gz QKTOFYPJKWJVMH-RKDXNWHRSA-N 1 2 243.401 2.427 20 0 BEADLO C[C@H](c1csnn1)[N@H+]1CCS[C@H](C)CC1 ZINC000334620367 354357454 /nfs/dbraw/zinc/35/74/54/354357454.db2.gz QKTOFYPJKWJVMH-RKDXNWHRSA-N 1 2 243.401 2.427 20 0 BEADLO Fc1ccc(C[NH2+]Cc2ccon2)cc1F ZINC000086452684 491061772 /nfs/dbraw/zinc/06/17/72/491061772.db2.gz ZDRKLFAFCLALSQ-UHFFFAOYSA-N 1 2 224.210 2.243 20 0 BEADLO COC[C@H]([NH2+]Cc1cnc[nH]1)c1ccc(F)cc1 ZINC000344597384 354322756 /nfs/dbraw/zinc/32/27/56/354322756.db2.gz ZJTIDJVZWTXZAE-ZDUSSCGKSA-N 1 2 249.289 2.026 20 0 BEADLO O[C@H]1C[C@@H](c2ccccc2)N(c2cccc[nH+]2)C1 ZINC000334644870 354403835 /nfs/dbraw/zinc/40/38/35/354403835.db2.gz KLRFTBDXNRNTOB-KBPBESRZSA-N 1 2 240.306 2.394 20 0 BEADLO O[C@@H]1C[C@@H](c2ccccc2)N(c2cccc[nH+]2)C1 ZINC000334644871 354403854 /nfs/dbraw/zinc/40/38/54/354403854.db2.gz KLRFTBDXNRNTOB-KGLIPLIRSA-N 1 2 240.306 2.394 20 0 BEADLO CC(F)(F)CC(=O)Nc1c[nH+]c2n1CCCC2 ZINC000334669176 354409266 /nfs/dbraw/zinc/40/92/66/354409266.db2.gz UENMMJXDVZPNGR-UHFFFAOYSA-N 1 2 243.257 2.203 20 0 BEADLO Cn1c[nH+]cc1CNc1ccc2c(c1)CCC2=O ZINC000334671202 354412683 /nfs/dbraw/zinc/41/26/83/354412683.db2.gz SLMCCROZFSKUSU-UHFFFAOYSA-N 1 2 241.294 2.161 20 0 BEADLO CC(=O)c1ccn(Cc2ccc(C)[nH+]c2C)n1 ZINC000334673077 354415317 /nfs/dbraw/zinc/41/53/17/354415317.db2.gz QFJFWWBDMUIKPD-UHFFFAOYSA-N 1 2 229.283 2.146 20 0 BEADLO Cc1cc(C)c(CNC(=O)N2CC[C@H](C)C2)c[nH+]1 ZINC000334680968 354427463 /nfs/dbraw/zinc/42/74/63/354427463.db2.gz LEPURYZRFHMERD-JTQLQIEISA-N 1 2 247.342 2.250 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)n1 ZINC000334683874 354429465 /nfs/dbraw/zinc/42/94/65/354429465.db2.gz OBQCBMLBDIDCLU-VIFPVBQESA-N 1 2 241.285 2.262 20 0 BEADLO Cc1ccnc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)n1 ZINC000334683874 354429470 /nfs/dbraw/zinc/42/94/70/354429470.db2.gz OBQCBMLBDIDCLU-VIFPVBQESA-N 1 2 241.285 2.262 20 0 BEADLO Cn1c[nH+]cc1Cc1nc(-c2ccsc2)no1 ZINC000349651847 366209009 /nfs/dbraw/zinc/20/90/09/366209009.db2.gz WKNRFEPHWMISOD-UHFFFAOYSA-N 1 2 246.295 2.122 20 0 BEADLO CCC1(C(=O)Nc2c[nH+]c3n2CCCC3)CC1 ZINC000334651953 354445254 /nfs/dbraw/zinc/44/52/54/354445254.db2.gz HNWHKMJSPLAUGW-UHFFFAOYSA-N 1 2 233.315 2.348 20 0 BEADLO O=C(Nc1c[nH+]c2n1CCCC2)[C@@H]1C[C@@H]1C1CC1 ZINC000334655610 354449477 /nfs/dbraw/zinc/44/94/77/354449477.db2.gz VASOAIYTXHTTKL-GHMZBOCLSA-N 1 2 245.326 2.204 20 0 BEADLO FC(F)(F)[C@@H]([NH2+]CCC[C@@H]1CCO1)C1CC1 ZINC000639189369 354452065 /nfs/dbraw/zinc/45/20/65/354452065.db2.gz XVBRGMZYNSKNFW-ZJUUUORDSA-N 1 2 237.265 2.486 20 0 BEADLO C[C@H]1CCC[C@@]1(C)C(=O)N1CCn2c[nH+]cc2C1 ZINC000334662064 354461818 /nfs/dbraw/zinc/46/18/18/354461818.db2.gz UFTFHBBXSOKHBJ-SMDDNHRTSA-N 1 2 247.342 2.052 20 0 BEADLO CC(=O)c1cccc(C[N@H+]2CCN(C)C[C@@H]2C)c1 ZINC000334664621 354465845 /nfs/dbraw/zinc/46/58/45/354465845.db2.gz VNJRHEJPCZVUIL-LBPRGKRZSA-N 1 2 246.354 2.025 20 0 BEADLO CC(=O)c1cccc(C[N@@H+]2CCN(C)C[C@@H]2C)c1 ZINC000334664621 354465848 /nfs/dbraw/zinc/46/58/48/354465848.db2.gz VNJRHEJPCZVUIL-LBPRGKRZSA-N 1 2 246.354 2.025 20 0 BEADLO CC(C)=CCNC(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000334694747 354485528 /nfs/dbraw/zinc/48/55/28/354485528.db2.gz BHRXJSCRPHNUMT-QWRGUYRKSA-N 1 2 248.330 2.154 20 0 BEADLO Cc1nnc(C[N@H+]2CCS[C@@H](C)[C@H]2C)s1 ZINC000334750373 354475515 /nfs/dbraw/zinc/47/55/15/354475515.db2.gz VOZTWJCYGDGBCN-SFYZADRCSA-N 1 2 243.401 2.172 20 0 BEADLO Cc1nnc(C[N@@H+]2CCS[C@@H](C)[C@H]2C)s1 ZINC000334750373 354475517 /nfs/dbraw/zinc/47/55/17/354475517.db2.gz VOZTWJCYGDGBCN-SFYZADRCSA-N 1 2 243.401 2.172 20 0 BEADLO COC(=O)C[N@@H+]1Cc2sccc2CC1(C)C ZINC000334738898 354542262 /nfs/dbraw/zinc/54/22/62/354542262.db2.gz BHVGEHITYQLLGS-UHFFFAOYSA-N 1 2 239.340 2.058 20 0 BEADLO COC(=O)C[N@H+]1Cc2sccc2CC1(C)C ZINC000334738898 354542264 /nfs/dbraw/zinc/54/22/64/354542264.db2.gz BHVGEHITYQLLGS-UHFFFAOYSA-N 1 2 239.340 2.058 20 0 BEADLO Cc1cc(N[C@H]2CS[C@H](C)C2)nc(C2CC2)[nH+]1 ZINC000334805624 354562694 /nfs/dbraw/zinc/56/26/94/354562694.db2.gz LFSQBTPLJXMIBO-MWLCHTKSSA-N 1 2 249.383 2.390 20 0 BEADLO OC[C@@]1(F)CC[N@H+](Cc2ccc(Cl)cc2)C1 ZINC000334814198 354571596 /nfs/dbraw/zinc/57/15/96/354571596.db2.gz KSDDAVARCLGKFN-GFCCVEGCSA-N 1 2 243.709 2.246 20 0 BEADLO OC[C@@]1(F)CC[N@@H+](Cc2ccc(Cl)cc2)C1 ZINC000334814198 354571598 /nfs/dbraw/zinc/57/15/98/354571598.db2.gz KSDDAVARCLGKFN-GFCCVEGCSA-N 1 2 243.709 2.246 20 0 BEADLO C[C@H]1CCCN(C(=O)[C@@H]2CCCc3[nH+]c[nH]c32)C1 ZINC000334761995 354582394 /nfs/dbraw/zinc/58/23/94/354582394.db2.gz DAHLBGUJISTYFA-WDEREUQCSA-N 1 2 247.342 2.088 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H](C)C1CCC1 ZINC000334769469 354590997 /nfs/dbraw/zinc/59/09/97/354590997.db2.gz GVARQOIOQHAXTD-JTQLQIEISA-N 1 2 218.300 2.187 20 0 BEADLO C[C@H]1C[C@H](NC(=O)c2ccccc2)c2[nH+]ccn21 ZINC000334743796 354547653 /nfs/dbraw/zinc/54/76/53/354547653.db2.gz NCORHMMVNKMWFP-JQWIXIFHSA-N 1 2 241.294 2.319 20 0 BEADLO CC1CC[NH+](Cc2nc(C(F)F)no2)CC1 ZINC000335097292 354637632 /nfs/dbraw/zinc/63/76/32/354637632.db2.gz BLUFRTUQBHQDAQ-UHFFFAOYSA-N 1 2 231.246 2.239 20 0 BEADLO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccn[nH]1)CC2 ZINC000113310653 354653433 /nfs/dbraw/zinc/65/34/33/354653433.db2.gz RAUSRQJIYJCSEB-AWEZNQCLSA-N 1 2 227.311 2.495 20 0 BEADLO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccn[nH]1)CC2 ZINC000113310650 354653452 /nfs/dbraw/zinc/65/34/52/354653452.db2.gz RAUSRQJIYJCSEB-CQSZACIVSA-N 1 2 227.311 2.495 20 0 BEADLO Cc1ccsc1C[N@@H+]1CC[S@](=O)[C@@H](C)C1 ZINC000335085424 354618857 /nfs/dbraw/zinc/61/88/57/354618857.db2.gz LCAKKYAHMNJFBI-BONVTDFDSA-N 1 2 243.397 2.009 20 0 BEADLO Cc1ccsc1C[N@H+]1CC[S@](=O)[C@@H](C)C1 ZINC000335085424 354618859 /nfs/dbraw/zinc/61/88/59/354618859.db2.gz LCAKKYAHMNJFBI-BONVTDFDSA-N 1 2 243.397 2.009 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H]1CCCC[C@@H]1C ZINC000335105584 354690075 /nfs/dbraw/zinc/69/00/75/354690075.db2.gz VPTNXERHVHXQDQ-ONGXEEELSA-N 1 2 235.331 2.161 20 0 BEADLO CCC(CC)CC(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000345682397 354731525 /nfs/dbraw/zinc/73/15/25/354731525.db2.gz XZMKEKMQNFCQIO-LLVKDONJSA-N 1 2 237.347 2.214 20 0 BEADLO Cc1cc(F)c(C[NH+]2CCC(O)CC2)c(F)c1 ZINC000335107338 354692628 /nfs/dbraw/zinc/69/26/28/354692628.db2.gz FASGRUOCAOSKLI-UHFFFAOYSA-N 1 2 241.281 2.230 20 0 BEADLO CC(C)n1cncc1C[N@@H+]1CC[C@H](F)C1 ZINC000335101554 354711828 /nfs/dbraw/zinc/71/18/28/354711828.db2.gz TWWVVKLIITXLIJ-JTQLQIEISA-N 1 2 211.284 2.008 20 0 BEADLO CC(C)n1cncc1C[N@H+]1CC[C@H](F)C1 ZINC000335101554 354711830 /nfs/dbraw/zinc/71/18/30/354711830.db2.gz TWWVVKLIITXLIJ-JTQLQIEISA-N 1 2 211.284 2.008 20 0 BEADLO CCc1cc(NC[C@]2(C)CCCO2)nc[nH+]1 ZINC000087256252 491067157 /nfs/dbraw/zinc/06/71/57/491067157.db2.gz NVFGQLLRGUFYSQ-LBPRGKRZSA-N 1 2 221.304 2.020 20 0 BEADLO CCn1cc(C(=O)Nc2c(C)cc[nH+]c2C)cn1 ZINC000335127127 354771862 /nfs/dbraw/zinc/77/18/62/354771862.db2.gz ARNIAXMKAIZTNZ-UHFFFAOYSA-N 1 2 244.298 2.167 20 0 BEADLO Fc1cccc(C[N@@H+]2CCCOCC2)c1F ZINC000335941143 134016963 /nfs/dbraw/zinc/01/69/63/134016963.db2.gz DGBLCNLGMLWUHU-UHFFFAOYSA-N 1 2 227.254 2.187 20 0 BEADLO Fc1cccc(C[N@H+]2CCCOCC2)c1F ZINC000335941143 134016964 /nfs/dbraw/zinc/01/69/64/134016964.db2.gz DGBLCNLGMLWUHU-UHFFFAOYSA-N 1 2 227.254 2.187 20 0 BEADLO CCc1ccc(C[N@@H+]2CCN(C)CC[C@@H]2C)cn1 ZINC000335134390 354782662 /nfs/dbraw/zinc/78/26/62/354782662.db2.gz YNGNVMYVGYVSCH-ZDUSSCGKSA-N 1 2 247.386 2.170 20 0 BEADLO CCc1ccc(C[N@H+]2CCN(C)CC[C@@H]2C)cn1 ZINC000335134390 354782664 /nfs/dbraw/zinc/78/26/64/354782664.db2.gz YNGNVMYVGYVSCH-ZDUSSCGKSA-N 1 2 247.386 2.170 20 0 BEADLO Cc1cc(C[NH2+][C@H]2CCCc3scnc32)[nH]n1 ZINC000623896626 354792374 /nfs/dbraw/zinc/79/23/74/354792374.db2.gz XFXPMKVOYZYZPT-JTQLQIEISA-N 1 2 248.355 2.342 20 0 BEADLO Cc1ccc(C[N@H+](C2CC2)C2COC2)c(F)c1 ZINC000639216370 354832596 /nfs/dbraw/zinc/83/25/96/354832596.db2.gz VKKBDDKPVUGOTI-UHFFFAOYSA-N 1 2 235.302 2.497 20 0 BEADLO Cc1ccc(C[N@@H+](C2CC2)C2COC2)c(F)c1 ZINC000639216370 354832600 /nfs/dbraw/zinc/83/26/00/354832600.db2.gz VKKBDDKPVUGOTI-UHFFFAOYSA-N 1 2 235.302 2.497 20 0 BEADLO CCc1cnc(C[N@@H+]2C[C@@H]3C[C@H]2CS3)s1 ZINC000335152643 354865164 /nfs/dbraw/zinc/86/51/64/354865164.db2.gz BTNNCQHXGVXGDD-WPRPVWTQSA-N 1 2 240.397 2.395 20 0 BEADLO CCc1cnc(C[N@H+]2C[C@@H]3C[C@H]2CS3)s1 ZINC000335152643 354865170 /nfs/dbraw/zinc/86/51/70/354865170.db2.gz BTNNCQHXGVXGDD-WPRPVWTQSA-N 1 2 240.397 2.395 20 0 BEADLO COC[C@@H](C)Nc1ccc(N2CCCC2)c[nH+]1 ZINC000346413419 354917043 /nfs/dbraw/zinc/91/70/43/354917043.db2.gz DLVOVJXCFRNBBO-LLVKDONJSA-N 1 2 235.331 2.129 20 0 BEADLO C[C@@H](O)C[N@@H+]1Cc2ccc(Cl)cc2C1 ZINC000335170257 354933499 /nfs/dbraw/zinc/93/34/99/354933499.db2.gz SSEQPAISHXUNCK-MRVPVSSYSA-N 1 2 211.692 2.036 20 0 BEADLO C[C@@H](O)C[N@H+]1Cc2ccc(Cl)cc2C1 ZINC000335170257 354933504 /nfs/dbraw/zinc/93/35/04/354933504.db2.gz SSEQPAISHXUNCK-MRVPVSSYSA-N 1 2 211.692 2.036 20 0 BEADLO CCc1cccc(C[N@H+](CC(=O)OC)C2CC2)c1 ZINC000346437460 354936267 /nfs/dbraw/zinc/93/62/67/354936267.db2.gz ORVLGQMUTPZEFS-UHFFFAOYSA-N 1 2 247.338 2.386 20 0 BEADLO CCc1cccc(C[N@@H+](CC(=O)OC)C2CC2)c1 ZINC000346437460 354936270 /nfs/dbraw/zinc/93/62/70/354936270.db2.gz ORVLGQMUTPZEFS-UHFFFAOYSA-N 1 2 247.338 2.386 20 0 BEADLO C[C@H](CNC(=O)[C@@H]1CC[C@@H](C)C1)Cn1cc[nH+]c1 ZINC000346525657 354975284 /nfs/dbraw/zinc/97/52/84/354975284.db2.gz LAYQNEMLEDKZLQ-JHJVBQTASA-N 1 2 249.358 2.072 20 0 BEADLO c1cc(N2CCC23CCC3)nc(C2CC2)[nH+]1 ZINC000335199379 355032423 /nfs/dbraw/zinc/03/24/23/355032423.db2.gz KDZGKJIAFIBLTM-UHFFFAOYSA-N 1 2 215.300 2.487 20 0 BEADLO c1c[nH]c([C@H]2CCC[N@H+]2Cc2ncccn2)c1 ZINC000335204587 355039436 /nfs/dbraw/zinc/03/94/36/355039436.db2.gz HJGLBDYMSJWCNR-GFCCVEGCSA-N 1 2 228.299 2.142 20 0 BEADLO c1c[nH]c([C@H]2CCC[N@@H+]2Cc2ncccn2)c1 ZINC000335204587 355039437 /nfs/dbraw/zinc/03/94/37/355039437.db2.gz HJGLBDYMSJWCNR-GFCCVEGCSA-N 1 2 228.299 2.142 20 0 BEADLO CCc1nc(C[N@@H+]2CC(C)(C)C[C@@H]2C)no1 ZINC000335195004 355028352 /nfs/dbraw/zinc/02/83/52/355028352.db2.gz QSDZEGDMICEGHV-VIFPVBQESA-N 1 2 223.320 2.252 20 0 BEADLO CCc1nc(C[N@H+]2CC(C)(C)C[C@@H]2C)no1 ZINC000335195004 355028356 /nfs/dbraw/zinc/02/83/56/355028356.db2.gz QSDZEGDMICEGHV-VIFPVBQESA-N 1 2 223.320 2.252 20 0 BEADLO Cn1c[nH+]cc1CSc1ccccn1 ZINC000335228398 355070082 /nfs/dbraw/zinc/07/00/82/355070082.db2.gz KNBAQEQBCCMIDA-UHFFFAOYSA-N 1 2 205.286 2.107 20 0 BEADLO CC(C)CC1(C(=O)N2CCn3cc[nH+]c3C2)CC1 ZINC000335228596 355070921 /nfs/dbraw/zinc/07/09/21/355070921.db2.gz NGFYCNASVAHHQU-UHFFFAOYSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1nc(C[N@H+]2CC(C)(C)OC[C@@H]2C)oc1C ZINC000335231073 355074374 /nfs/dbraw/zinc/07/43/74/355074374.db2.gz VRYZREYOUKMCPS-VIFPVBQESA-N 1 2 238.331 2.291 20 0 BEADLO Cc1nc(C[N@@H+]2CC(C)(C)OC[C@@H]2C)oc1C ZINC000335231073 355074377 /nfs/dbraw/zinc/07/43/77/355074377.db2.gz VRYZREYOUKMCPS-VIFPVBQESA-N 1 2 238.331 2.291 20 0 BEADLO Cc1ncc([C@H](C)[N@@H+]2CC[C@H](F)C2)c(C)n1 ZINC000639228420 355105202 /nfs/dbraw/zinc/10/52/02/355105202.db2.gz OJVJRECQCDUFFT-ONGXEEELSA-N 1 2 223.295 2.198 20 0 BEADLO Cc1ncc([C@H](C)[N@H+]2CC[C@H](F)C2)c(C)n1 ZINC000639228420 355105204 /nfs/dbraw/zinc/10/52/04/355105204.db2.gz OJVJRECQCDUFFT-ONGXEEELSA-N 1 2 223.295 2.198 20 0 BEADLO C[C@H](N[C@@H]1CCC[N@H+](C)[C@H]1C)c1ccccn1 ZINC000346785805 355116882 /nfs/dbraw/zinc/11/68/82/355116882.db2.gz AGSUZNQUJLCDJJ-SGMGOOAPSA-N 1 2 233.359 2.215 20 0 BEADLO C[C@H](N[C@@H]1CCC[N@@H+](C)[C@H]1C)c1ccccn1 ZINC000346785805 355116883 /nfs/dbraw/zinc/11/68/83/355116883.db2.gz AGSUZNQUJLCDJJ-SGMGOOAPSA-N 1 2 233.359 2.215 20 0 BEADLO Cc1cc(NC(=O)N(C)[C@@H]2CC[C@H](C)C2)cc[nH+]1 ZINC000335231525 355091651 /nfs/dbraw/zinc/09/16/51/355091651.db2.gz RFFDCPYESXFGCK-GXFFZTMASA-N 1 2 247.342 2.464 20 0 BEADLO Cc1nocc1C[NH2+]Cc1cc(C2CC2)no1 ZINC000639227798 355091869 /nfs/dbraw/zinc/09/18/69/355091869.db2.gz OMPNSYNOMYAUIA-UHFFFAOYSA-N 1 2 233.271 2.138 20 0 BEADLO F[C@H]1CC[N@H+](Cc2ccnn2CC2CCC2)C1 ZINC000639227854 355092957 /nfs/dbraw/zinc/09/29/57/355092957.db2.gz MBUSHYKQXPUOOL-LBPRGKRZSA-N 1 2 237.322 2.227 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2ccnn2CC2CCC2)C1 ZINC000639227854 355092959 /nfs/dbraw/zinc/09/29/59/355092959.db2.gz MBUSHYKQXPUOOL-LBPRGKRZSA-N 1 2 237.322 2.227 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc(F)cn2)[C@@H](C)[C@H](C)O1 ZINC000346971237 355207466 /nfs/dbraw/zinc/20/74/66/355207466.db2.gz GNEDWXOCGMNKMK-VWYCJHECSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc(F)cn2)[C@@H](C)[C@H](C)O1 ZINC000346971237 355207467 /nfs/dbraw/zinc/20/74/67/355207467.db2.gz GNEDWXOCGMNKMK-VWYCJHECSA-N 1 2 238.306 2.218 20 0 BEADLO c1cnc(C[N@@H+]2CCC[C@@H]2c2cccnc2)nc1 ZINC000346991409 355190344 /nfs/dbraw/zinc/19/03/44/355190344.db2.gz UOXXAZZWDFUNCL-CYBMUJFWSA-N 1 2 240.310 2.209 20 0 BEADLO c1cnc(C[N@H+]2CCC[C@@H]2c2cccnc2)nc1 ZINC000346991409 355190345 /nfs/dbraw/zinc/19/03/45/355190345.db2.gz UOXXAZZWDFUNCL-CYBMUJFWSA-N 1 2 240.310 2.209 20 0 BEADLO CC1(CNc2cc(NC3CC3)nc[nH+]2)CC1 ZINC000413171600 191361674 /nfs/dbraw/zinc/36/16/74/191361674.db2.gz MTXXHNJOGCJMBQ-UHFFFAOYSA-N 1 2 218.304 2.263 20 0 BEADLO CC1(CNc2cc(NC3CC3)[nH+]cn2)CC1 ZINC000413171600 191361677 /nfs/dbraw/zinc/36/16/77/191361677.db2.gz MTXXHNJOGCJMBQ-UHFFFAOYSA-N 1 2 218.304 2.263 20 0 BEADLO C[C@H]1C[C@H](C)N(c2cc(NC3CC3)[nH+]cn2)C1 ZINC000413157544 191356809 /nfs/dbraw/zinc/35/68/09/191356809.db2.gz UNHPRXMFLKZTNM-UWVGGRQHSA-N 1 2 232.331 2.286 20 0 BEADLO C[C@H]1C[C@H](C)N(c2cc(NC3CC3)nc[nH+]2)C1 ZINC000413157544 191356811 /nfs/dbraw/zinc/35/68/11/191356811.db2.gz UNHPRXMFLKZTNM-UWVGGRQHSA-N 1 2 232.331 2.286 20 0 BEADLO C[C@@H]1CCN(c2cc(NC3CC3)[nH+]cn2)[C@H]1C ZINC000413163308 191360292 /nfs/dbraw/zinc/36/02/92/191360292.db2.gz AVNPDRJHPCQJSJ-ZJUUUORDSA-N 1 2 232.331 2.286 20 0 BEADLO C[C@@H]1CCN(c2cc(NC3CC3)nc[nH+]2)[C@H]1C ZINC000413163308 191360293 /nfs/dbraw/zinc/36/02/93/191360293.db2.gz AVNPDRJHPCQJSJ-ZJUUUORDSA-N 1 2 232.331 2.286 20 0 BEADLO C[C@@H]1CCCCN1c1cc(NC2CC2)[nH+]cn1 ZINC000413022751 191343881 /nfs/dbraw/zinc/34/38/81/191343881.db2.gz FWOIYADXNJJUAK-SNVBAGLBSA-N 1 2 232.331 2.430 20 0 BEADLO C[C@@H]1CCCCN1c1cc(NC2CC2)nc[nH+]1 ZINC000413022751 191343883 /nfs/dbraw/zinc/34/38/83/191343883.db2.gz FWOIYADXNJJUAK-SNVBAGLBSA-N 1 2 232.331 2.430 20 0 BEADLO Cc1nc(N[C@H]2CCC[C@@H]3C[C@@H]32)cc[nH+]1 ZINC000413466631 191382982 /nfs/dbraw/zinc/38/29/82/191382982.db2.gz YGZNAHJLACVEEW-VWYCJHECSA-N 1 2 203.289 2.386 20 0 BEADLO CC[C@@H]1OCC[C@H]1Nc1cc(C)[nH+]c(C(C)C)n1 ZINC000413444937 191384102 /nfs/dbraw/zinc/38/41/02/191384102.db2.gz GOJYIJLGVTXLQW-NEPJUHHUSA-N 1 2 249.358 2.310 20 0 BEADLO Cc1nc(NC[C@@H]2CCC[C@@H]2C2CC2)cc[nH+]1 ZINC000413481662 191387733 /nfs/dbraw/zinc/38/77/33/191387733.db2.gz NXKMTPJTIQRAHC-QWHCGFSZSA-N 1 2 231.343 2.445 20 0 BEADLO C[N@@H+](Cc1ccn(C(F)F)n1)Cc1ccc[nH]1 ZINC000347683226 355267727 /nfs/dbraw/zinc/26/77/27/355267727.db2.gz MVTDVVXJBZVPJZ-UHFFFAOYSA-N 1 2 240.257 2.238 20 0 BEADLO C[N@H+](Cc1ccn(C(F)F)n1)Cc1ccc[nH]1 ZINC000347683226 355267730 /nfs/dbraw/zinc/26/77/30/355267730.db2.gz MVTDVVXJBZVPJZ-UHFFFAOYSA-N 1 2 240.257 2.238 20 0 BEADLO CO[C@@](C)([C@@H](C)Nc1cc(C)[nH+]cn1)C1CC1 ZINC000413524981 191392690 /nfs/dbraw/zinc/39/26/90/191392690.db2.gz XKLTWNPHMJDCIA-MFKMUULPSA-N 1 2 235.331 2.401 20 0 BEADLO FC1=CCCN(c2cc(NC3CC3)[nH+]cn2)C1 ZINC000413237423 191365853 /nfs/dbraw/zinc/36/58/53/191365853.db2.gz PCCUKDKRAIEYRY-UHFFFAOYSA-N 1 2 234.278 2.114 20 0 BEADLO FC1=CCCN(c2cc(NC3CC3)nc[nH+]2)C1 ZINC000413237423 191365854 /nfs/dbraw/zinc/36/58/54/191365854.db2.gz PCCUKDKRAIEYRY-UHFFFAOYSA-N 1 2 234.278 2.114 20 0 BEADLO Cc1nc(NCCC2CC(F)(F)C2)cc[nH+]1 ZINC000413340721 191372852 /nfs/dbraw/zinc/37/28/52/191372852.db2.gz MFGAUPAVHFUGOA-UHFFFAOYSA-N 1 2 227.258 2.054 20 0 BEADLO CCOC[C@H]1CCCCN1c1cc(C)[nH+]cn1 ZINC000413421987 191379697 /nfs/dbraw/zinc/37/96/97/191379697.db2.gz CAAPVFDWTMYLSF-GFCCVEGCSA-N 1 2 235.331 2.180 20 0 BEADLO c1cc(C[NH2+][C@@H]2CCCc3cn[nH]c32)sn1 ZINC000623225483 355288680 /nfs/dbraw/zinc/28/86/80/355288680.db2.gz SVDFZVIDGRJBDV-SNVBAGLBSA-N 1 2 234.328 2.033 20 0 BEADLO c1cc(C[NH2+][C@@H]2CCCc3c[nH]nc32)sn1 ZINC000623225483 355288683 /nfs/dbraw/zinc/28/86/83/355288683.db2.gz SVDFZVIDGRJBDV-SNVBAGLBSA-N 1 2 234.328 2.033 20 0 BEADLO FC1CC2(C1)C[NH+](Cc1ccns1)C2 ZINC000639252525 355288813 /nfs/dbraw/zinc/28/88/13/355288813.db2.gz IWSIVQABOLZVKZ-UHFFFAOYSA-N 1 2 212.293 2.077 20 0 BEADLO Cc1cccc2[nH]c(C[NH+]3CC(C)(O)C3)cc21 ZINC000639253498 355291219 /nfs/dbraw/zinc/29/12/19/355291219.db2.gz HSGUHSMILFYLMO-UHFFFAOYSA-N 1 2 230.311 2.043 20 0 BEADLO CCCc1ccc(C[NH+]2CC(C)(O)C2)s1 ZINC000639253533 355291233 /nfs/dbraw/zinc/29/12/33/355291233.db2.gz JKMQWMCXJMDNLX-UHFFFAOYSA-N 1 2 225.357 2.267 20 0 BEADLO COCC1(C)C[NH+](Cc2cc(C3CC3)no2)C1 ZINC000639255708 355296539 /nfs/dbraw/zinc/29/65/39/355296539.db2.gz XGORGRSQWBCAOL-UHFFFAOYSA-N 1 2 236.315 2.020 20 0 BEADLO COc1ccc[nH+]c1N[C@H](C)[C@@H]1CCCOC1 ZINC000388856711 355301818 /nfs/dbraw/zinc/30/18/18/355301818.db2.gz GRVXFGGBPBVBDB-GHMZBOCLSA-N 1 2 236.315 2.317 20 0 BEADLO Cc1ncc(C[NH2+]Cc2cc(C3CC3)no2)o1 ZINC000639257073 355302010 /nfs/dbraw/zinc/30/20/10/355302010.db2.gz ISJAZDHNPNTCKD-UHFFFAOYSA-N 1 2 233.271 2.138 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ccn(C)n2)sn1 ZINC000639258480 355306481 /nfs/dbraw/zinc/30/64/81/355306481.db2.gz BCFGEJJEYPMUIB-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@@H](CF)C2)c(F)c1 ZINC000639261868 355314807 /nfs/dbraw/zinc/31/48/07/355314807.db2.gz SPEIZRPFUUZDER-LBPRGKRZSA-N 1 2 241.281 2.304 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@@H](CF)C2)c(F)c1 ZINC000639261868 355314811 /nfs/dbraw/zinc/31/48/11/355314811.db2.gz SPEIZRPFUUZDER-LBPRGKRZSA-N 1 2 241.281 2.304 20 0 BEADLO CC(C)[N@H+](Cc1cnc[nH]1)Cc1cccnc1 ZINC000349241909 355373754 /nfs/dbraw/zinc/37/37/54/355373754.db2.gz LAWFVBUYUYPOEL-UHFFFAOYSA-N 1 2 230.315 2.215 20 0 BEADLO CC(C)[N@@H+](Cc1cnc[nH]1)Cc1cccnc1 ZINC000349241909 355373758 /nfs/dbraw/zinc/37/37/58/355373758.db2.gz LAWFVBUYUYPOEL-UHFFFAOYSA-N 1 2 230.315 2.215 20 0 BEADLO CC(C)[N@H+](Cc1c[nH]cn1)Cc1cccnc1 ZINC000349241909 355373760 /nfs/dbraw/zinc/37/37/60/355373760.db2.gz LAWFVBUYUYPOEL-UHFFFAOYSA-N 1 2 230.315 2.215 20 0 BEADLO CC(C)[N@@H+](Cc1c[nH]cn1)Cc1cccnc1 ZINC000349241909 355373764 /nfs/dbraw/zinc/37/37/64/355373764.db2.gz LAWFVBUYUYPOEL-UHFFFAOYSA-N 1 2 230.315 2.215 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)[C@H]1CCCS1 ZINC000608363940 355379252 /nfs/dbraw/zinc/37/92/52/355379252.db2.gz KGAFXBZCMZLNAX-SNVBAGLBSA-N 1 2 247.323 2.168 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000335740264 355389931 /nfs/dbraw/zinc/38/99/31/355389931.db2.gz ZUMFRCZMTLLBNK-WPRPVWTQSA-N 1 2 247.264 2.491 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000335740264 355389933 /nfs/dbraw/zinc/38/99/33/355389933.db2.gz ZUMFRCZMTLLBNK-WPRPVWTQSA-N 1 2 247.264 2.491 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1C[C@H](C)C[C@H](C)C1 ZINC000583508468 355346146 /nfs/dbraw/zinc/34/61/46/355346146.db2.gz LGMJBJLMNZISCE-GRYCIOLGSA-N 1 2 249.358 2.093 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1C[C@H](C)C[C@H](C)C1 ZINC000583508468 355346149 /nfs/dbraw/zinc/34/61/49/355346149.db2.gz LGMJBJLMNZISCE-GRYCIOLGSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1nn(C)cc1[C@H](C)[NH2+][C@@H](C)c1ccon1 ZINC000349857043 355501978 /nfs/dbraw/zinc/50/19/78/355501978.db2.gz ITWWNASFYVXQIC-WPRPVWTQSA-N 1 2 234.303 2.128 20 0 BEADLO CC(C)c1nc(C[N@@H+]2C[C@@H](C)C[C@@H]2C)no1 ZINC000335805979 355476740 /nfs/dbraw/zinc/47/67/40/355476740.db2.gz JJUMMLOLOQDHHP-UWVGGRQHSA-N 1 2 223.320 2.423 20 0 BEADLO CC(C)c1nc(C[N@H+]2C[C@@H](C)C[C@@H]2C)no1 ZINC000335805979 355476744 /nfs/dbraw/zinc/47/67/44/355476744.db2.gz JJUMMLOLOQDHHP-UWVGGRQHSA-N 1 2 223.320 2.423 20 0 BEADLO Cc1ncc([C@H](C)[NH2+][C@H](C)c2ccon2)c(C)n1 ZINC000349833926 355489070 /nfs/dbraw/zinc/48/90/70/355489070.db2.gz MIULMHJNJNETOG-WCBMZHEXSA-N 1 2 246.314 2.493 20 0 BEADLO CC[C@@H]([NH2+][C@@H](C)c1ccon1)c1ccn(C)n1 ZINC000349836346 355490159 /nfs/dbraw/zinc/49/01/59/355490159.db2.gz RXBHYDYWZOAALB-VHSXEESVSA-N 1 2 234.303 2.210 20 0 BEADLO C[NH2+]Cc1noc([C@H](C)c2cccc(C)c2)n1 ZINC000349900676 355522155 /nfs/dbraw/zinc/52/21/55/355522155.db2.gz ZSXVITVHQBAARW-SNVBAGLBSA-N 1 2 231.299 2.249 20 0 BEADLO CN(C(=O)c1ccc2[nH+]ccn2c1)[C@H]1CC1(C)C ZINC000335840724 355583816 /nfs/dbraw/zinc/58/38/16/355583816.db2.gz VKRNRJSFBCUFKL-NSHDSACASA-N 1 2 243.310 2.205 20 0 BEADLO c1cc2cc(NC[C@@H]3C[C@H]4C[C@H]4C3)[nH+]cc2[nH]1 ZINC000639296222 355593116 /nfs/dbraw/zinc/59/31/16/355593116.db2.gz MTNAGENGNMQKIM-YHPBZONMSA-N 1 2 227.311 2.443 20 0 BEADLO Cc1cc(C(=O)Nc2ccn3cc[nH+]c3c2)co1 ZINC000350144285 355614294 /nfs/dbraw/zinc/61/42/94/355614294.db2.gz CRRWALOXXSBIQW-UHFFFAOYSA-N 1 2 241.250 2.488 20 0 BEADLO Cc1cc(C(=O)N2CCC[C@@H]2c2[nH]cc[nH+]2)co1 ZINC000335875877 355645040 /nfs/dbraw/zinc/64/50/40/355645040.db2.gz HQQGTRNFMRNOHK-LLVKDONJSA-N 1 2 245.282 2.288 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)C1=CCCCCC1 ZINC000335861388 355623787 /nfs/dbraw/zinc/62/37/87/355623787.db2.gz ULYXTVQTVXBLIR-UHFFFAOYSA-N 1 2 233.315 2.259 20 0 BEADLO Nc1c(F)cccc1C[N@@H+]1CCC[C@@H](F)C1 ZINC000639312899 355684109 /nfs/dbraw/zinc/68/41/09/355684109.db2.gz KQXRRHKVGRUGIG-SNVBAGLBSA-N 1 2 226.270 2.342 20 0 BEADLO Nc1c(F)cccc1C[N@H+]1CCC[C@@H](F)C1 ZINC000639312899 355684114 /nfs/dbraw/zinc/68/41/14/355684114.db2.gz KQXRRHKVGRUGIG-SNVBAGLBSA-N 1 2 226.270 2.342 20 0 BEADLO C[C@@H]([NH2+]Cc1cc(C2CC2)no1)c1nccn1C ZINC000639328722 355741300 /nfs/dbraw/zinc/74/13/00/355741300.db2.gz YKAPXDVBJPALEI-SECBINFHSA-N 1 2 246.314 2.136 20 0 BEADLO C[C@@H](NCc1cc(C2CC2)no1)c1[nH+]ccn1C ZINC000639328722 355741305 /nfs/dbraw/zinc/74/13/05/355741305.db2.gz YKAPXDVBJPALEI-SECBINFHSA-N 1 2 246.314 2.136 20 0 BEADLO Cc1nocc1C[N@H+](C)CCC(F)(F)F ZINC000350704066 355744869 /nfs/dbraw/zinc/74/48/69/355744869.db2.gz WXPRMUHOHXFAPX-UHFFFAOYSA-N 1 2 222.210 2.367 20 0 BEADLO Cc1nocc1C[N@@H+](C)CCC(F)(F)F ZINC000350704066 355744871 /nfs/dbraw/zinc/74/48/71/355744871.db2.gz WXPRMUHOHXFAPX-UHFFFAOYSA-N 1 2 222.210 2.367 20 0 BEADLO CC(C)n1ncnc1C[NH+]1CC(CC2CC2)C1 ZINC000639341154 355782885 /nfs/dbraw/zinc/78/28/85/355782885.db2.gz OXBVGQHUDLYSTQ-UHFFFAOYSA-N 1 2 234.347 2.091 20 0 BEADLO c1coc(C2=CCC[N@@H+](Cc3ncccn3)C2)c1 ZINC000336023144 134056551 /nfs/dbraw/zinc/05/65/51/134056551.db2.gz TWCCIUVKHZRXJG-UHFFFAOYSA-N 1 2 241.294 2.359 20 0 BEADLO c1coc(C2=CCC[N@H+](Cc3ncccn3)C2)c1 ZINC000336023144 134056552 /nfs/dbraw/zinc/05/65/52/134056552.db2.gz TWCCIUVKHZRXJG-UHFFFAOYSA-N 1 2 241.294 2.359 20 0 BEADLO CN(C)c1c[nH+]cc(NCCC2CCOCC2)c1 ZINC000639363493 355824985 /nfs/dbraw/zinc/82/49/85/355824985.db2.gz CGOMCDKYLVONFE-UHFFFAOYSA-N 1 2 249.358 2.376 20 0 BEADLO Cc1ccc(C[NH+]2CC3(C2)CCCO3)c(F)c1 ZINC000639345875 355792633 /nfs/dbraw/zinc/79/26/33/355792633.db2.gz CCNHEZGCRSQHGX-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@H](CCF)C2)sn1 ZINC000639352362 355801510 /nfs/dbraw/zinc/80/15/10/355801510.db2.gz INKILBMQLZAPFW-SNVBAGLBSA-N 1 2 244.335 2.012 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@H](CCF)C2)sn1 ZINC000639352362 355801513 /nfs/dbraw/zinc/80/15/13/355801513.db2.gz INKILBMQLZAPFW-SNVBAGLBSA-N 1 2 244.335 2.012 20 0 BEADLO Cc1cn[nH]c1C[NH+]1CC(c2ccccc2)C1 ZINC000639361507 355815256 /nfs/dbraw/zinc/81/52/56/355815256.db2.gz FKHWHLBOZYHCDK-UHFFFAOYSA-N 1 2 227.311 2.318 20 0 BEADLO CN(C)c1c[nH+]cc(N[C@H]2CCSC2)c1 ZINC000639364731 355836761 /nfs/dbraw/zinc/83/67/61/355836761.db2.gz IPNBZWOFPBYQAA-VIFPVBQESA-N 1 2 223.345 2.065 20 0 BEADLO CN(C)c1c[nH+]cc(NCc2ccns2)c1 ZINC000639365475 355838306 /nfs/dbraw/zinc/83/83/06/355838306.db2.gz OXLBLPCZJZSTEP-UHFFFAOYSA-N 1 2 234.328 2.216 20 0 BEADLO CC(C)Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC000301867065 535292751 /nfs/dbraw/zinc/29/27/51/535292751.db2.gz GIQFWLOUSSWUEI-UHFFFAOYSA-N 1 2 233.319 2.402 20 0 BEADLO C[C@@H]1CSC[C@H]1Nc1c[nH+]cc(N(C)C)c1 ZINC000639365875 355841229 /nfs/dbraw/zinc/84/12/29/355841229.db2.gz SJUYESWYSYLHDA-BXKDBHETSA-N 1 2 237.372 2.311 20 0 BEADLO CCN(C(=O)CCCn1cc[nH+]c1)C1CCCC1 ZINC000623253633 355846420 /nfs/dbraw/zinc/84/64/20/355846420.db2.gz VEIQSAQFEMBMDT-UHFFFAOYSA-N 1 2 249.358 2.454 20 0 BEADLO CCCC[C@H](C)[C@@H](C)[NH2+]Cc1c[nH]nn1 ZINC000628363807 355850434 /nfs/dbraw/zinc/85/04/34/355850434.db2.gz YHPWVTXHJFDCLW-VHSXEESVSA-N 1 2 210.325 2.109 20 0 BEADLO CCCC[C@H](C)[C@@H](C)[NH2+]Cc1cn[nH]n1 ZINC000628363807 355850436 /nfs/dbraw/zinc/85/04/36/355850436.db2.gz YHPWVTXHJFDCLW-VHSXEESVSA-N 1 2 210.325 2.109 20 0 BEADLO CCN(CC(C)C)C(=O)CCCn1cc[nH+]c1 ZINC000623254861 355856374 /nfs/dbraw/zinc/85/63/74/355856374.db2.gz HYKFOLDFMOBGGQ-UHFFFAOYSA-N 1 2 237.347 2.168 20 0 BEADLO CC(C)(C)c1nc(C[NH2+]C2(C)COC2)cs1 ZINC000639382084 355926182 /nfs/dbraw/zinc/92/61/82/355926182.db2.gz LPPWPNQTHJXTRA-UHFFFAOYSA-N 1 2 240.372 2.319 20 0 BEADLO Cc1nnsc1C[N@@H+](C)Cc1ccccc1 ZINC000582219454 355957916 /nfs/dbraw/zinc/95/79/16/355957916.db2.gz MBVZDMMGBUREBN-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1nnsc1C[N@H+](C)Cc1ccccc1 ZINC000582219454 355957921 /nfs/dbraw/zinc/95/79/21/355957921.db2.gz MBVZDMMGBUREBN-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1sccc1C[N@H+](C)Cc1cc[nH]n1 ZINC000351562401 356017805 /nfs/dbraw/zinc/01/78/05/356017805.db2.gz AUEXUWJKNJUHGF-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1sccc1C[N@@H+](C)Cc1cc[nH]n1 ZINC000351562401 356017808 /nfs/dbraw/zinc/01/78/08/356017808.db2.gz AUEXUWJKNJUHGF-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO CCC(C)(C)[C@H](C)NC(=O)C[NH+]1CC(C)(C)C1 ZINC000617567586 356122142 /nfs/dbraw/zinc/12/21/42/356122142.db2.gz LPYVMRCPQBETFC-NSHDSACASA-N 1 2 240.391 2.269 20 0 BEADLO Cc1occc1C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000335914792 356152346 /nfs/dbraw/zinc/15/23/46/356152346.db2.gz NQQJSBKXRZONLU-NSHDSACASA-N 1 2 245.282 2.288 20 0 BEADLO Cn1c2ccccc2nc1C[NH+]1CC(C)(C)C1 ZINC000639402368 356176248 /nfs/dbraw/zinc/17/62/48/356176248.db2.gz CARWSNLWOONOGY-UHFFFAOYSA-N 1 2 229.327 2.415 20 0 BEADLO CCC(C)(C)[C@H](C)NC(=O)c1c[nH+]c(C)[nH]1 ZINC000617571585 356134907 /nfs/dbraw/zinc/13/49/07/356134907.db2.gz PVXYJBHXQHZCJB-QMMMGPOBSA-N 1 2 223.320 2.273 20 0 BEADLO C[C@@H](C(N)=O)[N@H+]1CC=C(C(F)(F)F)CC1 ZINC000335913318 356142496 /nfs/dbraw/zinc/14/24/96/356142496.db2.gz GXHQZWREGWQACR-LURJTMIESA-N 1 2 222.210 2.105 20 0 BEADLO C[C@@H](C(N)=O)[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000335913318 356142499 /nfs/dbraw/zinc/14/24/99/356142499.db2.gz GXHQZWREGWQACR-LURJTMIESA-N 1 2 222.210 2.105 20 0 BEADLO Fc1ccccc1C[N@@H+]1CCO[C@H](C2CC2)C1 ZINC000336088342 134077512 /nfs/dbraw/zinc/07/75/12/134077512.db2.gz JJCSHRQFTIQKBO-AWEZNQCLSA-N 1 2 235.302 2.437 20 0 BEADLO Fc1ccccc1C[N@H+]1CCO[C@H](C2CC2)C1 ZINC000336088342 134077513 /nfs/dbraw/zinc/07/75/13/134077513.db2.gz JJCSHRQFTIQKBO-AWEZNQCLSA-N 1 2 235.302 2.437 20 0 BEADLO CC[C@@H]1CCC[C@@H]1c1nc(C[NH2+]C)no1 ZINC000332365738 356213673 /nfs/dbraw/zinc/21/36/73/356213673.db2.gz KOKUJKBYFWIHAB-BDAKNGLRSA-N 1 2 209.293 2.083 20 0 BEADLO Cc1cc(C[N@H+](C)C[C@H]2CC(C)(C)CO2)no1 ZINC000639450708 356235802 /nfs/dbraw/zinc/23/58/02/356235802.db2.gz YBDKXSWVBBEXAB-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cc(C[N@@H+](C)C[C@H]2CC(C)(C)CO2)no1 ZINC000639450708 356235804 /nfs/dbraw/zinc/23/58/04/356235804.db2.gz YBDKXSWVBBEXAB-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO CC[C@@H](C)CCNC(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000617640781 356253290 /nfs/dbraw/zinc/25/32/90/356253290.db2.gz CGSMKDFUAYNHQF-IJLUTSLNSA-N 1 2 249.358 2.076 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCC[C@@H](OC)C1 ZINC000639473818 356266749 /nfs/dbraw/zinc/26/67/49/356266749.db2.gz OPHWWGGPVKFJGE-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CCC(F)(F)C[N@H+]1CCC[C@@H](OC)C1 ZINC000639473818 356266750 /nfs/dbraw/zinc/26/67/50/356266750.db2.gz OPHWWGGPVKFJGE-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO C[C@H]1C[C@H](CNC(=O)Cn2cc[nH+]c2)C[C@@H](C)C1 ZINC000617667310 356268515 /nfs/dbraw/zinc/26/85/15/356268515.db2.gz ZWPDEHDHJRURHS-ITGUQSILSA-N 1 2 249.358 2.072 20 0 BEADLO C[N@@H+](Cc1cscn1)C[C@@H]1CC(C)(C)CO1 ZINC000639460255 356248273 /nfs/dbraw/zinc/24/82/73/356248273.db2.gz HIJQFFCEFZGOMC-NSHDSACASA-N 1 2 240.372 2.390 20 0 BEADLO C[N@H+](Cc1cscn1)C[C@@H]1CC(C)(C)CO1 ZINC000639460255 356248274 /nfs/dbraw/zinc/24/82/74/356248274.db2.gz HIJQFFCEFZGOMC-NSHDSACASA-N 1 2 240.372 2.390 20 0 BEADLO CC(C)(C)CCCC(=O)N[C@@H]1Cc2c[nH+]cn2C1 ZINC000623267408 356326039 /nfs/dbraw/zinc/32/60/39/356326039.db2.gz QUKSUZOJZQHJEQ-LLVKDONJSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2CCSC(C)(C)C2)no1 ZINC000336122372 134091721 /nfs/dbraw/zinc/09/17/21/134091721.db2.gz XNHZYVLNDISKEP-MRVPVSSYSA-N 1 2 241.360 2.266 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2CCSC(C)(C)C2)no1 ZINC000336122372 134091722 /nfs/dbraw/zinc/09/17/22/134091722.db2.gz XNHZYVLNDISKEP-MRVPVSSYSA-N 1 2 241.360 2.266 20 0 BEADLO CCC(F)(F)C[NH+]1CCC(O)(CC)CC1 ZINC000639500926 356327602 /nfs/dbraw/zinc/32/76/02/356327602.db2.gz QTBUGKFOUBATTL-UHFFFAOYSA-N 1 2 221.291 2.269 20 0 BEADLO C[C@@H]1OCC[C@H]1C[N@H+](CC(F)F)C1CC1 ZINC000639483049 356297634 /nfs/dbraw/zinc/29/76/34/356297634.db2.gz PMPXJERCHJIOEU-IUCAKERBSA-N 1 2 219.275 2.141 20 0 BEADLO C[C@@H]1OCC[C@H]1C[N@@H+](CC(F)F)C1CC1 ZINC000639483049 356297636 /nfs/dbraw/zinc/29/76/36/356297636.db2.gz PMPXJERCHJIOEU-IUCAKERBSA-N 1 2 219.275 2.141 20 0 BEADLO CCC(F)(F)C[NH+]1CCC(COC)CC1 ZINC000639487533 356304169 /nfs/dbraw/zinc/30/41/69/356304169.db2.gz NGHPWCUGBOYYSS-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO CCc1[nH+]c(C)ccc1OC[C@H]1CCOC1 ZINC000352537745 356376746 /nfs/dbraw/zinc/37/67/46/356376746.db2.gz ZLVWHARTPFLLMJ-NSHDSACASA-N 1 2 221.300 2.368 20 0 BEADLO CC[C@](C)([NH2+]CC(C)=O)c1nc(C)cs1 ZINC000639535213 356387532 /nfs/dbraw/zinc/38/75/32/356387532.db2.gz FCHDKJZRYDFWKE-NSHDSACASA-N 1 2 226.345 2.255 20 0 BEADLO CC(C)(C)OC(=O)NCCNc1cccc[nH+]1 ZINC000049390636 356422357 /nfs/dbraw/zinc/42/23/57/356422357.db2.gz LNGSPBARAFUWCQ-UHFFFAOYSA-N 1 2 237.303 2.018 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCCOC[C@H]1C ZINC000639543572 356403563 /nfs/dbraw/zinc/40/35/63/356403563.db2.gz KJBDIYAIDJXNCA-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CCC(F)(F)C[N@H+]1CCCOC[C@H]1C ZINC000639543572 356403568 /nfs/dbraw/zinc/40/35/68/356403568.db2.gz KJBDIYAIDJXNCA-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CC[C@@H](C)[C@H](C)NC(=O)CCCn1cc[nH+]c1 ZINC000623280543 356453028 /nfs/dbraw/zinc/45/30/28/356453028.db2.gz AYIRLPZYJQMWFQ-NEPJUHHUSA-N 1 2 237.347 2.214 20 0 BEADLO Cc1cc(N2CC[C@@]23CCOC3)nc(C2CC2)[nH+]1 ZINC000420633913 192252255 /nfs/dbraw/zinc/25/22/55/192252255.db2.gz CNWVTCSNDAEDLI-AWEZNQCLSA-N 1 2 245.326 2.032 20 0 BEADLO CCC(F)(F)C[N@H+](C)C1(COC)CC1 ZINC000639551064 356433628 /nfs/dbraw/zinc/43/36/28/356433628.db2.gz GKQRGBTWURCKSC-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO CCC(F)(F)C[N@@H+](C)C1(COC)CC1 ZINC000639551064 356433630 /nfs/dbraw/zinc/43/36/30/356433630.db2.gz GKQRGBTWURCKSC-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO CC[C@H]1C[C@@H](Nc2cc[nH+]c(C)n2)CCO1 ZINC000420616023 192249362 /nfs/dbraw/zinc/24/93/62/192249362.db2.gz FZDYPHHGLSWYPH-QWRGUYRKSA-N 1 2 221.304 2.155 20 0 BEADLO OC1(CCC[NH+]=c2[nH]c3ccccc3[nH]2)CCC1 ZINC000420644588 192253699 /nfs/dbraw/zinc/25/36/99/192253699.db2.gz VLZKDWMSBOJOGP-UHFFFAOYSA-N 1 2 245.326 2.092 20 0 BEADLO Cc1cc(N2CC[C@]23CCOC3)nc(C(C)C)[nH+]1 ZINC000420646023 192254538 /nfs/dbraw/zinc/25/45/38/192254538.db2.gz VLNLQINMKJOPCC-CQSZACIVSA-N 1 2 247.342 2.278 20 0 BEADLO CC[C@H](C)CNc1[nH+]c(C)nc2[nH]ccc21 ZINC000420652844 192255116 /nfs/dbraw/zinc/25/51/16/192255116.db2.gz NGTCWKLMIUMMHG-QMMMGPOBSA-N 1 2 218.304 2.146 20 0 BEADLO CCC(F)(F)C[N@H+](C)CCOCCCOC ZINC000639562932 356478498 /nfs/dbraw/zinc/47/84/98/356478498.db2.gz ZDSVKWHDTJWWPM-UHFFFAOYSA-N 1 2 239.306 2.017 20 0 BEADLO CCC(F)(F)C[N@@H+](C)CCOCCCOC ZINC000639562932 356478500 /nfs/dbraw/zinc/47/85/00/356478500.db2.gz ZDSVKWHDTJWWPM-UHFFFAOYSA-N 1 2 239.306 2.017 20 0 BEADLO C(c1noc(C[N@@H+]2CCCC3(CC3)C2)n1)C1CC1 ZINC000639588232 356511770 /nfs/dbraw/zinc/51/17/70/356511770.db2.gz AKRAAPPKQCLTNG-UHFFFAOYSA-N 1 2 247.342 2.398 20 0 BEADLO C(c1noc(C[N@H+]2CCCC3(CC3)C2)n1)C1CC1 ZINC000639588232 356511774 /nfs/dbraw/zinc/51/17/74/356511774.db2.gz AKRAAPPKQCLTNG-UHFFFAOYSA-N 1 2 247.342 2.398 20 0 BEADLO Cc1cc(CNC(=O)NC[C@@H]2C[C@H]2C)cc(C)[nH+]1 ZINC000420812046 192262618 /nfs/dbraw/zinc/26/26/18/192262618.db2.gz WTQZRKBMNSWRJK-RNCFNFMXSA-N 1 2 247.342 2.154 20 0 BEADLO Cc1cc(CNC(=O)N(C)CC2CC2)cc(C)[nH+]1 ZINC000420846497 192267181 /nfs/dbraw/zinc/26/71/81/192267181.db2.gz JIQRZGDGDOLHMD-UHFFFAOYSA-N 1 2 247.342 2.250 20 0 BEADLO CCC(F)(F)C[NH+]1CCC(C)(CO)CC1 ZINC000639586029 356503720 /nfs/dbraw/zinc/50/37/20/356503720.db2.gz CKDYZMWHDLVXDR-UHFFFAOYSA-N 1 2 221.291 2.126 20 0 BEADLO CCC[N@H+](Cc1nn(C)cc1Cl)C1CC1 ZINC000420907360 192269287 /nfs/dbraw/zinc/26/92/87/192269287.db2.gz VKZBKKRQTLKILX-UHFFFAOYSA-N 1 2 227.739 2.448 20 0 BEADLO CCC[N@@H+](Cc1nn(C)cc1Cl)C1CC1 ZINC000420907360 192269290 /nfs/dbraw/zinc/26/92/90/192269290.db2.gz VKZBKKRQTLKILX-UHFFFAOYSA-N 1 2 227.739 2.448 20 0 BEADLO CC[N@H+](Cc1nn(C)cc1Cl)C1CCC1 ZINC000420911414 192270474 /nfs/dbraw/zinc/27/04/74/192270474.db2.gz GNBLPJIYQLFYMC-UHFFFAOYSA-N 1 2 227.739 2.448 20 0 BEADLO CC[N@@H+](Cc1nn(C)cc1Cl)C1CCC1 ZINC000420911414 192270476 /nfs/dbraw/zinc/27/04/76/192270476.db2.gz GNBLPJIYQLFYMC-UHFFFAOYSA-N 1 2 227.739 2.448 20 0 BEADLO CC[C@H]1C[NH+](Cc2cc(C)on2)C[C@H](CC)O1 ZINC000420960455 192280902 /nfs/dbraw/zinc/28/09/02/192280902.db2.gz RENZSZPUGLGPIF-STQMWFEESA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1C[NH+](Cc2cnc(C)nc2)C[C@@H](CC)O1 ZINC000420961410 192281645 /nfs/dbraw/zinc/28/16/45/192281645.db2.gz SHFIFLYELOZTID-ZIAGYGMSSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[NH+](Cc2cc(C)on2)C[C@@H](CC)O1 ZINC000420960454 192281652 /nfs/dbraw/zinc/28/16/52/192281652.db2.gz RENZSZPUGLGPIF-CHWSQXEVSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C)on2)C[C@H](CC)O1 ZINC000420960452 192281791 /nfs/dbraw/zinc/28/17/91/192281791.db2.gz RENZSZPUGLGPIF-BETUJISGSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C)on2)C[C@H](CC)O1 ZINC000420960452 192281794 /nfs/dbraw/zinc/28/17/94/192281794.db2.gz RENZSZPUGLGPIF-BETUJISGSA-N 1 2 238.331 2.372 20 0 BEADLO CCC(F)(F)C[NH2+][C@@H]1Cc2cccc(O)c2C1 ZINC000639614259 356531597 /nfs/dbraw/zinc/53/15/97/356531597.db2.gz YNWXDPZULWYWQT-SNVBAGLBSA-N 1 2 241.281 2.494 20 0 BEADLO CCC(F)(F)C[N@H+](CC(C)(C)O)C1CC1 ZINC000639596088 356514926 /nfs/dbraw/zinc/51/49/26/356514926.db2.gz RSOZRVKSAOFQCH-UHFFFAOYSA-N 1 2 221.291 2.267 20 0 BEADLO CCC(F)(F)C[N@@H+](CC(C)(C)O)C1CC1 ZINC000639596088 356514930 /nfs/dbraw/zinc/51/49/30/356514930.db2.gz RSOZRVKSAOFQCH-UHFFFAOYSA-N 1 2 221.291 2.267 20 0 BEADLO F[C@@H]1CCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000336189470 134123070 /nfs/dbraw/zinc/12/30/70/134123070.db2.gz WRWNGRMMWUOHBF-MRVPVSSYSA-N 1 2 205.236 2.111 20 0 BEADLO c1[nH]nnc1C[NH+]1CCC(c2ccccc2)CC1 ZINC000336191639 134123832 /nfs/dbraw/zinc/12/38/32/134123832.db2.gz ABUJAWLRZHIWKM-UHFFFAOYSA-N 1 2 242.326 2.184 20 0 BEADLO c1nn[nH]c1C[NH+]1CCC(c2ccccc2)CC1 ZINC000336191639 134123833 /nfs/dbraw/zinc/12/38/33/134123833.db2.gz ABUJAWLRZHIWKM-UHFFFAOYSA-N 1 2 242.326 2.184 20 0 BEADLO c1n[nH]nc1C[NH+]1CCC(c2ccccc2)CC1 ZINC000336191639 134123834 /nfs/dbraw/zinc/12/38/34/134123834.db2.gz ABUJAWLRZHIWKM-UHFFFAOYSA-N 1 2 242.326 2.184 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CCO[C@@H](C)[C@@H]2C)cn1 ZINC000179678266 366284623 /nfs/dbraw/zinc/28/46/23/366284623.db2.gz HZCYXLAFECLTEV-RYUDHWBXSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)n1cc(C[N@H+]2CCO[C@@H](C)[C@@H]2C)cn1 ZINC000179678266 366284628 /nfs/dbraw/zinc/28/46/28/366284628.db2.gz HZCYXLAFECLTEV-RYUDHWBXSA-N 1 2 237.347 2.073 20 0 BEADLO Fc1ccc(F)c(C[N@@H+]2CC[C@]23CCOC3)c1 ZINC000421014186 192301263 /nfs/dbraw/zinc/30/12/63/192301263.db2.gz HCHGFZRVTSXFRQ-CYBMUJFWSA-N 1 2 239.265 2.330 20 0 BEADLO Fc1ccc(F)c(C[N@H+]2CC[C@]23CCOC3)c1 ZINC000421014186 192301265 /nfs/dbraw/zinc/30/12/65/192301265.db2.gz HCHGFZRVTSXFRQ-CYBMUJFWSA-N 1 2 239.265 2.330 20 0 BEADLO Fc1ccc(C[N@@H+]2CC[C@@]23CCOC3)c(F)c1 ZINC000421017647 192303463 /nfs/dbraw/zinc/30/34/63/192303463.db2.gz KOHXMXLWTMLJSA-ZDUSSCGKSA-N 1 2 239.265 2.330 20 0 BEADLO Fc1ccc(C[N@H+]2CC[C@@]23CCOC3)c(F)c1 ZINC000421017647 192303466 /nfs/dbraw/zinc/30/34/66/192303466.db2.gz KOHXMXLWTMLJSA-ZDUSSCGKSA-N 1 2 239.265 2.330 20 0 BEADLO Fc1ccc(C[N@@H+]2CC[C@]23CCOC3)c(F)c1 ZINC000421017646 192304486 /nfs/dbraw/zinc/30/44/86/192304486.db2.gz KOHXMXLWTMLJSA-CYBMUJFWSA-N 1 2 239.265 2.330 20 0 BEADLO Fc1ccc(C[N@H+]2CC[C@]23CCOC3)c(F)c1 ZINC000421017646 192304489 /nfs/dbraw/zinc/30/44/89/192304489.db2.gz KOHXMXLWTMLJSA-CYBMUJFWSA-N 1 2 239.265 2.330 20 0 BEADLO CC(C)(NC(=O)c1cccs1)c1[nH]cc[nH+]1 ZINC000578137659 366299500 /nfs/dbraw/zinc/29/95/00/366299500.db2.gz QISGPXNNLSETDF-UHFFFAOYSA-N 1 2 235.312 2.136 20 0 BEADLO Cc1nc(C)c(C[NH2+]Cc2ccn(C(C)C)n2)o1 ZINC000394162504 356558935 /nfs/dbraw/zinc/55/89/35/356558935.db2.gz LLILMQFNWDJMJD-UHFFFAOYSA-N 1 2 248.330 2.359 20 0 BEADLO Fc1cccc(F)c1C[N@@H+]1CC[C@]12CCOC2 ZINC000421028629 192309112 /nfs/dbraw/zinc/30/91/12/192309112.db2.gz WNVWDTNNQNZAKD-CYBMUJFWSA-N 1 2 239.265 2.330 20 0 BEADLO Fc1cccc(F)c1C[N@H+]1CC[C@]12CCOC2 ZINC000421028629 192309113 /nfs/dbraw/zinc/30/91/13/192309113.db2.gz WNVWDTNNQNZAKD-CYBMUJFWSA-N 1 2 239.265 2.330 20 0 BEADLO CCC(F)(F)C[N@@H+]1CC[C@H](n2cccn2)C1 ZINC000639650816 356562038 /nfs/dbraw/zinc/56/20/38/356562038.db2.gz JWHOFSBWRVFFMQ-JTQLQIEISA-N 1 2 229.274 2.175 20 0 BEADLO CCC(F)(F)C[N@H+]1CC[C@H](n2cccn2)C1 ZINC000639650816 356562041 /nfs/dbraw/zinc/56/20/41/356562041.db2.gz JWHOFSBWRVFFMQ-JTQLQIEISA-N 1 2 229.274 2.175 20 0 BEADLO Fc1cnccc1CN1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000336212905 134135173 /nfs/dbraw/zinc/13/51/73/134135173.db2.gz VILYVHJSNUKUCT-GFCCVEGCSA-N 1 2 246.289 2.281 20 0 BEADLO COc1cc(C)ccc1C[N@@H+]1CCOC[C@H]1C ZINC000336213151 134135548 /nfs/dbraw/zinc/13/55/48/134135548.db2.gz HXDZDIUFQJCTNI-GFCCVEGCSA-N 1 2 235.327 2.224 20 0 BEADLO COc1cc(C)ccc1C[N@H+]1CCOC[C@H]1C ZINC000336213151 134135549 /nfs/dbraw/zinc/13/55/49/134135549.db2.gz HXDZDIUFQJCTNI-GFCCVEGCSA-N 1 2 235.327 2.224 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)NCc2c[nH+]c[nH]2)C[C@@H]1C ZINC000449908396 202051885 /nfs/dbraw/zinc/05/18/85/202051885.db2.gz UKZDRIIRTDGVJX-VWYCJHECSA-N 1 2 235.331 2.098 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)NCc2c[nH]c[nH+]2)C[C@@H]1C ZINC000449908396 202051888 /nfs/dbraw/zinc/05/18/88/202051888.db2.gz UKZDRIIRTDGVJX-VWYCJHECSA-N 1 2 235.331 2.098 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCC[C@@H]2COC[C@@H]21 ZINC000639670835 356586868 /nfs/dbraw/zinc/58/68/68/356586868.db2.gz IPWWVSSSKJHWDR-ZJUUUORDSA-N 1 2 219.275 2.143 20 0 BEADLO CCC(F)(F)C[N@H+]1CCC[C@@H]2COC[C@@H]21 ZINC000639670835 356586871 /nfs/dbraw/zinc/58/68/71/356586871.db2.gz IPWWVSSSKJHWDR-ZJUUUORDSA-N 1 2 219.275 2.143 20 0 BEADLO CCC(F)(F)C[N@@H+]1CC[C@@H](O)CC12CCC2 ZINC000639687925 356596262 /nfs/dbraw/zinc/59/62/62/356596262.db2.gz UGOMBBKWYAUJMA-SNVBAGLBSA-N 1 2 233.302 2.411 20 0 BEADLO CCC(F)(F)C[N@H+]1CC[C@@H](O)CC12CCC2 ZINC000639687925 356596268 /nfs/dbraw/zinc/59/62/68/356596268.db2.gz UGOMBBKWYAUJMA-SNVBAGLBSA-N 1 2 233.302 2.411 20 0 BEADLO CC[C@H](NC(=O)C1CC2(CC2)C1)c1[nH]cc[nH+]1 ZINC000613579274 363521514 /nfs/dbraw/zinc/52/15/14/363521514.db2.gz KWFPXYHHWWJYDR-JTQLQIEISA-N 1 2 233.315 2.167 20 0 BEADLO CC[C@H](NC(=O)[C@@H]1CCC1(C)C)c1[nH]cc[nH+]1 ZINC000613579214 363522063 /nfs/dbraw/zinc/52/20/63/363522063.db2.gz JCFARSKFPOPGQC-UWVGGRQHSA-N 1 2 235.331 2.413 20 0 BEADLO CC(=O)C[NH2+][C@@H](Cc1ccccc1)c1ncco1 ZINC000639750133 356644254 /nfs/dbraw/zinc/64/42/54/356644254.db2.gz LMMGMQGTJBLEPF-ZDUSSCGKSA-N 1 2 244.294 2.137 20 0 BEADLO C[N@@H+](Cc1nnc(C2CC2)s1)CC1CC1 ZINC000450269662 202115486 /nfs/dbraw/zinc/11/54/86/202115486.db2.gz JNATWTAYAWSSHY-UHFFFAOYSA-N 1 2 223.345 2.257 20 0 BEADLO C[N@H+](Cc1nnc(C2CC2)s1)CC1CC1 ZINC000450269662 202115488 /nfs/dbraw/zinc/11/54/88/202115488.db2.gz JNATWTAYAWSSHY-UHFFFAOYSA-N 1 2 223.345 2.257 20 0 BEADLO C[C@H](c1csnn1)[N@H+](C)C[C@H]1CCCCO1 ZINC000450286138 202117889 /nfs/dbraw/zinc/11/78/89/202117889.db2.gz NGPPUBYXWVFDOU-NXEZZACHSA-N 1 2 241.360 2.100 20 0 BEADLO C[C@H](c1csnn1)[N@@H+](C)C[C@H]1CCCCO1 ZINC000450286138 202117892 /nfs/dbraw/zinc/11/78/92/202117892.db2.gz NGPPUBYXWVFDOU-NXEZZACHSA-N 1 2 241.360 2.100 20 0 BEADLO CN(C[C@H]1CC1(C)C)c1cc(CO)cc[nH+]1 ZINC000630094355 363537088 /nfs/dbraw/zinc/53/70/88/363537088.db2.gz GMPDVQVMEZTVNB-LLVKDONJSA-N 1 2 220.316 2.056 20 0 BEADLO CCOC(C)(C)CNc1nc[nH+]c(C)c1OC ZINC000656174028 491100614 /nfs/dbraw/zinc/10/06/14/491100614.db2.gz NZFQPFLRCGPOHA-UHFFFAOYSA-N 1 2 239.319 2.021 20 0 BEADLO Cc1nn(C)cc1[C@@H](C)[NH2+][C@H](C)C(C)(F)F ZINC000389494200 356694351 /nfs/dbraw/zinc/69/43/51/356694351.db2.gz WODFLWPUHXDPLG-VXNVDRBHSA-N 1 2 231.290 2.423 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cnn(C)c1)C(C)(F)F ZINC000389474249 356682002 /nfs/dbraw/zinc/68/20/02/356682002.db2.gz WPCSBFKLLLVUPC-JGVFFNPUSA-N 1 2 217.263 2.114 20 0 BEADLO C[C@@H](NC(=O)C12CCC(CC1)C2)c1[nH]cc[nH+]1 ZINC000582250847 356683397 /nfs/dbraw/zinc/68/33/97/356683397.db2.gz DZZXRJBSXGGIKI-TTXORMCVSA-N 1 2 233.315 2.167 20 0 BEADLO CCN(C(=O)CCc1[nH]cc[nH+]1)[C@@H](C)C(C)C ZINC000582251111 356683488 /nfs/dbraw/zinc/68/34/88/356683488.db2.gz LOPWYBNUBYVLMK-NSHDSACASA-N 1 2 237.347 2.235 20 0 BEADLO CC(C)OCCC[N@H+](C)[C@H](C)c1csnn1 ZINC000450426634 202162057 /nfs/dbraw/zinc/16/20/57/202162057.db2.gz CPDGWIFMFLQZQN-SNVBAGLBSA-N 1 2 243.376 2.346 20 0 BEADLO CC(C)OCCC[N@@H+](C)[C@H](C)c1csnn1 ZINC000450426634 202162058 /nfs/dbraw/zinc/16/20/58/202162058.db2.gz CPDGWIFMFLQZQN-SNVBAGLBSA-N 1 2 243.376 2.346 20 0 BEADLO CCC[C@]1(C)CCC[N@H+](Cc2c[nH]nn2)C1 ZINC000450454295 202169199 /nfs/dbraw/zinc/16/91/99/202169199.db2.gz LGEBLGAARMGYPN-GFCCVEGCSA-N 1 2 222.336 2.207 20 0 BEADLO CCC[C@]1(C)CCC[N@@H+](Cc2c[nH]nn2)C1 ZINC000450454295 202169203 /nfs/dbraw/zinc/16/92/03/202169203.db2.gz LGEBLGAARMGYPN-GFCCVEGCSA-N 1 2 222.336 2.207 20 0 BEADLO CCC[C@]1(C)CCC[N@H+](Cc2cnn[nH]2)C1 ZINC000450454295 202169207 /nfs/dbraw/zinc/16/92/07/202169207.db2.gz LGEBLGAARMGYPN-GFCCVEGCSA-N 1 2 222.336 2.207 20 0 BEADLO CCC[C@]1(C)CCC[N@@H+](Cc2cnn[nH]2)C1 ZINC000450454295 202169210 /nfs/dbraw/zinc/16/92/10/202169210.db2.gz LGEBLGAARMGYPN-GFCCVEGCSA-N 1 2 222.336 2.207 20 0 BEADLO CCC[C@]1(C)CCC[N@H+](Cc2cn[nH]n2)C1 ZINC000450454295 202169213 /nfs/dbraw/zinc/16/92/13/202169213.db2.gz LGEBLGAARMGYPN-GFCCVEGCSA-N 1 2 222.336 2.207 20 0 BEADLO CCC[C@]1(C)CCC[N@@H+](Cc2cn[nH]n2)C1 ZINC000450454295 202169217 /nfs/dbraw/zinc/16/92/17/202169217.db2.gz LGEBLGAARMGYPN-GFCCVEGCSA-N 1 2 222.336 2.207 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@H]2c2cn[nH]c2)c(C)o1 ZINC000639776631 356717018 /nfs/dbraw/zinc/71/70/18/356717018.db2.gz OBOKZNXKNAUZAX-ZDUSSCGKSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@H]2c2cn[nH]c2)c(C)o1 ZINC000639776631 356717019 /nfs/dbraw/zinc/71/70/19/356717019.db2.gz OBOKZNXKNAUZAX-ZDUSSCGKSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2cn[nH]c2)no1 ZINC000639776070 356717183 /nfs/dbraw/zinc/71/71/83/356717183.db2.gz JWUIYPGGNJWCSU-GFCCVEGCSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2cn[nH]c2)no1 ZINC000639776070 356717186 /nfs/dbraw/zinc/71/71/86/356717186.db2.gz JWUIYPGGNJWCSU-GFCCVEGCSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccns2)nc(C)n1 ZINC000639808633 356778158 /nfs/dbraw/zinc/77/81/58/356778158.db2.gz NVBYVWHRZUVYOB-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccns2)nc(C)n1 ZINC000639808633 356778162 /nfs/dbraw/zinc/77/81/62/356778162.db2.gz NVBYVWHRZUVYOB-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO COc1cc(CNc2c[nH+]ccc2C)sn1 ZINC000399105332 366373080 /nfs/dbraw/zinc/37/30/80/366373080.db2.gz GKORFFYSGNQEOV-UHFFFAOYSA-N 1 2 235.312 2.467 20 0 BEADLO CCC[C@H](C)[N@H+](C)Cc1noc(CC)n1 ZINC000054316622 363566840 /nfs/dbraw/zinc/56/68/40/363566840.db2.gz OCTRVWUODODKTR-VIFPVBQESA-N 1 2 211.309 2.252 20 0 BEADLO CCC[C@H](C)[N@@H+](C)Cc1noc(CC)n1 ZINC000054316622 363566842 /nfs/dbraw/zinc/56/68/42/363566842.db2.gz OCTRVWUODODKTR-VIFPVBQESA-N 1 2 211.309 2.252 20 0 BEADLO CC(=O)C[N@@H+]1CC[C@@H]1c1ccc(F)cc1 ZINC000639801062 356764521 /nfs/dbraw/zinc/76/45/21/356764521.db2.gz OXFFXDJXDKJMSH-GFCCVEGCSA-N 1 2 207.248 2.162 20 0 BEADLO CC(=O)C[N@H+]1CC[C@@H]1c1ccc(F)cc1 ZINC000639801062 356764524 /nfs/dbraw/zinc/76/45/24/356764524.db2.gz OXFFXDJXDKJMSH-GFCCVEGCSA-N 1 2 207.248 2.162 20 0 BEADLO CC[N@H+](CC(=O)OC)[C@@H](C)c1ccc(F)cc1 ZINC000054340927 363567071 /nfs/dbraw/zinc/56/70/71/363567071.db2.gz UYFNLSGCCSJEKV-JTQLQIEISA-N 1 2 239.290 2.382 20 0 BEADLO CC[N@@H+](CC(=O)OC)[C@@H](C)c1ccc(F)cc1 ZINC000054340927 363567075 /nfs/dbraw/zinc/56/70/75/363567075.db2.gz UYFNLSGCCSJEKV-JTQLQIEISA-N 1 2 239.290 2.382 20 0 BEADLO CC1(C)CC[C@@H](NC(=O)CCc2[nH]cc[nH+]2)C1 ZINC000355724136 356771524 /nfs/dbraw/zinc/77/15/24/356771524.db2.gz DDQDXKZXUIRQGT-SNVBAGLBSA-N 1 2 235.331 2.037 20 0 BEADLO Cc1cc(F)ccc1C[N@H+]1CCN(C)C[C@H]1C ZINC000548156809 538654111 /nfs/dbraw/zinc/65/41/11/538654111.db2.gz PQJAKQWYWDCMGA-GFCCVEGCSA-N 1 2 236.334 2.270 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+]1CCN(C)C[C@H]1C ZINC000548156809 538654117 /nfs/dbraw/zinc/65/41/17/538654117.db2.gz PQJAKQWYWDCMGA-GFCCVEGCSA-N 1 2 236.334 2.270 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1C(=O)NCc1c[nH+]c[nH]1 ZINC000356158963 356790376 /nfs/dbraw/zinc/79/03/76/356790376.db2.gz WTRGXOVZIQTCJK-PWSUYJOCSA-N 1 2 235.331 2.242 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1C(=O)NCc1c[nH]c[nH+]1 ZINC000356158963 356790380 /nfs/dbraw/zinc/79/03/80/356790380.db2.gz WTRGXOVZIQTCJK-PWSUYJOCSA-N 1 2 235.331 2.242 20 0 BEADLO CCc1cccnc1[C@H](C)[NH2+]Cc1nccn1C ZINC000356882805 356808364 /nfs/dbraw/zinc/80/83/64/356808364.db2.gz VKRPSTHVOUKULP-NSHDSACASA-N 1 2 244.342 2.228 20 0 BEADLO CO[C@@H]1C[N@H+](Cc2ccc(C)c(C)c2)CCO1 ZINC000639836125 356827848 /nfs/dbraw/zinc/82/78/48/356827848.db2.gz GURKHXZRTBZEQX-AWEZNQCLSA-N 1 2 235.327 2.108 20 0 BEADLO CO[C@@H]1C[N@@H+](Cc2ccc(C)c(C)c2)CCO1 ZINC000639836125 356827851 /nfs/dbraw/zinc/82/78/51/356827851.db2.gz GURKHXZRTBZEQX-AWEZNQCLSA-N 1 2 235.327 2.108 20 0 BEADLO CC(C)C[C@@H]1CCC[N@H+](Cc2cnn[nH]2)C1 ZINC000450484847 202182411 /nfs/dbraw/zinc/18/24/11/202182411.db2.gz NHGGRRKVOBIYDF-NSHDSACASA-N 1 2 222.336 2.063 20 0 BEADLO CC(C)C[C@@H]1CCC[N@@H+](Cc2cnn[nH]2)C1 ZINC000450484847 202182413 /nfs/dbraw/zinc/18/24/13/202182413.db2.gz NHGGRRKVOBIYDF-NSHDSACASA-N 1 2 222.336 2.063 20 0 BEADLO CC(C)C[C@@H]1CCC[N@H+](Cc2cn[nH]n2)C1 ZINC000450484847 202182416 /nfs/dbraw/zinc/18/24/16/202182416.db2.gz NHGGRRKVOBIYDF-NSHDSACASA-N 1 2 222.336 2.063 20 0 BEADLO CC(C)C[C@@H]1CCC[N@@H+](Cc2cn[nH]n2)C1 ZINC000450484847 202182419 /nfs/dbraw/zinc/18/24/19/202182419.db2.gz NHGGRRKVOBIYDF-NSHDSACASA-N 1 2 222.336 2.063 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@H]2c2ncccn2)on1 ZINC000639840981 356836507 /nfs/dbraw/zinc/83/65/07/356836507.db2.gz QJYVYUPPNOBSCT-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@H]2c2ncccn2)on1 ZINC000639840981 356836512 /nfs/dbraw/zinc/83/65/12/356836512.db2.gz QJYVYUPPNOBSCT-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO CCc1cnccc1[C@H](C)[NH2+]Cc1nc(C)no1 ZINC000361118955 356917455 /nfs/dbraw/zinc/91/74/55/356917455.db2.gz DUYZCHJTMXELMA-VIFPVBQESA-N 1 2 246.314 2.186 20 0 BEADLO CCc1cnccc1[C@@H](C)[NH2+]Cc1ccon1 ZINC000361134601 356917876 /nfs/dbraw/zinc/91/78/76/356917876.db2.gz HHLGUMMIRUSCGL-SNVBAGLBSA-N 1 2 231.299 2.483 20 0 BEADLO CCCCOCCOCCNc1cccc[nH+]1 ZINC000361238526 356920527 /nfs/dbraw/zinc/92/05/27/356920527.db2.gz UMRICMJWWRWNKD-UHFFFAOYSA-N 1 2 238.331 2.327 20 0 BEADLO CC[N@H+](Cc1ncc(Cl)s1)[C@@H]1CCOC1 ZINC000361252079 356923402 /nfs/dbraw/zinc/92/34/02/356923402.db2.gz PPBWUOHITGQASP-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO CC[N@@H+](Cc1ncc(Cl)s1)[C@@H]1CCOC1 ZINC000361252079 356923404 /nfs/dbraw/zinc/92/34/04/356923404.db2.gz PPBWUOHITGQASP-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO CC[N@H+](Cc1noc(COC)n1)CC(C)(C)C ZINC000361529895 356932161 /nfs/dbraw/zinc/93/21/61/356932161.db2.gz WZLHGPRMPQDMGW-UHFFFAOYSA-N 1 2 241.335 2.084 20 0 BEADLO CC[N@@H+](Cc1noc(COC)n1)CC(C)(C)C ZINC000361529895 356932164 /nfs/dbraw/zinc/93/21/64/356932164.db2.gz WZLHGPRMPQDMGW-UHFFFAOYSA-N 1 2 241.335 2.084 20 0 BEADLO CC[N@H+](Cc1ncc(C2CC2)o1)[C@H]1CCOC1 ZINC000361587913 356934408 /nfs/dbraw/zinc/93/44/08/356934408.db2.gz LCUOHHXEGDPSKK-NSHDSACASA-N 1 2 236.315 2.163 20 0 BEADLO CC[N@@H+](Cc1ncc(C2CC2)o1)[C@H]1CCOC1 ZINC000361587913 356934413 /nfs/dbraw/zinc/93/44/13/356934413.db2.gz LCUOHHXEGDPSKK-NSHDSACASA-N 1 2 236.315 2.163 20 0 BEADLO CC(C)c1nc(NCCC(C)(F)F)cc[nH+]1 ZINC000450559277 202196346 /nfs/dbraw/zinc/19/63/46/202196346.db2.gz RWQDXKIAFXRFCH-UHFFFAOYSA-N 1 2 229.274 2.479 20 0 BEADLO CCOC1(C)CN(c2cc(C)[nH+]c(C3CC3)n2)C1 ZINC000450577846 202202767 /nfs/dbraw/zinc/20/27/67/202202767.db2.gz HWOOUIMNDHNMJL-UHFFFAOYSA-N 1 2 247.342 2.278 20 0 BEADLO CCOC1(C)CN(c2nc(C)[nH+]c(C)c2C)C1 ZINC000450582719 202203680 /nfs/dbraw/zinc/20/36/80/202203680.db2.gz SORVBHWRHJEWKB-UHFFFAOYSA-N 1 2 235.331 2.017 20 0 BEADLO Cc1cc(N[C@@H]2CCC(F)(F)C2)c(C#N)c[nH+]1 ZINC000399620415 356988334 /nfs/dbraw/zinc/98/83/34/356988334.db2.gz YSJXYIZLMNFMDV-SNVBAGLBSA-N 1 2 237.253 2.283 20 0 BEADLO Cc1cc(N[C@H]2CCC(F)(F)C2)c(C#N)c[nH+]1 ZINC000399620412 356988743 /nfs/dbraw/zinc/98/87/43/356988743.db2.gz YSJXYIZLMNFMDV-JTQLQIEISA-N 1 2 237.253 2.283 20 0 BEADLO Cc1c(F)cccc1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000399736944 357033154 /nfs/dbraw/zinc/03/31/54/357033154.db2.gz WFDBQVJJDKZMPA-UHFFFAOYSA-N 1 2 247.273 2.129 20 0 BEADLO CC[C@@H]([NH2+]Cc1csc(C)c1C)C(=O)OC ZINC000399760429 357041116 /nfs/dbraw/zinc/04/11/16/357041116.db2.gz BMBKJLKCWLGRNL-LLVKDONJSA-N 1 2 241.356 2.406 20 0 BEADLO COC[C@@H](Nc1ccc2c(c1)CC[NH2+]2)C1CC1 ZINC000423213627 192630269 /nfs/dbraw/zinc/63/02/69/192630269.db2.gz KEEFGEFPHVLNQN-CQSZACIVSA-N 1 2 232.327 2.492 20 0 BEADLO C[C@@H]1CCC[C@@H](CC(=O)NCc2c[nH+]cn2C)C1 ZINC000355258162 538790330 /nfs/dbraw/zinc/79/03/30/538790330.db2.gz RXMGCEMHUYIUMY-VXGBXAGGSA-N 1 2 249.358 2.253 20 0 BEADLO CCC(CC)[C@@H](C)C(=O)NCc1c[nH+]cn1C ZINC000355264905 538791020 /nfs/dbraw/zinc/79/10/20/538791020.db2.gz KNFHAEHTASKMDL-SNVBAGLBSA-N 1 2 237.347 2.109 20 0 BEADLO CC1CCC(CC(=O)NCc2c[nH+]cn2C)CC1 ZINC000355256759 538791274 /nfs/dbraw/zinc/79/12/74/538791274.db2.gz RXCQPTXLTWLTTJ-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO CC[C@H]([NH2+]Cc1ccno1)c1nccs1 ZINC000389879968 357058707 /nfs/dbraw/zinc/05/87/07/357058707.db2.gz NRAPMJWKJAROLT-VIFPVBQESA-N 1 2 223.301 2.372 20 0 BEADLO CCC1(c2noc(C[NH+](C)C)n2)CCCC1 ZINC000351019390 357092023 /nfs/dbraw/zinc/09/20/23/357092023.db2.gz WNOLZFOWKOBHJY-UHFFFAOYSA-N 1 2 223.320 2.353 20 0 BEADLO Cc1ccc2[nH]c(CCCCO)[nH+]c2c1 ZINC000026462174 357135942 /nfs/dbraw/zinc/13/59/42/357135942.db2.gz VFGVQJDJCTWFOW-UHFFFAOYSA-N 1 2 204.273 2.186 20 0 BEADLO Cc1ccc2[nH+]c(CCCCO)[nH]c2c1 ZINC000026462174 357135945 /nfs/dbraw/zinc/13/59/45/357135945.db2.gz VFGVQJDJCTWFOW-UHFFFAOYSA-N 1 2 204.273 2.186 20 0 BEADLO CC[N@@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000377431962 357233433 /nfs/dbraw/zinc/23/34/33/357233433.db2.gz ZQLWXZRZBMUFDO-SNVBAGLBSA-N 1 2 221.304 2.494 20 0 BEADLO CC[N@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000377431962 357233438 /nfs/dbraw/zinc/23/34/38/357233438.db2.gz ZQLWXZRZBMUFDO-SNVBAGLBSA-N 1 2 221.304 2.494 20 0 BEADLO CC[N@@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000377431961 357233648 /nfs/dbraw/zinc/23/36/48/357233648.db2.gz ZQLWXZRZBMUFDO-JTQLQIEISA-N 1 2 221.304 2.494 20 0 BEADLO CC[N@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000377431961 357233652 /nfs/dbraw/zinc/23/36/52/357233652.db2.gz ZQLWXZRZBMUFDO-JTQLQIEISA-N 1 2 221.304 2.494 20 0 BEADLO C[C@H]1C[NH+](Cc2cocn2)C[C@H](C)C1(F)F ZINC000628392292 357188448 /nfs/dbraw/zinc/18/84/48/357188448.db2.gz NPHGQTCGUCXDKD-IUCAKERBSA-N 1 2 230.258 2.398 20 0 BEADLO Cc1c[nH]c(C[NH+]2C[C@@H](C)C(F)(F)[C@H](C)C2)n1 ZINC000628392700 357189085 /nfs/dbraw/zinc/18/90/85/357189085.db2.gz VEOLLVOCLIWGSO-RKDXNWHRSA-N 1 2 243.301 2.441 20 0 BEADLO COc1ccccc1C[NH2+]CC(C)(F)F ZINC000393500672 357285676 /nfs/dbraw/zinc/28/56/76/357285676.db2.gz SDQWASCSOIQMRB-UHFFFAOYSA-N 1 2 215.243 2.440 20 0 BEADLO CC[C@H](NCC(C)(F)F)c1[nH+]ccn1C ZINC000393544453 357287474 /nfs/dbraw/zinc/28/74/74/357287474.db2.gz GIECMOBYJCCAKH-QMMMGPOBSA-N 1 2 217.263 2.116 20 0 BEADLO CCc1ccc(C[NH+]2CC3(C2)CCCO3)o1 ZINC000628427071 357256056 /nfs/dbraw/zinc/25/60/56/357256056.db2.gz DLLCQGXWBLWMPH-UHFFFAOYSA-N 1 2 221.300 2.207 20 0 BEADLO Cc1cccc(C[NH+]2CC3(C2)CCCO3)c1F ZINC000628427483 357256229 /nfs/dbraw/zinc/25/62/29/357256229.db2.gz FQTULWKPIIOJCK-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO COc1cc(C[NH+]2CC3(C2)CCCO3)ccc1C ZINC000628427726 357259251 /nfs/dbraw/zinc/25/92/51/357259251.db2.gz VVPCCIAGPPWWAZ-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO Cc1nc(NCCc2ccc(F)cc2F)cc[nH+]1 ZINC000582819501 357406467 /nfs/dbraw/zinc/40/64/67/357406467.db2.gz WXDUBOKKFRWPSC-UHFFFAOYSA-N 1 2 249.264 2.140 20 0 BEADLO Cc1ncncc1[C@@H](C)[NH2+][C@@H](C)C(C)(F)F ZINC000582914278 357435113 /nfs/dbraw/zinc/43/51/13/357435113.db2.gz FJDWOKCNWNCCKX-BDAKNGLRSA-N 1 2 229.274 2.479 20 0 BEADLO Cc1ncncc1[C@H](C)[NH2+][C@H](C)C(C)(F)F ZINC000582914279 357435360 /nfs/dbraw/zinc/43/53/60/357435360.db2.gz FJDWOKCNWNCCKX-DTWKUNHWSA-N 1 2 229.274 2.479 20 0 BEADLO Cc1ncncc1[C@@H](C)[NH2+][C@H](C)C(C)(F)F ZINC000582914281 357435370 /nfs/dbraw/zinc/43/53/70/357435370.db2.gz FJDWOKCNWNCCKX-RKDXNWHRSA-N 1 2 229.274 2.479 20 0 BEADLO CCCC[N@H+](C)Cc1noc(CCC)n1 ZINC000054982808 363583109 /nfs/dbraw/zinc/58/31/09/363583109.db2.gz WTXFKHVNLRDBOH-UHFFFAOYSA-N 1 2 211.309 2.254 20 0 BEADLO CCCC[N@@H+](C)Cc1noc(CCC)n1 ZINC000054982808 363583114 /nfs/dbraw/zinc/58/31/14/363583114.db2.gz WTXFKHVNLRDBOH-UHFFFAOYSA-N 1 2 211.309 2.254 20 0 BEADLO C[C@@H](CC(F)F)C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000583029688 357463690 /nfs/dbraw/zinc/46/36/90/357463690.db2.gz AQQGZXJRDHLWAO-ZETCQYMHSA-N 1 2 245.273 2.052 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)CC1CCC1 ZINC000583095163 357479515 /nfs/dbraw/zinc/47/95/15/357479515.db2.gz ZMJPIZPPGGEURK-UHFFFAOYSA-N 1 2 205.305 2.330 20 0 BEADLO Cc1oncc1C[N@@H+]1CCn2cccc2[C@@H]1C ZINC000188797570 357574695 /nfs/dbraw/zinc/57/46/95/357574695.db2.gz QTJFNWMMRNUTPR-JTQLQIEISA-N 1 2 231.299 2.361 20 0 BEADLO Cc1oncc1C[N@H+]1CCn2cccc2[C@@H]1C ZINC000188797570 357574696 /nfs/dbraw/zinc/57/46/96/357574696.db2.gz QTJFNWMMRNUTPR-JTQLQIEISA-N 1 2 231.299 2.361 20 0 BEADLO CC(C)(C)CCCCNC(=O)Cn1cc[nH+]c1 ZINC000073389759 357514730 /nfs/dbraw/zinc/51/47/30/357514730.db2.gz PIGOMJYZRBMNLO-UHFFFAOYSA-N 1 2 237.347 2.216 20 0 BEADLO c1cc(C[NH2+]Cc2cccc3cc[nH]c32)[nH]n1 ZINC000230657525 357545487 /nfs/dbraw/zinc/54/54/87/357545487.db2.gz MLGNTQSXTQHUHK-UHFFFAOYSA-N 1 2 226.283 2.181 20 0 BEADLO CCC(C)(CC)C(=O)NCCCn1cc[nH+]c1 ZINC000158536727 538862516 /nfs/dbraw/zinc/86/25/16/538862516.db2.gz CRSMDISIVULKCR-UHFFFAOYSA-N 1 2 237.347 2.216 20 0 BEADLO COC[C@@H](O)CCNc1ccc2ccccc2[nH+]1 ZINC000231570368 357609195 /nfs/dbraw/zinc/60/91/95/357609195.db2.gz DVHGZDWZSOIGDA-LBPRGKRZSA-N 1 2 246.310 2.044 20 0 BEADLO COC[C@H](O)CCNc1ccc2ccccc2[nH+]1 ZINC000231570386 357609365 /nfs/dbraw/zinc/60/93/65/357609365.db2.gz DVHGZDWZSOIGDA-GFCCVEGCSA-N 1 2 246.310 2.044 20 0 BEADLO COc1cccc(CNc2ccc[nH+]c2C)n1 ZINC000189431766 357642549 /nfs/dbraw/zinc/64/25/49/357642549.db2.gz KFHINISUZGDTNS-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO Cn1ccc(C[NH2+]Cc2scnc2C2CC2)n1 ZINC000487576981 538887962 /nfs/dbraw/zinc/88/79/62/538887962.db2.gz XYKSVWPQQRZKJF-UHFFFAOYSA-N 1 2 248.355 2.044 20 0 BEADLO CCN(CCO)c1[nH+]ccc2c(OC)cccc21 ZINC000233457340 357724803 /nfs/dbraw/zinc/72/48/03/357724803.db2.gz PKTSWKNKNLYCCW-UHFFFAOYSA-N 1 2 246.310 2.062 20 0 BEADLO c1cnc(C[N@@H+]2CCC[C@H]2c2ccncc2)nc1 ZINC000192134143 357824373 /nfs/dbraw/zinc/82/43/73/357824373.db2.gz IODQERBKUXEDJY-ZDUSSCGKSA-N 1 2 240.310 2.209 20 0 BEADLO c1cnc(C[N@H+]2CCC[C@H]2c2ccncc2)nc1 ZINC000192134143 357824375 /nfs/dbraw/zinc/82/43/75/357824375.db2.gz IODQERBKUXEDJY-ZDUSSCGKSA-N 1 2 240.310 2.209 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ncccn2)s1 ZINC000191989332 357819763 /nfs/dbraw/zinc/81/97/63/357819763.db2.gz XBLMJDZNEUKUGU-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ncccn2)s1 ZINC000191989332 357819767 /nfs/dbraw/zinc/81/97/67/357819767.db2.gz XBLMJDZNEUKUGU-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ccc2[nH+]cc(CNc3cnccn3)n2c1 ZINC000192151389 357825365 /nfs/dbraw/zinc/82/53/65/357825365.db2.gz LPVWOQDGOITOJL-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO COC(=O)[C@H](C)[N@H+](Cc1ccco1)C1CCC1 ZINC000191653156 357781394 /nfs/dbraw/zinc/78/13/94/357781394.db2.gz LYADLWOEMDCAEW-JTQLQIEISA-N 1 2 237.299 2.196 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](Cc1ccco1)C1CCC1 ZINC000191653156 357781396 /nfs/dbraw/zinc/78/13/96/357781396.db2.gz LYADLWOEMDCAEW-JTQLQIEISA-N 1 2 237.299 2.196 20 0 BEADLO COc1cccc([C@H](C)[NH2+]Cc2nnc(C)o2)c1 ZINC000235016578 357846005 /nfs/dbraw/zinc/84/60/05/357846005.db2.gz VAFKNPIWXWUSMM-VIFPVBQESA-N 1 2 247.298 2.237 20 0 BEADLO CC(C)=CCNC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000335305929 535370814 /nfs/dbraw/zinc/37/08/14/535370814.db2.gz BIGRIWPJEFYAAC-UHFFFAOYSA-N 1 2 244.298 2.422 20 0 BEADLO C[C@@H](NC(=O)[C@H](C)C(C)(C)C)c1[nH]cc[nH+]1 ZINC000399141569 357896583 /nfs/dbraw/zinc/89/65/83/357896583.db2.gz URLFTEVGCMKVCF-DTWKUNHWSA-N 1 2 223.320 2.269 20 0 BEADLO Fc1ccc(C=CC[NH2+]Cc2ccn[nH]2)cc1F ZINC000584450341 357962904 /nfs/dbraw/zinc/96/29/04/357962904.db2.gz ZVPKJVUBWZKUEZ-OWOJBTEDSA-N 1 2 249.264 2.491 20 0 BEADLO COC(=O)[C@@H]([NH2+]Cc1ccc(C)cc1)C(C)C ZINC000035084937 357962932 /nfs/dbraw/zinc/96/29/32/357962932.db2.gz HVFGCDVTMOAPHT-ZDUSSCGKSA-N 1 2 235.327 2.282 20 0 BEADLO C[C@H](CC(=O)N(C)[C@@H]1CC[C@@H](C)C1)n1cc[nH+]c1 ZINC000584473011 357990665 /nfs/dbraw/zinc/99/06/65/357990665.db2.gz MPWSJBODHFIFFL-JHJVBQTASA-N 1 2 249.358 2.481 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@@H](CCF)C2)o1 ZINC000628457998 358017507 /nfs/dbraw/zinc/01/75/07/358017507.db2.gz YUWDIIKUBAMHPB-NSHDSACASA-N 1 2 227.279 2.148 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@@H](CCF)C2)o1 ZINC000628457998 358017512 /nfs/dbraw/zinc/01/75/12/358017512.db2.gz YUWDIIKUBAMHPB-NSHDSACASA-N 1 2 227.279 2.148 20 0 BEADLO Cc1ncc([C@@H](C)[NH2+]CC(F)F)s1 ZINC000639995103 358034006 /nfs/dbraw/zinc/03/40/06/358034006.db2.gz QZPMOHSLGUAVKK-RXMQYKEDSA-N 1 2 206.261 2.367 20 0 BEADLO CCOC(=O)C(C)(C)[NH2+]CCCOC(C)(C)C ZINC000610682072 358077122 /nfs/dbraw/zinc/07/71/22/358077122.db2.gz ZNOZHYBYRFBKPH-UHFFFAOYSA-N 1 2 245.363 2.123 20 0 BEADLO CC[C@@H]1c2ccsc2CC[N@H+]1CC(=O)OC ZINC000053139669 358104441 /nfs/dbraw/zinc/10/44/41/358104441.db2.gz DQTAQXYPPAGPTH-SNVBAGLBSA-N 1 2 239.340 2.230 20 0 BEADLO CC[C@@H]1c2ccsc2CC[N@@H+]1CC(=O)OC ZINC000053139669 358104445 /nfs/dbraw/zinc/10/44/45/358104445.db2.gz DQTAQXYPPAGPTH-SNVBAGLBSA-N 1 2 239.340 2.230 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@H]1CCC(C)(C)C1 ZINC000583881013 358115176 /nfs/dbraw/zinc/11/51/76/358115176.db2.gz PSSIBNJRXPLPLC-GHMZBOCLSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@H]1CCC(C)(C)C1 ZINC000583881013 358115180 /nfs/dbraw/zinc/11/51/80/358115180.db2.gz PSSIBNJRXPLPLC-GHMZBOCLSA-N 1 2 249.358 2.283 20 0 BEADLO CCCn1ncnc1C[NH+]1CCC(C)(F)CC1 ZINC000640070826 358157116 /nfs/dbraw/zinc/15/71/16/358157116.db2.gz DRSRUNAKRRKDHO-UHFFFAOYSA-N 1 2 240.326 2.012 20 0 BEADLO C[C@H](c1csnn1)[NH+]1CCC(C)(F)CC1 ZINC000640071473 358162168 /nfs/dbraw/zinc/16/21/68/358162168.db2.gz OHHOLKPIHYUJGI-MRVPVSSYSA-N 1 2 229.324 2.423 20 0 BEADLO C[C@H](CC(=O)N1C[C@H](C)CC[C@@H]1C)n1cc[nH+]c1 ZINC000584723242 358165596 /nfs/dbraw/zinc/16/55/96/358165596.db2.gz HIHCBNRPNRJKEH-FRRDWIJNSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@H](c1csnn1)[N@H+](C)CCc1ccncc1 ZINC000450651164 202224733 /nfs/dbraw/zinc/22/47/33/202224733.db2.gz MNQLZUGTTXVLDL-SNVBAGLBSA-N 1 2 248.355 2.169 20 0 BEADLO C[C@H](c1csnn1)[N@@H+](C)CCc1ccncc1 ZINC000450651164 202224737 /nfs/dbraw/zinc/22/47/37/202224737.db2.gz MNQLZUGTTXVLDL-SNVBAGLBSA-N 1 2 248.355 2.169 20 0 BEADLO CC(C)(C)CC(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000584845648 358200283 /nfs/dbraw/zinc/20/02/83/358200283.db2.gz XWDSSPKEXGSHFH-UHFFFAOYSA-N 1 2 223.320 2.197 20 0 BEADLO CCOCC[N@H+](C)Cc1nnc(C(C)C)s1 ZINC000450639327 202221323 /nfs/dbraw/zinc/22/13/23/202221323.db2.gz AHVXHEKJFDZXSL-UHFFFAOYSA-N 1 2 243.376 2.130 20 0 BEADLO CCOCC[N@@H+](C)Cc1nnc(C(C)C)s1 ZINC000450639327 202221327 /nfs/dbraw/zinc/22/13/27/202221327.db2.gz AHVXHEKJFDZXSL-UHFFFAOYSA-N 1 2 243.376 2.130 20 0 BEADLO CCCC[N@H+](CCCO)[C@@H](C)c1csnn1 ZINC000450686687 202234478 /nfs/dbraw/zinc/23/44/78/202234478.db2.gz CYDQPOPZNRYPGV-JTQLQIEISA-N 1 2 243.376 2.084 20 0 BEADLO CCCC[N@@H+](CCCO)[C@@H](C)c1csnn1 ZINC000450686687 202234482 /nfs/dbraw/zinc/23/44/82/202234482.db2.gz CYDQPOPZNRYPGV-JTQLQIEISA-N 1 2 243.376 2.084 20 0 BEADLO C[C@H]([NH2+]CC1(C)CC1)C(=O)OC(C)(C)C ZINC000224399610 358232472 /nfs/dbraw/zinc/23/24/72/358232472.db2.gz CYVSJBYQHMWANK-VIFPVBQESA-N 1 2 213.321 2.106 20 0 BEADLO C[C@@H](CC1CC1)NC(=O)c1ccc2[nH+]ccn2c1 ZINC000171999060 134263849 /nfs/dbraw/zinc/26/38/49/134263849.db2.gz PRUGSUFHLZCZTP-JTQLQIEISA-N 1 2 243.310 2.253 20 0 BEADLO COc1ccnc(C[NH2+][C@@H](C)c2cccs2)n1 ZINC000450726294 202247777 /nfs/dbraw/zinc/24/77/77/202247777.db2.gz UMZOGFJOHOZNFM-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO CCO[C@@H]1CCN(c2cc[nH+]c(C)n2)C[C@H]1C ZINC000450744161 202253219 /nfs/dbraw/zinc/25/32/19/202253219.db2.gz LALAUXLPWHPPGW-ZYHUDNBSSA-N 1 2 235.331 2.036 20 0 BEADLO CO[C@@H]1CCN(c2nc(C)[nH+]c(C)c2C)C[C@@H]1C ZINC000450756598 202255037 /nfs/dbraw/zinc/25/50/37/202255037.db2.gz KKJUMTHABCNFBY-TVQRCGJNSA-N 1 2 249.358 2.263 20 0 BEADLO CC/C(C)=C/c1nc(Cc2c[nH+]cn2C)no1 ZINC000351095448 366410744 /nfs/dbraw/zinc/41/07/44/366410744.db2.gz TZQROROUFYXRBT-WEVVVXLNSA-N 1 2 232.287 2.207 20 0 BEADLO CCc1cn(Cc2cncc(F)c2)c[nH+]1 ZINC001641418709 1172246776 /nfs/dbraw/zinc/24/67/76/1172246776.db2.gz KXIIBUVYYWCKDO-UHFFFAOYSA-N 1 2 205.236 2.028 20 0 BEADLO c1cn(CCCCNc2ccccn2)c[nH+]1 ZINC000045108248 358401082 /nfs/dbraw/zinc/40/10/82/358401082.db2.gz OHMCUSSWAVGMTE-UHFFFAOYSA-N 1 2 216.288 2.170 20 0 BEADLO Cc1nc(CSc2[nH+]cc3ccccn32)no1 ZINC000031634306 358447908 /nfs/dbraw/zinc/44/79/08/358447908.db2.gz MFTTWLGIUCACJE-UHFFFAOYSA-N 1 2 246.295 2.318 20 0 BEADLO CCCc1nc(Cc2ccc[nH+]c2C)no1 ZINC000351239839 366457567 /nfs/dbraw/zinc/45/75/67/366457567.db2.gz MQISMGLCGBQNBD-UHFFFAOYSA-N 1 2 217.272 2.316 20 0 BEADLO Nc1[nH+]cnc(NCC2=CCCCC2)c1Cl ZINC000379761560 363610936 /nfs/dbraw/zinc/61/09/36/363610936.db2.gz DMKVTOOHQNSRAF-UHFFFAOYSA-N 1 2 238.722 2.046 20 0 BEADLO Nc1nc[nH+]c(NCC2=CCCCC2)c1Cl ZINC000379761560 363610938 /nfs/dbraw/zinc/61/09/38/363610938.db2.gz DMKVTOOHQNSRAF-UHFFFAOYSA-N 1 2 238.722 2.046 20 0 BEADLO FCC[NH2+][C@H](CF)c1ccc(F)cc1 ZINC000640154467 358438814 /nfs/dbraw/zinc/43/88/14/358438814.db2.gz GNGULEMENOAZIM-SNVBAGLBSA-N 1 2 203.207 2.395 20 0 BEADLO CCO[C@H]1CCCN(c2cc(C)[nH+]cc2C#N)C1 ZINC000399498792 358439133 /nfs/dbraw/zinc/43/91/33/358439133.db2.gz IEOWXURYTUZNJZ-ZDUSSCGKSA-N 1 2 245.326 2.267 20 0 BEADLO CC[N@H+](C/C=C\c1ccccc1)CC(=O)OC ZINC000219376401 134281334 /nfs/dbraw/zinc/28/13/34/134281334.db2.gz XGGPSYASIONIRG-YFHOEESVSA-N 1 2 233.311 2.195 20 0 BEADLO CC[N@@H+](C/C=C\c1ccccc1)CC(=O)OC ZINC000219376401 134281335 /nfs/dbraw/zinc/28/13/35/134281335.db2.gz XGGPSYASIONIRG-YFHOEESVSA-N 1 2 233.311 2.195 20 0 BEADLO CC[C@@H](C)C(=O)Nc1ccc[nH+]c1N(C)C ZINC000047976088 358609042 /nfs/dbraw/zinc/60/90/42/358609042.db2.gz RNUZXHORMUHJIN-SECBINFHSA-N 1 2 221.304 2.132 20 0 BEADLO Cc1cc(Cl)cc(C(=O)NCc2c[nH+]c[nH]2)c1 ZINC000130554227 358631567 /nfs/dbraw/zinc/63/15/67/358631567.db2.gz RZSWAMIFSOVMCY-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO Cc1cc(Cl)cc(C(=O)NCc2c[nH]c[nH+]2)c1 ZINC000130554227 358631568 /nfs/dbraw/zinc/63/15/68/358631568.db2.gz RZSWAMIFSOVMCY-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO COC(=O)c1coc(CNc2ccc(C)[nH+]c2)c1 ZINC000130805309 358647743 /nfs/dbraw/zinc/64/77/43/358647743.db2.gz OYAWKKNNTCSWQZ-UHFFFAOYSA-N 1 2 246.266 2.382 20 0 BEADLO CCCOCC(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC000049178606 358674164 /nfs/dbraw/zinc/67/41/64/358674164.db2.gz ZRECRJMMBAPDMA-UHFFFAOYSA-N 1 2 247.298 2.236 20 0 BEADLO Cc1[nH+]c2ccccn2c1CSc1nc[nH]n1 ZINC000133329981 358750598 /nfs/dbraw/zinc/75/05/98/358750598.db2.gz FRVIWHLBCOMZJG-UHFFFAOYSA-N 1 2 245.311 2.053 20 0 BEADLO C[NH2+]Cc1noc(CCCc2cccs2)n1 ZINC000051848500 358765403 /nfs/dbraw/zinc/76/54/03/358765403.db2.gz IUAPAEFCDNFYBO-UHFFFAOYSA-N 1 2 237.328 2.026 20 0 BEADLO CCc1ccc(C[N@H+](CC)CC(=O)OC)cc1 ZINC000050066214 358711581 /nfs/dbraw/zinc/71/15/81/358711581.db2.gz ANZWWMANBOWJQS-UHFFFAOYSA-N 1 2 235.327 2.244 20 0 BEADLO CCc1ccc(C[N@@H+](CC)CC(=O)OC)cc1 ZINC000050066214 358711585 /nfs/dbraw/zinc/71/15/85/358711585.db2.gz ANZWWMANBOWJQS-UHFFFAOYSA-N 1 2 235.327 2.244 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1nncn1C)c1ccsc1 ZINC000050341740 358724567 /nfs/dbraw/zinc/72/45/67/358724567.db2.gz DDUIHKREWQQAOS-IUCAKERBSA-N 1 2 236.344 2.288 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NCCC1CCCC1 ZINC000578245518 366468978 /nfs/dbraw/zinc/46/89/78/366468978.db2.gz QXTDMXHITJHQIU-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NCCC1CCCC1 ZINC000578245518 366468988 /nfs/dbraw/zinc/46/89/88/366468988.db2.gz QXTDMXHITJHQIU-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO CCc1nc(C[N@H+]2C[C@H](C)C[C@H](C)C2)no1 ZINC000054316307 358858051 /nfs/dbraw/zinc/85/80/51/358858051.db2.gz FFRUWRKAGFBYHQ-AOOOYVTPSA-N 1 2 223.320 2.110 20 0 BEADLO CCc1nc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)no1 ZINC000054316307 358858055 /nfs/dbraw/zinc/85/80/55/358858055.db2.gz FFRUWRKAGFBYHQ-AOOOYVTPSA-N 1 2 223.320 2.110 20 0 BEADLO CC(C)[N@H+](CC(F)F)C[C@@H]1CCCO1 ZINC000135383440 358831299 /nfs/dbraw/zinc/83/12/99/358831299.db2.gz YWDQVAVTNNNRBZ-VIFPVBQESA-N 1 2 207.264 2.141 20 0 BEADLO CC(C)[N@@H+](CC(F)F)C[C@@H]1CCCO1 ZINC000135383440 358831301 /nfs/dbraw/zinc/83/13/01/358831301.db2.gz YWDQVAVTNNNRBZ-VIFPVBQESA-N 1 2 207.264 2.141 20 0 BEADLO CCCC[N@H+](C)Cc1noc(C2CC2)n1 ZINC000053602367 358835929 /nfs/dbraw/zinc/83/59/29/358835929.db2.gz HUQJKKIABDEPFH-UHFFFAOYSA-N 1 2 209.293 2.179 20 0 BEADLO CCCC[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000053602367 358835933 /nfs/dbraw/zinc/83/59/33/358835933.db2.gz HUQJKKIABDEPFH-UHFFFAOYSA-N 1 2 209.293 2.179 20 0 BEADLO CC(C)(O)CCn1c[nH+]c2cc(F)c(F)cc21 ZINC000135809631 358852445 /nfs/dbraw/zinc/85/24/45/358852445.db2.gz VIMLRLFKULRXRH-UHFFFAOYSA-N 1 2 240.253 2.476 20 0 BEADLO Cc1cncc(NC(=O)C[C@@H](C)n2cc[nH+]c2)c1 ZINC000578326918 366516662 /nfs/dbraw/zinc/51/66/62/366516662.db2.gz KUCPWTZVNGRZBZ-LLVKDONJSA-N 1 2 244.298 2.176 20 0 BEADLO COc1ccc(NC[C@@H]2CC[C@H]3C[C@H]3C2)[nH+]c1 ZINC000403376447 358900519 /nfs/dbraw/zinc/90/05/19/358900519.db2.gz NPMMYHINSKPMEL-GRYCIOLGSA-N 1 2 232.327 2.360 20 0 BEADLO Cc1cc(C)c(NC(=O)c2cocn2)c(C)[nH+]1 ZINC000105366878 358900950 /nfs/dbraw/zinc/90/09/50/358900950.db2.gz ZKSCRXPINBPYNR-UHFFFAOYSA-N 1 2 231.255 2.247 20 0 BEADLO C[C@@H](Cc1nc(CC2CC2)no1)n1cc[nH+]c1 ZINC000351402557 366521249 /nfs/dbraw/zinc/52/12/49/366521249.db2.gz JOUWDKOYTSOEIA-VIFPVBQESA-N 1 2 232.287 2.022 20 0 BEADLO c1cn(CCSCCOCC2CCC2)c[nH+]1 ZINC000419651136 358964213 /nfs/dbraw/zinc/96/42/13/358964213.db2.gz SECRNZGQVZGLAU-UHFFFAOYSA-N 1 2 240.372 2.433 20 0 BEADLO C[C@H](CF)[NH2+]Cc1n[nH]c2ccccc21 ZINC000308829482 491138337 /nfs/dbraw/zinc/13/83/37/491138337.db2.gz FRRFTVJHXQLZFQ-MRVPVSSYSA-N 1 2 207.252 2.011 20 0 BEADLO CC[C@@H](NC(=O)c1cccc(F)c1)c1[nH]cc[nH+]1 ZINC000140503192 358922362 /nfs/dbraw/zinc/92/23/62/358922362.db2.gz QYSVTEKEHXVMES-LLVKDONJSA-N 1 2 247.273 2.430 20 0 BEADLO C(C[N@@H+]1OC2CCC1CC2)[C@H]1CCCO1 ZINC000640229957 358941054 /nfs/dbraw/zinc/94/10/54/358941054.db2.gz HHUGXVFWQKUAJB-MOENNCHZSA-N 1 2 211.305 2.114 20 0 BEADLO C(C[N@H+]1OC2CCC1CC2)[C@H]1CCCO1 ZINC000640229957 358941056 /nfs/dbraw/zinc/94/10/56/358941056.db2.gz HHUGXVFWQKUAJB-MOENNCHZSA-N 1 2 211.305 2.114 20 0 BEADLO C(C[N@@H+]1OC2CCC1CC2)[C@@H]1CCCO1 ZINC000640229956 358941416 /nfs/dbraw/zinc/94/14/16/358941416.db2.gz HHUGXVFWQKUAJB-CXQJBGSLSA-N 1 2 211.305 2.114 20 0 BEADLO C(C[N@H+]1OC2CCC1CC2)[C@@H]1CCCO1 ZINC000640229956 358941419 /nfs/dbraw/zinc/94/14/19/358941419.db2.gz HHUGXVFWQKUAJB-CXQJBGSLSA-N 1 2 211.305 2.114 20 0 BEADLO CC[C@H]([NH2+]Cc1cc[nH]n1)c1nc(C)cs1 ZINC000105502800 359024687 /nfs/dbraw/zinc/02/46/87/359024687.db2.gz ZBDFEJAZGVWPSE-JTQLQIEISA-N 1 2 236.344 2.416 20 0 BEADLO Cc1csc(C[NH2+][C@H](C)c2cnccn2)n1 ZINC000070025433 359038465 /nfs/dbraw/zinc/03/84/65/359038465.db2.gz DMTCSWNZGSLWQC-SECBINFHSA-N 1 2 234.328 2.092 20 0 BEADLO Cc1cc(C)cc(C(=O)N(C)Cc2[nH]cc[nH+]2)c1 ZINC000070978881 359067493 /nfs/dbraw/zinc/06/74/93/359067493.db2.gz ZSKHCPZSIOQDPZ-UHFFFAOYSA-N 1 2 243.310 2.299 20 0 BEADLO C[C@H](CC(=O)N(C)Cc1[nH]cc[nH+]1)C(C)(C)C ZINC000070980373 359069096 /nfs/dbraw/zinc/06/90/96/359069096.db2.gz LOQHCJHYSWUDDL-SNVBAGLBSA-N 1 2 237.347 2.440 20 0 BEADLO Cc1nn(C)c(C)c1CNc1c[nH+]ccc1C ZINC000071413567 359079394 /nfs/dbraw/zinc/07/93/94/359079394.db2.gz DZTAHYCTQNBPHE-UHFFFAOYSA-N 1 2 230.315 2.352 20 0 BEADLO C[C@H]([NH2+]Cc1ccccc1F)c1nccn1C ZINC000070443418 359053167 /nfs/dbraw/zinc/05/31/67/359053167.db2.gz YZHVHNZEXRVQSK-JTQLQIEISA-N 1 2 233.290 2.410 20 0 BEADLO Cc1cc(NC(=O)NCc2ccncc2)cc[nH+]1 ZINC000074753430 359126939 /nfs/dbraw/zinc/12/69/39/359126939.db2.gz QHBIJKRXLVFSCH-UHFFFAOYSA-N 1 2 242.282 2.107 20 0 BEADLO COC(=O)C[N@@H+]1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000247183110 359199242 /nfs/dbraw/zinc/19/92/42/359199242.db2.gz BLTBRMOBDYAQMW-GHMZBOCLSA-N 1 2 237.299 2.226 20 0 BEADLO COC(=O)C[N@H+]1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000247183110 359199246 /nfs/dbraw/zinc/19/92/46/359199246.db2.gz BLTBRMOBDYAQMW-GHMZBOCLSA-N 1 2 237.299 2.226 20 0 BEADLO C[C@H]1CCN(CC(F)(F)F)C[C@H]1n1cc[nH+]c1 ZINC000247325071 359212643 /nfs/dbraw/zinc/21/26/43/359212643.db2.gz GFGRWOPROYIROI-VHSXEESVSA-N 1 2 247.264 2.328 20 0 BEADLO CCCc1nc(C[N@@H+]2CC[C@@H](C)[C@H]2C)no1 ZINC000248330587 359264577 /nfs/dbraw/zinc/26/45/77/359264577.db2.gz DPFCDRJOFYYQGA-NXEZZACHSA-N 1 2 223.320 2.252 20 0 BEADLO CCCc1nc(C[N@H+]2CC[C@@H](C)[C@H]2C)no1 ZINC000248330587 359264582 /nfs/dbraw/zinc/26/45/82/359264582.db2.gz DPFCDRJOFYYQGA-NXEZZACHSA-N 1 2 223.320 2.252 20 0 BEADLO COC(=O)C[N@H+](C)Cc1ccccc1C1CC1 ZINC000611255199 359274947 /nfs/dbraw/zinc/27/49/47/359274947.db2.gz RRSKMBWZOLRVSV-UHFFFAOYSA-N 1 2 233.311 2.169 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1ccccc1C1CC1 ZINC000611255199 359274950 /nfs/dbraw/zinc/27/49/50/359274950.db2.gz RRSKMBWZOLRVSV-UHFFFAOYSA-N 1 2 233.311 2.169 20 0 BEADLO C[N@H+](Cc1ccc(Cl)s1)C1COC1 ZINC000306224463 359348252 /nfs/dbraw/zinc/34/82/52/359348252.db2.gz TZWXHCMWSCIPSQ-UHFFFAOYSA-N 1 2 217.721 2.232 20 0 BEADLO C[N@@H+](Cc1ccc(Cl)s1)C1COC1 ZINC000306224463 359348255 /nfs/dbraw/zinc/34/82/55/359348255.db2.gz TZWXHCMWSCIPSQ-UHFFFAOYSA-N 1 2 217.721 2.232 20 0 BEADLO CC[C@@H]([NH2+]Cc1ncn(C)n1)c1cccc(C)c1 ZINC000286177127 359352504 /nfs/dbraw/zinc/35/25/04/359352504.db2.gz QFEBMPHBCSGMLZ-CYBMUJFWSA-N 1 2 244.342 2.364 20 0 BEADLO CCC[C@H](C(=O)OCC)[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000611502511 359384716 /nfs/dbraw/zinc/38/47/16/359384716.db2.gz UVMKMIBCAAYLFJ-GRYCIOLGSA-N 1 2 245.338 2.398 20 0 BEADLO CCC[C@H](C(=O)OCC)[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000611502511 359384723 /nfs/dbraw/zinc/38/47/23/359384723.db2.gz UVMKMIBCAAYLFJ-GRYCIOLGSA-N 1 2 245.338 2.398 20 0 BEADLO CCOC(=O)[C@H](CC)[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000611502437 359384948 /nfs/dbraw/zinc/38/49/48/359384948.db2.gz SGPQOYNWENQQBC-VWYCJHECSA-N 1 2 231.311 2.008 20 0 BEADLO CCOC(=O)[C@H](CC)[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000611502437 359384952 /nfs/dbraw/zinc/38/49/52/359384952.db2.gz SGPQOYNWENQQBC-VWYCJHECSA-N 1 2 231.311 2.008 20 0 BEADLO C[C@H](C(=O)OC(C)(C)C)[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000611502490 359385489 /nfs/dbraw/zinc/38/54/89/359385489.db2.gz UEDYBLHZQYPSGU-GMTAPVOTSA-N 1 2 245.338 2.397 20 0 BEADLO C[C@H](C(=O)OC(C)(C)C)[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000611502490 359385491 /nfs/dbraw/zinc/38/54/91/359385491.db2.gz UEDYBLHZQYPSGU-GMTAPVOTSA-N 1 2 245.338 2.397 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C1CCC2(CC2)CC1 ZINC000611795138 359452905 /nfs/dbraw/zinc/45/29/05/359452905.db2.gz NXFAUJFJYOWJSC-UHFFFAOYSA-N 1 2 247.342 2.305 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C1(CF)CCC1 ZINC000574990052 359526757 /nfs/dbraw/zinc/52/67/57/359526757.db2.gz CMZIBFLWKKYWAZ-UHFFFAOYSA-N 1 2 236.290 2.144 20 0 BEADLO Nc1[nH+]cnc(N[C@@H]2CC[C@H](F)C2)c1Cl ZINC000308997157 491142060 /nfs/dbraw/zinc/14/20/60/491142060.db2.gz MXEIQOBTCRFODX-NTSWFWBYSA-N 1 2 230.674 2.015 20 0 BEADLO Nc1nc[nH+]c(N[C@@H]2CC[C@H](F)C2)c1Cl ZINC000308997157 491142061 /nfs/dbraw/zinc/14/20/61/491142061.db2.gz MXEIQOBTCRFODX-NTSWFWBYSA-N 1 2 230.674 2.015 20 0 BEADLO Cc1cc(C)n(Cc2ccc[nH+]c2C)n1 ZINC000309028651 491142639 /nfs/dbraw/zinc/14/26/39/491142639.db2.gz ZVXSACKLVUFWFW-UHFFFAOYSA-N 1 2 201.273 2.252 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnc(Cl)cn2)CCS1 ZINC000231284559 359694593 /nfs/dbraw/zinc/69/45/93/359694593.db2.gz NXRQYCLLULFCGA-MRVPVSSYSA-N 1 2 243.763 2.067 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnc(Cl)cn2)CCS1 ZINC000231284559 359694598 /nfs/dbraw/zinc/69/45/98/359694598.db2.gz NXRQYCLLULFCGA-MRVPVSSYSA-N 1 2 243.763 2.067 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)Nc1nccc(C)n1 ZINC000450835172 202284484 /nfs/dbraw/zinc/28/44/84/202284484.db2.gz WMJZQIMQQCGFGA-JTQLQIEISA-N 1 2 231.303 2.175 20 0 BEADLO CCC[C@H](O)C[N@@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000450842778 202286234 /nfs/dbraw/zinc/28/62/34/202286234.db2.gz CDPUHJWWTWGJEM-ZJUUUORDSA-N 1 2 221.291 2.125 20 0 BEADLO CCC[C@H](O)C[N@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000450842778 202286236 /nfs/dbraw/zinc/28/62/36/202286236.db2.gz CDPUHJWWTWGJEM-ZJUUUORDSA-N 1 2 221.291 2.125 20 0 BEADLO CO[C@H]1CC[C@H](C(=O)Nc2ccc(C)[nH+]c2C)C1 ZINC000612227032 359740874 /nfs/dbraw/zinc/74/08/74/359740874.db2.gz PJSQKUKOSSPQSR-RYUDHWBXSA-N 1 2 248.326 2.452 20 0 BEADLO CC[C@@H](O)[C@H](CC)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000450866590 202293334 /nfs/dbraw/zinc/29/33/34/202293334.db2.gz XIZRLYRSVUULFE-WDEREUQCSA-N 1 2 248.330 2.228 20 0 BEADLO COc1cccc2c1cc[nH+]c2N[C@H]1C[C@@H](O)C1 ZINC000450924636 202310687 /nfs/dbraw/zinc/31/06/87/202310687.db2.gz VJKZYBUNBGWRFA-AOOOYVTPSA-N 1 2 244.294 2.179 20 0 BEADLO CCc1nc(N2CCCC[C@@H]2COC)cc(C)[nH+]1 ZINC000450930810 202312501 /nfs/dbraw/zinc/31/25/01/202312501.db2.gz GDRMUEUOTLBIMN-GFCCVEGCSA-N 1 2 249.358 2.353 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000578364814 366540009 /nfs/dbraw/zinc/54/00/09/366540009.db2.gz JHTGPAFHLDTWTQ-VXGBXAGGSA-N 1 2 237.347 2.481 20 0 BEADLO COC[C@H]1CCCN(c2cc(C)[nH+]cn2)CC1 ZINC000450952176 202318895 /nfs/dbraw/zinc/31/88/95/202318895.db2.gz ZVYBSYXCDIJOQY-LBPRGKRZSA-N 1 2 235.331 2.038 20 0 BEADLO CCC(=O)CCC[N@@H+]1CCC[C@@H]1C(F)F ZINC000450993058 202328725 /nfs/dbraw/zinc/32/87/25/202328725.db2.gz STSUVSYRSUUSIC-SNVBAGLBSA-N 1 2 219.275 2.475 20 0 BEADLO CCC(=O)CCC[N@H+]1CCC[C@@H]1C(F)F ZINC000450993058 202328728 /nfs/dbraw/zinc/32/87/28/202328728.db2.gz STSUVSYRSUUSIC-SNVBAGLBSA-N 1 2 219.275 2.475 20 0 BEADLO C[NH2+]Cc1noc([C@@]2(C)C[C@@H]2c2ccccc2)n1 ZINC000578485885 366577534 /nfs/dbraw/zinc/57/75/34/366577534.db2.gz PJIPKFBGLWRBOU-RISCZKNCSA-N 1 2 243.310 2.234 20 0 BEADLO CC(C)[N@H+](CCC(F)(F)F)C1COC1 ZINC000451120138 202358522 /nfs/dbraw/zinc/35/85/22/202358522.db2.gz JQZMZJCXXRVDIQ-UHFFFAOYSA-N 1 2 211.227 2.048 20 0 BEADLO CC(C)[N@@H+](CCC(F)(F)F)C1COC1 ZINC000451120138 202358526 /nfs/dbraw/zinc/35/85/26/202358526.db2.gz JQZMZJCXXRVDIQ-UHFFFAOYSA-N 1 2 211.227 2.048 20 0 BEADLO CCC(C)(C)NC(=O)C[N@@H+]1CCC[C@@](C)(F)C1 ZINC000451123383 202359239 /nfs/dbraw/zinc/35/92/39/202359239.db2.gz VKDVEYSCGAYLTA-CYBMUJFWSA-N 1 2 244.354 2.115 20 0 BEADLO CCC(C)(C)NC(=O)C[N@H+]1CCC[C@@](C)(F)C1 ZINC000451123383 202359241 /nfs/dbraw/zinc/35/92/41/202359241.db2.gz VKDVEYSCGAYLTA-CYBMUJFWSA-N 1 2 244.354 2.115 20 0 BEADLO Cc1ccc(C[N@H+](C2CC2)C2COC2)c(C)n1 ZINC000451127743 202360238 /nfs/dbraw/zinc/36/02/38/202360238.db2.gz VGYJVQADEBDFMF-UHFFFAOYSA-N 1 2 232.327 2.062 20 0 BEADLO Cc1ccc(C[N@@H+](C2CC2)C2COC2)c(C)n1 ZINC000451127743 202360240 /nfs/dbraw/zinc/36/02/40/202360240.db2.gz VGYJVQADEBDFMF-UHFFFAOYSA-N 1 2 232.327 2.062 20 0 BEADLO CC[C@@H](C(=O)OC(C)(C)C)[N@@H+]1CC[C@H](F)C1 ZINC000451202569 202378166 /nfs/dbraw/zinc/37/81/66/202378166.db2.gz XJERMZVMRHVDME-UWVGGRQHSA-N 1 2 231.311 2.151 20 0 BEADLO CC[C@@H](C(=O)OC(C)(C)C)[N@H+]1CC[C@H](F)C1 ZINC000451202569 202378169 /nfs/dbraw/zinc/37/81/69/202378169.db2.gz XJERMZVMRHVDME-UWVGGRQHSA-N 1 2 231.311 2.151 20 0 BEADLO CC[C@H](C(=O)OC(C)(C)C)[N@@H+]1CC[C@@H](F)C1 ZINC000451202568 202380347 /nfs/dbraw/zinc/38/03/47/202380347.db2.gz XJERMZVMRHVDME-NXEZZACHSA-N 1 2 231.311 2.151 20 0 BEADLO CC[C@H](C(=O)OC(C)(C)C)[N@H+]1CC[C@@H](F)C1 ZINC000451202568 202380350 /nfs/dbraw/zinc/38/03/50/202380350.db2.gz XJERMZVMRHVDME-NXEZZACHSA-N 1 2 231.311 2.151 20 0 BEADLO Cc1cc(NC[C@@H]2CCCS2)nc[nH+]1 ZINC000087475259 359913340 /nfs/dbraw/zinc/91/33/40/359913340.db2.gz ROOZOONJFWEKID-VIFPVBQESA-N 1 2 209.318 2.093 20 0 BEADLO CCSCC[N@H+](C)[C@H](C)c1nc(C)no1 ZINC000578664589 366622971 /nfs/dbraw/zinc/62/29/71/366622971.db2.gz RUAZMUISODOSOX-MRVPVSSYSA-N 1 2 229.349 2.124 20 0 BEADLO CCSCC[N@@H+](C)[C@H](C)c1nc(C)no1 ZINC000578664589 366622978 /nfs/dbraw/zinc/62/29/78/366622978.db2.gz RUAZMUISODOSOX-MRVPVSSYSA-N 1 2 229.349 2.124 20 0 BEADLO CC(C)n1cc([C@H](C)[NH2+]Cc2ncccn2)cn1 ZINC000578699407 366628357 /nfs/dbraw/zinc/62/83/57/366628357.db2.gz KDWZHDQDYMARAK-NSHDSACASA-N 1 2 245.330 2.105 20 0 BEADLO FCCC[NH2+][C@@H](c1ncn[nH]1)C1CCCCC1 ZINC000578712749 366629609 /nfs/dbraw/zinc/62/96/09/366629609.db2.gz VTZBHPIHDYEWDW-LLVKDONJSA-N 1 2 240.326 2.375 20 0 BEADLO CC(C)COCC[NH+]1CC(C(F)(F)F)C1 ZINC000578723862 366632640 /nfs/dbraw/zinc/63/26/40/366632640.db2.gz HHQMIZAFMQCUGE-UHFFFAOYSA-N 1 2 225.254 2.153 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CCC2(C)C)c(C)c[nH+]1 ZINC000612746658 360040228 /nfs/dbraw/zinc/04/02/28/360040228.db2.gz IAEFCCTXSCOQKI-LLVKDONJSA-N 1 2 232.327 2.495 20 0 BEADLO CCOC1(C(=O)Nc2cc(C)[nH+]cc2C)CCC1 ZINC000612747574 360040509 /nfs/dbraw/zinc/04/05/09/360040509.db2.gz QDXRCLRKYGMFLQ-UHFFFAOYSA-N 1 2 248.326 2.018 20 0 BEADLO Cc1cc(NC[C@@H]2CCC[C@H]2O)nc(C(C)C)[nH+]1 ZINC000089166509 359996769 /nfs/dbraw/zinc/99/67/69/359996769.db2.gz MVSXXVDTURAOBN-NWDGAFQWSA-N 1 2 249.358 2.481 20 0 BEADLO Cn1c[nH+]cc1CNc1ccc(F)c(F)c1F ZINC000090153445 360059008 /nfs/dbraw/zinc/05/90/08/360059008.db2.gz AOPJFHVNBFQXBM-UHFFFAOYSA-N 1 2 241.216 2.450 20 0 BEADLO CCOCCCSCCn1cc[nH+]c1 ZINC000090201673 360063376 /nfs/dbraw/zinc/06/33/76/360063376.db2.gz XLICKUHCJPSSGR-UHFFFAOYSA-N 1 2 214.334 2.043 20 0 BEADLO CC(C)c1nc(N[C@H](C)C[C@H](C)O)cc[nH+]1 ZINC000309370821 491147626 /nfs/dbraw/zinc/14/76/26/491147626.db2.gz QKXYKWFOMBPVDH-ZJUUUORDSA-N 1 2 223.320 2.171 20 0 BEADLO c1ncc(C[NH+]2CCC(OC3CCCC3)CC2)[nH]1 ZINC000092758763 360194706 /nfs/dbraw/zinc/19/47/06/360194706.db2.gz PMCKLEKIJRBGHV-UHFFFAOYSA-N 1 2 249.358 2.333 20 0 BEADLO CCOCC[N@H+](C)[C@@H](C)c1nc(C(C)C)no1 ZINC000093317605 360229358 /nfs/dbraw/zinc/22/93/58/360229358.db2.gz ZPVJWKWCMLQKCR-JTQLQIEISA-N 1 2 241.335 2.222 20 0 BEADLO CCOCC[N@@H+](C)[C@@H](C)c1nc(C(C)C)no1 ZINC000093317605 360229361 /nfs/dbraw/zinc/22/93/61/360229361.db2.gz ZPVJWKWCMLQKCR-JTQLQIEISA-N 1 2 241.335 2.222 20 0 BEADLO c1cc([C@@H]2CN(Cc3c[nH+]c[nH]3)CCO2)cs1 ZINC000093768357 360274469 /nfs/dbraw/zinc/27/44/69/360274469.db2.gz JJYPNMANWGTCEP-LBPRGKRZSA-N 1 2 249.339 2.045 20 0 BEADLO c1cc([C@@H]2CN(Cc3c[nH]c[nH+]3)CCO2)cs1 ZINC000093768357 360274470 /nfs/dbraw/zinc/27/44/70/360274470.db2.gz JJYPNMANWGTCEP-LBPRGKRZSA-N 1 2 249.339 2.045 20 0 BEADLO O=C(Nc1cc[nH+]cc1O)C1CCC2(CC2)CC1 ZINC000613087116 360348682 /nfs/dbraw/zinc/34/86/82/360348682.db2.gz UJLIECDUIZDULT-UHFFFAOYSA-N 1 2 246.310 2.118 20 0 BEADLO O[C@@H](CNc1cc2ccccc2c[nH+]1)C1CC1 ZINC000631098697 360375719 /nfs/dbraw/zinc/37/57/19/360375719.db2.gz ROSVYIYMUZQWDF-ZDUSSCGKSA-N 1 2 228.295 2.418 20 0 BEADLO CCC[C@H]([NH2+]CCc1ccco1)C(=O)OCC ZINC000097988056 360385838 /nfs/dbraw/zinc/38/58/38/360385838.db2.gz SKUDSIWWSPZCED-LBPRGKRZSA-N 1 2 239.315 2.144 20 0 BEADLO CN(C)c1ncc(C[NH2+]C(C)(C)C(F)F)s1 ZINC000309465001 491149788 /nfs/dbraw/zinc/14/97/88/491149788.db2.gz PBVFEIMWXHNGOB-UHFFFAOYSA-N 1 2 249.330 2.342 20 0 BEADLO C[C@H](O)CCNc1cc2ccccc2c[nH+]1 ZINC000631118726 360625426 /nfs/dbraw/zinc/62/54/26/360625426.db2.gz MPFDKNXTFDDPPB-JTQLQIEISA-N 1 2 216.284 2.418 20 0 BEADLO Cn1cc[nH+]c1Cn1cc(-c2ccccc2)cn1 ZINC000158607940 200721611 /nfs/dbraw/zinc/72/16/11/200721611.db2.gz VRQXFKCDXCULTJ-UHFFFAOYSA-N 1 2 238.294 2.332 20 0 BEADLO CN(C)c1ccc(CSc2cccnn2)c[nH+]1 ZINC000629172175 360920335 /nfs/dbraw/zinc/92/03/35/360920335.db2.gz VAPXZSMOELSVEJ-UHFFFAOYSA-N 1 2 246.339 2.230 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)NC3(C)CCC3)ccn12 ZINC000579023572 366698626 /nfs/dbraw/zinc/69/86/26/366698626.db2.gz TYGOYIKYTWSWBY-UHFFFAOYSA-N 1 2 243.310 2.315 20 0 BEADLO Cc1csc([C@H](C)[NH2+]Cc2cc(C)ncn2)n1 ZINC000428347979 201010223 /nfs/dbraw/zinc/01/02/23/201010223.db2.gz IZXRJOGTEWGGRO-JTQLQIEISA-N 1 2 248.355 2.401 20 0 BEADLO CN(C)c1cccc(C[NH2+]Cc2cocn2)c1 ZINC000428879938 201047370 /nfs/dbraw/zinc/04/73/70/201047370.db2.gz IEMKJGUEYCVURZ-UHFFFAOYSA-N 1 2 231.299 2.030 20 0 BEADLO Cc1nc(N(C)[C@@H]2CC[C@H](C)C2)cc[nH+]1 ZINC000428674811 201034383 /nfs/dbraw/zinc/03/43/83/201034383.db2.gz YGRYQCABCZSZGE-GXSJLCMTSA-N 1 2 205.305 2.410 20 0 BEADLO c1c[nH]c(C[NH2+]Cc2cc3ccccc3o2)n1 ZINC000067694226 370694488 /nfs/dbraw/zinc/69/44/88/370694488.db2.gz RDJVAJKDXLMNPW-UHFFFAOYSA-N 1 2 227.267 2.446 20 0 BEADLO CC[C@H]1CC[N@@H+]1Cc1cn(-c2ccccc2)nn1 ZINC000429298585 201099848 /nfs/dbraw/zinc/09/98/48/201099848.db2.gz WMSXHWMENGOGAO-ZDUSSCGKSA-N 1 2 242.326 2.252 20 0 BEADLO CC[C@H]1CC[N@H+]1Cc1cn(-c2ccccc2)nn1 ZINC000429298585 201099852 /nfs/dbraw/zinc/09/98/52/201099852.db2.gz WMSXHWMENGOGAO-ZDUSSCGKSA-N 1 2 242.326 2.252 20 0 BEADLO Cc1nc2[nH]ccc2c(NCC2(C)CCC2)[nH+]1 ZINC000433794169 201194708 /nfs/dbraw/zinc/19/47/08/201194708.db2.gz WGDOLRDCFNLAOG-UHFFFAOYSA-N 1 2 230.315 2.290 20 0 BEADLO CCC1(C(=O)NC[C@H](C)Cn2cc[nH+]c2)CCC1 ZINC000434265803 201210843 /nfs/dbraw/zinc/21/08/43/201210843.db2.gz XLVVTPUNMSIVIQ-LBPRGKRZSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1ncccc1C[NH2+]Cc1cscn1 ZINC000163859530 361622619 /nfs/dbraw/zinc/62/26/19/361622619.db2.gz XBCUBFXRPBZUFS-UHFFFAOYSA-N 1 2 219.313 2.136 20 0 BEADLO CC(C)c1nc(N[C@]2(C)CCOC2)cc[nH+]1 ZINC000153493972 201240429 /nfs/dbraw/zinc/24/04/29/201240429.db2.gz WJDKFAOXGJJOKT-GFCCVEGCSA-N 1 2 221.304 2.191 20 0 BEADLO CNc1ccc(-c2ccccc2F)c[nH+]1 ZINC000629709677 361645199 /nfs/dbraw/zinc/64/51/99/361645199.db2.gz DSLAQVZWPSRAGH-UHFFFAOYSA-N 1 2 202.232 2.351 20 0 BEADLO COc1ccc(CNc2c[nH+]ccc2OC)cn1 ZINC000436022506 201306184 /nfs/dbraw/zinc/30/61/84/201306184.db2.gz SATYQCBUNBYCNG-UHFFFAOYSA-N 1 2 245.282 2.106 20 0 BEADLO FCC[NH2+][C@@H](c1ccc(F)cc1)c1cnccn1 ZINC000436316610 201321255 /nfs/dbraw/zinc/32/12/55/201321255.db2.gz SKUPFSUQSGWYEX-ZDUSSCGKSA-N 1 2 249.264 2.264 20 0 BEADLO COC(=O)c1occc1C[N@@H+]1CCC=C(C)C1 ZINC000436266321 201317007 /nfs/dbraw/zinc/31/70/07/201317007.db2.gz OITRQEQKQZYMBH-UHFFFAOYSA-N 1 2 235.283 2.218 20 0 BEADLO COC(=O)c1occc1C[N@H+]1CCC=C(C)C1 ZINC000436266321 201317009 /nfs/dbraw/zinc/31/70/09/201317009.db2.gz OITRQEQKQZYMBH-UHFFFAOYSA-N 1 2 235.283 2.218 20 0 BEADLO COCc1cnc(C[N@@H+]2CCC=C(C)C2)s1 ZINC000437349672 201351420 /nfs/dbraw/zinc/35/14/20/201351420.db2.gz TZEYISWMSPVZJP-UHFFFAOYSA-N 1 2 238.356 2.442 20 0 BEADLO COCc1cnc(C[N@H+]2CCC=C(C)C2)s1 ZINC000437349672 201351423 /nfs/dbraw/zinc/35/14/23/201351423.db2.gz TZEYISWMSPVZJP-UHFFFAOYSA-N 1 2 238.356 2.442 20 0 BEADLO CC1=C(C(=O)N(C)CCCn2cc[nH+]c2)CCC1 ZINC000437352989 201352142 /nfs/dbraw/zinc/35/21/42/201352142.db2.gz BMTAUWBPDTVQDJ-UHFFFAOYSA-N 1 2 247.342 2.232 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NC[C@@H]1CCCC12CC2 ZINC000629832322 361731242 /nfs/dbraw/zinc/73/12/42/361731242.db2.gz ZRLHMZZKGWATPS-NSHDSACASA-N 1 2 247.342 2.039 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NC[C@@H]1CCCC12CC2 ZINC000629832322 361731248 /nfs/dbraw/zinc/73/12/48/361731248.db2.gz ZRLHMZZKGWATPS-NSHDSACASA-N 1 2 247.342 2.039 20 0 BEADLO Cc1[nH+]c2ccccn2c1CNc1ncccn1 ZINC000438234219 201399501 /nfs/dbraw/zinc/39/95/01/201399501.db2.gz KYHOJZUHFFSYAI-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO COC(=O)[C@@](C)([NH2+]Cc1ccccc1)C1CC1 ZINC000037952512 363899407 /nfs/dbraw/zinc/89/94/07/363899407.db2.gz LMOSARGOMSLZJO-AWEZNQCLSA-N 1 2 233.311 2.118 20 0 BEADLO c1ccc(C[NH2+]Cc2nc3c(s2)CCC3)nc1 ZINC000093052616 541347305 /nfs/dbraw/zinc/34/73/05/541347305.db2.gz RWFMNNPVYAOVLN-UHFFFAOYSA-N 1 2 245.351 2.317 20 0 BEADLO CC[C@@H](C)N(C)C(=O)c1ccc2[nH+]ccn2c1 ZINC000170867051 364546174 /nfs/dbraw/zinc/54/61/74/364546174.db2.gz SRSMQYGHPGQJRV-SNVBAGLBSA-N 1 2 231.299 2.205 20 0 BEADLO Cc1cc2ccccc2[nH+]c1N1C[C@@H](C)[C@H](O)C1 ZINC000388110774 541369910 /nfs/dbraw/zinc/36/99/10/541369910.db2.gz XEVKQVYNGWTJMZ-BXUZGUMPSA-N 1 2 242.322 2.360 20 0 BEADLO C[C@H](C(=O)NC(C)(C)c1[nH]cc[nH+]1)C(C)(F)F ZINC000573501148 364847767 /nfs/dbraw/zinc/84/77/67/364847767.db2.gz ZFTPHXWXSBPKPG-SSDOTTSWSA-N 1 2 245.273 2.052 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+](C)CCOCC(C)C)n1 ZINC000573742263 364908515 /nfs/dbraw/zinc/90/85/15/364908515.db2.gz XTSURVFIFGBEGT-SNVBAGLBSA-N 1 2 241.335 2.043 20 0 BEADLO Cc1noc([C@@H](C)[N@H+](C)CCOCC(C)C)n1 ZINC000573742263 364908521 /nfs/dbraw/zinc/90/85/21/364908521.db2.gz XTSURVFIFGBEGT-SNVBAGLBSA-N 1 2 241.335 2.043 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N1CC2(C1)CCCCC2 ZINC000334207304 541412674 /nfs/dbraw/zinc/41/26/74/541412674.db2.gz WXEONSTZAYYSCG-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N1CC2(C1)CCCCC2 ZINC000334207304 541412677 /nfs/dbraw/zinc/41/26/77/541412677.db2.gz WXEONSTZAYYSCG-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO CCc1nc(C[NH2+][C@@H](C)c2cnccn2)cs1 ZINC000156432722 201432109 /nfs/dbraw/zinc/43/21/09/201432109.db2.gz ZTWOLFGVPMFAQK-VIFPVBQESA-N 1 2 248.355 2.346 20 0 BEADLO CC(C)[C@H]1CCN1C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000574092438 364986102 /nfs/dbraw/zinc/98/61/02/364986102.db2.gz TZBQTKCOGWMZSG-VXGBXAGGSA-N 1 2 235.331 2.091 20 0 BEADLO CCc1nocc1C[N@@H+]1CCC[C@H](F)C1 ZINC000574092384 364986424 /nfs/dbraw/zinc/98/64/24/364986424.db2.gz PNHAHVRMPNGETK-JTQLQIEISA-N 1 2 212.268 2.171 20 0 BEADLO CCc1nocc1C[N@H+]1CCC[C@H](F)C1 ZINC000574092384 364986429 /nfs/dbraw/zinc/98/64/29/364986429.db2.gz PNHAHVRMPNGETK-JTQLQIEISA-N 1 2 212.268 2.171 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)N2CCC2(C)C)c2[nH+]ccn21 ZINC000574537581 365086795 /nfs/dbraw/zinc/08/67/95/365086795.db2.gz OXPMXEWENAIRTJ-VHSXEESVSA-N 1 2 248.330 2.083 20 0 BEADLO F[C@@H]1CCC[N@H+](Cc2cccc3nccn32)C1 ZINC000574577554 365094496 /nfs/dbraw/zinc/09/44/96/365094496.db2.gz BRVWSUYFMIXHBX-LLVKDONJSA-N 1 2 233.290 2.268 20 0 BEADLO F[C@@H]1CCC[N@@H+](Cc2cccc3nccn32)C1 ZINC000574577554 365094504 /nfs/dbraw/zinc/09/45/04/365094504.db2.gz BRVWSUYFMIXHBX-LLVKDONJSA-N 1 2 233.290 2.268 20 0 BEADLO F[C@@H]1CCCN(Cc2cccc3[nH+]ccn32)C1 ZINC000574577554 365094510 /nfs/dbraw/zinc/09/45/10/365094510.db2.gz BRVWSUYFMIXHBX-LLVKDONJSA-N 1 2 233.290 2.268 20 0 BEADLO Cc1ccncc1NC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000574815497 365152070 /nfs/dbraw/zinc/15/20/70/365152070.db2.gz YAYMCNCFULYUOL-NSHDSACASA-N 1 2 244.298 2.176 20 0 BEADLO Cc1c[nH+]c(C)nc1NCC1C[C@@H](C)O[C@H](C)C1 ZINC000574770031 365141517 /nfs/dbraw/zinc/14/15/17/365141517.db2.gz GCHXLBPVZXUKOZ-GHMZBOCLSA-N 1 2 249.358 2.131 20 0 BEADLO CCCCCOC1CN(c2cc[nH+]c(C)n2)C1 ZINC000444079599 193034007 /nfs/dbraw/zinc/03/40/07/193034007.db2.gz YFGFKBHXZMQSAK-UHFFFAOYSA-N 1 2 235.331 2.180 20 0 BEADLO C[C@@H](C(=O)Nc1ccsc1)[NH+]1CC(C)C1 ZINC000575328735 365292536 /nfs/dbraw/zinc/29/25/36/365292536.db2.gz YOAORSQXFMOKPR-VIFPVBQESA-N 1 2 224.329 2.027 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)c1csc(Cl)c1 ZINC000336531871 365339442 /nfs/dbraw/zinc/33/94/42/365339442.db2.gz UALWSGGCFGYFGY-UHFFFAOYSA-N 1 2 241.703 2.055 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@H]1CCCC1(C)C ZINC000575933395 365420837 /nfs/dbraw/zinc/42/08/37/365420837.db2.gz LKCZXBQJEZOGPS-CMPLNLGQSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@H]1CCCC1(C)C ZINC000575933395 365420838 /nfs/dbraw/zinc/42/08/38/365420838.db2.gz LKCZXBQJEZOGPS-CMPLNLGQSA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)N(CC1CC1)C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000576050216 365464364 /nfs/dbraw/zinc/46/43/64/365464364.db2.gz ANHXUOZFQIBZMS-LLVKDONJSA-N 1 2 249.358 2.235 20 0 BEADLO CC(C)N(CC1CC1)C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000576050216 365464373 /nfs/dbraw/zinc/46/43/73/365464373.db2.gz ANHXUOZFQIBZMS-LLVKDONJSA-N 1 2 249.358 2.235 20 0 BEADLO CC[C@@]1(C)CCC[N@H+](Cc2noc(C)n2)C1 ZINC000174193891 365476002 /nfs/dbraw/zinc/47/60/02/365476002.db2.gz LGVXINYAQLPTEM-LBPRGKRZSA-N 1 2 223.320 2.390 20 0 BEADLO CC[C@@]1(C)CCC[N@@H+](Cc2noc(C)n2)C1 ZINC000174193891 365476005 /nfs/dbraw/zinc/47/60/05/365476005.db2.gz LGVXINYAQLPTEM-LBPRGKRZSA-N 1 2 223.320 2.390 20 0 BEADLO CC[C@@H]([NH2+][C@@H](C)[C@@H](C)OC)C(=O)OC(C)(C)C ZINC000575969097 365427275 /nfs/dbraw/zinc/42/72/75/365427275.db2.gz WQPHOYBWVAQVDH-HBNTYKKESA-N 1 2 245.363 2.120 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NCC1=CCCCC1 ZINC000576002247 365442855 /nfs/dbraw/zinc/44/28/55/365442855.db2.gz UERLHUSURUDCRC-NSHDSACASA-N 1 2 247.342 2.205 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NCC1=CCCCC1 ZINC000576002247 365442863 /nfs/dbraw/zinc/44/28/63/365442863.db2.gz UERLHUSURUDCRC-NSHDSACASA-N 1 2 247.342 2.205 20 0 BEADLO O=C(Cn1cc[nH+]c1)Nc1ccc2ccoc2c1 ZINC000576041875 365459973 /nfs/dbraw/zinc/45/99/73/365459973.db2.gz VJYPTMCXLGGNGD-UHFFFAOYSA-N 1 2 241.250 2.268 20 0 BEADLO COCCN(C)c1[nH+]ccc2cc(F)ccc21 ZINC000576153778 365501966 /nfs/dbraw/zinc/50/19/66/365501966.db2.gz LGTRIVUQBCFOIG-UHFFFAOYSA-N 1 2 234.274 2.457 20 0 BEADLO CC(C)[C@@H](C)Nc1ccc(N2CCOCC2)c[nH+]1 ZINC000182874718 366954655 /nfs/dbraw/zinc/95/46/55/366954655.db2.gz JMTCNBVWMABGEB-GFCCVEGCSA-N 1 2 249.358 2.375 20 0 BEADLO Cc1nccc(C(=O)Nc2ccc(C)[nH+]c2C)n1 ZINC000176192406 541501462 /nfs/dbraw/zinc/50/14/62/541501462.db2.gz DQOQMYSAQMJRAV-UHFFFAOYSA-N 1 2 242.282 2.049 20 0 BEADLO CCN(CCO)c1ccc2cc(OC)ccc2[nH+]1 ZINC000178227825 541503860 /nfs/dbraw/zinc/50/38/60/541503860.db2.gz RPYAZCHBTHNYQX-UHFFFAOYSA-N 1 2 246.310 2.062 20 0 BEADLO Cc1cc(NC(=O)NC[C@@H]2CC23CC3)c(C)c[nH+]1 ZINC000579690763 366981170 /nfs/dbraw/zinc/98/11/70/366981170.db2.gz KXYVLPHDZKMCHE-NSHDSACASA-N 1 2 245.326 2.042 20 0 BEADLO CC[C@@H](F)CSc1[nH+]cnc2c1cnn2C ZINC000440577129 201492492 /nfs/dbraw/zinc/49/24/92/201492492.db2.gz SPLCNEYCAVRBML-SSDOTTSWSA-N 1 2 240.307 2.204 20 0 BEADLO CCN(CC)C(=O)N[C@@H](c1[nH]cc[nH+]1)C(C)C ZINC000579773171 367002998 /nfs/dbraw/zinc/00/29/98/367002998.db2.gz OXJZOUUVFPNURO-SNVBAGLBSA-N 1 2 238.335 2.158 20 0 BEADLO Cc1ccn(Cc2ccc(C)[nH+]c2C)c(=O)c1 ZINC000185368166 367129237 /nfs/dbraw/zinc/12/92/37/367129237.db2.gz QUOFHVWTNSPMRY-UHFFFAOYSA-N 1 2 228.295 2.217 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@]12C[C@H]1CCC2 ZINC000581184922 367285743 /nfs/dbraw/zinc/28/57/43/367285743.db2.gz YQLZEVJDSXKFSB-NOZJJQNGSA-N 1 2 232.283 2.219 20 0 BEADLO CCCN(C(=O)[C@@H]1CCc2c[nH+]cn2C1)C(C)C ZINC000581200084 367293754 /nfs/dbraw/zinc/29/37/54/367293754.db2.gz NUBUGJBVLJOZJF-GFCCVEGCSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2CCOC[C@@H]2C)c(C)[nH+]1 ZINC000194658465 367315986 /nfs/dbraw/zinc/31/59/86/367315986.db2.gz WMTGBJBAAFUUCY-JOYOIKCWSA-N 1 2 248.326 2.310 20 0 BEADLO Cc1c[nH+]c(C)nc1NCC1CCCC1 ZINC000581459373 367480287 /nfs/dbraw/zinc/48/02/87/367480287.db2.gz NIKYTZBZOUYWLR-UHFFFAOYSA-N 1 2 205.305 2.117 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CCC[C@@H](C)C1)c1[nH]cc[nH+]1 ZINC000383273208 367611023 /nfs/dbraw/zinc/61/10/23/367611023.db2.gz ZJRMDSYDDKMOCQ-MXWKQRLJSA-N 1 2 235.331 2.413 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CCC[C@@H](C)[C@H]1C ZINC000581616752 367636054 /nfs/dbraw/zinc/63/60/54/367636054.db2.gz XHGPFHHRZGBKRC-IJLUTSLNSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CCC[C@@H](C)[C@H]1C ZINC000581616752 367636059 /nfs/dbraw/zinc/63/60/59/367636059.db2.gz XHGPFHHRZGBKRC-IJLUTSLNSA-N 1 2 249.358 2.235 20 0 BEADLO CC/C=C/C[NH2+][C@@H](CCC)C(=O)OCC ZINC000384710560 367719219 /nfs/dbraw/zinc/71/92/19/367719219.db2.gz DIMZYQVIWFONSP-AEZGRPFRSA-N 1 2 213.321 2.274 20 0 BEADLO Cc1ccc(N[C@@H]2C[C@H](C)O[C@H]2C)c[nH+]1 ZINC000384650974 367712336 /nfs/dbraw/zinc/71/23/36/367712336.db2.gz UNQPYYKGBGQIOZ-JBLDHEPKSA-N 1 2 206.289 2.368 20 0 BEADLO FC(F)(F)c1cnc(C[NH2+]CC2(F)CC2)nc1 ZINC000581864976 367855152 /nfs/dbraw/zinc/85/51/52/367855152.db2.gz BSDVQRQBKDUXOZ-UHFFFAOYSA-N 1 2 249.211 2.087 20 0 BEADLO Cc1c[nH+]c(C)nc1NC[C@H]1CCCSC1 ZINC000581954081 368019501 /nfs/dbraw/zinc/01/95/01/368019501.db2.gz IZAQGGDACFMMNG-LLVKDONJSA-N 1 2 237.372 2.070 20 0 BEADLO COc1ccc(C)cc1C[N@@H+]1CCOC[C@@H]1C ZINC000046774884 368449594 /nfs/dbraw/zinc/44/95/94/368449594.db2.gz AWNUKZWAGWXLDG-LBPRGKRZSA-N 1 2 235.327 2.224 20 0 BEADLO COc1ccc(C)cc1C[N@H+]1CCOC[C@@H]1C ZINC000046774884 368449597 /nfs/dbraw/zinc/44/95/97/368449597.db2.gz AWNUKZWAGWXLDG-LBPRGKRZSA-N 1 2 235.327 2.224 20 0 BEADLO Cc1ccccc1C(=O)N(C)Cc1[nH+]ccn1C ZINC000061511802 368564547 /nfs/dbraw/zinc/56/45/47/368564547.db2.gz JWXXGSVUJSEPOS-UHFFFAOYSA-N 1 2 243.310 2.001 20 0 BEADLO CC(C)[C@H](C)C(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456409269 202942405 /nfs/dbraw/zinc/94/24/05/202942405.db2.gz ZNATZOKCEXXILA-DCAQKATOSA-N 1 2 235.331 2.297 20 0 BEADLO CCC[N@H+](C)Cc1csc(C(=O)OCC)n1 ZINC000063761543 368595223 /nfs/dbraw/zinc/59/52/23/368595223.db2.gz YJFXWAUMXNAABE-UHFFFAOYSA-N 1 2 242.344 2.162 20 0 BEADLO CCC[N@@H+](C)Cc1csc(C(=O)OCC)n1 ZINC000063761543 368595228 /nfs/dbraw/zinc/59/52/28/368595228.db2.gz YJFXWAUMXNAABE-UHFFFAOYSA-N 1 2 242.344 2.162 20 0 BEADLO Cc1scc(CNc2cc[nH+]c(C)n2)c1C ZINC000399831362 368611657 /nfs/dbraw/zinc/61/16/57/368611657.db2.gz YRFWHZYYNXPRHJ-UHFFFAOYSA-N 1 2 233.340 2.497 20 0 BEADLO Cc1scc(C[NH2+]Cc2ccn[nH]2)c1C ZINC000399855718 368622428 /nfs/dbraw/zinc/62/24/28/368622428.db2.gz MLCJHBHYEAWFJA-UHFFFAOYSA-N 1 2 221.329 2.378 20 0 BEADLO c1c[nH+]c(COCc2cccc3c2CCOC3)[nH]1 ZINC000631015608 370899043 /nfs/dbraw/zinc/89/90/43/370899043.db2.gz UOPINOLKILNWET-UHFFFAOYSA-N 1 2 244.294 2.199 20 0 BEADLO CC[C@H](C)C(=O)NCc1cn2c(cccc2C)[nH+]1 ZINC000068570987 368731459 /nfs/dbraw/zinc/73/14/59/368731459.db2.gz QJIIWVZZPGQYMH-JTQLQIEISA-N 1 2 245.326 2.305 20 0 BEADLO Cc1cc(-n2cc[nH+]c2)nc(-c2ccccn2)n1 ZINC000068660176 368731810 /nfs/dbraw/zinc/73/18/10/368731810.db2.gz RBTWVNNULQBIKK-UHFFFAOYSA-N 1 2 237.266 2.033 20 0 BEADLO CC[C@H](C)C(=O)Nc1nc(C[NH+](C)C)cs1 ZINC000457292964 203035414 /nfs/dbraw/zinc/03/54/14/203035414.db2.gz ORQFDBNNWNMWRK-QMMMGPOBSA-N 1 2 241.360 2.189 20 0 BEADLO Cc1noc(C[N@H+]2CCC[C@H]2c2cccn2C)n1 ZINC000073641857 368811988 /nfs/dbraw/zinc/81/19/88/368811988.db2.gz AWBOOEHDEWZGOL-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1noc(C[N@@H+]2CCC[C@H]2c2cccn2C)n1 ZINC000073641857 368811993 /nfs/dbraw/zinc/81/19/93/368811993.db2.gz AWBOOEHDEWZGOL-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1nc(CCNc2cccc[nH+]2)c(C)o1 ZINC000309709507 326165311 /nfs/dbraw/zinc/16/53/11/326165311.db2.gz PZOJLAPJVHLUMP-UHFFFAOYSA-N 1 2 217.272 2.341 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1[C@@H](C)CCC1(C)C ZINC000616179039 369011712 /nfs/dbraw/zinc/01/17/12/369011712.db2.gz MIXAIYFGETYBTA-QWRGUYRKSA-N 1 2 249.358 2.378 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1[C@@H](C)CCC1(C)C ZINC000616179039 369011719 /nfs/dbraw/zinc/01/17/19/369011719.db2.gz MIXAIYFGETYBTA-QWRGUYRKSA-N 1 2 249.358 2.378 20 0 BEADLO Cc1cc(F)ccc1C[N@H+]1CCOC[C@H]1C ZINC000091814923 369021915 /nfs/dbraw/zinc/02/19/15/369021915.db2.gz CTJAMVFCKJYTDO-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+]1CCOC[C@H]1C ZINC000091814923 369021917 /nfs/dbraw/zinc/02/19/17/369021917.db2.gz CTJAMVFCKJYTDO-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO C[C@H]1COCC[N@@H+]1Cc1cnc(C2CC2)s1 ZINC000091815100 369021977 /nfs/dbraw/zinc/02/19/77/369021977.db2.gz IHUIJBDGTIGCKN-VIFPVBQESA-N 1 2 238.356 2.241 20 0 BEADLO C[C@H]1COCC[N@H+]1Cc1cnc(C2CC2)s1 ZINC000091815100 369021981 /nfs/dbraw/zinc/02/19/81/369021981.db2.gz IHUIJBDGTIGCKN-VIFPVBQESA-N 1 2 238.356 2.241 20 0 BEADLO CC[C@H](CC(F)F)C(=O)Nc1cc[nH+]c(C)c1 ZINC000457557216 203074286 /nfs/dbraw/zinc/07/42/86/203074286.db2.gz IFTKQILMNIYJAA-SECBINFHSA-N 1 2 242.269 2.432 20 0 BEADLO CC(C)CCCCC(=O)NCCn1cc[nH+]c1 ZINC000457457401 203065802 /nfs/dbraw/zinc/06/58/02/203065802.db2.gz XECSYHYOYKPIKZ-UHFFFAOYSA-N 1 2 237.347 2.216 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@H](C)C1CCC1 ZINC000457494591 203068196 /nfs/dbraw/zinc/06/81/96/203068196.db2.gz BGSYBVLGKNFJMK-SECBINFHSA-N 1 2 234.299 2.465 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C1CC(C(C)(C)C)C1 ZINC000457611995 203081287 /nfs/dbraw/zinc/08/12/87/203081287.db2.gz LOWHXILTNYMQHW-UHFFFAOYSA-N 1 2 249.358 2.407 20 0 BEADLO COc1nscc1C[N@H+]1CC=C(C)CC1 ZINC001642594614 1172375408 /nfs/dbraw/zinc/37/54/08/1172375408.db2.gz NIDOHJNJYSMCDM-UHFFFAOYSA-N 1 2 224.329 2.304 20 0 BEADLO COc1nscc1C[N@@H+]1CC=C(C)CC1 ZINC001642594614 1172375414 /nfs/dbraw/zinc/37/54/14/1172375414.db2.gz NIDOHJNJYSMCDM-UHFFFAOYSA-N 1 2 224.329 2.304 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NCCCC1CCC1 ZINC000618620756 369188151 /nfs/dbraw/zinc/18/81/51/369188151.db2.gz ZDRKWTPIQPSVNV-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NCCCC1CCC1 ZINC000618620756 369188152 /nfs/dbraw/zinc/18/81/52/369188152.db2.gz ZDRKWTPIQPSVNV-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO CCC[C@H](NC(=O)Cc1[nH]c[nH+]c1C)C1CCC1 ZINC000458349241 203164431 /nfs/dbraw/zinc/16/44/31/203164431.db2.gz ZDNKHPROZODKDO-LBPRGKRZSA-N 1 2 249.358 2.346 20 0 BEADLO CCC[C@H](NC(=O)Cc1[nH+]c[nH]c1C)C1CCC1 ZINC000458349241 203164433 /nfs/dbraw/zinc/16/44/33/203164433.db2.gz ZDNKHPROZODKDO-LBPRGKRZSA-N 1 2 249.358 2.346 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@H+]1CC=CCC1 ZINC000619049781 369267002 /nfs/dbraw/zinc/26/70/02/369267002.db2.gz ZFQWCGGNXQIMSK-NSHDSACASA-N 1 2 237.324 2.224 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@@H+]1CC=CCC1 ZINC000619049781 369267007 /nfs/dbraw/zinc/26/70/07/369267007.db2.gz ZFQWCGGNXQIMSK-NSHDSACASA-N 1 2 237.324 2.224 20 0 BEADLO COC(=O)[C@@H](c1ccsc1)[N@H+]1CC=CCC1 ZINC000619049780 369267018 /nfs/dbraw/zinc/26/70/18/369267018.db2.gz ZFQWCGGNXQIMSK-LLVKDONJSA-N 1 2 237.324 2.224 20 0 BEADLO COC(=O)[C@@H](c1ccsc1)[N@@H+]1CC=CCC1 ZINC000619049780 369267022 /nfs/dbraw/zinc/26/70/22/369267022.db2.gz ZFQWCGGNXQIMSK-LLVKDONJSA-N 1 2 237.324 2.224 20 0 BEADLO Cc1cccn2c(NC(=O)[C@@H]3CC34CC4)c[nH+]c12 ZINC000619016202 369257922 /nfs/dbraw/zinc/25/79/22/369257922.db2.gz XJQNVEFHNPFJGZ-JTQLQIEISA-N 1 2 241.294 2.381 20 0 BEADLO CC[C@H](C)CCC(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000521643821 259539417 /nfs/dbraw/zinc/53/94/17/259539417.db2.gz QDTDSJWWIQDJRG-VHSXEESVSA-N 1 2 223.320 2.413 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2C[C@]2(C)C(C)C)cc[nH+]1 ZINC000459477399 203286543 /nfs/dbraw/zinc/28/65/43/203286543.db2.gz HCUJTVWNDRXVMD-GXTWGEPZSA-N 1 2 247.342 2.368 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2C[C@H]2CC(C)C)cc[nH+]1 ZINC000459477315 203287112 /nfs/dbraw/zinc/28/71/12/203287112.db2.gz HBJFCQWNONAMLZ-DGCLKSJQSA-N 1 2 247.342 2.368 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2C[C@@]2(C)C(C)C)cc[nH+]1 ZINC000459477405 203288585 /nfs/dbraw/zinc/28/85/85/203288585.db2.gz HCUJTVWNDRXVMD-JSGCOSHPSA-N 1 2 247.342 2.368 20 0 BEADLO CCC(F)(F)CNCc1c[nH+]c2ccccn12 ZINC000623680132 369381763 /nfs/dbraw/zinc/38/17/63/369381763.db2.gz ZAXHGBBDUHJZCE-UHFFFAOYSA-N 1 2 239.269 2.469 20 0 BEADLO CCC(F)(F)C[NH2+]Cc1cnc2ccccn12 ZINC000623680132 369381766 /nfs/dbraw/zinc/38/17/66/369381766.db2.gz ZAXHGBBDUHJZCE-UHFFFAOYSA-N 1 2 239.269 2.469 20 0 BEADLO COC1C[NH+](Cc2ccc([C@@H]3C[C@@H]3C)o2)C1 ZINC000459588112 203307677 /nfs/dbraw/zinc/30/76/77/203307677.db2.gz VVHCXINWBXXGRI-JOYOIKCWSA-N 1 2 221.300 2.234 20 0 BEADLO OCCC1C[NH+](Cc2cccc(Cl)c2F)C1 ZINC000459593272 203309899 /nfs/dbraw/zinc/30/98/99/203309899.db2.gz NXEGUNOYOGPJNR-UHFFFAOYSA-N 1 2 243.709 2.293 20 0 BEADLO FC[C@H]1CCC[N@@H+]1Cc1cnc(C2CC2)nc1 ZINC000459596340 203311473 /nfs/dbraw/zinc/31/14/73/203311473.db2.gz UFXZFTNXOMWBKW-GFCCVEGCSA-N 1 2 235.306 2.288 20 0 BEADLO FC[C@H]1CCC[N@H+]1Cc1cnc(C2CC2)nc1 ZINC000459596340 203311477 /nfs/dbraw/zinc/31/14/77/203311477.db2.gz UFXZFTNXOMWBKW-GFCCVEGCSA-N 1 2 235.306 2.288 20 0 BEADLO Cc1cnc(C[NH+]2CC3(C2)CCCCC3)n1C ZINC000459600105 203312753 /nfs/dbraw/zinc/31/27/53/203312753.db2.gz RYKCCBIXVIKOOL-UHFFFAOYSA-N 1 2 233.359 2.495 20 0 BEADLO Cc1c[nH+]c(CN2CC3(C2)CCCCC3)n1C ZINC000459600105 203312755 /nfs/dbraw/zinc/31/27/55/203312755.db2.gz RYKCCBIXVIKOOL-UHFFFAOYSA-N 1 2 233.359 2.495 20 0 BEADLO CCOC1C[NH+](Cc2ccc(C)cc2OC)C1 ZINC000459603029 203313536 /nfs/dbraw/zinc/31/35/36/203313536.db2.gz GLEABYYTZADCBW-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@@H+]1CCC(C)(C)C ZINC000619433795 369352444 /nfs/dbraw/zinc/35/24/44/369352444.db2.gz XQFMPAPCZVBWIM-UWVGGRQHSA-N 1 2 231.311 2.008 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@H+]1CCC(C)(C)C ZINC000619433795 369352453 /nfs/dbraw/zinc/35/24/53/369352453.db2.gz XQFMPAPCZVBWIM-UWVGGRQHSA-N 1 2 231.311 2.008 20 0 BEADLO CCOC1C[NH+](C/C=C\c2ccccc2)C1 ZINC000459602411 203314702 /nfs/dbraw/zinc/31/47/02/203314702.db2.gz DQTHMKJZOBIBBN-TWGQIWQCSA-N 1 2 217.312 2.421 20 0 BEADLO COCc1cccc(C[NH+]2CC(C)(OC)C2)c1 ZINC000459572734 203304921 /nfs/dbraw/zinc/30/49/21/203304921.db2.gz DVALAGUNUMREJG-UHFFFAOYSA-N 1 2 235.327 2.054 20 0 BEADLO CCOC1(C)C[NH+](Cc2cc3cccnc3o2)C1 ZINC000459616603 203315888 /nfs/dbraw/zinc/31/58/88/203315888.db2.gz GTRPNJHNBNLKFB-UHFFFAOYSA-N 1 2 246.310 2.439 20 0 BEADLO CCOC1(C)C[NH+](Cc2cnccc2C)C1 ZINC000459626517 203320856 /nfs/dbraw/zinc/32/08/56/203320856.db2.gz URDQRWYFRVDSKW-UHFFFAOYSA-N 1 2 220.316 2.001 20 0 BEADLO COCC1(C)C[NH+](Cc2cc(F)ccc2F)C1 ZINC000459623604 203322315 /nfs/dbraw/zinc/32/23/15/203322315.db2.gz RQIJQCMUQKTQNE-UHFFFAOYSA-N 1 2 241.281 2.433 20 0 BEADLO CCNc1[nH+]c(C2CC2)nc2[nH]ccc21 ZINC000631031802 370968480 /nfs/dbraw/zinc/96/84/80/370968480.db2.gz JEHDNHNQJUYTKU-UHFFFAOYSA-N 1 2 202.261 2.219 20 0 BEADLO CC(NC(=O)CCc1c[nH+]c[nH]1)(C1CC1)C1CC1 ZINC000620025464 369672316 /nfs/dbraw/zinc/67/23/16/369672316.db2.gz SAEUJCFKWQPFEM-UHFFFAOYSA-N 1 2 247.342 2.037 20 0 BEADLO CC(NC(=O)CCc1c[nH]c[nH+]1)(C1CC1)C1CC1 ZINC000620025464 369672320 /nfs/dbraw/zinc/67/23/20/369672320.db2.gz SAEUJCFKWQPFEM-UHFFFAOYSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H]1CCN1C(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000620213097 369772305 /nfs/dbraw/zinc/77/23/05/369772305.db2.gz PZBWOKYPFZSIKO-NSHDSACASA-N 1 2 241.294 2.107 20 0 BEADLO COc1ccc2[nH+]c(NCC(C)(C)O)ccc2c1 ZINC000110523005 369850468 /nfs/dbraw/zinc/85/04/68/369850468.db2.gz IQRNRDCSFUYQSC-UHFFFAOYSA-N 1 2 246.310 2.426 20 0 BEADLO Cc1ccnc(NC(=O)CCCn2cc[nH+]c2)c1 ZINC000620412538 369867172 /nfs/dbraw/zinc/86/71/72/369867172.db2.gz HGHIYHKIJXTOBX-UHFFFAOYSA-N 1 2 244.298 2.005 20 0 BEADLO C[C@H](NC(=O)C(C1CC1)C1CC1)c1[nH+]ccn1C ZINC000620603816 369951335 /nfs/dbraw/zinc/95/13/35/369951335.db2.gz NNNASCUURBOHNE-VIFPVBQESA-N 1 2 247.342 2.034 20 0 BEADLO C[C@H](NC(=O)C[C@H]1CCC[C@H]1C)c1[nH+]ccn1C ZINC000620604186 369951457 /nfs/dbraw/zinc/95/14/57/369951457.db2.gz PLWXYWWDNCOWNA-GRYCIOLGSA-N 1 2 249.358 2.424 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CC[C@@H](C)CC1)c1[nH+]ccn1C ZINC000620612067 369957965 /nfs/dbraw/zinc/95/79/65/369957965.db2.gz QOJGGUUJPDGWTJ-IJLUTSLNSA-N 1 2 249.358 2.424 20 0 BEADLO C[C@H](NC(=O)C1=CC[C@H](C)CC1)c1[nH+]ccn1C ZINC000620611908 369958138 /nfs/dbraw/zinc/95/81/38/369958138.db2.gz OXZRZYRMRXOWMO-QWRGUYRKSA-N 1 2 247.342 2.344 20 0 BEADLO C[C@H](NC(=O)[C@@H]1CCCC[C@H]1C)c1[nH+]ccn1C ZINC000620612561 369958421 /nfs/dbraw/zinc/95/84/21/369958421.db2.gz YKWMDGDOUJTVCW-GRYCIOLGSA-N 1 2 249.358 2.424 20 0 BEADLO Cc1cn2ccc(NC(=O)C3CCC3)cc2[nH+]1 ZINC000620648267 369972454 /nfs/dbraw/zinc/97/24/54/369972454.db2.gz ZTRRHFVSGPAUDY-UHFFFAOYSA-N 1 2 229.283 2.381 20 0 BEADLO Cc1ccsc1C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620592092 369945414 /nfs/dbraw/zinc/94/54/14/369945414.db2.gz KAJJKHNWRMRWJZ-SECBINFHSA-N 1 2 249.339 2.281 20 0 BEADLO Cc1cc(C(=O)N[C@@H](C)c2[nH+]ccn2C)c(C)o1 ZINC000620594705 369946805 /nfs/dbraw/zinc/94/68/05/369946805.db2.gz BFCAYUGYKQSNKK-VIFPVBQESA-N 1 2 247.298 2.121 20 0 BEADLO CN(C[C@@H]1CC1(C)C)C(=O)CCCn1cc[nH+]c1 ZINC000621050907 370084443 /nfs/dbraw/zinc/08/44/43/370084443.db2.gz UJRIZPZSWYEFMT-LBPRGKRZSA-N 1 2 249.358 2.168 20 0 BEADLO Cc1nn(C(C)C)cc1CNc1c[nH]c[nH+]1 ZINC000309558080 370229684 /nfs/dbraw/zinc/22/96/84/370229684.db2.gz KFRWZQDIVKRHMY-UHFFFAOYSA-N 1 2 219.292 2.108 20 0 BEADLO Clc1cncc(C[N@H+]2CC=CCC2)c1 ZINC000621275346 370206950 /nfs/dbraw/zinc/20/69/50/370206950.db2.gz RIXQGMITYXQNFJ-UHFFFAOYSA-N 1 2 208.692 2.497 20 0 BEADLO Clc1cncc(C[N@@H+]2CC=CCC2)c1 ZINC000621275346 370206955 /nfs/dbraw/zinc/20/69/55/370206955.db2.gz RIXQGMITYXQNFJ-UHFFFAOYSA-N 1 2 208.692 2.497 20 0 BEADLO Cc1csc([C@@H](C)[NH2+]Cc2nccnc2C)n1 ZINC000621333804 370267292 /nfs/dbraw/zinc/26/72/92/370267292.db2.gz RGFXNQOAVZXLRA-SNVBAGLBSA-N 1 2 248.355 2.401 20 0 BEADLO FC1(F)C[C@H]1CCNc1cc[nH+]c(C2CC2)n1 ZINC000621345776 370280506 /nfs/dbraw/zinc/28/05/06/370280506.db2.gz WKHGMGIWWKQJCT-SECBINFHSA-N 1 2 239.269 2.233 20 0 BEADLO Cc1nccnc1C[N@@H+](C)[C@@H](C)c1cccnc1 ZINC000621722028 370473986 /nfs/dbraw/zinc/47/39/86/370473986.db2.gz JDJNHMGAKPMUKD-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1nccnc1C[N@H+](C)[C@@H](C)c1cccnc1 ZINC000621722028 370473990 /nfs/dbraw/zinc/47/39/90/370473990.db2.gz JDJNHMGAKPMUKD-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO CCc1cc(NCC(C)(C)C[C@H](C)O)nc[nH+]1 ZINC000078339804 370552096 /nfs/dbraw/zinc/55/20/96/370552096.db2.gz BMZWBDQXGLRUIN-JTQLQIEISA-N 1 2 237.347 2.248 20 0 BEADLO CCc1cc(NCC2(O)CCCCC2)nc[nH+]1 ZINC000078598047 370580233 /nfs/dbraw/zinc/58/02/33/370580233.db2.gz UJFLPQISYBGIOH-UHFFFAOYSA-N 1 2 235.331 2.146 20 0 BEADLO CC(C)(C(=O)N[C@@H]1CC12CCCC2)c1c[nH]c[nH+]1 ZINC000621973534 370630110 /nfs/dbraw/zinc/63/01/10/370630110.db2.gz OZZKCOMBOBWYRX-SNVBAGLBSA-N 1 2 247.342 2.136 20 0 BEADLO COCc1ccc(NCc2[nH]cc[nH+]2)cc1OC ZINC000623789575 371095390 /nfs/dbraw/zinc/09/53/90/371095390.db2.gz AJGOIJIJGDEAPL-UHFFFAOYSA-N 1 2 247.298 2.177 20 0 BEADLO CCc1cc(N[C@H](C)CSC)nc[nH+]1 ZINC000124730455 371227120 /nfs/dbraw/zinc/22/71/20/371227120.db2.gz AXESLHWCHYUYSW-MRVPVSSYSA-N 1 2 211.334 2.202 20 0 BEADLO COc1ccc[nH+]c1N(C)CCCOC(C)C ZINC000623988843 371222182 /nfs/dbraw/zinc/22/21/82/371222182.db2.gz ZWGGGAXSTVAIKM-UHFFFAOYSA-N 1 2 238.331 2.342 20 0 BEADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1ccns1 ZINC000624047164 371271977 /nfs/dbraw/zinc/27/19/77/371271977.db2.gz YGLSJNMZQWXJAI-SECBINFHSA-N 1 2 236.344 2.210 20 0 BEADLO C/C=C/CNC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000624223066 371411167 /nfs/dbraw/zinc/41/11/67/371411167.db2.gz NNSOQARYDPUULR-SNAWJCMRSA-N 1 2 233.315 2.074 20 0 BEADLO CC[C@@H](C)C[C@H](CO)Nc1[nH+]cccc1OC ZINC000624330551 371483572 /nfs/dbraw/zinc/48/35/72/371483572.db2.gz YUJOFQLBICKFKQ-GHMZBOCLSA-N 1 2 238.331 2.299 20 0 BEADLO C[C@@H]1CCC[C@H]1CC(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627369735 371587415 /nfs/dbraw/zinc/58/74/15/371587415.db2.gz BKGHDRCUANAILV-MNOVXSKESA-N 1 2 247.342 2.121 20 0 BEADLO C[C@@H]1CCC[C@H]1CC(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627369735 371587417 /nfs/dbraw/zinc/58/74/17/371587417.db2.gz BKGHDRCUANAILV-MNOVXSKESA-N 1 2 247.342 2.121 20 0 BEADLO O=C(C[C@H]1C=CCCC1)N1CCc2[nH]c[nH+]c2C1 ZINC000627371158 371588451 /nfs/dbraw/zinc/58/84/51/371588451.db2.gz WSBHJPNUGFDQBX-NSHDSACASA-N 1 2 245.326 2.041 20 0 BEADLO O=C(C[C@H]1C=CCCC1)N1CCc2[nH+]c[nH]c2C1 ZINC000627371158 371588456 /nfs/dbraw/zinc/58/84/56/371588456.db2.gz WSBHJPNUGFDQBX-NSHDSACASA-N 1 2 245.326 2.041 20 0 BEADLO CC1(C)CCC[C@@H]1C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627370988 371588761 /nfs/dbraw/zinc/58/87/61/371588761.db2.gz SDGIRZLVHVKFJU-SNVBAGLBSA-N 1 2 247.342 2.121 20 0 BEADLO CC1(C)CCC[C@@H]1C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627370988 371588766 /nfs/dbraw/zinc/58/87/66/371588766.db2.gz SDGIRZLVHVKFJU-SNVBAGLBSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@H]1CC=C(C(=O)N2CCc3[nH]c[nH+]c3C2)CC1 ZINC000627373158 371591676 /nfs/dbraw/zinc/59/16/76/371591676.db2.gz JFVZODXKRDQKKE-JTQLQIEISA-N 1 2 245.326 2.041 20 0 BEADLO C[C@H]1CC=C(C(=O)N2CCc3[nH+]c[nH]c3C2)CC1 ZINC000627373158 371591680 /nfs/dbraw/zinc/59/16/80/371591680.db2.gz JFVZODXKRDQKKE-JTQLQIEISA-N 1 2 245.326 2.041 20 0 BEADLO Cc1cc(C(=O)NCC[C@H](C)F)c2[nH+]ccn2c1 ZINC000627535360 371687677 /nfs/dbraw/zinc/68/76/77/371687677.db2.gz KVGZACQZWRNRCV-JTQLQIEISA-N 1 2 249.289 2.121 20 0 BEADLO CCc1cc(NC[C@@H](O)C(CC)CC)nc[nH+]1 ZINC000226530630 371688683 /nfs/dbraw/zinc/68/86/83/371688683.db2.gz QEABCEILHBWRRG-GFCCVEGCSA-N 1 2 237.347 2.248 20 0 BEADLO COc1ccc(NCc2cccnc2)[nH+]c1 ZINC000226949073 371760212 /nfs/dbraw/zinc/76/02/12/371760212.db2.gz OKNAPZDHJNJAAL-UHFFFAOYSA-N 1 2 215.256 2.097 20 0 BEADLO Nc1[nH+]cnc(N[C@@H]2CC=CCC2)c1Cl ZINC000236393752 181808897 /nfs/dbraw/zinc/80/88/97/181808897.db2.gz CTGCNOJHIYGMJK-SSDOTTSWSA-N 1 2 224.695 2.233 20 0 BEADLO Nc1nc[nH+]c(N[C@@H]2CC=CCC2)c1Cl ZINC000236393752 181808901 /nfs/dbraw/zinc/80/89/01/181808901.db2.gz CTGCNOJHIYGMJK-SSDOTTSWSA-N 1 2 224.695 2.233 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C1(C(F)F)CCC1 ZINC000631139348 372207207 /nfs/dbraw/zinc/20/72/07/372207207.db2.gz GBCLBRQGAQHDNP-UHFFFAOYSA-N 1 2 240.253 2.186 20 0 BEADLO CCCCc1cc(N[C@]2(C)CCOC2)nc[nH+]1 ZINC000631181301 372221545 /nfs/dbraw/zinc/22/15/45/372221545.db2.gz APVZPUNOWMNCNY-CYBMUJFWSA-N 1 2 235.331 2.410 20 0 BEADLO CCCCc1cc(N2CCC(=O)[C@H](C)C2)nc[nH+]1 ZINC000631214378 372237625 /nfs/dbraw/zinc/23/76/25/372237625.db2.gz VPSKOSHSHFZTBT-LLVKDONJSA-N 1 2 247.342 2.235 20 0 BEADLO COC[C@](C)(O)CNc1cc2ccccc2c[nH+]1 ZINC000631116156 372203142 /nfs/dbraw/zinc/20/31/42/372203142.db2.gz GZOJPPUQKMXNQD-CQSZACIVSA-N 1 2 246.310 2.044 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@@H](C)c2cnc(C)s2)n1 ZINC000631228919 372250548 /nfs/dbraw/zinc/25/05/48/372250548.db2.gz SCSDJRLMONWVDI-QMMMGPOBSA-N 1 2 236.344 2.334 20 0 BEADLO CC[C@H](O)CNc1cc2ccccc2c[nH+]1 ZINC000631281204 372275011 /nfs/dbraw/zinc/27/50/11/372275011.db2.gz CFKRUZCZUOEKEQ-LBPRGKRZSA-N 1 2 216.284 2.418 20 0 BEADLO Cc1cc(N(C)CCF)nc(-c2ccncc2)[nH+]1 ZINC000631296112 372281855 /nfs/dbraw/zinc/28/18/55/372281855.db2.gz LMHMQNMKOQMVPX-UHFFFAOYSA-N 1 2 246.289 2.253 20 0 BEADLO CO[C@@H]1COC[C@@H]1Nc1cc2ccccc2c[nH+]1 ZINC000631299128 372283207 /nfs/dbraw/zinc/28/32/07/372283207.db2.gz QONMBRXGKXUFQI-QWHCGFSZSA-N 1 2 244.294 2.061 20 0 BEADLO CCCCc1cc(N[C@H]2C[C@@](C)(O)C2)nc[nH+]1 ZINC000631314821 372288052 /nfs/dbraw/zinc/28/80/52/372288052.db2.gz SSDWDEMDMKXDTL-BJHJDKERSA-N 1 2 235.331 2.145 20 0 BEADLO O=C(CC1CCC1)NCCCNc1cccc[nH+]1 ZINC000173585769 181893201 /nfs/dbraw/zinc/89/32/01/181893201.db2.gz OJZVMELWIKDCHW-UHFFFAOYSA-N 1 2 247.342 2.190 20 0 BEADLO CCC[C@H](CCO)Nc1cc[nH+]c2ccncc12 ZINC000631428260 372359281 /nfs/dbraw/zinc/35/92/81/372359281.db2.gz VACFCKRJJZRBDR-LLVKDONJSA-N 1 2 245.326 2.015 20 0 BEADLO Cc1nc(N2CCC(CCF)CC2)cc[nH+]1 ZINC000631448314 372368714 /nfs/dbraw/zinc/36/87/14/372368714.db2.gz KCFSRAJTYJQTBS-UHFFFAOYSA-N 1 2 223.295 2.361 20 0 BEADLO c1nc(C[NH2+][C@@H]2CCCc3ncccc32)co1 ZINC000631605985 372456519 /nfs/dbraw/zinc/45/65/19/372456519.db2.gz CRPFGBVKYPLZJM-CYBMUJFWSA-N 1 2 229.283 2.237 20 0 BEADLO O=C(COc1cc[nH+]cc1)Nc1cccc(F)c1 ZINC000356103125 182004194 /nfs/dbraw/zinc/00/41/94/182004194.db2.gz YACZSZAGFOMKRM-UHFFFAOYSA-N 1 2 246.241 2.238 20 0 BEADLO O=C(COc1cc[nH+]cc1)NCC1CCCCC1 ZINC000292326803 182005043 /nfs/dbraw/zinc/00/50/43/182005043.db2.gz BXTADRXQRUGXMH-UHFFFAOYSA-N 1 2 248.326 2.157 20 0 BEADLO C[C@@H](NC(=O)C1(C(F)F)CCC1)c1[nH]cc[nH+]1 ZINC000633169641 373318801 /nfs/dbraw/zinc/31/88/01/373318801.db2.gz DVTYQZWZAYRJDY-SSDOTTSWSA-N 1 2 243.257 2.022 20 0 BEADLO O=C(NCCNc1cccc[nH+]1)C1=CCCCC1 ZINC000289780459 182188819 /nfs/dbraw/zinc/18/88/19/182188819.db2.gz LTDFFQFELFKYDX-UHFFFAOYSA-N 1 2 245.326 2.110 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)[C@H]1C[C@H]1C1CCCCC1 ZINC000120139706 182274218 /nfs/dbraw/zinc/27/42/18/182274218.db2.gz JYUANKFQPHLDHH-RYUDHWBXSA-N 1 2 247.342 2.242 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)[C@@H]1C[C@H]1C1CCCCC1 ZINC000120139531 182274389 /nfs/dbraw/zinc/27/43/89/182274389.db2.gz JYUANKFQPHLDHH-NWDGAFQWSA-N 1 2 247.342 2.242 20 0 BEADLO COCC(C)(C)C[N@H+](CC(F)F)C1CC1 ZINC000426419931 206046596 /nfs/dbraw/zinc/04/65/96/206046596.db2.gz NOFKWKIRBLMIKT-UHFFFAOYSA-N 1 2 221.291 2.389 20 0 BEADLO COCC(C)(C)C[N@@H+](CC(F)F)C1CC1 ZINC000426419931 206046601 /nfs/dbraw/zinc/04/66/01/206046601.db2.gz NOFKWKIRBLMIKT-UHFFFAOYSA-N 1 2 221.291 2.389 20 0 BEADLO C[N@H+](Cc1cn(C(C)(C)C)nn1)[C@H]1CC1(C)C ZINC000426577576 206053389 /nfs/dbraw/zinc/05/33/89/206053389.db2.gz CYIOSESPCHBSKG-NSHDSACASA-N 1 2 236.363 2.263 20 0 BEADLO C[N@@H+](Cc1cn(C(C)(C)C)nn1)[C@H]1CC1(C)C ZINC000426577576 206053394 /nfs/dbraw/zinc/05/33/94/206053394.db2.gz CYIOSESPCHBSKG-NSHDSACASA-N 1 2 236.363 2.263 20 0 BEADLO CCCCOC1CC[NH+](Cc2cocn2)CC1 ZINC000432727768 206063691 /nfs/dbraw/zinc/06/36/91/206063691.db2.gz KKYXBRGWBCNCLP-UHFFFAOYSA-N 1 2 238.331 2.456 20 0 BEADLO CCO[C@@H](C[NH2+]Cc1ccn[nH]1)c1ccccc1 ZINC000194463902 206089663 /nfs/dbraw/zinc/08/96/63/206089663.db2.gz URMRBBJQQAGYBO-AWEZNQCLSA-N 1 2 245.326 2.277 20 0 BEADLO CC[C@@H](F)C[NH2+][C@H](CO)c1c(F)cccc1F ZINC000440482855 206077933 /nfs/dbraw/zinc/07/79/33/206077933.db2.gz DRUSTEDNRTVSOP-LDYMZIIASA-N 1 2 247.260 2.336 20 0 BEADLO CC[C@H](F)C[NH+]1CCC(c2ccn[nH]2)CC1 ZINC000440701675 206080123 /nfs/dbraw/zinc/08/01/23/206080123.db2.gz JJIWCOBYEPJOBR-NSHDSACASA-N 1 2 225.311 2.337 20 0 BEADLO C[C@@H]1CN(c2cccc[nH+]2)[C@@H](C)[C@@H](C)O1 ZINC000445663523 206085011 /nfs/dbraw/zinc/08/50/11/206085011.db2.gz HOOHXNWBIIKYRQ-OUAUKWLOSA-N 1 2 206.289 2.084 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)NC1CCC1 ZINC000290834236 182385176 /nfs/dbraw/zinc/38/51/76/182385176.db2.gz XZRSGVSOAZUACC-UHFFFAOYSA-N 1 2 230.271 2.008 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)[C@H]1CCCS1 ZINC000294775367 182385261 /nfs/dbraw/zinc/38/52/61/182385261.db2.gz BGUSEQQRCVEDMQ-SNVBAGLBSA-N 1 2 247.323 2.168 20 0 BEADLO O=C(Nc1cc[nH+]cc1O)c1ccccc1F ZINC000109889576 182387723 /nfs/dbraw/zinc/38/77/23/182387723.db2.gz FWBSRKJFGFLUKN-UHFFFAOYSA-N 1 2 232.214 2.179 20 0 BEADLO CC(C)(C)c1nnc(C[N@@H+]2C[C@H]3CCCC[C@H]32)[nH]1 ZINC001643704713 1172490073 /nfs/dbraw/zinc/49/00/73/1172490073.db2.gz UCQCQNRHXXGNSI-GHMZBOCLSA-N 1 2 248.374 2.477 20 0 BEADLO CC(C)(C)c1nnc(C[N@H+]2C[C@H]3CCCC[C@H]32)[nH]1 ZINC001643704713 1172490077 /nfs/dbraw/zinc/49/00/77/1172490077.db2.gz UCQCQNRHXXGNSI-GHMZBOCLSA-N 1 2 248.374 2.477 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@@H]3CCC[C@@H]32)sn1 ZINC001643877304 1172505594 /nfs/dbraw/zinc/50/55/94/1172505594.db2.gz CAKFDACILPYPAH-NWDGAFQWSA-N 1 2 238.356 2.205 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@@H]3CCC[C@@H]32)sn1 ZINC001643877304 1172505599 /nfs/dbraw/zinc/50/55/99/1172505599.db2.gz CAKFDACILPYPAH-NWDGAFQWSA-N 1 2 238.356 2.205 20 0 BEADLO OCC(F)(F)C[NH2+][C@H]1CCCc2sccc21 ZINC000231793012 183034911 /nfs/dbraw/zinc/03/49/11/183034911.db2.gz KCTBUZVAVYWAGS-VIFPVBQESA-N 1 2 247.310 2.343 20 0 BEADLO OCC(F)(F)C[NH2+][C@H](c1ccccc1)C1CC1 ZINC000184707184 183035925 /nfs/dbraw/zinc/03/59/25/183035925.db2.gz RFBJUNRELFCGBW-GFCCVEGCSA-N 1 2 241.281 2.355 20 0 BEADLO OCCC[N@H+](Cc1cocn1)Cc1ccccc1 ZINC000277966530 183054450 /nfs/dbraw/zinc/05/44/50/183054450.db2.gz JKMRCTAHUWKPEB-UHFFFAOYSA-N 1 2 246.310 2.059 20 0 BEADLO OCCC[N@@H+](Cc1cocn1)Cc1ccccc1 ZINC000277966530 183054452 /nfs/dbraw/zinc/05/44/52/183054452.db2.gz JKMRCTAHUWKPEB-UHFFFAOYSA-N 1 2 246.310 2.059 20 0 BEADLO OCC[C@@H](Nc1cccc[nH+]1)c1ccco1 ZINC000274464576 183091809 /nfs/dbraw/zinc/09/18/09/183091809.db2.gz YCEJQRWVIUAVQU-SNVBAGLBSA-N 1 2 218.256 2.210 20 0 BEADLO CCCC[C@H]([NH2+][C@H]1CSC[C@@H]1C)C(=O)OC ZINC000310002924 169013482 /nfs/dbraw/zinc/01/34/82/169013482.db2.gz FMSJELPPXCBLEO-DCAQKATOSA-N 1 2 245.388 2.059 20 0 BEADLO OC[C@@H]([NH2+]CCF)c1cccc(Cl)c1F ZINC000308872801 183108315 /nfs/dbraw/zinc/10/83/15/183108315.db2.gz LJCQYUDQAPQJLA-SECBINFHSA-N 1 2 235.661 2.072 20 0 BEADLO OC[C@@]1(F)CC[N@H+](Cc2cccc(Cl)c2)C1 ZINC000335926016 183134173 /nfs/dbraw/zinc/13/41/73/183134173.db2.gz NIGHEUNFBYJEOV-GFCCVEGCSA-N 1 2 243.709 2.246 20 0 BEADLO OC[C@@]1(F)CC[N@@H+](Cc2cccc(Cl)c2)C1 ZINC000335926016 183134175 /nfs/dbraw/zinc/13/41/75/183134175.db2.gz NIGHEUNFBYJEOV-GFCCVEGCSA-N 1 2 243.709 2.246 20 0 BEADLO OC[C@@]1(F)CCC[N@H+](Cc2ccc(F)cc2)C1 ZINC000286707864 183134814 /nfs/dbraw/zinc/13/48/14/183134814.db2.gz BQWVJLBJTOTHNU-CYBMUJFWSA-N 1 2 241.281 2.122 20 0 BEADLO OC[C@@]1(F)CCC[N@@H+](Cc2ccc(F)cc2)C1 ZINC000286707864 183134816 /nfs/dbraw/zinc/13/48/16/183134816.db2.gz BQWVJLBJTOTHNU-CYBMUJFWSA-N 1 2 241.281 2.122 20 0 BEADLO OC[C@@]1(F)CC[N@H+](Cc2sccc2Cl)C1 ZINC000334155137 183134950 /nfs/dbraw/zinc/13/49/50/183134950.db2.gz UGSPFVXFYFXDPS-SNVBAGLBSA-N 1 2 249.738 2.308 20 0 BEADLO OC[C@@]1(F)CC[N@@H+](Cc2sccc2Cl)C1 ZINC000334155137 183134952 /nfs/dbraw/zinc/13/49/52/183134952.db2.gz UGSPFVXFYFXDPS-SNVBAGLBSA-N 1 2 249.738 2.308 20 0 BEADLO OC[C@H](CNc1ccc2ccccc2[nH+]1)C1CC1 ZINC000357777761 183136850 /nfs/dbraw/zinc/13/68/50/183136850.db2.gz AULOCLMAUSNSFI-ZDUSSCGKSA-N 1 2 242.322 2.087 20 0 BEADLO OC[C@H]([NH2+]CCF)c1cccc(Cl)c1F ZINC000308872803 183139674 /nfs/dbraw/zinc/13/96/74/183139674.db2.gz LJCQYUDQAPQJLA-VIFPVBQESA-N 1 2 235.661 2.072 20 0 BEADLO OC[C@H](Nc1cccc[nH+]1)c1ccsc1 ZINC000302288605 183142693 /nfs/dbraw/zinc/14/26/93/183142693.db2.gz WGKYGHJUQKCQHY-JTQLQIEISA-N 1 2 220.297 2.289 20 0 BEADLO OC[C@@H]1C[C@H](F)C[N@@H+]1Cc1ccsc1Cl ZINC000334154834 183128815 /nfs/dbraw/zinc/12/88/15/183128815.db2.gz SQXMNBWKBZKXKD-IUCAKERBSA-N 1 2 249.738 2.306 20 0 BEADLO OC[C@@H]1C[C@H](F)C[N@H+]1Cc1ccsc1Cl ZINC000334154834 183128817 /nfs/dbraw/zinc/12/88/17/183128817.db2.gz SQXMNBWKBZKXKD-IUCAKERBSA-N 1 2 249.738 2.306 20 0 BEADLO OC[C@]1(F)CCC[N@H+](Cc2cccc(F)c2)C1 ZINC000286821536 183158257 /nfs/dbraw/zinc/15/82/57/183158257.db2.gz KLKOCDYIMKEXGE-ZDUSSCGKSA-N 1 2 241.281 2.122 20 0 BEADLO OC[C@]1(F)CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000286821536 183158259 /nfs/dbraw/zinc/15/82/59/183158259.db2.gz KLKOCDYIMKEXGE-ZDUSSCGKSA-N 1 2 241.281 2.122 20 0 BEADLO OCc1ccc(CSCCn2cc[nH+]c2)cc1 ZINC000180744656 183165410 /nfs/dbraw/zinc/16/54/10/183165410.db2.gz MIOBUPDVGINTCL-UHFFFAOYSA-N 1 2 248.351 2.309 20 0 BEADLO CCCN(C(=O)c1ccc2[nH+]ccn2c1)C1CC1 ZINC000171482258 169047963 /nfs/dbraw/zinc/04/79/63/169047963.db2.gz JDRNWTXVJKODMR-UHFFFAOYSA-N 1 2 243.310 2.349 20 0 BEADLO O[C@@H]1CC[C@H]1Nc1ccc2ccccc2[nH+]1 ZINC000335605617 183204515 /nfs/dbraw/zinc/20/45/15/183204515.db2.gz UHNLRZQCJYVBJE-VXGBXAGGSA-N 1 2 214.268 2.170 20 0 BEADLO CCCN(C)C(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000299349586 169061913 /nfs/dbraw/zinc/06/19/13/169061913.db2.gz GPPMRVIKRLNADK-UHFFFAOYSA-N 1 2 243.310 2.354 20 0 BEADLO O[C@H](C[N@@H+]1CCC=C(F)C1)c1ccc(F)cc1 ZINC000272589342 183220128 /nfs/dbraw/zinc/22/01/28/183220128.db2.gz XANUCLBRUODDLE-CYBMUJFWSA-N 1 2 239.265 2.418 20 0 BEADLO O[C@H](C[N@H+]1CCC=C(F)C1)c1ccc(F)cc1 ZINC000272589342 183220129 /nfs/dbraw/zinc/22/01/29/183220129.db2.gz XANUCLBRUODDLE-CYBMUJFWSA-N 1 2 239.265 2.418 20 0 BEADLO O[C@H]1CCC[N@H+](Cc2cc(F)c(F)c(F)c2)C1 ZINC000158773439 183234432 /nfs/dbraw/zinc/23/44/32/183234432.db2.gz KHYKCYQVCXJPIC-VIFPVBQESA-N 1 2 245.244 2.061 20 0 BEADLO O[C@H]1CCC[N@@H+](Cc2cc(F)c(F)c(F)c2)C1 ZINC000158773439 183234434 /nfs/dbraw/zinc/23/44/34/183234434.db2.gz KHYKCYQVCXJPIC-VIFPVBQESA-N 1 2 245.244 2.061 20 0 BEADLO O[C@H]1CCC[C@@H](CNc2cc[nH+]c(C3CC3)n2)C1 ZINC000301394145 183235624 /nfs/dbraw/zinc/23/56/24/183235624.db2.gz KEOZVBRYQXRQAR-PWSUYJOCSA-N 1 2 247.342 2.317 20 0 BEADLO CCCN(CCC)C(=O)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000364764625 169144552 /nfs/dbraw/zinc/14/45/52/169144552.db2.gz OTAXUBICUHFDMA-NSHDSACASA-N 1 2 249.358 2.478 20 0 BEADLO Oc1cccc(C[N@@H+]2CCCOCC2)c1Cl ZINC000328209428 183290149 /nfs/dbraw/zinc/29/01/49/183290149.db2.gz IFGPZHKXZHHSCR-UHFFFAOYSA-N 1 2 241.718 2.268 20 0 BEADLO Oc1cccc(C[N@H+]2CCCOCC2)c1Cl ZINC000328209428 183290151 /nfs/dbraw/zinc/29/01/51/183290151.db2.gz IFGPZHKXZHHSCR-UHFFFAOYSA-N 1 2 241.718 2.268 20 0 BEADLO CCCN(CCO)c1cc(C)[nH+]c(C(C)C)n1 ZINC000042453423 169169416 /nfs/dbraw/zinc/16/94/16/169169416.db2.gz PDFYMQKMVOTFFX-UHFFFAOYSA-N 1 2 237.347 2.117 20 0 BEADLO c1c[nH]c(C[NH+]2CCC(OC3CCCC3)CC2)n1 ZINC000111210934 183323444 /nfs/dbraw/zinc/32/34/44/183323444.db2.gz AWADXPGXDRYPET-UHFFFAOYSA-N 1 2 249.358 2.333 20 0 BEADLO c1c[nH]c(CCNc2cc[nH+]c(C3CC3)n2)c1 ZINC000272257470 183323631 /nfs/dbraw/zinc/32/36/31/183323631.db2.gz MKBNMNSYYZHXKW-UHFFFAOYSA-N 1 2 228.299 2.337 20 0 BEADLO c1c[nH+]c(COCc2csc(C3CC3)n2)[nH]1 ZINC000180031655 183328166 /nfs/dbraw/zinc/32/81/66/183328166.db2.gz MUOYYLUSELYLTC-UHFFFAOYSA-N 1 2 235.312 2.460 20 0 BEADLO c1cn(Cc2ccc(-c3ccncc3)nc2)c[nH+]1 ZINC000084618074 183329336 /nfs/dbraw/zinc/32/93/36/183329336.db2.gz MBAVDMJPGMKVTG-UHFFFAOYSA-N 1 2 236.278 2.388 20 0 BEADLO c1cc(C[N@@H+]2CCc3sccc3C2)no1 ZINC000122646807 183346611 /nfs/dbraw/zinc/34/66/11/183346611.db2.gz MUHRBBLORNEIDZ-UHFFFAOYSA-N 1 2 220.297 2.294 20 0 BEADLO c1cc(C[N@H+]2CCc3sccc3C2)no1 ZINC000122646807 183346614 /nfs/dbraw/zinc/34/66/14/183346614.db2.gz MUHRBBLORNEIDZ-UHFFFAOYSA-N 1 2 220.297 2.294 20 0 BEADLO c1cc(C[N@@H+]2CCc3ccsc3C2)n[nH]1 ZINC000127090221 183347456 /nfs/dbraw/zinc/34/74/56/183347456.db2.gz PYZCBTSQGSMSAY-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO c1cc(C[N@H+]2CCc3ccsc3C2)n[nH]1 ZINC000127090221 183347457 /nfs/dbraw/zinc/34/74/57/183347457.db2.gz PYZCBTSQGSMSAY-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO c1cc(NC[C@@H]2CCCOC2)nc(C2CC2)[nH+]1 ZINC000264705167 183357038 /nfs/dbraw/zinc/35/70/38/183357038.db2.gz REAXNCKCPPFRGX-JTQLQIEISA-N 1 2 233.315 2.193 20 0 BEADLO c1nnnn1-c1ccc([NH2+]CC2CCCC2)cc1 ZINC000050271405 183334157 /nfs/dbraw/zinc/33/41/57/183334157.db2.gz GLUMBGQNWSKALG-UHFFFAOYSA-N 1 2 243.314 2.264 20 0 BEADLO c1ncc(C[N@@H+]2CCC[C@@H]2c2ccncc2)[nH]1 ZINC000188239894 183364054 /nfs/dbraw/zinc/36/40/54/183364054.db2.gz DCMGMQCYHJBEJE-CYBMUJFWSA-N 1 2 228.299 2.142 20 0 BEADLO c1ncc(C[N@H+]2CCC[C@@H]2c2ccncc2)[nH]1 ZINC000188239894 183364055 /nfs/dbraw/zinc/36/40/55/183364055.db2.gz DCMGMQCYHJBEJE-CYBMUJFWSA-N 1 2 228.299 2.142 20 0 BEADLO c1cc(C[N@@H+]2CCC[C@@H]2c2ccncc2)n[nH]1 ZINC000284215154 183364127 /nfs/dbraw/zinc/36/41/27/183364127.db2.gz ZNIRAWVAWZZJNO-CYBMUJFWSA-N 1 2 228.299 2.142 20 0 BEADLO c1cc(C[N@H+]2CCC[C@@H]2c2ccncc2)n[nH]1 ZINC000284215154 183364128 /nfs/dbraw/zinc/36/41/28/183364128.db2.gz ZNIRAWVAWZZJNO-CYBMUJFWSA-N 1 2 228.299 2.142 20 0 BEADLO c1cc2c(s1)C[N@H+](Cc1cnns1)CC2 ZINC000296346240 183372942 /nfs/dbraw/zinc/37/29/42/183372942.db2.gz QTVMKCLFSSXSJD-UHFFFAOYSA-N 1 2 237.353 2.158 20 0 BEADLO c1cc2c(s1)C[N@@H+](Cc1cnns1)CC2 ZINC000296346240 183372944 /nfs/dbraw/zinc/37/29/44/183372944.db2.gz QTVMKCLFSSXSJD-UHFFFAOYSA-N 1 2 237.353 2.158 20 0 BEADLO c1sc([C@@H]2COCC[NH2+]2)nc1-c1ccccc1 ZINC000076136747 183382175 /nfs/dbraw/zinc/38/21/75/183382175.db2.gz WYLRTYVYEPJSMV-NSHDSACASA-N 1 2 246.335 2.471 20 0 BEADLO c1nnsc1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC000290159749 183361305 /nfs/dbraw/zinc/36/13/05/183361305.db2.gz XHZNFPQDYOEVOA-LBPRGKRZSA-N 1 2 246.339 2.270 20 0 BEADLO c1nnsc1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000290159749 183361306 /nfs/dbraw/zinc/36/13/06/183361306.db2.gz XHZNFPQDYOEVOA-LBPRGKRZSA-N 1 2 246.339 2.270 20 0 BEADLO CCC[NH2+][C@@H](C(=O)OC)c1ccccc1C ZINC000037459249 169273989 /nfs/dbraw/zinc/27/39/89/169273989.db2.gz VDWLJOUJPVPDJM-GFCCVEGCSA-N 1 2 221.300 2.209 20 0 BEADLO CCCSCC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000355302432 169338002 /nfs/dbraw/zinc/33/80/02/169338002.db2.gz FNDFOJGHZYSWMD-UHFFFAOYSA-N 1 2 249.339 2.416 20 0 BEADLO CCC[C@@H](C)C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000105337111 169348735 /nfs/dbraw/zinc/34/87/35/169348735.db2.gz SLHXRZVDEWISAP-GFCCVEGCSA-N 1 2 249.358 2.483 20 0 BEADLO CCC[C@@H](C)CC(=O)N1CCn2c[nH+]cc2C1 ZINC000290942126 169354898 /nfs/dbraw/zinc/35/48/98/169354898.db2.gz OPMVKTYJDAYHMA-LLVKDONJSA-N 1 2 235.331 2.052 20 0 BEADLO CCC[C@@H](C)CC(=O)N1CCn2cc(C)[nH+]c2C1 ZINC000374656212 169355105 /nfs/dbraw/zinc/35/51/05/169355105.db2.gz ASWGMDNEYKRSPO-LLVKDONJSA-N 1 2 249.358 2.360 20 0 BEADLO CCC[C@@H](C)c1nc(Cc2c[nH+]cn2C)no1 ZINC000357936860 169375495 /nfs/dbraw/zinc/37/54/95/169375495.db2.gz OHWLQSGDNMESHR-SECBINFHSA-N 1 2 234.303 2.298 20 0 BEADLO CCC[C@H]([NH2+][C@H]1CSC1(C)C)C(=O)OCC ZINC000310039950 169513680 /nfs/dbraw/zinc/51/36/80/169513680.db2.gz XLPQPCPRBJNOMM-UWVGGRQHSA-N 1 2 245.388 2.202 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C[C@@H]1CCCCO1 ZINC000087322206 383824839 /nfs/dbraw/zinc/82/48/39/383824839.db2.gz HSPKEAIKAHBRHT-NSHDSACASA-N 1 2 234.299 2.288 20 0 BEADLO Fc1ccc(F)c(C[NH2+][C@H]2CCn3ccnc32)c1 ZINC000293834004 383825187 /nfs/dbraw/zinc/82/51/87/383825187.db2.gz BNDOMSGYBYXLLG-LBPRGKRZSA-N 1 2 249.264 2.396 20 0 BEADLO CN(C)c1cccnc1CNc1cccc[nH+]1 ZINC000357625450 383907252 /nfs/dbraw/zinc/90/72/52/383907252.db2.gz WFSZLLYASAHMPR-UHFFFAOYSA-N 1 2 228.299 2.155 20 0 BEADLO CCN(CC(C)(C)C)C(=O)CCc1c[nH+]c[nH]1 ZINC000291123157 383913895 /nfs/dbraw/zinc/91/38/95/383913895.db2.gz DCXGTRJPJAKVLF-UHFFFAOYSA-N 1 2 237.347 2.237 20 0 BEADLO CCN(CC(C)(C)C)C(=O)CCc1c[nH]c[nH+]1 ZINC000291123157 383913902 /nfs/dbraw/zinc/91/39/02/383913902.db2.gz DCXGTRJPJAKVLF-UHFFFAOYSA-N 1 2 237.347 2.237 20 0 BEADLO Cc1[nH]ncc1CNc1cccc(C[NH+](C)C)c1 ZINC000036979977 383922955 /nfs/dbraw/zinc/92/29/55/383922955.db2.gz BEIJJYKBQJEMSI-UHFFFAOYSA-N 1 2 244.342 2.392 20 0 BEADLO CC[C@@H]([NH2+]Cc1ncn(C)n1)c1cccs1 ZINC000090969197 383924335 /nfs/dbraw/zinc/92/43/35/383924335.db2.gz GJKPHNVGJSGMAI-SECBINFHSA-N 1 2 236.344 2.118 20 0 BEADLO CC[S@@](=O)Cc1[nH+]ccn1Cc1ccccc1 ZINC000089104834 383934122 /nfs/dbraw/zinc/93/41/22/383934122.db2.gz DOFRAJOQNMJJCK-KRWDZBQOSA-N 1 2 248.351 2.200 20 0 BEADLO CC[C@H]([NH2+][C@H]1C[C@H](C)N(C2CC2)C1)C(F)F ZINC000449364815 383993706 /nfs/dbraw/zinc/99/37/06/383993706.db2.gz UJUBUVYZYQVSTE-QXEWZRGKSA-N 1 2 232.318 2.245 20 0 BEADLO C[C@H]1C[C@@H]([NH2+]Cc2ccccn2)c2nccn21 ZINC000345353386 383952931 /nfs/dbraw/zinc/95/29/31/383952931.db2.gz KJOVJJVHLFPLDJ-CMPLNLGQSA-N 1 2 228.299 2.074 20 0 BEADLO C[C@H](CC(=O)NC1(C2(C)CC2)CC1)n1cc[nH+]c1 ZINC000569367815 383955744 /nfs/dbraw/zinc/95/57/44/383955744.db2.gz PKYNCFDBIWFDDS-LLVKDONJSA-N 1 2 247.342 2.283 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCn2ccnc21)c1ccccn1 ZINC000345355662 383956846 /nfs/dbraw/zinc/95/68/46/383956846.db2.gz SVTDCUYMBSBRFE-CMPLNLGQSA-N 1 2 228.299 2.074 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H](C)Cc1ccccc1C ZINC000090274472 384040305 /nfs/dbraw/zinc/04/03/05/384040305.db2.gz WYWUYEKOAWUSKG-NWDGAFQWSA-N 1 2 235.327 2.077 20 0 BEADLO CC[C@H]([NH2+]Cc1ncn(C)n1)c1ccc(C)cc1 ZINC000090969931 384085301 /nfs/dbraw/zinc/08/53/01/384085301.db2.gz CLVQKNXLSSAURS-ZDUSSCGKSA-N 1 2 244.342 2.364 20 0 BEADLO Cn1cnc(C[NH2+][C@H]2CCCc3sccc32)n1 ZINC000090969348 384086777 /nfs/dbraw/zinc/08/67/77/384086777.db2.gz QJTNFXTWOMKRPG-JTQLQIEISA-N 1 2 248.355 2.044 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2ncn(C)n2)cc1C ZINC000090969777 384086990 /nfs/dbraw/zinc/08/69/90/384086990.db2.gz OZASUQAPSQKBHO-GFCCVEGCSA-N 1 2 244.342 2.283 20 0 BEADLO Cc1nc(C)c(C[NH2+]C(CF)CF)s1 ZINC000449380252 384089756 /nfs/dbraw/zinc/08/97/56/384089756.db2.gz MLAWCXRRFDCMQE-UHFFFAOYSA-N 1 2 220.288 2.157 20 0 BEADLO Clc1nc(C[NH+]2CCCC2)cs1 ZINC000114878423 384059775 /nfs/dbraw/zinc/05/97/75/384059775.db2.gz OIQSQNXGUIPZIV-UHFFFAOYSA-N 1 2 202.710 2.392 20 0 BEADLO C[C@@H](CC(=O)N(C)C(C)(C)C)n1cc[nH+]c1 ZINC000569345436 384117832 /nfs/dbraw/zinc/11/78/32/384117832.db2.gz QVDGZLUAJNRTDL-JTQLQIEISA-N 1 2 223.320 2.091 20 0 BEADLO COc1cc(C)ccc1C[NH2+]C(CF)CF ZINC000449381048 384097303 /nfs/dbraw/zinc/09/73/03/384097303.db2.gz QHUWYMFKVXFRDU-UHFFFAOYSA-N 1 2 229.270 2.401 20 0 BEADLO Cc1csc(C[N@@H+]2CCOC(C)(C)[C@@H]2C)n1 ZINC000336552631 384113919 /nfs/dbraw/zinc/11/39/19/384113919.db2.gz LOIYQIIYFFNIRK-JTQLQIEISA-N 1 2 240.372 2.451 20 0 BEADLO Cc1csc(C[N@H+]2CCOC(C)(C)[C@@H]2C)n1 ZINC000336552631 384113926 /nfs/dbraw/zinc/11/39/26/384113926.db2.gz LOIYQIIYFFNIRK-JTQLQIEISA-N 1 2 240.372 2.451 20 0 BEADLO CC(C)(C)c1n[nH]cc1C[NH2+]C(CF)CF ZINC000449380708 384092501 /nfs/dbraw/zinc/09/25/01/384092501.db2.gz OKYPEWKTXHXIND-UHFFFAOYSA-N 1 2 231.290 2.104 20 0 BEADLO Cc1csc(C(C)(C)NCc2[nH]cc[nH+]2)n1 ZINC000116381695 384130517 /nfs/dbraw/zinc/13/05/17/384130517.db2.gz VFYBBTPASWZTEA-UHFFFAOYSA-N 1 2 236.344 2.200 20 0 BEADLO Cc1csc(C(C)(C)[NH2+]Cc2ncc[nH]2)n1 ZINC000116381695 384130523 /nfs/dbraw/zinc/13/05/23/384130523.db2.gz VFYBBTPASWZTEA-UHFFFAOYSA-N 1 2 236.344 2.200 20 0 BEADLO CC[C@H](Cc1ccccc1)[NH2+][C@H](C)C(=O)OC ZINC000116386844 384131662 /nfs/dbraw/zinc/13/16/62/384131662.db2.gz HTEJEKCFBZISRP-DGCLKSJQSA-N 1 2 235.327 2.159 20 0 BEADLO CCc1nc(N2CCC[C@H]2CF)cc(C)[nH+]1 ZINC000294001180 384175141 /nfs/dbraw/zinc/17/51/41/384175141.db2.gz JNKBXLWKLDZCRF-JTQLQIEISA-N 1 2 223.295 2.286 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N(C1CCC1)C1CCC1 ZINC000294006121 384181935 /nfs/dbraw/zinc/18/19/35/384181935.db2.gz XRULDYVALCLCTC-UHFFFAOYSA-N 1 2 247.342 2.276 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N(C1CCC1)C1CCC1 ZINC000294006121 384181938 /nfs/dbraw/zinc/18/19/38/384181938.db2.gz XRULDYVALCLCTC-UHFFFAOYSA-N 1 2 247.342 2.276 20 0 BEADLO Cc1cc(C)c(C[NH2+]Cc2ncn(C)n2)cc1C ZINC000092852254 384196764 /nfs/dbraw/zinc/19/67/64/384196764.db2.gz ZQVXFIBQNALDTD-UHFFFAOYSA-N 1 2 244.342 2.030 20 0 BEADLO CC(=O)Nc1c[nH+]ccc1OC(C)(C)C ZINC000132468311 384230931 /nfs/dbraw/zinc/23/09/31/384230931.db2.gz XSAVUJNIAJGISC-UHFFFAOYSA-N 1 2 208.261 2.217 20 0 BEADLO Cn1nccc1C[N@@H+]1CCc2cccc(F)c2C1 ZINC000093454293 384238612 /nfs/dbraw/zinc/23/86/12/384238612.db2.gz GQZNWSMJLNPCIP-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1nccc1C[N@H+]1CCc2cccc(F)c2C1 ZINC000093454293 384238614 /nfs/dbraw/zinc/23/86/14/384238614.db2.gz GQZNWSMJLNPCIP-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2cnc(C)s2)CCO1 ZINC000132185537 384219871 /nfs/dbraw/zinc/21/98/71/384219871.db2.gz IZRVYFQCRPTOSS-LLVKDONJSA-N 1 2 240.372 2.452 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2cnc(C)s2)CCO1 ZINC000132185537 384219880 /nfs/dbraw/zinc/21/98/80/384219880.db2.gz IZRVYFQCRPTOSS-LLVKDONJSA-N 1 2 240.372 2.452 20 0 BEADLO C[N@H+](Cc1cc(F)c(F)cc1F)[C@H]1CCOC1 ZINC000132180916 384220947 /nfs/dbraw/zinc/22/09/47/384220947.db2.gz ZARCYYVNCWSFIA-VIFPVBQESA-N 1 2 245.244 2.325 20 0 BEADLO C[N@@H+](Cc1cc(F)c(F)cc1F)[C@H]1CCOC1 ZINC000132180916 384220951 /nfs/dbraw/zinc/22/09/51/384220951.db2.gz ZARCYYVNCWSFIA-VIFPVBQESA-N 1 2 245.244 2.325 20 0 BEADLO COC(=O)[C@@H](c1ccccc1F)[NH+]1CCCC1 ZINC000072555241 384225484 /nfs/dbraw/zinc/22/54/84/384225484.db2.gz ASLFAEFTQAHOJT-GFCCVEGCSA-N 1 2 237.274 2.136 20 0 BEADLO COC(=O)C[NH2+][C@H](c1ccccc1)C1CCC1 ZINC000119037673 384228108 /nfs/dbraw/zinc/22/81/08/384228108.db2.gz CJVJLOSDLHAOJR-CQSZACIVSA-N 1 2 233.311 2.290 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2ccno2)n1 ZINC000558702542 384250548 /nfs/dbraw/zinc/25/05/48/384250548.db2.gz DWMPKQGKYRLMTN-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2ccno2)n1 ZINC000558702542 384250555 /nfs/dbraw/zinc/25/05/55/384250555.db2.gz DWMPKQGKYRLMTN-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)CCC(C)(C)C ZINC000158668498 384252677 /nfs/dbraw/zinc/25/26/77/384252677.db2.gz BPEOOWAIZVLQHB-UHFFFAOYSA-N 1 2 237.347 2.205 20 0 BEADLO CCCCOCC(=O)Nc1ccc(C)[nH+]c1C ZINC000119260970 384252651 /nfs/dbraw/zinc/25/26/51/384252651.db2.gz DTMWSAHZNDUDAD-UHFFFAOYSA-N 1 2 236.315 2.454 20 0 BEADLO Cc1cc(C[N@@H+]2CCOCC23CCCC3)on1 ZINC000336629818 384268637 /nfs/dbraw/zinc/26/86/37/384268637.db2.gz QFDPLUHSYVVUJT-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO Cc1cc(C[N@H+]2CCOCC23CCCC3)on1 ZINC000336629818 384268643 /nfs/dbraw/zinc/26/86/43/384268643.db2.gz QFDPLUHSYVVUJT-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO c1coc(CSCCn2cc[nH+]c2)c1 ZINC000159287458 384317991 /nfs/dbraw/zinc/31/79/91/384317991.db2.gz ODYXSKJDHCOBSP-UHFFFAOYSA-N 1 2 208.286 2.410 20 0 BEADLO CCN(C)C(=O)Nc1c(C)cc[nH+]c1C ZINC000335557196 384322868 /nfs/dbraw/zinc/32/28/68/384322868.db2.gz SMJUGFSARVADAR-UHFFFAOYSA-N 1 2 207.277 2.182 20 0 BEADLO C[C@@H]1CCCC[N@H+](CCOC[C@H]2CCCO2)C1 ZINC000558786884 384290375 /nfs/dbraw/zinc/29/03/75/384290375.db2.gz ZEHJDQUCMXJRHV-ZIAGYGMSSA-N 1 2 241.375 2.304 20 0 BEADLO C[C@@H]1CCCC[N@@H+](CCOC[C@H]2CCCO2)C1 ZINC000558786884 384290384 /nfs/dbraw/zinc/29/03/84/384290384.db2.gz ZEHJDQUCMXJRHV-ZIAGYGMSSA-N 1 2 241.375 2.304 20 0 BEADLO CCSCC[N@H+](C)Cc1cc(C)on1 ZINC000159086933 384300507 /nfs/dbraw/zinc/30/05/07/384300507.db2.gz LLMFTTLFRHNZHX-UHFFFAOYSA-N 1 2 214.334 2.168 20 0 BEADLO CCSCC[N@@H+](C)Cc1cc(C)on1 ZINC000159086933 384300512 /nfs/dbraw/zinc/30/05/12/384300512.db2.gz LLMFTTLFRHNZHX-UHFFFAOYSA-N 1 2 214.334 2.168 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NCC(C)C ZINC000120367174 384348861 /nfs/dbraw/zinc/34/88/61/384348861.db2.gz UTJVSTPAZDQEQV-UHFFFAOYSA-N 1 2 207.277 2.168 20 0 BEADLO Cc1cnc(C[NH2+][C@@H]2C[C@H](C)n3ccnc32)s1 ZINC000334200575 384385866 /nfs/dbraw/zinc/38/58/66/384385866.db2.gz NIEUWSDQKXURJH-WCBMZHEXSA-N 1 2 248.355 2.444 20 0 BEADLO CC(C)c1nc(N[C@H]2CC[C@H](F)C2)cc[nH+]1 ZINC000335607882 384386524 /nfs/dbraw/zinc/38/65/24/384386524.db2.gz KKHTUJSWKMPSRG-UWVGGRQHSA-N 1 2 223.295 2.324 20 0 BEADLO Cc1cnc(C[N@@H+]2CCOCC23CCCC3)o1 ZINC000097230179 384452349 /nfs/dbraw/zinc/45/23/49/384452349.db2.gz GRJGPQXKWUDPFV-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO Cc1cnc(C[N@H+]2CCOCC23CCCC3)o1 ZINC000097230179 384452352 /nfs/dbraw/zinc/45/23/52/384452352.db2.gz GRJGPQXKWUDPFV-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO FC(F)C[NH2+]Cc1c[nH]nc1-c1cccs1 ZINC000147424461 384452524 /nfs/dbraw/zinc/45/25/24/384452524.db2.gz KIFTXKRUYKFZQP-UHFFFAOYSA-N 1 2 243.282 2.493 20 0 BEADLO COc1cc(C[NH2+]CC(F)F)cc(OC)c1 ZINC000147326744 384453694 /nfs/dbraw/zinc/45/36/94/384453694.db2.gz XMULPFVZRJQXNF-UHFFFAOYSA-N 1 2 231.242 2.059 20 0 BEADLO C[C@H]1C[C@H](Nc2ccc(N3CCCC3)c[nH+]2)CO1 ZINC000647173692 384433755 /nfs/dbraw/zinc/43/37/55/384433755.db2.gz VOSDRHCMGQHNJX-RYUDHWBXSA-N 1 2 247.342 2.271 20 0 BEADLO CCCc1nc(C[N@@H+]2CCC[C@H]2C)no1 ZINC000076115240 384438860 /nfs/dbraw/zinc/43/88/60/384438860.db2.gz IEBFOEXBLAOWEG-SECBINFHSA-N 1 2 209.293 2.006 20 0 BEADLO CCCc1nc(C[N@H+]2CCC[C@H]2C)no1 ZINC000076115240 384438863 /nfs/dbraw/zinc/43/88/63/384438863.db2.gz IEBFOEXBLAOWEG-SECBINFHSA-N 1 2 209.293 2.006 20 0 BEADLO C[C@H]([NH2+][C@H]1C[C@@H](C)[C@@H]1C)C(=O)OC(C)(C)C ZINC000309888499 384461799 /nfs/dbraw/zinc/46/17/99/384461799.db2.gz ZKKPEVNVFFDLOY-RCWTZXSCSA-N 1 2 227.348 2.351 20 0 BEADLO O=C1C[C@H]2CC[C@@H](C1)N2c1cc[nH+]c(C2CC2)n1 ZINC000564457426 384477071 /nfs/dbraw/zinc/47/70/71/384477071.db2.gz BPKHXZZSCXSTMT-PHIMTYICSA-N 1 2 243.310 2.054 20 0 BEADLO Cc1ccccc1[C@@H]1NC(=O)[C@@H]2C[C@@H](C)CC[N@@H+]12 ZINC000186590067 384478836 /nfs/dbraw/zinc/47/88/36/384478836.db2.gz SOLISKPZZKGICU-LEWSCRJBSA-N 1 2 244.338 2.224 20 0 BEADLO Cc1ccccc1[C@@H]1NC(=O)[C@@H]2C[C@@H](C)CC[N@H+]12 ZINC000186590067 384478842 /nfs/dbraw/zinc/47/88/42/384478842.db2.gz SOLISKPZZKGICU-LEWSCRJBSA-N 1 2 244.338 2.224 20 0 BEADLO CC[C@]1(C)C[N@H+](Cc2csc(C)n2)CCO1 ZINC000135656762 384458483 /nfs/dbraw/zinc/45/84/83/384458483.db2.gz UESFEGZEMFTUAN-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO CC[C@]1(C)C[N@@H+](Cc2csc(C)n2)CCO1 ZINC000135656762 384458491 /nfs/dbraw/zinc/45/84/91/384458491.db2.gz UESFEGZEMFTUAN-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO CCCCC(=O)Nc1nc(C[NH+](C)C)cs1 ZINC000170484438 384511932 /nfs/dbraw/zinc/51/19/32/384511932.db2.gz WSAWGCQOFHFELW-UHFFFAOYSA-N 1 2 241.360 2.333 20 0 BEADLO C[C@@H]1CC(C)(C)CC[C@@H]1NC(=O)Cn1cc[nH+]c1 ZINC000517793642 384509808 /nfs/dbraw/zinc/50/98/08/384509808.db2.gz JFNXMCPIFQMPMK-NEPJUHHUSA-N 1 2 249.358 2.214 20 0 BEADLO C[N@H+](Cc1ccon1)Cc1ccc2c(c1)OCO2 ZINC000122540567 384489855 /nfs/dbraw/zinc/48/98/55/384489855.db2.gz YFPIAERHGHTPGQ-UHFFFAOYSA-N 1 2 246.266 2.035 20 0 BEADLO C[N@@H+](Cc1ccon1)Cc1ccc2c(c1)OCO2 ZINC000122540567 384489860 /nfs/dbraw/zinc/48/98/60/384489860.db2.gz YFPIAERHGHTPGQ-UHFFFAOYSA-N 1 2 246.266 2.035 20 0 BEADLO C[C@@H]1C[C@H]1c1ccc(C[NH+]2CCN(C)CC2)o1 ZINC000137072103 384517622 /nfs/dbraw/zinc/51/76/22/384517622.db2.gz GQNGWWJECPJDLP-DGCLKSJQSA-N 1 2 234.343 2.150 20 0 BEADLO Cn1ncc2c1nc[nH+]c2NC[C@H]1CC=CCC1 ZINC000049281748 384526448 /nfs/dbraw/zinc/52/64/48/384526448.db2.gz FIHZJHXKROWOID-JTQLQIEISA-N 1 2 243.314 2.132 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)o1 ZINC000097491846 384527358 /nfs/dbraw/zinc/52/73/58/384527358.db2.gz GTEFDZDPUQREIQ-LLVKDONJSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1nnc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)o1 ZINC000097491846 384527360 /nfs/dbraw/zinc/52/73/60/384527360.db2.gz GTEFDZDPUQREIQ-LLVKDONJSA-N 1 2 232.287 2.043 20 0 BEADLO COC(=O)[C@H]([NH2+][C@@H](C)C1CC1)c1ccccc1 ZINC000049538324 384544760 /nfs/dbraw/zinc/54/47/60/384544760.db2.gz OXOLIYDJOFTEJX-GXFFZTMASA-N 1 2 233.311 2.289 20 0 BEADLO Cc1[nH+]cccc1N[C@@H]1CCO[C@H](C)C1 ZINC000085726714 384554729 /nfs/dbraw/zinc/55/47/29/384554729.db2.gz OPHSIJJUJVNUKL-MWLCHTKSSA-N 1 2 206.289 2.369 20 0 BEADLO Fc1cc(F)cc(NCc2[nH]cc[nH+]2)c1 ZINC000049714588 384557225 /nfs/dbraw/zinc/55/72/25/384557225.db2.gz FVEVPOWBSYBGCU-UHFFFAOYSA-N 1 2 209.199 2.300 20 0 BEADLO COC[C@@H]([NH2+]Cc1ccccn1)c1ccc(C)o1 ZINC000080238330 384537574 /nfs/dbraw/zinc/53/75/74/384537574.db2.gz GDEHOQVIPFHYCA-CYBMUJFWSA-N 1 2 246.310 2.460 20 0 BEADLO COC[C@H]([NH2+]Cc1cccnc1)c1ccc(C)o1 ZINC000080238102 384538570 /nfs/dbraw/zinc/53/85/70/384538570.db2.gz BRFLXKRRFCDDHB-ZDUSSCGKSA-N 1 2 246.310 2.460 20 0 BEADLO CSCC[N@H+](C)Cc1nccn1C(C)C ZINC000138232047 384568983 /nfs/dbraw/zinc/56/89/83/384568983.db2.gz RSCSVJFXGSKVKU-UHFFFAOYSA-N 1 2 227.377 2.259 20 0 BEADLO CSCC[N@@H+](C)Cc1nccn1C(C)C ZINC000138232047 384568991 /nfs/dbraw/zinc/56/89/91/384568991.db2.gz RSCSVJFXGSKVKU-UHFFFAOYSA-N 1 2 227.377 2.259 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccncc2Cl)no1 ZINC000084084915 384570658 /nfs/dbraw/zinc/57/06/58/384570658.db2.gz BDRKSJJFDVBEON-UHFFFAOYSA-N 1 2 237.690 2.321 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccncc2Cl)on1 ZINC000084084918 384571368 /nfs/dbraw/zinc/57/13/68/384571368.db2.gz RGVPOFSMDYSFPV-UHFFFAOYSA-N 1 2 237.690 2.321 20 0 BEADLO CS[C@@H]1CCCC[N@H+](CC(F)F)C1 ZINC000179112602 384571821 /nfs/dbraw/zinc/57/18/21/384571821.db2.gz SMFPLJUVWHYBJB-MRVPVSSYSA-N 1 2 209.305 2.469 20 0 BEADLO CS[C@@H]1CCCC[N@@H+](CC(F)F)C1 ZINC000179112602 384571829 /nfs/dbraw/zinc/57/18/29/384571829.db2.gz SMFPLJUVWHYBJB-MRVPVSSYSA-N 1 2 209.305 2.469 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cc[nH]n2)c(C)n1 ZINC000359878393 384576529 /nfs/dbraw/zinc/57/65/29/384576529.db2.gz PEKFLCXCZIBXBS-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cc[nH]n2)c(C)n1 ZINC000359878393 384576536 /nfs/dbraw/zinc/57/65/36/384576536.db2.gz PEKFLCXCZIBXBS-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1nc(C[N@@H+]2CCCO[C@H](C)C2)cs1 ZINC000172321315 384565104 /nfs/dbraw/zinc/56/51/04/384565104.db2.gz GBVXPPLIIANBIZ-SECBINFHSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1nc(C[N@H+]2CCCO[C@H](C)C2)cs1 ZINC000172321315 384565107 /nfs/dbraw/zinc/56/51/07/384565107.db2.gz GBVXPPLIIANBIZ-SECBINFHSA-N 1 2 226.345 2.062 20 0 BEADLO CC(C)C[C@@H](C)C[N@H+](CCO)CC(F)F ZINC000300842546 384605280 /nfs/dbraw/zinc/60/52/80/384605280.db2.gz DKQJGLFBMKLSSJ-SNVBAGLBSA-N 1 2 223.307 2.228 20 0 BEADLO CC(C)C[C@@H](C)C[N@@H+](CCO)CC(F)F ZINC000300842546 384605290 /nfs/dbraw/zinc/60/52/90/384605290.db2.gz DKQJGLFBMKLSSJ-SNVBAGLBSA-N 1 2 223.307 2.228 20 0 BEADLO CC(C)n1ccnc1C[N@@H+]1CCSC[C@H]1C ZINC000172595103 384608217 /nfs/dbraw/zinc/60/82/17/384608217.db2.gz XNQCUIUVCVEZIX-LLVKDONJSA-N 1 2 239.388 2.401 20 0 BEADLO CC(C)n1ccnc1C[N@H+]1CCSC[C@H]1C ZINC000172595103 384608229 /nfs/dbraw/zinc/60/82/29/384608229.db2.gz XNQCUIUVCVEZIX-LLVKDONJSA-N 1 2 239.388 2.401 20 0 BEADLO Cc1nc(C[N@H+]2CCSC[C@H]2C)oc1C ZINC000172592238 384609958 /nfs/dbraw/zinc/60/99/58/384609958.db2.gz FEQCCQOUFZECHY-MRVPVSSYSA-N 1 2 226.345 2.229 20 0 BEADLO Cc1nc(C[N@@H+]2CCSC[C@H]2C)oc1C ZINC000172592238 384609964 /nfs/dbraw/zinc/60/99/64/384609964.db2.gz FEQCCQOUFZECHY-MRVPVSSYSA-N 1 2 226.345 2.229 20 0 BEADLO Cc1nc(N[C@@H]2CC[C@@H]3C[C@@H]3C2)cc[nH+]1 ZINC000403329681 384634028 /nfs/dbraw/zinc/63/40/28/384634028.db2.gz BYIWENDFLJMMTJ-GMTAPVOTSA-N 1 2 203.289 2.386 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+]2C[C@H](C)OC(C)(C)C2)cn1 ZINC000428460145 384616334 /nfs/dbraw/zinc/61/63/34/384616334.db2.gz GGWJOAUYVCAXNI-RYUDHWBXSA-N 1 2 249.358 2.345 20 0 BEADLO Cc1cnc([C@H](C)[N@H+]2C[C@H](C)OC(C)(C)C2)cn1 ZINC000428460145 384616338 /nfs/dbraw/zinc/61/63/38/384616338.db2.gz GGWJOAUYVCAXNI-RYUDHWBXSA-N 1 2 249.358 2.345 20 0 BEADLO CCOc1ccc(C[NH2+]Cc2ccn[nH]2)cc1 ZINC000041013812 384600757 /nfs/dbraw/zinc/60/07/57/384600757.db2.gz IIUDJQLGUMGDTL-UHFFFAOYSA-N 1 2 231.299 2.098 20 0 BEADLO FC(F)C[N@@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000367822926 384634386 /nfs/dbraw/zinc/63/43/86/384634386.db2.gz MWTJHQOENMWKFC-JTQLQIEISA-N 1 2 219.275 2.000 20 0 BEADLO FC(F)C[N@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000367822926 384634391 /nfs/dbraw/zinc/63/43/91/384634391.db2.gz MWTJHQOENMWKFC-JTQLQIEISA-N 1 2 219.275 2.000 20 0 BEADLO C[C@H]([NH2+]CC(F)(F)CO)c1ccc(F)cc1 ZINC000184703994 384638998 /nfs/dbraw/zinc/63/89/98/384638998.db2.gz DOVPOJLLKVFNON-QMMMGPOBSA-N 1 2 233.233 2.104 20 0 BEADLO C[C@@H]1Cc2ccccc2[C@H]1[NH2+]CC(F)(F)CO ZINC000184713775 384639755 /nfs/dbraw/zinc/63/97/55/384639755.db2.gz GVPRFYPLZUSAKU-SKDRFNHKSA-N 1 2 241.281 2.137 20 0 BEADLO CC[C@@H]([NH2+]CC(F)(F)CO)c1ccccc1 ZINC000184702950 384641265 /nfs/dbraw/zinc/64/12/65/384641265.db2.gz FMBWSGSUGKPSIK-LLVKDONJSA-N 1 2 229.270 2.355 20 0 BEADLO CC/C=C/CC[N@H+](C)Cc1noc(C)n1 ZINC000184739651 384644012 /nfs/dbraw/zinc/64/40/12/384644012.db2.gz TZZRJSOUNMVPDJ-AATRIKPKSA-N 1 2 209.293 2.166 20 0 BEADLO CC/C=C/CC[N@@H+](C)Cc1noc(C)n1 ZINC000184739651 384644020 /nfs/dbraw/zinc/64/40/20/384644020.db2.gz TZZRJSOUNMVPDJ-AATRIKPKSA-N 1 2 209.293 2.166 20 0 BEADLO C[C@H]([NH2+]Cc1cocn1)c1ccncc1F ZINC000309830513 384650215 /nfs/dbraw/zinc/65/02/15/384650215.db2.gz YKJIMUDWDBFZRV-QMMMGPOBSA-N 1 2 221.235 2.060 20 0 BEADLO CC[C@]1(C)C[C@@H]1C(=O)Nc1ccc(N)[nH+]c1 ZINC000151655125 384675653 /nfs/dbraw/zinc/67/56/53/384675653.db2.gz KNNQVXVVDABOJS-BXKDBHETSA-N 1 2 219.288 2.039 20 0 BEADLO c1cc(N2CCCCC2)[nH+]cc1N[C@@H]1CCOC1 ZINC000104059467 384658175 /nfs/dbraw/zinc/65/81/75/384658175.db2.gz GVWNAXBSZXKXFJ-CYBMUJFWSA-N 1 2 247.342 2.273 20 0 BEADLO Cc1nc(N2CCC([C@H]3CCOC3)CC2)cc[nH+]1 ZINC000368350411 384725495 /nfs/dbraw/zinc/72/54/95/384725495.db2.gz XCBAOFOJEGAPGR-ZDUSSCGKSA-N 1 2 247.342 2.038 20 0 BEADLO Cc1occc1C[N@@H+](C)CC(=O)c1cccn1C ZINC000048755895 384676824 /nfs/dbraw/zinc/67/68/24/384676824.db2.gz NPZHLSXKGFKSOW-UHFFFAOYSA-N 1 2 246.310 2.241 20 0 BEADLO Cc1occc1C[N@H+](C)CC(=O)c1cccn1C ZINC000048755895 384676828 /nfs/dbraw/zinc/67/68/28/384676828.db2.gz NPZHLSXKGFKSOW-UHFFFAOYSA-N 1 2 246.310 2.241 20 0 BEADLO CCC[C@@](C)([NH2+][C@@H]1C=CCCC1)C(=O)OC ZINC000171936000 384678582 /nfs/dbraw/zinc/67/85/82/384678582.db2.gz XHVCHALBRJSTDO-DGCLKSJQSA-N 1 2 225.332 2.417 20 0 BEADLO Cc1nc(C[NH2+]Cc2ccc(F)cn2)cs1 ZINC000309875511 384684501 /nfs/dbraw/zinc/68/45/01/384684501.db2.gz SNRARCYTZBKJGW-UHFFFAOYSA-N 1 2 237.303 2.275 20 0 BEADLO COc1ccc(Cl)cc1C[N@H+](C)CC(C)=O ZINC000258978167 384726878 /nfs/dbraw/zinc/72/68/78/384726878.db2.gz WBZRYJNWRHTAHM-UHFFFAOYSA-N 1 2 241.718 2.369 20 0 BEADLO COc1ccc(Cl)cc1C[N@@H+](C)CC(C)=O ZINC000258978167 384726883 /nfs/dbraw/zinc/72/68/83/384726883.db2.gz WBZRYJNWRHTAHM-UHFFFAOYSA-N 1 2 241.718 2.369 20 0 BEADLO CCCc1nc(C[N@H+](C)[C@H](C)CC)no1 ZINC000104688227 384702436 /nfs/dbraw/zinc/70/24/36/384702436.db2.gz SIFUKHKLDVXSRU-SECBINFHSA-N 1 2 211.309 2.252 20 0 BEADLO CCCc1nc(C[N@@H+](C)[C@H](C)CC)no1 ZINC000104688227 384702443 /nfs/dbraw/zinc/70/24/43/384702443.db2.gz SIFUKHKLDVXSRU-SECBINFHSA-N 1 2 211.309 2.252 20 0 BEADLO Cc1ccc(CNc2cccc(CO)[nH+]2)o1 ZINC000309729892 384778736 /nfs/dbraw/zinc/77/87/36/384778736.db2.gz ZLJPYPXCLKBDIV-UHFFFAOYSA-N 1 2 218.256 2.087 20 0 BEADLO CCc1cc(N)nc(SCCSC)[nH+]1 ZINC000279038644 384750848 /nfs/dbraw/zinc/75/08/48/384750848.db2.gz FTCCCLQOSWQZNN-UHFFFAOYSA-N 1 2 229.374 2.076 20 0 BEADLO CC[C@@H]([NH2+][C@@H](CC)CC(F)(F)F)C(=O)OC ZINC000309713870 384756564 /nfs/dbraw/zinc/75/65/64/384756564.db2.gz RXZANDMCPBAYPD-JGVFFNPUSA-N 1 2 241.253 2.259 20 0 BEADLO CC[C@H]([NH2+]Cc1ccccc1C)C(=O)OC ZINC000083351366 384760966 /nfs/dbraw/zinc/76/09/66/384760966.db2.gz VVUZPVIUIHHGAR-LBPRGKRZSA-N 1 2 221.300 2.036 20 0 BEADLO COC(=O)C(C)(C)[NH2+]Cc1ccc2cc[nH]c2c1 ZINC000083375286 384767643 /nfs/dbraw/zinc/76/76/43/384767643.db2.gz YZTDIXDDFINGOR-UHFFFAOYSA-N 1 2 246.310 2.209 20 0 BEADLO C/C=C/C[S@](=O)Cc1cn2ccccc2[nH+]1 ZINC000083952902 384821330 /nfs/dbraw/zinc/82/13/30/384821330.db2.gz KMABEZGKQFQIGA-WOMSROEHSA-N 1 2 234.324 2.159 20 0 BEADLO CC[C@H]1CCCN(c2cc[nH+]c(C)n2)C1 ZINC000174679841 384825289 /nfs/dbraw/zinc/82/52/89/384825289.db2.gz UBJPUVTYLLMAGI-NSHDSACASA-N 1 2 205.305 2.411 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccc(C)c(C)n2)on1 ZINC000314110710 384803722 /nfs/dbraw/zinc/80/37/22/384803722.db2.gz CKKLVIQVDYUESM-UHFFFAOYSA-N 1 2 231.299 2.285 20 0 BEADLO CCC[C@@H]([NH2+][C@@H]1CSC1(C)C)C(=O)OCC ZINC000310039949 384809386 /nfs/dbraw/zinc/80/93/86/384809386.db2.gz XLPQPCPRBJNOMM-NXEZZACHSA-N 1 2 245.388 2.202 20 0 BEADLO Cc1ccc(C(=O)CC[N@H+]2CCOC[C@H]2C)cc1 ZINC000053935311 384810074 /nfs/dbraw/zinc/81/00/74/384810074.db2.gz WFFSNYGDBPUXHJ-CYBMUJFWSA-N 1 2 247.338 2.289 20 0 BEADLO Cc1ccc(C(=O)CC[N@@H+]2CCOC[C@H]2C)cc1 ZINC000053935311 384810080 /nfs/dbraw/zinc/81/00/80/384810080.db2.gz WFFSNYGDBPUXHJ-CYBMUJFWSA-N 1 2 247.338 2.289 20 0 BEADLO Cc1cc[nH+]c(NCC[C@@H](C)O)c1Cl ZINC000306314886 384874043 /nfs/dbraw/zinc/87/40/43/384874043.db2.gz WTKPQXJUKSHMJC-MRVPVSSYSA-N 1 2 214.696 2.226 20 0 BEADLO Cn1cc(C[N@@H+]2CCC[C@@H]2c2nccs2)cn1 ZINC000370794733 384875840 /nfs/dbraw/zinc/87/58/40/384875840.db2.gz QGKNEHKPLBNBIM-LLVKDONJSA-N 1 2 248.355 2.214 20 0 BEADLO Cn1cc(C[N@H+]2CCC[C@@H]2c2nccs2)cn1 ZINC000370794733 384875843 /nfs/dbraw/zinc/87/58/43/384875843.db2.gz QGKNEHKPLBNBIM-LLVKDONJSA-N 1 2 248.355 2.214 20 0 BEADLO Cc1cccc([C@H](C)[N@H+](C)Cc2nnc[nH]2)c1 ZINC000177135348 384880800 /nfs/dbraw/zinc/88/08/00/384880800.db2.gz YJPZZZUZYIFUEL-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO Cc1cccc([C@H](C)[N@@H+](C)Cc2nnc[nH]2)c1 ZINC000177135348 384880803 /nfs/dbraw/zinc/88/08/03/384880803.db2.gz YJPZZZUZYIFUEL-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO COC(=O)C[N@H+](C)Cc1ccc(CC(C)C)cc1 ZINC000171342896 384881833 /nfs/dbraw/zinc/88/18/33/384881833.db2.gz RYLUXONMLFJSCM-UHFFFAOYSA-N 1 2 249.354 2.490 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1ccc(CC(C)C)cc1 ZINC000171342896 384881840 /nfs/dbraw/zinc/88/18/40/384881840.db2.gz RYLUXONMLFJSCM-UHFFFAOYSA-N 1 2 249.354 2.490 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccncc1)c1csnn1 ZINC000398286492 384885621 /nfs/dbraw/zinc/88/56/21/384885621.db2.gz NMBGTUOLOJLHGI-DTWKUNHWSA-N 1 2 234.328 2.345 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1csnn1)c1ccncc1 ZINC000398286491 384887009 /nfs/dbraw/zinc/88/70/09/384887009.db2.gz NMBGTUOLOJLHGI-BDAKNGLRSA-N 1 2 234.328 2.345 20 0 BEADLO C[C@@H]1[C@H](C)SCC[N@@H+]1CC(=O)OC(C)(C)C ZINC000118415311 384838488 /nfs/dbraw/zinc/83/84/88/384838488.db2.gz HJMMQHWQACGTTG-ZJUUUORDSA-N 1 2 245.388 2.154 20 0 BEADLO C[C@@H]1[C@H](C)SCC[N@H+]1CC(=O)OC(C)(C)C ZINC000118415311 384838497 /nfs/dbraw/zinc/83/84/97/384838497.db2.gz HJMMQHWQACGTTG-ZJUUUORDSA-N 1 2 245.388 2.154 20 0 BEADLO Cc1nc(C[N@@H+](C)CCCC(C)C)no1 ZINC000426487253 384838793 /nfs/dbraw/zinc/83/87/93/384838793.db2.gz SXKZMIPQHSUORJ-UHFFFAOYSA-N 1 2 211.309 2.246 20 0 BEADLO Cc1nc(C[N@H+](C)CCCC(C)C)no1 ZINC000426487253 384838800 /nfs/dbraw/zinc/83/88/00/384838800.db2.gz SXKZMIPQHSUORJ-UHFFFAOYSA-N 1 2 211.309 2.246 20 0 BEADLO C[N@H+](Cc1ncc(Br)s1)C1CC1 ZINC000306271085 384843089 /nfs/dbraw/zinc/84/30/89/384843089.db2.gz VDYDTNDCZWUQLU-UHFFFAOYSA-N 1 2 247.161 2.500 20 0 BEADLO C[N@@H+](Cc1ncc(Br)s1)C1CC1 ZINC000306271085 384843093 /nfs/dbraw/zinc/84/30/93/384843093.db2.gz VDYDTNDCZWUQLU-UHFFFAOYSA-N 1 2 247.161 2.500 20 0 BEADLO CCC[C@H]1CCC[C@@H]1C(=O)NCc1c[nH+]c[nH]1 ZINC000449907795 384844989 /nfs/dbraw/zinc/84/49/89/384844989.db2.gz PUVQORUPDRXQBN-JQWIXIFHSA-N 1 2 235.331 2.242 20 0 BEADLO CCC[C@H]1CCC[C@@H]1C(=O)NCc1c[nH]c[nH+]1 ZINC000449907795 384844998 /nfs/dbraw/zinc/84/49/98/384844998.db2.gz PUVQORUPDRXQBN-JQWIXIFHSA-N 1 2 235.331 2.242 20 0 BEADLO CCc1cc(N)nc(SCC2CC2)[nH+]1 ZINC000279117534 384854499 /nfs/dbraw/zinc/85/44/99/384854499.db2.gz SYHVBEGKCBAACH-UHFFFAOYSA-N 1 2 209.318 2.123 20 0 BEADLO CO[C@H](C)c1nc(C[NH+]2CCCC2)cs1 ZINC000175060851 384863192 /nfs/dbraw/zinc/86/31/92/384863192.db2.gz CUDIBGWKHTVCNA-SECBINFHSA-N 1 2 226.345 2.446 20 0 BEADLO Cc1cc[nH+]c(NCC[C@H](C)O)c1Cl ZINC000306433432 384949627 /nfs/dbraw/zinc/94/96/27/384949627.db2.gz WTKPQXJUKSHMJC-QMMMGPOBSA-N 1 2 214.696 2.226 20 0 BEADLO CCOCCOc1cccc(-n2cc[nH+]c2)c1 ZINC000127867442 384957114 /nfs/dbraw/zinc/95/71/14/384957114.db2.gz CILXSNAAMGBTAI-UHFFFAOYSA-N 1 2 232.283 2.288 20 0 BEADLO Cc1csc(CNc2cc[nH+]c(C)n2)c1 ZINC000336170733 384935419 /nfs/dbraw/zinc/93/54/19/384935419.db2.gz BRMPZDRJCOECSP-UHFFFAOYSA-N 1 2 219.313 2.189 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2ccon2)o1 ZINC000088052730 384991321 /nfs/dbraw/zinc/99/13/21/384991321.db2.gz JQJAQXWXBMRLMG-VIFPVBQESA-N 1 2 206.245 2.427 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2ccon2)o1 ZINC000088052729 384993665 /nfs/dbraw/zinc/99/36/65/384993665.db2.gz JQJAQXWXBMRLMG-SECBINFHSA-N 1 2 206.245 2.427 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccc(O)c2)on1 ZINC000530662809 385006234 /nfs/dbraw/zinc/00/62/34/385006234.db2.gz DOTNFHNLYYZEKJ-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccc(O)c2)on1 ZINC000530662809 385006246 /nfs/dbraw/zinc/00/62/46/385006246.db2.gz DOTNFHNLYYZEKJ-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO C[C@@H]([NH2+][C@@H](C(N)=O)c1ccccc1)c1ccco1 ZINC000120492932 385009728 /nfs/dbraw/zinc/00/97/28/385009728.db2.gz RPMKUSOHPMQKNU-ZWNOBZJWSA-N 1 2 244.294 2.157 20 0 BEADLO CNc1ccc(Nc2cncc(Cl)n2)c[nH+]1 ZINC000302840825 385010063 /nfs/dbraw/zinc/01/00/63/385010063.db2.gz CSBYKLIFQXMZAK-UHFFFAOYSA-N 1 2 235.678 2.310 20 0 BEADLO CN(CCCCO)c1cc(C(F)(F)F)cc[nH+]1 ZINC000302787132 385019981 /nfs/dbraw/zinc/01/99/81/385019981.db2.gz WRUBITLSTKVZOP-UHFFFAOYSA-N 1 2 248.248 2.309 20 0 BEADLO CCO[C@@H]1C[C@@H](N(C)c2cc(C)[nH+]cn2)C1(C)C ZINC000156793334 384961722 /nfs/dbraw/zinc/96/17/22/384961722.db2.gz UJCZEFABBOBCDW-VXGBXAGGSA-N 1 2 249.358 2.425 20 0 BEADLO CCc1ccc(C[NH+]2CCN(C3CC3)CC2)o1 ZINC000127912008 384964427 /nfs/dbraw/zinc/96/44/27/384964427.db2.gz CAVSEYFOTKRJEL-UHFFFAOYSA-N 1 2 234.343 2.122 20 0 BEADLO CC(C)CCNC(=O)c1ccc2[nH+]ccn2c1 ZINC000057825349 384964505 /nfs/dbraw/zinc/96/45/05/384964505.db2.gz LSLCIRLKRVLZBA-UHFFFAOYSA-N 1 2 231.299 2.110 20 0 BEADLO CC(C)n1cc(C[NH2+]Cc2ccc(F)cc2)nn1 ZINC000289639401 385066084 /nfs/dbraw/zinc/06/60/84/385066084.db2.gz GWEIXGRFWKXSJW-UHFFFAOYSA-N 1 2 248.305 2.288 20 0 BEADLO CN(C)c1ccc(NCc2cccn2C)[nH+]c1 ZINC000150899574 385074086 /nfs/dbraw/zinc/07/40/86/385074086.db2.gz AWJOVEQKJREGPQ-UHFFFAOYSA-N 1 2 230.315 2.098 20 0 BEADLO COc1cc(C)ccc1C[NH2+]Cc1ncc[nH]1 ZINC000151027368 385081373 /nfs/dbraw/zinc/08/13/73/385081373.db2.gz HLQIRGAPUKAMLB-UHFFFAOYSA-N 1 2 231.299 2.017 20 0 BEADLO Cc1cnc(C[NH2+]Cc2c(C)noc2C)s1 ZINC000164835869 385046044 /nfs/dbraw/zinc/04/60/44/385046044.db2.gz KNRBIIZSRJCFFB-UHFFFAOYSA-N 1 2 237.328 2.346 20 0 BEADLO Cc1cc(NCC2(CCO)CC2)nc(C(C)C)[nH+]1 ZINC000157256030 385116205 /nfs/dbraw/zinc/11/62/05/385116205.db2.gz GBNYIQWWVALBOZ-UHFFFAOYSA-N 1 2 249.358 2.483 20 0 BEADLO CCCCCN(CCO)c1cc[nH+]c(C2CC2)n1 ZINC000176734804 385142358 /nfs/dbraw/zinc/14/23/58/385142358.db2.gz CTJCDQHTIOOYMW-UHFFFAOYSA-N 1 2 249.358 2.343 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)NCCc2[nH]cc[nH+]2)C[C@@H]1C ZINC000448947994 385092381 /nfs/dbraw/zinc/09/23/81/385092381.db2.gz BFLSIFJZXIRVPF-WOPDTQHZSA-N 1 2 249.358 2.141 20 0 BEADLO CC(C)c1nc(C[NH+]2CCC3(CC3)CC2)n[nH]1 ZINC000644679554 385094244 /nfs/dbraw/zinc/09/42/44/385094244.db2.gz WMFIKQMHLJEPKK-UHFFFAOYSA-N 1 2 234.347 2.304 20 0 BEADLO CC[C@@H]([NH2+]Cc1c[nH]nn1)c1ccc(C)cc1 ZINC000398340513 385096338 /nfs/dbraw/zinc/09/63/38/385096338.db2.gz DBGBEXDHHPBAEG-CYBMUJFWSA-N 1 2 230.315 2.354 20 0 BEADLO CC[C@@H]([NH2+]Cc1cn[nH]n1)c1ccc(C)cc1 ZINC000398340513 385096350 /nfs/dbraw/zinc/09/63/50/385096350.db2.gz DBGBEXDHHPBAEG-CYBMUJFWSA-N 1 2 230.315 2.354 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cncc(C)c2)CCO1 ZINC000189782713 385182639 /nfs/dbraw/zinc/18/26/39/385182639.db2.gz OUPZCZDAHYOCPD-ZDUSSCGKSA-N 1 2 220.316 2.001 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cncc(C)c2)CCO1 ZINC000189782713 385182643 /nfs/dbraw/zinc/18/26/43/385182643.db2.gz OUPZCZDAHYOCPD-ZDUSSCGKSA-N 1 2 220.316 2.001 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2cncs2)C1 ZINC000306796777 385195888 /nfs/dbraw/zinc/19/58/88/385195888.db2.gz JXMKZNZRCFBATP-VIFPVBQESA-N 1 2 200.282 2.077 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2cncs2)C1 ZINC000306796777 385195890 /nfs/dbraw/zinc/19/58/90/385195890.db2.gz JXMKZNZRCFBATP-VIFPVBQESA-N 1 2 200.282 2.077 20 0 BEADLO Cn1c[nH+]cc1CSC1(CO)CCCCC1 ZINC000313013544 385144984 /nfs/dbraw/zinc/14/49/84/385144984.db2.gz WAERJJFEXDKMBE-UHFFFAOYSA-N 1 2 240.372 2.349 20 0 BEADLO CC[C@]1(C)C[N@H+](Cc2nc(C)cs2)CCO1 ZINC000190109486 385210498 /nfs/dbraw/zinc/21/04/98/385210498.db2.gz IGXRYHLHCPNNKC-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO CC[C@]1(C)C[N@@H+](Cc2nc(C)cs2)CCO1 ZINC000190109486 385210507 /nfs/dbraw/zinc/21/05/07/385210507.db2.gz IGXRYHLHCPNNKC-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO CCOc1ccc(OC)cc1NCc1[nH]cc[nH+]1 ZINC000130112842 385218094 /nfs/dbraw/zinc/21/80/94/385218094.db2.gz XEBIHYKGGPBNAF-UHFFFAOYSA-N 1 2 247.298 2.429 20 0 BEADLO Cc1ccc(NC(=O)N2CCCC2)c(C)[nH+]1 ZINC000130114738 385219962 /nfs/dbraw/zinc/21/99/62/385219962.db2.gz HZCRKZWNAMTCDJ-UHFFFAOYSA-N 1 2 219.288 2.326 20 0 BEADLO Cc1ccc(NC(=O)NC2CCC2)c(C)[nH+]1 ZINC000130115617 385221861 /nfs/dbraw/zinc/22/18/61/385221861.db2.gz DPDHCSOIZRYXTM-UHFFFAOYSA-N 1 2 219.288 2.372 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@H](C)C(C)(C)C2)no1 ZINC000336396470 385245769 /nfs/dbraw/zinc/24/57/69/385245769.db2.gz LVURXGYXKNCETL-SECBINFHSA-N 1 2 223.320 2.246 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@H](C)C(C)(C)C2)no1 ZINC000336396470 385245776 /nfs/dbraw/zinc/24/57/76/385245776.db2.gz LVURXGYXKNCETL-SECBINFHSA-N 1 2 223.320 2.246 20 0 BEADLO CC(C)n1nccc1CNc1cccc[nH+]1 ZINC000280079453 385249478 /nfs/dbraw/zinc/24/94/78/385249478.db2.gz YEXRJSMVZYXOCY-UHFFFAOYSA-N 1 2 216.288 2.471 20 0 BEADLO CC(C)[C@H]1CCN(c2cc(CO)cc[nH+]2)C1 ZINC000166523964 385251151 /nfs/dbraw/zinc/25/11/51/385251151.db2.gz RJIBUFGBTKMVJB-LBPRGKRZSA-N 1 2 220.316 2.056 20 0 BEADLO Nc1[nH+]cnc(NCCc2ccccc2)c1Cl ZINC000227840533 385253837 /nfs/dbraw/zinc/25/38/37/385253837.db2.gz IYWMSMWCAFBOLP-UHFFFAOYSA-N 1 2 248.717 2.367 20 0 BEADLO Nc1nc[nH+]c(NCCc2ccccc2)c1Cl ZINC000227840533 385253842 /nfs/dbraw/zinc/25/38/42/385253842.db2.gz IYWMSMWCAFBOLP-UHFFFAOYSA-N 1 2 248.717 2.367 20 0 BEADLO CC(C)c1nnc(C[N@H+](C)[C@H]2CCSC2)o1 ZINC000119961025 385313098 /nfs/dbraw/zinc/31/30/98/385313098.db2.gz IIRNKXMBNKKZOY-VIFPVBQESA-N 1 2 241.360 2.130 20 0 BEADLO CC(C)c1nnc(C[N@@H+](C)[C@H]2CCSC2)o1 ZINC000119961025 385313101 /nfs/dbraw/zinc/31/31/01/385313101.db2.gz IIRNKXMBNKKZOY-VIFPVBQESA-N 1 2 241.360 2.130 20 0 BEADLO CCn1cc[nH+]c1CN1CCOC2(CCCC2)C1 ZINC000157936812 385317054 /nfs/dbraw/zinc/31/70/54/385317054.db2.gz LOQPTWKCLNBZBJ-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CO[C@@H]1CCC[C@H]1CNc1cccc[nH+]1 ZINC000308966974 385318179 /nfs/dbraw/zinc/31/81/79/385318179.db2.gz WJVKWNJGVFLOHR-WDEREUQCSA-N 1 2 206.289 2.309 20 0 BEADLO CN(CCC1CC1)C(=O)c1ccc2[nH+]ccn2c1 ZINC000178706817 385318906 /nfs/dbraw/zinc/31/89/06/385318906.db2.gz ABUUTFAIQPTWDA-UHFFFAOYSA-N 1 2 243.310 2.206 20 0 BEADLO Cc1nnc(C[N@@H+](C)CCCOC(C)C)s1 ZINC000358505379 385260002 /nfs/dbraw/zinc/26/00/02/385260002.db2.gz HNDCRQYHYCBYGR-UHFFFAOYSA-N 1 2 243.376 2.093 20 0 BEADLO Cc1nnc(C[N@H+](C)CCCOC(C)C)s1 ZINC000358505379 385260008 /nfs/dbraw/zinc/26/00/08/385260008.db2.gz HNDCRQYHYCBYGR-UHFFFAOYSA-N 1 2 243.376 2.093 20 0 BEADLO CC[C@@H](C)CC(=O)Nc1c[nH+]ccc1OC ZINC000190802425 385263389 /nfs/dbraw/zinc/26/33/89/385263389.db2.gz WKNADIHQMNZDPY-SECBINFHSA-N 1 2 222.288 2.465 20 0 BEADLO O=C(C1CCCCCC1)N1CCn2c[nH+]cc2C1 ZINC000290975707 385267642 /nfs/dbraw/zinc/26/76/42/385267642.db2.gz USQJSNXTJAWIHS-UHFFFAOYSA-N 1 2 247.342 2.196 20 0 BEADLO CO[C@H](C)c1nc(Cn2cc[nH+]c2)cs1 ZINC000177644180 385268138 /nfs/dbraw/zinc/26/81/38/385268138.db2.gz MLPSZTREKREHSJ-MRVPVSSYSA-N 1 2 223.301 2.095 20 0 BEADLO Cc1nnsc1C[NH2+][C@@H](C)c1nccs1 ZINC000308991353 385333630 /nfs/dbraw/zinc/33/36/30/385333630.db2.gz NZYSIHOWVIFJHX-ZETCQYMHSA-N 1 2 240.357 2.154 20 0 BEADLO C[C@H](O)c1ccc(C[NH2+]Cc2cocn2)cc1 ZINC000192294751 385351592 /nfs/dbraw/zinc/35/15/92/385351592.db2.gz PBTBPWYOWFMWOG-JTQLQIEISA-N 1 2 232.283 2.018 20 0 BEADLO C[C@H]1CCC[C@H](C(=O)NCCCn2cc[nH+]c2)C1 ZINC000158190336 385363262 /nfs/dbraw/zinc/36/32/62/385363262.db2.gz FLCRTWCYYCZCNI-STQMWFEESA-N 1 2 249.358 2.216 20 0 BEADLO CC[C@H]([NH2+]CCc1c(C)cccc1C)C(=O)OC ZINC000192858945 385374477 /nfs/dbraw/zinc/37/44/77/385374477.db2.gz LMYKFCHNAXQWDT-AWEZNQCLSA-N 1 2 249.354 2.387 20 0 BEADLO COC[C@H](C)Nc1cc[nH+]c(C(C)C)n1 ZINC000110111810 385380461 /nfs/dbraw/zinc/38/04/61/385380461.db2.gz BNWRRAPAJQYVTN-VIFPVBQESA-N 1 2 209.293 2.047 20 0 BEADLO COC[C@@H](C)Nc1cc[nH+]c(C(C)C)n1 ZINC000110111812 385381530 /nfs/dbraw/zinc/38/15/30/385381530.db2.gz BNWRRAPAJQYVTN-SECBINFHSA-N 1 2 209.293 2.047 20 0 BEADLO CC(C)c1nc(NC[C@H]2CCOC2)cc[nH+]1 ZINC000110278681 385390785 /nfs/dbraw/zinc/39/07/85/385390785.db2.gz QYANFRCHGIRNRL-SNVBAGLBSA-N 1 2 221.304 2.048 20 0 BEADLO CCC1(CNC(=O)CCc2c[nH+]c[nH]2)CCCC1 ZINC000193539400 385401000 /nfs/dbraw/zinc/40/10/00/385401000.db2.gz QSFIWCUMUNAMHU-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO CCC1(CNC(=O)CCc2c[nH]c[nH+]2)CCCC1 ZINC000193539400 385401004 /nfs/dbraw/zinc/40/10/04/385401004.db2.gz QSFIWCUMUNAMHU-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO CC[C@@H](C)NC(=O)[C@H](C)[NH+]1Cc2ccccc2C1 ZINC000178646288 385401938 /nfs/dbraw/zinc/40/19/38/385401938.db2.gz GCABMSSHHXZILG-NEPJUHHUSA-N 1 2 246.354 2.305 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[NH2+]C[C@H](C)SC ZINC000181021825 385403069 /nfs/dbraw/zinc/40/30/69/385403069.db2.gz BEMKCFWEFQKLTG-QWRGUYRKSA-N 1 2 247.404 2.305 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000360800930 385407652 /nfs/dbraw/zinc/40/76/52/385407652.db2.gz IWZGMHZKJJPQMS-MFKMUULPSA-N 1 2 235.331 2.050 20 0 BEADLO C[C@@H]1C[C@H]1CNc1ccc(N(C)C)c[nH+]1 ZINC000309104923 385423787 /nfs/dbraw/zinc/42/37/87/385423787.db2.gz HONVWVCKTDYUFH-ZJUUUORDSA-N 1 2 205.305 2.216 20 0 BEADLO COC(=O)C1([NH2+]Cc2ccncc2)CCCCC1 ZINC000156124208 385438724 /nfs/dbraw/zinc/43/87/24/385438724.db2.gz VNOIURQZYPTQCC-UHFFFAOYSA-N 1 2 248.326 2.047 20 0 BEADLO CN(C)c1ccc(NC[C@H]2CCC=CO2)[nH+]c1 ZINC000194515229 385438986 /nfs/dbraw/zinc/43/89/86/385438986.db2.gz MPNMHMLKCWPFDV-GFCCVEGCSA-N 1 2 233.315 2.252 20 0 BEADLO CC[C@@H]1[C@@H](C)CCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492810147 385439989 /nfs/dbraw/zinc/43/99/89/385439989.db2.gz HNIKPECGYBQFLY-HDTYDHQFSA-N 1 2 233.315 2.070 20 0 BEADLO Cc1nnc(SCc2cc[nH+]c(N)c2)s1 ZINC000052756465 385456556 /nfs/dbraw/zinc/45/65/56/385456556.db2.gz GLXGPHHVUBVGMP-UHFFFAOYSA-N 1 2 238.341 2.116 20 0 BEADLO COc1ccc(N[C@@H](C)C(C)(C)OC)[nH+]c1 ZINC000378667544 385458532 /nfs/dbraw/zinc/45/85/32/385458532.db2.gz HLCIZUJEXZKASQ-VIFPVBQESA-N 1 2 224.304 2.316 20 0 BEADLO Cc1ncsc1C[N@@H+](C)Cc1c[nH]nc1C ZINC000179429879 385464972 /nfs/dbraw/zinc/46/49/72/385464972.db2.gz VILMXTAOSAIRLG-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1ncsc1C[N@H+](C)Cc1c[nH]nc1C ZINC000179429879 385464974 /nfs/dbraw/zinc/46/49/74/385464974.db2.gz VILMXTAOSAIRLG-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1ccc(C[NH2+]CC(F)(F)CO)cc1Cl ZINC000195450366 385469178 /nfs/dbraw/zinc/46/91/78/385469178.db2.gz DXNQQSRKDQWULS-UHFFFAOYSA-N 1 2 249.688 2.366 20 0 BEADLO C/C(=C\c1ccccc1)C[NH2+]Cc1ncn(C)n1 ZINC000179560652 385474697 /nfs/dbraw/zinc/47/46/97/385474697.db2.gz KSJMFTUPRFCRCE-XYOKQWHBSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@@H](CC(C)(C)C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616927928 385488386 /nfs/dbraw/zinc/48/83/86/385488386.db2.gz UMXKTPFJWPWTEC-JTQLQIEISA-N 1 2 237.347 2.440 20 0 BEADLO C[C@@H](CC(C)(C)C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616927928 385488390 /nfs/dbraw/zinc/48/83/90/385488390.db2.gz UMXKTPFJWPWTEC-JTQLQIEISA-N 1 2 237.347 2.440 20 0 BEADLO FC(F)(F)Cn1ccnc1C[NH+]1CCCC1 ZINC000171372620 385480711 /nfs/dbraw/zinc/48/07/11/385480711.db2.gz CPWBLLJZJZXLIB-UHFFFAOYSA-N 1 2 233.237 2.041 20 0 BEADLO Cc1ccc(C(=O)Nc2cc[nH+]cc2O)s1 ZINC000109890994 385491003 /nfs/dbraw/zinc/49/10/03/385491003.db2.gz GNNGTALSYVLPIR-UHFFFAOYSA-N 1 2 234.280 2.409 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+]1CCO[C@@H](C)C1 ZINC000179897203 385498699 /nfs/dbraw/zinc/49/86/99/385498699.db2.gz JKSYMQQWOXAQJL-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ccc(F)cc1C[N@H+]1CCO[C@@H](C)C1 ZINC000179897203 385498704 /nfs/dbraw/zinc/49/87/04/385498704.db2.gz JKSYMQQWOXAQJL-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO c1cn(Cc2noc(C3CCCCC3)n2)c[nH+]1 ZINC000157386505 385500686 /nfs/dbraw/zinc/50/06/86/385500686.db2.gz WTEAIASQTYKUND-UHFFFAOYSA-N 1 2 232.287 2.362 20 0 BEADLO C[C@@H]1CC(C)(C)CN1C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493069273 385512416 /nfs/dbraw/zinc/51/24/16/385512416.db2.gz GRZZIMRDCCWMGY-ORAHPGNNSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@H](C(=O)N(C)Cc1c[nH+]c[nH]1)c1ccccc1 ZINC000616927882 385489168 /nfs/dbraw/zinc/48/91/68/385489168.db2.gz SFGFSYVQGIUFTD-NSHDSACASA-N 1 2 243.310 2.172 20 0 BEADLO C[C@H](C(=O)N(C)Cc1c[nH]c[nH+]1)c1ccccc1 ZINC000616927882 385489174 /nfs/dbraw/zinc/48/91/74/385489174.db2.gz SFGFSYVQGIUFTD-NSHDSACASA-N 1 2 243.310 2.172 20 0 BEADLO CC(C)c1nc(C[NH2+][C@@H]2CSC[C@H]2C)no1 ZINC000309316970 385528784 /nfs/dbraw/zinc/52/87/84/385528784.db2.gz DHYBSBVENBZAJR-RKDXNWHRSA-N 1 2 241.360 2.034 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ncc[nH]2)cc1 ZINC000171912059 385531088 /nfs/dbraw/zinc/53/10/88/385531088.db2.gz ZFJOEVCGBBZTEZ-UHFFFAOYSA-N 1 2 215.300 2.350 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ncc[nH]2)cc1 ZINC000171912059 385531092 /nfs/dbraw/zinc/53/10/92/385531092.db2.gz ZFJOEVCGBBZTEZ-UHFFFAOYSA-N 1 2 215.300 2.350 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@H]1CCCOCC1 ZINC000180609747 385532813 /nfs/dbraw/zinc/53/28/13/385532813.db2.gz MORUHIFPYNBTMH-LLVKDONJSA-N 1 2 249.314 2.081 20 0 BEADLO CC[C@@H](F)CSCCn1cc[nH+]c1 ZINC000308212416 385533801 /nfs/dbraw/zinc/53/38/01/385533801.db2.gz GZYXUAZDMSDKFA-SECBINFHSA-N 1 2 202.298 2.364 20 0 BEADLO CC[N@H+](CC(F)F)C[C@H]1CCSC1 ZINC000308215323 385535009 /nfs/dbraw/zinc/53/50/09/385535009.db2.gz JBGXEDUIAJBLPF-MRVPVSSYSA-N 1 2 209.305 2.327 20 0 BEADLO CC[N@@H+](CC(F)F)C[C@H]1CCSC1 ZINC000308215323 385535013 /nfs/dbraw/zinc/53/50/13/385535013.db2.gz JBGXEDUIAJBLPF-MRVPVSSYSA-N 1 2 209.305 2.327 20 0 BEADLO CO[C@H](C)CSc1[nH+]cc2ccccn21 ZINC000180751594 385543807 /nfs/dbraw/zinc/54/38/07/385543807.db2.gz LXAKXLONDLDDJM-SECBINFHSA-N 1 2 222.313 2.461 20 0 BEADLO CC(C)(C)C1CC(NC(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493111201 385521540 /nfs/dbraw/zinc/52/15/40/385521540.db2.gz CFLXCCSJALCBIF-SNAWJCMRSA-N 1 2 247.342 2.364 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1ccncc1 ZINC000107285781 385562549 /nfs/dbraw/zinc/56/25/49/385562549.db2.gz YKWRXOPGKXYWJG-UHFFFAOYSA-N 1 2 213.240 2.037 20 0 BEADLO Cc1nnc(C[N@H+]2CCC[C@H]2c2cccn2C)o1 ZINC000181083295 385562920 /nfs/dbraw/zinc/56/29/20/385562920.db2.gz XDLAHGLAZJGMKE-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC[C@H]2c2cccn2C)o1 ZINC000181083295 385562923 /nfs/dbraw/zinc/56/29/23/385562923.db2.gz XDLAHGLAZJGMKE-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO FC(F)O[C@H]1CCCC[C@H]1[NH2+]Cc1ccn[nH]1 ZINC000337306552 385593324 /nfs/dbraw/zinc/59/33/24/385593324.db2.gz RVXHQVGBGCWYJM-ZJUUUORDSA-N 1 2 245.273 2.050 20 0 BEADLO COC[C@@H]([NH2+]Cc1cc(C)on1)c1ccccc1 ZINC000181684905 385593495 /nfs/dbraw/zinc/59/34/95/385593495.db2.gz MLCKDLLRTDSPDS-CQSZACIVSA-N 1 2 246.310 2.460 20 0 BEADLO FC(F)C1([NH2+]Cc2ccc3c[nH]nc3c2)CC1 ZINC000337321999 385597205 /nfs/dbraw/zinc/59/72/05/385597205.db2.gz ZRPOVABAANNQGC-UHFFFAOYSA-N 1 2 237.253 2.450 20 0 BEADLO c1ccc(NC[C@@H]2Cc3ccccc3O2)[nH+]c1 ZINC000037998900 385597391 /nfs/dbraw/zinc/59/73/91/385597391.db2.gz PMOYKYWAPMFROA-LBPRGKRZSA-N 1 2 226.279 2.497 20 0 BEADLO CCOc1ccc(COc2cc[nH+]cc2)nc1 ZINC000644869503 385601038 /nfs/dbraw/zinc/60/10/38/385601038.db2.gz FVJGITREPWVQSP-UHFFFAOYSA-N 1 2 230.267 2.454 20 0 BEADLO CC[C@H](SC)C(=O)Nc1cccc2[nH+]ccn21 ZINC000269526638 385601391 /nfs/dbraw/zinc/60/13/91/385601391.db2.gz FVKLPNAEOHYUFN-VIFPVBQESA-N 1 2 249.339 2.414 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1ccc(C)c(C)c1 ZINC000280791765 385604949 /nfs/dbraw/zinc/60/49/49/385604949.db2.gz HPPCAPFXJYDETM-LBPRGKRZSA-N 1 2 235.327 2.297 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1ccc(C)c(C)c1 ZINC000280791765 385604952 /nfs/dbraw/zinc/60/49/52/385604952.db2.gz HPPCAPFXJYDETM-LBPRGKRZSA-N 1 2 235.327 2.297 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)/C=C\C1CCCCC1 ZINC000493522775 385581970 /nfs/dbraw/zinc/58/19/70/385581970.db2.gz KFZPAHRMBKEPFC-FPLPWBNLSA-N 1 2 247.342 2.173 20 0 BEADLO CC[C@H](F)C[NH2+][C@H](C)c1nnc(C)s1 ZINC000336649068 385586974 /nfs/dbraw/zinc/58/69/74/385586974.db2.gz HIQVOWZAMVZQDI-SVRRBLITSA-N 1 2 217.313 2.245 20 0 BEADLO CC[C@](C)(OC)C(=O)Nc1cc[nH+]c(C)c1 ZINC000280972552 385622998 /nfs/dbraw/zinc/62/29/98/385622998.db2.gz LMHWPVAAHOBDCM-LBPRGKRZSA-N 1 2 222.288 2.144 20 0 BEADLO C[C@H]1SCC[N@H+](Cc2nccs2)[C@H]1C ZINC000269672245 385623157 /nfs/dbraw/zinc/62/31/57/385623157.db2.gz AUFCBDMUTSTTKP-DTWKUNHWSA-N 1 2 228.386 2.469 20 0 BEADLO C[C@H]1SCC[N@@H+](Cc2nccs2)[C@H]1C ZINC000269672245 385623160 /nfs/dbraw/zinc/62/31/60/385623160.db2.gz AUFCBDMUTSTTKP-DTWKUNHWSA-N 1 2 228.386 2.469 20 0 BEADLO C[N@H+](Cc1nccs1)[C@H](CO)c1ccccc1 ZINC000269672140 385623175 /nfs/dbraw/zinc/62/31/75/385623175.db2.gz ASDCVTBMFFIAPS-GFCCVEGCSA-N 1 2 248.351 2.309 20 0 BEADLO C[N@@H+](Cc1nccs1)[C@H](CO)c1ccccc1 ZINC000269672140 385623176 /nfs/dbraw/zinc/62/31/76/385623176.db2.gz ASDCVTBMFFIAPS-GFCCVEGCSA-N 1 2 248.351 2.309 20 0 BEADLO Cc1ccsc1CCNc1cc(C)[nH+]cn1 ZINC000336680780 385631336 /nfs/dbraw/zinc/63/13/36/385631336.db2.gz CXWBEZLEWWCCKW-UHFFFAOYSA-N 1 2 233.340 2.231 20 0 BEADLO CCCn1c(C)nnc1C[N@@H+]1CCC=C(C)C1 ZINC000280822600 385607640 /nfs/dbraw/zinc/60/76/40/385607640.db2.gz NPJXUVHTHAWULD-UHFFFAOYSA-N 1 2 234.347 2.149 20 0 BEADLO CCCn1c(C)nnc1C[N@H+]1CCC=C(C)C1 ZINC000280822600 385607647 /nfs/dbraw/zinc/60/76/47/385607647.db2.gz NPJXUVHTHAWULD-UHFFFAOYSA-N 1 2 234.347 2.149 20 0 BEADLO FCC[NH2+]Cc1csc(-c2ccccn2)n1 ZINC000280853588 385611955 /nfs/dbraw/zinc/61/19/55/385611955.db2.gz ZVBSLKMUHXVQFZ-UHFFFAOYSA-N 1 2 237.303 2.264 20 0 BEADLO C[C@@H]1OCC[C@@H]1Sc1[nH+]cnc2[nH]ccc21 ZINC000269905194 385645793 /nfs/dbraw/zinc/64/57/93/385645793.db2.gz GQYRUFLQRIVTSY-CBAPKCEASA-N 1 2 235.312 2.227 20 0 BEADLO CC(C)[C@H](Nc1ncccn1)c1[nH]cc[nH+]1 ZINC000309523273 385654798 /nfs/dbraw/zinc/65/47/98/385654798.db2.gz CDQUOHQIZWTXOW-VIFPVBQESA-N 1 2 217.276 2.009 20 0 BEADLO CO[C@H](C)CN1CC[N@@H+](C)C[C@@H]1c1ccccc1 ZINC000182370143 385661411 /nfs/dbraw/zinc/66/14/11/385661411.db2.gz JSWHLMCOWQJHQG-UKRRQHHQSA-N 1 2 248.370 2.010 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1cccnc1)c1ccon1 ZINC000309544280 385678284 /nfs/dbraw/zinc/67/82/84/385678284.db2.gz GNHXSWZTJHENQT-NXEZZACHSA-N 1 2 217.272 2.481 20 0 BEADLO c1cc2c(nc[nH+]c2SC2CCOCC2)[nH]1 ZINC000270225730 385686571 /nfs/dbraw/zinc/68/65/71/385686571.db2.gz UODZHOCVWZGMLA-UHFFFAOYSA-N 1 2 235.312 2.229 20 0 BEADLO C[C@@H]([NH2+]CC(F)(F)CO)c1ccsc1 ZINC000184695346 385691820 /nfs/dbraw/zinc/69/18/20/385691820.db2.gz KFODJAMMWDZPRW-SSDOTTSWSA-N 1 2 221.272 2.026 20 0 BEADLO C[C@H](CO)CCCNc1cc[nH+]c(C2CC2)n1 ZINC000270341010 385699164 /nfs/dbraw/zinc/69/91/64/385699164.db2.gz ZNVYLCQGCLFLKS-JTQLQIEISA-N 1 2 235.331 2.175 20 0 BEADLO CCCCc1nc(C[N@H+](C)CCCO)cs1 ZINC000281821881 385704804 /nfs/dbraw/zinc/70/48/04/385704804.db2.gz LTMBSUIKNCYWSW-UHFFFAOYSA-N 1 2 242.388 2.300 20 0 BEADLO CCCCc1nc(C[N@@H+](C)CCCO)cs1 ZINC000281821881 385704809 /nfs/dbraw/zinc/70/48/09/385704809.db2.gz LTMBSUIKNCYWSW-UHFFFAOYSA-N 1 2 242.388 2.300 20 0 BEADLO CN(CCCn1cc[nH+]c1)OCc1ccccc1 ZINC000183057918 385733410 /nfs/dbraw/zinc/73/34/10/385733410.db2.gz LIRVMVQSJXHICL-UHFFFAOYSA-N 1 2 245.326 2.337 20 0 BEADLO C[N@H+](CCOC(C)(C)C)Cc1ccncc1F ZINC000648378809 385734545 /nfs/dbraw/zinc/73/45/45/385734545.db2.gz YGBOCTOFNKWEQF-UHFFFAOYSA-N 1 2 240.322 2.468 20 0 BEADLO C[N@@H+](CCOC(C)(C)C)Cc1ccncc1F ZINC000648378809 385734548 /nfs/dbraw/zinc/73/45/48/385734548.db2.gz YGBOCTOFNKWEQF-UHFFFAOYSA-N 1 2 240.322 2.468 20 0 BEADLO C[C@@H]1OCC[N@H+](Cc2cc(O)cc(F)c2)[C@H]1C ZINC000186228536 385750194 /nfs/dbraw/zinc/75/01/94/385750194.db2.gz ZYDWMAAZZAFEGM-UWVGGRQHSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@@H]1OCC[N@@H+](Cc2cc(O)cc(F)c2)[C@H]1C ZINC000186228536 385750199 /nfs/dbraw/zinc/75/01/99/385750199.db2.gz ZYDWMAAZZAFEGM-UWVGGRQHSA-N 1 2 239.290 2.141 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC[C@H]1C[C@@H]1C ZINC000271108241 385786607 /nfs/dbraw/zinc/78/66/07/385786607.db2.gz FOVQSGBZWBQWHJ-WCBMZHEXSA-N 1 2 219.288 2.168 20 0 BEADLO CC(C)[N@@H+](Cc1cc[nH]n1)Cc1ccco1 ZINC000271030494 385773350 /nfs/dbraw/zinc/77/33/50/385773350.db2.gz CIXTXUWUJRQIMO-UHFFFAOYSA-N 1 2 219.288 2.413 20 0 BEADLO CC(C)[N@H+](Cc1cc[nH]n1)Cc1ccco1 ZINC000271030494 385773352 /nfs/dbraw/zinc/77/33/52/385773352.db2.gz CIXTXUWUJRQIMO-UHFFFAOYSA-N 1 2 219.288 2.413 20 0 BEADLO FC(F)[C@H]1CCC[N@@H+]1CCO[C@@H]1CCCCO1 ZINC000353197027 385722623 /nfs/dbraw/zinc/72/26/23/385722623.db2.gz VHGRLRAGSPJINW-GHMZBOCLSA-N 1 2 249.301 2.259 20 0 BEADLO FC(F)[C@H]1CCC[N@H+]1CCO[C@@H]1CCCCO1 ZINC000353197027 385722629 /nfs/dbraw/zinc/72/26/29/385722629.db2.gz VHGRLRAGSPJINW-GHMZBOCLSA-N 1 2 249.301 2.259 20 0 BEADLO CCn1ncnc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000488453311 385799725 /nfs/dbraw/zinc/79/97/25/385799725.db2.gz ZDMPDMOVFNFTHA-CYBMUJFWSA-N 1 2 242.326 2.245 20 0 BEADLO CCn1ncnc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000488453311 385799730 /nfs/dbraw/zinc/79/97/30/385799730.db2.gz ZDMPDMOVFNFTHA-CYBMUJFWSA-N 1 2 242.326 2.245 20 0 BEADLO C[C@@H]1[C@H](C)[S@@](=O)CC[N@@H+]1Cc1cccs1 ZINC000271180141 385801077 /nfs/dbraw/zinc/80/10/77/385801077.db2.gz HIPKSPKQPCFKLL-FTGAXOIBSA-N 1 2 243.397 2.089 20 0 BEADLO C[C@@H]1[C@H](C)[S@@](=O)CC[N@H+]1Cc1cccs1 ZINC000271180141 385801078 /nfs/dbraw/zinc/80/10/78/385801078.db2.gz HIPKSPKQPCFKLL-FTGAXOIBSA-N 1 2 243.397 2.089 20 0 BEADLO Cc1cc(N2CCNc3ccccc3C2)nc[nH+]1 ZINC000602542191 385806165 /nfs/dbraw/zinc/80/61/65/385806165.db2.gz LXAYPGSCEPUWFZ-UHFFFAOYSA-N 1 2 240.310 2.217 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC1(C)CCCCC1 ZINC000283145449 385809830 /nfs/dbraw/zinc/80/98/30/385809830.db2.gz VOXLKXBTYVWMTQ-UHFFFAOYSA-N 1 2 235.331 2.100 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)NC1(C)CCCCC1 ZINC000283145449 385809836 /nfs/dbraw/zinc/80/98/36/385809836.db2.gz VOXLKXBTYVWMTQ-UHFFFAOYSA-N 1 2 235.331 2.100 20 0 BEADLO Cc1nsc(NCCCNc2cccc[nH+]2)n1 ZINC000271277664 385812590 /nfs/dbraw/zinc/81/25/90/385812590.db2.gz FSFATDTYRVYWAB-UHFFFAOYSA-N 1 2 249.343 2.156 20 0 BEADLO COC(=O)C[N@H+](Cc1ccc(C)s1)C1CC1 ZINC000271300991 385814771 /nfs/dbraw/zinc/81/47/71/385814771.db2.gz UIDCZGCSBHYWGO-UHFFFAOYSA-N 1 2 239.340 2.194 20 0 BEADLO COC(=O)C[N@@H+](Cc1ccc(C)s1)C1CC1 ZINC000271300991 385814773 /nfs/dbraw/zinc/81/47/73/385814773.db2.gz UIDCZGCSBHYWGO-UHFFFAOYSA-N 1 2 239.340 2.194 20 0 BEADLO COCc1cccc(C[N@@H+]2CCC(=O)[C@@H](C)C2)c1 ZINC000283300124 385816704 /nfs/dbraw/zinc/81/67/04/385816704.db2.gz XLTLXLKGOCYJIH-LBPRGKRZSA-N 1 2 247.338 2.244 20 0 BEADLO COCc1cccc(C[N@H+]2CCC(=O)[C@@H](C)C2)c1 ZINC000283300124 385816709 /nfs/dbraw/zinc/81/67/09/385816709.db2.gz XLTLXLKGOCYJIH-LBPRGKRZSA-N 1 2 247.338 2.244 20 0 BEADLO CCc1nc(C[N@@H+]2CCCC(C)(C)C2)no1 ZINC000112702143 385857434 /nfs/dbraw/zinc/85/74/34/385857434.db2.gz YWKSSXAQIXMUPE-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO CCc1nc(C[N@H+]2CCCC(C)(C)C2)no1 ZINC000112702143 385857439 /nfs/dbraw/zinc/85/74/39/385857439.db2.gz YWKSSXAQIXMUPE-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO Cc1sccc1C(=O)NCCCn1cc[nH+]c1 ZINC000294255602 385830002 /nfs/dbraw/zinc/83/00/02/385830002.db2.gz PREZDBDAVZZYCS-UHFFFAOYSA-N 1 2 249.339 2.073 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCc3sccc3C2)n1 ZINC000336555934 385830801 /nfs/dbraw/zinc/83/08/01/385830801.db2.gz KDDILJFVXZIIDN-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ccnc(C[N@H+]2CCc3sccc3C2)n1 ZINC000336555934 385830807 /nfs/dbraw/zinc/83/08/07/385830807.db2.gz KDDILJFVXZIIDN-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CCc2cc(F)ccc2C1 ZINC000283719441 385831027 /nfs/dbraw/zinc/83/10/27/385831027.db2.gz AZRUVADLEXHSFH-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CCc2cc(F)ccc2C1 ZINC000283719441 385831029 /nfs/dbraw/zinc/83/10/29/385831029.db2.gz AZRUVADLEXHSFH-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1noc(C(C)(C)[NH2+]Cc2occc2C)n1 ZINC000283828733 385834826 /nfs/dbraw/zinc/83/48/26/385834826.db2.gz FAGIGAVUNWGMQK-UHFFFAOYSA-N 1 2 235.287 2.304 20 0 BEADLO Cc1sccc1C(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000294295549 385835039 /nfs/dbraw/zinc/83/50/39/385835039.db2.gz BTFBORLHVHNYRS-VIFPVBQESA-N 1 2 249.339 2.072 20 0 BEADLO c1ccc2[nH+]c(N3CCO[C@H]4CCC[C@H]43)[nH]c2c1 ZINC000271571072 385837904 /nfs/dbraw/zinc/83/79/04/385837904.db2.gz BTYOZWAZKOODNE-OLZOCXBDSA-N 1 2 243.310 2.321 20 0 BEADLO CCC[C@H]1CCC[C@@H]1C(=O)NCc1[nH+]ccn1C ZINC000294503174 385858604 /nfs/dbraw/zinc/85/86/04/385858604.db2.gz HCIGBTDEPAZVNV-RYUDHWBXSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1c[nH]nc1CN1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000284039797 385847856 /nfs/dbraw/zinc/84/78/56/385847856.db2.gz LSCILFSUYYVADO-LBPRGKRZSA-N 1 2 245.330 2.168 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NOC1CCCC1 ZINC000271804048 385851454 /nfs/dbraw/zinc/85/14/54/385851454.db2.gz KRZLXVBQZJYGNZ-UHFFFAOYSA-N 1 2 235.287 2.386 20 0 BEADLO CC(C)c1ccoc1C(=O)NCc1[nH]cc[nH+]1 ZINC000284084548 385851796 /nfs/dbraw/zinc/85/17/96/385851796.db2.gz SQLJLVNBNJHBCB-UHFFFAOYSA-N 1 2 233.271 2.056 20 0 BEADLO CCCC(CCC)C(=O)NCc1[nH+]ccn1C ZINC000337945188 385854002 /nfs/dbraw/zinc/85/40/02/385854002.db2.gz WKVWQUHHSTUVAZ-UHFFFAOYSA-N 1 2 237.347 2.253 20 0 BEADLO C[NH2+]Cc1cccc(NCc2cn[nH]c2C)c1 ZINC000414871205 385854255 /nfs/dbraw/zinc/85/42/55/385854255.db2.gz SVNHVAJAPYFOKM-UHFFFAOYSA-N 1 2 230.315 2.050 20 0 BEADLO CC[C@@H](Cc1ccc(C)cc1)[NH2+][C@@H](C)C(=O)OC ZINC000271846454 385855022 /nfs/dbraw/zinc/85/50/22/385855022.db2.gz UZRQTGSJAUPMRA-JSGCOSHPSA-N 1 2 249.354 2.467 20 0 BEADLO CC1(C)CCCN(C(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000284177255 385855365 /nfs/dbraw/zinc/85/53/65/385855365.db2.gz YBUIWYOMPAMDJR-SNAWJCMRSA-N 1 2 247.342 2.462 20 0 BEADLO Fc1cc(F)cc(C[NH+]2CC3(C2)CCOC3)c1 ZINC000294024916 385788913 /nfs/dbraw/zinc/78/89/13/385788913.db2.gz NSAREPVFTSFDNE-UHFFFAOYSA-N 1 2 239.265 2.187 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NCCC(C)(C)C1CC1 ZINC000294029096 385789220 /nfs/dbraw/zinc/78/92/20/385789220.db2.gz CXOSYWUWQXSBHO-UHFFFAOYSA-N 1 2 249.358 2.203 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)NCCC(C)(C)C1CC1 ZINC000294029096 385789228 /nfs/dbraw/zinc/78/92/28/385789228.db2.gz CXOSYWUWQXSBHO-UHFFFAOYSA-N 1 2 249.358 2.203 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CC[C@H](C)C1 ZINC000271151106 385793582 /nfs/dbraw/zinc/79/35/82/385793582.db2.gz SSRYWMMLRRDXSN-VIFPVBQESA-N 1 2 219.288 2.264 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccc(CO)cc2)no1 ZINC000272204630 385884297 /nfs/dbraw/zinc/88/42/97/385884297.db2.gz BDCWFQUPRJOIRQ-UHFFFAOYSA-N 1 2 246.310 2.107 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccc(CO)cc2)no1 ZINC000272204630 385884299 /nfs/dbraw/zinc/88/42/99/385884299.db2.gz BDCWFQUPRJOIRQ-UHFFFAOYSA-N 1 2 246.310 2.107 20 0 BEADLO Cn1c2cc(F)ccc2[nH+]c1N1CCCC1 ZINC000335802324 385890269 /nfs/dbraw/zinc/89/02/69/385890269.db2.gz RNWMHJFBQQUKKD-UHFFFAOYSA-N 1 2 219.263 2.313 20 0 BEADLO Cc1nc(N2Cc3cccnc3C2)c(C)c(C)[nH+]1 ZINC000644877298 385891133 /nfs/dbraw/zinc/89/11/33/385891133.db2.gz DRFMFYPFLIOVCY-UHFFFAOYSA-N 1 2 240.310 2.317 20 0 BEADLO c1cc2c(nc[nH+]c2S[C@@H]2CCCOC2)[nH]1 ZINC000272402297 385899674 /nfs/dbraw/zinc/89/96/74/385899674.db2.gz BDJQLZDQTCESAL-MRVPVSSYSA-N 1 2 235.312 2.229 20 0 BEADLO CC(C)c1nnc([C@@H](C)[NH2+][C@H](C)c2cn[nH]c2)[nH]1 ZINC000285157033 385902637 /nfs/dbraw/zinc/90/26/37/385902637.db2.gz MKVAZYHBDDOOSG-RKDXNWHRSA-N 1 2 248.334 2.063 20 0 BEADLO CC(C)c1nnc([C@H](C)[NH2+][C@H](C)c2cn[nH]c2)[nH]1 ZINC000285157020 385903461 /nfs/dbraw/zinc/90/34/61/385903461.db2.gz MKVAZYHBDDOOSG-BDAKNGLRSA-N 1 2 248.334 2.063 20 0 BEADLO CSC1(C[N@@H+]2CCC(F)(F)C2)CC1 ZINC000307100036 385906126 /nfs/dbraw/zinc/90/61/26/385906126.db2.gz SLDNAUPYZHAPAD-UHFFFAOYSA-N 1 2 207.289 2.223 20 0 BEADLO CSC1(C[N@H+]2CCC(F)(F)C2)CC1 ZINC000307100036 385906129 /nfs/dbraw/zinc/90/61/29/385906129.db2.gz SLDNAUPYZHAPAD-UHFFFAOYSA-N 1 2 207.289 2.223 20 0 BEADLO CC[C@@H](C)CCC(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000285292666 385912496 /nfs/dbraw/zinc/91/24/96/385912496.db2.gz VMWZEYUBXDYUOK-NEPJUHHUSA-N 1 2 237.347 2.214 20 0 BEADLO Cn1ncc2c1nc[nH+]c2SCCCCF ZINC000285311445 385913159 /nfs/dbraw/zinc/91/31/59/385913159.db2.gz WQWMVJIHNZQOCF-UHFFFAOYSA-N 1 2 240.307 2.205 20 0 BEADLO CC/C=C/CNc1cc(N2CCCC2)nc[nH+]1 ZINC000294922214 385915952 /nfs/dbraw/zinc/91/59/52/385915952.db2.gz GQTSWFUEJHUKCI-ONEGZZNKSA-N 1 2 232.331 2.455 20 0 BEADLO CC/C=C/CNc1cc(N2CCCC2)[nH+]cn1 ZINC000294922214 385915956 /nfs/dbraw/zinc/91/59/56/385915956.db2.gz GQTSWFUEJHUKCI-ONEGZZNKSA-N 1 2 232.331 2.455 20 0 BEADLO Cc1nocc1C[N@H+](C)Cc1ccco1 ZINC000294921350 385916534 /nfs/dbraw/zinc/91/65/34/385916534.db2.gz OCUTWJDTPOEZJK-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO Cc1nocc1C[N@@H+](C)Cc1ccco1 ZINC000294921350 385916538 /nfs/dbraw/zinc/91/65/38/385916538.db2.gz OCUTWJDTPOEZJK-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO CC/C(C)=C/C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000294536636 385863274 /nfs/dbraw/zinc/86/32/74/385863274.db2.gz LTTXMNXGVDREBX-ZRDIBKRKSA-N 1 2 247.342 2.403 20 0 BEADLO C[C@@H](NC(=O)c1cc[nH]c1C1CC1)c1[nH]cc[nH+]1 ZINC000647808866 385866724 /nfs/dbraw/zinc/86/67/24/385866724.db2.gz RKBJVLVEUMXTEE-MRVPVSSYSA-N 1 2 244.298 2.106 20 0 BEADLO Cc1nc(C)c(CNc2cccc[nH+]2)o1 ZINC000311773845 385868654 /nfs/dbraw/zinc/86/86/54/385868654.db2.gz HTCFTTCOYRCLEI-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO COc1nccnc1C[N@H+](C)[C@@H](C)c1ccco1 ZINC000294582480 385870974 /nfs/dbraw/zinc/87/09/74/385870974.db2.gz QHBQKBLFHXYTOM-JTQLQIEISA-N 1 2 247.298 2.271 20 0 BEADLO COc1nccnc1C[N@@H+](C)[C@@H](C)c1ccco1 ZINC000294582480 385870979 /nfs/dbraw/zinc/87/09/79/385870979.db2.gz QHBQKBLFHXYTOM-JTQLQIEISA-N 1 2 247.298 2.271 20 0 BEADLO CCCC[NH2+][C@H](c1cn[nH]n1)c1ccc(F)cc1 ZINC000340470445 385871392 /nfs/dbraw/zinc/87/13/92/385871392.db2.gz OJJOQBFFPLEYSH-ZDUSSCGKSA-N 1 2 248.305 2.423 20 0 BEADLO CCCC[NH2+][C@H](c1c[nH]nn1)c1ccc(F)cc1 ZINC000340470445 385871395 /nfs/dbraw/zinc/87/13/95/385871395.db2.gz OJJOQBFFPLEYSH-ZDUSSCGKSA-N 1 2 248.305 2.423 20 0 BEADLO CCC[C@H](OC)C(=O)Nc1cc[nH+]cc1C ZINC000294583998 385871500 /nfs/dbraw/zinc/87/15/00/385871500.db2.gz KZLFFYPQUSSQAZ-NSHDSACASA-N 1 2 222.288 2.144 20 0 BEADLO FC(F)[C@@H]1CCC[N@@H+]1CCOCC1CC1 ZINC000353173238 385872150 /nfs/dbraw/zinc/87/21/50/385872150.db2.gz OQXUUZGXYWNVHT-JTQLQIEISA-N 1 2 219.275 2.143 20 0 BEADLO FC(F)[C@@H]1CCC[N@H+]1CCOCC1CC1 ZINC000353173238 385872155 /nfs/dbraw/zinc/87/21/55/385872155.db2.gz OQXUUZGXYWNVHT-JTQLQIEISA-N 1 2 219.275 2.143 20 0 BEADLO CC(C)CC1(CNC(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000284496898 385872441 /nfs/dbraw/zinc/87/24/41/385872441.db2.gz USVPPPBOKQGHEG-ONEGZZNKSA-N 1 2 247.342 2.365 20 0 BEADLO Cn1ccc(C[N@@H+]2CCC[C@H]2c2ccncc2)n1 ZINC000272081799 385873924 /nfs/dbraw/zinc/87/39/24/385873924.db2.gz WMCIVCCMVQGYTG-AWEZNQCLSA-N 1 2 242.326 2.152 20 0 BEADLO Cn1ccc(C[N@H+]2CCC[C@H]2c2ccncc2)n1 ZINC000272081799 385873927 /nfs/dbraw/zinc/87/39/27/385873927.db2.gz WMCIVCCMVQGYTG-AWEZNQCLSA-N 1 2 242.326 2.152 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1nccn1C)c1ccncc1F ZINC000338017858 385875354 /nfs/dbraw/zinc/87/53/54/385875354.db2.gz WQILSANHBAHSMR-ZJUUUORDSA-N 1 2 248.305 2.366 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccncc2C)no1 ZINC000294642102 385877407 /nfs/dbraw/zinc/87/74/07/385877407.db2.gz AYHGDQBSNNEKAT-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccncc2C)no1 ZINC000294642102 385877410 /nfs/dbraw/zinc/87/74/10/385877410.db2.gz AYHGDQBSNNEKAT-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CC(C)C[C@@H](C)CC(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000647735904 385877866 /nfs/dbraw/zinc/87/78/66/385877866.db2.gz QXOJMWNTKAECOR-LLVKDONJSA-N 1 2 249.358 2.367 20 0 BEADLO CC(C)C[C@@H](C)CC(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000647735904 385877867 /nfs/dbraw/zinc/87/78/67/385877867.db2.gz QXOJMWNTKAECOR-LLVKDONJSA-N 1 2 249.358 2.367 20 0 BEADLO C[C@H]([NH2+]Cc1nnc(C2CC2)[nH]1)c1ccco1 ZINC000273231833 385978681 /nfs/dbraw/zinc/97/86/81/385978681.db2.gz CPSMFIDZMHMSGZ-QMMMGPOBSA-N 1 2 232.287 2.126 20 0 BEADLO Cl/C=C/C[N@@H+]1CCC[C@H]1c1cc[nH]n1 ZINC000285968779 385982918 /nfs/dbraw/zinc/98/29/18/385982918.db2.gz DOOARKVLAREOQT-FWYAXHSGSA-N 1 2 211.696 2.299 20 0 BEADLO Cl/C=C/C[N@H+]1CCC[C@H]1c1cc[nH]n1 ZINC000285968779 385982920 /nfs/dbraw/zinc/98/29/20/385982920.db2.gz DOOARKVLAREOQT-FWYAXHSGSA-N 1 2 211.696 2.299 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CC(C2CCC2)C1 ZINC000334321358 385985697 /nfs/dbraw/zinc/98/56/97/385985697.db2.gz WULDPIGIFAMDPJ-UHFFFAOYSA-N 1 2 245.326 2.076 20 0 BEADLO Cc1c(Cl)cncc1NCc1c[nH+]cn1C ZINC000295183600 385988233 /nfs/dbraw/zinc/98/82/33/385988233.db2.gz WFBPPBNHDHFEQK-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO CCC[C@H](OC)C(=O)Nc1cc[nH+]c(C)c1 ZINC000294980850 385935412 /nfs/dbraw/zinc/93/54/12/385935412.db2.gz RZCSNPNAVJJVQR-NSHDSACASA-N 1 2 222.288 2.144 20 0 BEADLO F[C@@H]1CN(c2[nH]c3ccccc3[nH+]2)C[C@@H]1F ZINC000295016279 385945171 /nfs/dbraw/zinc/94/51/71/385945171.db2.gz PZSANDIOMZLMTE-OCAPTIKFSA-N 1 2 223.226 2.059 20 0 BEADLO C[C@H]1COc2ccccc2C[N@@H+]1Cc1ccon1 ZINC000272935173 385952269 /nfs/dbraw/zinc/95/22/69/385952269.db2.gz KKMYHDMLTFHRSV-NSHDSACASA-N 1 2 244.294 2.458 20 0 BEADLO C[C@H]1COc2ccccc2C[N@H+]1Cc1ccon1 ZINC000272935173 385952272 /nfs/dbraw/zinc/95/22/72/385952272.db2.gz KKMYHDMLTFHRSV-NSHDSACASA-N 1 2 244.294 2.458 20 0 BEADLO C[C@@H]1OCC[C@H]1Nc1ccc2c(c1)CC[NH2+]2 ZINC000335054922 385953769 /nfs/dbraw/zinc/95/37/69/385953769.db2.gz ORPLUMIGZXMUIG-JOYOIKCWSA-N 1 2 218.300 2.244 20 0 BEADLO Cn1cc(Cl)c(C[N@@H+]2CC[C@@H](C(F)F)C2)n1 ZINC000643251530 385962215 /nfs/dbraw/zinc/96/22/15/385962215.db2.gz JBWTZUVBSUIYJD-SSDOTTSWSA-N 1 2 249.692 2.161 20 0 BEADLO Cn1cc(Cl)c(C[N@H+]2CC[C@@H](C(F)F)C2)n1 ZINC000643251530 385962219 /nfs/dbraw/zinc/96/22/19/385962219.db2.gz JBWTZUVBSUIYJD-SSDOTTSWSA-N 1 2 249.692 2.161 20 0 BEADLO Cc1cnc(CNc2ccc[nH+]c2C)o1 ZINC000638786366 385963004 /nfs/dbraw/zinc/96/30/04/385963004.db2.gz MYMZVONUBAEJCU-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO Cc1cc(CNC(=O)N2[C@H](C)C[C@@H]2C)cc(C)[nH+]1 ZINC000335015130 385971974 /nfs/dbraw/zinc/97/19/74/385971974.db2.gz UJJNABJBRVTOAY-TXEJJXNPSA-N 1 2 247.342 2.391 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@@H](CF)C2)cs1 ZINC000334858532 385972725 /nfs/dbraw/zinc/97/27/25/385972725.db2.gz DIXMKUWGXDOGTQ-NSHDSACASA-N 1 2 229.320 2.227 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@@H](CF)C2)cs1 ZINC000334858532 385972731 /nfs/dbraw/zinc/97/27/31/385972731.db2.gz DIXMKUWGXDOGTQ-NSHDSACASA-N 1 2 229.320 2.227 20 0 BEADLO Cc1cc(N[C@@H]2CC[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000336749930 385999621 /nfs/dbraw/zinc/99/96/21/385999621.db2.gz UKDACWKQJDMYJH-GZMMTYOYSA-N 1 2 217.316 2.295 20 0 BEADLO Cc1cc(N[C@H]2CC[C@H]2C)nc(C2CC2)[nH+]1 ZINC000336749931 385999729 /nfs/dbraw/zinc/99/97/29/385999729.db2.gz UKDACWKQJDMYJH-KCJUWKMLSA-N 1 2 217.316 2.295 20 0 BEADLO CC[C@H]([NH2+][C@H]1CCO[C@H](C)C1)C(F)(F)F ZINC000336750211 386000739 /nfs/dbraw/zinc/00/07/39/386000739.db2.gz DSRLRBVTOFGTCE-VGMNWLOBSA-N 1 2 225.254 2.484 20 0 BEADLO c1cn(CCCS[C@H]2CCCOC2)c[nH+]1 ZINC000273513571 386009344 /nfs/dbraw/zinc/00/93/44/386009344.db2.gz XHAPFWZTSFPHHC-NSHDSACASA-N 1 2 226.345 2.185 20 0 BEADLO Cc1ncc(C[N@@H+]2CCn3cccc3[C@H]2C)cn1 ZINC000335068843 386015481 /nfs/dbraw/zinc/01/54/81/386015481.db2.gz ZNCILXSYFCVRRG-LLVKDONJSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1ncc(C[N@H+]2CCn3cccc3[C@H]2C)cn1 ZINC000335068843 386015487 /nfs/dbraw/zinc/01/54/87/386015487.db2.gz ZNCILXSYFCVRRG-LLVKDONJSA-N 1 2 242.326 2.163 20 0 BEADLO Brc1cc(Cn2cc[nH+]c2)ccn1 ZINC000306848628 386020863 /nfs/dbraw/zinc/02/08/63/386020863.db2.gz MTKMAFCANUOUNU-UHFFFAOYSA-N 1 2 238.088 2.089 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@]1(C)C[C@H]2C[C@H]2C1 ZINC000334423092 386027892 /nfs/dbraw/zinc/02/78/92/386027892.db2.gz FERUZFJCTNLFPO-JJLQDPRZSA-N 1 2 244.338 2.441 20 0 BEADLO CC(C)=CC[N@@H+]1CCOC[C@H]1c1c(C)n[nH]c1C ZINC000334423180 386028156 /nfs/dbraw/zinc/02/81/56/386028156.db2.gz RTTQAWNLWJNOEW-ZDUSSCGKSA-N 1 2 249.358 2.366 20 0 BEADLO CC(C)=CC[N@H+]1CCOC[C@H]1c1c(C)n[nH]c1C ZINC000334423180 386028159 /nfs/dbraw/zinc/02/81/59/386028159.db2.gz RTTQAWNLWJNOEW-ZDUSSCGKSA-N 1 2 249.358 2.366 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+]C12CCC(C)CC2 ZINC000414197742 386034570 /nfs/dbraw/zinc/03/45/70/386034570.db2.gz PXGXTUHNUHBJSI-UHFFFAOYSA-N 1 2 224.348 2.123 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@]12CCC[C@@H](C)C2 ZINC000414196460 386035851 /nfs/dbraw/zinc/03/58/51/386035851.db2.gz OWYDLMAUSMLGBO-ZWNOBZJWSA-N 1 2 224.348 2.123 20 0 BEADLO Cn1c(C[N@@H+]2CCO[C@@H]3C[C@@H]32)cc2ccccc21 ZINC000639202363 386037348 /nfs/dbraw/zinc/03/73/48/386037348.db2.gz XWPIYAWBPXNZOF-LSDHHAIUSA-N 1 2 242.322 2.151 20 0 BEADLO Cn1c(C[N@H+]2CCO[C@@H]3C[C@@H]32)cc2ccccc21 ZINC000639202363 386037357 /nfs/dbraw/zinc/03/73/57/386037357.db2.gz XWPIYAWBPXNZOF-LSDHHAIUSA-N 1 2 242.322 2.151 20 0 BEADLO CCCCC[N@@H+]1CC(=O)N[C@@]12CC[C@@H](C)C2 ZINC000414200802 386037408 /nfs/dbraw/zinc/03/74/08/386037408.db2.gz DLQTUOQOTUPHDP-YPMHNXCESA-N 1 2 224.348 2.125 20 0 BEADLO CCCCC[N@H+]1CC(=O)N[C@@]12CC[C@@H](C)C2 ZINC000414200802 386037416 /nfs/dbraw/zinc/03/74/16/386037416.db2.gz DLQTUOQOTUPHDP-YPMHNXCESA-N 1 2 224.348 2.125 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C[C@@H]1CCC[C@H]1C ZINC000274458677 386105207 /nfs/dbraw/zinc/10/52/07/386105207.db2.gz UPLAAXWWPRMOAP-KOLCDFICSA-N 1 2 235.331 2.161 20 0 BEADLO Cc1c[nH+]c(C)nc1N1C[C@@H]2CCC[C@H]2C1 ZINC000647871515 386106140 /nfs/dbraw/zinc/10/61/40/386106140.db2.gz DUAUEPCGEJVVTB-RYUDHWBXSA-N 1 2 217.316 2.330 20 0 BEADLO FC1=CCC[N@H+](Cc2cnn3ccccc23)C1 ZINC000274471916 386108494 /nfs/dbraw/zinc/10/84/94/386108494.db2.gz KBYQUTJRJNDTAG-UHFFFAOYSA-N 1 2 231.274 2.393 20 0 BEADLO FC1=CCC[N@@H+](Cc2cnn3ccccc23)C1 ZINC000274471916 386108499 /nfs/dbraw/zinc/10/84/99/386108499.db2.gz KBYQUTJRJNDTAG-UHFFFAOYSA-N 1 2 231.274 2.393 20 0 BEADLO C/C=C/C[C@@H](CO)Nc1[nH+]c2ccccc2n1C ZINC000274522960 386112944 /nfs/dbraw/zinc/11/29/44/386112944.db2.gz XAACFMIUWXUJIU-UFFNRZRYSA-N 1 2 245.326 2.312 20 0 BEADLO C[C@@]1(F)CCC[N@H+](Cc2cnc3cnccn23)C1 ZINC000296007931 386120118 /nfs/dbraw/zinc/12/01/18/386120118.db2.gz LJVGUZGVGNPQFY-CYBMUJFWSA-N 1 2 248.305 2.053 20 0 BEADLO C[C@@]1(F)CCC[N@@H+](Cc2cnc3cnccn23)C1 ZINC000296007931 386120122 /nfs/dbraw/zinc/12/01/22/386120122.db2.gz LJVGUZGVGNPQFY-CYBMUJFWSA-N 1 2 248.305 2.053 20 0 BEADLO C[C@]1(F)CCC[N@H+](Cc2cnc3cnccn23)C1 ZINC000296007933 386120619 /nfs/dbraw/zinc/12/06/19/386120619.db2.gz LJVGUZGVGNPQFY-ZDUSSCGKSA-N 1 2 248.305 2.053 20 0 BEADLO C[C@]1(F)CCC[N@@H+](Cc2cnc3cnccn23)C1 ZINC000296007933 386120622 /nfs/dbraw/zinc/12/06/22/386120622.db2.gz LJVGUZGVGNPQFY-ZDUSSCGKSA-N 1 2 248.305 2.053 20 0 BEADLO CCn1ccc(C[NH2+][C@@H](C)c2ccco2)n1 ZINC000414208325 386062550 /nfs/dbraw/zinc/06/25/50/386062550.db2.gz LQORQHHXRGNSBJ-JTQLQIEISA-N 1 2 219.288 2.347 20 0 BEADLO C[NH2+]Cc1noc([C@H]2[C@H](c3ccccc3)[C@@H]2C)n1 ZINC000414649557 386070523 /nfs/dbraw/zinc/07/05/23/386070523.db2.gz XAFCETDAWWPNBQ-TVYUQYBPSA-N 1 2 243.310 2.306 20 0 BEADLO CC(C)c1noc([C@H](C)[NH2+][C@@H](C)c2cn[nH]c2)n1 ZINC000274152786 386077526 /nfs/dbraw/zinc/07/75/26/386077526.db2.gz YLYCWUYHODSYTJ-IUCAKERBSA-N 1 2 249.318 2.328 20 0 BEADLO CC(C)c1noc([C@@H](C)[NH2+][C@H](C)c2cn[nH]c2)n1 ZINC000274152788 386077601 /nfs/dbraw/zinc/07/76/01/386077601.db2.gz YLYCWUYHODSYTJ-RKDXNWHRSA-N 1 2 249.318 2.328 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCOC[C@@H]1C1CC1 ZINC000365408180 386079585 /nfs/dbraw/zinc/07/95/85/386079585.db2.gz BGFOINHCYYMIQV-CQSZACIVSA-N 1 2 249.358 2.075 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCOC[C@@H]1C1CC1 ZINC000365408180 386079591 /nfs/dbraw/zinc/07/95/91/386079591.db2.gz BGFOINHCYYMIQV-CQSZACIVSA-N 1 2 249.358 2.075 20 0 BEADLO Cc1nc(NC[C@H]2CCCC[C@H]2C)nc(N)[nH+]1 ZINC000310086286 386082255 /nfs/dbraw/zinc/08/22/55/386082255.db2.gz ATZFEFKYGCRKBR-PSASIEDQSA-N 1 2 235.335 2.000 20 0 BEADLO Cc1nc(N)nc(NC[C@H]2CCCC[C@H]2C)[nH+]1 ZINC000310086286 386082258 /nfs/dbraw/zinc/08/22/58/386082258.db2.gz ATZFEFKYGCRKBR-PSASIEDQSA-N 1 2 235.335 2.000 20 0 BEADLO CC(C)C[C@H](C)C(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000274245100 386084295 /nfs/dbraw/zinc/08/42/95/386084295.db2.gz SRLNLWGGNNVZEZ-RYUDHWBXSA-N 1 2 237.347 2.070 20 0 BEADLO c1coc(C[NH2+]Cc2cc(C3CC3)no2)c1 ZINC000638290002 386122760 /nfs/dbraw/zinc/12/27/60/386122760.db2.gz NWWWDRDRAFCHLI-UHFFFAOYSA-N 1 2 218.256 2.435 20 0 BEADLO CC(C)C[C@@H](C)C(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000274245098 386085853 /nfs/dbraw/zinc/08/58/53/386085853.db2.gz SRLNLWGGNNVZEZ-NEPJUHHUSA-N 1 2 237.347 2.070 20 0 BEADLO FC(F)(F)c1cc[nH+]c(N2CCO[C@@H]3C[C@@H]32)c1 ZINC000366108514 386085967 /nfs/dbraw/zinc/08/59/67/386085967.db2.gz ABTBGUJRLSAYQO-DTWKUNHWSA-N 1 2 244.216 2.078 20 0 BEADLO C[C@H]1CC[C@@H](C(=O)N(C)CCCn2cc[nH+]c2)C1 ZINC000345287076 386090687 /nfs/dbraw/zinc/09/06/87/386090687.db2.gz OFUOUGJRJBHROD-QWHCGFSZSA-N 1 2 249.358 2.168 20 0 BEADLO Cc1cnc(C[N@@H+]2C[C@@H]3C[C@H]2CS3)s1 ZINC000335153202 386147649 /nfs/dbraw/zinc/14/76/49/386147649.db2.gz FNWYAFOUHAFWQH-IUCAKERBSA-N 1 2 226.370 2.141 20 0 BEADLO Cc1cnc(C[N@H+]2C[C@@H]3C[C@H]2CS3)s1 ZINC000335153202 386147653 /nfs/dbraw/zinc/14/76/53/386147653.db2.gz FNWYAFOUHAFWQH-IUCAKERBSA-N 1 2 226.370 2.141 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H]1C[C@@]1(C)C(C)C ZINC000274884185 386159643 /nfs/dbraw/zinc/15/96/43/386159643.db2.gz HKYJCCUKAALPLR-MFKMUULPSA-N 1 2 235.331 2.017 20 0 BEADLO c1cc(NCC2=CCCOC2)nc(C2CC2)[nH+]1 ZINC000288130771 386170747 /nfs/dbraw/zinc/17/07/47/386170747.db2.gz ATHSLKKOYAHLQD-UHFFFAOYSA-N 1 2 231.299 2.113 20 0 BEADLO CC/C=C(\C)C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000263831874 386180212 /nfs/dbraw/zinc/18/02/12/386180212.db2.gz UGRZVQQHPOSYKK-UUILKARUSA-N 1 2 247.342 2.403 20 0 BEADLO CC(=O)c1ccc(C[N@H+]2C[C@@H](C)OC[C@H]2C)cc1 ZINC000296568281 386184574 /nfs/dbraw/zinc/18/45/74/386184574.db2.gz QFEJSVVNNGSUNB-VXGBXAGGSA-N 1 2 247.338 2.498 20 0 BEADLO CC(=O)c1ccc(C[N@@H+]2C[C@@H](C)OC[C@H]2C)cc1 ZINC000296568281 386184579 /nfs/dbraw/zinc/18/45/79/386184579.db2.gz QFEJSVVNNGSUNB-VXGBXAGGSA-N 1 2 247.338 2.498 20 0 BEADLO CC(=O)c1ccc(C[N@H+]2C[C@H](C)OC[C@@H]2C)cc1 ZINC000296568278 386185797 /nfs/dbraw/zinc/18/57/97/386185797.db2.gz QFEJSVVNNGSUNB-RYUDHWBXSA-N 1 2 247.338 2.498 20 0 BEADLO CC(=O)c1ccc(C[N@@H+]2C[C@H](C)OC[C@@H]2C)cc1 ZINC000296568278 386185814 /nfs/dbraw/zinc/18/58/14/386185814.db2.gz QFEJSVVNNGSUNB-RYUDHWBXSA-N 1 2 247.338 2.498 20 0 BEADLO Cc1cc(NC(=O)[C@]2(C)CC2(F)F)c(C)c[nH+]1 ZINC000643311705 386188611 /nfs/dbraw/zinc/18/86/11/386188611.db2.gz YNYNTPCULSKQTC-NSHDSACASA-N 1 2 240.253 2.104 20 0 BEADLO CC[C@H]([NH2+][C@@H](C)C(F)(F)F)[C@@H]1CCOC1 ZINC000336773648 386127512 /nfs/dbraw/zinc/12/75/12/386127512.db2.gz YXRRZJRIKGWTKO-YIZRAAEISA-N 1 2 225.254 2.342 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1cnn(C)c1C(F)(F)F ZINC000334464848 386134752 /nfs/dbraw/zinc/13/47/52/386134752.db2.gz TVUDQUDXTMTUQS-JGVFFNPUSA-N 1 2 247.264 2.279 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1cnn(C)c1C(F)(F)F ZINC000334464848 386134757 /nfs/dbraw/zinc/13/47/57/386134757.db2.gz TVUDQUDXTMTUQS-JGVFFNPUSA-N 1 2 247.264 2.279 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnn(C)c2C(F)(F)F)[C@@H]1C ZINC000334464847 386135703 /nfs/dbraw/zinc/13/57/03/386135703.db2.gz TVUDQUDXTMTUQS-HTQZYQBOSA-N 1 2 247.264 2.279 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnn(C)c2C(F)(F)F)[C@@H]1C ZINC000334464847 386135704 /nfs/dbraw/zinc/13/57/04/386135704.db2.gz TVUDQUDXTMTUQS-HTQZYQBOSA-N 1 2 247.264 2.279 20 0 BEADLO CC(=CC(C)(C)C)C(=O)NCc1[nH]c[nH+]c1C ZINC000274703640 386139357 /nfs/dbraw/zinc/13/93/57/386139357.db2.gz RAOIZUFAAOIOGE-RMKNXTFCSA-N 1 2 235.331 2.327 20 0 BEADLO CCC[C@H]1CCCN(C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000288553829 386214511 /nfs/dbraw/zinc/21/45/11/386214511.db2.gz WLYGGOORBAAGSV-LBPRGKRZSA-N 1 2 249.358 2.381 20 0 BEADLO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1cc[nH]n1 ZINC000288649050 386225040 /nfs/dbraw/zinc/22/50/40/386225040.db2.gz UYYOFSIJSZCDQH-RNCFNFMXSA-N 1 2 229.283 2.022 20 0 BEADLO CC(C)C[C@@H](C)OC(=O)NCc1c[nH+]cn1C ZINC000297203897 386233599 /nfs/dbraw/zinc/23/35/99/386233599.db2.gz UZDGQSOJFAUCHU-SNVBAGLBSA-N 1 2 239.319 2.081 20 0 BEADLO CC1(C)CCCN(C(=O)CCc2[nH]cc[nH+]2)CC1 ZINC000288833299 386234281 /nfs/dbraw/zinc/23/42/81/386234281.db2.gz OYCVWGMOZLVHLF-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO CO[C@H]1CN(c2[nH]c3ccccc3[nH+]2)CC[C@H]1C ZINC000275821667 386244471 /nfs/dbraw/zinc/24/44/71/386244471.db2.gz FQHSEYQLLYGBHF-MFKMUULPSA-N 1 2 245.326 2.424 20 0 BEADLO CCC1(CC)C[NH+](Cc2[nH]ncc2C)C1 ZINC000297417363 386254208 /nfs/dbraw/zinc/25/42/08/386254208.db2.gz LZVDONRTGJXXJR-UHFFFAOYSA-N 1 2 207.321 2.340 20 0 BEADLO CCC1(CC)C[NH+](Cc2nccn2C)C1 ZINC000297442330 386256368 /nfs/dbraw/zinc/25/63/68/386256368.db2.gz OHJYGWQPNJMFMY-UHFFFAOYSA-N 1 2 207.321 2.042 20 0 BEADLO CCc1cc(NC[C@@H](C)CC(F)F)nc[nH+]1 ZINC000645305490 386196846 /nfs/dbraw/zinc/19/68/46/386196846.db2.gz VVVHKUBWLKTAPB-QMMMGPOBSA-N 1 2 229.274 2.164 20 0 BEADLO C[C@H]1[C@@H](C)N(C(=O)C(C)(C)c2c[nH+]c[nH]2)C[C@H]1C ZINC000416325335 386259209 /nfs/dbraw/zinc/25/92/09/386259209.db2.gz SNAXPRCHLSLOJR-GMTAPVOTSA-N 1 2 249.358 2.190 20 0 BEADLO CC[C@H]1CCCN(C(=O)CCc2c[nH+]cn2C)C1 ZINC000339164544 386282145 /nfs/dbraw/zinc/28/21/45/386282145.db2.gz OLPXVQWTNQHCOE-LBPRGKRZSA-N 1 2 249.358 2.001 20 0 BEADLO F[C@H]1CCC[N@H+](Cc2cnc(C3CC3)o2)C1 ZINC000628326465 386288221 /nfs/dbraw/zinc/28/82/21/386288221.db2.gz HZQNAGGQSKMGRE-JTQLQIEISA-N 1 2 224.279 2.486 20 0 BEADLO F[C@H]1CCC[N@@H+](Cc2cnc(C3CC3)o2)C1 ZINC000628326465 386288224 /nfs/dbraw/zinc/28/82/24/386288224.db2.gz HZQNAGGQSKMGRE-JTQLQIEISA-N 1 2 224.279 2.486 20 0 BEADLO C[C@H](CNC(=O)C1=CCCCC1)Cn1cc[nH+]c1 ZINC000276256049 386293332 /nfs/dbraw/zinc/29/33/32/386293332.db2.gz PJCITPJVTQERIH-GFCCVEGCSA-N 1 2 247.342 2.136 20 0 BEADLO Cc1ccc(C[N@@H+]2CCn3cccc3[C@H]2C)nn1 ZINC000335264184 386294538 /nfs/dbraw/zinc/29/45/38/386294538.db2.gz XPUCFJSFCCABII-GFCCVEGCSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1ccc(C[N@H+]2CCn3cccc3[C@H]2C)nn1 ZINC000335264184 386294539 /nfs/dbraw/zinc/29/45/39/386294539.db2.gz XPUCFJSFCCABII-GFCCVEGCSA-N 1 2 242.326 2.163 20 0 BEADLO C[C@@H]([NH2+][C@@H]1/C=C/CCCCC1)c1ncn(C)n1 ZINC000334480534 386295709 /nfs/dbraw/zinc/29/57/09/386295709.db2.gz VDKZOMHBZJFHBX-RQDOONKYSA-N 1 2 234.347 2.355 20 0 BEADLO Nc1[nH+]cnc(NCC2(C(F)F)CC2)c1Cl ZINC000309655527 386298532 /nfs/dbraw/zinc/29/85/32/386298532.db2.gz YYZKUJQDVBYDHU-UHFFFAOYSA-N 1 2 248.664 2.169 20 0 BEADLO Nc1nc[nH+]c(NCC2(C(F)F)CC2)c1Cl ZINC000309655527 386298536 /nfs/dbraw/zinc/29/85/36/386298536.db2.gz YYZKUJQDVBYDHU-UHFFFAOYSA-N 1 2 248.664 2.169 20 0 BEADLO CC(C(=O)Nc1ccc(N)[nH+]c1)=C1CCCC1 ZINC000236694857 386302748 /nfs/dbraw/zinc/30/27/48/386302748.db2.gz PLSVZKCZXFJHJW-UHFFFAOYSA-N 1 2 231.299 2.493 20 0 BEADLO Cc1nonc1C[N@@H+](C)Cc1ccc(C)cc1 ZINC000265108099 386308200 /nfs/dbraw/zinc/30/82/00/386308200.db2.gz GTTJHRUYSVBHOE-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1nonc1C[N@H+](C)Cc1ccc(C)cc1 ZINC000265108099 386308206 /nfs/dbraw/zinc/30/82/06/386308206.db2.gz GTTJHRUYSVBHOE-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO C[C@H](C(=O)NCCCn1cc[nH+]c1)C(C)(C)C ZINC000265192333 386315264 /nfs/dbraw/zinc/31/52/64/386315264.db2.gz AZWFVQIXUMPIPY-LLVKDONJSA-N 1 2 237.347 2.072 20 0 BEADLO CC(C)[C@@H]1CCCCN1C(=O)CCn1cc[nH+]c1 ZINC000265274305 386323740 /nfs/dbraw/zinc/32/37/40/386323740.db2.gz HTZTUFPBQUAFBU-ZDUSSCGKSA-N 1 2 249.358 2.310 20 0 BEADLO CCC[C@@]1(CO)CCN(c2cccc[nH+]2)C1 ZINC000289125099 386266223 /nfs/dbraw/zinc/26/62/23/386266223.db2.gz RBANZVUDYKLZFW-CYBMUJFWSA-N 1 2 220.316 2.071 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@@H](C)c2ccccc2)c[nH+]1 ZINC000264742718 386268097 /nfs/dbraw/zinc/26/80/97/386268097.db2.gz RNVOVKOZAQTQGH-SNVBAGLBSA-N 1 2 243.310 2.252 20 0 BEADLO Cc1[nH]c(C(=O)NCCCC2CCCC2)c[nH+]1 ZINC000264799597 386270549 /nfs/dbraw/zinc/27/05/49/386270549.db2.gz YRIDOTNRZIJAEO-UHFFFAOYSA-N 1 2 235.331 2.418 20 0 BEADLO CCC[C@@](C)(O)CNc1cc[nH+]c(C2CC2)n1 ZINC000264790508 386270895 /nfs/dbraw/zinc/27/08/95/386270895.db2.gz KOMABEWYJTVEKU-CYBMUJFWSA-N 1 2 235.331 2.317 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CCC[C@@H]1CF ZINC000297687043 386271826 /nfs/dbraw/zinc/27/18/26/386271826.db2.gz HFDSRCNYAKYJMB-SNVBAGLBSA-N 1 2 237.278 2.356 20 0 BEADLO CC[C@@H]([NH2+][C@H](C)c1cn(C)nc1C)C(F)F ZINC000453245720 386272067 /nfs/dbraw/zinc/27/20/67/386272067.db2.gz LVENWIGGYWNNMM-GMSGAONNSA-N 1 2 231.290 2.423 20 0 BEADLO Cc1cc(CN(C)c2cccc[nH+]2)no1 ZINC000264819827 386273571 /nfs/dbraw/zinc/27/35/71/386273571.db2.gz FXSRRQWMWCIYCM-UHFFFAOYSA-N 1 2 203.245 2.014 20 0 BEADLO CCC[C@@H](C(=O)OCC)[N@@H+]1CC[C@@](C)(F)C1 ZINC000347345736 386340380 /nfs/dbraw/zinc/34/03/80/386340380.db2.gz FEIGSWMNQXEMPC-CMPLNLGQSA-N 1 2 231.311 2.152 20 0 BEADLO CCC[C@@H](C(=O)OCC)[N@H+]1CC[C@@](C)(F)C1 ZINC000347345736 386340385 /nfs/dbraw/zinc/34/03/85/386340385.db2.gz FEIGSWMNQXEMPC-CMPLNLGQSA-N 1 2 231.311 2.152 20 0 BEADLO CCC[C@H](C)[N@H+](C)Cc1nsc(N(C)C)n1 ZINC000336685791 386344365 /nfs/dbraw/zinc/34/43/65/386344365.db2.gz VRRXBINPBNRIRD-VIFPVBQESA-N 1 2 242.392 2.225 20 0 BEADLO CCC[C@H](C)[N@@H+](C)Cc1nsc(N(C)C)n1 ZINC000336685791 386344370 /nfs/dbraw/zinc/34/43/70/386344370.db2.gz VRRXBINPBNRIRD-VIFPVBQESA-N 1 2 242.392 2.225 20 0 BEADLO FC(F)C[C@H]1COCC[N@@H+]1Cc1ccco1 ZINC000289691709 386344719 /nfs/dbraw/zinc/34/47/19/386344719.db2.gz OGXPKCOWOGEISW-VIFPVBQESA-N 1 2 231.242 2.136 20 0 BEADLO FC(F)C[C@H]1COCC[N@H+]1Cc1ccco1 ZINC000289691709 386344725 /nfs/dbraw/zinc/34/47/25/386344725.db2.gz OGXPKCOWOGEISW-VIFPVBQESA-N 1 2 231.242 2.136 20 0 BEADLO Cc1[nH+]cccc1Cc1nc([C@@H]2C[C@@H]2C)no1 ZINC000334491673 386347064 /nfs/dbraw/zinc/34/70/64/386347064.db2.gz JIYBESACRWDCRA-GZMMTYOYSA-N 1 2 229.283 2.487 20 0 BEADLO CC(C)[C@H](NC(=O)c1ccco1)c1[nH]cc[nH+]1 ZINC000276594850 386350086 /nfs/dbraw/zinc/35/00/86/386350086.db2.gz KWYGPTCHSKKUIY-JTQLQIEISA-N 1 2 233.271 2.130 20 0 BEADLO CC[C@H](COC)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000265603918 386352508 /nfs/dbraw/zinc/35/25/08/386352508.db2.gz SOMGFPLSRKFTJK-LLVKDONJSA-N 1 2 235.331 2.499 20 0 BEADLO CC(C)n1cc[nH+]c1CN(C)Cc1ccon1 ZINC000336689679 386355616 /nfs/dbraw/zinc/35/56/16/386355616.db2.gz HUGFPMUZVVWONK-UHFFFAOYSA-N 1 2 234.303 2.084 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CCC[C@@H]2CCC[C@@H]21 ZINC000276639142 386357238 /nfs/dbraw/zinc/35/72/38/386357238.db2.gz UPHKWSRSTCMZCO-XTYWZOAOSA-N 1 2 245.326 2.214 20 0 BEADLO Cc1ccc(C[NH2+][C@]2(C)CCOC2=O)c(C)c1 ZINC000289838124 386361380 /nfs/dbraw/zinc/36/13/80/386361380.db2.gz OSBYQXCTYIVQTA-CQSZACIVSA-N 1 2 233.311 2.099 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)CC1(C)CCCC1 ZINC000289910101 386370618 /nfs/dbraw/zinc/37/06/18/386370618.db2.gz LGMFHYRRUNIFFN-UHFFFAOYSA-N 1 2 235.331 2.007 20 0 BEADLO CCCCN(CC)C(=O)C[N@@H+]1CC[C@](C)(F)C1 ZINC000347385883 386375476 /nfs/dbraw/zinc/37/54/76/386375476.db2.gz PSPMWGUCJSTXAG-ZDUSSCGKSA-N 1 2 244.354 2.069 20 0 BEADLO CCCCN(CC)C(=O)C[N@H+]1CC[C@](C)(F)C1 ZINC000347385883 386375482 /nfs/dbraw/zinc/37/54/82/386375482.db2.gz PSPMWGUCJSTXAG-ZDUSSCGKSA-N 1 2 244.354 2.069 20 0 BEADLO Cc1occc1-c1noc(CCn2cc[nH+]c2)n1 ZINC000289975254 386378373 /nfs/dbraw/zinc/37/83/73/386378373.db2.gz ZJUAXDLHMCUERF-UHFFFAOYSA-N 1 2 244.254 2.077 20 0 BEADLO CO[C@@H](C)CCNc1cc(C)[nH+]c(C2CC2)n1 ZINC000265387395 386334020 /nfs/dbraw/zinc/33/40/20/386334020.db2.gz SOVWKWMOVOFMFR-JTQLQIEISA-N 1 2 235.331 2.499 20 0 BEADLO CC[C@](C)([NH2+]Cc1ccccc1C)C(=O)OC ZINC000265434633 386336482 /nfs/dbraw/zinc/33/64/82/386336482.db2.gz NZKUPPZKAUBSQP-AWEZNQCLSA-N 1 2 235.327 2.426 20 0 BEADLO CCC[C@H](C)CC(=O)Nc1ccc(N)[nH+]c1 ZINC000237006302 386336640 /nfs/dbraw/zinc/33/66/40/386336640.db2.gz LNKIIHCHXYRBED-VIFPVBQESA-N 1 2 221.304 2.429 20 0 BEADLO Cc1c[nH]nc1CNc1ccc([NH+](C)C)cc1 ZINC000289660810 386338945 /nfs/dbraw/zinc/33/89/45/386338945.db2.gz YVYNUQBEWRFEJC-UHFFFAOYSA-N 1 2 230.315 2.396 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@H](C)c1cc[nH]c(=O)c1 ZINC000645485602 386437307 /nfs/dbraw/zinc/43/73/07/386437307.db2.gz JHPYSICEEGGEBC-BDAKNGLRSA-N 1 2 246.314 2.231 20 0 BEADLO C[C@@H]1SCC[C@@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000645402416 386437476 /nfs/dbraw/zinc/43/74/76/386437476.db2.gz RYYLEXIQFPSSEX-WPRPVWTQSA-N 1 2 235.356 2.082 20 0 BEADLO CC[C@@H](C)C[C@H](C)NC(=O)c1c[nH+]c(C)[nH]1 ZINC000266470824 386441198 /nfs/dbraw/zinc/44/11/98/386441198.db2.gz JDQDBKRNTMZNQZ-BDAKNGLRSA-N 1 2 223.320 2.273 20 0 BEADLO CC(C)Cc1noc(C[N@@H+]2CCC23CCC3)n1 ZINC000336717560 386441396 /nfs/dbraw/zinc/44/13/96/386441396.db2.gz WLRTUXSZTHQZFZ-UHFFFAOYSA-N 1 2 235.331 2.397 20 0 BEADLO CC(C)Cc1noc(C[N@H+]2CCC23CCC3)n1 ZINC000336717560 386441401 /nfs/dbraw/zinc/44/14/01/386441401.db2.gz WLRTUXSZTHQZFZ-UHFFFAOYSA-N 1 2 235.331 2.397 20 0 BEADLO COc1cc([C@H](C)[NH2+]Cc2cc(C)on2)ccn1 ZINC000347552915 386449836 /nfs/dbraw/zinc/44/98/36/386449836.db2.gz GWYBABGJUDDURD-JTQLQIEISA-N 1 2 247.298 2.237 20 0 BEADLO CO[C@@H]1CC[N@H+](Cc2ncc(C(C)(C)C)o2)C1 ZINC000336704709 386393183 /nfs/dbraw/zinc/39/31/83/386393183.db2.gz NMQDCWXMESLERI-SNVBAGLBSA-N 1 2 238.331 2.193 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2ncc(C(C)(C)C)o2)C1 ZINC000336704709 386393188 /nfs/dbraw/zinc/39/31/88/386393188.db2.gz NMQDCWXMESLERI-SNVBAGLBSA-N 1 2 238.331 2.193 20 0 BEADLO CCOc1nnc(C[N@@H+]2C[C@@H](C)C[C@H]2C)s1 ZINC000336705385 386395798 /nfs/dbraw/zinc/39/57/98/386395798.db2.gz QEAQPWXNFDLPII-DTWKUNHWSA-N 1 2 241.360 2.167 20 0 BEADLO CCOc1nnc(C[N@H+]2C[C@@H](C)C[C@H]2C)s1 ZINC000336705385 386395802 /nfs/dbraw/zinc/39/58/02/386395802.db2.gz QEAQPWXNFDLPII-DTWKUNHWSA-N 1 2 241.360 2.167 20 0 BEADLO CCOc1nnc(C[N@@H+]2C[C@H](C)C[C@H]2C)s1 ZINC000336705387 386396146 /nfs/dbraw/zinc/39/61/46/386396146.db2.gz QEAQPWXNFDLPII-RKDXNWHRSA-N 1 2 241.360 2.167 20 0 BEADLO CCOc1nnc(C[N@H+]2C[C@H](C)C[C@H]2C)s1 ZINC000336705387 386396151 /nfs/dbraw/zinc/39/61/51/386396151.db2.gz QEAQPWXNFDLPII-RKDXNWHRSA-N 1 2 241.360 2.167 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)CC(C)(F)F ZINC000276973633 386396452 /nfs/dbraw/zinc/39/64/52/386396452.db2.gz GAFAPOKSGZTKNW-UHFFFAOYSA-N 1 2 243.257 2.131 20 0 BEADLO Cc1cc(N2CC[C@@H](C(C)(C)C)[C@@H](O)C2)nc[nH+]1 ZINC000347424498 386397508 /nfs/dbraw/zinc/39/75/08/386397508.db2.gz TUHOPKVMJXYMNT-NEPJUHHUSA-N 1 2 249.358 2.018 20 0 BEADLO Cc1noc(CCC[N@H+](CC(F)F)C(C)C)n1 ZINC000336706538 386399076 /nfs/dbraw/zinc/39/90/76/386399076.db2.gz GCOYJSDJJUXSSJ-UHFFFAOYSA-N 1 2 247.289 2.286 20 0 BEADLO Cc1noc(CCC[N@@H+](CC(F)F)C(C)C)n1 ZINC000336706538 386399081 /nfs/dbraw/zinc/39/90/81/386399081.db2.gz GCOYJSDJJUXSSJ-UHFFFAOYSA-N 1 2 247.289 2.286 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@H](C)c2cccnc2)nn1C ZINC000336700737 386400864 /nfs/dbraw/zinc/40/08/64/386400864.db2.gz HARXWRGTCJVDDP-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cc(C[N@H+](C)[C@H](C)c2cccnc2)nn1C ZINC000336700737 386400870 /nfs/dbraw/zinc/40/08/70/386400870.db2.gz HARXWRGTCJVDDP-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO CSC[C@H](C)C(=O)Nc1cccc2[nH+]ccn21 ZINC000266143314 386403890 /nfs/dbraw/zinc/40/38/90/386403890.db2.gz UNPIJTPOVSGVRJ-VIFPVBQESA-N 1 2 249.339 2.272 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccs2)nn1C ZINC000336701936 386404838 /nfs/dbraw/zinc/40/48/38/386404838.db2.gz MJYUFRZFZFEFLO-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccs2)nn1C ZINC000336701936 386404842 /nfs/dbraw/zinc/40/48/42/386404842.db2.gz MJYUFRZFZFEFLO-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1ccn2cc(CNC(=O)CC3CC3)[nH+]c2c1 ZINC000299063832 386407068 /nfs/dbraw/zinc/40/70/68/386407068.db2.gz YUZMQMKYISWTCL-UHFFFAOYSA-N 1 2 243.310 2.059 20 0 BEADLO Cc1occc1C[NH2+][C@@H](C)c1ccon1 ZINC000414428264 386414119 /nfs/dbraw/zinc/41/41/19/386414119.db2.gz GNTMWHFTGJWSNB-QMMMGPOBSA-N 1 2 206.245 2.427 20 0 BEADLO C[C@H](C1CC1)[N@H+](C)Cc1noc(C2CC2)n1 ZINC000097078970 386420752 /nfs/dbraw/zinc/42/07/52/386420752.db2.gz GALWVMCOHIXQDG-MRVPVSSYSA-N 1 2 221.304 2.177 20 0 BEADLO C[C@H](C1CC1)[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000097078970 386420755 /nfs/dbraw/zinc/42/07/55/386420755.db2.gz GALWVMCOHIXQDG-MRVPVSSYSA-N 1 2 221.304 2.177 20 0 BEADLO O=C(/C=C/C1CC1)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000266328403 386426094 /nfs/dbraw/zinc/42/60/94/386426094.db2.gz YEPBRXSYFOLLRM-FYJFLYSWSA-N 1 2 245.326 2.082 20 0 BEADLO Cc1ccc([C@H](O)CNc2cc[nH+]c(C)n2)cc1 ZINC000266411077 386434657 /nfs/dbraw/zinc/43/46/57/386434657.db2.gz QQQWVUKTWOEZGP-CYBMUJFWSA-N 1 2 243.310 2.239 20 0 BEADLO CC[C@@H](CSC)[N@H+](C)Cc1cn[nH]c1C ZINC000290450271 386435394 /nfs/dbraw/zinc/43/53/94/386435394.db2.gz MHYHFMPOVWEGSC-NSHDSACASA-N 1 2 227.377 2.292 20 0 BEADLO CC[C@@H](CSC)[N@@H+](C)Cc1cn[nH]c1C ZINC000290450271 386435397 /nfs/dbraw/zinc/43/53/97/386435397.db2.gz MHYHFMPOVWEGSC-NSHDSACASA-N 1 2 227.377 2.292 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2C[C@@H](C)[C@@H]2C)s1 ZINC000339579276 386471890 /nfs/dbraw/zinc/47/18/90/386471890.db2.gz BLGZSECZOYHFCW-CSMHCCOUSA-N 1 2 211.334 2.248 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2C[C@@H](C)[C@@H]2C)s1 ZINC000339579276 386471894 /nfs/dbraw/zinc/47/18/94/386471894.db2.gz BLGZSECZOYHFCW-CSMHCCOUSA-N 1 2 211.334 2.248 20 0 BEADLO CC(C)Cc1noc(C[N@@H+]2C[C@@H](C)[C@@H]2C)n1 ZINC000339575505 386472735 /nfs/dbraw/zinc/47/27/35/386472735.db2.gz SJQWYFLOTQQTSK-ZJUUUORDSA-N 1 2 223.320 2.108 20 0 BEADLO CC(C)Cc1noc(C[N@H+]2C[C@@H](C)[C@@H]2C)n1 ZINC000339575505 386472748 /nfs/dbraw/zinc/47/27/48/386472748.db2.gz SJQWYFLOTQQTSK-ZJUUUORDSA-N 1 2 223.320 2.108 20 0 BEADLO COCc1nc(C[N@@H+]2C[C@@H](C)[C@@H]2C)cs1 ZINC000339574019 386473299 /nfs/dbraw/zinc/47/32/99/386473299.db2.gz OWDHOJXPDSVHOZ-BDAKNGLRSA-N 1 2 226.345 2.130 20 0 BEADLO COCc1nc(C[N@H+]2C[C@@H](C)[C@@H]2C)cs1 ZINC000339574019 386473304 /nfs/dbraw/zinc/47/33/04/386473304.db2.gz OWDHOJXPDSVHOZ-BDAKNGLRSA-N 1 2 226.345 2.130 20 0 BEADLO CCN(CC(C)(C)C)C(=O)CCn1cc[nH+]c1 ZINC000291260188 386528690 /nfs/dbraw/zinc/52/86/90/386528690.db2.gz SFDPSKVBRSMUET-UHFFFAOYSA-N 1 2 237.347 2.168 20 0 BEADLO C[C@H](CC[NH2+][C@@]1(C)CCOC1=O)c1ccccc1 ZINC000290779281 386475200 /nfs/dbraw/zinc/47/52/00/386475200.db2.gz CTTMCVBGAQZEPM-DOMZBBRYSA-N 1 2 247.338 2.475 20 0 BEADLO C[C@@H]1CCN(c2cc(N3CCCC3)[nH+]cn2)[C@H]1C ZINC000277908358 386476888 /nfs/dbraw/zinc/47/68/88/386476888.db2.gz UVWSRDJMNMOXNY-NEPJUHHUSA-N 1 2 246.358 2.312 20 0 BEADLO C[C@@H]1CCN(c2cc(N3CCCC3)nc[nH+]2)[C@H]1C ZINC000277908358 386476892 /nfs/dbraw/zinc/47/68/92/386476892.db2.gz UVWSRDJMNMOXNY-NEPJUHHUSA-N 1 2 246.358 2.312 20 0 BEADLO Cc1cnn([C@@H]2CCN(c3cccc[nH+]3)C2)c1 ZINC000290891331 386485525 /nfs/dbraw/zinc/48/55/25/386485525.db2.gz UCAATBDQNPPIDY-GFCCVEGCSA-N 1 2 228.299 2.038 20 0 BEADLO CCOC[C@H]1CCN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000267045231 386489098 /nfs/dbraw/zinc/48/90/98/386489098.db2.gz DEORCORYHIDGKD-NSHDSACASA-N 1 2 247.342 2.217 20 0 BEADLO CCOCc1nc([C@H](C)[NH2+]C2CC(C)C2)no1 ZINC000353610885 386493847 /nfs/dbraw/zinc/49/38/47/386493847.db2.gz OIRGNSZACCDADL-KYHHOPLUSA-N 1 2 239.319 2.055 20 0 BEADLO CCC1(C)CN(C(=O)c2ccc3[nH+]ccn3c2)C1 ZINC000291000656 386495877 /nfs/dbraw/zinc/49/58/77/386495877.db2.gz BNIKNIRFJGFCMC-UHFFFAOYSA-N 1 2 243.310 2.206 20 0 BEADLO C[C@H](C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1)C1CC1 ZINC000267128016 386498412 /nfs/dbraw/zinc/49/84/12/386498412.db2.gz LDYMQNACSAABJU-CMPLNLGQSA-N 1 2 247.342 2.162 20 0 BEADLO CCC(CC)c1noc(Cn2cc[nH+]c2)n1 ZINC000278199031 386501480 /nfs/dbraw/zinc/50/14/80/386501480.db2.gz VMLNRBXXEUYYIM-UHFFFAOYSA-N 1 2 220.276 2.218 20 0 BEADLO Cc1cnc(C[NH+]2CC(C)(C)OC(C)(C)C2)nc1 ZINC000336783343 386508121 /nfs/dbraw/zinc/50/81/21/386508121.db2.gz GFCCEBDOHSFVTC-UHFFFAOYSA-N 1 2 249.358 2.174 20 0 BEADLO COC(=O)[C@H]([NH2+]Cc1ccc(C)cc1)C1CC1 ZINC000227767171 386511400 /nfs/dbraw/zinc/51/14/00/386511400.db2.gz UMWWVOKVJFTLEP-CYBMUJFWSA-N 1 2 233.311 2.036 20 0 BEADLO COc1ncccc1C[N@@H+]1CCC[C@@H]1CF ZINC000339665009 386511921 /nfs/dbraw/zinc/51/19/21/386511921.db2.gz QGWRPMXDPCKIBP-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO COc1ncccc1C[N@H+]1CCC[C@@H]1CF ZINC000339665009 386511928 /nfs/dbraw/zinc/51/19/28/386511928.db2.gz QGWRPMXDPCKIBP-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO COC(=O)[C@@H]([NH2+]Cc1ccccc1C)C1CC1 ZINC000227767732 386512361 /nfs/dbraw/zinc/51/23/61/386512361.db2.gz JWVIITRTKOTRTJ-ZDUSSCGKSA-N 1 2 233.311 2.036 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@H](CC3CC3)C2)no1 ZINC000339678911 386517145 /nfs/dbraw/zinc/51/71/45/386517145.db2.gz OPIHGLFUACKQIM-NSHDSACASA-N 1 2 221.304 2.000 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@H](CC3CC3)C2)no1 ZINC000339678911 386517152 /nfs/dbraw/zinc/51/71/52/386517152.db2.gz OPIHGLFUACKQIM-NSHDSACASA-N 1 2 221.304 2.000 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1cc(F)ccc1C ZINC000278382095 386517409 /nfs/dbraw/zinc/51/74/09/386517409.db2.gz PDBKOTHUOOIKMM-SNVBAGLBSA-N 1 2 239.290 2.127 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1cc(F)ccc1C ZINC000278382095 386517414 /nfs/dbraw/zinc/51/74/14/386517414.db2.gz PDBKOTHUOOIKMM-SNVBAGLBSA-N 1 2 239.290 2.127 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1cc(F)ccc1C ZINC000278382089 386518422 /nfs/dbraw/zinc/51/84/22/386518422.db2.gz PDBKOTHUOOIKMM-JTQLQIEISA-N 1 2 239.290 2.127 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1cc(F)ccc1C ZINC000278382089 386518425 /nfs/dbraw/zinc/51/84/25/386518425.db2.gz PDBKOTHUOOIKMM-JTQLQIEISA-N 1 2 239.290 2.127 20 0 BEADLO Cc1nocc1C[N@H+]1C[C@H](C)OC2(CCC2)C1 ZINC000335450444 386521338 /nfs/dbraw/zinc/52/13/38/386521338.db2.gz YOPDJMNWVSGHNT-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO Cc1nocc1C[N@@H+]1C[C@H](C)OC2(CCC2)C1 ZINC000335450444 386521341 /nfs/dbraw/zinc/52/13/41/386521341.db2.gz YOPDJMNWVSGHNT-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO CC(C)(C)c1nc(NCC(C)(C)CO)cc[nH+]1 ZINC000135590288 386522909 /nfs/dbraw/zinc/52/29/09/386522909.db2.gz MFYKRQYUKMMLAW-UHFFFAOYSA-N 1 2 237.347 2.205 20 0 BEADLO c1ccc(NCCCOC[C@@H]2CCCO2)[nH+]c1 ZINC000266592022 386454296 /nfs/dbraw/zinc/45/42/96/386454296.db2.gz RCIQQIUPCYNOKF-LBPRGKRZSA-N 1 2 236.315 2.079 20 0 BEADLO CC(C)CN(C)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000290630540 386462484 /nfs/dbraw/zinc/46/24/84/386462484.db2.gz IYIRATWWABVWDQ-UHFFFAOYSA-N 1 2 246.314 2.454 20 0 BEADLO CO[C@@H](CNc1cc[nH+]c(C2CC2)n1)C(C)C ZINC000266725907 386465289 /nfs/dbraw/zinc/46/52/89/386465289.db2.gz MYKVNRNCGVKSRW-NSHDSACASA-N 1 2 235.331 2.437 20 0 BEADLO CO[C@@H](C)[C@@H](C)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000290654079 386465672 /nfs/dbraw/zinc/46/56/72/386465672.db2.gz IZSHKTNIOPKVEO-ZJUUUORDSA-N 1 2 235.331 2.498 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC1CCCCCC1 ZINC000278729196 386574217 /nfs/dbraw/zinc/57/42/17/386574217.db2.gz UBRMQQQSMCUCCV-UHFFFAOYSA-N 1 2 235.331 2.100 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)NC1CCCCCC1 ZINC000278729196 386574228 /nfs/dbraw/zinc/57/42/28/386574228.db2.gz UBRMQQQSMCUCCV-UHFFFAOYSA-N 1 2 235.331 2.100 20 0 BEADLO CCCc1occc1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000337003258 386577184 /nfs/dbraw/zinc/57/71/84/386577184.db2.gz WTBMQNLVUGZPKD-UHFFFAOYSA-N 1 2 247.298 2.227 20 0 BEADLO Cc1occc1C[NH2+]Cc1nnc(C(C)(C)C)[nH]1 ZINC000414458433 386584050 /nfs/dbraw/zinc/58/40/50/386584050.db2.gz HNRGAXDOEDDYFE-UHFFFAOYSA-N 1 2 248.330 2.293 20 0 BEADLO Cc1cc(NC(=O)C2CC3(CCC3)C2)cc[nH+]1 ZINC000335418286 386588003 /nfs/dbraw/zinc/58/80/03/386588003.db2.gz QIEYTMIJMCGMCI-UHFFFAOYSA-N 1 2 230.311 2.331 20 0 BEADLO CCn1cc[nH+]c1CN1C[C@H](C)OC2(CCC2)C1 ZINC000335461366 386543984 /nfs/dbraw/zinc/54/39/84/386543984.db2.gz HVMBQNBJHKHASW-LBPRGKRZSA-N 1 2 249.358 2.046 20 0 BEADLO CCn1ccnc1C[N@@H+]1C[C@H](C)OC2(CCC2)C1 ZINC000335461366 386543988 /nfs/dbraw/zinc/54/39/88/386543988.db2.gz HVMBQNBJHKHASW-LBPRGKRZSA-N 1 2 249.358 2.046 20 0 BEADLO CCn1ccnc1C[N@H+]1C[C@H](C)OC2(CCC2)C1 ZINC000335461366 386543991 /nfs/dbraw/zinc/54/39/91/386543991.db2.gz HVMBQNBJHKHASW-LBPRGKRZSA-N 1 2 249.358 2.046 20 0 BEADLO CCc1ccc(C[N@@H+]2CCn3cncc3C2)cc1 ZINC000291446474 386544519 /nfs/dbraw/zinc/54/45/19/386544519.db2.gz CENQHRPNEQRZIT-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO CCc1ccc(C[N@H+]2CCn3cncc3C2)cc1 ZINC000291446474 386544526 /nfs/dbraw/zinc/54/45/26/386544526.db2.gz CENQHRPNEQRZIT-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO CCc1ccc(CN2CCn3c[nH+]cc3C2)cc1 ZINC000291446474 386544532 /nfs/dbraw/zinc/54/45/32/386544532.db2.gz CENQHRPNEQRZIT-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO Fc1cc(F)cc(CN2CCn3c[nH+]cc3C2)c1 ZINC000291433935 386545611 /nfs/dbraw/zinc/54/56/11/386545611.db2.gz BLYAWEKIPMQCPS-UHFFFAOYSA-N 1 2 249.264 2.177 20 0 BEADLO CS[C@@H]1CCN(c2[nH+]c(C)nc3[nH]ccc32)C1 ZINC000335423786 386599033 /nfs/dbraw/zinc/59/90/33/386599033.db2.gz WXCOABINEUVMTN-SECBINFHSA-N 1 2 248.355 2.208 20 0 BEADLO FC(F)(F)C[C@@H]1CC[N@H+](Cc2ccon2)C1 ZINC000278620321 386555828 /nfs/dbraw/zinc/55/58/28/386555828.db2.gz FWIUWMFOIHUNRY-QMMMGPOBSA-N 1 2 234.221 2.449 20 0 BEADLO FC(F)(F)C[C@@H]1CC[N@@H+](Cc2ccon2)C1 ZINC000278620321 386555832 /nfs/dbraw/zinc/55/58/32/386555832.db2.gz FWIUWMFOIHUNRY-QMMMGPOBSA-N 1 2 234.221 2.449 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000291538177 386556593 /nfs/dbraw/zinc/55/65/93/386556593.db2.gz KZXBQIJMBBIXFL-SECBINFHSA-N 1 2 247.264 2.492 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000291538177 386556597 /nfs/dbraw/zinc/55/65/97/386556597.db2.gz KZXBQIJMBBIXFL-SECBINFHSA-N 1 2 247.264 2.492 20 0 BEADLO Cc1cc(CN(C)Cc2c[nH+]cn2C(C)C)no1 ZINC000425319196 386557778 /nfs/dbraw/zinc/55/77/78/386557778.db2.gz AEHKFBZRTQSSAU-UHFFFAOYSA-N 1 2 248.330 2.392 20 0 BEADLO CC(C)c1nnc(Cn2cc[nH+]c2C(C)C)[nH]1 ZINC000291594019 386558420 /nfs/dbraw/zinc/55/84/20/386558420.db2.gz HVBWJYVBIFCWAF-UHFFFAOYSA-N 1 2 233.319 2.296 20 0 BEADLO C/C=C(\C)C(=O)Nc1ccc[nH+]c1N(C)C ZINC000267607701 386558949 /nfs/dbraw/zinc/55/89/49/386558949.db2.gz RFYPNNUFLPSGLG-WEVVVXLNSA-N 1 2 219.288 2.052 20 0 BEADLO CC[C@H]1CC[C@@H](C(=O)Nc2cc[nH+]cc2C)O1 ZINC000268095633 386620213 /nfs/dbraw/zinc/62/02/13/386620213.db2.gz HDZTVQWTKPFTGU-JQWIXIFHSA-N 1 2 234.299 2.286 20 0 BEADLO CC[C@H]1CC[C@@H](C(=O)Nc2cc[nH+]c(C)c2)O1 ZINC000268137833 386621388 /nfs/dbraw/zinc/62/13/88/386621388.db2.gz NDVBCQRVGWGPFB-RYUDHWBXSA-N 1 2 234.299 2.286 20 0 BEADLO Cc1ccoc1C[N@@H+](C)Cc1cc(C)ncn1 ZINC000292111563 386621522 /nfs/dbraw/zinc/62/15/22/386621522.db2.gz GZJAODHCTWDGLW-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ccoc1C[N@H+](C)Cc1cc(C)ncn1 ZINC000292111563 386621531 /nfs/dbraw/zinc/62/15/31/386621531.db2.gz GZJAODHCTWDGLW-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cnc(N[C@@H](C)Cn2cc[nH+]c2)s1 ZINC000336758986 386655796 /nfs/dbraw/zinc/65/57/96/386655796.db2.gz LCKRACVZWZPQRQ-QMMMGPOBSA-N 1 2 222.317 2.149 20 0 BEADLO CCc1cc(N)nc(SC2CCC2)[nH+]1 ZINC000292332515 386629864 /nfs/dbraw/zinc/62/98/64/386629864.db2.gz CQENLWGFMLWPJB-UHFFFAOYSA-N 1 2 209.318 2.266 20 0 BEADLO Cc1ccc(C[S@](=O)Cc2c[nH+]cn2C)cc1 ZINC000268196984 386630130 /nfs/dbraw/zinc/63/01/30/386630130.db2.gz XYKVZLAPGAOESV-KRWDZBQOSA-N 1 2 248.351 2.177 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2ccc(C)cc2)[nH]1 ZINC000268264976 386635671 /nfs/dbraw/zinc/63/56/71/386635671.db2.gz FTJXRABJPCEDTO-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2ccc(C)cc2)[nH]1 ZINC000268264976 386635677 /nfs/dbraw/zinc/63/56/77/386635677.db2.gz FTJXRABJPCEDTO-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO CC(C)c1nc(NCCCCF)cc[nH+]1 ZINC000336758522 386637430 /nfs/dbraw/zinc/63/74/30/386637430.db2.gz KTQQIBCETROUJS-UHFFFAOYSA-N 1 2 211.284 2.184 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C[C@@H]1CC[C@@H](C)C1 ZINC000268301471 386638159 /nfs/dbraw/zinc/63/81/59/386638159.db2.gz YFCXYLDKHORQSN-MWLCHTKSSA-N 1 2 235.331 2.161 20 0 BEADLO CCCc1csc(C[N@H+](CCO)C2CC2)n1 ZINC000426056766 386640789 /nfs/dbraw/zinc/64/07/89/386640789.db2.gz CCNAHOIOFXIMCU-UHFFFAOYSA-N 1 2 240.372 2.052 20 0 BEADLO CCCc1csc(C[N@@H+](CCO)C2CC2)n1 ZINC000426056766 386640793 /nfs/dbraw/zinc/64/07/93/386640793.db2.gz CCNAHOIOFXIMCU-UHFFFAOYSA-N 1 2 240.372 2.052 20 0 BEADLO CN(Cc1ccccc1)C(=O)CCc1[nH]cc[nH+]1 ZINC000279146975 386640899 /nfs/dbraw/zinc/64/08/99/386640899.db2.gz GXQJYQWKKDCCJM-UHFFFAOYSA-N 1 2 243.310 2.001 20 0 BEADLO CCc1cc(N[C@H](CO)C[C@H](C)CC)nc[nH+]1 ZINC000645355002 386642798 /nfs/dbraw/zinc/64/27/98/386642798.db2.gz FOOYZLPSTZDCHJ-PWSUYJOCSA-N 1 2 237.347 2.248 20 0 BEADLO Cc1nnc(C[N@@H+](C)[C@H](C)c2cccs2)[nH]1 ZINC000292280922 386642744 /nfs/dbraw/zinc/64/27/44/386642744.db2.gz XVJRFOIZFNMOLR-MRVPVSSYSA-N 1 2 236.344 2.368 20 0 BEADLO Cc1nnc(C[N@H+](C)[C@H](C)c2cccs2)[nH]1 ZINC000292280922 386642750 /nfs/dbraw/zinc/64/27/50/386642750.db2.gz XVJRFOIZFNMOLR-MRVPVSSYSA-N 1 2 236.344 2.368 20 0 BEADLO C[N@H+](CCF)Cc1ccc(F)c(F)c1 ZINC000268339316 386645091 /nfs/dbraw/zinc/64/50/91/386645091.db2.gz ZRRXQFTXMYSJHT-UHFFFAOYSA-N 1 2 203.207 2.366 20 0 BEADLO C[N@@H+](CCF)Cc1ccc(F)c(F)c1 ZINC000268339316 386645095 /nfs/dbraw/zinc/64/50/95/386645095.db2.gz ZRRXQFTXMYSJHT-UHFFFAOYSA-N 1 2 203.207 2.366 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N([C@@H](C)C1CC1)C1CC1 ZINC000279195488 386645909 /nfs/dbraw/zinc/64/59/09/386645909.db2.gz KDAUJXWOOWUIKD-JTQLQIEISA-N 1 2 247.342 2.050 20 0 BEADLO Cc1nc(C(=O)Nc2c(C)cc[nH+]c2C)co1 ZINC000644972034 386646826 /nfs/dbraw/zinc/64/68/26/386646826.db2.gz MSBFPTZIXBSNCC-UHFFFAOYSA-N 1 2 231.255 2.247 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@H]1CCC[C@H](C)[C@H]1C ZINC000279195590 386647342 /nfs/dbraw/zinc/64/73/42/386647342.db2.gz KEXPZUPKNHHOPX-HOSYDEDBSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@@H]1CCC[C@H](C)[C@H]1C ZINC000279195590 386647348 /nfs/dbraw/zinc/64/73/48/386647348.db2.gz KEXPZUPKNHHOPX-HOSYDEDBSA-N 1 2 249.358 2.202 20 0 BEADLO CCCC(C)(C)NC(=O)CCc1[nH]cc[nH+]1 ZINC000279218919 386648658 /nfs/dbraw/zinc/64/86/58/386648658.db2.gz NFWLKUTYLSRKLJ-UHFFFAOYSA-N 1 2 223.320 2.037 20 0 BEADLO C/C=C(\C)C(=O)N1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000268376195 386649004 /nfs/dbraw/zinc/64/90/04/386649004.db2.gz LRCMNKKPDCZBQR-VVBALGDRSA-N 1 2 247.342 2.259 20 0 BEADLO CCn1cncc1C[N@H+](C)Cc1ccc(C)o1 ZINC000417751626 386654507 /nfs/dbraw/zinc/65/45/07/386654507.db2.gz ZDZONHJOCBMZLR-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CCn1cncc1C[N@@H+](C)Cc1ccc(C)o1 ZINC000417751626 386654513 /nfs/dbraw/zinc/65/45/13/386654513.db2.gz ZDZONHJOCBMZLR-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO O=C(C=C1CCC1)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000267952219 386600175 /nfs/dbraw/zinc/60/01/75/386600175.db2.gz HNKYNNWDFNZWND-UHFFFAOYSA-N 1 2 245.326 2.226 20 0 BEADLO CC[C@@H](CCO)CNc1cc[nH+]c2ccncc12 ZINC000268063856 386617077 /nfs/dbraw/zinc/61/70/77/386617077.db2.gz ZNRUUVXIFZJMCX-NSHDSACASA-N 1 2 245.326 2.450 20 0 BEADLO CCOc1cccc(C[N@@H+]2CCO[C@H]3C[C@H]32)c1 ZINC000366512239 386670471 /nfs/dbraw/zinc/67/04/71/386670471.db2.gz ACONOQJMKINREA-KGLIPLIRSA-N 1 2 233.311 2.058 20 0 BEADLO CCOc1cccc(C[N@H+]2CCO[C@H]3C[C@H]32)c1 ZINC000366512239 386670478 /nfs/dbraw/zinc/67/04/78/386670478.db2.gz ACONOQJMKINREA-KGLIPLIRSA-N 1 2 233.311 2.058 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1CCSC1 ZINC000335527830 386673542 /nfs/dbraw/zinc/67/35/42/386673542.db2.gz KUYUJSSENOWKOS-JTQLQIEISA-N 1 2 236.340 2.390 20 0 BEADLO C[C@H](Nc1cccc[nH+]1)[C@@H](O)Cc1ccccc1 ZINC000120645480 386675798 /nfs/dbraw/zinc/67/57/98/386675798.db2.gz GPPLTSRQQCLKMN-JSGCOSHPSA-N 1 2 242.322 2.486 20 0 BEADLO CC[C@@H](F)C[NH2+][C@H](C)c1ncc(C)o1 ZINC000336648117 386678792 /nfs/dbraw/zinc/67/87/92/386678792.db2.gz GGTJCSJHNLIUOW-RKDXNWHRSA-N 1 2 200.257 2.382 20 0 BEADLO CN(C)c1cccc(CNc2cccc[nH+]2)n1 ZINC000301812875 386679278 /nfs/dbraw/zinc/67/92/78/386679278.db2.gz CBNSFCCNHUDPEI-UHFFFAOYSA-N 1 2 228.299 2.155 20 0 BEADLO CO[C@@H](CNc1cc(C)[nH+]c(C2CC2)n1)C1CC1 ZINC000292686105 386710846 /nfs/dbraw/zinc/71/08/46/386710846.db2.gz FBUASJXAPQLZQZ-LBPRGKRZSA-N 1 2 247.342 2.499 20 0 BEADLO Cc1nnc(C[N@@H+]2CCc3ccccc3[C@@H]2C)[nH]1 ZINC000292511566 386683287 /nfs/dbraw/zinc/68/32/87/386683287.db2.gz NJOKIJBRKBHTHB-JTQLQIEISA-N 1 2 242.326 2.232 20 0 BEADLO Cc1nnc(C[N@H+]2CCc3ccccc3[C@@H]2C)[nH]1 ZINC000292511566 386683293 /nfs/dbraw/zinc/68/32/93/386683293.db2.gz NJOKIJBRKBHTHB-JTQLQIEISA-N 1 2 242.326 2.232 20 0 BEADLO CC[C@H]1CCC[C@@H](CNCC(F)(F)C[NH3+])C1 ZINC000414927440 386683384 /nfs/dbraw/zinc/68/33/84/386683384.db2.gz LCMCJNCCFKZXFX-WDEREUQCSA-N 1 2 234.334 2.386 20 0 BEADLO Cn1cc(CNc2cccc[nH+]2)c(C(F)F)n1 ZINC000292558365 386690722 /nfs/dbraw/zinc/69/07/22/386690722.db2.gz NOTXKGVDNUJXAA-UHFFFAOYSA-N 1 2 238.241 2.365 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2c(C)noc2C)nn1C ZINC000330381470 386694958 /nfs/dbraw/zinc/69/49/58/386694958.db2.gz NLCYIEULYGONIP-SNVBAGLBSA-N 1 2 248.330 2.184 20 0 BEADLO CC[C@@H]1C[C@H](C)CN1C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000520606848 386705498 /nfs/dbraw/zinc/70/54/98/386705498.db2.gz WDSNXNSKTIXXMF-GMXVVIOVSA-N 1 2 249.358 2.235 20 0 BEADLO CC[C@@H]1C[C@H](C)CN1C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000520606848 386705501 /nfs/dbraw/zinc/70/55/01/386705501.db2.gz WDSNXNSKTIXXMF-GMXVVIOVSA-N 1 2 249.358 2.235 20 0 BEADLO Cn1cc(Cl)c(C[N@H+](C)C2CCCC2)n1 ZINC000335544277 386730755 /nfs/dbraw/zinc/73/07/55/386730755.db2.gz MYJVNFGGAPPHLN-UHFFFAOYSA-N 1 2 227.739 2.448 20 0 BEADLO Cn1cc(Cl)c(C[N@@H+](C)C2CCCC2)n1 ZINC000335544277 386730762 /nfs/dbraw/zinc/73/07/62/386730762.db2.gz MYJVNFGGAPPHLN-UHFFFAOYSA-N 1 2 227.739 2.448 20 0 BEADLO CCn1cncc1C[N@H+](C)[C@@H](C)c1ccccn1 ZINC000417975360 386736774 /nfs/dbraw/zinc/73/67/74/386736774.db2.gz DUKGEOBLSCIYMB-LBPRGKRZSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1cncc1C[N@@H+](C)[C@@H](C)c1ccccn1 ZINC000417975360 386736779 /nfs/dbraw/zinc/73/67/79/386736779.db2.gz DUKGEOBLSCIYMB-LBPRGKRZSA-N 1 2 244.342 2.491 20 0 BEADLO O[C@@H]1CC[C@@H]2CN(c3cccc[nH+]3)CC[C@H]2C1 ZINC000450804680 386713392 /nfs/dbraw/zinc/71/33/92/386713392.db2.gz NHVDUNZPVYOUEO-YNEHKIRRSA-N 1 2 232.327 2.069 20 0 BEADLO FC1(C[NH2+]Cc2nc(-c3ccccc3)no2)CC1 ZINC000526985576 386718646 /nfs/dbraw/zinc/71/86/46/386718646.db2.gz VQWCMMBPRDHPKU-UHFFFAOYSA-N 1 2 247.273 2.328 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)C[C@@H]1C[C@@H]1c1ccccc1 ZINC000353744310 386719029 /nfs/dbraw/zinc/71/90/29/386719029.db2.gz ZVLKHNKEOCHDED-QWHCGFSZSA-N 1 2 242.326 2.040 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)C[C@@H]1C[C@@H]1c1ccccc1 ZINC000353744310 386719036 /nfs/dbraw/zinc/71/90/36/386719036.db2.gz ZVLKHNKEOCHDED-QWHCGFSZSA-N 1 2 242.326 2.040 20 0 BEADLO C[C@@]12CC[N@H+](Cc3cocn3)C[C@@H]1C2(F)F ZINC000292757760 386720660 /nfs/dbraw/zinc/72/06/60/386720660.db2.gz JEUPKVCWQPQIQS-VHSXEESVSA-N 1 2 228.242 2.152 20 0 BEADLO C[C@@]12CC[N@@H+](Cc3cocn3)C[C@@H]1C2(F)F ZINC000292757760 386720665 /nfs/dbraw/zinc/72/06/65/386720665.db2.gz JEUPKVCWQPQIQS-VHSXEESVSA-N 1 2 228.242 2.152 20 0 BEADLO C[C@@H]1SCC[N@H+](Cc2cocn2)[C@H]1C ZINC000191944165 386720716 /nfs/dbraw/zinc/72/07/16/386720716.db2.gz UHOPXDJURMDRCM-IUCAKERBSA-N 1 2 212.318 2.000 20 0 BEADLO C[C@@H]1SCC[N@@H+](Cc2cocn2)[C@H]1C ZINC000191944165 386720724 /nfs/dbraw/zinc/72/07/24/386720724.db2.gz UHOPXDJURMDRCM-IUCAKERBSA-N 1 2 212.318 2.000 20 0 BEADLO C[C@]12CC[N@H+](Cc3cocn3)C[C@H]1C2(F)F ZINC000292757764 386721250 /nfs/dbraw/zinc/72/12/50/386721250.db2.gz JEUPKVCWQPQIQS-ZJUUUORDSA-N 1 2 228.242 2.152 20 0 BEADLO C[C@]12CC[N@@H+](Cc3cocn3)C[C@H]1C2(F)F ZINC000292757764 386721258 /nfs/dbraw/zinc/72/12/58/386721258.db2.gz JEUPKVCWQPQIQS-ZJUUUORDSA-N 1 2 228.242 2.152 20 0 BEADLO CS[C@@H]1CC[N@H+](Cc2nn(C)cc2Cl)C1 ZINC000335541790 386722789 /nfs/dbraw/zinc/72/27/89/386722789.db2.gz YYQLUWWCQSORSR-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO CS[C@@H]1CC[N@@H+](Cc2nn(C)cc2Cl)C1 ZINC000335541790 386722794 /nfs/dbraw/zinc/72/27/94/386722794.db2.gz YYQLUWWCQSORSR-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1cocn1 ZINC000191975832 386727538 /nfs/dbraw/zinc/72/75/38/386727538.db2.gz UEQHXZKGEFGMPX-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1cocn1 ZINC000191975832 386727545 /nfs/dbraw/zinc/72/75/45/386727545.db2.gz UEQHXZKGEFGMPX-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H]1CCC[N@H+](Cc2nn(C)cc2Cl)C1 ZINC000335545049 386729622 /nfs/dbraw/zinc/72/96/22/386729622.db2.gz RFSRCFQSZUVZGT-VIFPVBQESA-N 1 2 227.739 2.305 20 0 BEADLO C[C@H]1CCC[N@@H+](Cc2nn(C)cc2Cl)C1 ZINC000335545049 386729625 /nfs/dbraw/zinc/72/96/25/386729625.db2.gz RFSRCFQSZUVZGT-VIFPVBQESA-N 1 2 227.739 2.305 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1C(=O)CCn1cc[nH+]c1 ZINC000357175321 386730325 /nfs/dbraw/zinc/73/03/25/386730325.db2.gz LTXNTKVOSLGASE-NEPJUHHUSA-N 1 2 235.331 2.063 20 0 BEADLO CCOC(=O)C[C@H](C)CNc1cccc[nH+]1 ZINC000192161842 386745932 /nfs/dbraw/zinc/74/59/32/386745932.db2.gz MLTCDMVZXKZRJG-JTQLQIEISA-N 1 2 222.288 2.083 20 0 BEADLO COC(=O)c1ccc(C[N@@H+]2CCC[C@H]2CF)o1 ZINC000293039508 386769353 /nfs/dbraw/zinc/76/93/53/386769353.db2.gz LYUXITMCOHOYLI-VIFPVBQESA-N 1 2 241.262 2.000 20 0 BEADLO COC(=O)c1ccc(C[N@H+]2CCC[C@H]2CF)o1 ZINC000293039508 386769358 /nfs/dbraw/zinc/76/93/58/386769358.db2.gz LYUXITMCOHOYLI-VIFPVBQESA-N 1 2 241.262 2.000 20 0 BEADLO CC[C@]1(C)CCN(C(=O)Nc2cc[nH+]c(C)c2)C1 ZINC000334150907 386748303 /nfs/dbraw/zinc/74/83/03/386748303.db2.gz OJHTWKLKAFGMRG-CQSZACIVSA-N 1 2 247.342 2.466 20 0 BEADLO COC[C@@H]([NH2+]Cc1cocn1)c1ccccc1 ZINC000192313113 386751929 /nfs/dbraw/zinc/75/19/29/386751929.db2.gz HUDZFJQOYBRZFX-CYBMUJFWSA-N 1 2 232.283 2.152 20 0 BEADLO Cn1c2ccccc2[nH+]c1N1CCSCC1 ZINC000269113172 386753765 /nfs/dbraw/zinc/75/37/65/386753765.db2.gz COUSPAXKCXUMBW-UHFFFAOYSA-N 1 2 233.340 2.127 20 0 BEADLO CN(CC1CC1)c1[nH+]c2ccccc2n1C ZINC000269175368 386757067 /nfs/dbraw/zinc/75/70/67/386757067.db2.gz SOFIDEHJBFCJQZ-UHFFFAOYSA-N 1 2 215.300 2.420 20 0 BEADLO C[C@@H]([NH2+]Cc1ncc(C2CC2)o1)c1cnn(C)c1 ZINC000329656529 386760476 /nfs/dbraw/zinc/76/04/76/386760476.db2.gz GIAVVGFXHFNADE-SECBINFHSA-N 1 2 246.314 2.136 20 0 BEADLO Cc1cn2cc(NC(=O)C(C)(F)F)ccc2[nH+]1 ZINC000293009236 386765494 /nfs/dbraw/zinc/76/54/94/386765494.db2.gz JREIOTRDUCNABK-UHFFFAOYSA-N 1 2 239.225 2.236 20 0 BEADLO c1nc(CNc2ccc(N3CCCC3)[nH+]c2)co1 ZINC000192334380 386765716 /nfs/dbraw/zinc/76/57/16/386765716.db2.gz LENJYDUHDMAFOX-UHFFFAOYSA-N 1 2 244.298 2.282 20 0 BEADLO COC(=O)c1ccc(C[N@@H+]2CCC[C@@H]2CF)o1 ZINC000293039506 386766884 /nfs/dbraw/zinc/76/68/84/386766884.db2.gz LYUXITMCOHOYLI-SECBINFHSA-N 1 2 241.262 2.000 20 0 BEADLO COC(=O)c1ccc(C[N@H+]2CCC[C@@H]2CF)o1 ZINC000293039506 386766892 /nfs/dbraw/zinc/76/68/92/386766892.db2.gz LYUXITMCOHOYLI-SECBINFHSA-N 1 2 241.262 2.000 20 0 BEADLO COC[C@@H]([NH2+]C1(C(F)F)CC1)C(C)C ZINC000336668279 386789488 /nfs/dbraw/zinc/78/94/88/386789488.db2.gz WTIAZDDMHZFNCS-MRVPVSSYSA-N 1 2 207.264 2.045 20 0 BEADLO CC[C@H](NC(=O)[C@H](C)C1CC1)c1[nH]cc[nH+]1 ZINC000125329836 386795556 /nfs/dbraw/zinc/79/55/56/386795556.db2.gz UJJVGHUCUCBPNO-SCZZXKLOSA-N 1 2 221.304 2.023 20 0 BEADLO CC(C)(C)C(C)(C)C(=O)NCc1[nH]cc[nH+]1 ZINC000336668414 386795705 /nfs/dbraw/zinc/79/57/05/386795705.db2.gz GCPLMZRAVQQQFX-UHFFFAOYSA-N 1 2 223.320 2.098 20 0 BEADLO CC[C@@H](NC(=O)CCn1cc[nH+]c1)C(C)(C)C ZINC000357375580 386770951 /nfs/dbraw/zinc/77/09/51/386770951.db2.gz VBKVLSZAYAKDIA-LLVKDONJSA-N 1 2 237.347 2.214 20 0 BEADLO Cc1cnc(C[N@@H+]2CCCO[C@@H](CF)C2)s1 ZINC000334637888 386775586 /nfs/dbraw/zinc/77/55/86/386775586.db2.gz SOAGHJQHKAHIHV-JTQLQIEISA-N 1 2 244.335 2.012 20 0 BEADLO Cc1cnc(C[N@H+]2CCCO[C@@H](CF)C2)s1 ZINC000334637888 386775590 /nfs/dbraw/zinc/77/55/90/386775590.db2.gz SOAGHJQHKAHIHV-JTQLQIEISA-N 1 2 244.335 2.012 20 0 BEADLO Cc1cc(C(=O)Nc2cc(C)[nH+]cc2C)co1 ZINC000527078363 386779303 /nfs/dbraw/zinc/77/93/03/386779303.db2.gz WOQBWTYUYLBIKD-UHFFFAOYSA-N 1 2 230.267 2.274 20 0 BEADLO Cc1occc1C(=O)Nc1cccc2[nH+]ccn21 ZINC000357433669 386782574 /nfs/dbraw/zinc/78/25/74/386782574.db2.gz BEQHNZUHFFSUAF-UHFFFAOYSA-N 1 2 241.250 2.488 20 0 BEADLO C[C@H]([NH2+]CC(F)(F)CN)[C@@H](C)c1ccccc1 ZINC000414933422 386783448 /nfs/dbraw/zinc/78/34/48/386783448.db2.gz UDSUBCUZMOAQTQ-MNOVXSKESA-N 1 2 242.313 2.362 20 0 BEADLO COC[C@H]([NH2+]C1(C(F)F)CC1)C(C)C ZINC000336668282 386788463 /nfs/dbraw/zinc/78/84/63/386788463.db2.gz WTIAZDDMHZFNCS-QMMMGPOBSA-N 1 2 207.264 2.045 20 0 BEADLO Cc1nocc1CNc1c[nH+]cc(C)c1 ZINC000293291964 386803780 /nfs/dbraw/zinc/80/37/80/386803780.db2.gz OXCZDGSPZAHMTG-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO CCC[C@H](C)C[NH2+][C@@H](CC(F)F)C(=O)OC ZINC000336670216 386804365 /nfs/dbraw/zinc/80/43/65/386804365.db2.gz ABNUUWBJQXHXAU-IUCAKERBSA-N 1 2 237.290 2.209 20 0 BEADLO COC(C[N@H+](C)Cc1c(F)cccc1F)OC ZINC000293384555 386808973 /nfs/dbraw/zinc/80/89/73/386808973.db2.gz KCKITFZELBRXBF-UHFFFAOYSA-N 1 2 245.269 2.016 20 0 BEADLO COC(C[N@@H+](C)Cc1c(F)cccc1F)OC ZINC000293384555 386808981 /nfs/dbraw/zinc/80/89/81/386808981.db2.gz KCKITFZELBRXBF-UHFFFAOYSA-N 1 2 245.269 2.016 20 0 BEADLO Cc1cnc(C[NH2+][C@H]2CCCc3occc32)n1C ZINC000341087348 386833563 /nfs/dbraw/zinc/83/35/63/386833563.db2.gz FIRAXVHQWJLOEH-LBPRGKRZSA-N 1 2 245.326 2.489 20 0 BEADLO Cc1c[nH+]c(CN[C@H]2CCCc3occc32)n1C ZINC000341087348 386833567 /nfs/dbraw/zinc/83/35/67/386833567.db2.gz FIRAXVHQWJLOEH-LBPRGKRZSA-N 1 2 245.326 2.489 20 0 BEADLO C[C@@H]1CC(C(=O)N(C)Cc2[nH]cc[nH+]2)C[C@@H](C)C1 ZINC000334816027 386835704 /nfs/dbraw/zinc/83/57/04/386835704.db2.gz DFZJUPQAHJEFCZ-QWRGUYRKSA-N 1 2 249.358 2.440 20 0 BEADLO CC[C@@H](C)OCC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000280695337 386837381 /nfs/dbraw/zinc/83/73/81/386837381.db2.gz FAUNGXHQSGUFOQ-SNVBAGLBSA-N 1 2 247.298 2.088 20 0 BEADLO CC(C)c1ccoc1C(=O)NCc1c[nH+]c[nH]1 ZINC000339955551 386841355 /nfs/dbraw/zinc/84/13/55/386841355.db2.gz OQGMWUOMRMYDHR-UHFFFAOYSA-N 1 2 233.271 2.056 20 0 BEADLO CC(C)c1ccoc1C(=O)NCc1c[nH]c[nH+]1 ZINC000339955551 386841358 /nfs/dbraw/zinc/84/13/58/386841358.db2.gz OQGMWUOMRMYDHR-UHFFFAOYSA-N 1 2 233.271 2.056 20 0 BEADLO CC(C)n1cncc1C[N@H+](C)Cc1ccc[nH]1 ZINC000425340998 386842596 /nfs/dbraw/zinc/84/25/96/386842596.db2.gz WRLPXRYHQNMAEK-UHFFFAOYSA-N 1 2 232.331 2.424 20 0 BEADLO CC(C)n1cncc1C[N@@H+](C)Cc1ccc[nH]1 ZINC000425340998 386842604 /nfs/dbraw/zinc/84/26/04/386842604.db2.gz WRLPXRYHQNMAEK-UHFFFAOYSA-N 1 2 232.331 2.424 20 0 BEADLO CC(C)n1c[nH+]cc1CN(C)Cc1ccc[nH]1 ZINC000425340998 386842612 /nfs/dbraw/zinc/84/26/12/386842612.db2.gz WRLPXRYHQNMAEK-UHFFFAOYSA-N 1 2 232.331 2.424 20 0 BEADLO Cc1cccn2cc(CC(=O)OC(C)C)[nH+]c12 ZINC000518884832 386849889 /nfs/dbraw/zinc/84/98/89/386849889.db2.gz SNBCSZCNKPABHB-UHFFFAOYSA-N 1 2 232.283 2.137 20 0 BEADLO Fc1ccc([C@H]([NH2+]CC2CC2)c2nnc[nH]2)cc1 ZINC000293646407 386854654 /nfs/dbraw/zinc/85/46/54/386854654.db2.gz IJNDAFJKPIWPQG-LBPRGKRZSA-N 1 2 246.289 2.033 20 0 BEADLO Cc1ccc2[nH+]cc(CN(C)CCF)n2c1 ZINC000293672082 386859187 /nfs/dbraw/zinc/85/91/87/386859187.db2.gz OYVTXGJWPCMRRR-UHFFFAOYSA-N 1 2 221.279 2.044 20 0 BEADLO Cc1ccc2ncc(C[N@H+](C)CCF)n2c1 ZINC000293672082 386859193 /nfs/dbraw/zinc/85/91/93/386859193.db2.gz OYVTXGJWPCMRRR-UHFFFAOYSA-N 1 2 221.279 2.044 20 0 BEADLO Cc1ccc2ncc(C[N@@H+](C)CCF)n2c1 ZINC000293672082 386859198 /nfs/dbraw/zinc/85/91/98/386859198.db2.gz OYVTXGJWPCMRRR-UHFFFAOYSA-N 1 2 221.279 2.044 20 0 BEADLO CCc1ccc(C[NH+]2CC(O)(C(F)F)C2)cc1 ZINC000425348359 386862797 /nfs/dbraw/zinc/86/27/97/386862797.db2.gz OBWIBMFWFDHJPC-UHFFFAOYSA-N 1 2 241.281 2.061 20 0 BEADLO Cc1[nH]ccc1C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000334829540 386866466 /nfs/dbraw/zinc/86/64/66/386866466.db2.gz ZOXHUOHHCOLERX-LLVKDONJSA-N 1 2 244.298 2.024 20 0 BEADLO CC[C@]1(C)C[C@H]1c1nc(Cc2c[nH+]cn2C)no1 ZINC000357930294 386866933 /nfs/dbraw/zinc/86/69/33/386866933.db2.gz FOQMCQDCGDSXPA-GXFFZTMASA-N 1 2 246.314 2.298 20 0 BEADLO Cc1nc(N(C)Cc2cccnc2)c(C)c(C)[nH+]1 ZINC000301689722 386867363 /nfs/dbraw/zinc/86/73/63/386867363.db2.gz NDEHNHMEKFTWNP-UHFFFAOYSA-N 1 2 242.326 2.433 20 0 BEADLO Cc1nc(N(C)CCOCC2CC2)c(C)c(C)[nH+]1 ZINC000301691223 386868733 /nfs/dbraw/zinc/86/87/33/386868733.db2.gz XPDPZMDMWVUAFZ-UHFFFAOYSA-N 1 2 249.358 2.265 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H]1C[C@@]1(C)CC ZINC000341264402 386869214 /nfs/dbraw/zinc/86/92/14/386869214.db2.gz ARIJOHAAWLMPIS-BXUZGUMPSA-N 1 2 232.327 2.441 20 0 BEADLO CC/C=C(/C)c1nc(Cc2c[nH+]cn2C)no1 ZINC000357954681 386871899 /nfs/dbraw/zinc/87/18/99/386871899.db2.gz WDDBAKADCTZFDY-UITAMQMPSA-N 1 2 232.287 2.207 20 0 BEADLO CC(C)C1(CNC(=O)C(C)(C)c2c[nH]c[nH+]2)CC1 ZINC000331630039 386877232 /nfs/dbraw/zinc/87/72/32/386877232.db2.gz HUYXOTDQSHCCDB-UHFFFAOYSA-N 1 2 249.358 2.240 20 0 BEADLO Cc1nc(N2CCC[C@@H]2C[C@H](C)O)c(C)c(C)[nH+]1 ZINC000301771024 386877246 /nfs/dbraw/zinc/87/72/46/386877246.db2.gz KSYHWUFBWQWWBJ-TVQRCGJNSA-N 1 2 249.358 2.142 20 0 BEADLO COC(=O)C[N@H+](C)Cc1ccccc1SC ZINC000358030226 386881823 /nfs/dbraw/zinc/88/18/23/386881823.db2.gz GGAKHEINFIAFGX-UHFFFAOYSA-N 1 2 239.340 2.013 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1ccccc1SC ZINC000358030226 386881825 /nfs/dbraw/zinc/88/18/25/386881825.db2.gz GGAKHEINFIAFGX-UHFFFAOYSA-N 1 2 239.340 2.013 20 0 BEADLO C[C@H]1c2ccccc2C[N@H+]1C[C@H](O)C(F)(F)F ZINC000334839405 386882445 /nfs/dbraw/zinc/88/24/45/386882445.db2.gz YRKOTNBWQVEKDM-KWQFWETISA-N 1 2 245.244 2.486 20 0 BEADLO C[C@H]1c2ccccc2C[N@@H+]1C[C@H](O)C(F)(F)F ZINC000334839405 386882449 /nfs/dbraw/zinc/88/24/49/386882449.db2.gz YRKOTNBWQVEKDM-KWQFWETISA-N 1 2 245.244 2.486 20 0 BEADLO C1=CCC(Nc2cc(NCC3CC3)[nH+]cn2)C1 ZINC000301827482 386882871 /nfs/dbraw/zinc/88/28/71/386882871.db2.gz NPPVJLWENZLBSH-UHFFFAOYSA-N 1 2 230.315 2.429 20 0 BEADLO C1=CCC(Nc2cc(NCC3CC3)nc[nH+]2)C1 ZINC000301827482 386882877 /nfs/dbraw/zinc/88/28/77/386882877.db2.gz NPPVJLWENZLBSH-UHFFFAOYSA-N 1 2 230.315 2.429 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CC[C@@H](C(F)(F)F)[C@H]1C ZINC000334845824 386894934 /nfs/dbraw/zinc/89/49/34/386894934.db2.gz UELOLKWQBFXFLH-RKDXNWHRSA-N 1 2 247.264 2.491 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CC[C@@H](C(F)(F)F)[C@H]1C ZINC000334845824 386894936 /nfs/dbraw/zinc/89/49/36/386894936.db2.gz UELOLKWQBFXFLH-RKDXNWHRSA-N 1 2 247.264 2.491 20 0 BEADLO CSC[C@@H](C)Nc1nc(N)c2ccccc2[nH+]1 ZINC000301853720 386885264 /nfs/dbraw/zinc/88/52/64/386885264.db2.gz AIWFNNSEAKNWCU-MRVPVSSYSA-N 1 2 248.355 2.375 20 0 BEADLO CC(C)(C)c1nc(N[C@@]2(C)CCOC2)cc[nH+]1 ZINC000301865539 386887184 /nfs/dbraw/zinc/88/71/84/386887184.db2.gz VAODZIHQNQARJY-ZDUSSCGKSA-N 1 2 235.331 2.365 20 0 BEADLO CC1(C)CCN(c2nc(N)c3ccccc3[nH+]2)C1 ZINC000301894427 386888771 /nfs/dbraw/zinc/88/87/71/386888771.db2.gz MZWZFABSYXDRCZ-UHFFFAOYSA-N 1 2 242.326 2.448 20 0 BEADLO Cc1cn[nH]c1C[NH2+][C@@H](C)c1ccncc1F ZINC000352887007 386889491 /nfs/dbraw/zinc/88/94/91/386889491.db2.gz FRVWJQFGMSMRGW-VIFPVBQESA-N 1 2 234.278 2.103 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@@H](C)c1ccncc1F ZINC000352887007 386889494 /nfs/dbraw/zinc/88/94/94/386889494.db2.gz FRVWJQFGMSMRGW-VIFPVBQESA-N 1 2 234.278 2.103 20 0 BEADLO Cc1c[nH+]c(CNc2ccc3c(c2)COC3)n1C ZINC000341367073 386895457 /nfs/dbraw/zinc/89/54/57/386895457.db2.gz XDKUQOAPQVRFOK-UHFFFAOYSA-N 1 2 243.310 2.371 20 0 BEADLO Cc1nc(N2CCCO[C@@H](C(C)C)C2)cc[nH+]1 ZINC000293912906 386900257 /nfs/dbraw/zinc/90/02/57/386900257.db2.gz DFEXWZGETDVHEA-GFCCVEGCSA-N 1 2 235.331 2.036 20 0 BEADLO CC[C@H](CC(=O)Nc1cc[nH+]cc1O)C(C)C ZINC000330782483 386901814 /nfs/dbraw/zinc/90/18/14/386901814.db2.gz HDEIOHPISMTNLG-SNVBAGLBSA-N 1 2 236.315 2.220 20 0 BEADLO CC[C@H](CC(=O)N1CCn2cc[nH+]c2C1)C(C)C ZINC000358167268 386905053 /nfs/dbraw/zinc/90/50/53/386905053.db2.gz DKMQKZWMDWHIPF-GFCCVEGCSA-N 1 2 249.358 2.298 20 0 BEADLO CCCCC[N@@H+]1CCCC[C@@H]1c1n[nH]c(=O)[nH]1 ZINC000330865746 386905856 /nfs/dbraw/zinc/90/58/56/386905856.db2.gz XLQHNDFZVLUSQB-SNVBAGLBSA-N 1 2 238.335 2.228 20 0 BEADLO CCCCC[N@H+]1CCCC[C@@H]1c1n[nH]c(=O)[nH]1 ZINC000330865746 386905860 /nfs/dbraw/zinc/90/58/60/386905860.db2.gz XLQHNDFZVLUSQB-SNVBAGLBSA-N 1 2 238.335 2.228 20 0 BEADLO Nc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1ccn[nH]1 ZINC000334856364 386908697 /nfs/dbraw/zinc/90/86/97/386908697.db2.gz PZQIDCRDWVFLEA-CQSZACIVSA-N 1 2 242.326 2.159 20 0 BEADLO c1cc(N2C[C@@H]3C[C@H]2CS3)nc(C2CC2)[nH+]1 ZINC000334819732 386947056 /nfs/dbraw/zinc/94/70/56/386947056.db2.gz VPTWCXGZBHCLOX-UWVGGRQHSA-N 1 2 233.340 2.048 20 0 BEADLO CCN(CC)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000334870881 386930132 /nfs/dbraw/zinc/93/01/32/386930132.db2.gz YLXSDWYNUXFNEO-UHFFFAOYSA-N 1 2 232.287 2.208 20 0 BEADLO Cc1ccc(CN(C)c2cc(C)[nH+]cn2)nc1 ZINC000302675348 386930352 /nfs/dbraw/zinc/93/03/52/386930352.db2.gz MLKBGLKAFCUURZ-UHFFFAOYSA-N 1 2 228.299 2.125 20 0 BEADLO Cc1ccc(CN(C)c2cc[nH+]c(C)n2)nc1 ZINC000302719802 386934341 /nfs/dbraw/zinc/93/43/41/386934341.db2.gz ZLFJROVLZBBVLJ-UHFFFAOYSA-N 1 2 228.299 2.125 20 0 BEADLO Cc1ccc(C[C@@H](CO)Nc2cccc[nH+]2)cc1 ZINC000302726997 386935072 /nfs/dbraw/zinc/93/50/72/386935072.db2.gz SNDFNVSMBOYWMV-AWEZNQCLSA-N 1 2 242.322 2.406 20 0 BEADLO CC(C)c1nc(N2CC(O)C2)cc(C(C)(C)C)[nH+]1 ZINC000302915905 386947998 /nfs/dbraw/zinc/94/79/98/386947998.db2.gz VXBFIUCHTZEZSC-UHFFFAOYSA-N 1 2 249.358 2.078 20 0 BEADLO Cc1cnc(N(C)CCCn2cc[nH+]c2)s1 ZINC000302882734 386943981 /nfs/dbraw/zinc/94/39/81/386943981.db2.gz KFAHKWCDJXLIHF-UHFFFAOYSA-N 1 2 236.344 2.175 20 0 BEADLO CC[C@@H](C)C(=O)N[C@H](c1[nH+]ccn1C)C1CC1 ZINC000341710102 386955354 /nfs/dbraw/zinc/95/53/54/386955354.db2.gz VVAPSQAHMWYSKZ-KOLCDFICSA-N 1 2 235.331 2.034 20 0 BEADLO FC(F)C[N@H+](CCn1cccn1)CC1CCC1 ZINC000341751492 386961353 /nfs/dbraw/zinc/96/13/53/386961353.db2.gz QVLBIVRGHHFFSJ-UHFFFAOYSA-N 1 2 243.301 2.250 20 0 BEADLO FC(F)C[N@@H+](CCn1cccn1)CC1CCC1 ZINC000341751492 386961358 /nfs/dbraw/zinc/96/13/58/386961358.db2.gz QVLBIVRGHHFFSJ-UHFFFAOYSA-N 1 2 243.301 2.250 20 0 BEADLO Cc1ccc(Cc2nc(C3(C)CC3)no2)c[nH+]1 ZINC000334890671 386964253 /nfs/dbraw/zinc/96/42/53/386964253.db2.gz WQVVZBWAYVEMTC-UHFFFAOYSA-N 1 2 229.283 2.415 20 0 BEADLO C[C@@H](CC1CCCC1)C(=O)NCc1c[nH+]c[nH]1 ZINC000332281705 386969277 /nfs/dbraw/zinc/96/92/77/386969277.db2.gz ICPZPTWOMOLAJU-JTQLQIEISA-N 1 2 235.331 2.242 20 0 BEADLO C[C@@H](CC1CCCC1)C(=O)NCc1c[nH]c[nH+]1 ZINC000332281705 386969282 /nfs/dbraw/zinc/96/92/82/386969282.db2.gz ICPZPTWOMOLAJU-JTQLQIEISA-N 1 2 235.331 2.242 20 0 BEADLO Cc1cc(NC(=O)N2CC(C)(C)C[C@@H]2C)cc[nH+]1 ZINC000334897156 386970299 /nfs/dbraw/zinc/97/02/99/386970299.db2.gz IVPFMNZIPXZLEE-NSHDSACASA-N 1 2 247.342 2.464 20 0 BEADLO CC[C@H]1CCC[C@H]1c1nc(C[NH2+]C)no1 ZINC000332365740 386973786 /nfs/dbraw/zinc/97/37/86/386973786.db2.gz KOKUJKBYFWIHAB-DTWKUNHWSA-N 1 2 209.293 2.083 20 0 BEADLO CCO[C@H](C)C(=O)Nc1c(C)cc[nH+]c1C ZINC000331156637 386978050 /nfs/dbraw/zinc/97/80/50/386978050.db2.gz VUCCFTZNDVBUFV-SNVBAGLBSA-N 1 2 222.288 2.062 20 0 BEADLO Cc1ccc(NC(=O)N2CC(CF)C2)c(C)[nH+]1 ZINC000334908251 386982032 /nfs/dbraw/zinc/98/20/32/386982032.db2.gz KKQLWZZNYGVKFR-UHFFFAOYSA-N 1 2 237.278 2.132 20 0 BEADLO CS[C@H]1CC[C@@H]1[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000425361461 386982465 /nfs/dbraw/zinc/98/24/65/386982465.db2.gz UDKXHUNQBHEXND-UTLUCORTSA-N 1 2 245.388 2.200 20 0 BEADLO FC(F)OC[C@H]1CC[N@H+](Cc2cscn2)C1 ZINC000353020323 386990065 /nfs/dbraw/zinc/99/00/65/386990065.db2.gz ADYDVVGNEXJKMY-QMMMGPOBSA-N 1 2 248.298 2.204 20 0 BEADLO FC(F)OC[C@H]1CC[N@@H+](Cc2cscn2)C1 ZINC000353020323 386990069 /nfs/dbraw/zinc/99/00/69/386990069.db2.gz ADYDVVGNEXJKMY-QMMMGPOBSA-N 1 2 248.298 2.204 20 0 BEADLO CC[C@H](NC(=O)[C@@H](C)C(F)(F)F)c1[nH]cc[nH+]1 ZINC000331262857 387001108 /nfs/dbraw/zinc/00/11/08/387001108.db2.gz DXFRAGHNRQYXNA-RQJHMYQMSA-N 1 2 249.236 2.175 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000368676032 387001733 /nfs/dbraw/zinc/00/17/33/387001733.db2.gz QRRWDLJRLKVWOR-CYBMUJFWSA-N 1 2 249.358 2.109 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000368676032 387001736 /nfs/dbraw/zinc/00/17/36/387001736.db2.gz QRRWDLJRLKVWOR-CYBMUJFWSA-N 1 2 249.358 2.109 20 0 BEADLO Cn1cc[nH+]c1[C@H](NC(=O)[C@@H]1CC1(C)C)C1CC1 ZINC000341686748 386950172 /nfs/dbraw/zinc/95/01/72/386950172.db2.gz GFKKMOVBXNGTNG-WDEREUQCSA-N 1 2 247.342 2.034 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1C/C=C(\C)Cl ZINC000528379475 387034856 /nfs/dbraw/zinc/03/48/56/387034856.db2.gz BNEQCGNPCJSPQW-WXLQGSQKSA-N 1 2 203.713 2.240 20 0 BEADLO CC[C@@H]1COCC[N@H+]1C/C=C(\C)Cl ZINC000528379475 387034858 /nfs/dbraw/zinc/03/48/58/387034858.db2.gz BNEQCGNPCJSPQW-WXLQGSQKSA-N 1 2 203.713 2.240 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1C/C=C(/C)Cl ZINC000528379479 387035107 /nfs/dbraw/zinc/03/51/07/387035107.db2.gz BNEQCGNPCJSPQW-ZUYFITGHSA-N 1 2 203.713 2.240 20 0 BEADLO CC[C@@H]1COCC[N@H+]1C/C=C(/C)Cl ZINC000528379479 387035110 /nfs/dbraw/zinc/03/51/10/387035110.db2.gz BNEQCGNPCJSPQW-ZUYFITGHSA-N 1 2 203.713 2.240 20 0 BEADLO C[C@@H]1C[C@H](Nc2ncc(Cl)cn2)c2[nH+]ccn21 ZINC000333642699 387047628 /nfs/dbraw/zinc/04/76/28/387047628.db2.gz CKSVTRADPPLRQL-APPZFPTMSA-N 1 2 249.705 2.444 20 0 BEADLO CCc1ccc([C@@H](C)[NH2+]Cc2ncnn2CC)o1 ZINC000359075264 387052721 /nfs/dbraw/zinc/05/27/21/387052721.db2.gz YPVJQRYZNHTDBU-SNVBAGLBSA-N 1 2 248.330 2.304 20 0 BEADLO Cc1nc(NC[C@H]2CC23CCSCC3)cc[nH+]1 ZINC000334971804 387057210 /nfs/dbraw/zinc/05/72/10/387057210.db2.gz BTYBJFNRECPKBX-LLVKDONJSA-N 1 2 249.383 2.152 20 0 BEADLO CC(C)CCC(=O)Nc1cc[nH+]cc1O ZINC000109891476 387057624 /nfs/dbraw/zinc/05/76/24/387057624.db2.gz GNMCFWQXFHTXNU-UHFFFAOYSA-N 1 2 208.261 2.162 20 0 BEADLO CCSCC[N@@H+]1CCOC[C@H]1c1ccco1 ZINC000369624628 387058018 /nfs/dbraw/zinc/05/80/18/387058018.db2.gz ANRWWRBPEYNYEB-NSHDSACASA-N 1 2 241.356 2.406 20 0 BEADLO CCSCC[N@H+]1CCOC[C@H]1c1ccco1 ZINC000369624628 387058020 /nfs/dbraw/zinc/05/80/20/387058020.db2.gz ANRWWRBPEYNYEB-NSHDSACASA-N 1 2 241.356 2.406 20 0 BEADLO Cn1c2ccccc2nc1C[N@@H+]1CC[C@H](F)C1 ZINC000336222692 387062018 /nfs/dbraw/zinc/06/20/18/387062018.db2.gz CIFAZNMCNOHLLZ-JTQLQIEISA-N 1 2 233.290 2.117 20 0 BEADLO Cn1c2ccccc2nc1C[N@H+]1CC[C@H](F)C1 ZINC000336222692 387062022 /nfs/dbraw/zinc/06/20/22/387062022.db2.gz CIFAZNMCNOHLLZ-JTQLQIEISA-N 1 2 233.290 2.117 20 0 BEADLO Cc1cnccc1C[N@@H+]1CCC=C(F)C1 ZINC000336224549 387065228 /nfs/dbraw/zinc/06/52/28/387065228.db2.gz KVNQCACOXREZGY-UHFFFAOYSA-N 1 2 206.264 2.449 20 0 BEADLO Cc1cnccc1C[N@H+]1CCC=C(F)C1 ZINC000336224549 387065232 /nfs/dbraw/zinc/06/52/32/387065232.db2.gz KVNQCACOXREZGY-UHFFFAOYSA-N 1 2 206.264 2.449 20 0 BEADLO CC[C@@H]1CCN1C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000334985821 387073542 /nfs/dbraw/zinc/07/35/42/387073542.db2.gz FMMOZDIMFCMGRX-CYBMUJFWSA-N 1 2 247.342 2.392 20 0 BEADLO Cc1noc([C@@H]2CCC[N@H+]2Cc2cccn2C)n1 ZINC000334987524 387075892 /nfs/dbraw/zinc/07/58/92/387075892.db2.gz CFVFGQQAYYQVON-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1noc([C@@H]2CCC[N@@H+]2Cc2cccn2C)n1 ZINC000334987524 387075897 /nfs/dbraw/zinc/07/58/97/387075897.db2.gz CFVFGQQAYYQVON-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO CC1(C(=O)Nc2ccn3cc[nH+]c3c2)CC1 ZINC000336240261 387079552 /nfs/dbraw/zinc/07/95/52/387079552.db2.gz WMKLSTLMBPQMTG-UHFFFAOYSA-N 1 2 215.256 2.073 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H]1CC12CCCC2 ZINC000336256348 387087444 /nfs/dbraw/zinc/08/74/44/387087444.db2.gz BGNJMJNKBVGFSS-LLVKDONJSA-N 1 2 230.311 2.331 20 0 BEADLO O=C1CCC(C[N@H+]2CCC[C@@H]2C(F)F)CC1 ZINC000336256774 387088239 /nfs/dbraw/zinc/08/82/39/387088239.db2.gz MWOOUJVMHHVDJF-LLVKDONJSA-N 1 2 231.286 2.475 20 0 BEADLO O=C1CCC(C[N@@H+]2CCC[C@@H]2C(F)F)CC1 ZINC000336256774 387088242 /nfs/dbraw/zinc/08/82/42/387088242.db2.gz MWOOUJVMHHVDJF-LLVKDONJSA-N 1 2 231.286 2.475 20 0 BEADLO CC[N@@H+]1CCO[C@@H](c2ccc(F)c(F)c2)C1 ZINC000066849431 387092739 /nfs/dbraw/zinc/09/27/39/387092739.db2.gz ICDVVMCMBKFPKK-GFCCVEGCSA-N 1 2 227.254 2.358 20 0 BEADLO CC[N@H+]1CCO[C@@H](c2ccc(F)c(F)c2)C1 ZINC000066849431 387092745 /nfs/dbraw/zinc/09/27/45/387092745.db2.gz ICDVVMCMBKFPKK-GFCCVEGCSA-N 1 2 227.254 2.358 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CCC(OC2CCC2)CC1 ZINC000418088857 387095569 /nfs/dbraw/zinc/09/55/69/387095569.db2.gz HIMOHSPQYJGVGU-UHFFFAOYSA-N 1 2 249.358 2.252 20 0 BEADLO COc1cc(C[N@@H+]2CCC[C@@](C)(F)C2)ccn1 ZINC000336275159 387107066 /nfs/dbraw/zinc/10/70/66/387107066.db2.gz AOXCILCGDCSKOO-CYBMUJFWSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cc(C[N@H+]2CCC[C@@](C)(F)C2)ccn1 ZINC000336275159 387107071 /nfs/dbraw/zinc/10/70/71/387107071.db2.gz AOXCILCGDCSKOO-CYBMUJFWSA-N 1 2 238.306 2.414 20 0 BEADLO Cc1cc(C)c(CNC(=O)N[C@@H]2CC[C@@H]2C)c[nH+]1 ZINC000334945813 387108199 /nfs/dbraw/zinc/10/81/99/387108199.db2.gz PHDZVFUMTYESGF-TVQRCGJNSA-N 1 2 247.342 2.296 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@H](C)CC2)no1 ZINC000068830371 387108270 /nfs/dbraw/zinc/10/82/70/387108270.db2.gz FXPONUGFUGKFEH-VIFPVBQESA-N 1 2 209.293 2.000 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@H](C)CC2)no1 ZINC000068830371 387108273 /nfs/dbraw/zinc/10/82/73/387108273.db2.gz FXPONUGFUGKFEH-VIFPVBQESA-N 1 2 209.293 2.000 20 0 BEADLO CCN(CC)C(=O)C[N@H+](C)[C@H](C)c1ccco1 ZINC000069069561 387112025 /nfs/dbraw/zinc/11/20/25/387112025.db2.gz GGXHGWSKBWPDTM-LLVKDONJSA-N 1 2 238.331 2.141 20 0 BEADLO CCN(CC)C(=O)C[N@@H+](C)[C@H](C)c1ccco1 ZINC000069069561 387112031 /nfs/dbraw/zinc/11/20/31/387112031.db2.gz GGXHGWSKBWPDTM-LLVKDONJSA-N 1 2 238.331 2.141 20 0 BEADLO COC[C@@H]1CCN(c2cc[nH+]c(C(C)C)n2)C1 ZINC000352365661 387113124 /nfs/dbraw/zinc/11/31/24/387113124.db2.gz VFXQQAHCUCPDBN-LLVKDONJSA-N 1 2 235.331 2.073 20 0 BEADLO c1ccc(Cc2nc(C[NH+]3CCCC3)no2)cc1 ZINC000069221101 387115599 /nfs/dbraw/zinc/11/55/99/387115599.db2.gz UPGISSFNRRIKMI-UHFFFAOYSA-N 1 2 243.310 2.256 20 0 BEADLO Fc1cccc(Cl)c1CNCc1[nH]cc[nH+]1 ZINC000070650032 387120715 /nfs/dbraw/zinc/12/07/15/387120715.db2.gz VDWZUACQWZQVKZ-UHFFFAOYSA-N 1 2 239.681 2.492 20 0 BEADLO C[C@@H](CC(=O)NCCC(C)(C)C)n1cc[nH+]c1 ZINC000516973904 387121297 /nfs/dbraw/zinc/12/12/97/387121297.db2.gz KQNALTPAUDJNGJ-NSHDSACASA-N 1 2 237.347 2.387 20 0 BEADLO c1coc([C@H]2COCC[N@H+]2C[C@H]2CCC=CO2)c1 ZINC000370526234 387124314 /nfs/dbraw/zinc/12/43/14/387124314.db2.gz CHRLZUYYWDQRRZ-CHWSQXEVSA-N 1 2 249.310 2.346 20 0 BEADLO c1coc([C@H]2COCC[N@@H+]2C[C@H]2CCC=CO2)c1 ZINC000370526234 387124322 /nfs/dbraw/zinc/12/43/22/387124322.db2.gz CHRLZUYYWDQRRZ-CHWSQXEVSA-N 1 2 249.310 2.346 20 0 BEADLO CCN(CC(C)C)C(=O)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000370606679 387129021 /nfs/dbraw/zinc/12/90/21/387129021.db2.gz NTLUNOPMMLZFJH-NSHDSACASA-N 1 2 249.358 2.334 20 0 BEADLO Cc1ccc2c(c1)CN(Cc1[nH+]ccn1C)C2 ZINC000336226961 387067788 /nfs/dbraw/zinc/06/77/88/387067788.db2.gz XGLYMRPPDJRFIP-UHFFFAOYSA-N 1 2 227.311 2.244 20 0 BEADLO FC(F)(CNCc1[nH]cc[nH+]1)c1ccccc1 ZINC000353183015 387150039 /nfs/dbraw/zinc/15/00/39/387150039.db2.gz ADQUVJDEYCCQBJ-UHFFFAOYSA-N 1 2 237.253 2.291 20 0 BEADLO COc1cc(C[N@@H+]2CC[C@](C)(F)C2)ccn1 ZINC000336324894 387152712 /nfs/dbraw/zinc/15/27/12/387152712.db2.gz YMZKOSMAJAAJDZ-LBPRGKRZSA-N 1 2 224.279 2.024 20 0 BEADLO COc1cc(C[N@H+]2CC[C@](C)(F)C2)ccn1 ZINC000336324894 387152715 /nfs/dbraw/zinc/15/27/15/387152715.db2.gz YMZKOSMAJAAJDZ-LBPRGKRZSA-N 1 2 224.279 2.024 20 0 BEADLO CC(C)COCC[N@@H+]1CCC[C@H]1C(F)F ZINC000353194147 387152745 /nfs/dbraw/zinc/15/27/45/387152745.db2.gz OLDBJVHZSCIZQA-JTQLQIEISA-N 1 2 221.291 2.389 20 0 BEADLO CC(C)COCC[N@H+]1CCC[C@H]1C(F)F ZINC000353194147 387152755 /nfs/dbraw/zinc/15/27/55/387152755.db2.gz OLDBJVHZSCIZQA-JTQLQIEISA-N 1 2 221.291 2.389 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1sccc1C ZINC000353268422 387169071 /nfs/dbraw/zinc/16/90/71/387169071.db2.gz QTRHMVJGLIOCHU-UHFFFAOYSA-N 1 2 227.329 2.051 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1sccc1C ZINC000353268422 387169077 /nfs/dbraw/zinc/16/90/77/387169077.db2.gz QTRHMVJGLIOCHU-UHFFFAOYSA-N 1 2 227.329 2.051 20 0 BEADLO Cc1oc(C(C)C)cc1C(=O)NCc1c[nH+]c[nH]1 ZINC000353281693 387171485 /nfs/dbraw/zinc/17/14/85/387171485.db2.gz CMDVLTMSFZHXCK-UHFFFAOYSA-N 1 2 247.298 2.365 20 0 BEADLO Cc1oc(C(C)C)cc1C(=O)NCc1c[nH]c[nH+]1 ZINC000353281693 387171488 /nfs/dbraw/zinc/17/14/88/387171488.db2.gz CMDVLTMSFZHXCK-UHFFFAOYSA-N 1 2 247.298 2.365 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ncc(C)cn2)CCS1 ZINC000336349575 387178332 /nfs/dbraw/zinc/17/83/32/387178332.db2.gz DACZEORQTFTCCN-NSHDSACASA-N 1 2 237.372 2.112 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ncc(C)cn2)CCS1 ZINC000336349575 387178334 /nfs/dbraw/zinc/17/83/34/387178334.db2.gz DACZEORQTFTCCN-NSHDSACASA-N 1 2 237.372 2.112 20 0 BEADLO Cc1oncc1C[N@@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000336349092 387178488 /nfs/dbraw/zinc/17/84/88/387178488.db2.gz ALMAWWCBXIUUSD-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1oncc1C[N@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000336349092 387178493 /nfs/dbraw/zinc/17/84/93/387178493.db2.gz ALMAWWCBXIUUSD-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO C[C@@H]1C[C@H](c2cccnc2)[N@H+](Cc2cnc[nH]2)C1 ZINC000336351802 387180084 /nfs/dbraw/zinc/18/00/84/387180084.db2.gz JGGXJIQKHOSDMJ-BXUZGUMPSA-N 1 2 242.326 2.388 20 0 BEADLO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2cnc[nH]2)C1 ZINC000336351802 387180086 /nfs/dbraw/zinc/18/00/86/387180086.db2.gz JGGXJIQKHOSDMJ-BXUZGUMPSA-N 1 2 242.326 2.388 20 0 BEADLO CCN(C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21)C1CC1 ZINC000334074422 387180104 /nfs/dbraw/zinc/18/01/04/387180104.db2.gz JFUIOKVDBAXAQF-MWLCHTKSSA-N 1 2 248.330 2.083 20 0 BEADLO CCc1ccc([C@H](C)[NH2+][C@@H](C)c2ncnn2C)o1 ZINC000353335347 387183351 /nfs/dbraw/zinc/18/33/51/387183351.db2.gz KYCFLBROZPZOFH-UWVGGRQHSA-N 1 2 248.330 2.382 20 0 BEADLO CCc1ccc([C@@H](C)[NH2+][C@H](C)c2ncnn2C)o1 ZINC000353335346 387183841 /nfs/dbraw/zinc/18/38/41/387183841.db2.gz KYCFLBROZPZOFH-NXEZZACHSA-N 1 2 248.330 2.382 20 0 BEADLO Cn1c[nH+]cc1CSc1ccncc1 ZINC000336358232 387188013 /nfs/dbraw/zinc/18/80/13/387188013.db2.gz SRORFBHWZVLQNU-UHFFFAOYSA-N 1 2 205.286 2.107 20 0 BEADLO c1cc(C[NH2+]Cc2ccc3ncccc3c2)[nH]n1 ZINC000069502057 387190890 /nfs/dbraw/zinc/19/08/90/387190890.db2.gz OFWPBKCECRKWTN-UHFFFAOYSA-N 1 2 238.294 2.248 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CCC[C@H]1C1CC1 ZINC000371313624 387191841 /nfs/dbraw/zinc/19/18/41/387191841.db2.gz MMDGDNQUPXLIBE-ZDUSSCGKSA-N 1 2 245.326 2.218 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](CC(=O)N(C)C(C)C)C2 ZINC000336308977 387138559 /nfs/dbraw/zinc/13/85/59/387138559.db2.gz SYEMRDDCURKYFW-UHFFFAOYSA-N 1 2 246.354 2.177 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](CC(=O)N(C)C(C)C)C2 ZINC000336308977 387138560 /nfs/dbraw/zinc/13/85/60/387138560.db2.gz SYEMRDDCURKYFW-UHFFFAOYSA-N 1 2 246.354 2.177 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2C[C@@H](C)[C@H]2C)o1 ZINC000336375562 387205647 /nfs/dbraw/zinc/20/56/47/387205647.db2.gz YHYLANSLBXZRAQ-RKDXNWHRSA-N 1 2 209.293 2.033 20 0 BEADLO CC(C)c1nnc(C[N@H+]2C[C@@H](C)[C@H]2C)o1 ZINC000336375562 387205650 /nfs/dbraw/zinc/20/56/50/387205650.db2.gz YHYLANSLBXZRAQ-RKDXNWHRSA-N 1 2 209.293 2.033 20 0 BEADLO CC/C=C(\C)C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000371442438 387213468 /nfs/dbraw/zinc/21/34/68/387213468.db2.gz ILKUQJARDJBABJ-UAWPZABVSA-N 1 2 233.315 2.430 20 0 BEADLO CCc1ccc(C[N@H+](C)Cc2cc[nH]n2)o1 ZINC000353519078 387221864 /nfs/dbraw/zinc/22/18/64/387221864.db2.gz MAMRMBMHLMNEST-UHFFFAOYSA-N 1 2 219.288 2.197 20 0 BEADLO CCc1ccc(C[N@@H+](C)Cc2cc[nH]n2)o1 ZINC000353519078 387221868 /nfs/dbraw/zinc/22/18/68/387221868.db2.gz MAMRMBMHLMNEST-UHFFFAOYSA-N 1 2 219.288 2.197 20 0 BEADLO COCC1=CC[N@H+](Cc2nccn2C(C)C)CC1 ZINC000187690742 387224540 /nfs/dbraw/zinc/22/45/40/387224540.db2.gz NPKSCTSGSQFCRR-UHFFFAOYSA-N 1 2 249.358 2.243 20 0 BEADLO COCC1=CC[N@@H+](Cc2nccn2C(C)C)CC1 ZINC000187690742 387224544 /nfs/dbraw/zinc/22/45/44/387224544.db2.gz NPKSCTSGSQFCRR-UHFFFAOYSA-N 1 2 249.358 2.243 20 0 BEADLO Cc1cccc(C(=O)NC(C)(C)c2[nH]cc[nH+]2)c1 ZINC000572127502 387240842 /nfs/dbraw/zinc/24/08/42/387240842.db2.gz HDFHQIJHFZTQRW-UHFFFAOYSA-N 1 2 243.310 2.383 20 0 BEADLO C[N@H+](Cc1ccsc1)Cc1cc[nH]n1 ZINC000120491277 387249095 /nfs/dbraw/zinc/24/90/95/387249095.db2.gz USQRSEWWBUHLRO-UHFFFAOYSA-N 1 2 207.302 2.103 20 0 BEADLO C[N@@H+](Cc1ccsc1)Cc1cc[nH]n1 ZINC000120491277 387249101 /nfs/dbraw/zinc/24/91/01/387249101.db2.gz USQRSEWWBUHLRO-UHFFFAOYSA-N 1 2 207.302 2.103 20 0 BEADLO CCC1(NC(=O)N[C@H]2C[C@H](C)n3cc[nH+]c32)CC1 ZINC000334098215 387195195 /nfs/dbraw/zinc/19/51/95/387195195.db2.gz UKZSJXAZDYWGAV-UWVGGRQHSA-N 1 2 248.330 2.131 20 0 BEADLO CCCC[C@@H](C)[C@@H](C)NCC(F)(F)C[NH3+] ZINC000423349640 387199839 /nfs/dbraw/zinc/19/98/39/387199839.db2.gz XGTGIQKQGSGSDK-NXEZZACHSA-N 1 2 222.323 2.385 20 0 BEADLO CC[C@@H]1[C@H](C)CCN1C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000514949053 387313203 /nfs/dbraw/zinc/31/32/03/387313203.db2.gz FUZILWVMIASIRQ-NQBHXWOUSA-N 1 2 249.358 2.235 20 0 BEADLO CC[C@@H]1[C@H](C)CCN1C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000514949053 387313208 /nfs/dbraw/zinc/31/32/08/387313208.db2.gz FUZILWVMIASIRQ-NQBHXWOUSA-N 1 2 249.358 2.235 20 0 BEADLO Cc1ccc2[nH+]c(CNC(=O)C3(C)CC3)cn2c1 ZINC000336485298 387313479 /nfs/dbraw/zinc/31/34/79/387313479.db2.gz NCNMCCCTRFXBJU-UHFFFAOYSA-N 1 2 243.310 2.059 20 0 BEADLO CC[C@H]([NH2+][C@@H]1C[C@H]1c1ccc(C)cc1)C(=O)OC ZINC000572243738 387275465 /nfs/dbraw/zinc/27/54/65/387275465.db2.gz IAHZWIVXVRXNRL-MELADBBJSA-N 1 2 247.338 2.392 20 0 BEADLO CCCCN(CC)C(=O)[C@@H]1CCn2c[nH+]cc2C1 ZINC000372175301 387281022 /nfs/dbraw/zinc/28/10/22/387281022.db2.gz HHEKIGFDIYABFP-GFCCVEGCSA-N 1 2 249.358 2.094 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@H]1CC[C@H](C)C[C@H]1C ZINC000514731646 387282592 /nfs/dbraw/zinc/28/25/92/387282592.db2.gz QMBVLPFLSJJMDK-HOSYDEDBSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@@H]1CC[C@H](C)C[C@H]1C ZINC000514731646 387282597 /nfs/dbraw/zinc/28/25/97/387282597.db2.gz QMBVLPFLSJJMDK-HOSYDEDBSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@H]1CC[C@H](C)C[C@@H]1C ZINC000514731647 387282625 /nfs/dbraw/zinc/28/26/25/387282625.db2.gz QMBVLPFLSJJMDK-JBLDHEPKSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@@H]1CC[C@H](C)C[C@@H]1C ZINC000514731647 387282630 /nfs/dbraw/zinc/28/26/30/387282630.db2.gz QMBVLPFLSJJMDK-JBLDHEPKSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1sccc1C[NH2+]Cc1ncccn1 ZINC000572258796 387288978 /nfs/dbraw/zinc/28/89/78/387288978.db2.gz WGLKPOCSDLARRZ-UHFFFAOYSA-N 1 2 219.313 2.136 20 0 BEADLO F[C@]1(c2ccccc2)CC[N@H+](Cc2cc[nH]n2)C1 ZINC000367163013 387289422 /nfs/dbraw/zinc/28/94/22/387289422.db2.gz ILMZKDFUBXGAAE-CQSZACIVSA-N 1 2 245.301 2.480 20 0 BEADLO F[C@]1(c2ccccc2)CC[N@@H+](Cc2cc[nH]n2)C1 ZINC000367163013 387289424 /nfs/dbraw/zinc/28/94/24/387289424.db2.gz ILMZKDFUBXGAAE-CQSZACIVSA-N 1 2 245.301 2.480 20 0 BEADLO CN(CC1CCC1)C(=O)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000336492804 387318556 /nfs/dbraw/zinc/31/85/56/387318556.db2.gz DLWRAEDENRVAJC-LLVKDONJSA-N 1 2 247.342 2.088 20 0 BEADLO Cn1ccc(C[N@@H+]2CCc3ccsc3C2)n1 ZINC000336472003 387301930 /nfs/dbraw/zinc/30/19/30/387301930.db2.gz PPOBMAJGLFAFCQ-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO Cn1ccc(C[N@H+]2CCc3ccsc3C2)n1 ZINC000336472003 387301936 /nfs/dbraw/zinc/30/19/36/387301936.db2.gz PPOBMAJGLFAFCQ-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CCO[C@H](C2CC2)C1 ZINC000372471085 387307677 /nfs/dbraw/zinc/30/76/77/387307677.db2.gz HIAAXPRRNADVEH-ZDUSSCGKSA-N 1 2 249.358 2.075 20 0 BEADLO O=C(CC(F)(F)F)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000336532678 387354667 /nfs/dbraw/zinc/35/46/67/387354667.db2.gz LRVXKCIDHAEVGW-ZETCQYMHSA-N 1 2 247.220 2.026 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCO[C@H](C2CC2)C1 ZINC000373396816 387361598 /nfs/dbraw/zinc/36/15/98/387361598.db2.gz XEAQGRZISWNGPM-AWEZNQCLSA-N 1 2 249.358 2.075 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCO[C@H](C2CC2)C1 ZINC000373396816 387361604 /nfs/dbraw/zinc/36/16/04/387361604.db2.gz XEAQGRZISWNGPM-AWEZNQCLSA-N 1 2 249.358 2.075 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CCCC[C@@H]2C)[nH]1 ZINC000336547360 387368148 /nfs/dbraw/zinc/36/81/48/387368148.db2.gz MOKLKYLYLJNSGB-JTQLQIEISA-N 1 2 222.336 2.303 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CCCC[C@@H]2C)[nH]1 ZINC000336547360 387368153 /nfs/dbraw/zinc/36/81/53/387368153.db2.gz MOKLKYLYLJNSGB-JTQLQIEISA-N 1 2 222.336 2.303 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CCCC[C@H]2C)[nH]1 ZINC000336547361 387368866 /nfs/dbraw/zinc/36/88/66/387368866.db2.gz MOKLKYLYLJNSGB-SNVBAGLBSA-N 1 2 222.336 2.303 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CCCC[C@H]2C)[nH]1 ZINC000336547361 387368869 /nfs/dbraw/zinc/36/88/69/387368869.db2.gz MOKLKYLYLJNSGB-SNVBAGLBSA-N 1 2 222.336 2.303 20 0 BEADLO c1coc([C@H]2C[N@H+](Cc3ccccn3)CCO2)c1 ZINC000121525821 387374640 /nfs/dbraw/zinc/37/46/40/387374640.db2.gz ZKODQZMUTRHMBG-CQSZACIVSA-N 1 2 244.294 2.248 20 0 BEADLO c1coc([C@H]2C[N@@H+](Cc3ccccn3)CCO2)c1 ZINC000121525821 387374644 /nfs/dbraw/zinc/37/46/44/387374644.db2.gz ZKODQZMUTRHMBG-CQSZACIVSA-N 1 2 244.294 2.248 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCc3n[nH]cc3C2)s1 ZINC000336552904 387374845 /nfs/dbraw/zinc/37/48/45/387374845.db2.gz OAZJAZWUWJBBBE-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCc3n[nH]cc3C2)s1 ZINC000336552904 387374854 /nfs/dbraw/zinc/37/48/54/387374854.db2.gz OAZJAZWUWJBBBE-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2CCO[C@H]2C)c(C)[nH+]1 ZINC000336494267 387320482 /nfs/dbraw/zinc/32/04/82/387320482.db2.gz JUKBHIUZQUONLK-WDEREUQCSA-N 1 2 234.299 2.062 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NCC12CCC(CC1)C2 ZINC000373577060 387382434 /nfs/dbraw/zinc/38/24/34/387382434.db2.gz MGLVMCLUEWRLRN-UHFFFAOYSA-N 1 2 247.342 2.039 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NCC12CCC(CC1)C2 ZINC000373577060 387382441 /nfs/dbraw/zinc/38/24/41/387382441.db2.gz MGLVMCLUEWRLRN-UHFFFAOYSA-N 1 2 247.342 2.039 20 0 BEADLO CCC[C@@H]1C[C@@H]1C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000360651219 387328549 /nfs/dbraw/zinc/32/85/49/387328549.db2.gz GGABPVLCXRTWCZ-OUAUKWLOSA-N 1 2 235.331 2.413 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000360651218 387328686 /nfs/dbraw/zinc/32/86/86/387328686.db2.gz GGABPVLCXRTWCZ-MXWKQRLJSA-N 1 2 235.331 2.413 20 0 BEADLO COc1ccc(C[NH2+][C@@H](C)c2cscn2)cn1 ZINC000162346202 387344293 /nfs/dbraw/zinc/34/42/93/387344293.db2.gz USEBZEKCWDHUCT-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO c1nc(C[NH2+][C@@H](c2cccnc2)C2CC2)co1 ZINC000515197622 387345863 /nfs/dbraw/zinc/34/58/63/387345863.db2.gz UKUCBMAWGAFHCN-CYBMUJFWSA-N 1 2 229.283 2.311 20 0 BEADLO FC1CN(Cc2ccc(-n3cc[nH+]c3)cc2)C1 ZINC000336522305 387346895 /nfs/dbraw/zinc/34/68/95/387346895.db2.gz HISXJRXODVHRFO-UHFFFAOYSA-N 1 2 231.274 2.026 20 0 BEADLO COC(=O)[C@@H](CNc1cccc[nH+]1)CC1CC1 ZINC000515188857 387348304 /nfs/dbraw/zinc/34/83/04/387348304.db2.gz XOSODBYYUNSYCO-LLVKDONJSA-N 1 2 234.299 2.083 20 0 BEADLO C[NH+](C)Cc1nc(CC2CC(C)(C)C2)no1 ZINC000361359668 387447868 /nfs/dbraw/zinc/44/78/68/387447868.db2.gz DWLSHOOMQOOJPN-UHFFFAOYSA-N 1 2 223.320 2.110 20 0 BEADLO C[N@H+](Cc1ncc(Cl)s1)[C@H]1CCCOC1 ZINC000336614271 387455257 /nfs/dbraw/zinc/45/52/57/387455257.db2.gz LOSAAPRLLBXSHX-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO C[N@@H+](Cc1ncc(Cl)s1)[C@H]1CCCOC1 ZINC000336614271 387455265 /nfs/dbraw/zinc/45/52/65/387455265.db2.gz LOSAAPRLLBXSHX-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1C[C@H](C)OC[C@@H]1C ZINC000336617991 387459556 /nfs/dbraw/zinc/45/95/56/387459556.db2.gz PCEBOLIUXLOJLX-RYUDHWBXSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)n1nccc1C[N@H+]1C[C@H](C)OC[C@@H]1C ZINC000336617991 387459561 /nfs/dbraw/zinc/45/95/61/387459561.db2.gz PCEBOLIUXLOJLX-RYUDHWBXSA-N 1 2 237.347 2.073 20 0 BEADLO C[C@@H](c1nc(Cc2c[nH+]cn2C)no1)C1CCC1 ZINC000351265971 387386182 /nfs/dbraw/zinc/38/61/82/387386182.db2.gz HCMHLFSJWCWBDC-SECBINFHSA-N 1 2 246.314 2.298 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC(C)(C)[C@H]1[C@H]1CCCO1 ZINC000336562405 387390283 /nfs/dbraw/zinc/39/02/83/387390283.db2.gz ZHMPFRQHLWOLMK-CHWSQXEVSA-N 1 2 249.358 2.108 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC(C)(C)[C@H]1[C@H]1CCCO1 ZINC000336562405 387390289 /nfs/dbraw/zinc/39/02/89/387390289.db2.gz ZHMPFRQHLWOLMK-CHWSQXEVSA-N 1 2 249.358 2.108 20 0 BEADLO Cc1cscc1C(=O)Nc1cc[nH+]cc1C ZINC000336572244 387395436 /nfs/dbraw/zinc/39/54/36/387395436.db2.gz BBGFRHMDGILQOO-UHFFFAOYSA-N 1 2 232.308 2.434 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC[C@@]1(C)CCCO1 ZINC000121720685 387400952 /nfs/dbraw/zinc/40/09/52/387400952.db2.gz SCDKITJPEWRMLQ-CYBMUJFWSA-N 1 2 249.314 2.081 20 0 BEADLO O=C(C1=CCCC1)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000336583181 387408023 /nfs/dbraw/zinc/40/80/23/387408023.db2.gz HETBOQTVYORSFT-UHFFFAOYSA-N 1 2 245.326 2.226 20 0 BEADLO Cn1ncc(Cl)c1C[N@H+](C)[C@@H]1CC1(C)C ZINC000336582840 387408364 /nfs/dbraw/zinc/40/83/64/387408364.db2.gz NLDDRMMPQCABJX-SNVBAGLBSA-N 1 2 227.739 2.304 20 0 BEADLO Cn1ncc(Cl)c1C[N@@H+](C)[C@@H]1CC1(C)C ZINC000336582840 387408369 /nfs/dbraw/zinc/40/83/69/387408369.db2.gz NLDDRMMPQCABJX-SNVBAGLBSA-N 1 2 227.739 2.304 20 0 BEADLO CCCC1(C(=O)N2CCn3c[nH+]cc3C2)CCC1 ZINC000336591833 387417208 /nfs/dbraw/zinc/41/72/08/387417208.db2.gz XRJXDFTZMWOQCY-UHFFFAOYSA-N 1 2 247.342 2.196 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1C[C@H](C)OC2(CCCC2)C1 ZINC000648076949 387503274 /nfs/dbraw/zinc/50/32/74/387503274.db2.gz RXARZINHMIEKPN-LBPRGKRZSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1C[C@H](C)OC2(CCCC2)C1 ZINC000648076949 387503277 /nfs/dbraw/zinc/50/32/77/387503277.db2.gz RXARZINHMIEKPN-LBPRGKRZSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1C[C@H](C)OC2(CCCC2)C1 ZINC000648076949 387503279 /nfs/dbraw/zinc/50/32/79/387503279.db2.gz RXARZINHMIEKPN-LBPRGKRZSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1C[C@H](C)OC2(CCCC2)C1 ZINC000648076949 387503283 /nfs/dbraw/zinc/50/32/83/387503283.db2.gz RXARZINHMIEKPN-LBPRGKRZSA-N 1 2 249.358 2.252 20 0 BEADLO C[C@@H](CC(=O)N[C@H]1CCCC12CC2)n1cc[nH+]c1 ZINC000633781573 387509258 /nfs/dbraw/zinc/50/92/58/387509258.db2.gz XXLNGENCSGWCIY-RYUDHWBXSA-N 1 2 247.342 2.283 20 0 BEADLO CCCOc1ccc(C[NH+]2CC(OC)C2)cc1 ZINC000572460622 387509993 /nfs/dbraw/zinc/50/99/93/387509993.db2.gz JOLVWRFZCXVNQQ-UHFFFAOYSA-N 1 2 235.327 2.306 20 0 BEADLO CCC1CCN(C(=O)[C@@H](C)Cc2c[nH+]c[nH]2)CC1 ZINC000516489741 387510403 /nfs/dbraw/zinc/51/04/03/387510403.db2.gz FVYXGSYBQFFAMC-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO CCC1CCN(C(=O)[C@@H](C)Cc2c[nH]c[nH+]2)CC1 ZINC000516489741 387510406 /nfs/dbraw/zinc/51/04/06/387510406.db2.gz FVYXGSYBQFFAMC-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO Cc1c[nH+]cc(N[C@H]2CCOC[C@@H]2C)c1 ZINC000192645222 387510621 /nfs/dbraw/zinc/51/06/21/387510621.db2.gz UFVQMUOVDJYWFY-JQWIXIFHSA-N 1 2 206.289 2.227 20 0 BEADLO Cn1c2cc(F)ccc2[nH]c1=[NH+][C@@H]1C[C@H]2C[C@H]2C1 ZINC000425286151 387522572 /nfs/dbraw/zinc/52/25/72/387522572.db2.gz AHWDUSLMDKRURF-DOFRTFSJSA-N 1 2 245.301 2.345 20 0 BEADLO Cc1ccsc1C[N@@H+](C)Cc1ncccn1 ZINC000361691505 387522513 /nfs/dbraw/zinc/52/25/13/387522513.db2.gz DLCHFFLPIPEINQ-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ccsc1C[N@H+](C)Cc1ncccn1 ZINC000361691505 387522520 /nfs/dbraw/zinc/52/25/20/387522520.db2.gz DLCHFFLPIPEINQ-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO C[C@H]1CCC[C@H](NC(=O)Cc2c[nH+]cn2C)CC1 ZINC000527190812 387522830 /nfs/dbraw/zinc/52/28/30/387522830.db2.gz RLXDUDINUKYOST-RYUDHWBXSA-N 1 2 249.358 2.048 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C[C@@H]1C[C@H]1C ZINC000361785681 387534884 /nfs/dbraw/zinc/53/48/84/387534884.db2.gz HDLMCFJNQCIXKH-KOLCDFICSA-N 1 2 218.300 2.051 20 0 BEADLO F[C@]1(c2ccccc2)CCN(Cc2[nH]cc[nH+]2)C1 ZINC000374534333 387464847 /nfs/dbraw/zinc/46/48/47/387464847.db2.gz DJHZIXANOZGTSP-CQSZACIVSA-N 1 2 245.301 2.480 20 0 BEADLO CSCC[N@@H+]1CCOC[C@H]1c1ccco1 ZINC000361478694 387467516 /nfs/dbraw/zinc/46/75/16/387467516.db2.gz NILRJZWMVVBUEX-JTQLQIEISA-N 1 2 227.329 2.016 20 0 BEADLO CSCC[N@H+]1CCOC[C@H]1c1ccco1 ZINC000361478694 387467519 /nfs/dbraw/zinc/46/75/19/387467519.db2.gz NILRJZWMVVBUEX-JTQLQIEISA-N 1 2 227.329 2.016 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC[C@@H]2c2ccccn2)o1 ZINC000516161944 387475897 /nfs/dbraw/zinc/47/58/97/387475897.db2.gz JHHKVSSOSAQGAO-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1nnc(C[N@H+]2CCC[C@@H]2c2ccccn2)o1 ZINC000516161944 387475901 /nfs/dbraw/zinc/47/59/01/387475901.db2.gz JHHKVSSOSAQGAO-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO COC(=O)[C@H](CC(F)F)[NH2+]CC1CCCCC1 ZINC000355083381 387478469 /nfs/dbraw/zinc/47/84/69/387478469.db2.gz WKNCCULJHNGJRE-JTQLQIEISA-N 1 2 249.301 2.353 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)C1(C)CCCCC1 ZINC000548361696 387487950 /nfs/dbraw/zinc/48/79/50/387487950.db2.gz FSTDHYVKZZNRDS-LBPRGKRZSA-N 1 2 249.358 2.358 20 0 BEADLO CC(C)(C)C1CC(NC(=O)CCn2cc[nH+]c2)C1 ZINC000356001197 387602637 /nfs/dbraw/zinc/60/26/37/387602637.db2.gz BBXYRWMGIVYYJM-UHFFFAOYSA-N 1 2 249.358 2.214 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3ncsc3C2)ccn1 ZINC000527538581 387607034 /nfs/dbraw/zinc/60/70/34/387607034.db2.gz LTPVTIDCBBSODE-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cc(C[N@H+]2CCc3ncsc3C2)ccn1 ZINC000527538581 387607036 /nfs/dbraw/zinc/60/70/36/387607036.db2.gz LTPVTIDCBBSODE-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO CCC1(C(=O)N[C@@H](C)Cn2cc[nH+]c2)CCCC1 ZINC000362507058 387621734 /nfs/dbraw/zinc/62/17/34/387621734.db2.gz OUVMGDXHEHBEKK-LBPRGKRZSA-N 1 2 249.358 2.358 20 0 BEADLO C[C@@H]1C[C@H]1CC(=O)N(C)c1ccc[nH+]c1N(C)C ZINC000361882577 387549431 /nfs/dbraw/zinc/54/94/31/387549431.db2.gz IVZBEHJVSKRDHQ-MNOVXSKESA-N 1 2 247.342 2.157 20 0 BEADLO OCC[C@@H]1CCC[N@@H+]1Cc1ncc(Cl)s1 ZINC000426251176 387549953 /nfs/dbraw/zinc/54/99/53/387549953.db2.gz JTFCZYAHRRUPHP-QMMMGPOBSA-N 1 2 246.763 2.143 20 0 BEADLO OCC[C@@H]1CCC[N@H+]1Cc1ncc(Cl)s1 ZINC000426251176 387549955 /nfs/dbraw/zinc/54/99/55/387549955.db2.gz JTFCZYAHRRUPHP-QMMMGPOBSA-N 1 2 246.763 2.143 20 0 BEADLO C[C@H]([NH2+]Cc1ccco1)c1nnc2ccccn21 ZINC000035044251 387551720 /nfs/dbraw/zinc/55/17/20/387551720.db2.gz OMLWXCQZPFNWMI-JTQLQIEISA-N 1 2 242.282 2.173 20 0 BEADLO CCc1cc(N)nc(SCCCSC)[nH+]1 ZINC000279143872 387561044 /nfs/dbraw/zinc/56/10/44/387561044.db2.gz YSAYYOBZHHSOTH-UHFFFAOYSA-N 1 2 243.401 2.466 20 0 BEADLO COC(=O)[C@@H](C)[NH2+]C/C(C)=C\c1ccccc1 ZINC000355664715 387565145 /nfs/dbraw/zinc/56/51/45/387565145.db2.gz VLELLKMPGBILOX-UCQJPZFISA-N 1 2 233.311 2.241 20 0 BEADLO CCCn1ncnc1C[N@@H+]1CCCC2(CC2)C1 ZINC000375668867 387565850 /nfs/dbraw/zinc/56/58/50/387565850.db2.gz LIZKBSYWTAUSGY-UHFFFAOYSA-N 1 2 234.347 2.064 20 0 BEADLO CCCn1ncnc1C[N@H+]1CCCC2(CC2)C1 ZINC000375668867 387565856 /nfs/dbraw/zinc/56/58/56/387565856.db2.gz LIZKBSYWTAUSGY-UHFFFAOYSA-N 1 2 234.347 2.064 20 0 BEADLO CC[C@H](Nc1ncc(Cl)cn1)c1[nH]cc[nH+]1 ZINC000125225571 387648814 /nfs/dbraw/zinc/64/88/14/387648814.db2.gz WUPXWDJFMZMGDP-QMMMGPOBSA-N 1 2 237.694 2.416 20 0 BEADLO COC1(CNc2cc[nH+]cc2F)CCCCC1 ZINC000362793012 387660221 /nfs/dbraw/zinc/66/02/21/387660221.db2.gz CBCUFCINDJRERV-UHFFFAOYSA-N 1 2 238.306 2.404 20 0 BEADLO CCCc1nc(C[N@H+]2[C@H](C)CC[C@@H]2C)no1 ZINC000123244693 387669959 /nfs/dbraw/zinc/66/99/59/387669959.db2.gz GRUWYNYUSKOEHR-AOOOYVTPSA-N 1 2 223.320 2.395 20 0 BEADLO CCCc1nc(C[N@@H+]2[C@H](C)CC[C@@H]2C)no1 ZINC000123244693 387669963 /nfs/dbraw/zinc/66/99/63/387669963.db2.gz GRUWYNYUSKOEHR-AOOOYVTPSA-N 1 2 223.320 2.395 20 0 BEADLO Cc1nc(-c2cccc(-n3cc[nH+]c3)c2)no1 ZINC000356593262 387679486 /nfs/dbraw/zinc/67/94/86/387679486.db2.gz MTEKZFOKTLDPOF-UHFFFAOYSA-N 1 2 226.239 2.231 20 0 BEADLO C[C@@H](CC(C)(C)C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000356593590 387680033 /nfs/dbraw/zinc/68/00/33/387680033.db2.gz JDUHRCGIRRMYPO-JTQLQIEISA-N 1 2 237.347 2.440 20 0 BEADLO COC1(CNc2c[nH]c[nH+]2)CCCCC1 ZINC000380359866 387688173 /nfs/dbraw/zinc/68/81/73/387688173.db2.gz XWIYSSSPAAMKIK-UHFFFAOYSA-N 1 2 209.293 2.171 20 0 BEADLO CCC[C@@H]1C[N@H+](C[C@H](F)CC)CCO1 ZINC000440771599 387690992 /nfs/dbraw/zinc/69/09/92/387690992.db2.gz RLCONZCVPIFULB-GHMZBOCLSA-N 1 2 203.301 2.235 20 0 BEADLO CCC[C@@H]1C[N@@H+](C[C@H](F)CC)CCO1 ZINC000440771599 387690996 /nfs/dbraw/zinc/69/09/96/387690996.db2.gz RLCONZCVPIFULB-GHMZBOCLSA-N 1 2 203.301 2.235 20 0 BEADLO CC(C)(C)C(C)(C)C(=O)NCCn1cc[nH+]c1 ZINC000432007138 387744495 /nfs/dbraw/zinc/74/44/95/387744495.db2.gz OCCSSCRTKWXPFU-UHFFFAOYSA-N 1 2 237.347 2.072 20 0 BEADLO C[C@@H]1CN(c2[nH+]ccc3ccccc32)CCO1 ZINC000527834311 387749114 /nfs/dbraw/zinc/74/91/14/387749114.db2.gz NUHGQYIOEFZYGU-LLVKDONJSA-N 1 2 228.295 2.460 20 0 BEADLO CCCCN(CC)C(=O)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000377781537 387750519 /nfs/dbraw/zinc/75/05/19/387750519.db2.gz NJIXCJQDUFGKHA-LLVKDONJSA-N 1 2 249.358 2.478 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)Nc1ccc(N)[nH+]c1 ZINC000422794319 387696954 /nfs/dbraw/zinc/69/69/54/387696954.db2.gz UCZBSDOVSFPFPV-IUCAKERBSA-N 1 2 221.304 2.115 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2nccs2)C1 ZINC000306784361 387711482 /nfs/dbraw/zinc/71/14/82/387711482.db2.gz HQIYHDZEGPRZIV-SECBINFHSA-N 1 2 200.282 2.077 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2nccs2)C1 ZINC000306784361 387711488 /nfs/dbraw/zinc/71/14/88/387711488.db2.gz HQIYHDZEGPRZIV-SECBINFHSA-N 1 2 200.282 2.077 20 0 BEADLO COc1ccc(COc2cc[nH+]cc2)cn1 ZINC000431512838 387713643 /nfs/dbraw/zinc/71/36/43/387713643.db2.gz INJIFTILNXKGAD-UHFFFAOYSA-N 1 2 216.240 2.064 20 0 BEADLO CC(C)n1cnnc1C[N@H+](C)CC1=CCCC1 ZINC000645922152 387772895 /nfs/dbraw/zinc/77/28/95/387772895.db2.gz FZUADNASVNDPTC-UHFFFAOYSA-N 1 2 234.347 2.401 20 0 BEADLO CC(C)n1cnnc1C[N@@H+](C)CC1=CCCC1 ZINC000645922152 387772899 /nfs/dbraw/zinc/77/28/99/387772899.db2.gz FZUADNASVNDPTC-UHFFFAOYSA-N 1 2 234.347 2.401 20 0 BEADLO CC[C@H](C)[C@@](C)(O)CNc1[nH+]cccc1OC ZINC000527892889 387776285 /nfs/dbraw/zinc/77/62/85/387776285.db2.gz LSVWXTZQWAOWDH-GWCFXTLKSA-N 1 2 238.331 2.299 20 0 BEADLO CC[C@H](C)[C@](C)(O)CNc1[nH+]cccc1OC ZINC000527892902 387776381 /nfs/dbraw/zinc/77/63/81/387776381.db2.gz LSVWXTZQWAOWDH-GXFFZTMASA-N 1 2 238.331 2.299 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CC2CCC1CC2 ZINC000378388099 387781181 /nfs/dbraw/zinc/78/11/81/387781181.db2.gz GTNHIRNXPCFJLY-UHFFFAOYSA-N 1 2 245.326 2.218 20 0 BEADLO CO[C@H](CSCCn1cc[nH+]c1)C1CC1 ZINC000424148642 387786861 /nfs/dbraw/zinc/78/68/61/387786861.db2.gz FSCUMFCPAHWGOY-LLVKDONJSA-N 1 2 226.345 2.041 20 0 BEADLO C[N@H+](CCC(F)(F)F)Cc1cocn1 ZINC000432736847 387812756 /nfs/dbraw/zinc/81/27/56/387812756.db2.gz HCSSZKDUEOWTMV-UHFFFAOYSA-N 1 2 208.183 2.059 20 0 BEADLO C[N@@H+](CCC(F)(F)F)Cc1cocn1 ZINC000432736847 387812758 /nfs/dbraw/zinc/81/27/58/387812758.db2.gz HCSSZKDUEOWTMV-UHFFFAOYSA-N 1 2 208.183 2.059 20 0 BEADLO CC(C)(C)OC1CC[NH+](Cc2cocn2)CC1 ZINC000432742144 387812919 /nfs/dbraw/zinc/81/29/19/387812919.db2.gz QMZXVWPJOZARLC-UHFFFAOYSA-N 1 2 238.331 2.454 20 0 BEADLO CC1(C)C[C@H]1C(=O)Nc1c[nH+]c2n1CCCC2 ZINC000452331228 387804726 /nfs/dbraw/zinc/80/47/26/387804726.db2.gz CTHRRGZFFNTAGF-VIFPVBQESA-N 1 2 233.315 2.204 20 0 BEADLO COc1ccc[nH+]c1N1C[C@@H](C2CC2)O[C@@H](C)C1 ZINC000527995866 387805521 /nfs/dbraw/zinc/80/55/21/387805521.db2.gz VPCYGRPXPSUWFK-GWCFXTLKSA-N 1 2 248.326 2.094 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CCO[C@H](C2CC2)C1 ZINC000527961066 387809391 /nfs/dbraw/zinc/80/93/91/387809391.db2.gz AUTIIUXXSLKLKA-AAEUAGOBSA-N 1 2 248.326 2.460 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1CCOC[C@H]1C ZINC000528018735 387825207 /nfs/dbraw/zinc/82/52/07/387825207.db2.gz KJWGVVOXCMOTOB-GHMZBOCLSA-N 1 2 236.315 2.175 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1C[C@@H]1C(F)F ZINC000528021423 387826676 /nfs/dbraw/zinc/82/66/76/387826676.db2.gz NLBZWUAQAAGGQH-BQBZGAKWSA-N 1 2 214.215 2.156 20 0 BEADLO CC[C@H](NC(=O)CCc1ccoc1)c1[nH]cc[nH+]1 ZINC000442794101 387841264 /nfs/dbraw/zinc/84/12/64/387841264.db2.gz CLLAMMGZAKCJDO-NSHDSACASA-N 1 2 247.298 2.203 20 0 BEADLO c1nc(C[N@H+]2CCC[C@@H](OCC3CC3)C2)co1 ZINC000432923011 387841326 /nfs/dbraw/zinc/84/13/26/387841326.db2.gz CPRRXOVSFWRPTH-CYBMUJFWSA-N 1 2 236.315 2.066 20 0 BEADLO c1nc(C[N@@H+]2CCC[C@@H](OCC3CC3)C2)co1 ZINC000432923011 387841329 /nfs/dbraw/zinc/84/13/29/387841329.db2.gz CPRRXOVSFWRPTH-CYBMUJFWSA-N 1 2 236.315 2.066 20 0 BEADLO c1cc(NCC[C@@H]2CCCOC2)nc(C2CC2)[nH+]1 ZINC000528073853 387843097 /nfs/dbraw/zinc/84/30/97/387843097.db2.gz ODUSMTOTRCCJBM-NSHDSACASA-N 1 2 247.342 2.005 20 0 BEADLO CC[C@H]1CCC[C@H]1CNC(=O)c1c[nH+]c(C)[nH]1 ZINC000452531384 387850573 /nfs/dbraw/zinc/85/05/73/387850573.db2.gz QLOVILFJUKSFHZ-QWRGUYRKSA-N 1 2 235.331 2.274 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1CCC[C@H]2OCC[C@@H]21 ZINC000582576399 387852510 /nfs/dbraw/zinc/85/25/10/387852510.db2.gz LZGIGRZQNDTOLH-JHJVBQTASA-N 1 2 247.342 2.463 20 0 BEADLO CC[C@](C)([NH2+][C@@H]1C=CCCC1)C(=O)OC ZINC000293134709 387864430 /nfs/dbraw/zinc/86/44/30/387864430.db2.gz LMLZFVXWYIGQJE-PWSUYJOCSA-N 1 2 211.305 2.026 20 0 BEADLO CCc1nc(CNc2cccc(CO)[nH+]2)cs1 ZINC000432755330 387815637 /nfs/dbraw/zinc/81/56/37/387815637.db2.gz BRZHKOXMHYYSEG-UHFFFAOYSA-N 1 2 249.339 2.205 20 0 BEADLO C[C@H](N[C@@H](C)c1ncccc1F)c1[nH+]ccn1C ZINC000528036412 387817218 /nfs/dbraw/zinc/81/72/18/387817218.db2.gz RLXLJXZXQNCROL-UWVGGRQHSA-N 1 2 248.305 2.366 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ncccc1F)c1ccnn1C ZINC000528036850 387818107 /nfs/dbraw/zinc/81/81/07/387818107.db2.gz YVEGYVZDXYCSIN-ZJUUUORDSA-N 1 2 248.305 2.366 20 0 BEADLO COc1ccnc(C[NH2+]Cc2ccsc2C)n1 ZINC000424183686 387897329 /nfs/dbraw/zinc/89/73/29/387897329.db2.gz BWRYWZBOMYMILR-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO Cc1cc(N2CC(C(C)(C)O)C2)nc(C(C)C)[nH+]1 ZINC000443984154 387878657 /nfs/dbraw/zinc/87/86/57/387878657.db2.gz FDEGIPZRIHELQH-UHFFFAOYSA-N 1 2 249.358 2.116 20 0 BEADLO Cc1cc[nH+]c(NCC2COC2)c1Cl ZINC000528226024 387882500 /nfs/dbraw/zinc/88/25/00/387882500.db2.gz MEXSSCSKKHERTP-UHFFFAOYSA-N 1 2 212.680 2.102 20 0 BEADLO FC(F)(F)c1cc[nH+]c(NCC2COC2)c1 ZINC000528225724 387883042 /nfs/dbraw/zinc/88/30/42/387883042.db2.gz KFAFRENWMQYYGW-UHFFFAOYSA-N 1 2 232.205 2.159 20 0 BEADLO CC[C@@H]1C[N@H+](C/C=C(/C)Cl)CCO1 ZINC000528354223 387907857 /nfs/dbraw/zinc/90/78/57/387907857.db2.gz WKCCHFAAEPRQLY-ZUYFITGHSA-N 1 2 203.713 2.240 20 0 BEADLO CC[C@@H]1C[N@@H+](C/C=C(/C)Cl)CCO1 ZINC000528354223 387907862 /nfs/dbraw/zinc/90/78/62/387907862.db2.gz WKCCHFAAEPRQLY-ZUYFITGHSA-N 1 2 203.713 2.240 20 0 BEADLO CC[N@H+](CCOC)Cc1ncccc1Cl ZINC000528356270 387908861 /nfs/dbraw/zinc/90/88/61/387908861.db2.gz FSRBSGMPCKPAPD-UHFFFAOYSA-N 1 2 228.723 2.203 20 0 BEADLO CC[N@@H+](CCOC)Cc1ncccc1Cl ZINC000528356270 387908867 /nfs/dbraw/zinc/90/88/67/387908867.db2.gz FSRBSGMPCKPAPD-UHFFFAOYSA-N 1 2 228.723 2.203 20 0 BEADLO Cc1cn[nH]c1C[NH2+][C@H]1C[C@]1(F)c1ccccc1 ZINC000424189452 387912199 /nfs/dbraw/zinc/91/21/99/387912199.db2.gz DQFXZSQAQMZLIN-KBPBESRZSA-N 1 2 245.301 2.445 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@H]1C[C@]1(F)c1ccccc1 ZINC000424189452 387912201 /nfs/dbraw/zinc/91/22/01/387912201.db2.gz DQFXZSQAQMZLIN-KBPBESRZSA-N 1 2 245.301 2.445 20 0 BEADLO CO[C@@H]1CCN(c2cc(C(F)(F)F)cc[nH+]2)C1 ZINC000238920735 387936360 /nfs/dbraw/zinc/93/63/60/387936360.db2.gz TUYQEXUJGYGFII-SECBINFHSA-N 1 2 246.232 2.326 20 0 BEADLO Fc1cccnc1NCc1cccc2[nH+]ccn21 ZINC000195310866 387920609 /nfs/dbraw/zinc/92/06/09/387920609.db2.gz QYXBMYSVPGIXEF-UHFFFAOYSA-N 1 2 242.257 2.481 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nccs2)[C@@H](C)[C@H](C)O1 ZINC000438359283 387929086 /nfs/dbraw/zinc/92/90/86/387929086.db2.gz PWNLTDVLWSVYAD-UTLUCORTSA-N 1 2 226.345 2.141 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nccs2)[C@@H](C)[C@H](C)O1 ZINC000438359283 387929090 /nfs/dbraw/zinc/92/90/90/387929090.db2.gz PWNLTDVLWSVYAD-UTLUCORTSA-N 1 2 226.345 2.141 20 0 BEADLO C[C@H](c1ccccc1)[C@@H](O)C[N@H+](C)CC(F)F ZINC000450352231 387955794 /nfs/dbraw/zinc/95/57/94/387955794.db2.gz BNZWXUAVUZKOFP-PWSUYJOCSA-N 1 2 243.297 2.348 20 0 BEADLO C[C@H](c1ccccc1)[C@@H](O)C[N@@H+](C)CC(F)F ZINC000450352231 387955796 /nfs/dbraw/zinc/95/57/96/387955796.db2.gz BNZWXUAVUZKOFP-PWSUYJOCSA-N 1 2 243.297 2.348 20 0 BEADLO COCCOC1C[NH+](C/C=C/c2ccccc2)C1 ZINC000459454629 387942842 /nfs/dbraw/zinc/94/28/42/387942842.db2.gz DSDTYPNZFPSBKL-VMPITWQZSA-N 1 2 247.338 2.047 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)[C@@H]1CCn2cc[nH+]c2C1 ZINC000438578414 387945215 /nfs/dbraw/zinc/94/52/15/387945215.db2.gz WLZDZJAMRHMQSX-VXGBXAGGSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1nc(N2CCC[C@@H]([C@@H]3CCOC3)C2)cc[nH+]1 ZINC000439073511 387977760 /nfs/dbraw/zinc/97/77/60/387977760.db2.gz CPUKMSPBMIBMRC-CHWSQXEVSA-N 1 2 247.342 2.038 20 0 BEADLO Cc1cc(N2CCC[C@H]([C@H]3CCOC3)C2)nc[nH+]1 ZINC000439082640 387978170 /nfs/dbraw/zinc/97/81/70/387978170.db2.gz DRXJBEFFUAMATM-STQMWFEESA-N 1 2 247.342 2.038 20 0 BEADLO CCc1nc(C[NH2+][C@H](C)c2cnccn2)cs1 ZINC000156432840 387978341 /nfs/dbraw/zinc/97/83/41/387978341.db2.gz ZTWOLFGVPMFAQK-SECBINFHSA-N 1 2 248.355 2.346 20 0 BEADLO CC[C@@H]([NH2+][C@@H](C)C(F)(F)F)[C@H]1CCOC1 ZINC000424334660 387978362 /nfs/dbraw/zinc/97/83/62/387978362.db2.gz YXRRZJRIKGWTKO-XHNCKOQMSA-N 1 2 225.254 2.342 20 0 BEADLO CCc1nc(C[NH2+][C@H](C)CF)cs1 ZINC000308471504 135070347 /nfs/dbraw/zinc/07/03/47/135070347.db2.gz KQTJUFGMSDVPFK-SSDOTTSWSA-N 1 2 202.298 2.153 20 0 BEADLO COC[C@H](Nc1ccc2c(c1)CC[NH2+]2)C1CC1 ZINC000423213626 387997995 /nfs/dbraw/zinc/99/79/95/387997995.db2.gz KEEFGEFPHVLNQN-AWEZNQCLSA-N 1 2 232.327 2.492 20 0 BEADLO C[C@@H](Cn1cccn1)Nc1ccc2c(c1)CC[NH2+]2 ZINC000423215816 387996730 /nfs/dbraw/zinc/99/67/30/387996730.db2.gz NOCMDEGTYUNCQH-NSHDSACASA-N 1 2 242.326 2.352 20 0 BEADLO Cc1nc(N2CCC(OCC3CC3)CC2)cc[nH+]1 ZINC000439701473 388013071 /nfs/dbraw/zinc/01/30/71/388013071.db2.gz XLRHCKVDMGBZHE-UHFFFAOYSA-N 1 2 247.342 2.180 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H](C)c2ccccc2)c[nH+]1 ZINC000082268182 388020387 /nfs/dbraw/zinc/02/03/87/388020387.db2.gz PKLQWPMPADPZDI-VIFPVBQESA-N 1 2 229.283 2.209 20 0 BEADLO CC[C@H](F)CN1CC[NH+](C[C@@H](F)CC)CC1 ZINC000440694986 388068898 /nfs/dbraw/zinc/06/88/98/388068898.db2.gz SIJJBQHKLMWWSK-RYUDHWBXSA-N 1 2 234.334 2.100 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1ccnc(C)c1 ZINC000447441427 388072543 /nfs/dbraw/zinc/07/25/43/388072543.db2.gz PYUOWBMUZKGFRV-UHFFFAOYSA-N 1 2 243.266 2.046 20 0 BEADLO Cn1c[nH+]cc1CNc1cc(F)ccc1F ZINC000085167678 388084769 /nfs/dbraw/zinc/08/47/69/388084769.db2.gz XJWJQWFDUMFXEY-UHFFFAOYSA-N 1 2 223.226 2.310 20 0 BEADLO Cc1cc(C)c(CNC(=O)NCC(C)C)c[nH+]1 ZINC000454133813 388100848 /nfs/dbraw/zinc/10/08/48/388100848.db2.gz HSCVWRSEOFRUJT-UHFFFAOYSA-N 1 2 235.331 2.154 20 0 BEADLO C[C@H]1CCC[C@@H](C[N@H+]2CC(=O)N(C3CC3)C2)C1 ZINC000447923065 388103273 /nfs/dbraw/zinc/10/32/73/388103273.db2.gz RBOILDXFDMYLKI-NWDGAFQWSA-N 1 2 236.359 2.077 20 0 BEADLO C[C@H]1CCC[C@@H](C[N@@H+]2CC(=O)N(C3CC3)C2)C1 ZINC000447923065 388103274 /nfs/dbraw/zinc/10/32/74/388103274.db2.gz RBOILDXFDMYLKI-NWDGAFQWSA-N 1 2 236.359 2.077 20 0 BEADLO C[C@H]1CCC[C@H](C[N@H+]2CC(=O)N(C3CC3)C2)C1 ZINC000447923066 388103647 /nfs/dbraw/zinc/10/36/47/388103647.db2.gz RBOILDXFDMYLKI-RYUDHWBXSA-N 1 2 236.359 2.077 20 0 BEADLO C[C@H]1CCC[C@H](C[N@@H+]2CC(=O)N(C3CC3)C2)C1 ZINC000447923066 388103651 /nfs/dbraw/zinc/10/36/51/388103651.db2.gz RBOILDXFDMYLKI-RYUDHWBXSA-N 1 2 236.359 2.077 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)Nc1ccc[nH+]c1N(C)C ZINC000448769618 388109666 /nfs/dbraw/zinc/10/96/66/388109666.db2.gz HOSBYNXTOUGSEV-NXEZZACHSA-N 1 2 233.315 2.132 20 0 BEADLO CCOc1ccc(C[N@@H+]2CC[C@H](F)C2)nc1 ZINC000648720660 388157745 /nfs/dbraw/zinc/15/77/45/388157745.db2.gz HLVFLTDIGQRXHZ-JTQLQIEISA-N 1 2 224.279 2.024 20 0 BEADLO CCOc1ccc(C[N@H+]2CC[C@H](F)C2)nc1 ZINC000648720660 388157746 /nfs/dbraw/zinc/15/77/46/388157746.db2.gz HLVFLTDIGQRXHZ-JTQLQIEISA-N 1 2 224.279 2.024 20 0 BEADLO Cc1sccc1C[N@@H+]1CCO[C@@H]2C[C@@H]21 ZINC000646206789 388164334 /nfs/dbraw/zinc/16/43/34/388164334.db2.gz UDQMLHFLKONCCC-WDEREUQCSA-N 1 2 209.314 2.030 20 0 BEADLO Cc1sccc1C[N@H+]1CCO[C@@H]2C[C@@H]21 ZINC000646206789 388164335 /nfs/dbraw/zinc/16/43/35/388164335.db2.gz UDQMLHFLKONCCC-WDEREUQCSA-N 1 2 209.314 2.030 20 0 BEADLO C[C@H](c1ccccc1)[N@H+](C)Cc1nncn1C ZINC000195513962 388165683 /nfs/dbraw/zinc/16/56/83/388165683.db2.gz JRXRUIICFKCABB-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1ccccc1)[N@@H+](C)Cc1nncn1C ZINC000195513962 388165686 /nfs/dbraw/zinc/16/56/86/388165686.db2.gz JRXRUIICFKCABB-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO CC1(C)CC=C(C(=O)Nc2cc[nH+]cc2O)CC1 ZINC000456002913 388171567 /nfs/dbraw/zinc/17/15/67/388171567.db2.gz NRRLDGVAMUVIRY-UHFFFAOYSA-N 1 2 246.310 2.284 20 0 BEADLO C[C@@H]1C[C@@H]1CNc1ccc(N2CCCC2)c[nH+]1 ZINC000488446619 388179522 /nfs/dbraw/zinc/17/95/22/388179522.db2.gz UOHDZSQTPZUELS-VXGBXAGGSA-N 1 2 231.343 2.172 20 0 BEADLO C[C@H]1C[C@@H]1CNc1ccc(N2CCCC2)c[nH+]1 ZINC000488446617 388179796 /nfs/dbraw/zinc/17/97/96/388179796.db2.gz UOHDZSQTPZUELS-NWDGAFQWSA-N 1 2 231.343 2.172 20 0 BEADLO COc1cccc(C[N@@H+]2CCO[C@H](C)C2)c1F ZINC000192938246 388182820 /nfs/dbraw/zinc/18/28/20/388182820.db2.gz YNRFFKZOCCSRRA-SNVBAGLBSA-N 1 2 239.290 2.055 20 0 BEADLO COc1cccc(C[N@H+]2CCO[C@H](C)C2)c1F ZINC000192938246 388182821 /nfs/dbraw/zinc/18/28/21/388182821.db2.gz YNRFFKZOCCSRRA-SNVBAGLBSA-N 1 2 239.290 2.055 20 0 BEADLO CC[C@@H](NCc1cccc2[nH+]ccn21)C(F)F ZINC000449366230 388182972 /nfs/dbraw/zinc/18/29/72/388182972.db2.gz YCVIWTQBJYKEFR-SNVBAGLBSA-N 1 2 239.269 2.468 20 0 BEADLO CC[C@H]1CCC[C@@H]1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000448937799 388121484 /nfs/dbraw/zinc/12/14/84/388121484.db2.gz RJRHQAVLEDSKCO-QWRGUYRKSA-N 1 2 235.331 2.194 20 0 BEADLO CCC[C@@H]1CCC[C@H]1C(=O)NCCc1[nH]cc[nH+]1 ZINC000448955945 388122776 /nfs/dbraw/zinc/12/27/76/388122776.db2.gz YGQSFDDNQUTROV-VXGBXAGGSA-N 1 2 249.358 2.285 20 0 BEADLO COC(=O)C[N@H+](CCc1cccc(C)c1)C1CC1 ZINC000449052239 388136008 /nfs/dbraw/zinc/13/60/08/388136008.db2.gz YTLKNZCUKXMTMO-UHFFFAOYSA-N 1 2 247.338 2.175 20 0 BEADLO COC(=O)C[N@@H+](CCc1cccc(C)c1)C1CC1 ZINC000449052239 388136010 /nfs/dbraw/zinc/13/60/10/388136010.db2.gz YTLKNZCUKXMTMO-UHFFFAOYSA-N 1 2 247.338 2.175 20 0 BEADLO COc1ccc(F)c(C[N@H+](C)Cc2cn[nH]c2)c1 ZINC000646087717 388139365 /nfs/dbraw/zinc/13/93/65/388139365.db2.gz RBDGXFCQVPGRHC-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO COc1ccc(F)c(C[N@@H+](C)Cc2cn[nH]c2)c1 ZINC000646087717 388139366 /nfs/dbraw/zinc/13/93/66/388139366.db2.gz RBDGXFCQVPGRHC-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccon2)CC2(CCCC2)O1 ZINC000646133539 388151502 /nfs/dbraw/zinc/15/15/02/388151502.db2.gz WKTHSWNKKGNSGZ-LLVKDONJSA-N 1 2 236.315 2.208 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccon2)CC2(CCCC2)O1 ZINC000646133539 388151504 /nfs/dbraw/zinc/15/15/04/388151504.db2.gz WKTHSWNKKGNSGZ-LLVKDONJSA-N 1 2 236.315 2.208 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ncccn2)CC2(CCCC2)O1 ZINC000646135296 388152078 /nfs/dbraw/zinc/15/20/78/388152078.db2.gz IPYHVAGZZBLQAW-GFCCVEGCSA-N 1 2 247.342 2.010 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ncccn2)CC2(CCCC2)O1 ZINC000646135296 388152081 /nfs/dbraw/zinc/15/20/81/388152081.db2.gz IPYHVAGZZBLQAW-GFCCVEGCSA-N 1 2 247.342 2.010 20 0 BEADLO C[C@H]1C[N@H+](Cc2ncccn2)CC2(CCCC2)O1 ZINC000646135297 388152564 /nfs/dbraw/zinc/15/25/64/388152564.db2.gz IPYHVAGZZBLQAW-LBPRGKRZSA-N 1 2 247.342 2.010 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ncccn2)CC2(CCCC2)O1 ZINC000646135297 388152566 /nfs/dbraw/zinc/15/25/66/388152566.db2.gz IPYHVAGZZBLQAW-LBPRGKRZSA-N 1 2 247.342 2.010 20 0 BEADLO Cc1ccc(N[C@@H](C)[C@@H]2CCOC2)c[nH+]1 ZINC000162931305 388254692 /nfs/dbraw/zinc/25/46/92/388254692.db2.gz VDRIBUMYDMWKEJ-WDEREUQCSA-N 1 2 206.289 2.227 20 0 BEADLO Cc1ccoc1CNc1[nH+]c(C)nc2[nH]ccc21 ZINC000488676554 388191420 /nfs/dbraw/zinc/19/14/20/388191420.db2.gz PJUACJUMXIAPEG-UHFFFAOYSA-N 1 2 242.282 2.202 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)C[C@@H]1C[C@H]1C ZINC000456350481 388196448 /nfs/dbraw/zinc/19/64/48/388196448.db2.gz KBUQQABCTHJMNO-VWYCJHECSA-N 1 2 235.331 2.126 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)CC1CCC1 ZINC000456349899 388197074 /nfs/dbraw/zinc/19/70/74/388197074.db2.gz JOMIUHSHTWTTEP-SNVBAGLBSA-N 1 2 235.331 2.270 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)C[C@H]2C=CCC2)c2[nH+]ccn21 ZINC000456372332 388197644 /nfs/dbraw/zinc/19/76/44/388197644.db2.gz IUUNZPRFNGUZTD-GRYCIOLGSA-N 1 2 245.326 2.361 20 0 BEADLO CCCCC(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456407912 388199473 /nfs/dbraw/zinc/19/94/73/388199473.db2.gz YWEWUJRULVZUCW-UWVGGRQHSA-N 1 2 221.304 2.195 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)[C@@H]2CC2(C)C)c2[nH+]ccn21 ZINC000456421010 388200330 /nfs/dbraw/zinc/20/03/30/388200330.db2.gz NARHJNRFAJWCPB-UTLUCORTSA-N 1 2 233.315 2.051 20 0 BEADLO C[C@H](C(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21)C1CC1 ZINC000456422308 388200340 /nfs/dbraw/zinc/20/03/40/388200340.db2.gz OCFYNAFLLNYOGK-YWVKMMECSA-N 1 2 233.315 2.051 20 0 BEADLO C[N@H+](Cc1ncc(Cl)s1)CC(C)(C)CO ZINC000449423506 388201776 /nfs/dbraw/zinc/20/17/76/388201776.db2.gz NXYNAONTPNHUCN-UHFFFAOYSA-N 1 2 248.779 2.247 20 0 BEADLO C[N@@H+](Cc1ncc(Cl)s1)CC(C)(C)CO ZINC000449423506 388201780 /nfs/dbraw/zinc/20/17/80/388201780.db2.gz NXYNAONTPNHUCN-UHFFFAOYSA-N 1 2 248.779 2.247 20 0 BEADLO CC[N@H+](Cc1ccccc1F)C1COC1 ZINC000449427300 388201823 /nfs/dbraw/zinc/20/18/23/388201823.db2.gz RMVLPNXDFWVXKG-UHFFFAOYSA-N 1 2 209.264 2.046 20 0 BEADLO CC[N@@H+](Cc1ccccc1F)C1COC1 ZINC000449427300 388201826 /nfs/dbraw/zinc/20/18/26/388201826.db2.gz RMVLPNXDFWVXKG-UHFFFAOYSA-N 1 2 209.264 2.046 20 0 BEADLO CC[N@H+](Cc1cc(C)ccc1F)C1COC1 ZINC000449429589 388203767 /nfs/dbraw/zinc/20/37/67/388203767.db2.gz XEXCUIRSRZTCCQ-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO CC[N@@H+](Cc1cc(C)ccc1F)C1COC1 ZINC000449429589 388203769 /nfs/dbraw/zinc/20/37/69/388203769.db2.gz XEXCUIRSRZTCCQ-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO COc1cc[nH+]cc1NCc1cncc(F)c1 ZINC000489759126 388224543 /nfs/dbraw/zinc/22/45/43/388224543.db2.gz ONSNZBYHWZOWFW-UHFFFAOYSA-N 1 2 233.246 2.236 20 0 BEADLO Cc1cc(C)c(CNC(=O)[C@@H]2CC2(C)C)c[nH+]1 ZINC000456851642 388226931 /nfs/dbraw/zinc/22/69/31/388226931.db2.gz WUOAUTCFPQLMGV-LBPRGKRZSA-N 1 2 232.327 2.361 20 0 BEADLO FC(F)(F)[C@H]([NH2+][C@@H]1CCCOCC1)C1CC1 ZINC000336661862 388259783 /nfs/dbraw/zinc/25/97/83/388259783.db2.gz CTIPWSIXXIPCRO-NXEZZACHSA-N 1 2 237.265 2.486 20 0 BEADLO CC[C@H](CC(C)C)C(=O)NCCn1cc[nH+]c1 ZINC000449574225 388237079 /nfs/dbraw/zinc/23/70/79/388237079.db2.gz TZIUWRYRYSDRDD-GFCCVEGCSA-N 1 2 237.347 2.072 20 0 BEADLO CO[C@@H]1C[C@@H]([N@H+](C)Cc2cn[nH]c2C)C12CCC2 ZINC000449637163 388246816 /nfs/dbraw/zinc/24/68/16/388246816.db2.gz YITMKWLEFOAKBB-CHWSQXEVSA-N 1 2 249.358 2.108 20 0 BEADLO CO[C@@H]1C[C@@H]([N@@H+](C)Cc2cn[nH]c2C)C12CCC2 ZINC000449637163 388246817 /nfs/dbraw/zinc/24/68/17/388246817.db2.gz YITMKWLEFOAKBB-CHWSQXEVSA-N 1 2 249.358 2.108 20 0 BEADLO CO[C@@H]1C[C@H]([N@H+](C)Cc2cn[nH]c2C)C12CCC2 ZINC000449637165 388247198 /nfs/dbraw/zinc/24/71/98/388247198.db2.gz YITMKWLEFOAKBB-QWHCGFSZSA-N 1 2 249.358 2.108 20 0 BEADLO CO[C@@H]1C[C@H]([N@@H+](C)Cc2cn[nH]c2C)C12CCC2 ZINC000449637165 388247200 /nfs/dbraw/zinc/24/72/00/388247200.db2.gz YITMKWLEFOAKBB-QWHCGFSZSA-N 1 2 249.358 2.108 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)N[C@H](c1[nH+]ccn1C)C1CC1 ZINC000451679072 388289096 /nfs/dbraw/zinc/28/90/96/388289096.db2.gz GHYRXRWRDSGBLQ-JLLWLGSASA-N 1 2 247.342 2.034 20 0 BEADLO CCCCC[N@@H+](CC(F)F)C[C@@H](C)O ZINC000451853083 388301073 /nfs/dbraw/zinc/30/10/73/388301073.db2.gz OBWDHQFFBDILMK-SECBINFHSA-N 1 2 209.280 2.125 20 0 BEADLO CCCCC[N@H+](CC(F)F)C[C@@H](C)O ZINC000451853083 388301074 /nfs/dbraw/zinc/30/10/74/388301074.db2.gz OBWDHQFFBDILMK-SECBINFHSA-N 1 2 209.280 2.125 20 0 BEADLO CCCCC[N@@H+](CC(F)F)C[C@H](C)O ZINC000451853084 388301372 /nfs/dbraw/zinc/30/13/72/388301372.db2.gz OBWDHQFFBDILMK-VIFPVBQESA-N 1 2 209.280 2.125 20 0 BEADLO CCCCC[N@H+](CC(F)F)C[C@H](C)O ZINC000451853084 388301374 /nfs/dbraw/zinc/30/13/74/388301374.db2.gz OBWDHQFFBDILMK-VIFPVBQESA-N 1 2 209.280 2.125 20 0 BEADLO Cc1cc(NC(=O)C=CC2CCC2)cc[nH+]1 ZINC000492049304 388332881 /nfs/dbraw/zinc/33/28/81/388332881.db2.gz OBGVPTZSAJZOOQ-WAYWQWQTSA-N 1 2 216.284 2.107 20 0 BEADLO O=C(/C=C\C1CC1)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000491905513 388327064 /nfs/dbraw/zinc/32/70/64/388327064.db2.gz OMSPYLCLGHIDNC-ZHRWSRJISA-N 1 2 245.326 2.430 20 0 BEADLO CS[C@H](CNc1cc[nH+]c(C)n1)C(C)(C)C ZINC000336663662 388262102 /nfs/dbraw/zinc/26/21/02/388262102.db2.gz DKGMIBZQNHOLDU-SNVBAGLBSA-N 1 2 239.388 2.397 20 0 BEADLO CC(C)c1nnc(C[NH+]2CCC(CF)CC2)o1 ZINC000451387016 388264689 /nfs/dbraw/zinc/26/46/89/388264689.db2.gz CCDYWQRGVCPXQC-UHFFFAOYSA-N 1 2 241.310 2.375 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N1CCCCCC1 ZINC000492297252 388340638 /nfs/dbraw/zinc/34/06/38/388340638.db2.gz RHDQHDJQCUTSSG-FPLPWBNLSA-N 1 2 247.342 2.319 20 0 BEADLO CCN(CC(C)C)C(=O)/C=C\c1[nH+]ccn1CC ZINC000492300049 388340967 /nfs/dbraw/zinc/34/09/67/388340967.db2.gz PPUYDCCZYFWIDV-FPLPWBNLSA-N 1 2 249.358 2.421 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ncn(C)n1)c1cccs1 ZINC000275663334 388344980 /nfs/dbraw/zinc/34/49/80/388344980.db2.gz GFWODZBTKLHJKA-BDAKNGLRSA-N 1 2 236.344 2.288 20 0 BEADLO CCc1ccc(C[NH2+][C@H](C)c2ncn(C)n2)cc1 ZINC000275852991 388345677 /nfs/dbraw/zinc/34/56/77/388345677.db2.gz RXJQHWNYHORBCJ-LLVKDONJSA-N 1 2 244.342 2.228 20 0 BEADLO CCC(O)(CC)CCNc1cccc[nH+]1 ZINC000276210737 388347347 /nfs/dbraw/zinc/34/73/47/388347347.db2.gz KJFCZPLKQBFBFX-UHFFFAOYSA-N 1 2 208.305 2.435 20 0 BEADLO Cc1nc(N2CC[C@H](C)[C@H](C)C2)cc[nH+]1 ZINC000162679031 388355632 /nfs/dbraw/zinc/35/56/32/388355632.db2.gz PBAJDWJZESXJLI-VHSXEESVSA-N 1 2 205.305 2.267 20 0 BEADLO CCn1nc(C)c(C[NH2+]Cc2cc(C)on2)c1C ZINC000307967107 388357822 /nfs/dbraw/zinc/35/78/22/388357822.db2.gz QVKSTEDTOZNLNC-UHFFFAOYSA-N 1 2 248.330 2.106 20 0 BEADLO C[C@@H]1CCCC[C@H]1CC(=O)NCc1[nH]cc[nH+]1 ZINC000524406769 388358994 /nfs/dbraw/zinc/35/89/94/388358994.db2.gz NXQMXLPBSFYEAS-MNOVXSKESA-N 1 2 235.331 2.242 20 0 BEADLO O=C(NCc1c[nH+]c[nH]1)[C@H]1CCCC[C@@H]1C1CC1 ZINC000648791596 388359741 /nfs/dbraw/zinc/35/97/41/388359741.db2.gz FNSLPOVWGNGOPR-OLZOCXBDSA-N 1 2 247.342 2.242 20 0 BEADLO O=C(NCc1c[nH]c[nH+]1)[C@H]1CCCC[C@@H]1C1CC1 ZINC000648791596 388359742 /nfs/dbraw/zinc/35/97/42/388359742.db2.gz FNSLPOVWGNGOPR-OLZOCXBDSA-N 1 2 247.342 2.242 20 0 BEADLO CSC(C)(C)CNc1nc[nH+]c(N)c1Cl ZINC000235042372 388364583 /nfs/dbraw/zinc/36/45/83/388364583.db2.gz OYBVXILSJIXGPL-UHFFFAOYSA-N 1 2 246.767 2.266 20 0 BEADLO CSC(C)(C)CNc1[nH+]cnc(N)c1Cl ZINC000235042372 388364586 /nfs/dbraw/zinc/36/45/86/388364586.db2.gz OYBVXILSJIXGPL-UHFFFAOYSA-N 1 2 246.767 2.266 20 0 BEADLO CC(C)[C@H](C)Nc1nc[nH+]c(N)c1Cl ZINC000227841449 388371439 /nfs/dbraw/zinc/37/14/39/388371439.db2.gz FTWBUHNGVCHLAX-LURJTMIESA-N 1 2 214.700 2.169 20 0 BEADLO CC(C)[C@H](C)Nc1[nH+]cnc(N)c1Cl ZINC000227841449 388371442 /nfs/dbraw/zinc/37/14/42/388371442.db2.gz FTWBUHNGVCHLAX-LURJTMIESA-N 1 2 214.700 2.169 20 0 BEADLO CC[C@H]1CCCN(c2nc[nH+]c(N)c2Cl)C1 ZINC000227848067 388371481 /nfs/dbraw/zinc/37/14/81/388371481.db2.gz XWRVVAQILPFATN-QMMMGPOBSA-N 1 2 240.738 2.339 20 0 BEADLO CC[C@H]1CCCN(c2[nH+]cnc(N)c2Cl)C1 ZINC000227848067 388371483 /nfs/dbraw/zinc/37/14/83/388371483.db2.gz XWRVVAQILPFATN-QMMMGPOBSA-N 1 2 240.738 2.339 20 0 BEADLO Cc1[nH]c(CNc2cn(C)nc2C(C)C)[nH+]c1C ZINC000572736290 388372514 /nfs/dbraw/zinc/37/25/14/388372514.db2.gz PDXCGANJDBOWQX-UHFFFAOYSA-N 1 2 247.346 2.496 20 0 BEADLO Cc1nc(N[C@@H](C)c2cnn(C(C)C)c2)cc[nH+]1 ZINC000524686565 388374682 /nfs/dbraw/zinc/37/46/82/388374682.db2.gz WPLFXLBUORWDSK-JTQLQIEISA-N 1 2 245.330 2.157 20 0 BEADLO C/C=C/C=C\C(=O)N1CCC[C@@H]1Cn1cc[nH+]c1 ZINC000492063562 388333418 /nfs/dbraw/zinc/33/34/18/388333418.db2.gz CSRFWDNZCIPFGV-XMDQBQTPSA-N 1 2 245.326 2.006 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)NCC(C)(C)C ZINC000492280312 388340076 /nfs/dbraw/zinc/34/00/76/388340076.db2.gz VYBMMINKCVBWHD-SREVYHEPSA-N 1 2 235.331 2.079 20 0 BEADLO CC(C)N(Cc1cc[nH+]c(N)c1)CC(F)F ZINC000298796777 388440674 /nfs/dbraw/zinc/44/06/74/388440674.db2.gz YROVCPVHRIKMAO-UHFFFAOYSA-N 1 2 229.274 2.139 20 0 BEADLO CCC(C)(C)OCC[NH2+]Cc1cn[nH]c1C ZINC000308546616 388442619 /nfs/dbraw/zinc/44/26/19/388442619.db2.gz PDMVIDIOFMMPCL-UHFFFAOYSA-N 1 2 225.336 2.013 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CC2CCC1CC2)c1[nH]cc[nH+]1 ZINC000394053577 388450238 /nfs/dbraw/zinc/45/02/38/388450238.db2.gz ABTPOANFCWVMIH-HBIQZDMRSA-N 1 2 247.342 2.413 20 0 BEADLO Cc1cc(NC(=O)c2ncncc2Cl)cc[nH+]1 ZINC000176469400 388454027 /nfs/dbraw/zinc/45/40/27/388454027.db2.gz VBCOZKZQYDHIJI-UHFFFAOYSA-N 1 2 248.673 2.086 20 0 BEADLO Cc1cc(NCC[C@H](C)F)nc(C2CC2)[nH+]1 ZINC000338756044 388477374 /nfs/dbraw/zinc/47/73/74/388477374.db2.gz PGDUFDGMJQIZNW-QMMMGPOBSA-N 1 2 223.295 2.244 20 0 BEADLO C[C@@H](CC(=O)N1CCCCCC1)n1cc[nH+]c1 ZINC000573124395 388421727 /nfs/dbraw/zinc/42/17/27/388421727.db2.gz YYUZLDSSPULTCF-LBPRGKRZSA-N 1 2 235.331 2.237 20 0 BEADLO CC[C@@H](CC(C)C)C(=O)NCCc1[nH]cc[nH+]1 ZINC000308082826 388431875 /nfs/dbraw/zinc/43/18/75/388431875.db2.gz ARPGQNKNASJYNF-NSHDSACASA-N 1 2 237.347 2.141 20 0 BEADLO COCC1(Nc2cc(C)[nH+]c(C(C)C)n2)CC1 ZINC000573266844 388437614 /nfs/dbraw/zinc/43/76/14/388437614.db2.gz QLWFSPKCYIYECU-UHFFFAOYSA-N 1 2 235.331 2.499 20 0 BEADLO Cc1cc(NC[C@]2(C)CCOC2)nc(C(C)C)[nH+]1 ZINC000354091847 388544198 /nfs/dbraw/zinc/54/41/98/388544198.db2.gz MJGGJEDVAFIVNB-AWEZNQCLSA-N 1 2 249.358 2.169 20 0 BEADLO Cc1cc(NC[C@@]2(C)CCOC2)nc(C(C)C)[nH+]1 ZINC000354091848 388544228 /nfs/dbraw/zinc/54/42/28/388544228.db2.gz MJGGJEDVAFIVNB-CQSZACIVSA-N 1 2 249.358 2.169 20 0 BEADLO CCCCN(C)c1cc(NC2CC2)[nH+]cn1 ZINC000244337203 388490808 /nfs/dbraw/zinc/49/08/08/388490808.db2.gz XRJWKGJORIKBJU-UHFFFAOYSA-N 1 2 220.320 2.287 20 0 BEADLO CCCCN(C)c1cc(NC2CC2)nc[nH+]1 ZINC000244337203 388490812 /nfs/dbraw/zinc/49/08/12/388490812.db2.gz XRJWKGJORIKBJU-UHFFFAOYSA-N 1 2 220.320 2.287 20 0 BEADLO CC[C@@]1(C)C[N@H+](Cc2nc(C)c(C)o2)CCO1 ZINC000135589738 388501461 /nfs/dbraw/zinc/50/14/61/388501461.db2.gz ZRWFAEZVRVSGLU-ZDUSSCGKSA-N 1 2 238.331 2.292 20 0 BEADLO CC[C@@]1(C)C[N@@H+](Cc2nc(C)c(C)o2)CCO1 ZINC000135589738 388501463 /nfs/dbraw/zinc/50/14/63/388501463.db2.gz ZRWFAEZVRVSGLU-ZDUSSCGKSA-N 1 2 238.331 2.292 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1CCOC[C@@H]1[C@H]1CCCO1 ZINC000528510268 388507344 /nfs/dbraw/zinc/50/73/44/388507344.db2.gz XWSRHNNOYDRREY-LGSVWZNTSA-N 1 2 245.750 2.009 20 0 BEADLO C/C(Cl)=C\C[N@H+]1CCOC[C@@H]1[C@H]1CCCO1 ZINC000528510268 388507346 /nfs/dbraw/zinc/50/73/46/388507346.db2.gz XWSRHNNOYDRREY-LGSVWZNTSA-N 1 2 245.750 2.009 20 0 BEADLO CCC[C@@H]1C[C@H]1NC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000517379153 388549310 /nfs/dbraw/zinc/54/93/10/388549310.db2.gz UPAPYGVTTYANPP-QJPTWQEYSA-N 1 2 235.331 2.139 20 0 BEADLO Cc1ccncc1NC(=O)C(C)(C)c1c[nH+]c[nH]1 ZINC000548091953 388509913 /nfs/dbraw/zinc/50/99/13/388509913.db2.gz RXBDHTRNEYXKNZ-UHFFFAOYSA-N 1 2 244.298 2.029 20 0 BEADLO Cc1ccncc1NC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000548091953 388509915 /nfs/dbraw/zinc/50/99/15/388509915.db2.gz RXBDHTRNEYXKNZ-UHFFFAOYSA-N 1 2 244.298 2.029 20 0 BEADLO COC(=O)[C@H](c1ccccc1)[NH+]1[C@H](C)C[C@H]1C ZINC000548097108 388510372 /nfs/dbraw/zinc/51/03/72/388510372.db2.gz GDCPVRIVLAAYHA-WZRBSPASSA-N 1 2 233.311 2.383 20 0 BEADLO COC(=O)[C@@H](c1ccccc1)[N@H+]1[C@H](C)C[C@@H]1C ZINC000548097107 388511412 /nfs/dbraw/zinc/51/14/12/388511412.db2.gz GDCPVRIVLAAYHA-NTZNESFSSA-N 1 2 233.311 2.383 20 0 BEADLO COC(=O)[C@@H](c1ccccc1)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548097107 388511414 /nfs/dbraw/zinc/51/14/14/388511414.db2.gz GDCPVRIVLAAYHA-NTZNESFSSA-N 1 2 233.311 2.383 20 0 BEADLO Cc1cccn2c(CNCC(C)(F)F)c[nH+]c12 ZINC000516668348 388513883 /nfs/dbraw/zinc/51/38/83/388513883.db2.gz YDUOYJUZQCCALZ-UHFFFAOYSA-N 1 2 239.269 2.388 20 0 BEADLO Cc1c[nH+]c(C)nc1NC[C@H](C)C(C)C ZINC000516981397 256809917 /nfs/dbraw/zinc/80/99/17/256809917.db2.gz OCBXCWUQXIYWSE-VIFPVBQESA-N 1 2 207.321 2.219 20 0 BEADLO CC[C@@H](CO)N(C)c1cc(C)[nH+]c(C(C)C)n1 ZINC000345834926 388516229 /nfs/dbraw/zinc/51/62/29/388516229.db2.gz MVHGPKQICHUNRT-NSHDSACASA-N 1 2 237.347 2.116 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2C[C@H]2C(C)C)c(C)c[nH+]1 ZINC000548192486 388520517 /nfs/dbraw/zinc/52/05/17/388520517.db2.gz ZPMKVVOTLNHBID-NWDGAFQWSA-N 1 2 232.327 2.351 20 0 BEADLO COCC1([N@H+](C)Cc2ncccc2Cl)CC1 ZINC000528435355 388525038 /nfs/dbraw/zinc/52/50/38/388525038.db2.gz ZMDYUPWRILMHDE-UHFFFAOYSA-N 1 2 240.734 2.346 20 0 BEADLO COCC1([N@@H+](C)Cc2ncccc2Cl)CC1 ZINC000528435355 388525040 /nfs/dbraw/zinc/52/50/40/388525040.db2.gz ZMDYUPWRILMHDE-UHFFFAOYSA-N 1 2 240.734 2.346 20 0 BEADLO C[C@@H](F)CCNc1cc[nH+]c(C(C)(C)C)n1 ZINC000378864467 388526586 /nfs/dbraw/zinc/52/65/86/388526586.db2.gz XKQCYCYRDGSBRK-SECBINFHSA-N 1 2 225.311 2.356 20 0 BEADLO CC(F)(F)CNCc1c[nH+]c2ccccn12 ZINC000378867802 388526829 /nfs/dbraw/zinc/52/68/29/388526829.db2.gz GDLJVMCAOCKGCD-UHFFFAOYSA-N 1 2 225.242 2.079 20 0 BEADLO CC(F)(F)C[NH2+]Cc1cnc2ccccn12 ZINC000378867802 388526832 /nfs/dbraw/zinc/52/68/32/388526832.db2.gz GDLJVMCAOCKGCD-UHFFFAOYSA-N 1 2 225.242 2.079 20 0 BEADLO Cc1c[nH+]c(C)nc1NC[C@@H](C)C(C)C ZINC000516981395 388531122 /nfs/dbraw/zinc/53/11/22/388531122.db2.gz OCBXCWUQXIYWSE-SECBINFHSA-N 1 2 207.321 2.219 20 0 BEADLO CCC[C@]1(C)C(=O)NCC[N@H+]1C/C=C(\C)Cl ZINC000528477453 388532193 /nfs/dbraw/zinc/53/21/93/388532193.db2.gz WBSIMKCJXKGOTJ-SBKJXLNCSA-N 1 2 244.766 2.120 20 0 BEADLO CCC[C@]1(C)C(=O)NCC[N@@H+]1C/C=C(\C)Cl ZINC000528477453 388532194 /nfs/dbraw/zinc/53/21/94/388532194.db2.gz WBSIMKCJXKGOTJ-SBKJXLNCSA-N 1 2 244.766 2.120 20 0 BEADLO CCC(NC(=O)Cc1[nH]cc[nH+]1)(C1CC1)C1CC1 ZINC000529800885 388590009 /nfs/dbraw/zinc/59/00/09/388590009.db2.gz UXHZMORNXQLMHX-UHFFFAOYSA-N 1 2 247.342 2.037 20 0 BEADLO Cn1cnc2cc(C[NH2+]CC(C)(F)F)ccc21 ZINC000549862858 388594104 /nfs/dbraw/zinc/59/41/04/388594104.db2.gz FWOPCOYXQJTKBN-UHFFFAOYSA-N 1 2 239.269 2.318 20 0 BEADLO CC(C)c1nnc(Cn2cc[nH+]c2C2CC2)[nH]1 ZINC000530131366 388615192 /nfs/dbraw/zinc/61/51/92/388615192.db2.gz ZQORSELMFPFYHL-UHFFFAOYSA-N 1 2 231.303 2.050 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1cc(F)ccc1O ZINC000080026454 388551586 /nfs/dbraw/zinc/55/15/86/388551586.db2.gz VSANLFVZVJXHFA-UHFFFAOYSA-N 1 2 246.241 2.487 20 0 BEADLO COC(=O)[C@@H]([NH2+][C@@H]1CC12CCCCC2)C1CC1 ZINC000358824781 388556325 /nfs/dbraw/zinc/55/63/25/388556325.db2.gz XBXRFLKTDDYVPS-NEPJUHHUSA-N 1 2 237.343 2.250 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC[C@H]1CCC[C@H]1C ZINC000521067097 388560303 /nfs/dbraw/zinc/56/03/03/388560303.db2.gz YWUZQCHWAQEYJI-IJLUTSLNSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC[C@H]1CCC[C@H]1C ZINC000521067097 388560305 /nfs/dbraw/zinc/56/03/05/388560305.db2.gz YWUZQCHWAQEYJI-IJLUTSLNSA-N 1 2 249.358 2.141 20 0 BEADLO CC(C)OCC[N@H+](C)[C@H](C)C(=O)OC(C)(C)C ZINC000081569422 388584603 /nfs/dbraw/zinc/58/46/03/388584603.db2.gz GRURMUSAWJBNFL-LLVKDONJSA-N 1 2 245.363 2.073 20 0 BEADLO CC(C)OCC[N@@H+](C)[C@H](C)C(=O)OC(C)(C)C ZINC000081569422 388584607 /nfs/dbraw/zinc/58/46/07/388584607.db2.gz GRURMUSAWJBNFL-LLVKDONJSA-N 1 2 245.363 2.073 20 0 BEADLO COc1c(C)[nH+]c(C2CC2)nc1NC1CCCC1 ZINC000521945461 388669113 /nfs/dbraw/zinc/66/91/13/388669113.db2.gz VDCPUTNYOBFQKX-UHFFFAOYSA-N 1 2 247.342 2.447 20 0 BEADLO CC[C@H]1CC[N@H+](Cc2noc(C(C)C)n2)C1 ZINC000125792760 388677816 /nfs/dbraw/zinc/67/78/16/388677816.db2.gz DLYRHWOOZJLFAM-JTQLQIEISA-N 1 2 223.320 2.425 20 0 BEADLO CC[C@H]1CC[N@@H+](Cc2noc(C(C)C)n2)C1 ZINC000125792760 388677819 /nfs/dbraw/zinc/67/78/19/388677819.db2.gz DLYRHWOOZJLFAM-JTQLQIEISA-N 1 2 223.320 2.425 20 0 BEADLO O[C@@H](C[N@H+](CC(F)F)C1CC1)CC(F)(F)F ZINC000189241582 388627804 /nfs/dbraw/zinc/62/78/04/388627804.db2.gz JONYUYGHEGMOEW-SSDOTTSWSA-N 1 2 247.207 2.029 20 0 BEADLO O[C@@H](C[N@@H+](CC(F)F)C1CC1)CC(F)(F)F ZINC000189241582 388627805 /nfs/dbraw/zinc/62/78/05/388627805.db2.gz JONYUYGHEGMOEW-SSDOTTSWSA-N 1 2 247.207 2.029 20 0 BEADLO CC(C)[N@H+](CC(F)F)C[C@@H](O)CC(F)(F)F ZINC000189573604 388638482 /nfs/dbraw/zinc/63/84/82/388638482.db2.gz OGJAJZGHFNMAEJ-ZETCQYMHSA-N 1 2 249.223 2.275 20 0 BEADLO CC(C)[N@@H+](CC(F)F)C[C@@H](O)CC(F)(F)F ZINC000189573604 388638484 /nfs/dbraw/zinc/63/84/84/388638484.db2.gz OGJAJZGHFNMAEJ-ZETCQYMHSA-N 1 2 249.223 2.275 20 0 BEADLO C[C@H](CN(C)C)[NH2+]Cc1cccc(O)c1Cl ZINC000328426616 388642881 /nfs/dbraw/zinc/64/28/81/388642881.db2.gz ADVAXGBPLJCNIA-SECBINFHSA-N 1 2 242.750 2.085 20 0 BEADLO Cc1cc(NC(=O)[C@@H](C)C(C)(F)F)c(C)c[nH+]1 ZINC000551897982 388644854 /nfs/dbraw/zinc/64/48/54/388644854.db2.gz GKHGZBXMCMLASQ-SECBINFHSA-N 1 2 242.269 2.350 20 0 BEADLO Cn1ncc2c1nc[nH+]c2N[C@@H]1CC12CCCC2 ZINC000328785081 388646109 /nfs/dbraw/zinc/64/61/09/388646109.db2.gz IPDAKCJPUAKPAR-SNVBAGLBSA-N 1 2 243.314 2.108 20 0 BEADLO CN(C(=O)CCCn1cc[nH+]c1)c1ccccc1 ZINC000620409790 388647038 /nfs/dbraw/zinc/64/70/38/388647038.db2.gz SXFGECNRGITUNW-UHFFFAOYSA-N 1 2 243.310 2.326 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@@H](C)[C@H]2C)no1 ZINC000246937463 388655415 /nfs/dbraw/zinc/65/54/15/388655415.db2.gz QQAXSGPRRHMYSW-NXEZZACHSA-N 1 2 223.320 2.252 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@@H](C)[C@H]2C)no1 ZINC000246937463 388655417 /nfs/dbraw/zinc/65/54/17/388655417.db2.gz QQAXSGPRRHMYSW-NXEZZACHSA-N 1 2 223.320 2.252 20 0 BEADLO C[C@@H](N(C)C(=O)CCn1cc[nH+]c1)C(C)(C)C ZINC000522252598 388734822 /nfs/dbraw/zinc/73/48/22/388734822.db2.gz FGHMUESIAUSBDO-LLVKDONJSA-N 1 2 237.347 2.166 20 0 BEADLO COc1cccnc1NCCCCn1cc[nH+]c1 ZINC000127979478 388734990 /nfs/dbraw/zinc/73/49/90/388734990.db2.gz PDSFAULUGLQPLR-UHFFFAOYSA-N 1 2 246.314 2.179 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1CCCC[C@@H]1O ZINC000128126577 388738618 /nfs/dbraw/zinc/73/86/18/388738618.db2.gz CYHZLSDIVVZIGC-MNOVXSKESA-N 1 2 236.315 2.053 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CCOC[C@@H]2C)cc[nH+]1 ZINC000194802759 388743547 /nfs/dbraw/zinc/74/35/47/388743547.db2.gz REWGEUBOFANNHA-JOYOIKCWSA-N 1 2 234.299 2.001 20 0 BEADLO CC[C@@H](C)NC(=O)C[N@H+](C)[C@@H](C)c1ccco1 ZINC000194982484 388747626 /nfs/dbraw/zinc/74/76/26/388747626.db2.gz OFQBARGEOYARSQ-MNOVXSKESA-N 1 2 238.331 2.187 20 0 BEADLO CC[C@@H](C)NC(=O)C[N@@H+](C)[C@@H](C)c1ccco1 ZINC000194982484 388747629 /nfs/dbraw/zinc/74/76/29/388747629.db2.gz OFQBARGEOYARSQ-MNOVXSKESA-N 1 2 238.331 2.187 20 0 BEADLO CC(C)(C)C[C@@H](O)CNc1cccc[nH+]1 ZINC000227357056 388748736 /nfs/dbraw/zinc/74/87/36/388748736.db2.gz LIDNBTHXLVYWMY-SNVBAGLBSA-N 1 2 208.305 2.291 20 0 BEADLO Cc1cnc([C@H](C)[NH2+]Cc2cncs2)o1 ZINC000227555815 388753190 /nfs/dbraw/zinc/75/31/90/388753190.db2.gz XMESZNVPNMNVAR-QMMMGPOBSA-N 1 2 223.301 2.290 20 0 BEADLO Cc1nc(C[N@@H+](C)CCOC(C)C)cs1 ZINC000065300355 388689800 /nfs/dbraw/zinc/68/98/00/388689800.db2.gz RCMJFNMDYPCDBF-UHFFFAOYSA-N 1 2 228.361 2.308 20 0 BEADLO Cc1nc(C[N@H+](C)CCOC(C)C)cs1 ZINC000065300355 388689804 /nfs/dbraw/zinc/68/98/04/388689804.db2.gz RCMJFNMDYPCDBF-UHFFFAOYSA-N 1 2 228.361 2.308 20 0 BEADLO CC[C@@H]1CN(C)CC[N@@H+]1Cc1ccc(F)cc1 ZINC000552406794 388703812 /nfs/dbraw/zinc/70/38/12/388703812.db2.gz PIUSBHVUPBRLIB-CQSZACIVSA-N 1 2 236.334 2.352 20 0 BEADLO CC[C@@H]1CN(C)CC[N@H+]1Cc1ccc(F)cc1 ZINC000552406794 388703814 /nfs/dbraw/zinc/70/38/14/388703814.db2.gz PIUSBHVUPBRLIB-CQSZACIVSA-N 1 2 236.334 2.352 20 0 BEADLO CCC[C@@H](C)C(=O)NCCCCn1cc[nH+]c1 ZINC000522189244 388717333 /nfs/dbraw/zinc/71/73/33/388717333.db2.gz OLKREORMAUGFDK-GFCCVEGCSA-N 1 2 237.347 2.216 20 0 BEADLO C[C@@H]1CC[N@H+]2[C@H](C1)C(=O)N[C@@H]2C1CCCCC1 ZINC000249434980 388722278 /nfs/dbraw/zinc/72/22/78/388722278.db2.gz IDHGNAKVBNTYFC-RTXFEEFZSA-N 1 2 236.359 2.123 20 0 BEADLO C[C@@H]1CC[N@@H+]2[C@H](C1)C(=O)N[C@@H]2C1CCCCC1 ZINC000249434980 388722280 /nfs/dbraw/zinc/72/22/80/388722280.db2.gz IDHGNAKVBNTYFC-RTXFEEFZSA-N 1 2 236.359 2.123 20 0 BEADLO Cc1ccc(CCNc2cc[nH+]c(C3CC3)n2)o1 ZINC000553859837 388792584 /nfs/dbraw/zinc/79/25/84/388792584.db2.gz YMPNCOYZEDMATI-UHFFFAOYSA-N 1 2 243.310 2.332 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)[C@@H]1CCc2c[nH+]cn2C1 ZINC000553313339 388761224 /nfs/dbraw/zinc/76/12/24/388761224.db2.gz HTMOEDYWYBXVRE-VXGBXAGGSA-N 1 2 249.358 2.093 20 0 BEADLO CCc1ccccc1C(=O)NCc1[nH]c[nH+]c1C ZINC000269525518 388775208 /nfs/dbraw/zinc/77/52/08/388775208.db2.gz LNBYLCNBOXXPOI-UHFFFAOYSA-N 1 2 243.310 2.211 20 0 BEADLO C[C@H]1CC[C@@H](C(=O)NCCCCn2cc[nH+]c2)C1 ZINC000540690025 388815696 /nfs/dbraw/zinc/81/56/96/388815696.db2.gz JNPOMDPEOAQKJB-QWHCGFSZSA-N 1 2 249.358 2.216 20 0 BEADLO CC(C)C[C@H](C)CC(=O)N1CC(n2cc[nH+]c2)C1 ZINC000523689191 388853180 /nfs/dbraw/zinc/85/31/80/388853180.db2.gz LTAGDKPFUIEPCZ-LBPRGKRZSA-N 1 2 249.358 2.339 20 0 BEADLO CC(C)C[C@@H](C)CC(=O)N1CC(n2cc[nH+]c2)C1 ZINC000523689190 388853369 /nfs/dbraw/zinc/85/33/69/388853369.db2.gz LTAGDKPFUIEPCZ-GFCCVEGCSA-N 1 2 249.358 2.339 20 0 BEADLO CC(C)(C)OCC[N@@H+]1Cc2cccnc2C1 ZINC000556085438 388866843 /nfs/dbraw/zinc/86/68/43/388866843.db2.gz UKFGRFQVIPKQQC-UHFFFAOYSA-N 1 2 220.316 2.212 20 0 BEADLO CC(C)(C)OCC[N@H+]1Cc2cccnc2C1 ZINC000556085438 388866846 /nfs/dbraw/zinc/86/68/46/388866846.db2.gz UKFGRFQVIPKQQC-UHFFFAOYSA-N 1 2 220.316 2.212 20 0 BEADLO CC(C)[C@H]([NH2+]Cc1cc[nH]n1)c1ccc(F)cn1 ZINC000541849383 388869621 /nfs/dbraw/zinc/86/96/21/388869621.db2.gz UGRQORUUQKXPQQ-ZDUSSCGKSA-N 1 2 248.305 2.431 20 0 BEADLO CC(C)OC(=O)[C@H](C)[N@H+](C)CCOC(C)(C)C ZINC000129782896 388871212 /nfs/dbraw/zinc/87/12/12/388871212.db2.gz CQLOICJGJUQRPZ-NSHDSACASA-N 1 2 245.363 2.073 20 0 BEADLO CC(C)OC(=O)[C@H](C)[N@@H+](C)CCOC(C)(C)C ZINC000129782896 388871215 /nfs/dbraw/zinc/87/12/15/388871215.db2.gz CQLOICJGJUQRPZ-NSHDSACASA-N 1 2 245.363 2.073 20 0 BEADLO CC(C)c1nc(N[C@@H]2C[C@H](O)C2(C)C)cc[nH+]1 ZINC000302480902 388846380 /nfs/dbraw/zinc/84/63/80/388846380.db2.gz XPEFSOUOWOSJEE-ZJUUUORDSA-N 1 2 235.331 2.171 20 0 BEADLO C[C@H]1CN(C)CC[N@@H+]1C/C=C\c1ccccc1 ZINC000523636946 388848613 /nfs/dbraw/zinc/84/86/13/388848613.db2.gz ZXRPSVBXAXSQBX-PIZKADEWSA-N 1 2 230.355 2.336 20 0 BEADLO CCc1noc(C)c1C[N@@H+]1CCOCC1(C)C ZINC000163110624 388880934 /nfs/dbraw/zinc/88/09/34/388880934.db2.gz KIARLVMZTHXYQQ-UHFFFAOYSA-N 1 2 238.331 2.156 20 0 BEADLO CCc1noc(C)c1C[N@H+]1CCOCC1(C)C ZINC000163110624 388880937 /nfs/dbraw/zinc/88/09/37/388880937.db2.gz KIARLVMZTHXYQQ-UHFFFAOYSA-N 1 2 238.331 2.156 20 0 BEADLO CC[C@H]([NH2+][C@@H](C)c1cncnc1C)C(F)F ZINC000565219662 388928596 /nfs/dbraw/zinc/92/85/96/388928596.db2.gz XLRKMMZVOXKLDV-WPRPVWTQSA-N 1 2 229.274 2.479 20 0 BEADLO COc1ncccc1NCc1[nH]c(C)c(C)[nH+]1 ZINC000565237986 388931436 /nfs/dbraw/zinc/93/14/36/388931436.db2.gz MTWAOCKODOQNOM-UHFFFAOYSA-N 1 2 232.287 2.042 20 0 BEADLO F[C@@]1(c2ccccc2)C[C@H]1[NH2+]Cc1cnccn1 ZINC000565418274 388942687 /nfs/dbraw/zinc/94/26/87/388942687.db2.gz ODZMRCZQSYEZQO-ZIAGYGMSSA-N 1 2 243.285 2.204 20 0 BEADLO CC(C)CC[C@H]1CCCN1C(=O)Cn1cc[nH+]c1 ZINC000565513918 388949317 /nfs/dbraw/zinc/94/93/17/388949317.db2.gz SQDONSWAYPBQMT-CYBMUJFWSA-N 1 2 249.358 2.310 20 0 BEADLO Cc1nsc(NCCc2cc[nH+]cc2C)n1 ZINC000269946657 389011414 /nfs/dbraw/zinc/01/14/14/389011414.db2.gz GKESXCPJVNOTJY-UHFFFAOYSA-N 1 2 234.328 2.205 20 0 BEADLO CCSCCSCc1c[nH+]cn1C ZINC000273615400 389043447 /nfs/dbraw/zinc/04/34/47/389043447.db2.gz NFRRJWXMHYDHNJ-UHFFFAOYSA-N 1 2 216.375 2.406 20 0 BEADLO COCC[N@H+](C)Cc1ncc(Cl)cc1Cl ZINC000347984511 136023194 /nfs/dbraw/zinc/02/31/94/136023194.db2.gz AICJJNNYTNZBBV-UHFFFAOYSA-N 1 2 249.141 2.467 20 0 BEADLO COCC[N@@H+](C)Cc1ncc(Cl)cc1Cl ZINC000347984511 136023195 /nfs/dbraw/zinc/02/31/95/136023195.db2.gz AICJJNNYTNZBBV-UHFFFAOYSA-N 1 2 249.141 2.467 20 0 BEADLO Cc1cc([NH2+]CCC2CC2)ccc1-n1cnnn1 ZINC000525870982 487528549 /nfs/dbraw/zinc/52/85/49/487528549.db2.gz BRTOLLPARWSYPL-UHFFFAOYSA-N 1 2 243.314 2.183 20 0 BEADLO CO[C@H]1C[C@@H]([N@H+](C)Cc2ncc(Cl)s2)C1 ZINC000510092153 533293467 /nfs/dbraw/zinc/29/34/67/533293467.db2.gz NIYCXLCGPRWSHB-OCAPTIKFSA-N 1 2 246.763 2.406 20 0 BEADLO CO[C@H]1C[C@@H]([N@@H+](C)Cc2ncc(Cl)s2)C1 ZINC000510092153 533293469 /nfs/dbraw/zinc/29/34/69/533293469.db2.gz NIYCXLCGPRWSHB-OCAPTIKFSA-N 1 2 246.763 2.406 20 0 BEADLO C[C@@H]1CCCC[C@H]1NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493254943 533608192 /nfs/dbraw/zinc/60/81/92/533608192.db2.gz DBTAAAGLVCSKRH-AFPRHGJPSA-N 1 2 233.315 2.118 20 0 BEADLO CC[C@@H]1CN(c2cccc[nH+]2)C[C@H](C)O1 ZINC000264714572 132179979 /nfs/dbraw/zinc/17/99/79/132179979.db2.gz GVKSIAFRQBDHQS-WDEREUQCSA-N 1 2 206.289 2.085 20 0 BEADLO Cc1cc(N2C[C@@H](C)OC[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000265297512 132181857 /nfs/dbraw/zinc/18/18/57/132181857.db2.gz CKQWCXJVSXPIGH-WDEREUQCSA-N 1 2 247.342 2.276 20 0 BEADLO Cc1nc(N2CCC(OCC(C)C)CC2)cc[nH+]1 ZINC000266404010 132187099 /nfs/dbraw/zinc/18/70/99/132187099.db2.gz PUOCMGZCKKEVTL-UHFFFAOYSA-N 1 2 249.358 2.426 20 0 BEADLO C[C@H]1COCCN1c1cc(C(F)(F)F)cc[nH+]1 ZINC000267391854 132190074 /nfs/dbraw/zinc/19/00/74/132190074.db2.gz NSDKWHCWKGUKAQ-QMMMGPOBSA-N 1 2 246.232 2.326 20 0 BEADLO C[C@@H]1CN(Cc2c[nH+]cn2C)c2ccccc2O1 ZINC000267638934 132190577 /nfs/dbraw/zinc/19/05/77/132190577.db2.gz VIAZFVZGPPNCAB-LLVKDONJSA-N 1 2 243.310 2.208 20 0 BEADLO CC[C@@]1(CO)CCCN(c2cccc[nH+]2)C1 ZINC000275010504 132204339 /nfs/dbraw/zinc/20/43/39/132204339.db2.gz IZPGTVICFHLFOZ-CYBMUJFWSA-N 1 2 220.316 2.071 20 0 BEADLO CC(C)(C)[C@@H]1CN(c2cccc[nH+]2)CCO1 ZINC000279557213 132209605 /nfs/dbraw/zinc/20/96/05/132209605.db2.gz TUUFTXFPZBGFQD-NSHDSACASA-N 1 2 220.316 2.333 20 0 BEADLO CC1=CCCN(c2cc(N3CCCC3)[nH+]cn2)C1 ZINC000280518551 132210601 /nfs/dbraw/zinc/21/06/01/132210601.db2.gz DQMQKAUXGTUNIK-UHFFFAOYSA-N 1 2 244.342 2.233 20 0 BEADLO CC1=CCCN(c2cc(N3CCCC3)nc[nH+]2)C1 ZINC000280518551 132210602 /nfs/dbraw/zinc/21/06/02/132210602.db2.gz DQMQKAUXGTUNIK-UHFFFAOYSA-N 1 2 244.342 2.233 20 0 BEADLO Cc1cc(N2CCC[C@@]3(CCCOC3)C2)nc[nH+]1 ZINC000353479112 132213070 /nfs/dbraw/zinc/21/30/70/132213070.db2.gz QIJRPCJAATYDBX-CQSZACIVSA-N 1 2 247.342 2.182 20 0 BEADLO CCc1nc(N2CCO[C@@H]3CCC[C@@H]32)cc(C)[nH+]1 ZINC000288218670 132216174 /nfs/dbraw/zinc/21/61/74/132216174.db2.gz DNTCNSBJAVPHCQ-NWDGAFQWSA-N 1 2 247.342 2.105 20 0 BEADLO Cc1nc(N2CCC[C@@H](C3CC3)C2)cc[nH+]1 ZINC000288188275 132216311 /nfs/dbraw/zinc/21/63/11/132216311.db2.gz JPZSSKREARKTRN-GFCCVEGCSA-N 1 2 217.316 2.411 20 0 BEADLO c1ccc(N2CCC(c3ccncn3)CC2)[nH+]c1 ZINC000298134829 132221742 /nfs/dbraw/zinc/22/17/42/132221742.db2.gz BUGQEANMGUBILH-UHFFFAOYSA-N 1 2 240.310 2.256 20 0 BEADLO c1[nH]c(CN2CCCc3ccccc32)c[nH+]1 ZINC000095561794 132240542 /nfs/dbraw/zinc/24/05/42/132240542.db2.gz BEIOOMXWXHHPHG-UHFFFAOYSA-N 1 2 213.284 2.363 20 0 BEADLO c1[nH]cc(CN2CCCc3ccccc32)[nH+]1 ZINC000095561794 132240545 /nfs/dbraw/zinc/24/05/45/132240545.db2.gz BEIOOMXWXHHPHG-UHFFFAOYSA-N 1 2 213.284 2.363 20 0 BEADLO c1ccc(N2CCC[C@H]([C@H]3CCOC3)C2)[nH+]c1 ZINC000336549196 132248725 /nfs/dbraw/zinc/24/87/25/132248725.db2.gz PDEGGUCCEDMFCF-STQMWFEESA-N 1 2 232.327 2.335 20 0 BEADLO c1ccc(N2CCC[C@H]([C@@H]3CCOC3)C2)[nH+]c1 ZINC000336549195 132248792 /nfs/dbraw/zinc/24/87/92/132248792.db2.gz PDEGGUCCEDMFCF-QWHCGFSZSA-N 1 2 232.327 2.335 20 0 BEADLO CCO[C@@H]1CCCN(c2cccc[nH+]2)C1 ZINC000301110414 132251326 /nfs/dbraw/zinc/25/13/26/132251326.db2.gz KPUJFGVHVXSRDX-LLVKDONJSA-N 1 2 206.289 2.087 20 0 BEADLO CC[C@@H]1CN(c2cc(C)[nH+]cn2)CCS1 ZINC000301447798 132254026 /nfs/dbraw/zinc/25/40/26/132254026.db2.gz OUIKABSVNATHQQ-SNVBAGLBSA-N 1 2 223.345 2.117 20 0 BEADLO CC[C@H]1CN(c2nc(C)[nH+]c(C)c2C)C[C@@H](C)O1 ZINC000301632149 132255479 /nfs/dbraw/zinc/25/54/79/132255479.db2.gz BVXOALRVCBMYOO-RNCFNFMXSA-N 1 2 249.358 2.406 20 0 BEADLO COCC1=CCN(c2nc(C)[nH+]c(C)c2C)CC1 ZINC000302445605 132263730 /nfs/dbraw/zinc/26/37/30/132263730.db2.gz RXVGBGZWBZFVGE-UHFFFAOYSA-N 1 2 247.342 2.185 20 0 BEADLO C[C@H]1CCC[C@H](NC(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000276547956 133551048 /nfs/dbraw/zinc/55/10/48/133551048.db2.gz HBMMRBPZGUJHFI-PZIAFJOJSA-N 1 2 233.315 2.118 20 0 BEADLO Cc1cc(C)c(CNC(=O)c2ccsn2)c[nH+]1 ZINC000334742511 133746075 /nfs/dbraw/zinc/74/60/75/133746075.db2.gz JMWSSQVMHQDBKN-UHFFFAOYSA-N 1 2 247.323 2.085 20 0 BEADLO C[C@@H]1CCCC[N@@H+]1Cc1nc(C(F)F)no1 ZINC000335097490 133764082 /nfs/dbraw/zinc/76/40/82/133764082.db2.gz DPNKAQBGIBRWNK-SSDOTTSWSA-N 1 2 231.246 2.382 20 0 BEADLO C[C@@H]1CCCC[N@H+]1Cc1nc(C(F)F)no1 ZINC000335097490 133764083 /nfs/dbraw/zinc/76/40/83/133764083.db2.gz DPNKAQBGIBRWNK-SSDOTTSWSA-N 1 2 231.246 2.382 20 0 BEADLO Cn1cc(CNc2c[nH+]c3c(c2)CCCC3)cn1 ZINC000335975650 134030721 /nfs/dbraw/zinc/03/07/21/134030721.db2.gz OXTKORAPIMVKSW-UHFFFAOYSA-N 1 2 242.326 2.306 20 0 BEADLO Cc1cc(NC(=O)C23CCC(CC2)C3)cc[nH+]1 ZINC000335984725 134038574 /nfs/dbraw/zinc/03/85/74/134038574.db2.gz RIVHKDOVCUUYOY-UHFFFAOYSA-N 1 2 230.311 2.331 20 0 BEADLO Cn1c[nH+]cc1CN1CCc2cccc(F)c21 ZINC000335997731 134043121 /nfs/dbraw/zinc/04/31/21/134043121.db2.gz QOUQZRJMODSFHY-UHFFFAOYSA-N 1 2 231.274 2.122 20 0 BEADLO C[C@@H]1CCC[C@@H](C(=O)N2CCn3c[nH+]cc3C2)C1 ZINC000336019468 134054102 /nfs/dbraw/zinc/05/41/02/134054102.db2.gz KRJCCZZSXROLGB-VXGBXAGGSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1nc(C[NH+]2CCSCC2)c(C)s1 ZINC000336023108 134056612 /nfs/dbraw/zinc/05/66/12/134056612.db2.gz DWWSFLWOVCVCTF-UHFFFAOYSA-N 1 2 228.386 2.309 20 0 BEADLO Cn1nccc1C[N@H+]1CC=C(C(F)(F)F)CC1 ZINC000336034027 134059229 /nfs/dbraw/zinc/05/92/29/134059229.db2.gz QEVSDCLMRVEHDQ-UHFFFAOYSA-N 1 2 245.248 2.115 20 0 BEADLO Cn1nccc1C[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000336034027 134059230 /nfs/dbraw/zinc/05/92/30/134059230.db2.gz QEVSDCLMRVEHDQ-UHFFFAOYSA-N 1 2 245.248 2.115 20 0 BEADLO FC(F)Cn1cc(CNc2cccc[nH+]2)cn1 ZINC000352171763 134090925 /nfs/dbraw/zinc/09/09/25/134090925.db2.gz NKEHZPOFIDCVFP-UHFFFAOYSA-N 1 2 238.241 2.155 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1occc1C ZINC000336125121 134092581 /nfs/dbraw/zinc/09/25/81/134092581.db2.gz IBLXPYYPAOQLJK-UHFFFAOYSA-N 1 2 230.267 2.220 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1CC[C@@H](C)C1 ZINC000336143581 134101610 /nfs/dbraw/zinc/10/16/10/134101610.db2.gz VPOBCHJFLQIPRN-ZYHUDNBSSA-N 1 2 232.327 2.441 20 0 BEADLO Cc1cccc(C[N@@H+]2CCOCC23CCC3)n1 ZINC000336172572 134115795 /nfs/dbraw/zinc/11/57/95/134115795.db2.gz LAIVFPSOPVUBOB-UHFFFAOYSA-N 1 2 232.327 2.145 20 0 BEADLO Cc1cccc(C[N@H+]2CCOCC23CCC3)n1 ZINC000336172572 134115796 /nfs/dbraw/zinc/11/57/96/134115796.db2.gz LAIVFPSOPVUBOB-UHFFFAOYSA-N 1 2 232.327 2.145 20 0 BEADLO Cc1noc(OCc2ccc3[nH]c(C)[nH+]c3c2)n1 ZINC000358853342 134192864 /nfs/dbraw/zinc/19/28/64/134192864.db2.gz MCNULPTULKDART-UHFFFAOYSA-N 1 2 244.254 2.142 20 0 BEADLO Cc1noc(OCc2ccc3[nH+]c(C)[nH]c3c2)n1 ZINC000358853342 134192865 /nfs/dbraw/zinc/19/28/65/134192865.db2.gz MCNULPTULKDART-UHFFFAOYSA-N 1 2 244.254 2.142 20 0 BEADLO C[C@H](CO)[N@H+](C)Cc1ncc(Cl)cc1Cl ZINC000180163436 134327706 /nfs/dbraw/zinc/32/77/06/134327706.db2.gz ZIOGPAOAFPQTDS-SSDOTTSWSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@H](CO)[N@@H+](C)Cc1ncc(Cl)cc1Cl ZINC000180163436 134327707 /nfs/dbraw/zinc/32/77/07/134327707.db2.gz ZIOGPAOAFPQTDS-SSDOTTSWSA-N 1 2 249.141 2.201 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2cncc(F)c2)no1 ZINC000222683057 134333769 /nfs/dbraw/zinc/33/37/69/134333769.db2.gz GGJGCSKUFSYVOJ-VIFPVBQESA-N 1 2 235.262 2.368 20 0 BEADLO CCC[N@H+](Cc1ncnn1CC(C)C)C1CC1 ZINC000182746088 134347971 /nfs/dbraw/zinc/34/79/71/134347971.db2.gz WZONXGSPKKMXEJ-UHFFFAOYSA-N 1 2 236.363 2.309 20 0 BEADLO CCC[N@@H+](Cc1ncnn1CC(C)C)C1CC1 ZINC000182746088 134347972 /nfs/dbraw/zinc/34/79/72/134347972.db2.gz WZONXGSPKKMXEJ-UHFFFAOYSA-N 1 2 236.363 2.309 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)NCCCn1cc[nH+]c1 ZINC000182891724 134349498 /nfs/dbraw/zinc/34/94/98/134349498.db2.gz FUTFOADMVSPDER-NWDGAFQWSA-N 1 2 237.347 2.072 20 0 BEADLO C[C@H]1CC(C(=O)NCCc2[nH]cc[nH+]2)C[C@@H](C)C1 ZINC000183750254 134353861 /nfs/dbraw/zinc/35/38/61/134353861.db2.gz SFYIOIIVAWFAKV-FOSCPWQOSA-N 1 2 249.358 2.141 20 0 BEADLO Cc1cc(C[NH2+]Cc2ncc(Cl)s2)on1 ZINC000225339721 134355121 /nfs/dbraw/zinc/35/51/21/134355121.db2.gz CIEPHUYGEXFKLW-UHFFFAOYSA-N 1 2 243.719 2.383 20 0 BEADLO C[C@H]1C[NH+](Cc2cc(O)cc(F)c2)C[C@H](C)O1 ZINC000184147775 134359191 /nfs/dbraw/zinc/35/91/91/134359191.db2.gz AQGHBPSSQFBACY-UWVGGRQHSA-N 1 2 239.290 2.141 20 0 BEADLO Fc1cccc2c1CCN2CCCn1cc[nH+]c1 ZINC000184047552 134360007 /nfs/dbraw/zinc/36/00/07/134360007.db2.gz WTLPSHMTZNPBPL-UHFFFAOYSA-N 1 2 245.301 2.475 20 0 BEADLO Cc1cc(C[N@H+](C)C[C@@H]2CCC(C)(C)O2)no1 ZINC000184650707 134366999 /nfs/dbraw/zinc/36/69/99/134366999.db2.gz BWYGROCRXXNJQT-LBPRGKRZSA-N 1 2 238.331 2.372 20 0 BEADLO Cc1cc(C[N@@H+](C)C[C@@H]2CCC(C)(C)O2)no1 ZINC000184650707 134367000 /nfs/dbraw/zinc/36/70/00/134367000.db2.gz BWYGROCRXXNJQT-LBPRGKRZSA-N 1 2 238.331 2.372 20 0 BEADLO Cc1oncc1C[N@@H+]1CCC[C@H](c2ccn[nH]2)C1 ZINC000185194295 134372786 /nfs/dbraw/zinc/37/27/86/134372786.db2.gz CNMKOOWNVAEIAY-NSHDSACASA-N 1 2 246.314 2.086 20 0 BEADLO Cc1oncc1C[N@H+]1CCC[C@H](c2ccn[nH]2)C1 ZINC000185194295 134372787 /nfs/dbraw/zinc/37/27/87/134372787.db2.gz CNMKOOWNVAEIAY-NSHDSACASA-N 1 2 246.314 2.086 20 0 BEADLO CCn1cc[nH+]c1CN1CCn2cccc2[C@H]1C ZINC000195514047 134844609 /nfs/dbraw/zinc/84/46/09/134844609.db2.gz NGIHDTYBLRSTJF-GFCCVEGCSA-N 1 2 244.342 2.281 20 0 BEADLO CCn1ccnc1C[N@@H+]1CCn2cccc2[C@H]1C ZINC000195514047 134844610 /nfs/dbraw/zinc/84/46/10/134844610.db2.gz NGIHDTYBLRSTJF-GFCCVEGCSA-N 1 2 244.342 2.281 20 0 BEADLO CCn1ccnc1C[N@H+]1CCn2cccc2[C@H]1C ZINC000195514047 134844611 /nfs/dbraw/zinc/84/46/11/134844611.db2.gz NGIHDTYBLRSTJF-GFCCVEGCSA-N 1 2 244.342 2.281 20 0 BEADLO Cc1ccc(C(=O)NCc2[nH]cc[nH+]2)c(Cl)c1 ZINC000235857649 135050013 /nfs/dbraw/zinc/05/00/13/135050013.db2.gz KCEOJZDLFLACEU-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO CCc1nc(C[N@@H+]2CC[C@H](C)[C@@H](C)C2)no1 ZINC000245968655 135081103 /nfs/dbraw/zinc/08/11/03/135081103.db2.gz VZXIZAANUVZYTJ-UWVGGRQHSA-N 1 2 223.320 2.110 20 0 BEADLO CCc1nc(C[N@H+]2CC[C@H](C)[C@@H](C)C2)no1 ZINC000245968655 135081105 /nfs/dbraw/zinc/08/11/05/135081105.db2.gz VZXIZAANUVZYTJ-UWVGGRQHSA-N 1 2 223.320 2.110 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cnc(C)s2)C[C@@H](C)O1 ZINC000252442549 135089467 /nfs/dbraw/zinc/08/94/67/135089467.db2.gz AFZNNZLOFJNBIE-KOLCDFICSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cnc(C)s2)C[C@@H](C)O1 ZINC000252442549 135089468 /nfs/dbraw/zinc/08/94/68/135089468.db2.gz AFZNNZLOFJNBIE-KOLCDFICSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1ccc(NCc2cncnc2)c(C)[nH+]1 ZINC000087151562 135107854 /nfs/dbraw/zinc/10/78/54/135107854.db2.gz OQPHIAUHSWGMJQ-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO Cc1ccc(NCc2ncc[nH]2)c(C)[nH+]1 ZINC000087151527 135107885 /nfs/dbraw/zinc/10/78/85/135107885.db2.gz DLYCYIAVFGXDCC-UHFFFAOYSA-N 1 2 202.261 2.034 20 0 BEADLO Cc1[nH]c(C(=O)NC2C[C@@H](C)C[C@H](C)C2)c[nH+]1 ZINC000265780024 135146111 /nfs/dbraw/zinc/14/61/11/135146111.db2.gz FAOJXVJBANOCSW-IUCAKERBSA-N 1 2 235.331 2.273 20 0 BEADLO C[C@H](O)CCNc1ccc2ccccc2[nH+]1 ZINC000078771266 135150334 /nfs/dbraw/zinc/15/03/34/135150334.db2.gz KSEVXCKQYZGCOE-JTQLQIEISA-N 1 2 216.284 2.418 20 0 BEADLO C[C@H](c1cnccn1)[N@H+](C)Cc1ccoc1 ZINC000342271185 135259825 /nfs/dbraw/zinc/25/98/25/135259825.db2.gz HRQPQXLWUZUJKM-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H](c1cnccn1)[N@@H+](C)Cc1ccoc1 ZINC000342271185 135259827 /nfs/dbraw/zinc/25/98/27/135259827.db2.gz HRQPQXLWUZUJKM-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO CCc1csc(N(C)Cc2[nH]cc[nH+]2)n1 ZINC000342411736 135266616 /nfs/dbraw/zinc/26/66/16/135266616.db2.gz IKOFAMJSMKKVEL-UHFFFAOYSA-N 1 2 222.317 2.065 20 0 BEADLO Cc1[nH]c2ccc(CS[C@@H](C)CO)cc2[nH+]1 ZINC000342662991 135308378 /nfs/dbraw/zinc/30/83/78/135308378.db2.gz MOSGBJHDRVHHDN-QMMMGPOBSA-N 1 2 236.340 2.485 20 0 BEADLO Cc1[nH]c2cc(CS[C@@H](C)CO)ccc2[nH+]1 ZINC000342662991 135308379 /nfs/dbraw/zinc/30/83/79/135308379.db2.gz MOSGBJHDRVHHDN-QMMMGPOBSA-N 1 2 236.340 2.485 20 0 BEADLO CO[C@@H]1[C@@H](C)[C@@H](Nc2cc(C)[nH+]cn2)C1(C)C ZINC000342779632 135317151 /nfs/dbraw/zinc/31/71/51/135317151.db2.gz FAKDVYRMHSMNIR-MVWJERBFSA-N 1 2 235.331 2.256 20 0 BEADLO CO[C@@H]1[C@H](C)[C@H](Nc2cc(C)[nH+]cn2)C1(C)C ZINC000342779628 135317451 /nfs/dbraw/zinc/31/74/51/135317451.db2.gz FAKDVYRMHSMNIR-ADEWGFFLSA-N 1 2 235.331 2.256 20 0 BEADLO CCN(Cc1[nH+]cc(C)n1C)CC(F)(F)F ZINC000342788768 135318388 /nfs/dbraw/zinc/31/83/88/135318388.db2.gz KPDPPUOWAOEQQD-UHFFFAOYSA-N 1 2 235.253 2.113 20 0 BEADLO Cc1c[nH+]c(CN(C)Cc2ccccc2)n1C ZINC000342800405 135320782 /nfs/dbraw/zinc/32/07/82/135320782.db2.gz RIZPYBAZEFIMCU-UHFFFAOYSA-N 1 2 229.327 2.361 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2ccccc2)n1C ZINC000342800405 135320784 /nfs/dbraw/zinc/32/07/84/135320784.db2.gz RIZPYBAZEFIMCU-UHFFFAOYSA-N 1 2 229.327 2.361 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2ccccc2)n1C ZINC000342800405 135320786 /nfs/dbraw/zinc/32/07/86/135320786.db2.gz RIZPYBAZEFIMCU-UHFFFAOYSA-N 1 2 229.327 2.361 20 0 BEADLO Cc1c[nH+]c(CN(C)Cc2ccccc2F)n1C ZINC000342797117 135320947 /nfs/dbraw/zinc/32/09/47/135320947.db2.gz DJZPOXLPUZMLSP-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1c[nH+]c(CN2CCOc3ccccc32)n1C ZINC000342769376 135326103 /nfs/dbraw/zinc/32/61/03/135326103.db2.gz QVBXFSMVULGQFF-UHFFFAOYSA-N 1 2 243.310 2.128 20 0 BEADLO CC(C)[C@@H]1CCN1C(=O)c1ccc2[nH+]ccn2c1 ZINC000334297054 135334788 /nfs/dbraw/zinc/33/47/88/135334788.db2.gz AEVBUGANHOJYFR-LBPRGKRZSA-N 1 2 243.310 2.205 20 0 BEADLO Cc1[nH]c(C(=O)NCc2ccccc2Cl)c[nH+]1 ZINC000334301115 135346863 /nfs/dbraw/zinc/34/68/63/135346863.db2.gz WPSMJOCAOCKVKZ-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO Cc1scc(C(=O)NCc2c[nH+]c[nH]2)c1C ZINC000334310021 135351082 /nfs/dbraw/zinc/35/10/82/135351082.db2.gz IWRSQCLDWPPLPQ-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO Cc1scc(C(=O)NCc2c[nH]c[nH+]2)c1C ZINC000334310021 135351084 /nfs/dbraw/zinc/35/10/84/135351084.db2.gz IWRSQCLDWPPLPQ-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO Cc1cc(N2CCC[C@@H]2C(C)C)nc[nH+]1 ZINC000334313380 135351348 /nfs/dbraw/zinc/35/13/48/135351348.db2.gz NIORYXIZNMMHNA-LLVKDONJSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1cc(N2CCC3(CCOCC3)CC2)nc[nH+]1 ZINC000343160000 135363993 /nfs/dbraw/zinc/36/39/93/135363993.db2.gz KJKAOUYYLMVHIM-UHFFFAOYSA-N 1 2 247.342 2.182 20 0 BEADLO O=C1OCC[C@@H]1[NH2+][C@H]1CCC[C@H]1c1ccccc1 ZINC000275640764 135367074 /nfs/dbraw/zinc/36/70/74/135367074.db2.gz RXOBDHXPNJRYJJ-IHRRRGAJSA-N 1 2 245.322 2.228 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccnc(C)n1)c1nccs1 ZINC000080263843 135367794 /nfs/dbraw/zinc/36/77/94/135367794.db2.gz AUBOEEIPOBFLJH-LLVKDONJSA-N 1 2 248.355 2.482 20 0 BEADLO Cn1cccc1C[N@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC000334357713 135370065 /nfs/dbraw/zinc/37/00/65/135370065.db2.gz QRDRJNROPHUUFY-UONOGXRCSA-N 1 2 234.343 2.169 20 0 BEADLO C[C@@H]1CC[N@@H+](CCC(C)(C)C)CC[S@@]1=O ZINC000334357762 135370298 /nfs/dbraw/zinc/37/02/98/135370298.db2.gz QTSLBQWKGDXDOS-ABAIWWIYSA-N 1 2 231.405 2.266 20 0 BEADLO c1c[nH]c([C@H]2CCC[N@H+]2CC2CCC2)n1 ZINC000334354276 135370521 /nfs/dbraw/zinc/37/05/21/135370521.db2.gz JMEGIEGVHZUPJE-LLVKDONJSA-N 1 2 205.305 2.347 20 0 BEADLO c1c[nH]c([C@H]2CCC[N@@H+]2CC2CCC2)n1 ZINC000334354276 135370522 /nfs/dbraw/zinc/37/05/22/135370522.db2.gz JMEGIEGVHZUPJE-LLVKDONJSA-N 1 2 205.305 2.347 20 0 BEADLO Cc1nc(N2CC[C@H](CC3CC3)C2)cc[nH+]1 ZINC000334381364 135379617 /nfs/dbraw/zinc/37/96/17/135379617.db2.gz JLOOMOOVGSVTSM-GFCCVEGCSA-N 1 2 217.316 2.411 20 0 BEADLO Cc1ccc(F)c(C[N@@H+]2CC[C@](F)(CO)C2)c1 ZINC000334388789 135384914 /nfs/dbraw/zinc/38/49/14/135384914.db2.gz RCRMZIJMJUHUJT-CYBMUJFWSA-N 1 2 241.281 2.040 20 0 BEADLO Cc1ccc(F)c(C[N@H+]2CC[C@](F)(CO)C2)c1 ZINC000334388789 135384915 /nfs/dbraw/zinc/38/49/15/135384915.db2.gz RCRMZIJMJUHUJT-CYBMUJFWSA-N 1 2 241.281 2.040 20 0 BEADLO O[C@@H]1CCC[C@H](CNc2cccc[nH+]2)C1 ZINC000078305051 135392857 /nfs/dbraw/zinc/39/28/57/135392857.db2.gz WWHSLRQDUWSZGY-WDEREUQCSA-N 1 2 206.289 2.045 20 0 BEADLO C[C@@H]1CCC[C@H](C(=O)N(C)Cc2[nH+]ccn2C)C1 ZINC000334418933 135399295 /nfs/dbraw/zinc/39/92/95/135399295.db2.gz PWGSZDYVCAXGMR-NEPJUHHUSA-N 1 2 249.358 2.205 20 0 BEADLO C[C@H]1CCC[C@H](C(=O)N(C)Cc2[nH+]ccn2C)C1 ZINC000334418939 135399514 /nfs/dbraw/zinc/39/95/14/135399514.db2.gz PWGSZDYVCAXGMR-RYUDHWBXSA-N 1 2 249.358 2.205 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@]1(C)CC=CCC1 ZINC000334549871 135702223 /nfs/dbraw/zinc/70/22/23/135702223.db2.gz WXNSOSNZJVRBIV-CQSZACIVSA-N 1 2 245.326 2.432 20 0 BEADLO Cc1cccc([C@@H](C)[N@H+](C)Cc2nncn2C)c1 ZINC000347631318 135993338 /nfs/dbraw/zinc/99/33/38/135993338.db2.gz BXBUOOYJICBWHX-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cccc([C@@H](C)[N@@H+](C)Cc2nncn2C)c1 ZINC000347631318 135993339 /nfs/dbraw/zinc/99/33/39/135993339.db2.gz BXBUOOYJICBWHX-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO O=C(C1CCCC1)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000335281933 136000336 /nfs/dbraw/zinc/00/03/36/136000336.db2.gz ZJKGPXLBAJHPES-LLVKDONJSA-N 1 2 233.315 2.263 20 0 BEADLO FC(F)n1ccc(C[N@@H+]2C[C@@H]3CCC[C@@H]32)n1 ZINC000347701434 136007150 /nfs/dbraw/zinc/00/71/50/136007150.db2.gz LERNRVOACPRJDB-WPRPVWTQSA-N 1 2 227.258 2.263 20 0 BEADLO FC(F)n1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]32)n1 ZINC000347701434 136007151 /nfs/dbraw/zinc/00/71/51/136007151.db2.gz LERNRVOACPRJDB-WPRPVWTQSA-N 1 2 227.258 2.263 20 0 BEADLO Cc1nc(C[N@@H+](C)CC23CCC(CC2)C3)no1 ZINC000347770499 136008790 /nfs/dbraw/zinc/00/87/90/136008790.db2.gz YHCMOAMLEXZJSL-UHFFFAOYSA-N 1 2 235.331 2.390 20 0 BEADLO Cc1nc(C[N@H+](C)CC23CCC(CC2)C3)no1 ZINC000347770499 136008791 /nfs/dbraw/zinc/00/87/91/136008791.db2.gz YHCMOAMLEXZJSL-UHFFFAOYSA-N 1 2 235.331 2.390 20 0 BEADLO CC[C@H]([NH2+]Cc1ccon1)c1c(C)nn(C)c1C ZINC000347909379 136016072 /nfs/dbraw/zinc/01/60/72/136016072.db2.gz IFBAYGDXHJJTLV-LBPRGKRZSA-N 1 2 248.330 2.266 20 0 BEADLO Cc1ncc(C[NH+]2Cc3ccccc3C2)cn1 ZINC000335316343 136025216 /nfs/dbraw/zinc/02/52/16/136025216.db2.gz DRXJOKOHINWOJN-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO Cc1cccnc1C[N@@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000335312881 136030788 /nfs/dbraw/zinc/03/07/88/136030788.db2.gz DEZREIPZSABCJK-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccnc1C[N@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000335312881 136030789 /nfs/dbraw/zinc/03/07/89/136030789.db2.gz DEZREIPZSABCJK-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO CC(C)c1nc(N[C@H]2C[C@H]2C(F)F)cc[nH+]1 ZINC000348113308 136037102 /nfs/dbraw/zinc/03/71/02/136037102.db2.gz FWBXTBMFSPPLHZ-SFYZADRCSA-N 1 2 227.258 2.087 20 0 BEADLO CC[C@H](F)C[N@@H+]1CCC[C@H]1c1cc[nH]n1 ZINC000348147609 136039315 /nfs/dbraw/zinc/03/93/15/136039315.db2.gz GTLAJBBCRNGMDN-ONGXEEELSA-N 1 2 211.284 2.295 20 0 BEADLO CC[C@H](F)C[N@H+]1CCC[C@H]1c1cc[nH]n1 ZINC000348147609 136039316 /nfs/dbraw/zinc/03/93/16/136039316.db2.gz GTLAJBBCRNGMDN-ONGXEEELSA-N 1 2 211.284 2.295 20 0 BEADLO Cc1c(NCCCc2c[nH+]ccc2C)cnn1C ZINC000348145559 136039515 /nfs/dbraw/zinc/03/95/15/136039515.db2.gz SKBWIEDNIGUSFC-UHFFFAOYSA-N 1 2 244.342 2.477 20 0 BEADLO Cc1nnc(C[N@@H+]2CC[C@H]2c2ccccc2)[nH]1 ZINC000335337563 136044773 /nfs/dbraw/zinc/04/47/73/136044773.db2.gz WRBYGHFKJAUTQB-LBPRGKRZSA-N 1 2 228.299 2.060 20 0 BEADLO Cc1nnc(C[N@H+]2CC[C@H]2c2ccccc2)[nH]1 ZINC000335337563 136044774 /nfs/dbraw/zinc/04/47/74/136044774.db2.gz WRBYGHFKJAUTQB-LBPRGKRZSA-N 1 2 228.299 2.060 20 0 BEADLO Cc1cc(C)c(NC(=O)Cc2ccon2)c(C)[nH+]1 ZINC000335338868 136045211 /nfs/dbraw/zinc/04/52/11/136045211.db2.gz NCZPKJVAXJVEHX-UHFFFAOYSA-N 1 2 245.282 2.176 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@@H](C3CC3)C2)cn1 ZINC000348189939 136048491 /nfs/dbraw/zinc/04/84/91/136048491.db2.gz ZATCHHYKSIIGAS-OAHLLOKOSA-N 1 2 246.354 2.255 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@@H](C3CC3)C2)cn1 ZINC000348189939 136048492 /nfs/dbraw/zinc/04/84/92/136048492.db2.gz ZATCHHYKSIIGAS-OAHLLOKOSA-N 1 2 246.354 2.255 20 0 BEADLO C[C@H](O)CN(C)c1[nH+]ccc2cc(F)ccc21 ZINC000335348220 136067617 /nfs/dbraw/zinc/06/76/17/136067617.db2.gz HNACWGTYMORGJV-VIFPVBQESA-N 1 2 234.274 2.191 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)C1CC(C)(C)C1 ZINC000348313235 136067661 /nfs/dbraw/zinc/06/76/61/136067661.db2.gz GOBRGXACVJJEBP-UHFFFAOYSA-N 1 2 248.326 2.143 20 0 BEADLO CCCC1(C(=O)NCc2c[nH+]ccc2OC)CC1 ZINC000348346096 136071666 /nfs/dbraw/zinc/07/16/66/136071666.db2.gz VTZNOZGRBOWPIA-UHFFFAOYSA-N 1 2 248.326 2.287 20 0 BEADLO Cc1cc(N(C)Cc2ncc[nH]2)nc(C(C)C)[nH+]1 ZINC000348365687 136073454 /nfs/dbraw/zinc/07/34/54/136073454.db2.gz OMBYFBDZOIDIFX-UHFFFAOYSA-N 1 2 245.330 2.268 20 0 BEADLO F[C@H]1CCN(c2cc[nH+]c3ccncc32)C1 ZINC000335401912 136082484 /nfs/dbraw/zinc/08/24/84/136082484.db2.gz WPEQUDHGTSPWFB-VIFPVBQESA-N 1 2 217.247 2.178 20 0 BEADLO Cn1cc(Cl)c(C[N@@H+]2CCC23CCC3)n1 ZINC000335387726 136089587 /nfs/dbraw/zinc/08/95/87/136089587.db2.gz SNNMRBSHYWRDGL-UHFFFAOYSA-N 1 2 225.723 2.202 20 0 BEADLO Cn1cc(Cl)c(C[N@H+]2CCC23CCC3)n1 ZINC000335387726 136089588 /nfs/dbraw/zinc/08/95/88/136089588.db2.gz SNNMRBSHYWRDGL-UHFFFAOYSA-N 1 2 225.723 2.202 20 0 BEADLO c1ccc(N2CC[C@H](c3cccnc3)C2)[nH+]c1 ZINC000335398917 136093530 /nfs/dbraw/zinc/09/35/30/136093530.db2.gz YQTHTBHZJPRCRO-ZDUSSCGKSA-N 1 2 225.295 2.471 20 0 BEADLO Cc1ncc(C[N@@H+]2CCC[C@](C)(F)C2)cn1 ZINC000335364112 136094832 /nfs/dbraw/zinc/09/48/32/136094832.db2.gz VPBULYMPSGLDSH-LBPRGKRZSA-N 1 2 223.295 2.109 20 0 BEADLO Cc1ncc(C[N@H+]2CCC[C@](C)(F)C2)cn1 ZINC000335364112 136094833 /nfs/dbraw/zinc/09/48/33/136094833.db2.gz VPBULYMPSGLDSH-LBPRGKRZSA-N 1 2 223.295 2.109 20 0 BEADLO C[C@@H]1CCN(C(=O)C(C)(C)c2c[nH+]c[nH]2)[C@H](C)C1 ZINC000335551035 136098008 /nfs/dbraw/zinc/09/80/08/136098008.db2.gz ZEUHXSFRFXEBLW-GHMZBOCLSA-N 1 2 249.358 2.334 20 0 BEADLO FC(F)C1CC[NH+](Cc2csnn2)CC1 ZINC000335556089 136099487 /nfs/dbraw/zinc/09/94/87/136099487.db2.gz XYWBZGZOQTVUKM-UHFFFAOYSA-N 1 2 233.287 2.015 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@@H](C)c2csnn2)CCS1 ZINC000335579080 136111933 /nfs/dbraw/zinc/11/19/33/136111933.db2.gz IMGHZNUCLBFILY-DTWKUNHWSA-N 1 2 243.401 2.427 20 0 BEADLO CC[C@@H]1C[N@H+]([C@@H](C)c2csnn2)CCS1 ZINC000335579080 136111934 /nfs/dbraw/zinc/11/19/34/136111934.db2.gz IMGHZNUCLBFILY-DTWKUNHWSA-N 1 2 243.401 2.427 20 0 BEADLO Nc1c(Cl)cccc1C[NH2+]Cc1ccon1 ZINC001647035958 1172750400 /nfs/dbraw/zinc/75/04/00/1172750400.db2.gz OCXWRUWCVTXSTE-UHFFFAOYSA-N 1 2 237.690 2.200 20 0 BEADLO CC(C)n1cc(C[NH2+][C@@H](C)c2ccccn2)nn1 ZINC000289693995 397739962 /nfs/dbraw/zinc/73/99/62/397739962.db2.gz KHLHBFCERLMDMW-NSHDSACASA-N 1 2 245.330 2.105 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NC1(C2CCC2)CCC1 ZINC000570414401 397744642 /nfs/dbraw/zinc/74/46/42/397744642.db2.gz QWOJMYNCTMCPEM-UHFFFAOYSA-N 1 2 247.342 2.181 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NC1(C2CCC2)CCC1 ZINC000570414401 397744644 /nfs/dbraw/zinc/74/46/44/397744644.db2.gz QWOJMYNCTMCPEM-UHFFFAOYSA-N 1 2 247.342 2.181 20 0 BEADLO CCCC[C@@H]([NH2+][C@@H]1C[C@H]1C1CC1)C(=O)OC ZINC000378672165 397826278 /nfs/dbraw/zinc/82/62/78/397826278.db2.gz LAWAOYUOLRJIJL-QJPTWQEYSA-N 1 2 225.332 2.106 20 0 BEADLO CC(C)(C)c1cnc(C[N@@H+]2CCCOCC2)o1 ZINC000336349210 397936123 /nfs/dbraw/zinc/93/61/23/397936123.db2.gz RKZDCDGPZRAYGQ-UHFFFAOYSA-N 1 2 238.331 2.194 20 0 BEADLO CC(C)(C)c1cnc(C[N@H+]2CCCOCC2)o1 ZINC000336349210 397936126 /nfs/dbraw/zinc/93/61/26/397936126.db2.gz RKZDCDGPZRAYGQ-UHFFFAOYSA-N 1 2 238.331 2.194 20 0 BEADLO CC(C)C[C@@H]1CCN(C(=O)CCn2cc[nH+]c2)C1 ZINC000266681850 397938708 /nfs/dbraw/zinc/93/87/08/397938708.db2.gz LGJNPEQWSIWLIO-ZDUSSCGKSA-N 1 2 249.358 2.168 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C=C1CCCCC1 ZINC000266983637 397942640 /nfs/dbraw/zinc/94/26/40/397942640.db2.gz RFAIYZBETXSZQE-UHFFFAOYSA-N 1 2 233.315 2.225 20 0 BEADLO CCO/C=C\C(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000493528020 397955820 /nfs/dbraw/zinc/95/58/20/397955820.db2.gz PJNBRESRYHNZSA-SDKXAQGSSA-N 1 2 249.314 2.014 20 0 BEADLO CCOCCCCNc1[nH+]cccc1OC ZINC000388422366 397896116 /nfs/dbraw/zinc/89/61/16/397896116.db2.gz IKDYKUGALNVCFF-UHFFFAOYSA-N 1 2 224.304 2.319 20 0 BEADLO CC(C)c1nc(NCCCn2cccn2)cc[nH+]1 ZINC000110128812 397902923 /nfs/dbraw/zinc/90/29/23/397902923.db2.gz CBTXJUDDSJKHSU-UHFFFAOYSA-N 1 2 245.330 2.299 20 0 BEADLO CC(C)c1nc(N(C)C[C@@H]2CCCOC2)cc[nH+]1 ZINC000110587163 397904759 /nfs/dbraw/zinc/90/47/59/397904759.db2.gz YCEYIVNHRQHJCA-LBPRGKRZSA-N 1 2 249.358 2.463 20 0 BEADLO FC1(F)CC[C@@H](COCc2[nH]cc[nH+]2)C1 ZINC000649528074 397919740 /nfs/dbraw/zinc/91/97/40/397919740.db2.gz FTTCJJKMRHPERO-MRVPVSSYSA-N 1 2 216.231 2.362 20 0 BEADLO C[C@@H](CNc1cc[nH+]c(C2CC2)n1)C(F)(F)F ZINC000355784102 397922102 /nfs/dbraw/zinc/92/21/02/397922102.db2.gz NXCATUMFHJGYHP-ZETCQYMHSA-N 1 2 245.248 2.386 20 0 BEADLO CC(C)CCN(C)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000649598953 397989926 /nfs/dbraw/zinc/98/99/26/397989926.db2.gz HACXPPSDXOBAPN-GFCCVEGCSA-N 1 2 237.347 2.339 20 0 BEADLO CC[C@@H]1CCCCN1C(=O)Cc1[nH]c[nH+]c1C ZINC000279292938 398044205 /nfs/dbraw/zinc/04/42/05/398044205.db2.gz YIGPQCCTFJDKIH-LLVKDONJSA-N 1 2 235.331 2.052 20 0 BEADLO CC(=O)C[N@@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000639876247 397999675 /nfs/dbraw/zinc/99/96/75/397999675.db2.gz BPZKXMCTLARGSY-LBPRGKRZSA-N 1 2 218.300 2.054 20 0 BEADLO CC(=O)C[N@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000639876247 397999676 /nfs/dbraw/zinc/99/96/76/397999676.db2.gz BPZKXMCTLARGSY-LBPRGKRZSA-N 1 2 218.300 2.054 20 0 BEADLO CCC[C@@H]1CCC[C@@H]1c1nc(C[NH2+]C)no1 ZINC000414648110 398001304 /nfs/dbraw/zinc/00/13/04/398001304.db2.gz VECLUDGCDSAGTD-ZJUUUORDSA-N 1 2 223.320 2.473 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@@H](OC(C)C)C2)nc1 ZINC000649702650 398049809 /nfs/dbraw/zinc/04/98/09/398049809.db2.gz JTNZIDXPSDUXNM-CYBMUJFWSA-N 1 2 249.358 2.174 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@@H](OC(C)C)C2)nc1 ZINC000649702650 398049814 /nfs/dbraw/zinc/04/98/14/398049814.db2.gz JTNZIDXPSDUXNM-CYBMUJFWSA-N 1 2 249.358 2.174 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ncn(C)n1)c1cccc(F)c1 ZINC000275598729 398041000 /nfs/dbraw/zinc/04/10/00/398041000.db2.gz IYESIOPREACWSR-ZJUUUORDSA-N 1 2 248.305 2.366 20 0 BEADLO COCC[C@@H](C)[N@@H+]1CCCC(F)(F)C1 ZINC000649693797 398041131 /nfs/dbraw/zinc/04/11/31/398041131.db2.gz RHOHESQASCVAQJ-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO COCC[C@@H](C)[N@H+]1CCCC(F)(F)C1 ZINC000649693797 398041133 /nfs/dbraw/zinc/04/11/33/398041133.db2.gz RHOHESQASCVAQJ-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CCC1(CC)CCN(C(=O)Cc2c[nH+]cn2C)C1 ZINC000582624803 398041406 /nfs/dbraw/zinc/04/14/06/398041406.db2.gz GWRBCWHTKNOORG-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO Cc1cc(C)cc(CCNc2cc[nH+]c(C)n2)c1 ZINC000361042738 397971588 /nfs/dbraw/zinc/97/15/88/397971588.db2.gz CJYSPZJYGVBFQO-UHFFFAOYSA-N 1 2 241.338 2.478 20 0 BEADLO CO[C@@H]1[C@H](C)[C@@H](Nc2cc[nH+]c(C)n2)C1(C)C ZINC000271754772 397973157 /nfs/dbraw/zinc/97/31/57/397973157.db2.gz CPSGNYTURIVRSM-GGZOMVNGSA-N 1 2 235.331 2.256 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N1CCC[C@H]2CCC[C@@H]21 ZINC000279262253 398042145 /nfs/dbraw/zinc/04/21/45/398042145.db2.gz VEJRLFZARVQSKH-NEPJUHHUSA-N 1 2 247.342 2.133 20 0 BEADLO C[C@H]1CC[C@@H](C[N@@H+]2CCCC(F)(F)C2)O1 ZINC000649695283 398042932 /nfs/dbraw/zinc/04/29/32/398042932.db2.gz PQQWJEYSARXHOS-UWVGGRQHSA-N 1 2 219.275 2.285 20 0 BEADLO C[C@H]1CC[C@@H](C[N@H+]2CCCC(F)(F)C2)O1 ZINC000649695283 398042936 /nfs/dbraw/zinc/04/29/36/398042936.db2.gz PQQWJEYSARXHOS-UWVGGRQHSA-N 1 2 219.275 2.285 20 0 BEADLO FC1=CCC[N@H+](Cc2cccc3c2OCO3)C1 ZINC000272766965 397987128 /nfs/dbraw/zinc/98/71/28/397987128.db2.gz MIDGKCXFMDPLEP-UHFFFAOYSA-N 1 2 235.258 2.474 20 0 BEADLO FC1=CCC[N@@H+](Cc2cccc3c2OCO3)C1 ZINC000272766965 397987133 /nfs/dbraw/zinc/98/71/33/397987133.db2.gz MIDGKCXFMDPLEP-UHFFFAOYSA-N 1 2 235.258 2.474 20 0 BEADLO CC[C@H](C[N@@H+]1CCCC(F)(F)C1)OC ZINC000649695649 398044105 /nfs/dbraw/zinc/04/41/05/398044105.db2.gz CVMNOPDMHBUZEK-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CC[C@H](C[N@H+]1CCCC(F)(F)C1)OC ZINC000649695649 398044107 /nfs/dbraw/zinc/04/41/07/398044107.db2.gz CVMNOPDMHBUZEK-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccno2)[C@@H](CC)CO1 ZINC000649718940 398061635 /nfs/dbraw/zinc/06/16/35/398061635.db2.gz JIQHBRQDVQUKQJ-WDEREUQCSA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccno2)[C@@H](CC)CO1 ZINC000649718940 398061637 /nfs/dbraw/zinc/06/16/37/398061637.db2.gz JIQHBRQDVQUKQJ-WDEREUQCSA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@H]1C[N@H+](Cc2nc(C)c(C)o2)[C@H](C)CO1 ZINC000649731629 398070880 /nfs/dbraw/zinc/07/08/80/398070880.db2.gz KHUIUKDKFKBWOV-SKDRFNHKSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2nc(C)c(C)o2)[C@H](C)CO1 ZINC000649731629 398070885 /nfs/dbraw/zinc/07/08/85/398070885.db2.gz KHUIUKDKFKBWOV-SKDRFNHKSA-N 1 2 238.331 2.291 20 0 BEADLO Cc1csc(C[NH2+]Cc2ccc(C)cn2)n1 ZINC000087782205 398072226 /nfs/dbraw/zinc/07/22/26/398072226.db2.gz FADQMGGCEPXSGP-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccncc2F)[C@H](C)CO1 ZINC000649737064 398079940 /nfs/dbraw/zinc/07/99/40/398079940.db2.gz QFSGCTNNKKLUNK-ZYHUDNBSSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccncc2F)[C@H](C)CO1 ZINC000649737064 398079943 /nfs/dbraw/zinc/07/99/43/398079943.db2.gz QFSGCTNNKKLUNK-ZYHUDNBSSA-N 1 2 238.306 2.220 20 0 BEADLO CCc1csc(N[C@H](C)Cn2cc[nH+]c2)n1 ZINC000061894602 398108763 /nfs/dbraw/zinc/10/87/63/398108763.db2.gz BETWORKVPZOPFK-SECBINFHSA-N 1 2 236.344 2.403 20 0 BEADLO CC(C)(C)C[C@@H]1C[C@H]1C(=O)NCCc1[nH]cc[nH+]1 ZINC000648777973 398114764 /nfs/dbraw/zinc/11/47/64/398114764.db2.gz GESGUVDRCJZCHT-WDEREUQCSA-N 1 2 249.358 2.141 20 0 BEADLO CC/C(C)=C/C(=O)Nc1ccc[nH+]c1N(C)C ZINC000294470459 398126919 /nfs/dbraw/zinc/12/69/19/398126919.db2.gz IPYQNFBVNUZIEF-MDZDMXLPSA-N 1 2 233.315 2.442 20 0 BEADLO C[C@H]([NH2+]Cc1c[nH]nn1)[C@@H]1CCCC[C@H]1C ZINC000649831503 398130867 /nfs/dbraw/zinc/13/08/67/398130867.db2.gz VUQJMCABTVQSJQ-JFGNBEQYSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@H]([NH2+]Cc1cn[nH]n1)[C@@H]1CCCC[C@H]1C ZINC000649831503 398130869 /nfs/dbraw/zinc/13/08/69/398130869.db2.gz VUQJMCABTVQSJQ-JFGNBEQYSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@@H]([NH2+]Cc1c[nH]nn1)[C@@H]1CCCC[C@H]1C ZINC000649831501 398130878 /nfs/dbraw/zinc/13/08/78/398130878.db2.gz VUQJMCABTVQSJQ-CKYFFXLPSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@@H]([NH2+]Cc1cn[nH]n1)[C@@H]1CCCC[C@H]1C ZINC000649831501 398130880 /nfs/dbraw/zinc/13/08/80/398130880.db2.gz VUQJMCABTVQSJQ-CKYFFXLPSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@H]1CC(=O)CC[N@@H+]1Cc1ccsc1 ZINC000063153010 1172803098 /nfs/dbraw/zinc/80/30/98/1172803098.db2.gz LLOWSHZTZJAAMQ-VIFPVBQESA-N 1 2 209.314 2.302 20 0 BEADLO C[C@H]1CC(=O)CC[N@H+]1Cc1ccsc1 ZINC000063153010 1172803103 /nfs/dbraw/zinc/80/31/03/1172803103.db2.gz LLOWSHZTZJAAMQ-VIFPVBQESA-N 1 2 209.314 2.302 20 0 BEADLO CCc1cnc(C[N@@H+]2CCCOC[C@@H]2C)s1 ZINC000680330495 487564498 /nfs/dbraw/zinc/56/44/98/487564498.db2.gz ZWAKEFANTAEYQA-JTQLQIEISA-N 1 2 240.372 2.316 20 0 BEADLO CCc1cnc(C[N@H+]2CCCOC[C@@H]2C)s1 ZINC000680330495 487564501 /nfs/dbraw/zinc/56/45/01/487564501.db2.gz ZWAKEFANTAEYQA-JTQLQIEISA-N 1 2 240.372 2.316 20 0 BEADLO CCc1cc(NC2CCC(OC)CC2)nc[nH+]1 ZINC000665735984 487577621 /nfs/dbraw/zinc/57/76/21/487577621.db2.gz UPZCKAJKKISEEK-UHFFFAOYSA-N 1 2 235.331 2.409 20 0 BEADLO Cc1occc1CN(C)C(=O)[C@H](C)n1cc[nH+]c1 ZINC000065689999 1172944929 /nfs/dbraw/zinc/94/49/29/1172944929.db2.gz WHBUNMAEMIIZHY-JTQLQIEISA-N 1 2 247.298 2.004 20 0 BEADLO Fc1cc2c(cc1F)C[NH+](C[C@H]1CCCO1)C2 ZINC000653833097 487595700 /nfs/dbraw/zinc/59/57/00/487595700.db2.gz ZXULFORTXNXHMJ-LLVKDONJSA-N 1 2 239.265 2.459 20 0 BEADLO C[C@H]1C[N@H+](CC2(F)CC2)C[C@](C)(C(F)F)O1 ZINC000668821630 487597462 /nfs/dbraw/zinc/59/74/62/487597462.db2.gz IRUXMNXZKQSZIP-WCBMZHEXSA-N 1 2 237.265 2.233 20 0 BEADLO C[C@H]1C[N@@H+](CC2(F)CC2)C[C@](C)(C(F)F)O1 ZINC000668821630 487597464 /nfs/dbraw/zinc/59/74/64/487597464.db2.gz IRUXMNXZKQSZIP-WCBMZHEXSA-N 1 2 237.265 2.233 20 0 BEADLO CC[C@H](Nc1ccc(OC)c[nH+]1)c1ccn(C)n1 ZINC000680469019 487601837 /nfs/dbraw/zinc/60/18/37/487601837.db2.gz WYSVZDYVDLCZQI-NSHDSACASA-N 1 2 246.314 2.387 20 0 BEADLO Cc1cc(NCC2(O)CCC(C)CC2)nc[nH+]1 ZINC000087066828 487603459 /nfs/dbraw/zinc/60/34/59/487603459.db2.gz DLBXYMTZPAIRND-UHFFFAOYSA-N 1 2 235.331 2.138 20 0 BEADLO C[N@H+](CCC1CCCCC1)Cc1n[nH]c(=O)o1 ZINC000660848040 409859241 /nfs/dbraw/zinc/85/92/41/409859241.db2.gz UMOPAOGDLWYHHS-UHFFFAOYSA-N 1 2 239.319 2.177 20 0 BEADLO C[N@@H+](CCC1CCCCC1)Cc1n[nH]c(=O)o1 ZINC000660848040 409859243 /nfs/dbraw/zinc/85/92/43/409859243.db2.gz UMOPAOGDLWYHHS-UHFFFAOYSA-N 1 2 239.319 2.177 20 0 BEADLO CC(C)C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000047514895 409893014 /nfs/dbraw/zinc/89/30/14/409893014.db2.gz QZAJEJVWAOHVGJ-UHFFFAOYSA-N 1 2 229.283 2.467 20 0 BEADLO COC[C@H](C)CNc1[nH+]cccc1SC ZINC000651971482 409944294 /nfs/dbraw/zinc/94/42/94/409944294.db2.gz HKTYWJABFWJTCP-SECBINFHSA-N 1 2 226.345 2.498 20 0 BEADLO CN(CC1(O)CCC1)c1cc[nH+]c(C(C)(C)C)n1 ZINC000680529993 487612596 /nfs/dbraw/zinc/61/25/96/487612596.db2.gz GEUSPQZWWYDJKP-UHFFFAOYSA-N 1 2 249.358 2.125 20 0 BEADLO COc1ccncc1C[N@@H+]1CCC[C@@H]1CF ZINC000293088559 410076136 /nfs/dbraw/zinc/07/61/36/410076136.db2.gz PJKANTGKYAVIHX-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO COc1ccncc1C[N@H+]1CCC[C@@H]1CF ZINC000293088559 410076147 /nfs/dbraw/zinc/07/61/47/410076147.db2.gz PJKANTGKYAVIHX-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO CCc1cc[nH+]cc1NCc1csnn1 ZINC000651979200 410111876 /nfs/dbraw/zinc/11/18/76/410111876.db2.gz BPEBHNYORSDSLY-UHFFFAOYSA-N 1 2 220.301 2.108 20 0 BEADLO CCc1cc[nH+]cc1N[C@H]1CCCOC1 ZINC000651979374 410112532 /nfs/dbraw/zinc/11/25/32/410112532.db2.gz MIIGXCOEYXSVRX-NSHDSACASA-N 1 2 206.289 2.235 20 0 BEADLO CCc1cc[nH+]cc1NC[C@@H](C)COC ZINC000651979345 410112667 /nfs/dbraw/zinc/11/26/67/410112667.db2.gz KNNWFTVRQIFQDV-SNVBAGLBSA-N 1 2 208.305 2.338 20 0 BEADLO CCc1cc[nH+]cc1NC1CCN(C(C)=O)CC1 ZINC000651979381 410113074 /nfs/dbraw/zinc/11/30/74/410113074.db2.gz MSENMLUHHAOKIG-UHFFFAOYSA-N 1 2 247.342 2.067 20 0 BEADLO Cc1cnn(CCCCCn2cc[nH+]c2)c1 ZINC000111197009 410217880 /nfs/dbraw/zinc/21/78/80/410217880.db2.gz JWCIDMVJFPZGSU-UHFFFAOYSA-N 1 2 218.304 2.259 20 0 BEADLO Cc1noc(Cn2c(C)[nH+]c3ccccc32)n1 ZINC000106074030 410173911 /nfs/dbraw/zinc/17/39/11/410173911.db2.gz SZDWGWLQNPMDNJ-UHFFFAOYSA-N 1 2 228.255 2.084 20 0 BEADLO C[C@@H](NC(=O)C1CC2(CCC2)C1)c1[nH]cc[nH+]1 ZINC000655402429 410209138 /nfs/dbraw/zinc/20/91/38/410209138.db2.gz HNLKHUCSTYSNRZ-SECBINFHSA-N 1 2 233.315 2.167 20 0 BEADLO Cc1cn2ccc(C(=O)NCCC(C)C)cc2[nH+]1 ZINC000071540824 410415954 /nfs/dbraw/zinc/41/59/54/410415954.db2.gz BTGQGQLAOZINJY-UHFFFAOYSA-N 1 2 245.326 2.419 20 0 BEADLO Cc1cn2ccc(C(=O)NC3CCCC3)cc2[nH+]1 ZINC000071540737 410416960 /nfs/dbraw/zinc/41/69/60/410416960.db2.gz HGXAWRIDAFCBHH-UHFFFAOYSA-N 1 2 243.310 2.315 20 0 BEADLO CCc1cc(C)nc(N[C@H](C)c2[nH]cc[nH+]2)n1 ZINC000663929759 410385025 /nfs/dbraw/zinc/38/50/25/410385025.db2.gz LGOKZANTLMOWPU-SECBINFHSA-N 1 2 231.303 2.244 20 0 BEADLO CCc1nc(N2CC[C@@H]2C(F)F)cc(C)[nH+]1 ZINC000663944382 410392795 /nfs/dbraw/zinc/39/27/95/410392795.db2.gz AEKVHWARRKDUDZ-MRVPVSSYSA-N 1 2 227.258 2.191 20 0 BEADLO C[C@H]1COCCN1c1[nH+]ccc2c(N)cccc21 ZINC000663948571 410396723 /nfs/dbraw/zinc/39/67/23/410396723.db2.gz ADXBYERLHJNWIH-JTQLQIEISA-N 1 2 243.310 2.042 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)c1csc(C)c1 ZINC000650787646 410434984 /nfs/dbraw/zinc/43/49/84/410434984.db2.gz MXYHEEWGRRPSQG-UHFFFAOYSA-N 1 2 249.339 2.203 20 0 BEADLO C[C@@H](NC(=O)CCCn1cc[nH+]c1)C(C)(C)C ZINC000650865303 410537310 /nfs/dbraw/zinc/53/73/10/410537310.db2.gz CXDUGCSRCMZHPU-LLVKDONJSA-N 1 2 237.347 2.214 20 0 BEADLO CC(C)(C)CC(=O)NCc1ccn2cc[nH+]c2c1 ZINC000178363859 166549196 /nfs/dbraw/zinc/54/91/96/166549196.db2.gz DSUBDXZXYRGZDN-UHFFFAOYSA-N 1 2 245.326 2.387 20 0 BEADLO CO[C@@H](C)c1noc(C[N@@H+]2CCC(C)(C)C2)n1 ZINC000175281655 410622542 /nfs/dbraw/zinc/62/25/42/410622542.db2.gz XGHYMCJKSBKRCT-VIFPVBQESA-N 1 2 239.319 2.009 20 0 BEADLO CO[C@@H](C)c1noc(C[N@H+]2CCC(C)(C)C2)n1 ZINC000175281655 410622551 /nfs/dbraw/zinc/62/25/51/410622551.db2.gz XGHYMCJKSBKRCT-VIFPVBQESA-N 1 2 239.319 2.009 20 0 BEADLO c1n[nH]c2c1C[N@H+](C[C@@H]1C[C@H]3C[C@H]3C1)CCC2 ZINC000664861270 410640357 /nfs/dbraw/zinc/64/03/57/410640357.db2.gz PXZDVNMCPREOGL-ZSBIGDGJSA-N 1 2 231.343 2.204 20 0 BEADLO c1n[nH]c2c1C[N@@H+](C[C@@H]1C[C@H]3C[C@H]3C1)CCC2 ZINC000664861270 410640366 /nfs/dbraw/zinc/64/03/66/410640366.db2.gz PXZDVNMCPREOGL-ZSBIGDGJSA-N 1 2 231.343 2.204 20 0 BEADLO CCc1cc(NCc2cc(C)cs2)nc[nH+]1 ZINC000393355539 410677377 /nfs/dbraw/zinc/67/73/77/410677377.db2.gz UFKYDWJGKLLWPP-UHFFFAOYSA-N 1 2 233.340 2.443 20 0 BEADLO CC(C)CC[NH2+]c1ccc(-n2cnnn2)cc1 ZINC000020094290 166867715 /nfs/dbraw/zinc/86/77/15/166867715.db2.gz MOGNWOTUEFAVEX-UHFFFAOYSA-N 1 2 231.303 2.120 20 0 BEADLO C[C@@H](c1ccccc1)[C@H](O)C[NH+]1CC(C)(F)C1 ZINC000651136249 410831660 /nfs/dbraw/zinc/83/16/60/410831660.db2.gz UAOXWQMHTICURL-WCQYABFASA-N 1 2 237.318 2.195 20 0 BEADLO C[C@H](CC(=O)N1CCC[C@H]1C1CC1)n1cc[nH+]c1 ZINC000651254350 410886352 /nfs/dbraw/zinc/88/63/52/410886352.db2.gz MUYIGLMTAICCHL-YPMHNXCESA-N 1 2 247.342 2.235 20 0 BEADLO CN(c1cc(CO)cc[nH+]1)C1CCCCC1 ZINC000040864510 410895630 /nfs/dbraw/zinc/89/56/30/410895630.db2.gz RKYWFSKNUQNSFQ-UHFFFAOYSA-N 1 2 220.316 2.343 20 0 BEADLO CCCCN(CC)c1cc(CO)cc[nH+]1 ZINC000040864431 410896709 /nfs/dbraw/zinc/89/67/09/410896709.db2.gz ZXMVGHJGUZFRFR-UHFFFAOYSA-N 1 2 208.305 2.200 20 0 BEADLO CC(C)C[NH2+][C@@H](c1cn[nH]n1)c1ccc(F)cc1 ZINC000340477030 167013223 /nfs/dbraw/zinc/01/32/23/167013223.db2.gz WHVQMMYNACVBIY-CYBMUJFWSA-N 1 2 248.305 2.279 20 0 BEADLO CC(C)C[NH2+][C@@H](c1c[nH]nn1)c1ccc(F)cc1 ZINC000340477030 167013226 /nfs/dbraw/zinc/01/32/26/167013226.db2.gz WHVQMMYNACVBIY-CYBMUJFWSA-N 1 2 248.305 2.279 20 0 BEADLO CC(C)CNc1cc(NCC2CC2)nc[nH+]1 ZINC000301297659 167016955 /nfs/dbraw/zinc/01/69/55/167016955.db2.gz SNDBOSSKEFHRLH-UHFFFAOYSA-N 1 2 220.320 2.366 20 0 BEADLO CC(C)CNc1cc(NCC2CC2)[nH+]cn1 ZINC000301297659 167016956 /nfs/dbraw/zinc/01/69/56/167016956.db2.gz SNDBOSSKEFHRLH-UHFFFAOYSA-N 1 2 220.320 2.366 20 0 BEADLO CC(C)NC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000106509441 167069707 /nfs/dbraw/zinc/06/97/07/167069707.db2.gz LHFGCOGNBWTZHI-SNVBAGLBSA-N 1 2 236.319 2.055 20 0 BEADLO C[C@H]1CC[C@H](C(=O)N(C)Cc2[nH]cc[nH+]2)CC1 ZINC000651292063 410902806 /nfs/dbraw/zinc/90/28/06/410902806.db2.gz BENCEYOAAXNAPK-XYPYZODXSA-N 1 2 235.331 2.194 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)[C@@H]1C[C@@H]1C1CCCC1 ZINC000651292535 410902925 /nfs/dbraw/zinc/90/29/25/410902925.db2.gz NVTNZKVYSJXCJI-VXGBXAGGSA-N 1 2 247.342 2.194 20 0 BEADLO CC(C)OCCC(=O)Nc1cccc2[nH+]ccn21 ZINC000266164549 167200781 /nfs/dbraw/zinc/20/07/81/167200781.db2.gz QDZVYXHVFMHKPH-UHFFFAOYSA-N 1 2 247.298 2.088 20 0 BEADLO CC(C)Oc1ncccc1NCc1[nH]cc[nH+]1 ZINC000049715682 167314809 /nfs/dbraw/zinc/31/48/09/167314809.db2.gz IEXYVKFMBJUBBF-UHFFFAOYSA-N 1 2 232.287 2.204 20 0 BEADLO CC(C)Oc1ncccc1OCc1c[nH+]cn1C ZINC000361917955 167315390 /nfs/dbraw/zinc/31/53/90/167315390.db2.gz VQNFGHXEXSTVOA-UHFFFAOYSA-N 1 2 247.298 2.181 20 0 BEADLO CC(C)[C@@H](C)C(=O)N[C@H](c1[nH+]ccn1C)C1CC1 ZINC000341717017 167352480 /nfs/dbraw/zinc/35/24/80/167352480.db2.gz IBMLUYOSRKKPQS-PWSUYJOCSA-N 1 2 249.358 2.280 20 0 BEADLO CC(C)[C@@H](C)[N@H+](C)Cc1noc(C2CC2)n1 ZINC000341837206 167368586 /nfs/dbraw/zinc/36/85/86/167368586.db2.gz MUKLFNZDINFSEC-SECBINFHSA-N 1 2 223.320 2.423 20 0 BEADLO CC(C)[C@@H](C)[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000341837206 167368587 /nfs/dbraw/zinc/36/85/87/167368587.db2.gz MUKLFNZDINFSEC-SECBINFHSA-N 1 2 223.320 2.423 20 0 BEADLO CC(C)[C@@H](CC(F)(F)F)[NH2+]Cc1ccn[nH]1 ZINC000336657428 167389362 /nfs/dbraw/zinc/38/93/62/167389362.db2.gz IJUKKWMTVZXZRP-SECBINFHSA-N 1 2 235.253 2.476 20 0 BEADLO Cc1nc(N2CCC[C@@H](OC(C)C)C2)cc[nH+]1 ZINC000651386231 410971154 /nfs/dbraw/zinc/97/11/54/410971154.db2.gz HHSIESGLWPTTAT-GFCCVEGCSA-N 1 2 235.331 2.179 20 0 BEADLO CC(C)[C@@H]1CCCN(C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000356804753 167468200 /nfs/dbraw/zinc/46/82/00/167468200.db2.gz OQVUKWYLDPIPBK-GFCCVEGCSA-N 1 2 249.358 2.237 20 0 BEADLO CC[C@H]1COC(C)(C)CN1c1cc[nH+]c(C)n1 ZINC000651396968 410978608 /nfs/dbraw/zinc/97/86/08/410978608.db2.gz HYAQWTJCLHBKNY-NSHDSACASA-N 1 2 235.331 2.179 20 0 BEADLO CC[C@@H]1CN(c2cc(C)[nH+]cn2)[C@H](CC)CO1 ZINC000651396755 410978799 /nfs/dbraw/zinc/97/87/99/410978799.db2.gz CBIVLTKMNRAJKJ-VXGBXAGGSA-N 1 2 235.331 2.179 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)CN1c1cc[nH+]c(C)n1 ZINC000651397595 410980500 /nfs/dbraw/zinc/98/05/00/410980500.db2.gz TVDTUIRPWXKZMK-NEPJUHHUSA-N 1 2 235.331 2.179 20 0 BEADLO Cc1nc(N[C@@H](C2CC2)C2CCOCC2)cc[nH+]1 ZINC000651402966 410984924 /nfs/dbraw/zinc/98/49/24/410984924.db2.gz ISPYXIOAJRVYAT-AWEZNQCLSA-N 1 2 247.342 2.402 20 0 BEADLO CCc1nc(N2C[C@H](CC)OC[C@@H]2C)cc(C)[nH+]1 ZINC000651405719 410986577 /nfs/dbraw/zinc/98/65/77/410986577.db2.gz WVOJNWZUNZKTJO-RYUDHWBXSA-N 1 2 249.358 2.351 20 0 BEADLO Cc1cc(N2CCC3(CC3(F)F)CC2)nc[nH+]1 ZINC000651424222 411011565 /nfs/dbraw/zinc/01/15/65/411011565.db2.gz LKBVHHMWATYSQV-UHFFFAOYSA-N 1 2 239.269 2.411 20 0 BEADLO Cc1cc2ccccc2[nH+]c1N[C@@H](CO)CCF ZINC000651463198 411046621 /nfs/dbraw/zinc/04/66/21/411046621.db2.gz NCAQCXAFLPDELX-GFCCVEGCSA-N 1 2 248.301 2.098 20 0 BEADLO CO[C@@H]([C@H](C)[NH2+][C@H](C)c1cn[nH]c1C)C1CC1 ZINC000651463718 411047915 /nfs/dbraw/zinc/04/79/15/411047915.db2.gz LSUVMHPZNMROCR-DVYJOKAKSA-N 1 2 237.347 2.182 20 0 BEADLO FC1(F)CCC[N@H+](CC2=CCCOC2)C1 ZINC000651895756 411149740 /nfs/dbraw/zinc/14/97/40/411149740.db2.gz VWMYQNPWPINZAN-UHFFFAOYSA-N 1 2 217.259 2.064 20 0 BEADLO FC1(F)CCC[N@@H+](CC2=CCCOC2)C1 ZINC000651895756 411149741 /nfs/dbraw/zinc/14/97/41/411149741.db2.gz VWMYQNPWPINZAN-UHFFFAOYSA-N 1 2 217.259 2.064 20 0 BEADLO CC(C)(C)C[C@@H]1C[C@H]1NC(=O)CCc1c[nH+]c[nH]1 ZINC000652758383 411151525 /nfs/dbraw/zinc/15/15/25/411151525.db2.gz UBUMYYCAKUDZQZ-CMPLNLGQSA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)(C)C[C@@H]1C[C@H]1NC(=O)CCc1c[nH]c[nH+]1 ZINC000652758383 411151527 /nfs/dbraw/zinc/15/15/27/411151527.db2.gz UBUMYYCAKUDZQZ-CMPLNLGQSA-N 1 2 249.358 2.283 20 0 BEADLO COCc1cc[nH+]c(N[C@H]2CCO[C@H](C)C2)c1 ZINC000652068562 411105274 /nfs/dbraw/zinc/10/52/74/411105274.db2.gz HFOHYPFXTUQGDS-PWSUYJOCSA-N 1 2 236.315 2.207 20 0 BEADLO C[NH+](C)Cc1nc([C@@H]2CCC[C@H]3C[C@H]32)no1 ZINC000656049221 411170856 /nfs/dbraw/zinc/17/08/56/411170856.db2.gz LJAXDERNVWKCJL-IVZWLZJFSA-N 1 2 221.304 2.035 20 0 BEADLO CC(C)n1cc(C[N@H+](C)Cc2ccccc2)nn1 ZINC000289203958 167744765 /nfs/dbraw/zinc/74/47/65/167744765.db2.gz VSPVHAFMQYQKEL-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO CC(C)n1cc(C[N@@H+](C)Cc2ccccc2)nn1 ZINC000289203958 167744768 /nfs/dbraw/zinc/74/47/68/167744768.db2.gz VSPVHAFMQYQKEL-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO COc1c(N)[nH+]cnc1NCCC1=CCCCC1 ZINC000656105258 411178884 /nfs/dbraw/zinc/17/88/84/411178884.db2.gz SJQVMCMPTABPEP-UHFFFAOYSA-N 1 2 248.330 2.370 20 0 BEADLO COc1c(N)nc[nH+]c1NCCC1=CCCCC1 ZINC000656105258 411178886 /nfs/dbraw/zinc/17/88/86/411178886.db2.gz SJQVMCMPTABPEP-UHFFFAOYSA-N 1 2 248.330 2.370 20 0 BEADLO COc1c(C)[nH+]cnc1N1CCC[C@@H](C)C1 ZINC000656103732 411178937 /nfs/dbraw/zinc/17/89/37/411178937.db2.gz CLFBXOUQOHPUDF-SECBINFHSA-N 1 2 221.304 2.030 20 0 BEADLO COc1c(C)[nH+]cnc1N1CCC(C)(C)CC1 ZINC000656117010 411182064 /nfs/dbraw/zinc/18/20/64/411182064.db2.gz NHIHTFGJMFGYKV-UHFFFAOYSA-N 1 2 235.331 2.420 20 0 BEADLO COc1c(C)[nH+]cnc1N(C)CC(C)(C)C ZINC000656117003 411182096 /nfs/dbraw/zinc/18/20/96/411182096.db2.gz NAHYMGYJHZSGPU-UHFFFAOYSA-N 1 2 223.320 2.276 20 0 BEADLO COc1c(C)[nH+]cnc1NC[C@@H]1CC1(C)C ZINC000656125212 411183356 /nfs/dbraw/zinc/18/33/56/411183356.db2.gz AQSZACNPUVQHAF-VIFPVBQESA-N 1 2 221.304 2.252 20 0 BEADLO CO[C@@H]1C[C@@H](Nc2nc(C)[nH+]cc2C)C1(C)C ZINC000656142217 411185217 /nfs/dbraw/zinc/18/52/17/411185217.db2.gz SQNZLNWWJYBMOI-GHMZBOCLSA-N 1 2 235.331 2.319 20 0 BEADLO COc1c(C)[nH+]cnc1N1CC[C@H](C)[C@H]1C ZINC000656138181 411185254 /nfs/dbraw/zinc/18/52/54/411185254.db2.gz PFEXXPLUUIFOJW-WCBMZHEXSA-N 1 2 221.304 2.028 20 0 BEADLO CO[C@H]1C[C@@H](Nc2nc(C)[nH+]cc2C)C1(C)C ZINC000656142220 411185335 /nfs/dbraw/zinc/18/53/35/411185335.db2.gz SQNZLNWWJYBMOI-MNOVXSKESA-N 1 2 235.331 2.319 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1CCC(F)(F)C1 ZINC000656147214 411185968 /nfs/dbraw/zinc/18/59/68/411185968.db2.gz DPABBUAUCWOKJD-MRVPVSSYSA-N 1 2 243.257 2.393 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)C[C@H]1CCCC[C@@H]1O ZINC000656152685 411186695 /nfs/dbraw/zinc/18/66/95/411186695.db2.gz CKINGXBBXUMSSP-OLZOCXBDSA-N 1 2 249.358 2.081 20 0 BEADLO COc1c(C)[nH+]cnc1N1CC(C)=C[C@@H](C)C1 ZINC000656182711 411195532 /nfs/dbraw/zinc/19/55/32/411195532.db2.gz LAGJBALNJNSXFE-SECBINFHSA-N 1 2 233.315 2.196 20 0 BEADLO CC(C)(O)CC[NH+]1Cc2cc(F)c(F)cc2C1 ZINC000653830741 411195827 /nfs/dbraw/zinc/19/58/27/411195827.db2.gz HZXHPKDSBZAHJA-UHFFFAOYSA-N 1 2 241.281 2.441 20 0 BEADLO C[C@@H](O)CCC[NH+]1Cc2cc(F)c(F)cc2C1 ZINC000653830802 411195842 /nfs/dbraw/zinc/19/58/42/411195842.db2.gz KREHYQMLCLBLLA-SECBINFHSA-N 1 2 241.281 2.441 20 0 BEADLO COC[C@H](C)[NH+]1Cc2cc(F)c(F)cc2C1 ZINC000653833712 411196445 /nfs/dbraw/zinc/19/64/45/411196445.db2.gz RSGGENKATNOPHL-QMMMGPOBSA-N 1 2 227.254 2.315 20 0 BEADLO CCCCOCC[N@H+](C)[C@H](C)c1nc(C)no1 ZINC000653844251 411197679 /nfs/dbraw/zinc/19/76/79/411197679.db2.gz FGYBSBCWHWFZAJ-SNVBAGLBSA-N 1 2 241.335 2.188 20 0 BEADLO CCCCOCC[N@@H+](C)[C@H](C)c1nc(C)no1 ZINC000653844251 411197682 /nfs/dbraw/zinc/19/76/82/411197682.db2.gz FGYBSBCWHWFZAJ-SNVBAGLBSA-N 1 2 241.335 2.188 20 0 BEADLO FC1(F)CCC[C@@H]1[NH2+][C@H]1CCCn2nccc21 ZINC000658016348 411198295 /nfs/dbraw/zinc/19/82/95/411198295.db2.gz XAGIKRLIRNRDCX-ONGXEEELSA-N 1 2 241.285 2.495 20 0 BEADLO COc1c(C)[nH+]cnc1NCCC(C)(F)F ZINC000656192589 411198703 /nfs/dbraw/zinc/19/87/03/411198703.db2.gz GVXGXDGPZAYYNK-UHFFFAOYSA-N 1 2 231.246 2.251 20 0 BEADLO C[C@H]([NH2+][C@@H]1C[C@H](C)n2ncnc21)c1ccco1 ZINC000658097781 411244994 /nfs/dbraw/zinc/24/49/94/411244994.db2.gz JBXVZLPFJGZFHB-LPEHRKFASA-N 1 2 232.287 2.228 20 0 BEADLO COc1c(C)[nH+]cnc1NCc1ccnc(C)c1 ZINC000656193738 411199622 /nfs/dbraw/zinc/19/96/22/411199622.db2.gz QWHFKUFBKUSTGD-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO COc1c(C)[nH+]cnc1NCc1cnccc1C ZINC000656195971 411200809 /nfs/dbraw/zinc/20/08/09/411200809.db2.gz PMWBHXGCQVZBCS-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO COCc1cc[nH+]c(N[C@H](C)c2cnn(C)c2)c1 ZINC000652330453 411201955 /nfs/dbraw/zinc/20/19/55/411201955.db2.gz GSKNKOBZLPIVFI-SNVBAGLBSA-N 1 2 246.314 2.135 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000656203243 411207956 /nfs/dbraw/zinc/20/79/56/411207956.db2.gz FWPBZDKALUIQPI-GMTAPVOTSA-N 1 2 233.315 2.394 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000656203242 411208006 /nfs/dbraw/zinc/20/80/06/411208006.db2.gz FWPBZDKALUIQPI-GARJFASQSA-N 1 2 233.315 2.394 20 0 BEADLO Cc1ccn2cc(CNC(=O)C(C)(C)C)[nH+]c2c1 ZINC000048750352 411213202 /nfs/dbraw/zinc/21/32/02/411213202.db2.gz XVXLRWZAWRLOCJ-UHFFFAOYSA-N 1 2 245.326 2.305 20 0 BEADLO CC[C@@H](C)C(=O)NCc1cn2ccc(C)cc2[nH+]1 ZINC000048750348 411213391 /nfs/dbraw/zinc/21/33/91/411213391.db2.gz CVEGULFXCYGTCC-LLVKDONJSA-N 1 2 245.326 2.305 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCC[C@@H]1CF ZINC000293036007 167791756 /nfs/dbraw/zinc/79/17/56/167791756.db2.gz LPBCRSULQIPXHJ-LLVKDONJSA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCC[C@@H]1CF ZINC000293036007 167791758 /nfs/dbraw/zinc/79/17/58/167791758.db2.gz LPBCRSULQIPXHJ-LLVKDONJSA-N 1 2 225.311 2.398 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2COC3(CCC3)C2)c1 ZINC000658045379 411217143 /nfs/dbraw/zinc/21/71/43/411217143.db2.gz TWVUABAPEPYUML-LBPRGKRZSA-N 1 2 248.326 2.352 20 0 BEADLO CCC1(C)C[NH+](Cc2cc3n(n2)CCCC3)C1 ZINC000656263151 411219047 /nfs/dbraw/zinc/21/90/47/411219047.db2.gz CENNAZDALGJYFZ-UHFFFAOYSA-N 1 2 233.359 2.451 20 0 BEADLO COc1c(C)cccc1C[NH2+]Cc1csnn1 ZINC000656270174 411220432 /nfs/dbraw/zinc/22/04/32/411220432.db2.gz ZNKFYHJHUCPPDY-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@H](OC2CCC2)C1 ZINC000656272561 411222658 /nfs/dbraw/zinc/22/26/58/411222658.db2.gz XUFMZJRLSBUHJC-AWEZNQCLSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@H](OC2CCC2)C1 ZINC000656272561 411222660 /nfs/dbraw/zinc/22/26/60/411222660.db2.gz XUFMZJRLSBUHJC-AWEZNQCLSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)[C@H]2CC2(C)C)[nH+]1 ZINC000652405146 411231428 /nfs/dbraw/zinc/23/14/28/411231428.db2.gz FWIUMKXAEGDUDH-SECBINFHSA-N 1 2 235.331 2.116 20 0 BEADLO CC(F)(F)CCC(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000652410516 411232097 /nfs/dbraw/zinc/23/20/97/411232097.db2.gz YEEDLWIBPRBAER-UHFFFAOYSA-N 1 2 245.273 2.196 20 0 BEADLO C[C@H](C(=O)NC(C)(C)c1[nH]cc[nH+]1)c1ccco1 ZINC000652411344 411232954 /nfs/dbraw/zinc/23/29/54/411232954.db2.gz APNTVRADCSRALJ-VIFPVBQESA-N 1 2 247.298 2.158 20 0 BEADLO CC(C)(NC(=O)C1CC(C)(C)C1)c1[nH]cc[nH+]1 ZINC000652412656 411234138 /nfs/dbraw/zinc/23/41/38/411234138.db2.gz LHZKKCKISXEQMR-UHFFFAOYSA-N 1 2 235.331 2.197 20 0 BEADLO COCCOc1ccccc1-c1[nH+]ccn1C ZINC000656369676 411236271 /nfs/dbraw/zinc/23/62/71/411236271.db2.gz UWYRCZPHVKYCAA-UHFFFAOYSA-N 1 2 232.283 2.112 20 0 BEADLO COc1cc(OC)cc(-c2[nH+]ccn2C)c1 ZINC000656371762 411238384 /nfs/dbraw/zinc/23/83/84/411238384.db2.gz SCSZGLPHFXCYPZ-UHFFFAOYSA-N 1 2 218.256 2.104 20 0 BEADLO Cc1nc(N[C@@H](C)CF)c2c([nH+]1)CCCC2 ZINC000309832493 411268352 /nfs/dbraw/zinc/26/83/52/411268352.db2.gz LGCWJWWMTZSLHB-QMMMGPOBSA-N 1 2 223.295 2.434 20 0 BEADLO CCC1CN(C(=O)Nc2ccc3[nH+]ccn3c2)C1 ZINC000652564456 411272867 /nfs/dbraw/zinc/27/28/67/411272867.db2.gz MXXUNGUYEPVNLQ-UHFFFAOYSA-N 1 2 244.298 2.208 20 0 BEADLO CC[C@@H](C)CCNc1[nH+]cnc2c1cnn2C ZINC000656472653 411276999 /nfs/dbraw/zinc/27/69/99/411276999.db2.gz MYCROLHZTRJFCN-SECBINFHSA-N 1 2 233.319 2.211 20 0 BEADLO CCc1ccc([C@@H](C)[NH2+]Cc2cn(CC)nn2)o1 ZINC000658175410 411281743 /nfs/dbraw/zinc/28/17/43/411281743.db2.gz ACHJFEHBDMAZSC-SNVBAGLBSA-N 1 2 248.330 2.304 20 0 BEADLO Fc1cnccc1C[NH+]1CC2(C1)CC(F)(F)C2 ZINC000656482820 411281951 /nfs/dbraw/zinc/28/19/51/411281951.db2.gz MGYFPBVPWXGGRP-UHFFFAOYSA-N 1 2 242.244 2.452 20 0 BEADLO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1cnccn1)CO2 ZINC000656507311 411287423 /nfs/dbraw/zinc/28/74/23/411287423.db2.gz GHYYABTXOPUJIF-ZDUSSCGKSA-N 1 2 241.294 2.008 20 0 BEADLO CCn1nccc1C[NH+]1CC(CC(F)(F)F)C1 ZINC000656686655 411329053 /nfs/dbraw/zinc/32/90/53/411329053.db2.gz UWKNLGCYOVULGN-UHFFFAOYSA-N 1 2 247.264 2.287 20 0 BEADLO CN(CCCn1cc[nH+]c1)c1ccsc1 ZINC000653468069 411288681 /nfs/dbraw/zinc/28/86/81/411288681.db2.gz IFDLURFABOEWQL-UHFFFAOYSA-N 1 2 221.329 2.471 20 0 BEADLO CCn1cc(C[NH+]2CC(CC(F)(F)F)C2)cn1 ZINC000656686835 411329326 /nfs/dbraw/zinc/32/93/26/411329326.db2.gz ZYAFAPYXMAWJHJ-UHFFFAOYSA-N 1 2 247.264 2.287 20 0 BEADLO c1ccc2c(CC[NH+]3CCOCC3)nsc2c1 ZINC000659812996 411299923 /nfs/dbraw/zinc/29/99/23/411299923.db2.gz FBXUSEREFFZJKK-UHFFFAOYSA-N 1 2 248.351 2.171 20 0 BEADLO CC(C)(C)OC(=O)CC[N@@H+]1CCC=C(F)C1 ZINC000299600822 411302630 /nfs/dbraw/zinc/30/26/30/411302630.db2.gz IOIPIIZIWFLAIR-UHFFFAOYSA-N 1 2 229.295 2.277 20 0 BEADLO CC(C)(C)OC(=O)CC[N@H+]1CCC=C(F)C1 ZINC000299600822 411302631 /nfs/dbraw/zinc/30/26/31/411302631.db2.gz IOIPIIZIWFLAIR-UHFFFAOYSA-N 1 2 229.295 2.277 20 0 BEADLO C[N@@H+](Cc1ncc[nH]1)C[C@H]1CCC2(CCCC2)O1 ZINC000660143027 411257868 /nfs/dbraw/zinc/25/78/68/411257868.db2.gz PRAAFLWPHPYKSJ-GFCCVEGCSA-N 1 2 249.358 2.333 20 0 BEADLO C[N@H+](Cc1ncc[nH]1)C[C@H]1CCC2(CCCC2)O1 ZINC000660143027 411257873 /nfs/dbraw/zinc/25/78/73/411257873.db2.gz PRAAFLWPHPYKSJ-GFCCVEGCSA-N 1 2 249.358 2.333 20 0 BEADLO CCC(CC)CCC[N@H+](C)Cc1ncnn1C ZINC000662036472 411351808 /nfs/dbraw/zinc/35/18/08/411351808.db2.gz CWFOASMRRIDWDK-UHFFFAOYSA-N 1 2 238.379 2.463 20 0 BEADLO CCC(CC)CCC[N@@H+](C)Cc1ncnn1C ZINC000662036472 411351811 /nfs/dbraw/zinc/35/18/11/411351811.db2.gz CWFOASMRRIDWDK-UHFFFAOYSA-N 1 2 238.379 2.463 20 0 BEADLO Cc1c[nH+]c(C)c(NCc2cnn3c2CCC3)c1 ZINC000656776552 411356333 /nfs/dbraw/zinc/35/63/33/411356333.db2.gz RMQQMBGTWUOARI-UHFFFAOYSA-N 1 2 242.326 2.453 20 0 BEADLO C[C@H](c1nccc(N)n1)[N@H+](C)Cc1ccsc1 ZINC000653483927 411373553 /nfs/dbraw/zinc/37/35/53/411373553.db2.gz HLSNDDCAQHINHA-SECBINFHSA-N 1 2 248.355 2.144 20 0 BEADLO C[C@H](c1nccc(N)n1)[N@@H+](C)Cc1ccsc1 ZINC000653483927 411373554 /nfs/dbraw/zinc/37/35/54/411373554.db2.gz HLSNDDCAQHINHA-SECBINFHSA-N 1 2 248.355 2.144 20 0 BEADLO CC(C)c1nc(C[N@@H+]2CC[C@H]3C[C@H]3C2)no1 ZINC000661969151 411338365 /nfs/dbraw/zinc/33/83/65/411338365.db2.gz BXXBNBFMVDGIJM-UWVGGRQHSA-N 1 2 221.304 2.035 20 0 BEADLO CC(C)c1nc(C[N@H+]2CC[C@H]3C[C@H]3C2)no1 ZINC000661969151 411338369 /nfs/dbraw/zinc/33/83/69/411338369.db2.gz BXXBNBFMVDGIJM-UWVGGRQHSA-N 1 2 221.304 2.035 20 0 BEADLO CC(C)(C)c1nc(C[N@@H+]2CC[C@H]3C[C@H]3C2)no1 ZINC000661971086 411339761 /nfs/dbraw/zinc/33/97/61/411339761.db2.gz HNCJVMGMOGLFFH-UWVGGRQHSA-N 1 2 235.331 2.209 20 0 BEADLO CC(C)(C)c1nc(C[N@H+]2CC[C@H]3C[C@H]3C2)no1 ZINC000661971086 411339766 /nfs/dbraw/zinc/33/97/66/411339766.db2.gz HNCJVMGMOGLFFH-UWVGGRQHSA-N 1 2 235.331 2.209 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ccc(F)cn1)c1nccn1C ZINC000658338430 411345858 /nfs/dbraw/zinc/34/58/58/411345858.db2.gz XWKZAPOWOCJSDQ-NXEZZACHSA-N 1 2 248.305 2.366 20 0 BEADLO CC1(CC(=O)Nc2ccn3cc[nH+]c3c2)CC1 ZINC000336278638 168018025 /nfs/dbraw/zinc/01/80/25/168018025.db2.gz ZROXMNNJXLJVQX-UHFFFAOYSA-N 1 2 229.283 2.463 20 0 BEADLO CC1(CO)C[NH+](Cc2cc(F)cc(Cl)c2)C1 ZINC000334648066 168051490 /nfs/dbraw/zinc/05/14/90/168051490.db2.gz SOUMBNCJRRNPCI-UHFFFAOYSA-N 1 2 243.709 2.293 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cc(C)nc(C)n2)C[C@H](C)O1 ZINC000659918110 411382698 /nfs/dbraw/zinc/38/26/98/411382698.db2.gz JBZZNDQYVMDMAH-FZMZJTMJSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cc(C)nc(C)n2)C[C@H](C)O1 ZINC000659918110 411382699 /nfs/dbraw/zinc/38/26/99/411382699.db2.gz JBZZNDQYVMDMAH-FZMZJTMJSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C)nc(C)n2)C[C@H](C)O1 ZINC000659918112 411382885 /nfs/dbraw/zinc/38/28/85/411382885.db2.gz JBZZNDQYVMDMAH-SMDDNHRTSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C)nc(C)n2)C[C@H](C)O1 ZINC000659918112 411382887 /nfs/dbraw/zinc/38/28/87/411382887.db2.gz JBZZNDQYVMDMAH-SMDDNHRTSA-N 1 2 249.358 2.093 20 0 BEADLO c1c(CNc2cccc[nH+]2)nn2c1CCCC2 ZINC000653496739 411396155 /nfs/dbraw/zinc/39/61/55/411396155.db2.gz GRKAXMWDDWTZAF-UHFFFAOYSA-N 1 2 228.299 2.227 20 0 BEADLO Cc1c[nH+]c(C)c(NCc2ccnn2C)c1 ZINC000404508119 411399145 /nfs/dbraw/zinc/39/91/45/411399145.db2.gz CHKGZBLMAJUQBV-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N[C@@H]3CC3(C)C)ccn12 ZINC000654575783 411413133 /nfs/dbraw/zinc/41/31/33/411413133.db2.gz NDJKVUWDEAJMIO-LLVKDONJSA-N 1 2 243.310 2.171 20 0 BEADLO Cc1cc(N)nc(S[C@@H]2COC(C)(C)C2)[nH+]1 ZINC000657237706 411423547 /nfs/dbraw/zinc/42/35/47/411423547.db2.gz UUACVOQCESTJFX-QMMMGPOBSA-N 1 2 239.344 2.027 20 0 BEADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1nonc1C ZINC000271448319 411430768 /nfs/dbraw/zinc/43/07/68/411430768.db2.gz WSJRFIOFKACKOA-CYBMUJFWSA-N 1 2 246.314 2.356 20 0 BEADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1nonc1C ZINC000271448319 411430771 /nfs/dbraw/zinc/43/07/71/411430771.db2.gz WSJRFIOFKACKOA-CYBMUJFWSA-N 1 2 246.314 2.356 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H](C)CC(C)C ZINC000274326485 411438068 /nfs/dbraw/zinc/43/80/68/411438068.db2.gz YJECBOIWWUOJMI-VIFPVBQESA-N 1 2 223.320 2.017 20 0 BEADLO COc1ccc(N[C@H]2CCCn3cc[nH+]c32)cn1 ZINC000655736830 411443520 /nfs/dbraw/zinc/44/35/20/411443520.db2.gz UKRWHCTUYFWMKG-NSHDSACASA-N 1 2 244.298 2.234 20 0 BEADLO COc1ccc(N[C@H]2CCCn3cc[nH+]c32)nc1 ZINC000655742775 411447511 /nfs/dbraw/zinc/44/75/11/411447511.db2.gz AKGVTQYVWPQQJV-NSHDSACASA-N 1 2 244.298 2.234 20 0 BEADLO Cn1cnc(C[N@H+](C)Cc2cccs2)c1 ZINC000659825304 411464135 /nfs/dbraw/zinc/46/41/35/411464135.db2.gz AMFHYLXDHJSOOX-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO Cn1cnc(C[N@@H+](C)Cc2cccs2)c1 ZINC000659825304 411464138 /nfs/dbraw/zinc/46/41/38/411464138.db2.gz AMFHYLXDHJSOOX-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO CC(C)=CCC[N@@H+]1C[C@H](O)CC(F)(F)C1 ZINC000660391518 411453219 /nfs/dbraw/zinc/45/32/19/411453219.db2.gz SUNIWVDJBNVXPO-SNVBAGLBSA-N 1 2 219.275 2.045 20 0 BEADLO CC(C)=CCC[N@H+]1C[C@H](O)CC(F)(F)C1 ZINC000660391518 411453220 /nfs/dbraw/zinc/45/32/20/411453220.db2.gz SUNIWVDJBNVXPO-SNVBAGLBSA-N 1 2 219.275 2.045 20 0 BEADLO c1nc(C[N@@H+]2CCC[C@@H]3COC[C@@H]32)oc1C1CC1 ZINC000657294839 411453985 /nfs/dbraw/zinc/45/39/85/411453985.db2.gz OWQYRPSWNHDKNO-NEPJUHHUSA-N 1 2 248.326 2.163 20 0 BEADLO c1nc(C[N@H+]2CCC[C@@H]3COC[C@@H]32)oc1C1CC1 ZINC000657294839 411453987 /nfs/dbraw/zinc/45/39/87/411453987.db2.gz OWQYRPSWNHDKNO-NEPJUHHUSA-N 1 2 248.326 2.163 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1O[C@@H](C)C[C@@H]1C ZINC000281832372 411454232 /nfs/dbraw/zinc/45/42/32/411454232.db2.gz IIUZZNZLOUFYDT-OUJBWJOFSA-N 1 2 248.326 2.396 20 0 BEADLO Cc1c[nH]c(C[NH2+]Cc2ccc(C)c(C)n2)n1 ZINC000657488929 411532624 /nfs/dbraw/zinc/53/26/24/411532624.db2.gz YBETYOXJOIYSMG-UHFFFAOYSA-N 1 2 230.315 2.020 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@H](C)c2cnn(C(C)C)c2)n1 ZINC000657359868 411477107 /nfs/dbraw/zinc/47/71/07/411477107.db2.gz QFHWRPWABVJISX-LLVKDONJSA-N 1 2 247.346 2.346 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H](C)OC(C)(C)C2)nc(C)n1 ZINC000659855228 411478621 /nfs/dbraw/zinc/47/86/21/411478621.db2.gz AWEYOFDRDMZGCO-NSHDSACASA-N 1 2 249.358 2.093 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H](C)OC(C)(C)C2)nc(C)n1 ZINC000659855228 411478623 /nfs/dbraw/zinc/47/86/23/411478623.db2.gz AWEYOFDRDMZGCO-NSHDSACASA-N 1 2 249.358 2.093 20 0 BEADLO COc1cc(C[N@H+](C)[C@@H](C)c2ccco2)on1 ZINC000659858478 411480088 /nfs/dbraw/zinc/48/00/88/411480088.db2.gz WHMLBOOXTQQJJC-VIFPVBQESA-N 1 2 236.271 2.469 20 0 BEADLO COc1cc(C[N@@H+](C)[C@@H](C)c2ccco2)on1 ZINC000659858478 411480090 /nfs/dbraw/zinc/48/00/90/411480090.db2.gz WHMLBOOXTQQJJC-VIFPVBQESA-N 1 2 236.271 2.469 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@@H](CO)c2ccccc2)co1 ZINC000659876271 411486871 /nfs/dbraw/zinc/48/68/71/411486871.db2.gz ZYLAXRRIJPQKJX-AWEZNQCLSA-N 1 2 246.310 2.148 20 0 BEADLO Cc1nc(C[N@H+](C)[C@@H](CO)c2ccccc2)co1 ZINC000659876271 411486874 /nfs/dbraw/zinc/48/68/74/411486874.db2.gz ZYLAXRRIJPQKJX-AWEZNQCLSA-N 1 2 246.310 2.148 20 0 BEADLO COC[C@H](NCc1[nH]cc(C)[nH+]1)c1ccc(C)o1 ZINC000657382712 411488228 /nfs/dbraw/zinc/48/82/28/411488228.db2.gz IWQCFNMRYAVHHJ-NSHDSACASA-N 1 2 249.314 2.097 20 0 BEADLO CCc1cc(CC)n(-c2cc(C)[nH+]c(C)n2)n1 ZINC000131638611 411489355 /nfs/dbraw/zinc/48/93/55/411489355.db2.gz YLAOFNSHKIILGD-UHFFFAOYSA-N 1 2 230.315 2.404 20 0 BEADLO CCc1cc(NCc2[nH+]ccn2C(C)C)n(C)n1 ZINC000657396043 411494182 /nfs/dbraw/zinc/49/41/82/411494182.db2.gz DWUFVFUTSLRSAI-UHFFFAOYSA-N 1 2 247.346 2.372 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@H]2COc3ccc(C)cc32)n1 ZINC000657399000 411495016 /nfs/dbraw/zinc/49/50/16/411495016.db2.gz QTTQAQSVQIUSHC-LBPRGKRZSA-N 1 2 243.310 2.250 20 0 BEADLO COc1ccc(NCc2[nH]c(C)c(C)[nH+]2)nc1 ZINC000657402630 411496435 /nfs/dbraw/zinc/49/64/35/411496435.db2.gz WBVSMAJBCBKSAX-UHFFFAOYSA-N 1 2 232.287 2.042 20 0 BEADLO Cc1c[nH]c(CNc2ccccc2N(C)C)[nH+]1 ZINC000657404225 411497279 /nfs/dbraw/zinc/49/72/79/411497279.db2.gz QZLVQXXHKMVDNT-UHFFFAOYSA-N 1 2 230.315 2.396 20 0 BEADLO Cc1ccc(NCc2c[nH+]c3n2CCC3)c(C)n1 ZINC000657413730 411499774 /nfs/dbraw/zinc/49/97/74/411499774.db2.gz QCYAFKCSRDOQGL-UHFFFAOYSA-N 1 2 242.326 2.453 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NC1(C2(C)CC2)CC1 ZINC000655138183 411502596 /nfs/dbraw/zinc/50/25/96/411502596.db2.gz WUWWHWIDIQVZNZ-JTQLQIEISA-N 1 2 247.342 2.037 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NC1(C2(C)CC2)CC1 ZINC000655138183 411502598 /nfs/dbraw/zinc/50/25/98/411502598.db2.gz WUWWHWIDIQVZNZ-JTQLQIEISA-N 1 2 247.342 2.037 20 0 BEADLO COc1cc(F)cc(C[NH2+]Cc2nc(C)c[nH]2)c1 ZINC000657424603 411504918 /nfs/dbraw/zinc/50/49/18/411504918.db2.gz ZMXJJCHUQDCLBV-UHFFFAOYSA-N 1 2 249.289 2.156 20 0 BEADLO Cc1[nH]c(CN[C@@H]2CCCC2(F)F)[nH+]c1C ZINC000657466980 411521036 /nfs/dbraw/zinc/52/10/36/411521036.db2.gz DHGCHXPOIZWULY-SECBINFHSA-N 1 2 229.274 2.304 20 0 BEADLO Cn1ncc(C2CC2)c1C[NH2+]CC(C)(F)F ZINC000657474860 411523784 /nfs/dbraw/zinc/52/37/84/411523784.db2.gz GEQBNJOPTYQDIA-UHFFFAOYSA-N 1 2 229.274 2.042 20 0 BEADLO CCCc1nc(C)c(C[NH2+]Cc2nc(C)c[nH]2)o1 ZINC000657473834 411524296 /nfs/dbraw/zinc/52/42/96/411524296.db2.gz UURUDOSFYQWPJV-UHFFFAOYSA-N 1 2 248.330 2.257 20 0 BEADLO CC[C@H]([NH2+]Cc1ccnn1CC1CC1)C(F)F ZINC000657476134 411524879 /nfs/dbraw/zinc/52/48/79/411524879.db2.gz AVENWHHHDZYQJV-NSHDSACASA-N 1 2 243.301 2.426 20 0 BEADLO CCc1nocc1C[N@@H+]1CCOC(C)(C)[C@@H]1C ZINC000660005960 411526653 /nfs/dbraw/zinc/52/66/53/411526653.db2.gz HRGNHPVUVDNIJD-JTQLQIEISA-N 1 2 238.331 2.236 20 0 BEADLO CCc1nocc1C[N@H+]1CCOC(C)(C)[C@@H]1C ZINC000660005960 411526655 /nfs/dbraw/zinc/52/66/55/411526655.db2.gz HRGNHPVUVDNIJD-JTQLQIEISA-N 1 2 238.331 2.236 20 0 BEADLO Cc1occc1C[NH2+]Cc1cn(C2CCC2)nn1 ZINC000657325843 411464769 /nfs/dbraw/zinc/46/47/69/411464769.db2.gz JHEHEMFPLGJTQN-UHFFFAOYSA-N 1 2 246.314 2.194 20 0 BEADLO COc1cc(C[N@H+](C)Cc2cccs2)on1 ZINC000659827086 411465568 /nfs/dbraw/zinc/46/55/68/411465568.db2.gz SUNPXRRLLJHERI-UHFFFAOYSA-N 1 2 238.312 2.377 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2cccs2)on1 ZINC000659827086 411465570 /nfs/dbraw/zinc/46/55/70/411465570.db2.gz SUNPXRRLLJHERI-UHFFFAOYSA-N 1 2 238.312 2.377 20 0 BEADLO CC[N@@H+]1C[C@H]([NH2+]CCC=C(C)C)[C@@H](C)C1 ZINC000309060747 170034627 /nfs/dbraw/zinc/03/46/27/170034627.db2.gz WKSMVFLSYNZIEL-STQMWFEESA-N 1 2 210.365 2.273 20 0 BEADLO CC[N@@H+]1C[C@H]([NH2+]CCC2(F)CCC2)[C@@H](C)C1 ZINC000336782273 170034660 /nfs/dbraw/zinc/03/46/60/170034660.db2.gz XDEJUUWHLRPOJC-RYUDHWBXSA-N 1 2 228.355 2.199 20 0 BEADLO CCc1nnc([C@@H](C)[N@H+]2CC=C(C)CC2)[nH]1 ZINC000660128322 411542075 /nfs/dbraw/zinc/54/20/75/411542075.db2.gz UOOSUYPKMCWIOQ-SNVBAGLBSA-N 1 2 220.320 2.080 20 0 BEADLO CCc1nnc([C@@H](C)[N@@H+]2CC=C(C)CC2)[nH]1 ZINC000660128322 411542077 /nfs/dbraw/zinc/54/20/77/411542077.db2.gz UOOSUYPKMCWIOQ-SNVBAGLBSA-N 1 2 220.320 2.080 20 0 BEADLO COc1cc(C[N@H+](C)[C@@H](C)c2ccccn2)on1 ZINC000660139697 411544082 /nfs/dbraw/zinc/54/40/82/411544082.db2.gz DJJAWBRMTMBADH-JTQLQIEISA-N 1 2 247.298 2.271 20 0 BEADLO COc1cc(C[N@@H+](C)[C@@H](C)c2ccccn2)on1 ZINC000660139697 411544084 /nfs/dbraw/zinc/54/40/84/411544084.db2.gz DJJAWBRMTMBADH-JTQLQIEISA-N 1 2 247.298 2.271 20 0 BEADLO CCNC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000335155106 170083893 /nfs/dbraw/zinc/08/38/93/170083893.db2.gz HRFDLKQXTCXCTO-UHFFFAOYSA-N 1 2 207.277 2.148 20 0 BEADLO C[C@H]1C[C@@H]([NH2+]Cc2ccc(F)cc2)c2ncnn21 ZINC000657567521 411552907 /nfs/dbraw/zinc/55/29/07/411552907.db2.gz SAGVVZNZSAMVAZ-JOYOIKCWSA-N 1 2 246.289 2.213 20 0 BEADLO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(F)cc2)c2ncnn21 ZINC000657567519 411553104 /nfs/dbraw/zinc/55/31/04/411553104.db2.gz SAGVVZNZSAMVAZ-BXKDBHETSA-N 1 2 246.289 2.213 20 0 BEADLO C[C@@H]1C[C@@H]([NH2+]Cc2cccc(F)c2)c2ncnn21 ZINC000657567093 411553287 /nfs/dbraw/zinc/55/32/87/411553287.db2.gz JEGJOYNMQFLPMQ-BXKDBHETSA-N 1 2 246.289 2.213 20 0 BEADLO Cn1c[nH+]c(CN[C@@H](C(C)(C)C)C(F)(F)F)c1 ZINC000660212520 411554458 /nfs/dbraw/zinc/55/44/58/411554458.db2.gz KZNBOADBRMXOJW-VIFPVBQESA-N 1 2 249.280 2.487 20 0 BEADLO CO[C@H](C[N@@H+]1CCC(F)(F)C1)C1CCC1 ZINC000660215694 411554464 /nfs/dbraw/zinc/55/44/64/411554464.db2.gz RJFKRUVFJJCIAA-SNVBAGLBSA-N 1 2 219.275 2.143 20 0 BEADLO CO[C@H](C[N@H+]1CCC(F)(F)C1)C1CCC1 ZINC000660215694 411554466 /nfs/dbraw/zinc/55/44/66/411554466.db2.gz RJFKRUVFJJCIAA-SNVBAGLBSA-N 1 2 219.275 2.143 20 0 BEADLO CCOC(=O)C(CC)(CC)[NH2+]CCSCC ZINC000336780320 170187830 /nfs/dbraw/zinc/18/78/30/170187830.db2.gz QXZXUFQYSQEKDS-UHFFFAOYSA-N 1 2 247.404 2.451 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1cc(F)ccc1C ZINC000129157395 170214622 /nfs/dbraw/zinc/21/46/22/170214622.db2.gz VHJMNALFBTUMNR-UHFFFAOYSA-N 1 2 239.290 2.129 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1cc(F)ccc1C ZINC000129157395 170214623 /nfs/dbraw/zinc/21/46/23/170214623.db2.gz VHJMNALFBTUMNR-UHFFFAOYSA-N 1 2 239.290 2.129 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+](C)Cc1ccc(C)cc1 ZINC000043638507 170247154 /nfs/dbraw/zinc/24/71/54/170247154.db2.gz BEBOSHIKJIULRQ-GFCCVEGCSA-N 1 2 235.327 2.378 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(C)cc1 ZINC000043638507 170247155 /nfs/dbraw/zinc/24/71/55/170247155.db2.gz BEBOSHIKJIULRQ-GFCCVEGCSA-N 1 2 235.327 2.378 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+](C)Cc1ccccc1C ZINC000043638668 170247393 /nfs/dbraw/zinc/24/73/93/170247393.db2.gz APNOHLQZGAUOSZ-GFCCVEGCSA-N 1 2 235.327 2.378 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+](C)Cc1ccccc1C ZINC000043638668 170247395 /nfs/dbraw/zinc/24/73/95/170247395.db2.gz APNOHLQZGAUOSZ-GFCCVEGCSA-N 1 2 235.327 2.378 20 0 BEADLO Cc1ccc(O)c(C[NH2+][C@@H](C)c2cscn2)n1 ZINC000657599477 411558757 /nfs/dbraw/zinc/55/87/57/411558757.db2.gz HNDYIUIDPAHLJD-VIFPVBQESA-N 1 2 249.339 2.403 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+]Cc1ccc(C)cc1C ZINC000049368878 170268830 /nfs/dbraw/zinc/26/88/30/170268830.db2.gz LHQUPBGYHZTNKR-LBPRGKRZSA-N 1 2 235.327 2.345 20 0 BEADLO CCOC(C)(C)CNc1cc[nH+]c(C)n1 ZINC000167064163 170315395 /nfs/dbraw/zinc/31/53/95/170315395.db2.gz LJWJILHBSZWNBO-UHFFFAOYSA-N 1 2 209.293 2.012 20 0 BEADLO CCOC1CC(Nc2c[nH+]cc(C)c2)C1 ZINC000225857253 170330423 /nfs/dbraw/zinc/33/04/23/170330423.db2.gz ZEYDPKDSIPQGBG-UHFFFAOYSA-N 1 2 206.289 2.369 20 0 BEADLO CCOC1CC2(C1)CC[N@H+](Cc1cn[nH]c1C)C2 ZINC000377707708 170332905 /nfs/dbraw/zinc/33/29/05/170332905.db2.gz XFFDDVUVKMEWFV-UHFFFAOYSA-N 1 2 249.358 2.109 20 0 BEADLO CCOC1CC2(C1)CC[N@@H+](Cc1cn[nH]c1C)C2 ZINC000377707708 170332907 /nfs/dbraw/zinc/33/29/07/170332907.db2.gz XFFDDVUVKMEWFV-UHFFFAOYSA-N 1 2 249.358 2.109 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)c(C)o1 ZINC000660373884 411574490 /nfs/dbraw/zinc/57/44/90/411574490.db2.gz CQJASJRVNQTQSW-LPEHRKFASA-N 1 2 238.331 2.289 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)c(C)o1 ZINC000660373884 411574492 /nfs/dbraw/zinc/57/44/92/411574492.db2.gz CQJASJRVNQTQSW-LPEHRKFASA-N 1 2 238.331 2.289 20 0 BEADLO CCOC1C[NH+](Cc2ccccc2F)C1 ZINC000297405894 170336697 /nfs/dbraw/zinc/33/66/97/170336697.db2.gz KVQLNLVTGUZIRP-UHFFFAOYSA-N 1 2 209.264 2.046 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H](C)O[C@H](C)[C@H]2C)nc(C)n1 ZINC000660375746 411574936 /nfs/dbraw/zinc/57/49/36/411574936.db2.gz XMYDHIHJPVHVFA-QJPTWQEYSA-N 1 2 249.358 2.091 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H](C)O[C@H](C)[C@H]2C)nc(C)n1 ZINC000660375746 411574938 /nfs/dbraw/zinc/57/49/38/411574938.db2.gz XMYDHIHJPVHVFA-QJPTWQEYSA-N 1 2 249.358 2.091 20 0 BEADLO CCOCC[N@H+](C)Cc1ncc(C2CC2)o1 ZINC000270695055 170391852 /nfs/dbraw/zinc/39/18/52/170391852.db2.gz YTWLHYDMSNJWHZ-UHFFFAOYSA-N 1 2 224.304 2.020 20 0 BEADLO CCOCC[N@@H+](C)Cc1ncc(C2CC2)o1 ZINC000270695055 170391853 /nfs/dbraw/zinc/39/18/53/170391853.db2.gz YTWLHYDMSNJWHZ-UHFFFAOYSA-N 1 2 224.304 2.020 20 0 BEADLO Cc1ccccc1C(F)(F)C[NH2+]C[C@@H](C)O ZINC000663367237 411638676 /nfs/dbraw/zinc/63/86/76/411638676.db2.gz OHAOQWSKOHLTBL-SNVBAGLBSA-N 1 2 229.270 2.057 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@H]1CCc2ccc(O)cc21 ZINC000657694625 411581068 /nfs/dbraw/zinc/58/10/68/411581068.db2.gz ULFIUBZAMBRPHO-AWEZNQCLSA-N 1 2 243.310 2.201 20 0 BEADLO CC(C)n1nccc1C[NH2+][C@H](C)c1nccn1C ZINC000657792465 411597997 /nfs/dbraw/zinc/59/79/97/411597997.db2.gz BUIWMAKCGUDWCI-LLVKDONJSA-N 1 2 247.346 2.048 20 0 BEADLO Cn1cc[nH+]c1CNCC(F)(F)C(C)(C)C ZINC000657794583 411599691 /nfs/dbraw/zinc/59/96/91/411599691.db2.gz XMJZWOGUDXUJJN-UHFFFAOYSA-N 1 2 231.290 2.191 20 0 BEADLO COc1cccc(C[NH2+]Cc2cocn2)c1C ZINC000657803765 411600086 /nfs/dbraw/zinc/60/00/86/411600086.db2.gz RVQUSGZZRQHBGK-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO FC1(F)COCC[N@H+](CCC2CCC2)C1 ZINC000660560075 411600159 /nfs/dbraw/zinc/60/01/59/411600159.db2.gz HLOVUVZABUYJFJ-UHFFFAOYSA-N 1 2 219.275 2.144 20 0 BEADLO FC1(F)COCC[N@@H+](CCC2CCC2)C1 ZINC000660560075 411600160 /nfs/dbraw/zinc/60/01/60/411600160.db2.gz HLOVUVZABUYJFJ-UHFFFAOYSA-N 1 2 219.275 2.144 20 0 BEADLO COc1cc(C[N@@H+]2CCC(F)(F)[C@H](C)C2)on1 ZINC000660567575 411601752 /nfs/dbraw/zinc/60/17/52/411601752.db2.gz XHKHLGFQYDQPMU-MRVPVSSYSA-N 1 2 246.257 2.160 20 0 BEADLO COc1cc(C[N@H+]2CCC(F)(F)[C@H](C)C2)on1 ZINC000660567575 411601753 /nfs/dbraw/zinc/60/17/53/411601753.db2.gz XHKHLGFQYDQPMU-MRVPVSSYSA-N 1 2 246.257 2.160 20 0 BEADLO C[C@@H](O)[C@@H]([NH2+]Cc1cscn1)c1ccccc1 ZINC000657815033 411604101 /nfs/dbraw/zinc/60/41/01/411604101.db2.gz HBKKCOFQYGOJKS-ZWNOBZJWSA-N 1 2 248.351 2.355 20 0 BEADLO Cc1cn(C)nc1NCc1[nH+]ccn1C(C)C ZINC000657813178 411604415 /nfs/dbraw/zinc/60/44/15/411604415.db2.gz ZNAMLIFFGJKKLG-UHFFFAOYSA-N 1 2 233.319 2.118 20 0 BEADLO C[C@@H]([NH2+]Cc1ccn[nH]1)C(C)(C)C(F)F ZINC000657875167 411615120 /nfs/dbraw/zinc/61/51/20/411615120.db2.gz HIFCDLGUDIQLJT-SSDOTTSWSA-N 1 2 217.263 2.179 20 0 BEADLO C[C@@H](O)C[N@H+](CCC1CCC1)CC(F)F ZINC000660736435 411619823 /nfs/dbraw/zinc/61/98/23/411619823.db2.gz HGGZKBCDGQPQOW-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO C[C@@H](O)C[N@@H+](CCC1CCC1)CC(F)F ZINC000660736435 411619824 /nfs/dbraw/zinc/61/98/24/411619824.db2.gz HGGZKBCDGQPQOW-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO CO[C@@H](C[N@H+](C)Cc1cnc[nH]1)c1ccccc1 ZINC000661091551 411703790 /nfs/dbraw/zinc/70/37/90/411703790.db2.gz ZNUZRDHXPONGIP-AWEZNQCLSA-N 1 2 245.326 2.229 20 0 BEADLO CO[C@@H](C[N@@H+](C)Cc1cnc[nH]1)c1ccccc1 ZINC000661091551 411703794 /nfs/dbraw/zinc/70/37/94/411703794.db2.gz ZNUZRDHXPONGIP-AWEZNQCLSA-N 1 2 245.326 2.229 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2coc(C)n2)[C@H](CC)CO1 ZINC000660911627 411668283 /nfs/dbraw/zinc/66/82/83/411668283.db2.gz FHWFECSQLKMTQT-CHWSQXEVSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2coc(C)n2)[C@H](CC)CO1 ZINC000660911627 411668287 /nfs/dbraw/zinc/66/82/87/411668287.db2.gz FHWFECSQLKMTQT-CHWSQXEVSA-N 1 2 238.331 2.372 20 0 BEADLO Cc1nc(C[N@H+]2C[C@@H](C)OCC23CCC3)co1 ZINC000660921917 411674613 /nfs/dbraw/zinc/67/46/13/411674613.db2.gz ZQWGSJBNHJBBAI-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@@H](C)OCC23CCC3)co1 ZINC000660921917 411674616 /nfs/dbraw/zinc/67/46/16/411674616.db2.gz ZQWGSJBNHJBBAI-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2C[C@@H]3CCCC[C@@H]32)no1 ZINC000660930952 411681122 /nfs/dbraw/zinc/68/11/22/411681122.db2.gz LTOJSSUZWFDOEO-LSJOCFKGSA-N 1 2 221.304 2.313 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2C[C@@H]3CCCC[C@@H]32)no1 ZINC000660930952 411681126 /nfs/dbraw/zinc/68/11/26/411681126.db2.gz LTOJSSUZWFDOEO-LSJOCFKGSA-N 1 2 221.304 2.313 20 0 BEADLO FC(F)c1noc(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)n1 ZINC000660935320 411684626 /nfs/dbraw/zinc/68/46/26/411684626.db2.gz ZPCYJMZCTLKKMJ-YUMQZZPRSA-N 1 2 243.257 2.382 20 0 BEADLO FC(F)c1noc(C[N@H+]2C[C@@H]3CCCC[C@@H]32)n1 ZINC000660935320 411684631 /nfs/dbraw/zinc/68/46/31/411684631.db2.gz ZPCYJMZCTLKKMJ-YUMQZZPRSA-N 1 2 243.257 2.382 20 0 BEADLO C[N@H+](CCC(=O)c1ccccc1)Cc1cnc[nH]1 ZINC000661089241 411699592 /nfs/dbraw/zinc/69/95/92/411699592.db2.gz ZAANWAYHOBDQRM-UHFFFAOYSA-N 1 2 243.310 2.115 20 0 BEADLO C[N@@H+](CCC(=O)c1ccccc1)Cc1cnc[nH]1 ZINC000661089241 411699596 /nfs/dbraw/zinc/69/95/96/411699596.db2.gz ZAANWAYHOBDQRM-UHFFFAOYSA-N 1 2 243.310 2.115 20 0 BEADLO C[N@H+](CCC(=O)c1ccccc1)Cc1c[nH]cn1 ZINC000661089241 411699598 /nfs/dbraw/zinc/69/95/98/411699598.db2.gz ZAANWAYHOBDQRM-UHFFFAOYSA-N 1 2 243.310 2.115 20 0 BEADLO C[N@@H+](CCC(=O)c1ccccc1)Cc1c[nH]cn1 ZINC000661089241 411699601 /nfs/dbraw/zinc/69/96/01/411699601.db2.gz ZAANWAYHOBDQRM-UHFFFAOYSA-N 1 2 243.310 2.115 20 0 BEADLO CCCc1nc(C)c(CN(C)Cc2c[nH+]c[nH]2)o1 ZINC000661090584 411702885 /nfs/dbraw/zinc/70/28/85/411702885.db2.gz RITZGTZEDQKMNM-UHFFFAOYSA-N 1 2 248.330 2.291 20 0 BEADLO CC(C)c1nsc(NCc2ccc[nH+]c2N)n1 ZINC000663961971 411792971 /nfs/dbraw/zinc/79/29/71/411792971.db2.gz IQIVIROBMYOFQH-UHFFFAOYSA-N 1 2 249.343 2.251 20 0 BEADLO CCc1cc(NCc2ccncc2OC)nc[nH+]1 ZINC000663868206 411765473 /nfs/dbraw/zinc/76/54/73/411765473.db2.gz UCONRRFHVHCCSS-UHFFFAOYSA-N 1 2 244.298 2.055 20 0 BEADLO C[C@H]1COC2(CCC2)C[N@@H+]1Cc1cncs1 ZINC000661461312 411780262 /nfs/dbraw/zinc/78/02/62/411780262.db2.gz CBRNKLISIKBTJM-JTQLQIEISA-N 1 2 238.356 2.287 20 0 BEADLO C[C@H]1COC2(CCC2)C[N@H+]1Cc1cncs1 ZINC000661461312 411780266 /nfs/dbraw/zinc/78/02/66/411780266.db2.gz CBRNKLISIKBTJM-JTQLQIEISA-N 1 2 238.356 2.287 20 0 BEADLO CC(C)[C@@H]([NH2+]Cc1cnn[nH]1)c1ccccc1F ZINC000661482741 411785867 /nfs/dbraw/zinc/78/58/67/411785867.db2.gz CECLNBPMKKTWQS-CYBMUJFWSA-N 1 2 248.305 2.431 20 0 BEADLO Cc1nc2[nH]ccc2c(N2C[C@H](C)[C@@H]2C)[nH+]1 ZINC000663947948 411787375 /nfs/dbraw/zinc/78/73/75/411787375.db2.gz SJRUYGIKUOAGMG-YUMQZZPRSA-N 1 2 216.288 2.111 20 0 BEADLO C[C@H](c1cnccn1)[N@@H+]1CCO[C@@](C)(C2CC2)C1 ZINC000661169947 411726080 /nfs/dbraw/zinc/72/60/80/411726080.db2.gz VMDRTYUFVYLMQQ-BXUZGUMPSA-N 1 2 247.342 2.039 20 0 BEADLO C[C@H](c1cnccn1)[N@H+]1CCO[C@@](C)(C2CC2)C1 ZINC000661169947 411726082 /nfs/dbraw/zinc/72/60/82/411726082.db2.gz VMDRTYUFVYLMQQ-BXUZGUMPSA-N 1 2 247.342 2.039 20 0 BEADLO Cc1ccc(C[NH+]2C[C@@H](C)C(=O)[C@H](C)C2)cn1 ZINC000661538385 411797737 /nfs/dbraw/zinc/79/77/37/411797737.db2.gz JBBLXVFLCYLTEJ-GHMZBOCLSA-N 1 2 232.327 2.047 20 0 BEADLO CCc1cc(NCCc2c(C)n[nH]c2C)nc[nH+]1 ZINC000663983959 411801300 /nfs/dbraw/zinc/80/13/00/411801300.db2.gz NZGCJYPRRSSQRY-UHFFFAOYSA-N 1 2 245.330 2.034 20 0 BEADLO CC[C@@H](C)CCC(=O)NCCCn1cc[nH+]c1 ZINC000285253719 170692185 /nfs/dbraw/zinc/69/21/85/170692185.db2.gz UUAIOEBKWQLEKQ-GFCCVEGCSA-N 1 2 237.347 2.216 20 0 BEADLO Cc1[nH+]c2cc(OC[C@@H]3CCOC3)ccc2n1C ZINC000664053183 411831637 /nfs/dbraw/zinc/83/16/37/411831637.db2.gz KIYGLDZWFFRRSG-LLVKDONJSA-N 1 2 246.310 2.297 20 0 BEADLO CC(C)c1nsc(N(C)Cc2c[nH+]c[nH]2)n1 ZINC000664127856 411863055 /nfs/dbraw/zinc/86/30/55/411863055.db2.gz SOSHFDBILIHHTC-UHFFFAOYSA-N 1 2 237.332 2.021 20 0 BEADLO CC(C)c1nsc(N(C)Cc2c[nH]c[nH+]2)n1 ZINC000664127856 411863060 /nfs/dbraw/zinc/86/30/60/411863060.db2.gz SOSHFDBILIHHTC-UHFFFAOYSA-N 1 2 237.332 2.021 20 0 BEADLO Cc1nc(NC[C@]2(C)CC2(F)F)cc[nH+]1 ZINC000664400244 411942909 /nfs/dbraw/zinc/94/29/09/411942909.db2.gz LKDRVAFRMMAFQP-VIFPVBQESA-N 1 2 213.231 2.242 20 0 BEADLO CC[C@@H](CC(=O)NCc1[nH]cc[nH+]1)C(C)C ZINC000114336857 170813477 /nfs/dbraw/zinc/81/34/77/170813477.db2.gz BSUXCWWBUUUZFF-JTQLQIEISA-N 1 2 223.320 2.098 20 0 BEADLO CC(C)(F)CCNc1nc[nH+]c(N)c1Cl ZINC000664370634 411933229 /nfs/dbraw/zinc/93/32/29/411933229.db2.gz AJUFNOXYGQBBRS-UHFFFAOYSA-N 1 2 232.690 2.262 20 0 BEADLO CC(C)(F)CCNc1[nH+]cnc(N)c1Cl ZINC000664370634 411933232 /nfs/dbraw/zinc/93/32/32/411933232.db2.gz AJUFNOXYGQBBRS-UHFFFAOYSA-N 1 2 232.690 2.262 20 0 BEADLO CC1(C)C[C@H](Nc2cc[nH+]c(C3CC3)n2)CO1 ZINC000664146239 411873228 /nfs/dbraw/zinc/87/32/28/411873228.db2.gz ZLARGJABIKCMGC-JTQLQIEISA-N 1 2 233.315 2.333 20 0 BEADLO CCc1cc(NCC(O)(C2CC2)C2CC2)nc[nH+]1 ZINC000664460792 411965004 /nfs/dbraw/zinc/96/50/04/411965004.db2.gz OIRQJIPHBKIPIR-UHFFFAOYSA-N 1 2 247.342 2.002 20 0 BEADLO CC(C)(C)N1C[C@@H](CNc2cccc[nH+]2)CC1=O ZINC000664544954 411981876 /nfs/dbraw/zinc/98/18/76/411981876.db2.gz AQEFJZRWXWGZQO-LLVKDONJSA-N 1 2 247.342 2.141 20 0 BEADLO C[C@H](O)C1(Nc2cc[nH+]c(C(C)(C)C)n2)CC1 ZINC000664549162 411983378 /nfs/dbraw/zinc/98/33/78/411983378.db2.gz GGTTWKSGULNHPT-VIFPVBQESA-N 1 2 235.331 2.099 20 0 BEADLO CO[C@H](CNc1cc[nH+]c(C)n1)C1CCCC1 ZINC000664561578 411987881 /nfs/dbraw/zinc/98/78/81/411987881.db2.gz WNCWSVAUGOKEPQ-GFCCVEGCSA-N 1 2 235.331 2.402 20 0 BEADLO Cc1nc(N2CCC(c3ccon3)CC2)cc[nH+]1 ZINC000664565586 411988036 /nfs/dbraw/zinc/98/80/36/411988036.db2.gz RIWFUALFJUUDOQ-UHFFFAOYSA-N 1 2 244.298 2.157 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3nccnc3C2)cs1 ZINC000662118890 411989619 /nfs/dbraw/zinc/98/96/19/411989619.db2.gz GQZORJYWXQADQJ-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cc(C[N@H+]2CCc3nccnc3C2)cs1 ZINC000662118890 411989624 /nfs/dbraw/zinc/98/96/24/411989624.db2.gz GQZORJYWXQADQJ-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO CC[C@@H]([NH2+]CCc1cccc(C)c1)C(=O)OC ZINC000134974319 170896730 /nfs/dbraw/zinc/89/67/30/170896730.db2.gz GIHAWYKAOVXIEW-CYBMUJFWSA-N 1 2 235.327 2.079 20 0 BEADLO CC1(C)OCC[C@@H]1CNc1cccc[nH+]1 ZINC000664602123 411994884 /nfs/dbraw/zinc/99/48/84/411994884.db2.gz BONQUNPPUWDURM-SNVBAGLBSA-N 1 2 206.289 2.309 20 0 BEADLO CCc1cc(NC[C@H]2CCOC2(C)C)nc[nH+]1 ZINC000664604792 411996368 /nfs/dbraw/zinc/99/63/68/411996368.db2.gz PXZPSYGFCIOZIG-SNVBAGLBSA-N 1 2 235.331 2.266 20 0 BEADLO CCc1cc(NC[C@@H]2CCOC2(C)C)nc[nH+]1 ZINC000664604791 411996875 /nfs/dbraw/zinc/99/68/75/411996875.db2.gz PXZPSYGFCIOZIG-JTQLQIEISA-N 1 2 235.331 2.266 20 0 BEADLO CCc1ncnc(N[C@H](C)c2[nH+]ccn2C)c1F ZINC000664609045 411997764 /nfs/dbraw/zinc/99/77/64/411997764.db2.gz ULQFJBYPOYOGJS-MRVPVSSYSA-N 1 2 249.293 2.085 20 0 BEADLO Cc1nc(N(C)C[C@@H]2CC2(C)C)cc[nH+]1 ZINC000664670721 412007805 /nfs/dbraw/zinc/00/78/05/412007805.db2.gz XGDFRIXSRJWMGI-JTQLQIEISA-N 1 2 205.305 2.267 20 0 BEADLO COc1c(C)[nH+]cnc1N(C)C[C@@H]1CC1(C)C ZINC000664670013 412008353 /nfs/dbraw/zinc/00/83/53/412008353.db2.gz JRTJLVTYPHIGMZ-JTQLQIEISA-N 1 2 235.331 2.276 20 0 BEADLO Cc1nc(NC[C@@]2(C)CC2(F)F)cc[nH+]1 ZINC000664400243 411945077 /nfs/dbraw/zinc/94/50/77/411945077.db2.gz LKDRVAFRMMAFQP-SECBINFHSA-N 1 2 213.231 2.242 20 0 BEADLO Cn1c[nH+]cc1Cc1noc([C@H]2CCC2(C)C)n1 ZINC000664824947 412026580 /nfs/dbraw/zinc/02/65/80/412026580.db2.gz QBSUUNCJIUMGCH-SNVBAGLBSA-N 1 2 246.314 2.298 20 0 BEADLO CO[C@H]1c2ccccc2C[C@H]1[NH2+]CC(F)F ZINC000664952214 412052755 /nfs/dbraw/zinc/05/27/55/412052755.db2.gz GROCILRQWFXVHL-PWSUYJOCSA-N 1 2 227.254 2.154 20 0 BEADLO CCn1ccnc1C[N@H+](C)CC1=CCSC1 ZINC000662268216 412060258 /nfs/dbraw/zinc/06/02/58/412060258.db2.gz SRAKZISFYHHEDG-UHFFFAOYSA-N 1 2 237.372 2.008 20 0 BEADLO CCn1ccnc1C[N@@H+](C)CC1=CCSC1 ZINC000662268216 412060261 /nfs/dbraw/zinc/06/02/61/412060261.db2.gz SRAKZISFYHHEDG-UHFFFAOYSA-N 1 2 237.372 2.008 20 0 BEADLO CCO[C@@H](C)c1nc(Cc2c[nH+]ccc2C)no1 ZINC000664982595 412055057 /nfs/dbraw/zinc/05/50/57/412055057.db2.gz SOMIZQMFPIZZBF-JTQLQIEISA-N 1 2 247.298 2.461 20 0 BEADLO O[C@H]1C[C@H](c2ccccc2)[N@H+](CC(F)F)C1 ZINC000665029835 412057188 /nfs/dbraw/zinc/05/71/88/412057188.db2.gz ZTUNNUUEXOKJQG-WDEREUQCSA-N 1 2 227.254 2.059 20 0 BEADLO O[C@H]1C[C@H](c2ccccc2)[N@@H+](CC(F)F)C1 ZINC000665029835 412057190 /nfs/dbraw/zinc/05/71/90/412057190.db2.gz ZTUNNUUEXOKJQG-WDEREUQCSA-N 1 2 227.254 2.059 20 0 BEADLO CC[C@@H]1CCC[C@H]1Nc1[nH+]cnc2c1cnn2C ZINC000268237117 171002643 /nfs/dbraw/zinc/00/26/43/171002643.db2.gz MQLHMWRWNVOXGQ-MWLCHTKSSA-N 1 2 245.330 2.354 20 0 BEADLO CC[C@H]1CC[C@H](C(=O)NCc2[nH+]ccn2C)CC1 ZINC000275642116 171031089 /nfs/dbraw/zinc/03/10/89/171031089.db2.gz BLRYKQJAPLVSKZ-HAQNSBGRSA-N 1 2 249.358 2.253 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1c1nc[nH+]c(N)c1Cl ZINC000233935189 171055565 /nfs/dbraw/zinc/05/55/65/171055565.db2.gz RMFLBDXBXMQVEK-JGVFFNPUSA-N 1 2 240.738 2.480 20 0 BEADLO Cc1nnc([C@H](C)[N@H+](C)CC2=CCSC2)o1 ZINC000662269357 412061490 /nfs/dbraw/zinc/06/14/90/412061490.db2.gz DAJQTQOXJKZPSJ-QMMMGPOBSA-N 1 2 239.344 2.044 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+](C)CC2=CCSC2)o1 ZINC000662269357 412061494 /nfs/dbraw/zinc/06/14/94/412061494.db2.gz DAJQTQOXJKZPSJ-QMMMGPOBSA-N 1 2 239.344 2.044 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)C1(CF)CCC1 ZINC000335381944 487621868 /nfs/dbraw/zinc/62/18/68/487621868.db2.gz KRLVVMKVKXUWKO-UHFFFAOYSA-N 1 2 247.273 2.413 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccc(F)cn2)C[C@@H](C)O1 ZINC000276360053 171088353 /nfs/dbraw/zinc/08/83/53/171088353.db2.gz MBZDRGGZQHDSPY-ZWNOBZJWSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccc(F)cn2)C[C@@H](C)O1 ZINC000276360053 171088356 /nfs/dbraw/zinc/08/83/56/171088356.db2.gz MBZDRGGZQHDSPY-ZWNOBZJWSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nc(C)c(C)s2)CCO1 ZINC000176323872 171090955 /nfs/dbraw/zinc/09/09/55/171090955.db2.gz BLJCTUXRXWIPNP-LLVKDONJSA-N 1 2 240.372 2.371 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nc(C)c(C)s2)CCO1 ZINC000176323872 171090956 /nfs/dbraw/zinc/09/09/56/171090956.db2.gz BLJCTUXRXWIPNP-LLVKDONJSA-N 1 2 240.372 2.371 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1ncc(C)s1 ZINC000271501844 171109780 /nfs/dbraw/zinc/10/97/80/171109780.db2.gz KRWHDGWKZNKSBA-GXSJLCMTSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ncc(C)s1 ZINC000271501844 171109781 /nfs/dbraw/zinc/10/97/81/171109781.db2.gz KRWHDGWKZNKSBA-GXSJLCMTSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[C@H](C[NH2+]CC(F)(F)F)CCO1 ZINC000336744071 171130439 /nfs/dbraw/zinc/13/04/39/171130439.db2.gz YVTXFYKADOTOJM-RKDXNWHRSA-N 1 2 225.254 2.344 20 0 BEADLO CCc1cc(N[C@@H]2C[C@H](OC)C23CCC3)nc[nH+]1 ZINC000665738161 487621764 /nfs/dbraw/zinc/62/17/64/487621764.db2.gz KWEUSBDETMAPND-NEPJUHHUSA-N 1 2 247.342 2.409 20 0 BEADLO CC[C@@H]1[C@H](C)CCN1c1cc(C)[nH+]cn1 ZINC000302465130 171161222 /nfs/dbraw/zinc/16/12/22/171161222.db2.gz VTRCQWKSTWVEDB-MWLCHTKSSA-N 1 2 205.305 2.410 20 0 BEADLO CC[C@@](C)(CO)Nc1cc(C)[nH+]c(C(C)C)n1 ZINC000080882438 171170816 /nfs/dbraw/zinc/17/08/16/171170816.db2.gz LQPUTOUKVBASOO-ZDUSSCGKSA-N 1 2 237.347 2.481 20 0 BEADLO CC[C@@](C)([NH2+]Cc1ccc(C)cc1)C(=O)OC ZINC000299724708 171175577 /nfs/dbraw/zinc/17/55/77/171175577.db2.gz UCTJFZNEUOARON-CQSZACIVSA-N 1 2 235.327 2.426 20 0 BEADLO CC[C@@]1(C)C[N@H+](Cc2ncc(C)s2)CCO1 ZINC000190105811 171204785 /nfs/dbraw/zinc/20/47/85/171204785.db2.gz QSWSYERKHKRJHX-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO CC[C@@]1(C)C[N@@H+](Cc2ncc(C)s2)CCO1 ZINC000190105811 171204787 /nfs/dbraw/zinc/20/47/87/171204787.db2.gz QSWSYERKHKRJHX-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO CCc1cc(N[C@@H]2C[C@@H](OC)C23CCC3)nc[nH+]1 ZINC000665738164 487621903 /nfs/dbraw/zinc/62/19/03/487621903.db2.gz KWEUSBDETMAPND-VXGBXAGGSA-N 1 2 247.342 2.409 20 0 BEADLO CC[C@H](C)C(=O)N1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000125557351 171248918 /nfs/dbraw/zinc/24/89/18/171248918.db2.gz SBYAQSCPLYVKQA-YNEHKIRRSA-N 1 2 249.358 2.339 20 0 BEADLO CC[C@H](C)C(=O)NCCCNc1cccc[nH+]1 ZINC000115161839 171250786 /nfs/dbraw/zinc/25/07/86/171250786.db2.gz LHPKPMMWUSEUPB-NSHDSACASA-N 1 2 235.331 2.046 20 0 BEADLO CC[C@H](C)CN(CC)C(=O)CCn1cc[nH+]c1 ZINC000267082849 171277258 /nfs/dbraw/zinc/27/72/58/171277258.db2.gz GUBLXLCWYBIZKC-LBPRGKRZSA-N 1 2 237.347 2.168 20 0 BEADLO CC[C@H](C)CONC(=O)Nc1cc[nH+]c(C)c1 ZINC000297897284 171290218 /nfs/dbraw/zinc/29/02/18/171290218.db2.gz XHJBABODGQNEDF-VIFPVBQESA-N 1 2 237.303 2.489 20 0 BEADLO CC[C@H](C)C[C@@H](C)NC(=O)c1c[nH+]c(C)[nH]1 ZINC000266470825 171294644 /nfs/dbraw/zinc/29/46/44/171294644.db2.gz JDQDBKRNTMZNQZ-DTWKUNHWSA-N 1 2 223.320 2.273 20 0 BEADLO CC[C@H](C)C[C@H](C)NC(=O)CCn1cc[nH+]c1 ZINC000266339604 171296154 /nfs/dbraw/zinc/29/61/54/171296154.db2.gz LWJVYTRLYBHRTQ-RYUDHWBXSA-N 1 2 237.347 2.214 20 0 BEADLO CC[C@H](C)NC(=O)[C@H](C)[NH+]1Cc2ccccc2C1 ZINC000178646304 171334580 /nfs/dbraw/zinc/33/45/80/171334580.db2.gz GCABMSSHHXZILG-RYUDHWBXSA-N 1 2 246.354 2.305 20 0 BEADLO CC[C@H](C)[NH2+][C@@H](c1cccs1)c1nnc[nH]1 ZINC000295964890 171348440 /nfs/dbraw/zinc/34/84/40/171348440.db2.gz MKCKCFHSCSRFDC-WPRPVWTQSA-N 1 2 236.344 2.344 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000272502564 171360028 /nfs/dbraw/zinc/36/00/28/171360028.db2.gz DUZZZFWKYJQWHZ-SDDRHHMPSA-N 1 2 237.347 2.070 20 0 BEADLO CC[C@H](C)[C@@H]([NH2+]CC=C(C)C)C(=O)OC ZINC000336747480 171374465 /nfs/dbraw/zinc/37/44/65/171374465.db2.gz BWJPSELYULBMDM-WDEREUQCSA-N 1 2 213.321 2.130 20 0 BEADLO CC[C@H](C)[C@H]([NH2+]CCc1ccccc1)C(=O)OC ZINC000035044496 171398969 /nfs/dbraw/zinc/39/89/69/171398969.db2.gz YNYWNHSEWFELCZ-JSGCOSHPSA-N 1 2 249.354 2.406 20 0 BEADLO CC12CC(C1)C[N@@H+]2Cc1nnc(C2CC2)s1 ZINC000662386118 412140463 /nfs/dbraw/zinc/14/04/63/412140463.db2.gz UHBCTARPRXHWIQ-UHFFFAOYSA-N 1 2 235.356 2.400 20 0 BEADLO CC12CC(C1)C[N@H+]2Cc1nnc(C2CC2)s1 ZINC000662386118 412140467 /nfs/dbraw/zinc/14/04/67/412140467.db2.gz UHBCTARPRXHWIQ-UHFFFAOYSA-N 1 2 235.356 2.400 20 0 BEADLO Cc1nc([C@H](C)[N@H+](C)C[C@H]2CC2(C)C)no1 ZINC000662346005 412115189 /nfs/dbraw/zinc/11/51/89/412115189.db2.gz PUZLUYDDSSCBFX-WCBMZHEXSA-N 1 2 223.320 2.417 20 0 BEADLO Cc1nc([C@H](C)[N@@H+](C)C[C@H]2CC2(C)C)no1 ZINC000662346005 412115193 /nfs/dbraw/zinc/11/51/93/412115193.db2.gz PUZLUYDDSSCBFX-WCBMZHEXSA-N 1 2 223.320 2.417 20 0 BEADLO Cn1cc[nH+]c1-c1cc2c(cc1N)CCC2 ZINC000665181429 412122339 /nfs/dbraw/zinc/12/23/39/412122339.db2.gz RKPYSLFHPMZUGW-UHFFFAOYSA-N 1 2 213.284 2.158 20 0 BEADLO CC(C)(C)c1noc(C[N@@H+]2CC3CC2(C)C3)n1 ZINC000662380104 412131352 /nfs/dbraw/zinc/13/13/52/412131352.db2.gz KMXHKZSVWRSCIP-UHFFFAOYSA-N 1 2 235.331 2.351 20 0 BEADLO CC(C)(C)c1noc(C[N@H+]2CC3CC2(C)C3)n1 ZINC000662380104 412131355 /nfs/dbraw/zinc/13/13/55/412131355.db2.gz KMXHKZSVWRSCIP-UHFFFAOYSA-N 1 2 235.331 2.351 20 0 BEADLO CCc1nc(Cn2cc[nH+]c2)sc1C ZINC000663221026 412394238 /nfs/dbraw/zinc/39/42/38/412394238.db2.gz YCKYYAHFIYIQCO-UHFFFAOYSA-N 1 2 207.302 2.259 20 0 BEADLO CCCCC[C@@H]([NH2+][C@H](CC)COC)C(=O)OC ZINC001652223460 1173046969 /nfs/dbraw/zinc/04/69/69/1173046969.db2.gz JPCDABDRAFKNCE-VXGBXAGGSA-N 1 2 245.363 2.123 20 0 BEADLO CCc1nnc([C@@H](C)[NH2+]Cc2ccc(C)o2)[nH]1 ZINC000270635019 172002144 /nfs/dbraw/zinc/00/21/44/172002144.db2.gz GQRCXAGVFFNZRH-SECBINFHSA-N 1 2 234.303 2.119 20 0 BEADLO CCc1nc([C@@H](C)NCc2[nH]cc[nH+]2)cs1 ZINC000111406683 172002273 /nfs/dbraw/zinc/00/22/73/172002273.db2.gz DSELQAYQTMJWHB-MRVPVSSYSA-N 1 2 236.344 2.279 20 0 BEADLO CCc1nnc([C@H](C)[NH2+][C@H](C)c2ccncc2)[nH]1 ZINC000358245272 172006978 /nfs/dbraw/zinc/00/69/78/172006978.db2.gz HJSNBSHBQURGBE-ZJUUUORDSA-N 1 2 245.330 2.174 20 0 BEADLO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2ccccn2)[nH]1 ZINC000271569083 172007226 /nfs/dbraw/zinc/00/72/26/172007226.db2.gz VKJMHXXUZNENTF-UWVGGRQHSA-N 1 2 245.330 2.174 20 0 BEADLO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2ccco2)[nH]1 ZINC000271502198 172007784 /nfs/dbraw/zinc/00/77/84/172007784.db2.gz MEPNXTWBPMTDQM-IUCAKERBSA-N 1 2 234.303 2.372 20 0 BEADLO CCc1ncc(C[N@@H+]2CCOCC23CC3)s1 ZINC000336433746 172016948 /nfs/dbraw/zinc/01/69/48/172016948.db2.gz YLBVJFFWANQTCK-UHFFFAOYSA-N 1 2 238.356 2.070 20 0 BEADLO CCc1ncc(C[N@H+]2CCOCC23CC3)s1 ZINC000336433746 172016949 /nfs/dbraw/zinc/01/69/49/172016949.db2.gz YLBVJFFWANQTCK-UHFFFAOYSA-N 1 2 238.356 2.070 20 0 BEADLO CCc1nn(C)cc1N[C@@H](CC)c1[nH+]ccn1C ZINC000272083652 172044017 /nfs/dbraw/zinc/04/40/17/172044017.db2.gz WPYAYGWIADBFQK-NSHDSACASA-N 1 2 247.346 2.279 20 0 BEADLO CCc1nnc(C[NH+]2CCC(C(F)F)CC2)o1 ZINC000336718708 172048901 /nfs/dbraw/zinc/04/89/01/172048901.db2.gz XDRLZXNMHJITBL-UHFFFAOYSA-N 1 2 245.273 2.109 20 0 BEADLO CCc1nnc([C@H](C)[N@@H+]2C[C@@H](C)[C@H]2C)o1 ZINC000339581755 172066215 /nfs/dbraw/zinc/06/62/15/172066215.db2.gz XGLFNCYVGYRSAB-HLTSFMKQSA-N 1 2 209.293 2.033 20 0 BEADLO CCc1nnc([C@H](C)[N@H+]2C[C@@H](C)[C@H]2C)o1 ZINC000339581755 172066216 /nfs/dbraw/zinc/06/62/16/172066216.db2.gz XGLFNCYVGYRSAB-HLTSFMKQSA-N 1 2 209.293 2.033 20 0 BEADLO CCc1noc(C)c1CNc1cc[nH+]c(C)n1 ZINC000292850496 172080755 /nfs/dbraw/zinc/08/07/55/172080755.db2.gz RGTPMPBROZNHDZ-UHFFFAOYSA-N 1 2 232.287 2.256 20 0 BEADLO CCc1noc([C@H](C)[N@@H+]2C[C@H](C)[C@H]2C)n1 ZINC000339567472 172092327 /nfs/dbraw/zinc/09/23/27/172092327.db2.gz JAPZASPBJLHXGX-YIZRAAEISA-N 1 2 209.293 2.033 20 0 BEADLO CCc1noc([C@H](C)[N@H+]2C[C@H](C)[C@H]2C)n1 ZINC000339567472 172092328 /nfs/dbraw/zinc/09/23/28/172092328.db2.gz JAPZASPBJLHXGX-YIZRAAEISA-N 1 2 209.293 2.033 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1cncc(F)c1 ZINC000293432667 172095742 /nfs/dbraw/zinc/09/57/42/172095742.db2.gz NYIBHTRAZDLRHK-UHFFFAOYSA-N 1 2 249.289 2.403 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1cncc(F)c1 ZINC000293432667 172095744 /nfs/dbraw/zinc/09/57/44/172095744.db2.gz NYIBHTRAZDLRHK-UHFFFAOYSA-N 1 2 249.289 2.403 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1cnoc1C ZINC000339607560 172095985 /nfs/dbraw/zinc/09/59/85/172095985.db2.gz ZEYUZSNMIYTZDP-UHFFFAOYSA-N 1 2 235.287 2.165 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1cnoc1C ZINC000339607560 172095986 /nfs/dbraw/zinc/09/59/86/172095986.db2.gz ZEYUZSNMIYTZDP-UHFFFAOYSA-N 1 2 235.287 2.165 20 0 BEADLO CCc1nocc1C[N@@H+]1CCO[C@@](C)(CC)C1 ZINC000353120645 172097834 /nfs/dbraw/zinc/09/78/34/172097834.db2.gz QWSXCBXTOLKOGF-ZDUSSCGKSA-N 1 2 238.331 2.238 20 0 BEADLO CCc1nocc1C[N@H+]1CCO[C@@](C)(CC)C1 ZINC000353120645 172097835 /nfs/dbraw/zinc/09/78/35/172097835.db2.gz QWSXCBXTOLKOGF-ZDUSSCGKSA-N 1 2 238.331 2.238 20 0 BEADLO CCc1nocc1C[N@@H+]1CC[C@@](C)(F)C1 ZINC000336603842 172098433 /nfs/dbraw/zinc/09/84/33/172098433.db2.gz IRXFEYJZUOBIPA-LLVKDONJSA-N 1 2 212.268 2.171 20 0 BEADLO CCc1nocc1C[N@H+]1CC[C@@](C)(F)C1 ZINC000336603842 172098434 /nfs/dbraw/zinc/09/84/34/172098434.db2.gz IRXFEYJZUOBIPA-LLVKDONJSA-N 1 2 212.268 2.171 20 0 BEADLO CCc1nsc(N2CCC[C@@H]2c2[nH]cc[nH+]2)n1 ZINC000371597845 172104193 /nfs/dbraw/zinc/10/41/93/172104193.db2.gz QYEUAFDONPSGSK-MRVPVSSYSA-N 1 2 249.343 2.165 20 0 BEADLO CCn1cc(N[C@@H]2C[C@@H](C)n3cc[nH+]c32)cn1 ZINC000294165134 172186828 /nfs/dbraw/zinc/18/68/28/172186828.db2.gz RAEJNFSCJPSBGG-MWLCHTKSSA-N 1 2 231.303 2.217 20 0 BEADLO CCn1cc([C@H](C)Nc2cc[nH+]c(C)n2)cn1 ZINC000295486382 172199071 /nfs/dbraw/zinc/19/90/71/172199071.db2.gz AFESQZHKZXJVKD-VIFPVBQESA-N 1 2 231.303 2.175 20 0 BEADLO CCn1cc[nH+]c1CN1CCC[C@H]1C(F)F ZINC000353171680 172220705 /nfs/dbraw/zinc/22/07/05/172220705.db2.gz MJKMWFKSWQQITR-VIFPVBQESA-N 1 2 229.274 2.133 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C(C)=C1CCCC1 ZINC000297282754 172221883 /nfs/dbraw/zinc/22/18/83/172221883.db2.gz SXRWMMRKWGDIJG-UHFFFAOYSA-N 1 2 247.342 2.410 20 0 BEADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)C1CC1 ZINC000281694038 172230684 /nfs/dbraw/zinc/23/06/84/172230684.db2.gz GQIJGJKFOQZLAW-GFCCVEGCSA-N 1 2 247.342 2.367 20 0 BEADLO CCn1cnnc1C[NH2+][C@@H](C)c1ccsc1 ZINC000166622464 172236177 /nfs/dbraw/zinc/23/61/77/172236177.db2.gz PYYWVYWZPMNOTB-VIFPVBQESA-N 1 2 236.344 2.210 20 0 BEADLO CCn1cnnc1C[NH2+]Cc1ccc(F)c(C)c1 ZINC000105419479 172236274 /nfs/dbraw/zinc/23/62/74/172236274.db2.gz PQLPFUFDMROVAF-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO CCn1nc(C)c(CNc2ccc(C)[nH+]c2C)n1 ZINC000295919017 172246810 /nfs/dbraw/zinc/24/68/10/172246810.db2.gz ZYWIIWGOHMXCPP-UHFFFAOYSA-N 1 2 245.330 2.230 20 0 BEADLO CCn1nc(C)c(C[NH2+]Cc2ccccc2F)n1 ZINC000294815688 172246999 /nfs/dbraw/zinc/24/69/99/172246999.db2.gz QVEZFVVIIFJBBV-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO CCn1nccc1C[N@H+](C)[C@@H](C)c1ccncc1 ZINC000183713234 172263964 /nfs/dbraw/zinc/26/39/64/172263964.db2.gz BXDJKIXMAMGVEV-LBPRGKRZSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1nccc1C[N@@H+](C)[C@@H](C)c1ccncc1 ZINC000183713234 172263965 /nfs/dbraw/zinc/26/39/65/172263965.db2.gz BXDJKIXMAMGVEV-LBPRGKRZSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1nccc1CNc1c[nH+]ccc1C ZINC000119823560 172273651 /nfs/dbraw/zinc/27/36/51/172273651.db2.gz USTZVIKAKZCTJI-UHFFFAOYSA-N 1 2 216.288 2.219 20 0 BEADLO CCn1ncnc1C[N@H+](C)Cc1ccccc1C ZINC000278490728 172278639 /nfs/dbraw/zinc/27/86/39/172278639.db2.gz JKVJEICBTNREKI-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1ncnc1C[N@@H+](C)Cc1ccccc1C ZINC000278490728 172278643 /nfs/dbraw/zinc/27/86/43/172278643.db2.gz JKVJEICBTNREKI-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CN(C)C(=O)[C@H]1CCC[C@H](Nc2cccc[nH+]2)C1 ZINC000265138684 172386419 /nfs/dbraw/zinc/38/64/19/172386419.db2.gz PQIOEEWMFQENKK-RYUDHWBXSA-N 1 2 247.342 2.141 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)c1nc2c(cccc2F)o1 ZINC000362647182 172929042 /nfs/dbraw/zinc/92/90/42/172929042.db2.gz AFYSVMYNWZUBMI-UHFFFAOYSA-N 1 2 246.245 2.326 20 0 BEADLO CC/C=C(\C)C(=O)N(C)CCCn1cc[nH+]c1 ZINC000269140421 487625818 /nfs/dbraw/zinc/62/58/18/487625818.db2.gz ZSCFKLVFNDCDIL-WUXMJOGZSA-N 1 2 235.331 2.088 20 0 BEADLO CNC(=O)CCCNc1ccc2ccccc2[nH+]1 ZINC000264938259 173244057 /nfs/dbraw/zinc/24/40/57/173244057.db2.gz RFFZDOGWQYKTQI-UHFFFAOYSA-N 1 2 243.310 2.173 20 0 BEADLO CNC(=O)COc1ccc([NH2+][C@@H](C)C2CC2)cc1 ZINC000179818155 173279232 /nfs/dbraw/zinc/27/92/32/173279232.db2.gz AZRBZMZPLKPMPG-JTQLQIEISA-N 1 2 248.326 2.022 20 0 BEADLO COC1(CNc2cc(C)[nH+]cn2)CCCC1 ZINC000310025331 174005381 /nfs/dbraw/zinc/00/53/81/174005381.db2.gz OYZJHIOOJQGPEK-UHFFFAOYSA-N 1 2 221.304 2.156 20 0 BEADLO COC1C[NH+](Cc2ccccc2OC(C)C)C1 ZINC000357922222 174034840 /nfs/dbraw/zinc/03/48/40/174034840.db2.gz ZCTJVEPCGABCIT-UHFFFAOYSA-N 1 2 235.327 2.304 20 0 BEADLO COC1C[NH+](C/C=C\c2ccccc2)C1 ZINC000358927534 174035744 /nfs/dbraw/zinc/03/57/44/174035744.db2.gz SAOLQIRWQAWNKC-YVMONPNESA-N 1 2 203.285 2.030 20 0 BEADLO COCC(C)(C)CNc1cc[nH+]c(C2CC2)n1 ZINC000291780120 174076005 /nfs/dbraw/zinc/07/60/05/174076005.db2.gz IBDUOCWIKBBVLD-UHFFFAOYSA-N 1 2 235.331 2.439 20 0 BEADLO COCC1=CC[N@H+](Cc2nc(C)c(C)o2)CC1 ZINC000187694105 174117959 /nfs/dbraw/zinc/11/79/59/174117959.db2.gz MZPKAJNKHRJAPG-UHFFFAOYSA-N 1 2 236.315 2.070 20 0 BEADLO COCC1=CC[N@@H+](Cc2nc(C)c(C)o2)CC1 ZINC000187694105 174117961 /nfs/dbraw/zinc/11/79/61/174117961.db2.gz MZPKAJNKHRJAPG-UHFFFAOYSA-N 1 2 236.315 2.070 20 0 BEADLO COCCC1(C)C[NH+](Cc2ncc(C)s2)C1 ZINC000297470141 174153279 /nfs/dbraw/zinc/15/32/79/174153279.db2.gz SIJJGRLNSKGTJX-UHFFFAOYSA-N 1 2 240.372 2.310 20 0 BEADLO COCCCCCNc1cc[nH+]c(C)n1 ZINC000230902319 174185027 /nfs/dbraw/zinc/18/50/27/174185027.db2.gz PBNKSRUQOKAACV-UHFFFAOYSA-N 1 2 209.293 2.014 20 0 BEADLO COCCC[N@H+](C)Cc1csc(Cl)n1 ZINC000290037784 174218401 /nfs/dbraw/zinc/21/84/01/174218401.db2.gz NUOWDYCNXWTXEG-UHFFFAOYSA-N 1 2 234.752 2.265 20 0 BEADLO COCCC[N@@H+](C)Cc1csc(Cl)n1 ZINC000290037784 174218402 /nfs/dbraw/zinc/21/84/02/174218402.db2.gz NUOWDYCNXWTXEG-UHFFFAOYSA-N 1 2 234.752 2.265 20 0 BEADLO COCCCN(C)c1cc(C)[nH+]c(C2CC2)n1 ZINC000265318840 174220927 /nfs/dbraw/zinc/22/09/27/174220927.db2.gz DMGZGHVAXIXAFB-UHFFFAOYSA-N 1 2 235.331 2.135 20 0 BEADLO COCC[N@H+](Cc1ccn(C(C)C)n1)C1CC1 ZINC000336703782 174300532 /nfs/dbraw/zinc/30/05/32/174300532.db2.gz NDOWMOIPVSKJNS-UHFFFAOYSA-N 1 2 237.347 2.075 20 0 BEADLO COCC[N@@H+](Cc1ccn(C(C)C)n1)C1CC1 ZINC000336703782 174300534 /nfs/dbraw/zinc/30/05/34/174300534.db2.gz NDOWMOIPVSKJNS-UHFFFAOYSA-N 1 2 237.347 2.075 20 0 BEADLO COCC[C@@H](C)Nc1cc[nH+]c(C(C)C)n1 ZINC000110464632 174386058 /nfs/dbraw/zinc/38/60/58/174386058.db2.gz RSJDLIIHHYWXCO-SNVBAGLBSA-N 1 2 223.320 2.437 20 0 BEADLO COC[C@@H](CNc1[nH+]ccc(C)c1Cl)OC ZINC000336759879 174473131 /nfs/dbraw/zinc/47/31/31/174473131.db2.gz JIATZWDMBOCWDO-SECBINFHSA-N 1 2 244.722 2.117 20 0 BEADLO CO[C@H](C)C[N@H+](CC(F)F)CC1CCC1 ZINC000360209324 174825579 /nfs/dbraw/zinc/82/55/79/174825579.db2.gz POVCDRQNYWXLAA-SECBINFHSA-N 1 2 221.291 2.389 20 0 BEADLO CO[C@H](C)C[N@@H+](CC(F)F)CC1CCC1 ZINC000360209324 174825582 /nfs/dbraw/zinc/82/55/82/174825582.db2.gz POVCDRQNYWXLAA-SECBINFHSA-N 1 2 221.291 2.389 20 0 BEADLO CO[C@H](C)c1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000273932973 174853714 /nfs/dbraw/zinc/85/37/14/174853714.db2.gz MEEXOXBRQQKEKJ-SECBINFHSA-N 1 2 233.271 2.071 20 0 BEADLO COc1ccc(-c2cc[nH+]c(N)c2)c(F)c1 ZINC000082729972 175035877 /nfs/dbraw/zinc/03/58/77/175035877.db2.gz DGEIUQGGOLRHOQ-UHFFFAOYSA-N 1 2 218.231 2.479 20 0 BEADLO COc1ccc(F)c(NCc2[nH+]ccn2C)c1 ZINC000094854369 175126368 /nfs/dbraw/zinc/12/63/68/175126368.db2.gz OWFJKMYUTJMEAC-UHFFFAOYSA-N 1 2 235.262 2.180 20 0 BEADLO COc1ccc(N(C)c2[nH+]cccc2N)cc1 ZINC000049969615 175136593 /nfs/dbraw/zinc/13/65/93/175136593.db2.gz OYJKOIPEZYNOED-UHFFFAOYSA-N 1 2 229.283 2.440 20 0 BEADLO COc1ccc(Nc2ccc(N)[nH+]c2)c(OC)c1 ZINC000019952215 175155924 /nfs/dbraw/zinc/15/59/24/175155924.db2.gz NBMWVRDKZKUGDZ-UHFFFAOYSA-N 1 2 245.282 2.425 20 0 BEADLO COc1ccc(N[C@H]2C[C@H](C)n3cc[nH+]c32)cn1 ZINC000294098695 175155967 /nfs/dbraw/zinc/15/59/67/175155967.db2.gz MMNJXWWJDDLCQS-ONGXEEELSA-N 1 2 244.298 2.405 20 0 BEADLO COc1ccc(Nc2[nH+]cccc2N)c(OC)c1 ZINC000020317646 175156679 /nfs/dbraw/zinc/15/66/79/175156679.db2.gz BZWUJOBWAFUXDB-UHFFFAOYSA-N 1 2 245.282 2.425 20 0 BEADLO COc1ccc([C@H](C)[NH2+]Cc2noc(C)n2)cc1 ZINC000223627969 175189325 /nfs/dbraw/zinc/18/93/25/175189325.db2.gz ZWDBWLCCAMCHFZ-VIFPVBQESA-N 1 2 247.298 2.237 20 0 BEADLO COc1cccc(C2([NH2+]Cc3c[nH]cn3)CC2)c1 ZINC000280143648 175248007 /nfs/dbraw/zinc/24/80/07/175248007.db2.gz CJRGGVOYNQOPID-UHFFFAOYSA-N 1 2 243.310 2.197 20 0 BEADLO COc1cccc(CCNc2cc[nH+]c(C)n2)c1 ZINC000230899934 175252547 /nfs/dbraw/zinc/25/25/47/175252547.db2.gz AIEICMZZFNUJRC-UHFFFAOYSA-N 1 2 243.310 2.448 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2ccoc2)n1 ZINC000353293367 175254641 /nfs/dbraw/zinc/25/46/41/175254641.db2.gz FNUUULHINTVIGL-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2ccoc2)n1 ZINC000353293367 175254643 /nfs/dbraw/zinc/25/46/43/175254643.db2.gz FNUUULHINTVIGL-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1cccc(F)c1NCc1c[nH+]cn1C ZINC000358221757 175274399 /nfs/dbraw/zinc/27/43/99/175274399.db2.gz JBKFCPSCJJPZAM-UHFFFAOYSA-N 1 2 235.262 2.180 20 0 BEADLO COc1cccc(NCc2[nH]cc[nH+]2)c1 ZINC000049714594 175279443 /nfs/dbraw/zinc/27/94/43/175279443.db2.gz WJYYGHUYDSLBEF-UHFFFAOYSA-N 1 2 203.245 2.030 20 0 BEADLO COc1cccc2c(NCCCO)cc[nH+]c12 ZINC000275617297 175300287 /nfs/dbraw/zinc/30/02/87/175300287.db2.gz RPHCJSFRUWVEHT-UHFFFAOYSA-N 1 2 232.283 2.038 20 0 BEADLO COc1cccc2c1CC[N@H+](Cc1cocn1)C2 ZINC000191975335 175300827 /nfs/dbraw/zinc/30/08/27/175300827.db2.gz DSRFMDIAKCSONP-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1cccc2c1CC[N@@H+](Cc1cocn1)C2 ZINC000191975335 175300829 /nfs/dbraw/zinc/30/08/29/175300829.db2.gz DSRFMDIAKCSONP-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1ccccc1/C=C/C[N@@H+]1CCOC[C@@H]1C ZINC000091810469 175313982 /nfs/dbraw/zinc/31/39/82/175313982.db2.gz UYVQSIORIKEGQC-IYNGYCSASA-N 1 2 247.338 2.429 20 0 BEADLO COc1ccccc1/C=C/C[N@H+]1CCOC[C@@H]1C ZINC000091810469 175313984 /nfs/dbraw/zinc/31/39/84/175313984.db2.gz UYVQSIORIKEGQC-IYNGYCSASA-N 1 2 247.338 2.429 20 0 BEADLO COc1ccccc1C[N@@H+]1CCC(=O)[C@H](C)C1 ZINC000049693512 175326512 /nfs/dbraw/zinc/32/65/12/175326512.db2.gz QQLJIFJPUWHVER-LLVKDONJSA-N 1 2 233.311 2.106 20 0 BEADLO COc1ccccc1C[N@H+]1CCC(=O)[C@H](C)C1 ZINC000049693512 175326514 /nfs/dbraw/zinc/32/65/14/175326514.db2.gz QQLJIFJPUWHVER-LLVKDONJSA-N 1 2 233.311 2.106 20 0 BEADLO COc1ccccc1C[NH2+]Cc1nc(C)c[nH]1 ZINC000045205739 175330530 /nfs/dbraw/zinc/33/05/30/175330530.db2.gz OLJQKHKTVFTYDA-UHFFFAOYSA-N 1 2 231.299 2.017 20 0 BEADLO COc1ccccc1Nc1ccc(N)[nH+]c1 ZINC000019952103 175340066 /nfs/dbraw/zinc/34/00/66/175340066.db2.gz CDRQRRBPJRRWNG-UHFFFAOYSA-N 1 2 215.256 2.416 20 0 BEADLO COc1ccccc1OCCOCc1[nH]cc[nH+]1 ZINC000123877275 175342013 /nfs/dbraw/zinc/34/20/13/175342013.db2.gz OBXDTWDHIMMNHB-UHFFFAOYSA-N 1 2 248.282 2.014 20 0 BEADLO COc1ccccc1[C@@H](C)[NH2+]Cc1nonc1C ZINC000149259061 175346175 /nfs/dbraw/zinc/34/61/75/175346175.db2.gz AEVGYLZVHCYSBS-SECBINFHSA-N 1 2 247.298 2.237 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)C1=CCCCC1 ZINC000293432471 175369531 /nfs/dbraw/zinc/36/95/31/175369531.db2.gz SNUKTLJRQXPWTJ-UHFFFAOYSA-N 1 2 246.310 2.207 20 0 BEADLO COc1cc[nH+]cc1COc1ccc(C)nc1 ZINC000341344771 175373471 /nfs/dbraw/zinc/37/34/71/175373471.db2.gz UAAHENIBKHGCQA-UHFFFAOYSA-N 1 2 230.267 2.373 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C1CCCC1 ZINC000299485816 175375785 /nfs/dbraw/zinc/37/57/85/175375785.db2.gz LMOUYZAUWDWJEF-UHFFFAOYSA-N 1 2 220.272 2.219 20 0 BEADLO COc1cc[nH+]cc1NC[C@H]1CCSC1 ZINC000278298214 175376262 /nfs/dbraw/zinc/37/62/62/175376262.db2.gz BYVLUJRRMNJYBI-SECBINFHSA-N 1 2 224.329 2.255 20 0 BEADLO COc1ccsc1C[N@H+](C)Cc1cc[nH]n1 ZINC000353540214 175376949 /nfs/dbraw/zinc/37/69/49/175376949.db2.gz CRRVGCNCFIRAQU-UHFFFAOYSA-N 1 2 237.328 2.112 20 0 BEADLO COc1ccsc1C[N@@H+](C)Cc1cc[nH]n1 ZINC000353540214 175376950 /nfs/dbraw/zinc/37/69/50/175376950.db2.gz CRRVGCNCFIRAQU-UHFFFAOYSA-N 1 2 237.328 2.112 20 0 BEADLO COc1ncc(C[N@H+](C)Cc2ccoc2)c(C)n1 ZINC000337141802 175397959 /nfs/dbraw/zinc/39/79/59/175397959.db2.gz SPCLDICGQPIZSM-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1ncc(C[N@@H+](C)Cc2ccoc2)c(C)n1 ZINC000337141802 175397960 /nfs/dbraw/zinc/39/79/60/175397960.db2.gz SPCLDICGQPIZSM-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO CS[C@@H](CNc1cc(C)[nH+]cn1)C(C)(C)C ZINC000336696679 175545390 /nfs/dbraw/zinc/54/53/90/175545390.db2.gz LYGVIWASYFWECJ-JTQLQIEISA-N 1 2 239.388 2.397 20 0 BEADLO Cc1ccc(NC(=O)C2(C)CCOCC2)c(C)[nH+]1 ZINC000674838657 487632244 /nfs/dbraw/zinc/63/22/44/487632244.db2.gz SZBVICCKXOTODD-UHFFFAOYSA-N 1 2 248.326 2.454 20 0 BEADLO C[C@@H](c1ccccc1)[N@H+](C)Cc1cn(C)nn1 ZINC000336701652 176019858 /nfs/dbraw/zinc/01/98/58/176019858.db2.gz PXUMJABXISAEPL-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1ccccc1)[N@@H+](C)Cc1cn(C)nn1 ZINC000336701652 176019860 /nfs/dbraw/zinc/01/98/60/176019860.db2.gz PXUMJABXISAEPL-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1cccs1)[N@H+](C)Cc1ncnn1C ZINC000177032351 176032968 /nfs/dbraw/zinc/03/29/68/176032968.db2.gz OTZVEXPHWRUAQO-VIFPVBQESA-N 1 2 236.344 2.070 20 0 BEADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1ncnn1C ZINC000177032351 176032970 /nfs/dbraw/zinc/03/29/70/176032970.db2.gz OTZVEXPHWRUAQO-VIFPVBQESA-N 1 2 236.344 2.070 20 0 BEADLO C[C@@H](c1cnccn1)[N@@H+]1C[C@@H](C)OC(C)(C)C1 ZINC000184473835 176037230 /nfs/dbraw/zinc/03/72/30/176037230.db2.gz XQKBGVJBRZUECV-MNOVXSKESA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H](c1cnccn1)[N@H+]1C[C@@H](C)OC(C)(C)C1 ZINC000184473835 176037231 /nfs/dbraw/zinc/03/72/31/176037231.db2.gz XQKBGVJBRZUECV-MNOVXSKESA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H](c1csnn1)[NH+]1CCC(CF)CC1 ZINC000336261738 176037289 /nfs/dbraw/zinc/03/72/89/176037289.db2.gz MFKVSGZCQNYPMM-QMMMGPOBSA-N 1 2 229.324 2.281 20 0 BEADLO C[C@@H]1CC(NC(=O)CCc2c[nH+]c[nH]2)C[C@@H](C)C1 ZINC000193324419 176053390 /nfs/dbraw/zinc/05/33/90/176053390.db2.gz IDVFGUUGUCQZDS-QWRGUYRKSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CC(NC(=O)CCc2c[nH]c[nH+]2)C[C@@H](C)C1 ZINC000193324419 176053391 /nfs/dbraw/zinc/05/33/91/176053391.db2.gz IDVFGUUGUCQZDS-QWRGUYRKSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CCCC[C@@H]1NC(=O)COc1cc[nH+]cc1 ZINC000276389748 176078647 /nfs/dbraw/zinc/07/86/47/176078647.db2.gz BNAMOQJELGHAIZ-YPMHNXCESA-N 1 2 248.326 2.155 20 0 BEADLO C[C@@H]1CCCC[C@H]1N(C)C(=O)CCn1cc[nH+]c1 ZINC000299619725 176085251 /nfs/dbraw/zinc/08/52/51/176085251.db2.gz QAXFRJWKCXQMFG-CHWSQXEVSA-N 1 2 249.358 2.310 20 0 BEADLO C[C@@H]1CCC[C@@H](C)C1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000283965697 176113301 /nfs/dbraw/zinc/11/33/01/176113301.db2.gz MBAQQRWNEHEALJ-AFPRHGJPSA-N 1 2 247.342 2.364 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)CCn2cc[nH+]c2)CC1 ZINC000275965081 176121583 /nfs/dbraw/zinc/12/15/83/176121583.db2.gz IYIIZUMZWUJZQJ-CHWSQXEVSA-N 1 2 249.358 2.358 20 0 BEADLO C[C@@H]1CCC[C@H](CC(=O)NCc2c[nH+]c[nH]2)C1 ZINC000330896958 176136862 /nfs/dbraw/zinc/13/68/62/176136862.db2.gz LSPFODLDWBFPLD-MNOVXSKESA-N 1 2 235.331 2.242 20 0 BEADLO C[C@@H]1CCC[C@H](CC(=O)NCc2c[nH]c[nH+]2)C1 ZINC000330896958 176136865 /nfs/dbraw/zinc/13/68/65/176136865.db2.gz LSPFODLDWBFPLD-MNOVXSKESA-N 1 2 235.331 2.242 20 0 BEADLO C[C@@H]1CCC[C@H](N(C)C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000287550801 176140987 /nfs/dbraw/zinc/14/09/87/176140987.db2.gz LUQJUQMITXSZPR-NEPJUHHUSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)C=Cc2c[nH]c[nH+]2)[C@@H]1C ZINC000276567262 176141231 /nfs/dbraw/zinc/14/12/31/176141231.db2.gz KUPIRCTWBQHRLC-DFJHPQPXSA-N 1 2 247.342 2.364 20 0 BEADLO C[C@@H]1CCN(C(=O)C(C)(C)C)C[C@H]1n1cc[nH+]c1 ZINC000123965646 176153688 /nfs/dbraw/zinc/15/36/88/176153688.db2.gz JREFQANGOCUPAV-VXGBXAGGSA-N 1 2 249.358 2.339 20 0 BEADLO C[C@@H]1CCN(C(=O)C2CCC2)C[C@@H]1n1cc[nH+]c1 ZINC000123053693 176154558 /nfs/dbraw/zinc/15/45/58/176154558.db2.gz XPXIVKFKUHBXJE-YPMHNXCESA-N 1 2 247.342 2.093 20 0 BEADLO C[C@@H]1CCN(C(=O)CCc2[nH]cc[nH+]2)C[C@@H](C)C1 ZINC000287586361 176155174 /nfs/dbraw/zinc/15/51/74/176155174.db2.gz GUPZQAVOTSUADI-NEPJUHHUSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2noc(C3CC3)n2)C[C@@H]1C ZINC000122807337 176179219 /nfs/dbraw/zinc/17/92/19/176179219.db2.gz LRWVULBAIMGASU-ZJUUUORDSA-N 1 2 235.331 2.425 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2noc(C3CC3)n2)C[C@@H]1C ZINC000122807337 176179220 /nfs/dbraw/zinc/17/92/20/176179220.db2.gz LRWVULBAIMGASU-ZJUUUORDSA-N 1 2 235.331 2.425 20 0 BEADLO C[C@@H]1CCN(c2[nH+]c3ccccc3n2C)C1 ZINC000270596550 176182739 /nfs/dbraw/zinc/18/27/39/176182739.db2.gz UQZPEBPDSNBQOS-SNVBAGLBSA-N 1 2 215.300 2.420 20 0 BEADLO C[C@@H]1CC[C@@H](C)[NH+]1Cc1noc(C2CC2)n1 ZINC000123053893 176199896 /nfs/dbraw/zinc/19/98/96/176199896.db2.gz GRGACPZIPRQOQK-RKDXNWHRSA-N 1 2 221.304 2.320 20 0 BEADLO C[C@@H]1CC[C@H](C[N@H+](C)Cc2nccs2)O1 ZINC000188558935 176224459 /nfs/dbraw/zinc/22/44/59/176224459.db2.gz BBYASFUGOMMMME-NXEZZACHSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@@H]1CC[C@H](C[N@@H+](C)Cc2nccs2)O1 ZINC000188558935 176224460 /nfs/dbraw/zinc/22/44/60/176224460.db2.gz BBYASFUGOMMMME-NXEZZACHSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@@H]1C[NH+](Cc2ccnc(Cl)c2)C[C@@H](C)O1 ZINC000050165737 176309459 /nfs/dbraw/zinc/30/94/59/176309459.db2.gz VRYRBXWZQRSPNX-NXEZZACHSA-N 1 2 240.734 2.344 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnn(C)n2)[C@H]1c1ccccc1 ZINC000289790229 176311190 /nfs/dbraw/zinc/31/11/90/176311190.db2.gz LOURMEDZNSWIAC-BXUZGUMPSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnn(C)n2)[C@H]1c1ccccc1 ZINC000289790229 176311191 /nfs/dbraw/zinc/31/11/91/176311191.db2.gz LOURMEDZNSWIAC-BXUZGUMPSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@@H]1CN(Cc2[nH+]ccn2CC(F)(F)F)[C@@H]1C ZINC000339573244 176311322 /nfs/dbraw/zinc/31/13/22/176311322.db2.gz KMMXREUHLZWGFR-RKDXNWHRSA-N 1 2 247.264 2.286 20 0 BEADLO C[C@@H]1COCC[N@@H+]1CC1=Cc2ccccc2OC1 ZINC000091810434 176336742 /nfs/dbraw/zinc/33/67/42/176336742.db2.gz IWPGZUYQVNUHIW-GFCCVEGCSA-N 1 2 245.322 2.183 20 0 BEADLO C[C@@H]1COCC[N@H+]1CC1=Cc2ccccc2OC1 ZINC000091810434 176336744 /nfs/dbraw/zinc/33/67/44/176336744.db2.gz IWPGZUYQVNUHIW-GFCCVEGCSA-N 1 2 245.322 2.183 20 0 BEADLO C[C@@H]1COCC[N@@H+]1Cc1cnc2ccccc2c1 ZINC000271107701 176337841 /nfs/dbraw/zinc/33/78/41/176337841.db2.gz XRYTYFKBDXSSFI-GFCCVEGCSA-N 1 2 242.322 2.456 20 0 BEADLO C[C@@H]1COCC[N@H+]1Cc1cnc2ccccc2c1 ZINC000271107701 176337842 /nfs/dbraw/zinc/33/78/42/176337842.db2.gz XRYTYFKBDXSSFI-GFCCVEGCSA-N 1 2 242.322 2.456 20 0 BEADLO C[C@@H]1COCC[C@H]1CNc1cccc[nH+]1 ZINC000309117036 176343666 /nfs/dbraw/zinc/34/36/66/176343666.db2.gz LYHQJNOSCXXUIG-MNOVXSKESA-N 1 2 206.289 2.166 20 0 BEADLO C[C@@H]1COCC[C@H]1[NH2+]c1ccc2c(c1)CCO2 ZINC000192584187 176345062 /nfs/dbraw/zinc/34/50/62/176345062.db2.gz RNMJCAUNAPLDLB-ZWNOBZJWSA-N 1 2 233.311 2.458 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1ncn(-c2ccccc2)n1 ZINC000335756735 176364144 /nfs/dbraw/zinc/36/41/44/176364144.db2.gz BNNWQAGURUIWBT-VXGBXAGGSA-N 1 2 242.326 2.250 20 0 BEADLO C[C@@H]1C[C@@H](C)N1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000336233075 176364357 /nfs/dbraw/zinc/36/43/57/176364357.db2.gz ORYJPOMQCREFMK-NXEZZACHSA-N 1 2 244.298 2.349 20 0 BEADLO C[C@@H]1C[C@@H]1C(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000120749618 176384494 /nfs/dbraw/zinc/38/44/94/176384494.db2.gz QBGCEAOAHJSXAP-OUAUKWLOSA-N 1 2 233.315 2.119 20 0 BEADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1cc[nH]n1 ZINC000093316244 177037467 /nfs/dbraw/zinc/03/74/67/177037467.db2.gz GVGNCBPPOTXFBN-SNVBAGLBSA-N 1 2 231.299 2.308 20 0 BEADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1cc[nH]n1 ZINC000093316244 177037468 /nfs/dbraw/zinc/03/74/68/177037468.db2.gz GVGNCBPPOTXFBN-SNVBAGLBSA-N 1 2 231.299 2.308 20 0 BEADLO C[C@H](c1ccco1)[N@H+](C)Cc1ccnn1C ZINC000131112634 177047274 /nfs/dbraw/zinc/04/72/74/177047274.db2.gz QVEXBBNBMSYDQS-SNVBAGLBSA-N 1 2 219.288 2.206 20 0 BEADLO C[C@H](c1ccco1)[N@@H+](C)Cc1ccnn1C ZINC000131112634 177047275 /nfs/dbraw/zinc/04/72/75/177047275.db2.gz QVEXBBNBMSYDQS-SNVBAGLBSA-N 1 2 219.288 2.206 20 0 BEADLO C[C@H](c1cccs1)[N@H+](C)Cc1cnnn1C ZINC000157802143 177048942 /nfs/dbraw/zinc/04/89/42/177048942.db2.gz PUIYZOXHFKTLGF-SECBINFHSA-N 1 2 236.344 2.070 20 0 BEADLO C[C@H](c1cccs1)[N@@H+](C)Cc1cnnn1C ZINC000157802143 177048943 /nfs/dbraw/zinc/04/89/43/177048943.db2.gz PUIYZOXHFKTLGF-SECBINFHSA-N 1 2 236.344 2.070 20 0 BEADLO C[C@H](c1ccncc1)[N@H+](C)Cc1cnns1 ZINC000290121304 177050078 /nfs/dbraw/zinc/05/00/78/177050078.db2.gz UEVSBUDTDDEZRU-SECBINFHSA-N 1 2 234.328 2.126 20 0 BEADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1cnns1 ZINC000290121304 177050080 /nfs/dbraw/zinc/05/00/80/177050080.db2.gz UEVSBUDTDDEZRU-SECBINFHSA-N 1 2 234.328 2.126 20 0 BEADLO C[C@H]1CCCCN(C(=O)CCc2c[nH+]cn2C)C1 ZINC000281578724 177070117 /nfs/dbraw/zinc/07/01/17/177070117.db2.gz MIHMBUDDLARIPB-LBPRGKRZSA-N 1 2 249.358 2.001 20 0 BEADLO C[C@H]1CCCCN1C(=O)C(C)(C)c1c[nH+]c[nH]1 ZINC000336455628 177072661 /nfs/dbraw/zinc/07/26/61/177072661.db2.gz AOBVNWUBMJJIRI-JTQLQIEISA-N 1 2 235.331 2.088 20 0 BEADLO C[C@@H](Nc1cccc[nH+]1)C(=O)N1CCCC[C@@H]1C ZINC000265105752 177073148 /nfs/dbraw/zinc/07/31/48/177073148.db2.gz GIWSXGNRZJJXFR-NWDGAFQWSA-N 1 2 247.342 2.283 20 0 BEADLO C[C@H]1CCCC[C@@H]1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000276506834 177081710 /nfs/dbraw/zinc/08/17/10/177081710.db2.gz INNNRDWNORWUFW-RIVSHMCHSA-N 1 2 233.315 2.118 20 0 BEADLO C[C@@H]1[C@@H](C)CCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000284073885 177091404 /nfs/dbraw/zinc/09/14/04/177091404.db2.gz RTNMJGXRWLKOOO-PFDYWKIBSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@H]1CCC[C@@H]1CC(=O)NCCCn1cc[nH+]c1 ZINC000185864665 177123832 /nfs/dbraw/zinc/12/38/32/177123832.db2.gz QOGFFTWEUIPSHD-QWHCGFSZSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@H]1CCC[C@H](CNC(=O)CCn2cc[nH+]c2)C1 ZINC000338052622 177133173 /nfs/dbraw/zinc/13/31/73/177133173.db2.gz QABSIQAWSVTQJI-STQMWFEESA-N 1 2 249.358 2.216 20 0 BEADLO C[C@H]1CCC[C@H](N(C)C(=O)CCn2cc[nH+]c2)C1 ZINC000299633012 177134717 /nfs/dbraw/zinc/13/47/17/177134717.db2.gz SRGCTSBROQERQY-STQMWFEESA-N 1 2 249.358 2.310 20 0 BEADLO C[C@H]1CCN(C(=O)C(C)(C)C)C[C@@H]1n1cc[nH+]c1 ZINC000123965385 177145197 /nfs/dbraw/zinc/14/51/97/177145197.db2.gz JREFQANGOCUPAV-RYUDHWBXSA-N 1 2 249.358 2.339 20 0 BEADLO C[C@H]1CC[N@H+](Cc2cccs2)CC[S@@]1=O ZINC000277101229 177164982 /nfs/dbraw/zinc/16/49/82/177164982.db2.gz GLXMJHIOFODTAB-BONVTDFDSA-N 1 2 243.397 2.091 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2cccs2)CC[S@@]1=O ZINC000277101229 177164983 /nfs/dbraw/zinc/16/49/83/177164983.db2.gz GLXMJHIOFODTAB-BONVTDFDSA-N 1 2 243.397 2.091 20 0 BEADLO C[C@H]1CC[S@@](=O)CC[N@@H+]1Cc1ccsc1 ZINC000336348270 177208435 /nfs/dbraw/zinc/20/84/35/177208435.db2.gz FSOAMWFTRSLZBN-ZUZCIYMTSA-N 1 2 243.397 2.091 20 0 BEADLO C[C@H]1CC[S@@](=O)CC[N@H+]1Cc1ccsc1 ZINC000336348270 177208437 /nfs/dbraw/zinc/20/84/37/177208437.db2.gz FSOAMWFTRSLZBN-ZUZCIYMTSA-N 1 2 243.397 2.091 20 0 BEADLO C[C@H]1C[N@H+](CCc2cccc(F)c2)CCC1=O ZINC000049693751 177253873 /nfs/dbraw/zinc/25/38/73/177253873.db2.gz UFTFWRXNZIECIH-NSHDSACASA-N 1 2 235.302 2.279 20 0 BEADLO C[C@H]1C[N@@H+](CCc2cccc(F)c2)CCC1=O ZINC000049693751 177253874 /nfs/dbraw/zinc/25/38/74/177253874.db2.gz UFTFWRXNZIECIH-NSHDSACASA-N 1 2 235.302 2.279 20 0 BEADLO C[C@H]1C[NH+](Cc2cc(F)ccc2N)C[C@H](C)O1 ZINC000035308375 177260779 /nfs/dbraw/zinc/26/07/79/177260779.db2.gz HWDNYEQOKDIPSH-UWVGGRQHSA-N 1 2 238.306 2.017 20 0 BEADLO C[C@H]1C[NH+](Cc2cccs2)C[C@H](C)S1=O ZINC000336462218 177268056 /nfs/dbraw/zinc/26/80/56/177268056.db2.gz NEKZVWUPLJRJMI-UWVGGRQHSA-N 1 2 243.397 2.089 20 0 BEADLO C[C@H]1CN(Cc2[nH+]ccn2CC(F)(F)F)[C@H]1C ZINC000339573243 177272251 /nfs/dbraw/zinc/27/22/51/177272251.db2.gz KMMXREUHLZWGFR-IUCAKERBSA-N 1 2 247.264 2.286 20 0 BEADLO C[C@H]1C[N@H+](Cc2scnc2C2CC2)CCO1 ZINC000335150892 177272446 /nfs/dbraw/zinc/27/24/46/177272446.db2.gz AAEIZMQBIQMJIR-VIFPVBQESA-N 1 2 238.356 2.241 20 0 BEADLO C[C@H]1C[N@@H+](Cc2scnc2C2CC2)CCO1 ZINC000335150892 177272447 /nfs/dbraw/zinc/27/24/47/177272447.db2.gz AAEIZMQBIQMJIR-VIFPVBQESA-N 1 2 238.356 2.241 20 0 BEADLO C[C@H]1COC(C)(C)C[N@@H+]1Cc1nccs1 ZINC000336419453 177287668 /nfs/dbraw/zinc/28/76/68/177287668.db2.gz OHBPTXTZSDCENR-VIFPVBQESA-N 1 2 226.345 2.142 20 0 BEADLO C[C@H]1COC(C)(C)C[N@H+]1Cc1nccs1 ZINC000336419453 177287670 /nfs/dbraw/zinc/28/76/70/177287670.db2.gz OHBPTXTZSDCENR-VIFPVBQESA-N 1 2 226.345 2.142 20 0 BEADLO C[C@H]1COCC[N@H+](Cc2ncc(C3CC3)o2)C1 ZINC000336612712 177289592 /nfs/dbraw/zinc/28/95/92/177289592.db2.gz BYRFGYCDDRBPJK-SNVBAGLBSA-N 1 2 236.315 2.020 20 0 BEADLO C[C@H]1COCC[N@@H+](Cc2ncc(C3CC3)o2)C1 ZINC000336612712 177289594 /nfs/dbraw/zinc/28/95/94/177289594.db2.gz BYRFGYCDDRBPJK-SNVBAGLBSA-N 1 2 236.315 2.020 20 0 BEADLO C[C@H]1COCC[C@@H]1[NH2+]c1ccc2c(c1)CCO2 ZINC000192584169 177294996 /nfs/dbraw/zinc/29/49/96/177294996.db2.gz RNMJCAUNAPLDLB-GWCFXTLKSA-N 1 2 233.311 2.458 20 0 BEADLO C[C@@H]1C[C@H](C)[C@@H](C)N(C(=O)CCn2cc[nH+]c2)C1 ZINC000354702854 177310847 /nfs/dbraw/zinc/31/08/47/177310847.db2.gz GKUSGJSXLJBYGG-FRRDWIJNSA-N 1 2 249.358 2.166 20 0 BEADLO C[C@H]1C[C@H](C(=O)NCc2[nH]cc[nH+]2)C[C@@H](C)C1 ZINC000272564986 177317685 /nfs/dbraw/zinc/31/76/85/177317685.db2.gz RGJHWUNDIWVYDU-URLYPYJESA-N 1 2 235.331 2.098 20 0 BEADLO C[C@H]1C[C@@H](O)CC[N@@H+]1Cc1cnc(Cl)s1 ZINC000292515021 177336281 /nfs/dbraw/zinc/33/62/81/177336281.db2.gz VVPMYMSDMRJGCY-YUMQZZPRSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@H]1C[C@@H](O)CC[N@H+]1Cc1cnc(Cl)s1 ZINC000292515021 177336284 /nfs/dbraw/zinc/33/62/84/177336284.db2.gz VVPMYMSDMRJGCY-YUMQZZPRSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@H]1C[C@@H](c2cccnc2)[N@H+](Cc2cnc[nH]2)C1 ZINC000336351803 177339734 /nfs/dbraw/zinc/33/97/34/177339734.db2.gz JGGXJIQKHOSDMJ-FZMZJTMJSA-N 1 2 242.326 2.388 20 0 BEADLO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cnc[nH]2)C1 ZINC000336351803 177339736 /nfs/dbraw/zinc/33/97/36/177339736.db2.gz JGGXJIQKHOSDMJ-FZMZJTMJSA-N 1 2 242.326 2.388 20 0 BEADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccn(C)n2)o1 ZINC000112341604 177352130 /nfs/dbraw/zinc/35/21/30/177352130.db2.gz QODNMBKDBMPAIU-GWCFXTLKSA-N 1 2 245.326 2.426 20 0 BEADLO C[C@@H]1CC[C@@H](NC(=O)CCc2[nH]cc[nH+]2)[C@@H](C)C1 ZINC000287401908 177356522 /nfs/dbraw/zinc/35/65/22/177356522.db2.gz JFERTSZGIIFASP-GRYCIOLGSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H]1C[C@H](NCc2nccs2)c2[nH+]ccn21 ZINC000345362963 177371321 /nfs/dbraw/zinc/37/13/21/177371321.db2.gz VWHILRYBVNRVFA-IUCAKERBSA-N 1 2 234.328 2.135 20 0 BEADLO C[C@H]1C[C@H]1CC(=O)Nc1ccc[nH+]c1N(C)C ZINC000361551855 177378350 /nfs/dbraw/zinc/37/83/50/177378350.db2.gz QVKCFADRUUFQDW-UWVGGRQHSA-N 1 2 233.315 2.132 20 0 BEADLO C[C@H]1C[C@H]1CC(=O)NCCCNc1cccc[nH+]1 ZINC000354379477 177378418 /nfs/dbraw/zinc/37/84/18/177378418.db2.gz CLJIMKHYKOTIFZ-RYUDHWBXSA-N 1 2 247.342 2.046 20 0 BEADLO C[C@H]1C[C@H]1CNC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000290592750 177380470 /nfs/dbraw/zinc/38/04/70/177380470.db2.gz GQMUPRUGFHOFCV-UWVGGRQHSA-N 1 2 244.298 2.112 20 0 BEADLO C[C@H]1Cc2ccccc2[C@@H]1[NH2+]CC(F)(F)CO ZINC000184713757 177390320 /nfs/dbraw/zinc/39/03/20/177390320.db2.gz GVPRFYPLZUSAKU-JOYOIKCWSA-N 1 2 241.281 2.137 20 0 BEADLO CCC(CC)CNC(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000668305192 487638434 /nfs/dbraw/zinc/63/84/34/487638434.db2.gz HAGZEWRESQOBRT-NSHDSACASA-N 1 2 249.358 2.067 20 0 BEADLO CCC(CC)CNC(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000668305192 487638437 /nfs/dbraw/zinc/63/84/37/487638437.db2.gz HAGZEWRESQOBRT-NSHDSACASA-N 1 2 249.358 2.067 20 0 BEADLO CCC(CC)CNC(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000668305510 487638734 /nfs/dbraw/zinc/63/87/34/487638734.db2.gz OTWJQGJBEXNGQL-VXGBXAGGSA-N 1 2 249.358 2.076 20 0 BEADLO CCc1[nH]c(CNC(=O)C[C@H]2CC[C@H](C)C2)c[nH+]1 ZINC001652464150 1173086403 /nfs/dbraw/zinc/08/64/03/1173086403.db2.gz VOZSITWNEPMGTC-QWRGUYRKSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)C[C@H]2CC[C@H](C)C2)[nH+]1 ZINC001652464150 1173086408 /nfs/dbraw/zinc/08/64/08/1173086408.db2.gz VOZSITWNEPMGTC-QWRGUYRKSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]c(CNC(=O)C[C@H]2CC=CCC2)c[nH+]1 ZINC001652463797 1173087977 /nfs/dbraw/zinc/08/79/77/1173087977.db2.gz OLXGAQWJICZBGD-NSHDSACASA-N 1 2 247.342 2.335 20 0 BEADLO CCc1[nH]cc(CNC(=O)C[C@H]2CC=CCC2)[nH+]1 ZINC001652463797 1173087982 /nfs/dbraw/zinc/08/79/82/1173087982.db2.gz OLXGAQWJICZBGD-NSHDSACASA-N 1 2 247.342 2.335 20 0 BEADLO C[C@H](CCc1cccn1C)Nc1cc[nH+]cc1F ZINC000678787761 487643063 /nfs/dbraw/zinc/64/30/63/487643063.db2.gz XWEYMDPQQZCGGE-LLVKDONJSA-N 1 2 247.317 2.414 20 0 BEADLO C[C@H]1C[C@@H]1C[NH2+]c1ccc(-n2ccnn2)cc1 ZINC000488349283 225384149 /nfs/dbraw/zinc/38/41/49/225384149.db2.gz OHFMDUOSMCNTBE-WDEREUQCSA-N 1 2 228.299 2.335 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)C=Cc2c[nH]c[nH+]2)C[C@H]1C ZINC000492809065 226057308 /nfs/dbraw/zinc/05/73/08/226057308.db2.gz FLIARZJWXUCGPF-QEPQOOGFSA-N 1 2 247.342 2.364 20 0 BEADLO Cc1cccc(O)c1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492812762 226059372 /nfs/dbraw/zinc/05/93/72/226059372.db2.gz NSPOTIPMJCXYII-AATRIKPKSA-N 1 2 243.266 2.076 20 0 BEADLO Cc1ccc(NC(=O)C=Cc2c[nH]c[nH+]2)c(O)c1 ZINC000492857291 226068040 /nfs/dbraw/zinc/06/80/40/226068040.db2.gz DEKUEQZCUDUIBP-HYXAFXHYSA-N 1 2 243.266 2.076 20 0 BEADLO Cc1ccccc1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492867097 226070124 /nfs/dbraw/zinc/07/01/24/226070124.db2.gz WZZJVUGGFFNYEK-SREVYHEPSA-N 1 2 227.267 2.370 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)Nc1ccc(F)c(F)c1 ZINC000493379212 226200259 /nfs/dbraw/zinc/20/02/59/226200259.db2.gz CUXLRHWBCPDPAP-DUXPYHPUSA-N 1 2 249.220 2.340 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N[C@H](C1CC1)C1CCC1 ZINC000493427877 226213868 /nfs/dbraw/zinc/21/38/68/226213868.db2.gz RIWCHEJIMFRKSK-UZYOAWRESA-N 1 2 245.326 2.118 20 0 BEADLO Cc1ccc(NC(=O)C=Cc2c[nH]c[nH+]2)cc1 ZINC000493564677 226243768 /nfs/dbraw/zinc/24/37/68/226243768.db2.gz WHZIHQIFQCANCE-VOTSOKGWSA-N 1 2 227.267 2.370 20 0 BEADLO C[C@H](N(C)C(=O)/C=C/c1[nH]cc[nH+]1)C1(C)CC1 ZINC000493582463 226244380 /nfs/dbraw/zinc/24/43/80/226244380.db2.gz JMMUEQZXZPDLEB-YEZKRMTDSA-N 1 2 233.315 2.070 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CC[C@H](CC2CC2)C1 ZINC000493600205 226245460 /nfs/dbraw/zinc/24/54/60/226245460.db2.gz WUOSLCDBZYOJHY-AAOUONPWSA-N 1 2 245.326 2.072 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)NCCC1=CCCC1 ZINC000493616141 226246272 /nfs/dbraw/zinc/24/62/72/226246272.db2.gz SMZBAARELAFNBT-WAYWQWQTSA-N 1 2 231.299 2.040 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)N[C@H]1CC2CCC1CC2 ZINC000493718610 226250852 /nfs/dbraw/zinc/25/08/52/226250852.db2.gz FWVIRRBAKWSYMA-GLRVLTOKSA-N 1 2 245.326 2.118 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1C[C@@H]2CCCC[C@H]2C1 ZINC000493750359 226252400 /nfs/dbraw/zinc/25/24/00/226252400.db2.gz FQAFDDGKRUXJQD-WTIVYXKASA-N 1 2 245.326 2.072 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)NCC1CCCCC1 ZINC000493795027 226254553 /nfs/dbraw/zinc/25/45/53/226254553.db2.gz SVLGHUNMPJZDOZ-VOTSOKGWSA-N 1 2 233.315 2.119 20 0 BEADLO CN(C(=O)C=Cc1c[nH]c[nH+]1)[C@H]1CCC(C)(C)C1 ZINC000493812182 226255116 /nfs/dbraw/zinc/25/51/16/226255116.db2.gz BORONPAHVIKSIM-ITKZLYELSA-N 1 2 247.342 2.460 20 0 BEADLO c1ccc2[nH]c(=[NH+]CCC[C@H]3CCOC3)[nH]c2c1 ZINC000402021380 226364200 /nfs/dbraw/zinc/36/42/00/226364200.db2.gz FHNGZAUWSQTRKA-NSHDSACASA-N 1 2 245.326 2.213 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)OCC1CC1 ZINC000496023121 226294858 /nfs/dbraw/zinc/29/48/58/226294858.db2.gz QQQXBVMFVLEKTN-VIFPVBQESA-N 1 2 237.303 2.100 20 0 BEADLO CCC(CC)NC(=O)Cc1cn2c([nH+]1)CCCC2 ZINC000650991407 487653243 /nfs/dbraw/zinc/65/32/43/487653243.db2.gz ICVURBMTYIYIBI-UHFFFAOYSA-N 1 2 249.358 2.067 20 0 BEADLO COc1ccc(C[NH2+][C@@H](C)C(F)F)cc1 ZINC000228479240 487656886 /nfs/dbraw/zinc/65/68/86/487656886.db2.gz MSEZVOVKAGNSFB-QMMMGPOBSA-N 1 2 215.243 2.438 20 0 BEADLO CC[C@@H]1CC[C@H](C)N(C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000456821709 487665909 /nfs/dbraw/zinc/66/59/09/487665909.db2.gz QAFLDQDJABQLFD-NWDGAFQWSA-N 1 2 249.358 2.379 20 0 BEADLO CC[C@@H]1CC[C@H](C)N(C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000456821709 487665914 /nfs/dbraw/zinc/66/59/14/487665914.db2.gz QAFLDQDJABQLFD-NWDGAFQWSA-N 1 2 249.358 2.379 20 0 BEADLO C[N@@H+](Cc1noc(C2CC2)n1)CC1CC=CC1 ZINC000660811852 487668058 /nfs/dbraw/zinc/66/80/58/487668058.db2.gz KJKJRJDJGDSPNN-UHFFFAOYSA-N 1 2 233.315 2.345 20 0 BEADLO C[N@H+](Cc1noc(C2CC2)n1)CC1CC=CC1 ZINC000660811852 487668065 /nfs/dbraw/zinc/66/80/65/487668065.db2.gz KJKJRJDJGDSPNN-UHFFFAOYSA-N 1 2 233.315 2.345 20 0 BEADLO Cc1cnccc1C[NH2+][C@@H](C)C(F)F ZINC000228522636 487671072 /nfs/dbraw/zinc/67/10/72/487671072.db2.gz PDBFZHGFJFCIDJ-QMMMGPOBSA-N 1 2 200.232 2.133 20 0 BEADLO Cc1nn(C)cc1C[NH2+]C1(C(F)F)CCCC1 ZINC000674144048 487674665 /nfs/dbraw/zinc/67/46/65/487674665.db2.gz PSEZVAVETNFZNG-UHFFFAOYSA-N 1 2 243.301 2.396 20 0 BEADLO C[C@@H](CC(C)(C)C)NC(=O)CCc1c[nH+]c[nH]1 ZINC000457189066 487682192 /nfs/dbraw/zinc/68/21/92/487682192.db2.gz HETMJAZRFSRBCQ-JTQLQIEISA-N 1 2 237.347 2.283 20 0 BEADLO C[C@@H](CC(C)(C)C)NC(=O)CCc1c[nH]c[nH+]1 ZINC000457189066 487682199 /nfs/dbraw/zinc/68/21/99/487682199.db2.gz HETMJAZRFSRBCQ-JTQLQIEISA-N 1 2 237.347 2.283 20 0 BEADLO CCC(C)(CC)C(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000680995359 487689520 /nfs/dbraw/zinc/68/95/20/487689520.db2.gz LEOMMVBMNXSYRF-NSHDSACASA-N 1 2 237.347 2.214 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2ccoc2C)nn1C ZINC000669698998 487694726 /nfs/dbraw/zinc/69/47/26/487694726.db2.gz HRLLGASBRUHQRQ-SNVBAGLBSA-N 1 2 233.315 2.481 20 0 BEADLO C[C@@H](c1cnccn1)[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000681031029 487701270 /nfs/dbraw/zinc/70/12/70/487701270.db2.gz WGZCSDDNEPMFPD-OUAUKWLOSA-N 1 2 223.295 2.218 20 0 BEADLO C[C@@H](c1cnccn1)[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000681031029 487701276 /nfs/dbraw/zinc/70/12/76/487701276.db2.gz WGZCSDDNEPMFPD-OUAUKWLOSA-N 1 2 223.295 2.218 20 0 BEADLO C[C@@H]1CO[C@@H](C(F)(F)F)C[N@@H+]1CCCCF ZINC000671715564 487704746 /nfs/dbraw/zinc/70/47/46/487704746.db2.gz JDSYATFDGDSAOA-RKDXNWHRSA-N 1 2 243.244 2.388 20 0 BEADLO C[C@@H]1CO[C@@H](C(F)(F)F)C[N@H+]1CCCCF ZINC000671715564 487704750 /nfs/dbraw/zinc/70/47/50/487704750.db2.gz JDSYATFDGDSAOA-RKDXNWHRSA-N 1 2 243.244 2.388 20 0 BEADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1cn(C)cn1 ZINC000683899181 487710865 /nfs/dbraw/zinc/71/08/65/487710865.db2.gz WCAWZJNBQUPBHP-NSHDSACASA-N 1 2 245.326 2.319 20 0 BEADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1cn(C)cn1 ZINC000683899181 487710871 /nfs/dbraw/zinc/71/08/71/487710871.db2.gz WCAWZJNBQUPBHP-NSHDSACASA-N 1 2 245.326 2.319 20 0 BEADLO COc1ccc(CN(C)Cc2c[nH+]c[nH]2)c(F)c1 ZINC000668422175 487727755 /nfs/dbraw/zinc/72/77/55/487727755.db2.gz SGISNSYTOXHUQQ-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO CCc1cc(NC(CC)(CC)CO)nc[nH+]1 ZINC000053071061 487731064 /nfs/dbraw/zinc/73/10/64/487731064.db2.gz YIMWKQUORSGENS-UHFFFAOYSA-N 1 2 223.320 2.002 20 0 BEADLO CCc1cc(N[C@@H](COC)c2ccco2)nc[nH+]1 ZINC000674248574 487731564 /nfs/dbraw/zinc/73/15/64/487731564.db2.gz OHCZWBXLAXZMKI-NSHDSACASA-N 1 2 247.298 2.432 20 0 BEADLO c1nc(NC2CC2)cc(NCC[C@H]2CCCO2)[nH+]1 ZINC000665690284 487732242 /nfs/dbraw/zinc/73/22/42/487732242.db2.gz GLIGVBPXRNYHNL-LLVKDONJSA-N 1 2 248.330 2.032 20 0 BEADLO c1nc(NCC[C@H]2CCCO2)cc(NC2CC2)[nH+]1 ZINC000665690284 487732248 /nfs/dbraw/zinc/73/22/48/487732248.db2.gz GLIGVBPXRNYHNL-LLVKDONJSA-N 1 2 248.330 2.032 20 0 BEADLO C1=CC[C@@H](CNc2[nH+]cnc3c2OCCN3)CC1 ZINC000665695193 487733127 /nfs/dbraw/zinc/73/31/27/487733127.db2.gz XCZVWJXMCGQLSR-SNVBAGLBSA-N 1 2 246.314 2.049 20 0 BEADLO C1=CC[C@@H](CNc2nc[nH+]c3c2OCCN3)CC1 ZINC000665695193 487733130 /nfs/dbraw/zinc/73/31/30/487733130.db2.gz XCZVWJXMCGQLSR-SNVBAGLBSA-N 1 2 246.314 2.049 20 0 BEADLO CCC(CC)(CC)C(=O)NCc1[nH+]ccn1C ZINC000675452501 487733696 /nfs/dbraw/zinc/73/36/96/487733696.db2.gz JWTLZJUVGDTAAT-UHFFFAOYSA-N 1 2 237.347 2.253 20 0 BEADLO CCC(CC)(CC)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000675465241 487737113 /nfs/dbraw/zinc/73/71/13/487737113.db2.gz HGIRWMWPRMXVCS-UHFFFAOYSA-N 1 2 249.358 2.483 20 0 BEADLO CC[C@H]1CC[C@H](C)N1c1nc[nH+]c2c1OCCN2 ZINC000665710095 487737226 /nfs/dbraw/zinc/73/72/26/487737226.db2.gz WATKEEKLNRRMGP-UWVGGRQHSA-N 1 2 248.330 2.048 20 0 BEADLO CC[C@H]1CC[C@H](C)N1c1[nH+]cnc2c1OCCN2 ZINC000665710095 487737227 /nfs/dbraw/zinc/73/72/27/487737227.db2.gz WATKEEKLNRRMGP-UWVGGRQHSA-N 1 2 248.330 2.048 20 0 BEADLO CC(C)n1ncnc1C[NH2+]Cc1cccc(F)c1 ZINC000088589057 487738613 /nfs/dbraw/zinc/73/86/13/487738613.db2.gz KUZDISWIGWYVCM-UHFFFAOYSA-N 1 2 248.305 2.288 20 0 BEADLO COC[C@H]1CCC[N@@H+]1Cc1ncc(Cl)s1 ZINC000681166808 487740813 /nfs/dbraw/zinc/74/08/13/487740813.db2.gz WBKSVGLQUXNUED-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO COC[C@H]1CCC[N@H+]1Cc1ncc(Cl)s1 ZINC000681166808 487740817 /nfs/dbraw/zinc/74/08/17/487740817.db2.gz WBKSVGLQUXNUED-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO Cc1cc(CNc2nc(C)[nH+]c(C)c2C)[nH]n1 ZINC000675548615 487747034 /nfs/dbraw/zinc/74/70/34/487747034.db2.gz VNUCKHHZFQPVAB-UHFFFAOYSA-N 1 2 231.303 2.045 20 0 BEADLO Cc1cc(CNc2nc(C)[nH+]c(C)c2C)n[nH]1 ZINC000675548615 487747038 /nfs/dbraw/zinc/74/70/38/487747038.db2.gz VNUCKHHZFQPVAB-UHFFFAOYSA-N 1 2 231.303 2.045 20 0 BEADLO c1csc([C@@H]2C[N@H+](Cc3cn[nH]c3)CCO2)c1 ZINC000678217881 487760529 /nfs/dbraw/zinc/76/05/29/487760529.db2.gz UFWKEVRVQHQCIU-NSHDSACASA-N 1 2 249.339 2.045 20 0 BEADLO c1csc([C@@H]2C[N@@H+](Cc3cn[nH]c3)CCO2)c1 ZINC000678217881 487760536 /nfs/dbraw/zinc/76/05/36/487760536.db2.gz UFWKEVRVQHQCIU-NSHDSACASA-N 1 2 249.339 2.045 20 0 BEADLO CCN(C(=O)CCc1c[nH+]c[nH]1)C1CC(C)(C)C1 ZINC000412812880 487763153 /nfs/dbraw/zinc/76/31/53/487763153.db2.gz NCKBWOOVXJIVHO-UHFFFAOYSA-N 1 2 249.358 2.379 20 0 BEADLO CCN(C(=O)CCc1c[nH]c[nH+]1)C1CC(C)(C)C1 ZINC000412812880 487763155 /nfs/dbraw/zinc/76/31/55/487763155.db2.gz NCKBWOOVXJIVHO-UHFFFAOYSA-N 1 2 249.358 2.379 20 0 BEADLO Cc1cc(N2CC[C@@H](C3CCC3)C2)nc[nH+]1 ZINC000665755806 487766510 /nfs/dbraw/zinc/76/65/10/487766510.db2.gz RMUQXOGGOPFCGM-GFCCVEGCSA-N 1 2 217.316 2.411 20 0 BEADLO CC(C)c1nc(N(C)CC2CC2)cc[nH+]1 ZINC000110242934 487771053 /nfs/dbraw/zinc/77/10/53/487771053.db2.gz HSZYMSWFWWWMRW-UHFFFAOYSA-N 1 2 205.305 2.446 20 0 BEADLO CCCC(C)(C)C(=O)N[C@H]1CCc2c[nH+]cn2C1 ZINC000652097917 487778207 /nfs/dbraw/zinc/77/82/07/487778207.db2.gz YUPCCKMUUYDIFA-NSHDSACASA-N 1 2 249.358 2.140 20 0 BEADLO CCCC(C)(C)C(=O)N[C@@H]1CCc2c[nH+]cn2C1 ZINC000652097916 487778354 /nfs/dbraw/zinc/77/83/54/487778354.db2.gz YUPCCKMUUYDIFA-LLVKDONJSA-N 1 2 249.358 2.140 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cc3cnccc3o2)CCO1 ZINC000651611886 487798608 /nfs/dbraw/zinc/79/86/08/487798608.db2.gz QKEFCFWCCZCCHR-LBPRGKRZSA-N 1 2 246.310 2.439 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cc3cnccc3o2)CCO1 ZINC000651611886 487798613 /nfs/dbraw/zinc/79/86/13/487798613.db2.gz QKEFCFWCCZCCHR-LBPRGKRZSA-N 1 2 246.310 2.439 20 0 BEADLO Cc1nc(N(C)C)nc(NCCC2CCCC2)[nH+]1 ZINC000676077344 487809971 /nfs/dbraw/zinc/80/99/71/487809971.db2.gz XASYFYWTAZKCMT-UHFFFAOYSA-N 1 2 249.362 2.238 20 0 BEADLO Cc1nc(NCCC2CCCC2)nc(N(C)C)[nH+]1 ZINC000676077344 487809976 /nfs/dbraw/zinc/80/99/76/487809976.db2.gz XASYFYWTAZKCMT-UHFFFAOYSA-N 1 2 249.362 2.238 20 0 BEADLO Cc1nc(N(C)C)nc(NCC2(C)CCCC2)[nH+]1 ZINC000676080726 487811389 /nfs/dbraw/zinc/81/13/89/487811389.db2.gz IGLNZWFMQYTBBH-UHFFFAOYSA-N 1 2 249.362 2.238 20 0 BEADLO Cc1nc(NCC2(C)CCCC2)nc(N(C)C)[nH+]1 ZINC000676080726 487811395 /nfs/dbraw/zinc/81/13/95/487811395.db2.gz IGLNZWFMQYTBBH-UHFFFAOYSA-N 1 2 249.362 2.238 20 0 BEADLO CO[C@H](C[NH2+][C@H](C)c1cn[nH]c1C)CC(C)C ZINC000669424969 487814932 /nfs/dbraw/zinc/81/49/32/487814932.db2.gz JQLWPWXQDQXYPW-PWSUYJOCSA-N 1 2 239.363 2.430 20 0 BEADLO Cc1cccc(C)c1NC(=O)Cc1c[nH+]cn1C ZINC000681582591 487818585 /nfs/dbraw/zinc/81/85/85/487818585.db2.gz FGCPHTUXRHJBLA-UHFFFAOYSA-N 1 2 243.310 2.218 20 0 BEADLO C[C@H](CC1CCCC1)C(=O)NCCn1cc[nH+]c1 ZINC000074400121 487818863 /nfs/dbraw/zinc/81/88/63/487818863.db2.gz YDVHVMVBJSAMMO-GFCCVEGCSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@]1(C)CC1(C)C ZINC000666493900 487821541 /nfs/dbraw/zinc/82/15/41/487821541.db2.gz NZUXRWZUMXBDHX-ZDUSSCGKSA-N 1 2 233.315 2.122 20 0 BEADLO CC[C@H](NC(=O)Nc1cc[nH+]cc1C)C1CC1 ZINC000666493938 487822016 /nfs/dbraw/zinc/82/20/16/487822016.db2.gz PLBKFQCWLSBONF-NSHDSACASA-N 1 2 233.315 2.122 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NCCC(C)(C)F ZINC000666494152 487822047 /nfs/dbraw/zinc/82/20/47/487822047.db2.gz QZDBHOOVIPUZPU-UHFFFAOYSA-N 1 2 239.294 2.072 20 0 BEADLO Cc1cc(NC(=O)N[C@@]2(C)CC2(C)C)c(C)c[nH+]1 ZINC000666496139 487822210 /nfs/dbraw/zinc/82/22/10/487822210.db2.gz JQOKXLMWBMMENM-AWEZNQCLSA-N 1 2 247.342 2.430 20 0 BEADLO O=C(c1ccco1)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000074828233 487822639 /nfs/dbraw/zinc/82/26/39/487822639.db2.gz WMWSCLZZSQLYKL-UHFFFAOYSA-N 1 2 245.282 2.023 20 0 BEADLO Cc1ncc([C@@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)c(C)n1 ZINC000681640156 487828605 /nfs/dbraw/zinc/82/86/05/487828605.db2.gz YSZDGJKMXINSSN-JFGNBEQYSA-N 1 2 249.358 2.264 20 0 BEADLO Cc1ncc([C@@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c(C)n1 ZINC000681640156 487828608 /nfs/dbraw/zinc/82/86/08/487828608.db2.gz YSZDGJKMXINSSN-JFGNBEQYSA-N 1 2 249.358 2.264 20 0 BEADLO CC[C@@H](CC(C)C)C(=O)NC1=[NH+]CCS1 ZINC000823671935 587236222 /nfs/dbraw/zinc/23/62/22/587236222.db2.gz XYQWUFSKZUWOQC-VIFPVBQESA-N 1 2 228.361 2.278 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1c(C(F)(F)F)cnn1C ZINC000668089974 487833304 /nfs/dbraw/zinc/83/33/04/487833304.db2.gz COJKTWDVNCJMFN-YUMQZZPRSA-N 1 2 247.264 2.422 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1cc(C(F)(F)F)nn1C ZINC000668090547 487834592 /nfs/dbraw/zinc/83/45/92/487834592.db2.gz NDKKRCKIKYPOIK-HTQZYQBOSA-N 1 2 247.264 2.422 20 0 BEADLO CC1=CC[C@@](C)(C(=O)NCc2c[nH+]c[nH]2)CC1 ZINC000668995324 487843753 /nfs/dbraw/zinc/84/37/53/487843753.db2.gz KUDKSOYDGUTPCF-CYBMUJFWSA-N 1 2 233.315 2.162 20 0 BEADLO CC1=CC[C@@](C)(C(=O)NCc2c[nH]c[nH+]2)CC1 ZINC000668995324 487843760 /nfs/dbraw/zinc/84/37/60/487843760.db2.gz KUDKSOYDGUTPCF-CYBMUJFWSA-N 1 2 233.315 2.162 20 0 BEADLO O=C(NCc1c[nH+]c[nH]1)C1CCC(C2CC2)CC1 ZINC000668996412 487844928 /nfs/dbraw/zinc/84/49/28/487844928.db2.gz ZGNJFAOGELRMAF-UHFFFAOYSA-N 1 2 247.342 2.242 20 0 BEADLO O=C(NCc1c[nH]c[nH+]1)C1CCC(C2CC2)CC1 ZINC000668996412 487844932 /nfs/dbraw/zinc/84/49/32/487844932.db2.gz ZGNJFAOGELRMAF-UHFFFAOYSA-N 1 2 247.342 2.242 20 0 BEADLO Cc1nc(C[NH+]2CCC(F)CC2)cs1 ZINC000880239664 590972295 /nfs/dbraw/zinc/97/22/95/590972295.db2.gz BPHMNVNFDVHUKF-UHFFFAOYSA-N 1 2 214.309 2.385 20 0 BEADLO CCC[C@@H](C)C[N@@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000668499832 487856068 /nfs/dbraw/zinc/85/60/68/487856068.db2.gz MSDFRIVYWZKKLY-NXEZZACHSA-N 1 2 221.291 2.125 20 0 BEADLO CCC[C@@H](C)C[N@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000668499832 487856077 /nfs/dbraw/zinc/85/60/77/487856077.db2.gz MSDFRIVYWZKKLY-NXEZZACHSA-N 1 2 221.291 2.125 20 0 BEADLO Cc1ccnc([C@@H](C)[NH2+]Cc2ccno2)c1 ZINC000564452846 322954961 /nfs/dbraw/zinc/95/49/61/322954961.db2.gz IFXGLRJXJVOXBO-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@H]2CCCCO2)c(C)o1 ZINC000659853107 487865018 /nfs/dbraw/zinc/86/50/18/487865018.db2.gz RSOQUMNRISLWIW-GFCCVEGCSA-N 1 2 238.331 2.292 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@H]2CCCCO2)c(C)o1 ZINC000659853107 487865020 /nfs/dbraw/zinc/86/50/20/487865020.db2.gz RSOQUMNRISLWIW-GFCCVEGCSA-N 1 2 238.331 2.292 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCO[C@H](C(C)(C)C)C1 ZINC000518396726 322963081 /nfs/dbraw/zinc/96/30/81/322963081.db2.gz KHJOSNHMEJNVBG-LBPRGKRZSA-N 1 2 249.358 2.345 20 0 BEADLO CC(C)(NCc1cccc2[nH+]ccn21)C(F)F ZINC000684414096 487881795 /nfs/dbraw/zinc/88/17/95/487881795.db2.gz SLTNBCHMSZKTER-UHFFFAOYSA-N 1 2 239.269 2.468 20 0 BEADLO CC/C=C\CC[N@@H+]1CC(F)(F)C[C@@H]1CO ZINC000682032995 487884794 /nfs/dbraw/zinc/88/47/94/487884794.db2.gz KPWQWWHMKWZMIG-UMBAGQNISA-N 1 2 219.275 2.045 20 0 BEADLO CC/C=C\CC[N@H+]1CC(F)(F)C[C@@H]1CO ZINC000682032995 487884800 /nfs/dbraw/zinc/88/48/00/487884800.db2.gz KPWQWWHMKWZMIG-UMBAGQNISA-N 1 2 219.275 2.045 20 0 BEADLO CC(C)CCO[C@@H]1CC[N@H+](CC(F)F)C1 ZINC000083248138 487885255 /nfs/dbraw/zinc/88/52/55/487885255.db2.gz QMVZRJMHZFZZNT-SNVBAGLBSA-N 1 2 221.291 2.389 20 0 BEADLO CC(C)CCO[C@@H]1CC[N@@H+](CC(F)F)C1 ZINC000083248138 487885258 /nfs/dbraw/zinc/88/52/58/487885258.db2.gz QMVZRJMHZFZZNT-SNVBAGLBSA-N 1 2 221.291 2.389 20 0 BEADLO COc1ccc(CN(C)c2cccc[nH+]2)cn1 ZINC000676638362 487886308 /nfs/dbraw/zinc/88/63/08/487886308.db2.gz JEHNTPOKOGQAAE-UHFFFAOYSA-N 1 2 229.283 2.122 20 0 BEADLO CC[C@H](NC(=O)c1cc(C)[nH]c1C)c1[nH]cc[nH+]1 ZINC000682041515 487887769 /nfs/dbraw/zinc/88/77/69/487887769.db2.gz SQTHJAUDSNZYNG-NSHDSACASA-N 1 2 246.314 2.236 20 0 BEADLO CC[C@@H](NC(=O)c1cc(C)[nH]c1C)c1[nH]cc[nH+]1 ZINC000682041514 487887935 /nfs/dbraw/zinc/88/79/35/487887935.db2.gz SQTHJAUDSNZYNG-LLVKDONJSA-N 1 2 246.314 2.236 20 0 BEADLO CC[C@@H](NC(=O)[C@H](C)c1ccco1)c1[nH]cc[nH+]1 ZINC000682040953 487888270 /nfs/dbraw/zinc/88/82/70/487888270.db2.gz BTNLRHMNBCCGBI-NXEZZACHSA-N 1 2 247.298 2.374 20 0 BEADLO CC1=CC[C@](C)(C(=O)NCCc2[nH]cc[nH+]2)CC1 ZINC000668535253 487897755 /nfs/dbraw/zinc/89/77/55/487897755.db2.gz DPWQFONAIDQPJV-AWEZNQCLSA-N 1 2 247.342 2.205 20 0 BEADLO CC(C)n1ccc(C[N@@H+]2CCCOC[C@H]2C)n1 ZINC000676713485 487900603 /nfs/dbraw/zinc/90/06/03/487900603.db2.gz PZUTUFDRPZMAMQ-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccc(C[N@H+]2CCCOC[C@H]2C)n1 ZINC000676713485 487900613 /nfs/dbraw/zinc/90/06/13/487900613.db2.gz PZUTUFDRPZMAMQ-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO COc1ccc(N[C@@H](C)c2nccnc2C)[nH+]c1 ZINC000682138979 487912755 /nfs/dbraw/zinc/91/27/55/487912755.db2.gz OUTBASQRMFDURG-JTQLQIEISA-N 1 2 244.298 2.362 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H](C)c2ccsc2)c[nH+]1 ZINC000669900062 487912770 /nfs/dbraw/zinc/91/27/70/487912770.db2.gz BFAIRORMTCQQDW-SSDOTTSWSA-N 1 2 235.312 2.271 20 0 BEADLO CC1CCC(O)(CNc2cccc[nH+]2)CC1 ZINC000083469962 487914071 /nfs/dbraw/zinc/91/40/71/487914071.db2.gz ZBFZPWLBUMPSSV-UHFFFAOYSA-N 1 2 220.316 2.435 20 0 BEADLO COCc1cc[nH+]c(N[C@H](C)[C@H]2CCCO2)c1 ZINC000652331185 487921392 /nfs/dbraw/zinc/92/13/92/487921392.db2.gz ZXUCJOKVWVUKSE-ZYHUDNBSSA-N 1 2 236.315 2.207 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)[C@H]1C[C@H]2C[C@H]2C1 ZINC000667000555 487925971 /nfs/dbraw/zinc/92/59/71/487925971.db2.gz GRORVVDQBIWUNF-URLYPYJESA-N 1 2 245.326 2.132 20 0 BEADLO CC=CC[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000682220723 487928111 /nfs/dbraw/zinc/92/81/11/487928111.db2.gz FZAUYFRHWYWNRZ-JDGPPOGSSA-N 1 2 228.299 2.060 20 0 BEADLO CCc1cc[nH+]cc1N[C@H](CC)COC ZINC000651979498 487939231 /nfs/dbraw/zinc/93/92/31/487939231.db2.gz VQZWKQSIVYIHNP-LLVKDONJSA-N 1 2 208.305 2.481 20 0 BEADLO COc1ccc(N[C@H]2COC(C)(C)C2)[nH+]c1 ZINC000396531055 487940021 /nfs/dbraw/zinc/94/00/21/487940021.db2.gz HBCNZYGXZDYROH-SECBINFHSA-N 1 2 222.288 2.070 20 0 BEADLO CCc1cc[nH+]cc1NCc1cc(COC)on1 ZINC000651980080 487943266 /nfs/dbraw/zinc/94/32/66/487943266.db2.gz ZWFULVXBCOTWIT-UHFFFAOYSA-N 1 2 247.298 2.391 20 0 BEADLO Cc1ccc2[nH+]c(CNC(=O)CCCF)cn2c1 ZINC000667136007 487944908 /nfs/dbraw/zinc/94/49/08/487944908.db2.gz QSQXEDYNMBIJQW-UHFFFAOYSA-N 1 2 249.289 2.009 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@H](C)[C@H]1CCCCO1 ZINC000679365011 487947990 /nfs/dbraw/zinc/94/79/90/487947990.db2.gz WOKZUDSHFRFLMO-UFGOTCBOSA-N 1 2 237.347 2.326 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000666351925 487956444 /nfs/dbraw/zinc/95/64/44/487956444.db2.gz LRSCKOOCCHFFCJ-GHMZBOCLSA-N 1 2 249.358 2.162 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000666351925 487956446 /nfs/dbraw/zinc/95/64/46/487956446.db2.gz LRSCKOOCCHFFCJ-GHMZBOCLSA-N 1 2 249.358 2.162 20 0 BEADLO CCC[C@H](C)N(C)C(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000666351927 487956343 /nfs/dbraw/zinc/95/63/43/487956343.db2.gz LRSCKOOCCHFFCJ-QWRGUYRKSA-N 1 2 249.358 2.162 20 0 BEADLO CCC[C@H](C)N(C)C(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000666351927 487956345 /nfs/dbraw/zinc/95/63/45/487956345.db2.gz LRSCKOOCCHFFCJ-QWRGUYRKSA-N 1 2 249.358 2.162 20 0 BEADLO COc1ccc[nH+]c1NCc1cnc(C)s1 ZINC000159447272 322969150 /nfs/dbraw/zinc/96/91/50/322969150.db2.gz ASMHTAHZGFKNGS-UHFFFAOYSA-N 1 2 235.312 2.467 20 0 BEADLO CC[C@H](C)CCC(=O)N1CC(n2cc[nH+]c2)C1 ZINC000560501171 322988661 /nfs/dbraw/zinc/98/86/61/322988661.db2.gz MFBMJTNILFQJKM-NSHDSACASA-N 1 2 235.331 2.093 20 0 BEADLO C[C@H](CC(=O)N1CC[C@H](C2CC2)C1)n1cc[nH+]c1 ZINC000565046016 323005933 /nfs/dbraw/zinc/00/59/33/323005933.db2.gz HRMHSDAPEHNZEX-YPMHNXCESA-N 1 2 247.342 2.093 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1CC12CCOCC2 ZINC000564739677 323016221 /nfs/dbraw/zinc/01/62/21/323016221.db2.gz FWVSYCZVNPEKGB-LLVKDONJSA-N 1 2 233.315 2.074 20 0 BEADLO COC(=O)c1ccc(C[N@@H+]2CCC[C@@H](F)C2)o1 ZINC000565100380 323018142 /nfs/dbraw/zinc/01/81/42/323018142.db2.gz UFGCPOBJXVHSEI-SECBINFHSA-N 1 2 241.262 2.000 20 0 BEADLO COC(=O)c1ccc(C[N@H+]2CCC[C@@H](F)C2)o1 ZINC000565100380 323018143 /nfs/dbraw/zinc/01/81/43/323018143.db2.gz UFGCPOBJXVHSEI-SECBINFHSA-N 1 2 241.262 2.000 20 0 BEADLO COC(=O)c1ccc(C[N@@H+]2CCC[C@H](F)C2)o1 ZINC000565100381 323018182 /nfs/dbraw/zinc/01/81/82/323018182.db2.gz UFGCPOBJXVHSEI-VIFPVBQESA-N 1 2 241.262 2.000 20 0 BEADLO COC(=O)c1ccc(C[N@H+]2CCC[C@H](F)C2)o1 ZINC000565100381 323018183 /nfs/dbraw/zinc/01/81/83/323018183.db2.gz UFGCPOBJXVHSEI-VIFPVBQESA-N 1 2 241.262 2.000 20 0 BEADLO CC1(C)CCCC[C@@H]1C(=O)Nc1cc[nH+]cc1O ZINC000562495495 323021902 /nfs/dbraw/zinc/02/19/02/323021902.db2.gz NOKWYIRASNZRHY-SNVBAGLBSA-N 1 2 248.326 2.364 20 0 BEADLO C[C@@H](c1csnn1)[N@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000562533384 323023168 /nfs/dbraw/zinc/02/31/68/323023168.db2.gz PSNKLLICJBYGDS-YIZRAAEISA-N 1 2 243.401 2.425 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000562533384 323023169 /nfs/dbraw/zinc/02/31/69/323023169.db2.gz PSNKLLICJBYGDS-YIZRAAEISA-N 1 2 243.401 2.425 20 0 BEADLO Cc1cc(NC(=O)[C@]2(C)CCCCO2)c(C)c[nH+]1 ZINC000562654773 323026270 /nfs/dbraw/zinc/02/62/70/323026270.db2.gz RCUWRLCDWOFQKR-AWEZNQCLSA-N 1 2 248.326 2.018 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NC[C@H]1CC=CCC1 ZINC000572973378 323037668 /nfs/dbraw/zinc/03/76/68/323037668.db2.gz VVMZNYUQQUKTEE-RYUDHWBXSA-N 1 2 247.342 2.061 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NC[C@H]1CC=CCC1 ZINC000572973378 323037669 /nfs/dbraw/zinc/03/76/69/323037669.db2.gz VVMZNYUQQUKTEE-RYUDHWBXSA-N 1 2 247.342 2.061 20 0 BEADLO C[C@H](O)CN(C)c1[nH+]ccc2ccccc21 ZINC000123793598 323037786 /nfs/dbraw/zinc/03/77/86/323037786.db2.gz NYUURIXXIUSVHI-JTQLQIEISA-N 1 2 216.284 2.052 20 0 BEADLO CCc1nocc1CN(C)c1nc(C)[nH+]cc1C ZINC000570106383 323050133 /nfs/dbraw/zinc/05/01/33/323050133.db2.gz IWFXHYVRCBBGEE-UHFFFAOYSA-N 1 2 246.314 2.280 20 0 BEADLO COc1cc[nH+]c(CN2CC(C(F)(F)F)C2)c1 ZINC000570192211 323052332 /nfs/dbraw/zinc/05/23/32/323052332.db2.gz BKUGJPPXMOLDIG-UHFFFAOYSA-N 1 2 246.232 2.084 20 0 BEADLO CC(C)[C@@H]1[C@@H](C(C)C)CN1C(=O)Cn1cc[nH+]c1 ZINC000570533428 323062350 /nfs/dbraw/zinc/06/23/50/323062350.db2.gz OWGOPCBJHDJZSX-TZMCWYRMSA-N 1 2 249.358 2.022 20 0 BEADLO Cc1[nH+]cn(-c2ccc(NC[C@H](C)O)cc2)c1C ZINC000570711466 323068179 /nfs/dbraw/zinc/06/81/79/323068179.db2.gz SAWNTMCFOYTTCM-JTQLQIEISA-N 1 2 245.326 2.282 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)Nc1nccs1 ZINC000158616425 323073378 /nfs/dbraw/zinc/07/33/78/323073378.db2.gz KGZRSGOQJJRFDA-ONEGZZNKSA-N 1 2 248.311 2.011 20 0 BEADLO CCOC(C)(C)CNc1[nH+]cccc1OC ZINC000167065722 323078222 /nfs/dbraw/zinc/07/82/22/323078222.db2.gz AXKMXWFCRXVPRJ-UHFFFAOYSA-N 1 2 224.304 2.317 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2cccc(O)c2)o1 ZINC000181542901 323079042 /nfs/dbraw/zinc/07/90/42/323079042.db2.gz HTLYEHQNZFDMBL-DTWKUNHWSA-N 1 2 247.298 2.495 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N3[C@@H](C)C[C@@H]3C)ccn12 ZINC000567751296 323080320 /nfs/dbraw/zinc/08/03/20/323080320.db2.gz XYCZSPSOYYTCMD-UWVGGRQHSA-N 1 2 243.310 2.266 20 0 BEADLO COCC1(CCNc2cc[nH+]c(C(C)C)n2)CC1 ZINC000563054247 323083103 /nfs/dbraw/zinc/08/31/03/323083103.db2.gz VENQHSHOMBDGJU-UHFFFAOYSA-N 1 2 249.358 2.251 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1Nc1[nH+]cnc2c1cnn2C ZINC000397383639 323090537 /nfs/dbraw/zinc/09/05/37/323090537.db2.gz OGKYGAXGTRZFTB-GXFFZTMASA-N 1 2 245.330 2.210 20 0 BEADLO CCCC[C@H]([NH2+][C@@H]1CS[C@@H](C)C1)C(=O)OC ZINC000397919703 323101123 /nfs/dbraw/zinc/10/11/23/323101123.db2.gz GRTHWKLMRFTCLZ-DCAQKATOSA-N 1 2 245.388 2.202 20 0 BEADLO CCCC[C@H]([NH2+][C@H]1CS[C@H](C)C1)C(=O)OC ZINC000397919704 323101139 /nfs/dbraw/zinc/10/11/39/323101139.db2.gz GRTHWKLMRFTCLZ-MXWKQRLJSA-N 1 2 245.388 2.202 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC1CCCCC1 ZINC000570981745 323102770 /nfs/dbraw/zinc/10/27/70/323102770.db2.gz WATQDUMXGMADOY-SNVBAGLBSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC1CCCCC1 ZINC000570981745 323102771 /nfs/dbraw/zinc/10/27/71/323102771.db2.gz WATQDUMXGMADOY-SNVBAGLBSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H](CC(=O)N(C)[C@H](C)C1(C)CC1)n1cc[nH+]c1 ZINC000563216218 323103149 /nfs/dbraw/zinc/10/31/49/323103149.db2.gz GPEIEHRNEZAXGD-VXGBXAGGSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1cc(NC(=O)c2cnccc2C)c(C)c[nH+]1 ZINC000534299236 323115835 /nfs/dbraw/zinc/11/58/35/323115835.db2.gz APGFYOWYSCSCCF-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO Cc1nc(N(C)Cc2cccc(O)c2)cc[nH+]1 ZINC000534342381 323117327 /nfs/dbraw/zinc/11/73/27/323117327.db2.gz QVRPIHVBBVZAMD-UHFFFAOYSA-N 1 2 229.283 2.127 20 0 BEADLO CCC(C)(C)CNc1nc(C)[nH+]cc1C ZINC000563426998 323126162 /nfs/dbraw/zinc/12/61/62/323126162.db2.gz QDOHPOQTIQTMMU-UHFFFAOYSA-N 1 2 207.321 2.363 20 0 BEADLO CC(C)(NC(=O)[C@@H]1CC[C@H]2C[C@H]2C1)c1[nH]cc[nH+]1 ZINC000571454918 323145296 /nfs/dbraw/zinc/14/52/96/323145296.db2.gz FOESNUMWYLSXDW-AXFHLTTASA-N 1 2 247.342 2.197 20 0 BEADLO Cc1ccc(CCC[NH2+][C@H]2CCC[NH2+][C@H]2C)c[nH+]1 ZINC000414960164 323152302 /nfs/dbraw/zinc/15/23/02/323152302.db2.gz ULZQDYWNRPUHPO-ZFWWWQNUSA-N 1 2 247.386 2.053 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)c1ccsc1 ZINC000049304645 323159572 /nfs/dbraw/zinc/15/95/72/323159572.db2.gz JNDJMOGBLNNDLW-UHFFFAOYSA-N 1 2 247.323 2.461 20 0 BEADLO COC(C)(C)C[N@H+](C)Cc1nc(C(C)C)no1 ZINC000532086445 323172693 /nfs/dbraw/zinc/17/26/93/323172693.db2.gz YGGOJNADVSQTLE-UHFFFAOYSA-N 1 2 241.335 2.050 20 0 BEADLO COC(C)(C)C[N@@H+](C)Cc1nc(C(C)C)no1 ZINC000532086445 323172694 /nfs/dbraw/zinc/17/26/94/323172694.db2.gz YGGOJNADVSQTLE-UHFFFAOYSA-N 1 2 241.335 2.050 20 0 BEADLO c1ccc(NCCOCC2CCC2)[nH+]c1 ZINC000308840871 323179933 /nfs/dbraw/zinc/17/99/33/323179933.db2.gz NJQUELDBXODPRA-UHFFFAOYSA-N 1 2 206.289 2.310 20 0 BEADLO Fc1ccc(C[NH2+]Cc2cnc(C3CC3)o2)nc1 ZINC000529543622 323183445 /nfs/dbraw/zinc/18/34/45/323183445.db2.gz LPBGEOQYOJQYLP-UHFFFAOYSA-N 1 2 247.273 2.376 20 0 BEADLO C[C@H](CC(=O)N[C@H]1CC=CCC1)n1cc[nH+]c1 ZINC000563888563 323183543 /nfs/dbraw/zinc/18/35/43/323183543.db2.gz BPBZQHSYNXYHQA-NEPJUHHUSA-N 1 2 233.315 2.059 20 0 BEADLO Nc1nc(NCCCC2CC2)[nH+]c2ccccc12 ZINC000535720352 323189423 /nfs/dbraw/zinc/18/94/23/323189423.db2.gz YAWZLLCMCJOGDI-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO CC[C@]1(C)C[C@@H]1C(=O)Nc1cc(C)[nH+]cc1C ZINC000535748091 323190214 /nfs/dbraw/zinc/19/02/14/323190214.db2.gz VAMNQZSGZNPHIT-BXUZGUMPSA-N 1 2 232.327 2.495 20 0 BEADLO Cc1cc(C(=O)C[N@H+]2CC=C(C)CC2)c(C)n1C ZINC000535964942 323194872 /nfs/dbraw/zinc/19/48/72/323194872.db2.gz WIIOSAOKEJEXPZ-UHFFFAOYSA-N 1 2 246.354 2.477 20 0 BEADLO Cc1cc(C(=O)C[N@@H+]2CC=C(C)CC2)c(C)n1C ZINC000535964942 323194873 /nfs/dbraw/zinc/19/48/73/323194873.db2.gz WIIOSAOKEJEXPZ-UHFFFAOYSA-N 1 2 246.354 2.477 20 0 BEADLO Cc1cc(NC(=O)[C@H]2C[C@@H]2C2CC2)c(C)c[nH+]1 ZINC000536574316 323197943 /nfs/dbraw/zinc/19/79/43/323197943.db2.gz BNYWAXLZRNUDCM-NEPJUHHUSA-N 1 2 230.311 2.105 20 0 BEADLO Cc1cc(NC(=O)[C@H](C)C(C)C)c(C)c[nH+]1 ZINC000536574716 323198061 /nfs/dbraw/zinc/19/80/61/323198061.db2.gz CUXDJFOHROEWRI-LLVKDONJSA-N 1 2 220.316 2.351 20 0 BEADLO Cc1cc(NC(=O)c2cccs2)c(C)c[nH+]1 ZINC000536574757 323198079 /nfs/dbraw/zinc/19/80/79/323198079.db2.gz BSFXYXWZSIAHJI-UHFFFAOYSA-N 1 2 232.308 2.434 20 0 BEADLO Cn1ccc(C[N@@H+]2CCC[C@H]2c2ccccn2)n1 ZINC000536629436 323198805 /nfs/dbraw/zinc/19/88/05/323198805.db2.gz KNPAVQVPCMRCDB-AWEZNQCLSA-N 1 2 242.326 2.152 20 0 BEADLO Cn1ccc(C[N@H+]2CCC[C@H]2c2ccccn2)n1 ZINC000536629436 323198806 /nfs/dbraw/zinc/19/88/06/323198806.db2.gz KNPAVQVPCMRCDB-AWEZNQCLSA-N 1 2 242.326 2.152 20 0 BEADLO COC(C)(C)CN(C)c1cc[nH+]c(C(C)C)n1 ZINC000532327653 323250878 /nfs/dbraw/zinc/25/08/78/323250878.db2.gz JDPCHIRGCHRGBH-UHFFFAOYSA-N 1 2 237.347 2.461 20 0 BEADLO COCC[N@H+](Cc1ccco1)CC1(F)CC1 ZINC000526969524 323309004 /nfs/dbraw/zinc/30/90/04/323309004.db2.gz AWINGQUATIHONI-UHFFFAOYSA-N 1 2 227.279 2.230 20 0 BEADLO COCC[N@@H+](Cc1ccco1)CC1(F)CC1 ZINC000526969524 323309007 /nfs/dbraw/zinc/30/90/07/323309007.db2.gz AWINGQUATIHONI-UHFFFAOYSA-N 1 2 227.279 2.230 20 0 BEADLO CCn1cc([C@@H](C)[NH2+]Cc2ncccc2F)cn1 ZINC000530418707 323385907 /nfs/dbraw/zinc/38/59/07/323385907.db2.gz ANXAJQQNJWRKSR-SNVBAGLBSA-N 1 2 248.305 2.288 20 0 BEADLO COc1ncc(C)cc1NCc1[nH]c(C)c(C)[nH+]1 ZINC000571894448 323500654 /nfs/dbraw/zinc/50/06/54/323500654.db2.gz IZFLQBXLCKYIPR-UHFFFAOYSA-N 1 2 246.314 2.351 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CCC(C)(C)O2)c(C)c[nH+]1 ZINC000571973231 323514615 /nfs/dbraw/zinc/51/46/15/323514615.db2.gz MZPRPQFRWFQSBB-LBPRGKRZSA-N 1 2 248.326 2.016 20 0 BEADLO CCn1cc[nH+]c1CN1CCOc2ccccc21 ZINC000195514480 323646171 /nfs/dbraw/zinc/64/61/71/323646171.db2.gz YXIFEQUVOSIFOU-UHFFFAOYSA-N 1 2 243.310 2.302 20 0 BEADLO COc1ccc[nH+]c1N1CC[C@@H](C)[C@@H]1C ZINC000527909561 323719344 /nfs/dbraw/zinc/71/93/44/323719344.db2.gz CBCKRFMIAPAWRJ-ZJUUUORDSA-N 1 2 206.289 2.325 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CCC[C@H]2OCC[C@H]21 ZINC000527925601 323731795 /nfs/dbraw/zinc/73/17/95/323731795.db2.gz MOTCGLSXOGRHOH-QJPTWQEYSA-N 1 2 248.326 2.460 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ncccc1F)c1cnn(C)c1 ZINC000528035198 323743490 /nfs/dbraw/zinc/74/34/90/323743490.db2.gz FGJCHMAKECHXBM-UWVGGRQHSA-N 1 2 248.305 2.366 20 0 BEADLO Cc1nc2[nH]ccc2c(NCC2CC=CC2)[nH+]1 ZINC000528112659 323766759 /nfs/dbraw/zinc/76/67/59/323766759.db2.gz DFKKBVPRUJRDIZ-UHFFFAOYSA-N 1 2 228.299 2.066 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CC[C@@H](OC)C1 ZINC000234908924 324119728 /nfs/dbraw/zinc/11/97/28/324119728.db2.gz JPNLMNVCKQPZPL-NXEZZACHSA-N 1 2 222.288 2.070 20 0 BEADLO OCCC1C[NH+](Cc2ccc(Cl)cc2F)C1 ZINC000459589670 324148780 /nfs/dbraw/zinc/14/87/80/324148780.db2.gz INFUTFKMONFHLV-UHFFFAOYSA-N 1 2 243.709 2.293 20 0 BEADLO CCC(C)(C)OC1C[NH+](Cc2cccn2C)C1 ZINC000529639281 324368565 /nfs/dbraw/zinc/36/85/65/324368565.db2.gz AGDOFFDPOFSUNF-UHFFFAOYSA-N 1 2 236.359 2.415 20 0 BEADLO Cc1ncc(C[NH2+][C@@H](C)c2ncccc2F)o1 ZINC000529691369 324378485 /nfs/dbraw/zinc/37/84/85/324378485.db2.gz XIBUQXAHSOCWTK-QMMMGPOBSA-N 1 2 235.262 2.368 20 0 BEADLO Cc1ccc(NC(=O)N(C)CC(F)F)c(C)[nH+]1 ZINC000125790500 324655019 /nfs/dbraw/zinc/65/50/19/324655019.db2.gz GXUQOIPGKYKTQG-UHFFFAOYSA-N 1 2 243.257 2.427 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CC[C@@H](C)C2)c(C)c[nH+]1 ZINC000538442499 324684581 /nfs/dbraw/zinc/68/45/81/324684581.db2.gz WVQVIEINUMLXMV-SKDRFNHKSA-N 1 2 232.327 2.495 20 0 BEADLO Cn1cc[nH+]c1CN[C@H](C(C)(C)C)C(F)(F)F ZINC000540917846 324930824 /nfs/dbraw/zinc/93/08/24/324930824.db2.gz IUFOYGYINUIEBN-SECBINFHSA-N 1 2 249.280 2.487 20 0 BEADLO CC(C)n1cc([C@H](C)[NH2+]Cc2ccon2)cn1 ZINC000541646069 324970563 /nfs/dbraw/zinc/97/05/63/324970563.db2.gz VLONKNAPAIDDKT-JTQLQIEISA-N 1 2 234.303 2.303 20 0 BEADLO CC(C)[N@H+](Cc1csnn1)C1CCC1 ZINC000130040828 325007769 /nfs/dbraw/zinc/00/77/69/325007769.db2.gz RESLRCRIDWCZDS-UHFFFAOYSA-N 1 2 211.334 2.301 20 0 BEADLO CC(C)[N@@H+](Cc1csnn1)C1CCC1 ZINC000130040828 325007771 /nfs/dbraw/zinc/00/77/71/325007771.db2.gz RESLRCRIDWCZDS-UHFFFAOYSA-N 1 2 211.334 2.301 20 0 BEADLO Cc1cccc(/C=C/C(=O)NCc2[nH]cc[nH+]2)c1 ZINC000070990374 325049018 /nfs/dbraw/zinc/04/90/18/325049018.db2.gz WPFFFNSMCYCFPC-AATRIKPKSA-N 1 2 241.294 2.048 20 0 BEADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2nccn2C)o1 ZINC000071138769 325057184 /nfs/dbraw/zinc/05/71/84/325057184.db2.gz IYVGEPYNFOYWFG-CMPLNLGQSA-N 1 2 245.326 2.426 20 0 BEADLO Cc1noc(C[NH2+][C@@H](c2cccnc2)C2CC2)n1 ZINC000543448172 325088710 /nfs/dbraw/zinc/08/87/10/325088710.db2.gz XKTILIINCKWYHM-CYBMUJFWSA-N 1 2 244.298 2.014 20 0 BEADLO CC(C)(C)c1nc(C[NH2+]C2(C3CC3)CC2)no1 ZINC000543455668 325090339 /nfs/dbraw/zinc/09/03/39/325090339.db2.gz XQGKMSXQWDKZQZ-UHFFFAOYSA-N 1 2 235.331 2.399 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccccc2F)o1 ZINC000543549461 325092901 /nfs/dbraw/zinc/09/29/01/325092901.db2.gz RXJCGTLYSHXODI-MRVPVSSYSA-N 1 2 235.262 2.368 20 0 BEADLO CCC[C@@H](C)C(=O)Nc1c[nH+]ccc1OC ZINC000131388222 325144620 /nfs/dbraw/zinc/14/46/20/325144620.db2.gz JDRGDNAHWFEBEW-SECBINFHSA-N 1 2 222.288 2.465 20 0 BEADLO CCc1cnc(C[NH2+][C@H](C)c2cnn(C)c2C)o1 ZINC000544485438 325145122 /nfs/dbraw/zinc/14/51/22/325145122.db2.gz CNYZKLKZDRFEIL-SECBINFHSA-N 1 2 248.330 2.130 20 0 BEADLO CCc1nnsc1C(=O)Nc1cc[nH+]c(C)c1 ZINC000073557383 325204409 /nfs/dbraw/zinc/20/44/09/325204409.db2.gz OEQCWWHFCJZPDL-UHFFFAOYSA-N 1 2 248.311 2.056 20 0 BEADLO O=S(=O)(Nc1cccc2cc[nH+]cc21)C1CC1 ZINC000545827351 325239482 /nfs/dbraw/zinc/23/94/82/325239482.db2.gz KENKNZIPRHNLCX-UHFFFAOYSA-N 1 2 248.307 2.139 20 0 BEADLO Cn1cc[nH+]c1CSCc1ccco1 ZINC000133008144 325259910 /nfs/dbraw/zinc/25/99/10/325259910.db2.gz JUVDIHHJQKIXNV-UHFFFAOYSA-N 1 2 208.286 2.447 20 0 BEADLO CC[N@H+](Cc1nc([C@H]2C[C@H]2C)no1)C1CC1 ZINC000546481364 325283778 /nfs/dbraw/zinc/28/37/78/325283778.db2.gz NRYISPIAOJGLPG-SCZZXKLOSA-N 1 2 221.304 2.177 20 0 BEADLO CC[N@@H+](Cc1nc([C@H]2C[C@H]2C)no1)C1CC1 ZINC000546481364 325283780 /nfs/dbraw/zinc/28/37/80/325283780.db2.gz NRYISPIAOJGLPG-SCZZXKLOSA-N 1 2 221.304 2.177 20 0 BEADLO O=C(CC1CCCCC1)NCCc1[nH]cc[nH+]1 ZINC000134492982 325361003 /nfs/dbraw/zinc/36/10/03/325361003.db2.gz JNHWSVSJZKFQOH-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO COC(=O)CSCc1ccc(C)[nH+]c1C ZINC000547498096 325364956 /nfs/dbraw/zinc/36/49/56/325364956.db2.gz DHLMNWQETJTMMO-UHFFFAOYSA-N 1 2 225.313 2.105 20 0 BEADLO C[C@@H](SCc1cn2ccccc2[nH+]1)[C@H](C)O ZINC000079039977 325441199 /nfs/dbraw/zinc/44/11/99/325441199.db2.gz SPWLZJXOCODYPQ-VHSXEESVSA-N 1 2 236.340 2.337 20 0 BEADLO CC(C)c1nc(N[C@H]2CC[C@H](O)CC2)cc[nH+]1 ZINC000245562101 325514837 /nfs/dbraw/zinc/51/48/37/325514837.db2.gz VKBBSMZMSGBWFG-XYPYZODXSA-N 1 2 235.331 2.315 20 0 BEADLO FC(F)(F)c1cc[nH+]c(NCc2cc[nH]n2)c1 ZINC000090803107 325680604 /nfs/dbraw/zinc/68/06/04/325680604.db2.gz JBFCGQCMWNCMRM-UHFFFAOYSA-N 1 2 242.204 2.436 20 0 BEADLO O=C(Cn1cc[nH+]c1)Nc1cccc2[nH]ccc21 ZINC000565573073 325928837 /nfs/dbraw/zinc/92/88/37/325928837.db2.gz UECGLVXZPXEARO-UHFFFAOYSA-N 1 2 240.266 2.003 20 0 BEADLO CCC1(CNC(=O)C[C@H](C)n2cc[nH+]c2)CC1 ZINC000566303649 326031084 /nfs/dbraw/zinc/03/10/84/326031084.db2.gz FVESGKPZINVLTK-NSHDSACASA-N 1 2 235.331 2.141 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCC[C@H](F)C1 ZINC000566352855 326035859 /nfs/dbraw/zinc/03/58/59/326035859.db2.gz AEACVBIMRSLWAQ-JTQLQIEISA-N 1 2 212.268 2.225 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCC[C@H](F)C1 ZINC000566352855 326035862 /nfs/dbraw/zinc/03/58/62/326035862.db2.gz AEACVBIMRSLWAQ-JTQLQIEISA-N 1 2 212.268 2.225 20 0 BEADLO CCCC1(CNC(=O)[C@H](C)Cc2c[nH+]c[nH]2)CC1 ZINC000566443729 326048434 /nfs/dbraw/zinc/04/84/34/326048434.db2.gz ZIXVNQAZCSALLH-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO CCCC1(CNC(=O)[C@H](C)Cc2c[nH]c[nH+]2)CC1 ZINC000566443729 326048438 /nfs/dbraw/zinc/04/84/38/326048438.db2.gz ZIXVNQAZCSALLH-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1CCCC[C@@H](C)C1 ZINC000566452542 326050234 /nfs/dbraw/zinc/05/02/34/326050234.db2.gz ZGRKUFMCTDCYDV-NEPJUHHUSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1CCCC[C@@H](C)C1 ZINC000566452542 326050238 /nfs/dbraw/zinc/05/02/38/326050238.db2.gz ZGRKUFMCTDCYDV-NEPJUHHUSA-N 1 2 249.358 2.237 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1C[C@@H]2OCCC[C@H]12 ZINC000566484923 326056821 /nfs/dbraw/zinc/05/68/21/326056821.db2.gz UAGJJNRIGALENN-UTUOFQBUSA-N 1 2 233.315 2.073 20 0 BEADLO CCn1nc(C)c(NCc2[nH]c(C)c(C)[nH+]2)c1C ZINC000566496526 326058548 /nfs/dbraw/zinc/05/85/48/326058548.db2.gz ISPJACBXQIDQMI-UHFFFAOYSA-N 1 2 247.346 2.472 20 0 BEADLO CC[C@@]1(C)CCN(C(=O)C[C@@H](C)n2cc[nH+]c2)C1 ZINC000566623216 326069352 /nfs/dbraw/zinc/06/93/52/326069352.db2.gz BKMRSAPRCMNVRB-OCCSQVGLSA-N 1 2 249.358 2.483 20 0 BEADLO CC(C)=CCCNC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000567170863 326128407 /nfs/dbraw/zinc/12/84/07/326128407.db2.gz OCXHLODDHMNFOV-LBPRGKRZSA-N 1 2 235.331 2.307 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@@H]2CC3CCC2CC3)c[nH+]1 ZINC000567274367 326154763 /nfs/dbraw/zinc/15/47/63/326154763.db2.gz SOXSRDDEFQUQRS-MCIGGMRASA-N 1 2 247.342 2.274 20 0 BEADLO CC(C)[C@@H]1CCN(C(=O)[C@H](C)Cc2c[nH+]c[nH]2)C1 ZINC000567288463 326156110 /nfs/dbraw/zinc/15/61/10/326156110.db2.gz PWBUDCGVFKXSKT-VXGBXAGGSA-N 1 2 249.358 2.093 20 0 BEADLO CC(C)[C@@H]1CCN(C(=O)[C@H](C)Cc2c[nH]c[nH+]2)C1 ZINC000567288463 326156113 /nfs/dbraw/zinc/15/61/13/326156113.db2.gz PWBUDCGVFKXSKT-VXGBXAGGSA-N 1 2 249.358 2.093 20 0 BEADLO COC(=O)[C@](C)([NH2+][C@H]1C=CCCC1)C1CC1 ZINC000309950050 326176799 /nfs/dbraw/zinc/17/67/99/326176799.db2.gz FSALSZICEODKKP-WCQYABFASA-N 1 2 223.316 2.026 20 0 BEADLO CC(C)c1cccnc1NC(=O)Cn1cc[nH+]c1 ZINC000567409397 326185990 /nfs/dbraw/zinc/18/59/90/326185990.db2.gz YFIMRHOWWNFXPE-UHFFFAOYSA-N 1 2 244.298 2.040 20 0 BEADLO C[C@H](C(=O)NC(C)(C)C)[NH+]1Cc2ccccc2C1 ZINC000155450677 326196476 /nfs/dbraw/zinc/19/64/76/326196476.db2.gz PGRYFQPFJYYMAP-LLVKDONJSA-N 1 2 246.354 2.305 20 0 BEADLO COc1ccc(C)cc1C[NH2+]Cc1ncccn1 ZINC000567488016 326203360 /nfs/dbraw/zinc/20/33/60/326203360.db2.gz CEYJMMXIVALPLH-UHFFFAOYSA-N 1 2 243.310 2.083 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccc(C)cn2)CCO1 ZINC000156078319 326218296 /nfs/dbraw/zinc/21/82/96/326218296.db2.gz QDFBJIDQXVBUBD-CYBMUJFWSA-N 1 2 220.316 2.001 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccc(C)cn2)CCO1 ZINC000156078319 326218300 /nfs/dbraw/zinc/21/83/00/326218300.db2.gz QDFBJIDQXVBUBD-CYBMUJFWSA-N 1 2 220.316 2.001 20 0 BEADLO CC(C)[C@H]1CCCN1C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000568014602 326296380 /nfs/dbraw/zinc/29/63/80/326296380.db2.gz GSZNZAYZEQRDIX-CHWSQXEVSA-N 1 2 249.358 2.481 20 0 BEADLO CN(C)c1ncc(C[N@@H+]2CCC[C@@H](F)C2)s1 ZINC000568054591 326301707 /nfs/dbraw/zinc/30/17/07/326301707.db2.gz WYCRCCCMKICOBC-SECBINFHSA-N 1 2 243.351 2.143 20 0 BEADLO CN(C)c1ncc(C[N@H+]2CCC[C@@H](F)C2)s1 ZINC000568054591 326301708 /nfs/dbraw/zinc/30/17/08/326301708.db2.gz WYCRCCCMKICOBC-SECBINFHSA-N 1 2 243.351 2.143 20 0 BEADLO Cc1nc2ccc(NCc3[nH]cc[nH+]3)cc2o1 ZINC000158988123 326347610 /nfs/dbraw/zinc/34/76/10/326347610.db2.gz JDVPSEPTCFIISA-UHFFFAOYSA-N 1 2 228.255 2.471 20 0 BEADLO C[C@@H]1C[C@H](C)N1C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000568363257 326349610 /nfs/dbraw/zinc/34/96/10/326349610.db2.gz CNDWZUBAZGGBCE-CHWFTXMASA-N 1 2 248.330 2.081 20 0 BEADLO C[C@@H]1C[C@H](C)N1C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000568363259 326349810 /nfs/dbraw/zinc/34/98/10/326349810.db2.gz CNDWZUBAZGGBCE-UKKRHICBSA-N 1 2 248.330 2.081 20 0 BEADLO Cc1ccoc1C[N@@H+](C)[C@H](C)c1nc(C)no1 ZINC000568710603 326373079 /nfs/dbraw/zinc/37/30/79/326373079.db2.gz WHMZQCGIJXPCEG-SECBINFHSA-N 1 2 235.287 2.472 20 0 BEADLO Cc1ccoc1C[N@H+](C)[C@H](C)c1nc(C)no1 ZINC000568710603 326373080 /nfs/dbraw/zinc/37/30/80/326373080.db2.gz WHMZQCGIJXPCEG-SECBINFHSA-N 1 2 235.287 2.472 20 0 BEADLO Fc1cncc(C[N@H+]2CC[C@H](OC(F)F)C2)c1 ZINC000569022982 326387286 /nfs/dbraw/zinc/38/72/86/326387286.db2.gz WZAFBDKHROJDMU-JTQLQIEISA-N 1 2 246.232 2.034 20 0 BEADLO Fc1cncc(C[N@@H+]2CC[C@H](OC(F)F)C2)c1 ZINC000569022982 326387287 /nfs/dbraw/zinc/38/72/87/326387287.db2.gz WZAFBDKHROJDMU-JTQLQIEISA-N 1 2 246.232 2.034 20 0 BEADLO COc1ccccc1CNc1nc(C)[nH+]cc1C ZINC000569040781 326387582 /nfs/dbraw/zinc/38/75/82/326387582.db2.gz LDESAOFJQMDHKZ-UHFFFAOYSA-N 1 2 243.310 2.136 20 0 BEADLO Cc1cc(CNC(=O)N[C@H]2CC23CC3)cc(C)[nH+]1 ZINC000569232865 326396405 /nfs/dbraw/zinc/39/64/05/326396405.db2.gz SLXBGEDSTBAEFD-LBPRGKRZSA-N 1 2 245.326 2.050 20 0 BEADLO Cc1cc(N)nc(SCc2cccc(N)c2)[nH+]1 ZINC000569302805 326399231 /nfs/dbraw/zinc/39/92/31/326399231.db2.gz ATPITVMPNXQKRJ-UHFFFAOYSA-N 1 2 246.339 2.072 20 0 BEADLO C[C@H](CC(=O)N1CCC(C)CC1)n1cc[nH+]c1 ZINC000573124951 326431077 /nfs/dbraw/zinc/43/10/77/326431077.db2.gz QPFJTEVSRMIDQV-GFCCVEGCSA-N 1 2 235.331 2.093 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CC(C(C)C)C2)[nH+]1 ZINC000677125339 487977320 /nfs/dbraw/zinc/97/73/20/487977320.db2.gz UMZCYRQLWYCLGH-UHFFFAOYSA-N 1 2 230.315 2.359 20 0 BEADLO Cc1cc(N[C@@H](c2[nH]cc[nH+]2)C(C)C)ncn1 ZINC000670818209 487979493 /nfs/dbraw/zinc/97/94/93/487979493.db2.gz VJSYYCHHKYKYMA-LLVKDONJSA-N 1 2 231.303 2.317 20 0 BEADLO CCC[C@H](C)C[N@@H+]1C[C@H](O)CC(F)(F)C1 ZINC000682558782 487987843 /nfs/dbraw/zinc/98/78/43/487987843.db2.gz PEADHUCFNNWNLK-VHSXEESVSA-N 1 2 221.291 2.125 20 0 BEADLO CCC[C@H](C)C[N@H+]1C[C@H](O)CC(F)(F)C1 ZINC000682558782 487987846 /nfs/dbraw/zinc/98/78/46/487987846.db2.gz PEADHUCFNNWNLK-VHSXEESVSA-N 1 2 221.291 2.125 20 0 BEADLO CO[C@H](C)CNc1cc[nH+]c(C(C)(C)C)n1 ZINC000309665761 487999282 /nfs/dbraw/zinc/99/92/82/487999282.db2.gz TYSYJEDYVUJTGB-SECBINFHSA-N 1 2 223.320 2.221 20 0 BEADLO CCN1CC[N@@H+]([C@@H](C)c2cccnc2)C[C@H]1C ZINC000677195625 487999818 /nfs/dbraw/zinc/99/98/18/487999818.db2.gz PIMSUFVODWSHMK-OLZOCXBDSA-N 1 2 233.359 2.169 20 0 BEADLO CCN1CC[N@H+]([C@@H](C)c2cccnc2)C[C@H]1C ZINC000677195625 487999822 /nfs/dbraw/zinc/99/98/22/487999822.db2.gz PIMSUFVODWSHMK-OLZOCXBDSA-N 1 2 233.359 2.169 20 0 BEADLO CC(C)(C)c1nc(N[C@H](CO)CC2CC2)cc[nH+]1 ZINC000677237083 488004082 /nfs/dbraw/zinc/00/40/82/488004082.db2.gz OAXQVEITMMDNKV-NSHDSACASA-N 1 2 249.358 2.347 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)Cc1ccncc1Cl ZINC000682672513 488009574 /nfs/dbraw/zinc/00/95/74/488009574.db2.gz CTZMVJUNYXVDFC-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO Cc1cn2c(C[NH2+]CC(F)F)c(C)nc2s1 ZINC000147371377 488012604 /nfs/dbraw/zinc/01/26/04/488012604.db2.gz YYTXDVNWDQUTLY-UHFFFAOYSA-N 1 2 245.298 2.367 20 0 BEADLO CC[C@@H]1CC[C@H]1Nc1ccc(N(C)CCO)c[nH+]1 ZINC000672606829 488013991 /nfs/dbraw/zinc/01/39/91/488013991.db2.gz FKKHVGKMSWRJRP-DGCLKSJQSA-N 1 2 249.358 2.111 20 0 BEADLO CCN(C[C@@H]1CCOC1)c1[nH]c2ccccc2[nH+]1 ZINC000682393754 488020236 /nfs/dbraw/zinc/02/02/36/488020236.db2.gz FEGXHVDFGBSGDR-NSHDSACASA-N 1 2 245.326 2.426 20 0 BEADLO CCC[N@H+](CC(F)F)[C@H]1CCCOC1 ZINC000677478097 488048052 /nfs/dbraw/zinc/04/80/52/488048052.db2.gz NFYHECLFBFZUMB-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CCC[N@@H+](CC(F)F)[C@H]1CCCOC1 ZINC000677478097 488048054 /nfs/dbraw/zinc/04/80/54/488048054.db2.gz NFYHECLFBFZUMB-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CCC[N@H+](CC(F)F)[C@@H]1CCCOC1 ZINC000677478096 488048178 /nfs/dbraw/zinc/04/81/78/488048178.db2.gz NFYHECLFBFZUMB-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CCC[N@@H+](CC(F)F)[C@@H]1CCCOC1 ZINC000677478096 488048182 /nfs/dbraw/zinc/04/81/82/488048182.db2.gz NFYHECLFBFZUMB-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2oc(C)nc2C)CCO1 ZINC000685569277 488077184 /nfs/dbraw/zinc/07/71/84/488077184.db2.gz AIFGRPOTYCBTRJ-GFCCVEGCSA-N 1 2 238.331 2.292 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2oc(C)nc2C)CCO1 ZINC000685569277 488077187 /nfs/dbraw/zinc/07/71/87/488077187.db2.gz AIFGRPOTYCBTRJ-GFCCVEGCSA-N 1 2 238.331 2.292 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1cc(C)ccn1 ZINC000683010089 488088965 /nfs/dbraw/zinc/08/89/65/488088965.db2.gz WPHXSBWERIAYSU-CYBMUJFWSA-N 1 2 220.316 2.001 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1cc(C)ccn1 ZINC000683010089 488088969 /nfs/dbraw/zinc/08/89/69/488088969.db2.gz WPHXSBWERIAYSU-CYBMUJFWSA-N 1 2 220.316 2.001 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCCc2c1cnn2C)C(F)F ZINC000228499315 488096805 /nfs/dbraw/zinc/09/68/05/488096805.db2.gz DBEDSVXAYHNLJK-VXNVDRBHSA-N 1 2 229.274 2.041 20 0 BEADLO Cc1ccnc(C[NH2+][C@H](CCO)c2ccco2)c1 ZINC000683024007 488099581 /nfs/dbraw/zinc/09/95/81/488099581.db2.gz ICGJLKORYABBJP-CYBMUJFWSA-N 1 2 246.310 2.196 20 0 BEADLO CCn1ccc(C[N@H+](C)Cc2ncc(C)o2)c1 ZINC000683030887 488100378 /nfs/dbraw/zinc/10/03/78/488100378.db2.gz FUNFCZODNNVGIF-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CCn1ccc(C[N@@H+](C)Cc2ncc(C)o2)c1 ZINC000683030887 488100383 /nfs/dbraw/zinc/10/03/83/488100383.db2.gz FUNFCZODNNVGIF-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1c1cc(CO)cc[nH+]1 ZINC000136427603 488102258 /nfs/dbraw/zinc/10/22/58/488102258.db2.gz KXIBBZGBDUUDAT-PWSUYJOCSA-N 1 2 220.316 2.341 20 0 BEADLO Fc1c[nH+]ccc1NCc1ccc2c(c1)COC2 ZINC000683071429 488105454 /nfs/dbraw/zinc/10/54/54/488105454.db2.gz WSCOUTGQOXWKRR-UHFFFAOYSA-N 1 2 244.269 2.285 20 0 BEADLO CC(C)c1noc(C[N@@H+]2CC[C@@H](C(F)F)C2)n1 ZINC000677733114 488111920 /nfs/dbraw/zinc/11/19/20/488111920.db2.gz JWEVTVKCSHNYAZ-MRVPVSSYSA-N 1 2 245.273 2.280 20 0 BEADLO CC(C)c1noc(C[N@H+]2CC[C@@H](C(F)F)C2)n1 ZINC000677733114 488111923 /nfs/dbraw/zinc/11/19/23/488111923.db2.gz JWEVTVKCSHNYAZ-MRVPVSSYSA-N 1 2 245.273 2.280 20 0 BEADLO FC(F)[C@H]1CC[N@H+](Cc2nc(C3CC3)no2)C1 ZINC000677734601 488113096 /nfs/dbraw/zinc/11/30/96/488113096.db2.gz XUNHLSQSNLBABE-QMMMGPOBSA-N 1 2 243.257 2.034 20 0 BEADLO FC(F)[C@H]1CC[N@@H+](Cc2nc(C3CC3)no2)C1 ZINC000677734601 488113099 /nfs/dbraw/zinc/11/30/99/488113099.db2.gz XUNHLSQSNLBABE-QMMMGPOBSA-N 1 2 243.257 2.034 20 0 BEADLO CC1(C)CC[C@H]1C(=O)NCCCCn1cc[nH+]c1 ZINC000668686173 488114888 /nfs/dbraw/zinc/11/48/88/488114888.db2.gz ISFMIRSZMFNERZ-LBPRGKRZSA-N 1 2 249.358 2.216 20 0 BEADLO CCc1ncc(C[NH2+]C(C)(C)C(F)F)cn1 ZINC000666361105 488115319 /nfs/dbraw/zinc/11/53/19/488115319.db2.gz DIUIJXGDJIEWBT-UHFFFAOYSA-N 1 2 229.274 2.172 20 0 BEADLO CC[C@@H]([NH2+]Cc1cn(C)nn1)c1ccccc1F ZINC000389831459 488116573 /nfs/dbraw/zinc/11/65/73/488116573.db2.gz HITNLTKRKMDRPR-CYBMUJFWSA-N 1 2 248.305 2.195 20 0 BEADLO CC[N@H+](CCC(F)(F)F)Cc1[nH]ncc1C ZINC000685835687 488117940 /nfs/dbraw/zinc/11/79/40/488117940.db2.gz ADFJBIUWAKJFSI-UHFFFAOYSA-N 1 2 235.253 2.492 20 0 BEADLO CC[N@@H+](CCC(F)(F)F)Cc1[nH]ncc1C ZINC000685835687 488117946 /nfs/dbraw/zinc/11/79/46/488117946.db2.gz ADFJBIUWAKJFSI-UHFFFAOYSA-N 1 2 235.253 2.492 20 0 BEADLO CC[N@H+](CCC(F)(F)F)Cc1n[nH]cc1C ZINC000685835687 488117949 /nfs/dbraw/zinc/11/79/49/488117949.db2.gz ADFJBIUWAKJFSI-UHFFFAOYSA-N 1 2 235.253 2.492 20 0 BEADLO CC[N@@H+](CCC(F)(F)F)Cc1n[nH]cc1C ZINC000685835687 488117955 /nfs/dbraw/zinc/11/79/55/488117955.db2.gz ADFJBIUWAKJFSI-UHFFFAOYSA-N 1 2 235.253 2.492 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCC1(F)CCC1 ZINC000516584326 488126499 /nfs/dbraw/zinc/12/64/99/488126499.db2.gz WCQTWDQJRSYFCW-UHFFFAOYSA-N 1 2 223.295 2.210 20 0 BEADLO CCc1cnc(C[NH2+]Cc2cc(C)ncn2)s1 ZINC000680133972 487539910 /nfs/dbraw/zinc/53/99/10/487539910.db2.gz OEJBEPVVONIDPZ-UHFFFAOYSA-N 1 2 248.355 2.094 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+](C)CCC(C)C)no1 ZINC000685561474 487544135 /nfs/dbraw/zinc/54/41/35/487544135.db2.gz DWMVVEKYCSUSIJ-SECBINFHSA-N 1 2 211.309 2.417 20 0 BEADLO Cc1nc([C@@H](C)[N@H+](C)CCC(C)C)no1 ZINC000685561474 487544142 /nfs/dbraw/zinc/54/41/42/487544142.db2.gz DWMVVEKYCSUSIJ-SECBINFHSA-N 1 2 211.309 2.417 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCO[C@H](C(C)C)C2)o1 ZINC000685571660 487552393 /nfs/dbraw/zinc/55/23/93/487552393.db2.gz CURDPORTJVHSBG-LBPRGKRZSA-N 1 2 238.331 2.148 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCO[C@H](C(C)C)C2)o1 ZINC000685571660 487552397 /nfs/dbraw/zinc/55/23/97/487552397.db2.gz CURDPORTJVHSBG-LBPRGKRZSA-N 1 2 238.331 2.148 20 0 BEADLO CN(C)c1cc[nH+]c(NC(=O)c2cccs2)c1 ZINC000680256484 487552423 /nfs/dbraw/zinc/55/24/23/487552423.db2.gz NFGZANSPRCSLRG-UHFFFAOYSA-N 1 2 247.323 2.461 20 0 BEADLO C[C@@H]1CCCC[C@H]1CC(=O)NCc1c[nH+]c[nH]1 ZINC000673934850 487484012 /nfs/dbraw/zinc/48/40/12/487484012.db2.gz JGOIPAPTSOEOMH-MNOVXSKESA-N 1 2 235.331 2.242 20 0 BEADLO C[C@@H]1CCCC[C@H]1CC(=O)NCc1c[nH]c[nH+]1 ZINC000673934850 487484016 /nfs/dbraw/zinc/48/40/16/487484016.db2.gz JGOIPAPTSOEOMH-MNOVXSKESA-N 1 2 235.331 2.242 20 0 BEADLO Cc1cc(C)c(CNC(=O)NCCC2CC2)c[nH+]1 ZINC000454598483 487481002 /nfs/dbraw/zinc/48/10/02/487481002.db2.gz PZRRDVOHVQPTOD-UHFFFAOYSA-N 1 2 247.342 2.298 20 0 BEADLO Cc1noc([C@H](C)[NH2+][C@@H](C)c2cnccc2C)n1 ZINC000679941056 487499823 /nfs/dbraw/zinc/49/98/23/487499823.db2.gz BTTSVSUGQUNXBX-UWVGGRQHSA-N 1 2 246.314 2.493 20 0 BEADLO CCc1cc(N[C@@H](C)C[C@@H]2CCOC2)nc[nH+]1 ZINC000675291709 487503542 /nfs/dbraw/zinc/50/35/42/487503542.db2.gz XLBIIXFFXAUVRJ-QWRGUYRKSA-N 1 2 235.331 2.266 20 0 BEADLO COCC1(O)C[NH+](Cc2cccc(C(C)C)c2)C1 ZINC000668233523 487504925 /nfs/dbraw/zinc/50/49/25/487504925.db2.gz AYLLFZBEZQJHEG-UHFFFAOYSA-N 1 2 249.354 2.003 20 0 BEADLO CN(CCO)c1ccc(N[C@@H]2CCC2(C)C)[nH+]c1 ZINC000671299368 487511936 /nfs/dbraw/zinc/51/19/36/487511936.db2.gz JZYXMFQDQJNMHU-GFCCVEGCSA-N 1 2 249.358 2.111 20 0 BEADLO Cc1cn2c([nH+]1)CN(Cc1occc1C)CC2 ZINC000680001118 487513601 /nfs/dbraw/zinc/51/36/01/487513601.db2.gz URTJOAOSZBYFFW-UHFFFAOYSA-N 1 2 231.299 2.109 20 0 BEADLO CCC1(C(=O)N2CCC[C@@H](n3cc[nH+]c3)C2)CC1 ZINC000674090429 487516930 /nfs/dbraw/zinc/51/69/30/487516930.db2.gz YNLBHRKOMWHUPH-GFCCVEGCSA-N 1 2 247.342 2.237 20 0 BEADLO CCC1(C(=O)Nc2ccc3[nH+]ccn3c2)CC1 ZINC000674092280 487517806 /nfs/dbraw/zinc/51/78/06/487517806.db2.gz DTKGDNNOBODROF-UHFFFAOYSA-N 1 2 229.283 2.463 20 0 BEADLO CCOC(=O)[C@@H](Cc1ccccc1)[NH2+]CC1CC1 ZINC000037968210 487518645 /nfs/dbraw/zinc/51/86/45/487518645.db2.gz GIADLRCUWSMKOK-CQSZACIVSA-N 1 2 247.338 2.160 20 0 BEADLO CCC(=O)CCC[N@@H+]1CCC[C@H](c2ccn[nH]2)C1 ZINC000685417636 487518809 /nfs/dbraw/zinc/51/88/09/487518809.db2.gz BVVILLWWQHCRMB-LBPRGKRZSA-N 1 2 249.358 2.348 20 0 BEADLO CCC(=O)CCC[N@H+]1CCC[C@H](c2ccn[nH]2)C1 ZINC000685417636 487518815 /nfs/dbraw/zinc/51/88/15/487518815.db2.gz BVVILLWWQHCRMB-LBPRGKRZSA-N 1 2 249.358 2.348 20 0 BEADLO Cc1cn[nH]c1C[NH2+][C@H](C)c1c(C)noc1C ZINC000685616189 487566094 /nfs/dbraw/zinc/56/60/94/487566094.db2.gz ZIHVUNGUKJRYFG-MRVPVSSYSA-N 1 2 234.303 2.174 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@H](C)c1c(C)noc1C ZINC000685616189 487566098 /nfs/dbraw/zinc/56/60/98/487566098.db2.gz ZIHVUNGUKJRYFG-MRVPVSSYSA-N 1 2 234.303 2.174 20 0 BEADLO Cc1c[nH]nc1C[N@@H+](C)Cc1ccc(C)cn1 ZINC000685844601 487586198 /nfs/dbraw/zinc/58/61/98/487586198.db2.gz PBGLHIZSSFFSFO-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1c[nH]nc1C[N@H+](C)Cc1ccc(C)cn1 ZINC000685844601 487586202 /nfs/dbraw/zinc/58/62/02/487586202.db2.gz PBGLHIZSSFFSFO-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO c1nc(N2CCC3(CC3)C2)cc(N2CCCC2)[nH+]1 ZINC000685919071 487597491 /nfs/dbraw/zinc/59/74/91/487597491.db2.gz ZWYKDUKQOZYIAE-UHFFFAOYSA-N 1 2 244.342 2.067 20 0 BEADLO c1nc(N2CCCC2)cc(N2CCC3(CC3)C2)[nH+]1 ZINC000685919071 487597494 /nfs/dbraw/zinc/59/74/94/487597494.db2.gz ZWYKDUKQOZYIAE-UHFFFAOYSA-N 1 2 244.342 2.067 20 0 BEADLO COc1ccc(NCc2cnn(C(C)C)c2)[nH+]c1 ZINC000676201558 487821202 /nfs/dbraw/zinc/82/12/02/487821202.db2.gz YUYFNCUXKBWSTL-UHFFFAOYSA-N 1 2 246.314 2.480 20 0 BEADLO COc1ccc(NCc2nc(C)ccc2O)[nH+]c1 ZINC000676201560 487821227 /nfs/dbraw/zinc/82/12/27/487821227.db2.gz YVSLBIFLFWOZBY-UHFFFAOYSA-N 1 2 245.282 2.111 20 0 BEADLO Cc1cc(C[NH2+]Cc2cccc(F)c2F)ncn1 ZINC000677425618 488034400 /nfs/dbraw/zinc/03/44/00/488034400.db2.gz XVRSUKZBBGKIOA-UHFFFAOYSA-N 1 2 249.264 2.353 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)C1CC2(CC2)C1 ZINC000668637880 488036940 /nfs/dbraw/zinc/03/69/40/488036940.db2.gz VMHYLFMRPUCVBE-UHFFFAOYSA-N 1 2 241.294 2.463 20 0 BEADLO c1nn(-c2ccccc2)cc1CNc1c[nH]c[nH+]1 ZINC000685845872 488127676 /nfs/dbraw/zinc/12/76/76/488127676.db2.gz AQCKYIJWWITCQE-UHFFFAOYSA-N 1 2 239.282 2.208 20 0 BEADLO COc1ccc[nH+]c1NCc1cccnc1C ZINC000677853671 488141290 /nfs/dbraw/zinc/14/12/90/488141290.db2.gz XXSDYJRBRBLCBO-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO Cc1oc(C)c(C(=O)N[C@H](C)c2[nH]cc[nH+]2)c1C ZINC000140828210 488147614 /nfs/dbraw/zinc/14/76/14/488147614.db2.gz ODTCPJUKHWGRKL-MRVPVSSYSA-N 1 2 247.298 2.419 20 0 BEADLO Cc1nn(C)cc1[C@H]1CCC[N@@H+]1Cc1cocn1 ZINC000683352216 488151534 /nfs/dbraw/zinc/15/15/34/488151534.db2.gz DWAGLPTVYOQJMD-CYBMUJFWSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1nn(C)cc1[C@H]1CCC[N@H+]1Cc1cocn1 ZINC000683352216 488151538 /nfs/dbraw/zinc/15/15/38/488151538.db2.gz DWAGLPTVYOQJMD-CYBMUJFWSA-N 1 2 246.314 2.054 20 0 BEADLO CN(CC(C)(C)C)C(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000667972331 488172861 /nfs/dbraw/zinc/17/28/61/488172861.db2.gz MPBYVRQKWYSGMK-SNVBAGLBSA-N 1 2 249.358 2.019 20 0 BEADLO CN(CC(C)(C)C)C(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000667972331 488172864 /nfs/dbraw/zinc/17/28/64/488172864.db2.gz MPBYVRQKWYSGMK-SNVBAGLBSA-N 1 2 249.358 2.019 20 0 BEADLO CC[C@@H](N[C@H](C)c1[nH]cc[nH+]1)C(F)F ZINC000453247065 488186452 /nfs/dbraw/zinc/18/64/52/488186452.db2.gz NTFNYMGXFSINMA-RNFRBKRXSA-N 1 2 203.236 2.104 20 0 BEADLO CC(C)c1nc(N(C)C)nc(N[C@@H]2CC2(C)C)[nH+]1 ZINC000678063988 488190266 /nfs/dbraw/zinc/19/02/66/488190266.db2.gz SSVGVYRAGCWYQH-SECBINFHSA-N 1 2 249.362 2.271 20 0 BEADLO CC(C)c1nc(N[C@@H]2CC2(C)C)nc(N(C)C)[nH+]1 ZINC000678063988 488190268 /nfs/dbraw/zinc/19/02/68/488190268.db2.gz SSVGVYRAGCWYQH-SECBINFHSA-N 1 2 249.362 2.271 20 0 BEADLO CCc1cc(NC2C[C@H](C)O[C@@H](C)C2)nc[nH+]1 ZINC000678070939 488191027 /nfs/dbraw/zinc/19/10/27/488191027.db2.gz KMMUMBVVQHHHBM-UWVGGRQHSA-N 1 2 235.331 2.407 20 0 BEADLO CCC[C@@H](C)NC(=O)Nc1cc[nH+]c(C)c1 ZINC000678096781 488197629 /nfs/dbraw/zinc/19/76/29/488197629.db2.gz YTMFRFGLAJAAIK-SECBINFHSA-N 1 2 221.304 2.122 20 0 BEADLO Cc1cc(NC(=O)NC[C@@H](C)C2CC2)c(C)c[nH+]1 ZINC000678097543 488197684 /nfs/dbraw/zinc/19/76/84/488197684.db2.gz IUDADAHAKBESCF-SECBINFHSA-N 1 2 247.342 2.288 20 0 BEADLO C[C@@H](c1noc(Cn2cc[nH+]c2)n1)C(C)(C)C ZINC000683580558 488199198 /nfs/dbraw/zinc/19/91/98/488199198.db2.gz JDNGBLVQXBXRCO-VIFPVBQESA-N 1 2 234.303 2.464 20 0 BEADLO CC(C)c1cc(C[NH2+][C@H](C)c2ccnn2C)on1 ZINC000683690731 488207024 /nfs/dbraw/zinc/20/70/24/488207024.db2.gz PHMWIZFFPNUKAU-SNVBAGLBSA-N 1 2 248.330 2.382 20 0 BEADLO c1c(C[NH+]2CC3(C2)CCCC3)nn2c1CCC2 ZINC000668173852 488213669 /nfs/dbraw/zinc/21/36/69/488213669.db2.gz VVXLWPNJYNDGHI-UHFFFAOYSA-N 1 2 231.343 2.205 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1[nH]nc2ccccc21 ZINC000678182586 488214371 /nfs/dbraw/zinc/21/43/71/488214371.db2.gz VWPCJOYDUSMNOJ-NSHDSACASA-N 1 2 245.326 2.174 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1[nH]nc2ccccc21 ZINC000678182586 488214374 /nfs/dbraw/zinc/21/43/74/488214374.db2.gz VWPCJOYDUSMNOJ-NSHDSACASA-N 1 2 245.326 2.174 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1n[nH]c2ccccc21 ZINC000678182586 488214376 /nfs/dbraw/zinc/21/43/76/488214376.db2.gz VWPCJOYDUSMNOJ-NSHDSACASA-N 1 2 245.326 2.174 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1n[nH]c2ccccc21 ZINC000678182586 488214378 /nfs/dbraw/zinc/21/43/78/488214378.db2.gz VWPCJOYDUSMNOJ-NSHDSACASA-N 1 2 245.326 2.174 20 0 BEADLO COC(C)(C)CC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000683740676 488215424 /nfs/dbraw/zinc/21/54/24/488215424.db2.gz APUOYUYASMCROW-UHFFFAOYSA-N 1 2 247.298 2.088 20 0 BEADLO CC1(C)COCC[N@@H+]1Cc1[nH]nc2ccccc21 ZINC000678210825 488216537 /nfs/dbraw/zinc/21/65/37/488216537.db2.gz YFIGQRWUMIWZCL-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO CC1(C)COCC[N@H+]1Cc1[nH]nc2ccccc21 ZINC000678210825 488216538 /nfs/dbraw/zinc/21/65/38/488216538.db2.gz YFIGQRWUMIWZCL-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO CC1(C)COCC[N@@H+]1Cc1n[nH]c2ccccc21 ZINC000678210825 488216542 /nfs/dbraw/zinc/21/65/42/488216542.db2.gz YFIGQRWUMIWZCL-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO CC1(C)COCC[N@H+]1Cc1n[nH]c2ccccc21 ZINC000678210825 488216545 /nfs/dbraw/zinc/21/65/45/488216545.db2.gz YFIGQRWUMIWZCL-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO Cc1cccc2[nH]c(C[N@@H+]3CCO[C@@H]4C[C@@H]43)cc21 ZINC000668187144 488217376 /nfs/dbraw/zinc/21/73/76/488217376.db2.gz YKWILNQHKUOIIL-LSDHHAIUSA-N 1 2 242.322 2.449 20 0 BEADLO Cc1cccc2[nH]c(C[N@H+]3CCO[C@@H]4C[C@@H]43)cc21 ZINC000668187144 488217379 /nfs/dbraw/zinc/21/73/79/488217379.db2.gz YKWILNQHKUOIIL-LSDHHAIUSA-N 1 2 242.322 2.449 20 0 BEADLO Cc1cnc(C[NH2+][C@@H]2COCc3ccccc32)o1 ZINC000231640134 488218101 /nfs/dbraw/zinc/21/81/01/488218101.db2.gz IXEPYIUVIQOLEX-CYBMUJFWSA-N 1 2 244.294 2.344 20 0 BEADLO CC1(C[N@@H+]2CCN(c3ccccc3)C(=O)C2)CC1 ZINC000683838686 488230446 /nfs/dbraw/zinc/23/04/46/488230446.db2.gz SBWDSRBGAIDNKY-UHFFFAOYSA-N 1 2 244.338 2.135 20 0 BEADLO CC1(C[N@H+]2CCN(c3ccccc3)C(=O)C2)CC1 ZINC000683838686 488230448 /nfs/dbraw/zinc/23/04/48/488230448.db2.gz SBWDSRBGAIDNKY-UHFFFAOYSA-N 1 2 244.338 2.135 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2[nH]nc3ccccc32)[C@@H]1C ZINC000678267365 488231005 /nfs/dbraw/zinc/23/10/05/488231005.db2.gz PQBAHEAGJSFAIH-GHMZBOCLSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2[nH]nc3ccccc32)[C@@H]1C ZINC000678267365 488231008 /nfs/dbraw/zinc/23/10/08/488231008.db2.gz PQBAHEAGJSFAIH-GHMZBOCLSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2n[nH]c3ccccc32)[C@@H]1C ZINC000678267365 488231010 /nfs/dbraw/zinc/23/10/10/488231010.db2.gz PQBAHEAGJSFAIH-GHMZBOCLSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2n[nH]c3ccccc32)[C@@H]1C ZINC000678267365 488231013 /nfs/dbraw/zinc/23/10/13/488231013.db2.gz PQBAHEAGJSFAIH-GHMZBOCLSA-N 1 2 245.326 2.172 20 0 BEADLO CCCCNc1cc(N(C)C2CCC2)nc(N)[nH+]1 ZINC000672224401 488246413 /nfs/dbraw/zinc/24/64/13/488246413.db2.gz WHGUBZCFPIPWSM-UHFFFAOYSA-N 1 2 249.362 2.260 20 0 BEADLO CCCCNc1cc(N(C)C2CCC2)[nH+]c(N)n1 ZINC000672224401 488246414 /nfs/dbraw/zinc/24/64/14/488246414.db2.gz WHGUBZCFPIPWSM-UHFFFAOYSA-N 1 2 249.362 2.260 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CCC[C@@H]3C[C@@H]32)[nH+]1 ZINC000672322905 488251197 /nfs/dbraw/zinc/25/11/97/488251197.db2.gz QVNATEFHYZBWHX-KOLCDFICSA-N 1 2 228.299 2.255 20 0 BEADLO c1nc(N2CCC[C@H]3C[C@H]32)cc(NCC2CC2)[nH+]1 ZINC000672323773 488251592 /nfs/dbraw/zinc/25/15/92/488251592.db2.gz QRCMRUYXKBRHTE-NWDGAFQWSA-N 1 2 244.342 2.287 20 0 BEADLO c1nc(NCC2CC2)cc(N2CCC[C@H]3C[C@H]32)[nH+]1 ZINC000672323773 488251593 /nfs/dbraw/zinc/25/15/93/488251593.db2.gz QRCMRUYXKBRHTE-NWDGAFQWSA-N 1 2 244.342 2.287 20 0 BEADLO C[C@@H]1COCC[N@@H+]1Cc1cc2ccccc2[nH]1 ZINC000684024274 488256886 /nfs/dbraw/zinc/25/68/86/488256886.db2.gz QVWVYUAYWXLAPX-LLVKDONJSA-N 1 2 230.311 2.389 20 0 BEADLO C[C@@H]1COCC[N@H+]1Cc1cc2ccccc2[nH]1 ZINC000684024274 488256888 /nfs/dbraw/zinc/25/68/88/488256888.db2.gz QVWVYUAYWXLAPX-LLVKDONJSA-N 1 2 230.311 2.389 20 0 BEADLO C[C@@H]1C[C@H]1NC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000673081418 488276025 /nfs/dbraw/zinc/27/60/25/488276025.db2.gz ZFEWNTMVNCBTAL-MXWKQRLJSA-N 1 2 248.330 2.055 20 0 BEADLO Cc1cc(CN(C)c2cc[nH+]cc2F)no1 ZINC000678788065 488283166 /nfs/dbraw/zinc/28/31/66/488283166.db2.gz DDTKVCTUSFAKMM-UHFFFAOYSA-N 1 2 221.235 2.154 20 0 BEADLO C1=CC[N@H+](Cc2nc(C3CCCC3)no2)CC1 ZINC000679321634 488335874 /nfs/dbraw/zinc/33/58/74/488335874.db2.gz NVWOPAIVDAODAI-UHFFFAOYSA-N 1 2 233.315 2.489 20 0 BEADLO C1=CC[N@@H+](Cc2nc(C3CCCC3)no2)CC1 ZINC000679321634 488335876 /nfs/dbraw/zinc/33/58/76/488335876.db2.gz NVWOPAIVDAODAI-UHFFFAOYSA-N 1 2 233.315 2.489 20 0 BEADLO CC(C)n1ccnc1C[N@H+]1CC=CCC1 ZINC000679321940 488336006 /nfs/dbraw/zinc/33/60/06/488336006.db2.gz PBCXMURXKNCZGD-UHFFFAOYSA-N 1 2 205.305 2.226 20 0 BEADLO CC(C)n1ccnc1C[N@@H+]1CC=CCC1 ZINC000679321940 488336007 /nfs/dbraw/zinc/33/60/07/488336007.db2.gz PBCXMURXKNCZGD-UHFFFAOYSA-N 1 2 205.305 2.226 20 0 BEADLO FC(F)C[N@@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000673857209 488310229 /nfs/dbraw/zinc/31/02/29/488310229.db2.gz KORAWHBKLMPFTP-LLVKDONJSA-N 1 2 219.275 2.144 20 0 BEADLO FC(F)C[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000673857209 488310232 /nfs/dbraw/zinc/31/02/32/488310232.db2.gz KORAWHBKLMPFTP-LLVKDONJSA-N 1 2 219.275 2.144 20 0 BEADLO CCc1cc(N(C)C[C@H]2CCCC[C@H]2O)nc[nH+]1 ZINC000679197817 488316231 /nfs/dbraw/zinc/31/62/31/488316231.db2.gz UPNFWIGRFSGCNV-DGCLKSJQSA-N 1 2 249.358 2.026 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)cn1 ZINC000679217740 488317161 /nfs/dbraw/zinc/31/71/61/488317161.db2.gz AUEPIXRHKCZRFV-PWSUYJOCSA-N 1 2 238.306 2.270 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)cn1 ZINC000679217740 488317164 /nfs/dbraw/zinc/31/71/64/488317164.db2.gz AUEPIXRHKCZRFV-PWSUYJOCSA-N 1 2 238.306 2.270 20 0 BEADLO C1=CCN(c2cc[nH+]c(C3CC3)n2)CC1 ZINC000679279784 488328364 /nfs/dbraw/zinc/32/83/64/488328364.db2.gz ISRQSGVKQZPDEU-UHFFFAOYSA-N 1 2 201.273 2.120 20 0 BEADLO CC[C@](C)(OC)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000684574506 488328481 /nfs/dbraw/zinc/32/84/81/488328481.db2.gz CYIIFJBLNIBRCA-ZDUSSCGKSA-N 1 2 247.298 2.088 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CC=CCC2)[nH+]1 ZINC000679279991 488328617 /nfs/dbraw/zinc/32/86/17/488328617.db2.gz OSMOHAJEQWARLR-UHFFFAOYSA-N 1 2 214.272 2.033 20 0 BEADLO CCn1nccc1C[N@@H+]1CC[C@H](C)[C@H](F)C1 ZINC000679359478 488344951 /nfs/dbraw/zinc/34/49/51/488344951.db2.gz QEWXFFPTRJWYIU-CMPLNLGQSA-N 1 2 225.311 2.083 20 0 BEADLO C[C@@H]1CCC[C@@H]1CNC(=O)CCCn1cc[nH+]c1 ZINC000684945472 488354686 /nfs/dbraw/zinc/35/46/86/488354686.db2.gz FQNRLJJQWBBICJ-CHWSQXEVSA-N 1 2 249.358 2.216 20 0 BEADLO CO[C@H](C)CCC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000679845313 488368493 /nfs/dbraw/zinc/36/84/93/488368493.db2.gz RPZHSZGTOIGALS-SNVBAGLBSA-N 1 2 247.298 2.088 20 0 BEADLO C[C@@H]1CCCC[C@]1(C)NC(=O)CCc1c[nH+]c[nH]1 ZINC000457293241 490117250 /nfs/dbraw/zinc/11/72/50/490117250.db2.gz PVNMDLRMNYAHJL-RISCZKNCSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@@H]1CCCC[C@]1(C)NC(=O)CCc1c[nH]c[nH+]1 ZINC000457293241 490117256 /nfs/dbraw/zinc/11/72/56/490117256.db2.gz PVNMDLRMNYAHJL-RISCZKNCSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@@H](N[C@H](C)c1[nH+]ccn1C)c1nccs1 ZINC000070732297 490236646 /nfs/dbraw/zinc/23/66/46/490236646.db2.gz CFYQEMPSNRQLMA-RKDXNWHRSA-N 1 2 236.344 2.288 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1nccn1C)c1nccs1 ZINC000070732297 490236649 /nfs/dbraw/zinc/23/66/49/490236649.db2.gz CFYQEMPSNRQLMA-RKDXNWHRSA-N 1 2 236.344 2.288 20 0 BEADLO Cc1nc(C[N@H+]2C[C@@H](C)OC(C)(C)C2)oc1C ZINC000065281474 490251253 /nfs/dbraw/zinc/25/12/53/490251253.db2.gz PSSZFDPZFGNKGK-SECBINFHSA-N 1 2 238.331 2.291 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@@H](C)OC(C)(C)C2)oc1C ZINC000065281474 490251258 /nfs/dbraw/zinc/25/12/58/490251258.db2.gz PSSZFDPZFGNKGK-SECBINFHSA-N 1 2 238.331 2.291 20 0 BEADLO CC(C)c1ccc(C[N@@H+]2CCNC(=O)[C@H]2C)cc1 ZINC000075636928 490315681 /nfs/dbraw/zinc/31/56/81/490315681.db2.gz MRTZIUDWYFKJPB-GFCCVEGCSA-N 1 2 246.354 2.130 20 0 BEADLO CC(C)c1ccc(C[N@H+]2CCNC(=O)[C@H]2C)cc1 ZINC000075636928 490315685 /nfs/dbraw/zinc/31/56/85/490315685.db2.gz MRTZIUDWYFKJPB-GFCCVEGCSA-N 1 2 246.354 2.130 20 0 BEADLO C[C@H](NC(=O)CCc1c[nH+]c[nH]1)c1ccccc1 ZINC000074726840 490501398 /nfs/dbraw/zinc/50/13/98/490501398.db2.gz YXITWTXHZLRSQB-NSHDSACASA-N 1 2 243.310 2.220 20 0 BEADLO C[C@H](NC(=O)CCc1c[nH]c[nH+]1)c1ccccc1 ZINC000074726840 490501402 /nfs/dbraw/zinc/50/14/02/490501402.db2.gz YXITWTXHZLRSQB-NSHDSACASA-N 1 2 243.310 2.220 20 0 BEADLO Cn1ccnc1[C@H](Nc1cccc[nH+]1)C1CC1 ZINC000128132407 490572623 /nfs/dbraw/zinc/57/26/23/490572623.db2.gz QQBPIVNKNPSBCV-GFCCVEGCSA-N 1 2 228.299 2.378 20 0 BEADLO Cc1cnc(C[NH2+]Cc2cccc3c2OCO3)o1 ZINC000227083838 491054995 /nfs/dbraw/zinc/05/49/95/491054995.db2.gz CNVOOTVPOUOVFQ-UHFFFAOYSA-N 1 2 246.266 2.002 20 0 BEADLO CCC(C)(C)N(C)C(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000668898778 491060013 /nfs/dbraw/zinc/06/00/13/491060013.db2.gz BFRGNOQRYRBBBV-SNVBAGLBSA-N 1 2 249.358 2.162 20 0 BEADLO CCC(C)(C)N(C)C(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000668898778 491060014 /nfs/dbraw/zinc/06/00/14/491060014.db2.gz BFRGNOQRYRBBBV-SNVBAGLBSA-N 1 2 249.358 2.162 20 0 BEADLO c1n[nH]nc1C[N@@H+]1CCC[C@@H](C2CCC2)CC1 ZINC000640105674 491069180 /nfs/dbraw/zinc/06/91/80/491069180.db2.gz AGRCUNDOBHFNAQ-GFCCVEGCSA-N 1 2 234.347 2.207 20 0 BEADLO c1n[nH]nc1C[N@H+]1CCC[C@@H](C2CCC2)CC1 ZINC000640105674 491069182 /nfs/dbraw/zinc/06/91/82/491069182.db2.gz AGRCUNDOBHFNAQ-GFCCVEGCSA-N 1 2 234.347 2.207 20 0 BEADLO CCCC(C)(C)C(=O)N[C@H]1CCn2cc[nH+]c2C1 ZINC000651775963 491074826 /nfs/dbraw/zinc/07/48/26/491074826.db2.gz VHEBOGCDDIAVDT-NSHDSACASA-N 1 2 249.358 2.140 20 0 BEADLO c1n[nH]nc1C[N@@H+]1CCC[C@H](C2CCC2)CC1 ZINC000640105675 491069106 /nfs/dbraw/zinc/06/91/06/491069106.db2.gz AGRCUNDOBHFNAQ-LBPRGKRZSA-N 1 2 234.347 2.207 20 0 BEADLO c1n[nH]nc1C[N@H+]1CCC[C@H](C2CCC2)CC1 ZINC000640105675 491069107 /nfs/dbraw/zinc/06/91/07/491069107.db2.gz AGRCUNDOBHFNAQ-LBPRGKRZSA-N 1 2 234.347 2.207 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2cscn2)nc(C)n1 ZINC000671303044 491083320 /nfs/dbraw/zinc/08/33/20/491083320.db2.gz NSTYBEBQQCJQCO-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO CO[C@@H]1CCC[C@H]1Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000649457996 491089587 /nfs/dbraw/zinc/08/95/87/491089587.db2.gz SXDOTUPWQYAKBR-GHMZBOCLSA-N 1 2 246.314 2.246 20 0 BEADLO CC(C)CC(=O)N(C)Cc1cn2c([nH+]1)CCCC2 ZINC000365380264 491094873 /nfs/dbraw/zinc/09/48/73/491094873.db2.gz QXLVUSZJBVEANX-UHFFFAOYSA-N 1 2 249.358 2.224 20 0 BEADLO COC[C@@H](Nc1ccc(OC)c[nH+]1)C(C)C ZINC000225836252 491096961 /nfs/dbraw/zinc/09/69/61/491096961.db2.gz KXNRFDOZFFAHGQ-LLVKDONJSA-N 1 2 224.304 2.173 20 0 BEADLO c1cc(C[N@@H+]2CCOc3ccccc3C2)on1 ZINC000077233856 491116748 /nfs/dbraw/zinc/11/67/48/491116748.db2.gz SCAQSSIBZOCCLM-UHFFFAOYSA-N 1 2 230.267 2.069 20 0 BEADLO c1cc(C[N@H+]2CCOc3ccccc3C2)on1 ZINC000077233856 491116749 /nfs/dbraw/zinc/11/67/49/491116749.db2.gz SCAQSSIBZOCCLM-UHFFFAOYSA-N 1 2 230.267 2.069 20 0 BEADLO CCCc1nc(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)no1 ZINC000660931073 491117944 /nfs/dbraw/zinc/11/79/44/491117944.db2.gz PEMBQFUUODDANU-QWRGUYRKSA-N 1 2 235.331 2.397 20 0 BEADLO CCCc1nc(C[N@H+]2C[C@@H]3CCCC[C@@H]32)no1 ZINC000660931073 491117945 /nfs/dbraw/zinc/11/79/45/491117945.db2.gz PEMBQFUUODDANU-QWRGUYRKSA-N 1 2 235.331 2.397 20 0 BEADLO CCc1cc(NC(C)(C)CCOC)nc[nH+]1 ZINC000309928088 491158290 /nfs/dbraw/zinc/15/82/90/491158290.db2.gz WIQCHLIUEHTECC-UHFFFAOYSA-N 1 2 223.320 2.266 20 0 BEADLO C[C@@H]1C[C@H](C)[C@H](C)N(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493697464 533821760 /nfs/dbraw/zinc/82/17/60/533821760.db2.gz VIXCIVUXZRBQOU-GQJJHNKNSA-N 1 2 247.342 2.316 20 0 BEADLO C[C@@H]1CCC[C@H](C)N(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493862499 533822665 /nfs/dbraw/zinc/82/26/65/533822665.db2.gz YKKDRZUYJUVWGB-JIVBQCDMSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@@H]1CCN(CCCn2cc[nH+]c2)CC1(F)F ZINC000494278473 534032183 /nfs/dbraw/zinc/03/21/83/534032183.db2.gz ADCXHFQSYZYLNO-LLVKDONJSA-N 1 2 243.301 2.250 20 0 BEADLO C[C@@H]1CC[C@@H](C)N(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492774521 534141385 /nfs/dbraw/zinc/14/13/85/534141385.db2.gz WVJGQZXQIQYKLD-ADRPCIBZSA-N 1 2 233.315 2.070 20 0 BEADLO CCc1nocc1C[NH+]1CC2(CCC2(F)F)C1 ZINC000335896366 535904165 /nfs/dbraw/zinc/90/41/65/535904165.db2.gz MMNBCQMUKMKXOE-UHFFFAOYSA-N 1 2 242.269 2.468 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccc(OC)o2)C[C@H](C)O1 ZINC000891805164 582724371 /nfs/dbraw/zinc/72/43/71/582724371.db2.gz FBONXBLEIPRMMB-QWRGUYRKSA-N 1 2 239.315 2.288 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccc(OC)o2)C[C@H](C)O1 ZINC000891805164 582724370 /nfs/dbraw/zinc/72/43/70/582724370.db2.gz FBONXBLEIPRMMB-QWRGUYRKSA-N 1 2 239.315 2.288 20 0 BEADLO COc1ccc(C[N@@H+]2CCOC(C)(C)[C@@H]2C)o1 ZINC000892067921 582784698 /nfs/dbraw/zinc/78/46/98/582784698.db2.gz CMLVCFYJMIIGFF-JTQLQIEISA-N 1 2 239.315 2.288 20 0 BEADLO COc1ccc(C[N@H+]2CCOC(C)(C)[C@@H]2C)o1 ZINC000892067921 582784701 /nfs/dbraw/zinc/78/47/01/582784701.db2.gz CMLVCFYJMIIGFF-JTQLQIEISA-N 1 2 239.315 2.288 20 0 BEADLO Cc1nnc(CSc2[nH+]cc3ccccn32)[nH]1 ZINC000488216884 534403999 /nfs/dbraw/zinc/40/39/99/534403999.db2.gz NDEGMEFZBQBCIR-UHFFFAOYSA-N 1 2 245.311 2.053 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)/C=C/C1CCCC1 ZINC000493495922 534717946 /nfs/dbraw/zinc/71/79/46/534717946.db2.gz WBOZODWYFLNWTI-VOTSOKGWSA-N 1 2 233.315 2.081 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)Nc1ccc(F)c(F)c1 ZINC000493379214 534804664 /nfs/dbraw/zinc/80/46/64/534804664.db2.gz CUXLRHWBCPDPAP-RQOWECAXSA-N 1 2 249.220 2.340 20 0 BEADLO CC(=O)c1cccc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)c1 ZINC000336195999 534888751 /nfs/dbraw/zinc/88/87/51/534888751.db2.gz JWWLPSHBKWLIET-GASCZTMLSA-N 1 2 245.322 2.252 20 0 BEADLO CC(=O)c1cccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c1 ZINC000336195999 534888754 /nfs/dbraw/zinc/88/87/54/534888754.db2.gz JWWLPSHBKWLIET-GASCZTMLSA-N 1 2 245.322 2.252 20 0 BEADLO CC(C)c1nc(N2CCO[C@H](C3CC3)C2)cc[nH+]1 ZINC000375329970 534909348 /nfs/dbraw/zinc/90/93/48/534909348.db2.gz WYUHWRWWBBOXEW-LBPRGKRZSA-N 1 2 247.342 2.215 20 0 BEADLO CC(C)c1nc(N2CCC(=O)[C@@H](C)C2)cc[nH+]1 ZINC000302604794 534907344 /nfs/dbraw/zinc/90/73/44/534907344.db2.gz ZKWXJUGQROEIIV-JTQLQIEISA-N 1 2 233.315 2.015 20 0 BEADLO C/C=C/C=C/C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000493090148 527584283 /nfs/dbraw/zinc/58/42/83/527584283.db2.gz ULEZPLAEHICHGG-MOGOGANBSA-N 1 2 231.299 2.137 20 0 BEADLO CCC[C@@H]1C[C@H]1NC(=O)/C=C/c1[nH+]ccn1CC ZINC000493426654 527851252 /nfs/dbraw/zinc/85/12/52/527851252.db2.gz QHVCNVKVEXIXFR-BYAJROORSA-N 1 2 247.342 2.221 20 0 BEADLO CC(C)[C@H]1N(C(=O)/C=C/c2[nH]cc[nH+]2)CC1(C)C ZINC000493404531 527886959 /nfs/dbraw/zinc/88/69/59/527886959.db2.gz WDSKALMPACPMQS-URWSZGRFSA-N 1 2 247.342 2.316 20 0 BEADLO CC1(CNC(=O)/C=C/c2[nH]cc[nH+]2)CCCC1 ZINC000493629472 527932838 /nfs/dbraw/zinc/93/28/38/527932838.db2.gz YNAZSMOYHOYIKB-SNAWJCMRSA-N 1 2 233.315 2.119 20 0 BEADLO CC1(CNC(=O)C=Cc2c[nH]c[nH+]2)CCCC1 ZINC000493266275 527933659 /nfs/dbraw/zinc/93/36/59/527933659.db2.gz WIPVFWYLBKYIQZ-PLNGDYQASA-N 1 2 233.315 2.119 20 0 BEADLO CCCN(CCC)C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493600755 528033553 /nfs/dbraw/zinc/03/35/53/528033553.db2.gz YPDGUXZPUNBBSG-AATRIKPKSA-N 1 2 221.304 2.072 20 0 BEADLO CC1CCC(CNC(=O)/C=C/c2[nH]cc[nH+]2)CC1 ZINC000493807535 528178879 /nfs/dbraw/zinc/17/88/79/528178879.db2.gz DOLLNAMTMNSDSF-VOTSOKGWSA-N 1 2 247.342 2.365 20 0 BEADLO CC(C)C[C@@H](C)OC(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000496374535 528269230 /nfs/dbraw/zinc/26/92/30/528269230.db2.gz LLNYJJWDBDUXPG-SNVBAGLBSA-N 1 2 239.319 2.413 20 0 BEADLO CC(C)C[C@@H](C)OC(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000496374535 528269233 /nfs/dbraw/zinc/26/92/33/528269233.db2.gz LLNYJJWDBDUXPG-SNVBAGLBSA-N 1 2 239.319 2.413 20 0 BEADLO CCCCN(C)C(=O)/C=C\c1[nH+]ccn1CC ZINC000493075609 528316040 /nfs/dbraw/zinc/31/60/40/528316040.db2.gz WNTRKTWBOFVKFF-FPLPWBNLSA-N 1 2 235.331 2.175 20 0 BEADLO CC(C)N(CC1CCC1)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493666303 528872117 /nfs/dbraw/zinc/87/21/17/528872117.db2.gz VMMDKEYIXWORJB-SREVYHEPSA-N 1 2 247.342 2.460 20 0 BEADLO CCCC[C@H](C)N(C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493818337 528887129 /nfs/dbraw/zinc/88/71/29/528887129.db2.gz SNNNHVIEJYIRHW-TVRMLOFPSA-N 1 2 235.331 2.460 20 0 BEADLO CC1(C)CCCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492864746 528910211 /nfs/dbraw/zinc/91/02/11/528910211.db2.gz NZOPUOBKOIJLII-WAYWQWQTSA-N 1 2 247.342 2.462 20 0 BEADLO CCN(C(=O)/C=C\c1[nH+]ccn1CC)C(C)C ZINC000492494870 528911482 /nfs/dbraw/zinc/91/14/82/528911482.db2.gz SYILJMNKPWUVIC-FPLPWBNLSA-N 1 2 235.331 2.173 20 0 BEADLO CC[C@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000492768281 529211865 /nfs/dbraw/zinc/21/18/65/529211865.db2.gz OVDUTWWGMBIFIR-FJOGCWAESA-N 1 2 247.342 2.462 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493325675 529336158 /nfs/dbraw/zinc/33/61/58/529336158.db2.gz RWUYCGBCLBXNFF-AFPRHGJPSA-N 1 2 233.315 2.212 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CCO[C@@H]3CCC[C@H]32)cn1 ZINC000334346764 535060058 /nfs/dbraw/zinc/06/00/58/535060058.db2.gz WJFPRNGQDWIMFE-ZIAGYGMSSA-N 1 2 249.358 2.217 20 0 BEADLO CC(C)n1cc(C[N@H+]2CCO[C@@H]3CCC[C@H]32)cn1 ZINC000334346764 535060062 /nfs/dbraw/zinc/06/00/62/535060062.db2.gz WJFPRNGQDWIMFE-ZIAGYGMSSA-N 1 2 249.358 2.217 20 0 BEADLO CC(C)C[N@@H+]1CC(=O)N[C@]12CC[C@@H](C)[C@@H](C)C2 ZINC000342444543 535066179 /nfs/dbraw/zinc/06/61/79/535066179.db2.gz CLYLHERAHOUFEI-MBNYWOFBSA-N 1 2 238.375 2.227 20 0 BEADLO CC(C)C[N@H+]1CC(=O)N[C@]12CC[C@@H](C)[C@@H](C)C2 ZINC000342444543 535066180 /nfs/dbraw/zinc/06/61/80/535066180.db2.gz CLYLHERAHOUFEI-MBNYWOFBSA-N 1 2 238.375 2.227 20 0 BEADLO CC(C)n1cncc1C[NH2+]Cc1nccs1 ZINC000085188199 535105559 /nfs/dbraw/zinc/10/55/59/535105559.db2.gz PLTKFMXNSRHXMG-UHFFFAOYSA-N 1 2 236.344 2.210 20 0 BEADLO CCC(=O)N(Cc1[nH]cc[nH+]1)c1cccc(F)c1 ZINC000352272805 535295723 /nfs/dbraw/zinc/29/57/23/535295723.db2.gz FMTMWEYCSDYHAY-UHFFFAOYSA-N 1 2 247.273 2.492 20 0 BEADLO CCN(CC)C(=O)c1ccc2[nH+]c(C)n(C)c2c1 ZINC000336064289 535481475 /nfs/dbraw/zinc/48/14/75/535481475.db2.gz NRJHJALNDLGASW-UHFFFAOYSA-N 1 2 245.326 2.364 20 0 BEADLO CC[C@](C)(OC)c1noc(C[N@H+](C)C(C)C)n1 ZINC000350446454 535866647 /nfs/dbraw/zinc/86/66/47/535866647.db2.gz XIRKSAMXLFCMKD-LBPRGKRZSA-N 1 2 241.335 2.181 20 0 BEADLO CC[C@](C)(OC)c1noc(C[N@@H+](C)C(C)C)n1 ZINC000350446454 535866650 /nfs/dbraw/zinc/86/66/50/535866650.db2.gz XIRKSAMXLFCMKD-LBPRGKRZSA-N 1 2 241.335 2.181 20 0 BEADLO CC[C@H](NC(=O)c1ccc(F)cc1)c1[nH]cc[nH+]1 ZINC000139426974 535875195 /nfs/dbraw/zinc/87/51/95/535875195.db2.gz CIOXOJQDDJEVCL-NSHDSACASA-N 1 2 247.273 2.430 20 0 BEADLO C[NH+](C)Cc1nc(CCC(C)(C)C)no1 ZINC000349773949 536063045 /nfs/dbraw/zinc/06/30/45/536063045.db2.gz ZSFFNSLTCILRAA-UHFFFAOYSA-N 1 2 211.309 2.110 20 0 BEADLO CC[C@H]1C[N@@H+]([C@@H](C)c2noc(C)n2)CCS1 ZINC000336122201 536158310 /nfs/dbraw/zinc/15/83/10/536158310.db2.gz VRRJMRGSSLTQFP-WPRPVWTQSA-N 1 2 241.360 2.266 20 0 BEADLO CC[C@H]1C[N@H+]([C@@H](C)c2noc(C)n2)CCS1 ZINC000336122201 536158312 /nfs/dbraw/zinc/15/83/12/536158312.db2.gz VRRJMRGSSLTQFP-WPRPVWTQSA-N 1 2 241.360 2.266 20 0 BEADLO COC[C@@H]1CCCN(c2nc(C)[nH+]c(C)c2C)C1 ZINC000301666849 536765985 /nfs/dbraw/zinc/76/59/85/536765985.db2.gz CKJGPBLKPKXMLV-CYBMUJFWSA-N 1 2 249.358 2.265 20 0 BEADLO CCCCC(=O)O[C@H]1CCn2c(C)c[nH+]c21 ZINC000893520084 583156118 /nfs/dbraw/zinc/15/61/18/583156118.db2.gz VOOLMOXUEKCBNZ-JTQLQIEISA-N 1 2 222.288 2.370 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+]2CCCO[C@H](C)C2)n1 ZINC000893994691 583266975 /nfs/dbraw/zinc/26/69/75/583266975.db2.gz DBAMJVRHQJNZLX-LLVKDONJSA-N 1 2 237.347 2.144 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+]2CCCO[C@H](C)C2)n1 ZINC000893994691 583266978 /nfs/dbraw/zinc/26/69/78/583266978.db2.gz DBAMJVRHQJNZLX-LLVKDONJSA-N 1 2 237.347 2.144 20 0 BEADLO CC[C@](C)(CNc1cccc([C@@H](C)O)[nH+]1)OC ZINC000894053120 583289929 /nfs/dbraw/zinc/28/99/29/583289929.db2.gz INIVBOCWYWWJHP-ZWNOBZJWSA-N 1 2 238.331 2.362 20 0 BEADLO Fc1cc(N2CCCC[C@@H]2c2[nH]cc[nH+]2)ncn1 ZINC000853411625 588741611 /nfs/dbraw/zinc/74/16/11/588741611.db2.gz PEPCAJFVPXQKBK-SECBINFHSA-N 1 2 247.277 2.070 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OCCC1(O)CCC1 ZINC000853636366 588751342 /nfs/dbraw/zinc/75/13/42/588751342.db2.gz CHIHAEZDUBODCV-UHFFFAOYSA-N 1 2 248.326 2.147 20 0 BEADLO CC(C)c1nc(N2C[C@@H](C)[C@H]2C)cc[nH+]1 ZINC000853650806 588752187 /nfs/dbraw/zinc/75/21/87/588752187.db2.gz WSRKHRVEPBDUAK-NXEZZACHSA-N 1 2 205.305 2.445 20 0 BEADLO CC(C)c1nc(N2CC[C@@H]2C(F)F)cc[nH+]1 ZINC000853650994 588752278 /nfs/dbraw/zinc/75/22/78/588752278.db2.gz ZDDKYSGVGVHJKK-MRVPVSSYSA-N 1 2 227.258 2.444 20 0 BEADLO CC1=NO[C@@H](CNc2cc[nH+]c(C(C)(C)C)n2)C1 ZINC000853661440 588753538 /nfs/dbraw/zinc/75/35/38/588753538.db2.gz VRDHAQGYEBQZLH-SNVBAGLBSA-N 1 2 248.330 2.351 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)Nc1cc(F)ncn1 ZINC000853667875 588754021 /nfs/dbraw/zinc/75/40/21/588754021.db2.gz DGCVHRUVYXXPQO-MRVPVSSYSA-N 1 2 235.266 2.005 20 0 BEADLO NC(Cc1cccnc1)=[NH+]OC[C@@H]1C[C@H]2C[C@H]2C1 ZINC000853678837 588755141 /nfs/dbraw/zinc/75/51/41/588755141.db2.gz NJZTYEGVMFOFSJ-CLLJXQQHSA-N 1 2 245.326 2.169 20 0 BEADLO CC(C)(C)OCC(N)=[NH+]OC[C@@H]1C[C@H]2C[C@H]2C1 ZINC000853689230 588756453 /nfs/dbraw/zinc/75/64/53/588756453.db2.gz ZWOFPCWIMAJHTI-JGPRNRPPSA-N 1 2 240.347 2.346 20 0 BEADLO Cc1cc(N[C@@H]2C[C@H](O)c3ccccc32)nc[nH+]1 ZINC000853836655 588765411 /nfs/dbraw/zinc/76/54/11/588765411.db2.gz DAULWUDOSISENE-OLZOCXBDSA-N 1 2 241.294 2.375 20 0 BEADLO Cc1cc(N[C@H]2C[C@@H](O)c3ccccc32)nc[nH+]1 ZINC000853836657 588765601 /nfs/dbraw/zinc/76/56/01/588765601.db2.gz DAULWUDOSISENE-QWHCGFSZSA-N 1 2 241.294 2.375 20 0 BEADLO CC(C)c1nc(N[C@H]2C[C@H](O)C23CCC3)cc[nH+]1 ZINC000853870249 588766680 /nfs/dbraw/zinc/76/66/80/588766680.db2.gz JLWLTAVRYJEEDW-QWRGUYRKSA-N 1 2 247.342 2.315 20 0 BEADLO CC[C@H]1CCCC[C@@H]1CNC(=O)Cc1[nH]cc[nH+]1 ZINC000854741178 588804847 /nfs/dbraw/zinc/80/48/47/588804847.db2.gz KEAYUZRFSQKQOM-NWDGAFQWSA-N 1 2 249.358 2.285 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)C=C1CCCCC1 ZINC000855134356 588822929 /nfs/dbraw/zinc/82/29/29/588822929.db2.gz LMGMIUVPYJZRCJ-UHFFFAOYSA-N 1 2 233.315 2.259 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)C=C1CCCCC1 ZINC000855134356 588822930 /nfs/dbraw/zinc/82/29/30/588822930.db2.gz LMGMIUVPYJZRCJ-UHFFFAOYSA-N 1 2 233.315 2.259 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)/C=C/C1CCCC1 ZINC000855135633 588823195 /nfs/dbraw/zinc/82/31/95/588823195.db2.gz RDROHMYPVMAOIF-VOTSOKGWSA-N 1 2 233.315 2.115 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)/C=C/C1CCCC1 ZINC000855135633 588823196 /nfs/dbraw/zinc/82/31/96/588823196.db2.gz RDROHMYPVMAOIF-VOTSOKGWSA-N 1 2 233.315 2.115 20 0 BEADLO CC/C(C)=C(\C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000855136712 588823260 /nfs/dbraw/zinc/82/32/60/588823260.db2.gz RKJYCELVWJFUNH-MDZDMXLPSA-N 1 2 221.304 2.115 20 0 BEADLO CC/C(C)=C(\C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000855136712 588823261 /nfs/dbraw/zinc/82/32/61/588823261.db2.gz RKJYCELVWJFUNH-MDZDMXLPSA-N 1 2 221.304 2.115 20 0 BEADLO CCCCCCNC(=O)CCc1c[nH+]c[nH]1 ZINC000138977724 582594740 /nfs/dbraw/zinc/59/47/40/582594740.db2.gz VITRJQMITFDYFZ-UHFFFAOYSA-N 1 2 223.320 2.039 20 0 BEADLO CCCCCCNC(=O)CCc1c[nH]c[nH+]1 ZINC000138977724 582594742 /nfs/dbraw/zinc/59/47/42/582594742.db2.gz VITRJQMITFDYFZ-UHFFFAOYSA-N 1 2 223.320 2.039 20 0 BEADLO CCc1cc(NCCCOC)nc(CC)[nH+]1 ZINC000891408907 582679528 /nfs/dbraw/zinc/67/95/28/582679528.db2.gz DDIIMESKOWDXOM-UHFFFAOYSA-N 1 2 223.320 2.050 20 0 BEADLO CC[C@@H](CO)Nc1ccc(-c2ccncc2)c[nH+]1 ZINC000891413630 582680840 /nfs/dbraw/zinc/68/08/40/582680840.db2.gz YMVRJBKQSVOFMM-ZDUSSCGKSA-N 1 2 243.310 2.326 20 0 BEADLO COCC[N@H+](C)Cc1c(Cl)n[nH]c1C1CC1 ZINC000891574964 582698576 /nfs/dbraw/zinc/69/85/76/582698576.db2.gz VQRPRWRCRFCNGB-UHFFFAOYSA-N 1 2 243.738 2.019 20 0 BEADLO COCC[N@@H+](C)Cc1c(Cl)n[nH]c1C1CC1 ZINC000891574964 582698577 /nfs/dbraw/zinc/69/85/77/582698577.db2.gz VQRPRWRCRFCNGB-UHFFFAOYSA-N 1 2 243.738 2.019 20 0 BEADLO CCC[C@@H](C)Nc1cc(N(C)C)nc[nH+]1 ZINC000891667874 582707915 /nfs/dbraw/zinc/70/79/15/582707915.db2.gz JHNPWOXTFWUTMY-SECBINFHSA-N 1 2 208.309 2.143 20 0 BEADLO CCC[C@@H](C)Nc1cc(N(C)C)[nH+]cn1 ZINC000891667874 582707916 /nfs/dbraw/zinc/70/79/16/582707916.db2.gz JHNPWOXTFWUTMY-SECBINFHSA-N 1 2 208.309 2.143 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccnn2C2CCC2)[C@@H](C)CO1 ZINC000891669239 582708648 /nfs/dbraw/zinc/70/86/48/582708648.db2.gz AQRNTASXVNPYCQ-RYUDHWBXSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccnn2C2CCC2)[C@@H](C)CO1 ZINC000891669239 582708649 /nfs/dbraw/zinc/70/86/49/582708649.db2.gz AQRNTASXVNPYCQ-RYUDHWBXSA-N 1 2 249.358 2.217 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1ccnn1C1CCC1 ZINC000891715296 582712063 /nfs/dbraw/zinc/71/20/63/582712063.db2.gz CILOWSBFRKNTFC-GFCCVEGCSA-N 1 2 249.358 2.219 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1ccnn1C1CCC1 ZINC000891715296 582712065 /nfs/dbraw/zinc/71/20/65/582712065.db2.gz CILOWSBFRKNTFC-GFCCVEGCSA-N 1 2 249.358 2.219 20 0 BEADLO CC[N@@H+](Cc1nccn1C1CC1)C[C@H]1CCCO1 ZINC000891783394 582720545 /nfs/dbraw/zinc/72/05/45/582720545.db2.gz GBGUWMQDPGLOPQ-CYBMUJFWSA-N 1 2 249.358 2.219 20 0 BEADLO CC[N@H+](Cc1nccn1C1CC1)C[C@H]1CCCO1 ZINC000891783394 582720548 /nfs/dbraw/zinc/72/05/48/582720548.db2.gz GBGUWMQDPGLOPQ-CYBMUJFWSA-N 1 2 249.358 2.219 20 0 BEADLO CCc1cc(NC[C@@H](C)COC)nc(CC)[nH+]1 ZINC000892025423 582765167 /nfs/dbraw/zinc/76/51/67/582765167.db2.gz SAOJMPHDAVWWMB-SNVBAGLBSA-N 1 2 237.347 2.296 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2C[C@@H]2[C@@H]2C[C@@H]2C)c(C)c[nH+]1 ZINC000866860621 582766032 /nfs/dbraw/zinc/76/60/32/582766032.db2.gz ZGKAKYARTWEEEF-BXGBBSSXSA-N 1 2 244.338 2.351 20 0 BEADLO Cc1cc(F)ncc1C[N@H+]1CCO[C@H](C)[C@@H]1C ZINC000892049499 582773808 /nfs/dbraw/zinc/77/38/08/582773808.db2.gz QZBWVDLKIBBEEL-WDEREUQCSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1cc(F)ncc1C[N@@H+]1CCO[C@H](C)[C@@H]1C ZINC000892049499 582773809 /nfs/dbraw/zinc/77/38/09/582773809.db2.gz QZBWVDLKIBBEEL-WDEREUQCSA-N 1 2 238.306 2.138 20 0 BEADLO CCC[C@H]1CN(Cc2[nH+]ccn2C2CC2)CCO1 ZINC000892068467 582784153 /nfs/dbraw/zinc/78/41/53/582784153.db2.gz OSWZORDUIRCPHV-ZDUSSCGKSA-N 1 2 249.358 2.219 20 0 BEADLO CCC[C@@H]1CN(Cc2[nH+]ccn2C2CC2)CCO1 ZINC000892068466 582784463 /nfs/dbraw/zinc/78/44/63/582784463.db2.gz OSWZORDUIRCPHV-CYBMUJFWSA-N 1 2 249.358 2.219 20 0 BEADLO CCCCC1(NC(=O)CCc2c[nH+]cn2C)CC1 ZINC000889528734 582821047 /nfs/dbraw/zinc/82/10/47/582821047.db2.gz WSNJTYOZNBISOQ-UHFFFAOYSA-N 1 2 249.358 2.192 20 0 BEADLO O=C(Cc1cn2ccccc2[nH+]1)O[C@H]1C=CCC1 ZINC000780553734 582833873 /nfs/dbraw/zinc/83/38/73/582833873.db2.gz ZQLLVERXTFLOKI-LBPRGKRZSA-N 1 2 242.278 2.139 20 0 BEADLO Cc1cc(NCC(C)(C)O)nc(C2CCC2)[nH+]1 ZINC000892308625 582834517 /nfs/dbraw/zinc/83/45/17/582834517.db2.gz SEQRPTRIWJYWPD-UHFFFAOYSA-N 1 2 235.331 2.235 20 0 BEADLO C[C@@H]1CCC[C@H]1Nc1cc(N(C)C)nc[nH+]1 ZINC000892341665 582861530 /nfs/dbraw/zinc/86/15/30/582861530.db2.gz DFKQYGBMYARQCB-NXEZZACHSA-N 1 2 220.320 2.143 20 0 BEADLO C[C@@H]1CCC[C@H]1Nc1cc(N(C)C)[nH+]cn1 ZINC000892341665 582861531 /nfs/dbraw/zinc/86/15/31/582861531.db2.gz DFKQYGBMYARQCB-NXEZZACHSA-N 1 2 220.320 2.143 20 0 BEADLO C[C@H](CCO)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000892341686 582861775 /nfs/dbraw/zinc/86/17/75/582861775.db2.gz ZPGCNWWAFBVYFG-LLVKDONJSA-N 1 2 245.326 2.270 20 0 BEADLO Cc1nnc(C[N@H+]2CC[C@@H]2C(C)C)s1 ZINC000892403720 582877811 /nfs/dbraw/zinc/87/78/11/582877811.db2.gz RHLBBDYEARWTGN-SECBINFHSA-N 1 2 211.334 2.077 20 0 BEADLO Cc1nnc(C[N@@H+]2CC[C@@H]2C(C)C)s1 ZINC000892403720 582877813 /nfs/dbraw/zinc/87/78/13/582877813.db2.gz RHLBBDYEARWTGN-SECBINFHSA-N 1 2 211.334 2.077 20 0 BEADLO COc1ccc(C[NH2+]Cc2nc(C)cs2)o1 ZINC000892532501 582906953 /nfs/dbraw/zinc/90/69/53/582906953.db2.gz CWRAYQUKRFRFEI-UHFFFAOYSA-N 1 2 238.312 2.343 20 0 BEADLO CCc1cc(N2CCOC[C@H]2CC)nc(CC)[nH+]1 ZINC000892560687 582914391 /nfs/dbraw/zinc/91/43/91/582914391.db2.gz YLNXIFRRFQHRSL-GFCCVEGCSA-N 1 2 249.358 2.217 20 0 BEADLO CSCCCCNc1cc(N(C)C)nc[nH+]1 ZINC000892605097 582927644 /nfs/dbraw/zinc/92/76/44/582927644.db2.gz ZHGUTTCRIJGHOX-UHFFFAOYSA-N 1 2 240.376 2.098 20 0 BEADLO CSCCCCNc1cc(N(C)C)[nH+]cn1 ZINC000892605097 582927646 /nfs/dbraw/zinc/92/76/46/582927646.db2.gz ZHGUTTCRIJGHOX-UHFFFAOYSA-N 1 2 240.376 2.098 20 0 BEADLO COc1ccc2ccc(N[C@H](C)CCO)[nH+]c2c1 ZINC000892615392 582930420 /nfs/dbraw/zinc/93/04/20/582930420.db2.gz CFKSDZJNCIEPHI-SNVBAGLBSA-N 1 2 246.310 2.426 20 0 BEADLO Cc1cc(N[C@H](C)CCO)nc(C2CCC2)[nH+]1 ZINC000892617107 582931174 /nfs/dbraw/zinc/93/11/74/582931174.db2.gz RLRYUDRZSHMJIB-SECBINFHSA-N 1 2 235.331 2.235 20 0 BEADLO c1cn(C2CC2)c(CNc2cccc[nH+]2)n1 ZINC000892638239 582935601 /nfs/dbraw/zinc/93/56/01/582935601.db2.gz ZOYLBBKMVFIDCF-UHFFFAOYSA-N 1 2 214.272 2.225 20 0 BEADLO Cn1ncc(C[NH2+]Cc2nccs2)c1C1CC1 ZINC000892641015 582935975 /nfs/dbraw/zinc/93/59/75/582935975.db2.gz OMPVKHXMEQHZMW-UHFFFAOYSA-N 1 2 248.355 2.044 20 0 BEADLO CCc1cc(NC[C@@H]2CCC[C@H]2O)nc(CC)[nH+]1 ZINC000892702754 582960770 /nfs/dbraw/zinc/96/07/70/582960770.db2.gz CEOHJXOCBMXCRF-CMPLNLGQSA-N 1 2 249.358 2.174 20 0 BEADLO c1[nH+]cn2ccnc(N3CCC4(CCCC4)C3)c12 ZINC000892723087 582969679 /nfs/dbraw/zinc/96/96/79/582969679.db2.gz ZFRLATNNYHKUMI-UHFFFAOYSA-N 1 2 242.326 2.500 20 0 BEADLO CC[C@@H]1CN(c2nccn3c[nH+]cc23)CCS1 ZINC000892734336 582971836 /nfs/dbraw/zinc/97/18/36/582971836.db2.gz WVNQMMTVCKUVEF-SNVBAGLBSA-N 1 2 248.355 2.061 20 0 BEADLO C[C@@H](O)c1cccc(N[C@H]2CCCSC2)[nH+]1 ZINC000892814522 582988050 /nfs/dbraw/zinc/98/80/50/582988050.db2.gz ZRFZHYFQILAQAF-ZJUUUORDSA-N 1 2 238.356 2.442 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@](C)(F)C2)nc(C)n1 ZINC000852096588 583001011 /nfs/dbraw/zinc/00/10/11/583001011.db2.gz MKBWGCHQSKOLCC-ZDUSSCGKSA-N 1 2 237.322 2.417 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@](C)(F)C2)nc(C)n1 ZINC000852096588 583001012 /nfs/dbraw/zinc/00/10/12/583001012.db2.gz MKBWGCHQSKOLCC-ZDUSSCGKSA-N 1 2 237.322 2.417 20 0 BEADLO CCc1cc(N[C@@H](C)CCCO)nc(CC)[nH+]1 ZINC000892884325 583005134 /nfs/dbraw/zinc/00/51/34/583005134.db2.gz XPDRXGXRNKTDTJ-JTQLQIEISA-N 1 2 237.347 2.174 20 0 BEADLO C[C@@H]1CC[C@H](C)N1c1nccn2c[nH+]cc12 ZINC000892899450 583007060 /nfs/dbraw/zinc/00/70/60/583007060.db2.gz LYYJWBMYJIGXKJ-AOOOYVTPSA-N 1 2 216.288 2.107 20 0 BEADLO CCc1cc(N[C@](C)(CO)C2CC2)nc(CC)[nH+]1 ZINC000892923270 583010010 /nfs/dbraw/zinc/01/00/10/583010010.db2.gz WHZFQPSZIYDHCU-CQSZACIVSA-N 1 2 249.358 2.174 20 0 BEADLO C[C@@H](O)c1cccc(NCCc2ccncc2)[nH+]1 ZINC000892930107 583011309 /nfs/dbraw/zinc/01/13/09/583011309.db2.gz RJIDUGCYWNBRAP-LLVKDONJSA-N 1 2 243.310 2.185 20 0 BEADLO COc1ccc2ccc(N[C@H]3CCOC3)[nH+]c2c1 ZINC000892954459 583019109 /nfs/dbraw/zinc/01/91/09/583019109.db2.gz YYBCXBJJVZGEBI-NSHDSACASA-N 1 2 244.294 2.444 20 0 BEADLO CCc1cc(N[C@H]2CC[C@H](O)CC2)nc(CC)[nH+]1 ZINC000892959577 583020603 /nfs/dbraw/zinc/02/06/03/583020603.db2.gz MKARDHHABSGTGS-HAQNSBGRSA-N 1 2 249.358 2.317 20 0 BEADLO C[C@@H]1CCN(c2nccn3c[nH+]cc23)C[C@@H]1C ZINC000893055414 583038349 /nfs/dbraw/zinc/03/83/49/583038349.db2.gz CHWBWVPWGMISTO-MNOVXSKESA-N 1 2 230.315 2.212 20 0 BEADLO COC1(CNc2cccc([C@H](C)O)[nH+]2)CCC1 ZINC000893108258 583050354 /nfs/dbraw/zinc/05/03/54/583050354.db2.gz NAEYSCPXFJNPOW-JTQLQIEISA-N 1 2 236.315 2.116 20 0 BEADLO COc1ccc(C[NH2+]Cc2cccc(F)n2)o1 ZINC000893202973 583070522 /nfs/dbraw/zinc/07/05/22/583070522.db2.gz PNMNHHVSLUTUFI-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO CCc1nc(N(CC)[C@H]2CCCOC2)cc(C)[nH+]1 ZINC000651415590 583086172 /nfs/dbraw/zinc/08/61/72/583086172.db2.gz IRZFJUNWYREJLK-LBPRGKRZSA-N 1 2 249.358 2.353 20 0 BEADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1cnccn1 ZINC000856788985 588877889 /nfs/dbraw/zinc/87/78/89/588877889.db2.gz XXHJOKRENFSGCH-UHFFFAOYSA-N 1 2 246.314 2.106 20 0 BEADLO C[C@@H](O)c1cccc(NC[C@@H]2CCC=CO2)[nH+]1 ZINC000893367745 583127054 /nfs/dbraw/zinc/12/70/54/583127054.db2.gz LUEWWYNZJNYFKW-MNOVXSKESA-N 1 2 234.299 2.240 20 0 BEADLO CC(C)[C@H]1CN(Cc2[nH+]ccn2C2CC2)CCO1 ZINC000893403097 583137540 /nfs/dbraw/zinc/13/75/40/583137540.db2.gz QLRTYJXRPLWNKN-CYBMUJFWSA-N 1 2 249.358 2.075 20 0 BEADLO FC1=CCCN(Cc2[nH+]ccn2C2CC2)C1 ZINC000893436603 583142975 /nfs/dbraw/zinc/14/29/75/583142975.db2.gz KVMSAKQDNBPSGG-UHFFFAOYSA-N 1 2 221.279 2.277 20 0 BEADLO Cc1c[nH+]c2n1CC[C@H]2OC(=O)CC(C)C ZINC000893516186 583155827 /nfs/dbraw/zinc/15/58/27/583155827.db2.gz JHDMNQKRYZIOJF-SNVBAGLBSA-N 1 2 222.288 2.226 20 0 BEADLO Cc1ccoc1C(=O)O[C@H]1CCn2c(C)c[nH+]c21 ZINC000893518215 583156040 /nfs/dbraw/zinc/15/60/40/583156040.db2.gz JQVXATBPJVPUJY-JTQLQIEISA-N 1 2 246.266 2.395 20 0 BEADLO CC[C@@H](C)C(=O)O[C@H]1CCn2c(C)c[nH+]c21 ZINC000893519453 583156152 /nfs/dbraw/zinc/15/61/52/583156152.db2.gz QALUUQNSDOEYCW-SCZZXKLOSA-N 1 2 222.288 2.226 20 0 BEADLO Cc1cc(CN2CC(F)C2)c2c([nH+]1)CCCC2 ZINC000893521643 583156636 /nfs/dbraw/zinc/15/66/36/583156636.db2.gz GHCHJTGKWPMHBZ-UHFFFAOYSA-N 1 2 234.318 2.423 20 0 BEADLO Cc1c[nH+]c2n1CC[C@@H]2OC(=O)[C@H]1CC1(C)C ZINC000893524346 583157433 /nfs/dbraw/zinc/15/74/33/583157433.db2.gz IZEDKRUSZOWHRG-ZJUUUORDSA-N 1 2 234.299 2.226 20 0 BEADLO CS/C=C\C(=O)O[C@@H]1CCn2c(C)c[nH+]c21 ZINC000893524756 583157471 /nfs/dbraw/zinc/15/74/71/583157471.db2.gz LHGLDIPCJBPSFL-XTULLQBASA-N 1 2 238.312 2.056 20 0 BEADLO Cc1ccc(C[NH+]2CC(CC(F)(F)F)C2)nn1 ZINC000840952482 583178816 /nfs/dbraw/zinc/17/88/16/583178816.db2.gz AVDDLWPPRCADJT-UHFFFAOYSA-N 1 2 245.248 2.169 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cn(C)nc2Cl)CCS1 ZINC000857015622 588882154 /nfs/dbraw/zinc/88/21/54/588882154.db2.gz DHKSWDRXDCPTMY-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cn(C)nc2Cl)CCS1 ZINC000857015622 588882155 /nfs/dbraw/zinc/88/21/55/588882155.db2.gz DHKSWDRXDCPTMY-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)Cc1nccnc1C ZINC000857018847 588882571 /nfs/dbraw/zinc/88/25/71/588882571.db2.gz VYNIZHWIAOWIBO-UHFFFAOYSA-N 1 2 246.314 2.022 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)Cc1nccnc1C ZINC000857018847 588882572 /nfs/dbraw/zinc/88/25/72/588882572.db2.gz VYNIZHWIAOWIBO-UHFFFAOYSA-N 1 2 246.314 2.022 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cn(C)nc2Cl)C[C@@H]1F ZINC000857035766 588882986 /nfs/dbraw/zinc/88/29/86/588882986.db2.gz BIKAZCPMCJYEIR-SCZZXKLOSA-N 1 2 245.729 2.253 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cn(C)nc2Cl)C[C@@H]1F ZINC000857035766 588882987 /nfs/dbraw/zinc/88/29/87/588882987.db2.gz BIKAZCPMCJYEIR-SCZZXKLOSA-N 1 2 245.729 2.253 20 0 BEADLO C[C@@H](O)c1cccc(N[C@H]2CSC2(C)C)[nH+]1 ZINC000893728809 583215646 /nfs/dbraw/zinc/21/56/46/583215646.db2.gz WEIGOUZUXJXPAS-SCZZXKLOSA-N 1 2 238.356 2.441 20 0 BEADLO CN(C)c1cc(N2CCC3(CCC3)CC2)nc[nH+]1 ZINC000893836747 583228874 /nfs/dbraw/zinc/22/88/74/583228874.db2.gz UVOPRPPLEOBBAF-UHFFFAOYSA-N 1 2 246.358 2.313 20 0 BEADLO CN(C)c1cc(N2CCC3(CCC3)CC2)[nH+]cn1 ZINC000893836747 583228875 /nfs/dbraw/zinc/22/88/75/583228875.db2.gz UVOPRPPLEOBBAF-UHFFFAOYSA-N 1 2 246.358 2.313 20 0 BEADLO CN(C)c1cc(NCCC2(F)CCC2)[nH+]cn1 ZINC000893858776 583233549 /nfs/dbraw/zinc/23/35/49/583233549.db2.gz LAOWFGLGQSYCLO-UHFFFAOYSA-N 1 2 238.310 2.237 20 0 BEADLO CN(C)c1cc(NCCC2(F)CCC2)nc[nH+]1 ZINC000893858776 583233552 /nfs/dbraw/zinc/23/35/52/583233552.db2.gz LAOWFGLGQSYCLO-UHFFFAOYSA-N 1 2 238.310 2.237 20 0 BEADLO C[C@H](c1ccco1)c1noc([C@H](C)[NH+](C)C)n1 ZINC000857086735 588886904 /nfs/dbraw/zinc/88/69/04/588886904.db2.gz FSAMLUNOFQOPHX-BDAKNGLRSA-N 1 2 235.287 2.437 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CCC[C@H](C)C2)c1C ZINC000893870443 583235797 /nfs/dbraw/zinc/23/57/97/583235797.db2.gz CZJSYUGZUJQXMR-VIFPVBQESA-N 1 2 207.321 2.258 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CCC[C@H](C)C2)c1C ZINC000893870443 583235800 /nfs/dbraw/zinc/23/58/00/583235800.db2.gz CZJSYUGZUJQXMR-VIFPVBQESA-N 1 2 207.321 2.258 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CCCC[C@H]2C)c1C ZINC000893871063 583235895 /nfs/dbraw/zinc/23/58/95/583235895.db2.gz DKWTWNWMMQBZJE-SECBINFHSA-N 1 2 207.321 2.401 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CCCC[C@H]2C)c1C ZINC000893871063 583235898 /nfs/dbraw/zinc/23/58/98/583235898.db2.gz DKWTWNWMMQBZJE-SECBINFHSA-N 1 2 207.321 2.401 20 0 BEADLO CCc1cc(N[C@H](C)[C@@H](C)OC)nc(CC)[nH+]1 ZINC000893917721 583246726 /nfs/dbraw/zinc/24/67/26/583246726.db2.gz XZWOKVLXFYUDKF-NXEZZACHSA-N 1 2 237.347 2.437 20 0 BEADLO CC[N@H+](Cc1ncc(C(=O)OC)s1)C(C)C ZINC000893921242 583247769 /nfs/dbraw/zinc/24/77/69/583247769.db2.gz ITAFVGKJTJTWRZ-UHFFFAOYSA-N 1 2 242.344 2.160 20 0 BEADLO CC[N@@H+](Cc1ncc(C(=O)OC)s1)C(C)C ZINC000893921242 583247771 /nfs/dbraw/zinc/24/77/71/583247771.db2.gz ITAFVGKJTJTWRZ-UHFFFAOYSA-N 1 2 242.344 2.160 20 0 BEADLO CSc1ccc(C[N@@H+]2CCOC[C@@H]2C)o1 ZINC000893962756 583257253 /nfs/dbraw/zinc/25/72/53/583257253.db2.gz QIRJPVDERNVOLU-VIFPVBQESA-N 1 2 227.329 2.222 20 0 BEADLO CSc1ccc(C[N@H+]2CCOC[C@@H]2C)o1 ZINC000893962756 583257255 /nfs/dbraw/zinc/25/72/55/583257255.db2.gz QIRJPVDERNVOLU-VIFPVBQESA-N 1 2 227.329 2.222 20 0 BEADLO CC(C)c1c[nH]c(CN2C[C@@H](C)OC[C@@H]2C)[nH+]1 ZINC000893952812 583261881 /nfs/dbraw/zinc/26/18/81/583261881.db2.gz MAPCGOWJUHAIIG-WDEREUQCSA-N 1 2 237.347 2.142 20 0 BEADLO Cc1ccoc1CN(C)c1cc(N(C)C)[nH+]cn1 ZINC000893959962 583262206 /nfs/dbraw/zinc/26/22/06/583262206.db2.gz PQHOGWCGBIBVQT-UHFFFAOYSA-N 1 2 246.314 2.080 20 0 BEADLO Cc1ccoc1CN(C)c1cc(N(C)C)nc[nH+]1 ZINC000893959962 583262210 /nfs/dbraw/zinc/26/22/10/583262210.db2.gz PQHOGWCGBIBVQT-UHFFFAOYSA-N 1 2 246.314 2.080 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2ocnc2C)s1 ZINC000893967082 583264033 /nfs/dbraw/zinc/26/40/33/583264033.db2.gz WVEIVIYYHRZXGK-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2ocnc2C)s1 ZINC000893967082 583264035 /nfs/dbraw/zinc/26/40/35/583264035.db2.gz WVEIVIYYHRZXGK-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1n[nH]c(C[N@H+](C)Cc2ccoc2)c1C ZINC000893973443 583264919 /nfs/dbraw/zinc/26/49/19/583264919.db2.gz KRMSOIWWUMTVRT-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO Cc1n[nH]c(C[N@@H+](C)Cc2ccoc2)c1C ZINC000893973443 583264921 /nfs/dbraw/zinc/26/49/21/583264921.db2.gz KRMSOIWWUMTVRT-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO C[C@H](F)CCNc1cccc([C@H](C)O)[nH+]1 ZINC000893981884 583266623 /nfs/dbraw/zinc/26/66/23/583266623.db2.gz MNLIJFRVQCZHDI-IUCAKERBSA-N 1 2 212.268 2.295 20 0 BEADLO CCc1cc(NC[C@H](OC)C2CC2)nc(CC)[nH+]1 ZINC000893989483 583270479 /nfs/dbraw/zinc/27/04/79/583270479.db2.gz WSVGJGVNOZCVRR-LBPRGKRZSA-N 1 2 249.358 2.438 20 0 BEADLO Cc1cc(N(C)CCF)nc(C2CCC2)[nH+]1 ZINC000894001396 583271412 /nfs/dbraw/zinc/27/14/12/583271412.db2.gz WBSCVJSQPKCKTM-UHFFFAOYSA-N 1 2 223.295 2.458 20 0 BEADLO CC[N@H+](Cc1ocnc1C)Cc1ccccn1 ZINC000894021323 583274357 /nfs/dbraw/zinc/27/43/57/583274357.db2.gz MNRPZPWJTHZHLX-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1ocnc1C)Cc1ccccn1 ZINC000894021323 583274358 /nfs/dbraw/zinc/27/43/58/583274358.db2.gz MNRPZPWJTHZHLX-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CCc1cc(NCC2=CCOCC2)nc(CC)[nH+]1 ZINC000894026694 583280992 /nfs/dbraw/zinc/28/09/92/583280992.db2.gz BFOZWAOXZRJAEY-UHFFFAOYSA-N 1 2 247.342 2.360 20 0 BEADLO CC(C)c1c[nH]c(CN2CCOC3(CCC3)C2)[nH+]1 ZINC000894050997 583289280 /nfs/dbraw/zinc/28/92/80/583289280.db2.gz WBOJYHTUBOBOTC-UHFFFAOYSA-N 1 2 249.358 2.288 20 0 BEADLO O[C@H]1C[C@@H](Nc2ccc(-c3ccncc3)c[nH+]2)C1 ZINC000894117636 583310172 /nfs/dbraw/zinc/31/01/72/583310172.db2.gz CIDLDFJCXRIFNG-BETUJISGSA-N 1 2 241.294 2.079 20 0 BEADLO Cc1ccc2c(c1C)OC[C@@H]2[NH2+]Cc1cnc[nH]1 ZINC000894138159 583314236 /nfs/dbraw/zinc/31/42/36/583314236.db2.gz YKSPSPQRLMSQGN-ZDUSSCGKSA-N 1 2 243.310 2.250 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H](C)Cc1cccc(C)c1 ZINC000877476554 583317311 /nfs/dbraw/zinc/31/73/11/583317311.db2.gz HKDXRWGQQVHJPU-RYUDHWBXSA-N 1 2 235.327 2.077 20 0 BEADLO CNc1cc(N2CC(C)(C)C[C@@H]2C)nc[nH+]1 ZINC000894205119 583341459 /nfs/dbraw/zinc/34/14/59/583341459.db2.gz HOTPPJKFMHTUEK-VIFPVBQESA-N 1 2 220.320 2.143 20 0 BEADLO CNc1cc(N2CC(C)(C)C[C@@H]2C)[nH+]cn1 ZINC000894205119 583341460 /nfs/dbraw/zinc/34/14/60/583341460.db2.gz HOTPPJKFMHTUEK-VIFPVBQESA-N 1 2 220.320 2.143 20 0 BEADLO CCN(Cc1occc1C)c1cc(NC)[nH+]cn1 ZINC000894210595 583373294 /nfs/dbraw/zinc/37/32/94/583373294.db2.gz UTPIAJCHDGDSHO-UHFFFAOYSA-N 1 2 246.314 2.446 20 0 BEADLO CCN(Cc1occc1C)c1cc(NC)nc[nH+]1 ZINC000894210595 583373298 /nfs/dbraw/zinc/37/32/98/583373298.db2.gz UTPIAJCHDGDSHO-UHFFFAOYSA-N 1 2 246.314 2.446 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2 ZINC000333349319 583381580 /nfs/dbraw/zinc/38/15/80/583381580.db2.gz FBLFKIUXZUJNLH-UTUOFQBUSA-N 1 2 246.310 2.204 20 0 BEADLO C[C@H](CNc1cc(N(C)C)nc[nH+]1)CC(F)F ZINC000894346592 583431264 /nfs/dbraw/zinc/43/12/64/583431264.db2.gz LYPIZVGFBULACP-QMMMGPOBSA-N 1 2 244.289 2.246 20 0 BEADLO C[C@H](CNc1cc(N(C)C)[nH+]cn1)CC(F)F ZINC000894346592 583431266 /nfs/dbraw/zinc/43/12/66/583431266.db2.gz LYPIZVGFBULACP-QMMMGPOBSA-N 1 2 244.289 2.246 20 0 BEADLO Cc1ccc(CNc2cccc([C@@H](C)O)[nH+]2)nc1 ZINC000894349667 583432385 /nfs/dbraw/zinc/43/23/85/583432385.db2.gz JWJHMMJQADEAES-LLVKDONJSA-N 1 2 243.310 2.450 20 0 BEADLO COc1ccc(C[NH2+]Cc2c[nH]cn2)c(C)c1 ZINC000894351907 583433598 /nfs/dbraw/zinc/43/35/98/583433598.db2.gz MGRQBTFMLJGEOE-UHFFFAOYSA-N 1 2 231.299 2.017 20 0 BEADLO CCc1cc(N[C@@H]2CO[C@@H](C)C2)nc(CC)[nH+]1 ZINC000894362559 583437927 /nfs/dbraw/zinc/43/79/27/583437927.db2.gz WXEGFWBRKYXQDZ-ONGXEEELSA-N 1 2 235.331 2.191 20 0 BEADLO CCCCn1cc(C[NH2+]Cc2c[nH]cn2)c(C)n1 ZINC000894373344 583441257 /nfs/dbraw/zinc/44/12/57/583441257.db2.gz SRYJYJPSDINVEJ-UHFFFAOYSA-N 1 2 247.346 2.005 20 0 BEADLO O=c1[nH]c2ccc(C[N@H+]3CCC=C(F)C3)cc2[nH]1 ZINC000894426924 583456371 /nfs/dbraw/zinc/45/63/71/583456371.db2.gz HODWHQJJVKULQP-UHFFFAOYSA-N 1 2 247.273 2.328 20 0 BEADLO O=c1[nH]c2ccc(C[N@@H+]3CCC=C(F)C3)cc2[nH]1 ZINC000894426924 583456373 /nfs/dbraw/zinc/45/63/73/583456373.db2.gz HODWHQJJVKULQP-UHFFFAOYSA-N 1 2 247.273 2.328 20 0 BEADLO Fc1cccc2c1CCN2Cc1c[nH+]c[nH]1 ZINC000894470482 583468987 /nfs/dbraw/zinc/46/89/87/583468987.db2.gz OOSGHIHDAQOBFU-UHFFFAOYSA-N 1 2 217.247 2.112 20 0 BEADLO Fc1cccc2c1CCN2Cc1c[nH]c[nH+]1 ZINC000894470482 583468988 /nfs/dbraw/zinc/46/89/88/583468988.db2.gz OOSGHIHDAQOBFU-UHFFFAOYSA-N 1 2 217.247 2.112 20 0 BEADLO C[C@@H]1CN(Cc2c[nH+]c[nH]2)c2ccccc2O1 ZINC000894471923 583469362 /nfs/dbraw/zinc/46/93/62/583469362.db2.gz UROVOBDFXCLLGP-SNVBAGLBSA-N 1 2 229.283 2.197 20 0 BEADLO C[C@@H]1CN(Cc2c[nH]c[nH+]2)c2ccccc2O1 ZINC000894471923 583469364 /nfs/dbraw/zinc/46/93/64/583469364.db2.gz UROVOBDFXCLLGP-SNVBAGLBSA-N 1 2 229.283 2.197 20 0 BEADLO Cc1noc([C@H](C)[NH2+][C@H]2CCc3cccnc32)n1 ZINC000894542148 583481205 /nfs/dbraw/zinc/48/12/05/583481205.db2.gz GNGWHRZGSXOUPI-KWQFWETISA-N 1 2 244.298 2.111 20 0 BEADLO Cc1ccc(CN(C)Cc2[nH]cc[nH+]2)c(F)c1 ZINC000894586544 583489076 /nfs/dbraw/zinc/48/90/76/583489076.db2.gz IABRIOIEMUFSJL-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1cc(NC2([C@@H](C)O)CC2)nc(C2CCC2)[nH+]1 ZINC000894600181 583490027 /nfs/dbraw/zinc/49/00/27/583490027.db2.gz BDMUEHZXASRUAM-SNVBAGLBSA-N 1 2 247.342 2.378 20 0 BEADLO Cc1sccc1CN(C)Cc1[nH]cc[nH+]1 ZINC000894587287 583490304 /nfs/dbraw/zinc/49/03/04/583490304.db2.gz YWRMFSAEVXVOHE-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1sccc1C[N@H+](C)Cc1ncc[nH]1 ZINC000894587287 583490306 /nfs/dbraw/zinc/49/03/06/583490306.db2.gz YWRMFSAEVXVOHE-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1sccc1C[N@@H+](C)Cc1ncc[nH]1 ZINC000894587287 583490307 /nfs/dbraw/zinc/49/03/07/583490307.db2.gz YWRMFSAEVXVOHE-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO COc1ccc(F)c(CN(C)Cc2[nH]cc[nH+]2)c1 ZINC000894587086 583490548 /nfs/dbraw/zinc/49/05/48/583490548.db2.gz PKKNBTBVAAMXRQ-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO CC(C)c1c[nH]c(C[NH+]2CC([C@@H]3CCOC3)C2)n1 ZINC000894604117 583491168 /nfs/dbraw/zinc/49/11/68/583491168.db2.gz JYXLLFDYNHMCPX-LLVKDONJSA-N 1 2 249.358 2.001 20 0 BEADLO CCc1cc(N2CC[C@H]3C[C@H]3C2)nc(CC)[nH+]1 ZINC000894591838 583491933 /nfs/dbraw/zinc/49/19/33/583491933.db2.gz AZMDIGCJWHDONJ-QWRGUYRKSA-N 1 2 231.343 2.448 20 0 BEADLO CN(C)c1cc(NC2CC(C)(C)C2)[nH+]cn1 ZINC000894638849 583498572 /nfs/dbraw/zinc/49/85/72/583498572.db2.gz HQDWPBVBLUXVRV-UHFFFAOYSA-N 1 2 220.320 2.143 20 0 BEADLO CN(C)c1cc(NC2CC(C)(C)C2)nc[nH+]1 ZINC000894638849 583498575 /nfs/dbraw/zinc/49/85/75/583498575.db2.gz HQDWPBVBLUXVRV-UHFFFAOYSA-N 1 2 220.320 2.143 20 0 BEADLO Cc1nc(C[NH+]2CC3(CC3)C2)sc1C ZINC000894663934 583501886 /nfs/dbraw/zinc/50/18/86/583501886.db2.gz OJBNBGSPAOEXPL-UHFFFAOYSA-N 1 2 208.330 2.356 20 0 BEADLO Cc1nn(C(C)C)c(C)c1C[NH2+]C(CF)CF ZINC000894665874 583502187 /nfs/dbraw/zinc/50/21/87/583502187.db2.gz BOFPXRPGMCFVRO-UHFFFAOYSA-N 1 2 245.317 2.478 20 0 BEADLO CCc1[nH]nc(Cl)c1C[N@@H+]1CC[C@H](F)C1 ZINC000894670134 583503590 /nfs/dbraw/zinc/50/35/90/583503590.db2.gz CNHVPCOSNNCGHN-ZETCQYMHSA-N 1 2 231.702 2.169 20 0 BEADLO CCc1[nH]nc(Cl)c1C[N@H+]1CC[C@H](F)C1 ZINC000894670134 583503593 /nfs/dbraw/zinc/50/35/93/583503593.db2.gz CNHVPCOSNNCGHN-ZETCQYMHSA-N 1 2 231.702 2.169 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2CCC[C@@H](CF)C2)no1 ZINC000880236963 583505856 /nfs/dbraw/zinc/50/58/56/583505856.db2.gz MXTFHZZRRHFVTO-WPRPVWTQSA-N 1 2 227.283 2.121 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2CCC[C@@H](CF)C2)no1 ZINC000880236963 583505857 /nfs/dbraw/zinc/50/58/57/583505857.db2.gz MXTFHZZRRHFVTO-WPRPVWTQSA-N 1 2 227.283 2.121 20 0 BEADLO FC[C@H]1CCC[N@H+](Cc2nc(C(F)F)no2)C1 ZINC000880237970 583507532 /nfs/dbraw/zinc/50/75/32/583507532.db2.gz LSQBPXFLOONLII-SSDOTTSWSA-N 1 2 249.236 2.189 20 0 BEADLO FC[C@H]1CCC[N@@H+](Cc2nc(C(F)F)no2)C1 ZINC000880237970 583507534 /nfs/dbraw/zinc/50/75/34/583507534.db2.gz LSQBPXFLOONLII-SSDOTTSWSA-N 1 2 249.236 2.189 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CC[C@@]3(C2)CCCOC3)c1C ZINC000894697866 583510796 /nfs/dbraw/zinc/51/07/96/583510796.db2.gz PKJXZSZFSVDFBH-CQSZACIVSA-N 1 2 249.358 2.029 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CC[C@@]3(C2)CCCOC3)c1C ZINC000894697866 583510797 /nfs/dbraw/zinc/51/07/97/583510797.db2.gz PKJXZSZFSVDFBH-CQSZACIVSA-N 1 2 249.358 2.029 20 0 BEADLO FC1CC[NH+](Cc2nnc(C3CC3)s2)CC1 ZINC000880239093 583512887 /nfs/dbraw/zinc/51/28/87/583512887.db2.gz VBCCKUDDEFWIOD-UHFFFAOYSA-N 1 2 241.335 2.349 20 0 BEADLO CCc1ncc(C[NH2+]Cc2c(C)noc2CC)o1 ZINC000894755301 583516253 /nfs/dbraw/zinc/51/62/53/583516253.db2.gz ZBJAIUHLJOJQLZ-UHFFFAOYSA-N 1 2 249.314 2.386 20 0 BEADLO Cc1ncoc1C[NH2+]Cc1noc2c1CCCC2 ZINC000894784709 583521510 /nfs/dbraw/zinc/52/15/10/583521510.db2.gz NNEGJKLIHHOPAQ-UHFFFAOYSA-N 1 2 247.298 2.140 20 0 BEADLO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1cnc[nH]1 ZINC000894786380 583521804 /nfs/dbraw/zinc/52/18/04/583521804.db2.gz HDOREMZZZKJRDR-ZANVPECISA-N 1 2 229.283 2.022 20 0 BEADLO CCOC1C[NH+](Cc2nccc3c2CCCC3)C1 ZINC000894818775 583524727 /nfs/dbraw/zinc/52/47/27/583524727.db2.gz FBSLDJKZHOBXRU-UHFFFAOYSA-N 1 2 246.354 2.181 20 0 BEADLO CCC1(CC)C[NH+](Cc2nnc(C)s2)C1 ZINC000894819277 583524833 /nfs/dbraw/zinc/52/48/33/583524833.db2.gz KJUDFTIKKRESBE-UHFFFAOYSA-N 1 2 225.361 2.469 20 0 BEADLO COC1C[NH+](Cc2ccc(CSC)cc2)C1 ZINC000894819759 583525020 /nfs/dbraw/zinc/52/50/20/583525020.db2.gz QHMRDZWRRCAAPE-UHFFFAOYSA-N 1 2 237.368 2.380 20 0 BEADLO FC(F)C1C[NH+](Cc2cn3ccnc3s2)C1 ZINC000894829977 583527256 /nfs/dbraw/zinc/52/72/56/583527256.db2.gz HDGYVUYTBAYGAI-UHFFFAOYSA-N 1 2 243.282 2.093 20 0 BEADLO Cc1c(Cl)c(C[N@H+]2C[C@H](C)[C@@H]2C)nn1C ZINC000894861244 583534311 /nfs/dbraw/zinc/53/43/11/583534311.db2.gz CJSASKNTBCCNFC-YUMQZZPRSA-N 1 2 227.739 2.222 20 0 BEADLO Cc1c(Cl)c(C[N@@H+]2C[C@H](C)[C@@H]2C)nn1C ZINC000894861244 583534312 /nfs/dbraw/zinc/53/43/12/583534312.db2.gz CJSASKNTBCCNFC-YUMQZZPRSA-N 1 2 227.739 2.222 20 0 BEADLO CCNc1cc(CNc2nc(C)ns2)cc[nH+]1 ZINC000894872129 583540304 /nfs/dbraw/zinc/54/03/04/583540304.db2.gz YXUFQHXWNITZFQ-UHFFFAOYSA-N 1 2 249.343 2.285 20 0 BEADLO CCc1cc(NCC2CSC2)nc(CC)[nH+]1 ZINC000894881416 583543426 /nfs/dbraw/zinc/54/34/26/583543426.db2.gz MOUUSMDEQRHDQM-UHFFFAOYSA-N 1 2 237.372 2.376 20 0 BEADLO Cc1cc(C[NH+]2CC(C(F)(F)F)C2)sn1 ZINC000894891519 583548647 /nfs/dbraw/zinc/54/86/47/583548647.db2.gz GXWNJQFCAWWKPN-UHFFFAOYSA-N 1 2 236.262 2.446 20 0 BEADLO CCn1ccc(C[NH2+]Cc2cnc(F)cc2C)n1 ZINC000894895176 583549825 /nfs/dbraw/zinc/54/98/25/583549825.db2.gz QYPJFOPDADJZNX-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO Oc1cccc(C[NH+]2CC(C(F)(F)F)C2)c1 ZINC000894898637 583550649 /nfs/dbraw/zinc/55/06/49/583550649.db2.gz ZUNQEMIOLBHWKR-UHFFFAOYSA-N 1 2 231.217 2.386 20 0 BEADLO CCn1ccnc1[C@H](C)[NH2+][C@@H](C)c1cnccn1 ZINC000894911956 583555074 /nfs/dbraw/zinc/55/50/74/583555074.db2.gz OXORMSPXLLOZGB-QWRGUYRKSA-N 1 2 245.330 2.105 20 0 BEADLO CN(C)c1cc(N[C@@H]2CCCC[C@@H]2F)[nH+]cn1 ZINC000894924817 583556806 /nfs/dbraw/zinc/55/68/06/583556806.db2.gz BHTCOMKXCWYURJ-VHSXEESVSA-N 1 2 238.310 2.235 20 0 BEADLO CN(C)c1cc(N[C@@H]2CCCC[C@@H]2F)nc[nH+]1 ZINC000894924817 583556808 /nfs/dbraw/zinc/55/68/08/583556808.db2.gz BHTCOMKXCWYURJ-VHSXEESVSA-N 1 2 238.310 2.235 20 0 BEADLO FC(F)CC1C[NH+](Cc2nccn2C2CC2)C1 ZINC000895011926 583568526 /nfs/dbraw/zinc/56/85/26/583568526.db2.gz HPXIDXNZYOHEMC-UHFFFAOYSA-N 1 2 241.285 2.305 20 0 BEADLO c1coc(C[N@@H+]2CCc3nc[nH]c3C23CCC3)c1 ZINC000895067961 583578458 /nfs/dbraw/zinc/57/84/58/583578458.db2.gz BUXWKJORPNAIJA-UHFFFAOYSA-N 1 2 243.310 2.440 20 0 BEADLO c1coc(C[N@H+]2CCc3nc[nH]c3C23CCC3)c1 ZINC000895067961 583578459 /nfs/dbraw/zinc/57/84/59/583578459.db2.gz BUXWKJORPNAIJA-UHFFFAOYSA-N 1 2 243.310 2.440 20 0 BEADLO c1ncc(CC[N@@H+]2Cc3ccncc3C2)s1 ZINC000857881946 588913367 /nfs/dbraw/zinc/91/33/67/588913367.db2.gz KKUXQIQQXHPMPO-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1ncc(CC[N@H+]2Cc3ccncc3C2)s1 ZINC000857881946 588913368 /nfs/dbraw/zinc/91/33/68/588913368.db2.gz KKUXQIQQXHPMPO-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO FC1(F)CC(C[N@@H+]2Cc3ccncc3C2)C1 ZINC000857882621 588913373 /nfs/dbraw/zinc/91/33/73/588913373.db2.gz WDQDSNFNGQUJEG-UHFFFAOYSA-N 1 2 224.254 2.443 20 0 BEADLO FC1(F)CC(C[N@H+]2Cc3ccncc3C2)C1 ZINC000857882621 588913374 /nfs/dbraw/zinc/91/33/74/588913374.db2.gz WDQDSNFNGQUJEG-UHFFFAOYSA-N 1 2 224.254 2.443 20 0 BEADLO C[C@H]([NH2+]Cc1cccnc1F)c1ccccn1 ZINC000793282022 583580049 /nfs/dbraw/zinc/58/00/49/583580049.db2.gz UDPTXBAUCJFWSX-JTQLQIEISA-N 1 2 231.274 2.467 20 0 BEADLO COC(=O)c1cnc(C[N@H+](C)C(C)(C)C)s1 ZINC000895083423 583583385 /nfs/dbraw/zinc/58/33/85/583583385.db2.gz GFZROQXBUXFGFG-UHFFFAOYSA-N 1 2 242.344 2.160 20 0 BEADLO COC(=O)c1cnc(C[N@@H+](C)C(C)(C)C)s1 ZINC000895083423 583583387 /nfs/dbraw/zinc/58/33/87/583583387.db2.gz GFZROQXBUXFGFG-UHFFFAOYSA-N 1 2 242.344 2.160 20 0 BEADLO Cc1ncoc1C[N@H+]1C[C@@H](C)OCC12CCC2 ZINC000895142599 583603280 /nfs/dbraw/zinc/60/32/80/583603280.db2.gz RAZDKXIRFLCYDY-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1ncoc1C[N@@H+]1C[C@@H](C)OCC12CCC2 ZINC000895142599 583603281 /nfs/dbraw/zinc/60/32/81/583603281.db2.gz RAZDKXIRFLCYDY-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO COc1ccc(C[N@@H+]2CCC[C@H](F)C2)o1 ZINC000895192309 583621663 /nfs/dbraw/zinc/62/16/63/583621663.db2.gz YVTNEZFQDNPYOK-VIFPVBQESA-N 1 2 213.252 2.222 20 0 BEADLO COc1ccc(C[N@H+]2CCC[C@H](F)C2)o1 ZINC000895192309 583621664 /nfs/dbraw/zinc/62/16/64/583621664.db2.gz YVTNEZFQDNPYOK-VIFPVBQESA-N 1 2 213.252 2.222 20 0 BEADLO COc1ccc(C[N@@H+]2CCC[C@@H](F)C2)nc1 ZINC000895191905 583621862 /nfs/dbraw/zinc/62/18/62/583621862.db2.gz UOSDOGMJHOBYCP-SNVBAGLBSA-N 1 2 224.279 2.024 20 0 BEADLO COc1ccc(C[N@H+]2CCC[C@@H](F)C2)nc1 ZINC000895191905 583621864 /nfs/dbraw/zinc/62/18/64/583621864.db2.gz UOSDOGMJHOBYCP-SNVBAGLBSA-N 1 2 224.279 2.024 20 0 BEADLO C[C@H](CC(=O)NC1(C2CC2)CCC1)n1cc[nH+]c1 ZINC000895352783 583656874 /nfs/dbraw/zinc/65/68/74/583656874.db2.gz AXIZLZRSWIDREY-LLVKDONJSA-N 1 2 247.342 2.283 20 0 BEADLO Cc1cnccc1C[N@@H+]1Cc2ccncc2C1 ZINC000857880264 588919470 /nfs/dbraw/zinc/91/94/70/588919470.db2.gz FCBHJCJMVAKWHF-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO Cc1cnccc1C[N@H+]1Cc2ccncc2C1 ZINC000857880264 588919471 /nfs/dbraw/zinc/91/94/71/588919471.db2.gz FCBHJCJMVAKWHF-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO c1cc2c(cn1)C[N@H+](CCOCC1CCC1)C2 ZINC000857881575 588920190 /nfs/dbraw/zinc/92/01/90/588920190.db2.gz INSNJKZTQCUPMP-UHFFFAOYSA-N 1 2 232.327 2.214 20 0 BEADLO FC(F)[C@H]1CC[N@@H+]1CC1CCSCC1 ZINC000895432265 583670854 /nfs/dbraw/zinc/67/08/54/583670854.db2.gz YCLQIZCEWRTIEC-SECBINFHSA-N 1 2 221.316 2.469 20 0 BEADLO FC(F)[C@H]1CC[N@H+]1CC1CCSCC1 ZINC000895432265 583670855 /nfs/dbraw/zinc/67/08/55/583670855.db2.gz YCLQIZCEWRTIEC-SECBINFHSA-N 1 2 221.316 2.469 20 0 BEADLO c1cc2c(cn1)C[N@@H+](CCOCC1CCC1)C2 ZINC000857881575 588920192 /nfs/dbraw/zinc/92/01/92/588920192.db2.gz INSNJKZTQCUPMP-UHFFFAOYSA-N 1 2 232.327 2.214 20 0 BEADLO Cc1ncccc1C[N@@H+]1Cc2ccncc2C1 ZINC000857879987 588920308 /nfs/dbraw/zinc/92/03/08/588920308.db2.gz YJSWIAFMKGHZQR-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO Cc1ncccc1C[N@H+]1Cc2ccncc2C1 ZINC000857879987 588920310 /nfs/dbraw/zinc/92/03/10/588920310.db2.gz YJSWIAFMKGHZQR-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2ccns2)o1 ZINC000895452780 583677340 /nfs/dbraw/zinc/67/73/40/583677340.db2.gz WJIXJKJIVMCIRS-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2ccns2)o1 ZINC000895452780 583677342 /nfs/dbraw/zinc/67/73/42/583677342.db2.gz WJIXJKJIVMCIRS-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO C[C@@H]1C[C@H]1[C@@H]1C[C@H]1Nc1cc(CO)cc[nH+]1 ZINC000895538218 583687219 /nfs/dbraw/zinc/68/72/19/583687219.db2.gz ZPLNRAJCWFZOOQ-KXGXSXBTSA-N 1 2 218.300 2.030 20 0 BEADLO CCCN(CC)C(=O)C(C)(C)n1c[nH+]c(C)c1 ZINC000895665439 583704971 /nfs/dbraw/zinc/70/49/71/583704971.db2.gz JVRMNALEEZNPGW-UHFFFAOYSA-N 1 2 237.347 2.185 20 0 BEADLO C[C@@H]1CCN(c2[nH+]c3ccccc3n2C)CCO1 ZINC000895759283 583721377 /nfs/dbraw/zinc/72/13/77/583721377.db2.gz BFZIGZRWMISLFQ-LLVKDONJSA-N 1 2 245.326 2.189 20 0 BEADLO COC(C)(C)[C@@H](C)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000895786592 583727024 /nfs/dbraw/zinc/72/70/24/583727024.db2.gz VODYJHBZCIVKEK-MRVPVSSYSA-N 1 2 248.330 2.492 20 0 BEADLO CC/C(C)=C(\C)C(=O)N[C@H]1CCn2c[nH+]cc2C1 ZINC000857946641 588924812 /nfs/dbraw/zinc/92/48/12/588924812.db2.gz XJBDJLFCTHIJNI-IIANPFDCSA-N 1 2 247.342 2.061 20 0 BEADLO CC[C@@H](C[NH2+][C@H]1CCOC1=O)c1ccccc1 ZINC000895802514 583731482 /nfs/dbraw/zinc/73/14/82/583731482.db2.gz ULALDONPOCMBKU-AAEUAGOBSA-N 1 2 233.311 2.085 20 0 BEADLO Cc1ccc(CC[C@@H](C)[NH2+][C@H]2CCOC2=O)cc1 ZINC000895804929 583732340 /nfs/dbraw/zinc/73/23/40/583732340.db2.gz ONXQGVGMLKALCW-OCCSQVGLSA-N 1 2 247.338 2.221 20 0 BEADLO Cc1cn(C(C)(C)C(=O)NC[C@H](C)C2CC2)c[nH+]1 ZINC000895871078 583737588 /nfs/dbraw/zinc/73/75/88/583737588.db2.gz YILMUCJKSILWSR-JTQLQIEISA-N 1 2 249.358 2.089 20 0 BEADLO Cc1c(Cl)c(C[N@H+](C)CCCF)nn1C ZINC000895895698 583743354 /nfs/dbraw/zinc/74/33/54/583743354.db2.gz CUXFWPSPGTVCRD-UHFFFAOYSA-N 1 2 233.718 2.173 20 0 BEADLO Cc1c(Cl)c(C[N@@H+](C)CCCF)nn1C ZINC000895895698 583743355 /nfs/dbraw/zinc/74/33/55/583743355.db2.gz CUXFWPSPGTVCRD-UHFFFAOYSA-N 1 2 233.718 2.173 20 0 BEADLO Cc1nc(N[C@H]2COC[C@@H]2C)c2c([nH+]1)CCCC2 ZINC000895908668 583745302 /nfs/dbraw/zinc/74/53/02/583745302.db2.gz JNMLPNAZGROAHL-ZANVPECISA-N 1 2 247.342 2.111 20 0 BEADLO CCc1cc(N[C@@H]2COC[C@H]2C)nc(CC)[nH+]1 ZINC000895909598 583745395 /nfs/dbraw/zinc/74/53/95/583745395.db2.gz PPIQGQRRHZOKFX-MWLCHTKSSA-N 1 2 235.331 2.048 20 0 BEADLO CC(C)OC1C[NH+](C[C@@H]2CC2(Cl)Cl)C1 ZINC000895956032 583752731 /nfs/dbraw/zinc/75/27/31/583752731.db2.gz INPPVSQTULOWAD-QMMMGPOBSA-N 1 2 238.158 2.289 20 0 BEADLO COCC1C[NH+](Cc2cc(C)cnc2Cl)C1 ZINC000895976969 583754713 /nfs/dbraw/zinc/75/47/13/583754713.db2.gz WXQZIVUDPZLZTQ-UHFFFAOYSA-N 1 2 240.734 2.122 20 0 BEADLO CCCc1cccc(C[N@@H+]2CCO[C@H](OC)C2)c1 ZINC000895968688 583755177 /nfs/dbraw/zinc/75/51/77/583755177.db2.gz QYUPTPNEQLNBQG-HNNXBMFYSA-N 1 2 249.354 2.444 20 0 BEADLO CCCc1cccc(C[N@H+]2CCO[C@H](OC)C2)c1 ZINC000895968688 583755178 /nfs/dbraw/zinc/75/51/78/583755178.db2.gz QYUPTPNEQLNBQG-HNNXBMFYSA-N 1 2 249.354 2.444 20 0 BEADLO CO[C@@H]1C[N@H+](C/C(C)=C/c2ccccc2)CCO1 ZINC000895970811 583756114 /nfs/dbraw/zinc/75/61/14/583756114.db2.gz VHKAFFDBNWLSAX-VOMSXAGXSA-N 1 2 247.338 2.395 20 0 BEADLO CO[C@@H]1C[N@@H+](C/C(C)=C/c2ccccc2)CCO1 ZINC000895970811 583756115 /nfs/dbraw/zinc/75/61/15/583756115.db2.gz VHKAFFDBNWLSAX-VOMSXAGXSA-N 1 2 247.338 2.395 20 0 BEADLO COCC1C[NH+](Cc2c(F)cc(C)cc2F)C1 ZINC000895975317 583757171 /nfs/dbraw/zinc/75/71/71/583757171.db2.gz VPZJGAMYINSUHU-UHFFFAOYSA-N 1 2 241.281 2.351 20 0 BEADLO C[C@@]1(C(=O)N[C@@H]2CCn3c[nH+]cc32)CC=CCC1 ZINC000857977774 588926964 /nfs/dbraw/zinc/92/69/64/588926964.db2.gz ZINFXCQWBOMTSD-BXUZGUMPSA-N 1 2 245.326 2.191 20 0 BEADLO C[C@@H]1CCC[C@@]1(C)C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857979600 588927145 /nfs/dbraw/zinc/92/71/45/588927145.db2.gz WUJOAFJXPGMBMB-JTNHKYCSSA-N 1 2 247.342 2.270 20 0 BEADLO C/C(=C/C(C)(C)C)C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857979311 588927213 /nfs/dbraw/zinc/92/72/13/588927213.db2.gz AYKBSGPTLDTYRD-BRNRAETOSA-N 1 2 247.342 2.437 20 0 BEADLO C[C@@H]([NH2+]Cc1cn2ccnc2s1)C(F)F ZINC000896038534 583766068 /nfs/dbraw/zinc/76/60/68/583766068.db2.gz QURAPEHTSROPDN-ZCFIWIBFSA-N 1 2 231.271 2.139 20 0 BEADLO C[C@@H]([NH2+]Cc1cnn(C)c1C1CC1)C(F)F ZINC000896038228 583766084 /nfs/dbraw/zinc/76/60/84/583766084.db2.gz MOJHYDNNGRFBMA-SSDOTTSWSA-N 1 2 229.274 2.041 20 0 BEADLO CCC/C(C)=C\C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857982622 588927736 /nfs/dbraw/zinc/92/77/36/588927736.db2.gz KJOYHPGHVHMECZ-ZJRUKIMVSA-N 1 2 233.315 2.191 20 0 BEADLO CC(C)C[C@@H](C)C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857982588 588927827 /nfs/dbraw/zinc/92/78/27/588927827.db2.gz QMZYSIPIFVDYJA-MNOVXSKESA-N 1 2 235.331 2.126 20 0 BEADLO CCC(C)(CC)C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857981217 588928031 /nfs/dbraw/zinc/92/80/31/588928031.db2.gz BZNWCTNTKDBILK-JTQLQIEISA-N 1 2 235.331 2.270 20 0 BEADLO Cn1ncc2c1nc[nH+]c2NCCC1CC=CC1 ZINC000896094024 583771553 /nfs/dbraw/zinc/77/15/53/583771553.db2.gz IUECLCXAAHFKAC-UHFFFAOYSA-N 1 2 243.314 2.132 20 0 BEADLO CCC(=CC(=O)N[C@@H]1CCn2c[nH+]cc21)CC ZINC000857981916 588928255 /nfs/dbraw/zinc/92/82/55/588928255.db2.gz CHERVVDTNWTSOF-LLVKDONJSA-N 1 2 233.315 2.191 20 0 BEADLO CC1(C(=O)N[C@H]2CCn3c[nH+]cc32)CCCCC1 ZINC000857982990 588928289 /nfs/dbraw/zinc/92/82/89/588928289.db2.gz UOMJFAFODPDWTO-NSHDSACASA-N 1 2 247.342 2.415 20 0 BEADLO FC(F)(F)[C@H]1C[N@@H+](CC2(F)CC2)CCS1 ZINC000896455434 583803295 /nfs/dbraw/zinc/80/32/95/583803295.db2.gz GZCKMWZTJHBJSO-SSDOTTSWSA-N 1 2 243.269 2.468 20 0 BEADLO C[C@]1(CNc2cc[nH+]cc2F)CCCCO1 ZINC000896183219 583778808 /nfs/dbraw/zinc/77/88/08/583778808.db2.gz WUGYKZXHSCHVGK-GFCCVEGCSA-N 1 2 224.279 2.014 20 0 BEADLO C[C@@]1(CNc2cccc[nH+]2)CCCCO1 ZINC000896183551 583778982 /nfs/dbraw/zinc/77/89/82/583778982.db2.gz NNJGDKJGPDCNBY-LBPRGKRZSA-N 1 2 206.289 2.453 20 0 BEADLO C[C@]1(CNc2cccc[nH+]2)CCCCO1 ZINC000896183550 583779055 /nfs/dbraw/zinc/77/90/55/583779055.db2.gz NNJGDKJGPDCNBY-GFCCVEGCSA-N 1 2 206.289 2.453 20 0 BEADLO CC[C@H]1CCC[N@@H+]1Cn1ncn(CC)c1=S ZINC000727825364 583779273 /nfs/dbraw/zinc/77/92/73/583779273.db2.gz ZNEHITRVKYUODY-JTQLQIEISA-N 1 2 240.376 2.266 20 0 BEADLO CC[C@H]1CCC[N@H+]1Cn1ncn(CC)c1=S ZINC000727825364 583779274 /nfs/dbraw/zinc/77/92/74/583779274.db2.gz ZNEHITRVKYUODY-JTQLQIEISA-N 1 2 240.376 2.266 20 0 BEADLO CC1(C)C(C(=O)N[C@H]2CCn3c[nH+]cc32)C1(C)C ZINC000857983574 588928623 /nfs/dbraw/zinc/92/86/23/588928623.db2.gz SSKRXMOKBMBGKV-VIFPVBQESA-N 1 2 247.342 2.126 20 0 BEADLO CCC[C@@H](O)CCNc1nc[nH+]c(C)c1C ZINC000896183943 583779303 /nfs/dbraw/zinc/77/93/03/583779303.db2.gz RCFQRGNPRJPDCL-LLVKDONJSA-N 1 2 223.320 2.056 20 0 BEADLO Cc1cc(N[C@H]2CCS[C@@H](C)C2)nc[nH+]1 ZINC000896245259 583784891 /nfs/dbraw/zinc/78/48/91/583784891.db2.gz LHHUMARNQHLJKO-UWVGGRQHSA-N 1 2 223.345 2.481 20 0 BEADLO Cc1c[nH+]c2c(c1)N(C(=O)[C@@H](C)C(C)C)CCN2 ZINC000857996599 588929876 /nfs/dbraw/zinc/92/98/76/588929876.db2.gz BXGUVIXKAGEHLR-NSHDSACASA-N 1 2 247.342 2.441 20 0 BEADLO COC[C@@H](Cc1ccccc1)[NH2+][C@H](C)C(F)F ZINC000883399245 583794322 /nfs/dbraw/zinc/79/43/22/583794322.db2.gz IERMEPZYMZKMTC-ZYHUDNBSSA-N 1 2 243.297 2.487 20 0 BEADLO Cc1c[nH+]c2c(c1)N(C(=O)CCC1CC1)CCN2 ZINC000857997290 588930242 /nfs/dbraw/zinc/93/02/42/588930242.db2.gz ITFQBMHMTFMVKH-UHFFFAOYSA-N 1 2 245.326 2.339 20 0 BEADLO FC(F)(F)[C@H]1C[N@H+](CC2(F)CC2)CCS1 ZINC000896455434 583803294 /nfs/dbraw/zinc/80/32/94/583803294.db2.gz GZCKMWZTJHBJSO-SSDOTTSWSA-N 1 2 243.269 2.468 20 0 BEADLO Cc1c[nH+]c2c(c1)N(C(=O)C=C1CCC1)CCN2 ZINC000857997124 588930485 /nfs/dbraw/zinc/93/04/85/588930485.db2.gz JNOUHRFJCMFHIG-UHFFFAOYSA-N 1 2 243.310 2.259 20 0 BEADLO Cc1cc(N[C@H]2C[C@H](CO)C2)nc(C2CCC2)[nH+]1 ZINC000896696872 583825229 /nfs/dbraw/zinc/82/52/29/583825229.db2.gz LLOYTMDZRWYWJR-UMSPYCQHSA-N 1 2 247.342 2.235 20 0 BEADLO CCc1nc(N[C@]23C[C@H]2CCC3)cc[nH+]1 ZINC000896725170 583825602 /nfs/dbraw/zinc/82/56/02/583825602.db2.gz ZDIZIPCDNFVISF-BXKDBHETSA-N 1 2 203.289 2.394 20 0 BEADLO CCCn1nccc1C[N@@H+]1CCn2cccc2C1 ZINC000896760487 583831679 /nfs/dbraw/zinc/83/16/79/583831679.db2.gz AVQSJBDCRGXXHV-UHFFFAOYSA-N 1 2 244.342 2.110 20 0 BEADLO CCCn1nccc1C[N@H+]1CCn2cccc2C1 ZINC000896760487 583831681 /nfs/dbraw/zinc/83/16/81/583831681.db2.gz AVQSJBDCRGXXHV-UHFFFAOYSA-N 1 2 244.342 2.110 20 0 BEADLO Nc1c(F)cccc1C[N@@H+]1CCn2cccc2C1 ZINC000896761948 583831694 /nfs/dbraw/zinc/83/16/94/583831694.db2.gz XASNMXKNGFTHHW-UHFFFAOYSA-N 1 2 245.301 2.225 20 0 BEADLO Nc1c(F)cccc1C[N@H+]1CCn2cccc2C1 ZINC000896761948 583831697 /nfs/dbraw/zinc/83/16/97/583831697.db2.gz XASNMXKNGFTHHW-UHFFFAOYSA-N 1 2 245.301 2.225 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@H]2CCCC23CC3)[nH+]c1C ZINC000896905905 583851209 /nfs/dbraw/zinc/85/12/09/583851209.db2.gz NXMKOMJXEHVIMR-LLVKDONJSA-N 1 2 247.342 2.223 20 0 BEADLO C[C@H]1C[C@@H]([NH2+]Cc2ccnc(F)c2)c2nccn21 ZINC000858171739 588936917 /nfs/dbraw/zinc/93/69/17/588936917.db2.gz BTSSCYVJONLTCB-GXSJLCMTSA-N 1 2 246.289 2.213 20 0 BEADLO CCCC(C)=CC(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000896916345 583855036 /nfs/dbraw/zinc/85/50/36/583855036.db2.gz CWHOAKZZCOGXNX-CLFYSBASSA-N 1 2 235.331 2.389 20 0 BEADLO CCC/C(C)=C\C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000896916345 583855038 /nfs/dbraw/zinc/85/50/38/583855038.db2.gz CWHOAKZZCOGXNX-CLFYSBASSA-N 1 2 235.331 2.389 20 0 BEADLO CONC(=O)C[NH2+]CC[C@H](C)CCC=C(C)C ZINC000896927699 583859110 /nfs/dbraw/zinc/85/91/10/583859110.db2.gz UVITYJYMNAQADQ-GFCCVEGCSA-N 1 2 242.363 2.026 20 0 BEADLO Cc1[nH]c(CNC(=O)CCC(C)C)[nH+]c1C ZINC000896927262 583859165 /nfs/dbraw/zinc/85/91/65/583859165.db2.gz LKGZHYGLFPEEKV-UHFFFAOYSA-N 1 2 223.320 2.079 20 0 BEADLO Cc1cc(C(=O)NCc2[nH]c(C)c(C)[nH+]2)c(C)o1 ZINC000896929736 583859949 /nfs/dbraw/zinc/85/99/49/583859949.db2.gz MSNIBIBRTBVTRI-UHFFFAOYSA-N 1 2 247.298 2.166 20 0 BEADLO CCc1cc(N[C@@H]2CCC[C@@H]2CO)nc(CC)[nH+]1 ZINC000896965122 583864903 /nfs/dbraw/zinc/86/49/03/583864903.db2.gz FDHKQAIEIAHXPS-ZYHUDNBSSA-N 1 2 249.358 2.174 20 0 BEADLO CN(C)c1cc(N[C@@H]2C[C@@H]3CCC[C@@H]23)[nH+]cn1 ZINC000897176626 583889207 /nfs/dbraw/zinc/88/92/07/583889207.db2.gz ASTYJCVRVDJBSB-HBNTYKKESA-N 1 2 232.331 2.143 20 0 BEADLO CN(C)c1cc(N[C@@H]2C[C@@H]3CCC[C@@H]23)nc[nH+]1 ZINC000897176626 583889208 /nfs/dbraw/zinc/88/92/08/583889208.db2.gz ASTYJCVRVDJBSB-HBNTYKKESA-N 1 2 232.331 2.143 20 0 BEADLO Cc1nc(N[C@@H]2C[C@@H]3CCC[C@@H]23)cc[nH+]1 ZINC000897178345 583891106 /nfs/dbraw/zinc/89/11/06/583891106.db2.gz AWNAJTPVAQSGIE-HBNTYKKESA-N 1 2 203.289 2.386 20 0 BEADLO CNc1cc(N[C@@H]2CCOC23CCCC3)nc[nH+]1 ZINC000897320050 583920985 /nfs/dbraw/zinc/92/09/85/583920985.db2.gz IWMBPOVJKPKUGG-SNVBAGLBSA-N 1 2 248.330 2.032 20 0 BEADLO CNc1cc(N[C@@H]2CCOC23CCCC3)[nH+]cn1 ZINC000897320050 583920988 /nfs/dbraw/zinc/92/09/88/583920988.db2.gz IWMBPOVJKPKUGG-SNVBAGLBSA-N 1 2 248.330 2.032 20 0 BEADLO Cc1nc(N[C@@H]2CCOC23CCCC3)cc[nH+]1 ZINC000897322493 583922319 /nfs/dbraw/zinc/92/23/19/583922319.db2.gz HOBAYXPYQIWJEA-LLVKDONJSA-N 1 2 233.315 2.299 20 0 BEADLO CCn1c[nH+]c2c1CCN(Cc1ccoc1C)C2 ZINC000897333727 583923904 /nfs/dbraw/zinc/92/39/04/583923904.db2.gz MEEOCLFSSZPNGE-UHFFFAOYSA-N 1 2 245.326 2.363 20 0 BEADLO O[C@H]1CCN(c2[nH+]ccc3ccccc32)C[C@@H]1F ZINC000897380313 583946818 /nfs/dbraw/zinc/94/68/18/583946818.db2.gz OOMBKEJGHXIASC-STQMWFEESA-N 1 2 246.285 2.144 20 0 BEADLO CC[C@@H](C)Oc1cc(-n2cc[nH+]c2)nc(C)n1 ZINC000858324511 588945355 /nfs/dbraw/zinc/94/53/55/588945355.db2.gz SDYNFCKQLIEPEY-SECBINFHSA-N 1 2 232.287 2.148 20 0 BEADLO c1c[nH+]c(-c2cccc(CO[C@H]3CCOC3)c2)[nH]1 ZINC000653510837 583960173 /nfs/dbraw/zinc/96/01/73/583960173.db2.gz ODONJJGPHRUEQI-ZDUSSCGKSA-N 1 2 244.294 2.382 20 0 BEADLO c1[nH]cc(-c2cccc(CO[C@@H]3CCOC3)c2)[nH+]1 ZINC000653510784 583960175 /nfs/dbraw/zinc/96/01/75/583960175.db2.gz MHMFYDYZJMCQLE-CYBMUJFWSA-N 1 2 244.294 2.382 20 0 BEADLO CCn1cnn(C[N@@H+]2C[C@H](C)C[C@@H]2C)c1=S ZINC000740858759 583971637 /nfs/dbraw/zinc/97/16/37/583971637.db2.gz GMKNQEQIHLKALG-ZJUUUORDSA-N 1 2 240.376 2.122 20 0 BEADLO CCn1cnn(C[N@H+]2C[C@H](C)C[C@@H]2C)c1=S ZINC000740858759 583971639 /nfs/dbraw/zinc/97/16/39/583971639.db2.gz GMKNQEQIHLKALG-ZJUUUORDSA-N 1 2 240.376 2.122 20 0 BEADLO c1cc(N[C@@H]2COC[C@@H]2C2CC2)nc(C2CC2)[nH+]1 ZINC000897448813 583987245 /nfs/dbraw/zinc/98/72/45/583987245.db2.gz YDKHNLHYYJNSCK-VXGBXAGGSA-N 1 2 245.326 2.191 20 0 BEADLO CCC/C=C/C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000729351377 583993797 /nfs/dbraw/zinc/99/37/97/583993797.db2.gz QUURTSBPXLEPIR-SNAWJCMRSA-N 1 2 247.342 2.472 20 0 BEADLO CCC/C=C\C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000729369885 583995187 /nfs/dbraw/zinc/99/51/87/583995187.db2.gz BIEPNFGLWILBMY-DJFZKKHWSA-N 1 2 247.342 2.472 20 0 BEADLO CC[C@@H](NC(=O)C(C)=C(C)C)c1[nH]cc[nH+]1 ZINC000785421000 584007143 /nfs/dbraw/zinc/00/71/43/584007143.db2.gz JDUPXSPRZRJRAL-SNVBAGLBSA-N 1 2 221.304 2.333 20 0 BEADLO Cc1noc(C[N@@H+]2CCc3c(C)cccc3C2)n1 ZINC000729479569 584015519 /nfs/dbraw/zinc/01/55/19/584015519.db2.gz LHRDBCFBVYOQDC-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1noc(C[N@H+]2CCc3c(C)cccc3C2)n1 ZINC000729479569 584015520 /nfs/dbraw/zinc/01/55/20/584015520.db2.gz LHRDBCFBVYOQDC-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO CCC[C@@H]([NH2+][C@H]1CC[C@@H](C)SC1)C(=O)OC ZINC000897834064 584052943 /nfs/dbraw/zinc/05/29/43/584052943.db2.gz GJOMBWQAFZTMCK-OUAUKWLOSA-N 1 2 245.388 2.202 20 0 BEADLO CO[C@@H]1CCN(c2[nH+]ccc3ccccc32)C1 ZINC000858435130 588954343 /nfs/dbraw/zinc/95/43/43/588954343.db2.gz WXXFVMWIKGAHEH-GFCCVEGCSA-N 1 2 228.295 2.460 20 0 BEADLO CSc1ccc(C[NH2+]Cc2cn(C)cn2)o1 ZINC000898043602 584081534 /nfs/dbraw/zinc/08/15/34/584081534.db2.gz VFBOFEOIRCINAM-UHFFFAOYSA-N 1 2 237.328 2.025 20 0 BEADLO Cc1cnc(C[NH+]2CC(Cc3ccoc3)C2)o1 ZINC000898160221 584087876 /nfs/dbraw/zinc/08/78/76/584087876.db2.gz WEVAKDBZZPKTJL-UHFFFAOYSA-N 1 2 232.283 2.251 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@@H](O)[C@H](F)C2)ccc1F ZINC000898191246 584095646 /nfs/dbraw/zinc/09/56/46/584095646.db2.gz AGMLSCIPLOZLAN-CHWSQXEVSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@@H](O)[C@H](F)C2)ccc1F ZINC000898191246 584095647 /nfs/dbraw/zinc/09/56/47/584095647.db2.gz AGMLSCIPLOZLAN-CHWSQXEVSA-N 1 2 241.281 2.039 20 0 BEADLO CCC(F)(F)C[NH2+][C@@H](C)c1cc(C)nn1C ZINC000858506304 588961519 /nfs/dbraw/zinc/96/15/19/588961519.db2.gz GHKQPSITMQJLRR-VIFPVBQESA-N 1 2 231.290 2.424 20 0 BEADLO CC(C)[C@@H](C)C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000898902380 584165310 /nfs/dbraw/zinc/16/53/10/584165310.db2.gz NDRIQBROZHTJLT-LLVKDONJSA-N 1 2 237.347 2.027 20 0 BEADLO C[C@H]1CC[C@H](C(=O)NCC(C)(C)n2cc[nH+]c2)C1 ZINC000898905866 584165515 /nfs/dbraw/zinc/16/55/15/584165515.db2.gz HXSYLYBYRKTGOF-RYUDHWBXSA-N 1 2 249.358 2.171 20 0 BEADLO C=C/C=C\CCNC(=O)C(C)(C)n1c[nH+]c(C)c1 ZINC000899203135 584181157 /nfs/dbraw/zinc/18/11/57/584181157.db2.gz HZJDQNACHQKCQS-SREVYHEPSA-N 1 2 247.342 2.175 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC1(C2CC2)CCC1 ZINC000899823143 584240178 /nfs/dbraw/zinc/24/01/78/584240178.db2.gz WWDIJHAZHZKVPH-SNVBAGLBSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC1(C2CC2)CCC1 ZINC000899823143 584240181 /nfs/dbraw/zinc/24/01/81/584240181.db2.gz WWDIJHAZHZKVPH-SNVBAGLBSA-N 1 2 247.342 2.037 20 0 BEADLO Cc1cccc([C@H](O)C[NH+]2CC(OC(C)C)C2)c1 ZINC000899901589 584250317 /nfs/dbraw/zinc/25/03/17/584250317.db2.gz PQBJYZSXSZLRRS-OAHLLOKOSA-N 1 2 249.354 2.138 20 0 BEADLO CCCCN(CC)C(=O)CNc1cccc[nH+]1 ZINC000899937593 584258681 /nfs/dbraw/zinc/25/86/81/584258681.db2.gz PYXGKMYHWAEBCE-UHFFFAOYSA-N 1 2 235.331 2.142 20 0 BEADLO CCCCC[C@@H](C)NC(=O)Cc1c[nH]c[nH+]1 ZINC000900111513 584276719 /nfs/dbraw/zinc/27/67/19/584276719.db2.gz YADFUXXEKLGNCK-SNVBAGLBSA-N 1 2 223.320 2.037 20 0 BEADLO CCCCC[C@@H](C)NC(=O)Cc1c[nH+]c[nH]1 ZINC000900111513 584276720 /nfs/dbraw/zinc/27/67/20/584276720.db2.gz YADFUXXEKLGNCK-SNVBAGLBSA-N 1 2 223.320 2.037 20 0 BEADLO CCCC[C@@H](CC)CNC(=O)Cc1c[nH]c[nH+]1 ZINC000900111393 584276757 /nfs/dbraw/zinc/27/67/57/584276757.db2.gz UMGVFFPCGCNTSH-LLVKDONJSA-N 1 2 237.347 2.285 20 0 BEADLO CCCC[C@@H](CC)CNC(=O)Cc1c[nH+]c[nH]1 ZINC000900111393 584276758 /nfs/dbraw/zinc/27/67/58/584276758.db2.gz UMGVFFPCGCNTSH-LLVKDONJSA-N 1 2 237.347 2.285 20 0 BEADLO CCC(CC)CN(CC)C(=O)Cc1c[nH+]c[nH]1 ZINC000900201366 584286919 /nfs/dbraw/zinc/28/69/19/584286919.db2.gz YTQLURHEZIYZAM-UHFFFAOYSA-N 1 2 237.347 2.237 20 0 BEADLO C[C@H]1CN(C(=O)Cc2c[nH+]c[nH]2)c2ccccc21 ZINC000900218990 584287148 /nfs/dbraw/zinc/28/71/48/584287148.db2.gz PLUNAGYXNLXTAI-JTQLQIEISA-N 1 2 241.294 2.103 20 0 BEADLO C[C@H]1CN(C(=O)Cc2c[nH]c[nH+]2)c2ccccc21 ZINC000900218990 584287151 /nfs/dbraw/zinc/28/71/51/584287151.db2.gz PLUNAGYXNLXTAI-JTQLQIEISA-N 1 2 241.294 2.103 20 0 BEADLO CC[C@@H](C)[C@H](C)NC(=O)CNc1cccc[nH+]1 ZINC000900365667 584296753 /nfs/dbraw/zinc/29/67/53/584296753.db2.gz PVILJBRHRSBEBQ-MNOVXSKESA-N 1 2 235.331 2.044 20 0 BEADLO CC(C)CN(C(=O)Cc1c[nH+]c[nH]1)C1CCCC1 ZINC000900421088 584306988 /nfs/dbraw/zinc/30/69/88/584306988.db2.gz GBGMHVFUUHRJCP-UHFFFAOYSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H](NC(=O)CNc1cccc[nH+]1)C1CCCC1 ZINC000900711431 584343850 /nfs/dbraw/zinc/34/38/50/584343850.db2.gz AZELJOPKUSNJJA-NSHDSACASA-N 1 2 247.342 2.188 20 0 BEADLO CC[C@H](C)[C@@H]1CCCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC000900771787 584349083 /nfs/dbraw/zinc/34/90/83/584349083.db2.gz DFSCOIFZNFUKDV-AAEUAGOBSA-N 1 2 249.358 2.379 20 0 BEADLO C/C=C/CNc1nc(C)[nH+]c(NC/C=C\C)n1 ZINC000858800555 588976856 /nfs/dbraw/zinc/97/68/56/588976856.db2.gz QLJFAOFGJNNPIN-XGXWUAJZSA-N 1 2 233.319 2.156 20 0 BEADLO C/C=C/CNc1nc(NC/C=C\C)nc(C)[nH+]1 ZINC000858800555 588976857 /nfs/dbraw/zinc/97/68/57/588976857.db2.gz QLJFAOFGJNNPIN-XGXWUAJZSA-N 1 2 233.319 2.156 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)N[C@H]1C[C@H]1C1CCCCC1 ZINC000900836529 584359175 /nfs/dbraw/zinc/35/91/75/584359175.db2.gz ORWGTQOUHPRCCM-STQMWFEESA-N 1 2 247.342 2.037 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)N[C@H]1C[C@H]1C1CCCCC1 ZINC000900836529 584359176 /nfs/dbraw/zinc/35/91/76/584359176.db2.gz ORWGTQOUHPRCCM-STQMWFEESA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H]1c2ccccc2CN1C(=O)Cc1c[nH+]c[nH]1 ZINC000900924101 584365595 /nfs/dbraw/zinc/36/55/95/584365595.db2.gz VOANFDSHHKXULV-JTQLQIEISA-N 1 2 241.294 2.056 20 0 BEADLO CC[C@@H](C)CN(CC)C(=O)CNc1cccc[nH+]1 ZINC000900943760 584368749 /nfs/dbraw/zinc/36/87/49/584368749.db2.gz FTTBFPIOOPQPLI-GFCCVEGCSA-N 1 2 249.358 2.388 20 0 BEADLO C[C@H](N(C)C(=O)CNc1cccc[nH+]1)C1(C)CC1 ZINC000900988577 584372977 /nfs/dbraw/zinc/37/29/77/584372977.db2.gz MHAPRABYZKNEBD-NSHDSACASA-N 1 2 247.342 2.141 20 0 BEADLO CC(C)C(NC(=O)CNc1cccc[nH+]1)C(C)C ZINC000901140432 584389838 /nfs/dbraw/zinc/38/98/38/584389838.db2.gz SBABUVGSDGQEOY-UHFFFAOYSA-N 1 2 249.358 2.290 20 0 BEADLO CC(C)c1cccnc1NC(=O)Cc1c[nH+]c[nH]1 ZINC000901185013 584392909 /nfs/dbraw/zinc/39/29/09/584392909.db2.gz HEMGGLWMEKPOKE-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO CC(C)c1cccnc1NC(=O)Cc1c[nH]c[nH+]1 ZINC000901185013 584392911 /nfs/dbraw/zinc/39/29/11/584392911.db2.gz HEMGGLWMEKPOKE-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO CNc1[nH+]c(C)ccc1C(=O)N1CC(C(C)C)C1 ZINC000901191230 584396433 /nfs/dbraw/zinc/39/64/33/584396433.db2.gz RVVBJIZTPXKEKT-UHFFFAOYSA-N 1 2 247.342 2.160 20 0 BEADLO CNc1[nH+]c(C)ccc1C(=O)N1CC=C(C)CC1 ZINC000901204266 584399292 /nfs/dbraw/zinc/39/92/92/584399292.db2.gz VRMIZUMWAOUWJF-UHFFFAOYSA-N 1 2 245.326 2.224 20 0 BEADLO CC(C)(C)C1=CCN(C(=O)Cc2c[nH+]c[nH]2)CC1 ZINC000901230378 584403557 /nfs/dbraw/zinc/40/35/57/584403557.db2.gz VUNBCDRKTKFIQV-UHFFFAOYSA-N 1 2 247.342 2.157 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)N1CCCC12CCCCC2 ZINC000901237947 584405700 /nfs/dbraw/zinc/40/57/00/584405700.db2.gz ULEMHKRPKFDNDJ-UHFFFAOYSA-N 1 2 247.342 2.278 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1C(=O)CNc1cccc[nH+]1 ZINC000901299871 584418887 /nfs/dbraw/zinc/41/88/87/584418887.db2.gz CXLRCQXRFLDNOP-NWDGAFQWSA-N 1 2 247.342 2.283 20 0 BEADLO Cc1ccccc1-c1cc([C@H]2COCC[NH2+]2)on1 ZINC000901388665 584436915 /nfs/dbraw/zinc/43/69/15/584436915.db2.gz XCNRMUPYVAVIDB-CYBMUJFWSA-N 1 2 244.294 2.311 20 0 BEADLO C[C@@H](O)CC[NH2+]c1ccc2c(c1)C[C@@H](C)O2 ZINC000901445410 584446918 /nfs/dbraw/zinc/44/69/18/584446918.db2.gz BBWBXLCTVYVSKX-NXEZZACHSA-N 1 2 221.300 2.193 20 0 BEADLO C[C@@H]1Cc2cc([NH2+]CCC3(O)CC3)ccc2O1 ZINC000901448605 584447776 /nfs/dbraw/zinc/44/77/76/584447776.db2.gz VUAKKBOSHDVMBU-SNVBAGLBSA-N 1 2 233.311 2.337 20 0 BEADLO C[C@@H]1C[C@H](COCc2[nH]cc[nH+]2)C[C@H](C)O1 ZINC000901531534 584459088 /nfs/dbraw/zinc/45/90/88/584459088.db2.gz ZLYFPARPPAPSJL-URLYPYJESA-N 1 2 224.304 2.130 20 0 BEADLO COc1c(C)c[nH+]c(CSC2COC2)c1C ZINC000901644435 584474791 /nfs/dbraw/zinc/47/47/91/584474791.db2.gz QRHLSHIRDQQOKJ-UHFFFAOYSA-N 1 2 239.340 2.339 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OCCOC1CC1 ZINC000902122938 584528695 /nfs/dbraw/zinc/52/86/95/584528695.db2.gz FRBLZYCXJNJFOE-UHFFFAOYSA-N 1 2 234.299 2.021 20 0 BEADLO Cc1nc(NCc2cn(C)nc2C2CC2)cc[nH+]1 ZINC000902125836 584529384 /nfs/dbraw/zinc/52/93/84/584529384.db2.gz CHHAYRSAMPKSSX-UHFFFAOYSA-N 1 2 243.314 2.008 20 0 BEADLO CCc1ncc(NCc2[nH+]ccn2C(C)C)cn1 ZINC000902202865 584538123 /nfs/dbraw/zinc/53/81/23/584538123.db2.gz XORMQJMFRLLBGG-UHFFFAOYSA-N 1 2 245.330 2.429 20 0 BEADLO CNc1ccccc1C[NH2+]Cc1cocn1 ZINC000902218701 584539857 /nfs/dbraw/zinc/53/98/57/584539857.db2.gz UJGWPUXGUUJDGA-UHFFFAOYSA-N 1 2 217.272 2.006 20 0 BEADLO CCn1c[nH+]c(CNc2cncc(C)c2)c1 ZINC000902403970 584589203 /nfs/dbraw/zinc/58/92/03/584589203.db2.gz GKLWKCCJKVZOIK-UHFFFAOYSA-N 1 2 216.288 2.219 20 0 BEADLO Cc1cncc([C@@H](C)[NH2+]Cc2csc(N)n2)c1 ZINC000902500491 584619712 /nfs/dbraw/zinc/61/97/12/584619712.db2.gz WSDIGQVALTXKGG-SECBINFHSA-N 1 2 248.355 2.280 20 0 BEADLO C[C@@H]([NH2+]Cc1csc(N)n1)c1ccoc1 ZINC000902487049 584625852 /nfs/dbraw/zinc/62/58/52/584625852.db2.gz AWIOFKVOJYZPSQ-SSDOTTSWSA-N 1 2 223.301 2.169 20 0 BEADLO C[C@@H]([NH2+]Cc1csc(N)n1)c1cccc(O)c1 ZINC000902487707 584626016 /nfs/dbraw/zinc/62/60/16/584626016.db2.gz CYKDZQMCJSYBLH-MRVPVSSYSA-N 1 2 249.339 2.282 20 0 BEADLO C[C@@H]([NH2+]Cc1csc(N)n1)c1ccco1 ZINC000902486879 584626189 /nfs/dbraw/zinc/62/61/89/584626189.db2.gz DOHZHSFYWJWPHX-SSDOTTSWSA-N 1 2 223.301 2.169 20 0 BEADLO C[C@@H]([NH2+]Cc1csc(N)n1)c1cncs1 ZINC000902488580 584627292 /nfs/dbraw/zinc/62/72/92/584627292.db2.gz HMKYEQQKENODOQ-ZCFIWIBFSA-N 1 2 240.357 2.033 20 0 BEADLO Cc1ccc(Cn2cc3c(n2)C(=O)CCC3)c[nH+]1 ZINC000902544002 584629633 /nfs/dbraw/zinc/62/96/33/584629633.db2.gz YQZSJOADBGSLCP-UHFFFAOYSA-N 1 2 241.294 2.154 20 0 BEADLO COC[C@@H](COc1ccc2c[nH+]ccc2c1)OC ZINC000902637020 584648222 /nfs/dbraw/zinc/64/82/22/584648222.db2.gz GERJLECVZFWMOG-AWEZNQCLSA-N 1 2 247.294 2.275 20 0 BEADLO Cn1c[nH+]c2cc(OC[C@@H]3CCCO3)ccc21 ZINC000902781088 584670329 /nfs/dbraw/zinc/67/03/29/584670329.db2.gz DSUJNVAJGSGTMR-NSHDSACASA-N 1 2 232.283 2.131 20 0 BEADLO COc1ccc2[nH+]ccc(OCC[C@@H](C)O)c2c1 ZINC000902901631 584693301 /nfs/dbraw/zinc/69/33/01/584693301.db2.gz XPIFPCIANXEFRT-SNVBAGLBSA-N 1 2 247.294 2.393 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc(Cl)n(C)n2)CCS1 ZINC000859118786 589004917 /nfs/dbraw/zinc/00/49/17/589004917.db2.gz HNIVXHDDJRXBSA-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc(Cl)n(C)n2)CCS1 ZINC000859118786 589004919 /nfs/dbraw/zinc/00/49/19/589004919.db2.gz HNIVXHDDJRXBSA-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO Fc1cccc(C[N@H+]2CCC[C@H](F)C2)n1 ZINC000902993526 584711616 /nfs/dbraw/zinc/71/16/16/584711616.db2.gz SWAWRXPDRCKOEC-VIFPVBQESA-N 1 2 212.243 2.155 20 0 BEADLO Fc1cccc(C[N@@H+]2CCC[C@H](F)C2)n1 ZINC000902993526 584711617 /nfs/dbraw/zinc/71/16/17/584711617.db2.gz SWAWRXPDRCKOEC-VIFPVBQESA-N 1 2 212.243 2.155 20 0 BEADLO COc1cc(C[N@@H+]2CCC[C@H](F)C2)ccn1 ZINC000902994605 584712157 /nfs/dbraw/zinc/71/21/57/584712157.db2.gz FZENONBZGLOMPQ-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO COc1cc(C[N@H+]2CCC[C@H](F)C2)ccn1 ZINC000902994605 584712159 /nfs/dbraw/zinc/71/21/59/584712159.db2.gz FZENONBZGLOMPQ-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO CCC(C)(C)NC(=O)[C@H](C)[N@@H+]1CCC[C@H](F)C1 ZINC000903001707 584716376 /nfs/dbraw/zinc/71/63/76/584716376.db2.gz PUJLJNVUKTZNTL-QWRGUYRKSA-N 1 2 244.354 2.114 20 0 BEADLO CCC(C)(C)NC(=O)[C@H](C)[N@H+]1CCC[C@H](F)C1 ZINC000903001707 584716378 /nfs/dbraw/zinc/71/63/78/584716378.db2.gz PUJLJNVUKTZNTL-QWRGUYRKSA-N 1 2 244.354 2.114 20 0 BEADLO Cc1cc(N[C@@H](C)c2cn(C)nn2)c[nH+]c1C ZINC000903087336 584725546 /nfs/dbraw/zinc/72/55/46/584725546.db2.gz FRHGQQUMDKXOFD-JTQLQIEISA-N 1 2 231.303 2.000 20 0 BEADLO CC(C)N(C(=O)/C=C/c1cn(C)c[nH+]1)C(C)C ZINC000903141863 584730652 /nfs/dbraw/zinc/73/06/52/584730652.db2.gz SLEVJOCVTJLEEW-VOTSOKGWSA-N 1 2 235.331 2.079 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@@H]1CC[C@H](C2CC2)O1 ZINC000903250869 584738910 /nfs/dbraw/zinc/73/89/10/584738910.db2.gz DSURMINIFCMXOR-DUFXMDAXSA-N 1 2 249.358 2.326 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1cncs1)c1ccn(C)n1 ZINC000903312638 584748215 /nfs/dbraw/zinc/74/82/15/584748215.db2.gz XMIPDLJHXBIPLJ-RKDXNWHRSA-N 1 2 236.344 2.288 20 0 BEADLO C[C@@H]([NH2+]Cc1cn(C)cn1)c1cc(O)ccc1F ZINC000903350512 584754681 /nfs/dbraw/zinc/75/46/81/584754681.db2.gz CIMUDTCFSCTIER-SECBINFHSA-N 1 2 249.289 2.116 20 0 BEADLO C[C@@H](NCc1cn(C)c[nH+]1)c1cc(O)ccc1F ZINC000903350512 584754682 /nfs/dbraw/zinc/75/46/82/584754682.db2.gz CIMUDTCFSCTIER-SECBINFHSA-N 1 2 249.289 2.116 20 0 BEADLO CCc1cccnc1[C@H](C)[NH2+]Cc1cn(C)cn1 ZINC000903351124 584755510 /nfs/dbraw/zinc/75/55/10/584755510.db2.gz HYPHWQIJWHUEIG-NSHDSACASA-N 1 2 244.342 2.228 20 0 BEADLO Cl/C=C\C[NH2+][C@H]1CCCc2[nH]ncc21 ZINC000903444133 584768940 /nfs/dbraw/zinc/76/89/40/584768940.db2.gz NFEJTKYEGBQVGL-ANTNXHBISA-N 1 2 211.696 2.129 20 0 BEADLO Fc1cccc(CCCN2CC=CC[NH2+]2)c1 ZINC000903489098 584780653 /nfs/dbraw/zinc/78/06/53/584780653.db2.gz DYQSYSSHRBQIRM-UHFFFAOYSA-N 1 2 220.291 2.135 20 0 BEADLO Cn1nc(C[N@@H+]2CCC(C)(C)C2)cc1Cl ZINC000859150192 589009999 /nfs/dbraw/zinc/00/99/99/589009999.db2.gz QLNWOJSKISGTGN-UHFFFAOYSA-N 1 2 227.739 2.305 20 0 BEADLO Cn1nc(C[N@H+]2CCC(C)(C)C2)cc1Cl ZINC000859150192 589010001 /nfs/dbraw/zinc/01/00/01/589010001.db2.gz QLNWOJSKISGTGN-UHFFFAOYSA-N 1 2 227.739 2.305 20 0 BEADLO Cn1nc(C[N@@H+]2CCC3(CCC3)C2)cc1Cl ZINC000859162962 589012136 /nfs/dbraw/zinc/01/21/36/589012136.db2.gz AEKXHIWQNSCNQV-UHFFFAOYSA-N 1 2 239.750 2.450 20 0 BEADLO Cn1nc(C[N@H+]2CCC3(CCC3)C2)cc1Cl ZINC000859162962 589012137 /nfs/dbraw/zinc/01/21/37/589012137.db2.gz AEKXHIWQNSCNQV-UHFFFAOYSA-N 1 2 239.750 2.450 20 0 BEADLO CCO[C@@H](C)c1nc(-c2ccc(N)[nH+]c2C)no1 ZINC000904258844 584859392 /nfs/dbraw/zinc/85/93/92/584859392.db2.gz UFRGRGMMAXLCHC-QMMMGPOBSA-N 1 2 248.286 2.120 20 0 BEADLO Cc1[nH+]c(N)ccc1-c1noc(C(C)(C)C)n1 ZINC000904259854 584859428 /nfs/dbraw/zinc/85/94/28/584859428.db2.gz KAJWCVOXOHTMBW-UHFFFAOYSA-N 1 2 232.287 2.320 20 0 BEADLO CCCCc1nc(-c2c[nH+]c(N)cc2C)no1 ZINC000904273343 584859978 /nfs/dbraw/zinc/85/99/78/584859978.db2.gz ZWRZVLURUTWGEK-UHFFFAOYSA-N 1 2 232.287 2.365 20 0 BEADLO CCC1(CC)CCCN1C(=O)Cc1[nH]c[nH+]c1C ZINC000874630134 584883186 /nfs/dbraw/zinc/88/31/86/584883186.db2.gz ORSNXIJKPSPGGT-UHFFFAOYSA-N 1 2 249.358 2.442 20 0 BEADLO CCCOC(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000859180924 589014997 /nfs/dbraw/zinc/01/49/97/589014997.db2.gz RPMNNWGWERXWRW-DTWKUNHWSA-N 1 2 223.276 2.025 20 0 BEADLO CCOC(=O)C[N@H+](C/C=C\Cl)C(C)C ZINC000219545605 584912083 /nfs/dbraw/zinc/91/20/83/584912083.db2.gz PAFZDUCPZWUURW-WAYWQWQTSA-N 1 2 219.712 2.012 20 0 BEADLO CCOC(=O)C[N@@H+](C/C=C\Cl)C(C)C ZINC000219545605 584912084 /nfs/dbraw/zinc/91/20/84/584912084.db2.gz PAFZDUCPZWUURW-WAYWQWQTSA-N 1 2 219.712 2.012 20 0 BEADLO CC(C)[N@H+](CC(F)F)C[C@H]1CC2(CC2)C(=O)O1 ZINC000763711210 584924015 /nfs/dbraw/zinc/92/40/15/584924015.db2.gz UBWKXIUESWIJPP-SECBINFHSA-N 1 2 247.285 2.058 20 0 BEADLO CC(C)[N@@H+](CC(F)F)C[C@H]1CC2(CC2)C(=O)O1 ZINC000763711210 584924016 /nfs/dbraw/zinc/92/40/16/584924016.db2.gz UBWKXIUESWIJPP-SECBINFHSA-N 1 2 247.285 2.058 20 0 BEADLO C[N@H+](CCOc1cccc(F)c1)Cc1ncc[nH]1 ZINC000731849343 584929535 /nfs/dbraw/zinc/92/95/35/584929535.db2.gz WZNGUCVQNUMBPP-UHFFFAOYSA-N 1 2 249.289 2.060 20 0 BEADLO C[N@@H+](CCOc1cccc(F)c1)Cc1ncc[nH]1 ZINC000731849343 584929536 /nfs/dbraw/zinc/92/95/36/584929536.db2.gz WZNGUCVQNUMBPP-UHFFFAOYSA-N 1 2 249.289 2.060 20 0 BEADLO CCCCCCNC(=O)c1c[nH+]c(C)[nH]1 ZINC000731867544 584930650 /nfs/dbraw/zinc/93/06/50/584930650.db2.gz MBXQFFJNAMLJBR-UHFFFAOYSA-N 1 2 209.293 2.028 20 0 BEADLO CCc1nc(N[C@@H](CO)C2CCCC2)cc[nH+]1 ZINC000884511868 584954828 /nfs/dbraw/zinc/95/48/28/584954828.db2.gz RSSIJIWZBWPAJE-NSHDSACASA-N 1 2 235.331 2.002 20 0 BEADLO C[C@H](CNC(=O)CCn1cc[nH+]c1)C(C)(C)C ZINC000734340965 584960880 /nfs/dbraw/zinc/96/08/80/584960880.db2.gz REOPQPQOTPXXQH-LLVKDONJSA-N 1 2 237.347 2.072 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819775896 585007064 /nfs/dbraw/zinc/00/70/64/585007064.db2.gz KMSCGQPUQLLYBV-YIZRAAEISA-N 1 2 228.361 2.276 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)[C@@]2(C)CCC[C@H]2C)S1 ZINC000819781052 585007596 /nfs/dbraw/zinc/00/75/96/585007596.db2.gz KZWCXQHEQXVYOS-LNLATYFQSA-N 1 2 240.372 2.420 20 0 BEADLO C/C(=C/C(C)(C)C)C(=O)NCc1cn(C)c[nH+]1 ZINC000890107657 585023676 /nfs/dbraw/zinc/02/36/76/585023676.db2.gz OSKWHWSWFVCFHQ-POHAHGRESA-N 1 2 235.331 2.029 20 0 BEADLO CCC(CC)C(=O)O[C@H]1CC[N@H+](CCF)C1 ZINC000788081456 585027569 /nfs/dbraw/zinc/02/75/69/585027569.db2.gz QINNATWQMHSMBS-NSHDSACASA-N 1 2 231.311 2.010 20 0 BEADLO CCC(CC)C(=O)O[C@H]1CC[N@@H+](CCF)C1 ZINC000788081456 585027570 /nfs/dbraw/zinc/02/75/70/585027570.db2.gz QINNATWQMHSMBS-NSHDSACASA-N 1 2 231.311 2.010 20 0 BEADLO O=C(C[C@@H]1CC[C@H]2C[C@H]21)OCCCn1cc[nH+]c1 ZINC000838123058 585046475 /nfs/dbraw/zinc/04/64/75/585046475.db2.gz MIZFJYPCMNFMGK-RWMBFGLXSA-N 1 2 248.326 2.253 20 0 BEADLO C[C@@H](C(=O)OCCCn1cc[nH+]c1)C1CCC1 ZINC000838389579 585055955 /nfs/dbraw/zinc/05/59/55/585055955.db2.gz SZLFEPQRNXDHHZ-LLVKDONJSA-N 1 2 236.315 2.253 20 0 BEADLO Cn1ncc(C[NH+]2CC3(C2)CCCC3)c1Cl ZINC000839107048 585091244 /nfs/dbraw/zinc/09/12/44/585091244.db2.gz UEEIWZNZSZNFJV-UHFFFAOYSA-N 1 2 239.750 2.450 20 0 BEADLO Cc1cccc(C[NH+]2CC(O)(C(C)C)C2)c1F ZINC000839133717 585094055 /nfs/dbraw/zinc/09/40/55/585094055.db2.gz VGZPQGYWCYCDDB-UHFFFAOYSA-N 1 2 237.318 2.337 20 0 BEADLO C[C@@H]1C[C@H](C)C[N@H+]1Cn1ncsc1=S ZINC000740861311 585107717 /nfs/dbraw/zinc/10/77/17/585107717.db2.gz MWDCRJQHMLCLSC-JGVFFNPUSA-N 1 2 229.374 2.362 20 0 BEADLO C[C@@H]1C[C@H](C)C[N@@H+]1Cn1ncsc1=S ZINC000740861311 585107718 /nfs/dbraw/zinc/10/77/18/585107718.db2.gz MWDCRJQHMLCLSC-JGVFFNPUSA-N 1 2 229.374 2.362 20 0 BEADLO CCc1cc(NC[C@@H](O)c2ccc(C)o2)nc[nH+]1 ZINC000741244961 585111789 /nfs/dbraw/zinc/11/17/89/585111789.db2.gz ZTPGGKWQJXRUDV-LLVKDONJSA-N 1 2 247.298 2.086 20 0 BEADLO CC(=CC(=O)NCc1c[nH+]c[nH]1)c1ccccc1 ZINC000742178991 585122741 /nfs/dbraw/zinc/12/27/41/585122741.db2.gz PSVNSIGUOSTRLS-XFFZJAGNSA-N 1 2 241.294 2.129 20 0 BEADLO CC(=CC(=O)NCc1c[nH]c[nH+]1)c1ccccc1 ZINC000742178991 585122742 /nfs/dbraw/zinc/12/27/42/585122742.db2.gz PSVNSIGUOSTRLS-XFFZJAGNSA-N 1 2 241.294 2.129 20 0 BEADLO Cc1cnc(CO[NH+]=C(N)c2cccc(F)c2)o1 ZINC000742356117 585124754 /nfs/dbraw/zinc/12/47/54/585124754.db2.gz HRTAPHZKVIQXMK-UHFFFAOYSA-N 1 2 249.245 2.169 20 0 BEADLO C[C@H]([NH2+]Cc1coc(C2CC2)n1)c1cnn(C)c1 ZINC000742372130 585124970 /nfs/dbraw/zinc/12/49/70/585124970.db2.gz HRXPWHWKFKKTSH-VIFPVBQESA-N 1 2 246.314 2.136 20 0 BEADLO C[C@@H]([NH2+]Cc1coc(C2CC2)n1)c1cnn(C)c1 ZINC000742372126 585125099 /nfs/dbraw/zinc/12/50/99/585125099.db2.gz HRXPWHWKFKKTSH-SECBINFHSA-N 1 2 246.314 2.136 20 0 BEADLO C/C(=C\C(=O)N(C)Cc1[nH]cc[nH+]1)C(C)(C)C ZINC000742650294 585129319 /nfs/dbraw/zinc/12/93/19/585129319.db2.gz NEYJGCSINTWXEJ-CSKARUKUSA-N 1 2 235.331 2.361 20 0 BEADLO C/C(=C/C(=O)N(C)Cc1[nH]cc[nH+]1)C(C)(C)C ZINC000742650295 585129326 /nfs/dbraw/zinc/12/93/26/585129326.db2.gz NEYJGCSINTWXEJ-NTMALXAHSA-N 1 2 235.331 2.361 20 0 BEADLO Cc1ccc([C@H](C)C(=O)Nc2cc[nH+]c(C)c2)o1 ZINC000742664472 585129544 /nfs/dbraw/zinc/12/95/44/585129544.db2.gz DIVUVAVFCIKGIC-NSHDSACASA-N 1 2 244.294 2.456 20 0 BEADLO CN1c2cc([NH2+]CC(C)(C)C)ccc2OCC1=O ZINC000743500515 585137399 /nfs/dbraw/zinc/13/73/99/585137399.db2.gz GSHWMMOGWKWLTD-UHFFFAOYSA-N 1 2 248.326 2.500 20 0 BEADLO O=C(Cc1cn2ccccc2[nH+]1)OCCC1CC1 ZINC000744283565 585147211 /nfs/dbraw/zinc/14/72/11/585147211.db2.gz XLYKLVCWUNVVRL-UHFFFAOYSA-N 1 2 244.294 2.220 20 0 BEADLO COc1cc2c(cc1OC)C[N@H+](CCF)CC2 ZINC000746499238 585168910 /nfs/dbraw/zinc/16/89/10/585168910.db2.gz IBXZATJMRHLULV-UHFFFAOYSA-N 1 2 239.290 2.031 20 0 BEADLO COc1cc2c(cc1OC)C[N@@H+](CCF)CC2 ZINC000746499238 585168911 /nfs/dbraw/zinc/16/89/11/585168911.db2.gz IBXZATJMRHLULV-UHFFFAOYSA-N 1 2 239.290 2.031 20 0 BEADLO Cc1ccc(C[N@H+](C)Cn2ccsc2=O)cc1 ZINC000746605628 585170670 /nfs/dbraw/zinc/17/06/70/585170670.db2.gz STUOLBSZZIMGNI-UHFFFAOYSA-N 1 2 248.351 2.308 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cn2ccsc2=O)cc1 ZINC000746605628 585170671 /nfs/dbraw/zinc/17/06/71/585170671.db2.gz STUOLBSZZIMGNI-UHFFFAOYSA-N 1 2 248.351 2.308 20 0 BEADLO CC1CCC(CO[NH+]=C(N)[C@@H]2CCCO2)CC1 ZINC000789609268 585172973 /nfs/dbraw/zinc/17/29/73/585172973.db2.gz MPUKFXNMMVWXKX-MCIGGMRASA-N 1 2 240.347 2.490 20 0 BEADLO Cc1ccc([C@@H](C)C(=O)OCc2c[nH+]cn2C)o1 ZINC000747780713 585184288 /nfs/dbraw/zinc/18/42/88/585184288.db2.gz HORUKKWYBNXJDY-SNVBAGLBSA-N 1 2 248.282 2.168 20 0 BEADLO CC(C)c1cnc(C[N@@H+]2CCCOC[C@@H]2C)o1 ZINC000749512782 585203064 /nfs/dbraw/zinc/20/30/64/585203064.db2.gz CGCXVCLTHWDVJB-NSHDSACASA-N 1 2 238.331 2.409 20 0 BEADLO CC(C)c1cnc(C[N@H+]2CCCOC[C@@H]2C)o1 ZINC000749512782 585203065 /nfs/dbraw/zinc/20/30/65/585203065.db2.gz CGCXVCLTHWDVJB-NSHDSACASA-N 1 2 238.331 2.409 20 0 BEADLO C/C=C(\C)C(=O)NCc1[nH+]cc(C)c(OC)c1C ZINC000751366273 585227792 /nfs/dbraw/zinc/22/77/92/585227792.db2.gz WOURTDKPSAGEOI-RMKNXTFCSA-N 1 2 248.326 2.289 20 0 BEADLO Nc1ccc(CCC(=O)OC2CCCC2)c[nH+]1 ZINC000751443004 585230446 /nfs/dbraw/zinc/23/04/46/585230446.db2.gz OYEFDMWRRZNSIB-UHFFFAOYSA-N 1 2 234.299 2.082 20 0 BEADLO CCC[C@@H](C)OC(=O)CCc1ccc(N)[nH+]c1 ZINC000751454977 585230548 /nfs/dbraw/zinc/23/05/48/585230548.db2.gz FVUGRYBAPUFSED-SNVBAGLBSA-N 1 2 236.315 2.328 20 0 BEADLO C[C@@H]1CC/C(=C/C(=O)N2CC(n3cc[nH+]c3)C2)C1 ZINC000753616138 585264196 /nfs/dbraw/zinc/26/41/96/585264196.db2.gz FOVQRTMPXLKBQU-HBZGRHIISA-N 1 2 245.326 2.013 20 0 BEADLO CC1CCC(=CC(=O)NCc2c[nH+]c[nH]2)CC1 ZINC000754295301 585282402 /nfs/dbraw/zinc/28/24/02/585282402.db2.gz TVLLZHYSFBSCJP-UHFFFAOYSA-N 1 2 233.315 2.162 20 0 BEADLO CC1CCC(=CC(=O)NCc2c[nH]c[nH+]2)CC1 ZINC000754295301 585282403 /nfs/dbraw/zinc/28/24/03/585282403.db2.gz TVLLZHYSFBSCJP-UHFFFAOYSA-N 1 2 233.315 2.162 20 0 BEADLO CCC/C(C)=C/C(=O)NCc1[nH]c[nH+]c1C ZINC000754347033 585282868 /nfs/dbraw/zinc/28/28/68/585282868.db2.gz XRFHBYIXGJDZTL-RMKNXTFCSA-N 1 2 221.304 2.081 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2nccc(N)n2)s1 ZINC000754660668 585288842 /nfs/dbraw/zinc/28/88/42/585288842.db2.gz FBHDZPASCOQYDF-VIFPVBQESA-N 1 2 248.355 2.280 20 0 BEADLO C[C@@H]1CC/C(=C/C(=O)OCc2c[nH+]cn2C)C1 ZINC000754682765 585289058 /nfs/dbraw/zinc/28/90/58/585289058.db2.gz BZKHDHVWOPAKFS-CHPNCVJKSA-N 1 2 234.299 2.210 20 0 BEADLO CCC(C)(C)CC(=O)OCc1c[nH+]cn1C ZINC000754684388 585289442 /nfs/dbraw/zinc/28/94/42/585289442.db2.gz YWZICBMCMXCOJU-UHFFFAOYSA-N 1 2 224.304 2.290 20 0 BEADLO CCC/C(C)=C\C(=O)OCc1c[nH+]cn1C ZINC000754685253 585289501 /nfs/dbraw/zinc/28/95/01/585289501.db2.gz RKPYBEPPBRBCRU-POHAHGRESA-N 1 2 222.288 2.210 20 0 BEADLO CN(C)c1cc(COC(=O)[C@H]2CC2(C)C)cc[nH+]1 ZINC000755913208 585310463 /nfs/dbraw/zinc/31/04/63/585310463.db2.gz JDMFAOSAJQFBFO-LLVKDONJSA-N 1 2 248.326 2.237 20 0 BEADLO CC[C@@H]1CC[N@H+](Cn2ncn(CC)c2=S)C1 ZINC000755924346 585310693 /nfs/dbraw/zinc/31/06/93/585310693.db2.gz KYNLVKLTHWVQKH-SNVBAGLBSA-N 1 2 240.376 2.123 20 0 BEADLO CC[C@@H]1CC[N@@H+](Cn2ncn(CC)c2=S)C1 ZINC000755924346 585310694 /nfs/dbraw/zinc/31/06/94/585310694.db2.gz KYNLVKLTHWVQKH-SNVBAGLBSA-N 1 2 240.376 2.123 20 0 BEADLO Cc1ccnc(C[N@@H+]2CC(C)(C)OCC2(C)C)n1 ZINC000756532783 585320680 /nfs/dbraw/zinc/32/06/80/585320680.db2.gz POLPAOOUAPWVQT-UHFFFAOYSA-N 1 2 249.358 2.174 20 0 BEADLO Cc1ccnc(C[N@H+]2CC(C)(C)OCC2(C)C)n1 ZINC000756532783 585320681 /nfs/dbraw/zinc/32/06/81/585320681.db2.gz POLPAOOUAPWVQT-UHFFFAOYSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@H]([NH2+]Cc1cccc(F)n1)c1ccn(C)n1 ZINC000756769158 585322930 /nfs/dbraw/zinc/32/29/30/585322930.db2.gz OLGVSGNCACQKIN-NSHDSACASA-N 1 2 248.305 2.195 20 0 BEADLO Cc1ccccc1OCC[N@@H+]1CCC(=O)[C@H](C)C1 ZINC000839567229 585330738 /nfs/dbraw/zinc/33/07/38/585330738.db2.gz PEVAUGJMNUCDLG-CYBMUJFWSA-N 1 2 247.338 2.285 20 0 BEADLO Cc1ccccc1OCC[N@H+]1CCC(=O)[C@H](C)C1 ZINC000839567229 585330739 /nfs/dbraw/zinc/33/07/39/585330739.db2.gz PEVAUGJMNUCDLG-CYBMUJFWSA-N 1 2 247.338 2.285 20 0 BEADLO C[C@@H](OC(=O)[C@H]1CCCC[N@@H+]1C)c1ccncc1 ZINC000757711711 585344650 /nfs/dbraw/zinc/34/46/50/585344650.db2.gz RQKWWLAAAKDBDL-DGCLKSJQSA-N 1 2 248.326 2.170 20 0 BEADLO C[C@@H](OC(=O)[C@H]1CCCC[N@H+]1C)c1ccncc1 ZINC000757711711 585344651 /nfs/dbraw/zinc/34/46/51/585344651.db2.gz RQKWWLAAAKDBDL-DGCLKSJQSA-N 1 2 248.326 2.170 20 0 BEADLO C[C@H]1CC[C@H](CC(=O)OCc2c[nH+]cn2C)C1 ZINC000759564100 585376332 /nfs/dbraw/zinc/37/63/32/585376332.db2.gz IRHUZQNUJRBSSZ-QWRGUYRKSA-N 1 2 236.315 2.290 20 0 BEADLO C[C@@H]1CC[C@H](CC(=O)OCc2c[nH+]cn2C)C1 ZINC000759564098 585376336 /nfs/dbraw/zinc/37/63/36/585376336.db2.gz IRHUZQNUJRBSSZ-MNOVXSKESA-N 1 2 236.315 2.290 20 0 BEADLO C[C@]1(c2ccccc2)C[N@H+](CCF)CCO1 ZINC000759755153 585379859 /nfs/dbraw/zinc/37/98/59/585379859.db2.gz PTYXFUNNICGKEV-CYBMUJFWSA-N 1 2 223.291 2.204 20 0 BEADLO C[C@]1(c2ccccc2)C[N@@H+](CCF)CCO1 ZINC000759755153 585379860 /nfs/dbraw/zinc/37/98/60/585379860.db2.gz PTYXFUNNICGKEV-CYBMUJFWSA-N 1 2 223.291 2.204 20 0 BEADLO CCn1ccnc1C[N@@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000761052523 585404414 /nfs/dbraw/zinc/40/44/14/585404414.db2.gz GPDRWSOGTDIHLI-SECBINFHSA-N 1 2 247.264 2.287 20 0 BEADLO CCn1ccnc1C[N@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000761052523 585404415 /nfs/dbraw/zinc/40/44/15/585404415.db2.gz GPDRWSOGTDIHLI-SECBINFHSA-N 1 2 247.264 2.287 20 0 BEADLO Cc1cnc(C[N@@H+]2CC[C@H](C(F)(F)F)C2)nc1 ZINC000761058949 585404633 /nfs/dbraw/zinc/40/46/33/585404633.db2.gz VGDIAEPEFMLGAP-VIFPVBQESA-N 1 2 245.248 2.169 20 0 BEADLO Cc1cnc(C[N@H+]2CC[C@H](C(F)(F)F)C2)nc1 ZINC000761058949 585404634 /nfs/dbraw/zinc/40/46/34/585404634.db2.gz VGDIAEPEFMLGAP-VIFPVBQESA-N 1 2 245.248 2.169 20 0 BEADLO COCC1([N@H+](C)Cc2ncc(C(C)C)o2)CC1 ZINC000761101391 585409437 /nfs/dbraw/zinc/40/94/37/585409437.db2.gz MJZWJIRLQDSDAJ-UHFFFAOYSA-N 1 2 238.331 2.409 20 0 BEADLO COCC1([N@@H+](C)Cc2ncc(C(C)C)o2)CC1 ZINC000761101391 585409438 /nfs/dbraw/zinc/40/94/38/585409438.db2.gz MJZWJIRLQDSDAJ-UHFFFAOYSA-N 1 2 238.331 2.409 20 0 BEADLO Cc1ccc2[nH+]c(COC(=O)C3(C)CC3)cn2c1 ZINC000761431542 585415623 /nfs/dbraw/zinc/41/56/23/585415623.db2.gz LPSYLCHVCZNFNR-UHFFFAOYSA-N 1 2 244.294 2.486 20 0 BEADLO CCCC[C@H]([NH2+][C@@H](C)c1ccc[nH]1)C(=O)OC ZINC000762557345 585434061 /nfs/dbraw/zinc/43/40/61/585434061.db2.gz DHQPXIOQVZCGDP-JQWIXIFHSA-N 1 2 238.331 2.397 20 0 BEADLO O=C(C=C1CCCC1)NCCNc1cccc[nH+]1 ZINC000762796156 585437325 /nfs/dbraw/zinc/43/73/25/585437325.db2.gz LFTITEFZQHWLQI-UHFFFAOYSA-N 1 2 245.326 2.110 20 0 BEADLO O=C(/C=C/c1ccco1)OCCCn1cc[nH+]c1 ZINC000763287882 585445790 /nfs/dbraw/zinc/44/57/90/585445790.db2.gz PIOUVLORPVBIKH-SNAWJCMRSA-N 1 2 246.266 2.123 20 0 BEADLO O=C(CC1CCCC1)OCCCn1cc[nH+]c1 ZINC000763288024 585445914 /nfs/dbraw/zinc/44/59/14/585445914.db2.gz SESZXZLZSUGXGI-UHFFFAOYSA-N 1 2 236.315 2.397 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)c1cccs1 ZINC000763289098 585445931 /nfs/dbraw/zinc/44/59/31/585445931.db2.gz ZHWWNBOOXYOUFK-UHFFFAOYSA-N 1 2 236.296 2.192 20 0 BEADLO CCC/C(C)=C\C(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000764893724 585477301 /nfs/dbraw/zinc/47/73/01/585477301.db2.gz WWBHYEOSNLKZJW-BRNRAETOSA-N 1 2 247.342 2.130 20 0 BEADLO CCCC(C)=CC(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000764893724 585477302 /nfs/dbraw/zinc/47/73/02/585477302.db2.gz WWBHYEOSNLKZJW-BRNRAETOSA-N 1 2 247.342 2.130 20 0 BEADLO CCCOC(=O)[C@H](C)[NH+]1CCC(C(F)F)CC1 ZINC000766190683 585498539 /nfs/dbraw/zinc/49/85/39/585498539.db2.gz POWGSCWFPREJDE-VIFPVBQESA-N 1 2 249.301 2.305 20 0 BEADLO Cc1ccc(C)c(N2CC[NH+](CCF)CC2)c1 ZINC000767052114 585512996 /nfs/dbraw/zinc/51/29/96/585512996.db2.gz ZXGPKEGCDQYJDL-UHFFFAOYSA-N 1 2 236.334 2.395 20 0 BEADLO O=C(NCc1c[nH+]c[nH]1)OCC1CCCCC1 ZINC000859235332 589022994 /nfs/dbraw/zinc/02/29/94/589022994.db2.gz DXEHXTDSFZZYCL-UHFFFAOYSA-N 1 2 237.303 2.216 20 0 BEADLO O=C(NCc1c[nH]c[nH+]1)OCC1CCCCC1 ZINC000859235332 589022995 /nfs/dbraw/zinc/02/29/95/589022995.db2.gz DXEHXTDSFZZYCL-UHFFFAOYSA-N 1 2 237.303 2.216 20 0 BEADLO CC/C=C/CCOC(=O)CCc1ccc(N)[nH+]c1 ZINC000767582138 585522883 /nfs/dbraw/zinc/52/28/83/585522883.db2.gz APKFUZNCVJNNQL-ONEGZZNKSA-N 1 2 248.326 2.496 20 0 BEADLO COC[C@@H](C)SCc1cc[nH+]c(N(C)C)c1 ZINC000767868463 585526902 /nfs/dbraw/zinc/52/69/02/585526902.db2.gz WDZPFWJXEFWUDY-SNVBAGLBSA-N 1 2 240.372 2.416 20 0 BEADLO O=C(CCCn1cc[nH+]c1)N1CCCC12CCC2 ZINC000768103798 585531901 /nfs/dbraw/zinc/53/19/01/585531901.db2.gz BIAWHDNEVQEICT-UHFFFAOYSA-N 1 2 247.342 2.208 20 0 BEADLO C/C=C(/C)C(=O)N1CCC[C@H](c2[nH+]ccn2C)C1 ZINC000768132410 585532453 /nfs/dbraw/zinc/53/24/53/585532453.db2.gz HRGOLQQAILLITI-MCWZUMHDSA-N 1 2 247.342 2.092 20 0 BEADLO CSCCCO[NH+]=C(N)COC(C)(C)C ZINC000768932739 585546067 /nfs/dbraw/zinc/54/60/67/585546067.db2.gz PGHNORRVFCSQKE-UHFFFAOYSA-N 1 2 234.365 2.053 20 0 BEADLO C[C@H]1CCC[C@H]1CC(=O)OCCn1cc[nH+]c1 ZINC000769184116 585550659 /nfs/dbraw/zinc/55/06/59/585550659.db2.gz QCGXXLPPJPFKFC-RYUDHWBXSA-N 1 2 236.315 2.253 20 0 BEADLO C[C@H]1CCC[C@H]1CC(=O)OCc1c[nH+]cn1C ZINC000769303204 585553175 /nfs/dbraw/zinc/55/31/75/585553175.db2.gz HBPPEBPWZDMNRZ-QWRGUYRKSA-N 1 2 236.315 2.290 20 0 BEADLO O=c1ccnc(C=Cc2cccc3[nH+]ccn32)[nH]1 ZINC000769610971 585560607 /nfs/dbraw/zinc/56/06/07/585560607.db2.gz UKUBWYAZSQKWRN-SNAWJCMRSA-N 1 2 238.250 2.000 20 0 BEADLO CCc1ccccc1C(=O)OCc1c[nH+]cn1C ZINC000770602444 585577341 /nfs/dbraw/zinc/57/73/41/585577341.db2.gz PKIJMBKLJYRXTB-UHFFFAOYSA-N 1 2 244.294 2.340 20 0 BEADLO O=C(C=C1CCC1)OCc1cccc2[nH+]ccn21 ZINC000770919976 585584355 /nfs/dbraw/zinc/58/43/55/585584355.db2.gz HLFHRHLMZOKRGY-UHFFFAOYSA-N 1 2 242.278 2.488 20 0 BEADLO O=C(/C=C/c1cccs1)OCCn1cc[nH+]c1 ZINC000771866858 585602849 /nfs/dbraw/zinc/60/28/49/585602849.db2.gz CBWWNRFKACBMHV-ONEGZZNKSA-N 1 2 248.307 2.201 20 0 BEADLO Cc1ccc(COC(=O)[C@H]2C[C@H]2C)c(C)[nH+]1 ZINC000771889433 585603817 /nfs/dbraw/zinc/60/38/17/585603817.db2.gz JHFMROQCCNOTKZ-PELKAZGASA-N 1 2 219.284 2.398 20 0 BEADLO Cc1ccc(COC(=O)C2CC2)c(C)[nH+]1 ZINC000771894312 585604024 /nfs/dbraw/zinc/60/40/24/585604024.db2.gz YEFBZNPQFUBJLQ-UHFFFAOYSA-N 1 2 205.257 2.152 20 0 BEADLO Cc1ccc(F)c(C(=O)OCCn2cc[nH+]c2)c1 ZINC000771954842 585605545 /nfs/dbraw/zinc/60/55/45/585605545.db2.gz VDSYUEPOWKLLSO-UHFFFAOYSA-N 1 2 248.257 2.188 20 0 BEADLO CC(C)CC(C)(C)C(=O)OCCn1cc[nH+]c1 ZINC000771999017 585606526 /nfs/dbraw/zinc/60/65/26/585606526.db2.gz DGNTUCUDDOZRCB-UHFFFAOYSA-N 1 2 238.331 2.499 20 0 BEADLO CCCOCC(=O)OCc1ccc(C)[nH+]c1C ZINC000772053476 585607774 /nfs/dbraw/zinc/60/77/74/585607774.db2.gz UXZIAUGEZRIOQG-UHFFFAOYSA-N 1 2 237.299 2.168 20 0 BEADLO Cc1ccc(COC(=O)[C@H]2CCCOC2)c(C)[nH+]1 ZINC000772088321 585608172 /nfs/dbraw/zinc/60/81/72/585608172.db2.gz MNNSVYJVLXJJQY-ZDUSSCGKSA-N 1 2 249.310 2.168 20 0 BEADLO CCC1(C(=O)OCc2ccc(C)[nH+]c2C)COC1 ZINC000772183542 585609731 /nfs/dbraw/zinc/60/97/31/585609731.db2.gz AIQHULRPEHHVLG-UHFFFAOYSA-N 1 2 249.310 2.168 20 0 BEADLO Cc1cnoc1C(=O)OCc1ccc(C)[nH+]c1C ZINC000772188198 585609780 /nfs/dbraw/zinc/60/97/80/585609780.db2.gz ZPSPFGLAHOKLIW-UHFFFAOYSA-N 1 2 246.266 2.352 20 0 BEADLO COc1cc[nH+]cc1COC(=O)c1cc[nH]c1C ZINC000805485243 585637523 /nfs/dbraw/zinc/63/75/23/585637523.db2.gz HARCWPBAPUNKMC-UHFFFAOYSA-N 1 2 246.266 2.084 20 0 BEADLO COc1cc[nH+]cc1COC(=O)[C@@H]1CC12CCC2 ZINC000805492254 585643220 /nfs/dbraw/zinc/64/32/20/585643220.db2.gz IGVRSWQJVAKWFP-NSHDSACASA-N 1 2 247.294 2.324 20 0 BEADLO C/C=C\C(=O)NCc1ccccc1-n1cc[nH+]c1 ZINC000774166406 585652501 /nfs/dbraw/zinc/65/25/01/585652501.db2.gz DOCJYWDPNDCPIC-DJWKRKHSSA-N 1 2 241.294 2.065 20 0 BEADLO COc1cc[nH+]cc1COC(=O)/C=C\C(C)C ZINC000805540558 585674449 /nfs/dbraw/zinc/67/44/49/585674449.db2.gz UERZXKOYBMCKGS-PLNGDYQASA-N 1 2 235.283 2.346 20 0 BEADLO CC(C)(C)OC1CC([N@@H+]2CCc3cn[nH]c3C2)C1 ZINC000775927582 585687889 /nfs/dbraw/zinc/68/78/89/585687889.db2.gz MJKHONFIICLZLC-UHFFFAOYSA-N 1 2 249.358 2.114 20 0 BEADLO CC(C)(C)OC1CC([N@H+]2CCc3cn[nH]c3C2)C1 ZINC000775927582 585687890 /nfs/dbraw/zinc/68/78/90/585687890.db2.gz MJKHONFIICLZLC-UHFFFAOYSA-N 1 2 249.358 2.114 20 0 BEADLO COC(=O)c1occc1C[NH2+]Cc1ccoc1C ZINC000776038648 585689495 /nfs/dbraw/zinc/68/94/95/585689495.db2.gz KFOSVXMZTZHRNI-UHFFFAOYSA-N 1 2 249.266 2.257 20 0 BEADLO CCC[C@@H](C)NC(=O)c1cccc2[nH+]ccn21 ZINC000776736448 585703818 /nfs/dbraw/zinc/70/38/18/585703818.db2.gz PWBFSEJWAXSDOW-SNVBAGLBSA-N 1 2 231.299 2.253 20 0 BEADLO O=C([C@@H]1CC12CCC2)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000777455191 585712393 /nfs/dbraw/zinc/71/23/93/585712393.db2.gz NLWXDKJRSDJEHG-QWRGUYRKSA-N 1 2 245.326 2.263 20 0 BEADLO O=C([C@H]1CC12CCC2)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000777455190 585712468 /nfs/dbraw/zinc/71/24/68/585712468.db2.gz NLWXDKJRSDJEHG-MNOVXSKESA-N 1 2 245.326 2.263 20 0 BEADLO C/C=C(/C)C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000777456505 585712588 /nfs/dbraw/zinc/71/25/88/585712588.db2.gz SAZWYVUXNLVJIG-BNFOFFDWSA-N 1 2 219.288 2.039 20 0 BEADLO FCc1ccc(C[N@@H+]2CCc3cn[nH]c3C2)cc1 ZINC000777712242 585718959 /nfs/dbraw/zinc/71/89/59/585718959.db2.gz IZBXYAYKCGSDFS-UHFFFAOYSA-N 1 2 245.301 2.438 20 0 BEADLO FCc1ccc(C[N@H+]2CCc3cn[nH]c3C2)cc1 ZINC000777712242 585718960 /nfs/dbraw/zinc/71/89/60/585718960.db2.gz IZBXYAYKCGSDFS-UHFFFAOYSA-N 1 2 245.301 2.438 20 0 BEADLO FCc1ccc(C[N@@H+]2CCc3c[nH]nc3C2)cc1 ZINC000777712242 585718961 /nfs/dbraw/zinc/71/89/61/585718961.db2.gz IZBXYAYKCGSDFS-UHFFFAOYSA-N 1 2 245.301 2.438 20 0 BEADLO FCc1ccc(C[N@H+]2CCc3c[nH]nc3C2)cc1 ZINC000777712242 585718962 /nfs/dbraw/zinc/71/89/62/585718962.db2.gz IZBXYAYKCGSDFS-UHFFFAOYSA-N 1 2 245.301 2.438 20 0 BEADLO CC(C)n1ccc(C[NH2+]Cc2ccc(F)nc2)n1 ZINC000778169511 585726530 /nfs/dbraw/zinc/72/65/30/585726530.db2.gz UVLWNFGXZATQTM-UHFFFAOYSA-N 1 2 248.305 2.288 20 0 BEADLO CCc1cnc(CN2CCC[C@H]2c2[nH]cc[nH+]2)o1 ZINC000778228753 585728198 /nfs/dbraw/zinc/72/81/98/585728198.db2.gz LCDIOUOSUDVFET-NSHDSACASA-N 1 2 246.314 2.297 20 0 BEADLO Cc1c(Cl)cnn1C[N@H+]1CC=CCC1 ZINC000778577273 585737341 /nfs/dbraw/zinc/73/73/41/585737341.db2.gz QBKUNUGQANHHOP-UHFFFAOYSA-N 1 2 211.696 2.064 20 0 BEADLO Cc1c(Cl)cnn1C[N@@H+]1CC=CCC1 ZINC000778577273 585737342 /nfs/dbraw/zinc/73/73/42/585737342.db2.gz QBKUNUGQANHHOP-UHFFFAOYSA-N 1 2 211.696 2.064 20 0 BEADLO O[C@@H](C[N@@H+]1CCC=C(F)C1)c1cccc(F)c1 ZINC000778961443 585742909 /nfs/dbraw/zinc/74/29/09/585742909.db2.gz RCAQEQNCVNVTJT-ZDUSSCGKSA-N 1 2 239.265 2.418 20 0 BEADLO O[C@@H](C[N@H+]1CCC=C(F)C1)c1cccc(F)c1 ZINC000778961443 585742910 /nfs/dbraw/zinc/74/29/10/585742910.db2.gz RCAQEQNCVNVTJT-ZDUSSCGKSA-N 1 2 239.265 2.418 20 0 BEADLO c1nn(-c2ccccc2)nc1C[N@H+]1CC=CCC1 ZINC000778969790 585743162 /nfs/dbraw/zinc/74/31/62/585743162.db2.gz SAHIIJMXNXWDJJ-UHFFFAOYSA-N 1 2 240.310 2.029 20 0 BEADLO c1nn(-c2ccccc2)nc1C[N@@H+]1CC=CCC1 ZINC000778969790 585743163 /nfs/dbraw/zinc/74/31/63/585743163.db2.gz SAHIIJMXNXWDJJ-UHFFFAOYSA-N 1 2 240.310 2.029 20 0 BEADLO Cc1nn(C)c(Cl)c1C[N@H+]1CC=CCC1 ZINC000778967323 585743278 /nfs/dbraw/zinc/74/32/78/585743278.db2.gz RHLFPBJLRSYNOD-UHFFFAOYSA-N 1 2 225.723 2.144 20 0 BEADLO Cc1nn(C)c(Cl)c1C[N@@H+]1CC=CCC1 ZINC000778967323 585743279 /nfs/dbraw/zinc/74/32/79/585743279.db2.gz RHLFPBJLRSYNOD-UHFFFAOYSA-N 1 2 225.723 2.144 20 0 BEADLO C[N@H+](Cc1ccoc1)Cc1ccc(F)nc1 ZINC000779154167 585746114 /nfs/dbraw/zinc/74/61/14/585746114.db2.gz GKNGYABDFDXZEX-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO C[N@@H+](Cc1ccoc1)Cc1ccc(F)nc1 ZINC000779154167 585746115 /nfs/dbraw/zinc/74/61/15/585746115.db2.gz GKNGYABDFDXZEX-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO c1oc(C2CC2)nc1C[N@H+]1CC=CCC1 ZINC000779160016 585746134 /nfs/dbraw/zinc/74/61/34/585746134.db2.gz SZXKSPNCBAIQDC-UHFFFAOYSA-N 1 2 204.273 2.314 20 0 BEADLO c1oc(C2CC2)nc1C[N@@H+]1CC=CCC1 ZINC000779160016 585746135 /nfs/dbraw/zinc/74/61/35/585746135.db2.gz SZXKSPNCBAIQDC-UHFFFAOYSA-N 1 2 204.273 2.314 20 0 BEADLO C[C@@H]1[N@H+](Cc2ccc(F)nc2)CCOC1(C)C ZINC000779156895 585746369 /nfs/dbraw/zinc/74/63/69/585746369.db2.gz AGLSOCOWMCQMJW-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H]1[N@@H+](Cc2ccc(F)nc2)CCOC1(C)C ZINC000779156895 585746370 /nfs/dbraw/zinc/74/63/70/585746370.db2.gz AGLSOCOWMCQMJW-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@]23CCOC3=O)c(C)o1 ZINC000779198259 585747060 /nfs/dbraw/zinc/74/70/60/585747060.db2.gz BXYNSMQETJKMBN-CQSZACIVSA-N 1 2 249.310 2.178 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@]23CCOC3=O)c(C)o1 ZINC000779198259 585747061 /nfs/dbraw/zinc/74/70/61/585747061.db2.gz BXYNSMQETJKMBN-CQSZACIVSA-N 1 2 249.310 2.178 20 0 BEADLO C[C@@H](CCO)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000779423596 585755031 /nfs/dbraw/zinc/75/50/31/585755031.db2.gz QQTLIXFZKBBLQD-NSHDSACASA-N 1 2 231.299 2.055 20 0 BEADLO Cc1cnc(C(=O)Nc2cc[nH+]cc2C)c(C)c1 ZINC000779926328 585769975 /nfs/dbraw/zinc/76/99/75/585769975.db2.gz SNBVVVDLDAGTSD-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO C1=CO[C@H](CNc2cc[nH+]c(C3CC3)n2)CC1 ZINC000780621612 585782392 /nfs/dbraw/zinc/78/23/92/585782392.db2.gz HBZDZAPILKVGHT-NSHDSACASA-N 1 2 231.299 2.459 20 0 BEADLO CC/C(C)=C(/C)C(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000780893103 585785809 /nfs/dbraw/zinc/78/58/09/585785809.db2.gz TWLGCJSONMHUPJ-NIANNCQZSA-N 1 2 235.331 2.134 20 0 BEADLO CC/C(C)=C(\C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000780932465 585786501 /nfs/dbraw/zinc/78/65/01/585786501.db2.gz OLXZBUQIBBVTME-MDZDMXLPSA-N 1 2 221.304 2.115 20 0 BEADLO CC/C(C)=C(/C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000780932464 585786635 /nfs/dbraw/zinc/78/66/35/585786635.db2.gz OLXZBUQIBBVTME-KTKRTIGZSA-N 1 2 221.304 2.115 20 0 BEADLO C[C@@H]([NH2+]Cc1ccc(CF)cc1)c1ncn(C)n1 ZINC000781956078 585805842 /nfs/dbraw/zinc/80/58/42/585805842.db2.gz SNXUJMRAGDHWTM-SNVBAGLBSA-N 1 2 248.305 2.135 20 0 BEADLO Cc1nonc1C[NH2+][C@H](c1cccnc1)C1CC1 ZINC000782530201 585819447 /nfs/dbraw/zinc/81/94/47/585819447.db2.gz HVUCVZXMJLPOCN-ZDUSSCGKSA-N 1 2 244.298 2.014 20 0 BEADLO Cc1nonc1C[NH2+][C@@H](c1cccnc1)C1CC1 ZINC000782530200 585819633 /nfs/dbraw/zinc/81/96/33/585819633.db2.gz HVUCVZXMJLPOCN-CYBMUJFWSA-N 1 2 244.298 2.014 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OCCCc1ccsc1 ZINC000782947134 585826458 /nfs/dbraw/zinc/82/64/58/585826458.db2.gz CCJABJAASGMCEY-SECBINFHSA-N 1 2 242.344 2.214 20 0 BEADLO O=C(OC1CC1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000783198270 585830165 /nfs/dbraw/zinc/83/01/65/585830165.db2.gz LXYWNEMBMFUHNW-UHFFFAOYSA-N 1 2 228.251 2.192 20 0 BEADLO Cc1[nH+]c2ccccc2n1CC(=O)OC1CC1 ZINC000783197464 585830175 /nfs/dbraw/zinc/83/01/75/585830175.db2.gz CDWJXRAJDYEAHL-UHFFFAOYSA-N 1 2 230.267 2.050 20 0 BEADLO O=C(CCc1ccoc1)OCCCn1cc[nH+]c1 ZINC000784060196 585848320 /nfs/dbraw/zinc/84/83/20/585848320.db2.gz AZCZFZVXKKWYTA-UHFFFAOYSA-N 1 2 248.282 2.042 20 0 BEADLO Cc1cc(C(=O)OCCCn2cc[nH+]c2)oc1C ZINC000784230492 585853034 /nfs/dbraw/zinc/85/30/34/585853034.db2.gz IBQXRZMPQIJLJH-UHFFFAOYSA-N 1 2 248.282 2.340 20 0 BEADLO CC[N@@H+]1CCCC[C@H]1C(=O)O[C@H](C)C(F)F ZINC000786517843 585893849 /nfs/dbraw/zinc/89/38/49/585893849.db2.gz YNULSEYHNNCUEY-BDAKNGLRSA-N 1 2 235.274 2.058 20 0 BEADLO CC[N@H+]1CCCC[C@H]1C(=O)O[C@H](C)C(F)F ZINC000786517843 585893850 /nfs/dbraw/zinc/89/38/50/585893850.db2.gz YNULSEYHNNCUEY-BDAKNGLRSA-N 1 2 235.274 2.058 20 0 BEADLO Cc1ccsc1C(=O)OCc1cc[nH+]c(N)c1 ZINC000787578072 585912192 /nfs/dbraw/zinc/91/21/92/585912192.db2.gz GGYDQBADAZFNMI-UHFFFAOYSA-N 1 2 248.307 2.391 20 0 BEADLO Nc1cc(COC(=O)Cc2cccs2)cc[nH+]1 ZINC000787579448 585912305 /nfs/dbraw/zinc/91/23/05/585912305.db2.gz WBDNUOCKYKMJLK-UHFFFAOYSA-N 1 2 248.307 2.011 20 0 BEADLO CCc1ccc(CN(C)Cc2[nH]cc[nH+]2)o1 ZINC000787770247 585915700 /nfs/dbraw/zinc/91/57/00/585915700.db2.gz PJTIQFHBGAXIHJ-UHFFFAOYSA-N 1 2 219.288 2.197 20 0 BEADLO CC(C)(C(=O)N1CCCCCCC1)c1c[nH+]c[nH]1 ZINC000788262212 585920057 /nfs/dbraw/zinc/92/00/57/585920057.db2.gz BOOANRSOFSXPKR-UHFFFAOYSA-N 1 2 249.358 2.480 20 0 BEADLO CC1(C)C[NH+](C[C@H](O)c2cc(F)ccc2F)C1 ZINC000788435169 585923112 /nfs/dbraw/zinc/92/31/12/585923112.db2.gz PLPXSTSCJQABAC-LBPRGKRZSA-N 1 2 241.281 2.340 20 0 BEADLO CC1(C)C[NH+](C[C@@H](O)c2cc(F)ccc2F)C1 ZINC000788435167 585923177 /nfs/dbraw/zinc/92/31/77/585923177.db2.gz PLPXSTSCJQABAC-GFCCVEGCSA-N 1 2 241.281 2.340 20 0 BEADLO CC(C)OCC(N)=[NH+]OCCCCCF ZINC000789588230 585944757 /nfs/dbraw/zinc/94/47/57/585944757.db2.gz LTWYGJSRCQGTNW-UHFFFAOYSA-N 1 2 220.288 2.050 20 0 BEADLO CC=C(CC)C(=O)Nc1cc(C)[nH+]cc1C ZINC000789662705 585948128 /nfs/dbraw/zinc/94/81/28/585948128.db2.gz VKYDOBNMJSAQOI-VZUCSPMQSA-N 1 2 218.300 2.415 20 0 BEADLO Cc1cc(C(=O)OCCc2c[nH+]cn2C)c(C)o1 ZINC000789773039 585949736 /nfs/dbraw/zinc/94/97/36/585949736.db2.gz RWOFBAWYNSAOPX-UHFFFAOYSA-N 1 2 248.282 2.029 20 0 BEADLO CCC[C@H](C)CC(=O)OCCc1c[nH+]cn1C ZINC000789776040 585949808 /nfs/dbraw/zinc/94/98/08/585949808.db2.gz GNJPHIRHAPWIJE-NSHDSACASA-N 1 2 238.331 2.332 20 0 BEADLO Cn1cc[nH+]c1CCCOC(=O)C[C@H]1C=CCC1 ZINC000789792430 585950363 /nfs/dbraw/zinc/95/03/63/585950363.db2.gz UMMZURNCOIHDQE-LBPRGKRZSA-N 1 2 248.326 2.252 20 0 BEADLO Cn1cc[nH+]c1CCCOC(=O)C1=CCCC1 ZINC000789792457 585950368 /nfs/dbraw/zinc/95/03/68/585950368.db2.gz VOQNVUNSAPMCJZ-UHFFFAOYSA-N 1 2 234.299 2.006 20 0 BEADLO CC[C@@H]1CC[C@H]1[NH2+]c1ccc(OCC(N)=O)cc1 ZINC000806151983 585983248 /nfs/dbraw/zinc/98/32/48/585983248.db2.gz NGVUDWJMXIKHCZ-ZWNOBZJWSA-N 1 2 248.326 2.151 20 0 BEADLO CC[C@H]1CC[C@H]1[NH2+]c1ccc(OCC(N)=O)cc1 ZINC000806151981 585983747 /nfs/dbraw/zinc/98/37/47/585983747.db2.gz NGVUDWJMXIKHCZ-GXFFZTMASA-N 1 2 248.326 2.151 20 0 BEADLO CC/C(C)=C(/C)C(=O)OCc1cc[nH+]c(N)c1 ZINC000792117047 585995990 /nfs/dbraw/zinc/99/59/90/585995990.db2.gz GTZZKFAOSLZCCQ-KTKRTIGZSA-N 1 2 234.299 2.453 20 0 BEADLO CC[C@@H](C)[C@@H](C)C(=O)OCc1cc[nH+]c(N)c1 ZINC000792119214 585996081 /nfs/dbraw/zinc/99/60/81/585996081.db2.gz SMPVJLWYMUVQPF-NXEZZACHSA-N 1 2 236.315 2.389 20 0 BEADLO C[C@H]1COC(C)(C)C[N@@H+]1Cc1ccnc(F)c1 ZINC000859277398 589027334 /nfs/dbraw/zinc/02/73/34/589027334.db2.gz UQFUXOIZJUMWRL-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H]1COC(C)(C)C[N@H+]1Cc1ccnc(F)c1 ZINC000859277398 589027336 /nfs/dbraw/zinc/02/73/36/589027336.db2.gz UQFUXOIZJUMWRL-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO FC1(C[NH2+]Cc2nnc(-c3ccccc3)[nH]2)CC1 ZINC000793044173 586009094 /nfs/dbraw/zinc/00/90/94/586009094.db2.gz FPAQETFSEYZQTA-UHFFFAOYSA-N 1 2 246.289 2.063 20 0 BEADLO FC1(C[NH2+]Cc2nc(-c3ccccc3)n[nH]2)CC1 ZINC000793044173 586009095 /nfs/dbraw/zinc/00/90/95/586009095.db2.gz FPAQETFSEYZQTA-UHFFFAOYSA-N 1 2 246.289 2.063 20 0 BEADLO CCC1(C(=O)OCCc2c[nH+]cn2C)CCC1 ZINC000793252837 586015099 /nfs/dbraw/zinc/01/50/99/586015099.db2.gz SPPIUVNKJABKRS-UHFFFAOYSA-N 1 2 236.315 2.086 20 0 BEADLO Cc1nnc(C[N@@H+]2Cc3ccccc3[C@H](C)C2)[nH]1 ZINC000794270381 586036609 /nfs/dbraw/zinc/03/66/09/586036609.db2.gz DPHXMRHNHONJES-SNVBAGLBSA-N 1 2 242.326 2.232 20 0 BEADLO Cc1nnc(C[N@H+]2Cc3ccccc3[C@H](C)C2)[nH]1 ZINC000794270381 586036610 /nfs/dbraw/zinc/03/66/10/586036610.db2.gz DPHXMRHNHONJES-SNVBAGLBSA-N 1 2 242.326 2.232 20 0 BEADLO Cc1cccn2cc(COC(=O)C(C)C)[nH+]c12 ZINC000795782144 586092049 /nfs/dbraw/zinc/09/20/49/586092049.db2.gz UDNBYEGSGPLFSR-UHFFFAOYSA-N 1 2 232.283 2.342 20 0 BEADLO Cc1cccn2cc(COC(=O)C3CC3)[nH+]c12 ZINC000795988250 586095534 /nfs/dbraw/zinc/09/55/34/586095534.db2.gz FYCFOHSNFQCORV-UHFFFAOYSA-N 1 2 230.267 2.096 20 0 BEADLO Cc1cccc2c1CC[N@H+](Cc1c[nH]cn1)C2 ZINC000796443175 586103391 /nfs/dbraw/zinc/10/33/91/586103391.db2.gz CXMHVOMJIRPTOE-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1cccc2c1CC[N@@H+](Cc1c[nH]cn1)C2 ZINC000796443175 586103392 /nfs/dbraw/zinc/10/33/92/586103392.db2.gz CXMHVOMJIRPTOE-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1cccc2c1CC[N@H+](Cc1cnc[nH]1)C2 ZINC000796443175 586103393 /nfs/dbraw/zinc/10/33/93/586103393.db2.gz CXMHVOMJIRPTOE-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1cccc2c1CC[N@@H+](Cc1cnc[nH]1)C2 ZINC000796443175 586103394 /nfs/dbraw/zinc/10/33/94/586103394.db2.gz CXMHVOMJIRPTOE-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO CC(C)c1occc1C(=O)OCc1c[nH+]cn1C ZINC000796738943 586111207 /nfs/dbraw/zinc/11/12/07/586111207.db2.gz GMLVDGJFKVYAHR-UHFFFAOYSA-N 1 2 248.282 2.494 20 0 BEADLO CC(C)c1cc(CN[C@@H](C)c2[nH]cc[nH+]2)on1 ZINC000796760305 586111560 /nfs/dbraw/zinc/11/15/60/586111560.db2.gz KHAQUGMHUYWSQA-VIFPVBQESA-N 1 2 234.303 2.372 20 0 BEADLO CC(C)c1cc(C[NH2+][C@@H](C)c2ncc[nH]2)on1 ZINC000796760305 586111561 /nfs/dbraw/zinc/11/15/61/586111561.db2.gz KHAQUGMHUYWSQA-VIFPVBQESA-N 1 2 234.303 2.372 20 0 BEADLO c1ccc([C@H]2CCN(c3cccc[nH+]3)C2)nc1 ZINC000798415591 586143623 /nfs/dbraw/zinc/14/36/23/586143623.db2.gz GTCZBRHWUSUCIY-LBPRGKRZSA-N 1 2 225.295 2.471 20 0 BEADLO Cn1nc(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)cc1Cl ZINC000859337812 589032299 /nfs/dbraw/zinc/03/22/99/589032299.db2.gz RIAJCUSYHOHYKD-ONGXEEELSA-N 1 2 239.750 2.448 20 0 BEADLO Cn1nc(C[N@H+]2C[C@@H]3CCCC[C@@H]32)cc1Cl ZINC000859337812 589032301 /nfs/dbraw/zinc/03/23/01/589032301.db2.gz RIAJCUSYHOHYKD-ONGXEEELSA-N 1 2 239.750 2.448 20 0 BEADLO CCCC[C@@H](C)C(=O)OCCn1cc[nH+]c1 ZINC000800275746 586207940 /nfs/dbraw/zinc/20/79/40/586207940.db2.gz CKXNJMYKHCRZTM-LLVKDONJSA-N 1 2 224.304 2.253 20 0 BEADLO Cc1nonc1C[NH+]1C[C@@H](C)C(F)(F)[C@H](C)C1 ZINC000859414395 589035943 /nfs/dbraw/zinc/03/59/43/589035943.db2.gz WHEOXUIMZPSEAY-HTQZYQBOSA-N 1 2 245.273 2.101 20 0 BEADLO CC(C)OCC(N)=[NH+]OCCSC(C)C ZINC000800868213 586235332 /nfs/dbraw/zinc/23/53/32/586235332.db2.gz VXIHVLIEZGPUQB-UHFFFAOYSA-N 1 2 234.365 2.051 20 0 BEADLO CC(C)SCC[N@@H+]1CCO[C@@H](C(F)F)C1 ZINC000801560629 586262787 /nfs/dbraw/zinc/26/27/87/586262787.db2.gz RVKZFLRMCPOJGN-SECBINFHSA-N 1 2 239.331 2.094 20 0 BEADLO CC(C)SCC[N@H+]1CCO[C@@H](C(F)F)C1 ZINC000801560629 586262788 /nfs/dbraw/zinc/26/27/88/586262788.db2.gz RVKZFLRMCPOJGN-SECBINFHSA-N 1 2 239.331 2.094 20 0 BEADLO FC(F)[C@@H]1C[N@H+](Cc2cccs2)CCO1 ZINC000801565157 586263383 /nfs/dbraw/zinc/26/33/83/586263383.db2.gz YEUOWOQBTBDHJW-VIFPVBQESA-N 1 2 233.283 2.214 20 0 BEADLO FC(F)[C@@H]1C[N@@H+](Cc2cccs2)CCO1 ZINC000801565157 586263386 /nfs/dbraw/zinc/26/33/86/586263386.db2.gz YEUOWOQBTBDHJW-VIFPVBQESA-N 1 2 233.283 2.214 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccc3c(c2)COC3)CCC1=O ZINC000801943830 586281226 /nfs/dbraw/zinc/28/12/26/586281226.db2.gz IZVYZVRPRAQEFY-NSHDSACASA-N 1 2 245.322 2.128 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccc3c(c2)COC3)CCC1=O ZINC000801943830 586281228 /nfs/dbraw/zinc/28/12/28/586281228.db2.gz IZVYZVRPRAQEFY-NSHDSACASA-N 1 2 245.322 2.128 20 0 BEADLO CCCC[C@@H](C)C(=O)O[C@H]1CC[N@H+](CCF)C1 ZINC000802232877 586297694 /nfs/dbraw/zinc/29/76/94/586297694.db2.gz LMWDUXVGGYEPEI-NEPJUHHUSA-N 1 2 245.338 2.400 20 0 BEADLO CCCC[C@@H](C)C(=O)O[C@H]1CC[N@@H+](CCF)C1 ZINC000802232877 586297695 /nfs/dbraw/zinc/29/76/95/586297695.db2.gz LMWDUXVGGYEPEI-NEPJUHHUSA-N 1 2 245.338 2.400 20 0 BEADLO CCC1(C(=O)O[C@@H]2CC[N@H+](CCF)C2)CCC1 ZINC000802236272 586297756 /nfs/dbraw/zinc/29/77/56/586297756.db2.gz XNEQLAGDJKSZJO-LLVKDONJSA-N 1 2 243.322 2.154 20 0 BEADLO CCC1(C(=O)O[C@@H]2CC[N@@H+](CCF)C2)CCC1 ZINC000802236272 586297758 /nfs/dbraw/zinc/29/77/58/586297758.db2.gz XNEQLAGDJKSZJO-LLVKDONJSA-N 1 2 243.322 2.154 20 0 BEADLO CC1(C(=O)O[C@@H]2CC[N@H+](CCF)C2)CCCC1 ZINC000802237647 586297868 /nfs/dbraw/zinc/29/78/68/586297868.db2.gz IGBIKLOWTRABPD-LLVKDONJSA-N 1 2 243.322 2.154 20 0 BEADLO CC1(C(=O)O[C@@H]2CC[N@@H+](CCF)C2)CCCC1 ZINC000802237647 586297872 /nfs/dbraw/zinc/29/78/72/586297872.db2.gz IGBIKLOWTRABPD-LLVKDONJSA-N 1 2 243.322 2.154 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@H](C(F)F)C2)o1 ZINC000802652577 586308080 /nfs/dbraw/zinc/30/80/80/586308080.db2.gz DXDBRVYLHLGGSM-JTQLQIEISA-N 1 2 231.242 2.054 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@H](C(F)F)C2)o1 ZINC000802652577 586308081 /nfs/dbraw/zinc/30/80/81/586308081.db2.gz DXDBRVYLHLGGSM-JTQLQIEISA-N 1 2 231.242 2.054 20 0 BEADLO CC/C=C(\C)C(=O)OCCCc1[nH+]ccn1C ZINC000802783645 586314553 /nfs/dbraw/zinc/31/45/53/586314553.db2.gz APGSVARYLFXKNI-IZZDOVSWSA-N 1 2 236.315 2.252 20 0 BEADLO CC[NH2+]Cc1noc([C@H](C)c2ccc(C)o2)n1 ZINC000843145246 586444735 /nfs/dbraw/zinc/44/47/35/586444735.db2.gz ZDYBIPPBDCMMFU-SECBINFHSA-N 1 2 235.287 2.232 20 0 BEADLO CC[NH2+]Cc1noc(COC2CCCCC2)n1 ZINC000843145672 586445656 /nfs/dbraw/zinc/44/56/56/586445656.db2.gz SASKXPKDGRYNEH-UHFFFAOYSA-N 1 2 239.319 2.028 20 0 BEADLO C[C@@]1(F)CCC[N@H+](Cn2cccnc2=S)C1 ZINC000840101777 586446312 /nfs/dbraw/zinc/44/63/12/586446312.db2.gz VKDIWMNEHSPOPH-LLVKDONJSA-N 1 2 241.335 2.394 20 0 BEADLO C[C@@]1(F)CCC[N@@H+](Cn2cccnc2=S)C1 ZINC000840101777 586446313 /nfs/dbraw/zinc/44/63/13/586446313.db2.gz VKDIWMNEHSPOPH-LLVKDONJSA-N 1 2 241.335 2.394 20 0 BEADLO NC(=[NH+]OCCOC1CCC1)c1ccccc1 ZINC000808243758 586467937 /nfs/dbraw/zinc/46/79/37/586467937.db2.gz IBEANFGFMQDTLQ-UHFFFAOYSA-N 1 2 234.299 2.102 20 0 BEADLO CCC[C@H]([NH2+]Cc1cn(C)cn1)c1ccccn1 ZINC000808386516 586470549 /nfs/dbraw/zinc/47/05/49/586470549.db2.gz GOAKIVAQBBXLKH-ZDUSSCGKSA-N 1 2 244.342 2.446 20 0 BEADLO Cn1c[nH+]c(CNc2cnc3c(c2)CCCC3)c1 ZINC000808401916 586470759 /nfs/dbraw/zinc/47/07/59/586470759.db2.gz BCAUTIOPQABBJC-UHFFFAOYSA-N 1 2 242.326 2.306 20 0 BEADLO Cc1cc2n[nH]cc2cc1NCc1cn(C)c[nH+]1 ZINC000808409943 586471822 /nfs/dbraw/zinc/47/18/22/586471822.db2.gz XJFMLDRUIBUQKU-UHFFFAOYSA-N 1 2 241.298 2.217 20 0 BEADLO FC(F)c1ccnc(C[NH2+]Cc2ccoc2)n1 ZINC000808435442 586472292 /nfs/dbraw/zinc/47/22/92/586472292.db2.gz LUMAMPAXYYDVRI-UHFFFAOYSA-N 1 2 239.225 2.297 20 0 BEADLO c1cc(C[NH2+]Cc2noc3c2CCCC3)co1 ZINC000808437700 586472492 /nfs/dbraw/zinc/47/24/92/586472492.db2.gz VKWSUPACPQFARB-UHFFFAOYSA-N 1 2 232.283 2.436 20 0 BEADLO CC(C)C(=O)CC[N@@H+]1CCC[C@H](c2ccn[nH]2)C1 ZINC000808710347 586483897 /nfs/dbraw/zinc/48/38/97/586483897.db2.gz HZKUDZGWIXPJNH-LBPRGKRZSA-N 1 2 249.358 2.204 20 0 BEADLO CC(C)C(=O)CC[N@H+]1CCC[C@H](c2ccn[nH]2)C1 ZINC000808710347 586483898 /nfs/dbraw/zinc/48/38/98/586483898.db2.gz HZKUDZGWIXPJNH-LBPRGKRZSA-N 1 2 249.358 2.204 20 0 BEADLO CCN1CC[N@H+](Cc2cc(C)oc2C)[C@H](C)C1 ZINC000809698139 586513143 /nfs/dbraw/zinc/51/31/43/586513143.db2.gz WPVDCGGWDXUSGK-LLVKDONJSA-N 1 2 236.359 2.422 20 0 BEADLO CCN1CC[N@@H+](Cc2cc(C)oc2C)[C@H](C)C1 ZINC000809698139 586513144 /nfs/dbraw/zinc/51/31/44/586513144.db2.gz WPVDCGGWDXUSGK-LLVKDONJSA-N 1 2 236.359 2.422 20 0 BEADLO Cc1nonc1C[NH2+]Cc1cc(F)ccc1C ZINC000809744024 586516474 /nfs/dbraw/zinc/51/64/74/586516474.db2.gz QVODKFBMPHWADV-UHFFFAOYSA-N 1 2 235.262 2.115 20 0 BEADLO Cc1ccccc1[C@H](C)[N@H+](C)Cc1cnn(C)n1 ZINC000809935195 586523716 /nfs/dbraw/zinc/52/37/16/586523716.db2.gz PVOLCURJGOWKPM-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1ccccc1[C@H](C)[N@@H+](C)Cc1cnn(C)n1 ZINC000809935195 586523718 /nfs/dbraw/zinc/52/37/18/586523718.db2.gz PVOLCURJGOWKPM-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cn1ncc(C[N@H+](C)C(C)(C)c2ccccc2)n1 ZINC000810011200 586531509 /nfs/dbraw/zinc/53/15/09/586531509.db2.gz GIGGJDMDRBVJLP-UHFFFAOYSA-N 1 2 244.342 2.182 20 0 BEADLO Cn1ncc(C[N@@H+](C)C(C)(C)c2ccccc2)n1 ZINC000810011200 586531511 /nfs/dbraw/zinc/53/15/11/586531511.db2.gz GIGGJDMDRBVJLP-UHFFFAOYSA-N 1 2 244.342 2.182 20 0 BEADLO CCCOC(=O)[C@H](C)[N@@H+]1CCC(F)(F)[C@H](C)C1 ZINC000810045379 586532764 /nfs/dbraw/zinc/53/27/64/586532764.db2.gz MKUZGJJDEGHLAQ-ZJUUUORDSA-N 1 2 249.301 2.305 20 0 BEADLO CCCOC(=O)[C@H](C)[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000810045379 586532765 /nfs/dbraw/zinc/53/27/65/586532765.db2.gz MKUZGJJDEGHLAQ-ZJUUUORDSA-N 1 2 249.301 2.305 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@@H+]1CCC(F)(F)[C@H](C)C1 ZINC000810045376 586532829 /nfs/dbraw/zinc/53/28/29/586532829.db2.gz MKUZGJJDEGHLAQ-NXEZZACHSA-N 1 2 249.301 2.305 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000810045376 586532830 /nfs/dbraw/zinc/53/28/30/586532830.db2.gz MKUZGJJDEGHLAQ-NXEZZACHSA-N 1 2 249.301 2.305 20 0 BEADLO CCc1cc(C[NH2+][C@@H](C)c2cc(C)on2)[nH]n1 ZINC000810218072 586536570 /nfs/dbraw/zinc/53/65/70/586536570.db2.gz OIDYJVOLOSAHTE-VIFPVBQESA-N 1 2 234.303 2.119 20 0 BEADLO COc1ccc([C@@H](C)[NH2+]Cc2ccon2)cc1O ZINC000810222257 586537432 /nfs/dbraw/zinc/53/74/32/586537432.db2.gz XQZAPODNCQALGM-SECBINFHSA-N 1 2 248.282 2.240 20 0 BEADLO Cc1ccoc1C[NH+]1CC(O)(c2ccccc2)C1 ZINC000811508712 586560161 /nfs/dbraw/zinc/56/01/61/586560161.db2.gz DQRRFFNRTDHFSE-UHFFFAOYSA-N 1 2 243.306 2.291 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)OCCCn1cc[nH+]c1 ZINC000812636218 586581379 /nfs/dbraw/zinc/58/13/79/586581379.db2.gz MLRNLOJODNTPAS-VXGBXAGGSA-N 1 2 236.315 2.253 20 0 BEADLO c1c(-c2ccc3c(c2)CCO3)[nH+]c2n1CCC2 ZINC000813237359 586598592 /nfs/dbraw/zinc/59/85/92/586598592.db2.gz BOZJUQZMRBVPOY-UHFFFAOYSA-N 1 2 226.279 2.431 20 0 BEADLO CC(C)(C)C(C)(C)C(=O)NC1=[NH+]CCS1 ZINC000814257931 586620813 /nfs/dbraw/zinc/62/08/13/586620813.db2.gz VXENMEHTBGFASS-UHFFFAOYSA-N 1 2 228.361 2.278 20 0 BEADLO CC(C)(C)c1nc(NCc2ncccn2)cc[nH+]1 ZINC000840325678 586630879 /nfs/dbraw/zinc/63/08/79/586630879.db2.gz LJTNJTGFGFCDAT-UHFFFAOYSA-N 1 2 243.314 2.176 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1nnc(C(C)(C)C)o1 ZINC000815161999 586671689 /nfs/dbraw/zinc/67/16/89/586671689.db2.gz FYUPPFBWLPEFTG-DTWKUNHWSA-N 1 2 223.320 2.207 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1nnc(C(C)(C)C)o1 ZINC000815161999 586671690 /nfs/dbraw/zinc/67/16/90/586671690.db2.gz FYUPPFBWLPEFTG-DTWKUNHWSA-N 1 2 223.320 2.207 20 0 BEADLO Cc1ccc(NC(=O)c2cc(C=O)c[nH]2)c(C)[nH+]1 ZINC000815781167 586693888 /nfs/dbraw/zinc/69/38/88/586693888.db2.gz VWMBCLDHYQTEIO-UHFFFAOYSA-N 1 2 243.266 2.091 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@@H]1CC2CCC1CC2 ZINC000815967432 586700333 /nfs/dbraw/zinc/70/03/33/586700333.db2.gz ATZNQWZQHUNUCG-GCZXYKMCSA-N 1 2 248.326 2.290 20 0 BEADLO C[N@H+](CCF)Cc1cnc(C2CC2)s1 ZINC000816639180 586747150 /nfs/dbraw/zinc/74/71/50/586747150.db2.gz KGKGRHHOTUARGP-UHFFFAOYSA-N 1 2 214.309 2.422 20 0 BEADLO C[N@@H+](CCF)Cc1cnc(C2CC2)s1 ZINC000816639180 586747151 /nfs/dbraw/zinc/74/71/51/586747151.db2.gz KGKGRHHOTUARGP-UHFFFAOYSA-N 1 2 214.309 2.422 20 0 BEADLO C[C@H]1CC/C(=C/C(=O)N2CCc3[nH]c[nH+]c3C2)C1 ZINC000816651349 586752784 /nfs/dbraw/zinc/75/27/84/586752784.db2.gz DFAHASBXLQJSPO-QBQSQJOESA-N 1 2 245.326 2.041 20 0 BEADLO C[C@H]1CC/C(=C/C(=O)N2CCc3[nH+]c[nH]c3C2)C1 ZINC000816651349 586752785 /nfs/dbraw/zinc/75/27/85/586752785.db2.gz DFAHASBXLQJSPO-QBQSQJOESA-N 1 2 245.326 2.041 20 0 BEADLO C[C@@H](NC(=O)/C=C1/CC[C@@H](C)C1)c1[nH]cc[nH+]1 ZINC000816719178 586759998 /nfs/dbraw/zinc/75/99/98/586759998.db2.gz RNCUQQQGLZHNIJ-VXNGBHNKSA-N 1 2 233.315 2.333 20 0 BEADLO C[C@@H](NC(=O)C=C1CC[C@@H](C)C1)c1[nH]cc[nH+]1 ZINC000816719178 586760000 /nfs/dbraw/zinc/76/00/00/586760000.db2.gz RNCUQQQGLZHNIJ-VXNGBHNKSA-N 1 2 233.315 2.333 20 0 BEADLO CCc1ccc(NC(=O)Cc2[nH]cc[nH+]2)cc1 ZINC000816820766 586766047 /nfs/dbraw/zinc/76/60/47/586766047.db2.gz ZUIASWMMINTONM-UHFFFAOYSA-N 1 2 229.283 2.153 20 0 BEADLO Cc1cc(F)ccc1NC(=O)Cc1[nH]cc[nH+]1 ZINC000816841033 586767570 /nfs/dbraw/zinc/76/75/70/586767570.db2.gz NWAFSWWAMJTREE-UHFFFAOYSA-N 1 2 233.246 2.038 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)N[C@@H]1C[C@H]1C1CCCCC1 ZINC000816936055 586772263 /nfs/dbraw/zinc/77/22/63/586772263.db2.gz COWYKKHMCMPXTA-NWDGAFQWSA-N 1 2 247.342 2.037 20 0 BEADLO Cn1cc(N[C@H]2CCc3ccc[nH+]c3CC2)cn1 ZINC000817581169 586812752 /nfs/dbraw/zinc/81/27/52/586812752.db2.gz PSTVPMDZXWMJEO-LBPRGKRZSA-N 1 2 242.326 2.175 20 0 BEADLO Cn1ccc(N[C@H]2CCc3ccc[nH+]c3CC2)n1 ZINC000817579063 586812874 /nfs/dbraw/zinc/81/28/74/586812874.db2.gz SXIAPCTVNGTWNP-LBPRGKRZSA-N 1 2 242.326 2.175 20 0 BEADLO Cc1cc(NCc2cn(C)c[nH+]2)nn1C(C)C ZINC000817710022 586819233 /nfs/dbraw/zinc/81/92/33/586819233.db2.gz FCUOAQXNJHKKKZ-UHFFFAOYSA-N 1 2 233.319 2.118 20 0 BEADLO CO[C@H](CO[NH+]=C(N)Cc1ccccc1)C1CC1 ZINC000818076591 586869486 /nfs/dbraw/zinc/86/94/86/586869486.db2.gz KEZOVQMKJGUVMX-CYBMUJFWSA-N 1 2 248.326 2.153 20 0 BEADLO C[C@H]1CCCC[C@@H]1C(=O)NC1=[NH+]CCS1 ZINC000819031585 586925548 /nfs/dbraw/zinc/92/55/48/586925548.db2.gz SSRSSIUEFLBDBR-IUCAKERBSA-N 1 2 226.345 2.032 20 0 BEADLO Cc1ccc([C@@H](O)C[NH2+]CC(C)(F)F)cc1 ZINC000819331749 586953050 /nfs/dbraw/zinc/95/30/50/586953050.db2.gz BHDYIZMBCOAORH-NSHDSACASA-N 1 2 229.270 2.273 20 0 BEADLO Cc1cc([NH+](C)C)ccc1NCC1(O)CCC1 ZINC000819408289 586962106 /nfs/dbraw/zinc/96/21/06/586962106.db2.gz DOVZXUAXXKUGHC-UHFFFAOYSA-N 1 2 234.343 2.388 20 0 BEADLO O[C@@H](CNc1ccc(-n2cc[nH+]c2)cc1)C1CC1 ZINC000819447278 586965083 /nfs/dbraw/zinc/96/50/83/586965083.db2.gz WLBBYVMAHYXGPP-AWEZNQCLSA-N 1 2 243.310 2.055 20 0 BEADLO CCn1ccc(C[NH2+][C@H](C)c2ccns2)n1 ZINC000860059467 589078117 /nfs/dbraw/zinc/07/81/17/589078117.db2.gz MEBYOPQNRMAIFP-SECBINFHSA-N 1 2 236.344 2.210 20 0 BEADLO CC(C)CCC(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819761957 586990983 /nfs/dbraw/zinc/99/09/83/586990983.db2.gz APOZDRITVFEGDZ-MRVPVSSYSA-N 1 2 214.334 2.030 20 0 BEADLO CCC[C@@H](C)CC(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819767348 586991352 /nfs/dbraw/zinc/99/13/52/586991352.db2.gz SGVYKHTYRQLFQW-BDAKNGLRSA-N 1 2 228.361 2.420 20 0 BEADLO CCCCSCC(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819768589 586991623 /nfs/dbraw/zinc/99/16/23/586991623.db2.gz NMMUPFWNSMXUSF-MRVPVSSYSA-N 1 2 246.401 2.127 20 0 BEADLO Cc1ccc(CC(=O)NC2=[NH+]C[C@H](C)S2)cc1 ZINC000819768638 586991747 /nfs/dbraw/zinc/99/17/47/586991747.db2.gz SSHORVIUZFKYEG-JTQLQIEISA-N 1 2 248.351 2.145 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NC2=[NH+]C[C@@H](C)S2)C1 ZINC000819775395 586992376 /nfs/dbraw/zinc/99/23/76/586992376.db2.gz FTVHIESABJHTJJ-IWSPIJDZSA-N 1 2 226.345 2.030 20 0 BEADLO CCCC[C@@H](C)C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819777140 586992786 /nfs/dbraw/zinc/99/27/86/586992786.db2.gz HRTIMDYYWPYXCW-RKDXNWHRSA-N 1 2 228.361 2.420 20 0 BEADLO CC(C)CCCC(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819779623 586993698 /nfs/dbraw/zinc/99/36/98/586993698.db2.gz AACVRUVTFXFGMI-SECBINFHSA-N 1 2 228.361 2.420 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)[C@]2(C)CCC[C@H]2C)S1 ZINC000819781049 586993748 /nfs/dbraw/zinc/99/37/48/586993748.db2.gz KZWCXQHEQXVYOS-KBVBSXBZSA-N 1 2 240.372 2.420 20 0 BEADLO CC[C@@H](C)CC(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819779922 586993764 /nfs/dbraw/zinc/99/37/64/586993764.db2.gz BJTPZAVSZLKBFO-HTQZYQBOSA-N 1 2 214.334 2.030 20 0 BEADLO C[C@H]1CCCC[C@H]1C(=O)OCc1c[nH+]cn1C ZINC000820161103 587030164 /nfs/dbraw/zinc/03/01/64/587030164.db2.gz DMIJYDARUFKNDZ-CMPLNLGQSA-N 1 2 236.315 2.290 20 0 BEADLO C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C(C)(C)C1 ZINC000820527719 587052806 /nfs/dbraw/zinc/05/28/06/587052806.db2.gz RDSXRVQPSHJKIM-GMTAPVOTSA-N 1 2 247.342 2.160 20 0 BEADLO C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C(C)(C)C1 ZINC000820527719 587052807 /nfs/dbraw/zinc/05/28/07/587052807.db2.gz RDSXRVQPSHJKIM-GMTAPVOTSA-N 1 2 247.342 2.160 20 0 BEADLO CC(C)c1nccc(N[C@H](C)c2[nH]cc[nH+]2)n1 ZINC000820595739 587057677 /nfs/dbraw/zinc/05/76/77/587057677.db2.gz OYGMGVBYQGVXDV-SECBINFHSA-N 1 2 231.303 2.496 20 0 BEADLO C[C@@H]1CCN(c2nccs2)C[C@@H]1n1cc[nH+]c1 ZINC000820674832 587065206 /nfs/dbraw/zinc/06/52/06/587065206.db2.gz CDEKKPBZBHHOBF-MNOVXSKESA-N 1 2 248.355 2.427 20 0 BEADLO COc1cc([C@H](C)[NH2+]Cc2ccco2)on1 ZINC000820805588 587073485 /nfs/dbraw/zinc/07/34/85/587073485.db2.gz NKSJMQLZAAKNDB-QMMMGPOBSA-N 1 2 222.244 2.127 20 0 BEADLO C[C@@H]1CCCC[C@H]1C(=O)OCCn1cc[nH+]c1 ZINC000820858433 587077851 /nfs/dbraw/zinc/07/78/51/587077851.db2.gz YSWWXGJYNFQPDU-VXGBXAGGSA-N 1 2 236.315 2.253 20 0 BEADLO C[C@H]1CCCC[C@@H]1C(=O)OCCn1cc[nH+]c1 ZINC000820858432 587078056 /nfs/dbraw/zinc/07/80/56/587078056.db2.gz YSWWXGJYNFQPDU-RYUDHWBXSA-N 1 2 236.315 2.253 20 0 BEADLO O=C(C[C@H]1CC=CCC1)N[C@@H]1CCn2cc[nH+]c21 ZINC000820947576 587083811 /nfs/dbraw/zinc/08/38/11/587083811.db2.gz FOORGIFIEFKDHU-NWDGAFQWSA-N 1 2 245.326 2.191 20 0 BEADLO CC1(CCC(=O)N[C@@H]2CCn3cc[nH+]c32)CC1 ZINC000820948342 587084293 /nfs/dbraw/zinc/08/42/93/587084293.db2.gz SVWAMCSTEPQAMQ-SNVBAGLBSA-N 1 2 233.315 2.024 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C[C@@H]1CC=CCC1 ZINC000821239594 587103416 /nfs/dbraw/zinc/10/34/16/587103416.db2.gz SYVBQWOXAYEYRO-GFCCVEGCSA-N 1 2 247.342 2.266 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)[C@@]1(C)C=CCC1 ZINC000821309346 587106419 /nfs/dbraw/zinc/10/64/19/587106419.db2.gz RUDQTTJBUAIGPS-RISCZKNCSA-N 1 2 247.342 2.437 20 0 BEADLO CN(C)c1[nH+]cccc1COC(=O)C1CC=CC1 ZINC000821608218 587132322 /nfs/dbraw/zinc/13/23/22/587132322.db2.gz XUFHEIGBRLJPME-UHFFFAOYSA-N 1 2 246.310 2.157 20 0 BEADLO C[C@H](NC(=O)/C=C/c1cn(C)c[nH+]1)C1CCCC1 ZINC000822058858 587150734 /nfs/dbraw/zinc/15/07/34/587150734.db2.gz MAZDKCAPZKXQIK-AEZGRPFRSA-N 1 2 247.342 2.128 20 0 BEADLO C[C@@H]1CN(C(=O)Cc2[nH]cc[nH+]2)c2ccccc21 ZINC000822182362 587158082 /nfs/dbraw/zinc/15/80/82/587158082.db2.gz IETHSSGNQFKVTR-SNVBAGLBSA-N 1 2 241.294 2.103 20 0 BEADLO CCC(=O)OCc1[nH]c[nH+]c1C(C)(C)C ZINC000822309019 587161338 /nfs/dbraw/zinc/16/13/38/587161338.db2.gz WYHKTTMHUBVOCL-UHFFFAOYSA-N 1 2 210.277 2.160 20 0 BEADLO CCCCC1(C(=O)NCCc2cn(C)c[nH+]2)CC1 ZINC000822365642 587164146 /nfs/dbraw/zinc/16/41/46/587164146.db2.gz ZRWNRTZGCPMZIC-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO CS[C@@H]1CC[C@@H]1[NH2+][C@@H](C)C(=O)OCC(C)C ZINC000822475955 587170665 /nfs/dbraw/zinc/17/06/65/587170665.db2.gz DZIWOKCCRPAGPJ-GARJFASQSA-N 1 2 245.388 2.058 20 0 BEADLO ClC1(Cl)C[C@H]1CCn1cc[nH+]c1 ZINC000822696419 587181951 /nfs/dbraw/zinc/18/19/51/587181951.db2.gz OAXSSPGOPGLWPT-SSDOTTSWSA-N 1 2 205.088 2.467 20 0 BEADLO C[C@H]1CC(C)(C)CN1C(=O)/C=C\c1cn(C)c[nH+]1 ZINC000822738232 587183889 /nfs/dbraw/zinc/18/38/89/587183889.db2.gz HLSSKNIIRGRHGS-GZTOBOFZSA-N 1 2 247.342 2.080 20 0 BEADLO Cc1cc(C)cc(N(C)C(=O)Cc2[nH]cc[nH+]2)c1 ZINC000822926724 587194172 /nfs/dbraw/zinc/19/41/72/587194172.db2.gz OOMNTUCNUPIGSU-UHFFFAOYSA-N 1 2 243.310 2.232 20 0 BEADLO CCn1ccc(C(=O)N[C@H](C)c2[nH]cc[nH+]2)c1C ZINC000823085117 587201986 /nfs/dbraw/zinc/20/19/86/587201986.db2.gz LWVLWFJCMVLVCH-SECBINFHSA-N 1 2 246.314 2.031 20 0 BEADLO CCC[C@@H](CC)C(=O)NCc1[nH+]ccn1CC ZINC000823308380 587215429 /nfs/dbraw/zinc/21/54/29/587215429.db2.gz YJEKCSLKISQCNP-LLVKDONJSA-N 1 2 237.347 2.346 20 0 BEADLO CO[C@H]1CC[N@H+](Cc2ccnc(Cl)c2F)C1 ZINC000823459859 587224142 /nfs/dbraw/zinc/22/41/42/587224142.db2.gz ZNHSUVIEZNMWRQ-VIFPVBQESA-N 1 2 244.697 2.095 20 0 BEADLO CO[C@H]1CC[N@@H+](Cc2ccnc(Cl)c2F)C1 ZINC000823459859 587224143 /nfs/dbraw/zinc/22/41/43/587224143.db2.gz ZNHSUVIEZNMWRQ-VIFPVBQESA-N 1 2 244.697 2.095 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)C2CCC=CCC2)S1 ZINC000823807169 587241176 /nfs/dbraw/zinc/24/11/76/587241176.db2.gz RYIUJBKPHIQICS-VIFPVBQESA-N 1 2 238.356 2.340 20 0 BEADLO Cc1cc(C[N@H+](C2CC2)C2COC2)c(C)o1 ZINC000824471965 587271504 /nfs/dbraw/zinc/27/15/04/587271504.db2.gz LCKJAOBTAVLUPG-UHFFFAOYSA-N 1 2 221.300 2.260 20 0 BEADLO Cc1cc(C[N@@H+](C2CC2)C2COC2)c(C)o1 ZINC000824471965 587271505 /nfs/dbraw/zinc/27/15/05/587271505.db2.gz LCKJAOBTAVLUPG-UHFFFAOYSA-N 1 2 221.300 2.260 20 0 BEADLO Fc1cccn2cc(C[NH+]3CC4(CC4)C3)nc12 ZINC000824533670 587274077 /nfs/dbraw/zinc/27/40/77/587274077.db2.gz JLQXDJQPQSCISI-UHFFFAOYSA-N 1 2 231.274 2.069 20 0 BEADLO Cc1nc(F)ccc1C[N@@H+]1CC[C@@H](F)C1 ZINC000824572530 587276965 /nfs/dbraw/zinc/27/69/65/587276965.db2.gz ZFLWNZCKXMAAEP-SNVBAGLBSA-N 1 2 212.243 2.073 20 0 BEADLO Cc1nc(F)ccc1C[N@H+]1CC[C@@H](F)C1 ZINC000824572530 587276966 /nfs/dbraw/zinc/27/69/66/587276966.db2.gz ZFLWNZCKXMAAEP-SNVBAGLBSA-N 1 2 212.243 2.073 20 0 BEADLO CCCCC1(C(=O)N(C)Cc2c[nH+]c[nH]2)CC1 ZINC000824629128 587280104 /nfs/dbraw/zinc/28/01/04/587280104.db2.gz PXZXGLWTHPZUGW-UHFFFAOYSA-N 1 2 235.331 2.339 20 0 BEADLO CCCCC1(C(=O)N(C)Cc2c[nH]c[nH+]2)CC1 ZINC000824629128 587280105 /nfs/dbraw/zinc/28/01/05/587280105.db2.gz PXZXGLWTHPZUGW-UHFFFAOYSA-N 1 2 235.331 2.339 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)C[C@H]1CC=CCC1 ZINC000824628534 587280362 /nfs/dbraw/zinc/28/03/62/587280362.db2.gz HDQJLQNYPMUFAJ-NSHDSACASA-N 1 2 233.315 2.115 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)C[C@H]1CC=CCC1 ZINC000824628534 587280363 /nfs/dbraw/zinc/28/03/63/587280363.db2.gz HDQJLQNYPMUFAJ-NSHDSACASA-N 1 2 233.315 2.115 20 0 BEADLO CC[C@H](C)N(CC)C(=O)/C=C/c1cn(C)c[nH+]1 ZINC000824652281 587281208 /nfs/dbraw/zinc/28/12/08/587281208.db2.gz YXRSUHMIFHSOOC-AEZGRPFRSA-N 1 2 235.331 2.080 20 0 BEADLO Cn1ncc(C(F)(F)F)c1C[N@@H+]1CCC1(C)C ZINC000824823904 587289291 /nfs/dbraw/zinc/28/92/91/587289291.db2.gz FXYDEHXCPKXDTJ-UHFFFAOYSA-N 1 2 247.264 2.423 20 0 BEADLO Cn1ncc(C(F)(F)F)c1C[N@H+]1CCC1(C)C ZINC000824823904 587289292 /nfs/dbraw/zinc/28/92/92/587289292.db2.gz FXYDEHXCPKXDTJ-UHFFFAOYSA-N 1 2 247.264 2.423 20 0 BEADLO CC[C@@H](C)C[NH2+]c1ccc(O[C@H]2CC(=O)N2)cc1 ZINC000824998815 587298090 /nfs/dbraw/zinc/29/80/90/587298090.db2.gz CWVADDHGWPAAED-YGRLFVJLSA-N 1 2 248.326 2.369 20 0 BEADLO CCCCCNc1[nH+]ccc(C)c1-c1nn[nH]n1 ZINC000825275832 587312124 /nfs/dbraw/zinc/31/21/24/587312124.db2.gz CQTXBHKOVOOODD-UHFFFAOYSA-N 1 2 246.318 2.172 20 0 BEADLO CCCCC1(C(=O)N[C@@H]2CCn3c[nH+]cc32)CC1 ZINC000825512413 587322651 /nfs/dbraw/zinc/32/26/51/587322651.db2.gz DHHGOUDDPBCTGB-LLVKDONJSA-N 1 2 247.342 2.415 20 0 BEADLO O=C(NCC1=CCCC1)c1cc2c[nH+]ccc2[nH]1 ZINC000825661085 587329714 /nfs/dbraw/zinc/32/97/14/587329714.db2.gz IQHMYOMZQOULHA-UHFFFAOYSA-N 1 2 241.294 2.403 20 0 BEADLO CC(C)[C@H]1CCC[C@@H](NC(=O)Cc2[nH]cc[nH+]2)C1 ZINC000826131768 587351088 /nfs/dbraw/zinc/35/10/88/587351088.db2.gz ZWSKQAZKFYPBHG-NWDGAFQWSA-N 1 2 249.358 2.283 20 0 BEADLO COCC[N@H+](CCF)Cc1cc(C)oc1C ZINC000827053971 587369139 /nfs/dbraw/zinc/36/91/39/587369139.db2.gz JWSXYYLOIILYFU-UHFFFAOYSA-N 1 2 229.295 2.314 20 0 BEADLO COCC[N@@H+](CCF)Cc1cc(C)oc1C ZINC000827053971 587369140 /nfs/dbraw/zinc/36/91/40/587369140.db2.gz JWSXYYLOIILYFU-UHFFFAOYSA-N 1 2 229.295 2.314 20 0 BEADLO Cc1cc(C[NH2+][C@H]2C[C@H](O)c3ccccc32)no1 ZINC000827170334 587371837 /nfs/dbraw/zinc/37/18/37/587371837.db2.gz IDFSGBFELRIGSA-KBPBESRZSA-N 1 2 244.294 2.251 20 0 BEADLO C[N@H+](Cc1coc(C2CC2)n1)CC1=CCCOC1 ZINC000827185189 587372349 /nfs/dbraw/zinc/37/23/49/587372349.db2.gz OBJXSNDHAQFEBR-UHFFFAOYSA-N 1 2 248.326 2.331 20 0 BEADLO C[N@@H+](Cc1coc(C2CC2)n1)CC1=CCCOC1 ZINC000827185189 587372350 /nfs/dbraw/zinc/37/23/50/587372350.db2.gz OBJXSNDHAQFEBR-UHFFFAOYSA-N 1 2 248.326 2.331 20 0 BEADLO CC/C(C)=C/C(=O)N(C)CCCn1cc[nH+]c1 ZINC000827256451 587374376 /nfs/dbraw/zinc/37/43/76/587374376.db2.gz YYYOAGQNXZPPLR-ZRDIBKRKSA-N 1 2 235.331 2.088 20 0 BEADLO CC(C(=O)N(C)CCCn1cc[nH+]c1)=C1CCC1 ZINC000827256454 587374416 /nfs/dbraw/zinc/37/44/16/587374416.db2.gz ZAZVXJYXYWKPRY-UHFFFAOYSA-N 1 2 247.342 2.232 20 0 BEADLO CSC(C)(C)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000827400981 587380016 /nfs/dbraw/zinc/38/00/16/587380016.db2.gz KCXVEHJQIRRCJB-UHFFFAOYSA-N 1 2 249.339 2.414 20 0 BEADLO CCC(C)=CC(=O)Nc1cc(C)[nH+]cc1C ZINC000827492333 587382513 /nfs/dbraw/zinc/38/25/13/587382513.db2.gz WXILGWYGAQLHKC-RMKNXTFCSA-N 1 2 218.300 2.415 20 0 BEADLO Cc1ccc([N@H+](C)C[C@@H]2CCNC(=O)CC2)cc1 ZINC000827641078 587393785 /nfs/dbraw/zinc/39/37/85/587393785.db2.gz HORAWGDVIZKSJC-ZDUSSCGKSA-N 1 2 246.354 2.348 20 0 BEADLO Cc1ccc([N@@H+](C)C[C@@H]2CCNC(=O)CC2)cc1 ZINC000827641078 587393787 /nfs/dbraw/zinc/39/37/87/587393787.db2.gz HORAWGDVIZKSJC-ZDUSSCGKSA-N 1 2 246.354 2.348 20 0 BEADLO CC/C(C)=C/C(=O)N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000827722063 587399162 /nfs/dbraw/zinc/39/91/62/587399162.db2.gz XWIVTVYCHQKWJI-ZKQHCESOSA-N 1 2 247.342 2.092 20 0 BEADLO CC(C)CC(=O)CC[N@H+](C)Cc1ccon1 ZINC000827936740 587411116 /nfs/dbraw/zinc/41/11/16/587411116.db2.gz UNXKLJRFBSUYIK-UHFFFAOYSA-N 1 2 224.304 2.112 20 0 BEADLO CC(C)CC(=O)CC[N@@H+](C)Cc1ccon1 ZINC000827936740 587411117 /nfs/dbraw/zinc/41/11/17/587411117.db2.gz UNXKLJRFBSUYIK-UHFFFAOYSA-N 1 2 224.304 2.112 20 0 BEADLO C[C@]1(Cn2cc[nH+]c2)CC1(Cl)Cl ZINC000828110354 587419793 /nfs/dbraw/zinc/41/97/93/587419793.db2.gz ZRYMORAKPGKNHI-SSDOTTSWSA-N 1 2 205.088 2.467 20 0 BEADLO Cc1cn2c([nH+]1)CN(CCC(=O)CC(C)C)CC2 ZINC000828212661 587424021 /nfs/dbraw/zinc/42/40/21/587424021.db2.gz VTNNVPZNKRODCO-UHFFFAOYSA-N 1 2 249.358 2.012 20 0 BEADLO C[C@@H](CC1CCC1)NC(=O)/C=C/c1cn(C)c[nH+]1 ZINC000828271486 587429787 /nfs/dbraw/zinc/42/97/87/587429787.db2.gz ZODULWHRXUOGRL-MLRMMBSGSA-N 1 2 247.342 2.128 20 0 BEADLO CC[C@H]1CCCCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC000828444069 587442851 /nfs/dbraw/zinc/44/28/51/587442851.db2.gz UHFXUMBNJVVBOR-NSHDSACASA-N 1 2 235.331 2.133 20 0 BEADLO CCC[C@@]1(C)CCCN(C(=O)Cc2[nH]cc[nH+]2)C1 ZINC000829255247 587490416 /nfs/dbraw/zinc/49/04/16/587490416.db2.gz RMBCLTXAVYCVNN-AWEZNQCLSA-N 1 2 249.358 2.381 20 0 BEADLO C[C@@]1([NH2+]CC/C=C/c2ccccc2)CCOC1=O ZINC000829962587 587530396 /nfs/dbraw/zinc/53/03/96/587530396.db2.gz LGLIVTVOPKRRAU-FUVBFXSKSA-N 1 2 245.322 2.385 20 0 BEADLO C[C@]1([NH2+]CCC2=CCCCC2)CCOC1=O ZINC000829962624 587530497 /nfs/dbraw/zinc/53/04/97/587530497.db2.gz MOIOQBPXKIBXHI-ZDUSSCGKSA-N 1 2 223.316 2.172 20 0 BEADLO CCCC[C@H](NC(=O)Cc1[nH]cc[nH+]1)C1CCC1 ZINC000829982646 587530948 /nfs/dbraw/zinc/53/09/48/587530948.db2.gz SYEUQFLZLXWYCS-LBPRGKRZSA-N 1 2 249.358 2.427 20 0 BEADLO CCC(CC)(CC)CNC(=O)Cc1[nH]cc[nH+]1 ZINC000830089332 587535166 /nfs/dbraw/zinc/53/51/66/587535166.db2.gz BPHOMKFMYAHVDH-UHFFFAOYSA-N 1 2 237.347 2.285 20 0 BEADLO CCCOC(=O)[C@H](C)[N@@H+]1CCC[C@@](C)(F)C1 ZINC000830212698 587541194 /nfs/dbraw/zinc/54/11/94/587541194.db2.gz TZWQDSSHLONTIA-CMPLNLGQSA-N 1 2 231.311 2.152 20 0 BEADLO CCCOC(=O)[C@H](C)[N@H+]1CCC[C@@](C)(F)C1 ZINC000830212698 587541195 /nfs/dbraw/zinc/54/11/95/587541195.db2.gz TZWQDSSHLONTIA-CMPLNLGQSA-N 1 2 231.311 2.152 20 0 BEADLO CC(C)[N@H+](Cc1ccnc(Cl)c1)C1COC1 ZINC000830217304 587541539 /nfs/dbraw/zinc/54/15/39/587541539.db2.gz GVNCKUXJRCMQRA-UHFFFAOYSA-N 1 2 240.734 2.344 20 0 BEADLO CC(C)[N@@H+](Cc1ccnc(Cl)c1)C1COC1 ZINC000830217304 587541541 /nfs/dbraw/zinc/54/15/41/587541541.db2.gz GVNCKUXJRCMQRA-UHFFFAOYSA-N 1 2 240.734 2.344 20 0 BEADLO O[C@H](C[N@@H+]1CC[C@@H](F)C1)c1c(F)cccc1F ZINC000830467231 587552325 /nfs/dbraw/zinc/55/23/25/587552325.db2.gz JCONXCMWDZHTJU-LDYMZIIASA-N 1 2 245.244 2.042 20 0 BEADLO O[C@H](C[N@H+]1CC[C@@H](F)C1)c1c(F)cccc1F ZINC000830467231 587552327 /nfs/dbraw/zinc/55/23/27/587552327.db2.gz JCONXCMWDZHTJU-LDYMZIIASA-N 1 2 245.244 2.042 20 0 BEADLO O=C(/C=C\C1CCCC1)OCCn1cc[nH+]c1 ZINC000830792739 587570673 /nfs/dbraw/zinc/57/06/73/587570673.db2.gz GCBWEKGODITRDZ-WAYWQWQTSA-N 1 2 234.299 2.173 20 0 BEADLO Cc1ccc(NC(=O)CCCF)c(N(C)C)[nH+]1 ZINC000830890671 587575110 /nfs/dbraw/zinc/57/51/10/587575110.db2.gz PTJFJQYXANHNBH-UHFFFAOYSA-N 1 2 239.294 2.144 20 0 BEADLO O[C@]1(C(F)F)CC[N@H+](C/C(Cl)=C/Cl)C1 ZINC000831176040 587589375 /nfs/dbraw/zinc/58/93/75/587589375.db2.gz RKVJWBCLTUQYID-WAXIIBMWSA-N 1 2 246.084 2.007 20 0 BEADLO O[C@]1(C(F)F)CC[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000831176040 587589377 /nfs/dbraw/zinc/58/93/77/587589377.db2.gz RKVJWBCLTUQYID-WAXIIBMWSA-N 1 2 246.084 2.007 20 0 BEADLO CCON(CC)C(=O)c1ccn2cc(C)[nH+]c2c1 ZINC000831451112 587608256 /nfs/dbraw/zinc/60/82/56/587608256.db2.gz LXJHXEZHISNMOS-UHFFFAOYSA-N 1 2 247.298 2.056 20 0 BEADLO CCCC[C@@](C)(F)C(=O)NC1C[NH+](C(C)C)C1 ZINC000832486664 587663130 /nfs/dbraw/zinc/66/31/30/587663130.db2.gz XYAIIBQQZVRQAS-CYBMUJFWSA-N 1 2 244.354 2.114 20 0 BEADLO CCON(Cc1c[nH+]cn1C)Cc1ccccc1 ZINC000832795509 587690399 /nfs/dbraw/zinc/69/03/99/587690399.db2.gz GXIKVZWDSQRJGV-UHFFFAOYSA-N 1 2 245.326 2.374 20 0 BEADLO CCC(C)(CC)C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833279024 587703299 /nfs/dbraw/zinc/70/32/99/587703299.db2.gz XMQYMEUDKQUYSG-JTQLQIEISA-N 1 2 235.331 2.270 20 0 BEADLO CC(C)C[C@H](C)C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833278036 587703317 /nfs/dbraw/zinc/70/33/17/587703317.db2.gz LZTZEPKSCASIME-QWRGUYRKSA-N 1 2 235.331 2.126 20 0 BEADLO CC[C@@H](C)CCC(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833271635 587703704 /nfs/dbraw/zinc/70/37/04/587703704.db2.gz IMUXTZYRAMKXCK-MNOVXSKESA-N 1 2 235.331 2.270 20 0 BEADLO C[C@@H]1CCC[C@@H]1CC(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833279001 587704149 /nfs/dbraw/zinc/70/41/49/587704149.db2.gz WNTZWDNBEZFEFU-IJLUTSLNSA-N 1 2 247.342 2.270 20 0 BEADLO CC(C)(C)CCC(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833292680 587704799 /nfs/dbraw/zinc/70/47/99/587704799.db2.gz KCIDIGIZIHIYQB-JTQLQIEISA-N 1 2 235.331 2.270 20 0 BEADLO C[C@@H](C(=O)N[C@@H]1CCn2cc[nH+]c21)C1CCCC1 ZINC000833284132 587704932 /nfs/dbraw/zinc/70/49/32/587704932.db2.gz GXIHNKDUTSFELI-ZYHUDNBSSA-N 1 2 247.342 2.270 20 0 BEADLO CCC[C@H](C)CC(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833293369 587705133 /nfs/dbraw/zinc/70/51/33/587705133.db2.gz XIJZAFQQPBMWEC-QWRGUYRKSA-N 1 2 235.331 2.270 20 0 BEADLO O=C(CC1CCCCC1)N[C@@H]1CCn2cc[nH+]c21 ZINC000833311633 587705434 /nfs/dbraw/zinc/70/54/34/587705434.db2.gz ZMLKOMGRIPEJLV-GFCCVEGCSA-N 1 2 247.342 2.415 20 0 BEADLO CC1(c2noc(-c3ccc4[nH+]ccn4c3)n2)CC1 ZINC000834882478 587769461 /nfs/dbraw/zinc/76/94/61/587769461.db2.gz KQDQAXCPXDSIDT-UHFFFAOYSA-N 1 2 240.266 2.436 20 0 BEADLO O=C(OC1CC1)c1cccc(Cn2cc[nH+]c2)c1 ZINC000835333610 587796710 /nfs/dbraw/zinc/79/67/10/587796710.db2.gz KFTRBSADXCRUSY-UHFFFAOYSA-N 1 2 242.278 2.251 20 0 BEADLO O=C(OCCn1cc[nH+]c1)C1(C2CCC2)CCC1 ZINC000835349842 587797924 /nfs/dbraw/zinc/79/79/24/587797924.db2.gz LUNJLNHVAQRKFP-UHFFFAOYSA-N 1 2 248.326 2.397 20 0 BEADLO CC[C@H](C)Cc1noc([C@H](C)[NH+](C)C)n1 ZINC000867136561 587816370 /nfs/dbraw/zinc/81/63/70/587816370.db2.gz KNAYVIKASCOWIR-IUCAKERBSA-N 1 2 211.309 2.281 20 0 BEADLO CC[C@@H](C)Cc1noc([C@H](C)[NH+](C)C)n1 ZINC000867136560 587816381 /nfs/dbraw/zinc/81/63/81/587816381.db2.gz KNAYVIKASCOWIR-BDAKNGLRSA-N 1 2 211.309 2.281 20 0 BEADLO CCCC[N@H+](C)Cn1nc(C)n(CC)c1=S ZINC000102389579 587829510 /nfs/dbraw/zinc/82/95/10/587829510.db2.gz DFASCOJTWFLGTG-UHFFFAOYSA-N 1 2 242.392 2.432 20 0 BEADLO CCCC[N@@H+](C)Cn1nc(C)n(CC)c1=S ZINC000102389579 587829511 /nfs/dbraw/zinc/82/95/11/587829511.db2.gz DFASCOJTWFLGTG-UHFFFAOYSA-N 1 2 242.392 2.432 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)C(C)=C(C)C ZINC000836951778 587843426 /nfs/dbraw/zinc/84/34/26/587843426.db2.gz ZSEAGLHFZAIUSI-NSHDSACASA-N 1 2 235.331 2.437 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)C=C1CCC1 ZINC000836949708 587843655 /nfs/dbraw/zinc/84/36/55/587843655.db2.gz MMBYXPDLBGFNTH-JTQLQIEISA-N 1 2 233.315 2.191 20 0 BEADLO CC/C=C(\C)C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000836953677 587843674 /nfs/dbraw/zinc/84/36/74/587843674.db2.gz GWXGOBMAVZWVIE-UJQHZETGSA-N 1 2 233.315 2.361 20 0 BEADLO CC/C(C)=C/C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000836961758 587843999 /nfs/dbraw/zinc/84/39/99/587843999.db2.gz WZQVYPQJKRSWGQ-JKWVPGAPSA-N 1 2 233.315 2.361 20 0 BEADLO C/C=C(/C)C(=O)NCc1c[nH+]c(C)cc1C ZINC000837106161 587854263 /nfs/dbraw/zinc/85/42/63/587854263.db2.gz WUVNGEVRHYYNDR-UITAMQMPSA-N 1 2 218.300 2.281 20 0 BEADLO Cc1cc(C)c(CNC(=O)[C@H](F)C(C)C)c[nH+]1 ZINC000837106157 587854352 /nfs/dbraw/zinc/85/43/52/587854352.db2.gz WTSZQRKCGXSWOB-GFCCVEGCSA-N 1 2 238.306 2.309 20 0 BEADLO O[C@H](Cn1c[nH+]c2cc(F)c(F)cc21)C1CC1 ZINC000840740519 587918956 /nfs/dbraw/zinc/91/89/56/587918956.db2.gz BPZGKXHNUNJUNM-GFCCVEGCSA-N 1 2 238.237 2.085 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1ccc(C)nn1 ZINC000840916544 587929662 /nfs/dbraw/zinc/92/96/62/587929662.db2.gz VZLQUBLFQBHPKH-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1ccc(C)nn1 ZINC000840916544 587929663 /nfs/dbraw/zinc/92/96/63/587929663.db2.gz VZLQUBLFQBHPKH-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CCn1c[nH+]cc1CNc1ccnn1CC1CC1 ZINC000841870443 587979494 /nfs/dbraw/zinc/97/94/94/587979494.db2.gz VKZAOZVZVUTPTC-UHFFFAOYSA-N 1 2 245.330 2.122 20 0 BEADLO CC(C)(C)[C@@H](C[NH3+])[NH2+]Cc1ccnc(Cl)c1 ZINC000842475115 588028873 /nfs/dbraw/zinc/02/88/73/588028873.db2.gz JVLPWGYQOHMRNB-SNVBAGLBSA-N 1 2 241.766 2.198 20 0 BEADLO NC(=[NH+]OCCC[C@@H]1CCOC1)c1ccccc1 ZINC000842649167 588049025 /nfs/dbraw/zinc/04/90/25/588049025.db2.gz ZRSHNUYOGSONLN-GFCCVEGCSA-N 1 2 248.326 2.350 20 0 BEADLO CC[NH2+]Cc1noc(CCc2cccs2)n1 ZINC000843145550 588086811 /nfs/dbraw/zinc/08/68/11/588086811.db2.gz JZFYJSYTIIIAOU-UHFFFAOYSA-N 1 2 237.328 2.026 20 0 BEADLO CC[NH2+]Cc1noc(COc2ccc(C)cc2)n1 ZINC000843145554 588086953 /nfs/dbraw/zinc/08/69/53/588086953.db2.gz KCRFIPKZEJXTPV-UHFFFAOYSA-N 1 2 247.298 2.067 20 0 BEADLO Cc1cn2cc(NC(=O)C3(F)CC3)ccc2[nH+]1 ZINC000843540595 588121417 /nfs/dbraw/zinc/12/14/17/588121417.db2.gz NLADEPWFXHPONG-UHFFFAOYSA-N 1 2 233.246 2.083 20 0 BEADLO O=C(N[C@@H]1CCn2cc[nH+]c21)C1CC2(CCC2)C1 ZINC000843600562 588128788 /nfs/dbraw/zinc/12/87/88/588128788.db2.gz FKEDPPIIBMAXCM-LLVKDONJSA-N 1 2 245.326 2.024 20 0 BEADLO ClC(Cl)=CCOCc1[nH]cc[nH+]1 ZINC000844237111 588176593 /nfs/dbraw/zinc/17/65/93/588176593.db2.gz RUIPHDVXQYRZIF-UHFFFAOYSA-N 1 2 207.060 2.245 20 0 BEADLO CCCOC(=O)[C@H](C)[NH2+]C1(C2CCC2)CC1 ZINC000844418662 588191327 /nfs/dbraw/zinc/19/13/27/588191327.db2.gz IDKVMLSOVJZDTN-JTQLQIEISA-N 1 2 225.332 2.250 20 0 BEADLO C[C@H](CC(=O)Nc1ccc(F)nc1)n1cc[nH+]c1 ZINC000844431498 588192473 /nfs/dbraw/zinc/19/24/73/588192473.db2.gz QXNMWEBQUZNGBD-SECBINFHSA-N 1 2 248.261 2.007 20 0 BEADLO Cc1ccoc1COC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000844544480 588201809 /nfs/dbraw/zinc/20/18/09/588201809.db2.gz SAZBIRBZDSHAEV-NSHDSACASA-N 1 2 248.282 2.479 20 0 BEADLO C[C@H]1CC[C@H](C(=O)N[C@H]2CCn3cc[nH+]c32)CC1 ZINC000844553720 588202009 /nfs/dbraw/zinc/20/20/09/588202009.db2.gz WFFPAEQZDIPDKO-SRVKXCTJSA-N 1 2 247.342 2.270 20 0 BEADLO CC[NH2+]Cc1noc(/C=C/C2CCCC2)n1 ZINC000844907209 588218891 /nfs/dbraw/zinc/21/88/91/588218891.db2.gz XMGASVHRAGUIAD-BQYQJAHWSA-N 1 2 221.304 2.383 20 0 BEADLO C[C@H](CC(=O)OC[Si](C)(C)C)n1cc[nH+]c1 ZINC000845281497 588225345 /nfs/dbraw/zinc/22/53/45/588225345.db2.gz IPBILBLGNPNPSI-SNVBAGLBSA-N 1 2 240.379 2.255 20 0 BEADLO C[C@@H](CC(=O)OC1(C)CCC1)n1cc[nH+]c1 ZINC000845482644 588230165 /nfs/dbraw/zinc/23/01/65/588230165.db2.gz GZWDVHCWVOALHZ-JTQLQIEISA-N 1 2 222.288 2.320 20 0 BEADLO C[C@@H](CC(=O)OCC1CC=CC1)n1cc[nH+]c1 ZINC000845492501 588230592 /nfs/dbraw/zinc/23/05/92/588230592.db2.gz GBIWLXRBNKDKKP-NSHDSACASA-N 1 2 234.299 2.344 20 0 BEADLO C[C@@H](CC(=O)OCC1(C)CC1)n1cc[nH+]c1 ZINC000845546831 588233282 /nfs/dbraw/zinc/23/32/82/588233282.db2.gz DQVSFYYIJDUUJZ-JTQLQIEISA-N 1 2 222.288 2.178 20 0 BEADLO CS[C@@H](C)COC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000845585585 588234185 /nfs/dbraw/zinc/23/41/85/588234185.db2.gz GIKQTUNGOYOHDE-ZJUUUORDSA-N 1 2 242.344 2.129 20 0 BEADLO C/C=C(\C)COC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000845612268 588236085 /nfs/dbraw/zinc/23/60/85/588236085.db2.gz KMKTYDKIRKUTKU-INJWIWPUSA-N 1 2 222.288 2.344 20 0 BEADLO FC1(F)[C@H]2CN(c3cc[nH+]c(C4CC4)n3)C[C@H]21 ZINC000845751609 588243589 /nfs/dbraw/zinc/24/35/89/588243589.db2.gz BESPSJOJYOQSPE-DTORHVGOSA-N 1 2 237.253 2.055 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1Cc1ccc(C)nn1 ZINC000846027734 588253893 /nfs/dbraw/zinc/25/38/93/588253893.db2.gz ORGLYDLQRLXXEK-KGLIPLIRSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@H+]1Cc1ccc(C)nn1 ZINC000846027734 588253894 /nfs/dbraw/zinc/25/38/94/588253894.db2.gz ORGLYDLQRLXXEK-KGLIPLIRSA-N 1 2 249.358 2.174 20 0 BEADLO COCc1cc[nH+]c(NC[C@H]2CCC=CO2)c1 ZINC000846117986 588257798 /nfs/dbraw/zinc/25/77/98/588257798.db2.gz SYXYUBUUDOTKNS-GFCCVEGCSA-N 1 2 234.299 2.333 20 0 BEADLO COCc1cc[nH+]c(NCc2cc(C)on2)c1 ZINC000846117523 588257809 /nfs/dbraw/zinc/25/78/09/588257809.db2.gz OLVCQMZMHCUVPY-UHFFFAOYSA-N 1 2 233.271 2.137 20 0 BEADLO COCc1cc[nH+]c(NC[C@@H]2CCC=CO2)c1 ZINC000846117987 588257865 /nfs/dbraw/zinc/25/78/65/588257865.db2.gz SYXYUBUUDOTKNS-LBPRGKRZSA-N 1 2 234.299 2.333 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2CC[C@@H]2C)c1 ZINC000846117245 588257966 /nfs/dbraw/zinc/25/79/66/588257966.db2.gz LGJUZGATJSGCGG-GXSJLCMTSA-N 1 2 206.289 2.438 20 0 BEADLO CN(C)c1ccc(C[N@@H+]2CCC[C@H](F)C2)cn1 ZINC000846120342 588258224 /nfs/dbraw/zinc/25/82/24/588258224.db2.gz OJCZAMKIOVYMBQ-LBPRGKRZSA-N 1 2 237.322 2.082 20 0 BEADLO CN(C)c1ccc(C[N@H+]2CCC[C@H](F)C2)cn1 ZINC000846120342 588258225 /nfs/dbraw/zinc/25/82/25/588258225.db2.gz OJCZAMKIOVYMBQ-LBPRGKRZSA-N 1 2 237.322 2.082 20 0 BEADLO F[C@H]1CCC[N@H+](Cc2cn3ccccc3n2)C1 ZINC000846120306 588258283 /nfs/dbraw/zinc/25/82/83/588258283.db2.gz ODIKFRHPOMYNOF-NSHDSACASA-N 1 2 233.290 2.268 20 0 BEADLO F[C@H]1CCC[N@@H+](Cc2cn3ccccc3n2)C1 ZINC000846120306 588258284 /nfs/dbraw/zinc/25/82/84/588258284.db2.gz ODIKFRHPOMYNOF-NSHDSACASA-N 1 2 233.290 2.268 20 0 BEADLO CC/C(C)=C\C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000846245764 588262396 /nfs/dbraw/zinc/26/23/96/588262396.db2.gz CPSQMAMEOIDUES-HJWRWDBZSA-N 1 2 221.304 2.117 20 0 BEADLO C/C(=C/C(=O)NC(C)(C)c1[nH]cc[nH+]1)C1CC1 ZINC000846245373 588262546 /nfs/dbraw/zinc/26/25/46/588262546.db2.gz DWHNTOIRECGYLN-HJWRWDBZSA-N 1 2 233.315 2.117 20 0 BEADLO C[C@H](C1CC1)[N@H+](Cc1cnsn1)C1CC1 ZINC000846773789 588287273 /nfs/dbraw/zinc/28/72/73/588287273.db2.gz KSNWSMCNFDQJDN-MRVPVSSYSA-N 1 2 223.345 2.301 20 0 BEADLO C[C@H](C1CC1)[N@@H+](Cc1cnsn1)C1CC1 ZINC000846773789 588287274 /nfs/dbraw/zinc/28/72/74/588287274.db2.gz KSNWSMCNFDQJDN-MRVPVSSYSA-N 1 2 223.345 2.301 20 0 BEADLO CC1(C)COCC[N@@H+]1CC1(Br)CC1 ZINC000846781111 588288125 /nfs/dbraw/zinc/28/81/25/588288125.db2.gz UCNQZXHPDLWDJH-UHFFFAOYSA-N 1 2 248.164 2.025 20 0 BEADLO CC1(C)COCC[N@H+]1CC1(Br)CC1 ZINC000846781111 588288126 /nfs/dbraw/zinc/28/81/26/588288126.db2.gz UCNQZXHPDLWDJH-UHFFFAOYSA-N 1 2 248.164 2.025 20 0 BEADLO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1cnsn1 ZINC000846804278 588289429 /nfs/dbraw/zinc/28/94/29/588289429.db2.gz YSBAFYNYTHPYKZ-RKDXNWHRSA-N 1 2 211.334 2.301 20 0 BEADLO c1nsnc1C[N@@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000846805764 588289665 /nfs/dbraw/zinc/28/96/65/588289665.db2.gz IGQFGLVYRYZGTC-ONGXEEELSA-N 1 2 223.345 2.303 20 0 BEADLO c1nsnc1C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000846805764 588289666 /nfs/dbraw/zinc/28/96/66/588289666.db2.gz IGQFGLVYRYZGTC-ONGXEEELSA-N 1 2 223.345 2.303 20 0 BEADLO C[C@@H]([N@H+](C)Cc1cnsn1)C1(C)CC1 ZINC000846814869 588290951 /nfs/dbraw/zinc/29/09/51/588290951.db2.gz VEHRWAZWULXXRF-MRVPVSSYSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]([N@@H+](C)Cc1cnsn1)C1(C)CC1 ZINC000846814869 588290952 /nfs/dbraw/zinc/29/09/52/588290952.db2.gz VEHRWAZWULXXRF-MRVPVSSYSA-N 1 2 211.334 2.159 20 0 BEADLO c1nsnc1C[N@@H+]1CC[C@@H]1Cc1ccccc1 ZINC000846813714 588290962 /nfs/dbraw/zinc/29/09/62/588290962.db2.gz JNJXVCHURCGOBI-CYBMUJFWSA-N 1 2 245.351 2.355 20 0 BEADLO c1nsnc1C[N@H+]1CC[C@@H]1Cc1ccccc1 ZINC000846813714 588290963 /nfs/dbraw/zinc/29/09/63/588290963.db2.gz JNJXVCHURCGOBI-CYBMUJFWSA-N 1 2 245.351 2.355 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cnsn2)CC[C@@H]1C ZINC000846841469 588292517 /nfs/dbraw/zinc/29/25/17/588292517.db2.gz OEVYOQSYDYFSKQ-IUCAKERBSA-N 1 2 211.334 2.016 20 0 BEADLO C[C@H]1C[N@H+](Cc2cnsn2)CC[C@@H]1C ZINC000846841469 588292518 /nfs/dbraw/zinc/29/25/18/588292518.db2.gz OEVYOQSYDYFSKQ-IUCAKERBSA-N 1 2 211.334 2.016 20 0 BEADLO COC[C@H]([NH2+]Cc1cnsn1)c1ccccc1 ZINC000846844900 588293052 /nfs/dbraw/zinc/29/30/52/588293052.db2.gz QUOFTGXMQLTANG-LBPRGKRZSA-N 1 2 249.339 2.015 20 0 BEADLO Cc1ccncc1[C@H](C)[NH2+]Cc1cnsn1 ZINC000846849844 588293133 /nfs/dbraw/zinc/29/31/33/588293133.db2.gz IHTFEFKPBTXRNV-VIFPVBQESA-N 1 2 234.328 2.092 20 0 BEADLO CCCCOC(=O)[C@H](C)[NH2+][C@H]1CCC1(C)C ZINC000846959484 588298533 /nfs/dbraw/zinc/29/85/33/588298533.db2.gz IXBWYWHUYAQSNY-QWRGUYRKSA-N 1 2 227.348 2.496 20 0 BEADLO O=C1CC[N@@H+](C/C=C/Cl)C2(CCC2)C1 ZINC000846997310 588301088 /nfs/dbraw/zinc/30/10/88/588301088.db2.gz ZRUWKRCFEFRTSJ-QHHAFSJGSA-N 1 2 213.708 2.327 20 0 BEADLO O=C1CC[N@H+](C/C=C/Cl)C2(CCC2)C1 ZINC000846997310 588301089 /nfs/dbraw/zinc/30/10/89/588301089.db2.gz ZRUWKRCFEFRTSJ-QHHAFSJGSA-N 1 2 213.708 2.327 20 0 BEADLO C[C@@H](NC(=O)C[C@H](C)C1CC1)c1[nH]cc[nH+]1 ZINC000848387178 588375621 /nfs/dbraw/zinc/37/56/21/588375621.db2.gz MDMASACJULSCDR-DTWKUNHWSA-N 1 2 221.304 2.023 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OCCC(C)(C)C1CC1 ZINC000848510882 588388411 /nfs/dbraw/zinc/38/84/11/588388411.db2.gz XNYMHGJZCWXCRA-SECBINFHSA-N 1 2 228.336 2.346 20 0 BEADLO COc1c(C)[nH+]cnc1N1CCC[C@](C)(F)C1 ZINC000848713814 588408151 /nfs/dbraw/zinc/40/81/51/588408151.db2.gz UTCIEJMKDDUBDZ-LBPRGKRZSA-N 1 2 239.294 2.122 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1cnc(Cl)n1C ZINC000848908463 588419274 /nfs/dbraw/zinc/41/92/74/588419274.db2.gz VFRWTLRMCVNYNS-YUMQZZPRSA-N 1 2 213.712 2.056 20 0 BEADLO C[NH+](C)c1ccc(-n2cc(C3CC3)nn2)cc1 ZINC000849146629 588455605 /nfs/dbraw/zinc/45/56/05/588455605.db2.gz STWHHYIQPCCHEZ-UHFFFAOYSA-N 1 2 228.299 2.211 20 0 BEADLO COc1cc(C)c([NH2+]CC[C@H](C)O)cc1C ZINC000849316217 588471988 /nfs/dbraw/zinc/47/19/88/588471988.db2.gz VXSIUSTZNWBPRM-NSHDSACASA-N 1 2 223.316 2.495 20 0 BEADLO COCc1csc(C[NH2+]C(CF)CF)c1 ZINC000850313060 588536097 /nfs/dbraw/zinc/53/60/97/588536097.db2.gz NFRVGYALHVOJKK-UHFFFAOYSA-N 1 2 235.299 2.292 20 0 BEADLO O[C@@H]1C[C@H]([NH2+]Cc2nccs2)c2ccccc21 ZINC000850372829 588541470 /nfs/dbraw/zinc/54/14/70/588541470.db2.gz ZPONVCNDGBIWRR-NWDGAFQWSA-N 1 2 246.335 2.411 20 0 BEADLO O[C@H]1C[C@@H]([NH2+]Cc2nccs2)c2ccccc21 ZINC000850372828 588541546 /nfs/dbraw/zinc/54/15/46/588541546.db2.gz ZPONVCNDGBIWRR-NEPJUHHUSA-N 1 2 246.335 2.411 20 0 BEADLO COc1cc(C)c(C)cc1[NH2+][C@H](C)CCO ZINC000850500171 588552205 /nfs/dbraw/zinc/55/22/05/588552205.db2.gz BILSITHVCPTZIU-LLVKDONJSA-N 1 2 223.316 2.495 20 0 BEADLO C1=C[C@@H]([NH2+][C@H](c2nnc[nH]2)c2ccccc2)CC1 ZINC000850510876 588555125 /nfs/dbraw/zinc/55/51/25/588555125.db2.gz XBZREBHILUJUPI-OLZOCXBDSA-N 1 2 240.310 2.202 20 0 BEADLO C[C@H](CCO)[NH2+]CC(F)(F)c1ccc(F)cc1 ZINC000850562191 588560803 /nfs/dbraw/zinc/56/08/03/588560803.db2.gz UCLNVQPLMASCME-SECBINFHSA-N 1 2 247.260 2.278 20 0 BEADLO Cc1ccc(COC(=O)[C@@H]2C[C@@H](C)CO2)c(C)[nH+]1 ZINC000885577124 588562040 /nfs/dbraw/zinc/56/20/40/588562040.db2.gz UWZAGEDGTOFGOD-RNCFNFMXSA-N 1 2 249.310 2.167 20 0 BEADLO CCC(F)(F)COC(=O)[C@H]1CCCC[N@@H+]1C ZINC000851490731 588607855 /nfs/dbraw/zinc/60/78/55/588607855.db2.gz FFBUHKBJJSWAPC-SECBINFHSA-N 1 2 235.274 2.059 20 0 BEADLO CCC(F)(F)COC(=O)[C@H]1CCCC[N@H+]1C ZINC000851490731 588607856 /nfs/dbraw/zinc/60/78/56/588607856.db2.gz FFBUHKBJJSWAPC-SECBINFHSA-N 1 2 235.274 2.059 20 0 BEADLO CC[N@@H+]1CCCC[C@H]1C(=O)OCC(F)(F)CC ZINC000851492149 588607950 /nfs/dbraw/zinc/60/79/50/588607950.db2.gz VGYKGRYWSGGPJB-JTQLQIEISA-N 1 2 249.301 2.449 20 0 BEADLO CC[N@H+]1CCCC[C@H]1C(=O)OCC(F)(F)CC ZINC000851492149 588607951 /nfs/dbraw/zinc/60/79/51/588607951.db2.gz VGYKGRYWSGGPJB-JTQLQIEISA-N 1 2 249.301 2.449 20 0 BEADLO Fc1ccc(C[N@H+](Cc2cnon2)C2CC2)cc1 ZINC000851711260 588615178 /nfs/dbraw/zinc/61/51/78/588615178.db2.gz XTFJRWSWGDTIGN-UHFFFAOYSA-N 1 2 247.273 2.373 20 0 BEADLO Fc1ccc(C[N@@H+](Cc2cnon2)C2CC2)cc1 ZINC000851711260 588615179 /nfs/dbraw/zinc/61/51/79/588615179.db2.gz XTFJRWSWGDTIGN-UHFFFAOYSA-N 1 2 247.273 2.373 20 0 BEADLO CC[N@H+](Cc1cnon1)Cc1ccccc1 ZINC000851713923 588615981 /nfs/dbraw/zinc/61/59/81/588615981.db2.gz KYRLIQOJEIOACP-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO CC[N@@H+](Cc1cnon1)Cc1ccccc1 ZINC000851713923 588615982 /nfs/dbraw/zinc/61/59/82/588615982.db2.gz KYRLIQOJEIOACP-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO Cc1cc([C@@H]2CCC[N@@H+]2CCOC(F)F)no1 ZINC000851715844 588616312 /nfs/dbraw/zinc/61/63/12/588616312.db2.gz CNUAJDMTAJBMGO-JTQLQIEISA-N 1 2 246.257 2.359 20 0 BEADLO Cc1cc([C@@H]2CCC[N@H+]2CCOC(F)F)no1 ZINC000851715844 588616313 /nfs/dbraw/zinc/61/63/13/588616313.db2.gz CNUAJDMTAJBMGO-JTQLQIEISA-N 1 2 246.257 2.359 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1cccc(F)n1 ZINC000851729245 588619140 /nfs/dbraw/zinc/61/91/40/588619140.db2.gz IXIITCKJMJUTOD-PWSUYJOCSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1cccc(F)n1 ZINC000851729245 588619141 /nfs/dbraw/zinc/61/91/41/588619141.db2.gz IXIITCKJMJUTOD-PWSUYJOCSA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H]1c2ccccc2CC[N@H+]1Cc1cnon1 ZINC000851762399 588624656 /nfs/dbraw/zinc/62/46/56/588624656.db2.gz PGZYWJLHEPIAOI-SNVBAGLBSA-N 1 2 229.283 2.189 20 0 BEADLO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1cnon1 ZINC000851762399 588624657 /nfs/dbraw/zinc/62/46/57/588624657.db2.gz PGZYWJLHEPIAOI-SNVBAGLBSA-N 1 2 229.283 2.189 20 0 BEADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cnon1 ZINC000851784920 588628240 /nfs/dbraw/zinc/62/82/40/588628240.db2.gz XFYUKGKOEQYCLF-SNVBAGLBSA-N 1 2 229.283 2.016 20 0 BEADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1cnon1 ZINC000851784920 588628241 /nfs/dbraw/zinc/62/82/41/588628241.db2.gz XFYUKGKOEQYCLF-SNVBAGLBSA-N 1 2 229.283 2.016 20 0 BEADLO Cc1cccnc1[C@H]([NH2+]Cc1cnon1)C(C)C ZINC000851844288 588634681 /nfs/dbraw/zinc/63/46/81/588634681.db2.gz UHQATEHTVPPEGN-GFCCVEGCSA-N 1 2 246.314 2.260 20 0 BEADLO ClC(Cl)=CC[N@@H+]1CCOCC2(CC2)C1 ZINC000851920161 588637594 /nfs/dbraw/zinc/63/75/94/588637594.db2.gz WCWVSJQRAUQJGK-UHFFFAOYSA-N 1 2 236.142 2.418 20 0 BEADLO ClC(Cl)=CC[N@H+]1CCOCC2(CC2)C1 ZINC000851920161 588637595 /nfs/dbraw/zinc/63/75/95/588637595.db2.gz WCWVSJQRAUQJGK-UHFFFAOYSA-N 1 2 236.142 2.418 20 0 BEADLO CC1(C)OC[C@@H](CC[N@@H+]2CCC[C@H]2C(F)F)O1 ZINC000851880728 588639527 /nfs/dbraw/zinc/63/95/27/588639527.db2.gz UBBHJJQNRRKFRB-ZJUUUORDSA-N 1 2 249.301 2.258 20 0 BEADLO CC1(C)OC[C@@H](CC[N@H+]2CCC[C@H]2C(F)F)O1 ZINC000851880728 588639528 /nfs/dbraw/zinc/63/95/28/588639528.db2.gz UBBHJJQNRRKFRB-ZJUUUORDSA-N 1 2 249.301 2.258 20 0 BEADLO CCOCC[N@H+](C)CC=C(Cl)Cl ZINC000851889548 588640748 /nfs/dbraw/zinc/64/07/48/588640748.db2.gz BCMOUCCQDFPIFD-UHFFFAOYSA-N 1 2 212.120 2.274 20 0 BEADLO CCOCC[N@@H+](C)CC=C(Cl)Cl ZINC000851889548 588640749 /nfs/dbraw/zinc/64/07/49/588640749.db2.gz BCMOUCCQDFPIFD-UHFFFAOYSA-N 1 2 212.120 2.274 20 0 BEADLO CC[C@@H]([NH2+]Cc1cnon1)c1ccc(OC)cc1 ZINC000851893057 588641419 /nfs/dbraw/zinc/64/14/19/588641419.db2.gz OYPJHBZTKROQLR-CYBMUJFWSA-N 1 2 247.298 2.319 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2cnon2)cc1F ZINC000851904921 588641992 /nfs/dbraw/zinc/64/19/92/588641992.db2.gz ABBAFINREBMNJB-SECBINFHSA-N 1 2 235.262 2.368 20 0 BEADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1cnon1 ZINC000851912627 588643209 /nfs/dbraw/zinc/64/32/09/588643209.db2.gz OCIRFAXYFLCASR-HTQZYQBOSA-N 1 2 249.236 2.232 20 0 BEADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1cnon1 ZINC000851912627 588643210 /nfs/dbraw/zinc/64/32/10/588643210.db2.gz OCIRFAXYFLCASR-HTQZYQBOSA-N 1 2 249.236 2.232 20 0 BEADLO Cc1noc([C@H](C)[NH2+]CC=C(Cl)Cl)n1 ZINC000851927518 588644570 /nfs/dbraw/zinc/64/45/70/588644570.db2.gz AYOCFNFJQFEAJB-YFKPBYRVSA-N 1 2 236.102 2.348 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@](C)(F)C2)nc(C)n1 ZINC000852096587 588661861 /nfs/dbraw/zinc/66/18/61/588661861.db2.gz MKBWGCHQSKOLCC-CYBMUJFWSA-N 1 2 237.322 2.417 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@](C)(F)C2)nc(C)n1 ZINC000852096587 588661862 /nfs/dbraw/zinc/66/18/62/588661862.db2.gz MKBWGCHQSKOLCC-CYBMUJFWSA-N 1 2 237.322 2.417 20 0 BEADLO C[C@@H](O)[C@H]1CCC[N@@H+]1Cc1csc(Cl)n1 ZINC000852560191 588690282 /nfs/dbraw/zinc/69/02/82/588690282.db2.gz YUBSKSJITQIFAT-VXNVDRBHSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H](O)[C@H]1CCC[N@H+]1Cc1csc(Cl)n1 ZINC000852560191 588690283 /nfs/dbraw/zinc/69/02/83/588690283.db2.gz YUBSKSJITQIFAT-VXNVDRBHSA-N 1 2 246.763 2.142 20 0 BEADLO CCCOC(=O)[C@@H](C)[NH2+]C1(CC(C)C)CC1 ZINC000852682586 588695499 /nfs/dbraw/zinc/69/54/99/588695499.db2.gz GBXQEIPSMPPHNM-LLVKDONJSA-N 1 2 227.348 2.496 20 0 BEADLO Clc1nc(C[N@@H+]2CCC3(COC3)C2)cs1 ZINC000852683406 588695592 /nfs/dbraw/zinc/69/55/92/588695592.db2.gz JWNZWNFMYBMHIQ-UHFFFAOYSA-N 1 2 244.747 2.019 20 0 BEADLO Clc1nc(C[N@H+]2CCC3(COC3)C2)cs1 ZINC000852683406 588695593 /nfs/dbraw/zinc/69/55/93/588695593.db2.gz JWNZWNFMYBMHIQ-UHFFFAOYSA-N 1 2 244.747 2.019 20 0 BEADLO Oc1ccc2c(c1)C[N@@H+](C/C=C\Cl)CCO2 ZINC000852689893 588696244 /nfs/dbraw/zinc/69/62/44/588696244.db2.gz LPBMOEMQKVAUQL-RJRFIUFISA-N 1 2 239.702 2.339 20 0 BEADLO Oc1ccc2c(c1)C[N@H+](C/C=C\Cl)CCO2 ZINC000852689893 588696245 /nfs/dbraw/zinc/69/62/45/588696245.db2.gz LPBMOEMQKVAUQL-RJRFIUFISA-N 1 2 239.702 2.339 20 0 BEADLO C[C@@H](CC(=O)OCc1c[nH+]cn1C)c1ccco1 ZINC000860575475 589106670 /nfs/dbraw/zinc/10/66/70/589106670.db2.gz DTZRZAWDYRDLRA-JTQLQIEISA-N 1 2 248.282 2.250 20 0 BEADLO C/C=C/CNC(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC000860811225 589121665 /nfs/dbraw/zinc/12/16/65/589121665.db2.gz RONPSCPMRMBGDM-AATRIKPKSA-N 1 2 248.330 2.154 20 0 BEADLO CC[N@@H+]1CCCC[C@@H]1C(=O)OCC(C)(F)F ZINC000861222907 589152190 /nfs/dbraw/zinc/15/21/90/589152190.db2.gz GFMYYXIAOFJHHD-SECBINFHSA-N 1 2 235.274 2.059 20 0 BEADLO CC[N@H+]1CCCC[C@@H]1C(=O)OCC(C)(F)F ZINC000861222907 589152191 /nfs/dbraw/zinc/15/21/91/589152191.db2.gz GFMYYXIAOFJHHD-SECBINFHSA-N 1 2 235.274 2.059 20 0 BEADLO C[C@@H]1SCC[N@H+](Cn2cc(Cl)cn2)[C@H]1C ZINC000118382472 589169258 /nfs/dbraw/zinc/16/92/58/589169258.db2.gz WQKZQIYAPQGZGQ-IUCAKERBSA-N 1 2 245.779 2.320 20 0 BEADLO C[C@@H]1SCC[N@@H+](Cn2cc(Cl)cn2)[C@H]1C ZINC000118382472 589169260 /nfs/dbraw/zinc/16/92/60/589169260.db2.gz WQKZQIYAPQGZGQ-IUCAKERBSA-N 1 2 245.779 2.320 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000861762590 589177129 /nfs/dbraw/zinc/17/71/29/589177129.db2.gz ZCLBUYRLFRTPET-JXMROGBWSA-N 1 2 247.342 2.287 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000861762590 589177130 /nfs/dbraw/zinc/17/71/30/589177130.db2.gz ZCLBUYRLFRTPET-JXMROGBWSA-N 1 2 247.342 2.287 20 0 BEADLO O=C(N[C@@H]1CCn2cc[nH+]c21)[C@H]1CCCC12CC2 ZINC000861854154 589180730 /nfs/dbraw/zinc/18/07/30/589180730.db2.gz KRDLUUJARYJPPK-GHMZBOCLSA-N 1 2 245.326 2.024 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2c(C)noc2C)o1 ZINC000862226831 589195834 /nfs/dbraw/zinc/19/58/34/589195834.db2.gz PDSSGWUBVHRMHH-UHFFFAOYSA-N 1 2 235.287 2.220 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2c(C)noc2C)o1 ZINC000862226831 589195836 /nfs/dbraw/zinc/19/58/36/589195836.db2.gz PDSSGWUBVHRMHH-UHFFFAOYSA-N 1 2 235.287 2.220 20 0 BEADLO Cc1[nH]c(CN2CCC[C@@H]2c2ncc[nH]2)[nH+]c1C ZINC000862325309 589200548 /nfs/dbraw/zinc/20/05/48/589200548.db2.gz AGNWICYSVSOWTB-LLVKDONJSA-N 1 2 245.330 2.087 20 0 BEADLO Cc1c(C[N@@H+]2CC[C@@H](F)C2)ccnc1F ZINC000862383649 589206049 /nfs/dbraw/zinc/20/60/49/589206049.db2.gz WPJDIXAMMKFRBV-SNVBAGLBSA-N 1 2 212.243 2.073 20 0 BEADLO Cc1c(C[N@H+]2CC[C@@H](F)C2)ccnc1F ZINC000862383649 589206050 /nfs/dbraw/zinc/20/60/50/589206050.db2.gz WPJDIXAMMKFRBV-SNVBAGLBSA-N 1 2 212.243 2.073 20 0 BEADLO CC1(C)CC(CO[NH+]=C(N)[C@H]2CCCO2)C1 ZINC000863472387 589291397 /nfs/dbraw/zinc/29/13/97/589291397.db2.gz DLRRKLPKLDUEEF-SNVBAGLBSA-N 1 2 226.320 2.100 20 0 BEADLO COC1(C(N)=[NH+]OCC(C)C)CCCC1 ZINC000863478394 589292230 /nfs/dbraw/zinc/29/22/30/589292230.db2.gz NEXQCDCHBOCPKP-UHFFFAOYSA-N 1 2 214.309 2.100 20 0 BEADLO Cc1ccc(-c2ccc(N[C@@H](C)CO)[nH+]c2)cn1 ZINC000863700332 589311584 /nfs/dbraw/zinc/31/15/84/589311584.db2.gz OFZWRYFUOPGEEP-NSHDSACASA-N 1 2 243.310 2.245 20 0 BEADLO Cc1[nH+]cc(-c2cccc3c2OCCO3)n1C ZINC000863974199 589330931 /nfs/dbraw/zinc/33/09/31/589330931.db2.gz DYMSQSPIJSUOHH-UHFFFAOYSA-N 1 2 230.267 2.167 20 0 BEADLO C[C@@H]1CC(CNC(=O)Cc2c[nH]c[nH+]2)C[C@@H](C)C1 ZINC000864066942 589338167 /nfs/dbraw/zinc/33/81/67/589338167.db2.gz DFVPHLWLYQXBBE-QWRGUYRKSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@@H]1CC(CNC(=O)Cc2c[nH+]c[nH]2)C[C@@H](C)C1 ZINC000864066942 589338168 /nfs/dbraw/zinc/33/81/68/589338168.db2.gz DFVPHLWLYQXBBE-QWRGUYRKSA-N 1 2 249.358 2.141 20 0 BEADLO CC(C)Cc1cc(N[C@@H](C)C2(CO)CC2)nc[nH+]1 ZINC000864091577 589343905 /nfs/dbraw/zinc/34/39/05/589343905.db2.gz QINLGWAFRYOOKU-NSHDSACASA-N 1 2 249.358 2.248 20 0 BEADLO CC/C=C(\F)C(=O)Nc1c[nH+]ccc1OC ZINC000865069648 589407271 /nfs/dbraw/zinc/40/72/71/589407271.db2.gz KEHVWNDQSMKEJK-YWEYNIOJSA-N 1 2 224.235 2.292 20 0 BEADLO Cc1nccc(Cn2c[nH+]c(C(C)(C)C)c2)n1 ZINC000865376341 589428036 /nfs/dbraw/zinc/42/80/36/589428036.db2.gz JWQLSVZENVEUGW-UHFFFAOYSA-N 1 2 230.315 2.327 20 0 BEADLO Cc1ccnc(Cn2c[nH+]c(C(C)(C)C)c2)n1 ZINC000865376415 589428216 /nfs/dbraw/zinc/42/82/16/589428216.db2.gz MKVWUQVIHCWFDM-UHFFFAOYSA-N 1 2 230.315 2.327 20 0 BEADLO CC(C)(C)c1cn(Cc2nnc(C3CC3)o2)c[nH+]1 ZINC000865376062 589428397 /nfs/dbraw/zinc/42/83/97/589428397.db2.gz XPQFOFRUVXSRTF-UHFFFAOYSA-N 1 2 246.314 2.489 20 0 BEADLO Cc1nc(CNCc2cn(C3CC3)c[nH+]2)cs1 ZINC000865419902 589435148 /nfs/dbraw/zinc/43/51/48/589435148.db2.gz BJMWGYJCCNRUQQ-UHFFFAOYSA-N 1 2 248.355 2.273 20 0 BEADLO Cc1cc(C(F)(F)F)c[nH+]c1N[C@H](C)CO ZINC000865430393 589435435 /nfs/dbraw/zinc/43/54/35/589435435.db2.gz URCOXPIJGXWSGX-SSDOTTSWSA-N 1 2 234.221 2.202 20 0 BEADLO C[C@@H](Nc1nc(N)[nH+]c(C2CCCC2)n1)C1CC1 ZINC000865431152 589435439 /nfs/dbraw/zinc/43/54/39/589435439.db2.gz FJIAMDSIRVFDLC-MRVPVSSYSA-N 1 2 247.346 2.322 20 0 BEADLO C[C@@H](Nc1nc(N)nc(C2CCCC2)[nH+]1)C1CC1 ZINC000865431152 589435441 /nfs/dbraw/zinc/43/54/41/589435441.db2.gz FJIAMDSIRVFDLC-MRVPVSSYSA-N 1 2 247.346 2.322 20 0 BEADLO CC[C@@](C)(O)CNc1cc(CC(C)C)[nH+]cn1 ZINC000865497019 589441137 /nfs/dbraw/zinc/44/11/37/589441137.db2.gz HXKYOFMQXPDTQV-CYBMUJFWSA-N 1 2 237.347 2.248 20 0 BEADLO CC(C)n1ncnc1C[NH2+][C@H](C)c1ccc[nH]1 ZINC000865511778 589442690 /nfs/dbraw/zinc/44/26/90/589442690.db2.gz GPSVWZVCSWTBPT-SNVBAGLBSA-N 1 2 233.319 2.038 20 0 BEADLO CC(C)n1ncnc1C[NH2+][C@@H](C)c1ccc[nH]1 ZINC000865511777 589442942 /nfs/dbraw/zinc/44/29/42/589442942.db2.gz GPSVWZVCSWTBPT-JTQLQIEISA-N 1 2 233.319 2.038 20 0 BEADLO CCc1nn(C)cc1NCc1cn(C2CC2)c[nH+]1 ZINC000865519483 589443120 /nfs/dbraw/zinc/44/31/20/589443120.db2.gz OTJFCCGLHLRRGU-UHFFFAOYSA-N 1 2 245.330 2.126 20 0 BEADLO CCc1cc(CNc2ccc([C@H](C)O)c[nH+]2)[nH]n1 ZINC000865536659 589444183 /nfs/dbraw/zinc/44/41/83/589444183.db2.gz GWWDXZSSPSUCTE-VIFPVBQESA-N 1 2 246.314 2.033 20 0 BEADLO CCc1cc(CNc2ccc([C@H](C)O)c[nH+]2)n[nH]1 ZINC000865536659 589444185 /nfs/dbraw/zinc/44/41/85/589444185.db2.gz GWWDXZSSPSUCTE-VIFPVBQESA-N 1 2 246.314 2.033 20 0 BEADLO C[C@H](NCc1cn(C2CC2)c[nH+]1)C(F)(F)F ZINC000865569142 589447441 /nfs/dbraw/zinc/44/74/41/589447441.db2.gz GTHZYBWJUNHQEF-ZETCQYMHSA-N 1 2 233.237 2.258 20 0 BEADLO FC(F)CNc1[nH+]cnc2[nH]c(Cl)cc21 ZINC000865573380 589447811 /nfs/dbraw/zinc/44/78/11/589447811.db2.gz LXBPAWOYRSBOBT-UHFFFAOYSA-N 1 2 232.621 2.288 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C ZINC000865574961 589447830 /nfs/dbraw/zinc/44/78/30/589447830.db2.gz HVAYMSFKWLIERV-JTLRNRKASA-N 1 2 230.311 2.043 20 0 BEADLO CCCn1cc(C[NH2+][C@@H]2CCCC[C@H]2F)nn1 ZINC000865604395 589450255 /nfs/dbraw/zinc/45/02/55/589450255.db2.gz RZEKZSNXGMGPHC-VXGBXAGGSA-N 1 2 240.326 2.058 20 0 BEADLO CCc1cc(NCc2cn(C3CC3)c[nH+]2)nn1C ZINC000865607463 589450320 /nfs/dbraw/zinc/45/03/20/589450320.db2.gz STSDZNRWWQPAKO-UHFFFAOYSA-N 1 2 245.330 2.126 20 0 BEADLO COc1ccc(NCc2c[nH+]cn2C)c(F)c1 ZINC000865662287 589454846 /nfs/dbraw/zinc/45/48/46/589454846.db2.gz ULWYKPBNFNDBAY-UHFFFAOYSA-N 1 2 235.262 2.180 20 0 BEADLO CC(C)Cc1cc(N[C@H](C)C[C@@H](C)O)nc[nH+]1 ZINC000865669697 589455436 /nfs/dbraw/zinc/45/54/36/589455436.db2.gz JBJJGCGFBWKSPG-GHMZBOCLSA-N 1 2 237.347 2.246 20 0 BEADLO CC/C=C(/F)C(=O)NCCCCn1cc[nH+]c1 ZINC000865804773 589462245 /nfs/dbraw/zinc/46/22/45/589462245.db2.gz HLWKYANCDKCURG-VZUCSPMQSA-N 1 2 239.294 2.043 20 0 BEADLO CC(C)n1ccnc1C[NH2+][C@H](C)c1ccnn1C ZINC000865838459 589464437 /nfs/dbraw/zinc/46/44/37/589464437.db2.gz WUHNCYQLYHQEOF-LLVKDONJSA-N 1 2 247.346 2.048 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C ZINC000865859526 589465559 /nfs/dbraw/zinc/46/55/59/589465559.db2.gz BLUBSLGCSXLUAO-WKSBVSIWSA-N 1 2 244.338 2.297 20 0 BEADLO CCN(CCSC)c1ccc([C@H](C)O)c[nH+]1 ZINC000865902815 589468065 /nfs/dbraw/zinc/46/80/65/589468065.db2.gz HYKKHIHHRYXPBF-JTQLQIEISA-N 1 2 240.372 2.324 20 0 BEADLO CO[C@@H]1CC[C@@H](C)N(c2cc[nH+]c(C3CC3)n2)C1 ZINC000866069667 589474589 /nfs/dbraw/zinc/47/45/89/589474589.db2.gz FRJWSABXKHZELM-ZYHUDNBSSA-N 1 2 247.342 2.358 20 0 BEADLO CCc1cc(N[C@H]2C[C@H](SC)C2)nc[nH+]1 ZINC000866101783 589476096 /nfs/dbraw/zinc/47/60/96/589476096.db2.gz AWLDVJKXVPDMGK-MGCOHNPYSA-N 1 2 223.345 2.345 20 0 BEADLO CS[C@H]1C[C@H](Nc2cc[nH+]c(C)n2)C1 ZINC000866101183 589476200 /nfs/dbraw/zinc/47/62/00/589476200.db2.gz GZDZGHSJQKNWTH-KYZUINATSA-N 1 2 209.318 2.091 20 0 BEADLO Cc1cc(NC[C@H]2CCC23CCOCC3)nc[nH+]1 ZINC000866172935 589478761 /nfs/dbraw/zinc/47/87/61/589478761.db2.gz FBPOXOFXDJBZCR-GFCCVEGCSA-N 1 2 247.342 2.404 20 0 BEADLO Cc1nc(N[C@@H]2C[C@H]2C2CCOCC2)cc[nH+]1 ZINC000866274063 589483778 /nfs/dbraw/zinc/48/37/78/589483778.db2.gz WDHOMKCYSGRFJK-NWDGAFQWSA-N 1 2 233.315 2.012 20 0 BEADLO Cc1cc(NCC[C@@H](O)C2CCCC2)nc[nH+]1 ZINC000866303905 589485277 /nfs/dbraw/zinc/48/52/77/589485277.db2.gz QSEMCRSOKNCVCT-GFCCVEGCSA-N 1 2 235.331 2.138 20 0 BEADLO FCC[NH2+][C@@H]1c2ccccc2OC[C@@H]1F ZINC000866351588 589487801 /nfs/dbraw/zinc/48/78/01/589487801.db2.gz BYFHCPUALCYNKB-GXSJLCMTSA-N 1 2 213.227 2.017 20 0 BEADLO CCn1ccnc1[C@H](C)[NH2+][C@@H](C)c1ccnn1C ZINC000866613995 589504988 /nfs/dbraw/zinc/50/49/88/589504988.db2.gz KRCOZYAREUSMNQ-QWRGUYRKSA-N 1 2 247.346 2.048 20 0 BEADLO C[C@H](CCO)[NH2+]c1ccc(N(C)C)c(F)c1 ZINC000866624874 589505841 /nfs/dbraw/zinc/50/58/41/589505841.db2.gz FARLDXZUDKJCKB-SECBINFHSA-N 1 2 226.295 2.075 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1C[C@H]1C(C)(C)C)c1[nH]cc[nH+]1 ZINC000868506035 589561411 /nfs/dbraw/zinc/56/14/11/589561411.db2.gz HFBUIGOUABQVMY-OPRDCNLKSA-N 1 2 235.331 2.269 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)CC(C)C)c1 ZINC000122257816 589573318 /nfs/dbraw/zinc/57/33/18/589573318.db2.gz QOXYDFJJJXWIBJ-UHFFFAOYSA-N 1 2 237.299 2.488 20 0 BEADLO C[C@@H]1C[C@@H]1[C@H]1C[C@H]1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000868731666 589574984 /nfs/dbraw/zinc/57/49/84/589574984.db2.gz KHOVILGMSMVXBQ-LMLFDSFASA-N 1 2 247.342 2.053 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)[C@H]2C[C@@H]2C)c1 ZINC000122285588 589576742 /nfs/dbraw/zinc/57/67/42/589576742.db2.gz LVCSUHXHBJQPRM-UFBFGSQYSA-N 1 2 235.283 2.098 20 0 BEADLO Cc1ccc(C(=O)Nc2cc[nH+]cc2C)nc1 ZINC000122337816 589581933 /nfs/dbraw/zinc/58/19/33/589581933.db2.gz ZIVOUFGVVDCVLR-UHFFFAOYSA-N 1 2 227.267 2.346 20 0 BEADLO C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C(=O)OCCCn1cc[nH+]c1 ZINC000869886301 589635299 /nfs/dbraw/zinc/63/52/99/589635299.db2.gz DVDXZPATXZOKAS-XQHKEYJVSA-N 1 2 248.326 2.109 20 0 BEADLO COCCSCc1[nH+]ccn1CC(F)F ZINC000871655033 589783313 /nfs/dbraw/zinc/78/33/13/589783313.db2.gz JVTXZPAILLHGTB-UHFFFAOYSA-N 1 2 236.287 2.028 20 0 BEADLO CC(C)(C)OCC(N)=[NH+]OC1CC(C)(C)C1 ZINC000871742628 589802966 /nfs/dbraw/zinc/80/29/66/589802966.db2.gz SMYAWURRRVJYTJ-UHFFFAOYSA-N 1 2 228.336 2.489 20 0 BEADLO C[C@H](CO[NH+]=C(N)[C@H]1CCCO1)C(C)(C)C ZINC000871748647 589804187 /nfs/dbraw/zinc/80/41/87/589804187.db2.gz MJXATRXVUCNAPO-NXEZZACHSA-N 1 2 228.336 2.346 20 0 BEADLO C[C@@H]([NH2+]Cc1ccon1)c1cc(O)ccc1F ZINC000872040500 589859473 /nfs/dbraw/zinc/85/94/73/589859473.db2.gz LZJAHWAKERCMDP-MRVPVSSYSA-N 1 2 236.246 2.370 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2nonc2C)oc1C ZINC000872137330 589878742 /nfs/dbraw/zinc/87/87/42/589878742.db2.gz SAXJDWDLZJIFKB-VIFPVBQESA-N 1 2 235.287 2.439 20 0 BEADLO Cc1nonc1C[NH2+][C@H](C)c1ccc(C)nc1C ZINC000872137125 589878918 /nfs/dbraw/zinc/87/89/18/589878918.db2.gz QTZXFJNFQBLPBW-SECBINFHSA-N 1 2 246.314 2.241 20 0 BEADLO CCn1ncc(N[C@@H]2CCCn3cc[nH+]c32)c1C ZINC000872139309 589880569 /nfs/dbraw/zinc/88/05/69/589880569.db2.gz JFDQDMSIJXALOO-LLVKDONJSA-N 1 2 245.330 2.355 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1C[C@H]2CCC[C@@H]2O1 ZINC000872695657 589962453 /nfs/dbraw/zinc/96/24/53/589962453.db2.gz IQYNWSHDWMUVAU-WOPDTQHZSA-N 1 2 248.326 2.460 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1C[C@H]2CCC[C@H]2O1 ZINC000872695652 589962569 /nfs/dbraw/zinc/96/25/69/589962569.db2.gz IQYNWSHDWMUVAU-GRYCIOLGSA-N 1 2 248.326 2.460 20 0 BEADLO CCc1cc(NC[C@@H]2C[C@@H]3CCC[C@H]3O2)nc[nH+]1 ZINC000872696309 589962616 /nfs/dbraw/zinc/96/26/16/589962616.db2.gz PXCKMARFVHLHIF-WCFLWFBJSA-N 1 2 247.342 2.409 20 0 BEADLO Cc1nc(NC[C@@H]2C[C@H]3CCC[C@H]3O2)cc[nH+]1 ZINC000872699770 589962849 /nfs/dbraw/zinc/96/28/49/589962849.db2.gz UAKZJNHUJQWKQJ-GRYCIOLGSA-N 1 2 233.315 2.155 20 0 BEADLO c1nc(N[C@@H]2CC23CCC3)cc(NC2CC2)[nH+]1 ZINC000872775126 589968464 /nfs/dbraw/zinc/96/84/64/589968464.db2.gz QHODFLUZVRVJLT-SNVBAGLBSA-N 1 2 230.315 2.405 20 0 BEADLO c1nc(NC2CC2)cc(N[C@@H]2CC23CCC3)[nH+]1 ZINC000872775126 589968466 /nfs/dbraw/zinc/96/84/66/589968466.db2.gz QHODFLUZVRVJLT-SNVBAGLBSA-N 1 2 230.315 2.405 20 0 BEADLO C[C@H](O)c1ccc(C[NH2+]Cc2ccon2)cc1 ZINC000873023057 589980195 /nfs/dbraw/zinc/98/01/95/589980195.db2.gz ZPDHLRJKGGYWTB-JTQLQIEISA-N 1 2 232.283 2.018 20 0 BEADLO COc1ccc([NH2+][C@@H]2CCNC(=O)CC2)c(C)c1 ZINC000873082523 589983685 /nfs/dbraw/zinc/98/36/85/589983685.db2.gz FCWCLSFQXXXCEV-NSHDSACASA-N 1 2 248.326 2.084 20 0 BEADLO Cc1cc(Cl)nc(C[NH2+]Cc2ccon2)c1 ZINC000873123176 589985398 /nfs/dbraw/zinc/98/53/98/589985398.db2.gz ZZYIGAQNZXEZKN-UHFFFAOYSA-N 1 2 237.690 2.321 20 0 BEADLO CCn1ncc(NCc2cn(C3CC3)c[nH+]2)c1C ZINC000873196991 589992265 /nfs/dbraw/zinc/99/22/65/589992265.db2.gz VMUHCUXOCHCTBR-UHFFFAOYSA-N 1 2 245.330 2.355 20 0 BEADLO CC[C@H]([NH2+][C@@H]1CCOC1=O)c1ccc(C)cc1 ZINC000019876561 590025566 /nfs/dbraw/zinc/02/55/66/590025566.db2.gz PHFLDFAJBWASOR-QWHCGFSZSA-N 1 2 233.311 2.351 20 0 BEADLO CCC[C@@H](CC)C(=O)OCc1c[nH+]cn1C ZINC000873508731 590052023 /nfs/dbraw/zinc/05/20/23/590052023.db2.gz RUQAYSFTAIUWJB-SNVBAGLBSA-N 1 2 224.304 2.290 20 0 BEADLO CCC[C@H](CC)C(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000874049590 590087963 /nfs/dbraw/zinc/08/79/63/590087963.db2.gz IRJXQQYFAQTVEE-RYUDHWBXSA-N 1 2 237.347 2.214 20 0 BEADLO CCOC(C)(C)C(=O)Nc1cccc2[nH+]ccn21 ZINC000875366161 590163141 /nfs/dbraw/zinc/16/31/41/590163141.db2.gz FSDNMWWYICIPQA-UHFFFAOYSA-N 1 2 247.298 2.088 20 0 BEADLO O=C(CCn1cc[nH+]c1)N[C@H]1CCCC2(CC2)C1 ZINC000888702061 590188412 /nfs/dbraw/zinc/18/84/12/590188412.db2.gz IAFYYGSHBQEIDE-LBPRGKRZSA-N 1 2 247.342 2.112 20 0 BEADLO CCCn1cc(C[N@H+](C)Cc2ccccc2)nn1 ZINC000876510140 590205735 /nfs/dbraw/zinc/20/57/35/590205735.db2.gz QLHOPXYNULMNNO-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CCCn1cc(C[N@@H+](C)Cc2ccccc2)nn1 ZINC000876510140 590205737 /nfs/dbraw/zinc/20/57/37/590205737.db2.gz QLHOPXYNULMNNO-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO C[N@H+](Cc1nc(Cl)cs1)[C@@H]1CCOC1 ZINC000876690850 590231189 /nfs/dbraw/zinc/23/11/89/590231189.db2.gz STLNHAQNJKHSSK-SSDOTTSWSA-N 1 2 232.736 2.017 20 0 BEADLO C[N@@H+](Cc1nc(Cl)cs1)[C@@H]1CCOC1 ZINC000876690850 590231191 /nfs/dbraw/zinc/23/11/91/590231191.db2.gz STLNHAQNJKHSSK-SSDOTTSWSA-N 1 2 232.736 2.017 20 0 BEADLO CC1=CC[N@H+](Cc2ccc(Cl)nn2)CC1 ZINC000876748767 590237502 /nfs/dbraw/zinc/23/75/02/590237502.db2.gz DZOIJDOTVBTXBC-UHFFFAOYSA-N 1 2 223.707 2.282 20 0 BEADLO CC1=CC[N@@H+](Cc2ccc(Cl)nn2)CC1 ZINC000876748767 590237504 /nfs/dbraw/zinc/23/75/04/590237504.db2.gz DZOIJDOTVBTXBC-UHFFFAOYSA-N 1 2 223.707 2.282 20 0 BEADLO CC(C)COC(=O)[C@H](C)[NH2+][C@H]1CS[C@@H](C)C1 ZINC000877469724 590331443 /nfs/dbraw/zinc/33/14/43/590331443.db2.gz SNWNQDVCOOKBMF-GARJFASQSA-N 1 2 245.388 2.058 20 0 BEADLO CC(C)COC(=O)[C@H](C)[NH2+][C@H]1CS[C@H](C)C1 ZINC000877469725 590332550 /nfs/dbraw/zinc/33/25/50/590332550.db2.gz SNWNQDVCOOKBMF-OUAUKWLOSA-N 1 2 245.388 2.058 20 0 BEADLO C[N@H+](CCCCO)Cc1nc(Cl)cs1 ZINC000877471308 590334566 /nfs/dbraw/zinc/33/45/66/590334566.db2.gz RHGVEABXALYNRT-UHFFFAOYSA-N 1 2 234.752 2.001 20 0 BEADLO C[N@@H+](CCCCO)Cc1nc(Cl)cs1 ZINC000877471308 590334568 /nfs/dbraw/zinc/33/45/68/590334568.db2.gz RHGVEABXALYNRT-UHFFFAOYSA-N 1 2 234.752 2.001 20 0 BEADLO CO[C@H]1C[C@@H]([N@H+](C)Cc2nc(Cl)cs2)C1 ZINC000877516137 590345300 /nfs/dbraw/zinc/34/53/00/590345300.db2.gz XFHZDDWBRWWVGX-OCAPTIKFSA-N 1 2 246.763 2.406 20 0 BEADLO CO[C@H]1C[C@@H]([N@@H+](C)Cc2nc(Cl)cs2)C1 ZINC000877516137 590345303 /nfs/dbraw/zinc/34/53/03/590345303.db2.gz XFHZDDWBRWWVGX-OCAPTIKFSA-N 1 2 246.763 2.406 20 0 BEADLO CC(F)(F)C[NH2+]C[C@H]1CC1(Cl)Cl ZINC000877551493 590355406 /nfs/dbraw/zinc/35/54/06/590355406.db2.gz BWJNMJULCDOKPA-RXMQYKEDSA-N 1 2 218.074 2.425 20 0 BEADLO O[C@H]1CCC[N@H+](Cc2nc(Cl)cs2)CC1 ZINC000877554157 590356838 /nfs/dbraw/zinc/35/68/38/590356838.db2.gz FHTHZDBJHSQXFC-QMMMGPOBSA-N 1 2 246.763 2.143 20 0 BEADLO O[C@H]1CCC[N@@H+](Cc2nc(Cl)cs2)CC1 ZINC000877554157 590356842 /nfs/dbraw/zinc/35/68/42/590356842.db2.gz FHTHZDBJHSQXFC-QMMMGPOBSA-N 1 2 246.763 2.143 20 0 BEADLO CN(C)c1ccc(F)cc1C[N@@H+]1CC[C@H](F)C1 ZINC000877559093 590358876 /nfs/dbraw/zinc/35/88/76/590358876.db2.gz IYRDXNLVSZPQML-LBPRGKRZSA-N 1 2 240.297 2.436 20 0 BEADLO CN(C)c1ccc(F)cc1C[N@H+]1CC[C@H](F)C1 ZINC000877559093 590358878 /nfs/dbraw/zinc/35/88/78/590358878.db2.gz IYRDXNLVSZPQML-LBPRGKRZSA-N 1 2 240.297 2.436 20 0 BEADLO CN(C)c1ccc(F)cc1C[N@@H+]1CC[C@@H](F)C1 ZINC000877559092 590359148 /nfs/dbraw/zinc/35/91/48/590359148.db2.gz IYRDXNLVSZPQML-GFCCVEGCSA-N 1 2 240.297 2.436 20 0 BEADLO CN(C)c1ccc(F)cc1C[N@H+]1CC[C@@H](F)C1 ZINC000877559092 590359152 /nfs/dbraw/zinc/35/91/52/590359152.db2.gz IYRDXNLVSZPQML-GFCCVEGCSA-N 1 2 240.297 2.436 20 0 BEADLO FC(F)OC1C[NH+](C[C@H]2CC2(Cl)Cl)C1 ZINC000877581789 590365326 /nfs/dbraw/zinc/36/53/26/590365326.db2.gz SPSVEQYOFGAGEW-RXMQYKEDSA-N 1 2 246.084 2.104 20 0 BEADLO CCCn1cc(C[NH+]2CC(C3CCCC3)C2)nn1 ZINC000877581757 590366030 /nfs/dbraw/zinc/36/60/30/590366030.db2.gz QVRMWSPYYHQEJT-UHFFFAOYSA-N 1 2 248.374 2.310 20 0 BEADLO C[C@H](C[C@H]1CCOC1)Nc1c[nH+]cc(N(C)C)c1 ZINC000877668869 590389355 /nfs/dbraw/zinc/38/93/55/590389355.db2.gz VKXMCWLRPINXSV-VXGBXAGGSA-N 1 2 249.358 2.375 20 0 BEADLO C[C@@H]1CC[C@H]1Nc1c[nH+]cc(N(C)C)c1 ZINC000877667154 590389562 /nfs/dbraw/zinc/38/95/62/590389562.db2.gz DSUOFFOJQBALMH-BXKDBHETSA-N 1 2 205.305 2.358 20 0 BEADLO Cc1cnc(C[NH2+][C@@H]2CCCC[C@@H]2F)o1 ZINC000877682848 590391194 /nfs/dbraw/zinc/39/11/94/590391194.db2.gz UYJUSZDZZQNLKC-VHSXEESVSA-N 1 2 212.268 2.353 20 0 BEADLO CC1([NH2+]Cc2ccnc(Cl)c2Cl)COC1 ZINC000877691790 590392636 /nfs/dbraw/zinc/39/26/36/590392636.db2.gz WTWLZZHYWQOFPY-UHFFFAOYSA-N 1 2 247.125 2.267 20 0 BEADLO CCCn1cc(C[NH+]2CCC(C)(F)CC2)nn1 ZINC000877700112 590393554 /nfs/dbraw/zinc/39/35/54/590393554.db2.gz DTBQQMPVBUTCLA-UHFFFAOYSA-N 1 2 240.326 2.012 20 0 BEADLO CCc1nn(C)c(Cl)c1C[NH+]1CC(C)(C)C1 ZINC000877718028 590399549 /nfs/dbraw/zinc/39/95/49/590399549.db2.gz VQSKMMCZEWBRLC-UHFFFAOYSA-N 1 2 241.766 2.478 20 0 BEADLO CC1(C)C[NH+](Cc2cn(-c3ccccc3)nn2)C1 ZINC000877717678 590399568 /nfs/dbraw/zinc/39/95/68/590399568.db2.gz PBJNLEXAQWMKFL-UHFFFAOYSA-N 1 2 242.326 2.109 20 0 BEADLO CC(C)(C)OC1C[NH+](Cc2ccncc2)C1 ZINC000877772152 590422049 /nfs/dbraw/zinc/42/20/49/590422049.db2.gz QIKQDKYCWBBYJD-UHFFFAOYSA-N 1 2 220.316 2.081 20 0 BEADLO COC[C@@H](COc1cc[nH+]cc1)C(C)C ZINC000877880994 590437048 /nfs/dbraw/zinc/43/70/48/590437048.db2.gz BOZNVZOMORCXRK-NSHDSACASA-N 1 2 209.289 2.379 20 0 BEADLO CC[C@H]1CCC[C@]1(C)C(=O)NC1=[NH+]CCS1 ZINC000877963033 590459390 /nfs/dbraw/zinc/45/93/90/590459390.db2.gz FCUYUDCXGNALMQ-CABZTGNLSA-N 1 2 240.372 2.422 20 0 BEADLO Cc1conc1C[N@@H+](C)[C@H](CO)c1ccccc1 ZINC000878049305 590481838 /nfs/dbraw/zinc/48/18/38/590481838.db2.gz VZQLVRNCJNOYCQ-CQSZACIVSA-N 1 2 246.310 2.148 20 0 BEADLO Cc1conc1C[N@H+](C)[C@H](CO)c1ccccc1 ZINC000878049305 590481841 /nfs/dbraw/zinc/48/18/41/590481841.db2.gz VZQLVRNCJNOYCQ-CQSZACIVSA-N 1 2 246.310 2.148 20 0 BEADLO CCC[C@@H](CC)C(=O)NCCNc1cccc[nH+]1 ZINC000878081686 590488595 /nfs/dbraw/zinc/48/85/95/590488595.db2.gz PBIBYFNTMWHCPN-GFCCVEGCSA-N 1 2 249.358 2.436 20 0 BEADLO C[N@H+](Cc1scnc1Cl)[C@H]1CCOC1 ZINC000878084650 590490219 /nfs/dbraw/zinc/49/02/19/590490219.db2.gz WZWATZYLSANNSU-ZETCQYMHSA-N 1 2 232.736 2.017 20 0 BEADLO C[N@@H+](Cc1scnc1Cl)[C@H]1CCOC1 ZINC000878084650 590490221 /nfs/dbraw/zinc/49/02/21/590490221.db2.gz WZWATZYLSANNSU-ZETCQYMHSA-N 1 2 232.736 2.017 20 0 BEADLO C[N@@H+](Cc1ccon1)C[C@H]1CCC(C)(C)CO1 ZINC000878124585 590500198 /nfs/dbraw/zinc/50/01/98/590500198.db2.gz IPSPTCDMCHXJDQ-GFCCVEGCSA-N 1 2 238.331 2.312 20 0 BEADLO C[N@H+](Cc1ccon1)C[C@H]1CCC(C)(C)CO1 ZINC000878124585 590500200 /nfs/dbraw/zinc/50/02/00/590500200.db2.gz IPSPTCDMCHXJDQ-GFCCVEGCSA-N 1 2 238.331 2.312 20 0 BEADLO C[N@@H+](Cc1ccon1)C[C@@H]1C[C@@H]2CCC[C@H]2O1 ZINC000878126309 590501444 /nfs/dbraw/zinc/50/14/44/590501444.db2.gz WZKLKXZIDNLKEI-WCFLWFBJSA-N 1 2 236.315 2.064 20 0 BEADLO C[N@H+](Cc1ccon1)C[C@@H]1C[C@@H]2CCC[C@H]2O1 ZINC000878126309 590501445 /nfs/dbraw/zinc/50/14/45/590501445.db2.gz WZKLKXZIDNLKEI-WCFLWFBJSA-N 1 2 236.315 2.064 20 0 BEADLO CC1(C)CCC[C@H](C[N@@H+]2CCc3c[nH]nc3C2)O1 ZINC000878290582 590535211 /nfs/dbraw/zinc/53/52/11/590535211.db2.gz BAHXZTULKFDHLP-GFCCVEGCSA-N 1 2 249.358 2.116 20 0 BEADLO CC1(C)CCC[C@H](C[N@H+]2CCc3c[nH]nc3C2)O1 ZINC000878290582 590535212 /nfs/dbraw/zinc/53/52/12/590535212.db2.gz BAHXZTULKFDHLP-GFCCVEGCSA-N 1 2 249.358 2.116 20 0 BEADLO CC1(C)CCC[C@H](C[N@@H+]2CCc3cn[nH]c3C2)O1 ZINC000878290582 590535213 /nfs/dbraw/zinc/53/52/13/590535213.db2.gz BAHXZTULKFDHLP-GFCCVEGCSA-N 1 2 249.358 2.116 20 0 BEADLO CC1(C)CCC[C@H](C[N@H+]2CCc3cn[nH]c3C2)O1 ZINC000878290582 590535214 /nfs/dbraw/zinc/53/52/14/590535214.db2.gz BAHXZTULKFDHLP-GFCCVEGCSA-N 1 2 249.358 2.116 20 0 BEADLO CC1=CC[N@H+](Cc2nccn2CC(F)F)CC1 ZINC000878301034 590537224 /nfs/dbraw/zinc/53/72/24/590537224.db2.gz QSOYOARHYVCNCO-UHFFFAOYSA-N 1 2 241.285 2.300 20 0 BEADLO CC1=CC[N@@H+](Cc2nccn2CC(F)F)CC1 ZINC000878301034 590537226 /nfs/dbraw/zinc/53/72/26/590537226.db2.gz QSOYOARHYVCNCO-UHFFFAOYSA-N 1 2 241.285 2.300 20 0 BEADLO CC1=CCN(Cc2[nH+]ccn2CC(F)F)CC1 ZINC000878301034 590537229 /nfs/dbraw/zinc/53/72/29/590537229.db2.gz QSOYOARHYVCNCO-UHFFFAOYSA-N 1 2 241.285 2.300 20 0 BEADLO C[C@@H]1COCC[N@H+](Cc2scnc2Cl)C1 ZINC000878298605 590537255 /nfs/dbraw/zinc/53/72/55/590537255.db2.gz JXDRGQOQTMURBB-QMMMGPOBSA-N 1 2 246.763 2.265 20 0 BEADLO C[C@@H]1COCC[N@@H+](Cc2scnc2Cl)C1 ZINC000878298605 590537258 /nfs/dbraw/zinc/53/72/58/590537258.db2.gz JXDRGQOQTMURBB-QMMMGPOBSA-N 1 2 246.763 2.265 20 0 BEADLO CC(C)[C@@H](O)CC[N@@H+]1CCC[C@H]1C(F)F ZINC000878321698 590545521 /nfs/dbraw/zinc/54/55/21/590545521.db2.gz SZQVWBDZOCCIDH-UWVGGRQHSA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)[C@@H](O)CC[N@H+]1CCC[C@H]1C(F)F ZINC000878321698 590545524 /nfs/dbraw/zinc/54/55/24/590545524.db2.gz SZQVWBDZOCCIDH-UWVGGRQHSA-N 1 2 221.291 2.123 20 0 BEADLO O[C@@H]1C[N@H+](CC2CC3(CCC3)C2)CC(F)(F)C1 ZINC000878493686 590579354 /nfs/dbraw/zinc/57/93/54/590579354.db2.gz TYMBAFSEZKXZCI-NSHDSACASA-N 1 2 245.313 2.269 20 0 BEADLO O[C@@H]1C[N@@H+](CC2CC3(CCC3)C2)CC(F)(F)C1 ZINC000878493686 590579357 /nfs/dbraw/zinc/57/93/57/590579357.db2.gz TYMBAFSEZKXZCI-NSHDSACASA-N 1 2 245.313 2.269 20 0 BEADLO OCC[N@H+](CC(F)F)CC1CC2(CCC2)C1 ZINC000878537564 590588611 /nfs/dbraw/zinc/58/86/11/590588611.db2.gz PIDUSQDGGSDSMN-UHFFFAOYSA-N 1 2 233.302 2.126 20 0 BEADLO OCC[N@@H+](CC(F)F)CC1CC2(CCC2)C1 ZINC000878537564 590588612 /nfs/dbraw/zinc/58/86/12/590588612.db2.gz PIDUSQDGGSDSMN-UHFFFAOYSA-N 1 2 233.302 2.126 20 0 BEADLO C=C/C=C/CC[N@H+](CC(F)F)C[C@@H](C)O ZINC000878685125 590609210 /nfs/dbraw/zinc/60/92/10/590609210.db2.gz QVOCSAJEZPMCCA-ORAHPGNNSA-N 1 2 219.275 2.067 20 0 BEADLO C=C/C=C/CC[N@@H+](CC(F)F)C[C@@H](C)O ZINC000878685125 590609211 /nfs/dbraw/zinc/60/92/11/590609211.db2.gz QVOCSAJEZPMCCA-ORAHPGNNSA-N 1 2 219.275 2.067 20 0 BEADLO CCN(CC)C(=O)[C@H](C)[N@@H+]1CCC=C(Cl)C1 ZINC000878793231 590621848 /nfs/dbraw/zinc/62/18/48/590621848.db2.gz JIUUBMNJHFRTAG-JTQLQIEISA-N 1 2 244.766 2.072 20 0 BEADLO CCN(CC)C(=O)[C@H](C)[N@H+]1CCC=C(Cl)C1 ZINC000878793231 590621849 /nfs/dbraw/zinc/62/18/49/590621849.db2.gz JIUUBMNJHFRTAG-JTQLQIEISA-N 1 2 244.766 2.072 20 0 BEADLO CC[C@H]1CCC[C@]1(C)C(=O)NCc1[nH]cc[nH+]1 ZINC000878816931 590626843 /nfs/dbraw/zinc/62/68/43/590626843.db2.gz XYBYDEKMAWAMDD-GWCFXTLKSA-N 1 2 235.331 2.242 20 0 BEADLO CO[C@H]1C[N@H+](Cc2ccc(C3CC3)cc2)CCO1 ZINC000878968784 590663545 /nfs/dbraw/zinc/66/35/45/590663545.db2.gz AYKYPBKIHJKOIL-OAHLLOKOSA-N 1 2 247.338 2.369 20 0 BEADLO CO[C@H]1C[N@@H+](Cc2ccc(C3CC3)cc2)CCO1 ZINC000878968784 590663547 /nfs/dbraw/zinc/66/35/47/590663547.db2.gz AYKYPBKIHJKOIL-OAHLLOKOSA-N 1 2 247.338 2.369 20 0 BEADLO C=C/C=C\CCNC(=O)Nc1cc(C)[nH+]cc1C ZINC000879074936 590693227 /nfs/dbraw/zinc/69/32/27/590693227.db2.gz CGEDAWBFJYEKPB-WAYWQWQTSA-N 1 2 245.326 2.374 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)CCCCCCCO ZINC000879185852 590709755 /nfs/dbraw/zinc/70/97/55/590709755.db2.gz AYUYLANRUQKHAL-UHFFFAOYSA-N 1 2 239.363 2.093 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)CCCC1CC1 ZINC000879187762 590710138 /nfs/dbraw/zinc/71/01/38/590710138.db2.gz BTUJAANOQKGTGP-UHFFFAOYSA-N 1 2 207.321 2.340 20 0 BEADLO Cc1ncc([C@@H](C)[NH2+]Cc2cnsn2)s1 ZINC000879252548 590721612 /nfs/dbraw/zinc/72/16/12/590721612.db2.gz TWVFWXUJTSWSCY-ZCFIWIBFSA-N 1 2 240.357 2.154 20 0 BEADLO CCCCOC(=O)C[NH+]1CCC(C)(F)CC1 ZINC000879381070 590758483 /nfs/dbraw/zinc/75/84/83/590758483.db2.gz MLOATZMIDAWAAT-UHFFFAOYSA-N 1 2 231.311 2.154 20 0 BEADLO CCC(F)(F)C[N@H+]1C[C@H](O)CC(C)(C)C1 ZINC000879624108 590838397 /nfs/dbraw/zinc/83/83/97/590838397.db2.gz MJQPJMIBBURKRT-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO CC1(C)C[C@@H](O)C[N@H+](C/C(Cl)=C\Cl)C1 ZINC000879622865 590836159 /nfs/dbraw/zinc/83/61/59/590836159.db2.gz SRLRXOSRKACSMZ-VGANXODHSA-N 1 2 238.158 2.398 20 0 BEADLO CC1(C)C[C@@H](O)C[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000879622865 590836162 /nfs/dbraw/zinc/83/61/62/590836162.db2.gz SRLRXOSRKACSMZ-VGANXODHSA-N 1 2 238.158 2.398 20 0 BEADLO CCC(F)(F)C[N@@H+]1C[C@H](O)CC(C)(C)C1 ZINC000879624108 590838395 /nfs/dbraw/zinc/83/83/95/590838395.db2.gz MJQPJMIBBURKRT-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO C[C@@H]([NH2+]Cc1ncc(C2CC2)o1)c1ccnn1C ZINC000879684925 590847068 /nfs/dbraw/zinc/84/70/68/590847068.db2.gz BWCYHSAXUQVTIG-SECBINFHSA-N 1 2 246.314 2.136 20 0 BEADLO CCON(CC)Cc1cn2c(cccc2C)[nH+]1 ZINC000879794472 590872848 /nfs/dbraw/zinc/87/28/48/590872848.db2.gz CTTRYGHJXNQRAN-UHFFFAOYSA-N 1 2 233.315 2.416 20 0 BEADLO CCOC(=O)[C@H](CC1CC1)[NH2+]CC1=CCCC1 ZINC000879981317 590904152 /nfs/dbraw/zinc/90/41/52/590904152.db2.gz PGPXYYQVCYEBAC-ZDUSSCGKSA-N 1 2 237.343 2.418 20 0 BEADLO Cc1noc(C[N@@H+]2CC[C@](C)(C(F)(F)F)C2)n1 ZINC000879999615 590904171 /nfs/dbraw/zinc/90/41/71/590904171.db2.gz GDZAESGFHUUEBI-VIFPVBQESA-N 1 2 249.236 2.152 20 0 BEADLO Cc1noc(C[N@H+]2CC[C@](C)(C(F)(F)F)C2)n1 ZINC000879999615 590904172 /nfs/dbraw/zinc/90/41/72/590904172.db2.gz GDZAESGFHUUEBI-VIFPVBQESA-N 1 2 249.236 2.152 20 0 BEADLO CC[C@H]1CCC[C@]1(C)C(=O)NCc1c[nH+]cn1C ZINC000880026139 590912091 /nfs/dbraw/zinc/91/20/91/590912091.db2.gz FSPRWURQGKLOKR-FZMZJTMJSA-N 1 2 249.358 2.253 20 0 BEADLO FC[C@H]1CCC[N@H+](Cc2nccn2C(F)F)C1 ZINC000880234621 590964252 /nfs/dbraw/zinc/96/42/52/590964252.db2.gz JXLNEDPVQHMVLL-SECBINFHSA-N 1 2 247.264 2.460 20 0 BEADLO FC[C@H]1CCC[N@@H+](Cc2nccn2C(F)F)C1 ZINC000880234621 590964256 /nfs/dbraw/zinc/96/42/56/590964256.db2.gz JXLNEDPVQHMVLL-SECBINFHSA-N 1 2 247.264 2.460 20 0 BEADLO FC[C@H]1CCC[N@H+](Cc2noc(C3CC3)n2)C1 ZINC000880233005 590965022 /nfs/dbraw/zinc/96/50/22/590965022.db2.gz SSFNSOQSBJVTHA-SECBINFHSA-N 1 2 239.294 2.129 20 0 BEADLO FC[C@H]1CCC[N@@H+](Cc2noc(C3CC3)n2)C1 ZINC000880233005 590965024 /nfs/dbraw/zinc/96/50/24/590965024.db2.gz SSFNSOQSBJVTHA-SECBINFHSA-N 1 2 239.294 2.129 20 0 BEADLO Cn1c(Cl)cnc1C[N@@H+]1CCC[C@@H](CF)C1 ZINC000880233769 590965539 /nfs/dbraw/zinc/96/55/39/590965539.db2.gz FUQHAXDVAKQTPV-VIFPVBQESA-N 1 2 245.729 2.255 20 0 BEADLO Cn1c(Cl)cnc1C[N@H+]1CCC[C@@H](CF)C1 ZINC000880233769 590965543 /nfs/dbraw/zinc/96/55/43/590965543.db2.gz FUQHAXDVAKQTPV-VIFPVBQESA-N 1 2 245.729 2.255 20 0 BEADLO C[C@@H](c1csnn1)[NH+]1CCC(F)CC1 ZINC000880240016 590973872 /nfs/dbraw/zinc/97/38/72/590973872.db2.gz WMZJSAAAYMGHBR-ZETCQYMHSA-N 1 2 215.297 2.033 20 0 BEADLO CC(C)(C)c1nnc(C[NH+]2CCC(F)CC2)o1 ZINC000880243825 590976620 /nfs/dbraw/zinc/97/66/20/590976620.db2.gz VWYOVTNJLSMWAC-UHFFFAOYSA-N 1 2 241.310 2.301 20 0 BEADLO C[C@H](c1nc(C2CC2)no1)[NH+]1CCC(F)CC1 ZINC000880243288 590977095 /nfs/dbraw/zinc/97/70/95/590977095.db2.gz WHSMNRRCJPIPAV-MRVPVSSYSA-N 1 2 239.294 2.442 20 0 BEADLO CC(C)(C)c1nc(C[N@@H+]2CC[C@@H](CF)C2)no1 ZINC000880294836 590989248 /nfs/dbraw/zinc/98/92/48/590989248.db2.gz FDTWTLCLKZFJGL-VIFPVBQESA-N 1 2 241.310 2.159 20 0 BEADLO CC(C)(C)c1nc(C[N@H+]2CC[C@@H](CF)C2)no1 ZINC000880294836 590989250 /nfs/dbraw/zinc/98/92/50/590989250.db2.gz FDTWTLCLKZFJGL-VIFPVBQESA-N 1 2 241.310 2.159 20 0 BEADLO Cc1nnc(C[N@@H+]2CCc3ccsc3[C@H]2C)[nH]1 ZINC000880377492 591015374 /nfs/dbraw/zinc/01/53/74/591015374.db2.gz XLSIEXALCCRBGO-MRVPVSSYSA-N 1 2 248.355 2.294 20 0 BEADLO Cc1nnc(C[N@H+]2CCc3ccsc3[C@H]2C)[nH]1 ZINC000880377492 591015379 /nfs/dbraw/zinc/01/53/79/591015379.db2.gz XLSIEXALCCRBGO-MRVPVSSYSA-N 1 2 248.355 2.294 20 0 BEADLO OC[C@@H]1C=CC[N@@H+]1Cc1nc2ccccc2s1 ZINC000880487067 591062575 /nfs/dbraw/zinc/06/25/75/591062575.db2.gz WGVPGPDRNSHRMF-JTQLQIEISA-N 1 2 246.335 2.029 20 0 BEADLO OC[C@@H]1C=CC[N@H+]1Cc1nc2ccccc2s1 ZINC000880487067 591062579 /nfs/dbraw/zinc/06/25/79/591062579.db2.gz WGVPGPDRNSHRMF-JTQLQIEISA-N 1 2 246.335 2.029 20 0 BEADLO C[C@H](NC(=O)C[C@@H]1C[C@H]1C1CC1)c1[nH+]ccn1C ZINC000880722151 591127486 /nfs/dbraw/zinc/12/74/86/591127486.db2.gz IBBCRJNJBJMYDO-DLOVCJGASA-N 1 2 247.342 2.034 20 0 BEADLO OC[C@@H]1CCC[N@H+](C/C(Cl)=C\Cl)C1 ZINC000211363047 591162396 /nfs/dbraw/zinc/16/23/96/591162396.db2.gz LJJCDSSTSBJTKP-SXPLAPADSA-N 1 2 224.131 2.010 20 0 BEADLO OC[C@@H]1CCC[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000211363047 591162398 /nfs/dbraw/zinc/16/23/98/591162398.db2.gz LJJCDSSTSBJTKP-SXPLAPADSA-N 1 2 224.131 2.010 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC[C@@]1(C)CC1(C)C ZINC000881545785 591237921 /nfs/dbraw/zinc/23/79/21/591237921.db2.gz OGIBFWQWTZEVPD-QMTHXVAHSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC[C@@]1(C)CC1(C)C ZINC000881545785 591237922 /nfs/dbraw/zinc/23/79/22/591237922.db2.gz OGIBFWQWTZEVPD-QMTHXVAHSA-N 1 2 249.358 2.141 20 0 BEADLO Fc1c[nH+]ccc1NC[C@H]1CC1(Cl)Cl ZINC000881769037 591269761 /nfs/dbraw/zinc/26/97/61/591269761.db2.gz HBJFAZSJFIDTOQ-ZCFIWIBFSA-N 1 2 235.089 2.248 20 0 BEADLO COc1ccc(CNc2nc[nH+]c(C)c2C)cn1 ZINC000881782318 591271391 /nfs/dbraw/zinc/27/13/91/591271391.db2.gz CLSIEJGZRBLPBA-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO C[C@@H](Cc1ccco1)Nc1cc(CO)cc[nH+]1 ZINC000881796892 591271418 /nfs/dbraw/zinc/27/14/18/591271418.db2.gz CHXHQYXABIHPNM-JTQLQIEISA-N 1 2 232.283 2.210 20 0 BEADLO Cc1[nH+]cnc(N(C)Cc2ccoc2)c1C ZINC000881835650 591273567 /nfs/dbraw/zinc/27/35/67/591273567.db2.gz HKUAVDUFBBLCLI-UHFFFAOYSA-N 1 2 217.272 2.323 20 0 BEADLO Cc1[nH+]cnc(NCC(F)(F)F)c1C ZINC000881846600 591274181 /nfs/dbraw/zinc/27/41/81/591274181.db2.gz SYMALFPATKGRQS-UHFFFAOYSA-N 1 2 205.183 2.068 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H](O)c2ccsc2)c1C ZINC000882004967 591286836 /nfs/dbraw/zinc/28/68/36/591286836.db2.gz XNQGSJHMEIGABX-LLVKDONJSA-N 1 2 249.339 2.300 20 0 BEADLO CS[C@H]1CC[C@H](Nc2cc(CO)cc[nH+]2)C1 ZINC000882027887 591288858 /nfs/dbraw/zinc/28/88/58/591288858.db2.gz GHMDYKJXDUSTIK-QWRGUYRKSA-N 1 2 238.356 2.270 20 0 BEADLO CS[C@@H]1CC[C@H](Nc2cc(CO)cc[nH+]2)C1 ZINC000882027888 591289061 /nfs/dbraw/zinc/28/90/61/591289061.db2.gz GHMDYKJXDUSTIK-WDEREUQCSA-N 1 2 238.356 2.270 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2CCCSC2)c1C ZINC000882054580 591292542 /nfs/dbraw/zinc/29/25/42/591292542.db2.gz PXIOQASKWXEWBW-SNVBAGLBSA-N 1 2 223.345 2.401 20 0 BEADLO CO[C@@H]1C[C@H](Nc2nc[nH+]c(C)c2C)C1(C)C ZINC000882071303 591293929 /nfs/dbraw/zinc/29/39/29/591293929.db2.gz BNWCZLHBXLAWMT-WDEREUQCSA-N 1 2 235.331 2.319 20 0 BEADLO CC[C@H]1CCN(c2nc[nH+]c(C)c2C)C1 ZINC000882078577 591294691 /nfs/dbraw/zinc/29/46/91/591294691.db2.gz XRYZYBCYANBMKM-NSHDSACASA-N 1 2 205.305 2.330 20 0 BEADLO Cc1[nH+]cnc(N[C@H](C)C[C@@H]2CCOC2)c1C ZINC000882088808 591295569 /nfs/dbraw/zinc/29/55/69/591295569.db2.gz MSGVRTGZSZOHQA-SKDRFNHKSA-N 1 2 235.331 2.320 20 0 BEADLO C[C@H]1CC[C@H](Nc2cc(CO)cc[nH+]2)C1 ZINC000882228928 591317665 /nfs/dbraw/zinc/31/76/65/591317665.db2.gz GIFYAVGETHNDRA-ONGXEEELSA-N 1 2 206.289 2.174 20 0 BEADLO Cc1[nH+]cnc(N2CC[C@H](C(F)F)C2)c1C ZINC000882311343 591327686 /nfs/dbraw/zinc/32/76/86/591327686.db2.gz LFFFZDFPLDTESR-VIFPVBQESA-N 1 2 227.258 2.185 20 0 BEADLO Cc1[nH+]cnc(NCCCOC(F)F)c1C ZINC000882321213 591330796 /nfs/dbraw/zinc/33/07/96/591330796.db2.gz TWZVRNVZRYDVLE-UHFFFAOYSA-N 1 2 231.246 2.135 20 0 BEADLO Cc1[nH+]cnc(N2CC[C@]3(C2)CCCOC3)c1C ZINC000882330153 591332424 /nfs/dbraw/zinc/33/24/24/591332424.db2.gz NTJHDVDOWIMGSD-AWEZNQCLSA-N 1 2 247.342 2.100 20 0 BEADLO CCOC1(C)CCN(c2nc[nH+]c(C)c2C)CC1 ZINC000882389595 591341156 /nfs/dbraw/zinc/34/11/56/591341156.db2.gz ICAPAHKVOUMEQF-UHFFFAOYSA-N 1 2 249.358 2.489 20 0 BEADLO Cc1ccncc1CNc1nc[nH+]c(C)c1C ZINC000882423066 591345993 /nfs/dbraw/zinc/34/59/93/591345993.db2.gz YXQZVWAAPVBTDL-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)Nc1ncnc(C)c1C ZINC000882426552 591346439 /nfs/dbraw/zinc/34/64/39/591346439.db2.gz LWSXTAFAPHWCFR-NSHDSACASA-N 1 2 245.330 2.483 20 0 BEADLO Cc1[nH+]cnc(N2CC[C@H](O)CC(C)(C)C2)c1C ZINC000882428116 591347007 /nfs/dbraw/zinc/34/70/07/591347007.db2.gz NBIDULLFLFYZSZ-LBPRGKRZSA-N 1 2 249.358 2.081 20 0 BEADLO CO[C@@H]1C[C@H](Nc2nc[nH+]c(C)c2C)C12CCC2 ZINC000882443119 591350063 /nfs/dbraw/zinc/35/00/63/591350063.db2.gz QMQLJSSZIJXOFM-NWDGAFQWSA-N 1 2 247.342 2.463 20 0 BEADLO COCC[C@H](C)CNc1nc[nH+]c(C)c1C ZINC000882453637 591350670 /nfs/dbraw/zinc/35/06/70/591350670.db2.gz VXEQOCBBIWRAJS-VIFPVBQESA-N 1 2 223.320 2.178 20 0 BEADLO CC[C@H]1C[C@@H](Nc2nc[nH+]c(C)c2C)CCO1 ZINC000882472522 591354007 /nfs/dbraw/zinc/35/40/07/591354007.db2.gz RIVDPAPZCREKQQ-RYUDHWBXSA-N 1 2 235.331 2.463 20 0 BEADLO CC[C@H]1C[C@H](Nc2nc[nH+]c(C)c2C)CCO1 ZINC000882472519 591354153 /nfs/dbraw/zinc/35/41/53/591354153.db2.gz RIVDPAPZCREKQQ-NEPJUHHUSA-N 1 2 235.331 2.463 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2CCS[C@@H]2C)c1C ZINC000882519386 591381184 /nfs/dbraw/zinc/38/11/84/591381184.db2.gz VVQHCWMKAIVIKZ-ZJUUUORDSA-N 1 2 223.345 2.399 20 0 BEADLO Cc1[nH+]cnc(NCCC2(CO)CCC2)c1C ZINC000882532088 591382990 /nfs/dbraw/zinc/38/29/90/591382990.db2.gz WNRJNUJDPKDFIY-UHFFFAOYSA-N 1 2 235.331 2.058 20 0 BEADLO COC1CC(CCNc2nc[nH+]c(C)c2C)C1 ZINC000882575975 591393255 /nfs/dbraw/zinc/39/32/55/591393255.db2.gz QGVLIWHTMCHTHM-UHFFFAOYSA-N 1 2 235.331 2.320 20 0 BEADLO Cc1ncnc(N[C@@H](C)c2[nH+]ccn2C)c1C ZINC000882625821 591402265 /nfs/dbraw/zinc/40/22/65/591402265.db2.gz OPFLMYMHHGDLJS-JTQLQIEISA-N 1 2 231.303 2.000 20 0 BEADLO OCc1cc[nH+]c(NCC[C@@H]2CCSC2)c1 ZINC000882675015 591408792 /nfs/dbraw/zinc/40/87/92/591408792.db2.gz KGCZPHIVVDBWBH-SNVBAGLBSA-N 1 2 238.356 2.129 20 0 BEADLO C[C@@H](Nc1cc(CO)cc[nH+]1)c1ccns1 ZINC000882669259 591408877 /nfs/dbraw/zinc/40/88/77/591408877.db2.gz YOJJZFNIARBTQN-MRVPVSSYSA-N 1 2 235.312 2.204 20 0 BEADLO CCC[C@H](CCO)Nc1nc[nH+]c(C)c1C ZINC000882678538 591410488 /nfs/dbraw/zinc/41/04/88/591410488.db2.gz UWSDUJJYNNSGPH-LLVKDONJSA-N 1 2 223.320 2.056 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@H]2CSC[C@H]2C1 ZINC000882697418 591413727 /nfs/dbraw/zinc/41/37/27/591413727.db2.gz FLOPJDIBSMWDOA-VHSXEESVSA-N 1 2 238.331 2.410 20 0 BEADLO CC[C@@H](C[C@H](C)O)Nc1nc[nH+]c(C)c1C ZINC000882708242 591415786 /nfs/dbraw/zinc/41/57/86/591415786.db2.gz WKDHUVVTJQUAQZ-KWQFWETISA-N 1 2 223.320 2.055 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2C[C@H]3CCC[C@H]3O2)c1C ZINC000882715001 591418134 /nfs/dbraw/zinc/41/81/34/591418134.db2.gz GODIJULETMSRAO-FRRDWIJNSA-N 1 2 247.342 2.463 20 0 BEADLO Fc1c[nH+]ccc1NC[C@@H]1C[C@H]2CCC[C@H]2O1 ZINC000882715497 591419618 /nfs/dbraw/zinc/41/96/18/591419618.db2.gz DXDFXZJVRVETBG-GBIKHYSHSA-N 1 2 236.290 2.012 20 0 BEADLO FC[C@H]1CCN(c2cc[nH+]c3ccncc32)C1 ZINC000882840772 591450790 /nfs/dbraw/zinc/45/07/90/591450790.db2.gz DSILMUKAEIDWFV-SNVBAGLBSA-N 1 2 231.274 2.426 20 0 BEADLO Cc1nc(N2CC[C@@H](CF)C2)c(C)c(C)[nH+]1 ZINC000882841186 591451225 /nfs/dbraw/zinc/45/12/25/591451225.db2.gz OOOFWGBCLIQKSJ-NSHDSACASA-N 1 2 223.295 2.198 20 0 BEADLO Cc1nc(N2CC[C@H](CF)C2)c(C)c(C)[nH+]1 ZINC000882841185 591451540 /nfs/dbraw/zinc/45/15/40/591451540.db2.gz OOOFWGBCLIQKSJ-LLVKDONJSA-N 1 2 223.295 2.198 20 0 BEADLO FC[C@@H]1CCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000882842214 591452469 /nfs/dbraw/zinc/45/24/69/591452469.db2.gz PRGKYGWNCRKFSG-VIFPVBQESA-N 1 2 219.263 2.359 20 0 BEADLO Cc1cc(N2CC(CC3CCOCC3)C2)nc[nH+]1 ZINC000882885569 591462979 /nfs/dbraw/zinc/46/29/79/591462979.db2.gz DATORFWHXFUBFW-UHFFFAOYSA-N 1 2 247.342 2.038 20 0 BEADLO CC(C)c1c[nH]c(C[NH2+]Cc2ccoc2)n1 ZINC000882914349 591474808 /nfs/dbraw/zinc/47/48/08/591474808.db2.gz PHYARTUPAUJIEG-UHFFFAOYSA-N 1 2 219.288 2.416 20 0 BEADLO Cc1cc(N[C@@H]2CCC[C@]23CCCO3)nc[nH+]1 ZINC000882982293 591492664 /nfs/dbraw/zinc/49/26/64/591492664.db2.gz HWTPRDOPBSAJHK-YPMHNXCESA-N 1 2 233.315 2.299 20 0 BEADLO CC1(C)C[C@@H](O[NH+]=C(N)c2ccccc2)CO1 ZINC000883048770 591528263 /nfs/dbraw/zinc/52/82/63/591528263.db2.gz VYALJEXUWVVTDP-LLVKDONJSA-N 1 2 234.299 2.101 20 0 BEADLO CSc1ccc(C[NH2+]Cc2ccn(C)n2)o1 ZINC000883078747 591535583 /nfs/dbraw/zinc/53/55/83/591535583.db2.gz BKUKFBAPAQNCRR-UHFFFAOYSA-N 1 2 237.328 2.025 20 0 BEADLO CC(C)c1c[nH]c(C[NH2+][C@H](C)c2cn[nH]c2)n1 ZINC000883076859 591536151 /nfs/dbraw/zinc/53/61/51/591536151.db2.gz PJYAWOVMIWVQSA-SECBINFHSA-N 1 2 233.319 2.107 20 0 BEADLO CC(C)c1c[nH]c(CNc2ccc(CO)c[nH+]2)n1 ZINC000883121772 591543908 /nfs/dbraw/zinc/54/39/08/591543908.db2.gz RLZDROKUASVATI-UHFFFAOYSA-N 1 2 246.314 2.033 20 0 BEADLO c1cc(C[NH2+]C2(c3ncccn3)CCC2)co1 ZINC000883307631 591610967 /nfs/dbraw/zinc/61/09/67/591610967.db2.gz YCVNFJCFKLHSPA-UHFFFAOYSA-N 1 2 229.283 2.239 20 0 BEADLO Cc1cc(NCc2c[nH+]c3n2CCC3)cnc1C ZINC000883341070 591619875 /nfs/dbraw/zinc/61/98/75/591619875.db2.gz HQCURFUGDWJQQI-UHFFFAOYSA-N 1 2 242.326 2.453 20 0 BEADLO COc1nccc(CNc2c[nH+]c(C)c(C)c2)n1 ZINC000883341449 591620394 /nfs/dbraw/zinc/62/03/94/591620394.db2.gz QGMFMBCQOBVFCE-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO C[N@H+](C/C(Cl)=C/Cl)C(C)(C)CO ZINC000131728157 591650304 /nfs/dbraw/zinc/65/03/04/591650304.db2.gz CXPLPPJOXVTNHG-DAXSKMNVSA-N 1 2 212.120 2.008 20 0 BEADLO C[N@@H+](C/C(Cl)=C/Cl)C(C)(C)CO ZINC000131728157 591650305 /nfs/dbraw/zinc/65/03/05/591650305.db2.gz CXPLPPJOXVTNHG-DAXSKMNVSA-N 1 2 212.120 2.008 20 0 BEADLO CNC(=O)CCOc1ccc([NH2+]C(C)C)cc1 ZINC000133050921 591761602 /nfs/dbraw/zinc/76/16/02/591761602.db2.gz BLFPQYLNCMJZSD-UHFFFAOYSA-N 1 2 236.315 2.022 20 0 BEADLO C[C@H](O)CC[NH2+]c1ccc(OC(F)F)cc1 ZINC000133556616 591823962 /nfs/dbraw/zinc/82/39/62/591823962.db2.gz IIEZHIQSIHTBKY-QMMMGPOBSA-N 1 2 231.242 2.471 20 0 BEADLO C[C@@H]([NH2+]c1ccc(OCCO)cc1)C1CC1 ZINC000134503210 591931404 /nfs/dbraw/zinc/93/14/04/591931404.db2.gz SCGFROQMCBIQGQ-SNVBAGLBSA-N 1 2 221.300 2.268 20 0 BEADLO CCc1nc(N2CCCC[C@H]2C[C@H](C)O)cc[nH+]1 ZINC000884490983 591955165 /nfs/dbraw/zinc/95/51/65/591955165.db2.gz KPLIFPXMZHHNQZ-RYUDHWBXSA-N 1 2 249.358 2.169 20 0 BEADLO CCc1nc(NCC2(COC)CCC2)cc[nH+]1 ZINC000884497918 591957714 /nfs/dbraw/zinc/95/77/14/591957714.db2.gz LVMUUWNCBVWNDI-UHFFFAOYSA-N 1 2 235.331 2.268 20 0 BEADLO CCc1nc(N2CCC[C@H]2[C@H]2CCCO2)cc[nH+]1 ZINC000884499738 591958125 /nfs/dbraw/zinc/95/81/25/591958125.db2.gz MDMLXXSIGWRUIE-NWDGAFQWSA-N 1 2 247.342 2.187 20 0 BEADLO CCc1nc(N[C@H]2CSC[C@@H]2C)cc[nH+]1 ZINC000884505286 591959927 /nfs/dbraw/zinc/95/99/27/591959927.db2.gz CWLUHWKBABYEQN-IUCAKERBSA-N 1 2 223.345 2.202 20 0 BEADLO CCC[C@@]1(CO)CCN(c2cc[nH+]c(CC)n2)C1 ZINC000884511062 591960857 /nfs/dbraw/zinc/96/08/57/591960857.db2.gz WXRWKWQIGXCHDK-CQSZACIVSA-N 1 2 249.358 2.028 20 0 BEADLO CCc1nc(NCC2CC(F)(F)C2)cc[nH+]1 ZINC000884513159 591961752 /nfs/dbraw/zinc/96/17/52/591961752.db2.gz ASWHCMLSUHFXKS-UHFFFAOYSA-N 1 2 227.258 2.496 20 0 BEADLO CCc1nc(N[C@H]2CCOC2(C)C)cc[nH+]1 ZINC000884519650 591964338 /nfs/dbraw/zinc/96/43/38/591964338.db2.gz YTQAOBJZWRNVRM-VIFPVBQESA-N 1 2 221.304 2.018 20 0 BEADLO CCc1nc(N[C@@H](C)CC(C)(C)O)cc[nH+]1 ZINC000884520566 591964838 /nfs/dbraw/zinc/96/48/38/591964838.db2.gz YXMUJCAVWKXHAZ-VIFPVBQESA-N 1 2 223.320 2.000 20 0 BEADLO CCc1nc(N[C@H](C)[C@@H](OC)C2CC2)cc[nH+]1 ZINC000884524472 591965901 /nfs/dbraw/zinc/96/59/01/591965901.db2.gz YPJOLFQFUIVUHM-NOZJJQNGSA-N 1 2 235.331 2.264 20 0 BEADLO CCc1nc(NC[C@@H]2CCCC[C@H]2O)cc[nH+]1 ZINC000884523282 591965909 /nfs/dbraw/zinc/96/59/09/591965909.db2.gz TYLUKPCLNQFSEG-WDEREUQCSA-N 1 2 235.331 2.002 20 0 BEADLO CCc1nc(N2CCCC[C@H]2COC)cc[nH+]1 ZINC000884525642 591966599 /nfs/dbraw/zinc/96/65/99/591966599.db2.gz ZYTUORXMZYUZDR-NSHDSACASA-N 1 2 235.331 2.044 20 0 BEADLO CCc1nc(N[C@@H]2CCO[C@H]2CC)cc[nH+]1 ZINC000884527843 591966875 /nfs/dbraw/zinc/96/68/75/591966875.db2.gz AMCMAGWJRXCPIC-ZJUUUORDSA-N 1 2 221.304 2.018 20 0 BEADLO CCc1nc(NC[C@@H]2C[C@H](C)O[C@@H]2C)cc[nH+]1 ZINC000884530227 591968596 /nfs/dbraw/zinc/96/85/96/591968596.db2.gz HVRAIKJZYWATCR-AXFHLTTASA-N 1 2 235.331 2.264 20 0 BEADLO CCc1nc(N[C@@H](C)c2csnn2)cc[nH+]1 ZINC000884531841 591969086 /nfs/dbraw/zinc/96/90/86/591969086.db2.gz WRONPRYYWKLTTI-ZETCQYMHSA-N 1 2 235.316 2.064 20 0 BEADLO CCC[C@@H](C)[C@@H](CO)Nc1cc[nH+]c(CC)n1 ZINC000884544769 591973526 /nfs/dbraw/zinc/97/35/26/591973526.db2.gz PCBZIWUKONSHQL-GHMZBOCLSA-N 1 2 237.347 2.248 20 0 BEADLO CCc1nc(N2CC[C@]3(CC3(F)F)C2)cc[nH+]1 ZINC000884546672 591975493 /nfs/dbraw/zinc/97/54/93/591975493.db2.gz QWWZXLMJXJXQGT-NSHDSACASA-N 1 2 239.269 2.275 20 0 BEADLO CCc1nc(N2CC[C@H]2C(F)(F)F)cc[nH+]1 ZINC000884551350 591976230 /nfs/dbraw/zinc/97/62/30/591976230.db2.gz YAWOLJREUYNOQT-ZETCQYMHSA-N 1 2 231.221 2.180 20 0 BEADLO CCc1nc(N[C@@H]2[C@H](C)O[C@H](C)[C@H]2C)cc[nH+]1 ZINC000884565726 591982332 /nfs/dbraw/zinc/98/23/32/591982332.db2.gz RKAFNRCTKWVCSN-DNJQJEMRSA-N 1 2 235.331 2.263 20 0 BEADLO CCc1nc(N[C@@H]2[C@H](C)O[C@@H](C)[C@H]2C)cc[nH+]1 ZINC000884565727 591982391 /nfs/dbraw/zinc/98/23/91/591982391.db2.gz RKAFNRCTKWVCSN-QYTUQVAYSA-N 1 2 235.331 2.263 20 0 BEADLO CCO[C@@]1(C)C[C@H]1Nc1cc[nH+]c(CC)n1 ZINC000884564641 591982718 /nfs/dbraw/zinc/98/27/18/591982718.db2.gz MRVSUJXIDMMVFJ-SKDRFNHKSA-N 1 2 221.304 2.018 20 0 BEADLO CCc1nc(N[C@@H]2C[C@H]2C2CCOCC2)cc[nH+]1 ZINC000884574872 591984874 /nfs/dbraw/zinc/98/48/74/591984874.db2.gz WBQOZDBHKWWMSJ-NWDGAFQWSA-N 1 2 247.342 2.266 20 0 BEADLO CCc1nc(NC[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc[nH+]1 ZINC000884579214 591985898 /nfs/dbraw/zinc/98/58/98/591985898.db2.gz UIZOQZHDHHNBSU-SRVKXCTJSA-N 1 2 247.342 2.409 20 0 BEADLO CCc1nc(N2CCC[C@@H](C(C)(C)O)C2)cc[nH+]1 ZINC000884578674 591986351 /nfs/dbraw/zinc/98/63/51/591986351.db2.gz GXCLUXMUXHOQOH-LLVKDONJSA-N 1 2 249.358 2.026 20 0 BEADLO CCc1nc(NCCc2ccns2)cc[nH+]1 ZINC000884580455 591986362 /nfs/dbraw/zinc/98/63/62/591986362.db2.gz CVCYSMALOIACDL-UHFFFAOYSA-N 1 2 234.328 2.150 20 0 BEADLO CCc1nc(N2CCC[C@@H](CF)C2)cc[nH+]1 ZINC000884581322 591987022 /nfs/dbraw/zinc/98/70/22/591987022.db2.gz ZNFMLZBFSAAWBI-JTQLQIEISA-N 1 2 223.295 2.225 20 0 BEADLO Cn1c2cc(F)ccc2[nH+]c1N1C[C@@H]2C[C@@H]2C1 ZINC000884591339 591989969 /nfs/dbraw/zinc/98/99/69/591989969.db2.gz PVTFMTGPGLQFSJ-DTORHVGOSA-N 1 2 231.274 2.169 20 0 BEADLO Cc1nc(N2C[C@@H]3CSC[C@@H]3C2)c(C)c(C)[nH+]1 ZINC000884645397 592001603 /nfs/dbraw/zinc/00/16/03/592001603.db2.gz DMLJUUDCSKKGDM-TXEJJXNPSA-N 1 2 249.383 2.201 20 0 BEADLO C[C@@H]1C[C@@]2(CC[C@H](CNc3cccc[nH+]3)O2)CO1 ZINC000884698294 592013046 /nfs/dbraw/zinc/01/30/46/592013046.db2.gz LWGMUFXFUICLLF-BZPMIXESSA-N 1 2 248.326 2.220 20 0 BEADLO CC(C)OC(=O)C1CCN(c2cccc[nH+]2)CC1 ZINC000884720396 592014725 /nfs/dbraw/zinc/01/47/25/592014725.db2.gz MLUGDZINTMBDRG-UHFFFAOYSA-N 1 2 248.326 2.250 20 0 BEADLO C[C@@H](CC(=O)N1CC[C@@H]2CCC[C@@H]21)n1cc[nH+]c1 ZINC000890235537 592014911 /nfs/dbraw/zinc/01/49/11/592014911.db2.gz GHJHNGRAYPTDSU-AVGNSLFASA-N 1 2 247.342 2.235 20 0 BEADLO O=C(NCCc1[nH]cc[nH+]1)C1CCCCCCC1 ZINC000135488422 592015073 /nfs/dbraw/zinc/01/50/73/592015073.db2.gz OQTLIXLFYARWBJ-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO CCc1nc(N2CC[C@@H]([C@@H]3CCCO3)C2)cc[nH+]1 ZINC000884751609 592017360 /nfs/dbraw/zinc/01/73/60/592017360.db2.gz MZMHMFUXXZDGBK-NEPJUHHUSA-N 1 2 247.342 2.044 20 0 BEADLO CCc1nc(N2CC[C@@H]([C@H]3CCCO3)C2)cc[nH+]1 ZINC000884751615 592017380 /nfs/dbraw/zinc/01/73/80/592017380.db2.gz MZMHMFUXXZDGBK-VXGBXAGGSA-N 1 2 247.342 2.044 20 0 BEADLO Cc1[nH+]cnc(N2CC[C@@H]([C@H]3CCCO3)C2)c1C ZINC000884752251 592017610 /nfs/dbraw/zinc/01/76/10/592017610.db2.gz SRVAZJBSPBAMOT-CHWSQXEVSA-N 1 2 247.342 2.099 20 0 BEADLO CC[C@H]1C[N@H+](CCSC(F)(F)F)CCO1 ZINC000885951595 592113876 /nfs/dbraw/zinc/11/38/76/592113876.db2.gz LIVQHMBYTYGUJK-QMMMGPOBSA-N 1 2 243.294 2.350 20 0 BEADLO CC[C@H]1C[N@@H+](CCSC(F)(F)F)CCO1 ZINC000885951595 592113877 /nfs/dbraw/zinc/11/38/77/592113877.db2.gz LIVQHMBYTYGUJK-QMMMGPOBSA-N 1 2 243.294 2.350 20 0 BEADLO CC1(C)COCC[N@@H+]1CCSC(F)(F)F ZINC000885965448 592116684 /nfs/dbraw/zinc/11/66/84/592116684.db2.gz NMNUKYACDPUOIS-UHFFFAOYSA-N 1 2 243.294 2.350 20 0 BEADLO Cc1coc(C[NH2+]Cc2nccn2C(F)F)c1 ZINC000885949466 592114271 /nfs/dbraw/zinc/11/42/71/592114271.db2.gz YSAAYBHKFBHDDD-UHFFFAOYSA-N 1 2 241.241 2.469 20 0 BEADLO CC1(C)COCC[N@H+]1CCSC(F)(F)F ZINC000885965448 592116687 /nfs/dbraw/zinc/11/66/87/592116687.db2.gz NMNUKYACDPUOIS-UHFFFAOYSA-N 1 2 243.294 2.350 20 0 BEADLO C[N@H+](CCOC1CCCCC1)Cc1cc[nH]n1 ZINC000886006637 592129368 /nfs/dbraw/zinc/12/93/68/592129368.db2.gz UFDYNRRRHKVWGO-UHFFFAOYSA-N 1 2 237.347 2.191 20 0 BEADLO C[N@@H+](CCOC1CCCCC1)Cc1cc[nH]n1 ZINC000886006637 592129370 /nfs/dbraw/zinc/12/93/70/592129370.db2.gz UFDYNRRRHKVWGO-UHFFFAOYSA-N 1 2 237.347 2.191 20 0 BEADLO C[N@@H+](Cc1ncc[nH]1)C[C@@H]1CCC2(CCC2)CO1 ZINC000886091485 592146736 /nfs/dbraw/zinc/14/67/36/592146736.db2.gz BAGVJIKIAWRVQR-LBPRGKRZSA-N 1 2 249.358 2.191 20 0 BEADLO C[N@H+](Cc1ncc[nH]1)C[C@@H]1CCC2(CCC2)CO1 ZINC000886091485 592146737 /nfs/dbraw/zinc/14/67/37/592146737.db2.gz BAGVJIKIAWRVQR-LBPRGKRZSA-N 1 2 249.358 2.191 20 0 BEADLO CCn1ccnc1[C@H](C)[NH2+]Cc1[nH]nc(C)c1C ZINC000886134429 592161055 /nfs/dbraw/zinc/16/10/55/592161055.db2.gz RSBCPSISGUTGTD-NSHDSACASA-N 1 2 247.346 2.094 20 0 BEADLO Cc1coc(C[NH2+][C@H](C)c2ccn(C)n2)c1 ZINC000886142652 592162271 /nfs/dbraw/zinc/16/22/71/592162271.db2.gz HMQHSBAEKMJNNP-SNVBAGLBSA-N 1 2 219.288 2.172 20 0 BEADLO Cc1ncc(C[NH2+][C@@H](C)c2ccn(C)n2)s1 ZINC000886243178 592183394 /nfs/dbraw/zinc/18/33/94/592183394.db2.gz QGDCKCGQXYRYGV-QMMMGPOBSA-N 1 2 236.344 2.036 20 0 BEADLO C=Cn1cc(C[NH2+]Cc2cc(C3CC3)no2)cn1 ZINC000886270897 592192128 /nfs/dbraw/zinc/19/21/28/592192128.db2.gz QFMIDNSOULAECE-UHFFFAOYSA-N 1 2 244.298 2.139 20 0 BEADLO C[N@H+](CCOC1CCCCC1)Cc1cnc[nH]1 ZINC000886274018 592194178 /nfs/dbraw/zinc/19/41/78/592194178.db2.gz KUGYUOYCQKKYTL-UHFFFAOYSA-N 1 2 237.347 2.191 20 0 BEADLO C[N@@H+](CCOC1CCCCC1)Cc1cnc[nH]1 ZINC000886274018 592194179 /nfs/dbraw/zinc/19/41/79/592194179.db2.gz KUGYUOYCQKKYTL-UHFFFAOYSA-N 1 2 237.347 2.191 20 0 BEADLO C[N@H+](CCOC1CCCCC1)Cc1c[nH]cn1 ZINC000886274018 592194180 /nfs/dbraw/zinc/19/41/80/592194180.db2.gz KUGYUOYCQKKYTL-UHFFFAOYSA-N 1 2 237.347 2.191 20 0 BEADLO C[N@@H+](CCOC1CCCCC1)Cc1c[nH]cn1 ZINC000886274018 592194181 /nfs/dbraw/zinc/19/41/81/592194181.db2.gz KUGYUOYCQKKYTL-UHFFFAOYSA-N 1 2 237.347 2.191 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCC(F)(F)C[C@H]1C ZINC000886300888 592203051 /nfs/dbraw/zinc/20/30/51/592203051.db2.gz RGZQTZCPZRDYNB-SECBINFHSA-N 1 2 229.274 2.338 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCC(F)(F)C[C@H]1C ZINC000886300888 592203053 /nfs/dbraw/zinc/20/30/53/592203053.db2.gz RGZQTZCPZRDYNB-SECBINFHSA-N 1 2 229.274 2.338 20 0 BEADLO Cc1cc(C[NH2+][C@@H](c2cnn(C)c2)C(C)C)no1 ZINC000886512942 592240552 /nfs/dbraw/zinc/24/05/52/592240552.db2.gz QCXHYGDIBWQFFL-CYBMUJFWSA-N 1 2 248.330 2.203 20 0 BEADLO CCc1nc(C[NH2+][C@H]2CCc3cccnc32)co1 ZINC000886620383 592276848 /nfs/dbraw/zinc/27/68/48/592276848.db2.gz IOKRDKAXNWQNJY-LBPRGKRZSA-N 1 2 243.310 2.409 20 0 BEADLO CCn1c[nH+]c2c1CCN(C(=O)[C@@H](C)C(C)C)C2 ZINC000886621215 592277180 /nfs/dbraw/zinc/27/71/80/592277180.db2.gz FRPPYCKKCNJRIO-NSHDSACASA-N 1 2 249.358 2.080 20 0 BEADLO CC(C)CC(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000075556691 592313926 /nfs/dbraw/zinc/31/39/26/592313926.db2.gz HBMVBEVRVFJGFW-NSHDSACASA-N 1 2 235.331 2.162 20 0 BEADLO O=C(N[C@]12C[C@H]1CCC2)c1cc2c[nH+]ccc2[nH]1 ZINC000887030946 592424189 /nfs/dbraw/zinc/42/41/89/592424189.db2.gz LDWIYSCZIHOEBK-QMTHXVAHSA-N 1 2 241.294 2.235 20 0 BEADLO FC(F)C[N@H+](CCCn1cc[nH+]c1)C1CCC1 ZINC000887100590 592441562 /nfs/dbraw/zinc/44/15/62/592441562.db2.gz IOPPJAZEMAULQV-UHFFFAOYSA-N 1 2 243.301 2.393 20 0 BEADLO FC(F)C[N@H+](CCCn1ccnc1)C1CCC1 ZINC000887100590 592441566 /nfs/dbraw/zinc/44/15/66/592441566.db2.gz IOPPJAZEMAULQV-UHFFFAOYSA-N 1 2 243.301 2.393 20 0 BEADLO FC(F)C[N@@H+](CCCn1ccnc1)C1CCC1 ZINC000887100590 592441569 /nfs/dbraw/zinc/44/15/69/592441569.db2.gz IOPPJAZEMAULQV-UHFFFAOYSA-N 1 2 243.301 2.393 20 0 BEADLO Cn1c[nH+]c(CN(CC(F)F)C2CCC2)c1 ZINC000887102265 592443299 /nfs/dbraw/zinc/44/32/99/592443299.db2.gz JHXFCDVGHDXQLH-UHFFFAOYSA-N 1 2 229.274 2.040 20 0 BEADLO CC(C)CCc1noc(C[N@H+](C)CCCF)n1 ZINC000887137418 592451483 /nfs/dbraw/zinc/45/14/83/592451483.db2.gz HSTJJWZIGWRGDM-UHFFFAOYSA-N 1 2 243.326 2.450 20 0 BEADLO CC(C)CCc1noc(C[N@@H+](C)CCCF)n1 ZINC000887137418 592451487 /nfs/dbraw/zinc/45/14/87/592451487.db2.gz HSTJJWZIGWRGDM-UHFFFAOYSA-N 1 2 243.326 2.450 20 0 BEADLO CCCCc1noc(C[N@H+](C)CCCF)n1 ZINC000887136682 592451742 /nfs/dbraw/zinc/45/17/42/592451742.db2.gz ZVWUSHXMUPMSQX-UHFFFAOYSA-N 1 2 229.299 2.204 20 0 BEADLO CCCCc1noc(C[N@@H+](C)CCCF)n1 ZINC000887136682 592451746 /nfs/dbraw/zinc/45/17/46/592451746.db2.gz ZVWUSHXMUPMSQX-UHFFFAOYSA-N 1 2 229.299 2.204 20 0 BEADLO CC(C)(CNC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C1CC1 ZINC000887370001 592494428 /nfs/dbraw/zinc/49/44/28/592494428.db2.gz CGFYYJQMJQKNFH-GHMZBOCLSA-N 1 2 247.342 2.066 20 0 BEADLO CC(C)(CNC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C1CC1 ZINC000887370001 592494430 /nfs/dbraw/zinc/49/44/30/592494430.db2.gz CGFYYJQMJQKNFH-GHMZBOCLSA-N 1 2 247.342 2.066 20 0 BEADLO O=C(CCn1cc[nH+]c1)N1CC[C@H]1C1CCCC1 ZINC000889399031 592607781 /nfs/dbraw/zinc/60/77/81/592607781.db2.gz WCWWFAYFRSNSKV-ZDUSSCGKSA-N 1 2 247.342 2.064 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CC[C@@H]1C1CCCC1 ZINC000889406758 592609072 /nfs/dbraw/zinc/60/90/72/592609072.db2.gz BDVUXQZAMMSZIM-CYBMUJFWSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1cc(NC(=O)C2(C3CC3)CC2)c(C)c[nH+]1 ZINC000889792993 592654623 /nfs/dbraw/zinc/65/46/23/592654623.db2.gz VPVMLIWSQQSSFV-UHFFFAOYSA-N 1 2 230.311 2.249 20 0 BEADLO O=C(Cn1cc[nH+]c1)NC[C@@H]1CCC=CCCC1 ZINC000890045731 592671222 /nfs/dbraw/zinc/67/12/22/592671222.db2.gz QLVSQLAEBZIJHY-CYBMUJFWSA-N 1 2 247.342 2.136 20 0 BEADLO CC[C@@H]1CCC[C@]1(C)C(=O)NCc1cn(C)c[nH+]1 ZINC000890100371 592679076 /nfs/dbraw/zinc/67/90/76/592679076.db2.gz USGDSLFKEVYEOX-RISCZKNCSA-N 1 2 249.358 2.253 20 0 BEADLO Cn1c[nH+]c(CNC(=O)[C@@H]2C[C@H]2CC(C)(C)C)c1 ZINC000890104739 592682051 /nfs/dbraw/zinc/68/20/51/592682051.db2.gz PQSUZKXVPZWMHG-CMPLNLGQSA-N 1 2 249.358 2.109 20 0 BEADLO CCC[C@](C)(CC)C(=O)NCc1cn(C)c[nH+]1 ZINC000890108302 592682842 /nfs/dbraw/zinc/68/28/42/592682842.db2.gz WZJJIFZRFFPHIT-ZDUSSCGKSA-N 1 2 237.347 2.253 20 0 BEADLO Cc1scc(C(=O)NCc2cn(C)c[nH+]2)c1C ZINC000890109489 592683105 /nfs/dbraw/zinc/68/31/05/592683105.db2.gz OUKRWEORKJYMAP-UHFFFAOYSA-N 1 2 249.339 2.028 20 0 BEADLO CC(C)CC1(C(=O)NCc2cn(C)c[nH+]2)CCC1 ZINC000890110374 592684823 /nfs/dbraw/zinc/68/48/23/592684823.db2.gz NOYLDPRHHBSLJE-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO C[C@@H]1CCCC[C@H]1CC(=O)NCc1cn(C)c[nH+]1 ZINC000890114585 592685315 /nfs/dbraw/zinc/68/53/15/592685315.db2.gz QMELHMGMDCXVNV-NEPJUHHUSA-N 1 2 249.358 2.253 20 0 BEADLO CCCCCOC(=O)C[NH2+][C@H](C)CCSC ZINC001258212904 991130572 /nfs/dbraw/zinc/13/05/72/991130572.db2.gz WCZBPSJIZAHHSF-LLVKDONJSA-N 1 2 247.404 2.451 20 0 BEADLO Cc1ccncc1C[NH+]1CC(C(F)(F)F)C1 ZINC000336188785 634612434 /nfs/dbraw/zinc/61/24/34/634612434.db2.gz BAQIOCJUGJNQTQ-UHFFFAOYSA-N 1 2 230.233 2.384 20 0 BEADLO CNc1cc(N2CCC3(CCC3)CC2)nc[nH+]1 ZINC000308717229 631359199 /nfs/dbraw/zinc/35/91/99/631359199.db2.gz LFHRSWMYORUYKF-UHFFFAOYSA-N 1 2 232.331 2.289 20 0 BEADLO CNc1cc(N2CCC3(CCC3)CC2)[nH+]cn1 ZINC000308717229 631359202 /nfs/dbraw/zinc/35/92/02/631359202.db2.gz LFHRSWMYORUYKF-UHFFFAOYSA-N 1 2 232.331 2.289 20 0 BEADLO OC[C@H]1CC[N@@H+]1Cc1cccc(Cl)c1F ZINC000934014757 631588404 /nfs/dbraw/zinc/58/84/04/631588404.db2.gz OSMAADJSPKMXFI-SECBINFHSA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@H]1CC[N@H+]1Cc1cccc(Cl)c1F ZINC000934014757 631588409 /nfs/dbraw/zinc/58/84/09/631588409.db2.gz OSMAADJSPKMXFI-SECBINFHSA-N 1 2 229.682 2.046 20 0 BEADLO C[C@@H](c1c(F)cccc1F)[N@@H+]1CC[C@@H]1CO ZINC000934024768 631597242 /nfs/dbraw/zinc/59/72/42/631597242.db2.gz ABLNJBSVTNJYBT-DTWKUNHWSA-N 1 2 227.254 2.092 20 0 BEADLO C[C@@H](c1c(F)cccc1F)[N@H+]1CC[C@@H]1CO ZINC000934024768 631597258 /nfs/dbraw/zinc/59/72/58/631597258.db2.gz ABLNJBSVTNJYBT-DTWKUNHWSA-N 1 2 227.254 2.092 20 0 BEADLO O=C(NCCC1CCC1)c1cc2c[nH+]ccc2[nH]1 ZINC000934472482 631866523 /nfs/dbraw/zinc/86/65/23/631866523.db2.gz RLZMJPLOFKUDQE-UHFFFAOYSA-N 1 2 243.310 2.483 20 0 BEADLO CCOC(=O)C[N@H+](CC)CCSC(C)(C)C ZINC000309161068 631924058 /nfs/dbraw/zinc/92/40/58/631924058.db2.gz JDYOTAZGZOOUOH-UHFFFAOYSA-N 1 2 247.404 2.403 20 0 BEADLO CCOC(=O)C[N@@H+](CC)CCSC(C)(C)C ZINC000309161068 631924062 /nfs/dbraw/zinc/92/40/62/631924062.db2.gz JDYOTAZGZOOUOH-UHFFFAOYSA-N 1 2 247.404 2.403 20 0 BEADLO Clc1csc(C[NH2+]Cc2cccnc2)n1 ZINC000308851816 631927507 /nfs/dbraw/zinc/92/75/07/631927507.db2.gz BPDPIWYUUGQNAM-UHFFFAOYSA-N 1 2 239.731 2.481 20 0 BEADLO C[C@H](c1cccc(F)c1)[N@@H+]1CC[C@H](O)[C@@H](F)C1 ZINC000934579089 631950084 /nfs/dbraw/zinc/95/00/84/631950084.db2.gz GRXQJDFPNWQPOX-ICCXJUOJSA-N 1 2 241.281 2.291 20 0 BEADLO C[C@H](c1cccc(F)c1)[N@H+]1CC[C@H](O)[C@@H](F)C1 ZINC000934579089 631950088 /nfs/dbraw/zinc/95/00/88/631950088.db2.gz GRXQJDFPNWQPOX-ICCXJUOJSA-N 1 2 241.281 2.291 20 0 BEADLO CCCCCC(=O)OCc1cc[nH+]c(N)c1 ZINC000309244962 631979474 /nfs/dbraw/zinc/97/94/74/631979474.db2.gz BWZBSQGDEMASMZ-UHFFFAOYSA-N 1 2 222.288 2.287 20 0 BEADLO CCC/C=C\C(=O)OCc1cc[nH+]c(N)c1 ZINC000309277285 631983002 /nfs/dbraw/zinc/98/30/02/631983002.db2.gz MKIPJFFRIFVZIZ-PLNGDYQASA-N 1 2 220.272 2.063 20 0 BEADLO c1snnc1C[NH2+][C@@H](c1ccncc1)C1CC1 ZINC000934695619 632018709 /nfs/dbraw/zinc/01/87/09/632018709.db2.gz AAOUOGIJLHXGBZ-GFCCVEGCSA-N 1 2 246.339 2.174 20 0 BEADLO C[C@H]([NH2+][C@H]1CC[C@H]1C)C(=O)OC(C)(C)C ZINC000308871071 632033259 /nfs/dbraw/zinc/03/32/59/632033259.db2.gz YZDVNJGAMRPDCC-UTLUCORTSA-N 1 2 213.321 2.105 20 0 BEADLO CC[C@]1([NH2+]CC(F)(F)C(F)F)CCOC1 ZINC000309164435 632656137 /nfs/dbraw/zinc/65/61/37/632656137.db2.gz IIKOUQDZLRKGEC-QMMMGPOBSA-N 1 2 229.217 2.046 20 0 BEADLO CCc1cc(NCCOCC2CC2)nc(CC)[nH+]1 ZINC000892417404 632660985 /nfs/dbraw/zinc/66/09/85/632660985.db2.gz CBQBSOGDXDVOAW-UHFFFAOYSA-N 1 2 249.358 2.440 20 0 BEADLO C#CC[N@@H+](Cc1nc(CC)no1)C1CCCCC1 ZINC000065960290 632810017 /nfs/dbraw/zinc/81/00/17/632810017.db2.gz MSWUASXKQJRXAU-UHFFFAOYSA-N 1 2 247.342 2.400 20 0 BEADLO C#CC[N@H+](Cc1nc(CC)no1)C1CCCCC1 ZINC000065960290 632810019 /nfs/dbraw/zinc/81/00/19/632810019.db2.gz MSWUASXKQJRXAU-UHFFFAOYSA-N 1 2 247.342 2.400 20 0 BEADLO Cc1nc(C[NH2+][C@H](C)c2cnccn2)sc1C ZINC000153884129 632825741 /nfs/dbraw/zinc/82/57/41/632825741.db2.gz OYQHMGRPCJFBME-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO C[C@H]1C[N@H+](C/C(Cl)=C/Cl)CCCO1 ZINC000177728487 632868954 /nfs/dbraw/zinc/86/89/54/632868954.db2.gz IIRFJPPOIZVYOW-HXOPTJOXSA-N 1 2 224.131 2.416 20 0 BEADLO C[C@H]1C[N@@H+](C/C(Cl)=C/Cl)CCCO1 ZINC000177728487 632868956 /nfs/dbraw/zinc/86/89/56/632868956.db2.gz IIRFJPPOIZVYOW-HXOPTJOXSA-N 1 2 224.131 2.416 20 0 BEADLO Cc1n[nH]c(C[N@H+]2CC[C@H](C)[C@@H](F)C2)c1C ZINC000894415921 635896785 /nfs/dbraw/zinc/89/67/85/635896785.db2.gz QRJSAZYNXNJITL-KWQFWETISA-N 1 2 225.311 2.206 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)c1C ZINC000894415921 635896788 /nfs/dbraw/zinc/89/67/88/635896788.db2.gz QRJSAZYNXNJITL-KWQFWETISA-N 1 2 225.311 2.206 20 0 BEADLO FC1(F)CC([NH2+][C@H]2CCCc3[nH]ncc32)C1 ZINC000309470063 633118220 /nfs/dbraw/zinc/11/82/20/633118220.db2.gz AJCSPGWJZQJWFQ-VIFPVBQESA-N 1 2 227.258 2.174 20 0 BEADLO C[C@@H]1C[N@H+](Cn2cccnc2=S)CCS1 ZINC000171605754 633203496 /nfs/dbraw/zinc/20/34/96/633203496.db2.gz GNDLBDNOXVSJIS-SECBINFHSA-N 1 2 241.385 2.007 20 0 BEADLO C[C@@H]1C[N@@H+](Cn2cccnc2=S)CCS1 ZINC000171605754 633203503 /nfs/dbraw/zinc/20/35/03/633203503.db2.gz GNDLBDNOXVSJIS-SECBINFHSA-N 1 2 241.385 2.007 20 0 BEADLO CN(C)c1cc(F)cc(NCc2c[nH+]cn2C)c1 ZINC000895173282 636115789 /nfs/dbraw/zinc/11/57/89/636115789.db2.gz YPLOGIVPGSIOOQ-UHFFFAOYSA-N 1 2 248.305 2.237 20 0 BEADLO Cc1ccc(F)c(C[N@@H+](C)C2(CO)CC2)c1F ZINC000930464856 633839485 /nfs/dbraw/zinc/83/94/85/633839485.db2.gz KFGCXTGJFZUBSU-UHFFFAOYSA-N 1 2 241.281 2.230 20 0 BEADLO Cc1ccc(F)c(C[N@H+](C)C2(CO)CC2)c1F ZINC000930464856 633839490 /nfs/dbraw/zinc/83/94/90/633839490.db2.gz KFGCXTGJFZUBSU-UHFFFAOYSA-N 1 2 241.281 2.230 20 0 BEADLO Cc1cccc(F)c1C[NH2+]Cc1cnc[nH]1 ZINC000309688965 633988971 /nfs/dbraw/zinc/98/89/71/633988971.db2.gz ILJGYGWNXJXAGN-UHFFFAOYSA-N 1 2 219.263 2.147 20 0 BEADLO CCC[C@@](C)([NH2+]C[C@H]1CCC=CO1)C(=O)OC ZINC000194174967 634308375 /nfs/dbraw/zinc/30/83/75/634308375.db2.gz RIGUDMHEKFIDQR-DGCLKSJQSA-N 1 2 241.331 2.001 20 0 BEADLO CCc1cc(NCCCCCO)nc(CC)[nH+]1 ZINC000893571489 635172962 /nfs/dbraw/zinc/17/29/62/635172962.db2.gz LSRHZFSWUKFKLG-UHFFFAOYSA-N 1 2 237.347 2.176 20 0 BEADLO CC(C)=CC(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000064441251 635347004 /nfs/dbraw/zinc/34/70/04/635347004.db2.gz KZKRPXCGMZJFCL-GFCCVEGCSA-N 1 2 249.358 2.380 20 0 BEADLO C[N@H+](Cc1cccnc1)Cc1cnc(Cl)cn1 ZINC000231276703 635497831 /nfs/dbraw/zinc/49/78/31/635497831.db2.gz ZAODCPWHQXZPFK-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[N@@H+](Cc1cccnc1)Cc1cnc(Cl)cn1 ZINC000231276703 635497836 /nfs/dbraw/zinc/49/78/36/635497836.db2.gz ZAODCPWHQXZPFK-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO CN(C)c1cc(N[C@@H]2C[C@H]2c2ccco2)[nH+]cn1 ZINC000894225232 635757523 /nfs/dbraw/zinc/75/75/23/635757523.db2.gz WQMOHFYQLFZXKM-NXEZZACHSA-N 1 2 244.298 2.104 20 0 BEADLO CN(C)c1cc(N[C@@H]2C[C@H]2c2ccco2)nc[nH+]1 ZINC000894225232 635757525 /nfs/dbraw/zinc/75/75/25/635757525.db2.gz WQMOHFYQLFZXKM-NXEZZACHSA-N 1 2 244.298 2.104 20 0 BEADLO CO[C@@H](C[NH2+][C@H](C)C(F)F)Cc1ccccc1 ZINC000895725733 636174654 /nfs/dbraw/zinc/17/46/54/636174654.db2.gz SEWBLJZCZKBDCG-ZYHUDNBSSA-N 1 2 243.297 2.487 20 0 BEADLO CC(C)(C)c1cn(CCc2cnoc2)c[nH+]1 ZINC000865376123 636813074 /nfs/dbraw/zinc/81/30/74/636813074.db2.gz ACPGMUYNIDUNGI-UHFFFAOYSA-N 1 2 219.288 2.411 20 0 BEADLO CC(C)(CNC(=O)C1=CCCCC1)n1cc[nH+]c1 ZINC000898907779 637064578 /nfs/dbraw/zinc/06/45/78/637064578.db2.gz ZMPCEFGNSMMAAA-UHFFFAOYSA-N 1 2 247.342 2.235 20 0 BEADLO CC(C)(CNC(=O)C1CC(C)(C)C1)n1cc[nH+]c1 ZINC000898909189 637064719 /nfs/dbraw/zinc/06/47/19/637064719.db2.gz JOZKLVHKNBRKRZ-UHFFFAOYSA-N 1 2 249.358 2.171 20 0 BEADLO CC[C@H](C)CC(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000898907564 637064859 /nfs/dbraw/zinc/06/48/59/637064859.db2.gz UNEYABNZGLXRTR-NSHDSACASA-N 1 2 237.347 2.171 20 0 BEADLO CC(C)CCCNC(=O)CNc1cccc[nH+]1 ZINC000900136799 637172628 /nfs/dbraw/zinc/17/26/28/637172628.db2.gz RVFYWZNUSURPTO-UHFFFAOYSA-N 1 2 235.331 2.046 20 0 BEADLO CN(C(=O)Cc1c[nH+]c[nH]1)C1CCC(C)(C)CC1 ZINC000901009106 637219163 /nfs/dbraw/zinc/21/91/63/637219163.db2.gz NNKPAEJYAKNEPW-UHFFFAOYSA-N 1 2 249.358 2.379 20 0 BEADLO Nc1ccc(Cn2ncc(Cl)c2C2CC2)c[nH+]1 ZINC000902579619 637310550 /nfs/dbraw/zinc/31/05/50/637310550.db2.gz NYXQYKFBPJYJIS-UHFFFAOYSA-N 1 2 248.717 2.439 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2C[C@@H]3CCCC[C@H]23)n1 ZINC000904500997 637427075 /nfs/dbraw/zinc/42/70/75/637427075.db2.gz QWLBEMMQKKZBFN-GARJFASQSA-N 1 2 235.331 2.473 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2C[C@@H]3C[C@@H]3C[C@H]2C)n1 ZINC000904501130 637429304 /nfs/dbraw/zinc/42/93/04/637429304.db2.gz UVKJULMNPLSCFS-VPOLOUISSA-N 1 2 235.331 2.329 20 0 BEADLO Cc1cc(C)c(C(=O)NCC(C)C)c(C)[nH+]1 ZINC000905069913 637601211 /nfs/dbraw/zinc/60/12/11/637601211.db2.gz BVZXMDYBUBEHBM-UHFFFAOYSA-N 1 2 220.316 2.393 20 0 BEADLO Cc1cc(C)c(C(=O)NC[C@H]2C[C@@H]2C)c(C)[nH+]1 ZINC000906165002 638080883 /nfs/dbraw/zinc/08/08/83/638080883.db2.gz YMXIDXIKHRXDPM-QPUJVOFHSA-N 1 2 232.327 2.393 20 0 BEADLO Cc1cc(C)c(C(=O)N(C)C2CC2)c(C)[nH+]1 ZINC000906419888 638164687 /nfs/dbraw/zinc/16/46/87/638164687.db2.gz KIHSGEXLDDVOJH-UHFFFAOYSA-N 1 2 218.300 2.241 20 0 BEADLO CCCC[NH2+]c1ccc(N(C)CCO)cc1 ZINC000906527282 638191275 /nfs/dbraw/zinc/19/12/75/638191275.db2.gz OTOCFTMSLMKOJJ-UHFFFAOYSA-N 1 2 222.332 2.327 20 0 BEADLO C[C@H]1C[N@@H+]([C@H]2C[C@@H]2c2cccc(F)c2)CCO1 ZINC000906590410 638215187 /nfs/dbraw/zinc/21/51/87/638215187.db2.gz QJECXBIHOVIFMF-GDLCADMTSA-N 1 2 235.302 2.402 20 0 BEADLO C[C@H]1C[N@H+]([C@H]2C[C@@H]2c2cccc(F)c2)CCO1 ZINC000906590410 638215190 /nfs/dbraw/zinc/21/51/90/638215190.db2.gz QJECXBIHOVIFMF-GDLCADMTSA-N 1 2 235.302 2.402 20 0 BEADLO C[C@@H]1C[N@@H+]([C@H]2C[C@@H]2c2cccc(F)c2)CCO1 ZINC000906584794 638220449 /nfs/dbraw/zinc/22/04/49/638220449.db2.gz QJECXBIHOVIFMF-HONMWMINSA-N 1 2 235.302 2.402 20 0 BEADLO C[C@@H]1C[N@H+]([C@H]2C[C@@H]2c2cccc(F)c2)CCO1 ZINC000906584794 638220451 /nfs/dbraw/zinc/22/04/51/638220451.db2.gz QJECXBIHOVIFMF-HONMWMINSA-N 1 2 235.302 2.402 20 0 BEADLO Cc1cc(NC(=O)C2(C3CC3)CCC2)cc[nH+]1 ZINC000906661311 638233576 /nfs/dbraw/zinc/23/35/76/638233576.db2.gz NZLIHPZEZMIXHA-UHFFFAOYSA-N 1 2 230.311 2.331 20 0 BEADLO Cc1cc(C)c(C(=O)NC2CC=CC2)c(C)[nH+]1 ZINC000906990086 638287052 /nfs/dbraw/zinc/28/70/52/638287052.db2.gz FMXCMDKBTHIDEK-UHFFFAOYSA-N 1 2 230.311 2.455 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)[C@@H]1CCC=CCCC1 ZINC000908258688 638626267 /nfs/dbraw/zinc/62/62/67/638626267.db2.gz GUNVGSDKLKYCLR-GFCCVEGCSA-N 1 2 247.342 2.173 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)[C@H]1CCC=CCCC1 ZINC000908258690 638626935 /nfs/dbraw/zinc/62/69/35/638626935.db2.gz GUNVGSDKLKYCLR-LBPRGKRZSA-N 1 2 247.342 2.173 20 0 BEADLO CCN(C(=O)CNc1cccc[nH+]1)[C@H](C)C(C)C ZINC000908273960 638628420 /nfs/dbraw/zinc/62/84/20/638628420.db2.gz HMAZRNOTORWIPZ-GFCCVEGCSA-N 1 2 249.358 2.387 20 0 BEADLO CC1CC(COC(=O)CCc2ccc(N)[nH+]c2)C1 ZINC000909100044 639143796 /nfs/dbraw/zinc/14/37/96/639143796.db2.gz LQEOQWREAMZONG-UHFFFAOYSA-N 1 2 248.326 2.186 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)N1CCCCCCCC1 ZINC000909201512 639170513 /nfs/dbraw/zinc/17/05/13/639170513.db2.gz DRDHASHTTXASTM-UHFFFAOYSA-N 1 2 235.331 2.135 20 0 BEADLO Cc1cc(C)c(C(=O)N[C@H]2CC23CC3)c(C)[nH+]1 ZINC000911297358 639614412 /nfs/dbraw/zinc/61/44/12/639614412.db2.gz ZPZBFDVRXLHCHB-NSHDSACASA-N 1 2 230.311 2.289 20 0 BEADLO CC1(C)C(C)(C)C1(C)C(=O)NCCn1cc[nH+]c1 ZINC000930221184 639641596 /nfs/dbraw/zinc/64/15/96/639641596.db2.gz GWWOIZZIPNXHSQ-UHFFFAOYSA-N 1 2 249.358 2.072 20 0 BEADLO C[C@H]1CC[N@H+](Cc2cnn(CCF)c2)C[C@H]1F ZINC000930243550 639651352 /nfs/dbraw/zinc/65/13/52/639651352.db2.gz GGOAIOZPPMZWEX-CMPLNLGQSA-N 1 2 243.301 2.033 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2cnn(CCF)c2)C[C@H]1F ZINC000930243550 639651357 /nfs/dbraw/zinc/65/13/57/639651357.db2.gz GGOAIOZPPMZWEX-CMPLNLGQSA-N 1 2 243.301 2.033 20 0 BEADLO Fc1cccc(CC[N@@H+]2CCOCC23CC3)c1 ZINC000930361297 639730532 /nfs/dbraw/zinc/73/05/32/639730532.db2.gz XNEOTZKTAZRUER-UHFFFAOYSA-N 1 2 235.302 2.233 20 0 BEADLO Fc1cccc(CC[N@H+]2CCOCC23CC3)c1 ZINC000930361297 639730542 /nfs/dbraw/zinc/73/05/42/639730542.db2.gz XNEOTZKTAZRUER-UHFFFAOYSA-N 1 2 235.302 2.233 20 0 BEADLO CO[C@H](C)C[N@H+](C)Cc1coc(C(C)(C)C)n1 ZINC000930475976 639772054 /nfs/dbraw/zinc/77/20/54/639772054.db2.gz KRGAORIVKJXXTB-SNVBAGLBSA-N 1 2 240.347 2.439 20 0 BEADLO CO[C@H](C)C[N@@H+](C)Cc1coc(C(C)(C)C)n1 ZINC000930475976 639772062 /nfs/dbraw/zinc/77/20/62/639772062.db2.gz KRGAORIVKJXXTB-SNVBAGLBSA-N 1 2 240.347 2.439 20 0 BEADLO CC[C@H](CO)[N@@H+]1CCn2c(cc3ccccc32)C1 ZINC000930533858 639804864 /nfs/dbraw/zinc/80/48/64/639804864.db2.gz XYCRLWLBTMUZKM-CYBMUJFWSA-N 1 2 244.338 2.228 20 0 BEADLO CC[C@H](CO)[N@H+]1CCn2c(cc3ccccc32)C1 ZINC000930533858 639804868 /nfs/dbraw/zinc/80/48/68/639804868.db2.gz XYCRLWLBTMUZKM-CYBMUJFWSA-N 1 2 244.338 2.228 20 0 BEADLO Cc1cn(C)nc1C[N@@H+]1CCC[C@@](C)(F)C1 ZINC000930596141 639815630 /nfs/dbraw/zinc/81/56/30/639815630.db2.gz SEEKWNTZVCGUIA-GFCCVEGCSA-N 1 2 225.311 2.053 20 0 BEADLO Cc1cn(C)nc1C[N@H+]1CCC[C@@](C)(F)C1 ZINC000930596141 639815631 /nfs/dbraw/zinc/81/56/31/639815631.db2.gz SEEKWNTZVCGUIA-GFCCVEGCSA-N 1 2 225.311 2.053 20 0 BEADLO Cc1cc(C)nc(C[N@@H+](C(C)C)C2COC2)c1 ZINC000930596260 639815720 /nfs/dbraw/zinc/81/57/20/639815720.db2.gz UAKRLWFKOTXBPS-UHFFFAOYSA-N 1 2 234.343 2.308 20 0 BEADLO Cc1cc(C)nc(C[N@H+](C(C)C)C2COC2)c1 ZINC000930596260 639815721 /nfs/dbraw/zinc/81/57/21/639815721.db2.gz UAKRLWFKOTXBPS-UHFFFAOYSA-N 1 2 234.343 2.308 20 0 BEADLO F[C@@H]1CC[N@H+](C[C@H]2CC[C@@H](C(F)(F)F)O2)C1 ZINC000930604337 639817809 /nfs/dbraw/zinc/81/78/09/639817809.db2.gz XDKHSOAJTYRLHX-HLTSFMKQSA-N 1 2 241.228 2.140 20 0 BEADLO F[C@@H]1CC[N@@H+](C[C@H]2CC[C@@H](C(F)(F)F)O2)C1 ZINC000930604337 639817811 /nfs/dbraw/zinc/81/78/11/639817811.db2.gz XDKHSOAJTYRLHX-HLTSFMKQSA-N 1 2 241.228 2.140 20 0 BEADLO CS[C@H]1CC[N@H+](Cc2c(F)cncc2F)C1 ZINC000930611511 639821436 /nfs/dbraw/zinc/82/14/36/639821436.db2.gz VUBIJZLTUCUAEI-QMMMGPOBSA-N 1 2 244.310 2.297 20 0 BEADLO CS[C@H]1CC[N@@H+](Cc2c(F)cncc2F)C1 ZINC000930611511 639821439 /nfs/dbraw/zinc/82/14/39/639821439.db2.gz VUBIJZLTUCUAEI-QMMMGPOBSA-N 1 2 244.310 2.297 20 0 BEADLO C[C@H](CNC(=O)c1cc2c[nH+]ccc2[nH]1)C1CC1 ZINC000930644500 639841114 /nfs/dbraw/zinc/84/11/14/639841114.db2.gz SGXMNDOYCKFWQP-SECBINFHSA-N 1 2 243.310 2.339 20 0 BEADLO COc1nnc(C[N@@H+]2CC[C@@H](C)C[C@H]2C)s1 ZINC000930760101 639899939 /nfs/dbraw/zinc/89/99/39/639899939.db2.gz GHZSPGOSPFEKTQ-RKDXNWHRSA-N 1 2 241.360 2.167 20 0 BEADLO COc1nnc(C[N@H+]2CC[C@@H](C)C[C@H]2C)s1 ZINC000930760101 639899941 /nfs/dbraw/zinc/89/99/41/639899941.db2.gz GHZSPGOSPFEKTQ-RKDXNWHRSA-N 1 2 241.360 2.167 20 0 BEADLO COc1nnc(C[N@H+](C)CCC(C)(C)C)s1 ZINC000930819206 639920858 /nfs/dbraw/zinc/92/08/58/639920858.db2.gz UMLWBCCGIFFPPG-UHFFFAOYSA-N 1 2 243.376 2.415 20 0 BEADLO COc1nnc(C[N@@H+](C)CCC(C)(C)C)s1 ZINC000930819206 639920861 /nfs/dbraw/zinc/92/08/61/639920861.db2.gz UMLWBCCGIFFPPG-UHFFFAOYSA-N 1 2 243.376 2.415 20 0 BEADLO CCCN(C(=O)CNc1cccc[nH+]1)C(C)C ZINC000912047708 639933684 /nfs/dbraw/zinc/93/36/84/639933684.db2.gz NLFPLDWYXTXVHS-UHFFFAOYSA-N 1 2 235.331 2.141 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@@H](CC)OC[C@@H]2C)o1 ZINC000930851758 639946335 /nfs/dbraw/zinc/94/63/35/639946335.db2.gz JQWJKZLBCXXEGP-WDEREUQCSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@@H](CC)OC[C@@H]2C)o1 ZINC000930851758 639946342 /nfs/dbraw/zinc/94/63/42/639946342.db2.gz JQWJKZLBCXXEGP-WDEREUQCSA-N 1 2 238.331 2.236 20 0 BEADLO C=C/C=C\CC[NH2+][C@@]1(C)CC(C)(C)OC1=O ZINC000930876870 639967841 /nfs/dbraw/zinc/96/78/41/639967841.db2.gz ASRKINJWECOVTQ-FWWRYZNZSA-N 1 2 223.316 2.193 20 0 BEADLO CC[C@@H](C)[N@H+](CC)Cc1nnc(OC)s1 ZINC000930922150 639991080 /nfs/dbraw/zinc/99/10/80/639991080.db2.gz KPJZITMSNWJAIC-MRVPVSSYSA-N 1 2 229.349 2.167 20 0 BEADLO CC[C@@H](C)[N@@H+](CC)Cc1nnc(OC)s1 ZINC000930922150 639991083 /nfs/dbraw/zinc/99/10/83/639991083.db2.gz KPJZITMSNWJAIC-MRVPVSSYSA-N 1 2 229.349 2.167 20 0 BEADLO FCC[C@H]1CCC[N@H+](Cc2nncs2)C1 ZINC000931014822 640018963 /nfs/dbraw/zinc/01/89/63/640018963.db2.gz IQPVLQYEMFVATL-SECBINFHSA-N 1 2 229.324 2.110 20 0 BEADLO FCC[C@H]1CCC[N@@H+](Cc2nncs2)C1 ZINC000931014822 640018966 /nfs/dbraw/zinc/01/89/66/640018966.db2.gz IQPVLQYEMFVATL-SECBINFHSA-N 1 2 229.324 2.110 20 0 BEADLO FCCCCC[N@@H+]1CCC[C@H]1c1nnc[nH]1 ZINC000931140555 640076035 /nfs/dbraw/zinc/07/60/35/640076035.db2.gz OPZRQIUMCKDGOJ-JTQLQIEISA-N 1 2 226.299 2.081 20 0 BEADLO FCCCCC[N@H+]1CCC[C@H]1c1nnc[nH]1 ZINC000931140555 640076038 /nfs/dbraw/zinc/07/60/38/640076038.db2.gz OPZRQIUMCKDGOJ-JTQLQIEISA-N 1 2 226.299 2.081 20 0 BEADLO CC(C)(C)/C=C/C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000912615019 640138719 /nfs/dbraw/zinc/13/87/19/640138719.db2.gz HVIACOLZVWSEDF-VOTSOKGWSA-N 1 2 249.358 2.337 20 0 BEADLO CNc1cc(N2CC[C@H](C(C)(C)C)C2)nc[nH+]1 ZINC000163693555 640409264 /nfs/dbraw/zinc/40/92/64/640409264.db2.gz LXCSXSHDWFAPMV-JTQLQIEISA-N 1 2 234.347 2.391 20 0 BEADLO CNc1cc(N2CC[C@H](C(C)(C)C)C2)[nH+]cn1 ZINC000163693555 640409268 /nfs/dbraw/zinc/40/92/68/640409268.db2.gz LXCSXSHDWFAPMV-JTQLQIEISA-N 1 2 234.347 2.391 20 0 BEADLO Cn1nccc1[C@@H]1CCC[N@@H+]1Cc1cncs1 ZINC000932262920 640462360 /nfs/dbraw/zinc/46/23/60/640462360.db2.gz XTZVVLLIDZFGRS-LBPRGKRZSA-N 1 2 248.355 2.214 20 0 BEADLO Cn1nccc1[C@@H]1CCC[N@H+]1Cc1cncs1 ZINC000932262920 640462366 /nfs/dbraw/zinc/46/23/66/640462366.db2.gz XTZVVLLIDZFGRS-LBPRGKRZSA-N 1 2 248.355 2.214 20 0 BEADLO Cn1nccc1[C@H]1CCC[N@@H+]1Cc1ccns1 ZINC000932262117 640463309 /nfs/dbraw/zinc/46/33/09/640463309.db2.gz MEFALJIQEPZJDN-GFCCVEGCSA-N 1 2 248.355 2.214 20 0 BEADLO Cn1nccc1[C@H]1CCC[N@H+]1Cc1ccns1 ZINC000932262117 640463317 /nfs/dbraw/zinc/46/33/17/640463317.db2.gz MEFALJIQEPZJDN-GFCCVEGCSA-N 1 2 248.355 2.214 20 0 BEADLO CCC[N@@H+]1CCOC[C@H]1c1ccc(COC)o1 ZINC000932322631 640474792 /nfs/dbraw/zinc/47/47/92/640474792.db2.gz HADPVRLRWSHEJU-LBPRGKRZSA-N 1 2 239.315 2.209 20 0 BEADLO CCC[N@H+]1CCOC[C@H]1c1ccc(COC)o1 ZINC000932322631 640474796 /nfs/dbraw/zinc/47/47/96/640474796.db2.gz HADPVRLRWSHEJU-LBPRGKRZSA-N 1 2 239.315 2.209 20 0 BEADLO C[C@H]1CC[N@H+](Cc2scnc2Cl)CCO1 ZINC000932334748 640475094 /nfs/dbraw/zinc/47/50/94/640475094.db2.gz DKCDNZDEGSGGOZ-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2scnc2Cl)CCO1 ZINC000932334748 640475097 /nfs/dbraw/zinc/47/50/97/640475097.db2.gz DKCDNZDEGSGGOZ-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO CC(C)c1cnc(C[N@@H+]2CCO[C@H](C)CC2)o1 ZINC000932334687 640476477 /nfs/dbraw/zinc/47/64/77/640476477.db2.gz CJLUAMMQDOEUTO-LLVKDONJSA-N 1 2 238.331 2.409 20 0 BEADLO CC(C)c1cnc(C[N@H+]2CCO[C@H](C)CC2)o1 ZINC000932334687 640476481 /nfs/dbraw/zinc/47/64/81/640476481.db2.gz CJLUAMMQDOEUTO-LLVKDONJSA-N 1 2 238.331 2.409 20 0 BEADLO CC(C)n1ccc(C[N@@H+]2CCO[C@H](C)CC2)n1 ZINC000932345681 640488517 /nfs/dbraw/zinc/48/85/17/640488517.db2.gz OCCKYDDQWJMKDR-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccc(C[N@H+]2CCO[C@H](C)CC2)n1 ZINC000932345681 640488521 /nfs/dbraw/zinc/48/85/21/640488521.db2.gz OCCKYDDQWJMKDR-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO CNc1cc(N[C@H](C)c2c(C)noc2C)nc[nH+]1 ZINC000156818332 640508808 /nfs/dbraw/zinc/50/88/08/640508808.db2.gz KECHFGFJAPJAGT-SSDOTTSWSA-N 1 2 247.302 2.296 20 0 BEADLO CNc1cc(N[C@H](C)c2c(C)noc2C)[nH+]cn1 ZINC000156818332 640508815 /nfs/dbraw/zinc/50/88/15/640508815.db2.gz KECHFGFJAPJAGT-SSDOTTSWSA-N 1 2 247.302 2.296 20 0 BEADLO Fc1cncc(F)c1C[N@@H+]1CCn2cccc2C1 ZINC000932527493 640571328 /nfs/dbraw/zinc/57/13/28/640571328.db2.gz XVRPBMYQYBXZMW-UHFFFAOYSA-N 1 2 249.264 2.177 20 0 BEADLO Fc1cncc(F)c1C[N@H+]1CCn2cccc2C1 ZINC000932527493 640571334 /nfs/dbraw/zinc/57/13/34/640571334.db2.gz XVRPBMYQYBXZMW-UHFFFAOYSA-N 1 2 249.264 2.177 20 0 BEADLO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1cnon1 ZINC000932559581 640574696 /nfs/dbraw/zinc/57/46/96/640574696.db2.gz KGXYGQMILHKTHX-SECBINFHSA-N 1 2 235.262 2.368 20 0 BEADLO CC(C)=CC[NH+]1CC(NC(=O)C[C@@H]2C=CCC2)C1 ZINC001030088108 640584129 /nfs/dbraw/zinc/58/41/29/640584129.db2.gz CFUHMGUNMVRNKT-CYBMUJFWSA-N 1 2 248.370 2.109 20 0 BEADLO CC(C)=CC[NH+]1CC(NC(=O)C[C@H]2C=CCC2)C1 ZINC001030088109 640585113 /nfs/dbraw/zinc/58/51/13/640585113.db2.gz CFUHMGUNMVRNKT-ZDUSSCGKSA-N 1 2 248.370 2.109 20 0 BEADLO C[C@@]1(C(=O)NCCCCn2cc[nH+]c2)C=CCC1 ZINC000932717979 640603715 /nfs/dbraw/zinc/60/37/15/640603715.db2.gz KVYCGXJIZJLCAV-CQSZACIVSA-N 1 2 247.342 2.136 20 0 BEADLO O=C(C[C@H]1CC=CCC1)N1CC(n2cc[nH+]c2)C1 ZINC000932827808 640613900 /nfs/dbraw/zinc/61/39/00/640613900.db2.gz ZVDAVWVSRALXLZ-LBPRGKRZSA-N 1 2 245.326 2.013 20 0 BEADLO COc1cc([NH2+]C[C@H]2C[C@@H]2C)ccc1N ZINC000166747642 640669308 /nfs/dbraw/zinc/66/93/08/640669308.db2.gz WMTXIQGARUQFGU-DTWKUNHWSA-N 1 2 206.289 2.345 20 0 BEADLO Cl/C=C\C[N@@H+]1CCOC[C@@H]1C[C@@H]1CCCO1 ZINC000933669404 640741127 /nfs/dbraw/zinc/74/11/27/640741127.db2.gz CAYOCKIUSCIAJG-YLQALMJQSA-N 1 2 245.750 2.009 20 0 BEADLO Cl/C=C\C[N@H+]1CCOC[C@@H]1C[C@@H]1CCCO1 ZINC000933669404 640741131 /nfs/dbraw/zinc/74/11/31/640741131.db2.gz CAYOCKIUSCIAJG-YLQALMJQSA-N 1 2 245.750 2.009 20 0 BEADLO Cc1cc(C[NH2+][C@@H]2CCc3cccnc32)on1 ZINC000226818043 640794360 /nfs/dbraw/zinc/79/43/60/640794360.db2.gz QXMKFZKTZPJKAD-GFCCVEGCSA-N 1 2 229.283 2.155 20 0 BEADLO C[C@@H]([NH2+]C1(C)CCC1)C(=O)OC(C)(C)C ZINC000228851446 640900153 /nfs/dbraw/zinc/90/01/53/640900153.db2.gz FRAJTDDCAZSLQJ-SECBINFHSA-N 1 2 213.321 2.249 20 0 BEADLO CCC[C@@H]1CCC[C@H]1C(=O)NC1C[NH+](CC)C1 ZINC001030568572 640920783 /nfs/dbraw/zinc/92/07/83/640920783.db2.gz FQUGRNFEQPXHAU-DGCLKSJQSA-N 1 2 238.375 2.023 20 0 BEADLO CCOC(C[NH2+][C@@H](C)c1cscn1)OCC ZINC000229131040 640924722 /nfs/dbraw/zinc/92/47/22/640924722.db2.gz JCELGXITJVGINJ-VIFPVBQESA-N 1 2 244.360 2.193 20 0 BEADLO CC[NH2+]Cc1noc(C2(c3ccccc3)CC2)n1 ZINC000061618608 640977289 /nfs/dbraw/zinc/97/72/89/640977289.db2.gz NOTLZCVBNFXNMA-UHFFFAOYSA-N 1 2 243.310 2.259 20 0 BEADLO CCCNc1cc(NC2CCC2)nc[nH+]1 ZINC000087827116 641058986 /nfs/dbraw/zinc/05/89/86/641058986.db2.gz PWLKWKQWQOHZDK-UHFFFAOYSA-N 1 2 206.293 2.263 20 0 BEADLO CCCNc1cc(NC2CCC2)[nH+]cn1 ZINC000087827116 641058991 /nfs/dbraw/zinc/05/89/91/641058991.db2.gz PWLKWKQWQOHZDK-UHFFFAOYSA-N 1 2 206.293 2.263 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@H+](C)C/C(Cl)=C\Cl ZINC000934113542 641077057 /nfs/dbraw/zinc/07/70/57/641077057.db2.gz BITAXJPEPUAQEA-LKJMDQPVSA-N 1 2 224.131 2.415 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@@H+](C)C/C(Cl)=C\Cl ZINC000934113542 641077058 /nfs/dbraw/zinc/07/70/58/641077058.db2.gz BITAXJPEPUAQEA-LKJMDQPVSA-N 1 2 224.131 2.415 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@H+](C)Cc1ncc(Cl)s1 ZINC000934114292 641079468 /nfs/dbraw/zinc/07/94/68/641079468.db2.gz SAHSUMUKOULBKK-JGVFFNPUSA-N 1 2 246.763 2.406 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@@H+](C)Cc1ncc(Cl)s1 ZINC000934114292 641079477 /nfs/dbraw/zinc/07/94/77/641079477.db2.gz SAHSUMUKOULBKK-JGVFFNPUSA-N 1 2 246.763 2.406 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@H+](C)Cc1ncc(C2CC2)o1 ZINC000934114637 641080816 /nfs/dbraw/zinc/08/08/16/641080816.db2.gz KTEOGPOZBKRJTO-GHMZBOCLSA-N 1 2 236.315 2.161 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@@H+](C)Cc1ncc(C2CC2)o1 ZINC000934114637 641080823 /nfs/dbraw/zinc/08/08/23/641080823.db2.gz KTEOGPOZBKRJTO-GHMZBOCLSA-N 1 2 236.315 2.161 20 0 BEADLO Cc1ccc(F)c(C[N@@H+]2CCCOCC2)c1F ZINC000929408963 641103769 /nfs/dbraw/zinc/10/37/69/641103769.db2.gz ADIIXINSIRWNMA-UHFFFAOYSA-N 1 2 241.281 2.496 20 0 BEADLO Cc1ccc(F)c(C[N@H+]2CCCOCC2)c1F ZINC000929408963 641103772 /nfs/dbraw/zinc/10/37/72/641103772.db2.gz ADIIXINSIRWNMA-UHFFFAOYSA-N 1 2 241.281 2.496 20 0 BEADLO COc1nnc(C[N@H+](C)CC2CCCC2)s1 ZINC000929410761 641121203 /nfs/dbraw/zinc/12/12/03/641121203.db2.gz BGIKYLACBHVMTI-UHFFFAOYSA-N 1 2 241.360 2.169 20 0 BEADLO COc1nnc(C[N@@H+](C)CC2CCCC2)s1 ZINC000929410761 641121208 /nfs/dbraw/zinc/12/12/08/641121208.db2.gz BGIKYLACBHVMTI-UHFFFAOYSA-N 1 2 241.360 2.169 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccsc2)CCC1=O ZINC000063152932 641141054 /nfs/dbraw/zinc/14/10/54/641141054.db2.gz PBIWZBXMMBBMJX-VIFPVBQESA-N 1 2 209.314 2.159 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccsc2)CCC1=O ZINC000063152932 641141060 /nfs/dbraw/zinc/14/10/60/641141060.db2.gz PBIWZBXMMBBMJX-VIFPVBQESA-N 1 2 209.314 2.159 20 0 BEADLO Cc1nn(C[N@H+]2CCC[C@H]2C)c(=S)s1 ZINC000173526330 641182098 /nfs/dbraw/zinc/18/20/98/641182098.db2.gz OKFVGKBICSCLFT-SSDOTTSWSA-N 1 2 229.374 2.424 20 0 BEADLO Cc1nn(C[N@@H+]2CCC[C@H]2C)c(=S)s1 ZINC000173526330 641182104 /nfs/dbraw/zinc/18/21/04/641182104.db2.gz OKFVGKBICSCLFT-SSDOTTSWSA-N 1 2 229.374 2.424 20 0 BEADLO Cc1nonc1C[NH2+][C@H](c1ccncc1)C1CC1 ZINC000934695028 641248854 /nfs/dbraw/zinc/24/88/54/641248854.db2.gz KTXXSJSFESEQAB-ZDUSSCGKSA-N 1 2 244.298 2.014 20 0 BEADLO c1cnc(C[NH2+][C@@H](c2ccncc2)C2CC2)nc1 ZINC000934700098 641251489 /nfs/dbraw/zinc/25/14/89/641251489.db2.gz ZPSGJPOREXFVDH-CQSZACIVSA-N 1 2 240.310 2.113 20 0 BEADLO c1cnc(C[NH2+][C@H](c2ccncc2)C2CC2)nc1 ZINC000934700096 641252090 /nfs/dbraw/zinc/25/20/90/641252090.db2.gz ZPSGJPOREXFVDH-AWEZNQCLSA-N 1 2 240.310 2.113 20 0 BEADLO CCCOC(=O)[C@H](C)[N@@H+]1CCS[C@H](CC)C1 ZINC000174357218 641279389 /nfs/dbraw/zinc/27/93/89/641279389.db2.gz SRFSFTQPMMKVQC-WDEREUQCSA-N 1 2 245.388 2.156 20 0 BEADLO CCCOC(=O)[C@H](C)[N@H+]1CCS[C@H](CC)C1 ZINC000174357218 641279397 /nfs/dbraw/zinc/27/93/97/641279397.db2.gz SRFSFTQPMMKVQC-WDEREUQCSA-N 1 2 245.388 2.156 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)[C@@]1(C)C=CCC1 ZINC000934913112 641300329 /nfs/dbraw/zinc/30/03/29/641300329.db2.gz UXFQOCAOLSKIMT-AWEZNQCLSA-N 1 2 247.342 2.088 20 0 BEADLO CN(CCC1CC1)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000935011798 641317133 /nfs/dbraw/zinc/31/71/33/641317133.db2.gz TTWPMGZSDFCJFK-UHFFFAOYSA-N 1 2 243.310 2.435 20 0 BEADLO CC1(NC(=O)c2cc3c[nH+]ccc3[nH]2)CCC1 ZINC000935081018 641332927 /nfs/dbraw/zinc/33/29/27/641332927.db2.gz VYEPOUHIEYYFPP-UHFFFAOYSA-N 1 2 229.283 2.235 20 0 BEADLO CC(C)OCCCc1noc([C@H](C)[NH+](C)C)n1 ZINC000350609759 641371572 /nfs/dbraw/zinc/37/15/72/641371572.db2.gz WTWCSHGXYYFNLB-JTQLQIEISA-N 1 2 241.335 2.050 20 0 BEADLO Cc1ccc(F)c(C[N@@H+](C)[C@H]2CCOC2)c1F ZINC000929602159 641374543 /nfs/dbraw/zinc/37/45/43/641374543.db2.gz UYCJRYLDZGWJED-JTQLQIEISA-N 1 2 241.281 2.494 20 0 BEADLO Cc1ccc(F)c(C[N@H+](C)[C@H]2CCOC2)c1F ZINC000929602159 641374544 /nfs/dbraw/zinc/37/45/44/641374544.db2.gz UYCJRYLDZGWJED-JTQLQIEISA-N 1 2 241.281 2.494 20 0 BEADLO Cc1cccc([C@H](O)C[N@@H+](C)Cc2ccon2)c1 ZINC000929694493 641400940 /nfs/dbraw/zinc/40/09/40/641400940.db2.gz BBSLMSGJWROLTF-CQSZACIVSA-N 1 2 246.310 2.148 20 0 BEADLO Cc1cccc([C@H](O)C[N@H+](C)Cc2ccon2)c1 ZINC000929694493 641400944 /nfs/dbraw/zinc/40/09/44/641400944.db2.gz BBSLMSGJWROLTF-CQSZACIVSA-N 1 2 246.310 2.148 20 0 BEADLO C[N@H+](CCSc1ccncc1)Cc1ccon1 ZINC000929697961 641404601 /nfs/dbraw/zinc/40/46/01/641404601.db2.gz WWFZVTRKUFCGEJ-UHFFFAOYSA-N 1 2 249.339 2.294 20 0 BEADLO C[N@@H+](CCSc1ccncc1)Cc1ccon1 ZINC000929697961 641404610 /nfs/dbraw/zinc/40/46/10/641404610.db2.gz WWFZVTRKUFCGEJ-UHFFFAOYSA-N 1 2 249.339 2.294 20 0 BEADLO CCC[C@H](C)NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000929718060 641417788 /nfs/dbraw/zinc/41/77/88/641417788.db2.gz NCYCIMQBTBEQQW-VIFPVBQESA-N 1 2 231.299 2.481 20 0 BEADLO COc1ccc(Cn2cc[nH+]c2)cc1C ZINC000041211133 641543617 /nfs/dbraw/zinc/54/36/17/641543617.db2.gz GZHGCFWBBRYSHG-UHFFFAOYSA-N 1 2 202.257 2.248 20 0 BEADLO Clc1cncc(NCCNc2cccc[nH+]2)n1 ZINC000043534927 641565181 /nfs/dbraw/zinc/56/51/81/641565181.db2.gz GFWSFMDJHLNTRR-UHFFFAOYSA-N 1 2 249.705 2.049 20 0 BEADLO CC[C@@H](C)C(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC000152590469 641621689 /nfs/dbraw/zinc/62/16/89/641621689.db2.gz DHPKIMVJCZPZMP-SECBINFHSA-N 1 2 235.331 2.441 20 0 BEADLO Cc1ccc(NC(=O)C2CC=CC2)c(N(C)C)[nH+]1 ZINC000152621369 641622632 /nfs/dbraw/zinc/62/26/32/641622632.db2.gz FPUBEBDWJZYDEH-UHFFFAOYSA-N 1 2 245.326 2.361 20 0 BEADLO CNc1cc(N(C)Cc2ccoc2C)nc[nH+]1 ZINC000130286381 641700185 /nfs/dbraw/zinc/70/01/85/641700185.db2.gz ZMQQOCJUTRJZLN-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO CNc1cc(N(C)Cc2ccoc2C)[nH+]cn1 ZINC000130286381 641700190 /nfs/dbraw/zinc/70/01/90/641700190.db2.gz ZMQQOCJUTRJZLN-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO CC(C)COC(=O)[C@H](C)[NH2+][C@@H]1CCCSC1 ZINC000187904510 641731454 /nfs/dbraw/zinc/73/14/54/641731454.db2.gz JLSSMTHCASCATP-WDEREUQCSA-N 1 2 245.388 2.059 20 0 BEADLO C[C@@H]1CCSCC[N@@H+]1Cn1cc(Cl)cn1 ZINC000189912685 641825337 /nfs/dbraw/zinc/82/53/37/641825337.db2.gz XDJMESBQOMLWCX-SECBINFHSA-N 1 2 245.779 2.321 20 0 BEADLO C[C@@H]1CCSCC[N@H+]1Cn1cc(Cl)cn1 ZINC000189912685 641825339 /nfs/dbraw/zinc/82/53/39/641825339.db2.gz XDJMESBQOMLWCX-SECBINFHSA-N 1 2 245.779 2.321 20 0 BEADLO Cc1nc(C[NH2+][C@@H](C)c2cnccn2)sc1C ZINC000153884024 641916259 /nfs/dbraw/zinc/91/62/59/641916259.db2.gz OYQHMGRPCJFBME-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO C[C@H]1CC[N@H+](Cn2cc(Cl)cn2)CCS1 ZINC000191668016 641936756 /nfs/dbraw/zinc/93/67/56/641936756.db2.gz PMLJRIKZIUZWOA-VIFPVBQESA-N 1 2 245.779 2.321 20 0 BEADLO C[C@H]1CC[N@@H+](Cn2cc(Cl)cn2)CCS1 ZINC000191668016 641936760 /nfs/dbraw/zinc/93/67/60/641936760.db2.gz PMLJRIKZIUZWOA-VIFPVBQESA-N 1 2 245.779 2.321 20 0 BEADLO Nc1ccc(CSc2nc3c([nH]2)CCC3)c[nH+]1 ZINC000917759471 642116512 /nfs/dbraw/zinc/11/65/12/642116512.db2.gz HDSZWDXNDHUBMS-UHFFFAOYSA-N 1 2 246.339 2.168 20 0 BEADLO Cc1nc(SCc2ccc(N)[nH+]c2)[nH]c1C ZINC000917772070 642119751 /nfs/dbraw/zinc/11/97/51/642119751.db2.gz NNPHSXPOZQBPRB-UHFFFAOYSA-N 1 2 234.328 2.296 20 0 BEADLO CC[NH+]1CC(NC(=O)[C@H]2CCCC(C)(C)C2)C1 ZINC001031452513 642171358 /nfs/dbraw/zinc/17/13/58/642171358.db2.gz JNCUBHBQQUQMLV-NSHDSACASA-N 1 2 238.375 2.023 20 0 BEADLO Cc1noc([C@@H](CC(C)C)n2cc[nH+]c2)n1 ZINC000923760447 642302118 /nfs/dbraw/zinc/30/21/18/642302118.db2.gz LGINVNHEVLJWCQ-SNVBAGLBSA-N 1 2 220.276 2.210 20 0 BEADLO C[C@H](CCO)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000779423542 642338970 /nfs/dbraw/zinc/33/89/70/642338970.db2.gz QJSZAVSKGNOIHL-SNVBAGLBSA-N 1 2 249.289 2.194 20 0 BEADLO C[N@@H+](Cc1ncc[nH]1)C[C@@H]1CCCC2(CCC2)O1 ZINC000930121974 642448766 /nfs/dbraw/zinc/44/87/66/642448766.db2.gz RUBUIIVREYPFDM-LBPRGKRZSA-N 1 2 249.358 2.333 20 0 BEADLO C[N@H+](Cc1ncc[nH]1)C[C@@H]1CCCC2(CCC2)O1 ZINC000930121974 642448773 /nfs/dbraw/zinc/44/87/73/642448773.db2.gz RUBUIIVREYPFDM-LBPRGKRZSA-N 1 2 249.358 2.333 20 0 BEADLO CCC/C(C)=C/C(=O)NCCCn1cc[nH+]c1 ZINC000920214530 642453479 /nfs/dbraw/zinc/45/34/79/642453479.db2.gz NOFYJQCFQHOCJN-ZRDIBKRKSA-N 1 2 235.331 2.136 20 0 BEADLO Cc1[nH]c(CN(C)Cc2ccco2)[nH+]c1C ZINC000628120236 642469118 /nfs/dbraw/zinc/46/91/18/642469118.db2.gz DMJIHMGVEIHYHB-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO CCC/C(C)=C\C(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000920290719 642469443 /nfs/dbraw/zinc/46/94/43/642469443.db2.gz OTANFBAUTDBBEL-KGTBHZDVSA-N 1 2 235.331 2.134 20 0 BEADLO CCC/C(C)=C\C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000920290720 642470927 /nfs/dbraw/zinc/47/09/27/642470927.db2.gz OTANFBAUTDBBEL-NXIHDVOMSA-N 1 2 235.331 2.134 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnn(C3CCC3)c2)C[C@H](C)O1 ZINC000891402695 642476935 /nfs/dbraw/zinc/47/69/35/642476935.db2.gz VJHOSFUGFWNZJO-TXEJJXNPSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnn(C3CCC3)c2)C[C@H](C)O1 ZINC000891402695 642476940 /nfs/dbraw/zinc/47/69/40/642476940.db2.gz VJHOSFUGFWNZJO-TXEJJXNPSA-N 1 2 249.358 2.217 20 0 BEADLO CCSCCOC(=O)[C@H]1CCCC[N@@H+]1CC ZINC000175465632 642685348 /nfs/dbraw/zinc/68/53/48/642685348.db2.gz OVTUCHPRCMUPRM-LLVKDONJSA-N 1 2 245.388 2.157 20 0 BEADLO CCSCCOC(=O)[C@H]1CCCC[N@H+]1CC ZINC000175465632 642685351 /nfs/dbraw/zinc/68/53/51/642685351.db2.gz OVTUCHPRCMUPRM-LLVKDONJSA-N 1 2 245.388 2.157 20 0 BEADLO CC[N@H+](C)[C@@H](C(=O)OCCF)c1ccccc1 ZINC000175474984 642686944 /nfs/dbraw/zinc/68/69/44/642686944.db2.gz GLEVQUJYQGXUGW-GFCCVEGCSA-N 1 2 239.290 2.192 20 0 BEADLO CC[N@@H+](C)[C@@H](C(=O)OCCF)c1ccccc1 ZINC000175474984 642686946 /nfs/dbraw/zinc/68/69/46/642686946.db2.gz GLEVQUJYQGXUGW-GFCCVEGCSA-N 1 2 239.290 2.192 20 0 BEADLO CCCCOC(=O)C[N@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000069908804 642932012 /nfs/dbraw/zinc/93/20/12/642932012.db2.gz SSICTKUBDQZWFX-PHIMTYICSA-N 1 2 245.388 2.156 20 0 BEADLO CCCCOC(=O)C[N@@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000069908804 642932022 /nfs/dbraw/zinc/93/20/22/642932022.db2.gz SSICTKUBDQZWFX-PHIMTYICSA-N 1 2 245.388 2.156 20 0 BEADLO Cc1nonc1C[NH2+][C@H]1CCc2ccccc21 ZINC000070261673 643007307 /nfs/dbraw/zinc/00/73/07/643007307.db2.gz YPMAWPZLURUTTJ-LBPRGKRZSA-N 1 2 229.283 2.155 20 0 BEADLO CCCCC[C@@H](C)NC(=O)CCc1c[nH]c[nH+]1 ZINC000276525153 643018278 /nfs/dbraw/zinc/01/82/78/643018278.db2.gz CNHPESAELWURLK-LLVKDONJSA-N 1 2 237.347 2.427 20 0 BEADLO CCCCC[C@@H](C)NC(=O)CCc1c[nH+]c[nH]1 ZINC000276525153 643018288 /nfs/dbraw/zinc/01/82/88/643018288.db2.gz CNHPESAELWURLK-LLVKDONJSA-N 1 2 237.347 2.427 20 0 BEADLO O=C(C=C1CCC1)NNc1cc[nH+]cc1Cl ZINC000185258479 643280782 /nfs/dbraw/zinc/28/07/82/643280782.db2.gz JBBVAVHTAQXKMH-UHFFFAOYSA-N 1 2 237.690 2.288 20 0 BEADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2cnc[nH]2)o1 ZINC000112341600 643332472 /nfs/dbraw/zinc/33/24/72/643332472.db2.gz IPFZWJANYPHAGT-JOYOIKCWSA-N 1 2 231.299 2.416 20 0 BEADLO CC(=O)[C@@H]1CCC[N@H+](Cc2csc(C)n2)C1 ZINC000082644623 643359625 /nfs/dbraw/zinc/35/96/25/643359625.db2.gz IZTYJFCUZAOHPO-LLVKDONJSA-N 1 2 238.356 2.253 20 0 BEADLO CC(=O)[C@@H]1CCC[N@@H+](Cc2csc(C)n2)C1 ZINC000082644623 643359627 /nfs/dbraw/zinc/35/96/27/643359627.db2.gz IZTYJFCUZAOHPO-LLVKDONJSA-N 1 2 238.356 2.253 20 0 BEADLO CC(=O)CC[N@@H+]1CCC(C)=C(Br)C1 ZINC000307199404 643418713 /nfs/dbraw/zinc/41/87/13/643418713.db2.gz ZMNKSYAXKHNZIX-UHFFFAOYSA-N 1 2 246.148 2.340 20 0 BEADLO CC(=O)CC[N@H+]1CCC(C)=C(Br)C1 ZINC000307199404 643418717 /nfs/dbraw/zinc/41/87/17/643418717.db2.gz ZMNKSYAXKHNZIX-UHFFFAOYSA-N 1 2 246.148 2.340 20 0 BEADLO CCCCOC(=O)C[N@H+](C)Cc1ccccc1 ZINC000049633279 643622834 /nfs/dbraw/zinc/62/28/34/643622834.db2.gz DKMBGOHUPMYCFI-UHFFFAOYSA-N 1 2 235.327 2.462 20 0 BEADLO CCCCOC(=O)C[N@@H+](C)Cc1ccccc1 ZINC000049633279 643622835 /nfs/dbraw/zinc/62/28/35/643622835.db2.gz DKMBGOHUPMYCFI-UHFFFAOYSA-N 1 2 235.327 2.462 20 0 BEADLO Cc1nc(N[C@H](C)c2ccc(F)cc2)nc(N)[nH+]1 ZINC000197839690 643729327 /nfs/dbraw/zinc/72/93/27/643729327.db2.gz DDWOFMIEONMKLH-SSDOTTSWSA-N 1 2 247.277 2.074 20 0 BEADLO Cc1nc(N)nc(N[C@H](C)c2ccc(F)cc2)[nH+]1 ZINC000197839690 643729331 /nfs/dbraw/zinc/72/93/31/643729331.db2.gz DDWOFMIEONMKLH-SSDOTTSWSA-N 1 2 247.277 2.074 20 0 BEADLO Cc1cc(C[NH2+]Cc2cnn(C3CCC3)c2)on1 ZINC000921688706 643745383 /nfs/dbraw/zinc/74/53/83/643745383.db2.gz BWLRXLMJYMOFJS-UHFFFAOYSA-N 1 2 246.314 2.194 20 0 BEADLO C[C@H](C(=O)OCc1c[nH+]cn1C)C1CCCC1 ZINC000085988982 643882340 /nfs/dbraw/zinc/88/23/40/643882340.db2.gz IANAGLDMZGSZGL-JTQLQIEISA-N 1 2 236.315 2.290 20 0 BEADLO Nc1ccc(COC(=O)CC2CCCC2)c[nH+]1 ZINC000922179021 643893927 /nfs/dbraw/zinc/89/39/27/643893927.db2.gz VRBGGIIIDIYKML-UHFFFAOYSA-N 1 2 234.299 2.287 20 0 BEADLO CCC(CC)C(=O)OCc1ccc(N)[nH+]c1 ZINC000922352290 643980047 /nfs/dbraw/zinc/98/00/47/643980047.db2.gz AVANEPQUEXYFDL-UHFFFAOYSA-N 1 2 222.288 2.143 20 0 BEADLO c1nc(C[NH2+][C@@H](c2ccccn2)C2CC2)co1 ZINC000922585050 644036424 /nfs/dbraw/zinc/03/64/24/644036424.db2.gz QDCCDUGBAIZLKH-CYBMUJFWSA-N 1 2 229.283 2.311 20 0 BEADLO CC[C@@H](C)[C@H](C)C(=O)OCc1ccc(N)[nH+]c1 ZINC000922594136 644037205 /nfs/dbraw/zinc/03/72/05/644037205.db2.gz UCAXTJQKZJOWOJ-ZJUUUORDSA-N 1 2 236.315 2.389 20 0 BEADLO CC(C)C[C@H](C)C(=O)OCc1ccc(N)[nH+]c1 ZINC000922613398 644042011 /nfs/dbraw/zinc/04/20/11/644042011.db2.gz HXCYONLNYQPIIC-JTQLQIEISA-N 1 2 236.315 2.389 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1C(=O)OCc1ccc(N)[nH+]c1 ZINC000922624030 644043120 /nfs/dbraw/zinc/04/31/20/644043120.db2.gz LLAQWQPTOXGZAG-FZMZJTMJSA-N 1 2 248.326 2.389 20 0 BEADLO CCn1nc(C)c(C[NH2+]C(C)(C)/C=C/Cl)n1 ZINC000922644370 644049819 /nfs/dbraw/zinc/04/98/19/644049819.db2.gz HNCHBOHDUHZJOX-VOTSOKGWSA-N 1 2 242.754 2.227 20 0 BEADLO CC1(C)CC(C(=O)OCc2ccc[nH+]c2N)C1 ZINC000922723284 644077743 /nfs/dbraw/zinc/07/77/43/644077743.db2.gz LGKRKVDSJUDBQF-UHFFFAOYSA-N 1 2 234.299 2.143 20 0 BEADLO CC(C)(C(=O)OCc1ccc[nH+]c1N)C1CC1 ZINC000922733234 644082701 /nfs/dbraw/zinc/08/27/01/644082701.db2.gz KPRKTYAVEAERRI-UHFFFAOYSA-N 1 2 234.299 2.143 20 0 BEADLO Cc1cc(F)ccc1C[NH2+]Cc1ccon1 ZINC000086452658 644138740 /nfs/dbraw/zinc/13/87/40/644138740.db2.gz DZLFWTSSRPXGIO-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO Cc1cc(NC(=O)C[C@@H]2CCCOC2)cc[nH+]1 ZINC000193241049 644225333 /nfs/dbraw/zinc/22/53/33/644225333.db2.gz HXIKZKIZKZGGBG-NSHDSACASA-N 1 2 234.299 2.145 20 0 BEADLO C[C@]1([NH2+]Cc2cocn2)CCOc2ccccc21 ZINC000923026977 644238349 /nfs/dbraw/zinc/23/83/49/644238349.db2.gz YFXLHVDFNUJDCH-AWEZNQCLSA-N 1 2 244.294 2.462 20 0 BEADLO CCCCN(C)C(=O)c1cccc2[nH+]ccn21 ZINC000082318006 644369055 /nfs/dbraw/zinc/36/90/55/644369055.db2.gz SNPSSNOFBLZVSD-UHFFFAOYSA-N 1 2 231.299 2.206 20 0 BEADLO C[C@@H]([NH2+][C@H]1CC1(C)C)C(=O)OC(C)(C)C ZINC000085494358 644441177 /nfs/dbraw/zinc/44/11/77/644441177.db2.gz HOKSEBHGUWXCTH-BDAKNGLRSA-N 1 2 213.321 2.105 20 0 BEADLO C[C@H]([NH2+][C@H]1CC1(C)C)C(=O)OC(C)(C)C ZINC000085494356 644441717 /nfs/dbraw/zinc/44/17/17/644441717.db2.gz HOKSEBHGUWXCTH-IUCAKERBSA-N 1 2 213.321 2.105 20 0 BEADLO CC1(C)CC[C@@H]1NC(=O)c1cccc2[nH+]ccn21 ZINC000805323449 644665758 /nfs/dbraw/zinc/66/57/58/644665758.db2.gz OYOUWGYBLDOELU-NSHDSACASA-N 1 2 243.310 2.253 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2ccoc2)CCO1 ZINC000093508881 644692508 /nfs/dbraw/zinc/69/25/08/644692508.db2.gz IAXHFVMNVQIFMX-LBPRGKRZSA-N 1 2 209.289 2.281 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2ccoc2)CCO1 ZINC000093508881 644692514 /nfs/dbraw/zinc/69/25/14/644692514.db2.gz IAXHFVMNVQIFMX-LBPRGKRZSA-N 1 2 209.289 2.281 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)C1=CCCCC1 ZINC000793241592 644802047 /nfs/dbraw/zinc/80/20/47/644802047.db2.gz KFHDSYDOMTZSRA-UHFFFAOYSA-N 1 2 234.299 2.006 20 0 BEADLO CCCOC(=O)[C@H](C)[N@@H+]1CCS[C@@H](CC)C1 ZINC000252481012 644857439 /nfs/dbraw/zinc/85/74/39/644857439.db2.gz SRFSFTQPMMKVQC-QWRGUYRKSA-N 1 2 245.388 2.156 20 0 BEADLO CCCOC(=O)[C@H](C)[N@H+]1CCS[C@@H](CC)C1 ZINC000252481012 644857449 /nfs/dbraw/zinc/85/74/49/644857449.db2.gz SRFSFTQPMMKVQC-QWRGUYRKSA-N 1 2 245.388 2.156 20 0 BEADLO c1cc(C[N@@H+]2C[C@@]3(CCCO3)[C@H]2C2CC2)co1 ZINC000816666348 644965477 /nfs/dbraw/zinc/96/54/77/644965477.db2.gz KZTVULJCERUSEI-KGLIPLIRSA-N 1 2 233.311 2.423 20 0 BEADLO c1cc(C[N@H+]2C[C@@]3(CCCO3)[C@H]2C2CC2)co1 ZINC000816666348 644965479 /nfs/dbraw/zinc/96/54/79/644965479.db2.gz KZTVULJCERUSEI-KGLIPLIRSA-N 1 2 233.311 2.423 20 0 BEADLO C/C=C(/C)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000817459024 644983730 /nfs/dbraw/zinc/98/37/30/644983730.db2.gz PBRMURWAVGBVDM-UITAMQMPSA-N 1 2 218.300 2.281 20 0 BEADLO CS/C=C\C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000817458016 644983882 /nfs/dbraw/zinc/98/38/82/644983882.db2.gz AMOIGVYTAVJYJK-PLNGDYQASA-N 1 2 236.340 2.191 20 0 BEADLO CC(C)C[C@@H](C(=O)N[C@@H]1C=CCC1)n1cc[nH+]c1 ZINC000824438701 645054509 /nfs/dbraw/zinc/05/45/09/645054509.db2.gz XOJAFUZQMSAUOS-OLZOCXBDSA-N 1 2 247.342 2.305 20 0 BEADLO CC(C)C[C@@H](C(=O)N[C@H]1C=CCC1)n1cc[nH+]c1 ZINC000824438703 645054558 /nfs/dbraw/zinc/05/45/58/645054558.db2.gz XOJAFUZQMSAUOS-STQMWFEESA-N 1 2 247.342 2.305 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)NCCCCC1CC1 ZINC000825670646 645062655 /nfs/dbraw/zinc/06/26/55/645062655.db2.gz XMQNFCHNUOHMNB-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO O=C(CCn1cc[nH+]c1)N1CCCCCCCC1 ZINC000836923442 645180563 /nfs/dbraw/zinc/18/05/63/645180563.db2.gz PIAUIKBIMVKUKP-UHFFFAOYSA-N 1 2 249.358 2.456 20 0 BEADLO COCc1cc[nH+]c(N[C@H](C)c2ncco2)c1 ZINC000926659381 645343025 /nfs/dbraw/zinc/34/30/25/645343025.db2.gz HNFAJXUEBYMIFB-SECBINFHSA-N 1 2 233.271 2.389 20 0 BEADLO C[C@H]([NH2+]C[C@@H]1CCN1C(C)(C)C)c1ncco1 ZINC000926670893 645347752 /nfs/dbraw/zinc/34/77/52/645347752.db2.gz GJKIXTAEYRJTQD-QWRGUYRKSA-N 1 2 237.347 2.198 20 0 BEADLO CC/C=C\COC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000845448891 645361593 /nfs/dbraw/zinc/36/15/93/645361593.db2.gz MLRZHJVJILVMRX-DOGVGXBMSA-N 1 2 222.288 2.344 20 0 BEADLO CCCCOC(=O)Cc1cn2c([nH+]1)CCCC2 ZINC000845447886 645362229 /nfs/dbraw/zinc/36/22/29/645362229.db2.gz RSDQAJOOUGHJEV-UHFFFAOYSA-N 1 2 236.315 2.105 20 0 BEADLO C[C@H]([NH2+][C@H]1C[C@H](O)C1)C(F)(F)c1ccccc1 ZINC000926733251 645392297 /nfs/dbraw/zinc/39/22/97/645392297.db2.gz SJKIFCIFJSXCQB-DLOVCJGASA-N 1 2 241.281 2.280 20 0 BEADLO CCC(F)(F)C[NH2+][C@@H](C)c1cc[nH]c(=O)c1 ZINC000926757124 645406462 /nfs/dbraw/zinc/40/64/62/645406462.db2.gz PESWJFOZLCHDKD-QMMMGPOBSA-N 1 2 230.258 2.483 20 0 BEADLO CC1(C)C[N@H+](CC2(Br)CC2)CCO1 ZINC000846763096 645406945 /nfs/dbraw/zinc/40/69/45/645406945.db2.gz VXPVDJNIVQRKRT-UHFFFAOYSA-N 1 2 248.164 2.025 20 0 BEADLO CC1(C)C[N@@H+](CC2(Br)CC2)CCO1 ZINC000846763096 645406950 /nfs/dbraw/zinc/40/69/50/645406950.db2.gz VXPVDJNIVQRKRT-UHFFFAOYSA-N 1 2 248.164 2.025 20 0 BEADLO Cc1nonc1[C@H](C)[NH2+][C@@H]1CCCC[C@@H]1F ZINC000926785186 645430138 /nfs/dbraw/zinc/43/01/38/645430138.db2.gz JIDJNPLHTSPRAD-UJNFCWOMSA-N 1 2 227.283 2.309 20 0 BEADLO C[C@@H]([N@@H+]1CCO[C@H](C(F)F)C1)C1(Cl)CC1 ZINC000926824835 645444234 /nfs/dbraw/zinc/44/42/34/645444234.db2.gz ZZIZMXJFBOIKRX-SFYZADRCSA-N 1 2 239.693 2.112 20 0 BEADLO C[C@@H]([N@H+]1CCO[C@H](C(F)F)C1)C1(Cl)CC1 ZINC000926824835 645444241 /nfs/dbraw/zinc/44/42/41/645444241.db2.gz ZZIZMXJFBOIKRX-SFYZADRCSA-N 1 2 239.693 2.112 20 0 BEADLO C/C=C/C(=O)N1CCC(Nc2cccc[nH+]2)CC1 ZINC000927074230 645536350 /nfs/dbraw/zinc/53/63/50/645536350.db2.gz GMRCTLVSUFGMHB-GORDUTHDSA-N 1 2 245.326 2.061 20 0 BEADLO CC(C)[C@H]([NH2+][C@H](C)c1ncco1)c1cnn(C)c1 ZINC000927072960 645538369 /nfs/dbraw/zinc/53/83/69/645538369.db2.gz ZUFNKYPGAIXRLI-PWSUYJOCSA-N 1 2 248.330 2.456 20 0 BEADLO CC1CC(CNC(=O)c2cccc3[nH+]ccn32)C1 ZINC000857406891 645549740 /nfs/dbraw/zinc/54/97/40/645549740.db2.gz YJIIEVMZSLOWJW-UHFFFAOYSA-N 1 2 243.310 2.110 20 0 BEADLO CCc1onc(C)c1C[NH2+][C@@H](C)c1ncc[nH]1 ZINC000927133220 645564313 /nfs/dbraw/zinc/56/43/13/645564313.db2.gz VSTIWTJRUQNCFX-VIFPVBQESA-N 1 2 234.303 2.119 20 0 BEADLO Nc1ccc(CNC(=O)/C=C\C2CCCC2)c[nH+]1 ZINC000927776468 645654610 /nfs/dbraw/zinc/65/46/10/645654610.db2.gz CRDIFNNOGIQHSJ-VURMDHGXSA-N 1 2 245.326 2.026 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CC[C@@H](C)C[C@@H](C)C1 ZINC000928186231 645706017 /nfs/dbraw/zinc/70/60/17/645706017.db2.gz ZMFORQHCNCMJFG-GHMZBOCLSA-N 1 2 249.358 2.155 20 0 BEADLO CCOC(=O)C[N@@H+]1C[C@@H]2CC[C@H]1c1ccccc12 ZINC000880537319 645836666 /nfs/dbraw/zinc/83/66/66/645836666.db2.gz SVVSEUADRZVNJM-FZMZJTMJSA-N 1 2 245.322 2.484 20 0 BEADLO CCOC(=O)C[N@H+]1C[C@@H]2CC[C@H]1c1ccccc12 ZINC000880537319 645836669 /nfs/dbraw/zinc/83/66/69/645836669.db2.gz SVVSEUADRZVNJM-FZMZJTMJSA-N 1 2 245.322 2.484 20 0 BEADLO O=C(c1cc2c[nH+]ccc2[nH]1)N1CCCCC1 ZINC000929096189 645938297 /nfs/dbraw/zinc/93/82/97/645938297.db2.gz FAFJSIOZBFCRAN-UHFFFAOYSA-N 1 2 229.283 2.189 20 0 BEADLO CC[C@@H](C)NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000929104628 645944454 /nfs/dbraw/zinc/94/44/54/645944454.db2.gz WWMSUTGUHNQDCR-MRVPVSSYSA-N 1 2 217.272 2.091 20 0 BEADLO Cn1nc(C[N@H+](C)C2CC2)cc1C(F)(F)F ZINC000929273963 646052435 /nfs/dbraw/zinc/05/24/35/646052435.db2.gz NPBAMOWTODAKAT-UHFFFAOYSA-N 1 2 233.237 2.033 20 0 BEADLO Cn1nc(C[N@@H+](C)C2CC2)cc1C(F)(F)F ZINC000929273963 646052438 /nfs/dbraw/zinc/05/24/38/646052438.db2.gz NPBAMOWTODAKAT-UHFFFAOYSA-N 1 2 233.237 2.033 20 0 BEADLO COCC[NH2+][C@H](C)C(F)(F)c1ccccc1 ZINC000924537635 646057765 /nfs/dbraw/zinc/05/77/65/646057765.db2.gz MIJQMUZHEVZZHT-SNVBAGLBSA-N 1 2 229.270 2.403 20 0 BEADLO COC/C(C)=C/C[N@@H+]1CCC[C@@H](c2ccn[nH]2)C1 ZINC000929297104 646070579 /nfs/dbraw/zinc/07/05/79/646070579.db2.gz UCSWIHLPEXZBBB-XEVNVYFWSA-N 1 2 249.358 2.182 20 0 BEADLO COC/C(C)=C/C[N@H+]1CCC[C@@H](c2ccn[nH]2)C1 ZINC000929297104 646070584 /nfs/dbraw/zinc/07/05/84/646070584.db2.gz UCSWIHLPEXZBBB-XEVNVYFWSA-N 1 2 249.358 2.182 20 0 BEADLO CC1(C)CC[NH+](Cc2nncs2)CC1 ZINC000929483381 646140140 /nfs/dbraw/zinc/14/01/40/646140140.db2.gz GWJWROGHVSZKJH-UHFFFAOYSA-N 1 2 211.334 2.160 20 0 BEADLO CCc1nc(C[NH2+][C@@H](C)c2ccnnc2)cs1 ZINC000925000316 646154000 /nfs/dbraw/zinc/15/40/00/646154000.db2.gz SGDNFRUIQPDVOD-VIFPVBQESA-N 1 2 248.355 2.346 20 0 BEADLO COC(=O)/C=C(\C)C[NH+]1Cc2ccccc2C1 ZINC000929584400 646184230 /nfs/dbraw/zinc/18/42/30/646184230.db2.gz SCEFXYBGZPKYFM-YRNVUSSQSA-N 1 2 231.295 2.122 20 0 BEADLO CC[C@H](C)C[N@H+](C)Cc1nnc(OC)s1 ZINC000929618251 646200661 /nfs/dbraw/zinc/20/06/61/646200661.db2.gz GBTRIAZGFTUREE-QMMMGPOBSA-N 1 2 229.349 2.025 20 0 BEADLO CC[C@H](C)C[N@@H+](C)Cc1nnc(OC)s1 ZINC000929618251 646200668 /nfs/dbraw/zinc/20/06/68/646200668.db2.gz GBTRIAZGFTUREE-QMMMGPOBSA-N 1 2 229.349 2.025 20 0 BEADLO COc1nnc(C[NH+]2[C@@H](C)CCC[C@@H]2C)s1 ZINC000929604932 646196210 /nfs/dbraw/zinc/19/62/10/646196210.db2.gz NYFXOMYBUNOQOY-IUCAKERBSA-N 1 2 241.360 2.310 20 0 BEADLO C[C@H](C1CC1)N(C)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000929706700 646261934 /nfs/dbraw/zinc/26/19/34/646261934.db2.gz RTDIGTVGWKHQPD-SECBINFHSA-N 1 2 243.310 2.433 20 0 BEADLO C[N@H+](CCc1cccs1)Cc1nncs1 ZINC000929731778 646277069 /nfs/dbraw/zinc/27/70/69/646277069.db2.gz LHJDYAFCQQRPIT-UHFFFAOYSA-N 1 2 239.369 2.274 20 0 BEADLO C[N@@H+](CCc1cccs1)Cc1nncs1 ZINC000929731778 646277077 /nfs/dbraw/zinc/27/70/77/646277077.db2.gz LHJDYAFCQQRPIT-UHFFFAOYSA-N 1 2 239.369 2.274 20 0 BEADLO C[N@H+](CCc1ccns1)Cc1nccs1 ZINC000929768451 646298036 /nfs/dbraw/zinc/29/80/36/646298036.db2.gz LIVWCRJGRSCJHN-UHFFFAOYSA-N 1 2 239.369 2.274 20 0 BEADLO C[N@@H+](CCc1ccns1)Cc1nccs1 ZINC000929768451 646298040 /nfs/dbraw/zinc/29/80/40/646298040.db2.gz LIVWCRJGRSCJHN-UHFFFAOYSA-N 1 2 239.369 2.274 20 0 BEADLO Cc1cc(C)c(C(=O)N(C)CCCF)c(C)[nH+]1 ZINC000925554323 646331412 /nfs/dbraw/zinc/33/14/12/646331412.db2.gz YDPIDRUOGQOOTK-UHFFFAOYSA-N 1 2 238.306 2.438 20 0 BEADLO Cc1cc(C)nc(C[N@H+]2CCO[C@@H](C)[C@H]2C)c1 ZINC000929848086 646359179 /nfs/dbraw/zinc/35/91/79/646359179.db2.gz QBUAOPXMWZGAQN-OLZOCXBDSA-N 1 2 234.343 2.308 20 0 BEADLO Cc1cc(C)nc(C[N@@H+]2CCO[C@@H](C)[C@H]2C)c1 ZINC000929848086 646359182 /nfs/dbraw/zinc/35/91/82/646359182.db2.gz QBUAOPXMWZGAQN-OLZOCXBDSA-N 1 2 234.343 2.308 20 0 BEADLO CCN(C(=O)c1cc2c[nH+]ccc2[nH]1)C1CC1 ZINC000929864153 646362958 /nfs/dbraw/zinc/36/29/58/646362958.db2.gz VKRUEFYSTOXGJN-UHFFFAOYSA-N 1 2 229.283 2.187 20 0 BEADLO CSCC[C@@H](C)[N@H+](C)Cc1nncs1 ZINC000929986598 646385586 /nfs/dbraw/zinc/38/55/86/646385586.db2.gz LXPBEMBRYKBUAF-MRVPVSSYSA-N 1 2 231.390 2.112 20 0 BEADLO CSCC[C@@H](C)[N@@H+](C)Cc1nncs1 ZINC000929986598 646385588 /nfs/dbraw/zinc/38/55/88/646385588.db2.gz LXPBEMBRYKBUAF-MRVPVSSYSA-N 1 2 231.390 2.112 20 0 BEADLO C[C@H]1CC2(CC(Nc3cccc[nH+]3)C2)CO1 ZINC000925716707 646441206 /nfs/dbraw/zinc/44/12/06/646441206.db2.gz BRRBMTFIVOSAPW-ZBOXLXRLSA-N 1 2 218.300 2.451 20 0 BEADLO C[C@@H]([NH2+]Cc1nncs1)c1ccccc1 ZINC000930183825 646482769 /nfs/dbraw/zinc/48/27/69/646482769.db2.gz XVXDHTJSUAXALM-SECBINFHSA-N 1 2 219.313 2.389 20 0 BEADLO C[C@H](Nc1ccc([NH+](C)C)cc1)c1cnnn1C ZINC000926027646 646562015 /nfs/dbraw/zinc/56/20/15/646562015.db2.gz PKEIHMGDUCCLNC-JTQLQIEISA-N 1 2 245.330 2.054 20 0 BEADLO Cc1c(F)cccc1NC(=O)C[C@H]([NH3+])C(F)F ZINC000724739920 711610037 /nfs/dbraw/zinc/61/00/37/711610037.db2.gz ORPMSJGPDWFWNJ-QMMMGPOBSA-N 1 2 246.232 2.055 20 0 BEADLO Oc1ccc(C[N@H+]2CCC[C@H](F)C2)cc1F ZINC000701674766 712027300 /nfs/dbraw/zinc/02/73/00/712027300.db2.gz RPZNJCGNLYNVDT-JTQLQIEISA-N 1 2 227.254 2.465 20 0 BEADLO C[C@@H](CF)[NH2+]Cc1occc1Br ZINC000379337552 712374369 /nfs/dbraw/zinc/37/43/69/712374369.db2.gz XZRJEXBACHTBRF-LURJTMIESA-N 1 2 236.084 2.490 20 0 BEADLO Cc1cnc(C[NH2+]Cc2[nH]nc(C)c2C)s1 ZINC000716464114 712563000 /nfs/dbraw/zinc/56/30/00/712563000.db2.gz FFKSIAKTBZPAHV-UHFFFAOYSA-N 1 2 236.344 2.081 20 0 BEADLO Cc1cnc(C[NH2+]C2(C)CC(F)(F)C2)o1 ZINC000720937899 712880513 /nfs/dbraw/zinc/88/05/13/712880513.db2.gz RHZFZLVPRALMCL-UHFFFAOYSA-N 1 2 216.231 2.260 20 0 BEADLO CC(C)=CC[NH+]1CC(N(C)C(=O)C(C)(C)C)C1 ZINC001044216144 710821999 /nfs/dbraw/zinc/82/19/99/710821999.db2.gz QUPLZDZMNFVVSC-UHFFFAOYSA-N 1 2 238.375 2.141 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@@H+]1Cc1ccc(O)c(F)c1 ZINC000380567429 712901654 /nfs/dbraw/zinc/90/16/54/712901654.db2.gz ZMAORICCVBRYEQ-ZJUUUORDSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1ccc(O)c(F)c1 ZINC000380567429 712901655 /nfs/dbraw/zinc/90/16/55/712901655.db2.gz ZMAORICCVBRYEQ-ZJUUUORDSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@H]([NH2+]Cc1cnsn1)c1ccccc1 ZINC000399811135 710912208 /nfs/dbraw/zinc/91/22/08/710912208.db2.gz DKHDLHFGWWJWNS-VIFPVBQESA-N 1 2 219.313 2.389 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+]CCC(C)(C)SC ZINC000385219982 711008366 /nfs/dbraw/zinc/00/83/66/711008366.db2.gz LBIVMCVIVYBMEQ-SECBINFHSA-N 1 2 233.377 2.059 20 0 BEADLO OCC[N@H+](C/C(Cl)=C\Cl)C1CCC1 ZINC000388117566 711052422 /nfs/dbraw/zinc/05/24/22/711052422.db2.gz FWXUFHUVHCYQPE-SOFGYWHQSA-N 1 2 224.131 2.152 20 0 BEADLO OCC[N@@H+](C/C(Cl)=C\Cl)C1CCC1 ZINC000388117566 711052423 /nfs/dbraw/zinc/05/24/23/711052423.db2.gz FWXUFHUVHCYQPE-SOFGYWHQSA-N 1 2 224.131 2.152 20 0 BEADLO CC(C)[C@@H]1C[N@H+](C/C=C\Cl)CCO1 ZINC000388751073 711066407 /nfs/dbraw/zinc/06/64/07/711066407.db2.gz BSGQPIYZBWOUQI-XOULXFPDSA-N 1 2 203.713 2.096 20 0 BEADLO CC(C)[C@@H]1C[N@@H+](C/C=C\Cl)CCO1 ZINC000388751073 711066409 /nfs/dbraw/zinc/06/64/09/711066409.db2.gz BSGQPIYZBWOUQI-XOULXFPDSA-N 1 2 203.713 2.096 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2cnn(C)n2)cs1 ZINC000389848009 711093146 /nfs/dbraw/zinc/09/31/46/711093146.db2.gz QIWOXZWFWWTBDY-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO COc1c(C)c[nH+]c(CN[C@H](C)C(F)F)c1C ZINC000389933137 711098358 /nfs/dbraw/zinc/09/83/58/711098358.db2.gz JYJVRRGEMGXMSG-SECBINFHSA-N 1 2 244.285 2.450 20 0 BEADLO COc1c(C)c[nH+]c(CN[C@@H](C)C(F)F)c1C ZINC000389933145 711099060 /nfs/dbraw/zinc/09/90/60/711099060.db2.gz JYJVRRGEMGXMSG-VIFPVBQESA-N 1 2 244.285 2.450 20 0 BEADLO CCOC(=O)[C@H](CC1CC1)[NH2+]CCSCC ZINC000390587040 711126536 /nfs/dbraw/zinc/12/65/36/711126536.db2.gz YLJUFZZOJIZIJA-NSHDSACASA-N 1 2 245.388 2.061 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2cccc(C)c2F)[nH]1 ZINC000392367462 711144480 /nfs/dbraw/zinc/14/44/80/711144480.db2.gz IEOBQPMWDBAGFU-SECBINFHSA-N 1 2 248.305 2.411 20 0 BEADLO CO[C@H]1C[C@@H]([N@H+](C)C/C(Cl)=C/Cl)C1 ZINC000393708129 711171040 /nfs/dbraw/zinc/17/10/40/711171040.db2.gz BJLJKEYFYSVOOB-YUGKURJKSA-N 1 2 224.131 2.415 20 0 BEADLO CO[C@H]1C[C@@H]([N@@H+](C)C/C(Cl)=C/Cl)C1 ZINC000393708129 711171045 /nfs/dbraw/zinc/17/10/45/711171045.db2.gz BJLJKEYFYSVOOB-YUGKURJKSA-N 1 2 224.131 2.415 20 0 BEADLO CNc1cc(N[C@@H]2CCC2(C)C)nc[nH+]1 ZINC000393764292 711172713 /nfs/dbraw/zinc/17/27/13/711172713.db2.gz RGCPVIWAFFPMQG-MRVPVSSYSA-N 1 2 206.293 2.119 20 0 BEADLO CNc1cc(N[C@@H]2CCC2(C)C)[nH+]cn1 ZINC000393764292 711172716 /nfs/dbraw/zinc/17/27/16/711172716.db2.gz RGCPVIWAFFPMQG-MRVPVSSYSA-N 1 2 206.293 2.119 20 0 BEADLO CC[C@H]1CC[C@@H]1[NH2+][C@@H](C)C(=O)OCC(C)C ZINC000381407771 710634354 /nfs/dbraw/zinc/63/43/54/710634354.db2.gz SVZJWMGCRWBGFO-SRVKXCTJSA-N 1 2 227.348 2.352 20 0 BEADLO CCc1cccc(NC(=O)C[C@@H]([NH3+])C(F)F)c1 ZINC000724763537 710746042 /nfs/dbraw/zinc/74/60/42/710746042.db2.gz XTHDCLZYKYZFTN-SNVBAGLBSA-N 1 2 242.269 2.170 20 0 BEADLO CC[C@H](Nc1cc[nH+]c(C)n1)[C@H]1CCCOC1 ZINC000723865713 711540128 /nfs/dbraw/zinc/54/01/28/711540128.db2.gz VOPNBYFKFUJJRD-RYUDHWBXSA-N 1 2 235.331 2.402 20 0 BEADLO CC[C@H](Nc1cc[nH+]c(C)n1)[C@@H]1CCCOC1 ZINC000723865710 711540226 /nfs/dbraw/zinc/54/02/26/711540226.db2.gz VOPNBYFKFUJJRD-NEPJUHHUSA-N 1 2 235.331 2.402 20 0 BEADLO CCN(C#N)CC[N@H+](Cc1ccoc1)C1CC1 ZINC000934004753 711561468 /nfs/dbraw/zinc/56/14/68/711561468.db2.gz SNQUGITYKFHVJX-UHFFFAOYSA-N 1 2 233.315 2.047 20 0 BEADLO CCN(C#N)CC[N@@H+](Cc1ccoc1)C1CC1 ZINC000934004753 711561470 /nfs/dbraw/zinc/56/14/70/711561470.db2.gz SNQUGITYKFHVJX-UHFFFAOYSA-N 1 2 233.315 2.047 20 0 BEADLO C[C@H](O)CC[N@H+](C)Cc1nc(C(C)(C)C)co1 ZINC000724412100 711579014 /nfs/dbraw/zinc/57/90/14/711579014.db2.gz CJUZMFDTCJSRSJ-JTQLQIEISA-N 1 2 240.347 2.175 20 0 BEADLO C[C@H](O)CC[N@@H+](C)Cc1nc(C(C)(C)C)co1 ZINC000724412100 711579016 /nfs/dbraw/zinc/57/90/16/711579016.db2.gz CJUZMFDTCJSRSJ-JTQLQIEISA-N 1 2 240.347 2.175 20 0 BEADLO CC(C)C[C@@H]1CCCN1C(=O)C[C@@H]([NH3+])C(F)F ZINC000724695157 711608956 /nfs/dbraw/zinc/60/89/56/711608956.db2.gz AXXFTHXUKJDRPC-VHSXEESVSA-N 1 2 248.317 2.006 20 0 BEADLO CCCCC[C@H](C)NC(=O)C[C@@H]([NH3+])C(F)F ZINC000724693121 711609268 /nfs/dbraw/zinc/60/92/68/711609268.db2.gz OLPFAJAQEWKIGP-DTWKUNHWSA-N 1 2 236.306 2.054 20 0 BEADLO CCC[N@H+](C)Cn1c2c(sc1=O)CCCC2 ZINC000066078270 711668836 /nfs/dbraw/zinc/66/88/36/711668836.db2.gz BLUOHIUTYMKCNZ-UHFFFAOYSA-N 1 2 240.372 2.088 20 0 BEADLO CCC[N@@H+](C)Cn1c2c(sc1=O)CCCC2 ZINC000066078270 711668838 /nfs/dbraw/zinc/66/88/38/711668838.db2.gz BLUOHIUTYMKCNZ-UHFFFAOYSA-N 1 2 240.372 2.088 20 0 BEADLO Cn1cnc(C[NH2+]Cc2ccccc2Cl)c1 ZINC000309278821 711696190 /nfs/dbraw/zinc/69/61/90/711696190.db2.gz MRGGPEUEKGHQFN-UHFFFAOYSA-N 1 2 235.718 2.363 20 0 BEADLO Cc1cc(N[C@H]2[C@@H]3COC[C@@H]32)nc(C2CCC2)[nH+]1 ZINC000893622598 711749567 /nfs/dbraw/zinc/74/95/67/711749567.db2.gz AOHKMHUEULZJRG-PJXYFTJBSA-N 1 2 245.326 2.109 20 0 BEADLO COc1ccc([C@@H](C)[NH2+]Cc2cnsn2)cc1 ZINC000399898954 711763927 /nfs/dbraw/zinc/76/39/27/711763927.db2.gz SHVCCUJHLKJNMT-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO Cc1ncoc1C[NH2+][C@@H](C)c1ccccn1 ZINC000894145928 711764340 /nfs/dbraw/zinc/76/43/40/711764340.db2.gz KRKHTNMIILWUJJ-VIFPVBQESA-N 1 2 217.272 2.229 20 0 BEADLO Cc1ncoc1C[NH2+][C@H](C)c1ccccn1 ZINC000894145926 711764351 /nfs/dbraw/zinc/76/43/51/711764351.db2.gz KRKHTNMIILWUJJ-SECBINFHSA-N 1 2 217.272 2.229 20 0 BEADLO CC(C)(C)C[C@@H]1CCN(C(=O)Cc2c[nH+]c[nH]2)C1 ZINC000909421208 711774799 /nfs/dbraw/zinc/77/47/99/711774799.db2.gz AVNSABHZEHWSPI-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO Cc1[nH]c(CNC(=O)C[C@@H]2C[C@H]2C2CC2)[nH+]c1C ZINC000896905460 711783653 /nfs/dbraw/zinc/78/36/53/711783653.db2.gz HRSBBRUFFCKFGG-RYUDHWBXSA-N 1 2 247.342 2.079 20 0 BEADLO C[N@H+](C/C(Cl)=C/Cl)C1(CO)CCC1 ZINC000379390972 711801072 /nfs/dbraw/zinc/80/10/72/711801072.db2.gz VTJLQCBQKVDMBH-YVMONPNESA-N 1 2 224.131 2.152 20 0 BEADLO C[N@@H+](C/C(Cl)=C/Cl)C1(CO)CCC1 ZINC000379390972 711801073 /nfs/dbraw/zinc/80/10/73/711801073.db2.gz VTJLQCBQKVDMBH-YVMONPNESA-N 1 2 224.131 2.152 20 0 BEADLO C[C@H](C(=O)OCc1ccc[nH+]c1N)C1CCC1 ZINC000922792462 711975934 /nfs/dbraw/zinc/97/59/34/711975934.db2.gz AKPAVJRMQVFQCK-VIFPVBQESA-N 1 2 234.299 2.143 20 0 BEADLO C[C@@H](C(=O)OCc1ccc(N)[nH+]c1)C1CCC1 ZINC000922793462 711976732 /nfs/dbraw/zinc/97/67/32/711976732.db2.gz LKZCPIDFRUTEMH-SECBINFHSA-N 1 2 234.299 2.143 20 0 BEADLO CCc1cnc(C[NH+]2CCC(C(C)=O)CC2)o1 ZINC000700404714 711992064 /nfs/dbraw/zinc/99/20/64/711992064.db2.gz FRXJNGSCHLREEW-UHFFFAOYSA-N 1 2 236.315 2.038 20 0 BEADLO CCCNc1cc(NCC[C@H](C)F)nc[nH+]1 ZINC000702570295 712055658 /nfs/dbraw/zinc/05/56/58/712055658.db2.gz HJUTZPYQLFPAHU-VIFPVBQESA-N 1 2 226.299 2.459 20 0 BEADLO CCCNc1cc(NCC[C@H](C)F)[nH+]cn1 ZINC000702570295 712055659 /nfs/dbraw/zinc/05/56/59/712055659.db2.gz HJUTZPYQLFPAHU-VIFPVBQESA-N 1 2 226.299 2.459 20 0 BEADLO CCC[C@@H](CNc1cc(NC)nc[nH+]1)OCC ZINC000705336896 712129437 /nfs/dbraw/zinc/12/94/37/712129437.db2.gz HXOXTRALOFRHBU-JTQLQIEISA-N 1 2 238.335 2.135 20 0 BEADLO CNc1cc(N[C@@H]2CCCC23CC3)nc[nH+]1 ZINC000706568113 712150180 /nfs/dbraw/zinc/15/01/80/712150180.db2.gz IMFJENLIVIQBHQ-SECBINFHSA-N 1 2 218.304 2.263 20 0 BEADLO CNc1cc(N[C@@H]2CCCC23CC3)[nH+]cn1 ZINC000706568113 712150181 /nfs/dbraw/zinc/15/01/81/712150181.db2.gz IMFJENLIVIQBHQ-SECBINFHSA-N 1 2 218.304 2.263 20 0 BEADLO CCOC(=O)C[NH2+][C@H](C)[C@@]12C[C@@H]1CCCC2 ZINC000709131592 712209991 /nfs/dbraw/zinc/20/99/91/712209991.db2.gz OYPOXCBJRPDUCD-NTZNESFSSA-N 1 2 225.332 2.108 20 0 BEADLO C[C@@H]([NH2+]Cc1ccccc1F)c1cn(C)cn1 ZINC000710010777 712240220 /nfs/dbraw/zinc/24/02/20/712240220.db2.gz IMBZKSUNICDSPG-SNVBAGLBSA-N 1 2 233.290 2.410 20 0 BEADLO Nc1[nH+]cccc1COC(=O)[C@]12C[C@H]1CCCC2 ZINC000922912527 712286605 /nfs/dbraw/zinc/28/66/05/712286605.db2.gz ZOJQRUBOEFXDHC-BXUZGUMPSA-N 1 2 246.310 2.287 20 0 BEADLO CC1(C)C[C@H](Cn2cc[nH+]c2)C(C)(C)O1 ZINC000711375668 712295685 /nfs/dbraw/zinc/29/56/85/712295685.db2.gz DFLBSBYOQMXGCS-SNVBAGLBSA-N 1 2 208.305 2.477 20 0 BEADLO Cc1ncsc1C[NH2+]Cc1nccn1C1CC1 ZINC000711817086 712332422 /nfs/dbraw/zinc/33/24/22/712332422.db2.gz KPLHZQLFFVNTMM-UHFFFAOYSA-N 1 2 248.355 2.273 20 0 BEADLO CC1(C)CCC[C@@H](C[N@@H+]2CCCC[C@H]2C[NH3+])O1 ZINC000714332677 712482143 /nfs/dbraw/zinc/48/21/43/712482143.db2.gz XOONDTDWMVOKRK-STQMWFEESA-N 1 2 240.391 2.147 20 0 BEADLO C[C@H]1CCCC[C@@H]1C(=O)NCc1ccc(N)[nH+]c1 ZINC000714404288 712485295 /nfs/dbraw/zinc/48/52/95/712485295.db2.gz LBTNWJXSGXPDIA-JQWIXIFHSA-N 1 2 247.342 2.106 20 0 BEADLO C[C@H](Nc1ccc([NH+](C)C)cc1)c1cn(C)nn1 ZINC000715852474 712536318 /nfs/dbraw/zinc/53/63/18/712536318.db2.gz OZGHIPUPUUXSOH-JTQLQIEISA-N 1 2 245.330 2.054 20 0 BEADLO C[N@H+](CCCF)CC(=O)c1ccccc1F ZINC000716646214 712568526 /nfs/dbraw/zinc/56/85/26/712568526.db2.gz XOBYSZGKUWDBLL-UHFFFAOYSA-N 1 2 227.254 2.300 20 0 BEADLO C[N@@H+](CCCF)CC(=O)c1ccccc1F ZINC000716646214 712568528 /nfs/dbraw/zinc/56/85/28/712568528.db2.gz XOBYSZGKUWDBLL-UHFFFAOYSA-N 1 2 227.254 2.300 20 0 BEADLO CCn1cc(C[N@H+](C)[C@@H](C)c2ccccc2)nn1 ZINC000883995784 712643222 /nfs/dbraw/zinc/64/32/22/712643222.db2.gz DGTWNMBCTQAIKF-LBPRGKRZSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1cc(C[N@@H+](C)[C@@H](C)c2ccccc2)nn1 ZINC000883995784 712643223 /nfs/dbraw/zinc/64/32/23/712643223.db2.gz DGTWNMBCTQAIKF-LBPRGKRZSA-N 1 2 244.342 2.491 20 0 BEADLO CC1(C)CO[C@@H](CNc2cccc[nH+]2)C1 ZINC000717568823 712661125 /nfs/dbraw/zinc/66/11/25/712661125.db2.gz PSNTYHKIMAPGFX-SNVBAGLBSA-N 1 2 206.289 2.309 20 0 BEADLO O=C(NCCc1[nH]cc[nH+]1)[C@H]1CCC=CCCC1 ZINC000719029100 712794038 /nfs/dbraw/zinc/79/40/38/712794038.db2.gz GPPQHUDCIANBDI-LBPRGKRZSA-N 1 2 247.342 2.205 20 0 BEADLO C[C@H]1CC[N@H+](Cc2ccc(Cl)nc2)CCO1 ZINC000720495354 712847587 /nfs/dbraw/zinc/84/75/87/712847587.db2.gz KTKGNGKRZQRTHR-JTQLQIEISA-N 1 2 240.734 2.346 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2ccc(Cl)nc2)CCO1 ZINC000720495354 712847589 /nfs/dbraw/zinc/84/75/89/712847589.db2.gz KTKGNGKRZQRTHR-JTQLQIEISA-N 1 2 240.734 2.346 20 0 BEADLO CCC(CC)N(CC)c1cc(N)nc[nH+]1 ZINC001167111438 957390664 /nfs/dbraw/zinc/39/06/64/957390664.db2.gz MXFFEHWURVWVCX-UHFFFAOYSA-N 1 2 208.309 2.074 20 0 BEADLO CN(Cc1ccn2cc[nH+]c2c1)CC(F)F ZINC001141050579 960840553 /nfs/dbraw/zinc/84/05/53/960840553.db2.gz CIBKDOZFHJVXSQ-UHFFFAOYSA-N 1 2 225.242 2.031 20 0 BEADLO C[C@]1(F)CCCC[N@H+](Cc2cocn2)C1 ZINC001141126342 960871069 /nfs/dbraw/zinc/87/10/69/960871069.db2.gz ILJSBMFCENSYNZ-NSHDSACASA-N 1 2 212.268 2.389 20 0 BEADLO C[C@]1(F)CCCC[N@@H+](Cc2cocn2)C1 ZINC001141126342 960871089 /nfs/dbraw/zinc/87/10/89/960871089.db2.gz ILJSBMFCENSYNZ-NSHDSACASA-N 1 2 212.268 2.389 20 0 BEADLO CCCC[C@@H](C(=O)NC1C[NH+](CC)C1)C(C)C ZINC001268492238 961874264 /nfs/dbraw/zinc/87/42/64/961874264.db2.gz TYIFCHQTOYNNGM-CYBMUJFWSA-N 1 2 240.391 2.269 20 0 BEADLO CC1(C)C[C@@H](Oc2cc[nH+]cc2)CCO1 ZINC001225296247 962062821 /nfs/dbraw/zinc/06/28/21/962062821.db2.gz SFZJZOBYFUYPBZ-NSHDSACASA-N 1 2 207.273 2.418 20 0 BEADLO COc1cc(C)c[nH+]c1N[C@@H](CO)C(C)(C)C ZINC001157758353 963719264 /nfs/dbraw/zinc/71/92/64/963719264.db2.gz BGXXMVPMHWZPAL-NSHDSACASA-N 1 2 238.331 2.218 20 0 BEADLO CCCNc1ccc([C@@H](C)C(=O)OC)c[nH+]1 ZINC001168132225 963821627 /nfs/dbraw/zinc/82/16/27/963821627.db2.gz LQKSGOZXKQAKEF-SECBINFHSA-N 1 2 222.288 2.180 20 0 BEADLO CNc1ccc(NCc2cnoc2C)c[nH+]1 ZINC001162272632 964900993 /nfs/dbraw/zinc/90/09/93/964900993.db2.gz NTSVYQARJNNRSA-UHFFFAOYSA-N 1 2 218.260 2.032 20 0 BEADLO CC(C)(C)C(=[NH2+])Nc1c[n+]([O-])ccc1Cl ZINC001162664506 965096741 /nfs/dbraw/zinc/09/67/41/965096741.db2.gz IRIYUIPDPHGSSO-UHFFFAOYSA-N 1 2 227.695 2.409 20 0 BEADLO Cc1nnc(C[N@@H+]2CCCCC23CC3)s1 ZINC001232247180 965319532 /nfs/dbraw/zinc/31/95/32/965319532.db2.gz RWNFZIDBBALVAV-UHFFFAOYSA-N 1 2 223.345 2.365 20 0 BEADLO Cc1nnc(C[N@H+]2CCCCC23CC3)s1 ZINC001232247180 965319551 /nfs/dbraw/zinc/31/95/51/965319551.db2.gz RWNFZIDBBALVAV-UHFFFAOYSA-N 1 2 223.345 2.365 20 0 BEADLO CC[C@@]12C[C@@H](CO1)[N@H+](Cc1cc(C)ns1)C2 ZINC001233312652 965486836 /nfs/dbraw/zinc/48/68/36/965486836.db2.gz DCKWFHQPHLYYCO-JQWIXIFHSA-N 1 2 238.356 2.205 20 0 BEADLO CC[C@@]12C[C@@H](CO1)[N@@H+](Cc1cc(C)ns1)C2 ZINC001233312652 965486845 /nfs/dbraw/zinc/48/68/45/965486845.db2.gz DCKWFHQPHLYYCO-JQWIXIFHSA-N 1 2 238.356 2.205 20 0 BEADLO CCOc1cc(NC2=CCOC2)cc(C)[nH+]1 ZINC001203386588 966624929 /nfs/dbraw/zinc/62/49/29/966624929.db2.gz LSRNAMOMQNGZNX-UHFFFAOYSA-N 1 2 220.272 2.115 20 0 BEADLO C[NH+](C)Cc1cc(Cl)c(O)cc1F ZINC001238141867 966725476 /nfs/dbraw/zinc/72/54/76/966725476.db2.gz ABFGKZMTUVQXLL-UHFFFAOYSA-N 1 2 203.644 2.246 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2cccnc2)C[C@@H]1F ZINC001204072694 966879710 /nfs/dbraw/zinc/87/97/10/966879710.db2.gz SGSCKOCXOVHTDX-NWDGAFQWSA-N 1 2 226.270 2.354 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2cccnc2)C[C@@H]1F ZINC001204072694 966879715 /nfs/dbraw/zinc/87/97/15/966879715.db2.gz SGSCKOCXOVHTDX-NWDGAFQWSA-N 1 2 226.270 2.354 20 0 BEADLO CCN(Cc1ccc(F)c(F)c1)C1C[NH+](C)C1 ZINC001204226647 966930004 /nfs/dbraw/zinc/93/00/04/966930004.db2.gz JALAQGXSFVRDDW-UHFFFAOYSA-N 1 2 240.297 2.101 20 0 BEADLO Cc1csc(C[NH+]2CC3(CCC3)C2)n1 ZINC001204374206 966984060 /nfs/dbraw/zinc/98/40/60/966984060.db2.gz CQUCSOZMPMCEDX-UHFFFAOYSA-N 1 2 208.330 2.437 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)oc1C ZINC001204530286 967029880 /nfs/dbraw/zinc/02/98/80/967029880.db2.gz CAZYFUFVNJMQLF-TXEJJXNPSA-N 1 2 221.300 2.260 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC3(CC3)C2)oc1C ZINC001204540281 967038857 /nfs/dbraw/zinc/03/88/57/967038857.db2.gz UXUWVJGIDJODSD-UHFFFAOYSA-N 1 2 221.300 2.261 20 0 BEADLO Cc1cc(C[N@H+]2CCOC3(CC3)C2)oc1C ZINC001204540281 967038868 /nfs/dbraw/zinc/03/88/68/967038868.db2.gz UXUWVJGIDJODSD-UHFFFAOYSA-N 1 2 221.300 2.261 20 0 BEADLO Cc1ncsc1C[N@@H+]1CCC(=O)C(C)(C)C1 ZINC001206988059 1165863902 /nfs/dbraw/zinc/86/39/02/1165863902.db2.gz XXVDVMHSIYXWPS-UHFFFAOYSA-N 1 2 238.356 2.253 20 0 BEADLO Cc1ncsc1C[N@H+]1CCC(=O)C(C)(C)C1 ZINC001206988059 1165863909 /nfs/dbraw/zinc/86/39/09/1165863909.db2.gz XXVDVMHSIYXWPS-UHFFFAOYSA-N 1 2 238.356 2.253 20 0 BEADLO COc1cccc(N)c1Nc1c[nH+]c(C)c(N)c1 ZINC001210289728 1165866314 /nfs/dbraw/zinc/86/63/14/1165866314.db2.gz YAKHFKZDKUIDQQ-UHFFFAOYSA-N 1 2 244.298 2.307 20 0 BEADLO Cc1cc(Cc2ccnn2C)cc(C)[nH+]1 ZINC001250437990 967858850 /nfs/dbraw/zinc/85/88/50/967858850.db2.gz ZTDWJUJKHVKBHC-UHFFFAOYSA-N 1 2 201.273 2.023 20 0 BEADLO Cc1c(F)cccc1C[NH+]1CC2(C1)CCCO2 ZINC001204509315 1165909495 /nfs/dbraw/zinc/90/94/95/1165909495.db2.gz YOXBNXIJLJZADC-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO COc1cnccc1C[N@@H+]1CCC[C@@H](F)C1 ZINC001206473514 968328169 /nfs/dbraw/zinc/32/81/69/968328169.db2.gz QKOVYAFFHXXEDC-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO COc1cnccc1C[N@H+]1CCC[C@@H](F)C1 ZINC001206473514 968328179 /nfs/dbraw/zinc/32/81/79/968328179.db2.gz QKOVYAFFHXXEDC-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO C[C@@H](C(=O)NC1CCCCCC1)n1cc[nH+]c1 ZINC000046761928 1165952455 /nfs/dbraw/zinc/95/24/55/1165952455.db2.gz SPEDNEGTZHWLKZ-NSHDSACASA-N 1 2 235.331 2.283 20 0 BEADLO CCCCOc1cc(NC[C@H](C)O)cc[nH+]1 ZINC001251955469 968392271 /nfs/dbraw/zinc/39/22/71/968392271.db2.gz QPLJMYZRBVSVBV-JTQLQIEISA-N 1 2 224.304 2.053 20 0 BEADLO CCC(CC)C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000822555081 968525964 /nfs/dbraw/zinc/52/59/64/968525964.db2.gz MWDHQFLLWBXPAI-UHFFFAOYSA-N 1 2 223.320 2.079 20 0 BEADLO C[N@H+](Cc1ncccc1F)C1CC(F)(F)C1 ZINC001207027004 968562515 /nfs/dbraw/zinc/56/25/15/968562515.db2.gz UOGQLPRQBJNYQU-UHFFFAOYSA-N 1 2 230.233 2.450 20 0 BEADLO C[N@@H+](Cc1ncccc1F)C1CC(F)(F)C1 ZINC001207027004 968562519 /nfs/dbraw/zinc/56/25/19/968562519.db2.gz UOGQLPRQBJNYQU-UHFFFAOYSA-N 1 2 230.233 2.450 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccccn1 ZINC000082645125 1166067455 /nfs/dbraw/zinc/06/74/55/1166067455.db2.gz QEPMRICNSBLJBB-ZDUSSCGKSA-N 1 2 218.300 2.025 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@H+]1Cc1ccccn1 ZINC000082645125 1166067460 /nfs/dbraw/zinc/06/74/60/1166067460.db2.gz QEPMRICNSBLJBB-ZDUSSCGKSA-N 1 2 218.300 2.025 20 0 BEADLO CC(=O)[C@H]1CCCC[N@@H+]1Cc1cnc(C)s1 ZINC000082645069 1166069010 /nfs/dbraw/zinc/06/90/10/1166069010.db2.gz RDLSOQFZUUGULY-GFCCVEGCSA-N 1 2 238.356 2.395 20 0 BEADLO CC(=O)[C@H]1CCCC[N@H+]1Cc1cnc(C)s1 ZINC000082645069 1166069017 /nfs/dbraw/zinc/06/90/17/1166069017.db2.gz RDLSOQFZUUGULY-GFCCVEGCSA-N 1 2 238.356 2.395 20 0 BEADLO Cc1cc(F)ccc1[C@@H](O)C[N@H+](C)CCC#N ZINC000083218578 1166098116 /nfs/dbraw/zinc/09/81/16/1166098116.db2.gz BLOPBGFPGBGSHZ-ZDUSSCGKSA-N 1 2 236.290 2.013 20 0 BEADLO Cc1cc(F)ccc1[C@@H](O)C[N@@H+](C)CCC#N ZINC000083218578 1166098122 /nfs/dbraw/zinc/09/81/22/1166098122.db2.gz BLOPBGFPGBGSHZ-ZDUSSCGKSA-N 1 2 236.290 2.013 20 0 BEADLO N#Cc1cccc(NCc2ccc[nH+]c2N)c1 ZINC000083353374 1166101546 /nfs/dbraw/zinc/10/15/46/1166101546.db2.gz LGRYVRSUWYFPTM-UHFFFAOYSA-N 1 2 224.267 2.148 20 0 BEADLO CO[C@@H](C)CNc1[nH+]cccc1OC(C)C ZINC000224352429 1166240013 /nfs/dbraw/zinc/24/00/13/1166240013.db2.gz XGHMRIBGHQUHHL-JTQLQIEISA-N 1 2 224.304 2.316 20 0 BEADLO Cc1nc(NC[C@]23C[C@H]2CCC3)cc[nH+]1 ZINC000693574452 1166268884 /nfs/dbraw/zinc/26/88/84/1166268884.db2.gz GFQWCIYYUDAONY-PWSUYJOCSA-N 1 2 203.289 2.387 20 0 BEADLO COCCOc1ccccc1-c1ccc[nH+]c1N ZINC000228966113 1166316828 /nfs/dbraw/zinc/31/68/28/1166316828.db2.gz PNXZNLPGGKYSAO-UHFFFAOYSA-N 1 2 244.294 2.356 20 0 BEADLO CCOC(=O)[C@H]1CC[C@H](C[NH+]2CC(F)C2)CC1 ZINC001209006316 969320300 /nfs/dbraw/zinc/32/03/00/969320300.db2.gz FKLONXJXTPZUHH-XYPYZODXSA-N 1 2 243.322 2.010 20 0 BEADLO CN(CC1CCCCC1)C(=O)C[C@@H]([NH3+])C(F)F ZINC000724760625 1166362392 /nfs/dbraw/zinc/36/23/92/1166362392.db2.gz ZHGLZPLQYPJHMR-SNVBAGLBSA-N 1 2 248.317 2.008 20 0 BEADLO Cc1cccc(C)c1NC(=O)C[C@H]([NH3+])C(F)F ZINC000724762047 1166360991 /nfs/dbraw/zinc/36/09/91/1166360991.db2.gz LSCOXZAKTMRJEK-VIFPVBQESA-N 1 2 242.269 2.224 20 0 BEADLO C[N@H+](Cc1c(F)ccc(N)c1F)C1CC1 ZINC000309067576 1166473129 /nfs/dbraw/zinc/47/31/29/1166473129.db2.gz AIEYLYKCHLIJMO-UHFFFAOYSA-N 1 2 212.243 2.141 20 0 BEADLO C[N@@H+](Cc1c(F)ccc(N)c1F)C1CC1 ZINC000309067576 1166473132 /nfs/dbraw/zinc/47/31/32/1166473132.db2.gz AIEYLYKCHLIJMO-UHFFFAOYSA-N 1 2 212.243 2.141 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)NCc1c[nH+]cn1C ZINC000292092794 1166481653 /nfs/dbraw/zinc/48/16/53/1166481653.db2.gz UZTGUHNYKBDGDC-UXBLZVDNSA-N 1 2 235.331 2.029 20 0 BEADLO Sc1ccc(O[C@@H]2CCCC[NH2+]C2)cc1 ZINC001217969278 1166501472 /nfs/dbraw/zinc/50/14/72/1166501472.db2.gz URJORGHQJCKXJV-LLVKDONJSA-N 1 2 223.341 2.496 20 0 BEADLO CCc1nnc(Nc2c[nH+]c(C)c(N)c2)s1 ZINC001210286311 969853747 /nfs/dbraw/zinc/85/37/47/969853747.db2.gz ZKENGEDMODQARA-UHFFFAOYSA-N 1 2 235.316 2.130 20 0 BEADLO Cc1cccnc1C[NH2+][C@@H]1C[C@H](C)n2ccnc21 ZINC000379004648 1166629153 /nfs/dbraw/zinc/62/91/53/1166629153.db2.gz DLSAVSCBIUGLNQ-NWDGAFQWSA-N 1 2 242.326 2.382 20 0 BEADLO CCC[C@@H](C)C(=O)OCc1cc[nH+]c(N)c1 ZINC000309278090 1166631576 /nfs/dbraw/zinc/63/15/76/1166631576.db2.gz MPGVRNIAYPHGLF-SECBINFHSA-N 1 2 222.288 2.143 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1csnn1)C1(Cl)CC1 ZINC000695665788 1166663406 /nfs/dbraw/zinc/66/34/06/1166663406.db2.gz DRRWMVIUXCGPAV-NKWVEPMBSA-N 1 2 231.752 2.349 20 0 BEADLO C[C@H](CC(F)(F)F)[N@H+](C)Cc1cnccn1 ZINC001255656726 970431207 /nfs/dbraw/zinc/43/12/07/970431207.db2.gz ADWQBGCOEGYBQU-MRVPVSSYSA-N 1 2 233.237 2.249 20 0 BEADLO C[C@H](CC(F)(F)F)[N@@H+](C)Cc1cnccn1 ZINC001255656726 970431215 /nfs/dbraw/zinc/43/12/15/970431215.db2.gz ADWQBGCOEGYBQU-MRVPVSSYSA-N 1 2 233.237 2.249 20 0 BEADLO CC(C)n1cc(-c2ccc[nH+]c2N)cn1 ZINC000396042529 1166731305 /nfs/dbraw/zinc/73/13/05/1166731305.db2.gz RNEIWXNQDBZCKC-UHFFFAOYSA-N 1 2 202.261 2.108 20 0 BEADLO Cc1cc(CO[C@@H]2CCOC[C@@H]2F)cc(C)[nH+]1 ZINC001223425984 1166863555 /nfs/dbraw/zinc/86/35/55/1166863555.db2.gz WIVJHRFTKQAWIP-QWHCGFSZSA-N 1 2 239.290 2.342 20 0 BEADLO C[C@H](c1nc(CCc2ccccc2)no1)[NH+](C)C ZINC000923769926 1166933872 /nfs/dbraw/zinc/93/38/72/1166933872.db2.gz JJYAKBSHSHXVDH-LLVKDONJSA-N 1 2 245.326 2.477 20 0 BEADLO C[NH+]1CC(Oc2cccc(OC(F)(F)F)c2)C1 ZINC001225325637 1166968810 /nfs/dbraw/zinc/96/88/10/1166968810.db2.gz IKACBENKRZHNCH-UHFFFAOYSA-N 1 2 247.216 2.278 20 0 BEADLO CC[C@H]1CC[C@H]([N@H+](C)Cc2noc(C)n2)C1 ZINC001173273767 975154399 /nfs/dbraw/zinc/15/43/99/975154399.db2.gz OPLRBNXSVLCQEY-QWRGUYRKSA-N 1 2 223.320 2.389 20 0 BEADLO CC[C@H]1CC[C@H]([N@@H+](C)Cc2noc(C)n2)C1 ZINC001173273767 975154408 /nfs/dbraw/zinc/15/44/08/975154408.db2.gz OPLRBNXSVLCQEY-QWRGUYRKSA-N 1 2 223.320 2.389 20 0 BEADLO Cc1ncc(C[NH2+]Cc2ccnn2C(C)C)o1 ZINC000397869851 1167027775 /nfs/dbraw/zinc/02/77/75/1167027775.db2.gz HOKHACOCLREWLX-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO c1cc2cc(C[NH2+]Cc3csnn3)ccc2[nH]1 ZINC000398327388 1167055228 /nfs/dbraw/zinc/05/52/28/1167055228.db2.gz JKKRSGSDWRJYPS-UHFFFAOYSA-N 1 2 244.323 2.309 20 0 BEADLO CC[C@H]1CC[C@@H]([N@@H+]2C[C@@H](F)C[C@H]2C(=O)OC)C1 ZINC001173280310 975234940 /nfs/dbraw/zinc/23/49/40/975234940.db2.gz LMPNYZJSFHQFPH-YFKTTZPYSA-N 1 2 243.322 2.151 20 0 BEADLO CC[C@H]1CC[C@@H]([N@H+]2C[C@@H](F)C[C@H]2C(=O)OC)C1 ZINC001173280310 975234947 /nfs/dbraw/zinc/23/49/47/975234947.db2.gz LMPNYZJSFHQFPH-YFKTTZPYSA-N 1 2 243.322 2.151 20 0 BEADLO CC[C@@H]1CC[C@H]([N@@H+]2CC[C@@H](O)C(F)(F)C2)C1 ZINC001173288974 975252850 /nfs/dbraw/zinc/25/28/50/975252850.db2.gz QACWHVMYUDEETP-OUAUKWLOSA-N 1 2 233.302 2.267 20 0 BEADLO CC[C@@H]1CC[C@H]([N@H+]2CC[C@@H](O)C(F)(F)C2)C1 ZINC001173288974 975252858 /nfs/dbraw/zinc/25/28/58/975252858.db2.gz QACWHVMYUDEETP-OUAUKWLOSA-N 1 2 233.302 2.267 20 0 BEADLO CC[C@@H]1CC[C@@H]([N@@H+]2CC[C@@H](O)C(F)(F)C2)C1 ZINC001173288971 975255373 /nfs/dbraw/zinc/25/53/73/975255373.db2.gz QACWHVMYUDEETP-GMTAPVOTSA-N 1 2 233.302 2.267 20 0 BEADLO CC[C@@H]1CC[C@@H]([N@H+]2CC[C@@H](O)C(F)(F)C2)C1 ZINC001173288971 975255387 /nfs/dbraw/zinc/25/53/87/975255387.db2.gz QACWHVMYUDEETP-GMTAPVOTSA-N 1 2 233.302 2.267 20 0 BEADLO FC[C@H]1CCC[N@H+](Cc2nnc(C3CC3)o2)C1 ZINC000880232255 1167076645 /nfs/dbraw/zinc/07/66/45/1167076645.db2.gz JSEZTDDIFBTOAM-SECBINFHSA-N 1 2 239.294 2.129 20 0 BEADLO FC[C@H]1CCC[N@@H+](Cc2nnc(C3CC3)o2)C1 ZINC000880232255 1167076649 /nfs/dbraw/zinc/07/66/49/1167076649.db2.gz JSEZTDDIFBTOAM-SECBINFHSA-N 1 2 239.294 2.129 20 0 BEADLO Cc1cc(Cn2cc[nH+]c2)cc(Cl)n1 ZINC000307394249 1167106119 /nfs/dbraw/zinc/10/61/19/1167106119.db2.gz CQNOZQYXOXIYOU-UHFFFAOYSA-N 1 2 207.664 2.288 20 0 BEADLO CCc1ncc(C[N@@H+]2CCO[C@@](C)(CC)C2)o1 ZINC001332968472 975346140 /nfs/dbraw/zinc/34/61/40/975346140.db2.gz PIGBYLFZBORRFA-ZDUSSCGKSA-N 1 2 238.331 2.238 20 0 BEADLO CCc1ncc(C[N@H+]2CCO[C@@](C)(CC)C2)o1 ZINC001332968472 975346148 /nfs/dbraw/zinc/34/61/48/975346148.db2.gz PIGBYLFZBORRFA-ZDUSSCGKSA-N 1 2 238.331 2.238 20 0 BEADLO CC[C@H](C)[C@H](C[NH2+][C@@H](C)c1noc(C)n1)OC ZINC001332998474 975363722 /nfs/dbraw/zinc/36/37/22/975363722.db2.gz FVAPXRISYBPNIN-QXEWZRGKSA-N 1 2 241.335 2.090 20 0 BEADLO Nc1cccc(O)c1Nc1ccn2cc[nH+]c2c1 ZINC001204996941 1167200566 /nfs/dbraw/zinc/20/05/66/1167200566.db2.gz BPGLIQUTIJKADA-UHFFFAOYSA-N 1 2 240.266 2.366 20 0 BEADLO CC[C@@H]([NH2+]CC=C(C)C)c1noc(C)n1 ZINC000308943475 1167224138 /nfs/dbraw/zinc/22/41/38/1167224138.db2.gz MWMNTHBAGIDBFN-SNVBAGLBSA-N 1 2 209.293 2.385 20 0 BEADLO CCOc1cc(Nc2cn[nH]c2)cc(C)[nH+]1 ZINC001174295829 976475880 /nfs/dbraw/zinc/47/58/80/976475880.db2.gz WRLNZMQIJVHSOF-UHFFFAOYSA-N 1 2 218.260 2.255 20 0 BEADLO COc1ncc(Nc2c[nH+]ccc2OC)s1 ZINC001175387469 977404710 /nfs/dbraw/zinc/40/47/10/977404710.db2.gz XOENRSHTVSPJSQ-UHFFFAOYSA-N 1 2 237.284 2.299 20 0 BEADLO Cc1nccnc1C[N@H+](C)CCC(F)(F)F ZINC001336757670 977928239 /nfs/dbraw/zinc/92/82/39/977928239.db2.gz XRKPYFXBXNTMIK-UHFFFAOYSA-N 1 2 233.237 2.169 20 0 BEADLO Cc1nccnc1C[N@@H+](C)CCC(F)(F)F ZINC001336757670 977928252 /nfs/dbraw/zinc/92/82/52/977928252.db2.gz XRKPYFXBXNTMIK-UHFFFAOYSA-N 1 2 233.237 2.169 20 0 BEADLO F[C@H]1CCCC[N@H+](Cc2cnsc2)C1 ZINC001232224218 977952425 /nfs/dbraw/zinc/95/24/25/977952425.db2.gz IBHMYOLVFJOZIE-JTQLQIEISA-N 1 2 214.309 2.467 20 0 BEADLO F[C@H]1CCCC[N@@H+](Cc2cnsc2)C1 ZINC001232224218 977952433 /nfs/dbraw/zinc/95/24/33/977952433.db2.gz IBHMYOLVFJOZIE-JTQLQIEISA-N 1 2 214.309 2.467 20 0 BEADLO Cc1ncccc1C[N@H+](C)Cc1cnsc1 ZINC001232228876 977956596 /nfs/dbraw/zinc/95/65/96/977956596.db2.gz BBAOMCUXUYJWND-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ncccc1C[N@@H+](C)Cc1cnsc1 ZINC001232228876 977956603 /nfs/dbraw/zinc/95/66/03/977956603.db2.gz BBAOMCUXUYJWND-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CCCn1cnc(C[NH+]2CC3(CCC3)C2)c1 ZINC001232796889 978286049 /nfs/dbraw/zinc/28/60/49/978286049.db2.gz DUQPQMWSTVILBC-UHFFFAOYSA-N 1 2 219.332 2.279 20 0 BEADLO CC[C@H](C)[C@H](C(=O)OC)[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC001168466335 1167758673 /nfs/dbraw/zinc/75/86/73/1167758673.db2.gz NEHRWNPWTSCIPL-IRCOFANPSA-N 1 2 245.338 2.254 20 0 BEADLO CC[C@H](C)[C@H](C(=O)OC)[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC001168466335 1167758682 /nfs/dbraw/zinc/75/86/82/1167758682.db2.gz NEHRWNPWTSCIPL-IRCOFANPSA-N 1 2 245.338 2.254 20 0 BEADLO Oc1cnc(Cl)cc1C[N@@H+]1CCC[C@H]2C[C@H]21 ZINC001233038596 978421075 /nfs/dbraw/zinc/42/10/75/978421075.db2.gz WKPPEHITZACACJ-WCBMZHEXSA-N 1 2 238.718 2.425 20 0 BEADLO Oc1cnc(Cl)cc1C[N@H+]1CCC[C@H]2C[C@H]21 ZINC001233038596 978421086 /nfs/dbraw/zinc/42/10/86/978421086.db2.gz WKPPEHITZACACJ-WCBMZHEXSA-N 1 2 238.718 2.425 20 0 BEADLO Oc1cnc(Cl)cc1C[N@@H+]1C[C@H]2CC[C@@H]1C2 ZINC001233034190 978418280 /nfs/dbraw/zinc/41/82/80/978418280.db2.gz HNXVGUOGURTSNZ-WCBMZHEXSA-N 1 2 238.718 2.425 20 0 BEADLO Oc1cnc(Cl)cc1C[N@H+]1C[C@H]2CC[C@@H]1C2 ZINC001233034190 978418290 /nfs/dbraw/zinc/41/82/90/978418290.db2.gz HNXVGUOGURTSNZ-WCBMZHEXSA-N 1 2 238.718 2.425 20 0 BEADLO O[C@H]1C[N@H+](Cc2ccsc2Cl)CC[C@H]1F ZINC001233053391 978447930 /nfs/dbraw/zinc/44/79/30/978447930.db2.gz ILRFLOJGJKBHOU-BDAKNGLRSA-N 1 2 249.738 2.306 20 0 BEADLO O[C@H]1C[N@@H+](Cc2ccsc2Cl)CC[C@H]1F ZINC001233053391 978447935 /nfs/dbraw/zinc/44/79/35/978447935.db2.gz ILRFLOJGJKBHOU-BDAKNGLRSA-N 1 2 249.738 2.306 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)sn1 ZINC001233310587 978534420 /nfs/dbraw/zinc/53/44/20/978534420.db2.gz NCIFZQDJULPZJB-INTQDDNPSA-N 1 2 226.320 2.241 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)sn1 ZINC001233310587 978534425 /nfs/dbraw/zinc/53/44/25/978534425.db2.gz NCIFZQDJULPZJB-INTQDDNPSA-N 1 2 226.320 2.241 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1cc(C)ns1 ZINC001233312910 978539000 /nfs/dbraw/zinc/53/90/00/978539000.db2.gz SVSYCVGGKBQNMF-LBPRGKRZSA-N 1 2 238.356 2.395 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@H+]1Cc1cc(C)ns1 ZINC001233312910 978539007 /nfs/dbraw/zinc/53/90/07/978539007.db2.gz SVSYCVGGKBQNMF-LBPRGKRZSA-N 1 2 238.356 2.395 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1sncc1C ZINC001233321956 978563583 /nfs/dbraw/zinc/56/35/83/978563583.db2.gz LPZMKWUULIQPOD-NSHDSACASA-N 1 2 238.356 2.395 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@H+]1Cc1sncc1C ZINC001233321956 978563586 /nfs/dbraw/zinc/56/35/86/978563586.db2.gz LPZMKWUULIQPOD-NSHDSACASA-N 1 2 238.356 2.395 20 0 BEADLO COC[C@H]1CCCN(c2cc(F)cc(C)[nH+]2)C1 ZINC001339579743 978873810 /nfs/dbraw/zinc/87/38/10/978873810.db2.gz WDDABQQJPDLPHK-NSHDSACASA-N 1 2 238.306 2.392 20 0 BEADLO Cc1ncn(C)c1C[N@@H+]1CC[C@@](C)(F)[C@@H](F)C1 ZINC001235539560 979078616 /nfs/dbraw/zinc/07/86/16/979078616.db2.gz VSZKOPWDNLGCDZ-NWDGAFQWSA-N 1 2 243.301 2.001 20 0 BEADLO Cc1ncn(C)c1C[N@H+]1CC[C@@](C)(F)[C@@H](F)C1 ZINC001235539560 979078625 /nfs/dbraw/zinc/07/86/25/979078625.db2.gz VSZKOPWDNLGCDZ-NWDGAFQWSA-N 1 2 243.301 2.001 20 0 BEADLO c1coc(Nc2ccc[nH+]c2N2CCOCC2)c1 ZINC001212355821 1168284705 /nfs/dbraw/zinc/28/47/05/1168284705.db2.gz CHXBXVQMUBCVKT-UHFFFAOYSA-N 1 2 245.282 2.255 20 0 BEADLO CCCOC1C[NH+](CC2OC=CC2=S)C1 ZINC001237178334 979830034 /nfs/dbraw/zinc/83/00/34/979830034.db2.gz JLRZMMHKWIZSTE-UHFFFAOYSA-N 1 2 227.329 2.179 20 0 BEADLO FC(F)Oc1cc(C[N@@H+]2CC[C@H](F)C2)ccn1 ZINC001237610389 979970463 /nfs/dbraw/zinc/97/04/63/979970463.db2.gz GARCNYFPGXOAOS-VIFPVBQESA-N 1 2 246.232 2.227 20 0 BEADLO FC(F)Oc1cc(C[N@H+]2CC[C@H](F)C2)ccn1 ZINC001237610389 979970464 /nfs/dbraw/zinc/97/04/64/979970464.db2.gz GARCNYFPGXOAOS-VIFPVBQESA-N 1 2 246.232 2.227 20 0 BEADLO CN(C)c1ccc(-c2cccc(N)[nH+]2)cc1 ZINC000038068932 1168420934 /nfs/dbraw/zinc/42/09/34/1168420934.db2.gz CCLZPRVJEWTCNA-UHFFFAOYSA-N 1 2 213.284 2.397 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2nnc[nH]2)s1 ZINC000037919068 1168421035 /nfs/dbraw/zinc/42/10/35/1168421035.db2.gz GVGYPRWSQNDRNU-QMMMGPOBSA-N 1 2 222.317 2.025 20 0 BEADLO CCN(Cc1ccsc1C)C1C[NH+](C)C1 ZINC001237974055 980119067 /nfs/dbraw/zinc/11/90/67/980119067.db2.gz KHSJLDPNRZARGB-UHFFFAOYSA-N 1 2 224.373 2.192 20 0 BEADLO COc1cc(C[N@@H+]2CC[C@@H]2C)c(Cl)cn1 ZINC001238360727 980235753 /nfs/dbraw/zinc/23/57/53/980235753.db2.gz OKAXTQNOEQGJCG-QMMMGPOBSA-N 1 2 226.707 2.338 20 0 BEADLO COc1cc(C[N@H+]2CC[C@@H]2C)c(Cl)cn1 ZINC001238360727 980235764 /nfs/dbraw/zinc/23/57/64/980235764.db2.gz OKAXTQNOEQGJCG-QMMMGPOBSA-N 1 2 226.707 2.338 20 0 BEADLO Clc1cnccc1C[NH2+]Cc1ccno1 ZINC000231896225 1168452015 /nfs/dbraw/zinc/45/20/15/1168452015.db2.gz JLUDYSMJOBESBH-UHFFFAOYSA-N 1 2 223.663 2.013 20 0 BEADLO C[C@@H](C[N@@H+]1CCC(=O)[C@H](C)C1)C(F)(F)F ZINC000335059020 980524944 /nfs/dbraw/zinc/52/49/44/980524944.db2.gz BAYPJQMPOBSGBC-SFYZADRCSA-N 1 2 223.238 2.096 20 0 BEADLO C[C@@H](C[N@H+]1CCC(=O)[C@H](C)C1)C(F)(F)F ZINC000335059020 980524949 /nfs/dbraw/zinc/52/49/49/980524949.db2.gz BAYPJQMPOBSGBC-SFYZADRCSA-N 1 2 223.238 2.096 20 0 BEADLO O=C(CC[NH2+]CC(F)F)Nc1cccc(F)c1 ZINC001346226937 980791586 /nfs/dbraw/zinc/79/15/86/980791586.db2.gz YQRPXHPZIKVRDP-UHFFFAOYSA-N 1 2 246.232 2.009 20 0 BEADLO COCn1cc(-c2cn3cc[nH+]c3cc2C)cn1 ZINC001245220429 1168592917 /nfs/dbraw/zinc/59/29/17/1168592917.db2.gz IZLVSYIZBTZHDM-UHFFFAOYSA-N 1 2 242.282 2.110 20 0 BEADLO CC(C)CC[C@@H]1CCC[C@H]1[NH2+]Cc1ncn[nH]1 ZINC001347114018 980974125 /nfs/dbraw/zinc/97/41/25/980974125.db2.gz NXYUFYLFLJPHBB-NWDGAFQWSA-N 1 2 236.363 2.499 20 0 BEADLO CS[C@@H]1CC[C@@H]([N@H+](C)Cc2cnsn2)C1 ZINC001349761263 981705902 /nfs/dbraw/zinc/70/59/02/981705902.db2.gz WFVAJJDAKQIHKW-NXEZZACHSA-N 1 2 243.401 2.254 20 0 BEADLO CS[C@@H]1CC[C@@H]([N@@H+](C)Cc2cnsn2)C1 ZINC001349761263 981705916 /nfs/dbraw/zinc/70/59/16/981705916.db2.gz WFVAJJDAKQIHKW-NXEZZACHSA-N 1 2 243.401 2.254 20 0 BEADLO CCC=CNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001151976373 1168785142 /nfs/dbraw/zinc/78/51/42/1168785142.db2.gz LRJURIRJKSQQCE-HWKANZROSA-N 1 2 215.256 2.216 20 0 BEADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1ncc[nH]1 ZINC001203980037 1168846112 /nfs/dbraw/zinc/84/61/12/1168846112.db2.gz KGFZCHTZTVFORQ-LLVKDONJSA-N 1 2 227.311 2.357 20 0 BEADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1ncc[nH]1 ZINC001203980037 1168846121 /nfs/dbraw/zinc/84/61/21/1168846121.db2.gz KGFZCHTZTVFORQ-LLVKDONJSA-N 1 2 227.311 2.357 20 0 BEADLO Cn1c[nH+]c2cc(Nc3cccc(=O)[nH]3)ccc21 ZINC001212791593 1168940890 /nfs/dbraw/zinc/94/08/90/1168940890.db2.gz UXHXKZJWRFKZIV-UHFFFAOYSA-N 1 2 240.266 2.418 20 0 BEADLO CC(C)NC(=S)Nc1cccc2[nH+]ccn21 ZINC001200774087 983353011 /nfs/dbraw/zinc/35/30/11/983353011.db2.gz ZRWFRNXWNIQYBS-UHFFFAOYSA-N 1 2 234.328 2.029 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)[C@@H](C)n1cc[nH+]c1 ZINC000052902289 1169134859 /nfs/dbraw/zinc/13/48/59/1169134859.db2.gz VDZAWQPZIZJHAI-GHMZBOCLSA-N 1 2 223.320 2.091 20 0 BEADLO CCC[C@@H](O)CNc1ccc([NH+](C)C)cc1 ZINC001252771946 983875144 /nfs/dbraw/zinc/87/51/44/983875144.db2.gz XGSFIYHAKQJLMA-CYBMUJFWSA-N 1 2 222.332 2.326 20 0 BEADLO Clc1cc2c(cn1)C[N@H+](C[C@@H]1CCOC1)C2 ZINC001202539809 983916888 /nfs/dbraw/zinc/91/68/88/983916888.db2.gz BYKKUGXYEHUALN-VIFPVBQESA-N 1 2 238.718 2.087 20 0 BEADLO Clc1cc2c(cn1)C[N@@H+](C[C@@H]1CCOC1)C2 ZINC001202539809 983916908 /nfs/dbraw/zinc/91/69/08/983916908.db2.gz BYKKUGXYEHUALN-VIFPVBQESA-N 1 2 238.718 2.087 20 0 BEADLO CC(C)OCC[C@@H](C)[NH2+][C@H]1CC1(F)F ZINC001172431888 974716728 /nfs/dbraw/zinc/71/67/28/974716728.db2.gz SBXHCLCGKMLZKT-BDAKNGLRSA-N 1 2 207.264 2.187 20 0 BEADLO CC(C)OCC[C@H](C)[N@@H+]1CCCC(=O)[C@H](F)C1 ZINC001172445244 974807377 /nfs/dbraw/zinc/80/73/77/974807377.db2.gz XVJDCRSTCWIZSF-NWDGAFQWSA-N 1 2 245.338 2.193 20 0 BEADLO CC(C)OCC[C@H](C)[N@H+]1CCCC(=O)[C@H](F)C1 ZINC001172445244 974807383 /nfs/dbraw/zinc/80/73/83/974807383.db2.gz XVJDCRSTCWIZSF-NWDGAFQWSA-N 1 2 245.338 2.193 20 0 BEADLO CC[C@@H](C)[C@@H]1CCCC[N@@H+]1Cc1nc[nH]n1 ZINC001327545038 972624122 /nfs/dbraw/zinc/62/41/22/972624122.db2.gz CZBPFXTVRGRJEA-MNOVXSKESA-N 1 2 222.336 2.205 20 0 BEADLO CC[C@@H](C)[C@@H]1CCCC[N@H+]1Cc1nc[nH]n1 ZINC001327545038 972624130 /nfs/dbraw/zinc/62/41/30/972624130.db2.gz CZBPFXTVRGRJEA-MNOVXSKESA-N 1 2 222.336 2.205 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1ccc(C)c(F)c1F ZINC001137972399 1169350123 /nfs/dbraw/zinc/35/01/23/1169350123.db2.gz OZIHSMDTGHYEEW-NSHDSACASA-N 1 2 241.281 2.494 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1ccc(C)c(F)c1F ZINC001137972399 1169350136 /nfs/dbraw/zinc/35/01/36/1169350136.db2.gz OZIHSMDTGHYEEW-NSHDSACASA-N 1 2 241.281 2.494 20 0 BEADLO CC(C)(C)C(=O)Nc1ncccc1C[NH+]1CCC1 ZINC001138539239 1169360695 /nfs/dbraw/zinc/36/06/95/1169360695.db2.gz SSNAEILGZVEHAG-UHFFFAOYSA-N 1 2 247.342 2.272 20 0 BEADLO CC[N@H+](C)Cc1cc(F)c(O)cc1F ZINC001144646799 972908009 /nfs/dbraw/zinc/90/80/09/972908009.db2.gz LDUCEGUWDFRXOI-UHFFFAOYSA-N 1 2 201.216 2.122 20 0 BEADLO CC[N@@H+](C)Cc1cc(F)c(O)cc1F ZINC001144646799 972908020 /nfs/dbraw/zinc/90/80/20/972908020.db2.gz LDUCEGUWDFRXOI-UHFFFAOYSA-N 1 2 201.216 2.122 20 0 BEADLO CC(C)CC[C@H](C)[N@@H+]1CCNCC(F)(F)C1 ZINC001256363886 970766085 /nfs/dbraw/zinc/76/60/85/970766085.db2.gz NPUMYTGVIYYWPE-NSHDSACASA-N 1 2 234.334 2.352 20 0 BEADLO CC(C)CC[C@H](C)[N@H+]1CCNCC(F)(F)C1 ZINC001256363886 970766096 /nfs/dbraw/zinc/76/60/96/970766096.db2.gz NPUMYTGVIYYWPE-NSHDSACASA-N 1 2 234.334 2.352 20 0 BEADLO CC(C)CC[C@H](C)N1CC[NH2+]CC(F)(F)C1 ZINC001256363886 970766105 /nfs/dbraw/zinc/76/61/05/970766105.db2.gz NPUMYTGVIYYWPE-NSHDSACASA-N 1 2 234.334 2.352 20 0 BEADLO CNc1ccc(Nc2cccc(N)c2)c[nH+]1 ZINC001159465477 1169437567 /nfs/dbraw/zinc/43/75/67/1169437567.db2.gz XAFRBIIOKNXDOB-UHFFFAOYSA-N 1 2 214.272 2.449 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1cccnc1N ZINC001243476975 970771362 /nfs/dbraw/zinc/77/13/62/970771362.db2.gz XJCFFFKGXMAIFI-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO Nc1[nH+]cccc1-c1cncc2[nH]ccc21 ZINC001243475926 970775428 /nfs/dbraw/zinc/77/54/28/970775428.db2.gz MTMBHGDVQJEFRD-UHFFFAOYSA-N 1 2 210.240 2.207 20 0 BEADLO CC(C)Cc1nnc([C@H]2CC3CC[NH+]2CC3)o1 ZINC001256400444 970809496 /nfs/dbraw/zinc/80/94/96/970809496.db2.gz NFULGNCQTOMKKS-LLVKDONJSA-N 1 2 235.331 2.425 20 0 BEADLO COc1cncc(Nc2[nH+]cc(C)cc2N)c1C ZINC001215731641 970816002 /nfs/dbraw/zinc/81/60/02/970816002.db2.gz OCRIUSCBTYOUNR-UHFFFAOYSA-N 1 2 244.298 2.428 20 0 BEADLO Cc1ccc(Nc2ccc(O)c(CO)c2)[nH+]c1 ZINC001216136596 970952409 /nfs/dbraw/zinc/95/24/09/970952409.db2.gz UDYVTSXSXFKEGI-UHFFFAOYSA-N 1 2 230.267 2.332 20 0 BEADLO CN(C)c1cc(-c2ccc(CCO)cc2)cc[nH+]1 ZINC001243847008 970989248 /nfs/dbraw/zinc/98/92/48/970989248.db2.gz SZOQBZRTWVPUAS-UHFFFAOYSA-N 1 2 242.322 2.349 20 0 BEADLO Cc1nc2ncc(C3=C[NH2+]CCC3)nc2s1 ZINC001243946970 971034955 /nfs/dbraw/zinc/03/49/55/971034955.db2.gz CATSJYCUJZNCTN-UHFFFAOYSA-N 1 2 232.312 2.119 20 0 BEADLO CC(C)[NH+]1CCC([NH2+]C2=CC=C[CH]2)CC1 ZINC001257210043 971129084 /nfs/dbraw/zinc/12/90/84/971129084.db2.gz FQKOOOVSTFKUDC-UHFFFAOYSA-N 1 2 205.325 2.107 20 0 BEADLO C[C@]1(CO)CC[N@H+](Cc2cnc(Cl)s2)C1 ZINC000307231115 971145509 /nfs/dbraw/zinc/14/55/09/971145509.db2.gz CADRYCVSMYAUFL-JTQLQIEISA-N 1 2 246.763 2.001 20 0 BEADLO C[C@]1(CO)CC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC000307231115 971145516 /nfs/dbraw/zinc/14/55/16/971145516.db2.gz CADRYCVSMYAUFL-JTQLQIEISA-N 1 2 246.763 2.001 20 0 BEADLO C[C@H]1C[C@H]1c1nnc([C@@H]([NH3+])COC(C)(C)C)o1 ZINC001217695185 971331141 /nfs/dbraw/zinc/33/11/41/971331141.db2.gz DDWDGLITLPOWNP-YIZRAAEISA-N 1 2 239.319 2.008 20 0 BEADLO C[C@H]1C[C@H]1c1nnc([C@H]([NH3+])COC(C)(C)C)o1 ZINC001217700354 971340269 /nfs/dbraw/zinc/34/02/69/971340269.db2.gz DDWDGLITLPOWNP-DJLDLDEBSA-N 1 2 239.319 2.008 20 0 BEADLO CC(C)Cc1nnc([C@H]([NH3+])COC(C)(C)C)o1 ZINC001217702207 971342808 /nfs/dbraw/zinc/34/28/08/971342808.db2.gz YQOOJKHFJRAWFZ-SECBINFHSA-N 1 2 241.335 2.083 20 0 BEADLO CCc1nnc([C@H]2CC[C@@H](C(F)(F)F)C[NH2+]2)o1 ZINC001217706048 971342873 /nfs/dbraw/zinc/34/28/73/971342873.db2.gz LOZNCTOUDIJVOZ-RNFRBKRXSA-N 1 2 249.236 2.235 20 0 BEADLO Nc1cc(-c2cccc(Cl)c2CO)cc[nH+]1 ZINC001244574549 971347231 /nfs/dbraw/zinc/34/72/31/971347231.db2.gz SVRKVJCTPPJTDB-UHFFFAOYSA-N 1 2 234.686 2.477 20 0 BEADLO CC(C)CCCO[C@H]1C[NH2+]CC(F)(F)C1 ZINC001217854666 971445603 /nfs/dbraw/zinc/44/56/03/971445603.db2.gz CWOKOBLBVLSVJS-SNVBAGLBSA-N 1 2 221.291 2.436 20 0 BEADLO CNc1ccc(O[C@H]2CC[NH2+]CC2(F)F)cc1 ZINC001218010973 971568540 /nfs/dbraw/zinc/56/85/40/971568540.db2.gz CYLFJXIVOMQTRN-NSHDSACASA-N 1 2 242.269 2.104 20 0 BEADLO CNc1ccc(O[C@@H]2CC[NH2+]CC2(F)F)cc1 ZINC001218010955 971569316 /nfs/dbraw/zinc/56/93/16/971569316.db2.gz CYLFJXIVOMQTRN-LLVKDONJSA-N 1 2 242.269 2.104 20 0 BEADLO CCc1cccnc1O[C@H]1CC[NH2+]CC1(F)F ZINC001218011352 971568915 /nfs/dbraw/zinc/56/89/15/971568915.db2.gz GNSBKHYJNMIVKU-JTQLQIEISA-N 1 2 242.269 2.020 20 0 BEADLO Cc1cc(S)ccc1O[C@H]1CC[NH2+]C1 ZINC001218180788 971615789 /nfs/dbraw/zinc/61/57/89/971615789.db2.gz CJBHMKZEEHJNTR-VIFPVBQESA-N 1 2 209.314 2.024 20 0 BEADLO CC(C)(C)OC(=O)C[NH2+][C@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170716517 971636898 /nfs/dbraw/zinc/63/68/98/971636898.db2.gz VMPDAFRBIABIHC-JGPRNRPPSA-N 1 2 239.359 2.352 20 0 BEADLO CNc1ccc(O[C@@H]2C[NH2+]CC(F)(F)C2)cc1 ZINC001218278349 971670615 /nfs/dbraw/zinc/67/06/15/971670615.db2.gz MCPMXQSUFRIAGK-NSHDSACASA-N 1 2 242.269 2.104 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@@H]2C[C@@H]3[C@H](C2)C3(C)C)no1 ZINC001170747007 971712168 /nfs/dbraw/zinc/71/21/68/971712168.db2.gz QIJOGXNCOBAXCD-RTCCRHLQSA-N 1 2 235.331 2.244 20 0 BEADLO Cc1nc(C[N@H+](C)[C@@H]2C[C@@H]3[C@H](C2)C3(C)C)no1 ZINC001170747007 971712174 /nfs/dbraw/zinc/71/21/74/971712174.db2.gz QIJOGXNCOBAXCD-RTCCRHLQSA-N 1 2 235.331 2.244 20 0 BEADLO Cc1cc(S)ccc1O[C@@H]1C[NH2+][C@H]1C ZINC001218384465 971763448 /nfs/dbraw/zinc/76/34/48/971763448.db2.gz DOQDQBLVYMFPMY-GZMMTYOYSA-N 1 2 209.314 2.023 20 0 BEADLO Fc1ccc(-c2cc[nH]n2)cc1-n1cc[nH+]c1 ZINC001245315005 971782938 /nfs/dbraw/zinc/78/29/38/971782938.db2.gz RDVJCHQRRCBACL-UHFFFAOYSA-N 1 2 228.230 2.402 20 0 BEADLO FC(F)(F)C(F)(F)C[NH2+][C@@H]1CCCOCC1 ZINC001170775241 971801371 /nfs/dbraw/zinc/80/13/71/971801371.db2.gz HJSIPDLMPQXQJX-SSDOTTSWSA-N 1 2 247.207 2.343 20 0 BEADLO O[C@H]1C[C@@H](COc2ccc(-n3cc[nH+]c3)cc2)C1 ZINC001218433099 971811121 /nfs/dbraw/zinc/81/11/21/971811121.db2.gz BLWOSBVMIPQWHJ-BJHJDKERSA-N 1 2 244.294 2.022 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc3c(c2)CCO3)CCC1=O ZINC000720697163 971826492 /nfs/dbraw/zinc/82/64/92/971826492.db2.gz IPRUKUHUMKNXEZ-LLVKDONJSA-N 1 2 245.322 2.032 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc3c(c2)CCO3)CCC1=O ZINC000720697163 971826497 /nfs/dbraw/zinc/82/64/97/971826497.db2.gz IPRUKUHUMKNXEZ-LLVKDONJSA-N 1 2 245.322 2.032 20 0 BEADLO Cc1cn2c(cccc2-c2cnc(N)c(F)c2)[nH+]1 ZINC001245521496 971843515 /nfs/dbraw/zinc/84/35/15/971843515.db2.gz YLBVQKWBLRIDLO-UHFFFAOYSA-N 1 2 242.257 2.426 20 0 BEADLO CC[C@H](C)OCC[C@@H](C)[N@@H+]1CCCC(=O)C1 ZINC001172343910 974610503 /nfs/dbraw/zinc/61/05/03/974610503.db2.gz WOUBMWCXJQNXLF-NEPJUHHUSA-N 1 2 227.348 2.245 20 0 BEADLO CC[C@H](C)OCC[C@@H](C)[N@H+]1CCCC(=O)C1 ZINC001172343910 974610511 /nfs/dbraw/zinc/61/05/11/974610511.db2.gz WOUBMWCXJQNXLF-NEPJUHHUSA-N 1 2 227.348 2.245 20 0 BEADLO Cc1cc(-c2cc(O)cc(F)c2)c[nH+]c1N ZINC001241271076 1169716522 /nfs/dbraw/zinc/71/65/22/1169716522.db2.gz KXZJZWDBGSSJFU-UHFFFAOYSA-N 1 2 218.231 2.484 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1ccc(F)c(C)c1 ZINC001136609477 972214371 /nfs/dbraw/zinc/21/43/71/972214371.db2.gz MQHVQYPYIACEIT-LBPRGKRZSA-N 1 2 236.290 2.167 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1ccc(F)c(C)c1 ZINC001136609477 972214376 /nfs/dbraw/zinc/21/43/76/972214376.db2.gz MQHVQYPYIACEIT-LBPRGKRZSA-N 1 2 236.290 2.167 20 0 BEADLO FC1(F)CCCC[N@H+](C[C@H]2CCCO2)C1 ZINC001207847966 956869436 /nfs/dbraw/zinc/86/94/36/956869436.db2.gz ZCXCPNIYOODZMA-SNVBAGLBSA-N 1 2 219.275 2.287 20 0 BEADLO FC1(F)CCCC[N@@H+](C[C@H]2CCCO2)C1 ZINC001207847966 956869439 /nfs/dbraw/zinc/86/94/39/956869439.db2.gz ZCXCPNIYOODZMA-SNVBAGLBSA-N 1 2 219.275 2.287 20 0 BEADLO CC(C)(C)OC(=O)N1CC[N@H+](CCC2CC2)C1 ZINC001208685582 957124066 /nfs/dbraw/zinc/12/40/66/957124066.db2.gz BXXOLLHGWCIZAU-UHFFFAOYSA-N 1 2 240.347 2.297 20 0 BEADLO CC(C)(C)OC(=O)N1CC[N@@H+](CCC2CC2)C1 ZINC001208685582 957124080 /nfs/dbraw/zinc/12/40/80/957124080.db2.gz BXXOLLHGWCIZAU-UHFFFAOYSA-N 1 2 240.347 2.297 20 0 BEADLO CCCOC1C[NH+](C[C@H](C)C(F)(F)F)C1 ZINC001208894055 957210733 /nfs/dbraw/zinc/21/07/33/957210733.db2.gz NRELVBPWNPYYJN-QMMMGPOBSA-N 1 2 225.254 2.296 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2ccccn2)C[C@@H]1F ZINC001204056155 972258710 /nfs/dbraw/zinc/25/87/10/972258710.db2.gz UYRSDBWYAHEJBH-NWDGAFQWSA-N 1 2 226.270 2.354 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2ccccn2)C[C@@H]1F ZINC001204056155 972258718 /nfs/dbraw/zinc/25/87/18/972258718.db2.gz UYRSDBWYAHEJBH-NWDGAFQWSA-N 1 2 226.270 2.354 20 0 BEADLO COCCCC[N@@H+]1CCC[C@@H](F)C(F)(F)C1 ZINC001209214946 957358526 /nfs/dbraw/zinc/35/85/26/957358526.db2.gz YTOAQGXSYCNKEN-SNVBAGLBSA-N 1 2 239.281 2.482 20 0 BEADLO COCCCC[N@H+]1CCC[C@@H](F)C(F)(F)C1 ZINC001209214946 957358537 /nfs/dbraw/zinc/35/85/37/957358537.db2.gz YTOAQGXSYCNKEN-SNVBAGLBSA-N 1 2 239.281 2.482 20 0 BEADLO C/C(=C\C(=O)NCCc1[nH+]ccn1C)C(C)(C)C ZINC000079781802 957365837 /nfs/dbraw/zinc/36/58/37/957365837.db2.gz UCISTLBLNIKFCV-ZHACJKMWSA-N 1 2 249.358 2.071 20 0 BEADLO c1cn(-c2ccc(NC3=CCOC3)cc2)c[nH+]1 ZINC001203388644 957514156 /nfs/dbraw/zinc/51/41/56/957514156.db2.gz BRJJCHFYYLMWRY-UHFFFAOYSA-N 1 2 227.267 2.198 20 0 BEADLO c1cn(Cc2ccc(NC3=CCOC3)cc2)c[nH+]1 ZINC001203389831 957519892 /nfs/dbraw/zinc/51/98/92/957519892.db2.gz HIIFKIDOTVMKMN-UHFFFAOYSA-N 1 2 241.294 2.257 20 0 BEADLO COc1ccc(C)[nH+]c1N1CC[C@H]2OCC[C@H]2C1 ZINC001167212782 957545698 /nfs/dbraw/zinc/54/56/98/957545698.db2.gz GPAJLKORMBFWEO-NWDGAFQWSA-N 1 2 248.326 2.014 20 0 BEADLO c1cn(-c2ccccc2Nc2ccnnc2)c[nH+]1 ZINC001209959582 957582491 /nfs/dbraw/zinc/58/24/91/957582491.db2.gz XLUHATBBHUULEW-UHFFFAOYSA-N 1 2 237.266 2.406 20 0 BEADLO Cc1cc(Nc2[nH+]cccc2CCO)ccc1O ZINC001209976128 957596289 /nfs/dbraw/zinc/59/62/89/957596289.db2.gz GJBHVGIDOXCPPX-UHFFFAOYSA-N 1 2 244.294 2.374 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cccc(F)n2)C[C@@H]1F ZINC001140131590 957603471 /nfs/dbraw/zinc/60/34/71/957603471.db2.gz OIGBKHXZTXFXQJ-SCZZXKLOSA-N 1 2 212.243 2.011 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cccc(F)n2)C[C@@H]1F ZINC001140131590 957603476 /nfs/dbraw/zinc/60/34/76/957603476.db2.gz OIGBKHXZTXFXQJ-SCZZXKLOSA-N 1 2 212.243 2.011 20 0 BEADLO Cc1conc1Nc1c[nH+]c(C)c(N)c1 ZINC001210285816 957714258 /nfs/dbraw/zinc/71/42/58/957714258.db2.gz SNYZNGBYUXYAEH-UHFFFAOYSA-N 1 2 204.233 2.012 20 0 BEADLO Cc1ccc(O)c(Nc2c[nH]c(=O)c(F)c2)[nH+]1 ZINC001210599554 957818581 /nfs/dbraw/zinc/81/85/81/957818581.db2.gz YDBPUKQBZSTNHS-UHFFFAOYSA-N 1 2 235.218 2.079 20 0 BEADLO O=c1[nH]cc(Nc2ccn3cc[nH+]c3c2)cc1F ZINC001210600515 957822269 /nfs/dbraw/zinc/82/22/69/957822269.db2.gz OTACEUODMHXFQU-UHFFFAOYSA-N 1 2 244.229 2.318 20 0 BEADLO Cc1cc(CN2CCn3c[nH+]cc3C2)oc1C ZINC001204532218 957931612 /nfs/dbraw/zinc/93/16/12/957931612.db2.gz BHERJIFVVFQREM-UHFFFAOYSA-N 1 2 231.299 2.109 20 0 BEADLO Cc1cccn2c(CN3CCCCO3)c[nH+]c12 ZINC001136958647 972304785 /nfs/dbraw/zinc/30/47/85/972304785.db2.gz YQXSBQHWFHYBEH-UHFFFAOYSA-N 1 2 231.299 2.170 20 0 BEADLO C[C@H](C(=O)N1CCC[C@@H](C2CC2)C1)n1cc[nH+]c1 ZINC001347513571 957958429 /nfs/dbraw/zinc/95/84/29/957958429.db2.gz IHGSVQBPFKBMQY-DGCLKSJQSA-N 1 2 247.342 2.093 20 0 BEADLO Cc1cn2c(cccc2Nc2ccncn2)[nH+]1 ZINC001211023185 957987675 /nfs/dbraw/zinc/98/76/75/957987675.db2.gz QWSCHJHEWMUNDL-UHFFFAOYSA-N 1 2 225.255 2.176 20 0 BEADLO c1cn(-c2ccccc2Nc2ccncn2)c[nH+]1 ZINC001211029338 957996209 /nfs/dbraw/zinc/99/62/09/957996209.db2.gz XPGJDVWOEXLHGF-UHFFFAOYSA-N 1 2 237.266 2.406 20 0 BEADLO COc1cccc(Nc2c[nH+]ccc2OC)n1 ZINC001211297750 958141336 /nfs/dbraw/zinc/14/13/36/958141336.db2.gz UOBKOVDOTFPMRM-UHFFFAOYSA-N 1 2 231.255 2.237 20 0 BEADLO CC(C(=O)NC[C@H](C)Cn1cc[nH+]c1)=C1CCC1 ZINC001347816340 958159392 /nfs/dbraw/zinc/15/93/92/958159392.db2.gz QQKLSRUVDVFBDE-NSHDSACASA-N 1 2 247.342 2.136 20 0 BEADLO Cc1c[nH+]cc(Nc2noc3nccnc23)c1C ZINC001213524691 958204844 /nfs/dbraw/zinc/20/48/44/958204844.db2.gz DKQLDOSYDSTPJF-UHFFFAOYSA-N 1 2 241.254 2.373 20 0 BEADLO C[C@@H](CN(C)c1cc(N)nc[nH+]1)C(C)(C)C ZINC000399488138 958750728 /nfs/dbraw/zinc/75/07/28/958750728.db2.gz GYDVYQXORNFDFG-VIFPVBQESA-N 1 2 222.336 2.177 20 0 BEADLO c1cn(CCO[C@H]2CCCc3cccnc32)c[nH+]1 ZINC001222134223 972384619 /nfs/dbraw/zinc/38/46/19/972384619.db2.gz BYZYQJFIVPUEGZ-ZDUSSCGKSA-N 1 2 243.310 2.372 20 0 BEADLO COC(C)(C)C[C@H](C)OCCn1cc[nH+]c1 ZINC001222138810 972387821 /nfs/dbraw/zinc/38/78/21/972387821.db2.gz KOKSFISLCOTVGQ-NSHDSACASA-N 1 2 226.320 2.103 20 0 BEADLO C[C@@H](COCCn1cc[nH+]c1)Oc1ccccc1 ZINC001222139801 972388426 /nfs/dbraw/zinc/38/84/26/972388426.db2.gz XIUHJGVFWQHNOV-ZDUSSCGKSA-N 1 2 246.310 2.367 20 0 BEADLO c1cn(CCO[C@@H]2C[C@@H]3CC[C@H]2C3)c[nH+]1 ZINC001222138882 972389889 /nfs/dbraw/zinc/38/98/89/972389889.db2.gz LLWUGEPKPWASTL-GRYCIOLGSA-N 1 2 206.289 2.088 20 0 BEADLO Cc1ncc(Cl)c(NCc2cc[nH+]c(N)c2)n1 ZINC001167613492 959063112 /nfs/dbraw/zinc/06/31/12/959063112.db2.gz KYZAONJPROGDOD-UHFFFAOYSA-N 1 2 249.705 2.028 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@@H]1C[C@H]1C1CCC1 ZINC001350344950 959077555 /nfs/dbraw/zinc/07/75/55/959077555.db2.gz PLUJKNGNJXBXIR-QWHCGFSZSA-N 1 2 248.326 2.382 20 0 BEADLO Nc1cc(CNc2cnc3c(c2)CCC3)cc[nH+]1 ZINC001167617051 959082030 /nfs/dbraw/zinc/08/20/30/959082030.db2.gz FNWJRFIWUUPYAJ-UHFFFAOYSA-N 1 2 240.310 2.160 20 0 BEADLO Cc1cc(N(C)c2[nH+]cccc2N)ccc1CO ZINC001211570931 959254590 /nfs/dbraw/zinc/25/45/90/959254590.db2.gz VUXPPJLECWXKCI-UHFFFAOYSA-N 1 2 243.310 2.232 20 0 BEADLO CCC[C@@H]1CCCN(C(=O)C[C@H]([NH3+])C(F)F)C1 ZINC000724737934 959322611 /nfs/dbraw/zinc/32/26/11/959322611.db2.gz DIDOBNPWQYBASD-ZJUUUORDSA-N 1 2 248.317 2.008 20 0 BEADLO Cc1cc(F)cc(NC(=O)C[C@@H]([NH3+])C(F)F)c1 ZINC000724739328 959325734 /nfs/dbraw/zinc/32/57/34/959325734.db2.gz MIVRJERHCIGPJU-SECBINFHSA-N 1 2 246.232 2.055 20 0 BEADLO CCC1(CC)CCN(C(=O)C[C@@H]([NH3+])C(F)F)C1 ZINC000724754814 959368851 /nfs/dbraw/zinc/36/88/51/959368851.db2.gz HDPTZERCJUVVJF-SECBINFHSA-N 1 2 248.317 2.008 20 0 BEADLO Nc1cc(Cl)[nH+]c(N2CCC[C@@H]3C[C@@H]32)c1 ZINC000308973629 959555256 /nfs/dbraw/zinc/55/52/56/959555256.db2.gz FYLXVMBLXUKTKG-APPZFPTMSA-N 1 2 223.707 2.306 20 0 BEADLO COC(C)(C)[C@@H](C)[NH2+]CC(F)(F)C(F)F ZINC000301007830 959588852 /nfs/dbraw/zinc/58/88/52/959588852.db2.gz NVEFFYIKCIIHCQ-ZCFIWIBFSA-N 1 2 231.233 2.290 20 0 BEADLO C1=C[C@@H]([NH2+]Cc2n[nH]c3ccccc32)CC1 ZINC000694015394 959674613 /nfs/dbraw/zinc/67/46/13/959674613.db2.gz DCRYPNOMBGZIRC-SNVBAGLBSA-N 1 2 213.284 2.371 20 0 BEADLO CNc1ncccc1C(=O)Nc1cc[nH+]c(C)c1 ZINC000092366178 959785102 /nfs/dbraw/zinc/78/51/02/959785102.db2.gz FATOSZCMQKPDGW-UHFFFAOYSA-N 1 2 242.282 2.079 20 0 BEADLO C[C@@H]1CC[N@@H+]1Cc1cc(Br)ccn1 ZINC001140762254 959816195 /nfs/dbraw/zinc/81/61/95/959816195.db2.gz SHYTYAJPYOJTDT-MRVPVSSYSA-N 1 2 241.132 2.438 20 0 BEADLO C[C@@H]1CC[N@H+]1Cc1cc(Br)ccn1 ZINC001140762254 959816198 /nfs/dbraw/zinc/81/61/98/959816198.db2.gz SHYTYAJPYOJTDT-MRVPVSSYSA-N 1 2 241.132 2.438 20 0 BEADLO Cc1ccc(F)c(O[C@@H]2C[NH2+]CC2(F)F)c1F ZINC001218233000 959904997 /nfs/dbraw/zinc/90/49/97/959904997.db2.gz WREXJPDMZMLQGZ-MRVPVSSYSA-N 1 2 249.207 2.259 20 0 BEADLO C[C@@H]1CCC[N@@H+]1Cn1ncsc1=S ZINC000173520754 960148093 /nfs/dbraw/zinc/14/80/93/960148093.db2.gz AEYFJESYADAMKL-SSDOTTSWSA-N 1 2 215.347 2.116 20 0 BEADLO C[C@@H]1CCC[N@H+]1Cn1ncsc1=S ZINC000173520754 960148102 /nfs/dbraw/zinc/14/81/02/960148102.db2.gz AEYFJESYADAMKL-SSDOTTSWSA-N 1 2 215.347 2.116 20 0 BEADLO CC(C)(O)C=CNc1ccc[nH+]c1N1CCCC1 ZINC001203209211 960289167 /nfs/dbraw/zinc/28/91/67/960289167.db2.gz GCXAYAIGVAEYSA-VQHVLOKHSA-N 1 2 247.342 2.378 20 0 BEADLO C[C@@H]([NH2+]Cc1nn(C)cc1Cl)C1(Cl)CC1 ZINC000695654616 960327553 /nfs/dbraw/zinc/32/75/53/960327553.db2.gz IJKZOTBYBLBYTI-SSDOTTSWSA-N 1 2 248.157 2.323 20 0 BEADLO CCOC(=O)[C@H]([NH2+]CC1=CCCC1)C1CC1 ZINC001327224582 972508582 /nfs/dbraw/zinc/50/85/82/972508582.db2.gz RYFPNEOFYHUKMW-GFCCVEGCSA-N 1 2 223.316 2.028 20 0 BEADLO F[C@@H]1C[N@H+](Cc2cc[nH]c2)CCC1(F)F ZINC001140704993 960516603 /nfs/dbraw/zinc/51/66/03/960516603.db2.gz SJQMTKZGOLMTNG-SECBINFHSA-N 1 2 218.222 2.194 20 0 BEADLO F[C@@H]1C[N@@H+](Cc2cc[nH]c2)CCC1(F)F ZINC001140704993 960516611 /nfs/dbraw/zinc/51/66/11/960516611.db2.gz SJQMTKZGOLMTNG-SECBINFHSA-N 1 2 218.222 2.194 20 0 BEADLO Cc1cc(F)ccc1C[N@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001140782230 960568408 /nfs/dbraw/zinc/56/84/08/960568408.db2.gz OORHQUFNYHVPOQ-BETUJISGSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001140782230 960568424 /nfs/dbraw/zinc/56/84/24/960568424.db2.gz OORHQUFNYHVPOQ-BETUJISGSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccc(O)c2)[nH]n1 ZINC001203070325 960626483 /nfs/dbraw/zinc/62/64/83/960626483.db2.gz OTGOLPRJNATCMU-UHFFFAOYSA-N 1 2 231.299 2.056 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccc(O)c2)[nH]n1 ZINC001203070325 960626492 /nfs/dbraw/zinc/62/64/92/960626492.db2.gz OTGOLPRJNATCMU-UHFFFAOYSA-N 1 2 231.299 2.056 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC(=O)[C@H](F)CC2)c1C ZINC001140858837 960631559 /nfs/dbraw/zinc/63/15/59/960631559.db2.gz PJWXMZBHKQRKHE-LLVKDONJSA-N 1 2 238.306 2.135 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC(=O)[C@H](F)CC2)c1C ZINC001140858837 960631572 /nfs/dbraw/zinc/63/15/72/960631572.db2.gz PJWXMZBHKQRKHE-LLVKDONJSA-N 1 2 238.306 2.135 20 0 BEADLO Cc1cc(C[NH+]2CC(C)(C)OC(C)(C)C2)[nH]n1 ZINC001203080724 960720139 /nfs/dbraw/zinc/72/01/39/960720139.db2.gz BYDYTUCYYKIJOI-UHFFFAOYSA-N 1 2 237.347 2.108 20 0 BEADLO CC[N@H+](Cc1cc(C)n[nH]1)Cc1ccccn1 ZINC001203081549 960746058 /nfs/dbraw/zinc/74/60/58/960746058.db2.gz BKWFHFUQDUOFBJ-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CC[N@@H+](Cc1cc(C)n[nH]1)Cc1ccccn1 ZINC001203081549 960746073 /nfs/dbraw/zinc/74/60/73/960746073.db2.gz BKWFHFUQDUOFBJ-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO c1coc(C[NH+]2CCC(OC3CCC3)CC2)n1 ZINC001141004769 960800020 /nfs/dbraw/zinc/80/00/20/960800020.db2.gz MIISEMGHQZWDPL-UHFFFAOYSA-N 1 2 236.315 2.208 20 0 BEADLO c1cc(COC2C[NH+](Cc3ccccc3)C2)no1 ZINC001222728577 960802447 /nfs/dbraw/zinc/80/24/47/960802447.db2.gz ZOLJPEGTUZCCTF-UHFFFAOYSA-N 1 2 244.294 2.076 20 0 BEADLO CC(C)OC1CC[NH+](Cc2ncco2)CC1 ZINC001141008822 960807973 /nfs/dbraw/zinc/80/79/73/960807973.db2.gz MZYDCNYXHGZUQO-UHFFFAOYSA-N 1 2 224.304 2.064 20 0 BEADLO CC[N@H+](C)Cc1ncc(Cl)nc1Cl ZINC001141132086 960882060 /nfs/dbraw/zinc/88/20/60/960882060.db2.gz SRSLVRGEOFXOAE-UHFFFAOYSA-N 1 2 220.103 2.235 20 0 BEADLO CC[N@@H+](C)Cc1ncc(Cl)nc1Cl ZINC001141132086 960882070 /nfs/dbraw/zinc/88/20/70/960882070.db2.gz SRSLVRGEOFXOAE-UHFFFAOYSA-N 1 2 220.103 2.235 20 0 BEADLO Fc1c[nH+]ccc1NC[C@H]1CC[C@@H](C2CC2)O1 ZINC000722321314 961013939 /nfs/dbraw/zinc/01/39/39/961013939.db2.gz MCOMLNLUJDUDOS-MFKMUULPSA-N 1 2 236.290 2.012 20 0 BEADLO COc1cc[nH+]cc1Nc1cccc(CCO)c1 ZINC001203107410 961016555 /nfs/dbraw/zinc/01/65/55/961016555.db2.gz JALVQAZVAWISLQ-UHFFFAOYSA-N 1 2 244.294 2.369 20 0 BEADLO CC[N@H+](Cc1ccncc1)Cc1cncc(C)n1 ZINC001203161375 961100387 /nfs/dbraw/zinc/10/03/87/961100387.db2.gz HNLFNIGXPRZSOJ-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO CC[N@@H+](Cc1ccncc1)Cc1cncc(C)n1 ZINC001203161375 961100398 /nfs/dbraw/zinc/10/03/98/961100398.db2.gz HNLFNIGXPRZSOJ-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO CC(C)(C)c1nc[nH]c1C[NH+]1CC(C(F)F)C1 ZINC001142242607 961372374 /nfs/dbraw/zinc/37/23/74/961372374.db2.gz KPJWYOHIZUWUFF-UHFFFAOYSA-N 1 2 243.301 2.404 20 0 BEADLO CC[N@H+](C)Cc1cnc(SC)nc1Cl ZINC001142408672 961429530 /nfs/dbraw/zinc/42/95/30/961429530.db2.gz VBRTYDPKBYRSQL-UHFFFAOYSA-N 1 2 231.752 2.304 20 0 BEADLO CC[N@@H+](C)Cc1cnc(SC)nc1Cl ZINC001142408672 961429546 /nfs/dbraw/zinc/42/95/46/961429546.db2.gz VBRTYDPKBYRSQL-UHFFFAOYSA-N 1 2 231.752 2.304 20 0 BEADLO Cc1c[nH]c(CCNC(=O)C2(C(C)C)CCC2)[nH+]1 ZINC001142652317 961551069 /nfs/dbraw/zinc/55/10/69/961551069.db2.gz FMLDKZODAWYJLJ-UHFFFAOYSA-N 1 2 249.358 2.203 20 0 BEADLO CC(C)/C=C/C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001142658116 961559030 /nfs/dbraw/zinc/55/90/30/961559030.db2.gz CSWJTKOTZNJYAO-ONEGZZNKSA-N 1 2 229.283 2.485 20 0 BEADLO CC(C)/C=C/C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC001142659771 961566707 /nfs/dbraw/zinc/56/67/07/961566707.db2.gz USHAHWYHJBZNDX-FYJFLYSWSA-N 1 2 247.342 2.328 20 0 BEADLO C[C@@H]1CC(=O)CC[N@@H+]1Cc1cccc2nc[nH]c21 ZINC001142673044 961585926 /nfs/dbraw/zinc/58/59/26/961585926.db2.gz WOSRRNFEGCMCKG-SNVBAGLBSA-N 1 2 243.310 2.116 20 0 BEADLO C[C@@H]1CC(=O)CC[N@H+]1Cc1cccc2nc[nH]c21 ZINC001142673044 961585933 /nfs/dbraw/zinc/58/59/33/961585933.db2.gz WOSRRNFEGCMCKG-SNVBAGLBSA-N 1 2 243.310 2.116 20 0 BEADLO C[C@@H](C(=O)N(CC1CC1)C1CCC1)n1cc[nH+]c1 ZINC001344404747 961640969 /nfs/dbraw/zinc/64/09/69/961640969.db2.gz DZAPHDWKHVMFNS-NSHDSACASA-N 1 2 247.342 2.235 20 0 BEADLO CCCC(CCC)C(=O)NC1C[NH+](CC)C1 ZINC001268437985 961781751 /nfs/dbraw/zinc/78/17/51/961781751.db2.gz NVBXWAMVJDQRDQ-UHFFFAOYSA-N 1 2 226.364 2.023 20 0 BEADLO COc1cc(C)c(C[N@@H+]2CCO[C@@H]3C[C@@H]32)c(C)c1 ZINC001142951155 961853763 /nfs/dbraw/zinc/85/37/63/961853763.db2.gz YDAJMKOMXLLUDK-LSDHHAIUSA-N 1 2 247.338 2.285 20 0 BEADLO COc1cc(C)c(C[N@H+]2CCO[C@@H]3C[C@@H]32)c(C)c1 ZINC001142951155 961853764 /nfs/dbraw/zinc/85/37/64/961853764.db2.gz YDAJMKOMXLLUDK-LSDHHAIUSA-N 1 2 247.338 2.285 20 0 BEADLO CCCCC[C@@H](CC)C(=O)NC1C[NH+](CC)C1 ZINC001268483508 961865525 /nfs/dbraw/zinc/86/55/25/961865525.db2.gz NCVHKCSSBREEGW-GFCCVEGCSA-N 1 2 240.391 2.413 20 0 BEADLO FC[C@H]1CCC[N@@H+]1Cc1cn2ccccc2n1 ZINC000293063158 961894994 /nfs/dbraw/zinc/89/49/94/961894994.db2.gz NQTMPWYPDOHKEH-GFCCVEGCSA-N 1 2 233.290 2.268 20 0 BEADLO FC[C@H]1CCC[N@H+]1Cc1cn2ccccc2n1 ZINC000293063158 961895001 /nfs/dbraw/zinc/89/50/01/961895001.db2.gz NQTMPWYPDOHKEH-GFCCVEGCSA-N 1 2 233.290 2.268 20 0 BEADLO CCOC(=O)[C@H]1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC001225295666 962068138 /nfs/dbraw/zinc/06/81/38/962068138.db2.gz NHRCEHWYGRHQAX-CMPLNLGQSA-N 1 2 235.283 2.192 20 0 BEADLO CN(C)c1cc(-c2ccc3nonc3c2)cc[nH+]1 ZINC001204946280 962134925 /nfs/dbraw/zinc/13/49/25/962134925.db2.gz ZIXMHXNRDJFPFS-UHFFFAOYSA-N 1 2 240.266 2.351 20 0 BEADLO CC(C)CC(=O)NCCCN(C)c1cccc[nH+]1 ZINC001153113537 962536971 /nfs/dbraw/zinc/53/69/71/962536971.db2.gz KCAQNGISWPQIJS-UHFFFAOYSA-N 1 2 249.358 2.070 20 0 BEADLO C[C@@H](NC(=O)Cc1c[nH]c[nH+]1)C1CCCCCC1 ZINC001153923723 962660133 /nfs/dbraw/zinc/66/01/33/962660133.db2.gz JCPLLBKHSGCGNU-LLVKDONJSA-N 1 2 249.358 2.427 20 0 BEADLO O=C(c1cccc2[nH+]ccn21)N1C2CCC1CC2 ZINC001154522094 962797386 /nfs/dbraw/zinc/79/73/86/962797386.db2.gz REAYXCYYERPTAA-UHFFFAOYSA-N 1 2 241.294 2.101 20 0 BEADLO Cc1ccnc(CNc2cc(N)cc(Cl)[nH+]2)n1 ZINC001154817290 962854560 /nfs/dbraw/zinc/85/45/60/962854560.db2.gz QNQLJRKHFSWBJN-UHFFFAOYSA-N 1 2 249.705 2.028 20 0 BEADLO CCCCNc1nc(C)[nH+]c2c1CCC2 ZINC001154828341 962861953 /nfs/dbraw/zinc/86/19/53/962861953.db2.gz XRLDKDLSPYSTGI-UHFFFAOYSA-N 1 2 205.305 2.486 20 0 BEADLO Cc1cnc(CCNc2[nH+]ccc(F)c2C)nc1 ZINC001154866928 962877027 /nfs/dbraw/zinc/87/70/27/962877027.db2.gz DKBPKZXRIAKIHA-UHFFFAOYSA-N 1 2 246.289 2.282 20 0 BEADLO CC(C)C[C@H](CO)Nc1ccc(Cl)c(N)[nH+]1 ZINC001154962431 962923875 /nfs/dbraw/zinc/92/38/75/962923875.db2.gz OOHFBPATAGANFF-MRVPVSSYSA-N 1 2 243.738 2.136 20 0 BEADLO Cc1nc2c(ccn2C)c(NCC(C)C)[nH+]1 ZINC001161645206 962979837 /nfs/dbraw/zinc/97/98/37/962979837.db2.gz UUBHFZZKRBCKGA-UHFFFAOYSA-N 1 2 218.304 2.345 20 0 BEADLO CC(C)(C)C(=[NH2+])Nc1ncnc2ncccc21 ZINC001155176344 963001652 /nfs/dbraw/zinc/00/16/52/963001652.db2.gz ZVRFNXXZBSBWJS-UHFFFAOYSA-N 1 2 229.287 2.460 20 0 BEADLO CCc1nccnc1NC(=[NH2+])C(C)(C)C ZINC001155181476 963004308 /nfs/dbraw/zinc/00/43/08/963004308.db2.gz QYQVRIINBMZSGL-UHFFFAOYSA-N 1 2 206.293 2.474 20 0 BEADLO CCOc1cc(NC(=[NH2+])C(C)(C)C)ncn1 ZINC001155180185 963006500 /nfs/dbraw/zinc/00/65/00/963006500.db2.gz KSINRJTUQDSTAL-UHFFFAOYSA-N 1 2 222.292 2.311 20 0 BEADLO Cc1csc(CN2CCC(F)(F)[C@@H]([NH3+])C2)c1 ZINC001206657385 963120755 /nfs/dbraw/zinc/12/07/55/963120755.db2.gz QCTMJMFJIDBWMY-JTQLQIEISA-N 1 2 246.326 2.225 20 0 BEADLO Cc1nc(N2CCOCC23CC3)cc(C(C)C)[nH+]1 ZINC001155830608 963180186 /nfs/dbraw/zinc/18/01/86/963180186.db2.gz MXIZJDQRJIYCHE-UHFFFAOYSA-N 1 2 247.342 2.278 20 0 BEADLO c1cc(C2CC2)[nH+]c(N2CCOCC23CC3)c1 ZINC001155852518 963186738 /nfs/dbraw/zinc/18/67/38/963186738.db2.gz PAQLFZDZTVJNCG-UHFFFAOYSA-N 1 2 230.311 2.328 20 0 BEADLO COc1ccc[nH+]c1NCCc1cccc(O)c1 ZINC001155865184 963189991 /nfs/dbraw/zinc/18/99/91/963189991.db2.gz PZZICMLXHRCSOE-UHFFFAOYSA-N 1 2 244.294 2.450 20 0 BEADLO COc1c[nH+]c(NC[C@@H]2CCCCO2)c(C)c1 ZINC001156372974 963326846 /nfs/dbraw/zinc/32/68/46/963326846.db2.gz VNVWCVNYNLSZFG-NSHDSACASA-N 1 2 236.315 2.380 20 0 BEADLO Cc1nnc(Cl)cc1NCc1cc[nH+]c(N)c1 ZINC001156756460 963452750 /nfs/dbraw/zinc/45/27/50/963452750.db2.gz YOXBQJRYPXXYKZ-UHFFFAOYSA-N 1 2 249.705 2.028 20 0 BEADLO CCOc1cccnc1NCc1cc[nH+]c(N)c1 ZINC001156760283 963453184 /nfs/dbraw/zinc/45/31/84/963453184.db2.gz HRSXEYLQVOCBFF-UHFFFAOYSA-N 1 2 244.298 2.070 20 0 BEADLO CCCN(C)c1cc(N(CC)CC)nc[nH+]1 ZINC001156877581 963480366 /nfs/dbraw/zinc/48/03/66/963480366.db2.gz FCUFYPQWUSFSLC-UHFFFAOYSA-N 1 2 222.336 2.169 20 0 BEADLO CCCN(C)c1cc(N(CC)CC)[nH+]cn1 ZINC001156877581 963480372 /nfs/dbraw/zinc/48/03/72/963480372.db2.gz FCUFYPQWUSFSLC-UHFFFAOYSA-N 1 2 222.336 2.169 20 0 BEADLO CCn1cncc1C[N@@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000669550993 963480573 /nfs/dbraw/zinc/48/05/73/963480573.db2.gz JYYGGWXTQRKPLC-JQWIXIFHSA-N 1 2 225.311 2.083 20 0 BEADLO CCn1cncc1C[N@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000669550993 963480580 /nfs/dbraw/zinc/48/05/80/963480580.db2.gz JYYGGWXTQRKPLC-JQWIXIFHSA-N 1 2 225.311 2.083 20 0 BEADLO CCn1cncc1C[N@@H+]1CC[C@H](C)[C@H](F)C1 ZINC000669550992 963482326 /nfs/dbraw/zinc/48/23/26/963482326.db2.gz JYYGGWXTQRKPLC-CMPLNLGQSA-N 1 2 225.311 2.083 20 0 BEADLO CCn1cncc1C[N@H+]1CC[C@H](C)[C@H](F)C1 ZINC000669550992 963482327 /nfs/dbraw/zinc/48/23/27/963482327.db2.gz JYYGGWXTQRKPLC-CMPLNLGQSA-N 1 2 225.311 2.083 20 0 BEADLO COc1c[nH+]c(NCc2cc(C)n(C)n2)c(C)c1 ZINC001156947951 963498392 /nfs/dbraw/zinc/49/83/92/963498392.db2.gz SPNLDUMEDCXEKS-UHFFFAOYSA-N 1 2 246.314 2.053 20 0 BEADLO CCOc1ccc[nH+]c1NCc1cc(C)n(C)n1 ZINC001156952919 963498398 /nfs/dbraw/zinc/49/83/98/963498398.db2.gz LVKPIJFDUVJRPL-UHFFFAOYSA-N 1 2 246.314 2.134 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H]2CCCC[C@@H]2C)[nH+]c1C ZINC000896910870 963521851 /nfs/dbraw/zinc/52/18/51/963521851.db2.gz ZUFIFXAYVGIWNV-JOYOIKCWSA-N 1 2 249.358 2.469 20 0 BEADLO Cc1nc(N(C)Cc2cncs2)c(C)c(C)[nH+]1 ZINC001157092663 963530892 /nfs/dbraw/zinc/53/08/92/963530892.db2.gz BSJMRMMQZCBPIN-UHFFFAOYSA-N 1 2 248.355 2.495 20 0 BEADLO CCCc1cc(N(C)Cc2ccno2)nc(C)[nH+]1 ZINC001157353401 963581680 /nfs/dbraw/zinc/58/16/80/963581680.db2.gz KWSWXZUJTLPOAP-UHFFFAOYSA-N 1 2 246.314 2.362 20 0 BEADLO CCc1cc(C[N@@H+]2C[C@H](F)C[C@H]2C)on1 ZINC001203212471 963651412 /nfs/dbraw/zinc/65/14/12/963651412.db2.gz NWCLTPKVYPMIAS-RKDXNWHRSA-N 1 2 212.268 2.169 20 0 BEADLO CCc1cc(C[N@H+]2C[C@H](F)C[C@H]2C)on1 ZINC001203212471 963651419 /nfs/dbraw/zinc/65/14/19/963651419.db2.gz NWCLTPKVYPMIAS-RKDXNWHRSA-N 1 2 212.268 2.169 20 0 BEADLO Cc1cc(NC[C@H]2C[C@@](C)(O)C2)nc(C2CC2)[nH+]1 ZINC001157559439 963662094 /nfs/dbraw/zinc/66/20/94/963662094.db2.gz BNCGZQXJJHFBQT-WJONMLJTSA-N 1 2 247.342 2.235 20 0 BEADLO CSc1ccc(OC2C[NH+](C)C2)cc1 ZINC001228158396 963688684 /nfs/dbraw/zinc/68/86/84/963688684.db2.gz OLEVZESUMVDUEY-UHFFFAOYSA-N 1 2 209.314 2.101 20 0 BEADLO CC1(C)C[C@H](CNc2ccc(Cl)c(N)[nH+]2)O1 ZINC001157662707 963695087 /nfs/dbraw/zinc/69/50/87/963695087.db2.gz ATYLKFAVHDOYIR-SSDOTTSWSA-N 1 2 241.722 2.297 20 0 BEADLO CC[C@H]([NH2+]CC(C)(C)C(C)(F)F)C(=O)OC ZINC000697101821 963718491 /nfs/dbraw/zinc/71/84/91/963718491.db2.gz RLHGXHYDUYQLQJ-QMMMGPOBSA-N 1 2 237.290 2.209 20 0 BEADLO CCc1cc(NCC[C@H](O)C2CC2)nc(CC)[nH+]1 ZINC000897384997 963878100 /nfs/dbraw/zinc/87/81/00/963878100.db2.gz PRFOALCMSQZMOV-LBPRGKRZSA-N 1 2 249.358 2.174 20 0 BEADLO CCSc1cc[nH+]c(N(C)[C@H]2CCOC2)c1 ZINC001158574188 963891032 /nfs/dbraw/zinc/89/10/32/963891032.db2.gz SCZFBYUWEYIMLN-JTQLQIEISA-N 1 2 238.356 2.419 20 0 BEADLO CO[C@@H]1CCN(c2nc(C)[nH+]c(C)c2C)[C@H](C)C1 ZINC001158898733 963953865 /nfs/dbraw/zinc/95/38/65/963953865.db2.gz WKWXHTWFYVTZTA-NOZJJQNGSA-N 1 2 249.358 2.406 20 0 BEADLO Cc1c[nH+]c(N(C)CC(F)F)nc1NC(C)C ZINC001158921447 963957729 /nfs/dbraw/zinc/95/77/29/963957729.db2.gz WLLJBSBOKQLYIN-UHFFFAOYSA-N 1 2 244.289 2.307 20 0 BEADLO Nc1[nH+]c(N2C3CCC2CC3)ccc1Cl ZINC001159083350 963997133 /nfs/dbraw/zinc/99/71/33/963997133.db2.gz OHGKWVVBFWLNEO-UHFFFAOYSA-N 1 2 223.707 2.448 20 0 BEADLO Cc1[nH+]cc(Nc2cccc(N)c2)cc1N ZINC001159464801 964099838 /nfs/dbraw/zinc/09/98/38/964099838.db2.gz NCMOEIMWBGKVHC-UHFFFAOYSA-N 1 2 214.272 2.298 20 0 BEADLO COc1c[nH+]c(N[C@H]2CCOC[C@@H]2C)c(C)c1 ZINC001159710926 964162051 /nfs/dbraw/zinc/16/20/51/964162051.db2.gz KPYVWLUZKFDNIX-JQWIXIFHSA-N 1 2 236.315 2.236 20 0 BEADLO CC(=O)Oc1ccc(Nc2[nH+]cccc2N)cc1 ZINC001212066150 964181119 /nfs/dbraw/zinc/18/11/19/964181119.db2.gz JSMNDFGFPUTYHX-UHFFFAOYSA-N 1 2 243.266 2.333 20 0 BEADLO Cc1ccccc1-c1noc(C[NH+]2CCC2)n1 ZINC001212095854 964256297 /nfs/dbraw/zinc/25/62/97/964256297.db2.gz XTVDHHKLXHFVGR-UHFFFAOYSA-N 1 2 229.283 2.251 20 0 BEADLO CSCc1ccc(NCC[C@@H](C)CO)[nH+]c1 ZINC001160607998 964358008 /nfs/dbraw/zinc/35/80/08/964358008.db2.gz KEPQEMHBEZXZAT-SNVBAGLBSA-N 1 2 240.372 2.375 20 0 BEADLO CCCN(CCC)C(=O)[C@@]1(C)CC(F)(F)C[NH2+]1 ZINC001160855788 964420613 /nfs/dbraw/zinc/42/06/13/964420613.db2.gz DUHWRDUJPNMKAO-LLVKDONJSA-N 1 2 248.317 2.022 20 0 BEADLO CCC1(Nc2ccc3[nH+]cn(C)c3c2)COC1 ZINC001168323551 964451941 /nfs/dbraw/zinc/45/19/41/964451941.db2.gz IMTTUVXRCLBJSY-UHFFFAOYSA-N 1 2 231.299 2.164 20 0 BEADLO Cc1cc[nH+]c(N[C@@H]2CCC(C)(C)C2)c1C(N)=O ZINC001161032451 964487288 /nfs/dbraw/zinc/48/72/88/964487288.db2.gz PZROWDCVIBQVCU-SNVBAGLBSA-N 1 2 247.342 2.480 20 0 BEADLO c1[nH+]cn(CC2CCC2)c1CNc1ncccn1 ZINC001161529978 964621094 /nfs/dbraw/zinc/62/10/94/964621094.db2.gz RGOZMEMKFAOUMA-UHFFFAOYSA-N 1 2 243.314 2.085 20 0 BEADLO CCC1(Nc2cc(N(C)C)nc[nH+]2)CCC1 ZINC001161558431 964634863 /nfs/dbraw/zinc/63/48/63/964634863.db2.gz GQWZHIBQVKKODB-UHFFFAOYSA-N 1 2 220.320 2.287 20 0 BEADLO CCC1(Nc2cc(N(C)C)[nH+]cn2)CCC1 ZINC001161558431 964634874 /nfs/dbraw/zinc/63/48/74/964634874.db2.gz GQWZHIBQVKKODB-UHFFFAOYSA-N 1 2 220.320 2.287 20 0 BEADLO CCc1ccc(NCc2c[nH+]cn2C(C)C)nn1 ZINC001161565276 964643775 /nfs/dbraw/zinc/64/37/75/964643775.db2.gz KLQAEFCKHXUCJE-UHFFFAOYSA-N 1 2 245.330 2.429 20 0 BEADLO COc1cc(C)c[nH+]c1N[C@H]1CCO[C@@H](C)C1 ZINC001161690751 964688745 /nfs/dbraw/zinc/68/87/45/964688745.db2.gz BDXFGAPBFLCMMR-QWRGUYRKSA-N 1 2 236.315 2.378 20 0 BEADLO C[C@@H]1C[C@H](Nc2ccc(Cl)c(N)[nH+]2)CCO1 ZINC001161695974 964693230 /nfs/dbraw/zinc/69/32/30/964693230.db2.gz JQVCVUJDDZETPP-HTQZYQBOSA-N 1 2 241.722 2.297 20 0 BEADLO C=Cc1ccc(NCCc2cnoc2)[nH+]c1 ZINC001161702213 964696962 /nfs/dbraw/zinc/69/69/62/964696962.db2.gz OZKPROPMROPEAZ-UHFFFAOYSA-N 1 2 215.256 2.367 20 0 BEADLO COc1cc(C)c[nH+]c1NCCc1cnoc1 ZINC001161702287 964697594 /nfs/dbraw/zinc/69/75/94/964697594.db2.gz RSIDECDDVDVXKA-UHFFFAOYSA-N 1 2 233.271 2.041 20 0 BEADLO Cc1nc2c(ccn2C)c(NCCOC(C)C)[nH+]1 ZINC001161788108 964754579 /nfs/dbraw/zinc/75/45/79/964754579.db2.gz GFBVMVICAHVSBR-UHFFFAOYSA-N 1 2 248.330 2.114 20 0 BEADLO CSc1cc(NCC(F)F)nc(C)[nH+]1 ZINC001161809604 964765313 /nfs/dbraw/zinc/76/53/13/964765313.db2.gz MFPOKUJDVZLTJK-UHFFFAOYSA-N 1 2 219.260 2.184 20 0 BEADLO CCN(C)c1cc(NCCC(F)(F)F)[nH+]cn1 ZINC001161819928 964770924 /nfs/dbraw/zinc/77/09/24/964770924.db2.gz JTUKANPMKUJJRL-UHFFFAOYSA-N 1 2 248.252 2.297 20 0 BEADLO CCN(C)c1cc(NCCC(F)(F)F)nc[nH+]1 ZINC001161819928 964770929 /nfs/dbraw/zinc/77/09/29/964770929.db2.gz JTUKANPMKUJJRL-UHFFFAOYSA-N 1 2 248.252 2.297 20 0 BEADLO c1ccn(-c2ccc[nH+]c2NC2CCOCC2)c1 ZINC001161861429 964797113 /nfs/dbraw/zinc/79/71/13/964797113.db2.gz BFNQKGDCYAHJGK-UHFFFAOYSA-N 1 2 243.310 2.463 20 0 BEADLO Cc1cc2cc(NCc3ccnn3C)[nH+]cc2[nH]1 ZINC001161870782 964803010 /nfs/dbraw/zinc/80/30/10/964803010.db2.gz HJQPWYDLTAQYSF-UHFFFAOYSA-N 1 2 241.298 2.217 20 0 BEADLO Cc1[nH+]c(C(C)(C)C)nc(NCC2COC2)c1C ZINC001161947204 964829747 /nfs/dbraw/zinc/82/97/47/964829747.db2.gz DMNBBPQRCTXUES-UHFFFAOYSA-N 1 2 249.358 2.449 20 0 BEADLO Cc1nccnc1CNc1[nH+]ccc(F)c1C ZINC001162002511 964845954 /nfs/dbraw/zinc/84/59/54/964845954.db2.gz QMGBXWUAILSGGA-UHFFFAOYSA-N 1 2 232.262 2.240 20 0 BEADLO CCCCNc1ccc2c([nH+]1)CCOC2 ZINC001162202460 964865228 /nfs/dbraw/zinc/86/52/28/964865228.db2.gz YPJBYDPJWYGPDN-UHFFFAOYSA-N 1 2 206.289 2.366 20 0 BEADLO FC1CC(Nc2ccc(Cn3cc[nH+]c3)cn2)C1 ZINC001162209528 964872028 /nfs/dbraw/zinc/87/20/28/964872028.db2.gz IOBHIHGPMZLNGE-UHFFFAOYSA-N 1 2 246.289 2.239 20 0 BEADLO OCC1C[NH+](Cc2cc(Cl)cc(Cl)c2)C1 ZINC000164426533 964924392 /nfs/dbraw/zinc/92/43/92/964924392.db2.gz NKRUOZGLHFBCAH-UHFFFAOYSA-N 1 2 246.137 2.418 20 0 BEADLO CC(C)(Nc1cc2c(c[nH+]1)OCC(=O)N2)C1CC1 ZINC001162514735 965010720 /nfs/dbraw/zinc/01/07/20/965010720.db2.gz OVTVETUVRZVSIV-UHFFFAOYSA-N 1 2 247.298 2.013 20 0 BEADLO Cc1c[nH+]c(Nc2ccncc2Cl)c(N)c1 ZINC001212146572 965079136 /nfs/dbraw/zinc/07/91/36/965079136.db2.gz GJWPMSLFZIBMFV-UHFFFAOYSA-N 1 2 234.690 2.186 20 0 BEADLO CCC(CC)[NH2+][C@@H](COC(C)(C)C)C(=O)OC ZINC001257287031 1169859618 /nfs/dbraw/zinc/85/96/18/1169859618.db2.gz KADKFXQDHGJBDU-NSHDSACASA-N 1 2 245.363 2.121 20 0 BEADLO Cc1cncc(NCc2ccc3[nH+]ccn3c2)n1 ZINC001163136488 965263534 /nfs/dbraw/zinc/26/35/34/965263534.db2.gz IMGONALVWWPQJB-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO Cc1c[nH+]c(N2CC(C)(C)C2)nc1NC(C)C ZINC001163724634 965533575 /nfs/dbraw/zinc/53/35/75/965533575.db2.gz YNLJWHWENOWVGP-UHFFFAOYSA-N 1 2 234.347 2.452 20 0 BEADLO COCC1CN(c2cc(CSC)cc[nH+]2)C1 ZINC001163734325 965549624 /nfs/dbraw/zinc/54/96/24/965549624.db2.gz HMBPUXZVEPQBCF-UHFFFAOYSA-N 1 2 238.356 2.027 20 0 BEADLO Nc1ccc[nH+]c1N1CCC(=O)[C@H]2CCCC[C@H]21 ZINC001163790573 965590875 /nfs/dbraw/zinc/59/08/75/965590875.db2.gz NLDTXJWCZDJUSW-CMPLNLGQSA-N 1 2 245.326 2.002 20 0 BEADLO CSc1cc[nH+]c(N2Cc3cncnc3C2)c1 ZINC001163986305 965684492 /nfs/dbraw/zinc/68/44/92/965684492.db2.gz CXTCISAUTVGEBL-UHFFFAOYSA-N 1 2 244.323 2.114 20 0 BEADLO CC(C)c1ccc(N2CC[C@@](C)(CO)C2)[nH+]c1 ZINC001164145051 965756906 /nfs/dbraw/zinc/75/69/06/965756906.db2.gz ZHALPATXAPXNCM-CQSZACIVSA-N 1 2 234.343 2.414 20 0 BEADLO CN(C)c1ccc(NC[C@H]2CC(C)(C)O2)[nH+]c1 ZINC001168455478 965758943 /nfs/dbraw/zinc/75/89/43/965758943.db2.gz GPWSDEBLUMGGBW-LLVKDONJSA-N 1 2 235.331 2.127 20 0 BEADLO C[C@H]1C[C@@H](CO)N(c2cc3ccccc3c[nH+]2)C1 ZINC001164150170 965759196 /nfs/dbraw/zinc/75/91/96/965759196.db2.gz BJXTWGKYROLGAO-FZMZJTMJSA-N 1 2 242.322 2.442 20 0 BEADLO CC(=O)C[N@@H+](C)C(C)(C)c1ccnc(Cl)c1 ZINC001164194019 965784346 /nfs/dbraw/zinc/78/43/46/965784346.db2.gz QVVSWBFNPKDWJG-UHFFFAOYSA-N 1 2 240.734 2.491 20 0 BEADLO CC(=O)C[N@H+](C)C(C)(C)c1ccnc(Cl)c1 ZINC001164194019 965784359 /nfs/dbraw/zinc/78/43/59/965784359.db2.gz QVVSWBFNPKDWJG-UHFFFAOYSA-N 1 2 240.734 2.491 20 0 BEADLO CNc1cc(CNc2ncncc2Cl)cc[nH+]1 ZINC001164191154 965786235 /nfs/dbraw/zinc/78/62/35/965786235.db2.gz ZKXKHNSZDSWJKO-UHFFFAOYSA-N 1 2 249.705 2.179 20 0 BEADLO Cc1c(F)cc[nH+]c1N1CCC[C@H](O)[C@H](C)C1 ZINC001164217040 965800784 /nfs/dbraw/zinc/80/07/84/965800784.db2.gz AFNVKTUDYRRQIM-SKDRFNHKSA-N 1 2 238.306 2.126 20 0 BEADLO CCCc1cc(N2[C@@H](C)CC[C@H]2CO)nc(C)[nH+]1 ZINC001164308083 965839834 /nfs/dbraw/zinc/83/98/34/965839834.db2.gz SDGGKSBYGINPCN-GWCFXTLKSA-N 1 2 249.358 2.087 20 0 BEADLO COc1cc(C)c[nH+]c1N1CCC(=O)[C@H](C)CC1 ZINC001164368858 965865945 /nfs/dbraw/zinc/86/59/45/965865945.db2.gz SEBBABHFSZPCDT-LLVKDONJSA-N 1 2 248.326 2.204 20 0 BEADLO COc1cc[nH+]cc1NCCn1cccc1 ZINC001164452400 965888289 /nfs/dbraw/zinc/88/82/89/965888289.db2.gz KJLHFROESUECGI-UHFFFAOYSA-N 1 2 217.272 2.004 20 0 BEADLO CCN(CC)C(=O)[C@@H](C)Nc1c(C)cc[nH+]c1C ZINC001164643846 965937866 /nfs/dbraw/zinc/93/78/66/965937866.db2.gz ZEMHXFAQBYBSNZ-GFCCVEGCSA-N 1 2 249.358 2.367 20 0 BEADLO CCc1ccc(C[N@@H+]2CCc3nn(C)cc3C2)o1 ZINC001204392774 965951186 /nfs/dbraw/zinc/95/11/86/965951186.db2.gz LRMVZJXXGWKYRO-UHFFFAOYSA-N 1 2 245.326 2.134 20 0 BEADLO CCc1ccc(C[N@H+]2CCc3nn(C)cc3C2)o1 ZINC001204392774 965951188 /nfs/dbraw/zinc/95/11/88/965951188.db2.gz LRMVZJXXGWKYRO-UHFFFAOYSA-N 1 2 245.326 2.134 20 0 BEADLO CCc1ccc(C[N@@H+]2CCc3cnn(C)c3C2)o1 ZINC001204395389 965953867 /nfs/dbraw/zinc/95/38/67/965953867.db2.gz NVQKKAACYBWPLO-UHFFFAOYSA-N 1 2 245.326 2.134 20 0 BEADLO CCc1ccc(C[N@H+]2CCc3cnn(C)c3C2)o1 ZINC001204395389 965953873 /nfs/dbraw/zinc/95/38/73/965953873.db2.gz NVQKKAACYBWPLO-UHFFFAOYSA-N 1 2 245.326 2.134 20 0 BEADLO c1cn2ccc(NC[C@@H]3CCCCO3)cc2[nH+]1 ZINC001165228476 965993969 /nfs/dbraw/zinc/99/39/69/965993969.db2.gz BYEFGDNSPRRFNW-LBPRGKRZSA-N 1 2 231.299 2.315 20 0 BEADLO Cc1cc(Cl)c(C)c(N2CC[C@](C)(O)C2)[nH+]1 ZINC001165227978 965995067 /nfs/dbraw/zinc/99/50/67/965995067.db2.gz GJFAYDZFLAQDCC-LBPRGKRZSA-N 1 2 240.734 2.313 20 0 BEADLO CCSc1cc[nH+]c(N2CC[C@](C)(O)C2)c1 ZINC001165231085 965996054 /nfs/dbraw/zinc/99/60/54/965996054.db2.gz DVAZAMKIZLKPAY-LBPRGKRZSA-N 1 2 238.356 2.155 20 0 BEADLO C[C@@H]1COC[C@H]1[NH2+]CC(F)(F)c1ccccc1 ZINC000699759955 966069482 /nfs/dbraw/zinc/06/94/82/966069482.db2.gz OHTGXLLKEXRBRW-ZYHUDNBSSA-N 1 2 241.281 2.403 20 0 BEADLO CC1(C)CN(Cc2ccc(S)cc2)CC[NH2+]1 ZINC001235838165 966117444 /nfs/dbraw/zinc/11/74/44/966117444.db2.gz PXUUQELHPCSBAJ-UHFFFAOYSA-N 1 2 236.384 2.159 20 0 BEADLO C[C@H](CCO)Nc1[nH+]cccc1-n1cccc1 ZINC001165866861 966179506 /nfs/dbraw/zinc/17/95/06/966179506.db2.gz LPIGBJWFWPPQTH-LLVKDONJSA-N 1 2 231.299 2.055 20 0 BEADLO COc1ccc2cc(N[C@@H](C)CCO)[nH+]cc2c1 ZINC001165866156 966182045 /nfs/dbraw/zinc/18/20/45/966182045.db2.gz DTUQYFZXEUDYDW-JTQLQIEISA-N 1 2 246.310 2.426 20 0 BEADLO COc1ccc(C)[nH+]c1N1C[C@@H]2C[C@H]1C[C@H]2F ZINC001166530874 966290580 /nfs/dbraw/zinc/29/05/80/966290580.db2.gz XAXVYPIHPHBWRW-GARJFASQSA-N 1 2 236.290 2.335 20 0 BEADLO CC(C)c1ccc(N2CC[C@H](CO)C2)[nH+]c1 ZINC001166549703 966294589 /nfs/dbraw/zinc/29/45/89/966294589.db2.gz KZNKRYZFTNSYOO-NSHDSACASA-N 1 2 220.316 2.024 20 0 BEADLO CC(C)c1ccc(N2CC[C@@H](CO)C2)[nH+]c1 ZINC001166549702 966295656 /nfs/dbraw/zinc/29/56/56/966295656.db2.gz KZNKRYZFTNSYOO-LLVKDONJSA-N 1 2 220.316 2.024 20 0 BEADLO CCN(CCC(N)=O)c1ccc(C(C)(C)C)c[nH+]1 ZINC001166589189 966314643 /nfs/dbraw/zinc/31/46/43/966314643.db2.gz CUJQUZPGOBYJGB-UHFFFAOYSA-N 1 2 249.358 2.081 20 0 BEADLO CC(=O)OC1CN(c2ccc(C(C)(C)C)c[nH+]2)C1 ZINC001166647595 966345005 /nfs/dbraw/zinc/34/50/05/966345005.db2.gz SLXZLZVMKPKFSQ-UHFFFAOYSA-N 1 2 248.326 2.131 20 0 BEADLO Cc1cccc(Nc2cc[nH]c(=O)c2)[nH+]1 ZINC001212262894 966370825 /nfs/dbraw/zinc/37/08/25/966370825.db2.gz LJDJATWNNOMIPQ-UHFFFAOYSA-N 1 2 201.229 2.234 20 0 BEADLO Cc1cn2c(cccc2Nc2cc[nH]c(=O)c2)[nH+]1 ZINC001212265491 966379299 /nfs/dbraw/zinc/37/92/99/966379299.db2.gz NCJZNRYDVSQWGK-UHFFFAOYSA-N 1 2 240.266 2.487 20 0 BEADLO O=c1cc(Nc2cccn3cc[nH+]c23)cc[nH]1 ZINC001212266948 966388329 /nfs/dbraw/zinc/38/83/29/966388329.db2.gz AZCDAVSPDYEPJG-UHFFFAOYSA-N 1 2 226.239 2.179 20 0 BEADLO CSCc1cc[nH+]c(N(C)CC2COC2)c1 ZINC001166948760 966474555 /nfs/dbraw/zinc/47/45/55/966474555.db2.gz KDRKSNXTWPNGOF-UHFFFAOYSA-N 1 2 238.356 2.027 20 0 BEADLO C[C@@]1(CF)CC[N@H+](Cc2nccnc2Cl)C1 ZINC001236614004 966481595 /nfs/dbraw/zinc/48/15/95/966481595.db2.gz NETDHTXVCCLHNB-NSHDSACASA-N 1 2 243.713 2.312 20 0 BEADLO C[C@@]1(CF)CC[N@@H+](Cc2nccnc2Cl)C1 ZINC001236614004 966481602 /nfs/dbraw/zinc/48/16/02/966481602.db2.gz NETDHTXVCCLHNB-NSHDSACASA-N 1 2 243.713 2.312 20 0 BEADLO C[N@H+](Cc1ccno1)Cc1ccc(F)c(O)c1 ZINC001236707118 966515797 /nfs/dbraw/zinc/51/57/97/966515797.db2.gz DJDVFXPHBQBQES-UHFFFAOYSA-N 1 2 236.246 2.151 20 0 BEADLO C[N@@H+](Cc1ccno1)Cc1ccc(F)c(O)c1 ZINC001236707118 966515804 /nfs/dbraw/zinc/51/58/04/966515804.db2.gz DJDVFXPHBQBQES-UHFFFAOYSA-N 1 2 236.246 2.151 20 0 BEADLO COC(CN(C)c1ccc(C(C)C)c[nH+]1)OC ZINC001167031948 966527421 /nfs/dbraw/zinc/52/74/21/966527421.db2.gz SSYTYQNFBNABOH-UHFFFAOYSA-N 1 2 238.331 2.260 20 0 BEADLO CC[N@H+](Cc1ccccn1)Cc1cncc(C)n1 ZINC001203173771 966538956 /nfs/dbraw/zinc/53/89/56/966538956.db2.gz RCPLLTGIWRTJEC-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO CC[N@@H+](Cc1ccccn1)Cc1cncc(C)n1 ZINC001203173771 966538963 /nfs/dbraw/zinc/53/89/63/966538963.db2.gz RCPLLTGIWRTJEC-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO c1nn[nH]c1C[N@@H+]1CCC[C@@H]1c1ccccc1 ZINC001203206396 966552522 /nfs/dbraw/zinc/55/25/22/966552522.db2.gz YJPDQJOJFFCNPE-CYBMUJFWSA-N 1 2 228.299 2.142 20 0 BEADLO c1nn[nH]c1C[N@H+]1CCC[C@@H]1c1ccccc1 ZINC001203206396 966552531 /nfs/dbraw/zinc/55/25/31/966552531.db2.gz YJPDQJOJFFCNPE-CYBMUJFWSA-N 1 2 228.299 2.142 20 0 BEADLO c1[nH]nnc1C[N@@H+]1CCC[C@@H]1c1ccccc1 ZINC001203206396 966552540 /nfs/dbraw/zinc/55/25/40/966552540.db2.gz YJPDQJOJFFCNPE-CYBMUJFWSA-N 1 2 228.299 2.142 20 0 BEADLO c1[nH]nnc1C[N@H+]1CCC[C@@H]1c1ccccc1 ZINC001203206396 966552551 /nfs/dbraw/zinc/55/25/51/966552551.db2.gz YJPDQJOJFFCNPE-CYBMUJFWSA-N 1 2 228.299 2.142 20 0 BEADLO CC(C)(O)C=C[NH+]=c1cc[nH]c(Cl)c1O ZINC001203216847 966561931 /nfs/dbraw/zinc/56/19/31/966561931.db2.gz QYBOBAXQYFGRFA-GQCTYLIASA-N 1 2 228.679 2.137 20 0 BEADLO c1coc(C[N@@H+]2CCc3ccncc3C2)c1 ZINC001203285342 966600194 /nfs/dbraw/zinc/60/01/94/966600194.db2.gz HURWQIMOLMZGAS-UHFFFAOYSA-N 1 2 214.268 2.233 20 0 BEADLO c1coc(C[N@H+]2CCc3ccncc3C2)c1 ZINC001203285342 966600202 /nfs/dbraw/zinc/60/02/02/966600202.db2.gz HURWQIMOLMZGAS-UHFFFAOYSA-N 1 2 214.268 2.233 20 0 BEADLO Cn1cc2c(n1)CC[N@@H+](Cc1ccccc1F)C2 ZINC001203353859 966613965 /nfs/dbraw/zinc/61/39/65/966613965.db2.gz PECZCYWMWGBKLK-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1cc2c(n1)CC[N@H+](Cc1ccccc1F)C2 ZINC001203353859 966613975 /nfs/dbraw/zinc/61/39/75/966613975.db2.gz PECZCYWMWGBKLK-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cc1ccc(Nc2cnc3cnccn32)c(C)[nH+]1 ZINC001203368652 966617199 /nfs/dbraw/zinc/61/71/99/966617199.db2.gz CLPHGECEZCADMA-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cc1ccc(Nc2cccnc2CO)c(C)[nH+]1 ZINC001203369226 966620361 /nfs/dbraw/zinc/62/03/61/966620361.db2.gz LIPOBCYHZQNZCA-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO CCOc1ccccc1C[N@@H+]1CCOC[C@H]1C ZINC001203534967 966670464 /nfs/dbraw/zinc/67/04/64/966670464.db2.gz KHROUAZLFBJFCP-GFCCVEGCSA-N 1 2 235.327 2.306 20 0 BEADLO CCOc1ccccc1C[N@H+]1CCOC[C@H]1C ZINC001203534967 966670468 /nfs/dbraw/zinc/67/04/68/966670468.db2.gz KHROUAZLFBJFCP-GFCCVEGCSA-N 1 2 235.327 2.306 20 0 BEADLO CCOc1ccccc1C[N@@H+]1CCN(C)[C@H](C)C1 ZINC001203544072 966681931 /nfs/dbraw/zinc/68/19/31/966681931.db2.gz RUMUUOLKQACLLR-CYBMUJFWSA-N 1 2 248.370 2.221 20 0 BEADLO Nc1ccnn1-c1ccc([NH+]2CCCCC2)cc1 ZINC001203712833 966748159 /nfs/dbraw/zinc/74/81/59/966748159.db2.gz PJNBTXRLBKIUHC-UHFFFAOYSA-N 1 2 242.326 2.445 20 0 BEADLO Cn1cnc2c1C[N@H+](Cc1cccc(F)c1)CC2 ZINC001203788145 966778263 /nfs/dbraw/zinc/77/82/63/966778263.db2.gz HNEOUWGEEQEWTB-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1cnc2c1C[N@@H+](Cc1cccc(F)c1)CC2 ZINC001203788145 966778268 /nfs/dbraw/zinc/77/82/68/966778268.db2.gz HNEOUWGEEQEWTB-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO COc1cccc(C[NH+]2CC3(C2)CCCCO3)c1 ZINC001203818341 966784118 /nfs/dbraw/zinc/78/41/18/966784118.db2.gz ZVPWTFCIORHXMP-UHFFFAOYSA-N 1 2 247.338 2.450 20 0 BEADLO Cc1cc2[nH+]ccn2cc1/C=C/C(C)(C)O ZINC001239156272 966831178 /nfs/dbraw/zinc/83/11/78/966831178.db2.gz PKMDEYYEVBJYFO-SNAWJCMRSA-N 1 2 216.284 2.427 20 0 BEADLO Cc1cccc(C[N@@H+]2CCC(=O)C(C)(C)C2)n1 ZINC001204067641 966874217 /nfs/dbraw/zinc/87/42/17/966874217.db2.gz CDXPTEVEFIBJHE-UHFFFAOYSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1cccc(C[N@H+]2CCC(=O)C(C)(C)C2)n1 ZINC001204067641 966874221 /nfs/dbraw/zinc/87/42/21/966874221.db2.gz CDXPTEVEFIBJHE-UHFFFAOYSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1c[nH+]c(Nc2ccc(CO)nc2)c(C)c1 ZINC001212372431 966937708 /nfs/dbraw/zinc/93/77/08/966937708.db2.gz JSKWPJFEWDWECJ-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccoc1 ZINC001204243742 966942534 /nfs/dbraw/zinc/94/25/34/966942534.db2.gz GYYXEHFQJRXOBB-LBPRGKRZSA-N 1 2 207.273 2.223 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@H+]1Cc1ccoc1 ZINC001204243742 966942544 /nfs/dbraw/zinc/94/25/44/966942544.db2.gz GYYXEHFQJRXOBB-LBPRGKRZSA-N 1 2 207.273 2.223 20 0 BEADLO CNc1ccc(Nc2cc(F)ccc2CO)c[nH+]1 ZINC001203460225 966961720 /nfs/dbraw/zinc/96/17/20/966961720.db2.gz SAFCYRWPNGXRSE-UHFFFAOYSA-N 1 2 247.273 2.498 20 0 BEADLO Cn1cc(C[NH+]2CCC(=O)CC2)c2ccccc21 ZINC001204316250 966970126 /nfs/dbraw/zinc/97/01/26/966970126.db2.gz ZRCLMZDIUDFJHK-UHFFFAOYSA-N 1 2 242.322 2.343 20 0 BEADLO Cc1cc(C[N@H+]2CCN(C)CC2(C)C)cc(C)n1 ZINC001204347447 966973843 /nfs/dbraw/zinc/97/38/43/966973843.db2.gz JVCOPYHIVQCPSE-UHFFFAOYSA-N 1 2 247.386 2.224 20 0 BEADLO Cc1cc(C[N@@H+]2CCN(C)CC2(C)C)cc(C)n1 ZINC001204347447 966973846 /nfs/dbraw/zinc/97/38/46/966973846.db2.gz JVCOPYHIVQCPSE-UHFFFAOYSA-N 1 2 247.386 2.224 20 0 BEADLO CC(=O)[C@H]1C[N@H+](Cc2ccc(C)c(C)c2)CCO1 ZINC001204357562 966981920 /nfs/dbraw/zinc/98/19/20/966981920.db2.gz WIOGHQLDYJSWCF-OAHLLOKOSA-N 1 2 247.338 2.093 20 0 BEADLO CC(=O)[C@H]1C[N@@H+](Cc2ccc(C)c(C)c2)CCO1 ZINC001204357562 966981931 /nfs/dbraw/zinc/98/19/31/966981931.db2.gz WIOGHQLDYJSWCF-OAHLLOKOSA-N 1 2 247.338 2.093 20 0 BEADLO CCc1ccc(C[N@@H+]2CCc3ncn(C)c3C2)o1 ZINC001204393760 966989594 /nfs/dbraw/zinc/98/95/94/966989594.db2.gz FCHSOJNLLJMTAF-UHFFFAOYSA-N 1 2 245.326 2.134 20 0 BEADLO CCc1ccc(C[N@H+]2CCc3ncn(C)c3C2)o1 ZINC001204393760 966989598 /nfs/dbraw/zinc/98/95/98/966989598.db2.gz FCHSOJNLLJMTAF-UHFFFAOYSA-N 1 2 245.326 2.134 20 0 BEADLO Cc1c(F)cccc1C[N@@H+]1CCN2CC[C@H]1C2 ZINC001204509349 967020564 /nfs/dbraw/zinc/02/05/64/967020564.db2.gz BSIRFBTVFUNMBU-ZDUSSCGKSA-N 1 2 234.318 2.024 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)oc1C ZINC001204530286 967029873 /nfs/dbraw/zinc/02/98/73/967029873.db2.gz CAZYFUFVNJMQLF-TXEJJXNPSA-N 1 2 221.300 2.260 20 0 BEADLO c1csc(C[N@H+]2CC[C@@H]3CCCO[C@@H]3C2)n1 ZINC001204545618 967041917 /nfs/dbraw/zinc/04/19/17/967041917.db2.gz ZITLENPZDSVWMD-WDEREUQCSA-N 1 2 238.356 2.144 20 0 BEADLO c1csc(C[N@@H+]2CC[C@@H]3CCCO[C@@H]3C2)n1 ZINC001204545618 967041902 /nfs/dbraw/zinc/04/19/02/967041902.db2.gz ZITLENPZDSVWMD-WDEREUQCSA-N 1 2 238.356 2.144 20 0 BEADLO Cc1cc(Nc2ccc3[nH+]ccn3c2)cnc1N ZINC001249781273 967054438 /nfs/dbraw/zinc/05/44/38/967054438.db2.gz AIZXBZQHDBVWKO-UHFFFAOYSA-N 1 2 239.282 2.364 20 0 BEADLO Cc1[nH+]c[nH]c1CN1CCC[C@@H](F)C(F)(F)C1 ZINC001204588046 967083532 /nfs/dbraw/zinc/08/35/32/967083532.db2.gz TZALIRLIHSRWAU-SNVBAGLBSA-N 1 2 247.264 2.287 20 0 BEADLO COC(=O)[C@@H]([NH3+])c1ccc(-c2ccoc2)cc1 ZINC001239690848 967085962 /nfs/dbraw/zinc/08/59/62/967085962.db2.gz RVSCWVMZUUAWQR-LBPRGKRZSA-N 1 2 231.251 2.119 20 0 BEADLO COC(=O)[C@H]([NH3+])c1ccc(C2=CCCC2)cc1 ZINC001239788540 967178658 /nfs/dbraw/zinc/17/86/58/967178658.db2.gz DWSXDFVUUPNFEM-CYBMUJFWSA-N 1 2 231.295 2.427 20 0 BEADLO CCCc1cc(C[NH+]2CCOCC2)ccc1OC ZINC001249968758 967210671 /nfs/dbraw/zinc/21/06/71/967210671.db2.gz OCWKDZHUNHRIPK-UHFFFAOYSA-N 1 2 249.354 2.480 20 0 BEADLO Cc1cc(Nc2ccn3cc[nH+]c3c2)no1 ZINC001204944309 967248636 /nfs/dbraw/zinc/24/86/36/967248636.db2.gz XSJVUPLXDZLSDR-UHFFFAOYSA-N 1 2 214.228 2.374 20 0 BEADLO COc1cc(Nc2ccn3cc[nH+]c3c2)no1 ZINC001204959878 967260401 /nfs/dbraw/zinc/26/04/01/967260401.db2.gz YZSXSRBZXPVOPR-UHFFFAOYSA-N 1 2 230.227 2.075 20 0 BEADLO CCc1nccnc1Nc1ccn2cc[nH+]c2c1 ZINC001204966464 967264818 /nfs/dbraw/zinc/26/48/18/967264818.db2.gz UEQDGPJECCFEHK-UHFFFAOYSA-N 1 2 239.282 2.430 20 0 BEADLO COCc1ccccc1-c1cc[nH+]c(N)c1 ZINC001239952271 967267578 /nfs/dbraw/zinc/26/75/78/967267578.db2.gz AALFBEKSVOYKSI-UHFFFAOYSA-N 1 2 214.268 2.477 20 0 BEADLO CCOc1cc(C[N@@H+]2CCC[C@@H](F)C2)ccn1 ZINC001250009120 967270429 /nfs/dbraw/zinc/27/04/29/967270429.db2.gz CYNSZBUAZHNQSJ-GFCCVEGCSA-N 1 2 238.306 2.414 20 0 BEADLO CCOc1cc(C[N@H+]2CCC[C@@H](F)C2)ccn1 ZINC001250009120 967270434 /nfs/dbraw/zinc/27/04/34/967270434.db2.gz CYNSZBUAZHNQSJ-GFCCVEGCSA-N 1 2 238.306 2.414 20 0 BEADLO Nc1ccc2ncn(-c3ccn4cc[nH+]c4c3)c2c1 ZINC001204978183 967272331 /nfs/dbraw/zinc/27/23/31/967272331.db2.gz OZWYAVDTGCJXRZ-UHFFFAOYSA-N 1 2 249.277 2.255 20 0 BEADLO Cc1nnc2ccc(-c3ccc4[nH+]ccn4c3)cn12 ZINC001240218458 967426630 /nfs/dbraw/zinc/42/66/30/967426630.db2.gz DFDKUKXABXHOLB-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO Cc1ccc(C[N@@H+]2C[C@H]3CC[C@@H]2CO3)cc1F ZINC001205252158 967437084 /nfs/dbraw/zinc/43/70/84/967437084.db2.gz XDZIIFVWYPZOSM-CHWSQXEVSA-N 1 2 235.302 2.497 20 0 BEADLO Cc1ccc(C[N@H+]2C[C@H]3CC[C@@H]2CO3)cc1F ZINC001205252158 967437091 /nfs/dbraw/zinc/43/70/91/967437091.db2.gz XDZIIFVWYPZOSM-CHWSQXEVSA-N 1 2 235.302 2.497 20 0 BEADLO CCn1nccc1Nc1cc(OC)cc[nH+]1 ZINC001205268336 967461484 /nfs/dbraw/zinc/46/14/84/967461484.db2.gz MAERNCCCLMREFS-UHFFFAOYSA-N 1 2 218.260 2.050 20 0 BEADLO CNc1cc(Cc2csc(C)n2)cc[nH+]1 ZINC001250198061 967515581 /nfs/dbraw/zinc/51/55/81/967515581.db2.gz HHUDVLSAOPYAKK-UHFFFAOYSA-N 1 2 219.313 2.479 20 0 BEADLO Oc1cc(Cl)cc(CCn2cc[nH+]c2)c1 ZINC001250316193 967675924 /nfs/dbraw/zinc/67/59/24/967675924.db2.gz CYXKMRWKNLMSJO-UHFFFAOYSA-N 1 2 222.675 2.485 20 0 BEADLO c1cnn(-c2cccc(CCn3cc[nH+]c3)c2)c1 ZINC001250315862 967682464 /nfs/dbraw/zinc/68/24/64/967682464.db2.gz UMPRDXUYQKGNFV-UHFFFAOYSA-N 1 2 238.294 2.312 20 0 BEADLO Cn1cc2cc(CCn3cc[nH+]c3)ccc2n1 ZINC001250316723 967687711 /nfs/dbraw/zinc/68/77/11/967687711.db2.gz UTNFXPJESOOODK-UHFFFAOYSA-N 1 2 226.283 2.013 20 0 BEADLO CC(=O)c1ccc(F)c(CCn2cc[nH+]c2)c1 ZINC001250316753 967689951 /nfs/dbraw/zinc/68/99/51/967689951.db2.gz WEHCHCCACPKYOL-UHFFFAOYSA-N 1 2 232.258 2.468 20 0 BEADLO Cc1cc(CCn2cc[nH+]c2)cc(O)c1F ZINC001250319963 967696703 /nfs/dbraw/zinc/69/67/03/967696703.db2.gz GYLBNBKGWWSZDA-UHFFFAOYSA-N 1 2 220.247 2.279 20 0 BEADLO CC(=O)Nc1ccc(CCn2cc[nH+]c2)cc1F ZINC001250320052 967696728 /nfs/dbraw/zinc/69/67/28/967696728.db2.gz XAOMZMXQRGYCFB-UHFFFAOYSA-N 1 2 247.273 2.223 20 0 BEADLO Cc1c(N)c(F)ccc1CCn1cc[nH+]c1 ZINC001250320286 967697843 /nfs/dbraw/zinc/69/78/43/967697843.db2.gz KAQJVHHXUOCJFX-UHFFFAOYSA-N 1 2 219.263 2.156 20 0 BEADLO CC(=O)c1cc(CCn2cc[nH+]c2)cs1 ZINC001250321111 967698854 /nfs/dbraw/zinc/69/88/54/967698854.db2.gz WUTCXZZOOUDBIS-UHFFFAOYSA-N 1 2 220.297 2.390 20 0 BEADLO Nc1c(F)c(F)c(F)cc1CCn1cc[nH+]c1 ZINC001250321109 967699746 /nfs/dbraw/zinc/69/97/46/967699746.db2.gz WULHXEOCDQHOBN-UHFFFAOYSA-N 1 2 241.216 2.125 20 0 BEADLO CCN(Cc1cc(C)cc(F)c1)C1C[NH+](C)C1 ZINC001143618690 967700065 /nfs/dbraw/zinc/70/00/65/967700065.db2.gz CXQXQBWXGSPENU-UHFFFAOYSA-N 1 2 236.334 2.270 20 0 BEADLO CCCCNc1cc[nH+]c(C(=O)OC)c1C ZINC001162205738 967738386 /nfs/dbraw/zinc/73/83/86/967738386.db2.gz OJRVDBZWLYVFOO-UHFFFAOYSA-N 1 2 222.288 2.389 20 0 BEADLO c1nocc1C[N@@H+]1CCOc2ccccc2C1 ZINC001205697142 967780293 /nfs/dbraw/zinc/78/02/93/967780293.db2.gz NPRAQMCZMGXHPN-UHFFFAOYSA-N 1 2 230.267 2.069 20 0 BEADLO c1nocc1C[N@H+]1CCOc2ccccc2C1 ZINC001205697142 967780314 /nfs/dbraw/zinc/78/03/14/967780314.db2.gz NPRAQMCZMGXHPN-UHFFFAOYSA-N 1 2 230.267 2.069 20 0 BEADLO C[N@H+](Cc1cnoc1)Cc1ccc(Cl)nc1 ZINC001205723888 967804501 /nfs/dbraw/zinc/80/45/01/967804501.db2.gz FBWCUNUVBOCQJM-UHFFFAOYSA-N 1 2 237.690 2.355 20 0 BEADLO C[N@@H+](Cc1cnoc1)Cc1ccc(Cl)nc1 ZINC001205723888 967804514 /nfs/dbraw/zinc/80/45/14/967804514.db2.gz FBWCUNUVBOCQJM-UHFFFAOYSA-N 1 2 237.690 2.355 20 0 BEADLO COc1cc[nH+]cc1Cc1cccc(C)n1 ZINC001250422982 967834706 /nfs/dbraw/zinc/83/47/06/967834706.db2.gz LTUPBYAGZFODLP-UHFFFAOYSA-N 1 2 214.268 2.384 20 0 BEADLO Cc1ccc(Cc2ccnn2C)c(C)[nH+]1 ZINC001250437656 967860147 /nfs/dbraw/zinc/86/01/47/967860147.db2.gz RQVZUQILNFHFBI-UHFFFAOYSA-N 1 2 201.273 2.023 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccnc2C)n(C)n1 ZINC001205927715 967888296 /nfs/dbraw/zinc/88/82/96/967888296.db2.gz GZRWMMLZVBGRIB-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccnc2C)n(C)n1 ZINC001205927715 967888299 /nfs/dbraw/zinc/88/82/99/967888299.db2.gz GZRWMMLZVBGRIB-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cc(-c2cccnc2F)c[nH+]c1N ZINC001250487330 967947271 /nfs/dbraw/zinc/94/72/71/967947271.db2.gz YJCMOSCWWTVWOK-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO Nc1cc(-c2ccnc3ccncc32)cc[nH+]1 ZINC001250503909 967993152 /nfs/dbraw/zinc/99/31/52/967993152.db2.gz NXTUIRUVLUUDLK-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO C[NH+](C)Cc1nnc(C[C@@H]2C=CCCC2)o1 ZINC001118138420 968015883 /nfs/dbraw/zinc/01/58/83/968015883.db2.gz DBQRFNHGDLDJBL-SNVBAGLBSA-N 1 2 221.304 2.030 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@@H](C(F)F)C2)co1 ZINC001206068193 968032243 /nfs/dbraw/zinc/03/22/43/968032243.db2.gz OLJLMLRWUAJPCS-SECBINFHSA-N 1 2 230.258 2.460 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@@H](C(F)F)C2)co1 ZINC001206068193 968032254 /nfs/dbraw/zinc/03/22/54/968032254.db2.gz OLJLMLRWUAJPCS-SECBINFHSA-N 1 2 230.258 2.460 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)co1 ZINC001206067641 968033527 /nfs/dbraw/zinc/03/35/27/968033527.db2.gz GRLSCOWZKLNEGU-MRVPVSSYSA-N 1 2 234.221 2.367 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@H](C(F)(F)F)C2)co1 ZINC001206067641 968033541 /nfs/dbraw/zinc/03/35/41/968033541.db2.gz GRLSCOWZKLNEGU-MRVPVSSYSA-N 1 2 234.221 2.367 20 0 BEADLO CNc1ccc(Nc2cccnc2F)c[nH+]1 ZINC001203449008 968123587 /nfs/dbraw/zinc/12/35/87/968123587.db2.gz VKPWBPASLGERMM-UHFFFAOYSA-N 1 2 218.235 2.401 20 0 BEADLO COCCCc1[nH+]c2cc(OC)ccc2n1C ZINC001250603268 968147982 /nfs/dbraw/zinc/14/79/82/968147982.db2.gz OXLTUAWWEJTWJJ-UHFFFAOYSA-N 1 2 234.299 2.161 20 0 BEADLO Cc1cccc2c1[nH+]c(CCC1OCCO1)n2C ZINC001250608005 968154322 /nfs/dbraw/zinc/15/43/22/968154322.db2.gz KNTSPKWXOLBTDK-UHFFFAOYSA-N 1 2 246.310 2.187 20 0 BEADLO C[C@H]1C[C@@H]1c1[nH]c2cc3c(cc2[nH+]1)OCC(=O)N3 ZINC001250616108 968163518 /nfs/dbraw/zinc/16/35/18/968163518.db2.gz WXFIFHPZKSMDNL-BQBZGAKWSA-N 1 2 243.266 2.017 20 0 BEADLO C[C@@H]1[C@H](CO)CCN1c1cccc(C2CC2)[nH+]1 ZINC001164056787 968165113 /nfs/dbraw/zinc/16/51/13/968165113.db2.gz SJXWPETYWKNBMP-PWSUYJOCSA-N 1 2 232.327 2.166 20 0 BEADLO Cc1c(F)cc[nH+]c1N1CCC(=O)[C@@H](C)CC1 ZINC001164369698 968230426 /nfs/dbraw/zinc/23/04/26/968230426.db2.gz YMYGSDJYKIVJFQ-VIFPVBQESA-N 1 2 236.290 2.335 20 0 BEADLO C[C@@H](C(=O)N[C@@H]1CCCC[C@H]1C)n1cc[nH+]c1 ZINC001251283773 968278605 /nfs/dbraw/zinc/27/86/05/968278605.db2.gz OCWWWLHETWDSRS-GRYCIOLGSA-N 1 2 235.331 2.139 20 0 BEADLO C[C@H](CCO)Nc1cccc(-c2c[nH+]cn2C)c1 ZINC001165938659 968301875 /nfs/dbraw/zinc/30/18/75/968301875.db2.gz PIWYLGMDPYLFRR-LLVKDONJSA-N 1 2 245.326 2.270 20 0 BEADLO Cn1c[nH+]c2cc(Nc3ccc[nH]c3=O)ccc21 ZINC001206463987 968321589 /nfs/dbraw/zinc/32/15/89/968321589.db2.gz LFUIQAMVKDTMNL-UHFFFAOYSA-N 1 2 240.266 2.418 20 0 BEADLO CC(C)[N@@H+](C)Cc1c(F)cncc1F ZINC001206856362 968492962 /nfs/dbraw/zinc/49/29/62/968492962.db2.gz SQOUQTGQOMTHTM-UHFFFAOYSA-N 1 2 200.232 2.200 20 0 BEADLO CC(C)[N@H+](C)Cc1c(F)cncc1F ZINC001206856362 968492957 /nfs/dbraw/zinc/49/29/57/968492957.db2.gz SQOUQTGQOMTHTM-UHFFFAOYSA-N 1 2 200.232 2.200 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000822715601 968534424 /nfs/dbraw/zinc/53/44/24/968534424.db2.gz HBRUDPHTHPNLGM-VXGBXAGGSA-N 1 2 249.358 2.469 20 0 BEADLO F[C@H]1CC[N@H+](Cc2ncccn2)CCC1(F)F ZINC001207010163 968545246 /nfs/dbraw/zinc/54/52/46/968545246.db2.gz KAGLVTQYNCJTRW-VIFPVBQESA-N 1 2 245.248 2.046 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2ncccn2)CCC1(F)F ZINC001207010163 968545258 /nfs/dbraw/zinc/54/52/58/968545258.db2.gz KAGLVTQYNCJTRW-VIFPVBQESA-N 1 2 245.248 2.046 20 0 BEADLO Fc1cncc(C[NH+]2CC(c3cccnc3)C2)c1 ZINC001207023514 968557987 /nfs/dbraw/zinc/55/79/87/968557987.db2.gz INSURWYJTYQJRZ-UHFFFAOYSA-N 1 2 243.285 2.215 20 0 BEADLO Cc1ncc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)s1 ZINC001207058020 968583980 /nfs/dbraw/zinc/58/39/80/968583980.db2.gz BERSQMBFMJIKRF-LSJOCFKGSA-N 1 2 226.320 2.241 20 0 BEADLO Cc1ncc(C[N@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)s1 ZINC001207058020 968583987 /nfs/dbraw/zinc/58/39/87/968583987.db2.gz BERSQMBFMJIKRF-LSJOCFKGSA-N 1 2 226.320 2.241 20 0 BEADLO CCc1nccc(C[N@H+](C)Cc2ccccn2)n1 ZINC001207082284 968613335 /nfs/dbraw/zinc/61/33/35/968613335.db2.gz JKWDWUIZFJJZCL-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO CCc1nccc(C[N@@H+](C)Cc2ccccn2)n1 ZINC001207082284 968613337 /nfs/dbraw/zinc/61/33/37/968613337.db2.gz JKWDWUIZFJJZCL-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO Fc1ccc(-c2nnc(C[NH+]3CCC3)o2)cc1 ZINC001252223758 968616285 /nfs/dbraw/zinc/61/62/85/968616285.db2.gz BDAOKIASBPHUAN-UHFFFAOYSA-N 1 2 233.246 2.081 20 0 BEADLO CCn1cc(-c2cccc3[nH+]ccn32)cn1 ZINC001240649979 968618270 /nfs/dbraw/zinc/61/82/70/968618270.db2.gz PQJMFSOEMJBWBM-UHFFFAOYSA-N 1 2 212.256 2.218 20 0 BEADLO CCc1nccc(C[N@@H+]2CCC[C@](C)(F)C2)n1 ZINC001207083565 968618371 /nfs/dbraw/zinc/61/83/71/968618371.db2.gz BNAUDGGQTDATNO-ZDUSSCGKSA-N 1 2 237.322 2.363 20 0 BEADLO CCc1nccc(C[N@H+]2CCC[C@](C)(F)C2)n1 ZINC001207083565 968618376 /nfs/dbraw/zinc/61/83/76/968618376.db2.gz BNAUDGGQTDATNO-ZDUSSCGKSA-N 1 2 237.322 2.363 20 0 BEADLO CC(C)(O)CNc1ccc(N2CCCCC2)[nH+]c1 ZINC001252346782 968627088 /nfs/dbraw/zinc/62/70/88/968627088.db2.gz RASQDJOAIMUTPJ-UHFFFAOYSA-N 1 2 249.358 2.255 20 0 BEADLO Fc1cnc(C[N@H+]2C[C@@H]3C[C@H]2C[C@@H]3F)c(F)c1 ZINC001207098843 968628853 /nfs/dbraw/zinc/62/88/53/968628853.db2.gz JRCZIHYAARQNSH-HGNGGELXSA-N 1 2 242.244 2.292 20 0 BEADLO Fc1cnc(C[N@@H+]2C[C@@H]3C[C@H]2C[C@@H]3F)c(F)c1 ZINC001207098843 968628862 /nfs/dbraw/zinc/62/88/62/968628862.db2.gz JRCZIHYAARQNSH-HGNGGELXSA-N 1 2 242.244 2.292 20 0 BEADLO CC(C)(O)CNc1cccc(-n2cc[nH+]c2)c1 ZINC001252359246 968637735 /nfs/dbraw/zinc/63/77/35/968637735.db2.gz WIGADFLSJUSZRE-UHFFFAOYSA-N 1 2 231.299 2.055 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCCCC12COC2 ZINC001207137459 968649869 /nfs/dbraw/zinc/64/98/69/968649869.db2.gz DRBHFKLCHHLQCK-UHFFFAOYSA-N 1 2 236.315 2.046 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCCCC12COC2 ZINC001207137459 968649874 /nfs/dbraw/zinc/64/98/74/968649874.db2.gz DRBHFKLCHHLQCK-UHFFFAOYSA-N 1 2 236.315 2.046 20 0 BEADLO Cc1cncc(C[N@@H+]2CCC(=O)[C@H](C)CC2)c1 ZINC001207155358 968667850 /nfs/dbraw/zinc/66/78/50/968667850.db2.gz QEKMIFGCOJBEDT-GFCCVEGCSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1cncc(C[N@H+]2CCC(=O)[C@H](C)CC2)c1 ZINC001207155358 968667856 /nfs/dbraw/zinc/66/78/56/968667856.db2.gz QEKMIFGCOJBEDT-GFCCVEGCSA-N 1 2 232.327 2.191 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@H+]1Cc1ccnn1C(C)C ZINC001207174942 968679347 /nfs/dbraw/zinc/67/93/47/968679347.db2.gz QIDRCHBDHJWNOW-AWEZNQCLSA-N 1 2 249.358 2.408 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccnn1C(C)C ZINC001207174942 968679352 /nfs/dbraw/zinc/67/93/52/968679352.db2.gz QIDRCHBDHJWNOW-AWEZNQCLSA-N 1 2 249.358 2.408 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1C[C@@H](F)C[C@H]1C ZINC001207171227 968680743 /nfs/dbraw/zinc/68/07/43/968680743.db2.gz ZGGFWIFODRHENY-MNOVXSKESA-N 1 2 225.311 2.396 20 0 BEADLO CC(C)n1nccc1C[N@H+]1C[C@@H](F)C[C@H]1C ZINC001207171227 968680749 /nfs/dbraw/zinc/68/07/49/968680749.db2.gz ZGGFWIFODRHENY-MNOVXSKESA-N 1 2 225.311 2.396 20 0 BEADLO CCOc1ccc[nH+]c1NC[C@@H](O)c1ccco1 ZINC001154881442 968702050 /nfs/dbraw/zinc/70/20/50/968702050.db2.gz XTQXAMOJQYHISB-SNVBAGLBSA-N 1 2 248.282 2.219 20 0 BEADLO Clc1ncnc(Cl)c1CC[NH+]1CCC1 ZINC001207324957 968721207 /nfs/dbraw/zinc/72/12/07/968721207.db2.gz XOZSKDKZXGVAHI-UHFFFAOYSA-N 1 2 232.114 2.032 20 0 BEADLO COC1C[NH+](CCCc2ccccc2F)C1 ZINC001207489772 968802498 /nfs/dbraw/zinc/80/24/98/968802498.db2.gz GSLSDWGJEPSTGA-UHFFFAOYSA-N 1 2 223.291 2.089 20 0 BEADLO Cn1ncc2c1C[N@H+](CCc1ccc(F)cc1)C2 ZINC001207515519 968816445 /nfs/dbraw/zinc/81/64/45/968816445.db2.gz SOABDIUGEMBJDT-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1ncc2c1C[N@@H+](CCc1ccc(F)cc1)C2 ZINC001207515519 968816450 /nfs/dbraw/zinc/81/64/50/968816450.db2.gz SOABDIUGEMBJDT-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1cnn2cccnc12 ZINC001240929248 968817841 /nfs/dbraw/zinc/81/78/41/968817841.db2.gz SCKNYNDERDAZMU-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO O=C1CCC[N@@H+](CC2CCSCC2)C[C@@H]1F ZINC001207697154 968864101 /nfs/dbraw/zinc/86/41/01/968864101.db2.gz YBTVNHWFJRZMJO-NSHDSACASA-N 1 2 245.363 2.133 20 0 BEADLO O=C1CCC[N@H+](CC2CCSCC2)C[C@@H]1F ZINC001207697154 968864104 /nfs/dbraw/zinc/86/41/04/968864104.db2.gz YBTVNHWFJRZMJO-NSHDSACASA-N 1 2 245.363 2.133 20 0 BEADLO Nc1cc(-c2ccc(-c3nc[nH]n3)cc2)cc[nH+]1 ZINC001241162742 968945105 /nfs/dbraw/zinc/94/51/05/968945105.db2.gz KTQPCMBFBWLSCW-UHFFFAOYSA-N 1 2 237.266 2.116 20 0 BEADLO CCC[C@@H](O)CNc1ccc(N2CCCC2)[nH+]c1 ZINC001252779783 968952477 /nfs/dbraw/zinc/95/24/77/968952477.db2.gz UUGXEZOWRHDWBC-CYBMUJFWSA-N 1 2 249.358 2.255 20 0 BEADLO CS[C@@H](C)CC[N@@H+]1CCC(F)(F)C1 ZINC001208136961 969043653 /nfs/dbraw/zinc/04/36/53/969043653.db2.gz DUJLLUKKJGQJMJ-QMMMGPOBSA-N 1 2 209.305 2.469 20 0 BEADLO CS[C@@H](C)CC[N@H+]1CCC(F)(F)C1 ZINC001208136961 969043665 /nfs/dbraw/zinc/04/36/65/969043665.db2.gz DUJLLUKKJGQJMJ-QMMMGPOBSA-N 1 2 209.305 2.469 20 0 BEADLO CS[C@H](C)CC[N@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001208139461 969051771 /nfs/dbraw/zinc/05/17/71/969051771.db2.gz RVRZDUJHGHZZHG-HLTSFMKQSA-N 1 2 209.305 2.120 20 0 BEADLO CS[C@H](C)CC[N@@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001208139461 969051781 /nfs/dbraw/zinc/05/17/81/969051781.db2.gz RVRZDUJHGHZZHG-HLTSFMKQSA-N 1 2 209.305 2.120 20 0 BEADLO COC(=O)C1(C)CCC([NH+]2CC(C)(F)C2)CC1 ZINC001168775456 969094008 /nfs/dbraw/zinc/09/40/08/969094008.db2.gz QHVARAZWAQBMGZ-UHFFFAOYSA-N 1 2 243.322 2.152 20 0 BEADLO CC1(C)C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc21 ZINC001242018320 969171959 /nfs/dbraw/zinc/17/19/59/969171959.db2.gz IHKFYJJHKFOOAW-UHFFFAOYSA-N 1 2 227.267 2.306 20 0 BEADLO c1cn(-c2ccc(-c3ccnnc3)cc2)c[nH+]1 ZINC001242055608 969186018 /nfs/dbraw/zinc/18/60/18/969186018.db2.gz IFPVYWMVRRMYJK-UHFFFAOYSA-N 1 2 222.251 2.329 20 0 BEADLO Cc1nnc(-c2ccc(-n3cc[nH+]c3)cc2)o1 ZINC001253463264 969187003 /nfs/dbraw/zinc/18/70/03/969187003.db2.gz MTVVAWMLATZDSQ-UHFFFAOYSA-N 1 2 226.239 2.231 20 0 BEADLO Cc1cn2c(cccc2C2=CCOCC2)[nH+]1 ZINC001242074688 969199174 /nfs/dbraw/zinc/19/91/74/969199174.db2.gz HRHZICHNHOGDOA-UHFFFAOYSA-N 1 2 214.268 2.446 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1nc(C)nc(C)c1F ZINC001242078137 969199844 /nfs/dbraw/zinc/19/98/44/969199844.db2.gz SEQAYUYKYPZZHE-UHFFFAOYSA-N 1 2 232.262 2.185 20 0 BEADLO CC/C=C\CC[N@@H+]1C[C@@H](CO)CC(F)(F)C1 ZINC001208726322 969211805 /nfs/dbraw/zinc/21/18/05/969211805.db2.gz UAENRHHLAICDGW-BYCRGOAPSA-N 1 2 233.302 2.292 20 0 BEADLO CC/C=C\CC[N@H+]1C[C@@H](CO)CC(F)(F)C1 ZINC001208726322 969211813 /nfs/dbraw/zinc/21/18/13/969211813.db2.gz UAENRHHLAICDGW-BYCRGOAPSA-N 1 2 233.302 2.292 20 0 BEADLO CC(C)CCC[N@@H+]1CCCC(=O)[C@@H](F)C1 ZINC001208734192 969221086 /nfs/dbraw/zinc/22/10/86/969221086.db2.gz RDPRJCNINNLHNQ-NSHDSACASA-N 1 2 215.312 2.426 20 0 BEADLO CC(C)CCC[N@H+]1CCCC(=O)[C@@H](F)C1 ZINC001208734192 969221095 /nfs/dbraw/zinc/22/10/95/969221095.db2.gz RDPRJCNINNLHNQ-NSHDSACASA-N 1 2 215.312 2.426 20 0 BEADLO CC(C)CCC[N@@H+]1Cc2cncnc2C1 ZINC001208733155 969219592 /nfs/dbraw/zinc/21/95/92/969219592.db2.gz GKXVEOOENKNBKE-UHFFFAOYSA-N 1 2 205.305 2.228 20 0 BEADLO CC(C)CCC[N@H+]1Cc2cncnc2C1 ZINC001208733155 969219603 /nfs/dbraw/zinc/21/96/03/969219603.db2.gz GKXVEOOENKNBKE-UHFFFAOYSA-N 1 2 205.305 2.228 20 0 BEADLO C[N@@H+](CC(=O)c1ccccc1)C[C@@H]1CCC=CO1 ZINC001208882081 969269339 /nfs/dbraw/zinc/26/93/39/969269339.db2.gz HMYIGFJMYMRUFU-AWEZNQCLSA-N 1 2 245.322 2.494 20 0 BEADLO C[N@H+](CC(=O)c1ccccc1)C[C@@H]1CCC=CO1 ZINC001208882081 969269347 /nfs/dbraw/zinc/26/93/47/969269347.db2.gz HMYIGFJMYMRUFU-AWEZNQCLSA-N 1 2 245.322 2.494 20 0 BEADLO Cc1nnc2n1CC[N@@H+](CC1(C)CCCCC1)C2 ZINC001208900264 969290811 /nfs/dbraw/zinc/29/08/11/969290811.db2.gz QMHMOVPDTGMJEF-UHFFFAOYSA-N 1 2 248.374 2.373 20 0 BEADLO Cc1nnc2n1CC[N@H+](CC1(C)CCCCC1)C2 ZINC001208900264 969290815 /nfs/dbraw/zinc/29/08/15/969290815.db2.gz QMHMOVPDTGMJEF-UHFFFAOYSA-N 1 2 248.374 2.373 20 0 BEADLO Cn1c[nH+]c2ccc(NC[C@H](O)C(C)(C)C)cc21 ZINC001253732951 969356655 /nfs/dbraw/zinc/35/66/55/969356655.db2.gz IOHOQYFAIPBPSY-ZDUSSCGKSA-N 1 2 247.342 2.392 20 0 BEADLO CC(C)[C@@H](O)CNc1ccc2[nH+]cn(C)c2c1 ZINC001253771102 969391959 /nfs/dbraw/zinc/39/19/59/969391959.db2.gz FUMLTQWNLNAZBL-ZDUSSCGKSA-N 1 2 233.315 2.002 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccoc2C)[nH]n1 ZINC001253997427 969443385 /nfs/dbraw/zinc/44/33/85/969443385.db2.gz NZXVVAZCBZAAJO-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccoc2C)[nH]n1 ZINC001253997427 969443392 /nfs/dbraw/zinc/44/33/92/969443392.db2.gz NZXVVAZCBZAAJO-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO CNc1ccc(NCc2ncccc2OC)c[nH+]1 ZINC001169209768 969484885 /nfs/dbraw/zinc/48/48/85/969484885.db2.gz CZEDGWIIELJAKR-UHFFFAOYSA-N 1 2 244.298 2.139 20 0 BEADLO COc1cc(CCNc2c[nH+]ccc2C)ccn1 ZINC001169223592 969494786 /nfs/dbraw/zinc/49/47/86/969494786.db2.gz WZUVWXUDEVDQFJ-UHFFFAOYSA-N 1 2 243.310 2.448 20 0 BEADLO COc1cncc(CCNc2c[nH+]ccc2C)c1 ZINC001169265477 969525164 /nfs/dbraw/zinc/52/51/64/969525164.db2.gz GXVMEHPXYAABFQ-UHFFFAOYSA-N 1 2 243.310 2.448 20 0 BEADLO O=C1CC[NH+](Cc2ccc3cc[nH]c3c2)CC1 ZINC001209507243 969529289 /nfs/dbraw/zinc/52/92/89/969529289.db2.gz HIJJHOCBBCOPGG-UHFFFAOYSA-N 1 2 228.295 2.333 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CC(C)(C)C2(C)C)[nH]1 ZINC001325221656 1169937286 /nfs/dbraw/zinc/93/72/86/1169937286.db2.gz FBOITGHRMSVSRB-QMMMGPOBSA-N 1 2 222.336 2.295 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CC(C)(C)C2(C)C)[nH]1 ZINC001325221656 1169937288 /nfs/dbraw/zinc/93/72/88/1169937288.db2.gz FBOITGHRMSVSRB-QMMMGPOBSA-N 1 2 222.336 2.295 20 0 BEADLO Clc1ccc2n[nH]c(C[NH+]3CCC3)c2c1 ZINC001209749710 969601661 /nfs/dbraw/zinc/60/16/61/969601661.db2.gz ABTHBQTVGRYAKY-UHFFFAOYSA-N 1 2 221.691 2.422 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1c[nH]nc1-c1ccccc1 ZINC001209759266 969601965 /nfs/dbraw/zinc/60/19/65/969601965.db2.gz VPWUGASBAYVZPR-UHFFFAOYSA-N 1 2 243.310 2.098 20 0 BEADLO CC(=O)C[N@H+](C)Cc1c[nH]nc1-c1ccccc1 ZINC001209759266 969601970 /nfs/dbraw/zinc/60/19/70/969601970.db2.gz VPWUGASBAYVZPR-UHFFFAOYSA-N 1 2 243.310 2.098 20 0 BEADLO C[NH+](C)Cc1n[nH]c2ccc(Cl)cc21 ZINC001209750548 969605328 /nfs/dbraw/zinc/60/53/28/969605328.db2.gz IRIJFYNBXPZANO-UHFFFAOYSA-N 1 2 209.680 2.278 20 0 BEADLO Cn1cnc(Nc2ccc3[nH]c[nH+]c3c2)c1 ZINC001209841468 969654653 /nfs/dbraw/zinc/65/46/53/969654653.db2.gz PXWZCAZFXHNKKT-UHFFFAOYSA-N 1 2 213.244 2.040 20 0 BEADLO Nc1cnc(Nc2ccc3c[nH+]ccc3c2)cn1 ZINC001210046083 969776225 /nfs/dbraw/zinc/77/62/25/969776225.db2.gz RUNWDHKFRJKMDF-UHFFFAOYSA-N 1 2 237.266 2.351 20 0 BEADLO Cc1c[nH+]c(Nc2cc(F)ccc2CO)c(N)c1 ZINC001210179740 969820050 /nfs/dbraw/zinc/82/00/50/969820050.db2.gz SCSNVAPXOSJDSN-UHFFFAOYSA-N 1 2 247.273 2.347 20 0 BEADLO CCC[C@H](OCC[NH+]1CCOCC1)C(C)C ZINC001210208457 969831886 /nfs/dbraw/zinc/83/18/86/969831886.db2.gz SOXLJJKXXKPSTE-ZDUSSCGKSA-N 1 2 229.364 2.160 20 0 BEADLO O=C1C[C@@H]2CC([NH+]3CC(F)(C4CC4)C3)C[C@H]2C1 ZINC001254946776 969835637 /nfs/dbraw/zinc/83/56/37/969835637.db2.gz UDRWQZWXJIAMQO-UWVGGRQHSA-N 1 2 237.318 2.178 20 0 BEADLO CCc1ccc(NCc2ncccc2O)[nH+]c1 ZINC001169733295 969837938 /nfs/dbraw/zinc/83/79/38/969837938.db2.gz SXHJDGHTPHSICA-UHFFFAOYSA-N 1 2 229.283 2.357 20 0 BEADLO Cn1cnc(Nc2cccc3cc[nH+]cc32)n1 ZINC001210222469 969838568 /nfs/dbraw/zinc/83/85/68/969838568.db2.gz JDDZVJDNXWZJQN-UHFFFAOYSA-N 1 2 225.255 2.107 20 0 BEADLO CC/C=C(\C)[C@H](CC)OCC[NH+]1CCOCC1 ZINC001210224660 969838962 /nfs/dbraw/zinc/83/89/62/969838962.db2.gz COOIMTGRJIOUPN-BLXFFLACSA-N 1 2 241.375 2.470 20 0 BEADLO Cc1cc(Nc2c[nH+]c(C)c(N)c2)nc(C)n1 ZINC001210283753 969852212 /nfs/dbraw/zinc/85/22/12/969852212.db2.gz BBXWDJFFIWOKJU-UHFFFAOYSA-N 1 2 229.287 2.123 20 0 BEADLO Cc1noc(Nc2c[nH+]c(C)c(N)c2)c1C ZINC001210286253 969853662 /nfs/dbraw/zinc/85/36/62/969853662.db2.gz ZENFZANYFUIQAE-UHFFFAOYSA-N 1 2 218.260 2.321 20 0 BEADLO COc1cncc(Nc2c[nH+]c(C)c(N)c2)c1 ZINC001210287502 969854851 /nfs/dbraw/zinc/85/48/51/969854851.db2.gz WCOIATGSEBOUJN-UHFFFAOYSA-N 1 2 230.271 2.119 20 0 BEADLO CSc1ncc(Nc2c[nH+]c(C)c(N)c2)cn1 ZINC001210289150 969856464 /nfs/dbraw/zinc/85/64/64/969856464.db2.gz XAABRRHHEZBILV-UHFFFAOYSA-N 1 2 247.327 2.228 20 0 BEADLO Cc1ccc(-c2noc([C@H](C)n3cc[nH+]c3)n2)o1 ZINC000350790913 969858622 /nfs/dbraw/zinc/85/86/22/969858622.db2.gz DESZQLUEIROQPE-VIFPVBQESA-N 1 2 244.254 2.444 20 0 BEADLO Cc1[nH+]cc(Nc2cccc(CO)c2F)cc1N ZINC001210290235 969859343 /nfs/dbraw/zinc/85/93/43/969859343.db2.gz GNLJZZIFVSKOSJ-UHFFFAOYSA-N 1 2 247.273 2.347 20 0 BEADLO Cc1[nH+]cc(Nc2cccc(N)c2O)cc1N ZINC001210293098 969859797 /nfs/dbraw/zinc/85/97/97/969859797.db2.gz FVUMBPVWAZWZKO-UHFFFAOYSA-N 1 2 230.271 2.004 20 0 BEADLO Cc1[nH+]cc(Nc2cccc(F)c2CO)cc1N ZINC001210289596 969860093 /nfs/dbraw/zinc/86/00/93/969860093.db2.gz TXLFGDRGFCYFIG-UHFFFAOYSA-N 1 2 247.273 2.347 20 0 BEADLO CC1(C)CC([NH2+][C@H]2CC2(F)F)CC(C)(C)N1O ZINC001169968313 969887348 /nfs/dbraw/zinc/88/73/48/969887348.db2.gz XUAYXWLSSMLLDV-VIFPVBQESA-N 1 2 248.317 2.394 20 0 BEADLO CCc1nnc(CCc2cn3ccccc3[nH+]2)o1 ZINC001255086581 969917595 /nfs/dbraw/zinc/91/75/95/969917595.db2.gz HDONEAMPNYILNQ-UHFFFAOYSA-N 1 2 242.282 2.065 20 0 BEADLO Cc1oncc1Nc1ccc(N(C)C)[nH+]c1 ZINC001210575684 969949605 /nfs/dbraw/zinc/94/96/05/969949605.db2.gz DFJBRLXOCFTKNZ-UHFFFAOYSA-N 1 2 218.260 2.188 20 0 BEADLO CC1(C)CC([NH+]2CC(F)C2)CC(C)(C)N1O ZINC001169994025 969963329 /nfs/dbraw/zinc/96/33/29/969963329.db2.gz WERJGNDVJWTYHR-UHFFFAOYSA-N 1 2 230.327 2.051 20 0 BEADLO C[C@H](O)c1ccc(Nc2[nH+]cccc2N)cc1 ZINC001210640660 969988138 /nfs/dbraw/zinc/98/81/38/969988138.db2.gz KCIDMQCFVMQBGX-VIFPVBQESA-N 1 2 229.283 2.461 20 0 BEADLO Cc1c[nH+]c(N2CC3CC(C3)C2)nc1NC(C)C ZINC001156887096 970021291 /nfs/dbraw/zinc/02/12/91/970021291.db2.gz BQPXHJSFKIGZMK-UHFFFAOYSA-N 1 2 246.358 2.452 20 0 BEADLO Nc1ccc[nH+]c1Nc1cc(F)c(N)c(F)c1 ZINC001210905025 970064206 /nfs/dbraw/zinc/06/42/06/970064206.db2.gz IBHNUJWNKMELQB-UHFFFAOYSA-N 1 2 236.225 2.268 20 0 BEADLO [NH2+]=CNc1ccc2c(Cl)ccnc2n1 ZINC001157077450 970073911 /nfs/dbraw/zinc/07/39/11/970073911.db2.gz DDOTUFOLZKMKIA-UHFFFAOYSA-N 1 2 206.636 2.302 20 0 BEADLO CSc1nc2c(c(NC=[NH2+])n1)CCCC2 ZINC001157079384 970078458 /nfs/dbraw/zinc/07/84/58/970078458.db2.gz YWFUTJICUJCWSS-UHFFFAOYSA-N 1 2 222.317 2.096 20 0 BEADLO CCCC[C@@H](C)[NH2+]CC(=O)OCCC ZINC001255320906 970091807 /nfs/dbraw/zinc/09/18/07/970091807.db2.gz UYEKXAMRVYDEDK-SNVBAGLBSA-N 1 2 201.310 2.108 20 0 BEADLO CCCC[C@@H](C)[N@@H+]1CC[C@H](O)C(F)(F)C1 ZINC001255330633 970111117 /nfs/dbraw/zinc/11/11/17/970111117.db2.gz VNRASGOUIHTNNZ-ZJUUUORDSA-N 1 2 221.291 2.267 20 0 BEADLO CCCC[C@@H](C)[N@H+]1CC[C@H](O)C(F)(F)C1 ZINC001255330633 970111121 /nfs/dbraw/zinc/11/11/21/970111121.db2.gz VNRASGOUIHTNNZ-ZJUUUORDSA-N 1 2 221.291 2.267 20 0 BEADLO Cc1ccc(Nc2ccc(F)c(C(N)=O)c2)[nH+]c1 ZINC001211011807 970112914 /nfs/dbraw/zinc/11/29/14/970112914.db2.gz CFFGFBOMYGVRDI-UHFFFAOYSA-N 1 2 245.257 2.372 20 0 BEADLO Cc1ccc(Nc2cccc(CC(N)=O)c2)[nH+]c1 ZINC001211012125 970116044 /nfs/dbraw/zinc/11/60/44/970116044.db2.gz WIKHURBXTGMWDR-UHFFFAOYSA-N 1 2 241.294 2.161 20 0 BEADLO CCOC(=O)[C@@H]1CCC[C@@H]([N@H+](C)CC(F)F)C1 ZINC001255379938 970126176 /nfs/dbraw/zinc/12/61/76/970126176.db2.gz YQIPBHQZZNWDEA-NXEZZACHSA-N 1 2 249.301 2.305 20 0 BEADLO CCOC(=O)[C@@H]1CCC[C@@H]([N@@H+](C)CC(F)F)C1 ZINC001255379938 970126182 /nfs/dbraw/zinc/12/61/82/970126182.db2.gz YQIPBHQZZNWDEA-NXEZZACHSA-N 1 2 249.301 2.305 20 0 BEADLO COC(OC)c1ccc(-c2c[nH+]cn2C)cc1 ZINC001243070873 970270450 /nfs/dbraw/zinc/27/04/50/970270450.db2.gz ABHQAWCMLKADGX-UHFFFAOYSA-N 1 2 232.283 2.379 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2oc(=O)ccc2c1 ZINC001243069902 970273529 /nfs/dbraw/zinc/27/35/29/970273529.db2.gz ZZSMNJSVMBVFJE-UHFFFAOYSA-N 1 2 226.235 2.194 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2ccnnc2c1 ZINC001243071534 970274657 /nfs/dbraw/zinc/27/46/57/970274657.db2.gz VBCOISOGDPZHFV-UHFFFAOYSA-N 1 2 210.240 2.030 20 0 BEADLO Cc1[nH+]cc(C2CC2)cc1Nc1cnnn1C ZINC001213495138 970324286 /nfs/dbraw/zinc/32/42/86/970324286.db2.gz RTJWRSZPXNOWLV-UHFFFAOYSA-N 1 2 229.287 2.140 20 0 BEADLO C[N@H+](CC(F)F)[C@@H]1CCOC(C)(C)C1 ZINC001255552920 970329067 /nfs/dbraw/zinc/32/90/67/970329067.db2.gz GUPDXJNLPAXLGK-MRVPVSSYSA-N 1 2 207.264 2.141 20 0 BEADLO C[N@@H+](CC(F)F)[C@@H]1CCOC(C)(C)C1 ZINC001255552920 970329077 /nfs/dbraw/zinc/32/90/77/970329077.db2.gz GUPDXJNLPAXLGK-MRVPVSSYSA-N 1 2 207.264 2.141 20 0 BEADLO Cc1cc(C)c(-n2c(C)cc(=O)c(N)c2C)c[nH+]1 ZINC001213510414 970333973 /nfs/dbraw/zinc/33/39/73/970333973.db2.gz BMBTZHGSGPSZPZ-UHFFFAOYSA-N 1 2 243.310 2.048 20 0 BEADLO Cc1cc(C)c(Nc2c(N)ncnc2Cl)c[nH+]1 ZINC001213503538 970334650 /nfs/dbraw/zinc/33/46/50/970334650.db2.gz LJDZGMVKWBLOKZ-UHFFFAOYSA-N 1 2 249.705 2.468 20 0 BEADLO COCCn1cnc(Nc2c[nH+]c(C)cc2C)c1 ZINC001213510910 970340790 /nfs/dbraw/zinc/34/07/90/970340790.db2.gz MCAUARWBPUCSEV-UHFFFAOYSA-N 1 2 246.314 2.285 20 0 BEADLO COc1cc(Nc2c[nH+]c(C)cc2C)c(N)cn1 ZINC001213510909 970341255 /nfs/dbraw/zinc/34/12/55/970341255.db2.gz MAWXBJDKZWZIPY-UHFFFAOYSA-N 1 2 244.298 2.428 20 0 BEADLO Cc1c[nH+]cc(Nc2cccnc2CO)c1C ZINC001213527576 970346582 /nfs/dbraw/zinc/34/65/82/970346582.db2.gz UDJKQTPQHBVLDD-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO Cc1c[nH+]cc(Nc2cnc3cccnn32)c1C ZINC001213527688 970350997 /nfs/dbraw/zinc/35/09/97/970350997.db2.gz YOEVJQQTCQPDCD-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cc1c(Nc2c[nH+]cc(C)c2C)ncn1C ZINC001213527703 970354962 /nfs/dbraw/zinc/35/49/62/970354962.db2.gz ZEPDXNWYUFEWPD-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO COC[C@@H](C)[N@@H+]1CCc2ncc(Cl)cc2C1 ZINC001255583832 970387834 /nfs/dbraw/zinc/38/78/34/970387834.db2.gz RVVQRLHVDMCMOK-SECBINFHSA-N 1 2 240.734 2.128 20 0 BEADLO COC[C@@H](C)[N@H+]1CCc2ncc(Cl)cc2C1 ZINC001255583832 970387844 /nfs/dbraw/zinc/38/78/44/970387844.db2.gz RVVQRLHVDMCMOK-SECBINFHSA-N 1 2 240.734 2.128 20 0 BEADLO Cc1cc(N)ccc1N(C)c1[nH+]cccc1N ZINC001214105820 970435781 /nfs/dbraw/zinc/43/57/81/970435781.db2.gz NTMMRXZYFIRHIR-UHFFFAOYSA-N 1 2 228.299 2.322 20 0 BEADLO Nc1ccc(Nc2ccc3c(c2)COC3)c[nH+]1 ZINC000302436927 970437779 /nfs/dbraw/zinc/43/77/79/970437779.db2.gz TXQICSIFGQOADS-UHFFFAOYSA-N 1 2 227.267 2.438 20 0 BEADLO CC(C)OC1C[NH+]([C@H](C)CC(F)(F)F)C1 ZINC001255660960 970445830 /nfs/dbraw/zinc/44/58/30/970445830.db2.gz MEHYRUFMMBXTTL-MRVPVSSYSA-N 1 2 225.254 2.437 20 0 BEADLO C[C@@H](c1nnc(Cc2ccccc2F)o1)[NH+](C)C ZINC001255803909 970504671 /nfs/dbraw/zinc/50/46/71/970504671.db2.gz BORHYHZHZXVGRK-VIFPVBQESA-N 1 2 249.289 2.422 20 0 BEADLO O=C1CC[N@@H+](Cc2ccsc2)CC[C@@H]1F ZINC001204034823 970523653 /nfs/dbraw/zinc/52/36/53/970523653.db2.gz PSBJLFMVGJESFK-JTQLQIEISA-N 1 2 227.304 2.251 20 0 BEADLO O=C1CC[N@H+](Cc2ccsc2)CC[C@@H]1F ZINC001204034823 970523666 /nfs/dbraw/zinc/52/36/66/970523666.db2.gz PSBJLFMVGJESFK-JTQLQIEISA-N 1 2 227.304 2.251 20 0 BEADLO CCCCCc1nnc(Cc2c[nH]c[nH+]2)o1 ZINC001256085239 970653070 /nfs/dbraw/zinc/65/30/70/970653070.db2.gz HXEZPJMWYGYQGG-UHFFFAOYSA-N 1 2 220.276 2.116 20 0 BEADLO CCCCCc1nnc(CCc2c[nH]c[nH+]2)o1 ZINC001256084819 970654280 /nfs/dbraw/zinc/65/42/80/970654280.db2.gz DAMYQDAEMTVMIU-UHFFFAOYSA-N 1 2 234.303 2.311 20 0 BEADLO CCCCCCc1nnc(Cn2cc[nH+]c2)o1 ZINC001256317326 970733291 /nfs/dbraw/zinc/73/32/91/970733291.db2.gz AKUJTMYYNVYKBW-UHFFFAOYSA-N 1 2 234.303 2.437 20 0 BEADLO C/C(=C\c1ccco1)c1nnc(C[NH+](C)C)o1 ZINC001327354529 972555796 /nfs/dbraw/zinc/55/57/96/972555796.db2.gz PKAVRRXNDMMIIV-VQHVLOKHSA-N 1 2 233.271 2.285 20 0 BEADLO Cn1c[nH+]cc1CO[C@@H]1CCCc2cccnc21 ZINC001222594576 972592675 /nfs/dbraw/zinc/59/26/75/972592675.db2.gz GXJAGVUVYZIKLY-CYBMUJFWSA-N 1 2 243.310 2.409 20 0 BEADLO Cn1c[nH+]cc1CO[C@@H]1CCOc2ccccc21 ZINC001222595257 972594375 /nfs/dbraw/zinc/59/43/75/972594375.db2.gz VCFLVMCFZFEIFB-CQSZACIVSA-N 1 2 244.294 2.461 20 0 BEADLO Cn1c[nH+]cc1CO[C@H]1CCc2cccnc21 ZINC001222595362 972598142 /nfs/dbraw/zinc/59/81/42/972598142.db2.gz XWJOXGOGXOUZFA-LBPRGKRZSA-N 1 2 229.283 2.019 20 0 BEADLO C[C@H](C1CCCCC1)[N@H+](C)Cc1nnc[nH]1 ZINC001327526146 972615008 /nfs/dbraw/zinc/61/50/08/972615008.db2.gz SPQDEZPORSKUKD-SNVBAGLBSA-N 1 2 222.336 2.205 20 0 BEADLO C[C@H](C1CCCCC1)[N@@H+](C)Cc1nnc[nH]1 ZINC001327526146 972615012 /nfs/dbraw/zinc/61/50/12/972615012.db2.gz SPQDEZPORSKUKD-SNVBAGLBSA-N 1 2 222.336 2.205 20 0 BEADLO CCC[C@H](C)[C@H]1CCC[N@@H+]1Cc1nc[nH]n1 ZINC001327545937 972621945 /nfs/dbraw/zinc/62/19/45/972621945.db2.gz HONXKUUCNNOUSH-WDEREUQCSA-N 1 2 222.336 2.205 20 0 BEADLO CCC[C@H](C)[C@H]1CCC[N@H+]1Cc1nc[nH]n1 ZINC001327545937 972621952 /nfs/dbraw/zinc/62/19/52/972621952.db2.gz HONXKUUCNNOUSH-WDEREUQCSA-N 1 2 222.336 2.205 20 0 BEADLO CCC[C@@H](C)[C@H]1CCC[N@@H+]1Cc1nc[nH]n1 ZINC001327545932 972625435 /nfs/dbraw/zinc/62/54/35/972625435.db2.gz HONXKUUCNNOUSH-GHMZBOCLSA-N 1 2 222.336 2.205 20 0 BEADLO CCC[C@@H](C)[C@H]1CCC[N@H+]1Cc1nc[nH]n1 ZINC001327545932 972625445 /nfs/dbraw/zinc/62/54/45/972625445.db2.gz HONXKUUCNNOUSH-GHMZBOCLSA-N 1 2 222.336 2.205 20 0 BEADLO CC[C@](C)([NH2+]Cc1nnc[nH]1)c1ccccc1 ZINC001327555047 972636267 /nfs/dbraw/zinc/63/62/67/972636267.db2.gz QJKFVLPUQQQKKA-ZDUSSCGKSA-N 1 2 230.315 2.220 20 0 BEADLO C[C@H]([NH2+]Cc1ncn[nH]1)[C@@H](C)c1ccccc1 ZINC001327553911 972636344 /nfs/dbraw/zinc/63/63/44/972636344.db2.gz KABKLHZAZXTLRS-MNOVXSKESA-N 1 2 230.315 2.087 20 0 BEADLO Oc1ccc(C[N@@H+]2CCc3sccc3C2)nc1 ZINC001144255639 972701663 /nfs/dbraw/zinc/70/16/63/972701663.db2.gz JPRMRDIIXPOLNG-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO Oc1ccc(C[N@H+]2CCc3sccc3C2)nc1 ZINC001144255639 972701674 /nfs/dbraw/zinc/70/16/74/972701674.db2.gz JPRMRDIIXPOLNG-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO CO[C@@H](C)C[N@H+](C)Cc1ncoc1C(C)C ZINC001327891008 972792255 /nfs/dbraw/zinc/79/22/55/972792255.db2.gz OBLXVFOJUAQAIW-JTQLQIEISA-N 1 2 226.320 2.265 20 0 BEADLO CO[C@@H](C)C[N@@H+](C)Cc1ncoc1C(C)C ZINC001327891008 972792264 /nfs/dbraw/zinc/79/22/64/972792264.db2.gz OBLXVFOJUAQAIW-JTQLQIEISA-N 1 2 226.320 2.265 20 0 BEADLO COc1c(F)ccc(F)c1C[NH+](C)C ZINC001144744812 972983199 /nfs/dbraw/zinc/98/31/99/972983199.db2.gz GCVBKKGCFKAHRK-UHFFFAOYSA-N 1 2 201.216 2.035 20 0 BEADLO CC(C)([NH2+]Cc1cnon1)c1cccs1 ZINC001328393681 973014949 /nfs/dbraw/zinc/01/49/49/973014949.db2.gz HRRFVJBEQVJMLR-UHFFFAOYSA-N 1 2 223.301 2.156 20 0 BEADLO Cc1cc(COC[C@H]2CCO2)cc(C)[nH+]1 ZINC001223420620 973056139 /nfs/dbraw/zinc/05/61/39/973056139.db2.gz LEDDCAIVZWJAIN-GFCCVEGCSA-N 1 2 207.273 2.004 20 0 BEADLO CCOC(=O)[C@H](C)OCc1cc(C)[nH+]c(C)c1 ZINC001223420737 973057625 /nfs/dbraw/zinc/05/76/25/973057625.db2.gz NIGHPMAQAQZFPR-NSHDSACASA-N 1 2 237.299 2.167 20 0 BEADLO C[C@@H]1CC[C@H](Cc2nnc(C[NH+](C)C)o2)C1 ZINC001328433443 973059681 /nfs/dbraw/zinc/05/96/81/973059681.db2.gz MNXDNSICQWMKDJ-ZJUUUORDSA-N 1 2 223.320 2.110 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N(C(=O)[C@@H](C)n2cc[nH+]c2)C1 ZINC001328827672 973361694 /nfs/dbraw/zinc/36/16/94/973361694.db2.gz LZHPDEYDDADXMJ-JHJVBQTASA-N 1 2 249.358 2.481 20 0 BEADLO C[C@H](C(=O)NC(C)(C1CC1)C1CC1)n1cc[nH+]c1 ZINC001328826548 973363633 /nfs/dbraw/zinc/36/36/33/973363633.db2.gz HAEOFSZVXFJOIJ-SNVBAGLBSA-N 1 2 247.342 2.139 20 0 BEADLO C[C@@H](OC1C[NH+](C)C1)c1ccc(F)cc1 ZINC001224007156 973399999 /nfs/dbraw/zinc/39/99/99/973399999.db2.gz QZRSGWTVTSZOGJ-SECBINFHSA-N 1 2 209.264 2.217 20 0 BEADLO CON(C(=O)c1ccn2c(C)c[nH+]c2c1)C(C)C ZINC001329169633 973537552 /nfs/dbraw/zinc/53/75/52/973537552.db2.gz YUFBFEXTBASKSW-UHFFFAOYSA-N 1 2 247.298 2.055 20 0 BEADLO O[C@H]1CN(c2[nH+]ccc3ccccc32)CC12CC2 ZINC001329174533 973545640 /nfs/dbraw/zinc/54/56/40/973545640.db2.gz GBPHJCBWZUOPIL-ZDUSSCGKSA-N 1 2 240.306 2.196 20 0 BEADLO C[C@H](C(=O)NCC[C@H]1CC=CCC1)n1cc[nH+]c1 ZINC001329182991 973550618 /nfs/dbraw/zinc/55/06/18/973550618.db2.gz FUROLROQQUXEKA-OLZOCXBDSA-N 1 2 247.342 2.307 20 0 BEADLO C[C@H](CC1CCC1)NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001332201310 1169967186 /nfs/dbraw/zinc/96/71/86/1169967186.db2.gz JNMLPWGQFPNPRX-MNOVXSKESA-N 1 2 235.331 2.139 20 0 BEADLO CC(C)([NH2+]Cc1ncn[nH]1)C1CCCCC1 ZINC001329896497 974009694 /nfs/dbraw/zinc/00/96/94/974009694.db2.gz XZHGHZBGKOHKFJ-UHFFFAOYSA-N 1 2 222.336 2.253 20 0 BEADLO CC1(NC(=O)Nc2ccn3cc[nH+]c3c2)CC1 ZINC001329955233 974048856 /nfs/dbraw/zinc/04/88/56/974048856.db2.gz FNVNFXLNYJNXSI-UHFFFAOYSA-N 1 2 230.271 2.008 20 0 BEADLO Cc1ccc(O)cc1NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001171477740 974084420 /nfs/dbraw/zinc/08/44/20/974084420.db2.gz ABTYOJSTVWDWJY-JTQLQIEISA-N 1 2 245.282 2.097 20 0 BEADLO CCOC(=[NH2+])CCCCO[C@@H](C)C(=O)OCC ZINC001224963016 974104273 /nfs/dbraw/zinc/10/42/73/974104273.db2.gz FIQWEMIERBEOOY-JTQLQIEISA-N 1 2 245.319 2.139 20 0 BEADLO COC(=O)C[NH2+][C@@H](C)CCc1ccc(C)cc1 ZINC001171658576 974125163 /nfs/dbraw/zinc/12/51/63/974125163.db2.gz SMVCXXPACFFRDR-LBPRGKRZSA-N 1 2 235.327 2.079 20 0 BEADLO CCCC[C@@H](C)N(C)C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001330192873 974132316 /nfs/dbraw/zinc/13/23/16/974132316.db2.gz RTHSCCMBCHSSTL-VXGBXAGGSA-N 1 2 237.347 2.481 20 0 BEADLO C[C@@H](Cc1ccco1)c1nnc(C[NH+](C)C)o1 ZINC001330181167 974140146 /nfs/dbraw/zinc/14/01/46/974140146.db2.gz ZBFASSUDIROVTK-VIFPVBQESA-N 1 2 235.287 2.070 20 0 BEADLO C[C@H](Cc1ccco1)c1nnc(C[NH+](C)C)o1 ZINC001330181166 974142590 /nfs/dbraw/zinc/14/25/90/974142590.db2.gz ZBFASSUDIROVTK-SECBINFHSA-N 1 2 235.287 2.070 20 0 BEADLO CCCOC1C[NH+]([C@H]2Cc3cccc(F)c3C2)C1 ZINC001171804273 974193365 /nfs/dbraw/zinc/19/33/65/974193365.db2.gz BTHGQICCIIAUJL-LBPRGKRZSA-N 1 2 249.329 2.404 20 0 BEADLO CCC[C@H](Oc1cc[nH+]cc1)C(=O)OCC ZINC001225290574 974361703 /nfs/dbraw/zinc/36/17/03/974361703.db2.gz BEGGRSRPANEHQQ-NSHDSACASA-N 1 2 223.272 2.192 20 0 BEADLO Cc1c([C@H](C)Oc2cc[nH+]cc2)cnn1C ZINC001225289737 974362575 /nfs/dbraw/zinc/36/25/75/974362575.db2.gz OLGYKUOAJMIDCU-JTQLQIEISA-N 1 2 217.272 2.264 20 0 BEADLO c1cc(OCCOC2CCCC2)cc[nH+]1 ZINC001225296386 974375223 /nfs/dbraw/zinc/37/52/23/974375223.db2.gz UMRSGMFDKRZKOT-UHFFFAOYSA-N 1 2 207.273 2.420 20 0 BEADLO COc1cc(F)ccc1OC1C[NH+](C(C)C)C1 ZINC001225343841 974420964 /nfs/dbraw/zinc/42/09/64/974420964.db2.gz DQCPJKKAKDFOLN-UHFFFAOYSA-N 1 2 239.290 2.306 20 0 BEADLO c1ccc2c(c1)C[C@H]([N@@H+]1CCO[C@@H]3C[C@@H]31)CS2 ZINC001172208881 974439290 /nfs/dbraw/zinc/43/92/90/974439290.db2.gz LXBYTICJFVZUSM-RWMBFGLXSA-N 1 2 247.363 2.177 20 0 BEADLO c1ccc2c(c1)C[C@H]([N@H+]1CCO[C@@H]3C[C@@H]31)CS2 ZINC001172208881 974439295 /nfs/dbraw/zinc/43/92/95/974439295.db2.gz LXBYTICJFVZUSM-RWMBFGLXSA-N 1 2 247.363 2.177 20 0 BEADLO Cc1ccnc2c(OC3C[NH+](C)C3)cccc12 ZINC001225494052 974531257 /nfs/dbraw/zinc/53/12/57/974531257.db2.gz KPLOIDUCUBJQSV-UHFFFAOYSA-N 1 2 228.295 2.236 20 0 BEADLO CCCn1cc(C[N@@H+]2CC(C)(C)C2(C)C)nn1 ZINC001331042263 974574902 /nfs/dbraw/zinc/57/49/02/974574902.db2.gz NSKAIUFNPDWDCL-UHFFFAOYSA-N 1 2 236.363 2.309 20 0 BEADLO CCCn1cc(C[N@H+]2CC(C)(C)C2(C)C)nn1 ZINC001331042263 974574908 /nfs/dbraw/zinc/57/49/08/974574908.db2.gz NSKAIUFNPDWDCL-UHFFFAOYSA-N 1 2 236.363 2.309 20 0 BEADLO CC[C@H](C)OCC[C@@H](C)[N@@H+]1Cc2cncnc2C1 ZINC001172341596 974607515 /nfs/dbraw/zinc/60/75/15/974607515.db2.gz VATXHVJGZSJAID-NEPJUHHUSA-N 1 2 249.358 2.386 20 0 BEADLO CC[C@H](C)OCC[C@@H](C)[N@H+]1Cc2cncnc2C1 ZINC001172341596 974607518 /nfs/dbraw/zinc/60/75/18/974607518.db2.gz VATXHVJGZSJAID-NEPJUHHUSA-N 1 2 249.358 2.386 20 0 BEADLO C[NH+]1CC(Oc2cc3ccccc3cc2O)C1 ZINC001225738086 974664675 /nfs/dbraw/zinc/66/46/75/974664675.db2.gz VMGGHHZEEKQGSL-UHFFFAOYSA-N 1 2 229.279 2.238 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@@H]2OCCC[C@H]2C1 ZINC001331272425 974667666 /nfs/dbraw/zinc/66/76/66/974667666.db2.gz UZBFYIBYAXQXDG-GWCFXTLKSA-N 1 2 236.290 2.226 20 0 BEADLO CCOCC[C@@H](C)[NH+]1CC(F)(C2CC2)C1 ZINC001172418292 974691231 /nfs/dbraw/zinc/69/12/31/974691231.db2.gz WZRYSLBTSJZPKA-SNVBAGLBSA-N 1 2 215.312 2.235 20 0 BEADLO CC[NH+]1CC(Oc2ncccc2C(F)(F)F)C1 ZINC001225833684 974699978 /nfs/dbraw/zinc/69/99/78/974699978.db2.gz IRQDGMRHURGCED-UHFFFAOYSA-N 1 2 246.232 2.183 20 0 BEADLO CC(C)OCC[C@@H](C)[NH2+][C@@H](C)C(=O)OC(C)C ZINC001172434346 974721968 /nfs/dbraw/zinc/72/19/68/974721968.db2.gz OKYOCOXAQQAEKX-NEPJUHHUSA-N 1 2 245.363 2.120 20 0 BEADLO CC(C)[NH+]1CC(Oc2cccc(F)c2F)C1 ZINC001225923491 974730449 /nfs/dbraw/zinc/73/04/49/974730449.db2.gz YKQJYGPERUXOFG-UHFFFAOYSA-N 1 2 227.254 2.436 20 0 BEADLO CC(C)OCC[C@H](C)[NH+]1C[C@@H](F)[C@H](F)C1 ZINC001172441606 974799942 /nfs/dbraw/zinc/79/99/42/974799942.db2.gz BLBUAUNVHWNEAM-HBNTYKKESA-N 1 2 221.291 2.182 20 0 BEADLO CC(C)OCC[C@@H](C)[NH+]1C[C@@H](F)[C@H](F)C1 ZINC001172441605 974800309 /nfs/dbraw/zinc/80/03/09/974800309.db2.gz BLBUAUNVHWNEAM-GMTAPVOTSA-N 1 2 221.291 2.182 20 0 BEADLO CC(C)[NH+]1CC(Oc2cc(O)ccc2F)C1 ZINC001226122215 974801019 /nfs/dbraw/zinc/80/10/19/974801019.db2.gz JCLKBURYHYPSDZ-UHFFFAOYSA-N 1 2 225.263 2.003 20 0 BEADLO CC(C)(C)[NH+]1CC(Oc2cccnc2F)C1 ZINC001226184666 974820086 /nfs/dbraw/zinc/82/00/86/974820086.db2.gz IYLKAYJTDUBIEE-UHFFFAOYSA-N 1 2 224.279 2.082 20 0 BEADLO OC1C[NH+](Cc2ccc(Nc3ccoc3)cc2)C1 ZINC001212667436 974830291 /nfs/dbraw/zinc/83/02/91/974830291.db2.gz SCEXIZJDJCKZPK-UHFFFAOYSA-N 1 2 244.294 2.200 20 0 BEADLO O=C1O[C@H]2C[C@@H]1[N@@H+](C1CCC3(CCCC3)CC1)C2 ZINC001172730571 974912906 /nfs/dbraw/zinc/91/29/06/974912906.db2.gz JRBTWSIEGOMWSS-STQMWFEESA-N 1 2 249.354 2.489 20 0 BEADLO O=C1O[C@H]2C[C@@H]1[N@H+](C1CCC3(CCCC3)CC1)C2 ZINC001172730571 974912913 /nfs/dbraw/zinc/91/29/13/974912913.db2.gz JRBTWSIEGOMWSS-STQMWFEESA-N 1 2 249.354 2.489 20 0 BEADLO CC[NH+]1CC(Oc2cncc(C(F)(F)F)c2)C1 ZINC001226473582 974920116 /nfs/dbraw/zinc/92/01/16/974920116.db2.gz ADOOZYNUBWMISK-UHFFFAOYSA-N 1 2 246.232 2.183 20 0 BEADLO CC[NH+]1CC(Oc2ccc3c(C)noc3c2)C1 ZINC001226537102 974948117 /nfs/dbraw/zinc/94/81/17/974948117.db2.gz FDWLHBWDNNKBHB-UHFFFAOYSA-N 1 2 232.283 2.219 20 0 BEADLO CC[C@H]1CC[C@H](N2CC[NH2+]CC(F)(F)C2)C1 ZINC001173272933 975150195 /nfs/dbraw/zinc/15/01/95/975150195.db2.gz LKLFJBICKDGKDV-QWRGUYRKSA-N 1 2 232.318 2.106 20 0 BEADLO CC[NH+]1CC(Oc2cccc3c2OC(C)(C)C3)C1 ZINC001227252366 975331008 /nfs/dbraw/zinc/33/10/08/975331008.db2.gz HOWFUDCGAUTANA-UHFFFAOYSA-N 1 2 247.338 2.483 20 0 BEADLO Cc1cc[nH+]c(C)c1O[C@@H]1CCn2ccnc21 ZINC001227258906 975334712 /nfs/dbraw/zinc/33/47/12/975334712.db2.gz BQWBGONMXQFSPF-LLVKDONJSA-N 1 2 229.283 2.419 20 0 BEADLO Cc1cc[nH+]c(C)c1O[C@H]1CCOC[C@H]1F ZINC001227262676 975337393 /nfs/dbraw/zinc/33/73/93/975337393.db2.gz UVMSPBHYHWWNOZ-MNOVXSKESA-N 1 2 225.263 2.204 20 0 BEADLO Cc1cc[nH+]c(C)c1O[C@H]1CCOC[C@@H]1F ZINC001227262678 975338693 /nfs/dbraw/zinc/33/86/93/975338693.db2.gz UVMSPBHYHWWNOZ-QWRGUYRKSA-N 1 2 225.263 2.204 20 0 BEADLO CC(=O)N1CCC[C@@H](Oc2c(C)cc[nH+]c2C)C1 ZINC001227264494 975339800 /nfs/dbraw/zinc/33/98/00/975339800.db2.gz MWFDUWZTZZBQMY-CYBMUJFWSA-N 1 2 248.326 2.088 20 0 BEADLO COC(=O)C1(C)CC(Oc2c(C)cc[nH+]c2C)C1 ZINC001227265664 975344855 /nfs/dbraw/zinc/34/48/55/975344855.db2.gz VNWDJIWQPRNKGV-UHFFFAOYSA-N 1 2 249.310 2.419 20 0 BEADLO CC[C@H](C)[C@@H](C[NH2+][C@@H](C)c1noc(C)n1)OC ZINC001332998470 975363886 /nfs/dbraw/zinc/36/38/86/975363886.db2.gz FVAPXRISYBPNIN-ATZCPNFKSA-N 1 2 241.335 2.090 20 0 BEADLO COc1nnc(C[N@@H+]2CCCC23CCC3)s1 ZINC001333001949 975367081 /nfs/dbraw/zinc/36/70/81/975367081.db2.gz RHPMMTOEBSUMAS-UHFFFAOYSA-N 1 2 239.344 2.065 20 0 BEADLO COc1nnc(C[N@H+]2CCCC23CCC3)s1 ZINC001333001949 975367087 /nfs/dbraw/zinc/36/70/87/975367087.db2.gz RHPMMTOEBSUMAS-UHFFFAOYSA-N 1 2 239.344 2.065 20 0 BEADLO C[C@@H]1CC=C(c2nnc(C[NH+](C)C)o2)CC1 ZINC001333120288 975447809 /nfs/dbraw/zinc/44/78/09/975447809.db2.gz BWBBAZRAMWQTEH-SECBINFHSA-N 1 2 221.304 2.335 20 0 BEADLO C[NH+]1CC(Oc2cccc3c2CCCC3)C1 ZINC001227685066 975611201 /nfs/dbraw/zinc/61/12/01/975611201.db2.gz NOEONQKRAAJFEL-UHFFFAOYSA-N 1 2 217.312 2.258 20 0 BEADLO CC[NH+]1CC(Oc2cc(F)cc3cccnc32)C1 ZINC001227977073 975820993 /nfs/dbraw/zinc/82/09/93/975820993.db2.gz SWUVCHRCXVIEGH-UHFFFAOYSA-N 1 2 246.285 2.457 20 0 BEADLO Cc1cccc(C)c1[N@@H+]1C=C(N)C(C)=CC1=N ZINC001173873818 975833456 /nfs/dbraw/zinc/83/34/56/975833456.db2.gz HQXIDJISCNGBLM-UHFFFAOYSA-N 1 2 227.311 2.464 20 0 BEADLO Cc1cccc(C)c1[N@H+]1C=C(N)C(C)=CC1=N ZINC001173873818 975833461 /nfs/dbraw/zinc/83/34/61/975833461.db2.gz HQXIDJISCNGBLM-UHFFFAOYSA-N 1 2 227.311 2.464 20 0 BEADLO CCCCC[C@@H]1CCC[N@@H+]1Cc1nnc[nH]1 ZINC001333586482 975872173 /nfs/dbraw/zinc/87/21/73/975872173.db2.gz JOJZPVWPFJGPSS-LLVKDONJSA-N 1 2 222.336 2.349 20 0 BEADLO CCCCC[C@@H]1CCC[N@H+]1Cc1nnc[nH]1 ZINC001333586482 975872175 /nfs/dbraw/zinc/87/21/75/975872175.db2.gz JOJZPVWPFJGPSS-LLVKDONJSA-N 1 2 222.336 2.349 20 0 BEADLO Cc1nnc(Nc2ccccc2C[NH+](C)C)o1 ZINC001173927863 976038628 /nfs/dbraw/zinc/03/86/28/976038628.db2.gz QSQDWADLWZIDBG-UHFFFAOYSA-N 1 2 232.287 2.183 20 0 BEADLO c1cc(Nc2ccc[nH+]c2N2CCOCC2)co1 ZINC001173932464 976043558 /nfs/dbraw/zinc/04/35/58/976043558.db2.gz OEEKPHLLASRJQL-UHFFFAOYSA-N 1 2 245.282 2.255 20 0 BEADLO c1cc(Nc2ccc(N3CCOCC3)[nH+]c2)co1 ZINC001173931879 976045287 /nfs/dbraw/zinc/04/52/87/976045287.db2.gz FTSKEHCKQJHVIT-UHFFFAOYSA-N 1 2 245.282 2.255 20 0 BEADLO COC(=O)C[C@@H](C)Oc1ccc2[nH]c(C)[nH+]c2c1 ZINC001228326110 976118655 /nfs/dbraw/zinc/11/86/55/976118655.db2.gz FNAAMKHHINNHEU-MRVPVSSYSA-N 1 2 248.282 2.202 20 0 BEADLO Cc1[nH]c2ccc(OCC(=O)OC(C)C)cc2[nH+]1 ZINC001228327814 976119109 /nfs/dbraw/zinc/11/91/09/976119109.db2.gz VXEKMBFTMMQQID-UHFFFAOYSA-N 1 2 248.282 2.202 20 0 BEADLO CC(=O)[C@H](C)Oc1ccc2[nH]c(C)[nH+]c2c1 ZINC001228326105 976121355 /nfs/dbraw/zinc/12/13/55/976121355.db2.gz FLGYFFBBVMGBFD-QMMMGPOBSA-N 1 2 218.256 2.228 20 0 BEADLO C1=C(Nc2ccc(N3CCOCC3)[nH+]c2)CCC1 ZINC001173996642 976131511 /nfs/dbraw/zinc/13/15/11/976131511.db2.gz JVEVARBNNBOAKK-UHFFFAOYSA-N 1 2 245.326 2.398 20 0 BEADLO COc1ncccc1Nc1cccc2[nH+]ccn21 ZINC001174040639 976245126 /nfs/dbraw/zinc/24/51/26/976245126.db2.gz SXRSYWWRCIDAFS-UHFFFAOYSA-N 1 2 240.266 2.482 20 0 BEADLO CC(C)(C)[NH+]1CC(Oc2ccc(F)nc2F)C1 ZINC001228537118 976307421 /nfs/dbraw/zinc/30/74/21/976307421.db2.gz TXUARELGLIWLCH-UHFFFAOYSA-N 1 2 242.269 2.221 20 0 BEADLO COc1cncc(Nc2cccn3cc[nH+]c23)c1 ZINC001174088005 976354628 /nfs/dbraw/zinc/35/46/28/976354628.db2.gz KVSNFKVMVXHPQR-UHFFFAOYSA-N 1 2 240.266 2.482 20 0 BEADLO COc1cncc(Nc2c[nH+]ccc2OC)c1 ZINC001174088205 976355794 /nfs/dbraw/zinc/35/57/94/976355794.db2.gz PQGAEGLBNSTYRS-UHFFFAOYSA-N 1 2 231.255 2.237 20 0 BEADLO CNC(=O)c1cccc(Nc2cccc(C)[nH+]2)c1 ZINC001174137337 976374485 /nfs/dbraw/zinc/37/44/85/976374485.db2.gz BESQRCOLGXUJTB-UHFFFAOYSA-N 1 2 241.294 2.493 20 0 BEADLO CC[C@H](C[NH2+]Cc1ncn[nH]1)c1ccccc1 ZINC001204137641 976378882 /nfs/dbraw/zinc/37/88/82/976378882.db2.gz ZGPFWZRVPSRUDY-LLVKDONJSA-N 1 2 230.315 2.088 20 0 BEADLO CCCn1cc(Nc2c[nH+]ccc2OC)cn1 ZINC001174218277 976406837 /nfs/dbraw/zinc/40/68/37/976406837.db2.gz PVFTTWHWGKCJDQ-UHFFFAOYSA-N 1 2 232.287 2.440 20 0 BEADLO CCc1cc(N[C@H](CC)[C@H](C)O)nc(CC)[nH+]1 ZINC001334265151 976415007 /nfs/dbraw/zinc/41/50/07/976415007.db2.gz QFEJPBWOIMYQPW-GXSJLCMTSA-N 1 2 237.347 2.173 20 0 BEADLO C[NH+]1CC(Oc2nccc3cccc(F)c32)C1 ZINC001228733249 976465325 /nfs/dbraw/zinc/46/53/25/976465325.db2.gz LCZPDPMQUGQUNX-UHFFFAOYSA-N 1 2 232.258 2.067 20 0 BEADLO c1cn(-c2ccccc2Nc2cn[nH]c2)c[nH+]1 ZINC001174293658 976467208 /nfs/dbraw/zinc/46/72/08/976467208.db2.gz QXTSVQQMGYYKAK-UHFFFAOYSA-N 1 2 225.255 2.339 20 0 BEADLO Cn1cc(Nc2cc(Cl)c3[nH+]ccn3c2)cn1 ZINC001174329424 976529334 /nfs/dbraw/zinc/52/93/34/976529334.db2.gz UCRCXPGZBZLWBA-UHFFFAOYSA-N 1 2 247.689 2.465 20 0 BEADLO CCOc1cc(Nc2cnn(C)c2)cc(C)[nH+]1 ZINC001174329418 976529506 /nfs/dbraw/zinc/52/95/06/976529506.db2.gz TVTAUZXEQYFXQE-UHFFFAOYSA-N 1 2 232.287 2.266 20 0 BEADLO Cn1cc(Nc2ccc(N3CCCC3)[nH+]c2)cn1 ZINC001174331427 976540819 /nfs/dbraw/zinc/54/08/19/976540819.db2.gz ROWYFBOILHZKGS-UHFFFAOYSA-N 1 2 243.314 2.159 20 0 BEADLO Cc1cn(C(C)(C)C(=O)NC/C=C/C2CC2)c[nH+]1 ZINC001334514645 976548035 /nfs/dbraw/zinc/54/80/35/976548035.db2.gz MPZVDEUSYSYPLY-SNAWJCMRSA-N 1 2 247.342 2.009 20 0 BEADLO C[C@@H](C(=O)N(CC1CC1)CC1CC1)n1cc[nH+]c1 ZINC001334557932 976555212 /nfs/dbraw/zinc/55/52/12/976555212.db2.gz MWHJJNFEKZMYGB-NSHDSACASA-N 1 2 247.342 2.093 20 0 BEADLO CS[C@H]1CC[C@H]([N@H+](C)Cc2nncs2)C1 ZINC001334603001 976564274 /nfs/dbraw/zinc/56/42/74/976564274.db2.gz JYNBQXOYEZXATO-IUCAKERBSA-N 1 2 243.401 2.254 20 0 BEADLO CS[C@H]1CC[C@H]([N@@H+](C)Cc2nncs2)C1 ZINC001334603001 976564291 /nfs/dbraw/zinc/56/42/91/976564291.db2.gz JYNBQXOYEZXATO-IUCAKERBSA-N 1 2 243.401 2.254 20 0 BEADLO Cc1c(Nc2ccn3cc[nH+]c3c2)cnn1C ZINC001174391563 976581841 /nfs/dbraw/zinc/58/18/41/976581841.db2.gz LOBGKMNSXUKDSD-UHFFFAOYSA-N 1 2 227.271 2.120 20 0 BEADLO CSc1cc(Nc2ccc(=O)n(C)c2)cc[nH+]1 ZINC001174356443 976597924 /nfs/dbraw/zinc/59/79/24/976597924.db2.gz OGKBSWDAJVVORH-UHFFFAOYSA-N 1 2 247.323 2.246 20 0 BEADLO CCOc1cc[nH+]cc1Nc1cncnc1 ZINC001174382783 976614043 /nfs/dbraw/zinc/61/40/43/976614043.db2.gz CHEGBDDURWPVNC-UHFFFAOYSA-N 1 2 216.244 2.014 20 0 BEADLO CC(C)(NC(=O)Cc1c[nH]c[nH+]1)C1CCCCC1 ZINC001334744458 976615753 /nfs/dbraw/zinc/61/57/53/976615753.db2.gz GAWZNXQHMNEFMZ-UHFFFAOYSA-N 1 2 249.358 2.427 20 0 BEADLO CC[NH+]1CC(Oc2ccc(C3CC3)cn2)C1 ZINC001229002571 976638156 /nfs/dbraw/zinc/63/81/56/976638156.db2.gz DOJFDNRAHQYALP-UHFFFAOYSA-N 1 2 218.300 2.042 20 0 BEADLO Nc1cn(-c2cc[nH+]c3[nH]ccc32)c2ncccc12 ZINC001174408811 976695614 /nfs/dbraw/zinc/69/56/14/976695614.db2.gz QLFDYEORNGBFEC-UHFFFAOYSA-N 1 2 249.277 2.436 20 0 BEADLO Cc1cn2cccc(Nc3c[nH]nc3C)c2[nH+]1 ZINC001174470912 976777788 /nfs/dbraw/zinc/77/77/88/976777788.db2.gz YBYYFKYDKFYHJK-UHFFFAOYSA-N 1 2 227.271 2.418 20 0 BEADLO Cc1c[nH+]ccc1NC(=S)c1ccccc1N ZINC001174540229 976833288 /nfs/dbraw/zinc/83/32/88/976833288.db2.gz ZDTVNFSBXUIPKY-UHFFFAOYSA-N 1 2 243.335 2.182 20 0 BEADLO CCn1cc(Nc2ccc(N(C)C)[nH+]c2)cn1 ZINC001174566667 976881791 /nfs/dbraw/zinc/88/17/91/976881791.db2.gz VKTDSRFCPAYPST-UHFFFAOYSA-N 1 2 231.303 2.108 20 0 BEADLO CCOc1cc[nH+]cc1Nc1cnn(CC)c1 ZINC001174567646 976884626 /nfs/dbraw/zinc/88/46/26/976884626.db2.gz XSOQIZOLCSLIJF-UHFFFAOYSA-N 1 2 232.287 2.440 20 0 BEADLO CO[C@H]1CC[N@H+](Cc2nc(C(C)(C)C)co2)C1 ZINC001335419612 977040188 /nfs/dbraw/zinc/04/01/88/977040188.db2.gz DYFLTZYKZPEMRC-JTQLQIEISA-N 1 2 238.331 2.193 20 0 BEADLO CO[C@H]1CC[N@@H+](Cc2nc(C(C)(C)C)co2)C1 ZINC001335419612 977040200 /nfs/dbraw/zinc/04/02/00/977040200.db2.gz DYFLTZYKZPEMRC-JTQLQIEISA-N 1 2 238.331 2.193 20 0 BEADLO Cc1cc(Nc2ccc(C)[nH+]c2C)n(C)n1 ZINC001174820693 977075337 /nfs/dbraw/zinc/07/53/37/977075337.db2.gz AKQCRYHDAAFTCR-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO Cc1cc(Nc2cccc3[nH+]ccn32)n(C)n1 ZINC001174822725 977077620 /nfs/dbraw/zinc/07/76/20/977077620.db2.gz ZHYGPQIZSBCIQK-UHFFFAOYSA-N 1 2 227.271 2.120 20 0 BEADLO COc1cc(Nc2cc(C)nn2C)cc(C)[nH+]1 ZINC001174822380 977079728 /nfs/dbraw/zinc/07/97/28/977079728.db2.gz REWKHJWLNNWSPT-UHFFFAOYSA-N 1 2 232.287 2.184 20 0 BEADLO CC1(C)C[N@H+](CC2=NOCC2)[C@@H]1c1ccncc1 ZINC001174984046 977218753 /nfs/dbraw/zinc/21/87/53/977218753.db2.gz LUUQPYBZIBXKKD-CYBMUJFWSA-N 1 2 245.326 2.241 20 0 BEADLO CC1(C)C[N@@H+](CC2=NOCC2)[C@@H]1c1ccncc1 ZINC001174984046 977218764 /nfs/dbraw/zinc/21/87/64/977218764.db2.gz LUUQPYBZIBXKKD-CYBMUJFWSA-N 1 2 245.326 2.241 20 0 BEADLO CC(C)Oc1cc2c(cc1O)C=[NH+]CC2 ZINC001230913780 977381068 /nfs/dbraw/zinc/38/10/68/977381068.db2.gz BGOGQQLOAPIXDZ-UHFFFAOYSA-N 1 2 205.257 2.154 20 0 BEADLO CCOC[C@H](C)Oc1cc2c(cc1O)C=[NH+]CC2 ZINC001230920547 977383950 /nfs/dbraw/zinc/38/39/50/977383950.db2.gz PAQTUOWNVMPKFB-JTQLQIEISA-N 1 2 249.310 2.171 20 0 BEADLO CCc1nnc(Nc2ccc(N(C)C)[nH+]c2)s1 ZINC001175338420 977386413 /nfs/dbraw/zinc/38/64/13/977386413.db2.gz SIKZXNHQHVPUNH-UHFFFAOYSA-N 1 2 249.343 2.305 20 0 BEADLO COc1cc[nH+]cc1Nc1cnc2n[nH]cc2c1 ZINC001175402440 977414876 /nfs/dbraw/zinc/41/48/76/977414876.db2.gz WAYPVDOBIASBBZ-UHFFFAOYSA-N 1 2 241.254 2.105 20 0 BEADLO Cn1ncc2cc(Nc3[nH+]cccc3N)ccc21 ZINC001175417984 977422573 /nfs/dbraw/zinc/42/25/73/977422573.db2.gz UBKDYLUNJGGDSG-UHFFFAOYSA-N 1 2 239.282 2.294 20 0 BEADLO CC(=O)[C@@H](C)Oc1ccc(-c2c[nH+]cn2C)cc1 ZINC001231078854 977465162 /nfs/dbraw/zinc/46/51/62/977465162.db2.gz FSDRHGMRMHBDIK-LLVKDONJSA-N 1 2 244.294 2.443 20 0 BEADLO COC[C@H](C)Oc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001231080278 977473856 /nfs/dbraw/zinc/47/38/56/977473856.db2.gz BAVCICHJZCNSHV-JTQLQIEISA-N 1 2 232.283 2.490 20 0 BEADLO CC[NH+]1CC(Oc2nc3cccc(C)c3o2)C1 ZINC001231164583 977520643 /nfs/dbraw/zinc/52/06/43/977520643.db2.gz SDAIMQPVPONJIO-UHFFFAOYSA-N 1 2 232.283 2.219 20 0 BEADLO C[NH+]1CC(Oc2c(O)ccc3ccccc32)C1 ZINC001231226278 977541809 /nfs/dbraw/zinc/54/18/09/977541809.db2.gz BXTWJERITRRYGQ-UHFFFAOYSA-N 1 2 229.279 2.238 20 0 BEADLO CC(C)OC1C[NH+](Cc2c[nH]c3cccnc23)C1 ZINC001231491769 977614324 /nfs/dbraw/zinc/61/43/24/977614324.db2.gz DDSAIDSJVHVBBU-UHFFFAOYSA-N 1 2 245.326 2.172 20 0 BEADLO C1=CC[NH+](Cc2nc3c(s2)CCCC3)C1 ZINC001231579874 977634937 /nfs/dbraw/zinc/63/49/37/977634937.db2.gz FKQAFBTYAPYBLO-UHFFFAOYSA-N 1 2 220.341 2.394 20 0 BEADLO Cc1c[nH+]c(Nc2cnc(N)nc2C)c(C)c1 ZINC001175666890 977645730 /nfs/dbraw/zinc/64/57/30/977645730.db2.gz VFDFVLDLYAXYRR-UHFFFAOYSA-N 1 2 229.287 2.123 20 0 BEADLO CCc1ccc(C[N@@H+]2CCCCC23COC3)nc1 ZINC001231641433 977656389 /nfs/dbraw/zinc/65/63/89/977656389.db2.gz ZRUMNYDEIXDHCO-UHFFFAOYSA-N 1 2 246.354 2.399 20 0 BEADLO CCc1ccc(C[N@H+]2CCCCC23COC3)nc1 ZINC001231641433 977656395 /nfs/dbraw/zinc/65/63/95/977656395.db2.gz ZRUMNYDEIXDHCO-UHFFFAOYSA-N 1 2 246.354 2.399 20 0 BEADLO CCc1ccc(C[N@@H+]2CCCC(=O)[C@H](C)C2)nc1 ZINC001231637897 977656742 /nfs/dbraw/zinc/65/67/42/977656742.db2.gz QBJAJWVGAAANMA-GFCCVEGCSA-N 1 2 246.354 2.445 20 0 BEADLO CCc1ccc(C[N@H+]2CCCC(=O)[C@H](C)C2)nc1 ZINC001231637897 977656747 /nfs/dbraw/zinc/65/67/47/977656747.db2.gz QBJAJWVGAAANMA-GFCCVEGCSA-N 1 2 246.354 2.445 20 0 BEADLO CC(=O)Nc1cc(Nc2ccc(F)cn2)cc[nH+]1 ZINC001175848347 977766825 /nfs/dbraw/zinc/76/68/25/977766825.db2.gz JSGSOWAUTKEZHD-UHFFFAOYSA-N 1 2 246.245 2.318 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@](C)(CO)C2)[nH+]1 ZINC001336555199 977772136 /nfs/dbraw/zinc/77/21/36/977772136.db2.gz GMJMYWZRNQVCJV-ZDUSSCGKSA-N 1 2 238.306 2.128 20 0 BEADLO CCc1ccc(N2CCOC3(CCC3)C2)[nH+]c1 ZINC001336575307 977790683 /nfs/dbraw/zinc/79/06/83/977790683.db2.gz UDAXKKHWZXPYIX-UHFFFAOYSA-N 1 2 232.327 2.403 20 0 BEADLO Cc1[nH+]c2ccc(N)cc2n1-c1cscn1 ZINC001175944060 977809403 /nfs/dbraw/zinc/80/94/03/977809403.db2.gz XMQHEDTYQOHHNQ-UHFFFAOYSA-N 1 2 230.296 2.373 20 0 BEADLO Cc1cc(F)ncc1C[N@H+](C)Cc1ccno1 ZINC001231985457 977821408 /nfs/dbraw/zinc/82/14/08/977821408.db2.gz METLTEIBVDNVCN-UHFFFAOYSA-N 1 2 235.262 2.149 20 0 BEADLO Cc1cc(F)ncc1C[N@@H+](C)Cc1ccno1 ZINC001231985457 977821413 /nfs/dbraw/zinc/82/14/13/977821413.db2.gz METLTEIBVDNVCN-UHFFFAOYSA-N 1 2 235.262 2.149 20 0 BEADLO Cc1cc(F)ncc1C[N@H+]1C[C@@H](F)C[C@H]1C ZINC001231980127 977823478 /nfs/dbraw/zinc/82/34/78/977823478.db2.gz REZZBEHBHHWOKD-KOLCDFICSA-N 1 2 226.270 2.461 20 0 BEADLO Cc1cc(F)ncc1C[N@@H+]1C[C@@H](F)C[C@H]1C ZINC001231980127 977823482 /nfs/dbraw/zinc/82/34/82/977823482.db2.gz REZZBEHBHHWOKD-KOLCDFICSA-N 1 2 226.270 2.461 20 0 BEADLO Fc1ncc(Cl)cc1C[NH+]1CCCC1 ZINC001231992567 977827595 /nfs/dbraw/zinc/82/75/95/977827595.db2.gz NHXXADBQPYXGEV-UHFFFAOYSA-N 1 2 214.671 2.470 20 0 BEADLO Cc1cc(C[NH+]2CC3(C2)CCCCO3)cc(C)n1 ZINC001231997296 977832118 /nfs/dbraw/zinc/83/21/18/977832118.db2.gz MFIUEWFWUNPOCB-UHFFFAOYSA-N 1 2 246.354 2.453 20 0 BEADLO COC(=O)c1ccsc1Nc1[nH]cc[nH+]1 ZINC001176080370 977877597 /nfs/dbraw/zinc/87/75/97/977877597.db2.gz VFJDBJJUCCJMPI-UHFFFAOYSA-N 1 2 223.257 2.001 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc3ncccc3[nH]2)[C@@H](C)CO1 ZINC001232067144 977882273 /nfs/dbraw/zinc/88/22/73/977882273.db2.gz JVJPVXVGAKQJEV-WDEREUQCSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc3ncccc3[nH]2)[C@@H](C)CO1 ZINC001232067144 977882277 /nfs/dbraw/zinc/88/22/77/977882277.db2.gz JVJPVXVGAKQJEV-WDEREUQCSA-N 1 2 245.326 2.172 20 0 BEADLO F[C@H]1CCC[N@H+](Cc2cc3ccncc3[nH]2)C1 ZINC001232092581 977890735 /nfs/dbraw/zinc/89/07/35/977890735.db2.gz NDIKWSRPOZXEFM-NSHDSACASA-N 1 2 233.290 2.497 20 0 BEADLO F[C@H]1CCC[N@@H+](Cc2cc3ccncc3[nH]2)C1 ZINC001232092581 977890742 /nfs/dbraw/zinc/89/07/42/977890742.db2.gz NDIKWSRPOZXEFM-NSHDSACASA-N 1 2 233.290 2.497 20 0 BEADLO c1cc(C[N@@H+]2CCC[C@@H]2c2cnccn2)sn1 ZINC001232192046 977913939 /nfs/dbraw/zinc/91/39/39/977913939.db2.gz SCIKWOJGOITDEY-GFCCVEGCSA-N 1 2 246.339 2.270 20 0 BEADLO c1cc(C[N@H+]2CCC[C@@H]2c2cnccn2)sn1 ZINC001232192046 977913950 /nfs/dbraw/zinc/91/39/50/977913950.db2.gz SCIKWOJGOITDEY-GFCCVEGCSA-N 1 2 246.339 2.270 20 0 BEADLO COc1cc(NC2=CCOCC2)cc(C)[nH+]1 ZINC001176141672 977920550 /nfs/dbraw/zinc/92/05/50/977920550.db2.gz DUTVOPWGQYTZGJ-UHFFFAOYSA-N 1 2 220.272 2.115 20 0 BEADLO COc1cc[nH+]cc1Nc1nc(C)ccc1O ZINC001176116456 977946527 /nfs/dbraw/zinc/94/65/27/977946527.db2.gz FFNDTTVCYOVWOC-UHFFFAOYSA-N 1 2 231.255 2.243 20 0 BEADLO Cc1cc(N[C@@H]2CC[C@H]2O)[nH+]c2ccccc12 ZINC001336778572 977949567 /nfs/dbraw/zinc/94/95/67/977949567.db2.gz ZLGATGPMHGZKPZ-CHWSQXEVSA-N 1 2 228.295 2.478 20 0 BEADLO COc1cc[nH+]cc1Nc1cc(C2CC2)nn1C ZINC001176119235 977953429 /nfs/dbraw/zinc/95/34/29/977953429.db2.gz PPUBRTISXVMCBC-UHFFFAOYSA-N 1 2 244.298 2.445 20 0 BEADLO CCc1cc(Nc2c[nH+]ccc2OC)on1 ZINC001176118970 977953854 /nfs/dbraw/zinc/95/38/54/977953854.db2.gz RKWDWAVUUIHILU-UHFFFAOYSA-N 1 2 219.244 2.384 20 0 BEADLO c1nscc1C[N@@H+]1CCC[C@@H]1c1cnccn1 ZINC001232226282 977958867 /nfs/dbraw/zinc/95/88/67/977958867.db2.gz DBSCAVDYMLSGAQ-GFCCVEGCSA-N 1 2 246.339 2.270 20 0 BEADLO c1nscc1C[N@H+]1CCC[C@@H]1c1cnccn1 ZINC001232226282 977958873 /nfs/dbraw/zinc/95/88/73/977958873.db2.gz DBSCAVDYMLSGAQ-GFCCVEGCSA-N 1 2 246.339 2.270 20 0 BEADLO COc1cc[nH+]cc1Nc1cnccc1F ZINC001176121800 977959688 /nfs/dbraw/zinc/95/96/88/977959688.db2.gz QLIYAZHKBYCBAQ-UHFFFAOYSA-N 1 2 219.219 2.368 20 0 BEADLO CCn1cnc(Nc2c[nH+]ccc2OC)c1 ZINC001176121724 977959739 /nfs/dbraw/zinc/95/97/39/977959739.db2.gz MHNUIUDOBQFKRS-UHFFFAOYSA-N 1 2 218.260 2.050 20 0 BEADLO Cc1cn2cccc(Nc3ccc(=O)[nH]c3)c2[nH+]1 ZINC001176126617 977962622 /nfs/dbraw/zinc/96/26/22/977962622.db2.gz QUBWFQGBUVNPPT-UHFFFAOYSA-N 1 2 240.266 2.487 20 0 BEADLO CCN(C)c1ccc(Nc2ccc(=O)[nH]c2)c[nH+]1 ZINC001176127293 977964905 /nfs/dbraw/zinc/96/49/05/977964905.db2.gz FUGRPHJMNPGQBU-UHFFFAOYSA-N 1 2 244.298 2.382 20 0 BEADLO C[N@H+](Cc1nccc2ccccc21)C1COC1 ZINC001232248442 977972945 /nfs/dbraw/zinc/97/29/45/977972945.db2.gz GCTSHZWYOXTDET-UHFFFAOYSA-N 1 2 228.295 2.065 20 0 BEADLO C[N@@H+](Cc1nccc2ccccc21)C1COC1 ZINC001232248442 977972952 /nfs/dbraw/zinc/97/29/52/977972952.db2.gz GCTSHZWYOXTDET-UHFFFAOYSA-N 1 2 228.295 2.065 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1nccc2ccccc21 ZINC001232247896 977977284 /nfs/dbraw/zinc/97/72/84/977977284.db2.gz GXURDLSKMSTYDZ-UHFFFAOYSA-N 1 2 228.295 2.256 20 0 BEADLO CC(=O)C[N@H+](C)Cc1nccc2ccccc21 ZINC001232247896 977977295 /nfs/dbraw/zinc/97/72/95/977977295.db2.gz GXURDLSKMSTYDZ-UHFFFAOYSA-N 1 2 228.295 2.256 20 0 BEADLO CCN(Cc1ccc(N)[nH+]c1C)CC(F)(F)F ZINC001232342612 978026613 /nfs/dbraw/zinc/02/66/13/978026613.db2.gz NSOGBRYUGYICIL-UHFFFAOYSA-N 1 2 247.264 2.356 20 0 BEADLO Cc1nc(N)ccc1C[N@H+](C)Cc1cncs1 ZINC001232347384 978028853 /nfs/dbraw/zinc/02/88/53/978028853.db2.gz OYLSBEIVPKDSPY-UHFFFAOYSA-N 1 2 248.355 2.061 20 0 BEADLO Cc1nc(N)ccc1C[N@@H+](C)Cc1cncs1 ZINC001232347384 978028862 /nfs/dbraw/zinc/02/88/62/978028862.db2.gz OYLSBEIVPKDSPY-UHFFFAOYSA-N 1 2 248.355 2.061 20 0 BEADLO Cc1c(F)cc(C[N@@H+](C)C2COC2)cc1F ZINC001232423540 978058816 /nfs/dbraw/zinc/05/88/16/978058816.db2.gz QUAAFSIHVCUKPD-UHFFFAOYSA-N 1 2 227.254 2.104 20 0 BEADLO Cc1c(F)cc(C[N@H+](C)C2COC2)cc1F ZINC001232423540 978058823 /nfs/dbraw/zinc/05/88/23/978058823.db2.gz QUAAFSIHVCUKPD-UHFFFAOYSA-N 1 2 227.254 2.104 20 0 BEADLO Cc1[nH]c(CN2CC(F)(F)C[C@@]2(C)CF)c[nH+]1 ZINC001232460416 978099117 /nfs/dbraw/zinc/09/91/17/978099117.db2.gz PWLWVLKXFMCVND-JTQLQIEISA-N 1 2 247.264 2.287 20 0 BEADLO Cc1[nH]cc(CN2CC(F)(F)C[C@@]2(C)CF)[nH+]1 ZINC001232460416 978099130 /nfs/dbraw/zinc/09/91/30/978099130.db2.gz PWLWVLKXFMCVND-JTQLQIEISA-N 1 2 247.264 2.287 20 0 BEADLO CCN(Cc1c[nH+]c(C)[nH]1)Cc1cccnc1 ZINC001232462813 978103045 /nfs/dbraw/zinc/10/30/45/978103045.db2.gz UHCIVWGBZPTQMC-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO C[N@H+](Cc1ccno1)Cc1cc(F)ccc1N ZINC001232511677 978157182 /nfs/dbraw/zinc/15/71/82/978157182.db2.gz QKYLXTPYXQJZPM-UHFFFAOYSA-N 1 2 235.262 2.028 20 0 BEADLO C[N@@H+](Cc1ccno1)Cc1cc(F)ccc1N ZINC001232511677 978157194 /nfs/dbraw/zinc/15/71/94/978157194.db2.gz QKYLXTPYXQJZPM-UHFFFAOYSA-N 1 2 235.262 2.028 20 0 BEADLO FCc1cccc(C[N@@H+]2CCC[C@H](F)C2)n1 ZINC001232535251 978163121 /nfs/dbraw/zinc/16/31/21/978163121.db2.gz NYVBTCDJNHQTOY-JTQLQIEISA-N 1 2 226.270 2.485 20 0 BEADLO FCc1cccc(C[N@H+]2CCC[C@H](F)C2)n1 ZINC001232535251 978163130 /nfs/dbraw/zinc/16/31/30/978163130.db2.gz NYVBTCDJNHQTOY-JTQLQIEISA-N 1 2 226.270 2.485 20 0 BEADLO Nc1c(Br)cccc1C[NH+]1CCC1 ZINC001232523321 978163365 /nfs/dbraw/zinc/16/33/65/978163365.db2.gz KEXUDCBRAWWBII-UHFFFAOYSA-N 1 2 241.132 2.237 20 0 BEADLO C[C@@H]1C[NH+](Cc2cc3ccoc3cn2)C[C@@H](C)O1 ZINC001232549523 978177812 /nfs/dbraw/zinc/17/78/12/978177812.db2.gz FCVJTBWDYJQJES-GHMZBOCLSA-N 1 2 246.310 2.437 20 0 BEADLO CC(C)[C@@H](O)C[N@@H+]1CC(F)(F)CC[C@@H]1C ZINC001176897776 978253731 /nfs/dbraw/zinc/25/37/31/978253731.db2.gz OIPBCMUHACOLOJ-UWVGGRQHSA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)[C@@H](O)C[N@H+]1CC(F)(F)CC[C@@H]1C ZINC001176897776 978253742 /nfs/dbraw/zinc/25/37/42/978253742.db2.gz OIPBCMUHACOLOJ-UWVGGRQHSA-N 1 2 221.291 2.123 20 0 BEADLO Fc1cc(F)c2c(c1)CC[N@H+]([C@@H]1CCOC1)C2 ZINC001177027396 978277696 /nfs/dbraw/zinc/27/76/96/978277696.db2.gz JMSJTBVGPGMYLT-LLVKDONJSA-N 1 2 239.265 2.112 20 0 BEADLO Fc1cc(F)c2c(c1)CC[N@@H+]([C@@H]1CCOC1)C2 ZINC001177027396 978277707 /nfs/dbraw/zinc/27/77/07/978277707.db2.gz JMSJTBVGPGMYLT-LLVKDONJSA-N 1 2 239.265 2.112 20 0 BEADLO CC[N@H+](CCOC)Cc1ccc(F)c(O)c1F ZINC001232931167 978341946 /nfs/dbraw/zinc/34/19/46/978341946.db2.gz KHPLGEHKKJFZOY-UHFFFAOYSA-N 1 2 245.269 2.139 20 0 BEADLO CC[N@@H+](CCOC)Cc1ccc(F)c(O)c1F ZINC001232931167 978341957 /nfs/dbraw/zinc/34/19/57/978341957.db2.gz KHPLGEHKKJFZOY-UHFFFAOYSA-N 1 2 245.269 2.139 20 0 BEADLO CS[C@@H](C)CC(=O)Nc1c(C)c[nH+]cc1C ZINC001337508415 978380790 /nfs/dbraw/zinc/38/07/90/978380790.db2.gz CEOGVOUATHDKNP-JTQLQIEISA-N 1 2 238.356 2.200 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1cc(Cl)ncc1O ZINC001233032083 978414873 /nfs/dbraw/zinc/41/48/73/978414873.db2.gz DDVPZQXJCMAKHM-VXNVDRBHSA-N 1 2 244.697 2.373 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1cc(Cl)ncc1O ZINC001233032083 978414874 /nfs/dbraw/zinc/41/48/74/978414874.db2.gz DDVPZQXJCMAKHM-VXNVDRBHSA-N 1 2 244.697 2.373 20 0 BEADLO C[C@H]1C[C@H](O)CC[N@@H+]1Cc1scnc1Cl ZINC000721941847 978430229 /nfs/dbraw/zinc/43/02/29/978430229.db2.gz JENKJWFKBHZJKK-JGVFFNPUSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@H]1C[C@H](O)CC[N@H+]1Cc1scnc1Cl ZINC000721941847 978430236 /nfs/dbraw/zinc/43/02/36/978430236.db2.gz JENKJWFKBHZJKK-JGVFFNPUSA-N 1 2 246.763 2.142 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]21 ZINC001337638837 978437655 /nfs/dbraw/zinc/43/76/55/978437655.db2.gz HFJWFIJSAIZOAS-AGIUHOORSA-N 1 2 244.338 2.495 20 0 BEADLO C[C@H](CC(=O)N1CC[C@H]1C(C)(C)C)n1cc[nH+]c1 ZINC001337663506 978449860 /nfs/dbraw/zinc/44/98/60/978449860.db2.gz ZIHMIEIAJPOOQS-NEPJUHHUSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@@H]1CCCC[N@@H+]1Cc1nc2ccccn2n1 ZINC001233068050 978453588 /nfs/dbraw/zinc/45/35/88/978453588.db2.gz QBYXUCCEDKEMBB-LLVKDONJSA-N 1 2 230.315 2.104 20 0 BEADLO C[C@@H]1CCCC[N@H+]1Cc1nc2ccccn2n1 ZINC001233068050 978453600 /nfs/dbraw/zinc/45/36/00/978453600.db2.gz QBYXUCCEDKEMBB-LLVKDONJSA-N 1 2 230.315 2.104 20 0 BEADLO C[N@@H+]1Cc2ccccc2[C@H]1CNc1nncs1 ZINC001337683363 978455644 /nfs/dbraw/zinc/45/56/44/978455644.db2.gz SHCNKDDWBWMIHQ-LLVKDONJSA-N 1 2 246.339 2.137 20 0 BEADLO C[N@H+]1Cc2ccccc2[C@H]1CNc1nncs1 ZINC001337683363 978455650 /nfs/dbraw/zinc/45/56/50/978455650.db2.gz SHCNKDDWBWMIHQ-LLVKDONJSA-N 1 2 246.339 2.137 20 0 BEADLO C[C@H](C(=O)NCC(C)(C)CC1CC1)n1cc[nH+]c1 ZINC001177929936 978478741 /nfs/dbraw/zinc/47/87/41/978478741.db2.gz VNWHXDCFKHGILX-LLVKDONJSA-N 1 2 249.358 2.387 20 0 BEADLO Cc1c[nH]c(=O)c(C[N@@H+]2Cc3ccncc3C2)c1 ZINC001233190844 978488485 /nfs/dbraw/zinc/48/84/85/978488485.db2.gz AENOOBAVFVHEOE-UHFFFAOYSA-N 1 2 241.294 2.006 20 0 BEADLO Cc1c[nH]c(=O)c(C[N@H+]2Cc3ccncc3C2)c1 ZINC001233190844 978488492 /nfs/dbraw/zinc/48/84/92/978488492.db2.gz AENOOBAVFVHEOE-UHFFFAOYSA-N 1 2 241.294 2.006 20 0 BEADLO CCOC[C@@H]1CCN(c2cc(F)cc(C)[nH+]2)C1 ZINC001337795569 978499983 /nfs/dbraw/zinc/49/99/83/978499983.db2.gz PZRXZSSQGVTNKT-LLVKDONJSA-N 1 2 238.306 2.392 20 0 BEADLO Cc1cc(F)cc(N2CCO[C@@H](C)[C@H]2C)[nH+]1 ZINC001337808632 978500905 /nfs/dbraw/zinc/50/09/05/978500905.db2.gz HFGIHNONMYGNHF-ZJUUUORDSA-N 1 2 224.279 2.143 20 0 BEADLO Cc1ccc(C[N@@H+]2C[C@H]3CC[C@@H]2CO3)cc1O ZINC001233234643 978507637 /nfs/dbraw/zinc/50/76/37/978507637.db2.gz BMMLASAHEHDGOW-CHWSQXEVSA-N 1 2 233.311 2.064 20 0 BEADLO Cc1ccc(C[N@H+]2C[C@H]3CC[C@@H]2CO3)cc1O ZINC001233234643 978507641 /nfs/dbraw/zinc/50/76/41/978507641.db2.gz BMMLASAHEHDGOW-CHWSQXEVSA-N 1 2 233.311 2.064 20 0 BEADLO CO[C@@H]1CN(c2cc(F)cc(C)[nH+]2)CC[C@@H]1C ZINC001337844721 978522814 /nfs/dbraw/zinc/52/28/14/978522814.db2.gz DQQKZVZAFDIVPY-JOYOIKCWSA-N 1 2 238.306 2.390 20 0 BEADLO CO[C@H]1CN(c2cc(F)cc(C)[nH+]2)CC[C@H]1C ZINC001337844722 978523265 /nfs/dbraw/zinc/52/32/65/978523265.db2.gz DQQKZVZAFDIVPY-SKDRFNHKSA-N 1 2 238.306 2.390 20 0 BEADLO CCOCCN(CC)c1cc(F)cc(C)[nH+]1 ZINC001337851027 978526021 /nfs/dbraw/zinc/52/60/21/978526021.db2.gz HFIXXCVXUSJJOG-UHFFFAOYSA-N 1 2 226.295 2.392 20 0 BEADLO CCOC(=O)[C@H](C)CNc1cc(F)cc(C)[nH+]1 ZINC001337882749 978546518 /nfs/dbraw/zinc/54/65/18/978546518.db2.gz DCUQXQIOVDKCDP-MRVPVSSYSA-N 1 2 240.278 2.140 20 0 BEADLO Cc1cc(F)cc(N2C[C@H]3COC[C@@]3(C)C2)[nH+]1 ZINC001337926537 978564861 /nfs/dbraw/zinc/56/48/61/978564861.db2.gz XZCDKDSEIMXMHY-GXFFZTMASA-N 1 2 236.290 2.002 20 0 BEADLO Cc1cc(F)cc(N2C[C@@H]3COC[C@@]3(C)C2)[nH+]1 ZINC001337926540 978564873 /nfs/dbraw/zinc/56/48/73/978564873.db2.gz XZCDKDSEIMXMHY-ZWNOBZJWSA-N 1 2 236.290 2.002 20 0 BEADLO c1c2cccnc2sc1C[N@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001233348688 978570978 /nfs/dbraw/zinc/57/09/78/978570978.db2.gz LNTHQXZXTCTOKB-PHIMTYICSA-N 1 2 246.335 2.269 20 0 BEADLO c1c2cccnc2sc1C[N@@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001233348688 978570985 /nfs/dbraw/zinc/57/09/85/978570985.db2.gz LNTHQXZXTCTOKB-PHIMTYICSA-N 1 2 246.335 2.269 20 0 BEADLO COc1ccc(C[NH+]2CCC2)c(Cl)c1O ZINC001233396903 978599325 /nfs/dbraw/zinc/59/93/25/978599325.db2.gz BMGWUSRVRFWNCL-UHFFFAOYSA-N 1 2 227.691 2.260 20 0 BEADLO CCCC(C)(C)C(=O)NCc1c[nH+]c(CC)[nH]1 ZINC001178670170 978603454 /nfs/dbraw/zinc/60/34/54/978603454.db2.gz SRTXYIXHEMANQM-UHFFFAOYSA-N 1 2 237.347 2.415 20 0 BEADLO CCCC(C)(C)C(=O)NCc1c[nH]c(CC)[nH+]1 ZINC001178670170 978603459 /nfs/dbraw/zinc/60/34/59/978603459.db2.gz SRTXYIXHEMANQM-UHFFFAOYSA-N 1 2 237.347 2.415 20 0 BEADLO Cc1ncsc1C(=O)Nc1c(C)c[nH+]cc1C ZINC001338244058 978643195 /nfs/dbraw/zinc/64/31/95/978643195.db2.gz SAFBHUJYHDLLTK-UHFFFAOYSA-N 1 2 247.323 2.138 20 0 BEADLO Cc1cc(CNc2cc(CO)cc[nH+]2)cnc1F ZINC001178991770 978659382 /nfs/dbraw/zinc/65/93/82/978659382.db2.gz HNHRKIXQFRHAOB-UHFFFAOYSA-N 1 2 247.273 2.029 20 0 BEADLO C[N@@H+]1CCO[C@H](COc2ccc3occc3c2)C1 ZINC001233676522 978669555 /nfs/dbraw/zinc/66/95/55/978669555.db2.gz HPSIRNFPFUKSEE-ZDUSSCGKSA-N 1 2 247.294 2.142 20 0 BEADLO C[N@H+]1CCO[C@H](COc2ccc3occc3c2)C1 ZINC001233676522 978669562 /nfs/dbraw/zinc/66/95/62/978669562.db2.gz HPSIRNFPFUKSEE-ZDUSSCGKSA-N 1 2 247.294 2.142 20 0 BEADLO Cc1cc(C[N@@H+]2CCC23COC3)sc1C ZINC001233683957 978671389 /nfs/dbraw/zinc/67/13/89/978671389.db2.gz BAQUKWAXRTTXMQ-UHFFFAOYSA-N 1 2 223.341 2.340 20 0 BEADLO Cc1cc(C[N@H+]2CCC23COC3)sc1C ZINC001233683957 978671394 /nfs/dbraw/zinc/67/13/94/978671394.db2.gz BAQUKWAXRTTXMQ-UHFFFAOYSA-N 1 2 223.341 2.340 20 0 BEADLO CCn1c[nH+]cc1CNc1cnc2[nH]ccc2c1 ZINC001179588397 978727861 /nfs/dbraw/zinc/72/78/61/978727861.db2.gz CABPAMVQTLICLN-UHFFFAOYSA-N 1 2 241.298 2.343 20 0 BEADLO CCOCCc1c[nH+]c(N)cc1C(F)(F)F ZINC001249940342 978739566 /nfs/dbraw/zinc/73/95/66/978739566.db2.gz YMOSAWMDAFDGBS-UHFFFAOYSA-N 1 2 234.221 2.262 20 0 BEADLO CCCc1ccc(C[NH2+]Cc2nnc[nH]2)s1 ZINC001179842743 978764067 /nfs/dbraw/zinc/76/40/67/978764067.db2.gz VOBXGCSXJUREIA-UHFFFAOYSA-N 1 2 236.344 2.109 20 0 BEADLO CC[N@H+](C)Cc1c(Cl)nccc1N(C)C ZINC001234095190 978772780 /nfs/dbraw/zinc/77/27/80/978772780.db2.gz HGNYBHZKSUHAOL-UHFFFAOYSA-N 1 2 227.739 2.253 20 0 BEADLO CC[N@@H+](C)Cc1c(Cl)nccc1N(C)C ZINC001234095190 978772786 /nfs/dbraw/zinc/77/27/86/978772786.db2.gz HGNYBHZKSUHAOL-UHFFFAOYSA-N 1 2 227.739 2.253 20 0 BEADLO CC1C[NH+](Cc2c(Cl)nccc2N(C)C)C1 ZINC001234095651 978773607 /nfs/dbraw/zinc/77/36/07/978773607.db2.gz KQDLWSZARXWLDQ-UHFFFAOYSA-N 1 2 239.750 2.253 20 0 BEADLO C[C@H]1CC[N@@H+]1Cc1c(Cl)nccc1N(C)C ZINC001234105206 978776416 /nfs/dbraw/zinc/77/64/16/978776416.db2.gz WNIABQKNNZCPPS-VIFPVBQESA-N 1 2 239.750 2.395 20 0 BEADLO C[C@H]1CC[N@H+]1Cc1c(Cl)nccc1N(C)C ZINC001234105206 978776422 /nfs/dbraw/zinc/77/64/22/978776422.db2.gz WNIABQKNNZCPPS-VIFPVBQESA-N 1 2 239.750 2.395 20 0 BEADLO COc1cccc(C[N@@H+]2CCCC[C@H]2C(C)=O)n1 ZINC000070093723 978807132 /nfs/dbraw/zinc/80/71/32/978807132.db2.gz PURZWOSJJDWUNT-ZDUSSCGKSA-N 1 2 248.326 2.034 20 0 BEADLO COc1cccc(C[N@H+]2CCCC[C@H]2C(C)=O)n1 ZINC000070093723 978807137 /nfs/dbraw/zinc/80/71/37/978807137.db2.gz PURZWOSJJDWUNT-ZDUSSCGKSA-N 1 2 248.326 2.034 20 0 BEADLO CN(C)c1cc(CSCc2cc[nH]n2)cc[nH+]1 ZINC001339182651 978812171 /nfs/dbraw/zinc/81/21/71/978812171.db2.gz HVEYHBWTWOVNKN-UHFFFAOYSA-N 1 2 248.355 2.304 20 0 BEADLO CC(C)[C@@H]1CCCCN1C(=O)[C@H](C)n1cc[nH+]c1 ZINC001339187447 978813348 /nfs/dbraw/zinc/81/33/48/978813348.db2.gz DYWPFKBMEZMAAR-STQMWFEESA-N 1 2 249.358 2.481 20 0 BEADLO C=C(F)C(=O)Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001180116713 978826136 /nfs/dbraw/zinc/82/61/36/978826136.db2.gz XFXARAOUQTXKFI-UHFFFAOYSA-N 1 2 245.257 2.353 20 0 BEADLO CC[NH+]1CC(Oc2ccc(C(C)C)nc2)C1 ZINC001234486269 978848057 /nfs/dbraw/zinc/84/80/57/978848057.db2.gz RKOGVLMKNNQOPI-UHFFFAOYSA-N 1 2 220.316 2.288 20 0 BEADLO C[C@@H](O)CCCC(=O)Oc1cc2[nH]ccc2c[nH+]1 ZINC001234525471 978855757 /nfs/dbraw/zinc/85/57/57/978855757.db2.gz JFVWRULNISQRQF-SECBINFHSA-N 1 2 248.282 2.019 20 0 BEADLO CC[C@@H]1CN(c2cc(F)cc(C)[nH+]2)CCO1 ZINC001339522942 978863555 /nfs/dbraw/zinc/86/35/55/978863555.db2.gz QQSGIISATDDWTP-LLVKDONJSA-N 1 2 224.279 2.144 20 0 BEADLO Cc1cc(F)cc(N2CCCO[C@H](C)C2)[nH+]1 ZINC001339560772 978871956 /nfs/dbraw/zinc/87/19/56/978871956.db2.gz FNDUPTDPRIZYRY-SNVBAGLBSA-N 1 2 224.279 2.144 20 0 BEADLO Cc1cc(F)cc(N(C)C[C@H]2CCCO2)[nH+]1 ZINC001339661249 978888686 /nfs/dbraw/zinc/88/86/86/978888686.db2.gz TXIPECJUJWMPLH-LLVKDONJSA-N 1 2 224.279 2.144 20 0 BEADLO CCc1ccc(N2CC[C@H](C(=O)OC)[C@@H]2C)[nH+]c1 ZINC001339685132 978893421 /nfs/dbraw/zinc/89/34/21/978893421.db2.gz DFZKAXKCLAJUSA-JQWIXIFHSA-N 1 2 248.326 2.032 20 0 BEADLO Fc1cnc(C[NH+]2CCC3(CCC3)CC2)nc1 ZINC001235008999 978950654 /nfs/dbraw/zinc/95/06/54/978950654.db2.gz ZOGVWHAMHISNAS-UHFFFAOYSA-N 1 2 235.306 2.382 20 0 BEADLO C[C@@H](C(=O)N(C)[C@@H](C)C1(C)CC1)n1cc[nH+]c1 ZINC001340074924 978965583 /nfs/dbraw/zinc/96/55/83/978965583.db2.gz PRYUWVYELXMRRC-QWRGUYRKSA-N 1 2 235.331 2.091 20 0 BEADLO COc1ccnc([C@@H](C)[NH2+]Cc2cnc(C)o2)c1 ZINC001340117807 978970758 /nfs/dbraw/zinc/97/07/58/978970758.db2.gz MFQBXXMJNZWLMN-SECBINFHSA-N 1 2 247.298 2.237 20 0 BEADLO CCc1cccc(C[N@@H+]2CCCC(=O)[C@H](C)C2)n1 ZINC001235249333 979006984 /nfs/dbraw/zinc/00/69/84/979006984.db2.gz BLOIMCXVZHFKSK-GFCCVEGCSA-N 1 2 246.354 2.445 20 0 BEADLO CCc1cccc(C[N@H+]2CCCC(=O)[C@H](C)C2)n1 ZINC001235249333 979006990 /nfs/dbraw/zinc/00/69/90/979006990.db2.gz BLOIMCXVZHFKSK-GFCCVEGCSA-N 1 2 246.354 2.445 20 0 BEADLO CCc1cccc(C[N@H+](C)Cc2ccncn2)n1 ZINC001235268645 979016402 /nfs/dbraw/zinc/01/64/02/979016402.db2.gz YEFIFFZTPVGPDH-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO CCc1cccc(C[N@@H+](C)Cc2ccncn2)n1 ZINC001235268645 979016408 /nfs/dbraw/zinc/01/64/08/979016408.db2.gz YEFIFFZTPVGPDH-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO COc1cc(C[NH+]2CCC(F)CC2)c(F)cn1 ZINC001235321242 979023491 /nfs/dbraw/zinc/02/34/91/979023491.db2.gz UBRZVLWAHOSPGX-UHFFFAOYSA-N 1 2 242.269 2.163 20 0 BEADLO CC[C@@H](C)C[C@H](C)NC(=O)Cc1cc[nH+]c(N)c1 ZINC001181265712 979030323 /nfs/dbraw/zinc/03/03/23/979030323.db2.gz RQPLUXJFEZDHMS-MNOVXSKESA-N 1 2 249.358 2.147 20 0 BEADLO FCC[NH2+]Cc1cncc(Cl)c1Cl ZINC001181325040 979043889 /nfs/dbraw/zinc/04/38/89/979043889.db2.gz UKRIJOZAVAQDOU-UHFFFAOYSA-N 1 2 223.078 2.448 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H]1CCC(C)(C)O1 ZINC001340809863 979116744 /nfs/dbraw/zinc/11/67/44/979116744.db2.gz GIBFNIQAHCXUHE-LLVKDONJSA-N 1 2 248.326 2.016 20 0 BEADLO Cc1nc(F)ccc1C[N@H+]1C[C@@H](F)C[C@H]1C ZINC001235806127 979151591 /nfs/dbraw/zinc/15/15/91/979151591.db2.gz QKTSDWHJXKLQID-KCJUWKMLSA-N 1 2 226.270 2.461 20 0 BEADLO Cc1nc(F)ccc1C[N@@H+]1C[C@@H](F)C[C@H]1C ZINC001235806127 979151597 /nfs/dbraw/zinc/15/15/97/979151597.db2.gz QKTSDWHJXKLQID-KCJUWKMLSA-N 1 2 226.270 2.461 20 0 BEADLO CCOc1cc(C[N@H+](C)CC(C)=O)ccc1F ZINC001235797003 979152911 /nfs/dbraw/zinc/15/29/11/979152911.db2.gz YGFNAAMGUSOSMA-UHFFFAOYSA-N 1 2 239.290 2.245 20 0 BEADLO CCOc1cc(C[N@@H+](C)CC(C)=O)ccc1F ZINC001235797003 979152913 /nfs/dbraw/zinc/15/29/13/979152913.db2.gz YGFNAAMGUSOSMA-UHFFFAOYSA-N 1 2 239.290 2.245 20 0 BEADLO COc1nccc(C[N@@H+]2CC[C@H]2C)c1Cl ZINC001235829462 979165206 /nfs/dbraw/zinc/16/52/06/979165206.db2.gz FCWPNAFMEBGOKU-MRVPVSSYSA-N 1 2 226.707 2.338 20 0 BEADLO COc1nccc(C[N@H+]2CC[C@H]2C)c1Cl ZINC001235829462 979165213 /nfs/dbraw/zinc/16/52/13/979165213.db2.gz FCWPNAFMEBGOKU-MRVPVSSYSA-N 1 2 226.707 2.338 20 0 BEADLO CNc1cc(-c2ccc(OCOC)nc2)cc[nH+]1 ZINC001235951046 979218465 /nfs/dbraw/zinc/21/84/65/979218465.db2.gz ACZSNLPVKYRKOJ-UHFFFAOYSA-N 1 2 245.282 2.168 20 0 BEADLO C[C@@H](c1ncccn1)[N@@H+]1CCOCC2(CCC2)C1 ZINC001341095101 979231727 /nfs/dbraw/zinc/23/17/27/979231727.db2.gz UVJRIFBIVVKCBW-LBPRGKRZSA-N 1 2 247.342 2.040 20 0 BEADLO C[C@@H](c1ncccn1)[N@H+]1CCOCC2(CCC2)C1 ZINC001341095101 979231741 /nfs/dbraw/zinc/23/17/41/979231741.db2.gz UVJRIFBIVVKCBW-LBPRGKRZSA-N 1 2 247.342 2.040 20 0 BEADLO C[N@H+](CCO)Cc1ccc(F)c(F)c1Cl ZINC001236256859 979479049 /nfs/dbraw/zinc/47/90/49/979479049.db2.gz VNYTZQYMBUSHNV-UHFFFAOYSA-N 1 2 235.661 2.042 20 0 BEADLO C[N@@H+](CCO)Cc1ccc(F)c(F)c1Cl ZINC001236256859 979479056 /nfs/dbraw/zinc/47/90/56/979479056.db2.gz VNYTZQYMBUSHNV-UHFFFAOYSA-N 1 2 235.661 2.042 20 0 BEADLO COC(=O)c1cccc(-c2ccc(N)[nH+]c2)c1C ZINC001236312509 979518520 /nfs/dbraw/zinc/51/85/20/979518520.db2.gz QZGURRCITYRXIM-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO Nc1ccc(-c2cc(F)c3nccnc3c2)c[nH+]1 ZINC001236313813 979524977 /nfs/dbraw/zinc/52/49/77/979524977.db2.gz ZDUZHRSLNCEJQK-UHFFFAOYSA-N 1 2 240.241 2.413 20 0 BEADLO Cc1noc(C)c1Cc1c[nH+]c(C)c(N)c1 ZINC001250067867 979563975 /nfs/dbraw/zinc/56/39/75/979563975.db2.gz GDSGFSLJPOFDTI-UHFFFAOYSA-N 1 2 217.272 2.168 20 0 BEADLO C[C@H]1CN(Cc2ccc(S)cc2)C[C@H](C)[NH2+]1 ZINC001236425764 979594647 /nfs/dbraw/zinc/59/46/47/979594647.db2.gz ZYNBDBRWBWMPRS-QWRGUYRKSA-N 1 2 236.384 2.158 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cc(F)cc(C(=O)N(C)C)c1 ZINC001236509060 979613083 /nfs/dbraw/zinc/61/30/83/979613083.db2.gz ZWDJAMYSXGUFNI-GQYICFGZSA-N 1 2 248.301 2.403 20 0 BEADLO Oc1cncc(-c2ccc3[nH+]ccn3c2)c1 ZINC001236581155 979657883 /nfs/dbraw/zinc/65/78/83/979657883.db2.gz UARQEMAJRNAYJE-UHFFFAOYSA-N 1 2 211.224 2.102 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1ccc(F)c(O)c1 ZINC001236702801 979699352 /nfs/dbraw/zinc/69/93/52/979699352.db2.gz MGGLBYJELFSQQM-SCZZXKLOSA-N 1 2 227.254 2.464 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1ccc(F)c(O)c1 ZINC001236702801 979699355 /nfs/dbraw/zinc/69/93/55/979699355.db2.gz MGGLBYJELFSQQM-SCZZXKLOSA-N 1 2 227.254 2.464 20 0 BEADLO Cc1c(C[N@@H+](C)C2COC2)ccc(F)c1F ZINC001237162037 979825376 /nfs/dbraw/zinc/82/53/76/979825376.db2.gz OLTYZQODJBCYLR-UHFFFAOYSA-N 1 2 227.254 2.104 20 0 BEADLO Cc1c(C[N@H+](C)C2COC2)ccc(F)c1F ZINC001237162037 979825380 /nfs/dbraw/zinc/82/53/80/979825380.db2.gz OLTYZQODJBCYLR-UHFFFAOYSA-N 1 2 227.254 2.104 20 0 BEADLO Nc1cccc(C[N@@H+]2Cc3cccnc3C2)c1 ZINC001237217380 979849675 /nfs/dbraw/zinc/84/96/75/979849675.db2.gz SWHABEXWDADMQD-UHFFFAOYSA-N 1 2 225.295 2.180 20 0 BEADLO Nc1cccc(C[N@H+]2Cc3cccnc3C2)c1 ZINC001237217380 979849677 /nfs/dbraw/zinc/84/96/77/979849677.db2.gz SWHABEXWDADMQD-UHFFFAOYSA-N 1 2 225.295 2.180 20 0 BEADLO C[N@H+](Cc1ccno1)Cc1cc(O)cc(F)c1 ZINC001237280010 979858112 /nfs/dbraw/zinc/85/81/12/979858112.db2.gz AIHIOYOUMCSCCE-UHFFFAOYSA-N 1 2 236.246 2.151 20 0 BEADLO C[N@@H+](Cc1ccno1)Cc1cc(O)cc(F)c1 ZINC001237280010 979858121 /nfs/dbraw/zinc/85/81/21/979858121.db2.gz AIHIOYOUMCSCCE-UHFFFAOYSA-N 1 2 236.246 2.151 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc(O)cc(F)c2)C[C@@H]1F ZINC001237285560 979864533 /nfs/dbraw/zinc/86/45/33/979864533.db2.gz VSNJWPAMKBMQBB-PELKAZGASA-N 1 2 227.254 2.321 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc(O)cc(F)c2)C[C@@H]1F ZINC001237285560 979864536 /nfs/dbraw/zinc/86/45/36/979864536.db2.gz VSNJWPAMKBMQBB-PELKAZGASA-N 1 2 227.254 2.321 20 0 BEADLO Cc1cc(F)cc(C)c1C[N@@H+]1CCC12COC2 ZINC001237321728 979867080 /nfs/dbraw/zinc/86/70/80/979867080.db2.gz NLTSJCRAVXGELF-UHFFFAOYSA-N 1 2 235.302 2.417 20 0 BEADLO Cc1cc(F)cc(C)c1C[N@H+]1CCC12COC2 ZINC001237321728 979867084 /nfs/dbraw/zinc/86/70/84/979867084.db2.gz NLTSJCRAVXGELF-UHFFFAOYSA-N 1 2 235.302 2.417 20 0 BEADLO Nc1ccc(CCC(=O)Nc2ccccc2)c[nH+]1 ZINC001183932146 979903090 /nfs/dbraw/zinc/90/30/90/979903090.db2.gz NHVFYOXWBNDZJA-UHFFFAOYSA-N 1 2 241.294 2.235 20 0 BEADLO CCC(CC)CNC(=O)CCc1ccc(N)[nH+]c1 ZINC001183928246 979909170 /nfs/dbraw/zinc/90/91/70/979909170.db2.gz APJMHVGSNNTHLJ-UHFFFAOYSA-N 1 2 249.358 2.149 20 0 BEADLO CCn1c[nH+]cc1CN1CCC(F)(F)[C@H](F)C1 ZINC001237587359 979944030 /nfs/dbraw/zinc/94/40/30/979944030.db2.gz CGGCQTKIODWJRW-SNVBAGLBSA-N 1 2 247.264 2.082 20 0 BEADLO CCn1cncc1C[N@H+](C)Cc1cccnc1C ZINC001237593199 979949956 /nfs/dbraw/zinc/94/99/56/979949956.db2.gz HOGQXPTWMFBFNO-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1cncc1C[N@@H+](C)Cc1cccnc1C ZINC001237593199 979949959 /nfs/dbraw/zinc/94/99/59/979949959.db2.gz HOGQXPTWMFBFNO-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1c[nH+]cc1CN1CC(F)(F)C[C@H]1CF ZINC001237588722 979951043 /nfs/dbraw/zinc/95/10/43/979951043.db2.gz TZLYPJDRRLIPCY-VIFPVBQESA-N 1 2 247.264 2.082 20 0 BEADLO CCc1cc(N2CCCOC[C@@H]2C)nc(CC)[nH+]1 ZINC001342948127 979953089 /nfs/dbraw/zinc/95/30/89/979953089.db2.gz UKOZZEDYGQRERD-NSHDSACASA-N 1 2 249.358 2.217 20 0 BEADLO CCn1c[nH+]cc1CN1Cc2nc(C)sc2C1 ZINC001237594635 979953450 /nfs/dbraw/zinc/95/34/50/979953450.db2.gz VUAPLRULGWEACM-UHFFFAOYSA-N 1 2 248.355 2.184 20 0 BEADLO C[NH+]1CC(NC(=O)CCCC2CCCCC2)C1 ZINC001184224693 979977031 /nfs/dbraw/zinc/97/70/31/979977031.db2.gz IRVFFMVGUJXMMH-UHFFFAOYSA-N 1 2 238.375 2.167 20 0 BEADLO FC(F)(F)CCC[N@@H+]1CCc2nccnc2C1 ZINC001343078340 980002467 /nfs/dbraw/zinc/00/24/67/980002467.db2.gz USIXRPNJPAPYLJ-UHFFFAOYSA-N 1 2 245.248 2.177 20 0 BEADLO FC(F)(F)CCC[N@H+]1CCc2nccnc2C1 ZINC001343078340 980002478 /nfs/dbraw/zinc/00/24/78/980002478.db2.gz USIXRPNJPAPYLJ-UHFFFAOYSA-N 1 2 245.248 2.177 20 0 BEADLO CCc1ncc(C[N@@H+]2CCC[C@H]2C(C)=O)s1 ZINC001237830716 980076953 /nfs/dbraw/zinc/07/69/53/980076953.db2.gz SKOSUBWVZKGFOO-NSHDSACASA-N 1 2 238.356 2.259 20 0 BEADLO CCc1ncc(C[N@H+]2CCC[C@H]2C(C)=O)s1 ZINC001237830716 980076961 /nfs/dbraw/zinc/07/69/61/980076961.db2.gz SKOSUBWVZKGFOO-NSHDSACASA-N 1 2 238.356 2.259 20 0 BEADLO COc1ccoc1C[N@@H+]1C[C@@H]2C[C@@H]2[C@@H](F)C1 ZINC001237870648 980105794 /nfs/dbraw/zinc/10/57/94/980105794.db2.gz ZZNZIXDAEJDANB-GUBZILKMSA-N 1 2 225.263 2.078 20 0 BEADLO COc1ccoc1C[N@H+]1C[C@@H]2C[C@@H]2[C@@H](F)C1 ZINC001237870648 980105799 /nfs/dbraw/zinc/10/57/99/980105799.db2.gz ZZNZIXDAEJDANB-GUBZILKMSA-N 1 2 225.263 2.078 20 0 BEADLO O=C(OCCn1cc[nH+]c1)C12CCC(CC1)CC2 ZINC001343455833 980112582 /nfs/dbraw/zinc/11/25/82/980112582.db2.gz FDWMGJJTPSCCGH-UHFFFAOYSA-N 1 2 248.326 2.397 20 0 BEADLO Cc1sccc1C[N@@H+]1CCC(=O)[C@H](C)C1 ZINC001237964340 980117883 /nfs/dbraw/zinc/11/78/83/980117883.db2.gz JWGBOKDDEFLEOF-SECBINFHSA-N 1 2 223.341 2.467 20 0 BEADLO Cc1sccc1C[N@H+]1CCC(=O)[C@H](C)C1 ZINC001237964340 980117888 /nfs/dbraw/zinc/11/78/88/980117888.db2.gz JWGBOKDDEFLEOF-SECBINFHSA-N 1 2 223.341 2.467 20 0 BEADLO Cn1c[nH+]cc1COC(=O)C[C@@H]1CC=CCC1 ZINC001343466852 980118229 /nfs/dbraw/zinc/11/82/29/980118229.db2.gz CADIGAZWGYOQBX-LLVKDONJSA-N 1 2 234.299 2.210 20 0 BEADLO CCOc1cc(C[N@@H+]2C[C@@H]3C[C@H]2CO3)ccc1C ZINC001238072330 980138214 /nfs/dbraw/zinc/13/82/14/980138214.db2.gz SBBXGXMGGWVGFA-KBPBESRZSA-N 1 2 247.338 2.367 20 0 BEADLO CCOc1cc(C[N@H+]2C[C@@H]3C[C@H]2CO3)ccc1C ZINC001238072330 980138217 /nfs/dbraw/zinc/13/82/17/980138217.db2.gz SBBXGXMGGWVGFA-KBPBESRZSA-N 1 2 247.338 2.367 20 0 BEADLO CCCOC1C[NH+](Cc2cc(O)ccc2C)C1 ZINC001238100325 980145250 /nfs/dbraw/zinc/14/52/50/980145250.db2.gz YNOPTRDUQODRPS-UHFFFAOYSA-N 1 2 235.327 2.311 20 0 BEADLO Cc1ccc(O)cc1C[N@H+](C)Cc1cnccn1 ZINC001238105729 980155054 /nfs/dbraw/zinc/15/50/54/980155054.db2.gz HBCAQCUNTHQMJB-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO Cc1ccc(O)cc1C[N@@H+](C)Cc1cnccn1 ZINC001238105729 980155064 /nfs/dbraw/zinc/15/50/64/980155064.db2.gz HBCAQCUNTHQMJB-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO Cc1ccc(O)cc1C[N@H+](C1CC1)C1COC1 ZINC001238105585 980156261 /nfs/dbraw/zinc/15/62/61/980156261.db2.gz FZSAOZWKVSLCRG-UHFFFAOYSA-N 1 2 233.311 2.064 20 0 BEADLO Cc1ccc(O)cc1C[N@@H+](C1CC1)C1COC1 ZINC001238105585 980156265 /nfs/dbraw/zinc/15/62/65/980156265.db2.gz FZSAOZWKVSLCRG-UHFFFAOYSA-N 1 2 233.311 2.064 20 0 BEADLO Nc1cc(Cl)[nH+]c(NC[C@@H]2CCCCO2)c1 ZINC000153940336 980166769 /nfs/dbraw/zinc/16/67/69/980166769.db2.gz PPQNPJPDKGDFQI-VIFPVBQESA-N 1 2 241.722 2.298 20 0 BEADLO C/C=C(/CC)C(=O)OCCCc1c[nH+]cn1C ZINC001343734862 980228904 /nfs/dbraw/zinc/22/89/04/980228904.db2.gz YMHBVZFPNAHXMH-WCIBSUBMSA-N 1 2 236.315 2.252 20 0 BEADLO Cc1cnc(C[N@@H+]2CCCC(=O)CC2)c(C)c1 ZINC001238429882 980256877 /nfs/dbraw/zinc/25/68/77/980256877.db2.gz NDVPINXRTUZWEQ-UHFFFAOYSA-N 1 2 232.327 2.253 20 0 BEADLO Cc1cnc(C[N@H+]2CCCC(=O)CC2)c(C)c1 ZINC001238429882 980256899 /nfs/dbraw/zinc/25/68/99/980256899.db2.gz NDVPINXRTUZWEQ-UHFFFAOYSA-N 1 2 232.327 2.253 20 0 BEADLO Cc1cc(C[NH+]2CC=CC2)ncc1Cl ZINC001238427977 980259181 /nfs/dbraw/zinc/25/91/81/980259181.db2.gz UPRCOHLDETZSQI-UHFFFAOYSA-N 1 2 208.692 2.415 20 0 BEADLO CC(C)Oc1cncc(C[N@@H+]2CC[C@H](F)C2)c1 ZINC001238460732 980272046 /nfs/dbraw/zinc/27/20/46/980272046.db2.gz AESQOWGMYUDWQF-LBPRGKRZSA-N 1 2 238.306 2.413 20 0 BEADLO CC(C)Oc1cncc(C[N@H+]2CC[C@H](F)C2)c1 ZINC001238460732 980272053 /nfs/dbraw/zinc/27/20/53/980272053.db2.gz AESQOWGMYUDWQF-LBPRGKRZSA-N 1 2 238.306 2.413 20 0 BEADLO c1cn(CCN2CCCc3ccccc32)c[nH+]1 ZINC000154298207 980272237 /nfs/dbraw/zinc/27/22/37/980272237.db2.gz WKMTYHJWNQEKAP-UHFFFAOYSA-N 1 2 227.311 2.336 20 0 BEADLO CC(C)(COC(=O)[C@H]1C[C@H]2C[C@H]2C1)n1cc[nH+]c1 ZINC001344090645 980346064 /nfs/dbraw/zinc/34/60/64/980346064.db2.gz HFLQYSDGTLKULH-GDNZZTSVSA-N 1 2 248.326 2.208 20 0 BEADLO Cc1occc1C(=O)OCC(C)(C)n1cc[nH+]c1 ZINC001344108739 980349137 /nfs/dbraw/zinc/34/91/37/980349137.db2.gz RNQLHOGGLJTZKT-UHFFFAOYSA-N 1 2 248.282 2.377 20 0 BEADLO Cc1nc(NCc2ccnc(Cl)c2)cc[nH+]1 ZINC001186675960 980434543 /nfs/dbraw/zinc/43/45/43/980434543.db2.gz SFOKMYOIMUHMJJ-UHFFFAOYSA-N 1 2 234.690 2.446 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2cnc3nccn3c2)c1 ZINC001203661301 980523131 /nfs/dbraw/zinc/52/31/31/980523131.db2.gz UHNRYUYRFUEKKF-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO C[C@H](C[N@@H+]1CCC(=O)[C@H](C)C1)C(F)(F)F ZINC000335059018 980525051 /nfs/dbraw/zinc/52/50/51/980525051.db2.gz BAYPJQMPOBSGBC-HTQZYQBOSA-N 1 2 223.238 2.096 20 0 BEADLO C[C@H](C[N@H+]1CCC(=O)[C@H](C)C1)C(F)(F)F ZINC000335059018 980525056 /nfs/dbraw/zinc/52/50/56/980525056.db2.gz BAYPJQMPOBSGBC-HTQZYQBOSA-N 1 2 223.238 2.096 20 0 BEADLO CNc1ccc(/C(C)=C/C=C/[NH3+])c(F)n1 ZINC001239421959 980570999 /nfs/dbraw/zinc/57/09/99/980570999.db2.gz VHRFUTDZHHMDBS-FCXRPNKRSA-N 1 2 207.252 2.138 20 0 BEADLO Cc1[nH]ccc1C(=O)Nc1cccc2[nH+]ccn21 ZINC001188150222 980603652 /nfs/dbraw/zinc/60/36/52/980603652.db2.gz ZRIXFVHNOGPOCV-UHFFFAOYSA-N 1 2 240.266 2.223 20 0 BEADLO Cc1cn2c(cccc2C2=CCOC2)[nH+]1 ZINC001239481895 980626370 /nfs/dbraw/zinc/62/63/70/980626370.db2.gz SJZLBUARVCCODE-UHFFFAOYSA-N 1 2 200.241 2.056 20 0 BEADLO CCn1c[nH+]cc1COC(=O)/C=C(/C)C1CC1 ZINC001345590951 980639812 /nfs/dbraw/zinc/63/98/12/980639812.db2.gz QPNKIFYMFBLSFD-POHAHGRESA-N 1 2 234.299 2.303 20 0 BEADLO Cc1n[nH]c2cc(CCn3cc[nH+]c3)ccc12 ZINC001250316336 980747959 /nfs/dbraw/zinc/74/79/59/980747959.db2.gz JNVBSDVASPPPCI-UHFFFAOYSA-N 1 2 226.283 2.311 20 0 BEADLO COc1ccc(CCn2cc[nH+]c2)c(C)c1 ZINC001250315235 980754007 /nfs/dbraw/zinc/75/40/07/980754007.db2.gz HFJXIIAHBRAHFN-UHFFFAOYSA-N 1 2 216.284 2.443 20 0 BEADLO OCc1c(Cl)cccc1CCn1cc[nH+]c1 ZINC001250320932 980762593 /nfs/dbraw/zinc/76/25/93/980762593.db2.gz SYLNQVQLXXEVOQ-UHFFFAOYSA-N 1 2 236.702 2.272 20 0 BEADLO CCC1(CNC(=O)CCc2[nH+]ccn2C)CCC1 ZINC001346394622 980825051 /nfs/dbraw/zinc/82/50/51/980825051.db2.gz TYUOLJVCHINVJL-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO CC[C@]1(C)CCN(C(=O)CCc2[nH+]ccn2C)C1 ZINC001346408287 980829201 /nfs/dbraw/zinc/82/92/01/980829201.db2.gz DXIKDIKQWBSPSX-CQSZACIVSA-N 1 2 249.358 2.001 20 0 BEADLO CC(C)(COC(=O)C1CC=CC1)n1cc[nH+]c1 ZINC001346607707 980869563 /nfs/dbraw/zinc/86/95/63/980869563.db2.gz CFPORUFTRMEJNT-UHFFFAOYSA-N 1 2 234.299 2.128 20 0 BEADLO C[C@H]1CC/C(=C/c2nnc(C[NH+](C)C)o2)C1 ZINC001346624923 980871142 /nfs/dbraw/zinc/87/11/42/980871142.db2.gz CZEUWDUPRIECIJ-CBFJXKFUSA-N 1 2 221.304 2.335 20 0 BEADLO COC(=O)c1cccc(-c2ccc(C)c(N)[nH+]2)c1 ZINC001239731345 980881272 /nfs/dbraw/zinc/88/12/72/980881272.db2.gz UPWMTJGYLRNERX-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO COC(=O)c1c[nH]c2nc(C3=CCCC3)[nH+]cc12 ZINC001239785821 980918467 /nfs/dbraw/zinc/91/84/67/980918467.db2.gz NSKWYPNCUNMSQE-UHFFFAOYSA-N 1 2 243.266 2.263 20 0 BEADLO CN(C)C(=O)c1ccc(-c2cc[nH+]c(N)c2)cc1 ZINC001239800248 980938591 /nfs/dbraw/zinc/93/85/91/980938591.db2.gz BPMDPKKGIXFKBV-UHFFFAOYSA-N 1 2 241.294 2.033 20 0 BEADLO CC[C@H]1CCC[C@H]1NC(=O)CCc1[nH+]ccn1C ZINC001347015589 980949617 /nfs/dbraw/zinc/94/96/17/980949617.db2.gz ODPYJFATAJPFJJ-NWDGAFQWSA-N 1 2 249.358 2.048 20 0 BEADLO Nc1ccc(-c2[nH+]ccc3[nH]ccc32)c(F)n1 ZINC001239808861 980950265 /nfs/dbraw/zinc/95/02/65/980950265.db2.gz OMNBEGUTOYCNKG-UHFFFAOYSA-N 1 2 228.230 2.346 20 0 BEADLO Cc1cn2cc(-c3ccc(N)nc3F)ccc2[nH+]1 ZINC001239822413 980967878 /nfs/dbraw/zinc/96/78/78/980967878.db2.gz HMCSBWGXJWZTBH-UHFFFAOYSA-N 1 2 242.257 2.426 20 0 BEADLO C[C@H]([NH2+]Cc1ncn[nH]1)[C@@H]1CCC[C@H](C)C1 ZINC001347122097 980980568 /nfs/dbraw/zinc/98/05/68/980980568.db2.gz VXGHEVCKOKRGFR-GARJFASQSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@@H]1CCCCN(C(=O)CCc2[nH+]ccn2C)C1 ZINC001347163199 981000473 /nfs/dbraw/zinc/00/04/73/981000473.db2.gz UJRUXHBXAKSNDV-GFCCVEGCSA-N 1 2 249.358 2.001 20 0 BEADLO NC(=O)c1ccc(-c2cccc3[nH+]ccn32)cc1 ZINC001239871753 981013403 /nfs/dbraw/zinc/01/34/03/981013403.db2.gz OJAMAZWDZDRAFM-UHFFFAOYSA-N 1 2 237.262 2.100 20 0 BEADLO c1coc(C[N@@H+]2CCC[C@@H]2c2ncccn2)c1 ZINC001203289956 981079614 /nfs/dbraw/zinc/07/96/14/981079614.db2.gz PJWRNEPZFNSXHR-GFCCVEGCSA-N 1 2 229.283 2.407 20 0 BEADLO c1coc(C[N@H+]2CCC[C@@H]2c2ncccn2)c1 ZINC001203289956 981079619 /nfs/dbraw/zinc/07/96/19/981079619.db2.gz PJWRNEPZFNSXHR-GFCCVEGCSA-N 1 2 229.283 2.407 20 0 BEADLO CC(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001347537530 981110514 /nfs/dbraw/zinc/11/05/14/981110514.db2.gz XYVICZWOCVCLPT-LBPRGKRZSA-N 1 2 249.358 2.364 20 0 BEADLO Cc1n[nH]c(C)c1-c1cc(-n2cc[nH+]c2)ccn1 ZINC001240123562 981117435 /nfs/dbraw/zinc/11/74/35/981117435.db2.gz KWUAWUOZBMZVNT-UHFFFAOYSA-N 1 2 239.282 2.274 20 0 BEADLO Cc1ccc(C)c(C[NH+]2CC(C)(N(C)C)C2)c1 ZINC001203749673 981124335 /nfs/dbraw/zinc/12/43/35/981124335.db2.gz REHRMLZPORUFBF-UHFFFAOYSA-N 1 2 232.371 2.439 20 0 BEADLO Cc1n[nH]c(C)c1-c1ccc2[nH+]ccn2c1 ZINC001240126372 981125728 /nfs/dbraw/zinc/12/57/28/981125728.db2.gz VOXZBIXVGQJTLG-UHFFFAOYSA-N 1 2 212.256 2.341 20 0 BEADLO Cc1n[nH]c(C)c1-c1cc[nH+]c2c1CCN2 ZINC001240128352 981127620 /nfs/dbraw/zinc/12/76/20/981127620.db2.gz VSACEIVFSIXARN-UHFFFAOYSA-N 1 2 214.272 2.057 20 0 BEADLO C(=C/C1CC1)\CNc1cc(N2CCCC2)nc[nH+]1 ZINC001347634537 981133580 /nfs/dbraw/zinc/13/35/80/981133580.db2.gz QFMIKCDWTUZMSZ-ONEGZZNKSA-N 1 2 244.342 2.455 20 0 BEADLO C(=C/C1CC1)\CNc1cc(N2CCCC2)[nH+]cn1 ZINC001347634537 981133583 /nfs/dbraw/zinc/13/35/83/981133583.db2.gz QFMIKCDWTUZMSZ-ONEGZZNKSA-N 1 2 244.342 2.455 20 0 BEADLO COc1cc(-c2ccc3[nH+]ccn3c2)nc(C)n1 ZINC001240214201 981160718 /nfs/dbraw/zinc/16/07/18/981160718.db2.gz KZKQVLIMRMDGCN-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO Cn1cnc2cnc(-c3ccc4[nH+]ccn4c3)cc21 ZINC001240214403 981161147 /nfs/dbraw/zinc/16/11/47/981161147.db2.gz NJHJHEHQEBTFRP-UHFFFAOYSA-N 1 2 249.277 2.283 20 0 BEADLO Cc1cc(-c2ccc3[nH+]ccn3c2)nc(C)n1 ZINC001240214280 981161443 /nfs/dbraw/zinc/16/14/43/981161443.db2.gz NISZUVMDQLMWNP-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO COc1ccnc(-c2ccc3[nH+]ccn3c2)c1 ZINC001240215851 981164533 /nfs/dbraw/zinc/16/45/33/981164533.db2.gz XMTKJIFOATWZHY-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO c1cn2cc(-c3cc4cncnc4cn3)ccc2[nH+]1 ZINC001240214565 981165095 /nfs/dbraw/zinc/16/50/95/981165095.db2.gz NPKAXKVNBXMPME-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO COc1c(C)ncnc1-c1ccc2[nH+]ccn2c1 ZINC001240217122 981166097 /nfs/dbraw/zinc/16/60/97/981166097.db2.gz BZZZIZLZIHYFKP-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO c1cn2cc(-c3cnc4nccnc4c3)ccc2[nH+]1 ZINC001240218073 981166832 /nfs/dbraw/zinc/16/68/32/981166832.db2.gz ZIPHTVPURSIGPV-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO S=c1ccc(-c2ccc3[nH+]ccn3c2)n[nH]1 ZINC001240217018 981167906 /nfs/dbraw/zinc/16/79/06/981167906.db2.gz XHQSTUTXVCCMGJ-UHFFFAOYSA-N 1 2 228.280 2.080 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@H](C)C1CCC1 ZINC001347973712 981231910 /nfs/dbraw/zinc/23/19/10/981231910.db2.gz VXXMKODBMQIMJM-SNVBAGLBSA-N 1 2 236.315 2.382 20 0 BEADLO CCN(C)C(=O)c1ccc(-c2c[nH+]cn2C)cc1 ZINC001240282557 981236404 /nfs/dbraw/zinc/23/64/04/981236404.db2.gz MJQSFBQLBXFRQW-UHFFFAOYSA-N 1 2 243.310 2.179 20 0 BEADLO CC(C)C[C@H]1CCCCN1c1cc(N)nc[nH+]1 ZINC001348031368 981251225 /nfs/dbraw/zinc/25/12/25/981251225.db2.gz LCTFEACEFBZFJT-LLVKDONJSA-N 1 2 234.347 2.464 20 0 BEADLO Cc1cn2c(cccc2-c2cn(C)nc2C)[nH+]1 ZINC001240300839 981260499 /nfs/dbraw/zinc/26/04/99/981260499.db2.gz ANHUEXSDEAVXTD-UHFFFAOYSA-N 1 2 226.283 2.352 20 0 BEADLO Cn1c[nH+]cc1-c1ccnc2ccncc21 ZINC001250504890 981267851 /nfs/dbraw/zinc/26/78/51/981267851.db2.gz XIJKAYHCLYYSLC-UHFFFAOYSA-N 1 2 210.240 2.030 20 0 BEADLO C[C@@H](C(=O)N(C)C1CCC(C)CC1)n1cc[nH+]c1 ZINC000078871596 981268639 /nfs/dbraw/zinc/26/86/39/981268639.db2.gz APFYKXIPXMXWRA-CPCZMJQVSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1nn(C)cc1-c1ccc2[nH+]ccn2c1C ZINC001240303313 981270939 /nfs/dbraw/zinc/27/09/39/981270939.db2.gz CUIITPFOWHFHBV-UHFFFAOYSA-N 1 2 226.283 2.352 20 0 BEADLO C[C@@H]1CN(c2cc(N)nc[nH+]2)[C@H]2CCCC[C@H]12 ZINC001348084415 981277933 /nfs/dbraw/zinc/27/79/33/981277933.db2.gz OJFIMZGRCOGLTM-MXWKQRLJSA-N 1 2 232.331 2.074 20 0 BEADLO Nc1cc(-c2cccc3n[nH]cc32)cc[nH+]1 ZINC001240313695 981283320 /nfs/dbraw/zinc/28/33/20/981283320.db2.gz QAOQXFGITYIWDF-UHFFFAOYSA-N 1 2 210.240 2.207 20 0 BEADLO Cc1cn2c(cccc2-c2ccc3ncnn3c2)[nH+]1 ZINC001240354906 981310466 /nfs/dbraw/zinc/31/04/66/981310466.db2.gz PLDSSXNESHIJKF-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO Cc1cn2cc(-c3cnn(C)c3C)ccc2[nH+]1 ZINC001240381694 981341942 /nfs/dbraw/zinc/34/19/42/981341942.db2.gz GSTHQWUTLNAAFP-UHFFFAOYSA-N 1 2 226.283 2.352 20 0 BEADLO Cc1cc(NCC(C)(C)[C@@H](C)O)nc(C2CC2)[nH+]1 ZINC001348388014 981353007 /nfs/dbraw/zinc/35/30/07/981353007.db2.gz QPSKIAGNUADFDI-SNVBAGLBSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1cnc2ccnn2c1 ZINC001240429709 981380829 /nfs/dbraw/zinc/38/08/29/981380829.db2.gz ZGMWXMVKEQHKAB-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO Cn1cc(Nc2[nH+]c3ccccc3n2C)cn1 ZINC000079044409 981393065 /nfs/dbraw/zinc/39/30/65/981393065.db2.gz HFXCBOQGSDHEHQ-UHFFFAOYSA-N 1 2 227.271 2.050 20 0 BEADLO Cc1cnc(-c2ccn3cc[nH+]c3c2)cn1 ZINC001240495905 981414939 /nfs/dbraw/zinc/41/49/39/981414939.db2.gz CDUFGTYPHCCZFQ-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO Cn1cnc2cnc(-c3ccn4cc[nH+]c4c3)cc21 ZINC001240496194 981415939 /nfs/dbraw/zinc/41/59/39/981415939.db2.gz HPILKERZCHTXSA-UHFFFAOYSA-N 1 2 249.277 2.283 20 0 BEADLO c1cn2ccc(-c3ccc4nc[nH]c4n3)cc2[nH+]1 ZINC001240496824 981417018 /nfs/dbraw/zinc/41/70/18/981417018.db2.gz PTQCALALOBVICB-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO c1cn2ccc(-c3nccc4nccnc43)cc2[nH+]1 ZINC001240497148 981418563 /nfs/dbraw/zinc/41/85/63/981418563.db2.gz ZKEVEKPWRNTYMR-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO Cn1ccc2nc(-c3ccn4cc[nH+]c4c3)ncc21 ZINC001240497543 981418950 /nfs/dbraw/zinc/41/89/50/981418950.db2.gz SMEHWCNNRJQUKR-UHFFFAOYSA-N 1 2 249.277 2.283 20 0 BEADLO Cc1nccnc1-c1ccn2cc[nH+]c2c1 ZINC001240496377 981419441 /nfs/dbraw/zinc/41/94/41/981419441.db2.gz LELPYFGDYOLDFE-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO C[C@@H](NC(=O)CCc1[nH+]ccn1C)C1CCCC1 ZINC001348717733 981427149 /nfs/dbraw/zinc/42/71/49/981427149.db2.gz SEOAHQMPFOLJMA-LLVKDONJSA-N 1 2 249.358 2.048 20 0 BEADLO c1cn2ccc(-c3cccc4nncn43)cc2[nH+]1 ZINC001240509057 981434303 /nfs/dbraw/zinc/43/43/03/981434303.db2.gz PMLURJZZODMSEC-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO c1cn2ccc(-c3ccc4nncn4c3)cc2[nH+]1 ZINC001240508878 981434409 /nfs/dbraw/zinc/43/44/09/981434409.db2.gz NWMXQDNANYYJBR-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO COC(=O)N[C@@H](C)c1c[nH+]c2c(C)cccn12 ZINC001193934135 981496371 /nfs/dbraw/zinc/49/63/71/981496371.db2.gz KVTMDSHZULCDKL-VIFPVBQESA-N 1 2 233.271 2.060 20 0 BEADLO COc1cc(-c2nc3[nH]ccc3c[nH+]2)ccc1O ZINC001240609999 981504142 /nfs/dbraw/zinc/50/41/42/981504142.db2.gz HTDAGSREWLUXCT-UHFFFAOYSA-N 1 2 241.250 2.291 20 0 BEADLO CNc1cc(-c2cnc(OC)c(OC)c2)cc[nH+]1 ZINC001240622431 981517535 /nfs/dbraw/zinc/51/75/35/981517535.db2.gz UGYVRBWXXCWBKA-UHFFFAOYSA-N 1 2 245.282 2.203 20 0 BEADLO CCCOC(=O)Nc1ccc2[nH+]ccn2c1 ZINC001194095115 981572255 /nfs/dbraw/zinc/57/22/55/981572255.db2.gz PKSXHBPEADLDMO-UHFFFAOYSA-N 1 2 219.244 2.293 20 0 BEADLO CCCCCCOC(=O)N(CC)C1C[NH+](C)C1 ZINC001194180291 981589032 /nfs/dbraw/zinc/58/90/32/981589032.db2.gz BSSKQFWZYLQOBY-UHFFFAOYSA-N 1 2 242.363 2.339 20 0 BEADLO CCCn1cncc1C[NH2+]Cc1nccs1 ZINC000085186422 981642205 /nfs/dbraw/zinc/64/22/05/981642205.db2.gz WNKREUWCLOCODI-UHFFFAOYSA-N 1 2 236.344 2.039 20 0 BEADLO CCCSCC(=O)Nc1c(C)c[nH+]cc1C ZINC001349791531 981744058 /nfs/dbraw/zinc/74/40/58/981744058.db2.gz JVIDTPAWNCUGEY-UHFFFAOYSA-N 1 2 238.356 2.202 20 0 BEADLO CCO[C@@H](C)n1cc(/C(C)=C/C=C/[NH3+])cn1 ZINC001240755915 981808306 /nfs/dbraw/zinc/80/83/06/981808306.db2.gz POGAROAXYXMICV-DGVNLBILSA-N 1 2 221.304 2.314 20 0 BEADLO FC1CC[NH+](Cn2cccnc2=S)CC1 ZINC001349927238 981818799 /nfs/dbraw/zinc/81/87/99/981818799.db2.gz CCGRLFYTLXSKBC-UHFFFAOYSA-N 1 2 227.308 2.004 20 0 BEADLO Cn1ccc2cc(-c3cc[nH+]c(N)c3)cnc21 ZINC001240835410 981878856 /nfs/dbraw/zinc/87/88/56/981878856.db2.gz JWHXXYLXWQOCRU-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO Cc1cc(NC(=O)CCF)ccc1-n1cc[nH+]c1 ZINC001584953119 981893766 /nfs/dbraw/zinc/89/37/66/981893766.db2.gz OSUDWAFVDAPUSZ-UHFFFAOYSA-N 1 2 247.273 2.479 20 0 BEADLO CCn1c[nH+]cc1COC(=O)C1CCCC1 ZINC001350332052 981930572 /nfs/dbraw/zinc/93/05/72/981930572.db2.gz BBVXUWPZIWQMSJ-UHFFFAOYSA-N 1 2 222.288 2.136 20 0 BEADLO Cc1ccccc1C(C)(C)[NH2+]Cc1nnc[nH]1 ZINC001350378503 981952575 /nfs/dbraw/zinc/95/25/75/981952575.db2.gz XOPQSILIYACUJZ-UHFFFAOYSA-N 1 2 230.315 2.138 20 0 BEADLO Cc1cn2cc(NC(=O)OCCF)ccc2[nH+]1 ZINC001194937076 981976015 /nfs/dbraw/zinc/97/60/15/981976015.db2.gz CAEQNHCSSZIENQ-UHFFFAOYSA-N 1 2 237.234 2.161 20 0 BEADLO COc1cc(C)[nH+]cc1-c1cnn2cccnc12 ZINC001240932405 982006942 /nfs/dbraw/zinc/00/69/42/982006942.db2.gz ZXNBGHRCXAEFNV-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO Cc1cc(-c2cnn3cccnc23)c2[nH+]ccn2c1 ZINC001240932062 982008103 /nfs/dbraw/zinc/00/81/03/982008103.db2.gz SAGJMYHDVMQQBG-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO COCc1ccc(-c2c[nH+]cn2C)cc1 ZINC001240950774 982022760 /nfs/dbraw/zinc/02/27/60/982022760.db2.gz NLNKOHLQLLHZRR-UHFFFAOYSA-N 1 2 202.257 2.234 20 0 BEADLO Nc1ccc(-c2ccc3occc(=O)c3c2)c[nH+]1 ZINC001240967965 982048034 /nfs/dbraw/zinc/04/80/34/982048034.db2.gz JECNIHHYKIQRTD-UHFFFAOYSA-N 1 2 238.246 2.437 20 0 BEADLO Cc1cn2c(cccc2-c2ccn(C)c(=O)c2)[nH+]1 ZINC001240986121 982070157 /nfs/dbraw/zinc/07/01/57/982070157.db2.gz MMSYPFYGMSDODD-UHFFFAOYSA-N 1 2 239.278 2.008 20 0 BEADLO CN(C)C(=O)[C@H]1CC[C@@H](Nc2cccc[nH+]2)CC1 ZINC001588151194 982118610 /nfs/dbraw/zinc/11/86/10/982118610.db2.gz WSWLSKGDDQISPH-TXEJJXNPSA-N 1 2 247.342 2.141 20 0 BEADLO CC[C@@H](C)OC(=O)NCc1ccc2[nH+]ccn2c1 ZINC001195162645 982144667 /nfs/dbraw/zinc/14/46/67/982144667.db2.gz SUYZXIIFLFTSPV-SNVBAGLBSA-N 1 2 247.298 2.359 20 0 BEADLO CNc1cc(-c2ccc(O)cc2)cc[nH+]1 ZINC001241063863 982177131 /nfs/dbraw/zinc/17/71/31/982177131.db2.gz CSTAABOHGPBJOV-UHFFFAOYSA-N 1 2 200.241 2.496 20 0 BEADLO O=c1[nH]cccc1-c1cc(-n2cc[nH+]c2)ccn1 ZINC001241107732 982216544 /nfs/dbraw/zinc/21/65/44/982216544.db2.gz ZKEBLTSCUVRZTD-UHFFFAOYSA-N 1 2 238.250 2.035 20 0 BEADLO Nc1cc(-c2ccc3c(c2)C(=O)OC3)cc[nH+]1 ZINC001241161944 982298007 /nfs/dbraw/zinc/29/80/07/982298007.db2.gz BPYQFUDHDYKHKC-UHFFFAOYSA-N 1 2 226.235 2.001 20 0 BEADLO Nc1cc(-c2ccc(=S)[nH]c2)cc[nH+]1 ZINC001241161988 982299013 /nfs/dbraw/zinc/29/90/13/982299013.db2.gz DPZWFHOWCMBJCJ-UHFFFAOYSA-N 1 2 203.270 2.015 20 0 BEADLO CCOc1cc(-c2cc[nH+]c(N)c2)ccn1 ZINC001241162296 982300644 /nfs/dbraw/zinc/30/06/44/982300644.db2.gz FATOHBSKXDARQA-UHFFFAOYSA-N 1 2 215.256 2.125 20 0 BEADLO COC(=O)c1ccccc1-c1cc[nH+]c(N)c1 ZINC001241162133 982300859 /nfs/dbraw/zinc/30/08/59/982300859.db2.gz CKHYGEXNTMADDO-UHFFFAOYSA-N 1 2 228.251 2.117 20 0 BEADLO Cc1cc(F)ncc1-c1cc[nH+]c(N)c1 ZINC001241163343 982302198 /nfs/dbraw/zinc/30/21/98/982302198.db2.gz LYJHFCJKONUGKB-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO COC(=O)Cc1cccc(-c2cc[nH+]c(N)c2)c1 ZINC001241162856 982304119 /nfs/dbraw/zinc/30/41/19/982304119.db2.gz NPBSJSCDZANKCF-UHFFFAOYSA-N 1 2 242.278 2.046 20 0 BEADLO COC(=O)Cc1ccccc1-c1cc[nH+]c(N)c1 ZINC001241163898 982308558 /nfs/dbraw/zinc/30/85/58/982308558.db2.gz UDWCWYUMKAEMPY-UHFFFAOYSA-N 1 2 242.278 2.046 20 0 BEADLO CC(=O)Oc1cccc(-c2cc[nH+]c(N)c2)c1 ZINC001241170060 982310247 /nfs/dbraw/zinc/31/02/47/982310247.db2.gz COZAGEYOAPGNCK-UHFFFAOYSA-N 1 2 228.251 2.256 20 0 BEADLO Nc1noc2cc(-c3cc[nH+]c(N)c3)ccc12 ZINC001241169484 982311089 /nfs/dbraw/zinc/31/10/89/982311089.db2.gz BFLWGBUNKWXPGV-UHFFFAOYSA-N 1 2 226.239 2.054 20 0 BEADLO Cc1cc2nccn2cc1-c1cc[nH+]c(N)c1 ZINC001241170670 982316101 /nfs/dbraw/zinc/31/61/01/982316101.db2.gz OKSRLOPTDDFFTQ-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1ccnc(N)c1 ZINC001241170670 982316113 /nfs/dbraw/zinc/31/61/13/982316113.db2.gz OKSRLOPTDDFFTQ-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO Nc1cc(-c2cnc3[nH]cc(F)c3c2)cc[nH+]1 ZINC001241170142 982318478 /nfs/dbraw/zinc/31/84/78/982318478.db2.gz FDCWRVCDRAKBCS-UHFFFAOYSA-N 1 2 228.230 2.346 20 0 BEADLO COc1ccc(-c2cc[nH+]c(N)c2)c(OC)c1F ZINC001241175536 982321563 /nfs/dbraw/zinc/32/15/63/982321563.db2.gz FTHKKPNSQKUIHF-UHFFFAOYSA-N 1 2 248.257 2.487 20 0 BEADLO CC1(C)CNc2cc(-c3cc[nH+]c(N)c3)cnc21 ZINC001241176242 982328023 /nfs/dbraw/zinc/32/80/23/982328023.db2.gz WSMCZRKGMNSKPK-UHFFFAOYSA-N 1 2 240.310 2.429 20 0 BEADLO CCC(=O)Nc1cc(-c2cc[nH+]c(N)c2)ccn1 ZINC001241175879 982328471 /nfs/dbraw/zinc/32/84/71/982328471.db2.gz PISINXWWJNBQAP-UHFFFAOYSA-N 1 2 242.282 2.074 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1ncc(N)cc1F ZINC001241233157 982385221 /nfs/dbraw/zinc/38/52/21/982385221.db2.gz GSKASXOPMJGIOY-UHFFFAOYSA-N 1 2 246.289 2.239 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1cnc(F)cn1 ZINC001241248507 982390359 /nfs/dbraw/zinc/39/03/59/982390359.db2.gz NVQPDAXLSVEKNI-UHFFFAOYSA-N 1 2 232.262 2.052 20 0 BEADLO C[C@H](C(=O)N1CC[C@@H]1C1CCCC1)n1cc[nH+]c1 ZINC001351842118 982399344 /nfs/dbraw/zinc/39/93/44/982399344.db2.gz JLMSCHHZXPHSEE-DGCLKSJQSA-N 1 2 247.342 2.235 20 0 BEADLO Nc1cn2ccc(-c3cc(O)cc(F)c3)cc2[nH+]1 ZINC001241267057 982403105 /nfs/dbraw/zinc/40/31/05/982403105.db2.gz SKADGCZBVAVKOO-UHFFFAOYSA-N 1 2 243.241 2.428 20 0 BEADLO CC[N@H+](Cc1c(Cl)c(C)nn1C)C1CC1 ZINC001351947274 982413370 /nfs/dbraw/zinc/41/33/70/982413370.db2.gz CCMKHMULKHBWJO-UHFFFAOYSA-N 1 2 227.739 2.366 20 0 BEADLO CC[N@@H+](Cc1c(Cl)c(C)nn1C)C1CC1 ZINC001351947274 982413374 /nfs/dbraw/zinc/41/33/74/982413374.db2.gz CCMKHMULKHBWJO-UHFFFAOYSA-N 1 2 227.739 2.366 20 0 BEADLO CCc1cc(N(C)[C@H]2C[C@@H](OC)C2)nc(CC)[nH+]1 ZINC001352015776 982438374 /nfs/dbraw/zinc/43/83/74/982438374.db2.gz JNSLFMUKWXCXAA-TXEJJXNPSA-N 1 2 249.358 2.215 20 0 BEADLO CC[C@H](C)C[C@@H](C)NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC000080691989 982487537 /nfs/dbraw/zinc/48/75/37/982487537.db2.gz NEZJMMYIHAFUEI-QJPTWQEYSA-N 1 2 237.347 2.385 20 0 BEADLO CN(C)c1ccc(-c2cccc3[nH+]ccn32)cn1 ZINC001241370393 982532149 /nfs/dbraw/zinc/53/21/49/982532149.db2.gz LQEJBSSIJJCEDX-UHFFFAOYSA-N 1 2 238.294 2.462 20 0 BEADLO Nc1cc(-c2cnc3cccnc3c2)cc[nH+]1 ZINC001241382792 982542607 /nfs/dbraw/zinc/54/26/07/982542607.db2.gz HPMPRLXADRYLHQ-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2nccnc2c1 ZINC001241490433 982644225 /nfs/dbraw/zinc/64/42/25/982644225.db2.gz CSFWHLOEZXWKJU-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OCCOCC1CC1 ZINC001353003947 982661977 /nfs/dbraw/zinc/66/19/77/982661977.db2.gz UDGQCSOMXTTZHL-UHFFFAOYSA-N 1 2 248.326 2.268 20 0 BEADLO Fc1cccnc1-c1cc(-n2cc[nH+]c2)ccn1 ZINC001241534030 982702129 /nfs/dbraw/zinc/70/21/29/982702129.db2.gz AUUMDRWTODCUKI-UHFFFAOYSA-N 1 2 240.241 2.468 20 0 BEADLO Nc1cn2ccc(-c3ncccc3F)cc2[nH+]1 ZINC001241534521 982703075 /nfs/dbraw/zinc/70/30/75/982703075.db2.gz KHBFVFFQRZCFHJ-UHFFFAOYSA-N 1 2 228.230 2.118 20 0 BEADLO Cn1ccc2c[nH+]c(-c3ccc(N)cc3)nc21 ZINC001241538140 982710666 /nfs/dbraw/zinc/71/06/66/982710666.db2.gz XQKFPSZDXCAQAQ-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO Cc1[nH+]c(N)ccc1-c1ncccc1F ZINC001241540651 982724893 /nfs/dbraw/zinc/72/48/93/982724893.db2.gz QVKNUZYKFJOQEO-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO CCOc1ncc(-c2ccn3cc[nH+]c3c2)cn1 ZINC001241552092 982769457 /nfs/dbraw/zinc/76/94/57/982769457.db2.gz UWEXQFJSRRPLQV-UHFFFAOYSA-N 1 2 240.266 2.190 20 0 BEADLO Cc1cc2c[nH+]c(-c3ccc(CO)cc3)nc2[nH]1 ZINC001241556432 982776437 /nfs/dbraw/zinc/77/64/37/982776437.db2.gz OYZKDTVQQGJSOG-UHFFFAOYSA-N 1 2 239.278 2.377 20 0 BEADLO Cn1cc2c(cccc2-c2cc[nH+]c(N)c2)n1 ZINC001241582256 982828494 /nfs/dbraw/zinc/82/84/94/982828494.db2.gz WVYAPJPBNHHJER-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO CCNC(=O)c1ccc(-c2ccc[nH+]c2N)cc1 ZINC001241616184 982852359 /nfs/dbraw/zinc/85/23/59/982852359.db2.gz CUKMXMRSKLZRPK-UHFFFAOYSA-N 1 2 241.294 2.081 20 0 BEADLO Cc1ncc(-c2cccc3[nH+]ccn32)cn1 ZINC001205853036 982866721 /nfs/dbraw/zinc/86/67/21/982866721.db2.gz FEMNEOJRVFYEKY-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccncc2C)n(C)n1 ZINC001205857516 982893192 /nfs/dbraw/zinc/89/31/92/982893192.db2.gz FYRKUMAJGOKTBZ-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccncc2C)n(C)n1 ZINC001205857516 982893195 /nfs/dbraw/zinc/89/31/95/982893195.db2.gz FYRKUMAJGOKTBZ-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1n[nH]c(C[N@H+]2C[C@H](C)OC(C)(C)C2)c1C ZINC001353582380 982896868 /nfs/dbraw/zinc/89/68/68/982896868.db2.gz SNRSAXBACWUGIK-VIFPVBQESA-N 1 2 237.347 2.026 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2C[C@H](C)OC(C)(C)C2)c1C ZINC001353582380 982896871 /nfs/dbraw/zinc/89/68/71/982896871.db2.gz SNRSAXBACWUGIK-VIFPVBQESA-N 1 2 237.347 2.026 20 0 BEADLO COCCOc1ccc(-c2ccc(N)[nH+]c2)cc1 ZINC001241748159 983032230 /nfs/dbraw/zinc/03/22/30/983032230.db2.gz ASRHDUKYEMEPIN-UHFFFAOYSA-N 1 2 244.294 2.356 20 0 BEADLO CCc1cc(NC(=S)N[C@H](C)CC)cc[nH+]1 ZINC001200475174 983039202 /nfs/dbraw/zinc/03/92/02/983039202.db2.gz OVIOWEZDHHTVNC-SECBINFHSA-N 1 2 237.372 2.151 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1CC[C@@H]1C(C)(C)C ZINC001353979574 983106533 /nfs/dbraw/zinc/10/65/33/983106533.db2.gz VPEATUXGFXNESD-CMPLNLGQSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1CC[C@@H]1C(C)(C)C ZINC001353979574 983106542 /nfs/dbraw/zinc/10/65/42/983106542.db2.gz VPEATUXGFXNESD-CMPLNLGQSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CC[C@H]1C(C)(C)C ZINC001353979578 983107637 /nfs/dbraw/zinc/10/76/37/983107637.db2.gz VPEATUXGFXNESD-PWSUYJOCSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CC[C@H]1C(C)(C)C ZINC001353979578 983107640 /nfs/dbraw/zinc/10/76/40/983107640.db2.gz VPEATUXGFXNESD-PWSUYJOCSA-N 1 2 249.358 2.235 20 0 BEADLO CC(C)(C)NC(=S)Nc1ccc2[nH+]ccn2c1 ZINC001200897523 983110250 /nfs/dbraw/zinc/11/02/50/983110250.db2.gz RGHSVWQISCJBPP-UHFFFAOYSA-N 1 2 248.355 2.419 20 0 BEADLO Cc1cc(-c2cnn(C3CC3)c2)c[nH+]c1N ZINC001241909832 983122886 /nfs/dbraw/zinc/12/28/86/983122886.db2.gz QFTZOTLWGQSNEF-UHFFFAOYSA-N 1 2 214.272 2.171 20 0 BEADLO Cc1cnn(CC2CC2)c1Nc1ccc(N)[nH+]c1 ZINC001201279703 983157895 /nfs/dbraw/zinc/15/78/95/983157895.db2.gz UEJUOLAPYNNWLA-UHFFFAOYSA-N 1 2 243.314 2.322 20 0 BEADLO Nc1ccc(Nc2cc(F)nc(F)c2F)c[nH+]1 ZINC001201279522 983158964 /nfs/dbraw/zinc/15/89/64/983158964.db2.gz WVRMFHCRIYOWHI-UHFFFAOYSA-N 1 2 240.188 2.220 20 0 BEADLO c1[nH+]cn2cc(-c3ccc4[nH]nnc4c3)ccc12 ZINC001241941721 983159877 /nfs/dbraw/zinc/15/98/77/983159877.db2.gz JYHARBPHWAHLMP-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO c1[nH+]cn2cc(-c3ccc4nn[nH]c4c3)ccc12 ZINC001241941721 983159882 /nfs/dbraw/zinc/15/98/82/983159882.db2.gz JYHARBPHWAHLMP-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO CC(=O)c1cccc(Nc2ccc(N)[nH+]c2)c1O ZINC001201286043 983160436 /nfs/dbraw/zinc/16/04/36/983160436.db2.gz VEYHMYRBLXBQOG-UHFFFAOYSA-N 1 2 243.266 2.316 20 0 BEADLO COC[C@@H]1CCN(c2cc(F)cc(C)[nH+]2)C1 ZINC001354110637 983160647 /nfs/dbraw/zinc/16/06/47/983160647.db2.gz ULYPGANPJJSVKI-SNVBAGLBSA-N 1 2 224.279 2.002 20 0 BEADLO Nc1ccc(Nc2ccc(F)c(O)c2)c[nH+]1 ZINC001201286891 983164156 /nfs/dbraw/zinc/16/41/56/983164156.db2.gz GKNQJECDNMHKIU-UHFFFAOYSA-N 1 2 219.219 2.252 20 0 BEADLO Nc1ccc(Nc2cc(CO)ccc2F)c[nH+]1 ZINC001201287202 983165652 /nfs/dbraw/zinc/16/56/52/983165652.db2.gz YUFVSYHHRMQPTM-UHFFFAOYSA-N 1 2 233.246 2.039 20 0 BEADLO Nc1ccc(Nc2cccc3c2COC3)c[nH+]1 ZINC001201291204 983168460 /nfs/dbraw/zinc/16/84/60/983168460.db2.gz FTXLGKNSGWTBQZ-UHFFFAOYSA-N 1 2 227.267 2.438 20 0 BEADLO Cc1cc(N)c(F)cc1Nc1ccc(N)[nH+]c1 ZINC001201291086 983170004 /nfs/dbraw/zinc/17/00/04/983170004.db2.gz ALIINUWUXNJFLI-UHFFFAOYSA-N 1 2 232.262 2.437 20 0 BEADLO Nc1ccc(Nc2ccc3c(c2)OCC3)c[nH+]1 ZINC001201291802 983170023 /nfs/dbraw/zinc/17/00/23/983170023.db2.gz CQTSYAILEMJKPW-UHFFFAOYSA-N 1 2 227.267 2.342 20 0 BEADLO Nc1ccc(Nc2c(F)cc(O)cc2F)c[nH+]1 ZINC001201291120 983170071 /nfs/dbraw/zinc/17/00/71/983170071.db2.gz BICXRWKVXXWNGY-UHFFFAOYSA-N 1 2 237.209 2.391 20 0 BEADLO Nc1ccc(-n2ccc3c2cc(F)cc3N)c[nH+]1 ZINC001201292526 983170240 /nfs/dbraw/zinc/17/02/40/983170240.db2.gz ZGLZCCPTQJSAEY-UHFFFAOYSA-N 1 2 242.257 2.329 20 0 BEADLO Nc1ccc(Nc2ncc3ccccc3n2)c[nH+]1 ZINC001201272709 983172571 /nfs/dbraw/zinc/17/25/71/983172571.db2.gz TXEJLFWHYWIZGD-UHFFFAOYSA-N 1 2 237.266 2.351 20 0 BEADLO Cc1cc(F)ncc1Nc1ccc(N)[nH+]c1 ZINC001201271772 983173798 /nfs/dbraw/zinc/17/37/98/983173798.db2.gz BNICAYVPPBUEAR-UHFFFAOYSA-N 1 2 218.235 2.250 20 0 BEADLO Cn1nc(C2CC2)cc1Nc1ccc(N)[nH+]c1 ZINC001201272370 983174027 /nfs/dbraw/zinc/17/40/27/983174027.db2.gz LVZWMJRKSDNRIQ-UHFFFAOYSA-N 1 2 229.287 2.018 20 0 BEADLO Cc1nc(Cl)ncc1Nc1ccc(N)[nH+]c1 ZINC001201276621 983175927 /nfs/dbraw/zinc/17/59/27/983175927.db2.gz YMPKKNPOZUHSFI-UHFFFAOYSA-N 1 2 235.678 2.159 20 0 BEADLO Cc1ncc(Nc2ccc(N)[nH+]c2)s1 ZINC001201278372 983179062 /nfs/dbraw/zinc/17/90/62/983179062.db2.gz INADYRCMFPUFMT-UHFFFAOYSA-N 1 2 206.274 2.172 20 0 BEADLO Cc1cccc(CO)c1Nc1ccc(N)[nH+]c1 ZINC001201295850 983180468 /nfs/dbraw/zinc/18/04/68/983180468.db2.gz ULZMFYWZLGDAIE-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO COC(=O)c1cc(-c2[nH]cc[nH+]2)ccc1C ZINC001242014718 983210710 /nfs/dbraw/zinc/21/07/10/983210710.db2.gz RVCVPEYMQYRIMX-UHFFFAOYSA-N 1 2 216.240 2.172 20 0 BEADLO COC(=O)c1cc(-c2[nH]cc[nH+]2)c(C)cc1C ZINC001242014905 983212201 /nfs/dbraw/zinc/21/22/01/983212201.db2.gz VKBNXVLBMQTPRE-UHFFFAOYSA-N 1 2 230.267 2.480 20 0 BEADLO c1c[nH]c(-c2ccccc2Cn2cc[nH+]c2)n1 ZINC001242017098 983217115 /nfs/dbraw/zinc/21/71/15/983217115.db2.gz BPFUIRRYWWVXSQ-UHFFFAOYSA-N 1 2 224.267 2.322 20 0 BEADLO CC(C)(C)C[N@@H+]1CCO[C@H](C(F)(F)F)C1 ZINC001201443854 983250086 /nfs/dbraw/zinc/25/00/86/983250086.db2.gz WADCVXVAIVZSAN-QMMMGPOBSA-N 1 2 225.254 2.296 20 0 BEADLO CC(C)(C)C[N@H+]1CCO[C@H](C(F)(F)F)C1 ZINC001201443854 983250095 /nfs/dbraw/zinc/25/00/95/983250095.db2.gz WADCVXVAIVZSAN-QMMMGPOBSA-N 1 2 225.254 2.296 20 0 BEADLO COC(=[NH2+])c1cccc(-c2ccnnc2)c1 ZINC001242061296 983275477 /nfs/dbraw/zinc/27/54/77/983275477.db2.gz BNILSPQBPCWMAG-UHFFFAOYSA-N 1 2 213.240 2.115 20 0 BEADLO O=c1ccc(-c2cccc3[nH+]ccn32)c[nH]1 ZINC001242064768 983286702 /nfs/dbraw/zinc/28/67/02/983286702.db2.gz DETVMYPNRHLICR-UHFFFAOYSA-N 1 2 211.224 2.102 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1nccc(NC2CC2)n1 ZINC001242068241 983296923 /nfs/dbraw/zinc/29/69/23/983296923.db2.gz LZTHYGSPOZCGSS-UHFFFAOYSA-N 1 2 241.298 2.004 20 0 BEADLO CCCc1cnc(-c2c[nH+]c(N)cc2C)nc1 ZINC001242070830 983304482 /nfs/dbraw/zinc/30/44/82/983304482.db2.gz MQYBHPUEJXALDB-UHFFFAOYSA-N 1 2 228.299 2.382 20 0 BEADLO Cc1ccc(F)c(-c2c[nH+]c(N)cc2C)n1 ZINC001242070537 983305889 /nfs/dbraw/zinc/30/58/89/983305889.db2.gz BFPUVEDQRLHQGH-UHFFFAOYSA-N 1 2 217.247 2.482 20 0 BEADLO c1cn2c(cccc2C2=CCOCC2)[nH+]1 ZINC001242076499 983320721 /nfs/dbraw/zinc/32/07/21/983320721.db2.gz SZNUUSJXNLGZOI-UHFFFAOYSA-N 1 2 200.241 2.138 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1nccnc1C(F)F ZINC001242078121 983325050 /nfs/dbraw/zinc/32/50/50/983325050.db2.gz RSKJOBRADCOYGT-UHFFFAOYSA-N 1 2 236.225 2.367 20 0 BEADLO Cc1c(C2=CCOCC2)ccc2[nH+]ccn21 ZINC001242079277 983327973 /nfs/dbraw/zinc/32/79/73/983327973.db2.gz WJOGVIIODOWQJF-UHFFFAOYSA-N 1 2 214.268 2.446 20 0 BEADLO COCOc1ccc(-c2cc[nH+]c(N)c2)cc1F ZINC001242114343 983359922 /nfs/dbraw/zinc/35/99/22/983359922.db2.gz RCKSEOVZMXJYKB-UHFFFAOYSA-N 1 2 248.257 2.453 20 0 BEADLO COCOc1ccc(-c2c[nH+]cn2C)cc1F ZINC001242113434 983361844 /nfs/dbraw/zinc/36/18/44/983361844.db2.gz REWMWYNHIJAIGR-UHFFFAOYSA-N 1 2 236.246 2.209 20 0 BEADLO Cc1ncc(C(=O)Nc2c(C)c[nH+]cc2C)s1 ZINC001355035310 983398893 /nfs/dbraw/zinc/39/88/93/983398893.db2.gz LFFUKDDHKWAJAN-UHFFFAOYSA-N 1 2 247.323 2.138 20 0 BEADLO CSC[C@H](C)C(=O)Nc1c(C)c[nH+]cc1C ZINC001355037431 983401054 /nfs/dbraw/zinc/40/10/54/983401054.db2.gz WPBPGCSTBYYZIZ-JTQLQIEISA-N 1 2 238.356 2.058 20 0 BEADLO CCCN1CC[C@@H]([NH+]2CCCC2)C(F)(F)C1 ZINC001201652030 983403437 /nfs/dbraw/zinc/40/34/37/983403437.db2.gz FWWOPYRAPXIIGC-LLVKDONJSA-N 1 2 232.318 2.202 20 0 BEADLO CCc1cc(NCCC(C)(C)O)nc(CC)[nH+]1 ZINC001355275072 983455360 /nfs/dbraw/zinc/45/53/60/983455360.db2.gz RKHNABKWBVVLFX-UHFFFAOYSA-N 1 2 237.347 2.174 20 0 BEADLO CCCC[C@@H](O)CNc1ccn2cc[nH+]c2c1 ZINC001252083935 983457405 /nfs/dbraw/zinc/45/74/05/983457405.db2.gz WQVQGZVNRZUYCO-GFCCVEGCSA-N 1 2 233.315 2.297 20 0 BEADLO FC[C@@H]1CC[N@H+](CC2CC2)CC1(F)F ZINC001201875781 983499511 /nfs/dbraw/zinc/49/95/11/983499511.db2.gz INIDFCZIFROJFN-VIFPVBQESA-N 1 2 207.239 2.323 20 0 BEADLO FC[C@@H]1CC[N@@H+](CC2CC2)CC1(F)F ZINC001201875781 983499534 /nfs/dbraw/zinc/49/95/34/983499534.db2.gz INIDFCZIFROJFN-VIFPVBQESA-N 1 2 207.239 2.323 20 0 BEADLO Cc1cc(C)c(NC(=O)[C@@H]2C[C@H](C)CO2)c(C)[nH+]1 ZINC001355891387 983544261 /nfs/dbraw/zinc/54/42/61/983544261.db2.gz LGLYDQROJWTLQU-UFBFGSQYSA-N 1 2 248.326 2.370 20 0 BEADLO Cc1cc(C)c(NC(=O)[C@H]2C[C@H](C)CO2)c(C)[nH+]1 ZINC001355891386 983546226 /nfs/dbraw/zinc/54/62/26/983546226.db2.gz LGLYDQROJWTLQU-QPUJVOFHSA-N 1 2 248.326 2.370 20 0 BEADLO Cc1cccc(-c2cc[nH+]c(N)c2)c1O ZINC001242345973 983602832 /nfs/dbraw/zinc/60/28/32/983602832.db2.gz GLRFYLFTNQKPGN-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO Cc1ccc(-c2ccc[nH+]c2N)cc1CO ZINC001242383383 983673267 /nfs/dbraw/zinc/67/32/67/983673267.db2.gz HTOIPPHFWGAHQG-UHFFFAOYSA-N 1 2 214.268 2.132 20 0 BEADLO CC(=O)c1ccc(C(C)=CC=C[NH3+])cn1 ZINC001242400177 983680438 /nfs/dbraw/zinc/68/04/38/983680438.db2.gz AHTWJDOXIFBNTC-DDEWIXKASA-N 1 2 202.257 2.160 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1ccn(C)n1 ZINC001242459066 983771780 /nfs/dbraw/zinc/77/17/80/983771780.db2.gz BKKOJUVXSUQWRV-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cccc2c1OCCO2 ZINC001242471561 983797056 /nfs/dbraw/zinc/79/70/56/983797056.db2.gz YAIJXFUJDRQWPB-DROBUMMNSA-N 1 2 217.268 2.334 20 0 BEADLO CN(C)c1cncc(-c2cccc3[nH+]ccn32)c1 ZINC001242529724 983852777 /nfs/dbraw/zinc/85/27/77/983852777.db2.gz ZPPLOIHJAQIVQK-UHFFFAOYSA-N 1 2 238.294 2.462 20 0 BEADLO CC(C)NC(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001202526100 983865243 /nfs/dbraw/zinc/86/52/43/983865243.db2.gz WQPZNWVSSHJLIE-UHFFFAOYSA-N 1 2 244.298 2.402 20 0 BEADLO C[C@H](O)c1cccc(-c2ccc(N)[nH+]c2)c1 ZINC001242550177 983871719 /nfs/dbraw/zinc/87/17/19/983871719.db2.gz NMSPDSIUSPLHIZ-VIFPVBQESA-N 1 2 214.268 2.384 20 0 BEADLO CCC[C@@H](O)CNc1ccccc1-n1cc[nH+]c1 ZINC001252772483 983876821 /nfs/dbraw/zinc/87/68/21/983876821.db2.gz ZTUGNUIWQDJPHN-GFCCVEGCSA-N 1 2 245.326 2.445 20 0 BEADLO Cc1ccc2[nH+]c(NCc3ncc[nH]3)[nH]c2c1 ZINC001560569735 983942257 /nfs/dbraw/zinc/94/22/57/983942257.db2.gz FXMDDDWNVLJBLS-UHFFFAOYSA-N 1 2 227.271 2.207 20 0 BEADLO Cc1ccc(-c2ccn3cc[nH+]c3c2)nn1 ZINC000150318803 983975309 /nfs/dbraw/zinc/97/53/09/983975309.db2.gz JOKFCZAJYPAMAK-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO Cc1cccc2c(C[N@H+](C)CCF)[nH]nc21 ZINC001137152249 983984241 /nfs/dbraw/zinc/98/42/41/983984241.db2.gz LAFQFDPPPPSAKH-UHFFFAOYSA-N 1 2 221.279 2.273 20 0 BEADLO Cc1cccc2c(C[N@@H+](C)CCF)[nH]nc21 ZINC001137152249 983984261 /nfs/dbraw/zinc/98/42/61/983984261.db2.gz LAFQFDPPPPSAKH-UHFFFAOYSA-N 1 2 221.279 2.273 20 0 BEADLO Cc1csc(C[N@H+]2CCc3c(ncn3C)C2)c1 ZINC001137158392 984003241 /nfs/dbraw/zinc/00/32/41/984003241.db2.gz QFKSUDYHEVPISF-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1csc(C[N@@H+]2CCc3c(ncn3C)C2)c1 ZINC001137158392 984003254 /nfs/dbraw/zinc/00/32/54/984003254.db2.gz QFKSUDYHEVPISF-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1csc(CN2CCc3c([nH+]cn3C)C2)c1 ZINC001137158392 984003264 /nfs/dbraw/zinc/00/32/64/984003264.db2.gz QFKSUDYHEVPISF-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO c1nc2c(ccnc2-c2ccc3c(c2)C[NH2+]C3)[nH]1 ZINC001242671503 984037359 /nfs/dbraw/zinc/03/73/59/984037359.db2.gz GRAHWMRRNZXIOR-UHFFFAOYSA-N 1 2 236.278 2.228 20 0 BEADLO CCNC(=O)N[C@@H](C)c1c[nH+]c2c(C)cccn12 ZINC001202557614 984056609 /nfs/dbraw/zinc/05/66/09/984056609.db2.gz XWZNVCKHAWPPLF-JTQLQIEISA-N 1 2 246.314 2.023 20 0 BEADLO Cc1ccc2nc(C[NH+]3CCOCC3)ccc2c1 ZINC001137209769 984172233 /nfs/dbraw/zinc/17/22/33/984172233.db2.gz RRZPBBJCTCTYHD-UHFFFAOYSA-N 1 2 242.322 2.375 20 0 BEADLO CCCCC[C@H](O)CNc1cccc[nH+]1 ZINC001253522403 984192891 /nfs/dbraw/zinc/19/28/91/984192891.db2.gz LORSVGWUPQROAH-NSHDSACASA-N 1 2 208.305 2.435 20 0 BEADLO CCn1ccc(C[NH2+]Cc2ccc(C)c(C)n2)n1 ZINC001202760254 984220101 /nfs/dbraw/zinc/22/01/01/984220101.db2.gz QGFASKWEFZUPFE-UHFFFAOYSA-N 1 2 244.342 2.205 20 0 BEADLO Cc1cc(C)c(NC(=O)[C@@H]2C[C@@H]2F)c(C)[nH+]1 ZINC001434889443 984271752 /nfs/dbraw/zinc/27/17/52/984271752.db2.gz HFPFHHMTSGYGNP-ZJUUUORDSA-N 1 2 222.263 2.303 20 0 BEADLO COc1ccc(-c2ccc[nH+]c2N)c(C)n1 ZINC001242927204 984300585 /nfs/dbraw/zinc/30/05/85/984300585.db2.gz XWDKSSBPNKWVRS-UHFFFAOYSA-N 1 2 215.256 2.043 20 0 BEADLO CCCN(CC(C)C)C(=O)Cc1[nH]c[nH+]c1C ZINC001440800010 984432978 /nfs/dbraw/zinc/43/29/78/984432978.db2.gz VUYRGPYDJNOWEQ-UHFFFAOYSA-N 1 2 237.347 2.155 20 0 BEADLO Cn1c[nH+]cc1-c1ccnc(N2CCCCC2)c1 ZINC001243066481 984478238 /nfs/dbraw/zinc/47/82/38/984478238.db2.gz GQXAJWFJSDKHLN-UHFFFAOYSA-N 1 2 242.326 2.472 20 0 BEADLO CC(=O)Oc1cccc(-c2c[nH+]cn2C)c1 ZINC001243067772 984483409 /nfs/dbraw/zinc/48/34/09/984483409.db2.gz PORXWUOPGZMWQY-UHFFFAOYSA-N 1 2 216.240 2.012 20 0 BEADLO CCOC(=O)c1ccc(-c2c[nH+]cn2C)cc1F ZINC001243068447 984488104 /nfs/dbraw/zinc/48/81/04/984488104.db2.gz XOIOSKYXXJUDEZ-UHFFFAOYSA-N 1 2 248.257 2.403 20 0 BEADLO Cn1c[nH+]cc1-c1cccc2ncncc21 ZINC001243069694 984492732 /nfs/dbraw/zinc/49/27/32/984492732.db2.gz WIMZQXHZBLEWBM-UHFFFAOYSA-N 1 2 210.240 2.030 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2nnc(C3CC3)n2c1 ZINC001243069937 984493511 /nfs/dbraw/zinc/49/35/11/984493511.db2.gz OLOOJIYTNOLIQD-UHFFFAOYSA-N 1 2 239.282 2.007 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2c(c1)COCC2 ZINC001243071093 984497112 /nfs/dbraw/zinc/49/71/12/984497112.db2.gz LKIINNZQRHHCAL-UHFFFAOYSA-N 1 2 214.268 2.160 20 0 BEADLO COC(=O)c1cc(C)c(-c2c[nH+]cn2C)c(C)c1 ZINC001243071090 984498262 /nfs/dbraw/zinc/49/82/62/984498262.db2.gz LDQNKFLLKUBEDP-UHFFFAOYSA-N 1 2 244.294 2.491 20 0 BEADLO Cc1cnc2[nH]ccc2c1-c1c[nH+]cn1C ZINC001243072180 984505959 /nfs/dbraw/zinc/50/59/59/984505959.db2.gz KQGSUGNWRNDQSR-UHFFFAOYSA-N 1 2 212.256 2.223 20 0 BEADLO COc1cccc(-c2cc(N(C)C)cc[nH+]2)n1 ZINC001243098153 984532110 /nfs/dbraw/zinc/53/21/10/984532110.db2.gz VVTDLPCGZCHKLA-UHFFFAOYSA-N 1 2 229.283 2.218 20 0 BEADLO CCOc1ccc[nH+]c1NCCc1cnoc1 ZINC000719331601 984627711 /nfs/dbraw/zinc/62/77/11/984627711.db2.gz OSCKAHRBYINKEG-UHFFFAOYSA-N 1 2 233.271 2.123 20 0 BEADLO Cc1cc(C)c(CNC(=O)c2cc(F)c[nH]2)c[nH+]1 ZINC001451443571 984892741 /nfs/dbraw/zinc/89/27/41/984892741.db2.gz UMGYSHUVOJCDRS-UHFFFAOYSA-N 1 2 247.273 2.096 20 0 BEADLO CC[NH2+]Cc1noc(C2CC3(CCC3)C2)n1 ZINC000691920904 984943095 /nfs/dbraw/zinc/94/30/95/984943095.db2.gz CUSKNZQOTJBOBJ-UHFFFAOYSA-N 1 2 221.304 2.227 20 0 BEADLO Nc1cc(-c2nc3[nH]ccc3c[nH+]2)ccc1F ZINC001243452261 984955625 /nfs/dbraw/zinc/95/56/25/984955625.db2.gz WBCOLUJSZUMNEO-UHFFFAOYSA-N 1 2 228.230 2.298 20 0 BEADLO C[C@@H](NC(=O)[C@H](C)n1cc[nH+]c1)c1ccsc1 ZINC001327188027 984966164 /nfs/dbraw/zinc/96/61/64/984966164.db2.gz OWGRQMBNYYXXHM-ZJUUUORDSA-N 1 2 249.339 2.383 20 0 BEADLO Nc1cc(-c2c[nH+]c3c(c2)CCCN3)ccc1F ZINC001243457491 984979605 /nfs/dbraw/zinc/97/96/05/984979605.db2.gz QFQQCYWRNGCNPE-UHFFFAOYSA-N 1 2 243.285 2.471 20 0 BEADLO CCOC(=O)[C@H](CC(C)(C)F)[NH2+][C@@H](C)CC ZINC001257433426 985005948 /nfs/dbraw/zinc/00/59/48/985005948.db2.gz OHAJOFFPRXCPPD-UWVGGRQHSA-N 1 2 233.327 2.444 20 0 BEADLO COC(=O)c1c(F)cccc1-c1ccc[nH+]c1N ZINC001243472982 985019402 /nfs/dbraw/zinc/01/94/02/985019402.db2.gz DGWUYZHATKPPNY-UHFFFAOYSA-N 1 2 246.241 2.257 20 0 BEADLO CC(C)n1cc(-c2ccc[nH+]c2N)ccc1=O ZINC001243473683 985020379 /nfs/dbraw/zinc/02/03/79/985020379.db2.gz OEHGJQUVDUIOMP-UHFFFAOYSA-N 1 2 229.283 2.073 20 0 BEADLO C[C@@H]1c2ccc(-c3ccc[nH+]c3N)cc2NC1=O ZINC001243474002 985022956 /nfs/dbraw/zinc/02/29/56/985022956.db2.gz HIFIOFAMFAESLZ-MRVPVSSYSA-N 1 2 239.278 2.386 20 0 BEADLO Cc1cc2c(nccc2-c2ccc[nH+]c2N)[nH]1 ZINC001243474075 985022984 /nfs/dbraw/zinc/02/29/84/985022984.db2.gz IZTHSMZAIGTQGB-UHFFFAOYSA-N 1 2 224.267 2.467 20 0 BEADLO Nc1[nH+]cccc1-c1cnc(F)c(F)c1 ZINC001243474772 985027207 /nfs/dbraw/zinc/02/72/07/985027207.db2.gz RLZFKUWFMJAZQP-UHFFFAOYSA-N 1 2 207.183 2.004 20 0 BEADLO Nc1[nH+]cccc1-c1cccc2ncncc21 ZINC001243475364 985028360 /nfs/dbraw/zinc/02/83/60/985028360.db2.gz WXQDZXLARMZPDE-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO Nc1[nH+]cccc1-c1cccc2nccnc21 ZINC001243475373 985029283 /nfs/dbraw/zinc/02/92/83/985029283.db2.gz XPLXDLKPPFCJCT-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO Nc1[nH+]cccc1-c1cccc(N2CCC2=O)c1 ZINC001243474718 985029504 /nfs/dbraw/zinc/02/95/04/985029504.db2.gz ZZQQHZXZHAVQIY-UHFFFAOYSA-N 1 2 239.278 2.068 20 0 BEADLO Cc1c2cc[nH]c2ncc1-c1ccc[nH+]c1N ZINC001243475407 985030844 /nfs/dbraw/zinc/03/08/44/985030844.db2.gz YKEQFDOFHSJSSL-UHFFFAOYSA-N 1 2 224.267 2.467 20 0 BEADLO Nc1[nH+]cccc1-c1cccc2c1NCC2 ZINC001243476869 985039992 /nfs/dbraw/zinc/03/99/92/985039992.db2.gz VXSAIIZGNPGNFW-UHFFFAOYSA-N 1 2 211.268 2.299 20 0 BEADLO Nc1[nH+]cccc1-c1cccc2ncoc21 ZINC001243476468 985040800 /nfs/dbraw/zinc/04/08/00/985040800.db2.gz SIQRRGHEEZQAIV-UHFFFAOYSA-N 1 2 211.224 2.472 20 0 BEADLO Cc1[nH]c([C@H]2CCCN2C(=O)C(C)C)[nH+]c1C ZINC001455762078 985091219 /nfs/dbraw/zinc/09/12/19/985091219.db2.gz KUZOOXWAJUQQNO-LLVKDONJSA-N 1 2 235.331 2.346 20 0 BEADLO COc1cc(C)[nH+]cc1-c1conc1C ZINC001243681468 985196499 /nfs/dbraw/zinc/19/64/99/985196499.db2.gz YYQAXNYUHFBXNT-UHFFFAOYSA-N 1 2 204.229 2.362 20 0 BEADLO Cc1nocc1-c1c[nH+]c2c(c1)CCCN2 ZINC001243680374 985198759 /nfs/dbraw/zinc/19/87/59/985198759.db2.gz KOSCFSMDGBGZOV-UHFFFAOYSA-N 1 2 215.256 2.046 20 0 BEADLO Nc1cc(-c2cccc(CO)c2Cl)cc[nH+]1 ZINC001243706499 985243508 /nfs/dbraw/zinc/24/35/08/985243508.db2.gz FCESAPMNYLLCFI-UHFFFAOYSA-N 1 2 234.686 2.477 20 0 BEADLO CC(=O)OCc1cccc(C)c1-c1c[nH+]cn1C ZINC001243716875 985246294 /nfs/dbraw/zinc/24/62/94/985246294.db2.gz AHEXYVIJNBBJEO-UHFFFAOYSA-N 1 2 244.294 2.459 20 0 BEADLO COc1cc2[nH+]c[nH]c2cc1-c1cccc(=O)[nH]1 ZINC001243737674 985275916 /nfs/dbraw/zinc/27/59/16/985275916.db2.gz JXFYKLYNRIIHQT-UHFFFAOYSA-N 1 2 241.250 2.339 20 0 BEADLO Cc1cncnc1NCc1ccn2cc[nH+]c2c1 ZINC001458302130 985284900 /nfs/dbraw/zinc/28/49/00/985284900.db2.gz YFHCHWMPXWZJPR-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO CCOc1ncc(-c2c[nH+]cn2C)cc1F ZINC001243777634 985311556 /nfs/dbraw/zinc/31/15/56/985311556.db2.gz ULTWITHVCUXVLT-UHFFFAOYSA-N 1 2 221.235 2.020 20 0 BEADLO CCOc1ccc(C[NH+]2CC3(CCO3)C2)c(C)c1 ZINC001138435629 985355803 /nfs/dbraw/zinc/35/58/03/985355803.db2.gz JWUGWYSYTAFDES-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO CO[C@@H]1CC=C(c2cccc(N)[nH+]2)CC1 ZINC001243805465 985381656 /nfs/dbraw/zinc/38/16/56/985381656.db2.gz GZQMJQPFCCTKFF-SNVBAGLBSA-N 1 2 204.273 2.246 20 0 BEADLO Nc1ccc(-c2ccc(CO)c(Cl)c2)c[nH+]1 ZINC001243818502 985419618 /nfs/dbraw/zinc/41/96/18/985419618.db2.gz AZLOBXMCIMGLDJ-UHFFFAOYSA-N 1 2 234.686 2.477 20 0 BEADLO CCc1cn(CCc2csc(C)n2)c[nH+]1 ZINC001459259137 985420931 /nfs/dbraw/zinc/42/09/31/985420931.db2.gz HFAXHRIAAKSQBD-UHFFFAOYSA-N 1 2 221.329 2.453 20 0 BEADLO Cc1cc(-c2ccc(CCO)cc2)c[nH+]c1N ZINC001243850519 985473543 /nfs/dbraw/zinc/47/35/43/985473543.db2.gz VMMBKWRSASKBJV-UHFFFAOYSA-N 1 2 228.295 2.174 20 0 BEADLO CCN(CC)c1ccc(N[C@@H]2COC[C@H]2C)c[nH+]1 ZINC000688046243 985527492 /nfs/dbraw/zinc/52/74/92/985527492.db2.gz IEWNURNFZJJOAR-DGCLKSJQSA-N 1 2 249.358 2.375 20 0 BEADLO CCN(CC)c1ccc(N[C@@H]2COC[C@@H]2C)c[nH+]1 ZINC000688046244 985528285 /nfs/dbraw/zinc/52/82/85/985528285.db2.gz IEWNURNFZJJOAR-WCQYABFASA-N 1 2 249.358 2.375 20 0 BEADLO Nc1cc[nH+]c(-c2cccc3nc[nH]c32)c1 ZINC001243927999 985599016 /nfs/dbraw/zinc/59/90/16/985599016.db2.gz RVGVFHLUGAFKIW-UHFFFAOYSA-N 1 2 210.240 2.207 20 0 BEADLO CCN(CC)c1cc(C2=C[NH2+]CCC2)ncn1 ZINC001243949511 985633410 /nfs/dbraw/zinc/63/34/10/985633410.db2.gz OUARBRSJJFBYJZ-UHFFFAOYSA-N 1 2 232.331 2.047 20 0 BEADLO COc1cc(C)cnc1C1=C[NH2+]CCC1 ZINC001243949442 985638925 /nfs/dbraw/zinc/63/89/25/985638925.db2.gz LMYFBKXGTWOADP-UHFFFAOYSA-N 1 2 204.273 2.123 20 0 BEADLO CC(C)c1nccnc1C1=C[NH2+]CCC1 ZINC001243950316 985641598 /nfs/dbraw/zinc/64/15/98/985641598.db2.gz XSRAPKVOEIMUHJ-UHFFFAOYSA-N 1 2 203.289 2.324 20 0 BEADLO CC(C)COc1cnc(C2=C[NH2+]CCC2)cn1 ZINC001243951599 985654325 /nfs/dbraw/zinc/65/43/25/985654325.db2.gz IYGQKWJQPFJACE-UHFFFAOYSA-N 1 2 233.315 2.236 20 0 BEADLO COC(=O)c1cccc(F)c1C1=C[NH2+]CCC1 ZINC001243951377 985656752 /nfs/dbraw/zinc/65/67/52/985656752.db2.gz VHRMGYRADSUJBB-UHFFFAOYSA-N 1 2 235.258 2.337 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2cc[nH]c(=O)c2c1 ZINC001244312599 985943830 /nfs/dbraw/zinc/94/38/30/985943830.db2.gz HPHPBGRQUYXGBK-UHFFFAOYSA-N 1 2 225.251 2.341 20 0 BEADLO CCOC(=O)CC[C@H](C)[N@@H+]1C[C@@H](F)C[C@H]1CF ZINC001258490549 985950778 /nfs/dbraw/zinc/95/07/78/985950778.db2.gz YSHHEJZPLPHJEH-DCAQKATOSA-N 1 2 249.301 2.100 20 0 BEADLO CCOC(=O)CC[C@H](C)[N@H+]1C[C@@H](F)C[C@H]1CF ZINC001258490549 985950796 /nfs/dbraw/zinc/95/07/96/985950796.db2.gz YSHHEJZPLPHJEH-DCAQKATOSA-N 1 2 249.301 2.100 20 0 BEADLO COC(=O)C1([NH2+][C@H]2C[C@H](C)CC(C)(C)C2)CC1 ZINC001258685431 986007274 /nfs/dbraw/zinc/00/72/74/986007274.db2.gz MKTUPXCYAXRQGR-QWRGUYRKSA-N 1 2 239.359 2.496 20 0 BEADLO COc1cncc(CNc2c[nH+]ccc2OC)c1 ZINC001461370813 986048505 /nfs/dbraw/zinc/04/85/05/986048505.db2.gz ZYMFRKIZMYRRSN-UHFFFAOYSA-N 1 2 245.282 2.106 20 0 BEADLO C[C@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc[nH]1 ZINC001461416190 986058226 /nfs/dbraw/zinc/05/82/26/986058226.db2.gz XPVXWRIKXWQBLE-QMMMGPOBSA-N 1 2 238.722 2.252 20 0 BEADLO CC[NH+](CC)c1ccc(Nc2cnn(C)n2)cc1 ZINC001212969035 986084562 /nfs/dbraw/zinc/08/45/62/986084562.db2.gz IMXSWKDKOQLIAF-UHFFFAOYSA-N 1 2 245.330 2.405 20 0 BEADLO COCOc1cccc(F)c1-c1cc(N)cc[nH+]1 ZINC001244479445 986152632 /nfs/dbraw/zinc/15/26/32/986152632.db2.gz YWSDGSYFNXYWSW-UHFFFAOYSA-N 1 2 248.257 2.453 20 0 BEADLO Cc1ccc2ccc(OC(=O)[C@H]3CC[NH2+]3)cc2c1 ZINC001579740404 986207080 /nfs/dbraw/zinc/20/70/80/986207080.db2.gz NSSCGPINVMRUNV-CQSZACIVSA-N 1 2 241.290 2.416 20 0 BEADLO CNc1cc(-c2ccc(CO)c(OC)c2)cc[nH+]1 ZINC001244670560 986302336 /nfs/dbraw/zinc/30/23/36/986302336.db2.gz IVIAFOBCXUNVJQ-UHFFFAOYSA-N 1 2 244.294 2.291 20 0 BEADLO Cc1cc(CO)cc(C)c1-c1c[nH+]cn1C ZINC001244691256 986310119 /nfs/dbraw/zinc/31/01/19/986310119.db2.gz RQGIIXAOXCUWJB-UHFFFAOYSA-N 1 2 216.284 2.196 20 0 BEADLO Cc1noc(C(C)(C)[NH2+]Cc2ccncc2C)n1 ZINC001462234630 986319186 /nfs/dbraw/zinc/31/91/86/986319186.db2.gz LEFLPWNVKZMUAL-UHFFFAOYSA-N 1 2 246.314 2.106 20 0 BEADLO CNc1cc(-c2cc(CO)cc(OC)c2)cc[nH+]1 ZINC001244843636 986391049 /nfs/dbraw/zinc/39/10/49/986391049.db2.gz HGDIMVTXDODLRM-UHFFFAOYSA-N 1 2 244.294 2.291 20 0 BEADLO c1[nH]c2c([nH+]1)[C@@H](c1nnc(C3CC3)o1)CCC2 ZINC001254063769 986497913 /nfs/dbraw/zinc/49/79/13/986497913.db2.gz FAKSJFCHYKSXRC-QMMMGPOBSA-N 1 2 230.271 2.138 20 0 BEADLO CNc1cc(-c2cccc3c2NC(=O)C3)cc[nH+]1 ZINC001244973349 986555716 /nfs/dbraw/zinc/55/57/16/986555716.db2.gz NDRDQEVSHRXFSN-UHFFFAOYSA-N 1 2 239.278 2.285 20 0 BEADLO CNc1cc(-c2ccc(=S)[nH]c2)cc[nH+]1 ZINC001244974483 986559263 /nfs/dbraw/zinc/55/92/63/986559263.db2.gz YISMUVZOJOPUHR-UHFFFAOYSA-N 1 2 217.297 2.474 20 0 BEADLO CNc1cc(-c2ccc(C(N)=O)cc2C)cc[nH+]1 ZINC001244975843 986559803 /nfs/dbraw/zinc/55/98/03/986559803.db2.gz DIINDJJEEIKREJ-UHFFFAOYSA-N 1 2 241.294 2.198 20 0 BEADLO Cc1cc(F)cc(N(CCCCO)C2CC2)[nH+]1 ZINC001262685438 986599139 /nfs/dbraw/zinc/59/91/39/986599139.db2.gz AZJQYTXZOVGTTN-UHFFFAOYSA-N 1 2 238.306 2.270 20 0 BEADLO O[C@@H](C[N@@H+]1CCC[C@H](F)C1)c1ccccc1F ZINC000689439222 986612465 /nfs/dbraw/zinc/61/24/65/986612465.db2.gz XPUSHVBTTUEDIM-GWCFXTLKSA-N 1 2 241.281 2.293 20 0 BEADLO O[C@@H](C[N@H+]1CCC[C@H](F)C1)c1ccccc1F ZINC000689439222 986612478 /nfs/dbraw/zinc/61/24/78/986612478.db2.gz XPUSHVBTTUEDIM-GWCFXTLKSA-N 1 2 241.281 2.293 20 0 BEADLO Cn1c[nH+]cc1-c1cc(Cl)cc(CO)c1 ZINC001245088065 986658409 /nfs/dbraw/zinc/65/84/09/986658409.db2.gz KCSSYEMFDLZGAF-UHFFFAOYSA-N 1 2 222.675 2.233 20 0 BEADLO Cn1c[nH+]cc1-c1cc(F)cc(C(C)(C)O)c1 ZINC001245141849 986670283 /nfs/dbraw/zinc/67/02/83/986670283.db2.gz UUTOMHDEWPCXHD-UHFFFAOYSA-N 1 2 234.274 2.454 20 0 BEADLO CNc1cc(N2CCC[C@H](CCF)C2)nc[nH+]1 ZINC000689487154 986670634 /nfs/dbraw/zinc/67/06/34/986670634.db2.gz AJVCZSIXADKNKT-SNVBAGLBSA-N 1 2 238.310 2.094 20 0 BEADLO CNc1cc(N2CCC[C@H](CCF)C2)[nH+]cn1 ZINC000689487154 986670647 /nfs/dbraw/zinc/67/06/47/986670647.db2.gz AJVCZSIXADKNKT-SNVBAGLBSA-N 1 2 238.310 2.094 20 0 BEADLO Cc1cn2c(cccc2C2=CCCOC2)[nH+]1 ZINC001245157269 986683821 /nfs/dbraw/zinc/68/38/21/986683821.db2.gz FOSRUHBWVGSIBD-UHFFFAOYSA-N 1 2 214.268 2.446 20 0 BEADLO C[C@@H]1C[N@H+](Cc2n[nH]c3ccccc32)C[C@@H]1F ZINC001137344942 986807773 /nfs/dbraw/zinc/80/77/73/986807773.db2.gz KCOJIPMDMTWPNF-KOLCDFICSA-N 1 2 233.290 2.353 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2n[nH]c3ccccc32)C[C@@H]1F ZINC001137344942 986807780 /nfs/dbraw/zinc/80/77/80/986807780.db2.gz KCOJIPMDMTWPNF-KOLCDFICSA-N 1 2 233.290 2.353 20 0 BEADLO CCCC[C@@H](C)[NH+]1CC(O)(C(F)(F)F)C1 ZINC001255322109 986919384 /nfs/dbraw/zinc/91/93/84/986919384.db2.gz GGNWPQKBPNVUOX-MRVPVSSYSA-N 1 2 225.254 2.174 20 0 BEADLO CSc1nc(C)cc(-c2c[nH+]c(N)c(C)c2)n1 ZINC001245535355 986910903 /nfs/dbraw/zinc/91/09/03/986910903.db2.gz UYTVTVZVEJHPTI-UHFFFAOYSA-N 1 2 246.339 2.460 20 0 BEADLO CCCC[C@H](C)[N@@H+]1C[C@@H](F)C[C@H]1C(=O)OC ZINC001255324062 986916345 /nfs/dbraw/zinc/91/63/45/986916345.db2.gz YZPMTWKXZZURSA-DCAQKATOSA-N 1 2 231.311 2.151 20 0 BEADLO CCCC[C@H](C)[N@H+]1C[C@@H](F)C[C@H]1C(=O)OC ZINC001255324062 986916354 /nfs/dbraw/zinc/91/63/54/986916354.db2.gz YZPMTWKXZZURSA-DCAQKATOSA-N 1 2 231.311 2.151 20 0 BEADLO Cc1ccc(-c2c[nH+]c(N)c(C)c2)c(F)n1 ZINC001245538518 986917234 /nfs/dbraw/zinc/91/72/34/986917234.db2.gz NAJSPYFNXKTQNP-UHFFFAOYSA-N 1 2 217.247 2.482 20 0 BEADLO Cc1cc(-c2nc(C)c(C)nc2C)c[nH+]c1N ZINC001245538651 986921587 /nfs/dbraw/zinc/92/15/87/986921587.db2.gz RCQRMKOWWVDHAC-UHFFFAOYSA-N 1 2 228.299 2.354 20 0 BEADLO Cc1cc(-c2cnc(F)c(F)c2)c[nH+]c1N ZINC001245537508 986922265 /nfs/dbraw/zinc/92/22/65/986922265.db2.gz QUGJAANBFSLABE-UHFFFAOYSA-N 1 2 221.210 2.312 20 0 BEADLO Cc1cc(-c2ccnc(N(C)C)c2)c[nH+]c1N ZINC001245537984 986922322 /nfs/dbraw/zinc/92/23/22/986922322.db2.gz IMIQHBYKXOUNSE-UHFFFAOYSA-N 1 2 228.299 2.100 20 0 BEADLO Cc1cc(-c2ccnc(F)c2F)c[nH+]c1N ZINC001245539460 986924174 /nfs/dbraw/zinc/92/41/74/986924174.db2.gz MAXSCHQTNXCFJY-UHFFFAOYSA-N 1 2 221.210 2.312 20 0 BEADLO Cc1cc(-c2cccnc2N(C)C)c[nH+]c1N ZINC001245540530 986925925 /nfs/dbraw/zinc/92/59/25/986925925.db2.gz VKPYYNJCZWQSOP-UHFFFAOYSA-N 1 2 228.299 2.100 20 0 BEADLO Cc1cc(-c2ncnc3sncc32)c[nH+]c1N ZINC001245539845 986927725 /nfs/dbraw/zinc/92/77/25/986927725.db2.gz XKJVNOOLDRVWOT-UHFFFAOYSA-N 1 2 243.295 2.039 20 0 BEADLO COCOc1cncc(-c2c[nH+]c(N)c(C)c2)c1 ZINC001245541423 986932121 /nfs/dbraw/zinc/93/21/21/986932121.db2.gz UBZAWJFHFRLDBG-UHFFFAOYSA-N 1 2 245.282 2.017 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cccc2c1CN(C)C2=O ZINC001245629041 987009945 /nfs/dbraw/zinc/00/99/45/987009945.db2.gz YSYBBHYNVXPTJG-DXNUHORPSA-N 1 2 228.295 2.148 20 0 BEADLO Cc1c[nH+]c(-c2c(O)cccc2F)cc1N ZINC001245653395 987028313 /nfs/dbraw/zinc/02/83/13/987028313.db2.gz KWFJPAIMRNGSBR-UHFFFAOYSA-N 1 2 218.231 2.484 20 0 BEADLO COC1(C)C[NH+]([C@@H](C)CC(F)(F)F)C1 ZINC001255646358 987046418 /nfs/dbraw/zinc/04/64/18/987046418.db2.gz NLYAYAQLEOCECP-ZETCQYMHSA-N 1 2 211.227 2.048 20 0 BEADLO C[C@H]1CCC[C@@H]1N1N=C(C2CC[NH2+]CC2)CC1=O ZINC001245918074 987150741 /nfs/dbraw/zinc/15/07/41/987150741.db2.gz VHWRRRCOXJBUIQ-GWCFXTLKSA-N 1 2 249.358 2.417 20 0 BEADLO Cc1cccc(C2=NN(CC[NH+](C)C)C(=O)C2)c1 ZINC001245919597 987160934 /nfs/dbraw/zinc/16/09/34/987160934.db2.gz JIDLYYDGTCWFCY-UHFFFAOYSA-N 1 2 245.326 2.126 20 0 BEADLO Cc1cccc(-c2cc(=O)n(CC[NH+](C)C)[nH]2)c1 ZINC001245919597 987160946 /nfs/dbraw/zinc/16/09/46/987160946.db2.gz JIDLYYDGTCWFCY-UHFFFAOYSA-N 1 2 245.326 2.126 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@H]2CCCC23CC3)c[nH+]1 ZINC001472020089 987163331 /nfs/dbraw/zinc/16/33/31/987163331.db2.gz CBBJSWWZGOHGEQ-LLVKDONJSA-N 1 2 247.342 2.169 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@H]2CCCC23CC3)[nH+]1 ZINC001472020089 987163346 /nfs/dbraw/zinc/16/33/46/987163346.db2.gz CBBJSWWZGOHGEQ-LLVKDONJSA-N 1 2 247.342 2.169 20 0 BEADLO O=c1cc(C2C[NH2+]C2)[nH]n1C1CCCCCC1 ZINC001245927956 987188752 /nfs/dbraw/zinc/18/87/52/987188752.db2.gz XJGYRPDNUCYZCX-UHFFFAOYSA-N 1 2 235.331 2.171 20 0 BEADLO Cc1cc(-c2cc(=O)n(CCC[NH3+])[nH]2)ccc1F ZINC001245943403 987218995 /nfs/dbraw/zinc/21/89/95/987218995.db2.gz GWQXFHARSVMWAV-UHFFFAOYSA-N 1 2 249.289 2.052 20 0 BEADLO Cc1cc(C)cc(-c2cc(=O)n(CCC[NH3+])[nH]2)c1 ZINC001245948764 987225842 /nfs/dbraw/zinc/22/58/42/987225842.db2.gz KAOJVCMEYPPOGA-UHFFFAOYSA-N 1 2 245.326 2.221 20 0 BEADLO Cn1c[nH+]cc1CNc1nc2ccc(F)cc2o1 ZINC001472857893 987291335 /nfs/dbraw/zinc/29/13/35/987291335.db2.gz IRRHVAPQPHVDPY-UHFFFAOYSA-N 1 2 246.245 2.313 20 0 BEADLO CCC(F)(F)C[NH2+]C[C@@H](O)c1cccc(F)c1 ZINC000697553644 987354797 /nfs/dbraw/zinc/35/47/97/987354797.db2.gz HLJGNKPFJBRPFH-LLVKDONJSA-N 1 2 247.260 2.494 20 0 BEADLO CSCC[C@@H](C)Nc1cc[nH+]cc1F ZINC000699719344 987379045 /nfs/dbraw/zinc/37/90/45/987379045.db2.gz ZHEBMPNOZODYLW-MRVPVSSYSA-N 1 2 214.309 2.196 20 0 BEADLO CO[C@H]1C[N@H+](Cc2cccc(C)c2F)C[C@@H]1F ZINC001137672651 987383624 /nfs/dbraw/zinc/38/36/24/987383624.db2.gz QWSNBPKSXVWAJH-RYUDHWBXSA-N 1 2 241.281 2.303 20 0 BEADLO CO[C@H]1C[N@@H+](Cc2cccc(C)c2F)C[C@@H]1F ZINC001137672651 987383628 /nfs/dbraw/zinc/38/36/28/987383628.db2.gz QWSNBPKSXVWAJH-RYUDHWBXSA-N 1 2 241.281 2.303 20 0 BEADLO Cc1ccc(O)c(NC(=O)[C@@H](C)n2cc[nH+]c2)c1 ZINC001115901336 987409687 /nfs/dbraw/zinc/40/96/87/987409687.db2.gz RQZMXNYNSIXNDF-SNVBAGLBSA-N 1 2 245.282 2.097 20 0 BEADLO Cc1cccc(N(C)C(=O)[C@@H](C)n2cc[nH+]c2)c1 ZINC001115960591 987419757 /nfs/dbraw/zinc/41/97/57/987419757.db2.gz XBVLZPDZKRPNTJ-GFCCVEGCSA-N 1 2 243.310 2.416 20 0 BEADLO C[C@H](C(=O)N1C[C@H](C)CCC[C@@H]1C)n1cc[nH+]c1 ZINC001116120527 987449877 /nfs/dbraw/zinc/44/98/77/987449877.db2.gz FOEXMVYFVKNCBS-FRRDWIJNSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@H](C(=O)N1CCC[C@H]2CCC[C@H]21)n1cc[nH+]c1 ZINC001116127967 987454092 /nfs/dbraw/zinc/45/40/92/987454092.db2.gz VPYDDAHMABZTOJ-JHJVBQTASA-N 1 2 247.342 2.235 20 0 BEADLO CC(C)CCC[C@H](C)N[C@H]1C[NH2+]CC[C@H]1F ZINC001246217967 987616271 /nfs/dbraw/zinc/61/62/71/987616271.db2.gz OVWZBKMYZAYWAH-XQQFMLRXSA-N 1 2 230.371 2.491 20 0 BEADLO CC(C)CCC[C@H](C)[NH2+][C@H]1CNCC[C@H]1F ZINC001246217967 987616277 /nfs/dbraw/zinc/61/62/77/987616277.db2.gz OVWZBKMYZAYWAH-XQQFMLRXSA-N 1 2 230.371 2.491 20 0 BEADLO CC(C)CCC[C@@H](C)N[C@H]1C[NH2+]CC[C@H]1F ZINC001246217966 987617359 /nfs/dbraw/zinc/61/73/59/987617359.db2.gz OVWZBKMYZAYWAH-UPJWGTAASA-N 1 2 230.371 2.491 20 0 BEADLO CC(C)CCC[C@@H](C)[NH2+][C@H]1CNCC[C@H]1F ZINC001246217966 987617365 /nfs/dbraw/zinc/61/73/65/987617365.db2.gz OVWZBKMYZAYWAH-UPJWGTAASA-N 1 2 230.371 2.491 20 0 BEADLO CCCCC[C@H](CC)[NH2+][C@@H]1CCNC[C@H]1OC ZINC001246218914 987618298 /nfs/dbraw/zinc/61/82/98/987618298.db2.gz WBCPCKPBTPZJMZ-BFHYXJOUSA-N 1 2 242.407 2.312 20 0 BEADLO COCc1ccc(C[NH2+][C@H](C)c2ccn(C)n2)o1 ZINC001474175730 987652205 /nfs/dbraw/zinc/65/22/05/987652205.db2.gz VBFYHRDVMDBVIF-SNVBAGLBSA-N 1 2 249.314 2.010 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)Cc1cc2cnccc2o1 ZINC001474386871 987709804 /nfs/dbraw/zinc/70/98/04/987709804.db2.gz RQPAZZWEKVNLOF-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)Cc1cc2cnccc2o1 ZINC001474386871 987709808 /nfs/dbraw/zinc/70/98/08/987709808.db2.gz RQPAZZWEKVNLOF-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO CC(C)C1CCC(N[C@@H]2C[NH2+]CC2(F)F)CC1 ZINC001246457136 987813824 /nfs/dbraw/zinc/81/38/24/987813824.db2.gz CPOKNYUBQGCQEU-HTAVTVPLSA-N 1 2 246.345 2.398 20 0 BEADLO CC(C)C1CCC([NH2+][C@@H]2CNCC2(F)F)CC1 ZINC001246457136 987813831 /nfs/dbraw/zinc/81/38/31/987813831.db2.gz CPOKNYUBQGCQEU-HTAVTVPLSA-N 1 2 246.345 2.398 20 0 BEADLO CCC1CCC(N[C@@H]2C[NH2+]CC2(F)F)CC1 ZINC001246457826 987815494 /nfs/dbraw/zinc/81/54/94/987815494.db2.gz FCGDLJXMUHPIOT-VQXHTEKXSA-N 1 2 232.318 2.152 20 0 BEADLO CCC1CCC([NH2+][C@@H]2CNCC2(F)F)CC1 ZINC001246457826 987815500 /nfs/dbraw/zinc/81/55/00/987815500.db2.gz FCGDLJXMUHPIOT-VQXHTEKXSA-N 1 2 232.318 2.152 20 0 BEADLO CC(C)C1CCC(N[C@H]2C[NH2+]CC2(F)F)CC1 ZINC001246457138 987815931 /nfs/dbraw/zinc/81/59/31/987815931.db2.gz CPOKNYUBQGCQEU-MCIGGMRASA-N 1 2 246.345 2.398 20 0 BEADLO CC(C)C1CCC([NH2+][C@H]2CNCC2(F)F)CC1 ZINC001246457138 987815937 /nfs/dbraw/zinc/81/59/37/987815937.db2.gz CPOKNYUBQGCQEU-MCIGGMRASA-N 1 2 246.345 2.398 20 0 BEADLO O=C(NC/C=C/C1CC1)c1cccc2[nH+]ccn21 ZINC001117771763 987899687 /nfs/dbraw/zinc/89/96/87/987899687.db2.gz PIJQXXNHDJPQGI-NSCUHMNNSA-N 1 2 241.294 2.030 20 0 BEADLO CN(C)c1ncccc1C[N@@H+]1CCC[C@@H](F)C1 ZINC001118247340 988151898 /nfs/dbraw/zinc/15/18/98/988151898.db2.gz ZHDDVEGWNCEXJS-GFCCVEGCSA-N 1 2 237.322 2.082 20 0 BEADLO CN(C)c1ncccc1C[N@H+]1CCC[C@@H](F)C1 ZINC001118247340 988151906 /nfs/dbraw/zinc/15/19/06/988151906.db2.gz ZHDDVEGWNCEXJS-GFCCVEGCSA-N 1 2 237.322 2.082 20 0 BEADLO CC[C@H]1CCC[C@H]1c1nnc(C[NH+](C)C)o1 ZINC001118371896 988275302 /nfs/dbraw/zinc/27/53/02/988275302.db2.gz JCKXVZNAWGANLC-VHSXEESVSA-N 1 2 223.320 2.425 20 0 BEADLO C[C@H](Cc1nnc(C[NH+](C)C)o1)c1ccccc1 ZINC001322582350 988333425 /nfs/dbraw/zinc/33/34/25/988333425.db2.gz IUCRPQVMEJWAPV-LLVKDONJSA-N 1 2 245.326 2.477 20 0 BEADLO C[C@@H]1CCCC[C@@H]1c1nnc(C[NH+](C)C)o1 ZINC001118433573 988346210 /nfs/dbraw/zinc/34/62/10/988346210.db2.gz VWYHBWWKJFTSGA-ZJUUUORDSA-N 1 2 223.320 2.425 20 0 BEADLO C[NH+](C)Cc1nnc(/C=C/C2CCCC2)o1 ZINC001118433106 988346371 /nfs/dbraw/zinc/34/63/71/988346371.db2.gz PLXFOPDZMWLQDQ-BQYQJAHWSA-N 1 2 221.304 2.335 20 0 BEADLO C[NH+](C)Cc1nnc([C@H]2CC3CCC2CC3)o1 ZINC001118433069 988348710 /nfs/dbraw/zinc/34/87/10/988348710.db2.gz OVVBZPZAZHJDNM-ILDUYXDCSA-N 1 2 235.331 2.425 20 0 BEADLO C[NH+](C)Cc1nnc(C(C)(C)c2ccccc2)o1 ZINC001322983159 988424519 /nfs/dbraw/zinc/42/45/19/988424519.db2.gz GHHCFNPACYUYOD-UHFFFAOYSA-N 1 2 245.326 2.457 20 0 BEADLO CC[N@H+](Cc1c(Cl)nc(OC)n1C)C1CC1 ZINC001323290718 988488183 /nfs/dbraw/zinc/48/81/83/988488183.db2.gz HMYYJZDSPAUDSK-UHFFFAOYSA-N 1 2 243.738 2.066 20 0 BEADLO CC[N@@H+](Cc1c(Cl)nc(OC)n1C)C1CC1 ZINC001323290718 988488193 /nfs/dbraw/zinc/48/81/93/988488193.db2.gz HMYYJZDSPAUDSK-UHFFFAOYSA-N 1 2 243.738 2.066 20 0 BEADLO COC(=O)C[N@@H+](Cc1ccc(C)o1)CC(C)C ZINC001323318551 988498765 /nfs/dbraw/zinc/49/87/65/988498765.db2.gz NTHWEKFFFRYUNE-UHFFFAOYSA-N 1 2 239.315 2.219 20 0 BEADLO COC(=O)C[N@H+](Cc1ccc(C)o1)CC(C)C ZINC001323318551 988498780 /nfs/dbraw/zinc/49/87/80/988498780.db2.gz NTHWEKFFFRYUNE-UHFFFAOYSA-N 1 2 239.315 2.219 20 0 BEADLO C/C=C(/C)C(=O)N(C)C1C[NH+](CC=C(C)C)C1 ZINC001323909989 988650313 /nfs/dbraw/zinc/65/03/13/988650313.db2.gz YMRVALIVLYHRQA-SDQBBNPISA-N 1 2 236.359 2.061 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2occc2C)[nH]n1 ZINC001324158164 988728124 /nfs/dbraw/zinc/72/81/24/988728124.db2.gz GVDRCDCGKUMETD-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2occc2C)[nH]n1 ZINC001324158164 988728137 /nfs/dbraw/zinc/72/81/37/988728137.db2.gz GVDRCDCGKUMETD-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO C[C@@H](C(=O)N1CC2(C1)CCCCC2)n1cc[nH+]c1 ZINC001324313647 988794429 /nfs/dbraw/zinc/79/44/29/988794429.db2.gz XQWZJRJDKIEHRC-LBPRGKRZSA-N 1 2 247.342 2.237 20 0 BEADLO COc1cc2[nH+]c(CCCO)[nH]c2cc1Cl ZINC001247010919 988836267 /nfs/dbraw/zinc/83/62/67/988836267.db2.gz NBNOXVGJJAEOJN-UHFFFAOYSA-N 1 2 240.690 2.150 20 0 BEADLO Cc1ccc(-c2noc(Cc3c[nH]c[nH+]3)n2)cc1 ZINC001247138629 988852440 /nfs/dbraw/zinc/85/24/40/988852440.db2.gz UCTSZEWZVQDTHV-UHFFFAOYSA-N 1 2 240.266 2.359 20 0 BEADLO Cn1c[nH+]cc1CCCOC(=O)C1CC2(CC2)C1 ZINC001515351987 989030199 /nfs/dbraw/zinc/03/01/99/989030199.db2.gz PYIBINHVFOGODG-UHFFFAOYSA-N 1 2 248.326 2.086 20 0 BEADLO CCN(C(=O)[C@H](C)n1cc[nH+]c1)C1CC(C)(C)C1 ZINC001325260889 989131469 /nfs/dbraw/zinc/13/14/69/989131469.db2.gz IUMBGPWNEWYLIK-NSHDSACASA-N 1 2 249.358 2.481 20 0 BEADLO COc1ccc(C[NH+]2CCC2)c(F)c1OC ZINC001248752932 989146644 /nfs/dbraw/zinc/14/66/44/989146644.db2.gz ILZWKEUPDMQMQL-UHFFFAOYSA-N 1 2 225.263 2.049 20 0 BEADLO C[NH+](C)Cc1ncc(C(F)(F)F)cc1F ZINC001248786929 989147948 /nfs/dbraw/zinc/14/79/48/989147948.db2.gz JNHVDIZUDWVKBL-UHFFFAOYSA-N 1 2 222.185 2.301 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3cnn(C)c3C2)cs1 ZINC001248804088 989154341 /nfs/dbraw/zinc/15/43/41/989154341.db2.gz LYOXDTDWFZRUCX-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1cc(C[N@H+]2CCc3cnn(C)c3C2)cs1 ZINC001248804088 989154347 /nfs/dbraw/zinc/15/43/47/989154347.db2.gz LYOXDTDWFZRUCX-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3ncn(C)c3C2)cs1 ZINC001248804515 989159400 /nfs/dbraw/zinc/15/94/00/989159400.db2.gz IJXDZGYGIAHVOO-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1cc(C[N@H+]2CCc3ncn(C)c3C2)cs1 ZINC001248804515 989159408 /nfs/dbraw/zinc/15/94/08/989159408.db2.gz IJXDZGYGIAHVOO-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1cc(C)nc(C[N@H+](C)C[C@@H]2CCCCO2)n1 ZINC001248965616 989232686 /nfs/dbraw/zinc/23/26/86/989232686.db2.gz KPDRVDIWXGPBRR-ZDUSSCGKSA-N 1 2 249.358 2.094 20 0 BEADLO Cc1cc(C)nc(C[N@@H+](C)C[C@@H]2CCCCO2)n1 ZINC001248965616 989232692 /nfs/dbraw/zinc/23/26/92/989232692.db2.gz KPDRVDIWXGPBRR-ZDUSSCGKSA-N 1 2 249.358 2.094 20 0 BEADLO COc1ccc2[nH]c(C[N@@H+]3CC[C@@H]3C)nc2c1 ZINC001249411934 989274039 /nfs/dbraw/zinc/27/40/39/989274039.db2.gz OJRDCNAADVZMBB-VIFPVBQESA-N 1 2 231.299 2.166 20 0 BEADLO COc1ccc2[nH]c(C[N@H+]3CC[C@@H]3C)nc2c1 ZINC001249411934 989274051 /nfs/dbraw/zinc/27/40/51/989274051.db2.gz OJRDCNAADVZMBB-VIFPVBQESA-N 1 2 231.299 2.166 20 0 BEADLO CC[C@@H]1CC[C@@H](C(=O)Nc2c(C)c[nH+]cc2C)O1 ZINC001518385920 989301519 /nfs/dbraw/zinc/30/15/19/989301519.db2.gz YERPCFKCGVXDDJ-NEPJUHHUSA-N 1 2 248.326 2.016 20 0 BEADLO CC(=O)[C@H]1CCC[N@H+](Cc2cc(C)sn2)C1 ZINC001249589063 989304592 /nfs/dbraw/zinc/30/45/92/989304592.db2.gz RKODZGSUQCDUFA-NSHDSACASA-N 1 2 238.356 2.253 20 0 BEADLO CC(=O)[C@H]1CCC[N@@H+](Cc2cc(C)sn2)C1 ZINC001249589063 989304604 /nfs/dbraw/zinc/30/46/04/989304604.db2.gz RKODZGSUQCDUFA-NSHDSACASA-N 1 2 238.356 2.253 20 0 BEADLO Cc1cc(C[N@@H+]2CCCO[C@H](C)C2)ns1 ZINC001249571038 989310032 /nfs/dbraw/zinc/31/00/32/989310032.db2.gz JBRGDUBOHOXXNN-SECBINFHSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1cc(C[N@H+]2CCCO[C@H](C)C2)ns1 ZINC001249571038 989310043 /nfs/dbraw/zinc/31/00/43/989310043.db2.gz JBRGDUBOHOXXNN-SECBINFHSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1ncc(C[NH2+]Cc2ccnn2C2CCC2)o1 ZINC001119678401 989327084 /nfs/dbraw/zinc/32/70/84/989327084.db2.gz CLKTVLYZCFKZOQ-UHFFFAOYSA-N 1 2 246.314 2.194 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ncccn1)c1cccnc1 ZINC001119692624 989338672 /nfs/dbraw/zinc/33/86/72/989338672.db2.gz LFXVREPEXOUZSH-QWRGUYRKSA-N 1 2 228.299 2.283 20 0 BEADLO c1nnc(C[NH2+]C2(c3ccccc3)CC2)s1 ZINC001119696420 989346338 /nfs/dbraw/zinc/34/63/38/989346338.db2.gz VPZJFNNCPYGTAP-UHFFFAOYSA-N 1 2 231.324 2.317 20 0 BEADLO c1nnc(C[NH2+][C@@H](c2cccnc2)C2CC2)s1 ZINC001119808243 989410977 /nfs/dbraw/zinc/41/09/77/989410977.db2.gz OKKUKTUVGOZMNE-GFCCVEGCSA-N 1 2 246.339 2.174 20 0 BEADLO CCc1cc(NCC[C@@H](C)OC)nc(CC)[nH+]1 ZINC001119965007 989514984 /nfs/dbraw/zinc/51/49/84/989514984.db2.gz WDHRBBMZPXUNNQ-SNVBAGLBSA-N 1 2 237.347 2.438 20 0 BEADLO COCC1C[NH+](Cc2csc(C(C)C)n2)C1 ZINC001119975476 989533485 /nfs/dbraw/zinc/53/34/85/989533485.db2.gz VTXNJEUCOFSVIR-UHFFFAOYSA-N 1 2 240.372 2.345 20 0 BEADLO C[C@H](CNc1cc(N(C)C)nc[nH+]1)C1CC1 ZINC001120018501 989568038 /nfs/dbraw/zinc/56/80/38/989568038.db2.gz SVYRRTSXRNUDOY-SECBINFHSA-N 1 2 220.320 2.001 20 0 BEADLO C[C@H](CNc1cc(N(C)C)[nH+]cn1)C1CC1 ZINC001120018501 989568041 /nfs/dbraw/zinc/56/80/41/989568041.db2.gz SVYRRTSXRNUDOY-SECBINFHSA-N 1 2 220.320 2.001 20 0 BEADLO CC[N@H+](CCOC)Cc1ncoc1C(C)C ZINC001326539884 989600674 /nfs/dbraw/zinc/60/06/74/989600674.db2.gz OGLUTDQHCUBGSD-UHFFFAOYSA-N 1 2 226.320 2.266 20 0 BEADLO CC[N@@H+](CCOC)Cc1ncoc1C(C)C ZINC001326539884 989600684 /nfs/dbraw/zinc/60/06/84/989600684.db2.gz OGLUTDQHCUBGSD-UHFFFAOYSA-N 1 2 226.320 2.266 20 0 BEADLO Cc1nc([C@H](C)[NH2+][C@H]2CC[C@@H](C)SC2)no1 ZINC001326853513 989753450 /nfs/dbraw/zinc/75/34/50/989753450.db2.gz OMJOTWXQIMYVPZ-WEDXCCLWSA-N 1 2 241.360 2.313 20 0 BEADLO Cc1cc(CN(C)c2cc(F)cc(C)[nH+]2)no1 ZINC001120797654 989887539 /nfs/dbraw/zinc/88/75/39/989887539.db2.gz HJKWGEUGISXRCI-UHFFFAOYSA-N 1 2 235.262 2.462 20 0 BEADLO C[C@H](C(=O)N1CC[C@H]1C(C)(C)C)n1cc[nH+]c1 ZINC001120850389 989920677 /nfs/dbraw/zinc/92/06/77/989920677.db2.gz VRSPVYJWDJLVDV-MNOVXSKESA-N 1 2 235.331 2.091 20 0 BEADLO CCc1ccc(N(C)C[C@H](C)OC)[nH+]c1 ZINC001120931640 989973235 /nfs/dbraw/zinc/97/32/35/989973235.db2.gz JJMNEODRMMPNEP-JTQLQIEISA-N 1 2 208.305 2.115 20 0 BEADLO CCc1ccc(N2CCC([C@@H](C)CO)CC2)[nH+]c1 ZINC001120943581 989980891 /nfs/dbraw/zinc/98/08/91/989980891.db2.gz IDZHMFZFAVNNLB-LBPRGKRZSA-N 1 2 248.370 2.489 20 0 BEADLO CCc1ccc(N2C[C@@H](C)[C@](C)(CO)C2)[nH+]c1 ZINC001120948770 989981823 /nfs/dbraw/zinc/98/18/23/989981823.db2.gz DGJVDDSIFABKJA-RISCZKNCSA-N 1 2 234.343 2.099 20 0 BEADLO CCc1ccc(N2C[C@@H](C)[C@@](C)(CO)C2)[nH+]c1 ZINC001120948768 989983405 /nfs/dbraw/zinc/98/34/05/989983405.db2.gz DGJVDDSIFABKJA-BXUZGUMPSA-N 1 2 234.343 2.099 20 0 BEADLO CC[C@@H](C)C(=O)Nc1c(C)c[nH+]cc1C ZINC001121141124 990022003 /nfs/dbraw/zinc/02/20/03/990022003.db2.gz YRXBGXNDSIYJON-MRVPVSSYSA-N 1 2 206.289 2.105 20 0 BEADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)[C@@H]1C[C@H]1F ZINC001525657412 990063506 /nfs/dbraw/zinc/06/35/06/990063506.db2.gz DGMYHIWXMUVMMB-VXGBXAGGSA-N 1 2 245.257 2.169 20 0 BEADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)[C@H]1C[C@H]1F ZINC001525657411 990064064 /nfs/dbraw/zinc/06/40/64/990064064.db2.gz DGMYHIWXMUVMMB-NWDGAFQWSA-N 1 2 245.257 2.169 20 0 BEADLO Cc1ccc(C(=O)OCC(C)(C)n2cc[nH+]c2)o1 ZINC001526098999 990113433 /nfs/dbraw/zinc/11/34/33/990113433.db2.gz HIOYDFHWRVTXMW-UHFFFAOYSA-N 1 2 248.282 2.377 20 0 BEADLO Cc1cc(C)c(NC(=O)c2cccnn2)c(C)[nH+]1 ZINC001526806593 990177513 /nfs/dbraw/zinc/17/75/13/990177513.db2.gz ZMEGVCQLGNPPOW-UHFFFAOYSA-N 1 2 242.282 2.049 20 0 BEADLO CCn1c[nH+]cc1COC(=O)c1ccc(C)o1 ZINC001527007682 990199764 /nfs/dbraw/zinc/19/97/64/990199764.db2.gz MVIODNYVJZSTKF-UHFFFAOYSA-N 1 2 234.255 2.161 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@@H]1CCC[C@H]2C[C@H]21 ZINC001527011412 990200451 /nfs/dbraw/zinc/20/04/51/990200451.db2.gz CTQBHQRKCUWKMP-CYZMBNFOSA-N 1 2 248.326 2.382 20 0 BEADLO CCn1c[nH+]cc1COC(=O)C1=CCCC1 ZINC001527011439 990200653 /nfs/dbraw/zinc/20/06/53/990200653.db2.gz DEUFWQJGOTVGGW-UHFFFAOYSA-N 1 2 220.272 2.057 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@@H]1CC=CCC1 ZINC001527008794 990201033 /nfs/dbraw/zinc/20/10/33/990201033.db2.gz ZBPRWSLMYLUQEB-LLVKDONJSA-N 1 2 234.299 2.303 20 0 BEADLO Cc1cc(C)c(CNC(=O)c2ccncc2)c[nH+]1 ZINC001528920404 990321341 /nfs/dbraw/zinc/32/13/41/990321341.db2.gz QWXCLLSGRUFSJI-UHFFFAOYSA-N 1 2 241.294 2.023 20 0 BEADLO CC(C)(COC(=O)[C@H]1CC1(C)C)n1cc[nH+]c1 ZINC001123050591 990496464 /nfs/dbraw/zinc/49/64/64/990496464.db2.gz NPZNFVVVZLBAKB-SNVBAGLBSA-N 1 2 236.315 2.208 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC001123377400 990568675 /nfs/dbraw/zinc/56/86/75/990568675.db2.gz HVLOFUWECDCZAU-IJLUTSLNSA-N 1 2 248.326 2.382 20 0 BEADLO CCn1c[nH+]cc1COC(=O)c1cc(C)oc1C ZINC001123469390 990589150 /nfs/dbraw/zinc/58/91/50/990589150.db2.gz LTKVVPQGMIWRJG-UHFFFAOYSA-N 1 2 248.282 2.470 20 0 BEADLO CCn1c[nH+]cc1COC(=O)c1cocc1C ZINC001123472549 990591281 /nfs/dbraw/zinc/59/12/81/990591281.db2.gz IPRIDKWMUNSIID-UHFFFAOYSA-N 1 2 234.255 2.161 20 0 BEADLO Cc1[nH]c2ccc(NC(=O)[C@@H]3C[C@@H]3F)cc2[nH+]1 ZINC001123748973 990660051 /nfs/dbraw/zinc/66/00/51/990660051.db2.gz RRYXZLGGEYHAJP-BDAKNGLRSA-N 1 2 233.246 2.168 20 0 BEADLO CCCC1(CNC(=O)CCc2[nH+]ccn2C)CC1 ZINC001123755943 990660206 /nfs/dbraw/zinc/66/02/06/990660206.db2.gz JBQWDQCPHHIZAI-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)[C@@H]1C[C@@H]1F ZINC001542442207 990663793 /nfs/dbraw/zinc/66/37/93/990663793.db2.gz MNDXYFKDZPKTCS-MNOVXSKESA-N 1 2 245.257 2.373 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1C(=O)CCc1[nH+]ccn1C ZINC001123782051 990668849 /nfs/dbraw/zinc/66/88/49/990668849.db2.gz DGLBRJXDHLUSFG-VXGBXAGGSA-N 1 2 249.358 2.142 20 0 BEADLO C=C/C=C/CC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001556482165 990830669 /nfs/dbraw/zinc/83/06/69/990830669.db2.gz SEFLGIDJJVFORN-ONEGZZNKSA-N 1 2 227.267 2.405 20 0 BEADLO C[C@H]1CC[N@@H+]1Cc1scnc1Cl ZINC001137817478 990852443 /nfs/dbraw/zinc/85/24/43/990852443.db2.gz VGBAOVDRZQZLLM-LURJTMIESA-N 1 2 202.710 2.391 20 0 BEADLO C[C@H]1CC[N@H+]1Cc1scnc1Cl ZINC001137817478 990852444 /nfs/dbraw/zinc/85/24/44/990852444.db2.gz VGBAOVDRZQZLLM-LURJTMIESA-N 1 2 202.710 2.391 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1ccc(C)c(F)c1F ZINC001137972398 990873448 /nfs/dbraw/zinc/87/34/48/990873448.db2.gz OZIHSMDTGHYEEW-LLVKDONJSA-N 1 2 241.281 2.494 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1ccc(C)c(F)c1F ZINC001137972398 990873450 /nfs/dbraw/zinc/87/34/50/990873450.db2.gz OZIHSMDTGHYEEW-LLVKDONJSA-N 1 2 241.281 2.494 20 0 BEADLO c1cnc2ccc(C[N@@H+]3CCC34COC4)cc2c1 ZINC001138110502 990883848 /nfs/dbraw/zinc/88/38/48/990883848.db2.gz KKWAAGUFRYVUAV-UHFFFAOYSA-N 1 2 240.306 2.210 20 0 BEADLO c1cnc2ccc(C[N@H+]3CCC34COC4)cc2c1 ZINC001138110502 990883849 /nfs/dbraw/zinc/88/38/49/990883849.db2.gz KKWAAGUFRYVUAV-UHFFFAOYSA-N 1 2 240.306 2.210 20 0 BEADLO C[C@H]1CCCCCN1C(=O)CCc1[nH+]ccn1C ZINC001138368086 990924460 /nfs/dbraw/zinc/92/44/60/990924460.db2.gz CMKBFXPGFSMEDW-LBPRGKRZSA-N 1 2 249.358 2.144 20 0 BEADLO COc1c(F)cc(C[NH+]2CCC2)cc1F ZINC001138420947 990943682 /nfs/dbraw/zinc/94/36/82/990943682.db2.gz VOEOWSWNBCMXLJ-UHFFFAOYSA-N 1 2 213.227 2.179 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@H]2CCC[C@H]2CC)c[nH+]1 ZINC001558497572 990952521 /nfs/dbraw/zinc/95/25/21/990952521.db2.gz UPCQXMBWDORVMU-PWSUYJOCSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@H]2CCC[C@H]2CC)[nH+]1 ZINC001558497572 990952527 /nfs/dbraw/zinc/95/25/27/990952527.db2.gz UPCQXMBWDORVMU-PWSUYJOCSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]c(CNC(=O)c2cscc2C)c[nH+]1 ZINC001558497688 990952842 /nfs/dbraw/zinc/95/28/42/990952842.db2.gz ZCPLEQRNBGMARC-UHFFFAOYSA-N 1 2 249.339 2.272 20 0 BEADLO CCc1[nH]cc(CNC(=O)c2cscc2C)[nH+]1 ZINC001558497688 990952852 /nfs/dbraw/zinc/95/28/52/990952852.db2.gz ZCPLEQRNBGMARC-UHFFFAOYSA-N 1 2 249.339 2.272 20 0 BEADLO Cc1cccc(O[C@@H](C)C[NH2+]Cc2ccn[nH]2)c1 ZINC001308275645 990955070 /nfs/dbraw/zinc/95/50/70/990955070.db2.gz UGVZHAYTJHRBSR-LBPRGKRZSA-N 1 2 245.326 2.275 20 0 BEADLO COC1C[NH+](Cc2ccccc2N2CCCC2)C1 ZINC001138610890 990981928 /nfs/dbraw/zinc/98/19/28/990981928.db2.gz XEHYUUGKBOPQBR-UHFFFAOYSA-N 1 2 246.354 2.117 20 0 BEADLO CCc1nc(C[NH2+]Cc2cccnc2C)co1 ZINC001308408758 990988436 /nfs/dbraw/zinc/98/84/36/990988436.db2.gz UKKHCNISRWHAAN-UHFFFAOYSA-N 1 2 231.299 2.230 20 0 BEADLO CCCn1ncc(C[N@H+](C)CCF)c1C ZINC001138641758 990994013 /nfs/dbraw/zinc/99/40/13/990994013.db2.gz QPSWZAODVFFGPS-UHFFFAOYSA-N 1 2 213.300 2.003 20 0 BEADLO CCCn1ncc(C[N@@H+](C)CCF)c1C ZINC001138641758 990994020 /nfs/dbraw/zinc/99/40/20/990994020.db2.gz QPSWZAODVFFGPS-UHFFFAOYSA-N 1 2 213.300 2.003 20 0 BEADLO CCSc1ncc(C[NH+]2CC(C)C2)cn1 ZINC001138649675 990997114 /nfs/dbraw/zinc/99/71/14/990997114.db2.gz KDJWMDDVZSXURO-UHFFFAOYSA-N 1 2 223.345 2.040 20 0 BEADLO CNc1ncccc1C[N@@H+]1CCCC[C@@H]1C(C)=O ZINC001138695434 991008399 /nfs/dbraw/zinc/00/83/99/991008399.db2.gz AMIQLBHYMMIREP-CYBMUJFWSA-N 1 2 247.342 2.067 20 0 BEADLO CNc1ncccc1C[N@H+]1CCCC[C@@H]1C(C)=O ZINC001138695434 991008404 /nfs/dbraw/zinc/00/84/04/991008404.db2.gz AMIQLBHYMMIREP-CYBMUJFWSA-N 1 2 247.342 2.067 20 0 BEADLO C[C@@H]1CC[N@@H+]1Cc1ccnc(Br)c1 ZINC001138731147 991023444 /nfs/dbraw/zinc/02/34/44/991023444.db2.gz BKJVFQRXTZMBTO-MRVPVSSYSA-N 1 2 241.132 2.438 20 0 BEADLO C[C@@H]1CC[N@H+]1Cc1ccnc(Br)c1 ZINC001138731147 991023451 /nfs/dbraw/zinc/02/34/51/991023451.db2.gz BKJVFQRXTZMBTO-MRVPVSSYSA-N 1 2 241.132 2.438 20 0 BEADLO C[C@H]1C[C@H]([N@@H+]2CCC(=O)[C@H](F)C2)C[C@@H](C)C1 ZINC001258167037 991057226 /nfs/dbraw/zinc/05/72/26/991057226.db2.gz FSMIZVMQLIQCTB-NOOOWODRSA-N 1 2 227.323 2.424 20 0 BEADLO C[C@H]1C[C@H]([N@H+]2CCC(=O)[C@H](F)C2)C[C@@H](C)C1 ZINC001258167037 991057234 /nfs/dbraw/zinc/05/72/34/991057234.db2.gz FSMIZVMQLIQCTB-NOOOWODRSA-N 1 2 227.323 2.424 20 0 BEADLO CCc1[nH]c(CNc2ccnc(C(C)C)n2)c[nH+]1 ZINC001559290174 991065580 /nfs/dbraw/zinc/06/55/80/991065580.db2.gz GVLOWNDAXFUEQY-UHFFFAOYSA-N 1 2 245.330 2.498 20 0 BEADLO CCc1[nH]cc(CNc2ccnc(C(C)C)n2)[nH+]1 ZINC001559290174 991065591 /nfs/dbraw/zinc/06/55/91/991065591.db2.gz GVLOWNDAXFUEQY-UHFFFAOYSA-N 1 2 245.330 2.498 20 0 BEADLO FC(F)C1C[NH+](Cc2cccc3ccnn32)C1 ZINC001138810172 991069388 /nfs/dbraw/zinc/06/93/88/991069388.db2.gz ONYHYFYYRJHKHD-UHFFFAOYSA-N 1 2 237.253 2.031 20 0 BEADLO C[N@H+](Cc1cc(F)cnc1Cl)C1CC1 ZINC001138891228 991095957 /nfs/dbraw/zinc/09/59/57/991095957.db2.gz QKTIUUZDAMRYQB-UHFFFAOYSA-N 1 2 214.671 2.468 20 0 BEADLO C[N@@H+](Cc1cc(F)cnc1Cl)C1CC1 ZINC001138891228 991095966 /nfs/dbraw/zinc/09/59/66/991095966.db2.gz QKTIUUZDAMRYQB-UHFFFAOYSA-N 1 2 214.671 2.468 20 0 BEADLO CSCC[C@@H](C)[N@@H+]1CCC(F)(F)C1 ZINC001258212825 991130927 /nfs/dbraw/zinc/13/09/27/991130927.db2.gz JSDXHBXNEWZCGY-MRVPVSSYSA-N 1 2 209.305 2.469 20 0 BEADLO CSCC[C@@H](C)[N@H+]1CCC(F)(F)C1 ZINC001258212825 991130934 /nfs/dbraw/zinc/13/09/34/991130934.db2.gz JSDXHBXNEWZCGY-MRVPVSSYSA-N 1 2 209.305 2.469 20 0 BEADLO CSCC[C@@H](C)[NH+]1C[C@@H](F)[C@H](F)C1 ZINC001258216137 991140890 /nfs/dbraw/zinc/14/08/90/991140890.db2.gz UVQMSHRXWYHZNN-IWSPIJDZSA-N 1 2 209.305 2.120 20 0 BEADLO CCn1ccc2ccc(C[NH+]3CC(OC)C3)cc21 ZINC001139119065 991147923 /nfs/dbraw/zinc/14/79/23/991147923.db2.gz AOYOXXQHAQYSCP-UHFFFAOYSA-N 1 2 244.338 2.492 20 0 BEADLO CCON(CCn1cc[nH+]c1)Cc1ccccc1 ZINC000832800171 991167880 /nfs/dbraw/zinc/16/78/80/991167880.db2.gz FKGSVTRICYZBLC-UHFFFAOYSA-N 1 2 245.326 2.337 20 0 BEADLO Cc1cccc2[nH]cc(C[NH+]3CC4(CCO4)C3)c21 ZINC001139195658 991186378 /nfs/dbraw/zinc/18/63/78/991186378.db2.gz AENFXTNYPMVZHD-UHFFFAOYSA-N 1 2 242.322 2.451 20 0 BEADLO CC(=O)C[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC001559629682 991191642 /nfs/dbraw/zinc/19/16/42/991191642.db2.gz RQQKDBYERBZPMS-OAHLLOKOSA-N 1 2 240.306 2.350 20 0 BEADLO Clc1cccc(C[N@@H+]2CC[C@]23CCOC3)n1 ZINC001139552757 991263663 /nfs/dbraw/zinc/26/36/63/991263663.db2.gz UWVMSHICQWIGBG-GFCCVEGCSA-N 1 2 238.718 2.100 20 0 BEADLO Clc1cccc(C[N@H+]2CC[C@]23CCOC3)n1 ZINC001139552757 991263675 /nfs/dbraw/zinc/26/36/75/991263675.db2.gz UWVMSHICQWIGBG-GFCCVEGCSA-N 1 2 238.718 2.100 20 0 BEADLO c1nc(-c2ccccc2)[nH]c1C[NH+]1CCC1 ZINC001139551308 991266321 /nfs/dbraw/zinc/26/63/21/991266321.db2.gz ZGGVWQHOXHRABV-UHFFFAOYSA-N 1 2 213.284 2.282 20 0 BEADLO Clc1ccnc(C[N@@H+]2CC[C@@]23CCOC3)c1 ZINC001139565222 991272291 /nfs/dbraw/zinc/27/22/91/991272291.db2.gz QJTYJQTWOAUIIG-LBPRGKRZSA-N 1 2 238.718 2.100 20 0 BEADLO Clc1ccnc(C[N@H+]2CC[C@@]23CCOC3)c1 ZINC001139565222 991272302 /nfs/dbraw/zinc/27/23/02/991272302.db2.gz QJTYJQTWOAUIIG-LBPRGKRZSA-N 1 2 238.718 2.100 20 0 BEADLO c1c(C[NH+]2CC3(C2)CCCC3)nc2cnccn12 ZINC001139695293 991326782 /nfs/dbraw/zinc/32/67/82/991326782.db2.gz GRDXPELAZFRSTD-UHFFFAOYSA-N 1 2 242.326 2.105 20 0 BEADLO FC(F)C1C[NH+](Cc2cnc3cccnc3c2)C1 ZINC001139746334 991352088 /nfs/dbraw/zinc/35/20/88/991352088.db2.gz UPNLFPUQSZKDRF-UHFFFAOYSA-N 1 2 249.264 2.327 20 0 BEADLO C[C@H](C(=O)N1[C@H](C)CCC1(C)C)n1cc[nH+]c1 ZINC001328408152 991390694 /nfs/dbraw/zinc/39/06/94/991390694.db2.gz WTGAGFGPDJXZKI-GHMZBOCLSA-N 1 2 235.331 2.234 20 0 BEADLO Cc1ccc(C[N@@H+]2CCCC(=O)[C@H](C)C2)nc1 ZINC001139837791 991393802 /nfs/dbraw/zinc/39/38/02/991393802.db2.gz XUWWMJVLQAXLCW-GFCCVEGCSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1ccc(C[N@H+]2CCCC(=O)[C@H](C)C2)nc1 ZINC001139837791 991393808 /nfs/dbraw/zinc/39/38/08/991393808.db2.gz XUWWMJVLQAXLCW-GFCCVEGCSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1ccc(C[N@@H+]2CCCC(=O)[C@@H](C)C2)nc1 ZINC001139837792 991394968 /nfs/dbraw/zinc/39/49/68/991394968.db2.gz XUWWMJVLQAXLCW-LBPRGKRZSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1ccc(C[N@H+]2CCCC(=O)[C@@H](C)C2)nc1 ZINC001139837792 991394971 /nfs/dbraw/zinc/39/49/71/991394971.db2.gz XUWWMJVLQAXLCW-LBPRGKRZSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1ccc(C[N@@H+]2CCc3ccncc3C2)nc1 ZINC001139840117 991401449 /nfs/dbraw/zinc/40/14/49/991401449.db2.gz GABDVWUFHUVDHI-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1ccc(C[N@H+]2CCc3ccncc3C2)nc1 ZINC001139840117 991401452 /nfs/dbraw/zinc/40/14/52/991401452.db2.gz GABDVWUFHUVDHI-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cn1c(C[N@H+]2C[C@H]3C[C@@H](C2)O3)cc2ccccc21 ZINC001139871755 991406162 /nfs/dbraw/zinc/40/61/62/991406162.db2.gz OXYMQHBZYJKDIS-OKILXGFUSA-N 1 2 242.322 2.151 20 0 BEADLO Cn1c(C[N@@H+]2C[C@H]3C[C@@H](C2)O3)cc2ccccc21 ZINC001139871755 991406167 /nfs/dbraw/zinc/40/61/67/991406167.db2.gz OXYMQHBZYJKDIS-OKILXGFUSA-N 1 2 242.322 2.151 20 0 BEADLO O=C1CC[NH+](Cc2cncc3ccccc32)CC1 ZINC001139893500 991409477 /nfs/dbraw/zinc/40/94/77/991409477.db2.gz FCPNUZUOFYZRCT-UHFFFAOYSA-N 1 2 240.306 2.400 20 0 BEADLO c1ccc2c(c1)cncc2C[N@@H+]1CCO[C@H]2C[C@H]21 ZINC001139899357 991413305 /nfs/dbraw/zinc/41/33/05/991413305.db2.gz ZMQXYEBPLCOHTQ-CABCVRRESA-N 1 2 240.306 2.208 20 0 BEADLO c1ccc2c(c1)cncc2C[N@H+]1CCO[C@H]2C[C@H]21 ZINC001139899357 991413312 /nfs/dbraw/zinc/41/33/12/991413312.db2.gz ZMQXYEBPLCOHTQ-CABCVRRESA-N 1 2 240.306 2.208 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[N@@H+]1CCC[C@H](F)C1 ZINC001560205370 991417402 /nfs/dbraw/zinc/41/74/02/991417402.db2.gz UCXYFDGICBNNBF-NWDGAFQWSA-N 1 2 245.338 2.398 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[N@H+]1CCC[C@H](F)C1 ZINC001560205370 991417408 /nfs/dbraw/zinc/41/74/08/991417408.db2.gz UCXYFDGICBNNBF-NWDGAFQWSA-N 1 2 245.338 2.398 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC(=O)[C@H](C)CC2)cn1 ZINC001139928964 991422387 /nfs/dbraw/zinc/42/23/87/991422387.db2.gz HTUXZIHPHMZJGO-LLVKDONJSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1ccc(C[N@H+]2CCC(=O)[C@H](C)CC2)cn1 ZINC001139928964 991422392 /nfs/dbraw/zinc/42/23/92/991422392.db2.gz HTUXZIHPHMZJGO-LLVKDONJSA-N 1 2 232.327 2.191 20 0 BEADLO COC(=O)C1(C[N@@H+]2CC(F)(F)CC[C@@H]2C)CC1 ZINC001560219108 991422906 /nfs/dbraw/zinc/42/29/06/991422906.db2.gz FZKLMHZYIHSHPD-VIFPVBQESA-N 1 2 247.285 2.059 20 0 BEADLO COC(=O)C1(C[N@H+]2CC(F)(F)CC[C@@H]2C)CC1 ZINC001560219108 991422911 /nfs/dbraw/zinc/42/29/11/991422911.db2.gz FZKLMHZYIHSHPD-VIFPVBQESA-N 1 2 247.285 2.059 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cncs2)cn1 ZINC001139934591 991426618 /nfs/dbraw/zinc/42/66/18/991426618.db2.gz UTNNEKYGHVXRPG-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cncs2)cn1 ZINC001139934591 991426628 /nfs/dbraw/zinc/42/66/28/991426628.db2.gz UTNNEKYGHVXRPG-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Fc1cccc2c1CC[N@H+](Cc1cccnn1)C2 ZINC001139971175 991438520 /nfs/dbraw/zinc/43/85/20/991438520.db2.gz DFXRHPAPHSITOD-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1cccc2c1CC[N@@H+](Cc1cccnn1)C2 ZINC001139971175 991438521 /nfs/dbraw/zinc/43/85/21/991438521.db2.gz DFXRHPAPHSITOD-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO COC1(C)C[NH+](Cc2cc3ccccc3cn2)C1 ZINC001139996089 991473635 /nfs/dbraw/zinc/47/36/35/991473635.db2.gz XBRYHYREIPLTFS-UHFFFAOYSA-N 1 2 242.322 2.456 20 0 BEADLO CC1(C)CC[C@@H]([N@@H+]2CCC(=O)[C@@H](F)C2)C1 ZINC001258604737 991486893 /nfs/dbraw/zinc/48/68/93/991486893.db2.gz JIEZLZVLVOZEMY-ZJUUUORDSA-N 1 2 213.296 2.178 20 0 BEADLO CC1(C)CC[C@@H]([N@H+]2CCC(=O)[C@@H](F)C2)C1 ZINC001258604737 991486903 /nfs/dbraw/zinc/48/69/03/991486903.db2.gz JIEZLZVLVOZEMY-ZJUUUORDSA-N 1 2 213.296 2.178 20 0 BEADLO C[C@H]1C[C@@H](CF)[N@H+](Cc2cccc(F)n2)C1 ZINC001140131744 991533375 /nfs/dbraw/zinc/53/33/75/991533375.db2.gz RAAODIOSWGKCQW-ONGXEEELSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@H]1C[C@@H](CF)[N@@H+](Cc2cccc(F)n2)C1 ZINC001140131744 991533390 /nfs/dbraw/zinc/53/33/90/991533390.db2.gz RAAODIOSWGKCQW-ONGXEEELSA-N 1 2 226.270 2.401 20 0 BEADLO COc1cc(C[N@@H+]2C[C@H]3CC[C@@H]2CO3)ccc1C ZINC001140161300 991547524 /nfs/dbraw/zinc/54/75/24/991547524.db2.gz DFEDNWPRWNVJQC-ZIAGYGMSSA-N 1 2 247.338 2.367 20 0 BEADLO COc1cc(C[N@H+]2C[C@H]3CC[C@@H]2CO3)ccc1C ZINC001140161300 991547537 /nfs/dbraw/zinc/54/75/37/991547537.db2.gz DFEDNWPRWNVJQC-ZIAGYGMSSA-N 1 2 247.338 2.367 20 0 BEADLO COC1(C)C[NH+](Cc2c[nH]c3cccc(O)c23)C1 ZINC001140231225 991570106 /nfs/dbraw/zinc/57/01/06/991570106.db2.gz GKBBGWSIUJQOAO-UHFFFAOYSA-N 1 2 246.310 2.094 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2ccncc2O)C[C@H]1F ZINC001140273684 991574274 /nfs/dbraw/zinc/57/42/74/991574274.db2.gz PKJVXAYCIWHCOE-NEPJUHHUSA-N 1 2 242.269 2.059 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2ccncc2O)C[C@H]1F ZINC001140273689 991576303 /nfs/dbraw/zinc/57/63/03/991576303.db2.gz PKJVXAYCIWHCOE-VXGBXAGGSA-N 1 2 242.269 2.059 20 0 BEADLO CCC[C@H](Cc1ccccc1)[NH2+]CC(=O)OC ZINC001258649439 991576393 /nfs/dbraw/zinc/57/63/93/991576393.db2.gz HJADUELBKBZIHA-CYBMUJFWSA-N 1 2 235.327 2.160 20 0 BEADLO COC1C[NH+](Cc2ccc3c(c2)CCC3)C1 ZINC001203019086 991589197 /nfs/dbraw/zinc/58/91/97/991589197.db2.gz AOEPMIPZSPTBRK-UHFFFAOYSA-N 1 2 217.312 2.006 20 0 BEADLO C[C@@H](C(=O)N[C@H]1CCC[C@@H](C)[C@@H]1C)n1cc[nH+]c1 ZINC001318097228 991623204 /nfs/dbraw/zinc/62/32/04/991623204.db2.gz QQAWQRPCDZEROO-VOAKCMCISA-N 1 2 249.358 2.385 20 0 BEADLO c1cc(C[N@@H+]2CCC23COC3)cc2c1CCC2 ZINC001203034123 991634586 /nfs/dbraw/zinc/63/45/86/991634586.db2.gz OZDYERNABSVUOG-UHFFFAOYSA-N 1 2 229.323 2.150 20 0 BEADLO c1cc(C[N@H+]2CCC23COC3)cc2c1CCC2 ZINC001203034123 991634588 /nfs/dbraw/zinc/63/45/88/991634588.db2.gz OZDYERNABSVUOG-UHFFFAOYSA-N 1 2 229.323 2.150 20 0 BEADLO COc1cccnc1C[NH2+][C@@H](C)c1ccccn1 ZINC001560886976 991638863 /nfs/dbraw/zinc/63/88/63/991638863.db2.gz DIUDEOZHFOXLJI-NSHDSACASA-N 1 2 243.310 2.336 20 0 BEADLO C[C@H](C(=O)N[C@@H]1CC[C@@H](C)CC1)n1cc[nH+]c1 ZINC001318333268 991649695 /nfs/dbraw/zinc/64/96/95/991649695.db2.gz CNXIPKPXZDDQOL-IJLUTSLNSA-N 1 2 235.331 2.139 20 0 BEADLO COc1cc(F)cc(C[N@H+](C)C2(C)COC2)c1 ZINC001140483226 991653961 /nfs/dbraw/zinc/65/39/61/991653961.db2.gz NTIBQYLDMDCBNA-UHFFFAOYSA-N 1 2 239.290 2.055 20 0 BEADLO COc1cc(F)cc(C[N@@H+](C)C2(C)COC2)c1 ZINC001140483226 991653963 /nfs/dbraw/zinc/65/39/63/991653963.db2.gz NTIBQYLDMDCBNA-UHFFFAOYSA-N 1 2 239.290 2.055 20 0 BEADLO COC(=O)C[NH2+][C@@H](C)Cc1cccc(Cl)c1 ZINC001258738771 991688708 /nfs/dbraw/zinc/68/87/08/991688708.db2.gz YWSHZZBKGSQLEQ-VIFPVBQESA-N 1 2 241.718 2.034 20 0 BEADLO CCn1ccc(C[NH+]2CC(Cc3ccoc3)C2)n1 ZINC001561039139 991697583 /nfs/dbraw/zinc/69/75/83/991697583.db2.gz KIWUBTWNAKFIQD-UHFFFAOYSA-N 1 2 245.326 2.171 20 0 BEADLO CC(C)C1CCN(C(=O)[C@@H](C)n2cc[nH+]c2)CC1 ZINC001318700877 991700669 /nfs/dbraw/zinc/70/06/69/991700669.db2.gz DKBNCXOGKPPXPQ-GFCCVEGCSA-N 1 2 249.358 2.339 20 0 BEADLO C[C@H](C(=O)N1C[C@H](C)CC[C@@H]1C)n1cc[nH+]c1 ZINC001318913616 991735036 /nfs/dbraw/zinc/73/50/36/991735036.db2.gz UDKSVJJIAMNFKV-GRYCIOLGSA-N 1 2 235.331 2.091 20 0 BEADLO CC[C@@H](C)C[C@H](CC)[N@H+]1CCOC(=O)C1 ZINC001258798086 991796391 /nfs/dbraw/zinc/79/63/91/991796391.db2.gz QPFPBTIMXJFGJO-MNOVXSKESA-N 1 2 213.321 2.060 20 0 BEADLO CC[C@H](C)C[C@H](C)NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001319123237 991791559 /nfs/dbraw/zinc/79/15/59/991791559.db2.gz NEZJMMYIHAFUEI-SRVKXCTJSA-N 1 2 237.347 2.385 20 0 BEADLO CC[C@@H](C)C[C@H](CC)[N@@H+]1CCOC(=O)C1 ZINC001258798086 991796376 /nfs/dbraw/zinc/79/63/76/991796376.db2.gz QPFPBTIMXJFGJO-MNOVXSKESA-N 1 2 213.321 2.060 20 0 BEADLO CC(=CC(=O)NCc1[nH]c[nH+]c1C)c1ccco1 ZINC001566188685 991828613 /nfs/dbraw/zinc/82/86/13/991828613.db2.gz FFRGRYIQIWNWPV-RMKNXTFCSA-N 1 2 245.282 2.031 20 0 BEADLO CCC1(CNC(=O)Cc2[nH]c[nH+]c2C)CCCC1 ZINC001566411006 991846751 /nfs/dbraw/zinc/84/67/51/991846751.db2.gz SOAKNBIIXVNECG-UHFFFAOYSA-N 1 2 249.358 2.347 20 0 BEADLO Cc1cccc(F)c1C(=O)OCCn1cc[nH+]c1 ZINC001319761326 991972196 /nfs/dbraw/zinc/97/21/96/991972196.db2.gz VPRMKDVDQKCSOA-UHFFFAOYSA-N 1 2 248.257 2.188 20 0 BEADLO CC(C)=CC[NH+]1CC(NC(=O)CC(C)(C)C)C1 ZINC001567783336 992086224 /nfs/dbraw/zinc/08/62/24/992086224.db2.gz DMHLGJORQYNWIE-UHFFFAOYSA-N 1 2 238.375 2.189 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1c(C)cccc1OC ZINC001568280438 992158118 /nfs/dbraw/zinc/15/81/18/992158118.db2.gz TUSCFSSPGIDEPZ-NSHDSACASA-N 1 2 248.326 2.036 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1c(C)cccc1OC ZINC001568280438 992158123 /nfs/dbraw/zinc/15/81/23/992158123.db2.gz TUSCFSSPGIDEPZ-NSHDSACASA-N 1 2 248.326 2.036 20 0 BEADLO C[C@H](C(=O)N[C@H]1CCC(C)(C)C1)n1cc[nH+]c1 ZINC001320486360 992217503 /nfs/dbraw/zinc/21/75/03/992217503.db2.gz BPOMWJHJZCQYIU-MNOVXSKESA-N 1 2 235.331 2.139 20 0 BEADLO CN(C)c1cc(COC(=O)CC2CCC2)cc[nH+]1 ZINC001320558366 992250295 /nfs/dbraw/zinc/25/02/95/992250295.db2.gz XSKBCJXLCZNUQU-UHFFFAOYSA-N 1 2 248.326 2.381 20 0 BEADLO C[C@H](C(=O)N(C)[C@H]1CCC(C)(C)C1)n1cc[nH+]c1 ZINC001321216969 992491090 /nfs/dbraw/zinc/49/10/90/992491090.db2.gz IVVXIPACMXMALZ-NEPJUHHUSA-N 1 2 249.358 2.481 20 0 BEADLO COC(=O)CC1CC(Nc2c[nH+]c(C)c(C)c2)C1 ZINC001262031726 992622813 /nfs/dbraw/zinc/62/28/13/992622813.db2.gz ZWBBNLSOEVMBKY-UHFFFAOYSA-N 1 2 248.326 2.452 20 0 BEADLO CCC[N@H+](CC)Cn1nc(CC)oc1=S ZINC001262049918 992631302 /nfs/dbraw/zinc/63/13/02/992631302.db2.gz LBMKQTWBIJJVBR-UHFFFAOYSA-N 1 2 229.349 2.457 20 0 BEADLO CCC[N@@H+](CC)Cn1nc(CC)oc1=S ZINC001262049918 992631306 /nfs/dbraw/zinc/63/13/06/992631306.db2.gz LBMKQTWBIJJVBR-UHFFFAOYSA-N 1 2 229.349 2.457 20 0 BEADLO CCc1ccc(N2CC[C@@H](O)C(C)(C)C2)[nH+]c1 ZINC001262692206 993032088 /nfs/dbraw/zinc/03/20/88/993032088.db2.gz BRAPETXCPVQYHM-GFCCVEGCSA-N 1 2 234.343 2.241 20 0 BEADLO C[C@@H](Cc1ccco1)[N@@H+]1Cc2cncnc2C1 ZINC000585332273 993257401 /nfs/dbraw/zinc/25/74/01/993257401.db2.gz PLYVRWLHYCORSS-JTQLQIEISA-N 1 2 229.283 2.016 20 0 BEADLO C[C@@H](Cc1ccco1)[N@H+]1Cc2cncnc2C1 ZINC000585332273 993257407 /nfs/dbraw/zinc/25/74/07/993257407.db2.gz PLYVRWLHYCORSS-JTQLQIEISA-N 1 2 229.283 2.016 20 0 BEADLO FC(F)(F)OCCNc1cccc[nH+]1 ZINC000379617255 993266179 /nfs/dbraw/zinc/26/61/79/993266179.db2.gz AHPHRPHRIFFWTM-UHFFFAOYSA-N 1 2 206.167 2.030 20 0 BEADLO C[C@H]1CCC[C@H](C)N1c1cc(N(C)C)[nH+]cn1 ZINC000585415008 993266917 /nfs/dbraw/zinc/26/69/17/993266917.db2.gz HLJNGTASWBUFSZ-QWRGUYRKSA-N 1 2 234.347 2.310 20 0 BEADLO C[C@H]1CCC[C@H](C)N1c1cc(N(C)C)nc[nH+]1 ZINC000585415008 993266926 /nfs/dbraw/zinc/26/69/26/993266926.db2.gz HLJNGTASWBUFSZ-QWRGUYRKSA-N 1 2 234.347 2.310 20 0 BEADLO COCCc1[nH]c2ccc(C)c(C)c2[nH+]1 ZINC000379825192 993284431 /nfs/dbraw/zinc/28/44/31/993284431.db2.gz VVJALUUSNDTGNL-UHFFFAOYSA-N 1 2 204.273 2.369 20 0 BEADLO O=C1COc2cc3[nH+]c(C4CCC4)[nH]c3cc2N1 ZINC000586883325 993416167 /nfs/dbraw/zinc/41/61/67/993416167.db2.gz BIEZPMAVYJHNQC-UHFFFAOYSA-N 1 2 243.266 2.161 20 0 BEADLO CC[C@@H](C)c1[nH]c2cc3c(cc2[nH+]1)OCC(=O)N3 ZINC000587956710 993465774 /nfs/dbraw/zinc/46/57/74/993465774.db2.gz VCMISBJXTDSZBJ-SSDOTTSWSA-N 1 2 245.282 2.407 20 0 BEADLO c1cn(CCCNc2ccc3c(c2)CCO3)c[nH+]1 ZINC000383886260 993528008 /nfs/dbraw/zinc/52/80/08/993528008.db2.gz XNKFTCQJQHMVME-UHFFFAOYSA-N 1 2 243.310 2.320 20 0 BEADLO CC[C@@](C)(NC(=O)CCc1[nH+]ccn1C)C1CC1 ZINC001263862532 993562722 /nfs/dbraw/zinc/56/27/22/993562722.db2.gz MEBRVUJLUYTASM-CQSZACIVSA-N 1 2 249.358 2.048 20 0 BEADLO Cc1ccc2nc(C[NH+](C)C)[nH]c2c1C ZINC000389334065 993746579 /nfs/dbraw/zinc/74/65/79/993746579.db2.gz NGGWXPDDHRNHLJ-UHFFFAOYSA-N 1 2 203.289 2.241 20 0 BEADLO Cc1[nH]c(CN2Cc3ccccc3C2)c[nH+]1 ZINC000724784961 994073062 /nfs/dbraw/zinc/07/30/62/994073062.db2.gz VJGMAYOZLIIYAN-UHFFFAOYSA-N 1 2 213.284 2.234 20 0 BEADLO Cc1[nH]cc(CN2Cc3ccccc3C2)[nH+]1 ZINC000724784961 994073073 /nfs/dbraw/zinc/07/30/73/994073073.db2.gz VJGMAYOZLIIYAN-UHFFFAOYSA-N 1 2 213.284 2.234 20 0 BEADLO O=C(Cn1cc[nH+]c1)Nc1ccc2occc2c1 ZINC001302481869 995120033 /nfs/dbraw/zinc/12/00/33/995120033.db2.gz JUBUFHOOROGSNA-UHFFFAOYSA-N 1 2 241.250 2.268 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)[C@]23C[C@H]2CCC3)[nH+]1 ZINC001304108644 995190258 /nfs/dbraw/zinc/19/02/58/995190258.db2.gz XVTLQZYLRUJVEM-QMTHXVAHSA-N 1 2 247.342 2.340 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)[C@]23C[C@H]2CCC3)c[nH+]1 ZINC001304108644 995190262 /nfs/dbraw/zinc/19/02/62/995190262.db2.gz XVTLQZYLRUJVEM-QMTHXVAHSA-N 1 2 247.342 2.340 20 0 BEADLO C[C@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)C1(C)CC1 ZINC001337522305 995200420 /nfs/dbraw/zinc/20/04/20/995200420.db2.gz NTBKWDLQVJKYMP-VIFPVBQESA-N 1 2 243.310 2.481 20 0 BEADLO CCc1cn(CC(=O)N2CCCC[C@H]2CC)c[nH+]1 ZINC001307397759 995343166 /nfs/dbraw/zinc/34/31/66/995343166.db2.gz UPRAIDFAGPIOQQ-CYBMUJFWSA-N 1 2 249.358 2.237 20 0 BEADLO CCC[C@H](O)C[N@@H+]1CC(F)(F)CC[C@@H]1C ZINC001308155092 995575415 /nfs/dbraw/zinc/57/54/15/995575415.db2.gz XJSOGNIUPKGMGV-UWVGGRQHSA-N 1 2 221.291 2.267 20 0 BEADLO CCC[C@H](O)C[N@H+]1CC(F)(F)CC[C@@H]1C ZINC001308155092 995575425 /nfs/dbraw/zinc/57/54/25/995575425.db2.gz XJSOGNIUPKGMGV-UWVGGRQHSA-N 1 2 221.291 2.267 20 0 BEADLO CCC[C@@H](O)C[N@@H+]1CC(F)(F)CC[C@H]1C ZINC001308155091 995577089 /nfs/dbraw/zinc/57/70/89/995577089.db2.gz XJSOGNIUPKGMGV-NXEZZACHSA-N 1 2 221.291 2.267 20 0 BEADLO CCC[C@@H](O)C[N@H+]1CC(F)(F)CC[C@H]1C ZINC001308155091 995577102 /nfs/dbraw/zinc/57/71/02/995577102.db2.gz XJSOGNIUPKGMGV-NXEZZACHSA-N 1 2 221.291 2.267 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)Nc1ccc2occc2c1 ZINC001557957076 1170085829 /nfs/dbraw/zinc/08/58/29/1170085829.db2.gz RJKVVKSKDXYQTJ-UHFFFAOYSA-N 1 2 241.250 2.337 20 0 BEADLO Cc1ccc(NCc2cc[nH]c(=O)c2)c(C)[nH+]1 ZINC001620869735 1170162370 /nfs/dbraw/zinc/16/23/70/1170162370.db2.gz RSSOYTFVTIMZHD-UHFFFAOYSA-N 1 2 229.283 2.411 20 0 BEADLO c1cn(Cc2ccc(-c3ccccn3)nc2)c[nH+]1 ZINC001615928606 1170539074 /nfs/dbraw/zinc/53/90/74/1170539074.db2.gz GQRLEHCQTVOGND-UHFFFAOYSA-N 1 2 236.278 2.388 20 0 BEADLO C[C@H]([NH2+]CC(=O)c1ccccc1F)c1cn[nH]c1 ZINC001617056006 1170577058 /nfs/dbraw/zinc/57/70/58/1170577058.db2.gz VRTCACSKRZITRE-VIFPVBQESA-N 1 2 247.273 2.082 20 0 BEADLO CCC(=O)N[C@@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC000018048086 1170663254 /nfs/dbraw/zinc/66/32/54/1170663254.db2.gz WZWRNGJYAIQIMX-NSHDSACASA-N 1 2 243.310 2.460 20 0 BEADLO CCOCC[N@@H+]1CCCC[C@H]1c1cc(C)[nH]n1 ZINC001620615000 1170686406 /nfs/dbraw/zinc/68/64/06/1170686406.db2.gz IUPCPKYNSCXLAX-ZDUSSCGKSA-N 1 2 237.347 2.282 20 0 BEADLO CCOCC[N@H+]1CCCC[C@H]1c1cc(C)[nH]n1 ZINC001620615000 1170686413 /nfs/dbraw/zinc/68/64/13/1170686413.db2.gz IUPCPKYNSCXLAX-ZDUSSCGKSA-N 1 2 237.347 2.282 20 0 BEADLO COC(=O)c1cccc(Nc2ccc(N)[nH+]c2)c1 ZINC000019951939 1170691777 /nfs/dbraw/zinc/69/17/77/1170691777.db2.gz MEPDQIUZNLWLOV-UHFFFAOYSA-N 1 2 243.266 2.194 20 0 BEADLO COC(=O)C1CC(Nc2c[nH+]c(C)c(C)c2)C1 ZINC001621498026 1170828629 /nfs/dbraw/zinc/82/86/29/1170828629.db2.gz KMKWIIQQXLFVRR-UHFFFAOYSA-N 1 2 234.299 2.062 20 0 BEADLO C[C@@H]([NH2+]CC1(C)CC1)c1nc(C(F)(F)F)n[nH]1 ZINC001621539995 1170841433 /nfs/dbraw/zinc/84/14/33/1170841433.db2.gz YNIMKELVGZGPOF-ZCFIWIBFSA-N 1 2 248.252 2.274 20 0 BEADLO C[C@H]([NH2+]CC1(C)CC1)c1nc(C(F)(F)F)n[nH]1 ZINC001621539994 1170843416 /nfs/dbraw/zinc/84/34/16/1170843416.db2.gz YNIMKELVGZGPOF-LURJTMIESA-N 1 2 248.252 2.274 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1[C@H](C)CCC[C@H]1C ZINC001628457340 1171237836 /nfs/dbraw/zinc/23/78/36/1171237836.db2.gz UNPGGHWYXDYXBQ-NXEZZACHSA-N 1 2 235.331 2.050 20 0 BEADLO C[C@@H](NC(=O)[C@H](C)n1cc[nH+]c1)c1cccs1 ZINC000044817670 1171413246 /nfs/dbraw/zinc/41/32/46/1171413246.db2.gz XCUJASHLSHFQDP-ZJUUUORDSA-N 1 2 249.339 2.383 20 0 BEADLO C=CCN1CC[NH+](Cc2ccccc2F)CC1 ZINC000045911392 1171466479 /nfs/dbraw/zinc/46/64/79/1171466479.db2.gz QDBOUAQPHPTQMG-UHFFFAOYSA-N 1 2 234.318 2.129 20 0 BEADLO COc1ccccc1NC(=O)[C@H](C)n1cc[nH+]c1 ZINC000049215286 1171682160 /nfs/dbraw/zinc/68/21/60/1171682160.db2.gz RZESMHXXFVELLM-JTQLQIEISA-N 1 2 245.282 2.091 20 0 BEADLO C[C@H](C(=O)N[C@H]1CCC[C@@H](C)[C@H]1C)n1cc[nH+]c1 ZINC000049215364 1171682689 /nfs/dbraw/zinc/68/26/89/1171682689.db2.gz QQAWQRPCDZEROO-LPWJVIDDSA-N 1 2 249.358 2.385 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H]2CC[C@@H]3C[C@@H]3C2)c[nH+]1 ZINC001635610705 1171740773 /nfs/dbraw/zinc/74/07/73/1171740773.db2.gz RXQSSRQJKOEQMN-GMTAPVOTSA-N 1 2 247.342 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H]2CC[C@@H]3C[C@@H]3C2)[nH+]1 ZINC001635610705 1171740782 /nfs/dbraw/zinc/74/07/82/1171740782.db2.gz RXQSSRQJKOEQMN-GMTAPVOTSA-N 1 2 247.342 2.025 20 0 BEADLO CCc1[nH]c(CNC(=O)c2occ(C)c2C)c[nH+]1 ZINC001635610612 1171743857 /nfs/dbraw/zinc/74/38/57/1171743857.db2.gz NYCVUDPKAOJKFS-UHFFFAOYSA-N 1 2 247.298 2.112 20 0 BEADLO CCc1[nH]cc(CNC(=O)c2occ(C)c2C)[nH+]1 ZINC001635610612 1171743861 /nfs/dbraw/zinc/74/38/61/1171743861.db2.gz NYCVUDPKAOJKFS-UHFFFAOYSA-N 1 2 247.298 2.112 20 0 BEADLO CC(C)C(C)(C)Nc1ncnc2c1C[N@H+](C)CC2 ZINC000572369618 398135677 /nfs/dbraw/zinc/13/56/77/398135677.db2.gz NQJFUPRPYYBYEL-UHFFFAOYSA-N 1 2 248.374 2.311 20 0 BEADLO CC(C)C(C)(C)Nc1ncnc2c1C[N@@H+](C)CC2 ZINC000572369618 398135679 /nfs/dbraw/zinc/13/56/79/398135679.db2.gz NQJFUPRPYYBYEL-UHFFFAOYSA-N 1 2 248.374 2.311 20 0 BEADLO FCCOc1cccc(NCc2[nH]cc[nH+]2)c1 ZINC000152085068 136212398 /nfs/dbraw/zinc/21/23/98/136212398.db2.gz DHKWVUVKNQMDEX-UHFFFAOYSA-N 1 2 235.262 2.370 20 0 BEADLO CC(C)[C@@H](C)C(=O)NCCCNc1cccc[nH+]1 ZINC000172345744 167349759 /nfs/dbraw/zinc/34/97/59/167349759.db2.gz VWGXCWLXEPFWQI-GFCCVEGCSA-N 1 2 249.358 2.292 20 0 BEADLO CCC1(CC)C[NH+](Cc2nccnc2OC)C1 ZINC000297508530 398145573 /nfs/dbraw/zinc/14/55/73/398145573.db2.gz VRKCBLUFBVFBPJ-UHFFFAOYSA-N 1 2 235.331 2.107 20 0 BEADLO C[C@@H](CC(=O)N[C@@H](C)C1CCC1)n1cc[nH+]c1 ZINC000649865339 398146346 /nfs/dbraw/zinc/14/63/46/398146346.db2.gz UHOARQODSNWBKC-QWRGUYRKSA-N 1 2 235.331 2.139 20 0 BEADLO CCC(CC)([NH2+][C@@H]1C=CCCC1)C(=O)OC ZINC000336749289 168332776 /nfs/dbraw/zinc/33/27/76/168332776.db2.gz YREOEARQDLFVQW-LLVKDONJSA-N 1 2 225.332 2.417 20 0 BEADLO Cc1cc2[nH+]cn(C[C@H](C)CO)c2cc1C ZINC000162077282 538920652 /nfs/dbraw/zinc/92/06/52/538920652.db2.gz VFLFYVQNXRCNDL-VIFPVBQESA-N 1 2 218.300 2.282 20 0 BEADLO COC(=O)[C@@H]([NH2+][C@H]1C=CCCCCC1)C1CC1 ZINC000339107908 398151628 /nfs/dbraw/zinc/15/16/28/398151628.db2.gz KPQLJPBOUWSMLW-STQMWFEESA-N 1 2 237.343 2.417 20 0 BEADLO COC(=O)[C@@H]([NH2+][C@@H]1C=CCCCCC1)C1CC1 ZINC000339107906 398151853 /nfs/dbraw/zinc/15/18/53/398151853.db2.gz KPQLJPBOUWSMLW-OLZOCXBDSA-N 1 2 237.343 2.417 20 0 BEADLO Cc1c[nH]c(CN(C)c2ccccc2)[nH+]1 ZINC000628118487 398159442 /nfs/dbraw/zinc/15/94/42/398159442.db2.gz VZDILISDOIXHOB-UHFFFAOYSA-N 1 2 201.273 2.355 20 0 BEADLO Cc1cc(C[NH2+]CC(F)F)ccc1F ZINC000147373529 178020200 /nfs/dbraw/zinc/02/02/00/178020200.db2.gz CSOQWPLUURYLBQ-UHFFFAOYSA-N 1 2 203.207 2.489 20 0 BEADLO Cc1cc(Cl)ncc1NCc1c[nH+]cn1C ZINC000186054424 178073228 /nfs/dbraw/zinc/07/32/28/178073228.db2.gz LJPVALASJJVMIU-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2cncc(F)c2)on1 ZINC000125654941 178032048 /nfs/dbraw/zinc/03/20/48/178032048.db2.gz ATHYOLHMHNKKEG-VIFPVBQESA-N 1 2 235.262 2.368 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](C)c2cccc(O)c2)n1C ZINC000341031417 398183178 /nfs/dbraw/zinc/18/31/78/398183178.db2.gz VVSUUCOGXWFURH-NSHDSACASA-N 1 2 245.326 2.285 20 0 BEADLO Cc1c[nH+]c(CN[C@@H](C)c2cccc(O)c2)n1C ZINC000341031417 398183182 /nfs/dbraw/zinc/18/31/82/398183182.db2.gz VVSUUCOGXWFURH-NSHDSACASA-N 1 2 245.326 2.285 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2ncnn2C)ccc1F ZINC000276615242 178038070 /nfs/dbraw/zinc/03/80/70/178038070.db2.gz DLKKSOPODVNQJK-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2ccncc2F)ncn1 ZINC000340312719 178038133 /nfs/dbraw/zinc/03/81/33/178038133.db2.gz MLUZFHWFGPXQJO-SNVBAGLBSA-N 1 2 246.289 2.170 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2cncc(F)c2)on1 ZINC000125655095 178038527 /nfs/dbraw/zinc/03/85/27/178038527.db2.gz ATHYOLHMHNKKEG-SECBINFHSA-N 1 2 235.262 2.368 20 0 BEADLO Cc1cc(C[NH2+][C@H]2CCc3c2cccc3O)no1 ZINC000044692776 178041372 /nfs/dbraw/zinc/04/13/72/178041372.db2.gz BBVJZWDPSRKPKE-ZDUSSCGKSA-N 1 2 244.294 2.466 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2C[C@@H]3C=C[C@H]2CC3)cc[nH+]1 ZINC000649883518 398162246 /nfs/dbraw/zinc/16/22/46/398162246.db2.gz UNBKLSFPYZGSII-MBNYWOFBSA-N 1 2 242.322 2.353 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1cc(C)cc(F)c1 ZINC000336607310 178076433 /nfs/dbraw/zinc/07/64/33/178076433.db2.gz KPXOLFJHOUCBDC-UHFFFAOYSA-N 1 2 247.273 2.096 20 0 BEADLO CCC(CC)C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000125342725 168339942 /nfs/dbraw/zinc/33/99/42/168339942.db2.gz ROTDLRZDZAUGAE-SNVBAGLBSA-N 1 2 223.320 2.413 20 0 BEADLO Cc1cc(F)ccc1C[N@H+](C)Cc1cnc[nH]1 ZINC000361325301 178084858 /nfs/dbraw/zinc/08/48/58/178084858.db2.gz KWNXHPCIAVGBPZ-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1cnc[nH]1 ZINC000361325301 178084860 /nfs/dbraw/zinc/08/48/60/178084860.db2.gz KWNXHPCIAVGBPZ-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1cc(F)ccc1C[N@H+](C)Cc1c[nH]cn1 ZINC000361325301 178084861 /nfs/dbraw/zinc/08/48/61/178084861.db2.gz KWNXHPCIAVGBPZ-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1c[nH]cn1 ZINC000361325301 178084862 /nfs/dbraw/zinc/08/48/62/178084862.db2.gz KWNXHPCIAVGBPZ-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1cc(F)ccc1C[NH2+]CC(F)F ZINC000147425857 178085763 /nfs/dbraw/zinc/08/57/63/178085763.db2.gz XYMSJJWXOGLSQL-UHFFFAOYSA-N 1 2 203.207 2.489 20 0 BEADLO Cc1cc(N(C)CCOc2ccccc2)nc[nH+]1 ZINC000301225539 178098665 /nfs/dbraw/zinc/09/86/65/178098665.db2.gz DEWRDCVBIDVGSM-UHFFFAOYSA-N 1 2 243.310 2.300 20 0 BEADLO Cc1cc(N(C)CC[C@@H](C)O)nc(C(C)C)[nH+]1 ZINC000135259992 178099049 /nfs/dbraw/zinc/09/90/49/178099049.db2.gz WBDDNLXSCNHYDT-LLVKDONJSA-N 1 2 237.347 2.116 20 0 BEADLO Cc1cc(N(C)CCc2ccccc2)nc[nH+]1 ZINC000301233723 178099396 /nfs/dbraw/zinc/09/93/96/178099396.db2.gz JALOXEVRHWOICX-UHFFFAOYSA-N 1 2 227.311 2.464 20 0 BEADLO Cc1cc(N(C)[C@@H](C)CO)c2cccc(F)c2[nH+]1 ZINC000301866392 178100889 /nfs/dbraw/zinc/10/08/89/178100889.db2.gz DKNUUODXQOPAQE-JTQLQIEISA-N 1 2 248.301 2.499 20 0 BEADLO Cc1cc(N2CCC[C@@H]2CCO)nc(C(C)C)[nH+]1 ZINC000336787116 178115355 /nfs/dbraw/zinc/11/53/55/178115355.db2.gz KMSCGIQPWPTZAW-GFCCVEGCSA-N 1 2 249.358 2.260 20 0 BEADLO Cc1cc(N)nc(SCC[C@@H](C)F)[nH+]1 ZINC000308553888 178109748 /nfs/dbraw/zinc/10/97/48/178109748.db2.gz YODDEYNJZJBLFG-ZCFIWIBFSA-N 1 2 215.297 2.207 20 0 BEADLO Cc1cc(N2CCOCC3(CCCC3)C2)nc[nH+]1 ZINC000302349834 178116505 /nfs/dbraw/zinc/11/65/05/178116505.db2.gz CYHARWIGIHWUPX-UHFFFAOYSA-N 1 2 247.342 2.182 20 0 BEADLO Cc1cc(N2C[C@@H]3CC=CC[C@@H]3C2)nc[nH+]1 ZINC000301458031 178122819 /nfs/dbraw/zinc/12/28/19/178122819.db2.gz ZHBCDCWFJNWEDW-TXEJJXNPSA-N 1 2 215.300 2.187 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccn[nH]1)c1ccncc1 ZINC000164689595 398202969 /nfs/dbraw/zinc/20/29/69/398202969.db2.gz MODQDDYEJPBETA-GFCCVEGCSA-N 1 2 216.288 2.046 20 0 BEADLO Cc1cc(NC(=O)C2(CCF)CC2)cc[nH+]1 ZINC000289644489 178126060 /nfs/dbraw/zinc/12/60/60/178126060.db2.gz WWQRUIPBPHOTTC-UHFFFAOYSA-N 1 2 222.263 2.468 20 0 BEADLO Cc1cc(NC(=O)CCc2cscn2)cc[nH+]1 ZINC000074644893 178128630 /nfs/dbraw/zinc/12/86/30/178128630.db2.gz JUZBXHKEHRNRCE-UHFFFAOYSA-N 1 2 247.323 2.418 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2ncnn2C)cc1F ZINC000094955581 398206843 /nfs/dbraw/zinc/20/68/43/398206843.db2.gz JQEALJQJUGMQMP-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO Cc1cc(NC(=O)C[C@@H]2CCC(=O)[C@@H]2C)cc[nH+]1 ZINC000280629142 178134085 /nfs/dbraw/zinc/13/40/85/178134085.db2.gz XDBKIMDFRULIHV-MNOVXSKESA-N 1 2 246.310 2.334 20 0 BEADLO CCc1cc(N2CCO[C@H]3CCC[C@@H]32)nc(C)[nH+]1 ZINC000272900746 538926631 /nfs/dbraw/zinc/92/66/31/538926631.db2.gz PONUBIQILVWCIL-STQMWFEESA-N 1 2 247.342 2.105 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2CCCOCC2)cc[nH+]1 ZINC000180609209 178142144 /nfs/dbraw/zinc/14/21/44/178142144.db2.gz WUTPUITYFNKNCY-NSHDSACASA-N 1 2 249.314 2.081 20 0 BEADLO Cc1cc(NC(=O)N[C@H](C)C(F)(F)F)cc[nH+]1 ZINC000288982489 178142217 /nfs/dbraw/zinc/14/22/17/178142217.db2.gz ZIIIWFSKENMWQG-SSDOTTSWSA-N 1 2 247.220 2.462 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CCC(C)(C)O2)cc[nH+]1 ZINC000278268725 178145612 /nfs/dbraw/zinc/14/56/12/178145612.db2.gz AOACCTOUXMNHAX-NSHDSACASA-N 1 2 234.299 2.286 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CCCO[C@H]2C)cc[nH+]1 ZINC000191633083 178145732 /nfs/dbraw/zinc/14/57/32/178145732.db2.gz FVJQVWUCAKIBCA-CMPLNLGQSA-N 1 2 234.299 2.144 20 0 BEADLO Cc1cc(NCCC(C)(C)C2CC2)nc[nH+]1 ZINC000336894921 398218075 /nfs/dbraw/zinc/21/80/75/398218075.db2.gz XZRYDMORNHUWJS-UHFFFAOYSA-N 1 2 219.332 2.445 20 0 BEADLO CCC(CC)CC(=O)N1CCn2c[nH+]cc2C1 ZINC000378071036 168344044 /nfs/dbraw/zinc/34/40/44/168344044.db2.gz PQEWNRWTJUDJHB-UHFFFAOYSA-N 1 2 235.331 2.052 20 0 BEADLO Cc1cc(NCCC2(F)CCC2)nc[nH+]1 ZINC000309196138 178158060 /nfs/dbraw/zinc/15/80/60/178158060.db2.gz QPOMMQVYIRETGS-UHFFFAOYSA-N 1 2 209.268 2.479 20 0 BEADLO Cc1cc(NCCCO)c2cccc(F)c2[nH+]1 ZINC000119731561 178159912 /nfs/dbraw/zinc/15/99/12/178159912.db2.gz TUUITVPJPBXZND-UHFFFAOYSA-N 1 2 234.274 2.477 20 0 BEADLO Cc1cc(NCCOC(C)C)nc(C2CC2)[nH+]1 ZINC000182641523 178161531 /nfs/dbraw/zinc/16/15/31/178161531.db2.gz GSZGKJWEIGIWQW-UHFFFAOYSA-N 1 2 235.331 2.499 20 0 BEADLO Cc1cc(NC[C@@H](C)O)c2cccc(F)c2[nH+]1 ZINC000119751807 178164189 /nfs/dbraw/zinc/16/41/89/178164189.db2.gz FETYZNCZTLWBGG-SECBINFHSA-N 1 2 234.274 2.475 20 0 BEADLO Cc1cc(NC[C@@H](O)C(C)(C)C)nc(C2CC2)[nH+]1 ZINC000265392202 178164486 /nfs/dbraw/zinc/16/44/86/178164486.db2.gz UWSZLJYKMKWJNN-LLVKDONJSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1cc(NC[C@@H]2CCCO2)nc(C2CC2)[nH+]1 ZINC000264606554 178166484 /nfs/dbraw/zinc/16/64/84/178166484.db2.gz DELBYZQPMJELIX-NSHDSACASA-N 1 2 233.315 2.253 20 0 BEADLO Cc1cc(NC[C@@](C)(O)c2ccsc2)nc[nH+]1 ZINC000301324809 178166687 /nfs/dbraw/zinc/16/66/87/178166687.db2.gz AGBVYNAKQJGZHE-GFCCVEGCSA-N 1 2 249.339 2.166 20 0 BEADLO Cc1cc(NC[C@H](C)CCO)nc(C(C)C)[nH+]1 ZINC000097442930 178169155 /nfs/dbraw/zinc/16/91/55/178169155.db2.gz YYKTXZSDRDMCID-SNVBAGLBSA-N 1 2 237.347 2.339 20 0 BEADLO Cc1cc(NC[C@H]2CCCO2)nc(C(C)C)[nH+]1 ZINC000035121226 178169638 /nfs/dbraw/zinc/16/96/38/178169638.db2.gz MXQGUDNACBJQGZ-LLVKDONJSA-N 1 2 235.331 2.499 20 0 BEADLO Cc1cc(NC[C@]2(C)CCCC[C@@H]2O)nc[nH+]1 ZINC000301474727 178170378 /nfs/dbraw/zinc/17/03/78/178170378.db2.gz AHEPIOMBFGJXLT-AAEUAGOBSA-N 1 2 235.331 2.138 20 0 BEADLO Cc1cc(NC[C@H]2CCOC2)nc(C2CC2)[nH+]1 ZINC000116260281 178170669 /nfs/dbraw/zinc/17/06/69/178170669.db2.gz BOMCLHKLEYIREY-SNVBAGLBSA-N 1 2 233.315 2.111 20 0 BEADLO CC[C@@H](C)[C@@H](CNc1ccc(CO)c[nH+]1)OC ZINC000381120029 398221916 /nfs/dbraw/zinc/22/19/16/398221916.db2.gz FADDMKDJWLWIMC-ZYHUDNBSSA-N 1 2 238.331 2.047 20 0 BEADLO Cc1noc(C)c1C[C@H](C)Nc1cc(C)[nH+]cn1 ZINC000301389135 178178074 /nfs/dbraw/zinc/17/80/74/178178074.db2.gz XVVCAHPASJRNIL-VIFPVBQESA-N 1 2 246.314 2.433 20 0 BEADLO Cc1cc(N[C@@H](C)CF)nc(C2CC2)[nH+]1 ZINC000288365436 178178241 /nfs/dbraw/zinc/17/82/41/178178241.db2.gz XZUFQVLLMMBBII-QMMMGPOBSA-N 1 2 209.268 2.432 20 0 BEADLO Cc1cc(N[C@@H](C)c2cccnc2)nc[nH+]1 ZINC000040727171 178180655 /nfs/dbraw/zinc/18/06/55/178180655.db2.gz MMDGQYUASARXJO-JTQLQIEISA-N 1 2 214.272 2.353 20 0 BEADLO Cc1cc(N[C@H]2CCCSC2)nc[nH+]1 ZINC000129212239 178188875 /nfs/dbraw/zinc/18/88/75/178188875.db2.gz CLYCWZPJISRFDZ-VIFPVBQESA-N 1 2 209.318 2.093 20 0 BEADLO Cc1cc(N[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)nc[nH+]1 ZINC000301340690 178184147 /nfs/dbraw/zinc/18/41/47/178184147.db2.gz HYFQIEHTACFCKU-JLLWLGSASA-N 1 2 233.315 2.010 20 0 BEADLO Cc1cc(N[C@H](C)C[C@H](O)c2ccco2)nc[nH+]1 ZINC000301647084 178185917 /nfs/dbraw/zinc/18/59/17/178185917.db2.gz PZAWYYXLNAANGK-MNOVXSKESA-N 1 2 247.298 2.302 20 0 BEADLO Cc1cc(N[C@H](C)c2ccccn2)nc[nH+]1 ZINC000040727181 178186923 /nfs/dbraw/zinc/18/69/23/178186923.db2.gz DIPCRSXYEIXURA-SNVBAGLBSA-N 1 2 214.272 2.353 20 0 BEADLO Cc1cc(N[C@H]2CCC[C@H]2OC(F)F)nc[nH+]1 ZINC000336907560 178190318 /nfs/dbraw/zinc/19/03/18/178190318.db2.gz FYQYFRVPDHDALM-DTWKUNHWSA-N 1 2 243.257 2.357 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(O[C@@H]2CCOC2)cc1 ZINC000649428138 398229540 /nfs/dbraw/zinc/22/95/40/398229540.db2.gz IXOGQEGXZPRPCM-CYBMUJFWSA-N 1 2 244.294 2.255 20 0 BEADLO C/C=C\C[C@@H]1CCCN(C(=O)Cn2cc[nH+]c2)C1 ZINC000629871535 361745444 /nfs/dbraw/zinc/74/54/44/361745444.db2.gz QYSZMHHGQJFUKY-XQJDBVBESA-N 1 2 247.342 2.088 20 0 BEADLO Cc1cc(OCC2OCCO2)c2ccccc2[nH+]1 ZINC000194734071 178209917 /nfs/dbraw/zinc/20/99/17/178209917.db2.gz PLGURGXPRATTTB-UHFFFAOYSA-N 1 2 245.278 2.295 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2conc2C)C[C@H](CC)O1 ZINC000421392702 192328238 /nfs/dbraw/zinc/32/82/38/192328238.db2.gz RDMWBXWVCHPJLQ-BETUJISGSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2conc2C)C[C@H](CC)O1 ZINC000421392702 192328239 /nfs/dbraw/zinc/32/82/39/192328239.db2.gz RDMWBXWVCHPJLQ-BETUJISGSA-N 1 2 238.331 2.372 20 0 BEADLO C[C@H]1N(c2cccc[nH+]2)CCC12CCOCC2 ZINC000334444860 136225725 /nfs/dbraw/zinc/22/57/25/136225725.db2.gz HVURGKGONBLRFV-GFCCVEGCSA-N 1 2 232.327 2.477 20 0 BEADLO CC(C)n1cc(C(C)(C)[NH2+]Cc2ccco2)nn1 ZINC000421406661 192331892 /nfs/dbraw/zinc/33/18/92/192331892.db2.gz UGIDFXXZYZQQBP-UHFFFAOYSA-N 1 2 248.330 2.477 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CCOCC2(C)C)cn1 ZINC000179556754 259304449 /nfs/dbraw/zinc/30/44/49/259304449.db2.gz JBTXKVRYVUZRDR-UHFFFAOYSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1cc(C[N@H+]2CCOCC2(C)C)cn1 ZINC000179556754 259304451 /nfs/dbraw/zinc/30/44/51/259304451.db2.gz JBTXKVRYVUZRDR-UHFFFAOYSA-N 1 2 237.347 2.075 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2ccoc2)nn1C ZINC000282320095 178229767 /nfs/dbraw/zinc/22/97/67/178229767.db2.gz UFZALVWQJWLZPM-SNVBAGLBSA-N 1 2 219.288 2.172 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@@H]2CCCc3cn[nH]c32)no1 ZINC000285316714 178230825 /nfs/dbraw/zinc/23/08/25/178230825.db2.gz SVUKLVXVIZDLGU-MWLCHTKSSA-N 1 2 246.314 2.434 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@@H]2CCCc3c[nH]nc32)no1 ZINC000285316714 178230827 /nfs/dbraw/zinc/23/08/27/178230827.db2.gz SVUKLVXVIZDLGU-MWLCHTKSSA-N 1 2 246.314 2.434 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2cn[nH]c2)no1 ZINC000309553358 178232190 /nfs/dbraw/zinc/23/21/90/178232190.db2.gz IXWPBUKVBUFOKI-RKDXNWHRSA-N 1 2 220.276 2.118 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2cnn(C)c2C)no1 ZINC000337533623 178232327 /nfs/dbraw/zinc/23/23/27/178232327.db2.gz FCDJXJFRDXKBJW-NXEZZACHSA-N 1 2 248.330 2.437 20 0 BEADLO COCCOCc1cccc(-c2c[nH+]cn2C)c1 ZINC000649433881 398235395 /nfs/dbraw/zinc/23/53/95/398235395.db2.gz LWPJODAJTXNUTI-UHFFFAOYSA-N 1 2 246.310 2.250 20 0 BEADLO Cc1ccsc1CNC(=O)CCc1c[nH+]c[nH]1 ZINC000280567788 538936908 /nfs/dbraw/zinc/93/69/08/538936908.db2.gz LMKUFPLENJFYQD-UHFFFAOYSA-N 1 2 249.339 2.029 20 0 BEADLO Cc1ccsc1CNC(=O)CCc1c[nH]c[nH+]1 ZINC000280567788 538936910 /nfs/dbraw/zinc/93/69/10/538936910.db2.gz LMKUFPLENJFYQD-UHFFFAOYSA-N 1 2 249.339 2.029 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2cnn[nH]2)c(C)s1 ZINC000284019561 178249815 /nfs/dbraw/zinc/24/98/15/178249815.db2.gz OFEDXLGOGPTMHU-QMMMGPOBSA-N 1 2 236.344 2.334 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2c[nH]nn2)c(C)s1 ZINC000284019561 178249817 /nfs/dbraw/zinc/24/98/17/178249817.db2.gz OFEDXLGOGPTMHU-QMMMGPOBSA-N 1 2 236.344 2.334 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2cn[nH]n2)c(C)s1 ZINC000284019561 178249819 /nfs/dbraw/zinc/24/98/19/178249819.db2.gz OFEDXLGOGPTMHU-QMMMGPOBSA-N 1 2 236.344 2.334 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cnn(C(C)C)c2)CCO1 ZINC000179930918 259305928 /nfs/dbraw/zinc/30/59/28/259305928.db2.gz IVHRJCIBFWSMNN-ZDUSSCGKSA-N 1 2 237.347 2.075 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cnn(C(C)C)c2)CCO1 ZINC000179930918 259305929 /nfs/dbraw/zinc/30/59/29/259305929.db2.gz IVHRJCIBFWSMNN-ZDUSSCGKSA-N 1 2 237.347 2.075 20 0 BEADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ccnn2C)no1 ZINC000371396810 178265882 /nfs/dbraw/zinc/26/58/82/178265882.db2.gz UPGIMRBILRSSSO-CYBMUJFWSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccnn2C)no1 ZINC000371396810 178265883 /nfs/dbraw/zinc/26/58/83/178265883.db2.gz UPGIMRBILRSSSO-CYBMUJFWSA-N 1 2 246.314 2.054 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1csc(C)c1C ZINC000602442735 349528367 /nfs/dbraw/zinc/52/83/67/349528367.db2.gz WVYRWWOOSJBXOQ-UHFFFAOYSA-N 1 2 241.356 2.360 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1csc(C)c1C ZINC000602442735 349528371 /nfs/dbraw/zinc/52/83/71/349528371.db2.gz WVYRWWOOSJBXOQ-UHFFFAOYSA-N 1 2 241.356 2.360 20 0 BEADLO O=c1ccc(-c2ccc(N3CCCC3)[nH+]c2)c[nH]1 ZINC000649437724 398239706 /nfs/dbraw/zinc/23/97/06/398239706.db2.gz BLRHRXCEGTVZCO-UHFFFAOYSA-N 1 2 241.294 2.449 20 0 BEADLO Cc1cc(C)nc(NCCc2cccc(C)[nH+]2)n1 ZINC000281420951 538939103 /nfs/dbraw/zinc/93/91/03/538939103.db2.gz IOWFKVFDBBGHRC-UHFFFAOYSA-N 1 2 242.326 2.451 20 0 BEADLO CCC(CC)C[NH2+][C@@H](CC(F)F)C(=O)OC ZINC000309994813 168363018 /nfs/dbraw/zinc/36/30/18/168363018.db2.gz BVMSOMOJWZUXLB-VIFPVBQESA-N 1 2 237.290 2.209 20 0 BEADLO C[C@@]1(C(=O)N2CC(n3cc[nH+]c3)C2)CC=CCC1 ZINC000576464043 365602482 /nfs/dbraw/zinc/60/24/82/365602482.db2.gz PGJADGVZMQFHRX-CQSZACIVSA-N 1 2 245.326 2.013 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2ccon2)cn1 ZINC000336775825 398240852 /nfs/dbraw/zinc/24/08/52/398240852.db2.gz CTXAUCGZZYPIBS-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO c1cc(-c2cc[nH+]c(N3CCOCC3)c2)co1 ZINC000649442629 398248000 /nfs/dbraw/zinc/24/80/00/398248000.db2.gz YGSRUBNBVNONPP-UHFFFAOYSA-N 1 2 230.267 2.178 20 0 BEADLO Cc1cc(N2C[C@@H](C)OC3(CCCC3)C2)nc[nH+]1 ZINC000645407147 398246462 /nfs/dbraw/zinc/24/64/62/398246462.db2.gz YSTOWNDEJJFLJX-GFCCVEGCSA-N 1 2 247.342 2.323 20 0 BEADLO C[C@@H](CC1CCC1)NC(=O)CCc1c[nH+]c[nH]1 ZINC000634369432 361824187 /nfs/dbraw/zinc/82/41/87/361824187.db2.gz AGHSXRJVMATJOY-JTQLQIEISA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H](CC1CCC1)NC(=O)CCc1c[nH]c[nH+]1 ZINC000634369432 361824190 /nfs/dbraw/zinc/82/41/90/361824190.db2.gz AGHSXRJVMATJOY-JTQLQIEISA-N 1 2 235.331 2.037 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CC[C@H]1SC ZINC000576631321 365642301 /nfs/dbraw/zinc/64/23/01/365642301.db2.gz ZPBLIYIVYQTSTA-WCBMZHEXSA-N 1 2 224.329 2.396 20 0 BEADLO CC(C)[NH2+][C@H](c1ncn[nH]1)C1CCCCC1 ZINC000381166837 398252427 /nfs/dbraw/zinc/25/24/27/398252427.db2.gz SMRYFGYXDOVQJE-NSHDSACASA-N 1 2 222.336 2.424 20 0 BEADLO Cc1noc(C)c1C[NH2+][C@@H](C)c1ccon1 ZINC000336780965 398253116 /nfs/dbraw/zinc/25/31/16/398253116.db2.gz STGXDMHCXWKVMV-QMMMGPOBSA-N 1 2 221.260 2.130 20 0 BEADLO Cc1noc(C)c1C[NH2+][C@H](C)c1ccon1 ZINC000336780964 398253138 /nfs/dbraw/zinc/25/31/38/398253138.db2.gz STGXDMHCXWKVMV-MRVPVSSYSA-N 1 2 221.260 2.130 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(=O)[C@H](C)C2)cs1 ZINC000306203815 398253405 /nfs/dbraw/zinc/25/34/05/398253405.db2.gz SSIIZELWCVWFII-SECBINFHSA-N 1 2 223.341 2.467 20 0 BEADLO Cc1cc(C[N@H+]2CCC(=O)[C@H](C)C2)cs1 ZINC000306203815 398253408 /nfs/dbraw/zinc/25/34/08/398253408.db2.gz SSIIZELWCVWFII-SECBINFHSA-N 1 2 223.341 2.467 20 0 BEADLO CC(C)CC[C@H](CO)Nc1cccc[nH+]1 ZINC000624530357 343995852 /nfs/dbraw/zinc/99/58/52/343995852.db2.gz JASICKQYWUWJKI-LLVKDONJSA-N 1 2 208.305 2.291 20 0 BEADLO CC(C)N(C(=O)[C@@H](C)Cc1c[nH+]c[nH]1)C1CCC1 ZINC000576716194 365668917 /nfs/dbraw/zinc/66/89/17/365668917.db2.gz SBVVHXBEYMEMIH-NSHDSACASA-N 1 2 249.358 2.378 20 0 BEADLO CC(C)N(C(=O)[C@@H](C)Cc1c[nH]c[nH+]1)C1CCC1 ZINC000576716194 365668922 /nfs/dbraw/zinc/66/89/22/365668922.db2.gz SBVVHXBEYMEMIH-NSHDSACASA-N 1 2 249.358 2.378 20 0 BEADLO CC(C)c1cc(C[NH2+][C@H](C)c2cnccn2)on1 ZINC000169241498 538947026 /nfs/dbraw/zinc/94/70/26/538947026.db2.gz BKZZOHHCGHGIFE-SNVBAGLBSA-N 1 2 246.314 2.439 20 0 BEADLO C[C@H]1C[C@H](C(=O)NCc2c[nH+]cn2C)C[C@@H](C)C1 ZINC000291473912 538948236 /nfs/dbraw/zinc/94/82/36/538948236.db2.gz PLBXVFZHNNDVGM-GDNZZTSVSA-N 1 2 249.358 2.109 20 0 BEADLO C[C@H]1c2cccn2CC[N@H+]1Cc1ccno1 ZINC000066864566 361826790 /nfs/dbraw/zinc/82/67/90/361826790.db2.gz PEAOXTBHZNQHNY-JTQLQIEISA-N 1 2 217.272 2.053 20 0 BEADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1ccno1 ZINC000066864566 361826796 /nfs/dbraw/zinc/82/67/96/361826796.db2.gz PEAOXTBHZNQHNY-JTQLQIEISA-N 1 2 217.272 2.053 20 0 BEADLO C[C@H](CC1CCC1)NC(=O)CCc1[nH]cc[nH+]1 ZINC000634369744 361827866 /nfs/dbraw/zinc/82/78/66/361827866.db2.gz HQHKQOHJTXMSMN-SNVBAGLBSA-N 1 2 235.331 2.037 20 0 BEADLO CCc1cc(NC[C@H]2CCCC2(F)F)nc[nH+]1 ZINC000390964583 398260776 /nfs/dbraw/zinc/26/07/76/398260776.db2.gz OGNBQJMXCGVDKP-SECBINFHSA-N 1 2 241.285 2.308 20 0 BEADLO CCCC(CCC)C(=O)NCc1c[nH+]cn1C ZINC000291322027 538947853 /nfs/dbraw/zinc/94/78/53/538947853.db2.gz UTDDNVUAHRJXMU-UHFFFAOYSA-N 1 2 237.347 2.253 20 0 BEADLO c1csc(C[N@@H+]2CCc3c[nH]nc3C2)c1 ZINC000204039373 538952858 /nfs/dbraw/zinc/95/28/58/538952858.db2.gz HJIALUZKSJMPCJ-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO c1csc(C[N@H+]2CCc3c[nH]nc3C2)c1 ZINC000204039373 538952859 /nfs/dbraw/zinc/95/28/59/538952859.db2.gz HJIALUZKSJMPCJ-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO c1csc(C[N@@H+]2CCc3cn[nH]c3C2)c1 ZINC000204039373 538952860 /nfs/dbraw/zinc/95/28/60/538952860.db2.gz HJIALUZKSJMPCJ-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO c1csc(C[N@H+]2CCc3cn[nH]c3C2)c1 ZINC000204039373 538952861 /nfs/dbraw/zinc/95/28/61/538952861.db2.gz HJIALUZKSJMPCJ-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO CCc1nocc1C[N@@H+]1C[C@H](C)OC(C)(C)C1 ZINC000335084954 136232786 /nfs/dbraw/zinc/23/27/86/136232786.db2.gz PLNMEOUEFDMXED-JTQLQIEISA-N 1 2 238.331 2.236 20 0 BEADLO CCc1nocc1C[N@H+]1C[C@H](C)OC(C)(C)C1 ZINC000335084954 136232787 /nfs/dbraw/zinc/23/27/87/136232787.db2.gz PLNMEOUEFDMXED-JTQLQIEISA-N 1 2 238.331 2.236 20 0 BEADLO Cc1csc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)n1 ZINC000081643011 398270548 /nfs/dbraw/zinc/27/05/48/398270548.db2.gz BWGYEDWDCLGQFB-AOOOYVTPSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1csc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)n1 ZINC000081643011 398270552 /nfs/dbraw/zinc/27/05/52/398270552.db2.gz BWGYEDWDCLGQFB-AOOOYVTPSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)sc1C ZINC000081643075 398270568 /nfs/dbraw/zinc/27/05/68/398270568.db2.gz PUTIIVXAWNMMPJ-DTORHVGOSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)sc1C ZINC000081643075 398270572 /nfs/dbraw/zinc/27/05/72/398270572.db2.gz PUTIIVXAWNMMPJ-DTORHVGOSA-N 1 2 240.372 2.369 20 0 BEADLO O[C@H]1C[N@H+](CC23CCC(CC2)C3)CC(F)(F)C1 ZINC000649473959 398272605 /nfs/dbraw/zinc/27/26/05/398272605.db2.gz VRUVISSALLODDX-MOENNCHZSA-N 1 2 245.313 2.269 20 0 BEADLO O[C@H]1C[N@@H+](CC23CCC(CC2)C3)CC(F)(F)C1 ZINC000649473959 398272606 /nfs/dbraw/zinc/27/26/06/398272606.db2.gz VRUVISSALLODDX-MOENNCHZSA-N 1 2 245.313 2.269 20 0 BEADLO OCCC[C@H]([NH2+]CC(F)F)c1ccccc1 ZINC000179750645 538956126 /nfs/dbraw/zinc/95/61/26/538956126.db2.gz VSWXBKZNTHWOME-NSHDSACASA-N 1 2 229.270 2.355 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]CCOc1ccccc1 ZINC000179987211 538956969 /nfs/dbraw/zinc/95/69/69/538956969.db2.gz KZOGBQUXKOQBGB-NSHDSACASA-N 1 2 245.326 2.448 20 0 BEADLO COC(=O)[C@H](C)[NH2+]C[C@@H](C)c1ccc(C)cc1 ZINC000600150728 342691392 /nfs/dbraw/zinc/69/13/92/342691392.db2.gz JSAYYUYQIPSVPZ-NEPJUHHUSA-N 1 2 235.327 2.250 20 0 BEADLO CCc1ccc(C[NH2+]Cc2ccno2)o1 ZINC000231882884 342742805 /nfs/dbraw/zinc/74/28/05/342742805.db2.gz MAFCMSOBHHTKRM-UHFFFAOYSA-N 1 2 206.245 2.120 20 0 BEADLO Cc1cc(CNC(=O)N(C)C2CC2)cc(C)[nH+]1 ZINC000335609780 136236616 /nfs/dbraw/zinc/23/66/16/136236616.db2.gz HTCVHMKJTAKTEV-UHFFFAOYSA-N 1 2 233.315 2.002 20 0 BEADLO CC[C@@H](C)[C@@H]([NH2+]Cc1ccccc1)C(=O)OC ZINC000035042625 342733707 /nfs/dbraw/zinc/73/37/07/342733707.db2.gz PTFWBRJIWLYMTF-DGCLKSJQSA-N 1 2 235.327 2.364 20 0 BEADLO CC1=C[C@H](C)C[N@H+](Cc2nc(C3CC3)nn2C)C1 ZINC000335365043 398287024 /nfs/dbraw/zinc/28/70/24/398287024.db2.gz GAIJFDWWGVSWML-JTQLQIEISA-N 1 2 246.358 2.091 20 0 BEADLO CC1=C[C@H](C)C[N@@H+](Cc2nc(C3CC3)nn2C)C1 ZINC000335365043 398287028 /nfs/dbraw/zinc/28/70/28/398287028.db2.gz GAIJFDWWGVSWML-JTQLQIEISA-N 1 2 246.358 2.091 20 0 BEADLO CCc1cc(NC[C@H]2CCCCO2)nc[nH+]1 ZINC000042822071 342782866 /nfs/dbraw/zinc/78/28/66/342782866.db2.gz DZXXWYIVOXLIDI-LLVKDONJSA-N 1 2 221.304 2.020 20 0 BEADLO C[C@@]1(C(=O)Nc2ccn3cc[nH+]c3c2)C[C@@H]1F ZINC000335614410 136237691 /nfs/dbraw/zinc/23/76/91/136237691.db2.gz YSISMSBRJNWMRE-JOYOIKCWSA-N 1 2 233.246 2.021 20 0 BEADLO CC1(C)CCCN1C(=O)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000336224051 342785723 /nfs/dbraw/zinc/78/57/23/342785723.db2.gz QNSYZNZKNBTPPB-JTQLQIEISA-N 1 2 247.342 2.231 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000421482428 192344770 /nfs/dbraw/zinc/34/47/70/192344770.db2.gz XWMVUJJTIAWTEB-JHJVBQTASA-N 1 2 244.338 2.441 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]C[C@H]1CCC(C)(C)O1 ZINC000187862172 538977355 /nfs/dbraw/zinc/97/73/55/538977355.db2.gz PJCNLSCTHJQXIV-MWLCHTKSSA-N 1 2 237.347 2.326 20 0 BEADLO CC[C@H]1CCCCN1C(=O)CCc1c[nH+]c[nH]1 ZINC000188385519 538978824 /nfs/dbraw/zinc/97/88/24/538978824.db2.gz IJUQKBXFSJQKSM-LBPRGKRZSA-N 1 2 235.331 2.133 20 0 BEADLO CC[C@H]1CCCCN1C(=O)CCc1c[nH]c[nH+]1 ZINC000188385519 538978826 /nfs/dbraw/zinc/97/88/26/538978826.db2.gz IJUQKBXFSJQKSM-LBPRGKRZSA-N 1 2 235.331 2.133 20 0 BEADLO COc1cccc(OC)c1-c1c[nH+]c(C)n1C ZINC000630050580 361913581 /nfs/dbraw/zinc/91/35/81/361913581.db2.gz CRBSTKZFYRCCDF-UHFFFAOYSA-N 1 2 232.283 2.413 20 0 BEADLO COc1cccc(-c2c[nH+]c(C)n2C)c1OC ZINC000630050720 361913897 /nfs/dbraw/zinc/91/38/97/361913897.db2.gz UJPWHUSOPPLDNU-UHFFFAOYSA-N 1 2 232.283 2.413 20 0 BEADLO CCC(CC)Nc1nc[nH+]c(N)c1Cl ZINC000227840912 168395178 /nfs/dbraw/zinc/39/51/78/168395178.db2.gz AVBTXKXFHZSLBJ-UHFFFAOYSA-N 1 2 214.700 2.313 20 0 BEADLO CCC(CC)Nc1[nH+]cnc(N)c1Cl ZINC000227840912 168395181 /nfs/dbraw/zinc/39/51/81/168395181.db2.gz AVBTXKXFHZSLBJ-UHFFFAOYSA-N 1 2 214.700 2.313 20 0 BEADLO CC(C)c1[nH+]cc(-c2cncnc2)n1C ZINC000630051820 361919863 /nfs/dbraw/zinc/91/98/63/361919863.db2.gz PBNVCLBAHMCGPT-UHFFFAOYSA-N 1 2 202.261 2.001 20 0 BEADLO COCCn1cc(-c2c[nH+]c(C(C)C)n2C)cn1 ZINC000630054512 361919935 /nfs/dbraw/zinc/91/99/35/361919935.db2.gz VZCPGPHWZTZSBJ-UHFFFAOYSA-N 1 2 248.330 2.053 20 0 BEADLO CC(C)c1[nH+]cc(-c2cnc3ccnn3c2)n1C ZINC000630053330 361923672 /nfs/dbraw/zinc/92/36/72/361923672.db2.gz PTDWUVNJIXDTJJ-UHFFFAOYSA-N 1 2 241.298 2.253 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H](C)OC3(CCC3)C2)on1 ZINC000335464009 398288989 /nfs/dbraw/zinc/28/89/89/398288989.db2.gz UESFSWIVRBBLKN-LLVKDONJSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H](C)OC3(CCC3)C2)on1 ZINC000335464009 398288991 /nfs/dbraw/zinc/28/89/91/398288991.db2.gz UESFSWIVRBBLKN-LLVKDONJSA-N 1 2 236.315 2.126 20 0 BEADLO CN(C)c1ccc(NCc2cc[nH]c2)c[nH+]1 ZINC000085579115 398289221 /nfs/dbraw/zinc/28/92/21/398289221.db2.gz FHQPQTXXHHKVAY-UHFFFAOYSA-N 1 2 216.288 2.088 20 0 BEADLO COc1ccsc1C[NH2+]Cc1cocn1 ZINC000380255966 538987934 /nfs/dbraw/zinc/98/79/34/538987934.db2.gz QJWZHISQIJGENE-UHFFFAOYSA-N 1 2 224.285 2.035 20 0 BEADLO Cc1cccc(N(C)C(=O)CCc2c[nH+]c[nH]2)c1 ZINC000188869854 538980010 /nfs/dbraw/zinc/98/00/10/538980010.db2.gz SMSMGKVOTLUTGV-UHFFFAOYSA-N 1 2 243.310 2.314 20 0 BEADLO Cc1cccc(N(C)C(=O)CCc2c[nH]c[nH+]2)c1 ZINC000188869854 538980012 /nfs/dbraw/zinc/98/00/12/538980012.db2.gz SMSMGKVOTLUTGV-UHFFFAOYSA-N 1 2 243.310 2.314 20 0 BEADLO C[C@@H]1CCC[C@H](C)CN1C(=O)CCc1c[nH+]c[nH]1 ZINC000189429937 538982613 /nfs/dbraw/zinc/98/26/13/538982613.db2.gz NFEKMZYJNSNQPU-NWDGAFQWSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H]1CCC[C@H](C)CN1C(=O)CCc1c[nH]c[nH+]1 ZINC000189429937 538982614 /nfs/dbraw/zinc/98/26/14/538982614.db2.gz NFEKMZYJNSNQPU-NWDGAFQWSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N(C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000189429917 538982781 /nfs/dbraw/zinc/98/27/81/538982781.db2.gz NFEKMZYJNSNQPU-VXGBXAGGSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N(C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000189429917 538982782 /nfs/dbraw/zinc/98/27/82/538982782.db2.gz NFEKMZYJNSNQPU-VXGBXAGGSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H]([NH2+][C@H]1CCCC1(F)F)c1cnn(C)c1 ZINC000381448318 539000897 /nfs/dbraw/zinc/00/08/97/539000897.db2.gz GOEHBXRMAKMBKG-WPRPVWTQSA-N 1 2 229.274 2.259 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N(C1CC1)C1CCCC1 ZINC000193154129 539002129 /nfs/dbraw/zinc/00/21/29/539002129.db2.gz UPLKMIUDGWCXIS-UHFFFAOYSA-N 1 2 247.342 2.276 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N(C1CC1)C1CCCC1 ZINC000193154129 539002131 /nfs/dbraw/zinc/00/21/31/539002131.db2.gz UPLKMIUDGWCXIS-UHFFFAOYSA-N 1 2 247.342 2.276 20 0 BEADLO CCC(CC)[C@@H](C)C(=O)NCc1[nH]c[nH+]c1C ZINC000330536984 168398577 /nfs/dbraw/zinc/39/85/77/168398577.db2.gz PRILGTLRFDPGBV-SECBINFHSA-N 1 2 237.347 2.407 20 0 BEADLO O=C(N1CCCC[C@@H]1c1[nH]cc[nH+]1)C12CC(C1)C2 ZINC000624935162 342838175 /nfs/dbraw/zinc/83/81/75/342838175.db2.gz MYQQCCCXFWRBMR-IQLKVPPVSA-N 1 2 245.326 2.263 20 0 BEADLO Cc1cc2ncn(Cc3[nH+]ccn3C)c2cc1C ZINC000131896154 398294594 /nfs/dbraw/zinc/29/45/94/398294594.db2.gz WHJQDGRREMKIEI-UHFFFAOYSA-N 1 2 240.310 2.435 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N[C@@H]1CC12CCCCC2 ZINC000193742502 539007504 /nfs/dbraw/zinc/00/75/04/539007504.db2.gz CBNWVNNLJXLHFK-GFCCVEGCSA-N 1 2 247.342 2.181 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N[C@@H]1CC12CCCCC2 ZINC000193742502 539007505 /nfs/dbraw/zinc/00/75/05/539007505.db2.gz CBNWVNNLJXLHFK-GFCCVEGCSA-N 1 2 247.342 2.181 20 0 BEADLO CC(C)[C@H](NC(=O)[C@H]1C[C@H]2C[C@H]2C1)c1[nH]cc[nH+]1 ZINC000640724857 361963308 /nfs/dbraw/zinc/96/33/08/361963308.db2.gz WKQNXQPXLACOGN-QCNOEVLYSA-N 1 2 247.342 2.269 20 0 BEADLO C[C@@H](NC(=O)CCc1c[nH+]c[nH]1)c1cccs1 ZINC000195033795 539009539 /nfs/dbraw/zinc/00/95/39/539009539.db2.gz FFXSWCGYTNTFFP-SECBINFHSA-N 1 2 249.339 2.281 20 0 BEADLO C[C@@H](NC(=O)CCc1c[nH]c[nH+]1)c1cccs1 ZINC000195033795 539009540 /nfs/dbraw/zinc/00/95/40/539009540.db2.gz FFXSWCGYTNTFFP-SECBINFHSA-N 1 2 249.339 2.281 20 0 BEADLO C[C@@H]1CCC[C@H](CNC(=O)CCc2c[nH+]c[nH]2)C1 ZINC000192865207 538998602 /nfs/dbraw/zinc/99/86/02/538998602.db2.gz YUMDTPXVKQSMRP-NEPJUHHUSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1CCC[C@H](CNC(=O)CCc2c[nH]c[nH+]2)C1 ZINC000192865207 538998604 /nfs/dbraw/zinc/99/86/04/538998604.db2.gz YUMDTPXVKQSMRP-NEPJUHHUSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCCC1(F)F)c1cnn(C)c1 ZINC000381448317 539000573 /nfs/dbraw/zinc/00/05/73/539000573.db2.gz GOEHBXRMAKMBKG-WCBMZHEXSA-N 1 2 229.274 2.259 20 0 BEADLO CC[C@H]([NH2+]CC(F)F)c1c(C)nn(C)c1C ZINC000390791370 539027619 /nfs/dbraw/zinc/02/76/19/539027619.db2.gz CFODTRKXHMZKQE-VIFPVBQESA-N 1 2 231.290 2.343 20 0 BEADLO Cc1cc2ccccc2[nH+]c1N1C[C@H](O)[C@@H](C)C1 ZINC000388110775 539014341 /nfs/dbraw/zinc/01/43/41/539014341.db2.gz XEVKQVYNGWTJMZ-FZMZJTMJSA-N 1 2 242.322 2.360 20 0 BEADLO CCOC[C@@H]1CCC[C@@H]1Nc1c[nH]c[nH+]1 ZINC000389996896 539019415 /nfs/dbraw/zinc/01/94/15/539019415.db2.gz QULDALVYEBNYEP-UWVGGRQHSA-N 1 2 209.293 2.027 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)o1 ZINC000348896441 136243538 /nfs/dbraw/zinc/24/35/38/136243538.db2.gz VDBIECJXDMKQBJ-OUAUKWLOSA-N 1 2 224.304 2.153 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)o1 ZINC000348896441 136243539 /nfs/dbraw/zinc/24/35/39/136243539.db2.gz VDBIECJXDMKQBJ-OUAUKWLOSA-N 1 2 224.304 2.153 20 0 BEADLO Cc1ncsc1C[N@@H+](C)Cc1ccnc(C)n1 ZINC000351353121 136244754 /nfs/dbraw/zinc/24/47/54/136244754.db2.gz SFCXJIJVKZNWOX-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO Cc1ncsc1C[N@H+](C)Cc1ccnc(C)n1 ZINC000351353121 136244755 /nfs/dbraw/zinc/24/47/55/136244755.db2.gz SFCXJIJVKZNWOX-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO COCC[C@H](C)CNc1[nH+]cccc1OC ZINC000624276047 398317265 /nfs/dbraw/zinc/31/72/65/398317265.db2.gz AVXLOKYWGNLZDA-JTQLQIEISA-N 1 2 224.304 2.175 20 0 BEADLO CC[C@@H](C)C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000336342822 398318030 /nfs/dbraw/zinc/31/80/30/398318030.db2.gz KOYBOSVHNNRALI-NXEZZACHSA-N 1 2 221.304 2.119 20 0 BEADLO Clc1ccc(C[NH2+]Cc2ccn[nH]2)cc1 ZINC000036900278 342913029 /nfs/dbraw/zinc/91/30/29/342913029.db2.gz OLYMECXXCOHVRU-UHFFFAOYSA-N 1 2 221.691 2.353 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000421460470 192346877 /nfs/dbraw/zinc/34/68/77/192346877.db2.gz PYEUIYOCZOHUCV-IJLUTSLNSA-N 1 2 230.311 2.187 20 0 BEADLO c1nc(N2CCCC2)cc(N2CCCCC2)[nH+]1 ZINC000105785143 398324699 /nfs/dbraw/zinc/32/46/99/398324699.db2.gz LWYVHBYBHMSMQN-UHFFFAOYSA-N 1 2 232.331 2.067 20 0 BEADLO c1nc(N2CCCCC2)cc(N2CCCC2)[nH+]1 ZINC000105785143 398324701 /nfs/dbraw/zinc/32/47/01/398324701.db2.gz LWYVHBYBHMSMQN-UHFFFAOYSA-N 1 2 232.331 2.067 20 0 BEADLO Cc1cc(N2CCC[C@H]2C2CC2)nc[nH+]1 ZINC000602601132 349647707 /nfs/dbraw/zinc/64/77/07/349647707.db2.gz XYKYJGXTPDSVRI-NSHDSACASA-N 1 2 203.289 2.164 20 0 BEADLO C(c1noc(C2CC2)n1)[N@@H+]1C[C@H]2CCCC[C@H]21 ZINC000368089625 398329767 /nfs/dbraw/zinc/32/97/67/398329767.db2.gz NABSOXQNKTYVPT-GHMZBOCLSA-N 1 2 233.315 2.321 20 0 BEADLO C(c1noc(C2CC2)n1)[N@H+]1C[C@H]2CCCC[C@H]21 ZINC000368089625 398329769 /nfs/dbraw/zinc/32/97/69/398329769.db2.gz NABSOXQNKTYVPT-GHMZBOCLSA-N 1 2 233.315 2.321 20 0 BEADLO COC(=O)[C@@H](C)[NH2+]C[C@@]1(C)C[C@@H]1c1ccccc1 ZINC000602643733 349656186 /nfs/dbraw/zinc/65/61/86/349656186.db2.gz IURWDFZLHXOIKL-UXIGCNINSA-N 1 2 247.338 2.331 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccccc1 ZINC000602645313 349657181 /nfs/dbraw/zinc/65/71/81/349657181.db2.gz RLWGYDKRNZQIQS-XCCSTKFXSA-N 1 2 247.338 2.330 20 0 BEADLO Cc1csc(C[N@@H+]2CCOCC3(CC3)C2)n1 ZINC000336489352 398332727 /nfs/dbraw/zinc/33/27/27/398332727.db2.gz JKOQJKGDXNVOKR-UHFFFAOYSA-N 1 2 238.356 2.064 20 0 BEADLO Cc1csc(C[N@H+]2CCOCC3(CC3)C2)n1 ZINC000336489352 398332728 /nfs/dbraw/zinc/33/27/28/398332728.db2.gz JKOQJKGDXNVOKR-UHFFFAOYSA-N 1 2 238.356 2.064 20 0 BEADLO CC(C)OC(=O)[C@H](C)[NH2+][C@@H]1CCC12CCC2 ZINC000602682771 349674431 /nfs/dbraw/zinc/67/44/31/349674431.db2.gz RRVMECSVPZEWFH-WDEREUQCSA-N 1 2 225.332 2.249 20 0 BEADLO CCOC1CC(C[N@@H+]2CCC(F)(F)C2)C1 ZINC000351757470 136251562 /nfs/dbraw/zinc/25/15/62/136251562.db2.gz NHWGASJAUMPIQP-UHFFFAOYSA-N 1 2 219.275 2.143 20 0 BEADLO CCOC1CC(C[N@H+]2CCC(F)(F)C2)C1 ZINC000351757470 136251563 /nfs/dbraw/zinc/25/15/63/136251563.db2.gz NHWGASJAUMPIQP-UHFFFAOYSA-N 1 2 219.275 2.143 20 0 BEADLO CC[C@@]1(C)CCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493657087 529521657 /nfs/dbraw/zinc/52/16/57/529521657.db2.gz KBIFOZUALOYETQ-GXMNPTEKSA-N 1 2 247.342 2.462 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N1CC(C)(CC)C1 ZINC000493433917 529550785 /nfs/dbraw/zinc/55/07/85/529550785.db2.gz NMIXKHGAXJGIEQ-VOTSOKGWSA-N 1 2 247.342 2.175 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)NCCC1(C)CC1 ZINC000492706603 529554025 /nfs/dbraw/zinc/55/40/25/529554025.db2.gz NOOMQNUCLOZVKW-SNAWJCMRSA-N 1 2 247.342 2.223 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N(C)[C@@H](C)C1CC1 ZINC000492450516 529557319 /nfs/dbraw/zinc/55/73/19/529557319.db2.gz RCWBGHITCXBCMM-TVRMLOFPSA-N 1 2 247.342 2.173 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N1CCC=C(C)C1 ZINC000493252168 529557399 /nfs/dbraw/zinc/55/73/99/529557399.db2.gz KITKECPZLVUMRR-SREVYHEPSA-N 1 2 245.326 2.095 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N1C[C@H](C)[C@H](C)C1 ZINC000492529445 529558865 /nfs/dbraw/zinc/55/88/65/529558865.db2.gz GTRDHPBTYMDQJK-DLXAAPBESA-N 1 2 247.342 2.031 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)/C=C\C1CCCC1 ZINC000493840542 529570849 /nfs/dbraw/zinc/57/08/49/529570849.db2.gz VWLFINZKZAWDBM-FPLPWBNLSA-N 1 2 247.342 2.266 20 0 BEADLO CCn1ccnc1C[N@H+](C)[C@H](C)c1ccncc1 ZINC000162445536 349709037 /nfs/dbraw/zinc/70/90/37/349709037.db2.gz FEYCBDICAFYNOI-GFCCVEGCSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1ccnc1C[N@@H+](C)[C@H](C)c1ccncc1 ZINC000162445536 349709040 /nfs/dbraw/zinc/70/90/40/349709040.db2.gz FEYCBDICAFYNOI-GFCCVEGCSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1cc[nH+]c1CN(C)[C@H](C)c1ccncc1 ZINC000162445536 349709044 /nfs/dbraw/zinc/70/90/44/349709044.db2.gz FEYCBDICAFYNOI-GFCCVEGCSA-N 1 2 244.342 2.491 20 0 BEADLO CC(C)N(C(=O)Cn1cc[nH+]c1)C1CCCC1 ZINC000076830241 342985754 /nfs/dbraw/zinc/98/57/54/342985754.db2.gz LHHKNWVIZMNSHI-UHFFFAOYSA-N 1 2 235.331 2.063 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)/C=C/C1CCCC1 ZINC000493840541 529568947 /nfs/dbraw/zinc/56/89/47/529568947.db2.gz VWLFINZKZAWDBM-BQYQJAHWSA-N 1 2 247.342 2.266 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)/C=C\C(C)(C)C ZINC000493589356 529570162 /nfs/dbraw/zinc/57/01/62/529570162.db2.gz SKOXANLWTOVJQE-SREVYHEPSA-N 1 2 235.331 2.122 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCCC[C@@H]1CC(=O)OC ZINC000602772069 349726169 /nfs/dbraw/zinc/72/61/69/349726169.db2.gz NXXXBXRJASJOKV-SNVBAGLBSA-N 1 2 249.301 2.449 20 0 BEADLO CCC(F)(F)C[N@H+]1CCCC[C@@H]1CC(=O)OC ZINC000602772069 349726174 /nfs/dbraw/zinc/72/61/74/349726174.db2.gz NXXXBXRJASJOKV-SNVBAGLBSA-N 1 2 249.301 2.449 20 0 BEADLO COC(=O)c1coc([C@H](C)[NH+]2[C@@H](C)C[C@@H]2C)n1 ZINC000602821411 349762335 /nfs/dbraw/zinc/76/23/35/349762335.db2.gz LVOZTAIBFNWLKG-CIUDSAMLSA-N 1 2 238.287 2.005 20 0 BEADLO Cc1[nH]ncc1C[NH2+]Cc1ccsc1 ZINC000037989249 343039921 /nfs/dbraw/zinc/03/99/21/343039921.db2.gz XOXMUEDRITZYRI-UHFFFAOYSA-N 1 2 207.302 2.069 20 0 BEADLO Cc1noc(C[N@@H+]2C[C@@H](C)C(F)(F)[C@@H](C)C2)n1 ZINC000625647465 344025049 /nfs/dbraw/zinc/02/50/49/344025049.db2.gz MHELDEAVUMZZJS-OCAPTIKFSA-N 1 2 245.273 2.101 20 0 BEADLO Cc1noc(C[N@H+]2C[C@@H](C)C(F)(F)[C@@H](C)C2)n1 ZINC000625647465 344025051 /nfs/dbraw/zinc/02/50/51/344025051.db2.gz MHELDEAVUMZZJS-OCAPTIKFSA-N 1 2 245.273 2.101 20 0 BEADLO CC[C@H](C)C[C@@H](C)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492811150 529675437 /nfs/dbraw/zinc/67/54/37/529675437.db2.gz KABRTXSSXCHHIF-TUISVCKWSA-N 1 2 235.331 2.364 20 0 BEADLO CC[C@H](C)C[C@@H](C)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492811146 529675575 /nfs/dbraw/zinc/67/55/75/529675575.db2.gz KABRTXSSXCHHIF-PFDYWKIBSA-N 1 2 235.331 2.364 20 0 BEADLO CC[C@H](C)C[C@H](C)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492811145 529679630 /nfs/dbraw/zinc/67/96/30/529679630.db2.gz KABRTXSSXCHHIF-OBOPVNRVSA-N 1 2 235.331 2.364 20 0 BEADLO CCN(Cc1c[nH+]cn1C)c1ccccc1 ZINC000177259454 346925265 /nfs/dbraw/zinc/92/52/65/346925265.db2.gz USWCJHJLDAMBNC-UHFFFAOYSA-N 1 2 215.300 2.447 20 0 BEADLO CS[C@H](C)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000421575736 192354965 /nfs/dbraw/zinc/35/49/65/192354965.db2.gz KTYOMJUFPRQJRQ-SNVBAGLBSA-N 1 2 238.356 2.066 20 0 BEADLO COc1c(N)[nH+]cnc1N[C@@H]1CCC(C)(C)C1 ZINC000130122746 343180068 /nfs/dbraw/zinc/18/00/68/343180068.db2.gz XHWIAFAZQBEDAN-MRVPVSSYSA-N 1 2 236.319 2.058 20 0 BEADLO COc1c(N)nc[nH+]c1N[C@@H]1CCC(C)(C)C1 ZINC000130122746 343180070 /nfs/dbraw/zinc/18/00/70/343180070.db2.gz XHWIAFAZQBEDAN-MRVPVSSYSA-N 1 2 236.319 2.058 20 0 BEADLO Cc1ccc(NCC2=CCCOC2)c[nH+]1 ZINC000124837521 343165506 /nfs/dbraw/zinc/16/55/06/343165506.db2.gz HOPVASRWRCDTQP-UHFFFAOYSA-N 1 2 204.273 2.149 20 0 BEADLO CC[C@@H](Nc1nc(C)ns1)c1[nH]cc[nH+]1 ZINC000125224756 343165558 /nfs/dbraw/zinc/16/55/58/343165558.db2.gz KVLMHMGLFJVEJV-SSDOTTSWSA-N 1 2 223.305 2.133 20 0 BEADLO Cc1ccc(C(=O)N[C@H](C)c2[nH]cc[nH+]2)s1 ZINC000125357643 343173089 /nfs/dbraw/zinc/17/30/89/343173089.db2.gz DIBOFCKTSDSJAQ-MRVPVSSYSA-N 1 2 235.312 2.271 20 0 BEADLO C[C@@H]1C[C@H](C)C[N@H+]1Cc1nnsc1Cl ZINC000125701070 343174051 /nfs/dbraw/zinc/17/40/51/343174051.db2.gz LCJLGTSJPQPJHW-NKWVEPMBSA-N 1 2 231.752 2.422 20 0 BEADLO C[C@@H]1C[C@H](C)C[N@@H+]1Cc1nnsc1Cl ZINC000125701070 343174052 /nfs/dbraw/zinc/17/40/52/343174052.db2.gz LCJLGTSJPQPJHW-NKWVEPMBSA-N 1 2 231.752 2.422 20 0 BEADLO Cc1ccc(C)c([S@](=O)Cc2c[nH+]cn2C)c1 ZINC000268228555 178504287 /nfs/dbraw/zinc/50/42/87/178504287.db2.gz UYSLHTGLUXXDLM-QGZVFWFLSA-N 1 2 248.351 2.345 20 0 BEADLO COC(=O)[C@H](CC(C)C)[NH2+]Cc1cccs1 ZINC000035036627 343283176 /nfs/dbraw/zinc/28/31/76/343283176.db2.gz ZKHYBXOKUYJFFF-NSHDSACASA-N 1 2 241.356 2.425 20 0 BEADLO COc1ccc(CNc2cccc[nH+]2)cc1O ZINC000019777003 343255958 /nfs/dbraw/zinc/25/59/58/343255958.db2.gz ZARSAHSWMORTGK-UHFFFAOYSA-N 1 2 230.267 2.408 20 0 BEADLO CCC1(C(=O)NCCc2c[nH+]cn2C)CCCC1 ZINC000121565705 343267985 /nfs/dbraw/zinc/26/79/85/343267985.db2.gz MGLAINOXPPAVSU-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO CC[C@@H]([NH2+][C@H](C)c1ccccc1)C(=O)OC ZINC000034431771 343270661 /nfs/dbraw/zinc/27/06/61/343270661.db2.gz KWPWOWNUGHMEDM-ZYHUDNBSSA-N 1 2 221.300 2.289 20 0 BEADLO Clc1ccccc1C[NH2+]Cc1csnn1 ZINC000036901874 343327209 /nfs/dbraw/zinc/32/72/09/343327209.db2.gz NJIWVXFTSZLWTL-UHFFFAOYSA-N 1 2 239.731 2.481 20 0 BEADLO COC(=O)[C@@H]([NH2+]C1CCCC1)c1ccccc1 ZINC000037853379 343358369 /nfs/dbraw/zinc/35/83/69/343358369.db2.gz QKFQMEIUHSOGNJ-ZDUSSCGKSA-N 1 2 233.311 2.433 20 0 BEADLO C[C@@H]1C[C@H]1CNc1ccc(Cn2cc[nH+]c2)cn1 ZINC000348838068 136302088 /nfs/dbraw/zinc/30/20/88/136302088.db2.gz LUKKZUFAGWMUCU-YPMHNXCESA-N 1 2 242.326 2.394 20 0 BEADLO C[C@@H](NC(=O)C(C1CC1)C1CC1)c1[nH]cc[nH+]1 ZINC000310191696 343377841 /nfs/dbraw/zinc/37/78/41/343377841.db2.gz YHZQIZBLKKYPAY-MRVPVSSYSA-N 1 2 233.315 2.023 20 0 BEADLO CC[N@H+](CC(F)F)C[C@H]1CCCOC1 ZINC000348832525 136303303 /nfs/dbraw/zinc/30/33/03/136303303.db2.gz IRZNQABIUPISGR-SECBINFHSA-N 1 2 207.264 2.000 20 0 BEADLO CC[N@@H+](CC(F)F)C[C@H]1CCCOC1 ZINC000348832525 136303304 /nfs/dbraw/zinc/30/33/04/136303304.db2.gz IRZNQABIUPISGR-SECBINFHSA-N 1 2 207.264 2.000 20 0 BEADLO Fc1cc(C[NH2+]Cc2ncc[nH]2)ccc1Cl ZINC000070819449 343350917 /nfs/dbraw/zinc/35/09/17/343350917.db2.gz ZJSVOSXYEQZZOW-UHFFFAOYSA-N 1 2 239.681 2.492 20 0 BEADLO CC[C@H](O)Cn1c[nH+]c2cc(C)c(C)cc21 ZINC000037694324 343351775 /nfs/dbraw/zinc/35/17/75/343351775.db2.gz VHQOROOOFZUTKA-NSHDSACASA-N 1 2 218.300 2.424 20 0 BEADLO Cc1cc(CNC(=O)CC(F)(F)F)cc(C)[nH+]1 ZINC000421554381 192360247 /nfs/dbraw/zinc/36/02/47/192360247.db2.gz GERWSLKBMVFOBB-UHFFFAOYSA-N 1 2 246.232 2.267 20 0 BEADLO CC(C)c1noc(C[NH+]2[C@H](C)C[C@H]2C)n1 ZINC000335689914 136324728 /nfs/dbraw/zinc/32/47/28/136324728.db2.gz FCUWHMSQQGHXJU-RKDXNWHRSA-N 1 2 209.293 2.176 20 0 BEADLO CC(C)(O)Cn1cc[nH+]c1-c1ccccc1 ZINC000040228506 343398604 /nfs/dbraw/zinc/39/86/04/343398604.db2.gz FVFMSOGIBJVERQ-UHFFFAOYSA-N 1 2 216.284 2.321 20 0 BEADLO CC(C)c1noc(C[NH+]2[C@@H](C)C[C@@H]2C)n1 ZINC000335689913 136324825 /nfs/dbraw/zinc/32/48/25/136324825.db2.gz FCUWHMSQQGHXJU-IUCAKERBSA-N 1 2 209.293 2.176 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](Cc1ccnn1C)C2 ZINC000335692070 136325316 /nfs/dbraw/zinc/32/53/16/136325316.db2.gz LZVLWKCLHIEMQI-UHFFFAOYSA-N 1 2 227.311 2.244 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](Cc1ccnn1C)C2 ZINC000335692070 136325317 /nfs/dbraw/zinc/32/53/17/136325317.db2.gz LZVLWKCLHIEMQI-UHFFFAOYSA-N 1 2 227.311 2.244 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)c1ccc(Cl)cn1 ZINC000335695959 136326982 /nfs/dbraw/zinc/32/69/82/136326982.db2.gz GHONOQCGMYPMQW-UHFFFAOYSA-N 1 2 222.679 2.095 20 0 BEADLO OC1(CCn2c[nH+]c3cc(F)c(F)cc32)CC1 ZINC000335735577 136350102 /nfs/dbraw/zinc/35/01/02/136350102.db2.gz BAXMCPRANQIULA-UHFFFAOYSA-N 1 2 238.237 2.230 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1cc(C(F)(F)F)n[nH]1 ZINC000335702700 136334576 /nfs/dbraw/zinc/33/45/76/136334576.db2.gz ATFKDQDXRTYLIA-KNVOCYPGSA-N 1 2 233.237 2.411 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1cc(C(F)(F)F)n[nH]1 ZINC000335702700 136334577 /nfs/dbraw/zinc/33/45/77/136334577.db2.gz ATFKDQDXRTYLIA-KNVOCYPGSA-N 1 2 233.237 2.411 20 0 BEADLO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1nccn1C ZINC000335714846 136338711 /nfs/dbraw/zinc/33/87/11/136338711.db2.gz PSEADFFKOKGPNF-DTWKUNHWSA-N 1 2 247.264 2.193 20 0 BEADLO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1nccn1C ZINC000335714846 136338712 /nfs/dbraw/zinc/33/87/12/136338712.db2.gz PSEADFFKOKGPNF-DTWKUNHWSA-N 1 2 247.264 2.193 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccc(C)cc1 ZINC000042304323 343434534 /nfs/dbraw/zinc/43/45/34/343434534.db2.gz IGWZMYYHGGWSQY-WDEREUQCSA-N 1 2 221.300 2.207 20 0 BEADLO Cc1cnc(C[N@H+]2CCS[C@H](C)[C@H]2C)nc1 ZINC000335718370 136340211 /nfs/dbraw/zinc/34/02/11/136340211.db2.gz KECGXWRVDZEOQQ-GHMZBOCLSA-N 1 2 237.372 2.111 20 0 BEADLO Cc1cnc(C[N@@H+]2CCS[C@H](C)[C@H]2C)nc1 ZINC000335718370 136340212 /nfs/dbraw/zinc/34/02/12/136340212.db2.gz KECGXWRVDZEOQQ-GHMZBOCLSA-N 1 2 237.372 2.111 20 0 BEADLO CCCCc1cc(N[C@@H]2CCC[C@H]2O)nc[nH+]1 ZINC000631297964 343450131 /nfs/dbraw/zinc/45/01/31/343450131.db2.gz SSDULDQGEWPKQG-VXGBXAGGSA-N 1 2 235.331 2.145 20 0 BEADLO Cc1nc(C[N@@H+]2CCOC(C)(C)C2)c(C)s1 ZINC000335899182 136360154 /nfs/dbraw/zinc/36/01/54/136360154.db2.gz LAEVVKNZDDDAAC-UHFFFAOYSA-N 1 2 240.372 2.371 20 0 BEADLO Cc1nc(C[N@H+]2CCOC(C)(C)C2)c(C)s1 ZINC000335899182 136360155 /nfs/dbraw/zinc/36/01/55/136360155.db2.gz LAEVVKNZDDDAAC-UHFFFAOYSA-N 1 2 240.372 2.371 20 0 BEADLO C[N@@H+](Cc1cscn1)C[C@@H](O)c1ccccc1 ZINC000042867504 343456005 /nfs/dbraw/zinc/45/60/05/343456005.db2.gz GYOXUKRZNYEAQN-CYBMUJFWSA-N 1 2 248.351 2.309 20 0 BEADLO C[N@H+](Cc1cscn1)C[C@@H](O)c1ccccc1 ZINC000042867504 343456012 /nfs/dbraw/zinc/45/60/12/343456012.db2.gz GYOXUKRZNYEAQN-CYBMUJFWSA-N 1 2 248.351 2.309 20 0 BEADLO Cc1csc(C[N@H+]2CCO[C@@H](C)[C@H]2C)n1 ZINC000247978357 136373602 /nfs/dbraw/zinc/37/36/02/136373602.db2.gz IBIQFNRODUTJSF-ZJUUUORDSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1csc(C[N@@H+]2CCO[C@@H](C)[C@H]2C)n1 ZINC000247978357 136373603 /nfs/dbraw/zinc/37/36/03/136373603.db2.gz IBIQFNRODUTJSF-ZJUUUORDSA-N 1 2 226.345 2.061 20 0 BEADLO CSC1CC[NH+]([C@H](C)c2csnn2)CC1 ZINC000602921595 349810948 /nfs/dbraw/zinc/81/09/48/349810948.db2.gz USZNNYAGTGLFBH-MRVPVSSYSA-N 1 2 243.401 2.427 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1ccn(C)n1 ZINC000678233037 488221509 /nfs/dbraw/zinc/22/15/09/488221509.db2.gz AIINVXGRTCBFAO-UHFFFAOYSA-N 1 2 219.288 2.035 20 0 BEADLO C[C@H](c1ccco1)[N@H+](C)Cc1cnccn1 ZINC000584092592 343537888 /nfs/dbraw/zinc/53/78/88/343537888.db2.gz QWEKMNVESMIXQL-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H](c1ccco1)[N@@H+](C)Cc1cnccn1 ZINC000584092592 343537889 /nfs/dbraw/zinc/53/78/89/343537889.db2.gz QWEKMNVESMIXQL-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO CC(C)(C(=O)N1C[C@@H]2CCCC[C@@H]21)c1c[nH+]c[nH]1 ZINC000616723822 343550876 /nfs/dbraw/zinc/55/08/76/343550876.db2.gz VKUFHRQMKHDKBM-QWRGUYRKSA-N 1 2 247.342 2.088 20 0 BEADLO CC(C)CCC(=O)NCc1ccc(N(C)C)[nH+]c1 ZINC000046386639 343544634 /nfs/dbraw/zinc/54/46/34/343544634.db2.gz JIUGCLLUJGODAR-UHFFFAOYSA-N 1 2 249.358 2.200 20 0 BEADLO CC(C)(C)C[NH2+]Cc1[nH]ncc1Br ZINC000379408093 343500161 /nfs/dbraw/zinc/50/01/61/343500161.db2.gz AKFNSXCWVVYDGH-UHFFFAOYSA-N 1 2 246.152 2.308 20 0 BEADLO C[C@@H](CC(=O)NCc1[nH]cc[nH+]1)CC(C)(C)C ZINC000070991216 343582637 /nfs/dbraw/zinc/58/26/37/343582637.db2.gz NOTRDOPPJOZYIO-JTQLQIEISA-N 1 2 237.347 2.488 20 0 BEADLO CC(C)[C@H](NC(=O)[C@H](C)Cc1c[nH+]c[nH]1)C1CC1 ZINC000620033002 343586785 /nfs/dbraw/zinc/58/67/85/343586785.db2.gz HMJITIRHAVZWTI-MFKMUULPSA-N 1 2 249.358 2.139 20 0 BEADLO CC(C)[C@H](NC(=O)[C@H](C)Cc1c[nH]c[nH+]1)C1CC1 ZINC000620033002 343586787 /nfs/dbraw/zinc/58/67/87/343586787.db2.gz HMJITIRHAVZWTI-MFKMUULPSA-N 1 2 249.358 2.139 20 0 BEADLO CCCC(=O)NCc1ccccc1-n1cc[nH+]c1 ZINC000048926917 343590389 /nfs/dbraw/zinc/59/03/89/343590389.db2.gz KMNIKXPPJKIMBV-UHFFFAOYSA-N 1 2 243.310 2.289 20 0 BEADLO CCN(C#N)CC[N@@H+]1CC(C)(C)[C@H]1c1ccco1 ZINC000602927975 349821343 /nfs/dbraw/zinc/82/13/43/349821343.db2.gz UXFIDOFDYDVIMX-CYBMUJFWSA-N 1 2 247.342 2.465 20 0 BEADLO CCN(C#N)CC[N@H+]1CC(C)(C)[C@H]1c1ccco1 ZINC000602927975 349821345 /nfs/dbraw/zinc/82/13/45/349821345.db2.gz UXFIDOFDYDVIMX-CYBMUJFWSA-N 1 2 247.342 2.465 20 0 BEADLO CC(C)(C)OC(=O)C[NH2+][C@@H]1CCC1(C)C ZINC000379795479 343626780 /nfs/dbraw/zinc/62/67/80/343626780.db2.gz KHLPGPITWISKNL-SECBINFHSA-N 1 2 213.321 2.106 20 0 BEADLO Cc1ccccc1[N@H+](C)C[C@H]1CCNC(=O)CC1 ZINC000622764636 343650004 /nfs/dbraw/zinc/65/00/04/343650004.db2.gz VNNLUTOUNGNQTR-CYBMUJFWSA-N 1 2 246.354 2.348 20 0 BEADLO Cc1ccccc1[N@@H+](C)C[C@H]1CCNC(=O)CC1 ZINC000622764636 343650006 /nfs/dbraw/zinc/65/00/06/343650006.db2.gz VNNLUTOUNGNQTR-CYBMUJFWSA-N 1 2 246.354 2.348 20 0 BEADLO Cc1ccccc1N(C)Cc1c[nH+]cn1C ZINC000622764923 343651974 /nfs/dbraw/zinc/65/19/74/343651974.db2.gz JKMULQZNCNNRJR-UHFFFAOYSA-N 1 2 215.300 2.365 20 0 BEADLO CCc1nc(C[N@H+](C)CCc2ccccc2)no1 ZINC000054317304 343658053 /nfs/dbraw/zinc/65/80/53/343658053.db2.gz ACTHXJSBDMFJAK-UHFFFAOYSA-N 1 2 245.326 2.307 20 0 BEADLO CCc1nc(C[N@@H+](C)CCc2ccccc2)no1 ZINC000054317304 343658055 /nfs/dbraw/zinc/65/80/55/343658055.db2.gz ACTHXJSBDMFJAK-UHFFFAOYSA-N 1 2 245.326 2.307 20 0 BEADLO CC(C)c1nc(N[C@@H](C)CCCO)cc[nH+]1 ZINC000153923963 343706156 /nfs/dbraw/zinc/70/61/56/343706156.db2.gz NSPXVLDRDCRQDB-JTQLQIEISA-N 1 2 223.320 2.173 20 0 BEADLO COc1ccsc1C[N@H+](C)Cc1cn[nH]c1 ZINC000678266894 488230923 /nfs/dbraw/zinc/23/09/23/488230923.db2.gz WKDPEXRGRPJGGQ-UHFFFAOYSA-N 1 2 237.328 2.112 20 0 BEADLO COc1ccsc1C[N@@H+](C)Cc1cn[nH]c1 ZINC000678266894 488230925 /nfs/dbraw/zinc/23/09/25/488230925.db2.gz WKDPEXRGRPJGGQ-UHFFFAOYSA-N 1 2 237.328 2.112 20 0 BEADLO Cc1nc(N2CC[C@H](c3ccncc3)C2)cc[nH+]1 ZINC000624358888 343737204 /nfs/dbraw/zinc/73/72/04/343737204.db2.gz XQOQBRHLKRCAFJ-ZDUSSCGKSA-N 1 2 240.310 2.174 20 0 BEADLO Cc1cc[nH+]c([C@@H]2CCN(c3cnccn3)C2)c1 ZINC000624371278 343739440 /nfs/dbraw/zinc/73/94/40/343739440.db2.gz IMXNSUKPSWJQHA-GFCCVEGCSA-N 1 2 240.310 2.174 20 0 BEADLO Cc1c[nH+]c(C)nc1NCC[C@H]1CCO[C@H](C)C1 ZINC000576172689 343720920 /nfs/dbraw/zinc/72/09/20/343720920.db2.gz UVYZSDLJACJCAQ-YPMHNXCESA-N 1 2 249.358 2.132 20 0 BEADLO Cc1c[nH+]c(C)nc1NCC[C@@H]1CCO[C@H](C)C1 ZINC000576172687 343720935 /nfs/dbraw/zinc/72/09/35/343720935.db2.gz UVYZSDLJACJCAQ-DGCLKSJQSA-N 1 2 249.358 2.132 20 0 BEADLO CN(CC1CCC1)C(=O)c1ccc2[nH+]ccn2c1 ZINC000171892051 343772129 /nfs/dbraw/zinc/77/21/29/343772129.db2.gz KKDRDEKPANBSSE-UHFFFAOYSA-N 1 2 243.310 2.206 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NCC1CCCCC1 ZINC000584122121 343762519 /nfs/dbraw/zinc/76/25/19/343762519.db2.gz IUCWJRZGHLRAMR-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NCC1CCCCC1 ZINC000584122121 343762521 /nfs/dbraw/zinc/76/25/21/343762521.db2.gz IUCWJRZGHLRAMR-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H]1CC2(CCC2)CN1C(=O)CCc1c[nH+]c[nH]1 ZINC000336441270 537810853 /nfs/dbraw/zinc/81/08/53/537810853.db2.gz OZAOCIDTUBIWJM-NSHDSACASA-N 1 2 247.342 2.133 20 0 BEADLO C[C@H]1CC2(CCC2)CN1C(=O)CCc1c[nH]c[nH+]1 ZINC000336441270 537810862 /nfs/dbraw/zinc/81/08/62/537810862.db2.gz OZAOCIDTUBIWJM-NSHDSACASA-N 1 2 247.342 2.133 20 0 BEADLO CNc1cc(NCc2ccccc2F)nc[nH+]1 ZINC000128594787 343787826 /nfs/dbraw/zinc/78/78/26/343787826.db2.gz UOMBJGOMOXEXAD-UHFFFAOYSA-N 1 2 232.262 2.270 20 0 BEADLO CNc1cc(NCc2ccccc2F)[nH+]cn1 ZINC000128594787 343787827 /nfs/dbraw/zinc/78/78/27/343787827.db2.gz UOMBJGOMOXEXAD-UHFFFAOYSA-N 1 2 232.262 2.270 20 0 BEADLO C[C@@H]1COCC[N@@H+]1Cc1scnc1C1CC1 ZINC000336451474 537812157 /nfs/dbraw/zinc/81/21/57/537812157.db2.gz OBQMHVPSFHLJMJ-SECBINFHSA-N 1 2 238.356 2.241 20 0 BEADLO C[C@@H]1COCC[N@H+]1Cc1scnc1C1CC1 ZINC000336451474 537812166 /nfs/dbraw/zinc/81/21/66/537812166.db2.gz OBQMHVPSFHLJMJ-SECBINFHSA-N 1 2 238.356 2.241 20 0 BEADLO CCC(C)(CC)NC(=O)CCCn1cc[nH+]c1 ZINC000603118353 349872291 /nfs/dbraw/zinc/87/22/91/349872291.db2.gz RSQNBRFXYYSAHJ-UHFFFAOYSA-N 1 2 237.347 2.358 20 0 BEADLO CC(C)c1noc(C[N@H+](C)[C@@H]2CCSC2)n1 ZINC000179263898 346979185 /nfs/dbraw/zinc/97/91/85/346979185.db2.gz YTXIAPKBHSTUQT-SECBINFHSA-N 1 2 241.360 2.130 20 0 BEADLO CC(C)c1noc(C[N@@H+](C)[C@@H]2CCSC2)n1 ZINC000179263898 346979187 /nfs/dbraw/zinc/97/91/87/346979187.db2.gz YTXIAPKBHSTUQT-SECBINFHSA-N 1 2 241.360 2.130 20 0 BEADLO CCC(CC)CNC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000570519765 323062281 /nfs/dbraw/zinc/06/22/81/323062281.db2.gz ZWQZGSNWYLIZOX-LLVKDONJSA-N 1 2 237.347 2.387 20 0 BEADLO C[C@H]1C[C@H]1C[N@H+](C)Cc1noc(C2CC2)n1 ZINC000625470408 343874668 /nfs/dbraw/zinc/87/46/68/343874668.db2.gz FSFZFGBJPIALAZ-WPRPVWTQSA-N 1 2 221.304 2.035 20 0 BEADLO C[C@H]1C[C@H]1C[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000625470408 343874670 /nfs/dbraw/zinc/87/46/70/343874670.db2.gz FSFZFGBJPIALAZ-WPRPVWTQSA-N 1 2 221.304 2.035 20 0 BEADLO CCC[C@H](C)Nc1cc[nH+]c(C2CC2)n1 ZINC000393630365 343903290 /nfs/dbraw/zinc/90/32/90/343903290.db2.gz MVNAYXQNNJCFIC-VIFPVBQESA-N 1 2 205.305 2.376 20 0 BEADLO Cc1cc(NC(=O)C[C@@H](C)C(F)(F)F)cc[nH+]1 ZINC000625513642 343914655 /nfs/dbraw/zinc/91/46/55/343914655.db2.gz KNFIRLZBOZUWLV-SSDOTTSWSA-N 1 2 246.232 2.339 20 0 BEADLO Cc1cc(NC(=O)C[C@H](C)C(F)(F)F)cc[nH+]1 ZINC000625513662 343915043 /nfs/dbraw/zinc/91/50/43/343915043.db2.gz KNFIRLZBOZUWLV-ZETCQYMHSA-N 1 2 246.232 2.339 20 0 BEADLO CC1(C)CCCN1C(=O)c1ccc2[nH+]ccn2c1 ZINC000068358498 343916636 /nfs/dbraw/zinc/91/66/36/343916636.db2.gz XLLQCTZATIQBNQ-UHFFFAOYSA-N 1 2 243.310 2.349 20 0 BEADLO CCn1cc(Cn2c(C)[nH+]c3ccccc32)nn1 ZINC000641187954 362258317 /nfs/dbraw/zinc/25/83/17/362258317.db2.gz ZUNJCIANNHRKMF-UHFFFAOYSA-N 1 2 241.298 2.004 20 0 BEADLO CC1(C(=O)N2CCc3[nH]c[nH+]c3C2)CCCCC1 ZINC000627371163 347017140 /nfs/dbraw/zinc/01/71/40/347017140.db2.gz WYLULWNAYQNHJH-UHFFFAOYSA-N 1 2 247.342 2.265 20 0 BEADLO CC1(C(=O)N2CCc3[nH+]c[nH]c3C2)CCCCC1 ZINC000627371163 347017143 /nfs/dbraw/zinc/01/71/43/347017143.db2.gz WYLULWNAYQNHJH-UHFFFAOYSA-N 1 2 247.342 2.265 20 0 BEADLO Cc1c[nH]c(CN(C)Cc2cccc(O)c2)[nH+]1 ZINC000628117902 343967742 /nfs/dbraw/zinc/96/77/42/343967742.db2.gz ZJUOOWYZPVHKTK-UHFFFAOYSA-N 1 2 231.299 2.056 20 0 BEADLO OCc1cc[nH+]c(NC2CCCCC2)c1 ZINC000641250495 362326117 /nfs/dbraw/zinc/32/61/17/362326117.db2.gz UWJBRHKYQGRSPC-UHFFFAOYSA-N 1 2 206.289 2.319 20 0 BEADLO CCc1noc(C[N@@H+]2CCCC(F)(F)CC2)n1 ZINC000625765652 344068216 /nfs/dbraw/zinc/06/82/16/344068216.db2.gz KECWFVHVZUUKQO-UHFFFAOYSA-N 1 2 245.273 2.253 20 0 BEADLO CCc1noc(C[N@H+]2CCCC(F)(F)CC2)n1 ZINC000625765652 344068217 /nfs/dbraw/zinc/06/82/17/344068217.db2.gz KECWFVHVZUUKQO-UHFFFAOYSA-N 1 2 245.273 2.253 20 0 BEADLO Cc1nc(C)c(CNc2cc[nH+]c(C)n2)s1 ZINC000078380978 344096188 /nfs/dbraw/zinc/09/61/88/344096188.db2.gz BIQTUOHCFNTPPW-UHFFFAOYSA-N 1 2 234.328 2.470 20 0 BEADLO Cc1nc(N2CCOC3(CCCCC3)C2)cc[nH+]1 ZINC000078423898 344097023 /nfs/dbraw/zinc/09/70/23/344097023.db2.gz XLRPZMPXJVXCPX-UHFFFAOYSA-N 1 2 247.342 2.325 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cnc(C3CC3)o2)CCO1 ZINC000628129362 344157200 /nfs/dbraw/zinc/15/72/00/344157200.db2.gz YBNLIYPQVKHXHM-NSHDSACASA-N 1 2 236.315 2.163 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cnc(C3CC3)o2)CCO1 ZINC000628129362 344157203 /nfs/dbraw/zinc/15/72/03/344157203.db2.gz YBNLIYPQVKHXHM-NSHDSACASA-N 1 2 236.315 2.163 20 0 BEADLO c1nc(C2CC2)oc1C[NH+]1CCSCC1 ZINC000628129787 344157729 /nfs/dbraw/zinc/15/77/29/344157729.db2.gz UXYMVNNMMDVDQB-UHFFFAOYSA-N 1 2 224.329 2.101 20 0 BEADLO COCC[C@@H](C)Nc1cc[nH+]c2ccncc12 ZINC000085660322 344207625 /nfs/dbraw/zinc/20/76/25/344207625.db2.gz PVNFZKYRPRFMSR-SNVBAGLBSA-N 1 2 231.299 2.467 20 0 BEADLO C[C@@H](SCc1ccc(N(C)C)[nH+]c1)[C@H](C)O ZINC000600524263 344256059 /nfs/dbraw/zinc/25/60/59/344256059.db2.gz GXFCUBJVPBCWDO-VHSXEESVSA-N 1 2 240.372 2.150 20 0 BEADLO C[C@H](O)[C@H](C)SCc1ccc(N(C)C)[nH+]c1 ZINC000600524262 344256202 /nfs/dbraw/zinc/25/62/02/344256202.db2.gz GXFCUBJVPBCWDO-UWVGGRQHSA-N 1 2 240.372 2.150 20 0 BEADLO CC[C@H]1CN(c2nc(C)[nH+]cc2C)CCCO1 ZINC000572617208 344296548 /nfs/dbraw/zinc/29/65/48/344296548.db2.gz VVORHDNCFVFVEC-LBPRGKRZSA-N 1 2 235.331 2.099 20 0 BEADLO CCn1c[nH+]cc1CNc1cnn(C(C)C)c1 ZINC000090173062 344266799 /nfs/dbraw/zinc/26/67/99/344266799.db2.gz DMSFKJDHEJLTGN-UHFFFAOYSA-N 1 2 233.319 2.293 20 0 BEADLO CC1(C)C[C@H](SCCn2cc[nH+]c2)CO1 ZINC000600574456 344288083 /nfs/dbraw/zinc/28/80/83/344288083.db2.gz VYCHSMQVRRYMRH-JTQLQIEISA-N 1 2 226.345 2.184 20 0 BEADLO OC1(CNc2cc[nH+]cc2F)CCCCCC1 ZINC000641379545 362383146 /nfs/dbraw/zinc/38/31/46/362383146.db2.gz APHPCWCZTVVNNG-UHFFFAOYSA-N 1 2 238.306 2.140 20 0 BEADLO OCc1cc[nH+]c(N2CC[C@@H](c3ccco3)C2)c1 ZINC000641369077 362380080 /nfs/dbraw/zinc/38/00/80/362380080.db2.gz ZMKSWRMUYWBBQW-GFCCVEGCSA-N 1 2 244.294 2.161 20 0 BEADLO CC[C@@H](C)[C@@H](C)Nc1cc(CO)cc[nH+]1 ZINC000641383727 362384973 /nfs/dbraw/zinc/38/49/73/362384973.db2.gz DOEBJJZRLMXFRB-NXEZZACHSA-N 1 2 208.305 2.420 20 0 BEADLO CO[C@H]1CC[C@H](C(=O)Nc2c(C)cc[nH+]c2C)C1 ZINC000622866432 344435258 /nfs/dbraw/zinc/43/52/58/344435258.db2.gz FEFDVORGRDWSGB-RYUDHWBXSA-N 1 2 248.326 2.452 20 0 BEADLO CO[C@H]1CC[C@@H](C(=O)Nc2c(C)cc[nH+]c2C)C1 ZINC000622866430 344435537 /nfs/dbraw/zinc/43/55/37/344435537.db2.gz FEFDVORGRDWSGB-NEPJUHHUSA-N 1 2 248.326 2.452 20 0 BEADLO CC1(C)CCC[C@H](CNCC(F)(F)C[NH3+])C1 ZINC000584279334 344405637 /nfs/dbraw/zinc/40/56/37/344405637.db2.gz SUBPYVLZDHKSAB-JTQLQIEISA-N 1 2 234.334 2.386 20 0 BEADLO c1cc2ccc(C[N@@H+]3CCO[C@H]4C[C@H]43)cc2[nH]1 ZINC000628291770 347048632 /nfs/dbraw/zinc/04/86/32/347048632.db2.gz TUJCZQXCJARING-KGLIPLIRSA-N 1 2 228.295 2.141 20 0 BEADLO c1cc2ccc(C[N@H+]3CCO[C@H]4C[C@H]43)cc2[nH]1 ZINC000628291770 347048637 /nfs/dbraw/zinc/04/86/37/347048637.db2.gz TUJCZQXCJARING-KGLIPLIRSA-N 1 2 228.295 2.141 20 0 BEADLO CCCCc1cc(N[C@H]2C[C@@H](CO)C2)nc[nH+]1 ZINC000631429630 344419176 /nfs/dbraw/zinc/41/91/76/344419176.db2.gz ISAISJJOONYYHE-KLPPZKSPSA-N 1 2 235.331 2.002 20 0 BEADLO Fc1c[nH+]ccc1NCCCC(F)(F)F ZINC000641407261 362395429 /nfs/dbraw/zinc/39/54/29/362395429.db2.gz AJIKUQLXKQMDTF-UHFFFAOYSA-N 1 2 222.185 2.397 20 0 BEADLO COC(C)(C)C[C@@H](C)Nc1cc(CO)cc[nH+]1 ZINC000641398923 362393295 /nfs/dbraw/zinc/39/32/95/362393295.db2.gz LBSLSLKEJQCQLJ-SNVBAGLBSA-N 1 2 238.331 2.189 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2csc(C)n2)[nH]n1 ZINC000381314904 344494900 /nfs/dbraw/zinc/49/49/00/344494900.db2.gz RNSDFSHUYHGTDT-MRVPVSSYSA-N 1 2 236.344 2.334 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2csc(C)n2)[nH]n1 ZINC000381314905 344495129 /nfs/dbraw/zinc/49/51/29/344495129.db2.gz RNSDFSHUYHGTDT-QMMMGPOBSA-N 1 2 236.344 2.334 20 0 BEADLO Cc1cc(NC(=O)C2(CF)CCC2)c(C)c[nH+]1 ZINC000570845426 323072635 /nfs/dbraw/zinc/07/26/35/323072635.db2.gz LZIMJWGZNASCTC-UHFFFAOYSA-N 1 2 236.290 2.199 20 0 BEADLO CCOC[C@@H]1CCN(c2cc[nH+]cc2F)C1 ZINC000641415768 362402391 /nfs/dbraw/zinc/40/23/91/362402391.db2.gz YTJTWMGOHMOYFJ-SNVBAGLBSA-N 1 2 224.279 2.084 20 0 BEADLO Cn1cc[nH+]c1CNc1ccsc1[N+](=O)[O-] ZINC000381556512 344520269 /nfs/dbraw/zinc/52/02/69/344520269.db2.gz PEFYMEFXOJWAGV-UHFFFAOYSA-N 1 2 238.272 2.002 20 0 BEADLO COCc1ccc(CNc2c[nH]c[nH+]2)cc1 ZINC000381614440 344525465 /nfs/dbraw/zinc/52/54/65/344525465.db2.gz UKCWFNFPWNXGPU-UHFFFAOYSA-N 1 2 217.272 2.168 20 0 BEADLO CC[N@H+](Cc1cccs1)[C@H](C)C(=O)OC ZINC000043628847 344528910 /nfs/dbraw/zinc/52/89/10/344528910.db2.gz IXMFCVSLPKPJPN-SECBINFHSA-N 1 2 227.329 2.132 20 0 BEADLO CC[N@@H+](Cc1cccs1)[C@H](C)C(=O)OC ZINC000043628847 344528912 /nfs/dbraw/zinc/52/89/12/344528912.db2.gz IXMFCVSLPKPJPN-SECBINFHSA-N 1 2 227.329 2.132 20 0 BEADLO CCc1cc(NCCCSC)nc[nH+]1 ZINC000069012847 344536575 /nfs/dbraw/zinc/53/65/75/344536575.db2.gz MVGFZYYZGDQJKC-UHFFFAOYSA-N 1 2 211.334 2.204 20 0 BEADLO C[C@@H](Cc1ccncc1)Nc1cc(CO)cc[nH+]1 ZINC000641417833 362405381 /nfs/dbraw/zinc/40/53/81/362405381.db2.gz JBOIHIUBEULFNS-NSHDSACASA-N 1 2 243.310 2.012 20 0 BEADLO OCc1cc[nH+]c(N2CCc3ccsc3C2)c1 ZINC000641465999 362439239 /nfs/dbraw/zinc/43/92/39/362439239.db2.gz QIILZEINUUIJKY-UHFFFAOYSA-N 1 2 246.335 2.198 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@H](C2CC2)C1 ZINC000641467590 362441372 /nfs/dbraw/zinc/44/13/72/362441372.db2.gz KEUOUEYQZLMWHX-JTQLQIEISA-N 1 2 206.264 2.457 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1cccc(Cl)c1 ZINC000047958441 344581413 /nfs/dbraw/zinc/58/14/13/344581413.db2.gz ONNNNXDQZLWMLY-UHFFFAOYSA-N 1 2 241.718 2.335 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1cccc(Cl)c1 ZINC000047958441 344581414 /nfs/dbraw/zinc/58/14/14/344581414.db2.gz ONNNNXDQZLWMLY-UHFFFAOYSA-N 1 2 241.718 2.335 20 0 BEADLO COCC1=CCN(c2cc[nH+]cc2F)CC1 ZINC000641499954 362463285 /nfs/dbraw/zinc/46/32/85/362463285.db2.gz NGGCKFQSWNWRAB-UHFFFAOYSA-N 1 2 222.263 2.004 20 0 BEADLO CC1(C)CC[C@@H](CNc2cc[nH+]cc2F)O1 ZINC000641503964 362466250 /nfs/dbraw/zinc/46/62/50/362466250.db2.gz QEHRHSKVZQHXBN-VIFPVBQESA-N 1 2 224.279 2.012 20 0 BEADLO CO[C@]1(C)CCCN(c2cc[nH+]cc2F)C1 ZINC000641545973 362493437 /nfs/dbraw/zinc/49/34/37/362493437.db2.gz RDYXGXVKXRXWSI-GFCCVEGCSA-N 1 2 224.279 2.226 20 0 BEADLO C[C@@H]1CN(c2cc[nH+]cc2F)C[C@H](C2CC2)O1 ZINC000641546574 362493616 /nfs/dbraw/zinc/49/36/16/362493616.db2.gz XVYAABYAHFELIJ-NOZJJQNGSA-N 1 2 236.290 2.224 20 0 BEADLO C[C@H]1CSCCN(c2cc[nH+]cc2F)C1 ZINC000641533032 362485218 /nfs/dbraw/zinc/48/52/18/362485218.db2.gz SOTHVTQGHQHHJN-SECBINFHSA-N 1 2 226.320 2.410 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000577955692 344658794 /nfs/dbraw/zinc/65/87/94/344658794.db2.gz DIPRBLUUZITFBO-JHJVBQTASA-N 1 2 249.358 2.385 20 0 BEADLO Cc1nocc1C[N@@H+]1CCc2c(O)cccc2C1 ZINC000626028332 344681350 /nfs/dbraw/zinc/68/13/50/344681350.db2.gz FSZMXXBDOWXAGX-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO Cc1nocc1C[N@H+]1CCc2c(O)cccc2C1 ZINC000626028332 344681352 /nfs/dbraw/zinc/68/13/52/344681352.db2.gz FSZMXXBDOWXAGX-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO CCC1(NC(=O)N[C@@H]2C[C@H](C)n3cc[nH+]c32)CC1 ZINC000334098216 168490787 /nfs/dbraw/zinc/49/07/87/168490787.db2.gz UKZSJXAZDYWGAV-VHSXEESVSA-N 1 2 248.330 2.131 20 0 BEADLO CCOC(=O)C[C@H](C)Nc1cc[nH+]c(C2CC2)n1 ZINC000152829908 344697185 /nfs/dbraw/zinc/69/71/85/344697185.db2.gz SHSWRJDYDLOURO-VIFPVBQESA-N 1 2 249.314 2.108 20 0 BEADLO CO[C@@]1(C)C[C@@H](Nc2cc[nH+]c(C)n2)C1(C)C ZINC000075064685 344764585 /nfs/dbraw/zinc/76/45/85/344764585.db2.gz KFTYKMUJYGINRL-MFKMUULPSA-N 1 2 235.331 2.401 20 0 BEADLO CC(C)[C@@H](C)CC(=O)NCCNc1cccc[nH+]1 ZINC000075988140 344789860 /nfs/dbraw/zinc/78/98/60/344789860.db2.gz KOTZLWWHJBQNRN-LBPRGKRZSA-N 1 2 249.358 2.292 20 0 BEADLO CC(C)c1nc(C[N@@H+]2CCC(C)(C)C2)no1 ZINC000076014349 344790608 /nfs/dbraw/zinc/79/06/08/344790608.db2.gz AKROAIAYFBQHLY-UHFFFAOYSA-N 1 2 223.320 2.425 20 0 BEADLO CC(C)c1nc(C[N@H+]2CCC(C)(C)C2)no1 ZINC000076014349 344790610 /nfs/dbraw/zinc/79/06/10/344790610.db2.gz AKROAIAYFBQHLY-UHFFFAOYSA-N 1 2 223.320 2.425 20 0 BEADLO C[N@H+](Cc1noc(C2CC2)n1)C1CCCC1 ZINC000053605077 323077339 /nfs/dbraw/zinc/07/73/39/323077339.db2.gz YKFOMLUTYBWTOO-UHFFFAOYSA-N 1 2 221.304 2.321 20 0 BEADLO C[N@@H+](Cc1noc(C2CC2)n1)C1CCCC1 ZINC000053605077 323077340 /nfs/dbraw/zinc/07/73/40/323077340.db2.gz YKFOMLUTYBWTOO-UHFFFAOYSA-N 1 2 221.304 2.321 20 0 BEADLO CC(C)c1nc(C[NH+]2C[C@@H](C)[C@H](C)C2)no1 ZINC000076111823 344795703 /nfs/dbraw/zinc/79/57/03/344795703.db2.gz SOLGOSUCOWNHJM-NXEZZACHSA-N 1 2 223.320 2.281 20 0 BEADLO CCN(Cc1[nH]c(C)c(C)[nH+]1)CC(F)(F)F ZINC000628144136 344815813 /nfs/dbraw/zinc/81/58/13/344815813.db2.gz PXXQSOMVXUBBNE-UHFFFAOYSA-N 1 2 235.253 2.411 20 0 BEADLO C[C@H]1CC[C@@H](CNc2cc(CO)cc[nH+]2)C1 ZINC000641547432 362495126 /nfs/dbraw/zinc/49/51/26/362495126.db2.gz QNXBLUPOMTVDTD-WDEREUQCSA-N 1 2 220.316 2.422 20 0 BEADLO Cn1cc[nH+]c1CSC(=S)N1CCCC1 ZINC000078384660 344858348 /nfs/dbraw/zinc/85/83/48/344858348.db2.gz ZCHLFELUCLBFAL-UHFFFAOYSA-N 1 2 241.385 2.034 20 0 BEADLO CC[N@H+](Cc1ccon1)Cc1ccccn1 ZINC000119724942 344860454 /nfs/dbraw/zinc/86/04/54/344860454.db2.gz YMLQTNBDKYEVHJ-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO CC[N@@H+](Cc1ccon1)Cc1ccccn1 ZINC000119724942 344860456 /nfs/dbraw/zinc/86/04/56/344860456.db2.gz YMLQTNBDKYEVHJ-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO Cc1c[nH]c(CN(C)Cc2scnc2C)[nH+]1 ZINC000628162949 344862190 /nfs/dbraw/zinc/86/21/90/344862190.db2.gz KEEVSUWCJSMVGZ-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1ccc(NCc2c[nH+]cn2C)c(F)c1 ZINC000085167988 178766258 /nfs/dbraw/zinc/76/62/58/178766258.db2.gz RFECVSCYDQSIOW-UHFFFAOYSA-N 1 2 219.263 2.480 20 0 BEADLO CO[C@H]1CCCC[C@@H]1Nc1cc[nH+]c(C)n1 ZINC000078426987 344867392 /nfs/dbraw/zinc/86/73/92/344867392.db2.gz UGFOXJUMQPRABG-QWRGUYRKSA-N 1 2 221.304 2.155 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1ccnn1C ZINC000583392759 344879417 /nfs/dbraw/zinc/87/94/17/344879417.db2.gz PCGGOIABZDHXQX-DTWKUNHWSA-N 1 2 236.344 2.288 20 0 BEADLO CCC(=O)CCC[N@H+](C)Cc1nccs1 ZINC000387560027 344881022 /nfs/dbraw/zinc/88/10/22/344881022.db2.gz JXFGLKWNZHEQTR-UHFFFAOYSA-N 1 2 226.345 2.334 20 0 BEADLO CCC(=O)CCC[N@@H+](C)Cc1nccs1 ZINC000387560027 344881023 /nfs/dbraw/zinc/88/10/23/344881023.db2.gz JXFGLKWNZHEQTR-UHFFFAOYSA-N 1 2 226.345 2.334 20 0 BEADLO Cc1nc(N2CCS[C@@H](C(C)C)C2)cc[nH+]1 ZINC000078578590 344885572 /nfs/dbraw/zinc/88/55/72/344885572.db2.gz NGJFYSQNYMLTCG-LLVKDONJSA-N 1 2 237.372 2.363 20 0 BEADLO CC[C@H]1CN(c2cccc[nH+]2)CCS1 ZINC000078590770 344887615 /nfs/dbraw/zinc/88/76/15/344887615.db2.gz XCMBKMODIWRBQM-JTQLQIEISA-N 1 2 208.330 2.413 20 0 BEADLO Cc1c[nH]c(CN2CCc3cccc(F)c3C2)[nH+]1 ZINC000628177193 344905994 /nfs/dbraw/zinc/90/59/94/344905994.db2.gz OMFCSGUPYQVNOU-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1c[nH]c(CN2CC=C(C(F)(F)F)CC2)[nH+]1 ZINC000628183271 344929048 /nfs/dbraw/zinc/92/90/48/344929048.db2.gz VQLSFDCXJMYQKH-UHFFFAOYSA-N 1 2 245.248 2.413 20 0 BEADLO Cc1ccc(N[C@H]2CCOC2(C)C)c[nH+]1 ZINC000294642770 178778372 /nfs/dbraw/zinc/77/83/72/178778372.db2.gz GJHMYQDDOYNVIS-NSHDSACASA-N 1 2 206.289 2.369 20 0 BEADLO Cc1[nH]c(CN(C)CCOC(C)(C)C)[nH+]c1C ZINC000628186100 344936144 /nfs/dbraw/zinc/93/61/44/344936144.db2.gz XJJHAHMWGGFGDT-UHFFFAOYSA-N 1 2 239.363 2.273 20 0 BEADLO Cc1nc(C[N@H+](C)CCOC(C)(C)C)[nH]c1C ZINC000628186100 344936147 /nfs/dbraw/zinc/93/61/47/344936147.db2.gz XJJHAHMWGGFGDT-UHFFFAOYSA-N 1 2 239.363 2.273 20 0 BEADLO Cc1nc(C[N@@H+](C)CCOC(C)(C)C)[nH]c1C ZINC000628186100 344936149 /nfs/dbraw/zinc/93/61/49/344936149.db2.gz XJJHAHMWGGFGDT-UHFFFAOYSA-N 1 2 239.363 2.273 20 0 BEADLO Cc1nc(C[N@H+]2CCS[C@H](C)[C@H]2C)[nH]c1C ZINC000628179205 344913812 /nfs/dbraw/zinc/91/38/12/344913812.db2.gz RCYDZRHXEJJFKZ-GHMZBOCLSA-N 1 2 239.388 2.352 20 0 BEADLO Cc1nc(C[N@@H+]2CCS[C@H](C)[C@H]2C)[nH]c1C ZINC000628179205 344913813 /nfs/dbraw/zinc/91/38/13/344913813.db2.gz RCYDZRHXEJJFKZ-GHMZBOCLSA-N 1 2 239.388 2.352 20 0 BEADLO Cc1[nH]c(CN2CCS[C@H](C)[C@H]2C)[nH+]c1C ZINC000628179205 344913815 /nfs/dbraw/zinc/91/38/15/344913815.db2.gz RCYDZRHXEJJFKZ-GHMZBOCLSA-N 1 2 239.388 2.352 20 0 BEADLO Cc1noc(C[N@@H+](C)[C@H]2CCc3ccccc32)n1 ZINC000042635305 344942412 /nfs/dbraw/zinc/94/24/12/344942412.db2.gz NVSULKMODPBXQJ-ZDUSSCGKSA-N 1 2 243.310 2.497 20 0 BEADLO Cc1noc(C[N@H+](C)[C@H]2CCc3ccccc32)n1 ZINC000042635305 344942413 /nfs/dbraw/zinc/94/24/13/344942413.db2.gz NVSULKMODPBXQJ-ZDUSSCGKSA-N 1 2 243.310 2.497 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)Nc1c[nH+]ccc1OC ZINC000079843608 345043522 /nfs/dbraw/zinc/04/35/22/345043522.db2.gz BIJVROJZRKWQPW-NXEZZACHSA-N 1 2 234.299 2.465 20 0 BEADLO COC[C@@]1(C)CCN(c2cc[nH+]cc2F)C1 ZINC000641615558 362548353 /nfs/dbraw/zinc/54/83/53/362548353.db2.gz MXLJIPPEPVLTGT-LBPRGKRZSA-N 1 2 224.279 2.084 20 0 BEADLO CC(C)[C@@H]1C[C@H]1CNc1cc(CO)cc[nH+]1 ZINC000641621367 362553300 /nfs/dbraw/zinc/55/33/00/362553300.db2.gz PCRAAFIZARPMAC-RYUDHWBXSA-N 1 2 220.316 2.278 20 0 BEADLO Cc1c[nH+]c(C)nc1NC[C@H](C)c1nccs1 ZINC000566485721 345087939 /nfs/dbraw/zinc/08/79/39/345087939.db2.gz RYKHOICXADLUJF-VIFPVBQESA-N 1 2 248.355 2.187 20 0 BEADLO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3CN2c1cc[nH+]cc1F ZINC000641593419 362535510 /nfs/dbraw/zinc/53/55/10/362535510.db2.gz QUCBGSHHTKKMGX-HAOVPJPFSA-N 1 2 248.301 2.080 20 0 BEADLO Fc1c[nH+]ccc1NC[C@H]1CCCSC1 ZINC000641598712 362538419 /nfs/dbraw/zinc/53/84/19/362538419.db2.gz MUTMBXWSRAQRBS-SECBINFHSA-N 1 2 226.320 2.198 20 0 BEADLO OCc1cc[nH+]c(NCCC2(F)CCC2)c1 ZINC000641600753 362539382 /nfs/dbraw/zinc/53/93/82/362539382.db2.gz VSDNPQCUEVVMQU-UHFFFAOYSA-N 1 2 224.279 2.268 20 0 BEADLO OCc1cc[nH+]c(NC[C@H]2CCCSC2)c1 ZINC000641599547 362540546 /nfs/dbraw/zinc/54/05/46/362540546.db2.gz SDIPLXJMZOHDLT-LLVKDONJSA-N 1 2 238.356 2.129 20 0 BEADLO CCc1noc(C)c1CNc1cc(CO)cc[nH+]1 ZINC000641611398 362546264 /nfs/dbraw/zinc/54/62/64/362546264.db2.gz SMRXIUPFTMIZEU-UHFFFAOYSA-N 1 2 247.298 2.045 20 0 BEADLO C[C@@H](CNc1cc(CO)cc[nH+]1)CC(F)F ZINC000641646762 362575118 /nfs/dbraw/zinc/57/51/18/362575118.db2.gz WDJZCUNWDHMOEC-MRVPVSSYSA-N 1 2 230.258 2.277 20 0 BEADLO C[C@H]1CCC[C@H](CNc2cc[nH+]cc2F)O1 ZINC000641660296 362579912 /nfs/dbraw/zinc/57/99/12/362579912.db2.gz WNTUPLBMQXLCEM-VHSXEESVSA-N 1 2 224.279 2.012 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000641630461 362561624 /nfs/dbraw/zinc/56/16/24/362561624.db2.gz VKUPUJHAGVLFMW-WCABBAIRSA-N 1 2 206.264 2.243 20 0 BEADLO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1ccon1 ZINC000634981069 345164399 /nfs/dbraw/zinc/16/43/99/345164399.db2.gz WJRYQAPBJMFKQX-RNCFNFMXSA-N 1 2 230.267 2.286 20 0 BEADLO CCCOc1ncccc1C[NH2+]Cc1ccon1 ZINC000634956623 345130919 /nfs/dbraw/zinc/13/09/19/345130919.db2.gz NNFGBLYTIYYPAX-UHFFFAOYSA-N 1 2 247.298 2.148 20 0 BEADLO Cc1cc(C)c(CNC(=O)NC(C)(C)C)c[nH+]1 ZINC000335128100 345139046 /nfs/dbraw/zinc/13/90/46/345139046.db2.gz BPZGVJBQFPTTTA-UHFFFAOYSA-N 1 2 235.331 2.296 20 0 BEADLO FC(F)(F)CN1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000156381968 345151923 /nfs/dbraw/zinc/15/19/23/345151923.db2.gz DHJOVYLTEREMDB-SNVBAGLBSA-N 1 2 246.232 2.097 20 0 BEADLO CC(C)C[C@@H](C(=O)N1CCCCC1)n1cc[nH+]c1 ZINC000635053418 345228619 /nfs/dbraw/zinc/22/86/19/345228619.db2.gz GVGZZQOGINBIKQ-ZDUSSCGKSA-N 1 2 249.358 2.483 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@H]2CCCC[C@@H]2C)[nH+]1 ZINC000635080263 345242144 /nfs/dbraw/zinc/24/21/44/345242144.db2.gz ZMZMLIAHDNSSEB-JQWIXIFHSA-N 1 2 249.358 2.210 20 0 BEADLO CCc1c[nH]c(CC(=O)N(C)C2CCCCC2)[nH+]1 ZINC000635183363 345266378 /nfs/dbraw/zinc/26/63/78/345266378.db2.gz OCSDGJRNTDAWTP-UHFFFAOYSA-N 1 2 249.358 2.306 20 0 BEADLO CC[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635267858 345291239 /nfs/dbraw/zinc/29/12/39/345291239.db2.gz TZIQGSLMAXFTRB-QJPTWQEYSA-N 1 2 247.342 2.162 20 0 BEADLO CC[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635267858 345291241 /nfs/dbraw/zinc/29/12/41/345291241.db2.gz TZIQGSLMAXFTRB-QJPTWQEYSA-N 1 2 247.342 2.162 20 0 BEADLO CCc1c[nH]c(CC(=O)N(CC2CC2)C(C)C)[nH+]1 ZINC000635269108 345292516 /nfs/dbraw/zinc/29/25/16/345292516.db2.gz HCFWDKVRIZAGFM-UHFFFAOYSA-N 1 2 249.358 2.162 20 0 BEADLO Cc1cn2ccc(C(=O)NC[C@H]3C[C@@H]3C)cc2[nH+]1 ZINC000635300607 345299266 /nfs/dbraw/zinc/29/92/66/345299266.db2.gz MYJAXLSMQDVNIT-JOYOIKCWSA-N 1 2 243.310 2.029 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)C1CCC=CCC1 ZINC000635327134 345308934 /nfs/dbraw/zinc/30/89/34/345308934.db2.gz RTNXRGKKHMTWFY-LBPRGKRZSA-N 1 2 247.342 2.134 20 0 BEADLO Cc1cn2ccc(C(=O)N3CC[C@H](C)C3)cc2[nH+]1 ZINC000635468178 345384883 /nfs/dbraw/zinc/38/48/83/345384883.db2.gz ZDTIKIZPTCCEPD-JTQLQIEISA-N 1 2 243.310 2.125 20 0 BEADLO CC(C)C[C@@H](C(=O)N(C)CC1CC1)n1cc[nH+]c1 ZINC000635378075 345333567 /nfs/dbraw/zinc/33/35/67/345333567.db2.gz SHAHAQYCXUBPCV-ZDUSSCGKSA-N 1 2 249.358 2.339 20 0 BEADLO Cc1nc(N2C[C@H](C)CC2(C)C)cc[nH+]1 ZINC000080684387 345430401 /nfs/dbraw/zinc/43/04/01/345430401.db2.gz BEOJCYFSYMIFED-SECBINFHSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1nc2[nH]ccc2c(NCc2ccco2)[nH+]1 ZINC000080761223 345448855 /nfs/dbraw/zinc/44/88/55/345448855.db2.gz ZDRBXMCAILPZSE-UHFFFAOYSA-N 1 2 228.255 2.471 20 0 BEADLO Cc1noc([C@H](C)[N@H+](C)Cc2cccc(O)c2)n1 ZINC000080924962 345451043 /nfs/dbraw/zinc/45/10/43/345451043.db2.gz WXLGZECLKWUUGO-VIFPVBQESA-N 1 2 247.298 2.277 20 0 BEADLO Cc1noc([C@H](C)[N@@H+](C)Cc2cccc(O)c2)n1 ZINC000080924962 345451047 /nfs/dbraw/zinc/45/10/47/345451047.db2.gz WXLGZECLKWUUGO-VIFPVBQESA-N 1 2 247.298 2.277 20 0 BEADLO CC(C)(C)OCCCNc1cc[nH+]cc1F ZINC000641658570 362583451 /nfs/dbraw/zinc/58/34/51/362583451.db2.gz GLAXQRHWYATELM-UHFFFAOYSA-N 1 2 226.295 2.260 20 0 BEADLO Cc1nnc(CN(C)c2cc[nH+]cc2F)s1 ZINC000641670201 362590218 /nfs/dbraw/zinc/59/02/18/362590218.db2.gz ZGFMYMWOVPDYGH-UHFFFAOYSA-N 1 2 238.291 2.017 20 0 BEADLO Cc1nc2[nH]ccc2c(NCCOCC2CC2)[nH+]1 ZINC000080986184 345458154 /nfs/dbraw/zinc/45/81/54/345458154.db2.gz IOPAIWCZBGBUTK-UHFFFAOYSA-N 1 2 246.314 2.105 20 0 BEADLO CCCC1CCC(NC(=O)Cn2cc[nH+]c2)CC1 ZINC000081287335 345467365 /nfs/dbraw/zinc/46/73/65/345467365.db2.gz RAZPDLBPMDNJAR-UHFFFAOYSA-N 1 2 249.358 2.358 20 0 BEADLO C(c1nnc(C2CC2)o1)[N@@H+]1CCC12CCC2 ZINC000081562824 345478732 /nfs/dbraw/zinc/47/87/32/345478732.db2.gz IJPAVGLYVLAESW-UHFFFAOYSA-N 1 2 219.288 2.075 20 0 BEADLO C(c1nnc(C2CC2)o1)[N@H+]1CCC12CCC2 ZINC000081562824 345478736 /nfs/dbraw/zinc/47/87/36/345478736.db2.gz IJPAVGLYVLAESW-UHFFFAOYSA-N 1 2 219.288 2.075 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CCSC1 ZINC000225868921 345527248 /nfs/dbraw/zinc/52/72/48/345527248.db2.gz CIXQJEHFMWNTQJ-MRVPVSSYSA-N 1 2 210.302 2.008 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CCSC1 ZINC000225868935 345527379 /nfs/dbraw/zinc/52/73/79/345527379.db2.gz CIXQJEHFMWNTQJ-QMMMGPOBSA-N 1 2 210.302 2.008 20 0 BEADLO C[C@@H]([NH2+]Cc1ncccc1F)c1ccccn1 ZINC000090720931 345574350 /nfs/dbraw/zinc/57/43/50/345574350.db2.gz OAWOXZVQUKHNEG-SNVBAGLBSA-N 1 2 231.274 2.467 20 0 BEADLO CN(C)c1[nH+]cccc1CNc1ncccc1F ZINC000084483989 345514035 /nfs/dbraw/zinc/51/40/35/345514035.db2.gz KWBZMTHNGYKYGH-UHFFFAOYSA-N 1 2 246.289 2.294 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@H]2CC[C@H](C)CC2)[nH+]1 ZINC000635539774 345514876 /nfs/dbraw/zinc/51/48/76/345514876.db2.gz HSMUKEMURCTOJM-UMSPYCQHSA-N 1 2 249.358 2.210 20 0 BEADLO O[C@@H]1Cc2ccccc2[C@H]1Nc1cccc[nH+]1 ZINC000091431376 345592839 /nfs/dbraw/zinc/59/28/39/345592839.db2.gz KCPGJYPLGNYKTA-TZMCWYRMSA-N 1 2 226.279 2.152 20 0 BEADLO Cc1nc(C)c(C[NH2+]Cc2cccc(C)n2)o1 ZINC000311648888 349933653 /nfs/dbraw/zinc/93/36/53/349933653.db2.gz BPOYCFCXJGTYBA-UHFFFAOYSA-N 1 2 231.299 2.285 20 0 BEADLO COCc1ccc(C[N@@H+]2CCOC(C)(C)C2)o1 ZINC000091917269 345611557 /nfs/dbraw/zinc/61/15/57/345611557.db2.gz RAQYZJZTZRVLQY-UHFFFAOYSA-N 1 2 239.315 2.037 20 0 BEADLO COCc1ccc(C[N@H+]2CCOC(C)(C)C2)o1 ZINC000091917269 345611560 /nfs/dbraw/zinc/61/15/60/345611560.db2.gz RAQYZJZTZRVLQY-UHFFFAOYSA-N 1 2 239.315 2.037 20 0 BEADLO Cc1cc(NC(=O)C2CCC=CCC2)cc[nH+]1 ZINC000635551805 345637979 /nfs/dbraw/zinc/63/79/79/345637979.db2.gz LTCPDTJINRIXRV-UHFFFAOYSA-N 1 2 230.311 2.497 20 0 BEADLO CCSCCCNc1cc[nH+]cc1F ZINC000603367680 349933462 /nfs/dbraw/zinc/93/34/62/349933462.db2.gz BAKJJOCRWDNLLP-UHFFFAOYSA-N 1 2 214.309 2.198 20 0 BEADLO Cc1ncsc1C[N@@H+]1CCOCC12CCC2 ZINC000093510631 345662438 /nfs/dbraw/zinc/66/24/38/345662438.db2.gz OUWAJWIOJWHJOJ-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO Cc1ncsc1C[N@H+]1CCOCC12CCC2 ZINC000093510631 345662441 /nfs/dbraw/zinc/66/24/41/345662441.db2.gz OUWAJWIOJWHJOJ-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO COCc1cc(C[NH2+]Cc2ccsc2)no1 ZINC000641706867 362616082 /nfs/dbraw/zinc/61/60/82/362616082.db2.gz GGYBJBIESPMKMT-UHFFFAOYSA-N 1 2 238.312 2.172 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2cocn2)o1 ZINC000182074267 178892957 /nfs/dbraw/zinc/89/29/57/178892957.db2.gz WUTWTZJWNVMXBE-VIFPVBQESA-N 1 2 206.245 2.427 20 0 BEADLO CCCCc1cc(NCC2CSC2)nc[nH+]1 ZINC000641681519 362604148 /nfs/dbraw/zinc/60/41/48/362604148.db2.gz CRZHCOORSXBOGS-UHFFFAOYSA-N 1 2 237.372 2.016 20 0 BEADLO C[C@H](Nc1cc[nH+]c(C(C)(C)C)n1)C(F)F ZINC000641729568 362644157 /nfs/dbraw/zinc/64/41/57/362644157.db2.gz HDTKRPAFYVSEOM-ZETCQYMHSA-N 1 2 229.274 2.262 20 0 BEADLO CSc1ccc(C[NH2+]Cc2cocn2)o1 ZINC000641720951 362637781 /nfs/dbraw/zinc/63/77/81/362637781.db2.gz YFTUCXZJUJECMP-UHFFFAOYSA-N 1 2 224.285 2.279 20 0 BEADLO COC(=O)C[N@@H+]1CCc2ccc(C(C)C)cc2C1 ZINC000082791804 345759955 /nfs/dbraw/zinc/75/99/55/345759955.db2.gz MAUAWMRJQGOLAM-UHFFFAOYSA-N 1 2 247.338 2.341 20 0 BEADLO COC(=O)C[N@H+]1CCc2ccc(C(C)C)cc2C1 ZINC000082791804 345759958 /nfs/dbraw/zinc/75/99/58/345759958.db2.gz MAUAWMRJQGOLAM-UHFFFAOYSA-N 1 2 247.338 2.341 20 0 BEADLO CCn1ccnc1[C@H](C)[NH2+]Cc1cc(C)no1 ZINC000631151361 345813291 /nfs/dbraw/zinc/81/32/91/345813291.db2.gz HRXVWDYWJGSXIL-JTQLQIEISA-N 1 2 234.303 2.050 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NCc1cc(C)no1 ZINC000631151361 345813292 /nfs/dbraw/zinc/81/32/92/345813292.db2.gz HRXVWDYWJGSXIL-JTQLQIEISA-N 1 2 234.303 2.050 20 0 BEADLO c1cc(C[NH2+]Cc2cnc(C3CC3)o2)co1 ZINC000628208188 345785749 /nfs/dbraw/zinc/78/57/49/345785749.db2.gz BQJQCVSXTXHPSN-UHFFFAOYSA-N 1 2 218.256 2.435 20 0 BEADLO C[C@@H]1C[C@@H](Nc2cc[nH+]c(C(C)(C)C)n2)[C@H](C)O1 ZINC000631466005 345854448 /nfs/dbraw/zinc/85/44/48/345854448.db2.gz UCFUWQDOYAPUNO-OUAUKWLOSA-N 1 2 249.358 2.174 20 0 BEADLO CC(C)c1nc(NC[C@H]2CC23CC3)cc[nH+]1 ZINC000418984937 192091134 /nfs/dbraw/zinc/09/11/34/192091134.db2.gz DTICJQKDYUVDFG-SNVBAGLBSA-N 1 2 217.316 2.234 20 0 BEADLO COc1ccsc1[C@@H](C)[NH2+]Cc1cc[nH]n1 ZINC000381427343 345855221 /nfs/dbraw/zinc/85/52/21/345855221.db2.gz ZIJBCPKMUIDXSU-MRVPVSSYSA-N 1 2 237.328 2.331 20 0 BEADLO O=C(Nc1ccsc1)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635576728 345855384 /nfs/dbraw/zinc/85/53/84/345855384.db2.gz LSWBJEYBWNIALT-RKDXNWHRSA-N 1 2 233.296 2.213 20 0 BEADLO O=C(Nc1ccsc1)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635576728 345855388 /nfs/dbraw/zinc/85/53/88/345855388.db2.gz LSWBJEYBWNIALT-RKDXNWHRSA-N 1 2 233.296 2.213 20 0 BEADLO Cc1ccc(C(=O)N[C@H](C)c2[nH]cc[nH+]2)cc1 ZINC000141075733 345834068 /nfs/dbraw/zinc/83/40/68/345834068.db2.gz PQPSMBHLAYJSEL-SNVBAGLBSA-N 1 2 229.283 2.209 20 0 BEADLO CC(C)C[C@@H](C(=O)N1CCC[C@H]1C)n1cc[nH+]c1 ZINC000635628866 345903559 /nfs/dbraw/zinc/90/35/59/345903559.db2.gz RVGRGVDWCYFAEB-OLZOCXBDSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1ncc(C[NH2+]Cc2cc(C(C)C)no2)o1 ZINC000628214837 345907013 /nfs/dbraw/zinc/90/70/13/345907013.db2.gz OICSJMZTDZXPAL-UHFFFAOYSA-N 1 2 235.287 2.384 20 0 BEADLO CCc1c[nH]c(CC(=O)N2C[C@H](C)C[C@H]2CC)[nH+]1 ZINC000635636173 345910816 /nfs/dbraw/zinc/91/08/16/345910816.db2.gz XXZQPUANBYZOLJ-ZYHUDNBSSA-N 1 2 249.358 2.162 20 0 BEADLO C[C@@H]1CC[C@H](C)CN1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635632862 345911141 /nfs/dbraw/zinc/91/11/41/345911141.db2.gz VEZKOZDZOZMUMA-IRCOFANPSA-N 1 2 247.342 2.160 20 0 BEADLO C[C@@H]1CC[C@H](C)CN1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635632862 345911142 /nfs/dbraw/zinc/91/11/42/345911142.db2.gz VEZKOZDZOZMUMA-IRCOFANPSA-N 1 2 247.342 2.160 20 0 BEADLO CC(C)C[C@@H](C(=O)NC1CC(C)C1)n1cc[nH+]c1 ZINC000635642391 345917230 /nfs/dbraw/zinc/91/72/30/345917230.db2.gz PNSCRXICXIHYEO-BPCQOVAHSA-N 1 2 249.358 2.385 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H]2C[C@@H](C)O[C@H]2C)[nH+]1 ZINC000631466780 345920057 /nfs/dbraw/zinc/92/00/57/345920057.db2.gz WVYJZWOWMRGWNH-VHSKPIJISA-N 1 2 246.314 2.244 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H]2C[C@H](C)O[C@@H]2C)[nH+]1 ZINC000631466779 345920104 /nfs/dbraw/zinc/92/01/04/345920104.db2.gz WVYJZWOWMRGWNH-VAOFZXAKSA-N 1 2 246.314 2.244 20 0 BEADLO CCc1cc(NCCc2ccc(C)o2)nc[nH+]1 ZINC000603382934 349940522 /nfs/dbraw/zinc/94/05/22/349940522.db2.gz VUSWUIMBOHSTGO-UHFFFAOYSA-N 1 2 231.299 2.017 20 0 BEADLO Cc1cc(N2CCC(OC3CCC3)CC2)nc[nH+]1 ZINC000418977239 192093378 /nfs/dbraw/zinc/09/33/78/192093378.db2.gz WJTCPGHHQQRPLE-UHFFFAOYSA-N 1 2 247.342 2.323 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CC[C@H](C(C)C)C2)[nH+]1 ZINC000635667133 345973104 /nfs/dbraw/zinc/97/31/04/345973104.db2.gz LCFGSENQPRBLGM-NSHDSACASA-N 1 2 249.358 2.019 20 0 BEADLO CC[C@]1(C)CCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635683506 345976516 /nfs/dbraw/zinc/97/65/16/345976516.db2.gz TYFRZIUXRYAUEI-JTNHKYCSSA-N 1 2 247.342 2.162 20 0 BEADLO CC[C@]1(C)CCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635683506 345976521 /nfs/dbraw/zinc/97/65/21/345976521.db2.gz TYFRZIUXRYAUEI-JTNHKYCSSA-N 1 2 247.342 2.162 20 0 BEADLO CC(C)C(NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C(C)C ZINC000635711092 346006084 /nfs/dbraw/zinc/00/60/84/346006084.db2.gz CYQBBEXLJFTFMJ-GHMZBOCLSA-N 1 2 249.358 2.310 20 0 BEADLO CC(C)C(NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C(C)C ZINC000635711092 346006085 /nfs/dbraw/zinc/00/60/85/346006085.db2.gz CYQBBEXLJFTFMJ-GHMZBOCLSA-N 1 2 249.358 2.310 20 0 BEADLO C[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C[C@@H]1C ZINC000635754090 346050258 /nfs/dbraw/zinc/05/02/58/346050258.db2.gz UNYSKLUFOAEETD-WRWGMCAJSA-N 1 2 247.342 2.018 20 0 BEADLO C[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C[C@@H]1C ZINC000635754090 346050259 /nfs/dbraw/zinc/05/02/59/346050259.db2.gz UNYSKLUFOAEETD-WRWGMCAJSA-N 1 2 247.342 2.018 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@H]2CCC(C)(C)C2)[nH+]1 ZINC000635757535 346051678 /nfs/dbraw/zinc/05/16/78/346051678.db2.gz HKAVEWJTLRKGGH-NSHDSACASA-N 1 2 249.358 2.210 20 0 BEADLO CC1(C)CC[C@H](NC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635758466 346052056 /nfs/dbraw/zinc/05/20/56/346052056.db2.gz RATVUHYYZBBFPG-HBNTYKKESA-N 1 2 247.342 2.208 20 0 BEADLO CC1(C)CC[C@H](NC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635758466 346052059 /nfs/dbraw/zinc/05/20/59/346052059.db2.gz RATVUHYYZBBFPG-HBNTYKKESA-N 1 2 247.342 2.208 20 0 BEADLO CCCCc1cc(NCCSC)nc[nH+]1 ZINC000601100575 346025049 /nfs/dbraw/zinc/02/50/49/346025049.db2.gz NSCYHPAKEVPJER-UHFFFAOYSA-N 1 2 225.361 2.016 20 0 BEADLO CC(C)C[C@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635722860 346031465 /nfs/dbraw/zinc/03/14/65/346031465.db2.gz CNTOBQMKWVWSPG-HBNTYKKESA-N 1 2 235.331 2.064 20 0 BEADLO CC(C)C[C@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635722860 346031467 /nfs/dbraw/zinc/03/14/67/346031467.db2.gz CNTOBQMKWVWSPG-HBNTYKKESA-N 1 2 235.331 2.064 20 0 BEADLO CO[C@@H](C)c1nc(C[NH2+]CC2(F)CC2)cs1 ZINC000381489715 346040098 /nfs/dbraw/zinc/04/00/98/346040098.db2.gz WWDHKSFBJGAMGZ-QMMMGPOBSA-N 1 2 244.335 2.442 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H]2C[C@H]2C(C)(C)C)c[nH+]1 ZINC001639097260 1172073151 /nfs/dbraw/zinc/07/31/51/1172073151.db2.gz IBZOODSUMCHIGS-GHMZBOCLSA-N 1 2 249.358 2.271 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H]2C[C@H]2C(C)(C)C)[nH+]1 ZINC001639097260 1172073160 /nfs/dbraw/zinc/07/31/60/1172073160.db2.gz IBZOODSUMCHIGS-GHMZBOCLSA-N 1 2 249.358 2.271 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CC[C@@H](C)[C@H](C)C2)[nH+]1 ZINC000635752705 346049635 /nfs/dbraw/zinc/04/96/35/346049635.db2.gz MEEHJBSOKNFGIF-GHMZBOCLSA-N 1 2 249.358 2.019 20 0 BEADLO CCc1c[nH]c(CC(=O)NCC2CC(C)(C)C2)[nH+]1 ZINC000635835918 346081967 /nfs/dbraw/zinc/08/19/67/346081967.db2.gz ZWLXRMZFUWOBLO-UHFFFAOYSA-N 1 2 249.358 2.067 20 0 BEADLO c1nc(N2CCCC2)cc(NC[C@@H]2CC23CC3)[nH+]1 ZINC000418999276 192097135 /nfs/dbraw/zinc/09/71/35/192097135.db2.gz WTVLMBNFNQGKAD-NSHDSACASA-N 1 2 244.342 2.289 20 0 BEADLO c1nc(NC[C@@H]2CC23CC3)cc(N2CCCC2)[nH+]1 ZINC000418999276 192097136 /nfs/dbraw/zinc/09/71/36/192097136.db2.gz WTVLMBNFNQGKAD-NSHDSACASA-N 1 2 244.342 2.289 20 0 BEADLO O=C(NCC1=CCCCC1)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635990433 346141138 /nfs/dbraw/zinc/14/11/38/346141138.db2.gz SIFNIRHYJNJHJG-VXGBXAGGSA-N 1 2 245.326 2.130 20 0 BEADLO O=C(NCC1=CCCCC1)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635990433 346141143 /nfs/dbraw/zinc/14/11/43/346141143.db2.gz SIFNIRHYJNJHJG-VXGBXAGGSA-N 1 2 245.326 2.130 20 0 BEADLO CCN(CC(C)(C)C)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635950262 346121176 /nfs/dbraw/zinc/12/11/76/346121176.db2.gz IQQRJLZXKOEKOB-GHMZBOCLSA-N 1 2 249.358 2.408 20 0 BEADLO CCN(CC(C)(C)C)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635950262 346121177 /nfs/dbraw/zinc/12/11/77/346121177.db2.gz IQQRJLZXKOEKOB-GHMZBOCLSA-N 1 2 249.358 2.408 20 0 BEADLO Cc1cn2ccc(C(=O)NCC[C@H](C)F)cc2[nH+]1 ZINC000635965900 346125225 /nfs/dbraw/zinc/12/52/25/346125225.db2.gz PKUYWPLEQVXHTI-VIFPVBQESA-N 1 2 249.289 2.121 20 0 BEADLO CC[C@H]1CCN1C(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC000635958290 346133115 /nfs/dbraw/zinc/13/31/15/346133115.db2.gz WFAFDFCMZULVOS-STQMWFEESA-N 1 2 249.358 2.481 20 0 BEADLO C[C@@H]1[C@H](C)CN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)[C@H]1C ZINC000636033469 346169540 /nfs/dbraw/zinc/16/95/40/346169540.db2.gz BQXAAQPCEFRWLO-RMPHRYRLSA-N 1 2 247.342 2.016 20 0 BEADLO C[C@@H]1[C@H](C)CN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)[C@H]1C ZINC000636033469 346169542 /nfs/dbraw/zinc/16/95/42/346169542.db2.gz BQXAAQPCEFRWLO-RMPHRYRLSA-N 1 2 247.342 2.016 20 0 BEADLO CCc1c[nH]c(CC(=O)N2C[C@H](C)[C@H](C)[C@H]2C)[nH+]1 ZINC000636033736 346169963 /nfs/dbraw/zinc/16/99/63/346169963.db2.gz DJSNFWCQGKBDNS-GARJFASQSA-N 1 2 249.358 2.018 20 0 BEADLO CCCCc1cc(N[C@](C)(CC)CO)nc[nH+]1 ZINC000631152159 346172875 /nfs/dbraw/zinc/17/28/75/346172875.db2.gz NEQXDHUQDIXEKQ-CYBMUJFWSA-N 1 2 237.347 2.392 20 0 BEADLO CCc1c[nH]c(CC(=O)N2[C@@H](C)CCC2(C)C)[nH+]1 ZINC000636011851 346153245 /nfs/dbraw/zinc/15/32/45/346153245.db2.gz NQPWJMGNMJCJHU-JTQLQIEISA-N 1 2 249.358 2.304 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CC(C(C)(C)C)C2)[nH+]1 ZINC000636013885 346155515 /nfs/dbraw/zinc/15/55/15/346155515.db2.gz FDHLXLJUSWRETQ-UHFFFAOYSA-N 1 2 249.358 2.019 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@]2(C)CC=CCC2)[nH+]1 ZINC000636021942 346159731 /nfs/dbraw/zinc/15/97/31/346159731.db2.gz UINOXKPDHJDTTF-CQSZACIVSA-N 1 2 247.342 2.130 20 0 BEADLO C[C@H]1CC(C)(C)CN1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636025633 346162329 /nfs/dbraw/zinc/16/23/29/346162329.db2.gz FIIJKDCMVHSOSY-HBNTYKKESA-N 1 2 247.342 2.160 20 0 BEADLO C[C@H]1CC(C)(C)CN1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636025633 346162332 /nfs/dbraw/zinc/16/23/32/346162332.db2.gz FIIJKDCMVHSOSY-HBNTYKKESA-N 1 2 247.342 2.160 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC[C@H](OCC3CC3)C2)n1 ZINC000628241118 346203805 /nfs/dbraw/zinc/20/38/05/346203805.db2.gz JCEHBPBOAOEZQI-ZDUSSCGKSA-N 1 2 249.358 2.109 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC[C@H](OCC3CC3)C2)n1 ZINC000628241118 346203807 /nfs/dbraw/zinc/20/38/07/346203807.db2.gz JCEHBPBOAOEZQI-ZDUSSCGKSA-N 1 2 249.358 2.109 20 0 BEADLO Cc1cc(C(=O)NC[C@@H]2C[C@@H]2C)c2[nH+]ccn2c1 ZINC000624108354 346207596 /nfs/dbraw/zinc/20/75/96/346207596.db2.gz RIJTWLGRYBELPQ-QWRGUYRKSA-N 1 2 243.310 2.029 20 0 BEADLO CC[C@]1(C)CN(Cc2[nH]c(C)c(C)[nH+]2)CCO1 ZINC000628245340 346210401 /nfs/dbraw/zinc/21/04/01/346210401.db2.gz SKZUOUDHLPGKFL-CYBMUJFWSA-N 1 2 237.347 2.027 20 0 BEADLO CCCC[C@H](CCC)NC(=O)Cn1cc[nH+]c1 ZINC000569777452 346215459 /nfs/dbraw/zinc/21/54/59/346215459.db2.gz HDJJNOIBZZCTJF-LBPRGKRZSA-N 1 2 237.347 2.358 20 0 BEADLO Cc1nc(C)c(C[NH2+]Cc2ncccc2F)o1 ZINC000628230030 346179472 /nfs/dbraw/zinc/17/94/72/346179472.db2.gz QQEHBBSMHISNBM-UHFFFAOYSA-N 1 2 235.262 2.115 20 0 BEADLO Cc1nn(C)cc1[C@H](C)Nc1cc(C)[nH+]cn1 ZINC000603390222 349942854 /nfs/dbraw/zinc/94/28/54/349942854.db2.gz FGPITXOEYMPQQG-VIFPVBQESA-N 1 2 231.303 2.000 20 0 BEADLO CC[C@@H](C)Nc1cc(NC2CC2)nc[nH+]1 ZINC000243011324 323112523 /nfs/dbraw/zinc/11/25/23/323112523.db2.gz HWDBABXTPCPCEP-MRVPVSSYSA-N 1 2 206.293 2.261 20 0 BEADLO CC[C@@H](C)Nc1cc(NC2CC2)[nH+]cn1 ZINC000243011324 323112524 /nfs/dbraw/zinc/11/25/24/323112524.db2.gz HWDBABXTPCPCEP-MRVPVSSYSA-N 1 2 206.293 2.261 20 0 BEADLO Cc1ncc(C[N@@H+]2CCO[C@H](C(C)(C)C)C2)o1 ZINC000628254578 346238520 /nfs/dbraw/zinc/23/85/20/346238520.db2.gz HQQAELQQWWPVAA-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1ncc(C[N@H+]2CCO[C@H](C(C)(C)C)C2)o1 ZINC000628254578 346238523 /nfs/dbraw/zinc/23/85/23/346238523.db2.gz HQQAELQQWWPVAA-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1[nH]c(CN2C[C@@H](C)O[C@H](C3CC3)C2)[nH+]c1C ZINC000628255464 346249298 /nfs/dbraw/zinc/24/92/98/346249298.db2.gz NPQYSUWMNXGOGA-RNCFNFMXSA-N 1 2 249.358 2.026 20 0 BEADLO COc1cc[nH+]c(-c2ccc(O)cc2)c1 ZINC000167454933 346250124 /nfs/dbraw/zinc/25/01/24/346250124.db2.gz BELWRBOFELNWAT-UHFFFAOYSA-N 1 2 201.225 2.463 20 0 BEADLO Cc1[nH]c(CN2CCC=C(C)C2)[nH+]c1C ZINC000628259010 346259151 /nfs/dbraw/zinc/25/91/51/346259151.db2.gz CJDNALOOBWHTIC-UHFFFAOYSA-N 1 2 205.305 2.179 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC[C@@H]2c2cccnc2)n1 ZINC000628277526 346285882 /nfs/dbraw/zinc/28/58/82/346285882.db2.gz WMOIHXNGGOEJOP-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC[C@@H]2c2cccnc2)n1 ZINC000628277526 346285886 /nfs/dbraw/zinc/28/58/86/346285886.db2.gz WMOIHXNGGOEJOP-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCCc3occc3C2)n1 ZINC000628283705 346295283 /nfs/dbraw/zinc/29/52/83/346295283.db2.gz HSJDQYXKQGQWBD-UHFFFAOYSA-N 1 2 231.299 2.260 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCCc3occc3C2)n1 ZINC000628283705 346295286 /nfs/dbraw/zinc/29/52/86/346295286.db2.gz HSJDQYXKQGQWBD-UHFFFAOYSA-N 1 2 231.299 2.260 20 0 BEADLO CC(C)C[C@@H](C(=O)N[C@@H]1CC12CC2)n1cc[nH+]c1 ZINC000636056200 346303317 /nfs/dbraw/zinc/30/33/17/346303317.db2.gz KHHFRYNJYVPTLC-NWDGAFQWSA-N 1 2 247.342 2.139 20 0 BEADLO COc1ccc(CNc2c[nH]c[nH+]2)cc1 ZINC000309087140 349950229 /nfs/dbraw/zinc/95/02/29/349950229.db2.gz ZCCOBPXCIYCWRS-UHFFFAOYSA-N 1 2 203.245 2.030 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@H](C)C(C)(C)C)[nH+]1 ZINC000636127524 346328313 /nfs/dbraw/zinc/32/83/13/346328313.db2.gz GHTUCFUSOZEAQP-SECBINFHSA-N 1 2 237.347 2.065 20 0 BEADLO CC(C)=C(C)CC(=O)N[C@H]1CCn2c[nH+]cc2C1 ZINC000636070450 346310679 /nfs/dbraw/zinc/31/06/79/346310679.db2.gz BGJSRTFABKQSAY-LBPRGKRZSA-N 1 2 247.342 2.061 20 0 BEADLO CCc1cnc(C[NH2+]Cc2[nH]ncc2C)s1 ZINC000289402061 346311774 /nfs/dbraw/zinc/31/17/74/346311774.db2.gz ALCQGTAQSNETKI-UHFFFAOYSA-N 1 2 236.344 2.027 20 0 BEADLO CCc1cnc(C[NH2+]Cc2n[nH]cc2C)s1 ZINC000289402061 346311778 /nfs/dbraw/zinc/31/17/78/346311778.db2.gz ALCQGTAQSNETKI-UHFFFAOYSA-N 1 2 236.344 2.027 20 0 BEADLO C[C@H](CC(=O)OC(C)(C)C)[NH2+][C@@H](C)C(F)F ZINC000603431477 349953209 /nfs/dbraw/zinc/95/32/09/349953209.db2.gz YCBPBMCELHSUBK-SFYZADRCSA-N 1 2 237.290 2.350 20 0 BEADLO CCc1c[nH]c(CC(=O)N(C)C[C@@H]2CC2(C)C)[nH+]1 ZINC000636236697 346365771 /nfs/dbraw/zinc/36/57/71/346365771.db2.gz BTLPIAXREUEOQL-JTQLQIEISA-N 1 2 249.358 2.019 20 0 BEADLO CCC(C)(C)[C@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636160290 346340816 /nfs/dbraw/zinc/34/08/16/346340816.db2.gz LKHIFJGEQJQSLX-HBNTYKKESA-N 1 2 249.358 2.454 20 0 BEADLO CCC(C)(C)[C@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636160290 346340820 /nfs/dbraw/zinc/34/08/20/346340820.db2.gz LKHIFJGEQJQSLX-HBNTYKKESA-N 1 2 249.358 2.454 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[NH2+]CC[C@@H](C)F ZINC000419172360 192101524 /nfs/dbraw/zinc/10/15/24/192101524.db2.gz JWUXZZGTXAAVKH-GHMZBOCLSA-N 1 2 233.327 2.302 20 0 BEADLO Cc1nn(C)cc1C[N@H+](C)Cc1cccc(C)n1 ZINC000353745714 179069518 /nfs/dbraw/zinc/06/95/18/179069518.db2.gz IXULDPKJLPCCFR-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1nn(C)cc1C[N@@H+](C)Cc1cccc(C)n1 ZINC000353745714 179069520 /nfs/dbraw/zinc/06/95/20/179069520.db2.gz IXULDPKJLPCCFR-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cccc(C[NH+]2CCC(=O)CC2)c1 ZINC000019434524 179073522 /nfs/dbraw/zinc/07/35/22/179073522.db2.gz BPBGKTBGIPVWTJ-UHFFFAOYSA-N 1 2 203.285 2.160 20 0 BEADLO CCSC1(CNc2cc(CO)cc[nH+]2)CC1 ZINC000603408965 349959040 /nfs/dbraw/zinc/95/90/40/349959040.db2.gz IATVOPNNYJITIN-UHFFFAOYSA-N 1 2 238.356 2.272 20 0 BEADLO Cc1ccccc1N(C)C(=O)CCn1cc[nH+]c1 ZINC000623012673 346430967 /nfs/dbraw/zinc/43/09/67/346430967.db2.gz FILMJJRPIFXJBM-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1n[nH]cc1[C@H](C)[NH2+][C@H](C)C(F)F ZINC000641792286 362727369 /nfs/dbraw/zinc/72/73/69/362727369.db2.gz TXVIIAJJXUVONV-CAHLUQPWSA-N 1 2 203.236 2.022 20 0 BEADLO Cn1cc(C[NH2+]CC(C)(F)F)c(C(C)(C)C)n1 ZINC000574930153 346418172 /nfs/dbraw/zinc/41/81/72/346418172.db2.gz KNDNEIIUVRUPAR-UHFFFAOYSA-N 1 2 245.317 2.462 20 0 BEADLO Cc1ccc2[nH]c(=[NH+]C[C@@H]3CCSC3)[nH]c2c1 ZINC000641795289 362736807 /nfs/dbraw/zinc/73/68/07/362736807.db2.gz WMIBTKLULMEMIX-JTQLQIEISA-N 1 2 247.367 2.458 20 0 BEADLO CCc1noc(C)c1C[N@@H+]1C[C@H](C)OC[C@H]1C ZINC000334226835 346447259 /nfs/dbraw/zinc/44/72/59/346447259.db2.gz NIHHKQGPTHYHKD-ZJUUUORDSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1noc(C)c1C[N@H+]1C[C@H](C)OC[C@H]1C ZINC000334226835 346447261 /nfs/dbraw/zinc/44/72/61/346447261.db2.gz NIHHKQGPTHYHKD-ZJUUUORDSA-N 1 2 238.331 2.155 20 0 BEADLO C[C@H]([NH2+][C@H]1CCCc2nn(C)cc21)C(F)F ZINC000641791284 362730540 /nfs/dbraw/zinc/73/05/40/362730540.db2.gz GGOFRBDPZAWIJA-CBAPKCEASA-N 1 2 229.274 2.041 20 0 BEADLO C[C@H]([NH2+]Cc1ccc2nccnc2c1)C(F)F ZINC000641794023 362733351 /nfs/dbraw/zinc/73/33/51/362733351.db2.gz JHYNOAWTFXTANF-QMMMGPOBSA-N 1 2 237.253 2.373 20 0 BEADLO CCOc1cncc(C[NH2+][C@@H](C)C(F)F)c1 ZINC000641794077 362734233 /nfs/dbraw/zinc/73/42/33/362734233.db2.gz JYSFVSDEAOFCQJ-QMMMGPOBSA-N 1 2 230.258 2.224 20 0 BEADLO C[C@@H]([NH2+]Cc1ccc2[nH]c(=O)[nH]c2c1)C(F)F ZINC000641794267 362734338 /nfs/dbraw/zinc/73/43/38/362734338.db2.gz UPLBDPRVSZTBFS-ZCFIWIBFSA-N 1 2 241.241 2.012 20 0 BEADLO C[C@@H]([NH2+]Cc1ccc2c(c1)ncn2C)C(F)F ZINC000641793629 362735364 /nfs/dbraw/zinc/73/53/64/362735364.db2.gz MJMREZXAOHNEPF-MRVPVSSYSA-N 1 2 239.269 2.317 20 0 BEADLO CN(c1cc(CO)cc[nH+]1)C1CC(C)(C)C1 ZINC000395528824 362735383 /nfs/dbraw/zinc/73/53/83/362735383.db2.gz RRAPXPRTHQMUIB-UHFFFAOYSA-N 1 2 220.316 2.199 20 0 BEADLO CO[C@H](CC(C)C)C[N@H+](C)CC(F)F ZINC000419204811 192104066 /nfs/dbraw/zinc/10/40/66/192104066.db2.gz JHICVNKQUZEBKS-SECBINFHSA-N 1 2 209.280 2.244 20 0 BEADLO CO[C@H](CC(C)C)C[N@@H+](C)CC(F)F ZINC000419204811 192104067 /nfs/dbraw/zinc/10/40/67/192104067.db2.gz JHICVNKQUZEBKS-SECBINFHSA-N 1 2 209.280 2.244 20 0 BEADLO CC[C@@H]([NH2+]Cc1c(C)noc1C)c1nccn1C ZINC000182605131 347100350 /nfs/dbraw/zinc/10/03/50/347100350.db2.gz QQPJACSEMNBKNM-GFCCVEGCSA-N 1 2 248.330 2.266 20 0 BEADLO CC(C)(C[NH2+]Cc1ccn[nH]1)C(F)(F)F ZINC000380153008 346528241 /nfs/dbraw/zinc/52/82/41/346528241.db2.gz YESUYWASMAYRSO-UHFFFAOYSA-N 1 2 221.226 2.088 20 0 BEADLO Cc1ccc(NC(=O)Cc2c[nH+]cn2C)c(C)c1 ZINC000186743402 346532757 /nfs/dbraw/zinc/53/27/57/346532757.db2.gz XSGHIOHWDRNTOJ-UHFFFAOYSA-N 1 2 243.310 2.218 20 0 BEADLO CCc1ccccc1NC(=O)Cc1c[nH+]cn1C ZINC000186857722 346542448 /nfs/dbraw/zinc/54/24/48/346542448.db2.gz ICXLYAOORKNRIQ-UHFFFAOYSA-N 1 2 243.310 2.164 20 0 BEADLO Cc1cc(NC(=O)[C@@H](C)C2CCC2)c(C)c[nH+]1 ZINC000580163505 346586399 /nfs/dbraw/zinc/58/63/99/346586399.db2.gz XLJJEQWRSGDUAT-NSHDSACASA-N 1 2 232.327 2.495 20 0 BEADLO CC1(C)CC[C@@H](CNc2cccc[nH+]2)O1 ZINC000302354597 346604883 /nfs/dbraw/zinc/60/48/83/346604883.db2.gz CBZDOTAEYXUEEU-JTQLQIEISA-N 1 2 206.289 2.451 20 0 BEADLO c1csc(C[NH2+]Cc2[nH]nc3ccccc32)n1 ZINC000589642526 346721798 /nfs/dbraw/zinc/72/17/98/346721798.db2.gz LHPXLNYNAQGUSO-UHFFFAOYSA-N 1 2 244.323 2.309 20 0 BEADLO CC(C)(C)c1nc(NCCn2cccn2)cc[nH+]1 ZINC000301565786 187371142 /nfs/dbraw/zinc/37/11/42/187371142.db2.gz ZCBAWQMYCCBFRH-UHFFFAOYSA-N 1 2 245.330 2.083 20 0 BEADLO CC1(C)CN(c2[nH+]ccc3ccccc32)C[C@@H]1O ZINC000387871997 347112732 /nfs/dbraw/zinc/11/27/32/347112732.db2.gz BLVFHYLYYRHYOT-ZDUSSCGKSA-N 1 2 242.322 2.442 20 0 BEADLO CCc1nnc(C[N@@H+](CC)Cc2ccccc2)[nH]1 ZINC000185147866 347191541 /nfs/dbraw/zinc/19/15/41/347191541.db2.gz LMHFKMFCIZEMMG-UHFFFAOYSA-N 1 2 244.342 2.389 20 0 BEADLO CCc1nnc(C[N@H+](CC)Cc2ccccc2)[nH]1 ZINC000185147866 347191544 /nfs/dbraw/zinc/19/15/44/347191544.db2.gz LMHFKMFCIZEMMG-UHFFFAOYSA-N 1 2 244.342 2.389 20 0 BEADLO Cc1cccc([C@@H](C)[NH2+]Cc2ncn(C)n2)c1C ZINC000090970264 179183164 /nfs/dbraw/zinc/18/31/64/179183164.db2.gz SUKGKZCFXIFJSV-GFCCVEGCSA-N 1 2 244.342 2.283 20 0 BEADLO CCc1nocc1CN(C)Cc1[nH]c(C)c(C)[nH+]1 ZINC000628296768 347245139 /nfs/dbraw/zinc/24/51/39/347245139.db2.gz XULOMCRSFBJLIY-UHFFFAOYSA-N 1 2 248.330 2.209 20 0 BEADLO Cc1cccc([C@H](C)[NH2+]Cc2ncn(C)n2)c1C ZINC000090970265 179195966 /nfs/dbraw/zinc/19/59/66/179195966.db2.gz SUKGKZCFXIFJSV-LBPRGKRZSA-N 1 2 244.342 2.283 20 0 BEADLO CCc1nc(C)c(C[NH2+][C@@H](C)c2nccn2C)o1 ZINC000311687952 349975801 /nfs/dbraw/zinc/97/58/01/349975801.db2.gz NYYVYSHPBIPFRL-JTQLQIEISA-N 1 2 248.330 2.130 20 0 BEADLO Cc1cccc([C@H](O)CNc2cc(C)[nH+]cn2)c1 ZINC000132588894 179202685 /nfs/dbraw/zinc/20/26/85/179202685.db2.gz UJHHLTGZBXYJNM-CYBMUJFWSA-N 1 2 243.310 2.239 20 0 BEADLO Cc1ccccc1N(C)C(=O)C[NH+]1CC(C)(C)C1 ZINC000623047597 347303850 /nfs/dbraw/zinc/30/38/50/347303850.db2.gz JCWXFARGOCDTCR-UHFFFAOYSA-N 1 2 246.354 2.300 20 0 BEADLO FC(F)(F)C1CC[NH+](Cc2ncccn2)CC1 ZINC000192047840 347366688 /nfs/dbraw/zinc/36/66/88/347366688.db2.gz JCLSXNSGFODYAC-UHFFFAOYSA-N 1 2 245.248 2.251 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+]2CC[C@@](C)(F)C2)cn1 ZINC000335876783 136744781 /nfs/dbraw/zinc/74/47/81/136744781.db2.gz MWAVJUVFAQITLO-ZYHUDNBSSA-N 1 2 223.295 2.280 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+]2CC[C@@](C)(F)C2)cn1 ZINC000335876783 136744782 /nfs/dbraw/zinc/74/47/82/136744782.db2.gz MWAVJUVFAQITLO-ZYHUDNBSSA-N 1 2 223.295 2.280 20 0 BEADLO CC[C@@H](CC(C)C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616921763 347451191 /nfs/dbraw/zinc/45/11/91/347451191.db2.gz BLSVDQNTDHRLOJ-NSHDSACASA-N 1 2 237.347 2.440 20 0 BEADLO CC[C@@H](CC(C)C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616921763 347451193 /nfs/dbraw/zinc/45/11/93/347451193.db2.gz BLSVDQNTDHRLOJ-NSHDSACASA-N 1 2 237.347 2.440 20 0 BEADLO Cc1cccc2[nH+]c(CSCCCO)cn21 ZINC000298210146 179230402 /nfs/dbraw/zinc/23/04/02/179230402.db2.gz IZDZTWINDRCLKB-UHFFFAOYSA-N 1 2 236.340 2.258 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)CC1CCCCC1 ZINC000616922169 347452161 /nfs/dbraw/zinc/45/21/61/347452161.db2.gz RKGFGIJDAJCCLD-UHFFFAOYSA-N 1 2 235.331 2.339 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)CC1CCCCC1 ZINC000616922169 347452164 /nfs/dbraw/zinc/45/21/64/347452164.db2.gz RKGFGIJDAJCCLD-UHFFFAOYSA-N 1 2 235.331 2.339 20 0 BEADLO Cc1oc(C)c(C(=O)N(C)Cc2c[nH+]c[nH]2)c1C ZINC000616922776 347453604 /nfs/dbraw/zinc/45/36/04/347453604.db2.gz IZNFVPZQFYBMAW-UHFFFAOYSA-N 1 2 247.298 2.200 20 0 BEADLO Cc1oc(C)c(C(=O)N(C)Cc2c[nH]c[nH+]2)c1C ZINC000616922776 347453607 /nfs/dbraw/zinc/45/36/07/347453607.db2.gz IZNFVPZQFYBMAW-UHFFFAOYSA-N 1 2 247.298 2.200 20 0 BEADLO C[C@H]1CCC[C@H](C(=O)N(C)Cc2c[nH+]c[nH]2)C1 ZINC000616925598 347456980 /nfs/dbraw/zinc/45/69/80/347456980.db2.gz LABNVZPSQLGYGG-QWRGUYRKSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@H]1CCC[C@H](C(=O)N(C)Cc2c[nH]c[nH+]2)C1 ZINC000616925598 347456982 /nfs/dbraw/zinc/45/69/82/347456982.db2.gz LABNVZPSQLGYGG-QWRGUYRKSA-N 1 2 235.331 2.194 20 0 BEADLO CCCC[C@H](C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616928617 347495127 /nfs/dbraw/zinc/49/51/27/347495127.db2.gz GXHYNNQYDBCJLD-JTQLQIEISA-N 1 2 223.320 2.194 20 0 BEADLO CCCC[C@H](C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616928617 347495130 /nfs/dbraw/zinc/49/51/30/347495130.db2.gz GXHYNNQYDBCJLD-JTQLQIEISA-N 1 2 223.320 2.194 20 0 BEADLO CC(C)CCC(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000590730939 347497396 /nfs/dbraw/zinc/49/73/96/347497396.db2.gz LBZNZPLLCVNWKV-ZDUSSCGKSA-N 1 2 249.358 2.483 20 0 BEADLO CC(C)(C)CC(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000590729393 347497484 /nfs/dbraw/zinc/49/74/84/347497484.db2.gz JEBPJPLXLWQKBQ-GFCCVEGCSA-N 1 2 249.358 2.483 20 0 BEADLO CCC1(C(=O)N(C)Cc2c[nH+]c[nH]2)CCCC1 ZINC000616926790 347459407 /nfs/dbraw/zinc/45/94/07/347459407.db2.gz QCYSTXDIKWPHTM-UHFFFAOYSA-N 1 2 235.331 2.339 20 0 BEADLO CCC1(C(=O)N(C)Cc2c[nH]c[nH+]2)CCCC1 ZINC000616926790 347459409 /nfs/dbraw/zinc/45/94/09/347459409.db2.gz QCYSTXDIKWPHTM-UHFFFAOYSA-N 1 2 235.331 2.339 20 0 BEADLO CCc1oc(C(=O)N(C)Cc2c[nH+]c[nH]2)cc1C ZINC000616926887 347459813 /nfs/dbraw/zinc/45/98/13/347459813.db2.gz UEGBSDAPGDURLK-UHFFFAOYSA-N 1 2 247.298 2.146 20 0 BEADLO CCc1oc(C(=O)N(C)Cc2c[nH]c[nH+]2)cc1C ZINC000616926887 347459816 /nfs/dbraw/zinc/45/98/16/347459816.db2.gz UEGBSDAPGDURLK-UHFFFAOYSA-N 1 2 247.298 2.146 20 0 BEADLO CCC[C@H](C(=O)N(C)Cc1c[nH+]c[nH]1)C(C)C ZINC000616927022 347459980 /nfs/dbraw/zinc/45/99/80/347459980.db2.gz YPGMMBKSWRLROZ-LBPRGKRZSA-N 1 2 237.347 2.440 20 0 BEADLO CCC[C@H](C(=O)N(C)Cc1c[nH]c[nH+]1)C(C)C ZINC000616927022 347459982 /nfs/dbraw/zinc/45/99/82/347459982.db2.gz YPGMMBKSWRLROZ-LBPRGKRZSA-N 1 2 237.347 2.440 20 0 BEADLO C[C@H]1CCC[C@H](C)N1C(=O)CCCn1cc[nH+]c1 ZINC000590885750 347579816 /nfs/dbraw/zinc/57/98/16/347579816.db2.gz PDSTULSZSAUJNQ-STQMWFEESA-N 1 2 249.358 2.453 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)[C@@H]1CCc2[nH+]ccn2C1 ZINC000616976614 347547259 /nfs/dbraw/zinc/54/72/59/347547259.db2.gz TXWCUCARHSQLEK-VXGBXAGGSA-N 1 2 249.358 2.093 20 0 BEADLO C[C@@H]1C[C@H]1C(=O)NCCCCNc1cccc[nH+]1 ZINC000591063059 347612723 /nfs/dbraw/zinc/61/27/23/347612723.db2.gz HNKHFMUTWRTGIX-VXGBXAGGSA-N 1 2 247.342 2.046 20 0 BEADLO c1cn([C@H]2CCCN(Cc3cscn3)C2)c[nH+]1 ZINC000591866866 347707435 /nfs/dbraw/zinc/70/74/35/347707435.db2.gz IALAMJCKXVOCRQ-LBPRGKRZSA-N 1 2 248.355 2.177 20 0 BEADLO CC[C@H]([NH2+][C@H](C)[C@H](C)OC)C(=O)OC(C)(C)C ZINC000592401030 347777097 /nfs/dbraw/zinc/77/70/97/347777097.db2.gz WQPHOYBWVAQVDH-VWYCJHECSA-N 1 2 245.363 2.120 20 0 BEADLO CC[C@H]([NH2+][C@@H](C)[C@@H](C)OC)C(=O)OC(C)(C)C ZINC000592401026 347777365 /nfs/dbraw/zinc/77/73/65/347777365.db2.gz WQPHOYBWVAQVDH-AXFHLTTASA-N 1 2 245.363 2.120 20 0 BEADLO Cc1nc(CN(C)c2cc[nH+]c(C)n2)cs1 ZINC000360529005 187380743 /nfs/dbraw/zinc/38/07/43/187380743.db2.gz JVCOIZKEUQFDJU-UHFFFAOYSA-N 1 2 234.328 2.186 20 0 BEADLO CCSCC[NH2+][C@@H](CC)C(=O)OC(C)(C)C ZINC000592529143 347796348 /nfs/dbraw/zinc/79/63/48/347796348.db2.gz YDIPFQVTGURTAK-JTQLQIEISA-N 1 2 247.404 2.449 20 0 BEADLO CC[C@@H]1CCC[N@H+](Cc2noc(C)n2)CC1 ZINC000117342553 347819494 /nfs/dbraw/zinc/81/94/94/347819494.db2.gz WVIQXBFAJFGSDB-LLVKDONJSA-N 1 2 223.320 2.390 20 0 BEADLO CC[C@@H]1CCC[N@@H+](Cc2noc(C)n2)CC1 ZINC000117342553 347819496 /nfs/dbraw/zinc/81/94/96/347819496.db2.gz WVIQXBFAJFGSDB-LLVKDONJSA-N 1 2 223.320 2.390 20 0 BEADLO CCOC(=O)CCCC[N@@H+]1CCCC(F)(F)C1 ZINC000593047948 347844038 /nfs/dbraw/zinc/84/40/38/347844038.db2.gz GNRMFEMYLKAJOX-UHFFFAOYSA-N 1 2 249.301 2.451 20 0 BEADLO CCOC(=O)CCCC[N@H+]1CCCC(F)(F)C1 ZINC000593047948 347844042 /nfs/dbraw/zinc/84/40/42/347844042.db2.gz GNRMFEMYLKAJOX-UHFFFAOYSA-N 1 2 249.301 2.451 20 0 BEADLO CCCC(CCC)C(=O)NCc1[nH]cc[nH+]1 ZINC000128618911 168581622 /nfs/dbraw/zinc/58/16/22/168581622.db2.gz RHGIFVPGGRFLJU-UHFFFAOYSA-N 1 2 223.320 2.242 20 0 BEADLO C[C@@H]1CC[C@@H](C)N1C(=O)c1ccc2[nH+]ccn2c1 ZINC000176934848 365931940 /nfs/dbraw/zinc/93/19/40/365931940.db2.gz VFANWZDKBPUERB-GHMZBOCLSA-N 1 2 243.310 2.347 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC1CC=CC1 ZINC000121895337 490112809 /nfs/dbraw/zinc/11/28/09/490112809.db2.gz GHPZKBJNGHFMBM-UHFFFAOYSA-N 1 2 217.272 2.230 20 0 BEADLO CCCN(C)c1cc(CC)[nH+]c(CC)n1 ZINC001639349839 1172098966 /nfs/dbraw/zinc/09/89/66/1172098966.db2.gz XZEVCOWFXLOCSJ-UHFFFAOYSA-N 1 2 207.321 2.448 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1CC[C@H](F)C1 ZINC000577411877 365950108 /nfs/dbraw/zinc/95/01/08/365950108.db2.gz LDXQDJKAPXSSBV-VHSXEESVSA-N 1 2 209.268 2.396 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1CC[C@H](F)C1 ZINC000577411876 365950597 /nfs/dbraw/zinc/95/05/97/365950597.db2.gz LDXQDJKAPXSSBV-UWVGGRQHSA-N 1 2 209.268 2.396 20 0 BEADLO Cc1cccn2cc(C[S@@](=O)CC3CC3)[nH+]c12 ZINC000133744969 179356044 /nfs/dbraw/zinc/35/60/44/179356044.db2.gz ZJQIYGATJQRLNU-QGZVFWFLSA-N 1 2 248.351 2.301 20 0 BEADLO CCCC[C@H]([NH2+]C[C@@]1(C)CC1(F)F)C(=O)OC ZINC000594732704 348109186 /nfs/dbraw/zinc/10/91/86/348109186.db2.gz XDQDDWPJOAIECY-GXSJLCMTSA-N 1 2 249.301 2.353 20 0 BEADLO Cc1cccn2cc(C[S@](=O)CC3CC3)[nH+]c12 ZINC000133745166 179357166 /nfs/dbraw/zinc/35/71/66/179357166.db2.gz ZJQIYGATJQRLNU-KRWDZBQOSA-N 1 2 248.351 2.301 20 0 BEADLO Cc1ccccc1[S@@](=O)Cc1[nH+]ccn1C ZINC000129285170 179352061 /nfs/dbraw/zinc/35/20/61/179352061.db2.gz AYVXQPDBIAKGIA-MRXNPFEDSA-N 1 2 234.324 2.036 20 0 BEADLO Cc1ccc[nH+]c1CCCNc1ncccn1 ZINC000295093647 179367935 /nfs/dbraw/zinc/36/79/35/179367935.db2.gz ZNXDJTPKRPHPED-UHFFFAOYSA-N 1 2 228.299 2.225 20 0 BEADLO Cc1cc(C)nc(N[C@H]2C[C@@H](C)n3cc[nH+]c32)n1 ZINC000577459918 365957057 /nfs/dbraw/zinc/95/70/57/365957057.db2.gz POSQUXPROQCAGU-MNOVXSKESA-N 1 2 243.314 2.408 20 0 BEADLO CC(C)C[C@H](C)Nc1[nH+]cnc2c1cnn2C ZINC000037265055 187392268 /nfs/dbraw/zinc/39/22/68/187392268.db2.gz QAAHJXUBPZFHDO-VIFPVBQESA-N 1 2 233.319 2.210 20 0 BEADLO Cc1cccnc1C[NH2+][C@H](C)c1ccon1 ZINC000309814162 179385218 /nfs/dbraw/zinc/38/52/18/179385218.db2.gz UXVKOJHUPRMHOD-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO CCOC(=O)[C@@H]1CC[C@H](C)[N@H+](CC(F)F)[C@@H]1C ZINC000595554219 348269516 /nfs/dbraw/zinc/26/95/16/348269516.db2.gz JMBRMJYVFGDETN-IVZWLZJFSA-N 1 2 249.301 2.304 20 0 BEADLO CCOC(=O)[C@@H]1CC[C@H](C)[N@@H+](CC(F)F)[C@@H]1C ZINC000595554219 348269519 /nfs/dbraw/zinc/26/95/19/348269519.db2.gz JMBRMJYVFGDETN-IVZWLZJFSA-N 1 2 249.301 2.304 20 0 BEADLO CCc1nc(C[NH2+]Cc2cncs2)cs1 ZINC000136088552 323180981 /nfs/dbraw/zinc/18/09/81/323180981.db2.gz XIFRABDUEXTGHK-UHFFFAOYSA-N 1 2 239.369 2.452 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1Cc1[nH]ncc1C ZINC000651913299 490154829 /nfs/dbraw/zinc/15/48/29/490154829.db2.gz RYILNOSMWUTUEO-NEPJUHHUSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@H+]1Cc1[nH]ncc1C ZINC000651913299 490154836 /nfs/dbraw/zinc/15/48/36/490154836.db2.gz RYILNOSMWUTUEO-NEPJUHHUSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1Cc1n[nH]cc1C ZINC000651913299 490154838 /nfs/dbraw/zinc/15/48/38/490154838.db2.gz RYILNOSMWUTUEO-NEPJUHHUSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@H+]1Cc1n[nH]cc1C ZINC000651913299 490154845 /nfs/dbraw/zinc/15/48/45/490154845.db2.gz RYILNOSMWUTUEO-NEPJUHHUSA-N 1 2 237.347 2.108 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)Nc1c[nH]c2ccccc12 ZINC001639397373 1172102876 /nfs/dbraw/zinc/10/28/76/1172102876.db2.gz YPCHTIHRDWYYIX-UHFFFAOYSA-N 1 2 240.266 2.072 20 0 BEADLO CC(C)CC1([NH2+]CC(=O)OC(C)(C)C)CC1 ZINC000595830043 348364965 /nfs/dbraw/zinc/36/49/65/348364965.db2.gz DTDKOIOCIOOBNQ-UHFFFAOYSA-N 1 2 227.348 2.496 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+]C1(CC(C)C)CC1 ZINC000595831001 348365658 /nfs/dbraw/zinc/36/56/58/348365658.db2.gz JPTYUKCRMVPDRD-JTQLQIEISA-N 1 2 213.321 2.106 20 0 BEADLO CSCC[N@@H+]1CCO[C@H](CC(F)(F)F)C1 ZINC000595888681 348389984 /nfs/dbraw/zinc/38/99/84/348389984.db2.gz ZOAZJEFRDUTZJL-MRVPVSSYSA-N 1 2 243.294 2.003 20 0 BEADLO CSCC[N@H+]1CCO[C@H](CC(F)(F)F)C1 ZINC000595888681 348389986 /nfs/dbraw/zinc/38/99/86/348389986.db2.gz ZOAZJEFRDUTZJL-MRVPVSSYSA-N 1 2 243.294 2.003 20 0 BEADLO CCC[C@H]([NH2+]CC1=CCCC1)C(=O)OCC ZINC000596048339 348429281 /nfs/dbraw/zinc/42/92/81/348429281.db2.gz USIDSEAIYDBGTA-LBPRGKRZSA-N 1 2 225.332 2.418 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N2C[C@H](C)C[C@@H]2C)c1 ZINC000596135720 348447659 /nfs/dbraw/zinc/44/76/59/348447659.db2.gz KONAETDSASDBJX-MNOVXSKESA-N 1 2 248.326 2.032 20 0 BEADLO CCCN(CC)c1cc(CC(=O)OC)cc[nH+]1 ZINC000596148254 348452354 /nfs/dbraw/zinc/45/23/54/348452354.db2.gz BFQFSZMQBHHOOX-UHFFFAOYSA-N 1 2 236.315 2.033 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@@H]2CC[C@H]2C)c1 ZINC000596231401 348463152 /nfs/dbraw/zinc/46/31/52/348463152.db2.gz LPTBRZJNFNZPLS-MWLCHTKSSA-N 1 2 234.299 2.008 20 0 BEADLO Cc1ccc(C[NH+]2CCOCC2)c(Cl)c1 ZINC000205483153 348531516 /nfs/dbraw/zinc/53/15/16/348531516.db2.gz OEIQSDPDVULFPZ-UHFFFAOYSA-N 1 2 225.719 2.481 20 0 BEADLO CSCc1nc(Cc2c[nH+]ccc2C)no1 ZINC000596616602 348594043 /nfs/dbraw/zinc/59/40/43/348594043.db2.gz JFNFJGMBFBETMW-UHFFFAOYSA-N 1 2 235.312 2.227 20 0 BEADLO CC[C@@H](Nc1cc(CC(=O)OC)cc[nH+]1)C1CC1 ZINC000596485449 348558574 /nfs/dbraw/zinc/55/85/74/348558574.db2.gz IVQUBMFXWUVCKN-GFCCVEGCSA-N 1 2 248.326 2.398 20 0 BEADLO COC(=O)Cc1cc[nH+]c(NC2CC(C)(C)C2)c1 ZINC000596552464 348576784 /nfs/dbraw/zinc/57/67/84/348576784.db2.gz MGZFVMGAWQTRDA-UHFFFAOYSA-N 1 2 248.326 2.398 20 0 BEADLO Cc1cnc(C[NH2+][C@H](C)c2cccc(O)c2)nc1 ZINC000341812029 179611517 /nfs/dbraw/zinc/61/15/17/179611517.db2.gz ZETIFACLJODFDI-LLVKDONJSA-N 1 2 243.310 2.341 20 0 BEADLO CC(C)(CO)CCCNc1cccc[nH+]1 ZINC000266284533 192373798 /nfs/dbraw/zinc/37/37/98/192373798.db2.gz VDQTUCPOOCFNJJ-UHFFFAOYSA-N 1 2 208.305 2.292 20 0 BEADLO Cc1occc1CNc1cc(CO)cc[nH+]1 ZINC000623051499 348917581 /nfs/dbraw/zinc/91/75/81/348917581.db2.gz PKJSVMFPKBZBIS-UHFFFAOYSA-N 1 2 218.256 2.087 20 0 BEADLO Cc1nc(C)c([C@@H](C)[NH2+]Cc2ncccn2)s1 ZINC000054459390 349033493 /nfs/dbraw/zinc/03/34/93/349033493.db2.gz NXOVRTUKYUSLHT-MRVPVSSYSA-N 1 2 248.355 2.401 20 0 BEADLO C[C@@H]([NH2+]Cc1ncccn1)c1ccc(F)cc1 ZINC000054459534 349033733 /nfs/dbraw/zinc/03/37/33/349033733.db2.gz BKXAGCFYPHALIS-SNVBAGLBSA-N 1 2 231.274 2.467 20 0 BEADLO COC[C@H](C)C[NH2+][C@@H](C(C)C)C(F)(F)F ZINC000308951490 349181257 /nfs/dbraw/zinc/18/12/57/349181257.db2.gz PFKOSZJYKOXIEL-BDAKNGLRSA-N 1 2 227.270 2.445 20 0 BEADLO CCOC(=O)[C@@H]1c2ccoc2CC[N@H+]1CC1CC1 ZINC000599548744 349215191 /nfs/dbraw/zinc/21/51/91/349215191.db2.gz QOWXTQNYTKOYKO-ZDUSSCGKSA-N 1 2 249.310 2.152 20 0 BEADLO CCOC(=O)[C@@H]1c2ccoc2CC[N@@H+]1CC1CC1 ZINC000599548744 349215193 /nfs/dbraw/zinc/21/51/93/349215193.db2.gz QOWXTQNYTKOYKO-ZDUSSCGKSA-N 1 2 249.310 2.152 20 0 BEADLO CSCC[NH2+]C(C)(C)C(=O)OC(C)(C)C ZINC000599650333 349234655 /nfs/dbraw/zinc/23/46/55/349234655.db2.gz SGUNOVIRVYAICX-UHFFFAOYSA-N 1 2 233.377 2.059 20 0 BEADLO CC[C@H]1C[C@@H](CNc2c[nH]c[nH+]2)CCO1 ZINC000308960381 349202740 /nfs/dbraw/zinc/20/27/40/349202740.db2.gz RTVIYUMQJHGQPJ-UWVGGRQHSA-N 1 2 209.293 2.027 20 0 BEADLO OC[C@@H](CCF)Nc1cc2ccccc2c[nH+]1 ZINC000631340757 349290774 /nfs/dbraw/zinc/29/07/74/349290774.db2.gz LKKBUCCHAITLLP-GFCCVEGCSA-N 1 2 234.274 2.367 20 0 BEADLO Cc1cc(N2CC[C@H]2C)nc(-c2ccncc2)[nH+]1 ZINC000601511386 349294738 /nfs/dbraw/zinc/29/47/38/349294738.db2.gz BFLRWURFCWIIDY-LLVKDONJSA-N 1 2 240.310 2.446 20 0 BEADLO Cc1nc(C(C)C)oc1C[N@@H+]1CCOC[C@@H]1C ZINC000336269619 179896644 /nfs/dbraw/zinc/89/66/44/179896644.db2.gz ICGGXZBSSIGMLF-JTQLQIEISA-N 1 2 238.331 2.327 20 0 BEADLO Cc1nc(C(C)C)oc1C[N@H+]1CCOC[C@@H]1C ZINC000336269619 179896647 /nfs/dbraw/zinc/89/66/47/179896647.db2.gz ICGGXZBSSIGMLF-JTQLQIEISA-N 1 2 238.331 2.327 20 0 BEADLO Cc1[nH]c(C(=O)NCCC2CCCC2)c[nH+]1 ZINC000264612776 179882753 /nfs/dbraw/zinc/88/27/53/179882753.db2.gz IMRWMXNGZRLGPP-UHFFFAOYSA-N 1 2 221.304 2.028 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@@H]2CCC[C@@H](C)C2)c[nH+]1 ZINC000264827034 179884033 /nfs/dbraw/zinc/88/40/33/179884033.db2.gz IGIMELSKVOALJF-MWLCHTKSSA-N 1 2 235.331 2.274 20 0 BEADLO Cc1nc(N(C)C[C@@H]2CCCO2)c(C)c(C)[nH+]1 ZINC000301630384 179905411 /nfs/dbraw/zinc/90/54/11/179905411.db2.gz BGLPSNKZGSOKKE-LBPRGKRZSA-N 1 2 235.331 2.017 20 0 BEADLO CCn1cc[nH+]c1CNc1cnn(C(C)C)c1 ZINC000061683153 349388072 /nfs/dbraw/zinc/38/80/72/349388072.db2.gz JTAXAJOPHZZUPR-UHFFFAOYSA-N 1 2 233.319 2.293 20 0 BEADLO COC(=O)c1oc(C[NH2+]Cc2ccco2)cc1C ZINC000603658848 350010117 /nfs/dbraw/zinc/01/01/17/350010117.db2.gz HHFUJZGQZASWJM-UHFFFAOYSA-N 1 2 249.266 2.257 20 0 BEADLO CC[C@H](C)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000603784905 350032892 /nfs/dbraw/zinc/03/28/92/350032892.db2.gz BKOLTMKHWGVKOZ-VIFPVBQESA-N 1 2 217.272 2.319 20 0 BEADLO CC(=O)[C@@H](C)Sc1[nH+]cc2ccccn21 ZINC000072739501 191005226 /nfs/dbraw/zinc/00/52/26/191005226.db2.gz WNFLMUHGTXGNDO-SECBINFHSA-N 1 2 220.297 2.404 20 0 BEADLO CCO[C@H](CC)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000603886028 350048577 /nfs/dbraw/zinc/04/85/77/350048577.db2.gz VSUCARZBPJWXIO-LLVKDONJSA-N 1 2 247.298 2.088 20 0 BEADLO Cc1nc(CNc2cccc[nH+]2)ccc1[C@@H](C)O ZINC000275387904 179976771 /nfs/dbraw/zinc/97/67/71/179976771.db2.gz CJGJVPYLPWCJED-LLVKDONJSA-N 1 2 243.310 2.450 20 0 BEADLO CC(C)(C)CCCC(=O)N1CC(n2cc[nH+]c2)C1 ZINC000603916461 350056187 /nfs/dbraw/zinc/05/61/87/350056187.db2.gz JDBGMFIJJUNZLL-UHFFFAOYSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1ncc(C[NH2+]Cc2cc(C(C)C)no2)cn1 ZINC000603949974 350058636 /nfs/dbraw/zinc/05/86/36/350058636.db2.gz JNZVCZHABPDXPO-UHFFFAOYSA-N 1 2 246.314 2.186 20 0 BEADLO Cc1nc([C@@H](C)[NH2+]Cc2cc[nH]n2)cs1 ZINC000041015140 180037149 /nfs/dbraw/zinc/03/71/49/180037149.db2.gz JAHPSSDFOAOAQM-SSDOTTSWSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1nc([C@@H](C)[NH2+]Cc2ccnn2C)cs1 ZINC000070904104 180037411 /nfs/dbraw/zinc/03/74/11/180037411.db2.gz CMWYAMOJJYNCTJ-MRVPVSSYSA-N 1 2 236.344 2.036 20 0 BEADLO CCC[C@H]([NH2+][C@@H]1CCS[C@@H]1C)C(=O)OCC ZINC000390748162 362949601 /nfs/dbraw/zinc/94/96/01/362949601.db2.gz BHAZSWAWRMCPGH-MXWKQRLJSA-N 1 2 245.388 2.202 20 0 BEADLO Cc1nc([C@H](C)NCc2[nH]cc[nH+]2)cs1 ZINC000066594153 180050451 /nfs/dbraw/zinc/05/04/51/180050451.db2.gz DRKPKTOUIZGOLQ-ZETCQYMHSA-N 1 2 222.317 2.025 20 0 BEADLO COC1CC(Nc2cccc(-n3cc[nH+]c3)c2)C1 ZINC000219402390 350125468 /nfs/dbraw/zinc/12/54/68/350125468.db2.gz QMDDLJFNNSFTIG-UHFFFAOYSA-N 1 2 243.310 2.462 20 0 BEADLO Cc1nc(N2CCCC2)c2c([nH+]1)CCCC2 ZINC000268033463 180067684 /nfs/dbraw/zinc/06/76/84/180067684.db2.gz ZNJNKNQQRJBWCL-UHFFFAOYSA-N 1 2 217.316 2.264 20 0 BEADLO CCOC(C)(C)C(=O)Nc1ccc(C)[nH+]c1C ZINC000636995567 350132183 /nfs/dbraw/zinc/13/21/83/350132183.db2.gz SORXXMMRLMGPQG-UHFFFAOYSA-N 1 2 236.315 2.452 20 0 BEADLO Cc1[nH+]c2ccc(C(=O)NCC3CC3)cc2n1C ZINC000336566469 180088665 /nfs/dbraw/zinc/08/86/65/180088665.db2.gz FRDNNDDLCFONIQ-UHFFFAOYSA-N 1 2 243.310 2.022 20 0 BEADLO Cc1nc(NCC2CC2)c2c([nH+]1)CCCC2 ZINC000302066201 180068452 /nfs/dbraw/zinc/06/84/52/180068452.db2.gz WDRQZHUTVLQNEH-UHFFFAOYSA-N 1 2 217.316 2.486 20 0 BEADLO Cc1nc(NC[C@H](C)CCO)c2c([nH+]1)CCCC2 ZINC000302115957 180069933 /nfs/dbraw/zinc/06/99/33/180069933.db2.gz WCFVBEPBRYAAHK-SNVBAGLBSA-N 1 2 249.358 2.094 20 0 BEADLO Cc1[nH+]c2ccccc2n1[C@@H](C)[C@@H](C)O ZINC000044184398 180104276 /nfs/dbraw/zinc/10/42/76/180104276.db2.gz ZMTRFGWKMYMZKD-DTWKUNHWSA-N 1 2 204.273 2.287 20 0 BEADLO Fc1ccc(C[N@@H+]2CCCOCC2)c(F)c1 ZINC000334274649 538063747 /nfs/dbraw/zinc/06/37/47/538063747.db2.gz BFDJGGLPZHFSTR-UHFFFAOYSA-N 1 2 227.254 2.187 20 0 BEADLO Fc1ccc(C[N@H+]2CCCOCC2)c(F)c1 ZINC000334274649 538063753 /nfs/dbraw/zinc/06/37/53/538063753.db2.gz BFDJGGLPZHFSTR-UHFFFAOYSA-N 1 2 227.254 2.187 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H](C)CCC2CC2)c[nH+]1 ZINC000331413270 180133539 /nfs/dbraw/zinc/13/35/39/180133539.db2.gz BSMFAHNECGNZSZ-MRVPVSSYSA-N 1 2 221.304 2.027 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H](C)C2CCCCC2)c[nH+]1 ZINC000339223552 180133747 /nfs/dbraw/zinc/13/37/47/180133747.db2.gz BSWKCJMNGODQAU-SECBINFHSA-N 1 2 235.331 2.417 20 0 BEADLO CCc1cc(N2CCC23CCC3)nc(C)[nH+]1 ZINC000334284286 538064127 /nfs/dbraw/zinc/06/41/27/538064127.db2.gz BFPZAIYCJFSTAO-UHFFFAOYSA-N 1 2 217.316 2.480 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H](C2CC2)C2CCC2)c[nH+]1 ZINC000333471507 180134169 /nfs/dbraw/zinc/13/41/69/180134169.db2.gz FYLOGLGIIGBORR-GFCCVEGCSA-N 1 2 233.315 2.027 20 0 BEADLO Cc1ncc(C[N@@H+]2CCO[C@@H]3CCC[C@H]32)s1 ZINC000299197904 180143382 /nfs/dbraw/zinc/14/33/82/180143382.db2.gz KQTOZLPYAAZHBZ-VXGBXAGGSA-N 1 2 238.356 2.205 20 0 BEADLO Cc1ncc(C[N@H+]2CCO[C@@H]3CCC[C@H]32)s1 ZINC000299197904 180143384 /nfs/dbraw/zinc/14/33/84/180143384.db2.gz KQTOZLPYAAZHBZ-VXGBXAGGSA-N 1 2 238.356 2.205 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2ccccn2)s1 ZINC000298777419 180140744 /nfs/dbraw/zinc/14/07/44/180140744.db2.gz RQGKBBXAJXLUEB-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2ccccn2)s1 ZINC000298777419 180140747 /nfs/dbraw/zinc/14/07/47/180140747.db2.gz RQGKBBXAJXLUEB-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ncc(C[N@@H+]2CCO[C@@H]3CCC[C@@H]32)s1 ZINC000299197901 180142618 /nfs/dbraw/zinc/14/26/18/180142618.db2.gz KQTOZLPYAAZHBZ-NWDGAFQWSA-N 1 2 238.356 2.205 20 0 BEADLO Cc1ncc(C[N@H+]2CCO[C@@H]3CCC[C@@H]32)s1 ZINC000299197901 180142620 /nfs/dbraw/zinc/14/26/20/180142620.db2.gz KQTOZLPYAAZHBZ-NWDGAFQWSA-N 1 2 238.356 2.205 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NCCCC1CCCC1 ZINC000346146985 180120413 /nfs/dbraw/zinc/12/04/13/180120413.db2.gz JFLMRMZLTRWHQA-UHFFFAOYSA-N 1 2 249.358 2.347 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)NCCCC1CCCC1 ZINC000346146985 180120415 /nfs/dbraw/zinc/12/04/15/180120415.db2.gz JFLMRMZLTRWHQA-UHFFFAOYSA-N 1 2 249.358 2.347 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C(C)(C)C(C)(C)C ZINC000341748557 180120658 /nfs/dbraw/zinc/12/06/58/180120658.db2.gz AQZLWADHOZIBPZ-UHFFFAOYSA-N 1 2 237.347 2.407 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1ccsc1C ZINC000335173447 180122143 /nfs/dbraw/zinc/12/21/43/180122143.db2.gz FIJFHFLKXXERHT-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO Cc1ncc(C[N@H+]2C[C@@H](C)OC[C@H]2C)s1 ZINC000250640441 180145249 /nfs/dbraw/zinc/14/52/49/180145249.db2.gz SVBKLHFXSGFWPN-RKDXNWHRSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ncc(C[N@@H+]2C[C@@H](C)OC[C@H]2C)s1 ZINC000250640441 180145250 /nfs/dbraw/zinc/14/52/50/180145250.db2.gz SVBKLHFXSGFWPN-RKDXNWHRSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1nc(N2C[C@H]3CCCC[C@H]32)cc[nH+]1 ZINC000368184856 180195340 /nfs/dbraw/zinc/19/53/40/180195340.db2.gz OPTXDYBRZQGVNL-GHMZBOCLSA-N 1 2 203.289 2.164 20 0 BEADLO Cc1nc(NC2Cc3ccccc3C2)cc[nH+]1 ZINC000184150154 180198608 /nfs/dbraw/zinc/19/86/08/180198608.db2.gz PIXFYOWLHYIIRS-UHFFFAOYSA-N 1 2 225.295 2.364 20 0 BEADLO Cc1nc(NCc2ccc([C@H](C)O)cc2)cc[nH+]1 ZINC000266457499 180200081 /nfs/dbraw/zinc/20/00/81/180200081.db2.gz YDELBEWNTBAMHC-JTQLQIEISA-N 1 2 243.310 2.450 20 0 BEADLO Cc1nc(CCNc2cc[nH+]c(C)n2)cs1 ZINC000230894825 180200730 /nfs/dbraw/zinc/20/07/30/180200730.db2.gz RHESUODDWXMXGL-UHFFFAOYSA-N 1 2 234.328 2.205 20 0 BEADLO Cc1nc(N[C@@H]2CCC[C@@H]3OCC[C@@H]32)cc[nH+]1 ZINC000153261608 180202886 /nfs/dbraw/zinc/20/28/86/180202886.db2.gz NSSODHIHQWXLHR-UTUOFQBUSA-N 1 2 233.315 2.155 20 0 BEADLO Cc1nn(C)cc1[C@H](C)Nc1cc[nH+]c(C)n1 ZINC000266416986 180202951 /nfs/dbraw/zinc/20/29/51/180202951.db2.gz RJBJNSNQCSPLJQ-QMMMGPOBSA-N 1 2 231.303 2.000 20 0 BEADLO Cc1nc(N[C@@H]2CCCc3c2cnn3C)cc[nH+]1 ZINC000266106602 180204066 /nfs/dbraw/zinc/20/40/66/180204066.db2.gz IZKVONWKPIQDJH-LLVKDONJSA-N 1 2 243.314 2.008 20 0 BEADLO Cc1nc(N[C@H](c2ncc[nH]2)C(C)C)cc[nH+]1 ZINC000285786422 180205116 /nfs/dbraw/zinc/20/51/16/180205116.db2.gz XEMIUNKIBPVPQA-NSHDSACASA-N 1 2 231.303 2.317 20 0 BEADLO Cc1nc(N[C@H]2CCC[C@H]2OC(F)F)cc[nH+]1 ZINC000336919285 180206128 /nfs/dbraw/zinc/20/61/28/180206128.db2.gz PXCLJMGNZHPWTK-DTWKUNHWSA-N 1 2 243.257 2.357 20 0 BEADLO Cc1nc(NC[C@H]2CCCC2(C)C)cc[nH+]1 ZINC000338812327 180181687 /nfs/dbraw/zinc/18/16/87/180181687.db2.gz QDFILUAIANNLCO-LLVKDONJSA-N 1 2 219.332 2.445 20 0 BEADLO Cc1nc(NCCCc2ccccc2F)cc[nH+]1 ZINC000360062199 180181822 /nfs/dbraw/zinc/18/18/22/180181822.db2.gz FEPXSKXUWIGARY-UHFFFAOYSA-N 1 2 245.301 2.391 20 0 BEADLO Cc1nc(NC[C@@H]2CCc3ccccc32)cc[nH+]1 ZINC000361022680 180182153 /nfs/dbraw/zinc/18/21/53/180182153.db2.gz OTTBEVJZXHMOOW-ZDUSSCGKSA-N 1 2 239.322 2.349 20 0 BEADLO Cc1[nH+]cccc1NCc1ccc(CO)o1 ZINC000085726812 180225890 /nfs/dbraw/zinc/22/58/90/180225890.db2.gz KUAOVLSLNKUDKP-UHFFFAOYSA-N 1 2 218.256 2.087 20 0 BEADLO Cc1[nH+]cccc1N[C@H](C)[C@@H]1CCOC1 ZINC000162942832 180228695 /nfs/dbraw/zinc/22/86/95/180228695.db2.gz ZELGWWHZOVPTLK-MWLCHTKSSA-N 1 2 206.289 2.227 20 0 BEADLO Cc1nc(N[C@@H](C)Cn2cc[nH+]c2)sc1C ZINC000083532818 350240142 /nfs/dbraw/zinc/24/01/42/350240142.db2.gz RLLGMCUIQNXSHY-QMMMGPOBSA-N 1 2 236.344 2.457 20 0 BEADLO CCCCCOC1CN(Cc2[nH]cc(C)[nH+]2)C1 ZINC000628306731 350253025 /nfs/dbraw/zinc/25/30/25/350253025.db2.gz SCEJQAPBBPDNEE-UHFFFAOYSA-N 1 2 237.347 2.109 20 0 BEADLO Cc1ncsc1C[N@@H+](C)Cc1cccnc1N ZINC000111674144 180312395 /nfs/dbraw/zinc/31/23/95/180312395.db2.gz JIEHUJYYBBBEJU-UHFFFAOYSA-N 1 2 248.355 2.061 20 0 BEADLO Cc1ncsc1C[N@H+](C)Cc1cccnc1N ZINC000111674144 180312397 /nfs/dbraw/zinc/31/23/97/180312397.db2.gz JIEHUJYYBBBEJU-UHFFFAOYSA-N 1 2 248.355 2.061 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2ccon2)cn1 ZINC000427857133 191095884 /nfs/dbraw/zinc/09/58/84/191095884.db2.gz PQLRGAVDYATPDM-NXEZZACHSA-N 1 2 232.287 2.185 20 0 BEADLO CC[C@@H](C)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000027987496 350332436 /nfs/dbraw/zinc/33/24/36/350332436.db2.gz FOGJYZUJUZRZHI-SSDOTTSWSA-N 1 2 204.277 2.477 20 0 BEADLO C[C@@H]1CCN(C(=O)Nc2ccc3[nH+]ccn3c2)C1 ZINC000606580173 350370879 /nfs/dbraw/zinc/37/08/79/350370879.db2.gz CJQDRCVNGWKTQV-SNVBAGLBSA-N 1 2 244.298 2.208 20 0 BEADLO C[C@H]1CCN(C(=O)Nc2ccc3[nH+]ccn3c2)C1 ZINC000606580172 350371051 /nfs/dbraw/zinc/37/10/51/350371051.db2.gz CJQDRCVNGWKTQV-JTQLQIEISA-N 1 2 244.298 2.208 20 0 BEADLO CC1(C)C[C@@H]1NC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606581982 350373162 /nfs/dbraw/zinc/37/31/62/350373162.db2.gz YXZSLARBMABMSH-JTQLQIEISA-N 1 2 244.298 2.254 20 0 BEADLO Cc1nn(C)c(C)c1N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000293898258 180345008 /nfs/dbraw/zinc/34/50/08/180345008.db2.gz GYXNDEDIXIACTH-KCJUWKMLSA-N 1 2 245.330 2.351 20 0 BEADLO CO[C@@H](C)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000162713252 350419233 /nfs/dbraw/zinc/41/92/33/350419233.db2.gz MYAZJLQVFLJFLF-VIFPVBQESA-N 1 2 245.282 2.050 20 0 BEADLO CCC[C@@H]([NH2+]C[C@H]1CCCS1)C(=O)OCC ZINC000148047254 191103243 /nfs/dbraw/zinc/10/32/43/191103243.db2.gz BNLAOXWEQXQGMU-GHMZBOCLSA-N 1 2 245.388 2.203 20 0 BEADLO CCc1nc(C[N@H+](CC)CC2CCC2)no1 ZINC000336663450 350424575 /nfs/dbraw/zinc/42/45/75/350424575.db2.gz RDEDLQHCBJHLTR-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO CCc1nc(C[N@@H+](CC)CC2CCC2)no1 ZINC000336663450 350424580 /nfs/dbraw/zinc/42/45/80/350424580.db2.gz RDEDLQHCBJHLTR-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO CC(C)(C)CCC(=O)N[C@@H]1CCn2cc[nH+]c2C1 ZINC000427995995 191104887 /nfs/dbraw/zinc/10/48/87/191104887.db2.gz MPRUMTCLYCJPCV-LLVKDONJSA-N 1 2 249.358 2.140 20 0 BEADLO FC(F)C1C[NH+](Cc2cnc3ccccc3n2)C1 ZINC000628307179 350455784 /nfs/dbraw/zinc/45/57/84/350455784.db2.gz SZYFFOJAHAYFTC-UHFFFAOYSA-N 1 2 249.264 2.327 20 0 BEADLO CCC[C@@H](C)CC(=O)N[C@@H]1CCn2cc[nH+]c2C1 ZINC000427989994 191104537 /nfs/dbraw/zinc/10/45/37/191104537.db2.gz CBESJTIGBAXDAJ-VXGBXAGGSA-N 1 2 249.358 2.140 20 0 BEADLO O=C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccco1 ZINC000054600793 1172128483 /nfs/dbraw/zinc/12/84/83/1172128483.db2.gz QQZWYWNGFUUZCS-PHIMTYICSA-N 1 2 219.284 2.366 20 0 BEADLO O=C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccco1 ZINC000054600793 1172128486 /nfs/dbraw/zinc/12/84/86/1172128486.db2.gz QQZWYWNGFUUZCS-PHIMTYICSA-N 1 2 219.284 2.366 20 0 BEADLO Cc1csc(C[NH2+][C@@H](C)c2nccn2C)n1 ZINC000070007908 350490518 /nfs/dbraw/zinc/49/05/18/350490518.db2.gz QTCPNHJTDYAATN-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO Cc1csc(CN[C@@H](C)c2[nH+]ccn2C)n1 ZINC000070007908 350490522 /nfs/dbraw/zinc/49/05/22/350490522.db2.gz QTCPNHJTDYAATN-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO CC[C@@H]([NH2+][C@@H]1CCCOCC1)C(F)(F)F ZINC000336747617 350497231 /nfs/dbraw/zinc/49/72/31/350497231.db2.gz CANWGKVINIOIRK-RKDXNWHRSA-N 1 2 225.254 2.486 20 0 BEADLO CC[C@](C)(NCc1c[nH+]c[nH]1)C(F)(F)F ZINC000380178976 350501668 /nfs/dbraw/zinc/50/16/68/350501668.db2.gz KWNLHXVZFHTTPS-QMMMGPOBSA-N 1 2 221.226 2.230 20 0 BEADLO CC[C@](C)(NCc1c[nH]c[nH+]1)C(F)(F)F ZINC000380178976 350501672 /nfs/dbraw/zinc/50/16/72/350501672.db2.gz KWNLHXVZFHTTPS-QMMMGPOBSA-N 1 2 221.226 2.230 20 0 BEADLO COC(=O)[C@@H]([NH2+][C@@H]1C=CCCC1)C(C)(C)C ZINC000309464446 350538768 /nfs/dbraw/zinc/53/87/68/350538768.db2.gz OWZSPBKQXDFOSN-GHMZBOCLSA-N 1 2 225.332 2.272 20 0 BEADLO CCCCCOC1CN(c2cccc[nH+]2)C1 ZINC000428151953 191106979 /nfs/dbraw/zinc/10/69/79/191106979.db2.gz CNDZROSBEOLMGA-UHFFFAOYSA-N 1 2 220.316 2.477 20 0 BEADLO c1cc(CNc2cc[nH+]c3ccncc23)co1 ZINC000444109639 191110872 /nfs/dbraw/zinc/11/08/72/191110872.db2.gz DHQRBYFHYFZYEC-UHFFFAOYSA-N 1 2 225.251 2.257 20 0 BEADLO COC[C@H](C)Nc1[nH+]c2ccccc2n1C ZINC000070609096 350547876 /nfs/dbraw/zinc/54/78/76/350547876.db2.gz MXUITHRAIXXGGW-VIFPVBQESA-N 1 2 219.288 2.020 20 0 BEADLO CCc1cnc(C[NH2+]Cc2c[nH]nc2C)s1 ZINC000230707016 350606854 /nfs/dbraw/zinc/60/68/54/350606854.db2.gz MRXXSEGLJPPOGW-UHFFFAOYSA-N 1 2 236.344 2.027 20 0 BEADLO Cc1nocc1C[NH+]1CC2(CCC2(F)F)C1 ZINC000334460373 180503626 /nfs/dbraw/zinc/50/36/26/180503626.db2.gz NARGLDMWSMYELR-UHFFFAOYSA-N 1 2 228.242 2.214 20 0 BEADLO CC[C@@H]([NH2+]Cc1nccn1C)c1c(C)noc1C ZINC000339788608 350832792 /nfs/dbraw/zinc/83/27/92/350832792.db2.gz SLTKBBYBLABMAY-LLVKDONJSA-N 1 2 248.330 2.266 20 0 BEADLO COC(=O)c1sccc1C[N@H+]1CC=CCC1 ZINC000382531884 350854679 /nfs/dbraw/zinc/85/46/79/350854679.db2.gz LNGIFNNSZPXSCK-UHFFFAOYSA-N 1 2 237.324 2.297 20 0 BEADLO COC(=O)c1sccc1C[N@@H+]1CC=CCC1 ZINC000382531884 350854681 /nfs/dbraw/zinc/85/46/81/350854681.db2.gz LNGIFNNSZPXSCK-UHFFFAOYSA-N 1 2 237.324 2.297 20 0 BEADLO Cc1cccc2[nH+]c(CNC(=O)C3(C)CC3)cn21 ZINC000177595684 366011097 /nfs/dbraw/zinc/01/10/97/366011097.db2.gz AUCRKPBLTUBVSZ-UHFFFAOYSA-N 1 2 243.310 2.059 20 0 BEADLO CC[C@@H]1CN(Cc2[nH]cc(C)[nH+]2)C[C@H](CC)O1 ZINC000628315656 350897330 /nfs/dbraw/zinc/89/73/30/350897330.db2.gz RKBAJSIIYNJNSG-TXEJJXNPSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@H]1CCCN1c1cc(-n2cc[nH+]c2)ncn1 ZINC000607144839 350945885 /nfs/dbraw/zinc/94/58/85/350945885.db2.gz VBLNMVWFRANSNI-NSHDSACASA-N 1 2 243.314 2.041 20 0 BEADLO CC[N@H+](Cc1ccccc1)Cc1nccc(N)n1 ZINC000258981184 351068103 /nfs/dbraw/zinc/06/81/03/351068103.db2.gz OOXVTFSRGUDDEI-UHFFFAOYSA-N 1 2 242.326 2.081 20 0 BEADLO CC[N@@H+](Cc1ccccc1)Cc1nccc(N)n1 ZINC000258981184 351068105 /nfs/dbraw/zinc/06/81/05/351068105.db2.gz OOXVTFSRGUDDEI-UHFFFAOYSA-N 1 2 242.326 2.081 20 0 BEADLO FC(F)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000616642663 351154434 /nfs/dbraw/zinc/15/44/34/351154434.db2.gz FGZIEFCCNZBPIB-NSHDSACASA-N 1 2 227.254 2.153 20 0 BEADLO FC(F)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000616642663 351154436 /nfs/dbraw/zinc/15/44/36/351154436.db2.gz FGZIEFCCNZBPIB-NSHDSACASA-N 1 2 227.254 2.153 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)Cc1cccnc1 ZINC000071007123 351138876 /nfs/dbraw/zinc/13/88/76/351138876.db2.gz RRUOBPLTVXCPBA-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)Cc1cccnc1 ZINC000071007123 351138877 /nfs/dbraw/zinc/13/88/77/351138877.db2.gz RRUOBPLTVXCPBA-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CC(C)[C@H]1CCC[C@@H]([NH2+]Cc2c[nH]nn2)C1 ZINC000398413607 351141675 /nfs/dbraw/zinc/14/16/75/351141675.db2.gz ROALTWSCYWFCSV-WDEREUQCSA-N 1 2 222.336 2.109 20 0 BEADLO CC(C)[C@H]1CCC[C@@H]([NH2+]Cc2cn[nH]n2)C1 ZINC000398413607 351141679 /nfs/dbraw/zinc/14/16/79/351141679.db2.gz ROALTWSCYWFCSV-WDEREUQCSA-N 1 2 222.336 2.109 20 0 BEADLO FC(F)c1ccc(C[NH2+]Cc2cnn[nH]2)cc1 ZINC000398416372 351142121 /nfs/dbraw/zinc/14/21/21/351142121.db2.gz WDWWYOYIDJNNPZ-UHFFFAOYSA-N 1 2 238.241 2.032 20 0 BEADLO FC(F)c1ccc(C[NH2+]Cc2c[nH]nn2)cc1 ZINC000398416372 351142124 /nfs/dbraw/zinc/14/21/24/351142124.db2.gz WDWWYOYIDJNNPZ-UHFFFAOYSA-N 1 2 238.241 2.032 20 0 BEADLO Cc1nc(NCc2ccsc2)cc[nH+]1 ZINC000063153140 351263351 /nfs/dbraw/zinc/26/33/51/351263351.db2.gz HOKJPGVTWOQJGZ-UHFFFAOYSA-N 1 2 205.286 2.459 20 0 BEADLO CC(C)CN(C)c1cc[nH+]c(C2CC2)n1 ZINC000264644022 351250285 /nfs/dbraw/zinc/25/02/85/351250285.db2.gz GWNMHTWDTRXZIK-UHFFFAOYSA-N 1 2 205.305 2.446 20 0 BEADLO Cc1[nH]c(CN2C[C@@H](C)OCC23CCC3)[nH+]c1C ZINC000628325258 351251056 /nfs/dbraw/zinc/25/10/56/351251056.db2.gz FAWNOWODUBKHPE-SNVBAGLBSA-N 1 2 249.358 2.170 20 0 BEADLO O=C1CCCCCN1CCCNc1cccc[nH+]1 ZINC000072521849 351251774 /nfs/dbraw/zinc/25/17/74/351251774.db2.gz AETILPYXIFQAML-UHFFFAOYSA-N 1 2 247.342 2.286 20 0 BEADLO FC1(F)CC12C[NH+](Cc1cnc(C3CC3)o1)C2 ZINC000628326564 351260360 /nfs/dbraw/zinc/26/03/60/351260360.db2.gz MOFRTOLFZVQQIR-UHFFFAOYSA-N 1 2 240.253 2.393 20 0 BEADLO COCc1cc[nH+]c(NCc2oc(C)nc2C)c1 ZINC000628326561 351260546 /nfs/dbraw/zinc/26/05/46/351260546.db2.gz MLTCKNRDNMJJHK-UHFFFAOYSA-N 1 2 247.298 2.445 20 0 BEADLO Cc1noc([C@H](C)SCCn2cc[nH+]c2)n1 ZINC000090200387 363022973 /nfs/dbraw/zinc/02/29/73/363022973.db2.gz CUHQQCONTOAOOQ-QMMMGPOBSA-N 1 2 238.316 2.069 20 0 BEADLO CCN(Cc1[nH]cc(C)[nH+]1)c1cccc(O)c1 ZINC000628353301 351318951 /nfs/dbraw/zinc/31/89/51/351318951.db2.gz QFCQIVJFXLEKLV-UHFFFAOYSA-N 1 2 231.299 2.450 20 0 BEADLO CCCCc1cc(N[C@H](C)[C@@H](C)CO)nc[nH+]1 ZINC000631126373 351336515 /nfs/dbraw/zinc/33/65/15/351336515.db2.gz MGHXWXBGGCOHMU-WDEREUQCSA-N 1 2 237.347 2.248 20 0 BEADLO CCCCc1cc(N[C@H](C)[C@H](C)CO)nc[nH+]1 ZINC000631126370 351336676 /nfs/dbraw/zinc/33/66/76/351336676.db2.gz MGHXWXBGGCOHMU-GHMZBOCLSA-N 1 2 237.347 2.248 20 0 BEADLO CC1(C)C[C@@H]1C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000269757815 351366602 /nfs/dbraw/zinc/36/66/02/351366602.db2.gz VRVGPDAUKLFUBG-LLVKDONJSA-N 1 2 247.342 2.162 20 0 BEADLO Nc1ccc[nH+]c1Nc1ccc2c(c1)OCCO2 ZINC000034964568 351366834 /nfs/dbraw/zinc/36/68/34/351366834.db2.gz NGEIYSAUCZAGHA-UHFFFAOYSA-N 1 2 243.266 2.179 20 0 BEADLO CC1(C)C[N@@H+]([C@@H]2CCOC2=O)Cc2ccccc21 ZINC000270364982 351378848 /nfs/dbraw/zinc/37/88/48/351378848.db2.gz LJCNLSNSVFKJLC-CYBMUJFWSA-N 1 2 245.322 2.095 20 0 BEADLO CC1(C)C[N@H+]([C@@H]2CCOC2=O)Cc2ccccc21 ZINC000270364982 351378851 /nfs/dbraw/zinc/37/88/51/351378851.db2.gz LJCNLSNSVFKJLC-CYBMUJFWSA-N 1 2 245.322 2.095 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@]1(C)CCCOC1 ZINC000272993703 351505871 /nfs/dbraw/zinc/50/58/71/351505871.db2.gz QQNCKTPDJUNVRF-CQSZACIVSA-N 1 2 248.326 2.399 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C1(OC)CCC1 ZINC000273052080 351508271 /nfs/dbraw/zinc/50/82/71/351508271.db2.gz BSJHMDDPDQNBPO-UHFFFAOYSA-N 1 2 234.299 2.152 20 0 BEADLO CC1(C)CCC[C@H]1C(=O)NCCCn1cc[nH+]c1 ZINC000274564851 351572872 /nfs/dbraw/zinc/57/28/72/351572872.db2.gz ARWVQYRCGVDMLT-LBPRGKRZSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N(C)[C@@H]1CC[C@@H](C)C1 ZINC000577744111 366050672 /nfs/dbraw/zinc/05/06/72/366050672.db2.gz DRPRIJRSDJOZCV-NQBHXWOUSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N(C)[C@@H]1CC[C@@H](C)C1 ZINC000577744111 366050675 /nfs/dbraw/zinc/05/06/75/366050675.db2.gz DRPRIJRSDJOZCV-NQBHXWOUSA-N 1 2 249.358 2.235 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1ccns1 ZINC000637851611 351710458 /nfs/dbraw/zinc/71/04/58/351710458.db2.gz JHYTUQUFSMJJSZ-VHSXEESVSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccns1 ZINC000637851611 351710459 /nfs/dbraw/zinc/71/04/59/351710459.db2.gz JHYTUQUFSMJJSZ-VHSXEESVSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@H]1CCC[C@H]1NC(=O)CCc1c[nH+]cn1C ZINC000279819849 351825050 /nfs/dbraw/zinc/82/50/50/351825050.db2.gz IFFBFQFFOHDDBT-DGCLKSJQSA-N 1 2 249.358 2.048 20 0 BEADLO CC[C@@H]1CCC[C@@H]1NC(=O)CCc1c[nH+]c[nH]1 ZINC000279903294 351828056 /nfs/dbraw/zinc/82/80/56/351828056.db2.gz MTHDCBIQMLRDBI-PWSUYJOCSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@@H]1CCC[C@@H]1NC(=O)CCc1c[nH]c[nH+]1 ZINC000279903294 351828059 /nfs/dbraw/zinc/82/80/59/351828059.db2.gz MTHDCBIQMLRDBI-PWSUYJOCSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1C(=O)NCc1[nH+]ccn1C ZINC000280584470 351851504 /nfs/dbraw/zinc/85/15/04/351851504.db2.gz SIKDTASIXGDUQO-NEPJUHHUSA-N 1 2 249.358 2.253 20 0 BEADLO CC[C@@H]([NH2+][C@H]1C[C@H](c2ccccc2)C1)C(=O)OC ZINC000280592298 351851615 /nfs/dbraw/zinc/85/16/15/351851615.db2.gz INUQBADNRDJUJN-MGPQQGTHSA-N 1 2 247.338 2.474 20 0 BEADLO C[N@@H+](Cc1ccoc1)Cc1ccns1 ZINC000637966602 351839490 /nfs/dbraw/zinc/83/94/90/351839490.db2.gz UIMUUBCJAGIAIJ-UHFFFAOYSA-N 1 2 208.286 2.368 20 0 BEADLO C[N@H+](Cc1ccoc1)Cc1ccns1 ZINC000637966602 351839494 /nfs/dbraw/zinc/83/94/94/351839494.db2.gz UIMUUBCJAGIAIJ-UHFFFAOYSA-N 1 2 208.286 2.368 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1C(=O)NCCn1cc[nH+]c1 ZINC000280446241 351844059 /nfs/dbraw/zinc/84/40/59/351844059.db2.gz YLIVYWTXGQQHTQ-OLZOCXBDSA-N 1 2 249.358 2.216 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1NC(=O)CCc1c[nH+]c[nH]1 ZINC000280461368 351844879 /nfs/dbraw/zinc/84/48/79/351844879.db2.gz ZUSVYDWXUJWGJT-YPMHNXCESA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1NC(=O)CCc1c[nH]c[nH+]1 ZINC000280461368 351844884 /nfs/dbraw/zinc/84/48/84/351844884.db2.gz ZUSVYDWXUJWGJT-YPMHNXCESA-N 1 2 249.358 2.427 20 0 BEADLO CCC[C@H](C[N@@H+]1CCC[C@H]1c1ncon1)OC ZINC000637997322 351874427 /nfs/dbraw/zinc/87/44/27/351874427.db2.gz ATGRFLFJIYLSNY-MNOVXSKESA-N 1 2 239.319 2.022 20 0 BEADLO CCC[C@H](C[N@H+]1CCC[C@H]1c1ncon1)OC ZINC000637997322 351874428 /nfs/dbraw/zinc/87/44/28/351874428.db2.gz ATGRFLFJIYLSNY-MNOVXSKESA-N 1 2 239.319 2.022 20 0 BEADLO Cc1cc(N(C)C[C@H]2CCCO2)nc(C2CC2)[nH+]1 ZINC000265337057 187506470 /nfs/dbraw/zinc/50/64/70/187506470.db2.gz HWLXFPACVWSHJF-GFCCVEGCSA-N 1 2 247.342 2.278 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@H](C)[C@@H]2C)sn1 ZINC000638085603 351961802 /nfs/dbraw/zinc/96/18/02/351961802.db2.gz SAQAJRDAIWQAML-VHSXEESVSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@H](C)[C@@H]2C)sn1 ZINC000638085603 351961804 /nfs/dbraw/zinc/96/18/04/351961804.db2.gz SAQAJRDAIWQAML-VHSXEESVSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ncc([C@H](C)[N@@H+]2CCO[C@H](C)[C@@H]2C)c(C)n1 ZINC000638085877 351962852 /nfs/dbraw/zinc/96/28/52/351962852.db2.gz UROIPPRTYMEZJL-SDDRHHMPSA-N 1 2 249.358 2.264 20 0 BEADLO Cc1ncc([C@H](C)[N@H+]2CCO[C@H](C)[C@@H]2C)c(C)n1 ZINC000638085877 351962853 /nfs/dbraw/zinc/96/28/53/351962853.db2.gz UROIPPRTYMEZJL-SDDRHHMPSA-N 1 2 249.358 2.264 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC(C)(C)[C@H]2C)sn1 ZINC000638096719 351976614 /nfs/dbraw/zinc/97/66/14/351976614.db2.gz RCJLBVCEZLXRTC-SNVBAGLBSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1cc(C[N@H+]2CCOC(C)(C)[C@H]2C)sn1 ZINC000638096719 351976616 /nfs/dbraw/zinc/97/66/16/351976616.db2.gz RCJLBVCEZLXRTC-SNVBAGLBSA-N 1 2 240.372 2.451 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2cc(C)ns2)CCO1 ZINC000638096951 351976980 /nfs/dbraw/zinc/97/69/80/351976980.db2.gz UOMCMFWALPMWRJ-NSHDSACASA-N 1 2 240.372 2.452 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2cc(C)ns2)CCO1 ZINC000638096951 351976983 /nfs/dbraw/zinc/97/69/83/351976983.db2.gz UOMCMFWALPMWRJ-NSHDSACASA-N 1 2 240.372 2.452 20 0 BEADLO CC[C@@H]1CCC[C@@H]1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000284335081 351995477 /nfs/dbraw/zinc/99/54/77/351995477.db2.gz IYNDCNVKCCJPRC-ZUOHBJSBSA-N 1 2 233.315 2.118 20 0 BEADLO CC1(CC(=O)NCCc2[nH]cc[nH+]2)CCCC1 ZINC000348533421 133887295 /nfs/dbraw/zinc/88/72/95/133887295.db2.gz KCHIXYHYJBJUHY-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO CC[C@@H]1CCCN(C(=O)CCc2[nH]cc[nH+]2)CC1 ZINC000287838843 352135815 /nfs/dbraw/zinc/13/58/15/352135815.db2.gz DHBUZQSXOMUXFU-GFCCVEGCSA-N 1 2 249.358 2.381 20 0 BEADLO Cc1nc(N[C@H]2[C@@H](C)[C@H](C)O[C@H]2C)cc[nH+]1 ZINC000528207200 323781018 /nfs/dbraw/zinc/78/10/18/323781018.db2.gz OZPWAMKHBGNINW-PEFMBERDSA-N 1 2 221.304 2.009 20 0 BEADLO CCCC[C@@H](C)N(C)c1[nH+]cnc2c1cnn2C ZINC000290927612 352249603 /nfs/dbraw/zinc/24/96/03/352249603.db2.gz YJTVKTNPEUMGMQ-SNVBAGLBSA-N 1 2 247.346 2.378 20 0 BEADLO CCCC[C@@H](CC)C(=O)N1CCn2c[nH+]cc2C1 ZINC000290972819 352252893 /nfs/dbraw/zinc/25/28/93/352252893.db2.gz UDZZYDPJTDZFTH-GFCCVEGCSA-N 1 2 249.358 2.442 20 0 BEADLO CC(C)CN(C(=O)COc1cc[nH+]cc1)C1CC1 ZINC000292520987 352323095 /nfs/dbraw/zinc/32/30/95/352323095.db2.gz UZGOLKAWVZBYMB-UHFFFAOYSA-N 1 2 248.326 2.107 20 0 BEADLO C[C@@H](C(=O)NCCNc1cccc[nH+]1)C1CCC1 ZINC000411298490 191175208 /nfs/dbraw/zinc/17/52/08/191175208.db2.gz VIRBLJPYHUZLHW-LLVKDONJSA-N 1 2 247.342 2.046 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2nccs2)n(C)n1 ZINC000084244688 352467141 /nfs/dbraw/zinc/46/71/41/352467141.db2.gz FKJMTFLEJWXUPP-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO CCc1ccc(C[NH2+][C@H](C)c2ccn(C)n2)nc1 ZINC000411822620 191213467 /nfs/dbraw/zinc/21/34/67/191213467.db2.gz OXAYXPPEXBHUSG-LLVKDONJSA-N 1 2 244.342 2.228 20 0 BEADLO Cn1cc[nH+]c1CNc1cc(F)c(F)cc1F ZINC000061093611 180748529 /nfs/dbraw/zinc/74/85/29/180748529.db2.gz PHZRHDNAINPPHS-UHFFFAOYSA-N 1 2 241.216 2.450 20 0 BEADLO Cc1[nH]c(CNCc2cccc(F)c2)[nH+]c1C ZINC000045205756 352587909 /nfs/dbraw/zinc/58/79/09/352587909.db2.gz JMCJVYKPXMAFOW-UHFFFAOYSA-N 1 2 233.290 2.455 20 0 BEADLO COc1ccc(CNc2cc(C)[nH+]cn2)cc1 ZINC000040727032 352603677 /nfs/dbraw/zinc/60/36/77/352603677.db2.gz IHRZTUDVYFWMJX-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO C[C@H](c1cnccn1)[N@@H+]1CCO[C@@H](C2CCC2)C1 ZINC000411855371 191219682 /nfs/dbraw/zinc/21/96/82/191219682.db2.gz URGNADVTIMHHAH-BXUZGUMPSA-N 1 2 247.342 2.039 20 0 BEADLO C[C@H](c1cnccn1)[N@H+]1CCO[C@@H](C2CCC2)C1 ZINC000411855371 191219684 /nfs/dbraw/zinc/21/96/84/191219684.db2.gz URGNADVTIMHHAH-BXUZGUMPSA-N 1 2 247.342 2.039 20 0 BEADLO C[C@@H]1CCC[C@H](CCNC(=O)Cn2cc[nH+]c2)C1 ZINC000073732223 352672539 /nfs/dbraw/zinc/67/25/39/352672539.db2.gz GWGASHRHXMIQBK-CHWSQXEVSA-N 1 2 249.358 2.216 20 0 BEADLO CCC[C@@H](CNc1ccc(SC)c[nH+]1)OC ZINC000638760779 352695970 /nfs/dbraw/zinc/69/59/70/352695970.db2.gz VNJVTZVZZMVVLE-JTQLQIEISA-N 1 2 240.372 2.452 20 0 BEADLO CC[N@H+](Cc1occc1C)[C@@H](C)c1nncn1C ZINC000412023617 191237949 /nfs/dbraw/zinc/23/79/49/191237949.db2.gz CVFSNJFSDCMFNP-NSHDSACASA-N 1 2 248.330 2.300 20 0 BEADLO CC[N@@H+](Cc1occc1C)[C@@H](C)c1nncn1C ZINC000412023617 191237951 /nfs/dbraw/zinc/23/79/51/191237951.db2.gz CVFSNJFSDCMFNP-NSHDSACASA-N 1 2 248.330 2.300 20 0 BEADLO Fc1ccccc1C[N@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC000334187559 352777503 /nfs/dbraw/zinc/77/75/03/352777503.db2.gz IGMXGVGHRKQYDJ-TXEJJXNPSA-N 1 2 221.275 2.189 20 0 BEADLO Fc1ccccc1C[N@@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC000334187559 352777504 /nfs/dbraw/zinc/77/75/04/352777504.db2.gz IGMXGVGHRKQYDJ-TXEJJXNPSA-N 1 2 221.275 2.189 20 0 BEADLO C/C=C(\CC)C(=O)N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000365094432 187830154 /nfs/dbraw/zinc/83/01/54/187830154.db2.gz SSJSGIKIRHSMOZ-QNCMIEPLSA-N 1 2 247.342 2.092 20 0 BEADLO CO[C@H](CNc1ccc[nH+]c1C)C1CC1 ZINC000638786782 352742702 /nfs/dbraw/zinc/74/27/02/352742702.db2.gz QVFRYWMYCCGCPD-GFCCVEGCSA-N 1 2 206.289 2.227 20 0 BEADLO Cc1c[nH+]cc(N[C@@H](C)C[C@@H]2CCCC(=O)N2)c1 ZINC000638787528 352743383 /nfs/dbraw/zinc/74/33/83/352743383.db2.gz KIOAQOJAUKQZPL-RYUDHWBXSA-N 1 2 247.342 2.249 20 0 BEADLO Cc1nc(C[N@H+]2CCO[C@@H](C)[C@H]2C)c(C)s1 ZINC000334184915 352772911 /nfs/dbraw/zinc/77/29/11/352772911.db2.gz DIJXEAXRFOYOMF-BDAKNGLRSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nc(C[N@@H+]2CCO[C@@H](C)[C@H]2C)c(C)s1 ZINC000334184915 352772914 /nfs/dbraw/zinc/77/29/14/352772914.db2.gz DIJXEAXRFOYOMF-BDAKNGLRSA-N 1 2 240.372 2.369 20 0 BEADLO CCC(C)(C)N(C)C(=O)[C@@H]1CCn2c[nH+]cc2C1 ZINC000334195300 352787904 /nfs/dbraw/zinc/78/79/04/352787904.db2.gz LTVQLXUDEVHODA-LLVKDONJSA-N 1 2 249.358 2.093 20 0 BEADLO C[C@H]1COCCN(c2[nH+]c3ccccc3n2C)C1 ZINC000334207363 352803601 /nfs/dbraw/zinc/80/36/01/352803601.db2.gz WXUIGELDQUNLOT-LLVKDONJSA-N 1 2 245.326 2.046 20 0 BEADLO Cc1c[nH+]c(CN2CCS[C@H](C)[C@H]2C)n1C ZINC000342804184 352859707 /nfs/dbraw/zinc/85/97/07/352859707.db2.gz AUAVXKBSLQDUGC-GHMZBOCLSA-N 1 2 239.388 2.054 20 0 BEADLO c1c[nH]c([C@H]2CCC[N@H+]2Cc2ccccn2)n1 ZINC000334243995 352833088 /nfs/dbraw/zinc/83/30/88/352833088.db2.gz ZATHNJDJFKFXDK-GFCCVEGCSA-N 1 2 228.299 2.142 20 0 BEADLO c1c[nH]c([C@H]2CCC[N@@H+]2Cc2ccccn2)n1 ZINC000334243995 352833090 /nfs/dbraw/zinc/83/30/90/352833090.db2.gz ZATHNJDJFKFXDK-GFCCVEGCSA-N 1 2 228.299 2.142 20 0 BEADLO CC1=C[C@H](C)C[N@H+](Cc2nnc(C3CC3)[nH]2)C1 ZINC000334246751 352837899 /nfs/dbraw/zinc/83/78/99/352837899.db2.gz ITSONMWLBRJYHE-VIFPVBQESA-N 1 2 232.331 2.080 20 0 BEADLO CC1=C[C@H](C)C[N@@H+](Cc2nnc(C3CC3)[nH]2)C1 ZINC000334246751 352837901 /nfs/dbraw/zinc/83/79/01/352837901.db2.gz ITSONMWLBRJYHE-VIFPVBQESA-N 1 2 232.331 2.080 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cn(C)nn2)[C@@H]1c1ccccc1 ZINC000334249329 352842792 /nfs/dbraw/zinc/84/27/92/352842792.db2.gz VDNBWZRMFXPFRB-RISCZKNCSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cn(C)nn2)[C@@H]1c1ccccc1 ZINC000334249329 352842794 /nfs/dbraw/zinc/84/27/94/352842794.db2.gz VDNBWZRMFXPFRB-RISCZKNCSA-N 1 2 242.326 2.008 20 0 BEADLO Cn1cc[nH+]c1CN[C@@H]1CCCc2scnc21 ZINC000623885840 352926457 /nfs/dbraw/zinc/92/64/57/352926457.db2.gz KENCICSZVBTCMB-SECBINFHSA-N 1 2 248.355 2.044 20 0 BEADLO Cn1ccnc1C[NH2+][C@@H]1CCCc2scnc21 ZINC000623885840 352926462 /nfs/dbraw/zinc/92/64/62/352926462.db2.gz KENCICSZVBTCMB-SECBINFHSA-N 1 2 248.355 2.044 20 0 BEADLO Cc1ccccc1NC(=O)NCc1[nH]cc[nH+]1 ZINC000334262044 352894847 /nfs/dbraw/zinc/89/48/47/352894847.db2.gz USGZHRRQTQBDII-UHFFFAOYSA-N 1 2 230.271 2.040 20 0 BEADLO Cc1cccc(CN2CCn3cc[nH+]c3C2)c1 ZINC000334266104 352901461 /nfs/dbraw/zinc/90/14/61/352901461.db2.gz MIDRBTHHNBRPDU-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO Fc1cccc(CN2CCn3cc[nH+]c3C2)c1 ZINC000334266169 352901665 /nfs/dbraw/zinc/90/16/65/352901665.db2.gz NGHXRNAFBYRWPI-UHFFFAOYSA-N 1 2 231.274 2.038 20 0 BEADLO Cc1nc(N2CC[C@](C)(F)C2)c(C)c(C)[nH+]1 ZINC000334340986 352976661 /nfs/dbraw/zinc/97/66/61/352976661.db2.gz IFWDSWCXMVADEI-LBPRGKRZSA-N 1 2 223.295 2.340 20 0 BEADLO CC[C@H](C)[C@@H](C[N@@H+]1CCC(F)(F)C1)OC ZINC000638842360 353018441 /nfs/dbraw/zinc/01/84/41/353018441.db2.gz PXPNIUUTXXAENI-VHSXEESVSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@H](C)[C@@H](C[N@H+]1CCC(F)(F)C1)OC ZINC000638842360 353018442 /nfs/dbraw/zinc/01/84/42/353018442.db2.gz PXPNIUUTXXAENI-VHSXEESVSA-N 1 2 221.291 2.389 20 0 BEADLO CCc1nn(C)cc1CNc1c[nH+]ccc1C ZINC000092414498 538106957 /nfs/dbraw/zinc/10/69/57/538106957.db2.gz GNOKEYILWLMETO-UHFFFAOYSA-N 1 2 230.315 2.298 20 0 BEADLO COc1ccnc(C[N@@H+]2CC[C@](C)(F)C2)c1 ZINC000334361799 353011939 /nfs/dbraw/zinc/01/19/39/353011939.db2.gz JNFZFVHFNJKTOY-LBPRGKRZSA-N 1 2 224.279 2.024 20 0 BEADLO COc1ccnc(C[N@H+]2CC[C@](C)(F)C2)c1 ZINC000334361799 353011941 /nfs/dbraw/zinc/01/19/41/353011941.db2.gz JNFZFVHFNJKTOY-LBPRGKRZSA-N 1 2 224.279 2.024 20 0 BEADLO COc1cc[nH+]c(CN2CC[C@](C)(F)C2)c1 ZINC000334361799 353011942 /nfs/dbraw/zinc/01/19/42/353011942.db2.gz JNFZFVHFNJKTOY-LBPRGKRZSA-N 1 2 224.279 2.024 20 0 BEADLO Cc1ccc(C[N@@H+]2C[C@@H](F)C[C@H]2CO)cc1F ZINC000334396273 353069421 /nfs/dbraw/zinc/06/94/21/353069421.db2.gz CGYLZIKUVKHARX-RYUDHWBXSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1ccc(C[N@H+]2C[C@@H](F)C[C@H]2CO)cc1F ZINC000334396273 353069422 /nfs/dbraw/zinc/06/94/22/353069422.db2.gz CGYLZIKUVKHARX-RYUDHWBXSA-N 1 2 241.281 2.039 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1nc(C)c(C)o1 ZINC000334429734 353104543 /nfs/dbraw/zinc/10/45/43/353104543.db2.gz ZFGSLPLYZPYOCR-SKDRFNHKSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1nc(C)c(C)o1 ZINC000334429734 353104545 /nfs/dbraw/zinc/10/45/45/353104545.db2.gz ZFGSLPLYZPYOCR-SKDRFNHKSA-N 1 2 238.331 2.291 20 0 BEADLO O=C(CC1CCCC1)Nc1cc[nH+]cc1O ZINC000109891371 188060222 /nfs/dbraw/zinc/06/02/22/188060222.db2.gz SNSJJDHXJOYDFZ-UHFFFAOYSA-N 1 2 220.272 2.306 20 0 BEADLO C/C=C\CS(=O)(=O)Cc1ccc(C)[nH+]c1C ZINC000358492595 188067565 /nfs/dbraw/zinc/06/75/65/188067565.db2.gz CRZDHSNWXQVHJD-PLNGDYQASA-N 1 2 239.340 2.189 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+]1CC[C@H]1c1ccccc1 ZINC000362186414 188071351 /nfs/dbraw/zinc/07/13/51/188071351.db2.gz YRMNBKFBHICABT-YPMHNXCESA-N 1 2 233.311 2.385 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+]1CC[C@H]1c1ccccc1 ZINC000362186414 188071353 /nfs/dbraw/zinc/07/13/53/188071353.db2.gz YRMNBKFBHICABT-YPMHNXCESA-N 1 2 233.311 2.385 20 0 BEADLO CC(C)C[C@@H](C)C[N@@H+]1CC(F)(F)C[C@H]1CO ZINC000369052310 188074297 /nfs/dbraw/zinc/07/42/97/188074297.db2.gz ASSKLNDFJMBUDO-MNOVXSKESA-N 1 2 235.318 2.371 20 0 BEADLO CC(C)C[C@@H](C)C[N@H+]1CC(F)(F)C[C@H]1CO ZINC000369052310 188074298 /nfs/dbraw/zinc/07/42/98/188074298.db2.gz ASSKLNDFJMBUDO-MNOVXSKESA-N 1 2 235.318 2.371 20 0 BEADLO Cc1cc(N(C)[C@@H]2CCCOC2)nc(C2CC2)[nH+]1 ZINC000343251792 353194786 /nfs/dbraw/zinc/19/47/86/353194786.db2.gz PHXAFFMNHUTFIQ-GFCCVEGCSA-N 1 2 247.342 2.278 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+]Cc1cc(C)ccc1C ZINC000049372368 188124912 /nfs/dbraw/zinc/12/49/12/188124912.db2.gz SEGNBHAKAAOTSW-GFCCVEGCSA-N 1 2 235.327 2.345 20 0 BEADLO Cc1nnc(NCCc2cccc(C)[nH+]2)s1 ZINC000281576565 538111161 /nfs/dbraw/zinc/11/11/61/538111161.db2.gz VYQLBLWIYRFOAO-UHFFFAOYSA-N 1 2 234.328 2.205 20 0 BEADLO CC(C)C[C@@H](C)CC(=O)NCCn1cc[nH+]c1 ZINC000067793269 188129014 /nfs/dbraw/zinc/12/90/14/188129014.db2.gz WFSYKWRBBDSQGR-GFCCVEGCSA-N 1 2 237.347 2.072 20 0 BEADLO Cc1csc(C[NH2+]Cc2ncccc2C)n1 ZINC000082725474 188140883 /nfs/dbraw/zinc/14/08/83/188140883.db2.gz DXHIICQJBUIOTB-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+]Cc1cccc2cc[nH]c21 ZINC000083375267 188141659 /nfs/dbraw/zinc/14/16/59/188141659.db2.gz GMXANTLIYPEVLO-SNVBAGLBSA-N 1 2 246.310 2.209 20 0 BEADLO CC(=O)NC1CCC(Nc2ccc[nH+]c2C)CC1 ZINC000133868930 188156199 /nfs/dbraw/zinc/15/61/99/188156199.db2.gz HWXVCOLBHIOQJB-UHFFFAOYSA-N 1 2 247.342 2.249 20 0 BEADLO Cc1ccc(C[NH2+]CC(F)F)cc1F ZINC000147271212 188156620 /nfs/dbraw/zinc/15/66/20/188156620.db2.gz YEBMKPKQBRXMSX-UHFFFAOYSA-N 1 2 203.207 2.489 20 0 BEADLO CC(C)[C@H](C)C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000171971675 188162835 /nfs/dbraw/zinc/16/28/35/188162835.db2.gz UOZGKGCWAYWTDC-LBPRGKRZSA-N 1 2 249.358 2.339 20 0 BEADLO CC(C)[N@H+](CC(F)F)C[C@@H](O)C(C)(C)C ZINC000308831229 188165415 /nfs/dbraw/zinc/16/54/15/188165415.db2.gz UCLNKYCFGSAUPV-SECBINFHSA-N 1 2 223.307 2.369 20 0 BEADLO CC(C)[N@@H+](CC(F)F)C[C@@H](O)C(C)(C)C ZINC000308831229 188165416 /nfs/dbraw/zinc/16/54/16/188165416.db2.gz UCLNKYCFGSAUPV-SECBINFHSA-N 1 2 223.307 2.369 20 0 BEADLO Cc1nc(N2CCCC[C@@H](C)C2)cc[nH+]1 ZINC000185858348 188170693 /nfs/dbraw/zinc/17/06/93/188170693.db2.gz QNRQWUONYOORNB-SNVBAGLBSA-N 1 2 205.305 2.411 20 0 BEADLO Cc1nc(N2CCC[C@@H](C)CC2)cc[nH+]1 ZINC000266112883 188195340 /nfs/dbraw/zinc/19/53/40/188195340.db2.gz KSLQPXCQQBVJOP-SNVBAGLBSA-N 1 2 205.305 2.411 20 0 BEADLO Cc1cccc(C[S@](=O)Cc2c[nH+]cn2C)c1 ZINC000268144472 188196467 /nfs/dbraw/zinc/19/64/67/188196467.db2.gz ITIKZLUDNCAPRD-KRWDZBQOSA-N 1 2 248.351 2.177 20 0 BEADLO C=Cn1cc(CNc2c[nH+]ccc2C)cn1 ZINC000194353180 188175577 /nfs/dbraw/zinc/17/55/77/188175577.db2.gz XISBKLZNKGOJBA-UHFFFAOYSA-N 1 2 214.272 2.299 20 0 BEADLO Cc1cc(N)nc(S[C@H](C)c2cccnc2)[nH+]1 ZINC000338593077 188189290 /nfs/dbraw/zinc/18/92/90/188189290.db2.gz RBXFKXBJXLODBG-SECBINFHSA-N 1 2 246.339 2.446 20 0 BEADLO C[C@H](C(N)=O)[N@H+](C)Cc1cc(C(C)(C)C)n[nH]1 ZINC000331339564 188220475 /nfs/dbraw/zinc/22/04/75/188220475.db2.gz MJZFBDMAFTVXRX-MRVPVSSYSA-N 1 2 238.335 2.063 20 0 BEADLO C[C@H](C(N)=O)[N@@H+](C)Cc1cc(C(C)(C)C)n[nH]1 ZINC000331339564 188220476 /nfs/dbraw/zinc/22/04/76/188220476.db2.gz MJZFBDMAFTVXRX-MRVPVSSYSA-N 1 2 238.335 2.063 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccco2)C[C@@H](C)[S@@]1=O ZINC000289254327 188210691 /nfs/dbraw/zinc/21/06/91/188210691.db2.gz FHNYPQURCVIEKR-SIVJFFJCSA-N 1 2 241.356 2.011 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccco2)C[C@@H](C)[S@@]1=O ZINC000289254327 188210693 /nfs/dbraw/zinc/21/06/93/188210693.db2.gz FHNYPQURCVIEKR-SIVJFFJCSA-N 1 2 241.356 2.011 20 0 BEADLO Cc1ccc(Cc2noc(C[NH+](C)C)n2)s1 ZINC000288989659 188210757 /nfs/dbraw/zinc/21/07/57/188210757.db2.gz CJPZACGZTYESAG-UHFFFAOYSA-N 1 2 237.328 2.092 20 0 BEADLO C/C=C(\C=C\C(=O)N1CCn2c[nH+]cc2C1)CC ZINC000290929998 188211866 /nfs/dbraw/zinc/21/18/66/188211866.db2.gz MEBUIYPPOOOJFC-JBFKJUGCSA-N 1 2 245.326 2.138 20 0 BEADLO CC1=C(C(=O)Nc2cc[nH+]cc2C)CCC1 ZINC000336161513 535219720 /nfs/dbraw/zinc/21/97/20/535219720.db2.gz NNYAPSKZTMAWGF-UHFFFAOYSA-N 1 2 216.284 2.251 20 0 BEADLO COc1ccc(N[C@@H]2CCO[C@@H](C)C2)[nH+]c1 ZINC000225835343 538114204 /nfs/dbraw/zinc/11/42/04/538114204.db2.gz IJFYJMCQQVCPDW-VHSXEESVSA-N 1 2 222.288 2.070 20 0 BEADLO COc1ccc(NC2CCSCC2)[nH+]c1 ZINC000225894118 538114500 /nfs/dbraw/zinc/11/45/00/538114500.db2.gz KORNQFJNTLPJIG-UHFFFAOYSA-N 1 2 224.329 2.398 20 0 BEADLO COc1ccc(NCc2scnc2C)[nH+]c1 ZINC000225894767 538114558 /nfs/dbraw/zinc/11/45/58/538114558.db2.gz QKGWENZYWFXVMK-UHFFFAOYSA-N 1 2 235.312 2.467 20 0 BEADLO COc1ccc(NCc2ccccn2)[nH+]c1 ZINC000225894902 538114598 /nfs/dbraw/zinc/11/45/98/538114598.db2.gz FULCNKMLVGSZJE-UHFFFAOYSA-N 1 2 215.256 2.097 20 0 BEADLO COc1ccc(NCc2c(C)noc2C)[nH+]c1 ZINC000225894367 538114600 /nfs/dbraw/zinc/11/46/00/538114600.db2.gz CYKKZCPAZINYCC-UHFFFAOYSA-N 1 2 233.271 2.307 20 0 BEADLO CC[N@H+](CC(F)F)C[C@@](C)(OC)C1CC1 ZINC000639060569 353367601 /nfs/dbraw/zinc/36/76/01/353367601.db2.gz NGGJNTNCUCHZKO-LLVKDONJSA-N 1 2 221.291 2.389 20 0 BEADLO CC[N@@H+](CC(F)F)C[C@@](C)(OC)C1CC1 ZINC000639060569 353367604 /nfs/dbraw/zinc/36/76/04/353367604.db2.gz NGGJNTNCUCHZKO-LLVKDONJSA-N 1 2 221.291 2.389 20 0 BEADLO C[C@@H](C(N)=O)[N@@H+]1CCO[C@@H](C2CCCCC2)C1 ZINC000334503724 353351109 /nfs/dbraw/zinc/35/11/09/353351109.db2.gz XJBRRAYLMLVQBQ-CMPLNLGQSA-N 1 2 240.347 2.191 20 0 BEADLO C[C@@H](C(N)=O)[N@H+]1CCO[C@@H](C2CCCCC2)C1 ZINC000334503724 353351112 /nfs/dbraw/zinc/35/11/12/353351112.db2.gz XJBRRAYLMLVQBQ-CMPLNLGQSA-N 1 2 240.347 2.191 20 0 BEADLO Cc1ccc(C[N@@H+]2C[C@@H](F)C[C@H]2CO)c(F)c1 ZINC000639086819 353428402 /nfs/dbraw/zinc/42/84/02/353428402.db2.gz TZCUYTFKQPSATH-RYUDHWBXSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1ccc(C[N@H+]2C[C@@H](F)C[C@H]2CO)c(F)c1 ZINC000639086819 353428404 /nfs/dbraw/zinc/42/84/04/353428404.db2.gz TZCUYTFKQPSATH-RYUDHWBXSA-N 1 2 241.281 2.039 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccns2)[C@@H](C)[C@@H](C)O1 ZINC000639085882 353433341 /nfs/dbraw/zinc/43/33/41/353433341.db2.gz MBVFMRJHFWOKOK-KXUCPTDWSA-N 1 2 226.345 2.141 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccns2)[C@@H](C)[C@@H](C)O1 ZINC000639085882 353433342 /nfs/dbraw/zinc/43/33/42/353433342.db2.gz MBVFMRJHFWOKOK-KXUCPTDWSA-N 1 2 226.345 2.141 20 0 BEADLO Cc1ccc(NC(=O)Nc2cnn(C)c2)c(C)[nH+]1 ZINC000152343876 353506496 /nfs/dbraw/zinc/50/64/96/353506496.db2.gz VIJPIOAGVUIWBB-UHFFFAOYSA-N 1 2 245.286 2.076 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2cnn(C)c2)o1 ZINC000230639959 353518928 /nfs/dbraw/zinc/51/89/28/353518928.db2.gz RHZVGGOAWIGNAP-NXEZZACHSA-N 1 2 234.303 2.128 20 0 BEADLO C[C@@H]1CC[C@@H](CNc2[nH+]cnc3c2cnn3C)C1 ZINC000230434242 353497831 /nfs/dbraw/zinc/49/78/31/353497831.db2.gz DNQFIEDJTFEURJ-NXEZZACHSA-N 1 2 245.330 2.211 20 0 BEADLO Fc1cccc2c1C[N@H+](Cc1cnccn1)CC2 ZINC000334514893 353593770 /nfs/dbraw/zinc/59/37/70/353593770.db2.gz GIEVHBLWRBIAOF-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1cccc2c1C[N@@H+](Cc1cnccn1)CC2 ZINC000334514893 353593771 /nfs/dbraw/zinc/59/37/71/353593771.db2.gz GIEVHBLWRBIAOF-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO CC1(NC(=O)CCc2c[nH+]c[nH]2)CCCCC1 ZINC000192840387 353570884 /nfs/dbraw/zinc/57/08/84/353570884.db2.gz ZXQYKWXDBXKDSP-UHFFFAOYSA-N 1 2 235.331 2.181 20 0 BEADLO CC1(NC(=O)CCc2c[nH]c[nH+]2)CCCCC1 ZINC000192840387 353570886 /nfs/dbraw/zinc/57/08/86/353570886.db2.gz ZXQYKWXDBXKDSP-UHFFFAOYSA-N 1 2 235.331 2.181 20 0 BEADLO Cc1cc(C[NH2+]Cc2ncccn2)c(C)s1 ZINC000577866805 366091516 /nfs/dbraw/zinc/09/15/16/366091516.db2.gz DYEFZMUKSUYFNX-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CC(C2CCCC2)C1 ZINC000334518929 353651977 /nfs/dbraw/zinc/65/19/77/353651977.db2.gz UYQWZQNAZUEJPZ-UHFFFAOYSA-N 1 2 219.332 2.340 20 0 BEADLO C[C@@H]1CCCN1c1nc(N)c2ccccc2[nH+]1 ZINC000152421020 353726306 /nfs/dbraw/zinc/72/63/06/353726306.db2.gz OIIZEZUKEZLCKA-SECBINFHSA-N 1 2 228.299 2.201 20 0 BEADLO Fc1ccccc1C[N@@H+]1CCc2n[nH]cc2C1 ZINC000265407661 181011766 /nfs/dbraw/zinc/01/17/66/181011766.db2.gz CRNXKVVAGLZYQZ-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO Fc1ccccc1C[N@H+]1CCc2n[nH]cc2C1 ZINC000265407661 181011769 /nfs/dbraw/zinc/01/17/69/181011769.db2.gz CRNXKVVAGLZYQZ-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO CO[C@@H](C[NH2+]C1(C(F)F)CC1)CC(C)C ZINC000639140294 353848727 /nfs/dbraw/zinc/84/87/27/353848727.db2.gz VANVNOHSOGBNSR-SECBINFHSA-N 1 2 221.291 2.435 20 0 BEADLO CCC[C@H](C[NH2+]C1(C(F)F)CC1)OC ZINC000639139913 353848960 /nfs/dbraw/zinc/84/89/60/353848960.db2.gz QEKXWTALIMKJBL-MRVPVSSYSA-N 1 2 207.264 2.189 20 0 BEADLO Cc1ccc(C[N@@H+]2CC[C@](F)(CO)C2)c(F)c1 ZINC000639145668 353851689 /nfs/dbraw/zinc/85/16/89/353851689.db2.gz VLKFCWPBDPJOMM-CYBMUJFWSA-N 1 2 241.281 2.040 20 0 BEADLO Cc1ccc(C[N@H+]2CC[C@](F)(CO)C2)c(F)c1 ZINC000639145668 353851691 /nfs/dbraw/zinc/85/16/91/353851691.db2.gz VLKFCWPBDPJOMM-CYBMUJFWSA-N 1 2 241.281 2.040 20 0 BEADLO CCC[C@@H](C(=O)N(C)Cc1[nH]cc[nH+]1)C(C)C ZINC000343547801 353918397 /nfs/dbraw/zinc/91/83/97/353918397.db2.gz XVBAIVCTHBCVDA-LLVKDONJSA-N 1 2 237.347 2.440 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2cncc(F)c2)C1 ZINC000334536921 353923658 /nfs/dbraw/zinc/92/36/58/353923658.db2.gz NHLGKIPUXSWESG-NSHDSACASA-N 1 2 212.243 2.155 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2cncc(F)c2)C1 ZINC000334536921 353923661 /nfs/dbraw/zinc/92/36/61/353923661.db2.gz NHLGKIPUXSWESG-NSHDSACASA-N 1 2 212.243 2.155 20 0 BEADLO CC1(C)CCCCN(C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000334539726 353927673 /nfs/dbraw/zinc/92/76/73/353927673.db2.gz JVRTZXWLSCSART-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO CC(C)c1nc(NC[C@H]2CCOC[C@H]2C)cc[nH+]1 ZINC000343558255 353934380 /nfs/dbraw/zinc/93/43/80/353934380.db2.gz UVGYXTQAHQBZAU-VXGBXAGGSA-N 1 2 249.358 2.106 20 0 BEADLO COC(=O)c1occc1CNc1cccc[nH+]1 ZINC000343475089 353902028 /nfs/dbraw/zinc/90/20/28/353902028.db2.gz MAZITMXLOFLTBS-UHFFFAOYSA-N 1 2 232.239 2.073 20 0 BEADLO Cc1cc(N2CC=C(C(F)(F)F)CC2)nc[nH+]1 ZINC000334544562 353981178 /nfs/dbraw/zinc/98/11/78/353981178.db2.gz XDHGAAAPSPODNN-UHFFFAOYSA-N 1 2 243.232 2.484 20 0 BEADLO CCOCC[N@H+](C)Cc1nc(C2CC2)cs1 ZINC000343774712 353985588 /nfs/dbraw/zinc/98/55/88/353985588.db2.gz VRCNHLAJPJVIKR-UHFFFAOYSA-N 1 2 240.372 2.489 20 0 BEADLO CCOCC[N@@H+](C)Cc1nc(C2CC2)cs1 ZINC000343774712 353985590 /nfs/dbraw/zinc/98/55/90/353985590.db2.gz VRCNHLAJPJVIKR-UHFFFAOYSA-N 1 2 240.372 2.489 20 0 BEADLO C[C@@H]1CC[C@@H]1Nc1cc(N2CCCC2)nc[nH+]1 ZINC000343809356 354011058 /nfs/dbraw/zinc/01/10/58/354011058.db2.gz OJFCHBKIHOBZNS-MNOVXSKESA-N 1 2 232.331 2.287 20 0 BEADLO C[C@@H]1CC[C@@H]1Nc1cc(N2CCCC2)[nH+]cn1 ZINC000343809356 354011061 /nfs/dbraw/zinc/01/10/61/354011061.db2.gz OJFCHBKIHOBZNS-MNOVXSKESA-N 1 2 232.331 2.287 20 0 BEADLO C[C@H]1CC[C@@H]1[NH+]=c1[nH]c2c(cccc2F)n1C ZINC000343842705 354019629 /nfs/dbraw/zinc/01/96/29/354019629.db2.gz HIBAIYCGASFOLF-WPRPVWTQSA-N 1 2 233.290 2.345 20 0 BEADLO C[C@@H](Nc1cccc[nH+]1)C1CCOCC1 ZINC000230217861 363300011 /nfs/dbraw/zinc/30/00/11/363300011.db2.gz OFOHZNXDKIHFPP-SNVBAGLBSA-N 1 2 206.289 2.309 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@@H+]1Cc1ccc2c(n1)CCC2 ZINC000334565833 354086189 /nfs/dbraw/zinc/08/61/89/354086189.db2.gz YNLMYLAFXQOMMD-NEPJUHHUSA-N 1 2 246.354 2.180 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1ccc2c(n1)CCC2 ZINC000334565833 354086192 /nfs/dbraw/zinc/08/61/92/354086192.db2.gz YNLMYLAFXQOMMD-NEPJUHHUSA-N 1 2 246.354 2.180 20 0 BEADLO CCc1nc(C[N@H+](C)C[C@H]2CC=CCC2)no1 ZINC000344059465 354128183 /nfs/dbraw/zinc/12/81/83/354128183.db2.gz LEWAUZFYTMFLAI-NSHDSACASA-N 1 2 235.331 2.420 20 0 BEADLO CCc1nc(C[N@@H+](C)C[C@H]2CC=CCC2)no1 ZINC000344059465 354128186 /nfs/dbraw/zinc/12/81/86/354128186.db2.gz LEWAUZFYTMFLAI-NSHDSACASA-N 1 2 235.331 2.420 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](Cc1ccno1)C2 ZINC000334571892 354099804 /nfs/dbraw/zinc/09/98/04/354099804.db2.gz USYZTELEVZIYFV-UHFFFAOYSA-N 1 2 214.268 2.499 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](Cc1ccno1)C2 ZINC000334571892 354099808 /nfs/dbraw/zinc/09/98/08/354099808.db2.gz USYZTELEVZIYFV-UHFFFAOYSA-N 1 2 214.268 2.499 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CCCC12CCC2 ZINC000334577895 354120953 /nfs/dbraw/zinc/12/09/53/354120953.db2.gz GYHFSFQRKSQLEU-UHFFFAOYSA-N 1 2 245.326 2.362 20 0 BEADLO Cc1cnc(CNc2cc(C)[nH+]cn2)s1 ZINC000230914641 363328798 /nfs/dbraw/zinc/32/87/98/363328798.db2.gz AGTMJONGWLAXIV-UHFFFAOYSA-N 1 2 220.301 2.162 20 0 BEADLO Cc1cc(F)ccc1NC(=O)CCc1[nH]cc[nH+]1 ZINC000344188415 354178201 /nfs/dbraw/zinc/17/82/01/354178201.db2.gz FBCOAVPOHPHCDD-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO COC[C@H]([NH2+]Cc1cc[nH]n1)c1ccc(F)cc1 ZINC000344583402 354311087 /nfs/dbraw/zinc/31/10/87/354311087.db2.gz UANKPVWRVZTNGQ-ZDUSSCGKSA-N 1 2 249.289 2.026 20 0 BEADLO CC[C@H]([NH2+]Cc1cn[nH]c1C)c1ccncc1 ZINC000344548395 354314895 /nfs/dbraw/zinc/31/48/95/354314895.db2.gz IPVDQOGCVOCHSQ-ZDUSSCGKSA-N 1 2 230.315 2.354 20 0 BEADLO O=C(Nc1c[nH+]c2n1CCCC2)c1ccoc1 ZINC000334634137 354378767 /nfs/dbraw/zinc/37/87/67/354378767.db2.gz QWTCDTVQMWFXNZ-UHFFFAOYSA-N 1 2 231.255 2.065 20 0 BEADLO Cc1cc(N2CC[C@@H](C(C)C)C2)nc[nH+]1 ZINC000334624456 354364168 /nfs/dbraw/zinc/36/41/68/354364168.db2.gz STISVPCBSPDWIO-LLVKDONJSA-N 1 2 205.305 2.267 20 0 BEADLO CC(=O)c1ccc(C[N@@H+]2CCOCC23CC3)cc1 ZINC000334624949 354364509 /nfs/dbraw/zinc/36/45/09/354364509.db2.gz RLSNFNUAAWGKCF-UHFFFAOYSA-N 1 2 245.322 2.254 20 0 BEADLO CC(=O)c1ccc(C[N@H+]2CCOCC23CC3)cc1 ZINC000334624949 354364514 /nfs/dbraw/zinc/36/45/14/354364514.db2.gz RLSNFNUAAWGKCF-UHFFFAOYSA-N 1 2 245.322 2.254 20 0 BEADLO CC1(CO)C[NH+](Cc2cccc(Cl)c2F)C1 ZINC000334643941 354401229 /nfs/dbraw/zinc/40/12/29/354401229.db2.gz BQODCGZTQZVCMC-UHFFFAOYSA-N 1 2 243.709 2.293 20 0 BEADLO Cc1csc(C[N@@H+]2CCCO[C@H](CF)C2)n1 ZINC000334644237 354402296 /nfs/dbraw/zinc/40/22/96/354402296.db2.gz CADVHIRHUIIVNG-SNVBAGLBSA-N 1 2 244.335 2.012 20 0 BEADLO Cc1csc(C[N@H+]2CCCO[C@H](CF)C2)n1 ZINC000334644237 354402299 /nfs/dbraw/zinc/40/22/99/354402299.db2.gz CADVHIRHUIIVNG-SNVBAGLBSA-N 1 2 244.335 2.012 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000580401626 358487224 /nfs/dbraw/zinc/48/72/24/358487224.db2.gz ZDYHLZKVQWOBLC-URLYPYJESA-N 1 2 236.315 2.458 20 0 BEADLO CCn1ncnc1C[N@@H+]1CC2(CCC2)[C@H]1C1CC1 ZINC000639190415 354426124 /nfs/dbraw/zinc/42/61/24/354426124.db2.gz AFOPKFSVHMCNLO-CYBMUJFWSA-N 1 2 246.358 2.063 20 0 BEADLO CCn1ncnc1C[N@H+]1CC2(CCC2)[C@H]1C1CC1 ZINC000639190415 354426128 /nfs/dbraw/zinc/42/61/28/354426128.db2.gz AFOPKFSVHMCNLO-CYBMUJFWSA-N 1 2 246.358 2.063 20 0 BEADLO CC1=CCC[N@@H+]([C@H](C)c2csnn2)C1 ZINC000334682735 354428218 /nfs/dbraw/zinc/42/82/18/354428218.db2.gz FIAPLNOBVUQCJN-SECBINFHSA-N 1 2 209.318 2.251 20 0 BEADLO CC1=CCC[N@H+]([C@H](C)c2csnn2)C1 ZINC000334682735 354428220 /nfs/dbraw/zinc/42/82/20/354428220.db2.gz FIAPLNOBVUQCJN-SECBINFHSA-N 1 2 209.318 2.251 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CC(C(C)(C)C)C1 ZINC000334682808 354428362 /nfs/dbraw/zinc/42/83/62/354428362.db2.gz IAADFHJCOCZBBO-UHFFFAOYSA-N 1 2 247.342 2.322 20 0 BEADLO Cn1cc[nH+]c1CNc1ccc2c(c1)CCC2=O ZINC000334653047 354446916 /nfs/dbraw/zinc/44/69/16/354446916.db2.gz QMICZADQKPXBED-UHFFFAOYSA-N 1 2 241.294 2.161 20 0 BEADLO C[C@H]1C[N@H+](C)CCN1C[C@H]1CCC(F)(F)C1 ZINC000334664602 354466011 /nfs/dbraw/zinc/46/60/11/354466011.db2.gz VDNBHWVVYVCODQ-QWRGUYRKSA-N 1 2 232.318 2.058 20 0 BEADLO Cc1ccc(C(=O)Nc2c[nH+]c3n2CCCC3)o1 ZINC000334694963 354486332 /nfs/dbraw/zinc/48/63/32/354486332.db2.gz HPDYAGQGORVWEB-UHFFFAOYSA-N 1 2 245.282 2.373 20 0 BEADLO CC(C)[C@@H]1C[C@H]1C(=O)Nc1c[nH+]c2n1CCCC2 ZINC000334665433 354467023 /nfs/dbraw/zinc/46/70/23/354467023.db2.gz DLCCSYIBPJGMGQ-WDEREUQCSA-N 1 2 247.342 2.450 20 0 BEADLO Cc1nnc(C[N@H+]2CCS[C@H](C)[C@@H]2C)s1 ZINC000334750371 354475678 /nfs/dbraw/zinc/47/56/78/354475678.db2.gz VOZTWJCYGDGBCN-JGVFFNPUSA-N 1 2 243.401 2.172 20 0 BEADLO Cc1nnc(C[N@@H+]2CCS[C@H](C)[C@@H]2C)s1 ZINC000334750371 354475681 /nfs/dbraw/zinc/47/56/81/354475681.db2.gz VOZTWJCYGDGBCN-JGVFFNPUSA-N 1 2 243.401 2.172 20 0 BEADLO C[C@H]1CCCC[C@H]1CCNC(=O)Cn1cc[nH+]c1 ZINC000578061029 366206492 /nfs/dbraw/zinc/20/64/92/366206492.db2.gz DTAXSSPIGKVQMJ-STQMWFEESA-N 1 2 249.358 2.216 20 0 BEADLO Cc1cccc(C[N@@H+]2CC[C@](F)(CO)C2)c1F ZINC000334742502 354545853 /nfs/dbraw/zinc/54/58/53/354545853.db2.gz JKHRDNVJLSRBKP-CYBMUJFWSA-N 1 2 241.281 2.040 20 0 BEADLO Cc1cccc(C[N@H+]2CC[C@](F)(CO)C2)c1F ZINC000334742502 354545854 /nfs/dbraw/zinc/54/58/54/354545854.db2.gz JKHRDNVJLSRBKP-CYBMUJFWSA-N 1 2 241.281 2.040 20 0 BEADLO Cc1cc(N[C@H]2CC[C@@H](F)C2)nc(C2CC2)[nH+]1 ZINC000334739062 354542149 /nfs/dbraw/zinc/54/21/49/354542149.db2.gz LATNACPYPVIYJK-MNOVXSKESA-N 1 2 235.306 2.387 20 0 BEADLO c1coc(C[N@@H+]2CCC[C@@H]2c2ncc[nH]2)c1 ZINC000334709139 354504965 /nfs/dbraw/zinc/50/49/65/354504965.db2.gz WINPNRYRHHQPDV-LLVKDONJSA-N 1 2 217.272 2.340 20 0 BEADLO c1coc(C[N@H+]2CCC[C@@H]2c2ncc[nH]2)c1 ZINC000334709139 354504967 /nfs/dbraw/zinc/50/49/67/354504967.db2.gz WINPNRYRHHQPDV-LLVKDONJSA-N 1 2 217.272 2.340 20 0 BEADLO C[C@@H]1C[C@H](Nc2cc[nH+]c3ccncc23)CS1 ZINC000334805571 354562058 /nfs/dbraw/zinc/56/20/58/354562058.db2.gz KTKGZXSVFWBZGG-ZJUUUORDSA-N 1 2 245.351 2.358 20 0 BEADLO Cc1cc(N[C@@H]2CS[C@H](C)C2)nc(C2CC2)[nH+]1 ZINC000334805621 354562582 /nfs/dbraw/zinc/56/25/82/354562582.db2.gz LFSQBTPLJXMIBO-KOLCDFICSA-N 1 2 249.383 2.390 20 0 BEADLO Cc1cc(N2CC[C@@H](CC3CC3)C2)nc[nH+]1 ZINC000334814496 354572146 /nfs/dbraw/zinc/57/21/46/354572146.db2.gz KGGBRGBUFGDNEQ-LBPRGKRZSA-N 1 2 217.316 2.411 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@@H](C3CCC3)C2)nc1 ZINC000334814841 354572941 /nfs/dbraw/zinc/57/29/41/354572941.db2.gz GSESBGARMXPHKF-OAHLLOKOSA-N 1 2 246.354 2.391 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@@H](C3CCC3)C2)nc1 ZINC000334814841 354572944 /nfs/dbraw/zinc/57/29/44/354572944.db2.gz GSESBGARMXPHKF-OAHLLOKOSA-N 1 2 246.354 2.391 20 0 BEADLO Cc1cnc(C[NH+]2C[C@H](C)S[C@@H](C)C2)nc1 ZINC000334754339 354575608 /nfs/dbraw/zinc/57/56/08/354575608.db2.gz DBOQNAIEHRAKPU-QWRGUYRKSA-N 1 2 237.372 2.111 20 0 BEADLO C[C@H]1[N@H+](Cc2ccncc2F)CCOC1(C)C ZINC000334758368 354579440 /nfs/dbraw/zinc/57/94/40/354579440.db2.gz VBHQEGWONVGBQK-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H]1[N@@H+](Cc2ccncc2F)CCOC1(C)C ZINC000334758368 354579442 /nfs/dbraw/zinc/57/94/42/354579442.db2.gz VBHQEGWONVGBQK-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO CCc1nc(C)c(C[N@@H+]2CCO[C@H](C)[C@H]2C)o1 ZINC000334762313 354582267 /nfs/dbraw/zinc/58/22/67/354582267.db2.gz KLIBOXNISWFPMX-GHMZBOCLSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1nc(C)c(C[N@H+]2CCO[C@H](C)[C@H]2C)o1 ZINC000334762313 354582270 /nfs/dbraw/zinc/58/22/70/354582270.db2.gz KLIBOXNISWFPMX-GHMZBOCLSA-N 1 2 238.331 2.155 20 0 BEADLO Cc1ccc(C(=O)N[C@H]2C[C@H](C)n3cc[nH+]c32)o1 ZINC000334743781 354547721 /nfs/dbraw/zinc/54/77/21/354547721.db2.gz MUNSHDIDFZMJSO-WPRPVWTQSA-N 1 2 245.282 2.220 20 0 BEADLO O=C(Nc1ccccc1)[C@H]1CCc2c[nH+]cn2C1 ZINC000334744672 354548488 /nfs/dbraw/zinc/54/84/88/354548488.db2.gz NYFXKIHYKXLRTE-NSHDSACASA-N 1 2 241.294 2.084 20 0 BEADLO C[C@H]1CCC[C@H](CC(=O)NCCn2cc[nH+]c2)C1 ZINC000345368105 354638882 /nfs/dbraw/zinc/63/88/82/354638882.db2.gz ATECQULQLKYVNA-STQMWFEESA-N 1 2 249.358 2.216 20 0 BEADLO C[C@H]1CCC[C@H](CC(=O)Nc2cc[nH+]cc2O)C1 ZINC000345382937 354646169 /nfs/dbraw/zinc/64/61/69/354646169.db2.gz UEAHWIZLCJZMEN-QWRGUYRKSA-N 1 2 248.326 2.364 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CCC(C(F)F)CC1 ZINC000335082827 354616022 /nfs/dbraw/zinc/61/60/22/354616022.db2.gz QEYNZYSWRMJXFB-UHFFFAOYSA-N 1 2 229.274 2.195 20 0 BEADLO CCCC1(C(=O)NCc2[nH]c[nH+]c2C)CCC1 ZINC000345342578 354619527 /nfs/dbraw/zinc/61/95/27/354619527.db2.gz KUUFGUREZKRFFG-UHFFFAOYSA-N 1 2 235.331 2.305 20 0 BEADLO C[C@H]1CN(C(=O)CCc2[nH]cc[nH+]2)CC(C)(C)C1 ZINC000335105219 354689621 /nfs/dbraw/zinc/68/96/21/354689621.db2.gz VKGRYUWXDDCUHC-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO Cc1cc(C[NH2+]CC(C)(F)F)sn1 ZINC000639207735 354693302 /nfs/dbraw/zinc/69/33/02/354693302.db2.gz KKXZFKDAYLOLQS-UHFFFAOYSA-N 1 2 206.261 2.196 20 0 BEADLO C[C@H]1C[NH+](Cc2nc(C(F)F)no2)C[C@@H]1C ZINC000335101012 354710335 /nfs/dbraw/zinc/71/03/35/354710335.db2.gz VLIYMUQGPMDXJN-BQBZGAKWSA-N 1 2 231.246 2.095 20 0 BEADLO CCC[C@H](C)CC(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000345606340 354728425 /nfs/dbraw/zinc/72/84/25/354728425.db2.gz IRFZQJXUPNCFIC-RYUDHWBXSA-N 1 2 237.347 2.214 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccns1)C(F)F ZINC000639214099 354802038 /nfs/dbraw/zinc/80/20/38/354802038.db2.gz NBGJJKLBPRHMMM-SSDOTTSWSA-N 1 2 206.261 2.276 20 0 BEADLO CC(C)c1nc(C[N@@H+]2CCC[C@@H](C)C2)no1 ZINC000053602280 363416782 /nfs/dbraw/zinc/41/67/82/363416782.db2.gz ILFWKYRAYTUNLB-SNVBAGLBSA-N 1 2 223.320 2.425 20 0 BEADLO CC(C)c1nc(C[N@H+]2CCC[C@@H](C)C2)no1 ZINC000053602280 363416783 /nfs/dbraw/zinc/41/67/83/363416783.db2.gz ILFWKYRAYTUNLB-SNVBAGLBSA-N 1 2 223.320 2.425 20 0 BEADLO FC1CN(Cc2[nH+]ccn2Cc2ccccc2)C1 ZINC000346319992 354895823 /nfs/dbraw/zinc/89/58/23/354895823.db2.gz QAQWETISOVMXRV-UHFFFAOYSA-N 1 2 245.301 2.085 20 0 BEADLO C[N@@H+](Cc1csnn1)C[C@@H]1CC=CCC1 ZINC000346334068 354899187 /nfs/dbraw/zinc/89/91/87/354899187.db2.gz NGDOPLFBHJDEDV-SNVBAGLBSA-N 1 2 223.345 2.326 20 0 BEADLO C[N@H+](Cc1csnn1)C[C@@H]1CC=CCC1 ZINC000346334068 354899192 /nfs/dbraw/zinc/89/91/92/354899192.db2.gz NGDOPLFBHJDEDV-SNVBAGLBSA-N 1 2 223.345 2.326 20 0 BEADLO C[N@H+](Cc1cccnc1)Cc1ccc(F)cn1 ZINC000346406636 354911935 /nfs/dbraw/zinc/91/19/35/354911935.db2.gz CTBYWRCLELKCMN-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[N@@H+](Cc1cccnc1)Cc1ccc(F)cn1 ZINC000346406636 354911937 /nfs/dbraw/zinc/91/19/37/354911937.db2.gz CTBYWRCLELKCMN-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO Cc1c(Cl)c(C[N@@H+]2CC[C@H]2C2CC2)nn1C ZINC000335174785 354941935 /nfs/dbraw/zinc/94/19/35/354941935.db2.gz HXAQDKJXXPNLJK-NSHDSACASA-N 1 2 239.750 2.366 20 0 BEADLO Cc1c(Cl)c(C[N@H+]2CC[C@H]2C2CC2)nn1C ZINC000335174785 354941939 /nfs/dbraw/zinc/94/19/39/354941939.db2.gz HXAQDKJXXPNLJK-NSHDSACASA-N 1 2 239.750 2.366 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@H](C)CCc1cccc(C)c1 ZINC000040500705 358493267 /nfs/dbraw/zinc/49/32/67/358493267.db2.gz BFNHBUSNALYJFE-OLZOCXBDSA-N 1 2 249.354 2.467 20 0 BEADLO c1c[nH]c([C@@H]2CCC[N@H+]2Cc2ncccn2)c1 ZINC000335204589 355039810 /nfs/dbraw/zinc/03/98/10/355039810.db2.gz HJGLBDYMSJWCNR-LBPRGKRZSA-N 1 2 228.299 2.142 20 0 BEADLO c1c[nH]c([C@@H]2CCC[N@@H+]2Cc2ncccn2)c1 ZINC000335204589 355039811 /nfs/dbraw/zinc/03/98/11/355039811.db2.gz HJGLBDYMSJWCNR-LBPRGKRZSA-N 1 2 228.299 2.142 20 0 BEADLO Cc1ccccc1-n1cc(C[NH+]2CC(C)C2)nn1 ZINC000335206428 355042055 /nfs/dbraw/zinc/04/20/55/355042055.db2.gz CHRWATYLZWFYHR-UHFFFAOYSA-N 1 2 242.326 2.027 20 0 BEADLO CC(CN(C)CC(F)F)C[N@H+](C)CC(F)F ZINC000346636629 355014623 /nfs/dbraw/zinc/01/46/23/355014623.db2.gz CGTQZKVKVFUZLX-UHFFFAOYSA-N 1 2 244.276 2.016 20 0 BEADLO CC(CN(C)CC(F)F)C[N@@H+](C)CC(F)F ZINC000346636629 355014626 /nfs/dbraw/zinc/01/46/26/355014626.db2.gz CGTQZKVKVFUZLX-UHFFFAOYSA-N 1 2 244.276 2.016 20 0 BEADLO Cc1ccc(F)c(NC(=O)CCn2cc[nH+]c2)c1 ZINC000346790842 355105879 /nfs/dbraw/zinc/10/58/79/355105879.db2.gz GCPDUVBNGHAHOM-UHFFFAOYSA-N 1 2 247.273 2.359 20 0 BEADLO Cc1[nH+]cccc1Cc1nc(-c2ccon2)no1 ZINC000346865463 355120314 /nfs/dbraw/zinc/12/03/14/355120314.db2.gz HESOJLTXZZPUPI-UHFFFAOYSA-N 1 2 242.238 2.019 20 0 BEADLO Cc1nc(COCc2[nH]cc[nH+]2)c(C)s1 ZINC000346741025 355090432 /nfs/dbraw/zinc/09/04/32/355090432.db2.gz CVVDNGQGSXWLPW-UHFFFAOYSA-N 1 2 223.301 2.200 20 0 BEADLO C[C@H]1[C@@H](CO)CCCN1c1[nH]c2ccccc2[nH+]1 ZINC000335233695 355094669 /nfs/dbraw/zinc/09/46/69/355094669.db2.gz RWLNQVPUMFCEMO-WDEREUQCSA-N 1 2 245.326 2.160 20 0 BEADLO C[C@@H](C1CC1)N(C)C(=O)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000335234828 355095342 /nfs/dbraw/zinc/09/53/42/355095342.db2.gz LSCHUVRZKAMZSI-GXSJLCMTSA-N 1 2 247.342 2.087 20 0 BEADLO C[C@H](c1cnn(C)c1)[N@H+](C)Cc1cncc(F)c1 ZINC000346969980 355174914 /nfs/dbraw/zinc/17/49/14/355174914.db2.gz QQWHCXXYVNXDQF-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO C[C@H](c1cnn(C)c1)[N@@H+](C)Cc1cncc(F)c1 ZINC000346969980 355174916 /nfs/dbraw/zinc/17/49/16/355174916.db2.gz QQWHCXXYVNXDQF-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO CC(C)[C@H]1C[C@H]1c1nc(Cc2c[nH+]cn2C)no1 ZINC000346927973 355178667 /nfs/dbraw/zinc/17/86/67/355178667.db2.gz DLGWBQFQXPDNKR-GHMZBOCLSA-N 1 2 246.314 2.153 20 0 BEADLO C[N@H+](Cc1ccon1)Cc1cccc2c1NCC2 ZINC000347013443 355204753 /nfs/dbraw/zinc/20/47/53/355204753.db2.gz WLOCQPAMXHIOMP-UHFFFAOYSA-N 1 2 243.310 2.275 20 0 BEADLO C[N@@H+](Cc1ccon1)Cc1cccc2c1NCC2 ZINC000347013443 355204757 /nfs/dbraw/zinc/20/47/57/355204757.db2.gz WLOCQPAMXHIOMP-UHFFFAOYSA-N 1 2 243.310 2.275 20 0 BEADLO CCCN(CC)c1cc(NC2CC2)[nH+]cn1 ZINC000413166500 191359931 /nfs/dbraw/zinc/35/99/31/191359931.db2.gz GPLOOHHTCABSJV-UHFFFAOYSA-N 1 2 220.320 2.287 20 0 BEADLO CCCN(CC)c1cc(NC2CC2)nc[nH+]1 ZINC000413166500 191359932 /nfs/dbraw/zinc/35/99/32/191359932.db2.gz GPLOOHHTCABSJV-UHFFFAOYSA-N 1 2 220.320 2.287 20 0 BEADLO Cc1ccc(CSC[C@@H](C)O)c(C)[nH+]1 ZINC000413011128 191339452 /nfs/dbraw/zinc/33/94/52/191339452.db2.gz CGCLUCGJAPVUJP-SECBINFHSA-N 1 2 211.330 2.312 20 0 BEADLO Cc1[nH+]c(C(C)C)ccc1CSCC(N)=O ZINC000413021351 191342911 /nfs/dbraw/zinc/34/29/11/191342911.db2.gz VYWRHXGYDSGABO-UHFFFAOYSA-N 1 2 238.356 2.232 20 0 BEADLO CC1(C)CCN(c2cc(NC3CC3)[nH+]cn2)C1 ZINC000413179723 191361277 /nfs/dbraw/zinc/36/12/77/191361277.db2.gz YNGBBWWYVGRSON-UHFFFAOYSA-N 1 2 232.331 2.287 20 0 BEADLO CC1(C)CCN(c2cc(NC3CC3)nc[nH+]2)C1 ZINC000413179723 191361280 /nfs/dbraw/zinc/36/12/80/191361280.db2.gz YNGBBWWYVGRSON-UHFFFAOYSA-N 1 2 232.331 2.287 20 0 BEADLO CC1(C)C[C@@H]1Nc1cc(NC2CC2)[nH+]cn1 ZINC000413072171 191350983 /nfs/dbraw/zinc/35/09/83/191350983.db2.gz MLJSCWXSHSVTFR-VIFPVBQESA-N 1 2 218.304 2.261 20 0 BEADLO CC1(C)C[C@@H]1Nc1cc(NC2CC2)nc[nH+]1 ZINC000413072171 191350985 /nfs/dbraw/zinc/35/09/85/191350985.db2.gz MLJSCWXSHSVTFR-VIFPVBQESA-N 1 2 218.304 2.261 20 0 BEADLO Cc1cc(N[C@H]2CCC[C@@H]3C[C@@H]32)nc[nH+]1 ZINC000413464986 191382940 /nfs/dbraw/zinc/38/29/40/191382940.db2.gz UEVPHBQUYSIIHW-VWYCJHECSA-N 1 2 203.289 2.386 20 0 BEADLO CC(C)c1nc(NC[C@H]2C[C@@H](C)O[C@@H]2C)cc[nH+]1 ZINC000413528449 191392819 /nfs/dbraw/zinc/39/28/19/191392819.db2.gz HBLRCFRQPUDDTQ-IJLUTSLNSA-N 1 2 249.358 2.247 20 0 BEADLO F[C@H]1CC[C@@H](Nc2cc(NC3CC3)[nH+]cn2)C1 ZINC000413290463 191368761 /nfs/dbraw/zinc/36/87/61/191368761.db2.gz AMJLSLORYFFLLM-WCBMZHEXSA-N 1 2 236.294 2.353 20 0 BEADLO F[C@H]1CC[C@@H](Nc2cc(NC3CC3)nc[nH+]2)C1 ZINC000413290463 191368764 /nfs/dbraw/zinc/36/87/64/191368764.db2.gz AMJLSLORYFFLLM-WCBMZHEXSA-N 1 2 236.294 2.353 20 0 BEADLO F[C@@H]1CC[C@H](Nc2cc(NC3CC3)[nH+]cn2)C1 ZINC000413290462 191369368 /nfs/dbraw/zinc/36/93/68/191369368.db2.gz AMJLSLORYFFLLM-SCZZXKLOSA-N 1 2 236.294 2.353 20 0 BEADLO F[C@@H]1CC[C@H](Nc2cc(NC3CC3)nc[nH+]2)C1 ZINC000413290462 191369371 /nfs/dbraw/zinc/36/93/71/191369371.db2.gz AMJLSLORYFFLLM-SCZZXKLOSA-N 1 2 236.294 2.353 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NCc1ncc(C)o1 ZINC000639247344 355276994 /nfs/dbraw/zinc/27/69/94/355276994.db2.gz JBFRZEVUMWHRBM-JTQLQIEISA-N 1 2 234.303 2.050 20 0 BEADLO CCOC1C[NH+](Cc2c(C)cccc2OC)C1 ZINC000639250244 355282305 /nfs/dbraw/zinc/28/23/05/355282305.db2.gz MJFFXCXYXODISQ-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1[C@@H](C)[C@@H]1C1CC1 ZINC000528464809 355334233 /nfs/dbraw/zinc/33/42/33/355334233.db2.gz GGPWGESEZIKUKE-ZWKOPEQDSA-N 1 2 230.311 2.043 20 0 BEADLO c1cc(C[N@@H+]2CCOC[C@H]2C2CCC2)sn1 ZINC000639284871 355386587 /nfs/dbraw/zinc/38/65/87/355386587.db2.gz DGLRVYXJUGCMJH-LBPRGKRZSA-N 1 2 238.356 2.144 20 0 BEADLO c1cc(C[N@H+]2CCOC[C@H]2C2CCC2)sn1 ZINC000639284871 355386590 /nfs/dbraw/zinc/38/65/90/355386590.db2.gz DGLRVYXJUGCMJH-LBPRGKRZSA-N 1 2 238.356 2.144 20 0 BEADLO Cc1ccc(CNc2ccc(C)[nH+]c2)nn1 ZINC000414382283 191503847 /nfs/dbraw/zinc/50/38/47/191503847.db2.gz RDYWGTFQEVNTQU-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO c1cc2c(s1)C[N@H+](Cc1ncccn1)CC2 ZINC000335776607 355402263 /nfs/dbraw/zinc/40/22/63/355402263.db2.gz IMXZZUPAGFNAQG-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1cc2c(s1)C[N@@H+](Cc1ncccn1)CC2 ZINC000335776607 355402264 /nfs/dbraw/zinc/40/22/64/355402264.db2.gz IMXZZUPAGFNAQG-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO Cc1nn(C)cc1[C@@H](C)[NH2+][C@H](C)c1ccon1 ZINC000349857040 355501424 /nfs/dbraw/zinc/50/14/24/355501424.db2.gz ITWWNASFYVXQIC-PSASIEDQSA-N 1 2 234.303 2.128 20 0 BEADLO CC(C)c1nc(C[N@@H+]2C[C@H](C)C[C@@H]2C)no1 ZINC000335805981 355476548 /nfs/dbraw/zinc/47/65/48/355476548.db2.gz JJUMMLOLOQDHHP-ZJUUUORDSA-N 1 2 223.320 2.423 20 0 BEADLO CC(C)c1nc(C[N@H+]2C[C@H](C)C[C@@H]2C)no1 ZINC000335805981 355476552 /nfs/dbraw/zinc/47/65/52/355476552.db2.gz JJUMMLOLOQDHHP-ZJUUUORDSA-N 1 2 223.320 2.423 20 0 BEADLO C[NH2+]Cc1noc(C2(c3ccc(F)cc3)CC2)n1 ZINC000349850527 355480086 /nfs/dbraw/zinc/48/00/86/355480086.db2.gz FPYHSBXUYNMJCL-UHFFFAOYSA-N 1 2 247.273 2.008 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@@H]3CCCC[C@H]32)n[nH]1 ZINC000335817436 355507786 /nfs/dbraw/zinc/50/77/86/355507786.db2.gz ITUTZXMERMZUDH-NWDGAFQWSA-N 1 2 234.347 2.268 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1nc(-c2ccco2)no1 ZINC000335817450 355507976 /nfs/dbraw/zinc/50/79/76/355507976.db2.gz JYJUOCMHPOXKKQ-IUCAKERBSA-N 1 2 233.271 2.312 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2C[C@@H]2c2sccc2C)n1 ZINC000349873122 355513937 /nfs/dbraw/zinc/51/39/37/355513937.db2.gz DDYALNFOEJLPOJ-DTWKUNHWSA-N 1 2 249.339 2.430 20 0 BEADLO CC(C)[C@H]1CN(c2cc[nH+]c(C3CC3)n2)CCO1 ZINC000349884860 355518585 /nfs/dbraw/zinc/51/85/85/355518585.db2.gz XTBUDSRDNAOAMF-GFCCVEGCSA-N 1 2 247.342 2.215 20 0 BEADLO C[NH2+]Cc1noc(C[C@H](C)c2ccccc2F)n1 ZINC000349899037 355522481 /nfs/dbraw/zinc/52/24/81/355522481.db2.gz VHVHPNJEIYROKS-VIFPVBQESA-N 1 2 249.289 2.274 20 0 BEADLO C[NH2+]Cc1noc([C@H](C)Oc2cccc(C)c2)n1 ZINC000349916158 355525708 /nfs/dbraw/zinc/52/57/08/355525708.db2.gz WSGNPAIZTKMFKR-JTQLQIEISA-N 1 2 247.298 2.237 20 0 BEADLO C[NH2+]Cc1noc(C2(c3ccccc3F)CC2)n1 ZINC000349918645 355526447 /nfs/dbraw/zinc/52/64/47/355526447.db2.gz DPQUQZOYJIAASL-UHFFFAOYSA-N 1 2 247.273 2.008 20 0 BEADLO C[NH2+]Cc1noc([C@@H](C)CC2CCCC2)n1 ZINC000349917367 355526667 /nfs/dbraw/zinc/52/66/67/355526667.db2.gz ZQFWUVXGJHFDIF-VIFPVBQESA-N 1 2 223.320 2.473 20 0 BEADLO C[NH2+]Cc1noc(C[C@H](C)c2ccccc2C)n1 ZINC000349919661 355527772 /nfs/dbraw/zinc/52/77/72/355527772.db2.gz HWJKHGRYQSZVFE-NSHDSACASA-N 1 2 245.326 2.444 20 0 BEADLO CCc1cc[nH+]cc1N[C@H](COC)C1CC1 ZINC000639297204 355602336 /nfs/dbraw/zinc/60/23/36/355602336.db2.gz ZZYVLINGNPZWAQ-CYBMUJFWSA-N 1 2 220.316 2.481 20 0 BEADLO CCCC[N@@H+]1CC(=O)N[C@@H]1[C@H]1CCC[C@H](C)C1 ZINC000350126922 355609905 /nfs/dbraw/zinc/60/99/05/355609905.db2.gz NWUPCIZKYKKRPU-OBJOEFQTSA-N 1 2 238.375 2.371 20 0 BEADLO CCCC[N@H+]1CC(=O)N[C@@H]1[C@H]1CCC[C@H](C)C1 ZINC000350126922 355609910 /nfs/dbraw/zinc/60/99/10/355609910.db2.gz NWUPCIZKYKKRPU-OBJOEFQTSA-N 1 2 238.375 2.371 20 0 BEADLO CCCC[N@@H+]1CC(=O)N[C@@H]1[C@H]1CCC[C@@H](C)C1 ZINC000350126920 355609919 /nfs/dbraw/zinc/60/99/19/355609919.db2.gz NWUPCIZKYKKRPU-DYEKYZERSA-N 1 2 238.375 2.371 20 0 BEADLO CCCC[N@H+]1CC(=O)N[C@@H]1[C@H]1CCC[C@@H](C)C1 ZINC000350126920 355609923 /nfs/dbraw/zinc/60/99/23/355609923.db2.gz NWUPCIZKYKKRPU-DYEKYZERSA-N 1 2 238.375 2.371 20 0 BEADLO CC(C)C[N@@H+]1CC(=O)N[C@@H]1[C@@H]1CCC[C@H](C)C1 ZINC000350129105 355610792 /nfs/dbraw/zinc/61/07/92/355610792.db2.gz YUUPCZMFRNTIAP-SCRDCRAPSA-N 1 2 238.375 2.227 20 0 BEADLO CC(C)C[N@H+]1CC(=O)N[C@@H]1[C@@H]1CCC[C@H](C)C1 ZINC000350129105 355610796 /nfs/dbraw/zinc/61/07/96/355610796.db2.gz YUUPCZMFRNTIAP-SCRDCRAPSA-N 1 2 238.375 2.227 20 0 BEADLO C[C@H](O)CN(C)c1[nH+]ccc2ccc(F)cc21 ZINC000335836039 355563989 /nfs/dbraw/zinc/56/39/89/355563989.db2.gz BXVOXGVVLCXXFA-VIFPVBQESA-N 1 2 234.274 2.191 20 0 BEADLO Cc1cc(C)c(NC(=O)C2=CCOCC2)c(C)[nH+]1 ZINC000335838381 355567539 /nfs/dbraw/zinc/56/75/39/355567539.db2.gz CUWCVJRDPHDZKP-UHFFFAOYSA-N 1 2 246.310 2.292 20 0 BEADLO NC(=O)C[N@@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000336546190 181202465 /nfs/dbraw/zinc/20/24/65/181202465.db2.gz KXOUPDCCBZWYQM-CQSZACIVSA-N 1 2 246.310 2.043 20 0 BEADLO NC(=O)C[N@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000336546190 181202467 /nfs/dbraw/zinc/20/24/67/181202467.db2.gz KXOUPDCCBZWYQM-CQSZACIVSA-N 1 2 246.310 2.043 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ccnc(C)n2)o1 ZINC000350239193 355654963 /nfs/dbraw/zinc/65/49/63/355654963.db2.gz IGOPRVYETRJRGF-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ccnc(C)n2)o1 ZINC000350239193 355654967 /nfs/dbraw/zinc/65/49/67/355654967.db2.gz IGOPRVYETRJRGF-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CCC[C@H](C)C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000582186485 355655830 /nfs/dbraw/zinc/65/58/30/355655830.db2.gz CSOOEVBJSQDZAZ-VIFPVBQESA-N 1 2 223.320 2.197 20 0 BEADLO NC(=O)C[N@@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000336546189 181203036 /nfs/dbraw/zinc/20/30/36/181203036.db2.gz KXOUPDCCBZWYQM-AWEZNQCLSA-N 1 2 246.310 2.043 20 0 BEADLO NC(=O)C[N@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000336546189 181203038 /nfs/dbraw/zinc/20/30/38/181203038.db2.gz KXOUPDCCBZWYQM-AWEZNQCLSA-N 1 2 246.310 2.043 20 0 BEADLO CCCC1(C(=O)NC[C@H](C)Cn2cc[nH+]c2)CC1 ZINC000350181546 355621406 /nfs/dbraw/zinc/62/14/06/355621406.db2.gz PTGPLVAKLHEPIG-LBPRGKRZSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@@H](CC1CCOCC1)C[NH+]1CC(F)C1 ZINC000350392040 355694519 /nfs/dbraw/zinc/69/45/19/355694519.db2.gz MKZPOZKDZOGJTA-JTQLQIEISA-N 1 2 215.312 2.093 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2ccnc(C)n2)s1 ZINC000350512988 355715363 /nfs/dbraw/zinc/71/53/63/355715363.db2.gz JNUMHRVLTLRBIW-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2ccnc(C)n2)s1 ZINC000350512988 355715367 /nfs/dbraw/zinc/71/53/67/355715367.db2.gz JNUMHRVLTLRBIW-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO CC(C)C1(C[N@@H+]2Cc3cnn(C)c3C2)CC1 ZINC000639321887 355722882 /nfs/dbraw/zinc/72/28/82/355722882.db2.gz NGJKYWPPPOCZMW-UHFFFAOYSA-N 1 2 219.332 2.172 20 0 BEADLO CC(C)C1(C[N@H+]2Cc3cnn(C)c3C2)CC1 ZINC000639321887 355722885 /nfs/dbraw/zinc/72/28/85/355722885.db2.gz NGJKYWPPPOCZMW-UHFFFAOYSA-N 1 2 219.332 2.172 20 0 BEADLO CC[C@H]1CCCN(C(=O)C(C)(C)c2c[nH+]c[nH]2)C1 ZINC000335889711 355681233 /nfs/dbraw/zinc/68/12/33/355681233.db2.gz OTLFTGIEFIVTDA-NSHDSACASA-N 1 2 249.358 2.336 20 0 BEADLO CO[C@H]1CC[C@H](Nc2[nH+]c(C)nc3[nH]ccc32)C1 ZINC000350683742 355740546 /nfs/dbraw/zinc/74/05/46/355740546.db2.gz HHKHEITVCMHWFH-UWVGGRQHSA-N 1 2 246.314 2.246 20 0 BEADLO CO[C@H]1CC[C@@H](Nc2[nH+]c(C)nc3[nH]ccc32)C1 ZINC000350683744 355740833 /nfs/dbraw/zinc/74/08/33/355740833.db2.gz HHKHEITVCMHWFH-ZJUUUORDSA-N 1 2 246.314 2.246 20 0 BEADLO COc1ccc(CC[N@H+](C)CC(F)F)cc1 ZINC000350717730 355742985 /nfs/dbraw/zinc/74/29/85/355742985.db2.gz AXMWBGFIGIITSU-UHFFFAOYSA-N 1 2 229.270 2.435 20 0 BEADLO COc1ccc(CC[N@@H+](C)CC(F)F)cc1 ZINC000350717730 355742987 /nfs/dbraw/zinc/74/29/87/355742987.db2.gz AXMWBGFIGIITSU-UHFFFAOYSA-N 1 2 229.270 2.435 20 0 BEADLO CO[C@@H]1CC[C@H](Nc2cc[nH+]c3ccncc23)C1 ZINC000350700579 355743382 /nfs/dbraw/zinc/74/33/82/355743382.db2.gz KBKTUXZPIUNCHN-WDEREUQCSA-N 1 2 243.310 2.031 20 0 BEADLO CC[C@](C)(C[N@H+](C)Cc1nnc(C)s1)OC ZINC000639332412 355759013 /nfs/dbraw/zinc/75/90/13/355759013.db2.gz IZJABKSQHGCMDQ-LLVKDONJSA-N 1 2 243.376 2.093 20 0 BEADLO CC[C@](C)(C[N@@H+](C)Cc1nnc(C)s1)OC ZINC000639332412 355759014 /nfs/dbraw/zinc/75/90/14/355759014.db2.gz IZJABKSQHGCMDQ-LLVKDONJSA-N 1 2 243.376 2.093 20 0 BEADLO C/C=C\CNC(=O)Nc1ccc(C)[nH+]c1C ZINC000626432719 355765994 /nfs/dbraw/zinc/76/59/94/355765994.db2.gz AXXHXWKGCMZIOE-PLNGDYQASA-N 1 2 219.288 2.396 20 0 BEADLO CCC(F)(F)C[NH2+]Cc1ccc(CO)cc1 ZINC000639349868 355796336 /nfs/dbraw/zinc/79/63/36/355796336.db2.gz SMDRKQCGRXEICM-UHFFFAOYSA-N 1 2 229.270 2.314 20 0 BEADLO CCc1cnc(C[N@H+]2C[C@@H](C)OC[C@H]2CC)o1 ZINC000608492514 355809154 /nfs/dbraw/zinc/80/91/54/355809154.db2.gz ITVVOQNANVLJSP-GHMZBOCLSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1cnc(C[N@@H+]2C[C@@H](C)OC[C@H]2CC)o1 ZINC000608492514 355809155 /nfs/dbraw/zinc/80/91/55/355809155.db2.gz ITVVOQNANVLJSP-GHMZBOCLSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1cnc(C[N@H+]2C[C@H](C)OC[C@@H]2CC)o1 ZINC000608492516 355809183 /nfs/dbraw/zinc/80/91/83/355809183.db2.gz ITVVOQNANVLJSP-QWRGUYRKSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1cnc(C[N@@H+]2C[C@H](C)OC[C@@H]2CC)o1 ZINC000608492516 355809184 /nfs/dbraw/zinc/80/91/84/355809184.db2.gz ITVVOQNANVLJSP-QWRGUYRKSA-N 1 2 238.331 2.236 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CC(c2ccccc2)C1 ZINC000639361815 355816207 /nfs/dbraw/zinc/81/62/07/355816207.db2.gz SVELQMOMJMVCFY-UHFFFAOYSA-N 1 2 227.311 2.318 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@H](n3ccnc3)C2)o1 ZINC000608495587 355821550 /nfs/dbraw/zinc/82/15/50/355821550.db2.gz SODUGCPERSCXLD-LBPRGKRZSA-N 1 2 246.314 2.017 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@H](n3ccnc3)C2)o1 ZINC000608495587 355821552 /nfs/dbraw/zinc/82/15/52/355821552.db2.gz SODUGCPERSCXLD-LBPRGKRZSA-N 1 2 246.314 2.017 20 0 BEADLO FC(F)C[NH+]1CCC(OCC2CC2)CC1 ZINC000608512371 355833375 /nfs/dbraw/zinc/83/33/75/355833375.db2.gz BLGFBCAOGQBIRQ-UHFFFAOYSA-N 1 2 219.275 2.143 20 0 BEADLO C[C@H](Nc1c[nH+]cc(N(C)C)c1)[C@@H]1CCCO1 ZINC000639364943 355837315 /nfs/dbraw/zinc/83/73/15/355837315.db2.gz KOPUDKQWBOLLHX-GWCFXTLKSA-N 1 2 235.331 2.127 20 0 BEADLO CCOC1CC(CNc2c[nH+]cc(N(C)C)c2)C1 ZINC000639364921 355837873 /nfs/dbraw/zinc/83/78/73/355837873.db2.gz KEPBVDJYWQUHHI-UHFFFAOYSA-N 1 2 249.358 2.375 20 0 BEADLO CC(C)CN(C(=O)CCCn1cc[nH+]c1)C1CC1 ZINC000623252652 355839309 /nfs/dbraw/zinc/83/93/09/355839309.db2.gz KXECSBXIOSDBSZ-UHFFFAOYSA-N 1 2 249.358 2.310 20 0 BEADLO C[C@H]1CSC[C@@H]1Nc1c[nH+]cc(N(C)C)c1 ZINC000639365876 355841103 /nfs/dbraw/zinc/84/11/03/355841103.db2.gz SJUYESWYSYLHDA-CABZTGNLSA-N 1 2 237.372 2.311 20 0 BEADLO FC(F)[C@H]1C[C@@H]1Nc1cc[nH+]c2ccncc12 ZINC000336026233 134057358 /nfs/dbraw/zinc/05/73/58/134057358.db2.gz ZJXZOUQPOXTMIE-CPCISQLKSA-N 1 2 235.237 2.117 20 0 BEADLO COC(=O)[C@H]([NH2+]Cc1csc(C)c1)C(C)C ZINC000380538250 355863420 /nfs/dbraw/zinc/86/34/20/355863420.db2.gz GKWTVFVGMAFFCF-LLVKDONJSA-N 1 2 241.356 2.344 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2conc2CC)CCO1 ZINC000351623971 356033246 /nfs/dbraw/zinc/03/32/46/356033246.db2.gz LHKHROHXEJTIRR-GFCCVEGCSA-N 1 2 238.331 2.238 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2conc2CC)CCO1 ZINC000351623971 356033249 /nfs/dbraw/zinc/03/32/49/356033249.db2.gz LHKHROHXEJTIRR-GFCCVEGCSA-N 1 2 238.331 2.238 20 0 BEADLO C/C=C\C[C@@H](CO)Nc1cc(C)[nH+]c(C(C)C)n1 ZINC000351543319 356012985 /nfs/dbraw/zinc/01/29/85/356012985.db2.gz JGMDXTOBFVWKAH-FJOGCWAESA-N 1 2 249.358 2.069 20 0 BEADLO Cc1cnc(N2CCC(n3cc[nH+]c3)CC2)s1 ZINC000302098788 191953463 /nfs/dbraw/zinc/95/34/63/191953463.db2.gz KIBQCHRCBNCIAR-UHFFFAOYSA-N 1 2 248.355 2.490 20 0 BEADLO Cc1cnn(CC[N@H+]2CC[C@H](C)C(F)(F)C2)c1 ZINC000335911324 356123364 /nfs/dbraw/zinc/12/33/64/356123364.db2.gz YXEYQAXNYFXUFD-NSHDSACASA-N 1 2 243.301 2.169 20 0 BEADLO Cc1cnn(CC[N@@H+]2CC[C@H](C)C(F)(F)C2)c1 ZINC000335911324 356123367 /nfs/dbraw/zinc/12/33/67/356123367.db2.gz YXEYQAXNYFXUFD-NSHDSACASA-N 1 2 243.301 2.169 20 0 BEADLO COc1ccc(C[N@@H+]2CCOCC23CC3)cc1 ZINC000335911322 356123765 /nfs/dbraw/zinc/12/37/65/356123765.db2.gz XSIPFOQRZGEJQD-UHFFFAOYSA-N 1 2 233.311 2.060 20 0 BEADLO COc1ccc(C[N@H+]2CCOCC23CC3)cc1 ZINC000335911322 356123769 /nfs/dbraw/zinc/12/37/69/356123769.db2.gz XSIPFOQRZGEJQD-UHFFFAOYSA-N 1 2 233.311 2.060 20 0 BEADLO CCC(C)(C)[C@H](C)NC(=O)CCc1c[nH+]c[nH]1 ZINC000617568404 356123799 /nfs/dbraw/zinc/12/37/99/356123799.db2.gz BURNGDHLSXPOPG-JTQLQIEISA-N 1 2 237.347 2.283 20 0 BEADLO CCC(C)(C)[C@H](C)NC(=O)CCc1c[nH]c[nH+]1 ZINC000617568404 356123802 /nfs/dbraw/zinc/12/38/02/356123802.db2.gz BURNGDHLSXPOPG-JTQLQIEISA-N 1 2 237.347 2.283 20 0 BEADLO FC(F)(F)CN1CCC(c2c[nH]c[nH+]2)CC1 ZINC000335916897 356158725 /nfs/dbraw/zinc/15/87/25/356158725.db2.gz IDYJZGRWYDBQCO-UHFFFAOYSA-N 1 2 233.237 2.151 20 0 BEADLO FC(F)(F)CN1CCC(c2c[nH+]c[nH]2)CC1 ZINC000335916897 356158729 /nfs/dbraw/zinc/15/87/29/356158729.db2.gz IDYJZGRWYDBQCO-UHFFFAOYSA-N 1 2 233.237 2.151 20 0 BEADLO c1ccc2[nH+]c(N3CCO[C@@H](C4CC4)C3)[nH]c2c1 ZINC000336089081 134077380 /nfs/dbraw/zinc/07/73/80/134077380.db2.gz USLAWUNOYCDKAE-CYBMUJFWSA-N 1 2 243.310 2.178 20 0 BEADLO CCC(F)(F)C[NH+]1CCC(OC)CC1 ZINC000639433735 356211225 /nfs/dbraw/zinc/21/12/25/356211225.db2.gz WELLXFRMVCNUMO-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO CCCC(CCC)C(=O)N[C@@H]1Cc2c[nH+]cn2C1 ZINC000623263144 356198361 /nfs/dbraw/zinc/19/83/61/356198361.db2.gz DGOKOOLLONXNAM-GFCCVEGCSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1occc1C(=O)N[C@@H](c1[nH]cc[nH+]1)C(C)C ZINC000352136305 134081617 /nfs/dbraw/zinc/08/16/17/134081617.db2.gz XUJKSMAQOYJYPJ-LLVKDONJSA-N 1 2 247.298 2.438 20 0 BEADLO C[C@H]1CC(CNC(=O)Cn2cc[nH+]c2)C[C@H](C)C1 ZINC000617667312 356268232 /nfs/dbraw/zinc/26/82/32/356268232.db2.gz ZWPDEHDHJRURHS-VXGBXAGGSA-N 1 2 249.358 2.072 20 0 BEADLO Cc1nc2[nH]ccc2c(NC2CC(F)(F)C2)[nH+]1 ZINC000336115719 134088128 /nfs/dbraw/zinc/08/81/28/134088128.db2.gz XGXBICDYXSIKHQ-UHFFFAOYSA-N 1 2 238.241 2.476 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCC[C@@H](CCO)C1 ZINC000639476833 356272047 /nfs/dbraw/zinc/27/20/47/356272047.db2.gz LYNDGXWTGHUUHF-JTQLQIEISA-N 1 2 221.291 2.126 20 0 BEADLO CCC(F)(F)C[N@H+]1CCC[C@@H](CCO)C1 ZINC000639476833 356272050 /nfs/dbraw/zinc/27/20/50/356272050.db2.gz LYNDGXWTGHUUHF-JTQLQIEISA-N 1 2 221.291 2.126 20 0 BEADLO CC[C@@H](C)CCNC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000617639433 356246135 /nfs/dbraw/zinc/24/61/35/356246135.db2.gz FWCFIBMUQMNMSF-SNVBAGLBSA-N 1 2 237.347 2.240 20 0 BEADLO CCC(F)(F)C[N@H+](CCCCO)C1CC1 ZINC000639495614 356321477 /nfs/dbraw/zinc/32/14/77/356321477.db2.gz SBAYULUFOXMIOK-UHFFFAOYSA-N 1 2 221.291 2.269 20 0 BEADLO CCC(F)(F)C[N@@H+](CCCCO)C1CC1 ZINC000639495614 356321479 /nfs/dbraw/zinc/32/14/79/356321479.db2.gz SBAYULUFOXMIOK-UHFFFAOYSA-N 1 2 221.291 2.269 20 0 BEADLO OC1(CCCNc2cccc[nH+]2)CCC1 ZINC000420634508 192252469 /nfs/dbraw/zinc/25/24/69/192252469.db2.gz LLVVKAXUFZQPSD-UHFFFAOYSA-N 1 2 206.289 2.189 20 0 BEADLO COc1cccc(F)c1[C@@H](C)[NH2+]CC(C)=O ZINC000639566535 356484954 /nfs/dbraw/zinc/48/49/54/356484954.db2.gz SYOLONCPJFHLBV-SECBINFHSA-N 1 2 225.263 2.074 20 0 BEADLO Cc1cc(CNC(=O)NCC2(C)CC2)cc(C)[nH+]1 ZINC000420802630 192261443 /nfs/dbraw/zinc/26/14/43/192261443.db2.gz LKYSCVFRHPKXIZ-UHFFFAOYSA-N 1 2 247.342 2.298 20 0 BEADLO CC[C@H](C)NC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000420775821 192263010 /nfs/dbraw/zinc/26/30/10/192263010.db2.gz URPXKMPCSZOTHS-VIFPVBQESA-N 1 2 235.331 2.296 20 0 BEADLO CC(C)=CCNC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000420849692 192263509 /nfs/dbraw/zinc/26/35/09/192263509.db2.gz ZBHGBCJGNIHVBA-UHFFFAOYSA-N 1 2 247.342 2.464 20 0 BEADLO CCC(F)(F)C[NH2+][C@@H](CO)c1ccc(F)cc1 ZINC000639594530 356513618 /nfs/dbraw/zinc/51/36/18/356513618.db2.gz GILWQFZHRCNYJS-NSHDSACASA-N 1 2 247.260 2.494 20 0 BEADLO CCC(F)(F)C[N@H+](C)[C@H](CO)CC(C)C ZINC000639594647 356513733 /nfs/dbraw/zinc/51/37/33/356513733.db2.gz VUTZAUXYTFXNFH-JTQLQIEISA-N 1 2 223.307 2.371 20 0 BEADLO CCC(F)(F)C[N@@H+](C)[C@H](CO)CC(C)C ZINC000639594647 356513736 /nfs/dbraw/zinc/51/37/36/356513736.db2.gz VUTZAUXYTFXNFH-JTQLQIEISA-N 1 2 223.307 2.371 20 0 BEADLO CC/C=C\CNC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000420845276 192266761 /nfs/dbraw/zinc/26/67/61/192266761.db2.gz OIIRMWVRFQLKSK-WAYWQWQTSA-N 1 2 247.342 2.464 20 0 BEADLO CC[C@@H]1C[NH+]([C@@H](C)c2cnccn2)C[C@@H](CC)O1 ZINC000420953271 192277273 /nfs/dbraw/zinc/27/72/73/192277273.db2.gz IYVBBIQCXFXXRV-YNEHKIRRSA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@H]1C[NH+](Cc2ccon2)C[C@H](CC)O1 ZINC000420952061 192277790 /nfs/dbraw/zinc/27/77/90/192277790.db2.gz HWRGXGQHLDMCCP-RYUDHWBXSA-N 1 2 224.304 2.064 20 0 BEADLO CCC(F)(F)C[N@H+](C)CCCCCO ZINC000639615862 356533307 /nfs/dbraw/zinc/53/33/07/356533307.db2.gz SRNOKYBLSZUQMU-UHFFFAOYSA-N 1 2 209.280 2.126 20 0 BEADLO CCC(F)(F)C[N@@H+](C)CCCCCO ZINC000639615862 356533310 /nfs/dbraw/zinc/53/33/10/356533310.db2.gz SRNOKYBLSZUQMU-UHFFFAOYSA-N 1 2 209.280 2.126 20 0 BEADLO CC(=O)C[N@@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC000639630819 356545964 /nfs/dbraw/zinc/54/59/64/356545964.db2.gz ZXPFRYDLXVXKQU-ZDUSSCGKSA-N 1 2 221.275 2.146 20 0 BEADLO CC(=O)C[N@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC000639630819 356545968 /nfs/dbraw/zinc/54/59/68/356545968.db2.gz ZXPFRYDLXVXKQU-ZDUSSCGKSA-N 1 2 221.275 2.146 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1nc(CC2CC2)no1 ZINC000639618842 356536184 /nfs/dbraw/zinc/53/61/84/356536184.db2.gz RYJJNCLPHMCIKB-IUCAKERBSA-N 1 2 221.304 2.005 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2noc(C(C)(C)C)n2)C1 ZINC000336191613 134123909 /nfs/dbraw/zinc/12/39/09/134123909.db2.gz UAFIUMWIBQYKLI-SECBINFHSA-N 1 2 223.320 2.209 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2noc(C(C)(C)C)n2)C1 ZINC000336191613 134123910 /nfs/dbraw/zinc/12/39/10/134123910.db2.gz UAFIUMWIBQYKLI-SECBINFHSA-N 1 2 223.320 2.209 20 0 BEADLO Fc1ccc(F)c(C[N@@H+]2CC[C@@]23CCOC3)c1 ZINC000421014189 192302299 /nfs/dbraw/zinc/30/22/99/192302299.db2.gz HCHGFZRVTSXFRQ-ZDUSSCGKSA-N 1 2 239.265 2.330 20 0 BEADLO Fc1ccc(F)c(C[N@H+]2CC[C@@]23CCOC3)c1 ZINC000421014189 192302302 /nfs/dbraw/zinc/30/23/02/192302302.db2.gz HCHGFZRVTSXFRQ-ZDUSSCGKSA-N 1 2 239.265 2.330 20 0 BEADLO CCCC(C)(C)C(=O)N[C@@H]1CCn2c[nH+]cc2C1 ZINC000623297767 356550799 /nfs/dbraw/zinc/55/07/99/356550799.db2.gz MSJPDOBDHCHIFI-LLVKDONJSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1cc(N[C@@H](C)c2ccon2)nc(C(C)C)[nH+]1 ZINC000353269464 134129544 /nfs/dbraw/zinc/12/95/44/134129544.db2.gz UEGUBJZGJMHSAC-JTQLQIEISA-N 1 2 246.314 2.491 20 0 BEADLO Fc1cccc(C[N@@H+]2CC[C@@]23CCOC3)c1F ZINC000421032620 192308636 /nfs/dbraw/zinc/30/86/36/192308636.db2.gz MAKVNKBZMMHFHF-ZDUSSCGKSA-N 1 2 239.265 2.330 20 0 BEADLO Fc1cccc(C[N@H+]2CC[C@@]23CCOC3)c1F ZINC000421032620 192308637 /nfs/dbraw/zinc/30/86/37/192308637.db2.gz MAKVNKBZMMHFHF-ZDUSSCGKSA-N 1 2 239.265 2.330 20 0 BEADLO C[C@H](c1csnn1)[N@@H+]1CCSC(C)(C)C1 ZINC000336201540 134130749 /nfs/dbraw/zinc/13/07/49/134130749.db2.gz VQFAQXBECBHWIA-MRVPVSSYSA-N 1 2 243.401 2.427 20 0 BEADLO C[C@H](c1csnn1)[N@H+]1CCSC(C)(C)C1 ZINC000336201540 134130750 /nfs/dbraw/zinc/13/07/50/134130750.db2.gz VQFAQXBECBHWIA-MRVPVSSYSA-N 1 2 243.401 2.427 20 0 BEADLO CC[N@H+](CC(F)(F)CC)[C@H]1CCOC1 ZINC000639651093 356561880 /nfs/dbraw/zinc/56/18/80/356561880.db2.gz NLYIFKSSIYPCJC-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CC[N@@H+](CC(F)(F)CC)[C@H]1CCOC1 ZINC000639651093 356561882 /nfs/dbraw/zinc/56/18/82/356561882.db2.gz NLYIFKSSIYPCJC-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1C[C@H]1CC ZINC000449893512 202049614 /nfs/dbraw/zinc/04/96/14/202049614.db2.gz YCYUVJGZFUQQOX-MWLCHTKSSA-N 1 2 218.300 2.051 20 0 BEADLO C[C@H]1COC(C)(C)C[N@@H+]1Cc1ccncc1F ZINC000336207176 134132601 /nfs/dbraw/zinc/13/26/01/134132601.db2.gz ZOMGQJNKOWXMKL-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H]1COC(C)(C)C[N@H+]1Cc1ccncc1F ZINC000336207176 134132602 /nfs/dbraw/zinc/13/26/02/134132602.db2.gz ZOMGQJNKOWXMKL-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO O[C@H]1C[C@@H](CSCc2cn3ccccc3[nH+]2)C1 ZINC000421230228 192317110 /nfs/dbraw/zinc/31/71/10/192317110.db2.gz VDORWMDFFKNZLQ-KLPPZKSPSA-N 1 2 248.351 2.338 20 0 BEADLO COc1ccc[nH+]c1N1C[C@@H](C)S[C@H](C)C1 ZINC000624003452 363496894 /nfs/dbraw/zinc/49/68/94/363496894.db2.gz ZMMTZTOYTIBNSD-NXEZZACHSA-N 1 2 238.356 2.420 20 0 BEADLO CCC(F)(F)C[N@@H+]1CC(C)(C)[C@@H]2COC[C@@H]21 ZINC000639669909 356581843 /nfs/dbraw/zinc/58/18/43/356581843.db2.gz CSOWZPWSXMFOGB-ZJUUUORDSA-N 1 2 233.302 2.389 20 0 BEADLO CCC(F)(F)C[N@H+]1CC(C)(C)[C@@H]2COC[C@@H]21 ZINC000639669909 356581845 /nfs/dbraw/zinc/58/18/45/356581845.db2.gz CSOWZPWSXMFOGB-ZJUUUORDSA-N 1 2 233.302 2.389 20 0 BEADLO CCC(CC)CC(=O)N[C@H]1CCn2c[nH+]cc2C1 ZINC000623307690 356612251 /nfs/dbraw/zinc/61/22/51/356612251.db2.gz MTPMMTMCGFZJLI-LBPRGKRZSA-N 1 2 249.358 2.140 20 0 BEADLO CC[C@@H](NC(=O)[C@@H]1CCC1(C)C)c1[nH]cc[nH+]1 ZINC000613579215 363521744 /nfs/dbraw/zinc/52/17/44/363521744.db2.gz JCFARSKFPOPGQC-VHSXEESVSA-N 1 2 235.331 2.413 20 0 BEADLO CC[N@H+](Cc1nnc(C2CC2)s1)C1CC1 ZINC000450252950 202108805 /nfs/dbraw/zinc/10/88/05/202108805.db2.gz BFISMVKXQCMPFN-UHFFFAOYSA-N 1 2 223.345 2.400 20 0 BEADLO CC[N@@H+](Cc1nnc(C2CC2)s1)C1CC1 ZINC000450252950 202108808 /nfs/dbraw/zinc/10/88/08/202108808.db2.gz BFISMVKXQCMPFN-UHFFFAOYSA-N 1 2 223.345 2.400 20 0 BEADLO C[C@H](c1csnn1)[N@H+](C)C[C@@H]1CCCCO1 ZINC000450286144 202119225 /nfs/dbraw/zinc/11/92/25/202119225.db2.gz NGPPUBYXWVFDOU-ZJUUUORDSA-N 1 2 241.360 2.100 20 0 BEADLO C[C@H](c1csnn1)[N@@H+](C)C[C@@H]1CCCCO1 ZINC000450286144 202119229 /nfs/dbraw/zinc/11/92/29/202119229.db2.gz NGPPUBYXWVFDOU-ZJUUUORDSA-N 1 2 241.360 2.100 20 0 BEADLO CC1(C)[C@@H](CNc2cc(CO)cc[nH+]2)C1(F)F ZINC000630094348 363536866 /nfs/dbraw/zinc/53/68/66/363536866.db2.gz GJRQRFWIFBEJMN-SECBINFHSA-N 1 2 242.269 2.277 20 0 BEADLO CCC[C@@H](C)[C@H](CO)Nc1cccc[nH+]1 ZINC000578136525 366311121 /nfs/dbraw/zinc/31/11/21/366311121.db2.gz RJEUPSXJXXMCQC-MNOVXSKESA-N 1 2 208.305 2.291 20 0 BEADLO Cc1nc(N[C@@H](C)c2nccs2)cc[nH+]1 ZINC000070634731 325019338 /nfs/dbraw/zinc/01/93/38/325019338.db2.gz RBPUWKRSDSVZLO-ZETCQYMHSA-N 1 2 220.301 2.415 20 0 BEADLO C=Cn1cc(C[NH2+][C@H](C)C(C)(F)F)cn1 ZINC000389473573 356681400 /nfs/dbraw/zinc/68/14/00/356681400.db2.gz VQSSGKSRMYKCMZ-MRVPVSSYSA-N 1 2 215.247 2.117 20 0 BEADLO C[C@H]([NH2+][C@@H](C)C(C)(F)F)c1cnn(C)c1 ZINC000389474251 356682025 /nfs/dbraw/zinc/68/20/25/356682025.db2.gz WPCSBFKLLLVUPC-YUMQZZPRSA-N 1 2 217.263 2.114 20 0 BEADLO O=S1CC[NH+](CC/C=C/c2ccccc2)CC1 ZINC000450394315 202151171 /nfs/dbraw/zinc/15/11/71/202151171.db2.gz SGPKSZZCWVOSCL-XBXARRHUSA-N 1 2 249.379 2.154 20 0 BEADLO c1snnc1C[N@H+](C1CC1)C1CCCC1 ZINC000130224990 325026333 /nfs/dbraw/zinc/02/63/33/325026333.db2.gz ACRCRWKPCFBYQP-UHFFFAOYSA-N 1 2 223.345 2.445 20 0 BEADLO c1snnc1C[N@@H+](C1CC1)C1CCCC1 ZINC000130224990 325026335 /nfs/dbraw/zinc/02/63/35/325026335.db2.gz ACRCRWKPCFBYQP-UHFFFAOYSA-N 1 2 223.345 2.445 20 0 BEADLO Cc1nocc1C[N@H+](C)Cc1ccns1 ZINC000639808639 356778444 /nfs/dbraw/zinc/77/84/44/356778444.db2.gz OCHQNZBTFBZAIS-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO Cc1nocc1C[N@@H+](C)Cc1ccns1 ZINC000639808639 356778448 /nfs/dbraw/zinc/77/84/48/356778448.db2.gz OCHQNZBTFBZAIS-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO CC(=O)C[N@@H+]1CC[C@H]1c1ccc(F)cc1 ZINC000639801063 356764723 /nfs/dbraw/zinc/76/47/23/356764723.db2.gz OXFFXDJXDKJMSH-LBPRGKRZSA-N 1 2 207.248 2.162 20 0 BEADLO CC(=O)C[N@H+]1CC[C@H]1c1ccc(F)cc1 ZINC000639801063 356764724 /nfs/dbraw/zinc/76/47/24/356764724.db2.gz OXFFXDJXDKJMSH-LBPRGKRZSA-N 1 2 207.248 2.162 20 0 BEADLO CCCc1ccc(C[N@@H+]2CCO[C@H](OC)C2)cc1 ZINC000639840071 356831977 /nfs/dbraw/zinc/83/19/77/356831977.db2.gz VKMDUGGOCWBBFK-HNNXBMFYSA-N 1 2 249.354 2.444 20 0 BEADLO CCCc1ccc(C[N@H+]2CCO[C@H](OC)C2)cc1 ZINC000639840071 356831979 /nfs/dbraw/zinc/83/19/79/356831979.db2.gz VKMDUGGOCWBBFK-HNNXBMFYSA-N 1 2 249.354 2.444 20 0 BEADLO CC[C@@H]1CCCC[C@H]1C(=O)NCCc1[nH]cc[nH+]1 ZINC000355985358 356783655 /nfs/dbraw/zinc/78/36/55/356783655.db2.gz KPBCSAYBCCKGMS-VXGBXAGGSA-N 1 2 249.358 2.285 20 0 BEADLO Cc1nc2[nH]ccc2c(NCC[C@H](C)CCO)[nH+]1 ZINC000450564234 202198843 /nfs/dbraw/zinc/19/88/43/202198843.db2.gz MIOKZGDYUATFTD-VIFPVBQESA-N 1 2 248.330 2.038 20 0 BEADLO CC[C@H](Nc1cc(C)[nH+]cn1)C(F)F ZINC000450568735 202201345 /nfs/dbraw/zinc/20/13/45/202201345.db2.gz SVDHWRRZAPINMY-ZETCQYMHSA-N 1 2 201.220 2.241 20 0 BEADLO CC[C@@H](Nc1cc[nH+]c(C(C)C)n1)C(F)F ZINC000450570504 202201588 /nfs/dbraw/zinc/20/15/88/202201588.db2.gz QIKFFSARFPTAAS-MRVPVSSYSA-N 1 2 229.274 2.478 20 0 BEADLO Cc1cc(NC(CF)CF)nc(C(C)C)[nH+]1 ZINC000450594429 202207101 /nfs/dbraw/zinc/20/71/01/202207101.db2.gz SKAZBTZOAQRECQ-UHFFFAOYSA-N 1 2 229.274 2.050 20 0 BEADLO CC(C)C[N@@H+]1CC(=O)NC12CCC1(CC1)CC2 ZINC000362608243 356947891 /nfs/dbraw/zinc/94/78/91/356947891.db2.gz YKQRJOUZMROPSU-UHFFFAOYSA-N 1 2 236.359 2.125 20 0 BEADLO CC(C)C[N@H+]1CC(=O)NC12CCC1(CC1)CC2 ZINC000362608243 356947894 /nfs/dbraw/zinc/94/78/94/356947894.db2.gz YKQRJOUZMROPSU-UHFFFAOYSA-N 1 2 236.359 2.125 20 0 BEADLO Cc1cc(NC(=O)N(C2CC2)C2CC2)c(C)c[nH+]1 ZINC000626470025 357008954 /nfs/dbraw/zinc/00/89/54/357008954.db2.gz WSLZUVICPMUEJH-UHFFFAOYSA-N 1 2 245.326 2.279 20 0 BEADLO c1cc(C[NH2+]Cc2scnc2C2CC2)n[nH]1 ZINC000390141394 357084544 /nfs/dbraw/zinc/08/45/44/357084544.db2.gz OTZDLQGXXTYZMU-UHFFFAOYSA-N 1 2 234.328 2.033 20 0 BEADLO CCO[C@H]1C[C@@H](Nc2c[nH]c[nH+]2)C12CCC2 ZINC000390493582 357096868 /nfs/dbraw/zinc/09/68/68/357096868.db2.gz RDPVZMJCMKVTNM-ZJUUUORDSA-N 1 2 221.304 2.169 20 0 BEADLO CCOc1ccccc1CNc1c[nH]c[nH+]1 ZINC000390506351 357098873 /nfs/dbraw/zinc/09/88/73/357098873.db2.gz XFDVURLBVRIDHL-UHFFFAOYSA-N 1 2 217.272 2.421 20 0 BEADLO CC[C@H](C(=O)OC)[N@H+](C)Cc1cccs1 ZINC000041392546 357128916 /nfs/dbraw/zinc/12/89/16/357128916.db2.gz CTNNUUWJHRPBFV-SNVBAGLBSA-N 1 2 227.329 2.132 20 0 BEADLO CC[C@H](C(=O)OC)[N@@H+](C)Cc1cccs1 ZINC000041392546 357128917 /nfs/dbraw/zinc/12/89/17/357128917.db2.gz CTNNUUWJHRPBFV-SNVBAGLBSA-N 1 2 227.329 2.132 20 0 BEADLO CCn1c[nH+]cc1CN1Cc2ccc(O)cc2C1 ZINC000628419230 357239793 /nfs/dbraw/zinc/23/97/93/357239793.db2.gz RDBWMJQCOXEFGX-UHFFFAOYSA-N 1 2 243.310 2.124 20 0 BEADLO CCCC1(C(=O)NCc2c[nH+]cn2C)CCC1 ZINC000356755772 538816672 /nfs/dbraw/zinc/81/66/72/538816672.db2.gz SLSRTXMYFDRFGP-UHFFFAOYSA-N 1 2 235.331 2.007 20 0 BEADLO CCc1nc(C[N@@H+]2CC[C@H](C)[C@H](C)C2)no1 ZINC000122473529 357178561 /nfs/dbraw/zinc/17/85/61/357178561.db2.gz VZXIZAANUVZYTJ-VHSXEESVSA-N 1 2 223.320 2.110 20 0 BEADLO CCc1nc(C[N@H+]2CC[C@H](C)[C@H](C)C2)no1 ZINC000122473529 357178564 /nfs/dbraw/zinc/17/85/64/357178564.db2.gz VZXIZAANUVZYTJ-VHSXEESVSA-N 1 2 223.320 2.110 20 0 BEADLO COc1ccc[nH+]c1NCC(C)(C)C[C@@H](C)O ZINC000393566108 357287360 /nfs/dbraw/zinc/28/73/60/357287360.db2.gz SCFNZXXMGNGNEE-SNVBAGLBSA-N 1 2 238.331 2.299 20 0 BEADLO CCc1nc(C[NH2+]CC2(F)CC2)cs1 ZINC000393671577 357292531 /nfs/dbraw/zinc/29/25/31/357292531.db2.gz XEBRLPCZRFDKFA-UHFFFAOYSA-N 1 2 214.309 2.297 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCCc2c1cnn2C)C(F)F ZINC000228499322 491109885 /nfs/dbraw/zinc/10/98/85/491109885.db2.gz DBEDSVXAYHNLJK-IONNQARKSA-N 1 2 229.274 2.041 20 0 BEADLO Cn1ncc2c1CCC[C@@H]2[NH2+]CC(C)(F)F ZINC000393461638 357310540 /nfs/dbraw/zinc/31/05/40/357310540.db2.gz GIYHEQXYXDGXBT-VIFPVBQESA-N 1 2 229.274 2.042 20 0 BEADLO c1cc(C[NH+]2CC3(C2)CCCO3)cs1 ZINC000628426844 357254767 /nfs/dbraw/zinc/25/47/67/357254767.db2.gz PPFSUMXLXJTBOT-UHFFFAOYSA-N 1 2 209.314 2.113 20 0 BEADLO COc1ccc(C[NH+]2CC3(C2)CCCO3)cc1 ZINC000628426793 357254859 /nfs/dbraw/zinc/25/48/59/357254859.db2.gz MDIMSNBDVQOQCS-UHFFFAOYSA-N 1 2 233.311 2.060 20 0 BEADLO Cc1cc(C[NH+]2CC3(C2)CCCO3)ccc1F ZINC000628427101 357255816 /nfs/dbraw/zinc/25/58/16/357255816.db2.gz GECNSDOBQRCOQL-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO COCc1ccc(C[NH+]2CC3(C2)CCCO3)cc1 ZINC000628427271 357257209 /nfs/dbraw/zinc/25/72/09/357257209.db2.gz QNLPNNSYBTVSDN-UHFFFAOYSA-N 1 2 247.338 2.198 20 0 BEADLO Cc1ccc(C[NH+]2CC3(C2)CCCO3)s1 ZINC000628426907 357257751 /nfs/dbraw/zinc/25/77/51/357257751.db2.gz UCEVFVCWWNFGJM-UHFFFAOYSA-N 1 2 223.341 2.421 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@]12C[C@@H]1CCCC2 ZINC000639899023 357276901 /nfs/dbraw/zinc/27/69/01/357276901.db2.gz AVTAYEIDXYLWEX-FZMZJTMJSA-N 1 2 245.326 2.266 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000582735417 357376730 /nfs/dbraw/zinc/37/67/30/357376730.db2.gz GZYYUNMQETUXFN-GBIKHYSHSA-N 1 2 235.331 2.269 20 0 BEADLO C[N@H+](Cc1nnc(C2CC2)o1)[C@@H]1CC1(C)C ZINC000582701554 357365940 /nfs/dbraw/zinc/36/59/40/357365940.db2.gz XUXJXVKRGKAVDG-SECBINFHSA-N 1 2 221.304 2.177 20 0 BEADLO C[N@@H+](Cc1nnc(C2CC2)o1)[C@@H]1CC1(C)C ZINC000582701554 357365943 /nfs/dbraw/zinc/36/59/43/357365943.db2.gz XUXJXVKRGKAVDG-SECBINFHSA-N 1 2 221.304 2.177 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N(CC1CC1)C1CCC1 ZINC000358424947 538843074 /nfs/dbraw/zinc/84/30/74/538843074.db2.gz GYNMXVIYHGYDKF-UHFFFAOYSA-N 1 2 247.342 2.133 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N(CC1CC1)C1CCC1 ZINC000358424947 538843078 /nfs/dbraw/zinc/84/30/78/538843078.db2.gz GYNMXVIYHGYDKF-UHFFFAOYSA-N 1 2 247.342 2.133 20 0 BEADLO CCCc1nc(C[N@@H+]2CCCC[C@@H]2C)no1 ZINC000054982883 363583020 /nfs/dbraw/zinc/58/30/20/363583020.db2.gz SZDAZCCMTJQJNA-JTQLQIEISA-N 1 2 223.320 2.397 20 0 BEADLO c1c[nH]c([C@@H]([NH2+][C@@H]2CC23CC3)c2cccnc2)n1 ZINC000583019208 357450348 /nfs/dbraw/zinc/45/03/48/357450348.db2.gz XHSFBSPYGPWQTC-NEPJUHHUSA-N 1 2 240.310 2.036 20 0 BEADLO CCCc1nc(C[N@H+]2CCCC[C@@H]2C)no1 ZINC000054982883 363583027 /nfs/dbraw/zinc/58/30/27/363583027.db2.gz SZDAZCCMTJQJNA-JTQLQIEISA-N 1 2 223.320 2.397 20 0 BEADLO c1c[nH]c([C@H]([NH2+][C@H]2CC23CC3)c2cccnc2)n1 ZINC000583019209 357450492 /nfs/dbraw/zinc/45/04/92/357450492.db2.gz XHSFBSPYGPWQTC-NWDGAFQWSA-N 1 2 240.310 2.036 20 0 BEADLO CC(C)=CCCNC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000583094327 357479424 /nfs/dbraw/zinc/47/94/24/357479424.db2.gz SRZGJVOJFLDVMI-LLVKDONJSA-N 1 2 235.331 2.061 20 0 BEADLO CC(C)=CCCNC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000583094327 357479427 /nfs/dbraw/zinc/47/94/27/357479427.db2.gz SRZGJVOJFLDVMI-LLVKDONJSA-N 1 2 235.331 2.061 20 0 BEADLO Cc1cc(C[N@H+]2CCOC[C@H]2CC(C)C)on1 ZINC000072980020 325183838 /nfs/dbraw/zinc/18/38/38/325183838.db2.gz NQIQZECROCFITM-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC[C@H]2CC(C)C)on1 ZINC000072980020 325183841 /nfs/dbraw/zinc/18/38/41/325183841.db2.gz NQIQZECROCFITM-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO CCc1nn(C)cc1NCc1c[nH+]cn1C(C)C ZINC000231081952 357589425 /nfs/dbraw/zinc/58/94/25/357589425.db2.gz UYTWVMSMEMNGBA-UHFFFAOYSA-N 1 2 247.346 2.372 20 0 BEADLO O=C(CCCn1cc[nH+]c1)Nc1ccc(O)cc1 ZINC000158971293 538871646 /nfs/dbraw/zinc/87/16/46/538871646.db2.gz VIOMCNRHTOIZIV-UHFFFAOYSA-N 1 2 245.282 2.008 20 0 BEADLO CC1(C)C[N@H+](Cc2cc[nH]n2)CC2(CCCC2)O1 ZINC000191225022 357758800 /nfs/dbraw/zinc/75/88/00/357758800.db2.gz IDQVZSCAVPRQNX-UHFFFAOYSA-N 1 2 249.358 2.333 20 0 BEADLO CC1(C)C[N@@H+](Cc2cc[nH]n2)CC2(CCCC2)O1 ZINC000191225022 357758804 /nfs/dbraw/zinc/75/88/04/357758804.db2.gz IDQVZSCAVPRQNX-UHFFFAOYSA-N 1 2 249.358 2.333 20 0 BEADLO CCc1occc1C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000233906606 357762211 /nfs/dbraw/zinc/76/22/11/357762211.db2.gz FIGRZTFKGYYVBQ-SNVBAGLBSA-N 1 2 247.298 2.446 20 0 BEADLO CCC(=O)CCC[NH+]1CCN([C@@H](C)CC)CC1 ZINC000234014726 357767978 /nfs/dbraw/zinc/76/79/78/357767978.db2.gz PMYFXBUGIXKKBO-ZDUSSCGKSA-N 1 2 240.391 2.162 20 0 BEADLO CC[C@H](O)CNc1[nH+]ccc2c(OC)cccc21 ZINC000234038522 357768687 /nfs/dbraw/zinc/76/86/87/357768687.db2.gz GPILQDJKEUXPHO-JTQLQIEISA-N 1 2 246.310 2.426 20 0 BEADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1ncccn1 ZINC000192136353 357824264 /nfs/dbraw/zinc/82/42/64/357824264.db2.gz WGBGRDDKGHJCIK-ZDUSSCGKSA-N 1 2 242.326 2.455 20 0 BEADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ncccn1 ZINC000192136353 357824267 /nfs/dbraw/zinc/82/42/67/357824267.db2.gz WGBGRDDKGHJCIK-ZDUSSCGKSA-N 1 2 242.326 2.455 20 0 BEADLO C[N@H+](Cc1ccc(F)cc1)Cc1ncccn1 ZINC000191877545 357800827 /nfs/dbraw/zinc/80/08/27/357800827.db2.gz ZASOPXLQDDOKDE-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[N@@H+](Cc1ccc(F)cc1)Cc1ncccn1 ZINC000191877545 357800835 /nfs/dbraw/zinc/80/08/35/357800835.db2.gz ZASOPXLQDDOKDE-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO CC[C@@H](C(=O)OC(C)(C)C)[NH+]1CCSCC1 ZINC000191944001 357806586 /nfs/dbraw/zinc/80/65/86/357806586.db2.gz OJOPFMOQKWWIFG-JTQLQIEISA-N 1 2 245.388 2.156 20 0 BEADLO C[C@H](c1ccco1)[N@H+](C)Cc1ncccn1 ZINC000191968961 357807951 /nfs/dbraw/zinc/80/79/51/357807951.db2.gz UNVXFDQYJFKKIH-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H](c1ccco1)[N@@H+](C)Cc1ncccn1 ZINC000191968961 357807954 /nfs/dbraw/zinc/80/79/54/357807954.db2.gz UNVXFDQYJFKKIH-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO CCCn1cc(CNc2cc[nH+]cc2F)cn1 ZINC000192150316 357825450 /nfs/dbraw/zinc/82/54/50/357825450.db2.gz MZVOGTJDPMMYJP-UHFFFAOYSA-N 1 2 234.278 2.439 20 0 BEADLO COc1cccc2c1cc[nH+]c2NCC[C@@H](C)O ZINC000234911766 357836599 /nfs/dbraw/zinc/83/65/99/357836599.db2.gz MRPRCNDZYLIOON-SNVBAGLBSA-N 1 2 246.310 2.426 20 0 BEADLO COc1cccc2c1cc[nH+]c2NCC[C@H](C)O ZINC000234911989 357836743 /nfs/dbraw/zinc/83/67/43/357836743.db2.gz MRPRCNDZYLIOON-JTQLQIEISA-N 1 2 246.310 2.426 20 0 BEADLO CC(C)CCc1noc(C[N@H+](C)C2CC2)n1 ZINC000064508456 357849685 /nfs/dbraw/zinc/84/96/85/357849685.db2.gz KASNBFSAEKZOEL-UHFFFAOYSA-N 1 2 223.320 2.252 20 0 BEADLO CC(C)CCc1noc(C[N@@H+](C)C2CC2)n1 ZINC000064508456 357849688 /nfs/dbraw/zinc/84/96/88/357849688.db2.gz KASNBFSAEKZOEL-UHFFFAOYSA-N 1 2 223.320 2.252 20 0 BEADLO C[C@H]1CCC[C@@]1(C)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000584391557 357883832 /nfs/dbraw/zinc/88/38/32/357883832.db2.gz YEVWTKYTBLDQCK-SMDDNHRTSA-N 1 2 247.342 2.093 20 0 BEADLO C[C@@H](NC(=O)C(C)(C)C1CC1)c1[nH]cc[nH+]1 ZINC000584420943 357918151 /nfs/dbraw/zinc/91/81/51/357918151.db2.gz XYSKJSUZZMQRQX-MRVPVSSYSA-N 1 2 221.304 2.023 20 0 BEADLO COc1c(C)[nH+]c(C2CC2)nc1NC[C@@H]1C[C@H]1C ZINC000583763431 357938523 /nfs/dbraw/zinc/93/85/23/357938523.db2.gz YRWROOZAKGVQIS-KCJUWKMLSA-N 1 2 247.342 2.161 20 0 BEADLO CCC(F)(F)C[N@@H+]1CC[C@@H](C)C[C@H]1CO ZINC000639937689 357939361 /nfs/dbraw/zinc/93/93/61/357939361.db2.gz BZFDEQUEMPQOQU-ZJUUUORDSA-N 1 2 221.291 2.125 20 0 BEADLO CCC(F)(F)C[N@H+]1CC[C@@H](C)C[C@H]1CO ZINC000639937689 357939364 /nfs/dbraw/zinc/93/93/64/357939364.db2.gz BZFDEQUEMPQOQU-ZJUUUORDSA-N 1 2 221.291 2.125 20 0 BEADLO C[C@@H]1C[C@H](O)CC[N@@H+]1Cc1ncc(Cl)s1 ZINC000639938980 357945553 /nfs/dbraw/zinc/94/55/53/357945553.db2.gz TVYKODNHXPWZHJ-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H]1C[C@H](O)CC[N@H+]1Cc1ncc(Cl)s1 ZINC000639938980 357945555 /nfs/dbraw/zinc/94/55/55/357945555.db2.gz TVYKODNHXPWZHJ-HTQZYQBOSA-N 1 2 246.763 2.142 20 0 BEADLO CCc1noc(C)c1C[N@H+](C)Cc1c[nH]nc1C ZINC000639969679 358021778 /nfs/dbraw/zinc/02/17/78/358021778.db2.gz ACWLUOQCXAJSBE-UHFFFAOYSA-N 1 2 248.330 2.209 20 0 BEADLO CCc1noc(C)c1C[N@@H+](C)Cc1c[nH]nc1C ZINC000639969679 358021782 /nfs/dbraw/zinc/02/17/82/358021782.db2.gz ACWLUOQCXAJSBE-UHFFFAOYSA-N 1 2 248.330 2.209 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)[C@H]1C=CCCC1 ZINC000639970742 358024053 /nfs/dbraw/zinc/02/40/53/358024053.db2.gz RMPXFWXMXBDECT-LBPRGKRZSA-N 1 2 205.305 2.259 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)[C@H]1C=CCCC1 ZINC000639970742 358024056 /nfs/dbraw/zinc/02/40/56/358024056.db2.gz RMPXFWXMXBDECT-LBPRGKRZSA-N 1 2 205.305 2.259 20 0 BEADLO Cn1c[nH+]cc1CSc1ccccc1O ZINC000085191886 134247647 /nfs/dbraw/zinc/24/76/47/134247647.db2.gz KJLSJRSDAODSJB-UHFFFAOYSA-N 1 2 220.297 2.418 20 0 BEADLO CCCC(CCC)C(=O)NCc1c[nH+]c[nH]1 ZINC000169000694 134249016 /nfs/dbraw/zinc/24/90/16/134249016.db2.gz QDSNNICADZXFLK-UHFFFAOYSA-N 1 2 223.320 2.242 20 0 BEADLO CCCC(CCC)C(=O)NCc1c[nH]c[nH+]1 ZINC000169000694 134249017 /nfs/dbraw/zinc/24/90/17/134249017.db2.gz QDSNNICADZXFLK-UHFFFAOYSA-N 1 2 223.320 2.242 20 0 BEADLO COc1cccc2c1CN(Cc1[nH]cc(C)[nH+]1)C2 ZINC000628463053 358118245 /nfs/dbraw/zinc/11/82/45/358118245.db2.gz QTYNIPGASMJPCF-UHFFFAOYSA-N 1 2 243.310 2.243 20 0 BEADLO CC(=O)c1cc(C[NH+]2CCC(C)(F)CC2)on1 ZINC000640070733 358157202 /nfs/dbraw/zinc/15/72/02/358157202.db2.gz ALTXDKZPMOIULM-UHFFFAOYSA-N 1 2 240.278 2.201 20 0 BEADLO C[C@@H](CC(=O)N1C[C@H](C)CC[C@@H]1C)n1cc[nH+]c1 ZINC000584723101 358165828 /nfs/dbraw/zinc/16/58/28/358165828.db2.gz HIHCBNRPNRJKEH-AGIUHOORSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@@H](Cc1nc(CCC2CC2)no1)n1cc[nH+]c1 ZINC000351433242 358201373 /nfs/dbraw/zinc/20/13/73/358201373.db2.gz RNBPXRGAASOSAC-JTQLQIEISA-N 1 2 246.314 2.412 20 0 BEADLO FCC1(CNc2cccc[nH+]2)CCOCC1 ZINC000450733712 202248895 /nfs/dbraw/zinc/24/88/95/202248895.db2.gz RJXQRIBHRSFWAA-UHFFFAOYSA-N 1 2 224.279 2.260 20 0 BEADLO COC[C@H]([NH2+]Cc1cccc(C)n1)c1ccco1 ZINC000450730986 202249219 /nfs/dbraw/zinc/24/92/19/202249219.db2.gz YGSACXSJBGEJJU-ZDUSSCGKSA-N 1 2 246.310 2.460 20 0 BEADLO CC[C@](C)(CNc1cc[nH+]c(C(C)C)n1)OC ZINC000450712360 202241924 /nfs/dbraw/zinc/24/19/24/202241924.db2.gz ISQMCDVLEWEAKJ-CYBMUJFWSA-N 1 2 237.347 2.249 20 0 BEADLO CC[C@@](C)(CNc1cc(C)[nH+]c(C2CC2)n1)OC ZINC000450712867 202242386 /nfs/dbraw/zinc/24/23/86/202242386.db2.gz JJDIZGCDZQKELZ-AWEZNQCLSA-N 1 2 249.358 2.311 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)on1 ZINC000225250329 491128996 /nfs/dbraw/zinc/12/89/96/491128996.db2.gz YENOPGCNZFXNHH-LDYMZIIASA-N 1 2 212.268 2.163 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)on1 ZINC000225250329 491128997 /nfs/dbraw/zinc/12/89/97/491128997.db2.gz YENOPGCNZFXNHH-LDYMZIIASA-N 1 2 212.268 2.163 20 0 BEADLO CC(C)CCCc1nc(Cc2c[nH+]cn2C)no1 ZINC000351092730 366410235 /nfs/dbraw/zinc/41/02/35/366410235.db2.gz QJVAVBDFIBCSHQ-UHFFFAOYSA-N 1 2 248.330 2.373 20 0 BEADLO CCc1cn(Cc2cc(C(=O)OC)c(C)o2)c[nH+]1 ZINC001641418780 1172246798 /nfs/dbraw/zinc/24/67/98/1172246798.db2.gz NPSKGSBMHYIIBR-UHFFFAOYSA-N 1 2 248.282 2.182 20 0 BEADLO CC[C@@H](Nc1cc(C)ncn1)c1[nH]cc[nH+]1 ZINC000125215709 358535421 /nfs/dbraw/zinc/53/54/21/358535421.db2.gz KISOBOBISHGOSB-SECBINFHSA-N 1 2 217.276 2.071 20 0 BEADLO CC[C@@H](Nc1ncc(Cl)cn1)c1[nH]cc[nH+]1 ZINC000125225811 358535757 /nfs/dbraw/zinc/53/57/57/358535757.db2.gz WUPXWDJFMZMGDP-MRVPVSSYSA-N 1 2 237.694 2.416 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)Nc1ccccc1 ZINC000047717892 358600778 /nfs/dbraw/zinc/60/07/78/358600778.db2.gz JBVFCZANNXALRE-LLVKDONJSA-N 1 2 244.298 2.093 20 0 BEADLO Cc1ccoc1C(=O)Nc1ccc[nH+]c1N(C)C ZINC000047976018 358608924 /nfs/dbraw/zinc/60/89/24/358608924.db2.gz FOXLTZLGFNUBOH-UHFFFAOYSA-N 1 2 245.282 2.301 20 0 BEADLO CCCC[C@H]([NH2+][C@@H](C)CSC)C(=O)OC ZINC000135225775 325400950 /nfs/dbraw/zinc/40/09/50/325400950.db2.gz UMBBKPGLWVWKBP-UWVGGRQHSA-N 1 2 233.377 2.059 20 0 BEADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(F)c1)C1CC1 ZINC000048809711 358656493 /nfs/dbraw/zinc/65/64/93/358656493.db2.gz CXTQCBHSLRZNCN-UHFFFAOYSA-N 1 2 245.257 2.360 20 0 BEADLO Cc1noc(C2C[NH+](Cc3ccccc3F)C2)n1 ZINC000049482657 358690909 /nfs/dbraw/zinc/69/09/09/358690909.db2.gz GWWXPPCSEANHLQ-UHFFFAOYSA-N 1 2 247.273 2.117 20 0 BEADLO Fc1cc2[nH+]cn(C[C@H]3CCOC3)c2cc1F ZINC000131875460 358698493 /nfs/dbraw/zinc/69/84/93/358698493.db2.gz GMPKVAHMNPWLJK-MRVPVSSYSA-N 1 2 238.237 2.351 20 0 BEADLO CC(C)c1nc(N[C@@H]2C[C@H]3CC[C@@H]2O3)cc[nH+]1 ZINC000133491138 358756345 /nfs/dbraw/zinc/75/63/45/358756345.db2.gz VDGYFUJUWRAADZ-MXWKQRLJSA-N 1 2 233.315 2.332 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1cc(C)ccc1C ZINC000049947910 358707058 /nfs/dbraw/zinc/70/70/58/358707058.db2.gz NYODENOCZQHXHL-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1cc(C)ccc1C ZINC000049947910 358707059 /nfs/dbraw/zinc/70/70/59/358707059.db2.gz NYODENOCZQHXHL-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO CC(C)c1nc(N2CCO[C@@H](C)[C@H]2C)cc[nH+]1 ZINC000132250579 358713923 /nfs/dbraw/zinc/71/39/23/358713923.db2.gz VXMFFCPLJBKRKH-MNOVXSKESA-N 1 2 235.331 2.214 20 0 BEADLO CSCc1nc(Cc2ccc[nH+]c2C)no1 ZINC000351245955 366458948 /nfs/dbraw/zinc/45/89/48/366458948.db2.gz YHZFMFWZFDAOFZ-UHFFFAOYSA-N 1 2 235.312 2.227 20 0 BEADLO CC[C@H](NC(=O)Cc1c[nH+]cn1C)C1CCCC1 ZINC000578220990 366460443 /nfs/dbraw/zinc/46/04/43/366460443.db2.gz UPEVKQPJXNQKEY-ZDUSSCGKSA-N 1 2 249.358 2.048 20 0 BEADLO CS[C@@H]1CCCC[N@H+](Cc2noc(C)n2)C1 ZINC000134577206 358796250 /nfs/dbraw/zinc/79/62/50/358796250.db2.gz ASJKFDMCFZAYTD-SNVBAGLBSA-N 1 2 241.360 2.096 20 0 BEADLO CS[C@@H]1CCCC[N@@H+](Cc2noc(C)n2)C1 ZINC000134577206 358796253 /nfs/dbraw/zinc/79/62/53/358796253.db2.gz ASJKFDMCFZAYTD-SNVBAGLBSA-N 1 2 241.360 2.096 20 0 BEADLO Cc1cc(F)cc(C(=O)N(C)Cc2[nH]cc[nH+]2)c1 ZINC000134788992 358806159 /nfs/dbraw/zinc/80/61/59/358806159.db2.gz ZTOMIRVVFAEOPL-UHFFFAOYSA-N 1 2 247.273 2.129 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCCSC1)C(=O)OC(C)(C)C ZINC000134814696 358808326 /nfs/dbraw/zinc/80/83/26/358808326.db2.gz NOHWSLQSQZDZAU-NXEZZACHSA-N 1 2 245.388 2.202 20 0 BEADLO CCc1nc(C[NH+]2C[C@H](C)C[C@@H](C)C2)no1 ZINC000054316309 358858026 /nfs/dbraw/zinc/85/80/26/358858026.db2.gz FFRUWRKAGFBYHQ-NXEZZACHSA-N 1 2 223.320 2.110 20 0 BEADLO CCc1nc(C[N@H+](CC)CC(C)C)no1 ZINC000054316781 358859510 /nfs/dbraw/zinc/85/95/10/358859510.db2.gz LJHNDMGQGNBIAW-UHFFFAOYSA-N 1 2 211.309 2.110 20 0 BEADLO CCc1nc(C[N@@H+](CC)CC(C)C)no1 ZINC000054316781 358859512 /nfs/dbraw/zinc/85/95/12/358859512.db2.gz LJHNDMGQGNBIAW-UHFFFAOYSA-N 1 2 211.309 2.110 20 0 BEADLO CCCC[N@H+](C)Cc1noc(C(C)C)n1 ZINC000053602372 358831963 /nfs/dbraw/zinc/83/19/63/358831963.db2.gz WPKFCCMHLDAWEE-UHFFFAOYSA-N 1 2 211.309 2.425 20 0 BEADLO CCCC[N@@H+](C)Cc1noc(C(C)C)n1 ZINC000053602372 358831967 /nfs/dbraw/zinc/83/19/67/358831967.db2.gz WPKFCCMHLDAWEE-UHFFFAOYSA-N 1 2 211.309 2.425 20 0 BEADLO C[C@@H]1CCC[N@H+](Cc2noc(C3CC3)n2)C1 ZINC000053602273 358836391 /nfs/dbraw/zinc/83/63/91/358836391.db2.gz IMBZUDAVEVMLFA-SECBINFHSA-N 1 2 221.304 2.179 20 0 BEADLO C[C@@H]1CCC[N@@H+](Cc2noc(C3CC3)n2)C1 ZINC000053602273 358836393 /nfs/dbraw/zinc/83/63/93/358836393.db2.gz IMBZUDAVEVMLFA-SECBINFHSA-N 1 2 221.304 2.179 20 0 BEADLO Cc1ncc2c(n1)CC[N@@H+](Cc1ccsc1)C2 ZINC000139457969 358911514 /nfs/dbraw/zinc/91/15/14/358911514.db2.gz IXCQUNOUYKVQNY-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ncc2c(n1)CC[N@H+](Cc1ccsc1)C2 ZINC000139457969 358911518 /nfs/dbraw/zinc/91/15/18/358911518.db2.gz IXCQUNOUYKVQNY-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO CC(C)Cc1noc(C[C@@H](C)n2cc[nH+]c2)n1 ZINC000351395866 366521926 /nfs/dbraw/zinc/52/19/26/366521926.db2.gz DHKRPJDXLTVYKV-SNVBAGLBSA-N 1 2 234.303 2.268 20 0 BEADLO C[C@H]1C[N@H+](CCc2ccc(F)c(F)c2)CCO1 ZINC000177946789 134302064 /nfs/dbraw/zinc/30/20/64/134302064.db2.gz LQVOMLCXNWYIMF-JTQLQIEISA-N 1 2 241.281 2.228 20 0 BEADLO C[C@H]1C[N@@H+](CCc2ccc(F)c(F)c2)CCO1 ZINC000177946789 134302065 /nfs/dbraw/zinc/30/20/65/134302065.db2.gz LQVOMLCXNWYIMF-JTQLQIEISA-N 1 2 241.281 2.228 20 0 BEADLO C[C@@H](C[C@@H]1CCOC1)Nc1cccc[nH+]1 ZINC000308844346 491138803 /nfs/dbraw/zinc/13/88/03/491138803.db2.gz LMLXGKGLOHSKBH-QWRGUYRKSA-N 1 2 206.289 2.309 20 0 BEADLO Cc1ccc(F)cc1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000070978952 359067942 /nfs/dbraw/zinc/06/79/42/359067942.db2.gz PMJCYXSJSSAIAB-UHFFFAOYSA-N 1 2 247.273 2.129 20 0 BEADLO Cc1cc(NCc2nccn2C)nc(C(C)C)[nH+]1 ZINC000071274401 359075270 /nfs/dbraw/zinc/07/52/70/359075270.db2.gz UPODZAPWFOIAFL-UHFFFAOYSA-N 1 2 245.330 2.254 20 0 BEADLO COC(=O)c1ccc(CNc2c[nH+]ccc2C)o1 ZINC000071413845 359079543 /nfs/dbraw/zinc/07/95/43/359079543.db2.gz IKYAAYIPXPPXEN-UHFFFAOYSA-N 1 2 246.266 2.382 20 0 BEADLO COC[C@H](C)[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000246456246 359098684 /nfs/dbraw/zinc/09/86/84/359098684.db2.gz FLTUANGAYMEDCW-CMPLNLGQSA-N 1 2 241.356 2.156 20 0 BEADLO COC[C@H](C)[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000246456246 359098691 /nfs/dbraw/zinc/09/86/91/359098691.db2.gz FLTUANGAYMEDCW-CMPLNLGQSA-N 1 2 241.356 2.156 20 0 BEADLO Cc1ccsc1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000070650720 359060610 /nfs/dbraw/zinc/06/06/10/359060610.db2.gz KKVQWGLLGVVSHN-UHFFFAOYSA-N 1 2 235.312 2.052 20 0 BEADLO FC1(F)CCC[C@H]1[NH2+]Cc1ccncc1 ZINC000308873258 491139495 /nfs/dbraw/zinc/13/94/95/491139495.db2.gz LVJITASQNDHBQZ-SNVBAGLBSA-N 1 2 212.243 2.359 20 0 BEADLO O=S1CC[NH+](Cc2ccccc2C2CC2)CC1 ZINC000611269023 359284750 /nfs/dbraw/zinc/28/47/50/359284750.db2.gz MIWLHOPZBXUZDH-UHFFFAOYSA-N 1 2 249.379 2.128 20 0 BEADLO CC(C)[C@@H]1C[C@H](Nc2c[nH]c[nH+]2)CS1 ZINC000306220855 359346808 /nfs/dbraw/zinc/34/68/08/359346808.db2.gz OXZMOBBVRBMCCR-IUCAKERBSA-N 1 2 211.334 2.352 20 0 BEADLO Nc1[nH+]cnc(N[C@@H]2CC[C@@H](F)C2)c1Cl ZINC000308997158 491142086 /nfs/dbraw/zinc/14/20/86/491142086.db2.gz MXEIQOBTCRFODX-PHDIDXHHSA-N 1 2 230.674 2.015 20 0 BEADLO Nc1nc[nH+]c(N[C@@H]2CC[C@@H](F)C2)c1Cl ZINC000308997158 491142087 /nfs/dbraw/zinc/14/20/87/491142087.db2.gz MXEIQOBTCRFODX-PHDIDXHHSA-N 1 2 230.674 2.015 20 0 BEADLO C[C@H]1CSCC[N@@H+]1Cc1cnc(Cl)cn1 ZINC000231282217 359693486 /nfs/dbraw/zinc/69/34/86/359693486.db2.gz MXPWSMPMQRJQMY-QMMMGPOBSA-N 1 2 243.763 2.067 20 0 BEADLO C[C@H]1CSCC[N@H+]1Cc1cnc(Cl)cn1 ZINC000231282217 359693489 /nfs/dbraw/zinc/69/34/89/359693489.db2.gz MXPWSMPMQRJQMY-QMMMGPOBSA-N 1 2 243.763 2.067 20 0 BEADLO CC(C)CCCC(=O)N[C@@H]1CCn2cc[nH+]c2C1 ZINC000450801363 202269625 /nfs/dbraw/zinc/26/96/25/202269625.db2.gz RXGHXDNPNXJZKU-GFCCVEGCSA-N 1 2 249.358 2.140 20 0 BEADLO CO[C@@H](C(=O)Nc1ccc(C)[nH+]c1C)C1CCC1 ZINC000612227308 359740445 /nfs/dbraw/zinc/74/04/45/359740445.db2.gz SFLPXVYNJCUOBD-CYBMUJFWSA-N 1 2 248.326 2.452 20 0 BEADLO CC(C)c1nc(NCCC[C@H]2CCOC2)cc[nH+]1 ZINC000450885431 202297390 /nfs/dbraw/zinc/29/73/90/202297390.db2.gz BXNBAAQCSJCYGW-LBPRGKRZSA-N 1 2 249.358 2.251 20 0 BEADLO CC[C@@H](Nc1cc(C)[nH+]c(C2CC2)n1)[C@@H](O)CC ZINC000450866562 202293502 /nfs/dbraw/zinc/29/35/02/202293502.db2.gz XFCQEKLZHDTIPD-NEPJUHHUSA-N 1 2 249.358 2.046 20 0 BEADLO CCO[C@@H]1CCC[C@H]1Nc1cc[nH+]c(C)n1 ZINC000450937641 202314208 /nfs/dbraw/zinc/31/42/08/202314208.db2.gz JMQXHGKEVYPLFD-GHMZBOCLSA-N 1 2 221.304 2.155 20 0 BEADLO CCO[C@@H]1CCC[C@H]1Nc1cccc[nH+]1 ZINC000450936192 202315317 /nfs/dbraw/zinc/31/53/17/202315317.db2.gz HMDKMLJICNQQAX-GHMZBOCLSA-N 1 2 206.289 2.451 20 0 BEADLO COC[C@H]1CCCN(c2cc[nH+]c(C)n2)CC1 ZINC000450945335 202316861 /nfs/dbraw/zinc/31/68/61/202316861.db2.gz KITLNFMCYRURNL-LBPRGKRZSA-N 1 2 235.331 2.038 20 0 BEADLO CC[C@]1(C)CN(c2nc(C)[nH+]cc2C)CCO1 ZINC000578453250 366573337 /nfs/dbraw/zinc/57/33/37/366573337.db2.gz KYZRHYJHBABBTC-CYBMUJFWSA-N 1 2 235.331 2.099 20 0 BEADLO Cc1nnsc1C[N@@H+]1CCC[C@@](C)(F)C1 ZINC000578512233 366584750 /nfs/dbraw/zinc/58/47/50/366584750.db2.gz RDYGHVQWOJXFJL-SNVBAGLBSA-N 1 2 229.324 2.171 20 0 BEADLO Cc1nnsc1C[N@H+]1CCC[C@@](C)(F)C1 ZINC000578512233 366584752 /nfs/dbraw/zinc/58/47/52/366584752.db2.gz RDYGHVQWOJXFJL-SNVBAGLBSA-N 1 2 229.324 2.171 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000578515569 366586457 /nfs/dbraw/zinc/58/64/57/366586457.db2.gz ZBFWCSIPYUWIMD-QMTHXVAHSA-N 1 2 249.358 2.443 20 0 BEADLO COC(=O)[C@@H](CC(C)C)[N@@H+]1CCC[C@](C)(F)C1 ZINC000451115966 202355353 /nfs/dbraw/zinc/35/53/53/202355353.db2.gz QCYJQSOEJXBFQO-YPMHNXCESA-N 1 2 245.338 2.398 20 0 BEADLO COC(=O)[C@@H](CC(C)C)[N@H+]1CCC[C@](C)(F)C1 ZINC000451115966 202355357 /nfs/dbraw/zinc/35/53/57/202355357.db2.gz QCYJQSOEJXBFQO-YPMHNXCESA-N 1 2 245.338 2.398 20 0 BEADLO CCc1ccc(C[N@H+](C2CC2)C2COC2)nc1 ZINC000451123444 202359758 /nfs/dbraw/zinc/35/97/58/202359758.db2.gz DHPCWVYUSMTBHM-UHFFFAOYSA-N 1 2 232.327 2.007 20 0 BEADLO CCc1ccc(C[N@@H+](C2CC2)C2COC2)nc1 ZINC000451123444 202359762 /nfs/dbraw/zinc/35/97/62/202359762.db2.gz DHPCWVYUSMTBHM-UHFFFAOYSA-N 1 2 232.327 2.007 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[N@@H+]1CC[C@H](F)C1 ZINC000451194925 202372475 /nfs/dbraw/zinc/37/24/75/202372475.db2.gz LAQGZIAXMYRWIH-WDEREUQCSA-N 1 2 231.311 2.008 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[N@H+]1CC[C@H](F)C1 ZINC000451194925 202372477 /nfs/dbraw/zinc/37/24/77/202372477.db2.gz LAQGZIAXMYRWIH-WDEREUQCSA-N 1 2 231.311 2.008 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C1(C2CCC2)CCC1 ZINC000578610249 366606406 /nfs/dbraw/zinc/60/64/06/366606406.db2.gz MGTIRRIPFNZVGA-UHFFFAOYSA-N 1 2 247.342 2.305 20 0 BEADLO Cc1noc(C)c1CC[NH+]1CC(C(F)(F)F)C1 ZINC000578715183 366629839 /nfs/dbraw/zinc/62/98/39/366629839.db2.gz QWPIZFMPQBWWCR-UHFFFAOYSA-N 1 2 248.248 2.328 20 0 BEADLO COCc1cccc(C[NH2+]Cc2cc(C)on2)c1 ZINC000088553644 359965671 /nfs/dbraw/zinc/96/56/71/359965671.db2.gz RUZFFBWMQSFPGU-UHFFFAOYSA-N 1 2 246.310 2.419 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)[C@@H]2CC=CCC2)[nH+]1 ZINC000578899767 366670959 /nfs/dbraw/zinc/67/09/59/366670959.db2.gz DPRICMPCBZTDKI-LLVKDONJSA-N 1 2 247.342 2.426 20 0 BEADLO COCc1ccc(C[NH2+]Cc2cc(C)on2)cc1 ZINC000088568329 359966921 /nfs/dbraw/zinc/96/69/21/359966921.db2.gz LASQDVKPWCXXBX-UHFFFAOYSA-N 1 2 246.310 2.419 20 0 BEADLO CCc1cc(C(=O)NCc2c[nH+]c[nH]2)sc1C ZINC000088753031 359976207 /nfs/dbraw/zinc/97/62/07/359976207.db2.gz OVXILJVVFBOXSY-UHFFFAOYSA-N 1 2 249.339 2.272 20 0 BEADLO CCc1cc(C(=O)NCc2c[nH]c[nH+]2)sc1C ZINC000088753031 359976211 /nfs/dbraw/zinc/97/62/11/359976211.db2.gz OVXILJVVFBOXSY-UHFFFAOYSA-N 1 2 249.339 2.272 20 0 BEADLO Cc1nc(N[C@H]2CCCC2(F)F)cc[nH+]1 ZINC000309218374 491146434 /nfs/dbraw/zinc/14/64/34/491146434.db2.gz USNWDWWTGSFNMW-QMMMGPOBSA-N 1 2 213.231 2.385 20 0 BEADLO CC(C)C[C@H](C)NC(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000612841029 360103584 /nfs/dbraw/zinc/10/35/84/360103584.db2.gz WJBVUHXSXBCJJE-WDEREUQCSA-N 1 2 249.358 2.065 20 0 BEADLO CC(C)C[C@H](C)NC(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000612841029 360103587 /nfs/dbraw/zinc/10/35/87/360103587.db2.gz WJBVUHXSXBCJJE-WDEREUQCSA-N 1 2 249.358 2.065 20 0 BEADLO CC(C)C[C@H](C)NC(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000612841028 360103845 /nfs/dbraw/zinc/10/38/45/360103845.db2.gz WJBVUHXSXBCJJE-QWRGUYRKSA-N 1 2 249.358 2.065 20 0 BEADLO CC(C)C[C@H](C)NC(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000612841028 360103848 /nfs/dbraw/zinc/10/38/48/360103848.db2.gz WJBVUHXSXBCJJE-QWRGUYRKSA-N 1 2 249.358 2.065 20 0 BEADLO COC(=O)C[N@H+]1CC=C(c2cccc(C)c2)CC1 ZINC000092821746 360202026 /nfs/dbraw/zinc/20/20/26/360202026.db2.gz IITZWSAAFCJALF-UHFFFAOYSA-N 1 2 245.322 2.257 20 0 BEADLO COC(=O)C[N@@H+]1CC=C(c2cccc(C)c2)CC1 ZINC000092821746 360202031 /nfs/dbraw/zinc/20/20/31/360202031.db2.gz IITZWSAAFCJALF-UHFFFAOYSA-N 1 2 245.322 2.257 20 0 BEADLO c1coc(C[N@@H+]2CCOCC23CCC3)c1 ZINC000093509788 360254132 /nfs/dbraw/zinc/25/41/32/360254132.db2.gz WLIDRBGACHZGOQ-UHFFFAOYSA-N 1 2 207.273 2.035 20 0 BEADLO c1coc(C[N@H+]2CCOCC23CCC3)c1 ZINC000093509788 360254135 /nfs/dbraw/zinc/25/41/35/360254135.db2.gz WLIDRBGACHZGOQ-UHFFFAOYSA-N 1 2 207.273 2.035 20 0 BEADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cc[nH]n2)n1 ZINC000093453643 360245105 /nfs/dbraw/zinc/24/51/05/360245105.db2.gz RYXIGJMHCOKIKL-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cc[nH]n2)n1 ZINC000093453643 360245109 /nfs/dbraw/zinc/24/51/09/360245109.db2.gz RYXIGJMHCOKIKL-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO CCC[NH+](CCC)Cc1noc(CC)n1 ZINC000097153320 360362234 /nfs/dbraw/zinc/36/22/34/360362234.db2.gz TWVBRAZWHGFDIG-UHFFFAOYSA-N 1 2 211.309 2.254 20 0 BEADLO Cc1cnc([C@H](C)NCc2cn(C)c[nH+]2)s1 ZINC000309416582 491148938 /nfs/dbraw/zinc/14/89/38/491148938.db2.gz GZBBLUFYOBEPNP-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO Cc1cnc([C@H](C)[NH2+]Cc2cn(C)cn2)s1 ZINC000309416582 491148939 /nfs/dbraw/zinc/14/89/39/491148939.db2.gz GZBBLUFYOBEPNP-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO O=C(CCCn1cc[nH+]c1)N[C@H]1CCCC12CC2 ZINC000633769369 360454959 /nfs/dbraw/zinc/45/49/59/360454959.db2.gz MKQXXGRCIORLCR-LBPRGKRZSA-N 1 2 247.342 2.112 20 0 BEADLO CC(C)(C)CC(=O)NCCCCn1cc[nH+]c1 ZINC000060408333 360463859 /nfs/dbraw/zinc/46/38/59/360463859.db2.gz QWMQLPBTNSUFHL-UHFFFAOYSA-N 1 2 237.347 2.216 20 0 BEADLO CC(C)n1ncnc1C[NH2+][C@@H]1CCCC[C@H]1F ZINC000631162790 360638808 /nfs/dbraw/zinc/63/88/08/360638808.db2.gz GSPNECPSJOOKFJ-GHMZBOCLSA-N 1 2 240.326 2.229 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)CC1CCCCC1 ZINC000061512839 360639342 /nfs/dbraw/zinc/63/93/42/360639342.db2.gz YHTRLZXYNPZFDT-UHFFFAOYSA-N 1 2 249.358 2.349 20 0 BEADLO c1n[nH]cc1C[NH2+]Cc1nc(C2CC2)cs1 ZINC000309543469 491150928 /nfs/dbraw/zinc/15/09/28/491150928.db2.gz GYDIQMYIVNBQJX-UHFFFAOYSA-N 1 2 234.328 2.033 20 0 BEADLO C[C@@H]1C[C@@H](Nc2c[nH+]cc(N(C)C)c2)[C@@H](C)O1 ZINC000631203591 360900325 /nfs/dbraw/zinc/90/03/25/360900325.db2.gz QQJZTAWVRUHPCC-GIPNMCIBSA-N 1 2 235.331 2.125 20 0 BEADLO C[C@@H]1C[C@H](Nc2c[nH+]cc(N(C)C)c2)[C@@H](C)O1 ZINC000631203589 360900477 /nfs/dbraw/zinc/90/04/77/360900477.db2.gz QQJZTAWVRUHPCC-BREBYQMCSA-N 1 2 235.331 2.125 20 0 BEADLO CCc1cc(N)nc(SC[C@H]2C[C@@H]2C)[nH+]1 ZINC000629178768 360926479 /nfs/dbraw/zinc/92/64/79/360926479.db2.gz JHFBUXFYZRKASS-JGVFFNPUSA-N 1 2 223.345 2.200 20 0 BEADLO C[C@H](C(=O)N1CCn2c[nH+]cc2C1)C1CCCC1 ZINC000640412157 361203260 /nfs/dbraw/zinc/20/32/60/361203260.db2.gz LDKSFOGNJIIQDN-NSHDSACASA-N 1 2 247.342 2.052 20 0 BEADLO Cc1nc(C(C)(C)[NH2+][C@H]2C=CCCC2)no1 ZINC000066539492 361301915 /nfs/dbraw/zinc/30/19/15/361301915.db2.gz SUVXJWDTHYITQS-JTQLQIEISA-N 1 2 221.304 2.311 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2CC[C@@H]2C)c(C)c[nH+]1 ZINC000579095797 366708867 /nfs/dbraw/zinc/70/88/67/366708867.db2.gz PSVNWLSDEJQYNE-KWQFWETISA-N 1 2 233.315 2.040 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1nccc(N)n1)c1ccccc1 ZINC000579123377 366718305 /nfs/dbraw/zinc/71/83/05/366718305.db2.gz MJAJBHNLIJFSDE-MNOVXSKESA-N 1 2 242.326 2.301 20 0 BEADLO CCc1nc(C)c(C[N@@H+]2CCO[C@@H](CC)C2)o1 ZINC000428255968 201004159 /nfs/dbraw/zinc/00/41/59/201004159.db2.gz ZWGZZGHQKWIJIY-NSHDSACASA-N 1 2 238.331 2.156 20 0 BEADLO CCc1nc(C)c(C[N@H+]2CCO[C@@H](CC)C2)o1 ZINC000428255968 201004162 /nfs/dbraw/zinc/00/41/62/201004162.db2.gz ZWGZZGHQKWIJIY-NSHDSACASA-N 1 2 238.331 2.156 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+]2CCO[C@@H](C(C)C)C2)cn1 ZINC000428348992 201010582 /nfs/dbraw/zinc/01/05/82/201010582.db2.gz QJTHKVAAHYCDCR-TZMCWYRMSA-N 1 2 249.358 2.203 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+]2CCO[C@@H](C(C)C)C2)cn1 ZINC000428348992 201010583 /nfs/dbraw/zinc/01/05/83/201010583.db2.gz QJTHKVAAHYCDCR-TZMCWYRMSA-N 1 2 249.358 2.203 20 0 BEADLO Cc1cc(F)cc(NCc2cn(C)c[nH+]2)c1 ZINC000309777235 491156226 /nfs/dbraw/zinc/15/62/26/491156226.db2.gz QBYMFMSXBFFSCB-UHFFFAOYSA-N 1 2 219.263 2.480 20 0 BEADLO Cc1cnc([C@H](C)[N@H+]2CCO[C@H](C(C)C)C2)cn1 ZINC000428348984 201008836 /nfs/dbraw/zinc/00/88/36/201008836.db2.gz QJTHKVAAHYCDCR-JSGCOSHPSA-N 1 2 249.358 2.203 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+]2CCO[C@H](C(C)C)C2)cn1 ZINC000428348984 201008838 /nfs/dbraw/zinc/00/88/38/201008838.db2.gz QJTHKVAAHYCDCR-JSGCOSHPSA-N 1 2 249.358 2.203 20 0 BEADLO Cc1n[nH]cc1C[NH2+][C@@H](C)c1cscn1 ZINC000161762144 201009516 /nfs/dbraw/zinc/00/95/16/201009516.db2.gz DNOWGQQDFDJQNM-QMMMGPOBSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1nc(N(C)[C@H]2CC[C@@H](C)C2)cc[nH+]1 ZINC000428674813 201035129 /nfs/dbraw/zinc/03/51/29/201035129.db2.gz YGRYQCABCZSZGE-KOLCDFICSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2cn(C)nn2)c1C ZINC000428739836 201040062 /nfs/dbraw/zinc/04/00/62/201040062.db2.gz JFGFRCIOWMGTFE-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2cn(C)nn2)c1C ZINC000428739836 201040065 /nfs/dbraw/zinc/04/00/65/201040065.db2.gz JFGFRCIOWMGTFE-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1nocc1C[NH2+]Cc1nccn1C(C)C ZINC000631219949 361368851 /nfs/dbraw/zinc/36/88/51/361368851.db2.gz NRUQKVREHZBPQO-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO CCC[N@H+](CC(N)=O)Cc1sccc1Cl ZINC000429165635 201076218 /nfs/dbraw/zinc/07/62/18/201076218.db2.gz TVGAXJLECIEMDU-UHFFFAOYSA-N 1 2 246.763 2.099 20 0 BEADLO CCC[N@@H+](CC(N)=O)Cc1sccc1Cl ZINC000429165635 201076221 /nfs/dbraw/zinc/07/62/21/201076221.db2.gz TVGAXJLECIEMDU-UHFFFAOYSA-N 1 2 246.763 2.099 20 0 BEADLO C[C@H]([NH2+]Cc1ccc(CO)o1)c1cscn1 ZINC000579376059 366774919 /nfs/dbraw/zinc/77/49/19/366774919.db2.gz YOFQQQQVXDDSFS-QMMMGPOBSA-N 1 2 238.312 2.079 20 0 BEADLO CCc1nc(C[N@H+](C)[C@H]2CC[C@@H](C)C2)no1 ZINC000429567665 201117757 /nfs/dbraw/zinc/11/77/57/201117757.db2.gz MLSPUFJGFIHEKO-ZJUUUORDSA-N 1 2 223.320 2.252 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@H]2CC[C@@H](C)C2)no1 ZINC000429567665 201117758 /nfs/dbraw/zinc/11/77/58/201117758.db2.gz MLSPUFJGFIHEKO-ZJUUUORDSA-N 1 2 223.320 2.252 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+]1CCc2cccc(C)c2C1 ZINC000429566903 201117809 /nfs/dbraw/zinc/11/78/09/201117809.db2.gz WFMKZKSWYWFXAN-LBPRGKRZSA-N 1 2 247.338 2.305 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+]1CCc2cccc(C)c2C1 ZINC000429566903 201117813 /nfs/dbraw/zinc/11/78/13/201117813.db2.gz WFMKZKSWYWFXAN-LBPRGKRZSA-N 1 2 247.338 2.305 20 0 BEADLO Cc1cccn2c(CNc3nncs3)c[nH+]c12 ZINC000181446304 366811822 /nfs/dbraw/zinc/81/18/22/366811822.db2.gz WEDSSNKFYJSJHY-UHFFFAOYSA-N 1 2 245.311 2.106 20 0 BEADLO c1cc2[nH+]ccc(NCCc3nc[nH]n3)c2s1 ZINC000433422705 201185739 /nfs/dbraw/zinc/18/57/39/201185739.db2.gz GSSRQHNVJITHSO-UHFFFAOYSA-N 1 2 245.311 2.069 20 0 BEADLO CS[C@H]1CC[N@H+](Cc2noc(C(C)C)n2)C1 ZINC000448545982 201197381 /nfs/dbraw/zinc/19/73/81/201197381.db2.gz QWCOHTIWQQJFAM-VIFPVBQESA-N 1 2 241.360 2.130 20 0 BEADLO CS[C@H]1CC[N@@H+](Cc2noc(C(C)C)n2)C1 ZINC000448545982 201197384 /nfs/dbraw/zinc/19/73/84/201197384.db2.gz QWCOHTIWQQJFAM-VIFPVBQESA-N 1 2 241.360 2.130 20 0 BEADLO CSCC[N@H+](C)Cc1nc(CC(C)C)no1 ZINC000152449500 201198633 /nfs/dbraw/zinc/19/86/33/201198633.db2.gz ODRSTHMFKCPETE-UHFFFAOYSA-N 1 2 243.376 2.063 20 0 BEADLO CSCC[N@@H+](C)Cc1nc(CC(C)C)no1 ZINC000152449500 201198635 /nfs/dbraw/zinc/19/86/35/201198635.db2.gz ODRSTHMFKCPETE-UHFFFAOYSA-N 1 2 243.376 2.063 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N1CCCC2(CC2)CC1 ZINC000629644402 361532840 /nfs/dbraw/zinc/53/28/40/361532840.db2.gz XHHQGEKOLNSLSQ-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N1CCCC2(CC2)CC1 ZINC000629644402 361532848 /nfs/dbraw/zinc/53/28/48/361532848.db2.gz XHHQGEKOLNSLSQ-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO Cc1[nH]cc(-c2ccc(N3CCCC3)nc2)[nH+]1 ZINC000629710608 361646421 /nfs/dbraw/zinc/64/64/21/361646421.db2.gz UMTUPEBTWNMQBE-UHFFFAOYSA-N 1 2 228.299 2.380 20 0 BEADLO c1ccc(OCC2CC2)c(C[NH+]2CCOCC2)c1 ZINC000154509067 201282149 /nfs/dbraw/zinc/28/21/49/201282149.db2.gz FQAZVAQZHCBFLP-UHFFFAOYSA-N 1 2 247.338 2.308 20 0 BEADLO C[C@H]1CCC[C@@]1(C)C(=O)NCCCn1cc[nH+]c1 ZINC000448564603 201288318 /nfs/dbraw/zinc/28/83/18/201288318.db2.gz HDXBXTWMOUQNQN-GXTWGEPZSA-N 1 2 249.358 2.216 20 0 BEADLO CCCn1nc(C)c(-c2ccc(NC)[nH+]c2)c1C ZINC000629735667 361672086 /nfs/dbraw/zinc/67/20/86/361672086.db2.gz CFHAJKKYBSBMNW-UHFFFAOYSA-N 1 2 244.342 2.436 20 0 BEADLO Cc1cocc1-c1ccc(N[C@@H](C)CO)[nH+]c1 ZINC000629738558 361675277 /nfs/dbraw/zinc/67/52/77/361675277.db2.gz OUDKGLRGPZPPRI-JTQLQIEISA-N 1 2 232.283 2.443 20 0 BEADLO CCNc1ccc(-c2cc(C)nn2CC)c[nH+]1 ZINC000629745090 361679616 /nfs/dbraw/zinc/67/96/16/361679616.db2.gz URHAYQLIQHTVHA-UHFFFAOYSA-N 1 2 230.315 2.127 20 0 BEADLO FC1C[NH+](CCCCOc2ccccc2)C1 ZINC000437801478 201375124 /nfs/dbraw/zinc/37/51/24/201375124.db2.gz PDJYZPWDMXWWGR-UHFFFAOYSA-N 1 2 223.291 2.499 20 0 BEADLO CC[N@H+](CC[C@H]1CCOC1)CC(F)F ZINC000437995917 201384233 /nfs/dbraw/zinc/38/42/33/201384233.db2.gz JYUQBAGGNZKDSA-VIFPVBQESA-N 1 2 207.264 2.000 20 0 BEADLO CC[N@@H+](CC[C@H]1CCOC1)CC(F)F ZINC000437995917 201384237 /nfs/dbraw/zinc/38/42/37/201384237.db2.gz JYUQBAGGNZKDSA-VIFPVBQESA-N 1 2 207.264 2.000 20 0 BEADLO CCc1noc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)n1 ZINC000067966731 370726896 /nfs/dbraw/zinc/72/68/96/370726896.db2.gz PNELVCVICSRISE-NSHDSACASA-N 1 2 246.314 2.297 20 0 BEADLO CCc1noc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)n1 ZINC000067966731 370726901 /nfs/dbraw/zinc/72/69/01/370726901.db2.gz PNELVCVICSRISE-NSHDSACASA-N 1 2 246.314 2.297 20 0 BEADLO CC[C@](C)(NC(=O)CCc1c[nH+]cn1C)C1CC1 ZINC000618962046 364399693 /nfs/dbraw/zinc/39/96/93/364399693.db2.gz UDCMPTNCWUIXEG-AWEZNQCLSA-N 1 2 249.358 2.048 20 0 BEADLO Cc1cc(N)nc(S[C@@H](C)C(F)(F)F)[nH+]1 ZINC000134584931 541358807 /nfs/dbraw/zinc/35/88/07/541358807.db2.gz UHIPHVRUMKBKDZ-YFKPBYRVSA-N 1 2 237.250 2.410 20 0 BEADLO CC[C@@](C)(NC(=O)CCc1c[nH+]c[nH]1)C1CC1 ZINC000618962766 364423678 /nfs/dbraw/zinc/42/36/78/364423678.db2.gz XHAXTMSBBOSELZ-CYBMUJFWSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@@](C)(NC(=O)CCc1c[nH]c[nH+]1)C1CC1 ZINC000618962766 364423684 /nfs/dbraw/zinc/42/36/84/364423684.db2.gz XHAXTMSBBOSELZ-CYBMUJFWSA-N 1 2 235.331 2.037 20 0 BEADLO Cc1cc(N)nc(SCc2ccncc2)[nH+]1 ZINC000077896787 364430213 /nfs/dbraw/zinc/43/02/13/364430213.db2.gz HIDFYTQDPWQRJK-UHFFFAOYSA-N 1 2 232.312 2.055 20 0 BEADLO C[C@@H](NC(=O)[C@]1(C)CCC[C@H]1C)c1[nH]cc[nH+]1 ZINC000615157669 364547879 /nfs/dbraw/zinc/54/78/79/364547879.db2.gz FGMOKXJFARTYOB-GIPNMCIBSA-N 1 2 235.331 2.413 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)[C@@H]1CCC1(C)C ZINC000615233568 364649533 /nfs/dbraw/zinc/64/95/33/364649533.db2.gz JOHIADWLIHDPLH-NSHDSACASA-N 1 2 248.326 2.143 20 0 BEADLO COc1cc(C[NH2+][C@H]2CCCC2(F)F)sn1 ZINC000399066691 364762202 /nfs/dbraw/zinc/76/22/02/364762202.db2.gz QOEPAUFDPJECNB-QMMMGPOBSA-N 1 2 248.298 2.429 20 0 BEADLO CCc1nnc(C[NH2+]Cc2ccc(C)c(F)c2)[nH]1 ZINC000296207508 364782368 /nfs/dbraw/zinc/78/23/68/364782368.db2.gz ZOJZBYQGQODBRO-UHFFFAOYSA-N 1 2 248.305 2.104 20 0 BEADLO CC(C)=CCNC(=O)Nc1cc(C)[nH+]cc1C ZINC000573656682 364885515 /nfs/dbraw/zinc/88/55/15/364885515.db2.gz HIHCIBJFTPEDGK-UHFFFAOYSA-N 1 2 233.315 2.208 20 0 BEADLO CC(C)=CC[N@@H+]1Cc2ccccc2NC(=O)C1 ZINC000573739786 364906778 /nfs/dbraw/zinc/90/67/78/364906778.db2.gz CPICQLDQPPYMSU-UHFFFAOYSA-N 1 2 230.311 2.407 20 0 BEADLO CC(C)=CC[N@H+]1Cc2ccccc2NC(=O)C1 ZINC000573739786 364906783 /nfs/dbraw/zinc/90/67/83/364906783.db2.gz CPICQLDQPPYMSU-UHFFFAOYSA-N 1 2 230.311 2.407 20 0 BEADLO CCc1nocc1C[N@@H+]1CCC[C@@H](F)C1 ZINC000574092392 364985760 /nfs/dbraw/zinc/98/57/60/364985760.db2.gz PNHAHVRMPNGETK-SNVBAGLBSA-N 1 2 212.268 2.171 20 0 BEADLO CCc1nocc1C[N@H+]1CCC[C@@H](F)C1 ZINC000574092392 364985767 /nfs/dbraw/zinc/98/57/67/364985767.db2.gz PNHAHVRMPNGETK-SNVBAGLBSA-N 1 2 212.268 2.171 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CC[C@@H](C)[C@H]1C ZINC000574465667 365068871 /nfs/dbraw/zinc/06/88/71/365068871.db2.gz OMQZCIGZYUOSDK-PSASIEDQSA-N 1 2 205.305 2.328 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CC[C@H](C)[C@H]1C ZINC000574465669 365069760 /nfs/dbraw/zinc/06/97/60/365069760.db2.gz OMQZCIGZYUOSDK-WCBMZHEXSA-N 1 2 205.305 2.328 20 0 BEADLO C[C@H](CC(=O)N(C)CC(C)(C)C)n1cc[nH+]c1 ZINC000574330850 365038082 /nfs/dbraw/zinc/03/80/82/365038082.db2.gz YYJILALFIAYBGH-LLVKDONJSA-N 1 2 237.347 2.339 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)N2CCC2(C)C)c2[nH+]ccn21 ZINC000574537584 365086364 /nfs/dbraw/zinc/08/63/64/365086364.db2.gz OXPMXEWENAIRTJ-ZJUUUORDSA-N 1 2 248.330 2.083 20 0 BEADLO C[C@H]1C[C@H](NC(=O)N2CCC2(C)C)c2[nH+]ccn21 ZINC000574537579 365086741 /nfs/dbraw/zinc/08/67/41/365086741.db2.gz OXPMXEWENAIRTJ-UWVGGRQHSA-N 1 2 248.330 2.083 20 0 BEADLO CCCc1[nH]ccc1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000574702751 365126760 /nfs/dbraw/zinc/12/67/60/365126760.db2.gz FLPAVGKLCCSDHY-SECBINFHSA-N 1 2 246.314 2.181 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1CCCCC[C@@H]1C ZINC000574769074 365141221 /nfs/dbraw/zinc/14/12/21/365141221.db2.gz RTLZOXVDPJGNCS-RYUDHWBXSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1CCCCC[C@@H]1C ZINC000574769074 365141225 /nfs/dbraw/zinc/14/12/25/365141225.db2.gz RTLZOXVDPJGNCS-RYUDHWBXSA-N 1 2 249.358 2.379 20 0 BEADLO Cc1c[nH+]c(C)nc1NC[C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000574770032 365141802 /nfs/dbraw/zinc/14/18/02/365141802.db2.gz GCHXLBPVZXUKOZ-PTEHBNRSSA-N 1 2 249.358 2.131 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CCCCC[C@H]1C ZINC000574769075 365141821 /nfs/dbraw/zinc/14/18/21/365141821.db2.gz RTLZOXVDPJGNCS-VXGBXAGGSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CCCCC[C@H]1C ZINC000574769075 365141828 /nfs/dbraw/zinc/14/18/28/365141828.db2.gz RTLZOXVDPJGNCS-VXGBXAGGSA-N 1 2 249.358 2.379 20 0 BEADLO CC(C)c1nnc(N(C)Cc2[nH]cc[nH+]2)s1 ZINC000575238299 365264575 /nfs/dbraw/zinc/26/45/75/365264575.db2.gz GUSRKAKLHUDMGW-UHFFFAOYSA-N 1 2 237.332 2.021 20 0 BEADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1ncccn1 ZINC000192041161 365270645 /nfs/dbraw/zinc/27/06/45/365270645.db2.gz HZJARRRESVYHSO-LBPRGKRZSA-N 1 2 239.322 2.423 20 0 BEADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1ncccn1 ZINC000192041161 365270647 /nfs/dbraw/zinc/27/06/47/365270647.db2.gz HZJARRRESVYHSO-LBPRGKRZSA-N 1 2 239.322 2.423 20 0 BEADLO Cc1ncc(C(=O)Nc2cc[nH+]c(C)c2)c(C)n1 ZINC000182319598 366885364 /nfs/dbraw/zinc/88/53/64/366885364.db2.gz HNZIZFDRVCZGOC-UHFFFAOYSA-N 1 2 242.282 2.049 20 0 BEADLO COC[C@@H](NCc1[nH]c(C)c(C)[nH+]1)c1ccco1 ZINC000575762788 365357968 /nfs/dbraw/zinc/35/79/68/365357968.db2.gz GPILBOHBUNISLS-LLVKDONJSA-N 1 2 249.314 2.097 20 0 BEADLO COC[C@H](NCc1[nH]c(C)c(C)[nH+]1)c1ccco1 ZINC000575762789 365357979 /nfs/dbraw/zinc/35/79/79/365357979.db2.gz GPILBOHBUNISLS-NSHDSACASA-N 1 2 249.314 2.097 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@@H](C)[C@@H]2C)no1 ZINC000172859464 365383829 /nfs/dbraw/zinc/38/38/29/365383829.db2.gz QQAXSGPRRHMYSW-ZJUUUORDSA-N 1 2 223.320 2.252 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@@H](C)[C@@H]2C)no1 ZINC000172859464 365383832 /nfs/dbraw/zinc/38/38/32/365383832.db2.gz QQAXSGPRRHMYSW-ZJUUUORDSA-N 1 2 223.320 2.252 20 0 BEADLO CCC[C@H](C)C[N@@H+]1CCOCC(F)(F)C1 ZINC000575929861 365418294 /nfs/dbraw/zinc/41/82/94/365418294.db2.gz SBRUKBHCPWTPRC-JTQLQIEISA-N 1 2 221.291 2.390 20 0 BEADLO CCC[C@H](C)C[N@H+]1CCOCC(F)(F)C1 ZINC000575929861 365418300 /nfs/dbraw/zinc/41/83/00/365418300.db2.gz SBRUKBHCPWTPRC-JTQLQIEISA-N 1 2 221.291 2.390 20 0 BEADLO CC1=C(C)CN(C(=O)C[C@H](C)n2cc[nH+]c2)CC1 ZINC000575928450 365418509 /nfs/dbraw/zinc/41/85/09/365418509.db2.gz LXIYBUBDXFCKQY-ZDUSSCGKSA-N 1 2 247.342 2.403 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)C[C@@H]1CCC2(CCCC2)O1 ZINC000575884076 365405256 /nfs/dbraw/zinc/40/52/56/365405256.db2.gz KEVQBMGIJPUCQC-ZDUSSCGKSA-N 1 2 249.358 2.333 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)C[C@@H]1CCC2(CCCC2)O1 ZINC000575884076 365405261 /nfs/dbraw/zinc/40/52/61/365405261.db2.gz KEVQBMGIJPUCQC-ZDUSSCGKSA-N 1 2 249.358 2.333 20 0 BEADLO CC[C@@H]([NH2+]Cc1n[nH]c(=O)[nH]1)c1ccc(C)cc1 ZINC000341030922 365511493 /nfs/dbraw/zinc/51/14/93/365511493.db2.gz BPCRMWHKKIHRAE-LLVKDONJSA-N 1 2 246.314 2.060 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)c2ccoc2C)[nH+]1 ZINC000576114324 365491358 /nfs/dbraw/zinc/49/13/58/365491358.db2.gz RYJJVZIEUDHQQH-UHFFFAOYSA-N 1 2 247.298 2.285 20 0 BEADLO CCC[C@H](CC)NC(=O)[C@H]1CCc2c[nH+]cn2C1 ZINC000576111315 365492086 /nfs/dbraw/zinc/49/20/86/365492086.db2.gz UEGIWCOQFKCGFC-RYUDHWBXSA-N 1 2 249.358 2.140 20 0 BEADLO CC[C@@H](NC(=O)C[NH+]1CC(C)(C)C1)C(C)(C)C ZINC000579610754 366907026 /nfs/dbraw/zinc/90/70/26/366907026.db2.gz JOYXDKRGOUBFFX-LLVKDONJSA-N 1 2 240.391 2.269 20 0 BEADLO C[C@H](Nc1ccc(N2CCOCC2)c[nH+]1)C1CC1 ZINC000182870492 366953633 /nfs/dbraw/zinc/95/36/33/366953633.db2.gz GHBFNBBMDQCOKQ-NSHDSACASA-N 1 2 247.342 2.129 20 0 BEADLO COc1ccc(C[NH2+][C@H](C)c2ncc[nH]2)c(F)c1 ZINC000353647735 541484494 /nfs/dbraw/zinc/48/44/94/541484494.db2.gz SMQTUKXSSRUZDN-SECBINFHSA-N 1 2 249.289 2.408 20 0 BEADLO CCc1cc(N[C@H](C)[C@@H]2CCCCO2)nc[nH+]1 ZINC000383123683 541513598 /nfs/dbraw/zinc/51/35/98/541513598.db2.gz UBQNQBARBKBAGK-PWSUYJOCSA-N 1 2 235.331 2.409 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+](C[C@H](F)CC)C1CC1 ZINC000440512669 201484801 /nfs/dbraw/zinc/48/48/01/201484801.db2.gz NIATVKDLZLPVPD-NXEZZACHSA-N 1 2 231.311 2.151 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+](C[C@H](F)CC)C1CC1 ZINC000440512669 201484804 /nfs/dbraw/zinc/48/48/04/201484804.db2.gz NIATVKDLZLPVPD-NXEZZACHSA-N 1 2 231.311 2.151 20 0 BEADLO COCC1(CC(=O)Nc2ccc(C)[nH+]c2C)CC1 ZINC000579839799 367041850 /nfs/dbraw/zinc/04/18/50/367041850.db2.gz XGWSQDMVXHNGPJ-UHFFFAOYSA-N 1 2 248.326 2.454 20 0 BEADLO CCN(C(=O)C[C@@H](C)n1cc[nH+]c1)C1CCC1 ZINC000579957475 367102412 /nfs/dbraw/zinc/10/24/12/367102412.db2.gz CCRQFXINDWNZII-LLVKDONJSA-N 1 2 235.331 2.235 20 0 BEADLO CCn1nnc(C)c1CNc1ccc(C)[nH+]c1C ZINC000580873778 367193574 /nfs/dbraw/zinc/19/35/74/367193574.db2.gz MUSKKKJFCAFLKF-UHFFFAOYSA-N 1 2 245.330 2.230 20 0 BEADLO CC(C)(C)[C@H]1CCC[C@@H]1NC(=O)Cn1cc[nH+]c1 ZINC000581178436 367283841 /nfs/dbraw/zinc/28/38/41/367283841.db2.gz WBJCIDWTEGETCG-RYUDHWBXSA-N 1 2 249.358 2.214 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)[C@H](C)C(C)C)[nH+]1 ZINC000581137136 367274251 /nfs/dbraw/zinc/27/42/51/367274251.db2.gz MKFZTVQOQVGKCL-SNVBAGLBSA-N 1 2 237.347 2.362 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@H]2COCC2(C)C)[nH+]1 ZINC000581172370 367282190 /nfs/dbraw/zinc/28/21/90/367282190.db2.gz HXGYVLMLUGDSKD-JTQLQIEISA-N 1 2 246.314 2.103 20 0 BEADLO CNc1[nH+]cnc2c1cnn2CC1CCCC1 ZINC000194418569 367285201 /nfs/dbraw/zinc/28/52/01/367285201.db2.gz MBAOEMSDGKTLMH-UHFFFAOYSA-N 1 2 231.303 2.058 20 0 BEADLO CC[C@H](c1ccc(F)cc1)[N@H+](C)CC(=O)OC ZINC000194544369 367303476 /nfs/dbraw/zinc/30/34/76/367303476.db2.gz ORWGBGOLGSJKKS-GFCCVEGCSA-N 1 2 239.290 2.382 20 0 BEADLO CC[C@H](c1ccc(F)cc1)[N@@H+](C)CC(=O)OC ZINC000194544369 367303482 /nfs/dbraw/zinc/30/34/82/367303482.db2.gz ORWGBGOLGSJKKS-GFCCVEGCSA-N 1 2 239.290 2.382 20 0 BEADLO Cc1nnc(C[NH2+][C@@H](C)c2ccncc2)s1 ZINC000381316703 367380029 /nfs/dbraw/zinc/38/00/29/367380029.db2.gz TYCAHCVCLCMVIZ-QMMMGPOBSA-N 1 2 234.328 2.092 20 0 BEADLO Cn1cc[nH+]c1CN1CCc2c1cc(F)cc2F ZINC000195514738 367366289 /nfs/dbraw/zinc/36/62/89/367366289.db2.gz IDONVFDVHDGJEN-UHFFFAOYSA-N 1 2 249.264 2.261 20 0 BEADLO CCn1cc([C@H](C)[NH2+]CC(C)(F)F)cn1 ZINC000382018668 367480362 /nfs/dbraw/zinc/48/03/62/367480362.db2.gz PITYKDNXFBISRJ-QMMMGPOBSA-N 1 2 217.263 2.209 20 0 BEADLO CCc1noc(C)c1CNCc1[nH]c(C)c(C)[nH+]1 ZINC000581499763 367528227 /nfs/dbraw/zinc/52/82/27/367528227.db2.gz REZGHJYMYAEEQY-UHFFFAOYSA-N 1 2 248.330 2.175 20 0 BEADLO CCc1noc(C)c1C[NH2+]Cc1nc(C)c(C)[nH]1 ZINC000581499763 367528235 /nfs/dbraw/zinc/52/82/35/367528235.db2.gz REZGHJYMYAEEQY-UHFFFAOYSA-N 1 2 248.330 2.175 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CC(F)(F)C(F)(F)C1 ZINC000581835197 367839022 /nfs/dbraw/zinc/83/90/22/367839022.db2.gz PJWGJUGXTAWQNW-UHFFFAOYSA-N 1 2 249.211 2.184 20 0 BEADLO CCC[C@@H](O)C[N@H+](CC(F)F)C(C)C ZINC000386029009 367900222 /nfs/dbraw/zinc/90/02/22/367900222.db2.gz VARPADFPXPJUKD-SECBINFHSA-N 1 2 209.280 2.123 20 0 BEADLO CCC[C@@H](O)C[N@@H+](CC(F)F)C(C)C ZINC000386029009 367900225 /nfs/dbraw/zinc/90/02/25/367900225.db2.gz VARPADFPXPJUKD-SECBINFHSA-N 1 2 209.280 2.123 20 0 BEADLO Cc1ccc([C@@H](C)NC(=O)Cn2cc[nH+]c2)cc1 ZINC000075681984 367942762 /nfs/dbraw/zinc/94/27/62/367942762.db2.gz CTGGPCITHDILRL-GFCCVEGCSA-N 1 2 243.310 2.069 20 0 BEADLO O=C(CCn1cc[nH+]c1)Nc1ccccc1F ZINC000021916634 368171202 /nfs/dbraw/zinc/17/12/02/368171202.db2.gz RGVWOCYROIHGGE-UHFFFAOYSA-N 1 2 233.246 2.051 20 0 BEADLO CN(C)c1c[nH+]cc(NCC2(C)CCOCC2)c1 ZINC000630956085 368149378 /nfs/dbraw/zinc/14/93/78/368149378.db2.gz KGFUIPNNMJWLAD-UHFFFAOYSA-N 1 2 249.358 2.376 20 0 BEADLO CN(C)c1c[nH+]cc(NCC2(C)CC2)c1 ZINC000630956900 368152190 /nfs/dbraw/zinc/15/21/90/368152190.db2.gz XTPJMBOTHSFWCU-UHFFFAOYSA-N 1 2 205.305 2.360 20 0 BEADLO Cc1noc(C[N@@H+](C)Cc2ccc(F)cc2)n1 ZINC000042332480 368305728 /nfs/dbraw/zinc/30/57/28/368305728.db2.gz PMLJXNSEBDRJGJ-UHFFFAOYSA-N 1 2 235.262 2.149 20 0 BEADLO Cc1noc(C[N@H+](C)Cc2ccc(F)cc2)n1 ZINC000042332480 368305735 /nfs/dbraw/zinc/30/57/35/368305735.db2.gz PMLJXNSEBDRJGJ-UHFFFAOYSA-N 1 2 235.262 2.149 20 0 BEADLO CC[C@H](C)NC(=O)NCc1c[nH+]c(C)cc1C ZINC000454188481 202799317 /nfs/dbraw/zinc/79/93/17/202799317.db2.gz OHMOEIFWKCMTMI-JTQLQIEISA-N 1 2 235.331 2.296 20 0 BEADLO Cc1c[nH+]c(C)nc1N1C[C@H](C)S[C@@H](C)C1 ZINC000566630289 326070102 /nfs/dbraw/zinc/07/01/02/326070102.db2.gz RRVMQYNYNQYCMJ-UWVGGRQHSA-N 1 2 237.372 2.424 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2ccc(F)cc2)o1 ZINC000061778870 368570469 /nfs/dbraw/zinc/57/04/69/368570469.db2.gz XATYGKJJVGBNCI-UHFFFAOYSA-N 1 2 235.262 2.149 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2ccc(F)cc2)o1 ZINC000061778870 368570476 /nfs/dbraw/zinc/57/04/76/368570476.db2.gz XATYGKJJVGBNCI-UHFFFAOYSA-N 1 2 235.262 2.149 20 0 BEADLO CCC[C@@H]1[C@@H](C)CCCN1C(=O)Cn1cc[nH+]c1 ZINC000081473003 368601501 /nfs/dbraw/zinc/60/15/01/368601501.db2.gz UNEUSRYLMRZRFR-QWHCGFSZSA-N 1 2 249.358 2.310 20 0 BEADLO COC(=O)C[N@H+](Cc1ccc(C)s1)C(C)C ZINC000067461451 368690075 /nfs/dbraw/zinc/69/00/75/368690075.db2.gz FJSHRTDUHKZWEK-UHFFFAOYSA-N 1 2 241.356 2.440 20 0 BEADLO COC(=O)C[N@@H+](Cc1ccc(C)s1)C(C)C ZINC000067461451 368690080 /nfs/dbraw/zinc/69/00/80/368690080.db2.gz FJSHRTDUHKZWEK-UHFFFAOYSA-N 1 2 241.356 2.440 20 0 BEADLO c1cnc(NCCCCNc2cccc[nH+]2)nc1 ZINC000067448121 368688314 /nfs/dbraw/zinc/68/83/14/368688314.db2.gz GQLLTJGTHNHXHL-UHFFFAOYSA-N 1 2 243.314 2.176 20 0 BEADLO C[C@@H]1CCCC[C@]1(C)NC(=O)CCn1cc[nH+]c1 ZINC000457249428 203028109 /nfs/dbraw/zinc/02/81/09/203028109.db2.gz IWDKWWVNAZIUMT-OCCSQVGLSA-N 1 2 249.358 2.358 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@H](C)CC(C)(C)C ZINC000457189021 203015834 /nfs/dbraw/zinc/01/58/34/203015834.db2.gz GVTNLGWIXRPBJI-SECBINFHSA-N 1 2 237.347 2.202 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@H](C)CC(C)(C)C ZINC000457189021 203015837 /nfs/dbraw/zinc/01/58/37/203015837.db2.gz GVTNLGWIXRPBJI-SECBINFHSA-N 1 2 237.347 2.202 20 0 BEADLO CC[C@]1(C(C)C)C[C@@H]1NC(=O)c1c[nH+]c(C)[nH]1 ZINC000457316408 203037476 /nfs/dbraw/zinc/03/74/76/203037476.db2.gz ZWALUFSRJSDJDK-WCQYABFASA-N 1 2 235.331 2.273 20 0 BEADLO C[N@H+](CC(=O)OC(C)(C)C)Cc1ccccc1 ZINC000070923730 368766574 /nfs/dbraw/zinc/76/65/74/368766574.db2.gz DXYTUQGVHAFAKY-UHFFFAOYSA-N 1 2 235.327 2.460 20 0 BEADLO C[N@@H+](CC(=O)OC(C)(C)C)Cc1ccccc1 ZINC000070923730 368766577 /nfs/dbraw/zinc/76/65/77/368766577.db2.gz DXYTUQGVHAFAKY-UHFFFAOYSA-N 1 2 235.327 2.460 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1sccc1C ZINC000073405271 368804578 /nfs/dbraw/zinc/80/45/78/368804578.db2.gz ODSCRGOXAALAFP-SECBINFHSA-N 1 2 227.329 2.050 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1sccc1C ZINC000073405271 368804584 /nfs/dbraw/zinc/80/45/84/368804584.db2.gz ODSCRGOXAALAFP-SECBINFHSA-N 1 2 227.329 2.050 20 0 BEADLO c1c(CCNc2cccc[nH+]2)nc2ccccn12 ZINC000073448499 368806522 /nfs/dbraw/zinc/80/65/22/368806522.db2.gz XXHVRRFPPWZZKW-UHFFFAOYSA-N 1 2 238.294 2.384 20 0 BEADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccno2)no1 ZINC000074255571 368834861 /nfs/dbraw/zinc/83/48/61/368834861.db2.gz XOIGUGYZJVMEKF-GFCCVEGCSA-N 1 2 233.271 2.308 20 0 BEADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ccno2)no1 ZINC000074255571 368834866 /nfs/dbraw/zinc/83/48/66/368834866.db2.gz XOIGUGYZJVMEKF-GFCCVEGCSA-N 1 2 233.271 2.308 20 0 BEADLO OCCCNc1[nH+]ccc2ccc(F)cc21 ZINC000074389192 368841570 /nfs/dbraw/zinc/84/15/70/368841570.db2.gz VRBHPFRNZXZULW-UHFFFAOYSA-N 1 2 220.247 2.168 20 0 BEADLO CCN(C(=O)Cn1cc[nH+]c1)[C@@H]1CCCC[C@H]1C ZINC000073306491 368799014 /nfs/dbraw/zinc/79/90/14/368799014.db2.gz MTKVJUIBYAWVJT-CHWSQXEVSA-N 1 2 249.358 2.310 20 0 BEADLO Cc1cc(CNCc2c[nH+]cn2C(C)C)no1 ZINC000090208895 368974676 /nfs/dbraw/zinc/97/46/76/368974676.db2.gz VFMXPWOJGAWVTD-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO COc1cccc(NCc2c[nH+]cn2C)c1C ZINC000623645833 368966066 /nfs/dbraw/zinc/96/60/66/368966066.db2.gz PQCPYHBZYMKZCB-UHFFFAOYSA-N 1 2 231.299 2.349 20 0 BEADLO CC[C@@H](C)NC(=O)C[N@H+](C)Cc1ccsc1 ZINC000061800426 369037107 /nfs/dbraw/zinc/03/71/07/369037107.db2.gz JFELCHKYCLPCCM-SNVBAGLBSA-N 1 2 240.372 2.095 20 0 BEADLO CC[C@@H](C)NC(=O)C[N@@H+](C)Cc1ccsc1 ZINC000061800426 369037112 /nfs/dbraw/zinc/03/71/12/369037112.db2.gz JFELCHKYCLPCCM-SNVBAGLBSA-N 1 2 240.372 2.095 20 0 BEADLO COC(=O)[C@@](C)([NH2+][C@H]1C=CCCC1)C1CC1 ZINC000309950047 326176734 /nfs/dbraw/zinc/17/67/34/326176734.db2.gz FSALSZICEODKKP-AAEUAGOBSA-N 1 2 223.316 2.026 20 0 BEADLO Cc1cc(NC(=O)[C@H](C)CC(F)(F)F)cc[nH+]1 ZINC000457568480 203074804 /nfs/dbraw/zinc/07/48/04/203074804.db2.gz PIHUKTUSSUCKLO-SSDOTTSWSA-N 1 2 246.232 2.339 20 0 BEADLO Cn1c[nH+]c(CCNC(=O)CC2CCCCC2)c1 ZINC000457885254 203117516 /nfs/dbraw/zinc/11/75/16/203117516.db2.gz PZJKILHOEVGIIP-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO CCC[C@H](NC(=O)CCc1[nH]cc[nH+]1)C1CCC1 ZINC000458300475 203156555 /nfs/dbraw/zinc/15/65/55/203156555.db2.gz BVRFUQQUPFWISV-LBPRGKRZSA-N 1 2 249.358 2.427 20 0 BEADLO CCC1(NC(=O)NCc2c[nH+]c(C)cc2C)CC1 ZINC000459068154 203227698 /nfs/dbraw/zinc/22/76/98/203227698.db2.gz CFSBYWAFSHKSFU-UHFFFAOYSA-N 1 2 247.342 2.440 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)NC(C)(C)C ZINC000459055835 203229199 /nfs/dbraw/zinc/22/91/99/203229199.db2.gz JKXLOXWBDPHVOX-SECBINFHSA-N 1 2 238.335 2.062 20 0 BEADLO CC[C@H](OC)C(=O)Nc1c[nH+]c2c(C)cccn12 ZINC000619013782 369257563 /nfs/dbraw/zinc/25/75/63/369257563.db2.gz YTHCRDGFUNITIF-JTQLQIEISA-N 1 2 247.298 2.006 20 0 BEADLO Cc1cccn2c(NC(=O)CCCF)c[nH+]c12 ZINC000619016256 369257957 /nfs/dbraw/zinc/25/79/57/369257957.db2.gz ZPNCHGADEWHHPT-UHFFFAOYSA-N 1 2 235.262 2.331 20 0 BEADLO CCn1nncc1C[N@H+](C)Cc1cccc(F)c1 ZINC000459294754 203250307 /nfs/dbraw/zinc/25/03/07/203250307.db2.gz CTCNOLMUTKLOFX-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO CCn1nncc1C[N@@H+](C)Cc1cccc(F)c1 ZINC000459294754 203250311 /nfs/dbraw/zinc/25/03/11/203250311.db2.gz CTCNOLMUTKLOFX-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO Cc1cc(CNc2ccc(N(C)C)[nH+]c2)no1 ZINC000459359911 203267854 /nfs/dbraw/zinc/26/78/54/203267854.db2.gz NESJEIUOWYDCEQ-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@H]1C[C@@]1(C)C(C)C ZINC000459480262 203289715 /nfs/dbraw/zinc/28/97/15/203289715.db2.gz LGSKGEPABXUMSF-JSGCOSHPSA-N 1 2 247.342 2.368 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@H]1C[C@H]1CC(C)C ZINC000459486387 203290341 /nfs/dbraw/zinc/29/03/41/203290341.db2.gz SWLBHEPCISCHAU-DGCLKSJQSA-N 1 2 247.342 2.368 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@H]1C[C@]1(C)C(C)C ZINC000459480261 203290849 /nfs/dbraw/zinc/29/08/49/203290849.db2.gz LGSKGEPABXUMSF-GXTWGEPZSA-N 1 2 247.342 2.368 20 0 BEADLO COC1C[NH+](CCc2ccc(F)cc2Cl)C1 ZINC000459587474 203305592 /nfs/dbraw/zinc/30/55/92/203305592.db2.gz VIYVSKDDKIKFEY-UHFFFAOYSA-N 1 2 243.709 2.352 20 0 BEADLO CCCCCOC1C[NH+](Cc2cccn2C)C1 ZINC000459591923 203308466 /nfs/dbraw/zinc/30/84/66/203308466.db2.gz LWFQYZNZXOCURT-UHFFFAOYSA-N 1 2 236.359 2.416 20 0 BEADLO CCC(F)(F)C[NH2+]Cc1ccncc1 ZINC000623680215 369387960 /nfs/dbraw/zinc/38/79/60/369387960.db2.gz BGVOJWXVXLPGHU-UHFFFAOYSA-N 1 2 200.232 2.217 20 0 BEADLO CC(C)c1cnc(C[NH+]2CC(CCO)C2)s1 ZINC000459591375 203309786 /nfs/dbraw/zinc/30/97/86/203309786.db2.gz LMGHXKIQEFZNTF-UHFFFAOYSA-N 1 2 240.372 2.081 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@@H+]1CCCC(C)C ZINC000619433665 369352618 /nfs/dbraw/zinc/35/26/18/369352618.db2.gz JRDORRJQEMYQDK-QWRGUYRKSA-N 1 2 231.311 2.008 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@H+]1CCCC(C)C ZINC000619433665 369352623 /nfs/dbraw/zinc/35/26/23/369352623.db2.gz JRDORRJQEMYQDK-QWRGUYRKSA-N 1 2 231.311 2.008 20 0 BEADLO CCc1c(C)nn(-c2cc(C)[nH+]c(C)n2)c1C ZINC000107893050 369367789 /nfs/dbraw/zinc/36/77/89/369367789.db2.gz ZRDAPCRBLCCIAH-UHFFFAOYSA-N 1 2 230.315 2.458 20 0 BEADLO CCC(F)(F)CNCc1[nH]c(C)c(C)[nH+]1 ZINC000623679349 369378785 /nfs/dbraw/zinc/37/87/85/369378785.db2.gz SDVSZADTBUSUOC-UHFFFAOYSA-N 1 2 217.263 2.161 20 0 BEADLO CCOC1C[NH+](Cc2ccc(OC)cc2CC)C1 ZINC000459613684 203316245 /nfs/dbraw/zinc/31/62/45/203316245.db2.gz VSFNFQNHKMELDK-UHFFFAOYSA-N 1 2 249.354 2.478 20 0 BEADLO Cc1ccsc1C[NH+]1CC(OC(F)F)C1 ZINC000459622237 203319542 /nfs/dbraw/zinc/31/95/42/203319542.db2.gz CWVXBEGBVOHKQU-UHFFFAOYSA-N 1 2 233.283 2.480 20 0 BEADLO Cc1ccc(C[NH+]2CC(OC(F)F)C2)cc1 ZINC000459628296 203324631 /nfs/dbraw/zinc/32/46/31/203324631.db2.gz INGUWJHQHSPPNG-UHFFFAOYSA-N 1 2 227.254 2.418 20 0 BEADLO CCCCc1cc(NCc2ccccn2)nc[nH+]1 ZINC000631029751 370960308 /nfs/dbraw/zinc/96/03/08/370960308.db2.gz DSBIFOWVTYPORE-UHFFFAOYSA-N 1 2 242.326 2.248 20 0 BEADLO COCCNc1cc2ccccc2c[nH+]1 ZINC000631029836 370956466 /nfs/dbraw/zinc/95/64/66/370956466.db2.gz ISNRLFVBFGCHAH-UHFFFAOYSA-N 1 2 202.257 2.293 20 0 BEADLO CCCCc1cc(N[C@H](CC)CO)nc[nH+]1 ZINC000631032097 370969538 /nfs/dbraw/zinc/96/95/38/370969538.db2.gz SSMNALCUQXJWPB-SNVBAGLBSA-N 1 2 223.320 2.002 20 0 BEADLO CCCn1ncnc1C[N@H+](C)C1CC(C)(C)C1 ZINC000459774666 203366366 /nfs/dbraw/zinc/36/63/66/203366366.db2.gz WIQASDXNAXGKNJ-UHFFFAOYSA-N 1 2 236.363 2.309 20 0 BEADLO CCCn1ncnc1C[N@@H+](C)C1CC(C)(C)C1 ZINC000459774666 203366368 /nfs/dbraw/zinc/36/63/68/203366368.db2.gz WIQASDXNAXGKNJ-UHFFFAOYSA-N 1 2 236.363 2.309 20 0 BEADLO C[N@@H+]1CCCC[C@H]1C(=O)Nc1ccccc1F ZINC000082324153 370986847 /nfs/dbraw/zinc/98/68/47/370986847.db2.gz OTOPAZSHJBFVGR-LBPRGKRZSA-N 1 2 236.290 2.249 20 0 BEADLO C[N@H+]1CCCC[C@H]1C(=O)Nc1ccccc1F ZINC000082324153 370986853 /nfs/dbraw/zinc/98/68/53/370986853.db2.gz OTOPAZSHJBFVGR-LBPRGKRZSA-N 1 2 236.290 2.249 20 0 BEADLO CC[C@H]1C[C@@H](C)CN1C(=O)CCCn1cc[nH+]c1 ZINC000073344123 369585721 /nfs/dbraw/zinc/58/57/21/369585721.db2.gz ZQUJLQWCOCVWOA-OLZOCXBDSA-N 1 2 249.358 2.310 20 0 BEADLO C[C@@H](CNC(=O)Cn1cc[nH+]c1)C1CCCCC1 ZINC000620368324 369856065 /nfs/dbraw/zinc/85/60/65/369856065.db2.gz KKJGTRKWCVVWMF-LBPRGKRZSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@H](NC(=O)[C@@H](C)C(C)(C)C)c1[nH+]ccn1C ZINC000620600484 369950502 /nfs/dbraw/zinc/95/05/02/369950502.db2.gz OCBJFMJTUPTUGU-ZJUUUORDSA-N 1 2 237.347 2.280 20 0 BEADLO C[C@H](NC(=O)C12CCC(CC1)C2)c1[nH+]ccn1C ZINC000620604147 369951716 /nfs/dbraw/zinc/95/17/16/369951716.db2.gz PCUSAXTYZUBAKA-IFQILLTASA-N 1 2 247.342 2.178 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620604923 369953351 /nfs/dbraw/zinc/95/33/51/369953351.db2.gz XEUOHTZMVMMOBT-DCAQKATOSA-N 1 2 237.347 2.280 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620604922 369953501 /nfs/dbraw/zinc/95/35/01/369953501.db2.gz XEUOHTZMVMMOBT-AXFHLTTASA-N 1 2 237.347 2.280 20 0 BEADLO CCCC[C@H](C)C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620606493 369954508 /nfs/dbraw/zinc/95/45/08/369954508.db2.gz UQKZMVSXJPDUEJ-WDEREUQCSA-N 1 2 237.347 2.424 20 0 BEADLO Cc1csc(C(=O)N[C@@H](C)c2[nH+]ccn2C)c1 ZINC000620608971 369956545 /nfs/dbraw/zinc/95/65/45/369956545.db2.gz QNIKAYQPAWKPHE-VIFPVBQESA-N 1 2 249.339 2.281 20 0 BEADLO C[C@H](NC(=O)[C@@H]1CC[C@@H]2C[C@@H]2C1)c1[nH+]ccn1C ZINC000620610226 369956624 /nfs/dbraw/zinc/95/66/24/369956624.db2.gz GLRKRNYMMMSITN-IRCOFANPSA-N 1 2 247.342 2.034 20 0 BEADLO C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)c1[nH+]ccn1C ZINC000620611178 369957985 /nfs/dbraw/zinc/95/79/85/369957985.db2.gz ZXKBGYWEZMEIAU-COPLHBTASA-N 1 2 249.358 2.424 20 0 BEADLO C[C@H](NC(=O)[C@@H]1CCC[C@@H]2C[C@@H]21)c1[nH+]ccn1C ZINC000620611670 369958387 /nfs/dbraw/zinc/95/83/87/369958387.db2.gz NCTHWSBVFPEFFE-QCNOEVLYSA-N 1 2 247.342 2.034 20 0 BEADLO CC[C@H](OC)C(=O)Nc1ccn2cc(C)[nH+]c2c1 ZINC000620648885 369972238 /nfs/dbraw/zinc/97/22/38/369972238.db2.gz NPOZTRZJIWJHHT-NSHDSACASA-N 1 2 247.298 2.006 20 0 BEADLO Cc1cn2ccc(NC(=O)[C@H]3CC34CC4)cc2[nH+]1 ZINC000620647813 369972319 /nfs/dbraw/zinc/97/23/19/369972319.db2.gz KCVCZCZFOVRGIN-LLVKDONJSA-N 1 2 241.294 2.381 20 0 BEADLO CC[C@@H]1CCC[C@H](C)N1C(=O)Cc1c[nH+]cn1C ZINC000620577904 369935613 /nfs/dbraw/zinc/93/56/13/369935613.db2.gz QXNROIRLGLBDSJ-NWDGAFQWSA-N 1 2 249.358 2.142 20 0 BEADLO Cc1cc(C(=O)N[C@H](C)c2[nH+]ccn2C)c(C)o1 ZINC000620594703 369946347 /nfs/dbraw/zinc/94/63/47/369946347.db2.gz BFCAYUGYKQSNKK-SECBINFHSA-N 1 2 247.298 2.121 20 0 BEADLO C[C@@H](NC(=O)C1(C)CCCC1)c1[nH+]ccn1C ZINC000620595121 369947444 /nfs/dbraw/zinc/94/74/44/369947444.db2.gz IQEAXHIFMGBWPK-SNVBAGLBSA-N 1 2 235.331 2.178 20 0 BEADLO C[C@@H](CC(=O)N(C)C[C@H]1CC1(C)C)n1cc[nH+]c1 ZINC000621045616 370080939 /nfs/dbraw/zinc/08/09/39/370080939.db2.gz SNOWQLJHSSVJDL-NWDGAFQWSA-N 1 2 249.358 2.339 20 0 BEADLO Cc1cnc([C@H](C)[NH2+]Cc2nccnc2C)s1 ZINC000621339919 370273734 /nfs/dbraw/zinc/27/37/34/370273734.db2.gz PSMCCTGYNFMZJJ-JTQLQIEISA-N 1 2 248.355 2.401 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CC(CC2CC2)C1 ZINC000621448823 370356635 /nfs/dbraw/zinc/35/66/35/370356635.db2.gz VFXKJDMSGZYLBT-UHFFFAOYSA-N 1 2 245.326 2.076 20 0 BEADLO CC[C@@H]([NH2+]Cc1cccc2[nH]ccc21)C(=O)OC ZINC000310875214 370369498 /nfs/dbraw/zinc/36/94/98/370369498.db2.gz SKVYQPUUCORVQJ-GFCCVEGCSA-N 1 2 246.310 2.209 20 0 BEADLO CCC[C@@H](C)N(C)c1cc(-n2cc[nH+]c2)ncn1 ZINC000077189590 370398720 /nfs/dbraw/zinc/39/87/20/370398720.db2.gz CAYUOPGUYCYDMD-LLVKDONJSA-N 1 2 245.330 2.287 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2nccnc2C)nc1 ZINC000621724833 370477294 /nfs/dbraw/zinc/47/72/94/370477294.db2.gz VCHSEZTWQYTOHU-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2nccnc2C)nc1 ZINC000621724833 370477296 /nfs/dbraw/zinc/47/72/96/370477296.db2.gz VCHSEZTWQYTOHU-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO CCOc1cncc(C[N@@H+]2CC[C@H](F)C2)c1 ZINC000621728892 370478548 /nfs/dbraw/zinc/47/85/48/370478548.db2.gz BUSUNRPWHGPENS-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO CCOc1cncc(C[N@H+]2CC[C@H](F)C2)c1 ZINC000621728892 370478551 /nfs/dbraw/zinc/47/85/51/370478551.db2.gz BUSUNRPWHGPENS-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO CC(C)n1cc(C[NH+]2CC(CC3CC3)C2)nn1 ZINC000621740193 370498338 /nfs/dbraw/zinc/49/83/38/370498338.db2.gz CORZRVKFABYMID-UHFFFAOYSA-N 1 2 234.347 2.091 20 0 BEADLO CC(C)(C)n1cc(C[NH+]2CC(CC3CC3)C2)nn1 ZINC000621740568 370499874 /nfs/dbraw/zinc/49/98/74/370499874.db2.gz XFJHXLNSFDWQNM-UHFFFAOYSA-N 1 2 248.374 2.265 20 0 BEADLO CCc1cc(NC[C@H]2CCC[C@@H](O)C2)nc[nH+]1 ZINC000078304942 370550071 /nfs/dbraw/zinc/55/00/71/370550071.db2.gz VBXQRVFBJWKOES-CMPLNLGQSA-N 1 2 235.331 2.002 20 0 BEADLO CCc1cc(NCc2ncc(C)s2)nc[nH+]1 ZINC000078425445 370558713 /nfs/dbraw/zinc/55/87/13/370558713.db2.gz DKCJFFHFSFLRRZ-UHFFFAOYSA-N 1 2 234.328 2.416 20 0 BEADLO C[C@H]1CCCCN(C(=O)C(C)(C)c2c[nH+]c[nH]2)C1 ZINC000621958497 370621127 /nfs/dbraw/zinc/62/11/27/370621127.db2.gz LHSOKDWBVADUEM-NSHDSACASA-N 1 2 249.358 2.336 20 0 BEADLO CC(C)(C(=O)N[C@@H]1CCC(C)(C)C1)c1c[nH]c[nH+]1 ZINC000621939606 370609645 /nfs/dbraw/zinc/60/96/45/370609645.db2.gz JRKSOKMZQQOAJP-SNVBAGLBSA-N 1 2 249.358 2.382 20 0 BEADLO CCCCc1cc(NC(C)(C)CO)nc[nH+]1 ZINC000631046882 371059554 /nfs/dbraw/zinc/05/95/54/371059554.db2.gz JWFPJHUYNMEOTN-UHFFFAOYSA-N 1 2 223.320 2.002 20 0 BEADLO CC(C)(C)CCC(=O)NCCCn1cc[nH+]c1 ZINC000154667098 371141428 /nfs/dbraw/zinc/14/14/28/371141428.db2.gz LCSSBOPBJQDLFU-UHFFFAOYSA-N 1 2 237.347 2.216 20 0 BEADLO CCO[C@H]1CCCN(c2[nH+]cccc2OC)C1 ZINC000623890697 371141692 /nfs/dbraw/zinc/14/16/92/371141692.db2.gz UHROYHVUIPZIKK-NSHDSACASA-N 1 2 236.315 2.096 20 0 BEADLO COc1ccc[nH+]c1N1CCSC[C@@H](C)C1 ZINC000624156495 371351288 /nfs/dbraw/zinc/35/12/88/371351288.db2.gz CMCKKWPROYEDLQ-JTQLQIEISA-N 1 2 238.356 2.280 20 0 BEADLO CCC(F)(F)C[NH2+][C@@H](C)c1cn[nH]c1 ZINC000624148710 371346465 /nfs/dbraw/zinc/34/64/65/371346465.db2.gz LVOLKNHIEQMAKB-ZETCQYMHSA-N 1 2 203.236 2.106 20 0 BEADLO CC[C@H](C)C[C@H](CO)Nc1[nH+]cccc1OC ZINC000624330554 371483683 /nfs/dbraw/zinc/48/36/83/371483683.db2.gz YUJOFQLBICKFKQ-WDEREUQCSA-N 1 2 238.331 2.299 20 0 BEADLO CC(C)c1nc(NC[C@@H](C)C[C@H](C)O)cc[nH+]1 ZINC000156709074 371492520 /nfs/dbraw/zinc/49/25/20/371492520.db2.gz HHCOZSOVPWPIPP-QWRGUYRKSA-N 1 2 237.347 2.419 20 0 BEADLO COc1ccc[nH+]c1N1CC2CC1(C)C2 ZINC000624411784 371502543 /nfs/dbraw/zinc/50/25/43/371502543.db2.gz UKFCUYCZHVFJCM-UHFFFAOYSA-N 1 2 204.273 2.079 20 0 BEADLO CCO[C@H]1C[C@H](Nc2[nH+]cccc2OC)C1 ZINC000624393814 371497912 /nfs/dbraw/zinc/49/79/12/371497912.db2.gz LPYFLSKBICHJFN-MGCOHNPYSA-N 1 2 222.288 2.070 20 0 BEADLO CC[C@@H](CC(=O)N1CCc2[nH]c[nH+]c2C1)C(C)C ZINC000627367420 371584936 /nfs/dbraw/zinc/58/49/36/371584936.db2.gz TXELDFUTWVMSHJ-NSHDSACASA-N 1 2 249.358 2.367 20 0 BEADLO CC[C@@H](CC(=O)N1CCc2[nH+]c[nH]c2C1)C(C)C ZINC000627367420 371584943 /nfs/dbraw/zinc/58/49/43/371584943.db2.gz TXELDFUTWVMSHJ-NSHDSACASA-N 1 2 249.358 2.367 20 0 BEADLO C[C@H](C(=O)N1CCc2[nH]c[nH+]c2C1)C1CCCC1 ZINC000627369064 371587664 /nfs/dbraw/zinc/58/76/64/371587664.db2.gz JRLYQEMQOLUXJG-JTQLQIEISA-N 1 2 247.342 2.121 20 0 BEADLO C[C@H](C(=O)N1CCc2[nH+]c[nH]c2C1)C1CCCC1 ZINC000627369064 371587665 /nfs/dbraw/zinc/58/76/65/371587665.db2.gz JRLYQEMQOLUXJG-JTQLQIEISA-N 1 2 247.342 2.121 20 0 BEADLO CC1(C)CC[C@H](C(=O)N2CCc3[nH]c[nH+]c3C2)C1 ZINC000627370358 371588403 /nfs/dbraw/zinc/58/84/03/371588403.db2.gz WVHBOCYKIMUGGG-JTQLQIEISA-N 1 2 247.342 2.121 20 0 BEADLO CC1(C)CC[C@H](C(=O)N2CCc3[nH+]c[nH]c3C2)C1 ZINC000627370358 371588407 /nfs/dbraw/zinc/58/84/07/371588407.db2.gz WVHBOCYKIMUGGG-JTQLQIEISA-N 1 2 247.342 2.121 20 0 BEADLO CC[C@@H](C)CCC(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627371353 371589556 /nfs/dbraw/zinc/58/95/56/371589556.db2.gz BWVRNDQVJPLQBS-SNVBAGLBSA-N 1 2 235.331 2.121 20 0 BEADLO CC[C@@H](C)CCC(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627371353 371589563 /nfs/dbraw/zinc/58/95/63/371589563.db2.gz BWVRNDQVJPLQBS-SNVBAGLBSA-N 1 2 235.331 2.121 20 0 BEADLO CC[C@H](CC(C)C)C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627372945 371591950 /nfs/dbraw/zinc/59/19/50/371591950.db2.gz AYHKSZIRLNCPCD-LLVKDONJSA-N 1 2 249.358 2.367 20 0 BEADLO CC[C@H](CC(C)C)C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627372945 371591956 /nfs/dbraw/zinc/59/19/56/371591956.db2.gz AYHKSZIRLNCPCD-LLVKDONJSA-N 1 2 249.358 2.367 20 0 BEADLO CC(C)(C(=O)N1CCc2[nH]c[nH+]c2C1)C1CCC1 ZINC000627373305 371592852 /nfs/dbraw/zinc/59/28/52/371592852.db2.gz NGPUIXHNCNPWTK-UHFFFAOYSA-N 1 2 247.342 2.121 20 0 BEADLO CC(C)(C(=O)N1CCc2[nH+]c[nH]c2C1)C1CCC1 ZINC000627373305 371592857 /nfs/dbraw/zinc/59/28/57/371592857.db2.gz NGPUIXHNCNPWTK-UHFFFAOYSA-N 1 2 247.342 2.121 20 0 BEADLO CCCCc1cc(N[C@H](C)C[C@@H](C)O)nc[nH+]1 ZINC000631203340 372233315 /nfs/dbraw/zinc/23/33/15/372233315.db2.gz OVDQBNGRLRUCMG-GHMZBOCLSA-N 1 2 237.347 2.391 20 0 BEADLO Cc1ncc([C@@H](C)[NH2+]Cc2ncc[nH]2)s1 ZINC000631223409 372246786 /nfs/dbraw/zinc/24/67/86/372246786.db2.gz ALOCXYYHWIJKMK-SSDOTTSWSA-N 1 2 222.317 2.025 20 0 BEADLO c1nc(C[NH2+]Cc2cccc3c2CCOC3)co1 ZINC000631243770 372256490 /nfs/dbraw/zinc/25/64/90/372256490.db2.gz GQUCCNYKDIEUDE-UHFFFAOYSA-N 1 2 244.294 2.037 20 0 BEADLO Cc1cc(N(C)CCF)nc(C2CC2)[nH+]1 ZINC000631295407 372280561 /nfs/dbraw/zinc/28/05/61/372280561.db2.gz IHQDEYYMJOETPF-UHFFFAOYSA-N 1 2 209.268 2.068 20 0 BEADLO CN(Cc1ccns1)c1cc[nH+]c(C2CC2)n1 ZINC000631353953 372310014 /nfs/dbraw/zinc/31/00/14/372310014.db2.gz UQWZWMSGZUTSMC-UHFFFAOYSA-N 1 2 246.339 2.447 20 0 BEADLO c1ccc2cc(NCC3COC3)[nH+]cc2c1 ZINC000631391230 372332076 /nfs/dbraw/zinc/33/20/76/372332076.db2.gz FROQTMQCNGCJDT-UHFFFAOYSA-N 1 2 214.268 2.293 20 0 BEADLO CC(C)(F)CNc1cc[nH+]c2ccncc12 ZINC000631408433 372343716 /nfs/dbraw/zinc/34/37/16/372343716.db2.gz RGBUHLCNYLSPGE-UHFFFAOYSA-N 1 2 219.263 2.212 20 0 BEADLO Cc1cc(N2CC[C@@H](O)C[C@H]2C)nc(C2CC2)[nH+]1 ZINC000631434648 372361725 /nfs/dbraw/zinc/36/17/25/372361725.db2.gz UNZFNOKWLCKCPD-ZYHUDNBSSA-N 1 2 247.342 2.012 20 0 BEADLO Cc1ccc(CNc2cc[nH+]c(C3CC3)n2)o1 ZINC000631509963 372399593 /nfs/dbraw/zinc/39/95/93/372399593.db2.gz CMFJRZFLRLQUQB-UHFFFAOYSA-N 1 2 229.283 2.289 20 0 BEADLO Cc1nc(N[C@H](C)CC2CCC2)cc[nH+]1 ZINC000631518765 372405640 /nfs/dbraw/zinc/40/56/40/372405640.db2.gz WFBLBEYEUCKALP-SECBINFHSA-N 1 2 205.305 2.198 20 0 BEADLO CCc1nnc(C[N@@H+]2CCSC[C@@H]2C)s1 ZINC000680052863 487528154 /nfs/dbraw/zinc/52/81/54/487528154.db2.gz BDUQMNGCHYMRBA-QMMMGPOBSA-N 1 2 243.401 2.038 20 0 BEADLO CCc1nnc(C[N@H+]2CCSC[C@@H]2C)s1 ZINC000680052863 487528159 /nfs/dbraw/zinc/52/81/59/487528159.db2.gz BDUQMNGCHYMRBA-QMMMGPOBSA-N 1 2 243.401 2.038 20 0 BEADLO C[C@@H](Nc1cnn2c1CCCC2)c1[nH+]ccn1C ZINC000631714798 372520817 /nfs/dbraw/zinc/52/08/17/372520817.db2.gz VJUTVIVWPPFFEW-SNVBAGLBSA-N 1 2 245.330 2.126 20 0 BEADLO O=C(CCn1cc[nH+]c1)N1CCC2(CCCC2)C1 ZINC000377871584 181950666 /nfs/dbraw/zinc/95/06/66/181950666.db2.gz WDZRJZPFKDCOJI-UHFFFAOYSA-N 1 2 247.342 2.066 20 0 BEADLO FC(F)C[N@@H+]1CCCN(c2ccccc2)CC1 ZINC000171990853 372847702 /nfs/dbraw/zinc/84/77/02/372847702.db2.gz UJMPBAWPRDSHHE-UHFFFAOYSA-N 1 2 240.297 2.464 20 0 BEADLO FC(F)C[N@H+]1CCCN(c2ccccc2)CC1 ZINC000171990853 372847707 /nfs/dbraw/zinc/84/77/07/372847707.db2.gz UJMPBAWPRDSHHE-UHFFFAOYSA-N 1 2 240.297 2.464 20 0 BEADLO CC(C)[C@@H](C)N(C(=O)[C@H](C)n1cc[nH+]c1)C1CC1 ZINC000058262348 1172431504 /nfs/dbraw/zinc/43/15/04/1172431504.db2.gz RICPBBNSBDFQQP-NEPJUHHUSA-N 1 2 249.358 2.480 20 0 BEADLO O=C(Cc1ccoc1)Nc1cccc2[nH+]ccn21 ZINC000361492556 182056252 /nfs/dbraw/zinc/05/62/52/182056252.db2.gz JJDILSHMRMMEJJ-UHFFFAOYSA-N 1 2 241.250 2.109 20 0 BEADLO O=C(Cn1cc[nH+]c1)N1CCC[C@@H]2CCCC[C@@H]21 ZINC000266308911 182070924 /nfs/dbraw/zinc/07/09/24/182070924.db2.gz SJYIPWWPFDEBHR-STQMWFEESA-N 1 2 247.342 2.064 20 0 BEADLO CC1CN(C(=O)c2ccc(-c3c[nH]c[nH+]3)cc2)C1 ZINC000632766454 373133572 /nfs/dbraw/zinc/13/35/72/373133572.db2.gz DEBMPSRAWAUUKW-UHFFFAOYSA-N 1 2 241.294 2.169 20 0 BEADLO O=C(NC1CCCCC1)c1ccc2[nH+]ccn2c1 ZINC000057757303 182112948 /nfs/dbraw/zinc/11/29/48/182112948.db2.gz VJRYROKMXUWKEY-UHFFFAOYSA-N 1 2 243.310 2.397 20 0 BEADLO Cc1cc(C)c(C(=O)N(C)Cc2c[nH+]c[nH]2)s1 ZINC000633601950 373620141 /nfs/dbraw/zinc/62/01/41/373620141.db2.gz LUSLIYVIPHVUKR-UHFFFAOYSA-N 1 2 249.339 2.360 20 0 BEADLO Cc1cc(C)c(C(=O)N(C)Cc2c[nH]c[nH+]2)s1 ZINC000633601950 373620146 /nfs/dbraw/zinc/62/01/46/373620146.db2.gz LUSLIYVIPHVUKR-UHFFFAOYSA-N 1 2 249.339 2.360 20 0 BEADLO CC[C@@H](C)NC(=O)Cc1cn2cccc(C)c2[nH+]1 ZINC000041287526 374128686 /nfs/dbraw/zinc/12/86/86/374128686.db2.gz FOXHMTFUTFSSFO-LLVKDONJSA-N 1 2 245.326 2.100 20 0 BEADLO CCCCCC[NH2+][C@](CC)(COC)C(=O)OC ZINC001643329266 1172453765 /nfs/dbraw/zinc/45/37/65/1172453765.db2.gz FZQYQGDHJZRLIC-CYBMUJFWSA-N 1 2 245.363 2.125 20 0 BEADLO Cc1cc(NC(=O)Cc2[nH]c[nH+]c2C)cs1 ZINC000634424363 374248630 /nfs/dbraw/zinc/24/86/30/374248630.db2.gz VFBXUMNKTQGIPG-UHFFFAOYSA-N 1 2 235.312 2.269 20 0 BEADLO CC[C@@H](F)C[N@H+](CC(=O)OC)[C@@H](C)CC ZINC000440488020 206080012 /nfs/dbraw/zinc/08/00/12/206080012.db2.gz CMZSNELSFPXWNO-VHSXEESVSA-N 1 2 219.300 2.008 20 0 BEADLO CC[C@@H](F)C[N@@H+](CC(=O)OC)[C@@H](C)CC ZINC000440488020 206080016 /nfs/dbraw/zinc/08/00/16/206080016.db2.gz CMZSNELSFPXWNO-VHSXEESVSA-N 1 2 219.300 2.008 20 0 BEADLO C[C@@H]1CN(c2cc[nH+]c(C3CC3)n2)[C@H](C)[C@@H](C)O1 ZINC000445677469 206085642 /nfs/dbraw/zinc/08/56/42/206085642.db2.gz XLBCBGRXFNILOS-GMTAPVOTSA-N 1 2 247.342 2.356 20 0 BEADLO O=C(N[C@H]1CC=CCC1)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000370491141 182327138 /nfs/dbraw/zinc/32/71/38/182327138.db2.gz KNIZKYXNVQJEGU-QWRGUYRKSA-N 1 2 245.326 2.055 20 0 BEADLO O=C(N[C@H]1CC=CCC1)[C@H]1CCCc2[nH]c[nH+]c21 ZINC000370491141 182327140 /nfs/dbraw/zinc/32/71/40/182327140.db2.gz KNIZKYXNVQJEGU-QWRGUYRKSA-N 1 2 245.326 2.055 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)c1ccoc1 ZINC000357437912 182375203 /nfs/dbraw/zinc/37/52/03/182375203.db2.gz LOVYCAYURJNOHI-UHFFFAOYSA-N 1 2 227.223 2.180 20 0 BEADLO O=C(Nc1ccsc1)[C@@H]1CCc2[nH+]ccn2C1 ZINC000372470210 182390294 /nfs/dbraw/zinc/39/02/94/182390294.db2.gz DOQKNJVHTNPKHD-SECBINFHSA-N 1 2 247.323 2.146 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)[C@H]1CCSC1 ZINC000336278585 182385527 /nfs/dbraw/zinc/38/55/27/182385527.db2.gz SOFHRPCMHFZFQT-VIFPVBQESA-N 1 2 247.323 2.026 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)c1ccoc1 ZINC000355326560 182385667 /nfs/dbraw/zinc/38/56/67/182385667.db2.gz ZEDVEAAJKCWDIS-UHFFFAOYSA-N 1 2 227.223 2.180 20 0 BEADLO O=C(Nc1cc[nH+]cc1O)[C@H]1CC=CCC1 ZINC000109889241 182387884 /nfs/dbraw/zinc/38/78/84/182387884.db2.gz NODIZMXLOUUCQY-VIFPVBQESA-N 1 2 218.256 2.082 20 0 BEADLO OC1CC[NH+](Cc2cc(F)c(F)cc2F)CC1 ZINC000271041805 183028577 /nfs/dbraw/zinc/02/85/77/183028577.db2.gz OTGDQFAVUGYCEG-UHFFFAOYSA-N 1 2 245.244 2.061 20 0 BEADLO OC1CC[NH+](Cc2cc(Cl)ccc2F)CC1 ZINC000128063753 183029390 /nfs/dbraw/zinc/02/93/90/183029390.db2.gz BDSBAMTWOQXAHZ-UHFFFAOYSA-N 1 2 243.709 2.436 20 0 BEADLO OCC(F)(F)C[NH2+]Cc1cc(Cl)cs1 ZINC000193216480 183033152 /nfs/dbraw/zinc/03/31/52/183033152.db2.gz FOUGYZNQGNTJHG-UHFFFAOYSA-N 1 2 241.690 2.119 20 0 BEADLO OCCC[N@@H+]1Cc2cccc(Cl)c2C1 ZINC000287494826 183056812 /nfs/dbraw/zinc/05/68/12/183056812.db2.gz SZQONZPYCHZNOH-UHFFFAOYSA-N 1 2 211.692 2.038 20 0 BEADLO OCCC[N@H+]1Cc2cccc(Cl)c2C1 ZINC000287494826 183056816 /nfs/dbraw/zinc/05/68/16/183056816.db2.gz SZQONZPYCHZNOH-UHFFFAOYSA-N 1 2 211.692 2.038 20 0 BEADLO OCCC[C@@H]([NH2+]Cc1cocn1)c1ccccc1 ZINC000192317649 183062452 /nfs/dbraw/zinc/06/24/52/183062452.db2.gz KPWRSPRZRLQADU-CQSZACIVSA-N 1 2 246.310 2.278 20 0 BEADLO OC[C@@H]([NH2+]Cc1nccs1)c1ccsc1 ZINC000336656829 183109795 /nfs/dbraw/zinc/10/97/95/183109795.db2.gz AOCKWVIGFBADEH-SECBINFHSA-N 1 2 240.353 2.028 20 0 BEADLO OC[C@H](Cc1ccccc1)Nc1cccc[nH+]1 ZINC000063218579 183138280 /nfs/dbraw/zinc/13/82/80/183138280.db2.gz ZMFYVFSEJJNFNM-ZDUSSCGKSA-N 1 2 228.295 2.097 20 0 BEADLO OC[C@@H]1CCC[C@@H](CNc2cccc[nH+]2)C1 ZINC000348230932 183122541 /nfs/dbraw/zinc/12/25/41/183122541.db2.gz RQYNQMMATMPTJJ-VXGBXAGGSA-N 1 2 220.316 2.292 20 0 BEADLO OC[C@H]1CCC[C@@H](Nc2cc[nH+]c(C3CC3)n2)C1 ZINC000298160787 183151827 /nfs/dbraw/zinc/15/18/27/183151827.db2.gz DNRJUGNWOXOOFK-CMPLNLGQSA-N 1 2 247.342 2.317 20 0 BEADLO OCc1ccc(NCc2cccc(Cl)c2)[nH+]c1 ZINC000356310655 183162644 /nfs/dbraw/zinc/16/26/44/183162644.db2.gz VGCJURCPGDCWJO-UHFFFAOYSA-N 1 2 248.713 2.261 20 0 BEADLO OCc1ccc(NC/C=C\c2ccccc2)[nH+]c1 ZINC000356289301 183163029 /nfs/dbraw/zinc/16/30/29/183163029.db2.gz ALWRWOFDXAEWPU-DAXSKMNVSA-N 1 2 240.306 2.121 20 0 BEADLO OCc1ccc(NCc2ccc(Cl)o2)[nH+]c1 ZINC000309532443 183165813 /nfs/dbraw/zinc/16/58/13/183165813.db2.gz DHSNYBUBEGUOFT-UHFFFAOYSA-N 1 2 238.674 2.432 20 0 BEADLO OCc1ccc(NCc2cc(O)cc(F)c2)[nH+]c1 ZINC000356298221 183166117 /nfs/dbraw/zinc/16/61/17/183166117.db2.gz GJJXCJSYOYEJPH-UHFFFAOYSA-N 1 2 248.257 2.031 20 0 BEADLO OCc1ccc(NC[C@@H]2CC=CCC2)[nH+]c1 ZINC000284310920 183166384 /nfs/dbraw/zinc/16/63/84/183166384.db2.gz VSFOITYAZCGUKS-LLVKDONJSA-N 1 2 218.300 2.342 20 0 BEADLO O[C@@H](CCOCc1[nH]cc[nH+]1)c1ccccc1 ZINC000287564833 183173505 /nfs/dbraw/zinc/17/35/05/183173505.db2.gz PGDKGPWKVYNHAD-LBPRGKRZSA-N 1 2 232.283 2.050 20 0 BEADLO CCCN(C)C(=O)Nc1cc[nH+]cc1C ZINC000120597174 169057648 /nfs/dbraw/zinc/05/76/48/169057648.db2.gz RPACJQJGGVZTMS-UHFFFAOYSA-N 1 2 207.277 2.264 20 0 BEADLO O[C@H]1CC[C@H](Nc2cc[nH+]c(C3CC3)n2)CC1 ZINC000157571210 183203260 /nfs/dbraw/zinc/20/32/60/183203260.db2.gz AQAOMZXDWAHHST-PHIMTYICSA-N 1 2 233.315 2.069 20 0 BEADLO CCCN(C)C(=O)c1ccc2[nH+]c(C)n(C)c2c1 ZINC000336465664 169061868 /nfs/dbraw/zinc/06/18/68/169061868.db2.gz MRRCALOQPRYSIU-UHFFFAOYSA-N 1 2 245.326 2.364 20 0 BEADLO O[C@@H]1CCCC[C@H]1CNc1cc[nH+]c(C2CC2)n1 ZINC000156858761 183190274 /nfs/dbraw/zinc/19/02/74/183190274.db2.gz SUOZBZORQZQEIM-NWDGAFQWSA-N 1 2 247.342 2.317 20 0 BEADLO O[C@@H]1CCC[N@H+](Cc2cc(F)c(F)cc2F)C1 ZINC000158790750 183194617 /nfs/dbraw/zinc/19/46/17/183194617.db2.gz HTLGWBCXKOVMFQ-SECBINFHSA-N 1 2 245.244 2.061 20 0 BEADLO O[C@@H]1CCC[N@@H+](Cc2cc(F)c(F)cc2F)C1 ZINC000158790750 183194620 /nfs/dbraw/zinc/19/46/20/183194620.db2.gz HTLGWBCXKOVMFQ-SECBINFHSA-N 1 2 245.244 2.061 20 0 BEADLO O[C@H](CNc1ccc2ccccc2[nH+]1)C1CC1 ZINC000071306207 183224968 /nfs/dbraw/zinc/22/49/68/183224968.db2.gz SOIGOMOFKFZHKK-CYBMUJFWSA-N 1 2 228.295 2.418 20 0 BEADLO CCC[N@H+](C)[C@@H](C(=O)OC)c1ccccc1F ZINC000072583661 169086137 /nfs/dbraw/zinc/08/61/37/169086137.db2.gz QAFHBPIFIQJYGN-GFCCVEGCSA-N 1 2 239.290 2.382 20 0 BEADLO CCC[N@@H+](C)[C@@H](C(=O)OC)c1ccccc1F ZINC000072583661 169086142 /nfs/dbraw/zinc/08/61/42/169086142.db2.gz QAFHBPIFIQJYGN-GFCCVEGCSA-N 1 2 239.290 2.382 20 0 BEADLO CCCN(C)c1cc(NCC2CC2)[nH+]cn1 ZINC000270223168 169088464 /nfs/dbraw/zinc/08/84/64/169088464.db2.gz CMQCKFQQSMGTFZ-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO CCCN(C)c1cc(NCC2CC2)nc[nH+]1 ZINC000270223168 169088467 /nfs/dbraw/zinc/08/84/67/169088467.db2.gz CMQCKFQQSMGTFZ-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO O[C@H]1CC[C@@H](CNc2cc[nH+]c3ccncc23)C1 ZINC000276866933 183241428 /nfs/dbraw/zinc/24/14/28/183241428.db2.gz JCAFZECJKNBWBS-MNOVXSKESA-N 1 2 243.310 2.203 20 0 BEADLO Oc1ccc(C[NH2+]Cc2cscn2)cc1F ZINC000120503954 183270922 /nfs/dbraw/zinc/27/09/22/183270922.db2.gz FDETWMFAEXRGTC-UHFFFAOYSA-N 1 2 238.287 2.278 20 0 BEADLO Oc1cccc(C[N@@H+]2CCC=C(F)C2)c1 ZINC000272716326 183288720 /nfs/dbraw/zinc/28/87/20/183288720.db2.gz DMYOLYWPMFSSAC-UHFFFAOYSA-N 1 2 207.248 2.451 20 0 BEADLO Oc1cccc(C[N@H+]2CCC=C(F)C2)c1 ZINC000272716326 183288723 /nfs/dbraw/zinc/28/87/23/183288723.db2.gz DMYOLYWPMFSSAC-UHFFFAOYSA-N 1 2 207.248 2.451 20 0 BEADLO CCC[N@H+](CCCc1nc(C)no1)CC(F)F ZINC000336715082 169156057 /nfs/dbraw/zinc/15/60/57/169156057.db2.gz STVSQFNPVWTIKF-UHFFFAOYSA-N 1 2 247.289 2.288 20 0 BEADLO CCC[N@@H+](CCCc1nc(C)no1)CC(F)F ZINC000336715082 169156058 /nfs/dbraw/zinc/15/60/58/169156058.db2.gz STVSQFNPVWTIKF-UHFFFAOYSA-N 1 2 247.289 2.288 20 0 BEADLO Oc1cccc2c1CC[C@@H]2[NH2+]Cc1csnn1 ZINC000271890318 183295818 /nfs/dbraw/zinc/29/58/18/183295818.db2.gz RVBKQSNIAULVBH-NSHDSACASA-N 1 2 247.323 2.021 20 0 BEADLO c1csc(C2(NCc3[nH]cc[nH+]3)CCCC2)n1 ZINC000116373987 183324861 /nfs/dbraw/zinc/32/48/61/183324861.db2.gz UQFDOIULAYGALJ-UHFFFAOYSA-N 1 2 248.355 2.425 20 0 BEADLO c1c[nH]c(C[NH2+]C2(c3nccs3)CCCC2)n1 ZINC000116373987 183324864 /nfs/dbraw/zinc/32/48/64/183324864.db2.gz UQFDOIULAYGALJ-UHFFFAOYSA-N 1 2 248.355 2.425 20 0 BEADLO CCC[N@@H+]1CCCC[C@H]1c1noc(C)n1 ZINC000370740049 169191785 /nfs/dbraw/zinc/19/17/85/169191785.db2.gz MWUKTJMLCLFMBM-JTQLQIEISA-N 1 2 209.293 2.315 20 0 BEADLO CCC[N@H+]1CCCC[C@H]1c1noc(C)n1 ZINC000370740049 169191786 /nfs/dbraw/zinc/19/17/86/169191786.db2.gz MWUKTJMLCLFMBM-JTQLQIEISA-N 1 2 209.293 2.315 20 0 BEADLO c1c[nH+]c(COCCc2ccc3c(c2)CCO3)[nH]1 ZINC000272050982 183326654 /nfs/dbraw/zinc/32/66/54/183326654.db2.gz MZOAGZWNIJFYIO-UHFFFAOYSA-N 1 2 244.294 2.104 20 0 BEADLO c1cc(C[N@@H+]2CCCC[C@H]2c2cc[nH]n2)on1 ZINC000285213518 183342619 /nfs/dbraw/zinc/34/26/19/183342619.db2.gz ACUNAUMUSUPPFM-LBPRGKRZSA-N 1 2 232.287 2.125 20 0 BEADLO c1cc(C[N@H+]2CCCC[C@H]2c2cc[nH]n2)on1 ZINC000285213518 183342623 /nfs/dbraw/zinc/34/26/23/183342623.db2.gz ACUNAUMUSUPPFM-LBPRGKRZSA-N 1 2 232.287 2.125 20 0 BEADLO c1cc(C[NH2+]C[C@H]2CCC3(CCCCC3)O2)[nH]n1 ZINC000359812674 183350821 /nfs/dbraw/zinc/35/08/21/183350821.db2.gz WSSGWLHRQATFPJ-CYBMUJFWSA-N 1 2 249.358 2.381 20 0 BEADLO c1nc(C[NH2+]Cc2cccc3c2OCO3)cs1 ZINC000040667284 183352582 /nfs/dbraw/zinc/35/25/82/183352582.db2.gz HKRAXFIHYRONQC-UHFFFAOYSA-N 1 2 248.307 2.162 20 0 BEADLO c1cn(-c2cccc(N[C@H]3CCOC3)c2)c[nH+]1 ZINC000109429748 183358439 /nfs/dbraw/zinc/35/84/39/183358439.db2.gz IYXUJAUZZOVROY-LBPRGKRZSA-N 1 2 229.283 2.073 20 0 BEADLO c1cc(NCCC2CCOCC2)nc(C2CC2)[nH+]1 ZINC000358218373 183334236 /nfs/dbraw/zinc/33/42/36/183334236.db2.gz DGZQUCANOWWJIZ-UHFFFAOYSA-N 1 2 247.342 2.005 20 0 BEADLO c1cc(C[N@@H+]2CCC[C@@H]2c2ccncc2)no1 ZINC000153839785 183363517 /nfs/dbraw/zinc/36/35/17/183363517.db2.gz AFMSCTICMABQNG-CYBMUJFWSA-N 1 2 229.283 2.407 20 0 BEADLO c1cc(C[N@H+]2CCC[C@@H]2c2ccncc2)no1 ZINC000153839785 183363519 /nfs/dbraw/zinc/36/35/19/183363519.db2.gz AFMSCTICMABQNG-CYBMUJFWSA-N 1 2 229.283 2.407 20 0 BEADLO c1nc(C[NH+]2CCCCC2)nn1-c1ccccc1 ZINC000092793728 183386302 /nfs/dbraw/zinc/38/63/02/183386302.db2.gz ZZKUFKUMFMVXFA-UHFFFAOYSA-N 1 2 242.326 2.253 20 0 BEADLO c1cc2[nH+]ccc(NCC3CCOCC3)c2cn1 ZINC000267976835 183377290 /nfs/dbraw/zinc/37/72/90/183377290.db2.gz OEQUAZHWQNBNCV-UHFFFAOYSA-N 1 2 243.310 2.468 20 0 BEADLO CCCNC(=O)[C@@H](C)[N@@H+]1Cc2ccc(C)cc2C1 ZINC000361595121 169242561 /nfs/dbraw/zinc/24/25/61/169242561.db2.gz SJZCPDSJRIZSPX-GFCCVEGCSA-N 1 2 246.354 2.225 20 0 BEADLO CCCNC(=O)[C@@H](C)[N@H+]1Cc2ccc(C)cc2C1 ZINC000361595121 169242563 /nfs/dbraw/zinc/24/25/63/169242563.db2.gz SJZCPDSJRIZSPX-GFCCVEGCSA-N 1 2 246.354 2.225 20 0 BEADLO CCCNC(=O)[C@H]1CCc2[nH+]c(C(C)C)[nH]c2C1 ZINC000370223389 169249400 /nfs/dbraw/zinc/24/94/00/169249400.db2.gz CHNDJCLUYUIMBR-JTQLQIEISA-N 1 2 249.358 2.164 20 0 BEADLO CCCNC(=O)[C@H]1CCc2[nH]c(C(C)C)[nH+]c2C1 ZINC000370223389 169249402 /nfs/dbraw/zinc/24/94/02/169249402.db2.gz CHNDJCLUYUIMBR-JTQLQIEISA-N 1 2 249.358 2.164 20 0 BEADLO c1cc([C@@H]2CCC[N@H+]2Cc2cnn[nH]2)cs1 ZINC000295458470 183360532 /nfs/dbraw/zinc/36/05/32/183360532.db2.gz HPTVLAPSGYXWPU-NSHDSACASA-N 1 2 234.328 2.203 20 0 BEADLO c1cc([C@@H]2CCC[N@@H+]2Cc2cnn[nH]2)cs1 ZINC000295458470 183360533 /nfs/dbraw/zinc/36/05/33/183360533.db2.gz HPTVLAPSGYXWPU-NSHDSACASA-N 1 2 234.328 2.203 20 0 BEADLO c1cc([C@@H]2CCC[N@H+]2Cc2c[nH]nn2)cs1 ZINC000295458470 183360536 /nfs/dbraw/zinc/36/05/36/183360536.db2.gz HPTVLAPSGYXWPU-NSHDSACASA-N 1 2 234.328 2.203 20 0 BEADLO c1cc([C@@H]2CCC[N@@H+]2Cc2c[nH]nn2)cs1 ZINC000295458470 183360538 /nfs/dbraw/zinc/36/05/38/183360538.db2.gz HPTVLAPSGYXWPU-NSHDSACASA-N 1 2 234.328 2.203 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@H+](C)Cc1ccccc1 ZINC000126634913 169298838 /nfs/dbraw/zinc/29/88/38/169298838.db2.gz LKHFHTOGEMBDDL-GFCCVEGCSA-N 1 2 235.327 2.460 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000126634913 169298839 /nfs/dbraw/zinc/29/88/39/169298839.db2.gz LKHFHTOGEMBDDL-GFCCVEGCSA-N 1 2 235.327 2.460 20 0 BEADLO CCC[NH2+][C@](CC)(C(=O)OC)c1ccccc1 ZINC000037513260 169293685 /nfs/dbraw/zinc/29/36/85/169293685.db2.gz RWVVNFNFUUJUOI-AWEZNQCLSA-N 1 2 235.327 2.465 20 0 BEADLO c1ccc(N2CCC[C@H]2[C@@H]2CCCO2)[nH+]c1 ZINC000286290342 183414444 /nfs/dbraw/zinc/41/44/44/183414444.db2.gz DAOIPICLHIIWKX-RYUDHWBXSA-N 1 2 218.300 2.229 20 0 BEADLO CCC[C@@H](C)[N@H+](C)Cc1nsc(N(C)C)n1 ZINC000336685790 169365767 /nfs/dbraw/zinc/36/57/67/169365767.db2.gz VRRXBINPBNRIRD-SECBINFHSA-N 1 2 242.392 2.225 20 0 BEADLO CCC[C@@H](C)[N@@H+](C)Cc1nsc(N(C)C)n1 ZINC000336685790 169365768 /nfs/dbraw/zinc/36/57/68/169365768.db2.gz VRRXBINPBNRIRD-SECBINFHSA-N 1 2 242.392 2.225 20 0 BEADLO CCC[C@@H](C(=O)NCc1[nH]c[nH+]c1C)C(C)C ZINC000270895263 169345488 /nfs/dbraw/zinc/34/54/88/169345488.db2.gz NNBGGUOTJBHEHV-LLVKDONJSA-N 1 2 237.347 2.407 20 0 BEADLO CCC[C@@H](C(=O)NCCn1cc[nH+]c1)C(C)C ZINC000135883275 169345613 /nfs/dbraw/zinc/34/56/13/169345613.db2.gz LKFSMWGRGATUBW-GFCCVEGCSA-N 1 2 237.347 2.072 20 0 BEADLO CCC[C@@H](C)C(=O)NCc1ccn2cc[nH+]c2c1 ZINC000178379240 169351400 /nfs/dbraw/zinc/35/14/00/169351400.db2.gz QQDKHNPLMOMVME-LLVKDONJSA-N 1 2 245.326 2.387 20 0 BEADLO CCC[C@@H](C)CC(=O)NCc1[nH+]ccn1CC ZINC000295779512 169355654 /nfs/dbraw/zinc/35/56/54/169355654.db2.gz QBCYVJVHYXZLAB-LLVKDONJSA-N 1 2 237.347 2.346 20 0 BEADLO CCC[C@@H](CC)NC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000362699015 169376130 /nfs/dbraw/zinc/37/61/30/169376130.db2.gz MDZNULPWYMRCKC-SNVBAGLBSA-N 1 2 237.347 2.382 20 0 BEADLO CCC[C@@H](CC)NC(=O)CCc1[nH]cc[nH+]1 ZINC000287615074 169376246 /nfs/dbraw/zinc/37/62/46/169376246.db2.gz HOQZACKJBFXULP-SNVBAGLBSA-N 1 2 223.320 2.037 20 0 BEADLO CCC[C@@H](CC)[S@](=O)Cc1c[nH+]cn1C ZINC000280004375 169381747 /nfs/dbraw/zinc/38/17/47/169381747.db2.gz NDERJSDAVWCKLN-IAQYHMDHSA-N 1 2 228.361 2.248 20 0 BEADLO CCC[C@@H]([NH2+]Cc1cccc(C)c1)C(=O)OC ZINC000083362435 169401699 /nfs/dbraw/zinc/40/16/99/169401699.db2.gz NYPVCUIWRNKEON-CYBMUJFWSA-N 1 2 235.327 2.426 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)Nc1cc[nH+]cc1C ZINC000360175436 169436478 /nfs/dbraw/zinc/43/64/78/169436478.db2.gz KRGKBNQZRSDXHQ-GHMZBOCLSA-N 1 2 218.300 2.187 20 0 BEADLO O=C(NC1CC=CC1)c1cc2c[nH+]ccc2[nH]1 ZINC001644495035 1172565505 /nfs/dbraw/zinc/56/55/05/1172565505.db2.gz QDKDTWXICSCHRN-UHFFFAOYSA-N 1 2 227.267 2.011 20 0 BEADLO Cc1cnc(C[NH2+][C@H](C)c2cccnc2)o1 ZINC000182891068 134349314 /nfs/dbraw/zinc/34/93/14/134349314.db2.gz WCYRTMGHPFNKCF-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO CC[N@H+](CCO)Cc1csc(C(C)C)n1 ZINC000048346892 383848474 /nfs/dbraw/zinc/84/84/74/383848474.db2.gz PKSVDNWLUHHPFH-UHFFFAOYSA-N 1 2 228.361 2.081 20 0 BEADLO CC[N@@H+](CCO)Cc1csc(C(C)C)n1 ZINC000048346892 383848479 /nfs/dbraw/zinc/84/84/79/383848479.db2.gz PKSVDNWLUHHPFH-UHFFFAOYSA-N 1 2 228.361 2.081 20 0 BEADLO C[C@@H]([NH2+]Cc1ccon1)c1cccc(O)c1 ZINC000088052600 383876400 /nfs/dbraw/zinc/87/64/00/383876400.db2.gz JOKXFHRJZLUZOQ-SECBINFHSA-N 1 2 218.256 2.231 20 0 BEADLO C[C@@H](NC(=O)C=Cc1c[nH]c[nH+]1)c1ccccc1 ZINC000492767152 533018092 /nfs/dbraw/zinc/01/80/92/533018092.db2.gz NLRDQPWBXISNQK-WSKFYRRCSA-N 1 2 241.294 2.300 20 0 BEADLO CC[C@H]([NH2+]Cc1ncn(C)n1)c1cccs1 ZINC000090969196 383924420 /nfs/dbraw/zinc/92/44/20/383924420.db2.gz GJKPHNVGJSGMAI-VIFPVBQESA-N 1 2 236.344 2.118 20 0 BEADLO Nc1[nH+]cnc(NC[C@@H]2C[C@H]2C2CC2)c1Cl ZINC000309635444 383889190 /nfs/dbraw/zinc/88/91/90/383889190.db2.gz SHLJXHDAPSQKKK-YUMQZZPRSA-N 1 2 238.722 2.170 20 0 BEADLO Nc1nc[nH+]c(NC[C@@H]2C[C@H]2C2CC2)c1Cl ZINC000309635444 383889194 /nfs/dbraw/zinc/88/91/94/383889194.db2.gz SHLJXHDAPSQKKK-YUMQZZPRSA-N 1 2 238.722 2.170 20 0 BEADLO CSC[C@H](C)C(=O)Nc1cc[nH+]cc1C ZINC000066839401 383891224 /nfs/dbraw/zinc/89/12/24/383891224.db2.gz CQLCACYKXZVKSP-VIFPVBQESA-N 1 2 224.329 2.328 20 0 BEADLO c1nc(N2CCCCC2)cc(NCC2CC2)[nH+]1 ZINC000112074920 383895458 /nfs/dbraw/zinc/89/54/58/383895458.db2.gz PTLSEFIBNTWUCT-UHFFFAOYSA-N 1 2 232.331 2.289 20 0 BEADLO c1nc(NCC2CC2)cc(N2CCCCC2)[nH+]1 ZINC000112074920 383895465 /nfs/dbraw/zinc/89/54/65/383895465.db2.gz PTLSEFIBNTWUCT-UHFFFAOYSA-N 1 2 232.331 2.289 20 0 BEADLO C[C@@H](CO)CNc1ccc2ccccc2[nH+]1 ZINC000088389808 383900166 /nfs/dbraw/zinc/90/01/66/383900166.db2.gz BZEGEDBFVWNPMB-SNVBAGLBSA-N 1 2 216.284 2.275 20 0 BEADLO Cc1cc(N)nc(SCC2=CCCC2)[nH+]1 ZINC000401131690 383981964 /nfs/dbraw/zinc/98/19/64/383981964.db2.gz SYGXTRFZDLWYMJ-UHFFFAOYSA-N 1 2 221.329 2.400 20 0 BEADLO CCCC[C@H]([NH2+][C@@H](CC)CSC)C(=O)OC ZINC000091555065 383982035 /nfs/dbraw/zinc/98/20/35/383982035.db2.gz CXULWCUFNSVOEQ-QWRGUYRKSA-N 1 2 247.404 2.449 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000569412180 383999425 /nfs/dbraw/zinc/99/94/25/383999425.db2.gz OYRDPUPBZVFEMB-IVZWLZJFSA-N 1 2 223.320 2.269 20 0 BEADLO CCCCC(=O)NCc1cn2c(cccc2C)[nH+]1 ZINC000068569119 383999497 /nfs/dbraw/zinc/99/94/97/383999497.db2.gz IPVFWUGDXSNOSB-UHFFFAOYSA-N 1 2 245.326 2.449 20 0 BEADLO CCOc1ccccc1C[NH2+]Cc1ncc[nH]1 ZINC000067667452 383937104 /nfs/dbraw/zinc/93/71/04/383937104.db2.gz PFOZSEARQLUROO-UHFFFAOYSA-N 1 2 231.299 2.098 20 0 BEADLO c1csc(-c2ccn3cc[nH+]c3c2)n1 ZINC000089201422 383943833 /nfs/dbraw/zinc/94/38/33/383943833.db2.gz DUDWEEAQZRSOGH-UHFFFAOYSA-N 1 2 201.254 2.458 20 0 BEADLO c1csc([C@H]([NH2+]CCC2CC2)c2nnc[nH]2)c1 ZINC000294788185 383944856 /nfs/dbraw/zinc/94/48/56/383944856.db2.gz OEIXKUONWWVFBM-NSHDSACASA-N 1 2 248.355 2.345 20 0 BEADLO CC[C@@H]1CCCC[C@H]1C[NH2+]Cc1c[nH]nn1 ZINC000401762708 383959430 /nfs/dbraw/zinc/95/94/30/383959430.db2.gz SPXBMEJJQIBSAI-MNOVXSKESA-N 1 2 222.336 2.111 20 0 BEADLO CC[C@@H]1CCCC[C@H]1C[NH2+]Cc1cn[nH]n1 ZINC000401762708 383959432 /nfs/dbraw/zinc/95/94/32/383959432.db2.gz SPXBMEJJQIBSAI-MNOVXSKESA-N 1 2 222.336 2.111 20 0 BEADLO CCC[C@@H]1CCCCN1C(=O)Cn1cc[nH+]c1 ZINC000558437010 384010613 /nfs/dbraw/zinc/01/06/13/384010613.db2.gz PWSQSEXTIQTHRJ-GFCCVEGCSA-N 1 2 235.331 2.064 20 0 BEADLO Cc1[nH]c(CNc2cccnc2C)[nH+]c1C ZINC000518564076 384013306 /nfs/dbraw/zinc/01/33/06/384013306.db2.gz GDGZLJUBELYVKU-UHFFFAOYSA-N 1 2 216.288 2.342 20 0 BEADLO COCC1(C)CCN(c2nc(C)[nH+]cc2C)CC1 ZINC000518564584 384015291 /nfs/dbraw/zinc/01/52/91/384015291.db2.gz QRLMLTQDSUIXRW-UHFFFAOYSA-N 1 2 249.358 2.346 20 0 BEADLO CO[C@@H]1C[C@@H](Nc2cc[nH+]c(C)n2)C1(C)C ZINC000227822081 134389282 /nfs/dbraw/zinc/38/92/82/134389282.db2.gz XCCHEVWFOSUXCP-NXEZZACHSA-N 1 2 221.304 2.010 20 0 BEADLO CCOC[C@H](O)Cn1c[nH+]c2cc(C)c(C)cc21 ZINC000069277543 384037750 /nfs/dbraw/zinc/03/77/50/384037750.db2.gz ZIIZBMVEHXZTJE-GFCCVEGCSA-N 1 2 248.326 2.051 20 0 BEADLO Cc1nc2[nH]ccc2c(N2C3CCC2CC3)[nH+]1 ZINC000530956308 384039973 /nfs/dbraw/zinc/03/99/73/384039973.db2.gz MBPBFOMBXIDRSQ-UHFFFAOYSA-N 1 2 228.299 2.398 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@H](C)Cc1ccccc1C ZINC000090274469 384040098 /nfs/dbraw/zinc/04/00/98/384040098.db2.gz WYWUYEKOAWUSKG-NEPJUHHUSA-N 1 2 235.327 2.077 20 0 BEADLO CCC[C@@H]([NH2+]Cc1ncn(C)n1)c1ccccc1 ZINC000090969176 384084900 /nfs/dbraw/zinc/08/49/00/384084900.db2.gz ARXCZQNPRCAGNK-CYBMUJFWSA-N 1 2 244.342 2.446 20 0 BEADLO Cc1nc(C[N@@H+]2CCOC(C)(C)[C@@H]2C)oc1C ZINC000336526109 384057963 /nfs/dbraw/zinc/05/79/63/384057963.db2.gz AOPTXMBOQSFGRQ-NSHDSACASA-N 1 2 238.331 2.291 20 0 BEADLO Cc1nc(C[N@H+]2CCOC(C)(C)[C@@H]2C)oc1C ZINC000336526109 384057972 /nfs/dbraw/zinc/05/79/72/384057972.db2.gz AOPTXMBOQSFGRQ-NSHDSACASA-N 1 2 238.331 2.291 20 0 BEADLO C[C@@H]1C[C@@H](Nc2cccc(-n3cc[nH+]c3)c2)CO1 ZINC000401829283 384078578 /nfs/dbraw/zinc/07/85/78/384078578.db2.gz MNXVUXVFKZUKMI-DGCLKSJQSA-N 1 2 243.310 2.462 20 0 BEADLO Cc1cc(NC(=O)c2ncccc2C)c(C)c[nH+]1 ZINC000560377267 384102954 /nfs/dbraw/zinc/10/29/54/384102954.db2.gz IQPTVPBOQFPIDS-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO CCOC(=O)C[N@H+](Cc1ccco1)C(C)C ZINC000050055671 384104309 /nfs/dbraw/zinc/10/43/09/384104309.db2.gz YGOVMNHBHHYDMC-UHFFFAOYSA-N 1 2 225.288 2.053 20 0 BEADLO CCOC(=O)C[N@@H+](Cc1ccco1)C(C)C ZINC000050055671 384104316 /nfs/dbraw/zinc/10/43/16/384104316.db2.gz YGOVMNHBHHYDMC-UHFFFAOYSA-N 1 2 225.288 2.053 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1nccs1)c1cnn(C)c1 ZINC000070717601 384134469 /nfs/dbraw/zinc/13/44/69/384134469.db2.gz TXUNOSWWKROIHV-IUCAKERBSA-N 1 2 236.344 2.288 20 0 BEADLO C(c1noc(C2CC2)n1)[NH+]1C[C@@H]2CCC[C@H]2C1 ZINC000152991283 384125002 /nfs/dbraw/zinc/12/50/02/384125002.db2.gz KHKUQRCWZRZCKS-QWRGUYRKSA-N 1 2 233.315 2.179 20 0 BEADLO C[C@@H]1Cc2ccccc2N1Cc1[nH+]ccn1C ZINC000070921224 384141289 /nfs/dbraw/zinc/14/12/89/384141289.db2.gz MNRSHRMCEPTXNH-LLVKDONJSA-N 1 2 227.311 2.371 20 0 BEADLO CCc1nc(N2CCC[C@@H]2CF)cc(C)[nH+]1 ZINC000294001181 384176546 /nfs/dbraw/zinc/17/65/46/384176546.db2.gz JNKBXLWKLDZCRF-SNVBAGLBSA-N 1 2 223.295 2.286 20 0 BEADLO C[C@@H]([NH2+]Cc1nc2ccccc2o1)c1cn[nH]c1 ZINC000358831874 384180249 /nfs/dbraw/zinc/18/02/49/384180249.db2.gz VJRYLMCNDIVZTH-SECBINFHSA-N 1 2 242.282 2.402 20 0 BEADLO CCc1cnc(C[N@H+]2CC=C(C)CC2)o1 ZINC000533760283 384180749 /nfs/dbraw/zinc/18/07/49/384180749.db2.gz CCNOSYNWTHSZIP-UHFFFAOYSA-N 1 2 206.289 2.389 20 0 BEADLO CCc1cnc(C[N@@H+]2CC=C(C)CC2)o1 ZINC000533760283 384180751 /nfs/dbraw/zinc/18/07/51/384180751.db2.gz CCNOSYNWTHSZIP-UHFFFAOYSA-N 1 2 206.289 2.389 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cncs2)C[C@H](C)O1 ZINC000092486919 384181890 /nfs/dbraw/zinc/18/18/90/384181890.db2.gz TZPNNMZWCOWOJA-UWVGGRQHSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cncs2)C[C@H](C)O1 ZINC000092486919 384181893 /nfs/dbraw/zinc/18/18/93/384181893.db2.gz TZPNNMZWCOWOJA-UWVGGRQHSA-N 1 2 226.345 2.142 20 0 BEADLO Cc1cc(N[C@H](CO)C(C)C)nc(C(C)C)[nH+]1 ZINC000092401566 384184123 /nfs/dbraw/zinc/18/41/23/384184123.db2.gz GZQFZJORCJQSLG-LLVKDONJSA-N 1 2 237.347 2.337 20 0 BEADLO Cn1cccc1C[N@@H+]1CCCC[C@@H]1c1ncc[nH]1 ZINC000092729953 384191567 /nfs/dbraw/zinc/19/15/67/384191567.db2.gz WWNMKGOEOWAXOL-CYBMUJFWSA-N 1 2 244.342 2.475 20 0 BEADLO Cn1cccc1C[N@H+]1CCCC[C@@H]1c1ncc[nH]1 ZINC000092729953 384191573 /nfs/dbraw/zinc/19/15/73/384191573.db2.gz WWNMKGOEOWAXOL-CYBMUJFWSA-N 1 2 244.342 2.475 20 0 BEADLO c1cc2ccc(NCCCn3cc[nH+]c3)nc2[nH]1 ZINC000072162800 384198116 /nfs/dbraw/zinc/19/81/16/384198116.db2.gz HMRCGOYTZXZRPK-UHFFFAOYSA-N 1 2 241.298 2.262 20 0 BEADLO Fc1ccc2c(c1)CN(Cc1c[nH+]c[nH]1)CC2 ZINC000093383760 384232598 /nfs/dbraw/zinc/23/25/98/384232598.db2.gz PCLFFHHMNCYLMG-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO COC(=O)[C@H]1CCCC[N@@H+]1Cc1occc1C ZINC000093441098 384238080 /nfs/dbraw/zinc/23/80/80/384238080.db2.gz GQRASBIORSXZGW-LLVKDONJSA-N 1 2 237.299 2.116 20 0 BEADLO COC(=O)[C@H]1CCCC[N@H+]1Cc1occc1C ZINC000093441098 384238086 /nfs/dbraw/zinc/23/80/86/384238086.db2.gz GQRASBIORSXZGW-LLVKDONJSA-N 1 2 237.299 2.116 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2cncs2)CCO1 ZINC000093508538 384244964 /nfs/dbraw/zinc/24/49/64/384244964.db2.gz ZPFMKWMQROKKPB-JTQLQIEISA-N 1 2 226.345 2.144 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2cncs2)CCO1 ZINC000093508538 384244969 /nfs/dbraw/zinc/24/49/69/384244969.db2.gz ZPFMKWMQROKKPB-JTQLQIEISA-N 1 2 226.345 2.144 20 0 BEADLO C[C@H]1C[N@H+](Cc2cnc(C3CC3)s2)CCO1 ZINC000560603347 384253431 /nfs/dbraw/zinc/25/34/31/384253431.db2.gz CKKKMEPWJBKKQU-VIFPVBQESA-N 1 2 238.356 2.241 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cnc(C3CC3)s2)CCO1 ZINC000560603347 384253438 /nfs/dbraw/zinc/25/34/38/384253438.db2.gz CKKKMEPWJBKKQU-VIFPVBQESA-N 1 2 238.356 2.241 20 0 BEADLO Cc1ccc(NC(=O)COCC2CC2)c(C)[nH+]1 ZINC000119323594 384258359 /nfs/dbraw/zinc/25/83/59/384258359.db2.gz UGXWQSIFNUKBDH-UHFFFAOYSA-N 1 2 234.299 2.064 20 0 BEADLO Cn1c2ccccc2[nH+]c1N1CCCC1 ZINC000138041141 384276048 /nfs/dbraw/zinc/27/60/48/384276048.db2.gz IBTXNSJKEMJIHF-UHFFFAOYSA-N 1 2 201.273 2.174 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CCC[C@H](C)C1)c1[nH]cc[nH+]1 ZINC000560698855 384305606 /nfs/dbraw/zinc/30/56/06/384305606.db2.gz ZJRMDSYDDKMOCQ-HBNTYKKESA-N 1 2 235.331 2.413 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H]1CCC[C@@H]1c1ccccc1 ZINC000133765954 384310478 /nfs/dbraw/zinc/31/04/78/384310478.db2.gz TXFCNABDHJUTLC-MRVWCRGKSA-N 1 2 247.338 2.474 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]Cc1ccc(CO)cc1 ZINC000647322570 384315245 /nfs/dbraw/zinc/31/52/45/384315245.db2.gz AYMUNKPJMJHYOR-SNVBAGLBSA-N 1 2 245.326 2.061 20 0 BEADLO CSC[C@H](C)NC(=O)Nc1cc[nH+]c(C)c1 ZINC000119499502 384280899 /nfs/dbraw/zinc/28/08/99/384280899.db2.gz AUJWNYKGRDNWLU-VIFPVBQESA-N 1 2 239.344 2.263 20 0 BEADLO CO[C@@H]1CCCN(C(=O)Nc2cc[nH+]c(C)c2)C1 ZINC000119637785 384292272 /nfs/dbraw/zinc/29/22/72/384292272.db2.gz YJLZLTOSZIFDTF-GFCCVEGCSA-N 1 2 249.314 2.033 20 0 BEADLO C[C@@H]([NH2+]Cc1cnc(N(C)C)s1)C(C)(F)F ZINC000449416086 384301529 /nfs/dbraw/zinc/30/15/29/384301529.db2.gz RVMKPDRTHFKLDG-SSDOTTSWSA-N 1 2 249.330 2.342 20 0 BEADLO CCCC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000120200746 384337313 /nfs/dbraw/zinc/33/73/13/384337313.db2.gz QZGTXHUTNLJTOB-JTQLQIEISA-N 1 2 221.304 2.263 20 0 BEADLO O=C(C1CCC1)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000120206139 384337942 /nfs/dbraw/zinc/33/79/42/384337942.db2.gz KDUNJEAZYOHQTQ-NSHDSACASA-N 1 2 233.315 2.263 20 0 BEADLO CS[C@H](C)CNC(=O)Nc1cc[nH+]c(C)c1 ZINC000120254661 384341086 /nfs/dbraw/zinc/34/10/86/384341086.db2.gz MMRYCNRAQBHJNQ-SECBINFHSA-N 1 2 239.344 2.263 20 0 BEADLO Cn1ccc(C[N@H+](C)Cc2cscn2)c1 ZINC000120223532 384341563 /nfs/dbraw/zinc/34/15/63/384341563.db2.gz YPEIEWUZFIECRB-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO Cn1ccc(C[N@@H+](C)Cc2cscn2)c1 ZINC000120223532 384341570 /nfs/dbraw/zinc/34/15/70/384341570.db2.gz YPEIEWUZFIECRB-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)CC(C)(F)F)[nH+]1 ZINC000568070616 384358760 /nfs/dbraw/zinc/35/87/60/384358760.db2.gz XAQLRBIXWDEVDX-UHFFFAOYSA-N 1 2 245.273 2.115 20 0 BEADLO CCC[C@H]([NH2+][C@H]1C[C@H]1CC)C(=O)OCC ZINC000300376333 384359512 /nfs/dbraw/zinc/35/95/12/384359512.db2.gz DTIRMBCFMJCAEE-VWYCJHECSA-N 1 2 213.321 2.106 20 0 BEADLO Cc1ccc(N[C@H](C)CCn2cccn2)c[nH+]1 ZINC000159315625 384323092 /nfs/dbraw/zinc/32/30/92/384323092.db2.gz IPNFSJKZQIYEAX-GFCCVEGCSA-N 1 2 230.315 2.477 20 0 BEADLO C[C@H]1OCC[C@@H]1Nc1ccc([NH+](C)C)cc1 ZINC000134086328 384330971 /nfs/dbraw/zinc/33/09/71/384330971.db2.gz CVTSBAJUQSYEHV-MFKMUULPSA-N 1 2 220.316 2.342 20 0 BEADLO Cc1scc(C(=O)N(C)Cc2[nH]cc[nH+]2)c1C ZINC000334238341 384407016 /nfs/dbraw/zinc/40/70/16/384407016.db2.gz MMNROUVPYRIICD-UHFFFAOYSA-N 1 2 249.339 2.360 20 0 BEADLO Cc1nc(CN[C@@H]2C[C@H](C)n3cc[nH+]c32)cs1 ZINC000334190513 384382443 /nfs/dbraw/zinc/38/24/43/384382443.db2.gz HILWBYJASABZGC-GZMMTYOYSA-N 1 2 248.355 2.444 20 0 BEADLO CC[C@H]1C[N@H+](Cc2csc(C)n2)C[C@H](C)O1 ZINC000076729578 384383725 /nfs/dbraw/zinc/38/37/25/384383725.db2.gz YSDBXIONNCANPA-CABZTGNLSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2csc(C)n2)C[C@H](C)O1 ZINC000076729578 384383728 /nfs/dbraw/zinc/38/37/28/384383728.db2.gz YSDBXIONNCANPA-CABZTGNLSA-N 1 2 240.372 2.451 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cocn2)C[C@H](C)S1 ZINC000530516518 384390711 /nfs/dbraw/zinc/39/07/11/384390711.db2.gz RCVJCSCNVFWGLI-DTORHVGOSA-N 1 2 212.318 2.000 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cocn2)C[C@H](C)S1 ZINC000530516518 384390718 /nfs/dbraw/zinc/39/07/18/384390718.db2.gz RCVJCSCNVFWGLI-DTORHVGOSA-N 1 2 212.318 2.000 20 0 BEADLO CO[C@H](C)c1noc(C[N@@H+]2CCCC[C@@H]2C)n1 ZINC000175063157 384390929 /nfs/dbraw/zinc/39/09/29/384390929.db2.gz WPQHNULQTOTSHQ-VHSXEESVSA-N 1 2 239.319 2.151 20 0 BEADLO CO[C@H](C)c1noc(C[N@H+]2CCCC[C@@H]2C)n1 ZINC000175063157 384390933 /nfs/dbraw/zinc/39/09/33/384390933.db2.gz WPQHNULQTOTSHQ-VHSXEESVSA-N 1 2 239.319 2.151 20 0 BEADLO Cc1ccc(SCCn2cc[nH+]c2)nc1 ZINC000121898944 384444936 /nfs/dbraw/zinc/44/49/36/384444936.db2.gz LJTCYYAPZQDZHK-UHFFFAOYSA-N 1 2 219.313 2.379 20 0 BEADLO CC(C)=CCC[C@@H](C)NC(=O)Cn1cc[nH+]c1 ZINC000556671085 384446621 /nfs/dbraw/zinc/44/66/21/384446621.db2.gz FBVPRAZNGLZQBD-GFCCVEGCSA-N 1 2 235.331 2.134 20 0 BEADLO O[C@H]1CCCN(c2cc(C(F)(F)F)cc[nH+]2)C1 ZINC000078612539 384451958 /nfs/dbraw/zinc/45/19/58/384451958.db2.gz BXDDCMLELJDWRW-VIFPVBQESA-N 1 2 246.232 2.062 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N(C)CC1CC1 ZINC000121610384 384430165 /nfs/dbraw/zinc/43/01/65/384430165.db2.gz YCOKNLPZCCWRSN-UHFFFAOYSA-N 1 2 219.288 2.264 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC1(C)CCC1 ZINC000121743794 384435080 /nfs/dbraw/zinc/43/50/80/384435080.db2.gz UHBFTOYPEQZHSW-UHFFFAOYSA-N 1 2 219.288 2.454 20 0 BEADLO COc1cccc([C@@H](C)[NH2+]Cc2ncccn2)c1 ZINC000148259916 384461502 /nfs/dbraw/zinc/46/15/02/384461502.db2.gz PZDRISSWQZMXBX-LLVKDONJSA-N 1 2 243.310 2.336 20 0 BEADLO COc1ccccc1[C@@H](C)[NH2+]Cc1ncccn1 ZINC000149276433 384474196 /nfs/dbraw/zinc/47/41/96/384474196.db2.gz VTSPMHGKIFIDBN-LLVKDONJSA-N 1 2 243.310 2.336 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)NC2(C)CCC2)c2[nH+]ccn21 ZINC000556769592 384477586 /nfs/dbraw/zinc/47/75/86/384477586.db2.gz QFZIHORETQHKJW-ZJUUUORDSA-N 1 2 248.330 2.131 20 0 BEADLO Cn1c2ccccc2[nH+]c1N[C@@H]1CCCC[C@H]1O ZINC000079046772 384482581 /nfs/dbraw/zinc/48/25/81/384482581.db2.gz FXYMPIBUTNZUKB-DGCLKSJQSA-N 1 2 245.326 2.289 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cnccc2C)nn1C ZINC000361408866 384489809 /nfs/dbraw/zinc/48/98/09/384489809.db2.gz DERCBKJFIALFQH-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cnccc2C)nn1C ZINC000361408866 384489816 /nfs/dbraw/zinc/48/98/16/384489816.db2.gz DERCBKJFIALFQH-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO CCCCC(=O)N1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000122863062 384515942 /nfs/dbraw/zinc/51/59/42/384515942.db2.gz ONEJQHPNRMZTAE-STQMWFEESA-N 1 2 249.358 2.483 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2CC23CC3)c(C)[nH+]1 ZINC000335066809 384523544 /nfs/dbraw/zinc/52/35/44/384523544.db2.gz GVDFTOXJCXEUJI-JTQLQIEISA-N 1 2 216.284 2.437 20 0 BEADLO COC[C@@H]([NH2+]Cc1c[nH]nc1C)c1ccc(C)o1 ZINC000080237741 384536432 /nfs/dbraw/zinc/53/64/32/384536432.db2.gz UOENJGUCBSEQIX-GFCCVEGCSA-N 1 2 249.314 2.097 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2ncccc2C)s1 ZINC000353580806 384530477 /nfs/dbraw/zinc/53/04/77/384530477.db2.gz JVTBEMNDZWKBIR-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO C[N@@H+]1CCCc2cc(NCc3ncc[nH]3)ccc21 ZINC000123338714 384552250 /nfs/dbraw/zinc/55/22/50/384552250.db2.gz BSXLRCSYSCLLHT-UHFFFAOYSA-N 1 2 242.326 2.404 20 0 BEADLO C[N@H+]1CCCc2cc(NCc3ncc[nH]3)ccc21 ZINC000123338714 384552256 /nfs/dbraw/zinc/55/22/56/384552256.db2.gz BSXLRCSYSCLLHT-UHFFFAOYSA-N 1 2 242.326 2.404 20 0 BEADLO Cn1cc[nH+]c1CN1CCc2c1cccc2F ZINC000184031257 384552579 /nfs/dbraw/zinc/55/25/79/384552579.db2.gz NZHKZPYSUYQLNQ-UHFFFAOYSA-N 1 2 231.274 2.122 20 0 BEADLO Fc1ccc(F)c(COCc2[nH]cc[nH+]2)c1 ZINC000097037550 384568868 /nfs/dbraw/zinc/56/88/68/384568868.db2.gz SNJGGWHULBGDTL-UHFFFAOYSA-N 1 2 224.210 2.405 20 0 BEADLO COC(=O)[C@H](C)C[N@H+](C)C/C(Cl)=C/Cl ZINC000086001383 384585471 /nfs/dbraw/zinc/58/54/71/384585471.db2.gz UASCGTUDQKGZAD-UDGZVJEDSA-N 1 2 240.130 2.046 20 0 BEADLO COC(=O)[C@H](C)C[N@@H+](C)C/C(Cl)=C/Cl ZINC000086001383 384585481 /nfs/dbraw/zinc/58/54/81/384585481.db2.gz UASCGTUDQKGZAD-UDGZVJEDSA-N 1 2 240.130 2.046 20 0 BEADLO CCN(CC1CCC1)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000517942484 384585729 /nfs/dbraw/zinc/58/57/29/384585729.db2.gz KJLMNKCFXHYWFJ-GFCCVEGCSA-N 1 2 249.358 2.483 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)C(C)(C)C1CCC1 ZINC000322986705 384566079 /nfs/dbraw/zinc/56/60/79/384566079.db2.gz QOFCOVKQHRYAOR-UHFFFAOYSA-N 1 2 235.331 2.194 20 0 BEADLO CC(C)C[C@H](C)C[N@H+](CCO)CC(F)F ZINC000300842544 384604542 /nfs/dbraw/zinc/60/45/42/384604542.db2.gz DKQJGLFBMKLSSJ-JTQLQIEISA-N 1 2 223.307 2.228 20 0 BEADLO CC(C)C[C@H](C)C[N@@H+](CCO)CC(F)F ZINC000300842544 384604550 /nfs/dbraw/zinc/60/45/50/384604550.db2.gz DKQJGLFBMKLSSJ-JTQLQIEISA-N 1 2 223.307 2.228 20 0 BEADLO Cc1nnc(C[N@@H+](C)[C@H](C)c2ccc(F)cc2)[nH]1 ZINC000362480693 384609360 /nfs/dbraw/zinc/60/93/60/384609360.db2.gz UQONZEGRGYFJTH-SECBINFHSA-N 1 2 248.305 2.445 20 0 BEADLO Cc1nnc(C[N@H+](C)[C@H](C)c2ccc(F)cc2)[nH]1 ZINC000362480693 384609367 /nfs/dbraw/zinc/60/93/67/384609367.db2.gz UQONZEGRGYFJTH-SECBINFHSA-N 1 2 248.305 2.445 20 0 BEADLO C[N@H+](CCCC1CCOCC1)CC(F)F ZINC000361465825 384621691 /nfs/dbraw/zinc/62/16/91/384621691.db2.gz XNJHWCCFLNSLOA-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO C[N@@H+](CCCC1CCOCC1)CC(F)F ZINC000361465825 384621699 /nfs/dbraw/zinc/62/16/99/384621699.db2.gz XNJHWCCFLNSLOA-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO CCC[C@@](C)([NH2+]CC=C(C)C)C(=O)OC ZINC000111247172 384594869 /nfs/dbraw/zinc/59/48/69/384594869.db2.gz XOSICARSQASFHO-GFCCVEGCSA-N 1 2 213.321 2.274 20 0 BEADLO COC(=O)[C@H](c1ccc(F)cc1)[NH+]1CCCC1 ZINC000101543018 384676256 /nfs/dbraw/zinc/67/62/56/384676256.db2.gz GQHXTRDCXKZACJ-LBPRGKRZSA-N 1 2 237.274 2.136 20 0 BEADLO Cc1nc(N[C@@H]2CC[C@H]3C[C@H]3C2)cc[nH+]1 ZINC000403329679 384634583 /nfs/dbraw/zinc/63/45/83/384634583.db2.gz BYIWENDFLJMMTJ-GARJFASQSA-N 1 2 203.289 2.386 20 0 BEADLO C[C@@H]([NH2+]Cc1cocn1)c1cncc(F)c1 ZINC000309818556 384641366 /nfs/dbraw/zinc/64/13/66/384641366.db2.gz VUUNFWHNHZAZFY-MRVPVSSYSA-N 1 2 221.235 2.060 20 0 BEADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1nccn1C ZINC000162549033 384643085 /nfs/dbraw/zinc/64/30/85/384643085.db2.gz VUKGSVGBJFRPEF-CYBMUJFWSA-N 1 2 244.342 2.398 20 0 BEADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1nccn1C ZINC000162549033 384643092 /nfs/dbraw/zinc/64/30/92/384643092.db2.gz VUKGSVGBJFRPEF-CYBMUJFWSA-N 1 2 244.342 2.398 20 0 BEADLO CC[C@@]1(C)C[C@@H]1C(=O)Nc1ccc(N)[nH+]c1 ZINC000151655193 384675513 /nfs/dbraw/zinc/67/55/13/384675513.db2.gz KNNQVXVVDABOJS-SKDRFNHKSA-N 1 2 219.288 2.039 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1ccc(Cl)cc1 ZINC000048667941 384675694 /nfs/dbraw/zinc/67/56/94/384675694.db2.gz ABGFKEHSCMWXMN-UHFFFAOYSA-N 1 2 241.718 2.335 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1ccc(Cl)cc1 ZINC000048667941 384675701 /nfs/dbraw/zinc/67/57/01/384675701.db2.gz ABGFKEHSCMWXMN-UHFFFAOYSA-N 1 2 241.718 2.335 20 0 BEADLO c1cc(N2CCCCC2)[nH+]cc1N[C@H]1CCOC1 ZINC000104059470 384658779 /nfs/dbraw/zinc/65/87/79/384658779.db2.gz GVWNAXBSZXKXFJ-ZDUSSCGKSA-N 1 2 247.342 2.273 20 0 BEADLO COC(=O)C[N@H+](C)[C@@H](C)c1cccc(C)c1 ZINC000173500101 384684670 /nfs/dbraw/zinc/68/46/70/384684670.db2.gz OCZZXICRBGBGLP-NSHDSACASA-N 1 2 221.300 2.161 20 0 BEADLO COC(=O)C[N@@H+](C)[C@@H](C)c1cccc(C)c1 ZINC000173500101 384684675 /nfs/dbraw/zinc/68/46/75/384684675.db2.gz OCZZXICRBGBGLP-NSHDSACASA-N 1 2 221.300 2.161 20 0 BEADLO Cc1ccccc1C[NH2+][C@H]1CCC[NH2+][C@H]1C ZINC000335358496 384693508 /nfs/dbraw/zinc/69/35/08/384693508.db2.gz SQIYEUGDRZQFFE-JSGCOSHPSA-N 1 2 218.344 2.225 20 0 BEADLO Cc1nc(N2CCC([C@@H]3CCOC3)CC2)cc[nH+]1 ZINC000368350410 384726918 /nfs/dbraw/zinc/72/69/18/384726918.db2.gz XCBAOFOJEGAPGR-CYBMUJFWSA-N 1 2 247.342 2.038 20 0 BEADLO COc1ccccc1C1([NH2+]Cc2ncc[nH]2)CC1 ZINC000647232784 384701820 /nfs/dbraw/zinc/70/18/20/384701820.db2.gz CGZXLGKQIDKLBB-UHFFFAOYSA-N 1 2 243.310 2.197 20 0 BEADLO Cc1nc(C[N@H+]2CCO[C@@H](C)[C@H]2C)sc1C ZINC000248216429 384727301 /nfs/dbraw/zinc/72/73/01/384727301.db2.gz ZSYNOTRUKROHLN-ZJUUUORDSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nc(C[N@@H+]2CCO[C@@H](C)[C@H]2C)sc1C ZINC000248216429 384727308 /nfs/dbraw/zinc/72/73/08/384727308.db2.gz ZSYNOTRUKROHLN-ZJUUUORDSA-N 1 2 240.372 2.369 20 0 BEADLO C[C@@H](CO)Nc1[nH+]ccc2ccc(F)cc21 ZINC000309910298 384705853 /nfs/dbraw/zinc/70/58/53/384705853.db2.gz MHQZKABUMNUFLB-QMMMGPOBSA-N 1 2 220.247 2.167 20 0 BEADLO Cc1cn2c([nH+]1)CN(Cc1ccccc1F)CC2 ZINC000363702170 384711228 /nfs/dbraw/zinc/71/12/28/384711228.db2.gz QMRYSRZWPXVCMK-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO CCc1ccccc1C[NH2+]Cc1csnn1 ZINC000082774591 384715582 /nfs/dbraw/zinc/71/55/82/384715582.db2.gz MJZOEQJNKNLIFO-UHFFFAOYSA-N 1 2 233.340 2.390 20 0 BEADLO CN(C)c1cccc(C[N@H+](C)Cc2ccon2)c1 ZINC000173787263 384720978 /nfs/dbraw/zinc/72/09/78/384720978.db2.gz MMHCLPLVLVNDAS-UHFFFAOYSA-N 1 2 245.326 2.373 20 0 BEADLO CN(C)c1cccc(C[N@@H+](C)Cc2ccon2)c1 ZINC000173787263 384720983 /nfs/dbraw/zinc/72/09/83/384720983.db2.gz MMHCLPLVLVNDAS-UHFFFAOYSA-N 1 2 245.326 2.373 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@H](CC)C2)o1 ZINC000125556982 384730804 /nfs/dbraw/zinc/73/08/04/384730804.db2.gz ZEBRKSCEBOTFRQ-GFCCVEGCSA-N 1 2 223.316 2.453 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@H](CC)C2)o1 ZINC000125556982 384730809 /nfs/dbraw/zinc/73/08/09/384730809.db2.gz ZEBRKSCEBOTFRQ-GFCCVEGCSA-N 1 2 223.316 2.453 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1CCC[C@@H](O)C1 ZINC000227692810 384741688 /nfs/dbraw/zinc/74/16/88/384741688.db2.gz FSGGNIOCQPLCCD-WDEREUQCSA-N 1 2 236.315 2.053 20 0 BEADLO CC(C)CCC[N@@H+](CC(F)F)C[C@H](C)O ZINC000449627880 384758827 /nfs/dbraw/zinc/75/88/27/384758827.db2.gz HQOBJOQUJRVOOS-JTQLQIEISA-N 1 2 223.307 2.371 20 0 BEADLO CC(C)CCC[N@H+](CC(F)F)C[C@H](C)O ZINC000449627880 384758833 /nfs/dbraw/zinc/75/88/33/384758833.db2.gz HQOBJOQUJRVOOS-JTQLQIEISA-N 1 2 223.307 2.371 20 0 BEADLO COC(=O)C(C)(C)[NH2+]Cc1c(C)cccc1C ZINC000083362460 384764360 /nfs/dbraw/zinc/76/43/60/384764360.db2.gz GVTNLBIBDGKFJZ-UHFFFAOYSA-N 1 2 235.327 2.345 20 0 BEADLO CCc1ccc([C@H]2COCC[N@H+]2CC)o1 ZINC000126039370 384764790 /nfs/dbraw/zinc/76/47/90/384764790.db2.gz PANAWMZNNCRZKY-LLVKDONJSA-N 1 2 209.289 2.235 20 0 BEADLO CCc1ccc([C@H]2COCC[N@@H+]2CC)o1 ZINC000126039370 384764797 /nfs/dbraw/zinc/76/47/97/384764797.db2.gz PANAWMZNNCRZKY-LLVKDONJSA-N 1 2 209.289 2.235 20 0 BEADLO COC[C@@H](C)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000053173154 384768844 /nfs/dbraw/zinc/76/88/44/384768844.db2.gz BNWHZNKIWBUKGX-LLVKDONJSA-N 1 2 231.299 2.319 20 0 BEADLO COC[C@@H](C)Nc1ccc([NH+](C)C)cc1 ZINC000053172988 384769634 /nfs/dbraw/zinc/76/96/34/384769634.db2.gz VAQDSTKRFLFUSM-SNVBAGLBSA-N 1 2 208.305 2.199 20 0 BEADLO COC[C@H](C)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000053173153 384770001 /nfs/dbraw/zinc/77/00/01/384770001.db2.gz BNWHZNKIWBUKGX-NSHDSACASA-N 1 2 231.299 2.319 20 0 BEADLO Cn1cc[nH+]c1CSc1cccc(O)c1 ZINC000127033312 384833610 /nfs/dbraw/zinc/83/36/10/384833610.db2.gz PWRYGFAZTUHJMH-UHFFFAOYSA-N 1 2 220.297 2.418 20 0 BEADLO CCC(CC)NC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000518192473 384782064 /nfs/dbraw/zinc/78/20/64/384782064.db2.gz KTDYJWLHQNOCLD-JTQLQIEISA-N 1 2 223.320 2.139 20 0 BEADLO CCCCN(C)C(=O)[C@@H]1CCn2cc(C)[nH+]c2C1 ZINC000623728054 384801715 /nfs/dbraw/zinc/80/17/15/384801715.db2.gz XHNWSSARPJESGN-GFCCVEGCSA-N 1 2 249.358 2.012 20 0 BEADLO CCC[C@H]([NH2+][C@H]1C[C@H]1C1CC1)C(=O)OCC ZINC000310039317 384806873 /nfs/dbraw/zinc/80/68/73/384806873.db2.gz WXKAQBLLINZEQI-SRVKXCTJSA-N 1 2 225.332 2.106 20 0 BEADLO CO[C@@H](CNc1cc(C)[nH+]cn1)C(C)(C)C ZINC000301414538 384877093 /nfs/dbraw/zinc/87/70/93/384877093.db2.gz DRMXBMHXNQJPGS-JTQLQIEISA-N 1 2 223.320 2.258 20 0 BEADLO Cc1cc[nH+]c(NC[C@H](C)CO)c1Cl ZINC000306333551 384886897 /nfs/dbraw/zinc/88/68/97/384886897.db2.gz RDTNFWJIKBQUTF-ZETCQYMHSA-N 1 2 214.696 2.084 20 0 BEADLO CCc1[nH]c(CNC(=O)CCC2(C)CC2)c[nH+]1 ZINC001645215023 1172642917 /nfs/dbraw/zinc/64/29/17/1172642917.db2.gz GJRHAESDZVSFHD-UHFFFAOYSA-N 1 2 235.331 2.169 20 0 BEADLO CCc1[nH]cc(CNC(=O)CCC2(C)CC2)[nH+]1 ZINC001645215023 1172642922 /nfs/dbraw/zinc/64/29/22/1172642922.db2.gz GJRHAESDZVSFHD-UHFFFAOYSA-N 1 2 235.331 2.169 20 0 BEADLO COCc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)o1 ZINC000126967155 384847816 /nfs/dbraw/zinc/84/78/16/384847816.db2.gz ZGWGPJCCLIINCT-PHIMTYICSA-N 1 2 239.315 2.035 20 0 BEADLO COCc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)o1 ZINC000126967155 384847826 /nfs/dbraw/zinc/84/78/26/384847826.db2.gz ZGWGPJCCLIINCT-PHIMTYICSA-N 1 2 239.315 2.035 20 0 BEADLO C[N@H+](CCC1CCOCC1)CC(F)F ZINC000177024531 384849640 /nfs/dbraw/zinc/84/96/40/384849640.db2.gz WGRGQZVBANKQIS-UHFFFAOYSA-N 1 2 207.264 2.000 20 0 BEADLO C[N@@H+](CCC1CCOCC1)CC(F)F ZINC000177024531 384849653 /nfs/dbraw/zinc/84/96/53/384849653.db2.gz WGRGQZVBANKQIS-UHFFFAOYSA-N 1 2 207.264 2.000 20 0 BEADLO CCC[NH+](CCC)Cc1nsc(N(C)C)n1 ZINC000163721549 384852292 /nfs/dbraw/zinc/85/22/92/384852292.db2.gz QOZGHMTWTYSRIE-UHFFFAOYSA-N 1 2 242.392 2.226 20 0 BEADLO CCCCC(=O)NCCc1cn2ccccc2[nH+]1 ZINC000055043635 384864353 /nfs/dbraw/zinc/86/43/53/384864353.db2.gz OLTNUPHGHXKLGB-UHFFFAOYSA-N 1 2 245.326 2.183 20 0 BEADLO C[N@H+](CCOC(C)(C)C)Cc1nccs1 ZINC000175093148 384866382 /nfs/dbraw/zinc/86/63/82/384866382.db2.gz LYDJIDMYIJAFTE-UHFFFAOYSA-N 1 2 228.361 2.390 20 0 BEADLO C[N@@H+](CCOC(C)(C)C)Cc1nccs1 ZINC000175093148 384866390 /nfs/dbraw/zinc/86/63/90/384866390.db2.gz LYDJIDMYIJAFTE-UHFFFAOYSA-N 1 2 228.361 2.390 20 0 BEADLO CO[C@H](C)c1nc(C[N@H+](C)C2CC2)cs1 ZINC000175095585 384869516 /nfs/dbraw/zinc/86/95/16/384869516.db2.gz XIPVZDQXCWTLDE-MRVPVSSYSA-N 1 2 226.345 2.445 20 0 BEADLO CO[C@H](C)c1nc(C[N@@H+](C)C2CC2)cs1 ZINC000175095585 384869523 /nfs/dbraw/zinc/86/95/23/384869523.db2.gz XIPVZDQXCWTLDE-MRVPVSSYSA-N 1 2 226.345 2.445 20 0 BEADLO COC(=O)C[N@H+](C)CCc1ccc(C(C)C)cc1 ZINC000258919489 384951899 /nfs/dbraw/zinc/95/18/99/384951899.db2.gz NGNDWGRYOBNJQJ-UHFFFAOYSA-N 1 2 249.354 2.457 20 0 BEADLO COC(=O)C[N@@H+](C)CCc1ccc(C(C)C)cc1 ZINC000258919489 384951908 /nfs/dbraw/zinc/95/19/08/384951908.db2.gz NGNDWGRYOBNJQJ-UHFFFAOYSA-N 1 2 249.354 2.457 20 0 BEADLO Cc1n[nH]cc1CNc1ccc([NH+](C)C)cc1 ZINC000057651432 384957289 /nfs/dbraw/zinc/95/72/89/384957289.db2.gz PSPYLCSESINNJI-UHFFFAOYSA-N 1 2 230.315 2.396 20 0 BEADLO C[C@@H](NCc1c[nH+]c2ccccn12)C(F)(F)F ZINC000643799242 384957339 /nfs/dbraw/zinc/95/73/39/384957339.db2.gz BMPXTUISOQGCPP-MRVPVSSYSA-N 1 2 243.232 2.375 20 0 BEADLO CCCCCNC(=O)C[NH+]1Cc2ccccc2C1 ZINC000106305788 384907165 /nfs/dbraw/zinc/90/71/65/384907165.db2.gz QOVXZEJORHUBGB-UHFFFAOYSA-N 1 2 246.354 2.309 20 0 BEADLO CCCc1nc(C[N@H+](C)CCOC)cs1 ZINC000056293848 384907839 /nfs/dbraw/zinc/90/78/39/384907839.db2.gz YTDLMKCFLNHDAO-UHFFFAOYSA-N 1 2 228.361 2.174 20 0 BEADLO CCCc1nc(C[N@@H+](C)CCOC)cs1 ZINC000056293848 384907848 /nfs/dbraw/zinc/90/78/48/384907848.db2.gz YTDLMKCFLNHDAO-UHFFFAOYSA-N 1 2 228.361 2.174 20 0 BEADLO C[C@@H](O)C[N@H+](C)Cc1c(F)cccc1Cl ZINC000051821455 384918463 /nfs/dbraw/zinc/91/84/63/384918463.db2.gz LHJXXARXJHTLFQ-MRVPVSSYSA-N 1 2 231.698 2.292 20 0 BEADLO C[C@@H](O)C[N@@H+](C)Cc1c(F)cccc1Cl ZINC000051821455 384918468 /nfs/dbraw/zinc/91/84/68/384918468.db2.gz LHJXXARXJHTLFQ-MRVPVSSYSA-N 1 2 231.698 2.292 20 0 BEADLO Cc1cnc(N[C@H](C)Cn2cc[nH+]c2)s1 ZINC000336758985 384919522 /nfs/dbraw/zinc/91/95/22/384919522.db2.gz LCKRACVZWZPQRQ-MRVPVSSYSA-N 1 2 222.317 2.149 20 0 BEADLO CCCc1cccc(C[NH2+]Cc2ncn(C)n2)c1 ZINC000187349779 384937333 /nfs/dbraw/zinc/93/73/33/384937333.db2.gz JYZBCIYEYDWDKD-UHFFFAOYSA-N 1 2 244.342 2.057 20 0 BEADLO C[C@H](F)CCNc1cc[nH+]c2ccncc12 ZINC000338759493 384946190 /nfs/dbraw/zinc/94/61/90/384946190.db2.gz YOAVIFBOSRYZOR-VIFPVBQESA-N 1 2 219.263 2.212 20 0 BEADLO Cn1ccnc1[C@@H]([NH2+]Cc1nccs1)C1CC1 ZINC000187761114 384979743 /nfs/dbraw/zinc/97/97/43/384979743.db2.gz VRMVNXXBZLBMJL-NSHDSACASA-N 1 2 248.355 2.118 20 0 BEADLO CSC[C@@H](O)Cn1cc[nH+]c1-c1ccccc1 ZINC000187895293 384992600 /nfs/dbraw/zinc/99/26/00/384992600.db2.gz GFJXUTVINZXPGY-LBPRGKRZSA-N 1 2 248.351 2.274 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+](C)Cc2cccc(O)c2)o1 ZINC000530662667 385005370 /nfs/dbraw/zinc/00/53/70/385005370.db2.gz CSUUZUBFRDUMBL-SECBINFHSA-N 1 2 247.298 2.277 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+](C)Cc2cccc(O)c2)o1 ZINC000530662667 385005376 /nfs/dbraw/zinc/00/53/76/385005376.db2.gz CSUUZUBFRDUMBL-SECBINFHSA-N 1 2 247.298 2.277 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2ccns2)s1 ZINC000404469793 385013668 /nfs/dbraw/zinc/01/36/68/385013668.db2.gz XUXNFIHPFMQJOV-LURJTMIESA-N 1 2 240.357 2.154 20 0 BEADLO FC1(F)CCC[C@H]1[NH2+]Cc1ccns1 ZINC000404466172 385013981 /nfs/dbraw/zinc/01/39/81/385013981.db2.gz MJDQBJGLZPTFRW-MRVPVSSYSA-N 1 2 218.272 2.421 20 0 BEADLO COCc1cnc(C[NH2+][C@@H]2CCC[C@@H]2F)s1 ZINC000339584382 385020606 /nfs/dbraw/zinc/02/06/06/385020606.db2.gz MANHUQQOZOJQEM-VHSXEESVSA-N 1 2 244.335 2.270 20 0 BEADLO Cc1cc(NC[C@H]2CCCC2(F)F)nc[nH+]1 ZINC000336232725 385057740 /nfs/dbraw/zinc/05/77/40/385057740.db2.gz LLOBNEMMFGFOHE-SECBINFHSA-N 1 2 227.258 2.054 20 0 BEADLO Cc1nc(C[N@H+]2C[C@@H](C)OC[C@H]2C)c(C)s1 ZINC000336324082 385062034 /nfs/dbraw/zinc/06/20/34/385062034.db2.gz TYWPMXPJSXIWLO-RKDXNWHRSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@@H](C)OC[C@H]2C)c(C)s1 ZINC000336324082 385062039 /nfs/dbraw/zinc/06/20/39/385062039.db2.gz TYWPMXPJSXIWLO-RKDXNWHRSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccsc2)ncn1 ZINC000644655838 385062043 /nfs/dbraw/zinc/06/20/43/385062043.db2.gz JCCDRMMPJJLWAO-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccsc2)ncn1 ZINC000644655838 385062046 /nfs/dbraw/zinc/06/20/46/385062046.db2.gz JCCDRMMPJJLWAO-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO COC[C@@H]1CCCCN(c2cccc[nH+]2)C1 ZINC000364155877 385072526 /nfs/dbraw/zinc/07/25/26/385072526.db2.gz UJNZPRJOANHLDS-GFCCVEGCSA-N 1 2 220.316 2.335 20 0 BEADLO Cc1csc(C[NH2+]CC2(N(C)C)CCC2)n1 ZINC000165175528 385078808 /nfs/dbraw/zinc/07/88/08/385078808.db2.gz JFPLPEHLXXNEBD-UHFFFAOYSA-N 1 2 239.388 2.025 20 0 BEADLO Cc1c(C[NH2+][C@H](C)c2nccs2)cnn1C ZINC000086552131 385025927 /nfs/dbraw/zinc/02/59/27/385025927.db2.gz HIUFJTZUDWQFSM-MRVPVSSYSA-N 1 2 236.344 2.036 20 0 BEADLO c1cc(C[N@@H+]2CCC[C@H]2c2ccccn2)no1 ZINC000530724600 385026859 /nfs/dbraw/zinc/02/68/59/385026859.db2.gz XGUWHNFMZRJHQL-ZDUSSCGKSA-N 1 2 229.283 2.407 20 0 BEADLO c1cc(C[N@H+]2CCC[C@H]2c2ccccn2)no1 ZINC000530724600 385026868 /nfs/dbraw/zinc/02/68/68/385026868.db2.gz XGUWHNFMZRJHQL-ZDUSSCGKSA-N 1 2 229.283 2.407 20 0 BEADLO CC[C@H]([NH2+]Cc1[nH]ncc1C)c1nccs1 ZINC000310015727 385027392 /nfs/dbraw/zinc/02/73/92/385027392.db2.gz KVJJMBXACVOILU-VIFPVBQESA-N 1 2 236.344 2.416 20 0 BEADLO Cc1c(C[NH2+][C@@H](C)c2nccs2)cnn1C ZINC000086552130 385027360 /nfs/dbraw/zinc/02/73/60/385027360.db2.gz HIUFJTZUDWQFSM-QMMMGPOBSA-N 1 2 236.344 2.036 20 0 BEADLO CC[C@H]([NH2+]Cc1n[nH]cc1C)c1nccs1 ZINC000310015727 385027400 /nfs/dbraw/zinc/02/74/00/385027400.db2.gz KVJJMBXACVOILU-VIFPVBQESA-N 1 2 236.344 2.416 20 0 BEADLO FC(F)C[NH+]1CCC(OC2CCC2)CC1 ZINC000642714034 385028550 /nfs/dbraw/zinc/02/85/50/385028550.db2.gz IUYCREOVRHCHTE-UHFFFAOYSA-N 1 2 219.275 2.285 20 0 BEADLO CCc1cc(C(=O)Nc2ccc(C)[nH+]c2C)n[nH]1 ZINC000176193270 385037410 /nfs/dbraw/zinc/03/74/10/385037410.db2.gz DYYUFSGKFWEAMU-UHFFFAOYSA-N 1 2 244.298 2.236 20 0 BEADLO Cc1csc([C@@H]2COCC[N@@H+]2CC2CC2)n1 ZINC000189271930 385141419 /nfs/dbraw/zinc/14/14/19/385141419.db2.gz GDRZYIRKQATOSO-NSHDSACASA-N 1 2 238.356 2.235 20 0 BEADLO Cc1csc([C@@H]2COCC[N@H+]2CC2CC2)n1 ZINC000189271930 385141423 /nfs/dbraw/zinc/14/14/23/385141423.db2.gz GDRZYIRKQATOSO-NSHDSACASA-N 1 2 238.356 2.235 20 0 BEADLO CCOC1(C)CC[NH+](CC(F)F)CC1 ZINC000644703455 385121660 /nfs/dbraw/zinc/12/16/60/385121660.db2.gz FPQAEJZCMMOQSW-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO CS[C@H](C)CCC(=O)Nc1cc[nH+]cc1C ZINC000358409328 385133742 /nfs/dbraw/zinc/13/37/42/385133742.db2.gz SKRNKOBONQLYJJ-SNVBAGLBSA-N 1 2 238.356 2.282 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2CCCO[C@H]2C)c(C)[nH+]1 ZINC000189232979 385137786 /nfs/dbraw/zinc/13/77/86/385137786.db2.gz LNTIDJRRWXDZEN-NWDGAFQWSA-N 1 2 248.326 2.452 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2ccc(C)cc2)o1 ZINC000061779454 385138336 /nfs/dbraw/zinc/13/83/36/385138336.db2.gz WLOPJAGADSYWNE-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2ccc(C)cc2)o1 ZINC000061779454 385138341 /nfs/dbraw/zinc/13/83/41/385138341.db2.gz WLOPJAGADSYWNE-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CC(C(=O)NC1=[NH+]CCS1)=C1CCCC1 ZINC000176511517 385105066 /nfs/dbraw/zinc/10/50/66/385105066.db2.gz OBFLLSVXMOPOOH-UHFFFAOYSA-N 1 2 224.329 2.096 20 0 BEADLO Cc1cc[nH+]cc1NCc1cn(C(C)(C)C)nn1 ZINC000189954010 385199330 /nfs/dbraw/zinc/19/93/30/385199330.db2.gz FGEGHSRSONXPOJ-UHFFFAOYSA-N 1 2 245.330 2.349 20 0 BEADLO CCN(CC)c1ccc(N[C@@H]2CCOC2)c[nH+]1 ZINC000109430167 385161086 /nfs/dbraw/zinc/16/10/86/385161086.db2.gz DGNMFBIIIHYIRM-GFCCVEGCSA-N 1 2 235.331 2.129 20 0 BEADLO C[C@@H](CC1CCCCC1)NC(=O)Cn1cc[nH+]c1 ZINC000360446085 385161626 /nfs/dbraw/zinc/16/16/26/385161626.db2.gz LAAYQZKIAJFPKF-LBPRGKRZSA-N 1 2 249.358 2.358 20 0 BEADLO CC(C)(C)OC(=O)[C@@H]1CCN(c2cccc[nH+]2)C1 ZINC000176957685 385161809 /nfs/dbraw/zinc/16/18/09/385161809.db2.gz YKEDCNWYZSQMMZ-LLVKDONJSA-N 1 2 248.326 2.250 20 0 BEADLO Cc1nc(C[N@@H+](C(C)C)C2CCC2)no1 ZINC000119723719 385164972 /nfs/dbraw/zinc/16/49/72/385164972.db2.gz ZRTPPIAVCNNSAM-UHFFFAOYSA-N 1 2 209.293 2.141 20 0 BEADLO Cc1nc(C[N@H+](C(C)C)C2CCC2)no1 ZINC000119723719 385164981 /nfs/dbraw/zinc/16/49/81/385164981.db2.gz ZRTPPIAVCNNSAM-UHFFFAOYSA-N 1 2 209.293 2.141 20 0 BEADLO Cc1ccc(N(C)Cc2c[nH+]cn2C)cc1 ZINC000177037825 385171048 /nfs/dbraw/zinc/17/10/48/385171048.db2.gz HTEQYBVQXXLGSY-UHFFFAOYSA-N 1 2 215.300 2.365 20 0 BEADLO COC[C@H]([NH2+]Cc1cncc(C)c1)c1ccco1 ZINC000190017203 385207288 /nfs/dbraw/zinc/20/72/88/385207288.db2.gz GZMFUCOSSDFTOA-ZDUSSCGKSA-N 1 2 246.310 2.460 20 0 BEADLO C[C@H](Nc1cc[nH+]c(C2CC2)n1)[C@@H]1CCCO1 ZINC000110128265 385215902 /nfs/dbraw/zinc/21/59/02/385215902.db2.gz VUORJQYIVZBRMU-ONGXEEELSA-N 1 2 233.315 2.333 20 0 BEADLO CC(C)CO[C@H]1CC[N@H+](Cc2cscn2)C1 ZINC000177409112 385235962 /nfs/dbraw/zinc/23/59/62/385235962.db2.gz XXNAIGSZXCAXHG-LBPRGKRZSA-N 1 2 240.372 2.390 20 0 BEADLO CC(C)CO[C@H]1CC[N@@H+](Cc2cscn2)C1 ZINC000177409112 385235966 /nfs/dbraw/zinc/23/59/66/385235966.db2.gz XXNAIGSZXCAXHG-LBPRGKRZSA-N 1 2 240.372 2.390 20 0 BEADLO COC[C@@H]1CC[N@H+](Cc2csc(Cl)n2)C1 ZINC000294823859 385244845 /nfs/dbraw/zinc/24/48/45/385244845.db2.gz AALPQVXYYFBHRA-MRVPVSSYSA-N 1 2 246.763 2.265 20 0 BEADLO COC[C@@H]1CC[N@@H+](Cc2csc(Cl)n2)C1 ZINC000294823859 385244851 /nfs/dbraw/zinc/24/48/51/385244851.db2.gz AALPQVXYYFBHRA-MRVPVSSYSA-N 1 2 246.763 2.265 20 0 BEADLO CC(C)C[C@H]1CCN(c2cc(CO)cc[nH+]2)C1 ZINC000307848208 385302312 /nfs/dbraw/zinc/30/23/12/385302312.db2.gz SZPFSTIXRZYOHF-GFCCVEGCSA-N 1 2 234.343 2.446 20 0 BEADLO C[C@@H]([NH2+]c1ccc(-n2ccnn2)cc1)C1CC1 ZINC000191453164 385304967 /nfs/dbraw/zinc/30/49/67/385304967.db2.gz SBIVLIIYIWDSHE-SNVBAGLBSA-N 1 2 228.299 2.478 20 0 BEADLO Cc1ccc(N[C@H](C)c2cnccn2)c[nH+]1 ZINC000154237160 385310853 /nfs/dbraw/zinc/31/08/53/385310853.db2.gz QFBDWPSATDPRDI-SNVBAGLBSA-N 1 2 214.272 2.353 20 0 BEADLO COC(=O)[C@@H](C)[NH2+]C(C)(C)c1cccs1 ZINC000308950232 385311387 /nfs/dbraw/zinc/31/13/87/385311387.db2.gz OWXLABSYQANEPO-MRVPVSSYSA-N 1 2 227.329 2.134 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2ccncc2)CCO1 ZINC000131233080 385319512 /nfs/dbraw/zinc/31/95/12/385319512.db2.gz BLLIYRGTTJDSHN-CYBMUJFWSA-N 1 2 220.316 2.083 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2ccncc2)CCO1 ZINC000131233080 385319517 /nfs/dbraw/zinc/31/95/17/385319517.db2.gz BLLIYRGTTJDSHN-CYBMUJFWSA-N 1 2 220.316 2.083 20 0 BEADLO C[N@@H+](Cc1nccs1)C[C@@H]1CCC=CO1 ZINC000191082310 385281024 /nfs/dbraw/zinc/28/10/24/385281024.db2.gz WTCGFNQBDFZLTB-JTQLQIEISA-N 1 2 224.329 2.268 20 0 BEADLO C[N@H+](Cc1nccs1)C[C@@H]1CCC=CO1 ZINC000191082310 385281029 /nfs/dbraw/zinc/28/10/29/385281029.db2.gz WTCGFNQBDFZLTB-JTQLQIEISA-N 1 2 224.329 2.268 20 0 BEADLO CC[C@@H]1C[NH+](Cc2ccno2)C[C@@H](CC)O1 ZINC000569224028 385291419 /nfs/dbraw/zinc/29/14/19/385291419.db2.gz ATCPZUHOCWQOIL-GHMZBOCLSA-N 1 2 224.304 2.064 20 0 BEADLO CSC1(CNc2cc(C)[nH+]cn2)CCC1 ZINC000227987989 385300383 /nfs/dbraw/zinc/30/03/83/385300383.db2.gz ZEKRGTWKCDJZFF-UHFFFAOYSA-N 1 2 223.345 2.483 20 0 BEADLO C[C@H]1CCCC[C@H]1C[N@H+]1CC(=O)N(C2CC2)C1 ZINC000448283064 385301137 /nfs/dbraw/zinc/30/11/37/385301137.db2.gz WXGQMLWNZYPMDD-RYUDHWBXSA-N 1 2 236.359 2.077 20 0 BEADLO C[C@H]1CCCC[C@H]1C[N@@H+]1CC(=O)N(C2CC2)C1 ZINC000448283064 385301141 /nfs/dbraw/zinc/30/11/41/385301141.db2.gz WXGQMLWNZYPMDD-RYUDHWBXSA-N 1 2 236.359 2.077 20 0 BEADLO C[N@H+](CCOCc1ccccc1)Cc1ncc[nH]1 ZINC000154550065 385337838 /nfs/dbraw/zinc/33/78/38/385337838.db2.gz MOTAYPNBIDPHNJ-UHFFFAOYSA-N 1 2 245.326 2.058 20 0 BEADLO C[N@@H+](CCOCc1ccccc1)Cc1ncc[nH]1 ZINC000154550065 385337841 /nfs/dbraw/zinc/33/78/41/385337841.db2.gz MOTAYPNBIDPHNJ-UHFFFAOYSA-N 1 2 245.326 2.058 20 0 BEADLO CC[C@H](C)CN(C)C(=O)/C=C\c1[nH+]ccn1CC ZINC000492322991 385358388 /nfs/dbraw/zinc/35/83/88/385358388.db2.gz UBBPRQRLVNKIQJ-KRZKBDHCSA-N 1 2 249.358 2.421 20 0 BEADLO CCCCCC(=O)N(C)CCCn1cc[nH+]c1 ZINC000154846675 385359297 /nfs/dbraw/zinc/35/92/97/385359297.db2.gz FPQIBXJCNVJIRA-UHFFFAOYSA-N 1 2 237.347 2.312 20 0 BEADLO CCN(C)C(=O)Cn1c[nH+]c2cc(C)c(C)cc21 ZINC000131893696 385367826 /nfs/dbraw/zinc/36/78/26/385367826.db2.gz MCCPWAPTBHKGGY-UHFFFAOYSA-N 1 2 245.326 2.131 20 0 BEADLO C[C@@H](C(=O)Nc1ccc[nH+]c1N(C)C)C1CC1 ZINC000178425513 385370974 /nfs/dbraw/zinc/37/09/74/385370974.db2.gz XITJNTQWIZTUIO-SECBINFHSA-N 1 2 233.315 2.132 20 0 BEADLO CC[C@@H]([NH2+]CCc1c(C)cccc1C)C(=O)OC ZINC000192858955 385375231 /nfs/dbraw/zinc/37/52/31/385375231.db2.gz LMYKFCHNAXQWDT-CQSZACIVSA-N 1 2 249.354 2.387 20 0 BEADLO CC(C)CCC(=O)N(C)CCCn1cc[nH+]c1 ZINC000155148187 385376723 /nfs/dbraw/zinc/37/67/23/385376723.db2.gz DSCBMEXDXSYLNQ-UHFFFAOYSA-N 1 2 237.347 2.168 20 0 BEADLO C/C=C/C[S@@](=O)Cc1cn2c(cccc2C)[nH+]1 ZINC000155219450 385381324 /nfs/dbraw/zinc/38/13/24/385381324.db2.gz DEMNAVVUZRREGQ-IDOMTICXSA-N 1 2 248.351 2.468 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCc2ccccc2C1 ZINC000154450178 385326786 /nfs/dbraw/zinc/32/67/86/385326786.db2.gz YHTAZTXEKMDWJU-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCc2ccccc2C1 ZINC000154450178 385326790 /nfs/dbraw/zinc/32/67/90/385326790.db2.gz YHTAZTXEKMDWJU-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N[C@H]1CC=CCC1 ZINC000492529922 385395211 /nfs/dbraw/zinc/39/52/11/385395211.db2.gz HGIHJBGWUOECNU-LAUAKBEESA-N 1 2 245.326 2.141 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[NH2+][C@H](C)CSC ZINC000180999586 385400512 /nfs/dbraw/zinc/40/05/12/385400512.db2.gz HNZWQJBYVINFBH-GHMZBOCLSA-N 1 2 247.404 2.305 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@H]2CCC2(C)C)c[nH+]1 ZINC001645215205 1172645176 /nfs/dbraw/zinc/64/51/76/1172645176.db2.gz OAHQXQKKEZHUKT-SNVBAGLBSA-N 1 2 235.331 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@H]2CCC2(C)C)[nH+]1 ZINC001645215205 1172645179 /nfs/dbraw/zinc/64/51/79/1172645179.db2.gz OAHQXQKKEZHUKT-SNVBAGLBSA-N 1 2 235.331 2.025 20 0 BEADLO Cc1oncc1C[NH2+]C(C)(C)c1nccs1 ZINC000181761678 385415713 /nfs/dbraw/zinc/41/57/13/385415713.db2.gz CIILQPZYKJBRKH-UHFFFAOYSA-N 1 2 237.328 2.464 20 0 BEADLO C=Cn1cc(C[N@@H+](C)Cc2scnc2C)cn1 ZINC000193873170 385416244 /nfs/dbraw/zinc/41/62/44/385416244.db2.gz QGGITWSMLVKEMO-UHFFFAOYSA-N 1 2 248.355 2.381 20 0 BEADLO C=Cn1cc(C[N@H+](C)Cc2scnc2C)cn1 ZINC000193873170 385416247 /nfs/dbraw/zinc/41/62/47/385416247.db2.gz QGGITWSMLVKEMO-UHFFFAOYSA-N 1 2 248.355 2.381 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](C)c2ccccn2)o1 ZINC000181794924 385417086 /nfs/dbraw/zinc/41/70/86/385417086.db2.gz JOGXPHUTKYAGCE-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CCCC1 ZINC000120769167 385417566 /nfs/dbraw/zinc/41/75/66/385417566.db2.gz KBFHETDMERSUCC-UHFFFAOYSA-N 1 2 205.261 2.018 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+](C)Cc2ccoc2C)o1 ZINC000170820235 385449170 /nfs/dbraw/zinc/44/91/70/385449170.db2.gz XEUHPTXMAAKLTF-MRVPVSSYSA-N 1 2 235.287 2.472 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+](C)Cc2ccoc2C)o1 ZINC000170820235 385449173 /nfs/dbraw/zinc/44/91/73/385449173.db2.gz XEUHPTXMAAKLTF-MRVPVSSYSA-N 1 2 235.287 2.472 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2cocn2)o1 ZINC000182074253 385428410 /nfs/dbraw/zinc/42/84/10/385428410.db2.gz WUTWTZJWNVMXBE-SECBINFHSA-N 1 2 206.245 2.427 20 0 BEADLO C[C@@H](C(=O)Nc1ccc(N)[nH+]c1)C1CCCC1 ZINC000644084446 385434915 /nfs/dbraw/zinc/43/49/15/385434915.db2.gz PPERMJLIQIECBI-SECBINFHSA-N 1 2 233.315 2.259 20 0 BEADLO Cc1nn(C)cc1C[N@@H+]1CCn2cccc2[C@H]1C ZINC000179563812 385474136 /nfs/dbraw/zinc/47/41/36/385474136.db2.gz BDUNMNANWBBKOG-GFCCVEGCSA-N 1 2 244.342 2.107 20 0 BEADLO Cc1nn(C)cc1C[N@H+]1CCn2cccc2[C@H]1C ZINC000179563812 385474139 /nfs/dbraw/zinc/47/41/39/385474139.db2.gz BDUNMNANWBBKOG-GFCCVEGCSA-N 1 2 244.342 2.107 20 0 BEADLO FC(F)(F)[C@H]1CCC[N@H+](Cc2cc[nH]n2)C1 ZINC000179624558 385477767 /nfs/dbraw/zinc/47/77/67/385477767.db2.gz SQMITVADXVPIME-QMMMGPOBSA-N 1 2 233.237 2.184 20 0 BEADLO FC(F)(F)[C@H]1CCC[N@@H+](Cc2cc[nH]n2)C1 ZINC000179624558 385477768 /nfs/dbraw/zinc/47/77/68/385477768.db2.gz SQMITVADXVPIME-QMMMGPOBSA-N 1 2 233.237 2.184 20 0 BEADLO COC[C@H]([NH2+][C@H](C)c1cnccn1)c1ccco1 ZINC000156620936 385462127 /nfs/dbraw/zinc/46/21/27/385462127.db2.gz TVSSMJSLDPWZRX-PWSUYJOCSA-N 1 2 247.298 2.108 20 0 BEADLO CCc1cnc(NC(=O)C=Cc2c[nH]c[nH+]2)s1 ZINC000492915807 385462715 /nfs/dbraw/zinc/46/27/15/385462715.db2.gz XYNQSVJXPLVSFF-ONEGZZNKSA-N 1 2 248.311 2.081 20 0 BEADLO CO[C@H]1CCCN(C(=O)Nc2cc[nH+]cc2C)C1 ZINC000179863410 385496012 /nfs/dbraw/zinc/49/60/12/385496012.db2.gz YHMOIDMQBFHLRG-NSHDSACASA-N 1 2 249.314 2.033 20 0 BEADLO CCN(CCC1CC1)c1nc[nH+]c(N)c1Cl ZINC000309242096 385496216 /nfs/dbraw/zinc/49/62/16/385496216.db2.gz BACCWVFMWBYYCJ-UHFFFAOYSA-N 1 2 240.738 2.339 20 0 BEADLO CCN(CCC1CC1)c1[nH+]cnc(N)c1Cl ZINC000309242096 385496219 /nfs/dbraw/zinc/49/62/19/385496219.db2.gz BACCWVFMWBYYCJ-UHFFFAOYSA-N 1 2 240.738 2.339 20 0 BEADLO CC(C)c1nc(C[N@H+](C)CC2CCC2)no1 ZINC000111299135 385502668 /nfs/dbraw/zinc/50/26/68/385502668.db2.gz QDQHFNMZOWKJHS-UHFFFAOYSA-N 1 2 223.320 2.425 20 0 BEADLO CC(C)c1nc(C[N@@H+](C)CC2CCC2)no1 ZINC000111299135 385502671 /nfs/dbraw/zinc/50/26/71/385502671.db2.gz QDQHFNMZOWKJHS-UHFFFAOYSA-N 1 2 223.320 2.425 20 0 BEADLO C=Cn1cc(CN2CCC[C@@H]2c2[nH]cc[nH+]2)cn1 ZINC000364762085 385510076 /nfs/dbraw/zinc/51/00/76/385510076.db2.gz XUUSXTJANNHUOI-GFCCVEGCSA-N 1 2 243.314 2.044 20 0 BEADLO C=Cn1cc(C[N@@H+]2CCC[C@@H]2c2ncc[nH]2)cn1 ZINC000364762085 385510080 /nfs/dbraw/zinc/51/00/80/385510080.db2.gz XUUSXTJANNHUOI-GFCCVEGCSA-N 1 2 243.314 2.044 20 0 BEADLO C=Cn1cc(C[N@H+]2CCC[C@@H]2c2ncc[nH]2)cn1 ZINC000364762085 385510084 /nfs/dbraw/zinc/51/00/84/385510084.db2.gz XUUSXTJANNHUOI-GFCCVEGCSA-N 1 2 243.314 2.044 20 0 BEADLO C[NH2+]Cc1noc(C2CCCCCC2)n1 ZINC000053716305 385515266 /nfs/dbraw/zinc/51/52/66/385515266.db2.gz MKTWGCNLUGSWKT-UHFFFAOYSA-N 1 2 209.293 2.227 20 0 BEADLO CCC[C@@](C)([NH2+]CCOC(C)(C)C)C(=O)OC ZINC000109801868 385489219 /nfs/dbraw/zinc/48/92/19/385489219.db2.gz XZZPCHXXYUYFAB-CYBMUJFWSA-N 1 2 245.363 2.123 20 0 BEADLO C[N@H+](CCOc1ccccc1F)Cc1cnc[nH]1 ZINC000179771239 385490299 /nfs/dbraw/zinc/49/02/99/385490299.db2.gz BVPLYWJCWBGGAX-UHFFFAOYSA-N 1 2 249.289 2.060 20 0 BEADLO C[N@@H+](CCOc1ccccc1F)Cc1cnc[nH]1 ZINC000179771239 385490302 /nfs/dbraw/zinc/49/03/02/385490302.db2.gz BVPLYWJCWBGGAX-UHFFFAOYSA-N 1 2 249.289 2.060 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2cccnc2)s1 ZINC000180668720 385536827 /nfs/dbraw/zinc/53/68/27/385536827.db2.gz VACXMXGMZYBCPF-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2cccnc2)s1 ZINC000180668720 385536829 /nfs/dbraw/zinc/53/68/29/385536829.db2.gz VACXMXGMZYBCPF-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CC(C)[C@@H]1CCCN1C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493162320 385539516 /nfs/dbraw/zinc/53/95/16/385539516.db2.gz SKFQECBZCSEQFE-QRGHLMKCSA-N 1 2 233.315 2.070 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CCO[C@@H](C)[C@H]1C ZINC000180726413 385542494 /nfs/dbraw/zinc/54/24/94/385542494.db2.gz RKKNYZYSMRTQNJ-MNOVXSKESA-N 1 2 249.314 2.031 20 0 BEADLO Cc1cnc(C[NH+]2C[C@@H](C)O[C@H](C)C2)s1 ZINC000180409721 385521923 /nfs/dbraw/zinc/52/19/23/385521923.db2.gz SNPMTOWRDXMPRJ-RKDXNWHRSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1cnc(C[N@H+]2C[C@H](C)OC(C)(C)C2)s1 ZINC000180447957 385523855 /nfs/dbraw/zinc/52/38/55/385523855.db2.gz RYVHYBDIMHPOEA-VIFPVBQESA-N 1 2 240.372 2.451 20 0 BEADLO Cc1cnc(C[N@@H+]2C[C@H](C)OC(C)(C)C2)s1 ZINC000180447957 385523860 /nfs/dbraw/zinc/52/38/60/385523860.db2.gz RYVHYBDIMHPOEA-VIFPVBQESA-N 1 2 240.372 2.451 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1ccoc1 ZINC000107287469 385562505 /nfs/dbraw/zinc/56/25/05/385562505.db2.gz RDWQCJHDVGFPTN-UHFFFAOYSA-N 1 2 202.213 2.235 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1cccnc1 ZINC000107287561 385562619 /nfs/dbraw/zinc/56/26/19/385562619.db2.gz OHIPFMBKDNLASK-UHFFFAOYSA-N 1 2 213.240 2.037 20 0 BEADLO Cc1nc(C[NH2+][C@H](C)c2ccccc2)no1 ZINC000181355917 385572698 /nfs/dbraw/zinc/57/26/98/385572698.db2.gz ZRWDWXVRPOKGJQ-SECBINFHSA-N 1 2 217.272 2.229 20 0 BEADLO C[N@@H+](Cc1ncn(-c2ccccc2)n1)CC1CC1 ZINC000181544685 385582740 /nfs/dbraw/zinc/58/27/40/385582740.db2.gz WDJDVSBMWHDUQX-UHFFFAOYSA-N 1 2 242.326 2.109 20 0 BEADLO C[N@H+](Cc1ncn(-c2ccccc2)n1)CC1CC1 ZINC000181544685 385582742 /nfs/dbraw/zinc/58/27/42/385582742.db2.gz WDJDVSBMWHDUQX-UHFFFAOYSA-N 1 2 242.326 2.109 20 0 BEADLO CC[N@H+](CC(=O)Oc1ccccc1OC)C1CC1 ZINC000269621464 385616011 /nfs/dbraw/zinc/61/60/11/385616011.db2.gz DXQZBRCBPZUFTN-UHFFFAOYSA-N 1 2 249.310 2.085 20 0 BEADLO CC[N@@H+](CC(=O)Oc1ccccc1OC)C1CC1 ZINC000269621464 385616016 /nfs/dbraw/zinc/61/60/16/385616016.db2.gz DXQZBRCBPZUFTN-UHFFFAOYSA-N 1 2 249.310 2.085 20 0 BEADLO CC[C@@H](C)OCC(=O)Nc1cccc2[nH+]ccn21 ZINC000269818813 385636623 /nfs/dbraw/zinc/63/66/23/385636623.db2.gz FXUATDXCMJQZNP-SNVBAGLBSA-N 1 2 247.298 2.088 20 0 BEADLO CC(C)n1cc(C[NH2+][C@@H]2CCCC[C@H]2F)nn1 ZINC000414513975 385634987 /nfs/dbraw/zinc/63/49/87/385634987.db2.gz QLWZMLANYQMMEX-VXGBXAGGSA-N 1 2 240.326 2.229 20 0 BEADLO COC(=O)C[N@H+](C)CCSC1CCCCC1 ZINC000337340291 385610708 /nfs/dbraw/zinc/61/07/08/385610708.db2.gz SPSTVEMLOZDWHZ-UHFFFAOYSA-N 1 2 245.388 2.157 20 0 BEADLO COC(=O)C[N@@H+](C)CCSC1CCCCC1 ZINC000337340291 385610714 /nfs/dbraw/zinc/61/07/14/385610714.db2.gz SPSTVEMLOZDWHZ-UHFFFAOYSA-N 1 2 245.388 2.157 20 0 BEADLO CCc1ccccc1C[N@H+](C)[C@@H](C)C(=O)OC ZINC000280842187 385611217 /nfs/dbraw/zinc/61/12/17/385611217.db2.gz XDZVKZCWMXDSJU-NSHDSACASA-N 1 2 235.327 2.242 20 0 BEADLO CCc1ccccc1C[N@@H+](C)[C@@H](C)C(=O)OC ZINC000280842187 385611223 /nfs/dbraw/zinc/61/12/23/385611223.db2.gz XDZVKZCWMXDSJU-NSHDSACASA-N 1 2 235.327 2.242 20 0 BEADLO C[C@H]1CN(c2[nH+]ccc3cc(F)ccc32)C[C@@H]1O ZINC000645203963 385639686 /nfs/dbraw/zinc/63/96/86/385639686.db2.gz HCGFGXDBLHOGLI-ZANVPECISA-N 1 2 246.285 2.191 20 0 BEADLO Cc1cnn(CC[N@@H+]2CCCC[C@@H]2C(F)F)c1 ZINC000337389258 385640256 /nfs/dbraw/zinc/64/02/56/385640256.db2.gz GOPGEXXDUUCGMG-LLVKDONJSA-N 1 2 243.301 2.311 20 0 BEADLO Cc1cnn(CC[N@H+]2CCCC[C@@H]2C(F)F)c1 ZINC000337389258 385640261 /nfs/dbraw/zinc/64/02/61/385640261.db2.gz GOPGEXXDUUCGMG-LLVKDONJSA-N 1 2 243.301 2.311 20 0 BEADLO C[C@@H]1OCC[C@H]1Sc1[nH+]cnc2[nH]ccc21 ZINC000269905196 385645137 /nfs/dbraw/zinc/64/51/37/385645137.db2.gz GQYRUFLQRIVTSY-IONNQARKSA-N 1 2 235.312 2.227 20 0 BEADLO CCc1cc(N[C@H]2CCO[C@H](CC)C2)nc[nH+]1 ZINC000643195934 385653369 /nfs/dbraw/zinc/65/33/69/385653369.db2.gz FPYPTWZRWFFWFP-NWDGAFQWSA-N 1 2 235.331 2.409 20 0 BEADLO CCc1cc(N[C@@H]2CCO[C@H](CC)C2)nc[nH+]1 ZINC000643195936 385654137 /nfs/dbraw/zinc/65/41/37/385654137.db2.gz FPYPTWZRWFFWFP-VXGBXAGGSA-N 1 2 235.331 2.409 20 0 BEADLO Clc1ccccc1CC[NH+]1CCOCC1 ZINC000058905656 385657242 /nfs/dbraw/zinc/65/72/42/385657242.db2.gz WZUNKGDZXCQIQT-UHFFFAOYSA-N 1 2 225.719 2.215 20 0 BEADLO c1nc(NCC2CC2)cc(NCC2CCCC2)[nH+]1 ZINC000340016541 385673759 /nfs/dbraw/zinc/67/37/59/385673759.db2.gz FAYCJJYWMMSNII-UHFFFAOYSA-N 1 2 246.358 2.323 20 0 BEADLO c1nc(NCC2CCCC2)cc(NCC2CC2)[nH+]1 ZINC000340016541 385673767 /nfs/dbraw/zinc/67/37/67/385673767.db2.gz FAYCJJYWMMSNII-UHFFFAOYSA-N 1 2 246.358 2.323 20 0 BEADLO CC[C@@H](NC(=O)C1(CCF)CC1)c1[nH]cc[nH+]1 ZINC000355752400 385684693 /nfs/dbraw/zinc/68/46/93/385684693.db2.gz NVBSYXQQABXLKU-SECBINFHSA-N 1 2 239.294 2.117 20 0 BEADLO CC[C@H]([NH2+]Cc1c(C)noc1C)c1nccn1C ZINC000182605110 385686779 /nfs/dbraw/zinc/68/67/79/385686779.db2.gz QQPJACSEMNBKNM-LBPRGKRZSA-N 1 2 248.330 2.266 20 0 BEADLO C[C@@H](Nc1cc[nH+]c(C2CC2)n1)c1cn[nH]c1 ZINC000270272398 385692135 /nfs/dbraw/zinc/69/21/35/385692135.db2.gz WTWDMLWLGZKDJG-MRVPVSSYSA-N 1 2 229.287 2.250 20 0 BEADLO C[C@@H]([NH2+]CC(F)(F)CO)c1cccs1 ZINC000184703082 385696001 /nfs/dbraw/zinc/69/60/01/385696001.db2.gz GYGBKPIHDQTELJ-SSDOTTSWSA-N 1 2 221.272 2.026 20 0 BEADLO CO[C@@H](C)CCNc1cc(C)[nH+]c(C(C)C)n1 ZINC000336653785 385717888 /nfs/dbraw/zinc/71/78/88/385717888.db2.gz GMTXUPRZMKHIND-NSHDSACASA-N 1 2 237.347 2.167 20 0 BEADLO COC(=O)CCC[N@@H+]1CCCC[C@H]1C(F)F ZINC000337538039 385699518 /nfs/dbraw/zinc/69/95/18/385699518.db2.gz ZHKNMZFDDAPOKJ-VIFPVBQESA-N 1 2 235.274 2.059 20 0 BEADLO COC(=O)CCC[N@H+]1CCCC[C@H]1C(F)F ZINC000337538039 385699527 /nfs/dbraw/zinc/69/95/27/385699527.db2.gz ZHKNMZFDDAPOKJ-VIFPVBQESA-N 1 2 235.274 2.059 20 0 BEADLO CC(C)[N@H+](CCCn1ccnc1)CC(F)F ZINC000182865989 385713687 /nfs/dbraw/zinc/71/36/87/385713687.db2.gz YXVHOFQWMAVGFO-UHFFFAOYSA-N 1 2 231.290 2.249 20 0 BEADLO CC(C)[N@@H+](CCCn1ccnc1)CC(F)F ZINC000182865989 385713692 /nfs/dbraw/zinc/71/36/92/385713692.db2.gz YXVHOFQWMAVGFO-UHFFFAOYSA-N 1 2 231.290 2.249 20 0 BEADLO CON(CCCn1cc[nH+]c1)Cc1ccccc1 ZINC000183098028 385736079 /nfs/dbraw/zinc/73/60/79/385736079.db2.gz FMJDLMBZLPCGLQ-UHFFFAOYSA-N 1 2 245.326 2.337 20 0 BEADLO C[C@@]1(O)CCN(c2cc(C(F)(F)F)cc[nH+]2)C1 ZINC000230476730 385738198 /nfs/dbraw/zinc/73/81/98/385738198.db2.gz YWODWUJHXBJEEV-SNVBAGLBSA-N 1 2 246.232 2.062 20 0 BEADLO COC(=O)C[NH2+][C@H](c1ccccc1C)C(C)C ZINC000183230283 385743799 /nfs/dbraw/zinc/74/37/99/385743799.db2.gz SIXIFSLPQKLSTJ-AWEZNQCLSA-N 1 2 235.327 2.455 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2nccn2C)cc1 ZINC000183231835 385744121 /nfs/dbraw/zinc/74/41/21/385744121.db2.gz ACXNTHSTTMMLJO-UHFFFAOYSA-N 1 2 229.327 2.361 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2nccn2C)cc1 ZINC000183231835 385744123 /nfs/dbraw/zinc/74/41/23/385744123.db2.gz ACXNTHSTTMMLJO-UHFFFAOYSA-N 1 2 229.327 2.361 20 0 BEADLO CCC[C@H](C)N(C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000282575469 385772961 /nfs/dbraw/zinc/77/29/61/385772961.db2.gz ASYIAZDYACGXJO-FGEFZZPRSA-N 1 2 221.304 2.070 20 0 BEADLO CC[N@H+](Cc1oc(C(C)C)nc1C)C1COC1 ZINC000451284992 385773431 /nfs/dbraw/zinc/77/34/31/385773431.db2.gz ABQLRAJQLDYRKL-UHFFFAOYSA-N 1 2 238.331 2.327 20 0 BEADLO CC[N@@H+](Cc1oc(C(C)C)nc1C)C1COC1 ZINC000451284992 385773434 /nfs/dbraw/zinc/77/34/34/385773434.db2.gz ABQLRAJQLDYRKL-UHFFFAOYSA-N 1 2 238.331 2.327 20 0 BEADLO Cc1cc(C[N@@H+](C)CCOCC(C)C)no1 ZINC000282640000 385774233 /nfs/dbraw/zinc/77/42/33/385774233.db2.gz KJVAYSDGKQFXKE-UHFFFAOYSA-N 1 2 226.320 2.087 20 0 BEADLO Cc1cc(C[N@H+](C)CCOCC(C)C)no1 ZINC000282640000 385774236 /nfs/dbraw/zinc/77/42/36/385774236.db2.gz KJVAYSDGKQFXKE-UHFFFAOYSA-N 1 2 226.320 2.087 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N(C1CCC1)C1CCC1 ZINC000293992186 385782547 /nfs/dbraw/zinc/78/25/47/385782547.db2.gz WMGNRKBBHDPKOF-UHFFFAOYSA-N 1 2 247.342 2.276 20 0 BEADLO CN(C[C@@H]1CCCO1)c1[nH]c2ccccc2[nH+]1 ZINC000270563092 385719340 /nfs/dbraw/zinc/71/93/40/385719340.db2.gz KOBCFSJDMHTICF-JTQLQIEISA-N 1 2 231.299 2.178 20 0 BEADLO CCN(CCOC)c1[nH+]c2ccccc2n1C ZINC000270561358 385720033 /nfs/dbraw/zinc/72/00/33/385720033.db2.gz JWDUBTFOWPKKKQ-UHFFFAOYSA-N 1 2 233.315 2.046 20 0 BEADLO FC(F)[C@@H]1CCC[N@@H+]1CCO[C@H]1CCCCO1 ZINC000353197029 385722772 /nfs/dbraw/zinc/72/27/72/385722772.db2.gz VHGRLRAGSPJINW-QWRGUYRKSA-N 1 2 249.301 2.259 20 0 BEADLO FC(F)[C@@H]1CCC[N@H+]1CCO[C@H]1CCCCO1 ZINC000353197029 385722778 /nfs/dbraw/zinc/72/27/78/385722778.db2.gz VHGRLRAGSPJINW-QWRGUYRKSA-N 1 2 249.301 2.259 20 0 BEADLO CC(C)c1nnc([C@H](C)[NH2+]Cc2ccco2)[nH]1 ZINC000270635136 385724578 /nfs/dbraw/zinc/72/45/78/385724578.db2.gz GUQDYOJUXFRJHP-VIFPVBQESA-N 1 2 234.303 2.372 20 0 BEADLO Cc1ccc(C[NH2+]CC(F)(F)CO)cc1C ZINC000183879242 385800070 /nfs/dbraw/zinc/80/00/70/385800070.db2.gz VIURMRPTWZMCIQ-UHFFFAOYSA-N 1 2 229.270 2.021 20 0 BEADLO CC[C@](C)([NH2+]Cc1cccc(C)c1)C(=O)OC ZINC000271185044 385801432 /nfs/dbraw/zinc/80/14/32/385801432.db2.gz JHLLDXROVNDQEE-AWEZNQCLSA-N 1 2 235.327 2.426 20 0 BEADLO COC(=O)C[N@H+](C)Cc1ccc(C(F)F)cc1 ZINC000183920886 385803503 /nfs/dbraw/zinc/80/35/03/385803503.db2.gz KPOHXSNSIZICLR-UHFFFAOYSA-N 1 2 243.253 2.229 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC000183920886 385803506 /nfs/dbraw/zinc/80/35/06/385803506.db2.gz KPOHXSNSIZICLR-UHFFFAOYSA-N 1 2 243.253 2.229 20 0 BEADLO C[C@@H]1[C@H](C)[S@](=O)CC[N@@H+]1Cc1ccsc1 ZINC000271221393 385805393 /nfs/dbraw/zinc/80/53/93/385805393.db2.gz ZGYRQLZBAVTJEP-HFBDOXOYSA-N 1 2 243.397 2.089 20 0 BEADLO C[C@@H]1[C@H](C)[S@](=O)CC[N@H+]1Cc1ccsc1 ZINC000271221393 385805398 /nfs/dbraw/zinc/80/53/98/385805398.db2.gz ZGYRQLZBAVTJEP-HFBDOXOYSA-N 1 2 243.397 2.089 20 0 BEADLO C[C@@H]1[C@@H](C)[S@@](=O)CC[N@@H+]1Cc1ccsc1 ZINC000271221392 385806369 /nfs/dbraw/zinc/80/63/69/385806369.db2.gz ZGYRQLZBAVTJEP-FCHSOHFDSA-N 1 2 243.397 2.089 20 0 BEADLO C[C@@H]1[C@@H](C)[S@@](=O)CC[N@H+]1Cc1ccsc1 ZINC000271221392 385806370 /nfs/dbraw/zinc/80/63/70/385806370.db2.gz ZGYRQLZBAVTJEP-FCHSOHFDSA-N 1 2 243.397 2.089 20 0 BEADLO c1oc2ccccc2c1C[N@@H+]1CCO[C@@H]2C[C@@H]21 ZINC000644838774 385856958 /nfs/dbraw/zinc/85/69/58/385856958.db2.gz SUOXXOUANBVQJO-GXTWGEPZSA-N 1 2 229.279 2.406 20 0 BEADLO c1oc2ccccc2c1C[N@H+]1CCO[C@@H]2C[C@@H]21 ZINC000644838774 385856963 /nfs/dbraw/zinc/85/69/63/385856963.db2.gz SUOXXOUANBVQJO-GXTWGEPZSA-N 1 2 229.279 2.406 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC[C@@H]1CCCC1(C)C ZINC000294224093 385823450 /nfs/dbraw/zinc/82/34/50/385823450.db2.gz QZZLIVKKDIRRDX-NSHDSACASA-N 1 2 249.358 2.203 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)NC[C@@H]1CCCC1(C)C ZINC000294224093 385823453 /nfs/dbraw/zinc/82/34/53/385823453.db2.gz QZZLIVKKDIRRDX-NSHDSACASA-N 1 2 249.358 2.203 20 0 BEADLO Cc1nnc(C[N@@H+]2CCc3ccccc3C2)s1 ZINC000271408401 385825853 /nfs/dbraw/zinc/82/58/53/385825853.db2.gz JOHGXIIDQHHYDA-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1nnc(C[N@H+]2CCc3ccccc3C2)s1 ZINC000271408401 385825857 /nfs/dbraw/zinc/82/58/57/385825857.db2.gz JOHGXIIDQHHYDA-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO CC[C@H]1CCC[C@H]1C(=O)N(C)Cc1[nH+]ccn1C ZINC000294252204 385828033 /nfs/dbraw/zinc/82/80/33/385828033.db2.gz CVDWKRUNOZNETR-NWDGAFQWSA-N 1 2 249.358 2.205 20 0 BEADLO C[C@@H](c1nnnn1C1CCCCC1)[NH+]1CCCC1 ZINC000188664758 385829528 /nfs/dbraw/zinc/82/95/28/385829528.db2.gz WPOSZJLKRJLJJE-NSHDSACASA-N 1 2 249.362 2.335 20 0 BEADLO Cn1nccc1[C@H]1CCCN(c2cccc[nH+]2)C1 ZINC000335667459 385832098 /nfs/dbraw/zinc/83/20/98/385832098.db2.gz WAICYDPJMJJKFK-LBPRGKRZSA-N 1 2 242.326 2.199 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@H](C)c1cnccc1C ZINC000271480600 385832986 /nfs/dbraw/zinc/83/29/86/385832986.db2.gz LTIXYHDVDOSQDM-LLVKDONJSA-N 1 2 230.315 2.272 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)CCCC1CC1 ZINC000643232022 385835351 /nfs/dbraw/zinc/83/53/51/385835351.db2.gz ZIWXTFCRNQAOQE-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO Cc1nc(C[N@@H+]2CCc3n[nH]cc3C2)sc1C ZINC000271631170 385841404 /nfs/dbraw/zinc/84/14/04/385841404.db2.gz YJVOQQKPKQFLSE-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO Cc1nc(C[N@H+]2CCc3n[nH]cc3C2)sc1C ZINC000271631170 385841408 /nfs/dbraw/zinc/84/14/08/385841408.db2.gz YJVOQQKPKQFLSE-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO CC[NH2+]Cc1cccc(NCc2cn[nH]c2C)c1 ZINC000414870090 385843889 /nfs/dbraw/zinc/84/38/89/385843889.db2.gz RIWVELZLVKRSQR-UHFFFAOYSA-N 1 2 244.342 2.440 20 0 BEADLO c1[nH]nnc1C[NH2+][C@@H]1CCC[C@H]1c1ccccc1 ZINC000283969379 385843953 /nfs/dbraw/zinc/84/39/53/385843953.db2.gz LYJHSWNKRDNKMC-UONOGXRCSA-N 1 2 242.326 2.231 20 0 BEADLO c1n[nH]nc1C[NH2+][C@@H]1CCC[C@H]1c1ccccc1 ZINC000283969379 385843954 /nfs/dbraw/zinc/84/39/54/385843954.db2.gz LYJHSWNKRDNKMC-UONOGXRCSA-N 1 2 242.326 2.231 20 0 BEADLO Cc1csc([C@H](C)[NH2+]Cc2ccn(C)n2)n1 ZINC000112466360 385845433 /nfs/dbraw/zinc/84/54/33/385845433.db2.gz OTPJMLIZBZBMKP-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO Cc1ccsc1C[N@@H+]1CCO[C@@H]2C[C@@H]21 ZINC000644837447 385848405 /nfs/dbraw/zinc/84/84/05/385848405.db2.gz JSFOZTDDONWNFZ-VHSXEESVSA-N 1 2 209.314 2.030 20 0 BEADLO Cc1ccsc1C[N@H+]1CCO[C@@H]2C[C@@H]21 ZINC000644837447 385848410 /nfs/dbraw/zinc/84/84/10/385848410.db2.gz JSFOZTDDONWNFZ-VHSXEESVSA-N 1 2 209.314 2.030 20 0 BEADLO CCC1(CC)CN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000294411684 385848941 /nfs/dbraw/zinc/84/89/41/385848941.db2.gz NSQLEWWZNQBTLK-AATRIKPKSA-N 1 2 233.315 2.072 20 0 BEADLO C[C@@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)[C@H]1C ZINC000284073888 385849765 /nfs/dbraw/zinc/84/97/65/385849765.db2.gz RTNMJGXRWLKOOO-PVTPVBHGSA-N 1 2 233.315 2.070 20 0 BEADLO OCCCCSc1[nH+]cc2ccccn21 ZINC000284092040 385851862 /nfs/dbraw/zinc/85/18/62/385851862.db2.gz VRYKZFKIISKBDA-UHFFFAOYSA-N 1 2 222.313 2.199 20 0 BEADLO CN(C[C@H]1CCCC[C@H]1O)c1cccc[nH+]1 ZINC000272253255 385888526 /nfs/dbraw/zinc/88/85/26/385888526.db2.gz TWIAJNLGZNBKFW-VXGBXAGGSA-N 1 2 220.316 2.069 20 0 BEADLO CC(C)c1nnc(C[NH2+]Cc2ccc(F)cc2)[nH]1 ZINC000294748098 385892317 /nfs/dbraw/zinc/89/23/17/385892317.db2.gz HVXOQONFPJDMIF-UHFFFAOYSA-N 1 2 248.305 2.357 20 0 BEADLO CCc1cccc(C[NH2+][C@@H](C(=O)OC)C2CC2)c1 ZINC000285051191 385895015 /nfs/dbraw/zinc/89/50/15/385895015.db2.gz ODAHJWJDPUAYDJ-CQSZACIVSA-N 1 2 247.338 2.290 20 0 BEADLO C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N)[nH+]c1 ZINC000335036461 385925186 /nfs/dbraw/zinc/92/51/86/385925186.db2.gz DTHKVBYYIMVQPZ-MWLCHTKSSA-N 1 2 233.315 2.259 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2CCO[C@H](C)C2)c(C)[nH+]1 ZINC000271961955 385864116 /nfs/dbraw/zinc/86/41/16/385864116.db2.gz GUWHSUXCCAXMSN-ZYHUDNBSSA-N 1 2 248.326 2.452 20 0 BEADLO Cc1ccc(CC(=O)N[C@H](C)c2[nH]cc[nH+]2)s1 ZINC000647808779 385866196 /nfs/dbraw/zinc/86/61/96/385866196.db2.gz JVMSUVISPUTUBA-SECBINFHSA-N 1 2 249.339 2.200 20 0 BEADLO CCN1CC[NH+](Cc2csc(C)c2)CC1 ZINC000294585080 385871111 /nfs/dbraw/zinc/87/11/11/385871111.db2.gz QYNLSJLQVDTSKH-UHFFFAOYSA-N 1 2 224.373 2.194 20 0 BEADLO Cn1ccnc1C[N@H+](C)CCSC(C)(C)C ZINC000284505892 385873898 /nfs/dbraw/zinc/87/38/98/385873898.db2.gz VGZYFKNOIHDAJT-UHFFFAOYSA-N 1 2 241.404 2.384 20 0 BEADLO Cn1ccnc1C[N@@H+](C)CCSC(C)(C)C ZINC000284505892 385873900 /nfs/dbraw/zinc/87/39/00/385873900.db2.gz VGZYFKNOIHDAJT-UHFFFAOYSA-N 1 2 241.404 2.384 20 0 BEADLO Cc1nocc1C[N@@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000294608061 385874146 /nfs/dbraw/zinc/87/41/46/385874146.db2.gz IHRHIUIYSSHHKW-CYBMUJFWSA-N 1 2 246.314 2.433 20 0 BEADLO Cc1nocc1C[N@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000294608061 385874150 /nfs/dbraw/zinc/87/41/50/385874150.db2.gz IHRHIUIYSSHHKW-CYBMUJFWSA-N 1 2 246.314 2.433 20 0 BEADLO Cc1ccc(CCOCc2[nH]cc[nH+]2)cc1 ZINC000272085864 385874204 /nfs/dbraw/zinc/87/42/04/385874204.db2.gz UCPBXPCEDWJDSQ-UHFFFAOYSA-N 1 2 216.284 2.477 20 0 BEADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1ccn(C)n1 ZINC000285441936 385928078 /nfs/dbraw/zinc/92/80/78/385928078.db2.gz IFMANHTZZTXCFR-UHFFFAOYSA-N 1 2 248.330 2.050 20 0 BEADLO CCC[C@@H]1CCC[C@H]1C(=O)NCc1[nH]cc[nH+]1 ZINC000294617530 385875774 /nfs/dbraw/zinc/87/57/74/385875774.db2.gz NJPRFAXWDOXQEF-GHMZBOCLSA-N 1 2 235.331 2.242 20 0 BEADLO CCC[C@H](C)CC(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000647736057 385878802 /nfs/dbraw/zinc/87/88/02/385878802.db2.gz YFYJZHUUTMJKJK-JTQLQIEISA-N 1 2 235.331 2.121 20 0 BEADLO CCC[C@H](C)CC(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000647736057 385878807 /nfs/dbraw/zinc/87/88/07/385878807.db2.gz YFYJZHUUTMJKJK-JTQLQIEISA-N 1 2 235.331 2.121 20 0 BEADLO COc1nccnc1C[N@H+](C)Cc1ccoc1C ZINC000294662711 385879850 /nfs/dbraw/zinc/87/98/50/385879850.db2.gz CCWWOPGFOFSWEA-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1nccnc1C[N@@H+](C)Cc1ccoc1C ZINC000294662711 385879855 /nfs/dbraw/zinc/87/98/55/385879855.db2.gz CCWWOPGFOFSWEA-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO CN(C(=O)CCn1cc[nH+]c1)C1CCCCC1 ZINC000338046511 385881176 /nfs/dbraw/zinc/88/11/76/385881176.db2.gz PWYQHMVHMIYHJI-UHFFFAOYSA-N 1 2 235.331 2.064 20 0 BEADLO CC[N@H+](Cc1coc(C)n1)Cc1ccccn1 ZINC000647966844 385976535 /nfs/dbraw/zinc/97/65/35/385976535.db2.gz JHZHXKIUORPPRH-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1coc(C)n1)Cc1ccccn1 ZINC000647966844 385976543 /nfs/dbraw/zinc/97/65/43/385976543.db2.gz JHZHXKIUORPPRH-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO Cc1cnc(C[NH2+][C@H](C)c2ccncc2F)nc1 ZINC000338367973 385980231 /nfs/dbraw/zinc/98/02/31/385980231.db2.gz LTJDLHUAVRUDJH-SNVBAGLBSA-N 1 2 246.289 2.170 20 0 BEADLO CO[C@@H](C)C[N@H+](C)Cc1csc(C2CC2)n1 ZINC000285508264 385933558 /nfs/dbraw/zinc/93/35/58/385933558.db2.gz DFPBAJHQEAKTPQ-VIFPVBQESA-N 1 2 240.372 2.487 20 0 BEADLO CO[C@@H](C)C[N@@H+](C)Cc1csc(C2CC2)n1 ZINC000285508264 385933561 /nfs/dbraw/zinc/93/35/61/385933561.db2.gz DFPBAJHQEAKTPQ-VIFPVBQESA-N 1 2 240.372 2.487 20 0 BEADLO CCC[C@@H](O)CNc1nc(C)[nH+]c2c1CCCC2 ZINC000272803807 385938306 /nfs/dbraw/zinc/93/83/06/385938306.db2.gz BDFPKMOFYBIGFS-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO CC[N@H+](Cc1nc(CC2CC2)no1)C1CC1 ZINC000342178092 385938810 /nfs/dbraw/zinc/93/88/10/385938810.db2.gz SDULQDMPPZNRKB-UHFFFAOYSA-N 1 2 221.304 2.006 20 0 BEADLO CC[N@@H+](Cc1nc(CC2CC2)no1)C1CC1 ZINC000342178092 385938814 /nfs/dbraw/zinc/93/88/14/385938814.db2.gz SDULQDMPPZNRKB-UHFFFAOYSA-N 1 2 221.304 2.006 20 0 BEADLO Cc1cc(C)c(CNC(=O)[C@H]2[C@@H]3CCC[C@@H]32)c[nH+]1 ZINC000335043865 385939169 /nfs/dbraw/zinc/93/91/69/385939169.db2.gz NSMOYXFTZXMPNF-WDNDVIMCSA-N 1 2 244.338 2.361 20 0 BEADLO CCC[N@H+](CC(F)F)C[C@@H](OC)C1CC1 ZINC000425391686 385943456 /nfs/dbraw/zinc/94/34/56/385943456.db2.gz DYDCRCIZLORCER-SNVBAGLBSA-N 1 2 221.291 2.389 20 0 BEADLO CCC[N@@H+](CC(F)F)C[C@@H](OC)C1CC1 ZINC000425391686 385943462 /nfs/dbraw/zinc/94/34/62/385943462.db2.gz DYDCRCIZLORCER-SNVBAGLBSA-N 1 2 221.291 2.389 20 0 BEADLO Cc1ccnc(N[C@H](c2[nH]cc[nH+]2)C(C)C)n1 ZINC000285594502 385945498 /nfs/dbraw/zinc/94/54/98/385945498.db2.gz LHEBHPVXMXSMHD-JTQLQIEISA-N 1 2 231.303 2.317 20 0 BEADLO CCN(CCOC)c1nc(C)[nH+]c2c1CCCC2 ZINC000272908727 385949874 /nfs/dbraw/zinc/94/98/74/385949874.db2.gz QXHMGZLQPVOQPL-UHFFFAOYSA-N 1 2 249.358 2.137 20 0 BEADLO FC1(F)CC[N@H+](CCCO[C@H]2CCCCO2)C1 ZINC000338293905 385956878 /nfs/dbraw/zinc/95/68/78/385956878.db2.gz CCRHHUASYAGORQ-NSHDSACASA-N 1 2 249.301 2.261 20 0 BEADLO FC1(F)CC[N@@H+](CCCO[C@H]2CCCCO2)C1 ZINC000338293905 385956884 /nfs/dbraw/zinc/95/68/84/385956884.db2.gz CCRHHUASYAGORQ-NSHDSACASA-N 1 2 249.301 2.261 20 0 BEADLO CC(C)n1cc[nH+]c1CN(C)Cc1ccccn1 ZINC000295104238 385965780 /nfs/dbraw/zinc/96/57/80/385965780.db2.gz GUDYMKUKACUMRY-UHFFFAOYSA-N 1 2 244.342 2.491 20 0 BEADLO Cc1oc(C(C)C)cc1C(=O)NCc1[nH]cc[nH+]1 ZINC000285864114 385973086 /nfs/dbraw/zinc/97/30/86/385973086.db2.gz IQHOZMFXROIVLE-UHFFFAOYSA-N 1 2 247.298 2.365 20 0 BEADLO Cc1nocc1CN1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000295227176 385997126 /nfs/dbraw/zinc/99/71/26/385997126.db2.gz CKNQJNUDLCGNRO-GFCCVEGCSA-N 1 2 246.314 2.433 20 0 BEADLO CC[C@H]1CCC[C@H]1CNC(=O)Cc1[nH]c[nH+]c1C ZINC000452992924 385999405 /nfs/dbraw/zinc/99/94/05/385999405.db2.gz CWHJCSZPMNASSP-RYUDHWBXSA-N 1 2 249.358 2.203 20 0 BEADLO CC[C@H]1CCC[C@H]1CNC(=O)Cc1[nH+]c[nH]c1C ZINC000452992924 385999411 /nfs/dbraw/zinc/99/94/11/385999411.db2.gz CWHJCSZPMNASSP-RYUDHWBXSA-N 1 2 249.358 2.203 20 0 BEADLO O=C([C@@H]1C[C@@H]1C1CC1)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000345066216 386001552 /nfs/dbraw/zinc/00/15/52/386001552.db2.gz VRPCSDCFIUMRBD-IJLUTSLNSA-N 1 2 245.326 2.119 20 0 BEADLO COC(=O)C[N@H+](Cc1ccsc1C)C(C)C ZINC000295335754 386013896 /nfs/dbraw/zinc/01/38/96/386013896.db2.gz MERUSHIGDCRNRU-UHFFFAOYSA-N 1 2 241.356 2.440 20 0 BEADLO COC(=O)C[N@@H+](Cc1ccsc1C)C(C)C ZINC000295335754 386013901 /nfs/dbraw/zinc/01/39/01/386013901.db2.gz MERUSHIGDCRNRU-UHFFFAOYSA-N 1 2 241.356 2.440 20 0 BEADLO Cc1noc([C@@H](C)[NH2+]C/C=C/c2ccncc2)n1 ZINC000425997472 386016345 /nfs/dbraw/zinc/01/63/45/386016345.db2.gz BWUXLYBSPJKSDD-HMDXOVGESA-N 1 2 244.298 2.137 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2CC[C@@H](C)[C@H](C)C2)n1 ZINC000414636388 386018688 /nfs/dbraw/zinc/01/86/88/386018688.db2.gz AFTCKDRHBVQZMU-OPRDCNLKSA-N 1 2 223.320 2.329 20 0 BEADLO Cc1cc(NCCC2C[C@@H](C)O[C@H](C)C2)nc[nH+]1 ZINC000338489442 386018873 /nfs/dbraw/zinc/01/88/73/386018873.db2.gz OMDUVXKGPPBBFV-VXGBXAGGSA-N 1 2 249.358 2.213 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1 ZINC000295364255 386019339 /nfs/dbraw/zinc/01/93/39/386019339.db2.gz REEILFGECZOKPC-CKYFFXLPSA-N 1 2 249.358 2.407 20 0 BEADLO CC[C@H]1CCC[C@@H]1C(=O)NCc1[nH]c[nH+]c1C ZINC000295411122 386026430 /nfs/dbraw/zinc/02/64/30/386026430.db2.gz VFWZDAUIMNDDNH-QWRGUYRKSA-N 1 2 235.331 2.161 20 0 BEADLO Cc1nocc1C[NH+]1Cc2ccccc2C1 ZINC000295408986 386026881 /nfs/dbraw/zinc/02/68/81/386026881.db2.gz RKCUYDPALHENRV-UHFFFAOYSA-N 1 2 214.268 2.499 20 0 BEADLO Cc1cc(N2CCC[C@@H]2C(F)F)nc[nH+]1 ZINC000334422510 386027722 /nfs/dbraw/zinc/02/77/22/386027722.db2.gz UOHOXGOLRWYGBF-MRVPVSSYSA-N 1 2 213.231 2.019 20 0 BEADLO C[C@]1(CNc2cc[nH+]c3ccncc23)CCCO1 ZINC000447057808 386031880 /nfs/dbraw/zinc/03/18/80/386031880.db2.gz GKZMPCPFWNZMCN-CQSZACIVSA-N 1 2 243.310 2.033 20 0 BEADLO COC(=O)[C@@H](CCn1cc[nH+]c1)c1ccccc1 ZINC000425429324 386032100 /nfs/dbraw/zinc/03/21/00/386032100.db2.gz YUZXCNVLGZXXPH-ZDUSSCGKSA-N 1 2 244.294 2.230 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@@]12CCC[C@H](C)C2 ZINC000414196453 386035473 /nfs/dbraw/zinc/03/54/73/386035473.db2.gz OWYDLMAUSMLGBO-GWCFXTLKSA-N 1 2 224.348 2.123 20 0 BEADLO Cc1ccc(F)c(CN(C)Cc2[nH+]ccn2C)c1 ZINC000273789842 386035975 /nfs/dbraw/zinc/03/59/75/386035975.db2.gz VAYMLNDYHOFQED-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1ccoc1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000355303094 386044026 /nfs/dbraw/zinc/04/40/26/386044026.db2.gz FUECMEOQKCSVBV-UHFFFAOYSA-N 1 2 241.250 2.488 20 0 BEADLO C[NH2+]Cc1noc(/C(C)=C/C(C)(C)C)n1 ZINC000414645025 386049287 /nfs/dbraw/zinc/04/92/87/386049287.db2.gz PRXOPOAVVXASGI-SOFGYWHQSA-N 1 2 209.293 2.238 20 0 BEADLO CO[C@@H](C)c1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000273932975 386050205 /nfs/dbraw/zinc/05/02/05/386050205.db2.gz MEEXOXBRQQKEKJ-VIFPVBQESA-N 1 2 233.271 2.071 20 0 BEADLO Cc1ccc(Cc2noc([C@]3(C)C[C@@H]3F)n2)c[nH+]1 ZINC000335078655 386050953 /nfs/dbraw/zinc/05/09/53/386050953.db2.gz RILKLVBBSPABKF-GXFFZTMASA-N 1 2 247.273 2.363 20 0 BEADLO CC[N@H+](CCC(C)(C)C(=O)OC)CC(F)F ZINC000338563854 386054197 /nfs/dbraw/zinc/05/41/97/386054197.db2.gz NZRSNAFDFNVNML-UHFFFAOYSA-N 1 2 237.290 2.163 20 0 BEADLO CC[N@@H+](CCC(C)(C)C(=O)OC)CC(F)F ZINC000338563854 386054200 /nfs/dbraw/zinc/05/42/00/386054200.db2.gz NZRSNAFDFNVNML-UHFFFAOYSA-N 1 2 237.290 2.163 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2CCCC3(CC3)C2)no1 ZINC000334434687 386055539 /nfs/dbraw/zinc/05/55/39/386055539.db2.gz YNMYNWVEPGEOBN-VIFPVBQESA-N 1 2 221.304 2.315 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2CCCC3(CC3)C2)no1 ZINC000334434687 386055545 /nfs/dbraw/zinc/05/55/45/386055545.db2.gz YNMYNWVEPGEOBN-VIFPVBQESA-N 1 2 221.304 2.315 20 0 BEADLO CCC[C@H]1CCCCN1C(=O)CCn1cc[nH+]c1 ZINC000273427438 385996830 /nfs/dbraw/zinc/99/68/30/385996830.db2.gz SRKYZQCYHGKJOX-ZDUSSCGKSA-N 1 2 249.358 2.454 20 0 BEADLO CC[C@@H](C)[NH2+][C@@H](c1nnc[nH]1)c1ccc(F)cc1 ZINC000295895225 386100691 /nfs/dbraw/zinc/10/06/91/386100691.db2.gz IKRXCXQGIUHACO-BXKDBHETSA-N 1 2 248.305 2.421 20 0 BEADLO Cc1c[nH+]c(C)nc1N1C[C@@H]2CCC[C@@H]2C1 ZINC000647871516 386105362 /nfs/dbraw/zinc/10/53/62/386105362.db2.gz DUAUEPCGEJVVTB-TXEJJXNPSA-N 1 2 217.316 2.330 20 0 BEADLO Cc1c[nH+]c(C)nc1N1C[C@H]2CCC[C@@H]2C1 ZINC000647871517 386106857 /nfs/dbraw/zinc/10/68/57/386106857.db2.gz DUAUEPCGEJVVTB-VXGBXAGGSA-N 1 2 217.316 2.330 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)[C@@H]1CCCC1(C)C ZINC000274584972 386123763 /nfs/dbraw/zinc/12/37/63/386123763.db2.gz GDWBLYUAIOUZSH-RYUDHWBXSA-N 1 2 249.358 2.214 20 0 BEADLO CCC1(C(=O)N[C@@H]2C[C@H](C)n3cc[nH+]c32)CC1 ZINC000335139310 386115012 /nfs/dbraw/zinc/11/50/12/386115012.db2.gz IILJVWMDJOLVOS-VHSXEESVSA-N 1 2 233.315 2.195 20 0 BEADLO C[C@H]1[N@H+](Cc2cncs2)CCOC1(C)C ZINC000334461375 386117725 /nfs/dbraw/zinc/11/77/25/386117725.db2.gz OUCKIIDYWANBEP-SECBINFHSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@H]1[N@@H+](Cc2cncs2)CCOC1(C)C ZINC000334461375 386117729 /nfs/dbraw/zinc/11/77/29/386117729.db2.gz OUCKIIDYWANBEP-SECBINFHSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@@H]1[N@H+](Cc2cncs2)CCOC1(C)C ZINC000334461376 386117982 /nfs/dbraw/zinc/11/79/82/386117982.db2.gz OUCKIIDYWANBEP-VIFPVBQESA-N 1 2 226.345 2.142 20 0 BEADLO C[C@@H]1[N@@H+](Cc2cncs2)CCOC1(C)C ZINC000334461376 386117990 /nfs/dbraw/zinc/11/79/90/386117990.db2.gz OUCKIIDYWANBEP-VIFPVBQESA-N 1 2 226.345 2.142 20 0 BEADLO FC(F)[C@@H]1CCC[N@@H+]1CCCn1ccnc1 ZINC000353181462 386118978 /nfs/dbraw/zinc/11/89/78/386118978.db2.gz MEEITFTVBRYIIM-JTQLQIEISA-N 1 2 229.274 2.003 20 0 BEADLO FC(F)[C@@H]1CCC[N@H+]1CCCn1ccnc1 ZINC000353181462 386118985 /nfs/dbraw/zinc/11/89/85/386118985.db2.gz MEEITFTVBRYIIM-JTQLQIEISA-N 1 2 229.274 2.003 20 0 BEADLO FC(F)[C@@H]1CCCN1CCCn1cc[nH+]c1 ZINC000353181462 386118991 /nfs/dbraw/zinc/11/89/91/386118991.db2.gz MEEITFTVBRYIIM-JTQLQIEISA-N 1 2 229.274 2.003 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)[C@H]1CCCC1(C)C ZINC000274574089 386121237 /nfs/dbraw/zinc/12/12/37/386121237.db2.gz FJOVHDOXRWRDEY-LLVKDONJSA-N 1 2 249.358 2.205 20 0 BEADLO CC[C@H](OC)c1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000274019935 386062031 /nfs/dbraw/zinc/06/20/31/386062031.db2.gz XESICTUJLBTNKZ-NSHDSACASA-N 1 2 247.298 2.461 20 0 BEADLO C[C@@H](NC(=O)CCc1[nH]cc[nH+]1)C1CCCC1 ZINC000287438766 386121964 /nfs/dbraw/zinc/12/19/64/386121964.db2.gz LSGWZFFZMWGNJG-SNVBAGLBSA-N 1 2 235.331 2.037 20 0 BEADLO Cc1nc(NC[C@@H]2CCCC[C@H]2C)nc(N)[nH+]1 ZINC000310086287 386082241 /nfs/dbraw/zinc/08/22/41/386082241.db2.gz ATZFEFKYGCRKBR-SCZZXKLOSA-N 1 2 235.335 2.000 20 0 BEADLO Cc1nc(N)nc(NC[C@@H]2CCCC[C@H]2C)[nH+]1 ZINC000310086287 386082248 /nfs/dbraw/zinc/08/22/48/386082248.db2.gz ATZFEFKYGCRKBR-SCZZXKLOSA-N 1 2 235.335 2.000 20 0 BEADLO C[C@@H](O)C[N@@H+]1Cc2cccc(Cl)c2C1 ZINC000287425187 386122626 /nfs/dbraw/zinc/12/26/26/386122626.db2.gz PFIFLJVCOYYICN-MRVPVSSYSA-N 1 2 211.692 2.036 20 0 BEADLO C[C@@H](O)C[N@H+]1Cc2cccc(Cl)c2C1 ZINC000287425187 386122634 /nfs/dbraw/zinc/12/26/34/386122634.db2.gz PFIFLJVCOYYICN-MRVPVSSYSA-N 1 2 211.692 2.036 20 0 BEADLO CC(C)C[C@@H](C)C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000274245101 386085659 /nfs/dbraw/zinc/08/56/59/386085659.db2.gz SRLNLWGGNNVZEZ-VXGBXAGGSA-N 1 2 237.347 2.070 20 0 BEADLO C[C@H](C(N)=O)[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000287006960 386088156 /nfs/dbraw/zinc/08/81/56/386088156.db2.gz QKMDGLLGKXIHLP-SCZZXKLOSA-N 1 2 238.356 2.005 20 0 BEADLO C[C@H](C(N)=O)[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000287006960 386088162 /nfs/dbraw/zinc/08/81/62/386088162.db2.gz QKMDGLLGKXIHLP-SCZZXKLOSA-N 1 2 238.356 2.005 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)c1nccc(C(C)(C)C)n1 ZINC000338670241 386091793 /nfs/dbraw/zinc/09/17/93/386091793.db2.gz ACTNBMZYFMYTIY-UHFFFAOYSA-N 1 2 245.330 2.134 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)NCCNc2cccc[nH+]2)C1 ZINC000345307885 386099130 /nfs/dbraw/zinc/09/91/30/386099130.db2.gz FZFSQIKEEABVQW-NEPJUHHUSA-N 1 2 247.342 2.046 20 0 BEADLO CC[C@H]1CCC[C@H](NC(=O)CCc2[nH]cc[nH+]2)C1 ZINC000287770081 386145317 /nfs/dbraw/zinc/14/53/17/386145317.db2.gz UWKSUDNDKPIRQC-RYUDHWBXSA-N 1 2 249.358 2.427 20 0 BEADLO Cc1ccc(CNc2ccc(C)[nH+]c2C)nn1 ZINC000414359289 386146376 /nfs/dbraw/zinc/14/63/76/386146376.db2.gz JRHXVNNYGAKTMX-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO Cc1cc(N2CCC[C@](CO)(C(C)C)C2)nc[nH+]1 ZINC000338810779 386149421 /nfs/dbraw/zinc/14/94/21/386149421.db2.gz QNVCDKLKAUULCX-AWEZNQCLSA-N 1 2 249.358 2.020 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@H](C)OC[C@@H]2CC)cn1 ZINC000414372613 386175700 /nfs/dbraw/zinc/17/57/00/386175700.db2.gz PXTCMZBAWFEZRD-AAEUAGOBSA-N 1 2 249.358 2.038 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@H](C)OC[C@@H]2CC)cn1 ZINC000414372613 386175703 /nfs/dbraw/zinc/17/57/03/386175703.db2.gz PXTCMZBAWFEZRD-AAEUAGOBSA-N 1 2 249.358 2.038 20 0 BEADLO CC(=O)c1cccc(C[N@H+]2C[C@@H](C)OC[C@H]2C)c1 ZINC000296586844 386188019 /nfs/dbraw/zinc/18/80/19/386188019.db2.gz ROBPQYUQZXWMRL-VXGBXAGGSA-N 1 2 247.338 2.498 20 0 BEADLO CC(=O)c1cccc(C[N@@H+]2C[C@@H](C)OC[C@H]2C)c1 ZINC000296586844 386188026 /nfs/dbraw/zinc/18/80/26/386188026.db2.gz ROBPQYUQZXWMRL-VXGBXAGGSA-N 1 2 247.338 2.498 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@H](C)c1cncc(C)c1 ZINC000274606338 386127658 /nfs/dbraw/zinc/12/76/58/386127658.db2.gz MLOMATXEIAIALO-SNVBAGLBSA-N 1 2 230.315 2.272 20 0 BEADLO Cc1nc(N[C@H](C)C2CCCCC2)nc(N)[nH+]1 ZINC000310126535 386129642 /nfs/dbraw/zinc/12/96/42/386129642.db2.gz WXXWLSVTTFHIKB-MRVPVSSYSA-N 1 2 235.335 2.143 20 0 BEADLO Cc1nc(N)nc(N[C@H](C)C2CCCCC2)[nH+]1 ZINC000310126535 386129645 /nfs/dbraw/zinc/12/96/45/386129645.db2.gz WXXWLSVTTFHIKB-MRVPVSSYSA-N 1 2 235.335 2.143 20 0 BEADLO Cc1nc(NCCC2=CCCCC2)nc(N)[nH+]1 ZINC000310133505 386133862 /nfs/dbraw/zinc/13/38/62/386133862.db2.gz ZWUCPGSJWGGERT-UHFFFAOYSA-N 1 2 233.319 2.065 20 0 BEADLO Cc1nc(N)nc(NCCC2=CCCCC2)[nH+]1 ZINC000310133505 386133865 /nfs/dbraw/zinc/13/38/65/386133865.db2.gz ZWUCPGSJWGGERT-UHFFFAOYSA-N 1 2 233.319 2.065 20 0 BEADLO CCO[C@@H](C)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000263887984 386189276 /nfs/dbraw/zinc/18/92/76/386189276.db2.gz YUOLQTNTALUHNO-JTQLQIEISA-N 1 2 247.298 2.006 20 0 BEADLO Cc1cnc(C[N@@H+]2CCO[C@H](C(C)C)C2)s1 ZINC000334464958 386136706 /nfs/dbraw/zinc/13/67/06/386136706.db2.gz CAVQRVJEWJCTJP-NSHDSACASA-N 1 2 240.372 2.308 20 0 BEADLO Cc1cnc(C[N@H+]2CCO[C@H](C(C)C)C2)s1 ZINC000334464958 386136709 /nfs/dbraw/zinc/13/67/09/386136709.db2.gz CAVQRVJEWJCTJP-NSHDSACASA-N 1 2 240.372 2.308 20 0 BEADLO COCc1ccc(C[N@H+](C(C)C)C2COC2)o1 ZINC000296138508 386141719 /nfs/dbraw/zinc/14/17/19/386141719.db2.gz VAPRFEUJRQSADW-UHFFFAOYSA-N 1 2 239.315 2.035 20 0 BEADLO COCc1ccc(C[N@@H+](C(C)C)C2COC2)o1 ZINC000296138508 386141722 /nfs/dbraw/zinc/14/17/22/386141722.db2.gz VAPRFEUJRQSADW-UHFFFAOYSA-N 1 2 239.315 2.035 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@@H](C)O[C@H](CC)C2)cn1 ZINC000414376446 386203529 /nfs/dbraw/zinc/20/35/29/386203529.db2.gz CHYYQMSVFKSPOD-DGCLKSJQSA-N 1 2 249.358 2.038 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@@H](C)O[C@H](CC)C2)cn1 ZINC000414376446 386203531 /nfs/dbraw/zinc/20/35/31/386203531.db2.gz CHYYQMSVFKSPOD-DGCLKSJQSA-N 1 2 249.358 2.038 20 0 BEADLO C[C@H](C1CC1)N(C)C(=O)c1ccc2[nH+]ccn2c1 ZINC000264023605 386204818 /nfs/dbraw/zinc/20/48/18/386204818.db2.gz SETYHFGMBDXTNM-SNVBAGLBSA-N 1 2 243.310 2.205 20 0 BEADLO COCc1ccc(C[N@H+](C)Cc2cc[nH]n2)cc1 ZINC000338992815 386205128 /nfs/dbraw/zinc/20/51/28/386205128.db2.gz PBFXFEXJILFLAH-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO COCc1ccc(C[N@@H+](C)Cc2cc[nH]n2)cc1 ZINC000338992815 386205134 /nfs/dbraw/zinc/20/51/34/386205134.db2.gz PBFXFEXJILFLAH-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO Cc1nc(CNc2cccc[nH+]2)ccc1[C@H](C)O ZINC000275390804 386207967 /nfs/dbraw/zinc/20/79/67/386207967.db2.gz CJGJVPYLPWCJED-NSHDSACASA-N 1 2 243.310 2.450 20 0 BEADLO CN(Cc1[nH+]ccn1C)c1ccccc1F ZINC000264163880 386211506 /nfs/dbraw/zinc/21/15/06/386211506.db2.gz YNGWODSOUMGOCG-UHFFFAOYSA-N 1 2 219.263 2.196 20 0 BEADLO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1cocn1 ZINC000288555640 386215027 /nfs/dbraw/zinc/21/50/27/386215027.db2.gz LXTQSENDIJMBEL-RNCFNFMXSA-N 1 2 230.267 2.286 20 0 BEADLO CC(C)(C)[C@H]1CCCN1C(=O)CCn1cc[nH+]c1 ZINC000264246494 386221290 /nfs/dbraw/zinc/22/12/90/386221290.db2.gz OFGCZYWDFQDGRZ-GFCCVEGCSA-N 1 2 249.358 2.310 20 0 BEADLO C[C@H](C[N@H+](C)Cc1c[nH]nn1)c1ccccc1 ZINC000297034732 386221611 /nfs/dbraw/zinc/22/16/11/386221611.db2.gz HOKJFVCCVHXBCD-LLVKDONJSA-N 1 2 230.315 2.040 20 0 BEADLO C[C@H](C[N@H+](C)Cc1cn[nH]n1)c1ccccc1 ZINC000297034732 386221621 /nfs/dbraw/zinc/22/16/21/386221621.db2.gz HOKJFVCCVHXBCD-LLVKDONJSA-N 1 2 230.315 2.040 20 0 BEADLO C[C@H](C[N@@H+](C)Cc1cn[nH]n1)c1ccccc1 ZINC000297034732 386221626 /nfs/dbraw/zinc/22/16/26/386221626.db2.gz HOKJFVCCVHXBCD-LLVKDONJSA-N 1 2 230.315 2.040 20 0 BEADLO Cc1cnc([C@@H](C)NCc2[nH]cc[nH+]2)s1 ZINC000125187946 386227389 /nfs/dbraw/zinc/22/73/89/386227389.db2.gz LVAUQTJUSSWUHO-MRVPVSSYSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+]Cc2cc[nH]n2)s1 ZINC000125176233 386232194 /nfs/dbraw/zinc/23/21/94/386232194.db2.gz ONXCGEPTKAJWIY-MRVPVSSYSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1[nH+]cccc1Cc1nc(-c2cocn2)no1 ZINC000347112968 386232824 /nfs/dbraw/zinc/23/28/24/386232824.db2.gz MMMRBMHQZPCKMJ-UHFFFAOYSA-N 1 2 242.238 2.019 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ccoc2)nn1 ZINC000414383066 386233364 /nfs/dbraw/zinc/23/33/64/386233364.db2.gz QRRUXQAIYPBELN-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ccoc2)nn1 ZINC000414383066 386233368 /nfs/dbraw/zinc/23/33/68/386233368.db2.gz QRRUXQAIYPBELN-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ccc(C[N@H+](C)CCC(F)(F)F)nn1 ZINC000414384488 386233931 /nfs/dbraw/zinc/23/39/31/386233931.db2.gz UBBSBFVIXRHXJU-UHFFFAOYSA-N 1 2 233.237 2.169 20 0 BEADLO Cc1ccc(C[N@@H+](C)CCC(F)(F)F)nn1 ZINC000414384488 386233934 /nfs/dbraw/zinc/23/39/34/386233934.db2.gz UBBSBFVIXRHXJU-UHFFFAOYSA-N 1 2 233.237 2.169 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)CC1=CCCCC1 ZINC000264403838 386235104 /nfs/dbraw/zinc/23/51/04/386235104.db2.gz GPZKIAANMPWIAQ-GFCCVEGCSA-N 1 2 247.342 2.278 20 0 BEADLO C[C@H](C(=O)Nc1ccn2cc[nH+]c2c1)C1CC1 ZINC000288854660 386236342 /nfs/dbraw/zinc/23/63/42/386236342.db2.gz KQMBHOXSVXCLBA-VIFPVBQESA-N 1 2 229.283 2.319 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CCCc3occc3C2)o1 ZINC000288852410 386236813 /nfs/dbraw/zinc/23/68/13/386236813.db2.gz PHMAEUHQOSVNJF-SECBINFHSA-N 1 2 247.298 2.480 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CCCc3occc3C2)o1 ZINC000288852410 386236816 /nfs/dbraw/zinc/23/68/16/386236816.db2.gz PHMAEUHQOSVNJF-SECBINFHSA-N 1 2 247.298 2.480 20 0 BEADLO COc1nccnc1C[NH+]1CC2(C1)CCCCC2 ZINC000297322128 386242660 /nfs/dbraw/zinc/24/26/60/386242660.db2.gz CSBRHYPZZWZWHT-UHFFFAOYSA-N 1 2 247.342 2.251 20 0 BEADLO CC[C@@H](NC(=O)CC(C)C)c1[nH]cc[nH+]1 ZINC000125324110 386246140 /nfs/dbraw/zinc/24/61/40/386246140.db2.gz CFNKOMDHOWHACO-SECBINFHSA-N 1 2 209.293 2.023 20 0 BEADLO CC[C@@H](NC(=O)c1c[nH+]c(C)[nH]1)[C@@H]1CC1(C)C ZINC000416280769 386257003 /nfs/dbraw/zinc/25/70/03/386257003.db2.gz ZJWOVAVVIKKYIG-VHSXEESVSA-N 1 2 235.331 2.273 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1ccc(F)cn1 ZINC000276198802 386283313 /nfs/dbraw/zinc/28/33/13/386283313.db2.gz DYVSPBPIMLUREQ-MFKMUULPSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1ccc(F)cn1 ZINC000276198802 386283314 /nfs/dbraw/zinc/28/33/14/386283314.db2.gz DYVSPBPIMLUREQ-MFKMUULPSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H](C)CONC(=O)Nc1cc[nH+]cc1C ZINC000297901668 386283421 /nfs/dbraw/zinc/28/34/21/386283421.db2.gz XOIGXRCVYQTYBX-SECBINFHSA-N 1 2 237.303 2.489 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1ccc2occc2c1 ZINC000289336237 386286029 /nfs/dbraw/zinc/28/60/29/386286029.db2.gz LIZHSBLGIDWUFY-UHFFFAOYSA-N 1 2 247.294 2.428 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1ccc2occc2c1 ZINC000289336237 386286032 /nfs/dbraw/zinc/28/60/32/386286032.db2.gz LIZHSBLGIDWUFY-UHFFFAOYSA-N 1 2 247.294 2.428 20 0 BEADLO Cc1nc(C)c(C[NH+]2CC3(CC3(F)F)C2)o1 ZINC000628326448 386290762 /nfs/dbraw/zinc/29/07/62/386290762.db2.gz HMBCNUQTRGGKJC-UHFFFAOYSA-N 1 2 228.242 2.132 20 0 BEADLO c1cn(CCc2nc(C3CCCC3)no2)c[nH+]1 ZINC000264974710 386292376 /nfs/dbraw/zinc/29/23/76/386292376.db2.gz GBYWENHKTRWMCZ-UHFFFAOYSA-N 1 2 232.287 2.166 20 0 BEADLO Cc1ccc(C[N@@H+]2CCn3cccc3[C@@H]2C)nn1 ZINC000335264185 386294441 /nfs/dbraw/zinc/29/44/41/386294441.db2.gz XPUCFJSFCCABII-LBPRGKRZSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1ccc(C[N@H+]2CCn3cccc3[C@@H]2C)nn1 ZINC000335264185 386294445 /nfs/dbraw/zinc/29/44/45/386294445.db2.gz XPUCFJSFCCABII-LBPRGKRZSA-N 1 2 242.326 2.163 20 0 BEADLO C[C@H]1CC(C)(C)CN1C(=O)C(C)(C)c1c[nH+]c[nH]1 ZINC000335263725 386295146 /nfs/dbraw/zinc/29/51/46/386295146.db2.gz GYVXZRWHMNJELR-JTQLQIEISA-N 1 2 249.358 2.334 20 0 BEADLO COC(=O)[C@@H]([NH2+]Cc1cc(C)ccc1C)C1CC1 ZINC000276281034 386295969 /nfs/dbraw/zinc/29/59/69/386295969.db2.gz FHOZSIOKYZUETM-AWEZNQCLSA-N 1 2 247.338 2.345 20 0 BEADLO CCSCC[N@@H+]1CCC[C@H]1C(F)F ZINC000336660594 386301372 /nfs/dbraw/zinc/30/13/72/386301372.db2.gz VAYUZPXDXNBHBK-QMMMGPOBSA-N 1 2 209.305 2.469 20 0 BEADLO CCSCC[N@H+]1CCC[C@H]1C(F)F ZINC000336660594 386301377 /nfs/dbraw/zinc/30/13/77/386301377.db2.gz VAYUZPXDXNBHBK-QMMMGPOBSA-N 1 2 209.305 2.469 20 0 BEADLO CC[C@H](O)CSc1[nH+]cc2ccccn21 ZINC000298149235 386304702 /nfs/dbraw/zinc/30/47/02/386304702.db2.gz BLCDTPGFRDGXKE-JTQLQIEISA-N 1 2 222.313 2.197 20 0 BEADLO Cc1cn[nH]c1C[NH2+][C@H]1c2ccccc2O[C@H]1C ZINC000289441129 386304826 /nfs/dbraw/zinc/30/48/26/386304826.db2.gz ARWZAJXTMFLLHL-IINYFYTJSA-N 1 2 243.310 2.330 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@H]1c2ccccc2O[C@H]1C ZINC000289441129 386304830 /nfs/dbraw/zinc/30/48/30/386304830.db2.gz ARWZAJXTMFLLHL-IINYFYTJSA-N 1 2 243.310 2.330 20 0 BEADLO C[C@@H](CC1CCCC1)C(=O)NCc1[nH+]ccn1C ZINC000265116868 386306670 /nfs/dbraw/zinc/30/66/70/386306670.db2.gz MNOXKSAAYAOBSZ-NSHDSACASA-N 1 2 249.358 2.253 20 0 BEADLO CSCCC[N@H+](C)Cc1noc(C2CC2)n1 ZINC000336669046 386308678 /nfs/dbraw/zinc/30/86/78/386308678.db2.gz VCXNOXUJILWMJQ-UHFFFAOYSA-N 1 2 241.360 2.132 20 0 BEADLO CSCCC[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000336669046 386308690 /nfs/dbraw/zinc/30/86/90/386308690.db2.gz VCXNOXUJILWMJQ-UHFFFAOYSA-N 1 2 241.360 2.132 20 0 BEADLO CC(C)[C@@H](O)CSc1[nH+]cc2ccccn21 ZINC000298210679 386309792 /nfs/dbraw/zinc/30/97/92/386309792.db2.gz GOWKEQMVWOGTGP-NSHDSACASA-N 1 2 236.340 2.443 20 0 BEADLO CCc1ccccc1CC[NH2+][C@]1(C)CCOC1=O ZINC000289485917 386314533 /nfs/dbraw/zinc/31/45/33/386314533.db2.gz IQPBLBQWSKOFHE-OAHLLOKOSA-N 1 2 247.338 2.087 20 0 BEADLO C[C@@H](C[NH2+][C@@]1(C)CCOC1=O)c1ccccc1 ZINC000289502257 386315823 /nfs/dbraw/zinc/31/58/23/386315823.db2.gz JYKBRGXDLCEPKV-FZMZJTMJSA-N 1 2 233.311 2.085 20 0 BEADLO Cc1[nH+]c(C(C)C)ccc1Cn1ccnn1 ZINC000298277138 386317672 /nfs/dbraw/zinc/31/76/72/386317672.db2.gz PNVKYKIYUSCDFN-UHFFFAOYSA-N 1 2 216.288 2.153 20 0 BEADLO C[C@H](C(=O)NCCNc1cccc[nH+]1)C(C)(C)C ZINC000265212553 386319037 /nfs/dbraw/zinc/31/90/37/386319037.db2.gz UXVKCZLSHRNLGB-LLVKDONJSA-N 1 2 249.358 2.292 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)[C@@H](C)C(C)(C)C ZINC000265245730 386322294 /nfs/dbraw/zinc/32/22/94/386322294.db2.gz RFZCMSLYRAEDMK-WDEREUQCSA-N 1 2 237.347 2.070 20 0 BEADLO c1nc(C[N@@H+]2CCC=C(c3ccncc3)C2)co1 ZINC000289524169 386323282 /nfs/dbraw/zinc/32/32/82/386323282.db2.gz HHRGJZIMIVIPHK-UHFFFAOYSA-N 1 2 241.294 2.359 20 0 BEADLO c1nc(C[N@H+]2CCC=C(c3ccncc3)C2)co1 ZINC000289524169 386323285 /nfs/dbraw/zinc/32/32/85/386323285.db2.gz HHRGJZIMIVIPHK-UHFFFAOYSA-N 1 2 241.294 2.359 20 0 BEADLO CC(C)[C@H]1CCCCN1C(=O)CCn1cc[nH+]c1 ZINC000265274302 386323657 /nfs/dbraw/zinc/32/36/57/386323657.db2.gz HTZTUFPBQUAFBU-CYBMUJFWSA-N 1 2 249.358 2.310 20 0 BEADLO Cc1[nH]c(C(=O)NCCCc2ccccc2)c[nH+]1 ZINC000264801858 386271122 /nfs/dbraw/zinc/27/11/22/386271122.db2.gz YVSPGQNFNOWHJT-UHFFFAOYSA-N 1 2 243.310 2.081 20 0 BEADLO CC[C@H]1CCCC[C@@H]1NC(=O)c1c[nH+]c(C)[nH]1 ZINC000264855533 386275385 /nfs/dbraw/zinc/27/53/85/386275385.db2.gz NZPMJQOICSLNBE-QWRGUYRKSA-N 1 2 235.331 2.417 20 0 BEADLO CN(CC1CCCC1)C(=O)CCc1c[nH+]cn1C ZINC000276526968 386341107 /nfs/dbraw/zinc/34/11/07/386341107.db2.gz DGGQVIPZYQRDNU-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO C[C@@H](C1CC1)N(C(=O)C=Cc1c[nH]c[nH+]1)C1CC1 ZINC000276533143 386341588 /nfs/dbraw/zinc/34/15/88/386341588.db2.gz DZCIFEWRTFQWGX-QBBOHKLWSA-N 1 2 245.326 2.212 20 0 BEADLO CC(C)[C@@H](NC(=O)c1ccoc1)c1[nH]cc[nH+]1 ZINC000276537773 386341950 /nfs/dbraw/zinc/34/19/50/386341950.db2.gz DRFGWZWZGLOQLY-SNVBAGLBSA-N 1 2 233.271 2.130 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1nc(C2CC2)cs1 ZINC000339290488 386342868 /nfs/dbraw/zinc/34/28/68/386342868.db2.gz OTUVQISXXAEQNV-SNVBAGLBSA-N 1 2 238.356 2.241 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1nc(C2CC2)cs1 ZINC000339290488 386342873 /nfs/dbraw/zinc/34/28/73/386342873.db2.gz OTUVQISXXAEQNV-SNVBAGLBSA-N 1 2 238.356 2.241 20 0 BEADLO C[C@@H](C1CC1)n1nccc1NCc1c[nH+]cn1C ZINC000237512892 386386321 /nfs/dbraw/zinc/38/63/21/386386321.db2.gz DWDAJJLLQQUTNX-JTQLQIEISA-N 1 2 245.330 2.200 20 0 BEADLO Cn1ncc(C[N@H+](Cc2cccs2)C2CC2)n1 ZINC000289773380 386351928 /nfs/dbraw/zinc/35/19/28/386351928.db2.gz KNBUBSDFEOLZNC-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO Cn1ncc(C[N@@H+](Cc2cccs2)C2CC2)n1 ZINC000289773380 386351934 /nfs/dbraw/zinc/35/19/34/386351934.db2.gz KNBUBSDFEOLZNC-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)[C@@H]1C[C@@H]1C1CC1 ZINC000334492562 386354134 /nfs/dbraw/zinc/35/41/34/386354134.db2.gz ONUKLYDXLCMYDA-GHMZBOCLSA-N 1 2 241.294 2.319 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2cnc(C)cn2)s1 ZINC000336689258 386355648 /nfs/dbraw/zinc/35/56/48/386355648.db2.gz HKJJTACTUNGADV-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2cnc(C)cn2)s1 ZINC000336689258 386355654 /nfs/dbraw/zinc/35/56/54/386355654.db2.gz HKJJTACTUNGADV-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO Cc1cc(C[N@@H+]2CCOCC23CC3)cs1 ZINC000336215694 386358672 /nfs/dbraw/zinc/35/86/72/386358672.db2.gz AVVYNLTYIYELHS-UHFFFAOYSA-N 1 2 223.341 2.421 20 0 BEADLO Cc1cc(C[N@H+]2CCOCC23CC3)cs1 ZINC000336215694 386358678 /nfs/dbraw/zinc/35/86/78/386358678.db2.gz AVVYNLTYIYELHS-UHFFFAOYSA-N 1 2 223.341 2.421 20 0 BEADLO CC[C@@H](C)C(=O)N[C@@H](c1[nH]cc[nH+]1)C(C)C ZINC000276646538 386358895 /nfs/dbraw/zinc/35/88/95/386358895.db2.gz RMTZPLTYBCRJME-NXEZZACHSA-N 1 2 223.320 2.269 20 0 BEADLO CC[C@@H](C)C(=O)N[C@H](c1[nH]cc[nH+]1)C(C)C ZINC000276646549 386360384 /nfs/dbraw/zinc/36/03/84/386360384.db2.gz RMTZPLTYBCRJME-ZJUUUORDSA-N 1 2 223.320 2.269 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1ncccc1N(C)C ZINC000289859829 386365154 /nfs/dbraw/zinc/36/51/54/386365154.db2.gz QGEHYWLBUJTDML-UHFFFAOYSA-N 1 2 245.326 2.339 20 0 BEADLO C[C@H](CNC(=O)C1CCCCC1)Cn1cc[nH+]c1 ZINC000265791743 386369765 /nfs/dbraw/zinc/36/97/65/386369765.db2.gz URZAADPPAPVHHY-GFCCVEGCSA-N 1 2 249.358 2.216 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1ccc(C)c(F)c1 ZINC000276727776 386370351 /nfs/dbraw/zinc/37/03/51/386370351.db2.gz CYAXNAFKDJZLES-JTQLQIEISA-N 1 2 239.290 2.127 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1ccc(C)c(F)c1 ZINC000276727776 386370357 /nfs/dbraw/zinc/37/03/57/386370357.db2.gz CYAXNAFKDJZLES-JTQLQIEISA-N 1 2 239.290 2.127 20 0 BEADLO FC(F)(F)CCNc1cc[nH+]c2ccncc12 ZINC000347374751 386370619 /nfs/dbraw/zinc/37/06/19/386370619.db2.gz APXFJFKJSNNYCC-UHFFFAOYSA-N 1 2 241.216 2.416 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)CC1(C)CCCC1 ZINC000289905339 386372235 /nfs/dbraw/zinc/37/22/35/386372235.db2.gz KVBXDRRQJCKWSC-GFCCVEGCSA-N 1 2 249.358 2.358 20 0 BEADLO CC(C)[C@@H]1C[C@H]1NC(=O)c1ccc2[nH+]ccn2c1 ZINC000334496743 386383560 /nfs/dbraw/zinc/38/35/60/386383560.db2.gz ADUAVLLPPIWOHL-NWDGAFQWSA-N 1 2 243.310 2.109 20 0 BEADLO COC(=O)[C@H]([NH2+]C[C@H]1C[C@@H]1C)c1cccs1 ZINC000336775422 386384092 /nfs/dbraw/zinc/38/40/92/386384092.db2.gz YYZGNEDTNVXLSK-IQJOONFLSA-N 1 2 239.340 2.208 20 0 BEADLO Cc1cc(C)cc(C[NH2+][C@]2(C)CCOC2=O)c1 ZINC000289541355 386326821 /nfs/dbraw/zinc/32/68/21/386326821.db2.gz MNULMAIAPGKQSF-CQSZACIVSA-N 1 2 233.311 2.099 20 0 BEADLO Cc1cc(C)cc(C[NH2+][C@@]2(C)CCOC2=O)c1 ZINC000289541352 386326892 /nfs/dbraw/zinc/32/68/92/386326892.db2.gz MNULMAIAPGKQSF-AWEZNQCLSA-N 1 2 233.311 2.099 20 0 BEADLO Fc1cccc(F)c1CN1CCc2[nH+]c[nH]c2C1 ZINC000647933169 386330200 /nfs/dbraw/zinc/33/02/00/386330200.db2.gz DLJXYPGWFXTOTL-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO CC[C@H](C)[C@H](O)CNc1cc(C)[nH+]c(C2CC2)n1 ZINC000265389748 386332807 /nfs/dbraw/zinc/33/28/07/386332807.db2.gz UCLGFOPIBVQEJU-JOYOIKCWSA-N 1 2 249.358 2.481 20 0 BEADLO COCC[C@H](C)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000265377526 386333545 /nfs/dbraw/zinc/33/35/45/386333545.db2.gz QDAWIKQIELDYHD-VIFPVBQESA-N 1 2 235.331 2.499 20 0 BEADLO CCCCOCC(=O)Nc1cc[nH+]cc1CC ZINC000265428724 386335847 /nfs/dbraw/zinc/33/58/47/386335847.db2.gz QYBRKEKRGXJBMJ-UHFFFAOYSA-N 1 2 236.315 2.399 20 0 BEADLO CC/C=C(\C)C(=O)NCCCNc1cccc[nH+]1 ZINC000265461302 386339068 /nfs/dbraw/zinc/33/90/68/386339068.db2.gz NEANMOAIBOELPP-KPKJPENVSA-N 1 2 247.342 2.356 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CCn2cccc2[C@H]1C ZINC000290438910 386436814 /nfs/dbraw/zinc/43/68/14/386436814.db2.gz NQOWGKQZUZVBCT-LLVKDONJSA-N 1 2 230.315 2.096 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CCn2cccc2[C@H]1C ZINC000290438910 386436818 /nfs/dbraw/zinc/43/68/18/386436818.db2.gz NQOWGKQZUZVBCT-LLVKDONJSA-N 1 2 230.315 2.096 20 0 BEADLO C[C@@H]1SCC[C@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000645402415 386438169 /nfs/dbraw/zinc/43/81/69/386438169.db2.gz RYYLEXIQFPSSEX-WCBMZHEXSA-N 1 2 235.356 2.082 20 0 BEADLO CSC[C@@H]1CCC[N@H+](Cc2csnn2)C1 ZINC000336720755 386452648 /nfs/dbraw/zinc/45/26/48/386452648.db2.gz ZYVWEVWNTBOKPH-SECBINFHSA-N 1 2 243.401 2.113 20 0 BEADLO CSC[C@@H]1CCC[N@@H+](Cc2csnn2)C1 ZINC000336720755 386452655 /nfs/dbraw/zinc/45/26/55/386452655.db2.gz ZYVWEVWNTBOKPH-SECBINFHSA-N 1 2 243.401 2.113 20 0 BEADLO COc1cc([C@@H](C)[NH2+]Cc2ncc(C)o2)ccn1 ZINC000347538225 386444290 /nfs/dbraw/zinc/44/42/90/386444290.db2.gz KWGCXYAZHKHFTG-SNVBAGLBSA-N 1 2 247.298 2.237 20 0 BEADLO CCc1ncc(C[N@@H+]2CCO[C@@](C)(CC)C2)cn1 ZINC000414434840 386446721 /nfs/dbraw/zinc/44/67/21/386446721.db2.gz MOGIDGBBMADIDZ-AWEZNQCLSA-N 1 2 249.358 2.040 20 0 BEADLO CCc1ncc(C[N@H+]2CCO[C@@](C)(CC)C2)cn1 ZINC000414434840 386446729 /nfs/dbraw/zinc/44/67/29/386446729.db2.gz MOGIDGBBMADIDZ-AWEZNQCLSA-N 1 2 249.358 2.040 20 0 BEADLO CCc1ccccc1CC[NH2+]C(C)(C)C(=O)OC ZINC000277569606 386447516 /nfs/dbraw/zinc/44/75/16/386447516.db2.gz BGJGXRZWVJUCOO-UHFFFAOYSA-N 1 2 249.354 2.333 20 0 BEADLO Cn1ncc(C[N@@H+]2CCC[C@@H]2c2cccs2)n1 ZINC000290058186 386389738 /nfs/dbraw/zinc/38/97/38/386389738.db2.gz SGAOJJCDRKGLPQ-LLVKDONJSA-N 1 2 248.355 2.214 20 0 BEADLO Cn1ncc(C[N@H+]2CCC[C@@H]2c2cccs2)n1 ZINC000290058186 386389741 /nfs/dbraw/zinc/38/97/41/386389741.db2.gz SGAOJJCDRKGLPQ-LLVKDONJSA-N 1 2 248.355 2.214 20 0 BEADLO COC(=O)c1ccoc1C[N@@H+]1CC[C@@](C)(F)C1 ZINC000347406627 386390318 /nfs/dbraw/zinc/39/03/18/386390318.db2.gz JZGHPFBFPUOTGV-GFCCVEGCSA-N 1 2 241.262 2.000 20 0 BEADLO COC(=O)c1ccoc1C[N@H+]1CC[C@@](C)(F)C1 ZINC000347406627 386390323 /nfs/dbraw/zinc/39/03/23/386390323.db2.gz JZGHPFBFPUOTGV-GFCCVEGCSA-N 1 2 241.262 2.000 20 0 BEADLO CCN(C(=O)Cc1cn2ccccc2[nH+]1)C(C)C ZINC000298864071 386395284 /nfs/dbraw/zinc/39/52/84/386395284.db2.gz PNWQXFOETIYSIH-UHFFFAOYSA-N 1 2 245.326 2.134 20 0 BEADLO Cc1nc(N(C)Cc2ccco2)cc[nH+]1 ZINC000266116087 386399710 /nfs/dbraw/zinc/39/97/10/386399710.db2.gz LLHFXSVBEYBQGW-UHFFFAOYSA-N 1 2 203.245 2.014 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC1CC(F)(F)C1 ZINC000277064942 386406356 /nfs/dbraw/zinc/40/63/56/386406356.db2.gz KCIZKTXEZULFLL-UHFFFAOYSA-N 1 2 241.241 2.309 20 0 BEADLO CCCCC(=O)Nc1cccc2[nH+]ccn21 ZINC000266166195 386406693 /nfs/dbraw/zinc/40/66/93/386406693.db2.gz QSVXOIHPESOAEV-UHFFFAOYSA-N 1 2 217.272 2.463 20 0 BEADLO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1csnn1 ZINC000290200856 386407605 /nfs/dbraw/zinc/40/76/05/386407605.db2.gz PPCBFLVAZZKXSM-QPUJVOFHSA-N 1 2 247.323 2.150 20 0 BEADLO C[C@@H](Nc1cc[nH+]c(C2CC2)n1)[C@H]1CCOC1 ZINC000266187920 386408812 /nfs/dbraw/zinc/40/88/12/386408812.db2.gz AZWKEXAIPPCJFE-KOLCDFICSA-N 1 2 233.315 2.191 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2ccco2)cn1 ZINC000336708460 386413041 /nfs/dbraw/zinc/41/30/41/386413041.db2.gz UKVUHVBNFGTHBT-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2ccco2)cn1 ZINC000336708460 386413046 /nfs/dbraw/zinc/41/30/46/386413046.db2.gz UKVUHVBNFGTHBT-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CCc2sccc2C1 ZINC000290314846 386418061 /nfs/dbraw/zinc/41/80/61/386418061.db2.gz AXJRNQGMZTZQHV-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CCc2sccc2C1 ZINC000290314846 386418065 /nfs/dbraw/zinc/41/80/65/386418065.db2.gz AXJRNQGMZTZQHV-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCc2sccc2C1 ZINC000290314846 386418071 /nfs/dbraw/zinc/41/80/71/386418071.db2.gz AXJRNQGMZTZQHV-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCc2sccc2C1 ZINC000290314846 386418074 /nfs/dbraw/zinc/41/80/74/386418074.db2.gz AXJRNQGMZTZQHV-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO CC(C)c1nc(C[N@H+](C)[C@H](C)C2CC2)no1 ZINC000097078971 386418102 /nfs/dbraw/zinc/41/81/02/386418102.db2.gz YEFXRYNPHQGFED-SECBINFHSA-N 1 2 223.320 2.423 20 0 BEADLO CC(C)c1nc(C[N@@H+](C)[C@H](C)C2CC2)no1 ZINC000097078971 386418108 /nfs/dbraw/zinc/41/81/08/386418108.db2.gz YEFXRYNPHQGFED-SECBINFHSA-N 1 2 223.320 2.423 20 0 BEADLO Cc1cnc(C[N@@H+](C)[C@H](C)c2cccnc2)nc1 ZINC000336708661 386419327 /nfs/dbraw/zinc/41/93/27/386419327.db2.gz LJAZPOPEYYSCQF-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cnc(C[N@H+](C)[C@H](C)c2cccnc2)nc1 ZINC000336708661 386419331 /nfs/dbraw/zinc/41/93/31/386419331.db2.gz LJAZPOPEYYSCQF-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO O=C(/C=C/C1CC1)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000266292349 386424158 /nfs/dbraw/zinc/42/41/58/386424158.db2.gz OMSPYLCLGHIDNC-SYTKJHMZSA-N 1 2 245.326 2.430 20 0 BEADLO CC(C)[C@@H](C)CC(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000347503243 386425887 /nfs/dbraw/zinc/42/58/87/386425887.db2.gz RUWVPXBSRIFORF-JTQLQIEISA-N 1 2 223.320 2.050 20 0 BEADLO CCOc1nnc(C[N@@H+]2CCC[C@@H]2CC)s1 ZINC000336710631 386426754 /nfs/dbraw/zinc/42/67/54/386426754.db2.gz ZVPOCGZFYNRUCB-VIFPVBQESA-N 1 2 241.360 2.311 20 0 BEADLO CCOc1nnc(C[N@H+]2CCC[C@@H]2CC)s1 ZINC000336710631 386426757 /nfs/dbraw/zinc/42/67/57/386426757.db2.gz ZVPOCGZFYNRUCB-VIFPVBQESA-N 1 2 241.360 2.311 20 0 BEADLO CO[C@H]1COC[C@@H]1Nc1ccc2ccccc2[nH+]1 ZINC000290699338 386468383 /nfs/dbraw/zinc/46/83/83/386468383.db2.gz NHNDXCDWSBUYRK-STQMWFEESA-N 1 2 244.294 2.061 20 0 BEADLO CCC[C@](C)(CC)C(=O)N1CCn2c[nH+]cc2C1 ZINC000290883009 386484411 /nfs/dbraw/zinc/48/44/11/386484411.db2.gz DZPMFNSDBAEIAX-AWEZNQCLSA-N 1 2 249.358 2.442 20 0 BEADLO CCC1(C(=O)N2CCn3c[nH+]cc3C2)CCCC1 ZINC000290931854 386489339 /nfs/dbraw/zinc/48/93/39/386489339.db2.gz MQMYAMPFLWXMIR-UHFFFAOYSA-N 1 2 247.342 2.196 20 0 BEADLO CC(C)C[C@@H](C)CC(=O)N1CCn2c[nH+]cc2C1 ZINC000290939052 386489497 /nfs/dbraw/zinc/48/94/97/386489497.db2.gz ODCGDVOGJRXITO-GFCCVEGCSA-N 1 2 249.358 2.298 20 0 BEADLO C[C@H](C(=O)Nc1cccc2[nH+]ccn21)C1CC1 ZINC000267107055 386497597 /nfs/dbraw/zinc/49/75/97/386497597.db2.gz XPKHDQPUFXVPAX-VIFPVBQESA-N 1 2 229.283 2.319 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@H](C)C2)c(F)c1 ZINC000637883001 386501050 /nfs/dbraw/zinc/50/10/50/386501050.db2.gz LCNLVNUIZPINIZ-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@H](C)C2)c(F)c1 ZINC000637883001 386501057 /nfs/dbraw/zinc/50/10/57/386501057.db2.gz LCNLVNUIZPINIZ-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO O=C(CCC1CCC1)NCCNc1cccc[nH+]1 ZINC000267338943 386529930 /nfs/dbraw/zinc/52/99/30/386529930.db2.gz HRWCSBKWHMUXOO-UHFFFAOYSA-N 1 2 247.342 2.190 20 0 BEADLO CCc1nc(N2CC(C)(C)OC[C@@H]2C)cc(C)[nH+]1 ZINC000343230904 386513991 /nfs/dbraw/zinc/51/39/91/386513991.db2.gz NAXBIYJZFXRZBA-NSHDSACASA-N 1 2 249.358 2.351 20 0 BEADLO CCn1cncc1C[N@@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC000335449227 386517820 /nfs/dbraw/zinc/51/78/20/386517820.db2.gz IRUSXAASIFBFQW-GFCCVEGCSA-N 1 2 249.358 2.046 20 0 BEADLO CCn1cncc1C[N@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC000335449227 386517823 /nfs/dbraw/zinc/51/78/23/386517823.db2.gz IRUSXAASIFBFQW-GFCCVEGCSA-N 1 2 249.358 2.046 20 0 BEADLO CCn1c[nH+]cc1CN1C[C@@H](C)OC2(CCC2)C1 ZINC000335449227 386517826 /nfs/dbraw/zinc/51/78/26/386517826.db2.gz IRUSXAASIFBFQW-GFCCVEGCSA-N 1 2 249.358 2.046 20 0 BEADLO CCn1nccc1C[N@@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC000335450028 386519629 /nfs/dbraw/zinc/51/96/29/386519629.db2.gz SDPBNPBMGXHGGM-GFCCVEGCSA-N 1 2 249.358 2.046 20 0 BEADLO CCn1nccc1C[N@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC000335450028 386519635 /nfs/dbraw/zinc/51/96/35/386519635.db2.gz SDPBNPBMGXHGGM-GFCCVEGCSA-N 1 2 249.358 2.046 20 0 BEADLO COc1c(C)[nH+]c(C2CC2)nc1NCC1(C)CC1 ZINC000519652872 386520248 /nfs/dbraw/zinc/52/02/48/386520248.db2.gz RQDGNNFMETTXTA-UHFFFAOYSA-N 1 2 247.342 2.305 20 0 BEADLO OC[C@@H]1CCN(c2[nH+]ccc3ccc(F)cc32)C1 ZINC000335452113 386524798 /nfs/dbraw/zinc/52/47/98/386524798.db2.gz VKBMHKLBTLEOJC-SNVBAGLBSA-N 1 2 246.285 2.193 20 0 BEADLO Cc1nc(F)ccc1C[N@H+]1C[C@H](C)OC[C@@H]1C ZINC000278442581 386526710 /nfs/dbraw/zinc/52/67/10/386526710.db2.gz LUCHLRPBXWAGTR-UWVGGRQHSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1nc(F)ccc1C[N@@H+]1C[C@H](C)OC[C@@H]1C ZINC000278442581 386526715 /nfs/dbraw/zinc/52/67/15/386526715.db2.gz LUCHLRPBXWAGTR-UWVGGRQHSA-N 1 2 238.306 2.138 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)cn1 ZINC000414437801 386461852 /nfs/dbraw/zinc/46/18/52/386461852.db2.gz QJVZXYZTRBPVPO-TUAOUCFPSA-N 1 2 249.358 2.037 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)cn1 ZINC000414437801 386461856 /nfs/dbraw/zinc/46/18/56/386461856.db2.gz QJVZXYZTRBPVPO-TUAOUCFPSA-N 1 2 249.358 2.037 20 0 BEADLO CC[C@@H](C)C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000299534305 386465370 /nfs/dbraw/zinc/46/53/70/386465370.db2.gz NSHWRNQRZXEWSM-LLVKDONJSA-N 1 2 235.331 2.093 20 0 BEADLO COC[C@@H](C)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000103363796 386576647 /nfs/dbraw/zinc/57/66/47/386576647.db2.gz VXMLHHWBZSRBQJ-SECBINFHSA-N 1 2 236.315 2.228 20 0 BEADLO C[C@H](CNC(=O)C(C)(C)C1CC1)Cn1cc[nH+]c1 ZINC000291737554 386576821 /nfs/dbraw/zinc/57/68/21/386576821.db2.gz CQUXFIUDEKXCOS-LLVKDONJSA-N 1 2 249.358 2.072 20 0 BEADLO C/C=C\C[C@@H]([NH2+]C1CC(C)C1)C(=O)OCC ZINC000336781256 386579713 /nfs/dbraw/zinc/57/97/13/386579713.db2.gz UEVIXANQVTYDQS-HSSXIKCFSA-N 1 2 225.332 2.272 20 0 BEADLO CCOc1ccccc1OCc1c[nH+]cn1C ZINC000267798040 386586683 /nfs/dbraw/zinc/58/66/83/386586683.db2.gz PEYYJCSTVXIFKP-UHFFFAOYSA-N 1 2 232.283 2.398 20 0 BEADLO Cc1c[nH+]cc(CCc2nc(C3CC3)no2)c1 ZINC000291851629 386591044 /nfs/dbraw/zinc/59/10/44/386591044.db2.gz GWJFYPZMEQIRFR-UHFFFAOYSA-N 1 2 229.283 2.436 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C=C1CC[C@@H](C)C1 ZINC000267875647 386595549 /nfs/dbraw/zinc/59/55/49/386595549.db2.gz MHQXWYPKRVYGJA-VKRGWIQLSA-N 1 2 233.315 2.081 20 0 BEADLO COCc1cc(C[N@H+](C)Cc2ccccc2)no1 ZINC000291392298 386538799 /nfs/dbraw/zinc/53/87/99/386538799.db2.gz CPZHGZLQBIVXGB-UHFFFAOYSA-N 1 2 246.310 2.453 20 0 BEADLO COCc1cc(C[N@@H+](C)Cc2ccccc2)no1 ZINC000291392298 386538808 /nfs/dbraw/zinc/53/88/08/386538808.db2.gz CPZHGZLQBIVXGB-UHFFFAOYSA-N 1 2 246.310 2.453 20 0 BEADLO Cc1nnc(C[N@@H+](C)[C@H]2CCc3ccccc32)[nH]1 ZINC000278549425 386545348 /nfs/dbraw/zinc/54/53/48/386545348.db2.gz SZYWZYRXQHVAQQ-ZDUSSCGKSA-N 1 2 242.326 2.232 20 0 BEADLO Cc1nnc(C[N@H+](C)[C@H]2CCc3ccccc32)[nH]1 ZINC000278549425 386545354 /nfs/dbraw/zinc/54/53/54/386545354.db2.gz SZYWZYRXQHVAQQ-ZDUSSCGKSA-N 1 2 242.326 2.232 20 0 BEADLO C[C@@H](O)CCN(C)c1cc(C(F)(F)F)cc[nH+]1 ZINC000135817717 386549204 /nfs/dbraw/zinc/54/92/04/386549204.db2.gz DCZOPKATIHNPCF-MRVPVSSYSA-N 1 2 248.248 2.308 20 0 BEADLO Fc1cc(C[N@@H+]2CCCSCC2)c(F)cn1 ZINC000291490275 386550519 /nfs/dbraw/zinc/55/05/19/386550519.db2.gz SMMIYJCWQMPACL-UHFFFAOYSA-N 1 2 244.310 2.299 20 0 BEADLO Fc1cc(C[N@H+]2CCCSCC2)c(F)cn1 ZINC000291490275 386550525 /nfs/dbraw/zinc/55/05/25/386550525.db2.gz SMMIYJCWQMPACL-UHFFFAOYSA-N 1 2 244.310 2.299 20 0 BEADLO C/C=C/C=C/C(=O)N1CCC[C@H]1Cn1cc[nH+]c1 ZINC000267570248 386554227 /nfs/dbraw/zinc/55/42/27/386554227.db2.gz CSRFWDNZCIPFGV-ADOIESLVSA-N 1 2 245.326 2.006 20 0 BEADLO CCCc1nc(C[N@@H+]2CC[C@H](OC)C2)cs1 ZINC000267627044 386562831 /nfs/dbraw/zinc/56/28/31/386562831.db2.gz FVCQUTLWPQYZNZ-NSHDSACASA-N 1 2 240.372 2.316 20 0 BEADLO CCCc1nc(C[N@H+]2CC[C@H](OC)C2)cs1 ZINC000267627044 386562838 /nfs/dbraw/zinc/56/28/38/386562838.db2.gz FVCQUTLWPQYZNZ-NSHDSACASA-N 1 2 240.372 2.316 20 0 BEADLO F[C@H]1CC[N@H+](Cc2ccnn2-c2ccccc2)C1 ZINC000335405460 386563072 /nfs/dbraw/zinc/56/30/72/386563072.db2.gz ALTGMYNLFKALGX-LBPRGKRZSA-N 1 2 245.301 2.416 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2ccnn2-c2ccccc2)C1 ZINC000335405460 386563079 /nfs/dbraw/zinc/56/30/79/386563079.db2.gz ALTGMYNLFKALGX-LBPRGKRZSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1nnc(C[N@@H+](C)[C@H](C)c2ccccc2)[nH]1 ZINC000267669028 386571917 /nfs/dbraw/zinc/57/19/17/386571917.db2.gz VBCFPKYUEDXOEZ-SNVBAGLBSA-N 1 2 230.315 2.306 20 0 BEADLO Cc1nnc(C[N@H+](C)[C@H](C)c2ccccc2)[nH]1 ZINC000267669028 386571927 /nfs/dbraw/zinc/57/19/27/386571927.db2.gz VBCFPKYUEDXOEZ-SNVBAGLBSA-N 1 2 230.315 2.306 20 0 BEADLO CCN1CC[N@H+](Cc2ccc(C)cc2)[C@H](C)C1=O ZINC000425913058 386573582 /nfs/dbraw/zinc/57/35/82/386573582.db2.gz FODNQXQTPINFCD-CYBMUJFWSA-N 1 2 246.354 2.048 20 0 BEADLO CCN1CC[N@@H+](Cc2ccc(C)cc2)[C@H](C)C1=O ZINC000425913058 386573585 /nfs/dbraw/zinc/57/35/85/386573585.db2.gz FODNQXQTPINFCD-CYBMUJFWSA-N 1 2 246.354 2.048 20 0 BEADLO Cn1c[nH+]cc1C[S@](=O)CC1CCCCC1 ZINC000268118148 386623231 /nfs/dbraw/zinc/62/32/31/386623231.db2.gz AULINIZUDQRPRF-MRXNPFEDSA-N 1 2 240.372 2.249 20 0 BEADLO Cc1ccc([S@@](=O)Cc2c[nH+]cn2C)c(C)c1 ZINC000268141994 386625357 /nfs/dbraw/zinc/62/53/57/386625357.db2.gz CMVVLYUDKUSIDF-KRWDZBQOSA-N 1 2 248.351 2.345 20 0 BEADLO CC(C)n1nccc1C[N@H+](C)Cc1cccn1C ZINC000337146430 386627428 /nfs/dbraw/zinc/62/74/28/386627428.db2.gz FNUKPPCNXDUDHI-UHFFFAOYSA-N 1 2 246.358 2.435 20 0 BEADLO CC(C)n1nccc1C[N@@H+](C)Cc1cccn1C ZINC000337146430 386627436 /nfs/dbraw/zinc/62/74/36/386627436.db2.gz FNUKPPCNXDUDHI-UHFFFAOYSA-N 1 2 246.358 2.435 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N1CCCCCCC1 ZINC000279110130 386634213 /nfs/dbraw/zinc/63/42/13/386634213.db2.gz BWFYTXNJEAKUKA-UHFFFAOYSA-N 1 2 235.331 2.135 20 0 BEADLO Cc1ccc(C[NH2+][C@H]2CCCc3cn[nH]c32)nc1 ZINC000329230860 386641395 /nfs/dbraw/zinc/64/13/95/386641395.db2.gz KFXROUGQRJGKDA-ZDUSSCGKSA-N 1 2 242.326 2.280 20 0 BEADLO Cc1ccc(C[NH2+][C@H]2CCCc3c[nH]nc32)nc1 ZINC000329230860 386641398 /nfs/dbraw/zinc/64/13/98/386641398.db2.gz KFXROUGQRJGKDA-ZDUSSCGKSA-N 1 2 242.326 2.280 20 0 BEADLO C[C@H](CC1CCCCC1)NC(=O)Cn1cc[nH+]c1 ZINC000279197343 386647531 /nfs/dbraw/zinc/64/75/31/386647531.db2.gz LAAYQZKIAJFPKF-GFCCVEGCSA-N 1 2 249.358 2.358 20 0 BEADLO C/C=C(\C)C(=O)N1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000268376194 386648696 /nfs/dbraw/zinc/64/86/96/386648696.db2.gz LRCMNKKPDCZBQR-UDLQBDOPSA-N 1 2 247.342 2.259 20 0 BEADLO CCn1cncc1C[N@H+](C)Cc1ccoc1C ZINC000417749640 386650699 /nfs/dbraw/zinc/65/06/99/386650699.db2.gz FNHLHFKVNFVXQW-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CCn1cncc1C[N@@H+](C)Cc1ccoc1C ZINC000417749640 386650706 /nfs/dbraw/zinc/65/07/06/386650706.db2.gz FNHLHFKVNFVXQW-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO Cc1cc(C[N@H+]2CCS[C@H](C)[C@H]2C)no1 ZINC000246383853 386652760 /nfs/dbraw/zinc/65/27/60/386652760.db2.gz NLSPRJVZVSDVQU-NXEZZACHSA-N 1 2 226.345 2.309 20 0 BEADLO Cc1cc(C[N@@H+]2CCS[C@H](C)[C@H]2C)no1 ZINC000246383853 386652766 /nfs/dbraw/zinc/65/27/66/386652766.db2.gz NLSPRJVZVSDVQU-NXEZZACHSA-N 1 2 226.345 2.309 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)[C@H]1CCCC[C@@H]1C ZINC000279237062 386654107 /nfs/dbraw/zinc/65/41/07/386654107.db2.gz PTBNOEVVXHCEKB-GWCFXTLKSA-N 1 2 249.358 2.298 20 0 BEADLO Cc1ccc(NC(=O)C(=O)C(C)(C)C)c(C)[nH+]1 ZINC000268000613 386607092 /nfs/dbraw/zinc/60/70/92/386607092.db2.gz MOXZCFDMHBSLQO-UHFFFAOYSA-N 1 2 234.299 2.252 20 0 BEADLO COC(C)(C)CC(=O)Nc1ccc(C)[nH+]c1C ZINC000278949945 386609194 /nfs/dbraw/zinc/60/91/94/386609194.db2.gz HCKIXBOWMCTMJL-UHFFFAOYSA-N 1 2 236.315 2.452 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CCC[C@@H]2CCC[C@@H]21 ZINC000278969022 386612615 /nfs/dbraw/zinc/61/26/15/386612615.db2.gz XKEPNUCUFAPWSY-AAEUAGOBSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CCC[C@H]2CCC[C@@H]21 ZINC000278969030 386612960 /nfs/dbraw/zinc/61/29/60/386612960.db2.gz XKEPNUCUFAPWSY-YPMHNXCESA-N 1 2 247.342 2.052 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1nc(C)cs1 ZINC000268047322 386613299 /nfs/dbraw/zinc/61/32/99/386613299.db2.gz SHMDQPKEFOESNS-QWRGUYRKSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1nc(C)cs1 ZINC000268047322 386613302 /nfs/dbraw/zinc/61/33/02/386613302.db2.gz SHMDQPKEFOESNS-QWRGUYRKSA-N 1 2 240.372 2.451 20 0 BEADLO [NH3+]CC(F)(F)CN[C@H]1CCCC[C@H]1C1CC1 ZINC000414923995 386613649 /nfs/dbraw/zinc/61/36/49/386613649.db2.gz FYPLNXIEQBIOIR-QWRGUYRKSA-N 1 2 232.318 2.139 20 0 BEADLO CC[C@]1(C(C)C)C[C@H]1NC(=O)CCn1cc[nH+]c1 ZINC000457279042 386614011 /nfs/dbraw/zinc/61/40/11/386614011.db2.gz LJHLHDDKAOIZIU-TZMCWYRMSA-N 1 2 249.358 2.214 20 0 BEADLO CC(C)(C)c1nc(C[NH+]2CCC3(CC3)CC2)n[nH]1 ZINC000644999042 386661060 /nfs/dbraw/zinc/66/10/60/386661060.db2.gz DDIBFKQMXIKEJH-UHFFFAOYSA-N 1 2 248.374 2.478 20 0 BEADLO CC[C@@H]1CN(Cc2c[nH+]cn2C(C)C)CCO1 ZINC000425329805 386661235 /nfs/dbraw/zinc/66/12/35/386661235.db2.gz UKJFQWYSOZIQLF-CYBMUJFWSA-N 1 2 237.347 2.075 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1CO[C@H](C)C1 ZINC000335527346 386673599 /nfs/dbraw/zinc/67/35/99/386673599.db2.gz IBTNEKXJPGWHIW-MWLCHTKSSA-N 1 2 234.299 2.062 20 0 BEADLO Cc1c[nH]nc1C[NH+]1CC(C)(CC(F)F)C1 ZINC000648058989 386675422 /nfs/dbraw/zinc/67/54/22/386675422.db2.gz OILBWAOVKVIGOO-UHFFFAOYSA-N 1 2 229.274 2.195 20 0 BEADLO Cc1cn[nH]c1C[NH+]1CC(C)(CC(F)F)C1 ZINC000648058989 386675428 /nfs/dbraw/zinc/67/54/28/386675428.db2.gz OILBWAOVKVIGOO-UHFFFAOYSA-N 1 2 229.274 2.195 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1CCCCO1 ZINC000335529889 386678440 /nfs/dbraw/zinc/67/84/40/386678440.db2.gz TWDPMEKJBCSSCZ-NSHDSACASA-N 1 2 234.299 2.206 20 0 BEADLO CC[C@@H](F)C[NH2+][C@@H](C)c1ncc(C)o1 ZINC000336648115 386679507 /nfs/dbraw/zinc/67/95/07/386679507.db2.gz GGTJCSJHNLIUOW-DTWKUNHWSA-N 1 2 200.257 2.382 20 0 BEADLO CCC[C@H](OC)C(=O)Nc1c(C)cc[nH+]c1C ZINC000425577769 386658478 /nfs/dbraw/zinc/65/84/78/386658478.db2.gz AWOGCKGTAPKJQJ-NSHDSACASA-N 1 2 236.315 2.452 20 0 BEADLO COC(=O)C[N@H+](C)[C@@H](C)c1cc(C)ccc1C ZINC000339830691 386685801 /nfs/dbraw/zinc/68/58/01/386685801.db2.gz SZGJBUJZGTWDJW-LBPRGKRZSA-N 1 2 235.327 2.469 20 0 BEADLO COC(=O)C[N@@H+](C)[C@@H](C)c1cc(C)ccc1C ZINC000339830691 386685808 /nfs/dbraw/zinc/68/58/08/386685808.db2.gz SZGJBUJZGTWDJW-LBPRGKRZSA-N 1 2 235.327 2.469 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)[C@@H]1CCC[C@@H](C)C1 ZINC000357018791 386687530 /nfs/dbraw/zinc/68/75/30/386687530.db2.gz MKVRYQLDGOODDY-FRRDWIJNSA-N 1 2 249.358 2.214 20 0 BEADLO COc1ccc(N[C@H](C)[C@@]2(C)CCCO2)[nH+]c1 ZINC000645437408 386693453 /nfs/dbraw/zinc/69/34/53/386693453.db2.gz CBECRJHOGDLEFW-ZWNOBZJWSA-N 1 2 236.315 2.460 20 0 BEADLO FC(F)C1(NCc2cn3ccccc3[nH+]2)CC1 ZINC000337277352 386697933 /nfs/dbraw/zinc/69/79/33/386697933.db2.gz FNRAHDHRLYVOBG-UHFFFAOYSA-N 1 2 237.253 2.222 20 0 BEADLO C[C@H](CO)C[N@@H+]1CCn2c(cc3ccccc32)C1 ZINC000643414822 386697877 /nfs/dbraw/zinc/69/78/77/386697877.db2.gz OSYDWIHCIGXIOR-LBPRGKRZSA-N 1 2 244.338 2.085 20 0 BEADLO C[C@H](CO)C[N@H+]1CCn2c(cc3ccccc32)C1 ZINC000643414822 386697883 /nfs/dbraw/zinc/69/78/83/386697883.db2.gz OSYDWIHCIGXIOR-LBPRGKRZSA-N 1 2 244.338 2.085 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1csc(C)n1 ZINC000268814617 386698552 /nfs/dbraw/zinc/69/85/52/386698552.db2.gz HEWOZQBXETWWRZ-SKDRFNHKSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1csc(C)n1 ZINC000268814617 386698556 /nfs/dbraw/zinc/69/85/56/386698556.db2.gz HEWOZQBXETWWRZ-SKDRFNHKSA-N 1 2 240.372 2.451 20 0 BEADLO C[C@@H](CO)C[N@@H+]1CCn2c(cc3ccccc32)C1 ZINC000643414821 386698885 /nfs/dbraw/zinc/69/88/85/386698885.db2.gz OSYDWIHCIGXIOR-GFCCVEGCSA-N 1 2 244.338 2.085 20 0 BEADLO C[C@@H](CO)C[N@H+]1CCn2c(cc3ccccc32)C1 ZINC000643414821 386698889 /nfs/dbraw/zinc/69/88/89/386698889.db2.gz OSYDWIHCIGXIOR-GFCCVEGCSA-N 1 2 244.338 2.085 20 0 BEADLO C1=CCC(Nc2cc(N3CCCC3)nc[nH+]2)C1 ZINC000302920443 386733692 /nfs/dbraw/zinc/73/36/92/386733692.db2.gz ZGHOFSUEHGWRCY-UHFFFAOYSA-N 1 2 230.315 2.207 20 0 BEADLO C1=CCC(Nc2cc(N3CCCC3)[nH+]cn2)C1 ZINC000302920443 386733698 /nfs/dbraw/zinc/73/36/98/386733698.db2.gz ZGHOFSUEHGWRCY-UHFFFAOYSA-N 1 2 230.315 2.207 20 0 BEADLO CCc1ccc([C@H](C)[NH2+][C@@H](C)c2nncn2C)o1 ZINC000268930052 386719141 /nfs/dbraw/zinc/71/91/41/386719141.db2.gz SLDRCJUKAKNPAR-UWVGGRQHSA-N 1 2 248.330 2.382 20 0 BEADLO C[C@H]1CCCC[N@@H+]1Cc1nn(C)cc1Cl ZINC000335542468 386724648 /nfs/dbraw/zinc/72/46/48/386724648.db2.gz DSHHDMZWIVHLBG-VIFPVBQESA-N 1 2 227.739 2.448 20 0 BEADLO C[C@H]1CCCC[N@H+]1Cc1nn(C)cc1Cl ZINC000335542468 386724657 /nfs/dbraw/zinc/72/46/57/386724657.db2.gz DSHHDMZWIVHLBG-VIFPVBQESA-N 1 2 227.739 2.448 20 0 BEADLO CCN1CC[N@H+](C/C=C(\C)Cl)C(C)(C)C1=O ZINC000528463045 386740449 /nfs/dbraw/zinc/74/04/49/386740449.db2.gz FIRPKAAZKTVFKI-UXBLZVDNSA-N 1 2 244.766 2.072 20 0 BEADLO CCN1CC[N@@H+](C/C=C(\C)Cl)C(C)(C)C1=O ZINC000528463045 386740454 /nfs/dbraw/zinc/74/04/54/386740454.db2.gz FIRPKAAZKTVFKI-UXBLZVDNSA-N 1 2 244.766 2.072 20 0 BEADLO CC[C@H]([NH2+][C@H]1C[C@H]1Cc1ccccc1)C(=O)OC ZINC000279739347 386729864 /nfs/dbraw/zinc/72/98/64/386729864.db2.gz KKUJVVKFINNWOC-RDBSUJKOSA-N 1 2 247.338 2.159 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@@H]2C[C@H]2c2ccccc2)no1 ZINC000268978629 386730091 /nfs/dbraw/zinc/73/00/91/386730091.db2.gz QAEFURQJQKTFLM-QWHCGFSZSA-N 1 2 243.310 2.366 20 0 BEADLO Cc1nc(C[N@H+](C)[C@@H]2C[C@H]2c2ccccc2)no1 ZINC000268978629 386730097 /nfs/dbraw/zinc/73/00/97/386730097.db2.gz QAEFURQJQKTFLM-QWHCGFSZSA-N 1 2 243.310 2.366 20 0 BEADLO COC(=O)[C@H](C)[NH2+]C[C@@H](C)Cc1ccccc1 ZINC000279873393 386749055 /nfs/dbraw/zinc/74/90/55/386749055.db2.gz JTGKLOBVCAOXSS-RYUDHWBXSA-N 1 2 235.327 2.016 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2CC[C@@H](C)C2)cc[nH+]1 ZINC000408441659 386749668 /nfs/dbraw/zinc/74/96/68/386749668.db2.gz FWNICKSIPKKKFD-MWLCHTKSSA-N 1 2 233.315 2.122 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@H](C)C3(CCC3)C2)no1 ZINC000334150349 386749968 /nfs/dbraw/zinc/74/99/68/386749968.db2.gz IVYCTKMNMBBWQS-JTQLQIEISA-N 1 2 235.331 2.390 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@H](C)C3(CCC3)C2)no1 ZINC000334150349 386749974 /nfs/dbraw/zinc/74/99/74/386749974.db2.gz IVYCTKMNMBBWQS-JTQLQIEISA-N 1 2 235.331 2.390 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nc(-c3ccco3)no2)[C@H]1C ZINC000292926735 386751651 /nfs/dbraw/zinc/75/16/51/386751651.db2.gz GRABDIMWKJIZPN-BDAKNGLRSA-N 1 2 233.271 2.170 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nc(-c3ccco3)no2)[C@H]1C ZINC000292926735 386751657 /nfs/dbraw/zinc/75/16/57/386751657.db2.gz GRABDIMWKJIZPN-BDAKNGLRSA-N 1 2 233.271 2.170 20 0 BEADLO CC(F)(F)C(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000292964036 386758856 /nfs/dbraw/zinc/75/88/56/386758856.db2.gz JRRSQADEPJWREO-MRVPVSSYSA-N 1 2 243.257 2.119 20 0 BEADLO Cc1csc(C[N@@H+]2CCC[C@H]2CF)n1 ZINC000292998678 386762198 /nfs/dbraw/zinc/76/21/98/386762198.db2.gz IWFYBGGUCYEABJ-VIFPVBQESA-N 1 2 214.309 2.385 20 0 BEADLO Cc1csc(C[N@H+]2CCC[C@H]2CF)n1 ZINC000292998678 386762204 /nfs/dbraw/zinc/76/22/04/386762204.db2.gz IWFYBGGUCYEABJ-VIFPVBQESA-N 1 2 214.309 2.385 20 0 BEADLO CC(C)c1occc1C(=O)NCCn1cc[nH+]c1 ZINC000280011153 386768837 /nfs/dbraw/zinc/76/88/37/386768837.db2.gz ISTYFZKUQJFIBS-UHFFFAOYSA-N 1 2 247.298 2.030 20 0 BEADLO CO[C@]1(C)CCCN(c2cc[nH+]c(C)n2)CC1 ZINC000280231685 386790028 /nfs/dbraw/zinc/79/00/28/386790028.db2.gz LTCQCDJJYIFNTL-CYBMUJFWSA-N 1 2 235.331 2.180 20 0 BEADLO FC(F)(F)C[C@H]1CC[N@H+](Cc2cnc[nH]2)C1 ZINC000280210085 386790774 /nfs/dbraw/zinc/79/07/74/386790774.db2.gz JXLRHVACZYEGMR-MRVPVSSYSA-N 1 2 233.237 2.184 20 0 BEADLO FC(F)(F)C[C@H]1CC[N@@H+](Cc2cnc[nH]2)C1 ZINC000280210085 386790778 /nfs/dbraw/zinc/79/07/78/386790778.db2.gz JXLRHVACZYEGMR-MRVPVSSYSA-N 1 2 233.237 2.184 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N1CCCC2(CCC2)C1 ZINC000357483421 386791586 /nfs/dbraw/zinc/79/15/86/386791586.db2.gz URKOUKWVBUAXEH-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO CC[C@H]1C[C@H](C[NH2+]CC(F)(F)F)CCO1 ZINC000336744065 386795202 /nfs/dbraw/zinc/79/52/02/386795202.db2.gz YVTXFYKADOTOJM-BDAKNGLRSA-N 1 2 225.254 2.344 20 0 BEADLO C[C@@H](CCc1ccsc1)[NH2+]CC(F)(F)CN ZINC000414932079 386772751 /nfs/dbraw/zinc/77/27/51/386772751.db2.gz RCACJKGJFLAPLR-VIFPVBQESA-N 1 2 248.342 2.253 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@@H]2CF)s1 ZINC000293090454 386776509 /nfs/dbraw/zinc/77/65/09/386776509.db2.gz PMMDEQVCJRSGLR-SECBINFHSA-N 1 2 214.309 2.385 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@@H]2CF)s1 ZINC000293090454 386776512 /nfs/dbraw/zinc/77/65/12/386776512.db2.gz PMMDEQVCJRSGLR-SECBINFHSA-N 1 2 214.309 2.385 20 0 BEADLO FC[C@@H]1CCC[N@@H+]1Cc1ccc(F)cn1 ZINC000293086194 386776704 /nfs/dbraw/zinc/77/67/04/386776704.db2.gz PDEARGKDYZCRRE-NSHDSACASA-N 1 2 212.243 2.155 20 0 BEADLO FC[C@@H]1CCC[N@H+]1Cc1ccc(F)cn1 ZINC000293086194 386776707 /nfs/dbraw/zinc/77/67/07/386776707.db2.gz PDEARGKDYZCRRE-NSHDSACASA-N 1 2 212.243 2.155 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C[C@H]1CCC(=O)[C@@H]1C ZINC000280104797 386778230 /nfs/dbraw/zinc/77/82/30/386778230.db2.gz CGUBLMPTIJBZDF-GHMZBOCLSA-N 1 2 246.310 2.334 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@H]2CCC(C)(C)C2)no1 ZINC000334639633 386781291 /nfs/dbraw/zinc/78/12/91/386781291.db2.gz ZHJSUVXDTMALAI-JTQLQIEISA-N 1 2 223.320 2.389 20 0 BEADLO Cc1nc(C[N@H+](C)[C@H]2CCC(C)(C)C2)no1 ZINC000334639633 386781295 /nfs/dbraw/zinc/78/12/95/386781295.db2.gz ZHJSUVXDTMALAI-JTQLQIEISA-N 1 2 223.320 2.389 20 0 BEADLO Cc1cc(C)cc(C[N@H+](C)Cc2cnn[nH]2)c1 ZINC000450865494 386787172 /nfs/dbraw/zinc/78/71/72/386787172.db2.gz WPIZFYCVNDMNIA-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1cc(C)cc(C[N@@H+](C)Cc2cnn[nH]2)c1 ZINC000450865494 386787177 /nfs/dbraw/zinc/78/71/77/386787177.db2.gz WPIZFYCVNDMNIA-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1cc(C)cc(C[N@H+](C)Cc2c[nH]nn2)c1 ZINC000450865494 386787180 /nfs/dbraw/zinc/78/71/80/386787180.db2.gz WPIZFYCVNDMNIA-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1cc(C)cc(C[N@@H+](C)Cc2c[nH]nn2)c1 ZINC000450865494 386787184 /nfs/dbraw/zinc/78/71/84/386787184.db2.gz WPIZFYCVNDMNIA-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1nocc1CNc1ccc(N(C)C)[nH+]c1 ZINC000293433050 386816517 /nfs/dbraw/zinc/81/65/17/386816517.db2.gz BIBGXVAMOLYPGB-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO c1c[nH+]c([C@@H]2CCCN2Cc2cncs2)[nH]1 ZINC000334769958 386820357 /nfs/dbraw/zinc/82/03/57/386820357.db2.gz BWJNUCZVDLSDRL-JTQLQIEISA-N 1 2 234.328 2.203 20 0 BEADLO FC(F)c1ccnc(CNc2cccc[nH+]2)n1 ZINC000340982975 386821739 /nfs/dbraw/zinc/82/17/39/386821739.db2.gz BVKQMSDFOHAZKF-UHFFFAOYSA-N 1 2 236.225 2.421 20 0 BEADLO Cc1noc(C)c1C[NH2+]Cc1ccc(F)cn1 ZINC000344908788 386798791 /nfs/dbraw/zinc/79/87/91/386798791.db2.gz SCPRREHTZSEGFF-UHFFFAOYSA-N 1 2 235.262 2.115 20 0 BEADLO Cn1c[nH+]cc1Cc1noc(C2CCCC2)n1 ZINC000329744059 386801010 /nfs/dbraw/zinc/80/10/10/386801010.db2.gz XPGSQVXWCJIYLH-UHFFFAOYSA-N 1 2 232.287 2.052 20 0 BEADLO c1cc2c(s1)C[N@H+](Cc1c[nH]cn1)CC2 ZINC000280320953 386804624 /nfs/dbraw/zinc/80/46/24/386804624.db2.gz YFESWUMUUNCQJD-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO c1cc2c(s1)C[N@@H+](Cc1c[nH]cn1)CC2 ZINC000280320953 386804629 /nfs/dbraw/zinc/80/46/29/386804629.db2.gz YFESWUMUUNCQJD-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO c1cc2c(s1)C[N@H+](Cc1cnc[nH]1)CC2 ZINC000280320953 386804634 /nfs/dbraw/zinc/80/46/34/386804634.db2.gz YFESWUMUUNCQJD-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO c1cc2c(s1)C[N@@H+](Cc1cnc[nH]1)CC2 ZINC000280320953 386804637 /nfs/dbraw/zinc/80/46/37/386804637.db2.gz YFESWUMUUNCQJD-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO CO[C@@H]1CCC[C@H]1CNc1cc[nH+]c(C(C)C)n1 ZINC000340953002 386805645 /nfs/dbraw/zinc/80/56/45/386805645.db2.gz QACXONZDISOOKO-NWDGAFQWSA-N 1 2 249.358 2.249 20 0 BEADLO Cc1nc(C(C)(C)[NH2+]CCOC(C)(C)C)no1 ZINC000330645601 386810539 /nfs/dbraw/zinc/81/05/39/386810539.db2.gz YVLIXUVSVSRANI-UHFFFAOYSA-N 1 2 241.335 2.018 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@H]1[C@@H]2CCC[C@@H]21 ZINC000456341579 386813248 /nfs/dbraw/zinc/81/32/48/386813248.db2.gz DERAKMWAXUEFMA-NNYUYHANSA-N 1 2 247.342 2.126 20 0 BEADLO CC(C)[C@H]1CCCC[C@@H]1[NH2+]Cc1c[nH]nn1 ZINC000398367670 386815600 /nfs/dbraw/zinc/81/56/00/386815600.db2.gz BVBKXFBKLQYUPJ-NEPJUHHUSA-N 1 2 222.336 2.109 20 0 BEADLO CC(C)[C@H]1CCCC[C@@H]1[NH2+]Cc1cn[nH]n1 ZINC000398367670 386815604 /nfs/dbraw/zinc/81/56/04/386815604.db2.gz BVBKXFBKLQYUPJ-NEPJUHHUSA-N 1 2 222.336 2.109 20 0 BEADLO CCC[C@H]([NH2+][C@H]1CSC[C@H]1C)C(=O)OCC ZINC000336672957 386832515 /nfs/dbraw/zinc/83/25/15/386832515.db2.gz AXCZHLFQYPAXRL-VWYCJHECSA-N 1 2 245.388 2.059 20 0 BEADLO CC[C@@H](C[NH2+]CC(F)(F)CN)c1ccccc1 ZINC000414936445 386833501 /nfs/dbraw/zinc/83/35/01/386833501.db2.gz VXLNGKRSWQBMJP-NSHDSACASA-N 1 2 242.313 2.364 20 0 BEADLO Cc1c[nH+]c(CNCc2ccc(F)cc2)n1C ZINC000341083617 386835419 /nfs/dbraw/zinc/83/54/19/386835419.db2.gz XTHHDEHQTOCIPQ-UHFFFAOYSA-N 1 2 233.290 2.157 20 0 BEADLO C[N@H+](CCF)Cc1ccc(N2CCCC2)nc1 ZINC000293556640 386837849 /nfs/dbraw/zinc/83/78/49/386837849.db2.gz FPIKASZABXZPFM-UHFFFAOYSA-N 1 2 237.322 2.083 20 0 BEADLO C[N@@H+](CCF)Cc1ccc(N2CCCC2)nc1 ZINC000293556640 386837853 /nfs/dbraw/zinc/83/78/53/386837853.db2.gz FPIKASZABXZPFM-UHFFFAOYSA-N 1 2 237.322 2.083 20 0 BEADLO Cc1ccc(N[C@@H](C)C(C)(C)n2cncn2)c[nH+]1 ZINC000280703346 386838475 /nfs/dbraw/zinc/83/84/75/386838475.db2.gz ATPHNHYMBIKUTA-NSHDSACASA-N 1 2 245.330 2.217 20 0 BEADLO Cc1cc(N(C)C[C@H]2CCOC2)nc(C(C)C)[nH+]1 ZINC000301519179 386850506 /nfs/dbraw/zinc/85/05/06/386850506.db2.gz HGJZOSNTSQHCET-GFCCVEGCSA-N 1 2 249.358 2.381 20 0 BEADLO CC(C)n1ccc(C[N@@H+]2C[C@@H]3C[C@H]2CS3)n1 ZINC000334788439 386852200 /nfs/dbraw/zinc/85/22/00/386852200.db2.gz WVZDYKUJOQOMCE-RYUDHWBXSA-N 1 2 237.372 2.154 20 0 BEADLO CC(C)n1ccc(C[N@H+]2C[C@@H]3C[C@H]2CS3)n1 ZINC000334788439 386852202 /nfs/dbraw/zinc/85/22/02/386852202.db2.gz WVZDYKUJOQOMCE-RYUDHWBXSA-N 1 2 237.372 2.154 20 0 BEADLO Cn1cnnc1C[N@H+](C)[C@H]1C=CCCCCC1 ZINC000293649142 386854111 /nfs/dbraw/zinc/85/41/11/386854111.db2.gz SFTPCLBMWBPNJW-LBPRGKRZSA-N 1 2 234.347 2.136 20 0 BEADLO Cn1cnnc1C[N@@H+](C)[C@H]1C=CCCCCC1 ZINC000293649142 386854115 /nfs/dbraw/zinc/85/41/15/386854115.db2.gz SFTPCLBMWBPNJW-LBPRGKRZSA-N 1 2 234.347 2.136 20 0 BEADLO COC[C@H](C)Nc1nc(C)[nH+]c2c1CCCC2 ZINC000301553357 386854587 /nfs/dbraw/zinc/85/45/87/386854587.db2.gz HVTGNLACKQRSPU-VIFPVBQESA-N 1 2 235.331 2.111 20 0 BEADLO Fc1ccc([C@@H]([NH2+]CC2CC2)c2nnc[nH]2)cc1 ZINC000293646406 386855066 /nfs/dbraw/zinc/85/50/66/386855066.db2.gz IJNDAFJKPIWPQG-GFCCVEGCSA-N 1 2 246.289 2.033 20 0 BEADLO CC[C@](C)([NH2+]CCSC(C)C)C(=O)OC ZINC000336744427 386855241 /nfs/dbraw/zinc/85/52/41/386855241.db2.gz ZJHQRMHQEIHHQF-NSHDSACASA-N 1 2 233.377 2.059 20 0 BEADLO COC(=O)[C@H](CC(C)C)[NH2+][C@@H]1CC[C@H]1SC ZINC000425343499 386855436 /nfs/dbraw/zinc/85/54/36/386855436.db2.gz RSXFETVJYMUQBI-OUAUKWLOSA-N 1 2 245.388 2.058 20 0 BEADLO Fc1cccc2c1C[N@H+](C[C@H]1CCCO1)C2 ZINC000334791181 386855843 /nfs/dbraw/zinc/85/58/43/386855843.db2.gz XCYVYLYLXBYVPK-LLVKDONJSA-N 1 2 221.275 2.320 20 0 BEADLO Fc1cccc2c1C[N@@H+](C[C@H]1CCCO1)C2 ZINC000334791181 386855845 /nfs/dbraw/zinc/85/58/45/386855845.db2.gz XCYVYLYLXBYVPK-LLVKDONJSA-N 1 2 221.275 2.320 20 0 BEADLO CS[C@@H]1CC[C@@H]1[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000425344810 386856121 /nfs/dbraw/zinc/85/61/21/386856121.db2.gz UDKXHUNQBHEXND-LPEHRKFASA-N 1 2 245.388 2.200 20 0 BEADLO CC(C)(C)c1nc(N[C@@H](CCO)C2CC2)cc[nH+]1 ZINC000301589588 386859164 /nfs/dbraw/zinc/85/91/64/386859164.db2.gz QCDZFALVFYYHLM-NSHDSACASA-N 1 2 249.358 2.347 20 0 BEADLO Cc1n[nH]cc1C[N@H+]1Cc2cccc(F)c2C1 ZINC000334793069 386860978 /nfs/dbraw/zinc/86/09/78/386860978.db2.gz SZFJLZDRQHSLEB-UHFFFAOYSA-N 1 2 231.274 2.373 20 0 BEADLO CN(CCC(C)(C)C)c1[nH+]cnc2c1cnn2C ZINC000645342362 386864529 /nfs/dbraw/zinc/86/45/29/386864529.db2.gz SUEIBJNYNXIYHF-UHFFFAOYSA-N 1 2 247.346 2.236 20 0 BEADLO CC(C)[C@H](C)Cc1nc(Cc2c[nH+]cn2C)no1 ZINC000357930116 386866954 /nfs/dbraw/zinc/86/69/54/386866954.db2.gz DZFRMQFWKASANS-SNVBAGLBSA-N 1 2 248.330 2.229 20 0 BEADLO Cn1c[nH+]cc1Cc1noc(-c2ccsc2)n1 ZINC000357935185 386868974 /nfs/dbraw/zinc/86/89/74/386868974.db2.gz MBCQXMBRQXPDJY-UHFFFAOYSA-N 1 2 246.295 2.122 20 0 BEADLO C[C@@H]([NH2+][C@H](c1cccs1)c1nnc[nH]1)C1CC1 ZINC000293757929 386874050 /nfs/dbraw/zinc/87/40/50/386874050.db2.gz ORBLWTQQFLWSMG-LDYMZIIASA-N 1 2 248.355 2.344 20 0 BEADLO CC[C@@H](Cc1ccccc1)[NH2+]CC(F)(F)CN ZINC000414940373 386879509 /nfs/dbraw/zinc/87/95/09/386879509.db2.gz ZUULPMCRPLDCCG-LBPRGKRZSA-N 1 2 242.313 2.191 20 0 BEADLO C[C@@H]1c2ccccc2C[N@H+]1C[C@@H](O)C(F)(F)F ZINC000334839408 386882208 /nfs/dbraw/zinc/88/22/08/386882208.db2.gz YRKOTNBWQVEKDM-LDYMZIIASA-N 1 2 245.244 2.486 20 0 BEADLO C[C@@H]1c2ccccc2C[N@@H+]1C[C@@H](O)C(F)(F)F ZINC000334839408 386882212 /nfs/dbraw/zinc/88/22/12/386882212.db2.gz YRKOTNBWQVEKDM-LDYMZIIASA-N 1 2 245.244 2.486 20 0 BEADLO CSC[C@H](C)Nc1nc(N)c2ccccc2[nH+]1 ZINC000301853721 386885032 /nfs/dbraw/zinc/88/50/32/386885032.db2.gz AIWFNNSEAKNWCU-QMMMGPOBSA-N 1 2 248.355 2.375 20 0 BEADLO C[C@@]1(CO)CCCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000301895617 386889126 /nfs/dbraw/zinc/88/91/26/386889126.db2.gz UDVKGLPXWASPKU-CQSZACIVSA-N 1 2 245.326 2.162 20 0 BEADLO Cc1occc1C[N@H+]1CCC[C@@H]1c1nncn1C ZINC000334859585 386913521 /nfs/dbraw/zinc/91/35/21/386913521.db2.gz KFCCKGQTTZSLBF-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1occc1C[N@@H+]1CCC[C@@H]1c1nncn1C ZINC000334859585 386913524 /nfs/dbraw/zinc/91/35/24/386913524.db2.gz KFCCKGQTTZSLBF-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO CC[C@@H](CC(=O)Nc1cc[nH+]cc1O)C(C)C ZINC000330782482 386900753 /nfs/dbraw/zinc/90/07/53/386900753.db2.gz HDEIOHPISMTNLG-JTQLQIEISA-N 1 2 236.315 2.220 20 0 BEADLO CC1CCN(C(=O)[C@@H]2CCCc3[nH+]c[nH]c32)CC1 ZINC000334851004 386900734 /nfs/dbraw/zinc/90/07/34/386900734.db2.gz ILAJGUAIZNESID-LLVKDONJSA-N 1 2 247.342 2.088 20 0 BEADLO CCOc1ncccc1NCc1[nH+]cc(C)n1C ZINC000341393761 386902406 /nfs/dbraw/zinc/90/24/06/386902406.db2.gz NABDNFIFCCYWDE-UHFFFAOYSA-N 1 2 246.314 2.134 20 0 BEADLO Cc1cccn2cc(C[S@](=O)C3CCC3)[nH+]c12 ZINC000334855588 386906577 /nfs/dbraw/zinc/90/65/77/386906577.db2.gz JCYBQIJMHRMMCF-KRWDZBQOSA-N 1 2 248.351 2.444 20 0 BEADLO Cc1cccc2[nH+]c(C[S@@](=O)C3CCC3)cn21 ZINC000334855568 386907175 /nfs/dbraw/zinc/90/71/75/386907175.db2.gz IOBPUOSVSDFNTN-QGZVFWFLSA-N 1 2 248.351 2.444 20 0 BEADLO CC(C)(O)CCNc1cc[nH+]c(C(C)(C)C)n1 ZINC000302412927 386921586 /nfs/dbraw/zinc/92/15/86/386921586.db2.gz ILNHUVNDIFPRFR-UHFFFAOYSA-N 1 2 237.347 2.347 20 0 BEADLO CO[C@@H](C)[C@H](C)Nc1nc(N)c2ccccc2[nH+]1 ZINC000302697512 386932734 /nfs/dbraw/zinc/93/27/34/386932734.db2.gz HCZSPNCOMIADGY-IUCAKERBSA-N 1 2 246.314 2.047 20 0 BEADLO OC[C@]1(F)CC[N@H+](Cc2ccsc2Cl)C1 ZINC000334873508 386935153 /nfs/dbraw/zinc/93/51/53/386935153.db2.gz XDZJAKRBPJYUDQ-JTQLQIEISA-N 1 2 249.738 2.308 20 0 BEADLO OC[C@]1(F)CC[N@@H+](Cc2ccsc2Cl)C1 ZINC000334873508 386935155 /nfs/dbraw/zinc/93/51/55/386935155.db2.gz XDZJAKRBPJYUDQ-JTQLQIEISA-N 1 2 249.738 2.308 20 0 BEADLO CCCCC(=O)N[C@@H](c1[nH]cc[nH+]1)C(C)C ZINC000331021204 386936740 /nfs/dbraw/zinc/93/67/40/386936740.db2.gz RVWPOJXFEQTWPY-LLVKDONJSA-N 1 2 223.320 2.413 20 0 BEADLO Cc1cc(NC(=O)N2C[C@H]3CCCC[C@H]32)cc[nH+]1 ZINC000368105074 386940878 /nfs/dbraw/zinc/94/08/78/386940878.db2.gz NUDZDRFLBCEVOQ-DGCLKSJQSA-N 1 2 245.326 2.218 20 0 BEADLO Cn1cc[nH+]c1[C@H](NC(=O)C1=CCCC1)C1CC1 ZINC000341692394 386952769 /nfs/dbraw/zinc/95/27/69/386952769.db2.gz RCMJCULMGHBNHQ-GFCCVEGCSA-N 1 2 245.326 2.098 20 0 BEADLO Cn1cc[nH+]c1[C@H](NC(=O)CCC1CC1)C1CC1 ZINC000341697929 386953159 /nfs/dbraw/zinc/95/31/59/386953159.db2.gz XIRFRKCXBGBJAN-CYBMUJFWSA-N 1 2 247.342 2.178 20 0 BEADLO Cn1cc[nH+]c1[C@@H](NC(=O)CC(C)(C)C)C1CC1 ZINC000341720573 386954481 /nfs/dbraw/zinc/95/44/81/386954481.db2.gz QAJXNVPNNCJEHG-LBPRGKRZSA-N 1 2 249.358 2.424 20 0 BEADLO Cc1ccc(N[C@@H](C)c2ccn(C)n2)c[nH+]1 ZINC000334825633 386957089 /nfs/dbraw/zinc/95/70/89/386957089.db2.gz SCIYWRRQOJBXCC-JTQLQIEISA-N 1 2 216.288 2.297 20 0 BEADLO CCC(CC)[C@H](C)C(=O)NCCc1[nH]cc[nH+]1 ZINC000341757526 386961589 /nfs/dbraw/zinc/96/15/89/386961589.db2.gz XXGPCIHXTZUCMY-JTQLQIEISA-N 1 2 237.347 2.141 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H](C)Cc2ccsc2)c[nH+]1 ZINC000518988946 386973923 /nfs/dbraw/zinc/97/39/23/386973923.db2.gz MMBLUXYKCIXKHX-MRVPVSSYSA-N 1 2 249.339 2.141 20 0 BEADLO Cc1c[nH+]c(C)nc1NC[C@@H]1CCOC(C)(C)C1 ZINC000519000196 386982260 /nfs/dbraw/zinc/98/22/60/386982260.db2.gz ZDLHRPCCTKDOOH-GFCCVEGCSA-N 1 2 249.358 2.132 20 0 BEADLO COC(=O)C[NH2+][C@@H](C)c1c(C)cccc1C ZINC000336745302 386982833 /nfs/dbraw/zinc/98/28/33/386982833.db2.gz VQFVMHXSBXLPRC-NSHDSACASA-N 1 2 221.300 2.127 20 0 BEADLO Cc1nc(C[NH+]2CCC3(CCC3)CC2)no1 ZINC000368608271 386994238 /nfs/dbraw/zinc/99/42/38/386994238.db2.gz NAQSMHRHFACSMF-UHFFFAOYSA-N 1 2 221.304 2.144 20 0 BEADLO C[C@H]1C[N@H+](CCc2cnn[nH]2)[C@@H]1c1ccccc1 ZINC000647966390 387005547 /nfs/dbraw/zinc/00/55/47/387005547.db2.gz QSVWZASQMRQPRD-FZMZJTMJSA-N 1 2 242.326 2.040 20 0 BEADLO C[C@H]1C[N@@H+](CCc2cnn[nH]2)[C@@H]1c1ccccc1 ZINC000647966390 387005550 /nfs/dbraw/zinc/00/55/50/387005550.db2.gz QSVWZASQMRQPRD-FZMZJTMJSA-N 1 2 242.326 2.040 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1CCCOCC1 ZINC000333439034 387036374 /nfs/dbraw/zinc/03/63/74/387036374.db2.gz WDEZVJCJIOQEGW-GFCCVEGCSA-N 1 2 248.326 2.454 20 0 BEADLO CCc1ccc([C@H](C)[NH2+]Cc2ncnn2CC)o1 ZINC000359075263 387052888 /nfs/dbraw/zinc/05/28/88/387052888.db2.gz YPVJQRYZNHTDBU-JTQLQIEISA-N 1 2 248.330 2.304 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccncc2F)C[C@@H](C)O1 ZINC000336222223 387061466 /nfs/dbraw/zinc/06/14/66/387061466.db2.gz MKMRYRFZGPGKCQ-ZYHUDNBSSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccncc2F)C[C@@H](C)O1 ZINC000336222223 387061469 /nfs/dbraw/zinc/06/14/69/387061469.db2.gz MKMRYRFZGPGKCQ-ZYHUDNBSSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccncc2F)C[C@H](C)O1 ZINC000336222220 387062340 /nfs/dbraw/zinc/06/23/40/387062340.db2.gz MKMRYRFZGPGKCQ-CMPLNLGQSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccncc2F)C[C@H](C)O1 ZINC000336222220 387062345 /nfs/dbraw/zinc/06/23/45/387062345.db2.gz MKMRYRFZGPGKCQ-CMPLNLGQSA-N 1 2 238.306 2.220 20 0 BEADLO CO[C@@H](C)C(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000118643137 387065111 /nfs/dbraw/zinc/06/51/11/387065111.db2.gz DTMYRGOXAFZVRP-VIFPVBQESA-N 1 2 245.282 2.050 20 0 BEADLO CCCCCOC1C[NH+](Cc2ccccn2)C1 ZINC000358771155 387011502 /nfs/dbraw/zinc/01/15/02/387011502.db2.gz NOFQEMVMTOCGCD-UHFFFAOYSA-N 1 2 234.343 2.473 20 0 BEADLO CCOC1(C)CN(Cc2c[nH+]cn2C(C)C)C1 ZINC000425372941 387015186 /nfs/dbraw/zinc/01/51/86/387015186.db2.gz UOYOAVUNTKSMRQ-UHFFFAOYSA-N 1 2 237.347 2.075 20 0 BEADLO Fc1cncc(C[NH+]2CC(CC(F)F)C2)c1 ZINC000425365349 387021515 /nfs/dbraw/zinc/02/15/15/387021515.db2.gz KNWNRZZFYNEJKK-UHFFFAOYSA-N 1 2 230.233 2.308 20 0 BEADLO Cc1ccc(Cn2nnc3ccccc32)c(C)[nH+]1 ZINC000358863990 387026047 /nfs/dbraw/zinc/02/60/47/387026047.db2.gz WZQXNLDEOSTSBL-UHFFFAOYSA-N 1 2 238.294 2.491 20 0 BEADLO Cc1ccc(N[C@@H]2CCOC[C@H]2C)c[nH+]1 ZINC000192631506 387029881 /nfs/dbraw/zinc/02/98/81/387029881.db2.gz WUPINFZODLKAKR-BXKDBHETSA-N 1 2 206.289 2.227 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1nccn1C)c1cncc(F)c1 ZINC000359224663 387069155 /nfs/dbraw/zinc/06/91/55/387069155.db2.gz FKUDHEPXOAHNGR-ZJUUUORDSA-N 1 2 248.305 2.366 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)NC2CCCC2)c2[nH+]ccn21 ZINC000333880547 387071488 /nfs/dbraw/zinc/07/14/88/387071488.db2.gz WFPJDWMMMKHCDU-KOLCDFICSA-N 1 2 248.330 2.131 20 0 BEADLO COC(=O)[C@H](C)[N@@H+]1Cc2ccccc2C2(CC2)C1 ZINC000186167675 387073715 /nfs/dbraw/zinc/07/37/15/387073715.db2.gz QIKZDVUNHRRVAJ-NSHDSACASA-N 1 2 245.322 2.095 20 0 BEADLO COC(=O)[C@H](C)[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000186167675 387073719 /nfs/dbraw/zinc/07/37/19/387073719.db2.gz QIKZDVUNHRRVAJ-NSHDSACASA-N 1 2 245.322 2.095 20 0 BEADLO OCC[C@H]1CCCN(c2cccc[nH+]2)CC1 ZINC000334994033 387084202 /nfs/dbraw/zinc/08/42/02/387084202.db2.gz SDSWXGPQNVUNFU-LBPRGKRZSA-N 1 2 220.316 2.071 20 0 BEADLO Cc1cc(C(=O)N(C)Cc2[nH]cc[nH+]2)sc1C ZINC000070980400 387085727 /nfs/dbraw/zinc/08/57/27/387085727.db2.gz JYBQGNJOWQJWAP-UHFFFAOYSA-N 1 2 249.339 2.360 20 0 BEADLO Cc1nc(C[N@H+]2[C@H](C)CCC[C@@H]2C)no1 ZINC000066531622 387086442 /nfs/dbraw/zinc/08/64/42/387086442.db2.gz HLXZHWQVMSUDBO-DTORHVGOSA-N 1 2 209.293 2.141 20 0 BEADLO Cc1nc(C[N@@H+]2[C@H](C)CCC[C@@H]2C)no1 ZINC000066531622 387086445 /nfs/dbraw/zinc/08/64/45/387086445.db2.gz HLXZHWQVMSUDBO-DTORHVGOSA-N 1 2 209.293 2.141 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@H]1CCCC[C@@H]1C ZINC000424860785 387092402 /nfs/dbraw/zinc/09/24/02/387092402.db2.gz FLNPRJANFLZOIR-RYUDHWBXSA-N 1 2 249.358 2.346 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nnc(C3CC3)s2)[C@H]1C ZINC000336266937 387102386 /nfs/dbraw/zinc/10/23/86/387102386.db2.gz OAGIXCRHOHDBLS-SFYZADRCSA-N 1 2 223.345 2.256 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nnc(C3CC3)s2)[C@H]1C ZINC000336266937 387102392 /nfs/dbraw/zinc/10/23/92/387102392.db2.gz OAGIXCRHOHDBLS-SFYZADRCSA-N 1 2 223.345 2.256 20 0 BEADLO CO[C@@H]1CCN(c2[nH]c3ccccc3[nH+]2)C[C@H]1C ZINC000336271252 387104493 /nfs/dbraw/zinc/10/44/93/387104493.db2.gz MBXHKDCPVMYIBK-ZWNOBZJWSA-N 1 2 245.326 2.424 20 0 BEADLO C[C@@H](O)CC[N@@H+]1CCn2c(cc3ccccc32)C1 ZINC000336273323 387106042 /nfs/dbraw/zinc/10/60/42/387106042.db2.gz AEUFMLPWPJIXMR-GFCCVEGCSA-N 1 2 244.338 2.228 20 0 BEADLO C[C@@H](O)CC[N@H+]1CCn2c(cc3ccccc32)C1 ZINC000336273323 387106046 /nfs/dbraw/zinc/10/60/46/387106046.db2.gz AEUFMLPWPJIXMR-GFCCVEGCSA-N 1 2 244.338 2.228 20 0 BEADLO Cc1cc(C)c(CNC(=O)N[C@H]2CC[C@H]2C)c[nH+]1 ZINC000334945812 387108420 /nfs/dbraw/zinc/10/84/20/387108420.db2.gz PHDZVFUMTYESGF-RNCFNFMXSA-N 1 2 247.342 2.296 20 0 BEADLO Cc1cc(C)c(CNC(=O)N[C@@H]2CC[C@H]2C)c[nH+]1 ZINC000334945811 387109134 /nfs/dbraw/zinc/10/91/34/387109134.db2.gz PHDZVFUMTYESGF-NOZJJQNGSA-N 1 2 247.342 2.296 20 0 BEADLO CC(C)CNC(=O)C[N@H+](C)[C@H](C)c1ccco1 ZINC000069069606 387113932 /nfs/dbraw/zinc/11/39/32/387113932.db2.gz CPDZVIMZTKOSRM-LLVKDONJSA-N 1 2 238.331 2.045 20 0 BEADLO CC(C)CNC(=O)C[N@@H+](C)[C@H](C)c1ccco1 ZINC000069069606 387113937 /nfs/dbraw/zinc/11/39/37/387113937.db2.gz CPDZVIMZTKOSRM-LLVKDONJSA-N 1 2 238.331 2.045 20 0 BEADLO O=C1OCC[C@]12CCC[N@H+]2Cc1cccc(F)c1 ZINC000186632268 387117005 /nfs/dbraw/zinc/11/70/05/387117005.db2.gz NWYNWZBMIALHDU-CQSZACIVSA-N 1 2 249.285 2.107 20 0 BEADLO O=C1OCC[C@]12CCC[N@@H+]2Cc1cccc(F)c1 ZINC000186632268 387117012 /nfs/dbraw/zinc/11/70/12/387117012.db2.gz NWYNWZBMIALHDU-CQSZACIVSA-N 1 2 249.285 2.107 20 0 BEADLO Cc1ccc(F)cc1NC(=O)NCc1[nH]cc[nH+]1 ZINC000119347632 387121373 /nfs/dbraw/zinc/12/13/73/387121373.db2.gz KJTSZQIECRPENR-UHFFFAOYSA-N 1 2 248.261 2.179 20 0 BEADLO c1coc([C@@H]2COCC[N@H+]2C[C@H]2CCC=CO2)c1 ZINC000370526235 387123748 /nfs/dbraw/zinc/12/37/48/387123748.db2.gz CHRLZUYYWDQRRZ-OLZOCXBDSA-N 1 2 249.310 2.346 20 0 BEADLO c1coc([C@@H]2COCC[N@@H+]2C[C@H]2CCC=CO2)c1 ZINC000370526235 387123752 /nfs/dbraw/zinc/12/37/52/387123752.db2.gz CHRLZUYYWDQRRZ-OLZOCXBDSA-N 1 2 249.310 2.346 20 0 BEADLO C[C@@H](C(=O)N(C)Cc1[nH]cc[nH+]1)c1ccccc1 ZINC000228905909 387126496 /nfs/dbraw/zinc/12/64/96/387126496.db2.gz PRMOLBQMGIBALH-LLVKDONJSA-N 1 2 243.310 2.172 20 0 BEADLO Cc1nc([C@H](C)[NH+]2C[C@@H](C)S[C@H](C)C2)no1 ZINC000571690030 387142507 /nfs/dbraw/zinc/14/25/07/387142507.db2.gz UGAYVNIPBVUYBR-HLTSFMKQSA-N 1 2 241.360 2.265 20 0 BEADLO Cc1cnc(C[N@H+]2CC[C@H](OCC(C)C)C2)o1 ZINC000120016634 387148219 /nfs/dbraw/zinc/14/82/19/387148219.db2.gz MERGWEKOILSXGS-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cnc(C[N@@H+]2CC[C@H](OCC(C)C)C2)o1 ZINC000120016634 387148224 /nfs/dbraw/zinc/14/82/24/387148224.db2.gz MERGWEKOILSXGS-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO CC[C@@H]1CCC[C@@H]1NC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000571699832 387149802 /nfs/dbraw/zinc/14/98/02/387149802.db2.gz LEHJFKGPAAKXAC-WZRBSPASSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@@H]1CCC[C@@H]1NC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000571699832 387149808 /nfs/dbraw/zinc/14/98/08/387149808.db2.gz LEHJFKGPAAKXAC-WZRBSPASSA-N 1 2 249.358 2.283 20 0 BEADLO CCCCNC(=O)CC[N@@H+]1CCC[C@H]1C(F)F ZINC000353175114 387150814 /nfs/dbraw/zinc/15/08/14/387150814.db2.gz SBZAHYBJQPRGKJ-JTQLQIEISA-N 1 2 248.317 2.022 20 0 BEADLO CCCCNC(=O)CC[N@H+]1CCC[C@H]1C(F)F ZINC000353175114 387150818 /nfs/dbraw/zinc/15/08/18/387150818.db2.gz SBZAHYBJQPRGKJ-JTQLQIEISA-N 1 2 248.317 2.022 20 0 BEADLO Fc1cccc(CCn2cc[nH+]c2)c1F ZINC000336325947 387154472 /nfs/dbraw/zinc/15/44/72/387154472.db2.gz KKZKOSUOIYDGFH-UHFFFAOYSA-N 1 2 208.211 2.404 20 0 BEADLO CCCC[C@H](NC(=O)Cn1cc[nH+]c1)C1CCC1 ZINC000571730957 387157717 /nfs/dbraw/zinc/15/77/17/387157717.db2.gz MFSWLGCEAMWUNC-ZDUSSCGKSA-N 1 2 249.358 2.358 20 0 BEADLO CCCC[C@@H](NC(=O)Cn1cc[nH+]c1)C1CCC1 ZINC000571730954 387158121 /nfs/dbraw/zinc/15/81/21/387158121.db2.gz MFSWLGCEAMWUNC-CYBMUJFWSA-N 1 2 249.358 2.358 20 0 BEADLO CCCc1noc(C[N@@H+]2CCCC3(CC3)C2)n1 ZINC000186985232 387159857 /nfs/dbraw/zinc/15/98/57/387159857.db2.gz YIICIOZBEAURJR-UHFFFAOYSA-N 1 2 235.331 2.398 20 0 BEADLO CCCc1noc(C[N@H+]2CCCC3(CC3)C2)n1 ZINC000186985232 387159858 /nfs/dbraw/zinc/15/98/58/387159858.db2.gz YIICIOZBEAURJR-UHFFFAOYSA-N 1 2 235.331 2.398 20 0 BEADLO Cc1cc(NC(=O)C2CC(C)(C)C2)cc[nH+]1 ZINC000336337319 387163696 /nfs/dbraw/zinc/16/36/96/387163696.db2.gz RCYPZVBIIQZGII-UHFFFAOYSA-N 1 2 218.300 2.187 20 0 BEADLO [NH3+]CC(F)(F)CN[C@H](C1CC1)C1CCCC1 ZINC000423343591 387193195 /nfs/dbraw/zinc/19/31/95/387193195.db2.gz MBDDRCSSAYCKKC-NSHDSACASA-N 1 2 232.318 2.139 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCOC[C@@H]1CC(F)F ZINC000353289342 387172801 /nfs/dbraw/zinc/17/28/01/387172801.db2.gz UCACLARGKDWXCB-BDAKNGLRSA-N 1 2 225.254 2.091 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCOC[C@@H]1CC(F)F ZINC000353289342 387172805 /nfs/dbraw/zinc/17/28/05/387172805.db2.gz UCACLARGKDWXCB-BDAKNGLRSA-N 1 2 225.254 2.091 20 0 BEADLO Cc1oncc1C[N@@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000336349091 387178584 /nfs/dbraw/zinc/17/85/84/387178584.db2.gz ALMAWWCBXIUUSD-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1oncc1C[N@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000336349091 387178589 /nfs/dbraw/zinc/17/85/89/387178589.db2.gz ALMAWWCBXIUUSD-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO CCC1(NC(=O)N[C@@H]2C[C@@H](C)n3cc[nH+]c32)CC1 ZINC000334098214 387194163 /nfs/dbraw/zinc/19/41/63/387194163.db2.gz UKZSJXAZDYWGAV-NXEZZACHSA-N 1 2 248.330 2.131 20 0 BEADLO CCCc1cccc(C[NH2+]CC(F)(F)CO)c1 ZINC000187364917 387182770 /nfs/dbraw/zinc/18/27/70/387182770.db2.gz UWLMGFWYSSVREL-UHFFFAOYSA-N 1 2 243.297 2.356 20 0 BEADLO CCc1ccc([C@@H](C)[NH2+][C@@H](C)c2ncnn2C)o1 ZINC000353335349 387183867 /nfs/dbraw/zinc/18/38/67/387183867.db2.gz KYCFLBROZPZOFH-ZJUUUORDSA-N 1 2 248.330 2.382 20 0 BEADLO CCC[C@H]1C[C@H]1C(=O)Nc1cc[nH+]c(C)c1 ZINC000359914845 387191072 /nfs/dbraw/zinc/19/10/72/387191072.db2.gz BWICBUUJAHMGHC-CMPLNLGQSA-N 1 2 218.300 2.187 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCC[C@H]1c1nc(C)no1 ZINC000353549301 387227397 /nfs/dbraw/zinc/22/73/97/387227397.db2.gz JPTPMPZRYFSPDG-ZJUUUORDSA-N 1 2 227.283 2.263 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCC[C@H]1c1nc(C)no1 ZINC000353549301 387227400 /nfs/dbraw/zinc/22/74/00/387227400.db2.gz JPTPMPZRYFSPDG-ZJUUUORDSA-N 1 2 227.283 2.263 20 0 BEADLO COc1cccc(C[N@@H+]2CCOC[C@@H]2C)c1F ZINC000648638975 387230220 /nfs/dbraw/zinc/23/02/20/387230220.db2.gz ZQBABJFCWQWTAJ-JTQLQIEISA-N 1 2 239.290 2.055 20 0 BEADLO COc1cccc(C[N@H+]2CCOC[C@@H]2C)c1F ZINC000648638975 387230226 /nfs/dbraw/zinc/23/02/26/387230226.db2.gz ZQBABJFCWQWTAJ-JTQLQIEISA-N 1 2 239.290 2.055 20 0 BEADLO Cc1cc(C)c(NC(=O)C2CCOCC2)c(C)[nH+]1 ZINC000097213875 387239899 /nfs/dbraw/zinc/23/98/99/387239899.db2.gz BBCKEUXWRVUPEY-UHFFFAOYSA-N 1 2 248.326 2.372 20 0 BEADLO CC(C)[C@H]1CCCC[C@@H]1NCC(F)(F)C[NH3+] ZINC000423347406 387197818 /nfs/dbraw/zinc/19/78/18/387197818.db2.gz QJJOGCOJFDDFOT-MNOVXSKESA-N 1 2 234.334 2.385 20 0 BEADLO CC(C)(C)CCC(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000371365187 387199300 /nfs/dbraw/zinc/19/93/00/387199300.db2.gz RSXBCWBJLQACFK-SNVBAGLBSA-N 1 2 249.358 2.210 20 0 BEADLO CC(C)(C)CCC(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000371365187 387199303 /nfs/dbraw/zinc/19/93/03/387199303.db2.gz RSXBCWBJLQACFK-SNVBAGLBSA-N 1 2 249.358 2.210 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)[C@H]1CCCC[C@H]1C ZINC000424590348 387199466 /nfs/dbraw/zinc/19/94/66/387199466.db2.gz LCULRSXJALJWMJ-UPJWGTAASA-N 1 2 249.358 2.214 20 0 BEADLO CC[C@@H]1[C@@H](C)CCN1C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000514949020 387312278 /nfs/dbraw/zinc/31/22/78/387312278.db2.gz FUZILWVMIASIRQ-GMXVVIOVSA-N 1 2 249.358 2.235 20 0 BEADLO CC[C@@H]1[C@@H](C)CCN1C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000514949020 387312281 /nfs/dbraw/zinc/31/22/81/387312281.db2.gz FUZILWVMIASIRQ-GMXVVIOVSA-N 1 2 249.358 2.235 20 0 BEADLO OC[C@@H]1C[C@@H](F)C[N@@H+]1Cc1cccc(Cl)c1 ZINC000336424395 387254106 /nfs/dbraw/zinc/25/41/06/387254106.db2.gz TWRMMCXMVZZHFX-NEPJUHHUSA-N 1 2 243.709 2.245 20 0 BEADLO OC[C@@H]1C[C@@H](F)C[N@H+]1Cc1cccc(Cl)c1 ZINC000336424395 387254113 /nfs/dbraw/zinc/25/41/13/387254113.db2.gz TWRMMCXMVZZHFX-NEPJUHHUSA-N 1 2 243.709 2.245 20 0 BEADLO COc1ccncc1NCc1[nH]c(C)c(C)[nH+]1 ZINC000572179962 387257328 /nfs/dbraw/zinc/25/73/28/387257328.db2.gz JQMFYQPHRIIPSN-UHFFFAOYSA-N 1 2 232.287 2.042 20 0 BEADLO CCC[C@H](C)C[N@@H+]1CC(F)(F)C[C@H]1CO ZINC000372638883 387317322 /nfs/dbraw/zinc/31/73/22/387317322.db2.gz KRENLXVXSYBUCV-UWVGGRQHSA-N 1 2 221.291 2.125 20 0 BEADLO CCC[C@H](C)C[N@H+]1CC(F)(F)C[C@H]1CO ZINC000372638883 387317328 /nfs/dbraw/zinc/31/73/28/387317328.db2.gz KRENLXVXSYBUCV-UWVGGRQHSA-N 1 2 221.291 2.125 20 0 BEADLO COC(=O)[C@H]([NH2+]CCCCF)c1ccccc1 ZINC000285774807 387285326 /nfs/dbraw/zinc/28/53/26/387285326.db2.gz WZIFADUBQFOBTI-GFCCVEGCSA-N 1 2 239.290 2.240 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1CCC[C@@H](CO)C1 ZINC000572257138 387287715 /nfs/dbraw/zinc/28/77/15/387287715.db2.gz FCPXQPZOKVOEDW-NEPJUHHUSA-N 1 2 235.331 2.056 20 0 BEADLO CC(C)N(C(=O)CCn1cc[nH+]c1)C1CCC1 ZINC000353863781 387288058 /nfs/dbraw/zinc/28/80/58/387288058.db2.gz XYSAAVRFHNWNNC-UHFFFAOYSA-N 1 2 235.331 2.063 20 0 BEADLO F[C@@]1(c2ccccc2)CC[N@H+](Cc2cc[nH]n2)C1 ZINC000367163012 387289636 /nfs/dbraw/zinc/28/96/36/387289636.db2.gz ILMZKDFUBXGAAE-AWEZNQCLSA-N 1 2 245.301 2.480 20 0 BEADLO F[C@@]1(c2ccccc2)CC[N@@H+](Cc2cc[nH]n2)C1 ZINC000367163012 387289640 /nfs/dbraw/zinc/28/96/40/387289640.db2.gz ILMZKDFUBXGAAE-AWEZNQCLSA-N 1 2 245.301 2.480 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NCc1nccs1 ZINC000121094777 387294248 /nfs/dbraw/zinc/29/42/48/387294248.db2.gz UHNXKGFGQHYXHE-UHFFFAOYSA-N 1 2 248.311 2.168 20 0 BEADLO CC(C)Cn1ncnc1C[N@@H+]1CCC12CCC2 ZINC000352546717 387307529 /nfs/dbraw/zinc/30/75/29/387307529.db2.gz ZJQADDXPYDDWOX-UHFFFAOYSA-N 1 2 234.347 2.063 20 0 BEADLO CC(C)Cn1ncnc1C[N@H+]1CCC12CCC2 ZINC000352546717 387307531 /nfs/dbraw/zinc/30/75/31/387307531.db2.gz ZJQADDXPYDDWOX-UHFFFAOYSA-N 1 2 234.347 2.063 20 0 BEADLO CC[C@](C)([NH2+]Cc1cncnc1)c1nccs1 ZINC000152619024 387308494 /nfs/dbraw/zinc/30/84/94/387308494.db2.gz AQGGUCFUOTWIMQ-LBPRGKRZSA-N 1 2 248.355 2.348 20 0 BEADLO CO[C@@H]1CC[N@H+](Cc2ncc(Cl)s2)C1 ZINC000336533105 387354810 /nfs/dbraw/zinc/35/48/10/387354810.db2.gz YONAZRPOKUOTMS-SSDOTTSWSA-N 1 2 232.736 2.017 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000336533105 387354813 /nfs/dbraw/zinc/35/48/13/387354813.db2.gz YONAZRPOKUOTMS-SSDOTTSWSA-N 1 2 232.736 2.017 20 0 BEADLO CCc1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)cn1 ZINC000336534043 387357420 /nfs/dbraw/zinc/35/74/20/387357420.db2.gz BKUSUDZHJMQDQN-OKILXGFUSA-N 1 2 232.327 2.007 20 0 BEADLO CCc1ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)cn1 ZINC000336534043 387357425 /nfs/dbraw/zinc/35/74/25/387357425.db2.gz BKUSUDZHJMQDQN-OKILXGFUSA-N 1 2 232.327 2.007 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)C1CC(C)(C)C1 ZINC000354357648 387366493 /nfs/dbraw/zinc/36/64/93/387366493.db2.gz DRTYFVUSCJMIER-UHFFFAOYSA-N 1 2 249.358 2.168 20 0 BEADLO CC(=O)C[N@@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000639537890 387369981 /nfs/dbraw/zinc/36/99/81/387369981.db2.gz BYFONEKBTPVRHX-JTQLQIEISA-N 1 2 207.273 2.394 20 0 BEADLO CC(=O)C[N@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000639537890 387369983 /nfs/dbraw/zinc/36/99/83/387369983.db2.gz BYFONEKBTPVRHX-JTQLQIEISA-N 1 2 207.273 2.394 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCSC(C)(C)C2)n1 ZINC000336553749 387374630 /nfs/dbraw/zinc/37/46/30/387374630.db2.gz JWCIKCCEQLXOCZ-UHFFFAOYSA-N 1 2 237.372 2.112 20 0 BEADLO Cc1ccnc(C[N@H+]2CCSC(C)(C)C2)n1 ZINC000336553749 387374632 /nfs/dbraw/zinc/37/46/32/387374632.db2.gz JWCIKCCEQLXOCZ-UHFFFAOYSA-N 1 2 237.372 2.112 20 0 BEADLO CCCC[C@H]([NH2+]C[C@@](C)(CC)OC)C(=O)OC ZINC000322616367 259711825 /nfs/dbraw/zinc/71/18/25/259711825.db2.gz MHXXDHJCFJXVTB-WCQYABFASA-N 1 2 245.363 2.123 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2CCO[C@H]2C)c(C)[nH+]1 ZINC000336494266 387320533 /nfs/dbraw/zinc/32/05/33/387320533.db2.gz JUKBHIUZQUONLK-QWRGUYRKSA-N 1 2 234.299 2.062 20 0 BEADLO CCCC(C)(C)NC(=O)[C@@H]1CCc2[nH+]ccn2C1 ZINC000372712976 387322924 /nfs/dbraw/zinc/32/29/24/387322924.db2.gz IFTZYNVFPDELAA-LLVKDONJSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCO[C@H](C2CCC2)C1 ZINC000515071999 387331609 /nfs/dbraw/zinc/33/16/09/387331609.db2.gz GETFMRDVDYCDMB-ZDUSSCGKSA-N 1 2 247.342 2.099 20 0 BEADLO F[C@@H]1CC[C@@H](Nc2cc[nH+]c3ccncc23)C1 ZINC000336514193 387337321 /nfs/dbraw/zinc/33/73/21/387337321.db2.gz WMVCERWUKGHHEN-NXEZZACHSA-N 1 2 231.274 2.354 20 0 BEADLO CC[C@@H](C)CCC(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000354233898 387350795 /nfs/dbraw/zinc/35/07/95/387350795.db2.gz ALXFDDGVWHJGOI-MNOVXSKESA-N 1 2 249.358 2.210 20 0 BEADLO CC[C@@H](C)CCC(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000354233898 387350804 /nfs/dbraw/zinc/35/08/04/387350804.db2.gz ALXFDDGVWHJGOI-MNOVXSKESA-N 1 2 249.358 2.210 20 0 BEADLO c1coc([C@H]2C[N@H+](Cc3cccnc3)CCO2)c1 ZINC000121440665 387351896 /nfs/dbraw/zinc/35/18/96/387351896.db2.gz VMKPEZGHJSCQBP-CQSZACIVSA-N 1 2 244.294 2.248 20 0 BEADLO c1coc([C@H]2C[N@@H+](Cc3cccnc3)CCO2)c1 ZINC000121440665 387351900 /nfs/dbraw/zinc/35/19/00/387351900.db2.gz VMKPEZGHJSCQBP-CQSZACIVSA-N 1 2 244.294 2.248 20 0 BEADLO c1c[nH]c(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)n1 ZINC000374222294 387433273 /nfs/dbraw/zinc/43/32/73/387433273.db2.gz FGRBXSKITKCSQT-ZDUSSCGKSA-N 1 2 243.310 2.063 20 0 BEADLO c1c[nH]c(C[N@H+]2CC[C@H](Oc3ccccc3)C2)n1 ZINC000374222294 387433278 /nfs/dbraw/zinc/43/32/78/387433278.db2.gz FGRBXSKITKCSQT-ZDUSSCGKSA-N 1 2 243.310 2.063 20 0 BEADLO c1csc([C@@H]2CCC[N@H+]2Cc2cncnc2)n1 ZINC000374302423 387440901 /nfs/dbraw/zinc/44/09/01/387440901.db2.gz OVAFWDMYEZRWNJ-NSHDSACASA-N 1 2 246.339 2.270 20 0 BEADLO c1csc([C@@H]2CCC[N@@H+]2Cc2cncnc2)n1 ZINC000374302423 387440907 /nfs/dbraw/zinc/44/09/07/387440907.db2.gz OVAFWDMYEZRWNJ-NSHDSACASA-N 1 2 246.339 2.270 20 0 BEADLO CCCc1nc(C[N@@H+]2CC[C@@H](OC)C2)cs1 ZINC000361361327 387447259 /nfs/dbraw/zinc/44/72/59/387447259.db2.gz FVCQUTLWPQYZNZ-LLVKDONJSA-N 1 2 240.372 2.316 20 0 BEADLO CCCc1nc(C[N@H+]2CC[C@@H](OC)C2)cs1 ZINC000361361327 387447272 /nfs/dbraw/zinc/44/72/72/387447272.db2.gz FVCQUTLWPQYZNZ-LLVKDONJSA-N 1 2 240.372 2.316 20 0 BEADLO Cc1ccncc1C[N@@H+](C)[C@@H](C)c1cnccn1 ZINC000361423499 387459717 /nfs/dbraw/zinc/45/97/17/387459717.db2.gz CETHISIDJLWVNG-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1ccncc1C[N@H+](C)[C@@H](C)c1cnccn1 ZINC000361423499 387459721 /nfs/dbraw/zinc/45/97/21/387459721.db2.gz CETHISIDJLWVNG-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1ccc(C)o1 ZINC000336561067 387386877 /nfs/dbraw/zinc/38/68/77/387386877.db2.gz WZZUDWZFPSPGRD-UHFFFAOYSA-N 1 2 230.267 2.220 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1ccncn1 ZINC000515500512 387390912 /nfs/dbraw/zinc/39/09/12/387390912.db2.gz LQIUWNILHKWPQB-BDAKNGLRSA-N 1 2 234.328 2.345 20 0 BEADLO CC[C@H]1C[C@H](Nc2[nH+]cccc2OC)CCO1 ZINC000648491211 387402172 /nfs/dbraw/zinc/40/21/72/387402172.db2.gz IJRWWNXLANXAJV-MNOVXSKESA-N 1 2 236.315 2.460 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NCc1ccncc1 ZINC000121752528 387402677 /nfs/dbraw/zinc/40/26/77/387402677.db2.gz ZHZGUEQFHZPENR-UHFFFAOYSA-N 1 2 242.282 2.107 20 0 BEADLO Cc1ccnc(C[NH2+][C@@H](C)c2cncc(F)c2)n1 ZINC000361118645 387403361 /nfs/dbraw/zinc/40/33/61/387403361.db2.gz CGVNYNAIZPEGOQ-JTQLQIEISA-N 1 2 246.289 2.170 20 0 BEADLO FC1C[NH+](C[C@H]2C[C@H]2c2ccccc2)C1 ZINC000336618731 387460868 /nfs/dbraw/zinc/46/08/68/387460868.db2.gz XYKUUIIFOUSZRQ-YPMHNXCESA-N 1 2 205.276 2.444 20 0 BEADLO Clc1cnccc1C[NH+]1CCSCC1 ZINC000336590998 387416334 /nfs/dbraw/zinc/41/63/34/387416334.db2.gz IPADYOOZHXHOHO-UHFFFAOYSA-N 1 2 228.748 2.284 20 0 BEADLO CC(C)Cn1cc[nH+]c1CNC(=O)C[C@@H]1C[C@H]1C ZINC000354706889 387420181 /nfs/dbraw/zinc/42/01/81/387420181.db2.gz HQHCBZNVKZAXTA-NEPJUHHUSA-N 1 2 249.358 2.201 20 0 BEADLO C[C@H](O)[C@H]1CCN(c2[nH+]ccc3ccccc32)C1 ZINC000162698041 387495584 /nfs/dbraw/zinc/49/55/84/387495584.db2.gz PCPBOTXIAIVPJB-AAEUAGOBSA-N 1 2 242.322 2.442 20 0 BEADLO Cc1cn[nH]c1CNc1ccc2c(c1)[nH+]cn2C ZINC000352810377 387500356 /nfs/dbraw/zinc/50/03/56/387500356.db2.gz MRJKBWMLAXESSZ-UHFFFAOYSA-N 1 2 241.298 2.217 20 0 BEADLO CCN(CC)C(=O)C[N@@H+]1Cc2ccc(C)cc2C1 ZINC000361589257 387504440 /nfs/dbraw/zinc/50/44/40/387504440.db2.gz USIVGZLMNWGUBL-UHFFFAOYSA-N 1 2 246.354 2.179 20 0 BEADLO CCN(CC)C(=O)C[N@H+]1Cc2ccc(C)cc2C1 ZINC000361589257 387504441 /nfs/dbraw/zinc/50/44/41/387504441.db2.gz USIVGZLMNWGUBL-UHFFFAOYSA-N 1 2 246.354 2.179 20 0 BEADLO Cc1nc(C)c(N[C@H](C)Cn2cc[nH+]c2)nc1C ZINC000396875094 387505745 /nfs/dbraw/zinc/50/57/45/387505745.db2.gz ZSXHYUNVZRMUHU-SECBINFHSA-N 1 2 245.330 2.099 20 0 BEADLO CCC[N@H+](CCC1(O)CCC1)CC(F)F ZINC000396914636 387514132 /nfs/dbraw/zinc/51/41/32/387514132.db2.gz MIPYVFGLILKBGP-UHFFFAOYSA-N 1 2 221.291 2.269 20 0 BEADLO CCC[N@@H+](CCC1(O)CCC1)CC(F)F ZINC000396914636 387514136 /nfs/dbraw/zinc/51/41/36/387514136.db2.gz MIPYVFGLILKBGP-UHFFFAOYSA-N 1 2 221.291 2.269 20 0 BEADLO CCOc1cccc(C[N@@H+]2CC[C@](C)(F)C2)n1 ZINC000355351499 387522842 /nfs/dbraw/zinc/52/28/42/387522842.db2.gz FKUDLKZPHGVUPE-ZDUSSCGKSA-N 1 2 238.306 2.414 20 0 BEADLO CCOc1cccc(C[N@H+]2CC[C@](C)(F)C2)n1 ZINC000355351499 387522845 /nfs/dbraw/zinc/52/28/45/387522845.db2.gz FKUDLKZPHGVUPE-ZDUSSCGKSA-N 1 2 238.306 2.414 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)Cc2c[nH+]cn2C)CC1 ZINC000527190813 387523190 /nfs/dbraw/zinc/52/31/90/387523190.db2.gz RLXDUDINUKYOST-VXGBXAGGSA-N 1 2 249.358 2.048 20 0 BEADLO CCC1(CC)C[N@H+](CC2(F)CC2)CC[S@@]1=O ZINC000527233653 387544199 /nfs/dbraw/zinc/54/41/99/387544199.db2.gz SUAWIVUEKCQIAQ-INIZCTEOSA-N 1 2 247.379 2.112 20 0 BEADLO CCC1(CC)C[N@@H+](CC2(F)CC2)CC[S@@]1=O ZINC000527233653 387544203 /nfs/dbraw/zinc/54/42/03/387544203.db2.gz SUAWIVUEKCQIAQ-INIZCTEOSA-N 1 2 247.379 2.112 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)Nc1cc[nH+]cc1CC ZINC000361788398 387535031 /nfs/dbraw/zinc/53/50/31/387535031.db2.gz RNDGREYXSULSIQ-VXGBXAGGSA-N 1 2 232.327 2.441 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C[C@@H]1C[C@@H]1C ZINC000361785683 387536317 /nfs/dbraw/zinc/53/63/17/387536317.db2.gz HDLMCFJNQCIXKH-ONGXEEELSA-N 1 2 218.300 2.051 20 0 BEADLO COC(=O)[C@H](CC(F)F)[NH2+]C[C@H]1CC=CCC1 ZINC000355048835 387469757 /nfs/dbraw/zinc/46/97/57/387469757.db2.gz KHMKWUWLOCKTHK-UWVGGRQHSA-N 1 2 247.285 2.129 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+](C)C[C@@H]2CCCO2)o1 ZINC000355057199 387472229 /nfs/dbraw/zinc/47/22/29/387472229.db2.gz JPJGZHQBAHSELN-MNOVXSKESA-N 1 2 224.304 2.155 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+](C)C[C@@H]2CCCO2)o1 ZINC000355057199 387472233 /nfs/dbraw/zinc/47/22/33/387472233.db2.gz JPJGZHQBAHSELN-MNOVXSKESA-N 1 2 224.304 2.155 20 0 BEADLO CCOCC[N@@H+]1CCn2c(cc3ccccc32)C1 ZINC000361512583 387477035 /nfs/dbraw/zinc/47/70/35/387477035.db2.gz LICZZUNIWUEWIT-UHFFFAOYSA-N 1 2 244.338 2.493 20 0 BEADLO CCOCC[N@H+]1CCn2c(cc3ccccc32)C1 ZINC000361512583 387477041 /nfs/dbraw/zinc/47/70/41/387477041.db2.gz LICZZUNIWUEWIT-UHFFFAOYSA-N 1 2 244.338 2.493 20 0 BEADLO Cc1cn2c(n1)C[N@H+]([C@H](C)c1cccnc1)CC2 ZINC000374702587 387482196 /nfs/dbraw/zinc/48/21/96/387482196.db2.gz SBKOFNHVRGNKSC-GFCCVEGCSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1cn2c(n1)C[N@@H+]([C@H](C)c1cccnc1)CC2 ZINC000374702587 387482201 /nfs/dbraw/zinc/48/22/01/387482201.db2.gz SBKOFNHVRGNKSC-GFCCVEGCSA-N 1 2 242.326 2.163 20 0 BEADLO CC(C)C1(NC(=O)c2ccc3[nH+]ccn3c2)CC1 ZINC000336630143 387482563 /nfs/dbraw/zinc/48/25/63/387482563.db2.gz ATFRLHBAJLYUHL-UHFFFAOYSA-N 1 2 243.310 2.253 20 0 BEADLO Cc1cn2c(n1)C[N@H+]([C@H]1C=CCCC1)CC2 ZINC000374708888 387485674 /nfs/dbraw/zinc/48/56/74/387485674.db2.gz DCSOWDGUDWLYRY-LBPRGKRZSA-N 1 2 217.316 2.116 20 0 BEADLO Cc1cn2c(n1)C[N@@H+]([C@H]1C=CCCC1)CC2 ZINC000374708888 387485678 /nfs/dbraw/zinc/48/56/78/387485678.db2.gz DCSOWDGUDWLYRY-LBPRGKRZSA-N 1 2 217.316 2.116 20 0 BEADLO CC[N@H+](C[C@@H](C)OC)[C@H](C)c1nnc(C)s1 ZINC000361559212 387490284 /nfs/dbraw/zinc/49/02/84/387490284.db2.gz NWKWBMOXIOXIKJ-RKDXNWHRSA-N 1 2 243.376 2.264 20 0 BEADLO CC[N@@H+](C[C@@H](C)OC)[C@H](C)c1nnc(C)s1 ZINC000361559212 387490289 /nfs/dbraw/zinc/49/02/89/387490289.db2.gz NWKWBMOXIOXIKJ-RKDXNWHRSA-N 1 2 243.376 2.264 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H]1C[C@H](c2ccccc2)[C@H]1C ZINC000355171983 387492795 /nfs/dbraw/zinc/49/27/95/387492795.db2.gz XBLAYPWFCOLABJ-UVLXDEKHSA-N 1 2 247.338 2.330 20 0 BEADLO CCC1(CC)CN(C(=O)C(C)(C)c2c[nH+]c[nH]2)C1 ZINC000355823968 387582539 /nfs/dbraw/zinc/58/25/39/387582539.db2.gz XVIJFXVYMWSZQO-UHFFFAOYSA-N 1 2 249.358 2.336 20 0 BEADLO CC(C)n1ccnc1C[N@@H+]1CCOCC[C@@H]1C ZINC000362239023 387586528 /nfs/dbraw/zinc/58/65/28/387586528.db2.gz RQLHCQFZVKHNJV-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccnc1C[N@H+]1CCOCC[C@@H]1C ZINC000362239023 387586534 /nfs/dbraw/zinc/58/65/34/387586534.db2.gz RQLHCQFZVKHNJV-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1ccc(F)cc1O ZINC000123724986 387592771 /nfs/dbraw/zinc/59/27/71/387592771.db2.gz QCJCKPYWBULOGC-UHFFFAOYSA-N 1 2 246.241 2.487 20 0 BEADLO Cc1ccnc(C[N@H+]2CCC(F)(F)C[C@H]2C)n1 ZINC000528765188 387595377 /nfs/dbraw/zinc/59/53/77/387595377.db2.gz ASWKNUKUKDPBPM-SNVBAGLBSA-N 1 2 241.285 2.405 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCC(F)(F)C[C@H]2C)n1 ZINC000528765188 387595380 /nfs/dbraw/zinc/59/53/80/387595380.db2.gz ASWKNUKUKDPBPM-SNVBAGLBSA-N 1 2 241.285 2.405 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2c(c1)CCOC2 ZINC000527532555 387600006 /nfs/dbraw/zinc/60/00/06/387600006.db2.gz JGKVJRMXDXEBID-UHFFFAOYSA-N 1 2 214.268 2.160 20 0 BEADLO CCCc1nc(C[N@H+]2CC(C)=C[C@@H](C)C2)no1 ZINC000430267117 387603279 /nfs/dbraw/zinc/60/32/79/387603279.db2.gz JAUNMXKKFJINGJ-SNVBAGLBSA-N 1 2 235.331 2.420 20 0 BEADLO CCCc1nc(C[N@@H+]2CC(C)=C[C@@H](C)C2)no1 ZINC000430267117 387603283 /nfs/dbraw/zinc/60/32/83/387603283.db2.gz JAUNMXKKFJINGJ-SNVBAGLBSA-N 1 2 235.331 2.420 20 0 BEADLO CCCn1ncnc1C[N@H+]1CC(C)=C[C@@H](C)C1 ZINC000430266982 387604184 /nfs/dbraw/zinc/60/41/84/387604184.db2.gz ZLTWIXZPAPIREE-LLVKDONJSA-N 1 2 234.347 2.086 20 0 BEADLO CCCn1ncnc1C[N@@H+]1CC(C)=C[C@@H](C)C1 ZINC000430266982 387604188 /nfs/dbraw/zinc/60/41/88/387604188.db2.gz ZLTWIXZPAPIREE-LLVKDONJSA-N 1 2 234.347 2.086 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2csnn2)ccn1 ZINC000527540930 387610475 /nfs/dbraw/zinc/61/04/75/387610475.db2.gz YRNXFZMVIAAZAQ-VIFPVBQESA-N 1 2 234.328 2.092 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+]1CCC(C)=C(c2ccco2)C1 ZINC000367222500 387614516 /nfs/dbraw/zinc/61/45/16/387614516.db2.gz BAYAIMHWSYOALF-LLVKDONJSA-N 1 2 249.310 2.320 20 0 BEADLO COC(=O)[C@@H](C)[N@H+]1CCC(C)=C(c2ccco2)C1 ZINC000367222500 387614518 /nfs/dbraw/zinc/61/45/18/387614518.db2.gz BAYAIMHWSYOALF-LLVKDONJSA-N 1 2 249.310 2.320 20 0 BEADLO CC(C)c1nnc(COc2cc[nH+]cc2)o1 ZINC000356102960 387616106 /nfs/dbraw/zinc/61/61/06/387616106.db2.gz XUTLVZWNTXBVRH-UHFFFAOYSA-N 1 2 219.244 2.167 20 0 BEADLO Cc1cc[nH+]cc1NCc1c[nH]c2nccnc12 ZINC000356147853 387621456 /nfs/dbraw/zinc/62/14/56/387621456.db2.gz YZYWKLHKDAPTBB-UHFFFAOYSA-N 1 2 239.282 2.225 20 0 BEADLO Cc1cc(NC[C@@H]2CCCS2)nc(C2CC2)[nH+]1 ZINC000362560027 387629754 /nfs/dbraw/zinc/62/97/54/387629754.db2.gz JKCWSLFPOQYLSN-NSHDSACASA-N 1 2 249.383 2.392 20 0 BEADLO C[C@H]([NH2+]Cc1cscn1)c1cccnc1 ZINC000040421127 387550698 /nfs/dbraw/zinc/55/06/98/387550698.db2.gz JHTSGZBJLUEFPA-VIFPVBQESA-N 1 2 219.313 2.389 20 0 BEADLO CC(C)c1nc(N[C@H](C)[C@H]2CCCOC2)cc[nH+]1 ZINC000355572111 387553001 /nfs/dbraw/zinc/55/30/01/387553001.db2.gz ZRAVWRYVKTZINL-NEPJUHHUSA-N 1 2 249.358 2.249 20 0 BEADLO Cc1ccc(C[N@H+](CCO)Cc2ccco2)o1 ZINC000355645490 387561435 /nfs/dbraw/zinc/56/14/35/387561435.db2.gz DNWQYPJLDAVSAR-UHFFFAOYSA-N 1 2 235.283 2.176 20 0 BEADLO Cc1ccc(C[N@@H+](CCO)Cc2ccco2)o1 ZINC000355645490 387561437 /nfs/dbraw/zinc/56/14/37/387561437.db2.gz DNWQYPJLDAVSAR-UHFFFAOYSA-N 1 2 235.283 2.176 20 0 BEADLO COC(=O)[C@H](C)[NH2+]C/C(C)=C\c1ccccc1 ZINC000355664713 387564336 /nfs/dbraw/zinc/56/43/36/387564336.db2.gz VLELLKMPGBILOX-MMRAYRKESA-N 1 2 233.311 2.241 20 0 BEADLO CCCC(C)(C)NC(=O)[C@H]1CCn2c[nH+]cc2C1 ZINC000362136473 387578835 /nfs/dbraw/zinc/57/88/35/387578835.db2.gz LUECNESLTKXVNU-NSHDSACASA-N 1 2 249.358 2.140 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H]1C[C@@H]1C(C)C ZINC000356221094 387630142 /nfs/dbraw/zinc/63/01/42/387630142.db2.gz OLWIXIGNWRAQMO-NEPJUHHUSA-N 1 2 232.327 2.297 20 0 BEADLO COc1cc(C[N@@H+]2CCC(F)(F)C[C@@H]2C)on1 ZINC000528767268 387634432 /nfs/dbraw/zinc/63/44/32/387634432.db2.gz GEKIDGKKMPSZGT-QMMMGPOBSA-N 1 2 246.257 2.303 20 0 BEADLO COc1cc(C[N@H+]2CCC(F)(F)C[C@@H]2C)on1 ZINC000528767268 387634439 /nfs/dbraw/zinc/63/44/39/387634439.db2.gz GEKIDGKKMPSZGT-QMMMGPOBSA-N 1 2 246.257 2.303 20 0 BEADLO CCc1nc(C[NH+]2[C@H](C)CC[C@H]2C)no1 ZINC000123032802 387639394 /nfs/dbraw/zinc/63/93/94/387639394.db2.gz PCGIIDJRFJJWNL-RKDXNWHRSA-N 1 2 209.293 2.005 20 0 BEADLO CC[C@H](NC(=O)c1ccsc1)c1[nH]cc[nH+]1 ZINC000125331792 387652053 /nfs/dbraw/zinc/65/20/53/387652053.db2.gz FGEXOQJAENKGKM-VIFPVBQESA-N 1 2 235.312 2.352 20 0 BEADLO CCCCOCCCNc1cc(C)[nH+]cn1 ZINC000123121443 387657041 /nfs/dbraw/zinc/65/70/41/387657041.db2.gz LKWDPJGAJZIXLB-UHFFFAOYSA-N 1 2 223.320 2.404 20 0 BEADLO Fc1c[nH+]ccc1NCc1cccc2c[nH]nc21 ZINC000362800044 387660844 /nfs/dbraw/zinc/66/08/44/387660844.db2.gz ZIDMRFKGQYPZHZ-UHFFFAOYSA-N 1 2 242.257 2.131 20 0 BEADLO c1cncc(CNc2cc[nH+]c3ccncc23)c1 ZINC000362857873 387666378 /nfs/dbraw/zinc/66/63/78/387666378.db2.gz YUUHISYPZIGLCR-UHFFFAOYSA-N 1 2 236.278 2.059 20 0 BEADLO c1nc(C[N@@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)co1 ZINC000356516638 387667810 /nfs/dbraw/zinc/66/78/10/387667810.db2.gz FCVLCOHJTVVASC-CHWSQXEVSA-N 1 2 248.326 2.208 20 0 BEADLO c1nc(C[N@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)co1 ZINC000356516638 387667815 /nfs/dbraw/zinc/66/78/15/387667815.db2.gz FCVLCOHJTVVASC-CHWSQXEVSA-N 1 2 248.326 2.208 20 0 BEADLO CC[C@@H](F)C[N@H+](C)C1(C(=O)OC)CCCC1 ZINC000440767381 387685910 /nfs/dbraw/zinc/68/59/10/387685910.db2.gz SGAHIASGLYDFOM-SNVBAGLBSA-N 1 2 231.311 2.152 20 0 BEADLO CC[C@@H](F)C[N@@H+](C)C1(C(=O)OC)CCCC1 ZINC000440767381 387685915 /nfs/dbraw/zinc/68/59/15/387685915.db2.gz SGAHIASGLYDFOM-SNVBAGLBSA-N 1 2 231.311 2.152 20 0 BEADLO CCn1cc(C[NH2+][C@@H](C)c2ncccc2F)cn1 ZINC000527826719 387745180 /nfs/dbraw/zinc/74/51/80/387745180.db2.gz SLXFQOTVXAQDCR-JTQLQIEISA-N 1 2 248.305 2.288 20 0 BEADLO COc1ccc[nH+]c1N1CCC(C)CC1 ZINC000527822862 387745926 /nfs/dbraw/zinc/74/59/26/387745926.db2.gz HZFSJYWACVMNQH-UHFFFAOYSA-N 1 2 206.289 2.327 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1C[C@H]2CCCC[C@H]21 ZINC000377745310 387746861 /nfs/dbraw/zinc/74/68/61/387746861.db2.gz NKNAAXNSIKGQCB-DGCLKSJQSA-N 1 2 245.326 2.218 20 0 BEADLO Cc1oncc1C[N@@H+]1CCO[C@H](c2ccco2)C1 ZINC000128872370 387756481 /nfs/dbraw/zinc/75/64/81/387756481.db2.gz NSAABGNYTDVKIP-ZDUSSCGKSA-N 1 2 248.282 2.150 20 0 BEADLO Cc1oncc1C[N@H+]1CCO[C@H](c2ccco2)C1 ZINC000128872370 387756487 /nfs/dbraw/zinc/75/64/87/387756487.db2.gz NSAABGNYTDVKIP-ZDUSSCGKSA-N 1 2 248.282 2.150 20 0 BEADLO COc1ccc[nH+]c1N(C)Cc1cc(C)on1 ZINC000527842471 387751006 /nfs/dbraw/zinc/75/10/06/387751006.db2.gz ONSQVBDRTVLQGO-UHFFFAOYSA-N 1 2 233.271 2.023 20 0 BEADLO CCn1c[nH+]cc1CNc1cccc2c1OCC2 ZINC000527763582 387700096 /nfs/dbraw/zinc/70/00/96/387700096.db2.gz RYDVRUBCGFCNGS-UHFFFAOYSA-N 1 2 243.310 2.450 20 0 BEADLO COc1cc(COc2cc[nH+]cc2)ccn1 ZINC000431506707 387713001 /nfs/dbraw/zinc/71/30/01/387713001.db2.gz OWSOVMAOWKKVBS-UHFFFAOYSA-N 1 2 216.240 2.064 20 0 BEADLO CC(C)n1ccc(C[N@@H+]2CCOCC[C@@H]2C)n1 ZINC000367637913 387736621 /nfs/dbraw/zinc/73/66/21/387736621.db2.gz ZRQADGMTMKRWFQ-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccc(C[N@H+]2CCOCC[C@@H]2C)n1 ZINC000367637913 387736625 /nfs/dbraw/zinc/73/66/25/387736625.db2.gz ZRQADGMTMKRWFQ-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccc(C[N@@H+]2CCOCC[C@H]2C)n1 ZINC000367637912 387736808 /nfs/dbraw/zinc/73/68/08/387736808.db2.gz ZRQADGMTMKRWFQ-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccc(C[N@H+]2CCOCC[C@H]2C)n1 ZINC000367637912 387736811 /nfs/dbraw/zinc/73/68/11/387736811.db2.gz ZRQADGMTMKRWFQ-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO COc1ccc[nH+]c1N1C[C@H](C)OC(C)(C)C1 ZINC000527867230 387739526 /nfs/dbraw/zinc/73/95/26/387739526.db2.gz RVJPKJRUUMMZOA-JTQLQIEISA-N 1 2 236.315 2.094 20 0 BEADLO COc1ccc[nH+]c1NCCc1ccc(C)nc1 ZINC000527890511 387773789 /nfs/dbraw/zinc/77/37/89/387773789.db2.gz ISJDNVUZEQGFDY-UHFFFAOYSA-N 1 2 243.310 2.448 20 0 BEADLO CC[C@@H](C)[C@@](C)(O)CNc1[nH+]cccc1OC ZINC000527892903 387776323 /nfs/dbraw/zinc/77/63/23/387776323.db2.gz LSVWXTZQWAOWDH-MFKMUULPSA-N 1 2 238.331 2.299 20 0 BEADLO CC(C)=CC(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000378407811 387783656 /nfs/dbraw/zinc/78/36/56/387783656.db2.gz IBKILCMYRDKNNL-SNVBAGLBSA-N 1 2 219.288 2.039 20 0 BEADLO COc1ccc[nH+]c1N1CCC=C(F)C1 ZINC000527958407 387784768 /nfs/dbraw/zinc/78/47/68/387784768.db2.gz VWIKCAXYBJZKBS-UHFFFAOYSA-N 1 2 208.236 2.154 20 0 BEADLO CC[C@@]1(C)CN(c2[nH+]cccc2OC)CCO1 ZINC000527984439 387802282 /nfs/dbraw/zinc/80/22/82/387802282.db2.gz WWHSZOFMHXXQKJ-ZDUSSCGKSA-N 1 2 236.315 2.096 20 0 BEADLO CC[C@@H]1CN(c2[nH+]cccc2OC)CCCO1 ZINC000527998268 387805215 /nfs/dbraw/zinc/80/52/15/387805215.db2.gz LIRVBEPOYNXDBL-LLVKDONJSA-N 1 2 236.315 2.096 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+][C@@H]1C[C@]1(C)OC(C)C ZINC000527999749 387806910 /nfs/dbraw/zinc/80/69/10/387806910.db2.gz PJVBKAVMDGHGLO-WQAKAFBOSA-N 1 2 237.347 2.325 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N1CCC2(CCC2)CC1 ZINC000367816798 387758433 /nfs/dbraw/zinc/75/84/33/387758433.db2.gz VPEAYJCRZDNDOC-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N1CCC2(CCC2)CC1 ZINC000367816798 387758449 /nfs/dbraw/zinc/75/84/49/387758449.db2.gz VPEAYJCRZDNDOC-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO CC[C@H]1C[C@H](C[N@H+](C)CC(F)F)CCO1 ZINC000356985992 387758780 /nfs/dbraw/zinc/75/87/80/387758780.db2.gz IRRDHRSQYBCHBU-ZJUUUORDSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@H]1C[C@H](C[N@@H+](C)CC(F)F)CCO1 ZINC000356985992 387758785 /nfs/dbraw/zinc/75/87/85/387758785.db2.gz IRRDHRSQYBCHBU-ZJUUUORDSA-N 1 2 221.291 2.389 20 0 BEADLO C[C@H](O)CCCNc1[nH+]ccc2ccc(F)cc21 ZINC000432827208 387829453 /nfs/dbraw/zinc/82/94/53/387829453.db2.gz BBTJTVWKMZJQQP-JTQLQIEISA-N 1 2 248.301 2.369 20 0 BEADLO COc1ccc[nH+]c1N(C)Cc1cccc(C)n1 ZINC000528032766 387833560 /nfs/dbraw/zinc/83/35/60/387833560.db2.gz JHCQPQBWHCNBRZ-UHFFFAOYSA-N 1 2 243.310 2.430 20 0 BEADLO CC(C)c1nc(NCC[C@@H]2CCCOC2)cc[nH+]1 ZINC000528075311 387835689 /nfs/dbraw/zinc/83/56/89/387835689.db2.gz XLVMORQDHICUDP-LBPRGKRZSA-N 1 2 249.358 2.251 20 0 BEADLO CN(C)c1ccccc1NCc1[nH]cc[nH+]1 ZINC000058930909 387840076 /nfs/dbraw/zinc/84/00/76/387840076.db2.gz JJSPSZMDEBOZLK-UHFFFAOYSA-N 1 2 216.288 2.088 20 0 BEADLO COCC1(C)CN(c2cc(C)[nH+]c(C3CC3)n2)C1 ZINC000432933876 387843466 /nfs/dbraw/zinc/84/34/66/387843466.db2.gz PTNXMCXOPOEBCD-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO COCC1(C)CN(c2cc[nH+]c(C(C)C)n2)C1 ZINC000432927959 387844342 /nfs/dbraw/zinc/84/43/42/387844342.db2.gz PCPONEJQZWMVTF-UHFFFAOYSA-N 1 2 235.331 2.073 20 0 BEADLO CC[C@@H]1CCC[C@@H]1CNC(=O)c1c[nH+]c(C)[nH]1 ZINC000452531382 387849981 /nfs/dbraw/zinc/84/99/81/387849981.db2.gz QLOVILFJUKSFHZ-GHMZBOCLSA-N 1 2 235.331 2.274 20 0 BEADLO CC(C)c1nc(NCC2CC=CC2)cc[nH+]1 ZINC000528116745 387850155 /nfs/dbraw/zinc/85/01/55/387850155.db2.gz WKGJCCBEIMLNIH-UHFFFAOYSA-N 1 2 217.316 2.400 20 0 BEADLO CCO[C@@]1(C)C[C@H]1Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000528152991 387856158 /nfs/dbraw/zinc/85/61/58/387856158.db2.gz BHQYDYPPKPIKBN-RISCZKNCSA-N 1 2 247.342 2.064 20 0 BEADLO Cc1nc(N2CC(Cc3ccco3)C2)cc[nH+]1 ZINC000528155084 387857182 /nfs/dbraw/zinc/85/71/82/387857182.db2.gz DPCPFZCLSCSPRY-UHFFFAOYSA-N 1 2 229.283 2.057 20 0 BEADLO CCCC1(C(=O)NCc2[nH+]ccn2CC)CC1 ZINC000452571503 387861641 /nfs/dbraw/zinc/86/16/41/387861641.db2.gz PFVOURZHHJDOJT-UHFFFAOYSA-N 1 2 235.331 2.100 20 0 BEADLO Cc1cc(N2CCC(F)(F)C[C@H]2C)nc[nH+]1 ZINC000528209496 387871208 /nfs/dbraw/zinc/87/12/08/387871208.db2.gz SCLWRSXKNNRJAT-SECBINFHSA-N 1 2 227.258 2.409 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1C[C@H](C)O[C@H]1C ZINC000528034135 387817921 /nfs/dbraw/zinc/81/79/21/387817921.db2.gz GNZSPLCSUCCVMO-DCAQKATOSA-N 1 2 236.315 2.316 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ncccc1F)c1cnccn1 ZINC000528035974 387817961 /nfs/dbraw/zinc/81/79/61/387817961.db2.gz NBBKBPPEEIAZTJ-ZJUUUORDSA-N 1 2 246.289 2.423 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ncccc1F)c1cn[nH]c1 ZINC000528035304 387818690 /nfs/dbraw/zinc/81/86/90/387818690.db2.gz FWGJKIGBHOJZPR-IUCAKERBSA-N 1 2 234.278 2.356 20 0 BEADLO C[C@H](N[C@@H]1CCn2cc[nH+]c21)c1ncccc1F ZINC000528037048 387818696 /nfs/dbraw/zinc/81/86/96/387818696.db2.gz ANTBGWAHHAXPMI-GXSJLCMTSA-N 1 2 246.289 2.213 20 0 BEADLO C[C@@H]1C[N@H+](CCc2c(F)cccc2F)CCO1 ZINC000645764676 387889616 /nfs/dbraw/zinc/88/96/16/387889616.db2.gz RXTFELXVXOOFDU-SNVBAGLBSA-N 1 2 241.281 2.228 20 0 BEADLO C[C@@H]1C[N@@H+](CCc2c(F)cccc2F)CCO1 ZINC000645764676 387889617 /nfs/dbraw/zinc/88/96/17/387889617.db2.gz RXTFELXVXOOFDU-SNVBAGLBSA-N 1 2 241.281 2.228 20 0 BEADLO O[C@@H](CNc1ccc2ccccc2[nH+]1)C(F)F ZINC000236526193 387894723 /nfs/dbraw/zinc/89/47/23/387894723.db2.gz TVYXNTLBDWAFBZ-JTQLQIEISA-N 1 2 238.237 2.273 20 0 BEADLO C[C@@H]1CCC[C@@H](C(=O)Nc2ccc(N)[nH+]c2)C1 ZINC000151669700 387875422 /nfs/dbraw/zinc/87/54/22/387875422.db2.gz WUSSOXLFDHCXPT-NXEZZACHSA-N 1 2 233.315 2.429 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H]2C[C@@H]2C2CCCCC2)c[nH+]1 ZINC000266597348 387883805 /nfs/dbraw/zinc/88/38/05/387883805.db2.gz RNISHEYURSOWMY-NEPJUHHUSA-N 1 2 247.342 2.417 20 0 BEADLO CCC[N@H+](C)Cc1nc([C@H]2CC[C@@H](C)O2)no1 ZINC000528227798 387884162 /nfs/dbraw/zinc/88/41/62/387884162.db2.gz AHIKVFVASRJRPF-NXEZZACHSA-N 1 2 239.319 2.151 20 0 BEADLO CCC[N@@H+](C)Cc1nc([C@H]2CC[C@@H](C)O2)no1 ZINC000528227798 387884166 /nfs/dbraw/zinc/88/41/66/387884166.db2.gz AHIKVFVASRJRPF-NXEZZACHSA-N 1 2 239.319 2.151 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H]1[C@@H](C)[C@@H]1C1CC1 ZINC000528321322 387901977 /nfs/dbraw/zinc/90/19/77/387901977.db2.gz YJWAMONFDPWPRH-ZEGGKSINSA-N 1 2 246.310 2.321 20 0 BEADLO FC1=CCC[N@H+](CCO[C@H]2CCCCO2)C1 ZINC000444667515 387903843 /nfs/dbraw/zinc/90/38/43/387903843.db2.gz AFNMQVRSEPTPJY-LBPRGKRZSA-N 1 2 229.295 2.089 20 0 BEADLO FC1=CCC[N@@H+](CCO[C@H]2CCCCO2)C1 ZINC000444667515 387903846 /nfs/dbraw/zinc/90/38/46/387903846.db2.gz AFNMQVRSEPTPJY-LBPRGKRZSA-N 1 2 229.295 2.089 20 0 BEADLO COc1ccnc(C[NH2+]Cc2csc(C)c2)n1 ZINC000424187575 387904016 /nfs/dbraw/zinc/90/40/16/387904016.db2.gz JINRCZYQFWCPMI-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO C[N@H+](Cc1ncccc1Cl)[C@@H]1CCCOC1 ZINC000528502439 387906088 /nfs/dbraw/zinc/90/60/88/387906088.db2.gz ABGJCUOZTHZFIT-SNVBAGLBSA-N 1 2 240.734 2.346 20 0 BEADLO C[N@@H+](Cc1ncccc1Cl)[C@@H]1CCCOC1 ZINC000528502439 387906091 /nfs/dbraw/zinc/90/60/91/387906091.db2.gz ABGJCUOZTHZFIT-SNVBAGLBSA-N 1 2 240.734 2.346 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@H](CC(F)(F)F)C2)no1 ZINC000444689474 387911587 /nfs/dbraw/zinc/91/15/87/387911587.db2.gz GECVNEQMRSSJFC-QMMMGPOBSA-N 1 2 249.236 2.152 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)no1 ZINC000444689474 387911590 /nfs/dbraw/zinc/91/15/90/387911590.db2.gz GECVNEQMRSSJFC-QMMMGPOBSA-N 1 2 249.236 2.152 20 0 BEADLO CC(C)c1nc(N2CC[C@@H](O)C(C)(C)C2)cc[nH+]1 ZINC000445619369 387952405 /nfs/dbraw/zinc/95/24/05/387952405.db2.gz RRKJXYVNWKCVSN-LLVKDONJSA-N 1 2 249.358 2.197 20 0 BEADLO Cc1cncc(-c2nc(C[NH+]3CCCC3)no2)c1 ZINC000438723469 387952479 /nfs/dbraw/zinc/95/24/79/387952479.db2.gz LKWQUIKKTCJSQG-UHFFFAOYSA-N 1 2 244.298 2.036 20 0 BEADLO COC(=O)CC1CC(Nc2c[nH+]cc(C)c2)C1 ZINC000424285217 387953564 /nfs/dbraw/zinc/95/35/64/387953564.db2.gz URLJHSKHJTYKMA-UHFFFAOYSA-N 1 2 234.299 2.144 20 0 BEADLO CCc1ccc(C[N@@H+]2C[C@@H](C)OC[C@H]2C)o1 ZINC000245513000 387953597 /nfs/dbraw/zinc/95/35/97/387953597.db2.gz BTLKDFWOYMQXFY-GHMZBOCLSA-N 1 2 223.316 2.451 20 0 BEADLO CCc1ccc(C[N@H+]2C[C@@H](C)OC[C@H]2C)o1 ZINC000245513000 387953600 /nfs/dbraw/zinc/95/36/00/387953600.db2.gz BTLKDFWOYMQXFY-GHMZBOCLSA-N 1 2 223.316 2.451 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)[C@H]1CCn2cc[nH+]c2C1 ZINC000438578411 387945887 /nfs/dbraw/zinc/94/58/87/387945887.db2.gz WLZDZJAMRHMQSX-NEPJUHHUSA-N 1 2 249.358 2.093 20 0 BEADLO COC(=O)CC1CC(Nc2ccc(C)[nH+]c2C)C1 ZINC000424282124 387950909 /nfs/dbraw/zinc/95/09/09/387950909.db2.gz OWKGXTIBWKADCF-UHFFFAOYSA-N 1 2 248.326 2.452 20 0 BEADLO Cc1cc(N2CCC[C@@H]([C@@H]3CCOC3)C2)nc[nH+]1 ZINC000439082637 387978029 /nfs/dbraw/zinc/97/80/29/387978029.db2.gz DRXJBEFFUAMATM-CHWSQXEVSA-N 1 2 247.342 2.038 20 0 BEADLO C[C@H]1C[C@H](C(=O)NCCn2cc[nH+]c2)C[C@@H](C)C1 ZINC000245770272 387982705 /nfs/dbraw/zinc/98/27/05/387982705.db2.gz XDRARPFMHQIBQN-ITGUQSILSA-N 1 2 249.358 2.072 20 0 BEADLO Cc1cnc(C[N@H+]2C[C@H](C)O[C@H](C)[C@H]2C)s1 ZINC000446083997 387998096 /nfs/dbraw/zinc/99/80/96/387998096.db2.gz STTVPYPEMJUVGI-JMJZKYOTSA-N 1 2 240.372 2.449 20 0 BEADLO Cc1cnc(C[N@@H+]2C[C@H](C)O[C@H](C)[C@H]2C)s1 ZINC000446083997 387998098 /nfs/dbraw/zinc/99/80/98/387998098.db2.gz STTVPYPEMJUVGI-JMJZKYOTSA-N 1 2 240.372 2.449 20 0 BEADLO CCOC[C@@H](C)Nc1ccc2c(c1)CC[NH2+]2 ZINC000423217206 388000753 /nfs/dbraw/zinc/00/07/53/388000753.db2.gz PPBJPCMIDVYBLT-SNVBAGLBSA-N 1 2 220.316 2.492 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)Nc1cnn(C)c1C ZINC000453188293 388005306 /nfs/dbraw/zinc/00/53/06/388005306.db2.gz WEWYUJFWLGWBPI-SECBINFHSA-N 1 2 233.319 2.118 20 0 BEADLO COc1ccc(OCc2c[nH+]cn2C)cc1F ZINC000439555313 388009863 /nfs/dbraw/zinc/00/98/63/388009863.db2.gz ALXHXRMEHJCCBJ-UHFFFAOYSA-N 1 2 236.246 2.147 20 0 BEADLO CC(=O)c1cccc(NCc2c[nH+]cn2C)c1 ZINC000439611982 388010831 /nfs/dbraw/zinc/01/08/31/388010831.db2.gz HKEMGFIKAQZOOT-UHFFFAOYSA-N 1 2 229.283 2.235 20 0 BEADLO Cc1nccc(Nc2ccc3c(c2)[nH+]cn3C)n1 ZINC000439700216 388014301 /nfs/dbraw/zinc/01/43/01/388014301.db2.gz RJADZBGCCOXESF-UHFFFAOYSA-N 1 2 239.282 2.415 20 0 BEADLO CC[C@H]([NH2+][C@@H]1CCCc2c1cnn2C)C(F)F ZINC000453233024 388017707 /nfs/dbraw/zinc/01/77/07/388017707.db2.gz GTVNPUNZZMNPBH-VHSXEESVSA-N 1 2 243.301 2.431 20 0 BEADLO CO[C@@H]1C[C@H](Nc2cc[nH+]c(C(C)C)n2)C1(C)C ZINC000440190586 388036001 /nfs/dbraw/zinc/03/60/01/388036001.db2.gz SKVFJYLGCMZEPN-WDEREUQCSA-N 1 2 249.358 2.247 20 0 BEADLO C=Cn1cc(C[N@@H+](C)Cc2ccccn2)cn1 ZINC000446760521 388037833 /nfs/dbraw/zinc/03/78/33/388037833.db2.gz ULWCPVOKLPGBMV-UHFFFAOYSA-N 1 2 228.299 2.011 20 0 BEADLO C=Cn1cc(C[N@H+](C)Cc2ccccn2)cn1 ZINC000446760521 388037834 /nfs/dbraw/zinc/03/78/34/388037834.db2.gz ULWCPVOKLPGBMV-UHFFFAOYSA-N 1 2 228.299 2.011 20 0 BEADLO Fc1cccnc1OCCNc1cccc[nH+]1 ZINC000446889161 388043666 /nfs/dbraw/zinc/04/36/66/388043666.db2.gz SOGKDYXLMULRJH-UHFFFAOYSA-N 1 2 233.246 2.107 20 0 BEADLO CC[NH+](CC)Cc1nn(C)c(C)c1Cl ZINC000421333722 388027014 /nfs/dbraw/zinc/02/70/14/388027014.db2.gz XJXIASGQHJIEEP-UHFFFAOYSA-N 1 2 215.728 2.224 20 0 BEADLO CC[C@H](F)C[N@@H+]1CCN(C)[C@H](C(C)C)C1 ZINC000440521717 388050973 /nfs/dbraw/zinc/05/09/73/388050973.db2.gz XZWUEWPBJPZHAG-RYUDHWBXSA-N 1 2 216.344 2.007 20 0 BEADLO CC[C@H](F)C[N@H+]1CCN(C)[C@H](C(C)C)C1 ZINC000440521717 388050979 /nfs/dbraw/zinc/05/09/79/388050979.db2.gz XZWUEWPBJPZHAG-RYUDHWBXSA-N 1 2 216.344 2.007 20 0 BEADLO Cn1ccnc1C[NH2+][C@@H]1CSc2ccccc21 ZINC000083748768 388060634 /nfs/dbraw/zinc/06/06/34/388060634.db2.gz FBNIQCPHIOMQBR-LLVKDONJSA-N 1 2 245.351 2.357 20 0 BEADLO Cc1cc(C(=O)NCc2c[nH+]c[nH]2)sc1C ZINC000084081575 388070745 /nfs/dbraw/zinc/07/07/45/388070745.db2.gz JXVOYKGXZUMFDZ-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO Cc1cc(C(=O)NCc2c[nH]c[nH+]2)sc1C ZINC000084081575 388070750 /nfs/dbraw/zinc/07/07/50/388070750.db2.gz JXVOYKGXZUMFDZ-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO Cc1ccoc1C[NH2+][C@@H](C)c1nccn1C ZINC000336659220 388082585 /nfs/dbraw/zinc/08/25/85/388082585.db2.gz MVLDTMBTFFVHEM-JTQLQIEISA-N 1 2 219.288 2.172 20 0 BEADLO CCC1CN(Cc2[nH+]ccn2CC(F)(F)F)C1 ZINC000453599127 388089972 /nfs/dbraw/zinc/08/99/72/388089972.db2.gz BMVJMIKRADZJJL-UHFFFAOYSA-N 1 2 247.264 2.287 20 0 BEADLO C=Cn1cc(C[N@H+](C)Cc2ccoc2)cn1 ZINC000447743236 388090367 /nfs/dbraw/zinc/09/03/67/388090367.db2.gz SLNWQOOOZLJVRF-UHFFFAOYSA-N 1 2 217.272 2.209 20 0 BEADLO C=Cn1cc(C[N@@H+](C)Cc2ccoc2)cn1 ZINC000447743236 388090370 /nfs/dbraw/zinc/09/03/70/388090370.db2.gz SLNWQOOOZLJVRF-UHFFFAOYSA-N 1 2 217.272 2.209 20 0 BEADLO CC[C@]1(C(C)C)C[C@@H]1[NH2+]Cc1ccn[nH]1 ZINC000453605566 388091667 /nfs/dbraw/zinc/09/16/67/388091667.db2.gz CXWQIAOQADIFEU-NWDGAFQWSA-N 1 2 207.321 2.324 20 0 BEADLO CC[C@H]([NH2+][C@H]1C[C@@H]1C1CCCCC1)C(=O)OC ZINC000447793764 388092352 /nfs/dbraw/zinc/09/23/52/388092352.db2.gz AHHDUGRJVZPDPU-AGIUHOORSA-N 1 2 239.359 2.496 20 0 BEADLO CC[C@H]([NH2+][C@H]1C[C@H]1C1CCCCC1)C(=O)OC ZINC000447793765 388093027 /nfs/dbraw/zinc/09/30/27/388093027.db2.gz AHHDUGRJVZPDPU-AVGNSLFASA-N 1 2 239.359 2.496 20 0 BEADLO COCCN(Cc1cncs1)c1cccc[nH+]1 ZINC000447816320 388095404 /nfs/dbraw/zinc/09/54/04/388095404.db2.gz ITEXTEGADKYPMU-UHFFFAOYSA-N 1 2 249.339 2.191 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CC[S@](=O)C(CC)(CC)C1 ZINC000440497533 388045479 /nfs/dbraw/zinc/04/54/79/388045479.db2.gz HUXZXRHBNGUPBA-BZNIZROVSA-N 1 2 249.395 2.358 20 0 BEADLO CC[C@@H](F)C[N@H+]1CC[S@](=O)C(CC)(CC)C1 ZINC000440497533 388045484 /nfs/dbraw/zinc/04/54/84/388045484.db2.gz HUXZXRHBNGUPBA-BZNIZROVSA-N 1 2 249.395 2.358 20 0 BEADLO CC[C@@H](F)C[N@H+](CCOC)Cc1cccnc1 ZINC000440517531 388049477 /nfs/dbraw/zinc/04/94/77/388049477.db2.gz IUSWRTSYJWCTKA-CYBMUJFWSA-N 1 2 240.322 2.278 20 0 BEADLO CC[C@@H](F)C[N@@H+](CCOC)Cc1cccnc1 ZINC000440517531 388049482 /nfs/dbraw/zinc/04/94/82/388049482.db2.gz IUSWRTSYJWCTKA-CYBMUJFWSA-N 1 2 240.322 2.278 20 0 BEADLO CC[C@H](F)C[N@@H+]1CCN(C)[C@@H](C(C)C)C1 ZINC000440521715 388050264 /nfs/dbraw/zinc/05/02/64/388050264.db2.gz XZWUEWPBJPZHAG-NWDGAFQWSA-N 1 2 216.344 2.007 20 0 BEADLO CC[C@H](F)C[N@H+]1CCN(C)[C@@H](C(C)C)C1 ZINC000440521715 388050268 /nfs/dbraw/zinc/05/02/68/388050268.db2.gz XZWUEWPBJPZHAG-NWDGAFQWSA-N 1 2 216.344 2.007 20 0 BEADLO Cc1nocc1C[N@H+]1CC[C@H](C)[C@H](F)C1 ZINC000646153309 388157481 /nfs/dbraw/zinc/15/74/81/388157481.db2.gz CXYLAMKBAVHIAN-GZMMTYOYSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1nocc1C[N@@H+]1CC[C@H](C)[C@H](F)C1 ZINC000646153309 388157484 /nfs/dbraw/zinc/15/74/84/388157484.db2.gz CXYLAMKBAVHIAN-GZMMTYOYSA-N 1 2 212.268 2.163 20 0 BEADLO CCC[C@H]([NH2+]CCc1cccc(C)c1)C(=O)OC ZINC000449258524 388163415 /nfs/dbraw/zinc/16/34/15/388163415.db2.gz PQSSAYNITFNNHG-AWEZNQCLSA-N 1 2 249.354 2.469 20 0 BEADLO CCn1ncnc1C[NH2+]Cc1cccc(C)c1F ZINC000449299260 388169428 /nfs/dbraw/zinc/16/94/28/388169428.db2.gz MQVJBDFCLIHLMC-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@]1(C)CCC[C@@H]1C ZINC000456112429 388178529 /nfs/dbraw/zinc/17/85/29/388178529.db2.gz PNBRUPXWOASXRP-SMDDNHRTSA-N 1 2 249.358 2.346 20 0 BEADLO COc1cc(C)ccc1C[N@H+](C1CC1)C1COC1 ZINC000449350307 388178828 /nfs/dbraw/zinc/17/88/28/388178828.db2.gz JVYVHMINDRXQBF-UHFFFAOYSA-N 1 2 247.338 2.367 20 0 BEADLO COc1cc(C)ccc1C[N@@H+](C1CC1)C1COC1 ZINC000449350307 388178831 /nfs/dbraw/zinc/17/88/31/388178831.db2.gz JVYVHMINDRXQBF-UHFFFAOYSA-N 1 2 247.338 2.367 20 0 BEADLO F[C@H]1CC[N@H+](Cc2nc3c(s2)CCC3)C1 ZINC000648721146 388178910 /nfs/dbraw/zinc/17/89/10/388178910.db2.gz RESXNCWNRIWRQY-QMMMGPOBSA-N 1 2 226.320 2.176 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2nc3c(s2)CCC3)C1 ZINC000648721146 388178912 /nfs/dbraw/zinc/17/89/12/388178912.db2.gz RESXNCWNRIWRQY-QMMMGPOBSA-N 1 2 226.320 2.176 20 0 BEADLO CCc1ccc(C[N@H+](C2CC2)C2COC2)cn1 ZINC000449349343 388179099 /nfs/dbraw/zinc/17/90/99/388179099.db2.gz FNHLRZUKKGJQEN-UHFFFAOYSA-N 1 2 232.327 2.007 20 0 BEADLO CCc1ccc(C[N@@H+](C2CC2)C2COC2)cn1 ZINC000449349343 388179100 /nfs/dbraw/zinc/17/91/00/388179100.db2.gz FNHLRZUKKGJQEN-UHFFFAOYSA-N 1 2 232.327 2.007 20 0 BEADLO CCOC1(C)CCN(c2cc(C)[nH+]cn2)CC1 ZINC000488446630 388179594 /nfs/dbraw/zinc/17/95/94/388179594.db2.gz ZZAHPLYKTLAZMF-UHFFFAOYSA-N 1 2 235.331 2.180 20 0 BEADLO C[C@@H]1C[C@H]1CNc1ccc(N2CCCC2)c[nH+]1 ZINC000488446616 388179744 /nfs/dbraw/zinc/17/97/44/388179744.db2.gz UOHDZSQTPZUELS-NEPJUHHUSA-N 1 2 231.343 2.172 20 0 BEADLO CC[C@@H]([NH2+]Cc1nc(C)ccc1O)C(F)F ZINC000449364575 388183360 /nfs/dbraw/zinc/18/33/60/388183360.db2.gz SLNCMUSRZGPIOT-MRVPVSSYSA-N 1 2 230.258 2.229 20 0 BEADLO FCC(CF)[NH2+]Cc1ccc(F)c(F)c1 ZINC000449372496 388185539 /nfs/dbraw/zinc/18/55/39/388185539.db2.gz IMJSVMMTVFWKCU-UHFFFAOYSA-N 1 2 221.197 2.362 20 0 BEADLO COc1ccccc1C[NH2+]C(CF)CF ZINC000449372229 388185560 /nfs/dbraw/zinc/18/55/60/388185560.db2.gz DTBSZZOTPTXXOP-UHFFFAOYSA-N 1 2 215.243 2.092 20 0 BEADLO Cc1cc(C)c(CNC(=O)NCC2(C)CC2)c[nH+]1 ZINC000454597916 388124930 /nfs/dbraw/zinc/12/49/30/388124930.db2.gz SFGZEXWDWQGNRN-UHFFFAOYSA-N 1 2 247.342 2.298 20 0 BEADLO COc1cc(C)ccc1C[N@H+](C)Cc1cc[nH]n1 ZINC000449028068 388131442 /nfs/dbraw/zinc/13/14/42/388131442.db2.gz NPXCBUQMCCXXHP-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1cc(C)ccc1C[N@@H+](C)Cc1cc[nH]n1 ZINC000449028068 388131446 /nfs/dbraw/zinc/13/14/46/388131446.db2.gz NPXCBUQMCCXXHP-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO Cc1nocc1C[N@@H+]1CCC[C@@H](c2ccn[nH]2)C1 ZINC000646063760 388135069 /nfs/dbraw/zinc/13/50/69/388135069.db2.gz HJMZXYIIISRLIH-LLVKDONJSA-N 1 2 246.314 2.086 20 0 BEADLO Cc1nocc1C[N@H+]1CCC[C@@H](c2ccn[nH]2)C1 ZINC000646063760 388135070 /nfs/dbraw/zinc/13/50/70/388135070.db2.gz HJMZXYIIISRLIH-LLVKDONJSA-N 1 2 246.314 2.086 20 0 BEADLO CN(C)c1ccccc1C[NH2+]C(CF)CF ZINC000449377684 388187078 /nfs/dbraw/zinc/18/70/78/388187078.db2.gz BIXJKXXAJDZNRM-UHFFFAOYSA-N 1 2 228.286 2.150 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccon2)CC2(CCCC2)O1 ZINC000646133540 388151208 /nfs/dbraw/zinc/15/12/08/388151208.db2.gz WKTHSWNKKGNSGZ-NSHDSACASA-N 1 2 236.315 2.208 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccon2)CC2(CCCC2)O1 ZINC000646133540 388151209 /nfs/dbraw/zinc/15/12/09/388151209.db2.gz WKTHSWNKKGNSGZ-NSHDSACASA-N 1 2 236.315 2.208 20 0 BEADLO CC(C)(C)c1ncc(C[NH2+]C(CF)CF)cn1 ZINC000449382243 388188846 /nfs/dbraw/zinc/18/88/46/388188846.db2.gz VYINZOMRSZVSMQ-UHFFFAOYSA-N 1 2 243.301 2.171 20 0 BEADLO COCC(C)(C)CNc1cc[nH+]c(C(C)C)n1 ZINC000488698933 388192132 /nfs/dbraw/zinc/19/21/32/388192132.db2.gz HHKALRYLLFERIZ-UHFFFAOYSA-N 1 2 237.347 2.106 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)CC(C)(F)F ZINC000456356432 388196274 /nfs/dbraw/zinc/19/62/74/388196274.db2.gz OUYWRGQROJEZEC-MRVPVSSYSA-N 1 2 245.273 2.126 20 0 BEADLO CC(C)CCC(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456355610 388196332 /nfs/dbraw/zinc/19/63/32/388196332.db2.gz ATQIIZANFIMPBR-MNOVXSKESA-N 1 2 235.331 2.441 20 0 BEADLO CC[C@H](C)C(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456356506 388196897 /nfs/dbraw/zinc/19/68/97/388196897.db2.gz BDVRLNHQALLDOO-AEJSXWLSSA-N 1 2 221.304 2.051 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@H]1C[C@H]1C1CC1 ZINC000456356440 388196943 /nfs/dbraw/zinc/19/69/43/388196943.db2.gz OVYHROFOJNUUIO-DLOVCJGASA-N 1 2 247.342 2.126 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)CC1(C)CC1 ZINC000456348961 388197038 /nfs/dbraw/zinc/19/70/38/388197038.db2.gz IVOLGKDICCMJFP-JTQLQIEISA-N 1 2 235.331 2.270 20 0 BEADLO CCCCC(=O)N[C@H](C)c1[nH+]ccn1CC ZINC000456368802 388197565 /nfs/dbraw/zinc/19/75/65/388197565.db2.gz CRCIVVOAAODOOW-SNVBAGLBSA-N 1 2 223.320 2.270 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456403306 388199315 /nfs/dbraw/zinc/19/93/15/388199315.db2.gz FNLBLUVQZNCQKK-KKOKHZNYSA-N 1 2 247.342 2.441 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@@H]1CC=CCC1 ZINC000456396414 388199471 /nfs/dbraw/zinc/19/94/71/388199471.db2.gz SISKDJORVULQDX-NWDGAFQWSA-N 1 2 247.342 2.437 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)[C@H]2CC2(C)C)c2[nH+]ccn21 ZINC000456421009 388200394 /nfs/dbraw/zinc/20/03/94/388200394.db2.gz NARHJNRFAJWCPB-OPRDCNLKSA-N 1 2 233.315 2.051 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@@H]2C2CC2)c2[nH+]ccn21 ZINC000456420414 388200504 /nfs/dbraw/zinc/20/05/04/388200504.db2.gz MNFSIMAFIOJZRY-HKWIRBFKSA-N 1 2 245.326 2.051 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456426856 388201416 /nfs/dbraw/zinc/20/14/16/388201416.db2.gz QRJOOAKRNQXBOR-ZDCRXTMVSA-N 1 2 233.315 2.051 20 0 BEADLO CCn1c[nH+]cc1CNc1cccc(CCO)c1 ZINC000313166942 256543342 /nfs/dbraw/zinc/54/33/42/256543342.db2.gz TXRKXWBAFOPZAF-UHFFFAOYSA-N 1 2 245.326 2.050 20 0 BEADLO CSCC[N@H+](C)[C@H](C)C(=O)OC(C)(C)C ZINC000162522532 388206381 /nfs/dbraw/zinc/20/63/81/388206381.db2.gz NBEDAUMVNPOESE-SECBINFHSA-N 1 2 233.377 2.011 20 0 BEADLO CSCC[N@@H+](C)[C@H](C)C(=O)OC(C)(C)C ZINC000162522532 388206382 /nfs/dbraw/zinc/20/63/82/388206382.db2.gz NBEDAUMVNPOESE-SECBINFHSA-N 1 2 233.377 2.011 20 0 BEADLO CO[C@@H](C)c1noc(C[N@H+](C)[C@H]2CC2(C)C)n1 ZINC000489467983 388215686 /nfs/dbraw/zinc/21/56/86/388215686.db2.gz WYTJZQUJDBXKGW-IUCAKERBSA-N 1 2 239.319 2.007 20 0 BEADLO CO[C@@H](C)c1noc(C[N@@H+](C)[C@H]2CC2(C)C)n1 ZINC000489467983 388215688 /nfs/dbraw/zinc/21/56/88/388215688.db2.gz WYTJZQUJDBXKGW-IUCAKERBSA-N 1 2 239.319 2.007 20 0 BEADLO Cc1cc(C)c(CNC(=O)Cc2ccoc2)c[nH+]1 ZINC000456830849 388226558 /nfs/dbraw/zinc/22/65/58/388226558.db2.gz DOVXOUCOASJCKS-UHFFFAOYSA-N 1 2 244.294 2.150 20 0 BEADLO Cc1cc(N2CCC[C@@H]2CCO)nc(C2CC2)[nH+]1 ZINC000489996652 388230322 /nfs/dbraw/zinc/23/03/22/388230322.db2.gz XPOSFCLLACZUKR-GFCCVEGCSA-N 1 2 247.342 2.014 20 0 BEADLO C[C@H](NC(=O)C(C)(C)c1c[nH]c[nH+]1)C1CCCC1 ZINC000456898725 388231895 /nfs/dbraw/zinc/23/18/95/388231895.db2.gz SJGLFLJAGQMHII-JTQLQIEISA-N 1 2 249.358 2.382 20 0 BEADLO CC[C@@]1(O)CCN(c2cc(C)[nH+]c(C(C)C)n2)C1 ZINC000490068072 388233028 /nfs/dbraw/zinc/23/30/28/388233028.db2.gz AZBDIUAJDJYTAO-CQSZACIVSA-N 1 2 249.358 2.260 20 0 BEADLO COCCN(Cc1[nH+]ccn1C)c1ccccc1 ZINC000449578412 388236573 /nfs/dbraw/zinc/23/65/73/388236573.db2.gz LVDXRKMGXCBOHK-UHFFFAOYSA-N 1 2 245.326 2.073 20 0 BEADLO Cc1ccccc1C[N@@H+](CC(F)F)C[C@@H](C)O ZINC000449630923 388246070 /nfs/dbraw/zinc/24/60/70/388246070.db2.gz NXBDVDPPLCCNLE-LLVKDONJSA-N 1 2 243.297 2.443 20 0 BEADLO Cc1ccccc1C[N@H+](CC(F)F)C[C@@H](C)O ZINC000449630923 388246073 /nfs/dbraw/zinc/24/60/73/388246073.db2.gz NXBDVDPPLCCNLE-LLVKDONJSA-N 1 2 243.297 2.443 20 0 BEADLO C[C@H](O)C[N@H+](CCc1ccccc1)CC(F)F ZINC000449633921 388247140 /nfs/dbraw/zinc/24/71/40/388247140.db2.gz VJYIOBAUFSSBQN-NSHDSACASA-N 1 2 243.297 2.177 20 0 BEADLO C[C@H](O)C[N@@H+](CCc1ccccc1)CC(F)F ZINC000449633921 388247141 /nfs/dbraw/zinc/24/71/41/388247141.db2.gz VJYIOBAUFSSBQN-NSHDSACASA-N 1 2 243.297 2.177 20 0 BEADLO C[C@@H](O)C[N@H+](CCc1ccccc1)CC(F)F ZINC000449633920 388247188 /nfs/dbraw/zinc/24/71/88/388247188.db2.gz VJYIOBAUFSSBQN-LLVKDONJSA-N 1 2 243.297 2.177 20 0 BEADLO C[C@@H](O)C[N@@H+](CCc1ccccc1)CC(F)F ZINC000449633920 388247190 /nfs/dbraw/zinc/24/71/90/388247190.db2.gz VJYIOBAUFSSBQN-LLVKDONJSA-N 1 2 243.297 2.177 20 0 BEADLO Cc1cnc(C[NH2+]Cc2ccoc2)s1 ZINC000164835749 388248050 /nfs/dbraw/zinc/24/80/50/388248050.db2.gz GBABPSKVFJLOFY-UHFFFAOYSA-N 1 2 208.286 2.334 20 0 BEADLO C[C@@H](O)C[N@H+](CC(F)F)[C@@H]1C=CCCC1 ZINC000451850079 388300219 /nfs/dbraw/zinc/30/02/19/388300219.db2.gz KFAMNMGRBYBUKD-NXEZZACHSA-N 1 2 219.275 2.043 20 0 BEADLO C[C@@H](O)C[N@@H+](CC(F)F)[C@@H]1C=CCCC1 ZINC000451850079 388300220 /nfs/dbraw/zinc/30/02/20/388300220.db2.gz KFAMNMGRBYBUKD-NXEZZACHSA-N 1 2 219.275 2.043 20 0 BEADLO COc1cc[nH+]cc1NC(=O)/C=C/C1CCC1 ZINC000492065597 388333234 /nfs/dbraw/zinc/33/32/34/388333234.db2.gz HWNALKADXNIEDF-AATRIKPKSA-N 1 2 232.283 2.385 20 0 BEADLO CO[C@H](C)CNc1cc[nH+]c2ccncc12 ZINC000276103406 388346883 /nfs/dbraw/zinc/34/68/83/388346883.db2.gz YMYJLLFDJVDMHB-SECBINFHSA-N 1 2 217.272 2.077 20 0 BEADLO Cc1csc(C(=O)NCCCn2cc[nH+]c2)c1 ZINC000293663210 388356777 /nfs/dbraw/zinc/35/67/77/388356777.db2.gz JOGPMHFLLCBDCT-UHFFFAOYSA-N 1 2 249.339 2.073 20 0 BEADLO COc1cccc2c1cc[nH+]c2N(C)C[C@@H](C)O ZINC000234904706 388363266 /nfs/dbraw/zinc/36/32/66/388363266.db2.gz SHORGMWHIWRIKJ-SNVBAGLBSA-N 1 2 246.310 2.060 20 0 BEADLO C[C@@H](CC(=O)N1C[C@@H](C)[C@H](C)[C@H]1C)n1cc[nH+]c1 ZINC000573005364 388405367 /nfs/dbraw/zinc/40/53/67/388405367.db2.gz NABPLNVNGHMWIZ-MROQNXINSA-N 1 2 249.358 2.337 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1cn(C(C)C)nn1 ZINC000291739006 388377742 /nfs/dbraw/zinc/37/77/42/388377742.db2.gz ORDUDWCNDOIKOJ-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO CC[C@H]([NH3+])C(=O)N[C@H]1CCC(C)(C)C[C@@H]1C ZINC000236945631 388386640 /nfs/dbraw/zinc/38/66/40/388386640.db2.gz YRDCCNIYETVAHV-DCAQKATOSA-N 1 2 226.364 2.055 20 0 BEADLO CSCc1cnc(C[NH2+][C@H](C)CF)s1 ZINC000293070075 388386770 /nfs/dbraw/zinc/38/67/70/388386770.db2.gz VIYSWIYPQDSTSQ-SSDOTTSWSA-N 1 2 234.365 2.454 20 0 BEADLO c1cn2c([nH+]1)[C@@H](Nc1ccc3c(c1)OCO3)CC2 ZINC000294076439 388394368 /nfs/dbraw/zinc/39/43/68/388394368.db2.gz LFERLIOXDHTAMK-JTQLQIEISA-N 1 2 243.266 2.169 20 0 BEADLO Cc1cc(N2CC[C@H](c3cccnc3)C2)nc[nH+]1 ZINC000572956071 388397644 /nfs/dbraw/zinc/39/76/44/388397644.db2.gz KLQKXAJZQJWKBC-ZDUSSCGKSA-N 1 2 240.310 2.174 20 0 BEADLO CCc1cc(NCc2cc(C)ccn2)nc[nH+]1 ZINC000328084405 388401040 /nfs/dbraw/zinc/40/10/40/388401040.db2.gz HIGVVJWZKMMMKI-UHFFFAOYSA-N 1 2 228.299 2.355 20 0 BEADLO Cc1nocc1C[N@@H+](C)Cc1cccc(O)c1 ZINC000572979868 388402324 /nfs/dbraw/zinc/40/23/24/388402324.db2.gz LWBGBYGVXJWCEL-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO Cc1nocc1C[N@H+](C)Cc1cccc(O)c1 ZINC000572979868 388402325 /nfs/dbraw/zinc/40/23/25/388402325.db2.gz LWBGBYGVXJWCEL-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO COC(=O)[C@@H]1CCC[N@@H+]1Cc1csc(C)c1 ZINC000294553956 388402375 /nfs/dbraw/zinc/40/23/75/388402375.db2.gz LGTPFSJYIYCQNJ-NSHDSACASA-N 1 2 239.340 2.194 20 0 BEADLO COC(=O)[C@@H]1CCC[N@H+]1Cc1csc(C)c1 ZINC000294553956 388402376 /nfs/dbraw/zinc/40/23/76/388402376.db2.gz LGTPFSJYIYCQNJ-NSHDSACASA-N 1 2 239.340 2.194 20 0 BEADLO Cc1csc(C[N@H+]2C[C@H](C)OC(C)(C)C2)n1 ZINC000173203370 388338672 /nfs/dbraw/zinc/33/86/72/388338672.db2.gz RDQISILDVLPGFI-JTQLQIEISA-N 1 2 240.372 2.451 20 0 BEADLO Cc1csc(C[N@@H+]2C[C@H](C)OC(C)(C)C2)n1 ZINC000173203370 388338673 /nfs/dbraw/zinc/33/86/73/388338673.db2.gz RDQISILDVLPGFI-JTQLQIEISA-N 1 2 240.372 2.451 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)NC(C)(C)CC ZINC000492270372 388339858 /nfs/dbraw/zinc/33/98/58/388339858.db2.gz DQHQQJFPPUUDNT-FPLPWBNLSA-N 1 2 235.331 2.221 20 0 BEADLO COc1ccc(N[C@H](C)C(C)(C)OC)[nH+]c1 ZINC000378667540 388480502 /nfs/dbraw/zinc/48/05/02/388480502.db2.gz HLCIZUJEXZKASQ-SECBINFHSA-N 1 2 224.304 2.316 20 0 BEADLO CC(C)n1nccc1C[NH2+]Cc1ncccc1F ZINC000525998373 388453419 /nfs/dbraw/zinc/45/34/19/388453419.db2.gz NQACGLZMPGOQIE-UHFFFAOYSA-N 1 2 248.305 2.288 20 0 BEADLO C[N@@H+](Cc1ccsc1)Cc1cnns1 ZINC000649231598 388463277 /nfs/dbraw/zinc/46/32/77/388463277.db2.gz QNAZHXXPGIZALN-UHFFFAOYSA-N 1 2 225.342 2.232 20 0 BEADLO C[N@H+](Cc1ccsc1)Cc1cnns1 ZINC000649231598 388463280 /nfs/dbraw/zinc/46/32/80/388463280.db2.gz QNAZHXXPGIZALN-UHFFFAOYSA-N 1 2 225.342 2.232 20 0 BEADLO FC1(F)CCCC[C@@H]1C[NH2+]Cc1ccn[nH]1 ZINC000295120671 388409044 /nfs/dbraw/zinc/40/90/44/388409044.db2.gz NDEJWNMMRZTQEO-SECBINFHSA-N 1 2 229.274 2.325 20 0 BEADLO COc1ncccc1C[NH2+]Cc1ncc(C)s1 ZINC000295920105 388416094 /nfs/dbraw/zinc/41/60/94/388416094.db2.gz BOJIZNMVKDMLDX-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO CO[C@@H](C)c1noc(C[N@@H+]2CCCC[C@@H]2C)n1 ZINC000245479741 388419856 /nfs/dbraw/zinc/41/98/56/388419856.db2.gz WPQHNULQTOTSHQ-UWVGGRQHSA-N 1 2 239.319 2.151 20 0 BEADLO CO[C@@H](C)c1noc(C[N@H+]2CCCC[C@@H]2C)n1 ZINC000245479741 388419860 /nfs/dbraw/zinc/41/98/60/388419860.db2.gz WPQHNULQTOTSHQ-UWVGGRQHSA-N 1 2 239.319 2.151 20 0 BEADLO CCC[C@H]([NH2+]C[C@](C)(CC)OC)C(=O)OCC ZINC000322578546 388439250 /nfs/dbraw/zinc/43/92/50/388439250.db2.gz CFPJJWDSXBIDDA-AAEUAGOBSA-N 1 2 245.363 2.123 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N(C)C3CCC3)ccn12 ZINC000516490495 256776271 /nfs/dbraw/zinc/77/62/71/256776271.db2.gz RTOMJKPAORHRCZ-UHFFFAOYSA-N 1 2 243.310 2.267 20 0 BEADLO F[C@H]1CC[N@H+](Cc2ncccc2Cl)C1 ZINC000528518030 388541160 /nfs/dbraw/zinc/54/11/60/388541160.db2.gz QSBWLVJOFTXYNS-QMMMGPOBSA-N 1 2 214.671 2.279 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2ncccc2Cl)C1 ZINC000528518030 388541162 /nfs/dbraw/zinc/54/11/62/388541162.db2.gz QSBWLVJOFTXYNS-QMMMGPOBSA-N 1 2 214.671 2.279 20 0 BEADLO Cc1cnccc1C[N@@H+]1CCC(=O)CC12CCC2 ZINC000528525001 388542294 /nfs/dbraw/zinc/54/22/94/388542294.db2.gz SFODLHGGUPEBGU-UHFFFAOYSA-N 1 2 244.338 2.478 20 0 BEADLO Cc1cnccc1C[N@H+]1CCC(=O)CC12CCC2 ZINC000528525001 388542296 /nfs/dbraw/zinc/54/22/96/388542296.db2.gz SFODLHGGUPEBGU-UHFFFAOYSA-N 1 2 244.338 2.478 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2[C@H](C)[C@H]2C2CC2)cc[nH+]1 ZINC000528533342 388544287 /nfs/dbraw/zinc/54/42/87/388544287.db2.gz JHFQRZNXLDPORT-JIMOISOXSA-N 1 2 230.311 2.043 20 0 BEADLO CCc1cnc(C[N@H+]2CC=C(COC)CC2)o1 ZINC000548497119 388544574 /nfs/dbraw/zinc/54/45/74/388544574.db2.gz ZJCHQVDQFPSZIC-UHFFFAOYSA-N 1 2 236.315 2.016 20 0 BEADLO CCc1cnc(C[N@@H+]2CC=C(COC)CC2)o1 ZINC000548497119 388544577 /nfs/dbraw/zinc/54/45/77/388544577.db2.gz ZJCHQVDQFPSZIC-UHFFFAOYSA-N 1 2 236.315 2.016 20 0 BEADLO CN(C)c1[nH+]cccc1N(C)C(=O)CC1CCC1 ZINC000079726316 388545422 /nfs/dbraw/zinc/54/54/22/388545422.db2.gz OVSICRGJJLKYFL-UHFFFAOYSA-N 1 2 247.342 2.301 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@H]2CCC[C@H](C)C2)no1 ZINC000079872532 388548013 /nfs/dbraw/zinc/54/80/13/388548013.db2.gz AFBHZJKCEYYVRU-ONGXEEELSA-N 1 2 223.320 2.389 20 0 BEADLO Cc1nc(C[N@H+](C)[C@H]2CCC[C@H](C)C2)no1 ZINC000079872532 388548015 /nfs/dbraw/zinc/54/80/15/388548015.db2.gz AFBHZJKCEYYVRU-ONGXEEELSA-N 1 2 223.320 2.389 20 0 BEADLO CC1(C)CCC[C@H]1C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000547801030 388484494 /nfs/dbraw/zinc/48/44/94/388484494.db2.gz QRODSUPNMUBWTF-LBPRGKRZSA-N 1 2 247.342 2.093 20 0 BEADLO CC(C)C1([NH2+]CC(=O)OC(C)(C)C)CC1 ZINC000339518765 388485391 /nfs/dbraw/zinc/48/53/91/388485391.db2.gz OLYGDPSRROFNIZ-UHFFFAOYSA-N 1 2 213.321 2.106 20 0 BEADLO CC[C@H]([NH2+]Cc1n[nH]c(=O)[nH]1)c1ccc(C)cc1 ZINC000341030923 388494514 /nfs/dbraw/zinc/49/45/14/388494514.db2.gz BPCRMWHKKIHRAE-NSHDSACASA-N 1 2 246.314 2.060 20 0 BEADLO C[C@H]1CC[C@@H](C(=O)NC(C)(C)c2[nH]cc[nH+]2)C1 ZINC000517380663 388548913 /nfs/dbraw/zinc/54/89/13/388548913.db2.gz DBADIYLQVLAMGR-VHSXEESVSA-N 1 2 235.331 2.197 20 0 BEADLO CC[C@]1(C)C[N@H+](Cc2nc(C)c(C)o2)CCO1 ZINC000135589717 388501823 /nfs/dbraw/zinc/50/18/23/388501823.db2.gz ZRWFAEZVRVSGLU-CYBMUJFWSA-N 1 2 238.331 2.292 20 0 BEADLO CC[C@]1(C)C[N@@H+](Cc2nc(C)c(C)o2)CCO1 ZINC000135589717 388501825 /nfs/dbraw/zinc/50/18/25/388501825.db2.gz ZRWFAEZVRVSGLU-CYBMUJFWSA-N 1 2 238.331 2.292 20 0 BEADLO CCCCN(CC)C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000520835031 388519663 /nfs/dbraw/zinc/51/96/63/388519663.db2.gz VTWIYXSZBFLKHN-LLVKDONJSA-N 1 2 237.347 2.237 20 0 BEADLO CCCCN(CC)C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000520835031 388519666 /nfs/dbraw/zinc/51/96/66/388519666.db2.gz VTWIYXSZBFLKHN-LLVKDONJSA-N 1 2 237.347 2.237 20 0 BEADLO C/C(Cl)=C/C[N@H+]1CCC[C@@H]1c1nncn1C ZINC000528428309 388524050 /nfs/dbraw/zinc/52/40/50/388524050.db2.gz DIEGJLGYNFUBNG-HYHWUIIZSA-N 1 2 240.738 2.095 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1CCC[C@@H]1c1nncn1C ZINC000528428309 388524052 /nfs/dbraw/zinc/52/40/52/388524052.db2.gz DIEGJLGYNFUBNG-HYHWUIIZSA-N 1 2 240.738 2.095 20 0 BEADLO C/C(Cl)=C\C[NH2+][C@@H](C)c1nnc(C)o1 ZINC000528450360 388527948 /nfs/dbraw/zinc/52/79/48/388527948.db2.gz KTIBCAMXKPIAGB-KNIZRNDPSA-N 1 2 215.684 2.171 20 0 BEADLO CC[C@H]1C(=O)N(CC)CC[N@H+]1C/C=C(\C)Cl ZINC000528463209 388529876 /nfs/dbraw/zinc/52/98/76/388529876.db2.gz GTGUZZYMVJWBBQ-RUYJGKKWSA-N 1 2 244.766 2.072 20 0 BEADLO CC[C@H]1C(=O)N(CC)CC[N@@H+]1C/C=C(\C)Cl ZINC000528463209 388529877 /nfs/dbraw/zinc/52/98/77/388529877.db2.gz GTGUZZYMVJWBBQ-RUYJGKKWSA-N 1 2 244.766 2.072 20 0 BEADLO CC[C@@H]1C(=O)N(CC)CC[N@H+]1C/C=C(/C)Cl ZINC000528463211 388529935 /nfs/dbraw/zinc/52/99/35/388529935.db2.gz GTGUZZYMVJWBBQ-SDKXAQGSSA-N 1 2 244.766 2.072 20 0 BEADLO CC[C@@H]1C(=O)N(CC)CC[N@@H+]1C/C=C(/C)Cl ZINC000528463211 388529936 /nfs/dbraw/zinc/52/99/36/388529936.db2.gz GTGUZZYMVJWBBQ-SDKXAQGSSA-N 1 2 244.766 2.072 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1CCC(=O)[C@@H](C)C1 ZINC000528462356 388530194 /nfs/dbraw/zinc/53/01/94/388530194.db2.gz WQDNZYYQFAQEAW-FVKOELHVSA-N 1 2 201.697 2.040 20 0 BEADLO C/C(Cl)=C\C[N@H+]1CCC(=O)[C@@H](C)C1 ZINC000528462356 388530196 /nfs/dbraw/zinc/53/01/96/388530196.db2.gz WQDNZYYQFAQEAW-FVKOELHVSA-N 1 2 201.697 2.040 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1CCOC[C@H]1CC(F)F ZINC000528502939 388536745 /nfs/dbraw/zinc/53/67/45/388536745.db2.gz JJQVPSRBQGCNDF-YPNJUMGQSA-N 1 2 239.693 2.485 20 0 BEADLO C/C(Cl)=C\C[N@H+]1CCOC[C@H]1CC(F)F ZINC000528502939 388536748 /nfs/dbraw/zinc/53/67/48/388536748.db2.gz JJQVPSRBQGCNDF-YPNJUMGQSA-N 1 2 239.693 2.485 20 0 BEADLO Cc1[nH]c(C(=O)NCC[C@@H]2CC=CCC2)c[nH+]1 ZINC000529868405 388594388 /nfs/dbraw/zinc/59/43/88/388594388.db2.gz MZKGDKZFYAPTSS-LLVKDONJSA-N 1 2 233.315 2.194 20 0 BEADLO c1cc(C[N@H+]2CCOC[C@H]2CC2CCC2)on1 ZINC000550140277 388600882 /nfs/dbraw/zinc/60/08/82/388600882.db2.gz BCPHTNMLVARCKD-GFCCVEGCSA-N 1 2 236.315 2.066 20 0 BEADLO c1cc(C[N@@H+]2CCOC[C@H]2CC2CCC2)on1 ZINC000550140277 388600884 /nfs/dbraw/zinc/60/08/84/388600884.db2.gz BCPHTNMLVARCKD-GFCCVEGCSA-N 1 2 236.315 2.066 20 0 BEADLO CC[C@H](F)C[N@@H+]1CC2CC1(c1nc(C)no1)C2 ZINC000528619329 388552517 /nfs/dbraw/zinc/55/25/17/388552517.db2.gz VVVWXJLNRLEFKZ-YZRBJQDESA-N 1 2 239.294 2.047 20 0 BEADLO CC[C@H](F)C[N@H+]1CC2CC1(c1nc(C)no1)C2 ZINC000528619329 388552520 /nfs/dbraw/zinc/55/25/20/388552520.db2.gz VVVWXJLNRLEFKZ-YZRBJQDESA-N 1 2 239.294 2.047 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N[C@@H]1CCC[C@H]1C ZINC000136950408 388552878 /nfs/dbraw/zinc/55/28/78/388552878.db2.gz JQVBOTGJCRXPPS-IDDPWSFUSA-N 1 2 247.342 2.221 20 0 BEADLO CC[C@H](C)CN(C)C(=O)/C=C/c1[nH+]ccn1CC ZINC000137027210 388555217 /nfs/dbraw/zinc/55/52/17/388555217.db2.gz UBBPRQRLVNKIQJ-GUOLPTJISA-N 1 2 249.358 2.421 20 0 BEADLO c1nc(C[NH2+][C@@H](c2ccccn2)C2CCC2)c[nH]1 ZINC000528656763 388555993 /nfs/dbraw/zinc/55/59/93/388555993.db2.gz HHPWRSSPVYBUKT-CQSZACIVSA-N 1 2 242.326 2.436 20 0 BEADLO COC(=O)[C@](C)([NH2+]Cc1ccc(C)cc1)C1CC1 ZINC000517707385 388556895 /nfs/dbraw/zinc/55/68/95/388556895.db2.gz GYLDTXNZAAWLPM-OAHLLOKOSA-N 1 2 247.338 2.426 20 0 BEADLO C[C@@H](CC(=O)N[C@H]1CC12CCCC2)n1cc[nH+]c1 ZINC000521055104 388560876 /nfs/dbraw/zinc/56/08/76/388560876.db2.gz WFBOPMUHWGFGOU-RYUDHWBXSA-N 1 2 247.342 2.283 20 0 BEADLO Cc1c[nH+]c(C)nc1NC[C@H]1CCC(F)(F)C1 ZINC000521068355 388562213 /nfs/dbraw/zinc/56/22/13/388562213.db2.gz VQRNTUNULKPPPS-JTQLQIEISA-N 1 2 241.285 2.363 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C[C@@H](C)c1ccco1 ZINC000528739866 388565173 /nfs/dbraw/zinc/56/51/73/388565173.db2.gz BRAPGQXGCKNKOJ-SECBINFHSA-N 1 2 247.298 2.121 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C[C@H](C)c1ccco1 ZINC000528739868 388565331 /nfs/dbraw/zinc/56/53/31/388565331.db2.gz BRAPGQXGCKNKOJ-VIFPVBQESA-N 1 2 247.298 2.121 20 0 BEADLO Cc1nnc(C[N@H+]2CCC(F)(F)C[C@@H]2C)s1 ZINC000528767136 388569626 /nfs/dbraw/zinc/56/96/26/388569626.db2.gz FPNKKBSCNHYTOY-ZETCQYMHSA-N 1 2 247.314 2.466 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC(F)(F)C[C@@H]2C)s1 ZINC000528767136 388569629 /nfs/dbraw/zinc/56/96/29/388569629.db2.gz FPNKKBSCNHYTOY-ZETCQYMHSA-N 1 2 247.314 2.466 20 0 BEADLO Cc1nnc(C[N@H+]2CCC(F)(F)C[C@H]2C)s1 ZINC000528767130 388570134 /nfs/dbraw/zinc/57/01/34/388570134.db2.gz FPNKKBSCNHYTOY-SSDOTTSWSA-N 1 2 247.314 2.466 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC(F)(F)C[C@H]2C)s1 ZINC000528767130 388570137 /nfs/dbraw/zinc/57/01/37/388570137.db2.gz FPNKKBSCNHYTOY-SSDOTTSWSA-N 1 2 247.314 2.466 20 0 BEADLO C[C@@H](C[N@H+](C)Cc1cn[nH]n1)C1CCCCC1 ZINC000528774064 388571819 /nfs/dbraw/zinc/57/18/19/388571819.db2.gz PLXIZRDALXLMNO-NSHDSACASA-N 1 2 236.363 2.453 20 0 BEADLO CCC[C@H]([NH2+]CC(F)(F)CO)c1cccnc1 ZINC000184705236 388582209 /nfs/dbraw/zinc/58/22/09/388582209.db2.gz GLWBSBJPOAWYFD-NSHDSACASA-N 1 2 244.285 2.140 20 0 BEADLO C[C@H](Cc1ccc(O)cc1)Nc1c[nH]c[nH+]1 ZINC000552214809 388682075 /nfs/dbraw/zinc/68/20/75/388682075.db2.gz LVJRLDUQMRRXNX-SECBINFHSA-N 1 2 217.272 2.158 20 0 BEADLO C[C@@H]1CC[C@H]1[NH2+][C@@H](c1cccs1)c1nnc[nH]1 ZINC000551201106 388623501 /nfs/dbraw/zinc/62/35/01/388623501.db2.gz PKAQLYIBOVZWHN-KKZNHRDASA-N 1 2 248.355 2.344 20 0 BEADLO CC(C)[N@H+](CCOCC(F)F)CC(F)F ZINC000189573524 388638454 /nfs/dbraw/zinc/63/84/54/388638454.db2.gz ZWTZKEQLAODYGX-UHFFFAOYSA-N 1 2 231.233 2.244 20 0 BEADLO CC(C)[N@@H+](CCOCC(F)F)CC(F)F ZINC000189573524 388638456 /nfs/dbraw/zinc/63/84/56/388638456.db2.gz ZWTZKEQLAODYGX-UHFFFAOYSA-N 1 2 231.233 2.244 20 0 BEADLO C[C@H]1CCCCN1C(=O)CCCn1cc[nH+]c1 ZINC000620409290 388646744 /nfs/dbraw/zinc/64/67/44/388646744.db2.gz KZTXJWWOPJDEMM-LBPRGKRZSA-N 1 2 235.331 2.064 20 0 BEADLO CC(C)c1nc(N2CCC[C@H]2C[C@H](C)O)cc[nH+]1 ZINC000246842512 388654268 /nfs/dbraw/zinc/65/42/68/388654268.db2.gz VHECGHRPKJQVCI-RYUDHWBXSA-N 1 2 249.358 2.340 20 0 BEADLO CC[C@@H](C(=O)OC)[N@H+](C)Cc1ccc(F)cc1 ZINC000194560551 388735344 /nfs/dbraw/zinc/73/53/44/388735344.db2.gz PTLNNUGBCCZSDE-LBPRGKRZSA-N 1 2 239.290 2.209 20 0 BEADLO CC[C@@H](C(=O)OC)[N@@H+](C)Cc1ccc(F)cc1 ZINC000194560551 388735348 /nfs/dbraw/zinc/73/53/48/388735348.db2.gz PTLNNUGBCCZSDE-LBPRGKRZSA-N 1 2 239.290 2.209 20 0 BEADLO COc1ccc(CNc2[nH+]cccc2OC)cn1 ZINC000128036261 388736290 /nfs/dbraw/zinc/73/62/90/388736290.db2.gz VRTCZCIMMZOEIL-UHFFFAOYSA-N 1 2 245.282 2.106 20 0 BEADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2ncc[nH]2)o1 ZINC000067670396 388737286 /nfs/dbraw/zinc/73/72/86/388737286.db2.gz WKPNPZFPLSTAOS-GXSJLCMTSA-N 1 2 231.299 2.416 20 0 BEADLO C[C@H]1C[C@H]1c1ccc(CNCc2[nH]cc[nH+]2)o1 ZINC000067670396 388737287 /nfs/dbraw/zinc/73/72/87/388737287.db2.gz WKPNPZFPLSTAOS-GXSJLCMTSA-N 1 2 231.299 2.416 20 0 BEADLO CN(CCC(C)(C)C)C(=O)CCc1c[nH+]c[nH]1 ZINC000649027965 388739951 /nfs/dbraw/zinc/73/99/51/388739951.db2.gz GWMRZIMBEVPFEN-UHFFFAOYSA-N 1 2 237.347 2.237 20 0 BEADLO CN(CCC(C)(C)C)C(=O)CCc1c[nH]c[nH+]1 ZINC000649027965 388739954 /nfs/dbraw/zinc/73/99/54/388739954.db2.gz GWMRZIMBEVPFEN-UHFFFAOYSA-N 1 2 237.347 2.237 20 0 BEADLO CN(C(=O)CCn1cc[nH+]c1)c1ccc(F)cc1 ZINC000522271488 388743246 /nfs/dbraw/zinc/74/32/46/388743246.db2.gz PRAMMMDKRYUTOB-UHFFFAOYSA-N 1 2 247.273 2.075 20 0 BEADLO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2ccoc2)[nH]1 ZINC000539063365 388745976 /nfs/dbraw/zinc/74/59/76/388745976.db2.gz BPZMXGVDYRDHQB-RKDXNWHRSA-N 1 2 234.303 2.372 20 0 BEADLO CC[C@H](C)NC(=O)C[N@H+](C)[C@@H](C)c1ccco1 ZINC000194982495 388747564 /nfs/dbraw/zinc/74/75/64/388747564.db2.gz OFQBARGEOYARSQ-QWRGUYRKSA-N 1 2 238.331 2.187 20 0 BEADLO CC[C@H](C)NC(=O)C[N@@H+](C)[C@@H](C)c1ccco1 ZINC000194982495 388747567 /nfs/dbraw/zinc/74/75/67/388747567.db2.gz OFQBARGEOYARSQ-QWRGUYRKSA-N 1 2 238.331 2.187 20 0 BEADLO CCC[C@H](C)[N@@H+]1CCC(C)(C)S(=O)(=O)CC1 ZINC000192850237 388686871 /nfs/dbraw/zinc/68/68/71/388686871.db2.gz BCBYAVROVJPQRW-NSHDSACASA-N 1 2 247.404 2.074 20 0 BEADLO CCC[C@H](C)[N@H+]1CCC(C)(C)S(=O)(=O)CC1 ZINC000192850237 388686874 /nfs/dbraw/zinc/68/68/74/388686874.db2.gz BCBYAVROVJPQRW-NSHDSACASA-N 1 2 247.404 2.074 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@@H](c1cccnc1)C1CC1 ZINC000538420291 388690302 /nfs/dbraw/zinc/69/03/02/388690302.db2.gz LENZZHLKXVZHTP-CQSZACIVSA-N 1 2 242.326 2.354 20 0 BEADLO Cc1cc(C[N@H+](C)CCOC(C)(C)C)no1 ZINC000065950320 388706426 /nfs/dbraw/zinc/70/64/26/388706426.db2.gz LDSLSUSBKBPBIM-UHFFFAOYSA-N 1 2 226.320 2.230 20 0 BEADLO Cc1cc(C[N@@H+](C)CCOC(C)(C)C)no1 ZINC000065950320 388706429 /nfs/dbraw/zinc/70/64/29/388706429.db2.gz LDSLSUSBKBPBIM-UHFFFAOYSA-N 1 2 226.320 2.230 20 0 BEADLO CC(C)c1cc(C(=O)N[C@H](C)c2[nH]cc[nH+]2)on1 ZINC000552557400 388726090 /nfs/dbraw/zinc/72/60/90/388726090.db2.gz DDGCLXHDIPOFFO-MRVPVSSYSA-N 1 2 248.286 2.012 20 0 BEADLO COc1ccc[nH+]c1NC[C@H](O)CC(C)(C)C ZINC000226128304 388732326 /nfs/dbraw/zinc/73/23/26/388732326.db2.gz YMONZROPPVFKRV-SNVBAGLBSA-N 1 2 238.331 2.299 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1nc(C)cs1 ZINC000088600061 388732611 /nfs/dbraw/zinc/73/26/11/388732611.db2.gz HUXINRAHNHRISP-JTQLQIEISA-N 1 2 226.345 2.062 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1nc(C)cs1 ZINC000088600061 388732613 /nfs/dbraw/zinc/73/26/13/388732613.db2.gz HUXINRAHNHRISP-JTQLQIEISA-N 1 2 226.345 2.062 20 0 BEADLO CCC[C@H](C)N(C)C(=O)[C@@H]1CCc2c[nH+]cn2C1 ZINC000553313337 388762310 /nfs/dbraw/zinc/76/23/10/388762310.db2.gz HTMOEDYWYBXVRE-NWDGAFQWSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H]2CSC[C@@H]2C)[nH+]1 ZINC000553678515 388786952 /nfs/dbraw/zinc/78/69/52/388786952.db2.gz FCANZMWCOYSCDD-OIBJUYFYSA-N 1 2 248.355 2.430 20 0 BEADLO Cn1cc[nH+]c1CN[C@@H](C(C)(C)C)C(F)(F)F ZINC000540917847 388826616 /nfs/dbraw/zinc/82/66/16/388826616.db2.gz IUFOYGYINUIEBN-VIFPVBQESA-N 1 2 249.280 2.487 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)[C@@H]1C[C@H]1CC(C)(C)C ZINC000648768083 388853208 /nfs/dbraw/zinc/85/32/08/388853208.db2.gz PAYKDXZPLWTYHW-WDEREUQCSA-N 1 2 249.358 2.109 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)[C@@H]1C[C@H]1CC(C)(C)C ZINC000648776162 388862635 /nfs/dbraw/zinc/86/26/35/388862635.db2.gz NTOVQDGYUNPRMA-WDEREUQCSA-N 1 2 249.358 2.440 20 0 BEADLO CC(C)OC(=O)[C@@H](C)[N@H+](C)CCOC(C)(C)C ZINC000129782680 388870776 /nfs/dbraw/zinc/87/07/76/388870776.db2.gz CQLOICJGJUQRPZ-LLVKDONJSA-N 1 2 245.363 2.073 20 0 BEADLO CC(C)OC(=O)[C@@H](C)[N@@H+](C)CCOC(C)(C)C ZINC000129782680 388870779 /nfs/dbraw/zinc/87/07/79/388870779.db2.gz CQLOICJGJUQRPZ-LLVKDONJSA-N 1 2 245.363 2.073 20 0 BEADLO CCCCOCC[N@H+](C)[C@H](C)C(=O)OC(C)C ZINC000129808740 388871115 /nfs/dbraw/zinc/87/11/15/388871115.db2.gz XGPXBGJHCKWPGI-GFCCVEGCSA-N 1 2 245.363 2.075 20 0 BEADLO CCCCOCC[N@@H+](C)[C@H](C)C(=O)OC(C)C ZINC000129808740 388871116 /nfs/dbraw/zinc/87/11/16/388871116.db2.gz XGPXBGJHCKWPGI-GFCCVEGCSA-N 1 2 245.363 2.075 20 0 BEADLO CCC1CCC(CNC(=O)Cn2cc[nH+]c2)CC1 ZINC000564436862 388875776 /nfs/dbraw/zinc/87/57/76/388875776.db2.gz HAUKQZZZWUJGAQ-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO F[C@@H]1C[N@@H+](C[C@@H]2CCC3(CCCC3)O2)C[C@@H]1F ZINC000565286248 388934513 /nfs/dbraw/zinc/93/45/13/388934513.db2.gz MBPSKTFVKPFQNV-SDDRHHMPSA-N 1 2 245.313 2.470 20 0 BEADLO F[C@@H]1C[N@H+](C[C@@H]2CCC3(CCCC3)O2)C[C@@H]1F ZINC000565286248 388934517 /nfs/dbraw/zinc/93/45/17/388934517.db2.gz MBPSKTFVKPFQNV-SDDRHHMPSA-N 1 2 245.313 2.470 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1CCCSC1 ZINC000565610014 388958681 /nfs/dbraw/zinc/95/86/81/388958681.db2.gz TWPCVTALASGLGS-SNVBAGLBSA-N 1 2 223.345 2.401 20 0 BEADLO Cc1nnsc1C[N@H+](C)[C@H](C)c1ccncc1 ZINC000565930229 388979144 /nfs/dbraw/zinc/97/91/44/388979144.db2.gz GXBKQAAETLJGTH-SNVBAGLBSA-N 1 2 248.355 2.435 20 0 BEADLO Cc1nnsc1C[N@@H+](C)[C@H](C)c1ccncc1 ZINC000565930229 388979142 /nfs/dbraw/zinc/97/91/42/388979142.db2.gz GXBKQAAETLJGTH-SNVBAGLBSA-N 1 2 248.355 2.435 20 0 BEADLO Cc1c(Cl)c(C[N@@H+]2CCC2(C)C)nn1C ZINC000566076931 388986475 /nfs/dbraw/zinc/98/64/75/388986475.db2.gz OBSYSPMHSRSTHA-UHFFFAOYSA-N 1 2 227.739 2.366 20 0 BEADLO Cc1c(Cl)c(C[N@H+]2CCC2(C)C)nn1C ZINC000566076931 388986477 /nfs/dbraw/zinc/98/64/77/388986477.db2.gz OBSYSPMHSRSTHA-UHFFFAOYSA-N 1 2 227.739 2.366 20 0 BEADLO CC[N@@H+](CCOC)C/C(Cl)=C/Cl ZINC000268701602 389003050 /nfs/dbraw/zinc/00/30/50/389003050.db2.gz VKDAQWIOQLMMTI-VURMDHGXSA-N 1 2 212.120 2.274 20 0 BEADLO CC[N@H+](CCOC)C/C(Cl)=C/Cl ZINC000268701602 389003047 /nfs/dbraw/zinc/00/30/47/389003047.db2.gz VKDAQWIOQLMMTI-VURMDHGXSA-N 1 2 212.120 2.274 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1ccc(C)c(C)c1 ZINC000266988640 388998183 /nfs/dbraw/zinc/99/81/83/388998183.db2.gz UGGJAUVNMDFHJB-UHFFFAOYSA-N 1 2 243.310 2.265 20 0 BEADLO CCOCCNc1cc[nH+]c2ccncc12 ZINC000267188420 388999266 /nfs/dbraw/zinc/99/92/66/388999266.db2.gz GVGMSQOSZKHXCL-UHFFFAOYSA-N 1 2 217.272 2.078 20 0 BEADLO C[C@@H](Nc1cccc[nH+]1)[C@H]1CCCCO1 ZINC000272014590 389027573 /nfs/dbraw/zinc/02/75/73/389027573.db2.gz NXDPNXUKRBNCGQ-GHMZBOCLSA-N 1 2 206.289 2.451 20 0 BEADLO C[C@@H](Nc1cccc[nH+]1)[C@@H]1CCCCO1 ZINC000272014592 389028375 /nfs/dbraw/zinc/02/83/75/389028375.db2.gz NXDPNXUKRBNCGQ-MNOVXSKESA-N 1 2 206.289 2.451 20 0 BEADLO CC1=C(C(=O)NCCCCn2cc[nH+]c2)CCC1 ZINC000533471846 322820903 /nfs/dbraw/zinc/82/09/03/322820903.db2.gz OBOGPKQWCMCTHB-UHFFFAOYSA-N 1 2 247.342 2.280 20 0 BEADLO C[C@@H](O)CCC[N@@H+]1CC[C@H](C)C(F)(F)C1 ZINC000494229615 533588788 /nfs/dbraw/zinc/58/87/88/533588788.db2.gz DNHBZKXOEJUNOS-VHSXEESVSA-N 1 2 221.291 2.125 20 0 BEADLO C[C@@H](O)CCC[N@H+]1CC[C@H](C)C(F)(F)C1 ZINC000494229615 533588792 /nfs/dbraw/zinc/58/87/92/533588792.db2.gz DNHBZKXOEJUNOS-VHSXEESVSA-N 1 2 221.291 2.125 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)OCC2CC2)c2[nH+]ccn21 ZINC000497104366 533632434 /nfs/dbraw/zinc/63/24/34/533632434.db2.gz BQULKPMGCQLEEF-PSASIEDQSA-N 1 2 235.287 2.025 20 0 BEADLO Cc1cc(CNC(=O)/C=C\C2CC2)cc(C)[nH+]1 ZINC000493168263 533640732 /nfs/dbraw/zinc/64/07/32/533640732.db2.gz CDTJURIQMVKSEC-WAYWQWQTSA-N 1 2 230.311 2.281 20 0 BEADLO C[C@@H]1CCCN(C(=O)/C=C/c2[nH]cc[nH+]2)[C@@H]1C ZINC000493283368 533637329 /nfs/dbraw/zinc/63/73/29/533637329.db2.gz HMXMNCGKUCESTG-XIJCSBCJSA-N 1 2 233.315 2.070 20 0 BEADLO Cc1cc(N2C[C@H](C)O[C@@H](C)C2)nc(C2CC2)[nH+]1 ZINC000264611275 132178932 /nfs/dbraw/zinc/17/89/32/132178932.db2.gz FMRWFBRASUQZQO-QWRGUYRKSA-N 1 2 247.342 2.276 20 0 BEADLO Cc1cc(N2C[C@@H](C)OC[C@H]2C)nc(C2CC2)[nH+]1 ZINC000265297502 132181975 /nfs/dbraw/zinc/18/19/75/132181975.db2.gz CKQWCXJVSXPIGH-GHMZBOCLSA-N 1 2 247.342 2.276 20 0 BEADLO Cc1nc(N2CC[C@H](C)C[C@H]2C)cc[nH+]1 ZINC000266211900 132185132 /nfs/dbraw/zinc/18/51/32/132185132.db2.gz GGNSWWIONQYCPC-VHSXEESVSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1nc(N2CC[C@H](C)C[C@@H]2C)cc[nH+]1 ZINC000266211896 132185229 /nfs/dbraw/zinc/18/52/29/132185229.db2.gz GGNSWWIONQYCPC-UWVGGRQHSA-N 1 2 205.305 2.410 20 0 BEADLO c1cc(N2CCO[C@@H]3CCC[C@H]32)nc(C2CC2)[nH+]1 ZINC000268016851 132191181 /nfs/dbraw/zinc/19/11/81/132191181.db2.gz GTQCFVHXQVNUNH-VXGBXAGGSA-N 1 2 245.326 2.112 20 0 BEADLO Cc1cc(N2CCO[C@H](C)[C@H]2C)nc(C2CC2)[nH+]1 ZINC000268820552 132193675 /nfs/dbraw/zinc/19/36/75/132193675.db2.gz PBUVGKSKBSGEHZ-GHMZBOCLSA-N 1 2 247.342 2.276 20 0 BEADLO CO[C@@H]1CCN(c2cc[nH+]c(C3CC3)n2)[C@@H](C)C1 ZINC000281673523 132211713 /nfs/dbraw/zinc/21/17/13/132211713.db2.gz PXDQTKAVVYTUEN-CMPLNLGQSA-N 1 2 247.342 2.358 20 0 BEADLO CCc1nc(N2CCO[C@@](C)(CC)C2)cc(C)[nH+]1 ZINC000286765155 132215412 /nfs/dbraw/zinc/21/54/12/132215412.db2.gz SROXSTQARSMHLZ-AWEZNQCLSA-N 1 2 249.358 2.353 20 0 BEADLO c1ccc(N2CCC3(CCOCC3)CC2)[nH+]c1 ZINC000286740358 132215555 /nfs/dbraw/zinc/21/55/55/132215555.db2.gz NKVKLWZQJOMVKQ-UHFFFAOYSA-N 1 2 232.327 2.479 20 0 BEADLO Cc1nc(N2CCC[C@](CO)(C(C)C)C2)cc[nH+]1 ZINC000294332010 132219448 /nfs/dbraw/zinc/21/94/48/132219448.db2.gz ZXBYYALTOVLPOS-AWEZNQCLSA-N 1 2 249.358 2.020 20 0 BEADLO C[C@@]1(F)CCCN(c2nc[nH+]c(N)c2Cl)C1 ZINC000294833565 132219520 /nfs/dbraw/zinc/21/95/20/132219520.db2.gz ALKRYELFDWYMCZ-SNVBAGLBSA-N 1 2 244.701 2.041 20 0 BEADLO C[C@@]1(F)CCCN(c2[nH+]cnc(N)c2Cl)C1 ZINC000294833565 132219521 /nfs/dbraw/zinc/21/95/21/132219521.db2.gz ALKRYELFDWYMCZ-SNVBAGLBSA-N 1 2 244.701 2.041 20 0 BEADLO CCC(=O)NCc1cc[nH+]c(N2CCCCC2)c1 ZINC000298655901 132222478 /nfs/dbraw/zinc/22/24/78/132222478.db2.gz LQMWJYSDOTVIIL-UHFFFAOYSA-N 1 2 247.342 2.098 20 0 BEADLO c1coc([C@H]2CN(c3cccc[nH+]3)CCO2)c1 ZINC000133441222 132238089 /nfs/dbraw/zinc/23/80/89/132238089.db2.gz YAJDZOYKMBQGQF-GFCCVEGCSA-N 1 2 230.267 2.253 20 0 BEADLO Cc1cc(N2C[C@H](C)C[C@H](C)C2)nc[nH+]1 ZINC000097075508 132242599 /nfs/dbraw/zinc/24/25/99/132242599.db2.gz DECBAMWRGAMONK-AOOOYVTPSA-N 1 2 205.305 2.267 20 0 BEADLO Cc1cc(N2CCc3c(F)cccc3C2)nc[nH+]1 ZINC000336572793 132248604 /nfs/dbraw/zinc/24/86/04/132248604.db2.gz HGJGZXSGZKDMJU-UHFFFAOYSA-N 1 2 243.285 2.487 20 0 BEADLO Cc1cc(N2CCOC[C@@H]2C)nc(C(C)C)[nH+]1 ZINC000301069062 132250638 /nfs/dbraw/zinc/25/06/38/132250638.db2.gz DSYANHLXXOTEEU-NSHDSACASA-N 1 2 235.331 2.134 20 0 BEADLO Cc1cc(N2CCO[C@H](C)C2)nc(C(C)C)[nH+]1 ZINC000301080259 132251265 /nfs/dbraw/zinc/25/12/65/132251265.db2.gz IWLJBQQUWDMGID-LLVKDONJSA-N 1 2 235.331 2.134 20 0 BEADLO c1cnn([C@@H]2CCCN(c3cccc[nH+]3)C2)c1 ZINC000301206543 132251704 /nfs/dbraw/zinc/25/17/04/132251704.db2.gz ZLGYTTPHNZHSCF-GFCCVEGCSA-N 1 2 228.299 2.120 20 0 BEADLO CCOC[C@@H]1CCCN(c2cc(C)[nH+]cn2)C1 ZINC000301304372 132252748 /nfs/dbraw/zinc/25/27/48/132252748.db2.gz XFDJRUKLIQYGEI-GFCCVEGCSA-N 1 2 235.331 2.038 20 0 BEADLO Cc1cc(N2C[C@@H](C)CC[C@H]2C)nc[nH+]1 ZINC000301425132 132253788 /nfs/dbraw/zinc/25/37/88/132253788.db2.gz GNVIWIVTZKSGPL-GXSJLCMTSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1nc(N2C[C@@H](C)O[C@@H](C)C2)c(C)c(C)[nH+]1 ZINC000301452622 132254067 /nfs/dbraw/zinc/25/40/67/132254067.db2.gz UVVKORBILMJYLM-DTORHVGOSA-N 1 2 235.331 2.015 20 0 BEADLO CC[C@@H]1CN(c2nc(C)[nH+]c(C)c2C)C[C@H](C)O1 ZINC000301632150 132255401 /nfs/dbraw/zinc/25/54/01/132255401.db2.gz BVXOALRVCBMYOO-TVQRCGJNSA-N 1 2 249.358 2.406 20 0 BEADLO COC[C@H]1CCCN(c2nc(C)[nH+]c(C)c2C)C1 ZINC000301666850 132255737 /nfs/dbraw/zinc/25/57/37/132255737.db2.gz CKJGPBLKPKXMLV-ZDUSSCGKSA-N 1 2 249.358 2.265 20 0 BEADLO CO[C@@H]1CCCN(c2nc(C)[nH+]c(C)c2C)C1 ZINC000301698461 132256205 /nfs/dbraw/zinc/25/62/05/132256205.db2.gz RDIZAOKWWJDQEL-GFCCVEGCSA-N 1 2 235.331 2.017 20 0 BEADLO Cc1cc(N2CC[C@@H](C)[C@@H](C)C2)nc[nH+]1 ZINC000301918326 132258598 /nfs/dbraw/zinc/25/85/98/132258598.db2.gz JSHCIWLSZCRLJC-ZJUUUORDSA-N 1 2 205.305 2.267 20 0 BEADLO CO[C@H]1CN(c2nc(C)[nH+]c(C)c2C)CC[C@H]1C ZINC000302570370 132264729 /nfs/dbraw/zinc/26/47/29/132264729.db2.gz QIWLAEPBUDKNPO-RNCFNFMXSA-N 1 2 249.358 2.263 20 0 BEADLO Cc1n[nH]cc1C1CCN(c2cccc[nH+]2)CC1 ZINC000376427588 132289220 /nfs/dbraw/zinc/28/92/20/132289220.db2.gz NFJKHIIKRAJMTP-UHFFFAOYSA-N 1 2 242.326 2.497 20 0 BEADLO c1ccc(N2CCN(c3cccc[nH+]3)CC2)cc1 ZINC000005338377 132293190 /nfs/dbraw/zinc/29/31/90/132293190.db2.gz OUTNYQRSFDIRCF-UHFFFAOYSA-N 1 2 239.322 2.408 20 0 BEADLO COc1cccc2c1cc[nH+]c2N1CCOCC1 ZINC000336790754 132296787 /nfs/dbraw/zinc/29/67/87/132296787.db2.gz MAHXAHSDYGZVDH-UHFFFAOYSA-N 1 2 244.294 2.080 20 0 BEADLO C[C@@H]1CCCN(c2nc(N)c3ccccc3[nH+]2)C1 ZINC000041146387 132349601 /nfs/dbraw/zinc/34/96/01/132349601.db2.gz YVDMTWKCHGXCJH-SNVBAGLBSA-N 1 2 242.326 2.448 20 0 BEADLO CC(C)CC[NH2+]c1ccc2c(c1)N(C)C(=O)CO2 ZINC000174905781 132446229 /nfs/dbraw/zinc/44/62/29/132446229.db2.gz CTXXMESXAJXVSG-UHFFFAOYSA-N 1 2 248.326 2.500 20 0 BEADLO COc1ccc[nH+]c1N[C@@H](C)C1CCOCC1 ZINC000225869316 322840272 /nfs/dbraw/zinc/84/02/72/322840272.db2.gz UBDOCMQLIONAAA-JTQLQIEISA-N 1 2 236.315 2.317 20 0 BEADLO Fc1ccc(C[NH2+]Cc2ccco2)nc1 ZINC000158163722 133498734 /nfs/dbraw/zinc/49/87/34/133498734.db2.gz GKKHQUJGCZKENN-UHFFFAOYSA-N 1 2 206.220 2.104 20 0 BEADLO CC[C@H]1CCCN1C(=O)Nc1cc[nH+]c(C)c1 ZINC000335940792 134017345 /nfs/dbraw/zinc/01/73/45/134017345.db2.gz QZJSMXJYJUMSER-LBPRGKRZSA-N 1 2 233.315 2.218 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)ccc1F ZINC000335945105 134019277 /nfs/dbraw/zinc/01/92/77/134019277.db2.gz XUXPSAJBZKFDDJ-BETUJISGSA-N 1 2 235.302 2.497 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)ccc1F ZINC000335945105 134019278 /nfs/dbraw/zinc/01/92/78/134019278.db2.gz XUXPSAJBZKFDDJ-BETUJISGSA-N 1 2 235.302 2.497 20 0 BEADLO FC(F)(F)CC[N@@H+]1CCOCC12CCC2 ZINC000335948451 134020951 /nfs/dbraw/zinc/02/09/51/134020951.db2.gz BSXAZFDWZWXDLV-UHFFFAOYSA-N 1 2 223.238 2.194 20 0 BEADLO FC(F)(F)CC[N@H+]1CCOCC12CCC2 ZINC000335948451 134020952 /nfs/dbraw/zinc/02/09/52/134020952.db2.gz BSXAZFDWZWXDLV-UHFFFAOYSA-N 1 2 223.238 2.194 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1CC[C@H](C)C1 ZINC000335954350 134022437 /nfs/dbraw/zinc/02/24/37/134022437.db2.gz XWBQBZLODQQEJS-GXSJLCMTSA-N 1 2 218.300 2.187 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+]Cc2cnc(C)nc2)s1 ZINC000351987570 134026156 /nfs/dbraw/zinc/02/61/56/134026156.db2.gz WSLCXKYRCWZYJU-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO COC[C@@H]1CC[N@H+](Cc2ncc(Cl)s2)C1 ZINC000351988952 134026582 /nfs/dbraw/zinc/02/65/82/134026582.db2.gz NXYJWVNHXSOHLY-MRVPVSSYSA-N 1 2 246.763 2.265 20 0 BEADLO COC[C@@H]1CC[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000351988952 134026583 /nfs/dbraw/zinc/02/65/83/134026583.db2.gz NXYJWVNHXSOHLY-MRVPVSSYSA-N 1 2 246.763 2.265 20 0 BEADLO C[C@H](c1nncn1C)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000335961982 134026769 /nfs/dbraw/zinc/02/67/69/134026769.db2.gz RSNDNOHNOFYMJJ-WDEREUQCSA-N 1 2 242.326 2.453 20 0 BEADLO C[C@H](c1nncn1C)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000335961982 134026770 /nfs/dbraw/zinc/02/67/70/134026770.db2.gz RSNDNOHNOFYMJJ-WDEREUQCSA-N 1 2 242.326 2.453 20 0 BEADLO C[C@H](F)CC[N@@H+]1CCO[C@@H](c2nccs2)C1 ZINC000352007731 134035259 /nfs/dbraw/zinc/03/52/59/134035259.db2.gz YOLYUPJCBLSIND-VHSXEESVSA-N 1 2 244.335 2.265 20 0 BEADLO C[C@H](F)CC[N@H+]1CCO[C@@H](c2nccs2)C1 ZINC000352007731 134035260 /nfs/dbraw/zinc/03/52/60/134035260.db2.gz YOLYUPJCBLSIND-VHSXEESVSA-N 1 2 244.335 2.265 20 0 BEADLO CC1(C)CCCC[C@@H]1C(=O)NCCc1[nH]cc[nH+]1 ZINC000192585141 134036621 /nfs/dbraw/zinc/03/66/21/134036621.db2.gz XYDGFHQPSNLRJX-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H]1C[C@H]1CC(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000336002560 134047814 /nfs/dbraw/zinc/04/78/14/134047814.db2.gz NYEXSBWJYSMMCZ-RYUDHWBXSA-N 1 2 247.342 2.093 20 0 BEADLO Cc1noc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)n1 ZINC000336006187 134048994 /nfs/dbraw/zinc/04/89/94/134048994.db2.gz NKYDBNVROIDYBL-POYBYMJQSA-N 1 2 249.236 2.151 20 0 BEADLO Cc1noc(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)n1 ZINC000336006187 134048995 /nfs/dbraw/zinc/04/89/95/134048995.db2.gz NKYDBNVROIDYBL-POYBYMJQSA-N 1 2 249.236 2.151 20 0 BEADLO Cc1[nH]c(C(=O)NCc2ccc(C)c(F)c2)c[nH+]1 ZINC000336021305 134055450 /nfs/dbraw/zinc/05/54/50/134055450.db2.gz ZYNXSKZXOYRDHV-UHFFFAOYSA-N 1 2 247.273 2.096 20 0 BEADLO OC1(Cn2c[nH+]c3cc(F)c(F)cc32)CCC1 ZINC000336041698 134062346 /nfs/dbraw/zinc/06/23/46/134062346.db2.gz BRBWACVECVYTJJ-UHFFFAOYSA-N 1 2 238.237 2.230 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)[C@@H]1CCSC1 ZINC000336058852 134067136 /nfs/dbraw/zinc/06/71/36/134067136.db2.gz PUNJQCZFABKBJM-SECBINFHSA-N 1 2 247.323 2.026 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CCC(F)(F)C2)cc[nH+]1 ZINC000336080768 134075455 /nfs/dbraw/zinc/07/54/55/134075455.db2.gz AMANKEOXUVUDJK-SECBINFHSA-N 1 2 240.253 2.186 20 0 BEADLO Cc1ccc2c(c1)CC[N@@H+](Cc1ncc[nH]1)C2 ZINC000336088802 134077224 /nfs/dbraw/zinc/07/72/24/134077224.db2.gz CBJZHSXKPMWYJW-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1ccc2c(c1)CC[N@H+](Cc1ncc[nH]1)C2 ZINC000336088802 134077225 /nfs/dbraw/zinc/07/72/25/134077225.db2.gz CBJZHSXKPMWYJW-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1ccc2c(c1)CCN(Cc1[nH]cc[nH+]1)C2 ZINC000336088802 134077226 /nfs/dbraw/zinc/07/72/26/134077226.db2.gz CBJZHSXKPMWYJW-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1csc(C[N@@H+]2CCO[C@@H](C3CC3)C2)n1 ZINC000336088585 134077228 /nfs/dbraw/zinc/07/72/28/134077228.db2.gz ZRJXCGCVYUPXAX-LLVKDONJSA-N 1 2 238.356 2.062 20 0 BEADLO Cc1csc(C[N@H+]2CCO[C@@H](C3CC3)C2)n1 ZINC000336088585 134077229 /nfs/dbraw/zinc/07/72/29/134077229.db2.gz ZRJXCGCVYUPXAX-LLVKDONJSA-N 1 2 238.356 2.062 20 0 BEADLO C[N@H+](Cc1nnc2n1CCCCC2)[C@H]1CC1(C)C ZINC000336092605 134078659 /nfs/dbraw/zinc/07/86/59/134078659.db2.gz FQOMMHDUVJADMD-NSHDSACASA-N 1 2 248.374 2.235 20 0 BEADLO C[N@@H+](Cc1nnc2n1CCCCC2)[C@H]1CC1(C)C ZINC000336092605 134078660 /nfs/dbraw/zinc/07/86/60/134078660.db2.gz FQOMMHDUVJADMD-NSHDSACASA-N 1 2 248.374 2.235 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CC(C)=C[C@@H](C)C1 ZINC000336139511 134097145 /nfs/dbraw/zinc/09/71/45/134097145.db2.gz FVKYJESVNVBARY-SNVBAGLBSA-N 1 2 245.326 2.242 20 0 BEADLO CC1=CCC[N@H+](CC(=O)Nc2ccccc2F)C1 ZINC000336145397 134102337 /nfs/dbraw/zinc/10/23/37/134102337.db2.gz QUHPXWRCDPJLMS-UHFFFAOYSA-N 1 2 248.301 2.416 20 0 BEADLO CC1=CCC[N@@H+](CC(=O)Nc2ccccc2F)C1 ZINC000336145397 134102338 /nfs/dbraw/zinc/10/23/38/134102338.db2.gz QUHPXWRCDPJLMS-UHFFFAOYSA-N 1 2 248.301 2.416 20 0 BEADLO C[C@H](c1csnn1)[N@@H+]1CCC(C)(C)C1 ZINC000336192502 134124188 /nfs/dbraw/zinc/12/41/88/134124188.db2.gz PEWLIEBIRBLYMP-MRVPVSSYSA-N 1 2 211.334 2.331 20 0 BEADLO C[C@H](c1csnn1)[N@H+]1CCC(C)(C)C1 ZINC000336192502 134124189 /nfs/dbraw/zinc/12/41/89/134124189.db2.gz PEWLIEBIRBLYMP-MRVPVSSYSA-N 1 2 211.334 2.331 20 0 BEADLO COc1cc(F)cc(C[N@@H+]2CCO[C@H](C)C2)c1 ZINC000336215972 134137121 /nfs/dbraw/zinc/13/71/21/134137121.db2.gz SFXDMAKBYXHSIR-SNVBAGLBSA-N 1 2 239.290 2.055 20 0 BEADLO COc1cc(F)cc(C[N@H+]2CCO[C@H](C)C2)c1 ZINC000336215972 134137122 /nfs/dbraw/zinc/13/71/22/134137122.db2.gz SFXDMAKBYXHSIR-SNVBAGLBSA-N 1 2 239.290 2.055 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2CCCc3sccc32)n1 ZINC000168463861 134198138 /nfs/dbraw/zinc/19/81/38/134198138.db2.gz MMBYBOPGTHONDG-SECBINFHSA-N 1 2 249.339 2.319 20 0 BEADLO CCCC[C@@H](C(=O)OC)[N@H+](C)Cc1ccoc1 ZINC000168805236 134247004 /nfs/dbraw/zinc/24/70/04/134247004.db2.gz SBEUSAKKBZJKGO-LBPRGKRZSA-N 1 2 239.315 2.443 20 0 BEADLO CCCC[C@@H](C(=O)OC)[N@@H+](C)Cc1ccoc1 ZINC000168805236 134247005 /nfs/dbraw/zinc/24/70/05/134247005.db2.gz SBEUSAKKBZJKGO-LBPRGKRZSA-N 1 2 239.315 2.443 20 0 BEADLO CCOCCC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000170840892 134254181 /nfs/dbraw/zinc/25/41/81/134254181.db2.gz OSPAKONFSSYVRH-UHFFFAOYSA-N 1 2 236.315 2.372 20 0 BEADLO Cc1nccnc1[C@@H](C)[NH2+]Cc1nccs1 ZINC000219104496 134274685 /nfs/dbraw/zinc/27/46/85/134274685.db2.gz CXIGXUBMVFNDSY-SECBINFHSA-N 1 2 234.328 2.092 20 0 BEADLO C[C@@H](c1ccncc1)N(C)Cc1[nH+]ccn1C ZINC000179259976 134319601 /nfs/dbraw/zinc/31/96/01/134319601.db2.gz GIFQVWZUHJDPBL-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1nccn1C ZINC000179259976 134319602 /nfs/dbraw/zinc/31/96/02/134319602.db2.gz GIFQVWZUHJDPBL-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1nccn1C ZINC000179259976 134319603 /nfs/dbraw/zinc/31/96/03/134319603.db2.gz GIFQVWZUHJDPBL-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO CCc1ncnc(N[C@H](CC)c2[nH]cc[nH+]2)c1F ZINC000221225526 134322367 /nfs/dbraw/zinc/32/23/67/134322367.db2.gz KOGHINIFJZGMCM-SECBINFHSA-N 1 2 249.293 2.464 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CCCO[C@@H](C)C1 ZINC000179860365 134324525 /nfs/dbraw/zinc/32/45/25/134324525.db2.gz VIUPNKWYCQSOGH-NSHDSACASA-N 1 2 249.314 2.033 20 0 BEADLO C[C@@H](CO)[N@H+](C)Cc1ncc(Cl)cc1Cl ZINC000180163415 134327669 /nfs/dbraw/zinc/32/76/69/134327669.db2.gz ZIOGPAOAFPQTDS-ZETCQYMHSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@@H](CO)[N@@H+](C)Cc1ncc(Cl)cc1Cl ZINC000180163415 134327670 /nfs/dbraw/zinc/32/76/70/134327670.db2.gz ZIOGPAOAFPQTDS-ZETCQYMHSA-N 1 2 249.141 2.201 20 0 BEADLO C[N@H+](Cc1nnc(C2CC2)n1C1CC1)C1CC1 ZINC000181100340 134333588 /nfs/dbraw/zinc/33/35/88/134333588.db2.gz BWICEPJUVLKQHM-UHFFFAOYSA-N 1 2 232.331 2.085 20 0 BEADLO C[N@@H+](Cc1nnc(C2CC2)n1C1CC1)C1CC1 ZINC000181100340 134333589 /nfs/dbraw/zinc/33/35/89/134333589.db2.gz BWICEPJUVLKQHM-UHFFFAOYSA-N 1 2 232.331 2.085 20 0 BEADLO Cn1cc[nH+]c1CNc1nccc2occc21 ZINC000223231065 134337910 /nfs/dbraw/zinc/33/79/10/134337910.db2.gz ZHOSNMTYHQGIDN-UHFFFAOYSA-N 1 2 228.255 2.173 20 0 BEADLO CC1(C)CCCC[C@@H]1C(=O)NCc1c[nH+]c[nH]1 ZINC000226627771 134368019 /nfs/dbraw/zinc/36/80/19/134368019.db2.gz KZESDALDBBDBCC-LLVKDONJSA-N 1 2 235.331 2.242 20 0 BEADLO CC1(C)CCCC[C@@H]1C(=O)NCc1c[nH]c[nH+]1 ZINC000226627771 134368020 /nfs/dbraw/zinc/36/80/20/134368020.db2.gz KZESDALDBBDBCC-LLVKDONJSA-N 1 2 235.331 2.242 20 0 BEADLO CO[C@H]1C[C@@H](Nc2cc[nH+]c(C)n2)C1(C)C ZINC000227822086 134389319 /nfs/dbraw/zinc/38/93/19/134389319.db2.gz XCCHEVWFOSUXCP-ZJUUUORDSA-N 1 2 221.304 2.010 20 0 BEADLO Cc1cc(NCCC[C@H](C)O)nc(C(C)C)[nH+]1 ZINC000227995624 134396176 /nfs/dbraw/zinc/39/61/76/134396176.db2.gz BEVNPOQDTREGHS-NSHDSACASA-N 1 2 237.347 2.481 20 0 BEADLO Cn1c[nH+]cc1CCC(=O)Nc1ccc(F)cc1 ZINC000188390199 134507419 /nfs/dbraw/zinc/50/74/19/134507419.db2.gz FPUKBNCNLPUESB-UHFFFAOYSA-N 1 2 247.273 2.131 20 0 BEADLO CCc1cnc(C[NH2+]Cc2nccs2)s1 ZINC000230706805 134534108 /nfs/dbraw/zinc/53/41/08/134534108.db2.gz ORTNXIXLBSPVGQ-UHFFFAOYSA-N 1 2 239.369 2.452 20 0 BEADLO OC1(CNc2cc(C(F)(F)F)cc[nH+]2)CCC1 ZINC000158682019 134745362 /nfs/dbraw/zinc/74/53/62/134745362.db2.gz BSAZILSKQTYXRD-UHFFFAOYSA-N 1 2 246.232 2.427 20 0 BEADLO CC[C@H]([NH2+]Cc1ccnn1C)c1nccs1 ZINC000070717129 135010469 /nfs/dbraw/zinc/01/04/69/135010469.db2.gz DRJDHWZWHDVILC-JTQLQIEISA-N 1 2 236.344 2.118 20 0 BEADLO NC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000077917125 135084353 /nfs/dbraw/zinc/08/43/53/135084353.db2.gz KLMXRFZCHMCGDV-UHFFFAOYSA-N 1 2 229.239 2.365 20 0 BEADLO CC[C@H]([NH2+][C@@H]1C[C@H]1c1ccccc1)C(=O)OC ZINC000252721805 135102734 /nfs/dbraw/zinc/10/27/34/135102734.db2.gz OTOJEOINIMJWSJ-RWMBFGLXSA-N 1 2 233.311 2.084 20 0 BEADLO Nc1cc(CSc2ccncc2)cc[nH+]1 ZINC000087110724 135105986 /nfs/dbraw/zinc/10/59/86/135105986.db2.gz PBSKUTBQPWJJIK-UHFFFAOYSA-N 1 2 217.297 2.351 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H](C)c2cccs2)c[nH+]1 ZINC000264896688 135140424 /nfs/dbraw/zinc/14/04/24/135140424.db2.gz WLEWBOFMKRPMLT-SSDOTTSWSA-N 1 2 235.312 2.271 20 0 BEADLO CCS[C@H](c1nc(C[NH2+]C)no1)C(C)C ZINC000261539152 135178025 /nfs/dbraw/zinc/17/80/25/135178025.db2.gz BSGFDWCSKXBJNS-VIFPVBQESA-N 1 2 229.349 2.239 20 0 BEADLO CCCC1(C(=O)Nc2ccc(N)[nH+]c2)CC1 ZINC000261568636 135210443 /nfs/dbraw/zinc/21/04/43/135210443.db2.gz FRLNNNSENQOUGS-UHFFFAOYSA-N 1 2 219.288 2.183 20 0 BEADLO C[C@@H]1C[C@H](C)CN1c1cc(N2CCCC2)[nH+]cn1 ZINC000342350542 135260941 /nfs/dbraw/zinc/26/09/41/135260941.db2.gz PKUNQXTWXVFHCV-NWDGAFQWSA-N 1 2 246.358 2.312 20 0 BEADLO C[C@@H]1C[C@H](C)CN1c1cc(N2CCCC2)nc[nH+]1 ZINC000342350542 135260942 /nfs/dbraw/zinc/26/09/42/135260942.db2.gz PKUNQXTWXVFHCV-NWDGAFQWSA-N 1 2 246.358 2.312 20 0 BEADLO COCC[N@H+](C)Cc1nc(C2CC2)cs1 ZINC000342693114 135306679 /nfs/dbraw/zinc/30/66/79/135306679.db2.gz LYGARSXJKSUOMO-UHFFFAOYSA-N 1 2 226.345 2.099 20 0 BEADLO COCC[N@@H+](C)Cc1nc(C2CC2)cs1 ZINC000342693114 135306681 /nfs/dbraw/zinc/30/66/81/135306681.db2.gz LYGARSXJKSUOMO-UHFFFAOYSA-N 1 2 226.345 2.099 20 0 BEADLO Cc1cc(N[C@H](C)c2nnc(C(C)C)[nH]2)nc[nH+]1 ZINC000342784725 135318698 /nfs/dbraw/zinc/31/86/98/135318698.db2.gz WCFYGTXFXSNLRH-SECBINFHSA-N 1 2 246.318 2.200 20 0 BEADLO Cc1c[nH+]c(CN(C)[C@@H](C)c2cccnc2)n1C ZINC000342796279 135319525 /nfs/dbraw/zinc/31/95/25/135319525.db2.gz JUJBOYHIRUJTIK-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cc(NC(=O)N(C)Cc2ccoc2)cc[nH+]1 ZINC000334165112 135323194 /nfs/dbraw/zinc/32/31/94/135323194.db2.gz AFCXXPGDONJJMV-UHFFFAOYSA-N 1 2 245.282 2.069 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@H](C)[C@H]2C)nc1 ZINC000334167303 135324338 /nfs/dbraw/zinc/32/43/38/135324338.db2.gz AMHKVRNULKCXKJ-VXGBXAGGSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@H](C)[C@H]2C)nc1 ZINC000334167303 135324340 /nfs/dbraw/zinc/32/43/40/135324340.db2.gz AMHKVRNULKCXKJ-VXGBXAGGSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1nc(N2CCO[C@H](C(C)C)C2)cc(C)[nH+]1 ZINC000342941746 135337348 /nfs/dbraw/zinc/33/73/48/135337348.db2.gz XMDKFPYYYKGJBS-LBPRGKRZSA-N 1 2 249.358 2.209 20 0 BEADLO CC(C)[C@@H]1C[N@H+](Cc2cncc(F)c2)CCO1 ZINC000334312494 135351827 /nfs/dbraw/zinc/35/18/27/135351827.db2.gz KXWXBNAIGGFGJO-ZDUSSCGKSA-N 1 2 238.306 2.078 20 0 BEADLO CC(C)[C@@H]1C[N@@H+](Cc2cncc(F)c2)CCO1 ZINC000334312494 135351829 /nfs/dbraw/zinc/35/18/29/135351829.db2.gz KXWXBNAIGGFGJO-ZDUSSCGKSA-N 1 2 238.306 2.078 20 0 BEADLO C[C@H](c1nncn1C)[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000334320707 135352520 /nfs/dbraw/zinc/35/25/20/135352520.db2.gz WAAVAMFWEDMDDA-DGCLKSJQSA-N 1 2 242.326 2.323 20 0 BEADLO C[C@H](c1nncn1C)[N@H+]1CC[C@@H]1c1ccccc1 ZINC000334320707 135352521 /nfs/dbraw/zinc/35/25/21/135352521.db2.gz WAAVAMFWEDMDDA-DGCLKSJQSA-N 1 2 242.326 2.323 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@](C)(F)C2)oc1C ZINC000334340684 135363724 /nfs/dbraw/zinc/36/37/24/135363724.db2.gz NFRRBNNRJMJCKB-NSHDSACASA-N 1 2 212.268 2.225 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@](C)(F)C2)oc1C ZINC000334340684 135363725 /nfs/dbraw/zinc/36/37/25/135363725.db2.gz NFRRBNNRJMJCKB-NSHDSACASA-N 1 2 212.268 2.225 20 0 BEADLO O=C1OCC[C@@H]1[NH2+][C@@H]1CCC[C@H]1c1ccccc1 ZINC000275640800 135367414 /nfs/dbraw/zinc/36/74/14/135367414.db2.gz RXOBDHXPNJRYJJ-MJBXVCDLSA-N 1 2 245.322 2.228 20 0 BEADLO C[C@@H]1c2ccccc2C[N@H+]1Cc1ccnn1C ZINC000334349754 135367789 /nfs/dbraw/zinc/36/77/89/135367789.db2.gz APHBJOPPUXXQHW-LLVKDONJSA-N 1 2 227.311 2.497 20 0 BEADLO C[C@@H]1c2ccccc2C[N@@H+]1Cc1ccnn1C ZINC000334349754 135367791 /nfs/dbraw/zinc/36/77/91/135367791.db2.gz APHBJOPPUXXQHW-LLVKDONJSA-N 1 2 227.311 2.497 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1sccc1F ZINC000334412011 135395544 /nfs/dbraw/zinc/39/55/44/135395544.db2.gz KTRUEHAXOWOQFR-UHFFFAOYSA-N 1 2 236.271 2.265 20 0 BEADLO Cc1ccsc1[C@H](C)[NH2+]CC(F)(F)CO ZINC000231792664 135635995 /nfs/dbraw/zinc/63/59/95/135635995.db2.gz KMJZGTKCFKXOCQ-QMMMGPOBSA-N 1 2 235.299 2.335 20 0 BEADLO Cc1[nH+]c2ccc(C(=O)NCC(C)C)cc2n1C ZINC000335294844 136006099 /nfs/dbraw/zinc/00/60/99/136006099.db2.gz BYUPGPZGDXGMHZ-UHFFFAOYSA-N 1 2 245.326 2.268 20 0 BEADLO FC(F)n1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]32)n1 ZINC000347701431 136007264 /nfs/dbraw/zinc/00/72/64/136007264.db2.gz LERNRVOACPRJDB-WCBMZHEXSA-N 1 2 227.258 2.263 20 0 BEADLO FC(F)n1ccc(C[N@H+]2C[C@@H]3CCC[C@H]32)n1 ZINC000347701431 136007265 /nfs/dbraw/zinc/00/72/65/136007265.db2.gz LERNRVOACPRJDB-WCBMZHEXSA-N 1 2 227.258 2.263 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)Cc1cc(F)cc(F)c1 ZINC000347705410 136007819 /nfs/dbraw/zinc/00/78/19/136007819.db2.gz JXUASDOLIYGMQE-UHFFFAOYSA-N 1 2 237.253 2.320 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cc[nH]n2)cc(C)c1O ZINC000347809080 136013213 /nfs/dbraw/zinc/01/32/13/136013213.db2.gz IOZXDZVWWIRTQU-UHFFFAOYSA-N 1 2 245.326 2.364 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cc[nH]n2)cc(C)c1O ZINC000347809080 136013214 /nfs/dbraw/zinc/01/32/14/136013214.db2.gz IOZXDZVWWIRTQU-UHFFFAOYSA-N 1 2 245.326 2.364 20 0 BEADLO CCc1[nH+]c(C)ccc1OCCc1cnn(C)c1 ZINC000347864765 136016531 /nfs/dbraw/zinc/01/65/31/136016531.db2.gz QWCMIZUUTGIHDM-UHFFFAOYSA-N 1 2 245.326 2.307 20 0 BEADLO C[C@H]1CCC[C@H](C)N(C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000335316069 136024687 /nfs/dbraw/zinc/02/46/87/136024687.db2.gz ORFSIJFHJDPIFM-RYUDHWBXSA-N 1 2 249.358 2.379 20 0 BEADLO O=C(C1=CCCC1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000335314554 136032029 /nfs/dbraw/zinc/03/20/29/136032029.db2.gz GETFBKDYJABQPZ-NSHDSACASA-N 1 2 231.299 2.184 20 0 BEADLO Cc1noc([C@@H](C)NCc2[nH+]ccn2C(C)C)n1 ZINC000348095312 136035959 /nfs/dbraw/zinc/03/59/59/136035959.db2.gz ILXOAZDAEMEKMY-SECBINFHSA-N 1 2 249.318 2.006 20 0 BEADLO CC1=C[C@@H](C)C[N@@H+](Cc2ncnn2C(C)C)C1 ZINC000335332779 136054607 /nfs/dbraw/zinc/05/46/07/136054607.db2.gz KKOBDKMBWYEZJE-LLVKDONJSA-N 1 2 234.347 2.257 20 0 BEADLO CC1=C[C@@H](C)C[N@H+](Cc2ncnn2C(C)C)C1 ZINC000335332779 136054608 /nfs/dbraw/zinc/05/46/08/136054608.db2.gz KKOBDKMBWYEZJE-LLVKDONJSA-N 1 2 234.347 2.257 20 0 BEADLO Cc1csc(C[N@@H+]2CCO[C@@H](C(C)C)C2)n1 ZINC000335335099 136055407 /nfs/dbraw/zinc/05/54/07/136055407.db2.gz DNRCIEXJODMKLA-LLVKDONJSA-N 1 2 240.372 2.308 20 0 BEADLO Cc1csc(C[N@H+]2CCO[C@@H](C(C)C)C2)n1 ZINC000335335099 136055408 /nfs/dbraw/zinc/05/54/08/136055408.db2.gz DNRCIEXJODMKLA-LLVKDONJSA-N 1 2 240.372 2.308 20 0 BEADLO Cc1nnc(C[NH+]2C[C@H](C)S[C@@H](C)C2)s1 ZINC000335350956 136068708 /nfs/dbraw/zinc/06/87/08/136068708.db2.gz YJABJCIIFFGTLG-YUMQZZPRSA-N 1 2 243.401 2.172 20 0 BEADLO CCc1nnc([C@H](C)[N@@H+]2CC[C@@](C)(F)C2)o1 ZINC000335354768 136070697 /nfs/dbraw/zinc/07/06/97/136070697.db2.gz HFADDQWWQDUXCT-GZMMTYOYSA-N 1 2 227.283 2.127 20 0 BEADLO CCc1nnc([C@H](C)[N@H+]2CC[C@@](C)(F)C2)o1 ZINC000335354768 136070698 /nfs/dbraw/zinc/07/06/98/136070698.db2.gz HFADDQWWQDUXCT-GZMMTYOYSA-N 1 2 227.283 2.127 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ccnn2C)c(C)n1 ZINC000348368513 136073446 /nfs/dbraw/zinc/07/34/46/136073446.db2.gz SXBZPCXBZJIBJX-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ccnn2C)c(C)n1 ZINC000348368513 136073447 /nfs/dbraw/zinc/07/34/47/136073447.db2.gz SXBZPCXBZJIBJX-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Nc1ccc(NC(=O)C2CC3(CCC3)C2)c[nH+]1 ZINC000335374550 136085362 /nfs/dbraw/zinc/08/53/62/136085362.db2.gz HSZYUKCBIFORHB-UHFFFAOYSA-N 1 2 231.299 2.013 20 0 BEADLO c1ccc(N2CCC[C@@H]2[C@H]2CCCOC2)[nH+]c1 ZINC000335379023 136086684 /nfs/dbraw/zinc/08/66/84/136086684.db2.gz VWLDGSALMVEUJG-QWHCGFSZSA-N 1 2 232.327 2.477 20 0 BEADLO CC1(C(N)=O)C[NH+](Cc2ccc(F)cc2F)C1 ZINC000335398431 136093321 /nfs/dbraw/zinc/09/33/21/136093321.db2.gz TZHVORFISZNCBJ-UHFFFAOYSA-N 1 2 240.253 2.322 20 0 BEADLO Cc1nc(C[NH+]2CC(C)(C(N)=O)C2)sc1C ZINC000335398532 136093402 /nfs/dbraw/zinc/09/34/02/136093402.db2.gz WXRNOLHLPCIDDX-UHFFFAOYSA-N 1 2 239.344 2.117 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)[C@]12C[C@H]1CCC2 ZINC000335568564 136108226 /nfs/dbraw/zinc/10/82/26/136108226.db2.gz NJYCMXRTAJHPQP-QMTHXVAHSA-N 1 2 245.326 2.276 20 0 BEADLO CC[C@H]1CN(c2cccc[nH+]2)C[C@H](CC)O1 ZINC000335567490 136108263 /nfs/dbraw/zinc/10/82/63/136108263.db2.gz IYKAXPFWJDOLMD-RYUDHWBXSA-N 1 2 220.316 2.475 20 0 BEADLO Cn1ccnc1C[NH+]1CC2(C1)CCCCC2 ZINC000335573074 136110512 /nfs/dbraw/zinc/11/05/12/136110512.db2.gz XHDQIJIAWSAFSR-UHFFFAOYSA-N 1 2 219.332 2.186 20 0 BEADLO C[C@@H](O)[C@@H](C)[NH+]1Cc2cc(F)c(F)cc2C1 ZINC001646448028 1172742018 /nfs/dbraw/zinc/74/20/18/1172742018.db2.gz DPEGSCPIHSLVFM-HTQZYQBOSA-N 1 2 227.254 2.050 20 0 BEADLO O=C(NCc1[nH]c2c([nH+]1)CCCC2)C1=CCCC1 ZINC001647344064 1172758555 /nfs/dbraw/zinc/75/85/55/1172758555.db2.gz SPILIYTTYHPVGB-UHFFFAOYSA-N 1 2 245.326 2.015 20 0 BEADLO COc1cc[nH+]cc1NC(=O)Cc1ccc(C)o1 ZINC000533581381 322860759 /nfs/dbraw/zinc/86/07/59/322860759.db2.gz DLQWTVCODYARAH-UHFFFAOYSA-N 1 2 246.266 2.173 20 0 BEADLO CCC1CC([NH2+][C@H](C)C(=O)OC(C)(C)C)C1 ZINC000310017980 397875218 /nfs/dbraw/zinc/87/52/18/397875218.db2.gz LTACNCXFLKCVTM-KPPDAEKUSA-N 1 2 227.348 2.495 20 0 BEADLO CC(C)[C@@H]1C[C@@H]1C(=O)Nc1ccc[nH+]c1N(C)C ZINC000186090918 397876658 /nfs/dbraw/zinc/87/66/58/397876658.db2.gz PAICNFXLRWJIEO-QWRGUYRKSA-N 1 2 247.342 2.378 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCc2ncsc2C1 ZINC000440529042 397931354 /nfs/dbraw/zinc/93/13/54/397931354.db2.gz GKEGKRDJMXPHDL-MRVPVSSYSA-N 1 2 214.309 2.249 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCc2ncsc2C1 ZINC000440529042 397931359 /nfs/dbraw/zinc/93/13/59/397931359.db2.gz GKEGKRDJMXPHDL-MRVPVSSYSA-N 1 2 214.309 2.249 20 0 BEADLO CCn1ccc(C[NH2+]Cc2cc(O)cc(F)c2)n1 ZINC000414485281 397954892 /nfs/dbraw/zinc/95/48/92/397954892.db2.gz RCGABPOVJKKJOA-UHFFFAOYSA-N 1 2 249.289 2.038 20 0 BEADLO CO[C@H]1C[C@H]([N@H+](C)CC(F)F)C12CCC2 ZINC000650184796 397961563 /nfs/dbraw/zinc/96/15/63/397961563.db2.gz QQMWJUQEMFUVEW-IUCAKERBSA-N 1 2 219.275 2.141 20 0 BEADLO CO[C@H]1C[C@H]([N@@H+](C)CC(F)F)C12CCC2 ZINC000650184796 397961565 /nfs/dbraw/zinc/96/15/65/397961565.db2.gz QQMWJUQEMFUVEW-IUCAKERBSA-N 1 2 219.275 2.141 20 0 BEADLO CCC[C@H](CC)NC(=O)[C@H]1CCc2[nH+]ccn2C1 ZINC000364983411 397926543 /nfs/dbraw/zinc/92/65/43/397926543.db2.gz BCMISIVXWZTELW-RYUDHWBXSA-N 1 2 249.358 2.140 20 0 BEADLO CC[C@H]1CCCCN1C(=O)Cc1[nH]c[nH+]c1C ZINC000279292941 398044490 /nfs/dbraw/zinc/04/44/90/398044490.db2.gz YIGPQCCTFJDKIH-NSHDSACASA-N 1 2 235.331 2.052 20 0 BEADLO CCN(CC(F)F)c1cc[nH+]c(C2CC2)n1 ZINC000273182860 397993757 /nfs/dbraw/zinc/99/37/57/397993757.db2.gz BISKBODZWZGORC-UHFFFAOYSA-N 1 2 227.258 2.445 20 0 BEADLO Cc1ccoc1C[N@H+](C)Cc1cc2n(n1)CCC2 ZINC000649616524 398001131 /nfs/dbraw/zinc/00/11/31/398001131.db2.gz KQASBTTXMFBOPX-UHFFFAOYSA-N 1 2 245.326 2.363 20 0 BEADLO Cc1ccoc1C[N@@H+](C)Cc1cc2n(n1)CCC2 ZINC000649616524 398001134 /nfs/dbraw/zinc/00/11/34/398001134.db2.gz KQASBTTXMFBOPX-UHFFFAOYSA-N 1 2 245.326 2.363 20 0 BEADLO Cc1cc(CNc2cc(C)c[nH+]c2C)nn1C ZINC000650242701 398003901 /nfs/dbraw/zinc/00/39/01/398003901.db2.gz VUPURVKMELAVEH-UHFFFAOYSA-N 1 2 230.315 2.352 20 0 BEADLO CCc1cc[nH+]cc1NCc1cnn(CC)c1 ZINC000650243054 398005442 /nfs/dbraw/zinc/00/54/42/398005442.db2.gz IPVFAGDPAZJLNQ-UHFFFAOYSA-N 1 2 230.315 2.473 20 0 BEADLO CCc1cc[nH+]cc1NCc1cn(C)nc1C ZINC000650243080 398005591 /nfs/dbraw/zinc/00/55/91/398005591.db2.gz JQFSKURPRLHWJE-UHFFFAOYSA-N 1 2 230.315 2.298 20 0 BEADLO CCc1ccncc1NCc1c[nH+]cn1CC ZINC000650242941 398005607 /nfs/dbraw/zinc/00/56/07/398005607.db2.gz DHSITMXRUBYMFT-UHFFFAOYSA-N 1 2 230.315 2.473 20 0 BEADLO Clc1ccc(C[N@H+](C2CC2)C2COC2)nc1 ZINC000649698058 398046833 /nfs/dbraw/zinc/04/68/33/398046833.db2.gz LYSGQMZBRDNIQF-UHFFFAOYSA-N 1 2 238.718 2.098 20 0 BEADLO Clc1ccc(C[N@@H+](C2CC2)C2COC2)nc1 ZINC000649698058 398046836 /nfs/dbraw/zinc/04/68/36/398046836.db2.gz LYSGQMZBRDNIQF-UHFFFAOYSA-N 1 2 238.718 2.098 20 0 BEADLO FC(F)C[N@@H+]1CCC[C@@]2(CCSC2)C1 ZINC000650261940 398012709 /nfs/dbraw/zinc/01/27/09/398012709.db2.gz UGMMKZDVKXWEEI-SNVBAGLBSA-N 1 2 221.316 2.471 20 0 BEADLO FC(F)C[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000650261940 398012711 /nfs/dbraw/zinc/01/27/11/398012711.db2.gz UGMMKZDVKXWEEI-SNVBAGLBSA-N 1 2 221.316 2.471 20 0 BEADLO C[N@H+](CCCCc1ccccc1)Cc1nnc[nH]1 ZINC000274792969 398014882 /nfs/dbraw/zinc/01/48/82/398014882.db2.gz OPOITCPWKYESKY-UHFFFAOYSA-N 1 2 244.342 2.259 20 0 BEADLO C[N@@H+](CCCCc1ccccc1)Cc1nnc[nH]1 ZINC000274792969 398014885 /nfs/dbraw/zinc/01/48/85/398014885.db2.gz OPOITCPWKYESKY-UHFFFAOYSA-N 1 2 244.342 2.259 20 0 BEADLO CCOC1CC[NH+]([C@@H](C)c2csnn2)CC1 ZINC000649650044 398021122 /nfs/dbraw/zinc/02/11/22/398021122.db2.gz HZXUOCQQVHTPOJ-VIFPVBQESA-N 1 2 241.360 2.100 20 0 BEADLO Fc1c[nH+]ccc1N1CCO[C@@H](C2CCC2)C1 ZINC000641634329 398021348 /nfs/dbraw/zinc/02/13/48/398021348.db2.gz YUYDPSDXFPMSSX-CYBMUJFWSA-N 1 2 236.290 2.226 20 0 BEADLO OCc1cc[nH+]c(N[C@@H]2CCCC[C@H]2F)c1 ZINC000641634395 398021470 /nfs/dbraw/zinc/02/14/70/398021470.db2.gz MXHJPGIDVQMIGH-GHMZBOCLSA-N 1 2 224.279 2.267 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CCC23CCCC3)[nH]1 ZINC000649658285 398027401 /nfs/dbraw/zinc/02/74/01/398027401.db2.gz FWJZEIINNLVEEF-UHFFFAOYSA-N 1 2 234.347 2.447 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CCC23CCCC3)[nH]1 ZINC000649658285 398027404 /nfs/dbraw/zinc/02/74/04/398027404.db2.gz FWJZEIINNLVEEF-UHFFFAOYSA-N 1 2 234.347 2.447 20 0 BEADLO Cn1cc(CCC[N@@H+]2CCCC(F)(F)C2)cn1 ZINC000649692951 398040516 /nfs/dbraw/zinc/04/05/16/398040516.db2.gz LIUPPYIOFLNAKF-UHFFFAOYSA-N 1 2 243.301 2.084 20 0 BEADLO Cn1cc(CCC[N@H+]2CCCC(F)(F)C2)cn1 ZINC000649692951 398040520 /nfs/dbraw/zinc/04/05/20/398040520.db2.gz LIUPPYIOFLNAKF-UHFFFAOYSA-N 1 2 243.301 2.084 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@H](C)c1ccccc1 ZINC000278768208 398041351 /nfs/dbraw/zinc/04/13/51/398041351.db2.gz WVMILOARVFTZEH-JTQLQIEISA-N 1 2 243.310 2.138 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@@H](C)c1ccccc1 ZINC000278768208 398041356 /nfs/dbraw/zinc/04/13/56/398041356.db2.gz WVMILOARVFTZEH-JTQLQIEISA-N 1 2 243.310 2.138 20 0 BEADLO CCOCCC[N@@H+]1CCCC(F)(F)C1 ZINC000649693523 398041495 /nfs/dbraw/zinc/04/14/95/398041495.db2.gz HANFMCBOWRZKPD-UHFFFAOYSA-N 1 2 207.264 2.144 20 0 BEADLO CCOCCC[N@H+]1CCCC(F)(F)C1 ZINC000649693523 398041496 /nfs/dbraw/zinc/04/14/96/398041496.db2.gz HANFMCBOWRZKPD-UHFFFAOYSA-N 1 2 207.264 2.144 20 0 BEADLO O=C(CCn1cc[nH+]c1)N[C@@H]1CC12CCCCC2 ZINC000271725418 397971017 /nfs/dbraw/zinc/97/10/17/397971017.db2.gz YIGPVQASAQOULZ-GFCCVEGCSA-N 1 2 247.342 2.112 20 0 BEADLO C[C@@H]1c2ccccc2C[N@H+]1CC(=O)NCC1CC1 ZINC000361058408 397972551 /nfs/dbraw/zinc/97/25/51/397972551.db2.gz PLQZBWZMLZFYAM-LLVKDONJSA-N 1 2 244.338 2.089 20 0 BEADLO C[C@@H]1c2ccccc2C[N@@H+]1CC(=O)NCC1CC1 ZINC000361058408 397972555 /nfs/dbraw/zinc/97/25/55/397972555.db2.gz PLQZBWZMLZFYAM-LLVKDONJSA-N 1 2 244.338 2.089 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)NCC1CCCCCC1 ZINC000452793419 397987818 /nfs/dbraw/zinc/98/78/18/397987818.db2.gz MZODPHGHHQQUDN-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1Cc1cnc(C)nc1 ZINC000649718651 398059849 /nfs/dbraw/zinc/05/98/49/398059849.db2.gz DFJFNTWXUFBKRD-KGLIPLIRSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@H+]1Cc1cnc(C)nc1 ZINC000649718651 398059852 /nfs/dbraw/zinc/05/98/52/398059852.db2.gz DFJFNTWXUFBKRD-KGLIPLIRSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ncc(C)cn2)[C@H](CC)CO1 ZINC000649719818 398062597 /nfs/dbraw/zinc/06/25/97/398062597.db2.gz XZQZQZOSBZIYJQ-CHWSQXEVSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ncc(C)cn2)[C@H](CC)CO1 ZINC000649719818 398062598 /nfs/dbraw/zinc/06/25/98/398062598.db2.gz XZQZQZOSBZIYJQ-CHWSQXEVSA-N 1 2 249.358 2.174 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1coc2ccccc12 ZINC000128551599 398069886 /nfs/dbraw/zinc/06/98/86/398069886.db2.gz ILJMXIRWOWATKI-UHFFFAOYSA-N 1 2 247.294 2.428 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1coc2ccccc12 ZINC000128551599 398069889 /nfs/dbraw/zinc/06/98/89/398069889.db2.gz ILJMXIRWOWATKI-UHFFFAOYSA-N 1 2 247.294 2.428 20 0 BEADLO CCC1(C(=O)NCc2c[nH+]cn2C)CCCC1 ZINC000291874056 398072779 /nfs/dbraw/zinc/07/27/79/398072779.db2.gz KVHWWAHGYDWJGG-UHFFFAOYSA-N 1 2 235.331 2.007 20 0 BEADLO C[C@H]1CC[N@H+](Cc2ccncc2F)C[C@H]1F ZINC000648504853 398073181 /nfs/dbraw/zinc/07/31/81/398073181.db2.gz GDYUGJVXVLQKCK-JOYOIKCWSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2ccncc2F)C[C@H]1F ZINC000648504853 398073184 /nfs/dbraw/zinc/07/31/84/398073184.db2.gz GDYUGJVXVLQKCK-JOYOIKCWSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2ccncc2F)C[C@H]1F ZINC000648504851 398073358 /nfs/dbraw/zinc/07/33/58/398073358.db2.gz GDYUGJVXVLQKCK-BXKDBHETSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2ccncc2F)C[C@H]1F ZINC000648504851 398073362 /nfs/dbraw/zinc/07/33/62/398073362.db2.gz GDYUGJVXVLQKCK-BXKDBHETSA-N 1 2 226.270 2.401 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ncc(C)s2)[C@@H](C)CO1 ZINC000649735306 398076829 /nfs/dbraw/zinc/07/68/29/398076829.db2.gz JFDVWAGVRKDWKQ-GXSJLCMTSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ncc(C)s2)[C@@H](C)CO1 ZINC000649735306 398076834 /nfs/dbraw/zinc/07/68/34/398076834.db2.gz JFDVWAGVRKDWKQ-GXSJLCMTSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1nccn1C ZINC000285644004 398078920 /nfs/dbraw/zinc/07/89/20/398078920.db2.gz ZNCNDHOKXKUISO-UHFFFAOYSA-N 1 2 248.330 2.050 20 0 BEADLO CCN(C#N)CC[N@@H+]1CC[C@@H]1c1ccc(F)cc1 ZINC000602883466 398081956 /nfs/dbraw/zinc/08/19/56/398081956.db2.gz IHYYWYNWBFUTSB-CQSZACIVSA-N 1 2 247.317 2.375 20 0 BEADLO CCN(C#N)CC[N@H+]1CC[C@@H]1c1ccc(F)cc1 ZINC000602883466 398081957 /nfs/dbraw/zinc/08/19/57/398081957.db2.gz IHYYWYNWBFUTSB-CQSZACIVSA-N 1 2 247.317 2.375 20 0 BEADLO CCC[N@H+](CCOCC(F)F)CC(F)F ZINC000189028357 398096751 /nfs/dbraw/zinc/09/67/51/398096751.db2.gz OMOQHFQBCVODHH-UHFFFAOYSA-N 1 2 231.233 2.245 20 0 BEADLO CCC[N@@H+](CCOCC(F)F)CC(F)F ZINC000189028357 398096754 /nfs/dbraw/zinc/09/67/54/398096754.db2.gz OMOQHFQBCVODHH-UHFFFAOYSA-N 1 2 231.233 2.245 20 0 BEADLO c1csc([C@H]([NH2+]C2CCCC2)c2nnc[nH]2)c1 ZINC000293949069 398118046 /nfs/dbraw/zinc/11/80/46/398118046.db2.gz ZEJAHLNKRNSHFX-NSHDSACASA-N 1 2 248.355 2.488 20 0 BEADLO Cc1nsc(N[C@@H](c2[nH]cc[nH+]2)C(C)C)n1 ZINC000284537179 398127198 /nfs/dbraw/zinc/12/71/98/398127198.db2.gz ATJGHCRLDKVGFS-MRVPVSSYSA-N 1 2 237.332 2.379 20 0 BEADLO Cc1nsc(N[C@H](c2[nH]cc[nH+]2)C(C)C)n1 ZINC000284537183 398127379 /nfs/dbraw/zinc/12/73/79/398127379.db2.gz ATJGHCRLDKVGFS-QMMMGPOBSA-N 1 2 237.332 2.379 20 0 BEADLO COc1ccc(N[C@@H]2C[C@@H](C)O[C@H]2C)[nH+]c1 ZINC000385083811 398132069 /nfs/dbraw/zinc/13/20/69/398132069.db2.gz FLMPZERTWSWYRN-WCABBAIRSA-N 1 2 222.288 2.068 20 0 BEADLO Cc1cccc([C@@H]2CC[N@H+](Cc3cn[nH]n3)C2)c1 ZINC000295047946 398131591 /nfs/dbraw/zinc/13/15/91/398131591.db2.gz UEVABZXAXSVQMV-CYBMUJFWSA-N 1 2 242.326 2.103 20 0 BEADLO Cc1cccc([C@@H]2CC[N@@H+](Cc3cn[nH]n3)C2)c1 ZINC000295047946 398131593 /nfs/dbraw/zinc/13/15/93/398131593.db2.gz UEVABZXAXSVQMV-CYBMUJFWSA-N 1 2 242.326 2.103 20 0 BEADLO Cc1[nH]c(CN2CCOC[C@@H]2CC2CC2)[nH+]c1C ZINC001648407669 1172830101 /nfs/dbraw/zinc/83/01/01/1172830101.db2.gz DXIAUSIGHKIHKP-ZDUSSCGKSA-N 1 2 249.358 2.027 20 0 BEADLO CC1(COc2ccccc2-n2cc[nH+]c2)COC1 ZINC000674346126 487560413 /nfs/dbraw/zinc/56/04/13/487560413.db2.gz ZWEIBUCHRJNJAO-UHFFFAOYSA-N 1 2 244.294 2.288 20 0 BEADLO Cc1nnc([C@@H]2CCCN(c3cccc[nH+]3)C2)o1 ZINC000680329258 487562994 /nfs/dbraw/zinc/56/29/94/487562994.db2.gz NOSIOHUIMSCELW-LLVKDONJSA-N 1 2 244.298 2.157 20 0 BEADLO C[C@H]1C[C@H]1Nc1[nH+]c(C2CC2)nc2[nH]ccc21 ZINC000631096113 487565071 /nfs/dbraw/zinc/56/50/71/487565071.db2.gz AHEGCOIKVYGSRY-OIBJUYFYSA-N 1 2 228.299 2.078 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@@H](C)c1c(C)noc1C ZINC000685616190 487565501 /nfs/dbraw/zinc/56/55/01/487565501.db2.gz ZIHVUNGUKJRYFG-QMMMGPOBSA-N 1 2 234.303 2.174 20 0 BEADLO Cc1cn[nH]c1C[NH2+][C@@H](C)c1c(C)noc1C ZINC000685616190 487565498 /nfs/dbraw/zinc/56/54/98/487565498.db2.gz ZIHVUNGUKJRYFG-QMMMGPOBSA-N 1 2 234.303 2.174 20 0 BEADLO Cn1cncc1C[N@H+](C)Cc1ccsc1 ZINC000674369970 487566514 /nfs/dbraw/zinc/56/65/14/487566514.db2.gz IJUFNIOYVIRYKK-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO Cn1cncc1C[N@@H+](C)Cc1ccsc1 ZINC000674369970 487566519 /nfs/dbraw/zinc/56/65/19/487566519.db2.gz IJUFNIOYVIRYKK-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO CN(Cc1ccsc1)Cc1c[nH+]cn1C ZINC000674369970 487566521 /nfs/dbraw/zinc/56/65/21/487566521.db2.gz IJUFNIOYVIRYKK-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO COc1ccc([C@H](C)[NH2+]Cc2cocn2)cc1O ZINC000685652636 487571214 /nfs/dbraw/zinc/57/12/14/487571214.db2.gz MZEVCJDODSHRGA-VIFPVBQESA-N 1 2 248.282 2.240 20 0 BEADLO COC[C@@H]1CCCN1c1cc(C)[nH+]c(C2CC2)n1 ZINC000674413913 487572860 /nfs/dbraw/zinc/57/28/60/487572860.db2.gz QUFHTLDYNJVXQR-LBPRGKRZSA-N 1 2 247.342 2.278 20 0 BEADLO CCn1ccnc1[C@H](C)[NH2+]Cc1c(C)noc1C ZINC001651073990 1172921081 /nfs/dbraw/zinc/92/10/81/1172921081.db2.gz UNAHQMFUWGZZKM-JTQLQIEISA-N 1 2 248.330 2.359 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCOC3(CCC3)C2)o1 ZINC000670991458 487580352 /nfs/dbraw/zinc/58/03/52/487580352.db2.gz VMCZRYOOCRCWFC-UHFFFAOYSA-N 1 2 236.315 2.046 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCOC3(CCC3)C2)o1 ZINC000670991458 487580355 /nfs/dbraw/zinc/58/03/55/487580355.db2.gz VMCZRYOOCRCWFC-UHFFFAOYSA-N 1 2 236.315 2.046 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CCOc2ccccc2C1 ZINC000685834590 487583578 /nfs/dbraw/zinc/58/35/78/487583578.db2.gz FOQRHOXPUTVMCD-UHFFFAOYSA-N 1 2 243.310 2.113 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CCOc2ccccc2C1 ZINC000685834590 487583582 /nfs/dbraw/zinc/58/35/82/487583582.db2.gz FOQRHOXPUTVMCD-UHFFFAOYSA-N 1 2 243.310 2.113 20 0 BEADLO CC[C@H](C)CCC(=O)N[C@H]1CCc2c[nH+]cn2C1 ZINC000672156779 487589703 /nfs/dbraw/zinc/58/97/03/487589703.db2.gz UNKGRKLIYQPZFB-RYUDHWBXSA-N 1 2 249.358 2.140 20 0 BEADLO c1nc(C[NH2+]Cc2ccc3cccnc3c2)c[nH]1 ZINC001651420035 1172951677 /nfs/dbraw/zinc/95/16/77/1172951677.db2.gz HIRPIDJHZMMBIQ-UHFFFAOYSA-N 1 2 238.294 2.248 20 0 BEADLO CCC(CC)C[N@@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000661412062 487597443 /nfs/dbraw/zinc/59/74/43/487597443.db2.gz CJPNQNLZKLWWNB-SNVBAGLBSA-N 1 2 221.291 2.125 20 0 BEADLO CCC(CC)C[N@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000661412062 487597447 /nfs/dbraw/zinc/59/74/47/487597447.db2.gz CJPNQNLZKLWWNB-SNVBAGLBSA-N 1 2 221.291 2.125 20 0 BEADLO CCc1nn(C)cc1C[N@H+](C)Cc1ccccn1 ZINC000680477453 487603913 /nfs/dbraw/zinc/60/39/13/487603913.db2.gz KJNDSZKPNJTONB-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO CCc1nn(C)cc1C[N@@H+](C)Cc1ccccn1 ZINC000680477453 487603916 /nfs/dbraw/zinc/60/39/16/487603916.db2.gz KJNDSZKPNJTONB-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)C1(C2CCC2)CCC1 ZINC000456058817 487604822 /nfs/dbraw/zinc/60/48/22/487604822.db2.gz XOCFXDQBJJEUAH-UHFFFAOYSA-N 1 2 247.342 2.007 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@@](C)(C(F)F)C2)o1 ZINC000668823680 487604885 /nfs/dbraw/zinc/60/48/85/487604885.db2.gz BECAFAMQIQPJKE-GFCCVEGCSA-N 1 2 245.269 2.444 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@@](C)(C(F)F)C2)o1 ZINC000668823680 487604891 /nfs/dbraw/zinc/60/48/91/487604891.db2.gz BECAFAMQIQPJKE-GFCCVEGCSA-N 1 2 245.269 2.444 20 0 BEADLO Cc1cc(NC(=O)N2CCC23CCCC3)cc[nH+]1 ZINC000650106313 409585860 /nfs/dbraw/zinc/58/58/60/409585860.db2.gz STHZQIWYLXKRSS-UHFFFAOYSA-N 1 2 245.326 2.362 20 0 BEADLO CC(C)c1cccc(C[N@H+]2CC(=O)N[C@H](C)C2)c1 ZINC000660726223 409656203 /nfs/dbraw/zinc/65/62/03/409656203.db2.gz VMAZPMCWMZEYDY-GFCCVEGCSA-N 1 2 246.354 2.130 20 0 BEADLO CC(C)c1cccc(C[N@@H+]2CC(=O)N[C@H](C)C2)c1 ZINC000660726223 409656210 /nfs/dbraw/zinc/65/62/10/409656210.db2.gz VMAZPMCWMZEYDY-GFCCVEGCSA-N 1 2 246.354 2.130 20 0 BEADLO CCc1c(C)nn(CCCn2cc[nH+]c2)c1C ZINC000680523212 487610750 /nfs/dbraw/zinc/61/07/50/487610750.db2.gz KHAWOUSZVSEALA-UHFFFAOYSA-N 1 2 232.331 2.349 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1NC(=O)CCCn1cc[nH+]c1 ZINC000655266589 409769748 /nfs/dbraw/zinc/76/97/48/409769748.db2.gz JGXSPNPBQACZKY-GXTWGEPZSA-N 1 2 249.358 2.214 20 0 BEADLO Cc1nocc1C[N@@H+]1CCC(=O)CC12CCC2 ZINC000660821654 409790562 /nfs/dbraw/zinc/79/05/62/409790562.db2.gz YUARXJPBUMDMKH-UHFFFAOYSA-N 1 2 234.299 2.071 20 0 BEADLO Cc1nocc1C[N@H+]1CCC(=O)CC12CCC2 ZINC000660821654 409790570 /nfs/dbraw/zinc/79/05/70/409790570.db2.gz YUARXJPBUMDMKH-UHFFFAOYSA-N 1 2 234.299 2.071 20 0 BEADLO C[C@@H](CF)[NH2+]Cc1n[nH]c2ccccc21 ZINC000308829485 409907570 /nfs/dbraw/zinc/90/75/70/409907570.db2.gz FRRFTVJHXQLZFQ-QMMMGPOBSA-N 1 2 207.252 2.011 20 0 BEADLO CSc1ccc[nH+]c1NCc1n[nH]cc1C ZINC000651971401 409943279 /nfs/dbraw/zinc/94/32/79/409943279.db2.gz DDUMFABEJXWKDL-UHFFFAOYSA-N 1 2 234.328 2.447 20 0 BEADLO COC[C@@H](C)CNc1[nH+]cccc1SC ZINC000651971483 409943666 /nfs/dbraw/zinc/94/36/66/409943666.db2.gz HKTYWJABFWJTCP-VIFPVBQESA-N 1 2 226.345 2.498 20 0 BEADLO CCOCn1c[nH+]c2c1C[C@H](C)[C@H](C)C2 ZINC000308951984 410073295 /nfs/dbraw/zinc/07/32/95/410073295.db2.gz VLZYVGVZEWBRQF-ZJUUUORDSA-N 1 2 208.305 2.248 20 0 BEADLO CCc1cc[nH+]cc1N[C@H](C)[C@@H]1CCOC1 ZINC000651979792 410114526 /nfs/dbraw/zinc/11/45/26/410114526.db2.gz JQGDJQFCUHXALQ-ZYHUDNBSSA-N 1 2 220.316 2.481 20 0 BEADLO CC[C@H](O)C[NH2+]CC(F)(F)c1ccccc1C ZINC000663367316 410157817 /nfs/dbraw/zinc/15/78/17/410157817.db2.gz QBKXEZDBKXTGQJ-NSHDSACASA-N 1 2 243.297 2.447 20 0 BEADLO CCc1nc(N2CC[C@H]2C(F)F)cc(C)[nH+]1 ZINC000663944383 410392077 /nfs/dbraw/zinc/39/20/77/410392077.db2.gz AEKVHWARRKDUDZ-QMMMGPOBSA-N 1 2 227.258 2.191 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@H](C)C1CCCC1 ZINC000650789167 410434816 /nfs/dbraw/zinc/43/48/16/410434816.db2.gz BEIZLDSVXAVFNA-LLVKDONJSA-N 1 2 249.358 2.346 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC[C@@H]2c2cc[nH]n2)nc1 ZINC000664198703 410515667 /nfs/dbraw/zinc/51/56/67/410515667.db2.gz AFQCFJIEYMMWQK-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc(C[N@H+]2CCC[C@@H]2c2cc[nH]n2)nc1 ZINC000664198703 410515675 /nfs/dbraw/zinc/51/56/75/410515675.db2.gz AFQCFJIEYMMWQK-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cc(NCCCOC(C)(C)C)nc[nH+]1 ZINC000664360848 410567074 /nfs/dbraw/zinc/56/70/74/410567074.db2.gz ZEQKRKZFSJHQSY-UHFFFAOYSA-N 1 2 223.320 2.402 20 0 BEADLO C[C@@H](C(N)=O)[N@@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000661437826 410658653 /nfs/dbraw/zinc/65/86/53/410658653.db2.gz PLQHDUZPRLFJGL-JQWIXIFHSA-N 1 2 248.326 2.071 20 0 BEADLO C[C@@H](C(N)=O)[N@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000661437826 410658658 /nfs/dbraw/zinc/65/86/58/410658658.db2.gz PLQHDUZPRLFJGL-JQWIXIFHSA-N 1 2 248.326 2.071 20 0 BEADLO C[C@@H](CC(=O)N1CCC[C@@H]1C1CC1)n1cc[nH+]c1 ZINC000651254349 410885705 /nfs/dbraw/zinc/88/57/05/410885705.db2.gz MUYIGLMTAICCHL-WCQYABFASA-N 1 2 247.342 2.235 20 0 BEADLO C[C@@H]1C[C@@H](C)CN(c2cc(CO)cc[nH+]2)C1 ZINC000040864695 410896519 /nfs/dbraw/zinc/89/65/19/410896519.db2.gz LVYNJVMDHQUFNT-GHMZBOCLSA-N 1 2 220.316 2.056 20 0 BEADLO CC(C)C[NH2+]c1ccc(-n2nccn2)cc1 ZINC000037128264 167016234 /nfs/dbraw/zinc/01/62/34/167016234.db2.gz OMSVMYSWBXOAHW-UHFFFAOYSA-N 1 2 216.288 2.335 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)[C@H]1C[C@@H]1C1CCCC1 ZINC000651292532 410904441 /nfs/dbraw/zinc/90/44/41/410904441.db2.gz NVTNZKVYSJXCJI-NEPJUHHUSA-N 1 2 247.342 2.194 20 0 BEADLO CC(C)NC(=O)[C@H]1CCc2[nH+]c(C(C)C)[nH]c2C1 ZINC000336451570 167083721 /nfs/dbraw/zinc/08/37/21/167083721.db2.gz SAUZQLGZFBQNGD-JTQLQIEISA-N 1 2 249.358 2.163 20 0 BEADLO CC(C)NC(=O)[C@H]1CCc2[nH]c(C(C)C)[nH+]c2C1 ZINC000336451570 167083723 /nfs/dbraw/zinc/08/37/23/167083723.db2.gz SAUZQLGZFBQNGD-JTQLQIEISA-N 1 2 249.358 2.163 20 0 BEADLO CC(C)Nc1ccc(Cn2cc[nH+]c2)cn1 ZINC000309316930 167144562 /nfs/dbraw/zinc/14/45/62/167144562.db2.gz DGOSKFCQJPKING-UHFFFAOYSA-N 1 2 216.288 2.147 20 0 BEADLO CC(C)OC(=O)[C@@H]1CN(c2cccc[nH+]2)C[C@H]1C ZINC000353637062 167167626 /nfs/dbraw/zinc/16/76/26/167167626.db2.gz JNMXBZOVQKEKRX-VXGBXAGGSA-N 1 2 248.326 2.106 20 0 BEADLO CC(C)OC(=O)[C@@H](c1ccccc1)[NH+](C)C ZINC000356096865 167168298 /nfs/dbraw/zinc/16/82/98/167168298.db2.gz WHPRYEDLGSSICP-GFCCVEGCSA-N 1 2 221.300 2.241 20 0 BEADLO CC(C)OC[C@H](C)[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000337245514 167266102 /nfs/dbraw/zinc/26/61/02/167266102.db2.gz HGFQLYOCWOFFBG-WDEREUQCSA-N 1 2 245.363 2.120 20 0 BEADLO Cc1cccc(C[NH2+]Cc2cocn2)c1F ZINC000397822404 410936840 /nfs/dbraw/zinc/93/68/40/410936840.db2.gz VEWOCVHAGVMNRK-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO CC(C)SCCOCc1[nH]cc[nH+]1 ZINC000308224919 167334447 /nfs/dbraw/zinc/33/44/47/167334447.db2.gz DNPOXLVWEQNFNU-UHFFFAOYSA-N 1 2 200.307 2.068 20 0 BEADLO CC(C)[C@@H](C)C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000336537287 167347844 /nfs/dbraw/zinc/34/78/44/167347844.db2.gz OQVWNIKWWNAGBE-MNOVXSKESA-N 1 2 235.331 2.365 20 0 BEADLO CC(C)[C@@H](C)C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000336549417 167348165 /nfs/dbraw/zinc/34/81/65/167348165.db2.gz DLESGNXJFWKMNG-LLVKDONJSA-N 1 2 249.358 2.408 20 0 BEADLO CC(C)[C@@H](C)C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000336549417 167348167 /nfs/dbraw/zinc/34/81/67/167348167.db2.gz DLESGNXJFWKMNG-LLVKDONJSA-N 1 2 249.358 2.408 20 0 BEADLO CCc1cc(N[C@@H]2C[C@H]3C[C@H]3C2)nc[nH+]1 ZINC000397641381 410930431 /nfs/dbraw/zinc/93/04/31/410930431.db2.gz AXOYKTZCXOUGLV-DOFRTFSJSA-N 1 2 203.289 2.249 20 0 BEADLO CCC[C@@H](C[NH2+][C@@H](C)c1cn[nH]c1C)OC ZINC000651374155 410959684 /nfs/dbraw/zinc/95/96/84/410959684.db2.gz IAOIZIUCSVYMCQ-ONGXEEELSA-N 1 2 225.336 2.184 20 0 BEADLO CCC[C@@H](C)[C@@H](CO)Nc1cc(CC)[nH+]cn1 ZINC000651384262 410966265 /nfs/dbraw/zinc/96/62/65/410966265.db2.gz IIPRAEXDZPUKLU-ZYHUDNBSSA-N 1 2 237.347 2.248 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)CN1c1cc(C)[nH+]cn1 ZINC000651396752 410978310 /nfs/dbraw/zinc/97/83/10/410978310.db2.gz CBIVLTKMNRAJKJ-NEPJUHHUSA-N 1 2 235.331 2.179 20 0 BEADLO CC[C@H]1CN(c2cc[nH+]c(C3CC3)n2)[C@@H](C)CO1 ZINC000651405341 410986307 /nfs/dbraw/zinc/98/63/07/410986307.db2.gz OFAPGABJAVICHN-JQWIXIFHSA-N 1 2 247.342 2.358 20 0 BEADLO CCc1nc(N2C[C@@H](CC)OC[C@H]2C)cc(C)[nH+]1 ZINC000651405720 410986379 /nfs/dbraw/zinc/98/63/79/410986379.db2.gz WVOJNWZUNZKTJO-VXGBXAGGSA-N 1 2 249.358 2.351 20 0 BEADLO CC[C@@H]1CN(c2cc[nH+]c(C3CC3)n2)[C@@H](C)CO1 ZINC000651405340 410987058 /nfs/dbraw/zinc/98/70/58/410987058.db2.gz OFAPGABJAVICHN-CMPLNLGQSA-N 1 2 247.342 2.358 20 0 BEADLO Cc1nc(N2CC[C@]3(CC3(F)F)C2)cc[nH+]1 ZINC000651487662 411066743 /nfs/dbraw/zinc/06/67/43/411066743.db2.gz DXNYNTOUVIIASF-JTQLQIEISA-N 1 2 225.242 2.021 20 0 BEADLO Cc1nc(N2CC[C@@]3(CC3(F)F)C2)cc[nH+]1 ZINC000651487663 411067663 /nfs/dbraw/zinc/06/76/63/411067663.db2.gz DXNYNTOUVIIASF-SNVBAGLBSA-N 1 2 225.242 2.021 20 0 BEADLO CCc1cccc(C[NH2+]Cc2csnn2)c1 ZINC000652032816 411083841 /nfs/dbraw/zinc/08/38/41/411083841.db2.gz CPYLTSLYWRRNAA-UHFFFAOYSA-N 1 2 233.340 2.390 20 0 BEADLO CCC1CN(Cc2cc(OC)cc(C)[nH+]2)C1 ZINC000651610239 411130055 /nfs/dbraw/zinc/13/00/55/411130055.db2.gz PLTLRPCHEULHLP-UHFFFAOYSA-N 1 2 220.316 2.240 20 0 BEADLO C[C@H](CC(=O)N1CC[C@H]2CCC[C@H]21)n1cc[nH+]c1 ZINC000651781278 411143300 /nfs/dbraw/zinc/14/33/00/411143300.db2.gz GHJHNGRAYPTDSU-JHJVBQTASA-N 1 2 247.342 2.235 20 0 BEADLO Cc1cc(C)c(CNC(=O)c2nccs2)c[nH+]1 ZINC000652175390 411164303 /nfs/dbraw/zinc/16/43/03/411164303.db2.gz KWCMHFHYVDPMSC-UHFFFAOYSA-N 1 2 247.323 2.085 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC[C@H]2c2cc[nH]n2)cn1 ZINC000653648773 411156047 /nfs/dbraw/zinc/15/60/47/411156047.db2.gz ITCQWEBQKHXCIW-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc(C[N@H+]2CCC[C@H]2c2cc[nH]n2)cn1 ZINC000653648773 411156049 /nfs/dbraw/zinc/15/60/49/411156049.db2.gz ITCQWEBQKHXCIW-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)C[C@H]1CCCCC1(C)C ZINC000659995490 411161183 /nfs/dbraw/zinc/16/11/83/411161183.db2.gz TXNHPLZVRTXTNS-LLVKDONJSA-N 1 2 236.363 2.453 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)C[C@H]1CCCCC1(C)C ZINC000659995490 411161186 /nfs/dbraw/zinc/16/11/86/411161186.db2.gz TXNHPLZVRTXTNS-LLVKDONJSA-N 1 2 236.363 2.453 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](C)[C@H]2CCOC2)c1 ZINC000652067658 411103064 /nfs/dbraw/zinc/10/30/64/411103064.db2.gz BZSRCFQOWDIFLY-JQWIXIFHSA-N 1 2 236.315 2.065 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2C[C@@H](C)O[C@@H]2C)c1 ZINC000652067702 411103730 /nfs/dbraw/zinc/10/37/30/411103730.db2.gz DHWBWRQVOWLFIJ-CKYFFXLPSA-N 1 2 236.315 2.206 20 0 BEADLO CCOC[C@@H](C)Nc1cc(COC)cc[nH+]1 ZINC000652068604 411104784 /nfs/dbraw/zinc/10/47/84/411104784.db2.gz ITHZIGBFOXDBPJ-SNVBAGLBSA-N 1 2 224.304 2.065 20 0 BEADLO COCc1cc[nH+]c(NC[C@H]2C[C@@H]2C)c1 ZINC000652067798 411105151 /nfs/dbraw/zinc/10/51/51/411105151.db2.gz HYAGSHADZYNDEP-GXSJLCMTSA-N 1 2 206.289 2.296 20 0 BEADLO COCc1cc[nH+]c(NC[C@@H]2C[C@H]2C)c1 ZINC000652067799 411105187 /nfs/dbraw/zinc/10/51/87/411105187.db2.gz HYAGSHADZYNDEP-KOLCDFICSA-N 1 2 206.289 2.296 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2CCOC[C@@H]2C)c1 ZINC000652068177 411105451 /nfs/dbraw/zinc/10/54/51/411105451.db2.gz VJSPKHOVBUZUAG-CMPLNLGQSA-N 1 2 236.315 2.065 20 0 BEADLO COCc1cc[nH+]c(NC[C@H]2CCSC2)c1 ZINC000652068221 411105671 /nfs/dbraw/zinc/10/56/71/411105671.db2.gz WGFUFDYDFXVDRJ-LLVKDONJSA-N 1 2 238.356 2.393 20 0 BEADLO COCc1cc[nH+]c(N[C@H]2CCSC2)c1 ZINC000652068877 411107035 /nfs/dbraw/zinc/10/70/35/411107035.db2.gz RGCXOWSVZNYQFH-JTQLQIEISA-N 1 2 224.329 2.145 20 0 BEADLO CO[C@H](C[N@H+](C)CC(F)F)C1CCCC1 ZINC000659878148 411170851 /nfs/dbraw/zinc/17/08/51/411170851.db2.gz ITZQWZIHYLRZLO-SNVBAGLBSA-N 1 2 221.291 2.389 20 0 BEADLO CO[C@H](C[N@@H+](C)CC(F)F)C1CCCC1 ZINC000659878148 411170854 /nfs/dbraw/zinc/17/08/54/411170854.db2.gz ITZQWZIHYLRZLO-SNVBAGLBSA-N 1 2 221.291 2.389 20 0 BEADLO COc1ccc(N[C@@H](C)C2(OC)CCC2)[nH+]c1 ZINC000657950786 411178927 /nfs/dbraw/zinc/17/89/27/411178927.db2.gz UNPNIGSGCZYTMU-JTQLQIEISA-N 1 2 236.315 2.460 20 0 BEADLO COc1c(C)[nH+]cnc1NCc1ccoc1C ZINC000656111330 411180251 /nfs/dbraw/zinc/18/02/51/411180251.db2.gz WJXFCJIBBHBFAH-UHFFFAOYSA-N 1 2 233.271 2.307 20 0 BEADLO CCC[C@@H](NC(=O)Cn1cc[nH+]c1)C(C)(C)C ZINC000653798531 411183448 /nfs/dbraw/zinc/18/34/48/411183448.db2.gz UKVJMEYMFIZASR-LLVKDONJSA-N 1 2 237.347 2.214 20 0 BEADLO COc1c(C)[nH+]cnc1NC[C@@H](C)C(C)C ZINC000656128678 411184372 /nfs/dbraw/zinc/18/43/72/411184372.db2.gz ZERVETVNIXOUEK-SECBINFHSA-N 1 2 223.320 2.498 20 0 BEADLO COc1c(C)[nH+]cnc1N1C[C@@H]2CCC[C@H]2C1 ZINC000656146980 411186109 /nfs/dbraw/zinc/18/61/09/411186109.db2.gz RQPRJGVLSWTPEL-QWRGUYRKSA-N 1 2 233.315 2.030 20 0 BEADLO COc1c(C)[nH+]cnc1N1CCCC[C@H](C)C1 ZINC000656163649 411189519 /nfs/dbraw/zinc/18/95/19/411189519.db2.gz IGHLOGGRKREINB-JTQLQIEISA-N 1 2 235.331 2.420 20 0 BEADLO c1cc(C[N@@H+]2CCC[C@H](OC3CCC3)C2)no1 ZINC000653812186 411190402 /nfs/dbraw/zinc/19/04/02/411190402.db2.gz DNSWZNYFPJPFBE-ZDUSSCGKSA-N 1 2 236.315 2.208 20 0 BEADLO c1cc(C[N@H+]2CCC[C@H](OC3CCC3)C2)no1 ZINC000653812186 411190405 /nfs/dbraw/zinc/19/04/05/411190405.db2.gz DNSWZNYFPJPFBE-ZDUSSCGKSA-N 1 2 236.315 2.208 20 0 BEADLO COc1c(C)[nH+]cnc1NCC=C(C)C ZINC000656176641 411192618 /nfs/dbraw/zinc/19/26/18/411192618.db2.gz QRAWIZOEDYEIJC-UHFFFAOYSA-N 1 2 207.277 2.172 20 0 BEADLO CO[C@@H](C)C[NH+]1Cc2cc(F)c(F)cc2C1 ZINC000653831199 411195831 /nfs/dbraw/zinc/19/58/31/411195831.db2.gz YZTPFSVOEAYPJF-QMMMGPOBSA-N 1 2 227.254 2.315 20 0 BEADLO CC[C@@H](O)C[NH+]1Cc2cc(F)c(F)cc2C1 ZINC000653833499 411196707 /nfs/dbraw/zinc/19/67/07/411196707.db2.gz KEBMKTCXMQPKDQ-SNVBAGLBSA-N 1 2 227.254 2.051 20 0 BEADLO COc1c(C)[nH+]cnc1NCCC1(F)CCC1 ZINC000656188475 411197473 /nfs/dbraw/zinc/19/74/73/411197473.db2.gz ZNLLMJYUGPZTNU-UHFFFAOYSA-N 1 2 239.294 2.488 20 0 BEADLO Cc1c[nH+]c(C)nc1NC1CC(C)(F)C1 ZINC000656192586 411198092 /nfs/dbraw/zinc/19/80/92/411198092.db2.gz GIUKAWVXNIFTCC-UHFFFAOYSA-N 1 2 209.268 2.396 20 0 BEADLO CC[C@@H]1C[C@H]1CNc1nc[nH+]c(C)c1OC ZINC000656194776 411200887 /nfs/dbraw/zinc/20/08/87/411200887.db2.gz QRNLJNGVDJJCEO-ZJUUUORDSA-N 1 2 221.304 2.252 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H](C)CCCCO ZINC000656195052 411201012 /nfs/dbraw/zinc/20/10/12/411201012.db2.gz STMGQEGSAJJNHZ-SNVBAGLBSA-N 1 2 223.320 2.056 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@H]1CCC[C@@H]2C[C@@H]21 ZINC000656199817 411205012 /nfs/dbraw/zinc/20/50/12/411205012.db2.gz DWXHJJMITXURNN-VWYCJHECSA-N 1 2 233.315 2.394 20 0 BEADLO CO[C@](C)(CO)CNc1ccc2ccccc2[nH+]1 ZINC000656205551 411207712 /nfs/dbraw/zinc/20/77/12/411207712.db2.gz IWCNVBPGCXYNDG-AWEZNQCLSA-N 1 2 246.310 2.044 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1CCS[C@@H]1C ZINC000656203593 411207739 /nfs/dbraw/zinc/20/77/39/411207739.db2.gz KNLIDEJXIWZEBX-RKDXNWHRSA-N 1 2 239.344 2.100 20 0 BEADLO Cc1c[nH+]c(CCNc2cnccn2)c(C)c1 ZINC000656211068 411210461 /nfs/dbraw/zinc/21/04/61/411210461.db2.gz OLBJRDZFJAEHAQ-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO Cc1c[nH+]c(CCNc2cc(C)ncn2)c(C)c1 ZINC000656210884 411210652 /nfs/dbraw/zinc/21/06/52/411210652.db2.gz JHAQWAGQMWQJSO-UHFFFAOYSA-N 1 2 242.326 2.451 20 0 BEADLO Cc1nc(N2CCC[C@H](OC3CCC3)C2)cc[nH+]1 ZINC000656216109 411212025 /nfs/dbraw/zinc/21/20/25/411212025.db2.gz DRVZMZHWLGLPNR-ZDUSSCGKSA-N 1 2 247.342 2.323 20 0 BEADLO COc1ccc2c(c1)CN(c1cc(C)[nH+]cn1)C2 ZINC000656222766 411214191 /nfs/dbraw/zinc/21/41/91/411214191.db2.gz PBKAARMLEFNTIR-UHFFFAOYSA-N 1 2 241.294 2.314 20 0 BEADLO C[C@@H](O)C[N@H+](Cc1ncc(Cl)s1)C1CC1 ZINC000653901833 411215885 /nfs/dbraw/zinc/21/58/85/411215885.db2.gz FEVVUADWLKYINR-SSDOTTSWSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H](O)C[N@@H+](Cc1ncc(Cl)s1)C1CC1 ZINC000653901833 411215888 /nfs/dbraw/zinc/21/58/88/411215888.db2.gz FEVVUADWLKYINR-SSDOTTSWSA-N 1 2 246.763 2.142 20 0 BEADLO CC[C@H]1C[C@H](Nc2cc(COC)cc[nH+]2)CO1 ZINC000658043398 411216655 /nfs/dbraw/zinc/21/66/55/411216655.db2.gz HEUSCOCZLSKIHD-RYUDHWBXSA-N 1 2 236.315 2.207 20 0 BEADLO Fc1cnccc1C[NH+]1CC2(CC2(F)F)C1 ZINC000656265346 411220470 /nfs/dbraw/zinc/22/04/70/411220470.db2.gz KHJCSBGITPWPFY-UHFFFAOYSA-N 1 2 228.217 2.062 20 0 BEADLO Cc1nc(C[NH2+][C@H](C)c2cncnc2C)cs1 ZINC000655698130 411246903 /nfs/dbraw/zinc/24/69/03/411246903.db2.gz XCCXXQSAVLQDFX-MRVPVSSYSA-N 1 2 248.355 2.401 20 0 BEADLO c1coc(C[NH2+][C@@H]2CCCn3ccnc32)c1 ZINC000655683936 411225710 /nfs/dbraw/zinc/22/57/10/411225710.db2.gz JIRKDVURSPFGRO-LLVKDONJSA-N 1 2 217.272 2.101 20 0 BEADLO Nc1ccc(NC(=O)[C@@H]2CCC[C@H]3C[C@H]32)c[nH+]1 ZINC000659295765 411226886 /nfs/dbraw/zinc/22/68/86/411226886.db2.gz ZJRURTMSTHMOEB-JMJZKYOTSA-N 1 2 231.299 2.039 20 0 BEADLO Cc1cc(C(=O)NC(C)(C)c2[nH]cc[nH+]2)c(C)[nH]1 ZINC000652410403 411232958 /nfs/dbraw/zinc/23/29/58/411232958.db2.gz COVPKRKLUXGZSC-UHFFFAOYSA-N 1 2 246.314 2.020 20 0 BEADLO CC[C@]1(C)C[C@H]1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000652411834 411233483 /nfs/dbraw/zinc/23/34/83/411233483.db2.gz ZNNCLNAYTAZUQU-TVQRCGJNSA-N 1 2 235.331 2.197 20 0 BEADLO C=C/C(C)=C\CC(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000652412422 411233774 /nfs/dbraw/zinc/23/37/74/411233774.db2.gz CENILDDRSREKSL-POHAHGRESA-N 1 2 233.315 2.283 20 0 BEADLO CC[C@]1(C)C[C@@H]1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000652411832 411234253 /nfs/dbraw/zinc/23/42/53/411234253.db2.gz ZNNCLNAYTAZUQU-NOZJJQNGSA-N 1 2 235.331 2.197 20 0 BEADLO CCc1cnn(Cc2ccc[nH+]c2C)c1 ZINC000655689765 411234555 /nfs/dbraw/zinc/23/45/55/411234555.db2.gz NHKDSUQCRFEFOI-UHFFFAOYSA-N 1 2 201.273 2.197 20 0 BEADLO COCCOCc1cccc(-c2[nH+]ccn2C)c1 ZINC000656371874 411237817 /nfs/dbraw/zinc/23/78/17/411237817.db2.gz ZUOFLNAGXODOIW-UHFFFAOYSA-N 1 2 246.310 2.250 20 0 BEADLO Cn1cc[nH+]c1-c1ccc(SCCO)cc1 ZINC000656371727 411238191 /nfs/dbraw/zinc/23/81/91/411238191.db2.gz QTBNDUSDUYNSSW-UHFFFAOYSA-N 1 2 234.324 2.172 20 0 BEADLO Cn1cc[nH+]c1-c1ccc2c(c1)C(=O)CCCO2 ZINC000656371805 411238336 /nfs/dbraw/zinc/23/83/36/411238336.db2.gz WDSSGAOCHFRYKJ-UHFFFAOYSA-N 1 2 242.278 2.442 20 0 BEADLO CC/C(C)=C/C(=O)NCc1ccn2cc[nH+]c2c1 ZINC000295531714 167823553 /nfs/dbraw/zinc/82/35/53/167823553.db2.gz SRLWJIXRCLYFKD-DHZHZOJOSA-N 1 2 243.310 2.307 20 0 BEADLO C[C@@H](CC(=O)N1CCC12CCCC2)n1cc[nH+]c1 ZINC000652565171 411272697 /nfs/dbraw/zinc/27/26/97/411272697.db2.gz ZMSIPOOFDUYVNL-LBPRGKRZSA-N 1 2 247.342 2.379 20 0 BEADLO COc1ccc(F)cc1CNc1c[nH]c[nH+]1 ZINC000309840995 411276950 /nfs/dbraw/zinc/27/69/50/411276950.db2.gz DCXAXRGIPYNGRP-UHFFFAOYSA-N 1 2 221.235 2.170 20 0 BEADLO O=C(NCCCCn1cc[nH+]c1)[C@@H]1CC=CCC1 ZINC000060408388 411278610 /nfs/dbraw/zinc/27/86/10/411278610.db2.gz AKXIQAKIMFYASB-CYBMUJFWSA-N 1 2 247.342 2.136 20 0 BEADLO Cc1ccc(NCCCc2cnn(C)c2)c[nH+]1 ZINC000653463972 411281144 /nfs/dbraw/zinc/28/11/44/411281144.db2.gz FZSPIRPPKSXEOG-UHFFFAOYSA-N 1 2 230.315 2.168 20 0 BEADLO Cc1cnc(CNc2c[nH+]ccc2C)o1 ZINC000653465640 411283939 /nfs/dbraw/zinc/28/39/39/411283939.db2.gz JHJBRRJGEQYKBC-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO Cc1ncc(CNc2c[nH+]cc(C)c2)o1 ZINC000653466873 411286539 /nfs/dbraw/zinc/28/65/39/411286539.db2.gz YTFYSVDIITWQQI-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1cc2n(n1)CCCC2 ZINC000655776866 411287144 /nfs/dbraw/zinc/28/71/44/411287144.db2.gz PQBISGLYDZDAJF-UHFFFAOYSA-N 1 2 245.326 2.411 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1cc(C)nc(C)n1 ZINC000659840907 411329416 /nfs/dbraw/zinc/32/94/16/411329416.db2.gz LPJCCLVTAVSDGQ-FZMZJTMJSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1cc(C)nc(C)n1 ZINC000659840907 411329418 /nfs/dbraw/zinc/32/94/18/411329418.db2.gz LPJCCLVTAVSDGQ-FZMZJTMJSA-N 1 2 249.358 2.093 20 0 BEADLO FC(F)C1C[NH+](Cc2cccc3nccn32)C1 ZINC000656689960 411329779 /nfs/dbraw/zinc/32/97/79/411329779.db2.gz DZCYKWFDLVJXNB-UHFFFAOYSA-N 1 2 237.253 2.031 20 0 BEADLO FC(F)C1CN(Cc2cccc3[nH+]ccn32)C1 ZINC000656689960 411329780 /nfs/dbraw/zinc/32/97/80/411329780.db2.gz DZCYKWFDLVJXNB-UHFFFAOYSA-N 1 2 237.253 2.031 20 0 BEADLO CC1(C)C[N@H+](Cc2cc(C3CC3)no2)CCO1 ZINC000659813683 411300436 /nfs/dbraw/zinc/30/04/36/411300436.db2.gz VWPDXYJPMHAJBW-UHFFFAOYSA-N 1 2 236.315 2.163 20 0 BEADLO CC1(C)C[N@@H+](Cc2cc(C3CC3)no2)CCO1 ZINC000659813683 411300439 /nfs/dbraw/zinc/30/04/39/411300439.db2.gz VWPDXYJPMHAJBW-UHFFFAOYSA-N 1 2 236.315 2.163 20 0 BEADLO Cc1ccc(C[NH+]2CC(C(F)F)C2)nc1 ZINC000656691335 411330403 /nfs/dbraw/zinc/33/04/03/411330403.db2.gz YPHQPFPKROQQKL-UHFFFAOYSA-N 1 2 212.243 2.087 20 0 BEADLO COc1cc(C)c(C)cc1[NH2+]CC[C@H](C)O ZINC000656659657 411318379 /nfs/dbraw/zinc/31/83/79/411318379.db2.gz FZLLKLDOMWTTAY-NSHDSACASA-N 1 2 223.316 2.495 20 0 BEADLO C[C@H]([NH2+][C@H]1C[C@H](C)n2ncnc21)c1cccnc1 ZINC000656679787 411320182 /nfs/dbraw/zinc/32/01/82/411320182.db2.gz KLOYSSDFIQZNGD-NHCYSSNCSA-N 1 2 243.314 2.030 20 0 BEADLO C[C@H]([NH2+][C@@H]1C[C@@H](C)n2ncnc21)c1ccncc1 ZINC000656678561 411322760 /nfs/dbraw/zinc/32/27/60/411322760.db2.gz ADYAQZGPUIPXBY-JFGNBEQYSA-N 1 2 243.314 2.030 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)[C@@H]1CC12CCCCC2 ZINC000336499618 411252294 /nfs/dbraw/zinc/25/22/94/411252294.db2.gz CGJPTOGNLDLUHY-NSHDSACASA-N 1 2 247.342 2.007 20 0 BEADLO Cc1cc[nH+]cc1Cc1nc([C@@H]2CCCO2)no1 ZINC000656752826 411349817 /nfs/dbraw/zinc/34/98/17/411349817.db2.gz WHYZVLDUOLCXEH-NSHDSACASA-N 1 2 245.282 2.215 20 0 BEADLO COc1cc(C[N@H+](C)Cc2occc2C)on1 ZINC000660615097 411355586 /nfs/dbraw/zinc/35/55/86/411355586.db2.gz POJVAFUKZBMBGS-UHFFFAOYSA-N 1 2 236.271 2.217 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2occc2C)on1 ZINC000660615097 411355587 /nfs/dbraw/zinc/35/55/87/411355587.db2.gz POJVAFUKZBMBGS-UHFFFAOYSA-N 1 2 236.271 2.217 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1cc(OC)no1 ZINC000659870864 411356080 /nfs/dbraw/zinc/35/60/80/411356080.db2.gz MQRQQVDZHPCTLW-UHFFFAOYSA-N 1 2 236.271 2.298 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1cc(OC)no1 ZINC000659870864 411356081 /nfs/dbraw/zinc/35/60/81/411356081.db2.gz MQRQQVDZHPCTLW-UHFFFAOYSA-N 1 2 236.271 2.298 20 0 BEADLO Cn1ccc(CNc2c[nH+]cc3c2CCCC3)n1 ZINC000656776923 411356771 /nfs/dbraw/zinc/35/67/71/411356771.db2.gz VLUMLNSEKXHPEK-UHFFFAOYSA-N 1 2 242.326 2.306 20 0 BEADLO COCCC1(C)C[NH+](Cc2nccs2)C1 ZINC000656795262 411373478 /nfs/dbraw/zinc/37/34/78/411373478.db2.gz IGVNWJNIVOQYAU-UHFFFAOYSA-N 1 2 226.345 2.002 20 0 BEADLO Cc1ccc(NCc2cc3n(n2)CCC3)c(C)[nH+]1 ZINC000656771117 411364097 /nfs/dbraw/zinc/36/40/97/411364097.db2.gz HVOHAWNVLNHCNQ-UHFFFAOYSA-N 1 2 242.326 2.453 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2nccn2C)o1 ZINC000070008279 411365781 /nfs/dbraw/zinc/36/57/81/411365781.db2.gz OTDSQTUMVJHDMV-JTQLQIEISA-N 1 2 219.288 2.172 20 0 BEADLO CC[C@@H](O)C[NH2+]CC(F)(F)c1cccc(F)c1 ZINC000656705995 411334605 /nfs/dbraw/zinc/33/46/05/411334605.db2.gz XCHIZWBQKAZRBG-LLVKDONJSA-N 1 2 247.260 2.278 20 0 BEADLO CC(C)(C)c1nc(C[N@@H+]2CC[C@@H]3C[C@@H]3C2)no1 ZINC000661971084 411339423 /nfs/dbraw/zinc/33/94/23/411339423.db2.gz HNCJVMGMOGLFFH-NXEZZACHSA-N 1 2 235.331 2.209 20 0 BEADLO CC(C)(C)c1nc(C[N@H+]2CC[C@@H]3C[C@@H]3C2)no1 ZINC000661971084 411339426 /nfs/dbraw/zinc/33/94/26/411339426.db2.gz HNCJVMGMOGLFFH-NXEZZACHSA-N 1 2 235.331 2.209 20 0 BEADLO CCCCC(=O)N1CCC[C@H](c2[nH+]ccn2C)C1 ZINC000373062209 411341585 /nfs/dbraw/zinc/34/15/85/411341585.db2.gz BDEMZBGZRPXFOO-LBPRGKRZSA-N 1 2 249.358 2.316 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NCCC(F)(F)F ZINC000121377092 411341624 /nfs/dbraw/zinc/34/16/24/411341624.db2.gz IPFJMHFRJYXSKO-UHFFFAOYSA-N 1 2 247.220 2.464 20 0 BEADLO Cc1cc[nH+]cc1Cc1nc(C2CC2)no1 ZINC000656744989 411342315 /nfs/dbraw/zinc/34/23/15/411342315.db2.gz OVFDKFJWRUJKLJ-UHFFFAOYSA-N 1 2 215.256 2.241 20 0 BEADLO Cc1ncccc1C[N@@H+]1CCC(=O)CC12CCC2 ZINC000653765146 411345684 /nfs/dbraw/zinc/34/56/84/411345684.db2.gz FSOKSFYQXHGMRT-UHFFFAOYSA-N 1 2 244.338 2.478 20 0 BEADLO Cc1ncccc1C[N@H+]1CCC(=O)CC12CCC2 ZINC000653765146 411345688 /nfs/dbraw/zinc/34/56/88/411345688.db2.gz FSOKSFYQXHGMRT-UHFFFAOYSA-N 1 2 244.338 2.478 20 0 BEADLO CC1(CC(=O)NCc2ccn3cc[nH+]c3c2)CC1 ZINC000346278422 168016255 /nfs/dbraw/zinc/01/62/55/168016255.db2.gz MLFPWMOJBQUWJJ-UHFFFAOYSA-N 1 2 243.310 2.141 20 0 BEADLO C[C@H]1CCC(C)(C)N1C(=O)CCCn1cc[nH+]c1 ZINC000662019910 411347134 /nfs/dbraw/zinc/34/71/34/411347134.db2.gz ACHDWCJVZNMSFF-LBPRGKRZSA-N 1 2 249.358 2.453 20 0 BEADLO CC1(CNC(=O)c2ccc3[nH+]ccn3c2)CCC1 ZINC000175112302 168037499 /nfs/dbraw/zinc/03/74/99/168037499.db2.gz GTWKOAYZVNDQRE-UHFFFAOYSA-N 1 2 243.310 2.254 20 0 BEADLO C[N@H+](Cc1cscn1)[C@@H]1COC(C)(C)C1 ZINC000659857902 411348720 /nfs/dbraw/zinc/34/87/20/411348720.db2.gz OFWFZFHCQGNKMH-JTQLQIEISA-N 1 2 226.345 2.142 20 0 BEADLO C[N@@H+](Cc1cscn1)[C@@H]1COC(C)(C)C1 ZINC000659857902 411348723 /nfs/dbraw/zinc/34/87/23/411348723.db2.gz OFWFZFHCQGNKMH-JTQLQIEISA-N 1 2 226.345 2.142 20 0 BEADLO CC1=C(c2ccco2)C[N@H+](Cc2cnn[nH]2)CC1 ZINC000336257128 168089166 /nfs/dbraw/zinc/08/91/66/168089166.db2.gz GXVPBAARBNAUOE-UHFFFAOYSA-N 1 2 244.298 2.077 20 0 BEADLO CC1=C(c2ccco2)C[N@@H+](Cc2cnn[nH]2)CC1 ZINC000336257128 168089167 /nfs/dbraw/zinc/08/91/67/168089167.db2.gz GXVPBAARBNAUOE-UHFFFAOYSA-N 1 2 244.298 2.077 20 0 BEADLO CC1=C(c2ccco2)C[N@H+](Cc2c[nH]nn2)CC1 ZINC000336257128 168089169 /nfs/dbraw/zinc/08/91/69/168089169.db2.gz GXVPBAARBNAUOE-UHFFFAOYSA-N 1 2 244.298 2.077 20 0 BEADLO CC1=C(c2ccco2)C[N@@H+](Cc2c[nH]nn2)CC1 ZINC000336257128 168089170 /nfs/dbraw/zinc/08/91/70/168089170.db2.gz GXVPBAARBNAUOE-UHFFFAOYSA-N 1 2 244.298 2.077 20 0 BEADLO CC1=C(c2ccco2)C[N@H+](Cc2cn[nH]n2)CC1 ZINC000336257128 168089171 /nfs/dbraw/zinc/08/91/71/168089171.db2.gz GXVPBAARBNAUOE-UHFFFAOYSA-N 1 2 244.298 2.077 20 0 BEADLO CC1=C(c2ccco2)C[N@@H+](Cc2cn[nH]n2)CC1 ZINC000336257128 168089173 /nfs/dbraw/zinc/08/91/73/168089173.db2.gz GXVPBAARBNAUOE-UHFFFAOYSA-N 1 2 244.298 2.077 20 0 BEADLO CC1=CCC[C@H](C)[C@H]1C[N@H+](C)Cc1nnc[nH]1 ZINC000191074492 168103403 /nfs/dbraw/zinc/10/34/03/168103403.db2.gz VXBFXEZHMLBRDA-RYUDHWBXSA-N 1 2 234.347 2.229 20 0 BEADLO CC1=CCC[C@H](C)[C@H]1C[N@@H+](C)Cc1nnc[nH]1 ZINC000191074492 168103405 /nfs/dbraw/zinc/10/34/05/168103405.db2.gz VXBFXEZHMLBRDA-RYUDHWBXSA-N 1 2 234.347 2.229 20 0 BEADLO CC1=C[C@H](C)C[C@H](C[N@H+]2CC(=O)N(C3CC3)C2)C1 ZINC000356415000 168129946 /nfs/dbraw/zinc/12/99/46/168129946.db2.gz CPRZZWHIWFPOCU-AAEUAGOBSA-N 1 2 248.370 2.243 20 0 BEADLO CC1=C[C@H](C)C[C@H](C[N@@H+]2CC(=O)N(C3CC3)C2)C1 ZINC000356415000 168129948 /nfs/dbraw/zinc/12/99/48/168129948.db2.gz CPRZZWHIWFPOCU-AAEUAGOBSA-N 1 2 248.370 2.243 20 0 BEADLO CC1CCC(=CC(=O)NC2=[NH+]CCS2)CC1 ZINC000114634389 168149827 /nfs/dbraw/zinc/14/98/27/168149827.db2.gz ZPHPCSVCZMCUMM-UHFFFAOYSA-N 1 2 238.356 2.342 20 0 BEADLO CC1CCC(C)(NC(=O)CCc2[nH]cc[nH+]2)CC1 ZINC000279455704 168151210 /nfs/dbraw/zinc/15/12/10/168151210.db2.gz OJFFDPGPTHAKDB-UHFFFAOYSA-N 1 2 249.358 2.427 20 0 BEADLO CC1CCC(N(C)C(=O)CCc2[nH]cc[nH+]2)CC1 ZINC000279176639 168158334 /nfs/dbraw/zinc/15/83/34/168158334.db2.gz HQQFVDFOUJFMTK-UHFFFAOYSA-N 1 2 249.358 2.379 20 0 BEADLO CCC(=O)CC[N@@H+]1CCOC[C@@H]1c1ccccc1 ZINC000375425542 168203305 /nfs/dbraw/zinc/20/33/05/168203305.db2.gz KRHROLRKIVZWMW-OAHLLOKOSA-N 1 2 247.338 2.429 20 0 BEADLO CCC(=O)CC[N@H+]1CCOC[C@@H]1c1ccccc1 ZINC000375425542 168203306 /nfs/dbraw/zinc/20/33/06/168203306.db2.gz KRHROLRKIVZWMW-OAHLLOKOSA-N 1 2 247.338 2.429 20 0 BEADLO CCC(=O)CC[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000276931823 168203423 /nfs/dbraw/zinc/20/34/23/168203423.db2.gz TULKAKDPRQTAMQ-OAHLLOKOSA-N 1 2 247.338 2.429 20 0 BEADLO CCC(=O)CC[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000276931823 168203425 /nfs/dbraw/zinc/20/34/25/168203425.db2.gz TULKAKDPRQTAMQ-OAHLLOKOSA-N 1 2 247.338 2.429 20 0 BEADLO CCC(=O)N(C)[C@@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000294230202 168212696 /nfs/dbraw/zinc/21/26/96/168212696.db2.gz QJAHJWHIUZDPBU-CYBMUJFWSA-N 1 2 243.310 2.368 20 0 BEADLO CCC(=O)N1CCCC[C@H]1c1[nH+]ccn1CC ZINC000281476344 168217114 /nfs/dbraw/zinc/21/71/14/168217114.db2.gz CUXBWTWKZMSBSV-NSHDSACASA-N 1 2 235.331 2.367 20 0 BEADLO c1nn[nH]c1CC[N@@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000659926788 411384104 /nfs/dbraw/zinc/38/41/04/411384104.db2.gz ORFPGLIAGNLLNF-CQSZACIVSA-N 1 2 246.358 2.170 20 0 BEADLO c1nn[nH]c1CC[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000659926788 411384110 /nfs/dbraw/zinc/38/41/10/411384110.db2.gz ORFPGLIAGNLLNF-CQSZACIVSA-N 1 2 246.358 2.170 20 0 BEADLO CCC(C)(C)NC(=O)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000336533030 168295614 /nfs/dbraw/zinc/29/56/14/168295614.db2.gz MUIILAGLIOOGTQ-SECBINFHSA-N 1 2 235.331 2.134 20 0 BEADLO CCC(C)(C)NC(=O)[C@@H]1CCCc2[nH]c[nH+]c21 ZINC000336533030 168295617 /nfs/dbraw/zinc/29/56/17/168295617.db2.gz MUIILAGLIOOGTQ-SECBINFHSA-N 1 2 235.331 2.134 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc(C3CC3)no2)C[C@H](C)O1 ZINC000659814514 411461788 /nfs/dbraw/zinc/46/17/88/411461788.db2.gz RMVBRHZJNXGGNM-AOOOYVTPSA-N 1 2 236.315 2.161 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc(C3CC3)no2)C[C@H](C)O1 ZINC000659814514 411461789 /nfs/dbraw/zinc/46/17/89/411461789.db2.gz RMVBRHZJNXGGNM-AOOOYVTPSA-N 1 2 236.315 2.161 20 0 BEADLO COc1cc(C[N@H+](C)Cc2ccco2)sn1 ZINC000659815907 411462039 /nfs/dbraw/zinc/46/20/39/411462039.db2.gz MARXRRMUALFVDH-UHFFFAOYSA-N 1 2 238.312 2.377 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2ccco2)sn1 ZINC000659815907 411462041 /nfs/dbraw/zinc/46/20/41/411462041.db2.gz MARXRRMUALFVDH-UHFFFAOYSA-N 1 2 238.312 2.377 20 0 BEADLO CC(C)CC1(CNC(=O)CCn2cc[nH+]c2)CC1 ZINC000268206943 411422769 /nfs/dbraw/zinc/42/27/69/411422769.db2.gz HNJNIDNKEGWDRZ-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO CC(C)n1cc[nH+]c1CNCc1nccs1 ZINC000657318779 411463724 /nfs/dbraw/zinc/46/37/24/411463724.db2.gz WDHPVKKCFWYMHS-UHFFFAOYSA-N 1 2 236.344 2.210 20 0 BEADLO Cc1[nH]c(CN[C@@H](C)c2ccccn2)[nH+]c1C ZINC000657287261 411446704 /nfs/dbraw/zinc/44/67/04/411446704.db2.gz JTOIWCJXTBWVPU-NSHDSACASA-N 1 2 230.315 2.272 20 0 BEADLO Cc1nc(C[NH2+][C@@H](C)c2ccccn2)[nH]c1C ZINC000657287261 411446706 /nfs/dbraw/zinc/44/67/06/411446706.db2.gz JTOIWCJXTBWVPU-NSHDSACASA-N 1 2 230.315 2.272 20 0 BEADLO COc1ccc(N[C@@H]2CCCn3cc[nH+]c32)nc1 ZINC000655742773 411446968 /nfs/dbraw/zinc/44/69/68/411446968.db2.gz AKGVTQYVWPQQJV-LLVKDONJSA-N 1 2 244.298 2.234 20 0 BEADLO CC[N@H+](Cc1nonc1C)Cc1ccccc1 ZINC000265155449 169914774 /nfs/dbraw/zinc/91/47/74/169914774.db2.gz RJSFRXQPUIYUHQ-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1nonc1C)Cc1ccccc1 ZINC000265155449 169914775 /nfs/dbraw/zinc/91/47/75/169914775.db2.gz RJSFRXQPUIYUHQ-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@H]1CC[C@H](c2ccccc2)C1 ZINC000280192191 411451493 /nfs/dbraw/zinc/45/14/93/411451493.db2.gz HKZUHFGFKZOVNM-XBFCOCLRSA-N 1 2 247.338 2.474 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@H]1CC[C@@H](c2ccccc2)C1 ZINC000280192172 411451844 /nfs/dbraw/zinc/45/18/44/411451844.db2.gz HKZUHFGFKZOVNM-BNOWGMLFSA-N 1 2 247.338 2.474 20 0 BEADLO CC(C)=CCC[N@@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000660391510 411453542 /nfs/dbraw/zinc/45/35/42/411453542.db2.gz SUNIWVDJBNVXPO-JTQLQIEISA-N 1 2 219.275 2.045 20 0 BEADLO CC(C)=CCC[N@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000660391510 411453544 /nfs/dbraw/zinc/45/35/44/411453544.db2.gz SUNIWVDJBNVXPO-JTQLQIEISA-N 1 2 219.275 2.045 20 0 BEADLO Cc1ncc(C[NH2+]Cc2nccn2C(C)C)o1 ZINC000657491501 411532588 /nfs/dbraw/zinc/53/25/88/411532588.db2.gz HOOKKQKYHHBFDP-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO Cc1ncc(CNCc2[nH+]ccn2C(C)C)o1 ZINC000657491501 411532590 /nfs/dbraw/zinc/53/25/90/411532590.db2.gz HOOKKQKYHHBFDP-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO CC(C)n1cc[nH+]c1CN[C@H](C)c1ccn(C)n1 ZINC000657491932 411532646 /nfs/dbraw/zinc/53/26/46/411532646.db2.gz NKLCJPLYPBHPCK-LLVKDONJSA-N 1 2 247.346 2.048 20 0 BEADLO CC(C)n1ccnc1C[NH2+][C@H](C)c1ccn(C)n1 ZINC000657491932 411532648 /nfs/dbraw/zinc/53/26/48/411532648.db2.gz NKLCJPLYPBHPCK-LLVKDONJSA-N 1 2 247.346 2.048 20 0 BEADLO Cn1ncc(C2CC2)c1C[NH2+]Cc1cscn1 ZINC000657337592 411471780 /nfs/dbraw/zinc/47/17/80/411471780.db2.gz ANHJOLAHWXVIRE-UHFFFAOYSA-N 1 2 248.355 2.044 20 0 BEADLO CCn1ccnc1C[NH2+]Cc1ccc(C)o1 ZINC000053036777 411474769 /nfs/dbraw/zinc/47/47/69/411474769.db2.gz BCCXKOVGOYLLRT-UHFFFAOYSA-N 1 2 219.288 2.094 20 0 BEADLO CC1(C)COCC[N@@H+]1Cc1cc(C2CC2)no1 ZINC000659859384 411481475 /nfs/dbraw/zinc/48/14/75/411481475.db2.gz ZQMRZXNLGZBXJN-UHFFFAOYSA-N 1 2 236.315 2.163 20 0 BEADLO CC1(C)COCC[N@H+]1Cc1cc(C2CC2)no1 ZINC000659859384 411481477 /nfs/dbraw/zinc/48/14/77/411481477.db2.gz ZQMRZXNLGZBXJN-UHFFFAOYSA-N 1 2 236.315 2.163 20 0 BEADLO CCC[N@H+](CCO[C@H]1CC1(F)F)CC(F)F ZINC000659868449 411482778 /nfs/dbraw/zinc/48/27/78/411482778.db2.gz OIWFSKGOKTZEFD-QMMMGPOBSA-N 1 2 243.244 2.388 20 0 BEADLO CCC[N@@H+](CCO[C@H]1CC1(F)F)CC(F)F ZINC000659868449 411482779 /nfs/dbraw/zinc/48/27/79/411482779.db2.gz OIWFSKGOKTZEFD-QMMMGPOBSA-N 1 2 243.244 2.388 20 0 BEADLO CC[C@H]1C[C@@H](Nc2ccc(OC)c[nH+]2)CO1 ZINC000657402065 411496408 /nfs/dbraw/zinc/49/64/08/411496408.db2.gz LARKIUZJCDZAFC-ZJUUUORDSA-N 1 2 222.288 2.070 20 0 BEADLO CC[C@H]1C[N@H+](Cc2nc(C)oc2C)C[C@H](C)O1 ZINC000659920950 411499320 /nfs/dbraw/zinc/49/93/20/411499320.db2.gz YCFFLJROJGXADB-CABZTGNLSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2nc(C)oc2C)C[C@H](C)O1 ZINC000659920950 411499324 /nfs/dbraw/zinc/49/93/24/411499324.db2.gz YCFFLJROJGXADB-CABZTGNLSA-N 1 2 238.331 2.291 20 0 BEADLO CCC1(NC(=O)C[NH+]2CC(C)(C)C2)CCCC1 ZINC000655123993 411499452 /nfs/dbraw/zinc/49/94/52/411499452.db2.gz ZUIWTPWJVCPZSL-UHFFFAOYSA-N 1 2 238.375 2.167 20 0 BEADLO Cc1c[nH]c(CNc2cnn(CC(C)C)c2)[nH+]1 ZINC000657420325 411502004 /nfs/dbraw/zinc/50/20/04/411502004.db2.gz NNRDTIGGBQNKGY-UHFFFAOYSA-N 1 2 233.319 2.183 20 0 BEADLO CCn1cc(NCc2[nH+]ccn2C(C)C)cn1 ZINC000657419053 411502438 /nfs/dbraw/zinc/50/24/38/411502438.db2.gz XEKJCNZKOCFZQA-UHFFFAOYSA-N 1 2 233.319 2.293 20 0 BEADLO COc1ccc(F)c(NCc2[nH]cc(C)[nH+]2)c1 ZINC000657421374 411503265 /nfs/dbraw/zinc/50/32/65/411503265.db2.gz MUZGHXBWAAQWNQ-UHFFFAOYSA-N 1 2 235.262 2.478 20 0 BEADLO COc1cc(C[N@@H+]2CCSC[C@@H]2C)sn1 ZINC000659945216 411506087 /nfs/dbraw/zinc/50/60/87/411506087.db2.gz UFCVHFVSLVTROC-QMMMGPOBSA-N 1 2 244.385 2.089 20 0 BEADLO COc1cc(C[N@H+]2CCSC[C@@H]2C)sn1 ZINC000659945216 411506091 /nfs/dbraw/zinc/50/60/91/411506091.db2.gz UFCVHFVSLVTROC-QMMMGPOBSA-N 1 2 244.385 2.089 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC1(C2CCC2)CC1 ZINC000655165951 411509670 /nfs/dbraw/zinc/50/96/70/411509670.db2.gz YCTMBWCSKZWORJ-SNVBAGLBSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC1(C2CCC2)CC1 ZINC000655165951 411509672 /nfs/dbraw/zinc/50/96/72/411509672.db2.gz YCTMBWCSKZWORJ-SNVBAGLBSA-N 1 2 247.342 2.037 20 0 BEADLO Cc1nc(C[NH+]2C[C@@H](C)S[C@H](C)C2)co1 ZINC000659961524 411512459 /nfs/dbraw/zinc/51/24/59/411512459.db2.gz RMFHHXDRGIVNDP-RKDXNWHRSA-N 1 2 226.345 2.309 20 0 BEADLO C[N@H+](Cc1nccs1)[C@H]1COC(C)(C)C1 ZINC000659976540 411516319 /nfs/dbraw/zinc/51/63/19/411516319.db2.gz CCKGQDNBZBAPLS-SECBINFHSA-N 1 2 226.345 2.142 20 0 BEADLO C[N@@H+](Cc1nccs1)[C@H]1COC(C)(C)C1 ZINC000659976540 411516321 /nfs/dbraw/zinc/51/63/21/411516321.db2.gz CCKGQDNBZBAPLS-SECBINFHSA-N 1 2 226.345 2.142 20 0 BEADLO Cc1nc(C[N@@H+](C)Cc2cccc(O)c2)co1 ZINC000659983242 411518399 /nfs/dbraw/zinc/51/83/99/411518399.db2.gz HQPJUWVTQMTKIN-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO Cc1nc(C[N@H+](C)Cc2cccc(O)c2)co1 ZINC000659983242 411518401 /nfs/dbraw/zinc/51/84/01/411518401.db2.gz HQPJUWVTQMTKIN-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO FC1(F)CCC[C@@H]1[NH2+]Cc1cnn2c1CCC2 ZINC000657467318 411520658 /nfs/dbraw/zinc/52/06/58/411520658.db2.gz IUKDVAWLRKESOC-NSHDSACASA-N 1 2 241.285 2.107 20 0 BEADLO CC(F)(F)C[NH2+]Cc1ccnn1CC1CC1 ZINC000657475094 411524066 /nfs/dbraw/zinc/52/40/66/411524066.db2.gz JBGOXEOYGMWQIF-UHFFFAOYSA-N 1 2 229.274 2.038 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC(C)(C)[C@H]2C)nc(C)n1 ZINC000660006593 411526283 /nfs/dbraw/zinc/52/62/83/411526283.db2.gz PVPDZMXADDPAKO-LLVKDONJSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1cc(C[N@H+]2CCOC(C)(C)[C@H]2C)nc(C)n1 ZINC000660006593 411526284 /nfs/dbraw/zinc/52/62/84/411526284.db2.gz PVPDZMXADDPAKO-LLVKDONJSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@H](OCC(C)C)C2)co1 ZINC000660003115 411526421 /nfs/dbraw/zinc/52/64/21/411526421.db2.gz MOMCROAPAONXIS-CYBMUJFWSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@H](OCC(C)C)C2)co1 ZINC000660003115 411526424 /nfs/dbraw/zinc/52/64/24/411526424.db2.gz MOMCROAPAONXIS-CYBMUJFWSA-N 1 2 238.331 2.230 20 0 BEADLO CC(C)[N@H+](CCO[C@H]1CC1(F)F)CC(F)F ZINC000660017966 411528650 /nfs/dbraw/zinc/52/86/50/411528650.db2.gz POIOPEZIVWWCAF-QMMMGPOBSA-N 1 2 243.244 2.386 20 0 BEADLO CC(C)[N@@H+](CCO[C@H]1CC1(F)F)CC(F)F ZINC000660017966 411528652 /nfs/dbraw/zinc/52/86/52/411528652.db2.gz POIOPEZIVWWCAF-QMMMGPOBSA-N 1 2 243.244 2.386 20 0 BEADLO Cc1[nH]ncc1C[NH2+]C[C@@H]1CCC2(CCCC2)O1 ZINC000655860248 411540204 /nfs/dbraw/zinc/54/02/04/411540204.db2.gz DIYUYTUILCRICF-ZDUSSCGKSA-N 1 2 249.358 2.300 20 0 BEADLO CC[N@@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC000293066994 170040825 /nfs/dbraw/zinc/04/08/25/170040825.db2.gz IUATUDQMZSZRII-UHFFFAOYSA-N 1 2 213.284 2.208 20 0 BEADLO CC[N@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC000293066994 170040826 /nfs/dbraw/zinc/04/08/26/170040826.db2.gz IUATUDQMZSZRII-UHFFFAOYSA-N 1 2 213.284 2.208 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@@H]2C[C@]2(F)c2ccccc2)n1 ZINC000657496355 411535450 /nfs/dbraw/zinc/53/54/50/411535450.db2.gz RVOAZZLXMBNMBN-OCCSQVGLSA-N 1 2 245.301 2.445 20 0 BEADLO COc1cc(C[NH2+][C@H](C)c2cccc(O)c2)on1 ZINC000660192675 411552577 /nfs/dbraw/zinc/55/25/77/411552577.db2.gz UMGLSOYXFTWEKA-SECBINFHSA-N 1 2 248.282 2.240 20 0 BEADLO CCc1ccc(C[NH2+][C@@H]2C[C@H](C)n3ncnc32)o1 ZINC000657567844 411553293 /nfs/dbraw/zinc/55/32/93/411553293.db2.gz FOIHNCMCMIXVQK-JOYOIKCWSA-N 1 2 246.314 2.229 20 0 BEADLO CC[NH2+]Cc1noc(Cc2cccc(C)c2)n1 ZINC000052137761 170131997 /nfs/dbraw/zinc/13/19/97/170131997.db2.gz CYHKBDJUSSOERB-UHFFFAOYSA-N 1 2 231.299 2.078 20 0 BEADLO CC[C@@H](CC(F)F)C[N@H+](C)Cc1noc(C)n1 ZINC000660217426 411553757 /nfs/dbraw/zinc/55/37/57/411553757.db2.gz VZNAOLHJVQXJCJ-VIFPVBQESA-N 1 2 247.289 2.491 20 0 BEADLO CC[C@@H](CC(F)F)C[N@@H+](C)Cc1noc(C)n1 ZINC000660217426 411553759 /nfs/dbraw/zinc/55/37/59/411553759.db2.gz VZNAOLHJVQXJCJ-VIFPVBQESA-N 1 2 247.289 2.491 20 0 BEADLO Cc1nc(C[N@@H+]2CCO[C@H](C(C)C)C2)c(C)o1 ZINC000660222485 411556024 /nfs/dbraw/zinc/55/60/24/411556024.db2.gz VZSXCCJAGPQGLL-ZDUSSCGKSA-N 1 2 238.331 2.148 20 0 BEADLO Cc1nc(C[N@H+]2CCO[C@H](C(C)C)C2)c(C)o1 ZINC000660222485 411556026 /nfs/dbraw/zinc/55/60/26/411556026.db2.gz VZSXCCJAGPQGLL-ZDUSSCGKSA-N 1 2 238.331 2.148 20 0 BEADLO CC[NH2+][C@@](CC)(C(=O)OC)c1ccccc1 ZINC000037446769 170154838 /nfs/dbraw/zinc/15/48/38/170154838.db2.gz QHNNSASCBYEBGL-CYBMUJFWSA-N 1 2 221.300 2.074 20 0 BEADLO CCc1nnc([C@H](C)[N@@H+]2CC[C@H](C(F)F)C2)[nH]1 ZINC000660146276 411545759 /nfs/dbraw/zinc/54/57/59/411545759.db2.gz FPXHEKQVMPSPDT-YUMQZZPRSA-N 1 2 244.289 2.015 20 0 BEADLO CCc1nnc([C@H](C)[N@H+]2CC[C@H](C(F)F)C2)[nH]1 ZINC000660146276 411545761 /nfs/dbraw/zinc/54/57/61/411545761.db2.gz FPXHEKQVMPSPDT-YUMQZZPRSA-N 1 2 244.289 2.015 20 0 BEADLO Cn1cnc(C[N@@H+]2CCc3ccsc3C2)c1 ZINC000660151557 411547203 /nfs/dbraw/zinc/54/72/03/411547203.db2.gz UNFXOWCGPOOBNM-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO Cn1cnc(C[N@H+]2CCc3ccsc3C2)c1 ZINC000660151557 411547205 /nfs/dbraw/zinc/54/72/05/411547205.db2.gz UNFXOWCGPOOBNM-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO c1c(C[N@@H+]2CCOC[C@H]2C2CC2)onc1C1CC1 ZINC000660152091 411547254 /nfs/dbraw/zinc/54/72/54/411547254.db2.gz ZHZPMDICHOMOID-AWEZNQCLSA-N 1 2 248.326 2.163 20 0 BEADLO c1c(C[N@H+]2CCOC[C@H]2C2CC2)onc1C1CC1 ZINC000660152091 411547257 /nfs/dbraw/zinc/54/72/57/411547257.db2.gz ZHZPMDICHOMOID-AWEZNQCLSA-N 1 2 248.326 2.163 20 0 BEADLO Cc1nc(C[N@@H+]2CCOC3(CCC3)C2)c(C)o1 ZINC000660153998 411547790 /nfs/dbraw/zinc/54/77/90/411547790.db2.gz FXQHDQLGJREILB-UHFFFAOYSA-N 1 2 236.315 2.046 20 0 BEADLO Cc1nc(C[N@H+]2CCOC3(CCC3)C2)c(C)o1 ZINC000660153998 411547792 /nfs/dbraw/zinc/54/77/92/411547792.db2.gz FXQHDQLGJREILB-UHFFFAOYSA-N 1 2 236.315 2.046 20 0 BEADLO CCOC(=O)CCCCC[N@@H+]1CCC(F)(F)C1 ZINC000313273862 170199044 /nfs/dbraw/zinc/19/90/44/170199044.db2.gz DJPSTEPCUROOPM-UHFFFAOYSA-N 1 2 249.301 2.451 20 0 BEADLO CCOC(=O)CCCCC[N@H+]1CCC(F)(F)C1 ZINC000313273862 170199045 /nfs/dbraw/zinc/19/90/45/170199045.db2.gz DJPSTEPCUROOPM-UHFFFAOYSA-N 1 2 249.301 2.451 20 0 BEADLO CCOC(=O)CCCC[N@@H+]1CCC[C@H]1C(F)F ZINC000353179023 170199769 /nfs/dbraw/zinc/19/97/69/170199769.db2.gz YHHYLQXDZNGKIC-JTQLQIEISA-N 1 2 249.301 2.449 20 0 BEADLO CCOC(=O)CCCC[N@H+]1CCC[C@H]1C(F)F ZINC000353179023 170199770 /nfs/dbraw/zinc/19/97/70/170199770.db2.gz YHHYLQXDZNGKIC-JTQLQIEISA-N 1 2 249.301 2.449 20 0 BEADLO CCOC(=O)CCC[N@@H+]1CCCC[C@@H]1C(F)F ZINC000337515232 170200366 /nfs/dbraw/zinc/20/03/66/170200366.db2.gz LINKEUJIWAGKER-SNVBAGLBSA-N 1 2 249.301 2.449 20 0 BEADLO CCOC(=O)CCC[N@H+]1CCCC[C@@H]1C(F)F ZINC000337515232 170200368 /nfs/dbraw/zinc/20/03/68/170200368.db2.gz LINKEUJIWAGKER-SNVBAGLBSA-N 1 2 249.301 2.449 20 0 BEADLO CCOC(=O)C[N@H+](C)C/C=C/c1ccccc1 ZINC000050066541 170213990 /nfs/dbraw/zinc/21/39/90/170213990.db2.gz ZXBVJLYHGKJOPV-JXMROGBWSA-N 1 2 233.311 2.195 20 0 BEADLO CCOC(=O)C[N@@H+](C)C/C=C/c1ccccc1 ZINC000050066541 170213991 /nfs/dbraw/zinc/21/39/91/170213991.db2.gz ZXBVJLYHGKJOPV-JXMROGBWSA-N 1 2 233.311 2.195 20 0 BEADLO CCOC(=O)C[N@H+](C)CCc1ccc(C)cc1 ZINC000124105823 170214422 /nfs/dbraw/zinc/21/44/22/170214422.db2.gz FIWGFWUGYACSOH-UHFFFAOYSA-N 1 2 235.327 2.032 20 0 BEADLO CCOC(=O)C[N@@H+](C)CCc1ccc(C)cc1 ZINC000124105823 170214423 /nfs/dbraw/zinc/21/44/23/170214423.db2.gz FIWGFWUGYACSOH-UHFFFAOYSA-N 1 2 235.327 2.032 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1cccc(C)c1C ZINC000128565106 170214800 /nfs/dbraw/zinc/21/48/00/170214800.db2.gz GHPXECDYABXVJJ-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1cccc(C)c1C ZINC000128565106 170214803 /nfs/dbraw/zinc/21/48/03/170214803.db2.gz GHPXECDYABXVJJ-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO CCOC(=O)C[N@@H+]1CCc2ccccc2[C@@H]1C ZINC000171630039 170221141 /nfs/dbraw/zinc/22/11/41/170221141.db2.gz AICFXNGPDBMICT-NSHDSACASA-N 1 2 233.311 2.169 20 0 BEADLO CCOC(=O)C[N@H+]1CCc2ccccc2[C@@H]1C ZINC000171630039 170221142 /nfs/dbraw/zinc/22/11/42/170221142.db2.gz AICFXNGPDBMICT-NSHDSACASA-N 1 2 233.311 2.169 20 0 BEADLO CCOC(=O)C[N@@H+]1Cc2ccccc2C(C)(C)C1 ZINC000340235929 170222070 /nfs/dbraw/zinc/22/20/70/170222070.db2.gz PMNUUNPGVNOUNL-UHFFFAOYSA-N 1 2 247.338 2.343 20 0 BEADLO CCOC(=O)C[N@H+]1Cc2ccccc2C(C)(C)C1 ZINC000340235929 170222071 /nfs/dbraw/zinc/22/20/71/170222071.db2.gz PMNUUNPGVNOUNL-UHFFFAOYSA-N 1 2 247.338 2.343 20 0 BEADLO CCOC(=O)C[NH2+][C@@H](CC)c1ccccc1 ZINC000037472481 170226436 /nfs/dbraw/zinc/22/64/36/170226436.db2.gz MABZWFSZOUFBEN-LBPRGKRZSA-N 1 2 221.300 2.290 20 0 BEADLO CCOC(=O)COc1ccc([NH2+]CC2CC2)cc1 ZINC000183919233 170228783 /nfs/dbraw/zinc/22/87/83/170228783.db2.gz KRVUNJVJVNIQEX-UHFFFAOYSA-N 1 2 249.310 2.450 20 0 BEADLO CCOC(=O)N1CCC(Nc2cccc[nH+]2)CC1 ZINC000013580405 170239128 /nfs/dbraw/zinc/23/91/28/170239128.db2.gz LIKFZBWZGQWAMR-UHFFFAOYSA-N 1 2 249.314 2.114 20 0 BEADLO CCOC(=O)[C@@H](CC)[N@H+](C)Cc1ccoc1C ZINC000084120613 170249562 /nfs/dbraw/zinc/24/95/62/170249562.db2.gz YOSXZNKUODZQLH-GFCCVEGCSA-N 1 2 239.315 2.362 20 0 BEADLO CCOC(=O)[C@@H](CC)[N@@H+](C)Cc1ccoc1C ZINC000084120613 170249564 /nfs/dbraw/zinc/24/95/64/170249564.db2.gz YOSXZNKUODZQLH-GFCCVEGCSA-N 1 2 239.315 2.362 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[N@@H+]1CC[C@@](C)(F)C1 ZINC000360206569 170249890 /nfs/dbraw/zinc/24/98/90/170249890.db2.gz BERISQMKOXHONE-DGCLKSJQSA-N 1 2 245.338 2.398 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[N@H+]1CC[C@@](C)(F)C1 ZINC000360206569 170249891 /nfs/dbraw/zinc/24/98/91/170249891.db2.gz BERISQMKOXHONE-DGCLKSJQSA-N 1 2 245.338 2.398 20 0 BEADLO C[C@H](NCc1c[nH+]c2n1CCC2)c1cscn1 ZINC000657600001 411558652 /nfs/dbraw/zinc/55/86/52/411558652.db2.gz HQWBWCBRPOKCIU-VIFPVBQESA-N 1 2 248.355 2.137 20 0 BEADLO Cc1c[nH]c(CN[C@@H](C)c2cscn2)[nH+]1 ZINC000657601004 411558727 /nfs/dbraw/zinc/55/87/27/411558727.db2.gz XFMPSKZPGCOJNX-QMMMGPOBSA-N 1 2 222.317 2.025 20 0 BEADLO CCOC(=O)[C@@H]1CCC[N@@H+]1Cc1ccsc1 ZINC000050064970 170257970 /nfs/dbraw/zinc/25/79/70/170257970.db2.gz RSNZUFRUXASGMQ-NSHDSACASA-N 1 2 239.340 2.276 20 0 BEADLO CCOC(=O)[C@@H]1CCC[N@H+]1Cc1ccsc1 ZINC000050064970 170257971 /nfs/dbraw/zinc/25/79/71/170257971.db2.gz RSNZUFRUXASGMQ-NSHDSACASA-N 1 2 239.340 2.276 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+](C)Cc1ccc(F)cc1 ZINC000043638673 170265838 /nfs/dbraw/zinc/26/58/38/170265838.db2.gz YEETZPAJTFZSBR-JTQLQIEISA-N 1 2 239.290 2.209 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+](C)Cc1ccc(F)cc1 ZINC000043638673 170265839 /nfs/dbraw/zinc/26/58/39/170265839.db2.gz YEETZPAJTFZSBR-JTQLQIEISA-N 1 2 239.290 2.209 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+]Cc1c(C)cccc1C ZINC000083362438 170268193 /nfs/dbraw/zinc/26/81/93/170268193.db2.gz ISUPUVCPXYMKHN-LBPRGKRZSA-N 1 2 235.327 2.345 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[NH2+][C@H]1CCSC1 ZINC000336776661 170271417 /nfs/dbraw/zinc/27/14/17/170271417.db2.gz GGGQDQHFYFLDMR-QWRGUYRKSA-N 1 2 245.388 2.059 20 0 BEADLO CCOC1CC(CCNc2cc(C)[nH+]cn2)C1 ZINC000302680357 170322967 /nfs/dbraw/zinc/32/29/67/170322967.db2.gz ORWNCNXFXDXOQQ-UHFFFAOYSA-N 1 2 235.331 2.402 20 0 BEADLO OC[C@H]1CC(F)(F)C[N@@H+]1CCCC1CCC1 ZINC000660371392 411574169 /nfs/dbraw/zinc/57/41/69/411574169.db2.gz ISYJRVUHTNVHNQ-LLVKDONJSA-N 1 2 233.302 2.269 20 0 BEADLO OC[C@H]1CC(F)(F)C[N@H+]1CCCC1CCC1 ZINC000660371392 411574170 /nfs/dbraw/zinc/57/41/70/411574170.db2.gz ISYJRVUHTNVHNQ-LLVKDONJSA-N 1 2 233.302 2.269 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)c(C)o1 ZINC000660373881 411574500 /nfs/dbraw/zinc/57/45/00/411574500.db2.gz CQJASJRVNQTQSW-GUBZILKMSA-N 1 2 238.331 2.289 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)c(C)o1 ZINC000660373881 411574502 /nfs/dbraw/zinc/57/45/02/411574502.db2.gz CQJASJRVNQTQSW-GUBZILKMSA-N 1 2 238.331 2.289 20 0 BEADLO CCOC1C[NH+](Cc2ccc(COC)cc2)C1 ZINC000297430313 170336645 /nfs/dbraw/zinc/33/66/45/170336645.db2.gz NFOQFIJBSWZURS-UHFFFAOYSA-N 1 2 235.327 2.054 20 0 BEADLO CCOC1CN(c2cc(C)[nH+]c(C(C)C)n2)C1 ZINC000338833244 170337297 /nfs/dbraw/zinc/33/72/97/170337297.db2.gz KDUWUOCGOBGXCG-UHFFFAOYSA-N 1 2 235.331 2.134 20 0 BEADLO CCOCC(=O)Cn1c[nH+]c2cc(C)c(C)cc21 ZINC000194642789 170338316 /nfs/dbraw/zinc/33/83/16/170338316.db2.gz FOUYAKAZRFNCBD-UHFFFAOYSA-N 1 2 246.310 2.259 20 0 BEADLO CCc1nocc1C[N@@H+]1C[C@H](C)O[C@@H](C)[C@H]1C ZINC000660375857 411574913 /nfs/dbraw/zinc/57/49/13/411574913.db2.gz ZNVLETMTJMZVCF-AXFHLTTASA-N 1 2 238.331 2.235 20 0 BEADLO CCc1nocc1C[N@H+]1C[C@H](C)O[C@@H](C)[C@H]1C ZINC000660375857 411574914 /nfs/dbraw/zinc/57/49/14/411574914.db2.gz ZNVLETMTJMZVCF-AXFHLTTASA-N 1 2 238.331 2.235 20 0 BEADLO CCOCC1(C(=O)Nc2cc[nH+]cc2C)CC1 ZINC000281587705 170356838 /nfs/dbraw/zinc/35/68/38/170356838.db2.gz DVHMHNCCHFQAME-UHFFFAOYSA-N 1 2 234.299 2.145 20 0 BEADLO CC(C)(C)C(F)(F)C[NH2+]C[C@H](O)C(F)(F)F ZINC000663379778 411642919 /nfs/dbraw/zinc/64/29/19/411642919.db2.gz VLUMDRIUGINTEP-LURJTMIESA-N 1 2 249.223 2.181 20 0 BEADLO Cc1cc(C[N@H+]2CC(C)(C)OC[C@@H]2C)nc(C)n1 ZINC000660407262 411580649 /nfs/dbraw/zinc/58/06/49/411580649.db2.gz MPSFFFIURZXAJT-NSHDSACASA-N 1 2 249.358 2.093 20 0 BEADLO Cc1cc(C[N@@H+]2CC(C)(C)OC[C@@H]2C)nc(C)n1 ZINC000660407262 411580651 /nfs/dbraw/zinc/58/06/51/411580651.db2.gz MPSFFFIURZXAJT-NSHDSACASA-N 1 2 249.358 2.093 20 0 BEADLO COc1cc(C[N@H+](C)Cc2cnccc2C)on1 ZINC000660450118 411586759 /nfs/dbraw/zinc/58/67/59/411586759.db2.gz CJFVLXWDEFCHPC-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2cnccc2C)on1 ZINC000660450118 411586761 /nfs/dbraw/zinc/58/67/61/411586761.db2.gz CJFVLXWDEFCHPC-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO Cc1ccccc1C(F)(F)C[NH2+][C@H]1CCOC1 ZINC000657769725 411593494 /nfs/dbraw/zinc/59/34/94/411593494.db2.gz HOVAHVYDJKUFCO-NSHDSACASA-N 1 2 241.281 2.465 20 0 BEADLO Cc1cnn(C)c1C[NH2+]CC(F)(F)C(C)(C)C ZINC000657794181 411599694 /nfs/dbraw/zinc/59/96/94/411599694.db2.gz UUXRNEVDBOLKOM-UHFFFAOYSA-N 1 2 245.317 2.500 20 0 BEADLO COc1cccc(C[NH2+]Cc2ccn[nH]2)c1C ZINC000657804800 411600345 /nfs/dbraw/zinc/60/03/45/411600345.db2.gz ORYWMERJSJHDOR-UHFFFAOYSA-N 1 2 231.299 2.017 20 0 BEADLO COc1cc(C[N@@H+]2CCCc3occc3C2)on1 ZINC000660564888 411601019 /nfs/dbraw/zinc/60/10/19/411601019.db2.gz ZJDLSBJLYAJRJM-UHFFFAOYSA-N 1 2 248.282 2.225 20 0 BEADLO COc1cc(C[N@H+]2CCCc3occc3C2)on1 ZINC000660564888 411601021 /nfs/dbraw/zinc/60/10/21/411601021.db2.gz ZJDLSBJLYAJRJM-UHFFFAOYSA-N 1 2 248.282 2.225 20 0 BEADLO CC[C@H](C)[N@H+](CC)Cc1nnn(C(C)(C)C)n1 ZINC000661102835 411707544 /nfs/dbraw/zinc/70/75/44/411707544.db2.gz AZHHGGRRLYXVFR-JTQLQIEISA-N 1 2 239.367 2.049 20 0 BEADLO CC[C@H](C)[N@@H+](CC)Cc1nnn(C(C)(C)C)n1 ZINC000661102835 411707547 /nfs/dbraw/zinc/70/75/47/411707547.db2.gz AZHHGGRRLYXVFR-JTQLQIEISA-N 1 2 239.367 2.049 20 0 BEADLO CCCN(CCO)c1[nH+]ccc2c(N)cccc21 ZINC000663647492 411714624 /nfs/dbraw/zinc/71/46/24/411714624.db2.gz WVMIUFJGTWDMDG-UHFFFAOYSA-N 1 2 245.326 2.026 20 0 BEADLO C[C@@H]1CCC[C@@H](C[N@H+](C)Cc2n[nH]c(=O)o2)C1 ZINC000660843632 411653302 /nfs/dbraw/zinc/65/33/02/411653302.db2.gz BKKPLWCESVVJKC-NXEZZACHSA-N 1 2 239.319 2.033 20 0 BEADLO C[C@@H]1CCC[C@@H](C[N@@H+](C)Cc2n[nH]c(=O)o2)C1 ZINC000660843632 411653303 /nfs/dbraw/zinc/65/33/03/411653303.db2.gz BKKPLWCESVVJKC-NXEZZACHSA-N 1 2 239.319 2.033 20 0 BEADLO C[N@H+](CCC1=CCCCC1)Cc1n[nH]c(=O)o1 ZINC000660843326 411654597 /nfs/dbraw/zinc/65/45/97/411654597.db2.gz GDYDCVOUSYOYNO-UHFFFAOYSA-N 1 2 237.303 2.098 20 0 BEADLO C[N@@H+](CCC1=CCCCC1)Cc1n[nH]c(=O)o1 ZINC000660843326 411654600 /nfs/dbraw/zinc/65/46/00/411654600.db2.gz GDYDCVOUSYOYNO-UHFFFAOYSA-N 1 2 237.303 2.098 20 0 BEADLO Cc1cc(C)cc(C[N@H+](C)Cc2n[nH]c(=O)o2)c1 ZINC000660847890 411656761 /nfs/dbraw/zinc/65/67/61/411656761.db2.gz DQQIACOGYIRZCZ-UHFFFAOYSA-N 1 2 247.298 2.024 20 0 BEADLO Cc1cc(C)cc(C[N@@H+](C)Cc2n[nH]c(=O)o2)c1 ZINC000660847890 411656763 /nfs/dbraw/zinc/65/67/63/411656763.db2.gz DQQIACOGYIRZCZ-UHFFFAOYSA-N 1 2 247.298 2.024 20 0 BEADLO Cc1nc([C@@H](C)[NH+]2CCC3(CC3)CC2)n[nH]1 ZINC000663437439 411657654 /nfs/dbraw/zinc/65/76/54/411657654.db2.gz AFOREZGSYRTEDK-SECBINFHSA-N 1 2 220.320 2.050 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cc(C)nc(C)n2)[C@H](C)CO1 ZINC000660912633 411669674 /nfs/dbraw/zinc/66/96/74/411669674.db2.gz LNYXKKWBJVVPLU-RISCZKNCSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cc(C)nc(C)n2)[C@H](C)CO1 ZINC000660912633 411669676 /nfs/dbraw/zinc/66/96/76/411669676.db2.gz LNYXKKWBJVVPLU-RISCZKNCSA-N 1 2 249.358 2.093 20 0 BEADLO C[C@H](c1csnn1)[N@@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660933330 411684274 /nfs/dbraw/zinc/68/42/74/411684274.db2.gz AGJRLCPKUOQOME-YWVKMMECSA-N 1 2 223.345 2.474 20 0 BEADLO C[C@H](c1csnn1)[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660933330 411684276 /nfs/dbraw/zinc/68/42/76/411684276.db2.gz AGJRLCPKUOQOME-YWVKMMECSA-N 1 2 223.345 2.474 20 0 BEADLO O[C@@H]1CC[N@H+](CCC2CCCC2)CC1(F)F ZINC000661401027 411769670 /nfs/dbraw/zinc/76/96/70/411769670.db2.gz NCPKMMYNLICMFF-LLVKDONJSA-N 1 2 233.302 2.269 20 0 BEADLO O[C@@H]1CC[N@@H+](CCC2CCCC2)CC1(F)F ZINC000661401027 411769672 /nfs/dbraw/zinc/76/96/72/411769672.db2.gz NCPKMMYNLICMFF-LLVKDONJSA-N 1 2 233.302 2.269 20 0 BEADLO Fc1ccc([C@H]2CC[N@@H+]2Cc2cc[nH]n2)cc1 ZINC000661514866 411793456 /nfs/dbraw/zinc/79/34/56/411793456.db2.gz SIIVHZPAABGALN-CYBMUJFWSA-N 1 2 231.274 2.496 20 0 BEADLO Fc1ccc([C@H]2CC[N@H+]2Cc2cc[nH]n2)cc1 ZINC000661514866 411793457 /nfs/dbraw/zinc/79/34/57/411793457.db2.gz SIIVHZPAABGALN-CYBMUJFWSA-N 1 2 231.274 2.496 20 0 BEADLO FC(F)[C@H]1CCN1c1cc[nH+]c(C2CC2)n1 ZINC000663946958 411786138 /nfs/dbraw/zinc/78/61/38/411786138.db2.gz XZOXIPFVJJFNTR-MRVPVSSYSA-N 1 2 225.242 2.198 20 0 BEADLO Cc1nc2[nH]ccc2c(N2C[C@@H](C)[C@@H]2C)[nH+]1 ZINC000663947947 411786985 /nfs/dbraw/zinc/78/69/85/411786985.db2.gz SJRUYGIKUOAGMG-SFYZADRCSA-N 1 2 216.288 2.111 20 0 BEADLO c1coc(C2CC[NH+](Cc3cnc[nH]3)CC2)c1 ZINC000661161769 411724417 /nfs/dbraw/zinc/72/44/17/411724417.db2.gz XXPZQXINUNLUQQ-UHFFFAOYSA-N 1 2 231.299 2.382 20 0 BEADLO C[C@@H](c1cnccn1)[N@@H+]1CCO[C@@](C)(C2CC2)C1 ZINC000661169950 411725526 /nfs/dbraw/zinc/72/55/26/411725526.db2.gz VMDRTYUFVYLMQQ-SMDDNHRTSA-N 1 2 247.342 2.039 20 0 BEADLO C[C@@H](c1cnccn1)[N@H+]1CCO[C@@](C)(C2CC2)C1 ZINC000661169950 411725531 /nfs/dbraw/zinc/72/55/31/411725531.db2.gz VMDRTYUFVYLMQQ-SMDDNHRTSA-N 1 2 247.342 2.039 20 0 BEADLO C[C@@]1(C2CC2)C[N@H+](Cc2cncs2)CCO1 ZINC000661170871 411728088 /nfs/dbraw/zinc/72/80/88/411728088.db2.gz JICYFIJGKFDZFG-LBPRGKRZSA-N 1 2 238.356 2.144 20 0 BEADLO C[C@@]1(C2CC2)C[N@@H+](Cc2cncs2)CCO1 ZINC000661170871 411728090 /nfs/dbraw/zinc/72/80/90/411728090.db2.gz JICYFIJGKFDZFG-LBPRGKRZSA-N 1 2 238.356 2.144 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)c1ccnc(C(C)(C)C)n1 ZINC000664128590 411864355 /nfs/dbraw/zinc/86/43/55/411864355.db2.gz ZJBROSGIMBJRBW-UHFFFAOYSA-N 1 2 245.330 2.134 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)c1ncc(Cl)s1 ZINC000664128445 411865026 /nfs/dbraw/zinc/86/50/26/411865026.db2.gz YSDBZQMTNMLBOU-UHFFFAOYSA-N 1 2 228.708 2.156 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)c1ncc(Cl)s1 ZINC000664128445 411865030 /nfs/dbraw/zinc/86/50/30/411865030.db2.gz YSDBZQMTNMLBOU-UHFFFAOYSA-N 1 2 228.708 2.156 20 0 BEADLO C[C@H](c1ccncc1)[NH+]1C[C@@H](C)C(=O)[C@H](C)C1 ZINC000661551193 411801707 /nfs/dbraw/zinc/80/17/07/411801707.db2.gz OYAFOVYSVRGUFS-IJLUTSLNSA-N 1 2 232.327 2.300 20 0 BEADLO Cc1[nH+]c2cc(OCC[C@H](C)O)ccc2n1C ZINC000664046409 411826934 /nfs/dbraw/zinc/82/69/34/411826934.db2.gz CYODHCFLXFWKAK-VIFPVBQESA-N 1 2 234.299 2.031 20 0 BEADLO Cc1ccc(Cn2cc3c(n2)CCOC3)c(C)[nH+]1 ZINC000664050241 411829751 /nfs/dbraw/zinc/82/97/51/411829751.db2.gz SBBXGZPYPINSFR-UHFFFAOYSA-N 1 2 243.310 2.016 20 0 BEADLO Cc1c[nH+]c(CCNc2ccc(C)nn2)c(C)c1 ZINC000664073368 411840217 /nfs/dbraw/zinc/84/02/17/411840217.db2.gz FNLGWQZOOKLTGS-UHFFFAOYSA-N 1 2 242.326 2.451 20 0 BEADLO CCn1ccc(C[N@H+](C)[C@H](C)c2nnc(C)[nH]2)c1 ZINC000664091943 411850183 /nfs/dbraw/zinc/85/01/83/411850183.db2.gz FAJZGBCUFMYUKQ-SNVBAGLBSA-N 1 2 247.346 2.128 20 0 BEADLO CCn1ccc(C[N@@H+](C)[C@H](C)c2nnc(C)[nH]2)c1 ZINC000664091943 411850188 /nfs/dbraw/zinc/85/01/88/411850188.db2.gz FAJZGBCUFMYUKQ-SNVBAGLBSA-N 1 2 247.346 2.128 20 0 BEADLO Cc1ccc(COc2c(C)[nH]ccc2=O)c(C)[nH+]1 ZINC000664098626 411851844 /nfs/dbraw/zinc/85/18/44/411851844.db2.gz LTKJAFQRAYJUJT-UHFFFAOYSA-N 1 2 244.294 2.274 20 0 BEADLO CC[C@@H](C)[NH2+][C@@H](Cc1ccccc1)C(=O)OC ZINC000038066892 170756290 /nfs/dbraw/zinc/75/62/90/170756290.db2.gz YRSMFCKMTZFEFW-YPMHNXCESA-N 1 2 235.327 2.159 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+]1CC[C@@H](C)O[C@@H](C)C1 ZINC000661852921 411902558 /nfs/dbraw/zinc/90/25/58/411902558.db2.gz LVAPMMCBDUTRKA-UTLUCORTSA-N 1 2 241.360 2.098 20 0 BEADLO C[C@@H](c1csnn1)[N@H+]1CC[C@@H](C)O[C@@H](C)C1 ZINC000661852921 411902562 /nfs/dbraw/zinc/90/25/62/411902562.db2.gz LVAPMMCBDUTRKA-UTLUCORTSA-N 1 2 241.360 2.098 20 0 BEADLO C[C@H](Nc1cc[nH+]c(C(C)(C)C)n1)C1(CO)CC1 ZINC000664271848 411907499 /nfs/dbraw/zinc/90/74/99/411907499.db2.gz MGZFSUBZVUNNMH-JTQLQIEISA-N 1 2 249.358 2.347 20 0 BEADLO Cc1cnc(C[NH+]2CCC3(CCCC3=O)CC2)o1 ZINC000661955747 411920967 /nfs/dbraw/zinc/92/09/67/411920967.db2.gz PBEXNTYJYPZVLG-UHFFFAOYSA-N 1 2 248.326 2.318 20 0 BEADLO C[C@H]1COC2(CCCC2)C[N@@H+]1Cc1ccon1 ZINC000661978806 411934110 /nfs/dbraw/zinc/93/41/10/411934110.db2.gz PNQABCDYDWDXIM-NSHDSACASA-N 1 2 236.315 2.208 20 0 BEADLO C[C@H]1COC2(CCCC2)C[N@H+]1Cc1ccon1 ZINC000661978806 411934114 /nfs/dbraw/zinc/93/41/14/411934114.db2.gz PNQABCDYDWDXIM-NSHDSACASA-N 1 2 236.315 2.208 20 0 BEADLO c1cc(C[N@@H+]2CCOC(C3CC3)(C3CC3)C2)no1 ZINC000661993423 411937539 /nfs/dbraw/zinc/93/75/39/411937539.db2.gz KNECUPRFRAFWTQ-UHFFFAOYSA-N 1 2 248.326 2.066 20 0 BEADLO c1cc(C[N@H+]2CCOC(C3CC3)(C3CC3)C2)no1 ZINC000661993423 411937542 /nfs/dbraw/zinc/93/75/42/411937542.db2.gz KNECUPRFRAFWTQ-UHFFFAOYSA-N 1 2 248.326 2.066 20 0 BEADLO C[C@H]1CCC[C@@H](CNc2cccc[nH+]2)O1 ZINC000664392842 411938927 /nfs/dbraw/zinc/93/89/27/411938927.db2.gz LDSANZMAKLZKNE-QWRGUYRKSA-N 1 2 206.289 2.451 20 0 BEADLO Cc1cc(NC[C@H]2CCC[C@H](C)O2)nc[nH+]1 ZINC000664395840 411941021 /nfs/dbraw/zinc/94/10/21/411941021.db2.gz SSGKKQMTRBOZRV-WDEREUQCSA-N 1 2 221.304 2.155 20 0 BEADLO CC1(C)C[C@H](Nc2cc[nH+]c3ccncc23)CO1 ZINC000664144034 411871249 /nfs/dbraw/zinc/87/12/49/411871249.db2.gz GDBJTMFYOZNYDO-JTQLQIEISA-N 1 2 243.310 2.031 20 0 BEADLO C[C@@H]1CCN(c2cc[nH+]c(C3CC3)n2)C[C@H](C)O1 ZINC000664470767 411967372 /nfs/dbraw/zinc/96/73/72/411967372.db2.gz HIWQBRPPDAFIGV-MNOVXSKESA-N 1 2 247.342 2.358 20 0 BEADLO Cc1cc(N2CCC3(CCCC3=O)CC2)nc[nH+]1 ZINC000664516464 411973731 /nfs/dbraw/zinc/97/37/31/411973731.db2.gz RTYHVCLNQUGIGN-UHFFFAOYSA-N 1 2 245.326 2.125 20 0 BEADLO Cc1nc(NC[C@H]2C(C)(C)C2(F)F)cc[nH+]1 ZINC000664522223 411974725 /nfs/dbraw/zinc/97/47/25/411974725.db2.gz BAHVXKJKJCQHTI-QMMMGPOBSA-N 1 2 227.258 2.488 20 0 BEADLO c1cc2[nH+]ccc(N3CC[C@@H]4C[C@@H]4C3)c2cn1 ZINC000664522909 411975948 /nfs/dbraw/zinc/97/59/48/411975948.db2.gz GXHHQYCTZVHHGH-GHMZBOCLSA-N 1 2 225.295 2.476 20 0 BEADLO Cc1cc(NC[C@H]2C(C)(C)C2(F)F)nc[nH+]1 ZINC000664525160 411977434 /nfs/dbraw/zinc/97/74/34/411977434.db2.gz VWZLFTHNMOLNIE-QMMMGPOBSA-N 1 2 227.258 2.488 20 0 BEADLO c1ccc(N2CCOC(C3CC3)(C3CC3)C2)[nH+]c1 ZINC000664533966 411980080 /nfs/dbraw/zinc/98/00/80/411980080.db2.gz FARUSTCGDUJSOJ-UHFFFAOYSA-N 1 2 244.338 2.477 20 0 BEADLO C[C@H](Nc1ncc(Cl)cn1)c1[nH+]ccn1C ZINC000664609012 411998126 /nfs/dbraw/zinc/99/81/26/411998126.db2.gz SMKVQKHVZZSCJK-ZETCQYMHSA-N 1 2 237.694 2.037 20 0 BEADLO Cc1nc(N[C@@H](c2ccccc2)[C@H](C)O)cc[nH+]1 ZINC000664658122 412007017 /nfs/dbraw/zinc/00/70/17/412007017.db2.gz QYMQTFULFVNMMM-IINYFYTJSA-N 1 2 243.310 2.319 20 0 BEADLO C[C@@H]1CN(c2cccc[nH+]2)C[C@](C)(C(F)F)O1 ZINC000664691266 412010148 /nfs/dbraw/zinc/01/01/48/412010148.db2.gz WXWOVIOGUDQIMT-BXKDBHETSA-N 1 2 242.269 2.331 20 0 BEADLO Cc1cc(C[NH+]2CCC(c3ccon3)CC2)no1 ZINC000662043197 411960965 /nfs/dbraw/zinc/96/09/65/411960965.db2.gz IDNYHSDUINLMIX-UHFFFAOYSA-N 1 2 247.298 2.351 20 0 BEADLO c1cc(C[N@@H+]2CCCc3[nH]ncc3C2)cs1 ZINC000664860274 412034854 /nfs/dbraw/zinc/03/48/54/412034854.db2.gz FRZAEVKBSFRDHT-UHFFFAOYSA-N 1 2 233.340 2.420 20 0 BEADLO c1cc(C[N@H+]2CCCc3[nH]ncc3C2)cs1 ZINC000664860274 412034855 /nfs/dbraw/zinc/03/48/55/412034855.db2.gz FRZAEVKBSFRDHT-UHFFFAOYSA-N 1 2 233.340 2.420 20 0 BEADLO CC[C@@H]1CCCC[C@H]1NC(=O)c1c[nH+]c(C)[nH]1 ZINC000264855531 170969862 /nfs/dbraw/zinc/96/98/62/170969862.db2.gz NZPMJQOICSLNBE-GHMZBOCLSA-N 1 2 235.331 2.417 20 0 BEADLO CC[C@@H]1CCC[C@@H](NC(=O)c2c[nH+]c(C)[nH]2)C1 ZINC000265960939 170985670 /nfs/dbraw/zinc/98/56/70/170985670.db2.gz XMCDCCDXWUPJCG-GHMZBOCLSA-N 1 2 235.331 2.417 20 0 BEADLO Cc1cc[nH+]cc1Cc1noc(CC2CC2)n1 ZINC000664979710 412055288 /nfs/dbraw/zinc/05/52/88/412055288.db2.gz AXFOQTBCMPMYFM-UHFFFAOYSA-N 1 2 229.283 2.316 20 0 BEADLO CC[C@H]1CC[C@H](C(=O)NCc2c[nH+]c[nH]2)CC1 ZINC000328370552 171031261 /nfs/dbraw/zinc/03/12/61/171031261.db2.gz WCFOZQSUKBPRLN-XYPYZODXSA-N 1 2 235.331 2.242 20 0 BEADLO CC[C@H]1CC[C@H](C(=O)NCc2c[nH]c[nH+]2)CC1 ZINC000328370552 171031263 /nfs/dbraw/zinc/03/12/63/171031263.db2.gz WCFOZQSUKBPRLN-XYPYZODXSA-N 1 2 235.331 2.242 20 0 BEADLO Cc1nc(C[N@H+](C)CC2=CCSC2)oc1C ZINC000662269295 412061090 /nfs/dbraw/zinc/06/10/90/412061090.db2.gz BDGCJRZGMQFTNJ-UHFFFAOYSA-N 1 2 238.356 2.396 20 0 BEADLO Cc1nc(C[N@@H+](C)CC2=CCSC2)oc1C ZINC000662269295 412061093 /nfs/dbraw/zinc/06/10/93/412061093.db2.gz BDGCJRZGMQFTNJ-UHFFFAOYSA-N 1 2 238.356 2.396 20 0 BEADLO CC[C@@H]1C[N@H+](CCC(=O)c2ccccc2)CCO1 ZINC000053931643 171078478 /nfs/dbraw/zinc/07/84/78/171078478.db2.gz MKLONVOFNMLNKE-CQSZACIVSA-N 1 2 247.338 2.370 20 0 BEADLO CC[C@@H]1C[N@@H+](CCC(=O)c2ccccc2)CCO1 ZINC000053931643 171078479 /nfs/dbraw/zinc/07/84/79/171078479.db2.gz MKLONVOFNMLNKE-CQSZACIVSA-N 1 2 247.338 2.370 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cncs2)C[C@H](C)O1 ZINC000092486917 171090316 /nfs/dbraw/zinc/09/03/16/171090316.db2.gz TZPNNMZWCOWOJA-VHSXEESVSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cncs2)C[C@H](C)O1 ZINC000092486917 171090319 /nfs/dbraw/zinc/09/03/19/171090319.db2.gz TZPNNMZWCOWOJA-VHSXEESVSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cncc(F)c2)C[C@H](C)O1 ZINC000275121093 171090709 /nfs/dbraw/zinc/09/07/09/171090709.db2.gz JDQOSLBKVXKGAX-GXFFZTMASA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cncc(F)c2)C[C@H](C)O1 ZINC000275121093 171090712 /nfs/dbraw/zinc/09/07/12/171090712.db2.gz JDQOSLBKVXKGAX-GXFFZTMASA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ncc(C)o2)CCS1 ZINC000174357372 171092442 /nfs/dbraw/zinc/09/24/42/171092442.db2.gz ISVGHCCGTBSIEN-SNVBAGLBSA-N 1 2 226.345 2.310 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ncc(C)o2)CCS1 ZINC000174357372 171092445 /nfs/dbraw/zinc/09/24/45/171092445.db2.gz ISVGHCCGTBSIEN-SNVBAGLBSA-N 1 2 226.345 2.310 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2sccc2OC)CCO1 ZINC000271053281 171093811 /nfs/dbraw/zinc/09/38/11/171093811.db2.gz XRDRCHZCPPLYAS-SNVBAGLBSA-N 1 2 241.356 2.368 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2sccc2OC)CCO1 ZINC000271053281 171093813 /nfs/dbraw/zinc/09/38/13/171093813.db2.gz XRDRCHZCPPLYAS-SNVBAGLBSA-N 1 2 241.356 2.368 20 0 BEADLO CCC[N@H+](C)Cc1nc([C@H](CC)OCC)no1 ZINC000665037493 412063636 /nfs/dbraw/zinc/06/36/36/412063636.db2.gz AVXOBTQHCYEUKR-JTQLQIEISA-N 1 2 241.335 2.399 20 0 BEADLO CCC[N@@H+](C)Cc1nc([C@H](CC)OCC)no1 ZINC000665037493 412063642 /nfs/dbraw/zinc/06/36/42/412063642.db2.gz AVXOBTQHCYEUKR-JTQLQIEISA-N 1 2 241.335 2.399 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1cncc(F)c1 ZINC000275168057 171110532 /nfs/dbraw/zinc/11/05/32/171110532.db2.gz WJGBRHUBQYDBST-GXFFZTMASA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1cncc(F)c1 ZINC000275168057 171110535 /nfs/dbraw/zinc/11/05/35/171110535.db2.gz WJGBRHUBQYDBST-GXFFZTMASA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1cncs1 ZINC000270988337 171110967 /nfs/dbraw/zinc/11/09/67/171110967.db2.gz GSEJNWGLYDQRDE-VHSXEESVSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1cncs1 ZINC000270988337 171110970 /nfs/dbraw/zinc/11/09/70/171110970.db2.gz GSEJNWGLYDQRDE-VHSXEESVSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1cncc(F)c1 ZINC000275168060 171113652 /nfs/dbraw/zinc/11/36/52/171113652.db2.gz WJGBRHUBQYDBST-ZWNOBZJWSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1cncc(F)c1 ZINC000275168060 171113655 /nfs/dbraw/zinc/11/36/55/171113655.db2.gz WJGBRHUBQYDBST-ZWNOBZJWSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[C@@H](C[N@H+](C)CC(F)F)CCO1 ZINC000356985990 171120725 /nfs/dbraw/zinc/12/07/25/171120725.db2.gz IRRDHRSQYBCHBU-VHSXEESVSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@@H]1C[C@@H](C[N@@H+](C)CC(F)F)CCO1 ZINC000356985990 171120728 /nfs/dbraw/zinc/12/07/28/171120728.db2.gz IRRDHRSQYBCHBU-VHSXEESVSA-N 1 2 221.291 2.389 20 0 BEADLO NC(=O)c1csc(C[NH+]2CC3(CC3)C2)c1 ZINC000335382709 487621742 /nfs/dbraw/zinc/62/17/42/487621742.db2.gz CCDCILHYQMTAEL-UHFFFAOYSA-N 1 2 222.313 2.227 20 0 BEADLO CC[C@@](C)([NH2+][C@H]1C=CCCC1)C(=O)OC ZINC000293134701 171176084 /nfs/dbraw/zinc/17/60/84/171176084.db2.gz LMLZFVXWYIGQJE-CMPLNLGQSA-N 1 2 211.305 2.026 20 0 BEADLO CC[C@H](C)C(=O)NCc1cn2cccc(C)c2[nH+]1 ZINC000264791796 171252146 /nfs/dbraw/zinc/25/21/46/171252146.db2.gz XSZREHUOEZVNOX-JTQLQIEISA-N 1 2 245.326 2.305 20 0 BEADLO CC[C@H](C)C(=O)N[C@H](c1[nH+]ccn1C)C1CC1 ZINC000341710106 171254154 /nfs/dbraw/zinc/25/41/54/171254154.db2.gz VVAPSQAHMWYSKZ-ONGXEEELSA-N 1 2 235.331 2.034 20 0 BEADLO CC[C@H](C)CC(=O)N[C@@H](c1[nH+]ccn1C)C1CC1 ZINC000341691366 171260695 /nfs/dbraw/zinc/26/06/95/171260695.db2.gz PKZDRHLXPQQOHT-GXFFZTMASA-N 1 2 249.358 2.424 20 0 BEADLO CC[C@H](C)CCC(=O)N[C@@H]1CCn2cc[nH+]c2C1 ZINC000354852985 171267299 /nfs/dbraw/zinc/26/72/99/171267299.db2.gz RUSHEQNLIGTSAZ-NWDGAFQWSA-N 1 2 249.358 2.140 20 0 BEADLO CC[C@H](C)CCC(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000354233900 171267438 /nfs/dbraw/zinc/26/74/38/171267438.db2.gz ALXFDDGVWHJGOI-WDEREUQCSA-N 1 2 249.358 2.210 20 0 BEADLO CC[C@H](C)CCC(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000354233900 171267441 /nfs/dbraw/zinc/26/74/41/171267441.db2.gz ALXFDDGVWHJGOI-WDEREUQCSA-N 1 2 249.358 2.210 20 0 BEADLO CC[C@H](C)CNc1ccc(Cn2cc[nH+]c2)cn1 ZINC000353133972 171282201 /nfs/dbraw/zinc/28/22/01/171282201.db2.gz GTOAILADGAUWTN-LBPRGKRZSA-N 1 2 244.342 2.206 20 0 BEADLO CC[C@H](C)N(C)C(=O)Cc1cn2ccccc2[nH+]1 ZINC000340118324 171302434 /nfs/dbraw/zinc/30/24/34/171302434.db2.gz LHKYWWFTOWNBTQ-NSHDSACASA-N 1 2 245.326 2.134 20 0 BEADLO CC[C@H](C)[NH2+][C@H](c1nnc[nH]1)c1ccc(F)cc1 ZINC000295895228 171346247 /nfs/dbraw/zinc/34/62/47/171346247.db2.gz IKRXCXQGIUHACO-CABZTGNLSA-N 1 2 248.305 2.421 20 0 BEADLO CC[C@H](C)[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000282185943 171346618 /nfs/dbraw/zinc/34/66/18/171346618.db2.gz WFGYZMBPOZERNE-JQWIXIFHSA-N 1 2 230.315 2.282 20 0 BEADLO CC[C@H](C)[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000282185942 171348537 /nfs/dbraw/zinc/34/85/37/171348537.db2.gz WFGYZMBPOZERNE-CMPLNLGQSA-N 1 2 230.315 2.282 20 0 BEADLO CC[C@H](C)OCC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000280695335 171354457 /nfs/dbraw/zinc/35/44/57/171354457.db2.gz FAUNGXHQSGUFOQ-JTQLQIEISA-N 1 2 247.298 2.088 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000356808143 171361270 /nfs/dbraw/zinc/36/12/70/171361270.db2.gz XJRFWGREDJTPFR-AXFHLTTASA-N 1 2 249.358 2.065 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000356808143 171361272 /nfs/dbraw/zinc/36/12/72/171361272.db2.gz XJRFWGREDJTPFR-AXFHLTTASA-N 1 2 249.358 2.065 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000330944735 171362732 /nfs/dbraw/zinc/36/27/32/171362732.db2.gz GMRYTUWBHXSLRZ-HBNTYKKESA-N 1 2 249.358 2.380 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)[C@@H]1CCCc2[nH]c[nH+]c21 ZINC000330944735 171362733 /nfs/dbraw/zinc/36/27/33/171362733.db2.gz GMRYTUWBHXSLRZ-HBNTYKKESA-N 1 2 249.358 2.380 20 0 BEADLO CC[C@H](C)[C@@H]([NH2+]CCc1ccccc1)C(=O)OC ZINC000035044499 171374982 /nfs/dbraw/zinc/37/49/82/171374982.db2.gz YNYWNHSEWFELCZ-GXTWGEPZSA-N 1 2 249.354 2.406 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000330940861 171385768 /nfs/dbraw/zinc/38/57/68/171385768.db2.gz CQEORQFWNAJBSE-UWVGGRQHSA-N 1 2 237.347 2.238 20 0 BEADLO COc1ccc(-c2c[nH+]cn2C)c(C)c1 ZINC000665181885 412122628 /nfs/dbraw/zinc/12/26/28/412122628.db2.gz AYKPRSMBNQMZOI-UHFFFAOYSA-N 1 2 202.257 2.404 20 0 BEADLO CCCc1nc(C[N@@H+]2CC3CC2(C)C3)no1 ZINC000662381677 412133756 /nfs/dbraw/zinc/13/37/56/412133756.db2.gz AGIBEKQSUCWPHS-UHFFFAOYSA-N 1 2 221.304 2.006 20 0 BEADLO CCCc1nc(C[N@H+]2CC3CC2(C)C3)no1 ZINC000662381677 412133759 /nfs/dbraw/zinc/13/37/59/412133759.db2.gz AGIBEKQSUCWPHS-UHFFFAOYSA-N 1 2 221.304 2.006 20 0 BEADLO COCCCOc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000665217721 412154406 /nfs/dbraw/zinc/15/44/06/412154406.db2.gz TXOCWHTXMHPZNO-UHFFFAOYSA-N 1 2 232.283 2.492 20 0 BEADLO CC[C@H]1CN(c2cccc[nH+]2)CCCO1 ZINC000281729234 171666461 /nfs/dbraw/zinc/66/64/61/171666461.db2.gz COWYKMZZVZYSTK-NSHDSACASA-N 1 2 206.289 2.087 20 0 BEADLO CC[C@H]1[C@H](C)CCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000283016522 171686869 /nfs/dbraw/zinc/68/68/69/171686869.db2.gz HNIKPECGYBQFLY-PRANIUCASA-N 1 2 233.315 2.070 20 0 BEADLO CCc1cc(NCCF)nc(-c2ccncc2)[nH+]1 ZINC000280707073 171766142 /nfs/dbraw/zinc/76/61/42/171766142.db2.gz HIEVJKYXJGPINI-UHFFFAOYSA-N 1 2 246.289 2.482 20 0 BEADLO CCc1cn(CC(=O)c2ccc(OC)cc2)c[nH+]1 ZINC001652207918 1173045819 /nfs/dbraw/zinc/04/58/19/1173045819.db2.gz JKDONZMYVSZBRL-UHFFFAOYSA-N 1 2 244.294 2.337 20 0 BEADLO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2cccnc2)[nH]1 ZINC000271492995 172001775 /nfs/dbraw/zinc/00/17/75/172001775.db2.gz LFBGOTWKUZQWRV-VHSXEESVSA-N 1 2 245.330 2.174 20 0 BEADLO CCc1ccc(C[NH2+][C@H](C)c2nnc(CC)[nH]2)o1 ZINC000270620981 172002923 /nfs/dbraw/zinc/00/29/23/172002923.db2.gz CFXNHNLJKNWGNO-SECBINFHSA-N 1 2 248.330 2.373 20 0 BEADLO CCc1ncc(C[N@@H+]2CCO[C@H](C)[C@H]2C)s1 ZINC000271198554 172016570 /nfs/dbraw/zinc/01/65/70/172016570.db2.gz SDAPQPGCDQMRDZ-NXEZZACHSA-N 1 2 240.372 2.315 20 0 BEADLO CCc1ncc(C[N@H+]2CCO[C@H](C)[C@H]2C)s1 ZINC000271198554 172016572 /nfs/dbraw/zinc/01/65/72/172016572.db2.gz SDAPQPGCDQMRDZ-NXEZZACHSA-N 1 2 240.372 2.315 20 0 BEADLO CCc1nnc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)o1 ZINC000104674693 172050613 /nfs/dbraw/zinc/05/06/13/172050613.db2.gz JKWZWYLMHZRGLB-LLVKDONJSA-N 1 2 246.314 2.297 20 0 BEADLO CCc1nnc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)o1 ZINC000104674693 172050615 /nfs/dbraw/zinc/05/06/15/172050615.db2.gz JKWZWYLMHZRGLB-LLVKDONJSA-N 1 2 246.314 2.297 20 0 BEADLO CCc1nnc(C[NH2+]Cc2cccc(O)c2)s1 ZINC000289729653 172051704 /nfs/dbraw/zinc/05/17/04/172051704.db2.gz GRVNWUVQJJYCCY-UHFFFAOYSA-N 1 2 249.339 2.096 20 0 BEADLO CCc1nnc(C[NH2+]C2(c3ccccc3)CC2)o1 ZINC000264188195 172051770 /nfs/dbraw/zinc/05/17/70/172051770.db2.gz LUUXZCKEZDEWBG-UHFFFAOYSA-N 1 2 243.310 2.411 20 0 BEADLO CCc1nnc(C[NH2+]Cc2cnccc2C)s1 ZINC000289817069 172051859 /nfs/dbraw/zinc/05/18/59/172051859.db2.gz NKEBUKWMKBJLPL-UHFFFAOYSA-N 1 2 248.355 2.094 20 0 BEADLO CCc1nnc(C[NH2+]Cc2ccc(C)o2)s1 ZINC000289919489 172052132 /nfs/dbraw/zinc/05/21/32/172052132.db2.gz VGGNXBKVVNQQGP-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO CCc1noc(C)c1C[N@H+]1CCOC[C@H]1CC ZINC000119232475 172077803 /nfs/dbraw/zinc/07/78/03/172077803.db2.gz YHACRMZJEZSSIB-LLVKDONJSA-N 1 2 238.331 2.156 20 0 BEADLO CCc1noc(C)c1C[N@@H+]1CCOC[C@H]1CC ZINC000119232475 172077807 /nfs/dbraw/zinc/07/78/07/172077807.db2.gz YHACRMZJEZSSIB-LLVKDONJSA-N 1 2 238.331 2.156 20 0 BEADLO CCc1noc(Cn2c(C)[nH+]c3ccccc32)n1 ZINC000106087039 172087144 /nfs/dbraw/zinc/08/71/44/172087144.db2.gz ORMNVFYYVCIFHE-UHFFFAOYSA-N 1 2 242.282 2.338 20 0 BEADLO CCc1noc([C@@H](C)[NH2+][C@@H](C)c2cccnc2)n1 ZINC000182885642 172089100 /nfs/dbraw/zinc/08/91/00/172089100.db2.gz RIRIZYIRFIJLIO-VHSXEESVSA-N 1 2 246.314 2.439 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1cccnc1 ZINC000293419788 172095134 /nfs/dbraw/zinc/09/51/34/172095134.db2.gz NBSGZTXYIKXHPZ-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1cccnc1 ZINC000293419788 172095136 /nfs/dbraw/zinc/09/51/36/172095136.db2.gz NBSGZTXYIKXHPZ-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1cccn1C ZINC000295256580 172096605 /nfs/dbraw/zinc/09/66/05/172096605.db2.gz GNQZLABUBCMCQQ-UHFFFAOYSA-N 1 2 233.315 2.208 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1cccn1C ZINC000295256580 172096608 /nfs/dbraw/zinc/09/66/08/172096608.db2.gz GNQZLABUBCMCQQ-UHFFFAOYSA-N 1 2 233.315 2.208 20 0 BEADLO CCc1nocc1C[NH2+]Cc1ccc(F)cn1 ZINC000339305229 172100991 /nfs/dbraw/zinc/10/09/91/172100991.db2.gz VXCYKKPICDEJLB-UHFFFAOYSA-N 1 2 235.262 2.061 20 0 BEADLO CCc1ocnc1C(=O)Nc1cc[nH+]c(C)c1 ZINC000266076520 172123658 /nfs/dbraw/zinc/12/36/58/172123658.db2.gz XHXAIOIDKHRROG-UHFFFAOYSA-N 1 2 231.255 2.193 20 0 BEADLO CCn1cc(C[N@H+](C)Cc2ccco2)cn1 ZINC000162143620 172163127 /nfs/dbraw/zinc/16/31/27/172163127.db2.gz NJNMBKBNFXYXFT-UHFFFAOYSA-N 1 2 219.288 2.128 20 0 BEADLO CCn1cc(C[N@@H+](C)Cc2ccco2)cn1 ZINC000162143620 172163131 /nfs/dbraw/zinc/16/31/31/172163131.db2.gz NJNMBKBNFXYXFT-UHFFFAOYSA-N 1 2 219.288 2.128 20 0 BEADLO CCn1cc(NC(=O)Nc2cc[nH+]c(C)c2)cn1 ZINC000119879796 172180899 /nfs/dbraw/zinc/18/08/99/172180899.db2.gz YYKADNOKANQQOU-UHFFFAOYSA-N 1 2 245.286 2.250 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)CC1CCCCC1 ZINC000295765891 172221799 /nfs/dbraw/zinc/22/17/99/172221799.db2.gz OTPPNJIJFOFXGY-UHFFFAOYSA-N 1 2 249.358 2.490 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@H]1C[C@@]1(C)C(C)C ZINC000295597771 172221933 /nfs/dbraw/zinc/22/19/33/172221933.db2.gz IFWQNUWJRXIQIY-RISCZKNCSA-N 1 2 249.358 2.201 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)CC(C)(C)C1CC1 ZINC000295796569 172222571 /nfs/dbraw/zinc/22/25/71/172222571.db2.gz ZPTHSCZVFITDIW-UHFFFAOYSA-N 1 2 249.358 2.346 20 0 BEADLO CCn1cncc1C[N@@H+]1CCOC2(CCCC2)C1 ZINC000334924065 172233948 /nfs/dbraw/zinc/23/39/48/172233948.db2.gz KKRBQVOZXACHCJ-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CCn1cncc1C[N@H+]1CCOC2(CCCC2)C1 ZINC000334924065 172233950 /nfs/dbraw/zinc/23/39/50/172233950.db2.gz KKRBQVOZXACHCJ-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CCn1c[nH+]cc1CN1CCOC2(CCCC2)C1 ZINC000334924065 172233953 /nfs/dbraw/zinc/23/39/53/172233953.db2.gz KKRBQVOZXACHCJ-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CCn1cnnc1C[NH2+]Cc1cc(C)ccc1F ZINC000116913688 172236474 /nfs/dbraw/zinc/23/64/74/172236474.db2.gz FGWVWSDKKWCTEB-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO CCn1nccc1C[N@@H+]1CCn2cccc2[C@@H]1C ZINC000179566335 172269375 /nfs/dbraw/zinc/26/93/75/172269375.db2.gz OROUIFPESSNOAI-LBPRGKRZSA-N 1 2 244.342 2.281 20 0 BEADLO CCn1nccc1C[N@H+]1CCn2cccc2[C@@H]1C ZINC000179566335 172269378 /nfs/dbraw/zinc/26/93/78/172269378.db2.gz OROUIFPESSNOAI-LBPRGKRZSA-N 1 2 244.342 2.281 20 0 BEADLO CCn1ncnc1C[NH2+][C@H](C)c1cc(C)c(C)o1 ZINC000337475803 172283919 /nfs/dbraw/zinc/28/39/19/172283919.db2.gz OZQDSXIOFQOEMN-SNVBAGLBSA-N 1 2 248.330 2.359 20 0 BEADLO CN(C(=O)CCc1c[nH+]cn1C)C1(C)CCCC1 ZINC000357131031 172306329 /nfs/dbraw/zinc/30/63/29/172306329.db2.gz UOLJJAXVTHYUKU-UHFFFAOYSA-N 1 2 249.358 2.144 20 0 BEADLO CN(Cc1nccn1C(F)F)c1cccc[nH+]1 ZINC000298710919 172930315 /nfs/dbraw/zinc/93/03/15/172930315.db2.gz KGRFFQUFTTVIDE-UHFFFAOYSA-N 1 2 238.241 2.310 20 0 BEADLO CNC(=O)CCNc1[nH+]c2ccccc2cc1C ZINC000063106090 173261501 /nfs/dbraw/zinc/26/15/01/173261501.db2.gz MRBGRZZFDPLTOX-UHFFFAOYSA-N 1 2 243.310 2.091 20 0 BEADLO CNC(=O)CCn1c2ccccc2[nH+]c1C1CC1 ZINC000354137153 173264895 /nfs/dbraw/zinc/26/48/95/173264895.db2.gz DRUFZJKLZGREJY-UHFFFAOYSA-N 1 2 243.310 2.050 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H](C)c1ccc(C)cc1 ZINC000037074007 173787151 /nfs/dbraw/zinc/78/71/51/173787151.db2.gz IGWZMYYHGGWSQY-QWRGUYRKSA-N 1 2 221.300 2.207 20 0 BEADLO COC1C[NH+](Cc2cccc(OC(C)C)c2)C1 ZINC000358457510 174035181 /nfs/dbraw/zinc/03/51/81/174035181.db2.gz OHCSYPODHFZJKZ-UHFFFAOYSA-N 1 2 235.327 2.304 20 0 BEADLO COCC(C)(C)C(=O)Nc1ccc(C)[nH+]c1C ZINC000270242165 174066705 /nfs/dbraw/zinc/06/67/05/174066705.db2.gz WSGJTYQLAQDJJW-UHFFFAOYSA-N 1 2 236.315 2.310 20 0 BEADLO COCC(C)(C)C(=O)Nc1cc[nH+]cc1C ZINC000132363397 174067973 /nfs/dbraw/zinc/06/79/73/174067973.db2.gz SRFNLCHFNYWOAG-UHFFFAOYSA-N 1 2 222.288 2.001 20 0 BEADLO COCCC(C)(C)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000353259930 174147768 /nfs/dbraw/zinc/14/77/68/174147768.db2.gz FOGYLYATJGHIFH-UHFFFAOYSA-N 1 2 248.330 2.493 20 0 BEADLO COCCC1(CNc2cc(C)[nH+]cn2)CCC1 ZINC000301682435 174157589 /nfs/dbraw/zinc/15/75/89/174157589.db2.gz VSILPRMGEOIYRN-UHFFFAOYSA-N 1 2 235.331 2.404 20 0 BEADLO COCCCC(=O)Nc1ccc(C)[nH+]c1C ZINC000176200647 174169129 /nfs/dbraw/zinc/16/91/29/174169129.db2.gz ZUPOYPKYPCKXIO-UHFFFAOYSA-N 1 2 222.288 2.064 20 0 BEADLO COCCCN1CC[N@H+](C)C[C@H]1c1ccccc1 ZINC000119596956 174230836 /nfs/dbraw/zinc/23/08/36/174230836.db2.gz WZPYDQJMRPJBPZ-HNNXBMFYSA-N 1 2 248.370 2.012 20 0 BEADLO COCCCN1CC[N@@H+](C)C[C@H]1c1ccccc1 ZINC000119596956 174230837 /nfs/dbraw/zinc/23/08/37/174230837.db2.gz WZPYDQJMRPJBPZ-HNNXBMFYSA-N 1 2 248.370 2.012 20 0 BEADLO COCCCNc1cc[nH+]c2ccncc12 ZINC000267256192 174252072 /nfs/dbraw/zinc/25/20/72/174252072.db2.gz VMUIRMCUNPGSQL-UHFFFAOYSA-N 1 2 217.272 2.078 20 0 BEADLO COCCCSCc1c[nH+]ccc1OC ZINC000289352633 174258601 /nfs/dbraw/zinc/25/86/01/174258601.db2.gz HBARRVRLPXVVPV-UHFFFAOYSA-N 1 2 227.329 2.360 20 0 BEADLO COCC[N@H+](C)Cc1ncc(C(C)C)s1 ZINC000346149976 174280853 /nfs/dbraw/zinc/28/08/53/174280853.db2.gz LVVCIXBZPDEZIZ-UHFFFAOYSA-N 1 2 228.361 2.345 20 0 BEADLO COCC[N@@H+](C)Cc1ncc(C(C)C)s1 ZINC000346149976 174280854 /nfs/dbraw/zinc/28/08/54/174280854.db2.gz LVVCIXBZPDEZIZ-UHFFFAOYSA-N 1 2 228.361 2.345 20 0 BEADLO COCC[N@H+](CC(F)F)CC1CCCC1 ZINC000103485575 174288312 /nfs/dbraw/zinc/28/83/12/174288312.db2.gz ITAQHQHTEUZGHO-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO COCC[N@@H+](CC(F)F)CC1CCCC1 ZINC000103485575 174288314 /nfs/dbraw/zinc/28/83/14/174288314.db2.gz ITAQHQHTEUZGHO-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO COCC[N@H+](Cc1ccco1)Cc1ccccn1 ZINC000264268149 174299034 /nfs/dbraw/zinc/29/90/34/174299034.db2.gz LDVSWNYGMXUQFV-UHFFFAOYSA-N 1 2 246.310 2.323 20 0 BEADLO COCC[N@@H+](Cc1ccco1)Cc1ccccn1 ZINC000264268149 174299036 /nfs/dbraw/zinc/29/90/36/174299036.db2.gz LDVSWNYGMXUQFV-UHFFFAOYSA-N 1 2 246.310 2.323 20 0 BEADLO COCC[N@H+](Cc1ccco1)Cc1cccnc1 ZINC000298274488 174300870 /nfs/dbraw/zinc/30/08/70/174300870.db2.gz JTLXMRXBNNGPOH-UHFFFAOYSA-N 1 2 246.310 2.323 20 0 BEADLO COCC[N@@H+](Cc1ccco1)Cc1cccnc1 ZINC000298274488 174300871 /nfs/dbraw/zinc/30/08/71/174300871.db2.gz JTLXMRXBNNGPOH-UHFFFAOYSA-N 1 2 246.310 2.323 20 0 BEADLO COCC[C@@H]([NH2+]Cc1[nH]ncc1C)c1ccco1 ZINC000289593788 174393841 /nfs/dbraw/zinc/39/38/41/174393841.db2.gz UIIBRHQIXOSDPK-LLVKDONJSA-N 1 2 249.314 2.179 20 0 BEADLO COCC[C@@H]([NH2+]Cc1n[nH]cc1C)c1ccco1 ZINC000289593788 174393843 /nfs/dbraw/zinc/39/38/43/174393843.db2.gz UIIBRHQIXOSDPK-LLVKDONJSA-N 1 2 249.314 2.179 20 0 BEADLO COCCc1ccccc1NCc1c[nH+]cn1C ZINC000188038433 174423487 /nfs/dbraw/zinc/42/34/87/174423487.db2.gz DXUVHZWJOIHGNL-UHFFFAOYSA-N 1 2 245.326 2.221 20 0 BEADLO COC[C@H]([NH2+]Cc1cncs1)c1ccco1 ZINC000124349114 174582962 /nfs/dbraw/zinc/58/29/62/174582962.db2.gz GRSLRSDAWINMBW-JTQLQIEISA-N 1 2 238.312 2.213 20 0 BEADLO CO[C@@H]1CC[C@H](Nc2cc[nH+]c(C3CC3)n2)C1 ZINC000302750102 174764761 /nfs/dbraw/zinc/76/47/61/174764761.db2.gz GRQGDPWUDBVZKK-WDEREUQCSA-N 1 2 233.315 2.333 20 0 BEADLO CO[C@H](C)[C@@H](C)Nc1[nH+]c2ccccc2n1C ZINC000290770653 174845258 /nfs/dbraw/zinc/84/52/58/174845258.db2.gz VIHYQZPVAYEFDP-NXEZZACHSA-N 1 2 233.315 2.409 20 0 BEADLO COc1cc(NCc2c[nH+]c[nH]2)cc(OC)c1 ZINC000054763120 175003213 /nfs/dbraw/zinc/00/32/13/175003213.db2.gz XIUKOLATEAFFBF-UHFFFAOYSA-N 1 2 233.271 2.039 20 0 BEADLO COc1cc(NCc2c[nH]c[nH+]2)cc(OC)c1 ZINC000054763120 175003216 /nfs/dbraw/zinc/00/32/16/175003216.db2.gz XIUKOLATEAFFBF-UHFFFAOYSA-N 1 2 233.271 2.039 20 0 BEADLO COc1ccc(-c2cccc(N)[nH+]2)cc1 ZINC000034412900 175035349 /nfs/dbraw/zinc/03/53/49/175035349.db2.gz YKLVCVZNUVREBR-UHFFFAOYSA-N 1 2 200.241 2.339 20 0 BEADLO COc1ccc(-c2cc[nH+]c(N)c2)cc1F ZINC000082729974 175035890 /nfs/dbraw/zinc/03/58/90/175035890.db2.gz HSEKWERJZUVBHF-UHFFFAOYSA-N 1 2 218.231 2.479 20 0 BEADLO COc1ccc(C[NH2+]Cc2[nH]ncc2C)c(F)c1 ZINC000352849586 175108515 /nfs/dbraw/zinc/10/85/15/175108515.db2.gz WYXDLCNTBTZQCG-UHFFFAOYSA-N 1 2 249.289 2.156 20 0 BEADLO COc1ccc(C[NH2+]Cc2n[nH]cc2C)c(F)c1 ZINC000352849586 175108516 /nfs/dbraw/zinc/10/85/16/175108516.db2.gz WYXDLCNTBTZQCG-UHFFFAOYSA-N 1 2 249.289 2.156 20 0 BEADLO COc1ccc(F)c(NCc2[nH+]cc(C)n2C)c1 ZINC000341285979 175126494 /nfs/dbraw/zinc/12/64/94/175126494.db2.gz PQFYUQBMLXGYHC-UHFFFAOYSA-N 1 2 249.289 2.488 20 0 BEADLO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1ncc[nH]1 ZINC000049715260 175132320 /nfs/dbraw/zinc/13/23/20/175132320.db2.gz UKOGNOIDLOAULZ-SECBINFHSA-N 1 2 249.289 2.408 20 0 BEADLO COc1ccc(NCc2[nH+]cc(C)n2C)c(C)n1 ZINC000341311446 175153506 /nfs/dbraw/zinc/15/35/06/175153506.db2.gz ZMDFLHGMWFHZRL-UHFFFAOYSA-N 1 2 246.314 2.053 20 0 BEADLO COc1ccc(N[C@@H]2CCn3cc[nH+]c32)cc1 ZINC000294247601 175154629 /nfs/dbraw/zinc/15/46/29/175154629.db2.gz WMABWASWUHKQJR-GFCCVEGCSA-N 1 2 229.283 2.449 20 0 BEADLO COc1ccc(N[C@@H]2C[C@@H](C)n3cc[nH+]c32)cn1 ZINC000294098691 175154813 /nfs/dbraw/zinc/15/48/13/175154813.db2.gz MMNJXWWJDDLCQS-MWLCHTKSSA-N 1 2 244.298 2.405 20 0 BEADLO COc1ccc2c(c1)C[N@@H+](Cc1cocn1)CC2 ZINC000191937113 175210755 /nfs/dbraw/zinc/21/07/55/175210755.db2.gz BVLAAGYJKIVKNE-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1ccc2c(c1)C[N@H+](Cc1cocn1)CC2 ZINC000191937113 175210757 /nfs/dbraw/zinc/21/07/57/175210757.db2.gz BVLAAGYJKIVKNE-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2ccn(C)n2)c1 ZINC000271013801 175255553 /nfs/dbraw/zinc/25/55/53/175255553.db2.gz QJDFDXOOEFXMMC-UHFFFAOYSA-N 1 2 245.326 2.061 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2ccn(C)n2)c1 ZINC000271013801 175255555 /nfs/dbraw/zinc/25/55/55/175255555.db2.gz QJDFDXOOEFXMMC-UHFFFAOYSA-N 1 2 245.326 2.061 20 0 BEADLO COc1cccc(C[N@@H+]2CCC(=O)[C@H](C)C2)c1 ZINC000049693790 175256526 /nfs/dbraw/zinc/25/65/26/175256526.db2.gz FMJUNDZCXWIIMO-LLVKDONJSA-N 1 2 233.311 2.106 20 0 BEADLO COc1cccc(C[N@H+]2CCC(=O)[C@H](C)C2)c1 ZINC000049693790 175256528 /nfs/dbraw/zinc/25/65/28/175256528.db2.gz FMJUNDZCXWIIMO-LLVKDONJSA-N 1 2 233.311 2.106 20 0 BEADLO COc1cccc(C[NH2+][C@H](C)c2nc(C)no2)c1 ZINC000356900289 175268056 /nfs/dbraw/zinc/26/80/56/175268056.db2.gz YGDNXPPGXWREAW-SECBINFHSA-N 1 2 247.298 2.237 20 0 BEADLO COc1cccc2c(N[C@H](C)CO)cc[nH+]c12 ZINC000275679774 175300017 /nfs/dbraw/zinc/30/00/17/175300017.db2.gz ZVSXEZSOLGLUEE-SECBINFHSA-N 1 2 232.283 2.036 20 0 BEADLO COc1ccccc1C[NH2+]Cc1cscn1 ZINC000040420451 175329868 /nfs/dbraw/zinc/32/98/68/175329868.db2.gz OCXIDROTVHISHD-UHFFFAOYSA-N 1 2 234.324 2.442 20 0 BEADLO COc1ccccc1NCc1c[nH+]cn1C ZINC000085167664 175337967 /nfs/dbraw/zinc/33/79/67/175337967.db2.gz IYEJIVYQZPJSRT-UHFFFAOYSA-N 1 2 217.272 2.041 20 0 BEADLO COc1ccccc1[C@@H](C)[NH2+]Cc1cnns1 ZINC000296305503 175344329 /nfs/dbraw/zinc/34/43/29/175344329.db2.gz NAZHFFLGSSQRCL-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO COc1ccccc1[C@H](C)[NH2+]Cc1cnns1 ZINC000296306831 175352188 /nfs/dbraw/zinc/35/21/88/175352188.db2.gz NAZHFFLGSSQRCL-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO COc1ccnc(C[N@@H+]2CCC[C@@](C)(F)C2)c1 ZINC000295539484 175358955 /nfs/dbraw/zinc/35/89/55/175358955.db2.gz WCHFOMANYPPTNC-CYBMUJFWSA-N 1 2 238.306 2.414 20 0 BEADLO COc1ccnc(C[N@H+]2CCC[C@@](C)(F)C2)c1 ZINC000295539484 175358957 /nfs/dbraw/zinc/35/89/57/175358957.db2.gz WCHFOMANYPPTNC-CYBMUJFWSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cc[nH+]c(CN2CCC[C@@](C)(F)C2)c1 ZINC000295539484 175358959 /nfs/dbraw/zinc/35/89/59/175358959.db2.gz WCHFOMANYPPTNC-CYBMUJFWSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)OC(C)(C)C ZINC000293028187 175371701 /nfs/dbraw/zinc/37/17/01/175371701.db2.gz QFAFZQWQAPZYMM-UHFFFAOYSA-N 1 2 238.287 2.115 20 0 BEADLO COc1cc[nH+]cc1COC(=O)[C@H]1C[C@@H]1C(C)C ZINC000287120417 175373072 /nfs/dbraw/zinc/37/30/72/175373072.db2.gz XCISLIODEVNAOK-NEPJUHHUSA-N 1 2 249.310 2.426 20 0 BEADLO COc1cc[nH+]cc1CS[C@H](C)[C@@H](C)O ZINC000309035470 175373203 /nfs/dbraw/zinc/37/32/03/175373203.db2.gz FRODRNYCZOYSRA-RKDXNWHRSA-N 1 2 227.329 2.093 20 0 BEADLO COc1cc[nH+]cc1CS[C@@H](C)[C@@H](C)O ZINC000309035467 175373593 /nfs/dbraw/zinc/37/35/93/175373593.db2.gz FRODRNYCZOYSRA-BDAKNGLRSA-N 1 2 227.329 2.093 20 0 BEADLO COc1ccncc1C[NH2+][C@H](C)c1cc(C)on1 ZINC000287088455 175373950 /nfs/dbraw/zinc/37/39/50/175373950.db2.gz VTBSEJOUKLLJTQ-SNVBAGLBSA-N 1 2 247.298 2.237 20 0 BEADLO COc1cc[nH+]cc1Cn1ncc(Cl)c1C ZINC000288168676 175374679 /nfs/dbraw/zinc/37/46/79/175374679.db2.gz AFRWYIWVLKFUMU-UHFFFAOYSA-N 1 2 237.690 2.297 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1ccoc1C ZINC000334149565 175376197 /nfs/dbraw/zinc/37/61/97/175376197.db2.gz HSJPQCVIPASPKL-UHFFFAOYSA-N 1 2 232.239 2.244 20 0 BEADLO COc1ccsc1C[N@H+](C)CCF ZINC000293768546 175377306 /nfs/dbraw/zinc/37/73/06/175377306.db2.gz YKFAEUXDYZTEIN-UHFFFAOYSA-N 1 2 203.282 2.158 20 0 BEADLO COc1ccsc1C[N@@H+](C)CCF ZINC000293768546 175377308 /nfs/dbraw/zinc/37/73/08/175377308.db2.gz YKFAEUXDYZTEIN-UHFFFAOYSA-N 1 2 203.282 2.158 20 0 BEADLO COc1ccsc1C[N@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC000336471691 175378287 /nfs/dbraw/zinc/37/82/87/175378287.db2.gz OXHKRSUUQKLFAY-AOOOYVTPSA-N 1 2 239.340 2.120 20 0 BEADLO COc1ccsc1C[N@@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC000336471691 175378288 /nfs/dbraw/zinc/37/82/88/175378288.db2.gz OXHKRSUUQKLFAY-AOOOYVTPSA-N 1 2 239.340 2.120 20 0 BEADLO C[C@@H]([NH2+][C@@H](CCO)c1ccco1)c1ccccn1 ZINC000186515325 175910050 /nfs/dbraw/zinc/91/00/50/175910050.db2.gz PAVMHBGMRKXTHT-YPMHNXCESA-N 1 2 246.310 2.449 20 0 BEADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1cnccn1 ZINC000177242617 176025841 /nfs/dbraw/zinc/02/58/41/176025841.db2.gz BCXVUIVXGPMMOP-NSHDSACASA-N 1 2 228.299 2.065 20 0 BEADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1cnccn1 ZINC000177242617 176025843 /nfs/dbraw/zinc/02/58/43/176025843.db2.gz BCXVUIVXGPMMOP-NSHDSACASA-N 1 2 228.299 2.065 20 0 BEADLO C[C@@H](c1ccccn1)N(C)Cc1[nH+]ccn1C ZINC000179259323 176026061 /nfs/dbraw/zinc/02/60/61/176026061.db2.gz ANSAEIKQPYMDSY-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1cocn1 ZINC000191975846 176028918 /nfs/dbraw/zinc/02/89/18/176028918.db2.gz HCESNMKETZUNHM-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1cocn1 ZINC000191975846 176028919 /nfs/dbraw/zinc/02/89/19/176028919.db2.gz HCESNMKETZUNHM-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1ccon1 ZINC000150871211 176028963 /nfs/dbraw/zinc/02/89/63/176028963.db2.gz FEJZKKHVXONHKG-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1ccon1 ZINC000150871211 176028965 /nfs/dbraw/zinc/02/89/65/176028965.db2.gz FEJZKKHVXONHKG-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@@H](c1ccco1)[N@H+](C)Cc1cncn1C ZINC000177026408 176031025 /nfs/dbraw/zinc/03/10/25/176031025.db2.gz BDUBJOUNQSUCGH-JTQLQIEISA-N 1 2 219.288 2.206 20 0 BEADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1cncn1C ZINC000177026408 176031026 /nfs/dbraw/zinc/03/10/26/176031026.db2.gz BDUBJOUNQSUCGH-JTQLQIEISA-N 1 2 219.288 2.206 20 0 BEADLO C[C@@H](c1ccco1)[N@H+](C)Cc1cnns1 ZINC000336693632 176031871 /nfs/dbraw/zinc/03/18/71/176031871.db2.gz NJOYFNKJNCBPTE-QMMMGPOBSA-N 1 2 223.301 2.324 20 0 BEADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1cnns1 ZINC000336693632 176031873 /nfs/dbraw/zinc/03/18/73/176031873.db2.gz NJOYFNKJNCBPTE-QMMMGPOBSA-N 1 2 223.301 2.324 20 0 BEADLO C[C@@H](c1ccco1)[N@H+](C)Cc1cc(=O)c(O)co1 ZINC000124128145 176031888 /nfs/dbraw/zinc/03/18/88/176031888.db2.gz PXLYIYAIMZZRIU-VIFPVBQESA-N 1 2 249.266 2.131 20 0 BEADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1cc(=O)c(O)co1 ZINC000124128145 176031891 /nfs/dbraw/zinc/03/18/91/176031891.db2.gz PXLYIYAIMZZRIU-VIFPVBQESA-N 1 2 249.266 2.131 20 0 BEADLO C[C@@H](c1ccco1)[N@H+](C)Cc1ccn(C)n1 ZINC000270763803 176032060 /nfs/dbraw/zinc/03/20/60/176032060.db2.gz GBRBWRTVFOXVCR-JTQLQIEISA-N 1 2 219.288 2.206 20 0 BEADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1ccn(C)n1 ZINC000270763803 176032062 /nfs/dbraw/zinc/03/20/62/176032062.db2.gz GBRBWRTVFOXVCR-JTQLQIEISA-N 1 2 219.288 2.206 20 0 BEADLO C[C@@H]1CCCCCN1c1[nH+]cnc2c1cnn2C ZINC000337881372 176062905 /nfs/dbraw/zinc/06/29/05/176062905.db2.gz UYMJEOKJULIVNT-SNVBAGLBSA-N 1 2 245.330 2.132 20 0 BEADLO C[C@@H]1CCCN(C(=O)CCc2c[nH+]cn2C)CC1 ZINC000276588687 176092141 /nfs/dbraw/zinc/09/21/41/176092141.db2.gz MSPLSXJDHRPIOI-GFCCVEGCSA-N 1 2 249.358 2.001 20 0 BEADLO C[C@@H]1CCC[N@@H+]1Cc1nccn1C(F)F ZINC000076115329 176109598 /nfs/dbraw/zinc/10/95/98/176109598.db2.gz FSBWCEXNEWWYTK-MRVPVSSYSA-N 1 2 215.247 2.263 20 0 BEADLO C[C@@H]1CCC[N@H+]1Cc1nccn1C(F)F ZINC000076115329 176109600 /nfs/dbraw/zinc/10/96/00/176109600.db2.gz FSBWCEXNEWWYTK-MRVPVSSYSA-N 1 2 215.247 2.263 20 0 BEADLO C[C@@H]1CCC[C@@H](CC(=O)NCc2c[nH+]c[nH]2)C1 ZINC000330896957 176116048 /nfs/dbraw/zinc/11/60/48/176116048.db2.gz LSPFODLDWBFPLD-GHMZBOCLSA-N 1 2 235.331 2.242 20 0 BEADLO C[C@@H]1CCC[C@@H](CC(=O)NCc2c[nH]c[nH+]2)C1 ZINC000330896957 176116050 /nfs/dbraw/zinc/11/60/50/176116050.db2.gz LSPFODLDWBFPLD-GHMZBOCLSA-N 1 2 235.331 2.242 20 0 BEADLO C[C@@H]1CCC[C@@H](N(C)C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000287550813 176119398 /nfs/dbraw/zinc/11/93/98/176119398.db2.gz LUQJUQMITXSZPR-VXGBXAGGSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)CCc2[nH]cc[nH+]2)CC1 ZINC000289277637 176141287 /nfs/dbraw/zinc/14/12/87/176141287.db2.gz YXVCGXRMSXXCIA-NEPJUHHUSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@@H]1CCN(C(=O)CC2CC2)C[C@H]1n1cc[nH+]c1 ZINC000123836871 176154551 /nfs/dbraw/zinc/15/45/51/176154551.db2.gz XBOURLSGNSOABT-DGCLKSJQSA-N 1 2 247.342 2.093 20 0 BEADLO C[C@@H]1CC[C@@H](CC(=O)NCCCn2cc[nH+]c2)C1 ZINC000164141309 176200842 /nfs/dbraw/zinc/20/08/42/176200842.db2.gz IQPPYDSHCCTFMU-CHWSQXEVSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@@H]1CC[C@@H](CC(=O)N2CCn3c[nH+]cc3C2)C1 ZINC000290950696 176200848 /nfs/dbraw/zinc/20/08/48/176200848.db2.gz PXAHUJAPSVGQHS-VXGBXAGGSA-N 1 2 247.342 2.052 20 0 BEADLO C[C@H]1CN(C(=O)c2ccc3[nH+]ccn3c2)C[C@H]1C ZINC000267613741 176261483 /nfs/dbraw/zinc/26/14/83/176261483.db2.gz HANNCXUSUPHYKM-PHIMTYICSA-N 1 2 243.310 2.062 20 0 BEADLO C[C@@H]1C[N@H+](CCc2cccc(F)c2)CCC1=O ZINC000049693750 176294115 /nfs/dbraw/zinc/29/41/15/176294115.db2.gz UFTFWRXNZIECIH-LLVKDONJSA-N 1 2 235.302 2.279 20 0 BEADLO C[C@@H]1C[N@@H+](CCc2cccc(F)c2)CCC1=O ZINC000049693750 176294116 /nfs/dbraw/zinc/29/41/16/176294116.db2.gz UFTFWRXNZIECIH-LLVKDONJSA-N 1 2 235.302 2.279 20 0 BEADLO C[C@@H]1C[N@H+](Cc2c(N)cccc2F)[C@H](C)CO1 ZINC000104056475 176301879 /nfs/dbraw/zinc/30/18/79/176301879.db2.gz JNDAFNBZXKFKCR-NXEZZACHSA-N 1 2 238.306 2.017 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2c(N)cccc2F)[C@H](C)CO1 ZINC000104056475 176301881 /nfs/dbraw/zinc/30/18/81/176301881.db2.gz JNDAFNBZXKFKCR-NXEZZACHSA-N 1 2 238.306 2.017 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccon2)Cc2ccccc2O1 ZINC000292442444 176309200 /nfs/dbraw/zinc/30/92/00/176309200.db2.gz OPVCHAFZDFYBED-LLVKDONJSA-N 1 2 244.294 2.458 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccon2)Cc2ccccc2O1 ZINC000292442444 176309202 /nfs/dbraw/zinc/30/92/02/176309202.db2.gz OPVCHAFZDFYBED-LLVKDONJSA-N 1 2 244.294 2.458 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnc(Cl)s2)CCCO1 ZINC000086776837 176309745 /nfs/dbraw/zinc/30/97/45/176309745.db2.gz BMWSQPKUYPIHPL-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnc(Cl)s2)CCCO1 ZINC000086776837 176309746 /nfs/dbraw/zinc/30/97/46/176309746.db2.gz BMWSQPKUYPIHPL-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnc3ccccc3c2)CCO1 ZINC000271043286 176310928 /nfs/dbraw/zinc/31/09/28/176310928.db2.gz OWQYTPYZJPXKOY-GFCCVEGCSA-N 1 2 242.322 2.456 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnc3ccccc3c2)CCO1 ZINC000271043286 176310929 /nfs/dbraw/zinc/31/09/29/176310929.db2.gz OWQYTPYZJPXKOY-GFCCVEGCSA-N 1 2 242.322 2.456 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ncc(C3CC3)o2)CCS1 ZINC000270612342 176311832 /nfs/dbraw/zinc/31/18/32/176311832.db2.gz NLCADYPVISKDQA-SECBINFHSA-N 1 2 238.356 2.489 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ncc(C3CC3)o2)CCS1 ZINC000270612342 176311833 /nfs/dbraw/zinc/31/18/33/176311833.db2.gz NLCADYPVISKDQA-SECBINFHSA-N 1 2 238.356 2.489 20 0 BEADLO C[C@@H]1CN(c2cc[nH+]c3ccncc32)CCCO1 ZINC000267929713 176319678 /nfs/dbraw/zinc/31/96/78/176319678.db2.gz FGJLRKGVEJWKEU-LLVKDONJSA-N 1 2 243.310 2.245 20 0 BEADLO C[C@H]1CN(c2cc[nH+]c(C3CC3)n2)C[C@H]1C ZINC000267664199 176320347 /nfs/dbraw/zinc/32/03/47/176320347.db2.gz NNGACLQZUYLVCW-AOOOYVTPSA-N 1 2 217.316 2.446 20 0 BEADLO C[C@@H]1COCCN(c2cc[nH+]c3ccncc32)C1 ZINC000371102284 176333146 /nfs/dbraw/zinc/33/31/46/176333146.db2.gz WCZBJMLYQVKSJI-NSHDSACASA-N 1 2 243.310 2.103 20 0 BEADLO C[C@@H]1COCC[N@@H+]1Cc1ccccc1OC1CC1 ZINC000290098003 176337182 /nfs/dbraw/zinc/33/71/82/176337182.db2.gz RTLUMLPUUWRUAB-GFCCVEGCSA-N 1 2 247.338 2.449 20 0 BEADLO C[C@@H]1COCC[N@H+]1Cc1ccccc1OC1CC1 ZINC000290098003 176337184 /nfs/dbraw/zinc/33/71/84/176337184.db2.gz RTLUMLPUUWRUAB-GFCCVEGCSA-N 1 2 247.338 2.449 20 0 BEADLO C[C@@H]1CSC(SCCn2cc[nH+]c2)=N1 ZINC000155517911 176348981 /nfs/dbraw/zinc/34/89/81/176348981.db2.gz GUUFETIEKVRZOF-MRVPVSSYSA-N 1 2 227.358 2.108 20 0 BEADLO C[C@@H]1C[C@@H](C)[C@@H](C)N(C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000357126868 176365781 /nfs/dbraw/zinc/36/57/81/176365781.db2.gz UDGQQUCSTLZEPR-IJLUTSLNSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H]1C[C@@H](NCc2cscn2)c2[nH+]ccn21 ZINC000345345016 176377942 /nfs/dbraw/zinc/37/79/42/176377942.db2.gz BKNFOYGAADFFFB-PSASIEDQSA-N 1 2 234.328 2.135 20 0 BEADLO C[C@@H]1C[C@@H]([NH2+]Cc2ncn(C)n2)c2ccccc21 ZINC000290234469 176378229 /nfs/dbraw/zinc/37/82/29/176378229.db2.gz IWASJAPDIFSPQX-ZWNOBZJWSA-N 1 2 242.326 2.153 20 0 BEADLO C[C@@H]1C[C@@H]1C[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000277200548 176397794 /nfs/dbraw/zinc/39/77/94/176397794.db2.gz JLIYHBVCZAQGKP-RAIGVLPGSA-N 1 2 242.326 2.140 20 0 BEADLO C[C@H](O)c1ncc(C[N@@H+]2CCC[C@H]2CF)s1 ZINC000294197838 177019300 /nfs/dbraw/zinc/01/93/00/177019300.db2.gz XQMLQZSCDRHRAG-IUCAKERBSA-N 1 2 244.335 2.130 20 0 BEADLO C[C@H](O)c1ncc(C[N@H+]2CCC[C@H]2CF)s1 ZINC000294197838 177019301 /nfs/dbraw/zinc/01/93/01/177019301.db2.gz XQMLQZSCDRHRAG-IUCAKERBSA-N 1 2 244.335 2.130 20 0 BEADLO C[C@H](c1cccnc1)N(C)Cc1[nH+]ccn1C ZINC000179260705 177045668 /nfs/dbraw/zinc/04/56/68/177045668.db2.gz VKGGYKRVFKXPGP-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1ccco1)[N@H+](Cc1cn(C)nn1)C1CC1 ZINC000336783958 177049313 /nfs/dbraw/zinc/04/93/13/177049313.db2.gz NAJHGMAQFIXYMR-SNVBAGLBSA-N 1 2 246.314 2.134 20 0 BEADLO C[C@H](c1ccco1)[N@@H+](Cc1cn(C)nn1)C1CC1 ZINC000336783958 177049316 /nfs/dbraw/zinc/04/93/16/177049316.db2.gz NAJHGMAQFIXYMR-SNVBAGLBSA-N 1 2 246.314 2.134 20 0 BEADLO C[C@H]1CCCC[C@@H]1NC(=O)COc1cc[nH+]cc1 ZINC000276389742 177081696 /nfs/dbraw/zinc/08/16/96/177081696.db2.gz BNAMOQJELGHAIZ-AAEUAGOBSA-N 1 2 248.326 2.155 20 0 BEADLO C[C@H]1CCCC[C@H]1OCCn1cc[nH+]c1 ZINC000121756008 177089595 /nfs/dbraw/zinc/08/95/95/177089595.db2.gz QXWNOJZZQYRVCO-NWDGAFQWSA-N 1 2 208.305 2.478 20 0 BEADLO C[C@H]1CCC[N@@H+]1Cc1ncc(Cl)n1C ZINC000076117860 177110749 /nfs/dbraw/zinc/11/07/49/177110749.db2.gz DBLKLUALNCLLRO-QMMMGPOBSA-N 1 2 213.712 2.058 20 0 BEADLO C[C@H]1CCC[N@H+]1Cc1ncc(Cl)n1C ZINC000076117860 177110750 /nfs/dbraw/zinc/11/07/50/177110750.db2.gz DBLKLUALNCLLRO-QMMMGPOBSA-N 1 2 213.712 2.058 20 0 BEADLO C[C@H]1CCC[C@H](CC(=O)NCCc2[nH]cc[nH+]2)C1 ZINC000330895166 177132582 /nfs/dbraw/zinc/13/25/82/177132582.db2.gz KMHADLKHOOYDLM-RYUDHWBXSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H]1CCC[C@H](CC(=O)NCc2[nH]cc[nH+]2)C1 ZINC000114335522 177132667 /nfs/dbraw/zinc/13/26/67/177132667.db2.gz IHWNKGJJVBFPSL-QWRGUYRKSA-N 1 2 235.331 2.242 20 0 BEADLO C[C@H]1CCC[C@H](NC(=O)CCc2c[nH+]cn2C)C1 ZINC000188572896 177134983 /nfs/dbraw/zinc/13/49/83/177134983.db2.gz HESBZOMPCFTBLW-RYUDHWBXSA-N 1 2 249.358 2.048 20 0 BEADLO C[C@H]1CCC[C@H]1CC(=O)N(C)Cc1[nH+]ccn1C ZINC000274382236 177140082 /nfs/dbraw/zinc/14/00/82/177140082.db2.gz AJMRYJMLTJVPFU-RYUDHWBXSA-N 1 2 249.358 2.205 20 0 BEADLO C[C@H]1CCN(C(=O)C=Cc2c[nH]c[nH+]2)[C@@H](C)C1 ZINC000282708663 177145557 /nfs/dbraw/zinc/14/55/57/177145557.db2.gz GLZDROKQMCAFTG-SEUFLZDSSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@H]1CCN(C(=O)CCc2[nH]cc[nH+]2)CC1(C)C ZINC000287686793 177147035 /nfs/dbraw/zinc/14/70/35/177147035.db2.gz FFGNZKKEBUMCDP-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO C[C@H]1CC[N@H+](Cc2nccn2CC(F)(F)F)C1 ZINC000264091577 177169179 /nfs/dbraw/zinc/16/91/79/177169179.db2.gz QACNWFIRACKRIZ-VIFPVBQESA-N 1 2 247.264 2.287 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2nccn2CC(F)(F)F)C1 ZINC000264091577 177169180 /nfs/dbraw/zinc/16/91/80/177169180.db2.gz QACNWFIRACKRIZ-VIFPVBQESA-N 1 2 247.264 2.287 20 0 BEADLO C[C@H]1CC[C@@H](CC(=O)NCCCn2cc[nH+]c2)C1 ZINC000164141429 177188574 /nfs/dbraw/zinc/18/85/74/177188574.db2.gz IQPPYDSHCCTFMU-QWHCGFSZSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@H]1CC[C@H](CC(=O)N2CCn3c[nH+]cc3C2)C1 ZINC000290950693 177199898 /nfs/dbraw/zinc/19/98/98/177199898.db2.gz PXAHUJAPSVGQHS-RYUDHWBXSA-N 1 2 247.342 2.052 20 0 BEADLO C[C@H]1C[N@H+](CC2=Cc3ccccc3OC2)CCO1 ZINC000179864315 177245199 /nfs/dbraw/zinc/24/51/99/177245199.db2.gz WQOSWUXLRVVEGM-LBPRGKRZSA-N 1 2 245.322 2.183 20 0 BEADLO C[C@H]1C[N@@H+](CC2=Cc3ccccc3OC2)CCO1 ZINC000179864315 177245201 /nfs/dbraw/zinc/24/52/01/177245201.db2.gz WQOSWUXLRVVEGM-LBPRGKRZSA-N 1 2 245.322 2.183 20 0 BEADLO C[C@H]1C[N@H+](Cc2cccc(F)c2)CCC1=O ZINC000049693671 177264989 /nfs/dbraw/zinc/26/49/89/177264989.db2.gz KWKRGQDDBCQASF-JTQLQIEISA-N 1 2 221.275 2.237 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cccc(F)c2)CCC1=O ZINC000049693671 177264990 /nfs/dbraw/zinc/26/49/90/177264990.db2.gz KWKRGQDDBCQASF-JTQLQIEISA-N 1 2 221.275 2.237 20 0 BEADLO C[C@H]1C[N@H+](Cc2cncc(F)c2)CC(C)(C)O1 ZINC000274885177 177268808 /nfs/dbraw/zinc/26/88/08/177268808.db2.gz XYNQGDHCWNTCJQ-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cncc(F)c2)CC(C)(C)O1 ZINC000274885177 177268810 /nfs/dbraw/zinc/26/88/10/177268810.db2.gz XYNQGDHCWNTCJQ-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H]1C[N@H+](Cc2cnc3ccccc3c2)CCO1 ZINC000271043287 177269596 /nfs/dbraw/zinc/26/95/96/177269596.db2.gz OWQYTPYZJPXKOY-LBPRGKRZSA-N 1 2 242.322 2.456 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cnc3ccccc3c2)CCO1 ZINC000271043287 177269597 /nfs/dbraw/zinc/26/95/97/177269597.db2.gz OWQYTPYZJPXKOY-LBPRGKRZSA-N 1 2 242.322 2.456 20 0 BEADLO C[C@H]1CN(c2cc[nH+]c(C3CC3)n2)C[C@@H]1C ZINC000267665700 177277528 /nfs/dbraw/zinc/27/75/28/177277528.db2.gz NNGACLQZUYLVCW-UWVGGRQHSA-N 1 2 217.316 2.446 20 0 BEADLO C[C@H]1COCC[C@@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000277754725 177295630 /nfs/dbraw/zinc/29/56/30/177295630.db2.gz VDSKDRLTJNENMM-ONGXEEELSA-N 1 2 233.315 2.191 20 0 BEADLO C[C@H]1COCC[C@H]1CNc1cccc[nH+]1 ZINC000309117037 177296059 /nfs/dbraw/zinc/29/60/59/177296059.db2.gz LYHQJNOSCXXUIG-QWRGUYRKSA-N 1 2 206.289 2.166 20 0 BEADLO C[C@@H]1C[C@H](C)[C@@H](C)N(C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000357126866 177310724 /nfs/dbraw/zinc/31/07/24/177310724.db2.gz UDGQQUCSTLZEPR-GRYCIOLGSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H]1C[C@@H](O)CN1c1cc(C(F)(F)F)cc[nH+]1 ZINC000335797209 177338728 /nfs/dbraw/zinc/33/87/28/177338728.db2.gz PENNFYGDPRIVJF-IONNQARKSA-N 1 2 246.232 2.060 20 0 BEADLO C[C@H]1C[C@@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000029951528 177340943 /nfs/dbraw/zinc/34/09/43/177340943.db2.gz JWPQYGYGFMLHLX-GWCFXTLKSA-N 1 2 241.294 2.467 20 0 BEADLO C[C@@H]1C[C@@H]1CNc1cc(NC[C@H]2C[C@@H]2C)nc[nH+]1 ZINC000357314263 177345880 /nfs/dbraw/zinc/34/58/80/177345880.db2.gz LLNWTMGKRLUQJI-WRWGMCAJSA-N 1 2 246.358 2.034 20 0 BEADLO C[C@@H]1C[C@@H]1CNc1cc(NC[C@H]2C[C@@H]2C)[nH+]cn1 ZINC000357314263 177345881 /nfs/dbraw/zinc/34/58/81/177345881.db2.gz LLNWTMGKRLUQJI-WRWGMCAJSA-N 1 2 246.358 2.034 20 0 BEADLO C[C@H]1C[C@@H]1CNc1cc[nH+]c(C2CC2)n1 ZINC000264901439 177345948 /nfs/dbraw/zinc/34/59/48/177345948.db2.gz VYKCNSSBSJPWIT-WCBMZHEXSA-N 1 2 203.289 2.422 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NCc2[nH]cc[nH+]2)C[C@@H]1C ZINC000294717220 177354414 /nfs/dbraw/zinc/35/44/14/177354414.db2.gz UWINCQCSUYMSLZ-OUAUKWLOSA-N 1 2 235.331 2.098 20 0 BEADLO C[C@H]1C[C@H](C)CN(C(=O)C(C)(C)c2c[nH+]c[nH]2)C1 ZINC000336404339 177356531 /nfs/dbraw/zinc/35/65/31/177356531.db2.gz ZOSYUYZXXSIBGB-QWRGUYRKSA-N 1 2 249.358 2.192 20 0 BEADLO C[C@H]1C[C@H]([NH2+]CC(F)(F)CO)c2ccccc21 ZINC000290380470 177369041 /nfs/dbraw/zinc/36/90/41/177369041.db2.gz RSLWTELGVQBSCE-CABZTGNLSA-N 1 2 241.281 2.452 20 0 BEADLO C[C@H]1C[C@H](Nc2cc(NC3CC3)[nH+]cn2)CCO1 ZINC000334027494 177371163 /nfs/dbraw/zinc/37/11/63/177371163.db2.gz IHBPYBVXSMNHJS-GXSJLCMTSA-N 1 2 248.330 2.030 20 0 BEADLO C[C@H]1C[C@H](Nc2cc(NC3CC3)nc[nH+]2)CCO1 ZINC000334027494 177371164 /nfs/dbraw/zinc/37/11/64/177371164.db2.gz IHBPYBVXSMNHJS-GXSJLCMTSA-N 1 2 248.330 2.030 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2ccnc(Cl)c2)[C@@H]1C ZINC000178585897 177399986 /nfs/dbraw/zinc/39/99/86/177399986.db2.gz SKNSRIUESXBNIW-NXEZZACHSA-N 1 2 240.734 2.344 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2ccnc(Cl)c2)[C@@H]1C ZINC000178585897 177399988 /nfs/dbraw/zinc/39/99/88/177399988.db2.gz SKNSRIUESXBNIW-NXEZZACHSA-N 1 2 240.734 2.344 20 0 BEADLO Cc1ccc(Cc2noc([C@H]3C[C@@H]3C)n2)c[nH+]1 ZINC000680712793 487638628 /nfs/dbraw/zinc/63/86/28/487638628.db2.gz MXTMXDGDMUODRO-KWQFWETISA-N 1 2 229.283 2.487 20 0 BEADLO c1cc(C[NH2+][C@H]2COCc3ccccc32)no1 ZINC000226005415 487643785 /nfs/dbraw/zinc/64/37/85/487643785.db2.gz ZPNVTPZTIZXMCC-ZDUSSCGKSA-N 1 2 230.267 2.036 20 0 BEADLO c1cc(C[NH2+][C@@H]2COCc3ccccc32)no1 ZINC000226005405 487643824 /nfs/dbraw/zinc/64/38/24/487643824.db2.gz ZPNVTPZTIZXMCC-CYBMUJFWSA-N 1 2 230.267 2.036 20 0 BEADLO Cc1cc(N[C@@H]2[C@@H]3CCC[C@@H]32)nc(C2CC2)[nH+]1 ZINC000486478504 225265369 /nfs/dbraw/zinc/26/53/69/225265369.db2.gz LMCQWNSSLNBONF-PTEHBNRSSA-N 1 2 229.327 2.295 20 0 BEADLO Cc1ccsc1[C@H](CO)Nc1cc[nH+]c(C)n1 ZINC000487614189 225318583 /nfs/dbraw/zinc/31/85/83/225318583.db2.gz BWSDQRKKHIFXBA-JTQLQIEISA-N 1 2 249.339 2.300 20 0 BEADLO OC[C@@H](CNc1cccc[nH+]1)c1ccccc1 ZINC000487660033 225320401 /nfs/dbraw/zinc/32/04/01/225320401.db2.gz CCKRBBOUKVFLGS-CYBMUJFWSA-N 1 2 228.295 2.270 20 0 BEADLO COc1ncccc1C[N@H+](C)CCC(F)(F)F ZINC000487909745 225331638 /nfs/dbraw/zinc/33/16/38/225331638.db2.gz NOADCDKPMNPTBU-UHFFFAOYSA-N 1 2 248.248 2.474 20 0 BEADLO COc1ncccc1C[N@@H+](C)CCC(F)(F)F ZINC000487909745 225331640 /nfs/dbraw/zinc/33/16/40/225331640.db2.gz NOADCDKPMNPTBU-UHFFFAOYSA-N 1 2 248.248 2.474 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N[C@@H]1CC2CCC1CC2 ZINC000492774182 226051101 /nfs/dbraw/zinc/05/11/01/226051101.db2.gz WQVBKWYNJAZPQF-ARXWGKNUSA-N 1 2 245.326 2.118 20 0 BEADLO Cc1ccccc1CNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492776529 226052618 /nfs/dbraw/zinc/05/26/18/226052618.db2.gz ZVZUULCDIOZRHH-VOTSOKGWSA-N 1 2 241.294 2.048 20 0 BEADLO C[C@H]1CC2(CCC2)CN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492856266 226066521 /nfs/dbraw/zinc/06/65/21/226066521.db2.gz BLBCSHZLKITXSD-UFFNRZRYSA-N 1 2 245.326 2.214 20 0 BEADLO Cc1cc(NC(=O)C=CC2CCCC2)cc[nH+]1 ZINC000493296841 226179262 /nfs/dbraw/zinc/17/92/62/226179262.db2.gz WITCQUVWZNZGRX-SREVYHEPSA-N 1 2 230.311 2.497 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)/C=C/c2[nH]cc[nH+]2)C[C@H]1C ZINC000493197227 226154132 /nfs/dbraw/zinc/15/41/32/226154132.db2.gz AJIDXXRFOPXCNW-QEPQOOGFSA-N 1 2 247.342 2.364 20 0 BEADLO Cc1cc(C)nc(NC(=O)C=Cc2c[nH]c[nH+]2)c1 ZINC000493238223 226162733 /nfs/dbraw/zinc/16/27/33/226162733.db2.gz KBGLWVKKQWVEFN-ONEGZZNKSA-N 1 2 242.282 2.073 20 0 BEADLO C[C@H](N(C)C(=O)/C=C/c1[nH]cc[nH+]1)C(C)(C)C ZINC000493509095 226235855 /nfs/dbraw/zinc/23/58/55/226235855.db2.gz AYSUOZUYMPPOJD-FGEFZZPRSA-N 1 2 235.331 2.316 20 0 BEADLO C[C@]1(NC(=O)C=Cc2c[nH]c[nH+]2)CC=CCC1 ZINC000493699264 226249962 /nfs/dbraw/zinc/24/99/62/226249962.db2.gz YBRZRNOWDJTGSD-GFUIURDCSA-N 1 2 231.299 2.038 20 0 BEADLO Nc1ccc(NC(=O)C=CC2CCCC2)c[nH+]1 ZINC000493717470 226250798 /nfs/dbraw/zinc/25/07/98/226250798.db2.gz DJPGCBHZSXANDW-YVMONPNESA-N 1 2 231.299 2.179 20 0 BEADLO O=C(OC1CCC1)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000496363390 226303287 /nfs/dbraw/zinc/30/32/87/226303287.db2.gz OJWIUFJAZRDWMV-JTQLQIEISA-N 1 2 249.314 2.278 20 0 BEADLO C[C@H]1C[C@H](NC(=O)OCC2CC2)c2[nH+]ccn21 ZINC000497104369 226322440 /nfs/dbraw/zinc/32/24/40/226322440.db2.gz BQULKPMGCQLEEF-WPRPVWTQSA-N 1 2 235.287 2.025 20 0 BEADLO Cc1cc(N2C[C@H](C)C[C@H](O)C2)nc(C(C)C)[nH+]1 ZINC000401889785 226362808 /nfs/dbraw/zinc/36/28/08/226362808.db2.gz GSUKQPNWAPFZTQ-PWSUYJOCSA-N 1 2 249.358 2.116 20 0 BEADLO Cc1cc(C)c(CNC(=O)OCCCF)c[nH+]1 ZINC000495985489 226293635 /nfs/dbraw/zinc/29/36/35/226293635.db2.gz ARQQFFSBASUPTB-UHFFFAOYSA-N 1 2 240.278 2.284 20 0 BEADLO C[C@@H]([NH2+]Cc1noc2c1CCCC2)c1cn[nH]c1 ZINC000680833868 487655043 /nfs/dbraw/zinc/65/50/43/487655043.db2.gz HKNCXNUFLOJURG-SECBINFHSA-N 1 2 246.314 2.127 20 0 BEADLO c1c(Cc2nc(C3CC3)no2)[nH+]c2n1CCCC2 ZINC000351408817 487659678 /nfs/dbraw/zinc/65/96/78/487659678.db2.gz QZQMTMMYFBBEAB-UHFFFAOYSA-N 1 2 244.298 2.071 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@H]1CC12CCCC2 ZINC000565752270 322936778 /nfs/dbraw/zinc/93/67/78/322936778.db2.gz DKGWLKJAAUIHHN-LBPRGKRZSA-N 1 2 245.326 2.266 20 0 BEADLO Cc1ccc(C[NH2+]Cc2ncccn2)c(C)c1 ZINC000514615782 487662711 /nfs/dbraw/zinc/66/27/11/487662711.db2.gz FIHIWFUUNOJDNX-UHFFFAOYSA-N 1 2 227.311 2.383 20 0 BEADLO Cc1cc(C)c(CNC(=O)Cc2ccco2)c[nH+]1 ZINC000456829582 487665646 /nfs/dbraw/zinc/66/56/46/487665646.db2.gz CPZVACQKTPWRQY-UHFFFAOYSA-N 1 2 244.294 2.150 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccccc2)nn1C ZINC000487426691 229179630 /nfs/dbraw/zinc/17/96/30/229179630.db2.gz ILGXNYDXVBMJIT-UHFFFAOYSA-N 1 2 229.327 2.361 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccccc2)nn1C ZINC000487426691 229179633 /nfs/dbraw/zinc/17/96/33/229179633.db2.gz ILGXNYDXVBMJIT-UHFFFAOYSA-N 1 2 229.327 2.361 20 0 BEADLO CCc1cc(C)nc(N[C@H](C)Cn2cc[nH+]c2)n1 ZINC000680952948 487677512 /nfs/dbraw/zinc/67/75/12/487677512.db2.gz ZOAGOCRYVRSFFX-LLVKDONJSA-N 1 2 245.330 2.045 20 0 BEADLO CCO[C@@H](C)c1noc(C[N@H+](C)C(C)C)n1 ZINC000115945469 487684090 /nfs/dbraw/zinc/68/40/90/487684090.db2.gz YMPXEEDLKZJMEU-VIFPVBQESA-N 1 2 227.308 2.007 20 0 BEADLO CCO[C@@H](C)c1noc(C[N@@H+](C)C(C)C)n1 ZINC000115945469 487684093 /nfs/dbraw/zinc/68/40/93/487684093.db2.gz YMPXEEDLKZJMEU-VIFPVBQESA-N 1 2 227.308 2.007 20 0 BEADLO CCCC(C)(C)NC(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000667645360 487691889 /nfs/dbraw/zinc/69/18/89/487691889.db2.gz NFRXASKVJHMCPV-SNVBAGLBSA-N 1 2 249.358 2.210 20 0 BEADLO CCCC(C)(C)NC(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000667645360 487691893 /nfs/dbraw/zinc/69/18/93/487691893.db2.gz NFRXASKVJHMCPV-SNVBAGLBSA-N 1 2 249.358 2.210 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2ccoc2C)nn1C ZINC000669698997 487694171 /nfs/dbraw/zinc/69/41/71/487694171.db2.gz HRLLGASBRUHQRQ-JTQLQIEISA-N 1 2 233.315 2.481 20 0 BEADLO Cc1cc(NC(=O)[C@H](C)c2ccco2)c(C)c[nH+]1 ZINC000676587977 487697259 /nfs/dbraw/zinc/69/72/59/487697259.db2.gz MLKDAAVVISCRDI-LLVKDONJSA-N 1 2 244.294 2.456 20 0 BEADLO CCn1cc[nH+]c1CN[C@@H](C)c1ncccc1F ZINC000527826845 262887633 /nfs/dbraw/zinc/88/76/33/262887633.db2.gz UHCNLBJTRPSDPE-JTQLQIEISA-N 1 2 248.305 2.288 20 0 BEADLO C[C@H]1CO[C@H](C(F)(F)F)C[N@@H+]1CCCCF ZINC000671715563 487704817 /nfs/dbraw/zinc/70/48/17/487704817.db2.gz JDSYATFDGDSAOA-IUCAKERBSA-N 1 2 243.244 2.388 20 0 BEADLO C[C@H]1CO[C@H](C(F)(F)F)C[N@H+]1CCCCF ZINC000671715563 487704821 /nfs/dbraw/zinc/70/48/21/487704821.db2.gz JDSYATFDGDSAOA-IUCAKERBSA-N 1 2 243.244 2.388 20 0 BEADLO CC(C)CCCCC(=O)NCc1c[nH+]cn1C ZINC000457820806 487709472 /nfs/dbraw/zinc/70/94/72/487709472.db2.gz WYIHRWHMNFDBDP-UHFFFAOYSA-N 1 2 237.347 2.253 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccn2C)sn1 ZINC000683889878 487709396 /nfs/dbraw/zinc/70/93/96/487709396.db2.gz SILRWFYKJSGBGT-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccn2C)sn1 ZINC000683889878 487709400 /nfs/dbraw/zinc/70/94/00/487709400.db2.gz SILRWFYKJSGBGT-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2cn[nH]c2)c1F ZINC000669708519 487712309 /nfs/dbraw/zinc/71/23/09/487712309.db2.gz KFBITUPPGWZOLE-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2cn[nH]c2)c1F ZINC000669708519 487712312 /nfs/dbraw/zinc/71/23/12/487712312.db2.gz KFBITUPPGWZOLE-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO CCc1cc(N[C@H](CCO)c2ccco2)nc[nH+]1 ZINC000681093308 487719356 /nfs/dbraw/zinc/71/93/56/487719356.db2.gz UATDZBKDKULVCQ-LLVKDONJSA-N 1 2 247.298 2.168 20 0 BEADLO C[N@H+](CCCOC(C)(C)C)CC(F)F ZINC000674906120 487720378 /nfs/dbraw/zinc/72/03/78/487720378.db2.gz DMDFYNVVNIVFMB-UHFFFAOYSA-N 1 2 209.280 2.389 20 0 BEADLO C[N@@H+](CCCOC(C)(C)C)CC(F)F ZINC000674906120 487720386 /nfs/dbraw/zinc/72/03/86/487720386.db2.gz DMDFYNVVNIVFMB-UHFFFAOYSA-N 1 2 209.280 2.389 20 0 BEADLO CCc1cc(NC[C@H](C)CCOC)nc[nH+]1 ZINC000665743975 487720843 /nfs/dbraw/zinc/72/08/43/487720843.db2.gz FMODKNOYBPKCMD-SNVBAGLBSA-N 1 2 223.320 2.124 20 0 BEADLO C[C@H](CCC1CC1)NC(=O)CCCn1cc[nH+]c1 ZINC000681108009 487727519 /nfs/dbraw/zinc/72/75/19/487727519.db2.gz ZCSUFUHCWJYCLJ-GFCCVEGCSA-N 1 2 249.358 2.358 20 0 BEADLO CCc1noc(C[N@@H+]2CCCC3(CC3)C2)n1 ZINC000681169006 487742199 /nfs/dbraw/zinc/74/21/99/487742199.db2.gz KYRDWBWADHPCGB-UHFFFAOYSA-N 1 2 221.304 2.008 20 0 BEADLO CCc1noc(C[N@H+]2CCCC3(CC3)C2)n1 ZINC000681169006 487742203 /nfs/dbraw/zinc/74/22/03/487742203.db2.gz KYRDWBWADHPCGB-UHFFFAOYSA-N 1 2 221.304 2.008 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)[C@H]1CCSC1 ZINC000675567316 487749489 /nfs/dbraw/zinc/74/94/89/487749489.db2.gz JHVJHDOPOROMNU-VIFPVBQESA-N 1 2 247.323 2.026 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccc(Cl)o2)nn1C ZINC000666215979 487756025 /nfs/dbraw/zinc/75/60/25/487756025.db2.gz KVEOKRWOQWACKC-UHFFFAOYSA-N 1 2 239.706 2.265 20 0 BEADLO Cc1ccc(F)cc1CN1CCn2c[nH+]cc2C1 ZINC000291689872 487759328 /nfs/dbraw/zinc/75/93/28/487759328.db2.gz XZESQZDRWKUKMS-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO CC1=C(C)CN(c2cc(CO)cc[nH+]2)CC1 ZINC000382974641 487769364 /nfs/dbraw/zinc/76/93/64/487769364.db2.gz OSTVEWUGXOSUHZ-UHFFFAOYSA-N 1 2 218.300 2.120 20 0 BEADLO Cc1nc(N(C)C)nc(NCC2CCCCC2)[nH+]1 ZINC000676076885 487810102 /nfs/dbraw/zinc/81/01/02/487810102.db2.gz GPFUFCFKIHMEQD-UHFFFAOYSA-N 1 2 249.362 2.238 20 0 BEADLO Cc1nc(NCC2CCCCC2)nc(N(C)C)[nH+]1 ZINC000676076885 487810110 /nfs/dbraw/zinc/81/01/10/487810110.db2.gz GPFUFCFKIHMEQD-UHFFFAOYSA-N 1 2 249.362 2.238 20 0 BEADLO C[C@@H]1C[C@@H](O)C[N@@H+]1Cc1ccc(F)c(F)c1F ZINC000668045229 487818840 /nfs/dbraw/zinc/81/88/40/487818840.db2.gz LNTYFJIKZSCVHU-VXNVDRBHSA-N 1 2 245.244 2.059 20 0 BEADLO C[C@@H]1C[C@@H](O)C[N@H+]1Cc1ccc(F)c(F)c1F ZINC000668045229 487818843 /nfs/dbraw/zinc/81/88/43/487818843.db2.gz LNTYFJIKZSCVHU-VXNVDRBHSA-N 1 2 245.244 2.059 20 0 BEADLO Cc1cc(NC(=O)N[C@@H](C(C)C)C2CC2)cc[nH+]1 ZINC000666490435 487820603 /nfs/dbraw/zinc/82/06/03/487820603.db2.gz QNEWXANZWNWFIS-ZDUSSCGKSA-N 1 2 247.342 2.368 20 0 BEADLO CC[C@@H](NC(=O)Nc1cc[nH+]c(C)c1)C1CC1 ZINC000666489872 487820229 /nfs/dbraw/zinc/82/02/29/487820229.db2.gz KXPBXDYEXDEUIZ-GFCCVEGCSA-N 1 2 233.315 2.122 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@H](C(C)C)C1CC1 ZINC000666493624 487821095 /nfs/dbraw/zinc/82/10/95/487821095.db2.gz KKRHIIMFYJPBEI-ZDUSSCGKSA-N 1 2 247.342 2.368 20 0 BEADLO COCc1ccc(CNc2ccc(OC)c[nH+]2)o1 ZINC000676201614 487820809 /nfs/dbraw/zinc/82/08/09/487820809.db2.gz ZXBHTJBVZRQNEV-UHFFFAOYSA-N 1 2 248.282 2.442 20 0 BEADLO Cc1cc(NC(=O)N[C@]2(C)CC2(C)C)c(C)c[nH+]1 ZINC000666496140 487821499 /nfs/dbraw/zinc/82/14/99/487821499.db2.gz JQOKXLMWBMMENM-CQSZACIVSA-N 1 2 247.342 2.430 20 0 BEADLO CC[C@@H](NC(=O)Nc1cc[nH+]cc1C)C1CC1 ZINC000666493937 487822097 /nfs/dbraw/zinc/82/20/97/487822097.db2.gz PLBKFQCWLSBONF-LLVKDONJSA-N 1 2 233.315 2.122 20 0 BEADLO CC[C@@H]1[C@H](C)CCN1C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493532892 487822909 /nfs/dbraw/zinc/82/29/09/487822909.db2.gz WINUMAURHDTCMU-XKFHPXPTSA-N 1 2 233.315 2.070 20 0 BEADLO CC[C@@H](O)Cn1c[nH+]c2cc(F)c(F)cc21 ZINC000156341695 487826158 /nfs/dbraw/zinc/82/61/58/487826158.db2.gz NNYJVFFGQVCQEF-SSDOTTSWSA-N 1 2 226.226 2.085 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1c(C(F)(F)F)cnn1C ZINC000668089972 487833249 /nfs/dbraw/zinc/83/32/49/487833249.db2.gz COJKTWDVNCJMFN-HTQZYQBOSA-N 1 2 247.264 2.422 20 0 BEADLO C[C@H]([N@H+](C)Cc1cnsn1)C(C)(C)C ZINC000846768706 588286780 /nfs/dbraw/zinc/28/67/80/588286780.db2.gz DJSLXTFRAIMTNT-QMMMGPOBSA-N 1 2 213.350 2.405 20 0 BEADLO C[C@H]([N@@H+](C)Cc1cnsn1)C(C)(C)C ZINC000846768706 588286781 /nfs/dbraw/zinc/28/67/81/588286781.db2.gz DJSLXTFRAIMTNT-QMMMGPOBSA-N 1 2 213.350 2.405 20 0 BEADLO COCC[N@@H+](CCF)C[C@@H]1CC1(Cl)Cl ZINC000852484511 588684958 /nfs/dbraw/zinc/68/49/58/588684958.db2.gz GGJFUAQRFKPTSD-QMMMGPOBSA-N 1 2 244.137 2.098 20 0 BEADLO CC(C)(C)C[C@@H]1C[C@H]1[NH2+]Cc1ccn[nH]1 ZINC000651911590 487859875 /nfs/dbraw/zinc/85/98/75/487859875.db2.gz KGCGBDUNAZXYFZ-GXSJLCMTSA-N 1 2 207.321 2.324 20 0 BEADLO CC(=O)C(C)(C)CCC(=O)Nc1cc[nH+]cc1C ZINC000676527307 487865081 /nfs/dbraw/zinc/86/50/81/487865081.db2.gz FMAOUGYPLPEWOF-UHFFFAOYSA-N 1 2 248.326 2.146 20 0 BEADLO CC(=O)C(C)(C)CCC(=O)Nc1cc[nH+]c(C)c1 ZINC000676528536 487865790 /nfs/dbraw/zinc/86/57/90/487865790.db2.gz OTFJVUBXEYEEHI-UHFFFAOYSA-N 1 2 248.326 2.146 20 0 BEADLO COc1nccnc1CNc1cc(C)c[nH+]c1C ZINC000651924877 487865481 /nfs/dbraw/zinc/86/54/81/487865481.db2.gz RBSQVBZGGXNKSP-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO CCc1cc(N[C@@H]2CCC[C@H]3OCC[C@@H]32)nc[nH+]1 ZINC000675449117 487870338 /nfs/dbraw/zinc/87/03/38/487870338.db2.gz PYASTYBZJJZZRX-JHJVBQTASA-N 1 2 247.342 2.409 20 0 BEADLO C[C@H](C[N@H+]1CC(=O)N(CC2CC2)C1)C(C)(C)C ZINC000670270482 487886090 /nfs/dbraw/zinc/88/60/90/487886090.db2.gz JKXJQQRSYQOOEA-LLVKDONJSA-N 1 2 238.375 2.180 20 0 BEADLO C[C@H](C[N@@H+]1CC(=O)N(CC2CC2)C1)C(C)(C)C ZINC000670270482 487886095 /nfs/dbraw/zinc/88/60/95/487886095.db2.gz JKXJQQRSYQOOEA-LLVKDONJSA-N 1 2 238.375 2.180 20 0 BEADLO C[C@@H](C[N@H+]1CC(=O)N(CC2CC2)C1)C(C)(C)C ZINC000670270483 487886157 /nfs/dbraw/zinc/88/61/57/487886157.db2.gz JKXJQQRSYQOOEA-NSHDSACASA-N 1 2 238.375 2.180 20 0 BEADLO C[C@@H](C[N@@H+]1CC(=O)N(CC2CC2)C1)C(C)(C)C ZINC000670270483 487886161 /nfs/dbraw/zinc/88/61/61/487886161.db2.gz JKXJQQRSYQOOEA-NSHDSACASA-N 1 2 238.375 2.180 20 0 BEADLO Cc1ncc([C@@H](C)[N@H+](C)Cc2cc[nH]n2)c(C)n1 ZINC000682068981 487889580 /nfs/dbraw/zinc/88/95/80/487889580.db2.gz BGONGCDMWLMWNU-SNVBAGLBSA-N 1 2 245.330 2.010 20 0 BEADLO Cc1ncc([C@@H](C)[N@@H+](C)Cc2cc[nH]n2)c(C)n1 ZINC000682068981 487889582 /nfs/dbraw/zinc/88/95/82/487889582.db2.gz BGONGCDMWLMWNU-SNVBAGLBSA-N 1 2 245.330 2.010 20 0 BEADLO Cc1ncc([C@H](C)[N@H+](C)Cc2cc[nH]n2)c(C)n1 ZINC000682068980 487889826 /nfs/dbraw/zinc/88/98/26/487889826.db2.gz BGONGCDMWLMWNU-JTQLQIEISA-N 1 2 245.330 2.010 20 0 BEADLO Cc1ncc([C@H](C)[N@@H+](C)Cc2cc[nH]n2)c(C)n1 ZINC000682068980 487889830 /nfs/dbraw/zinc/88/98/30/487889830.db2.gz BGONGCDMWLMWNU-JTQLQIEISA-N 1 2 245.330 2.010 20 0 BEADLO Cc1ncc([C@@H](C)[N@H+](C)Cc2cn[nH]c2)c(C)n1 ZINC000682071394 487893813 /nfs/dbraw/zinc/89/38/13/487893813.db2.gz HTLBTIYAWXDRJW-SNVBAGLBSA-N 1 2 245.330 2.010 20 0 BEADLO Cc1ncc([C@@H](C)[N@@H+](C)Cc2cn[nH]c2)c(C)n1 ZINC000682071394 487893817 /nfs/dbraw/zinc/89/38/17/487893817.db2.gz HTLBTIYAWXDRJW-SNVBAGLBSA-N 1 2 245.330 2.010 20 0 BEADLO CC(C)(C[NH2+]CC(F)(F)CN)c1ccccc1 ZINC000666865828 487894097 /nfs/dbraw/zinc/89/40/97/487894097.db2.gz MTAOJPUSPDHUTF-UHFFFAOYSA-N 1 2 242.313 2.148 20 0 BEADLO CCc1nc(C[N@@H+]2CCCOC[C@@H]2C)cs1 ZINC000676710427 487897557 /nfs/dbraw/zinc/89/75/57/487897557.db2.gz DHIVCYTWUDKRIG-JTQLQIEISA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nc(C[N@H+]2CCCOC[C@@H]2C)cs1 ZINC000676710427 487897561 /nfs/dbraw/zinc/89/75/61/487897561.db2.gz DHIVCYTWUDKRIG-JTQLQIEISA-N 1 2 240.372 2.316 20 0 BEADLO CC(C)n1ccc(C[N@@H+]2CCCOC[C@@H]2C)n1 ZINC000676713486 487902136 /nfs/dbraw/zinc/90/21/36/487902136.db2.gz PZUTUFDRPZMAMQ-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccc(C[N@H+]2CCCOC[C@@H]2C)n1 ZINC000676713486 487902139 /nfs/dbraw/zinc/90/21/39/487902139.db2.gz PZUTUFDRPZMAMQ-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO Cc1cn2c([nH+]1)CN(C(=O)C1=CCCCC1)CC2 ZINC000682165623 487922919 /nfs/dbraw/zinc/92/29/19/487922919.db2.gz XEUSUTNXVUJPRM-UHFFFAOYSA-N 1 2 245.326 2.034 20 0 BEADLO Cc1cnn(C)c1CNc1cc(C)c[nH+]c1C ZINC000404597708 487928224 /nfs/dbraw/zinc/92/82/24/487928224.db2.gz JHXXFTQUWWHEIQ-UHFFFAOYSA-N 1 2 230.315 2.352 20 0 BEADLO FC(F)C[NH+]1CCC(C2CCOCC2)CC1 ZINC000676913160 487946673 /nfs/dbraw/zinc/94/66/73/487946673.db2.gz DASZFUSRBMJODQ-UHFFFAOYSA-N 1 2 233.302 2.390 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1ccnc(C)n1 ZINC000684618311 487947074 /nfs/dbraw/zinc/94/70/74/487947074.db2.gz MCQGFWMMNYNCGR-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1ccnc(C)n1 ZINC000684618311 487947076 /nfs/dbraw/zinc/94/70/76/487947076.db2.gz MCQGFWMMNYNCGR-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H](C)[C@H]1CCCCO1 ZINC000679365012 487948069 /nfs/dbraw/zinc/94/80/69/487948069.db2.gz WOKZUDSHFRFLMO-XHVZSJERSA-N 1 2 237.347 2.326 20 0 BEADLO COc1cc([C@H](C)[NH2+][C@@H](C)c2ccon2)ccn1 ZINC000569589978 322971406 /nfs/dbraw/zinc/97/14/06/322971406.db2.gz DDADDJZVADTHAM-UWVGGRQHSA-N 1 2 247.298 2.490 20 0 BEADLO Cc1ccnc(NC(=O)C[C@H](C)n2cc[nH+]c2)c1 ZINC000560342396 322985959 /nfs/dbraw/zinc/98/59/59/322985959.db2.gz DDIRQBQUYZUEDY-NSHDSACASA-N 1 2 244.298 2.176 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCSC[C@H](C)C1 ZINC000566484770 323001507 /nfs/dbraw/zinc/00/15/07/323001507.db2.gz SGYNFVDAAOFDHU-SECBINFHSA-N 1 2 237.372 2.283 20 0 BEADLO CN(c1[nH+]c2ccccc2n1C)C1CCOCC1 ZINC000258727894 323002636 /nfs/dbraw/zinc/00/26/36/323002636.db2.gz GXRJTODIZZLZMD-UHFFFAOYSA-N 1 2 245.326 2.189 20 0 BEADLO CC[C@@]1(C(C)C)C[C@@H]1NC(=O)Cc1[nH]c[nH+]c1C ZINC000516954551 323005316 /nfs/dbraw/zinc/00/53/16/323005316.db2.gz ULJBHHHALLUVGY-JSGCOSHPSA-N 1 2 249.358 2.202 20 0 BEADLO CC[C@@]1(C(C)C)C[C@@H]1NC(=O)Cc1[nH+]c[nH]c1C ZINC000516954551 323005317 /nfs/dbraw/zinc/00/53/17/323005317.db2.gz ULJBHHHALLUVGY-JSGCOSHPSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCCc1nccs1 ZINC000564740372 323017129 /nfs/dbraw/zinc/01/71/29/323017129.db2.gz LJSWHEIGHBMQFM-UHFFFAOYSA-N 1 2 248.355 2.017 20 0 BEADLO OCCC1CCN(c2[nH]c3ccccc3[nH+]2)CC1 ZINC000400930596 323024172 /nfs/dbraw/zinc/02/41/72/323024172.db2.gz OGIKGIKXKAOIKM-UHFFFAOYSA-N 1 2 245.326 2.162 20 0 BEADLO CCC1(NC(=O)Nc2ccn3cc[nH+]c3c2)CC1 ZINC000562610527 323025491 /nfs/dbraw/zinc/02/54/91/323025491.db2.gz ABNCZQFFNVMXKY-UHFFFAOYSA-N 1 2 244.298 2.398 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N(C)CC1CCC1 ZINC000137034257 323032733 /nfs/dbraw/zinc/03/27/33/323032733.db2.gz XEXCNOYYTUJEBV-BQYQJAHWSA-N 1 2 247.342 2.175 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1CCC[C@@H](C)CC1 ZINC000569707243 323037876 /nfs/dbraw/zinc/03/78/76/323037876.db2.gz WRPMAAMQMRJQBJ-NEPJUHHUSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1CCC[C@@H](C)CC1 ZINC000569707243 323037877 /nfs/dbraw/zinc/03/78/77/323037877.db2.gz WRPMAAMQMRJQBJ-NEPJUHHUSA-N 1 2 249.358 2.237 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCC(OC(C)C)CC1 ZINC000572734815 323040569 /nfs/dbraw/zinc/04/05/69/323040569.db2.gz LASRWELRRSSMJL-UHFFFAOYSA-N 1 2 249.358 2.487 20 0 BEADLO C[C@@H](CC(=O)N1CCC(C)(C)C1)n1cc[nH+]c1 ZINC000570049551 323048195 /nfs/dbraw/zinc/04/81/95/323048195.db2.gz PAOOJPGLVKYNKS-NSHDSACASA-N 1 2 235.331 2.093 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)[C@@H]1CC[C@@H](C)CC1 ZINC000570285016 323055188 /nfs/dbraw/zinc/05/51/88/323055188.db2.gz QNPXMZDEVKZZKG-JHJVBQTASA-N 1 2 249.358 2.214 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CC[C@H]3C[C@H]3C2)c(C)c[nH+]1 ZINC000570318910 323056039 /nfs/dbraw/zinc/05/60/39/323056039.db2.gz XROKFVLKQAVPLJ-XQQFMLRXSA-N 1 2 244.338 2.495 20 0 BEADLO C[C@H]1CC[C@@H]1NC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000570733288 323069025 /nfs/dbraw/zinc/06/90/25/323069025.db2.gz KILYZNYJQSCAJM-ONGXEEELSA-N 1 2 244.298 2.254 20 0 BEADLO C[C@@H](CC(=O)Nc1ccccc1O)n1cc[nH+]c1 ZINC000570832472 323072148 /nfs/dbraw/zinc/07/21/48/323072148.db2.gz CCGNICSVOCUEKN-JTQLQIEISA-N 1 2 245.282 2.179 20 0 BEADLO CC(C)(C)CCNc1nc(N)c2ccccc2[nH+]1 ZINC000536538745 323076958 /nfs/dbraw/zinc/07/69/58/323076958.db2.gz JWKOPIPFKLRZJT-UHFFFAOYSA-N 1 2 244.342 2.312 20 0 BEADLO C[C@H](c1ccccc1)[C@H](O)C[NH2+]CC(C)(F)F ZINC000563001506 323079227 /nfs/dbraw/zinc/07/92/27/323079227.db2.gz VSRCGGSSAAQLRC-ZYHUDNBSSA-N 1 2 243.297 2.396 20 0 BEADLO CC[C@H]([NH2+]C[C@@H](C)COC)C(F)(F)F ZINC000308582480 323080624 /nfs/dbraw/zinc/08/06/24/323080624.db2.gz HCDSRWHEJYNKST-SFYZADRCSA-N 1 2 213.243 2.199 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1Nc1[nH+]cnc2c1cnn2C ZINC000397383640 323090505 /nfs/dbraw/zinc/09/05/05/323090505.db2.gz OGKYGAXGTRZFTB-MFKMUULPSA-N 1 2 245.330 2.210 20 0 BEADLO Cc1cc(CC(=O)Nc2ccc(C)[nH+]c2C)on1 ZINC000570973976 323102348 /nfs/dbraw/zinc/10/23/48/323102348.db2.gz WCYAKZOLXPQVFI-UHFFFAOYSA-N 1 2 245.282 2.176 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NC1CCCCC1 ZINC000570981744 323102796 /nfs/dbraw/zinc/10/27/96/323102796.db2.gz WATQDUMXGMADOY-JTQLQIEISA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NC1CCCCC1 ZINC000570981744 323102797 /nfs/dbraw/zinc/10/27/97/323102797.db2.gz WATQDUMXGMADOY-JTQLQIEISA-N 1 2 235.331 2.037 20 0 BEADLO CCC1CCN(C(=O)C[C@H](C)n2cc[nH+]c2)CC1 ZINC000563237049 323105825 /nfs/dbraw/zinc/10/58/25/323105825.db2.gz DHROSVICFIRRMG-LBPRGKRZSA-N 1 2 249.358 2.483 20 0 BEADLO C[C@@H]1C[C@@H](C)N(c2nc(N)c3ccccc3[nH+]2)C1 ZINC000534272773 323115347 /nfs/dbraw/zinc/11/53/47/323115347.db2.gz YIRZTOFQZYJYTI-NXEZZACHSA-N 1 2 242.326 2.277 20 0 BEADLO CCC[C@H](CC)Nc1nc(N)c2ccccc2[nH+]1 ZINC000534272737 323115358 /nfs/dbraw/zinc/11/53/58/323115358.db2.gz OCHXFWFIZIIKPP-JTQLQIEISA-N 1 2 244.342 2.455 20 0 BEADLO Cc1ccc(CC(=O)Nc2cc(C)[nH+]cc2C)o1 ZINC000534299899 323115825 /nfs/dbraw/zinc/11/58/25/323115825.db2.gz ITBZRPAEWRAONH-UHFFFAOYSA-N 1 2 244.294 2.203 20 0 BEADLO Cc1cc(NC(=O)C2=CCCC2)c(C)c[nH+]1 ZINC000534299659 323115911 /nfs/dbraw/zinc/11/59/11/323115911.db2.gz DSNNPVKBKWUIOO-UHFFFAOYSA-N 1 2 216.284 2.169 20 0 BEADLO CO[C@@H]1C[C@H](Nc2nc(C)[nH+]cc2C)C12CCC2 ZINC000563423769 323124266 /nfs/dbraw/zinc/12/42/66/323124266.db2.gz JGCAPUVPXRHIQZ-NWDGAFQWSA-N 1 2 247.342 2.463 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CC(C2CCC2)C1 ZINC000563634666 323132920 /nfs/dbraw/zinc/13/29/20/323132920.db2.gz GSQXQOMOGRQEIS-UHFFFAOYSA-N 1 2 217.316 2.330 20 0 BEADLO Cc1c[nH+]c(C)nc1NCC1(C)CCC1 ZINC000571418149 323144385 /nfs/dbraw/zinc/14/43/85/323144385.db2.gz RXIYQXAROGMVQA-UHFFFAOYSA-N 1 2 205.305 2.117 20 0 BEADLO Cc1cccc(CC[N@@H+]2Cc3cccnc3C2)n1 ZINC000571555945 323147882 /nfs/dbraw/zinc/14/78/82/323147882.db2.gz FCVUWYXCZVCQKY-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1cccc(CC[N@H+]2Cc3cccnc3C2)n1 ZINC000571555945 323147883 /nfs/dbraw/zinc/14/78/83/323147883.db2.gz FCVUWYXCZVCQKY-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CC(CC(F)F)C1 ZINC000571581912 323148584 /nfs/dbraw/zinc/14/85/84/323148584.db2.gz UMJZJNDMNLWBJY-UHFFFAOYSA-N 1 2 227.258 2.185 20 0 BEADLO CCC1(CNC(=O)Nc2cc(C)[nH+]cc2C)CC1 ZINC000535061164 323164854 /nfs/dbraw/zinc/16/48/54/323164854.db2.gz YLDCZNFMFAUJMW-UHFFFAOYSA-N 1 2 247.342 2.432 20 0 BEADLO CCCC[C@@H]([NH2+]CCOC(C)(C)C)C(=O)OC ZINC000308595077 323176084 /nfs/dbraw/zinc/17/60/84/323176084.db2.gz YHPPSKLLCZKCQP-LLVKDONJSA-N 1 2 245.363 2.123 20 0 BEADLO C[C@@H](CCc1ccco1)Nc1c[nH]c[nH+]1 ZINC000308835822 323179827 /nfs/dbraw/zinc/17/98/27/323179827.db2.gz IAMFFMMESUUBMT-VIFPVBQESA-N 1 2 205.261 2.436 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1CNC(=O)Cn1cc[nH+]c1 ZINC000563861120 323181535 /nfs/dbraw/zinc/18/15/35/323181535.db2.gz LIFADLPDXDLQAR-CHWSQXEVSA-N 1 2 249.358 2.216 20 0 BEADLO COc1cccc(C[NH2+][C@H](C)c2csnn2)c1 ZINC000398483505 323185928 /nfs/dbraw/zinc/18/59/28/323185928.db2.gz SSNNDCCCEHOSRB-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO OCC1CCN(c2[nH+]ccc3ccccc32)CC1 ZINC000113363747 323188145 /nfs/dbraw/zinc/18/81/45/323188145.db2.gz WGGCHTXQUMQYGF-UHFFFAOYSA-N 1 2 242.322 2.444 20 0 BEADLO CSC[C@@H](C)C(=O)Nc1cc(C)[nH+]cc1C ZINC000535748644 323190437 /nfs/dbraw/zinc/19/04/37/323190437.db2.gz PACOJTGKJNBFEZ-SECBINFHSA-N 1 2 238.356 2.058 20 0 BEADLO Cc1cccc(C[NH2+][C@H](C)c2cnccn2)n1 ZINC000070479595 323196063 /nfs/dbraw/zinc/19/60/63/323196063.db2.gz YIVZCNYRWXYWSQ-LLVKDONJSA-N 1 2 228.299 2.031 20 0 BEADLO CC[C@@H]1CC[C@H](C(=O)Nc2cc(C)[nH+]cc2C)O1 ZINC000536574374 323197918 /nfs/dbraw/zinc/19/79/18/323197918.db2.gz SCFYAGFISHQQGB-DGCLKSJQSA-N 1 2 248.326 2.016 20 0 BEADLO Cc1cc(NC(O)=CC(F)(F)F)c(C)c[nH+]1 ZINC000536574359 323198005 /nfs/dbraw/zinc/19/80/05/323198005.db2.gz PXAAIQRTUAPPAD-UHFFFAOYSA-N 1 2 232.205 2.011 20 0 BEADLO Cc1cc(NC(=O)NCCC(C)C)c(C)c[nH+]1 ZINC000536619486 323198777 /nfs/dbraw/zinc/19/87/77/323198777.db2.gz JFRWDMGLNANFAB-UHFFFAOYSA-N 1 2 235.331 2.288 20 0 BEADLO Cc1cc(NC(=O)NCC2(C)CCC2)c(C)c[nH+]1 ZINC000536620011 323198828 /nfs/dbraw/zinc/19/88/28/323198828.db2.gz NSSYGNBLEGUEKX-UHFFFAOYSA-N 1 2 247.342 2.432 20 0 BEADLO c1[nH+]c(SC[C@H]2CCOC2)n2ccccc12 ZINC000042152673 323243859 /nfs/dbraw/zinc/24/38/59/323243859.db2.gz MHWHAUUOOZZOFD-JTQLQIEISA-N 1 2 234.324 2.463 20 0 BEADLO C[N@H+](CCC(F)(F)F)Cc1ccno1 ZINC000532662141 323286321 /nfs/dbraw/zinc/28/63/21/323286321.db2.gz KRWSSAWLVJLYJD-UHFFFAOYSA-N 1 2 208.183 2.059 20 0 BEADLO C[N@@H+](CCC(F)(F)F)Cc1ccno1 ZINC000532662141 323286323 /nfs/dbraw/zinc/28/63/23/323286323.db2.gz KRWSSAWLVJLYJD-UHFFFAOYSA-N 1 2 208.183 2.059 20 0 BEADLO C[N@H+](Cc1ccno1)Cc1nc2ccccc2o1 ZINC000532749924 323294097 /nfs/dbraw/zinc/29/40/97/323294097.db2.gz VPTBMMKLGIOQIQ-UHFFFAOYSA-N 1 2 243.266 2.448 20 0 BEADLO C[N@@H+](Cc1ccno1)Cc1nc2ccccc2o1 ZINC000532749924 323294101 /nfs/dbraw/zinc/29/41/01/323294101.db2.gz VPTBMMKLGIOQIQ-UHFFFAOYSA-N 1 2 243.266 2.448 20 0 BEADLO CCCCOCC[N@@H+]1Cc2cccnc2C1 ZINC000563953435 323333752 /nfs/dbraw/zinc/33/37/52/323333752.db2.gz OEBHWCCWFDOZIZ-UHFFFAOYSA-N 1 2 220.316 2.214 20 0 BEADLO CCCCOCC[N@H+]1Cc2cccnc2C1 ZINC000563953435 323333756 /nfs/dbraw/zinc/33/37/56/323333756.db2.gz OEBHWCCWFDOZIZ-UHFFFAOYSA-N 1 2 220.316 2.214 20 0 BEADLO CCc1ccc(NC(=O)Cn2cc[nH+]c2)cc1F ZINC000152478599 323341104 /nfs/dbraw/zinc/34/11/04/323341104.db2.gz VFKJNVWTRHTQFC-UHFFFAOYSA-N 1 2 247.273 2.223 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCC1(C)C)C(=O)OC(C)(C)C ZINC000309304425 323341396 /nfs/dbraw/zinc/34/13/96/323341396.db2.gz MUCLJXACQWOCJU-NXEZZACHSA-N 1 2 227.348 2.495 20 0 BEADLO CC(C)(C)[C@@H]1C[C@H]([NH2+]Cc2ccn[nH]2)CS1 ZINC000309397262 323372508 /nfs/dbraw/zinc/37/25/08/323372508.db2.gz VQFJPWHTDPOBLO-QWRGUYRKSA-N 1 2 239.388 2.420 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1CCC[C@@H]1F ZINC000572257060 323580522 /nfs/dbraw/zinc/58/05/22/323580522.db2.gz AVDFPYUQECLWDK-VHSXEESVSA-N 1 2 209.268 2.396 20 0 BEADLO CS[C@@H](C)CCC(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000572378045 323612875 /nfs/dbraw/zinc/61/28/75/323612875.db2.gz VUDWFMWDMXBFES-DTWKUNHWSA-N 1 2 241.360 2.119 20 0 BEADLO O=[S@@]1CC[C@H](Nc2[nH+]ccc3ccccc32)C1 ZINC000527908680 323718156 /nfs/dbraw/zinc/71/81/56/323718156.db2.gz FYMSBVXMZFVUOH-APPDUMDISA-N 1 2 246.335 2.168 20 0 BEADLO CCn1ncc(C[NH2+][C@@H](C)c2cc(C)c(C)o2)n1 ZINC000527924029 323730943 /nfs/dbraw/zinc/73/09/43/323730943.db2.gz NISRIBZFUCXMNA-JTQLQIEISA-N 1 2 248.330 2.359 20 0 BEADLO FC[C@@H]1CN(c2[nH+]ccc3ccccc32)CCO1 ZINC000528033337 323742256 /nfs/dbraw/zinc/74/22/56/323742256.db2.gz AUQUGOOKFCGKHL-GFCCVEGCSA-N 1 2 246.285 2.410 20 0 BEADLO O[C@@H]1C[C@H](F)CN(c2[nH+]ccc3ccccc32)C1 ZINC000528052927 323753479 /nfs/dbraw/zinc/75/34/79/323753479.db2.gz GMFBKLHPGSHUIV-NWDGAFQWSA-N 1 2 246.285 2.144 20 0 BEADLO CC(C)O[C@@]1(C)C[C@H]1Nc1cc[nH+]c(C(C)C)n1 ZINC000528204381 323780356 /nfs/dbraw/zinc/78/03/56/323780356.db2.gz XCWFNMRFXOSJAN-RISCZKNCSA-N 1 2 249.358 2.390 20 0 BEADLO O=C(C[C@H]1C=CCCC1)N1CC(n2cc[nH+]c2)C1 ZINC000548634531 323781961 /nfs/dbraw/zinc/78/19/61/323781961.db2.gz IUSSLIKYIHJGBX-LBPRGKRZSA-N 1 2 245.326 2.013 20 0 BEADLO COc1ccc[nH+]c1NCC[C@H]1CCCCO1 ZINC000224139587 323902875 /nfs/dbraw/zinc/90/28/75/323902875.db2.gz BWZXZBJWUKJGMO-LLVKDONJSA-N 1 2 236.315 2.461 20 0 BEADLO COc1ccc2oc(C[NH+]3CC(OC)C3)cc2c1 ZINC000459575801 324148821 /nfs/dbraw/zinc/14/88/21/324148821.db2.gz FHNNWBHSMAEEFN-UHFFFAOYSA-N 1 2 247.294 2.272 20 0 BEADLO CC[C@H](CO)Nc1[nH+]ccc2c(OC)cccc21 ZINC000234030824 324210671 /nfs/dbraw/zinc/21/06/71/324210671.db2.gz QDFUNWGLWSISLX-SNVBAGLBSA-N 1 2 246.310 2.426 20 0 BEADLO C[C@H](CO)[N@H+](C)Cc1c(F)ccc(F)c1Cl ZINC000529566263 324342678 /nfs/dbraw/zinc/34/26/78/324342678.db2.gz DNOSCUXICVYVFV-SSDOTTSWSA-N 1 2 249.688 2.431 20 0 BEADLO C[C@H](CO)[N@@H+](C)Cc1c(F)ccc(F)c1Cl ZINC000529566263 324342681 /nfs/dbraw/zinc/34/26/81/324342681.db2.gz DNOSCUXICVYVFV-SSDOTTSWSA-N 1 2 249.688 2.431 20 0 BEADLO Cc1[nH]c(CN2CCC(F)(F)CC2)[nH+]c1C ZINC000529559355 324343024 /nfs/dbraw/zinc/34/30/24/324343024.db2.gz WGUQYSBHQITUSL-UHFFFAOYSA-N 1 2 229.274 2.258 20 0 BEADLO CCC(C)(C)OC1C[NH+](Cc2cccnc2)C1 ZINC000529639388 324369069 /nfs/dbraw/zinc/36/90/69/324369069.db2.gz CGSZCBATFOJDJQ-UHFFFAOYSA-N 1 2 234.343 2.471 20 0 BEADLO CNc1ccc(-c2ccc3c(c2)CCOC3)c[nH+]1 ZINC000530249399 324558813 /nfs/dbraw/zinc/55/88/13/324558813.db2.gz FMDMNDGWNJQTQY-UHFFFAOYSA-N 1 2 240.306 2.285 20 0 BEADLO O=C(NCc1cccc(-c2[nH]cc[nH+]2)c1)C1CC1 ZINC000538653006 324722158 /nfs/dbraw/zinc/72/21/58/324722158.db2.gz QLJMZBJPMJQQSO-UHFFFAOYSA-N 1 2 241.294 2.103 20 0 BEADLO Cn1c[nH+]cc1CCNC(=O)CC1CCCCC1 ZINC000542481827 325030385 /nfs/dbraw/zinc/03/03/85/325030385.db2.gz GTAASIQOXBBGTA-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO C[C@@H]([NH2+]Cc1ccc2[nH]cnc2c1)c1ccon1 ZINC000542708521 325043144 /nfs/dbraw/zinc/04/31/44/325043144.db2.gz BVJUQGDAZOOJLY-SECBINFHSA-N 1 2 242.282 2.402 20 0 BEADLO C[C@@H]([NH2+]Cc1ccc2nc[nH]c2c1)c1ccon1 ZINC000542708521 325043147 /nfs/dbraw/zinc/04/31/47/325043147.db2.gz BVJUQGDAZOOJLY-SECBINFHSA-N 1 2 242.282 2.402 20 0 BEADLO Cc1nc(N[C@]2(C)CCOC2)c2c([nH+]1)CCCC2 ZINC000542949039 325064952 /nfs/dbraw/zinc/06/49/52/325064952.db2.gz QOKQIEPJEUHCSK-CQSZACIVSA-N 1 2 247.342 2.255 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2ccccc2F)o1 ZINC000543549468 325093215 /nfs/dbraw/zinc/09/32/15/325093215.db2.gz RXJCGTLYSHXODI-QMMMGPOBSA-N 1 2 235.262 2.368 20 0 BEADLO CCC[C@H]1C[N@H+](CCC(F)(F)F)CCO1 ZINC000131415917 325147632 /nfs/dbraw/zinc/14/76/32/325147632.db2.gz ATYPFIUZQSZIDN-VIFPVBQESA-N 1 2 225.254 2.440 20 0 BEADLO CCC[C@H]1C[N@@H+](CCC(F)(F)F)CCO1 ZINC000131415917 325147637 /nfs/dbraw/zinc/14/76/37/325147637.db2.gz ATYPFIUZQSZIDN-VIFPVBQESA-N 1 2 225.254 2.440 20 0 BEADLO CO[C@H](C)COc1ccccc1-n1cc[nH+]c1 ZINC000543911123 325122316 /nfs/dbraw/zinc/12/23/16/325122316.db2.gz ROISDXGEPNGMMB-LLVKDONJSA-N 1 2 232.283 2.286 20 0 BEADLO Cn1c[nH+]cc1Cc1noc(/C=C/C2CCC2)n1 ZINC000545843790 325239813 /nfs/dbraw/zinc/23/98/13/325239813.db2.gz PIAFLCFXYRZSBL-AATRIKPKSA-N 1 2 244.298 2.207 20 0 BEADLO C[C@@]1(O)CCN(c2[nH+]ccc3ccccc32)C1 ZINC000235426994 325264485 /nfs/dbraw/zinc/26/44/85/325264485.db2.gz VZGNPPKSIAXZPL-CQSZACIVSA-N 1 2 228.295 2.196 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1ccncc1F ZINC000133140746 325271063 /nfs/dbraw/zinc/27/10/63/325271063.db2.gz SAOCLEFJSIYTGC-UHFFFAOYSA-N 1 2 231.230 2.176 20 0 BEADLO CC(=O)Nc1ccc2c(c1)[nH+]c(C1CC1)n2C ZINC000074985832 325273662 /nfs/dbraw/zinc/27/36/62/325273662.db2.gz WUGVAEWFVTWVAL-UHFFFAOYSA-N 1 2 229.283 2.409 20 0 BEADLO C[C@]1(O)CCN(c2[nH+]ccc3ccccc32)C1 ZINC000235728191 325284536 /nfs/dbraw/zinc/28/45/36/325284536.db2.gz VZGNPPKSIAXZPL-AWEZNQCLSA-N 1 2 228.295 2.196 20 0 BEADLO COc1ccc[nH+]c1N[C@H](C)CCn1cccn1 ZINC000546716120 325304334 /nfs/dbraw/zinc/30/43/34/325304334.db2.gz IWHSHXQGXPVQQT-LLVKDONJSA-N 1 2 246.314 2.177 20 0 BEADLO Cc1cnc(C[N@H+]2CCOC[C@H]2CC(C)C)o1 ZINC000075743859 325310000 /nfs/dbraw/zinc/31/00/00/325310000.db2.gz WSAGUYJIYVIXCO-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cnc(C[N@@H+]2CCOC[C@H]2CC(C)C)o1 ZINC000075743859 325310001 /nfs/dbraw/zinc/31/00/01/325310001.db2.gz WSAGUYJIYVIXCO-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cnc([C@H](C)[NH2+]C(C)(C)c2cnn(C)c2)o1 ZINC000547412747 325351768 /nfs/dbraw/zinc/35/17/68/325351768.db2.gz DCCLPQLNDPQQFP-JTQLQIEISA-N 1 2 248.330 2.302 20 0 BEADLO O=C(NCCc1[nH]cc[nH+]1)c1ccccc1Cl ZINC000134492119 325361067 /nfs/dbraw/zinc/36/10/67/325361067.db2.gz JXHUULPIIDJFEO-UHFFFAOYSA-N 1 2 249.701 2.036 20 0 BEADLO CCc1nnc([C@@H](C)[N@H+]2[C@H](C)C[C@@H]2C)o1 ZINC000547768463 325394480 /nfs/dbraw/zinc/39/44/80/325394480.db2.gz NPLPVPZDPCUEHH-HRDYMLBCSA-N 1 2 209.293 2.176 20 0 BEADLO CCc1nnc([C@@H](C)[N@@H+]2[C@H](C)C[C@@H]2C)o1 ZINC000547768463 325394482 /nfs/dbraw/zinc/39/44/82/325394482.db2.gz NPLPVPZDPCUEHH-HRDYMLBCSA-N 1 2 209.293 2.176 20 0 BEADLO C[C@H]1C[C@H](C)N1Cc1[nH+]ccn1CC(F)(F)F ZINC000547769991 325394972 /nfs/dbraw/zinc/39/49/72/325394972.db2.gz NVNUCEFIMPYPPC-IUCAKERBSA-N 1 2 247.264 2.428 20 0 BEADLO Cc1[nH+]c2ccccc2n1CC(=O)N(C)C(C)C ZINC000078442045 325418404 /nfs/dbraw/zinc/41/84/04/325418404.db2.gz RFUCLBUUYZQDBR-UHFFFAOYSA-N 1 2 245.326 2.212 20 0 BEADLO CO[C@@]1(C)C[C@@H](N(C)c2cc[nH+]c(C)n2)C1(C)C ZINC000246075620 325540523 /nfs/dbraw/zinc/54/05/23/325540523.db2.gz JOJQOOIWPMBIRE-RISCZKNCSA-N 1 2 249.358 2.425 20 0 BEADLO CC(C)C[C@H](C)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000565213190 325876488 /nfs/dbraw/zinc/87/64/88/325876488.db2.gz LNQRGXAAPYJDMZ-VHSXEESVSA-N 1 2 223.320 2.269 20 0 BEADLO CCCC[C@@H](CC)CNC(=O)Cn1cc[nH+]c1 ZINC000565263308 325889052 /nfs/dbraw/zinc/88/90/52/325889052.db2.gz RFLTUXNBHNCTNH-GFCCVEGCSA-N 1 2 237.347 2.216 20 0 BEADLO CCC1(CC)CN(C(=O)C[C@@H](C)n2cc[nH+]c2)C1 ZINC000565600379 325933412 /nfs/dbraw/zinc/93/34/12/325933412.db2.gz NJEBOXSEKUHQOP-GFCCVEGCSA-N 1 2 249.358 2.483 20 0 BEADLO Cn1ncc2c1nc[nH+]c2N[C@@H]1CCC[C@H](F)C1 ZINC000566161492 326004468 /nfs/dbraw/zinc/00/44/68/326004468.db2.gz ZUYXNYXUZRRBGK-DTWKUNHWSA-N 1 2 249.293 2.056 20 0 BEADLO O=c1[nH]c2ccccc2cc1CNc1c[nH]c[nH+]1 ZINC000572574956 326011152 /nfs/dbraw/zinc/01/11/52/326011152.db2.gz SVUREOHEDNBNRC-UHFFFAOYSA-N 1 2 240.266 2.276 20 0 BEADLO Cc1nc(N(C)C)nc(NC(C)(C)C(C)C)[nH+]1 ZINC000566329617 326033971 /nfs/dbraw/zinc/03/39/71/326033971.db2.gz KLZUYJAQUFFCNT-UHFFFAOYSA-N 1 2 237.351 2.093 20 0 BEADLO Cc1nc(NC(C)(C)C(C)C)nc(N(C)C)[nH+]1 ZINC000566329617 326033974 /nfs/dbraw/zinc/03/39/74/326033974.db2.gz KLZUYJAQUFFCNT-UHFFFAOYSA-N 1 2 237.351 2.093 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@H]1CCC[C@@H](C)C1 ZINC000566432741 326046394 /nfs/dbraw/zinc/04/63/94/326046394.db2.gz IFTSMDJXQQCSJU-UTUOFQBUSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@H]1CCC[C@@H](C)C1 ZINC000566432741 326046397 /nfs/dbraw/zinc/04/63/97/326046397.db2.gz IFTSMDJXQQCSJU-UTUOFQBUSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@H](C)C1CCCC1 ZINC000566465919 326051497 /nfs/dbraw/zinc/05/14/97/326051497.db2.gz MPPGWPUXBUMDGT-QWRGUYRKSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@H](C)C1CCCC1 ZINC000566465919 326051500 /nfs/dbraw/zinc/05/15/00/326051500.db2.gz MPPGWPUXBUMDGT-QWRGUYRKSA-N 1 2 249.358 2.283 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CC[C@](C)(F)C1 ZINC000566483382 326056501 /nfs/dbraw/zinc/05/65/01/326056501.db2.gz SRISWCGEAKISKY-NSHDSACASA-N 1 2 209.268 2.032 20 0 BEADLO C[C@@H](CC(=O)N1CCC(C)(C)CC1)n1cc[nH+]c1 ZINC000566859660 326089379 /nfs/dbraw/zinc/08/93/79/326089379.db2.gz AYDHSOHNZXJOQC-LBPRGKRZSA-N 1 2 249.358 2.483 20 0 BEADLO C[C@@H](NC(=O)C[C@@H]1CC[C@H]2C[C@H]21)c1[nH]cc[nH+]1 ZINC000567123413 326120050 /nfs/dbraw/zinc/12/00/50/326120050.db2.gz HGONURMIFWPFPR-VPOLOUISSA-N 1 2 233.315 2.023 20 0 BEADLO CC[C@H]1CCCN(C(=O)Cc2c[nH+]cn2C)CC1 ZINC000567368762 326176111 /nfs/dbraw/zinc/17/61/11/326176111.db2.gz FTTGZDWAOUXJDN-LBPRGKRZSA-N 1 2 249.358 2.001 20 0 BEADLO COC(=O)[C@](C)([NH2+][C@@H]1C=CCCC1)C1CC1 ZINC000309950049 326176964 /nfs/dbraw/zinc/17/69/64/326176964.db2.gz FSALSZICEODKKP-DGCLKSJQSA-N 1 2 223.316 2.026 20 0 BEADLO Cn1cc[nH+]c1CNc1ccc2c(c1)COC2 ZINC000155576302 326201141 /nfs/dbraw/zinc/20/11/41/326201141.db2.gz DOVFCKDVHGGHDN-UHFFFAOYSA-N 1 2 229.283 2.062 20 0 BEADLO Cn1ccnc1SCc1c[nH+]c2ccccn12 ZINC000155865639 326213772 /nfs/dbraw/zinc/21/37/72/326213772.db2.gz YXPMXCVPLLQTMW-UHFFFAOYSA-N 1 2 244.323 2.360 20 0 BEADLO CCC(CC)CNC(=O)/C=C/c1[nH+]ccn1CC ZINC000156158866 326220472 /nfs/dbraw/zinc/22/04/72/326220472.db2.gz FUZORBMLMORORX-BQYQJAHWSA-N 1 2 249.358 2.469 20 0 BEADLO Cn1c[nH+]cc1CCNC(=O)C1(C)CCCCC1 ZINC000157622973 326287272 /nfs/dbraw/zinc/28/72/72/326287272.db2.gz DLLJUICLDVPBQE-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO CC(C)[C@@H]1CCCN1C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000568014605 326296099 /nfs/dbraw/zinc/29/60/99/326296099.db2.gz GSZNZAYZEQRDIX-STQMWFEESA-N 1 2 249.358 2.481 20 0 BEADLO C[C@H](CC(=O)N1C[C@H](C)CC1(C)C)n1cc[nH+]c1 ZINC000568021439 326297018 /nfs/dbraw/zinc/29/70/18/326297018.db2.gz UHCMTHMSQXNRNG-VXGBXAGGSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1ncc(C[N@@H+]2CCC[C@H](F)C2)s1 ZINC000568053782 326301006 /nfs/dbraw/zinc/30/10/06/326301006.db2.gz GXMWDNSYNTYAHZ-VIFPVBQESA-N 1 2 214.309 2.385 20 0 BEADLO Cc1ncc(C[N@H+]2CCC[C@H](F)C2)s1 ZINC000568053782 326301009 /nfs/dbraw/zinc/30/10/09/326301009.db2.gz GXMWDNSYNTYAHZ-VIFPVBQESA-N 1 2 214.309 2.385 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N[C@H]3CC[C@H]3C)ccn12 ZINC000568212128 326327228 /nfs/dbraw/zinc/32/72/28/326327228.db2.gz UJPPUGUYGKTWGE-SKDRFNHKSA-N 1 2 243.310 2.171 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCc2ncsc2C1 ZINC000568250622 326335109 /nfs/dbraw/zinc/33/51/09/326335109.db2.gz WZWSCBXBAPDRIX-UHFFFAOYSA-N 1 2 246.339 2.113 20 0 BEADLO CC[C@@H]1C[C@@H](C)CN1C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000568519452 326362361 /nfs/dbraw/zinc/36/23/61/326362361.db2.gz GTGFDYRQNVCJCP-FRRDWIJNSA-N 1 2 249.358 2.481 20 0 BEADLO CCCN(C(=O)[C@@H]1CCn2cc[nH+]c2C1)C(C)C ZINC000568764181 326376149 /nfs/dbraw/zinc/37/61/49/326376149.db2.gz VSINLALRYLSYKL-GFCCVEGCSA-N 1 2 249.358 2.093 20 0 BEADLO CCc1ccnc(CNc2nc(C)[nH+]cc2C)c1 ZINC000568768346 326376528 /nfs/dbraw/zinc/37/65/28/326376528.db2.gz PGXLYKJWFBSFDV-UHFFFAOYSA-N 1 2 242.326 2.085 20 0 BEADLO COc1ccc(C[C@H](C)Nc2c[nH]c[nH+]2)cc1 ZINC000569044958 326387640 /nfs/dbraw/zinc/38/76/40/326387640.db2.gz XSBGSPNYAHXUQS-JTQLQIEISA-N 1 2 231.299 2.461 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N(C)C(C)C)ccn12 ZINC000572982324 326422600 /nfs/dbraw/zinc/42/26/00/326422600.db2.gz SAWITRXGVDGSES-UHFFFAOYSA-N 1 2 231.299 2.123 20 0 BEADLO CC(C)C[C@H](C)NC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000573253923 326438248 /nfs/dbraw/zinc/43/82/48/326438248.db2.gz KHDNIKOLCRCISF-RYUDHWBXSA-N 1 2 237.347 2.385 20 0 BEADLO CC(C)C1CN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000677125206 487976429 /nfs/dbraw/zinc/97/64/29/487976429.db2.gz NNKIKGAUHFWHPR-UHFFFAOYSA-N 1 2 217.316 2.446 20 0 BEADLO CC(C)(C)CC[N@@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000682542837 487982157 /nfs/dbraw/zinc/98/21/57/487982157.db2.gz CFNWFZZIZZBBMW-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)(C)CC[N@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000682542837 487982158 /nfs/dbraw/zinc/98/21/58/487982158.db2.gz CFNWFZZIZZBBMW-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)(C)CC[N@@H+]1C[C@H](O)CC(F)(F)C1 ZINC000682542835 487982336 /nfs/dbraw/zinc/98/23/36/487982336.db2.gz CFNWFZZIZZBBMW-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)(C)CC[N@H+]1C[C@H](O)CC(F)(F)C1 ZINC000682542835 487982340 /nfs/dbraw/zinc/98/23/40/487982340.db2.gz CFNWFZZIZZBBMW-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO CCN1CC[N@H+]([C@H](C)c2ccccn2)C[C@H]1C ZINC000677191400 487994240 /nfs/dbraw/zinc/99/42/40/487994240.db2.gz BTUAPMJJHCQLBU-CHWSQXEVSA-N 1 2 233.359 2.169 20 0 BEADLO Oc1cccc2c1CC[C@@H]2[NH2+]CC(F)F ZINC000147288441 487995461 /nfs/dbraw/zinc/99/54/61/487995461.db2.gz XTRJVQATVGLSLU-VIFPVBQESA-N 1 2 213.227 2.234 20 0 BEADLO CCOC(=O)[C@H]1CCC[N@H+](CC(F)(F)CC)C1 ZINC000602755182 487999289 /nfs/dbraw/zinc/99/92/89/487999289.db2.gz APHKUSVHRMOXSQ-JTQLQIEISA-N 1 2 249.301 2.307 20 0 BEADLO CCOC(=O)[C@H]1CCC[N@@H+](CC(F)(F)CC)C1 ZINC000602755182 487999295 /nfs/dbraw/zinc/99/92/95/487999295.db2.gz APHKUSVHRMOXSQ-JTQLQIEISA-N 1 2 249.301 2.307 20 0 BEADLO CCc1cc(N[C@@H](CC)[C@H]2CCCO2)nc[nH+]1 ZINC000677308977 488012862 /nfs/dbraw/zinc/01/28/62/488012862.db2.gz YIHUDPDPAJIECC-NWDGAFQWSA-N 1 2 235.331 2.409 20 0 BEADLO Cc1ccc(F)cc1C[NH2+][C@@H](C)c1ncn(C)n1 ZINC000391876850 488024522 /nfs/dbraw/zinc/02/45/22/488024522.db2.gz QSTUTZOKICNMMF-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO CC(C)(C)c1nc(NC[C@@H]2CC[C@H](O)C2)cc[nH+]1 ZINC000682721541 488026072 /nfs/dbraw/zinc/02/60/72/488026072.db2.gz ZBKGXBQHUPXSLX-MNOVXSKESA-N 1 2 249.358 2.347 20 0 BEADLO Cc1noc([C@@H](C)[N@H+]2CC=C(C)CC2)n1 ZINC000677379734 488026126 /nfs/dbraw/zinc/02/61/26/488026126.db2.gz HHVGHJRNZDMPEZ-SECBINFHSA-N 1 2 207.277 2.091 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+]2CC=C(C)CC2)n1 ZINC000677379734 488026130 /nfs/dbraw/zinc/02/61/30/488026130.db2.gz HHVGHJRNZDMPEZ-SECBINFHSA-N 1 2 207.277 2.091 20 0 BEADLO OC[C@H]1CCC[N@@H+]1Cc1ccc(F)c(F)c1F ZINC000667494620 488027112 /nfs/dbraw/zinc/02/71/12/488027112.db2.gz FJFLLNWLIMUCIM-SECBINFHSA-N 1 2 245.244 2.061 20 0 BEADLO OC[C@H]1CCC[N@H+]1Cc1ccc(F)c(F)c1F ZINC000667494620 488027116 /nfs/dbraw/zinc/02/71/16/488027116.db2.gz FJFLLNWLIMUCIM-SECBINFHSA-N 1 2 245.244 2.061 20 0 BEADLO Cc1cc(C[NH2+]Cc2c(F)cccc2F)ncn1 ZINC000677425164 488033465 /nfs/dbraw/zinc/03/34/65/488033465.db2.gz ZRKSQDLGFRDHKY-UHFFFAOYSA-N 1 2 249.264 2.353 20 0 BEADLO CN(Cc1ccoc1)Cc1c[nH+]c2n1CCC2 ZINC000667544225 488041199 /nfs/dbraw/zinc/04/11/99/488041199.db2.gz AJMODXLIPGPCHZ-UHFFFAOYSA-N 1 2 231.299 2.054 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@H]1CCC[C@@H]1C ZINC000656119830 488052822 /nfs/dbraw/zinc/05/28/22/488052822.db2.gz BGAJSGZYCJGEGU-WPRPVWTQSA-N 1 2 221.304 2.394 20 0 BEADLO COC1CCC(Nc2nc(C)[nH+]cc2C)CC1 ZINC000656200751 488066756 /nfs/dbraw/zinc/06/67/56/488066756.db2.gz VEJKCQNJUFOKHR-UHFFFAOYSA-N 1 2 235.331 2.463 20 0 BEADLO O=C(CCCF)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000667652729 488075389 /nfs/dbraw/zinc/07/53/89/488075389.db2.gz IDKXIQMJCAEWIE-SNVBAGLBSA-N 1 2 239.294 2.213 20 0 BEADLO CCCn1nccc1C[N@@H+]1CCOC2(CCC2)C1 ZINC000667666200 488081103 /nfs/dbraw/zinc/08/11/03/488081103.db2.gz FJCLIVUSTQGBSS-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CCCn1nccc1C[N@H+]1CCOC2(CCC2)C1 ZINC000667666200 488081106 /nfs/dbraw/zinc/08/11/06/488081106.db2.gz FJCLIVUSTQGBSS-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO C[N@H+](Cc1ccc[nH]1)Cc1ccnn1CC1CC1 ZINC000667687353 488086168 /nfs/dbraw/zinc/08/61/68/488086168.db2.gz JZILFYAVTIIUDE-UHFFFAOYSA-N 1 2 244.342 2.253 20 0 BEADLO C[N@@H+](Cc1ccc[nH]1)Cc1ccnn1CC1CC1 ZINC000667687353 488086171 /nfs/dbraw/zinc/08/61/71/488086171.db2.gz JZILFYAVTIIUDE-UHFFFAOYSA-N 1 2 244.342 2.253 20 0 BEADLO CCCn1nccc1C[N@H+](C)Cc1ccc[nH]1 ZINC000667687782 488086556 /nfs/dbraw/zinc/08/65/56/488086556.db2.gz XCHGJKSTQLQDQF-UHFFFAOYSA-N 1 2 232.331 2.253 20 0 BEADLO CCCn1nccc1C[N@@H+](C)Cc1ccc[nH]1 ZINC000667687782 488086562 /nfs/dbraw/zinc/08/65/62/488086562.db2.gz XCHGJKSTQLQDQF-UHFFFAOYSA-N 1 2 232.331 2.253 20 0 BEADLO C(c1noc(C2CC2)n1)[N@@H+]1[C@H]2CC[C@@H]1CCC2 ZINC000335291799 488088499 /nfs/dbraw/zinc/08/84/99/488088499.db2.gz ZDYDOSWBDUQPKH-PHIMTYICSA-N 1 2 233.315 2.464 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1ncccn1 ZINC000683006510 488088503 /nfs/dbraw/zinc/08/85/03/488088503.db2.gz OCAADQZBJMFFFF-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1ncccn1 ZINC000683006510 488088504 /nfs/dbraw/zinc/08/85/04/488088504.db2.gz OCAADQZBJMFFFF-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO C(c1noc(C2CC2)n1)[N@H+]1[C@H]2CC[C@@H]1CCC2 ZINC000335291799 488088502 /nfs/dbraw/zinc/08/85/02/488088502.db2.gz ZDYDOSWBDUQPKH-PHIMTYICSA-N 1 2 233.315 2.464 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCO[C@@H](C3CC3)C2)c1 ZINC000683022982 488097875 /nfs/dbraw/zinc/09/78/75/488097875.db2.gz GIVZWKWTRUIRTK-CQSZACIVSA-N 1 2 232.327 2.001 20 0 BEADLO Cc1ccnc(C[N@H+]2CCO[C@@H](C3CC3)C2)c1 ZINC000683022982 488097880 /nfs/dbraw/zinc/09/78/80/488097880.db2.gz GIVZWKWTRUIRTK-CQSZACIVSA-N 1 2 232.327 2.001 20 0 BEADLO COCC1([N@H+](C)Cc2ncc(C3CC3)o2)CC1 ZINC000677727489 488104528 /nfs/dbraw/zinc/10/45/28/488104528.db2.gz AFVVZSJZNPURBX-UHFFFAOYSA-N 1 2 236.315 2.163 20 0 BEADLO COCC1([N@@H+](C)Cc2ncc(C3CC3)o2)CC1 ZINC000677727489 488104530 /nfs/dbraw/zinc/10/45/30/488104530.db2.gz AFVVZSJZNPURBX-UHFFFAOYSA-N 1 2 236.315 2.163 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+]2CC[C@H](C(F)F)C2)n1 ZINC000677729872 488106971 /nfs/dbraw/zinc/10/69/71/488106971.db2.gz DPTFOANNYXHVIB-SVRRBLITSA-N 1 2 231.246 2.026 20 0 BEADLO Cc1noc([C@@H](C)[N@H+]2CC[C@H](C(F)F)C2)n1 ZINC000677729872 488106974 /nfs/dbraw/zinc/10/69/74/488106974.db2.gz DPTFOANNYXHVIB-SVRRBLITSA-N 1 2 231.246 2.026 20 0 BEADLO CC[C@H](C(N)=O)[N@@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000451833121 488114221 /nfs/dbraw/zinc/11/42/21/488114221.db2.gz HOLODVWGYFBJTP-ZYHUDNBSSA-N 1 2 248.326 2.071 20 0 BEADLO CC[C@H](C(N)=O)[N@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000451833121 488114224 /nfs/dbraw/zinc/11/42/24/488114224.db2.gz HOLODVWGYFBJTP-ZYHUDNBSSA-N 1 2 248.326 2.071 20 0 BEADLO FC(F)[C@@H]1CCC[N@@H+]1C[C@H]1CCCCO1 ZINC000677737513 488116176 /nfs/dbraw/zinc/11/61/76/488116176.db2.gz HBEJQOOHXBMYQC-ZJUUUORDSA-N 1 2 219.275 2.285 20 0 BEADLO FC(F)[C@@H]1CCC[N@H+]1C[C@H]1CCCCO1 ZINC000677737513 488116180 /nfs/dbraw/zinc/11/61/80/488116180.db2.gz HBEJQOOHXBMYQC-ZJUUUORDSA-N 1 2 219.275 2.285 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccn(C(C)C)n2)on1 ZINC000085161395 488133678 /nfs/dbraw/zinc/13/36/78/488133678.db2.gz JPPZQUUXNDRNBZ-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO CCn1nccc1C[NH2+][C@H](C)c1nccs1 ZINC000119128815 487530451 /nfs/dbraw/zinc/53/04/51/487530451.db2.gz MWPTZJQLWZYOAT-SECBINFHSA-N 1 2 236.344 2.210 20 0 BEADLO Nc1nc(N2CC[C@@H]3C[C@@H]3C2)[nH+]c2ccccc12 ZINC000664523854 487554018 /nfs/dbraw/zinc/55/40/18/487554018.db2.gz JVNLBJSTGCDJEW-NXEZZACHSA-N 1 2 240.310 2.058 20 0 BEADLO Cc1ccc(C(=O)Nc2cc(N(C)C)cc[nH+]2)o1 ZINC000680260018 487554674 /nfs/dbraw/zinc/55/46/74/487554674.db2.gz OCGCPVPEQXBBKD-UHFFFAOYSA-N 1 2 245.282 2.301 20 0 BEADLO Cc1cc(N2CCC([C@@H]3CCOC3)CC2)nc[nH+]1 ZINC000680066235 487530761 /nfs/dbraw/zinc/53/07/61/487530761.db2.gz NJZIXPVCCRTJDT-CYBMUJFWSA-N 1 2 247.342 2.038 20 0 BEADLO C[C@@H](C(=O)Nc1ccc2[nH+]ccn2c1)C1CC1 ZINC000673899969 487472199 /nfs/dbraw/zinc/47/21/99/487472199.db2.gz RSKVJGCQSWKNJY-SECBINFHSA-N 1 2 229.283 2.319 20 0 BEADLO C[C@@H](C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1)C1CC1 ZINC000673906244 487474505 /nfs/dbraw/zinc/47/45/05/487474505.db2.gz MXDYREGQAIYNBZ-DGCLKSJQSA-N 1 2 247.342 2.093 20 0 BEADLO C[C@@H]1[C@H](O)CC[N@@H+]1Cc1ccc(F)c(F)c1F ZINC000668225804 487483781 /nfs/dbraw/zinc/48/37/81/487483781.db2.gz WWRXJARUTJJILQ-GMSGAONNSA-N 1 2 245.244 2.059 20 0 BEADLO C[C@@H]1[C@H](O)CC[N@H+]1Cc1ccc(F)c(F)c1F ZINC000668225804 487483787 /nfs/dbraw/zinc/48/37/87/487483787.db2.gz WWRXJARUTJJILQ-GMSGAONNSA-N 1 2 245.244 2.059 20 0 BEADLO C[C@H]1CCCC[C@H]1CC(=O)NCc1c[nH+]c[nH]1 ZINC000673934852 487483901 /nfs/dbraw/zinc/48/39/01/487483901.db2.gz JGOIPAPTSOEOMH-QWRGUYRKSA-N 1 2 235.331 2.242 20 0 BEADLO C[C@H]1CCCC[C@H]1CC(=O)NCc1c[nH]c[nH+]1 ZINC000673934852 487483905 /nfs/dbraw/zinc/48/39/05/487483905.db2.gz JGOIPAPTSOEOMH-QWRGUYRKSA-N 1 2 235.331 2.242 20 0 BEADLO Cc1cn2c([nH+]1)CN(C(=O)C1=C(C)CCC1)CC2 ZINC000679908648 487484199 /nfs/dbraw/zinc/48/41/99/487484199.db2.gz PWZXAWKJXINXIZ-UHFFFAOYSA-N 1 2 245.326 2.034 20 0 BEADLO CCc1noc(C[N@@H+]2CCCc3occc3C2)n1 ZINC000685058510 487498398 /nfs/dbraw/zinc/49/83/98/487498398.db2.gz NMTBPHAUDVDHRG-UHFFFAOYSA-N 1 2 247.298 2.173 20 0 BEADLO CCc1noc(C[N@H+]2CCCc3occc3C2)n1 ZINC000685058510 487498405 /nfs/dbraw/zinc/49/84/05/487498405.db2.gz NMTBPHAUDVDHRG-UHFFFAOYSA-N 1 2 247.298 2.173 20 0 BEADLO Cc1noc([C@@H](C)[NH2+][C@@H](C)c2ccncc2)n1 ZINC000679934419 487498407 /nfs/dbraw/zinc/49/84/07/487498407.db2.gz PRSFJRBHQVCZJJ-DTWKUNHWSA-N 1 2 232.287 2.185 20 0 BEADLO Cc1noc([C@@H](C)[NH2+][C@H](C)c2ccncc2)n1 ZINC000679934421 487498536 /nfs/dbraw/zinc/49/85/36/487498536.db2.gz PRSFJRBHQVCZJJ-RKDXNWHRSA-N 1 2 232.287 2.185 20 0 BEADLO OC[C@@]1([NH2+]CC(F)F)CCCc2ccccc21 ZINC000685041652 487495654 /nfs/dbraw/zinc/49/56/54/487495654.db2.gz BBRIEQBQMRAAML-ZDUSSCGKSA-N 1 2 241.281 2.065 20 0 BEADLO C[C@@H](O)C[C@@H](C)Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000679934143 487496608 /nfs/dbraw/zinc/49/66/08/487496608.db2.gz YXFXIUYEEYQXQD-NXEZZACHSA-N 1 2 237.347 2.345 20 0 BEADLO CCc1cc(N[C@H](C)C[C@@H]2CCOC2)nc[nH+]1 ZINC000675291708 487503637 /nfs/dbraw/zinc/50/36/37/487503637.db2.gz XLBIIXFFXAUVRJ-MNOVXSKESA-N 1 2 235.331 2.266 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2ncn(C)n2)cs1 ZINC000391925848 487505658 /nfs/dbraw/zinc/50/56/58/487505658.db2.gz DSXRXGSYIIWWQT-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO CCc1ccc(CN2CCn3cc(C)[nH+]c3C2)o1 ZINC000680000380 487513697 /nfs/dbraw/zinc/51/36/97/487513697.db2.gz INBSNLBEURDDQI-UHFFFAOYSA-N 1 2 245.326 2.363 20 0 BEADLO Cc1cc(NC[C@H](C)c2ccncc2)nc[nH+]1 ZINC000674067049 487508967 /nfs/dbraw/zinc/50/89/67/487508967.db2.gz YSFYOWLSBZRIJM-JTQLQIEISA-N 1 2 228.299 2.396 20 0 BEADLO CCC1(NC(=O)CCc2c[nH+]c[nH]2)CCCC1 ZINC000295793432 487514605 /nfs/dbraw/zinc/51/46/05/487514605.db2.gz AQPAVOZFHUMBAA-UHFFFAOYSA-N 1 2 235.331 2.181 20 0 BEADLO CCC1(NC(=O)CCc2c[nH]c[nH+]2)CCCC1 ZINC000295793432 487514612 /nfs/dbraw/zinc/51/46/12/487514612.db2.gz AQPAVOZFHUMBAA-UHFFFAOYSA-N 1 2 235.331 2.181 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)NCc2c[nH+]cn2C)C[C@H]1C ZINC000295935852 487515623 /nfs/dbraw/zinc/51/56/23/487515623.db2.gz GHUFXKBZPXGKNS-UTUOFQBUSA-N 1 2 249.358 2.109 20 0 BEADLO CC(C)CCO[C@@H]1CC[N@H+](Cc2ncc[nH]2)C1 ZINC000177389454 487516852 /nfs/dbraw/zinc/51/68/52/487516852.db2.gz OWJPJNKAHFYFPN-GFCCVEGCSA-N 1 2 237.347 2.047 20 0 BEADLO CC(C)CCO[C@@H]1CC[N@@H+](Cc2ncc[nH]2)C1 ZINC000177389454 487516858 /nfs/dbraw/zinc/51/68/58/487516858.db2.gz OWJPJNKAHFYFPN-GFCCVEGCSA-N 1 2 237.347 2.047 20 0 BEADLO CC(C)(C)n1cc(N[C@H]2CCn3cc[nH+]c32)cn1 ZINC000334542821 487521811 /nfs/dbraw/zinc/52/18/11/487521811.db2.gz AWIRYDOXTLXTFE-NSHDSACASA-N 1 2 245.330 2.392 20 0 BEADLO Cc1cc(CNc2c[nH+]cc(C)c2)on1 ZINC000379943537 488162142 /nfs/dbraw/zinc/16/21/42/488162142.db2.gz CMFRSPZMNPHQAD-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)N1CC=CCC1 ZINC000685651673 487570664 /nfs/dbraw/zinc/57/06/64/487570664.db2.gz VWEBQVNPHDNIOV-UHFFFAOYSA-N 1 2 242.282 2.128 20 0 BEADLO c1cnn(-c2cccc(CNc3c[nH]c[nH+]3)c2)c1 ZINC000685845683 487586126 /nfs/dbraw/zinc/58/61/26/487586126.db2.gz OXEXLMGFFKXTJE-UHFFFAOYSA-N 1 2 239.282 2.208 20 0 BEADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cncnc2)on1 ZINC000535787448 487605767 /nfs/dbraw/zinc/60/57/67/487605767.db2.gz WCJWNKYNKQFUQY-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cncnc2)on1 ZINC000535787448 487605769 /nfs/dbraw/zinc/60/57/69/487605769.db2.gz WCJWNKYNKQFUQY-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO Oc1cc(F)cc(C[NH+]2CC3(CC3)C2)c1 ZINC000335382691 487621501 /nfs/dbraw/zinc/62/15/01/487621501.db2.gz ARSGLVDJNAAUTO-UHFFFAOYSA-N 1 2 207.248 2.127 20 0 BEADLO Cc1cc(C(=O)N[C@@H](C)Cn2cc[nH+]c2)cs1 ZINC000671656840 487674748 /nfs/dbraw/zinc/67/47/48/487674748.db2.gz LOSMUMCMFDFVPP-VIFPVBQESA-N 1 2 249.339 2.072 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@H]1CC12CCC2 ZINC000675320492 487702677 /nfs/dbraw/zinc/70/26/77/487702677.db2.gz LENHXPLHSURQMD-SECBINFHSA-N 1 2 232.283 2.219 20 0 BEADLO COC(C)(C)CN(C)c1nc(C)[nH+]c(C)c1C ZINC000675550130 487747142 /nfs/dbraw/zinc/74/71/42/487747142.db2.gz WZMMWYUOWSPXBV-UHFFFAOYSA-N 1 2 237.347 2.263 20 0 BEADLO c1[nH]cc(N[C@H]2Cc3[nH]c4ccccc4c3C2)[nH+]1 ZINC000555104925 487770123 /nfs/dbraw/zinc/77/01/23/487770123.db2.gz WFSREGHFHFOQMP-SECBINFHSA-N 1 2 238.294 2.470 20 0 BEADLO Cc1cc(N(C)CCOC(C)(C)C)nc[nH+]1 ZINC000676030807 487801144 /nfs/dbraw/zinc/80/11/44/487801144.db2.gz SNLDXBUNSACIRZ-UHFFFAOYSA-N 1 2 223.320 2.036 20 0 BEADLO CCc1cc(N[C@@H]2CCC[C@H]3OCC[C@H]32)nc[nH+]1 ZINC000675449126 487870662 /nfs/dbraw/zinc/87/06/62/487870662.db2.gz PYASTYBZJJZZRX-YNEHKIRRSA-N 1 2 247.342 2.409 20 0 BEADLO Fc1c[nH+]ccc1NCc1n[nH]c2ccccc12 ZINC000683070999 488105236 /nfs/dbraw/zinc/10/52/36/488105236.db2.gz QSEHNTHAESGCOU-UHFFFAOYSA-N 1 2 242.257 2.131 20 0 BEADLO CC1(CC(=O)N2CCC[C@H](n3cc[nH+]c3)C2)CC1 ZINC000683240258 488136468 /nfs/dbraw/zinc/13/64/68/488136468.db2.gz BWAHVFSSPRMZCT-LBPRGKRZSA-N 1 2 247.342 2.237 20 0 BEADLO CN(CCc1cccs1)c1cc(CO)cc[nH+]1 ZINC000093269587 488148935 /nfs/dbraw/zinc/14/89/35/488148935.db2.gz PMINPNUPUGDDNE-UHFFFAOYSA-N 1 2 248.351 2.314 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H]2CCOC[C@@H]2C)[nH+]1 ZINC000683354414 488152650 /nfs/dbraw/zinc/15/26/50/488152650.db2.gz ZUHOWFDJJYYYTP-GZMMTYOYSA-N 1 2 246.314 2.103 20 0 BEADLO CCn1cc(C[NH2+][C@@H](C)c2ccccc2F)nn1 ZINC000404484659 488163489 /nfs/dbraw/zinc/16/34/89/488163489.db2.gz AAHCOUBGFWMVJE-JTQLQIEISA-N 1 2 248.305 2.288 20 0 BEADLO CCn1cc(C[NH2+][C@H](C)c2cccc(F)c2)nn1 ZINC000404515671 488167045 /nfs/dbraw/zinc/16/70/45/488167045.db2.gz VIYBHLXLWWWWOF-SNVBAGLBSA-N 1 2 248.305 2.288 20 0 BEADLO CC(C)(C)c1nc(NCc2cccnn2)cc[nH+]1 ZINC000683461256 488167744 /nfs/dbraw/zinc/16/77/44/488167744.db2.gz VSTDCWLESMIIHA-UHFFFAOYSA-N 1 2 243.314 2.176 20 0 BEADLO Cc1cc(NC(=O)c2c(C)cncc2C)cc[nH+]1 ZINC000678024716 488174974 /nfs/dbraw/zinc/17/49/74/488174974.db2.gz BCYIYISUFYEMKW-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)Cc1occc1C ZINC000668745109 488203715 /nfs/dbraw/zinc/20/37/15/488203715.db2.gz BTHXYTYNRRHLJF-UHFFFAOYSA-N 1 2 244.294 2.149 20 0 BEADLO Cc1ccc(F)cc1CN(C)Cc1[nH]cc[nH+]1 ZINC000683671493 488206092 /nfs/dbraw/zinc/20/60/92/488206092.db2.gz CEOOWOWDFZOYRA-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1ccc(F)cc1C[N@H+](C)Cc1ncc[nH]1 ZINC000683671493 488206093 /nfs/dbraw/zinc/20/60/93/488206093.db2.gz CEOOWOWDFZOYRA-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+](C)Cc1ncc[nH]1 ZINC000683671493 488206096 /nfs/dbraw/zinc/20/60/96/488206096.db2.gz CEOOWOWDFZOYRA-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO C=Cn1cc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)cn1 ZINC000683708261 488211385 /nfs/dbraw/zinc/21/13/85/488211385.db2.gz BMEIBERLJPQNFC-JQWIXIFHSA-N 1 2 223.295 2.164 20 0 BEADLO C=Cn1cc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)cn1 ZINC000683708261 488211389 /nfs/dbraw/zinc/21/13/89/488211389.db2.gz BMEIBERLJPQNFC-JQWIXIFHSA-N 1 2 223.295 2.164 20 0 BEADLO CC[C@@H]1CC[N@@H+]1Cc1cc(C(F)(F)F)nn1C ZINC000668189886 488218921 /nfs/dbraw/zinc/21/89/21/488218921.db2.gz SDGFWOYWRUHTQJ-MRVPVSSYSA-N 1 2 247.264 2.423 20 0 BEADLO CC[C@@H]1CC[N@H+]1Cc1cc(C(F)(F)F)nn1C ZINC000668189886 488218923 /nfs/dbraw/zinc/21/89/23/488218923.db2.gz SDGFWOYWRUHTQJ-MRVPVSSYSA-N 1 2 247.264 2.423 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1ccn(C)n1 ZINC000678233037 488221506 /nfs/dbraw/zinc/22/15/06/488221506.db2.gz AIINVXGRTCBFAO-UHFFFAOYSA-N 1 2 219.288 2.035 20 0 BEADLO C[N@@H+](Cc1cn[nH]c1)Cc1ccc(Cl)o1 ZINC000678266780 488230104 /nfs/dbraw/zinc/23/01/04/488230104.db2.gz KQNVTURBHDQGRS-UHFFFAOYSA-N 1 2 225.679 2.288 20 0 BEADLO C[N@H+](Cc1cn[nH]c1)Cc1ccc(Cl)o1 ZINC000678266780 488230105 /nfs/dbraw/zinc/23/01/05/488230105.db2.gz KQNVTURBHDQGRS-UHFFFAOYSA-N 1 2 225.679 2.288 20 0 BEADLO Fc1cccc2c1C[N@H+](Cc1cn[nH]c1)CC2 ZINC000678268635 488231399 /nfs/dbraw/zinc/23/13/99/488231399.db2.gz OLZZUELVAKVVNT-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO Fc1cccc2c1C[N@@H+](Cc1cn[nH]c1)CC2 ZINC000678268635 488231400 /nfs/dbraw/zinc/23/14/00/488231400.db2.gz OLZZUELVAKVVNT-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO C[C@@H]1OCC[N@H+](Cc2[nH]nc3ccccc32)[C@H]1C ZINC000678267368 488231485 /nfs/dbraw/zinc/23/14/85/488231485.db2.gz PQBAHEAGJSFAIH-QWRGUYRKSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1OCC[N@@H+](Cc2[nH]nc3ccccc32)[C@H]1C ZINC000678267368 488231486 /nfs/dbraw/zinc/23/14/86/488231486.db2.gz PQBAHEAGJSFAIH-QWRGUYRKSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1OCC[N@H+](Cc2n[nH]c3ccccc32)[C@H]1C ZINC000678267368 488231488 /nfs/dbraw/zinc/23/14/88/488231488.db2.gz PQBAHEAGJSFAIH-QWRGUYRKSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1OCC[N@@H+](Cc2n[nH]c3ccccc32)[C@H]1C ZINC000678267368 488231490 /nfs/dbraw/zinc/23/14/90/488231490.db2.gz PQBAHEAGJSFAIH-QWRGUYRKSA-N 1 2 245.326 2.172 20 0 BEADLO Cc1ccsc1C[N@@H+]1CCc2c[nH]nc2C1 ZINC000678273478 488233740 /nfs/dbraw/zinc/23/37/40/488233740.db2.gz PPTATBFOAFHSDQ-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1ccsc1C[N@H+]1CCc2c[nH]nc2C1 ZINC000678273478 488233743 /nfs/dbraw/zinc/23/37/43/488233743.db2.gz PPTATBFOAFHSDQ-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1ccsc1C[N@@H+]1CCc2cn[nH]c2C1 ZINC000678273478 488233747 /nfs/dbraw/zinc/23/37/47/488233747.db2.gz PPTATBFOAFHSDQ-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1ccsc1C[N@H+]1CCc2cn[nH]c2C1 ZINC000678273478 488233749 /nfs/dbraw/zinc/23/37/49/488233749.db2.gz PPTATBFOAFHSDQ-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1ccc(C[N@@H+]2CCc3c[nH]nc3C2)cc1F ZINC000678276088 488235224 /nfs/dbraw/zinc/23/52/24/488235224.db2.gz VOOBJPCREKAUQI-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1ccc(C[N@H+]2CCc3c[nH]nc3C2)cc1F ZINC000678276088 488235225 /nfs/dbraw/zinc/23/52/25/488235225.db2.gz VOOBJPCREKAUQI-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2cn(C)cn2)cc1 ZINC000683897066 488238868 /nfs/dbraw/zinc/23/88/68/488238868.db2.gz LCEFWFCCYYZLAK-UHFFFAOYSA-N 1 2 245.326 2.061 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2cn(C)cn2)cc1 ZINC000683897066 488238870 /nfs/dbraw/zinc/23/88/70/488238870.db2.gz LCEFWFCCYYZLAK-UHFFFAOYSA-N 1 2 245.326 2.061 20 0 BEADLO CCC(C)(CC)C(=O)N[C@H]1CCc2c[nH+]cn2C1 ZINC000672149711 488240873 /nfs/dbraw/zinc/24/08/73/488240873.db2.gz VTCGYEWTOALORZ-NSHDSACASA-N 1 2 249.358 2.140 20 0 BEADLO C[C@@H](O)CCCNc1cc[nH+]c(C(C)(C)C)n1 ZINC000683937896 488248279 /nfs/dbraw/zinc/24/82/79/488248279.db2.gz RZPKOFHPXMMAKV-SNVBAGLBSA-N 1 2 237.347 2.347 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N1CCC2(CCC2)CC1 ZINC000672255877 488248485 /nfs/dbraw/zinc/24/84/85/488248485.db2.gz UYXWHROWFHEVRO-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO CN(CCO)c1ccc(NC2CC(C)(C)C2)[nH+]c1 ZINC000683941550 488249179 /nfs/dbraw/zinc/24/91/79/488249179.db2.gz ORNUNKPEEXOAPL-UHFFFAOYSA-N 1 2 249.358 2.111 20 0 BEADLO Cc1nc(N2CCC3(CC3)C2)c(C)c(C)[nH+]1 ZINC000672275603 488249890 /nfs/dbraw/zinc/24/98/90/488249890.db2.gz ZSKSOWIMZHTINZ-UHFFFAOYSA-N 1 2 217.316 2.392 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1C(=O)CCCn1cc[nH+]c1 ZINC000678485446 488260784 /nfs/dbraw/zinc/26/07/84/488260784.db2.gz DYUQPUWRBVQKFJ-OLZOCXBDSA-N 1 2 249.358 2.453 20 0 BEADLO Fc1c[nH+]ccc1N1CCC[C@@H](c2cc[nH]n2)C1 ZINC000678789170 488283113 /nfs/dbraw/zinc/28/31/13/488283113.db2.gz SNDFUOIMLHEWJP-SNVBAGLBSA-N 1 2 246.289 2.328 20 0 BEADLO Cc1cc(NCC2([C@@H](C)CCO)CCC2)nc[nH+]1 ZINC000678829947 488289152 /nfs/dbraw/zinc/28/91/52/488289152.db2.gz MOAJVQHVBBZKOF-NSHDSACASA-N 1 2 249.358 2.386 20 0 BEADLO Cn1cnc(C[NH2+][C@H]2CSc3ccccc32)c1 ZINC000673602202 488296765 /nfs/dbraw/zinc/29/67/65/488296765.db2.gz SNJPIGMJCLIJTJ-LBPRGKRZSA-N 1 2 245.351 2.357 20 0 BEADLO CC[C@H](NC(=O)Cn1cc[nH+]c1)C1CCCCC1 ZINC000673653883 488300876 /nfs/dbraw/zinc/30/08/76/488300876.db2.gz FSEFLZUSQHHLQW-ZDUSSCGKSA-N 1 2 249.358 2.358 20 0 BEADLO CC[C@H](Nc1ccc(N(C)CCO)c[nH+]1)C1CC1 ZINC000679069058 488305720 /nfs/dbraw/zinc/30/57/20/488305720.db2.gz AYPVKWYPOGMYOU-ZDUSSCGKSA-N 1 2 249.358 2.111 20 0 BEADLO CC(C)C1C[NH+](Cc2c(Cl)cnn2C)C1 ZINC000684409221 488308196 /nfs/dbraw/zinc/30/81/96/488308196.db2.gz ROZHZUDXMHQRQN-UHFFFAOYSA-N 1 2 227.739 2.161 20 0 BEADLO CCc1cc(NCc2cccc3[nH+]ccn32)no1 ZINC000679122037 488310881 /nfs/dbraw/zinc/31/08/81/488310881.db2.gz JQTZQARHMQGOPW-UHFFFAOYSA-N 1 2 242.282 2.497 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)oc1C ZINC000679221429 488319987 /nfs/dbraw/zinc/31/99/87/488319987.db2.gz KUNUOYZQWMDKTQ-KCJUWKMLSA-N 1 2 226.295 2.471 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)oc1C ZINC000679221429 488319989 /nfs/dbraw/zinc/31/99/89/488319989.db2.gz KUNUOYZQWMDKTQ-KCJUWKMLSA-N 1 2 226.295 2.471 20 0 BEADLO COc1cc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)ccn1 ZINC000679223572 488320426 /nfs/dbraw/zinc/32/04/26/488320426.db2.gz QSCXSNBICZDTFQ-JQWIXIFHSA-N 1 2 238.306 2.270 20 0 BEADLO COc1cc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)ccn1 ZINC000679223572 488320428 /nfs/dbraw/zinc/32/04/28/488320428.db2.gz QSCXSNBICZDTFQ-JQWIXIFHSA-N 1 2 238.306 2.270 20 0 BEADLO CCc1cc(N[C@H](CO)CC2CCC2)nc[nH+]1 ZINC000684598671 488330475 /nfs/dbraw/zinc/33/04/75/488330475.db2.gz ANTBQOBGEFODES-LBPRGKRZSA-N 1 2 235.331 2.002 20 0 BEADLO CCCn1cc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)cn1 ZINC000679361670 488346677 /nfs/dbraw/zinc/34/66/77/488346677.db2.gz UNTJBHALMMJYOQ-AAEUAGOBSA-N 1 2 239.338 2.473 20 0 BEADLO CCCn1cc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)cn1 ZINC000679361670 488346679 /nfs/dbraw/zinc/34/66/79/488346679.db2.gz UNTJBHALMMJYOQ-AAEUAGOBSA-N 1 2 239.338 2.473 20 0 BEADLO CC(C)(C(=O)NCCC1CCCC1)c1c[nH]c[nH+]1 ZINC000684830435 488347331 /nfs/dbraw/zinc/34/73/31/488347331.db2.gz HNHABTRACDLCFT-UHFFFAOYSA-N 1 2 249.358 2.384 20 0 BEADLO Cn1c[nH+]c(CN2CCc3ccc(F)cc3C2)c1 ZINC000684835855 488347939 /nfs/dbraw/zinc/34/79/39/488347939.db2.gz KJEKRSXSNXSQGN-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1cnc(C[N@@H+]2CCc3ccc(F)cc3C2)c1 ZINC000684835855 488347941 /nfs/dbraw/zinc/34/79/41/488347941.db2.gz KJEKRSXSNXSQGN-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1cnc(C[N@H+]2CCc3ccc(F)cc3C2)c1 ZINC000684835855 488347943 /nfs/dbraw/zinc/34/79/43/488347943.db2.gz KJEKRSXSNXSQGN-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cc1cnc(CNc2cc3cc[nH]c3c[nH+]2)o1 ZINC000684839868 488348155 /nfs/dbraw/zinc/34/81/55/488348155.db2.gz YVOGSIXLTLVCNG-UHFFFAOYSA-N 1 2 228.255 2.471 20 0 BEADLO C[N@H+](Cc1nccs1)Cc1ccc(O)cc1 ZINC000679391874 488349703 /nfs/dbraw/zinc/34/97/03/488349703.db2.gz BDLBAASVABMUIT-UHFFFAOYSA-N 1 2 234.324 2.481 20 0 BEADLO C[N@@H+](Cc1nccs1)Cc1ccc(O)cc1 ZINC000679391874 488349706 /nfs/dbraw/zinc/34/97/06/488349706.db2.gz BDLBAASVABMUIT-UHFFFAOYSA-N 1 2 234.324 2.481 20 0 BEADLO c1nc(C[N@H+]2CC=CCC2)oc1C1CC1 ZINC000679321947 490111457 /nfs/dbraw/zinc/11/14/57/490111457.db2.gz PLEWJKHIVYHDPL-UHFFFAOYSA-N 1 2 204.273 2.314 20 0 BEADLO c1nc(C[N@@H+]2CC=CCC2)oc1C1CC1 ZINC000679321947 490111461 /nfs/dbraw/zinc/11/14/61/490111461.db2.gz PLEWJKHIVYHDPL-UHFFFAOYSA-N 1 2 204.273 2.314 20 0 BEADLO CCc1cc(N[C@H]2CCC[C@H](CO)C2)nc[nH+]1 ZINC000384089123 490179461 /nfs/dbraw/zinc/17/94/61/490179461.db2.gz YOROYXVTHOEJNF-JQWIXIFHSA-N 1 2 235.331 2.002 20 0 BEADLO CC[C@H](C)CNc1cccc(CC(=O)OC)[nH+]1 ZINC000191653106 490181000 /nfs/dbraw/zinc/18/10/00/490181000.db2.gz KRPMQJKZHPWGHJ-JTQLQIEISA-N 1 2 236.315 2.255 20 0 BEADLO c1c(CCNc2cccc[nH+]2)nc2n1CCS2 ZINC000274284649 490288002 /nfs/dbraw/zinc/28/80/02/490288002.db2.gz XAMOWRQKQGTQQF-UHFFFAOYSA-N 1 2 246.339 2.038 20 0 BEADLO Cc1cccc2[nH+]c(CNC(=O)CCCF)cn21 ZINC000668528669 490353151 /nfs/dbraw/zinc/35/31/51/490353151.db2.gz VBZNQTAXYYLKBN-UHFFFAOYSA-N 1 2 249.289 2.009 20 0 BEADLO Cn1ccnc1[C@@H](Nc1cccc[nH+]1)C1CC1 ZINC000128132622 490572729 /nfs/dbraw/zinc/57/27/29/490572729.db2.gz QQBPIVNKNPSBCV-LBPRGKRZSA-N 1 2 228.299 2.378 20 0 BEADLO Cc1ccc(NC(=O)N(C)Cc2[nH]cc[nH+]2)cc1 ZINC000080526832 490641862 /nfs/dbraw/zinc/64/18/62/490641862.db2.gz WCXCNSGTMHYHCJ-UHFFFAOYSA-N 1 2 244.298 2.382 20 0 BEADLO Cc1nc(N2CC[C@@H]3C[C@@H]3C2)c(C)c(C)[nH+]1 ZINC000664521628 490669344 /nfs/dbraw/zinc/66/93/44/490669344.db2.gz BVCSRLFGMAZYBS-VXGBXAGGSA-N 1 2 217.316 2.248 20 0 BEADLO C[N@H+](Cc1cn[nH]c1)Cc1cc(F)ccc1F ZINC000085825484 491053600 /nfs/dbraw/zinc/05/36/00/491053600.db2.gz FVTQWNBPBQRBEE-UHFFFAOYSA-N 1 2 237.253 2.320 20 0 BEADLO C[N@@H+](Cc1cn[nH]c1)Cc1cc(F)ccc1F ZINC000085825484 491053602 /nfs/dbraw/zinc/05/36/02/491053602.db2.gz FVTQWNBPBQRBEE-UHFFFAOYSA-N 1 2 237.253 2.320 20 0 BEADLO C[C@@H]([NH2+]CC(F)F)c1ccc2c(c1)OCCO2 ZINC000136570956 491061167 /nfs/dbraw/zinc/06/11/67/491061167.db2.gz RUZBYIYRQSIMII-MRVPVSSYSA-N 1 2 243.253 2.374 20 0 BEADLO CCn1cc(NCc2cn3ccccc3[nH+]2)cn1 ZINC000088627116 491075874 /nfs/dbraw/zinc/07/58/74/491075874.db2.gz UIEFKWUWPQTHAE-UHFFFAOYSA-N 1 2 241.298 2.163 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2cscn2)nc(C)n1 ZINC000671303043 491083268 /nfs/dbraw/zinc/08/32/68/491083268.db2.gz NSTYBEBQQCJQCO-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO CCc1cc(N[C@@H]2CCOC(C)(C)C2)nc[nH+]1 ZINC000228087946 491089782 /nfs/dbraw/zinc/08/97/82/491089782.db2.gz KVTKBSQKSCFNSN-LLVKDONJSA-N 1 2 235.331 2.409 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H](C)OC(C)(C)C2)cs1 ZINC000076722680 491125503 /nfs/dbraw/zinc/12/55/03/491125503.db2.gz VVMYSXHIOUFJQL-VIFPVBQESA-N 1 2 240.372 2.451 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H](C)OC(C)(C)C2)cs1 ZINC000076722680 491125504 /nfs/dbraw/zinc/12/55/04/491125504.db2.gz VVMYSXHIOUFJQL-VIFPVBQESA-N 1 2 240.372 2.451 20 0 BEADLO Cn1c[nH+]c(CCNc2ncccc2Cl)c1 ZINC000313482555 491125968 /nfs/dbraw/zinc/12/59/68/491125968.db2.gz KINWGDFZRKADPN-UHFFFAOYSA-N 1 2 236.706 2.123 20 0 BEADLO CCc1ccc(C[N@H+]2CCN(C)C[C@@H]2CC)cn1 ZINC000560614524 491129305 /nfs/dbraw/zinc/12/93/05/491129305.db2.gz IDZSLTUAFQIKFZ-HNNXBMFYSA-N 1 2 247.386 2.170 20 0 BEADLO CCc1ccc(C[N@@H+]2CCN(C)C[C@@H]2CC)cn1 ZINC000560614524 491129306 /nfs/dbraw/zinc/12/93/06/491129306.db2.gz IDZSLTUAFQIKFZ-HNNXBMFYSA-N 1 2 247.386 2.170 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2cn(C)cn2)o1 ZINC000309250969 491146478 /nfs/dbraw/zinc/14/64/78/491146478.db2.gz DXMKENCBDZXJKN-JTQLQIEISA-N 1 2 219.288 2.172 20 0 BEADLO c1cc2cc(NCc3ccon3)[nH+]cc2[nH]1 ZINC000309331225 491147915 /nfs/dbraw/zinc/14/79/15/491147915.db2.gz HTSQUQWIZPHEHU-UHFFFAOYSA-N 1 2 214.228 2.163 20 0 BEADLO Cc1occc1C[NH2+][C@@H](C)c1nccn1C ZINC000309774163 491156166 /nfs/dbraw/zinc/15/61/66/491156166.db2.gz LGVPSBNSRHWLKB-VIFPVBQESA-N 1 2 219.288 2.172 20 0 BEADLO Cn1c[nH+]c(CNc2ccc3c(c2)COC3)c1 ZINC000310184709 491160676 /nfs/dbraw/zinc/16/06/76/491160676.db2.gz XFBZKUYEMVICBR-UHFFFAOYSA-N 1 2 229.283 2.062 20 0 BEADLO FC1(F)[C@H]2C[N@H+](Cc3ccncc3Cl)C[C@H]21 ZINC000844449641 582588815 /nfs/dbraw/zinc/58/88/15/582588815.db2.gz HMCJSJVNGMVNDM-DTORHVGOSA-N 1 2 244.672 2.432 20 0 BEADLO FC1(F)[C@H]2C[N@@H+](Cc3ccncc3Cl)C[C@H]21 ZINC000844449641 582588818 /nfs/dbraw/zinc/58/88/18/582588818.db2.gz HMCJSJVNGMVNDM-DTORHVGOSA-N 1 2 244.672 2.432 20 0 BEADLO C[C@@H]1C[C@@H]1C[NH2+]c1ccc(-n2ccnn2)cc1 ZINC000488348785 533729699 /nfs/dbraw/zinc/72/96/99/533729699.db2.gz OHFMDUOSMCNTBE-GHMZBOCLSA-N 1 2 228.299 2.335 20 0 BEADLO C[C@@H]1CCC[C@H](C)N(C(=O)/C=C\c2[nH]cc[nH+]2)C1 ZINC000493862501 533823634 /nfs/dbraw/zinc/82/36/34/533823634.db2.gz YKKDRZUYJUVWGB-PBWNMSGQSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@@H]1CCC[C@H](C)N(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493465693 533823075 /nfs/dbraw/zinc/82/30/75/533823075.db2.gz ZDIVMPFWOHVDBR-JIVBQCDMSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@@H]1C[C@H](C)[C@H](C)N(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492815372 533823440 /nfs/dbraw/zinc/82/34/40/533823440.db2.gz WVAIFADUWQGCTO-YYEJGFRBSA-N 1 2 247.342 2.316 20 0 BEADLO CCc1cc(N[C@H](C)COC)nc(CC)[nH+]1 ZINC000891438271 582685408 /nfs/dbraw/zinc/68/54/08/582685408.db2.gz HQUIQRGIGCBLSF-SECBINFHSA-N 1 2 223.320 2.048 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCOC[C@H]2CC)o1 ZINC000891716568 582713446 /nfs/dbraw/zinc/71/34/46/582713446.db2.gz SPKZNCASFVSSFK-LLVKDONJSA-N 1 2 239.315 2.289 20 0 BEADLO CCOc1ccc(C[N@H+]2CCOC[C@H]2CC)o1 ZINC000891716568 582713450 /nfs/dbraw/zinc/71/34/50/582713450.db2.gz SPKZNCASFVSSFK-LLVKDONJSA-N 1 2 239.315 2.289 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)/C=C\C1CCCC1 ZINC000493238935 534271746 /nfs/dbraw/zinc/27/17/46/534271746.db2.gz YCTOCVJJRLBOHT-DGMVEKRQSA-N 1 2 247.342 2.134 20 0 BEADLO Cc1c[nH+]cc(NCc2c[nH]c3nccnc23)c1 ZINC000356130711 518191838 /nfs/dbraw/zinc/19/18/38/518191838.db2.gz CNTYTDQPKYGUEE-UHFFFAOYSA-N 1 2 239.282 2.225 20 0 BEADLO Cc1cn[nH]c1C[NH2+]Cc1ccc(Cl)o1 ZINC000393607716 582818800 /nfs/dbraw/zinc/81/88/00/582818800.db2.gz JGVJGQBAHXITBZ-UHFFFAOYSA-N 1 2 225.679 2.254 20 0 BEADLO Cc1c[nH]nc1C[NH2+]Cc1ccc(Cl)o1 ZINC000393607716 582818803 /nfs/dbraw/zinc/81/88/03/582818803.db2.gz JGVJGQBAHXITBZ-UHFFFAOYSA-N 1 2 225.679 2.254 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)NC1CCCCCC1 ZINC000493523932 534786156 /nfs/dbraw/zinc/78/61/56/534786156.db2.gz LLMBUKNOGUPMPK-BQYQJAHWSA-N 1 2 233.315 2.262 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CCC[C@@H]2CCC[C@H]21 ZINC000493698707 534801220 /nfs/dbraw/zinc/80/12/20/534801220.db2.gz UPHKWSRSTCMZCO-BTWRCGQFSA-N 1 2 245.326 2.214 20 0 BEADLO Cc1cscc1CNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492901455 534832294 /nfs/dbraw/zinc/83/22/94/534832294.db2.gz PIELKVMLLGWUKQ-IHWYPQMZSA-N 1 2 247.323 2.109 20 0 BEADLO CC(C)c1nc(N2CCC(=O)[C@H](C)C2)cc[nH+]1 ZINC000302604796 534907684 /nfs/dbraw/zinc/90/76/84/534907684.db2.gz ZKWXJUGQROEIIV-SNVBAGLBSA-N 1 2 233.315 2.015 20 0 BEADLO CC(C)c1nc(N2CCO[C@H]3CCC[C@@H]32)cc[nH+]1 ZINC000370388067 534910080 /nfs/dbraw/zinc/91/00/80/534910080.db2.gz ZRYSVKZWPKKNBL-RYUDHWBXSA-N 1 2 247.342 2.358 20 0 BEADLO CC(C)(NC(=O)C=Cc1c[nH]c[nH+]1)C1CCC1 ZINC000493252745 527264086 /nfs/dbraw/zinc/26/40/86/527264086.db2.gz HKCRPBGDXGAKIL-SREVYHEPSA-N 1 2 233.315 2.118 20 0 BEADLO C/C=C/C=C/C(=O)N[C@@H](c1[nH+]ccn1C)C1CC1 ZINC000492879989 527584495 /nfs/dbraw/zinc/58/44/95/527584495.db2.gz IFVAIHIJWDNSLO-RXLKZRQMSA-N 1 2 245.326 2.120 20 0 BEADLO C/C=C/C=C\C(=O)NCc1c[nH+]c(C)cc1C ZINC000493630823 527606865 /nfs/dbraw/zinc/60/68/65/527606865.db2.gz MXIPBPOCKUJLHF-DEQVHDEQSA-N 1 2 230.311 2.447 20 0 BEADLO C/C=C/C=C\C(=O)N[C@@H](c1[nH+]ccn1C)C1CC1 ZINC000492879986 527608018 /nfs/dbraw/zinc/60/80/18/527608018.db2.gz IFVAIHIJWDNSLO-BLWGNTIKSA-N 1 2 245.326 2.120 20 0 BEADLO CCC[C@@H]1C[C@@H]1NC(=O)/C=C/c1[nH+]ccn1CC ZINC000493426657 527817506 /nfs/dbraw/zinc/81/75/06/527817506.db2.gz QHVCNVKVEXIXFR-JIVBQCDMSA-N 1 2 247.342 2.221 20 0 BEADLO CCN(CC1CC1)C(=O)/C=C\c1[nH+]ccn1CC ZINC000492450633 528319836 /nfs/dbraw/zinc/31/98/36/528319836.db2.gz RVTZRZFLUQSPLL-FPLPWBNLSA-N 1 2 247.342 2.175 20 0 BEADLO CCN(CC1CCC1)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493812564 528336526 /nfs/dbraw/zinc/33/65/26/528336526.db2.gz BXSZLZUFHHZWPK-VOTSOKGWSA-N 1 2 233.315 2.072 20 0 BEADLO CC(C)C[C@@H]1CCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493196958 528377028 /nfs/dbraw/zinc/37/70/28/528377028.db2.gz YCAYOPDEFXFKEQ-SZZPACECSA-N 1 2 247.342 2.460 20 0 BEADLO CCO/C=C/C(=O)Nc1ccc(C)[nH+]c1C ZINC000492963624 528498606 /nfs/dbraw/zinc/49/86/06/528498606.db2.gz RXICXEMOODUMJF-BQYQJAHWSA-N 1 2 220.272 2.187 20 0 BEADLO CCC(C)(CC)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493361803 528609473 /nfs/dbraw/zinc/60/94/73/528609473.db2.gz XLFTVNNNGVGACM-SREVYHEPSA-N 1 2 221.304 2.118 20 0 BEADLO CCOCCC[N@@H+]1CC[C@H](C)C(F)(F)C1 ZINC000494280675 528666337 /nfs/dbraw/zinc/66/63/37/528666337.db2.gz YCVWMARSMWVFEE-JTQLQIEISA-N 1 2 221.291 2.390 20 0 BEADLO CCOCCC[N@H+]1CC[C@H](C)C(F)(F)C1 ZINC000494280675 528666341 /nfs/dbraw/zinc/66/63/41/528666341.db2.gz YCVWMARSMWVFEE-JTQLQIEISA-N 1 2 221.291 2.390 20 0 BEADLO CC(C)[C@@H]1N(C(=O)/C=C/c2[nH]cc[nH+]2)CC1(C)C ZINC000493404529 528803737 /nfs/dbraw/zinc/80/37/37/528803737.db2.gz WDSKALMPACPMQS-GFUIURDCSA-N 1 2 247.342 2.316 20 0 BEADLO CCN(C(=O)/C=C/c1[nH]cc[nH+]1)C1CCCC1 ZINC000493584423 528907963 /nfs/dbraw/zinc/90/79/63/528907963.db2.gz LNDCGCPIJIFQEN-BQYQJAHWSA-N 1 2 233.315 2.214 20 0 BEADLO CCN(C(=O)C=Cc1c[nH]c[nH+]1)C1CC(C)(C)C1 ZINC000493583633 528911144 /nfs/dbraw/zinc/91/11/44/528911144.db2.gz GLPTXPKVIVAFNO-WAYWQWQTSA-N 1 2 247.342 2.460 20 0 BEADLO CCC[C@@H](CC)NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493085902 528914821 /nfs/dbraw/zinc/91/48/21/528914821.db2.gz DEBNYTJFBGMNMX-VQCYPWCPSA-N 1 2 221.304 2.118 20 0 BEADLO CC1(C)CCC[C@H]1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492775018 528990083 /nfs/dbraw/zinc/99/00/83/528990083.db2.gz XNGXURAJEXHTOU-ISALQUGTSA-N 1 2 233.315 2.118 20 0 BEADLO CC1(C)CC[C@@H](NC(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493497396 529026159 /nfs/dbraw/zinc/02/61/59/529026159.db2.gz YAYXCUUOZWZDCF-UMBAGQNISA-N 1 2 233.315 2.118 20 0 BEADLO CC1(C)CC[C@@H](NC(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493497394 529026535 /nfs/dbraw/zinc/02/65/35/529026535.db2.gz YAYXCUUOZWZDCF-HMDXOVGESA-N 1 2 233.315 2.118 20 0 BEADLO CC1(C)CN(C(=O)C=Cc2c[nH]c[nH+]2)[C@H]1C1CC1 ZINC000493773119 529061088 /nfs/dbraw/zinc/06/10/88/529061088.db2.gz WAMCCPIOCQMXRJ-SZZPACECSA-N 1 2 245.326 2.070 20 0 BEADLO CC[C@H]1CC[C@H](NC(=O)CCc2c[nH+]c[nH]2)CC1 ZINC000479430841 529254284 /nfs/dbraw/zinc/25/42/84/529254284.db2.gz VIKUPXXCZWPRLA-HAQNSBGRSA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@H]1CC[C@H](NC(=O)CCc2c[nH]c[nH+]2)CC1 ZINC000479430841 529254286 /nfs/dbraw/zinc/25/42/86/529254286.db2.gz VIKUPXXCZWPRLA-HAQNSBGRSA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@H]1CC[C@H](NC(=O)CCn2cc[nH+]c2)CC1 ZINC000479471277 529254559 /nfs/dbraw/zinc/25/45/59/529254559.db2.gz DSRXTKYBPNFKJI-JOCQHMNTSA-N 1 2 249.358 2.358 20 0 BEADLO CC[C@H](CC(C)C)c1nc(C[NH2+]C)no1 ZINC000308058005 529310254 /nfs/dbraw/zinc/31/02/54/529310254.db2.gz PZDZKYXYSRXURI-SECBINFHSA-N 1 2 211.309 2.329 20 0 BEADLO CC[C@@H](Nc1cc(C)[nH+]cn1)C1CCOCC1 ZINC000348181226 535809612 /nfs/dbraw/zinc/80/96/12/535809612.db2.gz NGYUCKWOVSOEFD-GFCCVEGCSA-N 1 2 235.331 2.402 20 0 BEADLO CC[C@@](C)(OC)c1noc(C[N@H+](C)C(C)C)n1 ZINC000350446452 536020198 /nfs/dbraw/zinc/02/01/98/536020198.db2.gz XIRKSAMXLFCMKD-GFCCVEGCSA-N 1 2 241.335 2.181 20 0 BEADLO CC[C@@](C)(OC)c1noc(C[N@@H+](C)C(C)C)n1 ZINC000350446452 536020200 /nfs/dbraw/zinc/02/02/00/536020200.db2.gz XIRKSAMXLFCMKD-GFCCVEGCSA-N 1 2 241.335 2.181 20 0 BEADLO CC[C@H]1CO[C@H](C)CN1c1cc[nH+]c(C2CC2)n1 ZINC000268024424 536171482 /nfs/dbraw/zinc/17/14/82/536171482.db2.gz IWAQJSXIXXIDMA-PWSUYJOCSA-N 1 2 247.342 2.358 20 0 BEADLO CNc1cc(N[C@H]2CC=CCC2)[nH+]cn1 ZINC000892605201 582927715 /nfs/dbraw/zinc/92/77/15/582927715.db2.gz MLCDVGPOIQODTJ-VIFPVBQESA-N 1 2 204.277 2.039 20 0 BEADLO COC(=O)[C@@H]1CCCCC[N@@H+]1Cc1ccco1 ZINC000260313926 536462978 /nfs/dbraw/zinc/46/29/78/536462978.db2.gz ZSQABWZQQHJDPU-LBPRGKRZSA-N 1 2 237.299 2.197 20 0 BEADLO COC(=O)[C@@H]1CCCCC[N@H+]1Cc1ccco1 ZINC000260313926 536462980 /nfs/dbraw/zinc/46/29/80/536462980.db2.gz ZSQABWZQQHJDPU-LBPRGKRZSA-N 1 2 237.299 2.197 20 0 BEADLO CO[C@@H](C)[C@@H](C)Nc1cc(C)[nH+]c(C(C)C)n1 ZINC000342452447 536884922 /nfs/dbraw/zinc/88/49/22/536884922.db2.gz DGULAUVXIJOJCX-MNOVXSKESA-N 1 2 237.347 2.166 20 0 BEADLO Fc1ccc2[nH+]c(NCc3cn[nH]c3)[nH]c2c1 ZINC000236191583 537941347 /nfs/dbraw/zinc/94/13/47/537941347.db2.gz GQYBXJNEGDRXSK-UHFFFAOYSA-N 1 2 231.234 2.037 20 0 BEADLO CC(C)(C)c1cc(C[N@@H+]2CCCOCC2)no1 ZINC000335872849 538101569 /nfs/dbraw/zinc/10/15/69/538101569.db2.gz LARMAKFJMDLIEB-UHFFFAOYSA-N 1 2 238.331 2.194 20 0 BEADLO CC(C)(C)c1cc(C[N@H+]2CCCOCC2)no1 ZINC000335872849 538101572 /nfs/dbraw/zinc/10/15/72/538101572.db2.gz LARMAKFJMDLIEB-UHFFFAOYSA-N 1 2 238.331 2.194 20 0 BEADLO C[C@@H](CCO)Nc1cc2ccccc2c[nH+]1 ZINC000631124089 538457839 /nfs/dbraw/zinc/45/78/39/538457839.db2.gz FUEJWQRIDLFJKC-JTQLQIEISA-N 1 2 216.284 2.418 20 0 BEADLO Fc1ccc(/C=C/C[NH+]2CCOCC2)cc1F ZINC000289026016 566383734 /nfs/dbraw/zinc/38/37/34/566383734.db2.gz GQNADLHNDMABFA-OWOJBTEDSA-N 1 2 239.265 2.310 20 0 BEADLO CC(C)=CCCNc1cc(N(C)C)nc[nH+]1 ZINC000893456426 583146516 /nfs/dbraw/zinc/14/65/16/583146516.db2.gz ZEOLNJBYXGHWEL-UHFFFAOYSA-N 1 2 220.320 2.311 20 0 BEADLO CC(C)=CCCNc1cc(N(C)C)[nH+]cn1 ZINC000893456426 583146518 /nfs/dbraw/zinc/14/65/18/583146518.db2.gz ZEOLNJBYXGHWEL-UHFFFAOYSA-N 1 2 220.320 2.311 20 0 BEADLO CCc1cc(NCCC[C@H](C)O)nc(CC)[nH+]1 ZINC000893562335 583164468 /nfs/dbraw/zinc/16/44/68/583164468.db2.gz SLAHHMDCELAHPB-JTQLQIEISA-N 1 2 237.347 2.174 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CCC[C@@H](C)C2)c1C ZINC000893870442 583235466 /nfs/dbraw/zinc/23/54/66/583235466.db2.gz CZJSYUGZUJQXMR-SECBINFHSA-N 1 2 207.321 2.258 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CCC[C@@H](C)C2)c1C ZINC000893870442 583235471 /nfs/dbraw/zinc/23/54/71/583235471.db2.gz CZJSYUGZUJQXMR-SECBINFHSA-N 1 2 207.321 2.258 20 0 BEADLO CSc1ccc(C[N@H+]2CCOC[C@H]2C)o1 ZINC000893962754 583258105 /nfs/dbraw/zinc/25/81/05/583258105.db2.gz QIRJPVDERNVOLU-SECBINFHSA-N 1 2 227.329 2.222 20 0 BEADLO CC(C)c1c[nH]c(CN2CCO[C@H](C)[C@@H]2C)[nH+]1 ZINC000894026546 583280181 /nfs/dbraw/zinc/28/01/81/583280181.db2.gz MMKRSCDIVNHIKR-WDEREUQCSA-N 1 2 237.347 2.142 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@H]2CC[C@@H](C)C2)c1 ZINC000853508537 588746672 /nfs/dbraw/zinc/74/66/72/588746672.db2.gz IPIHCPKQZHVRLY-PWSUYJOCSA-N 1 2 248.326 2.398 20 0 BEADLO CC(C)OCC(N)=[NH+]OC[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000853657657 588752929 /nfs/dbraw/zinc/75/29/29/588752929.db2.gz FBRPFYCZSHXZDU-UTUOFQBUSA-N 1 2 240.347 2.346 20 0 BEADLO CC[C@H](CO[NH+]=C(N)[C@@H](C)OC)CC(F)F ZINC000853674341 588754754 /nfs/dbraw/zinc/75/47/54/588754754.db2.gz WQXNGSCIRYONQO-SFYZADRCSA-N 1 2 238.278 2.201 20 0 BEADLO CC1(CO[NH+]=C(N)Cc2cccnc2)CCC1 ZINC000853678138 588755291 /nfs/dbraw/zinc/75/52/91/588755291.db2.gz BTEFOUGBNLJNPV-UHFFFAOYSA-N 1 2 233.315 2.313 20 0 BEADLO NC(Cc1cccnc1)=[NH+]OCC1CC=CC1 ZINC000853679429 588755330 /nfs/dbraw/zinc/75/53/30/588755330.db2.gz XTAVJANQVNZDSG-UHFFFAOYSA-N 1 2 231.299 2.089 20 0 BEADLO C1=C[C@@H](Nc2cc(N3CCCC3)nc[nH+]2)CC1 ZINC000853801298 588764306 /nfs/dbraw/zinc/76/43/06/588764306.db2.gz UMUXIEOFBDDXDH-LLVKDONJSA-N 1 2 230.315 2.207 20 0 BEADLO C1=C[C@@H](Nc2cc(N3CCCC3)[nH+]cn2)CC1 ZINC000853801298 588764307 /nfs/dbraw/zinc/76/43/07/588764307.db2.gz UMUXIEOFBDDXDH-LLVKDONJSA-N 1 2 230.315 2.207 20 0 BEADLO CC(C)c1nc(N2C[C@@H](C)C(=O)[C@H](C)C2)cc[nH+]1 ZINC000853819787 588764860 /nfs/dbraw/zinc/76/48/60/588764860.db2.gz BHJXCMBHQZGHOR-GHMZBOCLSA-N 1 2 247.342 2.261 20 0 BEADLO CC(C)c1nc(N(C)CC2=CCCOC2)cc[nH+]1 ZINC000853837421 588765436 /nfs/dbraw/zinc/76/54/36/588765436.db2.gz VYLJBURDUMTBSH-UHFFFAOYSA-N 1 2 247.342 2.383 20 0 BEADLO CC(C)c1nc(NC[C@@H](CO)CC2CC2)cc[nH+]1 ZINC000853869469 588766687 /nfs/dbraw/zinc/76/66/87/588766687.db2.gz VWWYOEABXCBKBT-LBPRGKRZSA-N 1 2 249.358 2.421 20 0 BEADLO CCC[C@H](C)c1noc([C@@H]([NH3+])COC(C)C)n1 ZINC000854138347 588774800 /nfs/dbraw/zinc/77/48/00/588774800.db2.gz HIELBQXGUPQPDZ-UWVGGRQHSA-N 1 2 241.335 2.398 20 0 BEADLO CC[NH2+]Cc1noc([C@H](OC)C2CCCC2)n1 ZINC000854132427 588775767 /nfs/dbraw/zinc/77/57/67/588775767.db2.gz YORJUKURSSCARK-LLVKDONJSA-N 1 2 239.319 2.057 20 0 BEADLO C[C@@H](NC(=O)/C=C/C1CCCC1)c1[nH]cc[nH+]1 ZINC000854594632 588796285 /nfs/dbraw/zinc/79/62/85/588796285.db2.gz OWZDHYHHCKBDPW-VQCYPWCPSA-N 1 2 233.315 2.333 20 0 BEADLO C[C@@H](NC(=O)C=CC1CCCC1)c1[nH]cc[nH+]1 ZINC000854594632 588796286 /nfs/dbraw/zinc/79/62/86/588796286.db2.gz OWZDHYHHCKBDPW-VQCYPWCPSA-N 1 2 233.315 2.333 20 0 BEADLO CC(C)C[C@@]1(C)CCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC000854750784 588805267 /nfs/dbraw/zinc/80/52/67/588805267.db2.gz XMBKYGHFWJTMBI-CQSZACIVSA-N 1 2 249.358 2.379 20 0 BEADLO CCC1(NC(=O)Cc2[nH]cc[nH+]2)CCCCC1 ZINC000854826720 588812483 /nfs/dbraw/zinc/81/24/83/588812483.db2.gz SLHLQHYBWCDLJN-UHFFFAOYSA-N 1 2 235.331 2.181 20 0 BEADLO CC(C)[C@@H]1CN(C(=O)Cc2[nH]cc[nH+]2)[C@H]1C(C)C ZINC000854827283 588812491 /nfs/dbraw/zinc/81/24/91/588812491.db2.gz IAKFPKPFVXETOA-FZMZJTMJSA-N 1 2 249.358 2.091 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)NCC1(C2CCC2)CCC1 ZINC000854899036 588815985 /nfs/dbraw/zinc/81/59/85/588815985.db2.gz JAAXZJMYYPMDDW-UHFFFAOYSA-N 1 2 247.342 2.039 20 0 BEADLO C[C@@H]1CCCC[C@@]1(C)NC(=O)Cc1[nH]cc[nH+]1 ZINC000854902470 588816174 /nfs/dbraw/zinc/81/61/74/588816174.db2.gz DUODNIZEIZZTLZ-ZWNOBZJWSA-N 1 2 235.331 2.037 20 0 BEADLO CCC[C@H](NC(=O)Cc1[nH]cc[nH+]1)C1CCCC1 ZINC000854918606 588816747 /nfs/dbraw/zinc/81/67/47/588816747.db2.gz CDHNEORJZMEKNM-LBPRGKRZSA-N 1 2 249.358 2.427 20 0 BEADLO CC(C)(C)[C@@H]1CCC[C@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000854942521 588817560 /nfs/dbraw/zinc/81/75/60/588817560.db2.gz VKOZELSLEWIVKG-GHMZBOCLSA-N 1 2 249.358 2.283 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)C(C)(C)C(C)(F)F ZINC000855134795 588822573 /nfs/dbraw/zinc/82/25/73/588822573.db2.gz AELIKZLGQPBYEH-UHFFFAOYSA-N 1 2 245.273 2.050 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)C(C)(C)C(C)(F)F ZINC000855134795 588822574 /nfs/dbraw/zinc/82/25/74/588822574.db2.gz AELIKZLGQPBYEH-UHFFFAOYSA-N 1 2 245.273 2.050 20 0 BEADLO CCCC[C@@](C)(F)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000855135201 588822813 /nfs/dbraw/zinc/82/28/13/588822813.db2.gz ICYYYKICVOUJHR-GFCCVEGCSA-N 1 2 241.310 2.287 20 0 BEADLO CCCC[C@@](C)(F)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000855135201 588822814 /nfs/dbraw/zinc/82/28/14/588822814.db2.gz ICYYYKICVOUJHR-GFCCVEGCSA-N 1 2 241.310 2.287 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@H]1CC=CC[C@H]1C ZINC000890765567 582542354 /nfs/dbraw/zinc/54/23/54/582542354.db2.gz KQJNBLMRWYELBD-NQBHXWOUSA-N 1 2 247.342 2.059 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@H]1CC=CC[C@H]1C ZINC000890765567 582542357 /nfs/dbraw/zinc/54/23/57/582542357.db2.gz KQJNBLMRWYELBD-NQBHXWOUSA-N 1 2 247.342 2.059 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N[C@@H]3C=CCC3)ccn12 ZINC000855434811 588836104 /nfs/dbraw/zinc/83/61/04/588836104.db2.gz QOQAPSOOAYDWFN-GFCCVEGCSA-N 1 2 241.294 2.091 20 0 BEADLO C[C@@H](O)c1cccc(NCc2ccco2)[nH+]1 ZINC000891387806 582675732 /nfs/dbraw/zinc/67/57/32/582675732.db2.gz FHNAPYVULHUMAD-SECBINFHSA-N 1 2 218.256 2.340 20 0 BEADLO CC[C@@H]1CCCCN1c1nccn2c[nH+]cc12 ZINC000891395038 582676803 /nfs/dbraw/zinc/67/68/03/582676803.db2.gz UWTMGXQSMJOPSF-LLVKDONJSA-N 1 2 230.315 2.498 20 0 BEADLO CC[C@@H](CO)Nc1cc(C)[nH+]c(C2CCC2)n1 ZINC000891412876 582680915 /nfs/dbraw/zinc/68/09/15/582680915.db2.gz GPKZTJUNQVRNJK-NSHDSACASA-N 1 2 235.331 2.235 20 0 BEADLO CCN(CCO)c1cc(C2CC2)[nH+]c(C2CC2)n1 ZINC000891428036 582682606 /nfs/dbraw/zinc/68/26/06/582682606.db2.gz ZSVIDOMNBRYKOV-UHFFFAOYSA-N 1 2 247.342 2.050 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nccc3c2CCCC3)CCO1 ZINC000891542121 582695576 /nfs/dbraw/zinc/69/55/76/582695576.db2.gz IKKMUXOEJQALDX-GFCCVEGCSA-N 1 2 246.354 2.181 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nccc3c2CCCC3)CCO1 ZINC000891542121 582695577 /nfs/dbraw/zinc/69/55/77/582695577.db2.gz IKKMUXOEJQALDX-GFCCVEGCSA-N 1 2 246.354 2.181 20 0 BEADLO CC(C)(CO)Nc1cc(C2CC2)[nH+]c(C2CC2)n1 ZINC000891593774 582700424 /nfs/dbraw/zinc/70/04/24/582700424.db2.gz ZEYKUQLJSAGZQB-UHFFFAOYSA-N 1 2 247.342 2.414 20 0 BEADLO Cc1cc(F)ncc1C[N@H+]1C[C@H](C)OC[C@@H]1C ZINC000891672620 582708244 /nfs/dbraw/zinc/70/82/44/582708244.db2.gz WMVCGSCPBXHPTB-QWRGUYRKSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1cc(F)ncc1C[N@@H+]1C[C@H](C)OC[C@@H]1C ZINC000891672620 582708246 /nfs/dbraw/zinc/70/82/46/582708246.db2.gz WMVCGSCPBXHPTB-QWRGUYRKSA-N 1 2 238.306 2.138 20 0 BEADLO CCOc1ccc(C[N@@H+]2C[C@H](C)OC[C@@H]2C)o1 ZINC000891672349 582708639 /nfs/dbraw/zinc/70/86/39/582708639.db2.gz VRZAPJGYGXPWFW-QWRGUYRKSA-N 1 2 239.315 2.288 20 0 BEADLO CCOc1ccc(C[N@H+]2C[C@H](C)OC[C@@H]2C)o1 ZINC000891672349 582708640 /nfs/dbraw/zinc/70/86/40/582708640.db2.gz VRZAPJGYGXPWFW-QWRGUYRKSA-N 1 2 239.315 2.288 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H](C)OC[C@@H]2C)cnc1F ZINC000891669881 582708804 /nfs/dbraw/zinc/70/88/04/582708804.db2.gz FYPHHZLHEWOOJW-QWRGUYRKSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H](C)OC[C@@H]2C)cnc1F ZINC000891669881 582708807 /nfs/dbraw/zinc/70/88/07/582708807.db2.gz FYPHHZLHEWOOJW-QWRGUYRKSA-N 1 2 238.306 2.138 20 0 BEADLO CCc1cc(N2CCO[C@H](CC)C2)nc(CC)[nH+]1 ZINC000891684794 582710033 /nfs/dbraw/zinc/71/00/33/582710033.db2.gz XICPZDYOINUCKT-GFCCVEGCSA-N 1 2 249.358 2.217 20 0 BEADLO Cc1cc(F)ncc1C[N@@H+]1CCOC(C)(C)C1 ZINC000891706383 582711007 /nfs/dbraw/zinc/71/10/07/582711007.db2.gz NIRWMEBIDRGLLX-UHFFFAOYSA-N 1 2 238.306 2.140 20 0 BEADLO Cc1cc(F)ncc1C[N@H+]1CCOC(C)(C)C1 ZINC000891706383 582711009 /nfs/dbraw/zinc/71/10/09/582711009.db2.gz NIRWMEBIDRGLLX-UHFFFAOYSA-N 1 2 238.306 2.140 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1cnc(F)c(C)c1 ZINC000891716567 582713104 /nfs/dbraw/zinc/71/31/04/582713104.db2.gz SNHSKXFSMJPVLI-LBPRGKRZSA-N 1 2 238.306 2.140 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1cnc(F)c(C)c1 ZINC000891716567 582713105 /nfs/dbraw/zinc/71/31/05/582713105.db2.gz SNHSKXFSMJPVLI-LBPRGKRZSA-N 1 2 238.306 2.140 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1cnc(F)cc1C ZINC000891716314 582713400 /nfs/dbraw/zinc/71/34/00/582713400.db2.gz OCMVXCYNOZVZPL-GFCCVEGCSA-N 1 2 238.306 2.140 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1cnc(F)cc1C ZINC000891716314 582713403 /nfs/dbraw/zinc/71/34/03/582713403.db2.gz OCMVXCYNOZVZPL-GFCCVEGCSA-N 1 2 238.306 2.140 20 0 BEADLO CC(C)(C)c1coc(C[N@@H+]2CCCOCC2)n1 ZINC000891720975 582714029 /nfs/dbraw/zinc/71/40/29/582714029.db2.gz SADIKCYLQACNEM-UHFFFAOYSA-N 1 2 238.331 2.194 20 0 BEADLO CC(C)(C)c1coc(C[N@H+]2CCCOCC2)n1 ZINC000891720975 582714032 /nfs/dbraw/zinc/71/40/32/582714032.db2.gz SADIKCYLQACNEM-UHFFFAOYSA-N 1 2 238.331 2.194 20 0 BEADLO CC[C@H]1CCCN(c2nccn3c[nH+]cc23)C1 ZINC000891784404 582721096 /nfs/dbraw/zinc/72/10/96/582721096.db2.gz WSLHFQIHNRETDG-NSHDSACASA-N 1 2 230.315 2.356 20 0 BEADLO CC(C)(F)CCNC(=O)c1cccc2[nH+]ccn21 ZINC000855745677 588846918 /nfs/dbraw/zinc/84/69/18/588846918.db2.gz DOMCVPLGJORZES-UHFFFAOYSA-N 1 2 249.289 2.202 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nc(Br)c[nH]2)C1 ZINC000891797489 582724210 /nfs/dbraw/zinc/72/42/10/582724210.db2.gz KTLBDBWNWROTMV-SSDOTTSWSA-N 1 2 244.136 2.014 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nc(Br)c[nH]2)C1 ZINC000891797489 582724212 /nfs/dbraw/zinc/72/42/12/582724212.db2.gz KTLBDBWNWROTMV-SSDOTTSWSA-N 1 2 244.136 2.014 20 0 BEADLO CCOc1ccc(C[N@H+](C)Cc2cnccn2)o1 ZINC000891822972 582726884 /nfs/dbraw/zinc/72/68/84/582726884.db2.gz JBSTVVLWFBODRK-UHFFFAOYSA-N 1 2 247.298 2.100 20 0 BEADLO CCOc1ccc(C[N@@H+](C)Cc2cnccn2)o1 ZINC000891822972 582726885 /nfs/dbraw/zinc/72/68/85/582726885.db2.gz JBSTVVLWFBODRK-UHFFFAOYSA-N 1 2 247.298 2.100 20 0 BEADLO Cc1cc(NCc2cc[nH]n2)nc(C2CCC2)[nH+]1 ZINC000891823087 582726891 /nfs/dbraw/zinc/72/68/91/582726891.db2.gz ZMPJLZWCGGHSBY-UHFFFAOYSA-N 1 2 243.314 2.388 20 0 BEADLO CCc1cc(N2CCSCC2)nc(CC)[nH+]1 ZINC000891877862 582734242 /nfs/dbraw/zinc/73/42/42/582734242.db2.gz BFZWEBQYYWAUKU-UHFFFAOYSA-N 1 2 237.372 2.155 20 0 BEADLO C[C@@H]1CCC[N@@H+]1Cc1nc(Br)c[nH]1 ZINC000892018736 582762544 /nfs/dbraw/zinc/76/25/44/582762544.db2.gz FZBKNNNNXBJEEW-SSDOTTSWSA-N 1 2 244.136 2.157 20 0 BEADLO C[C@@H]1CCC[N@H+]1Cc1nc(Br)c[nH]1 ZINC000892018736 582762545 /nfs/dbraw/zinc/76/25/45/582762545.db2.gz FZBKNNNNXBJEEW-SSDOTTSWSA-N 1 2 244.136 2.157 20 0 BEADLO Cc1cc(CNc2cccc([C@@H](C)O)[nH+]2)on1 ZINC000892019436 582762879 /nfs/dbraw/zinc/76/28/79/582762879.db2.gz SXFSWOCTHIAGKZ-SECBINFHSA-N 1 2 233.271 2.043 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCO[C@@H](C)[C@@H]2C)o1 ZINC000892047789 582773196 /nfs/dbraw/zinc/77/31/96/582773196.db2.gz BYTHELFGMVMSEX-QWRGUYRKSA-N 1 2 239.315 2.288 20 0 BEADLO CCOc1ccc(C[N@H+]2CCO[C@@H](C)[C@@H]2C)o1 ZINC000892047789 582773198 /nfs/dbraw/zinc/77/31/98/582773198.db2.gz BYTHELFGMVMSEX-QWRGUYRKSA-N 1 2 239.315 2.288 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCO[C@@H](C)[C@H]2C)o1 ZINC000892047788 582773406 /nfs/dbraw/zinc/77/34/06/582773406.db2.gz BYTHELFGMVMSEX-MNOVXSKESA-N 1 2 239.315 2.288 20 0 BEADLO CCOc1ccc(C[N@H+]2CCO[C@@H](C)[C@H]2C)o1 ZINC000892047788 582773408 /nfs/dbraw/zinc/77/34/08/582773408.db2.gz BYTHELFGMVMSEX-MNOVXSKESA-N 1 2 239.315 2.288 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@@H](C)[C@H]2C)cnc1F ZINC000892049260 582773803 /nfs/dbraw/zinc/77/38/03/582773803.db2.gz QKUUXBCNUZWNSM-MNOVXSKESA-N 1 2 238.306 2.138 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@@H](C)[C@H]2C)cnc1F ZINC000892049260 582773805 /nfs/dbraw/zinc/77/38/05/582773805.db2.gz QKUUXBCNUZWNSM-MNOVXSKESA-N 1 2 238.306 2.138 20 0 BEADLO CCCCOCCNc1cccc([C@H](C)O)[nH+]1 ZINC000892075661 582785982 /nfs/dbraw/zinc/78/59/82/582785982.db2.gz LLZUNIAHIUFSPA-NSHDSACASA-N 1 2 238.331 2.364 20 0 BEADLO Cc1cc(N2CCCOCC2)nc(C2CCC2)[nH+]1 ZINC000892124936 582795530 /nfs/dbraw/zinc/79/55/30/582795530.db2.gz DVXZFWVXSQKLER-UHFFFAOYSA-N 1 2 247.342 2.279 20 0 BEADLO CCC(O)(CC)CNc1cccc([C@H](C)O)[nH+]1 ZINC000892125796 582795719 /nfs/dbraw/zinc/79/57/19/582795719.db2.gz MXADRGQSICNPQT-JTQLQIEISA-N 1 2 238.331 2.098 20 0 BEADLO Cc1cccn2c(NC(=O)C3(F)CC3)c[nH+]c12 ZINC000855903282 588853166 /nfs/dbraw/zinc/85/31/66/588853166.db2.gz VVXNJOHDOCVJQF-UHFFFAOYSA-N 1 2 233.246 2.083 20 0 BEADLO CN(C)c1cc(N(C)CC(C)(C)C)nc[nH+]1 ZINC000892278333 582825481 /nfs/dbraw/zinc/82/54/81/582825481.db2.gz PGSASPXQKGRJOI-UHFFFAOYSA-N 1 2 222.336 2.025 20 0 BEADLO CN(C)c1cc(N(C)CC(C)(C)C)[nH+]cn1 ZINC000892278333 582825482 /nfs/dbraw/zinc/82/54/82/582825482.db2.gz PGSASPXQKGRJOI-UHFFFAOYSA-N 1 2 222.336 2.025 20 0 BEADLO CC(C)(O)CNc1ccc(-c2ccncc2)c[nH+]1 ZINC000892308213 582835007 /nfs/dbraw/zinc/83/50/07/582835007.db2.gz GLOAMGBPMZZUPC-UHFFFAOYSA-N 1 2 243.310 2.326 20 0 BEADLO Cc1noc(C)c1[C@H](C)[NH2+][C@@H](C)c1cnccn1 ZINC000092326998 582855578 /nfs/dbraw/zinc/85/55/78/582855578.db2.gz GTYOFTDVPOUYLG-IUCAKERBSA-N 1 2 246.314 2.493 20 0 BEADLO COc1ccc(C[NH2+]Cc2ccco2)o1 ZINC000892429438 582885969 /nfs/dbraw/zinc/88/59/69/582885969.db2.gz JZBZCASBQZWJHD-UHFFFAOYSA-N 1 2 207.229 2.171 20 0 BEADLO CC1(C)CCCN(c2nccn3c[nH+]cc23)C1 ZINC000892507991 582901487 /nfs/dbraw/zinc/90/14/87/582901487.db2.gz HSTFNFSHGLRZED-UHFFFAOYSA-N 1 2 230.315 2.356 20 0 BEADLO COc1ccc(C[NH2+]Cc2csc(C)n2)o1 ZINC000892511211 582903399 /nfs/dbraw/zinc/90/33/99/582903399.db2.gz ATHKHIUWKNLHKO-UHFFFAOYSA-N 1 2 238.312 2.343 20 0 BEADLO CCc1cc(N2CCOC[C@@H]2CC)nc(CC)[nH+]1 ZINC000892560690 582914193 /nfs/dbraw/zinc/91/41/93/582914193.db2.gz YLNXIFRRFQHRSL-LBPRGKRZSA-N 1 2 249.358 2.217 20 0 BEADLO Cn1ncc(CNc2cccc[nH+]2)c1C1CC1 ZINC000892637783 582935203 /nfs/dbraw/zinc/93/52/03/582935203.db2.gz QWZZXEMZQMYDER-UHFFFAOYSA-N 1 2 228.299 2.305 20 0 BEADLO CCOc1ccc(C[NH2+]Cc2cc(C)on2)o1 ZINC000892675909 582949729 /nfs/dbraw/zinc/94/97/29/582949729.db2.gz GZUIAIPNGDMZJH-UHFFFAOYSA-N 1 2 236.271 2.265 20 0 BEADLO Cc1cc(C[NH2+]Cc2cnc(F)cc2C)no1 ZINC000892676175 582949739 /nfs/dbraw/zinc/94/97/39/582949739.db2.gz IODAZPXNOOSYOU-UHFFFAOYSA-N 1 2 235.262 2.115 20 0 BEADLO C[C@H](NC(=O)/C=C/C(C)(C)C)c1[nH+]ccn1C ZINC000856278038 588866710 /nfs/dbraw/zinc/86/67/10/588866710.db2.gz WFZRBGRTZUEXGN-FGEFZZPRSA-N 1 2 235.331 2.200 20 0 BEADLO Cc1cnc(CNc2cccc([C@@H](C)O)[nH+]2)o1 ZINC000892747662 582974983 /nfs/dbraw/zinc/97/49/83/582974983.db2.gz DHJWEJBODFVICQ-SECBINFHSA-N 1 2 233.271 2.043 20 0 BEADLO C[C@H](NC(=O)/C=C1\CC[C@@H](C)C1)c1[nH+]ccn1C ZINC000856277648 588866739 /nfs/dbraw/zinc/86/67/39/588866739.db2.gz NMWHNVJKXOHBBA-XPOMOVIQSA-N 1 2 247.342 2.344 20 0 BEADLO CO[C@@H](CNc1cccc([C@@H](C)O)[nH+]1)C(C)C ZINC000892753835 582975703 /nfs/dbraw/zinc/97/57/03/582975703.db2.gz XYJSRADPRPHJDA-PWSUYJOCSA-N 1 2 238.331 2.218 20 0 BEADLO CO[C@@H](CNc1cccc([C@H](C)O)[nH+]1)C(C)C ZINC000892753833 582976134 /nfs/dbraw/zinc/97/61/34/582976134.db2.gz XYJSRADPRPHJDA-JQWIXIFHSA-N 1 2 238.331 2.218 20 0 BEADLO Cc1ccccc1[C@@H](C)[NH2+]Cc1cnon1 ZINC000851892471 582976551 /nfs/dbraw/zinc/97/65/51/582976551.db2.gz JSMUANUQIANRIW-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO C[C@@H](O)c1cccc(N[C@@H]2CCCSC2)[nH+]1 ZINC000892814518 582987734 /nfs/dbraw/zinc/98/77/34/582987734.db2.gz ZRFZHYFQILAQAF-NXEZZACHSA-N 1 2 238.356 2.442 20 0 BEADLO CO[C@@H]1CCN(c2cc(C)[nH+]c(C3CCC3)n2)C1 ZINC000892812312 582987840 /nfs/dbraw/zinc/98/78/40/582987840.db2.gz LBPJCLBBVVJBRV-GFCCVEGCSA-N 1 2 247.342 2.278 20 0 BEADLO CCc1nnc([C@@H](C)[NH+]2CCC(F)(F)CC2)[nH]1 ZINC000852002102 582992413 /nfs/dbraw/zinc/99/24/13/582992413.db2.gz SPVQDTBVVVQDBK-MRVPVSSYSA-N 1 2 244.289 2.159 20 0 BEADLO CC1(C)CN(c2nccn3c[nH+]cc23)CCS1 ZINC000892862485 582998041 /nfs/dbraw/zinc/99/80/41/582998041.db2.gz UKMXPXNXPCQOCC-UHFFFAOYSA-N 1 2 248.355 2.061 20 0 BEADLO Cc1cncc(CNc2cccc([C@H](C)O)[nH+]2)c1 ZINC000893023511 583032079 /nfs/dbraw/zinc/03/20/79/583032079.db2.gz RUBAGURXKPUTNW-NSHDSACASA-N 1 2 243.310 2.450 20 0 BEADLO C[C@H](O)c1cccc(N[C@H]2CCO[C@H](C)C2)[nH+]1 ZINC000893087590 583047249 /nfs/dbraw/zinc/04/72/49/583047249.db2.gz CXJIRMFIWIFKGU-VWYCJHECSA-N 1 2 236.315 2.114 20 0 BEADLO NC(=[NH+]OCCCC1CCC1)[C@@H]1CCCO1 ZINC000853698965 583062118 /nfs/dbraw/zinc/06/21/18/583062118.db2.gz WEGRGTASSJBALT-NSHDSACASA-N 1 2 226.320 2.244 20 0 BEADLO Cc1cc(N(C)C2CC(O)C2)nc(C2CCC2)[nH+]1 ZINC000893167877 583062637 /nfs/dbraw/zinc/06/26/37/583062637.db2.gz OTVOQYKYPBIJBS-UHFFFAOYSA-N 1 2 247.342 2.012 20 0 BEADLO Cc1oncc1CSCCn1cc[nH+]c1 ZINC000853788061 583067525 /nfs/dbraw/zinc/06/75/25/583067525.db2.gz SJRXCTOCWCTUCT-UHFFFAOYSA-N 1 2 223.301 2.113 20 0 BEADLO Cc1cncc(C[NH2+]Cc2nccn2C2CC2)c1 ZINC000893250128 583077925 /nfs/dbraw/zinc/07/79/25/583077925.db2.gz ZGCAWHZXAIMCLF-UHFFFAOYSA-N 1 2 242.326 2.211 20 0 BEADLO Cc1[nH+]cccc1NCc1cn(C)nc1Cl ZINC000856775338 588876977 /nfs/dbraw/zinc/87/69/77/588876977.db2.gz LPPSNJOLANHDFG-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO CC(C)[C@@H]1CN(Cc2[nH+]ccn2C2CC2)CCO1 ZINC000893403099 583137506 /nfs/dbraw/zinc/13/75/06/583137506.db2.gz QLRTYJXRPLWNKN-ZDUSSCGKSA-N 1 2 249.358 2.075 20 0 BEADLO Cc1c[nH+]c2n1CC[C@@H]2OC(=O)C(C)(C)C ZINC000893517418 583155801 /nfs/dbraw/zinc/15/58/01/583155801.db2.gz FSZHUKLJSCVPDR-VIFPVBQESA-N 1 2 222.288 2.226 20 0 BEADLO Cc1c[nH+]c2n1CC[C@@H]2OC(=O)[C@@H]1CC1(C)C ZINC000893524342 583157366 /nfs/dbraw/zinc/15/73/66/583157366.db2.gz IZEDKRUSZOWHRG-UWVGGRQHSA-N 1 2 234.299 2.226 20 0 BEADLO CC[C@]1(C)COCC[N@@H+]1Cc1ccc(OC)o1 ZINC000893664449 583191733 /nfs/dbraw/zinc/19/17/33/583191733.db2.gz BPGRSQOSSSTYGJ-CYBMUJFWSA-N 1 2 239.315 2.289 20 0 BEADLO CC[C@]1(C)COCC[N@H+]1Cc1ccc(OC)o1 ZINC000893664449 583191736 /nfs/dbraw/zinc/19/17/36/583191736.db2.gz BPGRSQOSSSTYGJ-CYBMUJFWSA-N 1 2 239.315 2.289 20 0 BEADLO CCc1cc(N2CC[C@H]3C[C@H]32)nc(CC)[nH+]1 ZINC000893680159 583198156 /nfs/dbraw/zinc/19/81/56/583198156.db2.gz HOBQIMOXDRQJLF-GXSJLCMTSA-N 1 2 217.316 2.200 20 0 BEADLO C[C@H](O)c1cccc(N[C@@H]2CSC[C@H]2C)[nH+]1 ZINC000893829450 583227106 /nfs/dbraw/zinc/22/71/06/583227106.db2.gz YNDKXTZEJKPCCP-WCABBAIRSA-N 1 2 238.356 2.298 20 0 BEADLO COc1ccc(F)c(C[NH2+][C@@H](C)c2ncc[nH]2)c1 ZINC000857080905 588885862 /nfs/dbraw/zinc/88/58/62/588885862.db2.gz LMRKVJUXFKTNSL-VIFPVBQESA-N 1 2 249.289 2.408 20 0 BEADLO c1[nH+]cn2ccnc(N3CCC4(CCC4)CC3)c12 ZINC000893836454 583228682 /nfs/dbraw/zinc/22/86/82/583228682.db2.gz OSFWRKWPVAPPSV-UHFFFAOYSA-N 1 2 242.326 2.500 20 0 BEADLO CC[C@@H]1CN(Cc2[nH]cc(C(C)C)[nH+]2)CCO1 ZINC000893918707 583247426 /nfs/dbraw/zinc/24/74/26/583247426.db2.gz CXRJOFOTLYPLRT-LLVKDONJSA-N 1 2 237.347 2.144 20 0 BEADLO CSc1ccc(C[N@@H+]2CCOC[C@H]2C)o1 ZINC000893962754 583258102 /nfs/dbraw/zinc/25/81/02/583258102.db2.gz QIRJPVDERNVOLU-SECBINFHSA-N 1 2 227.329 2.222 20 0 BEADLO Cc1coc(C[N@H+]2C[C@H](C)OC[C@@H]2C)c1 ZINC000893953838 583261254 /nfs/dbraw/zinc/26/12/54/583261254.db2.gz ZSMZHLPFCIOZPC-QWRGUYRKSA-N 1 2 209.289 2.197 20 0 BEADLO Cc1coc(C[N@@H+]2C[C@H](C)OC[C@@H]2C)c1 ZINC000893953838 583261256 /nfs/dbraw/zinc/26/12/56/583261256.db2.gz ZSMZHLPFCIOZPC-QWRGUYRKSA-N 1 2 209.289 2.197 20 0 BEADLO CCc1cc(N[C@@H](C)CF)nc(CC)[nH+]1 ZINC000893971974 583263919 /nfs/dbraw/zinc/26/39/19/583263919.db2.gz XGVCUSSQDCLYDS-QMMMGPOBSA-N 1 2 211.284 2.371 20 0 BEADLO CC[C@H]1C[N@H+](Cc2[nH]nc(C)c2C)C[C@H](C)O1 ZINC000893976051 583264942 /nfs/dbraw/zinc/26/49/42/583264942.db2.gz LYJGHEBDMDGVSL-CABZTGNLSA-N 1 2 237.347 2.026 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2[nH]nc(C)c2C)C[C@H](C)O1 ZINC000893976051 583264943 /nfs/dbraw/zinc/26/49/43/583264943.db2.gz LYJGHEBDMDGVSL-CABZTGNLSA-N 1 2 237.347 2.026 20 0 BEADLO C[C@@H](F)CCNc1cccc([C@H](C)O)[nH+]1 ZINC000893981881 583265991 /nfs/dbraw/zinc/26/59/91/583265991.db2.gz MNLIJFRVQCZHDI-BDAKNGLRSA-N 1 2 212.268 2.295 20 0 BEADLO C[C@@H](O)c1cccc(NCC[C@H](C)F)[nH+]1 ZINC000893981883 583266287 /nfs/dbraw/zinc/26/62/87/583266287.db2.gz MNLIJFRVQCZHDI-DTWKUNHWSA-N 1 2 212.268 2.295 20 0 BEADLO Cc1ncoc1C[N@@H+]1CCC[C@@H](c2ccn[nH]2)C1 ZINC000893994391 583268005 /nfs/dbraw/zinc/26/80/05/583268005.db2.gz FTIUFHUEEFMALQ-LLVKDONJSA-N 1 2 246.314 2.086 20 0 BEADLO Cc1ncoc1C[N@H+]1CCC[C@@H](c2ccn[nH]2)C1 ZINC000893994391 583268007 /nfs/dbraw/zinc/26/80/07/583268007.db2.gz FTIUFHUEEFMALQ-LLVKDONJSA-N 1 2 246.314 2.086 20 0 BEADLO Cc1ncoc1CN1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000893986717 583269456 /nfs/dbraw/zinc/26/94/56/583269456.db2.gz LPELTNFAUYSFPM-NSHDSACASA-N 1 2 246.314 2.433 20 0 BEADLO C[C@H](O)c1cccc(N2CCC[C@](C)(F)C2)[nH+]1 ZINC000894004849 583271853 /nfs/dbraw/zinc/27/18/53/583271853.db2.gz AYRFFFJRPWZCBJ-GWCFXTLKSA-N 1 2 238.306 2.463 20 0 BEADLO C[C@@H](O)c1cccc(N2CCC[C@@](C)(F)C2)[nH+]1 ZINC000894004852 583272227 /nfs/dbraw/zinc/27/22/27/583272227.db2.gz AYRFFFJRPWZCBJ-ZWNOBZJWSA-N 1 2 238.306 2.463 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CCC(C)(C)C2)c1C ZINC000894021371 583274424 /nfs/dbraw/zinc/27/44/24/583274424.db2.gz WONQHSHNROUJMM-UHFFFAOYSA-N 1 2 207.321 2.258 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CCC(C)(C)C2)c1C ZINC000894021371 583274426 /nfs/dbraw/zinc/27/44/26/583274426.db2.gz WONQHSHNROUJMM-UHFFFAOYSA-N 1 2 207.321 2.258 20 0 BEADLO Cn1cc[nH+]c1[C@H]1N(c2nccs2)CC1(C)C ZINC000894033634 583276938 /nfs/dbraw/zinc/27/69/38/583276938.db2.gz HBWQVACUCLSYAS-SECBINFHSA-N 1 2 248.355 2.464 20 0 BEADLO CC(C)c1c[nH]c(CN(C)Cc2ccon2)[nH+]1 ZINC000894040372 583284287 /nfs/dbraw/zinc/28/42/87/583284287.db2.gz SXQJBTOUSKBWOC-UHFFFAOYSA-N 1 2 234.303 2.153 20 0 BEADLO CCc1cc(NC[C@@H](O)C2CCC2)nc(CC)[nH+]1 ZINC000894119340 583310925 /nfs/dbraw/zinc/31/09/25/583310925.db2.gz NKWJKPWIVCBELY-GFCCVEGCSA-N 1 2 249.358 2.174 20 0 BEADLO CC(C)c1nnc(C[NH+]2CC(C)C2)s1 ZINC000894159616 583320980 /nfs/dbraw/zinc/32/09/80/583320980.db2.gz XHCLGHLJKVRUSK-UHFFFAOYSA-N 1 2 211.334 2.113 20 0 BEADLO CC(C)CCCC[N@H+](CCO)CC(F)F ZINC000894160909 583321294 /nfs/dbraw/zinc/32/12/94/583321294.db2.gz FBGDBBKTYVMICS-UHFFFAOYSA-N 1 2 223.307 2.372 20 0 BEADLO CC(C)CCCC[N@@H+](CCO)CC(F)F ZINC000894160909 583321295 /nfs/dbraw/zinc/32/12/95/583321295.db2.gz FBGDBBKTYVMICS-UHFFFAOYSA-N 1 2 223.307 2.372 20 0 BEADLO CN(C)c1cc(N(C)C2CC(C)(C)C2)nc[nH+]1 ZINC000894168208 583324690 /nfs/dbraw/zinc/32/46/90/583324690.db2.gz VDODRXHHCZHHMB-UHFFFAOYSA-N 1 2 234.347 2.167 20 0 BEADLO CN(C)c1cc(N(C)C2CC(C)(C)C2)[nH+]cn1 ZINC000894168208 583324692 /nfs/dbraw/zinc/32/46/92/583324692.db2.gz VDODRXHHCZHHMB-UHFFFAOYSA-N 1 2 234.347 2.167 20 0 BEADLO C[C@H](O)c1cccc(N[C@H]2CS[C@H](C)C2)[nH+]1 ZINC000894194061 583333451 /nfs/dbraw/zinc/33/34/51/583333451.db2.gz JHGZQVQWHSEPQL-KXUCPTDWSA-N 1 2 238.356 2.441 20 0 BEADLO O[C@@H]1CCC[N@H+](Cc2cc(C(F)(F)F)co2)C1 ZINC000877936427 583354365 /nfs/dbraw/zinc/35/43/65/583354365.db2.gz ZOCZFYMEBGEQFI-SECBINFHSA-N 1 2 249.232 2.255 20 0 BEADLO O[C@@H]1CCC[N@@H+](Cc2cc(C(F)(F)F)co2)C1 ZINC000877936427 583354367 /nfs/dbraw/zinc/35/43/67/583354367.db2.gz ZOCZFYMEBGEQFI-SECBINFHSA-N 1 2 249.232 2.255 20 0 BEADLO CCN(C)c1ccccc1C[NH2+]Cc1c[nH]cn1 ZINC000894233712 583385732 /nfs/dbraw/zinc/38/57/32/583385732.db2.gz LJRFFRNQZBQNRI-UHFFFAOYSA-N 1 2 244.342 2.156 20 0 BEADLO C[N@@H+](Cc1ccc(Cl)s1)CN1CCC1=O ZINC000857229305 588896302 /nfs/dbraw/zinc/89/63/02/588896302.db2.gz OFWIGZFFJNUNPV-UHFFFAOYSA-N 1 2 244.747 2.023 20 0 BEADLO C[N@H+](Cc1ccc(Cl)s1)CN1CCC1=O ZINC000857229305 588896303 /nfs/dbraw/zinc/89/63/03/588896303.db2.gz OFWIGZFFJNUNPV-UHFFFAOYSA-N 1 2 244.747 2.023 20 0 BEADLO COc1cc(C)ccc1C[NH2+]Cc1c[nH]cn1 ZINC000894343865 583429917 /nfs/dbraw/zinc/42/99/17/583429917.db2.gz HPHAFSSLALPTAS-UHFFFAOYSA-N 1 2 231.299 2.017 20 0 BEADLO COc1cc(C)cc(C[NH2+]Cc2c[nH]cn2)c1 ZINC000894356787 583436075 /nfs/dbraw/zinc/43/60/75/583436075.db2.gz NGGHNHOWBQKWTH-UHFFFAOYSA-N 1 2 231.299 2.017 20 0 BEADLO Cc1ncoc1CNc1c[nH+]ccc1C ZINC000894359216 583436797 /nfs/dbraw/zinc/43/67/97/583436797.db2.gz MGDYNILFOGPMLW-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO c1[nH+]cn2ccnc(N3C[C@@H]4CCCC[C@@H]43)c12 ZINC000894440890 583457553 /nfs/dbraw/zinc/45/75/53/583457553.db2.gz NQMIMDWFZIHXDR-QWRGUYRKSA-N 1 2 228.299 2.108 20 0 BEADLO Cc1ncoc1C[N@@H+](C)Cc1ccncc1 ZINC000894450300 583462361 /nfs/dbraw/zinc/46/23/61/583462361.db2.gz YAALVZOFOYYWIK-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ncoc1C[N@H+](C)Cc1ccncc1 ZINC000894450300 583462363 /nfs/dbraw/zinc/46/23/63/583462363.db2.gz YAALVZOFOYYWIK-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO CCc1cc(N[C@@H](CO)C2CCC2)nc(CC)[nH+]1 ZINC000894487347 583472044 /nfs/dbraw/zinc/47/20/44/583472044.db2.gz RIQJHLOOKRJCSO-LBPRGKRZSA-N 1 2 249.358 2.174 20 0 BEADLO CCn1cc(C[NH2+][C@H]2CCCC2(F)F)c(C)n1 ZINC000894513672 583476108 /nfs/dbraw/zinc/47/61/08/583476108.db2.gz MPVFKEWFGNPZEE-NSHDSACASA-N 1 2 243.301 2.489 20 0 BEADLO CC[C@@]1(C)C[N@H+](Cc2[nH]nc(C)c2C)CCO1 ZINC000894535331 583480123 /nfs/dbraw/zinc/48/01/23/583480123.db2.gz ZEBDHXXMZUWNGS-ZDUSSCGKSA-N 1 2 237.347 2.027 20 0 BEADLO CC[C@@]1(C)C[N@@H+](Cc2[nH]nc(C)c2C)CCO1 ZINC000894535331 583480125 /nfs/dbraw/zinc/48/01/25/583480125.db2.gz ZEBDHXXMZUWNGS-ZDUSSCGKSA-N 1 2 237.347 2.027 20 0 BEADLO Cc1noc([C@H](C)NCc2[nH]cc(C(C)C)[nH+]2)n1 ZINC000894542202 583480630 /nfs/dbraw/zinc/48/06/30/583480630.db2.gz HMNCZWIWDTZFML-QMMMGPOBSA-N 1 2 249.318 2.075 20 0 BEADLO FCC[C@H]1CCCN(c2nccn3c[nH+]cc23)C1 ZINC000894567454 583485403 /nfs/dbraw/zinc/48/54/03/583485403.db2.gz UOGOPWBILDOPAS-LLVKDONJSA-N 1 2 248.305 2.305 20 0 BEADLO Cc1nn(C(C)C)cc1CN(C)Cc1[nH]cc[nH+]1 ZINC000894585072 583489312 /nfs/dbraw/zinc/48/93/12/583489312.db2.gz BQMPBKVKANEDNP-UHFFFAOYSA-N 1 2 247.346 2.128 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1nc(C(C)(C)C)co1 ZINC000894613605 583494372 /nfs/dbraw/zinc/49/43/72/583494372.db2.gz ZVWGDOPEHDNWPL-SNVBAGLBSA-N 1 2 238.331 2.193 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1nc(C(C)(C)C)co1 ZINC000894613605 583494375 /nfs/dbraw/zinc/49/43/75/583494375.db2.gz ZVWGDOPEHDNWPL-SNVBAGLBSA-N 1 2 238.331 2.193 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1cc(O)cc(Cl)c1 ZINC000894613052 583494424 /nfs/dbraw/zinc/49/44/24/583494424.db2.gz QUQFOBYUTZVXLC-LLVKDONJSA-N 1 2 241.718 2.266 20 0 BEADLO F[C@H]1CC[N@H+](Cc2cnn(C3CCC3)c2)C1 ZINC000894669915 583502957 /nfs/dbraw/zinc/50/29/57/583502957.db2.gz ALNLWJSTHPOTJH-NSHDSACASA-N 1 2 223.295 2.152 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2cnn(C3CCC3)c2)C1 ZINC000894669915 583502959 /nfs/dbraw/zinc/50/29/59/583502959.db2.gz ALNLWJSTHPOTJH-NSHDSACASA-N 1 2 223.295 2.152 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CCC[C@H](CF)C2)[nH]1 ZINC000880237683 583505759 /nfs/dbraw/zinc/50/57/59/583505759.db2.gz FHPRPSHKVNBCGT-SNVBAGLBSA-N 1 2 240.326 2.110 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CCC[C@H](CF)C2)[nH]1 ZINC000880237683 583505762 /nfs/dbraw/zinc/50/57/62/583505762.db2.gz FHPRPSHKVNBCGT-SNVBAGLBSA-N 1 2 240.326 2.110 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC[C@H](CF)C2)s1 ZINC000880236791 583506139 /nfs/dbraw/zinc/50/61/39/583506139.db2.gz IYBDXTVEXOQVOV-SECBINFHSA-N 1 2 229.324 2.028 20 0 BEADLO Cc1nnc(C[N@H+]2CCC[C@H](CF)C2)s1 ZINC000880236791 583506141 /nfs/dbraw/zinc/50/61/41/583506141.db2.gz IYBDXTVEXOQVOV-SECBINFHSA-N 1 2 229.324 2.028 20 0 BEADLO CCc1nnc(C[N@@H+]2CC[C@@H]2C2CC2)s1 ZINC000894690931 583508817 /nfs/dbraw/zinc/50/88/17/583508817.db2.gz UKDINESOUFWNNF-SECBINFHSA-N 1 2 223.345 2.085 20 0 BEADLO CCc1nnc(C[N@H+]2CC[C@@H]2C2CC2)s1 ZINC000894690931 583508818 /nfs/dbraw/zinc/50/88/18/583508818.db2.gz UKDINESOUFWNNF-SECBINFHSA-N 1 2 223.345 2.085 20 0 BEADLO CCn1cc(C[NH+]2CC(C(F)(F)F)C2)c(C)n1 ZINC000894711857 583510593 /nfs/dbraw/zinc/51/05/93/583510593.db2.gz MDPDLOLDYOGMQA-UHFFFAOYSA-N 1 2 247.264 2.206 20 0 BEADLO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1cnc[nH]1 ZINC000894786378 583521826 /nfs/dbraw/zinc/52/18/26/583521826.db2.gz HDOREMZZZKJRDR-TVQRCGJNSA-N 1 2 229.283 2.022 20 0 BEADLO FC(F)C1C[NH+](Cc2ccnn2C2CCC2)C1 ZINC000894828965 583527137 /nfs/dbraw/zinc/52/71/37/583527137.db2.gz VSVRWLJXEPDDEQ-UHFFFAOYSA-N 1 2 241.285 2.305 20 0 BEADLO CC1(O)C[NH+](Cc2ccc(C(F)F)c(F)c2)C1 ZINC000894831660 583527716 /nfs/dbraw/zinc/52/77/16/583527716.db2.gz YKJYZQAEVVHSHK-UHFFFAOYSA-N 1 2 245.244 2.330 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1ocnc1C ZINC000894844424 583530633 /nfs/dbraw/zinc/53/06/33/583530633.db2.gz PQMXSWQMOLAVLU-UHFFFAOYSA-N 1 2 206.245 2.174 20 0 BEADLO C[C@@H]1C[N@H+](Cc2c(C(F)(F)F)cnn2C)[C@H]1C ZINC000894861467 583535919 /nfs/dbraw/zinc/53/59/19/583535919.db2.gz HTEMXIBJXXMUSE-SFYZADRCSA-N 1 2 247.264 2.279 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2c(C(F)(F)F)cnn2C)[C@H]1C ZINC000894861467 583535920 /nfs/dbraw/zinc/53/59/20/583535920.db2.gz HTEMXIBJXXMUSE-SFYZADRCSA-N 1 2 247.264 2.279 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2CCC[C@](C)(F)C2)c1C ZINC000894869003 583538804 /nfs/dbraw/zinc/53/88/04/583538804.db2.gz LDQLGIWRFHEPOI-LBPRGKRZSA-N 1 2 225.311 2.351 20 0 BEADLO Cc1n[nH]c(C[N@H+]2CCC[C@](C)(F)C2)c1C ZINC000894869003 583538805 /nfs/dbraw/zinc/53/88/05/583538805.db2.gz LDQLGIWRFHEPOI-LBPRGKRZSA-N 1 2 225.311 2.351 20 0 BEADLO CCNc1cc(CNc2nccc(C)n2)cc[nH+]1 ZINC000894869575 583539221 /nfs/dbraw/zinc/53/92/21/583539221.db2.gz CAUAYEWTJQUHAB-UHFFFAOYSA-N 1 2 243.314 2.224 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CC[C@H]2C2CC2)c1C ZINC000894880025 583543378 /nfs/dbraw/zinc/54/33/78/583543378.db2.gz ASSQIYZHGQKFAJ-LBPRGKRZSA-N 1 2 205.305 2.011 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CC[C@H]2C2CC2)c1C ZINC000894880025 583543380 /nfs/dbraw/zinc/54/33/80/583543380.db2.gz ASSQIYZHGQKFAJ-LBPRGKRZSA-N 1 2 205.305 2.011 20 0 BEADLO CCn1ccc(C[NH2+]Cc2cnc(F)c(C)c2)n1 ZINC000894894745 583549805 /nfs/dbraw/zinc/54/98/05/583549805.db2.gz PEOJCDHAQBYBER-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO CNc1cc(N[C@H](C)c2cnc(C)s2)nc[nH+]1 ZINC000894923751 583556546 /nfs/dbraw/zinc/55/65/46/583556546.db2.gz LQACLBGOHCSQNM-SSDOTTSWSA-N 1 2 249.343 2.456 20 0 BEADLO CNc1cc(N[C@H](C)c2cnc(C)s2)[nH+]cn1 ZINC000894923751 583556548 /nfs/dbraw/zinc/55/65/48/583556548.db2.gz LQACLBGOHCSQNM-SSDOTTSWSA-N 1 2 249.343 2.456 20 0 BEADLO Cc1nnc(C[NH2+]Cc2cc(C)nc(C)c2)s1 ZINC000894967243 583560087 /nfs/dbraw/zinc/56/00/87/583560087.db2.gz ZMFDUDOHJJLVNU-UHFFFAOYSA-N 1 2 248.355 2.148 20 0 BEADLO Cc1cccc(C[NH2+][C@H]2CCCc3cn[nH]c32)n1 ZINC000857847891 588912612 /nfs/dbraw/zinc/91/26/12/588912612.db2.gz BHMJGIZKSXXTEX-ZDUSSCGKSA-N 1 2 242.326 2.280 20 0 BEADLO Cc1cccc(C[NH2+][C@H]2CCCc3c[nH]nc32)n1 ZINC000857847891 588912614 /nfs/dbraw/zinc/91/26/14/588912614.db2.gz BHMJGIZKSXXTEX-ZDUSSCGKSA-N 1 2 242.326 2.280 20 0 BEADLO C[C@H]1CC/C(=C\C(=O)OCCc2c[nH+]cn2C)C1 ZINC000793237899 583578868 /nfs/dbraw/zinc/57/88/68/583578868.db2.gz LEOZEJNOYDHNKH-SERMCNLOSA-N 1 2 248.326 2.252 20 0 BEADLO CC[C@H]1CC[N@@H+]1Cn1nc2ccccn2c1=S ZINC000793820394 583590966 /nfs/dbraw/zinc/59/09/66/583590966.db2.gz KWEHRFPRUYEHFS-JTQLQIEISA-N 1 2 248.355 2.307 20 0 BEADLO CC[C@H]1CC[N@H+]1Cn1nc2ccccn2c1=S ZINC000793820394 583590968 /nfs/dbraw/zinc/59/09/68/583590968.db2.gz KWEHRFPRUYEHFS-JTQLQIEISA-N 1 2 248.355 2.307 20 0 BEADLO CCc1cc[nH+]cc1N[C@@H]1CC[C@H](C(=O)OC)C1 ZINC000895142955 583603607 /nfs/dbraw/zinc/60/36/07/583603607.db2.gz YKRHEPKMCBKCTG-NWDGAFQWSA-N 1 2 248.326 2.398 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+]2C[C@H]3[C@@H](C2)C3(F)F)n1 ZINC000895149584 583605829 /nfs/dbraw/zinc/60/58/29/583605829.db2.gz LSSOOAGMQMTUCG-DTORHVGOSA-N 1 2 241.285 2.230 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)n1 ZINC000895149584 583605832 /nfs/dbraw/zinc/60/58/32/583605832.db2.gz LSSOOAGMQMTUCG-DTORHVGOSA-N 1 2 241.285 2.230 20 0 BEADLO COCc1cc[nH+]c(N[C@H]2COCC2(C)C)c1 ZINC000895150252 583606324 /nfs/dbraw/zinc/60/63/24/583606324.db2.gz IYINUVRJGPVSGG-NSHDSACASA-N 1 2 236.315 2.065 20 0 BEADLO Cc1[nH]c([C@@H]2CCCN2c2cnccn2)[nH+]c1C ZINC000895197769 583623658 /nfs/dbraw/zinc/62/36/58/583623658.db2.gz VELPYQTZDNNEIV-NSHDSACASA-N 1 2 243.314 2.158 20 0 BEADLO CC1=NO[C@H](C[NH2+]Cc2nc(Cl)cs2)C1 ZINC000895300211 583641825 /nfs/dbraw/zinc/64/18/25/583641825.db2.gz KCBHYNZLLBMRET-ZETCQYMHSA-N 1 2 245.735 2.051 20 0 BEADLO CC(C)(C)OC(=O)CC[N@@H+]1Cc2ccncc2C1 ZINC000857875440 588918187 /nfs/dbraw/zinc/91/81/87/588918187.db2.gz OMQNOSJUZDBPCA-UHFFFAOYSA-N 1 2 248.326 2.129 20 0 BEADLO CC(C)(C)OC(=O)CC[N@H+]1Cc2ccncc2C1 ZINC000857875440 588918188 /nfs/dbraw/zinc/91/81/88/588918188.db2.gz OMQNOSJUZDBPCA-UHFFFAOYSA-N 1 2 248.326 2.129 20 0 BEADLO CCOc1ccc(C[N@H+](CCF)CCOC)o1 ZINC000895355123 583657329 /nfs/dbraw/zinc/65/73/29/583657329.db2.gz IGPKJOSDQSVLRJ-UHFFFAOYSA-N 1 2 245.294 2.096 20 0 BEADLO CCOc1ccc(C[N@@H+](CCF)CCOC)o1 ZINC000895355123 583657330 /nfs/dbraw/zinc/65/73/30/583657330.db2.gz IGPKJOSDQSVLRJ-UHFFFAOYSA-N 1 2 245.294 2.096 20 0 BEADLO CC(C)CC[C@@H](O)C[N@@H+]1Cc2ccncc2C1 ZINC000857879527 588919364 /nfs/dbraw/zinc/91/93/64/588919364.db2.gz HMDTZDNBHDWMNI-CQSZACIVSA-N 1 2 234.343 2.194 20 0 BEADLO CC(C)CC[C@@H](O)C[N@H+]1Cc2ccncc2C1 ZINC000857879527 588919365 /nfs/dbraw/zinc/91/93/65/588919365.db2.gz HMDTZDNBHDWMNI-CQSZACIVSA-N 1 2 234.343 2.194 20 0 BEADLO C[C@@H]1C[C@@H]1C(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000727496318 583661386 /nfs/dbraw/zinc/66/13/86/583661386.db2.gz MWMFPWSNFLFXFD-WOPDTQHZSA-N 1 2 249.358 2.070 20 0 BEADLO Cc1n[nH]c(Cn2c[nH+]c3c2CCCC3)c1C ZINC000895389880 583664099 /nfs/dbraw/zinc/66/40/99/583664099.db2.gz RHABNMKIYNEYLT-UHFFFAOYSA-N 1 2 230.315 2.150 20 0 BEADLO Cc1ncoc1C[NH2+][C@@H](C)c1ccns1 ZINC000895411370 583666721 /nfs/dbraw/zinc/66/67/21/583666721.db2.gz OIXLTHUSEQVWAX-QMMMGPOBSA-N 1 2 223.301 2.290 20 0 BEADLO CCCCCNC(=O)C(C)(C)n1c[nH+]c(C)c1 ZINC000895431047 583670019 /nfs/dbraw/zinc/67/00/19/583670019.db2.gz KYNQIVDQZVZPIW-UHFFFAOYSA-N 1 2 237.347 2.233 20 0 BEADLO CO[C@](C)(C[N@@H+]1CC[C@H]1C(F)F)C1CC1 ZINC000895432055 583670902 /nfs/dbraw/zinc/67/09/02/583670902.db2.gz UATMGBUZMNSZSA-GXSJLCMTSA-N 1 2 219.275 2.141 20 0 BEADLO CO[C@](C)(C[N@H+]1CC[C@H]1C(F)F)C1CC1 ZINC000895432055 583670903 /nfs/dbraw/zinc/67/09/03/583670903.db2.gz UATMGBUZMNSZSA-GXSJLCMTSA-N 1 2 219.275 2.141 20 0 BEADLO C[C@@H]1C[C@H](C[N@@H+]2CC[C@@H]2C(F)F)CCO1 ZINC000895432795 583671238 /nfs/dbraw/zinc/67/12/38/583671238.db2.gz PXPOPNLHHHVGFE-OPRDCNLKSA-N 1 2 219.275 2.141 20 0 BEADLO C[C@@H]1C[C@H](C[N@H+]2CC[C@@H]2C(F)F)CCO1 ZINC000895432795 583671241 /nfs/dbraw/zinc/67/12/41/583671241.db2.gz PXPOPNLHHHVGFE-OPRDCNLKSA-N 1 2 219.275 2.141 20 0 BEADLO Cc1n[nH]c(C[N@H+](C)Cc2ccns2)c1C ZINC000895452368 583676296 /nfs/dbraw/zinc/67/62/96/583676296.db2.gz VLZDJOSYUOUUCS-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1n[nH]c(C[N@@H+](C)Cc2ccns2)c1C ZINC000895452368 583676297 /nfs/dbraw/zinc/67/62/97/583676297.db2.gz VLZDJOSYUOUUCS-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO c1[nH]c(CNc2cccc3c2OCCCO3)c[nH+]1 ZINC000895467436 583678882 /nfs/dbraw/zinc/67/88/82/583678882.db2.gz NBWLYDOCTUABMU-UHFFFAOYSA-N 1 2 245.282 2.183 20 0 BEADLO c1[nH]cc(CNc2cccc3c2OCCCO3)[nH+]1 ZINC000895467436 583678883 /nfs/dbraw/zinc/67/88/83/583678883.db2.gz NBWLYDOCTUABMU-UHFFFAOYSA-N 1 2 245.282 2.183 20 0 BEADLO C[N@H+](CC1=CCSC1)Cc1nccn1C1CC1 ZINC000895466515 583679084 /nfs/dbraw/zinc/67/90/84/583679084.db2.gz VVERLOMSOYZLGY-UHFFFAOYSA-N 1 2 249.383 2.323 20 0 BEADLO C[N@@H+](CC1=CCSC1)Cc1nccn1C1CC1 ZINC000895466515 583679086 /nfs/dbraw/zinc/67/90/86/583679086.db2.gz VVERLOMSOYZLGY-UHFFFAOYSA-N 1 2 249.383 2.323 20 0 BEADLO COc1cnc(F)c(C[NH+]2CCC(F)CC2)c1 ZINC000895546855 583689833 /nfs/dbraw/zinc/68/98/33/583689833.db2.gz WFJFDXCGTNTCEZ-UHFFFAOYSA-N 1 2 242.269 2.163 20 0 BEADLO FC(F)C[NH2+]C[C@H]1CC1(Cl)Cl ZINC000147702946 583699955 /nfs/dbraw/zinc/69/99/55/583699955.db2.gz SEXVFCRKGGFHJD-SCSAIBSYSA-N 1 2 204.047 2.035 20 0 BEADLO COC[C@H](C)CNc1c[nH+]c(C)c(C)c1 ZINC000895645150 583700657 /nfs/dbraw/zinc/70/06/57/583700657.db2.gz NNJRMEOMTSGQBG-SECBINFHSA-N 1 2 208.305 2.393 20 0 BEADLO CCc1cc(N2CCO[C@H](C)CC2)nc(CC)[nH+]1 ZINC000895766779 583719389 /nfs/dbraw/zinc/71/93/89/583719389.db2.gz XZGFCPSMTJIKDO-LLVKDONJSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@H]1CCN(c2cc[nH+]c3ccncc32)CCO1 ZINC000895761352 583721908 /nfs/dbraw/zinc/72/19/08/583721908.db2.gz XPJSWSOMLIQPNX-NSHDSACASA-N 1 2 243.310 2.245 20 0 BEADLO CCC/C(C)=C\C(=O)N[C@@H]1CCn2c[nH+]cc2C1 ZINC000857952387 588924740 /nfs/dbraw/zinc/92/47/40/588924740.db2.gz SFRKQPMRDTVMEA-SEVUFMINSA-N 1 2 247.342 2.061 20 0 BEADLO Cc1ccc([C@H](C)C[NH2+][C@H]2CCOC2=O)cc1 ZINC000895808937 583729282 /nfs/dbraw/zinc/72/92/82/583729282.db2.gz XAXZESKYVLMMHR-YPMHNXCESA-N 1 2 233.311 2.004 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCOC1=O)[C@H](C)c1ccccc1 ZINC000895803372 583731430 /nfs/dbraw/zinc/73/14/30/583731430.db2.gz BLBCZHDKRBIHSU-LOWVWBTDSA-N 1 2 233.311 2.084 20 0 BEADLO CCC[C@H](C[NH2+][C@H]1CCOC1=O)c1ccccc1 ZINC000895804609 583732141 /nfs/dbraw/zinc/73/21/41/583732141.db2.gz LORVPSCUZULBQN-KGLIPLIRSA-N 1 2 247.338 2.475 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+](C)CCCF)n1 ZINC000895895613 583742727 /nfs/dbraw/zinc/74/27/27/583742727.db2.gz AWYRHTLAGINGGN-UHFFFAOYSA-N 1 2 213.300 2.325 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+](C)CCCF)n1 ZINC000895895613 583742728 /nfs/dbraw/zinc/74/27/28/583742728.db2.gz AWYRHTLAGINGGN-UHFFFAOYSA-N 1 2 213.300 2.325 20 0 BEADLO Cc1cc(N[C@@H]2COC[C@H]2C)nc(C2CC2)[nH+]1 ZINC000895905272 583742585 /nfs/dbraw/zinc/74/25/85/583742585.db2.gz KLADSHTWUNAPEF-LDYMZIIASA-N 1 2 233.315 2.109 20 0 BEADLO CC(C)c1nc(N[C@H]2COC[C@H]2C)cc[nH+]1 ZINC000895905061 583742599 /nfs/dbraw/zinc/74/25/99/583742599.db2.gz HOHGRGPPMXXOQC-ZJUUUORDSA-N 1 2 221.304 2.047 20 0 BEADLO Cc1cc(N[C@H]2COC[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000895905270 583743082 /nfs/dbraw/zinc/74/30/82/583743082.db2.gz KLADSHTWUNAPEF-KWQFWETISA-N 1 2 233.315 2.109 20 0 BEADLO Cc1nc(N[C@@H]2COC[C@H]2C)c2c([nH+]1)CCCC2 ZINC000895908665 583745331 /nfs/dbraw/zinc/74/53/31/583745331.db2.gz JNMLPNAZGROAHL-NOZJJQNGSA-N 1 2 247.342 2.111 20 0 BEADLO C[C@H](C(=O)N[C@H]1CCn2c[nH+]cc21)C(C)(C)C ZINC000857987648 588926286 /nfs/dbraw/zinc/92/62/86/588926286.db2.gz XMUJXGBCECTMPC-ZJUUUORDSA-N 1 2 235.331 2.126 20 0 BEADLO CC(C)OC1C[NH+](Cc2cccc(O)c2)C1 ZINC000895952241 583751356 /nfs/dbraw/zinc/75/13/56/583751356.db2.gz KYXBMXMLSPBSOB-UHFFFAOYSA-N 1 2 221.300 2.001 20 0 BEADLO CC(C)OC1C[NH+](Cc2cccc3c2OCC3)C1 ZINC000895956358 583752648 /nfs/dbraw/zinc/75/26/48/583752648.db2.gz KUAIGXFUVBXSRJ-UHFFFAOYSA-N 1 2 247.338 2.231 20 0 BEADLO CC(C)OC1C[NH+](Cc2cc3cccnc3o2)C1 ZINC000895955045 583752786 /nfs/dbraw/zinc/75/27/86/583752786.db2.gz MTAYRSBMMHLGDZ-UHFFFAOYSA-N 1 2 246.310 2.437 20 0 BEADLO CC[C@H](C)CCC(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857977151 588926741 /nfs/dbraw/zinc/92/67/41/588926741.db2.gz AUVDIKKSXUEGFC-QWRGUYRKSA-N 1 2 235.331 2.270 20 0 BEADLO COCC1C[NH+](Cc2cc(F)ccc2F)C1 ZINC000895971301 583756015 /nfs/dbraw/zinc/75/60/15/583756015.db2.gz LPLNEOGDTBTNBZ-UHFFFAOYSA-N 1 2 227.254 2.043 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857978879 588927278 /nfs/dbraw/zinc/92/72/78/588927278.db2.gz RKLJAGGUYYTGPL-GRYCIOLGSA-N 1 2 247.342 2.270 20 0 BEADLO COc1ccc(C[NH2+]Cc2cc(C3CC3)no2)o1 ZINC000896044503 583765416 /nfs/dbraw/zinc/76/54/16/583765416.db2.gz ATOOGPHQZITKMT-UHFFFAOYSA-N 1 2 248.282 2.443 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)C(F)F)cnc1F ZINC000896038102 583766320 /nfs/dbraw/zinc/76/63/20/583766320.db2.gz KYTWXFFOKMPXHM-SSDOTTSWSA-N 1 2 218.222 2.272 20 0 BEADLO C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857979604 588927638 /nfs/dbraw/zinc/92/76/38/588927638.db2.gz WUJOAFJXPGMBMB-UHIISALHSA-N 1 2 247.342 2.270 20 0 BEADLO O=C(N[C@@H]1CCn2c[nH+]cc21)[C@@H]1CC12CCCC2 ZINC000857982421 588927937 /nfs/dbraw/zinc/92/79/37/588927937.db2.gz INJRNABTEHGKHY-WDEREUQCSA-N 1 2 245.326 2.024 20 0 BEADLO C[C@@H](C(=O)N[C@@H]1CCn2c[nH+]cc21)C1CCCC1 ZINC000857982026 588927951 /nfs/dbraw/zinc/92/79/51/588927951.db2.gz DJESFHPQWTXCKV-ZYHUDNBSSA-N 1 2 247.342 2.270 20 0 BEADLO OCc1cc[nH+]c(NCCC2CC=CC2)c1 ZINC000896094456 583771809 /nfs/dbraw/zinc/77/18/09/583771809.db2.gz MRTAJWLUXPTBIJ-UHFFFAOYSA-N 1 2 218.300 2.342 20 0 BEADLO C[C@H](c1noc(C2([NH+](C)C)CC2)n1)C1CC1 ZINC000896148034 583776036 /nfs/dbraw/zinc/77/60/36/583776036.db2.gz FACCJLCYCGOFNM-QMMMGPOBSA-N 1 2 221.304 2.134 20 0 BEADLO O=C(C=C1CCCCC1)N[C@@H]1CCn2c[nH+]cc21 ZINC000857983173 588928526 /nfs/dbraw/zinc/92/85/26/588928526.db2.gz PKQRPGADXMIQGT-GFCCVEGCSA-N 1 2 245.326 2.335 20 0 BEADLO CCC(C)(C)CC(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857983813 588928601 /nfs/dbraw/zinc/92/86/01/588928601.db2.gz VRNBJXFHFWMWFR-JTQLQIEISA-N 1 2 235.331 2.270 20 0 BEADLO C[C@@H]1CCC[C@H](C(=O)N[C@@H]2CCn3c[nH+]cc32)C1 ZINC000857985595 588929136 /nfs/dbraw/zinc/92/91/36/588929136.db2.gz IPMHAXVIHCRGSS-GRYCIOLGSA-N 1 2 247.342 2.270 20 0 BEADLO CNc1cc(N[C@H]2CCS[C@H](C)C2)[nH+]cn1 ZINC000896245974 583784998 /nfs/dbraw/zinc/78/49/98/583784998.db2.gz KBYJYEWWKWFZBV-BDAKNGLRSA-N 1 2 238.360 2.214 20 0 BEADLO C/C=C(/C=C/C(=O)N[C@H]1CCn2c[nH+]cc21)CC ZINC000857987629 588929314 /nfs/dbraw/zinc/92/93/14/588929314.db2.gz XDJLMNLFBHJOAT-XEZOKDOFSA-N 1 2 245.326 2.357 20 0 BEADLO CC(C)(C)/C=C\C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857985964 588929485 /nfs/dbraw/zinc/92/94/85/588929485.db2.gz MTNHCXTVHRXTMY-OAQKJQOQSA-N 1 2 233.315 2.046 20 0 BEADLO Cc1ccsc1C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857990048 588929667 /nfs/dbraw/zinc/92/96/67/588929667.db2.gz MDVWNDCLSZSEOE-SECBINFHSA-N 1 2 247.323 2.128 20 0 BEADLO Cc1ccccc1C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857989731 588929806 /nfs/dbraw/zinc/92/98/06/588929806.db2.gz JVSIWEHIZOQDPQ-LBPRGKRZSA-N 1 2 241.294 2.066 20 0 BEADLO CCO[C@H]1CCN(c2nc(C)[nH+]c(C)c2C)C1 ZINC000896406922 583800685 /nfs/dbraw/zinc/80/06/85/583800685.db2.gz MNROJHHCAXETOK-LBPRGKRZSA-N 1 2 235.331 2.017 20 0 BEADLO C/C=C(\C)C(=O)N1CCNc2[nH+]cc(C)cc21 ZINC000857997913 588930525 /nfs/dbraw/zinc/93/05/25/588930525.db2.gz XJKWOGOIRVZQKW-ONNFQVAWSA-N 1 2 231.299 2.115 20 0 BEADLO CC(C)n1ccc(C[NH2+]Cc2ccnc(F)c2)n1 ZINC000858141406 588934768 /nfs/dbraw/zinc/93/47/68/588934768.db2.gz NURFZCWWJSDUCC-UHFFFAOYSA-N 1 2 248.305 2.288 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N2CCC(C)(C)C2)c[nH+]1 ZINC000896738597 583829294 /nfs/dbraw/zinc/82/92/94/583829294.db2.gz RGZDODNOUINRML-UHFFFAOYSA-N 1 2 249.358 2.185 20 0 BEADLO Cc1[nH+]cnc(NCC[C@@H]2CCCC[C@@H]2O)c1C ZINC000896812710 583836245 /nfs/dbraw/zinc/83/62/45/583836245.db2.gz MMRLIMNZGLEOBY-STQMWFEESA-N 1 2 249.358 2.447 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N2CC[C@H](C)[C@H]2C)c[nH+]1 ZINC000896837466 583838959 /nfs/dbraw/zinc/83/89/59/583838959.db2.gz DTAAZFNIBIEVRI-CMPLNLGQSA-N 1 2 249.358 2.184 20 0 BEADLO CCC(C)(C)C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000896921598 583857069 /nfs/dbraw/zinc/85/70/69/583857069.db2.gz PBQHQFYJMTVNJS-UHFFFAOYSA-N 1 2 223.320 2.079 20 0 BEADLO C[C@H](c1ccco1)c1noc(C2([NH+](C)C)CC2)n1 ZINC000896927108 583858374 /nfs/dbraw/zinc/85/83/74/583858374.db2.gz KCIZFPUHXBGWLH-SECBINFHSA-N 1 2 247.298 2.365 20 0 BEADLO CC(C)(C)c1nc(N[C@@H]2CCC[C@@H]2CO)cc[nH+]1 ZINC000896961531 583865342 /nfs/dbraw/zinc/86/53/42/583865342.db2.gz BRBDFOFIIVJWNZ-GHMZBOCLSA-N 1 2 249.358 2.347 20 0 BEADLO COC(=O)[C@H]1C[C@@H]2C[C@H](Nc3cccc[nH+]3)[C@@H]2C1 ZINC000897011914 583869727 /nfs/dbraw/zinc/86/97/27/583869727.db2.gz XSBKSWBCUCPDFI-KXNHARMFSA-N 1 2 246.310 2.081 20 0 BEADLO CCc1cc(NC2CC3(C2)CO[C@H](C)C3)nc[nH+]1 ZINC000897045459 583872960 /nfs/dbraw/zinc/87/29/60/583872960.db2.gz NKQYBIHHFPGXJH-PWQPVHBWSA-N 1 2 247.342 2.409 20 0 BEADLO CC(C)(C)c1nc(N[C@H]2CC23CC(O)C3)cc[nH+]1 ZINC000897090950 583879125 /nfs/dbraw/zinc/87/91/25/583879125.db2.gz BFRVLCFLWDNSKG-XIRUVYRFSA-N 1 2 247.342 2.099 20 0 BEADLO Cc1csc(C[NH2+]Cc2ccnc(F)c2)n1 ZINC000858092925 588932502 /nfs/dbraw/zinc/93/25/02/588932502.db2.gz NNUJTIHFZVHOBZ-UHFFFAOYSA-N 1 2 237.303 2.275 20 0 BEADLO CCc1cc(N(C)[C@H]2CC[C@@H]2OC)nc(CC)[nH+]1 ZINC000897139966 583884368 /nfs/dbraw/zinc/88/43/68/583884368.db2.gz LSGRGJMHBQNUMI-RYUDHWBXSA-N 1 2 249.358 2.215 20 0 BEADLO CO[C@H]1CC[C@@H]1N(C)c1cc[nH+]c2ccncc21 ZINC000897148060 583884556 /nfs/dbraw/zinc/88/45/56/583884556.db2.gz UNVNJZGTACYORD-KBPBESRZSA-N 1 2 243.310 2.243 20 0 BEADLO CO[C@@H]1CC[C@@H]1N(C)c1nc(C)[nH+]c(C)c1C ZINC000897146848 583885473 /nfs/dbraw/zinc/88/54/73/583885473.db2.gz CCRNIPDHUDEWDL-NWDGAFQWSA-N 1 2 235.331 2.015 20 0 BEADLO CO[C@H]1CC[C@H]1N(C)c1nc(C)[nH+]c(C)c1C ZINC000897146847 583885512 /nfs/dbraw/zinc/88/55/12/583885512.db2.gz CCRNIPDHUDEWDL-NEPJUHHUSA-N 1 2 235.331 2.015 20 0 BEADLO CO[C@H]1CC[C@@H]1N(C)c1[nH+]c2ccccc2n1C ZINC000897147605 583885945 /nfs/dbraw/zinc/88/59/45/583885945.db2.gz OHWGFJQIIKASCD-STQMWFEESA-N 1 2 245.326 2.187 20 0 BEADLO CO[C@@H]1CC[C@H]1N(C)c1[nH+]c2ccccc2n1C ZINC000897147602 583886275 /nfs/dbraw/zinc/88/62/75/583886275.db2.gz OHWGFJQIIKASCD-CHWSQXEVSA-N 1 2 245.326 2.187 20 0 BEADLO Cc1nc(N[C@@H]2C[C@H]3CCC[C@@H]32)cc[nH+]1 ZINC000897178346 583891223 /nfs/dbraw/zinc/89/12/23/583891223.db2.gz AWNAJTPVAQSGIE-OUAUKWLOSA-N 1 2 203.289 2.386 20 0 BEADLO Cc1nc(N[C@@H]2C[C@H]3CCC[C@H]32)cc[nH+]1 ZINC000897178344 583891360 /nfs/dbraw/zinc/89/13/60/583891360.db2.gz AWNAJTPVAQSGIE-GMTAPVOTSA-N 1 2 203.289 2.386 20 0 BEADLO CCc1cc(N[C@@H](C)Cc2cccnc2)nc[nH+]1 ZINC000897195018 583893566 /nfs/dbraw/zinc/89/35/66/583893566.db2.gz GIYIUWWQOZGMKR-NSHDSACASA-N 1 2 242.326 2.477 20 0 BEADLO C[C@@H](Cc1cccnc1)Nc1cc(CO)cc[nH+]1 ZINC000897194394 583893582 /nfs/dbraw/zinc/89/35/82/583893582.db2.gz DPVZVXDMDLQSLT-NSHDSACASA-N 1 2 243.310 2.012 20 0 BEADLO CCc1nc(N[C@H](C)Cc2cccnc2)cc[nH+]1 ZINC000897194719 583893626 /nfs/dbraw/zinc/89/36/26/583893626.db2.gz FTPPGPKLUBEKCQ-LLVKDONJSA-N 1 2 242.326 2.477 20 0 BEADLO C/C=C/C=C/C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000728542132 583896564 /nfs/dbraw/zinc/89/65/64/583896564.db2.gz MGLNFJFGSOBAGS-YUQOPSFVSA-N 1 2 245.326 2.179 20 0 BEADLO CCc1nc(N2C[C@@H]3CCC[C@@H]3C2)cc[nH+]1 ZINC000897295985 583911179 /nfs/dbraw/zinc/91/11/79/583911179.db2.gz USTMMNTXXWBCIS-PHIMTYICSA-N 1 2 217.316 2.275 20 0 BEADLO Cc1[nH+]cnc(N2C[C@@H]3CCC[C@@H]3C2)c1C ZINC000897296073 583911375 /nfs/dbraw/zinc/91/13/75/583911375.db2.gz ZJXHECIAZJSBLP-TXEJJXNPSA-N 1 2 217.316 2.330 20 0 BEADLO CCc1nc(N2CC(Cc3ccoc3)C2)cc[nH+]1 ZINC000897348815 583928604 /nfs/dbraw/zinc/92/86/04/583928604.db2.gz MUXFKRUUULDELU-UHFFFAOYSA-N 1 2 243.310 2.311 20 0 BEADLO C=C=CCNC(=O)Nc1c(C)cc[nH+]c1C ZINC000888130950 583968718 /nfs/dbraw/zinc/96/87/18/583968718.db2.gz GQORGPALGOMSAW-UHFFFAOYSA-N 1 2 217.272 2.161 20 0 BEADLO COc1ccc[nH+]c1N(C)Cc1c(C)noc1C ZINC000858343724 588947760 /nfs/dbraw/zinc/94/77/60/588947760.db2.gz BRMYQPZCDOBZRP-UHFFFAOYSA-N 1 2 247.298 2.331 20 0 BEADLO CC(C)Cc1cc(N[C@@H](C)C[C@H](C)O)nc[nH+]1 ZINC000865669700 584025733 /nfs/dbraw/zinc/02/57/33/584025733.db2.gz JBJJGCGFBWKSPG-QWRGUYRKSA-N 1 2 237.347 2.246 20 0 BEADLO CCc1nc(OC)ccc1NCc1[nH]cc(C)[nH+]1 ZINC000897711826 584042538 /nfs/dbraw/zinc/04/25/38/584042538.db2.gz SVGFOAXLLISCFG-UHFFFAOYSA-N 1 2 246.314 2.296 20 0 BEADLO CC/C=C\CNC(=O)C(C)(C)n1c[nH+]c(C)c1 ZINC000897893305 584057916 /nfs/dbraw/zinc/05/79/16/584057916.db2.gz XOZBBNCRIWMMHB-SREVYHEPSA-N 1 2 235.331 2.009 20 0 BEADLO Cc1[nH]ncc1C[NH2+]C[C@H]1CCCC(C)(C)O1 ZINC000898049573 584073653 /nfs/dbraw/zinc/07/36/53/584073653.db2.gz JGHSYLITYUCHLA-GFCCVEGCSA-N 1 2 237.347 2.155 20 0 BEADLO COC(=O)[C@@H]([NH2+][C@@H]1CC[C@@H]1C)c1ccccc1 ZINC000898336591 584111595 /nfs/dbraw/zinc/11/15/95/584111595.db2.gz UJHICBNIEKQRAU-UHTWSYAYSA-N 1 2 233.311 2.289 20 0 BEADLO CC1(C)C(C)(C)C1(C)[NH2+]Cc1ccn[nH]1 ZINC000898414647 584131444 /nfs/dbraw/zinc/13/14/44/584131444.db2.gz SGMWQQKUHJUTIE-UHFFFAOYSA-N 1 2 207.321 2.324 20 0 BEADLO CCC[C@@H](CC)C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000898809545 584160213 /nfs/dbraw/zinc/16/02/13/584160213.db2.gz ATOGLDYMLJYQQM-MNOVXSKESA-N 1 2 235.331 2.270 20 0 BEADLO CCC(CC)C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000898899838 584165129 /nfs/dbraw/zinc/16/51/29/584165129.db2.gz SDWUXPFQYRROJK-UHFFFAOYSA-N 1 2 237.347 2.171 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ccns1)c1ncc[nH]1 ZINC000858578034 588968147 /nfs/dbraw/zinc/96/81/47/588968147.db2.gz XAIPXHUJKMYHBB-HTQZYQBOSA-N 1 2 222.317 2.278 20 0 BEADLO Clc1csc(N2CCn3c[nH+]cc3C2)n1 ZINC000858550291 588964742 /nfs/dbraw/zinc/96/47/42/588964742.db2.gz LLQSEYUBSFZNAW-UHFFFAOYSA-N 1 2 240.719 2.013 20 0 BEADLO CCn1c[nH+]c(/C=C(/C)c2ncccn2)c1 ZINC000899378901 584209540 /nfs/dbraw/zinc/20/95/40/584209540.db2.gz UPVGDFQESIYRCR-YFHOEESVSA-N 1 2 214.272 2.254 20 0 BEADLO CC(C)CCC[C@H](C)NC(=O)Cc1c[nH]c[nH+]1 ZINC000900096527 584273413 /nfs/dbraw/zinc/27/34/13/584273413.db2.gz GUGXNOLKICSODJ-NSHDSACASA-N 1 2 237.347 2.283 20 0 BEADLO CC(C)CCC[C@H](C)NC(=O)Cc1c[nH+]c[nH]1 ZINC000900096527 584273414 /nfs/dbraw/zinc/27/34/14/584273414.db2.gz GUGXNOLKICSODJ-NSHDSACASA-N 1 2 237.347 2.283 20 0 BEADLO CC[C@H]1CCCN(C(=O)CNc2cccc[nH+]2)C1 ZINC000900181110 584282981 /nfs/dbraw/zinc/28/29/81/584282981.db2.gz YWNIOJHTDDUMHJ-LBPRGKRZSA-N 1 2 247.342 2.142 20 0 BEADLO CC[C@H]1CCCC[C@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000900189273 584284901 /nfs/dbraw/zinc/28/49/01/584284901.db2.gz XFZRNHNNCSOUKP-CMPLNLGQSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@H]1CCCC[C@H]1NC(=O)Cc1c[nH+]c[nH]1 ZINC000900189273 584284903 /nfs/dbraw/zinc/28/49/03/584284903.db2.gz XFZRNHNNCSOUKP-CMPLNLGQSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H]1CCCN(C(=O)CNc2cccc[nH+]2)CC1 ZINC000900418543 584306182 /nfs/dbraw/zinc/30/61/82/584306182.db2.gz YFRVYCWECNZOMR-GFCCVEGCSA-N 1 2 247.342 2.142 20 0 BEADLO CC(C)C(C)(C)NC(=O)CNc1cccc[nH+]1 ZINC000900548446 584321504 /nfs/dbraw/zinc/32/15/04/584321504.db2.gz MHOFPGHAWKHRFA-UHFFFAOYSA-N 1 2 235.331 2.044 20 0 BEADLO CNc1[nH+]c(C)ccc1C(=O)N(C(C)C)C1CC1 ZINC000900554673 584322521 /nfs/dbraw/zinc/32/25/21/584322521.db2.gz WSXVBEYFSHPHLN-UHFFFAOYSA-N 1 2 247.342 2.445 20 0 BEADLO CCCC[C@H]1CCC[C@@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000900543166 584324337 /nfs/dbraw/zinc/32/43/37/584324337.db2.gz LUSVLCZRNVCAQF-AAEUAGOBSA-N 1 2 249.358 2.427 20 0 BEADLO CCCC[C@H]1CCC[C@@H]1NC(=O)Cc1c[nH+]c[nH]1 ZINC000900543166 584324338 /nfs/dbraw/zinc/32/43/38/584324338.db2.gz LUSVLCZRNVCAQF-AAEUAGOBSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@@H]1CCCC[C@@H]1CCNC(=O)Cc1c[nH]c[nH+]1 ZINC000900718087 584344496 /nfs/dbraw/zinc/34/44/96/584344496.db2.gz JSPLGRJNYUDVJZ-VXGBXAGGSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1CCCC[C@@H]1CCNC(=O)Cc1c[nH+]c[nH]1 ZINC000900718087 584344499 /nfs/dbraw/zinc/34/44/99/584344499.db2.gz JSPLGRJNYUDVJZ-VXGBXAGGSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1CCCC[C@H]1CCNC(=O)Cc1c[nH]c[nH+]1 ZINC000900718084 584344538 /nfs/dbraw/zinc/34/45/38/584344538.db2.gz JSPLGRJNYUDVJZ-NEPJUHHUSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1CCCC[C@H]1CCNC(=O)Cc1c[nH+]c[nH]1 ZINC000900718084 584344541 /nfs/dbraw/zinc/34/45/41/584344541.db2.gz JSPLGRJNYUDVJZ-NEPJUHHUSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H](CNC(=O)CNc1cccc[nH+]1)C(C)(C)C ZINC000900722464 584344849 /nfs/dbraw/zinc/34/48/49/584344849.db2.gz ICCZVOWQEVCCLH-LLVKDONJSA-N 1 2 249.358 2.292 20 0 BEADLO C[C@@H]1CCC[C@@H](CCNC(=O)Cc2c[nH]c[nH+]2)C1 ZINC000900733158 584347245 /nfs/dbraw/zinc/34/72/45/584347245.db2.gz ZCRWBOPIZFXDFF-NEPJUHHUSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1CCC[C@@H](CCNC(=O)Cc2c[nH+]c[nH]2)C1 ZINC000900733158 584347247 /nfs/dbraw/zinc/34/72/47/584347247.db2.gz ZCRWBOPIZFXDFF-NEPJUHHUSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1[C@@H](C)CCCN1C(=O)CNc1cccc[nH+]1 ZINC000900829083 584355009 /nfs/dbraw/zinc/35/50/09/584355009.db2.gz NDSRATNJXSWFJJ-NWDGAFQWSA-N 1 2 247.342 2.141 20 0 BEADLO C[C@H]1CC(C)(C)CC[C@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000900953710 584366260 /nfs/dbraw/zinc/36/62/60/584366260.db2.gz FOGGHJCQVVIHGU-CMPLNLGQSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H]1CC(C)(C)CC[C@H]1NC(=O)Cc1c[nH+]c[nH]1 ZINC000900953710 584366262 /nfs/dbraw/zinc/36/62/62/584366262.db2.gz FOGGHJCQVVIHGU-CMPLNLGQSA-N 1 2 249.358 2.283 20 0 BEADLO CCCC[C@H](CCC)NC(=O)Cc1c[nH]c[nH+]1 ZINC000900953026 584366651 /nfs/dbraw/zinc/36/66/51/584366651.db2.gz AIKYSGMNEAIFQE-NSHDSACASA-N 1 2 237.347 2.427 20 0 BEADLO CCCC[C@H](CCC)NC(=O)Cc1c[nH+]c[nH]1 ZINC000900953026 584366652 /nfs/dbraw/zinc/36/66/52/584366652.db2.gz AIKYSGMNEAIFQE-NSHDSACASA-N 1 2 237.347 2.427 20 0 BEADLO CC1(C)CCC[C@H]1NC(=O)CNc1cccc[nH+]1 ZINC000900972122 584369637 /nfs/dbraw/zinc/36/96/37/584369637.db2.gz IJXXAHNWELQKFK-LLVKDONJSA-N 1 2 247.342 2.188 20 0 BEADLO CC[C@@H](O)[C@@H](C)C(=O)Nc1ccc(C)[nH+]c1C ZINC000901014394 584374484 /nfs/dbraw/zinc/37/44/84/584374484.db2.gz VJQULUIBPDKWRZ-BXKDBHETSA-N 1 2 236.315 2.044 20 0 BEADLO CCCC1(CNC(=O)Cc2c[nH]c[nH+]2)CCC1 ZINC000901034269 584376310 /nfs/dbraw/zinc/37/63/10/584376310.db2.gz YSTUSZRCOQNRSE-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO CCCC1(CNC(=O)Cc2c[nH+]c[nH]2)CCC1 ZINC000901034269 584376311 /nfs/dbraw/zinc/37/63/11/584376311.db2.gz YSTUSZRCOQNRSE-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO CCCC[C@@H](NC(=O)Cc1c[nH]c[nH+]1)C1CCC1 ZINC000901021473 584377535 /nfs/dbraw/zinc/37/75/35/584377535.db2.gz JQIHAHGAKZPJGW-CYBMUJFWSA-N 1 2 249.358 2.427 20 0 BEADLO CCCC[C@@H](NC(=O)Cc1c[nH+]c[nH]1)C1CCC1 ZINC000901021473 584377536 /nfs/dbraw/zinc/37/75/36/584377536.db2.gz JQIHAHGAKZPJGW-CYBMUJFWSA-N 1 2 249.358 2.427 20 0 BEADLO CC(C)CCOC(=O)N(C)Cc1[nH+]ccn1C ZINC000858882769 588981597 /nfs/dbraw/zinc/98/15/97/588981597.db2.gz GKTAJXDPZSYSCZ-UHFFFAOYSA-N 1 2 239.319 2.035 20 0 BEADLO CCn1c[nH+]cc1/C=C(/C)c1cnccn1 ZINC000901491345 584452919 /nfs/dbraw/zinc/45/29/19/584452919.db2.gz SUQPTLGVDJIKOW-POHAHGRESA-N 1 2 214.272 2.254 20 0 BEADLO CC(C)c1c[nH]c(C=Cc2c[nH]c(C=O)n2)[nH+]1 ZINC000901554883 584462587 /nfs/dbraw/zinc/46/25/87/584462587.db2.gz HJEYVZBRQKYHLC-ONEGZZNKSA-N 1 2 230.271 2.239 20 0 BEADLO CC[C@@H]1C[C@H]1C[NH2+]c1ccc(-n2cnnn2)cc1 ZINC000901949610 584507096 /nfs/dbraw/zinc/50/70/96/584507096.db2.gz HOVSUEQMKODQIO-MNOVXSKESA-N 1 2 243.314 2.120 20 0 BEADLO CCc1cc(NCc2[nH+]ccn2C2CC2)no1 ZINC000902050809 584517328 /nfs/dbraw/zinc/51/73/28/584517328.db2.gz WQCYSHBKMHUUCW-UHFFFAOYSA-N 1 2 232.287 2.381 20 0 BEADLO Cc1nc(NCc2ccnn2CC2CC2)cc[nH+]1 ZINC000902126059 584529369 /nfs/dbraw/zinc/52/93/69/584529369.db2.gz XDAATPQFSCYDKH-UHFFFAOYSA-N 1 2 243.314 2.004 20 0 BEADLO C[C@@H]1C[N@H+](CN2CCOC2=O)[C@@H]1c1ccccc1 ZINC000902164440 584533350 /nfs/dbraw/zinc/53/33/50/584533350.db2.gz FPTYTQRVUFDPEZ-YPMHNXCESA-N 1 2 246.310 2.089 20 0 BEADLO C[C@@H]1C[N@@H+](CN2CCOC2=O)[C@@H]1c1ccccc1 ZINC000902164440 584533353 /nfs/dbraw/zinc/53/33/53/584533353.db2.gz FPTYTQRVUFDPEZ-YPMHNXCESA-N 1 2 246.310 2.089 20 0 BEADLO C[C@H]1C[N@H+](CN2CCOC2=O)[C@@H]1c1ccccc1 ZINC000902164434 584533805 /nfs/dbraw/zinc/53/38/05/584533805.db2.gz FPTYTQRVUFDPEZ-AAEUAGOBSA-N 1 2 246.310 2.089 20 0 BEADLO C[C@H]1C[N@@H+](CN2CCOC2=O)[C@@H]1c1ccccc1 ZINC000902164434 584533807 /nfs/dbraw/zinc/53/38/07/584533807.db2.gz FPTYTQRVUFDPEZ-AAEUAGOBSA-N 1 2 246.310 2.089 20 0 BEADLO Cc1ccc(C)c(C[N@H+](C)CN2CCOC2=O)c1 ZINC000902239128 584543637 /nfs/dbraw/zinc/54/36/37/584543637.db2.gz SATISWSODLLHMY-UHFFFAOYSA-N 1 2 248.326 2.145 20 0 BEADLO Cc1ccc(C)c(C[N@@H+](C)CN2CCOC2=O)c1 ZINC000902239128 584543639 /nfs/dbraw/zinc/54/36/39/584543639.db2.gz SATISWSODLLHMY-UHFFFAOYSA-N 1 2 248.326 2.145 20 0 BEADLO C[N@H+](Cc1ccco1)Cc1ccnc(F)c1 ZINC000859054245 588994435 /nfs/dbraw/zinc/99/44/35/588994435.db2.gz MZFBAJOVMFVRJQ-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO C[N@@H+](Cc1ccco1)Cc1ccnc(F)c1 ZINC000859054245 588994436 /nfs/dbraw/zinc/99/44/36/588994436.db2.gz MZFBAJOVMFVRJQ-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO CCn1c[nH+]c(CNc2ccc(F)nc2)c1 ZINC000902400079 584586679 /nfs/dbraw/zinc/58/66/79/584586679.db2.gz XPSBJSVZEKOQEL-UHFFFAOYSA-N 1 2 220.251 2.049 20 0 BEADLO C[C@H]1CCC[N@H+](Cc2cc(Cl)n(C)n2)C1 ZINC000859064402 588996176 /nfs/dbraw/zinc/99/61/76/588996176.db2.gz ZVDVQSXINNTXTN-VIFPVBQESA-N 1 2 227.739 2.305 20 0 BEADLO C[C@H]1CCC[N@@H+](Cc2cc(Cl)n(C)n2)C1 ZINC000859064402 588996177 /nfs/dbraw/zinc/99/61/77/588996177.db2.gz ZVDVQSXINNTXTN-VIFPVBQESA-N 1 2 227.739 2.305 20 0 BEADLO CCn1cnc(C[NH2+][C@@H](C)c2cncc(F)c2)c1 ZINC000902473231 584601113 /nfs/dbraw/zinc/60/11/13/584601113.db2.gz VOUWYJUURWQIKK-JTQLQIEISA-N 1 2 248.305 2.288 20 0 BEADLO CCCOC(=O)NCc1[nH+]ccn1CC(C)C ZINC000859093408 589000852 /nfs/dbraw/zinc/00/08/52/589000852.db2.gz MKZZDLHMJKUTMY-UHFFFAOYSA-N 1 2 239.319 2.175 20 0 BEADLO CCn1c[nH+]c(CNc2cc(C3CC3)n(C)n2)c1 ZINC000902572440 584636737 /nfs/dbraw/zinc/63/67/37/584636737.db2.gz UXXOBNYSRZJRMF-UHFFFAOYSA-N 1 2 245.330 2.126 20 0 BEADLO CCc1cc(NCc2[nH+]ccn2C2CC2)nn1C ZINC000902601420 584641163 /nfs/dbraw/zinc/64/11/63/584641163.db2.gz NWWGWINWNMALEA-UHFFFAOYSA-N 1 2 245.330 2.126 20 0 BEADLO COCCOCCOc1ccc2c[nH+]ccc2c1 ZINC000902636288 584648266 /nfs/dbraw/zinc/64/82/66/584648266.db2.gz BDKZOYXFGWUCQK-UHFFFAOYSA-N 1 2 247.294 2.277 20 0 BEADLO c1[nH]c(CNc2cccnc2C2CC2)c[nH+]1 ZINC000902695247 584656867 /nfs/dbraw/zinc/65/68/67/584656867.db2.gz PPNDODFGUXNJJN-UHFFFAOYSA-N 1 2 214.272 2.294 20 0 BEADLO c1[nH]cc(CNc2cccnc2C2CC2)[nH+]1 ZINC000902695247 584656868 /nfs/dbraw/zinc/65/68/68/584656868.db2.gz PPNDODFGUXNJJN-UHFFFAOYSA-N 1 2 214.272 2.294 20 0 BEADLO CC1CC(CO[NH+]=C(N)Cc2cccnc2)C1 ZINC000902722836 584660467 /nfs/dbraw/zinc/66/04/67/584660467.db2.gz NGMOWASVQCZQMV-UHFFFAOYSA-N 1 2 233.315 2.169 20 0 BEADLO Cc1cc(C)[nH+]c(Cn2cnc(C3CC3)n2)c1 ZINC000902744465 584664410 /nfs/dbraw/zinc/66/44/10/584664410.db2.gz VDQPQGDEAIMQKW-UHFFFAOYSA-N 1 2 228.299 2.216 20 0 BEADLO C[C@@H]([NH2+][C@H]1CC[C@@H]2[C@H]3OCC[C@H]3[C@@H]21)C(F)(F)F ZINC000902995211 584708894 /nfs/dbraw/zinc/70/88/94/584708894.db2.gz WWJYBPVRWQCRCZ-BAMVVWIKSA-N 1 2 249.276 2.340 20 0 BEADLO Cc1nnsc1[C@@H](C)[N@@H+]1CCC[C@@H](F)C1 ZINC000902991455 584710454 /nfs/dbraw/zinc/71/04/54/584710454.db2.gz RQWZBKRYGXUOPR-RKDXNWHRSA-N 1 2 229.324 2.341 20 0 BEADLO Cc1nnsc1[C@@H](C)[N@H+]1CCC[C@@H](F)C1 ZINC000902991455 584710455 /nfs/dbraw/zinc/71/04/55/584710455.db2.gz RQWZBKRYGXUOPR-RKDXNWHRSA-N 1 2 229.324 2.341 20 0 BEADLO CN(C)c1cc(C[N@@H+]2CCC[C@H](F)C2)ccn1 ZINC000902994613 584712138 /nfs/dbraw/zinc/71/21/38/584712138.db2.gz GDTSWSBYVVNTOQ-LBPRGKRZSA-N 1 2 237.322 2.082 20 0 BEADLO CN(C)c1cc(C[N@H+]2CCC[C@H](F)C2)ccn1 ZINC000902994613 584712139 /nfs/dbraw/zinc/71/21/39/584712139.db2.gz GDTSWSBYVVNTOQ-LBPRGKRZSA-N 1 2 237.322 2.082 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+]2CCC[C@H](F)C2)o1 ZINC000902996737 584714408 /nfs/dbraw/zinc/71/44/08/584714408.db2.gz WIZXTMFOBGIDHQ-UWVGGRQHSA-N 1 2 212.268 2.478 20 0 BEADLO Cc1cnc([C@H](C)[N@H+]2CCC[C@H](F)C2)o1 ZINC000902996737 584714409 /nfs/dbraw/zinc/71/44/09/584714409.db2.gz WIZXTMFOBGIDHQ-UWVGGRQHSA-N 1 2 212.268 2.478 20 0 BEADLO COCc1cc[nH+]c(N[C@H]2CCC[C@H]2OC)c1 ZINC000903196137 584734514 /nfs/dbraw/zinc/73/45/14/584734514.db2.gz IGZQYEQPJSSNLQ-NWDGAFQWSA-N 1 2 236.315 2.207 20 0 BEADLO C[C@H](NCc1nc2c(s1)CCC2)c1[nH]cc[nH+]1 ZINC000903191019 584735989 /nfs/dbraw/zinc/73/59/89/584735989.db2.gz KWSWGKSSBVPBLL-QMMMGPOBSA-N 1 2 248.355 2.206 20 0 BEADLO C[C@H]([NH2+]Cc1nc2c(s1)CCC2)c1ncc[nH]1 ZINC000903191019 584735990 /nfs/dbraw/zinc/73/59/90/584735990.db2.gz KWSWGKSSBVPBLL-QMMMGPOBSA-N 1 2 248.355 2.206 20 0 BEADLO C[C@H]([NH2+][C@H]1CCn2ccnc21)c1cncs1 ZINC000903312589 584748327 /nfs/dbraw/zinc/74/83/27/584748327.db2.gz WYSVCVARKCQCLE-IUCAKERBSA-N 1 2 234.328 2.135 20 0 BEADLO CCc1ccc([C@@H](C)[NH2+]Cc2cn(C)cn2)o1 ZINC000903351657 584755351 /nfs/dbraw/zinc/75/53/51/584755351.db2.gz NTASGCPFZKIKGY-SNVBAGLBSA-N 1 2 233.315 2.426 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2cn(C)cn2)oc1C ZINC000903352943 584755757 /nfs/dbraw/zinc/75/57/57/584755757.db2.gz XIHPACWDLHQCPY-JTQLQIEISA-N 1 2 233.315 2.481 20 0 BEADLO Cl/C=C/C[NH2+][C@@H]1CCCc2[nH]ncc21 ZINC000903444136 584768681 /nfs/dbraw/zinc/76/86/81/584768681.db2.gz NFEJTKYEGBQVGL-OSOUNJMWSA-N 1 2 211.696 2.129 20 0 BEADLO CCn1nc(C)c([C@@H](C)[NH2+]C/C=C\Cl)n1 ZINC000903445188 584769347 /nfs/dbraw/zinc/76/93/47/584769347.db2.gz SEMZYBIQPLRLPR-RPSMYOMKSA-N 1 2 228.727 2.010 20 0 BEADLO COc1ccccc1CCCN1CC=CC[NH2+]1 ZINC000903488989 584780531 /nfs/dbraw/zinc/78/05/31/584780531.db2.gz BKBJGLHXAZSQRT-UHFFFAOYSA-N 1 2 232.327 2.004 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1noc(C(C)(C)C)n1 ZINC000904269656 584858575 /nfs/dbraw/zinc/85/85/75/584858575.db2.gz OSTQLKDCNIFITA-UHFFFAOYSA-N 1 2 232.287 2.320 20 0 BEADLO CC[C@H](OC)c1nc(-c2ccc(N)[nH+]c2C)no1 ZINC000904259078 584859418 /nfs/dbraw/zinc/85/94/18/584859418.db2.gz XLKXKWJJAXMNBA-VIFPVBQESA-N 1 2 248.286 2.120 20 0 BEADLO CCCOC(=O)N[C@H](C)c1[nH+]ccn1CC ZINC000859181166 589014883 /nfs/dbraw/zinc/01/48/83/589014883.db2.gz XLSCQXSWWKXRDC-SECBINFHSA-N 1 2 225.292 2.100 20 0 BEADLO OCC[N@H+](C/C(Cl)=C/Cl)C1CCC1 ZINC000221172914 584906517 /nfs/dbraw/zinc/90/65/17/584906517.db2.gz FWXUFHUVHCYQPE-VURMDHGXSA-N 1 2 224.131 2.152 20 0 BEADLO OCC[N@@H+](C/C(Cl)=C/Cl)C1CCC1 ZINC000221172914 584906518 /nfs/dbraw/zinc/90/65/18/584906518.db2.gz FWXUFHUVHCYQPE-VURMDHGXSA-N 1 2 224.131 2.152 20 0 BEADLO CC[N@@H+]1CCCC[C@H]1C(=O)OC[C@H](C)SC ZINC000835684084 584929111 /nfs/dbraw/zinc/92/91/11/584929111.db2.gz CZISQKRQHFRATN-QWRGUYRKSA-N 1 2 245.388 2.156 20 0 BEADLO CC[N@H+]1CCCC[C@H]1C(=O)OC[C@H](C)SC ZINC000835684084 584929112 /nfs/dbraw/zinc/92/91/12/584929112.db2.gz CZISQKRQHFRATN-QWRGUYRKSA-N 1 2 245.388 2.156 20 0 BEADLO CC(C)c1nc(N2CCC[C@H](CCO)C2)cc[nH+]1 ZINC000732039867 584933088 /nfs/dbraw/zinc/93/30/88/584933088.db2.gz YUBQAVPWGMCTOO-GFCCVEGCSA-N 1 2 249.358 2.199 20 0 BEADLO CCC/C(C)=C\C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000732094931 584933862 /nfs/dbraw/zinc/93/38/62/584933862.db2.gz VAGLPZLQPYFAQZ-NTMALXAHSA-N 1 2 221.304 2.115 20 0 BEADLO CC[C@@H](C)C[N@H+](C)Cn1ncn(CC)c1=S ZINC000732184178 584934480 /nfs/dbraw/zinc/93/44/80/584934480.db2.gz WOQAVKIRVONLMH-SNVBAGLBSA-N 1 2 242.392 2.369 20 0 BEADLO CC[C@@H](C)C[N@@H+](C)Cn1ncn(CC)c1=S ZINC000732184178 584934481 /nfs/dbraw/zinc/93/44/81/584934481.db2.gz WOQAVKIRVONLMH-SNVBAGLBSA-N 1 2 242.392 2.369 20 0 BEADLO CCc1ncc(CN(C)Cc2[nH]cc[nH+]2)s1 ZINC000732203655 584934623 /nfs/dbraw/zinc/93/46/23/584934623.db2.gz DFOATKGQQHAUFB-UHFFFAOYSA-N 1 2 236.344 2.061 20 0 BEADLO O[C@H](COc1ccccc1-n1cc[nH+]c1)C1CC1 ZINC000840759271 584945449 /nfs/dbraw/zinc/94/54/49/584945449.db2.gz HNIQEGRVPRMTQB-CYBMUJFWSA-N 1 2 244.294 2.022 20 0 BEADLO CC(C)c1cnc(C[N@@H+]2CCCO[C@H](C)C2)o1 ZINC000733309166 584946745 /nfs/dbraw/zinc/94/67/45/584946745.db2.gz CVACWPRFYVSZIP-LLVKDONJSA-N 1 2 238.331 2.409 20 0 BEADLO CC(C)c1cnc(C[N@H+]2CCCO[C@H](C)C2)o1 ZINC000733309166 584946746 /nfs/dbraw/zinc/94/67/46/584946746.db2.gz CVACWPRFYVSZIP-LLVKDONJSA-N 1 2 238.331 2.409 20 0 BEADLO CC[N@H+](CCOC)Cc1ncc(C(C)C)o1 ZINC000733308527 584946765 /nfs/dbraw/zinc/94/67/65/584946765.db2.gz LMWQQBFSMCFYCE-UHFFFAOYSA-N 1 2 226.320 2.266 20 0 BEADLO CC[N@@H+](CCOC)Cc1ncc(C(C)C)o1 ZINC000733308527 584946766 /nfs/dbraw/zinc/94/67/66/584946766.db2.gz LMWQQBFSMCFYCE-UHFFFAOYSA-N 1 2 226.320 2.266 20 0 BEADLO Cc1nonc1C[N@@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000734146504 584957183 /nfs/dbraw/zinc/95/71/83/584957183.db2.gz FGLYHSBAROWNMK-JTQLQIEISA-N 1 2 243.310 2.497 20 0 BEADLO Cc1nonc1C[N@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000734146504 584957184 /nfs/dbraw/zinc/95/71/84/584957184.db2.gz FGLYHSBAROWNMK-JTQLQIEISA-N 1 2 243.310 2.497 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)[C@@H]2CC23CC3)c1 ZINC000817231655 584983752 /nfs/dbraw/zinc/98/37/52/584983752.db2.gz WIDORVOBCQVLHL-LBPRGKRZSA-N 1 2 247.294 2.242 20 0 BEADLO C[N@H+](C[C@H]1CCCOC1)CC(F)(F)C(F)F ZINC000736618704 585007342 /nfs/dbraw/zinc/00/73/42/585007342.db2.gz HJKFXPXTNNMGDL-MRVPVSSYSA-N 1 2 243.244 2.245 20 0 BEADLO C[N@@H+](C[C@H]1CCCOC1)CC(F)(F)C(F)F ZINC000736618704 585007343 /nfs/dbraw/zinc/00/73/43/585007343.db2.gz HJKFXPXTNNMGDL-MRVPVSSYSA-N 1 2 243.244 2.245 20 0 BEADLO CC[N@H+](C[C@H]1CCOC1)CC(F)(F)C(F)F ZINC000736620284 585007999 /nfs/dbraw/zinc/00/79/99/585007999.db2.gz BUAOCUGXDXFLOP-MRVPVSSYSA-N 1 2 243.244 2.245 20 0 BEADLO CC[N@@H+](C[C@H]1CCOC1)CC(F)(F)C(F)F ZINC000736620284 585008000 /nfs/dbraw/zinc/00/80/00/585008000.db2.gz BUAOCUGXDXFLOP-MRVPVSSYSA-N 1 2 243.244 2.245 20 0 BEADLO Cn1c[nH+]c(CNC(=O)C2(C)CCCCC2)c1 ZINC000890108281 585023689 /nfs/dbraw/zinc/02/36/89/585023689.db2.gz XSERMGRSEOKUNR-UHFFFAOYSA-N 1 2 235.331 2.007 20 0 BEADLO Cc1coc(C[NH2+][C@@H](CCO)c2ccco2)c1 ZINC000886067925 585036825 /nfs/dbraw/zinc/03/68/25/585036825.db2.gz QPTCSOLYSIBNGT-LBPRGKRZSA-N 1 2 235.283 2.394 20 0 BEADLO Nc1cc(COC(=O)C[C@@H]2CC[C@@H]3C[C@@H]32)cc[nH+]1 ZINC000838122341 585046382 /nfs/dbraw/zinc/04/63/82/585046382.db2.gz JUXTUHSUQVNQOU-WOPDTQHZSA-N 1 2 246.310 2.143 20 0 BEADLO CC[C@@H](C)OC(=O)c1ccc2[nH+]ccn2c1 ZINC000738650249 585050035 /nfs/dbraw/zinc/05/00/35/585050035.db2.gz NOABRFILGOLKDV-SECBINFHSA-N 1 2 218.256 2.290 20 0 BEADLO CCn1ncc(C[N@H+](C)[C@H](C)c2ccccc2)n1 ZINC000838785892 585070174 /nfs/dbraw/zinc/07/01/74/585070174.db2.gz CLRGSZDVFTVQMT-GFCCVEGCSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1ncc(C[N@@H+](C)[C@H](C)c2ccccc2)n1 ZINC000838785892 585070175 /nfs/dbraw/zinc/07/01/75/585070175.db2.gz CLRGSZDVFTVQMT-GFCCVEGCSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1ncc(C[NH2+][C@H]2CCCc3occc32)n1 ZINC000838899658 585080214 /nfs/dbraw/zinc/08/02/14/585080214.db2.gz XMUJUMKVUJLBDL-LBPRGKRZSA-N 1 2 246.314 2.058 20 0 BEADLO CCOC1C[NH+](Cc2cc(C)oc2C)C1 ZINC000839131709 585093545 /nfs/dbraw/zinc/09/35/45/585093545.db2.gz ZIBPHGPHSDIEGQ-UHFFFAOYSA-N 1 2 209.289 2.117 20 0 BEADLO COC1C[NH+](Cc2ccc3cnccc3c2)C1 ZINC000839130731 585093704 /nfs/dbraw/zinc/09/37/04/585093704.db2.gz GBRXZMNNRFXSMX-UHFFFAOYSA-N 1 2 228.295 2.065 20 0 BEADLO CCC1(C)C[NH+](Cc2cnn(C)c2Cl)C1 ZINC000839144455 585094707 /nfs/dbraw/zinc/09/47/07/585094707.db2.gz XNOGHOXFUZISBZ-UHFFFAOYSA-N 1 2 227.739 2.305 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2ccn(C)n2)c(C)o1 ZINC000839189632 585097156 /nfs/dbraw/zinc/09/71/56/585097156.db2.gz AYHCMBMRXYKYRO-SNVBAGLBSA-N 1 2 233.315 2.481 20 0 BEADLO CC(C)[C@H](F)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000839360247 585101923 /nfs/dbraw/zinc/10/19/23/585101923.db2.gz FAXKTBGIUQQCCT-NSHDSACASA-N 1 2 235.262 2.267 20 0 BEADLO CC(C)C[C@@H](C)OC(=O)NCc1[nH]cc[nH+]1 ZINC000867012654 585105487 /nfs/dbraw/zinc/10/54/87/585105487.db2.gz IDGNOTGNBXDJIA-SECBINFHSA-N 1 2 225.292 2.071 20 0 BEADLO Cc1nc(NC[C@H](O)c2ccc(F)cc2)cc[nH+]1 ZINC000742254473 585124279 /nfs/dbraw/zinc/12/42/79/585124279.db2.gz FTTKEZDNYQWDAO-LBPRGKRZSA-N 1 2 247.273 2.070 20 0 BEADLO CC(=O)N(C)c1ccc(NCc2[nH]cc[nH+]2)cc1 ZINC000742378828 585125403 /nfs/dbraw/zinc/12/54/03/585125403.db2.gz CAUGCJHZGMEBKG-UHFFFAOYSA-N 1 2 244.298 2.005 20 0 BEADLO CC1CCC2(CC1)[NH2+]C1(CCCC1)C(=O)N2C ZINC000742439640 585126419 /nfs/dbraw/zinc/12/64/19/585126419.db2.gz NFLHIAFNXQCTOQ-UHFFFAOYSA-N 1 2 236.359 2.267 20 0 BEADLO C[C@H]1CCC[C@]2(C1)[NH2+]C1(CCCC1)C(=O)N2C ZINC000742438485 585126436 /nfs/dbraw/zinc/12/64/36/585126436.db2.gz DAFKDOPZQUFJKS-FZMZJTMJSA-N 1 2 236.359 2.267 20 0 BEADLO C/C(=C\C(=O)NCCCn1cc[nH+]c1)C(C)(C)C ZINC000742466224 585126744 /nfs/dbraw/zinc/12/67/44/585126744.db2.gz SUUWCYXREMCRGB-ZRDIBKRKSA-N 1 2 249.358 2.382 20 0 BEADLO C/C(=C/C(=O)NC1=[NH+]CCS1)C(C)(C)C ZINC000742487970 585127270 /nfs/dbraw/zinc/12/72/70/585127270.db2.gz BKSUYGYNQCOVNO-FPLPWBNLSA-N 1 2 226.345 2.198 20 0 BEADLO C/C(=C\C(=O)NCc1[nH]cc[nH+]1)C(C)(C)C ZINC000742663177 585129361 /nfs/dbraw/zinc/12/93/61/585129361.db2.gz PFJOPNULQLVVAV-VQHVLOKHSA-N 1 2 221.304 2.018 20 0 BEADLO CC(=CC(=O)NCc1[nH]cc[nH+]1)C(C)(C)C ZINC000742663177 585129362 /nfs/dbraw/zinc/12/93/62/585129362.db2.gz PFJOPNULQLVVAV-VQHVLOKHSA-N 1 2 221.304 2.018 20 0 BEADLO C/C(=C/C(=O)NCc1[nH]cc[nH+]1)C(C)(C)C ZINC000742663175 585129376 /nfs/dbraw/zinc/12/93/76/585129376.db2.gz PFJOPNULQLVVAV-CLFYSBASSA-N 1 2 221.304 2.018 20 0 BEADLO CC(=CC(=O)NCc1[nH]cc[nH+]1)C(C)(C)C ZINC000742663175 585129377 /nfs/dbraw/zinc/12/93/77/585129377.db2.gz PFJOPNULQLVVAV-CLFYSBASSA-N 1 2 221.304 2.018 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)OCC1CCCCC1 ZINC000867013612 585155017 /nfs/dbraw/zinc/15/50/17/585155017.db2.gz TWQRNELYNKEFKK-UHFFFAOYSA-N 1 2 237.303 2.216 20 0 BEADLO CCC[N@H+](C)Cn1nc2ccccn2c1=S ZINC000746074705 585162899 /nfs/dbraw/zinc/16/28/99/585162899.db2.gz GLRJVBHWYFULHR-UHFFFAOYSA-N 1 2 236.344 2.165 20 0 BEADLO CCC[N@@H+](C)Cn1nc2ccccn2c1=S ZINC000746074705 585162900 /nfs/dbraw/zinc/16/29/00/585162900.db2.gz GLRJVBHWYFULHR-UHFFFAOYSA-N 1 2 236.344 2.165 20 0 BEADLO FCC[NH+]1CCN(c2cccc(Cl)c2)CC1 ZINC000746495376 585168246 /nfs/dbraw/zinc/16/82/46/585168246.db2.gz MQUCUQVAVFQKKM-UHFFFAOYSA-N 1 2 242.725 2.432 20 0 BEADLO C[C@@H]1CN(C(=O)CCCn2cc[nH+]c2)C(C)(C)C1 ZINC000746656710 585171974 /nfs/dbraw/zinc/17/19/74/585171974.db2.gz JROXDOZZVQXAOL-LBPRGKRZSA-N 1 2 249.358 2.310 20 0 BEADLO NC(=[NH+]OCc1cccc(F)c1)[C@H]1CCCO1 ZINC000789626058 585178300 /nfs/dbraw/zinc/17/83/00/585178300.db2.gz DJAGCVMMUCKJRF-LLVKDONJSA-N 1 2 238.262 2.003 20 0 BEADLO CCCCCCC(=O)Nc1cc[nH+]cc1O ZINC000748312436 585190758 /nfs/dbraw/zinc/19/07/58/585190758.db2.gz LCMJKTCKXSSISE-UHFFFAOYSA-N 1 2 222.288 2.118 20 0 BEADLO C/C=C(\C)C(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000751360580 585227243 /nfs/dbraw/zinc/22/72/43/585227243.db2.gz MGYLYXRXIVIBPR-BCMYLCSRSA-N 1 2 249.358 2.380 20 0 BEADLO CC(C)=C(C)C(=O)Nc1ccc[nH+]c1N(C)C ZINC000751362926 585227575 /nfs/dbraw/zinc/22/75/75/585227575.db2.gz HFGAUECRXALRNX-UHFFFAOYSA-N 1 2 233.315 2.442 20 0 BEADLO CC(C)=C(C)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000751376803 585228217 /nfs/dbraw/zinc/22/82/17/585228217.db2.gz OJTREAXMOKXXSK-CYBMUJFWSA-N 1 2 247.342 2.403 20 0 BEADLO CC1(C)C[C@H]1C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000751882164 585238397 /nfs/dbraw/zinc/23/83/97/585238397.db2.gz BZUQNUFDQSWBIS-NEPJUHHUSA-N 1 2 247.342 2.093 20 0 BEADLO C[C@@H]1C[NH+](CC(F)(F)C(F)F)C[C@H]1C ZINC000752077297 585241386 /nfs/dbraw/zinc/24/13/86/585241386.db2.gz WWPYKHULTPOLST-RNFRBKRXSA-N 1 2 213.218 2.475 20 0 BEADLO Cn1c[nH+]cc1CSc1ccc(Cl)nn1 ZINC000753061268 585252757 /nfs/dbraw/zinc/25/27/57/585252757.db2.gz PLYGDCFTCIYHEX-UHFFFAOYSA-N 1 2 240.719 2.156 20 0 BEADLO Cc1nnc(-c2cccc(Cn3cc[nH+]c3)c2)o1 ZINC000753544427 585261189 /nfs/dbraw/zinc/26/11/89/585261189.db2.gz ZLUFDTAQBCAWAO-UHFFFAOYSA-N 1 2 240.266 2.290 20 0 BEADLO C[C@H]1CC/C(=C/C(=O)N(C)Cc2[nH]cc[nH+]2)C1 ZINC000753607993 585263651 /nfs/dbraw/zinc/26/36/51/585263651.db2.gz PBJOLDZSJQRUQH-DFYQSJSGSA-N 1 2 233.315 2.115 20 0 BEADLO Cc1ccc(COC(=O)C[C@H]2CCOC2)c(C)[nH+]1 ZINC000753625093 585264797 /nfs/dbraw/zinc/26/47/97/585264797.db2.gz QUVZTXDFEFGYDN-GFCCVEGCSA-N 1 2 249.310 2.168 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OCC(C)C ZINC000754279103 585281268 /nfs/dbraw/zinc/28/12/68/585281268.db2.gz KIKKIUAEJAVYDG-UHFFFAOYSA-N 1 2 206.289 2.498 20 0 BEADLO FCC[N@@H+]1CCO[C@H](C2CCCCC2)C1 ZINC000755308424 585297516 /nfs/dbraw/zinc/29/75/16/585297516.db2.gz PPAIGVGIJLVSDY-LBPRGKRZSA-N 1 2 215.312 2.237 20 0 BEADLO FCC[N@H+]1CCO[C@H](C2CCCCC2)C1 ZINC000755308424 585297517 /nfs/dbraw/zinc/29/75/17/585297517.db2.gz PPAIGVGIJLVSDY-LBPRGKRZSA-N 1 2 215.312 2.237 20 0 BEADLO CCC1(C(=O)OCc2cc[nH+]c(N(C)C)c2)CC1 ZINC000755888396 585309218 /nfs/dbraw/zinc/30/92/18/585309218.db2.gz QZWUBJLVPICWTE-UHFFFAOYSA-N 1 2 248.326 2.381 20 0 BEADLO CC(C)=C(C)C(=O)N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000756129173 585314981 /nfs/dbraw/zinc/31/49/81/585314981.db2.gz BBJZGNBYPVCSTL-GFCCVEGCSA-N 1 2 247.342 2.092 20 0 BEADLO CC(C)OCC(N)=[NH+]OCCCOC(C)(C)C ZINC000756860787 585324568 /nfs/dbraw/zinc/32/45/68/585324568.db2.gz OPAWWPRZUFPFNT-UHFFFAOYSA-N 1 2 246.351 2.115 20 0 BEADLO O[C@@H](Cn1cc[nH+]c1)c1ccc(Cl)c(F)c1 ZINC000759050551 585363959 /nfs/dbraw/zinc/36/39/59/585363959.db2.gz QUEPROOZYYTZDP-NSHDSACASA-N 1 2 240.665 2.409 20 0 BEADLO Cc1ccc(N2CC[NH+](CCF)CC2)cc1C ZINC000759345980 585369922 /nfs/dbraw/zinc/36/99/22/585369922.db2.gz JEYXTJZNGKMNFU-UHFFFAOYSA-N 1 2 236.334 2.395 20 0 BEADLO CCC(CC)CC(=O)OCc1c[nH+]cn1C ZINC000759565352 585376423 /nfs/dbraw/zinc/37/64/23/585376423.db2.gz WXPMRZBPNDWQDZ-UHFFFAOYSA-N 1 2 224.304 2.290 20 0 BEADLO COCC[N@H+](CCF)Cc1ccc(C)o1 ZINC000759770125 585380029 /nfs/dbraw/zinc/38/00/29/585380029.db2.gz IUAMAVDPZYXAID-UHFFFAOYSA-N 1 2 215.268 2.006 20 0 BEADLO COCC[N@@H+](CCF)Cc1ccc(C)o1 ZINC000759770125 585380030 /nfs/dbraw/zinc/38/00/30/585380030.db2.gz IUAMAVDPZYXAID-UHFFFAOYSA-N 1 2 215.268 2.006 20 0 BEADLO CC(C)CCOC(=O)CCc1ccc(N)[nH+]c1 ZINC000759815770 585380996 /nfs/dbraw/zinc/38/09/96/585380996.db2.gz RQHFAJBQASSCLN-UHFFFAOYSA-N 1 2 236.315 2.186 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)no1 ZINC000761043048 585403853 /nfs/dbraw/zinc/40/38/53/585403853.db2.gz SQWFYOXPVWDEDK-MRVPVSSYSA-N 1 2 234.221 2.367 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@@H](C(F)(F)F)C2)no1 ZINC000761043048 585403854 /nfs/dbraw/zinc/40/38/54/585403854.db2.gz SQWFYOXPVWDEDK-MRVPVSSYSA-N 1 2 234.221 2.367 20 0 BEADLO c1cc(-c2nc(C[N@@H+]3CC[C@H]4C[C@H]43)no2)cs1 ZINC000761095216 585408709 /nfs/dbraw/zinc/40/87/09/585408709.db2.gz PUESWVUIMYBAKW-WCBMZHEXSA-N 1 2 247.323 2.392 20 0 BEADLO c1cc(-c2nc(C[N@H+]3CC[C@H]4C[C@H]43)no2)cs1 ZINC000761095216 585408710 /nfs/dbraw/zinc/40/87/10/585408710.db2.gz PUESWVUIMYBAKW-WCBMZHEXSA-N 1 2 247.323 2.392 20 0 BEADLO CCc1cc(CNc2nc(C)[nH+]c(C)c2C)[nH]n1 ZINC000761898986 585422424 /nfs/dbraw/zinc/42/24/24/585422424.db2.gz SNMUUCTUOOTLFN-UHFFFAOYSA-N 1 2 245.330 2.299 20 0 BEADLO CCc1cc(CNc2nc(C)[nH+]c(C)c2C)n[nH]1 ZINC000761898986 585422425 /nfs/dbraw/zinc/42/24/25/585422425.db2.gz SNMUUCTUOOTLFN-UHFFFAOYSA-N 1 2 245.330 2.299 20 0 BEADLO CN(Cc1cnc(Cl)s1)Cc1[nH]cc[nH+]1 ZINC000762326979 585430829 /nfs/dbraw/zinc/43/08/29/585430829.db2.gz AYPUVMVJCDQAPC-UHFFFAOYSA-N 1 2 242.735 2.152 20 0 BEADLO CN(C)c1cc(CSc2cnccn2)cc[nH+]1 ZINC000762481875 585432900 /nfs/dbraw/zinc/43/29/00/585432900.db2.gz UHGCARPTAFWOBV-UHFFFAOYSA-N 1 2 246.339 2.230 20 0 BEADLO Cc1cnc(C)c(NC[C@H](C)Cn2cc[nH+]c2)n1 ZINC000762784522 585437055 /nfs/dbraw/zinc/43/70/55/585437055.db2.gz DNKXFZNEMHBDIV-JTQLQIEISA-N 1 2 245.330 2.038 20 0 BEADLO Cc1ccc(C(=O)OCCn2cc[nH+]c2)s1 ZINC000763117201 585443270 /nfs/dbraw/zinc/44/32/70/585443270.db2.gz WLYYNDFCWVLBLN-UHFFFAOYSA-N 1 2 236.296 2.110 20 0 BEADLO Cc1ccc(C(=O)OCCn2cc[nH+]c2)cc1C ZINC000763113555 585443325 /nfs/dbraw/zinc/44/33/25/585443325.db2.gz CKUKLKNIIPUPGF-UHFFFAOYSA-N 1 2 244.294 2.357 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)c1ccsc1 ZINC000763286748 585446009 /nfs/dbraw/zinc/44/60/09/585446009.db2.gz HHEQIAPWEOMSHI-UHFFFAOYSA-N 1 2 236.296 2.192 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)c1ccccc1F ZINC000763293478 585446156 /nfs/dbraw/zinc/44/61/56/585446156.db2.gz IDLMGFXCJWLGCW-UHFFFAOYSA-N 1 2 248.257 2.269 20 0 BEADLO CSCCO[NH+]=C(N)c1cccc(F)c1 ZINC000763427516 585448284 /nfs/dbraw/zinc/44/82/84/585448284.db2.gz UBAIQYLPHQBPQK-UHFFFAOYSA-N 1 2 228.292 2.035 20 0 BEADLO NC(Cc1cccs1)=[NH+]OCc1ccccn1 ZINC000767550562 585522367 /nfs/dbraw/zinc/52/23/67/585522367.db2.gz SPDYLGMPNNMDJD-UHFFFAOYSA-N 1 2 247.323 2.384 20 0 BEADLO Cc1cc(NC(=O)N[C@@H](C)c2ccc[nH]2)cc[nH+]1 ZINC000767896522 585527890 /nfs/dbraw/zinc/52/78/90/585527890.db2.gz GWKXNQLIMWSGMJ-JTQLQIEISA-N 1 2 244.298 2.023 20 0 BEADLO CCCOC(=O)[C@H](C)[N@H+](C)CCOC(C)(C)C ZINC000767905545 585528042 /nfs/dbraw/zinc/52/80/42/585528042.db2.gz PMBMEQKZJDJTSV-NSHDSACASA-N 1 2 245.363 2.075 20 0 BEADLO CCCOC(=O)[C@H](C)[N@@H+](C)CCOC(C)(C)C ZINC000767905545 585528043 /nfs/dbraw/zinc/52/80/43/585528043.db2.gz PMBMEQKZJDJTSV-NSHDSACASA-N 1 2 245.363 2.075 20 0 BEADLO C[C@@H]1CCC[C@H]1CC(=O)OCCn1cc[nH+]c1 ZINC000769184114 585550757 /nfs/dbraw/zinc/55/07/57/585550757.db2.gz QCGXXLPPJPFKFC-NEPJUHHUSA-N 1 2 236.315 2.253 20 0 BEADLO CCC/C=C\C(=O)N(C)CCCn1cc[nH+]c1 ZINC000769306419 585553320 /nfs/dbraw/zinc/55/33/20/585553320.db2.gz GWJOCEBEAPUNAZ-ALCCZGGFSA-N 1 2 235.331 2.088 20 0 BEADLO C[C@H]1C[C@@H]1C(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000769369635 585554684 /nfs/dbraw/zinc/55/46/84/585554684.db2.gz MWMFPWSNFLFXFD-SRVKXCTJSA-N 1 2 249.358 2.070 20 0 BEADLO C[C@H]1COCCC[N@@H+]1Cc1coc(C2CC2)n1 ZINC000769457162 585557619 /nfs/dbraw/zinc/55/76/19/585557619.db2.gz NZFJOASEFGGBKI-JTQLQIEISA-N 1 2 236.315 2.163 20 0 BEADLO C[C@H]1COCCC[N@H+]1Cc1coc(C2CC2)n1 ZINC000769457162 585557620 /nfs/dbraw/zinc/55/76/20/585557620.db2.gz NZFJOASEFGGBKI-JTQLQIEISA-N 1 2 236.315 2.163 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)[C@@H](F)c1ccccc1 ZINC000769575706 585559840 /nfs/dbraw/zinc/55/98/40/585559840.db2.gz QPQDESAZQVPVBF-LBPRGKRZSA-N 1 2 247.273 2.079 20 0 BEADLO O=c1ccnc(C=Cc2cccc3[nH+]ccn32)[nH]1 ZINC000769610969 585560715 /nfs/dbraw/zinc/56/07/15/585560715.db2.gz UKUBWYAZSQKWRN-PLNGDYQASA-N 1 2 238.250 2.000 20 0 BEADLO CCc1noc(C)c1[C@H](C)[NH2+]Cc1nccn1C ZINC000769872703 585565900 /nfs/dbraw/zinc/56/59/00/585565900.db2.gz KGCDALOBQGLCLA-VIFPVBQESA-N 1 2 248.330 2.130 20 0 BEADLO CC(C)(C)c1nc(N[C@](C)(CO)C2CC2)cc[nH+]1 ZINC000770463146 585574584 /nfs/dbraw/zinc/57/45/84/585574584.db2.gz RVKSAXMNJQCMLZ-CQSZACIVSA-N 1 2 249.358 2.347 20 0 BEADLO C[C@@H]1C[C@H]1C(=O)OCc1cccc2[nH+]ccn21 ZINC000770733474 585580534 /nfs/dbraw/zinc/58/05/34/585580534.db2.gz MLKPAYMRYUKYFU-MWLCHTKSSA-N 1 2 230.267 2.034 20 0 BEADLO CCC[C@@H](C)c1noc(Cn2cc[nH+]c2)n1 ZINC000770873762 585583301 /nfs/dbraw/zinc/58/33/01/585583301.db2.gz CMYUGPKSOYATBJ-SECBINFHSA-N 1 2 220.276 2.218 20 0 BEADLO O=C(/C=C\C1CC1)OCc1cccc2[nH+]ccn21 ZINC000770931192 585584651 /nfs/dbraw/zinc/58/46/51/585584651.db2.gz SMXMDJDSIZKPOA-SREVYHEPSA-N 1 2 242.278 2.344 20 0 BEADLO COc1cc[nH+]cc1COC(=O)c1c[nH]cc1C ZINC000805424040 585591841 /nfs/dbraw/zinc/59/18/41/585591841.db2.gz LPHWKARBKJYFGC-UHFFFAOYSA-N 1 2 246.266 2.084 20 0 BEADLO CCC/C(C)=C\C(=O)OCCn1cc[nH+]c1 ZINC000771935653 585604880 /nfs/dbraw/zinc/60/48/80/585604880.db2.gz BRLGGZJTAVASMP-LUAWRHEFSA-N 1 2 222.288 2.173 20 0 BEADLO O=C(CC1=CCCCC1)OCCn1cc[nH+]c1 ZINC000771959086 585605624 /nfs/dbraw/zinc/60/56/24/585605624.db2.gz OMXOVWOQDPOZRL-UHFFFAOYSA-N 1 2 234.299 2.317 20 0 BEADLO O=C(OCCn1cc[nH+]c1)[C@@H]1CC12CCCC2 ZINC000771984344 585606230 /nfs/dbraw/zinc/60/62/30/585606230.db2.gz NVFJXKNUPLSPGW-NSHDSACASA-N 1 2 234.299 2.007 20 0 BEADLO C[C@H]1CC[C@@H](CC(=O)OCCn2cc[nH+]c2)C1 ZINC000772002330 585606711 /nfs/dbraw/zinc/60/67/11/585606711.db2.gz HWTFSHNKQKMFFW-NWDGAFQWSA-N 1 2 236.315 2.253 20 0 BEADLO CC(C(=O)OCCn1cc[nH+]c1)=C1CCCC1 ZINC000772001822 585606726 /nfs/dbraw/zinc/60/67/26/585606726.db2.gz OPHXPXMEDNDXPX-UHFFFAOYSA-N 1 2 234.299 2.317 20 0 BEADLO CCC[C@H](C(=O)OCCn1cc[nH+]c1)C(C)C ZINC000772039096 585607377 /nfs/dbraw/zinc/60/73/77/585607377.db2.gz TVNYRKSVAMZGJG-LBPRGKRZSA-N 1 2 238.331 2.499 20 0 BEADLO Cc1ccc(COC(=O)c2ccn(C)c2)c(C)[nH+]1 ZINC000772189756 585609817 /nfs/dbraw/zinc/60/98/17/585609817.db2.gz HPOGYSFIADMICQ-UHFFFAOYSA-N 1 2 244.294 2.394 20 0 BEADLO C[C@H](CC(C)(C)C)C(=O)OCCn1cc[nH+]c1 ZINC000772612130 585619131 /nfs/dbraw/zinc/61/91/31/585619131.db2.gz OKMKHRMYUKFRHY-LLVKDONJSA-N 1 2 238.331 2.499 20 0 BEADLO CCCN(C)C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000772937791 585627759 /nfs/dbraw/zinc/62/77/59/585627759.db2.gz KBNNQAXLLAAREW-SNVBAGLBSA-N 1 2 236.319 2.008 20 0 BEADLO Cc1cc(NC(=O)C2(F)CCCC2)cc[nH+]1 ZINC000772972388 585628220 /nfs/dbraw/zinc/62/82/20/585628220.db2.gz HCHAZHKBWAVBJB-UHFFFAOYSA-N 1 2 222.263 2.033 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@H]1CCCC1(C)C ZINC000774138103 585651644 /nfs/dbraw/zinc/65/16/44/585651644.db2.gz KMYBAOUKBHQFDC-LLVKDONJSA-N 1 2 236.315 2.290 20 0 BEADLO CCc1cc(CNc2[nH]c3ccccc3[nH+]2)n[nH]1 ZINC000774530851 585660871 /nfs/dbraw/zinc/66/08/71/585660871.db2.gz WYYWZOACGAQMQW-UHFFFAOYSA-N 1 2 241.298 2.461 20 0 BEADLO CC(=O)c1c(F)cccc1NCc1[nH+]ccn1C ZINC000774528544 585661066 /nfs/dbraw/zinc/66/10/66/585661066.db2.gz FXCVJAOPLUSRML-UHFFFAOYSA-N 1 2 247.273 2.374 20 0 BEADLO Cc1ccc(CO[NH+]=C(N)CCO)c(Cl)c1 ZINC000774841156 585667174 /nfs/dbraw/zinc/66/71/74/585667174.db2.gz OBIMPNCPVSMMRK-UHFFFAOYSA-N 1 2 242.706 2.029 20 0 BEADLO CC[C@@H]([NH2+]Cc1cccc(F)n1)c1nccn1C ZINC000775413613 585677641 /nfs/dbraw/zinc/67/76/41/585677641.db2.gz HLVFPDXPUQMDNE-LLVKDONJSA-N 1 2 248.305 2.195 20 0 BEADLO COC(=O)[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1ccoc1 ZINC000775996959 585689280 /nfs/dbraw/zinc/68/92/80/585689280.db2.gz ATAPLWXBUOWALE-JQWIXIFHSA-N 1 2 237.299 2.053 20 0 BEADLO COC(=O)[C@@H]1C[C@@H](C)CC[N@H+]1Cc1ccoc1 ZINC000775996959 585689281 /nfs/dbraw/zinc/68/92/81/585689281.db2.gz ATAPLWXBUOWALE-JQWIXIFHSA-N 1 2 237.299 2.053 20 0 BEADLO C[C@H]1CC[C@H](C)N1C(=O)c1cccc2[nH+]ccn21 ZINC000777013605 585707297 /nfs/dbraw/zinc/70/72/97/585707297.db2.gz ZOEOYPSHJRQKPW-QWRGUYRKSA-N 1 2 243.310 2.347 20 0 BEADLO COc1ccc(N[C@H](C)C[C@H]2CCOC2)[nH+]c1 ZINC000777199866 585709353 /nfs/dbraw/zinc/70/93/53/585709353.db2.gz CMBOMYWDCWNYQB-GHMZBOCLSA-N 1 2 236.315 2.317 20 0 BEADLO C/C=C(/C)C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000777456506 585712785 /nfs/dbraw/zinc/71/27/85/585712785.db2.gz SAZWYVUXNLVJIG-KSXVILFYSA-N 1 2 219.288 2.039 20 0 BEADLO CCC/C=C/C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000777457968 585712957 /nfs/dbraw/zinc/71/29/57/585712957.db2.gz XIXJEOKUDWZXJO-ZPMKCOPCSA-N 1 2 233.315 2.430 20 0 BEADLO CCC/C=C\C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000777457965 585712993 /nfs/dbraw/zinc/71/29/93/585712993.db2.gz XIXJEOKUDWZXJO-IBHLPDHGSA-N 1 2 233.315 2.430 20 0 BEADLO Cc1ccc(OCc2c[nH+]cn2C)c(Cl)n1 ZINC000777592843 585716273 /nfs/dbraw/zinc/71/62/73/585716273.db2.gz CWFMWAOKEADLOG-UHFFFAOYSA-N 1 2 237.690 2.356 20 0 BEADLO CCCCOC(=O)[C@H](C)[N@@H+]1CC[C@H](C)[C@H](F)C1 ZINC000778230834 585728571 /nfs/dbraw/zinc/72/85/71/585728571.db2.gz CKZMGMPOVPXPBY-SDDRHHMPSA-N 1 2 245.338 2.398 20 0 BEADLO CCCCOC(=O)[C@H](C)[N@H+]1CC[C@H](C)[C@H](F)C1 ZINC000778230834 585728572 /nfs/dbraw/zinc/72/85/72/585728572.db2.gz CKZMGMPOVPXPBY-SDDRHHMPSA-N 1 2 245.338 2.398 20 0 BEADLO CCCOC(=O)[C@H](C)[N@@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000778232519 585728924 /nfs/dbraw/zinc/72/89/24/585728924.db2.gz FXJIAZGMKSKNHQ-DCAQKATOSA-N 1 2 231.311 2.008 20 0 BEADLO CCCOC(=O)[C@H](C)[N@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000778232519 585728925 /nfs/dbraw/zinc/72/89/25/585728925.db2.gz FXJIAZGMKSKNHQ-DCAQKATOSA-N 1 2 231.311 2.008 20 0 BEADLO CCC/C(C)=C\C(=O)N[C@@H]1CCn2cc[nH+]c2C1 ZINC000779097776 585745099 /nfs/dbraw/zinc/74/50/99/585745099.db2.gz XDLAYXUOYNAMFF-UCQJPZFISA-N 1 2 247.342 2.061 20 0 BEADLO CCC/C(C)=C/C(=O)N[C@@H]1CCn2cc[nH+]c2C1 ZINC000779097774 585745243 /nfs/dbraw/zinc/74/52/43/585745243.db2.gz XDLAYXUOYNAMFF-LMMOQWNQSA-N 1 2 247.342 2.061 20 0 BEADLO CC(C)[C@H]1C[N@H+](Cc2ccc(F)nc2)CCO1 ZINC000779165975 585746756 /nfs/dbraw/zinc/74/67/56/585746756.db2.gz IHWGUPDPDRJGJM-GFCCVEGCSA-N 1 2 238.306 2.078 20 0 BEADLO CC(C)[C@H]1C[N@@H+](Cc2ccc(F)nc2)CCO1 ZINC000779165975 585746757 /nfs/dbraw/zinc/74/67/57/585746757.db2.gz IHWGUPDPDRJGJM-GFCCVEGCSA-N 1 2 238.306 2.078 20 0 BEADLO C[C@@H](CCO)Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000779422287 585754773 /nfs/dbraw/zinc/75/47/73/585754773.db2.gz NAMGNKMLDUBLDQ-LBPRGKRZSA-N 1 2 249.358 2.255 20 0 BEADLO C[C@@H](CCO)[NH2+]c1ccc2c(c1)CCCN2C ZINC000779423824 585755008 /nfs/dbraw/zinc/75/50/08/585755008.db2.gz SSVWSUDFEIWKQA-NSHDSACASA-N 1 2 234.343 2.252 20 0 BEADLO C[C@@H](CCO)Nc1ccc2c(c1)CCC[N@H+]2C ZINC000779423824 585755009 /nfs/dbraw/zinc/75/50/09/585755009.db2.gz SSVWSUDFEIWKQA-NSHDSACASA-N 1 2 234.343 2.252 20 0 BEADLO C[C@@H](CCO)Nc1ccc2c(c1)CCC[N@@H+]2C ZINC000779423824 585755010 /nfs/dbraw/zinc/75/50/10/585755010.db2.gz SSVWSUDFEIWKQA-NSHDSACASA-N 1 2 234.343 2.252 20 0 BEADLO CCC(C)=C(C)C(=O)Nc1cc[nH+]cc1C ZINC000779926309 585769978 /nfs/dbraw/zinc/76/99/78/585769978.db2.gz SDMVPDIMNPANMT-LUAWRHEFSA-N 1 2 218.300 2.497 20 0 BEADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1ccon1 ZINC000780725353 585783583 /nfs/dbraw/zinc/78/35/83/585783583.db2.gz QHGKMRWOVCLFEF-SNVBAGLBSA-N 1 2 231.299 2.483 20 0 BEADLO CC/C(C)=C(\C)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000780944021 585787050 /nfs/dbraw/zinc/78/70/50/585787050.db2.gz QSUFTQYXLRBIQG-ZHACJKMWSA-N 1 2 233.315 2.013 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)C1CCCC1 ZINC000782006118 585806316 /nfs/dbraw/zinc/80/63/16/585806316.db2.gz IEKCWJNZPWEFFS-UHFFFAOYSA-N 1 2 222.288 2.007 20 0 BEADLO C[C@@H](CO)CSCc1cc[nH+]c(N(C)C)c1 ZINC000782111902 585807991 /nfs/dbraw/zinc/80/79/91/585807991.db2.gz LGXMFXNJEFCTRA-JTQLQIEISA-N 1 2 240.372 2.009 20 0 BEADLO CCn1cc[nH+]c1CNc1cccc2c1OCO2 ZINC000782217113 585812326 /nfs/dbraw/zinc/81/23/26/585812326.db2.gz ISXIEJDNEHVKIG-UHFFFAOYSA-N 1 2 245.282 2.244 20 0 BEADLO CC1(C(=O)OCCCn2cc[nH+]c2)CCCC1 ZINC000782233258 585812720 /nfs/dbraw/zinc/81/27/20/585812720.db2.gz WWSKQCFSQPSPII-UHFFFAOYSA-N 1 2 236.315 2.397 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2cnoc2C)cn1 ZINC000782526170 585819700 /nfs/dbraw/zinc/81/97/00/585819700.db2.gz HVVSQZXFGKFONQ-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2cnoc2C)cn1 ZINC000782526170 585819701 /nfs/dbraw/zinc/81/97/01/585819701.db2.gz HVVSQZXFGKFONQ-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO Cc1cc(C(=O)OCCCn2cc[nH+]c2)c(C)[nH]1 ZINC000782729104 585824188 /nfs/dbraw/zinc/82/41/88/585824188.db2.gz LTJUNANJOPLZQX-UHFFFAOYSA-N 1 2 247.298 2.075 20 0 BEADLO Cc1cn2c([nH+]1)CN(C(=O)C=C1CCCC1)CC2 ZINC000782728404 585824324 /nfs/dbraw/zinc/82/43/24/585824324.db2.gz QFTNPUPPPHTPIU-UHFFFAOYSA-N 1 2 245.326 2.034 20 0 BEADLO C(c1nnc(C2CC2)n1C1CC1)[N@@H+]1CC[C@@H]2C[C@@H]21 ZINC000782960619 585826568 /nfs/dbraw/zinc/82/65/68/585826568.db2.gz SVMDAWXVXGLVAD-PWSUYJOCSA-N 1 2 244.342 2.085 20 0 BEADLO C(c1nnc(C2CC2)n1C1CC1)[N@H+]1CC[C@@H]2C[C@@H]21 ZINC000782960619 585826569 /nfs/dbraw/zinc/82/65/69/585826569.db2.gz SVMDAWXVXGLVAD-PWSUYJOCSA-N 1 2 244.342 2.085 20 0 BEADLO C[C@@H]1C[C@H](CO[NH+]=C(N)c2ccccc2)CCO1 ZINC000783001296 585826871 /nfs/dbraw/zinc/82/68/71/585826871.db2.gz MFHIUQUSLOJQQO-VXGBXAGGSA-N 1 2 248.326 2.348 20 0 BEADLO c1cnn(-c2ccc([NH2+]CCC3CC3)cc2)n1 ZINC000783567183 585837345 /nfs/dbraw/zinc/83/73/45/585837345.db2.gz VIYPYBRSGSXVAA-UHFFFAOYSA-N 1 2 228.299 2.479 20 0 BEADLO Cc1nonc1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC000805747904 585837488 /nfs/dbraw/zinc/83/74/88/585837488.db2.gz JCMIHYXMNZCKJM-ZDUSSCGKSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1nonc1C[N@H+]1CCC[C@H]1c1cccnc1 ZINC000805747904 585837489 /nfs/dbraw/zinc/83/74/89/585837489.db2.gz JCMIHYXMNZCKJM-ZDUSSCGKSA-N 1 2 244.298 2.110 20 0 BEADLO CC1=C(C(=O)OCCCn2cc[nH+]c2)CCC1 ZINC000784307891 585855268 /nfs/dbraw/zinc/85/52/68/585855268.db2.gz XZJLCSVRMCHEGP-UHFFFAOYSA-N 1 2 234.299 2.317 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)OCCCn2cc[nH+]c2)C1 ZINC000784568018 585863673 /nfs/dbraw/zinc/86/36/73/585863673.db2.gz PZMZBRVIBLZRHT-NEPJUHHUSA-N 1 2 236.315 2.253 20 0 BEADLO CO[C@H]1Cc2ccc(NCc3[nH]cc[nH+]3)cc2C1 ZINC000784637578 585864984 /nfs/dbraw/zinc/86/49/84/585864984.db2.gz SGXGBCQROPDADN-ZDUSSCGKSA-N 1 2 243.310 2.135 20 0 BEADLO CC(C)C[C@H](C)C(=O)OCCCn1cc[nH+]c1 ZINC000784733765 585865694 /nfs/dbraw/zinc/86/56/94/585865694.db2.gz FBPHKGIKVFZPQG-LBPRGKRZSA-N 1 2 238.331 2.499 20 0 BEADLO CC[C@@H](C)CC(=O)OCCCn1cc[nH+]c1 ZINC000784923824 585868568 /nfs/dbraw/zinc/86/85/68/585868568.db2.gz DFAKDZZBCCGZKK-LLVKDONJSA-N 1 2 224.304 2.253 20 0 BEADLO CC[C@H](C)CC(=O)OCCCn1cc[nH+]c1 ZINC000784923825 585868598 /nfs/dbraw/zinc/86/85/98/585868598.db2.gz DFAKDZZBCCGZKK-NSHDSACASA-N 1 2 224.304 2.253 20 0 BEADLO C[C@@H](c1nc(CCc2ccccc2)no1)[NH+](C)C ZINC000785558979 585875479 /nfs/dbraw/zinc/87/54/79/585875479.db2.gz JJYAKBSHSHXVDH-NSHDSACASA-N 1 2 245.326 2.477 20 0 BEADLO FCC[N@@H+]1CCC[C@@H](Oc2ncccc2F)C1 ZINC000785839257 585881647 /nfs/dbraw/zinc/88/16/47/585881647.db2.gz TVTOWSUBBVDOOE-SNVBAGLBSA-N 1 2 242.269 2.033 20 0 BEADLO FCC[N@H+]1CCC[C@@H](Oc2ncccc2F)C1 ZINC000785839257 585881648 /nfs/dbraw/zinc/88/16/48/585881648.db2.gz TVTOWSUBBVDOOE-SNVBAGLBSA-N 1 2 242.269 2.033 20 0 BEADLO Fc1cc(C[N@@H+]2CCc3ncsc3C2)ccn1 ZINC000859270529 589026417 /nfs/dbraw/zinc/02/64/17/589026417.db2.gz SQKUQFNYZZIXJK-UHFFFAOYSA-N 1 2 249.314 2.236 20 0 BEADLO Fc1cc(C[N@H+]2CCc3ncsc3C2)ccn1 ZINC000859270529 589026419 /nfs/dbraw/zinc/02/64/19/589026419.db2.gz SQKUQFNYZZIXJK-UHFFFAOYSA-N 1 2 249.314 2.236 20 0 BEADLO CCCCCC[N@@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000787368500 585907891 /nfs/dbraw/zinc/90/78/91/585907891.db2.gz NQGMWGWOCURTCO-JTQLQIEISA-N 1 2 221.291 2.269 20 0 BEADLO CCCCCC[N@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000787368500 585907892 /nfs/dbraw/zinc/90/78/92/585907892.db2.gz NQGMWGWOCURTCO-JTQLQIEISA-N 1 2 221.291 2.269 20 0 BEADLO C[C@H](C1CC1)n1nccc1NCc1cn(C)c[nH+]1 ZINC000808384383 585911070 /nfs/dbraw/zinc/91/10/70/585911070.db2.gz GYLILKCANQPWSK-SNVBAGLBSA-N 1 2 245.330 2.200 20 0 BEADLO C/C=C(/CC)C(=O)N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000788933312 585932122 /nfs/dbraw/zinc/93/21/22/585932122.db2.gz SSJSGIKIRHSMOZ-CSXHZRMWSA-N 1 2 247.342 2.092 20 0 BEADLO NC(=[NH+]OCCCc1ccccc1)[C@@H]1CCCO1 ZINC000789608837 585946287 /nfs/dbraw/zinc/94/62/87/585946287.db2.gz DQMGBLUAJNUSBS-ZDUSSCGKSA-N 1 2 248.326 2.297 20 0 BEADLO CC(C)(C)SCCO[NH+]=C(N)[C@@H]1CCCO1 ZINC000789607880 585946318 /nfs/dbraw/zinc/94/63/18/585946318.db2.gz IWKXBINOPQEMKZ-VIFPVBQESA-N 1 2 246.376 2.196 20 0 BEADLO CC(C)CCCO[NH+]=C(N)[C@H]1CCCO1 ZINC000789608537 585946371 /nfs/dbraw/zinc/94/63/71/585946371.db2.gz KKXFIPBOCSGTOX-SNVBAGLBSA-N 1 2 214.309 2.100 20 0 BEADLO CC(C)C[C@@H](C)CO[NH+]=C(N)[C@@H]1CCCO1 ZINC000789608698 585946460 /nfs/dbraw/zinc/94/64/60/585946460.db2.gz LDUGSNBDIOHMCZ-MNOVXSKESA-N 1 2 228.336 2.346 20 0 BEADLO NC(=[NH+]OCC1CCCCC1)[C@@H]1CCCO1 ZINC000789613808 585946835 /nfs/dbraw/zinc/94/68/35/585946835.db2.gz VVTNWSYPBIMNJB-NSHDSACASA-N 1 2 226.320 2.244 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+]C[C@H](C)Cc1ccccc1 ZINC000789744620 585949333 /nfs/dbraw/zinc/94/93/33/585949333.db2.gz WYDFUINJJVAMCR-OLZOCXBDSA-N 1 2 249.354 2.406 20 0 BEADLO C/C=C(/CC)C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000789838886 585951354 /nfs/dbraw/zinc/95/13/54/585951354.db2.gz ITPNZPZYQZFRDK-LBQOUHFTSA-N 1 2 233.315 2.430 20 0 BEADLO CC(=O)OCc1ccc(-n2cc[nH+]c2)cc1C ZINC000791265107 585975773 /nfs/dbraw/zinc/97/57/73/585975773.db2.gz ABJIDJAGAJBQRR-UHFFFAOYSA-N 1 2 230.267 2.244 20 0 BEADLO CC1(CCNC(=O)c2cccc3[nH+]ccn32)CC1 ZINC000791808377 585988524 /nfs/dbraw/zinc/98/85/24/585988524.db2.gz XAUAJOURYLPWEE-UHFFFAOYSA-N 1 2 243.310 2.254 20 0 BEADLO Nc1cc(COC(=O)[C@H]2[C@@H]3CCCC[C@@H]32)cc[nH+]1 ZINC000791995123 585992885 /nfs/dbraw/zinc/99/28/85/585992885.db2.gz MRBRTKZMVDNXEE-PJXYFTJBSA-N 1 2 246.310 2.143 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)OCc1cc[nH+]c(N)c1 ZINC000792119225 585995948 /nfs/dbraw/zinc/99/59/48/585995948.db2.gz SMPVJLWYMUVQPF-VHSXEESVSA-N 1 2 236.315 2.389 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1C(=O)OCc1cc[nH+]c(N)c1 ZINC000792151122 585996741 /nfs/dbraw/zinc/99/67/41/585996741.db2.gz MGJOXABBUWSPDC-FZMZJTMJSA-N 1 2 248.326 2.389 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCC[C@H]2c2ncc[nH]2)c1 ZINC000792270010 585998628 /nfs/dbraw/zinc/99/86/28/585998628.db2.gz ZFJHFDQITYHLEP-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccnc(C[N@H+]2CCC[C@H]2c2ncc[nH]2)c1 ZINC000792270010 585998629 /nfs/dbraw/zinc/99/86/29/585998629.db2.gz ZFJHFDQITYHLEP-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO O=C1O[C@@H](C[N@H+]2CCC=C(F)C2)CC12CCC2 ZINC000792269942 585998688 /nfs/dbraw/zinc/99/86/88/585998688.db2.gz WUDDLOPGSODVRS-LLVKDONJSA-N 1 2 239.290 2.031 20 0 BEADLO O=C1O[C@@H](C[N@@H+]2CCC=C(F)C2)CC12CCC2 ZINC000792269942 585998689 /nfs/dbraw/zinc/99/86/89/585998689.db2.gz WUDDLOPGSODVRS-LLVKDONJSA-N 1 2 239.290 2.031 20 0 BEADLO C[C@H]([NH2+]Cc1ncccn1)c1ccc(Cl)nc1 ZINC000792303004 585999439 /nfs/dbraw/zinc/99/94/39/585999439.db2.gz VFOZJVJZZAIABQ-VIFPVBQESA-N 1 2 248.717 2.376 20 0 BEADLO CCn1ccc(C[N@H+](C)Cc2nccc(C)n2)c1 ZINC000792314651 585999609 /nfs/dbraw/zinc/99/96/09/585999609.db2.gz YMHSUWLHFYWYFS-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1ccc(C[N@@H+](C)Cc2nccc(C)n2)c1 ZINC000792314651 585999610 /nfs/dbraw/zinc/99/96/10/585999610.db2.gz YMHSUWLHFYWYFS-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCC/C(C)=C\C(=O)OCCc1c[nH+]cn1C ZINC000793249377 586014972 /nfs/dbraw/zinc/01/49/72/586014972.db2.gz FCCKUJFVGYOVIQ-FLIBITNWSA-N 1 2 236.315 2.252 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)/C=C\C(C)(C)C ZINC000793257544 586015406 /nfs/dbraw/zinc/01/54/06/586015406.db2.gz INHLYZCXJYGFAR-ALCCZGGFSA-N 1 2 236.315 2.108 20 0 BEADLO Cc1ccc(C[N@H+](CCO)Cc2ccoc2)o1 ZINC000793364753 586017449 /nfs/dbraw/zinc/01/74/49/586017449.db2.gz GIWQTOOPVZXRMZ-UHFFFAOYSA-N 1 2 235.283 2.176 20 0 BEADLO Cc1ccc(C[N@@H+](CCO)Cc2ccoc2)o1 ZINC000793364753 586017450 /nfs/dbraw/zinc/01/74/50/586017450.db2.gz GIWQTOOPVZXRMZ-UHFFFAOYSA-N 1 2 235.283 2.176 20 0 BEADLO O=C(CCC(F)F)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000793771411 586026364 /nfs/dbraw/zinc/02/63/64/586026364.db2.gz VGDYFDKFWRLPNZ-QMMMGPOBSA-N 1 2 243.257 2.119 20 0 BEADLO CC[C@H]1CC[N@@H+]1Cn1nc(C)n(CC)c1=S ZINC000793824576 586027406 /nfs/dbraw/zinc/02/74/06/586027406.db2.gz UAXJLJTWTBGXEW-JTQLQIEISA-N 1 2 240.376 2.184 20 0 BEADLO CC[C@H]1CC[N@H+]1Cn1nc(C)n(CC)c1=S ZINC000793824576 586027407 /nfs/dbraw/zinc/02/74/07/586027407.db2.gz UAXJLJTWTBGXEW-JTQLQIEISA-N 1 2 240.376 2.184 20 0 BEADLO CC[C@@H]1CC[N@@H+]1Cn1nc(C)sc1=S ZINC000793821030 586027470 /nfs/dbraw/zinc/02/74/70/586027470.db2.gz OBIVHNDZBWIIMJ-MRVPVSSYSA-N 1 2 229.374 2.424 20 0 BEADLO CC[C@@H]1CC[N@H+]1Cn1nc(C)sc1=S ZINC000793821030 586027471 /nfs/dbraw/zinc/02/74/71/586027471.db2.gz OBIVHNDZBWIIMJ-MRVPVSSYSA-N 1 2 229.374 2.424 20 0 BEADLO Cc1ccccc1CC(N)=[NH+]OC[C@@H]1CCCO1 ZINC000794522018 586041877 /nfs/dbraw/zinc/04/18/77/586041877.db2.gz MOKBAGJFASERBH-ZDUSSCGKSA-N 1 2 248.326 2.215 20 0 BEADLO Fc1cc(C[NH+]2CCC(F)(F)CC2)ccn1 ZINC000859289033 589027811 /nfs/dbraw/zinc/02/78/11/589027811.db2.gz CGAGBONULYDOCD-UHFFFAOYSA-N 1 2 230.233 2.452 20 0 BEADLO Fc1ccccc1C1(F)CN(Cc2c[nH+]c[nH]2)C1 ZINC000794925894 586055315 /nfs/dbraw/zinc/05/53/15/586055315.db2.gz AJLDTWVJZIRUIM-UHFFFAOYSA-N 1 2 249.264 2.229 20 0 BEADLO Fc1ccccc1C1(F)CN(Cc2c[nH]c[nH+]2)C1 ZINC000794925894 586055316 /nfs/dbraw/zinc/05/53/16/586055316.db2.gz AJLDTWVJZIRUIM-UHFFFAOYSA-N 1 2 249.264 2.229 20 0 BEADLO C[C@@H]1CN(c2cccc(F)c2)CC[N@@H+]1CCF ZINC000795187087 586070604 /nfs/dbraw/zinc/07/06/04/586070604.db2.gz FPAOUBSMSOEMPA-LLVKDONJSA-N 1 2 240.297 2.306 20 0 BEADLO C[C@@H]1CN(c2cccc(F)c2)CC[N@H+]1CCF ZINC000795187087 586070606 /nfs/dbraw/zinc/07/06/06/586070606.db2.gz FPAOUBSMSOEMPA-LLVKDONJSA-N 1 2 240.297 2.306 20 0 BEADLO CO[C@@H](C(=O)OCc1ccc(C)[nH+]c1C)C1CC1 ZINC000795831339 586092828 /nfs/dbraw/zinc/09/28/28/586092828.db2.gz DRVRVDYGISTUNN-CYBMUJFWSA-N 1 2 249.310 2.167 20 0 BEADLO Fc1ccc(C[NH+]2CCC(F)(F)CC2)nc1 ZINC000796539491 586106467 /nfs/dbraw/zinc/10/64/67/586106467.db2.gz AEYFMKHSDGMAMF-UHFFFAOYSA-N 1 2 230.233 2.452 20 0 BEADLO CO[C@H](C)C[N@H+](C)Cc1ncc(C(C)C)o1 ZINC000796642986 586109430 /nfs/dbraw/zinc/10/94/30/586109430.db2.gz VJQVRVMBVFMDPU-SNVBAGLBSA-N 1 2 226.320 2.265 20 0 BEADLO CO[C@H](C)C[N@@H+](C)Cc1ncc(C(C)C)o1 ZINC000796642986 586109431 /nfs/dbraw/zinc/10/94/31/586109431.db2.gz VJQVRVMBVFMDPU-SNVBAGLBSA-N 1 2 226.320 2.265 20 0 BEADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)OC ZINC000797776111 586131029 /nfs/dbraw/zinc/13/10/29/586131029.db2.gz NFWNOYBGTLBHMX-JTQLQIEISA-N 1 2 237.303 2.196 20 0 BEADLO COc1ccc(N[C@@H]2CCC23CCOCC3)[nH+]c1 ZINC000800486633 586222871 /nfs/dbraw/zinc/22/28/71/586222871.db2.gz NEMPFOGAGJNWPC-GFCCVEGCSA-N 1 2 248.326 2.461 20 0 BEADLO COc1ccc(N[C@H]2CCC23CCOCC3)[nH+]c1 ZINC000800486634 586223002 /nfs/dbraw/zinc/22/30/02/586223002.db2.gz NEMPFOGAGJNWPC-LBPRGKRZSA-N 1 2 248.326 2.461 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@H](C)c2nccnc2C)no1 ZINC000800502792 586223895 /nfs/dbraw/zinc/22/38/95/586223895.db2.gz GZSLVPASPLMGSS-GXSJLCMTSA-N 1 2 246.314 2.493 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)c1cccc(Cl)n1 ZINC000800853014 586234716 /nfs/dbraw/zinc/23/47/16/586234716.db2.gz RUFIXVATTWFUMO-UHFFFAOYSA-N 1 2 222.679 2.095 20 0 BEADLO C[C@H](c1ccccn1)[N@@H+]1CCO[C@@H](C(F)F)C1 ZINC000801559173 586262000 /nfs/dbraw/zinc/26/20/00/586262000.db2.gz FBCQQLRYLZMBER-MWLCHTKSSA-N 1 2 242.269 2.109 20 0 BEADLO C[C@H](c1ccccn1)[N@H+]1CCO[C@@H](C(F)F)C1 ZINC000801559173 586262001 /nfs/dbraw/zinc/26/20/01/586262001.db2.gz FBCQQLRYLZMBER-MWLCHTKSSA-N 1 2 242.269 2.109 20 0 BEADLO FC(F)[C@H]1C[N@H+](Cc2cccs2)CCO1 ZINC000801565153 586263682 /nfs/dbraw/zinc/26/36/82/586263682.db2.gz YEUOWOQBTBDHJW-SECBINFHSA-N 1 2 233.283 2.214 20 0 BEADLO FC(F)[C@H]1C[N@@H+](Cc2cccs2)CCO1 ZINC000801565153 586263683 /nfs/dbraw/zinc/26/36/83/586263683.db2.gz YEUOWOQBTBDHJW-SECBINFHSA-N 1 2 233.283 2.214 20 0 BEADLO C[C@H](c1cccnc1)[N@@H+]1CCO[C@@H](C(F)F)C1 ZINC000801566626 586264277 /nfs/dbraw/zinc/26/42/77/586264277.db2.gz DHZSSZQZROALAI-MWLCHTKSSA-N 1 2 242.269 2.109 20 0 BEADLO C[C@H](c1cccnc1)[N@H+]1CCO[C@@H](C(F)F)C1 ZINC000801566626 586264280 /nfs/dbraw/zinc/26/42/80/586264280.db2.gz DHZSSZQZROALAI-MWLCHTKSSA-N 1 2 242.269 2.109 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@@H](C(F)F)C2)o1 ZINC000802652582 586307703 /nfs/dbraw/zinc/30/77/03/586307703.db2.gz DXDBRVYLHLGGSM-SNVBAGLBSA-N 1 2 231.242 2.054 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@@H](C(F)F)C2)o1 ZINC000802652582 586307704 /nfs/dbraw/zinc/30/77/04/586307704.db2.gz DXDBRVYLHLGGSM-SNVBAGLBSA-N 1 2 231.242 2.054 20 0 BEADLO Cn1cc[nH+]c1CCCOC(=O)[C@@H]1CC12CCC2 ZINC000802786807 586314391 /nfs/dbraw/zinc/31/43/91/586314391.db2.gz ZELRRMDXYOBKJD-NSHDSACASA-N 1 2 248.326 2.086 20 0 BEADLO CC[NH2+]Cc1noc(Cc2ccc(CC)cc2)n1 ZINC000843144711 586432154 /nfs/dbraw/zinc/43/21/54/586432154.db2.gz INHSCMMHAGSBQX-UHFFFAOYSA-N 1 2 245.326 2.332 20 0 BEADLO C[C@@]1(F)CCC[N@H+](CN2CCSC2=S)C1 ZINC000840100996 586445833 /nfs/dbraw/zinc/44/58/33/586445833.db2.gz QSFWFASZJOTWNF-SNVBAGLBSA-N 1 2 248.392 2.102 20 0 BEADLO C[C@@]1(F)CCC[N@@H+](CN2CCSC2=S)C1 ZINC000840100996 586445835 /nfs/dbraw/zinc/44/58/35/586445835.db2.gz QSFWFASZJOTWNF-SNVBAGLBSA-N 1 2 248.392 2.102 20 0 BEADLO CC1(CC(=O)NC2=[NH+]CCS2)CCCC1 ZINC000808085592 586462377 /nfs/dbraw/zinc/46/23/77/586462377.db2.gz QNLPGRPBSRLSHQ-UHFFFAOYSA-N 1 2 226.345 2.176 20 0 BEADLO Cc1cc(N[C@H](C)[C@@H](O)c2ccccc2)nc[nH+]1 ZINC000808130750 586464206 /nfs/dbraw/zinc/46/42/06/586464206.db2.gz QJDPZJOKNSDVRK-BXUZGUMPSA-N 1 2 243.310 2.319 20 0 BEADLO CC(C)=CCO[NH+]=C(N)Cc1cccnc1 ZINC000808259693 586468886 /nfs/dbraw/zinc/46/88/86/586468886.db2.gz FFHUWXYRUZPWRI-UHFFFAOYSA-N 1 2 219.288 2.089 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OCCOC1CCC1 ZINC000808243950 586468973 /nfs/dbraw/zinc/46/89/73/586468973.db2.gz LGRBUKMRHVQILG-UHFFFAOYSA-N 1 2 248.326 2.411 20 0 BEADLO Cn1cnc(C[NH2+]Cc2cc3ccccc3o2)c1 ZINC000808379298 586470399 /nfs/dbraw/zinc/47/03/99/586470399.db2.gz KXLNNUZNOICORB-UHFFFAOYSA-N 1 2 241.294 2.456 20 0 BEADLO Cc1nc(CC[N@@H+]2Cc3ccncc3C2)cs1 ZINC000809565187 586507344 /nfs/dbraw/zinc/50/73/44/586507344.db2.gz WQGDDOPZZPOZSH-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1nc(CC[N@H+]2Cc3ccncc3C2)cs1 ZINC000809565187 586507346 /nfs/dbraw/zinc/50/73/46/586507346.db2.gz WQGDDOPZZPOZSH-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO FC(F)C[C@H]1COCC[N@@H+]1Cc1ccoc1 ZINC000809712526 586514534 /nfs/dbraw/zinc/51/45/34/586514534.db2.gz PPYXFYUZBUWRHR-JTQLQIEISA-N 1 2 231.242 2.136 20 0 BEADLO FC(F)C[C@H]1COCC[N@H+]1Cc1ccoc1 ZINC000809712526 586514536 /nfs/dbraw/zinc/51/45/36/586514536.db2.gz PPYXFYUZBUWRHR-JTQLQIEISA-N 1 2 231.242 2.136 20 0 BEADLO Cc1noc([C@@H]2CCC[N@@H+]2Cc2ccoc2)n1 ZINC000809721765 586514954 /nfs/dbraw/zinc/51/49/54/586514954.db2.gz ZYLMMERUWYGKAQ-NSHDSACASA-N 1 2 233.271 2.308 20 0 BEADLO Cc1noc([C@@H]2CCC[N@H+]2Cc2ccoc2)n1 ZINC000809721765 586514956 /nfs/dbraw/zinc/51/49/56/586514956.db2.gz ZYLMMERUWYGKAQ-NSHDSACASA-N 1 2 233.271 2.308 20 0 BEADLO Cc1nonc1C[NH2+]Cc1ccc2occc2c1 ZINC000809744240 586516768 /nfs/dbraw/zinc/51/67/68/586516768.db2.gz BZERQKYQYCFLIA-UHFFFAOYSA-N 1 2 243.266 2.414 20 0 BEADLO CC[C@@H](O)c1nccn1Cc1ccc(C)[nH+]c1C ZINC000810005247 586530761 /nfs/dbraw/zinc/53/07/61/586530761.db2.gz KCKLSWLZGGBOIP-CYBMUJFWSA-N 1 2 245.326 2.387 20 0 BEADLO Cc1ccc(C)c(C[NH2+][C@]2(C)CCOC2=O)c1 ZINC000810096235 586533649 /nfs/dbraw/zinc/53/36/49/586533649.db2.gz IJTQDMHIZFAJAB-CQSZACIVSA-N 1 2 233.311 2.099 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2cccc(F)n2)no1 ZINC000810228065 586537264 /nfs/dbraw/zinc/53/72/64/586537264.db2.gz QSYMUFVCQBUGTF-SECBINFHSA-N 1 2 235.262 2.368 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2cccc(F)n2)no1 ZINC000810228066 586537563 /nfs/dbraw/zinc/53/75/63/586537563.db2.gz QSYMUFVCQBUGTF-VIFPVBQESA-N 1 2 235.262 2.368 20 0 BEADLO Cc1cc(COCc2[nH]cc[nH+]2)cc(Cl)n1 ZINC000840202521 586539035 /nfs/dbraw/zinc/53/90/35/586539035.db2.gz CLYPRVMBSHCKDZ-UHFFFAOYSA-N 1 2 237.690 2.483 20 0 BEADLO Cc1cc(C(F)(F)F)nn1C[NH+]1CCCC1 ZINC000811727151 586566484 /nfs/dbraw/zinc/56/64/84/586566484.db2.gz UQCKJETZLUCCSE-UHFFFAOYSA-N 1 2 233.237 2.264 20 0 BEADLO C/C(=C\C(=O)N1CCn2c[nH+]cc2C1)C(C)(C)C ZINC000811934229 586568769 /nfs/dbraw/zinc/56/87/69/586568769.db2.gz YQARXRIYVQPGCY-YRNVUSSQSA-N 1 2 247.342 2.218 20 0 BEADLO C[C@@]1([NH2+]C[C@@H]2C[C@H]2c2ccccc2)CCOC1=O ZINC000812844643 586587853 /nfs/dbraw/zinc/58/78/53/586587853.db2.gz LHGMMPGMSNQBRF-KCQAQPDRSA-N 1 2 245.322 2.085 20 0 BEADLO CC[C@@H](C)CONc1cc(-n2cc[nH+]c2)ncn1 ZINC000813621657 586604505 /nfs/dbraw/zinc/60/45/05/586604505.db2.gz CZUSSNRAOBJKOZ-SNVBAGLBSA-N 1 2 247.302 2.052 20 0 BEADLO C[N@H+](Cc1ccsc1)[C@H]1CC(C)(C)OC1=O ZINC000814179838 586615460 /nfs/dbraw/zinc/61/54/60/586615460.db2.gz HRDMKVFDRZYQNP-JTQLQIEISA-N 1 2 239.340 2.274 20 0 BEADLO C[N@@H+](Cc1ccsc1)[C@H]1CC(C)(C)OC1=O ZINC000814179838 586615461 /nfs/dbraw/zinc/61/54/61/586615461.db2.gz HRDMKVFDRZYQNP-JTQLQIEISA-N 1 2 239.340 2.274 20 0 BEADLO CC(C)CO[C@@H](C)C(N)=[NH+]OC1CCC1 ZINC000814265065 586620905 /nfs/dbraw/zinc/62/09/05/586620905.db2.gz MLOCMBUIKKAIHJ-VIFPVBQESA-N 1 2 214.309 2.098 20 0 BEADLO Cc1cnc(COc2cc[nH+]cc2)s1 ZINC000814266210 586620959 /nfs/dbraw/zinc/62/09/59/586620959.db2.gz YPFMLFHPTJUQHD-UHFFFAOYSA-N 1 2 206.270 2.426 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)OC[C@@H]3C[C@H]3C)ccn12 ZINC000859734467 589057926 /nfs/dbraw/zinc/05/79/26/589057926.db2.gz CCKPGNIXJKKZLW-SKDRFNHKSA-N 1 2 244.294 2.456 20 0 BEADLO CCc1nocc1C[NH2+]Cc1cccnc1F ZINC000815138511 586669803 /nfs/dbraw/zinc/66/98/03/586669803.db2.gz UVCXRSHTIMJENQ-UHFFFAOYSA-N 1 2 235.262 2.061 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnn(C)c2Cl)CCS1 ZINC000816502999 586737429 /nfs/dbraw/zinc/73/74/29/586737429.db2.gz ZEHZLSKYLIZVTL-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnn(C)c2Cl)CCS1 ZINC000816502999 586737430 /nfs/dbraw/zinc/73/74/30/586737430.db2.gz ZEHZLSKYLIZVTL-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cnn(C)c2Cl)C[C@@H]1F ZINC000816564565 586740305 /nfs/dbraw/zinc/74/03/05/586740305.db2.gz JTPIAVUMFRWEAH-SCZZXKLOSA-N 1 2 245.729 2.253 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cnn(C)c2Cl)C[C@@H]1F ZINC000816564565 586740307 /nfs/dbraw/zinc/74/03/07/586740307.db2.gz JTPIAVUMFRWEAH-SCZZXKLOSA-N 1 2 245.729 2.253 20 0 BEADLO C[C@H]1CC[N@H+](Cc2cnn(C)c2Cl)C[C@H]1F ZINC000816564566 586740497 /nfs/dbraw/zinc/74/04/97/586740497.db2.gz JTPIAVUMFRWEAH-WCBMZHEXSA-N 1 2 245.729 2.253 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2cnn(C)c2Cl)C[C@H]1F ZINC000816564566 586740500 /nfs/dbraw/zinc/74/05/00/586740500.db2.gz JTPIAVUMFRWEAH-WCBMZHEXSA-N 1 2 245.729 2.253 20 0 BEADLO C[C@@H]1CC/C(=C/C(=O)N2CCc3[nH]c[nH+]c3C2)C1 ZINC000816651348 586752874 /nfs/dbraw/zinc/75/28/74/586752874.db2.gz DFAHASBXLQJSPO-PAKSIRSJSA-N 1 2 245.326 2.041 20 0 BEADLO C[C@@H]1CC/C(=C/C(=O)N2CCc3[nH+]c[nH]c3C2)C1 ZINC000816651348 586752875 /nfs/dbraw/zinc/75/28/75/586752875.db2.gz DFAHASBXLQJSPO-PAKSIRSJSA-N 1 2 245.326 2.041 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)NCCCC1CCCC1 ZINC000816846389 586768103 /nfs/dbraw/zinc/76/81/03/586768103.db2.gz YXSSPMIYHHCFPR-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@@H+]1CCC(F)(F)C[C@@H]1C ZINC000859836793 589064776 /nfs/dbraw/zinc/06/47/76/589064776.db2.gz ZLBFGDWMXSWCNZ-VHSXEESVSA-N 1 2 249.301 2.448 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@H+]1CCC(F)(F)C[C@@H]1C ZINC000859836793 589064778 /nfs/dbraw/zinc/06/47/78/589064778.db2.gz ZLBFGDWMXSWCNZ-VHSXEESVSA-N 1 2 249.301 2.448 20 0 BEADLO CCC/C(C)=C/C(=O)NCc1c[nH+]ccc1OC ZINC000817086750 586781392 /nfs/dbraw/zinc/78/13/92/586781392.db2.gz JUXRJJOAXYJNPG-DHZHZOJOSA-N 1 2 248.326 2.453 20 0 BEADLO COC(=O)N(C)[C@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000817497660 586808120 /nfs/dbraw/zinc/80/81/20/586808120.db2.gz XDWQFKCJJNNESN-NSHDSACASA-N 1 2 245.282 2.197 20 0 BEADLO CC(C)CC(=O)CC[N@@H+]1CCO[C@@H](CCF)C1 ZINC000859908312 589069886 /nfs/dbraw/zinc/06/98/86/589069886.db2.gz FYCRKVPIKGOWRF-ZDUSSCGKSA-N 1 2 245.338 2.052 20 0 BEADLO CC(C)CC(=O)CC[N@H+]1CCO[C@@H](CCF)C1 ZINC000859908312 589069888 /nfs/dbraw/zinc/06/98/88/589069888.db2.gz FYCRKVPIKGOWRF-ZDUSSCGKSA-N 1 2 245.338 2.052 20 0 BEADLO C[C@@H]1CC/C(=C/C(=O)Nc2ccc(N)[nH+]c2)C1 ZINC000818541226 586898962 /nfs/dbraw/zinc/89/89/62/586898962.db2.gz QDMJGRXAMURPKF-SBMLRHLQSA-N 1 2 231.299 2.349 20 0 BEADLO C[C@@H](CC(=O)Nc1ccc(N)[nH+]c1)C1CC1 ZINC000818541253 586898988 /nfs/dbraw/zinc/89/89/88/586898988.db2.gz SPLPIGXVMRZCNC-QMMMGPOBSA-N 1 2 219.288 2.039 20 0 BEADLO CCC/C(C)=C\C(=O)Nc1ccc(N)[nH+]c1 ZINC000818541307 586899075 /nfs/dbraw/zinc/89/90/75/586899075.db2.gz ZURUTZMHZKGYSY-CLFYSBASSA-N 1 2 219.288 2.349 20 0 BEADLO C[C@@H]1CCCC[C@H]1C(=O)NC1=[NH+]CCS1 ZINC000819031586 586925648 /nfs/dbraw/zinc/92/56/48/586925648.db2.gz SSRSSIUEFLBDBR-RKDXNWHRSA-N 1 2 226.345 2.032 20 0 BEADLO Cc1cc(NC(=O)C(F)=C2CCC2)cc[nH+]1 ZINC000819275120 586946458 /nfs/dbraw/zinc/94/64/58/586946458.db2.gz MPVAGSAVBZJDNZ-UHFFFAOYSA-N 1 2 220.247 2.158 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ccns1)c1csnn1 ZINC000860061549 589076911 /nfs/dbraw/zinc/07/69/11/589076911.db2.gz LCGNBFITVIWDDI-RNFRBKRXSA-N 1 2 240.357 2.406 20 0 BEADLO Cc1cc(F)ccc1[C@@H](O)C[NH2+]CC(C)(F)F ZINC000819331894 586953173 /nfs/dbraw/zinc/95/31/73/586953173.db2.gz FHEVKENYVFOUEV-NSHDSACASA-N 1 2 247.260 2.412 20 0 BEADLO Cc1cc(NC[C@H](O)C2CC2)ccc1[NH+](C)C ZINC000819409155 586961983 /nfs/dbraw/zinc/96/19/83/586961983.db2.gz XSOMKMUTVCIVBB-AWEZNQCLSA-N 1 2 234.343 2.244 20 0 BEADLO CC(C)CCC(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819761964 586990934 /nfs/dbraw/zinc/99/09/34/586990934.db2.gz APOZDRITVFEGDZ-QMMMGPOBSA-N 1 2 214.334 2.030 20 0 BEADLO CCC/C(C)=C\C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819764120 586991145 /nfs/dbraw/zinc/99/11/45/586991145.db2.gz BNKMXOVSMULVMI-JGAIRUGNSA-N 1 2 226.345 2.340 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)CC(C)(C)C)S1 ZINC000819767143 586991719 /nfs/dbraw/zinc/99/17/19/586991719.db2.gz DEEIQBTVYBEPOH-ZETCQYMHSA-N 1 2 214.334 2.030 20 0 BEADLO C[C@@H](CC(=O)NC1=[NH+]C[C@H](C)S1)C1CC1 ZINC000819766436 586991910 /nfs/dbraw/zinc/99/19/10/586991910.db2.gz OGJFVNHVXUFCAM-YUMQZZPRSA-N 1 2 226.345 2.030 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)[C@@H]2CCC(C)(C)C2)S1 ZINC000819775637 586992215 /nfs/dbraw/zinc/99/22/15/586992215.db2.gz IRZNCFVRDXCONO-DTWKUNHWSA-N 1 2 240.372 2.420 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819775893 586992446 /nfs/dbraw/zinc/99/24/46/586992446.db2.gz KMSCGQPUQLLYBV-DJLDLDEBSA-N 1 2 228.361 2.276 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)C[C@@H]2CCC[C@@H]2C)S1 ZINC000819775809 586992539 /nfs/dbraw/zinc/99/25/39/586992539.db2.gz JNOWCEHMULUONU-AEJSXWLSSA-N 1 2 240.372 2.420 20 0 BEADLO CC[C@H](C)CCC(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819777465 586993147 /nfs/dbraw/zinc/99/31/47/586993147.db2.gz JIBIOJOMHHUKKF-DTWKUNHWSA-N 1 2 228.361 2.420 20 0 BEADLO C[C@@H](C(=O)NC1=[NH+]C[C@@H](C)S1)C1CCC1 ZINC000819780084 586993806 /nfs/dbraw/zinc/99/38/06/586993806.db2.gz DADKYYJKROXFQI-HTQZYQBOSA-N 1 2 226.345 2.030 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1C(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819780168 586993834 /nfs/dbraw/zinc/99/38/34/586993834.db2.gz FRJHUZRSNSIGDK-IVZWLZJFSA-N 1 2 240.372 2.276 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)[C@H]2CCCC2(C)C)S1 ZINC000819781192 586993992 /nfs/dbraw/zinc/99/39/92/586993992.db2.gz JIWWIGSCVFVMGE-DTWKUNHWSA-N 1 2 240.372 2.420 20 0 BEADLO CC(C)C(C)(C)C(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819783367 586994590 /nfs/dbraw/zinc/99/45/90/586994590.db2.gz SIZZBXUUAFFTEL-QMMMGPOBSA-N 1 2 228.361 2.276 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)C(C)(C)C2CCC2)S1 ZINC000819782399 586994664 /nfs/dbraw/zinc/99/46/64/586994664.db2.gz UZKGSDZCPASUKV-MRVPVSSYSA-N 1 2 240.372 2.420 20 0 BEADLO C=C/C(C)=C\CC(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819783966 586994955 /nfs/dbraw/zinc/99/49/55/586994955.db2.gz VKIAPYGVUXLLDV-RDOCRHDPSA-N 1 2 224.329 2.116 20 0 BEADLO Cc1c[nH+]ccc1CCNc1ccc(Cl)nn1 ZINC000819922358 587002509 /nfs/dbraw/zinc/00/25/09/587002509.db2.gz BMCKPKRZGHKNQS-UHFFFAOYSA-N 1 2 248.717 2.488 20 0 BEADLO O=C(C=C1CCCCC1)N1CCc2[nH]c[nH+]c2C1 ZINC000819967571 587008497 /nfs/dbraw/zinc/00/84/97/587008497.db2.gz HPGNPGZJIVPGAM-UHFFFAOYSA-N 1 2 245.326 2.185 20 0 BEADLO O=C(C=C1CCCCC1)N1CCc2[nH+]c[nH]c2C1 ZINC000819967571 587008499 /nfs/dbraw/zinc/00/84/99/587008499.db2.gz HPGNPGZJIVPGAM-UHFFFAOYSA-N 1 2 245.326 2.185 20 0 BEADLO CC=C(C=CC(=O)N1CCc2[nH]c[nH+]c2C1)CC ZINC000819967852 587008776 /nfs/dbraw/zinc/00/87/76/587008776.db2.gz NXNUZPOUICKYLH-YOYJXUCXSA-N 1 2 245.326 2.207 20 0 BEADLO CC=C(C=CC(=O)N1CCc2[nH+]c[nH]c2C1)CC ZINC000819967852 587008778 /nfs/dbraw/zinc/00/87/78/587008778.db2.gz NXNUZPOUICKYLH-YOYJXUCXSA-N 1 2 245.326 2.207 20 0 BEADLO CCC1(C)CN(C(=O)c2cc3c[nH+]ccc3[nH]2)C1 ZINC000819969350 587009162 /nfs/dbraw/zinc/00/91/62/587009162.db2.gz MOEUQMPHINIPGR-UHFFFAOYSA-N 1 2 243.310 2.435 20 0 BEADLO CC(C)C[C@@H](C(=O)N1CCC1(C)C)n1cc[nH+]c1 ZINC000820176766 587032040 /nfs/dbraw/zinc/03/20/40/587032040.db2.gz IHPNSNWCUPISHC-LBPRGKRZSA-N 1 2 249.358 2.481 20 0 BEADLO C/C=C(/C=C\C(=O)N[C@H](C)c1[nH]cc[nH+]1)CC ZINC000820267871 587039386 /nfs/dbraw/zinc/03/93/86/587039386.db2.gz LDRWGRPEUCYLIR-IHDDOFGNSA-N 1 2 233.315 2.499 20 0 BEADLO CCc1c[nH]c(CC(=O)N2C[C@H](C)CC2(C)C)[nH+]1 ZINC000820526352 587052768 /nfs/dbraw/zinc/05/27/68/587052768.db2.gz KXJCDLCSCLDTRL-SNVBAGLBSA-N 1 2 249.358 2.162 20 0 BEADLO CCC1(CC)CN(C(=O)/C=C/c2cn(C)c[nH+]2)C1 ZINC000820599657 587058029 /nfs/dbraw/zinc/05/80/29/587058029.db2.gz ZFYAWVAOBOOXDC-VOTSOKGWSA-N 1 2 247.342 2.082 20 0 BEADLO Clc1ccc2c(n1)[C@H]([NH2+]Cc1cc[nH]n1)CC2 ZINC000820810164 587073858 /nfs/dbraw/zinc/07/38/58/587073858.db2.gz QPTMPIHVIABZPA-SNVBAGLBSA-N 1 2 248.717 2.235 20 0 BEADLO CC[C@@H](NC(=O)Cc1[nH]cc[nH+]1)c1ccccc1 ZINC000821023700 587089563 /nfs/dbraw/zinc/08/95/63/587089563.db2.gz TUTDVWLUPYKZJW-GFCCVEGCSA-N 1 2 243.310 2.220 20 0 BEADLO Cc1ccc(C2CC[NH+]([C@H](C)C(=O)[O-])CC2)c[nH+]1 ZINC000821076178 587094386 /nfs/dbraw/zinc/09/43/86/587094386.db2.gz VBYCKDYSSULQMT-LLVKDONJSA-N 1 2 248.326 2.043 20 0 BEADLO O=C(c1cc2c[nH+]ccc2[nH]1)N1CC[C@H]1C1CC1 ZINC000821149987 587098909 /nfs/dbraw/zinc/09/89/09/587098909.db2.gz UCCSMHWMUUXWLI-ZDUSSCGKSA-N 1 2 241.294 2.187 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)[C@H]1CCCC12CC2 ZINC000860175096 589086725 /nfs/dbraw/zinc/08/67/25/589086725.db2.gz DUBMIJBQIFXUGZ-GFCCVEGCSA-N 1 2 248.326 2.086 20 0 BEADLO O=C(OCCn1cc[nH+]c1)[C@H]1CCCC12CC2 ZINC000860174277 589086753 /nfs/dbraw/zinc/08/67/53/589086753.db2.gz LYJPCFJPGBJAAE-LLVKDONJSA-N 1 2 234.299 2.007 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)[C@@]2(C)C=CCC2)c2[nH+]ccn21 ZINC000821786946 587138033 /nfs/dbraw/zinc/13/80/33/587138033.db2.gz PJNURRMEIMXTRH-SUNKGSAMSA-N 1 2 245.326 2.361 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)NC2=[NH+]CCS2)C[C@H]1C ZINC000822234313 587158935 /nfs/dbraw/zinc/15/89/35/587158935.db2.gz OEEMYTHXEIRDQH-BBBLOLIVSA-N 1 2 240.372 2.278 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NC2=[NH+]CCS2)C[C@H]1C ZINC000822234315 587159005 /nfs/dbraw/zinc/15/90/05/587159005.db2.gz OEEMYTHXEIRDQH-OPRDCNLKSA-N 1 2 240.372 2.278 20 0 BEADLO CCC[C@@H](CC)C(=O)N[C@H]1CCc2c[nH+]cn2C1 ZINC000822861257 587189853 /nfs/dbraw/zinc/18/98/53/587189853.db2.gz IUUIEFGJPLUKCP-NEPJUHHUSA-N 1 2 249.358 2.140 20 0 BEADLO CCC(F)(F)C(=O)Nc1ccc[nH+]c1N(C)C ZINC000823178115 587206444 /nfs/dbraw/zinc/20/64/44/587206444.db2.gz MKLPPFHTJWHVCR-UHFFFAOYSA-N 1 2 243.257 2.131 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)CCC2(C)CC2)S1 ZINC000823307874 587215403 /nfs/dbraw/zinc/21/54/03/587215403.db2.gz XTMLRGSIGONMFX-MRVPVSSYSA-N 1 2 226.345 2.174 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)C[C@@H]2CC=CCC2)S1 ZINC000823307404 587215578 /nfs/dbraw/zinc/21/55/78/587215578.db2.gz SXUSZPOJGBYOSG-VHSXEESVSA-N 1 2 238.356 2.340 20 0 BEADLO CCC[C@@H]([NH2+][C@H](CF)C(=O)OC)C1CCCC1 ZINC000824396973 587269107 /nfs/dbraw/zinc/26/91/07/587269107.db2.gz WLZGIKZVBWIAHR-VXGBXAGGSA-N 1 2 245.338 2.446 20 0 BEADLO CCC[C@H]([NH2+][C@H](CF)C(=O)OC)C1CCCC1 ZINC000824396970 587269324 /nfs/dbraw/zinc/26/93/24/587269324.db2.gz WLZGIKZVBWIAHR-NWDGAFQWSA-N 1 2 245.338 2.446 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1ccnc(Cl)c1F ZINC000824434879 587270664 /nfs/dbraw/zinc/27/06/64/587270664.db2.gz TYEXNVMPMUATHY-SECBINFHSA-N 1 2 244.697 2.095 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1ccnc(Cl)c1F ZINC000824434879 587270666 /nfs/dbraw/zinc/27/06/66/587270666.db2.gz TYEXNVMPMUATHY-SECBINFHSA-N 1 2 244.697 2.095 20 0 BEADLO CC(C)(C)c1ncc(C[NH+]2CC3(CC3)C2)cn1 ZINC000824533560 587274669 /nfs/dbraw/zinc/27/46/69/587274669.db2.gz ICPSTLZKYJCAOF-UHFFFAOYSA-N 1 2 231.343 2.370 20 0 BEADLO CCc1nn(C)c(Cl)c1C[N@@H+]1CC[C@@H](F)C1 ZINC000824570371 587277252 /nfs/dbraw/zinc/27/72/52/587277252.db2.gz CQLKGEBLOXDNCJ-MRVPVSSYSA-N 1 2 245.729 2.180 20 0 BEADLO CCc1nn(C)c(Cl)c1C[N@H+]1CC[C@@H](F)C1 ZINC000824570371 587277253 /nfs/dbraw/zinc/27/72/53/587277253.db2.gz CQLKGEBLOXDNCJ-MRVPVSSYSA-N 1 2 245.729 2.180 20 0 BEADLO Cc1cc(C[NH2+]Cc2nnc(C3CC3)[nH]2)c(C)o1 ZINC000824602908 587279109 /nfs/dbraw/zinc/27/91/09/587279109.db2.gz GNYNMWXWBMSCIK-UHFFFAOYSA-N 1 2 246.314 2.182 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)[C@@H]1CC[C@@H]2C[C@@H]2CC1 ZINC000824629514 587280305 /nfs/dbraw/zinc/28/03/05/587280305.db2.gz UZTAWCDQGUXVQQ-CNDDSTCGSA-N 1 2 247.342 2.194 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)[C@@H]1CC[C@@H]2C[C@@H]2CC1 ZINC000824629514 587280306 /nfs/dbraw/zinc/28/03/06/587280306.db2.gz UZTAWCDQGUXVQQ-CNDDSTCGSA-N 1 2 247.342 2.194 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C(C)(C)SC ZINC000824894795 587292056 /nfs/dbraw/zinc/29/20/56/587292056.db2.gz KDEXHQCDMAGLIL-UHFFFAOYSA-N 1 2 240.328 2.170 20 0 BEADLO CC(C)(C)C[NH2+]c1ccc(O[C@H]2CC(=O)N2)cc1 ZINC000824999022 587297979 /nfs/dbraw/zinc/29/79/79/587297979.db2.gz GHFOCGJXFOKLNT-ZDUSSCGKSA-N 1 2 248.326 2.369 20 0 BEADLO CCC(CC)Nc1[nH+]ccc(C)c1-c1nn[nH]n1 ZINC000825108356 587305097 /nfs/dbraw/zinc/30/50/97/587305097.db2.gz WHMDWNFJNDCHSO-UHFFFAOYSA-N 1 2 246.318 2.171 20 0 BEADLO CCCC[C@H]1CCC[C@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000825773730 587338248 /nfs/dbraw/zinc/33/82/48/587338248.db2.gz OKJANQIQOGGRDW-NWDGAFQWSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@@]1(F)CCCN(Cc2c[nH+]c3n2CCC3)C1 ZINC000826029445 587348613 /nfs/dbraw/zinc/34/86/13/587348613.db2.gz FRJRIILWKAIEGI-CYBMUJFWSA-N 1 2 237.322 2.153 20 0 BEADLO CC(C)[C@@H]1CCC[C@@H](NC(=O)Cc2[nH]cc[nH+]2)C1 ZINC000826131770 587351263 /nfs/dbraw/zinc/35/12/63/587351263.db2.gz ZWSKQAZKFYPBHG-VXGBXAGGSA-N 1 2 249.358 2.283 20 0 BEADLO CCc1ccc(C[N@H+](CCF)CCOC)o1 ZINC000827053846 587369252 /nfs/dbraw/zinc/36/92/52/587369252.db2.gz HNRYYDIFVVXFIS-UHFFFAOYSA-N 1 2 229.295 2.260 20 0 BEADLO CCc1ccc(C[N@@H+](CCF)CCOC)o1 ZINC000827053846 587369253 /nfs/dbraw/zinc/36/92/53/587369253.db2.gz HNRYYDIFVVXFIS-UHFFFAOYSA-N 1 2 229.295 2.260 20 0 BEADLO CCC(F)(F)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000827401507 587379858 /nfs/dbraw/zinc/37/98/58/587379858.db2.gz YJBQTRJCMRLUFT-UHFFFAOYSA-N 1 2 239.225 2.318 20 0 BEADLO c1cn2c([nH+]1)[C@@H](Nc1ccnc(C3CC3)n1)CC2 ZINC000828359257 587438429 /nfs/dbraw/zinc/43/84/29/587438429.db2.gz ZBVBQKXLTWVGIJ-JTQLQIEISA-N 1 2 241.298 2.107 20 0 BEADLO CCC[C@@H]1[C@@H](C)CCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC000829016236 587480025 /nfs/dbraw/zinc/48/00/25/587480025.db2.gz PXVJBIINUPGFGT-NWDGAFQWSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H]1c2ccccc2CN1C(=O)Cc1[nH]cc[nH+]1 ZINC000829476600 587499751 /nfs/dbraw/zinc/49/97/51/587499751.db2.gz HJAJGQZGPIZWFK-JTQLQIEISA-N 1 2 241.294 2.056 20 0 BEADLO C[C@@]1([NH2+]CC/C=C\c2ccccc2)CCOC1=O ZINC000829962588 587530314 /nfs/dbraw/zinc/53/03/14/587530314.db2.gz LGLIVTVOPKRRAU-HMZQOCAUSA-N 1 2 245.322 2.385 20 0 BEADLO ClC1(Cl)C[C@H]1C[N@H+](C1CC1)C1COC1 ZINC000830227480 587542668 /nfs/dbraw/zinc/54/26/68/587542668.db2.gz MIKHEXBMZHTHQI-ZETCQYMHSA-N 1 2 236.142 2.043 20 0 BEADLO ClC1(Cl)C[C@H]1C[N@@H+](C1CC1)C1COC1 ZINC000830227480 587542669 /nfs/dbraw/zinc/54/26/69/587542669.db2.gz MIKHEXBMZHTHQI-ZETCQYMHSA-N 1 2 236.142 2.043 20 0 BEADLO O[C@@H](C[N@@H+]1CC[C@@H](F)C1)c1ccc(F)c(F)c1 ZINC000830467365 587552331 /nfs/dbraw/zinc/55/23/31/587552331.db2.gz KIAQXVVULFAHQW-SKDRFNHKSA-N 1 2 245.244 2.042 20 0 BEADLO O[C@@H](C[N@H+]1CC[C@@H](F)C1)c1ccc(F)c(F)c1 ZINC000830467365 587552332 /nfs/dbraw/zinc/55/23/32/587552332.db2.gz KIAQXVVULFAHQW-SKDRFNHKSA-N 1 2 245.244 2.042 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@H](F)C2)nc2ccccc12 ZINC000830474656 587553240 /nfs/dbraw/zinc/55/32/40/587553240.db2.gz PDZYINZRVDTMIN-NSHDSACASA-N 1 2 245.301 2.482 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@H](F)C2)nc2ccccc12 ZINC000830474656 587553242 /nfs/dbraw/zinc/55/32/42/587553242.db2.gz PDZYINZRVDTMIN-NSHDSACASA-N 1 2 245.301 2.482 20 0 BEADLO Cc1ccc(COC(=O)[C@@H]2CCC(=O)C2)c(C)[nH+]1 ZINC000830896673 587576206 /nfs/dbraw/zinc/57/62/06/587576206.db2.gz KFRYZHVOJCLOEI-LLVKDONJSA-N 1 2 247.294 2.111 20 0 BEADLO O[C@@H](C[N@@H+]1CC[C@@H](F)C1)c1cc(F)ccc1F ZINC000831215929 587592233 /nfs/dbraw/zinc/59/22/33/587592233.db2.gz GHGSVTYGTZUMBA-SKDRFNHKSA-N 1 2 245.244 2.042 20 0 BEADLO O[C@@H](C[N@H+]1CC[C@@H](F)C1)c1cc(F)ccc1F ZINC000831215929 587592234 /nfs/dbraw/zinc/59/22/34/587592234.db2.gz GHGSVTYGTZUMBA-SKDRFNHKSA-N 1 2 245.244 2.042 20 0 BEADLO C[C@H]1CCC[C@H](NC(=O)Cc2[nH]cc[nH+]2)CC1 ZINC000832760825 587685487 /nfs/dbraw/zinc/68/54/87/587685487.db2.gz VIGYIPVTGGIRGT-QWRGUYRKSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)Cc2[nH]cc[nH+]2)CC1 ZINC000832760820 587685843 /nfs/dbraw/zinc/68/58/43/587685843.db2.gz VIGYIPVTGGIRGT-GHMZBOCLSA-N 1 2 235.331 2.037 20 0 BEADLO CCON(Cc1[nH+]ccn1C)Cc1ccccc1 ZINC000832795608 587690391 /nfs/dbraw/zinc/69/03/91/587690391.db2.gz KYRCIRVCDUBHAM-UHFFFAOYSA-N 1 2 245.326 2.374 20 0 BEADLO CC(C)CCCC(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833272533 587703346 /nfs/dbraw/zinc/70/33/46/587703346.db2.gz OVEORIMFBKIZDP-NSHDSACASA-N 1 2 235.331 2.270 20 0 BEADLO CC1(C)CCC[C@H]1C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833279313 587704051 /nfs/dbraw/zinc/70/40/51/587704051.db2.gz YRXNIHVOAGZHCW-QWRGUYRKSA-N 1 2 247.342 2.270 20 0 BEADLO CC1(C)CCC[C@@H]1C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833279311 587704058 /nfs/dbraw/zinc/70/40/58/587704058.db2.gz YRXNIHVOAGZHCW-GHMZBOCLSA-N 1 2 247.342 2.270 20 0 BEADLO O=C(C[C@H]1C=CCCC1)N[C@@H]1CCn2cc[nH+]c21 ZINC000833279434 587704313 /nfs/dbraw/zinc/70/43/13/587704313.db2.gz ZYWLENBUJVOHBM-NWDGAFQWSA-N 1 2 245.326 2.191 20 0 BEADLO O=C(N[C@@H]1CCn2cc[nH+]c21)C1CCCCCC1 ZINC000833292141 587704467 /nfs/dbraw/zinc/70/44/67/587704467.db2.gz CCMXOQBSGFAYPQ-GFCCVEGCSA-N 1 2 247.342 2.415 20 0 BEADLO C[C@H](C(=O)N[C@H]1CCn2cc[nH+]c21)C1CCCC1 ZINC000833284127 587704558 /nfs/dbraw/zinc/70/45/58/587704558.db2.gz GXIHNKDUTSFELI-JQWIXIFHSA-N 1 2 247.342 2.270 20 0 BEADLO CC(C)c1nn(C[NH+]2CCCC2)c(=S)n1C ZINC000101901622 587779739 /nfs/dbraw/zinc/77/97/39/587779739.db2.gz YGQQXDPEROENQX-UHFFFAOYSA-N 1 2 240.376 2.128 20 0 BEADLO Cc1sccc1C(=O)OCCn1cc[nH+]c1 ZINC000835349646 587798089 /nfs/dbraw/zinc/79/80/89/587798089.db2.gz IUHPOUJEKVVRTO-UHFFFAOYSA-N 1 2 236.296 2.110 20 0 BEADLO CCC[N@H+](C)Cn1nc(C)n(CC)c1=S ZINC000102391764 587829586 /nfs/dbraw/zinc/82/95/86/587829586.db2.gz VQDMLHCHEVCIBS-UHFFFAOYSA-N 1 2 228.365 2.042 20 0 BEADLO CCC[N@@H+](C)Cn1nc(C)n(CC)c1=S ZINC000102391764 587829587 /nfs/dbraw/zinc/82/95/87/587829587.db2.gz VQDMLHCHEVCIBS-UHFFFAOYSA-N 1 2 228.365 2.042 20 0 BEADLO Cc1cc(C)c(NC(=O)NOCC2CC2)c(C)[nH+]1 ZINC000836632439 587835713 /nfs/dbraw/zinc/83/57/13/587835713.db2.gz NWCWAPSEUXAHBU-UHFFFAOYSA-N 1 2 249.314 2.470 20 0 BEADLO C/C=C(\CC)C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000836962482 587844103 /nfs/dbraw/zinc/84/41/03/587844103.db2.gz ZTRZUCAFWATEID-BMRUEUJLSA-N 1 2 233.315 2.361 20 0 BEADLO CCC/C=C\C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000836961650 587844321 /nfs/dbraw/zinc/84/43/21/587844321.db2.gz ZTSPEJKRUXPXEJ-ADRPCIBZSA-N 1 2 233.315 2.361 20 0 BEADLO Cc1cc(C)c(CNC(=O)[C@@H]2CCC=CO2)c[nH+]1 ZINC000837104853 587854132 /nfs/dbraw/zinc/85/41/32/587854132.db2.gz NJKGBJSSEJZFAR-ZDUSSCGKSA-N 1 2 246.310 2.007 20 0 BEADLO CC/C(C)=C(/C)C(=O)OCCc1c[nH+]cn1C ZINC000837621316 587885900 /nfs/dbraw/zinc/88/59/00/587885900.db2.gz KGBAYINLKYVXFA-KHPPLWFESA-N 1 2 236.315 2.252 20 0 BEADLO Cc1ccc(COC(=O)[C@@H]2CC2(F)F)c(C)[nH+]1 ZINC000837978042 587906931 /nfs/dbraw/zinc/90/69/31/587906931.db2.gz BOQQWRCPGCGUNI-JTQLQIEISA-N 1 2 241.237 2.397 20 0 BEADLO Cc1ccc(CNc2ccc([NH+](C)C)cc2)nn1 ZINC000840909320 587929217 /nfs/dbraw/zinc/92/92/17/587929217.db2.gz QDFLXJPAFMIZKI-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO COc1ccc([NH2+]C[C@H]2CCSC2)cc1N ZINC000841040355 587938552 /nfs/dbraw/zinc/93/85/52/587938552.db2.gz KTNFIEJOMFYJHS-SECBINFHSA-N 1 2 238.356 2.442 20 0 BEADLO COCC(C)(C)C[NH2+]c1ccc(OC)c(N)c1 ZINC000841040378 587938612 /nfs/dbraw/zinc/93/86/12/587938612.db2.gz LJZCEYASZKUYNX-UHFFFAOYSA-N 1 2 238.331 2.362 20 0 BEADLO C/C(=C\C(=O)NCCc1c[nH+]cn1C)C(C)(C)C ZINC000121507847 587955059 /nfs/dbraw/zinc/95/50/59/587955059.db2.gz PLEVMISTIKUNBB-DHZHZOJOSA-N 1 2 249.358 2.071 20 0 BEADLO NC(=[NH+]OCCOCC1CCC1)c1ccccc1 ZINC000842013943 587989069 /nfs/dbraw/zinc/98/90/69/587989069.db2.gz XAYJZAFPLWVUNL-UHFFFAOYSA-N 1 2 248.326 2.350 20 0 BEADLO CC(=O)NOCc1ccc(C(C)C)[nH+]c1C ZINC000842026370 587989767 /nfs/dbraw/zinc/98/97/67/587989767.db2.gz MEJBECHHPSWXRY-UHFFFAOYSA-N 1 2 222.288 2.081 20 0 BEADLO CC(C)C[C@@H](C)O[NH+]=C(N)COC(C)C ZINC000842025847 587989807 /nfs/dbraw/zinc/98/98/07/587989807.db2.gz VUULNRLGEZOYGA-SNVBAGLBSA-N 1 2 216.325 2.344 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OCc1cc(C)ccc1F ZINC000842037310 587992174 /nfs/dbraw/zinc/99/21/74/587992174.db2.gz XBGUNWPEIGUBIB-SECBINFHSA-N 1 2 240.278 2.167 20 0 BEADLO CC(C)C[C@H](C)O[NH+]=C(N)[C@H]1CCCO1 ZINC000842047835 587993009 /nfs/dbraw/zinc/99/30/09/587993009.db2.gz UWSOBOXCKVMWLK-VHSXEESVSA-N 1 2 214.309 2.098 20 0 BEADLO CC(C)(C)[C@H](C[NH3+])[NH2+]Cc1ccnc(Cl)c1 ZINC000842475114 588029079 /nfs/dbraw/zinc/02/90/79/588029079.db2.gz JVLPWGYQOHMRNB-JTQLQIEISA-N 1 2 241.766 2.198 20 0 BEADLO C/C=C(\C)COC(=O)Cc1cn2ccccc2[nH+]1 ZINC000842847930 588069560 /nfs/dbraw/zinc/06/95/60/588069560.db2.gz DVEUZHZWUSPQTR-QDEBKDIKSA-N 1 2 244.294 2.386 20 0 BEADLO CC(C)(C)C(=O)OCC1CN(c2cccc[nH+]2)C1 ZINC000842890977 588070860 /nfs/dbraw/zinc/07/08/60/588070860.db2.gz OWNYECGXJQGWFT-UHFFFAOYSA-N 1 2 248.326 2.107 20 0 BEADLO CC(C)CC(=O)OCC1CN(c2cccc[nH+]2)C1 ZINC000842893035 588071166 /nfs/dbraw/zinc/07/11/66/588071166.db2.gz SJTROXCTQSYUJX-UHFFFAOYSA-N 1 2 248.326 2.107 20 0 BEADLO COC(=O)Oc1ccc2c(c1)[nH+]c(C)n2C ZINC000867314250 588074536 /nfs/dbraw/zinc/07/45/36/588074536.db2.gz QVAHHVCTXFCZMW-UHFFFAOYSA-N 1 2 220.228 2.027 20 0 BEADLO CC[NH2+]Cc1noc([C@@H](C)c2cccs2)n1 ZINC000843145028 588083890 /nfs/dbraw/zinc/08/38/90/588083890.db2.gz RVHOXMFFQPMQPJ-QMMMGPOBSA-N 1 2 237.328 2.392 20 0 BEADLO CC[NH2+]Cc1noc(/C=C\c2ncccc2C)n1 ZINC000843140955 588085852 /nfs/dbraw/zinc/08/58/52/588085852.db2.gz FZMXMGDTXFZZAL-SREVYHEPSA-N 1 2 244.298 2.053 20 0 BEADLO CC[NH2+]Cc1noc([C@H]2CC23CCCC3)n1 ZINC000843144634 588086227 /nfs/dbraw/zinc/08/62/27/588086227.db2.gz FKUQNIYQFALTLT-SECBINFHSA-N 1 2 221.304 2.227 20 0 BEADLO FC1(F)CC[NH+](Cc2cc3n(n2)CCC3)CC1 ZINC000844325041 588184897 /nfs/dbraw/zinc/18/48/97/588184897.db2.gz OMAXULFFPWVWAN-UHFFFAOYSA-N 1 2 241.285 2.060 20 0 BEADLO C[C@H](CC(=O)O[C@H](C)C1CC1)n1cc[nH+]c1 ZINC000844457637 588196675 /nfs/dbraw/zinc/19/66/75/588196675.db2.gz DJHOMUTUMMVHHG-NXEZZACHSA-N 1 2 222.288 2.176 20 0 BEADLO CCCCOC(=O)C[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000844472554 588198049 /nfs/dbraw/zinc/19/80/49/588198049.db2.gz YKLWITNGFPQVJD-NSHDSACASA-N 1 2 247.285 2.061 20 0 BEADLO CCCCOC(=O)C[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000844472554 588198050 /nfs/dbraw/zinc/19/80/50/588198050.db2.gz YKLWITNGFPQVJD-NSHDSACASA-N 1 2 247.285 2.061 20 0 BEADLO C[C@H](CC(=O)N[C@H]1CC[C@@H](C)C1)n1cc[nH+]c1 ZINC000844491980 588199599 /nfs/dbraw/zinc/19/95/99/588199599.db2.gz VJUOEWNNQLRKMT-UTUOFQBUSA-N 1 2 235.331 2.139 20 0 BEADLO Cc1ccoc1COC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000844544479 588201577 /nfs/dbraw/zinc/20/15/77/588201577.db2.gz SAZBIRBZDSHAEV-LLVKDONJSA-N 1 2 248.282 2.479 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2C[C@@H]3C=C[C@H]2CC3)n1 ZINC000844905843 588218874 /nfs/dbraw/zinc/21/88/74/588218874.db2.gz HWIDROMRZBZCFA-OUAUKWLOSA-N 1 2 233.315 2.249 20 0 BEADLO C[C@H](CC(=O)OC/C=C/Cl)n1cc[nH+]c1 ZINC000845279447 588225620 /nfs/dbraw/zinc/22/56/20/588225620.db2.gz WOAUGRKVWXRPCI-GKQMSVHHSA-N 1 2 228.679 2.130 20 0 BEADLO CC[C@H](C)OC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000845283410 588225760 /nfs/dbraw/zinc/22/57/60/588225760.db2.gz WPUTVJHHTIAWQK-UWVGGRQHSA-N 1 2 210.277 2.176 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@@H]1C[C@@H]1C1CCCC1 ZINC000845479528 588230006 /nfs/dbraw/zinc/23/00/06/588230006.db2.gz POBVPBOEIQSIEY-CHWSQXEVSA-N 1 2 248.326 2.290 20 0 BEADLO C[C@@H](CC(=O)OCCc1ccco1)n1cc[nH+]c1 ZINC000845606706 588235761 /nfs/dbraw/zinc/23/57/61/588235761.db2.gz UFUMFKIHVPQIMS-NSHDSACASA-N 1 2 248.282 2.213 20 0 BEADLO C/C=C(\C)COC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000845612269 588236097 /nfs/dbraw/zinc/23/60/97/588236097.db2.gz KMKTYDKIRKUTKU-LLMHMKPQSA-N 1 2 222.288 2.344 20 0 BEADLO Cc1cc(N2CCC[C@@]3(CC3(F)F)C2)nc[nH+]1 ZINC000845741490 588243379 /nfs/dbraw/zinc/24/33/79/588243379.db2.gz GBAOVRMWEFNPTK-LLVKDONJSA-N 1 2 239.269 2.411 20 0 BEADLO COc1ccc(C[N@H+](C)CCF)c(F)c1 ZINC000845976085 588252445 /nfs/dbraw/zinc/25/24/45/588252445.db2.gz IDEKRGQLHOCVOY-UHFFFAOYSA-N 1 2 215.243 2.236 20 0 BEADLO COc1ccc(C[N@@H+](C)CCF)c(F)c1 ZINC000845976085 588252446 /nfs/dbraw/zinc/25/24/46/588252446.db2.gz IDEKRGQLHOCVOY-UHFFFAOYSA-N 1 2 215.243 2.236 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccc(C)nn2)[C@H](CC)CO1 ZINC000846027736 588254067 /nfs/dbraw/zinc/25/40/67/588254067.db2.gz ORGLYDLQRLXXEK-ZIAGYGMSSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccc(C)nn2)[C@H](CC)CO1 ZINC000846027736 588254068 /nfs/dbraw/zinc/25/40/68/588254068.db2.gz ORGLYDLQRLXXEK-ZIAGYGMSSA-N 1 2 249.358 2.174 20 0 BEADLO CCCC[C@@H]1CCC[C@H]1[NH2+]CC(=O)NOCC ZINC000846090501 588256194 /nfs/dbraw/zinc/25/61/94/588256194.db2.gz BMTSMTKAYWGHEU-VXGBXAGGSA-N 1 2 242.363 2.003 20 0 BEADLO COCc1cc[nH+]c(NC[C@@H]2CCCOC2)c1 ZINC000846117536 588257742 /nfs/dbraw/zinc/25/77/42/588257742.db2.gz OUJRKCJSHGXAOO-LBPRGKRZSA-N 1 2 236.315 2.067 20 0 BEADLO Fc1cncc(C[N@H+]2CCC[C@@H](F)C2)c1 ZINC000846119906 588258117 /nfs/dbraw/zinc/25/81/17/588258117.db2.gz JUSLMIMJLWOIND-SNVBAGLBSA-N 1 2 212.243 2.155 20 0 BEADLO Fc1cncc(C[N@@H+]2CCC[C@@H](F)C2)c1 ZINC000846119906 588258118 /nfs/dbraw/zinc/25/81/18/588258118.db2.gz JUSLMIMJLWOIND-SNVBAGLBSA-N 1 2 212.243 2.155 20 0 BEADLO C[C@@H]1C[N@H+](CC2(Br)CC2)[C@H](C)CO1 ZINC000846766478 588286656 /nfs/dbraw/zinc/28/66/56/588286656.db2.gz SPWSDWSSLSOATQ-RKDXNWHRSA-N 1 2 248.164 2.023 20 0 BEADLO C[C@@H]1C[N@@H+](CC2(Br)CC2)[C@H](C)CO1 ZINC000846766478 588286657 /nfs/dbraw/zinc/28/66/57/588286657.db2.gz SPWSDWSSLSOATQ-RKDXNWHRSA-N 1 2 248.164 2.023 20 0 BEADLO CC[C@H]1CCC[N@H+](Cc2cnsn2)C1 ZINC000846767833 588286788 /nfs/dbraw/zinc/28/67/88/588286788.db2.gz OLPHSGGIYMZDHQ-VIFPVBQESA-N 1 2 211.334 2.160 20 0 BEADLO CC[C@H]1CCC[N@@H+](Cc2cnsn2)C1 ZINC000846767833 588286789 /nfs/dbraw/zinc/28/67/89/588286789.db2.gz OLPHSGGIYMZDHQ-VIFPVBQESA-N 1 2 211.334 2.160 20 0 BEADLO C[N@H+](Cc1cnsn1)C1CCCCC1 ZINC000846768119 588286968 /nfs/dbraw/zinc/28/69/68/588286968.db2.gz CIPJXXFFPNENBW-UHFFFAOYSA-N 1 2 211.334 2.303 20 0 BEADLO C[N@@H+](Cc1cnsn1)C1CCCCC1 ZINC000846768119 588286969 /nfs/dbraw/zinc/28/69/69/588286969.db2.gz CIPJXXFFPNENBW-UHFFFAOYSA-N 1 2 211.334 2.303 20 0 BEADLO CCC1CC[NH+](Cc2cnsn2)CC1 ZINC000846776137 588287604 /nfs/dbraw/zinc/28/76/04/588287604.db2.gz KYPUIHCPTCKVDX-UHFFFAOYSA-N 1 2 211.334 2.160 20 0 BEADLO CC[C@H]1COCC[N@@H+]1CC1(Br)CC1 ZINC000846808688 588290033 /nfs/dbraw/zinc/29/00/33/588290033.db2.gz LMFGOPPGVPLCNE-VIFPVBQESA-N 1 2 248.164 2.025 20 0 BEADLO CC[C@H]1COCC[N@H+]1CC1(Br)CC1 ZINC000846808688 588290034 /nfs/dbraw/zinc/29/00/34/588290034.db2.gz LMFGOPPGVPLCNE-VIFPVBQESA-N 1 2 248.164 2.025 20 0 BEADLO c1nsnc1C[N@@H+]1CC[C@H]1Cc1ccccc1 ZINC000846813715 588290973 /nfs/dbraw/zinc/29/09/73/588290973.db2.gz JNJXVCHURCGOBI-ZDUSSCGKSA-N 1 2 245.351 2.355 20 0 BEADLO c1nsnc1C[N@H+]1CC[C@H]1Cc1ccccc1 ZINC000846813715 588290974 /nfs/dbraw/zinc/29/09/74/588290974.db2.gz JNJXVCHURCGOBI-ZDUSSCGKSA-N 1 2 245.351 2.355 20 0 BEADLO CS[C@@H]1CCCC[N@H+](Cc2cnsn2)C1 ZINC000846830973 588291466 /nfs/dbraw/zinc/29/14/66/588291466.db2.gz FXGTWXMNCGEBKS-SNVBAGLBSA-N 1 2 243.401 2.256 20 0 BEADLO CS[C@@H]1CCCC[N@@H+](Cc2cnsn2)C1 ZINC000846830973 588291467 /nfs/dbraw/zinc/29/14/67/588291467.db2.gz FXGTWXMNCGEBKS-SNVBAGLBSA-N 1 2 243.401 2.256 20 0 BEADLO COC[C@@H]([NH2+]Cc1cnsn1)c1ccccc1 ZINC000846844899 588293073 /nfs/dbraw/zinc/29/30/73/588293073.db2.gz QUOFTGXMQLTANG-GFCCVEGCSA-N 1 2 249.339 2.015 20 0 BEADLO CC(C)[C@@H]1CCC[N@H+](Cc2cnsn2)C1 ZINC000846868430 588294520 /nfs/dbraw/zinc/29/45/20/588294520.db2.gz OYLDDVMJHQNDRL-SNVBAGLBSA-N 1 2 225.361 2.406 20 0 BEADLO CC(C)[C@@H]1CCC[N@@H+](Cc2cnsn2)C1 ZINC000846868430 588294521 /nfs/dbraw/zinc/29/45/21/588294521.db2.gz OYLDDVMJHQNDRL-SNVBAGLBSA-N 1 2 225.361 2.406 20 0 BEADLO CC1=C(C)C[N@H+](Cc2cnsn2)CC1 ZINC000846888005 588295551 /nfs/dbraw/zinc/29/55/51/588295551.db2.gz MLWUEYGUZPRVQC-UHFFFAOYSA-N 1 2 209.318 2.080 20 0 BEADLO CC1=C(C)C[N@@H+](Cc2cnsn2)CC1 ZINC000846888005 588295552 /nfs/dbraw/zinc/29/55/52/588295552.db2.gz MLWUEYGUZPRVQC-UHFFFAOYSA-N 1 2 209.318 2.080 20 0 BEADLO C[C@@H]1CCC[C@H](CNC(=O)Cc2[nH]cc[nH+]2)[C@H]1C ZINC000846986347 588300308 /nfs/dbraw/zinc/30/03/08/588300308.db2.gz JXBUYNDYDGNGPX-GRYCIOLGSA-N 1 2 249.358 2.141 20 0 BEADLO CCCCCCNC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000847311880 588310592 /nfs/dbraw/zinc/31/05/92/588310592.db2.gz CVIHFAUCINEYCT-LLVKDONJSA-N 1 2 237.347 2.285 20 0 BEADLO CCCCCCNC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000847311880 588310593 /nfs/dbraw/zinc/31/05/93/588310593.db2.gz CVIHFAUCINEYCT-LLVKDONJSA-N 1 2 237.347 2.285 20 0 BEADLO CC[NH2+]Cc1noc(/C(C)=C/c2ccncc2)n1 ZINC000848618310 588402002 /nfs/dbraw/zinc/40/20/02/588402002.db2.gz RXQPGPQLLMPFFN-CSKARUKUSA-N 1 2 244.298 2.135 20 0 BEADLO CCCOC(=O)c1ccn2c(C)c[nH+]c2c1 ZINC000848780098 588413730 /nfs/dbraw/zinc/41/37/30/588413730.db2.gz ITGHWTXTBXMYEN-UHFFFAOYSA-N 1 2 218.256 2.210 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1cnc(Cl)n1C ZINC000848908462 588419098 /nfs/dbraw/zinc/41/90/98/588419098.db2.gz VFRWTLRMCVNYNS-OCAPTIKFSA-N 1 2 213.712 2.056 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1cnc(Cl)n1C ZINC000848908462 588419099 /nfs/dbraw/zinc/41/90/99/588419099.db2.gz VFRWTLRMCVNYNS-OCAPTIKFSA-N 1 2 213.712 2.056 20 0 BEADLO Cn1c(C[NH+]2CCC(F)(F)CC2)cnc1Cl ZINC000848908029 588419253 /nfs/dbraw/zinc/41/92/53/588419253.db2.gz LZPYIOJEEJQXMG-UHFFFAOYSA-N 1 2 249.692 2.305 20 0 BEADLO O=C(OCCn1cc[nH+]c1)[C@@H]1CCCC2(CC2)C1 ZINC000850204977 588528692 /nfs/dbraw/zinc/52/86/92/588528692.db2.gz DGNGMJJXZYVUGB-GFCCVEGCSA-N 1 2 248.326 2.397 20 0 BEADLO CCONC(=O)C[NH2+][C@H]1CCC[C@H](CC)CC1 ZINC000850337869 588537271 /nfs/dbraw/zinc/53/72/71/588537271.db2.gz BNCWNCTVOOGBLG-RYUDHWBXSA-N 1 2 242.363 2.003 20 0 BEADLO CCONC(=O)C[NH2+][C@H]1CCC[C@@H](CC)CC1 ZINC000850337867 588537605 /nfs/dbraw/zinc/53/76/05/588537605.db2.gz BNCWNCTVOOGBLG-NEPJUHHUSA-N 1 2 242.363 2.003 20 0 BEADLO O[C@@H]1C[C@@H]([NH2+]Cc2nccs2)c2ccccc21 ZINC000850372831 588541408 /nfs/dbraw/zinc/54/14/08/588541408.db2.gz ZPONVCNDGBIWRR-VXGBXAGGSA-N 1 2 246.335 2.411 20 0 BEADLO c1csc([C@H]([NH2+][C@@H]2C=CCC2)c2nnc[nH]2)c1 ZINC000850509548 588554646 /nfs/dbraw/zinc/55/46/46/588554646.db2.gz RJRASDWZGBTUDF-KOLCDFICSA-N 1 2 246.339 2.264 20 0 BEADLO c1csc([C@@H]([NH2+][C@H]2C=CCC2)c2nnc[nH]2)c1 ZINC000850509547 588554795 /nfs/dbraw/zinc/55/47/95/588554795.db2.gz RJRASDWZGBTUDF-GXSJLCMTSA-N 1 2 246.339 2.264 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2ncccn2)c(C)n1 ZINC000850553461 588560421 /nfs/dbraw/zinc/56/04/21/588560421.db2.gz ZKZGNIMQYLHLMP-NSHDSACASA-N 1 2 242.326 2.339 20 0 BEADLO C[C@H]1c2cccn2CC[N@H+]1CCOC(F)F ZINC000851717353 588616031 /nfs/dbraw/zinc/61/60/31/588616031.db2.gz JUXMQDFTGKOZTE-VIFPVBQESA-N 1 2 230.258 2.104 20 0 BEADLO C[C@H]1c2cccn2CC[N@@H+]1CCOC(F)F ZINC000851717353 588616032 /nfs/dbraw/zinc/61/60/32/588616032.db2.gz JUXMQDFTGKOZTE-VIFPVBQESA-N 1 2 230.258 2.104 20 0 BEADLO C[C@H]1C[N@H+](Cc2cnon2)Cc2ccccc21 ZINC000851720892 588617035 /nfs/dbraw/zinc/61/70/35/588617035.db2.gz VODJEQVZBKAFJB-JTQLQIEISA-N 1 2 229.283 2.189 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cnon2)Cc2ccccc21 ZINC000851720892 588617036 /nfs/dbraw/zinc/61/70/36/588617036.db2.gz VODJEQVZBKAFJB-JTQLQIEISA-N 1 2 229.283 2.189 20 0 BEADLO c1cc([C@H]2CCC[N@H+]2Cc2cnon2)cs1 ZINC000851726749 588618102 /nfs/dbraw/zinc/61/81/02/588618102.db2.gz VOSPIKMQKWAQJZ-LLVKDONJSA-N 1 2 235.312 2.468 20 0 BEADLO c1cc([C@H]2CCC[N@@H+]2Cc2cnon2)cs1 ZINC000851726749 588618103 /nfs/dbraw/zinc/61/81/03/588618103.db2.gz VOSPIKMQKWAQJZ-LLVKDONJSA-N 1 2 235.312 2.468 20 0 BEADLO Fc1cccc(C[N@H+](Cc2cnon2)C2CC2)c1 ZINC000851730738 588618914 /nfs/dbraw/zinc/61/89/14/588618914.db2.gz RHPOLODVTCILTB-UHFFFAOYSA-N 1 2 247.273 2.373 20 0 BEADLO Fc1cccc(C[N@@H+](Cc2cnon2)C2CC2)c1 ZINC000851730738 588618915 /nfs/dbraw/zinc/61/89/15/588618915.db2.gz RHPOLODVTCILTB-UHFFFAOYSA-N 1 2 247.273 2.373 20 0 BEADLO CC[N@H+](Cc1cnon1)Cc1ccc(OC)cc1 ZINC000851730441 588619043 /nfs/dbraw/zinc/61/90/43/588619043.db2.gz ORNZYHYWRWBIKA-UHFFFAOYSA-N 1 2 247.298 2.100 20 0 BEADLO CC[N@@H+](Cc1cnon1)Cc1ccc(OC)cc1 ZINC000851730441 588619044 /nfs/dbraw/zinc/61/90/44/588619044.db2.gz ORNZYHYWRWBIKA-UHFFFAOYSA-N 1 2 247.298 2.100 20 0 BEADLO CCC[N@H+](CCOC(F)F)CC(F)F ZINC000851744834 588621835 /nfs/dbraw/zinc/62/18/35/588621835.db2.gz PMLVSPZLDPGELZ-UHFFFAOYSA-N 1 2 217.206 2.203 20 0 BEADLO CCC[N@@H+](CCOC(F)F)CC(F)F ZINC000851744834 588621836 /nfs/dbraw/zinc/62/18/36/588621836.db2.gz PMLVSPZLDPGELZ-UHFFFAOYSA-N 1 2 217.206 2.203 20 0 BEADLO CC1(C)OC[C@H](CC[N@@H+]2CCC[C@H]2C(F)F)O1 ZINC000851880727 588639571 /nfs/dbraw/zinc/63/95/71/588639571.db2.gz UBBHJJQNRRKFRB-UWVGGRQHSA-N 1 2 249.301 2.258 20 0 BEADLO CC1(C)OC[C@H](CC[N@H+]2CCC[C@H]2C(F)F)O1 ZINC000851880727 588639572 /nfs/dbraw/zinc/63/95/72/588639572.db2.gz UBBHJJQNRRKFRB-UWVGGRQHSA-N 1 2 249.301 2.258 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2cnon2)ccc1F ZINC000851904971 588641981 /nfs/dbraw/zinc/64/19/81/588641981.db2.gz AORGSRYLKRZJKQ-SECBINFHSA-N 1 2 235.262 2.368 20 0 BEADLO C[C@H]1CC[N@H+](Cc2cccc(F)n2)C[C@H]1F ZINC000851909311 588642329 /nfs/dbraw/zinc/64/23/29/588642329.db2.gz BAOILEGSRJRBBZ-GXSJLCMTSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2cccc(F)n2)C[C@H]1F ZINC000851909311 588642330 /nfs/dbraw/zinc/64/23/30/588642330.db2.gz BAOILEGSRJRBBZ-GXSJLCMTSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@@H](C[S@@](C)=O)[N@@H+](C)CC=C(Cl)Cl ZINC000851923493 588644352 /nfs/dbraw/zinc/64/43/52/588644352.db2.gz RESVRPRIFYFEIK-WPPNPWJKSA-N 1 2 244.187 2.004 20 0 BEADLO C[C@@H](C[S@@](C)=O)[N@H+](C)CC=C(Cl)Cl ZINC000851923493 588644351 /nfs/dbraw/zinc/64/43/51/588644351.db2.gz RESVRPRIFYFEIK-WPPNPWJKSA-N 1 2 244.187 2.004 20 0 BEADLO CSc1ccccc1C[N@H+](C)Cc1cnon1 ZINC000851998679 588654029 /nfs/dbraw/zinc/65/40/29/588654029.db2.gz WLRMCXKODDKUKG-UHFFFAOYSA-N 1 2 249.339 2.424 20 0 BEADLO CSc1ccccc1C[N@@H+](C)Cc1cnon1 ZINC000851998679 588654030 /nfs/dbraw/zinc/65/40/30/588654030.db2.gz WLRMCXKODDKUKG-UHFFFAOYSA-N 1 2 249.339 2.424 20 0 BEADLO CC1(C)OC[C@@H](C[N@@H+]2CCCC[C@@H]2C(F)F)O1 ZINC000852016020 588655176 /nfs/dbraw/zinc/65/51/76/588655176.db2.gz SJNSRQMXUGGDJJ-NXEZZACHSA-N 1 2 249.301 2.258 20 0 BEADLO CC1(C)OC[C@@H](C[N@H+]2CCCC[C@@H]2C(F)F)O1 ZINC000852016020 588655177 /nfs/dbraw/zinc/65/51/77/588655177.db2.gz SJNSRQMXUGGDJJ-NXEZZACHSA-N 1 2 249.301 2.258 20 0 BEADLO FCc1ccc(CN2CCn3c[nH+]cc3C2)cc1 ZINC000852065381 588658895 /nfs/dbraw/zinc/65/88/95/588658895.db2.gz IVILHMXNZVFIOV-UHFFFAOYSA-N 1 2 245.301 2.368 20 0 BEADLO FCc1ccc(C[N@@H+]2CCn3cncc3C2)cc1 ZINC000852065381 588658896 /nfs/dbraw/zinc/65/88/96/588658896.db2.gz IVILHMXNZVFIOV-UHFFFAOYSA-N 1 2 245.301 2.368 20 0 BEADLO FCc1ccc(C[N@H+]2CCn3cncc3C2)cc1 ZINC000852065381 588658897 /nfs/dbraw/zinc/65/88/97/588658897.db2.gz IVILHMXNZVFIOV-UHFFFAOYSA-N 1 2 245.301 2.368 20 0 BEADLO CN(Cc1csc(Cl)n1)Cc1c[nH+]c[nH]1 ZINC000852288255 588675940 /nfs/dbraw/zinc/67/59/40/588675940.db2.gz MGHHAWDFWXPDPF-UHFFFAOYSA-N 1 2 242.735 2.152 20 0 BEADLO CN(Cc1csc(Cl)n1)Cc1c[nH]c[nH+]1 ZINC000852288255 588675941 /nfs/dbraw/zinc/67/59/41/588675941.db2.gz MGHHAWDFWXPDPF-UHFFFAOYSA-N 1 2 242.735 2.152 20 0 BEADLO C[N@H+](Cc1cnc[nH]1)C[C@]1(C)CC1(Cl)Cl ZINC000852288213 588676015 /nfs/dbraw/zinc/67/60/15/588676015.db2.gz LNOTUKCCIZHPQF-VIFPVBQESA-N 1 2 248.157 2.425 20 0 BEADLO C[N@@H+](Cc1cnc[nH]1)C[C@]1(C)CC1(Cl)Cl ZINC000852288213 588676016 /nfs/dbraw/zinc/67/60/16/588676016.db2.gz LNOTUKCCIZHPQF-VIFPVBQESA-N 1 2 248.157 2.425 20 0 BEADLO C[N@H+](Cc1c[nH]cn1)C[C@]1(C)CC1(Cl)Cl ZINC000852288213 588676017 /nfs/dbraw/zinc/67/60/17/588676017.db2.gz LNOTUKCCIZHPQF-VIFPVBQESA-N 1 2 248.157 2.425 20 0 BEADLO C[N@@H+](Cc1c[nH]cn1)C[C@]1(C)CC1(Cl)Cl ZINC000852288213 588676018 /nfs/dbraw/zinc/67/60/18/588676018.db2.gz LNOTUKCCIZHPQF-VIFPVBQESA-N 1 2 248.157 2.425 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)Cc1cnc(Cl)s1 ZINC000852286752 588676128 /nfs/dbraw/zinc/67/61/28/588676128.db2.gz LHEQNLPDIPLHCW-UHFFFAOYSA-N 1 2 242.735 2.152 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)Cc1cnc(Cl)s1 ZINC000852286752 588676129 /nfs/dbraw/zinc/67/61/29/588676129.db2.gz LHEQNLPDIPLHCW-UHFFFAOYSA-N 1 2 242.735 2.152 20 0 BEADLO COCC[N@H+](CCF)C[C@@H]1CC1(Cl)Cl ZINC000852484511 588684957 /nfs/dbraw/zinc/68/49/57/588684957.db2.gz GGJFUAQRFKPTSD-QMMMGPOBSA-N 1 2 244.137 2.098 20 0 BEADLO Cc1ccc(N2CC[NH+](CCF)CC2)c(C)c1 ZINC000852744570 588699038 /nfs/dbraw/zinc/69/90/38/588699038.db2.gz FMHYOYTZCBFJHP-UHFFFAOYSA-N 1 2 236.334 2.395 20 0 BEADLO C[C@@H]1C[N@H+](C/C=C/Cl)C[C@](C)(C(F)F)O1 ZINC000852781000 588702162 /nfs/dbraw/zinc/70/21/62/588702162.db2.gz QLIZFYUTNJBSMQ-KHSHYHJCSA-N 1 2 239.693 2.483 20 0 BEADLO C[C@@H]1C[N@@H+](C/C=C/Cl)C[C@](C)(C(F)F)O1 ZINC000852781000 588702163 /nfs/dbraw/zinc/70/21/63/588702163.db2.gz QLIZFYUTNJBSMQ-KHSHYHJCSA-N 1 2 239.693 2.483 20 0 BEADLO C[C@@]1(C(F)F)C[N@H+](C/C=C\Cl)CCO1 ZINC000852784555 588702241 /nfs/dbraw/zinc/70/22/41/588702241.db2.gz OFCHCDQXQPUSBL-XADBCAIWSA-N 1 2 225.666 2.095 20 0 BEADLO C[C@@]1(C(F)F)C[N@@H+](C/C=C\Cl)CCO1 ZINC000852784555 588702242 /nfs/dbraw/zinc/70/22/42/588702242.db2.gz OFCHCDQXQPUSBL-XADBCAIWSA-N 1 2 225.666 2.095 20 0 BEADLO C/C=C\CNC(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC000860811226 589121720 /nfs/dbraw/zinc/12/17/20/589121720.db2.gz RONPSCPMRMBGDM-WAYWQWQTSA-N 1 2 248.330 2.154 20 0 BEADLO C[C@H](CC(=O)OCC(C)(F)F)n1cc[nH+]c1 ZINC000861219341 589151382 /nfs/dbraw/zinc/15/13/82/589151382.db2.gz ALGWZJAMYRAARF-MRVPVSSYSA-N 1 2 232.230 2.033 20 0 BEADLO O=C(OCC[NH+]1CCC1)c1ccc(Cl)s1 ZINC000861385167 589162362 /nfs/dbraw/zinc/16/23/62/589162362.db2.gz NTCASSGJGCEELS-UHFFFAOYSA-N 1 2 245.731 2.264 20 0 BEADLO CCCCOC(=O)C[N@@H+]1CCS[C@H](C)[C@@H]1C ZINC000118534324 589177025 /nfs/dbraw/zinc/17/70/25/589177025.db2.gz IZYBAPIRTRKPGS-WDEREUQCSA-N 1 2 245.388 2.156 20 0 BEADLO CCCCOC(=O)C[N@H+]1CCS[C@H](C)[C@@H]1C ZINC000118534324 589177026 /nfs/dbraw/zinc/17/70/26/589177026.db2.gz IZYBAPIRTRKPGS-WDEREUQCSA-N 1 2 245.388 2.156 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1ccnc(F)c1C ZINC000862228636 589195900 /nfs/dbraw/zinc/19/59/00/589195900.db2.gz UIUFYCWYBXSWQA-GFCCVEGCSA-N 1 2 238.306 2.140 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1ccnc(F)c1C ZINC000862228636 589195901 /nfs/dbraw/zinc/19/59/01/589195901.db2.gz UIUFYCWYBXSWQA-GFCCVEGCSA-N 1 2 238.306 2.140 20 0 BEADLO Fc1cccc(C[NH2+]Cc2cnc(C3CC3)o2)n1 ZINC000862291295 589200253 /nfs/dbraw/zinc/20/02/53/589200253.db2.gz NHGKTTCYVNRLHZ-UHFFFAOYSA-N 1 2 247.273 2.376 20 0 BEADLO O=C(NCC1CC=CC1)c1cccc2[nH+]ccn21 ZINC000862630581 589229837 /nfs/dbraw/zinc/22/98/37/589229837.db2.gz LLJUKMKESARSBI-UHFFFAOYSA-N 1 2 241.294 2.030 20 0 BEADLO C[C@H]1C[C@@H]1CO[NH+]=C(N)Cc1ccccc1 ZINC000863453666 589288970 /nfs/dbraw/zinc/28/89/70/589288970.db2.gz LUHNGJHKHJFDEI-CMPLNLGQSA-N 1 2 218.300 2.384 20 0 BEADLO CC(C)CO[C@H](C)C(N)=[NH+]OC[C@H]1C[C@@H]1C ZINC000863456946 589289544 /nfs/dbraw/zinc/28/95/44/589289544.db2.gz ABDFPKQWRYVFSP-HBNTYKKESA-N 1 2 228.336 2.202 20 0 BEADLO Fc1cncc(-c2c[nH+]c3n2CCCC3)c1 ZINC000863973233 589330893 /nfs/dbraw/zinc/33/08/93/589330893.db2.gz HLTXTOOUDKSKQB-UHFFFAOYSA-N 1 2 217.247 2.421 20 0 BEADLO CC(C)Cc1cc(N[C@H](C)C2(CO)CC2)nc[nH+]1 ZINC000864091576 589343837 /nfs/dbraw/zinc/34/38/37/589343837.db2.gz QINLGWAFRYOOKU-LLVKDONJSA-N 1 2 249.358 2.248 20 0 BEADLO OCc1cc[nH+]c(NCC[C@@H]2CCCS2)c1 ZINC000864093132 589344189 /nfs/dbraw/zinc/34/41/89/589344189.db2.gz HYPMNNFGMAHDDP-NSHDSACASA-N 1 2 238.356 2.272 20 0 BEADLO CCO[C@@]1(C)C[C@H]1Nc1ccc([C@H](C)O)c[nH+]1 ZINC000864093198 589344522 /nfs/dbraw/zinc/34/45/22/589344522.db2.gz JQMWCPAPSSTYBS-NDMJEZRESA-N 1 2 236.315 2.114 20 0 BEADLO CC(C)(C)[C@@H]1C[C@H]1C(=O)NCCCn1cc[nH+]c1 ZINC000864413540 589360218 /nfs/dbraw/zinc/36/02/18/589360218.db2.gz OZLPWGVIHPBFTA-VXGBXAGGSA-N 1 2 249.358 2.072 20 0 BEADLO CCc1noc(Cn2c[nH+]c(C(C)(C)C)c2)n1 ZINC000865375015 589428081 /nfs/dbraw/zinc/42/80/81/589428081.db2.gz DPYPLUCRBAXDQK-UHFFFAOYSA-N 1 2 234.303 2.174 20 0 BEADLO CC(C)(C)c1cn(C[C@H]2CCOC2)c[nH+]1 ZINC000865375976 589428147 /nfs/dbraw/zinc/42/81/47/589428147.db2.gz SWCYFLNTDQRCMM-SNVBAGLBSA-N 1 2 208.305 2.217 20 0 BEADLO CC(C)(C)c1cn(CC(=O)N2CCCCC2)c[nH+]1 ZINC000865375518 589428223 /nfs/dbraw/zinc/42/82/23/589428223.db2.gz XXABDQNKBUKLMK-UHFFFAOYSA-N 1 2 249.358 2.193 20 0 BEADLO CC(C)(C)c1cn(Cc2ccon2)c[nH+]1 ZINC000865376110 589428393 /nfs/dbraw/zinc/42/83/93/589428393.db2.gz ZOHIUPKSCAIUJR-UHFFFAOYSA-N 1 2 205.261 2.217 20 0 BEADLO CC(C)(C)c1cn(CCC2(O)CC2)c[nH+]1 ZINC000865376633 589428809 /nfs/dbraw/zinc/42/88/09/589428809.db2.gz WZKVMZSXECNGIO-UHFFFAOYSA-N 1 2 208.305 2.096 20 0 BEADLO CC(C)(C)c1cn(Cc2csnn2)c[nH+]1 ZINC000865376499 589428818 /nfs/dbraw/zinc/42/88/18/589428818.db2.gz PXLIAFXKEBGKHK-UHFFFAOYSA-N 1 2 222.317 2.080 20 0 BEADLO CC(C)CNc1nc(N)[nH+]c(C2CCCC2)n1 ZINC000865400627 589432595 /nfs/dbraw/zinc/43/25/95/589432595.db2.gz KXMZAWHVHNCUEY-UHFFFAOYSA-N 1 2 235.335 2.179 20 0 BEADLO CC(C)CNc1nc(N)nc(C2CCCC2)[nH+]1 ZINC000865400627 589432597 /nfs/dbraw/zinc/43/25/97/589432597.db2.gz KXMZAWHVHNCUEY-UHFFFAOYSA-N 1 2 235.335 2.179 20 0 BEADLO C[C@H](Nc1[nH+]cnc2[nH]c(Cl)cc21)C1CC1 ZINC000865415421 589434231 /nfs/dbraw/zinc/43/42/31/589434231.db2.gz MUGJAFSLCVTJIS-LURJTMIESA-N 1 2 236.706 2.244 20 0 BEADLO Clc1cc2c(nc[nH+]c2NCC2CC2)[nH]1 ZINC000865429348 589435287 /nfs/dbraw/zinc/43/52/87/589435287.db2.gz RPHXQOZCKQTSBU-UHFFFAOYSA-N 1 2 222.679 2.433 20 0 BEADLO CN(CC1CC1)c1[nH+]cnc2[nH]c(Cl)cc21 ZINC000865451922 589437068 /nfs/dbraw/zinc/43/70/68/589437068.db2.gz GMSXVOYFIYEJHO-UHFFFAOYSA-N 1 2 236.706 2.409 20 0 BEADLO FC(F)c1ccc(C[NH2+]Cc2ccon2)cn1 ZINC000865481691 589440445 /nfs/dbraw/zinc/44/04/45/589440445.db2.gz UGADBWMDHIRAQG-UHFFFAOYSA-N 1 2 239.225 2.297 20 0 BEADLO OCc1ccccc1NCc1cn(C2CC2)c[nH+]1 ZINC000865496244 589440926 /nfs/dbraw/zinc/44/09/26/589440926.db2.gz TZMFVMDCFPNHAZ-UHFFFAOYSA-N 1 2 243.310 2.322 20 0 BEADLO Fc1ccc(C[NH2+]Cc2cn(C3CC3)cn2)nc1 ZINC000865494324 589441405 /nfs/dbraw/zinc/44/14/05/589441405.db2.gz UUXNFTPHDDYRTM-UHFFFAOYSA-N 1 2 246.289 2.042 20 0 BEADLO CC(C)Cc1cc(NCc2[nH+]ccn2C)ncn1 ZINC000865510357 589442108 /nfs/dbraw/zinc/44/21/08/589442108.db2.gz ZUXWFKGWYWNZTJ-UHFFFAOYSA-N 1 2 245.330 2.021 20 0 BEADLO CC(C)Cc1cc(NCC2(O)CCC2)nc[nH+]1 ZINC000865526420 589443604 /nfs/dbraw/zinc/44/36/04/589443604.db2.gz RBCDDKQOFIZBTG-UHFFFAOYSA-N 1 2 235.331 2.002 20 0 BEADLO Cc1c(Cl)cccc1C[NH2+]CC(F)(F)CO ZINC000865531471 589443749 /nfs/dbraw/zinc/44/37/49/589443749.db2.gz XOGNRPWXWLRIJK-UHFFFAOYSA-N 1 2 249.688 2.366 20 0 BEADLO CC(C)Cc1cc(N[C@@H](CCO)C2CC2)nc[nH+]1 ZINC000865554299 589445972 /nfs/dbraw/zinc/44/59/72/589445972.db2.gz WOYGACAOBQDHED-ZDUSSCGKSA-N 1 2 249.358 2.248 20 0 BEADLO Clc1cc2c(nc[nH+]c2NC2CC=CC2)[nH]1 ZINC000865612445 589450747 /nfs/dbraw/zinc/45/07/47/589450747.db2.gz LAJAODORSGWPDQ-UHFFFAOYSA-N 1 2 234.690 2.164 20 0 BEADLO CC(C)Cc1cc(N[C@H](C)C[C@H](C)O)nc[nH+]1 ZINC000865669699 589455562 /nfs/dbraw/zinc/45/55/62/589455562.db2.gz JBJJGCGFBWKSPG-MNOVXSKESA-N 1 2 237.347 2.246 20 0 BEADLO CC1CN(c2[nH+]cnc3[nH]c(Cl)cc32)C1 ZINC000865680202 589455847 /nfs/dbraw/zinc/45/58/47/589455847.db2.gz SSTSBQCNNUTSGW-UHFFFAOYSA-N 1 2 222.679 2.019 20 0 BEADLO CC(C)Cc1cc(N[C@@H]2C[C@@H](O)C2(C)C)nc[nH+]1 ZINC000865688930 589456222 /nfs/dbraw/zinc/45/62/22/589456222.db2.gz RJEWLXIUHNENSB-VXGBXAGGSA-N 1 2 249.358 2.246 20 0 BEADLO CC(C)Cc1cc(NCCC(C)(C)O)nc[nH+]1 ZINC000865686038 589456226 /nfs/dbraw/zinc/45/62/26/589456226.db2.gz BRFLWUDEKJHXBF-UHFFFAOYSA-N 1 2 237.347 2.248 20 0 BEADLO CO[C@@H](C)CNc1cc(CC(C)C)[nH+]cn1 ZINC000865714142 589457880 /nfs/dbraw/zinc/45/78/80/589457880.db2.gz GYVQALZIZFMRII-JTQLQIEISA-N 1 2 223.320 2.122 20 0 BEADLO Fc1cc(C[NH2+]Cc2cn(C3CC3)cn2)ccn1 ZINC000865721087 589458317 /nfs/dbraw/zinc/45/83/17/589458317.db2.gz OHHAUICSNSDRSR-UHFFFAOYSA-N 1 2 246.289 2.042 20 0 BEADLO CCC=C(F)C(=O)Nc1cc[nH+]c(C)c1 ZINC000865740742 589460055 /nfs/dbraw/zinc/46/00/55/589460055.db2.gz JAGDRNGHWVIGCH-WMZJFQQLSA-N 1 2 208.236 2.014 20 0 BEADLO C[C@H]([NH2+]Cc1coc(C2CC2)n1)c1ccnn1C ZINC000865839019 589464392 /nfs/dbraw/zinc/46/43/92/589464392.db2.gz GRRQMJBUSADPCY-VIFPVBQESA-N 1 2 246.314 2.136 20 0 BEADLO F[C@H]1CCN(c2[nH+]cnc3[nH]c(Cl)cc32)C1 ZINC000865843576 589464554 /nfs/dbraw/zinc/46/45/54/589464554.db2.gz VMWDONNSMCPBJY-LURJTMIESA-N 1 2 240.669 2.111 20 0 BEADLO CC(C)Cc1cc(NC[C@H](O)C2CCC2)nc[nH+]1 ZINC000865862925 589465811 /nfs/dbraw/zinc/46/58/11/589465811.db2.gz UHPLNHPWVZIRPL-ZDUSSCGKSA-N 1 2 249.358 2.248 20 0 BEADLO CO[C@@H]1CC[C@H](C)N(c2cccc[nH+]2)C1 ZINC000866070647 589474916 /nfs/dbraw/zinc/47/49/16/589474916.db2.gz ZZWBOAYONXMERK-WDEREUQCSA-N 1 2 206.289 2.085 20 0 BEADLO CS[C@H]1C[C@H](Nc2cc(C)[nH+]cn2)C1 ZINC000866101911 589476052 /nfs/dbraw/zinc/47/60/52/589476052.db2.gz CTWTZWXKDSSYDJ-KYZUINATSA-N 1 2 209.318 2.091 20 0 BEADLO C[C@]1(C(F)(F)F)CN(c2cccc[nH+]2)CCO1 ZINC000866159911 589478445 /nfs/dbraw/zinc/47/84/45/589478445.db2.gz PMTKQWKCISNAIQ-SNVBAGLBSA-N 1 2 246.232 2.239 20 0 BEADLO Cc1cc(NC[C@@H]2CCC23CCOCC3)nc[nH+]1 ZINC000866172936 589478763 /nfs/dbraw/zinc/47/87/63/589478763.db2.gz FBPOXOFXDJBZCR-LBPRGKRZSA-N 1 2 247.342 2.404 20 0 BEADLO C[C@@H](Nc1cc[nH+]c(C2CC2)n1)c1ccnn1C ZINC000866251709 589483045 /nfs/dbraw/zinc/48/30/45/589483045.db2.gz PPHBTBQPFZFDJR-SECBINFHSA-N 1 2 243.314 2.261 20 0 BEADLO Cc1cc(N[C@@H]2C[C@H]2C2CCOCC2)nc[nH+]1 ZINC000866272875 589483799 /nfs/dbraw/zinc/48/37/99/589483799.db2.gz WUQJWDXNMRUQMS-NWDGAFQWSA-N 1 2 233.315 2.012 20 0 BEADLO CC[C@H](C[C@@H](C)O)Nc1cc[nH+]c2ccncc12 ZINC000866300852 589484939 /nfs/dbraw/zinc/48/49/39/589484939.db2.gz YGCBHMQWMFFGJU-GHMZBOCLSA-N 1 2 245.326 2.013 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2ccnc(F)c2)nn1C ZINC000866475383 589495310 /nfs/dbraw/zinc/49/53/10/589495310.db2.gz XQCUVSCFLBCUOB-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO CC(C)C[C@@H](C)OC(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000867756032 589532946 /nfs/dbraw/zinc/53/29/46/589532946.db2.gz DLMJVDSFVVVRPB-SNVBAGLBSA-N 1 2 239.319 2.413 20 0 BEADLO Cc1conc1CSCCn1cc[nH+]c1 ZINC000871713972 589797291 /nfs/dbraw/zinc/79/72/91/589797291.db2.gz HDNMTRHSSLFPPC-UHFFFAOYSA-N 1 2 223.301 2.113 20 0 BEADLO NC(COC1CCC1)=[NH+]OCCc1ccccc1 ZINC000871775811 589813518 /nfs/dbraw/zinc/81/35/18/589813518.db2.gz QALSQHALXYUTMR-UHFFFAOYSA-N 1 2 248.326 2.297 20 0 BEADLO CC1(C)CC(CO[NH+]=C(N)COC2CCC2)C1 ZINC000871778463 589814131 /nfs/dbraw/zinc/81/41/31/589814131.db2.gz JHFBJFPIJKUJTI-UHFFFAOYSA-N 1 2 240.347 2.490 20 0 BEADLO Cc1ccncc1-c1ccc(N[C@@H](C)CO)[nH+]c1 ZINC000871889190 589829213 /nfs/dbraw/zinc/82/92/13/589829213.db2.gz DQVGKCSAVSIQTF-NSHDSACASA-N 1 2 243.310 2.245 20 0 BEADLO CCc1cccnc1[C@H](C)[NH2+]Cc1nonc1C ZINC000872137374 589879041 /nfs/dbraw/zinc/87/90/41/589879041.db2.gz SITRJJOPMPJMSO-JTQLQIEISA-N 1 2 246.314 2.186 20 0 BEADLO CC(C)c1nc(N2CC[C@H](C(C)(C)O)C2)cc[nH+]1 ZINC000872783239 589969876 /nfs/dbraw/zinc/96/98/76/589969876.db2.gz QMFUXUOBVDKFQT-NSHDSACASA-N 1 2 249.358 2.197 20 0 BEADLO COC(=O)[C@]12CCC[C@H]1N(c1cccc[nH+]1)CC2 ZINC000872788403 589970461 /nfs/dbraw/zinc/97/04/61/589970461.db2.gz RNEBPXDEXCJGBI-RISCZKNCSA-N 1 2 246.310 2.004 20 0 BEADLO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccon1)CO2 ZINC000873077099 589983377 /nfs/dbraw/zinc/98/33/77/589983377.db2.gz JOBWGPJYHNRESY-GFCCVEGCSA-N 1 2 230.267 2.206 20 0 BEADLO FCC(CF)[NH2+]Cc1ccc2nccnc2c1 ZINC000873128856 589985769 /nfs/dbraw/zinc/98/57/69/589985769.db2.gz FPJUJJQGBUCONF-UHFFFAOYSA-N 1 2 237.253 2.027 20 0 BEADLO Cc1[nH]ncc1C[NH2+]CC1(OC(C)C)CCC1 ZINC000873167048 589989125 /nfs/dbraw/zinc/98/91/25/589989125.db2.gz NCEMYQDWYBMXQZ-UHFFFAOYSA-N 1 2 237.347 2.155 20 0 BEADLO CC[C@H]([NH2+]Cc1ccn[nH]1)[C@@H](O)c1ccccc1 ZINC000873195158 589991164 /nfs/dbraw/zinc/99/11/64/589991164.db2.gz YKBHYCVOQQFYLL-KBPBESRZSA-N 1 2 245.326 2.012 20 0 BEADLO CC[C@@H]([NH2+][C@@H]1CCOC1=O)c1ccc(C)cc1 ZINC000019876560 590025463 /nfs/dbraw/zinc/02/54/63/590025463.db2.gz PHFLDFAJBWASOR-CHWSQXEVSA-N 1 2 233.311 2.351 20 0 BEADLO Cc1nc(CN[C@H](C)c2[nH]cc[nH+]2)cs1 ZINC000124766611 590084521 /nfs/dbraw/zinc/08/45/21/590084521.db2.gz ZYINWGDFNDZGCP-SSDOTTSWSA-N 1 2 222.317 2.025 20 0 BEADLO C[C@@H](CN(C)C(=O)Cc1[nH]cc[nH+]1)C(C)(C)C ZINC000874591254 590117840 /nfs/dbraw/zinc/11/78/40/590117840.db2.gz HCHUXQAZESBNQC-JTQLQIEISA-N 1 2 237.347 2.093 20 0 BEADLO O=C(N[C@@H]1CC12CCC2)c1ccc2[nH+]ccn2c1 ZINC000874787384 590136358 /nfs/dbraw/zinc/13/63/58/590136358.db2.gz WDFXPKKQYYBBJD-LLVKDONJSA-N 1 2 241.294 2.007 20 0 BEADLO O=C(C[NH+]1CCCC1)Nc1cscc1Cl ZINC000874811362 590139068 /nfs/dbraw/zinc/13/90/68/590139068.db2.gz KBWLJWVJODGOAY-UHFFFAOYSA-N 1 2 244.747 2.436 20 0 BEADLO CCOc1ccc([NH2+]CC[C@@H](C)O)cc1 ZINC000125349394 590162077 /nfs/dbraw/zinc/16/20/77/590162077.db2.gz KJISOSWNNBIUBQ-SNVBAGLBSA-N 1 2 209.289 2.268 20 0 BEADLO O=C(CCn1cc[nH+]c1)N[C@@H]1CCCC2(CC2)C1 ZINC000888702060 590188386 /nfs/dbraw/zinc/18/83/86/590188386.db2.gz IAFYYGSHBQEIDE-GFCCVEGCSA-N 1 2 247.342 2.112 20 0 BEADLO CC[N@H+](CCO)Cc1c(Cl)cncc1Cl ZINC000876527320 590208847 /nfs/dbraw/zinc/20/88/47/590208847.db2.gz ZMCPNWLEBGRHTO-UHFFFAOYSA-N 1 2 249.141 2.203 20 0 BEADLO CC[N@@H+](CCO)Cc1c(Cl)cncc1Cl ZINC000876527320 590208849 /nfs/dbraw/zinc/20/88/49/590208849.db2.gz ZMCPNWLEBGRHTO-UHFFFAOYSA-N 1 2 249.141 2.203 20 0 BEADLO CO[C@@H]1CCC[N@H+](Cc2nc(Cl)cs2)C1 ZINC000876610243 590221591 /nfs/dbraw/zinc/22/15/91/590221591.db2.gz UFICABLIQVXZDQ-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO CO[C@@H]1CCC[N@@H+](Cc2nc(Cl)cs2)C1 ZINC000876610243 590221592 /nfs/dbraw/zinc/22/15/92/590221592.db2.gz UFICABLIQVXZDQ-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO CO[C@H]1CC[N@@H+](Cc2nc(Cl)cs2)C1 ZINC000876746963 590237238 /nfs/dbraw/zinc/23/72/38/590237238.db2.gz YNRWIUBZZHFGED-ZETCQYMHSA-N 1 2 232.736 2.017 20 0 BEADLO CO[C@H]1CC[N@H+](Cc2nc(Cl)cs2)C1 ZINC000876746963 590237237 /nfs/dbraw/zinc/23/72/37/590237237.db2.gz YNRWIUBZZHFGED-ZETCQYMHSA-N 1 2 232.736 2.017 20 0 BEADLO CC(C)COC(=O)[C@H](C)[NH2+][C@@H]1CS[C@H](C)C1 ZINC000877469726 590333064 /nfs/dbraw/zinc/33/30/64/590333064.db2.gz SNWNQDVCOOKBMF-VWYCJHECSA-N 1 2 245.388 2.058 20 0 BEADLO CC1(C[N@@H+]2C[C@H](O)CC(F)(F)C2)CCCC1 ZINC000877467977 590334223 /nfs/dbraw/zinc/33/42/23/590334223.db2.gz VBBIWRKQEQQQNU-SNVBAGLBSA-N 1 2 233.302 2.269 20 0 BEADLO CC1(C[N@H+]2C[C@H](O)CC(F)(F)C2)CCCC1 ZINC000877467977 590334226 /nfs/dbraw/zinc/33/42/26/590334226.db2.gz VBBIWRKQEQQQNU-SNVBAGLBSA-N 1 2 233.302 2.269 20 0 BEADLO CC1(C)[C@H](O)CC[N@@H+]1Cc1nc(Cl)cs1 ZINC000877541461 590351450 /nfs/dbraw/zinc/35/14/50/590351450.db2.gz JJFWJCPORXNIFV-SSDOTTSWSA-N 1 2 246.763 2.142 20 0 BEADLO CC1(C)[C@H](O)CC[N@H+]1Cc1nc(Cl)cs1 ZINC000877541461 590351453 /nfs/dbraw/zinc/35/14/53/590351453.db2.gz JJFWJCPORXNIFV-SSDOTTSWSA-N 1 2 246.763 2.142 20 0 BEADLO COC(=O)c1csc(C[NH+]2CC3(CC3)C2)c1 ZINC000877556333 590357493 /nfs/dbraw/zinc/35/74/93/590357493.db2.gz QAQRDDQQNNWECP-UHFFFAOYSA-N 1 2 237.324 2.131 20 0 BEADLO CSC(C)(C)CC[NH2+][C@@H](C)C(=O)OC(C)C ZINC000877571622 590362673 /nfs/dbraw/zinc/36/26/73/590362673.db2.gz GHPVFWBSRPTPRI-JTQLQIEISA-N 1 2 247.404 2.448 20 0 BEADLO CCCn1cc(C[NH+]2CC3(C2)CCCCC3)nn1 ZINC000877580513 590364616 /nfs/dbraw/zinc/36/46/16/590364616.db2.gz RWWWEOYMWHFDFM-UHFFFAOYSA-N 1 2 248.374 2.454 20 0 BEADLO COC1C[NH+](Cc2cnc3c(F)cccc3c2)C1 ZINC000877580621 590366076 /nfs/dbraw/zinc/36/60/76/590366076.db2.gz VHWFPSYSYJKCAN-UHFFFAOYSA-N 1 2 246.285 2.205 20 0 BEADLO C[C@@H]1CC[C@H](O)C[N@@H+]1Cc1nc(Cl)cs1 ZINC000877595673 590370304 /nfs/dbraw/zinc/37/03/04/590370304.db2.gz GYXXBADZIAKHSV-SFYZADRCSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H]1CC[C@H](O)C[N@H+]1Cc1nc(Cl)cs1 ZINC000877595673 590370306 /nfs/dbraw/zinc/37/03/06/590370306.db2.gz GYXXBADZIAKHSV-SFYZADRCSA-N 1 2 246.763 2.142 20 0 BEADLO CC1(C)C[NH+](Cc2cnn(-c3ccccc3)n2)C1 ZINC000877717062 590399105 /nfs/dbraw/zinc/39/91/05/590399105.db2.gz DWJGROHCQADVCT-UHFFFAOYSA-N 1 2 242.326 2.109 20 0 BEADLO Cc1[nH]c(CN2CC(OC(C)(C)C)C2)[nH+]c1C ZINC000877769422 590421173 /nfs/dbraw/zinc/42/11/73/590421173.db2.gz BOAKPGZMIUKNOY-UHFFFAOYSA-N 1 2 237.347 2.026 20 0 BEADLO Cn1ccc(C[NH+]2CC(OC(C)(C)C)C2)c1 ZINC000877769518 590421473 /nfs/dbraw/zinc/42/14/73/590421473.db2.gz DMWSULUCSBJHSP-UHFFFAOYSA-N 1 2 222.332 2.024 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CC[C@](C)(C(F)(F)F)C2)n1 ZINC000877811928 590427036 /nfs/dbraw/zinc/42/70/36/590427036.db2.gz CKWCRFFWFBGTBH-JTQLQIEISA-N 1 2 247.264 2.492 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CC[C@](C)(C(F)(F)F)C2)n1 ZINC000877811928 590427037 /nfs/dbraw/zinc/42/70/37/590427037.db2.gz CKWCRFFWFBGTBH-JTQLQIEISA-N 1 2 247.264 2.492 20 0 BEADLO CCC[N@@H+]1CC(=O)N[C@@]12C[C@H](C)CC(C)(C)C2 ZINC000877857778 590433494 /nfs/dbraw/zinc/43/34/94/590433494.db2.gz ZUMUFPZHEFKCSV-RISCZKNCSA-N 1 2 238.375 2.371 20 0 BEADLO CCC[N@H+]1CC(=O)N[C@@]12C[C@H](C)CC(C)(C)C2 ZINC000877857778 590433495 /nfs/dbraw/zinc/43/34/95/590433495.db2.gz ZUMUFPZHEFKCSV-RISCZKNCSA-N 1 2 238.375 2.371 20 0 BEADLO c1cn(-c2cccc(OCCOC3CC3)c2)c[nH+]1 ZINC000877878684 590436343 /nfs/dbraw/zinc/43/63/43/590436343.db2.gz WKSFFDVPTMJFGA-UHFFFAOYSA-N 1 2 244.294 2.430 20 0 BEADLO Cc1cc(COc2cc[nH+]cc2)c(C)nn1 ZINC000877882121 590437376 /nfs/dbraw/zinc/43/73/76/590437376.db2.gz VXFXAUJLJUTBLO-UHFFFAOYSA-N 1 2 215.256 2.067 20 0 BEADLO CC[C@@H]1C[N@H+](CCCOC(F)(F)F)CCO1 ZINC000877958454 590457773 /nfs/dbraw/zinc/45/77/73/590457773.db2.gz UYVWSODVGZNRKL-SECBINFHSA-N 1 2 241.253 2.024 20 0 BEADLO CC[C@@H]1C[N@@H+](CCCOC(F)(F)F)CCO1 ZINC000877958454 590457776 /nfs/dbraw/zinc/45/77/76/590457776.db2.gz UYVWSODVGZNRKL-SECBINFHSA-N 1 2 241.253 2.024 20 0 BEADLO C[N@@H+](Cc1ccon1)C[C@@H]1CCC(C)(C)CO1 ZINC000878124587 590499864 /nfs/dbraw/zinc/49/98/64/590499864.db2.gz IPSPTCDMCHXJDQ-LBPRGKRZSA-N 1 2 238.331 2.312 20 0 BEADLO C[N@H+](Cc1ccon1)C[C@@H]1CCC(C)(C)CO1 ZINC000878124587 590499867 /nfs/dbraw/zinc/49/98/67/590499867.db2.gz IPSPTCDMCHXJDQ-LBPRGKRZSA-N 1 2 238.331 2.312 20 0 BEADLO C=C/C=C\CC[N@@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000878123317 590500138 /nfs/dbraw/zinc/50/01/38/590500138.db2.gz WRBDUXPOLIDHMD-UMBAGQNISA-N 1 2 235.249 2.382 20 0 BEADLO C=C/C=C\CC[N@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000878123317 590500139 /nfs/dbraw/zinc/50/01/39/590500139.db2.gz WRBDUXPOLIDHMD-UMBAGQNISA-N 1 2 235.249 2.382 20 0 BEADLO C[C@H]1COCC[N@H+](Cc2scnc2Cl)C1 ZINC000878298604 590537661 /nfs/dbraw/zinc/53/76/61/590537661.db2.gz JXDRGQOQTMURBB-MRVPVSSYSA-N 1 2 246.763 2.265 20 0 BEADLO C[C@H]1COCC[N@@H+](Cc2scnc2Cl)C1 ZINC000878298604 590537663 /nfs/dbraw/zinc/53/76/63/590537663.db2.gz JXDRGQOQTMURBB-MRVPVSSYSA-N 1 2 246.763 2.265 20 0 BEADLO FC1=CCCN(Cc2[nH+]ccn2CC(F)F)C1 ZINC000878340820 590552295 /nfs/dbraw/zinc/55/22/95/590552295.db2.gz YXTOTNJLBUGJJQ-UHFFFAOYSA-N 1 2 245.248 2.207 20 0 BEADLO C1=CC[N@H+](Cc2nc3c(o2)CCCC3)CC1 ZINC000878384054 590557269 /nfs/dbraw/zinc/55/72/69/590557269.db2.gz HAOCACCWAGMBDQ-UHFFFAOYSA-N 1 2 218.300 2.315 20 0 BEADLO C1=CC[N@@H+](Cc2nc3c(o2)CCCC3)CC1 ZINC000878384054 590557270 /nfs/dbraw/zinc/55/72/70/590557270.db2.gz HAOCACCWAGMBDQ-UHFFFAOYSA-N 1 2 218.300 2.315 20 0 BEADLO c1cc2c(cn1)C[N@H+](C[C@@H]1C[C@@H]3CCC[C@H]3O1)C2 ZINC000878609315 590595873 /nfs/dbraw/zinc/59/58/73/590595873.db2.gz XBPOJYAAMCCKKO-TUKIKUTGSA-N 1 2 244.338 2.355 20 0 BEADLO c1cc2c(cn1)C[N@@H+](C[C@@H]1C[C@@H]3CCC[C@H]3O1)C2 ZINC000878609315 590595875 /nfs/dbraw/zinc/59/58/75/590595875.db2.gz XBPOJYAAMCCKKO-TUKIKUTGSA-N 1 2 244.338 2.355 20 0 BEADLO Cc1nccc(C[N@@H+]2CCC=C(Cl)C2)n1 ZINC000878791228 590621124 /nfs/dbraw/zinc/62/11/24/590621124.db2.gz JJIHSWLQKYYKTC-UHFFFAOYSA-N 1 2 223.707 2.113 20 0 BEADLO Cc1nccc(C[N@H+]2CCC=C(Cl)C2)n1 ZINC000878791228 590621125 /nfs/dbraw/zinc/62/11/25/590621125.db2.gz JJIHSWLQKYYKTC-UHFFFAOYSA-N 1 2 223.707 2.113 20 0 BEADLO CC(C)N(C)C(=O)[C@@H](C)[N@@H+]1CCC=C(Cl)C1 ZINC000878792443 590623191 /nfs/dbraw/zinc/62/31/91/590623191.db2.gz MEJCDVQTTGCBRL-SNVBAGLBSA-N 1 2 244.766 2.070 20 0 BEADLO CC(C)N(C)C(=O)[C@@H](C)[N@H+]1CCC=C(Cl)C1 ZINC000878792443 590623192 /nfs/dbraw/zinc/62/31/92/590623192.db2.gz MEJCDVQTTGCBRL-SNVBAGLBSA-N 1 2 244.766 2.070 20 0 BEADLO COc1cc(C[N@@H+]2CCC=C(Cl)C2)ccn1 ZINC000878792773 590623305 /nfs/dbraw/zinc/62/33/05/590623305.db2.gz XVZDAJMYZKTLPN-UHFFFAOYSA-N 1 2 238.718 2.419 20 0 BEADLO COc1cc(C[N@H+]2CCC=C(Cl)C2)ccn1 ZINC000878792773 590623306 /nfs/dbraw/zinc/62/33/06/590623306.db2.gz XVZDAJMYZKTLPN-UHFFFAOYSA-N 1 2 238.718 2.419 20 0 BEADLO C[C@@H](C(=O)NC(C)(C)C)[N@@H+]1CCC=C(Cl)C1 ZINC000878794046 590624074 /nfs/dbraw/zinc/62/40/74/590624074.db2.gz YYQOUFYGJRTGIH-VIFPVBQESA-N 1 2 244.766 2.118 20 0 BEADLO C[C@@H](C(=O)NC(C)(C)C)[N@H+]1CCC=C(Cl)C1 ZINC000878794046 590624076 /nfs/dbraw/zinc/62/40/76/590624076.db2.gz YYQOUFYGJRTGIH-VIFPVBQESA-N 1 2 244.766 2.118 20 0 BEADLO CC[C@@H](C)NC(=O)[C@H](C)[N@@H+]1CCC=C(Cl)C1 ZINC000878793115 590624176 /nfs/dbraw/zinc/62/41/76/590624176.db2.gz FPOMVXISGQLTSM-ZJUUUORDSA-N 1 2 244.766 2.118 20 0 BEADLO CC[C@@H](C)NC(=O)[C@H](C)[N@H+]1CCC=C(Cl)C1 ZINC000878793115 590624177 /nfs/dbraw/zinc/62/41/77/590624177.db2.gz FPOMVXISGQLTSM-ZJUUUORDSA-N 1 2 244.766 2.118 20 0 BEADLO CC[C@H]1CCC[C@]1(C)C(=O)NCCc1[nH]cc[nH+]1 ZINC000878798792 590625008 /nfs/dbraw/zinc/62/50/08/590625008.db2.gz XBBOORPJNYCFJQ-FZMZJTMJSA-N 1 2 249.358 2.285 20 0 BEADLO CC(C)[C@@H](O)CC[N@@H+]1CCCC(F)(F)C1 ZINC000878803605 590625010 /nfs/dbraw/zinc/62/50/10/590625010.db2.gz DVXJTJAOEGEDAR-JTQLQIEISA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)[C@@H](O)CC[N@H+]1CCCC(F)(F)C1 ZINC000878803605 590625011 /nfs/dbraw/zinc/62/50/11/590625011.db2.gz DVXJTJAOEGEDAR-JTQLQIEISA-N 1 2 221.291 2.125 20 0 BEADLO C[N@H+](Cc1ccns1)Cc1ccnc(F)c1 ZINC000878900042 590643367 /nfs/dbraw/zinc/64/33/67/590643367.db2.gz UCNXLKZLZSMLBZ-UHFFFAOYSA-N 1 2 237.303 2.309 20 0 BEADLO C[N@@H+](Cc1ccns1)Cc1ccnc(F)c1 ZINC000878900042 590643370 /nfs/dbraw/zinc/64/33/70/590643370.db2.gz UCNXLKZLZSMLBZ-UHFFFAOYSA-N 1 2 237.303 2.309 20 0 BEADLO CSC1CC[NH+](CC(=O)OCC(C)C)CC1 ZINC000879098830 590696920 /nfs/dbraw/zinc/69/69/20/590696920.db2.gz IUSYEQDRBLFMPP-UHFFFAOYSA-N 1 2 245.388 2.013 20 0 BEADLO Cc1coc(C(=O)N2CCC[C@H]2c2[nH]cc[nH+]2)c1 ZINC000879372758 590755565 /nfs/dbraw/zinc/75/55/65/590755565.db2.gz VVRVYFQNHNQRME-JTQLQIEISA-N 1 2 245.282 2.288 20 0 BEADLO CC(C)COC(=O)C[NH+]1CCC(C)(F)CC1 ZINC000879382751 590758827 /nfs/dbraw/zinc/75/88/27/590758827.db2.gz OFWLVLYIFBNLJW-UHFFFAOYSA-N 1 2 231.311 2.010 20 0 BEADLO C[C@H]([NH2+]C/C(Cl)=C\Cl)c1ccnn1C ZINC000879686102 590848706 /nfs/dbraw/zinc/84/87/06/590848706.db2.gz SOPGEAVOUKMHDR-QAZRXNLGSA-N 1 2 234.130 2.390 20 0 BEADLO Cc1cncc([C@H]2CCC[N@@H+]2Cc2c[nH]cn2)c1 ZINC000879749931 590863214 /nfs/dbraw/zinc/86/32/14/590863214.db2.gz NFDJUUROLKYWEV-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cncc([C@H]2CCC[N@H+]2Cc2c[nH]cn2)c1 ZINC000879749931 590863216 /nfs/dbraw/zinc/86/32/16/590863216.db2.gz NFDJUUROLKYWEV-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cncc([C@H]2CCC[N@@H+]2Cc2cnc[nH]2)c1 ZINC000879749931 590863219 /nfs/dbraw/zinc/86/32/19/590863219.db2.gz NFDJUUROLKYWEV-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cncc([C@H]2CCC[N@H+]2Cc2cnc[nH]2)c1 ZINC000879749931 590863223 /nfs/dbraw/zinc/86/32/23/590863223.db2.gz NFDJUUROLKYWEV-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO CC[C@@H]1CCC[C@@]1(C)C(=O)NCc1c[nH+]cn1C ZINC000880026137 590911495 /nfs/dbraw/zinc/91/14/95/590911495.db2.gz FSPRWURQGKLOKR-BXUZGUMPSA-N 1 2 249.358 2.253 20 0 BEADLO CC(C)c1noc(C[N@@H+]2CCC[C@@H](CF)C2)n1 ZINC000880230752 590962635 /nfs/dbraw/zinc/96/26/35/590962635.db2.gz OVOVGMDUMRDYCB-JTQLQIEISA-N 1 2 241.310 2.375 20 0 BEADLO CC(C)c1noc(C[N@H+]2CCC[C@@H](CF)C2)n1 ZINC000880230752 590962636 /nfs/dbraw/zinc/96/26/36/590962636.db2.gz OVOVGMDUMRDYCB-JTQLQIEISA-N 1 2 241.310 2.375 20 0 BEADLO CC(=O)c1cc(C[N@@H+]2CCC[C@@H](CF)C2)on1 ZINC000880237457 590967581 /nfs/dbraw/zinc/96/75/81/590967581.db2.gz CLKWVFCVNNWRPH-JTQLQIEISA-N 1 2 240.278 2.059 20 0 BEADLO CC(=O)c1cc(C[N@H+]2CCC[C@@H](CF)C2)on1 ZINC000880237457 590967583 /nfs/dbraw/zinc/96/75/83/590967583.db2.gz CLKWVFCVNNWRPH-JTQLQIEISA-N 1 2 240.278 2.059 20 0 BEADLO Cn1nc(C[N@@H+]2CCC[C@H](CF)C2)cc1Cl ZINC000880238060 590968985 /nfs/dbraw/zinc/96/89/85/590968985.db2.gz NOYWTRPVPQVEJI-SECBINFHSA-N 1 2 245.729 2.255 20 0 BEADLO Cn1nc(C[N@H+]2CCC[C@H](CF)C2)cc1Cl ZINC000880238060 590968989 /nfs/dbraw/zinc/96/89/89/590968989.db2.gz NOYWTRPVPQVEJI-SECBINFHSA-N 1 2 245.729 2.255 20 0 BEADLO CC(C)(C)c1nnc(C[N@@H+]2CC[C@H](CF)C2)o1 ZINC000880292102 590983588 /nfs/dbraw/zinc/98/35/88/590983588.db2.gz VBXBYRNJBVDXMB-SECBINFHSA-N 1 2 241.310 2.159 20 0 BEADLO CC(C)(C)c1nnc(C[N@H+]2CC[C@H](CF)C2)o1 ZINC000880292102 590983592 /nfs/dbraw/zinc/98/35/92/590983592.db2.gz VBXBYRNJBVDXMB-SECBINFHSA-N 1 2 241.310 2.159 20 0 BEADLO OC[C@@H]1C=CC[N@@H+]1Cc1c(F)cccc1Cl ZINC000880483159 591055261 /nfs/dbraw/zinc/05/52/61/591055261.db2.gz BUJQXVCLHRULIR-VIFPVBQESA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@@H]1C=CC[N@H+]1Cc1c(F)cccc1Cl ZINC000880483159 591055265 /nfs/dbraw/zinc/05/52/65/591055265.db2.gz BUJQXVCLHRULIR-VIFPVBQESA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@H]1C=CC[N@@H+]1Cc1cc(Cl)ccc1F ZINC000880488254 591063877 /nfs/dbraw/zinc/06/38/77/591063877.db2.gz ARLHOVKXMUOYAD-LLVKDONJSA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@H]1C=CC[N@H+]1Cc1cc(Cl)ccc1F ZINC000880488254 591063880 /nfs/dbraw/zinc/06/38/80/591063880.db2.gz ARLHOVKXMUOYAD-LLVKDONJSA-N 1 2 241.693 2.212 20 0 BEADLO CCCCCCC(=O)NCCc1[nH]cc[nH+]1 ZINC000128720373 591153116 /nfs/dbraw/zinc/15/31/16/591153116.db2.gz JKOKHSNKLWUGQQ-UHFFFAOYSA-N 1 2 223.320 2.039 20 0 BEADLO CCOC(=O)CC[N@H+](C)C/C(Cl)=C\Cl ZINC000211335512 591160469 /nfs/dbraw/zinc/16/04/69/591160469.db2.gz TYXCYOPDIGJTJR-SOFGYWHQSA-N 1 2 240.130 2.190 20 0 BEADLO CCOC(=O)CC[N@@H+](C)C/C(Cl)=C\Cl ZINC000211335512 591160470 /nfs/dbraw/zinc/16/04/70/591160470.db2.gz TYXCYOPDIGJTJR-SOFGYWHQSA-N 1 2 240.130 2.190 20 0 BEADLO O=C(NC[C@@H]1C=CCC1)c1cccc2[nH+]ccn21 ZINC000881495818 591218466 /nfs/dbraw/zinc/21/84/66/591218466.db2.gz ORAMJWVAVBTXBY-LLVKDONJSA-N 1 2 241.294 2.030 20 0 BEADLO Cc1[nH+]cnc(NCc2ccncc2)c1C ZINC000881736099 591266757 /nfs/dbraw/zinc/26/67/57/591266757.db2.gz XVWLQCUIXLZNMM-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO Cc1[nH+]cnc(NC[C@H](C)Cn2cccn2)c1C ZINC000881812630 591272614 /nfs/dbraw/zinc/27/26/14/591272614.db2.gz UYZUNLBPIJKGQT-JTQLQIEISA-N 1 2 245.330 2.038 20 0 BEADLO Cc1[nH+]cnc(NCC2(O)CCCCC2)c1C ZINC000881879072 591276071 /nfs/dbraw/zinc/27/60/71/591276071.db2.gz HXUUSOSRLUBQKS-UHFFFAOYSA-N 1 2 235.331 2.201 20 0 BEADLO Cc1[nH+]cnc(NCCc2cscn2)c1C ZINC000881996893 591286261 /nfs/dbraw/zinc/28/62/61/591286261.db2.gz MGIPBHZLGOHQOO-UHFFFAOYSA-N 1 2 234.328 2.205 20 0 BEADLO CSCC[C@H](C)Nc1cc(CO)cc[nH+]1 ZINC000881996563 591286449 /nfs/dbraw/zinc/28/64/49/591286449.db2.gz WLPVZSXUFQDYHJ-VIFPVBQESA-N 1 2 226.345 2.127 20 0 BEADLO Cc1[nH+]cnc(NC[C@H](O)c2ccsc2)c1C ZINC000882004968 591286903 /nfs/dbraw/zinc/28/69/03/591286903.db2.gz XNQGSJHMEIGABX-NSHDSACASA-N 1 2 249.339 2.300 20 0 BEADLO Cc1[nH+]cnc(NCCCC(C)(C)CO)c1C ZINC000882010820 591287510 /nfs/dbraw/zinc/28/75/10/591287510.db2.gz SCLYJHFQSBOOIW-UHFFFAOYSA-N 1 2 237.347 2.304 20 0 BEADLO CC[C@@H](O)CCCNc1nc[nH+]c(C)c1C ZINC000882015348 591288018 /nfs/dbraw/zinc/28/80/18/591288018.db2.gz UDXYNWSAFRHCLQ-LLVKDONJSA-N 1 2 223.320 2.056 20 0 BEADLO Cc1[nH+]cnc(NC[C@@](C)(O)c2ccco2)c1C ZINC000882019127 591288456 /nfs/dbraw/zinc/28/84/56/591288456.db2.gz KAWUNZWRQBFUSU-CYBMUJFWSA-N 1 2 247.298 2.006 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2CCCS2)c1C ZINC000882079994 591294727 /nfs/dbraw/zinc/29/47/27/591294727.db2.gz DNTWZNQXAZUKJO-JTQLQIEISA-N 1 2 223.345 2.401 20 0 BEADLO Cc1[nH+]cnc(N(C)Cc2ccc(O)cc2)c1C ZINC000882138658 591304938 /nfs/dbraw/zinc/30/49/38/591304938.db2.gz KFDLCGUVZSPREW-UHFFFAOYSA-N 1 2 243.310 2.435 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2CCO[C@@H](C)C2)c1C ZINC000882154340 591307817 /nfs/dbraw/zinc/30/78/17/591307817.db2.gz YKEDERMAPFIFBA-KWQFWETISA-N 1 2 221.304 2.073 20 0 BEADLO CO[C@H]1CCC[C@@H]1CNc1nc[nH+]c(C)c1C ZINC000882159546 591309015 /nfs/dbraw/zinc/30/90/15/591309015.db2.gz CBBKHKCWOPUHPT-NEPJUHHUSA-N 1 2 235.331 2.320 20 0 BEADLO Cc1[nH+]cnc(NCC2(CO)CCCC2)c1C ZINC000882198999 591315428 /nfs/dbraw/zinc/31/54/28/591315428.db2.gz HTJYOPWRKGYXHP-UHFFFAOYSA-N 1 2 235.331 2.058 20 0 BEADLO Cc1[nH+]cnc(N2CC[C@@]3(C2)CCCOC3)c1C ZINC000882330154 591332665 /nfs/dbraw/zinc/33/26/65/591332665.db2.gz NTJHDVDOWIMGSD-CQSZACIVSA-N 1 2 247.342 2.100 20 0 BEADLO CCC1(C)CN(c2nc[nH+]c(C)c2C)C1 ZINC000882390662 591341463 /nfs/dbraw/zinc/34/14/63/591341463.db2.gz YMTNTNVMOLSELB-UHFFFAOYSA-N 1 2 205.305 2.330 20 0 BEADLO CO[C@@](C)(CNc1nc[nH+]c(C)c1C)C1CC1 ZINC000882388899 591341577 /nfs/dbraw/zinc/34/15/77/591341577.db2.gz YWMRXSRJRFPLHC-ZDUSSCGKSA-N 1 2 235.331 2.320 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2C[C@H](C)O[C@@H]2C)c1C ZINC000882459682 591351590 /nfs/dbraw/zinc/35/15/90/591351590.db2.gz MEVHJDNJICVPOP-AXTRIDKLSA-N 1 2 235.331 2.319 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2CS[C@H](C)C2)c1C ZINC000882456335 591352102 /nfs/dbraw/zinc/35/21/02/591352102.db2.gz JOPSHOSZLCGCQS-GMSGAONNSA-N 1 2 223.345 2.399 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2CCC[C@@H](CO)C2)c1C ZINC000882467201 591352973 /nfs/dbraw/zinc/35/29/73/591352973.db2.gz ICIRWFKXZKHJMY-NEPJUHHUSA-N 1 2 235.331 2.056 20 0 BEADLO Cc1[nH+]cnc(N2CCC[C@H](CCO)CC2)c1C ZINC000882473716 591355166 /nfs/dbraw/zinc/35/51/66/591355166.db2.gz QQVFAQAJEBYMCP-ZDUSSCGKSA-N 1 2 249.358 2.082 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2CCS[C@H]2C)c1C ZINC000882519385 591381525 /nfs/dbraw/zinc/38/15/25/591381525.db2.gz VVQHCWMKAIVIKZ-VHSXEESVSA-N 1 2 223.345 2.399 20 0 BEADLO Cc1[nH+]cnc(N2CC[C@@]3(CC3(F)F)C2)c1C ZINC000882532135 591383823 /nfs/dbraw/zinc/38/38/23/591383823.db2.gz GEDMKUAIADNGNY-LLVKDONJSA-N 1 2 239.269 2.329 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2COC3(CCC3)C2)c1C ZINC000882617489 591400415 /nfs/dbraw/zinc/40/04/15/591400415.db2.gz ZPVLEVYDTPMGEN-LLVKDONJSA-N 1 2 233.315 2.217 20 0 BEADLO Cc1[nH+]cnc(NC[C@H]2CCC[C@@H](C)O2)c1C ZINC000882620671 591401821 /nfs/dbraw/zinc/40/18/21/591401821.db2.gz RLOUKODRNWXBNA-BXKDBHETSA-N 1 2 235.331 2.463 20 0 BEADLO Cc1[nH+]cnc(NCC2CCC(O)CC2)c1C ZINC000882628492 591403726 /nfs/dbraw/zinc/40/37/26/591403726.db2.gz QPYDSFOZTCMDIS-UHFFFAOYSA-N 1 2 235.331 2.056 20 0 BEADLO Cc1[nH+]cnc(N(C)CC2=CCSC2)c1C ZINC000882639771 591405366 /nfs/dbraw/zinc/40/53/66/591405366.db2.gz OQFBQLGHWJBNCX-UHFFFAOYSA-N 1 2 235.356 2.203 20 0 BEADLO Cc1[nH+]cnc(NCc2ccns2)c1C ZINC000882642936 591405915 /nfs/dbraw/zinc/40/59/15/591405915.db2.gz XIRZWOLEXZUCGJ-UHFFFAOYSA-N 1 2 220.301 2.162 20 0 BEADLO Cc1[nH+]cnc(NCC2(O)CCC(C)CC2)c1C ZINC000882640864 591406056 /nfs/dbraw/zinc/40/60/56/591406056.db2.gz NWALWBUIBGAREP-UHFFFAOYSA-N 1 2 249.358 2.447 20 0 BEADLO Cc1[nH+]cnc(NCC(F)(F)C(F)F)c1C ZINC000882647413 591407094 /nfs/dbraw/zinc/40/70/94/591407094.db2.gz AUCCFTPETNAFPB-UHFFFAOYSA-N 1 2 237.200 2.406 20 0 BEADLO Cc1[nH+]cnc(NCC2CC=CC2)c1C ZINC000882652179 591407123 /nfs/dbraw/zinc/40/71/23/591407123.db2.gz XIOWXVOWQJOXPZ-UHFFFAOYSA-N 1 2 203.289 2.472 20 0 BEADLO Cc1ncccc1CNc1nc[nH+]c(C)c1C ZINC000882658132 591408036 /nfs/dbraw/zinc/40/80/36/591408036.db2.gz CVPJMRFEDCOYKT-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO Cc1[nH+]cnc(N2CC[C@H]3CSC[C@@H]3C2)c1C ZINC000882697856 591413207 /nfs/dbraw/zinc/41/32/07/591413207.db2.gz HEIQVPRJMKHGDP-RYUDHWBXSA-N 1 2 249.383 2.283 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2C[C@@H]3CCC[C@H]3O2)c1C ZINC000882715002 591417821 /nfs/dbraw/zinc/41/78/21/591417821.db2.gz GODIJULETMSRAO-RWMBFGLXSA-N 1 2 247.342 2.463 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2CC(C)(C)CO2)c1C ZINC000882715188 591419610 /nfs/dbraw/zinc/41/96/10/591419610.db2.gz OYINUZVDFSHQLJ-NSHDSACASA-N 1 2 235.331 2.320 20 0 BEADLO c1cc(CCNc2cc[nH+]c(C3CC3)n2)sn1 ZINC000882762115 591431080 /nfs/dbraw/zinc/43/10/80/591431080.db2.gz SEJCCOZGIBFUOX-UHFFFAOYSA-N 1 2 246.339 2.465 20 0 BEADLO C1=C[C@@H](CNc2cc(N3CCCC3)nc[nH+]2)CC1 ZINC000882757780 591431724 /nfs/dbraw/zinc/43/17/24/591431724.db2.gz PAEWUIZSHKXDRC-GFCCVEGCSA-N 1 2 244.342 2.455 20 0 BEADLO C1=C[C@@H](CNc2cc(N3CCCC3)[nH+]cn2)CC1 ZINC000882757780 591431726 /nfs/dbraw/zinc/43/17/26/591431726.db2.gz PAEWUIZSHKXDRC-GFCCVEGCSA-N 1 2 244.342 2.455 20 0 BEADLO FC[C@@H]1CCCN(c2cc[nH+]cc2F)C1 ZINC000882803676 591444816 /nfs/dbraw/zinc/44/48/16/591444816.db2.gz AKLZSLLNXOFWHS-VIFPVBQESA-N 1 2 212.243 2.407 20 0 BEADLO COc1ccc[nH+]c1N1CCC[C@H](CF)C1 ZINC000882804300 591444906 /nfs/dbraw/zinc/44/49/06/591444906.db2.gz ZXLNHLYNHZGKDN-SNVBAGLBSA-N 1 2 224.279 2.276 20 0 BEADLO CCC(=O)N[C@H](Cn1cc[nH+]c1)c1ccccc1 ZINC000882837357 591449957 /nfs/dbraw/zinc/44/99/57/591449957.db2.gz FNXQLJNJXCZEQA-CYBMUJFWSA-N 1 2 243.310 2.151 20 0 BEADLO Cn1c2ccccc2[nH+]c1N1CC[C@H](CF)C1 ZINC000882840857 591450901 /nfs/dbraw/zinc/45/09/01/591450901.db2.gz GQRWEAUQOIPJQD-SNVBAGLBSA-N 1 2 233.290 2.369 20 0 BEADLO C=C/C=C/CCO[NH+]=C(N)COC(C)(C)C ZINC000882988131 591496609 /nfs/dbraw/zinc/49/66/09/591496609.db2.gz BTAPYTCRPDSSFW-VOTSOKGWSA-N 1 2 226.320 2.432 20 0 BEADLO C[C@H]1CCC[C@H](CC(=O)NC2=[NH+]CCS2)C1 ZINC000130764834 591518132 /nfs/dbraw/zinc/51/81/32/591518132.db2.gz CZJPYORGIISZCN-UWVGGRQHSA-N 1 2 240.372 2.422 20 0 BEADLO CCOC1CC(O[NH+]=C(N)c2ccccc2C)C1 ZINC000883058767 591531820 /nfs/dbraw/zinc/53/18/20/591531820.db2.gz ATZZQLSHWURCEE-UHFFFAOYSA-N 1 2 248.326 2.409 20 0 BEADLO Cc1ccccc1C(N)=[NH+]O[C@@H]1COC(C)(C)C1 ZINC000883059182 591532069 /nfs/dbraw/zinc/53/20/69/591532069.db2.gz OAGOBZPYAGGEMI-NSHDSACASA-N 1 2 248.326 2.409 20 0 BEADLO CCn1cc(NCc2[nH]cc(C(C)C)[nH+]2)cn1 ZINC000883077266 591535929 /nfs/dbraw/zinc/53/59/29/591535929.db2.gz DWLMLCKQMYTXFW-UHFFFAOYSA-N 1 2 233.319 2.362 20 0 BEADLO FC(F)C[NH2+]Cc1cccc2c1CCOC2 ZINC000883118492 591542797 /nfs/dbraw/zinc/54/27/97/591542797.db2.gz YBHDUQJXSSQSCH-UHFFFAOYSA-N 1 2 227.254 2.114 20 0 BEADLO CC(C)c1c[nH]c(C[NH2+][C@@H](C)c2ccnn2C)n1 ZINC000883199365 591570719 /nfs/dbraw/zinc/57/07/19/591570719.db2.gz BTKWOCKQVHINCS-JTQLQIEISA-N 1 2 247.346 2.117 20 0 BEADLO Cc1cc(NC2CCC(O)CC2)c[nH+]c1C ZINC000883342583 591619150 /nfs/dbraw/zinc/61/91/50/591619150.db2.gz DWKOTNOLQWOWRD-UHFFFAOYSA-N 1 2 220.316 2.414 20 0 BEADLO Cc1cc(NCc2cn(C)cn2)c[nH+]c1C ZINC000883341129 591620531 /nfs/dbraw/zinc/62/05/31/591620531.db2.gz JBJNBPHQWPTGLJ-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO COC(=O)[C@@H]1C[C@@H]1[C@@H](C)Nc1c[nH+]c(C)c(C)c1 ZINC000883341452 591620862 /nfs/dbraw/zinc/62/08/62/591620862.db2.gz QGRYUXIFSIXMPH-RAIGVLPGSA-N 1 2 248.326 2.308 20 0 BEADLO Cc1cc(NCc2nccn2C)c[nH+]c1C ZINC000883342410 591621742 /nfs/dbraw/zinc/62/17/42/591621742.db2.gz WQNXZJZRXRUGPB-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO COC[C@@H](Cc1ccccc1)[NH2+][C@@H](C)C(F)F ZINC000883399242 591646820 /nfs/dbraw/zinc/64/68/20/591646820.db2.gz IERMEPZYMZKMTC-CMPLNLGQSA-N 1 2 243.297 2.487 20 0 BEADLO CC(C)c1c[nH]c(CN[C@H](C)C(F)F)[nH+]1 ZINC000883408348 591651654 /nfs/dbraw/zinc/65/16/54/591651654.db2.gz USMZOGJUXOHULH-SSDOTTSWSA-N 1 2 217.263 2.276 20 0 BEADLO C[C@@H]1C[C@@H]([NH3+])C[N@@H+]1CC[C@H]1CCCC1(F)F ZINC000883438482 591667749 /nfs/dbraw/zinc/66/77/49/591667749.db2.gz UIVHTCINBGANIO-GMTAPVOTSA-N 1 2 232.318 2.233 20 0 BEADLO COc1ccc([NH2+][C@@H](C)C2CC2)cc1CO ZINC000134496487 591931987 /nfs/dbraw/zinc/93/19/87/591931987.db2.gz UIVKUQSSQOTWNR-VIFPVBQESA-N 1 2 221.300 2.398 20 0 BEADLO CCc1nc(NC[C@@H]2CCSC2)cc[nH+]1 ZINC000884491159 591954791 /nfs/dbraw/zinc/95/47/91/591954791.db2.gz OQGLZPQETRFDST-VIFPVBQESA-N 1 2 223.345 2.204 20 0 BEADLO Cc1cnc(NCCc2cccc(C)[nH+]2)o1 ZINC000884492258 591956254 /nfs/dbraw/zinc/95/62/54/591956254.db2.gz QHPDLWZYVLOELF-UHFFFAOYSA-N 1 2 217.272 2.341 20 0 BEADLO CCc1nc(N2CCC[C@@H]2[C@H]2CCCO2)cc[nH+]1 ZINC000884499740 591958006 /nfs/dbraw/zinc/95/80/06/591958006.db2.gz MDMLXXSIGWRUIE-VXGBXAGGSA-N 1 2 247.342 2.187 20 0 BEADLO CCc1nc(NCCCOC(F)F)cc[nH+]1 ZINC000884498375 591958239 /nfs/dbraw/zinc/95/82/39/591958239.db2.gz AFPFLBAWETYVDL-UHFFFAOYSA-N 1 2 231.246 2.080 20 0 BEADLO CCc1nc(N[C@H](CO)C2CCCC2)cc[nH+]1 ZINC000884511867 591962449 /nfs/dbraw/zinc/96/24/49/591962449.db2.gz RSSIJIWZBWPAJE-LLVKDONJSA-N 1 2 235.331 2.002 20 0 BEADLO Cc1cnc(NCCc2ccc(C)c[nH+]2)o1 ZINC000884526538 591966559 /nfs/dbraw/zinc/96/65/59/591966559.db2.gz XNFWQXYREPDEJX-UHFFFAOYSA-N 1 2 217.272 2.341 20 0 BEADLO CCc1nc(NC[C@@H](C)CCOC)cc[nH+]1 ZINC000884529717 591968002 /nfs/dbraw/zinc/96/80/02/591968002.db2.gz UVCKLFSUOKHSLZ-JTQLQIEISA-N 1 2 223.320 2.124 20 0 BEADLO CCc1nc(N[C@H](CC)[C@H](O)C(C)C)cc[nH+]1 ZINC000884530343 591968559 /nfs/dbraw/zinc/96/85/59/591968559.db2.gz JQAZAZXAPLZARW-ZWNOBZJWSA-N 1 2 237.347 2.246 20 0 BEADLO CCc1nc(N[C@@H](CC)[C@H](O)C(C)C)cc[nH+]1 ZINC000884530341 591968718 /nfs/dbraw/zinc/96/87/18/591968718.db2.gz JQAZAZXAPLZARW-GXFFZTMASA-N 1 2 237.347 2.246 20 0 BEADLO CCc1nc(NC[C@@H]2C[C@@H](C)O[C@@H]2C)cc[nH+]1 ZINC000884530229 591969069 /nfs/dbraw/zinc/96/90/69/591969069.db2.gz HVRAIKJZYWATCR-MXWKQRLJSA-N 1 2 235.331 2.264 20 0 BEADLO CCc1nc(N2C[C@H](C)OC3(CCC3)C2)cc[nH+]1 ZINC000884543619 591973068 /nfs/dbraw/zinc/97/30/68/591973068.db2.gz JQMFBIZLRDELNY-NSHDSACASA-N 1 2 247.342 2.187 20 0 BEADLO CCc1nc(N2C[C@H](CC)OC[C@@H]2C)cc[nH+]1 ZINC000884544587 591973487 /nfs/dbraw/zinc/97/34/87/591973487.db2.gz KPFJYHVQKIBFIW-QWRGUYRKSA-N 1 2 235.331 2.043 20 0 BEADLO CCc1nc(N2CCC[C@@H](C)[C@@H]2CCO)cc[nH+]1 ZINC000884554867 591976989 /nfs/dbraw/zinc/97/69/89/591976989.db2.gz DXWSNWIKXFKGFU-NEPJUHHUSA-N 1 2 249.358 2.026 20 0 BEADLO CCc1nc(N2CCO[C@](C)(C3CC3)C2)cc[nH+]1 ZINC000884553105 591977029 /nfs/dbraw/zinc/97/70/29/591977029.db2.gz PJHSGNXKBAVQCC-AWEZNQCLSA-N 1 2 247.342 2.044 20 0 BEADLO CCc1nc(NCC[C@@H]2CCCOC2)cc[nH+]1 ZINC000884562762 591980155 /nfs/dbraw/zinc/98/01/55/591980155.db2.gz JWRKEAFLJYCMOY-NSHDSACASA-N 1 2 235.331 2.268 20 0 BEADLO CCc1nc(N2CC(OC(C)(C)CC)C2)cc[nH+]1 ZINC000884563990 591981163 /nfs/dbraw/zinc/98/11/63/591981163.db2.gz UZBNLNZMMCHEKO-UHFFFAOYSA-N 1 2 249.358 2.433 20 0 BEADLO CCC[C@@H](CCO)Nc1cc[nH+]c(CC)n1 ZINC000884569432 591983270 /nfs/dbraw/zinc/98/32/70/591983270.db2.gz NFWMQJMICHYSKB-JTQLQIEISA-N 1 2 223.320 2.002 20 0 BEADLO CCc1nc(N2CC[C@@H]3CSC[C@@H]3C2)cc[nH+]1 ZINC000884573903 591983882 /nfs/dbraw/zinc/98/38/82/591983882.db2.gz XFDLALCOGFMQCZ-MNOVXSKESA-N 1 2 249.383 2.228 20 0 BEADLO CCc1nc(NCCC(C)(C)OC)cc[nH+]1 ZINC000884572420 591984076 /nfs/dbraw/zinc/98/40/76/591984076.db2.gz NOSVQUYLHPNUGL-UHFFFAOYSA-N 1 2 223.320 2.266 20 0 BEADLO COc1ccc(N[C@@H](C)c2ncco2)[nH+]c1 ZINC000884639805 592000304 /nfs/dbraw/zinc/00/03/04/592000304.db2.gz KUVSQBDBMDTCIT-QMMMGPOBSA-N 1 2 219.244 2.251 20 0 BEADLO CCc1nc(NC[C@@H]2CC3(CCC3)CO2)cc[nH+]1 ZINC000884660103 592006546 /nfs/dbraw/zinc/00/65/46/592006546.db2.gz LKHAQKLKTJLBEP-NSHDSACASA-N 1 2 247.342 2.410 20 0 BEADLO c1ccc(N2CC[C@H]([C@H]3CCCO3)C2)[nH+]c1 ZINC000884731307 592015977 /nfs/dbraw/zinc/01/59/77/592015977.db2.gz WLNGAVBOFNSYMA-NWDGAFQWSA-N 1 2 218.300 2.087 20 0 BEADLO CCc1nc(N2CC[C@H]([C@H]3CCCO3)C2)cc[nH+]1 ZINC000884751611 592017343 /nfs/dbraw/zinc/01/73/43/592017343.db2.gz MZMHMFUXXZDGBK-NWDGAFQWSA-N 1 2 247.342 2.044 20 0 BEADLO OCc1cc[nH+]c(NC2CCC=CCC2)c1 ZINC000884844926 592025083 /nfs/dbraw/zinc/02/50/83/592025083.db2.gz RYRGNUNJVKNWDY-UHFFFAOYSA-N 1 2 218.300 2.485 20 0 BEADLO C[C@H]1C[N@H+](CCSC(F)(F)F)[C@@H](C)CO1 ZINC000885940461 592110584 /nfs/dbraw/zinc/11/05/84/592110584.db2.gz KBCKFXDZXLCGBJ-YUMQZZPRSA-N 1 2 243.294 2.349 20 0 BEADLO C[C@H]1C[N@@H+](CCSC(F)(F)F)[C@@H](C)CO1 ZINC000885940461 592110586 /nfs/dbraw/zinc/11/05/86/592110586.db2.gz KBCKFXDZXLCGBJ-YUMQZZPRSA-N 1 2 243.294 2.349 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CC[C@H](C(F)(F)F)C1 ZINC000886092300 592146091 /nfs/dbraw/zinc/14/60/91/592146091.db2.gz SWGBLNGPKZFWOO-QMMMGPOBSA-N 1 2 233.237 2.102 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CC[C@H](C(F)(F)F)C1 ZINC000886092300 592146092 /nfs/dbraw/zinc/14/60/92/592146092.db2.gz SWGBLNGPKZFWOO-QMMMGPOBSA-N 1 2 233.237 2.102 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CC[C@H](C(F)(F)F)C1 ZINC000886092300 592146094 /nfs/dbraw/zinc/14/60/94/592146094.db2.gz SWGBLNGPKZFWOO-QMMMGPOBSA-N 1 2 233.237 2.102 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CC[C@H](C(F)(F)F)C1 ZINC000886092300 592146095 /nfs/dbraw/zinc/14/60/95/592146095.db2.gz SWGBLNGPKZFWOO-QMMMGPOBSA-N 1 2 233.237 2.102 20 0 BEADLO C[N@H+](CCOC1CCCCC1)Cc1ncc[nH]1 ZINC000886091496 592146745 /nfs/dbraw/zinc/14/67/45/592146745.db2.gz BCMXMBITOSANAL-UHFFFAOYSA-N 1 2 237.347 2.191 20 0 BEADLO C[N@@H+](CCOC1CCCCC1)Cc1ncc[nH]1 ZINC000886091496 592146747 /nfs/dbraw/zinc/14/67/47/592146747.db2.gz BCMXMBITOSANAL-UHFFFAOYSA-N 1 2 237.347 2.191 20 0 BEADLO Cc1coc(C[NH2+]Cc2ncccc2N(C)C)c1 ZINC000886120655 592158324 /nfs/dbraw/zinc/15/83/24/592158324.db2.gz LAKIXBUUHUYYAE-UHFFFAOYSA-N 1 2 245.326 2.339 20 0 BEADLO CCc1cc(NC[C@@H](O)c2ccsc2)nc[nH+]1 ZINC000218912487 592191739 /nfs/dbraw/zinc/19/17/39/592191739.db2.gz YRIFBLICABXFIH-LLVKDONJSA-N 1 2 249.339 2.246 20 0 BEADLO CCc1cc(NC[C@H](O)c2ccsc2)nc[nH+]1 ZINC000218912575 592191893 /nfs/dbraw/zinc/19/18/93/592191893.db2.gz YRIFBLICABXFIH-NSHDSACASA-N 1 2 249.339 2.246 20 0 BEADLO C[C@H]([NH2+]Cc1c(C2CC2)cnn1C)c1ncco1 ZINC000886272531 592192829 /nfs/dbraw/zinc/19/28/29/592192829.db2.gz RYJVHENZBVVORG-VIFPVBQESA-N 1 2 246.314 2.136 20 0 BEADLO CCn1nc(C)c(C[NH2+][C@H](C)c2ncco2)c1C ZINC000886273685 592193667 /nfs/dbraw/zinc/19/36/67/592193667.db2.gz DWLYEAOWSVABJI-SNVBAGLBSA-N 1 2 248.330 2.359 20 0 BEADLO Cc1ccoc1C[NH2+][C@@H](C)c1ncco1 ZINC000886274736 592194387 /nfs/dbraw/zinc/19/43/87/592194387.db2.gz ZTBQPGJVZUVQIT-VIFPVBQESA-N 1 2 206.245 2.427 20 0 BEADLO Cc1noc(C)c1C[NH2+][C@@H](C)c1ncco1 ZINC000886275876 592195834 /nfs/dbraw/zinc/19/58/34/592195834.db2.gz PEDWQSKCFFHHDR-QMMMGPOBSA-N 1 2 221.260 2.130 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CC2(CCCC2)OC[C@@H]1C ZINC000886283588 592200429 /nfs/dbraw/zinc/20/04/29/592200429.db2.gz AROMRDOXEQVAES-LBPRGKRZSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CC2(CCCC2)OC[C@@H]1C ZINC000886283588 592200432 /nfs/dbraw/zinc/20/04/32/592200432.db2.gz AROMRDOXEQVAES-LBPRGKRZSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CC2(CCCC2)OC[C@@H]1C ZINC000886283588 592200433 /nfs/dbraw/zinc/20/04/33/592200433.db2.gz AROMRDOXEQVAES-LBPRGKRZSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CC2(CCCC2)OC[C@@H]1C ZINC000886283588 592200435 /nfs/dbraw/zinc/20/04/35/592200435.db2.gz AROMRDOXEQVAES-LBPRGKRZSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)C[C@@H]1CC[C@H](C2CC2)O1 ZINC000886305999 592203669 /nfs/dbraw/zinc/20/36/69/592203669.db2.gz WFFXKPAYOQPLMX-UONOGXRCSA-N 1 2 249.358 2.108 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)C[C@@H]1CC[C@H](C2CC2)O1 ZINC000886305999 592203671 /nfs/dbraw/zinc/20/36/71/592203671.db2.gz WFFXKPAYOQPLMX-UONOGXRCSA-N 1 2 249.358 2.108 20 0 BEADLO COC(=O)C[NH2+][C@@H](Cc1ccccc1)C(C)C ZINC000886422243 592224276 /nfs/dbraw/zinc/22/42/76/592224276.db2.gz IXMQWUADBXZHCJ-ZDUSSCGKSA-N 1 2 235.327 2.016 20 0 BEADLO Cc1cc(C[NH2+][C@H](c2cnn(C)c2)C(C)C)no1 ZINC000886512943 592241221 /nfs/dbraw/zinc/24/12/21/592241221.db2.gz QCXHYGDIBWQFFL-ZDUSSCGKSA-N 1 2 248.330 2.203 20 0 BEADLO CCn1c[nH+]c2c1CCN(C(=O)C(C)=C(C)C)C2 ZINC000886619930 592277417 /nfs/dbraw/zinc/27/74/17/592277417.db2.gz WEXWBJXFAFDREW-UHFFFAOYSA-N 1 2 247.342 2.144 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]C[C@@H]1CC2(CCC2)CO1 ZINC000886701753 592307069 /nfs/dbraw/zinc/30/70/69/592307069.db2.gz VJGYKYPVKPYIJG-PWSUYJOCSA-N 1 2 249.358 2.328 20 0 BEADLO COc1ccc([NH2+]C2CC(OC)C2)c(OC)c1 ZINC000220379629 592309757 /nfs/dbraw/zinc/30/97/57/592309757.db2.gz HHNHSDRXLFSYBJ-UHFFFAOYSA-N 1 2 237.299 2.293 20 0 BEADLO COCCC[N@H+](CC(F)F)C1CCC1 ZINC000887098780 592439938 /nfs/dbraw/zinc/43/99/38/592439938.db2.gz BJROLXGKCFRVHW-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO COCCC[N@@H+](CC(F)F)C1CCC1 ZINC000887098780 592439939 /nfs/dbraw/zinc/43/99/39/592439939.db2.gz BJROLXGKCFRVHW-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO CCCOc1ccnc(N[C@H](C)c2[nH]cc[nH+]2)n1 ZINC000139930382 592441378 /nfs/dbraw/zinc/44/13/78/592441378.db2.gz WCZXWXAWZHLCNN-SECBINFHSA-N 1 2 247.302 2.162 20 0 BEADLO CC(=O)CC[N@H+](CC(F)F)C1CCC1 ZINC000887099080 592441840 /nfs/dbraw/zinc/44/18/40/592441840.db2.gz QHXIIJCWSWKKMI-UHFFFAOYSA-N 1 2 205.248 2.085 20 0 BEADLO CC(=O)CC[N@@H+](CC(F)F)C1CCC1 ZINC000887099080 592441843 /nfs/dbraw/zinc/44/18/43/592441843.db2.gz QHXIIJCWSWKKMI-UHFFFAOYSA-N 1 2 205.248 2.085 20 0 BEADLO CC(C)[C@H](O)C[N@@H+](CC(F)F)C1CCC1 ZINC000887102451 592443487 /nfs/dbraw/zinc/44/34/87/592443487.db2.gz QFGAMIXBIXZQLJ-SNVBAGLBSA-N 1 2 221.291 2.123 20 0 BEADLO FC(F)C[N@H+](CCc1cnccn1)C1CCC1 ZINC000887103971 592443370 /nfs/dbraw/zinc/44/33/70/592443370.db2.gz RMNVHZNXIXRMLN-UHFFFAOYSA-N 1 2 241.285 2.139 20 0 BEADLO FC(F)C[N@@H+](CCc1cnccn1)C1CCC1 ZINC000887103971 592443373 /nfs/dbraw/zinc/44/33/73/592443373.db2.gz RMNVHZNXIXRMLN-UHFFFAOYSA-N 1 2 241.285 2.139 20 0 BEADLO C[C@H](O)CCC[N@H+](CC(F)F)C1CCC1 ZINC000887102274 592443405 /nfs/dbraw/zinc/44/34/05/592443405.db2.gz JKNVUUMHKOFCRZ-VIFPVBQESA-N 1 2 221.291 2.267 20 0 BEADLO C[C@H](O)CCC[N@@H+](CC(F)F)C1CCC1 ZINC000887102274 592443406 /nfs/dbraw/zinc/44/34/06/592443406.db2.gz JKNVUUMHKOFCRZ-VIFPVBQESA-N 1 2 221.291 2.267 20 0 BEADLO CC(C)[C@H](O)C[N@H+](CC(F)F)C1CCC1 ZINC000887102451 592443486 /nfs/dbraw/zinc/44/34/86/592443486.db2.gz QFGAMIXBIXZQLJ-SNVBAGLBSA-N 1 2 221.291 2.123 20 0 BEADLO C[C@@H](O)CCC[N@H+](CC(F)F)C1CCC1 ZINC000887102273 592443763 /nfs/dbraw/zinc/44/37/63/592443763.db2.gz JKNVUUMHKOFCRZ-SECBINFHSA-N 1 2 221.291 2.267 20 0 BEADLO C[C@@H](O)CCC[N@@H+](CC(F)F)C1CCC1 ZINC000887102273 592443767 /nfs/dbraw/zinc/44/37/67/592443767.db2.gz JKNVUUMHKOFCRZ-SECBINFHSA-N 1 2 221.291 2.267 20 0 BEADLO CC(C)Cc1noc(C[N@H+](C)CCCF)n1 ZINC000887136120 592450999 /nfs/dbraw/zinc/45/09/99/592450999.db2.gz KKOHWGVFJGGENT-UHFFFAOYSA-N 1 2 229.299 2.060 20 0 BEADLO CC(C)Cc1noc(C[N@@H+](C)CCCF)n1 ZINC000887136120 592451002 /nfs/dbraw/zinc/45/10/02/592451002.db2.gz KKOHWGVFJGGENT-UHFFFAOYSA-N 1 2 229.299 2.060 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+](C)CCCF)s1 ZINC000887141033 592455688 /nfs/dbraw/zinc/45/56/88/592455688.db2.gz CHAQWXHELMIXBT-SSDOTTSWSA-N 1 2 217.313 2.199 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+](C)CCCF)s1 ZINC000887141033 592455691 /nfs/dbraw/zinc/45/56/91/592455691.db2.gz CHAQWXHELMIXBT-SSDOTTSWSA-N 1 2 217.313 2.199 20 0 BEADLO CCCC[N@@H+]1CC(=O)N[C@@]12C[C@@H]1CC[C@@H](C1)C2 ZINC000887326502 592481499 /nfs/dbraw/zinc/48/14/99/592481499.db2.gz DSVFQRZWKXCULD-IMRBUKKESA-N 1 2 236.359 2.125 20 0 BEADLO CCCC[N@H+]1CC(=O)N[C@@]12C[C@@H]1CC[C@@H](C1)C2 ZINC000887326502 592481502 /nfs/dbraw/zinc/48/15/02/592481502.db2.gz DSVFQRZWKXCULD-IMRBUKKESA-N 1 2 236.359 2.125 20 0 BEADLO C[C@H](CC(=O)NCC(C)(C)C1CC1)n1cc[nH+]c1 ZINC000887370523 592495214 /nfs/dbraw/zinc/49/52/14/592495214.db2.gz WEYCODBNHRMXKW-LLVKDONJSA-N 1 2 249.358 2.387 20 0 BEADLO CCCCOC(=O)C[NH+]1CCC(SC)CC1 ZINC000300816371 592520830 /nfs/dbraw/zinc/52/08/30/592520830.db2.gz IBGATYYIZOMYCT-UHFFFAOYSA-N 1 2 245.388 2.157 20 0 BEADLO CCn1cc(C[N@H+]2CC=C(C(C)(C)C)CC2)nn1 ZINC000887555434 592525459 /nfs/dbraw/zinc/52/54/59/592525459.db2.gz LSCSNHTZKZMMAA-UHFFFAOYSA-N 1 2 248.374 2.476 20 0 BEADLO CCn1cc(C[N@@H+]2CC=C(C(C)(C)C)CC2)nn1 ZINC000887555434 592525460 /nfs/dbraw/zinc/52/54/60/592525460.db2.gz LSCSNHTZKZMMAA-UHFFFAOYSA-N 1 2 248.374 2.476 20 0 BEADLO Cc1cc(NC(=O)NC2(C3CC3)CCC2)cc[nH+]1 ZINC000887934532 592560461 /nfs/dbraw/zinc/56/04/61/592560461.db2.gz ZZZBQYLONREQAY-UHFFFAOYSA-N 1 2 245.326 2.266 20 0 BEADLO C[C@@H]1CN(C(=O)Nc2ccn3cc[nH+]c3c2)[C@@H]1C ZINC000888071602 592574731 /nfs/dbraw/zinc/57/47/31/592574731.db2.gz SDJVFCZPYPSXIW-NXEZZACHSA-N 1 2 244.298 2.206 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CC[C@H]1C1CCCC1 ZINC000889406759 592608961 /nfs/dbraw/zinc/60/89/61/592608961.db2.gz BDVUXQZAMMSZIM-ZDUSSCGKSA-N 1 2 247.342 2.052 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N1CC[C@H]1C1CCCC1 ZINC000889407156 592609375 /nfs/dbraw/zinc/60/93/75/592609375.db2.gz KFQURCQLEFUXHF-ZDUSSCGKSA-N 1 2 247.342 2.133 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N1CC[C@H]1C1CCCC1 ZINC000889407156 592609378 /nfs/dbraw/zinc/60/93/78/592609378.db2.gz KFQURCQLEFUXHF-ZDUSSCGKSA-N 1 2 247.342 2.133 20 0 BEADLO CC[C@H]1CCC[C@]1(C)C(=O)NCc1cn(C)c[nH+]1 ZINC000890100370 592678985 /nfs/dbraw/zinc/67/89/85/592678985.db2.gz USGDSLFKEVYEOX-FZMZJTMJSA-N 1 2 249.358 2.253 20 0 BEADLO CC[C@@H]1CCC[C@@]1(C)C(=O)NCc1cn(C)c[nH+]1 ZINC000890100369 592679086 /nfs/dbraw/zinc/67/90/86/592679086.db2.gz USGDSLFKEVYEOX-BXUZGUMPSA-N 1 2 249.358 2.253 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NCc2cn(C)c[nH+]2)C[C@@H]1C ZINC000890106864 592680990 /nfs/dbraw/zinc/68/09/90/592680990.db2.gz HBLFCMKRULAOHR-GRYCIOLGSA-N 1 2 249.358 2.109 20 0 BEADLO Cn1c[nH+]c(CNC(=O)C(C)(C)C2CCCC2)c1 ZINC000890109289 592682615 /nfs/dbraw/zinc/68/26/15/592682615.db2.gz JDDYYIBAYQQPLM-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO Cn1c[nH+]c(CNC(=O)[C@H]2CCCCC2(C)C)c1 ZINC000890108275 592682836 /nfs/dbraw/zinc/68/28/36/592682836.db2.gz XPAOVDACEBGUEU-GFCCVEGCSA-N 1 2 249.358 2.253 20 0 BEADLO Cn1c[nH+]c(CNC(=O)C2CCC(C)(C)CC2)c1 ZINC000890110434 592684212 /nfs/dbraw/zinc/68/42/12/592684212.db2.gz PJEGCRNZQUERGE-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO CC(C)C[C@@H](C)CC(=O)NCc1cn(C)c[nH+]1 ZINC000890114125 592684237 /nfs/dbraw/zinc/68/42/37/592684237.db2.gz VCJRZPSIDMPSAE-LLVKDONJSA-N 1 2 237.347 2.109 20 0 BEADLO Cn1c[nH+]c(CNC(=O)/C=C\C2CCCCC2)c1 ZINC000890113503 592684557 /nfs/dbraw/zinc/68/45/57/592684557.db2.gz GNASIDQCNKJAKU-FPLPWBNLSA-N 1 2 247.342 2.173 20 0 BEADLO CCCC[C@H](CC)C(=O)NCc1cn(C)c[nH+]1 ZINC000890117381 592685708 /nfs/dbraw/zinc/68/57/08/592685708.db2.gz PTAZZAKDPUQKEQ-NSHDSACASA-N 1 2 237.347 2.253 20 0 BEADLO CSCC[C@@H](C)[N@@H+]1CCCC(=O)[C@@H](F)C1 ZINC001258215897 991137663 /nfs/dbraw/zinc/13/76/63/991137663.db2.gz RZGXJBHEXMJPNJ-ZJUUUORDSA-N 1 2 233.352 2.131 20 0 BEADLO CSCC[C@@H](C)[N@H+]1CCCC(=O)[C@@H](F)C1 ZINC001258215897 991137676 /nfs/dbraw/zinc/13/76/76/991137676.db2.gz RZGXJBHEXMJPNJ-ZJUUUORDSA-N 1 2 233.352 2.131 20 0 BEADLO CCc1cc(N[C@@H]2CCOC[C@@H]2C)nc(CC)[nH+]1 ZINC000893503185 634538419 /nfs/dbraw/zinc/53/84/19/634538419.db2.gz YTNMPLWGRVIHKJ-CMPLNLGQSA-N 1 2 249.358 2.438 20 0 BEADLO C[C@H]1CCCCN1c1nccn2c[nH+]cc12 ZINC000891442568 631301290 /nfs/dbraw/zinc/30/12/90/631301290.db2.gz SDALDZFBZFQJLF-JTQLQIEISA-N 1 2 216.288 2.108 20 0 BEADLO CC(C)(C)CCC(=O)NCc1ccc(N)[nH+]c1 ZINC000308385182 631308425 /nfs/dbraw/zinc/30/84/25/631308425.db2.gz GSLIEFXSHPBENY-UHFFFAOYSA-N 1 2 235.331 2.106 20 0 BEADLO C[C@@H]1CCC[C@@H](C(=O)NCc2ccc(N)[nH+]c2)C1 ZINC000308392446 631309347 /nfs/dbraw/zinc/30/93/47/631309347.db2.gz OLNFZRNOXKQNFW-ZYHUDNBSSA-N 1 2 247.342 2.106 20 0 BEADLO C[C@@H]1CCC[C@H](C(=O)NCc2ccc(N)[nH+]c2)C1 ZINC000308392445 631309849 /nfs/dbraw/zinc/30/98/49/631309849.db2.gz OLNFZRNOXKQNFW-PWSUYJOCSA-N 1 2 247.342 2.106 20 0 BEADLO CCC1(C(=O)NCc2ccc(N)[nH+]c2)CCCC1 ZINC000308374016 631311431 /nfs/dbraw/zinc/31/14/31/631311431.db2.gz IJQUAVBYZSMLDQ-UHFFFAOYSA-N 1 2 247.342 2.250 20 0 BEADLO OCCC[N@H+](C/C(Cl)=C\Cl)C1CC1 ZINC000308406877 631325209 /nfs/dbraw/zinc/32/52/09/631325209.db2.gz MKSVJBUUMLPJMV-SOFGYWHQSA-N 1 2 224.131 2.152 20 0 BEADLO OCCC[N@@H+](C/C(Cl)=C\Cl)C1CC1 ZINC000308406877 631325215 /nfs/dbraw/zinc/32/52/15/631325215.db2.gz MKSVJBUUMLPJMV-SOFGYWHQSA-N 1 2 224.131 2.152 20 0 BEADLO C[C@H]1C[C@H](C)N(C(=O)c2cc3c[nH+]ccc3[nH]2)C1 ZINC000933368934 631329314 /nfs/dbraw/zinc/32/93/14/631329314.db2.gz NFUZXQZTCBVIEC-UWVGGRQHSA-N 1 2 243.310 2.433 20 0 BEADLO CC(C)(C)c1csc(C[NH2+]CCF)n1 ZINC000308559255 631425386 /nfs/dbraw/zinc/42/53/86/631425386.db2.gz UYVRHSLKGCZOAE-UHFFFAOYSA-N 1 2 216.325 2.500 20 0 BEADLO CCC[C@H](C)N(C)c1cc(N(C)C)[nH+]cn1 ZINC000891808583 631498972 /nfs/dbraw/zinc/49/89/72/631498972.db2.gz ICNIQILOIDUICD-JTQLQIEISA-N 1 2 222.336 2.167 20 0 BEADLO CCC[C@H](C)N(C)c1cc(N(C)C)nc[nH+]1 ZINC000891808583 631498978 /nfs/dbraw/zinc/49/89/78/631498978.db2.gz ICNIQILOIDUICD-JTQLQIEISA-N 1 2 222.336 2.167 20 0 BEADLO CNc1cc(N[C@@H](C)CC(F)(F)F)[nH+]cn1 ZINC000234513382 631560785 /nfs/dbraw/zinc/56/07/85/631560785.db2.gz WZWVXUUGOJGBMY-LURJTMIESA-N 1 2 234.225 2.271 20 0 BEADLO CCc1cc(NCC2=CCCOC2)nc(CC)[nH+]1 ZINC000893867759 635633501 /nfs/dbraw/zinc/63/35/01/635633501.db2.gz RQNIMMPAYSOYID-UHFFFAOYSA-N 1 2 247.342 2.360 20 0 BEADLO OC[C@@H]1CC[N@@H+]1Cc1ccc(Cl)c(F)c1 ZINC000934015367 631607334 /nfs/dbraw/zinc/60/73/34/631607334.db2.gz WQZSGGRRRDFEDN-VIFPVBQESA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@@H]1CC[N@H+]1Cc1ccc(Cl)c(F)c1 ZINC000934015367 631607341 /nfs/dbraw/zinc/60/73/41/631607341.db2.gz WQZSGGRRRDFEDN-VIFPVBQESA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@H]1CC[N@@H+]1Cc1cc(F)ccc1Cl ZINC000934015254 631608511 /nfs/dbraw/zinc/60/85/11/631608511.db2.gz UNXWFYFMZGNWGF-SNVBAGLBSA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@H]1CC[N@H+]1Cc1cc(F)ccc1Cl ZINC000934015254 631608513 /nfs/dbraw/zinc/60/85/13/631608513.db2.gz UNXWFYFMZGNWGF-SNVBAGLBSA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@H]1CC[N@@H+]1Cc1ccc(F)cc1Cl ZINC000934016025 631611869 /nfs/dbraw/zinc/61/18/69/631611869.db2.gz JNHRUUWRQIYKAN-SNVBAGLBSA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@H]1CC[N@H+]1Cc1ccc(F)cc1Cl ZINC000934016025 631611876 /nfs/dbraw/zinc/61/18/76/631611876.db2.gz JNHRUUWRQIYKAN-SNVBAGLBSA-N 1 2 229.682 2.046 20 0 BEADLO C[C@H](c1ccc(F)cc1F)[N@@H+]1CC[C@@H]1CO ZINC000934028758 631628980 /nfs/dbraw/zinc/62/89/80/631628980.db2.gz ZMFGMWCPTCWCQT-PSASIEDQSA-N 1 2 227.254 2.092 20 0 BEADLO C[C@H](c1ccc(F)cc1F)[N@H+]1CC[C@@H]1CO ZINC000934028758 631628982 /nfs/dbraw/zinc/62/89/82/631628982.db2.gz ZMFGMWCPTCWCQT-PSASIEDQSA-N 1 2 227.254 2.092 20 0 BEADLO C[C@@H]1CCCN(c2cc(N(C)C)[nH+]cn2)CC1 ZINC000892100122 631728531 /nfs/dbraw/zinc/72/85/31/631728531.db2.gz CSHZPADMOOTAAA-LLVKDONJSA-N 1 2 234.347 2.169 20 0 BEADLO C[C@@H]1CCCN(c2cc(N(C)C)nc[nH+]2)CC1 ZINC000892100122 631728533 /nfs/dbraw/zinc/72/85/33/631728533.db2.gz CSHZPADMOOTAAA-LLVKDONJSA-N 1 2 234.347 2.169 20 0 BEADLO C[C@H]1CCCN(c2nccn3c[nH+]cc23)CC1 ZINC000892103165 631729825 /nfs/dbraw/zinc/72/98/25/631729825.db2.gz UYUOYPQNWPLJDP-NSHDSACASA-N 1 2 230.315 2.356 20 0 BEADLO Cc1[nH]c(CNC(=O)C[C@H]2CC=CCC2)[nH+]c1C ZINC000934426422 631835392 /nfs/dbraw/zinc/83/53/92/631835392.db2.gz VCGHSEOSYWQOKE-LBPRGKRZSA-N 1 2 247.342 2.389 20 0 BEADLO O[C@H]1CC[N@H+](CCCCC(F)(F)F)C[C@@H]1F ZINC000934564526 631928254 /nfs/dbraw/zinc/92/82/54/631928254.db2.gz DBYRRNPOZYWECJ-IUCAKERBSA-N 1 2 243.244 2.124 20 0 BEADLO O[C@H]1CC[N@@H+](CCCCC(F)(F)F)C[C@@H]1F ZINC000934564526 631928260 /nfs/dbraw/zinc/92/82/60/631928260.db2.gz DBYRRNPOZYWECJ-IUCAKERBSA-N 1 2 243.244 2.124 20 0 BEADLO O[C@@H]1CC[N@H+](C/C=C\c2ccccc2)C[C@@H]1F ZINC000934581451 631949894 /nfs/dbraw/zinc/94/98/94/631949894.db2.gz IWOGTCPVCWCMOX-WREBYIDWSA-N 1 2 235.302 2.105 20 0 BEADLO O[C@@H]1CC[N@@H+](C/C=C\c2ccccc2)C[C@@H]1F ZINC000934581451 631949902 /nfs/dbraw/zinc/94/99/02/631949902.db2.gz IWOGTCPVCWCMOX-WREBYIDWSA-N 1 2 235.302 2.105 20 0 BEADLO CC[NH2+]Cc1noc(CCCc2ccccc2)n1 ZINC000051860803 631971845 /nfs/dbraw/zinc/97/18/45/631971845.db2.gz QIQLCWTUMPGESQ-UHFFFAOYSA-N 1 2 245.326 2.354 20 0 BEADLO C[C@H]([NH2+][C@@H]1CC[C@@H]1C)C(=O)OC(C)(C)C ZINC000308871069 632032019 /nfs/dbraw/zinc/03/20/19/632032019.db2.gz YZDVNJGAMRPDCC-LPEHRKFASA-N 1 2 213.321 2.105 20 0 BEADLO Cc1cc(C)c(CNC(=S)NCC2CC2)c[nH+]1 ZINC000849264111 632066827 /nfs/dbraw/zinc/06/68/27/632066827.db2.gz FBSNSIRGBQJZSO-UHFFFAOYSA-N 1 2 249.383 2.073 20 0 BEADLO CNc1cc(Br)cc(C)[nH+]1 ZINC000238325379 632085388 /nfs/dbraw/zinc/08/53/88/632085388.db2.gz YSJBJGNKMLZYQA-UHFFFAOYSA-N 1 2 201.067 2.194 20 0 BEADLO C[C@H]([NH2+][C@H]1CCS[C@H]1C)C(=O)OC(C)(C)C ZINC000309588167 632550404 /nfs/dbraw/zinc/55/04/04/632550404.db2.gz SUIWISXQZSXMKL-GUBZILKMSA-N 1 2 245.388 2.200 20 0 BEADLO CCCCOC(=O)[C@H](C)[NH2+][C@H]1CSC[C@H]1C ZINC000310023004 632694527 /nfs/dbraw/zinc/69/45/27/632694527.db2.gz OEJHQNLGLMENJX-VWYCJHECSA-N 1 2 245.388 2.059 20 0 BEADLO Cc1nc(N2CC3(CC3)C2)c(C)c(C)[nH+]1 ZINC000334794436 635865164 /nfs/dbraw/zinc/86/51/64/635865164.db2.gz YJNWHJHEBMLYQV-UHFFFAOYSA-N 1 2 203.289 2.002 20 0 BEADLO CCCN(CCO)c1cc(C)[nH+]c(C2CCC2)n1 ZINC000892626507 633025749 /nfs/dbraw/zinc/02/57/49/633025749.db2.gz ZDSHFVDZWWPJRJ-UHFFFAOYSA-N 1 2 249.358 2.261 20 0 BEADLO FC1(F)CC([NH2+][C@@H]2CCCc3[nH]ncc32)C1 ZINC000309470062 633117287 /nfs/dbraw/zinc/11/72/87/633117287.db2.gz AJCSPGWJZQJWFQ-SECBINFHSA-N 1 2 227.258 2.174 20 0 BEADLO C[C@H](NC(=O)Cc1c[nH]c[nH+]1)[C@@H]1CCC[C@@H](C)C1 ZINC000909412330 635957143 /nfs/dbraw/zinc/95/71/43/635957143.db2.gz AZNGDBSQLCJHJI-GRYCIOLGSA-N 1 2 249.358 2.283 20 0 BEADLO CCC[C@@H](C)CCNC(=O)CCc1[nH]cc[nH+]1 ZINC000881533085 636026951 /nfs/dbraw/zinc/02/69/51/636026951.db2.gz YFMYLWGAONTNBJ-LLVKDONJSA-N 1 2 237.347 2.285 20 0 BEADLO COC[C@@H](C)[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000237169525 636031365 /nfs/dbraw/zinc/03/13/65/636031365.db2.gz KRKXZENLQVRHPF-RKDXNWHRSA-N 1 2 241.335 2.053 20 0 BEADLO Cc1ccc(OC[C@H](C)[NH2+]Cc2ccn[nH]2)cc1 ZINC000040499579 633816486 /nfs/dbraw/zinc/81/64/86/633816486.db2.gz PSMVAXVTNVDRFU-LBPRGKRZSA-N 1 2 245.326 2.275 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccc(Cl)nc2)no1 ZINC000309856974 633856867 /nfs/dbraw/zinc/85/68/67/633856867.db2.gz KXMNGJBVOCCGBI-UHFFFAOYSA-N 1 2 237.690 2.321 20 0 BEADLO C[C@H]([NH2+][C@H]1CCS[C@@H]1C)C(=O)OC(C)(C)C ZINC000309588166 633958975 /nfs/dbraw/zinc/95/89/75/633958975.db2.gz SUIWISXQZSXMKL-AEJSXWLSSA-N 1 2 245.388 2.200 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCS[C@H]1C)C(=O)OC(C)(C)C ZINC000309588169 633959479 /nfs/dbraw/zinc/95/94/79/633959479.db2.gz SUIWISXQZSXMKL-LPEHRKFASA-N 1 2 245.388 2.200 20 0 BEADLO COC(=O)[C@@H]([NH2+]CCSC(C)(C)C)C1CC1 ZINC000309588713 633961056 /nfs/dbraw/zinc/96/10/56/633961056.db2.gz TYDAADWGWSEEMA-JTQLQIEISA-N 1 2 245.388 2.059 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@H]1CS[C@H](C(C)C)C1 ZINC000309960292 633985940 /nfs/dbraw/zinc/98/59/40/633985940.db2.gz KRYJDAHGKVUAOA-AXFHLTTASA-N 1 2 245.388 2.058 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@@H]1CS[C@@H](C(C)C)C1 ZINC000309960294 633986824 /nfs/dbraw/zinc/98/68/24/633986824.db2.gz KRYJDAHGKVUAOA-GARJFASQSA-N 1 2 245.388 2.058 20 0 BEADLO C[C@H]([NH2+]C[C@H]1CC1(Cl)Cl)C(F)F ZINC000895726084 636175049 /nfs/dbraw/zinc/17/50/49/636175049.db2.gz ZRYNXHVOJMZYRK-CRCLSJGQSA-N 1 2 218.074 2.423 20 0 BEADLO Cc1cnc(C[NH2+][C@H](C)c2ccnnc2)s1 ZINC000925149847 636309329 /nfs/dbraw/zinc/30/93/29/636309329.db2.gz ASRKKSROWAKYSX-SECBINFHSA-N 1 2 234.328 2.092 20 0 BEADLO Cc1ccc(F)cc1C[NH2+]Cc1ccon1 ZINC000163249220 636309818 /nfs/dbraw/zinc/30/98/18/636309818.db2.gz RTQIEABDBDOOIR-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO Cc1nc(NCCc2cccnc2C)cc[nH+]1 ZINC000897405637 636600000 /nfs/dbraw/zinc/60/00/00/636600000.db2.gz FMEGGVZUXPPKDH-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO Cc1c(C[N@H+]2CCO[C@@H](C)[C@@H]2C)ccnc1F ZINC000862245741 636616904 /nfs/dbraw/zinc/61/69/04/636616904.db2.gz WIVQGAFMHPDBEL-QWRGUYRKSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1c(C[N@@H+]2CCO[C@@H](C)[C@@H]2C)ccnc1F ZINC000862245741 636616912 /nfs/dbraw/zinc/61/69/12/636616912.db2.gz WIVQGAFMHPDBEL-QWRGUYRKSA-N 1 2 238.306 2.138 20 0 BEADLO CN(C)c1ccc(C(=O)/C=C/c2[nH]cc[nH+]2)cc1 ZINC000067647858 636757891 /nfs/dbraw/zinc/75/78/91/636757891.db2.gz MMYFKXPPMKKVHZ-BQYQJAHWSA-N 1 2 241.294 2.372 20 0 BEADLO CC(C)(C)c1cn(CC[C@H]2CCOC2=O)c[nH+]1 ZINC000865376194 636811797 /nfs/dbraw/zinc/81/17/97/636811797.db2.gz DFGUQPCJSQTWCN-JTQLQIEISA-N 1 2 236.315 2.134 20 0 BEADLO C[C@H]([NH2+]Cc1ccon1)c1ccc2c(c1)CCO2 ZINC000148701200 636831963 /nfs/dbraw/zinc/83/19/63/636831963.db2.gz ISDQBHDIIILUOW-JTQLQIEISA-N 1 2 244.294 2.460 20 0 BEADLO Cc1ccccc1CC(N)=[NH+]OCc1ccon1 ZINC000080292138 636940840 /nfs/dbraw/zinc/94/08/40/636940840.db2.gz XZQHJFJRYZRAHE-UHFFFAOYSA-N 1 2 245.282 2.015 20 0 BEADLO CC[C@@H]1C[C@@H](C)CN1C(=O)CNc1cccc[nH+]1 ZINC000900908479 637204152 /nfs/dbraw/zinc/20/41/52/637204152.db2.gz HYPRIXFTHRKYKL-VXGBXAGGSA-N 1 2 247.342 2.141 20 0 BEADLO Cc1[nH]cc(-c2cccc3c2CCO3)[nH+]1 ZINC000904900288 637529298 /nfs/dbraw/zinc/52/92/98/637529298.db2.gz GTAFMTPOZAZECI-UHFFFAOYSA-N 1 2 200.241 2.320 20 0 BEADLO Cc1cc(C)c(C(=O)N2CCCC2)c(C)[nH+]1 ZINC000905023630 637571489 /nfs/dbraw/zinc/57/14/89/637571489.db2.gz MIPHRYWGULPQNH-UHFFFAOYSA-N 1 2 218.300 2.243 20 0 BEADLO Cc1cccc([C@H](O)C[NH2+]CC(C)(F)F)c1 ZINC000905267003 637719292 /nfs/dbraw/zinc/71/92/92/637719292.db2.gz GYDBNIAGSBGQSW-LLVKDONJSA-N 1 2 229.270 2.273 20 0 BEADLO CC(C)(C)C(F)(F)C[NH2+]C[C@@](C)(O)C(F)F ZINC000905380301 637782220 /nfs/dbraw/zinc/78/22/20/637782220.db2.gz FFIUHVFKYSFZRO-SECBINFHSA-N 1 2 245.260 2.274 20 0 BEADLO CC[C@H](C)[C@@H]([NH2+][C@H]1CC12CCC2)C(=O)OC ZINC000905779786 637908899 /nfs/dbraw/zinc/90/88/99/637908899.db2.gz ZMDJUULDDPXUOH-GARJFASQSA-N 1 2 225.332 2.106 20 0 BEADLO CC/C=C/C[NH2+][C@H](C(=O)OC)[C@@H](C)CC ZINC000905769766 637925683 /nfs/dbraw/zinc/92/56/83/637925683.db2.gz JAMCCFRPALOMLD-IJUHFESZSA-N 1 2 213.321 2.130 20 0 BEADLO CC[C@H](C)[C@H]([NH2+][C@@H]1CCC(F)(F)C1)C(=O)OC ZINC000905768006 637923719 /nfs/dbraw/zinc/92/37/19/637923719.db2.gz POOZETGGQZGBDR-AEJSXWLSSA-N 1 2 249.301 2.352 20 0 BEADLO Cc1[nH]cc(-c2cnn(C(C)(C)C)c2)[nH+]1 ZINC000906188137 638096033 /nfs/dbraw/zinc/09/60/33/638096033.db2.gz ZQJWNPJEBHCRCW-UHFFFAOYSA-N 1 2 204.277 2.337 20 0 BEADLO Cc1cc(C)c(C(=O)N[C@@H]2C[C@H]2C)c(C)[nH+]1 ZINC000906539500 638207492 /nfs/dbraw/zinc/20/74/92/638207492.db2.gz FDYNMEWVXVBIIK-RDDDGLTNSA-N 1 2 218.300 2.145 20 0 BEADLO Fc1cccc([C@H]2C[C@H]2[NH+]2CCOCC2)c1 ZINC000906585216 638210695 /nfs/dbraw/zinc/21/06/95/638210695.db2.gz XNMSFJZPEHVFOI-CHWSQXEVSA-N 1 2 221.275 2.014 20 0 BEADLO C[C@H]1CCC[C@H](NC(=O)Cc2c[nH]c[nH+]2)CC1 ZINC000907629599 638424620 /nfs/dbraw/zinc/42/46/20/638424620.db2.gz FYUCKLLJHQOHHQ-QWRGUYRKSA-N 1 2 235.331 2.037 20 0 BEADLO CC1CCC(C)(CNC(=O)Cc2c[nH]c[nH+]2)CC1 ZINC000907892432 638501291 /nfs/dbraw/zinc/50/12/91/638501291.db2.gz LNRXJCBYKNLKRS-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO CC(C)(C)[C@@H]1CCCN(C(=O)Cc2c[nH+]c[nH]2)C1 ZINC000907922535 638512361 /nfs/dbraw/zinc/51/23/61/638512361.db2.gz YRSVTEAIVAWMRR-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO CC(C)=CCC[C@@H](C)NC(=O)Cc1c[nH]c[nH+]1 ZINC000908564264 639017227 /nfs/dbraw/zinc/01/72/27/639017227.db2.gz IWSMIGAKNRRLLV-LLVKDONJSA-N 1 2 235.331 2.203 20 0 BEADLO CC(C)[C@H]1CN(C(=O)Cc2c[nH+]c[nH]2)[C@H]1C(C)C ZINC000909052759 639131364 /nfs/dbraw/zinc/13/13/64/639131364.db2.gz SMKCWSGDAHODBE-OCCSQVGLSA-N 1 2 249.358 2.091 20 0 BEADLO CC1(CCC(=O)OCc2ccc[nH+]c2N)CC1 ZINC000910038482 639347022 /nfs/dbraw/zinc/34/70/22/639347022.db2.gz VEMFNTCCLVOHDQ-UHFFFAOYSA-N 1 2 234.299 2.287 20 0 BEADLO C[C@@H]1CCN(C(=O)CNc2cccc[nH+]2)[C@H](C)C1 ZINC000911299893 639615180 /nfs/dbraw/zinc/61/51/80/639615180.db2.gz CBHKWNBXIOARBG-VXGBXAGGSA-N 1 2 247.342 2.141 20 0 BEADLO CCc1ncc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)o1 ZINC000930243780 639653949 /nfs/dbraw/zinc/65/39/49/639653949.db2.gz IJCCSAFDTGXAHW-ONGXEEELSA-N 1 2 226.295 2.417 20 0 BEADLO CCc1ncc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)o1 ZINC000930243780 639653956 /nfs/dbraw/zinc/65/39/56/639653956.db2.gz IJCCSAFDTGXAHW-ONGXEEELSA-N 1 2 226.295 2.417 20 0 BEADLO C[C@@H]([NH2+]Cc1nncs1)c1ccsc1 ZINC000930345884 639718725 /nfs/dbraw/zinc/71/87/25/639718725.db2.gz UTJBBUIFJGGXIL-SSDOTTSWSA-N 1 2 225.342 2.450 20 0 BEADLO CC[N@@H+](Cc1c(F)cncc1F)C[C@H](C)OC ZINC000930541123 639807768 /nfs/dbraw/zinc/80/77/68/639807768.db2.gz UPQSFOSEKNNYKK-VIFPVBQESA-N 1 2 244.285 2.217 20 0 BEADLO CC[N@H+](Cc1c(F)cncc1F)C[C@H](C)OC ZINC000930541123 639807771 /nfs/dbraw/zinc/80/77/71/639807771.db2.gz UPQSFOSEKNNYKK-VIFPVBQESA-N 1 2 244.285 2.217 20 0 BEADLO CSC[C@H]1CCC[N@H+](Cc2nncs2)C1 ZINC000930559457 639810663 /nfs/dbraw/zinc/81/06/63/639810663.db2.gz LIPBFOJBJCCAIJ-VIFPVBQESA-N 1 2 243.401 2.113 20 0 BEADLO CSC[C@H]1CCC[N@@H+](Cc2nncs2)C1 ZINC000930559457 639810664 /nfs/dbraw/zinc/81/06/64/639810664.db2.gz LIPBFOJBJCCAIJ-VIFPVBQESA-N 1 2 243.401 2.113 20 0 BEADLO CSC[C@@H]1CCC[N@H+](Cc2nncs2)C1 ZINC000930559456 639811029 /nfs/dbraw/zinc/81/10/29/639811029.db2.gz LIPBFOJBJCCAIJ-SECBINFHSA-N 1 2 243.401 2.113 20 0 BEADLO CSC[C@@H]1CCC[N@@H+](Cc2nncs2)C1 ZINC000930559456 639811030 /nfs/dbraw/zinc/81/10/30/639811030.db2.gz LIPBFOJBJCCAIJ-SECBINFHSA-N 1 2 243.401 2.113 20 0 BEADLO F[C@H]1CC[N@H+](C[C@@H]2CC[C@@H](C(F)(F)F)O2)C1 ZINC000930623712 639828238 /nfs/dbraw/zinc/82/82/38/639828238.db2.gz XDKHSOAJTYRLHX-CIUDSAMLSA-N 1 2 241.228 2.140 20 0 BEADLO F[C@H]1CC[N@@H+](C[C@@H]2CC[C@@H](C(F)(F)F)O2)C1 ZINC000930623712 639828239 /nfs/dbraw/zinc/82/82/39/639828239.db2.gz XDKHSOAJTYRLHX-CIUDSAMLSA-N 1 2 241.228 2.140 20 0 BEADLO C[C@@H](O)C[N@H+](CCCC(C)(F)F)CC(F)F ZINC000930653517 639846631 /nfs/dbraw/zinc/84/66/31/639846631.db2.gz ACAOSBPGSSEVGN-MRVPVSSYSA-N 1 2 245.260 2.370 20 0 BEADLO C[C@@H](O)C[N@@H+](CCCC(C)(F)F)CC(F)F ZINC000930653517 639846635 /nfs/dbraw/zinc/84/66/35/639846635.db2.gz ACAOSBPGSSEVGN-MRVPVSSYSA-N 1 2 245.260 2.370 20 0 BEADLO COc1nnc(C[N@@H+]2CC(C)(C)C[C@H]2C)s1 ZINC000930721484 639877512 /nfs/dbraw/zinc/87/75/12/639877512.db2.gz GSYWFSJCFULWJK-MRVPVSSYSA-N 1 2 241.360 2.167 20 0 BEADLO COc1nnc(C[N@H+]2CC(C)(C)C[C@H]2C)s1 ZINC000930721484 639877513 /nfs/dbraw/zinc/87/75/13/639877513.db2.gz GSYWFSJCFULWJK-MRVPVSSYSA-N 1 2 241.360 2.167 20 0 BEADLO COCCCC[N@H+](C)Cc1c(F)cncc1F ZINC000930744879 639892073 /nfs/dbraw/zinc/89/20/73/639892073.db2.gz OTCQRHMPLPKYKP-UHFFFAOYSA-N 1 2 244.285 2.218 20 0 BEADLO COCCCC[N@@H+](C)Cc1c(F)cncc1F ZINC000930744879 639892074 /nfs/dbraw/zinc/89/20/74/639892074.db2.gz OTCQRHMPLPKYKP-UHFFFAOYSA-N 1 2 244.285 2.218 20 0 BEADLO C[N@H+](CCC(C)(C)C)Cc1nncs1 ZINC000930818374 639919183 /nfs/dbraw/zinc/91/91/83/639919183.db2.gz GWCCUCJIDQMXNM-UHFFFAOYSA-N 1 2 213.350 2.406 20 0 BEADLO C[N@@H+](CCC(C)(C)C)Cc1nncs1 ZINC000930818374 639919190 /nfs/dbraw/zinc/91/91/90/639919190.db2.gz GWCCUCJIDQMXNM-UHFFFAOYSA-N 1 2 213.350 2.406 20 0 BEADLO CC[C@H](C)CCNC(=O)CNc1cccc[nH+]1 ZINC000912385025 640037737 /nfs/dbraw/zinc/03/77/37/640037737.db2.gz RNZJTCXYWXBBLI-NSHDSACASA-N 1 2 235.331 2.046 20 0 BEADLO COc1nnc(C[N@H+](C)C[C@H]2CC2(C)C)s1 ZINC000931082319 640064028 /nfs/dbraw/zinc/06/40/28/640064028.db2.gz QUXBOLFFMYWMEJ-MRVPVSSYSA-N 1 2 241.360 2.025 20 0 BEADLO COc1nnc(C[N@@H+](C)C[C@H]2CC2(C)C)s1 ZINC000931082319 640064035 /nfs/dbraw/zinc/06/40/35/640064035.db2.gz QUXBOLFFMYWMEJ-MRVPVSSYSA-N 1 2 241.360 2.025 20 0 BEADLO CC/C=C/CC[N@@H+]1CCC[C@H]1c1nnc[nH]1 ZINC000931139856 640076127 /nfs/dbraw/zinc/07/61/27/640076127.db2.gz AUKLYUWLSRFVBZ-UFFNRZRYSA-N 1 2 220.320 2.298 20 0 BEADLO CC/C=C/CC[N@H+]1CCC[C@H]1c1nnc[nH]1 ZINC000931139856 640076136 /nfs/dbraw/zinc/07/61/36/640076136.db2.gz AUKLYUWLSRFVBZ-UFFNRZRYSA-N 1 2 220.320 2.298 20 0 BEADLO CC[C@H](NC(=O)C(C)(C)n1c[nH+]c(C)c1)C1CC1 ZINC000912514714 640103207 /nfs/dbraw/zinc/10/32/07/640103207.db2.gz JEHSIAJAJOBMKZ-LBPRGKRZSA-N 1 2 249.358 2.231 20 0 BEADLO CC[C@](C)(NC(=O)CNc1cccc[nH+]1)C1CC1 ZINC000912515031 640103830 /nfs/dbraw/zinc/10/38/30/640103830.db2.gz RSJKQCUAPYMVOO-AWEZNQCLSA-N 1 2 247.342 2.188 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)N1CCCCC1 ZINC000931224249 640105790 /nfs/dbraw/zinc/10/57/90/640105790.db2.gz ZXPLBEAEQHQORL-UHFFFAOYSA-N 1 2 244.298 2.352 20 0 BEADLO CC1=C(C(=O)NCC(C)(C)n2cc[nH+]c2)CCC1 ZINC000912615254 640136653 /nfs/dbraw/zinc/13/66/53/640136653.db2.gz JGRXPYOUUOGNFD-UHFFFAOYSA-N 1 2 247.342 2.235 20 0 BEADLO CC(C(=O)NCC(C)(C)n1cc[nH+]c1)=C1CCC1 ZINC000912614013 640138968 /nfs/dbraw/zinc/13/89/68/640138968.db2.gz HAWDBQQYBBJUHQ-UHFFFAOYSA-N 1 2 247.342 2.235 20 0 BEADLO Cc1n[nH]cc1C[N@@H+](C)Cc1cc(C)cc(C)n1 ZINC000931417662 640187704 /nfs/dbraw/zinc/18/77/04/640187704.db2.gz NTEJEOQKCIMLOH-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO Cc1n[nH]cc1C[N@H+](C)Cc1cc(C)cc(C)n1 ZINC000931417662 640187706 /nfs/dbraw/zinc/18/77/06/640187706.db2.gz NTEJEOQKCIMLOH-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO FCCC1CC[NH+](Cc2nncs2)CC1 ZINC000931466936 640227072 /nfs/dbraw/zinc/22/70/72/640227072.db2.gz VKEAEWCMAFOFQB-UHFFFAOYSA-N 1 2 229.324 2.110 20 0 BEADLO C/C=C\C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000912909636 640232915 /nfs/dbraw/zinc/23/29/15/640232915.db2.gz MSMWAQZUBCQZHV-IHWYPQMZSA-N 1 2 227.267 2.387 20 0 BEADLO FC[C@@H]1CC[N@H+](Cc2c(F)cncc2F)C1 ZINC000931688729 640318341 /nfs/dbraw/zinc/31/83/41/640318341.db2.gz LNHXNEPSXRPCQU-QMMMGPOBSA-N 1 2 230.233 2.151 20 0 BEADLO FC[C@@H]1CC[N@@H+](Cc2c(F)cncc2F)C1 ZINC000931688729 640318344 /nfs/dbraw/zinc/31/83/44/640318344.db2.gz LNHXNEPSXRPCQU-QMMMGPOBSA-N 1 2 230.233 2.151 20 0 BEADLO CC(C)C[N@H+](Cn1ncn(C)c1=S)C1CC1 ZINC000078330054 640426299 /nfs/dbraw/zinc/42/62/99/640426299.db2.gz VTRFYIBGKJTUAW-UHFFFAOYSA-N 1 2 240.376 2.029 20 0 BEADLO CC(C)C[N@@H+](Cn1ncn(C)c1=S)C1CC1 ZINC000078330054 640426300 /nfs/dbraw/zinc/42/63/00/640426300.db2.gz VTRFYIBGKJTUAW-UHFFFAOYSA-N 1 2 240.376 2.029 20 0 BEADLO CC(C)c1cnc(C[N@@H+]2CCO[C@@H](C)CC2)o1 ZINC000932334688 640478674 /nfs/dbraw/zinc/47/86/74/640478674.db2.gz CJLUAMMQDOEUTO-NSHDSACASA-N 1 2 238.331 2.409 20 0 BEADLO CC(C)c1cnc(C[N@H+]2CCO[C@@H](C)CC2)o1 ZINC000932334688 640478679 /nfs/dbraw/zinc/47/86/79/640478679.db2.gz CJLUAMMQDOEUTO-NSHDSACASA-N 1 2 238.331 2.409 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CCO[C@H](C)CC2)s1 ZINC000932346480 640486376 /nfs/dbraw/zinc/48/63/76/640486376.db2.gz IPIPNVBRLXKLLA-BDAKNGLRSA-N 1 2 241.360 2.018 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CCO[C@H](C)CC2)s1 ZINC000932346480 640486384 /nfs/dbraw/zinc/48/63/84/640486384.db2.gz IPIPNVBRLXKLLA-BDAKNGLRSA-N 1 2 241.360 2.018 20 0 BEADLO CC(C)=CC[NH+]1CC(NC(=O)c2ccccc2)C1 ZINC001030058894 640553981 /nfs/dbraw/zinc/55/39/81/640553981.db2.gz PBRKJWUVCFDIKV-UHFFFAOYSA-N 1 2 244.338 2.067 20 0 BEADLO CC(C)=CC[NH+]1CC(NC(=O)[C@@H]2CC=CCC2)C1 ZINC001030090028 640584446 /nfs/dbraw/zinc/58/44/46/640584446.db2.gz PRZBBRCISVGJOX-CYBMUJFWSA-N 1 2 248.370 2.109 20 0 BEADLO Cc1cc(NC(=O)C[C@H]2CC=CCC2)cc[nH+]1 ZINC000932607849 640585685 /nfs/dbraw/zinc/58/56/85/640585685.db2.gz YGAQPEUJNVXWMH-LBPRGKRZSA-N 1 2 230.311 2.497 20 0 BEADLO O=C(/C=C/c1ccccc1)OCCn1cc[nH+]c1 ZINC000224294148 640607635 /nfs/dbraw/zinc/60/76/35/640607635.db2.gz NXFKMUGHTXFEOI-VOTSOKGWSA-N 1 2 242.278 2.140 20 0 BEADLO Cn1cnn(C[N@H+](C)CC2CCCC2)c1=S ZINC000058207434 640690784 /nfs/dbraw/zinc/69/07/84/640690784.db2.gz PWVNJURZPLJLKX-UHFFFAOYSA-N 1 2 240.376 2.031 20 0 BEADLO Cn1cnn(C[N@@H+](C)CC2CCCC2)c1=S ZINC000058207434 640690785 /nfs/dbraw/zinc/69/07/85/640690785.db2.gz PWVNJURZPLJLKX-UHFFFAOYSA-N 1 2 240.376 2.031 20 0 BEADLO O=C(NCCC1CC1)c1cc2c[nH+]ccc2[nH]1 ZINC000933692757 640745885 /nfs/dbraw/zinc/74/58/85/640745885.db2.gz PUNBUMRTBFENLE-UHFFFAOYSA-N 1 2 229.283 2.093 20 0 BEADLO c1csc(C[NH2+][C@@H]2CCc3cccnc32)n1 ZINC000226816603 640794114 /nfs/dbraw/zinc/79/41/14/640794114.db2.gz WMOZOHHFZBMFAX-SNVBAGLBSA-N 1 2 231.324 2.315 20 0 BEADLO c1nc(C[NH2+][C@H]2CCc3cccnc32)cs1 ZINC000226820875 640794217 /nfs/dbraw/zinc/79/42/17/640794217.db2.gz VXCICQBHVRBLCF-NSHDSACASA-N 1 2 231.324 2.315 20 0 BEADLO Cn1nccc1C[N@H+](Cc1ccoc1)C1CC1 ZINC000934005210 640803348 /nfs/dbraw/zinc/80/33/48/640803348.db2.gz WVYLWRZQUMOUMH-UHFFFAOYSA-N 1 2 231.299 2.178 20 0 BEADLO Cn1nccc1C[N@@H+](Cc1ccoc1)C1CC1 ZINC000934005210 640803352 /nfs/dbraw/zinc/80/33/52/640803352.db2.gz WVYLWRZQUMOUMH-UHFFFAOYSA-N 1 2 231.299 2.178 20 0 BEADLO C[C@H](c1cc(F)ccc1F)[N@@H+]1CC[C@@H]1CO ZINC000934027494 640808293 /nfs/dbraw/zinc/80/82/93/640808293.db2.gz VAFCWTUJPRKLRT-PSASIEDQSA-N 1 2 227.254 2.092 20 0 BEADLO C[C@H](c1cc(F)ccc1F)[N@H+]1CC[C@@H]1CO ZINC000934027494 640808297 /nfs/dbraw/zinc/80/82/97/640808297.db2.gz VAFCWTUJPRKLRT-PSASIEDQSA-N 1 2 227.254 2.092 20 0 BEADLO CCOC(C[NH2+][C@H](C)c1cscn1)OCC ZINC000229131054 640924961 /nfs/dbraw/zinc/92/49/61/640924961.db2.gz JCELGXITJVGINJ-SECBINFHSA-N 1 2 244.360 2.193 20 0 BEADLO CNc1cc(N(C)Cc2ccsc2)nc[nH+]1 ZINC000087811781 641050199 /nfs/dbraw/zinc/05/01/99/641050199.db2.gz GCINZODHJFVISK-UHFFFAOYSA-N 1 2 234.328 2.216 20 0 BEADLO CNc1cc(N(C)Cc2ccsc2)[nH+]cn1 ZINC000087811781 641050201 /nfs/dbraw/zinc/05/02/01/641050201.db2.gz GCINZODHJFVISK-UHFFFAOYSA-N 1 2 234.328 2.216 20 0 BEADLO CCCNc1cc(N2CCC[C@@H]2C)nc[nH+]1 ZINC000087820192 641055653 /nfs/dbraw/zinc/05/56/53/641055653.db2.gz PDHNQTIIJCKNAP-JTQLQIEISA-N 1 2 220.320 2.287 20 0 BEADLO CCCNc1cc(N2CCC[C@@H]2C)[nH+]cn1 ZINC000087820192 641055654 /nfs/dbraw/zinc/05/56/54/641055654.db2.gz PDHNQTIIJCKNAP-JTQLQIEISA-N 1 2 220.320 2.287 20 0 BEADLO CC[C@H]1CCCN(c2cc(NC)[nH+]cn2)C1 ZINC000087819202 641056997 /nfs/dbraw/zinc/05/69/97/641056997.db2.gz JQDGQNCDWFNGCF-JTQLQIEISA-N 1 2 220.320 2.145 20 0 BEADLO CC[C@H]1CCCN(c2cc(NC)nc[nH+]2)C1 ZINC000087819202 641057000 /nfs/dbraw/zinc/05/70/00/641057000.db2.gz JQDGQNCDWFNGCF-JTQLQIEISA-N 1 2 220.320 2.145 20 0 BEADLO CO[C@H]1CC[C@@H]1[N@H+](C)Cc1scnc1Cl ZINC000934107996 641061843 /nfs/dbraw/zinc/06/18/43/641061843.db2.gz YIEMEWUUDQQDCJ-YUMQZZPRSA-N 1 2 246.763 2.406 20 0 BEADLO CO[C@H]1CC[C@@H]1[N@@H+](C)Cc1scnc1Cl ZINC000934107996 641061846 /nfs/dbraw/zinc/06/18/46/641061846.db2.gz YIEMEWUUDQQDCJ-YUMQZZPRSA-N 1 2 246.763 2.406 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@H+](C)Cc1ncc(C(C)C)o1 ZINC000934111035 641073208 /nfs/dbraw/zinc/07/32/08/641073208.db2.gz QHPQLZWYUMRAPU-WDEREUQCSA-N 1 2 238.331 2.407 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@@H+](C)Cc1ncc(C(C)C)o1 ZINC000934111035 641073214 /nfs/dbraw/zinc/07/32/14/641073214.db2.gz QHPQLZWYUMRAPU-WDEREUQCSA-N 1 2 238.331 2.407 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@H+](C)Cc1ncc(Cl)s1 ZINC000934114291 641080181 /nfs/dbraw/zinc/08/01/81/641080181.db2.gz SAHSUMUKOULBKK-HTQZYQBOSA-N 1 2 246.763 2.406 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@@H+](C)Cc1ncc(Cl)s1 ZINC000934114291 641080185 /nfs/dbraw/zinc/08/01/85/641080185.db2.gz SAHSUMUKOULBKK-HTQZYQBOSA-N 1 2 246.763 2.406 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@H+](C)Cc1ncc(C2CC2)o1 ZINC000934114640 641080796 /nfs/dbraw/zinc/08/07/96/641080796.db2.gz KTEOGPOZBKRJTO-WDEREUQCSA-N 1 2 236.315 2.161 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@@H+](C)Cc1ncc(C2CC2)o1 ZINC000934114640 641080800 /nfs/dbraw/zinc/08/08/00/641080800.db2.gz KTEOGPOZBKRJTO-WDEREUQCSA-N 1 2 236.315 2.161 20 0 BEADLO CCCCC1([NH2+]Cc2noc(C)n2)CC1 ZINC000934208540 641102971 /nfs/dbraw/zinc/10/29/71/641102971.db2.gz AWQTYIIFGQOWCD-UHFFFAOYSA-N 1 2 209.293 2.190 20 0 BEADLO Cc1[nH]c(CNC(=O)CCC2(C)CC2)[nH+]c1C ZINC000934424576 641143361 /nfs/dbraw/zinc/14/33/61/641143361.db2.gz GJXQQLKSTPWRJF-UHFFFAOYSA-N 1 2 235.331 2.223 20 0 BEADLO C[C@H]1SCC[N@H+](Cn2cc[nH]c2=S)[C@H]1C ZINC000173351564 641172618 /nfs/dbraw/zinc/17/26/18/641172618.db2.gz ZJWIGUAVCRLCCL-DTWKUNHWSA-N 1 2 243.401 2.329 20 0 BEADLO C[C@H]1SCC[N@@H+](Cn2cc[nH]c2=S)[C@H]1C ZINC000173351564 641172622 /nfs/dbraw/zinc/17/26/22/641172622.db2.gz ZJWIGUAVCRLCCL-DTWKUNHWSA-N 1 2 243.401 2.329 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+]1CC[C@@H](O)[C@H](F)C1 ZINC000934574991 641204095 /nfs/dbraw/zinc/20/40/95/641204095.db2.gz VSJMPTPBINNNFY-CHWSQXEVSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1ccc(F)cc1C[N@H+]1CC[C@@H](O)[C@H](F)C1 ZINC000934574991 641204101 /nfs/dbraw/zinc/20/41/01/641204101.db2.gz VSJMPTPBINNNFY-CHWSQXEVSA-N 1 2 241.281 2.039 20 0 BEADLO CCCc1nc(C[NH2+]C(C)(C)CSC)no1 ZINC000934676374 641243616 /nfs/dbraw/zinc/24/36/16/641243616.db2.gz XRAGBCDOCHRTRA-UHFFFAOYSA-N 1 2 243.376 2.253 20 0 BEADLO CCCCOC(=O)[C@H](C)[NH2+]C(C)(C)CSC ZINC000934676196 641245383 /nfs/dbraw/zinc/24/53/83/641245383.db2.gz TWDVJFHJXQAMCB-JTQLQIEISA-N 1 2 247.404 2.449 20 0 BEADLO c1nsnc1C[NH2+][C@H](c1ccncc1)C1CC1 ZINC000934700283 641250876 /nfs/dbraw/zinc/25/08/76/641250876.db2.gz PLOMAQCIOPKGSM-LBPRGKRZSA-N 1 2 246.339 2.174 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)CCC1(C)CC1 ZINC000934912471 641301827 /nfs/dbraw/zinc/30/18/27/641301827.db2.gz LNIVZMULZYGFAW-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO CS[C@H](C)CNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000935045228 641324906 /nfs/dbraw/zinc/32/49/06/641324906.db2.gz WSVCOEACDAUVOZ-MRVPVSSYSA-N 1 2 249.339 2.044 20 0 BEADLO C[C@@H](c1nc(C2CCCC2)no1)[NH+](C)C ZINC000350594977 641369927 /nfs/dbraw/zinc/36/99/27/641369927.db2.gz LJDNHAGKJYGPCY-QMMMGPOBSA-N 1 2 209.293 2.350 20 0 BEADLO C[C@@H]1CC[C@@H](NC(=O)c2cc3c[nH+]ccc3[nH]2)C1 ZINC000935540795 641425431 /nfs/dbraw/zinc/42/54/31/641425431.db2.gz MUOAIDCJHVIDDA-MWLCHTKSSA-N 1 2 243.310 2.481 20 0 BEADLO O=C(N[C@H]1[C@@H]2CCC[C@@H]21)c1cc2c[nH+]ccc2[nH]1 ZINC000935702097 641465045 /nfs/dbraw/zinc/46/50/45/641465045.db2.gz QWBGITBLXYCJPK-IWIIMEHWSA-N 1 2 241.294 2.091 20 0 BEADLO O=C(NCCCCF)c1cc2c[nH+]ccc2[nH]1 ZINC000936066067 641528488 /nfs/dbraw/zinc/52/84/88/641528488.db2.gz KFFLHNBBOAFEEH-UHFFFAOYSA-N 1 2 235.262 2.042 20 0 BEADLO CCCC(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC000152590962 641621783 /nfs/dbraw/zinc/62/17/83/641621783.db2.gz RWGQGBCAEPASNL-UHFFFAOYSA-N 1 2 221.304 2.195 20 0 BEADLO Cc1ccc(NC(=O)C(C)C)c(N(C)C)[nH+]1 ZINC000152619480 641622149 /nfs/dbraw/zinc/62/21/49/641622149.db2.gz CKZMWVWBIRUDTD-UHFFFAOYSA-N 1 2 221.304 2.051 20 0 BEADLO CCCC[C@@H]([NH2+]C[C@H]1CCC=CO1)C(=O)OC ZINC000187732903 641722614 /nfs/dbraw/zinc/72/26/14/641722614.db2.gz NVGXKDIFPFZRBH-VXGBXAGGSA-N 1 2 241.331 2.001 20 0 BEADLO Cc1cnc(C[NH2+]Cc2ccc(F)nc2)s1 ZINC000189129722 641789072 /nfs/dbraw/zinc/78/90/72/641789072.db2.gz KIYQPTQBCCRROA-UHFFFAOYSA-N 1 2 237.303 2.275 20 0 BEADLO CC[NH+]1CC(NC(=O)[C@H]2CCCCC2(C)C)C1 ZINC001031458954 642177557 /nfs/dbraw/zinc/17/75/57/642177557.db2.gz QEYUHXBAZWLUAL-GFCCVEGCSA-N 1 2 238.375 2.023 20 0 BEADLO CC[NH+]1CC(NC(=O)[C@@H]2CCCCC2(C)C)C1 ZINC001031458957 642178079 /nfs/dbraw/zinc/17/80/79/642178079.db2.gz QEYUHXBAZWLUAL-LBPRGKRZSA-N 1 2 238.375 2.023 20 0 BEADLO Cc1nn(C)c(C[NH2+]Cc2ccoc2)c1Cl ZINC000130669676 642361221 /nfs/dbraw/zinc/36/12/21/642361221.db2.gz DQUKFSVBRFNRNP-UHFFFAOYSA-N 1 2 239.706 2.265 20 0 BEADLO O=C(NCCCC1CC1)c1cc2c[nH+]ccc2[nH]1 ZINC000933173140 642371815 /nfs/dbraw/zinc/37/18/15/642371815.db2.gz VAIJAQCOXGSKNZ-UHFFFAOYSA-N 1 2 243.310 2.483 20 0 BEADLO O=C(N[C@@H]1CC=CCC1)c1cc2c[nH+]ccc2[nH]1 ZINC000933178999 642376554 /nfs/dbraw/zinc/37/65/54/642376554.db2.gz GNFMXRTXUJPDJG-LLVKDONJSA-N 1 2 241.294 2.401 20 0 BEADLO Fc1cccc(NCCNc2cccc[nH+]2)n1 ZINC000919961909 642414663 /nfs/dbraw/zinc/41/46/63/642414663.db2.gz ABINLUOFUXQWTF-UHFFFAOYSA-N 1 2 232.262 2.140 20 0 BEADLO c1[nH+]cn2ccnc(N3CCCCCC3)c12 ZINC000891389074 642455048 /nfs/dbraw/zinc/45/50/48/642455048.db2.gz BRDBKLVURLLGFM-UHFFFAOYSA-N 1 2 216.288 2.110 20 0 BEADLO CN(c1nccn2c[nH+]cc12)C1CCCCC1 ZINC000891394136 642463108 /nfs/dbraw/zinc/46/31/08/642463108.db2.gz AKWZPWCUGRZPNH-UHFFFAOYSA-N 1 2 230.315 2.498 20 0 BEADLO CC[C@@H]1CCC[N@H+](Cc2nnc(OC)s2)C1 ZINC000920258026 642464352 /nfs/dbraw/zinc/46/43/52/642464352.db2.gz DTSNQJYWDKXUBY-SECBINFHSA-N 1 2 241.360 2.169 20 0 BEADLO CC[C@@H]1CCC[N@@H+](Cc2nnc(OC)s2)C1 ZINC000920258026 642464358 /nfs/dbraw/zinc/46/43/58/642464358.db2.gz DTSNQJYWDKXUBY-SECBINFHSA-N 1 2 241.360 2.169 20 0 BEADLO CCCCOC(=O)C[NH+]1C[C@@H](C)S[C@H](C)C1 ZINC000069908807 642932478 /nfs/dbraw/zinc/93/24/78/642932478.db2.gz SSICTKUBDQZWFX-GHMZBOCLSA-N 1 2 245.388 2.156 20 0 BEADLO C#CCCCOC(=O)[C@@H](c1ccccc1)[NH+](C)C ZINC000181984979 642936334 /nfs/dbraw/zinc/93/63/34/642936334.db2.gz YVKMEURSEASEMR-CQSZACIVSA-N 1 2 245.322 2.246 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@H](C)Cc1cccs1 ZINC000070917152 643081796 /nfs/dbraw/zinc/08/17/96/643081796.db2.gz UBLJPZLZMSCWPC-ZJUUUORDSA-N 1 2 241.356 2.220 20 0 BEADLO C=CCCCO[NH+]=C(N)c1ccccc1 ZINC000077238341 643266574 /nfs/dbraw/zinc/26/65/74/643266574.db2.gz MJVBDOWRCHLRFS-UHFFFAOYSA-N 1 2 204.273 2.290 20 0 BEADLO CC=CC(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC000082275461 643291491 /nfs/dbraw/zinc/29/14/91/643291491.db2.gz QTWVTSAVRFHTDO-ONEGZZNKSA-N 1 2 215.256 2.386 20 0 BEADLO C[C@H]1CCCN(C(=O)c2cccc3[nH+]ccn32)C1 ZINC000082319529 643297745 /nfs/dbraw/zinc/29/77/45/643297745.db2.gz CGOBROQUTREIBS-NSHDSACASA-N 1 2 243.310 2.206 20 0 BEADLO Cc1nonc1C[N@@H+](C)[C@H]1CCc2ccccc21 ZINC000733897768 643477768 /nfs/dbraw/zinc/47/77/68/643477768.db2.gz VZKXGWOZPGQTIX-AWEZNQCLSA-N 1 2 243.310 2.497 20 0 BEADLO Cc1nonc1C[N@H+](C)[C@H]1CCc2ccccc21 ZINC000733897768 643477772 /nfs/dbraw/zinc/47/77/72/643477772.db2.gz VZKXGWOZPGQTIX-AWEZNQCLSA-N 1 2 243.310 2.497 20 0 BEADLO C[C@H]1C(=O)CCC[N@H+]1C[C@@H]1CCC(F)(F)C1 ZINC000932847129 643527886 /nfs/dbraw/zinc/52/78/86/643527886.db2.gz VVDZXVBMEKCIHU-VHSXEESVSA-N 1 2 231.286 2.475 20 0 BEADLO C[C@H]1C(=O)CCC[N@@H+]1C[C@@H]1CCC(F)(F)C1 ZINC000932847129 643527893 /nfs/dbraw/zinc/52/78/93/643527893.db2.gz VVDZXVBMEKCIHU-VHSXEESVSA-N 1 2 231.286 2.475 20 0 BEADLO C[C@H]1C(=O)CCC[N@H+]1C[C@H]1CCC(F)(F)C1 ZINC000932847128 643528695 /nfs/dbraw/zinc/52/86/95/643528695.db2.gz VVDZXVBMEKCIHU-UWVGGRQHSA-N 1 2 231.286 2.475 20 0 BEADLO C[C@H]1C(=O)CCC[N@@H+]1C[C@H]1CCC(F)(F)C1 ZINC000932847128 643528700 /nfs/dbraw/zinc/52/87/00/643528700.db2.gz VVDZXVBMEKCIHU-UWVGGRQHSA-N 1 2 231.286 2.475 20 0 BEADLO Cc1cc(C[NH2+]Cc2cnn(C3CCC3)c2)no1 ZINC000921590692 643615793 /nfs/dbraw/zinc/61/57/93/643615793.db2.gz LDDRWVJZQXFYAT-UHFFFAOYSA-N 1 2 246.314 2.194 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@H](C)OC[C@H]2CC)o1 ZINC000929268176 643882166 /nfs/dbraw/zinc/88/21/66/643882166.db2.gz GUQFUVSHVXFEOJ-WDEREUQCSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@H](C)OC[C@H]2CC)o1 ZINC000929268176 643882170 /nfs/dbraw/zinc/88/21/70/643882170.db2.gz GUQFUVSHVXFEOJ-WDEREUQCSA-N 1 2 238.331 2.236 20 0 BEADLO CC1(C(=O)OCc2ccc[nH+]c2N)CCCC1 ZINC000922222033 643908389 /nfs/dbraw/zinc/90/83/89/643908389.db2.gz NGIHPIKAPBYTHP-UHFFFAOYSA-N 1 2 234.299 2.287 20 0 BEADLO CCC/C=C\C(=O)OCc1ccc(N)[nH+]c1 ZINC000922352973 643979871 /nfs/dbraw/zinc/97/98/71/643979871.db2.gz WVVNVVQUERDOOW-PLNGDYQASA-N 1 2 220.272 2.063 20 0 BEADLO Cc1[nH]c(CNc2cc(F)ccn2)[nH+]c1C ZINC000922379861 643983645 /nfs/dbraw/zinc/98/36/45/643983645.db2.gz HHWYCFRTQHINME-UHFFFAOYSA-N 1 2 220.251 2.173 20 0 BEADLO CC1(C)C(C(=O)OCc2ccc(N)[nH+]c2)C1(C)C ZINC000922502163 644005249 /nfs/dbraw/zinc/00/52/49/644005249.db2.gz SPGPLSRIWMLOFU-UHFFFAOYSA-N 1 2 248.326 2.389 20 0 BEADLO Nc1ccc(COC(=O)[C@H]2CC23CCCC3)c[nH+]1 ZINC000922507575 644005823 /nfs/dbraw/zinc/00/58/23/644005823.db2.gz HGWOJAWWPGIURQ-LLVKDONJSA-N 1 2 246.310 2.287 20 0 BEADLO Nc1[nH+]cccc1COC(=O)[C@@H]1CC12CCCC2 ZINC000922508429 644006452 /nfs/dbraw/zinc/00/64/52/644006452.db2.gz SWDZSRONYPRXMO-NSHDSACASA-N 1 2 246.310 2.287 20 0 BEADLO CCC(=CC(=O)OCc1ccc(N)[nH+]c1)CC ZINC000922527763 644015429 /nfs/dbraw/zinc/01/54/29/644015429.db2.gz YJNBSSVLJNHSAJ-UHFFFAOYSA-N 1 2 234.299 2.453 20 0 BEADLO c1cc(C[NH2+][C@H](c2ncccn2)C2CC2)co1 ZINC000922581879 644034210 /nfs/dbraw/zinc/03/42/10/644034210.db2.gz WVHRKALXNCLBES-LBPRGKRZSA-N 1 2 229.283 2.311 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)OCc2ccc(N)[nH+]c2)C1 ZINC000922585358 644035975 /nfs/dbraw/zinc/03/59/75/644035975.db2.gz FHELHQAZGIGKCZ-MWLCHTKSSA-N 1 2 234.299 2.143 20 0 BEADLO c1nc(C[NH2+][C@H](c2ccccn2)C2CC2)co1 ZINC000922585053 644036131 /nfs/dbraw/zinc/03/61/31/644036131.db2.gz QDCCDUGBAIZLKH-ZDUSSCGKSA-N 1 2 229.283 2.311 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)OCc1ccc[nH+]c1N ZINC000922593643 644037179 /nfs/dbraw/zinc/03/71/79/644037179.db2.gz OUQWXKPNSLTROR-VHSXEESVSA-N 1 2 236.315 2.389 20 0 BEADLO Cc1[nH]ncc1C[NH2+]C[C@H]1CCCC2(CCC2)O1 ZINC000922813907 644099699 /nfs/dbraw/zinc/09/96/99/644099699.db2.gz SLFDNYNYLXXIMO-CYBMUJFWSA-N 1 2 249.358 2.300 20 0 BEADLO Oc1ccc(C[NH2+]Cc2ccon2)cc1Cl ZINC000086452649 644138966 /nfs/dbraw/zinc/13/89/66/644138966.db2.gz XDUPQAOXOZSBHA-UHFFFAOYSA-N 1 2 238.674 2.323 20 0 BEADLO Cc1nn(C)c(Cl)c1C[NH2+]Cc1ccco1 ZINC000073870587 644142967 /nfs/dbraw/zinc/14/29/67/644142967.db2.gz PJTBYJQFKZWHRV-UHFFFAOYSA-N 1 2 239.706 2.265 20 0 BEADLO C[C@@]1([NH2+]Cc2ncc[nH]2)CCOc2ccccc21 ZINC000923023870 644235914 /nfs/dbraw/zinc/23/59/14/644235914.db2.gz CLJGMGGUCCZTAV-CQSZACIVSA-N 1 2 243.310 2.197 20 0 BEADLO C[C@@]1([NH2+]Cc2cocn2)CCOc2ccccc21 ZINC000923026978 644236838 /nfs/dbraw/zinc/23/68/38/644236838.db2.gz YFXLHVDFNUJDCH-CQSZACIVSA-N 1 2 244.294 2.462 20 0 BEADLO CC[N@H+](CCC#N)C[C@H](O)c1ccccc1C ZINC000081515151 644325634 /nfs/dbraw/zinc/32/56/34/644325634.db2.gz ZHJJPPMVHOSIDN-AWEZNQCLSA-N 1 2 232.327 2.264 20 0 BEADLO CC[N@@H+](CCC#N)C[C@H](O)c1ccccc1C ZINC000081515151 644325641 /nfs/dbraw/zinc/32/56/41/644325641.db2.gz ZHJJPPMVHOSIDN-AWEZNQCLSA-N 1 2 232.327 2.264 20 0 BEADLO Nc1[nH+]cccc1COC(=O)C1(C2CC2)CCC1 ZINC000923338185 644358252 /nfs/dbraw/zinc/35/82/52/644358252.db2.gz YGMZNCFCKCTJDZ-UHFFFAOYSA-N 1 2 246.310 2.287 20 0 BEADLO CCC[C@H](C)N(C)c1cc(NC)[nH+]cn1 ZINC000087813465 644503709 /nfs/dbraw/zinc/50/37/09/644503709.db2.gz IJRRAIBOWCZEOZ-VIFPVBQESA-N 1 2 208.309 2.143 20 0 BEADLO CCC[C@H](C)N(C)c1cc(NC)nc[nH+]1 ZINC000087813465 644503712 /nfs/dbraw/zinc/50/37/12/644503712.db2.gz IJRRAIBOWCZEOZ-VIFPVBQESA-N 1 2 208.309 2.143 20 0 BEADLO CCOc1ccccc1C[NH+]1CC(O)(C(C)C)C1 ZINC000089676670 644561306 /nfs/dbraw/zinc/56/13/06/644561306.db2.gz IMOOPVFHOBCAPF-UHFFFAOYSA-N 1 2 249.354 2.288 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C(F)=C1CCCC1 ZINC000763055458 644653676 /nfs/dbraw/zinc/65/36/76/644653676.db2.gz IDICHKXYSCCAGY-UHFFFAOYSA-N 1 2 237.278 2.132 20 0 BEADLO CCC(=CC(=O)N[C@H]1CCn2cc[nH+]c2C1)CC ZINC000779212939 644710794 /nfs/dbraw/zinc/71/07/94/644710794.db2.gz AJJKLHZHHXMSNZ-LBPRGKRZSA-N 1 2 247.342 2.061 20 0 BEADLO COC[C@H]([NH3+])c1nc([C@H]2CCC[C@H](C)C2)no1 ZINC000251857842 644828955 /nfs/dbraw/zinc/82/89/55/644828955.db2.gz PPFVIYZVEXINHV-GUBZILKMSA-N 1 2 239.319 2.010 20 0 BEADLO c1cc(C[N@@H+]2C[C@]3(CCCO3)[C@@H]2C2CC2)co1 ZINC000816666349 644965023 /nfs/dbraw/zinc/96/50/23/644965023.db2.gz KZTVULJCERUSEI-UONOGXRCSA-N 1 2 233.311 2.423 20 0 BEADLO c1cc(C[N@H+]2C[C@]3(CCCO3)[C@@H]2C2CC2)co1 ZINC000816666349 644965024 /nfs/dbraw/zinc/96/50/24/644965024.db2.gz KZTVULJCERUSEI-UONOGXRCSA-N 1 2 233.311 2.423 20 0 BEADLO Cc1cc(CNC(=O)[C@@H](F)C(C)C)cc(C)[nH+]1 ZINC000817459157 644984034 /nfs/dbraw/zinc/98/40/34/644984034.db2.gz QPZVAKFBOVMGLP-LBPRGKRZSA-N 1 2 238.306 2.309 20 0 BEADLO CCn1nc(C)c(C[NH2+][C@H](C)c2ccoc2)n1 ZINC000823990028 645052932 /nfs/dbraw/zinc/05/29/32/645052932.db2.gz GGIYUOPRFCDKEU-SECBINFHSA-N 1 2 234.303 2.050 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)NCCC[C@H]1C=CCC1 ZINC000834326684 645138745 /nfs/dbraw/zinc/13/87/45/645138745.db2.gz ILVVPULGAIBWME-LBPRGKRZSA-N 1 2 247.342 2.205 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2ncc[nH]2)nc1C ZINC000926570646 645290552 /nfs/dbraw/zinc/29/05/52/645290552.db2.gz XWHXEOYOAZTZAP-LLVKDONJSA-N 1 2 230.315 2.272 20 0 BEADLO Cc1ccnc(C[N@H+]2CCC[C@H](OC(C)C)C2)n1 ZINC000844379361 645322261 /nfs/dbraw/zinc/32/22/61/645322261.db2.gz PYCIPPWHYLPOCE-ZDUSSCGKSA-N 1 2 249.358 2.174 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCC[C@H](OC(C)C)C2)n1 ZINC000844379361 645322267 /nfs/dbraw/zinc/32/22/67/645322267.db2.gz PYCIPPWHYLPOCE-ZDUSSCGKSA-N 1 2 249.358 2.174 20 0 BEADLO Cc1ccnc(C[N@H+]2CCC[C@@H](OC(C)C)C2)n1 ZINC000844379359 645322358 /nfs/dbraw/zinc/32/23/58/645322358.db2.gz PYCIPPWHYLPOCE-CYBMUJFWSA-N 1 2 249.358 2.174 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCC[C@@H](OC(C)C)C2)n1 ZINC000844379359 645322361 /nfs/dbraw/zinc/32/23/61/645322361.db2.gz PYCIPPWHYLPOCE-CYBMUJFWSA-N 1 2 249.358 2.174 20 0 BEADLO CCC[C@H](C)[C@H](CO)[NH2+]CC(F)(F)C(F)F ZINC000844378801 645322989 /nfs/dbraw/zinc/32/29/89/645322989.db2.gz MLLOGDPUIYTKDT-YUMQZZPRSA-N 1 2 245.260 2.274 20 0 BEADLO COCc1cc[nH+]c(N[C@H](C)C(C)(C)CO)c1 ZINC000926658258 645340743 /nfs/dbraw/zinc/34/07/43/645340743.db2.gz CJYXAZIKZRGNKQ-SNVBAGLBSA-N 1 2 238.331 2.047 20 0 BEADLO CC[C@@H]1COC[C@@H]1Nc1cc(COC)cc[nH+]1 ZINC000926660522 645342869 /nfs/dbraw/zinc/34/28/69/645342869.db2.gz JOTHTHYQBJCXJU-NEPJUHHUSA-N 1 2 236.315 2.065 20 0 BEADLO C[C@@H]([NH2+]C[C@@H]1CCN1C(C)(C)C)c1ncco1 ZINC000926670891 645347222 /nfs/dbraw/zinc/34/72/22/645347222.db2.gz GJKIXTAEYRJTQD-MNOVXSKESA-N 1 2 237.347 2.198 20 0 BEADLO O=C(Cc1cn2c([nH+]1)CCCC2)OC1CCCC1 ZINC000845448076 645361450 /nfs/dbraw/zinc/36/14/50/645361450.db2.gz BFPSRJXREYGFFQ-UHFFFAOYSA-N 1 2 248.326 2.248 20 0 BEADLO CC[C@@H](C)OC(=O)Cc1cn2c([nH+]1)CCCC2 ZINC000845451005 645363412 /nfs/dbraw/zinc/36/34/12/645363412.db2.gz UHHGEPXYQSTZCL-SNVBAGLBSA-N 1 2 236.315 2.104 20 0 BEADLO COc1cc([C@H](C)[NH2+]Cc2ccc(C)o2)on1 ZINC000926788461 645433174 /nfs/dbraw/zinc/43/31/74/645433174.db2.gz GOMGZRPVYHKXJA-VIFPVBQESA-N 1 2 236.271 2.435 20 0 BEADLO Cc1cc(N[C@H]2COC[C@H]2C)c[nH+]c1C ZINC000926854617 645457128 /nfs/dbraw/zinc/45/71/28/645457128.db2.gz DGMGBWROZDEETD-SKDRFNHKSA-N 1 2 206.289 2.145 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)o1 ZINC000930251579 645535418 /nfs/dbraw/zinc/53/54/18/645535418.db2.gz LNWUFCVVKCHHFP-DCAQKATOSA-N 1 2 238.331 2.235 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)o1 ZINC000930251579 645535424 /nfs/dbraw/zinc/53/54/24/645535424.db2.gz LNWUFCVVKCHHFP-DCAQKATOSA-N 1 2 238.331 2.235 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@H](C)O[C@H](C)[C@H]2C)o1 ZINC000930251581 645535499 /nfs/dbraw/zinc/53/54/99/645535499.db2.gz LNWUFCVVKCHHFP-HBNTYKKESA-N 1 2 238.331 2.235 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@H](C)O[C@H](C)[C@H]2C)o1 ZINC000930251581 645535506 /nfs/dbraw/zinc/53/55/06/645535506.db2.gz LNWUFCVVKCHHFP-HBNTYKKESA-N 1 2 238.331 2.235 20 0 BEADLO Cc1ccc(C)c(NC(=O)Cc2[nH]cc[nH+]2)c1 ZINC000857428780 645554870 /nfs/dbraw/zinc/55/48/70/645554870.db2.gz FIWOZZHNBIPMLO-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO CC[C@H](CC(=O)NCc1ccc(N)[nH+]c1)C(C)C ZINC000927781035 645658547 /nfs/dbraw/zinc/65/85/47/645658547.db2.gz SKCNKDSVMUMBRO-GFCCVEGCSA-N 1 2 249.358 2.352 20 0 BEADLO C[C@H](c1nc(C2CCCC2)no1)[NH+](C)C ZINC000923806041 645956880 /nfs/dbraw/zinc/95/68/80/645956880.db2.gz LJDNHAGKJYGPCY-MRVPVSSYSA-N 1 2 209.293 2.350 20 0 BEADLO CCC(CC)(OC)c1noc([C@@H](C)[NH+](C)C)n1 ZINC000924078141 645975016 /nfs/dbraw/zinc/97/50/16/645975016.db2.gz FVUUGFCHSILQTJ-SECBINFHSA-N 1 2 241.335 2.354 20 0 BEADLO c1[nH]cc([C@@H]2C[C@H]2c2nc([C@H]3CC34CC4)no2)[nH+]1 ZINC000924105308 645980233 /nfs/dbraw/zinc/98/02/33/645980233.db2.gz YHGGJYHNLPTFHF-IWSPIJDZSA-N 1 2 242.282 2.331 20 0 BEADLO Cc1cn(C)nc1C[N@H+](C)Cc1cccs1 ZINC000929207245 646003819 /nfs/dbraw/zinc/00/38/19/646003819.db2.gz JALFLZAVPBXIHQ-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1cn(C)nc1C[N@@H+](C)Cc1cccs1 ZINC000929207245 646003827 /nfs/dbraw/zinc/00/38/27/646003827.db2.gz JALFLZAVPBXIHQ-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO CC1(C(=O)OCc2ccc[nH+]c2N)CC=CC1 ZINC000924205539 646007097 /nfs/dbraw/zinc/00/70/97/646007097.db2.gz VWZXCKDFOAURBP-UHFFFAOYSA-N 1 2 232.283 2.063 20 0 BEADLO CC[N@@H+](Cc1nnc(OC)s1)CC(C)C ZINC000929259089 646043909 /nfs/dbraw/zinc/04/39/09/646043909.db2.gz PYZRXSANAXBAAI-UHFFFAOYSA-N 1 2 229.349 2.025 20 0 BEADLO CC[N@H+](Cc1nnc(OC)s1)CC(C)C ZINC000929259089 646043918 /nfs/dbraw/zinc/04/39/18/646043918.db2.gz PYZRXSANAXBAAI-UHFFFAOYSA-N 1 2 229.349 2.025 20 0 BEADLO Cc1ccc(F)c(C[N@H+](CCO)C2CC2)c1F ZINC000929265883 646045456 /nfs/dbraw/zinc/04/54/56/646045456.db2.gz CUQPXNBDBAMKGK-UHFFFAOYSA-N 1 2 241.281 2.230 20 0 BEADLO Cc1ccc(F)c(C[N@@H+](CCO)C2CC2)c1F ZINC000929265883 646045458 /nfs/dbraw/zinc/04/54/58/646045458.db2.gz CUQPXNBDBAMKGK-UHFFFAOYSA-N 1 2 241.281 2.230 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@@H](C)OC[C@H]2CC)o1 ZINC000929268171 646047475 /nfs/dbraw/zinc/04/74/75/646047475.db2.gz GUQFUVSHVXFEOJ-GHMZBOCLSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@@H](C)OC[C@H]2CC)o1 ZINC000929268171 646047481 /nfs/dbraw/zinc/04/74/81/646047481.db2.gz GUQFUVSHVXFEOJ-GHMZBOCLSA-N 1 2 238.331 2.236 20 0 BEADLO COc1ccc(C[NH2+][C@H](C)c2nonc2C)cc1 ZINC000924530572 646050888 /nfs/dbraw/zinc/05/08/88/646050888.db2.gz CUZWAPYOBOYMKM-SECBINFHSA-N 1 2 247.298 2.237 20 0 BEADLO C[N@@H+](Cc1c(F)cncc1F)CC1CC1 ZINC000929290067 646065543 /nfs/dbraw/zinc/06/55/43/646065543.db2.gz LDXOAVVJVBCGGI-UHFFFAOYSA-N 1 2 212.243 2.202 20 0 BEADLO C[N@H+](Cc1c(F)cncc1F)CC1CC1 ZINC000929290067 646065547 /nfs/dbraw/zinc/06/55/47/646065547.db2.gz LDXOAVVJVBCGGI-UHFFFAOYSA-N 1 2 212.243 2.202 20 0 BEADLO Cc1csc(C[NH2+][C@H](C)c2ccnnc2)n1 ZINC000924617101 646078616 /nfs/dbraw/zinc/07/86/16/646078616.db2.gz XNFIYJVBKUOUMZ-SECBINFHSA-N 1 2 234.328 2.092 20 0 BEADLO Cc1nonc1[C@@H](C)[NH2+]Cc1ccsc1 ZINC000924666184 646088166 /nfs/dbraw/zinc/08/81/66/646088166.db2.gz TYYKZRQSVDTABX-SSDOTTSWSA-N 1 2 223.301 2.290 20 0 BEADLO Cc1cc(C)nc(C[N@@H+]2CCOCC2(C)C)c1 ZINC000929348163 646089933 /nfs/dbraw/zinc/08/99/33/646089933.db2.gz URTYRPYBTXSCDW-UHFFFAOYSA-N 1 2 234.343 2.309 20 0 BEADLO Cc1cc(C)nc(C[N@H+]2CCOCC2(C)C)c1 ZINC000929348163 646089939 /nfs/dbraw/zinc/08/99/39/646089939.db2.gz URTYRPYBTXSCDW-UHFFFAOYSA-N 1 2 234.343 2.309 20 0 BEADLO COCCC[N@H+](C)Cc1nc(C(C)C)ns1 ZINC000929354060 646092414 /nfs/dbraw/zinc/09/24/14/646092414.db2.gz ZCYHYINROMSWEY-UHFFFAOYSA-N 1 2 243.376 2.130 20 0 BEADLO COCCC[N@@H+](C)Cc1nc(C(C)C)ns1 ZINC000929354060 646092418 /nfs/dbraw/zinc/09/24/18/646092418.db2.gz ZCYHYINROMSWEY-UHFFFAOYSA-N 1 2 243.376 2.130 20 0 BEADLO COc1cc([C@@H](C)[NH2+]Cc2ccoc2)on1 ZINC000924751384 646101233 /nfs/dbraw/zinc/10/12/33/646101233.db2.gz WSMQCUZZTYUNGP-MRVPVSSYSA-N 1 2 222.244 2.127 20 0 BEADLO CCC[N@H+](CC(F)F)C[C@@H]1C[C@H]1C(=O)OCC ZINC000929466095 646128669 /nfs/dbraw/zinc/12/86/69/646128669.db2.gz ICKWWUBSTWDJDT-VHSXEESVSA-N 1 2 249.301 2.163 20 0 BEADLO CCC[N@@H+](CC(F)F)C[C@@H]1C[C@H]1C(=O)OCC ZINC000929466095 646128671 /nfs/dbraw/zinc/12/86/71/646128671.db2.gz ICKWWUBSTWDJDT-VHSXEESVSA-N 1 2 249.301 2.163 20 0 BEADLO COCC[N@H+](CC(F)F)CC1CC(C)C1 ZINC000929515407 646164981 /nfs/dbraw/zinc/16/49/81/646164981.db2.gz HZQWEIGBOGUNNP-UHFFFAOYSA-N 1 2 221.291 2.246 20 0 BEADLO COCC[N@@H+](CC(F)F)CC1CC(C)C1 ZINC000929515407 646164984 /nfs/dbraw/zinc/16/49/84/646164984.db2.gz HZQWEIGBOGUNNP-UHFFFAOYSA-N 1 2 221.291 2.246 20 0 BEADLO Cc1cc(C)[nH+]c(CN(C)CC(F)F)c1 ZINC000929517114 646165243 /nfs/dbraw/zinc/16/52/43/646165243.db2.gz XHPGQVVSGAHRBD-UHFFFAOYSA-N 1 2 214.259 2.395 20 0 BEADLO CC[C@@H](C)C[N@@H+](C)Cc1nnc(OC)s1 ZINC000929618248 646200564 /nfs/dbraw/zinc/20/05/64/646200564.db2.gz GBTRIAZGFTUREE-MRVPVSSYSA-N 1 2 229.349 2.025 20 0 BEADLO COC(=O)/C=C(/C)C[NH+]1Cc2ccccc2C1 ZINC000929584399 646186048 /nfs/dbraw/zinc/18/60/48/646186048.db2.gz SCEFXYBGZPKYFM-XFFZJAGNSA-N 1 2 231.295 2.122 20 0 BEADLO CC[C@@H](C)C[N@H+](C)Cc1nnc(OC)s1 ZINC000929618248 646200561 /nfs/dbraw/zinc/20/05/61/646200561.db2.gz GBTRIAZGFTUREE-MRVPVSSYSA-N 1 2 229.349 2.025 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1cc(C)cc(C)n1 ZINC000929659953 646228911 /nfs/dbraw/zinc/22/89/11/646228911.db2.gz NFFUWAGNXXYQFG-AWEZNQCLSA-N 1 2 234.343 2.309 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1cc(C)cc(C)n1 ZINC000929659953 646228918 /nfs/dbraw/zinc/22/89/18/646228918.db2.gz NFFUWAGNXXYQFG-AWEZNQCLSA-N 1 2 234.343 2.309 20 0 BEADLO C[C@@H](C1CC1)N(C)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000929706701 646261051 /nfs/dbraw/zinc/26/10/51/646261051.db2.gz RTDIGTVGWKHQPD-VIFPVBQESA-N 1 2 243.310 2.433 20 0 BEADLO COC(C)(C)C[N@H+](C)Cc1c(F)cncc1F ZINC000929829444 646346446 /nfs/dbraw/zinc/34/64/46/646346446.db2.gz SPLLGACLTNJPHG-UHFFFAOYSA-N 1 2 244.285 2.217 20 0 BEADLO COC(C)(C)C[N@@H+](C)Cc1c(F)cncc1F ZINC000929829444 646346454 /nfs/dbraw/zinc/34/64/54/646346454.db2.gz SPLLGACLTNJPHG-UHFFFAOYSA-N 1 2 244.285 2.217 20 0 BEADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@@H](C)c1cn[nH]c1 ZINC000925633240 646378531 /nfs/dbraw/zinc/37/85/31/646378531.db2.gz COJTVKCGNCIJLP-KWQFWETISA-N 1 2 246.314 2.434 20 0 BEADLO Cc1cc(C)nc(C[N@H+](C)Cc2cn[nH]c2)c1 ZINC000930015151 646394814 /nfs/dbraw/zinc/39/48/14/646394814.db2.gz XXLUZWMZSRPQSM-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1cc(C)nc(C[N@@H+](C)Cc2cn[nH]c2)c1 ZINC000930015151 646394818 /nfs/dbraw/zinc/39/48/18/646394818.db2.gz XXLUZWMZSRPQSM-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO CC[N@H+](Cc1nn(C)cc1C)Cc1ccncc1 ZINC000930152985 646462489 /nfs/dbraw/zinc/46/24/89/646462489.db2.gz NAADRROKIYIODR-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CC[N@@H+](Cc1nn(C)cc1C)Cc1ccncc1 ZINC000930152985 646462497 /nfs/dbraw/zinc/46/24/97/646462497.db2.gz NAADRROKIYIODR-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CC[C@H](CSC)[N@H+](C)Cc1nncs1 ZINC000930178784 646480610 /nfs/dbraw/zinc/48/06/10/646480610.db2.gz ATDLKMQCNCWDSR-MRVPVSSYSA-N 1 2 231.390 2.112 20 0 BEADLO CC[C@H](CSC)[N@@H+](C)Cc1nncs1 ZINC000930178784 646480616 /nfs/dbraw/zinc/48/06/16/646480616.db2.gz ATDLKMQCNCWDSR-MRVPVSSYSA-N 1 2 231.390 2.112 20 0 BEADLO COc1nnc(C[NH2+][C@H](C)c2ccccc2)s1 ZINC000930182489 646482454 /nfs/dbraw/zinc/48/24/54/646482454.db2.gz NEHJZYSVTGFKRU-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO C[C@H]([NH2+]C1(C(F)F)CC1)c1cc[nH]c(=O)c1 ZINC000926367698 646626626 /nfs/dbraw/zinc/62/66/26/646626626.db2.gz NIOCUDBSHIZQLY-ZETCQYMHSA-N 1 2 228.242 2.236 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1cnn(C)n1)c1ccsc1 ZINC000926368927 646628563 /nfs/dbraw/zinc/62/85/63/646628563.db2.gz GRBBGOASFCBIAG-IUCAKERBSA-N 1 2 236.344 2.288 20 0 BEADLO Cc1ccc(F)cc1NC(=O)C[C@@H]([NH3+])C(F)F ZINC000724738193 711609835 /nfs/dbraw/zinc/60/98/35/711609835.db2.gz FAVMXXKQFYSGAN-MRVPVSSYSA-N 1 2 246.232 2.055 20 0 BEADLO [NH3+][C@H](CC(=O)NC1CCCCCCC1)C(F)F ZINC000724759524 711610513 /nfs/dbraw/zinc/61/05/13/711610513.db2.gz QKTOYNWRFSQDBK-SNVBAGLBSA-N 1 2 248.317 2.198 20 0 BEADLO CCCCOC(=O)C[NH2+]C1(CC(C)C)CC1 ZINC000701487809 712024107 /nfs/dbraw/zinc/02/41/07/712024107.db2.gz KBBFLJAXXDWSMC-UHFFFAOYSA-N 1 2 227.348 2.498 20 0 BEADLO CC[NH2+]Cc1noc(C23CCC(CC2)C3)n1 ZINC000711044258 712276844 /nfs/dbraw/zinc/27/68/44/712276844.db2.gz OKOQTRNZHQMWNL-UHFFFAOYSA-N 1 2 221.304 2.011 20 0 BEADLO Cc1[nH]ncc1C[NH2+]C[C@H]1CCC(C)(C)CO1 ZINC000711393093 712297312 /nfs/dbraw/zinc/29/73/12/712297312.db2.gz VRAAFRMMCPGKRW-GFCCVEGCSA-N 1 2 237.347 2.013 20 0 BEADLO CO[C@@H]1CC[N@H+](C/C(Cl)=C\Cl)C1 ZINC000379332691 712374299 /nfs/dbraw/zinc/37/42/99/712374299.db2.gz HWAMSSAVXIJASJ-RXLGXGPVSA-N 1 2 210.104 2.026 20 0 BEADLO CO[C@@H]1CC[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000379332691 712374301 /nfs/dbraw/zinc/37/43/01/712374301.db2.gz HWAMSSAVXIJASJ-RXLGXGPVSA-N 1 2 210.104 2.026 20 0 BEADLO CC(C)[N@H+](C)Cc1cn(C)nc1Br ZINC000713818190 712472807 /nfs/dbraw/zinc/47/28/07/712472807.db2.gz SUMMTIWZRPNMCR-UHFFFAOYSA-N 1 2 246.152 2.023 20 0 BEADLO CC(C)[N@@H+](C)Cc1cn(C)nc1Br ZINC000713818190 712472808 /nfs/dbraw/zinc/47/28/08/712472808.db2.gz SUMMTIWZRPNMCR-UHFFFAOYSA-N 1 2 246.152 2.023 20 0 BEADLO CC1(C)CCC[C@@H](C[N@H+]2CCCC[C@H]2C[NH3+])O1 ZINC000714332677 712482144 /nfs/dbraw/zinc/48/21/44/712482144.db2.gz XOONDTDWMVOKRK-STQMWFEESA-N 1 2 240.391 2.147 20 0 BEADLO CC[NH2+]Cc1noc([C@H]2CCCC[C@@H]2C)n1 ZINC000714453087 712490350 /nfs/dbraw/zinc/49/03/50/712490350.db2.gz YJTQPUBRYYKZRX-UWVGGRQHSA-N 1 2 223.320 2.473 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ccns2)on1 ZINC000715997557 712551908 /nfs/dbraw/zinc/55/19/08/712551908.db2.gz ZIXCRDOPVUIBDM-QMMMGPOBSA-N 1 2 223.301 2.290 20 0 BEADLO Cc1conc1C[NH2+][C@H](C)c1cccnc1 ZINC000720406215 712839964 /nfs/dbraw/zinc/83/99/64/712839964.db2.gz GECBNGVEZBHRRW-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO CNc1cc(N[C@@H]2CCC(F)(F)C2)[nH+]cn1 ZINC000381129479 710603138 /nfs/dbraw/zinc/60/31/38/710603138.db2.gz KGMSVHXOYNSKJS-SSDOTTSWSA-N 1 2 228.246 2.118 20 0 BEADLO CCCC[C@@H]([NH2+][C@H]1CC12CCC2)C(=O)OC ZINC000721223263 712899649 /nfs/dbraw/zinc/89/96/49/712899649.db2.gz UNYOMQUTYQPOHT-MNOVXSKESA-N 1 2 225.332 2.250 20 0 BEADLO Cc1nc(NC[C@@H]2CC[C@@H](C3CC3)O2)cc[nH+]1 ZINC000722307561 710706827 /nfs/dbraw/zinc/70/68/27/710706827.db2.gz CHYIDJAZZRQEKV-RYUDHWBXSA-N 1 2 233.315 2.155 20 0 BEADLO CNc1cc(N(C)[C@@H](C)C2(C)CC2)nc[nH+]1 ZINC000385559577 711014222 /nfs/dbraw/zinc/01/42/22/711014222.db2.gz PEVBOOWGQAYLDQ-VIFPVBQESA-N 1 2 220.320 2.143 20 0 BEADLO CNc1cc(N(C)[C@@H](C)C2(C)CC2)[nH+]cn1 ZINC000385559577 711014223 /nfs/dbraw/zinc/01/42/23/711014223.db2.gz PEVBOOWGQAYLDQ-VIFPVBQESA-N 1 2 220.320 2.143 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+][C@@H](C)CSC(C)(C)C ZINC000390425754 711116180 /nfs/dbraw/zinc/11/61/80/711116180.db2.gz MHAVXLGRTGFNJO-VHSXEESVSA-N 1 2 247.404 2.448 20 0 BEADLO CCCCSCc1nc(C[NH2+]CC)no1 ZINC000390755743 711131960 /nfs/dbraw/zinc/13/19/60/711131960.db2.gz HKUKJVVPMXXKIO-UHFFFAOYSA-N 1 2 229.349 2.212 20 0 BEADLO CC[NH2+]Cc1noc([C@H]2CC[C@H](C)C2)n1 ZINC000390781470 711134609 /nfs/dbraw/zinc/13/46/09/711134609.db2.gz KFZJVTIPXIAWMO-IUCAKERBSA-N 1 2 209.293 2.083 20 0 BEADLO CCc1nnc(C[NH2+]Cc2cncc(C)c2)s1 ZINC000391933322 711140966 /nfs/dbraw/zinc/14/09/66/711140966.db2.gz UZDWGVVTSYGOHH-UHFFFAOYSA-N 1 2 248.355 2.094 20 0 BEADLO Cc1nccnc1[C@H](C)Nc1cccc[nH+]1 ZINC000393753871 711172581 /nfs/dbraw/zinc/17/25/81/711172581.db2.gz GJVBCGUMFLBMFA-JTQLQIEISA-N 1 2 214.272 2.353 20 0 BEADLO CCOC(=O)C[N@H+](C)CCSC(C)(C)C ZINC000393765903 711173927 /nfs/dbraw/zinc/17/39/27/711173927.db2.gz SRHXEYWTZUSPBS-UHFFFAOYSA-N 1 2 233.377 2.013 20 0 BEADLO CCOC(=O)C[N@@H+](C)CCSC(C)(C)C ZINC000393765903 711173929 /nfs/dbraw/zinc/17/39/29/711173929.db2.gz SRHXEYWTZUSPBS-UHFFFAOYSA-N 1 2 233.377 2.013 20 0 BEADLO CNc1cc(N(C)C2CC(C)(C)C2)nc[nH+]1 ZINC000395372980 711208961 /nfs/dbraw/zinc/20/89/61/711208961.db2.gz LZKJURWWRPNHIL-UHFFFAOYSA-N 1 2 220.320 2.143 20 0 BEADLO CNc1cc(N(C)C2CC(C)(C)C2)[nH+]cn1 ZINC000395372980 711208966 /nfs/dbraw/zinc/20/89/66/711208966.db2.gz LZKJURWWRPNHIL-UHFFFAOYSA-N 1 2 220.320 2.143 20 0 BEADLO C[C@H]([NH2+]Cc1cocn1)c1ccc2c(c1)CCO2 ZINC000397939304 711397073 /nfs/dbraw/zinc/39/70/73/711397073.db2.gz TVMPJZFUEGFVBB-JTQLQIEISA-N 1 2 244.294 2.460 20 0 BEADLO Fc1cccc2c1CC[C@H]2[NH2+]Cc1csnn1 ZINC000398486506 711411022 /nfs/dbraw/zinc/41/10/22/711411022.db2.gz UMSQDQXEZIMHEB-GFCCVEGCSA-N 1 2 249.314 2.454 20 0 BEADLO c1cc(C[NH2+]Cc2scnc2C2CC2)no1 ZINC000381181095 710606524 /nfs/dbraw/zinc/60/65/24/710606524.db2.gz WJXTYGSYEQYLHQ-UHFFFAOYSA-N 1 2 235.312 2.298 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1CCC=CO1 ZINC000381410174 710634391 /nfs/dbraw/zinc/63/43/91/710634391.db2.gz UGWRJGAFNCCJCP-JTQLQIEISA-N 1 2 220.272 2.195 20 0 BEADLO OCC[N@H+](Cc1scnc1Cl)C1CCC1 ZINC000721929610 710692198 /nfs/dbraw/zinc/69/21/98/710692198.db2.gz OVIVEAFOUQNYNT-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO OCC[N@@H+](Cc1scnc1Cl)C1CCC1 ZINC000721929610 710692200 /nfs/dbraw/zinc/69/22/00/710692200.db2.gz OVIVEAFOUQNYNT-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO [NH3+][C@@H](CC(=O)NCCC1CCCCC1)C(F)F ZINC000724757470 710745688 /nfs/dbraw/zinc/74/56/88/710745688.db2.gz DEVGIXHTGWOFIG-JTQLQIEISA-N 1 2 248.317 2.056 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2cc(C)ccc2F)[nH]1 ZINC000392442110 711147066 /nfs/dbraw/zinc/14/70/66/711147066.db2.gz BFJTZIRYJODRGG-VIFPVBQESA-N 1 2 248.305 2.411 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccc(F)cc2)[nH]1 ZINC000392474210 711147894 /nfs/dbraw/zinc/14/78/94/711147894.db2.gz VMJQVSITEGJTCQ-MRVPVSSYSA-N 1 2 234.278 2.103 20 0 BEADLO Cc1cc(C)c(CNC(=O)N2CCCCC2)c[nH+]1 ZINC000397020310 711374104 /nfs/dbraw/zinc/37/41/04/711374104.db2.gz HBMUEDGVLBVBKY-UHFFFAOYSA-N 1 2 247.342 2.394 20 0 BEADLO Cc1cc(C#N)ccc1NCCc1cn(C)c[nH+]1 ZINC000397693800 711389665 /nfs/dbraw/zinc/38/96/65/711389665.db2.gz YECMCRCSKUJOOI-UHFFFAOYSA-N 1 2 240.310 2.255 20 0 BEADLO Cc1nocc1CNc1cc(C)[nH+]c(C(C)C)n1 ZINC000397883263 711395720 /nfs/dbraw/zinc/39/57/20/711395720.db2.gz NZALFRUDDROOEA-UHFFFAOYSA-N 1 2 246.314 2.239 20 0 BEADLO C[C@@H]([NH2+]Cc1cocn1)c1ccc2c(c1)CCO2 ZINC000397939306 711396430 /nfs/dbraw/zinc/39/64/30/711396430.db2.gz TVMPJZFUEGFVBB-SNVBAGLBSA-N 1 2 244.294 2.460 20 0 BEADLO CC[C@@H](Nc1cc[nH+]c(C)n1)[C@H]1CCCOC1 ZINC000723865711 711540559 /nfs/dbraw/zinc/54/05/59/711540559.db2.gz VOPNBYFKFUJJRD-NWDGAFQWSA-N 1 2 235.331 2.402 20 0 BEADLO Cc1cc(N[C@H](C)C[C@H]2CCC(=O)N2)c[nH+]c1C ZINC000926854663 711689304 /nfs/dbraw/zinc/68/93/04/711689304.db2.gz FJKRXFKZLAIWFR-ZYHUDNBSSA-N 1 2 247.342 2.168 20 0 BEADLO C[C@@H]([NH2+]C1(c2ccccc2)CC1)c1cnn(C)n1 ZINC000925827011 711758988 /nfs/dbraw/zinc/75/89/88/711758988.db2.gz RHAKDPAMNPNUCS-LLVKDONJSA-N 1 2 242.326 2.155 20 0 BEADLO Cc1cc(F)ncc1C[N@@H+]1CCC[C@H](F)C1 ZINC000895191324 711779870 /nfs/dbraw/zinc/77/98/70/711779870.db2.gz NTRXQTCVXGIWHJ-NSHDSACASA-N 1 2 226.270 2.463 20 0 BEADLO Cc1cc(F)ncc1C[N@H+]1CCC[C@H](F)C1 ZINC000895191324 711779872 /nfs/dbraw/zinc/77/98/72/711779872.db2.gz NTRXQTCVXGIWHJ-NSHDSACASA-N 1 2 226.270 2.463 20 0 BEADLO CC[C@](C)(C[NH2+]C(C)(C)C(=O)OC(C)C)OC ZINC000898507113 711801702 /nfs/dbraw/zinc/80/17/02/711801702.db2.gz PELZVTJHFRRSLN-CYBMUJFWSA-N 1 2 245.363 2.121 20 0 BEADLO CCC(=O)NC1C[NH+](Cc2ccc(C)c(C)c2)C1 ZINC001030039157 711825933 /nfs/dbraw/zinc/82/59/33/711825933.db2.gz ASPWLDNPFHVJJF-UHFFFAOYSA-N 1 2 246.354 2.014 20 0 BEADLO C[C@H](C(=O)OCc1ccc(N)[nH+]c1)C1CCC1 ZINC000922793464 711976889 /nfs/dbraw/zinc/97/68/89/711976889.db2.gz LKZCPIDFRUTEMH-VIFPVBQESA-N 1 2 234.299 2.143 20 0 BEADLO COC(=O)[C@H]([NH2+]CC(C)(C)C(C)(F)F)C1CC1 ZINC000700363572 711990746 /nfs/dbraw/zinc/99/07/46/711990746.db2.gz LIXAAUWBCASTAO-SECBINFHSA-N 1 2 249.301 2.209 20 0 BEADLO Oc1ccc(C[N@H+]2CCC[C@@H](F)C2)cc1F ZINC000701674768 712027265 /nfs/dbraw/zinc/02/72/65/712027265.db2.gz RPZNJCGNLYNVDT-SNVBAGLBSA-N 1 2 227.254 2.465 20 0 BEADLO Cc1cc(C[NH2+]Cc2cccc3c2OCC3)no1 ZINC000703210347 712068517 /nfs/dbraw/zinc/06/85/17/712068517.db2.gz YDNKFCPSWCNXOO-UHFFFAOYSA-N 1 2 244.294 2.208 20 0 BEADLO CCCNc1cc(N2CC=C(C)CC2)nc[nH+]1 ZINC000706437698 712146674 /nfs/dbraw/zinc/14/66/74/712146674.db2.gz MLBCTDJDAAIIQF-UHFFFAOYSA-N 1 2 232.331 2.455 20 0 BEADLO CCCNc1cc(N2CC=C(C)CC2)[nH+]cn1 ZINC000706437698 712146676 /nfs/dbraw/zinc/14/66/76/712146676.db2.gz MLBCTDJDAAIIQF-UHFFFAOYSA-N 1 2 232.331 2.455 20 0 BEADLO COC(C)(C)[C@H](C)[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000707230264 712166743 /nfs/dbraw/zinc/16/67/43/712166743.db2.gz ORMZQVLWDLBQNH-ZJUUUORDSA-N 1 2 245.363 2.120 20 0 BEADLO COC[C@@H]([NH2+]Cc1nocc1C)c1ccccc1 ZINC000708334659 712188459 /nfs/dbraw/zinc/18/84/59/712188459.db2.gz KMFFQQWMNAQQKZ-CQSZACIVSA-N 1 2 246.310 2.460 20 0 BEADLO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2ncc[nH]2)C1 ZINC000708621472 712195739 /nfs/dbraw/zinc/19/57/39/712195739.db2.gz ZVVBOEGTMZCDKB-SECBINFHSA-N 1 2 233.237 2.184 20 0 BEADLO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ncc[nH]2)C1 ZINC000708621472 712195740 /nfs/dbraw/zinc/19/57/40/712195740.db2.gz ZVVBOEGTMZCDKB-SECBINFHSA-N 1 2 233.237 2.184 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2cn(C)cn2)o1 ZINC000710006575 712239270 /nfs/dbraw/zinc/23/92/70/712239270.db2.gz MWURBXPIZAPDPQ-SNVBAGLBSA-N 1 2 219.288 2.172 20 0 BEADLO C[C@@H]1COC[C@H]1Nc1ccc([NH+](C)C)cc1 ZINC000710887610 712261361 /nfs/dbraw/zinc/26/13/61/712261361.db2.gz DFHOWDSTJUENCU-ZWNOBZJWSA-N 1 2 220.316 2.199 20 0 BEADLO CC(C)(C)[C@@H]1C[C@H]1C(=O)OCc1ccc(N)[nH+]c1 ZINC000922907247 712285309 /nfs/dbraw/zinc/28/53/09/712285309.db2.gz DBOJEMVMHGJLRM-GHMZBOCLSA-N 1 2 248.326 2.389 20 0 BEADLO CNc1cc(NC[C@H]2CCC3(CCC3)O2)[nH+]cn1 ZINC000711414422 712298547 /nfs/dbraw/zinc/29/85/47/712298547.db2.gz LGALLOWYEAQBHW-SNVBAGLBSA-N 1 2 248.330 2.032 20 0 BEADLO CCCNc1cc(N2CC[C@@H](CF)C2)nc[nH+]1 ZINC000711435332 712299868 /nfs/dbraw/zinc/29/98/68/712299868.db2.gz OACACPXYHZFADQ-JTQLQIEISA-N 1 2 238.310 2.094 20 0 BEADLO CCCNc1cc(N2CC[C@@H](CF)C2)[nH+]cn1 ZINC000711435332 712299870 /nfs/dbraw/zinc/29/98/70/712299870.db2.gz OACACPXYHZFADQ-JTQLQIEISA-N 1 2 238.310 2.094 20 0 BEADLO Cc1ccc(C[NH2+]Cc2nccn2C2CC2)o1 ZINC000711736096 712320940 /nfs/dbraw/zinc/32/09/40/712320940.db2.gz BFDKLRJOVIIUSB-UHFFFAOYSA-N 1 2 231.299 2.409 20 0 BEADLO C[C@@H]([NH2+]Cc1nccn1C1CC1)c1ccccn1 ZINC000711726129 712322038 /nfs/dbraw/zinc/32/20/38/712322038.db2.gz OOCVQZXHLZVBFD-LLVKDONJSA-N 1 2 242.326 2.464 20 0 BEADLO C[C@@H]1CCC(C)(C)C[C@H]1[NH2+]Cc1c[nH]nn1 ZINC000713096961 712452444 /nfs/dbraw/zinc/45/24/44/712452444.db2.gz PBPLFYCSSBBQPK-MWLCHTKSSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@@H]1CCC(C)(C)C[C@H]1[NH2+]Cc1cn[nH]n1 ZINC000713096961 712452445 /nfs/dbraw/zinc/45/24/45/712452445.db2.gz PBPLFYCSSBBQPK-MWLCHTKSSA-N 1 2 222.336 2.109 20 0 BEADLO C=C/C=C/CC[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000713661799 712468923 /nfs/dbraw/zinc/46/89/23/712468923.db2.gz RTNYDLMQTQGBGO-AEZGRPFRSA-N 1 2 225.332 2.439 20 0 BEADLO FC1(F)[C@H]2C[N@H+](Cc3cccc(Cl)n3)C[C@H]21 ZINC000715416364 712518374 /nfs/dbraw/zinc/51/83/74/712518374.db2.gz OZQMCDZVOXNVFL-DTORHVGOSA-N 1 2 244.672 2.432 20 0 BEADLO FC1(F)[C@H]2C[N@@H+](Cc3cccc(Cl)n3)C[C@H]21 ZINC000715416364 712518375 /nfs/dbraw/zinc/51/83/75/712518375.db2.gz OZQMCDZVOXNVFL-DTORHVGOSA-N 1 2 244.672 2.432 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ccccc1F)c1cn(C)nn1 ZINC000715876945 712538715 /nfs/dbraw/zinc/53/87/15/712538715.db2.gz JBDHLPCDLXFNRR-UWVGGRQHSA-N 1 2 248.305 2.366 20 0 BEADLO Cc1n[nH]c(C[NH2+][C@@H]2C[C@H](C)n3ccnc32)c1C ZINC000716465293 712562918 /nfs/dbraw/zinc/56/29/18/712562918.db2.gz LDNKAABLYZGDQV-GZMMTYOYSA-N 1 2 245.330 2.019 20 0 BEADLO O=C1O[C@H](Cn2cc[nH+]c2)CN1C1CCCCC1 ZINC000828021726 712593816 /nfs/dbraw/zinc/59/38/16/712593816.db2.gz ZTIGFYRCSXVWCO-GFCCVEGCSA-N 1 2 249.314 2.037 20 0 BEADLO CCn1cc(C[N@H+](C)[C@H](C)c2ccccc2)nn1 ZINC000883995783 712643219 /nfs/dbraw/zinc/64/32/19/712643219.db2.gz DGTWNMBCTQAIKF-GFCCVEGCSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1cc(C[N@@H+](C)[C@H](C)c2ccccc2)nn1 ZINC000883995783 712643220 /nfs/dbraw/zinc/64/32/20/712643220.db2.gz DGTWNMBCTQAIKF-GFCCVEGCSA-N 1 2 244.342 2.491 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@H](C)CCc1ccco1 ZINC000042322100 712720406 /nfs/dbraw/zinc/72/04/06/712720406.db2.gz NUINMPQUYGZFCI-MNOVXSKESA-N 1 2 239.315 2.142 20 0 BEADLO COc1cc[nH+]cc1NCc1ccoc1 ZINC000380313746 712873656 /nfs/dbraw/zinc/87/36/56/712873656.db2.gz IBXBDYZXSDASMX-UHFFFAOYSA-N 1 2 204.229 2.295 20 0 BEADLO CCOC1CC2(C[C@H]2Nc2[nH+]cccc2OC)C1 ZINC000721168829 712894200 /nfs/dbraw/zinc/89/42/00/712894200.db2.gz KOYRHUYYHKUXFP-KSGYAGIASA-N 1 2 248.326 2.460 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@@]3(CCO3)C2)cs1 ZINC001206802395 957236307 /nfs/dbraw/zinc/23/63/07/957236307.db2.gz HGJNUERAHIWSBL-GFCCVEGCSA-N 1 2 238.356 2.206 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@@]3(CCO3)C2)cs1 ZINC001206802395 957236331 /nfs/dbraw/zinc/23/63/31/957236331.db2.gz HGJNUERAHIWSBL-GFCCVEGCSA-N 1 2 238.356 2.206 20 0 BEADLO Cc1[nH+]cc(Nc2cccnc2)cc1N ZINC001210286167 957715705 /nfs/dbraw/zinc/71/57/05/957715705.db2.gz WTNUHECGUROTRO-UHFFFAOYSA-N 1 2 200.245 2.111 20 0 BEADLO CC(C)Oc1cc(NC2CC(=O)C2)cc[nH+]1 ZINC001167341333 957801485 /nfs/dbraw/zinc/80/14/85/957801485.db2.gz SURRKHIHUYCFFR-UHFFFAOYSA-N 1 2 220.272 2.012 20 0 BEADLO Nc1ccc(F)cc1C[NH+]1CC(C(F)F)C1 ZINC000706489122 957920641 /nfs/dbraw/zinc/92/06/41/957920641.db2.gz GQXUVYWETDXVBK-UHFFFAOYSA-N 1 2 230.233 2.105 20 0 BEADLO CSCc1cc[nH+]c(N[C@@H](C)CCO)c1 ZINC000309085949 959596231 /nfs/dbraw/zinc/59/62/31/959596231.db2.gz XOAMXVLZHPQSHA-VIFPVBQESA-N 1 2 226.345 2.127 20 0 BEADLO C[C@@H]1CC[N@@H+]1Cc1ccc(O)c(F)c1F ZINC001140889782 960667101 /nfs/dbraw/zinc/66/71/01/960667101.db2.gz KSNIPLHJLXXULH-SSDOTTSWSA-N 1 2 213.227 2.265 20 0 BEADLO C[C@@H]1CC[N@H+]1Cc1ccc(O)c(F)c1F ZINC001140889782 960667106 /nfs/dbraw/zinc/66/71/06/960667106.db2.gz KSNIPLHJLXXULH-SSDOTTSWSA-N 1 2 213.227 2.265 20 0 BEADLO COc1c[nH+]c(N[C@@H](CO)CC(C)C)c(C)c1 ZINC001154957558 962921930 /nfs/dbraw/zinc/92/19/30/962921930.db2.gz UGJXDZJLJPTWHY-LLVKDONJSA-N 1 2 238.331 2.218 20 0 BEADLO Cc1ccsc1CN1CCC(F)(F)[C@H]([NH3+])C1 ZINC001206658410 963159864 /nfs/dbraw/zinc/15/98/64/963159864.db2.gz XPZJPGBPPWERED-SNVBAGLBSA-N 1 2 246.326 2.225 20 0 BEADLO CSc1cc[nH+]c(NCc2nonc2C)c1 ZINC001156087749 963254477 /nfs/dbraw/zinc/25/44/77/963254477.db2.gz JZFNJQLPZMVNJS-UHFFFAOYSA-N 1 2 236.300 2.107 20 0 BEADLO CCOc1ccc[nH+]c1NCC1(CC)COC1 ZINC001157547614 963656906 /nfs/dbraw/zinc/65/69/06/963656906.db2.gz OKXPDYLQJKRSEM-UHFFFAOYSA-N 1 2 236.315 2.319 20 0 BEADLO CCCc1cc(N(C)CC(F)F)nc(C)[nH+]1 ZINC001158926811 963960114 /nfs/dbraw/zinc/96/01/14/963960114.db2.gz ONQHFKCZIDTNTJ-UHFFFAOYSA-N 1 2 229.274 2.439 20 0 BEADLO C[C@H]1C[C@@H](Nc2ccc(Cl)c(N)[nH+]2)CCO1 ZINC001161695977 964693902 /nfs/dbraw/zinc/69/39/02/964693902.db2.gz JQVCVUJDDZETPP-YUMQZZPRSA-N 1 2 241.722 2.297 20 0 BEADLO c1nnc(C[NH2+][C@@H](c2ccccc2)C2CC2)[nH]1 ZINC000041075750 1165806592 /nfs/dbraw/zinc/80/65/92/1165806592.db2.gz GOMAYVCRXOIBAZ-ZDUSSCGKSA-N 1 2 228.299 2.046 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(=O)[C@@H](F)CC2)oc1C ZINC001204537982 967032515 /nfs/dbraw/zinc/03/25/15/967032515.db2.gz WFRSWLLXLLFHGY-LBPRGKRZSA-N 1 2 239.290 2.399 20 0 BEADLO C[C@H](COc1cccc(F)c1)[NH2+]Cc1ccn[nH]1 ZINC001648897837 1165883793 /nfs/dbraw/zinc/88/37/93/1165883793.db2.gz CLLNICHBGFKENF-SNVBAGLBSA-N 1 2 249.289 2.106 20 0 BEADLO O=C1CCc2cc(CCn3cc[nH+]c3)ccc21 ZINC000148665424 1165904414 /nfs/dbraw/zinc/90/44/14/1165904414.db2.gz DXUYOGBMCIWHJL-UHFFFAOYSA-N 1 2 226.279 2.255 20 0 BEADLO Cc1cccc2[nH+]c(CCCCO)[nH]c21 ZINC000086086839 1165915338 /nfs/dbraw/zinc/91/53/38/1165915338.db2.gz WHSYJJOYRPZMSC-UHFFFAOYSA-N 1 2 204.273 2.186 20 0 BEADLO Cc1cccc2[nH]c(CCCCO)[nH+]c21 ZINC000086086839 1165915342 /nfs/dbraw/zinc/91/53/42/1165915342.db2.gz WHSYJJOYRPZMSC-UHFFFAOYSA-N 1 2 204.273 2.186 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000822576018 968529471 /nfs/dbraw/zinc/52/94/71/968529471.db2.gz YCGMLMRGAAGMIG-IUCAKERBSA-N 1 2 237.347 2.325 20 0 BEADLO C[C@H]1C[C@@H](CF)[N@H+](Cc2ccc(F)cn2)C1 ZINC001207038832 968569779 /nfs/dbraw/zinc/56/97/79/968569779.db2.gz UBFOWVWGBKTWHZ-CABZTGNLSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@H]1C[C@@H](CF)[N@@H+](Cc2ccc(F)cn2)C1 ZINC001207038832 968569784 /nfs/dbraw/zinc/56/97/84/968569784.db2.gz UBFOWVWGBKTWHZ-CABZTGNLSA-N 1 2 226.270 2.401 20 0 BEADLO Cc1cccnc1C[NH2+]Cc1nccs1 ZINC000082493727 1166048013 /nfs/dbraw/zinc/04/80/13/1166048013.db2.gz AMTXZFOEYVLYNT-UHFFFAOYSA-N 1 2 219.313 2.136 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1cnc(C)s1 ZINC000082645070 1166068887 /nfs/dbraw/zinc/06/88/87/1166068887.db2.gz RDLSOQFZUUGULY-LBPRGKRZSA-N 1 2 238.356 2.395 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@H+]1Cc1cnc(C)s1 ZINC000082645070 1166068894 /nfs/dbraw/zinc/06/88/94/1166068894.db2.gz RDLSOQFZUUGULY-LBPRGKRZSA-N 1 2 238.356 2.395 20 0 BEADLO CC1C[NH+](CCc2c(Cl)ncnc2Cl)C1 ZINC001207323917 968723985 /nfs/dbraw/zinc/72/39/85/968723985.db2.gz IZMUERUBQDEWBK-UHFFFAOYSA-N 1 2 246.141 2.278 20 0 BEADLO Clc1cccc(CC[N@@H+]2C[C@@H]3C[C@H]2CO3)c1 ZINC001207423212 968759102 /nfs/dbraw/zinc/75/91/02/968759102.db2.gz XLHDKXCHORXGSY-STQMWFEESA-N 1 2 237.730 2.356 20 0 BEADLO Clc1cccc(CC[N@H+]2C[C@@H]3C[C@H]2CO3)c1 ZINC001207423212 968759110 /nfs/dbraw/zinc/75/91/10/968759110.db2.gz XLHDKXCHORXGSY-STQMWFEESA-N 1 2 237.730 2.356 20 0 BEADLO CS[C@H](C)CC[N@@H+]1CCCC(=O)[C@@H](F)C1 ZINC001208138997 969052106 /nfs/dbraw/zinc/05/21/06/969052106.db2.gz OGSYBEMGBDJTIX-ZJUUUORDSA-N 1 2 233.352 2.131 20 0 BEADLO CS[C@H](C)CC[N@H+]1CCCC(=O)[C@@H](F)C1 ZINC001208138997 969052114 /nfs/dbraw/zinc/05/21/14/969052114.db2.gz OGSYBEMGBDJTIX-ZJUUUORDSA-N 1 2 233.352 2.131 20 0 BEADLO CC/C=C\CC[N@@H+]1CCCC(=O)[C@H](F)C1 ZINC001208726502 969212521 /nfs/dbraw/zinc/21/25/21/969212521.db2.gz XYNZLIBUHSEYIG-DLRQAJBASA-N 1 2 213.296 2.346 20 0 BEADLO CC/C=C\CC[N@H+]1CCCC(=O)[C@H](F)C1 ZINC001208726502 969212527 /nfs/dbraw/zinc/21/25/27/969212527.db2.gz XYNZLIBUHSEYIG-DLRQAJBASA-N 1 2 213.296 2.346 20 0 BEADLO FC[C@@H]1C[C@H](F)C[N@@H+]1C[C@H]1CCC=CO1 ZINC001208877337 969267365 /nfs/dbraw/zinc/26/73/65/969267365.db2.gz QPXVQHUDCIORSK-GARJFASQSA-N 1 2 217.259 2.061 20 0 BEADLO FC[C@@H]1C[C@H](F)C[N@H+]1C[C@H]1CCC=CO1 ZINC001208877337 969267378 /nfs/dbraw/zinc/26/73/78/969267378.db2.gz QPXVQHUDCIORSK-GARJFASQSA-N 1 2 217.259 2.061 20 0 BEADLO CN1CC[C@@H](Nc2ccc(C(C)(C)C)c[nH+]2)C1=O ZINC000230275210 1166333567 /nfs/dbraw/zinc/33/35/67/1166333567.db2.gz PZJSFLAMQKEBHP-LLVKDONJSA-N 1 2 247.342 2.022 20 0 BEADLO COC(C)(C)CC[NH+]1CC(F)(C2CC2)C1 ZINC001209404382 969469968 /nfs/dbraw/zinc/46/99/68/969469968.db2.gz WZSXPQZYOLPKOM-UHFFFAOYSA-N 1 2 215.312 2.235 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC[C@H]2CCC[C@@H]2C1 ZINC001209551851 969538969 /nfs/dbraw/zinc/53/89/69/969538969.db2.gz CETSMPNPCFCORN-VXGBXAGGSA-N 1 2 219.332 2.340 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC[C@H]2CCC[C@@H]2C1 ZINC001209551851 969538973 /nfs/dbraw/zinc/53/89/73/969538973.db2.gz CETSMPNPCFCORN-VXGBXAGGSA-N 1 2 219.332 2.340 20 0 BEADLO Oc1ccc([NH2+][C@H]2CCC[C@@H](O)C2)cc1 ZINC001169250777 969539676 /nfs/dbraw/zinc/53/96/76/969539676.db2.gz KGRMIIHNEFBQBA-CMPLNLGQSA-N 1 2 207.273 2.108 20 0 BEADLO CCOC(=O)[C@@H]1CCC[C@H]([N@@H+](C)CC(F)F)C1 ZINC001255379941 970126362 /nfs/dbraw/zinc/12/63/62/970126362.db2.gz YQIPBHQZZNWDEA-ZJUUUORDSA-N 1 2 249.301 2.305 20 0 BEADLO Cc1cccnc1C[NH2+][C@H]1C[C@H](C)n2ccnc21 ZINC000379004649 1166629733 /nfs/dbraw/zinc/62/97/33/1166629733.db2.gz DLSAVSCBIUGLNQ-RYUDHWBXSA-N 1 2 242.326 2.382 20 0 BEADLO COc1ccc(C[NH2+][C@H]2CCCc3cn[nH]c32)o1 ZINC000893171999 1166633302 /nfs/dbraw/zinc/63/33/02/1166633302.db2.gz BLZIZYAWVKUXKA-NSHDSACASA-N 1 2 247.298 2.179 20 0 BEADLO COc1ccc(C[NH2+][C@H]2CCCc3c[nH]nc32)o1 ZINC000893171999 1166633309 /nfs/dbraw/zinc/63/33/09/1166633309.db2.gz BLZIZYAWVKUXKA-NSHDSACASA-N 1 2 247.298 2.179 20 0 BEADLO Cc1cc([C@@H](C)Nc2cc(N)nc[nH+]2)c(C)o1 ZINC000112750323 1166633499 /nfs/dbraw/zinc/63/34/99/1166633499.db2.gz YGMUDEONTZTTGI-MRVPVSSYSA-N 1 2 232.287 2.442 20 0 BEADLO Cc1ccc(O)c(Nc2ccc(N)[nH+]c2)c1 ZINC000019952187 1166652400 /nfs/dbraw/zinc/65/24/00/1166652400.db2.gz NRDCTNQWWADJSM-UHFFFAOYSA-N 1 2 215.256 2.421 20 0 BEADLO CCOC(=O)C[NH2+][C@H](C)CCCC(C)C ZINC000042304875 1166680730 /nfs/dbraw/zinc/68/07/30/1166680730.db2.gz GCXSIHXXQPTQCW-LLVKDONJSA-N 1 2 215.337 2.354 20 0 BEADLO CC1(F)CN(Cc2cccc(-n3cc[nH+]c3)c2)C1 ZINC001141238904 1166691669 /nfs/dbraw/zinc/69/16/69/1166691669.db2.gz XWFROTLJROBCFR-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1cc(C)c(Nc2cnccn2)c[nH+]1 ZINC001213503697 970335928 /nfs/dbraw/zinc/33/59/28/970335928.db2.gz SUSBKYFFOSMVIX-UHFFFAOYSA-N 1 2 200.245 2.232 20 0 BEADLO CC[N@H+](C)Cc1c(F)cc(C#N)cc1F ZINC000194322823 1166707262 /nfs/dbraw/zinc/70/72/62/1166707262.db2.gz SBFNOGBGRKISMV-UHFFFAOYSA-N 1 2 210.227 2.288 20 0 BEADLO CC[N@@H+](C)Cc1c(F)cc(C#N)cc1F ZINC000194322823 1166707271 /nfs/dbraw/zinc/70/72/71/1166707271.db2.gz SBFNOGBGRKISMV-UHFFFAOYSA-N 1 2 210.227 2.288 20 0 BEADLO COC(=O)C1([NH2+][C@@H](C)CCC(C)C)CC1 ZINC001256350880 970744977 /nfs/dbraw/zinc/74/49/77/970744977.db2.gz FPAWHUAXPIFJBG-JTQLQIEISA-N 1 2 213.321 2.106 20 0 BEADLO Cc1cc(C)c(C[NH2+]Cc2cscn2)cn1 ZINC000397498889 1166997303 /nfs/dbraw/zinc/99/73/03/1166997303.db2.gz PYOFNNXAZYTWGN-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO CCSC[C@H](C)[NH2+][C@@H](C)C(=O)OC(C)C ZINC001173288377 975253676 /nfs/dbraw/zinc/25/36/76/975253676.db2.gz UOYQJOAKTLSCER-UWVGGRQHSA-N 1 2 233.377 2.058 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C/C=C\C1CC1 ZINC000382160958 1167089209 /nfs/dbraw/zinc/08/92/09/1167089209.db2.gz SQQNSKPRSZALHG-TYRPZCRBSA-N 1 2 205.305 2.335 20 0 BEADLO Nc1cc(N2CCC3(C2)CCCCC3)[nH+]cn1 ZINC000383216684 1167118678 /nfs/dbraw/zinc/11/86/78/1167118678.db2.gz YMGSXAGANYSGRH-UHFFFAOYSA-N 1 2 232.331 2.219 20 0 BEADLO COC(C[C@@H](C)Oc1c(C)cc[nH+]c1C)OC ZINC001227262991 975339469 /nfs/dbraw/zinc/33/94/69/975339469.db2.gz AZLKTWHPBFJBAL-SNVBAGLBSA-N 1 2 239.315 2.475 20 0 BEADLO Cc1ccc(CN(C)c2cc(N)nc[nH+]2)s1 ZINC000309248561 1167273881 /nfs/dbraw/zinc/27/38/81/1167273881.db2.gz DBJHJTIWTOMDEE-UHFFFAOYSA-N 1 2 234.328 2.065 20 0 BEADLO COc1cc[nH+]cc1Nc1cncc(F)c1 ZINC001174290143 976458528 /nfs/dbraw/zinc/45/85/28/976458528.db2.gz ZTMVCQPSQCDBRU-UHFFFAOYSA-N 1 2 219.219 2.368 20 0 BEADLO CCOc1ccc(C)c(OC2C[NH+](CC)C2)c1 ZINC001228726084 976460023 /nfs/dbraw/zinc/46/00/23/976460023.db2.gz ZQTSRROURYMRJU-UHFFFAOYSA-N 1 2 235.327 2.477 20 0 BEADLO Cc1nn(C)cc1Nc1[nH+]c(C)ccc1C ZINC001174333636 976548717 /nfs/dbraw/zinc/54/87/17/976548717.db2.gz UWHYJSYLPNFCQM-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO CC[C@@](C)(NC(=O)[C@@H](C)n1cc[nH+]c1)C1CC1 ZINC001334566642 976554900 /nfs/dbraw/zinc/55/49/00/976554900.db2.gz RRRYWIWXEFIDBM-ZWNOBZJWSA-N 1 2 235.331 2.139 20 0 BEADLO CNc1cc(N[C@H]2CCC[C@H](F)C2)[nH+]cn1 ZINC001335533412 977123577 /nfs/dbraw/zinc/12/35/77/977123577.db2.gz KEHQASSBWKWKLX-IUCAKERBSA-N 1 2 224.283 2.211 20 0 BEADLO C[NH+](C)Cc1nc2ccc(Cl)cc2[nH]1 ZINC000041580065 1167527570 /nfs/dbraw/zinc/52/75/70/1167527570.db2.gz YNAJXANTGXUREW-UHFFFAOYSA-N 1 2 209.680 2.278 20 0 BEADLO CC[N@H+](Cc1ccc(F)cc1OC)C1COC1 ZINC001231604585 977646807 /nfs/dbraw/zinc/64/68/07/977646807.db2.gz DHUVLKWLQXZGRU-UHFFFAOYSA-N 1 2 239.290 2.055 20 0 BEADLO CC[N@@H+](Cc1ccc(F)cc1OC)C1COC1 ZINC001231604585 977646818 /nfs/dbraw/zinc/64/68/18/977646818.db2.gz DHUVLKWLQXZGRU-UHFFFAOYSA-N 1 2 239.290 2.055 20 0 BEADLO FC(F)(F)c1cccnc1C[NH+]1CCC1 ZINC001231961399 977815709 /nfs/dbraw/zinc/81/57/09/977815709.db2.gz CIGQXJNUNMJMBH-UHFFFAOYSA-N 1 2 216.206 2.306 20 0 BEADLO CC(C)(C)[NH+]1CC(OCC(=O)c2ccccc2)C1 ZINC001204716467 1167573808 /nfs/dbraw/zinc/57/38/08/1167573808.db2.gz PVSOSWISWAVCNI-UHFFFAOYSA-N 1 2 247.338 2.369 20 0 BEADLO C[NH+](C)Cc1ccnc(Br)c1F ZINC001232028615 977859502 /nfs/dbraw/zinc/85/95/02/977859502.db2.gz KBJIPPVXOFMING-UHFFFAOYSA-N 1 2 233.084 2.045 20 0 BEADLO Fc1cc(Cl)cnc1Nc1[nH]cc[nH+]1 ZINC001176079030 977873700 /nfs/dbraw/zinc/87/37/00/977873700.db2.gz DEGVNXSXDZDVSM-UHFFFAOYSA-N 1 2 212.615 2.341 20 0 BEADLO CC[N@H+](CCOC)Cc1nc(Cl)ccc1F ZINC001232156118 977898857 /nfs/dbraw/zinc/89/88/57/977898857.db2.gz ITNAYRNTEWHUSB-UHFFFAOYSA-N 1 2 246.713 2.342 20 0 BEADLO CC[N@@H+](CCOC)Cc1nc(Cl)ccc1F ZINC001232156118 977898859 /nfs/dbraw/zinc/89/88/59/977898859.db2.gz ITNAYRNTEWHUSB-UHFFFAOYSA-N 1 2 246.713 2.342 20 0 BEADLO Cc1scnc1C[N@@H+](C)[C@@H]1CCCOC1 ZINC001232208034 977938948 /nfs/dbraw/zinc/93/89/48/977938948.db2.gz SNJJAKMODGGQIN-SNVBAGLBSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1scnc1C[N@H+](C)[C@@H]1CCCOC1 ZINC001232208034 977938956 /nfs/dbraw/zinc/93/89/56/977938956.db2.gz SNJJAKMODGGQIN-SNVBAGLBSA-N 1 2 226.345 2.062 20 0 BEADLO FC(F)(F)c1cc(C[NH+]2CC=CC2)ccn1 ZINC001232237976 977970715 /nfs/dbraw/zinc/97/07/15/977970715.db2.gz WQWDRBIIXJQJTG-UHFFFAOYSA-N 1 2 228.217 2.472 20 0 BEADLO Cc1cccc(F)c1C[N@@H+]1CC[C@@H](O)[C@H](F)C1 ZINC001232485643 1167689302 /nfs/dbraw/zinc/68/93/02/1167689302.db2.gz BIXZGJVMOQJZHS-CHWSQXEVSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cccc(F)c1C[N@H+]1CC[C@@H](O)[C@H](F)C1 ZINC001232485643 1167689304 /nfs/dbraw/zinc/68/93/04/1167689304.db2.gz BIXZGJVMOQJZHS-CHWSQXEVSA-N 1 2 241.281 2.039 20 0 BEADLO CO[C@@H](C)CNc1cccc(-n2cc[nH+]c2)c1 ZINC000386220867 1167702351 /nfs/dbraw/zinc/70/23/51/1167702351.db2.gz FNKDLQMFSHXXPL-NSHDSACASA-N 1 2 231.299 2.319 20 0 BEADLO CCC[C@H](C)CC(=O)NCc1c[nH+]c(CC)[nH]1 ZINC001597251201 978301626 /nfs/dbraw/zinc/30/16/26/978301626.db2.gz QVXPCCRSVHKACF-JTQLQIEISA-N 1 2 237.347 2.415 20 0 BEADLO CCC[C@H](C)CC(=O)NCc1c[nH]c(CC)[nH+]1 ZINC001597251201 978301634 /nfs/dbraw/zinc/30/16/34/978301634.db2.gz QVXPCCRSVHKACF-JTQLQIEISA-N 1 2 237.347 2.415 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H](C)[C@@H](F)C2)sn1 ZINC001233309933 978536110 /nfs/dbraw/zinc/53/61/10/978536110.db2.gz IWAYPITYAJMENU-XCBNKYQSSA-N 1 2 214.309 2.241 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H](C)[C@@H](F)C2)sn1 ZINC001233309933 978536115 /nfs/dbraw/zinc/53/61/15/978536115.db2.gz IWAYPITYAJMENU-XCBNKYQSSA-N 1 2 214.309 2.241 20 0 BEADLO Cc1cnsc1C[N@@H+]1CCOCC12CCC2 ZINC001233321459 978559338 /nfs/dbraw/zinc/55/93/38/978559338.db2.gz PMVHMPXQNKPERV-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO Cc1cnsc1C[N@H+]1CCOCC12CCC2 ZINC001233321459 978559346 /nfs/dbraw/zinc/55/93/46/978559346.db2.gz PMVHMPXQNKPERV-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1sncc1C ZINC001233321664 978560014 /nfs/dbraw/zinc/56/00/14/978560014.db2.gz YKYPQDUREXCYFA-SNVBAGLBSA-N 1 2 226.345 2.062 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1sncc1C ZINC001233321664 978560021 /nfs/dbraw/zinc/56/00/21/978560021.db2.gz YKYPQDUREXCYFA-SNVBAGLBSA-N 1 2 226.345 2.062 20 0 BEADLO C[C@@H]1CC[N@@H+]1Cc1c(Cl)nccc1N(C)C ZINC001234105205 978776992 /nfs/dbraw/zinc/77/69/92/978776992.db2.gz WNIABQKNNZCPPS-SECBINFHSA-N 1 2 239.750 2.395 20 0 BEADLO C[C@@H]1CC[N@H+]1Cc1c(Cl)nccc1N(C)C ZINC001234105205 978776996 /nfs/dbraw/zinc/77/69/96/978776996.db2.gz WNIABQKNNZCPPS-SECBINFHSA-N 1 2 239.750 2.395 20 0 BEADLO CSc1cc(F)cc(OC2C[NH+](C)C2)c1 ZINC001234294782 978815449 /nfs/dbraw/zinc/81/54/49/978815449.db2.gz VGBYYQQXYGUZJI-UHFFFAOYSA-N 1 2 227.304 2.240 20 0 BEADLO Cc1[nH]c(CN2CCCC[C@@H](F)C2)c(C)[nH+]1 ZINC001234600383 978870530 /nfs/dbraw/zinc/87/05/30/978870530.db2.gz FJSKGLVMNFNJEH-LLVKDONJSA-N 1 2 225.311 2.351 20 0 BEADLO CCc1ccc(N2CCO[C@H](C(F)F)C2)[nH+]c1 ZINC001339706906 978897664 /nfs/dbraw/zinc/89/76/64/978897664.db2.gz PIXPXBUSMPLPIR-JTQLQIEISA-N 1 2 242.269 2.114 20 0 BEADLO CC[N@H+](CCOC)Cc1cncc(F)c1Cl ZINC001235491532 979057434 /nfs/dbraw/zinc/05/74/34/979057434.db2.gz HTIGAEDUOTXDAI-UHFFFAOYSA-N 1 2 246.713 2.342 20 0 BEADLO CC[N@@H+](CCOC)Cc1cncc(F)c1Cl ZINC001235491532 979057440 /nfs/dbraw/zinc/05/74/40/979057440.db2.gz HTIGAEDUOTXDAI-UHFFFAOYSA-N 1 2 246.713 2.342 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCCOCC2)c1Cl ZINC001235577647 979102224 /nfs/dbraw/zinc/10/22/24/979102224.db2.gz SJHAZANFQXQOTC-UHFFFAOYSA-N 1 2 240.734 2.266 20 0 BEADLO Cc1ccnc(C[N@H+]2CCCOCC2)c1Cl ZINC001235577647 979102230 /nfs/dbraw/zinc/10/22/30/979102230.db2.gz SJHAZANFQXQOTC-UHFFFAOYSA-N 1 2 240.734 2.266 20 0 BEADLO Cc1nc(F)ccc1C[N@H+]1C[C@H](F)C[C@H]1C ZINC001235806131 979154923 /nfs/dbraw/zinc/15/49/23/979154923.db2.gz QKTSDWHJXKLQID-LDYMZIIASA-N 1 2 226.270 2.461 20 0 BEADLO Cc1nc(F)ccc1C[N@@H+]1C[C@H](F)C[C@H]1C ZINC001235806131 979154929 /nfs/dbraw/zinc/15/49/29/979154929.db2.gz QKTSDWHJXKLQID-LDYMZIIASA-N 1 2 226.270 2.461 20 0 BEADLO COc1nccc(C[NH+]2CC(C)C2)c1Cl ZINC001235831300 979163689 /nfs/dbraw/zinc/16/36/89/979163689.db2.gz ZKBCCJVCYZXBMO-UHFFFAOYSA-N 1 2 226.707 2.195 20 0 BEADLO CC[C@H](CC(C)C)C(=O)N(CC)C1C[NH+](C)C1 ZINC001181829653 979322453 /nfs/dbraw/zinc/32/24/53/979322453.db2.gz AZRBZFJAXKLHJF-GFCCVEGCSA-N 1 2 240.391 2.221 20 0 BEADLO CC(C)c1ccc(C[N@H+](C)CCO)c(Cl)n1 ZINC001236258814 979478183 /nfs/dbraw/zinc/47/81/83/979478183.db2.gz IHTCABPBWOCUNL-UHFFFAOYSA-N 1 2 242.750 2.283 20 0 BEADLO CC(C)c1ccc(C[N@@H+](C)CCO)c(Cl)n1 ZINC001236258814 979478189 /nfs/dbraw/zinc/47/81/89/979478189.db2.gz IHTCABPBWOCUNL-UHFFFAOYSA-N 1 2 242.750 2.283 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@H]3CCCC[C@@H]3C2)no1 ZINC000045914742 1168319688 /nfs/dbraw/zinc/31/96/88/1168319688.db2.gz YFYIYGFFMCHDRR-NWDGAFQWSA-N 1 2 235.331 2.390 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@H]3CCCC[C@@H]3C2)no1 ZINC000045914742 1168319690 /nfs/dbraw/zinc/31/96/90/1168319690.db2.gz YFYIYGFFMCHDRR-NWDGAFQWSA-N 1 2 235.331 2.390 20 0 BEADLO C[C@H](C(=O)N(C)CC1CCCCC1)n1cc[nH+]c1 ZINC000045881045 1168320449 /nfs/dbraw/zinc/32/04/49/1168320449.db2.gz UNCHQUINCNHZKZ-GFCCVEGCSA-N 1 2 249.358 2.483 20 0 BEADLO CCOc1cc(F)cc(C[N@H+](C)C2COC2)c1 ZINC001237917682 980114995 /nfs/dbraw/zinc/11/49/95/980114995.db2.gz ZBIGONBXBPOEGV-UHFFFAOYSA-N 1 2 239.290 2.055 20 0 BEADLO CCOc1cc(F)cc(C[N@@H+](C)C2COC2)c1 ZINC001237917682 980115000 /nfs/dbraw/zinc/11/50/00/980115000.db2.gz ZBIGONBXBPOEGV-UHFFFAOYSA-N 1 2 239.290 2.055 20 0 BEADLO Cc1c[nH+]c(N2CC(C)(C)C2)nc1N1CCCC1 ZINC001163724637 1168424629 /nfs/dbraw/zinc/42/46/29/1168424629.db2.gz YRFCVLWNQPEDBN-UHFFFAOYSA-N 1 2 246.358 2.231 20 0 BEADLO CC(C)Oc1cc(C[NH+]2CCC2)cnc1F ZINC001238590266 980295932 /nfs/dbraw/zinc/29/59/32/980295932.db2.gz JUJDLQUURKSKTI-UHFFFAOYSA-N 1 2 224.279 2.214 20 0 BEADLO CN(C)c1cccc(CCn2cc[nH+]c2)c1 ZINC001250316259 980747029 /nfs/dbraw/zinc/74/70/29/980747029.db2.gz FPLVGKZVUOOKFW-UHFFFAOYSA-N 1 2 215.300 2.192 20 0 BEADLO C[NH+](C)Cc1nnc([C@@H]2CCC(F)(F)C2)o1 ZINC001346661410 980878104 /nfs/dbraw/zinc/87/81/04/980878104.db2.gz BHHFVLYSFNBXHW-SSDOTTSWSA-N 1 2 231.246 2.034 20 0 BEADLO O=C1CC[N@H+](Cc2ccccn2)[C@H]2CCCC[C@H]12 ZINC001204056231 1168632424 /nfs/dbraw/zinc/63/24/24/1168632424.db2.gz WVMCUNRWXCGYDR-KBPBESRZSA-N 1 2 244.338 2.415 20 0 BEADLO O=C1CC[N@@H+](Cc2ccccn2)[C@H]2CCCC[C@H]12 ZINC001204056231 1168632427 /nfs/dbraw/zinc/63/24/27/1168632427.db2.gz WVMCUNRWXCGYDR-KBPBESRZSA-N 1 2 244.338 2.415 20 0 BEADLO C[NH+](C)Cc1nnc([C@@H]2CCCC23CC3)o1 ZINC001348437671 981364826 /nfs/dbraw/zinc/36/48/26/981364826.db2.gz YPBQXAULQYQKRF-VIFPVBQESA-N 1 2 221.304 2.179 20 0 BEADLO C[C@H]1CCC(F)(F)CN1CCCn1cc[nH+]c1 ZINC001198640504 982813594 /nfs/dbraw/zinc/81/35/94/982813594.db2.gz DJDHVEXWNDOVFI-NSHDSACASA-N 1 2 243.301 2.393 20 0 BEADLO CC(=O)c1ccccc1-c1c[nH+]cn1C ZINC000258134123 1168935405 /nfs/dbraw/zinc/93/54/05/1168935405.db2.gz QMJHKYSBAJWGSZ-UHFFFAOYSA-N 1 2 200.241 2.290 20 0 BEADLO CN(CC1CCCCC1)c1cc(N)nc[nH+]1 ZINC000082426536 983070122 /nfs/dbraw/zinc/07/01/22/983070122.db2.gz OHCLZNGEDUELCC-UHFFFAOYSA-N 1 2 220.320 2.075 20 0 BEADLO CCC(CC)C[NH+]1CC(O)(C(F)(F)F)C1 ZINC001201523662 983322638 /nfs/dbraw/zinc/32/26/38/983322638.db2.gz UFJLLUPMRQHWIT-UHFFFAOYSA-N 1 2 225.254 2.032 20 0 BEADLO CN1CCC12C[NH+](Cc1ccc3occc3c1)C2 ZINC001275660524 1169052569 /nfs/dbraw/zinc/05/25/69/1169052569.db2.gz QUXYZIGUGXDKKJ-UHFFFAOYSA-N 1 2 242.322 2.323 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C=Cc1cccs1 ZINC000380188059 1169070457 /nfs/dbraw/zinc/07/04/57/1169070457.db2.gz VGVBHDRCTRUYMS-SNAWJCMRSA-N 1 2 247.323 2.109 20 0 BEADLO FC1(F)CN(CC2CC2)CC[C@H]1[NH+]1CCCC1 ZINC001201952284 983521149 /nfs/dbraw/zinc/52/11/49/983521149.db2.gz JZIZVIMOCZUIOO-GFCCVEGCSA-N 1 2 244.329 2.202 20 0 BEADLO CC[C@H](F)C(=O)NCc1c[nH+]c(C)cc1C ZINC001358285769 983849116 /nfs/dbraw/zinc/84/91/16/983849116.db2.gz GRQBRGWMDFBRFZ-NSHDSACASA-N 1 2 224.279 2.063 20 0 BEADLO Nc1[nH+]cccc1-c1cnc2ccoc2c1 ZINC001243474051 970764813 /nfs/dbraw/zinc/76/48/13/970764813.db2.gz IHNVOYFIYKCBTC-UHFFFAOYSA-N 1 2 211.224 2.472 20 0 BEADLO CCOCC[C@H](C)[NH+]1CC(F)(C2CC2)C1 ZINC001172418291 974690566 /nfs/dbraw/zinc/69/05/66/974690566.db2.gz WZRYSLBTSJZPKA-JTQLQIEISA-N 1 2 215.312 2.235 20 0 BEADLO CC(C)COCC[C@H](C)[NH+]1C[C@@H](F)[C@H](F)C1 ZINC001172475028 974768465 /nfs/dbraw/zinc/76/84/65/974768465.db2.gz ZALMIMLVNJQRRB-QJPTWQEYSA-N 1 2 235.318 2.429 20 0 BEADLO Cc1[nH]c(CNc2nccs2)[nH+]c1C ZINC001120870249 1169323073 /nfs/dbraw/zinc/32/30/73/1169323073.db2.gz QWKXGEGRGAUNGN-UHFFFAOYSA-N 1 2 208.290 2.095 20 0 BEADLO CC(C)C[C@H](C)c1nnc(C[NH+](C)C)o1 ZINC001327935500 972818438 /nfs/dbraw/zinc/81/84/38/972818438.db2.gz QXPDZHXJAIZJGE-VIFPVBQESA-N 1 2 211.309 2.281 20 0 BEADLO O=C(N[C@H]1C[C@H]1C1CC1)c1cc2c[nH+]ccc2[nH]1 ZINC001151979545 1169412026 /nfs/dbraw/zinc/41/20/26/1169412026.db2.gz SAHAUHSRUBUZDE-JQWIXIFHSA-N 1 2 241.294 2.091 20 0 BEADLO COC(C)(CNc1c(C)cc[nH+]c1C)OC ZINC001170435465 970815087 /nfs/dbraw/zinc/81/50/87/970815087.db2.gz NUFMACMWFANTNS-UHFFFAOYSA-N 1 2 224.304 2.119 20 0 BEADLO COC(C)(CNc1c[nH+]c(C)c(C)c1)OC ZINC001170436968 970818397 /nfs/dbraw/zinc/81/83/97/970818397.db2.gz BBGDIFLPJYDZJA-UHFFFAOYSA-N 1 2 224.304 2.119 20 0 BEADLO COC(C)(CNc1c[nH+]cc(C)c1C)OC ZINC001170438010 970821580 /nfs/dbraw/zinc/82/15/80/970821580.db2.gz SOVIAQIBJSBPSI-UHFFFAOYSA-N 1 2 224.304 2.119 20 0 BEADLO CC(C)Cc1nnc([C@@H]2CCCc3[nH]c[nH+]c32)o1 ZINC001256432674 970838833 /nfs/dbraw/zinc/83/88/33/970838833.db2.gz YQWJRQPXJQEKEP-SECBINFHSA-N 1 2 246.314 2.459 20 0 BEADLO COc1cc[nH+]cc1Nc1cc(F)ncc1OC ZINC001215803485 970848695 /nfs/dbraw/zinc/84/86/95/970848695.db2.gz WOYKTYMCBGWVRB-UHFFFAOYSA-N 1 2 249.245 2.377 20 0 BEADLO Cn1ncc2c1C[N@H+](Cc1ccc(F)cc1)CC2 ZINC001203914993 1169469524 /nfs/dbraw/zinc/46/95/24/1169469524.db2.gz HEMYMTJPLFFTBZ-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1ncc2c1C[N@@H+](Cc1ccc(F)cc1)CC2 ZINC001203914993 1169469528 /nfs/dbraw/zinc/46/95/28/1169469528.db2.gz HEMYMTJPLFFTBZ-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1cc2c(n1)CC[N@@H+](Cc1ccc(F)cc1)C2 ZINC001203915241 1169469702 /nfs/dbraw/zinc/46/97/02/1169469702.db2.gz NTVUOFRMKILWKY-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1cc2c(n1)CC[N@H+](Cc1ccc(F)cc1)C2 ZINC001203915241 1169469706 /nfs/dbraw/zinc/46/97/06/1169469706.db2.gz NTVUOFRMKILWKY-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO C[C@@H]1C[C@H]1c1nnc(C[NH+]2CCCCC2)o1 ZINC001256610901 970867362 /nfs/dbraw/zinc/86/73/62/970867362.db2.gz SPFUFWMPVRQFPD-NXEZZACHSA-N 1 2 221.304 2.179 20 0 BEADLO C[C@H]1C[C@H]1c1nnc([C@H]2CCCC[N@@H+]2C)o1 ZINC001256683176 970919808 /nfs/dbraw/zinc/91/98/08/970919808.db2.gz NIMNEKRHECVWNP-IVZWLZJFSA-N 1 2 221.304 2.350 20 0 BEADLO C[C@H]1C[C@H]1c1nnc([C@H]2CCCC[N@H+]2C)o1 ZINC001256683176 970919814 /nfs/dbraw/zinc/91/98/14/970919814.db2.gz NIMNEKRHECVWNP-IVZWLZJFSA-N 1 2 221.304 2.350 20 0 BEADLO Cc1ccc[nH+]c1Nc1ccc(O)c(CO)c1 ZINC001216136669 970951208 /nfs/dbraw/zinc/95/12/08/970951208.db2.gz XWGCAXFGPBEIKF-UHFFFAOYSA-N 1 2 230.267 2.332 20 0 BEADLO O=C1CC[N@@H+]([C@H]2CCO[C@H](c3ccccc3)C2)C1 ZINC001256817252 970994689 /nfs/dbraw/zinc/99/46/89/970994689.db2.gz LDSRAKHVQAWOBR-ZFWWWQNUSA-N 1 2 245.322 2.182 20 0 BEADLO O=C1CC[N@H+]([C@H]2CCO[C@H](c3ccccc3)C2)C1 ZINC001256817252 970994694 /nfs/dbraw/zinc/99/46/94/970994694.db2.gz LDSRAKHVQAWOBR-ZFWWWQNUSA-N 1 2 245.322 2.182 20 0 BEADLO COc1ccc(Nc2[nH+]c(C)ccc2O)cc1N ZINC001216255298 971001725 /nfs/dbraw/zinc/00/17/25/971001725.db2.gz CKIUFYZQQPWZSY-UHFFFAOYSA-N 1 2 245.282 2.430 20 0 BEADLO c1ccc(-c2ccc(C3=C[NH2+]CCC3)nn2)nc1 ZINC001243948363 971031390 /nfs/dbraw/zinc/03/13/90/971031390.db2.gz CIVLIEWYWHMDPW-UHFFFAOYSA-N 1 2 238.294 2.263 20 0 BEADLO C[C@@H]1CC[N@H+](CCCn2cccn2)CC1(F)F ZINC001208080645 1169501283 /nfs/dbraw/zinc/50/12/83/1169501283.db2.gz FYYDEYYAFWCHGF-LLVKDONJSA-N 1 2 243.301 2.250 20 0 BEADLO C[C@@H]1CC[N@@H+](CCCn2cccn2)CC1(F)F ZINC001208080645 1169501290 /nfs/dbraw/zinc/50/12/90/1169501290.db2.gz FYYDEYYAFWCHGF-LLVKDONJSA-N 1 2 243.301 2.250 20 0 BEADLO COc1c(O)cccc1Nc1[nH+]cc(C)cc1N ZINC001216347656 971059707 /nfs/dbraw/zinc/05/97/07/971059707.db2.gz BWMQSVAHMNBXOM-UHFFFAOYSA-N 1 2 245.282 2.430 20 0 BEADLO CCC[C@@H](CC)[NH+]1CC(O)(C(F)(F)F)C1 ZINC001257258372 971156623 /nfs/dbraw/zinc/15/66/23/971156623.db2.gz YQPSQWFPOFXOEF-MRVPVSSYSA-N 1 2 225.254 2.174 20 0 BEADLO C[C@@H]1C[C@H]1c1nnc([C@@H]([NH3+])COC(C)(C)C)o1 ZINC001217695183 971328995 /nfs/dbraw/zinc/32/89/95/971328995.db2.gz DDWDGLITLPOWNP-HLTSFMKQSA-N 1 2 239.319 2.008 20 0 BEADLO C[NH+](C)Cc1nnc([C@]2(C)CC=CCC2)o1 ZINC001330100306 974106320 /nfs/dbraw/zinc/10/63/20/974106320.db2.gz NOJXUZBSHAWPCP-GFCCVEGCSA-N 1 2 221.304 2.129 20 0 BEADLO CCCCC[C@@H](C)[NH2+]CC(=O)OCCC ZINC001257506662 971425296 /nfs/dbraw/zinc/42/52/96/971425296.db2.gz RGISTOYKQAUZQV-LLVKDONJSA-N 1 2 215.337 2.498 20 0 BEADLO CC[N@H+](C)Cc1nnc(CC(C)(C)C)o1 ZINC001257861196 971508063 /nfs/dbraw/zinc/50/80/63/971508063.db2.gz GJUOOFWODZPUSA-UHFFFAOYSA-N 1 2 211.309 2.110 20 0 BEADLO CC[N@@H+](C)Cc1nnc(CC(C)(C)C)o1 ZINC001257861196 971508069 /nfs/dbraw/zinc/50/80/69/971508069.db2.gz GJUOOFWODZPUSA-UHFFFAOYSA-N 1 2 211.309 2.110 20 0 BEADLO Fc1cc(F)cc(O[C@@H]2CC[NH2+]CC2(F)F)c1 ZINC001218004242 971567259 /nfs/dbraw/zinc/56/72/59/971567259.db2.gz BNAIFLQNONYECQ-SNVBAGLBSA-N 1 2 249.207 2.341 20 0 BEADLO Fc1cc(F)cc(O[C@H]2CC[NH2+]CC2(F)F)c1 ZINC001218004239 971569714 /nfs/dbraw/zinc/56/97/14/971569714.db2.gz BNAIFLQNONYECQ-JTQLQIEISA-N 1 2 249.207 2.341 20 0 BEADLO CCc1cccnc1O[C@@H]1CC[NH2+]CC1(F)F ZINC001218011354 971570636 /nfs/dbraw/zinc/57/06/36/971570636.db2.gz GNSBKHYJNMIVKU-SNVBAGLBSA-N 1 2 242.269 2.020 20 0 BEADLO CNc1cc(-c2cccc3c2CNC3=O)cc[nH+]1 ZINC001244974429 971578559 /nfs/dbraw/zinc/57/85/59/971578559.db2.gz XYGJHLJOOWBLIT-UHFFFAOYSA-N 1 2 239.278 2.034 20 0 BEADLO Cc1cc(S)ccc1O[C@@H]1C[NH2+][C@H](C)C1 ZINC001218045996 971588274 /nfs/dbraw/zinc/58/82/74/971588274.db2.gz JVGRELWBECEARM-ZJUUUORDSA-N 1 2 223.341 2.413 20 0 BEADLO CC1(C)[C@@H]2C[C@H]([N@@H+]3CC(F)(F)C[C@H]3CO)C[C@@H]21 ZINC001170739567 971686650 /nfs/dbraw/zinc/68/66/50/971686650.db2.gz PFVYSBTXVBWOGF-MMWGEVLESA-N 1 2 245.313 2.123 20 0 BEADLO CC1(C)[C@@H]2C[C@H]([N@H+]3CC(F)(F)C[C@H]3CO)C[C@@H]21 ZINC001170739567 971686663 /nfs/dbraw/zinc/68/66/63/971686663.db2.gz PFVYSBTXVBWOGF-MMWGEVLESA-N 1 2 245.313 2.123 20 0 BEADLO CC[NH+]1CC(Oc2ccc(F)c(C)c2)C1 ZINC001225322683 974397821 /nfs/dbraw/zinc/39/78/21/974397821.db2.gz ZEUMRRVFZZIOBS-UHFFFAOYSA-N 1 2 209.264 2.217 20 0 BEADLO CC1(C)[C@@H]2C[C@@H]([NH+]3CC(O)(C(F)(F)F)C3)C[C@@H]21 ZINC001170747663 971715058 /nfs/dbraw/zinc/71/50/58/971715058.db2.gz UTXCPYSOKOKIHX-PSVAKVPMSA-N 1 2 249.276 2.030 20 0 BEADLO CC1(C)[C@@H]2C[C@H]([N@@H+]3CC[C@@H](O)C(F)(F)C3)C[C@@H]21 ZINC001170761886 971744629 /nfs/dbraw/zinc/74/46/29/971744629.db2.gz PCRVGEVEJWHKQP-LMLFDSFASA-N 1 2 245.313 2.123 20 0 BEADLO CC1(C)[C@@H]2C[C@H]([N@H+]3CC[C@@H](O)C(F)(F)C3)C[C@@H]21 ZINC001170761886 971744637 /nfs/dbraw/zinc/74/46/37/971744637.db2.gz PCRVGEVEJWHKQP-LMLFDSFASA-N 1 2 245.313 2.123 20 0 BEADLO CCC=CNc1ccn2cc(N)[nH+]c2c1 ZINC001170768522 971771887 /nfs/dbraw/zinc/77/18/87/971771887.db2.gz ZEQIJICTLBPPGN-HWKANZROSA-N 1 2 202.261 2.252 20 0 BEADLO FC(F)(F)C(F)(F)C[NH2+][C@H]1CCCOCC1 ZINC001170775249 971802005 /nfs/dbraw/zinc/80/20/05/971802005.db2.gz HJSIPDLMPQXQJX-ZETCQYMHSA-N 1 2 247.207 2.343 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@H](C)CCO[C@H](C)CC ZINC001172319394 974527990 /nfs/dbraw/zinc/52/79/90/974527990.db2.gz QKPIVYCMXJBOFH-UTUOFQBUSA-N 1 2 245.363 2.121 20 0 BEADLO CC[C@@H](C)OCC[C@H](C)[NH2+]C(C)(C)C(=O)OC ZINC001172322480 974534057 /nfs/dbraw/zinc/53/40/57/974534057.db2.gz VAGFXLAKJODQDS-WDEREUQCSA-N 1 2 245.363 2.121 20 0 BEADLO CC1(C)C[C@H]([N@@H+]2CCC(F)(F)[C@H](F)C2)CO1 ZINC001172283291 974541843 /nfs/dbraw/zinc/54/18/43/974541843.db2.gz JKLGDJHLSSKIDA-DTWKUNHWSA-N 1 2 237.265 2.233 20 0 BEADLO CC1(C)C[C@H]([N@H+]2CCC(F)(F)[C@H](F)C2)CO1 ZINC001172283291 974541853 /nfs/dbraw/zinc/54/18/53/974541853.db2.gz JKLGDJHLSSKIDA-DTWKUNHWSA-N 1 2 237.265 2.233 20 0 BEADLO COc1cc[nH+]cc1-n1ncc2ccc(N)cc21 ZINC000311073043 971990647 /nfs/dbraw/zinc/99/06/47/971990647.db2.gz ZLYJFYOOHVDCRG-UHFFFAOYSA-N 1 2 240.266 2.011 20 0 BEADLO CC[C@@H](C)OCC[C@@H](C)[N@@H+]1CCCC(=O)C1 ZINC001172343915 974612791 /nfs/dbraw/zinc/61/27/91/974612791.db2.gz WOUBMWCXJQNXLF-VXGBXAGGSA-N 1 2 227.348 2.245 20 0 BEADLO CC[C@@H](C)OCC[C@@H](C)[N@H+]1CCCC(=O)C1 ZINC001172343915 974612802 /nfs/dbraw/zinc/61/28/02/974612802.db2.gz WOUBMWCXJQNXLF-VXGBXAGGSA-N 1 2 227.348 2.245 20 0 BEADLO CCOc1ccccc1NC(=O)[C@H]1CC[N@@H+]1CC ZINC001135999526 972020399 /nfs/dbraw/zinc/02/03/99/972020399.db2.gz PBYWVGIFHKAAMO-GFCCVEGCSA-N 1 2 248.326 2.118 20 0 BEADLO CCOc1ccccc1NC(=O)[C@H]1CC[N@H+]1CC ZINC001135999526 972020405 /nfs/dbraw/zinc/02/04/05/972020405.db2.gz PBYWVGIFHKAAMO-GFCCVEGCSA-N 1 2 248.326 2.118 20 0 BEADLO CCOC(=O)C1([NH2+][C@@H]2CC[C@H](C)[C@@H](C)C2)CC1 ZINC001172358647 974627685 /nfs/dbraw/zinc/62/76/85/974627685.db2.gz JGZUFHYYHOAISU-SDDRHHMPSA-N 1 2 239.359 2.496 20 0 BEADLO Cc1ccc(C[NH2+]Cc2nccs2)nc1C ZINC000314210308 972122742 /nfs/dbraw/zinc/12/27/42/972122742.db2.gz SOZZMTNGRHNSBG-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO FC1(F)CCCC[N@H+](C[C@@H]2CCCO2)C1 ZINC001207847965 956868422 /nfs/dbraw/zinc/86/84/22/956868422.db2.gz ZCXCPNIYOODZMA-JTQLQIEISA-N 1 2 219.275 2.287 20 0 BEADLO FC1(F)CCCC[N@@H+](C[C@@H]2CCCO2)C1 ZINC001207847965 956868431 /nfs/dbraw/zinc/86/84/31/956868431.db2.gz ZCXCPNIYOODZMA-JTQLQIEISA-N 1 2 219.275 2.287 20 0 BEADLO CS[C@@H](C)CC[N@@H+]1CCC[C@H](F)C(=O)C1 ZINC001208139758 957006657 /nfs/dbraw/zinc/00/66/57/957006657.db2.gz VAMGQILSOKHHKU-UWVGGRQHSA-N 1 2 233.352 2.131 20 0 BEADLO CS[C@@H](C)CC[N@H+]1CCC[C@H](F)C(=O)C1 ZINC001208139758 957006671 /nfs/dbraw/zinc/00/66/71/957006671.db2.gz VAMGQILSOKHHKU-UWVGGRQHSA-N 1 2 233.352 2.131 20 0 BEADLO CC(=O)c1nn(C)cc1Nc1c[nH+]c(C)cc1C ZINC001213510721 957067350 /nfs/dbraw/zinc/06/73/50/957067350.db2.gz HOOKGJWZHYKLPB-UHFFFAOYSA-N 1 2 244.298 2.378 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC(=O)C(C)(C)C2)cn1 ZINC001139932868 957076517 /nfs/dbraw/zinc/07/65/17/957076517.db2.gz VMCDUYFVOAJTNO-UHFFFAOYSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1ccc(C[N@H+]2CCC(=O)C(C)(C)C2)cn1 ZINC001139932868 957076526 /nfs/dbraw/zinc/07/65/26/957076526.db2.gz VMCDUYFVOAJTNO-UHFFFAOYSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1nc2c(o1)CC[N@H+](C[C@H]1CCC=CO1)C2 ZINC001208888207 957208552 /nfs/dbraw/zinc/20/85/52/957208552.db2.gz TUEIYRXHQFEGJQ-LLVKDONJSA-N 1 2 234.299 2.034 20 0 BEADLO Cc1nc2c(o1)CC[N@@H+](C[C@H]1CCC=CO1)C2 ZINC001208888207 957208561 /nfs/dbraw/zinc/20/85/61/957208561.db2.gz TUEIYRXHQFEGJQ-LLVKDONJSA-N 1 2 234.299 2.034 20 0 BEADLO COCC[N@@H+]1CCc2c3ccccc3oc2C1 ZINC001209211759 957358890 /nfs/dbraw/zinc/35/88/90/957358890.db2.gz WFPVXFCSGWQRMD-UHFFFAOYSA-N 1 2 231.295 2.437 20 0 BEADLO COCC[N@H+]1CCc2c3ccccc3oc2C1 ZINC001209211759 957358899 /nfs/dbraw/zinc/35/88/99/957358899.db2.gz WFPVXFCSGWQRMD-UHFFFAOYSA-N 1 2 231.295 2.437 20 0 BEADLO CN(C)c1cc(N2CC3(C2)CCCCC3)nc[nH+]1 ZINC001167182505 957527640 /nfs/dbraw/zinc/52/76/40/957527640.db2.gz XWTHZQJEMHWQJN-UHFFFAOYSA-N 1 2 246.358 2.313 20 0 BEADLO CN(C)c1cc(N2CC3(C2)CCCCC3)[nH+]cn1 ZINC001167182505 957527644 /nfs/dbraw/zinc/52/76/44/957527644.db2.gz XWTHZQJEMHWQJN-UHFFFAOYSA-N 1 2 246.358 2.313 20 0 BEADLO COc1ccc(C)[nH+]c1N1CC[C@@H]2OCC[C@@H]2C1 ZINC001167212780 957545428 /nfs/dbraw/zinc/54/54/28/957545428.db2.gz GPAJLKORMBFWEO-NEPJUHHUSA-N 1 2 248.326 2.014 20 0 BEADLO COc1ccc(C)[nH+]c1N1C[C@H]2[C@H](CF)[C@H]2C1 ZINC001167221685 957553807 /nfs/dbraw/zinc/55/38/07/957553807.db2.gz HOEYONVDPWHVRA-RTCCRHLQSA-N 1 2 236.290 2.050 20 0 BEADLO Cc1cc(N2C[C@H]3[C@H](CF)[C@H]3C2)nc(C2CC2)[nH+]1 ZINC001167224632 957557252 /nfs/dbraw/zinc/55/72/52/957557252.db2.gz COTIMEJZQFDWPZ-CNDDSTCGSA-N 1 2 247.317 2.314 20 0 BEADLO Cc1c(F)cc[nH+]c1N1C[C@H]2[C@H](CF)[C@H]2C1 ZINC001167225207 957557958 /nfs/dbraw/zinc/55/79/58/957557958.db2.gz HNJOGXDAYFJBEC-OWUUHHOZSA-N 1 2 224.254 2.181 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cn3ccccc3n2)C[C@@H]1F ZINC001136876127 972288041 /nfs/dbraw/zinc/28/80/41/972288041.db2.gz QSGGOZJMOOEYPV-PWSUYJOCSA-N 1 2 233.290 2.124 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cn3ccccc3n2)C[C@@H]1F ZINC001136876127 972288043 /nfs/dbraw/zinc/28/80/43/972288043.db2.gz QSGGOZJMOOEYPV-PWSUYJOCSA-N 1 2 233.290 2.124 20 0 BEADLO CC=C(C)Nc1ccc(N2CCC(O)CC2)[nH+]c1 ZINC001210791709 957885475 /nfs/dbraw/zinc/88/54/75/957885475.db2.gz BZDAFQSSGHNTKP-QDEBKDIKSA-N 1 2 247.342 2.378 20 0 BEADLO FC1(F)C[NH2+]CCN(CCC2CCCCC2)C1 ZINC001210814792 957908728 /nfs/dbraw/zinc/90/87/28/957908728.db2.gz KBJHROYXMJGKAX-UHFFFAOYSA-N 1 2 246.345 2.497 20 0 BEADLO FC1(F)CNCC[N@H+](CCC2CCCCC2)C1 ZINC001210814792 957908742 /nfs/dbraw/zinc/90/87/42/957908742.db2.gz KBJHROYXMJGKAX-UHFFFAOYSA-N 1 2 246.345 2.497 20 0 BEADLO FC1(F)CNCC[N@@H+](CCC2CCCCC2)C1 ZINC001210814792 957908750 /nfs/dbraw/zinc/90/87/50/957908750.db2.gz KBJHROYXMJGKAX-UHFFFAOYSA-N 1 2 246.345 2.497 20 0 BEADLO Nc1cccc(F)c1C[NH+]1CC(C(F)F)C1 ZINC000706489062 957917524 /nfs/dbraw/zinc/91/75/24/957917524.db2.gz FCSKRGWHEDQWBW-UHFFFAOYSA-N 1 2 230.233 2.105 20 0 BEADLO CC[NH2+]Cc1noc([C@@]23C[C@@H]2CCCC3)n1 ZINC000693214425 957927187 /nfs/dbraw/zinc/92/71/87/957927187.db2.gz ZAYAQZPCTZUQQM-CABZTGNLSA-N 1 2 221.304 2.011 20 0 BEADLO Cc1cccn2c(C[N@H+]3C[C@@H](C)[C@@H](F)C3)cnc12 ZINC001136958482 972304548 /nfs/dbraw/zinc/30/45/48/972304548.db2.gz UDLGKBXXNMHUEH-YPMHNXCESA-N 1 2 247.317 2.433 20 0 BEADLO Cc1cccn2c(C[N@@H+]3C[C@@H](C)[C@@H](F)C3)cnc12 ZINC001136958482 972304555 /nfs/dbraw/zinc/30/45/55/972304555.db2.gz UDLGKBXXNMHUEH-YPMHNXCESA-N 1 2 247.317 2.433 20 0 BEADLO CCN1CC[N@H+](Cc2cc(C)c(C)o2)[C@H](C)C1 ZINC001204541339 958032949 /nfs/dbraw/zinc/03/29/49/958032949.db2.gz JQIIBKMQEFILRD-GFCCVEGCSA-N 1 2 236.359 2.422 20 0 BEADLO CCN1CC[N@@H+](Cc2cc(C)c(C)o2)[C@H](C)C1 ZINC001204541339 958032957 /nfs/dbraw/zinc/03/29/57/958032957.db2.gz JQIIBKMQEFILRD-GFCCVEGCSA-N 1 2 236.359 2.422 20 0 BEADLO CCCNc1cc(NCCSC)nc[nH+]1 ZINC000087830601 958049447 /nfs/dbraw/zinc/04/94/47/958049447.db2.gz FRGBZGXIEPGOHZ-UHFFFAOYSA-N 1 2 226.349 2.073 20 0 BEADLO CCCNc1cc(NCCSC)[nH+]cn1 ZINC000087830601 958049451 /nfs/dbraw/zinc/04/94/51/958049451.db2.gz FRGBZGXIEPGOHZ-UHFFFAOYSA-N 1 2 226.349 2.073 20 0 BEADLO Clc1cncc(C[N@@H+]2CC[C@]23CCOC3)c1 ZINC001136997977 972317515 /nfs/dbraw/zinc/31/75/15/972317515.db2.gz YDRPLMCCNYYECP-GFCCVEGCSA-N 1 2 238.718 2.100 20 0 BEADLO Clc1cncc(C[N@H+]2CC[C@]23CCOC3)c1 ZINC001136997977 972317519 /nfs/dbraw/zinc/31/75/19/972317519.db2.gz YDRPLMCCNYYECP-GFCCVEGCSA-N 1 2 238.718 2.100 20 0 BEADLO CC[N@H+](Cc1nc(C(F)(F)F)c[nH]1)C1CC1 ZINC001137010317 972324450 /nfs/dbraw/zinc/32/44/50/972324450.db2.gz NIPVDAQCCFRVEA-UHFFFAOYSA-N 1 2 233.237 2.413 20 0 BEADLO CC[N@@H+](Cc1nc(C(F)(F)F)c[nH]1)C1CC1 ZINC001137010317 972324456 /nfs/dbraw/zinc/32/44/56/972324456.db2.gz NIPVDAQCCFRVEA-UHFFFAOYSA-N 1 2 233.237 2.413 20 0 BEADLO COc1cc(Nc2c[nH+]cc(C)c2C)ncn1 ZINC001213522787 958196798 /nfs/dbraw/zinc/19/67/98/958196798.db2.gz GPYOMUPQVPYVMX-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO Cc1c[nH+]cc(Nc2cn(C)cn2)c1C ZINC001213523206 958201514 /nfs/dbraw/zinc/20/15/14/958201514.db2.gz NIIZAPVBTATFJA-UHFFFAOYSA-N 1 2 202.261 2.176 20 0 BEADLO Cc1c[nH+]cc(Nc2ncccc2N)c1C ZINC001213523616 958205046 /nfs/dbraw/zinc/20/50/46/958205046.db2.gz XBRQBDNHUSNVDH-UHFFFAOYSA-N 1 2 214.272 2.419 20 0 BEADLO CCCCOC(=O)C[NH+]1CCC(C(F)F)CC1 ZINC000307858736 958233872 /nfs/dbraw/zinc/23/38/72/958233872.db2.gz SBVQVOHFOFVVPB-UHFFFAOYSA-N 1 2 249.301 2.307 20 0 BEADLO CC1(C)CCC[C@H](N[C@@H]2C[NH2+]CC2(F)F)C1 ZINC001246461259 972336932 /nfs/dbraw/zinc/33/69/32/972336932.db2.gz OHFWEWUVBSONMV-VHSXEESVSA-N 1 2 232.318 2.152 20 0 BEADLO CO[C@@H]1CCC[N@H+](C/C(Cl)=C\Cl)C1 ZINC000308457966 958389849 /nfs/dbraw/zinc/38/98/49/958389849.db2.gz GQGLYDLGZWWYNH-WHXYTISESA-N 1 2 224.131 2.416 20 0 BEADLO CO[C@@H]1CCC[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000308457966 958389861 /nfs/dbraw/zinc/38/98/61/958389861.db2.gz GQGLYDLGZWWYNH-WHXYTISESA-N 1 2 224.131 2.416 20 0 BEADLO Cc1nn(C)cc1C[N@@H+]1CC[C@@](C)(F)[C@H](F)C1 ZINC001204576136 958534471 /nfs/dbraw/zinc/53/44/71/958534471.db2.gz FIBFABKYPYNAMM-VXGBXAGGSA-N 1 2 243.301 2.001 20 0 BEADLO Cc1nn(C)cc1C[N@H+]1CC[C@@](C)(F)[C@H](F)C1 ZINC001204576136 958534498 /nfs/dbraw/zinc/53/44/98/958534498.db2.gz FIBFABKYPYNAMM-VXGBXAGGSA-N 1 2 243.301 2.001 20 0 BEADLO Cc1sccc1Cc1nnc(C[NH+](C)C)o1 ZINC001327000180 972359722 /nfs/dbraw/zinc/35/97/22/972359722.db2.gz GTJDBWGKGWDLHQ-UHFFFAOYSA-N 1 2 237.328 2.092 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cnc(N2CCCCC2)nc1 ZINC001222118713 972373192 /nfs/dbraw/zinc/37/31/92/972373192.db2.gz QDPUKMKVOQETGP-YTEPGLGFSA-N 1 2 244.342 2.343 20 0 BEADLO C[C@H]1CC[C@H](OCCn2cc[nH+]c2)CC1 ZINC001222134727 972381312 /nfs/dbraw/zinc/38/13/12/972381312.db2.gz LTMTVWAHOLIMAX-HAQNSBGRSA-N 1 2 208.305 2.478 20 0 BEADLO CCCCOC[C@H](C)OCCn1cc[nH+]c1 ZINC001222134187 972381744 /nfs/dbraw/zinc/38/17/44/972381744.db2.gz BKYXVCWETGEXSS-LBPRGKRZSA-N 1 2 226.320 2.105 20 0 BEADLO C[C@@H](OCCn1cc[nH+]c1)c1ccccn1 ZINC001222134195 972383850 /nfs/dbraw/zinc/38/38/50/972383850.db2.gz BPLFVGFDUBHONU-LLVKDONJSA-N 1 2 217.272 2.056 20 0 BEADLO CCOc1cc[nH+]cc1Nc1cnn(COC)c1 ZINC001216572546 959053019 /nfs/dbraw/zinc/05/30/19/959053019.db2.gz AADGPUYPBZLIPS-UHFFFAOYSA-N 1 2 248.286 2.024 20 0 BEADLO COc1cccc(F)c1NCc1cc[nH+]c(N)c1 ZINC001167616910 959080882 /nfs/dbraw/zinc/08/08/82/959080882.db2.gz CIYOMQWBTACSJF-UHFFFAOYSA-N 1 2 247.273 2.424 20 0 BEADLO Nc1cc(CNc2ccc3c(c2)NCC3)cc[nH+]1 ZINC001167618580 959088767 /nfs/dbraw/zinc/08/87/67/959088767.db2.gz KWKGOOQKVWGNKJ-UHFFFAOYSA-N 1 2 240.310 2.244 20 0 BEADLO CC1(F)C[NH+](C[C@@H]2CCOC(C)(C)C2)C1 ZINC001207354786 959223640 /nfs/dbraw/zinc/22/36/40/959223640.db2.gz XVMDEHBQGZZRGI-SNVBAGLBSA-N 1 2 215.312 2.235 20 0 BEADLO CCc1ccc(NC(=O)C[C@H]([NH3+])C(F)F)cc1 ZINC000724762892 959301696 /nfs/dbraw/zinc/30/16/96/959301696.db2.gz TUYVFZOWQUCTCC-JTQLQIEISA-N 1 2 242.269 2.170 20 0 BEADLO C[C@@H](NC(=O)C[C@H]([NH3+])C(F)F)C1CCCCC1 ZINC000724754632 959361673 /nfs/dbraw/zinc/36/16/73/959361673.db2.gz DYAQQRHMLKPYSD-SCZZXKLOSA-N 1 2 248.317 2.054 20 0 BEADLO COCC[N@H+](C)Cc1c(F)ccc(OC)c1F ZINC001143969505 972439239 /nfs/dbraw/zinc/43/92/39/972439239.db2.gz DDYTVEFWBGXBLH-UHFFFAOYSA-N 1 2 245.269 2.052 20 0 BEADLO COCC[N@@H+](C)Cc1c(F)ccc(OC)c1F ZINC001143969505 972439241 /nfs/dbraw/zinc/43/92/41/972439241.db2.gz DDYTVEFWBGXBLH-UHFFFAOYSA-N 1 2 245.269 2.052 20 0 BEADLO Cc1cc([NH2+][C@@H]2CCOC[C@H]2C)ccc1N ZINC000301026095 959681030 /nfs/dbraw/zinc/68/10/30/959681030.db2.gz PKBBBVKYJVXMRM-ZWNOBZJWSA-N 1 2 220.316 2.414 20 0 BEADLO Cc1nccn1CCNc1cc(C)cc[nH+]1 ZINC000309195348 959737125 /nfs/dbraw/zinc/73/71/25/959737125.db2.gz JWBBPJJGZPKFDG-UHFFFAOYSA-N 1 2 216.288 2.007 20 0 BEADLO COc1ccccc1C[N@H+](C)Cc1cnco1 ZINC001140931400 960090463 /nfs/dbraw/zinc/09/04/63/960090463.db2.gz IPZRJZJLTWOODM-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1ccccc1C[N@@H+](C)Cc1cnco1 ZINC001140931400 960090467 /nfs/dbraw/zinc/09/04/67/960090467.db2.gz IPZRJZJLTWOODM-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO CCOC(=O)[C@@H]([NH2+]CC1=CCCC1)C1CC1 ZINC001327224585 972507457 /nfs/dbraw/zinc/50/74/57/972507457.db2.gz RYFPNEOFYHUKMW-LBPRGKRZSA-N 1 2 223.316 2.028 20 0 BEADLO Cc1ccc(C[NH+]2CC3(COC3)C2)c(Cl)c1 ZINC001140796472 960579014 /nfs/dbraw/zinc/57/90/14/960579014.db2.gz JNMDGMGNXOTKAL-UHFFFAOYSA-N 1 2 237.730 2.481 20 0 BEADLO COCC[N@H+](C)Cc1c(F)cc(OC)cc1F ZINC001140823411 960611719 /nfs/dbraw/zinc/61/17/19/960611719.db2.gz HAEMQWWFXOWJII-UHFFFAOYSA-N 1 2 245.269 2.052 20 0 BEADLO COCC[N@@H+](C)Cc1c(F)cc(OC)cc1F ZINC001140823411 960611726 /nfs/dbraw/zinc/61/17/26/960611726.db2.gz HAEMQWWFXOWJII-UHFFFAOYSA-N 1 2 245.269 2.052 20 0 BEADLO Cc1cc(C[N@@H+]2CCCC[C@@H](F)C2)[nH]n1 ZINC001203070489 960621671 /nfs/dbraw/zinc/62/16/71/960621671.db2.gz WDRBLCYQNSMAEP-SNVBAGLBSA-N 1 2 211.284 2.042 20 0 BEADLO Cc1cc(C[N@H+]2CCCC[C@@H](F)C2)[nH]n1 ZINC001203070489 960621680 /nfs/dbraw/zinc/62/16/80/960621680.db2.gz WDRBLCYQNSMAEP-SNVBAGLBSA-N 1 2 211.284 2.042 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3sccc3C2)[nH]n1 ZINC001203070691 960628252 /nfs/dbraw/zinc/62/82/52/960628252.db2.gz AIXQEHRADXSVTP-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO Cc1cc(C[N@H+]2CCc3sccc3C2)[nH]n1 ZINC001203070691 960628259 /nfs/dbraw/zinc/62/82/59/960628259.db2.gz AIXQEHRADXSVTP-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO CC1C[NH+](Cc2ccc(O)c(F)c2F)C1 ZINC001140889701 960665995 /nfs/dbraw/zinc/66/59/95/960665995.db2.gz JTZYZOLBAVKAGW-UHFFFAOYSA-N 1 2 213.227 2.122 20 0 BEADLO COC1=CC[C@H](OCc2c[nH+]cn2C)CC1 ZINC001222601117 960721974 /nfs/dbraw/zinc/72/19/74/960721974.db2.gz YCUOOEOKNNXHDD-LBPRGKRZSA-N 1 2 222.288 2.020 20 0 BEADLO Cn1c[nH+]cc1CO[C@H]1CCCc2cccnc21 ZINC001222594577 960722424 /nfs/dbraw/zinc/72/24/24/960722424.db2.gz GXJAGVUVYZIKLY-ZDUSSCGKSA-N 1 2 243.310 2.409 20 0 BEADLO CC[N@H+](Cc1cccnc1)Cc1nccnc1C ZINC001140937460 960728126 /nfs/dbraw/zinc/72/81/26/960728126.db2.gz GNQKOHIJCFFNEW-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO CC[N@@H+](Cc1cccnc1)Cc1nccnc1C ZINC001140937460 960728140 /nfs/dbraw/zinc/72/81/40/960728140.db2.gz GNQKOHIJCFFNEW-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2nccnc2C)cn1 ZINC001140939856 960733308 /nfs/dbraw/zinc/73/33/08/960733308.db2.gz JWYNOFZGUZZHEM-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2nccnc2C)cn1 ZINC001140939856 960733324 /nfs/dbraw/zinc/73/33/24/960733324.db2.gz JWYNOFZGUZZHEM-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO FC(F)C1CC[NH+](Cc2ncco2)CC1 ZINC001141007638 960807947 /nfs/dbraw/zinc/80/79/47/960807947.db2.gz UWVYUCXIFFPZBI-UHFFFAOYSA-N 1 2 216.231 2.152 20 0 BEADLO c1coc(C[NH+]2CC(c3ccccc3)C2)n1 ZINC001141011174 960810903 /nfs/dbraw/zinc/81/09/03/960810903.db2.gz SSYAVQDZBSETKD-UHFFFAOYSA-N 1 2 214.268 2.274 20 0 BEADLO Cc1ncoc1C[N@@H+](C)Cc1ccc(C)nc1 ZINC001141055024 960851060 /nfs/dbraw/zinc/85/10/60/960851060.db2.gz JPRYSIFOWJAOAY-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ncoc1C[N@H+](C)Cc1ccc(C)nc1 ZINC001141055024 960851064 /nfs/dbraw/zinc/85/10/64/960851064.db2.gz JPRYSIFOWJAOAY-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CCCCc1[nH]cc(CN2CC[C@H](F)C2)[nH+]1 ZINC001141067392 960859805 /nfs/dbraw/zinc/85/98/05/960859805.db2.gz AMUAZNIYVBTCJH-JTQLQIEISA-N 1 2 225.311 2.296 20 0 BEADLO CCCCc1[nH]c(CN2CC[C@H](F)C2)c[nH+]1 ZINC001141067392 960859810 /nfs/dbraw/zinc/85/98/10/960859810.db2.gz AMUAZNIYVBTCJH-JTQLQIEISA-N 1 2 225.311 2.296 20 0 BEADLO CCCCc1[nH]cc(CN2CCC(=O)C[C@@H]2C)[nH+]1 ZINC001141068115 960861089 /nfs/dbraw/zinc/86/10/89/960861089.db2.gz YULLDXBGXIWNAU-NSHDSACASA-N 1 2 249.358 2.306 20 0 BEADLO CCCCc1[nH]c(CN2CCC(=O)C[C@@H]2C)c[nH+]1 ZINC001141068115 960861074 /nfs/dbraw/zinc/86/10/74/960861074.db2.gz YULLDXBGXIWNAU-NSHDSACASA-N 1 2 249.358 2.306 20 0 BEADLO FC(F)[C@H]1CCC[N@H+](Cc2cocn2)C1 ZINC001141129953 960877047 /nfs/dbraw/zinc/87/70/47/960877047.db2.gz YCWVLLFLNIXQIN-QMMMGPOBSA-N 1 2 216.231 2.152 20 0 BEADLO FC(F)[C@H]1CCC[N@@H+](Cc2cocn2)C1 ZINC001141129953 960877049 /nfs/dbraw/zinc/87/70/49/960877049.db2.gz YCWVLLFLNIXQIN-QMMMGPOBSA-N 1 2 216.231 2.152 20 0 BEADLO C[N@@H+](Cc1cocn1)C[C@@H]1Cc2ccccc2O1 ZINC001141131460 960882474 /nfs/dbraw/zinc/88/24/74/960882474.db2.gz FEZUJTZLXATXET-ZDUSSCGKSA-N 1 2 244.294 2.110 20 0 BEADLO C[N@H+](Cc1cocn1)C[C@@H]1Cc2ccccc2O1 ZINC001141131460 960882478 /nfs/dbraw/zinc/88/24/78/960882478.db2.gz FEZUJTZLXATXET-ZDUSSCGKSA-N 1 2 244.294 2.110 20 0 BEADLO CC[N@H+](Cc1ccc(C)cc1F)C1COC1 ZINC001141195779 960918857 /nfs/dbraw/zinc/91/88/57/960918857.db2.gz DAVHZLXHGRTLIR-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO CC[N@@H+](Cc1ccc(C)cc1F)C1COC1 ZINC001141195779 960918896 /nfs/dbraw/zinc/91/88/96/960918896.db2.gz DAVHZLXHGRTLIR-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ncc(C[N@@H+]2CCCC[C@@H](F)C2)cn1 ZINC001203102614 960936011 /nfs/dbraw/zinc/93/60/11/960936011.db2.gz IDLITZZLNBFIAU-GFCCVEGCSA-N 1 2 223.295 2.109 20 0 BEADLO Cc1ncc(C[N@H+]2CCCC[C@@H](F)C2)cn1 ZINC001203102614 960936044 /nfs/dbraw/zinc/93/60/44/960936044.db2.gz IDLITZZLNBFIAU-GFCCVEGCSA-N 1 2 223.295 2.109 20 0 BEADLO CCc1ccccc1C[N@@H+]1CCO[C@@H](C(C)=O)C1 ZINC001141228282 960982290 /nfs/dbraw/zinc/98/22/90/960982290.db2.gz FEIXCNRJHLVDBW-OAHLLOKOSA-N 1 2 247.338 2.039 20 0 BEADLO CCc1ccccc1C[N@H+]1CCO[C@@H](C(C)=O)C1 ZINC001141228282 960982319 /nfs/dbraw/zinc/98/23/19/960982319.db2.gz FEIXCNRJHLVDBW-OAHLLOKOSA-N 1 2 247.338 2.039 20 0 BEADLO Cc1noc(C)c1Cc1ccc(N(C)C)[nH+]c1 ZINC001250066478 1169784687 /nfs/dbraw/zinc/78/46/87/1169784687.db2.gz APOZIPNRVICTPB-UHFFFAOYSA-N 1 2 231.299 2.343 20 0 BEADLO OCC1(Nc2ccn3cc[nH+]c3c2)CCCC1 ZINC001167805491 961072685 /nfs/dbraw/zinc/07/26/85/961072685.db2.gz ZXCNKHJABISJHH-UHFFFAOYSA-N 1 2 231.299 2.051 20 0 BEADLO Clc1ccc(C[N@@H+]2CCC[C@H]3C[C@H]32)nn1 ZINC001142076422 961241319 /nfs/dbraw/zinc/24/13/19/961241319.db2.gz HMMXGZTXXGVQQU-WCBMZHEXSA-N 1 2 223.707 2.114 20 0 BEADLO Clc1ccc(C[N@H+]2CCC[C@H]3C[C@H]32)nn1 ZINC001142076422 961241337 /nfs/dbraw/zinc/24/13/37/961241337.db2.gz HMMXGZTXXGVQQU-WCBMZHEXSA-N 1 2 223.707 2.114 20 0 BEADLO Cc1cc(NC=[NH2+])ncc1C(F)(F)F ZINC001167863890 961330442 /nfs/dbraw/zinc/33/04/42/961330442.db2.gz HLYTUWLZWBVXIE-UHFFFAOYSA-N 1 2 203.167 2.428 20 0 BEADLO CC(C)(C)c1nc[nH]c1C[N@@H+]1CC[C@@H](F)C1 ZINC001142213251 961354710 /nfs/dbraw/zinc/35/47/10/961354710.db2.gz RZWXOANTRGMQAQ-SECBINFHSA-N 1 2 225.311 2.251 20 0 BEADLO CC(C)(C)c1nc[nH]c1C[N@H+]1CC[C@@H](F)C1 ZINC001142213251 961354722 /nfs/dbraw/zinc/35/47/22/961354722.db2.gz RZWXOANTRGMQAQ-SECBINFHSA-N 1 2 225.311 2.251 20 0 BEADLO CC(C)(C)c1nc[nH]c1C[N@@H+]1CCCC12COC2 ZINC001142226399 961358476 /nfs/dbraw/zinc/35/84/76/961358476.db2.gz IOSUVAFFZTYKDH-UHFFFAOYSA-N 1 2 249.358 2.072 20 0 BEADLO CC(C)(C)c1nc[nH]c1C[N@H+]1CCCC12COC2 ZINC001142226399 961358488 /nfs/dbraw/zinc/35/84/88/961358488.db2.gz IOSUVAFFZTYKDH-UHFFFAOYSA-N 1 2 249.358 2.072 20 0 BEADLO CO[C@@H](C)CNc1cc(C(C)C)[nH+]c(C)n1 ZINC000709817936 961629911 /nfs/dbraw/zinc/62/99/11/961629911.db2.gz HJYQAJWJLQDWQM-VIFPVBQESA-N 1 2 223.320 2.355 20 0 BEADLO Cc1nc(N[C@H]2CCC[C@H]2CO)cc(C(C)C)[nH+]1 ZINC000709831451 961672756 /nfs/dbraw/zinc/67/27/56/961672756.db2.gz PNMHHTVOTWGTSJ-RYUDHWBXSA-N 1 2 249.358 2.481 20 0 BEADLO O[C@H]1C[N@H+](Cc2csc(Cl)c2)CC[C@H]1F ZINC001142760647 961710466 /nfs/dbraw/zinc/71/04/66/961710466.db2.gz ZQHZZSXMJWZMNJ-BDAKNGLRSA-N 1 2 249.738 2.306 20 0 BEADLO O[C@H]1C[N@@H+](Cc2csc(Cl)c2)CC[C@H]1F ZINC001142760647 961710486 /nfs/dbraw/zinc/71/04/86/961710486.db2.gz ZQHZZSXMJWZMNJ-BDAKNGLRSA-N 1 2 249.738 2.306 20 0 BEADLO Cc1nc(NCc2cccnn2)cc(C(C)C)[nH+]1 ZINC000709843625 961710728 /nfs/dbraw/zinc/71/07/28/961710728.db2.gz VKCPVFJQWPSVJL-UHFFFAOYSA-N 1 2 243.314 2.311 20 0 BEADLO COc1c(F)cc(F)cc1C[NH+]1CC(C)C1 ZINC001143551534 961818715 /nfs/dbraw/zinc/81/87/15/961818715.db2.gz BLERWLFPKJKROF-UHFFFAOYSA-N 1 2 227.254 2.425 20 0 BEADLO Cc1ccc(C[NH+]2CC(C)(CC(F)F)C2)nn1 ZINC000843424474 962006555 /nfs/dbraw/zinc/00/65/55/962006555.db2.gz BCAXHCGVPTYZET-UHFFFAOYSA-N 1 2 241.285 2.262 20 0 BEADLO CSCc1cc[nH+]c(NCC2COC2)c1 ZINC001154638439 962825128 /nfs/dbraw/zinc/82/51/28/962825128.db2.gz XYYCOKCOFKKWFQ-UHFFFAOYSA-N 1 2 224.329 2.003 20 0 BEADLO COc1c[nH+]c(NCc2cnoc2C)c(C)c1 ZINC001154883561 962879050 /nfs/dbraw/zinc/87/90/50/962879050.db2.gz AGSQLTCZDGCMKF-UHFFFAOYSA-N 1 2 233.271 2.307 20 0 BEADLO CC(C)(C)CNc1ccc(C2(C(N)=O)CC2)c[nH+]1 ZINC001161634769 962895499 /nfs/dbraw/zinc/89/54/99/962895499.db2.gz MGTKJJHANZYBNE-UHFFFAOYSA-N 1 2 247.342 2.057 20 0 BEADLO Cc1c(F)cc[nH+]c1N[C@@H](CO)CC(C)C ZINC001154959920 962923624 /nfs/dbraw/zinc/92/36/24/962923624.db2.gz BQAOIYYXGADFLT-SNVBAGLBSA-N 1 2 226.295 2.348 20 0 BEADLO CC(C)(C)C(=[NH2+])Nc1cc2c(nn1)CCC2 ZINC001155181648 963008258 /nfs/dbraw/zinc/00/82/58/963008258.db2.gz NRHKDTKZHNONLZ-UHFFFAOYSA-N 1 2 218.304 2.401 20 0 BEADLO CCOc1ccc[nH+]c1NCc1cccn1C ZINC001155213386 963027284 /nfs/dbraw/zinc/02/72/84/963027284.db2.gz WGRWNYVIMFBKEQ-UHFFFAOYSA-N 1 2 231.299 2.431 20 0 BEADLO Cc1c(F)cc[nH+]c1NCc1cccn1C ZINC001155212647 963028431 /nfs/dbraw/zinc/02/84/31/963028431.db2.gz QRVQGJGGPSXILP-UHFFFAOYSA-N 1 2 219.263 2.480 20 0 BEADLO Cc1cccc(CN2CCC(F)(F)[C@H]([NH3+])C2)c1 ZINC001206655343 963079912 /nfs/dbraw/zinc/07/99/12/963079912.db2.gz HKOSVVHMETXUMG-GFCCVEGCSA-N 1 2 240.297 2.163 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H]2C[C@H]2CC(C)C)c[nH+]1 ZINC001156538563 963383003 /nfs/dbraw/zinc/38/30/03/963383003.db2.gz WOCGDXFRLZKKIS-ZYHUDNBSSA-N 1 2 249.358 2.271 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H]2C[C@H]2CC(C)C)[nH+]1 ZINC001156538563 963383012 /nfs/dbraw/zinc/38/30/12/963383012.db2.gz WOCGDXFRLZKKIS-ZYHUDNBSSA-N 1 2 249.358 2.271 20 0 BEADLO Cc1ccnc(NCc2cc[nH+]c(N)c2)c1F ZINC001156757288 963453044 /nfs/dbraw/zinc/45/30/44/963453044.db2.gz QGAVXYJTRJSNHR-UHFFFAOYSA-N 1 2 232.262 2.118 20 0 BEADLO COc1ccc[nH+]c1NC1(C2CCOCC2)CC1 ZINC001156917816 963495846 /nfs/dbraw/zinc/49/58/46/963495846.db2.gz KNQQBGIZJDJVDX-UHFFFAOYSA-N 1 2 248.326 2.461 20 0 BEADLO Cc1cc[nH+]c(NCc2ccc(N)nc2C)c1 ZINC001156974609 963507052 /nfs/dbraw/zinc/50/70/52/963507052.db2.gz IHALELQDISVZJH-UHFFFAOYSA-N 1 2 228.299 2.288 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@H]2CCCC[C@@H]2C)[nH+]c1C ZINC000896910869 963521956 /nfs/dbraw/zinc/52/19/56/963521956.db2.gz ZUFIFXAYVGIWNV-CABZTGNLSA-N 1 2 249.358 2.469 20 0 BEADLO COc1cc2nc(NC=[NH2+])ccc2c(OC)c1 ZINC001157079827 963525149 /nfs/dbraw/zinc/52/51/49/963525149.db2.gz DBHNBZPUDQKUJA-UHFFFAOYSA-N 1 2 231.255 2.271 20 0 BEADLO COc1cc(C)c[nH+]c1N1CCC[C@@H]2C[C@@H]21 ZINC001157143403 963546363 /nfs/dbraw/zinc/54/63/63/963546363.db2.gz HTOZRAQMXFENTL-MNOVXSKESA-N 1 2 218.300 2.387 20 0 BEADLO CC(C)(CNc1cc[nH+]cc1F)c1ccncc1 ZINC000714257063 963637288 /nfs/dbraw/zinc/63/72/88/963637288.db2.gz NWFAOLOFDBGSKL-UHFFFAOYSA-N 1 2 245.301 2.427 20 0 BEADLO CCC1(Nc2cc(C)[nH+]c(C(C)C)n2)COC1 ZINC001157540158 963652508 /nfs/dbraw/zinc/65/25/08/963652508.db2.gz MFYXLWMRDUHUJI-UHFFFAOYSA-N 1 2 235.331 2.499 20 0 BEADLO COc1c[nH+]c(NCc2cnc(C)nc2)c(C)c1 ZINC001157603087 963674108 /nfs/dbraw/zinc/67/41/08/963674108.db2.gz QEVWKHPCBDRUPU-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO Cc1nc(N[C@@H](CO)C(C)(C)C)c2c([nH+]1)CCC2 ZINC001157758545 963718233 /nfs/dbraw/zinc/71/82/33/963718233.db2.gz HSOLNPJLGGSVAP-LBPRGKRZSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@@H]([NH2+]CC(C)(C)C(C)(F)F)C(=O)OC ZINC000697101818 963720683 /nfs/dbraw/zinc/72/06/83/963720683.db2.gz RLHGXHYDUYQLQJ-MRVPVSSYSA-N 1 2 237.290 2.209 20 0 BEADLO CCc1cc(C[N@H+](C)Cc2ccccn2)on1 ZINC001203212619 963749143 /nfs/dbraw/zinc/74/91/43/963749143.db2.gz POKYMCOGOKBLMC-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1cc(C[N@@H+](C)Cc2ccccn2)on1 ZINC001203212619 963749148 /nfs/dbraw/zinc/74/91/48/963749148.db2.gz POKYMCOGOKBLMC-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1cc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)on1 ZINC001203212674 963752469 /nfs/dbraw/zinc/75/24/69/963752469.db2.gz QJDOXSFSDRNWED-BXKDBHETSA-N 1 2 226.295 2.417 20 0 BEADLO CCc1cc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)on1 ZINC001203212674 963752472 /nfs/dbraw/zinc/75/24/72/963752472.db2.gz QJDOXSFSDRNWED-BXKDBHETSA-N 1 2 226.295 2.417 20 0 BEADLO CCCNc1ccc(-n2c[nH+]c(C)c2C)nn1 ZINC001168132503 963821020 /nfs/dbraw/zinc/82/10/20/963821020.db2.gz PTWMSZCEFLPHGI-UHFFFAOYSA-N 1 2 231.303 2.101 20 0 BEADLO Cc1cc(Cl)c(C)c(NCC2OCCO2)[nH+]1 ZINC001158197952 963829471 /nfs/dbraw/zinc/82/94/71/963829471.db2.gz FKPSEPXFQUROGG-UHFFFAOYSA-N 1 2 242.706 2.137 20 0 BEADLO Cc1ccccc1NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC000053898591 963844662 /nfs/dbraw/zinc/84/46/62/963844662.db2.gz UTYUBARPGXZDKU-LLVKDONJSA-N 1 2 229.283 2.391 20 0 BEADLO Cc1cc(N(C)[C@H]2CCOC2)nc(C(C)(C)C)[nH+]1 ZINC001158574427 963891331 /nfs/dbraw/zinc/89/13/31/963891331.db2.gz VGIQRXMWUSZHFR-NSHDSACASA-N 1 2 249.358 2.308 20 0 BEADLO Cc1c(F)cc[nH+]c1N[C@H]1CCCOC1 ZINC001158713392 963905845 /nfs/dbraw/zinc/90/58/45/963905845.db2.gz DQJWLAZKXGGMJW-VIFPVBQESA-N 1 2 210.252 2.120 20 0 BEADLO Cc1nc2c(o1)CCN(c1[nH+]ccc(F)c1C)C2 ZINC001158827608 963936790 /nfs/dbraw/zinc/93/67/90/963936790.db2.gz NECHNOPVEHTMST-UHFFFAOYSA-N 1 2 247.273 2.388 20 0 BEADLO CN(c1cc(N)nc[nH+]1)[C@H]1CCc2ccccc21 ZINC001158920004 963958457 /nfs/dbraw/zinc/95/84/57/963958457.db2.gz FBJBSHWABCVCHK-LBPRGKRZSA-N 1 2 240.310 2.183 20 0 BEADLO Cc1c(F)cc[nH+]c1N1C[C@@H]2C(=O)CCC[C@@H]2C1 ZINC001159002818 963971934 /nfs/dbraw/zinc/97/19/34/963971934.db2.gz YCQVFYPBYIYLMO-MNOVXSKESA-N 1 2 248.301 2.335 20 0 BEADLO Nc1cc(Nc2ccc3c(c2)CCCN3)[nH+]cn1 ZINC001159223881 964028698 /nfs/dbraw/zinc/02/86/98/964028698.db2.gz CHIBRVDZAAJDJA-UHFFFAOYSA-N 1 2 241.298 2.161 20 0 BEADLO CCOCC[N@H+](C)Cc1ncoc1C(C)C ZINC000093313303 964097639 /nfs/dbraw/zinc/09/76/39/964097639.db2.gz DDWHFHNTQQVFGP-UHFFFAOYSA-N 1 2 226.320 2.266 20 0 BEADLO CCOCC[N@@H+](C)Cc1ncoc1C(C)C ZINC000093313303 964097649 /nfs/dbraw/zinc/09/76/49/964097649.db2.gz DDWHFHNTQQVFGP-UHFFFAOYSA-N 1 2 226.320 2.266 20 0 BEADLO Cc1ccc(F)cc1-c1noc(C[NH+]2CCC2)n1 ZINC001212093145 964254910 /nfs/dbraw/zinc/25/49/10/964254910.db2.gz ILHDPVYQOCSMSM-UHFFFAOYSA-N 1 2 247.273 2.390 20 0 BEADLO Cc1cc(C[NH+]2CC(C)(CO)C2)cc(F)c1F ZINC001143597125 964311179 /nfs/dbraw/zinc/31/11/79/964311179.db2.gz KQROWILRGIDMFW-UHFFFAOYSA-N 1 2 241.281 2.087 20 0 BEADLO CNc1cc(N2CCC(F)(F)C[C@H]2C)nc[nH+]1 ZINC000697653676 964416909 /nfs/dbraw/zinc/41/69/09/964416909.db2.gz RDIWIYNDNAXXFP-MRVPVSSYSA-N 1 2 242.273 2.142 20 0 BEADLO CNc1cc(N2CCC(F)(F)C[C@H]2C)[nH+]cn1 ZINC000697653676 964416918 /nfs/dbraw/zinc/41/69/18/964416918.db2.gz RDIWIYNDNAXXFP-MRVPVSSYSA-N 1 2 242.273 2.142 20 0 BEADLO CCC1(CNc2ccn3cc[nH+]c3c2)COC1 ZINC001168327801 964459353 /nfs/dbraw/zinc/45/93/53/964459353.db2.gz VUHWMTNTOMLSLR-UHFFFAOYSA-N 1 2 231.299 2.173 20 0 BEADLO Cn1c[nH+]c2ccc(NC[C@H]3C[C@@](C)(O)C3)cc21 ZINC001168346655 964486899 /nfs/dbraw/zinc/48/68/99/964486899.db2.gz SFUZWYJDETXRGV-WJONMLJTSA-N 1 2 245.326 2.146 20 0 BEADLO c1cn(CCCNc2cccc3c2COC3)c[nH+]1 ZINC001161688655 964686748 /nfs/dbraw/zinc/68/67/48/964686748.db2.gz YODDMVOVTCUVIK-UHFFFAOYSA-N 1 2 243.310 2.416 20 0 BEADLO C[C@@H]1C[C@@H](Nc2ccc(Cl)c(N)[nH+]2)CCO1 ZINC001161695976 964695598 /nfs/dbraw/zinc/69/55/98/964695598.db2.gz JQVCVUJDDZETPP-SFYZADRCSA-N 1 2 241.722 2.297 20 0 BEADLO COc1c[nH+]c(NCCc2cnoc2)c(C)c1 ZINC001161699326 964695669 /nfs/dbraw/zinc/69/56/69/964695669.db2.gz SKGKFXWYGRPKJH-UHFFFAOYSA-N 1 2 233.271 2.041 20 0 BEADLO CSc1cc[nH+]c(NCCc2cnoc2)c1 ZINC001161702195 964699842 /nfs/dbraw/zinc/69/98/42/964699842.db2.gz OLGIHLWZNQAURC-UHFFFAOYSA-N 1 2 235.312 2.446 20 0 BEADLO O=C(Nc1ccsc1)[C@H]1CC2CC[NH+]1CC2 ZINC001142626145 964712038 /nfs/dbraw/zinc/71/20/38/964712038.db2.gz FSGZOJUZDOTNEQ-LLVKDONJSA-N 1 2 236.340 2.171 20 0 BEADLO CN(C)c1cc(Cl)[nH+]c(NCC(F)F)c1 ZINC001161809872 964764683 /nfs/dbraw/zinc/76/46/83/964764683.db2.gz QCCLYQFWVVWXCJ-UHFFFAOYSA-N 1 2 235.665 2.478 20 0 BEADLO CC(C)/C=C/C(=O)Nc1cccc2[nH+]ccn21 ZINC001142655236 964756240 /nfs/dbraw/zinc/75/62/40/964756240.db2.gz RNABIYADCQTRHC-VOTSOKGWSA-N 1 2 229.283 2.485 20 0 BEADLO C[Si](C)(C)c1ccc[nH+]c1NCC(F)F ZINC001161810099 964764643 /nfs/dbraw/zinc/76/46/43/964764643.db2.gz WZGSDUCTDXTEEX-UHFFFAOYSA-N 1 2 230.334 2.304 20 0 BEADLO COC(=[NH2+])c1cccc(NCc2cnn(C)c2)c1 ZINC001161855375 964793083 /nfs/dbraw/zinc/79/30/83/964793083.db2.gz CNENCUKEROGCIH-UHFFFAOYSA-N 1 2 244.298 2.004 20 0 BEADLO CC(C)Oc1cc(NCc2nccn2C)cc[nH+]1 ZINC001161915074 964813893 /nfs/dbraw/zinc/81/38/93/964813893.db2.gz DGRDRQQCABEBJZ-UHFFFAOYSA-N 1 2 246.314 2.214 20 0 BEADLO CCCNc1cc(NCC(C)(F)F)nc[nH+]1 ZINC000697992518 964852457 /nfs/dbraw/zinc/85/24/57/964852457.db2.gz NVRVLZDHFZFYPB-UHFFFAOYSA-N 1 2 230.262 2.366 20 0 BEADLO CCCNc1cc(NCC(C)(F)F)[nH+]cn1 ZINC000697992518 964852459 /nfs/dbraw/zinc/85/24/59/964852459.db2.gz NVRVLZDHFZFYPB-UHFFFAOYSA-N 1 2 230.262 2.366 20 0 BEADLO Cc1c[nH+]cc(NC[C@H](O)c2ccco2)c1C ZINC001162260702 964894784 /nfs/dbraw/zinc/89/47/84/964894784.db2.gz HYWSUALEBZPBKA-LBPRGKRZSA-N 1 2 232.283 2.437 20 0 BEADLO CC(C)C[C@H](CO)Nc1cc2cc[nH]c2c[nH+]1 ZINC001162365685 964943028 /nfs/dbraw/zinc/94/30/28/964943028.db2.gz XQWSPOUZEMXSOE-LLVKDONJSA-N 1 2 233.315 2.382 20 0 BEADLO COc1cc(C)c[nH+]c1N[C@H]1C[C@]12CCCOC2 ZINC001162379612 964949036 /nfs/dbraw/zinc/94/90/36/964949036.db2.gz ZAQHVJVDGAPWBB-JSGCOSHPSA-N 1 2 248.326 2.380 20 0 BEADLO C[N@@H+]1CCc2ncnc(NC(C)(C)C3CC3)c2C1 ZINC001162517149 965014359 /nfs/dbraw/zinc/01/43/59/965014359.db2.gz PHBXYDBGMNSENE-UHFFFAOYSA-N 1 2 246.358 2.065 20 0 BEADLO C[N@H+]1CCc2ncnc(NC(C)(C)C3CC3)c2C1 ZINC001162517149 965014368 /nfs/dbraw/zinc/01/43/68/965014368.db2.gz PHBXYDBGMNSENE-UHFFFAOYSA-N 1 2 246.358 2.065 20 0 BEADLO Cc1cc(N[C@H]2CCC[C@H]2CO)nc(C2CC2)[nH+]1 ZINC001162607889 965077121 /nfs/dbraw/zinc/07/71/21/965077121.db2.gz LCHOMXGITXVJCE-RYUDHWBXSA-N 1 2 247.342 2.235 20 0 BEADLO COc1cc[nH+]cc1Nc1ccncc1Cl ZINC001212146364 965078031 /nfs/dbraw/zinc/07/80/31/965078031.db2.gz FINJOYSZEAQDJA-UHFFFAOYSA-N 1 2 235.674 2.304 20 0 BEADLO COc1ccc[nH+]c1NCCOC1CCC1 ZINC000691012331 965088045 /nfs/dbraw/zinc/08/80/45/965088045.db2.gz TZCVKMXMASKLCY-UHFFFAOYSA-N 1 2 222.288 2.071 20 0 BEADLO C1=C[C@H]([NH2+][C@H]2CCCc3[nH]ncc32)CC1 ZINC000698203051 965097133 /nfs/dbraw/zinc/09/71/33/965097133.db2.gz DNMWTPQOGANDPC-ONGXEEELSA-N 1 2 203.289 2.095 20 0 BEADLO COc1cc[nH+]cc1NCc1c(C)nn(C)c1C ZINC001162883432 965203400 /nfs/dbraw/zinc/20/34/00/965203400.db2.gz DOUNWXBYMYZCAL-UHFFFAOYSA-N 1 2 246.314 2.053 20 0 BEADLO COC1CC(CNc2[nH+]ccc(F)c2C)C1 ZINC001162991618 965220043 /nfs/dbraw/zinc/22/00/43/965220043.db2.gz MZBIYDIYHATQKK-UHFFFAOYSA-N 1 2 224.279 2.366 20 0 BEADLO Cc1nc(N[C@@H](C)c2ccno2)c2c([nH+]1)CCC2 ZINC001163214477 965309740 /nfs/dbraw/zinc/30/97/40/965309740.db2.gz VGFMOCUJFASWGZ-QMMMGPOBSA-N 1 2 244.298 2.435 20 0 BEADLO Cc1cc(C)[nH+]c(CN(C)Cc2cc[nH]n2)c1 ZINC000929624572 965520201 /nfs/dbraw/zinc/52/02/01/965520201.db2.gz LWOSBWNCMYHRDH-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO CN(CC(F)(F)F)c1ccc(Cl)c(N)[nH+]1 ZINC001163709985 965530051 /nfs/dbraw/zinc/53/00/51/965530051.db2.gz ANEMPRIIRBFZFL-UHFFFAOYSA-N 1 2 239.628 2.316 20 0 BEADLO CSCCCNc1ccn2cc(N)[nH+]c2c1 ZINC001163874490 965613154 /nfs/dbraw/zinc/61/31/54/965613154.db2.gz DBSQWAHNNRBYER-UHFFFAOYSA-N 1 2 236.344 2.082 20 0 BEADLO COc1cc[nH+]cc1NCc1ccccc1N ZINC001163886031 965619888 /nfs/dbraw/zinc/61/98/88/965619888.db2.gz QHIVVGHWHXVUSO-UHFFFAOYSA-N 1 2 229.283 2.285 20 0 BEADLO Cc1nc(N2CC=CC2)cc(C(C)C)[nH+]1 ZINC001163915508 965623657 /nfs/dbraw/zinc/62/36/57/965623657.db2.gz DZLSFSSTQWGTLS-UHFFFAOYSA-N 1 2 203.289 2.285 20 0 BEADLO CO[C@@H]1CN(c2cc3ccccc3c[nH+]2)C[C@@H]1F ZINC001164125051 965747176 /nfs/dbraw/zinc/74/71/76/965747176.db2.gz NJQLQRHXXCUGCC-QWHCGFSZSA-N 1 2 246.285 2.408 20 0 BEADLO C[C@@]1(CO)CCN(c2cccc(C3CC3)[nH+]2)C1 ZINC001164148694 965759130 /nfs/dbraw/zinc/75/91/30/965759130.db2.gz QXYQMNQDBRQEMA-CQSZACIVSA-N 1 2 232.327 2.168 20 0 BEADLO CC(C)c1ccc(N2C[C@@H](C)C[C@H]2CO)[nH+]c1 ZINC001164152771 965764131 /nfs/dbraw/zinc/76/41/31/965764131.db2.gz RPPPAZMSXGJQDI-AAEUAGOBSA-N 1 2 234.343 2.412 20 0 BEADLO Cc1cc(N2C[C@@H](F)[C@H](F)C2)nc(C(C)C)[nH+]1 ZINC001164215104 965799633 /nfs/dbraw/zinc/79/96/33/965799633.db2.gz NWLANBVAEYRDMY-NXEZZACHSA-N 1 2 241.285 2.405 20 0 BEADLO Cc1cc(NCC2(CO)CCC2)c[nH+]c1C ZINC001164363990 965862817 /nfs/dbraw/zinc/86/28/17/965862817.db2.gz YDCIBJVFJRLTCD-UHFFFAOYSA-N 1 2 220.316 2.273 20 0 BEADLO Cn1c[nH+]c2ccc(NCCn3cccc3)cc21 ZINC001164452595 965889070 /nfs/dbraw/zinc/88/90/70/965889070.db2.gz UQJUOGAUSRTQCS-UHFFFAOYSA-N 1 2 240.310 2.487 20 0 BEADLO C[C@@]1(CF)CC(F)(F)CN1c1ccc(N)c[nH+]1 ZINC001164557428 965915564 /nfs/dbraw/zinc/91/55/64/965915564.db2.gz GDCQUPPSEFUIKF-JTQLQIEISA-N 1 2 245.248 2.237 20 0 BEADLO Cc1cn2c(cccc2Nc2cnoc2)[nH+]1 ZINC001203226722 965988084 /nfs/dbraw/zinc/98/80/84/965988084.db2.gz KVCCTNUQTXXSSE-UHFFFAOYSA-N 1 2 214.228 2.374 20 0 BEADLO CNc1ccc(Nc2nonc2C2CC2)c[nH+]1 ZINC001203453136 966055239 /nfs/dbraw/zinc/05/52/39/966055239.db2.gz WQODXYKTXCGVDN-UHFFFAOYSA-N 1 2 231.259 2.127 20 0 BEADLO Cc1cc(N2C[C@@H]3C[C@@H]3[C@H](F)C2)nc(C2CC2)[nH+]1 ZINC001165366589 966065470 /nfs/dbraw/zinc/06/54/70/966065470.db2.gz VLBRYKLPKDWPST-SDDRHHMPSA-N 1 2 247.317 2.457 20 0 BEADLO Cc1cc(N[C@@H](C)CCO)[nH+]c2cc[nH]c21 ZINC001165965630 966214617 /nfs/dbraw/zinc/21/46/17/966214617.db2.gz DGJHOZLNHISYHX-VIFPVBQESA-N 1 2 219.288 2.054 20 0 BEADLO COCC(C)(C)Nc1[nH+]cc(OC)c2cc[nH]c21 ZINC001165983518 966225005 /nfs/dbraw/zinc/22/50/05/966225005.db2.gz FKHPUAPGFVURBL-UHFFFAOYSA-N 1 2 249.314 2.408 20 0 BEADLO Cc1c(F)cc[nH+]c1N1C[C@@H]2C[C@H]1C[C@H]2F ZINC001166530314 966286256 /nfs/dbraw/zinc/28/62/56/966286256.db2.gz OOPUIQILWPDMDI-ATZCPNFKSA-N 1 2 224.254 2.466 20 0 BEADLO CN(CC1COC1)c1[nH+]ccc2ccccc21 ZINC001166948462 966472451 /nfs/dbraw/zinc/47/24/51/966472451.db2.gz YKEZZSUSWOOJNI-UHFFFAOYSA-N 1 2 228.295 2.317 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCCC(=O)[C@H](C)C2)o1 ZINC001236590328 966474904 /nfs/dbraw/zinc/47/49/04/966474904.db2.gz ZZRXNCQGZVNPEW-SECBINFHSA-N 1 2 236.315 2.092 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCCC(=O)[C@H](C)C2)o1 ZINC001236590328 966474908 /nfs/dbraw/zinc/47/49/08/966474908.db2.gz ZZRXNCQGZVNPEW-SECBINFHSA-N 1 2 236.315 2.092 20 0 BEADLO Cc1cc(N(C)CC2COC2)nc(C(C)(C)C)[nH+]1 ZINC001166949531 966478386 /nfs/dbraw/zinc/47/83/86/966478386.db2.gz ZXZOUTCXQLVZGP-UHFFFAOYSA-N 1 2 249.358 2.165 20 0 BEADLO CSc1cc[nH+]c(N2C[C@H](C)O[C@@H](C)C2)c1 ZINC001166969142 966494103 /nfs/dbraw/zinc/49/41/03/966494103.db2.gz HOLQBJQLIRSUBB-UWVGGRQHSA-N 1 2 238.356 2.417 20 0 BEADLO CC[C@H](c1ccccc1)[N@H+](C)Cc1cnn[nH]1 ZINC001203206610 966550330 /nfs/dbraw/zinc/55/03/30/966550330.db2.gz CJXQYLCSGYEOFO-CYBMUJFWSA-N 1 2 230.315 2.388 20 0 BEADLO CC[C@H](c1ccccc1)[N@@H+](C)Cc1cnn[nH]1 ZINC001203206610 966550342 /nfs/dbraw/zinc/55/03/42/966550342.db2.gz CJXQYLCSGYEOFO-CYBMUJFWSA-N 1 2 230.315 2.388 20 0 BEADLO c1nn[nH]c1C[N@@H+]1CCC[C@H]1c1ccccc1 ZINC001203206397 966555760 /nfs/dbraw/zinc/55/57/60/966555760.db2.gz YJPDQJOJFFCNPE-ZDUSSCGKSA-N 1 2 228.299 2.142 20 0 BEADLO c1nn[nH]c1C[N@H+]1CCC[C@H]1c1ccccc1 ZINC001203206397 966555771 /nfs/dbraw/zinc/55/57/71/966555771.db2.gz YJPDQJOJFFCNPE-ZDUSSCGKSA-N 1 2 228.299 2.142 20 0 BEADLO c1[nH]nnc1C[N@@H+]1CCC[C@H]1c1ccccc1 ZINC001203206397 966555783 /nfs/dbraw/zinc/55/57/83/966555783.db2.gz YJPDQJOJFFCNPE-ZDUSSCGKSA-N 1 2 228.299 2.142 20 0 BEADLO c1[nH]nnc1C[N@H+]1CCC[C@H]1c1ccccc1 ZINC001203206397 966555790 /nfs/dbraw/zinc/55/57/90/966555790.db2.gz YJPDQJOJFFCNPE-ZDUSSCGKSA-N 1 2 228.299 2.142 20 0 BEADLO c1coc(C[N@@H+]2CCCCC23COC3)c1 ZINC001203278302 966599817 /nfs/dbraw/zinc/59/98/17/966599817.db2.gz KJEXEXDHVJXOEO-UHFFFAOYSA-N 1 2 207.273 2.035 20 0 BEADLO c1coc(C[N@H+]2CCCCC23COC3)c1 ZINC001203278302 966599824 /nfs/dbraw/zinc/59/98/24/966599824.db2.gz KJEXEXDHVJXOEO-UHFFFAOYSA-N 1 2 207.273 2.035 20 0 BEADLO COc1nccc(Nc2ccc(C)[nH+]c2C)n1 ZINC001203363330 966608663 /nfs/dbraw/zinc/60/86/63/966608663.db2.gz PNPAIDAGAWGEIV-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO CNc1ccc(Nc2nnc(C(C)C)o2)c[nH+]1 ZINC001203447809 966646670 /nfs/dbraw/zinc/64/66/70/966646670.db2.gz PYROIEANEIPEFM-UHFFFAOYSA-N 1 2 233.275 2.373 20 0 BEADLO CNc1ccc(Nc2onc(C)c2C)c[nH+]1 ZINC001203447270 966647461 /nfs/dbraw/zinc/64/74/61/966647461.db2.gz LCUFCPZANWBENB-UHFFFAOYSA-N 1 2 218.260 2.472 20 0 BEADLO CNc1ccc(Nc2ncccc2N(C)C)c[nH+]1 ZINC001203452186 966654087 /nfs/dbraw/zinc/65/40/87/966654087.db2.gz HPQDWRHGIBQYTA-UHFFFAOYSA-N 1 2 243.314 2.328 20 0 BEADLO CNc1ccc(Nc2cc(N)ccc2O)c[nH+]1 ZINC001203457984 966657169 /nfs/dbraw/zinc/65/71/69/966657169.db2.gz FYGUSSGXJNKILO-UHFFFAOYSA-N 1 2 230.271 2.155 20 0 BEADLO COc1ncc(Nc2ccc(C)[nH+]c2C)cc1N ZINC001203497073 966660968 /nfs/dbraw/zinc/66/09/68/966660968.db2.gz MGTXZSCTZFAUGP-UHFFFAOYSA-N 1 2 244.298 2.428 20 0 BEADLO COCCn1nccc1Nc1cc(C)c[nH+]c1C ZINC001203657098 966720390 /nfs/dbraw/zinc/72/03/90/966720390.db2.gz JBKQCOSDMXRUNZ-UHFFFAOYSA-N 1 2 246.314 2.285 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2ncccc2CCO)c1 ZINC001203661568 966729701 /nfs/dbraw/zinc/72/97/01/966729701.db2.gz WXEZFQABVHOIRI-UHFFFAOYSA-N 1 2 243.310 2.372 20 0 BEADLO COc1ccc(C[NH+]2CCC(=O)CC2)c(C)c1C ZINC001203715832 966742424 /nfs/dbraw/zinc/74/24/24/966742424.db2.gz JASILEZFIYTDBZ-UHFFFAOYSA-N 1 2 247.338 2.477 20 0 BEADLO COc1cc(C)c(C[N@@H+]2CCO[C@@H]3C[C@@H]32)cc1C ZINC001203759090 966775611 /nfs/dbraw/zinc/77/56/11/966775611.db2.gz VVXBETREIIVCTJ-DZGCQCFKSA-N 1 2 247.338 2.285 20 0 BEADLO COc1cc(C)c(C[N@H+]2CCO[C@@H]3C[C@@H]32)cc1C ZINC001203759090 966775619 /nfs/dbraw/zinc/77/56/19/966775619.db2.gz VVXBETREIIVCTJ-DZGCQCFKSA-N 1 2 247.338 2.285 20 0 BEADLO CCOc1cc(C)c(-c2ccc[nH+]c2N)cn1 ZINC001238976134 966810112 /nfs/dbraw/zinc/81/01/12/966810112.db2.gz TWHJGCDMHFJLED-UHFFFAOYSA-N 1 2 229.283 2.433 20 0 BEADLO CCCOC1C[NH+](Cc2cccs2)C1 ZINC001204015272 966854799 /nfs/dbraw/zinc/85/47/99/966854799.db2.gz OAIHIMZCRPWPTF-UHFFFAOYSA-N 1 2 211.330 2.359 20 0 BEADLO Cn1cc2c(n1)CC[N@@H+](Cc1ccsc1)C2 ZINC001204039256 966863155 /nfs/dbraw/zinc/86/31/55/966863155.db2.gz SAHQMOAUBCKTIN-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO Cn1cc2c(n1)CC[N@H+](Cc1ccsc1)C2 ZINC001204039256 966863157 /nfs/dbraw/zinc/86/31/57/966863157.db2.gz SAHQMOAUBCKTIN-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO O=C1CC[N@H+](Cc2cccnc2)[C@H]2CCCC[C@H]12 ZINC001204068675 966874463 /nfs/dbraw/zinc/87/44/63/966874463.db2.gz DXMDBRJWIXUZLV-KBPBESRZSA-N 1 2 244.338 2.415 20 0 BEADLO O=C1CC[N@@H+](Cc2cccnc2)[C@H]2CCCC[C@H]12 ZINC001204068675 966874468 /nfs/dbraw/zinc/87/44/68/966874468.db2.gz DXMDBRJWIXUZLV-KBPBESRZSA-N 1 2 244.338 2.415 20 0 BEADLO Cc1cccc(C[N@@H+]2CCc3ccncc3C2)n1 ZINC001204067626 966874716 /nfs/dbraw/zinc/87/47/16/966874716.db2.gz BIRVTJVEUHPMJW-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1cccc(C[N@H+]2CCc3ccncc3C2)n1 ZINC001204067626 966874719 /nfs/dbraw/zinc/87/47/19/966874719.db2.gz BIRVTJVEUHPMJW-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2cccnc2)C[C@@H]1F ZINC001204072695 966878584 /nfs/dbraw/zinc/87/85/84/966878584.db2.gz SGSCKOCXOVHTDX-RYUDHWBXSA-N 1 2 226.270 2.354 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2cccnc2)C[C@@H]1F ZINC001204072695 966878591 /nfs/dbraw/zinc/87/85/91/966878591.db2.gz SGSCKOCXOVHTDX-RYUDHWBXSA-N 1 2 226.270 2.354 20 0 BEADLO c1cc(C[N@@H+]2CCc3cccnc3C2)co1 ZINC001204243738 966943637 /nfs/dbraw/zinc/94/36/37/966943637.db2.gz GWEQTQZALNHJIB-UHFFFAOYSA-N 1 2 214.268 2.233 20 0 BEADLO c1cc(C[N@H+]2CCc3cccnc3C2)co1 ZINC001204243738 966943652 /nfs/dbraw/zinc/94/36/52/966943652.db2.gz GWEQTQZALNHJIB-UHFFFAOYSA-N 1 2 214.268 2.233 20 0 BEADLO c1ccc2nc(C[N@@H+]3C[C@@H]4C[C@H]3CO4)ccc2c1 ZINC001204502712 967010186 /nfs/dbraw/zinc/01/01/86/967010186.db2.gz IBZRXBRLKAJVCY-KBPBESRZSA-N 1 2 240.306 2.208 20 0 BEADLO c1ccc2nc(C[N@H+]3C[C@@H]4C[C@H]3CO4)ccc2c1 ZINC001204502712 967010197 /nfs/dbraw/zinc/01/01/97/967010197.db2.gz IBZRXBRLKAJVCY-KBPBESRZSA-N 1 2 240.306 2.208 20 0 BEADLO Nc1[nH+]cccc1Nc1ccc[nH]c1=S ZINC001212393446 967018011 /nfs/dbraw/zinc/01/80/11/967018011.db2.gz FOJWMDAAIZEASU-UHFFFAOYSA-N 1 2 218.285 2.091 20 0 BEADLO Cc1cc(C[N@H+]2CCC(=O)[C@@H](F)CC2)oc1C ZINC001204537982 967032502 /nfs/dbraw/zinc/03/25/02/967032502.db2.gz WFRSWLLXLLFHGY-LBPRGKRZSA-N 1 2 239.290 2.399 20 0 BEADLO C[C@H]1C[C@@H](CF)[N@H+](Cc2nccs2)C1 ZINC001204545098 967038979 /nfs/dbraw/zinc/03/89/79/967038979.db2.gz NQFXBBULKUQZLC-IUCAKERBSA-N 1 2 214.309 2.323 20 0 BEADLO C[C@H]1C[C@@H](CF)[N@@H+](Cc2nccs2)C1 ZINC001204545098 967038994 /nfs/dbraw/zinc/03/89/94/967038994.db2.gz NQFXBBULKUQZLC-IUCAKERBSA-N 1 2 214.309 2.323 20 0 BEADLO Cc1cc(C[N@@H+]2CCOCC23CC3)oc1C ZINC001204539523 967039042 /nfs/dbraw/zinc/03/90/42/967039042.db2.gz QGIQDGCABIESGF-UHFFFAOYSA-N 1 2 221.300 2.261 20 0 BEADLO Cc1cc(C[N@H+]2CCOCC23CC3)oc1C ZINC001204539523 967039053 /nfs/dbraw/zinc/03/90/53/967039053.db2.gz QGIQDGCABIESGF-UHFFFAOYSA-N 1 2 221.300 2.261 20 0 BEADLO Nc1ncc(Nc2cccn3cc[nH+]c23)cc1F ZINC001249756177 967043642 /nfs/dbraw/zinc/04/36/42/967043642.db2.gz WSPHHCJXOQKLDZ-UHFFFAOYSA-N 1 2 243.245 2.194 20 0 BEADLO Cc1[nH+]c[nH]c1CN1CCCC(F)(F)[C@H](F)C1 ZINC001204587998 967084400 /nfs/dbraw/zinc/08/44/00/967084400.db2.gz RFYQLAUUWDVBGG-SNVBAGLBSA-N 1 2 247.264 2.287 20 0 BEADLO Cc1[nH+]c[nH]c1CN(C)CC(=O)c1ccccc1 ZINC001204591702 967087485 /nfs/dbraw/zinc/08/74/85/967087485.db2.gz HCWBGSDKLAOUHQ-UHFFFAOYSA-N 1 2 243.310 2.033 20 0 BEADLO Cc1ccc(C(=O)COC2C[NH+](C(C)C)C2)cc1 ZINC001204824309 967181393 /nfs/dbraw/zinc/18/13/93/967181393.db2.gz FTOQAPBTQCLTST-UHFFFAOYSA-N 1 2 247.338 2.287 20 0 BEADLO O=c1cc(Nc2ccn3cc[nH+]c3c2)cc[nH]1 ZINC001204950657 967248728 /nfs/dbraw/zinc/24/87/28/967248728.db2.gz DAAISSQXEMYCOC-UHFFFAOYSA-N 1 2 226.239 2.179 20 0 BEADLO Cc1cc(O)cnc1Nc1ccn2cc[nH+]c2c1 ZINC001204951711 967250714 /nfs/dbraw/zinc/25/07/14/967250714.db2.gz XNLRJJQRTZCQRA-UHFFFAOYSA-N 1 2 240.266 2.487 20 0 BEADLO CCc1nnc(Nc2ccn3cc[nH+]c3c2)s1 ZINC001204950953 967251830 /nfs/dbraw/zinc/25/18/30/967251830.db2.gz JFIFQKBFPCZCPX-UHFFFAOYSA-N 1 2 245.311 2.492 20 0 BEADLO Nc1cncc(Nc2ccn3cc[nH+]c3c2)c1 ZINC001204959678 967262637 /nfs/dbraw/zinc/26/26/37/967262637.db2.gz TZPOUMRUVZCWPZ-UHFFFAOYSA-N 1 2 225.255 2.055 20 0 BEADLO Cc1ncc(Nc2ccn3cc[nH+]c3c2)c(C)n1 ZINC001204966824 967265761 /nfs/dbraw/zinc/26/57/61/967265761.db2.gz YWOUBNYVKJUWDG-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cc1c(Nc2ccn3cc[nH+]c3c2)ncn1C ZINC001204966836 967267524 /nfs/dbraw/zinc/26/75/24/967267524.db2.gz ZKHWGWQHDIXKSN-UHFFFAOYSA-N 1 2 227.271 2.120 20 0 BEADLO COCc1ccccc1-c1ccc(N)[nH+]c1 ZINC001239952979 967268971 /nfs/dbraw/zinc/26/89/71/967268971.db2.gz VNEOYDGQZLXFSE-UHFFFAOYSA-N 1 2 214.268 2.477 20 0 BEADLO CNc1ccc(Nc2cc(C)no2)c[nH+]1 ZINC001203447708 967270468 /nfs/dbraw/zinc/27/04/68/967270468.db2.gz NYLLJUOOFQQGIK-UHFFFAOYSA-N 1 2 204.233 2.163 20 0 BEADLO C[C@H](Nc1cc2c(c[nH+]1)OCC(=O)N2)C(C)(C)C ZINC001168682432 967307691 /nfs/dbraw/zinc/30/76/91/967307691.db2.gz PZAOUTJDMZOKQP-QMMMGPOBSA-N 1 2 249.314 2.259 20 0 BEADLO c1cn2ccc(C[C@H]3CCCO3)cc2[nH+]1 ZINC001250104499 967379908 /nfs/dbraw/zinc/37/99/08/967379908.db2.gz UFEFDKNOQUBHAJ-LLVKDONJSA-N 1 2 202.257 2.056 20 0 BEADLO CCc1cncnc1-c1ccc2[nH+]ccn2c1 ZINC001240214585 967425237 /nfs/dbraw/zinc/42/52/37/967425237.db2.gz NYALWJSTYKZVJY-UHFFFAOYSA-N 1 2 224.267 2.354 20 0 BEADLO c1cn2cc(Cc3cccnc3)ccc2[nH+]1 ZINC001250168419 967466826 /nfs/dbraw/zinc/46/68/26/967466826.db2.gz UETXXSAGJAWJID-UHFFFAOYSA-N 1 2 209.252 2.320 20 0 BEADLO CC1(C)OC[C@H](Cc2ccn3cc[nH+]c3c2)O1 ZINC001250184212 967485380 /nfs/dbraw/zinc/48/53/80/967485380.db2.gz DJPIFOSCHRQTLY-NSHDSACASA-N 1 2 232.283 2.028 20 0 BEADLO CCn1nccc1-n1c(C)[nH+]c2ccc(N)cc21 ZINC001205301196 967498646 /nfs/dbraw/zinc/49/86/46/967498646.db2.gz FNNREVHIEUEAJW-UHFFFAOYSA-N 1 2 241.298 2.133 20 0 BEADLO OCc1cc(-c2c[nH+]c3c(c2)CCCN3)cs1 ZINC001205322727 967530419 /nfs/dbraw/zinc/53/04/19/967530419.db2.gz CBNGBYIWWSBTGK-UHFFFAOYSA-N 1 2 246.335 2.303 20 0 BEADLO c1nc2ccc(CC[NH+]3CCOCC3)cc2s1 ZINC001250275840 967598236 /nfs/dbraw/zinc/59/82/36/967598236.db2.gz QJAWMMDPTQMSJI-UHFFFAOYSA-N 1 2 248.351 2.171 20 0 BEADLO Fc1cc(CC[NH+]2CCOCC2)ccc1Cl ZINC001250275403 967598781 /nfs/dbraw/zinc/59/87/81/967598781.db2.gz IIQYYUWPJRNJIR-UHFFFAOYSA-N 1 2 243.709 2.354 20 0 BEADLO CSc1ccccc1CC[NH+]1CCOCC1 ZINC001250277500 967608434 /nfs/dbraw/zinc/60/84/34/967608434.db2.gz IBXXYNWOESLDBY-UHFFFAOYSA-N 1 2 237.368 2.283 20 0 BEADLO CCn1cc(C[NH+]2CC3(C2)CC(F)(F)C3)cn1 ZINC001205514246 967663582 /nfs/dbraw/zinc/66/35/82/967663582.db2.gz ZSYGQVJRIPUVAW-UHFFFAOYSA-N 1 2 241.285 2.134 20 0 BEADLO COCc1ccc(CCn2cc[nH+]c2)cc1 ZINC001250316107 967677507 /nfs/dbraw/zinc/67/75/07/967677507.db2.gz AZJIXIXEEZZELB-UHFFFAOYSA-N 1 2 216.284 2.272 20 0 BEADLO c1cn(CCc2ccc3c[nH]nc3c2)c[nH+]1 ZINC001250315813 967678740 /nfs/dbraw/zinc/67/87/40/967678740.db2.gz RQNLKBYSNNOJKF-UHFFFAOYSA-N 1 2 212.256 2.002 20 0 BEADLO CC(C)CCn1cc(CCn2cc[nH+]c2)cn1 ZINC001250315106 967680664 /nfs/dbraw/zinc/68/06/64/967680664.db2.gz FNNJRWMEBWZAAA-UHFFFAOYSA-N 1 2 232.331 2.368 20 0 BEADLO COc1cccc(CCn2cc[nH+]c2)c1F ZINC001250315886 967682580 /nfs/dbraw/zinc/68/25/80/967682580.db2.gz WBUQUCUYVPYJOS-UHFFFAOYSA-N 1 2 220.247 2.274 20 0 BEADLO COc1ccc(F)c(CCn2cc[nH+]c2)c1F ZINC001250316625 967685350 /nfs/dbraw/zinc/68/53/50/967685350.db2.gz PRWFSUGMXSGLSH-UHFFFAOYSA-N 1 2 238.237 2.413 20 0 BEADLO O=c1[nH]ccc2ccc(CCn3cc[nH+]c3)cc21 ZINC001250318627 967687003 /nfs/dbraw/zinc/68/70/03/967687003.db2.gz HHOWESBNPCZRGA-UHFFFAOYSA-N 1 2 239.278 2.380 20 0 BEADLO COc1nccc(CCn2cc[nH+]c2)c1Cl ZINC001250318318 967688383 /nfs/dbraw/zinc/68/83/83/967688383.db2.gz BPVKTTBJMIZWDK-UHFFFAOYSA-N 1 2 237.690 2.183 20 0 BEADLO Cn1ccc2cc(CCn3cc[nH+]c3)cnc21 ZINC001250316547 967691561 /nfs/dbraw/zinc/69/15/61/967691561.db2.gz MDKLWPDAUCFMQK-UHFFFAOYSA-N 1 2 226.283 2.013 20 0 BEADLO C[C@@H](O)c1cccc(CCn2cc[nH+]c2)c1 ZINC001250318918 967692846 /nfs/dbraw/zinc/69/28/46/967692846.db2.gz MGGQASHTJAVBBM-LLVKDONJSA-N 1 2 216.284 2.179 20 0 BEADLO CC(C)Oc1cnc(F)c(CCn2cc[nH+]c2)c1 ZINC001250319421 967693037 /nfs/dbraw/zinc/69/30/37/967693037.db2.gz DDNVOALPSDCEBI-UHFFFAOYSA-N 1 2 249.289 2.447 20 0 BEADLO CCOc1ncc(CCn2cc[nH+]c2)cc1C ZINC001250319307 967694708 /nfs/dbraw/zinc/69/47/08/967694708.db2.gz BTJNQLSZBDYDDY-UHFFFAOYSA-N 1 2 231.299 2.228 20 0 BEADLO COc1cc(C)cc(CCn2cc[nH+]c2)c1 ZINC001250318941 967695304 /nfs/dbraw/zinc/69/53/04/967695304.db2.gz NNZWUJNBPHAHFM-UHFFFAOYSA-N 1 2 216.284 2.443 20 0 BEADLO CO[C@H]1CC=C(CCn2cc[nH+]c2)CC1 ZINC001250320228 967696068 /nfs/dbraw/zinc/69/60/68/967696068.db2.gz ZUHHDOZNZRACFB-LBPRGKRZSA-N 1 2 206.289 2.399 20 0 BEADLO COCc1cc(OC)ccc1CCn1cc[nH+]c1 ZINC001250320307 967696455 /nfs/dbraw/zinc/69/64/55/967696455.db2.gz KIWGTTNSLDNVRY-UHFFFAOYSA-N 1 2 246.310 2.281 20 0 BEADLO O=c1ccc2c(CCn3cc[nH+]c3)cccc2[nH]1 ZINC001250319918 967697855 /nfs/dbraw/zinc/69/78/55/967697855.db2.gz GNWIYYHBUKBGBC-UHFFFAOYSA-N 1 2 239.278 2.380 20 0 BEADLO COc1cccc(CCn2cc[nH+]c2)c1C ZINC001250320421 967697945 /nfs/dbraw/zinc/69/79/45/967697945.db2.gz LAMJMVNEJRQTQZ-UHFFFAOYSA-N 1 2 216.284 2.443 20 0 BEADLO Cc1ccc(O)cc1CCn1cc[nH+]c1 ZINC001250319915 967697976 /nfs/dbraw/zinc/69/79/76/967697976.db2.gz GNCRGFKHUKTRKT-UHFFFAOYSA-N 1 2 202.257 2.140 20 0 BEADLO Cc1c(O)cccc1CCn1cc[nH+]c1 ZINC001250320987 967699559 /nfs/dbraw/zinc/69/95/59/967699559.db2.gz UZFWKTLJOCCFMG-UHFFFAOYSA-N 1 2 202.257 2.140 20 0 BEADLO Cc1ccc(F)c(C[N@@H+]2C[C@@H]3C[C@H]2CO3)c1 ZINC001205646991 967744144 /nfs/dbraw/zinc/74/41/44/967744144.db2.gz ADKSKLPZYTXIGP-RYUDHWBXSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1ccc(F)c(C[N@H+]2C[C@@H]3C[C@H]2CO3)c1 ZINC001205646991 967744152 /nfs/dbraw/zinc/74/41/52/967744152.db2.gz ADKSKLPZYTXIGP-RYUDHWBXSA-N 1 2 221.275 2.107 20 0 BEADLO CC[N@H+](Cc1cc(C)ccc1F)C1CN(C)C1 ZINC001205661976 967751184 /nfs/dbraw/zinc/75/11/84/967751184.db2.gz PKLCLHKWLSFYOK-UHFFFAOYSA-N 1 2 236.334 2.270 20 0 BEADLO CC[N@@H+](Cc1cc(C)ccc1F)C1CN(C)C1 ZINC001205661976 967751195 /nfs/dbraw/zinc/75/11/95/967751195.db2.gz PKLCLHKWLSFYOK-UHFFFAOYSA-N 1 2 236.334 2.270 20 0 BEADLO COc1ccc2c(c1)CC[N@@H+](Cc1cnoc1)C2 ZINC001205670904 967756514 /nfs/dbraw/zinc/75/65/14/967756514.db2.gz ZOIAWZSTULFQDJ-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1ccc2c(c1)CC[N@H+](Cc1cnoc1)C2 ZINC001205670904 967756516 /nfs/dbraw/zinc/75/65/16/967756516.db2.gz ZOIAWZSTULFQDJ-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cnoc2)cn1 ZINC001205731144 967806134 /nfs/dbraw/zinc/80/61/34/967806134.db2.gz DALDJXNHAMGWTH-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cnoc2)cn1 ZINC001205731144 967806137 /nfs/dbraw/zinc/80/61/37/967806137.db2.gz DALDJXNHAMGWTH-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO COc1cccc2c1CC[N@H+](Cc1cnoc1)C2 ZINC001205731944 967807009 /nfs/dbraw/zinc/80/70/09/967807009.db2.gz MNPFGJKTCMGFGE-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1cccc2c1CC[N@@H+](Cc1cnoc1)C2 ZINC001205731944 967807011 /nfs/dbraw/zinc/80/70/11/967807011.db2.gz MNPFGJKTCMGFGE-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO CNc1cc(Cc2cccc(C)n2)cc[nH+]1 ZINC001250425985 967841135 /nfs/dbraw/zinc/84/11/35/967841135.db2.gz XXXCUHPHCXPQSR-UHFFFAOYSA-N 1 2 213.284 2.418 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@H](C)c2ccno2)[nH+]1 ZINC001163208800 968005875 /nfs/dbraw/zinc/00/58/75/968005875.db2.gz NJXKDLCMGGJGBE-SSDOTTSWSA-N 1 2 243.270 2.427 20 0 BEADLO Cc1ccc(-c2ccc3[nH+]ccn3c2)nn1 ZINC001250518335 968016036 /nfs/dbraw/zinc/01/60/36/968016036.db2.gz YDCYIMUVRFDNSP-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO C[NH+](C)Cc1nc2cc(F)cc(Cl)c2[nH]1 ZINC001250565858 968079158 /nfs/dbraw/zinc/07/91/58/968079158.db2.gz WSVXTOPQHVTBEH-UHFFFAOYSA-N 1 2 227.670 2.417 20 0 BEADLO Cc1cc(F)cc2[nH]c(C[NH+](C)C)nc21 ZINC001250565825 968079231 /nfs/dbraw/zinc/07/92/31/968079231.db2.gz UYFQYXIYLPTKJQ-UHFFFAOYSA-N 1 2 207.252 2.072 20 0 BEADLO C[C@@H](C(=O)N[C@H]1CC[C@@H](C)[C@H](C)C1)n1cc[nH+]c1 ZINC001320394351 1169916393 /nfs/dbraw/zinc/91/63/93/1169916393.db2.gz IUWBIGNDJGBQAD-NDBYEHHHSA-N 1 2 249.358 2.385 20 0 BEADLO Cc1ccc(NC[C@@H](O)C(F)(F)F)c(C)[nH+]1 ZINC001250956252 968219919 /nfs/dbraw/zinc/21/99/19/968219919.db2.gz XDZQTFYODWSMAS-SECBINFHSA-N 1 2 234.221 2.034 20 0 BEADLO Cc1c(F)cc[nH+]c1N1CC[C@]2(CCOC2)C1 ZINC001165253551 968274361 /nfs/dbraw/zinc/27/43/61/968274361.db2.gz IKKRPKDBKFDXBW-ZDUSSCGKSA-N 1 2 236.290 2.146 20 0 BEADLO C[C@@H](C(=O)N(C)[C@H]1CCC[C@@H](C)C1)n1cc[nH+]c1 ZINC001251283604 968277729 /nfs/dbraw/zinc/27/77/29/968277729.db2.gz IZMADZUWQYGCKH-AGIUHOORSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@@H](C(=O)N(C)[C@@H]1CCCC[C@H]1C)n1cc[nH+]c1 ZINC001251283772 968279809 /nfs/dbraw/zinc/27/98/09/968279809.db2.gz OCPCYRWPOKFAIP-FRRDWIJNSA-N 1 2 249.358 2.481 20 0 BEADLO O=c1[nH]cccc1Nc1cccc2[nH+]ccn21 ZINC001206417376 968289715 /nfs/dbraw/zinc/28/97/15/968289715.db2.gz TWOVUZXDLJCKOJ-UHFFFAOYSA-N 1 2 226.239 2.179 20 0 BEADLO CC[C@@H](O)CNc1ccc2ccc[nH+]c2c1 ZINC001251784263 968326920 /nfs/dbraw/zinc/32/69/20/968326920.db2.gz DPLGHDWIPFRWTJ-GFCCVEGCSA-N 1 2 216.284 2.418 20 0 BEADLO COc1ncccc1C[N@@H+]1CCCC[C@@H](F)C1 ZINC001206553827 968381025 /nfs/dbraw/zinc/38/10/25/968381025.db2.gz LBEVDOOIAMIBDJ-GFCCVEGCSA-N 1 2 238.306 2.414 20 0 BEADLO COc1ncccc1C[N@H+]1CCCC[C@@H](F)C1 ZINC001206553827 968381030 /nfs/dbraw/zinc/38/10/30/968381030.db2.gz LBEVDOOIAMIBDJ-GFCCVEGCSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cccnc1C[N@@H+]1CCCC[C@H](F)C1 ZINC001206610487 968415660 /nfs/dbraw/zinc/41/56/60/968415660.db2.gz HVYNRDQITJDOQV-NSHDSACASA-N 1 2 238.306 2.414 20 0 BEADLO COc1cccnc1C[N@H+]1CCCC[C@H](F)C1 ZINC001206610487 968415666 /nfs/dbraw/zinc/41/56/66/968415666.db2.gz HVYNRDQITJDOQV-NSHDSACASA-N 1 2 238.306 2.414 20 0 BEADLO O[C@@H](C[N@@H+]1Cc2cccnc2C1)c1ccccc1 ZINC001251976589 968416859 /nfs/dbraw/zinc/41/68/59/968416859.db2.gz BOWLOUFMQGVFNK-HNNXBMFYSA-N 1 2 240.306 2.131 20 0 BEADLO O[C@@H](C[N@H+]1Cc2cccnc2C1)c1ccccc1 ZINC001251976589 968416865 /nfs/dbraw/zinc/41/68/65/968416865.db2.gz BOWLOUFMQGVFNK-HNNXBMFYSA-N 1 2 240.306 2.131 20 0 BEADLO COc1cccnc1C[N@@H+]1CCC[C@@](C)(F)C1 ZINC001206611023 968419679 /nfs/dbraw/zinc/41/96/79/968419679.db2.gz QFAHFROPHLRIIJ-CYBMUJFWSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cccnc1C[N@H+]1CCC[C@@](C)(F)C1 ZINC001206611023 968419687 /nfs/dbraw/zinc/41/96/87/968419687.db2.gz QFAHFROPHLRIIJ-CYBMUJFWSA-N 1 2 238.306 2.414 20 0 BEADLO CCN(Cc1ccc(C)cc1OC)C1C[NH+](C)C1 ZINC001206783030 968469407 /nfs/dbraw/zinc/46/94/07/968469407.db2.gz MTDTUGPBDNJYIP-UHFFFAOYSA-N 1 2 248.370 2.140 20 0 BEADLO C[C@H](Nc1cc(N(C)C)nc[nH+]1)c1cncs1 ZINC001119982414 968491010 /nfs/dbraw/zinc/49/10/10/968491010.db2.gz FROKSRPTONAKCH-QMMMGPOBSA-N 1 2 249.343 2.172 20 0 BEADLO C[C@H](Nc1cc(N(C)C)[nH+]cn1)c1cncs1 ZINC001119982414 968491017 /nfs/dbraw/zinc/49/10/17/968491017.db2.gz FROKSRPTONAKCH-QMMMGPOBSA-N 1 2 249.343 2.172 20 0 BEADLO CCc1cc(N2CCC[C@H](OC)C2)nc(CC)[nH+]1 ZINC001120020445 968511832 /nfs/dbraw/zinc/51/18/32/968511832.db2.gz SCCFTUSVHDVFMI-LBPRGKRZSA-N 1 2 249.358 2.217 20 0 BEADLO Cc1ncsc1C[N@@H+]1CCc2cccnc2C1 ZINC001206991782 968527217 /nfs/dbraw/zinc/52/72/17/968527217.db2.gz NGLUZUNJCHQAQR-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ncsc1C[N@H+]1CCc2cccnc2C1 ZINC001206991782 968527218 /nfs/dbraw/zinc/52/72/18/968527218.db2.gz NGLUZUNJCHQAQR-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1nnc(C[NH2+]Cc2cnc(C)cc2C)s1 ZINC000698352365 968570161 /nfs/dbraw/zinc/57/01/61/968570161.db2.gz XHXZDYVZNDLJLI-UHFFFAOYSA-N 1 2 248.355 2.148 20 0 BEADLO F[C@H]1C[N@H+](Cc2ncc3ccccn32)C[C@@H]2C[C@@H]21 ZINC001207050966 968582262 /nfs/dbraw/zinc/58/22/62/968582262.db2.gz UCBRKORWBDDGDJ-DRZSPHRISA-N 1 2 245.301 2.124 20 0 BEADLO F[C@H]1C[N@@H+](Cc2ncc3ccccn32)C[C@@H]2C[C@@H]21 ZINC001207050966 968582269 /nfs/dbraw/zinc/58/22/69/968582269.db2.gz UCBRKORWBDDGDJ-DRZSPHRISA-N 1 2 245.301 2.124 20 0 BEADLO Cc1cnc(C[N@@H+]2CCCC[C@H](F)C2)cn1 ZINC001207071628 968607506 /nfs/dbraw/zinc/60/75/06/968607506.db2.gz DIJZGURCKXMLMS-NSHDSACASA-N 1 2 223.295 2.109 20 0 BEADLO Cc1cnc(C[N@H+]2CCCC[C@H](F)C2)cn1 ZINC001207071628 968607511 /nfs/dbraw/zinc/60/75/11/968607511.db2.gz DIJZGURCKXMLMS-NSHDSACASA-N 1 2 223.295 2.109 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCC(=O)[C@@H](C)CC1 ZINC001207133100 968648387 /nfs/dbraw/zinc/64/83/87/968648387.db2.gz HJQMHLRRNKHEFB-VIFPVBQESA-N 1 2 236.315 2.092 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCC(=O)[C@@H](C)CC1 ZINC001207133100 968648390 /nfs/dbraw/zinc/64/83/90/968648390.db2.gz HJQMHLRRNKHEFB-VIFPVBQESA-N 1 2 236.315 2.092 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCc2ccncc2C1 ZINC001207137686 968649187 /nfs/dbraw/zinc/64/91/87/968649187.db2.gz NQNJGJBAGLVOJL-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCc2ccncc2C1 ZINC001207137686 968649194 /nfs/dbraw/zinc/64/91/94/968649194.db2.gz NQNJGJBAGLVOJL-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1cncc(C[N@@H+]2CCC(=O)[C@@H](C)CC2)c1 ZINC001207155361 968665452 /nfs/dbraw/zinc/66/54/52/968665452.db2.gz QEKMIFGCOJBEDT-LBPRGKRZSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1cncc(C[N@H+]2CCC(=O)[C@@H](C)CC2)c1 ZINC001207155361 968665457 /nfs/dbraw/zinc/66/54/57/968665457.db2.gz QEKMIFGCOJBEDT-LBPRGKRZSA-N 1 2 232.327 2.191 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCCC(=O)[C@@H](C)C1 ZINC001207170820 968679998 /nfs/dbraw/zinc/67/99/98/968679998.db2.gz CNZVXVZVPIQLFR-LBPRGKRZSA-N 1 2 249.358 2.265 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCCC(=O)[C@@H](C)C1 ZINC001207170820 968680002 /nfs/dbraw/zinc/68/00/02/968680002.db2.gz CNZVXVZVPIQLFR-LBPRGKRZSA-N 1 2 249.358 2.265 20 0 BEADLO C=Cc1ccc(OCC[NH+]2CCOCC2)cc1 ZINC001240829999 968715897 /nfs/dbraw/zinc/71/58/97/968715897.db2.gz SIOVBKHVLJLVHH-UHFFFAOYSA-N 1 2 233.311 2.041 20 0 BEADLO FC1C[C@@H]2COC[C@H](C1)[N@@H+]2Cc1cccs1 ZINC001204015745 968813339 /nfs/dbraw/zinc/81/33/39/968813339.db2.gz LAODLGOSXOJQTH-FGWVZKOKSA-N 1 2 241.331 2.449 20 0 BEADLO FC1C[C@@H]2COC[C@H](C1)[N@H+]2Cc1cccs1 ZINC001204015745 968813344 /nfs/dbraw/zinc/81/33/44/968813344.db2.gz LAODLGOSXOJQTH-FGWVZKOKSA-N 1 2 241.331 2.449 20 0 BEADLO CCc1nnc(C[N@@H+]2CC(C)(C)C2(C)C)o1 ZINC001252637801 968889872 /nfs/dbraw/zinc/88/98/72/968889872.db2.gz GXSOUHBFKNSOFP-UHFFFAOYSA-N 1 2 223.320 2.252 20 0 BEADLO CCc1nnc(C[N@H+]2CC(C)(C)C2(C)C)o1 ZINC001252637801 968889878 /nfs/dbraw/zinc/88/98/78/968889878.db2.gz GXSOUHBFKNSOFP-UHFFFAOYSA-N 1 2 223.320 2.252 20 0 BEADLO Nc1cc(-c2ccc3ocnc3c2)cc[nH+]1 ZINC001241162388 968944724 /nfs/dbraw/zinc/94/47/24/968944724.db2.gz ICNWUVPJEDMEGO-UHFFFAOYSA-N 1 2 211.224 2.472 20 0 BEADLO CCOCc1cncc(-c2cc[nH+]c(N)c2)c1 ZINC001241175680 968945902 /nfs/dbraw/zinc/94/59/02/968945902.db2.gz JVCYJDOQEBPELC-UHFFFAOYSA-N 1 2 229.283 2.262 20 0 BEADLO Cc1cnc(CO[NH+]=C(N)c2ccccc2C)o1 ZINC000742348367 968948528 /nfs/dbraw/zinc/94/85/28/968948528.db2.gz CYVWQKOZJMLPQA-UHFFFAOYSA-N 1 2 245.282 2.338 20 0 BEADLO CS[C@@H](C)CC[N@@H+]1CCCC(=O)[C@@H](F)C1 ZINC001208138995 969057088 /nfs/dbraw/zinc/05/70/88/969057088.db2.gz OGSYBEMGBDJTIX-UWVGGRQHSA-N 1 2 233.352 2.131 20 0 BEADLO CS[C@@H](C)CC[N@H+]1CCCC(=O)[C@@H](F)C1 ZINC001208138995 969057095 /nfs/dbraw/zinc/05/70/95/969057095.db2.gz OGSYBEMGBDJTIX-UWVGGRQHSA-N 1 2 233.352 2.131 20 0 BEADLO Cc1[nH]c[nH+]c1NC[C@@H](O)c1ccc(F)cc1 ZINC001252838117 969032089 /nfs/dbraw/zinc/03/20/89/969032089.db2.gz IEEXYNXAVWRKAC-LLVKDONJSA-N 1 2 235.262 2.003 20 0 BEADLO CC/C=C\CCC[N@@H+]1Cc2cnn(C)c2C1 ZINC001208136321 969040084 /nfs/dbraw/zinc/04/00/84/969040084.db2.gz VFQXMINSFAOZKW-PLNGDYQASA-N 1 2 219.332 2.482 20 0 BEADLO CC/C=C\CCC[N@H+]1Cc2cnn(C)c2C1 ZINC001208136321 969040089 /nfs/dbraw/zinc/04/00/89/969040089.db2.gz VFQXMINSFAOZKW-PLNGDYQASA-N 1 2 219.332 2.482 20 0 BEADLO CCCNc1ccnc(-c2c[nH+]c(N)cc2C)n1 ZINC001242068977 969195368 /nfs/dbraw/zinc/19/53/68/969195368.db2.gz ZJWJRUDCFJRLBM-UHFFFAOYSA-N 1 2 243.314 2.251 20 0 BEADLO Fc1ccc(-c2ccnnc2)cc1-n1cc[nH+]c1 ZINC001242068809 969195947 /nfs/dbraw/zinc/19/59/47/969195947.db2.gz WJWNGBBODBESOA-UHFFFAOYSA-N 1 2 240.241 2.468 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1cnc(OC(C)C)cn1 ZINC001242072344 969196770 /nfs/dbraw/zinc/19/67/70/969196770.db2.gz JQNAQSWMSDBOHQ-UHFFFAOYSA-N 1 2 244.298 2.216 20 0 BEADLO C[C@@H](C[NH+]1CCC(=O)CC1)OCc1ccccc1 ZINC001208700231 969198400 /nfs/dbraw/zinc/19/84/00/969198400.db2.gz ITWACXKUEQHDGD-ZDUSSCGKSA-N 1 2 247.338 2.257 20 0 BEADLO CCCCC[C@@H](O)CNc1[nH+]cccc1O ZINC001253521533 969198437 /nfs/dbraw/zinc/19/84/37/969198437.db2.gz UPBGUDGJDFTNGZ-SNVBAGLBSA-N 1 2 224.304 2.140 20 0 BEADLO COc1cc2[nH+]c[nH]c2cc1C1=CCOCC1 ZINC001242075989 969200131 /nfs/dbraw/zinc/20/01/31/969200131.db2.gz SOXGODFKAHUSJC-UHFFFAOYSA-N 1 2 230.267 2.375 20 0 BEADLO Cc1cc(C2=CCOCC2)c2[nH+]ccn2c1 ZINC001242075949 969200631 /nfs/dbraw/zinc/20/06/31/969200631.db2.gz QHSLHEXCOMNDMY-UHFFFAOYSA-N 1 2 214.268 2.446 20 0 BEADLO CC1(C)OCC(Nc2cc3cc[nH]c3c[nH+]2)CO1 ZINC001168900636 969254535 /nfs/dbraw/zinc/25/45/35/969254535.db2.gz WUXFXALXTOPHMQ-UHFFFAOYSA-N 1 2 247.298 2.126 20 0 BEADLO F[C@@H]1C[N@H+](C[C@H]2CCC=CO2)CCC1(F)F ZINC001208876569 969267029 /nfs/dbraw/zinc/26/70/29/969267029.db2.gz KXCVWKQFLGFPIK-NXEZZACHSA-N 1 2 235.249 2.358 20 0 BEADLO F[C@@H]1C[N@@H+](C[C@H]2CCC=CO2)CCC1(F)F ZINC001208876569 969267038 /nfs/dbraw/zinc/26/70/38/969267038.db2.gz KXCVWKQFLGFPIK-NXEZZACHSA-N 1 2 235.249 2.358 20 0 BEADLO CC(C)OC1C[NH+](C[C@@H](C)C(F)(F)F)C1 ZINC001208890797 969279791 /nfs/dbraw/zinc/27/97/91/969279791.db2.gz HXZRRMXHVSNZRH-MRVPVSSYSA-N 1 2 225.254 2.294 20 0 BEADLO COCOCCC[N@@H+]1CCCCC(F)(F)C1 ZINC001209023972 969317898 /nfs/dbraw/zinc/31/78/98/969317898.db2.gz SNUPXHJNCSICCW-UHFFFAOYSA-N 1 2 237.290 2.118 20 0 BEADLO COCOCCC[N@H+]1CCCCC(F)(F)C1 ZINC001209023972 969317904 /nfs/dbraw/zinc/31/79/04/969317904.db2.gz SNUPXHJNCSICCW-UHFFFAOYSA-N 1 2 237.290 2.118 20 0 BEADLO CCOC(=O)CC[N@@H+]1Cc2ccc(F)cc2C1 ZINC001209037593 969329629 /nfs/dbraw/zinc/32/96/29/969329629.db2.gz UPFWJGGLMBEQIH-UHFFFAOYSA-N 1 2 237.274 2.095 20 0 BEADLO CCOC(=O)CC[N@H+]1Cc2ccc(F)cc2C1 ZINC001209037593 969329634 /nfs/dbraw/zinc/32/96/34/969329634.db2.gz UPFWJGGLMBEQIH-UHFFFAOYSA-N 1 2 237.274 2.095 20 0 BEADLO FC[C@@H]1C[C@H](F)C[N@@H+]1CCCc1ccncc1 ZINC001209185696 969376119 /nfs/dbraw/zinc/37/61/19/969376119.db2.gz WYPIUXWOYWFMEA-STQMWFEESA-N 1 2 240.297 2.396 20 0 BEADLO FC[C@@H]1C[C@H](F)C[N@H+]1CCCc1ccncc1 ZINC001209185696 969376127 /nfs/dbraw/zinc/37/61/27/969376127.db2.gz WYPIUXWOYWFMEA-STQMWFEESA-N 1 2 240.297 2.396 20 0 BEADLO c1ccc(OCC[NH+]2CC3(C2)CCCCO3)cc1 ZINC001209295977 969430645 /nfs/dbraw/zinc/43/06/45/969430645.db2.gz UFVNQPRUBAAAOQ-UHFFFAOYSA-N 1 2 247.338 2.320 20 0 BEADLO C1CC1c1nnc([C@@H]2CC3CC[NH+]2CC3)o1 ZINC001254037628 969453300 /nfs/dbraw/zinc/45/33/00/969453300.db2.gz MHUDJRKDQKAWOX-JTQLQIEISA-N 1 2 219.288 2.104 20 0 BEADLO CC[C@H](C)[C@H](Nc1ccc(C2CC2)c[nH+]1)C(N)=O ZINC001169156803 969476212 /nfs/dbraw/zinc/47/62/12/969476212.db2.gz OMLYEARSNGPJPI-ZANVPECISA-N 1 2 247.342 2.271 20 0 BEADLO COc1cc[nH+]cc1NCc1ncccc1OC ZINC001169207916 969484909 /nfs/dbraw/zinc/48/49/09/969484909.db2.gz ZCTIVRDLGUGINC-UHFFFAOYSA-N 1 2 245.282 2.106 20 0 BEADLO Cc1ccc2[nH]cc(C[N@@H+]3CCO[C@H]4C[C@H]43)c2c1 ZINC001209500731 969530336 /nfs/dbraw/zinc/53/03/36/969530336.db2.gz ZMBPCDRWTFVEKT-CABCVRRESA-N 1 2 242.322 2.449 20 0 BEADLO Cc1ccc2[nH]cc(C[N@H+]3CCO[C@H]4C[C@H]43)c2c1 ZINC001209500731 969530341 /nfs/dbraw/zinc/53/03/41/969530341.db2.gz ZMBPCDRWTFVEKT-CABCVRRESA-N 1 2 242.322 2.449 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC[C@@H]2CCC[C@@H]2C1 ZINC001209551848 969539097 /nfs/dbraw/zinc/53/90/97/969539097.db2.gz CETSMPNPCFCORN-NWDGAFQWSA-N 1 2 219.332 2.340 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC[C@@H]2CCC[C@@H]2C1 ZINC001209551848 969539100 /nfs/dbraw/zinc/53/91/00/969539100.db2.gz CETSMPNPCFCORN-NWDGAFQWSA-N 1 2 219.332 2.340 20 0 BEADLO COC(=O)C1([NH2+]C2CCC3(CC3)CC2)CC1 ZINC001254432518 969619746 /nfs/dbraw/zinc/61/97/46/969619746.db2.gz MEEPKGQYCLZJIX-UHFFFAOYSA-N 1 2 223.316 2.004 20 0 BEADLO Cc1nsc(Nc2ccc3[nH]c[nH+]c3c2)n1 ZINC001209841415 969654546 /nfs/dbraw/zinc/65/45/46/969654546.db2.gz NNNPBORRCWBPFL-UHFFFAOYSA-N 1 2 231.284 2.466 20 0 BEADLO CCc1ccc(C)[nH+]c1Nc1ccnnc1 ZINC001209956338 969697856 /nfs/dbraw/zinc/69/78/56/969697856.db2.gz VTQRYYYZUXQKHI-UHFFFAOYSA-N 1 2 214.272 2.486 20 0 BEADLO Cc1cc(C)[nH+]c(Nc2ccnnc2)c1 ZINC001209955151 969712322 /nfs/dbraw/zinc/71/23/22/969712322.db2.gz MRHQKUJVTYGJDE-UHFFFAOYSA-N 1 2 200.245 2.232 20 0 BEADLO CNc1ccc(N[C@H](C)c2cnccn2)c[nH+]1 ZINC001169533380 969727223 /nfs/dbraw/zinc/72/72/23/969727223.db2.gz MWZWFXIZBDYKDI-SECBINFHSA-N 1 2 229.287 2.086 20 0 BEADLO CC1(C)CCC(OCC[NH+]2CCOCC2)CC1 ZINC001210208454 969832451 /nfs/dbraw/zinc/83/24/51/969832451.db2.gz SOUZFGGEWBKKQC-UHFFFAOYSA-N 1 2 241.375 2.304 20 0 BEADLO C[C@H]1CCC[C@H](C)C1OCC[NH+]1CCOCC1 ZINC001210224753 969837754 /nfs/dbraw/zinc/83/77/54/969837754.db2.gz GNJJUVAAROANNU-STQMWFEESA-N 1 2 241.375 2.160 20 0 BEADLO Cc1ccc(Nc2[nH+]cccc2N)cc1CO ZINC001210244480 969839989 /nfs/dbraw/zinc/83/99/89/969839989.db2.gz CBSWMSFRGOIQCA-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO Cc1[nH+]cc(Nc2cc(C3CC3)nn2C)cc1N ZINC001210283748 969850988 /nfs/dbraw/zinc/85/09/88/969850988.db2.gz AVJIEZZWKLCVLB-UHFFFAOYSA-N 1 2 243.314 2.327 20 0 BEADLO Cc1csc(Nc2c[nH+]c(C)c(N)c2)n1 ZINC001210285291 969851605 /nfs/dbraw/zinc/85/16/05/969851605.db2.gz NJSDIWVTDLJPSJ-UHFFFAOYSA-N 1 2 220.301 2.481 20 0 BEADLO Cc1[nH+]cc(Nc2cc(F)nc(F)c2)cc1N ZINC001210286982 969853590 /nfs/dbraw/zinc/85/35/90/969853590.db2.gz HXAVYZZIWPZUPO-UHFFFAOYSA-N 1 2 236.225 2.389 20 0 BEADLO Cc1cccc(Nc2c[nH+]c(C)c(N)c2)n1 ZINC001210285776 969854857 /nfs/dbraw/zinc/85/48/57/969854857.db2.gz RIQBERFDWUNTNN-UHFFFAOYSA-N 1 2 214.272 2.419 20 0 BEADLO Cc1[nH+]cc(Nc2ccc3c(c2)OCO3)cc1N ZINC001210287889 969856614 /nfs/dbraw/zinc/85/66/14/969856614.db2.gz FSQDLCUKQJHMCZ-UHFFFAOYSA-N 1 2 243.266 2.445 20 0 BEADLO Cc1ccc(-c2noc([C@@H](C)n3cc[nH+]c3)n2)o1 ZINC000350790912 969859811 /nfs/dbraw/zinc/85/98/11/969859811.db2.gz DESZQLUEIROQPE-SECBINFHSA-N 1 2 244.254 2.444 20 0 BEADLO Cn1ccc(Nc2cc(Cl)c3[nH+]ccn3c2)n1 ZINC001210348177 969873557 /nfs/dbraw/zinc/87/35/57/969873557.db2.gz IXJFBMPOOCGYJZ-UHFFFAOYSA-N 1 2 247.689 2.465 20 0 BEADLO c1cn2ccc(NCCc3cncs3)cc2[nH+]1 ZINC001169863558 969874614 /nfs/dbraw/zinc/87/46/14/969874614.db2.gz MNZXAJLEYNCCAX-UHFFFAOYSA-N 1 2 244.323 2.445 20 0 BEADLO C[C@H](O)c1cccc(N(C)c2[nH+]cccc2N)c1 ZINC001210502441 969912022 /nfs/dbraw/zinc/91/20/22/969912022.db2.gz AEMRTTMWDAOINJ-JTQLQIEISA-N 1 2 243.310 2.485 20 0 BEADLO CC(=O)c1cc(Nc2c[nH+]c(C)cc2C)ccn1 ZINC001210588606 969966770 /nfs/dbraw/zinc/96/67/70/969966770.db2.gz ATBQDAAHOWHJLO-UHFFFAOYSA-N 1 2 241.294 2.462 20 0 BEADLO Cc1cc(-c2cncc(N)c2)cn2cc[nH+]c12 ZINC001242500846 969979856 /nfs/dbraw/zinc/97/98/56/969979856.db2.gz VAQJXBFGMMGLPS-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO CC(C)c1ccc(NCc2cc[nH+]c(N)c2)nn1 ZINC001156757618 969993379 /nfs/dbraw/zinc/99/33/79/969993379.db2.gz ZEAPFPLXRDVCPJ-UHFFFAOYSA-N 1 2 243.314 2.189 20 0 BEADLO CCCN(C)c1[nH+]cc(C)cc1/C=C/C(=O)OC ZINC001156877527 970019288 /nfs/dbraw/zinc/01/92/88/970019288.db2.gz BTZHIFWXHAIGAL-VOTSOKGWSA-N 1 2 248.326 2.422 20 0 BEADLO Cc1c[nH+]c(N2CC3CC(C3)C2)nc1NC1CC1 ZINC001156887742 970021780 /nfs/dbraw/zinc/02/17/80/970021780.db2.gz MBXJOJLHQMCRGX-UHFFFAOYSA-N 1 2 244.342 2.206 20 0 BEADLO FC1(F)C[NH2+]CCN(CCC2CCCC2)C1 ZINC001210815309 970025800 /nfs/dbraw/zinc/02/58/00/970025800.db2.gz TZNREBGOYBUKOA-UHFFFAOYSA-N 1 2 232.318 2.107 20 0 BEADLO FC1(F)CNCC[N@H+](CCC2CCCC2)C1 ZINC001210815309 970025814 /nfs/dbraw/zinc/02/58/14/970025814.db2.gz TZNREBGOYBUKOA-UHFFFAOYSA-N 1 2 232.318 2.107 20 0 BEADLO FC1(F)CNCC[N@@H+](CCC2CCCC2)C1 ZINC001210815309 970025830 /nfs/dbraw/zinc/02/58/30/970025830.db2.gz TZNREBGOYBUKOA-UHFFFAOYSA-N 1 2 232.318 2.107 20 0 BEADLO CCCn1nccc1Nc1ccc(N(C)C)[nH+]c1 ZINC001210911835 970064546 /nfs/dbraw/zinc/06/45/46/970064546.db2.gz CJOAHCDXQCCULF-UHFFFAOYSA-N 1 2 245.330 2.498 20 0 BEADLO [NH2+]=CNc1nc(-c2cccnc2)nc2c1CCC2 ZINC001157079960 970078143 /nfs/dbraw/zinc/07/81/43/970078143.db2.gz KIYFINYFJQXWKZ-UHFFFAOYSA-N 1 2 239.282 2.046 20 0 BEADLO Cc1[nH+]cn(-c2cccc(S)c2)c1N ZINC001210946668 970084011 /nfs/dbraw/zinc/08/40/11/970084011.db2.gz UONWDPBHAKCUIY-UHFFFAOYSA-N 1 2 205.286 2.052 20 0 BEADLO CCCC[C@@H](C)[N@@H+]1CC[C@@H](O)C(F)(F)C1 ZINC001255330630 970110392 /nfs/dbraw/zinc/11/03/92/970110392.db2.gz VNRASGOUIHTNNZ-NXEZZACHSA-N 1 2 221.291 2.267 20 0 BEADLO CCCC[C@@H](C)[N@H+]1CC[C@@H](O)C(F)(F)C1 ZINC001255330630 970110398 /nfs/dbraw/zinc/11/03/98/970110398.db2.gz VNRASGOUIHTNNZ-NXEZZACHSA-N 1 2 221.291 2.267 20 0 BEADLO CCOC(=O)[C@@H]1CCC[C@H]([N@H+](C)CC(F)F)C1 ZINC001255379941 970126356 /nfs/dbraw/zinc/12/63/56/970126356.db2.gz YQIPBHQZZNWDEA-ZJUUUORDSA-N 1 2 249.301 2.305 20 0 BEADLO c1cn(Cc2ccc(-c3ccncn3)cc2)c[nH+]1 ZINC001242919242 970152494 /nfs/dbraw/zinc/15/24/94/970152494.db2.gz VPDCYXMAQRXAIN-UHFFFAOYSA-N 1 2 236.278 2.388 20 0 BEADLO CCOC(=O)Cc1ccc[nH+]c1N[C@H](C)CC ZINC001157229814 970159449 /nfs/dbraw/zinc/15/94/49/970159449.db2.gz CCSLAMDZKOJLKK-SNVBAGLBSA-N 1 2 236.315 2.398 20 0 BEADLO CCOC(=O)Cc1ccc[nH+]c1N[C@@H](C)CC ZINC001157229813 970159683 /nfs/dbraw/zinc/15/96/83/970159683.db2.gz CCSLAMDZKOJLKK-JTQLQIEISA-N 1 2 236.315 2.398 20 0 BEADLO CC(C)CCC[C@@H](C)[N@@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001170088349 970218257 /nfs/dbraw/zinc/21/82/57/970218257.db2.gz QXQBTDXYJQSSBP-WOPDTQHZSA-N 1 2 225.332 2.201 20 0 BEADLO CC(C)CCC[C@@H](C)[N@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001170088349 970218265 /nfs/dbraw/zinc/21/82/65/970218265.db2.gz QXQBTDXYJQSSBP-WOPDTQHZSA-N 1 2 225.332 2.201 20 0 BEADLO Cc1occc1-c1ccn2cc(N)[nH+]c2c1 ZINC001243061170 970225240 /nfs/dbraw/zinc/22/52/40/970225240.db2.gz DRPJUYWZKLLCHI-UHFFFAOYSA-N 1 2 213.240 2.485 20 0 BEADLO Cn1c[nH+]cc1-c1cc(F)ncc1C1CC1 ZINC001243066420 970255446 /nfs/dbraw/zinc/25/54/46/970255446.db2.gz FATCENWMVGVTEZ-UHFFFAOYSA-N 1 2 217.247 2.499 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(-c2c[nH]cn2)cc1 ZINC001243070384 970261191 /nfs/dbraw/zinc/26/11/91/970261191.db2.gz UHFOXNREDOQYOM-UHFFFAOYSA-N 1 2 224.267 2.477 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(C(F)F)nc1 ZINC001243068867 970264898 /nfs/dbraw/zinc/26/48/98/970264898.db2.gz JQMRUNQBCINCCD-UHFFFAOYSA-N 1 2 209.199 2.420 20 0 BEADLO C=CCOc1ccccc1C[N@H+]1CCOC[C@@H]1C ZINC000091814855 970267731 /nfs/dbraw/zinc/26/77/31/970267731.db2.gz LNGYTMBGMMVDNL-ZDUSSCGKSA-N 1 2 247.338 2.472 20 0 BEADLO C=CCOc1ccccc1C[N@@H+]1CCOC[C@@H]1C ZINC000091814855 970267763 /nfs/dbraw/zinc/26/77/63/970267763.db2.gz LNGYTMBGMMVDNL-ZDUSSCGKSA-N 1 2 247.338 2.472 20 0 BEADLO Cc1nc2[nH]ccc2c(NC[C@H]2C[C@H](F)C2)[nH+]1 ZINC001157452675 970310702 /nfs/dbraw/zinc/31/07/02/970310702.db2.gz HTGNKADLDLDJOV-KYZUINATSA-N 1 2 234.278 2.426 20 0 BEADLO Cc1cc(C)c(Nc2cc(=O)[nH]c(=S)[nH]2)c[nH+]1 ZINC001213506025 970329662 /nfs/dbraw/zinc/32/96/62/970329662.db2.gz YXDBOSGUTUMJJN-UHFFFAOYSA-N 1 2 248.311 2.226 20 0 BEADLO COc1cc(Nc2c[nH+]c(C)cc2C)ncn1 ZINC001213505342 970330844 /nfs/dbraw/zinc/33/08/44/970330844.db2.gz CGGAMBAISZXVEO-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO Cc1nn(C)cc1Nc1c[nH+]cc(C)c1C ZINC001213522749 970338141 /nfs/dbraw/zinc/33/81/41/970338141.db2.gz FVGPPDQUTLXMNG-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO COc1nn(C)cc1Nc1c[nH+]cc(C)c1C ZINC001213522583 970342731 /nfs/dbraw/zinc/34/27/31/970342731.db2.gz CVSRRRIDFHQTAK-UHFFFAOYSA-N 1 2 232.287 2.184 20 0 BEADLO Cc1c[nH+]cc(Nc2ncccn2)c1C ZINC001213520947 970342813 /nfs/dbraw/zinc/34/28/13/970342813.db2.gz LUGNBAPEECGWFA-UHFFFAOYSA-N 1 2 200.245 2.232 20 0 BEADLO Cc1c[nH+]cc(Nc2nc(Cl)cnc2N)c1C ZINC001213527485 970344682 /nfs/dbraw/zinc/34/46/82/970344682.db2.gz NWZODKBJLGSFFD-UHFFFAOYSA-N 1 2 249.705 2.468 20 0 BEADLO COc1ccc(N)c(Nc2c[nH+]cc(C)c2C)n1 ZINC001213524911 970347309 /nfs/dbraw/zinc/34/73/09/970347309.db2.gz JEHKRSJCMWRKSG-UHFFFAOYSA-N 1 2 244.298 2.428 20 0 BEADLO C[C@@H](CC(F)(F)F)[NH2+]Cc1ncc(F)cn1 ZINC001255632771 970406960 /nfs/dbraw/zinc/40/69/60/970406960.db2.gz DTEMLCJAOBBXOO-LURJTMIESA-N 1 2 237.200 2.046 20 0 BEADLO CCOC(=O)C[NH2+][C@H](C)Cc1ccc(C)cc1 ZINC001255776040 970482759 /nfs/dbraw/zinc/48/27/59/970482759.db2.gz CTMPWDCBAPPWBQ-GFCCVEGCSA-N 1 2 235.327 2.079 20 0 BEADLO Cc1ccc(C[C@@H](C)[N@@H+]2CCC(=O)C2)cc1 ZINC001255791913 970497201 /nfs/dbraw/zinc/49/72/01/970497201.db2.gz HDDUVIYBFYURFL-GFCCVEGCSA-N 1 2 217.312 2.201 20 0 BEADLO Cc1ccc(C[C@@H](C)[N@H+]2CCC(=O)C2)cc1 ZINC001255791913 970497208 /nfs/dbraw/zinc/49/72/08/970497208.db2.gz HDDUVIYBFYURFL-GFCCVEGCSA-N 1 2 217.312 2.201 20 0 BEADLO CC[N@H+](C)Cc1nnc(Cc2ccccc2F)o1 ZINC001255803984 970504127 /nfs/dbraw/zinc/50/41/27/970504127.db2.gz CYBXXUNQJCYGRQ-UHFFFAOYSA-N 1 2 249.289 2.251 20 0 BEADLO CC[N@@H+](C)Cc1nnc(Cc2ccccc2F)o1 ZINC001255803984 970504133 /nfs/dbraw/zinc/50/41/33/970504133.db2.gz CYBXXUNQJCYGRQ-UHFFFAOYSA-N 1 2 249.289 2.251 20 0 BEADLO CCCNc1cc(N2CCC3(CC3)C2)nc[nH+]1 ZINC000400163682 970560005 /nfs/dbraw/zinc/56/00/05/970560005.db2.gz KLEZCJPYKVHHEU-UHFFFAOYSA-N 1 2 232.331 2.289 20 0 BEADLO CCCNc1cc(N2CCC3(CC3)C2)[nH+]cn1 ZINC000400163682 970560017 /nfs/dbraw/zinc/56/00/17/970560017.db2.gz KLEZCJPYKVHHEU-UHFFFAOYSA-N 1 2 232.331 2.289 20 0 BEADLO CCCCOC[C@@H](C)OCc1c[nH+]cn1C ZINC001222594619 972593235 /nfs/dbraw/zinc/59/32/35/972593235.db2.gz HUFVKLBZVWFKPM-LLVKDONJSA-N 1 2 226.320 2.142 20 0 BEADLO Cc1c(O)cccc1C[N@@H+]1CCOCC12CC2 ZINC001144121224 972595815 /nfs/dbraw/zinc/59/58/15/972595815.db2.gz HQLPSVHCXYDOBP-UHFFFAOYSA-N 1 2 233.311 2.065 20 0 BEADLO Cc1c(O)cccc1C[N@H+]1CCOCC12CC2 ZINC001144121224 972595821 /nfs/dbraw/zinc/59/58/21/972595821.db2.gz HQLPSVHCXYDOBP-UHFFFAOYSA-N 1 2 233.311 2.065 20 0 BEADLO C[C@@H](OCc1c[nH+]cn1C)c1ccncc1F ZINC001222600910 972598081 /nfs/dbraw/zinc/59/80/81/972598081.db2.gz VAZQKGKDXDQURI-SECBINFHSA-N 1 2 235.262 2.232 20 0 BEADLO C[C@@H](Cc1ccco1)OCc1c[nH+]cn1C ZINC001222599775 972598461 /nfs/dbraw/zinc/59/84/61/972598461.db2.gz FPAJYPJOZGVZDO-JTQLQIEISA-N 1 2 220.272 2.161 20 0 BEADLO C[C@H](OCc1c[nH+]cn1C)c1nccs1 ZINC001222599434 972598888 /nfs/dbraw/zinc/59/88/88/972598888.db2.gz AYZXMKVWQNUEMJ-QMMMGPOBSA-N 1 2 223.301 2.154 20 0 BEADLO Cn1c[nH+]cc1CO[C@H]1CCCC(=O)C1(C)C ZINC001222600392 972600635 /nfs/dbraw/zinc/60/06/35/972600635.db2.gz NVXUUJSDWLMIPV-LBPRGKRZSA-N 1 2 236.315 2.085 20 0 BEADLO COc1ccc(O)cc1/C(C)=C/C=C/[NH3+] ZINC001222628768 972609178 /nfs/dbraw/zinc/60/91/78/972609178.db2.gz GBPIQBXUISUNCT-DDEWIXKASA-N 1 2 205.257 2.277 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2nnc[nH]2)ccc1F ZINC001327536229 972619972 /nfs/dbraw/zinc/61/99/72/972619972.db2.gz YZVUCMOBFXOLIO-SECBINFHSA-N 1 2 234.278 2.103 20 0 BEADLO c1nnc(C[N@@H+]2CCCC3(CCCCC3)C2)[nH]1 ZINC001327547989 972624813 /nfs/dbraw/zinc/62/48/13/972624813.db2.gz ZXSDWJSVGRFVIO-UHFFFAOYSA-N 1 2 234.347 2.351 20 0 BEADLO c1nnc(C[N@H+]2CCCC3(CCCCC3)C2)[nH]1 ZINC001327547989 972624821 /nfs/dbraw/zinc/62/48/21/972624821.db2.gz ZXSDWJSVGRFVIO-UHFFFAOYSA-N 1 2 234.347 2.351 20 0 BEADLO COC(=O)Cc1cc[nH+]c(NC/C=C\C2CC2)c1 ZINC001327713303 972709003 /nfs/dbraw/zinc/70/90/03/972709003.db2.gz BJZFMKZEOYWKGV-IHWYPQMZSA-N 1 2 246.310 2.175 20 0 BEADLO CC[NH+]1CC(OCc2nc3ccccc3o2)C1 ZINC001222912424 972745391 /nfs/dbraw/zinc/74/53/91/972745391.db2.gz XFQBQNMUQLOBRY-UHFFFAOYSA-N 1 2 232.283 2.049 20 0 BEADLO C[C@H]1CCC[C@H]1Cc1nnc(C[NH+](C)C)o1 ZINC001327865210 972770577 /nfs/dbraw/zinc/77/05/77/972770577.db2.gz MHBJXHZGCPKSFU-UWVGGRQHSA-N 1 2 223.320 2.110 20 0 BEADLO C[NH+]1CC(OCc2ncoc2-c2ccccc2)C1 ZINC001223084342 972835441 /nfs/dbraw/zinc/83/54/41/972835441.db2.gz CKUVNOIEJSZOBD-UHFFFAOYSA-N 1 2 244.294 2.172 20 0 BEADLO O=C(O[C@@H]1CCc2[nH+]ccn2C1)c1ccccc1 ZINC001223149877 972855579 /nfs/dbraw/zinc/85/55/79/972855579.db2.gz UKAHVXTVOIOFMN-GFCCVEGCSA-N 1 2 242.278 2.055 20 0 BEADLO CCC1(NC(=O)c2cccc3[nH+]ccn32)CC1 ZINC001328032042 972856295 /nfs/dbraw/zinc/85/62/95/972856295.db2.gz DTIUNFLCVTVYDE-UHFFFAOYSA-N 1 2 229.283 2.007 20 0 BEADLO C[NH+]1CC(OCc2ccc(-c3ccon3)cc2)C1 ZINC001223301744 972933358 /nfs/dbraw/zinc/93/33/58/972933358.db2.gz FCDFYRDLSDJFGA-UHFFFAOYSA-N 1 2 244.294 2.172 20 0 BEADLO Cc1ccccc1[C@H]([NH2+]Cc1nnc[nH]1)C1CC1 ZINC001328395172 973019471 /nfs/dbraw/zinc/01/94/71/973019471.db2.gz VWXBQOSOBODPDY-CQSZACIVSA-N 1 2 242.326 2.354 20 0 BEADLO Cc1cc(CO[C@H]2COC[C@@H]2C)cc(C)[nH+]1 ZINC001223422940 973059593 /nfs/dbraw/zinc/05/95/93/973059593.db2.gz ROZXCHMIXBAGIA-ZANVPECISA-N 1 2 221.300 2.250 20 0 BEADLO COC(=O)[C@H]1C[C@@H](OCc2cc(C)[nH+]c(C)c2)C1 ZINC001223422184 973063044 /nfs/dbraw/zinc/06/30/44/973063044.db2.gz UOPGOMOYYQHDIR-BETUJISGSA-N 1 2 249.310 2.167 20 0 BEADLO Cc1ncc(COC2C[NH+](C(C)C)C2)s1 ZINC001223538600 973143135 /nfs/dbraw/zinc/14/31/35/973143135.db2.gz IDYDKCONAXLOCH-UHFFFAOYSA-N 1 2 226.345 2.061 20 0 BEADLO O=C(NCc1c[nH+]cn1C1CCC1)C1CC=CC1 ZINC001146704111 973205753 /nfs/dbraw/zinc/20/57/53/973205753.db2.gz RTMCSSGPLJDNML-UHFFFAOYSA-N 1 2 245.326 2.191 20 0 BEADLO CCN(C(=O)C[C@H](C)n1cc[nH+]c1)C(C)(C)C ZINC001329598596 973847151 /nfs/dbraw/zinc/84/71/51/973847151.db2.gz XXNKXKCYWIFSDG-NSHDSACASA-N 1 2 237.347 2.481 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@@H+]1Cc1cc(C)n[nH]1 ZINC001329658604 973872828 /nfs/dbraw/zinc/87/28/28/973872828.db2.gz FSHAZHFBIDZFGM-LBPRGKRZSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@H+]1Cc1cc(C)n[nH]1 ZINC001329658604 973872830 /nfs/dbraw/zinc/87/28/30/973872830.db2.gz FSHAZHFBIDZFGM-LBPRGKRZSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1cnc(C[N@H+]2[C@@H]3CC[C@H]2CC(=O)C3)s1 ZINC000235995955 973904780 /nfs/dbraw/zinc/90/47/80/973904780.db2.gz GPXQMCCZHBEFEM-AOOOYVTPSA-N 1 2 236.340 2.147 20 0 BEADLO Cc1cnc(C[N@@H+]2[C@@H]3CC[C@H]2CC(=O)C3)s1 ZINC000235995955 973904810 /nfs/dbraw/zinc/90/48/10/973904810.db2.gz GPXQMCCZHBEFEM-AOOOYVTPSA-N 1 2 236.340 2.147 20 0 BEADLO CN(C)c1cc(NCc2ccc(F)cc2)[nH+]cn1 ZINC000585414951 973911439 /nfs/dbraw/zinc/91/14/39/973911439.db2.gz DGDNLXZNRPYIFM-UHFFFAOYSA-N 1 2 246.289 2.294 20 0 BEADLO CN(C)c1cc(NCc2ccc(F)cc2)nc[nH+]1 ZINC000585414951 973911446 /nfs/dbraw/zinc/91/14/46/973911446.db2.gz DGDNLXZNRPYIFM-UHFFFAOYSA-N 1 2 246.289 2.294 20 0 BEADLO CC(C)(C)[C@@H]1CCC[N@H+](Cc2nnc[nH]2)CC1 ZINC001329878480 973998719 /nfs/dbraw/zinc/99/87/19/973998719.db2.gz UTWWVTQBQHOHHU-LLVKDONJSA-N 1 2 236.363 2.453 20 0 BEADLO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2nnc[nH]2)CC1 ZINC001329878480 973998728 /nfs/dbraw/zinc/99/87/28/973998728.db2.gz UTWWVTQBQHOHHU-LLVKDONJSA-N 1 2 236.363 2.453 20 0 BEADLO C[C@@H](c1nnc(C[NH+](C)C)o1)C1CCC1 ZINC001330098953 974106868 /nfs/dbraw/zinc/10/68/68/974106868.db2.gz IXKKPFKCDUBGMG-MRVPVSSYSA-N 1 2 209.293 2.035 20 0 BEADLO COC(=O)C[NH2+][C@H](C)CCc1ccc(C)cc1 ZINC001171658575 974126349 /nfs/dbraw/zinc/12/63/49/974126349.db2.gz SMVCXXPACFFRDR-GFCCVEGCSA-N 1 2 235.327 2.079 20 0 BEADLO Fc1cccc2c1C[C@@H]([NH2+]CC(F)F)C2 ZINC001171768969 974154562 /nfs/dbraw/zinc/15/45/62/974154562.db2.gz MBXMLGLTVDDUFM-QMMMGPOBSA-N 1 2 215.218 2.148 20 0 BEADLO CC[C@H](C)[C@H](C)[N@@H+]1CC[C@@H](O)C(F)(F)C1 ZINC001171847477 974208227 /nfs/dbraw/zinc/20/82/27/974208227.db2.gz MFRUOJLVQLRPLN-LPEHRKFASA-N 1 2 221.291 2.123 20 0 BEADLO CC[C@H](C)[C@H](C)[N@H+]1CC[C@@H](O)C(F)(F)C1 ZINC001171847477 974208240 /nfs/dbraw/zinc/20/82/40/974208240.db2.gz MFRUOJLVQLRPLN-LPEHRKFASA-N 1 2 221.291 2.123 20 0 BEADLO CCN(CC)c1cccc(OC2C[NH+](C)C2)c1 ZINC001225236114 974288989 /nfs/dbraw/zinc/28/89/89/974288989.db2.gz YRPKZSGCRZOQCN-UHFFFAOYSA-N 1 2 234.343 2.226 20 0 BEADLO CCCn1cc(C[NH+]2CC3(C2)CCCC3)nn1 ZINC001330622169 974356009 /nfs/dbraw/zinc/35/60/09/974356009.db2.gz QJVSNMDMRPLCOG-UHFFFAOYSA-N 1 2 234.347 2.064 20 0 BEADLO CCC[C@@H](CC(=O)OC)Oc1cc[nH+]cc1 ZINC001225290721 974362458 /nfs/dbraw/zinc/36/24/58/974362458.db2.gz GYYHTFQMRYHISY-NSHDSACASA-N 1 2 223.272 2.192 20 0 BEADLO COC(=O)[C@@H]1CCC[C@H](Oc2cc[nH+]cc2)C1 ZINC001225295334 974368257 /nfs/dbraw/zinc/36/82/57/974368257.db2.gz KRDHEBHMYBHFHP-PWSUYJOCSA-N 1 2 235.283 2.192 20 0 BEADLO O=C1CC[NH+]([C@H]2CSc3ccccc3C2)CC1 ZINC001172194935 974479789 /nfs/dbraw/zinc/47/97/89/974479789.db2.gz XSKJZSBYDQDVKC-GFCCVEGCSA-N 1 2 247.363 2.368 20 0 BEADLO [CH2]CC[N@H+](CC[NH3+])[C@@H]1CSc2ccccc2C1 ZINC001172201058 974482175 /nfs/dbraw/zinc/48/21/75/974482175.db2.gz LRTWAURFKLPHBG-ZDUSSCGKSA-N 1 2 249.403 2.188 20 0 BEADLO [CH2]CC[N@@H+](CC[NH3+])[C@@H]1CSc2ccccc2C1 ZINC001172201058 974482181 /nfs/dbraw/zinc/48/21/81/974482181.db2.gz LRTWAURFKLPHBG-ZDUSSCGKSA-N 1 2 249.403 2.188 20 0 BEADLO COc1cccc(NCc2cc[nH+]c(N)c2)c1 ZINC000258305946 974483027 /nfs/dbraw/zinc/48/30/27/974483027.db2.gz RYMDZUXLUHOAMV-UHFFFAOYSA-N 1 2 229.283 2.285 20 0 BEADLO Cc1ccc(OC2C[NH+](C)C2)c2ncccc12 ZINC001225473920 974515038 /nfs/dbraw/zinc/51/50/38/974515038.db2.gz LCVYMYFSMYRCHD-UHFFFAOYSA-N 1 2 228.295 2.236 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@@H](C)CCO[C@H](C)CC ZINC001172319393 974527626 /nfs/dbraw/zinc/52/76/26/974527626.db2.gz QKPIVYCMXJBOFH-TUAOUCFPSA-N 1 2 245.363 2.121 20 0 BEADLO CCCOC(=O)C[NH2+][C@@H](C)CCO[C@H](C)CC ZINC001172353814 974623798 /nfs/dbraw/zinc/62/37/98/974623798.db2.gz YDXXHTVSRMQXOO-NWDGAFQWSA-N 1 2 245.363 2.123 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@H]2OCCC[C@@H]2C1 ZINC001331272431 974667789 /nfs/dbraw/zinc/66/77/89/974667789.db2.gz UZBFYIBYAXQXDG-ZWNOBZJWSA-N 1 2 236.290 2.226 20 0 BEADLO Cc1ccc(OC2C[NH+](C)C2)cc1Cl ZINC001225859068 974703420 /nfs/dbraw/zinc/70/34/20/974703420.db2.gz ZWKDCXRQJREXHP-UHFFFAOYSA-N 1 2 211.692 2.341 20 0 BEADLO CCOC(=O)C1([NH2+][C@H](CC)CC(C)C)CC1 ZINC001172389931 974737323 /nfs/dbraw/zinc/73/73/23/974737323.db2.gz QROFJAQAZOLRON-LLVKDONJSA-N 1 2 227.348 2.496 20 0 BEADLO CC[C@H](CC(C)C)[N@@H+]1CCC(=O)[C@H](F)C1 ZINC001172399337 974758601 /nfs/dbraw/zinc/75/86/01/974758601.db2.gz CAOBXWFBFJDZLQ-GHMZBOCLSA-N 1 2 215.312 2.424 20 0 BEADLO CC[C@H](CC(C)C)[N@H+]1CCC(=O)[C@H](F)C1 ZINC001172399337 974758607 /nfs/dbraw/zinc/75/86/07/974758607.db2.gz CAOBXWFBFJDZLQ-GHMZBOCLSA-N 1 2 215.312 2.424 20 0 BEADLO Cc1cc(N[C@H](C)Cn2cccn2)c[nH+]c1C ZINC001331933855 974875040 /nfs/dbraw/zinc/87/50/40/974875040.db2.gz TXDQPDVGUHRXPD-LLVKDONJSA-N 1 2 230.315 2.396 20 0 BEADLO C[C@H](C(=O)NCCC[C@@H]1C=CCC1)n1cc[nH+]c1 ZINC001332398495 975091226 /nfs/dbraw/zinc/09/12/26/975091226.db2.gz WYAGHXDAGIDYLM-CHWSQXEVSA-N 1 2 247.342 2.307 20 0 BEADLO C[C@@H](C(=O)NCCC[C@H]1C=CCC1)n1cc[nH+]c1 ZINC001332398500 975092156 /nfs/dbraw/zinc/09/21/56/975092156.db2.gz WYAGHXDAGIDYLM-STQMWFEESA-N 1 2 247.342 2.307 20 0 BEADLO CCc1ccc(C[C@@H](C)[NH2+][C@H]2CCOC2=O)cc1 ZINC001173239941 975163313 /nfs/dbraw/zinc/16/33/13/975163313.db2.gz VEIHEUVFNFUKQW-RISCZKNCSA-N 1 2 247.338 2.085 20 0 BEADLO CCCc1ccccc1OC1C[NH+](C)C1 ZINC001227172433 975303423 /nfs/dbraw/zinc/30/34/23/975303423.db2.gz KOVUHWWFPOMQAM-UHFFFAOYSA-N 1 2 205.301 2.332 20 0 BEADLO CC[NH+]1CC(Oc2ccc(C)cc2NC(C)=O)C1 ZINC001227176910 975303547 /nfs/dbraw/zinc/30/35/47/975303547.db2.gz NANPMABZYHHEKJ-UHFFFAOYSA-N 1 2 248.326 2.036 20 0 BEADLO Cc1cc[nH+]c(C)c1OC1CC2(COC2)C1 ZINC001227264671 975338883 /nfs/dbraw/zinc/33/88/83/975338883.db2.gz PYYWKJPKVAAWGT-UHFFFAOYSA-N 1 2 219.284 2.256 20 0 BEADLO CCCOC(=O)[C@@H](C)Oc1c(C)cc[nH+]c1C ZINC001227263377 975338918 /nfs/dbraw/zinc/33/89/18/975338918.db2.gz GACCNFJERASZRJ-LLVKDONJSA-N 1 2 237.299 2.419 20 0 BEADLO CO[C@H](C[NH2+][C@H](C)c1noc(C)n1)CC(C)C ZINC001332961834 975343345 /nfs/dbraw/zinc/34/33/45/975343345.db2.gz OUYTUICNYUQHDP-KOLCDFICSA-N 1 2 241.335 2.090 20 0 BEADLO C[C@H]1CC=C(c2nnc(C[NH+](C)C)o2)CC1 ZINC001333120289 975454154 /nfs/dbraw/zinc/45/41/54/975454154.db2.gz BWBBAZRAMWQTEH-VIFPVBQESA-N 1 2 221.304 2.335 20 0 BEADLO Cc1cc(CO)cc(N(C)c2[nH+]cccc2N)c1 ZINC001212751703 975522151 /nfs/dbraw/zinc/52/21/51/975522151.db2.gz WBRUDKCJJMEYMG-UHFFFAOYSA-N 1 2 243.310 2.232 20 0 BEADLO COc1cc[nH+]c(Nc2cccnc2)c1 ZINC001173853597 975764897 /nfs/dbraw/zinc/76/48/97/975764897.db2.gz AXIYORKUIDBNQQ-UHFFFAOYSA-N 1 2 201.229 2.229 20 0 BEADLO Cc1c[nH]c2ccc(OC3C[NH+](C)C3)cc12 ZINC001228012443 975851344 /nfs/dbraw/zinc/85/13/44/975851344.db2.gz JLKYFYGACPKITL-UHFFFAOYSA-N 1 2 216.284 2.169 20 0 BEADLO c1cc(N=c2ccc3[nH+]s[nH]c-3c2)ccn1 ZINC001173882874 975940759 /nfs/dbraw/zinc/94/07/59/975940759.db2.gz ZKEKKVNNLGMIGG-UHFFFAOYSA-N 1 2 228.280 2.252 20 0 BEADLO CC1(CCC(=O)NCCNc2cccc[nH+]2)CC1 ZINC001333680819 975983269 /nfs/dbraw/zinc/98/32/69/975983269.db2.gz COTLATLNHPHJLH-UHFFFAOYSA-N 1 2 247.342 2.190 20 0 BEADLO Cc1coc(C(=O)NCc2[nH]c(C)c(C)[nH+]2)c1C ZINC001333745359 976055495 /nfs/dbraw/zinc/05/54/95/976055495.db2.gz FDTRRJHWXNNZPT-UHFFFAOYSA-N 1 2 247.298 2.166 20 0 BEADLO CCc1cc(NC2CSC2)nc(CC)[nH+]1 ZINC001333824343 976108216 /nfs/dbraw/zinc/10/82/16/976108216.db2.gz XBBMSLRCWRBAPW-UHFFFAOYSA-N 1 2 223.345 2.129 20 0 BEADLO CSCC1CC[NH+](Cc2cc(C)[nH]n2)CC1 ZINC001333868688 976133990 /nfs/dbraw/zinc/13/39/90/976133990.db2.gz ZVXQVUXXHLFIDQ-UHFFFAOYSA-N 1 2 239.388 2.293 20 0 BEADLO CCc1cccc(Nc2ccc(C(N)=O)cc2)[nH+]1 ZINC001174048773 976200899 /nfs/dbraw/zinc/20/08/99/976200899.db2.gz MNNVTOSLXLPZNM-UHFFFAOYSA-N 1 2 241.294 2.487 20 0 BEADLO COc1ncc(Nc2cc(C)cc(C)[nH+]2)cn1 ZINC001174032859 976230781 /nfs/dbraw/zinc/23/07/81/976230781.db2.gz ULVCUYFPUVSEGJ-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO COc1ncccc1Nc1cccn2cc[nH+]c12 ZINC001174041053 976255830 /nfs/dbraw/zinc/25/58/30/976255830.db2.gz FXXDTVDZGOWWFD-UHFFFAOYSA-N 1 2 240.266 2.482 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)C[C@@H]1CC=CCC1 ZINC001334112632 976310325 /nfs/dbraw/zinc/31/03/25/976310325.db2.gz ZRJWZMBQZXHNHC-CHWSQXEVSA-N 1 2 247.342 2.134 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)C[C@H]1CC=CCC1 ZINC001334112633 976312831 /nfs/dbraw/zinc/31/28/31/976312831.db2.gz ZRJWZMBQZXHNHC-OLZOCXBDSA-N 1 2 247.342 2.134 20 0 BEADLO COc1cncc(Nc2cccc3[nH+]ccn32)c1 ZINC001174087000 976347938 /nfs/dbraw/zinc/34/79/38/976347938.db2.gz WNFXAGHNBZOUCB-UHFFFAOYSA-N 1 2 240.266 2.482 20 0 BEADLO Cc1nc(C[NH2+]Cc2cc(C)ncn2)sc1C ZINC001334201988 976373627 /nfs/dbraw/zinc/37/36/27/976373627.db2.gz WDPFVVMPIDYQPT-UHFFFAOYSA-N 1 2 248.355 2.148 20 0 BEADLO CNC(=O)c1cccc(Nc2cc(C)cc[nH+]2)c1 ZINC001174138608 976375447 /nfs/dbraw/zinc/37/54/47/976375447.db2.gz WDVYJFDVKUXFJL-UHFFFAOYSA-N 1 2 241.294 2.493 20 0 BEADLO CNC(=O)c1cccc(Nc2[nH+]cccc2C)c1 ZINC001174137320 976375985 /nfs/dbraw/zinc/37/59/85/976375985.db2.gz AMQWIHHGSCNPFW-UHFFFAOYSA-N 1 2 241.294 2.493 20 0 BEADLO C[C@H](C(=O)N(C)c1ccsc1)n1cc[nH+]c1 ZINC001334229839 976392107 /nfs/dbraw/zinc/39/21/07/976392107.db2.gz KCBNBENALFJAJB-SECBINFHSA-N 1 2 235.312 2.169 20 0 BEADLO Cc1n[nH]c(C)c1Nc1ccc(N(C)C)[nH+]c1 ZINC001174213249 976392966 /nfs/dbraw/zinc/39/29/66/976392966.db2.gz RCWKJBRWGAGZHJ-UHFFFAOYSA-N 1 2 231.303 2.231 20 0 BEADLO COc1cc(Nc2ccc(N(C)C)[nH+]c2)ccn1 ZINC001174304909 976514102 /nfs/dbraw/zinc/51/41/02/976514102.db2.gz CRAYVOGJWFFMSJ-UHFFFAOYSA-N 1 2 244.298 2.295 20 0 BEADLO CCN(C)c1ccc(Nc2cn(C)nc2C)c[nH+]1 ZINC001174335176 976556674 /nfs/dbraw/zinc/55/66/74/976556674.db2.gz WRJPJRXHNTXSAD-UHFFFAOYSA-N 1 2 245.330 2.323 20 0 BEADLO Cc1ccc(Nc2ccc3ncnn3c2)c(C)[nH+]1 ZINC001174371349 976610310 /nfs/dbraw/zinc/61/03/10/976610310.db2.gz KZSKCLQQBSHFIO-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO CCc1[nH+]ccc(C)c1Nc1cncnc1 ZINC001174386194 976629674 /nfs/dbraw/zinc/62/96/74/976629674.db2.gz ZIKLDOADCSIRSO-UHFFFAOYSA-N 1 2 214.272 2.486 20 0 BEADLO Cc1cn2cccc(Nc3cnn(C)c3C)c2[nH+]1 ZINC001174387932 976636119 /nfs/dbraw/zinc/63/61/19/976636119.db2.gz FTDMCUOIZIFKJY-UHFFFAOYSA-N 1 2 241.298 2.428 20 0 BEADLO Cc1c(Nc2cccc3[nH+]ccn32)cnn1C ZINC001174389707 976649086 /nfs/dbraw/zinc/64/90/86/976649086.db2.gz NQTUZHRIMRNDKU-UHFFFAOYSA-N 1 2 227.271 2.120 20 0 BEADLO Cc1c(Nc2ccc3c(c2)[nH+]cn3C)cnn1C ZINC001174390792 976654244 /nfs/dbraw/zinc/65/42/44/976654244.db2.gz SHZXZWGQYQCUTG-UHFFFAOYSA-N 1 2 241.298 2.359 20 0 BEADLO COc1cc[nH+]c(Nc2cnn(CC3CC3)c2)c1 ZINC001174467071 976768917 /nfs/dbraw/zinc/76/89/17/976768917.db2.gz RWGOSCWOPXOANN-UHFFFAOYSA-N 1 2 244.298 2.440 20 0 BEADLO Cc1n[nH]cc1Nc1cc(C)cc(C)[nH+]1 ZINC001174472061 976779257 /nfs/dbraw/zinc/77/92/57/976779257.db2.gz YHFGTJKVJYFEON-UHFFFAOYSA-N 1 2 202.261 2.474 20 0 BEADLO CN(CCC(F)(F)F)c1nccn2c[nH+]cc12 ZINC001334900901 976781348 /nfs/dbraw/zinc/78/13/48/976781348.db2.gz DZJQFCIUXGVTRO-UHFFFAOYSA-N 1 2 244.220 2.118 20 0 BEADLO Cc1cc(NCC2(O)CCC2)nc(C2CCC2)[nH+]1 ZINC001334935201 976801227 /nfs/dbraw/zinc/80/12/27/976801227.db2.gz HKDSBTHPDVDKPC-UHFFFAOYSA-N 1 2 247.342 2.379 20 0 BEADLO Cc1c[nH+]ccc1Nc1nnc(C(C)(C)C)o1 ZINC001174536077 976812009 /nfs/dbraw/zinc/81/20/09/976812009.db2.gz KMSHUBOGWZFHGA-UHFFFAOYSA-N 1 2 232.287 2.236 20 0 BEADLO CCn1cc(Nc2cccn3cc[nH+]c23)cn1 ZINC001174567278 976884675 /nfs/dbraw/zinc/88/46/75/976884675.db2.gz SBQLKVKAWMPNSO-UHFFFAOYSA-N 1 2 227.271 2.294 20 0 BEADLO C[NH+]1CC(Oc2nccc3ccc(F)cc32)C1 ZINC001229514173 976887189 /nfs/dbraw/zinc/88/71/89/976887189.db2.gz FSFAXBAFOFCSGK-UHFFFAOYSA-N 1 2 232.258 2.067 20 0 BEADLO CC(C)(C)[NH+]1CC(Oc2ncc(F)cc2F)C1 ZINC001229862689 977009686 /nfs/dbraw/zinc/00/96/86/977009686.db2.gz SSOOZRAYJKFQHZ-UHFFFAOYSA-N 1 2 242.269 2.221 20 0 BEADLO CO[C@H](C)COc1ccc(-n2cc[nH+]c2)cc1 ZINC001229955179 977041085 /nfs/dbraw/zinc/04/10/85/977041085.db2.gz YAFVDSMLASFORK-LLVKDONJSA-N 1 2 232.283 2.286 20 0 BEADLO CN(C)c1ccc(N(C)c2[nH+]cccc2N)cc1 ZINC001174874346 977142051 /nfs/dbraw/zinc/14/20/51/977142051.db2.gz AJQBGCBVGRWFHJ-UHFFFAOYSA-N 1 2 242.326 2.498 20 0 BEADLO C[NH+](C)c1ccc(-n2cccc2N)cc1 ZINC001174877802 977144661 /nfs/dbraw/zinc/14/46/61/977144661.db2.gz SPITVDRHCGRHBI-UHFFFAOYSA-N 1 2 201.273 2.126 20 0 BEADLO C=Cc1ccc(OC[C@@H]2C[N@H+](C)CCO2)cc1 ZINC001230448489 977213283 /nfs/dbraw/zinc/21/32/83/977213283.db2.gz NVEPGDQERXINSO-AWEZNQCLSA-N 1 2 233.311 2.039 20 0 BEADLO C=Cc1ccc(OC[C@@H]2C[N@@H+](C)CCO2)cc1 ZINC001230448489 977213287 /nfs/dbraw/zinc/21/32/87/977213287.db2.gz NVEPGDQERXINSO-AWEZNQCLSA-N 1 2 233.311 2.039 20 0 BEADLO C=Cc1ccc(OC[C@H]2C[N@H+](C)CCO2)cc1 ZINC001230448490 977213522 /nfs/dbraw/zinc/21/35/22/977213522.db2.gz NVEPGDQERXINSO-CQSZACIVSA-N 1 2 233.311 2.039 20 0 BEADLO C=Cc1ccc(OC[C@H]2C[N@@H+](C)CCO2)cc1 ZINC001230448490 977213532 /nfs/dbraw/zinc/21/35/32/977213532.db2.gz NVEPGDQERXINSO-CQSZACIVSA-N 1 2 233.311 2.039 20 0 BEADLO CCCC(=O)N(C)C[C@H]1CC[N@@H+]1C/C=C/Cl ZINC001230633906 977282904 /nfs/dbraw/zinc/28/29/04/977282904.db2.gz MJHLCQHLIGEXQX-TZOMUSMUSA-N 1 2 244.766 2.072 20 0 BEADLO CCCC(=O)N(C)C[C@H]1CC[N@H+]1C/C=C/Cl ZINC001230633906 977282913 /nfs/dbraw/zinc/28/29/13/977282913.db2.gz MJHLCQHLIGEXQX-TZOMUSMUSA-N 1 2 244.766 2.072 20 0 BEADLO Cc1conc1Nc1ccc(N(C)C)[nH+]c1 ZINC001175337742 977384225 /nfs/dbraw/zinc/38/42/25/977384225.db2.gz LQWHNIKPUIJTGN-UHFFFAOYSA-N 1 2 218.260 2.188 20 0 BEADLO CN(C)c1ccc(Nc2cc(F)ccn2)c[nH+]1 ZINC001175338553 977387249 /nfs/dbraw/zinc/38/72/49/977387249.db2.gz YLAIQAVGKKWACG-UHFFFAOYSA-N 1 2 232.262 2.425 20 0 BEADLO CCc1nccnc1Nc1ccc(N(C)C)[nH+]c1 ZINC001175340408 977387495 /nfs/dbraw/zinc/38/74/95/977387495.db2.gz FJFRPRCEEJQNPS-UHFFFAOYSA-N 1 2 243.314 2.244 20 0 BEADLO Cc1cc(Nc2ccc(N(C)C)[nH+]c2)on1 ZINC001175338396 977388926 /nfs/dbraw/zinc/38/89/26/977388926.db2.gz REKRFNVTOZXSLA-UHFFFAOYSA-N 1 2 218.260 2.188 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(OC[C@@H]2CCO2)cc1 ZINC001231079122 977459854 /nfs/dbraw/zinc/45/98/54/977459854.db2.gz HAWOICJNIKKYFG-ZDUSSCGKSA-N 1 2 244.294 2.255 20 0 BEADLO CC(=O)[C@@H](C)Oc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001231081875 977461848 /nfs/dbraw/zinc/46/18/48/977461848.db2.gz OWLYVTUHODMBQR-SNVBAGLBSA-N 1 2 230.267 2.433 20 0 BEADLO c1c[nH+]c(-c2ccc(OC[C@H]3CCO3)cc2)[nH]1 ZINC001231080588 977469430 /nfs/dbraw/zinc/46/94/30/977469430.db2.gz FSPQYFRYGDIAIE-GFCCVEGCSA-N 1 2 230.267 2.244 20 0 BEADLO COC(=O)[C@@H](C)Oc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001231083057 977474470 /nfs/dbraw/zinc/47/44/70/977474470.db2.gz BMAXUGUONPGUJQ-SECBINFHSA-N 1 2 246.266 2.017 20 0 BEADLO COC(=O)C[C@@H](C)Nc1cccc(C2CC2)[nH+]1 ZINC000260406258 977497765 /nfs/dbraw/zinc/49/77/65/977497765.db2.gz OXAXOAHMRIQOBK-SECBINFHSA-N 1 2 234.299 2.323 20 0 BEADLO C[NH+]1CC(Oc2cccc3cc(F)cnc32)C1 ZINC001231153852 977512786 /nfs/dbraw/zinc/51/27/86/977512786.db2.gz OCKLFQJKGYQVGD-UHFFFAOYSA-N 1 2 232.258 2.067 20 0 BEADLO COc1cc[nH+]cc1Nc1ccc(CO)cc1 ZINC001175562998 977547098 /nfs/dbraw/zinc/54/70/98/977547098.db2.gz KDHCTWCXYOQNGN-UHFFFAOYSA-N 1 2 230.267 2.326 20 0 BEADLO CN(C)c1ccc[nH+]c1Nc1ccc(CO)cc1 ZINC001175563733 977549368 /nfs/dbraw/zinc/54/93/68/977549368.db2.gz LHSICGACMNGEIZ-UHFFFAOYSA-N 1 2 243.310 2.384 20 0 BEADLO CCCc1cc(N=C2CCC[N@H+](C)C2)on1 ZINC001175574418 977569097 /nfs/dbraw/zinc/56/90/97/977569097.db2.gz VUENLGQCPWYWQV-UHFFFAOYSA-N 1 2 221.304 2.258 20 0 BEADLO CCCc1cc(N=C2CCC[N@@H+](C)C2)on1 ZINC001175574418 977569103 /nfs/dbraw/zinc/56/91/03/977569103.db2.gz VUENLGQCPWYWQV-UHFFFAOYSA-N 1 2 221.304 2.258 20 0 BEADLO Cc1cc(N=C2CCC[N@@H+](C)C2)sn1 ZINC001175575319 977569689 /nfs/dbraw/zinc/56/96/89/977569689.db2.gz RNCDEIUJIDARMD-UHFFFAOYSA-N 1 2 209.318 2.083 20 0 BEADLO Cc1cc(N=C2CCC[N@H+](C)C2)sn1 ZINC001175575319 977569693 /nfs/dbraw/zinc/56/96/93/977569693.db2.gz RNCDEIUJIDARMD-UHFFFAOYSA-N 1 2 209.318 2.083 20 0 BEADLO Cc1c(F)ccc(C[NH+]2CC(C)(CO)C2)c1F ZINC001231475696 977598147 /nfs/dbraw/zinc/59/81/47/977598147.db2.gz JLFFVIPVZFNTTI-UHFFFAOYSA-N 1 2 241.281 2.087 20 0 BEADLO C[C@@H]1CC(=O)CC[N@@H+]1Cc1c[nH]c2cccnc12 ZINC001231485696 977608204 /nfs/dbraw/zinc/60/82/04/977608204.db2.gz JCDGKFBJNPZDEW-SNVBAGLBSA-N 1 2 243.310 2.116 20 0 BEADLO C[C@@H]1CC(=O)CC[N@H+]1Cc1c[nH]c2cccnc12 ZINC001231485696 977608210 /nfs/dbraw/zinc/60/82/10/977608210.db2.gz JCDGKFBJNPZDEW-SNVBAGLBSA-N 1 2 243.310 2.116 20 0 BEADLO O=C1CCC[N@H+](Cc2cc3cc[nH]c3cn2)CC1 ZINC001231666493 977677404 /nfs/dbraw/zinc/67/74/04/977677404.db2.gz VJVBWELTULABMR-UHFFFAOYSA-N 1 2 243.310 2.118 20 0 BEADLO O=C1CCC[N@@H+](Cc2cc3cc[nH]c3cn2)CC1 ZINC001231666493 977677421 /nfs/dbraw/zinc/67/74/21/977677421.db2.gz VJVBWELTULABMR-UHFFFAOYSA-N 1 2 243.310 2.118 20 0 BEADLO COC1CCN(c2cc(F)cc(C)[nH+]2)CC1 ZINC001336452456 977690283 /nfs/dbraw/zinc/69/02/83/977690283.db2.gz BGDSACSRDPHXHG-UHFFFAOYSA-N 1 2 224.279 2.144 20 0 BEADLO CCCCC1(C(=O)N2CCn3c[nH+]cc3C2)CC1 ZINC001336498676 977725812 /nfs/dbraw/zinc/72/58/12/977725812.db2.gz YPBUTCOOCOUMNL-UHFFFAOYSA-N 1 2 247.342 2.196 20 0 BEADLO CCCOC1C[NH+](Cc2ccc3c[nH]nc3c2)C1 ZINC001231907502 977790717 /nfs/dbraw/zinc/79/07/17/977790717.db2.gz UDGUEBXJDDIJSJ-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO C[NH+](C)Cc1cc(Br)ncc1F ZINC001231913935 977797804 /nfs/dbraw/zinc/79/78/04/977797804.db2.gz USZRWMNWJYRYOK-UHFFFAOYSA-N 1 2 233.084 2.045 20 0 BEADLO CCCCC1(NC(=O)[C@@H](C)n2cc[nH+]c2)CC1 ZINC001336604508 977808248 /nfs/dbraw/zinc/80/82/48/977808248.db2.gz DLEFRBXVWHMWTM-LLVKDONJSA-N 1 2 235.331 2.283 20 0 BEADLO Oc1cncc(C[NH+]2CCC(F)(F)CC2)c1 ZINC001232039071 977861350 /nfs/dbraw/zinc/86/13/50/977861350.db2.gz MQYPORSIZJPCRL-UHFFFAOYSA-N 1 2 228.242 2.018 20 0 BEADLO C[N@H+](Cc1cccc(O)c1)Cc1cncc(O)c1 ZINC001232038222 977862542 /nfs/dbraw/zinc/86/25/42/977862542.db2.gz ASTZVTADOLNQBD-UHFFFAOYSA-N 1 2 244.294 2.125 20 0 BEADLO C[N@@H+](Cc1cccc(O)c1)Cc1cncc(O)c1 ZINC001232038222 977862545 /nfs/dbraw/zinc/86/25/45/977862545.db2.gz ASTZVTADOLNQBD-UHFFFAOYSA-N 1 2 244.294 2.125 20 0 BEADLO C/C=C/C[C@@H]1CCCN(c2cc(N)nc[nH+]2)C1 ZINC001336702992 977866442 /nfs/dbraw/zinc/86/64/42/977866442.db2.gz IYVYYYCHZFMSRM-KXMPLOMGSA-N 1 2 232.331 2.241 20 0 BEADLO Oc1cncc(C[N@@H+]2CCc3ccsc3C2)c1 ZINC001232042176 977866777 /nfs/dbraw/zinc/86/67/77/977866777.db2.gz OZXVQNPNSKCEJA-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO Oc1cncc(C[N@H+]2CCc3ccsc3C2)c1 ZINC001232042176 977866781 /nfs/dbraw/zinc/86/67/81/977866781.db2.gz OZXVQNPNSKCEJA-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO O=C1CCC[N@H+](Cc2cc3ncccc3[nH]2)CC1 ZINC001232063603 977878677 /nfs/dbraw/zinc/87/86/77/977878677.db2.gz VYFFFEBWSCSANH-UHFFFAOYSA-N 1 2 243.310 2.118 20 0 BEADLO O=C1CCC[N@@H+](Cc2cc3ncccc3[nH]2)CC1 ZINC001232063603 977878681 /nfs/dbraw/zinc/87/86/81/977878681.db2.gz VYFFFEBWSCSANH-UHFFFAOYSA-N 1 2 243.310 2.118 20 0 BEADLO F[C@@H]1CCC[N@H+](Cc2cc3ccncc3[nH]2)C1 ZINC001232092579 977888489 /nfs/dbraw/zinc/88/84/89/977888489.db2.gz NDIKWSRPOZXEFM-LLVKDONJSA-N 1 2 233.290 2.497 20 0 BEADLO F[C@@H]1CCC[N@@H+](Cc2cc3ccncc3[nH]2)C1 ZINC001232092579 977888497 /nfs/dbraw/zinc/88/84/97/977888497.db2.gz NDIKWSRPOZXEFM-LLVKDONJSA-N 1 2 233.290 2.497 20 0 BEADLO F[C@H]1CC[N@H+](Cc2cc3ccncc3[nH]2)C1 ZINC001232091566 977889285 /nfs/dbraw/zinc/88/92/85/977889285.db2.gz WYFFFPPOQUOVHN-JTQLQIEISA-N 1 2 219.263 2.107 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2cc3ccncc3[nH]2)C1 ZINC001232091566 977889289 /nfs/dbraw/zinc/88/92/89/977889289.db2.gz WYFFFPPOQUOVHN-JTQLQIEISA-N 1 2 219.263 2.107 20 0 BEADLO Cn1c[nH+]c2cc(Nc3ccc(=O)[nH]c3)ccc21 ZINC001176131931 977911834 /nfs/dbraw/zinc/91/18/34/977911834.db2.gz KCPNBXXOEUDWOQ-UHFFFAOYSA-N 1 2 240.266 2.418 20 0 BEADLO COc1cc[nH+]cc1Nc1ccnnc1Cl ZINC001176118481 977946428 /nfs/dbraw/zinc/94/64/28/977946428.db2.gz LOSFRIQHRZCZIZ-UHFFFAOYSA-N 1 2 236.662 2.277 20 0 BEADLO COc1cc[nH+]cc1Nc1ncc(F)cc1O ZINC001176118228 977947306 /nfs/dbraw/zinc/94/73/06/977947306.db2.gz DPGLEFPSCZJAGM-UHFFFAOYSA-N 1 2 235.218 2.074 20 0 BEADLO COc1cc[nH+]cc1-n1ncc2c1cccc2N ZINC001176120536 977949679 /nfs/dbraw/zinc/94/96/79/977949679.db2.gz CQOOCRITQLYFGT-UHFFFAOYSA-N 1 2 240.266 2.011 20 0 BEADLO COc1cc[nH+]cc1Nc1nonc1C1CC1 ZINC001176119486 977954546 /nfs/dbraw/zinc/95/45/46/977954546.db2.gz VBQAOWZYTNEIFR-UHFFFAOYSA-N 1 2 232.243 2.094 20 0 BEADLO COc1cc[nH+]cc1N(C)c1cccc(N)c1 ZINC001176122856 977958498 /nfs/dbraw/zinc/95/84/98/977958498.db2.gz AUNUUHFCYOGCMC-UHFFFAOYSA-N 1 2 229.283 2.440 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1cc(Cl)cs1 ZINC001232276715 977990633 /nfs/dbraw/zinc/99/06/33/977990633.db2.gz HTCWCGCYLJOLAA-UHFFFAOYSA-N 1 2 217.721 2.422 20 0 BEADLO CC(=O)C[N@H+](C)Cc1cc(Cl)cs1 ZINC001232276715 977990640 /nfs/dbraw/zinc/99/06/40/977990640.db2.gz HTCWCGCYLJOLAA-UHFFFAOYSA-N 1 2 217.721 2.422 20 0 BEADLO c1ccc2c(c1)ccnc2C[N@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001232252643 977983146 /nfs/dbraw/zinc/98/31/46/977983146.db2.gz WNRKKJLCXHSUFX-BETUJISGSA-N 1 2 240.306 2.208 20 0 BEADLO c1ccc2c(c1)ccnc2C[N@@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001232252643 977983151 /nfs/dbraw/zinc/98/31/51/977983151.db2.gz WNRKKJLCXHSUFX-BETUJISGSA-N 1 2 240.306 2.208 20 0 BEADLO CCCOC1C[NH+](Cc2ccc(COC)cc2)C1 ZINC001232300105 977994936 /nfs/dbraw/zinc/99/49/36/977994936.db2.gz IQCMAUXJFJXAPA-UHFFFAOYSA-N 1 2 249.354 2.444 20 0 BEADLO COc1ccc(C[NH+]2CC(C(F)F)C2)c(C)n1 ZINC001232338837 978012824 /nfs/dbraw/zinc/01/28/24/978012824.db2.gz YHXGOFOWFFFVSB-UHFFFAOYSA-N 1 2 242.269 2.096 20 0 BEADLO COc1ccc(Nc2[nH+]cccc2N)cc1O ZINC001176253724 978016117 /nfs/dbraw/zinc/01/61/17/978016117.db2.gz IKTTXZRVNPPNPH-UHFFFAOYSA-N 1 2 231.255 2.122 20 0 BEADLO COc1cc(C)c(C[N@H+](C)Cc2ccno2)cn1 ZINC001232353516 978029952 /nfs/dbraw/zinc/02/99/52/978029952.db2.gz BSHMDRMHBVHUEF-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1cc(C)c(C[N@@H+](C)Cc2ccno2)cn1 ZINC001232353516 978029960 /nfs/dbraw/zinc/02/99/60/978029960.db2.gz BSHMDRMHBVHUEF-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO Cc1ncc(Nc2ccc3c(c2)[nH+]cn3C)cn1 ZINC001176395907 978069912 /nfs/dbraw/zinc/06/99/12/978069912.db2.gz JFYPOBKMUIWWMY-UHFFFAOYSA-N 1 2 239.282 2.415 20 0 BEADLO Cc1ncc(C[NH+]2CCC(OC3CCC3)CC2)[nH]1 ZINC001232460452 978095063 /nfs/dbraw/zinc/09/50/63/978095063.db2.gz QWAQWUQJGCEPHA-UHFFFAOYSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1[nH]c(CN2CCOC3(CCCCC3)C2)c[nH+]1 ZINC001232464581 978114217 /nfs/dbraw/zinc/11/42/17/978114217.db2.gz INIOOSIZZQSSDR-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1cccc(F)c1CN1CCn2c[nH+]cc2C1 ZINC001232483124 978133925 /nfs/dbraw/zinc/13/39/25/978133925.db2.gz CBYPKAJFRIDIBV-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO C[N@H+](Cc1ccccn1)Cc1cc(F)ccn1 ZINC001232491651 978143363 /nfs/dbraw/zinc/14/33/63/978143363.db2.gz UXKLRGNWDJZMAU-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[N@@H+](Cc1ccccn1)Cc1cc(F)ccn1 ZINC001232491651 978143367 /nfs/dbraw/zinc/14/33/67/978143367.db2.gz UXKLRGNWDJZMAU-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO CCOC(=O)[C@@H](C)CNc1ccc(CC)c[nH+]1 ZINC001337066765 978152008 /nfs/dbraw/zinc/15/20/08/978152008.db2.gz KYYFZSHYOCKKMS-JTQLQIEISA-N 1 2 236.315 2.255 20 0 BEADLO Cc1cc(C)c(Nc2cnc3nonc3c2)c[nH+]1 ZINC001176688587 978153326 /nfs/dbraw/zinc/15/33/26/978153326.db2.gz IRVIQLSBNZZQSI-UHFFFAOYSA-N 1 2 241.254 2.373 20 0 BEADLO FC[C@H]1CCC[N@@H+]1Cc1cc(F)ccn1 ZINC001232498472 978153478 /nfs/dbraw/zinc/15/34/78/978153478.db2.gz XMEFEEPTDVZOLI-LLVKDONJSA-N 1 2 212.243 2.155 20 0 BEADLO FC[C@H]1CCC[N@H+]1Cc1cc(F)ccn1 ZINC001232498472 978153480 /nfs/dbraw/zinc/15/34/80/978153480.db2.gz XMEFEEPTDVZOLI-LLVKDONJSA-N 1 2 212.243 2.155 20 0 BEADLO FCc1cccc(C[NH+]2CC3(CSC3)C2)n1 ZINC001232541557 978165608 /nfs/dbraw/zinc/16/56/08/978165608.db2.gz XWYKXANUOJXCGT-UHFFFAOYSA-N 1 2 238.331 2.100 20 0 BEADLO FCc1cccc(C[N@H+]2CCC[C@@H]2CF)n1 ZINC001232536595 978166319 /nfs/dbraw/zinc/16/63/19/978166319.db2.gz AYNSXBXTYGNGLM-GFCCVEGCSA-N 1 2 226.270 2.485 20 0 BEADLO FCc1cccc(C[N@@H+]2CCC[C@@H]2CF)n1 ZINC001232536595 978166327 /nfs/dbraw/zinc/16/63/27/978166327.db2.gz AYNSXBXTYGNGLM-GFCCVEGCSA-N 1 2 226.270 2.485 20 0 BEADLO CC(=O)[C@@H]1CCC[N@@H+]1Cc1cccc(CF)n1 ZINC001232541483 978168323 /nfs/dbraw/zinc/16/83/23/978168323.db2.gz WHDVTFYREBWXRD-ZDUSSCGKSA-N 1 2 236.290 2.105 20 0 BEADLO CC(=O)[C@@H]1CCC[N@H+]1Cc1cccc(CF)n1 ZINC001232541483 978168330 /nfs/dbraw/zinc/16/83/30/978168330.db2.gz WHDVTFYREBWXRD-ZDUSSCGKSA-N 1 2 236.290 2.105 20 0 BEADLO Cn1ccc(Nc2ccc[nH+]c2N2CCCC2)n1 ZINC001176744176 978168972 /nfs/dbraw/zinc/16/89/72/978168972.db2.gz QCOOEGLRAVIJRX-UHFFFAOYSA-N 1 2 243.314 2.159 20 0 BEADLO Cn1nccc1Nc1ccc[nH+]c1N1CCCC1 ZINC001176744691 978171857 /nfs/dbraw/zinc/17/18/57/978171857.db2.gz XKQFAMRDBRHLNE-UHFFFAOYSA-N 1 2 243.314 2.159 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc3ccoc3cn2)[C@H](C)CO1 ZINC001232556425 978180577 /nfs/dbraw/zinc/18/05/77/978180577.db2.gz JXNYRXQJQHEHPP-GHMZBOCLSA-N 1 2 246.310 2.437 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc3ccoc3cn2)[C@H](C)CO1 ZINC001232556425 978180586 /nfs/dbraw/zinc/18/05/86/978180586.db2.gz JXNYRXQJQHEHPP-GHMZBOCLSA-N 1 2 246.310 2.437 20 0 BEADLO C[N@H+](Cc1ccno1)Cc1cc2ccoc2cn1 ZINC001232556148 978182806 /nfs/dbraw/zinc/18/28/06/978182806.db2.gz GQERDSLJQIFXQR-UHFFFAOYSA-N 1 2 243.266 2.448 20 0 BEADLO C[N@@H+](Cc1ccno1)Cc1cc2ccoc2cn1 ZINC001232556148 978182814 /nfs/dbraw/zinc/18/28/14/978182814.db2.gz GQERDSLJQIFXQR-UHFFFAOYSA-N 1 2 243.266 2.448 20 0 BEADLO CCOc1ccnc(C[N@@H+]2C[C@@H](C)[C@@H](F)C2)c1 ZINC001232578668 978185783 /nfs/dbraw/zinc/18/57/83/978185783.db2.gz FGEDPLKHHGWSIR-MFKMUULPSA-N 1 2 238.306 2.270 20 0 BEADLO CCOc1ccnc(C[N@H+]2C[C@@H](C)[C@@H](F)C2)c1 ZINC001232578668 978185790 /nfs/dbraw/zinc/18/57/90/978185790.db2.gz FGEDPLKHHGWSIR-MFKMUULPSA-N 1 2 238.306 2.270 20 0 BEADLO CC(C)c1cccc(NC(=O)Cc2c[nH]c[nH+]2)n1 ZINC001176827014 978191245 /nfs/dbraw/zinc/19/12/45/978191245.db2.gz BUUZLNWFAAUGFX-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)Nc1cccc2cc[nH]c21 ZINC001176833777 978201099 /nfs/dbraw/zinc/20/10/99/978201099.db2.gz WRADZRNZFZRIIV-UHFFFAOYSA-N 1 2 240.266 2.072 20 0 BEADLO COC1C[NH+](Cc2cccc3ncsc32)C1 ZINC001232733045 978252851 /nfs/dbraw/zinc/25/28/51/978252851.db2.gz GGOMPMJLWYBVEA-UHFFFAOYSA-N 1 2 234.324 2.127 20 0 BEADLO C[N@H+](CCF)Cc1ccc(Br)[nH]1 ZINC001232692216 978253123 /nfs/dbraw/zinc/25/31/23/978253123.db2.gz RSNDMNGJCDLWAO-UHFFFAOYSA-N 1 2 235.100 2.179 20 0 BEADLO C[N@@H+](CCF)Cc1ccc(Br)[nH]1 ZINC001232692216 978253137 /nfs/dbraw/zinc/25/31/37/978253137.db2.gz RSNDMNGJCDLWAO-UHFFFAOYSA-N 1 2 235.100 2.179 20 0 BEADLO COc1cc(O)cc(C[N@@H+]2C[C@@H](F)C[C@H]2C)c1 ZINC001232805299 978298940 /nfs/dbraw/zinc/29/89/40/978298940.db2.gz FZLMUOWCCVEOQK-KOLCDFICSA-N 1 2 239.290 2.333 20 0 BEADLO COc1cc(O)cc(C[N@H+]2C[C@@H](F)C[C@H]2C)c1 ZINC001232805299 978298957 /nfs/dbraw/zinc/29/89/57/978298957.db2.gz FZLMUOWCCVEOQK-KOLCDFICSA-N 1 2 239.290 2.333 20 0 BEADLO Cc1cc(O)cc(C[NH+]2CC(OC(C)C)C2)c1 ZINC001232882652 978319444 /nfs/dbraw/zinc/31/94/44/978319444.db2.gz ZTIKOVIHOAVXOX-UHFFFAOYSA-N 1 2 235.327 2.310 20 0 BEADLO Cc1cc(O)cc(C[N@@H+](C)Cc2ccncn2)c1 ZINC001232883792 978327137 /nfs/dbraw/zinc/32/71/37/978327137.db2.gz YGDUBORSOJVKBY-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO Cc1cc(O)cc(C[N@H+](C)Cc2ccncn2)c1 ZINC001232883792 978327149 /nfs/dbraw/zinc/32/71/49/978327149.db2.gz YGDUBORSOJVKBY-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO C[C@H]1COCC[N@@H+]1Cc1ccc2ncoc2c1 ZINC001232937634 978346681 /nfs/dbraw/zinc/34/66/81/978346681.db2.gz FVARWFLRKPWPQR-JTQLQIEISA-N 1 2 232.283 2.049 20 0 BEADLO C[C@H]1COCC[N@H+]1Cc1ccc2ncoc2c1 ZINC001232937634 978346688 /nfs/dbraw/zinc/34/66/88/978346688.db2.gz FVARWFLRKPWPQR-JTQLQIEISA-N 1 2 232.283 2.049 20 0 BEADLO CC(C)=C(C)C(=O)Nc1c(C)c[nH+]cc1C ZINC001337509930 978381671 /nfs/dbraw/zinc/38/16/71/978381671.db2.gz NWSQOUWVUXEJDS-UHFFFAOYSA-N 1 2 218.300 2.415 20 0 BEADLO Cc1ncc(F)cc1C[N@@H+]1CCC[C@@H]1CF ZINC001232993381 978392778 /nfs/dbraw/zinc/39/27/78/978392778.db2.gz LUJLDWULVZCHAR-GFCCVEGCSA-N 1 2 226.270 2.463 20 0 BEADLO Cc1ncc(F)cc1C[N@H+]1CCC[C@@H]1CF ZINC001232993381 978392790 /nfs/dbraw/zinc/39/27/90/978392790.db2.gz LUJLDWULVZCHAR-GFCCVEGCSA-N 1 2 226.270 2.463 20 0 BEADLO Oc1cc(Br)cc(C[NH+]2CCC2)c1 ZINC001232996314 978396403 /nfs/dbraw/zinc/39/64/03/978396403.db2.gz FDXXZPJGNLXQQY-UHFFFAOYSA-N 1 2 242.116 2.360 20 0 BEADLO O=C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cccc(O)c1F ZINC001233050155 978439670 /nfs/dbraw/zinc/43/96/70/978439670.db2.gz HNKXTMPKYHZYEO-PHIMTYICSA-N 1 2 249.285 2.227 20 0 BEADLO O=C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc(O)c1F ZINC001233050155 978439680 /nfs/dbraw/zinc/43/96/80/978439680.db2.gz HNKXTMPKYHZYEO-PHIMTYICSA-N 1 2 249.285 2.227 20 0 BEADLO C[C@H]1CCCC[N@@H+]1Cc1nc2ccccn2n1 ZINC001233068051 978455955 /nfs/dbraw/zinc/45/59/55/978455955.db2.gz QBYXUCCEDKEMBB-NSHDSACASA-N 1 2 230.315 2.104 20 0 BEADLO C[C@H]1CCCC[N@H+]1Cc1nc2ccccn2n1 ZINC001233068051 978455961 /nfs/dbraw/zinc/45/59/61/978455961.db2.gz QBYXUCCEDKEMBB-NSHDSACASA-N 1 2 230.315 2.104 20 0 BEADLO CC1(C)CC[NH+](Cc2nc3ccccn3n2)CC1 ZINC001233070136 978459384 /nfs/dbraw/zinc/45/93/84/978459384.db2.gz KDQXFXKDSGNZGQ-UHFFFAOYSA-N 1 2 244.342 2.351 20 0 BEADLO C[C@H]1CC[N@H+](Cc2nc3ccccn3n2)[C@@H](C)C1 ZINC001233069785 978461492 /nfs/dbraw/zinc/46/14/92/978461492.db2.gz GCPPWGFQUUMFBA-RYUDHWBXSA-N 1 2 244.342 2.350 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2nc3ccccn3n2)[C@@H](C)C1 ZINC001233069785 978461505 /nfs/dbraw/zinc/46/15/05/978461505.db2.gz GCPPWGFQUUMFBA-RYUDHWBXSA-N 1 2 244.342 2.350 20 0 BEADLO C[C@H](C1CC1)N(C)c1cc(NC2CC2)[nH+]cn1 ZINC001337707376 978468855 /nfs/dbraw/zinc/46/88/55/978468855.db2.gz KRJWLPYHIXYBDX-SECBINFHSA-N 1 2 232.331 2.286 20 0 BEADLO C[C@H](C1CC1)N(C)c1cc(NC2CC2)nc[nH+]1 ZINC001337707376 978468860 /nfs/dbraw/zinc/46/88/60/978468860.db2.gz KRJWLPYHIXYBDX-SECBINFHSA-N 1 2 232.331 2.286 20 0 BEADLO CC(C)N(C(=O)[C@@H](C)n1cc[nH+]c1)C(C)C ZINC001177922615 978474863 /nfs/dbraw/zinc/47/48/63/978474863.db2.gz YGONGZYZYQVBIN-LLVKDONJSA-N 1 2 223.320 2.090 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)cnc1C ZINC001233156575 978477613 /nfs/dbraw/zinc/47/76/13/978477613.db2.gz QFYJRFWJOMZEEF-OKILXGFUSA-N 1 2 232.327 2.062 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)cnc1C ZINC001233156575 978477616 /nfs/dbraw/zinc/47/76/16/978477616.db2.gz QFYJRFWJOMZEEF-OKILXGFUSA-N 1 2 232.327 2.062 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cncnc2)cnc1C ZINC001233164772 978485522 /nfs/dbraw/zinc/48/55/22/978485522.db2.gz INLODGIWYFMEEI-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cncnc2)cnc1C ZINC001233164772 978485529 /nfs/dbraw/zinc/48/55/29/978485529.db2.gz INLODGIWYFMEEI-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H](C)OC[C@@H]2C)cnc1C ZINC001233163338 978486748 /nfs/dbraw/zinc/48/67/48/978486748.db2.gz XOMUFFCLKWKDNY-NWDGAFQWSA-N 1 2 234.343 2.308 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)cnc1C ZINC001233163338 978486752 /nfs/dbraw/zinc/48/67/52/978486752.db2.gz XOMUFFCLKWKDNY-NWDGAFQWSA-N 1 2 234.343 2.308 20 0 BEADLO C[C@@H]1CCC[C@H](C)N1C(=O)CCc1[nH]cc[nH+]1 ZINC001177990001 978493178 /nfs/dbraw/zinc/49/31/78/978493178.db2.gz FSQZJQIMQBIDMA-PHIMTYICSA-N 1 2 235.331 2.132 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ccno2)cc1O ZINC001233235024 978505359 /nfs/dbraw/zinc/50/53/59/978505359.db2.gz MHXBFMRQXGKEDI-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ccno2)cc1O ZINC001233235024 978505365 /nfs/dbraw/zinc/50/53/65/978505365.db2.gz MHXBFMRQXGKEDI-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO C[C@@H]1CC(=O)CC[N@@H+]1Cc1cccc2c1CCO2 ZINC001233274662 978525353 /nfs/dbraw/zinc/52/53/53/978525353.db2.gz XVWYPSATMHIHFJ-LLVKDONJSA-N 1 2 245.322 2.175 20 0 BEADLO C[C@@H]1CC(=O)CC[N@H+]1Cc1cccc2c1CCO2 ZINC001233274662 978525362 /nfs/dbraw/zinc/52/53/62/978525362.db2.gz XVWYPSATMHIHFJ-LLVKDONJSA-N 1 2 245.322 2.175 20 0 BEADLO CC(C)CC1CCN(c2cc(N)nc[nH+]2)CC1 ZINC001337887945 978553007 /nfs/dbraw/zinc/55/30/07/978553007.db2.gz LFOCZJBEECIHHA-UHFFFAOYSA-N 1 2 234.347 2.321 20 0 BEADLO CC(=O)[C@H]1CCCC[N@@H+]1Cc1sncc1C ZINC001233321955 978562560 /nfs/dbraw/zinc/56/25/60/978562560.db2.gz LPZMKWUULIQPOD-LLVKDONJSA-N 1 2 238.356 2.395 20 0 BEADLO CC(=O)[C@H]1CCCC[N@H+]1Cc1sncc1C ZINC001233321955 978562566 /nfs/dbraw/zinc/56/25/66/978562566.db2.gz LPZMKWUULIQPOD-LLVKDONJSA-N 1 2 238.356 2.395 20 0 BEADLO Cc1cc(F)cc(N(C)[C@@H](CO)CC(C)C)[nH+]1 ZINC001337941567 978572208 /nfs/dbraw/zinc/57/22/08/978572208.db2.gz YNDGJVNKNBHLAN-GFCCVEGCSA-N 1 2 240.322 2.372 20 0 BEADLO Clc1cccc2ncc(C[NH+]3CCC3)n21 ZINC001233355792 978572482 /nfs/dbraw/zinc/57/24/82/978572482.db2.gz MMFYHDODAVLBLS-UHFFFAOYSA-N 1 2 221.691 2.193 20 0 BEADLO Cc1ncc(C[N@@H+]2CCc3ncc(C)cc3C2)o1 ZINC001233368401 978580042 /nfs/dbraw/zinc/58/00/42/978580042.db2.gz NUAQFJXITDZIMX-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1ncc(C[N@H+]2CCc3ncc(C)cc3C2)o1 ZINC001233368401 978580045 /nfs/dbraw/zinc/58/00/45/978580045.db2.gz NUAQFJXITDZIMX-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1ncc(C[N@@H+]2CCc3nc(C)sc3C2)o1 ZINC001233367294 978580977 /nfs/dbraw/zinc/58/09/77/978580977.db2.gz XSRHTXQLZYPISP-UHFFFAOYSA-N 1 2 249.339 2.306 20 0 BEADLO Cc1ncc(C[N@H+]2CCc3nc(C)sc3C2)o1 ZINC001233367294 978580984 /nfs/dbraw/zinc/58/09/84/978580984.db2.gz XSRHTXQLZYPISP-UHFFFAOYSA-N 1 2 249.339 2.306 20 0 BEADLO C[C@H]1CCN(Cc2cccc(N)[nH+]2)CC1(F)F ZINC001233368940 978585441 /nfs/dbraw/zinc/58/54/41/978585441.db2.gz PARJCEAMPXXPBG-VIFPVBQESA-N 1 2 241.285 2.141 20 0 BEADLO C[N@H+](Cc1ccc(N)cc1Cl)C1(C)COC1 ZINC001233376389 978589669 /nfs/dbraw/zinc/58/96/69/978589669.db2.gz GUDIIUFOSVZRBT-UHFFFAOYSA-N 1 2 240.734 2.143 20 0 BEADLO C[N@@H+](Cc1ccc(N)cc1Cl)C1(C)COC1 ZINC001233376389 978589674 /nfs/dbraw/zinc/58/96/74/978589674.db2.gz GUDIIUFOSVZRBT-UHFFFAOYSA-N 1 2 240.734 2.143 20 0 BEADLO Clc1ccn2cc(C[NH+]3CC=CC3)nc2c1 ZINC001233388818 978598847 /nfs/dbraw/zinc/59/88/47/978598847.db2.gz NUZOECMUMVAJKG-UHFFFAOYSA-N 1 2 233.702 2.360 20 0 BEADLO Cc1[nH]c(CNc2nc(C)cnc2C)[nH+]c1C ZINC001338085146 978607269 /nfs/dbraw/zinc/60/72/69/978607269.db2.gz UVJFUMHDLXBRGP-UHFFFAOYSA-N 1 2 231.303 2.045 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H]1C[C@H]1C(C)C ZINC001338244294 978643751 /nfs/dbraw/zinc/64/37/51/978643751.db2.gz UXBOUFIBRWKKHH-RYUDHWBXSA-N 1 2 232.327 2.351 20 0 BEADLO C[NH+]1CC(Oc2ccc3occc3c2)C1 ZINC001233672084 978668159 /nfs/dbraw/zinc/66/81/59/978668159.db2.gz SXXCEVCUZDIMKP-UHFFFAOYSA-N 1 2 203.241 2.126 20 0 BEADLO CCC(=O)Cc1ccc(Cn2cc[nH+]c2)cc1 ZINC001249921287 978677994 /nfs/dbraw/zinc/67/79/94/978677994.db2.gz MIKGFFWWZBIEJX-UHFFFAOYSA-N 1 2 228.295 2.453 20 0 BEADLO C[NH+]1CC(Oc2nccc3c(F)cccc32)C1 ZINC001233723193 978678481 /nfs/dbraw/zinc/67/84/81/978678481.db2.gz VNBRCHLJKKABRN-UHFFFAOYSA-N 1 2 232.258 2.067 20 0 BEADLO CC[NH+]1CC(Oc2ccc(-c3ncco3)cc2)C1 ZINC001233733753 978682157 /nfs/dbraw/zinc/68/21/57/978682157.db2.gz FVLRLLAWKJQJQK-UHFFFAOYSA-N 1 2 244.294 2.425 20 0 BEADLO Fc1ccccc1C[N@@H+]1CCOC2(CC2)C1 ZINC001203359812 978726277 /nfs/dbraw/zinc/72/62/77/978726277.db2.gz HSYOYOIZEFDBCB-UHFFFAOYSA-N 1 2 221.275 2.191 20 0 BEADLO Fc1ccccc1C[N@H+]1CCOC2(CC2)C1 ZINC001203359812 978726282 /nfs/dbraw/zinc/72/62/82/978726282.db2.gz HSYOYOIZEFDBCB-UHFFFAOYSA-N 1 2 221.275 2.191 20 0 BEADLO CCOCCc1ccc[nH+]c1N1CCCC1 ZINC001249942970 978741524 /nfs/dbraw/zinc/74/15/24/978741524.db2.gz RGQKSIVTPLHIIU-UHFFFAOYSA-N 1 2 220.316 2.261 20 0 BEADLO CCC(C)=CC(=O)Nc1c(C)c[nH+]cc1C ZINC001338994348 978768792 /nfs/dbraw/zinc/76/87/92/978768792.db2.gz ZVOHBKAMXXCECR-TWGQIWQCSA-N 1 2 218.300 2.415 20 0 BEADLO CC[NH+]1CC(Oc2ccc(C(C)(C)C)nc2)C1 ZINC001234175832 978786056 /nfs/dbraw/zinc/78/60/56/978786056.db2.gz ACTKIBHJGGNVJO-UHFFFAOYSA-N 1 2 234.343 2.462 20 0 BEADLO Cc1cc(OC2C[NH+](C)C2)cc(C)c1C ZINC001234387998 978825829 /nfs/dbraw/zinc/82/58/29/978825829.db2.gz ZLOCFQFPFKWCLJ-UHFFFAOYSA-N 1 2 205.301 2.305 20 0 BEADLO CC(C)CC(=O)N1CCC(c2c[nH+]cn2C)CC1 ZINC001339374323 978843982 /nfs/dbraw/zinc/84/39/82/978843982.db2.gz HFAIDNFCZRMDIE-UHFFFAOYSA-N 1 2 249.358 2.172 20 0 BEADLO CC[NH+]1CC(Oc2cccc3ncsc32)C1 ZINC001234475975 978846336 /nfs/dbraw/zinc/84/63/36/978846336.db2.gz DUURKKIEYJJRII-UHFFFAOYSA-N 1 2 234.324 2.379 20 0 BEADLO CCOC(=[NH2+])c1ccc(OC[C@@H]2CCO2)cc1 ZINC001234584979 978864271 /nfs/dbraw/zinc/86/42/71/978864271.db2.gz LIJLZUSWUABLBX-LBPRGKRZSA-N 1 2 235.283 2.216 20 0 BEADLO Cc1cc(F)cc(N2CCCO[C@@H](C)C2)[nH+]1 ZINC001339560771 978872346 /nfs/dbraw/zinc/87/23/46/978872346.db2.gz FNDUPTDPRIZYRY-JTQLQIEISA-N 1 2 224.279 2.144 20 0 BEADLO COC[C@@H]1CCCN(c2cc(F)cc(C)[nH+]2)C1 ZINC001339579742 978874775 /nfs/dbraw/zinc/87/47/75/978874775.db2.gz WDDABQQJPDLPHK-LLVKDONJSA-N 1 2 238.306 2.392 20 0 BEADLO CCc1ccc(N2CC[C@H](C(=O)OC)[C@H]2C)[nH+]c1 ZINC001339685134 978892360 /nfs/dbraw/zinc/89/23/60/978892360.db2.gz DFZKAXKCLAJUSA-PWSUYJOCSA-N 1 2 248.326 2.032 20 0 BEADLO Cc1cc(C)cc(CN(C)c2cc(N)nc[nH+]2)c1 ZINC001339692320 978895596 /nfs/dbraw/zinc/89/55/96/978895596.db2.gz JUYYYXRDRJSSBB-UHFFFAOYSA-N 1 2 242.326 2.312 20 0 BEADLO Fc1cnc(C[N@@H+]2CCCC3(CCC3)C2)nc1 ZINC001235014444 978952877 /nfs/dbraw/zinc/95/28/77/978952877.db2.gz VHOQHWAQYSTSPT-UHFFFAOYSA-N 1 2 235.306 2.382 20 0 BEADLO Fc1cnc(C[N@H+]2CCCC3(CCC3)C2)nc1 ZINC001235014444 978952880 /nfs/dbraw/zinc/95/28/80/978952880.db2.gz VHOQHWAQYSTSPT-UHFFFAOYSA-N 1 2 235.306 2.382 20 0 BEADLO CCC[C@H]1CCCN(C(=O)[C@H](C)n2cc[nH+]c2)C1 ZINC001340272583 979000813 /nfs/dbraw/zinc/00/08/13/979000813.db2.gz FUEMCKLLCSIVJA-STQMWFEESA-N 1 2 249.358 2.483 20 0 BEADLO CCc1cccc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)n1 ZINC001235251081 979007476 /nfs/dbraw/zinc/00/74/76/979007476.db2.gz PGUOZOVGXSCGLY-OKILXGFUSA-N 1 2 232.327 2.007 20 0 BEADLO CCc1cccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)n1 ZINC001235251081 979007482 /nfs/dbraw/zinc/00/74/82/979007482.db2.gz PGUOZOVGXSCGLY-OKILXGFUSA-N 1 2 232.327 2.007 20 0 BEADLO CCc1cccc(C[N@@H+]2CC[C@@H](F)C2)n1 ZINC001235256241 979009438 /nfs/dbraw/zinc/00/94/38/979009438.db2.gz YUUCWOMJYJWLFH-SNVBAGLBSA-N 1 2 208.280 2.188 20 0 BEADLO CCc1cccc(C[N@H+]2CC[C@@H](F)C2)n1 ZINC001235256241 979009442 /nfs/dbraw/zinc/00/94/42/979009442.db2.gz YUUCWOMJYJWLFH-SNVBAGLBSA-N 1 2 208.280 2.188 20 0 BEADLO CCc1cccc(C[N@H+]2CCOC[C@@H]2CC)n1 ZINC001235262098 979014244 /nfs/dbraw/zinc/01/42/44/979014244.db2.gz WFCMIJPUFXLLRA-AWEZNQCLSA-N 1 2 234.343 2.255 20 0 BEADLO CCc1cccc(C[N@@H+]2CCOC[C@@H]2CC)n1 ZINC001235262098 979014251 /nfs/dbraw/zinc/01/42/51/979014251.db2.gz WFCMIJPUFXLLRA-AWEZNQCLSA-N 1 2 234.343 2.255 20 0 BEADLO CCc1cccc(C[NH+]2CC(C(F)F)C2)n1 ZINC001235270614 979017517 /nfs/dbraw/zinc/01/75/17/979017517.db2.gz KTAWFEJDAWHQSD-UHFFFAOYSA-N 1 2 226.270 2.341 20 0 BEADLO CCOc1cc(O)cc(C[N@@H+]2CC[C@@H](F)C2)c1 ZINC001235394671 979035062 /nfs/dbraw/zinc/03/50/62/979035062.db2.gz VFNMXJNZYXYHQG-LLVKDONJSA-N 1 2 239.290 2.335 20 0 BEADLO CCOc1cc(O)cc(C[N@H+]2CC[C@@H](F)C2)c1 ZINC001235394671 979035068 /nfs/dbraw/zinc/03/50/68/979035068.db2.gz VFNMXJNZYXYHQG-LLVKDONJSA-N 1 2 239.290 2.335 20 0 BEADLO COc1cc(C[N@H+](C)CCF)cc(F)c1F ZINC001235447384 979050340 /nfs/dbraw/zinc/05/03/40/979050340.db2.gz VJRQMCUJLCNUDQ-UHFFFAOYSA-N 1 2 233.233 2.375 20 0 BEADLO COc1cc(C[N@@H+](C)CCF)cc(F)c1F ZINC001235447384 979050341 /nfs/dbraw/zinc/05/03/41/979050341.db2.gz VJRQMCUJLCNUDQ-UHFFFAOYSA-N 1 2 233.233 2.375 20 0 BEADLO Cc1[nH+]cn(C)c1CN1Cc2cccc(F)c2C1 ZINC001235553234 979094272 /nfs/dbraw/zinc/09/42/72/979094272.db2.gz OGCJYEOFELXJRG-UHFFFAOYSA-N 1 2 245.301 2.383 20 0 BEADLO C[C@@H]1C[C@H]1C[N@@H+]1CCNC[C@@H]1c1ccccc1F ZINC001235743205 979139264 /nfs/dbraw/zinc/13/92/64/979139264.db2.gz LPUQADKNMCQVOL-TYNCELHUSA-N 1 2 248.345 2.428 20 0 BEADLO C[C@@H]1C[C@H]1C[N@H+]1CCNC[C@@H]1c1ccccc1F ZINC001235743205 979139272 /nfs/dbraw/zinc/13/92/72/979139272.db2.gz LPUQADKNMCQVOL-TYNCELHUSA-N 1 2 248.345 2.428 20 0 BEADLO CCOc1cc(C[N@H+](C)C2COC2)ccc1F ZINC001235799400 979153054 /nfs/dbraw/zinc/15/30/54/979153054.db2.gz AWNRIGBOZVWKMA-UHFFFAOYSA-N 1 2 239.290 2.055 20 0 BEADLO CCOc1cc(C[N@@H+](C)C2COC2)ccc1F ZINC001235799400 979153056 /nfs/dbraw/zinc/15/30/56/979153056.db2.gz AWNRIGBOZVWKMA-UHFFFAOYSA-N 1 2 239.290 2.055 20 0 BEADLO Cc1nc(F)ccc1C[NH+]1CC2(CSC2)C1 ZINC001235820385 979156891 /nfs/dbraw/zinc/15/68/91/979156891.db2.gz NDAHRYADUCYNPV-UHFFFAOYSA-N 1 2 238.331 2.078 20 0 BEADLO Cc1nc(F)ccc1C[N@H+](C)Cc1ccno1 ZINC001235818445 979157255 /nfs/dbraw/zinc/15/72/55/979157255.db2.gz CAJNNXWULJEJTE-UHFFFAOYSA-N 1 2 235.262 2.149 20 0 BEADLO Cc1nc(F)ccc1C[N@@H+](C)Cc1ccno1 ZINC001235818445 979157259 /nfs/dbraw/zinc/15/72/59/979157259.db2.gz CAJNNXWULJEJTE-UHFFFAOYSA-N 1 2 235.262 2.149 20 0 BEADLO CS[C@@H]1CC[C@@H]([N@H+](C)Cc2csnn2)C1 ZINC001341570433 979473724 /nfs/dbraw/zinc/47/37/24/979473724.db2.gz WQYFTEKRSDANBT-NXEZZACHSA-N 1 2 243.401 2.254 20 0 BEADLO CS[C@@H]1CC[C@@H]([N@@H+](C)Cc2csnn2)C1 ZINC001341570433 979473731 /nfs/dbraw/zinc/47/37/31/979473731.db2.gz WQYFTEKRSDANBT-NXEZZACHSA-N 1 2 243.401 2.254 20 0 BEADLO C[N@H+](CCO)Cc1cc(F)c(F)cc1Cl ZINC001236256583 979478404 /nfs/dbraw/zinc/47/84/04/979478404.db2.gz PHMGPJYOBIFGSF-UHFFFAOYSA-N 1 2 235.661 2.042 20 0 BEADLO C[N@@H+](CCO)Cc1cc(F)c(F)cc1Cl ZINC001236256583 979478409 /nfs/dbraw/zinc/47/84/09/979478409.db2.gz PHMGPJYOBIFGSF-UHFFFAOYSA-N 1 2 235.661 2.042 20 0 BEADLO Cc1cn2c(cccc2-c2ccc(N)nc2)[nH+]1 ZINC001236312851 979516313 /nfs/dbraw/zinc/51/63/13/979516313.db2.gz ZXPXHPFNLGCCHC-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO Nc1ccc(-c2cccc(C3COC3)c2)c[nH+]1 ZINC001236313658 979522905 /nfs/dbraw/zinc/52/29/05/979522905.db2.gz UHYHCQATJHHVIY-UHFFFAOYSA-N 1 2 226.279 2.445 20 0 BEADLO Nc1ccc(-c2ccc3c(c2)OCCN3)c[nH+]1 ZINC001236315978 979530368 /nfs/dbraw/zinc/53/03/68/979530368.db2.gz KZPMDQLGORNSCC-UHFFFAOYSA-N 1 2 227.267 2.135 20 0 BEADLO CN1CCOc2ccc(-c3ccc(N)[nH+]c3)cc21 ZINC001236318485 979532948 /nfs/dbraw/zinc/53/29/48/979532948.db2.gz RVZVSMIZRMVJHF-UHFFFAOYSA-N 1 2 241.294 2.159 20 0 BEADLO CO[C@@H](C)CNc1ccc(N2CCCC2)c[nH+]1 ZINC001182497934 979545017 /nfs/dbraw/zinc/54/50/17/979545017.db2.gz GJSPUZNPOIFPGB-NSHDSACASA-N 1 2 235.331 2.129 20 0 BEADLO Cc1ccc(C2=CCSCC2)[nH+]c1N ZINC001236362578 979557767 /nfs/dbraw/zinc/55/77/67/979557767.db2.gz OXDCFQOHOBPFSV-UHFFFAOYSA-N 1 2 206.314 2.493 20 0 BEADLO CC(C)N(CC1CCC1)C(=O)C[C@@H]([NH3+])C(F)F ZINC001341928426 979596274 /nfs/dbraw/zinc/59/62/74/979596274.db2.gz JNEGMDMPVABVOK-SNVBAGLBSA-N 1 2 248.317 2.006 20 0 BEADLO COc1ccc(-c2ccc[nH+]c2N)c2c[nH]nc21 ZINC001236464476 979603087 /nfs/dbraw/zinc/60/30/87/979603087.db2.gz WEDPCPOXYVWQMZ-UHFFFAOYSA-N 1 2 240.266 2.216 20 0 BEADLO C[C@@H]1CN(Cc2ccc(S)cc2)C[C@@H](C)[NH2+]1 ZINC001236582232 979664071 /nfs/dbraw/zinc/66/40/71/979664071.db2.gz ZYNBDBRWBWMPRS-GHMZBOCLSA-N 1 2 236.384 2.158 20 0 BEADLO CCOc1ncc(C[NH+]2CC(C)C2)cc1F ZINC001236688853 979693602 /nfs/dbraw/zinc/69/36/02/979693602.db2.gz BKBOITPMWPUOOT-UHFFFAOYSA-N 1 2 224.279 2.071 20 0 BEADLO Oc1cc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)ccc1F ZINC001236700289 979696243 /nfs/dbraw/zinc/69/62/43/979696243.db2.gz VTGCESNSPJBHGL-JBLDHEPKSA-N 1 2 239.265 2.321 20 0 BEADLO Oc1cc(C[N@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)ccc1F ZINC001236700289 979696248 /nfs/dbraw/zinc/69/62/48/979696248.db2.gz VTGCESNSPJBHGL-JBLDHEPKSA-N 1 2 239.265 2.321 20 0 BEADLO Oc1ccc(C[NH+]2CCC2)c(OC(F)(F)F)c1 ZINC001236721137 979714041 /nfs/dbraw/zinc/71/40/41/979714041.db2.gz FXWDESBMWWXXJF-UHFFFAOYSA-N 1 2 247.216 2.497 20 0 BEADLO O=c1[nH]c(Cl)c(C[NH+]2CC3(CCC3)C2)s1 ZINC001237158873 979823044 /nfs/dbraw/zinc/82/30/44/979823044.db2.gz PMEAKBOLFZNENE-UHFFFAOYSA-N 1 2 244.747 2.488 20 0 BEADLO Cc1nc2c(o1)CC[N@H+](Cc1cccc(N)c1)C2 ZINC001237222447 979850479 /nfs/dbraw/zinc/85/04/79/979850479.db2.gz BCVOHPWIGWTGAS-UHFFFAOYSA-N 1 2 243.310 2.124 20 0 BEADLO Cc1nc2c(o1)CC[N@@H+](Cc1cccc(N)c1)C2 ZINC001237222447 979850480 /nfs/dbraw/zinc/85/04/80/979850480.db2.gz BCVOHPWIGWTGAS-UHFFFAOYSA-N 1 2 243.310 2.124 20 0 BEADLO COc1c(C)cccc1C[N@@H+]1CCOC[C@H]1C ZINC001237499818 979921585 /nfs/dbraw/zinc/92/15/85/979921585.db2.gz FXJFKQKSKUCNAW-GFCCVEGCSA-N 1 2 235.327 2.224 20 0 BEADLO COc1c(C)cccc1C[N@H+]1CCOC[C@H]1C ZINC001237499818 979921590 /nfs/dbraw/zinc/92/15/90/979921590.db2.gz FXJFKQKSKUCNAW-GFCCVEGCSA-N 1 2 235.327 2.224 20 0 BEADLO CC(C)(C)CC[NH2+]C1(c2ncon2)CC1 ZINC001183991986 979925999 /nfs/dbraw/zinc/92/59/99/979925999.db2.gz PVUUUKOHOWPTCS-UHFFFAOYSA-N 1 2 209.293 2.085 20 0 BEADLO CCn1cncc1C[N@H+](CC)Cc1cccnc1 ZINC001237591868 979949683 /nfs/dbraw/zinc/94/96/83/979949683.db2.gz ZZFXRBQDPVVIPA-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CCn1cncc1C[N@@H+](CC)Cc1cccnc1 ZINC001237591868 979949688 /nfs/dbraw/zinc/94/96/88/979949688.db2.gz ZZFXRBQDPVVIPA-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO c1cc(N2CCOCC2)[nH+]cc1CC1CCC1 ZINC001250140833 979950670 /nfs/dbraw/zinc/95/06/70/979950670.db2.gz IWDNVRDPTLLOQV-UHFFFAOYSA-N 1 2 232.327 2.261 20 0 BEADLO Cc1cccnc1[C@@H](C)[NH2+][C@H]1CCn2ccnc21 ZINC001184292456 980015993 /nfs/dbraw/zinc/01/59/93/980015993.db2.gz ZSDYRGYXWXWYCC-NEPJUHHUSA-N 1 2 242.326 2.382 20 0 BEADLO CCc1n[nH]cc1C[N@@H+]1CCn2cccc2[C@@H]1C ZINC001237653058 980016118 /nfs/dbraw/zinc/01/61/18/980016118.db2.gz BCTMQMMHEGXZSW-NSHDSACASA-N 1 2 244.342 2.350 20 0 BEADLO CCc1n[nH]cc1C[N@H+]1CCn2cccc2[C@@H]1C ZINC001237653058 980016120 /nfs/dbraw/zinc/01/61/20/980016120.db2.gz BCTMQMMHEGXZSW-NSHDSACASA-N 1 2 244.342 2.350 20 0 BEADLO Cc1cccnc1[C@H](C)[NH2+][C@@H]1CCn2ccnc21 ZINC001184292457 980017017 /nfs/dbraw/zinc/01/70/17/980017017.db2.gz ZSDYRGYXWXWYCC-NWDGAFQWSA-N 1 2 242.326 2.382 20 0 BEADLO CN(C)c1cc(N[C@@H]2CCC[C@@H](F)C2)[nH+]cn1 ZINC001343153654 980024356 /nfs/dbraw/zinc/02/43/56/980024356.db2.gz JIOJBQRATASHPA-NXEZZACHSA-N 1 2 238.310 2.235 20 0 BEADLO CN(C)c1cc(N[C@@H]2CCC[C@@H](F)C2)nc[nH+]1 ZINC001343153654 980024365 /nfs/dbraw/zinc/02/43/65/980024365.db2.gz JIOJBQRATASHPA-NXEZZACHSA-N 1 2 238.310 2.235 20 0 BEADLO Cc1cnc(C[NH+]2CC(c3ccccc3)C2)nc1 ZINC001237808013 980055712 /nfs/dbraw/zinc/05/57/12/980055712.db2.gz NADLOZUFWOLKAM-UHFFFAOYSA-N 1 2 239.322 2.384 20 0 BEADLO c1ccc(OC2C[NH+](C[C@@H]3CCC=CO3)C2)cc1 ZINC001184429611 980086908 /nfs/dbraw/zinc/08/69/08/980086908.db2.gz YRNYZDQBRCAPHZ-AWEZNQCLSA-N 1 2 245.322 2.442 20 0 BEADLO Cc1ccc(O)cc1C[N@@H+]1CCC(=O)[C@@H](C)C1 ZINC001238094905 980148023 /nfs/dbraw/zinc/14/80/23/980148023.db2.gz NVDWSKVVHZVSPW-NSHDSACASA-N 1 2 233.311 2.112 20 0 BEADLO Cc1ccc(O)cc1C[N@H+]1CCC(=O)[C@@H](C)C1 ZINC001238094905 980148030 /nfs/dbraw/zinc/14/80/30/980148030.db2.gz NVDWSKVVHZVSPW-NSHDSACASA-N 1 2 233.311 2.112 20 0 BEADLO CC1(CC(=O)NCCOc2cc[nH+]cc2)CCC1 ZINC001185111934 980180272 /nfs/dbraw/zinc/18/02/72/980180272.db2.gz CBLZPYXPKIWGAB-UHFFFAOYSA-N 1 2 248.326 2.157 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cncc(C3CC3)c2)CCO1 ZINC001238181141 980215930 /nfs/dbraw/zinc/21/59/30/980215930.db2.gz DIXMDERZLPXWPE-LLVKDONJSA-N 1 2 232.327 2.180 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cncc(C3CC3)c2)CCO1 ZINC001238181141 980215937 /nfs/dbraw/zinc/21/59/37/980215937.db2.gz DIXMDERZLPXWPE-LLVKDONJSA-N 1 2 232.327 2.180 20 0 BEADLO Cn1c[nH+]cc1CNc1ccc(C(C)(C)C)nn1 ZINC001343723493 980222713 /nfs/dbraw/zinc/22/27/13/980222713.db2.gz YTTDWWJGKKTDLC-UHFFFAOYSA-N 1 2 245.330 2.120 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1cc(C)c(Cl)cn1 ZINC001238421542 980250773 /nfs/dbraw/zinc/25/07/73/980250773.db2.gz IKDCEKCSZQQFGJ-LLVKDONJSA-N 1 2 240.734 2.264 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1cc(C)c(Cl)cn1 ZINC001238421542 980250782 /nfs/dbraw/zinc/25/07/82/980250782.db2.gz IKDCEKCSZQQFGJ-LLVKDONJSA-N 1 2 240.734 2.264 20 0 BEADLO CC[N@H+](Cc1cc(C)c(Cl)cn1)C1COC1 ZINC001238422539 980253460 /nfs/dbraw/zinc/25/34/60/980253460.db2.gz NTMKXYJUSKNPGB-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO CC[N@@H+](Cc1cc(C)c(Cl)cn1)C1COC1 ZINC001238422539 980253467 /nfs/dbraw/zinc/25/34/67/980253467.db2.gz NTMKXYJUSKNPGB-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO Cc1cc(C[N@@H+](C)C2COC2)cnc1C1CC1 ZINC001238618870 980301707 /nfs/dbraw/zinc/30/17/07/980301707.db2.gz WRSUXOJXKVIFIN-UHFFFAOYSA-N 1 2 232.327 2.098 20 0 BEADLO Cc1cc(C[N@H+](C)C2COC2)cnc1C1CC1 ZINC001238618870 980301717 /nfs/dbraw/zinc/30/17/17/980301717.db2.gz WRSUXOJXKVIFIN-UHFFFAOYSA-N 1 2 232.327 2.098 20 0 BEADLO Cc1cc(C[NH+]2CC(O)C2)cc(C)c1OC(C)C ZINC001238754454 980318495 /nfs/dbraw/zinc/31/84/95/980318495.db2.gz HSYMSYJQKGRNHE-UHFFFAOYSA-N 1 2 249.354 2.267 20 0 BEADLO C[C@H]1C[N@H+](Cc2cccn2C2CC2)CCO1 ZINC001344060774 980332725 /nfs/dbraw/zinc/33/27/25/980332725.db2.gz FZACCOJPUVKMSG-NSHDSACASA-N 1 2 220.316 2.044 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cccn2C2CC2)CCO1 ZINC001344060774 980332734 /nfs/dbraw/zinc/33/27/34/980332734.db2.gz FZACCOJPUVKMSG-NSHDSACASA-N 1 2 220.316 2.044 20 0 BEADLO FC(F)n1cc(-c2cc[nH+]c3c2CCN3)cn1 ZINC001238870459 980356143 /nfs/dbraw/zinc/35/61/43/980356143.db2.gz VIVRVSURBQPHGJ-UHFFFAOYSA-N 1 2 236.225 2.308 20 0 BEADLO C=Cc1ccc(C(=O)N(CC)C2C[NH+](C)C2)cc1 ZINC001186513738 980387179 /nfs/dbraw/zinc/38/71/79/980387179.db2.gz PLBZKXODQSPGLF-UHFFFAOYSA-N 1 2 244.338 2.106 20 0 BEADLO COc1cc2[nH+]c[nH]c2cc1C=CC(C)(C)O ZINC001239156546 980469174 /nfs/dbraw/zinc/46/91/74/980469174.db2.gz QQAGRNWMWSEQEG-SNAWJCMRSA-N 1 2 232.283 2.356 20 0 BEADLO COCCn1cc(Nc2cc(C)c[nH+]c2C)cn1 ZINC001203655781 980492354 /nfs/dbraw/zinc/49/23/54/980492354.db2.gz ABKXEPSJFQHAMQ-UHFFFAOYSA-N 1 2 246.314 2.285 20 0 BEADLO CC[C@H]1CCCCN1C(=O)CCc1[nH+]ccn1C ZINC001345480082 980618855 /nfs/dbraw/zinc/61/88/55/980618855.db2.gz ZSGQOXIGBJIVEO-LBPRGKRZSA-N 1 2 249.358 2.144 20 0 BEADLO C[NH+](C)Cc1nnc(C=C2CCSCC2)o1 ZINC001345528441 980624934 /nfs/dbraw/zinc/62/49/34/980624934.db2.gz DJKDEAQTJGEQCH-UHFFFAOYSA-N 1 2 239.344 2.042 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)CCc2[nH+]ccn2C)C1 ZINC001345589030 980637760 /nfs/dbraw/zinc/63/77/60/980637760.db2.gz RQHKFBXPUFTOFY-NEPJUHHUSA-N 1 2 249.358 2.048 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)c1cc(F)c[nH]1 ZINC001188475653 980651255 /nfs/dbraw/zinc/65/12/55/980651255.db2.gz JZGVCXCRSSKMKO-UHFFFAOYSA-N 1 2 244.229 2.054 20 0 BEADLO CC(C)Oc1cc(CCn2cc[nH+]c2)ccn1 ZINC001250320567 980761814 /nfs/dbraw/zinc/76/18/14/980761814.db2.gz PCWIWFCIBQGCMU-UHFFFAOYSA-N 1 2 231.299 2.308 20 0 BEADLO Cn1c[nH+]cc1CCCOC(=O)C[C@H]1C=CCC1 ZINC001346227132 980792444 /nfs/dbraw/zinc/79/24/44/980792444.db2.gz QMABEGWHCTURLK-LBPRGKRZSA-N 1 2 248.326 2.252 20 0 BEADLO O[C@H](C[NH2+]CC(F)F)c1cccc(Cl)c1 ZINC001346226969 980792819 /nfs/dbraw/zinc/79/28/19/980792819.db2.gz ZHKGSMBCOICZQS-SECBINFHSA-N 1 2 235.661 2.228 20 0 BEADLO c1cc(-c2c[nH+]c3c(c2)CCCN3)ccn1 ZINC001239612784 980810994 /nfs/dbraw/zinc/81/09/94/980810994.db2.gz WMXJYVGBNSWUQF-UHFFFAOYSA-N 1 2 211.268 2.144 20 0 BEADLO CC(C)CCCCNC(=O)[C@H](C)n1cc[nH+]c1 ZINC000077030836 980816015 /nfs/dbraw/zinc/81/60/15/980816015.db2.gz NVHKDUCTUIVJPY-LBPRGKRZSA-N 1 2 237.347 2.387 20 0 BEADLO CC[C@@H](C)NC(=O)c1ccccc1-n1cc[nH+]c1 ZINC001190108195 980846772 /nfs/dbraw/zinc/84/67/72/980846772.db2.gz ZZMRNDKXTHGUNV-LLVKDONJSA-N 1 2 243.310 2.401 20 0 BEADLO CC(C)N(C)C(=O)c1ccccc1-n1cc[nH+]c1 ZINC001190074291 980848196 /nfs/dbraw/zinc/84/81/96/980848196.db2.gz BLWDIKBDSDBUNN-UHFFFAOYSA-N 1 2 243.310 2.353 20 0 BEADLO C[NH+](C)Cc1nnc([C@@H]2CCC(C)(C)C2)o1 ZINC001346625303 980870243 /nfs/dbraw/zinc/87/02/43/980870243.db2.gz DNFRTXQQCBPAMT-SECBINFHSA-N 1 2 223.320 2.425 20 0 BEADLO c1ccc(C[NH+]2CC(OCC3CC3)C2)cc1 ZINC001205534443 980890016 /nfs/dbraw/zinc/89/00/16/980890016.db2.gz TYHQEZRSOROMJK-UHFFFAOYSA-N 1 2 217.312 2.297 20 0 BEADLO CCCCNC(=O)Nc1cccc2[nH+]ccn21 ZINC001190582490 980891655 /nfs/dbraw/zinc/89/16/55/980891655.db2.gz QZDFOHSZEBSKFK-UHFFFAOYSA-N 1 2 232.287 2.256 20 0 BEADLO COc1cc2ccccc2cc1C[NH+]1CC(O)C1 ZINC000335477957 980894172 /nfs/dbraw/zinc/89/41/72/980894172.db2.gz ZVYMLIVSWQZRLF-UHFFFAOYSA-N 1 2 243.306 2.025 20 0 BEADLO CC(=O)Nc1ccc(-c2ccc(N)[nH+]c2)cc1 ZINC001239756906 980898662 /nfs/dbraw/zinc/89/86/62/980898662.db2.gz UNVAINSYGVPKDO-UHFFFAOYSA-N 1 2 227.267 2.289 20 0 BEADLO Cc1cc(N[C@@H](C)CCO)nc(C(C)(C)C)[nH+]1 ZINC000077988010 981007197 /nfs/dbraw/zinc/00/71/97/981007197.db2.gz IFOPYAOFJHZMKB-VIFPVBQESA-N 1 2 237.347 2.265 20 0 BEADLO Cc1cc[nH+]c(C)c1-c1cccc(C(N)=O)c1 ZINC001239885115 981020532 /nfs/dbraw/zinc/02/05/32/981020532.db2.gz UCZYKHRPQWPRJF-UHFFFAOYSA-N 1 2 226.279 2.464 20 0 BEADLO Fc1cccc([C@@H]2CC[N@@H+]2CC2=NOCC2)c1 ZINC001191390807 981020470 /nfs/dbraw/zinc/02/04/70/981020470.db2.gz QEKSGJQSHPIMHQ-ZDUSSCGKSA-N 1 2 234.274 2.349 20 0 BEADLO Fc1cccc([C@@H]2CC[N@H+]2CC2=NOCC2)c1 ZINC001191390807 981020473 /nfs/dbraw/zinc/02/04/73/981020473.db2.gz QEKSGJQSHPIMHQ-ZDUSSCGKSA-N 1 2 234.274 2.349 20 0 BEADLO C[C@@H](C(=O)N1CCC[C@H](C2CC2)C1)n1cc[nH+]c1 ZINC001347513570 981106605 /nfs/dbraw/zinc/10/66/05/981106605.db2.gz IHGSVQBPFKBMQY-AAEUAGOBSA-N 1 2 247.342 2.093 20 0 BEADLO CC(C)NC(=O)c1cccc(-c2c[nH+]cn2C)c1 ZINC001240079811 981111011 /nfs/dbraw/zinc/11/10/11/981111011.db2.gz BJLLVSHQPGHMNH-UHFFFAOYSA-N 1 2 243.310 2.225 20 0 BEADLO C[C@@H](C(=O)N[C@@H]1CC2CCC1CC2)n1cc[nH+]c1 ZINC001347729999 981155096 /nfs/dbraw/zinc/15/50/96/981155096.db2.gz YZTHHPDTOXVCCE-YWPUVAFDSA-N 1 2 247.342 2.139 20 0 BEADLO CN(C)c1cccc(-c2ccc3[nH+]ccn3c2)n1 ZINC001240214242 981161756 /nfs/dbraw/zinc/16/17/56/981161756.db2.gz MHOAZRANWNBQLY-UHFFFAOYSA-N 1 2 238.294 2.462 20 0 BEADLO Cc1cc(-c2ccc3[nH+]ccn3c2)ncn1 ZINC001240214988 981163214 /nfs/dbraw/zinc/16/32/14/981163214.db2.gz NNNUZTTVSVFAOI-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO c1cn2cc(-c3cc4c(nn3)CCC4)ccc2[nH+]1 ZINC001240217298 981166783 /nfs/dbraw/zinc/16/67/83/981166783.db2.gz LPENCQSYAUJPLP-UHFFFAOYSA-N 1 2 236.278 2.280 20 0 BEADLO Cc1ncc(-c2ccc3[nH+]ccn3c2)cn1 ZINC001240217998 981167351 /nfs/dbraw/zinc/16/73/51/981167351.db2.gz VPDDYQPCJQPZDW-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO Cc1ncc(-c2ccc3[nH+]ccn3c2)c(C)n1 ZINC001240218409 981168777 /nfs/dbraw/zinc/16/87/77/981168777.db2.gz MUSOSDVIGKCHDF-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO c1cn2cc(-c3cccc4ncnn43)ccc2[nH+]1 ZINC001240219825 981171020 /nfs/dbraw/zinc/17/10/20/981171020.db2.gz WCJNZCGXVKVVTE-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO Cc1ccc(-c2cc[nH+]c3c2CCN3)cn1 ZINC001240226922 981185983 /nfs/dbraw/zinc/18/59/83/981185983.db2.gz RWBBKSSMLLZFRV-UHFFFAOYSA-N 1 2 211.268 2.420 20 0 BEADLO CCc1ccc(N2CCO[C@H](C)[C@@H]2C)[nH+]c1 ZINC001348041694 981260673 /nfs/dbraw/zinc/26/06/73/981260673.db2.gz CGGKIOFVJXXAQN-WDEREUQCSA-N 1 2 220.316 2.258 20 0 BEADLO Cn1ncc2ccc(-c3nc4[nH]ccc4c[nH+]3)cc21 ZINC001240305218 981272175 /nfs/dbraw/zinc/27/21/75/981272175.db2.gz PMFUNRDHXDELRH-UHFFFAOYSA-N 1 2 249.277 2.463 20 0 BEADLO Cn1ccc(C[NH+]2CC(c3ccc(F)cc3)C2)n1 ZINC001348075392 981273282 /nfs/dbraw/zinc/27/32/82/981273282.db2.gz QIOQDXKVLRVJPN-UHFFFAOYSA-N 1 2 245.301 2.159 20 0 BEADLO C[C@@H]1CN(c2cc(N)nc[nH+]2)[C@@H]2CCCC[C@H]21 ZINC001348084416 981277023 /nfs/dbraw/zinc/27/70/23/981277023.db2.gz OJFIMZGRCOGLTM-OUAUKWLOSA-N 1 2 232.331 2.074 20 0 BEADLO Cc1c(-c2ccc(=O)n(C)c2)ccc2[nH+]ccn21 ZINC001240334188 981304527 /nfs/dbraw/zinc/30/45/27/981304527.db2.gz DTBKSMSPIYKAHB-UHFFFAOYSA-N 1 2 239.278 2.008 20 0 BEADLO C[NH+](C)Cc1c(F)cc(-c2cncnc2)cc1F ZINC001240378614 981333914 /nfs/dbraw/zinc/33/39/14/981333914.db2.gz HZDJMQTZVWAKQL-UHFFFAOYSA-N 1 2 249.264 2.483 20 0 BEADLO Cc1cccn2c(CNC(=O)OC(C)C)c[nH+]c12 ZINC001193499235 981354912 /nfs/dbraw/zinc/35/49/12/981354912.db2.gz SRFHXAVHRVJXLL-UHFFFAOYSA-N 1 2 247.298 2.277 20 0 BEADLO c1cc2ncc(-c3cccc4[nH+]ccn43)cn2n1 ZINC001240428589 981381020 /nfs/dbraw/zinc/38/10/20/981381020.db2.gz HGPUCLRNZBSPTM-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO COC(=O)c1ccc(/C(C)=C/C=C/[NH3+])cc1OC ZINC001240445055 981389929 /nfs/dbraw/zinc/38/99/29/981389929.db2.gz RTHPCTOJFNNTEN-DXNUHORPSA-N 1 2 247.294 2.358 20 0 BEADLO CC[C@@H](C)Cc1noc([C@H](C)n2cc[nH+]c2)n1 ZINC001348573327 981396003 /nfs/dbraw/zinc/39/60/03/981396003.db2.gz GNRPNOXJPRYDCV-ZJUUUORDSA-N 1 2 234.303 2.464 20 0 BEADLO c1cc2ncnc(-c3ccn4cc[nH+]c4c3)c2[nH]1 ZINC001240496144 981415311 /nfs/dbraw/zinc/41/53/11/981415311.db2.gz ILPWADDRODYSBJ-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO C=Cc1cnc(-c2ccn3cc[nH+]c3c2)nc1 ZINC001240497573 981417283 /nfs/dbraw/zinc/41/72/83/981417283.db2.gz UUQXULRTDHOWOI-UHFFFAOYSA-N 1 2 222.251 2.434 20 0 BEADLO c1cn2ccc(-c3ncnc4c3CCC4)cc2[nH+]1 ZINC001240496378 981417498 /nfs/dbraw/zinc/41/74/98/981417498.db2.gz LGOBPQYCOMKSAI-UHFFFAOYSA-N 1 2 236.278 2.280 20 0 BEADLO c1cn2ccc(-c3ncnc4cccnc43)cc2[nH+]1 ZINC001240497327 981418066 /nfs/dbraw/zinc/41/80/66/981418066.db2.gz WXXOLXZFKFRYDJ-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO c1cc2ncc(-c3ccn4cc[nH+]c4c3)nc2[nH]1 ZINC001240496620 981418254 /nfs/dbraw/zinc/41/82/54/981418254.db2.gz OQQWDWREHTUMAN-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO Nc1cc(-c2ccn3cc[nH+]c3c2)ncc1F ZINC001240496813 981418749 /nfs/dbraw/zinc/41/87/49/981418749.db2.gz IVIKXHHYHPBNEW-UHFFFAOYSA-N 1 2 228.230 2.118 20 0 BEADLO C[C@@H]1CCCN(C(=O)CCc2[nH+]ccn2C)CC1 ZINC001348713562 981423551 /nfs/dbraw/zinc/42/35/51/981423551.db2.gz ZFOVCGFZWQUTOL-GFCCVEGCSA-N 1 2 249.358 2.001 20 0 BEADLO Cc1nc2ccc(-c3ccn4cc[nH+]c4c3)cn2n1 ZINC001240509061 981434806 /nfs/dbraw/zinc/43/48/06/981434806.db2.gz PPXKIPANLDBXIX-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO Cc1nnc2ccc(-c3ccn4cc[nH+]c4c3)cn12 ZINC001240512701 981438296 /nfs/dbraw/zinc/43/82/96/981438296.db2.gz XWFYDTBPVHZGEW-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO CCCNc1cc(N[C@@H]2C[C@@H]3CC[C@H]2O3)nc[nH+]1 ZINC001348779709 981441342 /nfs/dbraw/zinc/44/13/42/981441342.db2.gz QAVAEESCZKZXFT-HBNTYKKESA-N 1 2 248.330 2.030 20 0 BEADLO CCCNc1cc(N[C@@H]2C[C@@H]3CC[C@H]2O3)[nH+]cn1 ZINC001348779709 981441345 /nfs/dbraw/zinc/44/13/45/981441345.db2.gz QAVAEESCZKZXFT-HBNTYKKESA-N 1 2 248.330 2.030 20 0 BEADLO c1cn2ccc(-c3cc[nH+]c4c3CCN4)cc2n1 ZINC001240517724 981446023 /nfs/dbraw/zinc/44/60/23/981446023.db2.gz CQUAQKAWSAINMI-UHFFFAOYSA-N 1 2 236.278 2.364 20 0 BEADLO Cc1cc(-c2ccc(N)cc2F)c[nH+]c1N ZINC001240528209 981466314 /nfs/dbraw/zinc/46/63/14/981466314.db2.gz QQRPMPPTEOGBEO-UHFFFAOYSA-N 1 2 217.247 2.361 20 0 BEADLO Fc1cccc(C[N@@H+]2C[C@H]3CC[C@@H]2CO3)c1 ZINC001203788548 981547572 /nfs/dbraw/zinc/54/75/72/981547572.db2.gz NSXUSVPJYSCUOQ-CHWSQXEVSA-N 1 2 221.275 2.189 20 0 BEADLO Fc1cccc(C[N@H+]2C[C@H]3CC[C@@H]2CO3)c1 ZINC001203788548 981547586 /nfs/dbraw/zinc/54/75/86/981547586.db2.gz NSXUSVPJYSCUOQ-CHWSQXEVSA-N 1 2 221.275 2.189 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cnn([C@@H]2CCCCO2)c1 ZINC001240677447 981583141 /nfs/dbraw/zinc/58/31/41/981583141.db2.gz MJYJYTFTRJZDBC-ABXCDXNGSA-N 1 2 233.315 2.458 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cnn([C@H]2CCCCO2)c1 ZINC001240677454 981585849 /nfs/dbraw/zinc/58/58/49/981585849.db2.gz MJYJYTFTRJZDBC-AGJGZZINSA-N 1 2 233.315 2.458 20 0 BEADLO C[C@H](CO)[N@H+](C)Cc1nccc(Cl)c1Cl ZINC001194298923 981631134 /nfs/dbraw/zinc/63/11/34/981631134.db2.gz BGXKVTHHWALGSV-SSDOTTSWSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@H](CO)[N@@H+](C)Cc1nccc(Cl)c1Cl ZINC001194298923 981631156 /nfs/dbraw/zinc/63/11/56/981631156.db2.gz BGXKVTHHWALGSV-SSDOTTSWSA-N 1 2 249.141 2.201 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1CCC[C@H](F)C1 ZINC001349775562 981728665 /nfs/dbraw/zinc/72/86/65/981728665.db2.gz HCVUAUCXZUBBOO-DTWKUNHWSA-N 1 2 212.243 2.335 20 0 BEADLO CC[C@@H](C)CC(=O)Nc1c(C)c[nH+]cc1C ZINC001349793365 981745191 /nfs/dbraw/zinc/74/51/91/981745191.db2.gz YGTWLUMAZDSWHD-SECBINFHSA-N 1 2 220.316 2.495 20 0 BEADLO CC/C(C)=C(\C)c1nnc(C[NH+](C)C)o1 ZINC001349948407 981824293 /nfs/dbraw/zinc/82/42/93/981824293.db2.gz XUEUPPLNTUTPAZ-CMDGGOBGSA-N 1 2 209.293 2.335 20 0 BEADLO Nc1cn2ccc(-c3ccc(O)c(F)c3)cc2[nH+]1 ZINC001240785481 981825033 /nfs/dbraw/zinc/82/50/33/981825033.db2.gz AXBZTUUFTOCGIZ-UHFFFAOYSA-N 1 2 243.241 2.428 20 0 BEADLO C=C/C=C\CC(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC001583786647 981836933 /nfs/dbraw/zinc/83/69/33/981836933.db2.gz DNGSXSZZEFABCT-ARJAWSKDSA-N 1 2 245.326 2.248 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)Nc1c(C)c[nH+]cc1C ZINC001584256900 981860820 /nfs/dbraw/zinc/86/08/20/981860820.db2.gz KJEBZWGGIRJGBA-VXGBXAGGSA-N 1 2 232.327 2.495 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)c1ccsn1 ZINC001584330151 981865431 /nfs/dbraw/zinc/86/54/31/981865431.db2.gz LVFWOIZFQLRQTN-UHFFFAOYSA-N 1 2 244.279 2.043 20 0 BEADLO Cc1cc(-c2cc(C)c3[nH+]ccn3c2)n(C)n1 ZINC001240858883 981898389 /nfs/dbraw/zinc/89/83/89/981898389.db2.gz WLPWCYMYPVVBJD-UHFFFAOYSA-N 1 2 226.283 2.352 20 0 BEADLO CCOc1ccc[nH+]c1NCC(C)(C)OC ZINC000159264862 981913107 /nfs/dbraw/zinc/91/31/07/981913107.db2.gz SPKDGYICOLMQHM-UHFFFAOYSA-N 1 2 224.304 2.317 20 0 BEADLO CC(C)[C@H]([NH2+]Cc1nnc[nH]1)c1ccc(F)cc1 ZINC001350364920 981942791 /nfs/dbraw/zinc/94/27/91/981942791.db2.gz OIJDQJUOPNVFQW-ZDUSSCGKSA-N 1 2 248.305 2.431 20 0 BEADLO c1nnc(C[NH2+][C@@H](CC2CC2)c2ccccc2)[nH]1 ZINC001350371474 981949562 /nfs/dbraw/zinc/94/95/62/981949562.db2.gz NHACTTZAWDWDMB-ZDUSSCGKSA-N 1 2 242.326 2.436 20 0 BEADLO O=C(Nc1ccccc1-n1cc[nH+]c1)OCCF ZINC001194929506 981970065 /nfs/dbraw/zinc/97/00/65/981970065.db2.gz MMNIVXDBUFBATE-UHFFFAOYSA-N 1 2 249.245 2.390 20 0 BEADLO CC[C@@H](C)C[C@H](C)NC(=O)Cc1[nH]c[nH+]c1C ZINC001586816089 982022426 /nfs/dbraw/zinc/02/24/26/982022426.db2.gz JEXFPELXZJRCRL-ZJUUUORDSA-N 1 2 237.347 2.202 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2occc(=O)c2c1 ZINC001240967785 982044687 /nfs/dbraw/zinc/04/46/87/982044687.db2.gz IBUFVMPFIDOSRA-UHFFFAOYSA-N 1 2 226.235 2.194 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2occc(=O)c2c1 ZINC001240968801 982046395 /nfs/dbraw/zinc/04/63/95/982046395.db2.gz XKJQCRKJRFFZGN-UHFFFAOYSA-N 1 2 238.246 2.437 20 0 BEADLO CC[C@@H](C)OC(=O)N(CC)CCn1cc[nH+]c1 ZINC001195111818 982095960 /nfs/dbraw/zinc/09/59/60/982095960.db2.gz KEUKQFJUSWTOSA-LLVKDONJSA-N 1 2 239.319 2.140 20 0 BEADLO COc1cc(-c2c[nH+]cn2C)ccc1C ZINC001241034409 982134406 /nfs/dbraw/zinc/13/44/06/982134406.db2.gz QJXOALLGCFFSFC-UHFFFAOYSA-N 1 2 202.257 2.404 20 0 BEADLO CCNC(=S)Nc1ccccc1-n1cc[nH+]c1 ZINC001195300141 982185551 /nfs/dbraw/zinc/18/55/51/982185551.db2.gz KHGOQVOVTAGQPN-UHFFFAOYSA-N 1 2 246.339 2.179 20 0 BEADLO CN(C)c1cc(-c2ccccc2N)cc[nH+]1 ZINC001241072312 982191107 /nfs/dbraw/zinc/19/11/07/982191107.db2.gz JBUJUXCHNQVLFN-UHFFFAOYSA-N 1 2 213.284 2.397 20 0 BEADLO COc1nccc(-c2cc[nH+]c(N)c2)c1C ZINC001241170106 982259077 /nfs/dbraw/zinc/25/90/77/982259077.db2.gz DSSRAABDVZCHDT-UHFFFAOYSA-N 1 2 215.256 2.043 20 0 BEADLO Nc1cc(-c2cccc3c2CCN3)cc[nH+]1 ZINC001241163374 982303317 /nfs/dbraw/zinc/30/33/17/982303317.db2.gz NKMAZDHZSXNZTI-UHFFFAOYSA-N 1 2 211.268 2.299 20 0 BEADLO COC(=O)c1cccc(-c2cc[nH+]c(N)c2)c1C ZINC001241164079 982305666 /nfs/dbraw/zinc/30/56/66/982305666.db2.gz UVNZVWXWNXHTSP-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO Nc1cc(-c2cccc3oncc32)cc[nH+]1 ZINC001241163508 982306157 /nfs/dbraw/zinc/30/61/57/982306157.db2.gz VKTWDRSCEGJBPD-UHFFFAOYSA-N 1 2 211.224 2.472 20 0 BEADLO Cc1c2cc[nH]c2ncc1-c1cc[nH+]c(N)c1 ZINC001241163682 982307121 /nfs/dbraw/zinc/30/71/21/982307121.db2.gz YEOXVOOQFZSWIB-UHFFFAOYSA-N 1 2 224.267 2.467 20 0 BEADLO Nc1cc(-c2cnc3ccoc3c2)cc[nH+]1 ZINC001241163763 982307866 /nfs/dbraw/zinc/30/78/66/982307866.db2.gz ZOQDHVHGADFWFY-UHFFFAOYSA-N 1 2 211.224 2.472 20 0 BEADLO Cc1cc(C(N)=O)cc(C)c1-c1cc[nH+]c(N)c1 ZINC001241169760 982309896 /nfs/dbraw/zinc/30/98/96/982309896.db2.gz OIPCGOWSNGASIL-UHFFFAOYSA-N 1 2 241.294 2.047 20 0 BEADLO Nc1cc(-c2ccc3nnccc3c2)cc[nH+]1 ZINC001241171234 982321503 /nfs/dbraw/zinc/32/15/03/982321503.db2.gz ZUMQUQFCXCLTDK-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO COc1cc(-c2cc[nH+]c(N)c2)cc(C)n1 ZINC001241175779 982326011 /nfs/dbraw/zinc/32/60/11/982326011.db2.gz MJCNNGNTDWRDQR-UHFFFAOYSA-N 1 2 215.256 2.043 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc2c(c1)OCC2 ZINC001241219927 982358057 /nfs/dbraw/zinc/35/80/57/982358057.db2.gz KBYLSSYVKCIHRX-GBWIQOKOSA-N 1 2 201.269 2.497 20 0 BEADLO C[C@H](C(=O)N1CCCC2(CC2)CC1)n1cc[nH+]c1 ZINC001351679941 982359397 /nfs/dbraw/zinc/35/93/97/982359397.db2.gz RJABGDZRPKIGMI-GFCCVEGCSA-N 1 2 247.342 2.237 20 0 BEADLO CO[C@H]1CC[C@@H]1[N@H+](C)Cc1ncoc1C(C)C ZINC001351737553 982368570 /nfs/dbraw/zinc/36/85/70/982368570.db2.gz YNASGILCDQZOGG-RYUDHWBXSA-N 1 2 238.331 2.407 20 0 BEADLO CO[C@H]1CC[C@@H]1[N@@H+](C)Cc1ncoc1C(C)C ZINC001351737553 982368585 /nfs/dbraw/zinc/36/85/85/982368585.db2.gz YNASGILCDQZOGG-RYUDHWBXSA-N 1 2 238.331 2.407 20 0 BEADLO CO[C@H]1CC[C@H]1[N@H+](C)Cc1ncoc1C(C)C ZINC001351737551 982370944 /nfs/dbraw/zinc/37/09/44/982370944.db2.gz YNASGILCDQZOGG-NEPJUHHUSA-N 1 2 238.331 2.407 20 0 BEADLO CO[C@H]1CC[C@H]1[N@@H+](C)Cc1ncoc1C(C)C ZINC001351737551 982370958 /nfs/dbraw/zinc/37/09/58/982370958.db2.gz YNASGILCDQZOGG-NEPJUHHUSA-N 1 2 238.331 2.407 20 0 BEADLO CCc1cncnc1-c1c[nH+]c(N(C)C)cc1C ZINC001241233866 982385321 /nfs/dbraw/zinc/38/53/21/982385321.db2.gz UTBHUTSBGJPXTI-UHFFFAOYSA-N 1 2 242.326 2.475 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1cnc(F)nc1 ZINC001241243982 982385657 /nfs/dbraw/zinc/38/56/57/982385657.db2.gz QDMVJSDVEOWRMW-UHFFFAOYSA-N 1 2 232.262 2.052 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1cccnc1N ZINC001241243502 982386648 /nfs/dbraw/zinc/38/66/48/982386648.db2.gz IGGKXNIUZPPGHX-UHFFFAOYSA-N 1 2 228.299 2.100 20 0 BEADLO C[C@@H](C(=O)N1CC[C@@H]1C1CCCC1)n1cc[nH+]c1 ZINC001351842122 982398604 /nfs/dbraw/zinc/39/86/04/982398604.db2.gz JLMSCHHZXPHSEE-WCQYABFASA-N 1 2 247.342 2.235 20 0 BEADLO Cn1nccc1[C@H]1CCCN1c1cccc[nH+]1 ZINC001352080936 982458204 /nfs/dbraw/zinc/45/82/04/982458204.db2.gz ZQYRSWJNMCSVEK-GFCCVEGCSA-N 1 2 228.299 2.157 20 0 BEADLO CC1(C)C[N@H+](Cc2cccc(O)c2)CCC1=O ZINC001203862224 982501212 /nfs/dbraw/zinc/50/12/12/982501212.db2.gz BTADRUNNNNZVND-UHFFFAOYSA-N 1 2 233.311 2.193 20 0 BEADLO CC1(C)C[N@@H+](Cc2cccc(O)c2)CCC1=O ZINC001203862224 982501219 /nfs/dbraw/zinc/50/12/19/982501219.db2.gz BTADRUNNNNZVND-UHFFFAOYSA-N 1 2 233.311 2.193 20 0 BEADLO CNc1cc(-c2cnc3n[nH]cc3c2)cc[nH+]1 ZINC001241426489 982580356 /nfs/dbraw/zinc/58/03/56/982580356.db2.gz DRLLODCFRBDZBG-UHFFFAOYSA-N 1 2 225.255 2.062 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2c(c1)NCCO2 ZINC001241474862 982617590 /nfs/dbraw/zinc/61/75/90/982617590.db2.gz YUJXXPVFUPHSCY-UHFFFAOYSA-N 1 2 227.267 2.135 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc2c(c1)NCCO2 ZINC001241479538 982634914 /nfs/dbraw/zinc/63/49/14/982634914.db2.gz ANSOYTYSARJIRG-ZRSOPRJESA-N 1 2 216.284 2.367 20 0 BEADLO C[S@](=O)c1ccc(-c2ccc(N)[nH+]c2)cc1 ZINC001241485043 982640079 /nfs/dbraw/zinc/64/00/79/982640079.db2.gz XFNNDGDTBRKBCT-INIZCTEOSA-N 1 2 232.308 2.068 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2nccnc2c1 ZINC001241490686 982643509 /nfs/dbraw/zinc/64/35/09/982643509.db2.gz KRGYJPQBMDVXQO-UHFFFAOYSA-N 1 2 210.240 2.030 20 0 BEADLO c1cn(-c2ccnc(-c3cncs3)c2)c[nH+]1 ZINC001241497140 982651893 /nfs/dbraw/zinc/65/18/93/982651893.db2.gz OBMJDBQEZXPEOC-UHFFFAOYSA-N 1 2 228.280 2.391 20 0 BEADLO CN(C)c1cc(-c2ccc(N)cc2)cc[nH+]1 ZINC001241542458 982735783 /nfs/dbraw/zinc/73/57/83/982735783.db2.gz GJUKQZHJTNRMJP-UHFFFAOYSA-N 1 2 213.284 2.397 20 0 BEADLO CCOc1ncc(-c2cccc3[nH+]ccn32)cn1 ZINC001241550532 982766807 /nfs/dbraw/zinc/76/68/07/982766807.db2.gz CWWBFKZGBANQDG-UHFFFAOYSA-N 1 2 240.266 2.190 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC12CCC(CC1)C2 ZINC000847716888 982871542 /nfs/dbraw/zinc/87/15/42/982871542.db2.gz RYUQKGNXLJGKNT-CDWSIMAYSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC12CCC(CC1)C2 ZINC000847716888 982871548 /nfs/dbraw/zinc/87/15/48/982871548.db2.gz RYUQKGNXLJGKNT-CDWSIMAYSA-N 1 2 247.342 2.037 20 0 BEADLO COc1cc(/C(C)=C/C=C/[NH3+])c(F)cn1 ZINC001241664535 982897681 /nfs/dbraw/zinc/89/76/81/982897681.db2.gz XBMTWXOWPVDFTK-MSLMYCKWSA-N 1 2 208.236 2.105 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@H]2CC23CCCC3)[nH+]c1C ZINC001353888230 983054502 /nfs/dbraw/zinc/05/45/02/983054502.db2.gz UHSICIDRCXAIKJ-LLVKDONJSA-N 1 2 247.342 2.223 20 0 BEADLO CC(C)(C)[C@H]1CCN1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC001353979502 983108220 /nfs/dbraw/zinc/10/82/20/983108220.db2.gz UNJIDYCCJAYIIT-CKYFFXLPSA-N 1 2 247.342 2.160 20 0 BEADLO CC(C)(C)[C@H]1CCN1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC001353979502 983108225 /nfs/dbraw/zinc/10/82/25/983108225.db2.gz UNJIDYCCJAYIIT-CKYFFXLPSA-N 1 2 247.342 2.160 20 0 BEADLO Nc1ccc2ccn(-c3ccc(N)[nH+]c3)c2c1 ZINC001201283857 983156376 /nfs/dbraw/zinc/15/63/76/983156376.db2.gz HKQGSHLZNCXKCD-UHFFFAOYSA-N 1 2 224.267 2.190 20 0 BEADLO COc1ccc(Nc2ccc(N)[nH+]c2)cc1O ZINC001201283816 983156966 /nfs/dbraw/zinc/15/69/66/983156966.db2.gz GPLSUBVRDKBBPY-UHFFFAOYSA-N 1 2 231.255 2.122 20 0 BEADLO Nc1ccc(Nc2cc(O)c(F)c(F)c2)c[nH+]1 ZINC001201285138 983161690 /nfs/dbraw/zinc/16/16/90/983161690.db2.gz BDALNNCYUXEIGI-UHFFFAOYSA-N 1 2 237.209 2.391 20 0 BEADLO Nc1ccc(Nc2ccc(CO)cc2F)c[nH+]1 ZINC001201287140 983166020 /nfs/dbraw/zinc/16/60/20/983166020.db2.gz VOTUKMSOEBDFAT-UHFFFAOYSA-N 1 2 233.246 2.039 20 0 BEADLO CC(=O)Nc1ccc(Nc2ccc(N)[nH+]c2)cc1 ZINC001201287203 983166729 /nfs/dbraw/zinc/16/67/29/983166729.db2.gz YVWRSOMQTCDDCN-UHFFFAOYSA-N 1 2 242.282 2.366 20 0 BEADLO CC(=O)Oc1ccc(Nc2ccc(N)[nH+]c2)cc1 ZINC001201291702 983169039 /nfs/dbraw/zinc/16/90/39/983169039.db2.gz NVWIWEBKLSKXCU-UHFFFAOYSA-N 1 2 243.266 2.333 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@H]2C[C@@H](C)O)[nH+]1 ZINC001354141351 983171128 /nfs/dbraw/zinc/17/11/28/983171128.db2.gz OQFLVRXXMQWKJW-PWSUYJOCSA-N 1 2 238.306 2.269 20 0 BEADLO Nc1ccc(Nc2ncc(F)s2)c[nH+]1 ZINC001201272410 983171824 /nfs/dbraw/zinc/17/18/24/983171824.db2.gz NQUZJHNSJOIKIW-UHFFFAOYSA-N 1 2 210.237 2.003 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@@H]2C[C@H](C)O)[nH+]1 ZINC001354141349 983171943 /nfs/dbraw/zinc/17/19/43/983171943.db2.gz OQFLVRXXMQWKJW-CMPLNLGQSA-N 1 2 238.306 2.269 20 0 BEADLO COc1ncc(Nc2ccc(N)[nH+]c2)cc1C ZINC001201271806 983172407 /nfs/dbraw/zinc/17/24/07/983172407.db2.gz DLCRREPPSKYVRQ-UHFFFAOYSA-N 1 2 230.271 2.119 20 0 BEADLO Cc1cc(O)cc(Nc2ccc(N)[nH+]c2)c1 ZINC001201292910 983173083 /nfs/dbraw/zinc/17/30/83/983173083.db2.gz UMRIJQUIGGVFTN-UHFFFAOYSA-N 1 2 215.256 2.421 20 0 BEADLO Nc1ccc(Nc2ccc(Cl)cn2)c[nH+]1 ZINC001201272242 983173860 /nfs/dbraw/zinc/17/38/60/983173860.db2.gz KWBPWVCFKZMHHP-UHFFFAOYSA-N 1 2 220.663 2.456 20 0 BEADLO COC(=O)c1ccc(Nc2ccc(N)[nH+]c2)s1 ZINC001201272691 983174174 /nfs/dbraw/zinc/17/41/74/983174174.db2.gz SNJWQTVJBDULTG-UHFFFAOYSA-N 1 2 249.295 2.256 20 0 BEADLO Cc1csc(Nc2ccc(N)[nH+]c2)n1 ZINC001201271090 983174432 /nfs/dbraw/zinc/17/44/32/983174432.db2.gz DAJUHLUUZSHUDX-UHFFFAOYSA-N 1 2 206.274 2.172 20 0 BEADLO COc1ccc(Nc2ccc(N)[nH+]c2)c(C)n1 ZINC001201273049 983175191 /nfs/dbraw/zinc/17/51/91/983175191.db2.gz ZVAKSUVYUAVIEK-UHFFFAOYSA-N 1 2 230.271 2.119 20 0 BEADLO Nc1ccc(Nc2cc(F)nc(F)c2)c[nH+]1 ZINC001201276227 983175242 /nfs/dbraw/zinc/17/52/42/983175242.db2.gz QGVHACCFUSMIFA-UHFFFAOYSA-N 1 2 222.198 2.081 20 0 BEADLO Cc1cc(Nc2ccc(N)[nH+]c2)cnc1F ZINC001201275751 983176119 /nfs/dbraw/zinc/17/61/19/983176119.db2.gz LGDYQFKTRPJKHI-UHFFFAOYSA-N 1 2 218.235 2.250 20 0 BEADLO CCCc1cc(Nc2ccc(N)[nH+]c2)on1 ZINC001201273046 983177242 /nfs/dbraw/zinc/17/72/42/983177242.db2.gz ZUJTVRRIMWAKDJ-UHFFFAOYSA-N 1 2 218.260 2.348 20 0 BEADLO COc1cc(Nc2ccc(N)[nH+]c2)cc(C)n1 ZINC001201278753 983178492 /nfs/dbraw/zinc/17/84/92/983178492.db2.gz NBBCMSYIVJQBGV-UHFFFAOYSA-N 1 2 230.271 2.119 20 0 BEADLO Cn1nc2c(c1Nc1ccc(N)[nH+]c1)CCCC2 ZINC001201278726 983178900 /nfs/dbraw/zinc/17/89/00/983178900.db2.gz LVJMDUJJTNASDN-UHFFFAOYSA-N 1 2 243.314 2.020 20 0 BEADLO Nc1ccc(Nc2ccc3c(c2)[C@@H](O)CC3)c[nH+]1 ZINC001201299782 983180241 /nfs/dbraw/zinc/18/02/41/983180241.db2.gz JCRLCDINPBVTIZ-ZDUSSCGKSA-N 1 2 241.294 2.387 20 0 BEADLO Cc1ccc(CO)c(Nc2ccc(N)[nH+]c2)c1 ZINC001201295301 983180598 /nfs/dbraw/zinc/18/05/98/983180598.db2.gz NYNLUQSIBCCRQS-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cc(C(=O)N(C)C)ccc1F ZINC001241986487 983181105 /nfs/dbraw/zinc/18/11/05/983181105.db2.gz SVBNZPDXDJCBRO-DXNUHORPSA-N 1 2 248.301 2.403 20 0 BEADLO Cc1cccc(CN(C)c2cc(N)nc[nH+]2)c1C ZINC001354200487 983193383 /nfs/dbraw/zinc/19/33/83/983193383.db2.gz ZYDQVUPVVCOHEF-UHFFFAOYSA-N 1 2 242.326 2.312 20 0 BEADLO Fc1cc(-c2[nH]cc[nH+]2)ccc1N1CCOCC1 ZINC001242017769 983217467 /nfs/dbraw/zinc/21/74/67/983217467.db2.gz WRQZAKOKJZXNNT-UHFFFAOYSA-N 1 2 247.273 2.052 20 0 BEADLO O=C1CCCc2cc(-c3[nH]cc[nH+]3)ccc2N1 ZINC001242017268 983217622 /nfs/dbraw/zinc/21/76/22/983217622.db2.gz GTBPEMDAWYYWET-UHFFFAOYSA-N 1 2 227.267 2.352 20 0 BEADLO COC(=O)c1cc(-c2[nH]cc[nH+]2)c(C)cc1OC ZINC001242017668 983218782 /nfs/dbraw/zinc/21/87/82/983218782.db2.gz QXIUXNDAQAKQJZ-UHFFFAOYSA-N 1 2 246.266 2.180 20 0 BEADLO COC(=[NH2+])c1cccc(-c2ncc[nH]2)c1 ZINC001242019046 983222705 /nfs/dbraw/zinc/22/27/05/983222705.db2.gz XCNZAIXEHKXORH-UHFFFAOYSA-N 1 2 201.229 2.048 20 0 BEADLO C[C@@H]1CN(c2cc[nH+]cc2F)[C@H](C)CCO1 ZINC001354351413 983289221 /nfs/dbraw/zinc/28/92/21/983289221.db2.gz IJHSPDIUDJXCFV-NXEZZACHSA-N 1 2 224.279 2.224 20 0 BEADLO CNc1ccc(-c2c[nH+]c3c(c2)CCCN3)cn1 ZINC001242072523 983310892 /nfs/dbraw/zinc/31/08/92/983310892.db2.gz FTJSQUHURPQNGL-UHFFFAOYSA-N 1 2 240.310 2.186 20 0 BEADLO CCc1ncc(F)c(-c2c[nH+]c(N)cc2C)n1 ZINC001242078046 983324370 /nfs/dbraw/zinc/32/43/70/983324370.db2.gz QFNSUHOYUUYHCV-UHFFFAOYSA-N 1 2 232.262 2.131 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1ncc(C(F)F)cn1 ZINC001242077344 983324419 /nfs/dbraw/zinc/32/44/19/983324419.db2.gz DQORJCBDADIDDV-UHFFFAOYSA-N 1 2 236.225 2.367 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1cccc2ccoc21 ZINC000449011741 983331156 /nfs/dbraw/zinc/33/11/56/983331156.db2.gz UFNPMIZGDUPHBC-UHFFFAOYSA-N 1 2 247.294 2.428 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1cccc2ccoc21 ZINC000449011741 983331164 /nfs/dbraw/zinc/33/11/64/983331164.db2.gz UFNPMIZGDUPHBC-UHFFFAOYSA-N 1 2 247.294 2.428 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1nc(F)c(F)cc1F ZINC001242084829 983332128 /nfs/dbraw/zinc/33/21/28/983332128.db2.gz BJRMABQVKOQRCW-UHFFFAOYSA-N 1 2 239.200 2.452 20 0 BEADLO C[C@H]1CC[N@H+](Cc2nncs2)CC1(C)C ZINC001354611614 983333409 /nfs/dbraw/zinc/33/34/09/983333409.db2.gz UQRPOZAFFYQMCS-VIFPVBQESA-N 1 2 225.361 2.406 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2nncs2)CC1(C)C ZINC001354611614 983333416 /nfs/dbraw/zinc/33/34/16/983333416.db2.gz UQRPOZAFFYQMCS-VIFPVBQESA-N 1 2 225.361 2.406 20 0 BEADLO Cc1ccccc1O[C@@H](C)C[NH2+]Cc1ccn[nH]1 ZINC001200772513 983354992 /nfs/dbraw/zinc/35/49/92/983354992.db2.gz BNTYNSUSVYBVPO-LBPRGKRZSA-N 1 2 245.326 2.275 20 0 BEADLO CCN1CC[C@H]([NH+]2CCCCC2)C(F)(F)C1 ZINC001201590030 983355558 /nfs/dbraw/zinc/35/55/58/983355558.db2.gz IDMWYLWWSWBEDG-NSHDSACASA-N 1 2 232.318 2.202 20 0 BEADLO C[N@H+]1CCC[C@@H]2C[NH+](CCc3ccccc3)C[C@@H]21 ZINC001201606092 983375494 /nfs/dbraw/zinc/37/54/94/983375494.db2.gz IJZYYHDXBSEGEN-CVEARBPZSA-N 1 2 244.382 2.255 20 0 BEADLO C[NH+]1CCC[C@@H]2C[N@H+](CCc3ccccc3)C[C@@H]21 ZINC001201606092 983375501 /nfs/dbraw/zinc/37/55/01/983375501.db2.gz IJZYYHDXBSEGEN-CVEARBPZSA-N 1 2 244.382 2.255 20 0 BEADLO Oc1cncc(Nc2cccn3cc[nH+]c23)c1 ZINC001201628573 983384374 /nfs/dbraw/zinc/38/43/74/983384374.db2.gz ODNAZJASDKVFCP-UHFFFAOYSA-N 1 2 226.239 2.179 20 0 BEADLO CCC[N@@H+]1CC[C@@H]1N(C)C(=O)OC(C)(C)C ZINC001201648345 983401085 /nfs/dbraw/zinc/40/10/85/983401085.db2.gz UTVBMMHPGBGJML-SNVBAGLBSA-N 1 2 228.336 2.295 20 0 BEADLO CCC[N@H+]1CC[C@@H]1N(C)C(=O)OC(C)(C)C ZINC001201648345 983401087 /nfs/dbraw/zinc/40/10/87/983401087.db2.gz UTVBMMHPGBGJML-SNVBAGLBSA-N 1 2 228.336 2.295 20 0 BEADLO CCCCC[N@@H+]1CCCC(=O)[C@@H](F)C1 ZINC001201725478 983434296 /nfs/dbraw/zinc/43/42/96/983434296.db2.gz OZEOHKZVDIWGQW-JTQLQIEISA-N 1 2 201.285 2.180 20 0 BEADLO CCCCC[N@H+]1CCCC(=O)[C@@H](F)C1 ZINC001201725478 983434303 /nfs/dbraw/zinc/43/43/03/983434303.db2.gz OZEOHKZVDIWGQW-JTQLQIEISA-N 1 2 201.285 2.180 20 0 BEADLO CCc1nnc(C[NH2+][C@H](C)c2ccc[nH]2)s1 ZINC001355275211 983455888 /nfs/dbraw/zinc/45/58/88/983455888.db2.gz SIPOLEHOHGAVGK-MRVPVSSYSA-N 1 2 236.344 2.279 20 0 BEADLO CCCC[C@H](O)CNc1ccn2cc[nH+]c2c1 ZINC001252083936 983458631 /nfs/dbraw/zinc/45/86/31/983458631.db2.gz WQVQGZVNRZUYCO-LBPRGKRZSA-N 1 2 233.315 2.297 20 0 BEADLO C[C@@H](Nc1cc(N(C)C)nc[nH+]1)c1cscn1 ZINC001355320355 983470708 /nfs/dbraw/zinc/47/07/08/983470708.db2.gz DAKLIJPDDDHHBW-MRVPVSSYSA-N 1 2 249.343 2.172 20 0 BEADLO C[C@@H](Nc1cc(N(C)C)[nH+]cn1)c1cscn1 ZINC001355320355 983470712 /nfs/dbraw/zinc/47/07/12/983470712.db2.gz DAKLIJPDDDHHBW-MRVPVSSYSA-N 1 2 249.343 2.172 20 0 BEADLO Cc1c(N)cc[nH+]c1-c1cccc(F)c1O ZINC001242349758 983619373 /nfs/dbraw/zinc/61/93/73/983619373.db2.gz QYJOFCAZMIURSO-UHFFFAOYSA-N 1 2 218.231 2.484 20 0 BEADLO CC(=O)c1ccc(-c2c[nH+]c(N)c(C)c2)cn1 ZINC001242401154 983684658 /nfs/dbraw/zinc/68/46/58/983684658.db2.gz RAHBAMKRUQZSEC-UHFFFAOYSA-N 1 2 227.267 2.237 20 0 BEADLO COc1ncc(-c2c[nH+]c(N)c(C)c2)cc1C ZINC001242432698 983732412 /nfs/dbraw/zinc/73/24/12/983732412.db2.gz PHNFWWAJBYXHHR-UHFFFAOYSA-N 1 2 229.283 2.351 20 0 BEADLO CC(C)n1c[nH+]cc1CNC(=O)NC(C)(C)C ZINC001202490997 983774231 /nfs/dbraw/zinc/77/42/31/983774231.db2.gz RELWDXYXSMCWFB-UHFFFAOYSA-N 1 2 238.335 2.062 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CCC[C@@H]1C(C)(C)C ZINC001137101233 983942651 /nfs/dbraw/zinc/94/26/51/983942651.db2.gz FHFIKXUAUIZEGW-GFCCVEGCSA-N 1 2 249.358 2.298 20 0 BEADLO CC[N@H+](Cc1cc(C)cs1)[C@@H](C)C(=O)OC ZINC001137161661 984008832 /nfs/dbraw/zinc/00/88/32/984008832.db2.gz NJYHLGRSLHDMCR-JTQLQIEISA-N 1 2 241.356 2.440 20 0 BEADLO CC[N@@H+](Cc1cc(C)cs1)[C@@H](C)C(=O)OC ZINC001137161661 984008844 /nfs/dbraw/zinc/00/88/44/984008844.db2.gz NJYHLGRSLHDMCR-JTQLQIEISA-N 1 2 241.356 2.440 20 0 BEADLO COc1cc(-c2ccc(C)c(N)[nH+]2)cc(C)n1 ZINC001242745841 984102391 /nfs/dbraw/zinc/10/23/91/984102391.db2.gz JSZJYWWUISAFHT-UHFFFAOYSA-N 1 2 229.283 2.351 20 0 BEADLO FC1(C2CC2)C[NH+](CCC2CCOCC2)C1 ZINC001202611297 984126664 /nfs/dbraw/zinc/12/66/64/984126664.db2.gz NVUFYLKKDKYAPT-UHFFFAOYSA-N 1 2 227.323 2.237 20 0 BEADLO O=C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccc[nH]1 ZINC001204006691 984144225 /nfs/dbraw/zinc/14/42/25/984144225.db2.gz BAUDNEJLMBWZER-TXEJJXNPSA-N 1 2 218.300 2.101 20 0 BEADLO O=C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccc[nH]1 ZINC001204006691 984144226 /nfs/dbraw/zinc/14/42/26/984144226.db2.gz BAUDNEJLMBWZER-TXEJJXNPSA-N 1 2 218.300 2.101 20 0 BEADLO COc1ccc(-c2c[nH+]c(N)c(C)c2)c(C)n1 ZINC001242928144 984302585 /nfs/dbraw/zinc/30/25/85/984302585.db2.gz RVVHOYQLTBCEKF-UHFFFAOYSA-N 1 2 229.283 2.351 20 0 BEADLO Cc1cc(-c2cnn3ccccc23)c[nH+]c1N ZINC001242966107 984329194 /nfs/dbraw/zinc/32/91/94/984329194.db2.gz LLHWLKUPYYYQMD-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO Cc1cc(CNC(=O)c2ccco2)cc(C)[nH+]1 ZINC001436881904 984345176 /nfs/dbraw/zinc/34/51/76/984345176.db2.gz LQEZUTIRLYXWBD-UHFFFAOYSA-N 1 2 230.267 2.221 20 0 BEADLO COC(=O)c1cccc(-c2c[nH+]cn2C)c1C ZINC001243066347 984479917 /nfs/dbraw/zinc/47/99/17/984479917.db2.gz CFQGRTGAXUNGFW-UHFFFAOYSA-N 1 2 230.267 2.182 20 0 BEADLO Cc1c2cc[nH]c2ncc1-c1c[nH+]cn1C ZINC001243068514 984489866 /nfs/dbraw/zinc/48/98/66/984489866.db2.gz BKJRZERTKDZBDU-UHFFFAOYSA-N 1 2 212.256 2.223 20 0 BEADLO Cn1c[nH+]cc1-c1cccc2c1CN(C)C(=O)N2 ZINC001243070806 984494264 /nfs/dbraw/zinc/49/42/64/984494264.db2.gz YVSBCRFNKLKLNY-UHFFFAOYSA-N 1 2 242.282 2.064 20 0 BEADLO Cn1c[nH+]cc1-c1ccc([S@@](C)(=N)=O)cc1 ZINC001243069925 984495423 /nfs/dbraw/zinc/49/54/23/984495423.db2.gz BWAPRVNPCSQYOZ-INIZCTEOSA-N 1 2 235.312 2.123 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2c(c1)CCCC(=O)N2 ZINC001243071205 984499669 /nfs/dbraw/zinc/49/96/69/984499669.db2.gz OWOUITPHJZNAMT-UHFFFAOYSA-N 1 2 241.294 2.362 20 0 BEADLO Nc1cc(-c2ccnc3ncccc32)cc[nH+]1 ZINC000718918980 984564921 /nfs/dbraw/zinc/56/49/21/984564921.db2.gz DLBWDOJNUBXEKZ-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO C=C/C=C/CC(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC001445356353 984590630 /nfs/dbraw/zinc/59/06/30/984590630.db2.gz XZJWCPPIOOXTPZ-ONEGZZNKSA-N 1 2 245.326 2.248 20 0 BEADLO C=C/C=C/CC(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC001445356353 984590642 /nfs/dbraw/zinc/59/06/42/984590642.db2.gz XZJWCPPIOOXTPZ-ONEGZZNKSA-N 1 2 245.326 2.248 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cccc(CO)c1F ZINC001243142844 984603528 /nfs/dbraw/zinc/60/35/28/984603528.db2.gz SKDBSZOMQSUXLJ-DDEWIXKASA-N 1 2 207.248 2.194 20 0 BEADLO COCC=CC(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC001445734379 984613325 /nfs/dbraw/zinc/61/33/25/984613325.db2.gz BXFGTGQASMIEAA-ONEGZZNKSA-N 1 2 245.282 2.012 20 0 BEADLO COc1ccc(CO)cc1-c1c[nH+]c(N)c(C)c1 ZINC001243174368 984630502 /nfs/dbraw/zinc/63/05/02/984630502.db2.gz NUVCGMLOLIILRL-UHFFFAOYSA-N 1 2 244.294 2.140 20 0 BEADLO COCOc1ccc(-c2cccc(N)[nH+]2)cc1 ZINC001243212443 984706386 /nfs/dbraw/zinc/70/63/86/984706386.db2.gz MPHJYNJZMJLETJ-UHFFFAOYSA-N 1 2 230.267 2.314 20 0 BEADLO Cc1ccc(-c2ccc(F)c(N)c2)[nH+]c1N ZINC001243453900 984952535 /nfs/dbraw/zinc/95/25/35/984952535.db2.gz WYSGIQGOPJSSIL-UHFFFAOYSA-N 1 2 217.247 2.361 20 0 BEADLO COC(=O)c1ccc(-c2ccc[nH+]c2N)c(F)c1 ZINC001243472316 985018925 /nfs/dbraw/zinc/01/89/25/985018925.db2.gz IEBCKDGBJXHTCI-UHFFFAOYSA-N 1 2 246.241 2.257 20 0 BEADLO COc1cc(SC)c(-c2ccc[nH+]c2N)cn1 ZINC001243476384 985029713 /nfs/dbraw/zinc/02/97/13/985029713.db2.gz DBTJOWDXIIRBAW-UHFFFAOYSA-N 1 2 247.323 2.456 20 0 BEADLO Cn1cnc2c1cccc2-c1ccc[nH+]c1N ZINC001243476421 985030879 /nfs/dbraw/zinc/03/08/79/985030879.db2.gz RUJZVPPVODOYBB-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO Cc1c(-c2cccnc2N)ccc2[nH+]ccn21 ZINC001243476318 985031005 /nfs/dbraw/zinc/03/10/05/985031005.db2.gz BEPHQGMPKPEHHZ-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO COc1cc(C)c(-c2ccc[nH+]c2N)c(C)n1 ZINC001243476466 985037438 /nfs/dbraw/zinc/03/74/38/985037438.db2.gz SIOYRMVBLPETAM-UHFFFAOYSA-N 1 2 229.283 2.351 20 0 BEADLO C=CC(=O)Oc1ccc(-c2ccc[nH+]c2N)cc1 ZINC001243478474 985042052 /nfs/dbraw/zinc/04/20/52/985042052.db2.gz YMUREZWCPQKNMH-UHFFFAOYSA-N 1 2 240.262 2.422 20 0 BEADLO [NH3+]Cc1ccnc(-c2cc(F)cc(F)c2O)c1 ZINC001243499229 985055290 /nfs/dbraw/zinc/05/52/90/985055290.db2.gz DJXWOGQEYSFPME-UHFFFAOYSA-N 1 2 236.221 2.191 20 0 BEADLO CCc1[nH]c(CNC(=O)c2oc(C)cc2C)c[nH+]1 ZINC001456143830 985115631 /nfs/dbraw/zinc/11/56/31/985115631.db2.gz UASCZABBXZUAAZ-UHFFFAOYSA-N 1 2 247.298 2.112 20 0 BEADLO CCc1[nH]cc(CNC(=O)c2oc(C)cc2C)[nH+]1 ZINC001456143830 985115639 /nfs/dbraw/zinc/11/56/39/985115639.db2.gz UASCZABBXZUAAZ-UHFFFAOYSA-N 1 2 247.298 2.112 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H]2CCC(C)(C)C2)c[nH+]1 ZINC001456143963 985116728 /nfs/dbraw/zinc/11/67/28/985116728.db2.gz MMSJXRWFEWLUGJ-SNVBAGLBSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H]2CCC(C)(C)C2)[nH+]1 ZINC001456143963 985116743 /nfs/dbraw/zinc/11/67/43/985116743.db2.gz MMSJXRWFEWLUGJ-SNVBAGLBSA-N 1 2 249.358 2.415 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccc(C)cc2F)[nH]1 ZINC000686505563 985126353 /nfs/dbraw/zinc/12/63/53/985126353.db2.gz DKIXUZJQEXNKBW-SECBINFHSA-N 1 2 248.305 2.411 20 0 BEADLO CC[C@@H](C)CC(=O)NCc1[nH]c2c([nH+]1)CCCC2 ZINC001456240391 985129350 /nfs/dbraw/zinc/12/93/50/985129350.db2.gz PXQNYUSECUCEGI-SNVBAGLBSA-N 1 2 249.358 2.341 20 0 BEADLO CC(C)c1cnc(C[NH+]2CCC(C)(O)CC2)o1 ZINC000686602437 985146622 /nfs/dbraw/zinc/14/66/22/985146622.db2.gz BIJKUTSTLWDRAN-UHFFFAOYSA-N 1 2 238.331 2.145 20 0 BEADLO Cc1nocc1-c1cc(N(C)C)cc[nH+]1 ZINC001243672318 985160708 /nfs/dbraw/zinc/16/07/08/985160708.db2.gz TVWPILWYUFZVSD-UHFFFAOYSA-N 1 2 203.245 2.111 20 0 BEADLO Cc1nc(N(C)C[Si](C)(C)C)cc[nH+]1 ZINC001458617897 985338517 /nfs/dbraw/zinc/33/85/17/985338517.db2.gz LIMXYCPEAZPHDK-UHFFFAOYSA-N 1 2 209.369 2.099 20 0 BEADLO CO[C@H]1CC=C(c2ccc[nH+]c2N)CC1 ZINC001243810909 985399635 /nfs/dbraw/zinc/39/96/35/985399635.db2.gz VZAKVLLBPAVOKJ-JTQLQIEISA-N 1 2 204.273 2.246 20 0 BEADLO CCc1cn(CC(=O)NCC2CCCCC2)c[nH+]1 ZINC001459266015 985426544 /nfs/dbraw/zinc/42/65/44/985426544.db2.gz ZGIYCVKBWZGUMD-UHFFFAOYSA-N 1 2 249.358 2.142 20 0 BEADLO CCN(CC)c1ccc(N[C@H]2COC[C@H]2C)c[nH+]1 ZINC000688046245 985524140 /nfs/dbraw/zinc/52/41/40/985524140.db2.gz IEWNURNFZJJOAR-YPMHNXCESA-N 1 2 249.358 2.375 20 0 BEADLO FC(F)Oc1ccnc(C2=C[NH2+]CCC2)c1 ZINC001243947023 985614051 /nfs/dbraw/zinc/61/40/51/985614051.db2.gz CSXZDXZHCJWYDA-UHFFFAOYSA-N 1 2 226.226 2.407 20 0 BEADLO c1nc2c(nc1C1=C[NH2+]CCC1)CCCC2 ZINC001243948834 985627500 /nfs/dbraw/zinc/62/75/00/985627500.db2.gz CXCSWLJDSVHSCJ-UHFFFAOYSA-N 1 2 215.300 2.080 20 0 BEADLO Fc1ccc2ncc(C3=C[NH2+]CCC3)nc2c1 ZINC001243948275 985628129 /nfs/dbraw/zinc/62/81/29/985628129.db2.gz XVSGVQJPWDPAPK-UHFFFAOYSA-N 1 2 229.258 2.493 20 0 BEADLO c1cc(-c2cc(C3=C[NH2+]CCC3)ncn2)ccn1 ZINC001243948552 985629295 /nfs/dbraw/zinc/62/92/95/985629295.db2.gz HEDZKULBBQLCFU-UHFFFAOYSA-N 1 2 238.294 2.263 20 0 BEADLO c1ccc(-c2cc(C3=C[NH2+]CCC3)ncn2)nc1 ZINC001243948568 985629318 /nfs/dbraw/zinc/62/93/18/985629318.db2.gz HZTOPLWTAWCOKY-UHFFFAOYSA-N 1 2 238.294 2.263 20 0 BEADLO C=C(OCC)c1ccc(C2=C[NH2+]CCC2)nn1 ZINC001243947950 985630027 /nfs/dbraw/zinc/63/00/27/985630027.db2.gz RXSFUAHCCHTBLK-UHFFFAOYSA-N 1 2 231.299 2.208 20 0 BEADLO COc1ccc2ncc(C3=C[NH2+]CCC3)nc2c1 ZINC001243948189 985630499 /nfs/dbraw/zinc/63/04/99/985630499.db2.gz VFWPVGISFYDCFZ-UHFFFAOYSA-N 1 2 241.294 2.363 20 0 BEADLO COC(OC)c1cc(C)cnc1C1=C[NH2+]CCC1 ZINC001243949466 985634971 /nfs/dbraw/zinc/63/49/71/985634971.db2.gz MLQKWDJPJYIFBC-UHFFFAOYSA-N 1 2 248.326 2.406 20 0 BEADLO CSc1nc2c(c(C3=C[NH2+]CCC3)n1)CCC2 ZINC001243949464 985638286 /nfs/dbraw/zinc/63/82/86/985638286.db2.gz MJKCJTSPWSAIOI-UHFFFAOYSA-N 1 2 247.367 2.412 20 0 BEADLO CC(C)OC1C[NH+](Cc2cnc3[nH]ccc3c2)C1 ZINC001138739993 985807688 /nfs/dbraw/zinc/80/76/88/985807688.db2.gz JWRVAUIHYUWPKM-UHFFFAOYSA-N 1 2 245.326 2.172 20 0 BEADLO COC(=O)CC[C@@H](C)[N@@H+]1Cc2cnc(C)cc2C1 ZINC001258375278 985855532 /nfs/dbraw/zinc/85/55/32/985855532.db2.gz PQKRKBJNLKKBNY-LLVKDONJSA-N 1 2 248.326 2.047 20 0 BEADLO COC(=O)CC[C@@H](C)[N@H+]1Cc2cnc(C)cc2C1 ZINC001258375278 985855534 /nfs/dbraw/zinc/85/55/34/985855534.db2.gz PQKRKBJNLKKBNY-LLVKDONJSA-N 1 2 248.326 2.047 20 0 BEADLO CCn1cc(Nc2[nH+]c(C)ccc2O)ccc1=O ZINC001212908992 985915243 /nfs/dbraw/zinc/91/52/43/985915243.db2.gz QMZANCFMRSJCKE-UHFFFAOYSA-N 1 2 245.282 2.021 20 0 BEADLO Cc1cc([C@H]2CCCC[N@@H+]2Cc2ccno2)[nH]n1 ZINC001460841382 985916613 /nfs/dbraw/zinc/91/66/13/985916613.db2.gz IMDOHEMHICPIDH-CYBMUJFWSA-N 1 2 246.314 2.433 20 0 BEADLO Cc1cc([C@H]2CCCC[N@H+]2Cc2ccno2)[nH]n1 ZINC001460841382 985916626 /nfs/dbraw/zinc/91/66/26/985916626.db2.gz IMDOHEMHICPIDH-CYBMUJFWSA-N 1 2 246.314 2.433 20 0 BEADLO CCc1cc(-c2cccc(N)[nH+]2)ccc1N ZINC001244282053 985925569 /nfs/dbraw/zinc/92/55/69/985925569.db2.gz KHUULQYOVPACJB-UHFFFAOYSA-N 1 2 213.284 2.475 20 0 BEADLO Cn1c[nH+]cc1-c1cccc2[nH]c(=O)ccc21 ZINC001244316657 985949062 /nfs/dbraw/zinc/94/90/62/985949062.db2.gz FBMPHVWKTHNGTJ-UHFFFAOYSA-N 1 2 225.251 2.341 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cc(F)c(CO)c(F)c1 ZINC001244340810 985983163 /nfs/dbraw/zinc/98/31/63/985983163.db2.gz CPLVIGOQSRNOAL-BVOBWIRXSA-N 1 2 225.238 2.333 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@@H](C)c2ncccc2C)n1 ZINC001461813263 986175549 /nfs/dbraw/zinc/17/55/49/986175549.db2.gz AOTDTNIYMOPRON-NSHDSACASA-N 1 2 230.315 2.272 20 0 BEADLO Cc1n[nH]cc1CNc1ccc2c(c1)CC[NH2+]2 ZINC001579839620 986264420 /nfs/dbraw/zinc/26/44/20/986264420.db2.gz OCCKMKNCTALLQO-UHFFFAOYSA-N 1 2 228.299 2.298 20 0 BEADLO CC(=O)c1cc(-c2c[nH+]cn2C)cs1 ZINC001244625180 986285594 /nfs/dbraw/zinc/28/55/94/986285594.db2.gz OBURTKYHBHRRJC-UHFFFAOYSA-N 1 2 206.270 2.351 20 0 BEADLO CCc1cc(-c2ccc(N)[nH+]c2)ccc1CO ZINC001244640594 986296967 /nfs/dbraw/zinc/29/69/67/986296967.db2.gz VBCHPLKIXLUSCA-UHFFFAOYSA-N 1 2 228.295 2.386 20 0 BEADLO Cc1cc(-c2ccc(N)[nH+]c2)cc(C)c1CO ZINC001244694296 986315346 /nfs/dbraw/zinc/31/53/46/986315346.db2.gz SIQGBUAPWMMRBM-UHFFFAOYSA-N 1 2 228.295 2.440 20 0 BEADLO COc1nccc(C[NH+]2CC3(CCC3)C2)c1F ZINC001462322074 986352037 /nfs/dbraw/zinc/35/20/37/986352037.db2.gz GMYZTFXTNAOWRB-UHFFFAOYSA-N 1 2 236.290 2.215 20 0 BEADLO CCCNC(=S)Nc1cccc2[nH+]ccn21 ZINC001244832437 986374948 /nfs/dbraw/zinc/37/49/48/986374948.db2.gz PIEZDJBTYKSZPW-UHFFFAOYSA-N 1 2 234.328 2.031 20 0 BEADLO CC(C)[C@@H](O)C[N@@H+]1CCC[C@@H](F)C(F)(F)C1 ZINC001253757600 986383802 /nfs/dbraw/zinc/38/38/02/986383802.db2.gz PVUVGWXHQWEMQX-VHSXEESVSA-N 1 2 239.281 2.073 20 0 BEADLO CC(C)[C@@H](O)C[N@H+]1CCC[C@@H](F)C(F)(F)C1 ZINC001253757600 986383815 /nfs/dbraw/zinc/38/38/15/986383815.db2.gz PVUVGWXHQWEMQX-VHSXEESVSA-N 1 2 239.281 2.073 20 0 BEADLO COc1cc(CO)cc(/C(C)=C/C=C/[NH3+])c1 ZINC001244840667 986384597 /nfs/dbraw/zinc/38/45/97/986384597.db2.gz AZYAKXJFOTVWQC-OXWOXFIQSA-N 1 2 219.284 2.063 20 0 BEADLO COc1cc(CO)cc(-c2ccc(C)c(N)[nH+]2)c1 ZINC001244839565 986385343 /nfs/dbraw/zinc/38/53/43/986385343.db2.gz ZSBYECZGPSCHRM-UHFFFAOYSA-N 1 2 244.294 2.140 20 0 BEADLO CCCNc1cc(N2CCC[C@@H](F)C2)nc[nH+]1 ZINC000689403090 986563462 /nfs/dbraw/zinc/56/34/62/986563462.db2.gz ZIKFPSGOUFVRHL-SNVBAGLBSA-N 1 2 238.310 2.237 20 0 BEADLO CCCNc1cc(N2CCC[C@@H](F)C2)[nH+]cn1 ZINC000689403090 986563475 /nfs/dbraw/zinc/56/34/75/986563475.db2.gz ZIKFPSGOUFVRHL-SNVBAGLBSA-N 1 2 238.310 2.237 20 0 BEADLO COC(=O)[C@@H](CC(C)C)[N@@H+]1CCC[C@H](F)C1 ZINC000689423649 986585050 /nfs/dbraw/zinc/58/50/50/986585050.db2.gz CUOFZGSRUGYFIZ-WDEREUQCSA-N 1 2 231.311 2.008 20 0 BEADLO COC(=O)[C@@H](CC(C)C)[N@H+]1CCC[C@H](F)C1 ZINC000689423649 986585063 /nfs/dbraw/zinc/58/50/63/986585063.db2.gz CUOFZGSRUGYFIZ-WDEREUQCSA-N 1 2 231.311 2.008 20 0 BEADLO COc1cc(-c2c[nH+]c(N)c(C)c2)cnc1F ZINC001245075955 986639068 /nfs/dbraw/zinc/63/90/68/986639068.db2.gz LIGUBVLWLQKEHB-UHFFFAOYSA-N 1 2 233.246 2.182 20 0 BEADLO Cc1c(C[N@H+]2C[C@@H](C)[C@@H](F)C2)nc2ccccn12 ZINC001137267424 986704075 /nfs/dbraw/zinc/70/40/75/986704075.db2.gz AACLWTOGOKCISV-PWSUYJOCSA-N 1 2 247.317 2.433 20 0 BEADLO Cc1c(C[N@@H+]2C[C@@H](C)[C@@H](F)C2)nc2ccccn12 ZINC001137267424 986704081 /nfs/dbraw/zinc/70/40/81/986704081.db2.gz AACLWTOGOKCISV-PWSUYJOCSA-N 1 2 247.317 2.433 20 0 BEADLO Cc1c(CN2C[C@@H](C)[C@@H](F)C2)[nH+]c2ccccn12 ZINC001137267424 986704099 /nfs/dbraw/zinc/70/40/99/986704099.db2.gz AACLWTOGOKCISV-PWSUYJOCSA-N 1 2 247.317 2.433 20 0 BEADLO Cn1c[nH+]cc1-c1cccc(Cl)c1N ZINC001245178893 986716156 /nfs/dbraw/zinc/71/61/56/986716156.db2.gz LZGWSXNGTHNKLO-UHFFFAOYSA-N 1 2 207.664 2.323 20 0 BEADLO COCn1cc(-c2cccc(C(=[NH2+])OC)c2)cn1 ZINC001245221693 986749820 /nfs/dbraw/zinc/74/98/20/986749820.db2.gz IBYZDQVWVXFXFL-UHFFFAOYSA-N 1 2 245.282 2.126 20 0 BEADLO Cc1cc(C)c(C[N@H+]2CCC(=O)C[C@@H]2C)[nH]1 ZINC001137322446 986770104 /nfs/dbraw/zinc/77/01/04/986770104.db2.gz FGURGUPOTWCNSA-NSHDSACASA-N 1 2 220.316 2.185 20 0 BEADLO Cc1cc(C)c(C[N@@H+]2CCC(=O)C[C@@H]2C)[nH]1 ZINC001137322446 986770114 /nfs/dbraw/zinc/77/01/14/986770114.db2.gz FGURGUPOTWCNSA-NSHDSACASA-N 1 2 220.316 2.185 20 0 BEADLO CC/C=C/CNC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001466418411 986796858 /nfs/dbraw/zinc/79/68/58/986796858.db2.gz RPFQKTBBNLTQTJ-ONEGZZNKSA-N 1 2 244.298 2.422 20 0 BEADLO C[NH+](C)Cc1c(F)cc(-c2cc[nH]n2)cc1F ZINC001245314840 986808181 /nfs/dbraw/zinc/80/81/81/986808181.db2.gz PFMZPVJZWRLKEN-UHFFFAOYSA-N 1 2 237.253 2.417 20 0 BEADLO FC[C@H]1CCC[N@@H+]1Cc1n[nH]c2ccccc21 ZINC001137353885 986818733 /nfs/dbraw/zinc/81/87/33/986818733.db2.gz ZISZOHZGZXTFKV-SNVBAGLBSA-N 1 2 233.290 2.497 20 0 BEADLO FC[C@H]1CCC[N@H+]1Cc1n[nH]c2ccccc21 ZINC001137353885 986818736 /nfs/dbraw/zinc/81/87/36/986818736.db2.gz ZISZOHZGZXTFKV-SNVBAGLBSA-N 1 2 233.290 2.497 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cn(C)c2cnccc12 ZINC001245490545 986870341 /nfs/dbraw/zinc/87/03/41/986870341.db2.gz UWQLWYMKKXZUCV-GOKWTUSKSA-N 1 2 213.284 2.449 20 0 BEADLO CCCc1cncnc1-c1c[nH+]c(N)c(C)c1 ZINC001245537011 986912711 /nfs/dbraw/zinc/91/27/11/986912711.db2.gz VSHGOYXDEJAEEC-UHFFFAOYSA-N 1 2 228.299 2.382 20 0 BEADLO Cc1cc(-c2ccccc2NC(N)=O)c[nH+]c1N ZINC001245537605 986920313 /nfs/dbraw/zinc/92/03/13/986920313.db2.gz SDXFHXGSNOZXBD-UHFFFAOYSA-N 1 2 242.282 2.130 20 0 BEADLO C[N@H+](Cc1ccc(Cl)nc1F)[C@H]1CCOC1 ZINC001137476490 986924173 /nfs/dbraw/zinc/92/41/73/986924173.db2.gz GHGWUGUZWVIZMW-VIFPVBQESA-N 1 2 244.697 2.095 20 0 BEADLO C[N@@H+](Cc1ccc(Cl)nc1F)[C@H]1CCOC1 ZINC001137476490 986924187 /nfs/dbraw/zinc/92/41/87/986924187.db2.gz GHGWUGUZWVIZMW-VIFPVBQESA-N 1 2 244.697 2.095 20 0 BEADLO Cc1cc(-c2cc[nH+]c3c2CCN3)cnc1N ZINC001245541306 986929079 /nfs/dbraw/zinc/92/90/79/986929079.db2.gz PZMXAEVNDFQULQ-UHFFFAOYSA-N 1 2 226.283 2.002 20 0 BEADLO COC[C@H](C)[N@@H+]1CCc2ncc(Cl)cc2C1 ZINC001255583835 987035192 /nfs/dbraw/zinc/03/51/92/987035192.db2.gz RVVQRLHVDMCMOK-VIFPVBQESA-N 1 2 240.734 2.128 20 0 BEADLO COC[C@H](C)[N@H+]1CCc2ncc(Cl)cc2C1 ZINC001255583835 987035205 /nfs/dbraw/zinc/03/52/05/987035205.db2.gz RVVQRLHVDMCMOK-VIFPVBQESA-N 1 2 240.734 2.128 20 0 BEADLO Cc1cn2cc(-c3ccc4nncn4c3)ccc2[nH+]1 ZINC001245661167 987048866 /nfs/dbraw/zinc/04/88/66/987048866.db2.gz WHGFDWGXVHJAKS-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO CC[N@H+]([C@@H](C)CC(F)(F)F)C1COC1 ZINC001255655956 987050033 /nfs/dbraw/zinc/05/00/33/987050033.db2.gz OATXDXIKBIWFRJ-ZETCQYMHSA-N 1 2 211.227 2.048 20 0 BEADLO CC[N@@H+]([C@@H](C)CC(F)(F)F)C1COC1 ZINC001255655956 987050044 /nfs/dbraw/zinc/05/00/44/987050044.db2.gz OATXDXIKBIWFRJ-ZETCQYMHSA-N 1 2 211.227 2.048 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H](C)Cc1ccc(C)cc1 ZINC001255775599 987067890 /nfs/dbraw/zinc/06/78/90/987067890.db2.gz ZTHUPMBTONSMIK-RYUDHWBXSA-N 1 2 235.327 2.077 20 0 BEADLO Nc1cc[nH+]c(-c2c(F)ccc(CO)c2F)c1 ZINC001245850198 987096054 /nfs/dbraw/zinc/09/60/54/987096054.db2.gz PLURJFKVFRXIEF-UHFFFAOYSA-N 1 2 236.221 2.101 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc2c(c1)NC(=O)C2 ZINC001245891465 987101621 /nfs/dbraw/zinc/10/16/21/987101621.db2.gz QFXGJLFKLLPQPZ-YGQDEOHPSA-N 1 2 214.268 2.057 20 0 BEADLO CC[C@H](C)N1N=C(C2CC[NH2+]CC2)CC1=O ZINC001245917423 987150055 /nfs/dbraw/zinc/15/00/55/987150055.db2.gz JZEXCQWFOZGNQW-VIFPVBQESA-N 1 2 223.320 2.027 20 0 BEADLO C[C@@H]1C[C@H]1c1nnc([C@@H]2CC3CC[NH+]2CC3)o1 ZINC001256611686 987244552 /nfs/dbraw/zinc/24/45/52/987244552.db2.gz YDUNHLCBVYBDHM-IEBDPFPHSA-N 1 2 233.315 2.350 20 0 BEADLO C[C@@H]1C[C@@H]1c1nnc([C@@H]2CCCC[N@@H+]2C)o1 ZINC001256657961 987262425 /nfs/dbraw/zinc/26/24/25/987262425.db2.gz NIMNEKRHECVWNP-UTLUCORTSA-N 1 2 221.304 2.350 20 0 BEADLO C[C@@H]1C[C@@H]1c1nnc([C@@H]2CCCC[N@H+]2C)o1 ZINC001256657961 987262440 /nfs/dbraw/zinc/26/24/40/987262440.db2.gz NIMNEKRHECVWNP-UTLUCORTSA-N 1 2 221.304 2.350 20 0 BEADLO C[C@@H]1C[C@H]1c1nnc([C@H]2CCCc3[nH]c[nH+]c32)o1 ZINC001256661078 987266071 /nfs/dbraw/zinc/26/60/71/987266071.db2.gz YWNZMIWOQHGKPN-HRDYMLBCSA-N 1 2 244.298 2.384 20 0 BEADLO C[C@@H]1C[C@H]1c1nnc([C@@H]2CCCC[N@@H+]2C)o1 ZINC001256657956 987266316 /nfs/dbraw/zinc/26/63/16/987266316.db2.gz NIMNEKRHECVWNP-BBBLOLIVSA-N 1 2 221.304 2.350 20 0 BEADLO C[C@@H]1C[C@H]1c1nnc([C@@H]2CCCC[N@H+]2C)o1 ZINC001256657956 987266327 /nfs/dbraw/zinc/26/63/27/987266327.db2.gz NIMNEKRHECVWNP-BBBLOLIVSA-N 1 2 221.304 2.350 20 0 BEADLO CCc1cc(N[C@@H]2C[C@]2(C)OC)nc(CC)[nH+]1 ZINC001472836786 987289692 /nfs/dbraw/zinc/28/96/92/987289692.db2.gz ANNFXQWEONXIDJ-MFKMUULPSA-N 1 2 235.331 2.191 20 0 BEADLO CSC(C)(C)CNc1cc[nH+]cc1F ZINC000699719348 987381025 /nfs/dbraw/zinc/38/10/25/987381025.db2.gz ZIGNEZSEMKRZPP-UHFFFAOYSA-N 1 2 214.309 2.196 20 0 BEADLO C[C@H](C(=O)N1C2CCCC1CCC2)n1cc[nH+]c1 ZINC001116127685 987452838 /nfs/dbraw/zinc/45/28/38/987452838.db2.gz JYPZSXXEYUEGNW-PNESKVBLSA-N 1 2 247.342 2.378 20 0 BEADLO Fc1cccc2c1CC[C@@H]2[NH+]1CCOCC1 ZINC001116196261 987469277 /nfs/dbraw/zinc/46/92/77/987469277.db2.gz VEEZOIAVENBNJA-ZDUSSCGKSA-N 1 2 221.275 2.145 20 0 BEADLO Fc1cccc2c1CC[C@H]2[NH+]1CCOCC1 ZINC001116196260 987471850 /nfs/dbraw/zinc/47/18/50/987471850.db2.gz VEEZOIAVENBNJA-CYBMUJFWSA-N 1 2 221.275 2.145 20 0 BEADLO COc1nc(Cl)c(C[N@H+](C)C2CCC2)n1C ZINC001116443806 987579414 /nfs/dbraw/zinc/57/94/14/987579414.db2.gz IHEHEFFVGGJDIE-UHFFFAOYSA-N 1 2 243.738 2.066 20 0 BEADLO COc1nc(Cl)c(C[N@@H+](C)C2CCC2)n1C ZINC001116443806 987579423 /nfs/dbraw/zinc/57/94/23/987579423.db2.gz IHEHEFFVGGJDIE-UHFFFAOYSA-N 1 2 243.738 2.066 20 0 BEADLO Cc1cc(C[N@@H+]2CC(C)(C)C2(C)C)n[nH]1 ZINC001116443790 987580271 /nfs/dbraw/zinc/58/02/71/987580271.db2.gz HPPAQKIJXXTMSY-UHFFFAOYSA-N 1 2 207.321 2.339 20 0 BEADLO Cc1cc(C[N@H+]2CC(C)(C)C2(C)C)n[nH]1 ZINC001116443790 987580285 /nfs/dbraw/zinc/58/02/85/987580285.db2.gz HPPAQKIJXXTMSY-UHFFFAOYSA-N 1 2 207.321 2.339 20 0 BEADLO CCCCC[C@H](C)N[C@H]1C[NH2+]CC[C@H]1F ZINC001246218194 987617281 /nfs/dbraw/zinc/61/72/81/987617281.db2.gz PDHZXBZQTMYTFB-TUAOUCFPSA-N 1 2 216.344 2.245 20 0 BEADLO CCCCC[C@H](C)[NH2+][C@H]1CNCC[C@H]1F ZINC001246218194 987617284 /nfs/dbraw/zinc/61/72/84/987617284.db2.gz PDHZXBZQTMYTFB-TUAOUCFPSA-N 1 2 216.344 2.245 20 0 BEADLO Cc1nnc(C[NH2+][C@H](c2cccnc2)C2CC2)o1 ZINC001116555749 987627353 /nfs/dbraw/zinc/62/73/53/987627353.db2.gz VADBTWIUDMQILA-ZDUSSCGKSA-N 1 2 244.298 2.014 20 0 BEADLO Cc1cc(C[N@@H+]2CCCC3(CC3)C2)n[nH]1 ZINC001116631884 987652038 /nfs/dbraw/zinc/65/20/38/987652038.db2.gz RAHOTLGZYNBSQM-UHFFFAOYSA-N 1 2 205.305 2.094 20 0 BEADLO Cc1cc(C[N@H+]2CCCC3(CC3)C2)n[nH]1 ZINC001116631884 987652043 /nfs/dbraw/zinc/65/20/43/987652043.db2.gz RAHOTLGZYNBSQM-UHFFFAOYSA-N 1 2 205.305 2.094 20 0 BEADLO CCCn1c[nH+]cc1CNc1conc1C ZINC001474251889 987667421 /nfs/dbraw/zinc/66/74/21/987667421.db2.gz BEPDGOFQDBLDEC-UHFFFAOYSA-N 1 2 220.276 2.202 20 0 BEADLO Cc1cc(C[N@H+]2CCSCC[C@@H]2C)n[nH]1 ZINC001116771113 987702747 /nfs/dbraw/zinc/70/27/47/987702747.db2.gz NTGKYOBTCQZRJK-JTQLQIEISA-N 1 2 225.361 2.046 20 0 BEADLO Cc1cc(C[N@@H+]2CCSCC[C@@H]2C)n[nH]1 ZINC001116771113 987702755 /nfs/dbraw/zinc/70/27/55/987702755.db2.gz NTGKYOBTCQZRJK-JTQLQIEISA-N 1 2 225.361 2.046 20 0 BEADLO CC(C)Oc1ccc[nH+]c1N[C@@H]1C[C@@H]2COC[C@H]12 ZINC001474451046 987728127 /nfs/dbraw/zinc/72/81/27/987728127.db2.gz CXMKXSPGVYHHLL-GRYCIOLGSA-N 1 2 248.326 2.316 20 0 BEADLO CCCC[C@H](CC)N[C@H]1C[NH2+]CC1(F)F ZINC001246457059 987812649 /nfs/dbraw/zinc/81/26/49/987812649.db2.gz CBZBBHSOSQNLQN-UWVGGRQHSA-N 1 2 220.307 2.152 20 0 BEADLO CCCC[C@H](CC)[NH2+][C@H]1CNCC1(F)F ZINC001246457059 987812658 /nfs/dbraw/zinc/81/26/58/987812658.db2.gz CBZBBHSOSQNLQN-UWVGGRQHSA-N 1 2 220.307 2.152 20 0 BEADLO CC[C@H](C)C[C@H](CC)N[C@@H]1C[NH2+]CC1(F)F ZINC001246460318 987820529 /nfs/dbraw/zinc/82/05/29/987820529.db2.gz LPPBOCPTJBNVJT-GARJFASQSA-N 1 2 234.334 2.398 20 0 BEADLO Cc1[nH+]ccn1CCCOc1ccnc(C)c1 ZINC001117668624 987858228 /nfs/dbraw/zinc/85/82/28/987858228.db2.gz MSZMHWBWJXBHDZ-UHFFFAOYSA-N 1 2 231.299 2.364 20 0 BEADLO C[C@H](C(=O)N1CC[C@@H](C)C[C@H]1C)n1cc[nH+]c1 ZINC001118154591 988056718 /nfs/dbraw/zinc/05/67/18/988056718.db2.gz ZHUOHGKMDIVRQZ-IJLUTSLNSA-N 1 2 235.331 2.091 20 0 BEADLO C[C@@H]1COCC[N@@H+]1CCc1ccc(F)cc1F ZINC001322140621 988138219 /nfs/dbraw/zinc/13/82/19/988138219.db2.gz LTPXWUBUAIRLPK-SNVBAGLBSA-N 1 2 241.281 2.228 20 0 BEADLO C[C@@H]1COCC[N@H+]1CCc1ccc(F)cc1F ZINC001322140621 988138224 /nfs/dbraw/zinc/13/82/24/988138224.db2.gz LTPXWUBUAIRLPK-SNVBAGLBSA-N 1 2 241.281 2.228 20 0 BEADLO CN(C)c1ncccc1C[N@@H+]1CCC[C@H](F)C1 ZINC001118247342 988148166 /nfs/dbraw/zinc/14/81/66/988148166.db2.gz ZHDDVEGWNCEXJS-LBPRGKRZSA-N 1 2 237.322 2.082 20 0 BEADLO CN(C)c1ncccc1C[N@H+]1CCC[C@H](F)C1 ZINC001118247342 988148176 /nfs/dbraw/zinc/14/81/76/988148176.db2.gz ZHDDVEGWNCEXJS-LBPRGKRZSA-N 1 2 237.322 2.082 20 0 BEADLO Cc1ccc(C)c(Cc2nnc(C[NH+](C)C)o2)c1 ZINC001322338317 988211056 /nfs/dbraw/zinc/21/10/56/988211056.db2.gz ARVWTTOLTSGPDL-UHFFFAOYSA-N 1 2 245.326 2.339 20 0 BEADLO CC(C)OC(=O)C[N@@H+]1CC[C@@H]1Cc1ccccc1 ZINC001322422602 988265196 /nfs/dbraw/zinc/26/51/96/988265196.db2.gz MMJWSIYQAFEICR-CQSZACIVSA-N 1 2 247.338 2.255 20 0 BEADLO CC(C)OC(=O)C[N@H+]1CC[C@@H]1Cc1ccccc1 ZINC001322422602 988265213 /nfs/dbraw/zinc/26/52/13/988265213.db2.gz MMJWSIYQAFEICR-CQSZACIVSA-N 1 2 247.338 2.255 20 0 BEADLO CC[C@H]1CCC[C@@H]1c1nnc(C[NH+](C)C)o1 ZINC001118371895 988277345 /nfs/dbraw/zinc/27/73/45/988277345.db2.gz JCKXVZNAWGANLC-UWVGGRQHSA-N 1 2 223.320 2.425 20 0 BEADLO C[C@H]1CC[C@@H](c2nnc(C[NH+](C)C)o2)C1 ZINC001118419373 988335015 /nfs/dbraw/zinc/33/50/15/988335015.db2.gz VRSRDGZFFSHUDF-DTWKUNHWSA-N 1 2 209.293 2.035 20 0 BEADLO C[C@@H](Cc1nnc(C[NH+](C)C)o1)c1ccccc1 ZINC001322582351 988335470 /nfs/dbraw/zinc/33/54/70/988335470.db2.gz IUCRPQVMEJWAPV-NSHDSACASA-N 1 2 245.326 2.477 20 0 BEADLO C[C@H]1CCC[C@@]1(C)c1nnc(C[NH+](C)C)o1 ZINC001118432793 988345959 /nfs/dbraw/zinc/34/59/59/988345959.db2.gz LRMCYIBLOXIDRX-JOYOIKCWSA-N 1 2 223.320 2.209 20 0 BEADLO C[C@H]1CCC[C@]1(C)c1nnc(C[NH+](C)C)o1 ZINC001118432792 988349647 /nfs/dbraw/zinc/34/96/47/988349647.db2.gz LRMCYIBLOXIDRX-CABZTGNLSA-N 1 2 223.320 2.209 20 0 BEADLO CC(C)CC[C@@H]1CCC[N@@H+]1Cc1nnc[nH]1 ZINC001118495847 988386570 /nfs/dbraw/zinc/38/65/70/988386570.db2.gz DXOGYBJQZGCGNR-NSHDSACASA-N 1 2 222.336 2.205 20 0 BEADLO CC(C)CC[C@@H]1CCC[N@H+]1Cc1nnc[nH]1 ZINC001118495847 988386587 /nfs/dbraw/zinc/38/65/87/988386587.db2.gz DXOGYBJQZGCGNR-NSHDSACASA-N 1 2 222.336 2.205 20 0 BEADLO C[NH+](C)Cc1nnc(C=C2CCCC2)o1 ZINC001322983792 988421905 /nfs/dbraw/zinc/42/19/05/988421905.db2.gz QBWAEERRHDUNFD-UHFFFAOYSA-N 1 2 207.277 2.089 20 0 BEADLO CC(C)C1(C)CC[NH+](Cc2nnc[nH]2)CC1 ZINC001118557905 988436748 /nfs/dbraw/zinc/43/67/48/988436748.db2.gz LGVDTCUAPLWBKE-UHFFFAOYSA-N 1 2 222.336 2.063 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@H]2c2cc(C)no2)[nH]n1 ZINC001323304049 988492437 /nfs/dbraw/zinc/49/24/37/988492437.db2.gz SPIOWICAHKJHHQ-LBPRGKRZSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@H]2c2cc(C)no2)[nH]n1 ZINC001323304049 988492443 /nfs/dbraw/zinc/49/24/43/988492443.db2.gz SPIOWICAHKJHHQ-LBPRGKRZSA-N 1 2 246.314 2.352 20 0 BEADLO CCC(C)(C)[C@H](C)NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001118727366 988526061 /nfs/dbraw/zinc/52/60/61/988526061.db2.gz YOEVFLSCOYUVMQ-MNOVXSKESA-N 1 2 237.347 2.385 20 0 BEADLO CCC1(CC)CCN(C(=O)[C@H](C)n2cc[nH+]c2)C1 ZINC001323739426 988601053 /nfs/dbraw/zinc/60/10/53/988601053.db2.gz VLEINTYIFLGGAB-LBPRGKRZSA-N 1 2 249.358 2.483 20 0 BEADLO CC[C@H](CSC)[N@H+](C)Cc1cc(C)[nH]n1 ZINC001323817696 988623689 /nfs/dbraw/zinc/62/36/89/988623689.db2.gz WEBHBGMOVBYKMG-LLVKDONJSA-N 1 2 227.377 2.292 20 0 BEADLO CC[C@H](CSC)[N@@H+](C)Cc1cc(C)[nH]n1 ZINC001323817696 988623700 /nfs/dbraw/zinc/62/37/00/988623700.db2.gz WEBHBGMOVBYKMG-LLVKDONJSA-N 1 2 227.377 2.292 20 0 BEADLO Cc1c[nH+]c2c(c1)N(C(=O)CC1(C)CC1)CCN2 ZINC001118849891 988648287 /nfs/dbraw/zinc/64/82/87/988648287.db2.gz XWFLUVJBOXOWOV-UHFFFAOYSA-N 1 2 245.326 2.339 20 0 BEADLO C[C@@H](O)CCCn1c[nH+]c(C(C)(C)C)c1 ZINC001118928154 988711262 /nfs/dbraw/zinc/71/12/62/988711262.db2.gz XAGFHYFBWCENRO-SNVBAGLBSA-N 1 2 210.321 2.342 20 0 BEADLO CCC[C@@H](C)Cc1nnc(C[NH+](C)C)o1 ZINC001324177313 988738350 /nfs/dbraw/zinc/73/83/50/988738350.db2.gz CWWFGSSBJWDMNF-SECBINFHSA-N 1 2 211.309 2.110 20 0 BEADLO C[C@H](C(=O)NC[C@H]1CCCC1(C)C)n1cc[nH+]c1 ZINC001324455001 988846427 /nfs/dbraw/zinc/84/64/27/988846427.db2.gz VAZKDELTKILEET-VXGBXAGGSA-N 1 2 249.358 2.387 20 0 BEADLO CCc1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001247389729 988871524 /nfs/dbraw/zinc/87/15/24/988871524.db2.gz QJRQNNOCYFXJMP-UHFFFAOYSA-N 1 2 240.266 2.485 20 0 BEADLO CC(C)c1oncc1NC(=O)CCc1[nH]cc[nH+]1 ZINC001514581791 988898276 /nfs/dbraw/zinc/89/82/76/988898276.db2.gz WJUPYSDRKXENAR-UHFFFAOYSA-N 1 2 248.286 2.092 20 0 BEADLO CC[C@@H]1CCC[C@H]1CNC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001324790658 988980624 /nfs/dbraw/zinc/98/06/24/988980624.db2.gz NWBJCYOIPSMKJZ-UPJWGTAASA-N 1 2 249.358 2.387 20 0 BEADLO Cc1cnc(N2CCC[C@@H](n3cc[nH+]c3)C2)o1 ZINC001119401950 989043734 /nfs/dbraw/zinc/04/37/34/989043734.db2.gz LOUYWTIOOHGVJZ-LLVKDONJSA-N 1 2 232.287 2.021 20 0 BEADLO c1[nH+]cn2ccnc(N3CCC[C@@H]3C3CC3)c12 ZINC001515445453 989048026 /nfs/dbraw/zinc/04/80/26/989048026.db2.gz UKZLZSKWFVYOGT-LLVKDONJSA-N 1 2 228.299 2.108 20 0 BEADLO C[C@H](C(=O)N1CC(C)(C)C[C@@H]1C)n1cc[nH+]c1 ZINC001325251008 989132502 /nfs/dbraw/zinc/13/25/02/989132502.db2.gz ZPBOHGJJMLQGFV-WDEREUQCSA-N 1 2 235.331 2.091 20 0 BEADLO C[C@@H](C(=O)N1C[C@@H](C)CC(C)(C)C1)n1cc[nH+]c1 ZINC001325298197 989150898 /nfs/dbraw/zinc/15/08/98/989150898.db2.gz BOGJLXMVCTXQRQ-RYUDHWBXSA-N 1 2 249.358 2.339 20 0 BEADLO Cc1cc(C)nc(C[N@H+](C)C[C@H]2CCCCO2)n1 ZINC001248965615 989231462 /nfs/dbraw/zinc/23/14/62/989231462.db2.gz KPDRVDIWXGPBRR-CYBMUJFWSA-N 1 2 249.358 2.094 20 0 BEADLO Cc1cc(C)nc(C[N@@H+](C)C[C@H]2CCCCO2)n1 ZINC001248965615 989231478 /nfs/dbraw/zinc/23/14/78/989231478.db2.gz KPDRVDIWXGPBRR-CYBMUJFWSA-N 1 2 249.358 2.094 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@@H]1CC[C@H](C)C1 ZINC001518049745 989270228 /nfs/dbraw/zinc/27/02/28/989270228.db2.gz XFBHOOKGPKPGSZ-WDEREUQCSA-N 1 2 236.315 2.382 20 0 BEADLO CCn1c[nH+]cc1COC(=O)C(C)(C)C1CC1 ZINC001518049207 989278486 /nfs/dbraw/zinc/27/84/86/989278486.db2.gz UCMSLHRWOUWGEF-UHFFFAOYSA-N 1 2 236.315 2.382 20 0 BEADLO Fc1cc2cc[nH]c2c(C[N@H+]2C[C@H]3C[C@@H](C2)O3)c1 ZINC001249525204 989302899 /nfs/dbraw/zinc/30/28/99/989302899.db2.gz CYVDMIPYBZYOMW-BETUJISGSA-N 1 2 246.285 2.280 20 0 BEADLO Fc1cc2cc[nH]c2c(C[N@@H+]2C[C@H]3C[C@@H](C2)O3)c1 ZINC001249525204 989302904 /nfs/dbraw/zinc/30/29/04/989302904.db2.gz CYVDMIPYBZYOMW-BETUJISGSA-N 1 2 246.285 2.280 20 0 BEADLO CCn1c[nH+]cc1COC(=O)c1oc(C)cc1C ZINC001520443164 989567326 /nfs/dbraw/zinc/56/73/26/989567326.db2.gz WQWPEQPAMDGZED-UHFFFAOYSA-N 1 2 248.282 2.470 20 0 BEADLO CCN(C(=O)[C@H](C)n1cc[nH+]c1)[C@H](C)C(C)C ZINC001326800664 989722105 /nfs/dbraw/zinc/72/21/05/989722105.db2.gz SBHNAKZXMAYLRS-NEPJUHHUSA-N 1 2 237.347 2.337 20 0 BEADLO Cc1nc([C@H](C)[NH2+][C@H]2CC[C@H](C)SC2)no1 ZINC001326853511 989747738 /nfs/dbraw/zinc/74/77/38/989747738.db2.gz OMJOTWXQIMYVPZ-NRPADANISA-N 1 2 241.360 2.313 20 0 BEADLO CCC[C@H]1CCCN1C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC001120712759 989842794 /nfs/dbraw/zinc/84/27/94/989842794.db2.gz SUESBZDIXOHWNV-YPMHNXCESA-N 1 2 249.358 2.379 20 0 BEADLO CCC[C@H]1CCCN1C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC001120712759 989842796 /nfs/dbraw/zinc/84/27/96/989842796.db2.gz SUESBZDIXOHWNV-YPMHNXCESA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H](C(=O)N1CC[C@H]1C(C)(C)C)n1cc[nH+]c1 ZINC001120850390 989920571 /nfs/dbraw/zinc/92/05/71/989920571.db2.gz VRSPVYJWDJLVDV-QWRGUYRKSA-N 1 2 235.331 2.091 20 0 BEADLO CCc1ccc(N2CC[C@@H]3C[C@@H]3C2)[nH+]c1 ZINC001120863483 989935180 /nfs/dbraw/zinc/93/51/80/989935180.db2.gz ZTXVZFFDMVURMA-VXGBXAGGSA-N 1 2 202.301 2.490 20 0 BEADLO CCc1ccc(N2C[C@@H](C)[C@H](O)[C@@H](C)C2)[nH+]c1 ZINC001120945511 989980950 /nfs/dbraw/zinc/98/09/50/989980950.db2.gz DDSHEUGFFVNLGB-YABSGUDNSA-N 1 2 234.343 2.097 20 0 BEADLO Cc1cc(F)cc(N2CC[C@H]3C[C@H]3C2)[nH+]1 ZINC001120949325 989983494 /nfs/dbraw/zinc/98/34/94/989983494.db2.gz OFZQGTIWDGQRGZ-UWVGGRQHSA-N 1 2 206.264 2.375 20 0 BEADLO CC[C@H](SC)C(=O)Nc1c(C)c[nH+]cc1C ZINC001121232106 990040019 /nfs/dbraw/zinc/04/00/19/990040019.db2.gz VGGYYKQVBKLKPU-JTQLQIEISA-N 1 2 238.356 2.200 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C ZINC001121231225 990053054 /nfs/dbraw/zinc/05/30/54/990053054.db2.gz JOGLEDQJZREQOA-HUXSOILUSA-N 1 2 244.338 2.351 20 0 BEADLO CC[C@@]1(C)CCCN(C(=O)C[C@H]([NH3+])C(F)F)C1 ZINC001121880300 990106548 /nfs/dbraw/zinc/10/65/48/990106548.db2.gz JXGGBPMIBULPKS-CABZTGNLSA-N 1 2 248.317 2.008 20 0 BEADLO C/C=C(\C)C(=O)OCC(C)(C)n1cc[nH+]c1 ZINC001526088938 990114600 /nfs/dbraw/zinc/11/46/00/990114600.db2.gz RSNPUTZOHCDJPR-BJMVGYQFSA-N 1 2 222.288 2.128 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)Cc1ccsc1 ZINC001534713593 990454272 /nfs/dbraw/zinc/45/42/72/990454272.db2.gz WNPDLUBOPQNJFS-UHFFFAOYSA-N 1 2 246.335 2.363 20 0 BEADLO CN(C(=O)CCc1[nH+]ccn1C)c1ccccc1 ZINC001123568395 990614931 /nfs/dbraw/zinc/61/49/31/990614931.db2.gz DSDOLRUCYHBCOT-UHFFFAOYSA-N 1 2 243.310 2.016 20 0 BEADLO CC[C@H]1CC[C@H](C)N1C(=O)CCc1[nH+]ccn1C ZINC001123782050 990667869 /nfs/dbraw/zinc/66/78/69/990667869.db2.gz DGLBRJXDHLUSFG-RYUDHWBXSA-N 1 2 249.358 2.142 20 0 BEADLO CC(C)c1cc(NC(=O)[C@H](C)n2cc[nH+]c2)no1 ZINC001544893933 990739776 /nfs/dbraw/zinc/73/97/76/990739776.db2.gz YRORNYDOJBRCLQ-VIFPVBQESA-N 1 2 248.286 2.194 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@H]1CCCC(C)(C)C1 ZINC001556231678 990812228 /nfs/dbraw/zinc/81/22/28/990812228.db2.gz KOSPWFAAALWHCZ-LLVKDONJSA-N 1 2 249.358 2.346 20 0 BEADLO O[C@H]1CCC[N@H+](Cc2cc(F)cc(F)c2F)C1 ZINC001137867517 990863445 /nfs/dbraw/zinc/86/34/45/990863445.db2.gz ZLJPFKKQCTYAGP-JTQLQIEISA-N 1 2 245.244 2.061 20 0 BEADLO O[C@H]1CCC[N@@H+](Cc2cc(F)cc(F)c2F)C1 ZINC001137867517 990863447 /nfs/dbraw/zinc/86/34/47/990863447.db2.gz ZLJPFKKQCTYAGP-JTQLQIEISA-N 1 2 245.244 2.061 20 0 BEADLO CCOc1cccc(C[N@@H+]2CCC(=O)[C@H](C)C2)c1 ZINC001138096044 990882514 /nfs/dbraw/zinc/88/25/14/990882514.db2.gz RDCWJXFFPUSIOF-GFCCVEGCSA-N 1 2 247.338 2.496 20 0 BEADLO CCOc1cccc(C[N@H+]2CCC(=O)[C@H](C)C2)c1 ZINC001138096044 990882515 /nfs/dbraw/zinc/88/25/15/990882515.db2.gz RDCWJXFFPUSIOF-GFCCVEGCSA-N 1 2 247.338 2.496 20 0 BEADLO c1cnc2ccc(C[NH+]3CC4(CCO4)C3)cc2c1 ZINC001138111878 990885004 /nfs/dbraw/zinc/88/50/04/990885004.db2.gz USNFIOYCAUXFNJ-UHFFFAOYSA-N 1 2 240.306 2.210 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1cc(O)cc(O)c1 ZINC001138324469 990914798 /nfs/dbraw/zinc/91/47/98/990914798.db2.gz OQAGCOZMTPFQFP-PSASIEDQSA-N 1 2 225.263 2.030 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1cc(O)cc(O)c1 ZINC001138324469 990914801 /nfs/dbraw/zinc/91/48/01/990914801.db2.gz OQAGCOZMTPFQFP-PSASIEDQSA-N 1 2 225.263 2.030 20 0 BEADLO Cc1c2ccccc2[nH]c1C[N@@H+](C)C1COC1 ZINC001138401191 990941442 /nfs/dbraw/zinc/94/14/42/990941442.db2.gz CZFNNKJZRHFVAN-UHFFFAOYSA-N 1 2 230.311 2.307 20 0 BEADLO Cc1c2ccccc2[nH]c1C[N@H+](C)C1COC1 ZINC001138401191 990941448 /nfs/dbraw/zinc/94/14/48/990941448.db2.gz CZFNNKJZRHFVAN-UHFFFAOYSA-N 1 2 230.311 2.307 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1cc2cc(C)ccc2[nH]1 ZINC001138418780 990943797 /nfs/dbraw/zinc/94/37/97/990943797.db2.gz GXSUHDPQCZCXEW-UHFFFAOYSA-N 1 2 230.311 2.497 20 0 BEADLO CC(=O)C[N@H+](C)Cc1cc2cc(C)ccc2[nH]1 ZINC001138418780 990943803 /nfs/dbraw/zinc/94/38/03/990943803.db2.gz GXSUHDPQCZCXEW-UHFFFAOYSA-N 1 2 230.311 2.497 20 0 BEADLO COc1c(C)cc(C[N@@H+]2CCC23COC3)cc1C ZINC001138429419 990945694 /nfs/dbraw/zinc/94/56/94/990945694.db2.gz CDGHHUDBYAFGHL-UHFFFAOYSA-N 1 2 247.338 2.287 20 0 BEADLO COc1c(C)cc(C[N@H+]2CCC23COC3)cc1C ZINC001138429419 990945701 /nfs/dbraw/zinc/94/57/01/990945701.db2.gz CDGHHUDBYAFGHL-UHFFFAOYSA-N 1 2 247.338 2.287 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@H]2CCCC[C@H]2C)c[nH+]1 ZINC001558497331 990948733 /nfs/dbraw/zinc/94/87/33/990948733.db2.gz KDSKOXBRNUFTEC-PWSUYJOCSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@H]2CCCC[C@H]2C)[nH+]1 ZINC001558497331 990948738 /nfs/dbraw/zinc/94/87/38/990948738.db2.gz KDSKOXBRNUFTEC-PWSUYJOCSA-N 1 2 249.358 2.415 20 0 BEADLO COc1ccc(C)cc1C[N@@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001138489647 990962775 /nfs/dbraw/zinc/96/27/75/990962775.db2.gz VSILYZMCXPWVIS-ZIAGYGMSSA-N 1 2 247.338 2.367 20 0 BEADLO COc1ccc(C)cc1C[N@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001138489647 990962786 /nfs/dbraw/zinc/96/27/86/990962786.db2.gz VSILYZMCXPWVIS-ZIAGYGMSSA-N 1 2 247.338 2.367 20 0 BEADLO Cc1cc(C(=O)NCc2c[nH]c(C(C)C)[nH+]2)co1 ZINC001558560964 990969287 /nfs/dbraw/zinc/96/92/87/990969287.db2.gz PSWFOZSQCLBADL-UHFFFAOYSA-N 1 2 247.298 2.365 20 0 BEADLO Cc1cc(C(=O)NCc2c[nH+]c(C(C)C)[nH]2)co1 ZINC001558560964 990969301 /nfs/dbraw/zinc/96/93/01/990969301.db2.gz PSWFOZSQCLBADL-UHFFFAOYSA-N 1 2 247.298 2.365 20 0 BEADLO CC(C)C[C@@H](C)C[C@H](C)[N@@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001258075098 990971686 /nfs/dbraw/zinc/97/16/86/990971686.db2.gz RCTMZUPEDLDRRA-VOAKCMCISA-N 1 2 239.359 2.447 20 0 BEADLO CC(C)C[C@@H](C)C[C@H](C)[N@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001258075098 990971693 /nfs/dbraw/zinc/97/16/93/990971693.db2.gz RCTMZUPEDLDRRA-VOAKCMCISA-N 1 2 239.359 2.447 20 0 BEADLO C=Cn1cc(CNc2cc3cc[nH]c3c[nH+]2)cn1 ZINC001308450748 990996434 /nfs/dbraw/zinc/99/64/34/990996434.db2.gz PWMKLWSNWNCWPI-UHFFFAOYSA-N 1 2 239.282 2.472 20 0 BEADLO COC(=O)C1([NH2+][C@H]2C[C@H](C)C[C@H](C)C2)CC1 ZINC001258151123 991031845 /nfs/dbraw/zinc/03/18/45/991031845.db2.gz DSXQZYAMQLPYPF-URLYPYJESA-N 1 2 225.332 2.106 20 0 BEADLO Cn1c[nH+]c2cc(Nc3cc(F)ncn3)ccc21 ZINC001559119421 991038259 /nfs/dbraw/zinc/03/82/59/991038259.db2.gz NTBBUWZHZZCHQZ-UHFFFAOYSA-N 1 2 243.245 2.246 20 0 BEADLO C[C@H]1CC([N@@H+]2CCC(=O)[C@H](F)C2)C[C@H](C)C1 ZINC001258167035 991061156 /nfs/dbraw/zinc/06/11/56/991061156.db2.gz FSMIZVMQLIQCTB-CKYFFXLPSA-N 1 2 227.323 2.424 20 0 BEADLO C[C@H]1CC([N@H+]2CCC(=O)[C@H](F)C2)C[C@H](C)C1 ZINC001258167035 991061163 /nfs/dbraw/zinc/06/11/63/991061163.db2.gz FSMIZVMQLIQCTB-CKYFFXLPSA-N 1 2 227.323 2.424 20 0 BEADLO C[N@H+](CCF)Cc1ccnc(Cl)c1 ZINC001138822989 991075007 /nfs/dbraw/zinc/07/50/07/991075007.db2.gz WTTAPVIVZOPFCW-UHFFFAOYSA-N 1 2 202.660 2.136 20 0 BEADLO Clc1cc(C[N@@H+]2CC[C@@]23CCOC3)ccn1 ZINC001138821489 991072476 /nfs/dbraw/zinc/07/24/76/991072476.db2.gz UKVITZDVGBGDDR-LBPRGKRZSA-N 1 2 238.718 2.100 20 0 BEADLO Clc1cc(C[N@H+]2CC[C@@]23CCOC3)ccn1 ZINC001138821489 991072489 /nfs/dbraw/zinc/07/24/89/991072489.db2.gz UKVITZDVGBGDDR-LBPRGKRZSA-N 1 2 238.718 2.100 20 0 BEADLO C[N@@H+](CCF)Cc1ccnc(Cl)c1 ZINC001138822989 991075012 /nfs/dbraw/zinc/07/50/12/991075012.db2.gz WTTAPVIVZOPFCW-UHFFFAOYSA-N 1 2 202.660 2.136 20 0 BEADLO CO[C@H]1CC[N@H+](Cc2cc(F)cnc2Cl)C1 ZINC001138891033 991093697 /nfs/dbraw/zinc/09/36/97/991093697.db2.gz LFQUBECWVTUPHL-JTQLQIEISA-N 1 2 244.697 2.095 20 0 BEADLO CO[C@H]1CC[N@@H+](Cc2cc(F)cnc2Cl)C1 ZINC001138891033 991093706 /nfs/dbraw/zinc/09/37/06/991093706.db2.gz LFQUBECWVTUPHL-JTQLQIEISA-N 1 2 244.697 2.095 20 0 BEADLO CCCOc1ccccc1C[N@@H+]1C[C@@H]2C[C@H]1CO2 ZINC001139002164 991123982 /nfs/dbraw/zinc/12/39/82/991123982.db2.gz VPDVABVPNVDUKV-KBPBESRZSA-N 1 2 247.338 2.449 20 0 BEADLO CCCOc1ccccc1C[N@H+]1C[C@@H]2C[C@H]1CO2 ZINC001139002164 991123986 /nfs/dbraw/zinc/12/39/86/991123986.db2.gz VPDVABVPNVDUKV-KBPBESRZSA-N 1 2 247.338 2.449 20 0 BEADLO CCCc1ncc(C[NH2+]Cc2conc2C)o1 ZINC001308767431 991126096 /nfs/dbraw/zinc/12/60/96/991126096.db2.gz SUQMWNJITGTFEL-UHFFFAOYSA-N 1 2 235.287 2.213 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@H](C)c1ccsc1 ZINC001139132785 991154944 /nfs/dbraw/zinc/15/49/44/991154944.db2.gz OKGQMLSYILBHOQ-MRVPVSSYSA-N 1 2 249.339 2.200 20 0 BEADLO CO[C@@H](C)CNc1c[nH+]cc2c1CCCC2 ZINC001308858033 991187394 /nfs/dbraw/zinc/18/73/94/991187394.db2.gz AQJUSJGRIOHNRX-JTQLQIEISA-N 1 2 220.316 2.407 20 0 BEADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1cnc(N)s1 ZINC001139230649 991211714 /nfs/dbraw/zinc/21/17/14/991211714.db2.gz FNTSISPWLTZPHA-SECBINFHSA-N 1 2 248.355 2.104 20 0 BEADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1cnc(N)s1 ZINC001139230649 991211724 /nfs/dbraw/zinc/21/17/24/991211724.db2.gz FNTSISPWLTZPHA-SECBINFHSA-N 1 2 248.355 2.104 20 0 BEADLO COCC[N@H+](C)Cc1cc(Cl)cnc1Cl ZINC001139354600 991229027 /nfs/dbraw/zinc/22/90/27/991229027.db2.gz WSCKGYNZUHWFRZ-UHFFFAOYSA-N 1 2 249.141 2.467 20 0 BEADLO COCC[N@@H+](C)Cc1cc(Cl)cnc1Cl ZINC001139354600 991229041 /nfs/dbraw/zinc/22/90/41/991229041.db2.gz WSCKGYNZUHWFRZ-UHFFFAOYSA-N 1 2 249.141 2.467 20 0 BEADLO c1cn(-c2ccc(CN3CCCCO3)cc2)c[nH+]1 ZINC001139358446 991230634 /nfs/dbraw/zinc/23/06/34/991230634.db2.gz RVVDKEZOSWZVFT-UHFFFAOYSA-N 1 2 243.310 2.400 20 0 BEADLO COc1ccncc1C[N@H+](C)Cc1ccncc1 ZINC001139606900 991287419 /nfs/dbraw/zinc/28/74/19/991287419.db2.gz RWXJCVAVKFIJBE-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1ccncc1C[N@@H+](C)Cc1ccncc1 ZINC001139606900 991287428 /nfs/dbraw/zinc/28/74/28/991287428.db2.gz RWXJCVAVKFIJBE-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO Cc1nc2cc(C)ccn2c1C[N@H+](C)CCF ZINC001139679861 991313018 /nfs/dbraw/zinc/31/30/18/991313018.db2.gz XVHMBMPBXQVQCZ-UHFFFAOYSA-N 1 2 235.306 2.352 20 0 BEADLO Cc1nc2cc(C)ccn2c1C[N@@H+](C)CCF ZINC001139679861 991313027 /nfs/dbraw/zinc/31/30/27/991313027.db2.gz XVHMBMPBXQVQCZ-UHFFFAOYSA-N 1 2 235.306 2.352 20 0 BEADLO Cc1cnc(C[NH+]2CC(c3cccnc3)C2)s1 ZINC001139813376 991378255 /nfs/dbraw/zinc/37/82/55/991378255.db2.gz FCXKVGCABDAUNI-UHFFFAOYSA-N 1 2 245.351 2.446 20 0 BEADLO COc1ncc(C[N@H+](C)C2CC(F)(F)C2)s1 ZINC001139815145 991380031 /nfs/dbraw/zinc/38/00/31/991380031.db2.gz YMVKLZDERZVSAJ-UHFFFAOYSA-N 1 2 248.298 2.381 20 0 BEADLO COc1ncc(C[N@@H+](C)C2CC(F)(F)C2)s1 ZINC001139815145 991380036 /nfs/dbraw/zinc/38/00/36/991380036.db2.gz YMVKLZDERZVSAJ-UHFFFAOYSA-N 1 2 248.298 2.381 20 0 BEADLO CCCCC[C@@H](CC)[N@@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001258442955 991380419 /nfs/dbraw/zinc/38/04/19/991380419.db2.gz IBKDJWJNDDKBIE-WOPDTQHZSA-N 1 2 225.332 2.345 20 0 BEADLO CCCCC[C@@H](CC)[N@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001258442955 991380425 /nfs/dbraw/zinc/38/04/25/991380425.db2.gz IBKDJWJNDDKBIE-WOPDTQHZSA-N 1 2 225.332 2.345 20 0 BEADLO CCCCC[C@H](CC)[NH+]1CC(F)(CO)C1 ZINC001258440570 991381613 /nfs/dbraw/zinc/38/16/13/991381613.db2.gz TUMZJTKFNCCTDD-NSHDSACASA-N 1 2 217.328 2.362 20 0 BEADLO CCCCC[C@@H](CC)[N@@H+]1CCOC(=O)C1 ZINC001258444232 991386843 /nfs/dbraw/zinc/38/68/43/991386843.db2.gz UXZZOOQBBRDQGY-LLVKDONJSA-N 1 2 213.321 2.204 20 0 BEADLO CCCCC[C@@H](CC)[N@H+]1CCOC(=O)C1 ZINC001258444232 991386851 /nfs/dbraw/zinc/38/68/51/991386851.db2.gz UXZZOOQBBRDQGY-LLVKDONJSA-N 1 2 213.321 2.204 20 0 BEADLO CCCCC[C@@H](CC)[NH+]1CC(S(C)(=O)=O)C1 ZINC001258445024 991384842 /nfs/dbraw/zinc/38/48/42/991384842.db2.gz DXLXVVDAHAVNDR-LLVKDONJSA-N 1 2 247.404 2.074 20 0 BEADLO Cc1[nH]c([C@H]2CCCN2Cc2ccon2)[nH+]c1C ZINC001560136985 991391178 /nfs/dbraw/zinc/39/11/78/991391178.db2.gz OFMYYOFABYOBMI-GFCCVEGCSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1ccc(C[N@@H+]2CCc3cccnc3C2)nc1 ZINC001139842695 991400786 /nfs/dbraw/zinc/40/07/86/991400786.db2.gz WQABLBOTRKRGDK-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1ccc(C[N@H+]2CCc3cccnc3C2)nc1 ZINC001139842695 991400789 /nfs/dbraw/zinc/40/07/89/991400789.db2.gz WQABLBOTRKRGDK-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO c1ccc2c(c1)cncc2C[N@@H+]1CCO[C@@H]2C[C@@H]21 ZINC001139899360 991415135 /nfs/dbraw/zinc/41/51/35/991415135.db2.gz ZMQXYEBPLCOHTQ-LSDHHAIUSA-N 1 2 240.306 2.208 20 0 BEADLO c1ccc2c(c1)cncc2C[N@H+]1CCO[C@@H]2C[C@@H]21 ZINC001139899360 991415143 /nfs/dbraw/zinc/41/51/43/991415143.db2.gz ZMQXYEBPLCOHTQ-LSDHHAIUSA-N 1 2 240.306 2.208 20 0 BEADLO COc1ccc(C[NH+]2CC3(CCC3)C2)c(OC)n1 ZINC001139919329 991418581 /nfs/dbraw/zinc/41/85/81/991418581.db2.gz FKDWDGHCYLBAFM-UHFFFAOYSA-N 1 2 248.326 2.085 20 0 BEADLO CCOC(=O)CC[C@@H](C)[N@@H+]1Cc2ccncc2C1 ZINC001258494747 991464981 /nfs/dbraw/zinc/46/49/81/991464981.db2.gz ANQGKBVTFSWEBH-LLVKDONJSA-N 1 2 248.326 2.129 20 0 BEADLO CCOC(=O)CC[C@@H](C)[N@H+]1Cc2ccncc2C1 ZINC001258494747 991464986 /nfs/dbraw/zinc/46/49/86/991464986.db2.gz ANQGKBVTFSWEBH-LLVKDONJSA-N 1 2 248.326 2.129 20 0 BEADLO CN(C)c1ccc(NCc2cnsc2)[nH+]c1 ZINC001560382195 991465099 /nfs/dbraw/zinc/46/50/99/991465099.db2.gz LTQFIIDPBRGQNI-UHFFFAOYSA-N 1 2 234.328 2.216 20 0 BEADLO Nc1nccnc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC001140011877 991482238 /nfs/dbraw/zinc/48/22/38/991482238.db2.gz JAILKVRQKAQJMS-CYBMUJFWSA-N 1 2 240.310 2.006 20 0 BEADLO Nc1nccnc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC001140011877 991482245 /nfs/dbraw/zinc/48/22/45/991482245.db2.gz JAILKVRQKAQJMS-CYBMUJFWSA-N 1 2 240.310 2.006 20 0 BEADLO Cc1nc(C[NH2+]C2(CF)CCOCC2)cs1 ZINC001560489217 991486423 /nfs/dbraw/zinc/48/64/23/991486423.db2.gz ZSTNONGUZZADHT-UHFFFAOYSA-N 1 2 244.335 2.060 20 0 BEADLO Oc1ccc(F)c(C[NH+]2CCSCC2)c1 ZINC001140046125 991497400 /nfs/dbraw/zinc/49/74/00/991497400.db2.gz WKNPFBCFZDSTOY-UHFFFAOYSA-N 1 2 227.304 2.080 20 0 BEADLO COc1ccc2n[nH]c(C[N@@H+]3CC[C@H](F)C3)c2c1 ZINC001140065021 991518378 /nfs/dbraw/zinc/51/83/78/991518378.db2.gz WJNLWVVWTHJWTK-VIFPVBQESA-N 1 2 249.289 2.115 20 0 BEADLO COc1ccc2n[nH]c(C[N@H+]3CC[C@H](F)C3)c2c1 ZINC001140065021 991518388 /nfs/dbraw/zinc/51/83/88/991518388.db2.gz WJNLWVVWTHJWTK-VIFPVBQESA-N 1 2 249.289 2.115 20 0 BEADLO CC(C)[C@H]1COCC[N@@H+]1Cc1cccc(F)n1 ZINC001140133898 991532327 /nfs/dbraw/zinc/53/23/27/991532327.db2.gz HGLCDMIQTWWECY-GFCCVEGCSA-N 1 2 238.306 2.078 20 0 BEADLO CC(C)[C@H]1COCC[N@H+]1Cc1cccc(F)n1 ZINC001140133898 991532336 /nfs/dbraw/zinc/53/23/36/991532336.db2.gz HGLCDMIQTWWECY-GFCCVEGCSA-N 1 2 238.306 2.078 20 0 BEADLO Oc1ccc(C[NH+]2CC(C(F)F)C2)c(F)c1 ZINC001140130858 991533688 /nfs/dbraw/zinc/53/36/88/991533688.db2.gz VKHRQIVIAHEEAB-UHFFFAOYSA-N 1 2 231.217 2.228 20 0 BEADLO C[C@@H](Cc1cccnc1)[N@@H+]1C[C@@H](F)C[C@H]1CF ZINC001258622856 991556887 /nfs/dbraw/zinc/55/68/87/991556887.db2.gz SVNSNPGYVBTXRX-DRZSPHRISA-N 1 2 240.297 2.395 20 0 BEADLO C[C@@H](Cc1cccnc1)[N@H+]1C[C@@H](F)C[C@H]1CF ZINC001258622856 991556901 /nfs/dbraw/zinc/55/69/01/991556901.db2.gz SVNSNPGYVBTXRX-DRZSPHRISA-N 1 2 240.297 2.395 20 0 BEADLO CCC[C@@H](Cc1ccccc1)[NH2+]CC(=O)OC ZINC001258649440 991575121 /nfs/dbraw/zinc/57/51/21/991575121.db2.gz HJADUELBKBZIHA-ZDUSSCGKSA-N 1 2 235.327 2.160 20 0 BEADLO CC[N@H+](C)Cc1nnc(CC2CCCC2)o1 ZINC001258640983 991581537 /nfs/dbraw/zinc/58/15/37/991581537.db2.gz YQFVOUTZYHQBRQ-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO CC[N@@H+](C)Cc1nnc(CC2CCCC2)o1 ZINC001258640983 991581547 /nfs/dbraw/zinc/58/15/47/991581547.db2.gz YQFVOUTZYHQBRQ-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO C[C@@H](C(=O)N(C)[C@@H](C)C(C)(C)C)n1cc[nH+]c1 ZINC001317998786 991608434 /nfs/dbraw/zinc/60/84/34/991608434.db2.gz OQHBWIUSZXDGPQ-QWRGUYRKSA-N 1 2 237.347 2.337 20 0 BEADLO C[C@H](C(=O)N1CCC(C)(C)CC1)n1cc[nH+]c1 ZINC001318180402 991629932 /nfs/dbraw/zinc/62/99/32/991629932.db2.gz BTQUXFXINJQIQS-LLVKDONJSA-N 1 2 235.331 2.093 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1nc(Cl)ccc1C ZINC001140448759 991641277 /nfs/dbraw/zinc/64/12/77/991641277.db2.gz QBQJIVMGVSWVKL-JTQLQIEISA-N 1 2 240.734 2.264 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1nc(Cl)ccc1C ZINC001140448759 991641282 /nfs/dbraw/zinc/64/12/82/991641282.db2.gz QBQJIVMGVSWVKL-JTQLQIEISA-N 1 2 240.734 2.264 20 0 BEADLO CCC[NH+]1CCC([NH2+]C2=CC=C[CH]2)CC1 ZINC001258769281 991733846 /nfs/dbraw/zinc/73/38/46/991733846.db2.gz JHPZJLYCEUDDAL-UHFFFAOYSA-N 1 2 205.325 2.108 20 0 BEADLO CC(C)CC1(CNC(=O)[C@H](C)n2cc[nH+]c2)CC1 ZINC001319246165 991826602 /nfs/dbraw/zinc/82/66/02/991826602.db2.gz SPDXRHQVZNZAAN-LBPRGKRZSA-N 1 2 249.358 2.387 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1ccc(CF)cc1 ZINC001566189029 991829722 /nfs/dbraw/zinc/82/97/22/991829722.db2.gz UOIYCVFYTCZKPH-UHFFFAOYSA-N 1 2 247.273 2.118 20 0 BEADLO C[C@@H]1CCC[C@H]([NH+]2CC(O)(C(F)(F)F)C2)C1 ZINC001258820209 991843335 /nfs/dbraw/zinc/84/33/35/991843335.db2.gz VRSQQKCHSHCKQR-BDAKNGLRSA-N 1 2 237.265 2.174 20 0 BEADLO CC[C@H](Cc1ccccc1)[N@@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001258850799 991883869 /nfs/dbraw/zinc/88/38/69/991883869.db2.gz BJADYZLIXKBOAJ-RDBSUJKOSA-N 1 2 245.322 2.007 20 0 BEADLO CC[C@H](Cc1ccccc1)[N@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001258850799 991883877 /nfs/dbraw/zinc/88/38/77/991883877.db2.gz BJADYZLIXKBOAJ-RDBSUJKOSA-N 1 2 245.322 2.007 20 0 BEADLO COc1ccccc1C[C@H](C)[NH+]1CCC(=O)CC1 ZINC001258888539 991890558 /nfs/dbraw/zinc/89/05/58/991890558.db2.gz LRGRPQKRWZDSLP-LBPRGKRZSA-N 1 2 247.338 2.291 20 0 BEADLO C[C@H](C(=O)N[C@@H]1CC12CCCCC2)n1cc[nH+]c1 ZINC001319864702 992011672 /nfs/dbraw/zinc/01/16/72/992011672.db2.gz AANJQGIXNOBUDA-VXGBXAGGSA-N 1 2 247.342 2.283 20 0 BEADLO CCC[C@H](CC)NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001320385496 992189367 /nfs/dbraw/zinc/18/93/67/992189367.db2.gz HEDZTCMYHZWWOK-MNOVXSKESA-N 1 2 223.320 2.139 20 0 BEADLO CCCC[C@@H](C)c1nnc(C[NH+](C)C)o1 ZINC001261432574 992302935 /nfs/dbraw/zinc/30/29/35/992302935.db2.gz UMRQAMLNVQAHMT-SECBINFHSA-N 1 2 211.309 2.425 20 0 BEADLO C[NH+](C)Cc1nnc([C@H]2CCCC(F)(F)C2)o1 ZINC001261432375 992303676 /nfs/dbraw/zinc/30/36/76/992303676.db2.gz LQBQJZQZKQCYMY-QMMMGPOBSA-N 1 2 245.273 2.424 20 0 BEADLO C[NH+](C)Cc1nnc([C@@H]2CCC[C@H](F)C2)o1 ZINC001261575500 992398466 /nfs/dbraw/zinc/39/84/66/992398466.db2.gz KEZZSBIKZKOFIM-BDAKNGLRSA-N 1 2 227.283 2.127 20 0 BEADLO CCC[C@H](CC)C(=O)N1CCn2c[nH+]cc2C1 ZINC001262016409 992606482 /nfs/dbraw/zinc/60/64/82/992606482.db2.gz UEFGCUHWDMFEHM-NSHDSACASA-N 1 2 235.331 2.052 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+]2CCCOC[C@H]2C)n1 ZINC001262109625 992679588 /nfs/dbraw/zinc/67/95/88/992679588.db2.gz ZNCMHXSFJBVAGU-LLVKDONJSA-N 1 2 237.347 2.144 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+]2CCCOC[C@H]2C)n1 ZINC001262109625 992679594 /nfs/dbraw/zinc/67/95/94/992679594.db2.gz ZNCMHXSFJBVAGU-LLVKDONJSA-N 1 2 237.347 2.144 20 0 BEADLO C[C@H](C1CC1)N(C)c1nc(N)c2ccccc2[nH+]1 ZINC001262678054 993018625 /nfs/dbraw/zinc/01/86/25/993018625.db2.gz NTODXCONBNTIMR-SECBINFHSA-N 1 2 242.326 2.447 20 0 BEADLO Cc1cccc2c1CC[C@H]2Nc1cc(N)nc[nH+]1 ZINC001262682521 993023240 /nfs/dbraw/zinc/02/32/40/993023240.db2.gz AEMUQWDOTFXWLM-GFCCVEGCSA-N 1 2 240.310 2.467 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)CSC(F)F ZINC001262805166 993067861 /nfs/dbraw/zinc/06/78/61/993067861.db2.gz HACYKTLTYIBWEB-UHFFFAOYSA-N 1 2 246.282 2.015 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)C[C@@H]1C=CCC1 ZINC001262805314 993069529 /nfs/dbraw/zinc/06/95/29/993069529.db2.gz MXKXVNUAUPZEQF-GFCCVEGCSA-N 1 2 230.311 2.415 20 0 BEADLO C[C@@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1c[nH]nn1 ZINC001575691844 993095482 /nfs/dbraw/zinc/09/54/82/993095482.db2.gz XGMVFGMSVIKHCJ-WXHSDQCUSA-N 1 2 242.326 2.259 20 0 BEADLO C[C@@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1cn[nH]n1 ZINC001575691844 993095490 /nfs/dbraw/zinc/09/54/90/993095490.db2.gz XGMVFGMSVIKHCJ-WXHSDQCUSA-N 1 2 242.326 2.259 20 0 BEADLO CC[C@H]([NH2+][C@H]1C[C@@H]2CC[C@@H](C2)C1)c1cn[nH]n1 ZINC001576288597 993257437 /nfs/dbraw/zinc/25/74/37/993257437.db2.gz HSMWWHKYDUAWIY-QCNOEVLYSA-N 1 2 234.347 2.424 20 0 BEADLO CC[C@H]([NH2+][C@H]1C[C@@H]2CC[C@@H](C2)C1)c1c[nH]nn1 ZINC001576288597 993257452 /nfs/dbraw/zinc/25/74/52/993257452.db2.gz HSMWWHKYDUAWIY-QCNOEVLYSA-N 1 2 234.347 2.424 20 0 BEADLO FC(F)(F)CNc1cc(N2CCCC2)nc[nH+]1 ZINC000585415698 993266120 /nfs/dbraw/zinc/26/61/20/993266120.db2.gz BXRMFVNSRDKWFF-UHFFFAOYSA-N 1 2 246.236 2.051 20 0 BEADLO FC(F)(F)CNc1cc(N2CCCC2)[nH+]cn1 ZINC000585415698 993266132 /nfs/dbraw/zinc/26/61/32/993266132.db2.gz BXRMFVNSRDKWFF-UHFFFAOYSA-N 1 2 246.236 2.051 20 0 BEADLO Cc1cc[nH+]c(C)c1NC1COC(C)(C)OC1 ZINC000383303105 993487537 /nfs/dbraw/zinc/48/75/37/993487537.db2.gz PHPSCYTURWNNMA-UHFFFAOYSA-N 1 2 236.315 2.262 20 0 BEADLO CCc1ccc[nH+]c1NCc1cc(C)[nH]n1 ZINC000390657960 993800107 /nfs/dbraw/zinc/80/01/07/993800107.db2.gz RJPTWIIIKJVTTB-UHFFFAOYSA-N 1 2 216.288 2.288 20 0 BEADLO CCCc1nnc(C[NH+]2CCCCC2)o1 ZINC000700348432 993829556 /nfs/dbraw/zinc/82/95/56/993829556.db2.gz FBCQVKZHJZNCIW-UHFFFAOYSA-N 1 2 209.293 2.008 20 0 BEADLO CC[C@@H]1CC[C@H](C)N(C(=O)[C@@H](C)n2cc[nH+]c2)C1 ZINC001297836027 994884784 /nfs/dbraw/zinc/88/47/84/994884784.db2.gz LZHPDEYDDADXMJ-YNEHKIRRSA-N 1 2 249.358 2.481 20 0 BEADLO CCC=CCNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001298519858 994930493 /nfs/dbraw/zinc/93/04/93/994930493.db2.gz SDKOAYPLWRYUAQ-ONEGZZNKSA-N 1 2 229.283 2.259 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)[C@H]2[C@@H]3CCC[C@@H]32)[nH+]1 ZINC001304108051 995190144 /nfs/dbraw/zinc/19/01/44/995190144.db2.gz OMKRUNYJHAWXMK-GDNZZTSVSA-N 1 2 247.342 2.195 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)[C@H]2[C@@H]3CCC[C@@H]32)c[nH+]1 ZINC001304108051 995190151 /nfs/dbraw/zinc/19/01/51/995190151.db2.gz OMKRUNYJHAWXMK-GDNZZTSVSA-N 1 2 247.342 2.195 20 0 BEADLO CCc1cn(Cc2nc(C(C)C)no2)c[nH+]1 ZINC001307397489 995343962 /nfs/dbraw/zinc/34/39/62/995343962.db2.gz QGCCOTUTKJDFTG-UHFFFAOYSA-N 1 2 220.276 2.000 20 0 BEADLO Cc1ccc(C[N@H+](CC2=NOCC2)C2CC2)o1 ZINC001307417883 995351388 /nfs/dbraw/zinc/35/13/88/995351388.db2.gz CSPZTVNLBRMTAT-UHFFFAOYSA-N 1 2 234.299 2.329 20 0 BEADLO Cc1ccc(C[N@@H+](CC2=NOCC2)C2CC2)o1 ZINC001307417883 995351401 /nfs/dbraw/zinc/35/14/01/995351401.db2.gz CSPZTVNLBRMTAT-UHFFFAOYSA-N 1 2 234.299 2.329 20 0 BEADLO Cc1cc(C)[nH+]c(CN(C)Cc2ccn(C)n2)c1 ZINC001308150131 995569565 /nfs/dbraw/zinc/56/95/65/995569565.db2.gz IHFKVHPSHXLBPN-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO CC(=O)Nc1cccc(Nc2[nH+]cccc2N)c1 ZINC000020317741 1170149385 /nfs/dbraw/zinc/14/93/85/1170149385.db2.gz IIYCYHTUOKVFQG-UHFFFAOYSA-N 1 2 242.282 2.366 20 0 BEADLO OCc1cc[nH+]c(NCc2ccccc2)c1 ZINC001620978581 1170178361 /nfs/dbraw/zinc/17/83/61/1170178361.db2.gz OMLMLQMNJQDTMP-UHFFFAOYSA-N 1 2 214.268 2.186 20 0 BEADLO C=C/C=C/CC(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC001626175162 1170193496 /nfs/dbraw/zinc/19/34/96/1170193496.db2.gz ROVSJUQHNVXJCV-ONEGZZNKSA-N 1 2 245.326 2.179 20 0 BEADLO CCc1[nH]c(CNC(=O)Nc2ccccc2)c[nH+]1 ZINC001622640910 1170505324 /nfs/dbraw/zinc/50/53/24/1170505324.db2.gz SKMWAVLVRKQUDD-UHFFFAOYSA-N 1 2 244.298 2.294 20 0 BEADLO CCc1[nH]cc(CNC(=O)Nc2ccccc2)[nH+]1 ZINC001622640910 1170505329 /nfs/dbraw/zinc/50/53/29/1170505329.db2.gz SKMWAVLVRKQUDD-UHFFFAOYSA-N 1 2 244.298 2.294 20 0 BEADLO c1cn2cc(CNc3cccc[nH+]3)sc2n1 ZINC001620732485 1170708381 /nfs/dbraw/zinc/70/83/81/1170708381.db2.gz AZASJYYVOTVYGE-UHFFFAOYSA-N 1 2 230.296 2.403 20 0 BEADLO Cc1noc([C@H](C)[NH2+]Cc2cccn2C2CC2)n1 ZINC001621307085 1170768050 /nfs/dbraw/zinc/76/80/50/1170768050.db2.gz DEDVEJPPHKNRII-VIFPVBQESA-N 1 2 246.314 2.365 20 0 BEADLO CCC[C@H](C)[NH2+]CC(=O)OC(C)(C)C ZINC000037394149 1170942736 /nfs/dbraw/zinc/94/27/36/1170942736.db2.gz OJPTWXZCNIWCJD-VIFPVBQESA-N 1 2 201.310 2.106 20 0 BEADLO CCCCC[C@H](C)[NH2+]CC(=O)OCC ZINC000037394117 1170942851 /nfs/dbraw/zinc/94/28/51/1170942851.db2.gz YZXTUNHKXGAWCJ-JTQLQIEISA-N 1 2 201.310 2.108 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1C[C@H](C)CCC[C@H]1C ZINC001628176235 1171212822 /nfs/dbraw/zinc/21/28/22/1171212822.db2.gz WYJDXLYWBAANCM-GHMZBOCLSA-N 1 2 249.358 2.298 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1c(C)cccc1C ZINC001629065023 1171277754 /nfs/dbraw/zinc/27/77/54/1171277754.db2.gz KWAZXRPOFFUNGY-LBPRGKRZSA-N 1 2 232.327 2.336 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1c(C)cccc1C ZINC001629065023 1171277761 /nfs/dbraw/zinc/27/77/61/1171277761.db2.gz KWAZXRPOFFUNGY-LBPRGKRZSA-N 1 2 232.327 2.336 20 0 BEADLO CC(C)CC[C@@H](C)NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC000045878998 1171465984 /nfs/dbraw/zinc/46/59/84/1171465984.db2.gz CJYUHUPCWVXQFO-VXGBXAGGSA-N 1 2 237.347 2.385 20 0 BEADLO CC(C)CC[C@H](C)NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC000045879001 1171466020 /nfs/dbraw/zinc/46/60/20/1171466020.db2.gz CJYUHUPCWVXQFO-NWDGAFQWSA-N 1 2 237.347 2.385 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1C[C@@H](C)CC(C)(C)C1 ZINC001632651176 1171521868 /nfs/dbraw/zinc/52/18/68/1171521868.db2.gz MSDWFKGPBYLJGM-JTQLQIEISA-N 1 2 249.358 2.155 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C(C)C)C1CCCC1 ZINC001632964047 1171547909 /nfs/dbraw/zinc/54/79/09/1171547909.db2.gz WQSUNDYFQKAWFR-UHFFFAOYSA-N 1 2 249.358 2.440 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H]2CC[C@H]3C[C@H]3C2)c[nH+]1 ZINC001635610704 1171741547 /nfs/dbraw/zinc/74/15/47/1171741547.db2.gz RXQSSRQJKOEQMN-AXFHLTTASA-N 1 2 247.342 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H]2CC[C@H]3C[C@H]3C2)[nH+]1 ZINC001635610704 1171741556 /nfs/dbraw/zinc/74/15/56/1171741556.db2.gz RXQSSRQJKOEQMN-AXFHLTTASA-N 1 2 247.342 2.025 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)CC2CCC2)[nH+]1 ZINC001636016732 1171783188 /nfs/dbraw/zinc/78/31/88/1171783188.db2.gz HZONHSUHPLDYMA-UHFFFAOYSA-N 1 2 235.331 2.340 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)CC2CCC2)c[nH+]1 ZINC001636016732 1171783201 /nfs/dbraw/zinc/78/32/01/1171783201.db2.gz HZONHSUHPLDYMA-UHFFFAOYSA-N 1 2 235.331 2.340 20 0 BEADLO CCCC[C@H](C)[NH2+]CC(=O)OC(C)C ZINC000050888118 1171848160 /nfs/dbraw/zinc/84/81/60/1171848160.db2.gz KBXMZGVOUCKPHP-JTQLQIEISA-N 1 2 201.310 2.106 20 0 BEADLO CCCC[C@@H](C)[NH2+]CC(=O)OC(C)C ZINC000050888117 1171849436 /nfs/dbraw/zinc/84/94/36/1171849436.db2.gz KBXMZGVOUCKPHP-SNVBAGLBSA-N 1 2 201.310 2.106 20 0 BEADLO CCCC[C@@H](C)[NH2+]CC(=O)OC(C)(C)C ZINC000050888537 1171849469 /nfs/dbraw/zinc/84/94/69/1171849469.db2.gz HZMPYCQYGVDZBK-SNVBAGLBSA-N 1 2 215.337 2.496 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1cc(C)c(C)c(O)c1 ZINC001636894831 1171887461 /nfs/dbraw/zinc/88/74/61/1171887461.db2.gz ANEIGMFYBHUHDG-GFCCVEGCSA-N 1 2 248.326 2.042 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1cc(C)c(C)c(O)c1 ZINC001636894831 1171887466 /nfs/dbraw/zinc/88/74/66/1171887466.db2.gz ANEIGMFYBHUHDG-GFCCVEGCSA-N 1 2 248.326 2.042 20 0 BEADLO CCn1cc[nH+]c1CN(C)c1cccc(O)c1 ZINC000605421450 343976349 /nfs/dbraw/zinc/97/63/49/343976349.db2.gz GRJDGNNZHRXKQR-UHFFFAOYSA-N 1 2 231.299 2.245 20 0 BEADLO C[C@H](O)C1CCN(c2[nH]c3ccccc3[nH+]2)CC1 ZINC000230467125 398142415 /nfs/dbraw/zinc/14/24/15/398142415.db2.gz IQEQIQBIOFTBSF-JTQLQIEISA-N 1 2 245.326 2.160 20 0 BEADLO CC[C@H]([NH2+]Cc1ccco1)c1ccn(C)n1 ZINC000336742721 398144103 /nfs/dbraw/zinc/14/41/03/398144103.db2.gz SGOBREMOPHUVMN-NSHDSACASA-N 1 2 219.288 2.254 20 0 BEADLO O=C(Nc1ccsc1)[C@@H]1CCn2cc[nH+]c2C1 ZINC000161729875 349491235 /nfs/dbraw/zinc/49/12/35/349491235.db2.gz YXDCOXPLBAWZGA-SECBINFHSA-N 1 2 247.323 2.146 20 0 BEADLO CCC(C)(C)NC(=O)[C@H]1CCn2cc(C)[nH+]c2C1 ZINC000623721378 349475479 /nfs/dbraw/zinc/47/54/79/349475479.db2.gz YKLLFTKFBKKSLI-NSHDSACASA-N 1 2 249.358 2.059 20 0 BEADLO CCC(CC)([NH2+][C@H]1C=CCCC1)C(=O)OC ZINC000336749290 168332072 /nfs/dbraw/zinc/33/20/72/168332072.db2.gz YREOEARQDLFVQW-NSHDSACASA-N 1 2 225.332 2.417 20 0 BEADLO CC(C)n1c[nH+]cc1CN[C@H](C)C(F)F ZINC000389915273 398148730 /nfs/dbraw/zinc/14/87/30/398148730.db2.gz MMFASUGKTYEVBA-MRVPVSSYSA-N 1 2 217.263 2.207 20 0 BEADLO Cc1cc(C[N@@H+]2CCn3cccc3[C@@H]2C)nn1C ZINC000336720071 178006828 /nfs/dbraw/zinc/00/68/28/178006828.db2.gz WGSXTSMWBKZKMY-LBPRGKRZSA-N 1 2 244.342 2.107 20 0 BEADLO Cc1cc(C[N@H+]2CCn3cccc3[C@@H]2C)nn1C ZINC000336720071 178006830 /nfs/dbraw/zinc/00/68/30/178006830.db2.gz WGSXTSMWBKZKMY-LBPRGKRZSA-N 1 2 244.342 2.107 20 0 BEADLO COc1cc(C)[nH+]c(CN[C@H](C)C(F)F)c1 ZINC000389953193 398152401 /nfs/dbraw/zinc/15/24/01/398152401.db2.gz YGVCJPVBBYSMFY-MRVPVSSYSA-N 1 2 230.258 2.142 20 0 BEADLO CC(=O)Nc1ccc(C[NH2+][C@H](C)C(F)F)cc1 ZINC000389965410 398153324 /nfs/dbraw/zinc/15/33/24/398153324.db2.gz MCUPZUFUBKOHOP-MRVPVSSYSA-N 1 2 242.269 2.388 20 0 BEADLO Cc1nc(NC[C@@H](C)CC(F)(F)F)cc[nH+]1 ZINC000397009558 398167930 /nfs/dbraw/zinc/16/79/30/398167930.db2.gz NWLCEGJVBCULCY-ZETCQYMHSA-N 1 2 233.237 2.207 20 0 BEADLO Cc1cc(C[NH2+]Cc2cccc3c2OCO3)on1 ZINC000044986444 178027086 /nfs/dbraw/zinc/02/70/86/178027086.db2.gz JATPTYAHWJNGTB-UHFFFAOYSA-N 1 2 246.266 2.002 20 0 BEADLO Cc1cc(C[NH2+]Cc2cocn2)ccc1F ZINC000237639483 178027180 /nfs/dbraw/zinc/02/71/80/178027180.db2.gz ILSBWXOUPKSAIC-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ccccn2)on1 ZINC000044985538 178030633 /nfs/dbraw/zinc/03/06/33/178030633.db2.gz WBKFJQAPRRCOEM-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ccncc2F)nn1C ZINC000338338522 178031193 /nfs/dbraw/zinc/03/11/93/178031193.db2.gz BABXVHPPXULEPG-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO Cc1nc([C@H](C)[NH2+]Cc2cc(C)ncn2)cs1 ZINC000358346593 178032178 /nfs/dbraw/zinc/03/21/78/178032178.db2.gz ACZDPGSMLXFZIC-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2ccccn2)no1 ZINC000044296399 178038323 /nfs/dbraw/zinc/03/83/23/178038323.db2.gz PWEQDZPJMOQGKC-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2cccnc2)no1 ZINC000044296630 178038461 /nfs/dbraw/zinc/03/84/61/178038461.db2.gz HNFZVMDEMLFXRM-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO Cc1cc(Cl)cc(C[NH2+]CC(F)(F)CO)c1 ZINC000339365807 178064343 /nfs/dbraw/zinc/06/43/43/178064343.db2.gz XMUXZTVMRTUIGP-UHFFFAOYSA-N 1 2 249.688 2.366 20 0 BEADLO C[C@H](c1csnn1)[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000649907987 398182816 /nfs/dbraw/zinc/18/28/16/398182816.db2.gz DNBLWHIPKNEYJO-APPZFPTMSA-N 1 2 245.298 2.330 20 0 BEADLO C[C@H](c1csnn1)[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000649907987 398182818 /nfs/dbraw/zinc/18/28/18/398182818.db2.gz DNBLWHIPKNEYJO-APPZFPTMSA-N 1 2 245.298 2.330 20 0 BEADLO CCC(CC)C(=O)NCc1ccc(N(C)C)[nH+]c1 ZINC000298282060 168338301 /nfs/dbraw/zinc/33/83/01/168338301.db2.gz JDJSXPPKLKJAQA-UHFFFAOYSA-N 1 2 249.358 2.200 20 0 BEADLO Cc1cc(F)ccc1OCc1c[nH+]cn1C ZINC000163312300 178091362 /nfs/dbraw/zinc/09/13/62/178091362.db2.gz PYAQBDLWUOCBQM-UHFFFAOYSA-N 1 2 220.247 2.447 20 0 BEADLO Cc1cc(N(C)CC2(CO)CC2)nc(C(C)C)[nH+]1 ZINC000302518332 178097629 /nfs/dbraw/zinc/09/76/29/178097629.db2.gz WFSQYZACKMVGRF-UHFFFAOYSA-N 1 2 249.358 2.117 20 0 BEADLO Cc1cc(N(C)C2Cc3ccccc3C2)nc[nH+]1 ZINC000352999516 178097637 /nfs/dbraw/zinc/09/76/37/178097637.db2.gz VQZMCPLUDVONPQ-UHFFFAOYSA-N 1 2 239.322 2.389 20 0 BEADLO CCC(CC)C(=O)NC[C@H](C)Cn1cc[nH+]c1 ZINC000265840783 168339095 /nfs/dbraw/zinc/33/90/95/168339095.db2.gz RYVPLDQKJYYWAM-NSHDSACASA-N 1 2 237.347 2.072 20 0 BEADLO Cc1cc(N(C)[C@H](C)c2ccccn2)nc[nH+]1 ZINC000301258323 178100364 /nfs/dbraw/zinc/10/03/64/178100364.db2.gz KWHHZXLXXJQOIS-LLVKDONJSA-N 1 2 228.299 2.377 20 0 BEADLO Cc1cc(N(C)[C@H](C)C2CCC2)nc[nH+]1 ZINC000356793107 178100484 /nfs/dbraw/zinc/10/04/84/178100484.db2.gz JWVFGPMZBOVSJH-SNVBAGLBSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1cc(N(CCO)CC2CCCCC2)nc[nH+]1 ZINC000362691950 178101490 /nfs/dbraw/zinc/10/14/90/178101490.db2.gz JTLGGPFNOKOKRJ-UHFFFAOYSA-N 1 2 249.358 2.164 20 0 BEADLO Cc1cc(N)nc(SCC[C@H](C)F)[nH+]1 ZINC000308553887 178108859 /nfs/dbraw/zinc/10/88/59/178108859.db2.gz YODDEYNJZJBLFG-LURJTMIESA-N 1 2 215.297 2.207 20 0 BEADLO Cc1cc(N)nc(SC[C@@H]2CC[C@@H](C)O2)[nH+]1 ZINC000188525305 178109036 /nfs/dbraw/zinc/10/90/36/178109036.db2.gz XLJYUMLFRAYKJM-BDAKNGLRSA-N 1 2 239.344 2.027 20 0 BEADLO Cc1cc(N)nc(SCCCCF)[nH+]1 ZINC000285318339 178109793 /nfs/dbraw/zinc/10/97/93/178109793.db2.gz XDONTPIEDQRLNK-UHFFFAOYSA-N 1 2 215.297 2.209 20 0 BEADLO Cc1cc(N)nc(SCc2cccnc2)[nH+]1 ZINC000071850743 178110291 /nfs/dbraw/zinc/11/02/91/178110291.db2.gz ZIZLPRWWVJDTAB-UHFFFAOYSA-N 1 2 232.312 2.055 20 0 BEADLO Cc1cc(N2CCCC[C@@H](C)C2)nc[nH+]1 ZINC000302477910 178112818 /nfs/dbraw/zinc/11/28/18/178112818.db2.gz XNPARAJBOAVGKU-SNVBAGLBSA-N 1 2 205.305 2.411 20 0 BEADLO Cc1cc(N2CCCCC[C@@H]2C[C@@H](C)O)nc[nH+]1 ZINC000336785033 178112851 /nfs/dbraw/zinc/11/28/51/178112851.db2.gz AVVAFFRNNLPQON-CHWSQXEVSA-N 1 2 249.358 2.305 20 0 BEADLO Cc1cc(N2CCC3(CCC3)C2)nc[nH+]1 ZINC000131412957 178112980 /nfs/dbraw/zinc/11/29/80/178112980.db2.gz ZCXPKFUEXPOVQQ-UHFFFAOYSA-N 1 2 203.289 2.165 20 0 BEADLO Cc1cc(N2CCCCC[C@H]2C[C@H](C)O)nc[nH+]1 ZINC000336785036 178113480 /nfs/dbraw/zinc/11/34/80/178113480.db2.gz AVVAFFRNNLPQON-STQMWFEESA-N 1 2 249.358 2.305 20 0 BEADLO Cc1cc(N2CCC[C@@H](C3CC3)C2)nc[nH+]1 ZINC000335983495 178114282 /nfs/dbraw/zinc/11/42/82/178114282.db2.gz UOZMCGNYUSGVRY-GFCCVEGCSA-N 1 2 217.316 2.411 20 0 BEADLO Cc1cc(N2CCC[C@@H](O)CC2)nc(C2CC2)[nH+]1 ZINC000294045676 178114389 /nfs/dbraw/zinc/11/43/89/178114389.db2.gz LWVMXFPEKKKDPP-GFCCVEGCSA-N 1 2 247.342 2.014 20 0 BEADLO Cc1cc(N2CCOC[C@H](C)C2)nc(C2CC2)[nH+]1 ZINC000371098597 178116063 /nfs/dbraw/zinc/11/60/63/178116063.db2.gz HRDBZMXVQMBPCU-SNVBAGLBSA-N 1 2 247.342 2.135 20 0 BEADLO Cc1cc(N2CC[C@@H](OCC(C)C)C2)nc[nH+]1 ZINC000301651213 178117616 /nfs/dbraw/zinc/11/76/16/178117616.db2.gz SBBZECCINZQHTL-GFCCVEGCSA-N 1 2 235.331 2.036 20 0 BEADLO Cc1cc(N2C[C@@H]3CCC[C@@H]3C2)nc[nH+]1 ZINC000301587041 178121965 /nfs/dbraw/zinc/12/19/65/178121965.db2.gz BOLMYUQMTZWCOB-PHIMTYICSA-N 1 2 203.289 2.021 20 0 BEADLO Cc1cc(N2C[C@@H](F)[C@@H](F)C2)nc(C(C)C)[nH+]1 ZINC000336266281 178122526 /nfs/dbraw/zinc/12/25/26/178122526.db2.gz NWLANBVAEYRDMY-AOOOYVTPSA-N 1 2 241.285 2.405 20 0 BEADLO Cc1cc(NC(=O)NCC(C)C)cc[nH+]1 ZINC000074621678 178139209 /nfs/dbraw/zinc/13/92/09/178139209.db2.gz ZEGWWJZGDOOLQI-UHFFFAOYSA-N 1 2 207.277 2.168 20 0 BEADLO C[C@@H]1CC[C@H](CNC(=O)C(C)(C)c2c[nH]c[nH+]2)C1 ZINC000621987458 370645485 /nfs/dbraw/zinc/64/54/85/370645485.db2.gz WDJOPDRWIZRKOD-MNOVXSKESA-N 1 2 249.358 2.240 20 0 BEADLO Cc1cc(NC(=O)N(C)C2CC2)cc[nH+]1 ZINC000119511597 178135142 /nfs/dbraw/zinc/13/51/42/178135142.db2.gz KEVGDODUVONZEE-UHFFFAOYSA-N 1 2 205.261 2.016 20 0 BEADLO COC(=O)[C@@H](C)SCc1ccc(C)[nH+]c1C ZINC000186574616 136220470 /nfs/dbraw/zinc/22/04/70/136220470.db2.gz SOHAEZGHVBDAKJ-SNVBAGLBSA-N 1 2 239.340 2.493 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CCC(C)(C)O2)cc[nH+]1 ZINC000278268723 178147540 /nfs/dbraw/zinc/14/75/40/178147540.db2.gz AOACCTOUXMNHAX-LLVKDONJSA-N 1 2 234.299 2.286 20 0 BEADLO CC(C)CCC(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000576352933 365574809 /nfs/dbraw/zinc/57/48/09/365574809.db2.gz JEGYVIUWNFZWOQ-UHFFFAOYSA-N 1 2 223.320 2.197 20 0 BEADLO CCC(CC)CC(=O)N1CCn2cc(C)[nH+]c2C1 ZINC000373301117 168343459 /nfs/dbraw/zinc/34/34/59/168343459.db2.gz KKBBFOPAKHRPLK-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO Cc1cc(NCC2CC2)nc(C2CC2)[nH+]1 ZINC000264660601 178158676 /nfs/dbraw/zinc/15/86/76/178158676.db2.gz RAJCSBJEFJXVAO-UHFFFAOYSA-N 1 2 203.289 2.484 20 0 BEADLO Cc1cc(NCCF)nc(-c2cccnc2)[nH+]1 ZINC000280758560 178159304 /nfs/dbraw/zinc/15/93/04/178159304.db2.gz NALKLLNUZWEWQT-UHFFFAOYSA-N 1 2 232.262 2.228 20 0 BEADLO CCC1(C)CN(C(=O)Nc2cc(C)[nH+]cc2C)C1 ZINC000576323926 365565599 /nfs/dbraw/zinc/56/55/99/365565599.db2.gz BNSOHTQLFONGLS-UHFFFAOYSA-N 1 2 247.342 2.384 20 0 BEADLO CCc1cc(N2CCC=C(F)C2)nc(C)[nH+]1 ZINC000274299330 538929498 /nfs/dbraw/zinc/92/94/98/538929498.db2.gz NFSRJHGKTRIVCG-UHFFFAOYSA-N 1 2 221.279 2.411 20 0 BEADLO CCC(CC)CC(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000371359671 168347252 /nfs/dbraw/zinc/34/72/52/168347252.db2.gz KYHOLXKPELIUBS-LLVKDONJSA-N 1 2 249.358 2.210 20 0 BEADLO CCC(CC)CC(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000371359671 168347253 /nfs/dbraw/zinc/34/72/53/168347253.db2.gz KYHOLXKPELIUBS-LLVKDONJSA-N 1 2 249.358 2.210 20 0 BEADLO Cc1cc(NC[C@H]2Cc3ccccc3O2)nc[nH+]1 ZINC000040727330 178170712 /nfs/dbraw/zinc/17/07/12/178170712.db2.gz YDENWKJXOWHSNV-GFCCVEGCSA-N 1 2 241.294 2.201 20 0 BEADLO Cc1cc(NC[C@H]2CSCCS2)nc[nH+]1 ZINC000130290633 178170744 /nfs/dbraw/zinc/17/07/44/178170744.db2.gz PYXGTWLJJHJIMU-VIFPVBQESA-N 1 2 241.385 2.046 20 0 BEADLO Cc1n[nH]cc1CNc1cc(C)[nH+]c(C2CC2)n1 ZINC000264677829 178171004 /nfs/dbraw/zinc/17/10/04/178171004.db2.gz WCOHESVWIFVUFR-UHFFFAOYSA-N 1 2 243.314 2.306 20 0 BEADLO Cc1cc(NCc2[nH+]ccn2CC(C)C)ncn1 ZINC000301416710 178176067 /nfs/dbraw/zinc/17/60/67/178176067.db2.gz MEZOWKAALWIKSG-UHFFFAOYSA-N 1 2 245.330 2.250 20 0 BEADLO Cc1cc(NCc2nccn2CC(C)C)nc[nH+]1 ZINC000301416710 178176070 /nfs/dbraw/zinc/17/60/70/178176070.db2.gz MEZOWKAALWIKSG-UHFFFAOYSA-N 1 2 245.330 2.250 20 0 BEADLO Cc1cc(N[C@@H](C)[C@H](C)CO)nc(C2CC2)[nH+]1 ZINC000265813901 178178129 /nfs/dbraw/zinc/17/81/29/178178129.db2.gz GGDQXWAWOCRWST-SCZZXKLOSA-N 1 2 235.331 2.091 20 0 BEADLO Cc1cc(N[C@@H](C)C[C@H]2CCCO2)nc[nH+]1 ZINC000110484409 178179244 /nfs/dbraw/zinc/17/92/44/178179244.db2.gz MWSQNYBOBPUWRT-WDEREUQCSA-N 1 2 221.304 2.155 20 0 BEADLO Cc1cc(N[C@@H](CCO)c2ccccc2)nc[nH+]1 ZINC000354312776 178181121 /nfs/dbraw/zinc/18/11/21/178181121.db2.gz SOKBQULTSHZKDM-ZDUSSCGKSA-N 1 2 243.310 2.321 20 0 BEADLO Cc1cc(N[C@@H]2CCO[C@@H](C(C)C)C2)nc[nH+]1 ZINC000357216552 178182690 /nfs/dbraw/zinc/18/26/90/178182690.db2.gz YCBIDVTYQNNZJB-VXGBXAGGSA-N 1 2 235.331 2.401 20 0 BEADLO Cc1cc(N[C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)nc[nH+]1 ZINC000361136165 178184022 /nfs/dbraw/zinc/18/40/22/178184022.db2.gz MTFFMWCVSCXDCT-UHTWSYAYSA-N 1 2 247.342 2.401 20 0 BEADLO Cc1cc(N[C@@H]2[C@@H]3CCO[C@H]3C2(C)C)nc[nH+]1 ZINC000301340693 178184315 /nfs/dbraw/zinc/18/43/15/178184315.db2.gz HYFQIEHTACFCKU-MVWJERBFSA-N 1 2 233.315 2.010 20 0 BEADLO Cc1cc(N[C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)nc[nH+]1 ZINC000361136164 178184840 /nfs/dbraw/zinc/18/48/40/178184840.db2.gz MTFFMWCVSCXDCT-RTXFEEFZSA-N 1 2 247.342 2.401 20 0 BEADLO Cc1cc(N[C@@H]2[C@H]3CCCO[C@H]3C2(C)C)nc[nH+]1 ZINC000361136163 178185106 /nfs/dbraw/zinc/18/51/06/178185106.db2.gz MTFFMWCVSCXDCT-RAIGVLPGSA-N 1 2 247.342 2.401 20 0 BEADLO Cc1cc(N[C@H](C)[C@H]2CCOC2)nc(C2CC2)[nH+]1 ZINC000266287724 178185247 /nfs/dbraw/zinc/18/52/47/178185247.db2.gz VVWPSNRPBUDVBO-PWSUYJOCSA-N 1 2 247.342 2.499 20 0 BEADLO Cc1cc(N[C@H](C)CCCO)nc(C(C)C)[nH+]1 ZINC000094944848 178186009 /nfs/dbraw/zinc/18/60/09/178186009.db2.gz NJZSCBHGMALYCY-SNVBAGLBSA-N 1 2 237.347 2.481 20 0 BEADLO Cc1cc(N[C@H]2CCOC3(CCC3)C2)nc[nH+]1 ZINC000362992132 178190535 /nfs/dbraw/zinc/19/05/35/178190535.db2.gz HDYFHPOSKKQUAF-NSHDSACASA-N 1 2 233.315 2.299 20 0 BEADLO c1c[nH+]c(-c2ccc(O[C@@H]3CCOC3)cc2)[nH]1 ZINC000649428210 398229663 /nfs/dbraw/zinc/22/96/63/398229663.db2.gz LDFQJSQMFMOEIM-GFCCVEGCSA-N 1 2 230.267 2.244 20 0 BEADLO CN(CC1(C)COC1)c1[nH]c2ccccc2[nH+]1 ZINC000624527699 343987590 /nfs/dbraw/zinc/98/75/90/343987590.db2.gz NDKOQOSPIZNYQS-UHFFFAOYSA-N 1 2 231.299 2.036 20 0 BEADLO CC[C@H]1C[NH+](Cc2[nH]ncc2C)C[C@H](CC)O1 ZINC000421385470 192325941 /nfs/dbraw/zinc/32/59/41/192325941.db2.gz GMIGZEUGQAQZMN-RYUDHWBXSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@H]1C[NH+](Cc2n[nH]cc2C)C[C@H](CC)O1 ZINC000421385470 192325942 /nfs/dbraw/zinc/32/59/42/192325942.db2.gz GMIGZEUGQAQZMN-RYUDHWBXSA-N 1 2 237.347 2.108 20 0 BEADLO C/C=C/C[C@H]1CCCN(C(=O)Cn2cc[nH+]c2)C1 ZINC000629871532 361745924 /nfs/dbraw/zinc/74/59/24/361745924.db2.gz QYSZMHHGQJFUKY-IBUXWKBASA-N 1 2 247.342 2.088 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2ccc(F)cn2)no1 ZINC000337412513 178229457 /nfs/dbraw/zinc/22/94/57/178229457.db2.gz NZKBZGOIPDTZIT-SECBINFHSA-N 1 2 235.262 2.368 20 0 BEADLO c1c[nH+]c(-c2ccccc2OC[C@H]2CCOC2)[nH]1 ZINC000649434442 398235423 /nfs/dbraw/zinc/23/54/23/398235423.db2.gz LZFUASWEHKFCOK-NSHDSACASA-N 1 2 244.294 2.492 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2nccn2C)s1 ZINC000076342396 398236220 /nfs/dbraw/zinc/23/62/20/398236220.db2.gz MCFBIOFFBOXSDQ-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2nccn2C)s1 ZINC000076342396 398236223 /nfs/dbraw/zinc/23/62/23/398236223.db2.gz MCFBIOFFBOXSDQ-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccnn2C)no1 ZINC000371396811 178241176 /nfs/dbraw/zinc/24/11/76/178241176.db2.gz UPGIMRBILRSSSO-ZDUSSCGKSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccnn2C)no1 ZINC000371396811 178241179 /nfs/dbraw/zinc/24/11/79/178241179.db2.gz UPGIMRBILRSSSO-ZDUSSCGKSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cncn2C)on1 ZINC000336397973 178241346 /nfs/dbraw/zinc/24/13/46/178241346.db2.gz DPWVOBNBMXZDBQ-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cncn2C)on1 ZINC000336397973 178241348 /nfs/dbraw/zinc/24/13/48/178241348.db2.gz DPWVOBNBMXZDBQ-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc([C@@H]2CCCN2Cc2c[nH+]c[nH]2)no1 ZINC000367229248 178241673 /nfs/dbraw/zinc/24/16/73/178241673.db2.gz PLRSKQCQFJQWQE-LBPRGKRZSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1cc([C@@H]2CCCN2Cc2c[nH]c[nH+]2)no1 ZINC000367229248 178241676 /nfs/dbraw/zinc/24/16/76/178241676.db2.gz PLRSKQCQFJQWQE-LBPRGKRZSA-N 1 2 232.287 2.043 20 0 BEADLO CCc1noc(CC)c1C[NH2+][C@H](C)c1ncc[nH]1 ZINC000278950431 538935248 /nfs/dbraw/zinc/93/52/48/538935248.db2.gz MXFIQKRXCYNQQJ-SECBINFHSA-N 1 2 248.330 2.373 20 0 BEADLO COCCOc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000649431355 398234216 /nfs/dbraw/zinc/23/42/16/398234216.db2.gz RHQYNAVSABKRSK-UHFFFAOYSA-N 1 2 218.256 2.102 20 0 BEADLO C[C@]1(C(=O)N2CC(n3cc[nH+]c3)C2)CC=CCC1 ZINC000576464042 365602515 /nfs/dbraw/zinc/60/25/15/365602515.db2.gz PGJADGVZMQFHRX-AWEZNQCLSA-N 1 2 245.326 2.013 20 0 BEADLO COCC[C@@H]([NH2+][C@H](C)c1ncc[nH]1)c1ccco1 ZINC000285496658 538941182 /nfs/dbraw/zinc/94/11/82/538941182.db2.gz APXPHUGUCGLFSG-GHMZBOCLSA-N 1 2 249.314 2.431 20 0 BEADLO Cc1cccc(C)c1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000230226614 398243325 /nfs/dbraw/zinc/24/33/25/398243325.db2.gz ASMGUXFZVPAENP-UHFFFAOYSA-N 1 2 243.310 2.299 20 0 BEADLO Cc1cc2ccccc2[nH+]c1NC[C@@H](C)O ZINC000063105705 178298321 /nfs/dbraw/zinc/29/83/21/178298321.db2.gz AHYNYKNDJYELAA-SNVBAGLBSA-N 1 2 216.284 2.336 20 0 BEADLO Cc1cc2n[nH]cc2cc1NCc1[nH]cc[nH+]1 ZINC000359820571 178300585 /nfs/dbraw/zinc/30/05/85/178300585.db2.gz UMGDUOASMQQEEO-UHFFFAOYSA-N 1 2 227.271 2.207 20 0 BEADLO Cc1cc2[nH+]cn(CC(C)(C)O)c2cc1C ZINC000037694326 178304758 /nfs/dbraw/zinc/30/47/58/178304758.db2.gz YSFIUYPXMKRNMF-UHFFFAOYSA-N 1 2 218.300 2.424 20 0 BEADLO Cc1cc2[nH+]cn(C[C@H](C)O)c2cc1C ZINC000037694323 178305047 /nfs/dbraw/zinc/30/50/47/178305047.db2.gz POZZVHIHQYFRPA-JTQLQIEISA-N 1 2 204.273 2.034 20 0 BEADLO Cc1nc(N2C[C@@H](C)OC3(CCCC3)C2)cc[nH+]1 ZINC000645406898 398246245 /nfs/dbraw/zinc/24/62/45/398246245.db2.gz XBPPATHSSDMSKG-LLVKDONJSA-N 1 2 247.342 2.323 20 0 BEADLO Cc1cc2[nH+]cn(C[C@@H]3COCCO3)c2cc1C ZINC000336262602 178306004 /nfs/dbraw/zinc/30/60/04/178306004.db2.gz VWDDTTGSZWFJCI-GFCCVEGCSA-N 1 2 246.310 2.069 20 0 BEADLO C[C@H](N[C@H](C1CC1)C(F)(F)F)c1[nH]cc[nH+]1 ZINC000287379722 538945319 /nfs/dbraw/zinc/94/53/19/538945319.db2.gz PIWCESDNDKGWJO-POYBYMJQSA-N 1 2 233.237 2.401 20 0 BEADLO Cc1cc(NC(=O)NC2(C(C)C)CC2)c(C)c[nH+]1 ZINC000576677416 365655478 /nfs/dbraw/zinc/65/54/78/365655478.db2.gz RALHVWFJZZVUFY-UHFFFAOYSA-N 1 2 247.342 2.430 20 0 BEADLO Cc1cc(Nc2cc(C3CC3)n(C)n2)nc(C)[nH+]1 ZINC000291070999 538946870 /nfs/dbraw/zinc/94/68/70/538946870.db2.gz HAABWWORDQSANQ-UHFFFAOYSA-N 1 2 243.314 2.448 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)CC1CCCCC1 ZINC000291450679 538947921 /nfs/dbraw/zinc/94/79/21/538947921.db2.gz NDIASRJPGAUZLY-UHFFFAOYSA-N 1 2 235.331 2.007 20 0 BEADLO CC[C@@H]1CCCC[C@H]1C(=O)NCc1c[nH+]cn1C ZINC000291432247 538948070 /nfs/dbraw/zinc/94/80/70/538948070.db2.gz LLXMHUYTLQULLA-DGCLKSJQSA-N 1 2 249.358 2.253 20 0 BEADLO CCC[C@@H](C[N@H+](C)CC(=O)OC(C)(C)C)OC ZINC000602450960 349551830 /nfs/dbraw/zinc/55/18/30/349551830.db2.gz CYFUBTRFSQCXKO-NSHDSACASA-N 1 2 245.363 2.075 20 0 BEADLO CCC[C@@H](C[N@@H+](C)CC(=O)OC(C)(C)C)OC ZINC000602450960 349551832 /nfs/dbraw/zinc/55/18/32/349551832.db2.gz CYFUBTRFSQCXKO-NSHDSACASA-N 1 2 245.363 2.075 20 0 BEADLO CCC(CC)N(CC)C(=O)CCc1[nH]cc[nH+]1 ZINC000292128677 168371183 /nfs/dbraw/zinc/37/11/83/168371183.db2.gz LKBVWCHELBCGKE-UHFFFAOYSA-N 1 2 237.347 2.379 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)CC1(C)CCCCC1 ZINC000291410331 538947857 /nfs/dbraw/zinc/94/78/57/538947857.db2.gz JPFCRIKQORTJNN-UHFFFAOYSA-N 1 2 249.358 2.397 20 0 BEADLO Cc1ccc(NC(=O)[C@]2(C)C[C@H]2F)c(C)[nH+]1 ZINC000335088375 136232940 /nfs/dbraw/zinc/23/29/40/136232940.db2.gz XSHGITGNLQRNKG-ZYHUDNBSSA-N 1 2 222.263 2.385 20 0 BEADLO CCC[C@@H](C)NC(=O)Cc1cn2ccccc2[nH+]1 ZINC000649470075 398270757 /nfs/dbraw/zinc/27/07/57/398270757.db2.gz LHPAYEQAOSJKNH-LLVKDONJSA-N 1 2 245.326 2.182 20 0 BEADLO CCC[C@](C)([NH2+]C[C@](C)(CC)OC)C(=O)OC ZINC000602508036 349583590 /nfs/dbraw/zinc/58/35/90/349583590.db2.gz YWJLRHMLCAAKRH-STQMWFEESA-N 1 2 245.363 2.123 20 0 BEADLO Cn1c2ccccc2[nH+]c1NCC(C)(F)F ZINC000378853324 346844204 /nfs/dbraw/zinc/84/42/04/346844204.db2.gz HSSGKAKPMRRCJJ-UHFFFAOYSA-N 1 2 225.242 2.062 20 0 BEADLO CC[C@H](C(N)=O)[N@H+](C)Cc1ccccc1Cl ZINC000061679446 349602447 /nfs/dbraw/zinc/60/24/47/349602447.db2.gz OWQZDSWUNVVPSH-LLVKDONJSA-N 1 2 240.734 2.036 20 0 BEADLO CC[C@H](C(N)=O)[N@@H+](C)Cc1ccccc1Cl ZINC000061679446 349602448 /nfs/dbraw/zinc/60/24/48/349602448.db2.gz OWQZDSWUNVVPSH-LLVKDONJSA-N 1 2 240.734 2.036 20 0 BEADLO CC[C@@H](OCC[NH+]1CCOCC1)c1ccccc1 ZINC000649474909 398274065 /nfs/dbraw/zinc/27/40/65/398274065.db2.gz ZZZKEPSDJYLKGM-OAHLLOKOSA-N 1 2 249.354 2.487 20 0 BEADLO C[C@@H]1CCCC[C@H]1C[N@H+](C)Cc1nnc[nH]1 ZINC000183085027 538966042 /nfs/dbraw/zinc/96/60/42/538966042.db2.gz MNIWHCLMBODDTF-MNOVXSKESA-N 1 2 222.336 2.063 20 0 BEADLO C[C@@H]1CCCC[C@H]1C[N@@H+](C)Cc1nnc[nH]1 ZINC000183085027 538966043 /nfs/dbraw/zinc/96/60/43/538966043.db2.gz MNIWHCLMBODDTF-MNOVXSKESA-N 1 2 222.336 2.063 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C[N@H+](C)Cc1nnc[nH]1 ZINC000183084990 538966099 /nfs/dbraw/zinc/96/60/99/538966099.db2.gz MNIWHCLMBODDTF-GHMZBOCLSA-N 1 2 222.336 2.063 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C[N@@H+](C)Cc1nnc[nH]1 ZINC000183084990 538966101 /nfs/dbraw/zinc/96/61/01/538966101.db2.gz MNIWHCLMBODDTF-GHMZBOCLSA-N 1 2 222.336 2.063 20 0 BEADLO Cc1cc(CNC(=O)N2C[C@@H](C)[C@H]2C)cc(C)[nH+]1 ZINC000335610655 136236716 /nfs/dbraw/zinc/23/67/16/136236716.db2.gz IQVKFUZRKWIGFY-BXKDBHETSA-N 1 2 247.342 2.248 20 0 BEADLO CCC[C@H](C)NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000649488488 398283952 /nfs/dbraw/zinc/28/39/52/398283952.db2.gz PEYNSWRRCJDWSD-WDEREUQCSA-N 1 2 223.320 2.139 20 0 BEADLO CC[C@@H](C)NC(=O)Cn1c(C)[nH+]c2ccccc21 ZINC000005627765 342767366 /nfs/dbraw/zinc/76/73/66/342767366.db2.gz HIKUVFROMWMJHZ-SNVBAGLBSA-N 1 2 245.326 2.259 20 0 BEADLO CCN(CC)C(=O)Cn1c(C)[nH+]c2ccccc21 ZINC000007454290 342791511 /nfs/dbraw/zinc/79/15/11/342791511.db2.gz ZFLZGAALKVVELH-UHFFFAOYSA-N 1 2 245.326 2.213 20 0 BEADLO Cc1cc(C)cc(C[N@@H+](C)Cc2ncnn2C)c1 ZINC000075023951 342792066 /nfs/dbraw/zinc/79/20/66/342792066.db2.gz GQNURXLVZFNILR-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cc(C)cc(C[N@H+](C)Cc2ncnn2C)c1 ZINC000075023951 342792068 /nfs/dbraw/zinc/79/20/68/342792068.db2.gz GQNURXLVZFNILR-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO CC[C@H]1C[C@H](C)CN1c1cc[nH+]c(C)n1 ZINC000075065971 342792648 /nfs/dbraw/zinc/79/26/48/342792648.db2.gz MGDHHWOABKCCEQ-ONGXEEELSA-N 1 2 205.305 2.410 20 0 BEADLO C/C=C\CNc1cc(C)[nH+]c(C2CC2)n1 ZINC000624655200 342809462 /nfs/dbraw/zinc/80/94/62/342809462.db2.gz MSURPWHLHJLUKK-ARJAWSKDSA-N 1 2 203.289 2.072 20 0 BEADLO C/C=C/CNc1cc(C)[nH+]c(C2CC2)n1 ZINC000624655201 342809578 /nfs/dbraw/zinc/80/95/78/342809578.db2.gz MSURPWHLHJLUKK-ONEGZZNKSA-N 1 2 203.289 2.072 20 0 BEADLO CCc1nn(C)cc1C[NH2+]CC(F)(F)CC ZINC000623679750 398290622 /nfs/dbraw/zinc/29/06/22/398290622.db2.gz IBEFMFSLNLYAGZ-UHFFFAOYSA-N 1 2 231.290 2.117 20 0 BEADLO Cc1nc(NC[C@H]2CCCC23CC3)cc[nH+]1 ZINC000624758129 342825800 /nfs/dbraw/zinc/82/58/00/342825800.db2.gz UVSUVQXYFPHNFL-LLVKDONJSA-N 1 2 217.316 2.199 20 0 BEADLO Cn1c[nH+]cc1Cc1nc(C2(C)CCCC2)no1 ZINC000624759384 342826353 /nfs/dbraw/zinc/82/63/53/342826353.db2.gz RFPFPTSJROQSRR-UHFFFAOYSA-N 1 2 246.314 2.226 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1c(C)oc(C)c1C ZINC000380173072 538986800 /nfs/dbraw/zinc/98/68/00/538986800.db2.gz LUWWBYUFMZYRRN-UHFFFAOYSA-N 1 2 247.298 2.166 20 0 BEADLO CC[C@]1(C)CCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492869656 529396006 /nfs/dbraw/zinc/39/60/06/529396006.db2.gz VBSALCMZYBZSKD-DSYXLKISSA-N 1 2 233.315 2.072 20 0 BEADLO Cc1cc(NC(=O)c2ncc(F)cc2F)cc[nH+]1 ZINC000190541535 538989719 /nfs/dbraw/zinc/98/97/19/538989719.db2.gz NPEZBMIJJQERGI-UHFFFAOYSA-N 1 2 249.220 2.316 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@H]1CSC1(C)C ZINC000380115085 538985242 /nfs/dbraw/zinc/98/52/42/538985242.db2.gz PGXDDESFHLEHLL-XVKPBYJWSA-N 1 2 225.361 2.263 20 0 BEADLO Cc1ccncc1[C@H](C)[NH2+]Cc1csnn1 ZINC000381452483 539000774 /nfs/dbraw/zinc/00/07/74/539000774.db2.gz HEEKEGXKWLICHC-VIFPVBQESA-N 1 2 234.328 2.092 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCCC1(F)F)c1cnn(C)c1 ZINC000381448310 539000839 /nfs/dbraw/zinc/00/08/39/539000839.db2.gz GOEHBXRMAKMBKG-PSASIEDQSA-N 1 2 229.274 2.259 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N1CCC[C@H]1C1CCC1 ZINC000193137201 539002480 /nfs/dbraw/zinc/00/24/80/539002480.db2.gz YCFOGWYFHSLCLK-ZDUSSCGKSA-N 1 2 247.342 2.133 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N1CCC[C@H]1C1CCC1 ZINC000193137201 539002482 /nfs/dbraw/zinc/00/24/82/539002482.db2.gz YCFOGWYFHSLCLK-ZDUSSCGKSA-N 1 2 247.342 2.133 20 0 BEADLO Cc1noc(C)c1[C@H](C)[NH2+]Cc1cocn1 ZINC000381507725 539002739 /nfs/dbraw/zinc/00/27/39/539002739.db2.gz QEWNEWIVUXLPHI-ZETCQYMHSA-N 1 2 221.260 2.130 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2ccccn2)s1 ZINC000381520794 539003306 /nfs/dbraw/zinc/00/33/06/539003306.db2.gz UPFDUGHAGAAKLD-QMMMGPOBSA-N 1 2 234.328 2.092 20 0 BEADLO CC(C)(C)c1nc(N[C@@H]2COCC2(C)C)cc[nH+]1 ZINC000649498022 398295913 /nfs/dbraw/zinc/29/59/13/398295913.db2.gz AWLDWJSRBWAWFN-SNVBAGLBSA-N 1 2 249.358 2.033 20 0 BEADLO COc1ccc[nH+]c1N[C@H](C)CCCCO ZINC000381417691 539000385 /nfs/dbraw/zinc/00/03/85/539000385.db2.gz WNZJTAHYAUVPIJ-SNVBAGLBSA-N 1 2 224.304 2.053 20 0 BEADLO CCc1cc(N[C@@H]2CCCOCC2)nc[nH+]1 ZINC000390226952 539020520 /nfs/dbraw/zinc/02/05/20/539020520.db2.gz BLKDUPIQYNSNLU-LLVKDONJSA-N 1 2 221.304 2.020 20 0 BEADLO C[C@H](c1ccccc1)[C@H](CO)[NH2+]CC(F)F ZINC000390211314 539020617 /nfs/dbraw/zinc/02/06/17/539020617.db2.gz VJPIACAYWGLTEN-KOLCDFICSA-N 1 2 229.270 2.006 20 0 BEADLO Cc1nn(C)cc1C[NH2+][C@@H]1CCCC1(F)F ZINC000390665762 539027163 /nfs/dbraw/zinc/02/71/63/539027163.db2.gz UGMLMUBNNSNDPG-SNVBAGLBSA-N 1 2 229.274 2.006 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C(=O)N(C)Cc1[nH+]ccn1C ZINC000335633606 136241564 /nfs/dbraw/zinc/24/15/64/136241564.db2.gz LBWONQYOHUCNEE-NEPJUHHUSA-N 1 2 249.358 2.205 20 0 BEADLO Cc1cc2ccccc2[nH+]c1N1C[C@H](C)[C@H](O)C1 ZINC000388110778 539014617 /nfs/dbraw/zinc/01/46/17/539014617.db2.gz XEVKQVYNGWTJMZ-SMDDNHRTSA-N 1 2 242.322 2.360 20 0 BEADLO COc1ccc(N[C@H](C)[C@@H]2CCCOC2)[nH+]c1 ZINC000389101821 539015418 /nfs/dbraw/zinc/01/54/18/539015418.db2.gz LIDULUPBPNLAOB-GHMZBOCLSA-N 1 2 236.315 2.317 20 0 BEADLO c1c[nH+]c(Cn2cc(C3CCCCCC3)nn2)[nH]1 ZINC000640754524 361992419 /nfs/dbraw/zinc/99/24/19/361992419.db2.gz KEHUEZPYSLWHFC-UHFFFAOYSA-N 1 2 245.330 2.487 20 0 BEADLO Cc1ccncc1CNc1cc[nH+]c(C)n1 ZINC000167306893 136245309 /nfs/dbraw/zinc/24/53/09/136245309.db2.gz XERIAIAEOIZQIU-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO CCCn1cc(C[NH2+][C@H](C)c2ccon2)cn1 ZINC000351598646 136247413 /nfs/dbraw/zinc/24/74/13/136247413.db2.gz WONCFLRZXFSJAO-SNVBAGLBSA-N 1 2 234.303 2.132 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nc3ccccc3o2)CCO1 ZINC000045752492 342916354 /nfs/dbraw/zinc/91/63/54/342916354.db2.gz RUIPMSKPBFCHPX-LLVKDONJSA-N 1 2 246.310 2.439 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nc3ccccc3o2)CCO1 ZINC000045752492 342916355 /nfs/dbraw/zinc/91/63/55/342916355.db2.gz RUIPMSKPBFCHPX-LLVKDONJSA-N 1 2 246.310 2.439 20 0 BEADLO CC[C@@H]1C[C@@H](C)CN1C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493189662 529421491 /nfs/dbraw/zinc/42/14/91/529421491.db2.gz NRZMSTOCIBKITC-XKFHPXPTSA-N 1 2 233.315 2.070 20 0 BEADLO CC[C@@H]1CN(Cc2[nH]c(C)c(C)[nH+]2)C[C@H](C)O1 ZINC000628155044 398336158 /nfs/dbraw/zinc/33/61/58/398336158.db2.gz OQZMNEZFJKDXCL-JOYOIKCWSA-N 1 2 237.347 2.026 20 0 BEADLO CC[C@H](NC(=O)CC1(C)CC1)c1[nH]cc[nH+]1 ZINC000401275145 529470915 /nfs/dbraw/zinc/47/09/15/529470915.db2.gz PCORQHMGEXGKMA-VIFPVBQESA-N 1 2 221.304 2.167 20 0 BEADLO CS[C@@H](C)CC(=O)Nc1cc[nH+]c(C)c1 ZINC000120758113 398337323 /nfs/dbraw/zinc/33/73/23/398337323.db2.gz HDLMDNCKIFQWLK-VIFPVBQESA-N 1 2 224.329 2.470 20 0 BEADLO C[C@H]([NH2+][C@H]1CCCc2occc21)c1nncn1C ZINC000123951683 398338669 /nfs/dbraw/zinc/33/86/69/398338669.db2.gz GJXUTFYPLLRHTM-ONGXEEELSA-N 1 2 246.314 2.136 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2CCCC[C@H]2C2CC2)n1 ZINC000564958327 398331502 /nfs/dbraw/zinc/33/15/02/398331502.db2.gz ZXZMKJXPVZYGPL-WDEREUQCSA-N 1 2 235.331 2.473 20 0 BEADLO Cc1noc(C)c1C[NH2+][C@@H]1C[C@@H](C)n2ccnc21 ZINC000379025152 346888905 /nfs/dbraw/zinc/88/89/05/346888905.db2.gz URMKPGBTCIISNI-PRHODGIISA-N 1 2 246.314 2.284 20 0 BEADLO CCc1cccc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)c1 ZINC000368336329 398343888 /nfs/dbraw/zinc/34/38/88/398343888.db2.gz MRXVBKLSUVKTSX-UONOGXRCSA-N 1 2 217.312 2.222 20 0 BEADLO CCc1cccc(C[N@H+]2CCO[C@@H]3C[C@@H]32)c1 ZINC000368336329 398343889 /nfs/dbraw/zinc/34/38/89/398343889.db2.gz MRXVBKLSUVKTSX-UONOGXRCSA-N 1 2 217.312 2.222 20 0 BEADLO CCc1cc(C)c(C(=O)NCc2[nH]c[nH+]c2C)o1 ZINC000487948137 529524184 /nfs/dbraw/zinc/52/41/84/529524184.db2.gz MDMCBFWNRKRFSN-UHFFFAOYSA-N 1 2 247.298 2.112 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)NCC1(C)CCC1 ZINC000492462534 529553726 /nfs/dbraw/zinc/55/37/26/529553726.db2.gz UFZJCHIZAWFXKH-AATRIKPKSA-N 1 2 247.342 2.223 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N(C)C1CCCC1 ZINC000492528092 529556872 /nfs/dbraw/zinc/55/68/72/529556872.db2.gz FICAQRHTDIXZSR-HJWRWDBZSA-N 1 2 247.342 2.317 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N1[C@H](C)CC[C@@H]1C ZINC000492492544 529558918 /nfs/dbraw/zinc/55/89/18/529558918.db2.gz MBGZYHVWMADOMU-OVFHYVDXSA-N 1 2 247.342 2.316 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N[C@@H]1C[C@H]1C(C)C ZINC000493030461 529560270 /nfs/dbraw/zinc/56/02/70/529560270.db2.gz WFTVGEXFEXTGJZ-ABZJQCSKSA-N 1 2 247.342 2.077 20 0 BEADLO Cn1c2ccccc2nc1[C@H]([NH3+])c1ccccn1 ZINC000019930120 342963451 /nfs/dbraw/zinc/96/34/51/342963451.db2.gz XFSJJLJQKQFTTN-CYBMUJFWSA-N 1 2 238.294 2.016 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N1C2CCC1CC2 ZINC000492535554 529549275 /nfs/dbraw/zinc/54/92/75/529549275.db2.gz OAGPRBASNBVBJT-BQYQJAHWSA-N 1 2 245.326 2.070 20 0 BEADLO CC[C@@H](NC(=O)/C=C/c1[nH]cc[nH+]1)C(C)(C)C ZINC000493813306 529572846 /nfs/dbraw/zinc/57/28/46/529572846.db2.gz CRFZBGJBXIPYNT-VQCYPWCPSA-N 1 2 235.331 2.364 20 0 BEADLO CCCC[C@H]([NH2+]C[C@H](C)SC)C(=O)OC ZINC000135256015 323028013 /nfs/dbraw/zinc/02/80/13/323028013.db2.gz LWNNMTMICGMTQR-UWVGGRQHSA-N 1 2 233.377 2.059 20 0 BEADLO CS[C@@H]1CC[C@@H]1Nc1c[nH+]cc(N(C)C)c1 ZINC000602726015 349715292 /nfs/dbraw/zinc/71/52/92/349715292.db2.gz UIQGZKGFNFVXCA-NWDGAFQWSA-N 1 2 237.372 2.454 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)/C=C\C1CC1 ZINC000493066662 529593596 /nfs/dbraw/zinc/59/35/96/529593596.db2.gz UFPUJBOBOZIEGT-GFVADAIESA-N 1 2 233.315 2.046 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nccn2C)C[C@H](C)C1(F)F ZINC000625650845 344023829 /nfs/dbraw/zinc/02/38/29/344023829.db2.gz SFPGQQJDFUFGPM-AOOOYVTPSA-N 1 2 243.301 2.143 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nccn2C)C[C@H](C)C1(F)F ZINC000625650845 344023830 /nfs/dbraw/zinc/02/38/30/344023830.db2.gz SFPGQQJDFUFGPM-AOOOYVTPSA-N 1 2 243.301 2.143 20 0 BEADLO CCN(C#N)CC[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000602785785 349749114 /nfs/dbraw/zinc/74/91/14/349749114.db2.gz VJNDTVWEOLDNLV-LBPRGKRZSA-N 1 2 229.327 2.366 20 0 BEADLO CCN(C#N)CC[N@H+]1Cc2ccccc2[C@@H]1C ZINC000602785785 349749120 /nfs/dbraw/zinc/74/91/20/349749120.db2.gz VJNDTVWEOLDNLV-LBPRGKRZSA-N 1 2 229.327 2.366 20 0 BEADLO Cc1nc2[nH]ccc2c(NCCc2ccc[nH]2)[nH+]1 ZINC000351878445 136262018 /nfs/dbraw/zinc/26/20/18/136262018.db2.gz OSFKZVDMNJLNLU-UHFFFAOYSA-N 1 2 241.298 2.201 20 0 BEADLO Cc1noc(C[NH+]2C[C@H](C)C(F)(F)[C@@H](C)C2)n1 ZINC000625647466 344024992 /nfs/dbraw/zinc/02/49/92/344024992.db2.gz MHELDEAVUMZZJS-YUMQZZPRSA-N 1 2 245.273 2.101 20 0 BEADLO CCCN(CCC)C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000576886002 365715136 /nfs/dbraw/zinc/71/51/36/365715136.db2.gz TUCLDCPLCMRHAM-LLVKDONJSA-N 1 2 237.347 2.237 20 0 BEADLO CCCN(CCC)C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000576886002 365715144 /nfs/dbraw/zinc/71/51/44/365715144.db2.gz TUCLDCPLCMRHAM-LLVKDONJSA-N 1 2 237.347 2.237 20 0 BEADLO CS[C@@H](C)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000421575734 192354699 /nfs/dbraw/zinc/35/46/99/192354699.db2.gz KTYOMJUFPRQJRQ-JTQLQIEISA-N 1 2 238.356 2.066 20 0 BEADLO CC[C@H]([NH2+][C@@H]1CCSC1)C(=O)OC(C)(C)C ZINC000310015499 343178972 /nfs/dbraw/zinc/17/89/72/343178972.db2.gz KSDNUDOKHYRRDY-ZJUUUORDSA-N 1 2 245.388 2.202 20 0 BEADLO CC[C@@H](C)CNC(=O)c1ccc2[nH+]ccn2c1 ZINC000421583357 192357150 /nfs/dbraw/zinc/35/71/50/192357150.db2.gz XQOYMBGUNIUSMH-SNVBAGLBSA-N 1 2 231.299 2.110 20 0 BEADLO C[C@@H](NC(=O)CC(C)(C)C)c1[nH]cc[nH+]1 ZINC000125365948 343173127 /nfs/dbraw/zinc/17/31/27/343173127.db2.gz KLEORRMXVMZFQT-MRVPVSSYSA-N 1 2 209.293 2.023 20 0 BEADLO Cc1cscc1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000125395241 343173654 /nfs/dbraw/zinc/17/36/54/343173654.db2.gz MMALTFVNRBQWCA-MRVPVSSYSA-N 1 2 235.312 2.271 20 0 BEADLO C[C@@H]1C[C@@H](C)[N@H+](Cc2nnsc2Cl)C1 ZINC000125700814 343174403 /nfs/dbraw/zinc/17/44/03/343174403.db2.gz LCJLGTSJPQPJHW-RNFRBKRXSA-N 1 2 231.752 2.422 20 0 BEADLO C[C@@H]1C[C@@H](C)[N@@H+](Cc2nnsc2Cl)C1 ZINC000125700814 343174405 /nfs/dbraw/zinc/17/44/05/343174405.db2.gz LCJLGTSJPQPJHW-RNFRBKRXSA-N 1 2 231.752 2.422 20 0 BEADLO C[NH+]1CCN(c2ncc(Cl)cc2Cl)CC1 ZINC000067949395 343215218 /nfs/dbraw/zinc/21/52/18/343215218.db2.gz CKZMYSTYEGEFJS-UHFFFAOYSA-N 1 2 246.141 2.140 20 0 BEADLO Cc1cc2ccccc2[nH+]c1N[C@@H](C)CC(N)=O ZINC000133207630 343189637 /nfs/dbraw/zinc/18/96/37/343189637.db2.gz KQHAFVXHRNELJU-JTQLQIEISA-N 1 2 243.310 2.219 20 0 BEADLO COc1c(N)[nH+]cnc1N[C@H]1CCC[C@@H](C)C1 ZINC000134822197 343195544 /nfs/dbraw/zinc/19/55/44/343195544.db2.gz GSRCCJHCMFWTER-BDAKNGLRSA-N 1 2 236.319 2.058 20 0 BEADLO COc1c(N)nc[nH+]c1N[C@H]1CCC[C@@H](C)C1 ZINC000134822197 343195546 /nfs/dbraw/zinc/19/55/46/343195546.db2.gz GSRCCJHCMFWTER-BDAKNGLRSA-N 1 2 236.319 2.058 20 0 BEADLO CC(C)(C)OC(=O)CC[N@@H+]1CCC[C@H]1C(F)F ZINC000353166490 136282404 /nfs/dbraw/zinc/28/24/04/136282404.db2.gz CCJWDLRLFPCDBE-VIFPVBQESA-N 1 2 249.301 2.448 20 0 BEADLO CC(C)(C)OC(=O)CC[N@H+]1CCC[C@H]1C(F)F ZINC000353166490 136282405 /nfs/dbraw/zinc/28/24/05/136282405.db2.gz CCJWDLRLFPCDBE-VIFPVBQESA-N 1 2 249.301 2.448 20 0 BEADLO CCc1cc(NCc2c[nH+]cn2CC)no1 ZINC000668154930 488210621 /nfs/dbraw/zinc/21/06/21/488210621.db2.gz NISACFCMTAAATN-UHFFFAOYSA-N 1 2 220.276 2.066 20 0 BEADLO C[C@H]([NH2+]c1ccc(OCCC(N)=O)cc1)C1CC1 ZINC000036934255 343328423 /nfs/dbraw/zinc/32/84/23/343328423.db2.gz PQSUDALLROQERX-JTQLQIEISA-N 1 2 248.326 2.151 20 0 BEADLO CCC(C)(C)c1cn(CCCn2cc[nH+]c2)nn1 ZINC000641054247 362163885 /nfs/dbraw/zinc/16/38/85/362163885.db2.gz DKQPKOYBZKCWDS-UHFFFAOYSA-N 1 2 247.346 2.253 20 0 BEADLO CO[C@H]1CCCC[C@@H]1Nc1cccc[nH+]1 ZINC000078427350 343369690 /nfs/dbraw/zinc/36/96/90/343369690.db2.gz DGKMEVVBNAVDRC-QWRGUYRKSA-N 1 2 206.289 2.451 20 0 BEADLO CCCN(CC)C(=O)Nc1cc[nH+]c(C)c1 ZINC000348833883 136303290 /nfs/dbraw/zinc/30/32/90/136303290.db2.gz MMTARWKGDOHYNA-UHFFFAOYSA-N 1 2 221.304 2.076 20 0 BEADLO CCC[NH2+][C@]1(C(=O)OCC)CCc2ccccc21 ZINC000037513555 343347493 /nfs/dbraw/zinc/34/74/93/343347493.db2.gz ZSXDOKFRLIWJHJ-OAHLLOKOSA-N 1 2 247.338 2.391 20 0 BEADLO FC1(F)CCN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000335647538 136304224 /nfs/dbraw/zinc/30/42/24/136304224.db2.gz DMPJINSHMBMXAN-UHFFFAOYSA-N 1 2 225.242 2.199 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1ccsc1 ZINC000335670954 136312806 /nfs/dbraw/zinc/31/28/06/136312806.db2.gz JZMHCCIIGSXGHH-UHFFFAOYSA-N 1 2 232.308 2.380 20 0 BEADLO FC(F)(F)c1ccc(Cn2cc[nH+]c2)nc1 ZINC000335665769 136316845 /nfs/dbraw/zinc/31/68/45/136316845.db2.gz CCQJYWUYUQKZNB-UHFFFAOYSA-N 1 2 227.189 2.345 20 0 BEADLO CC(C)C[C@H](C)Cn1cc(Cn2cc[nH+]c2)nn1 ZINC000641078072 362186869 /nfs/dbraw/zinc/18/68/69/362186869.db2.gz WYNTXVSZOQHPKT-LBPRGKRZSA-N 1 2 247.346 2.205 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1ccc(C)cc1F ZINC000335695687 136326995 /nfs/dbraw/zinc/32/69/95/136326995.db2.gz CTTXHEAISFZXAW-UHFFFAOYSA-N 1 2 247.273 2.096 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cccc(C)n2)CCO1 ZINC000335697322 136327346 /nfs/dbraw/zinc/32/73/46/136327346.db2.gz GPKUZQZZJUEKTH-ZDUSSCGKSA-N 1 2 220.316 2.001 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cccc(C)n2)CCO1 ZINC000335697322 136327347 /nfs/dbraw/zinc/32/73/47/136327347.db2.gz GPKUZQZZJUEKTH-ZDUSSCGKSA-N 1 2 220.316 2.001 20 0 BEADLO CC1C[NH+](Cc2cnc3ccc(Cl)cn23)C1 ZINC000335721030 136345932 /nfs/dbraw/zinc/34/59/32/136345932.db2.gz KQSNCBPZHSVILF-UHFFFAOYSA-N 1 2 235.718 2.439 20 0 BEADLO Cc1ccc(C[NH2+]Cc2nccs2)cn1 ZINC000082394280 343440803 /nfs/dbraw/zinc/44/08/03/343440803.db2.gz XJWJYMSIJKFCMZ-UHFFFAOYSA-N 1 2 219.313 2.136 20 0 BEADLO CC[C@@H]([NH2+]C[C@@H]1CCCCC1(F)F)C(=O)OC ZINC000394501460 259360488 /nfs/dbraw/zinc/36/04/88/259360488.db2.gz NSKFYILKECUXAS-VHSXEESVSA-N 1 2 249.301 2.353 20 0 BEADLO CC(C)C[C@@H](C)n1cc(Cn2cc[nH+]c2)nn1 ZINC000641092821 362219515 /nfs/dbraw/zinc/21/95/15/362219515.db2.gz LQHJGRZBJLOZDO-LLVKDONJSA-N 1 2 233.319 2.130 20 0 BEADLO CCOc1cccc(C[NH2+][C@H](C)c2ccon2)n1 ZINC000349206158 136331715 /nfs/dbraw/zinc/33/17/15/136331715.db2.gz XVOYRKPILCOKHQ-SNVBAGLBSA-N 1 2 247.298 2.319 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[S@@]1=O ZINC000335709021 136336818 /nfs/dbraw/zinc/33/68/18/136336818.db2.gz ZQOISCGHBOBKNC-DRXBFXEBSA-N 1 2 237.368 2.028 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[S@@]1=O ZINC000335709021 136336819 /nfs/dbraw/zinc/33/68/19/136336819.db2.gz ZQOISCGHBOBKNC-DRXBFXEBSA-N 1 2 237.368 2.028 20 0 BEADLO COC(=O)[C@@H](C)[NH2+]Cc1cc(C)c(C)cc1C ZINC000042307580 343434589 /nfs/dbraw/zinc/43/45/89/343434589.db2.gz NEOJOVHJCMETPY-GFCCVEGCSA-N 1 2 235.327 2.263 20 0 BEADLO CSC1CC[NH+]([C@@H](C)c2noc(C)n2)CC1 ZINC000602919172 349809678 /nfs/dbraw/zinc/80/96/78/349809678.db2.gz HRSYMTIMQBIFQI-QMMMGPOBSA-N 1 2 241.360 2.266 20 0 BEADLO CC(C)[C@H]1N(C(=O)CCc2[nH]cc[nH+]2)CC1(C)C ZINC000350748474 136362832 /nfs/dbraw/zinc/36/28/32/136362832.db2.gz NISWXMFPDCIJAW-CYBMUJFWSA-N 1 2 249.358 2.235 20 0 BEADLO Oc1cccc2c1CCC[C@H]2[NH2+]Cc1c[nH]cn1 ZINC000191659571 136363141 /nfs/dbraw/zinc/36/31/41/136363141.db2.gz GPUKWIOIMXUYBG-CYBMUJFWSA-N 1 2 243.310 2.283 20 0 BEADLO CSC1CC[NH+]([C@H](C)c2noc(C)n2)CC1 ZINC000602919171 349809283 /nfs/dbraw/zinc/80/92/83/349809283.db2.gz HRSYMTIMQBIFQI-MRVPVSSYSA-N 1 2 241.360 2.266 20 0 BEADLO Cc1cc(NC(=O)N2CCCCCO2)c(C)c[nH+]1 ZINC000576995360 365747393 /nfs/dbraw/zinc/74/73/93/365747393.db2.gz ATWXLCMTEKHJKL-UHFFFAOYSA-N 1 2 249.314 2.070 20 0 BEADLO Cc1csc(C[N@H+]2CCO[C@H](C)[C@H]2C)n1 ZINC000247978354 136373522 /nfs/dbraw/zinc/37/35/22/136373522.db2.gz IBIQFNRODUTJSF-NXEZZACHSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1csc(C[N@@H+]2CCO[C@H](C)[C@H]2C)n1 ZINC000247978354 136373523 /nfs/dbraw/zinc/37/35/23/136373523.db2.gz IBIQFNRODUTJSF-NXEZZACHSA-N 1 2 226.345 2.061 20 0 BEADLO CC(C)Cc1csc([C@H]2COCC[NH2+]2)n1 ZINC000084017206 343513481 /nfs/dbraw/zinc/51/34/81/343513481.db2.gz SIDRYEPDJLNQLB-SNVBAGLBSA-N 1 2 226.345 2.003 20 0 BEADLO CC(C)Cc1csc([C@@H]2COCC[NH2+]2)n1 ZINC000084017204 343513845 /nfs/dbraw/zinc/51/38/45/343513845.db2.gz SIDRYEPDJLNQLB-JTQLQIEISA-N 1 2 226.345 2.003 20 0 BEADLO C[C@@H](c1ccco1)[N@H+](C)Cc1cnccn1 ZINC000584092591 343537575 /nfs/dbraw/zinc/53/75/75/343537575.db2.gz QWEKMNVESMIXQL-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1cnccn1 ZINC000584092591 343537577 /nfs/dbraw/zinc/53/75/77/343537577.db2.gz QWEKMNVESMIXQL-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H](CC(=O)NCC1=CCCC1)n1cc[nH+]c1 ZINC000619999802 343544824 /nfs/dbraw/zinc/54/48/24/343544824.db2.gz AARDMDOUMLPSGC-LLVKDONJSA-N 1 2 233.315 2.061 20 0 BEADLO C[C@@H](NC(=O)c1cccc(F)c1)c1[nH]cc[nH+]1 ZINC000140806298 343562785 /nfs/dbraw/zinc/56/27/85/343562785.db2.gz VPSKKDKVCDFGMK-MRVPVSSYSA-N 1 2 233.246 2.040 20 0 BEADLO CC(C)[C@@H](NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1)C1CC1 ZINC000620033001 343586999 /nfs/dbraw/zinc/58/69/99/343586999.db2.gz HMJITIRHAVZWTI-GXFFZTMASA-N 1 2 249.358 2.139 20 0 BEADLO CC(C)[C@@H](NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1)C1CC1 ZINC000620033001 343587001 /nfs/dbraw/zinc/58/70/01/343587001.db2.gz HMJITIRHAVZWTI-GXFFZTMASA-N 1 2 249.358 2.139 20 0 BEADLO O=C(Nc1c[nH+]c2n1CCCC2)[C@@]12C[C@@H]1CCC2 ZINC000421570206 192363210 /nfs/dbraw/zinc/36/32/10/192363210.db2.gz QAJUAVSLHSMLSF-HZMBPMFUSA-N 1 2 245.326 2.348 20 0 BEADLO CCc1cc(N[C@@H](COC)C(C)C)nc[nH+]1 ZINC000083400319 343595548 /nfs/dbraw/zinc/59/55/48/343595548.db2.gz TWCMYFHTYJSZJW-NSHDSACASA-N 1 2 223.320 2.122 20 0 BEADLO COC(=O)[C@@H]([NH2+][C@H](C)C1CC1)c1ccccc1 ZINC000049538323 343601409 /nfs/dbraw/zinc/60/14/09/343601409.db2.gz OXOLIYDJOFTEJX-MFKMUULPSA-N 1 2 233.311 2.289 20 0 BEADLO COC(=O)C[N@H+](Cc1ccc(F)cc1)C(C)C ZINC000049573319 343603291 /nfs/dbraw/zinc/60/32/91/343603291.db2.gz QYLMLTINRIDBQP-UHFFFAOYSA-N 1 2 239.290 2.209 20 0 BEADLO COC(=O)C[N@@H+](Cc1ccc(F)cc1)C(C)C ZINC000049573319 343603293 /nfs/dbraw/zinc/60/32/93/343603293.db2.gz QYLMLTINRIDBQP-UHFFFAOYSA-N 1 2 239.290 2.209 20 0 BEADLO CCc1nc(C[NH2+]Cc2cc(C)no2)cs1 ZINC000050285667 343612198 /nfs/dbraw/zinc/61/21/98/343612198.db2.gz JLEIMOIVWLUDSA-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO COc1cc[nH+]cc1CS[C@H](C)CCO ZINC000379879447 343647659 /nfs/dbraw/zinc/64/76/59/343647659.db2.gz UYUZICGDDFQRBS-SECBINFHSA-N 1 2 227.329 2.094 20 0 BEADLO CCc1cc(NC[C@@H]2CCCC[C@H]2O)nc[nH+]1 ZINC000077208388 343671162 /nfs/dbraw/zinc/67/11/62/343671162.db2.gz OTRAHNYFALYSBI-CMPLNLGQSA-N 1 2 235.331 2.002 20 0 BEADLO C[C@H](CCO)SCc1cn2ccccc2[nH+]1 ZINC000083812634 343674222 /nfs/dbraw/zinc/67/42/22/343674222.db2.gz RNVXHTQXWCTWQS-SNVBAGLBSA-N 1 2 236.340 2.338 20 0 BEADLO CCc1nc(C[NH2+]Cc2conc2C)cs1 ZINC000339244760 343696107 /nfs/dbraw/zinc/69/61/07/343696107.db2.gz CXUYBHCGWXGWBF-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO CN(c1nc2ccccc2n2c[nH+]cc12)C1CC1 ZINC000623848547 343684021 /nfs/dbraw/zinc/68/40/21/343684021.db2.gz AQYCUBVJUJACAP-UHFFFAOYSA-N 1 2 238.294 2.481 20 0 BEADLO Cc1cc(CNC(=O)C[C@H]2C[C@@H]2C)cc(C)[nH+]1 ZINC000421573778 192364286 /nfs/dbraw/zinc/36/42/86/192364286.db2.gz CABRSOPQOCIIMZ-TVQRCGJNSA-N 1 2 232.327 2.361 20 0 BEADLO Cc1ccc(CN2CCc3[nH+]c[nH]c3C2)cc1F ZINC000625434079 343734809 /nfs/dbraw/zinc/73/48/09/343734809.db2.gz CEHRPRRPHXONOX-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)c1ccc(Cl)cc1 ZINC000336395713 537806103 /nfs/dbraw/zinc/80/61/03/537806103.db2.gz PXUWITZDYPINKI-UHFFFAOYSA-N 1 2 249.701 2.004 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2nccs2)[nH]n1 ZINC000380265200 343712109 /nfs/dbraw/zinc/71/21/09/343712109.db2.gz TUDCUWNJFKSGNU-QMMMGPOBSA-N 1 2 222.317 2.025 20 0 BEADLO COC1(C(=O)Nc2cc(C)[nH+]cc2C)CCCC1 ZINC000584208136 343773664 /nfs/dbraw/zinc/77/36/64/343773664.db2.gz SUFQXLNZGASJFT-UHFFFAOYSA-N 1 2 248.326 2.018 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CC[C@H](C)C1)c1[nH]cc[nH+]1 ZINC000570409664 323058855 /nfs/dbraw/zinc/05/88/55/323058855.db2.gz CJHMATYIJNCDHX-IVZWLZJFSA-N 1 2 221.304 2.023 20 0 BEADLO c1nc(C2CC2)c(CNc2c[nH]c[nH+]2)s1 ZINC000309074609 349854489 /nfs/dbraw/zinc/85/44/89/349854489.db2.gz IUTNTZDPEAWWCM-UHFFFAOYSA-N 1 2 220.301 2.356 20 0 BEADLO CC(C)CC1(NC(=O)CCCn2cc[nH+]c2)CC1 ZINC000620280415 343785467 /nfs/dbraw/zinc/78/54/67/343785467.db2.gz KWVWDMZWXFJLRH-UHFFFAOYSA-N 1 2 249.358 2.358 20 0 BEADLO CNc1cc(NCc2ccc(C)cc2)nc[nH+]1 ZINC000128639117 343787204 /nfs/dbraw/zinc/78/72/04/343787204.db2.gz DRFYKODPPZAKDL-UHFFFAOYSA-N 1 2 228.299 2.439 20 0 BEADLO CNc1cc(NCc2ccc(C)cc2)[nH+]cn1 ZINC000128639117 343787205 /nfs/dbraw/zinc/78/72/05/343787205.db2.gz DRFYKODPPZAKDL-UHFFFAOYSA-N 1 2 228.299 2.439 20 0 BEADLO c1cc2cc(C[N@@H+]3CCO[C@@H]4C[C@@H]43)ccc2[nH]1 ZINC000628291270 346987252 /nfs/dbraw/zinc/98/72/52/346987252.db2.gz VENCTABUIBQNFF-UONOGXRCSA-N 1 2 228.295 2.141 20 0 BEADLO c1cc2cc(C[N@H+]3CCO[C@@H]4C[C@@H]43)ccc2[nH]1 ZINC000628291270 346987255 /nfs/dbraw/zinc/98/72/55/346987255.db2.gz VENCTABUIBQNFF-UONOGXRCSA-N 1 2 228.295 2.141 20 0 BEADLO C[N@H+](CC(=O)OC(C)(C)C)[C@H]1C=CCCC1 ZINC000066497503 349877164 /nfs/dbraw/zinc/87/71/64/349877164.db2.gz ZVQNJXYABGDBAM-NSHDSACASA-N 1 2 225.332 2.369 20 0 BEADLO C[N@@H+](CC(=O)OC(C)(C)C)[C@H]1C=CCCC1 ZINC000066497503 349877167 /nfs/dbraw/zinc/87/71/67/349877167.db2.gz ZVQNJXYABGDBAM-NSHDSACASA-N 1 2 225.332 2.369 20 0 BEADLO C[N@H+](Cc1cnc[nH]1)Cc1ccc(F)cc1 ZINC000179646521 346991424 /nfs/dbraw/zinc/99/14/24/346991424.db2.gz HWIKRQBXJHKIOE-UHFFFAOYSA-N 1 2 219.263 2.181 20 0 BEADLO C[N@@H+](Cc1cnc[nH]1)Cc1ccc(F)cc1 ZINC000179646521 346991428 /nfs/dbraw/zinc/99/14/28/346991428.db2.gz HWIKRQBXJHKIOE-UHFFFAOYSA-N 1 2 219.263 2.181 20 0 BEADLO C[N@H+](Cc1c[nH]cn1)Cc1ccc(F)cc1 ZINC000179646521 346991432 /nfs/dbraw/zinc/99/14/32/346991432.db2.gz HWIKRQBXJHKIOE-UHFFFAOYSA-N 1 2 219.263 2.181 20 0 BEADLO C[N@@H+](Cc1c[nH]cn1)Cc1ccc(F)cc1 ZINC000179646521 346991434 /nfs/dbraw/zinc/99/14/34/346991434.db2.gz HWIKRQBXJHKIOE-UHFFFAOYSA-N 1 2 219.263 2.181 20 0 BEADLO COc1ccccc1N(C)Cc1[nH+]ccn1C ZINC000624482134 343906040 /nfs/dbraw/zinc/90/60/40/343906040.db2.gz BOZTXAXKGSBJRX-UHFFFAOYSA-N 1 2 231.299 2.065 20 0 BEADLO Cc1ccc(Cc2noc(C34CC(C3)C4)n2)c[nH+]1 ZINC000624487020 343906625 /nfs/dbraw/zinc/90/66/25/343906625.db2.gz WXFMDSJPFCUHFG-UHFFFAOYSA-N 1 2 241.294 2.415 20 0 BEADLO CCC[C@H](C)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000603246569 349898231 /nfs/dbraw/zinc/89/82/31/349898231.db2.gz IPYRVCIRDLRXMM-QWHCGFSZSA-N 1 2 249.358 2.483 20 0 BEADLO CO[C@H](CNc1cccc[nH+]1)C(F)(F)F ZINC000393776964 343927343 /nfs/dbraw/zinc/92/73/43/343927343.db2.gz NYSWXEASAMGUKM-SSDOTTSWSA-N 1 2 220.194 2.071 20 0 BEADLO Cc1[nH]c(CN2CCn3cccc3[C@@H]2C)[nH+]c1C ZINC000628119234 343970775 /nfs/dbraw/zinc/97/07/75/343970775.db2.gz ICEDFQPILCUFCL-LBPRGKRZSA-N 1 2 244.342 2.405 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)CCc1nccs1 ZINC000558533579 343950942 /nfs/dbraw/zinc/95/09/42/343950942.db2.gz OBITWWZHDUXITE-UHFFFAOYSA-N 1 2 248.355 2.229 20 0 BEADLO Cn1c2cc(F)ccc2[nH]c1=[NH+]CC(C)(C)F ZINC000631406740 343957524 /nfs/dbraw/zinc/95/75/24/343957524.db2.gz QLIUCVJLILITFF-UHFFFAOYSA-N 1 2 239.269 2.294 20 0 BEADLO Cc1[nH+]c2ccc(C(=O)N3CC[C@@H]3C)cc2n1C ZINC000641244251 362321242 /nfs/dbraw/zinc/32/12/42/362321242.db2.gz XRGIASKYKNMPHJ-VIFPVBQESA-N 1 2 243.310 2.116 20 0 BEADLO CC(C)C[C@H](C(=O)N1CC[C@H]1C)n1cc[nH+]c1 ZINC000641247390 362327269 /nfs/dbraw/zinc/32/72/69/362327269.db2.gz RAPATEIRJAUGLZ-VXGBXAGGSA-N 1 2 235.331 2.091 20 0 BEADLO Fc1c[nH+]ccc1NC(C1CC1)C1CC1 ZINC000641275730 362342666 /nfs/dbraw/zinc/34/26/66/362342666.db2.gz UGOFEORVBMKYGO-UHFFFAOYSA-N 1 2 206.264 2.243 20 0 BEADLO CCN(C[C@@H]1CCCO1)c1cc[nH+]cc1F ZINC000641305533 362354534 /nfs/dbraw/zinc/35/45/34/362354534.db2.gz CBPJSWWGINATQI-JTQLQIEISA-N 1 2 224.279 2.226 20 0 BEADLO Cc1ccc(C[N@@H+]2CCOC(C)(C)C2)nc1 ZINC000130090979 344111076 /nfs/dbraw/zinc/11/10/76/344111076.db2.gz WBGZLSOBCINZDS-UHFFFAOYSA-N 1 2 220.316 2.001 20 0 BEADLO Cc1ccc(C[N@H+]2CCOC(C)(C)C2)nc1 ZINC000130090979 344111081 /nfs/dbraw/zinc/11/10/81/344111081.db2.gz WBGZLSOBCINZDS-UHFFFAOYSA-N 1 2 220.316 2.001 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000570693283 323067477 /nfs/dbraw/zinc/06/74/77/323067477.db2.gz BKRNPYGVRXIFSU-GARJFASQSA-N 1 2 237.347 2.139 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000570693283 323067478 /nfs/dbraw/zinc/06/74/78/323067478.db2.gz BKRNPYGVRXIFSU-GARJFASQSA-N 1 2 237.347 2.139 20 0 BEADLO Cc1cc(C[N@@H+]2CCOCC23CCCC3)no1 ZINC000335911400 344084106 /nfs/dbraw/zinc/08/41/06/344084106.db2.gz UZCWVESBTVHWDV-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO Cc1cc(C[N@H+]2CCOCC23CCCC3)no1 ZINC000335911400 344084108 /nfs/dbraw/zinc/08/41/08/344084108.db2.gz UZCWVESBTVHWDV-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO CC(C)c1noc(C[NH+](C2CC2)C2CC2)n1 ZINC000625834911 344088736 /nfs/dbraw/zinc/08/87/36/344088736.db2.gz RLHFLMJHDUOYSP-UHFFFAOYSA-N 1 2 221.304 2.320 20 0 BEADLO C(c1nc(C2CC2)no1)[NH+](C1CC1)C1CC1 ZINC000625837361 344089804 /nfs/dbraw/zinc/08/98/04/344089804.db2.gz NGDGMZBUBPPAMQ-UHFFFAOYSA-N 1 2 219.288 2.074 20 0 BEADLO FC(F)c1noc(C[NH+](C2CC2)C2CC2)n1 ZINC000625840865 344092142 /nfs/dbraw/zinc/09/21/42/344092142.db2.gz DZNDLQOUFSRZDO-UHFFFAOYSA-N 1 2 229.230 2.134 20 0 BEADLO CC1(C)CCN(C(=O)c2ccc3[nH+]ccn3c2)C1 ZINC000081351966 344141186 /nfs/dbraw/zinc/14/11/86/344141186.db2.gz AZSHIWFBHCQSED-UHFFFAOYSA-N 1 2 243.310 2.206 20 0 BEADLO Cc1ccc(CNc2ccc(N(C)C)[nH+]c2)nc1 ZINC000121791786 178638443 /nfs/dbraw/zinc/63/84/43/178638443.db2.gz VNPHARDLFWBAFR-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO CN(C[C@H]1CCOC1)c1cc[nH+]c2ccncc21 ZINC000085689467 344208132 /nfs/dbraw/zinc/20/81/32/344208132.db2.gz HMUQRSDKCBMRBT-LLVKDONJSA-N 1 2 243.310 2.103 20 0 BEADLO CCc1noc(C)c1C[NH2+]Cc1cc(C)no1 ZINC000631142776 344204439 /nfs/dbraw/zinc/20/44/39/344204439.db2.gz KTPBSNNBIIPPBW-UHFFFAOYSA-N 1 2 235.287 2.132 20 0 BEADLO Cc1cc(C(=O)NCCC2CC2)c2[nH+]ccn2c1 ZINC000625871445 344252011 /nfs/dbraw/zinc/25/20/11/344252011.db2.gz IUNBUWVZPZQULO-UHFFFAOYSA-N 1 2 243.310 2.173 20 0 BEADLO C[C@H](CCO)SCc1ccc(N(C)C)[nH+]c1 ZINC000600525555 344256962 /nfs/dbraw/zinc/25/69/62/344256962.db2.gz WWNOBBQBTJSXRP-SNVBAGLBSA-N 1 2 240.372 2.152 20 0 BEADLO C[C@@H]1CCC[C@@H]1Nc1cc(CO)cc[nH+]1 ZINC000641348430 362373671 /nfs/dbraw/zinc/37/36/71/362373671.db2.gz XOPHKMDYFURTQC-KOLCDFICSA-N 1 2 206.289 2.174 20 0 BEADLO CC1=C[C@@H](C)CN(C(=O)C(C)(C)c2c[nH+]c[nH]2)C1 ZINC000621989260 370646641 /nfs/dbraw/zinc/64/66/41/370646641.db2.gz ANMJUMODXNLHBU-SNVBAGLBSA-N 1 2 247.342 2.112 20 0 BEADLO CC[C@@H](C)[C@H](C)Nc1cc(CO)cc[nH+]1 ZINC000641383733 362384639 /nfs/dbraw/zinc/38/46/39/362384639.db2.gz DOEBJJZRLMXFRB-ZJUUUORDSA-N 1 2 208.305 2.420 20 0 BEADLO CC1(C)C[C@@H]1CNc1cc(CO)cc[nH+]1 ZINC000641371249 362379803 /nfs/dbraw/zinc/37/98/03/362379803.db2.gz BMVVSJWDELWROA-SNVBAGLBSA-N 1 2 206.289 2.032 20 0 BEADLO CC[C@@H]1CN(c2cc[nH+]cc2F)C[C@@H](C)O1 ZINC000641368721 362379942 /nfs/dbraw/zinc/37/99/42/362379942.db2.gz XXJVKUMXIADUAO-NXEZZACHSA-N 1 2 224.279 2.224 20 0 BEADLO OCc1cc[nH+]c(N2CC[C@H](c3ccco3)C2)c1 ZINC000641369086 362380413 /nfs/dbraw/zinc/38/04/13/362380413.db2.gz ZMKSWRMUYWBBQW-LBPRGKRZSA-N 1 2 244.294 2.161 20 0 BEADLO CC(F)(F)CC[N@@H+]1Cc2cccnc2C1 ZINC000584287945 344421998 /nfs/dbraw/zinc/42/19/98/344421998.db2.gz BEFUIIMGZTZZJP-UHFFFAOYSA-N 1 2 212.243 2.443 20 0 BEADLO CC(F)(F)CC[N@H+]1Cc2cccnc2C1 ZINC000584287945 344421999 /nfs/dbraw/zinc/42/19/99/344421999.db2.gz BEFUIIMGZTZZJP-UHFFFAOYSA-N 1 2 212.243 2.443 20 0 BEADLO CCC[N@@H+]1CC[C@H](NCc2cc(C#N)cs2)C1 ZINC000389308965 344429953 /nfs/dbraw/zinc/42/99/53/344429953.db2.gz FQLSFGXDORXRHI-LBPRGKRZSA-N 1 2 249.383 2.194 20 0 BEADLO CCC[N@H+]1CC[C@H](NCc2cc(C#N)cs2)C1 ZINC000389308965 344429955 /nfs/dbraw/zinc/42/99/55/344429955.db2.gz FQLSFGXDORXRHI-LBPRGKRZSA-N 1 2 249.383 2.194 20 0 BEADLO CC(C)(C)CCCNc1cc(CO)cc[nH+]1 ZINC000641388457 362387871 /nfs/dbraw/zinc/38/78/71/362387871.db2.gz SXPMWIWCAUDSNJ-UHFFFAOYSA-N 1 2 222.332 2.234 20 0 BEADLO O=C([C@@H]1CC12CC2)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000622337958 344506312 /nfs/dbraw/zinc/50/63/12/344506312.db2.gz RBCMUOCGYLZEPV-QWRGUYRKSA-N 1 2 245.326 2.263 20 0 BEADLO Cc1nc(C)c(CNc2cc(CO)cc[nH+]2)s1 ZINC000641398993 362393189 /nfs/dbraw/zinc/39/31/89/362393189.db2.gz WSJLCQFJMSAZPI-UHFFFAOYSA-N 1 2 249.339 2.259 20 0 BEADLO Fc1c[nH+]ccc1N1CCC2(C1)CCOCC2 ZINC000641411400 362402414 /nfs/dbraw/zinc/40/24/14/362402414.db2.gz YXHULLGFXQAUAD-UHFFFAOYSA-N 1 2 236.290 2.228 20 0 BEADLO CCCC[C@H]([NH2+][C@H]1CCS[C@@H]1C)C(=O)OC ZINC000381551197 344520125 /nfs/dbraw/zinc/52/01/25/344520125.db2.gz MUMXOGXWTQZLRJ-VWYCJHECSA-N 1 2 245.388 2.202 20 0 BEADLO Fc1c[nH+]ccc1N[C@H]1CCOC2(CCC2)C1 ZINC000641446737 362423508 /nfs/dbraw/zinc/42/35/08/362423508.db2.gz FJVXBZCKSXBUQJ-JTQLQIEISA-N 1 2 236.290 2.156 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@@H]([C@H]2CCOC2)C1 ZINC000641457700 362429161 /nfs/dbraw/zinc/42/91/61/362429161.db2.gz ZGOOJUKHNZBOGD-MNOVXSKESA-N 1 2 236.290 2.084 20 0 BEADLO C[C@@H]1CCN(c2cc(CO)cc[nH+]2)C[C@@H](C)C1 ZINC000641456543 362429782 /nfs/dbraw/zinc/42/97/82/362429782.db2.gz QKCGJIYBPDCIQT-NEPJUHHUSA-N 1 2 234.343 2.446 20 0 BEADLO C[C@H](Nc1cc(CO)cc[nH+]1)C1CCC1 ZINC000641462345 362436663 /nfs/dbraw/zinc/43/66/63/362436663.db2.gz RPSMJYVIAKUWFY-VIFPVBQESA-N 1 2 206.289 2.174 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1[C@H]2CCO[C@H]2C12CCC2 ZINC000641461947 362436734 /nfs/dbraw/zinc/43/67/34/362436734.db2.gz ZNZLDZFAMIPKQN-OASPWFOLSA-N 1 2 248.301 2.012 20 0 BEADLO C[C@]1(CNc2cc(CO)cc[nH+]2)CCCS1 ZINC000641432731 362416486 /nfs/dbraw/zinc/41/64/86/362416486.db2.gz PUUMPUJPJBTNAN-GFCCVEGCSA-N 1 2 238.356 2.272 20 0 BEADLO C[C@]1(CNc2cc[nH+]cc2F)CCCS1 ZINC000641433389 362416511 /nfs/dbraw/zinc/41/65/11/362416511.db2.gz UPPLRZHBWMNPFM-LLVKDONJSA-N 1 2 226.320 2.340 20 0 BEADLO CC(C)(C)[C@@H]1CN(c2cc[nH+]cc2F)CCO1 ZINC000641544589 362492087 /nfs/dbraw/zinc/49/20/87/362492087.db2.gz ZGJYIZNDZDNFQE-LBPRGKRZSA-N 1 2 238.306 2.472 20 0 BEADLO C[C@H]1CCN(c2cc[nH+]cc2F)C[C@@H]1F ZINC000641483930 362452604 /nfs/dbraw/zinc/45/26/04/362452604.db2.gz XSMYOWXPLLKMGH-WPRPVWTQSA-N 1 2 212.243 2.405 20 0 BEADLO Fc1c[nH+]ccc1N1CCC[C@@H](OC(F)F)C1 ZINC000641485076 362453932 /nfs/dbraw/zinc/45/39/32/362453932.db2.gz IOMBOMNGWDGVPA-MRVPVSSYSA-N 1 2 246.232 2.429 20 0 BEADLO OCc1cc[nH+]c(NC[C@H]2CCCCS2)c1 ZINC000641487284 362454770 /nfs/dbraw/zinc/45/47/70/362454770.db2.gz IRVJYDUPRTUTDQ-LLVKDONJSA-N 1 2 238.356 2.272 20 0 BEADLO Nc1[nH+]cccc1CSc1nc2c([nH]1)CCC2 ZINC000641485632 362456493 /nfs/dbraw/zinc/45/64/93/362456493.db2.gz JEYAOATXHRSIEV-UHFFFAOYSA-N 1 2 246.339 2.168 20 0 BEADLO C[C@@H](CC(F)(F)F)Nc1cc(CO)cc[nH+]1 ZINC000641494202 362460756 /nfs/dbraw/zinc/46/07/56/362460756.db2.gz ROFUZOGXLNCNQK-ZETCQYMHSA-N 1 2 234.221 2.327 20 0 BEADLO C[C@@H]1CN(c2cc[nH+]cc2F)[C@@H](C)[C@H](C)O1 ZINC000641522876 362480147 /nfs/dbraw/zinc/48/01/47/362480147.db2.gz WXAUPHWNQGZWDL-UTLUCORTSA-N 1 2 224.279 2.223 20 0 BEADLO CO[C@H]1CN(c2cc[nH+]cc2F)CC[C@@H]1C ZINC000641523006 362480257 /nfs/dbraw/zinc/48/02/57/362480257.db2.gz XLGJVZTVRDAYEC-CABZTGNLSA-N 1 2 224.279 2.082 20 0 BEADLO C[C@@H]1CN(c2cc[nH+]cc2F)[C@@H](C)[C@@H](C)O1 ZINC000641522874 362480388 /nfs/dbraw/zinc/48/03/88/362480388.db2.gz WXAUPHWNQGZWDL-KXUCPTDWSA-N 1 2 224.279 2.223 20 0 BEADLO C[C@H]1CN(c2cc[nH+]cc2F)C[C@@H](C2CC2)O1 ZINC000641546577 362493927 /nfs/dbraw/zinc/49/39/27/362493927.db2.gz XVYAABYAHFELIJ-ZANVPECISA-N 1 2 236.290 2.224 20 0 BEADLO Cc1cc(C(=O)NCC2(C)CC2)c2[nH+]ccn2c1 ZINC000625981838 344649436 /nfs/dbraw/zinc/64/94/36/344649436.db2.gz GLFKGLGNZOPVHA-UHFFFAOYSA-N 1 2 243.310 2.173 20 0 BEADLO OC[C@H]1CCN(c2[nH+]ccc3ccccc32)C1 ZINC000168747516 344680619 /nfs/dbraw/zinc/68/06/19/344680619.db2.gz AHLXMJAWLDIPLF-NSHDSACASA-N 1 2 228.295 2.053 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1NC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000577955693 344658690 /nfs/dbraw/zinc/65/86/90/344658690.db2.gz DIPRBLUUZITFBO-YNEHKIRRSA-N 1 2 249.358 2.385 20 0 BEADLO C[C@H](c1cccnc1)[N@@H+]1CCO[C@@H](CCF)C1 ZINC000626001972 344662187 /nfs/dbraw/zinc/66/21/87/344662187.db2.gz CIHNBVOGNMGKLT-YPMHNXCESA-N 1 2 238.306 2.203 20 0 BEADLO C[C@H](c1cccnc1)[N@H+]1CCO[C@@H](CCF)C1 ZINC000626001972 344662190 /nfs/dbraw/zinc/66/21/90/344662190.db2.gz CIHNBVOGNMGKLT-YPMHNXCESA-N 1 2 238.306 2.203 20 0 BEADLO Cc1ncsc1C[N@@H+]1CCO[C@H](CCF)C1 ZINC000626005513 344668331 /nfs/dbraw/zinc/66/83/31/344668331.db2.gz DTTHABJDDRGOPQ-SNVBAGLBSA-N 1 2 244.335 2.012 20 0 BEADLO Cc1ncsc1C[N@H+]1CCO[C@H](CCF)C1 ZINC000626005513 344668333 /nfs/dbraw/zinc/66/83/33/344668333.db2.gz DTTHABJDDRGOPQ-SNVBAGLBSA-N 1 2 244.335 2.012 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N2CCC(C)CC2)c1 ZINC000259712914 344684964 /nfs/dbraw/zinc/68/49/64/344684964.db2.gz AGICHRVNQCXTFX-UHFFFAOYSA-N 1 2 248.326 2.033 20 0 BEADLO CC[C@H](Nc1cc[nH+]c(C)n1)C1CCOCC1 ZINC000074774355 344758950 /nfs/dbraw/zinc/75/89/50/344758950.db2.gz UPJUKRGUSFOGBH-LBPRGKRZSA-N 1 2 235.331 2.402 20 0 BEADLO CC[C@@H](Nc1cc[nH+]c(C)n1)C1CCOCC1 ZINC000074774357 344758990 /nfs/dbraw/zinc/75/89/90/344758990.db2.gz UPJUKRGUSFOGBH-GFCCVEGCSA-N 1 2 235.331 2.402 20 0 BEADLO CC[C@@H]1C[C@@H](C)CN1c1cc[nH+]c(C)n1 ZINC000075065972 344764780 /nfs/dbraw/zinc/76/47/80/344764780.db2.gz MGDHHWOABKCCEQ-MWLCHTKSSA-N 1 2 205.305 2.410 20 0 BEADLO CC(C)[C@@H](C)CC(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000075630059 344781859 /nfs/dbraw/zinc/78/18/59/344781859.db2.gz CHMXYKRRRAYGJA-NWDGAFQWSA-N 1 2 237.347 2.070 20 0 BEADLO C[C@H]1C[N@H+](Cc2noc(C3CC3)n2)C[C@H]1C ZINC000076111532 344795669 /nfs/dbraw/zinc/79/56/69/344795669.db2.gz JWCZIWMJNURNRS-DTORHVGOSA-N 1 2 221.304 2.035 20 0 BEADLO C[C@H]1C[N@@H+](Cc2noc(C3CC3)n2)C[C@H]1C ZINC000076111532 344795670 /nfs/dbraw/zinc/79/56/70/344795670.db2.gz JWCZIWMJNURNRS-DTORHVGOSA-N 1 2 221.304 2.035 20 0 BEADLO C[C@@H]1C[NH+](Cc2noc(C3CC3)n2)C[C@H]1C ZINC000076111534 344795787 /nfs/dbraw/zinc/79/57/87/344795787.db2.gz JWCZIWMJNURNRS-RKDXNWHRSA-N 1 2 221.304 2.035 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1cnc(C2CC2)o1 ZINC000628140512 344805787 /nfs/dbraw/zinc/80/57/87/344805787.db2.gz NOQUEDDGNQNDRM-ZJUUUORDSA-N 1 2 236.315 2.161 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1cnc(C2CC2)o1 ZINC000628140512 344805789 /nfs/dbraw/zinc/80/57/89/344805789.db2.gz NOQUEDDGNQNDRM-ZJUUUORDSA-N 1 2 236.315 2.161 20 0 BEADLO C[C@H](c1cccs1)N(C)C(=O)Cn1cc[nH+]c1 ZINC000076830370 344806889 /nfs/dbraw/zinc/80/68/89/344806889.db2.gz AKHAUZWMUYMTIF-SNVBAGLBSA-N 1 2 249.339 2.164 20 0 BEADLO C[C@@H]1[C@@H](C)[S@@](=O)CC[N@@H+]1Cc1ccccc1 ZINC000076825064 344806896 /nfs/dbraw/zinc/80/68/96/344806896.db2.gz CQQXJFSNNKJUHY-XHBSWPGZSA-N 1 2 237.368 2.028 20 0 BEADLO C[C@@H]1[C@@H](C)[S@@](=O)CC[N@H+]1Cc1ccccc1 ZINC000076825064 344806897 /nfs/dbraw/zinc/80/68/97/344806897.db2.gz CQQXJFSNNKJUHY-XHBSWPGZSA-N 1 2 237.368 2.028 20 0 BEADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccon2)on1 ZINC000077265841 344814656 /nfs/dbraw/zinc/81/46/56/344814656.db2.gz FVYCOGMBICLKDJ-LLVKDONJSA-N 1 2 233.271 2.308 20 0 BEADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ccon2)on1 ZINC000077265841 344814658 /nfs/dbraw/zinc/81/46/58/344814658.db2.gz FVYCOGMBICLKDJ-LLVKDONJSA-N 1 2 233.271 2.308 20 0 BEADLO C[C@@H]1CC[C@@H](CNc2cc(CO)cc[nH+]2)C1 ZINC000641547428 362495488 /nfs/dbraw/zinc/49/54/88/362495488.db2.gz QNXBLUPOMTVDTD-GHMZBOCLSA-N 1 2 220.316 2.422 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2C[C@@H](C)S[C@@H](C)C2)n1 ZINC000628156355 344848452 /nfs/dbraw/zinc/84/84/52/344848452.db2.gz MEHNMQPEUQFRMF-AOOOYVTPSA-N 1 2 225.361 2.044 20 0 BEADLO Cc1c[nH]c(C[N@H+]2C[C@@H](C)S[C@@H](C)C2)n1 ZINC000628156355 344848455 /nfs/dbraw/zinc/84/84/55/344848455.db2.gz MEHNMQPEUQFRMF-AOOOYVTPSA-N 1 2 225.361 2.044 20 0 BEADLO C[C@@H](O)CC(C)(C)CNc1cccc[nH+]1 ZINC000078339862 344850067 /nfs/dbraw/zinc/85/00/67/344850067.db2.gz UMIQNZBZMVXRDY-SNVBAGLBSA-N 1 2 208.305 2.291 20 0 BEADLO CCN(Cc1ccoc1)Cc1[nH]cc(C)[nH+]1 ZINC000628161897 344859726 /nfs/dbraw/zinc/85/97/26/344859726.db2.gz VWORJDBLBBNEGC-UHFFFAOYSA-N 1 2 219.288 2.333 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2scnc2C)o1 ZINC000628162792 344862182 /nfs/dbraw/zinc/86/21/82/344862182.db2.gz DYEDDVOYNASVKW-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2scnc2C)o1 ZINC000628162792 344862184 /nfs/dbraw/zinc/86/21/84/344862184.db2.gz DYEDDVOYNASVKW-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO C[C@@H](CC(=O)N(C)CCC1CC1)n1cc[nH+]c1 ZINC000578512144 344888425 /nfs/dbraw/zinc/88/84/25/344888425.db2.gz PLJXRMVAFGPZBX-NSHDSACASA-N 1 2 235.331 2.093 20 0 BEADLO C[C@H](CC(=O)N(C)CCC1CC1)n1cc[nH+]c1 ZINC000578512141 344888743 /nfs/dbraw/zinc/88/87/43/344888743.db2.gz PLJXRMVAFGPZBX-LLVKDONJSA-N 1 2 235.331 2.093 20 0 BEADLO CC(C)[C@H]1C[C@@H]1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000577071040 365803023 /nfs/dbraw/zinc/80/30/23/365803023.db2.gz IXALYUHEKREEKZ-ZJUUUORDSA-N 1 2 235.331 2.053 20 0 BEADLO CO[C@H]1CCN(c2cc3ccccc3c[nH+]2)C1 ZINC000631148144 344925441 /nfs/dbraw/zinc/92/54/41/344925441.db2.gz JUJHFNIIVURLHB-ZDUSSCGKSA-N 1 2 228.295 2.460 20 0 BEADLO Cc1[nH]c(CN(C)Cc2cccc(C)n2)[nH+]c1C ZINC000628183379 344929724 /nfs/dbraw/zinc/92/97/24/344929724.db2.gz ZDWAQFDCLCDYOC-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO CC(C)[C@@H]1C[C@H]1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000577071038 365803200 /nfs/dbraw/zinc/80/32/00/365803200.db2.gz IXALYUHEKREEKZ-VHSXEESVSA-N 1 2 235.331 2.053 20 0 BEADLO Cc1nc(C[N@H+]2CCS[C@@H](C)[C@H]2C)[nH]c1C ZINC000628179206 344913832 /nfs/dbraw/zinc/91/38/32/344913832.db2.gz RCYDZRHXEJJFKZ-MNOVXSKESA-N 1 2 239.388 2.352 20 0 BEADLO Cc1nc(C[N@@H+]2CCS[C@@H](C)[C@H]2C)[nH]c1C ZINC000628179206 344913835 /nfs/dbraw/zinc/91/38/35/344913835.db2.gz RCYDZRHXEJJFKZ-MNOVXSKESA-N 1 2 239.388 2.352 20 0 BEADLO Cc1[nH]c(CN2CCS[C@@H](C)[C@H]2C)[nH+]c1C ZINC000628179206 344913837 /nfs/dbraw/zinc/91/38/37/344913837.db2.gz RCYDZRHXEJJFKZ-MNOVXSKESA-N 1 2 239.388 2.352 20 0 BEADLO CC[C@@H]1CCCC[C@H]1C[N@H+](C)Cc1nnc[nH]1 ZINC000628179657 344915574 /nfs/dbraw/zinc/91/55/74/344915574.db2.gz JPZRSERYJYDDEP-NEPJUHHUSA-N 1 2 236.363 2.453 20 0 BEADLO CC[C@@H]1CCCC[C@H]1C[N@@H+](C)Cc1nnc[nH]1 ZINC000628179657 344915576 /nfs/dbraw/zinc/91/55/76/344915576.db2.gz JPZRSERYJYDDEP-NEPJUHHUSA-N 1 2 236.363 2.453 20 0 BEADLO c1nc(C2CC2)oc1C[N@@H+]1CCOCC12CCC2 ZINC000628179654 344915642 /nfs/dbraw/zinc/91/56/42/344915642.db2.gz JNLWJRLXCUKQPW-UHFFFAOYSA-N 1 2 248.326 2.307 20 0 BEADLO c1nc(C2CC2)oc1C[N@H+]1CCOCC12CCC2 ZINC000628179654 344915643 /nfs/dbraw/zinc/91/56/43/344915643.db2.gz JNLWJRLXCUKQPW-UHFFFAOYSA-N 1 2 248.326 2.307 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@@H]3CCCC[C@@]32C)no1 ZINC000626105350 344974785 /nfs/dbraw/zinc/97/47/85/344974785.db2.gz CJBCCJUPTMGGQL-JQWIXIFHSA-N 1 2 221.304 2.143 20 0 BEADLO Cc1nc(C[N@H+]2C[C@@H]3CCCC[C@@]32C)no1 ZINC000626105350 344974789 /nfs/dbraw/zinc/97/47/89/344974789.db2.gz CJBCCJUPTMGGQL-JQWIXIFHSA-N 1 2 221.304 2.143 20 0 BEADLO C[C@@H]1CCC[C@H]1CNc1cc(CO)cc[nH+]1 ZINC000641553275 362497662 /nfs/dbraw/zinc/49/76/62/362497662.db2.gz VCCZYLLGBWKTGX-PWSUYJOCSA-N 1 2 220.316 2.422 20 0 BEADLO C[C@H]1CCC[C@@H]1CNc1cc(CO)cc[nH+]1 ZINC000641553272 362498054 /nfs/dbraw/zinc/49/80/54/362498054.db2.gz VCCZYLLGBWKTGX-CMPLNLGQSA-N 1 2 220.316 2.422 20 0 BEADLO Fc1c[nH+]ccc1N1CCC[C@@H]1[C@H]1CCCO1 ZINC000641560653 362500605 /nfs/dbraw/zinc/50/06/05/362500605.db2.gz FNTCRIUWYVRJOV-CHWSQXEVSA-N 1 2 236.290 2.369 20 0 BEADLO CC(=O)NCc1ccc(N2CCCCCC2)[nH+]c1 ZINC000048937795 345028413 /nfs/dbraw/zinc/02/84/13/345028413.db2.gz HBRYWGYMRMPPAK-UHFFFAOYSA-N 1 2 247.342 2.098 20 0 BEADLO CC[C@H](C)[C@H](CNc1cc[nH+]cc1F)OC ZINC000641615220 362547542 /nfs/dbraw/zinc/54/75/42/362547542.db2.gz IKHFWQGYCYQIDZ-CABZTGNLSA-N 1 2 226.295 2.116 20 0 BEADLO COc1c(C)[nH+]c(C2CC2)nc1NC1CCC1 ZINC000566479337 345072452 /nfs/dbraw/zinc/07/24/52/345072452.db2.gz XXLFBTPJMRZCSZ-UHFFFAOYSA-N 1 2 233.315 2.057 20 0 BEADLO CO[C@H]1CCN(c2cc[nH+]cc2F)C[C@@H]1C ZINC000641618397 362551799 /nfs/dbraw/zinc/55/17/99/362551799.db2.gz FZJAQUVMJXOHJE-CABZTGNLSA-N 1 2 224.279 2.082 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)Nc1ncncc1C ZINC000641622298 362554237 /nfs/dbraw/zinc/55/42/37/362554237.db2.gz QBCVZBCDBHSUGQ-SNVBAGLBSA-N 1 2 231.303 2.175 20 0 BEADLO CC(C)[C@@H]1CN(c2cc[nH+]cc2F)CCCO1 ZINC000641612486 362544257 /nfs/dbraw/zinc/54/42/57/362544257.db2.gz GICHTIMIQDBXJI-ZDUSSCGKSA-N 1 2 238.306 2.472 20 0 BEADLO OCc1cc[nH+]c(N2CCC(C3CC3)CC2)c1 ZINC000641607327 362544272 /nfs/dbraw/zinc/54/42/72/362544272.db2.gz RMYUDBAYFIJWQB-UHFFFAOYSA-N 1 2 232.327 2.200 20 0 BEADLO CC(C)c1nnc(C[NH2+][C@H](C)c2cccnc2)o1 ZINC000182883035 534986608 /nfs/dbraw/zinc/98/66/08/534986608.db2.gz ILTPBKMVQHSMAP-SNVBAGLBSA-N 1 2 246.314 2.439 20 0 BEADLO C[C@H]1CCC[C@@H](CNc2cc[nH+]cc2F)O1 ZINC000641660295 362580357 /nfs/dbraw/zinc/58/03/57/362580357.db2.gz WNTUPLBMQXLCEM-UWVGGRQHSA-N 1 2 224.279 2.012 20 0 BEADLO COC[C@@H]1CCCN(c2cc[nH+]cc2F)CC1 ZINC000641625456 362557769 /nfs/dbraw/zinc/55/77/69/362557769.db2.gz RTKJDRWHIDHUEJ-LLVKDONJSA-N 1 2 238.306 2.474 20 0 BEADLO COCC1CCC(Nc2cc[nH+]cc2F)CC1 ZINC000641634001 362563771 /nfs/dbraw/zinc/56/37/71/362563771.db2.gz IQSXHJYBYZDOLY-UHFFFAOYSA-N 1 2 238.306 2.260 20 0 BEADLO C[C@@H]1CC(C)(C)CN1c1cc(CO)cc[nH+]1 ZINC000641634187 362564087 /nfs/dbraw/zinc/56/40/87/362564087.db2.gz KHVQXMGWGODMBU-SNVBAGLBSA-N 1 2 220.316 2.199 20 0 BEADLO CC[C@@H]1C[C@H](Nc2cc[nH+]cc2F)CCO1 ZINC000641638359 362565998 /nfs/dbraw/zinc/56/59/98/362565998.db2.gz CXTRKCDACWKALR-NXEZZACHSA-N 1 2 224.279 2.012 20 0 BEADLO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1ccon1 ZINC000634981070 345164468 /nfs/dbraw/zinc/16/44/68/345164468.db2.gz WJRYQAPBJMFKQX-TVQRCGJNSA-N 1 2 230.267 2.286 20 0 BEADLO CCc1cc[nH+]cc1NCc1ccon1 ZINC000634985603 345165177 /nfs/dbraw/zinc/16/51/77/345165177.db2.gz YNSHWNOAEITVDU-UHFFFAOYSA-N 1 2 203.245 2.244 20 0 BEADLO COc1c(C)cccc1C[NH2+]Cc1ccon1 ZINC000634985507 345165410 /nfs/dbraw/zinc/16/54/10/345165410.db2.gz VOCJEDOJNGOIAN-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO CC[C@@H](CSC)Nc1cc(CO)cc[nH+]1 ZINC000603328803 349924321 /nfs/dbraw/zinc/92/43/21/349924321.db2.gz HFCTWUQXLSTNNT-JTQLQIEISA-N 1 2 226.345 2.127 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CCCC[C@H]2CC)[nH+]1 ZINC000635058368 345232234 /nfs/dbraw/zinc/23/22/34/345232234.db2.gz LABKJCCQKDWNHZ-GFCCVEGCSA-N 1 2 249.358 2.306 20 0 BEADLO CCCCN(CC)C(=O)Cc1[nH]cc(CC)[nH+]1 ZINC000635078504 345242863 /nfs/dbraw/zinc/24/28/63/345242863.db2.gz NWLDWTHCIDZMIW-UHFFFAOYSA-N 1 2 237.347 2.163 20 0 BEADLO Cc1cc(C)c(C[N@@H+]2CCC[C@@H]2C(=O)[O-])c(C)[nH+]1 ZINC000635014713 345218870 /nfs/dbraw/zinc/21/88/70/345218870.db2.gz DXAXTZDBNBKYEY-CYBMUJFWSA-N 1 2 248.326 2.056 20 0 BEADLO Cc1cc(C)c(C[N@H+]2CCC[C@@H]2C(=O)[O-])c(C)[nH+]1 ZINC000635014713 345218872 /nfs/dbraw/zinc/21/88/72/345218872.db2.gz DXAXTZDBNBKYEY-CYBMUJFWSA-N 1 2 248.326 2.056 20 0 BEADLO CCN(C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C1CCCC1 ZINC000635346999 345313934 /nfs/dbraw/zinc/31/39/34/345313934.db2.gz ZMJARHVYCNAZDX-VXGBXAGGSA-N 1 2 247.342 2.304 20 0 BEADLO CCN(C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C1CCCC1 ZINC000635346999 345313936 /nfs/dbraw/zinc/31/39/36/345313936.db2.gz ZMJARHVYCNAZDX-VXGBXAGGSA-N 1 2 247.342 2.304 20 0 BEADLO CCc1c[nH]c(CC(=O)N(CC)C2CCCC2)[nH+]1 ZINC000635346876 345313942 /nfs/dbraw/zinc/31/39/42/345313942.db2.gz XOFCPJMUYNMOAL-UHFFFAOYSA-N 1 2 249.358 2.306 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@@H]2CCC[C@@H](C)C2)[nH+]1 ZINC000635230078 345278893 /nfs/dbraw/zinc/27/88/93/345278893.db2.gz VQELGVFNOAMCLY-ZYHUDNBSSA-N 1 2 249.358 2.210 20 0 BEADLO CCc1c[nH]c(CC(=O)N(C)[C@@H](C)C(C)C)[nH+]1 ZINC000635233821 345281169 /nfs/dbraw/zinc/28/11/69/345281169.db2.gz BJPKXFXRCJLRKJ-JTQLQIEISA-N 1 2 237.347 2.018 20 0 BEADLO Cc1cn2ccc(C(=O)N(C)CC(C)C)cc2[nH+]1 ZINC000635247327 345282857 /nfs/dbraw/zinc/28/28/57/345282857.db2.gz QHAGKGNWKICYSU-UHFFFAOYSA-N 1 2 245.326 2.371 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)Cc1[nH]cc(CC)[nH+]1 ZINC000635277346 345293664 /nfs/dbraw/zinc/29/36/64/345293664.db2.gz GCDTXJIDMDKYJC-SNVBAGLBSA-N 1 2 237.347 2.162 20 0 BEADLO CC(C)C[C@H](C(=O)N[C@@H]1CC1(C)C)n1cc[nH+]c1 ZINC000635406986 345351333 /nfs/dbraw/zinc/35/13/33/345351333.db2.gz PRRDWCKZVCITMN-VXGBXAGGSA-N 1 2 249.358 2.385 20 0 BEADLO OCCCSCCc1[nH]c2ccccc2[nH+]1 ZINC000603335470 349926954 /nfs/dbraw/zinc/92/69/54/349926954.db2.gz SOCGYXQYOLHBJF-UHFFFAOYSA-N 1 2 236.340 2.221 20 0 BEADLO CC[C@@H]1CCCCN1C(=O)[C@@H](C)n1cc[nH+]c1 ZINC000053898613 1172060588 /nfs/dbraw/zinc/06/05/88/1172060588.db2.gz AOPTUFZYZGYKKC-VXGBXAGGSA-N 1 2 235.331 2.235 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CCC[C@@H](C)CC2)[nH+]1 ZINC000635447449 345373866 /nfs/dbraw/zinc/37/38/66/345373866.db2.gz RHTPMEVLJKNYEV-LLVKDONJSA-N 1 2 249.358 2.163 20 0 BEADLO CC(C)C[C@@H](C(=O)N1CC[C@H](C)C1)n1cc[nH+]c1 ZINC000635464809 345382946 /nfs/dbraw/zinc/38/29/46/345382946.db2.gz CPCFRZUDOLOJOY-STQMWFEESA-N 1 2 249.358 2.339 20 0 BEADLO Cc1nc(C[NH2+][C@@H](C)c2ccnn2C)cs1 ZINC000235502663 537896177 /nfs/dbraw/zinc/89/61/77/537896177.db2.gz OTGCOYDMVOZNQI-QMMMGPOBSA-N 1 2 236.344 2.036 20 0 BEADLO CCCCS(=O)(=O)N(CC)c1cc[nH+]cc1 ZINC000132375701 345329408 /nfs/dbraw/zinc/32/94/08/345329408.db2.gz CUHYRUZHALVTIS-UHFFFAOYSA-N 1 2 242.344 2.038 20 0 BEADLO CC[C@@H]([NH2+]Cc1ncn(C)n1)c1ccccc1 ZINC000134201900 345403744 /nfs/dbraw/zinc/40/37/44/345403744.db2.gz MCAWOAZLUJROBH-GFCCVEGCSA-N 1 2 230.315 2.056 20 0 BEADLO C[C@@H]1CCC[C@H](C)N1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635512417 345409301 /nfs/dbraw/zinc/40/93/01/345409301.db2.gz RIORMTVGAUMNGP-WRWGMCAJSA-N 1 2 247.342 2.303 20 0 BEADLO C[C@@H]1CCC[C@H](C)N1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635512417 345409302 /nfs/dbraw/zinc/40/93/02/345409302.db2.gz RIORMTVGAUMNGP-WRWGMCAJSA-N 1 2 247.342 2.303 20 0 BEADLO Cc1ccc([C@@H](O)CNc2cc(C)[nH+]cn2)cc1 ZINC000110203223 178867849 /nfs/dbraw/zinc/86/78/49/178867849.db2.gz JNLRCAXHURGMCB-ZDUSSCGKSA-N 1 2 243.310 2.239 20 0 BEADLO CCOCC[N@@H+]1CCc2c(F)ccc(F)c2C1 ZINC000084136888 345511279 /nfs/dbraw/zinc/51/12/79/345511279.db2.gz KRILKOQLXQCITD-UHFFFAOYSA-N 1 2 241.281 2.359 20 0 BEADLO CCOCC[N@H+]1CCc2c(F)ccc(F)c2C1 ZINC000084136888 345511281 /nfs/dbraw/zinc/51/12/81/345511281.db2.gz KRILKOQLXQCITD-UHFFFAOYSA-N 1 2 241.281 2.359 20 0 BEADLO CCc1ncnc(NC(C)(C)c2[nH]cc[nH+]2)c1F ZINC000641664502 362589500 /nfs/dbraw/zinc/58/95/00/362589500.db2.gz IMCXBSVWCBHTPR-UHFFFAOYSA-N 1 2 249.293 2.248 20 0 BEADLO C[C@@H](Nc1cc(C2CC2)ncn1)c1[nH+]ccn1C ZINC000641665315 362590297 /nfs/dbraw/zinc/59/02/97/362590297.db2.gz RSDLUVZQNXGDLD-SECBINFHSA-N 1 2 243.314 2.261 20 0 BEADLO CC1(C)CC(Nc2cc(CO)cc[nH+]2)C1 ZINC000641669640 362590401 /nfs/dbraw/zinc/59/04/01/362590401.db2.gz IYBINRVWQRZHIU-UHFFFAOYSA-N 1 2 206.289 2.174 20 0 BEADLO Fc1c[nH+]ccc1NCC[C@H]1CC1(F)F ZINC000641674342 362591104 /nfs/dbraw/zinc/59/11/04/362591104.db2.gz UBAVMFVHBRDVFD-ZETCQYMHSA-N 1 2 216.206 2.100 20 0 BEADLO Cc1nc2[nH]ccc2c(NC[C@](C)(O)C(C)C)[nH+]1 ZINC000080982564 345458088 /nfs/dbraw/zinc/45/80/88/345458088.db2.gz DRBAMJYPAAUJIB-ZDUSSCGKSA-N 1 2 248.330 2.085 20 0 BEADLO C[C@@H](CO)[C@H](C)Nc1cc[nH+]c2ccncc12 ZINC000085687883 345528916 /nfs/dbraw/zinc/52/89/16/345528916.db2.gz PVOZCMDEKXEQFT-UWVGGRQHSA-N 1 2 231.299 2.059 20 0 BEADLO CO[C@H]1CCCN(c2cc[nH+]c3ccncc32)C1 ZINC000085681963 345528924 /nfs/dbraw/zinc/52/89/24/345528924.db2.gz VOPIQTPSTABIKP-NSHDSACASA-N 1 2 243.310 2.245 20 0 BEADLO CCC(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000070243819 345549291 /nfs/dbraw/zinc/54/92/91/345549291.db2.gz AKCGMDJVGQWJJD-UHFFFAOYSA-N 1 2 215.256 2.425 20 0 BEADLO Cc1nc(NCCCn2ccnc2)c(C)c(C)[nH+]1 ZINC000091424753 345592431 /nfs/dbraw/zinc/59/24/31/345592431.db2.gz AIUWLKQTQWEOJA-UHFFFAOYSA-N 1 2 245.330 2.101 20 0 BEADLO Cc1cc(N2CCc3cc(F)ccc3C2)nc[nH+]1 ZINC000091673774 345602448 /nfs/dbraw/zinc/60/24/48/345602448.db2.gz WROFITXNFJLVPU-UHFFFAOYSA-N 1 2 243.285 2.487 20 0 BEADLO CC(=CC(=O)Nc1cc[nH+]c(C)c1)C(C)C ZINC000635550510 345609675 /nfs/dbraw/zinc/60/96/75/345609675.db2.gz GIPRQIRAKWWOCQ-UHFFFAOYSA-N 1 2 218.300 2.497 20 0 BEADLO COCC[N@H+](CC(F)F)[C@H]1CC[C@H](C)C1 ZINC000092965779 345649532 /nfs/dbraw/zinc/64/95/32/345649532.db2.gz SQDRKOYXHJLLAI-UWVGGRQHSA-N 1 2 221.291 2.389 20 0 BEADLO COCC[N@@H+](CC(F)F)[C@H]1CC[C@H](C)C1 ZINC000092965779 345649536 /nfs/dbraw/zinc/64/95/36/345649536.db2.gz SQDRKOYXHJLLAI-UWVGGRQHSA-N 1 2 221.291 2.389 20 0 BEADLO CCOc1ccn(Cc2ccc[nH+]c2C)n1 ZINC000641730098 362645270 /nfs/dbraw/zinc/64/52/70/362645270.db2.gz RAFNJADJDMKCNC-UHFFFAOYSA-N 1 2 217.272 2.034 20 0 BEADLO COc1ccsc1C[N@@H+]1CCO[C@@H](C)[C@@H]1C ZINC000093417900 345670598 /nfs/dbraw/zinc/67/05/98/345670598.db2.gz LEFQQNFFDURJHG-UWVGGRQHSA-N 1 2 241.356 2.366 20 0 BEADLO COc1ccsc1C[N@H+]1CCO[C@@H](C)[C@@H]1C ZINC000093417900 345670602 /nfs/dbraw/zinc/67/06/02/345670602.db2.gz LEFQQNFFDURJHG-UWVGGRQHSA-N 1 2 241.356 2.366 20 0 BEADLO CC(=O)c1ccc(C[NH+]2[C@@H](C)COC[C@@H]2C)cc1 ZINC000115035021 345676597 /nfs/dbraw/zinc/67/65/97/345676597.db2.gz FVMODMJEVQWWBO-RYUDHWBXSA-N 1 2 247.338 2.498 20 0 BEADLO Cc1ccc([C@H](O)C[N@@H+](C)Cc2ccon2)cc1 ZINC000266525318 178912267 /nfs/dbraw/zinc/91/22/67/178912267.db2.gz JZMVGIHVFLEXMX-CQSZACIVSA-N 1 2 246.310 2.148 20 0 BEADLO Cc1ccc([C@H](O)C[N@H+](C)Cc2ccon2)cc1 ZINC000266525318 178912268 /nfs/dbraw/zinc/91/22/68/178912268.db2.gz JZMVGIHVFLEXMX-CQSZACIVSA-N 1 2 246.310 2.148 20 0 BEADLO CCc1c[nH]c(CC(=O)NC(C)(CC)CC)[nH+]1 ZINC000635557714 345720248 /nfs/dbraw/zinc/72/02/48/345720248.db2.gz CNYRIZKKNOGRMQ-UHFFFAOYSA-N 1 2 237.347 2.210 20 0 BEADLO CC[C@H](Nc1nc(C)cc(C)n1)c1[nH]cc[nH+]1 ZINC000139826720 345803062 /nfs/dbraw/zinc/80/30/62/345803062.db2.gz AQLNVBNYLQMXRP-JTQLQIEISA-N 1 2 231.303 2.380 20 0 BEADLO CCc1c[nH]c(CC(=O)Nc2ccsc2)[nH+]1 ZINC000635577836 345857746 /nfs/dbraw/zinc/85/77/46/345857746.db2.gz RAYQILZIVORISS-UHFFFAOYSA-N 1 2 235.312 2.215 20 0 BEADLO CCc1cnc(CN[C@@H]2CCn3cc[nH+]c32)s1 ZINC000294281879 345889792 /nfs/dbraw/zinc/88/97/92/345889792.db2.gz YNOZYRXNYWLZQO-SNVBAGLBSA-N 1 2 248.355 2.137 20 0 BEADLO CCc1cnc(C[NH2+][C@@H]2CCn3ccnc32)s1 ZINC000294281879 345889796 /nfs/dbraw/zinc/88/97/96/345889796.db2.gz YNOZYRXNYWLZQO-SNVBAGLBSA-N 1 2 248.355 2.137 20 0 BEADLO COC1(CCOc2cc[nH+]cc2)CCC1 ZINC000418951980 192092429 /nfs/dbraw/zinc/09/24/29/192092429.db2.gz JJLDZSAQULHABW-UHFFFAOYSA-N 1 2 207.273 2.420 20 0 BEADLO CC[C@@H]1C[C@@H](C)CN1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635634319 345908787 /nfs/dbraw/zinc/90/87/87/345908787.db2.gz DGZFBVAFPGPYJJ-DDHJBXDOSA-N 1 2 247.342 2.160 20 0 BEADLO CC[C@@H]1C[C@@H](C)CN1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635634319 345908789 /nfs/dbraw/zinc/90/87/89/345908789.db2.gz DGZFBVAFPGPYJJ-DDHJBXDOSA-N 1 2 247.342 2.160 20 0 BEADLO CCc1[nH]c(CNC(=O)C[C@H]2C=CCCC2)c[nH+]1 ZINC001639094215 1172067810 /nfs/dbraw/zinc/06/78/10/1172067810.db2.gz WXXCQPIZQKAWCW-NSHDSACASA-N 1 2 247.342 2.335 20 0 BEADLO CCc1[nH]cc(CNC(=O)C[C@H]2C=CCCC2)[nH+]1 ZINC001639094215 1172067821 /nfs/dbraw/zinc/06/78/21/1172067821.db2.gz WXXCQPIZQKAWCW-NSHDSACASA-N 1 2 247.342 2.335 20 0 BEADLO CC[C@@](C)(C[NH2+][C@@H](C)C(=O)OC(C)(C)C)OC ZINC000322639997 345956927 /nfs/dbraw/zinc/95/69/27/345956927.db2.gz UBSNZAJVLCEXEF-GWCFXTLKSA-N 1 2 245.363 2.121 20 0 BEADLO COCCCCN(C)c1cc[nH+]c(C(C)C)n1 ZINC000419017914 192093934 /nfs/dbraw/zinc/09/39/34/192093934.db2.gz RPEPDTGDSZRDGV-UHFFFAOYSA-N 1 2 237.347 2.463 20 0 BEADLO COCCCCN(C)c1[nH+]c(C)nc2[nH]ccc21 ZINC000419020235 192094629 /nfs/dbraw/zinc/09/46/29/192094629.db2.gz WKFZAZPZLJQKMH-UHFFFAOYSA-N 1 2 248.330 2.129 20 0 BEADLO C[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C[C@H]1C ZINC000635754085 346050545 /nfs/dbraw/zinc/05/05/45/346050545.db2.gz UNYSKLUFOAEETD-DDHJBXDOSA-N 1 2 247.342 2.018 20 0 BEADLO C[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C[C@H]1C ZINC000635754085 346050549 /nfs/dbraw/zinc/05/05/49/346050549.db2.gz UNYSKLUFOAEETD-DDHJBXDOSA-N 1 2 247.342 2.018 20 0 BEADLO CCc1c[nH]c(CC(=O)N2[C@@H](C)CC[C@@H]2CC)[nH+]1 ZINC000635764514 346057234 /nfs/dbraw/zinc/05/72/34/346057234.db2.gz NGEMMKLRTANHQQ-JQWIXIFHSA-N 1 2 249.358 2.304 20 0 BEADLO CSCCNc1[nH+]c(C2CC2)nc2[nH]ccc21 ZINC000601100213 346024958 /nfs/dbraw/zinc/02/49/58/346024958.db2.gz ILLXSECEMWJAJJ-UHFFFAOYSA-N 1 2 248.355 2.032 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@H](C)CC(C)C)[nH+]1 ZINC000635722321 346030604 /nfs/dbraw/zinc/03/06/04/346030604.db2.gz GFWYRYUTWSARSD-SNVBAGLBSA-N 1 2 237.347 2.065 20 0 BEADLO CC[C@H]1[C@H](C)CCN1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635815437 346071417 /nfs/dbraw/zinc/07/14/17/346071417.db2.gz AYXMIFWIITTZNV-UZWSLXQKSA-N 1 2 247.342 2.160 20 0 BEADLO CC[C@H]1[C@H](C)CCN1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635815437 346071419 /nfs/dbraw/zinc/07/14/19/346071419.db2.gz AYXMIFWIITTZNV-UZWSLXQKSA-N 1 2 247.342 2.160 20 0 BEADLO CC(C)C[C@@H](C(=O)N1CC(C)(C)C1)n1cc[nH+]c1 ZINC000635873082 346094279 /nfs/dbraw/zinc/09/42/79/346094279.db2.gz UIJHVUFZUUZMTR-LBPRGKRZSA-N 1 2 249.358 2.339 20 0 BEADLO CC(C)C[C@H](C(=O)N1[C@@H](C)C[C@@H]1C)n1cc[nH+]c1 ZINC000635876004 346095855 /nfs/dbraw/zinc/09/58/55/346095855.db2.gz SLOYKRHAFSLZGX-RWMBFGLXSA-N 1 2 249.358 2.480 20 0 BEADLO CC(=O)c1ccc(NC(=O)[C@@H](C)[NH+](C)C)cc1C ZINC000635942054 346125307 /nfs/dbraw/zinc/12/53/07/346125307.db2.gz PNRFSMFYWGOABG-SNVBAGLBSA-N 1 2 248.326 2.086 20 0 BEADLO CC[C@H]1CCN1C(=O)c1ccn2cc(C)[nH+]c2c1 ZINC000635957057 346131614 /nfs/dbraw/zinc/13/16/14/346131614.db2.gz DFQPLSBIYCJHBC-LBPRGKRZSA-N 1 2 243.310 2.267 20 0 BEADLO CCc1c[nH]c(CC(=O)NCC2=CCCCC2)[nH+]1 ZINC000635983798 346137338 /nfs/dbraw/zinc/13/73/38/346137338.db2.gz AWEXBKKMUFGRQQ-UHFFFAOYSA-N 1 2 247.342 2.131 20 0 BEADLO C[C@@H]1[C@@H](C)[C@H](C)CN1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636033467 346169264 /nfs/dbraw/zinc/16/92/64/346169264.db2.gz BQXAAQPCEFRWLO-IYKVGLELSA-N 1 2 247.342 2.016 20 0 BEADLO C[C@@H]1[C@@H](C)[C@H](C)CN1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636033467 346169266 /nfs/dbraw/zinc/16/92/66/346169266.db2.gz BQXAAQPCEFRWLO-IYKVGLELSA-N 1 2 247.342 2.016 20 0 BEADLO CCC1CN(C(=O)[C@@H](CC(C)C)n2cc[nH+]c2)C1 ZINC000636014263 346155354 /nfs/dbraw/zinc/15/53/54/346155354.db2.gz FTQPXMZZMJMFAZ-CYBMUJFWSA-N 1 2 249.358 2.339 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636018970 346157877 /nfs/dbraw/zinc/15/78/77/346157877.db2.gz QIDMJTBPQWXKEU-FTUHBYGFSA-N 1 2 247.342 2.064 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636018970 346157878 /nfs/dbraw/zinc/15/78/78/346157878.db2.gz QIDMJTBPQWXKEU-FTUHBYGFSA-N 1 2 247.342 2.064 20 0 BEADLO Cc1c[nH]c(CN2CCc3c2cccc3F)[nH+]1 ZINC000628239440 346200394 /nfs/dbraw/zinc/20/03/94/346200394.db2.gz QOWIAVRIPSRACW-UHFFFAOYSA-N 1 2 231.274 2.420 20 0 BEADLO Cc1[nH]c(CN2C[C@H](C)O[C@H](C)[C@H]2C)[nH+]c1C ZINC000628244682 346209035 /nfs/dbraw/zinc/20/90/35/346209035.db2.gz RSPLSDAMPUVPHY-XXILOJSOSA-N 1 2 237.347 2.024 20 0 BEADLO Cc1ncc(C[NH2+]Cc2ccc(Cl)cn2)o1 ZINC000628232207 346184837 /nfs/dbraw/zinc/18/48/37/346184837.db2.gz PYQAJXDZURKOIP-UHFFFAOYSA-N 1 2 237.690 2.321 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2ccncc2)o1 ZINC000628237346 346193446 /nfs/dbraw/zinc/19/34/46/346193446.db2.gz KLEKDXYXRDZUKP-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2ccncc2)o1 ZINC000628237346 346193448 /nfs/dbraw/zinc/19/34/48/346193448.db2.gz KLEKDXYXRDZUKP-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1nn(C)cc1[C@@H](C)Nc1cc(C)[nH+]cn1 ZINC000603390221 349943152 /nfs/dbraw/zinc/94/31/52/349943152.db2.gz FGPITXOEYMPQQG-SECBINFHSA-N 1 2 231.303 2.000 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2ccc(C)cn2)o1 ZINC000628249375 346218522 /nfs/dbraw/zinc/21/85/22/346218522.db2.gz AYQTZVKCYLHLCG-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2ccc(C)cn2)o1 ZINC000628249375 346218524 /nfs/dbraw/zinc/21/85/24/346218524.db2.gz AYQTZVKCYLHLCG-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CC(C)C[C@H](C(=O)N[C@@H]1CC12CC2)n1cc[nH+]c1 ZINC000636056204 346302905 /nfs/dbraw/zinc/30/29/05/346302905.db2.gz KHHFRYNJYVPTLC-VXGBXAGGSA-N 1 2 247.342 2.139 20 0 BEADLO CC(=O)c1cc(NC(=O)[C@@H](C)[NH+](C)C)ccc1C ZINC000636138900 346331019 /nfs/dbraw/zinc/33/10/19/346331019.db2.gz AYYZGHGFWPLCFP-SNVBAGLBSA-N 1 2 248.326 2.086 20 0 BEADLO CCCN(C(=O)Cc1[nH]cc(CC)[nH+]1)C(C)C ZINC000636146653 346333497 /nfs/dbraw/zinc/33/34/97/346333497.db2.gz RUYNBFWGPFTGNV-UHFFFAOYSA-N 1 2 237.347 2.162 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2nccs2)C[C@@H]1F ZINC000679218168 488315246 /nfs/dbraw/zinc/31/52/46/488315246.db2.gz CEZJPICTZSJVNM-IUCAKERBSA-N 1 2 214.309 2.323 20 0 BEADLO Cc1cccc(CCC[NH2+][C@]2(C)CCOC2=O)c1 ZINC000289464350 179056030 /nfs/dbraw/zinc/05/60/30/179056030.db2.gz GVCBRCKWEIDZGB-OAHLLOKOSA-N 1 2 247.338 2.223 20 0 BEADLO CCc1c[nH]c(CC(=O)N(CC)[C@H](C)CC)[nH+]1 ZINC000636157081 346339105 /nfs/dbraw/zinc/33/91/05/346339105.db2.gz ZMQZNGQJPBGUEE-SNVBAGLBSA-N 1 2 237.347 2.162 20 0 BEADLO CCc1c[nH]c(CC(=O)N(CC)[C@@H](C)CC)[nH+]1 ZINC000636157080 346339117 /nfs/dbraw/zinc/33/91/17/346339117.db2.gz ZMQZNGQJPBGUEE-JTQLQIEISA-N 1 2 237.347 2.162 20 0 BEADLO C=C/C=C\CC(=O)NCc1c[nH+]c(C)cc1C ZINC001639155614 1172080984 /nfs/dbraw/zinc/08/09/84/1172080984.db2.gz YUPGXBYRGFRWRC-WAYWQWQTSA-N 1 2 230.311 2.447 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2cnn(C)n2)c1C ZINC000298422537 179068380 /nfs/dbraw/zinc/06/83/80/179068380.db2.gz XVGJOVBYBZFELL-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2cnn(C)n2)c1C ZINC000298422537 179068381 /nfs/dbraw/zinc/06/83/81/179068381.db2.gz XVGJOVBYBZFELL-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cccc(C[N@H+](C2CC2)C2COC2)c1F ZINC000296156516 179071598 /nfs/dbraw/zinc/07/15/98/179071598.db2.gz WGWRRVPVYWKVBG-UHFFFAOYSA-N 1 2 235.302 2.497 20 0 BEADLO Cc1cccc(C[N@@H+](C2CC2)C2COC2)c1F ZINC000296156516 179071600 /nfs/dbraw/zinc/07/16/00/179071600.db2.gz WGWRRVPVYWKVBG-UHFFFAOYSA-N 1 2 235.302 2.497 20 0 BEADLO COc1cc([C@@H](C)[NH2+][C@@H](C)C(F)F)ccn1 ZINC000641792467 362727360 /nfs/dbraw/zinc/72/73/60/362727360.db2.gz VUXDNCGOSMFGHM-SFYZADRCSA-N 1 2 230.258 2.394 20 0 BEADLO Cc1ccc2[nH+]c(CN[C@@H](C)C(F)F)cn2c1 ZINC000641794220 362734670 /nfs/dbraw/zinc/73/46/70/362734670.db2.gz SHZTVCYZABLAKG-VIFPVBQESA-N 1 2 239.269 2.386 20 0 BEADLO Cc1cccc(C[NH2+][C@H](C)c2ncnn2C)c1F ZINC000296758384 179099362 /nfs/dbraw/zinc/09/93/62/179099362.db2.gz KSSFKEBLCWESJK-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO Cc1cc(CNC(=O)N2CCC2(C)C)cc(C)[nH+]1 ZINC000580062139 346501490 /nfs/dbraw/zinc/50/14/90/346501490.db2.gz GESHTCAKXYLOMO-UHFFFAOYSA-N 1 2 247.342 2.392 20 0 BEADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1nnc(C)o1 ZINC000162538525 346527064 /nfs/dbraw/zinc/52/70/64/346527064.db2.gz HYNHHXZUJNKPSY-LBPRGKRZSA-N 1 2 246.314 2.356 20 0 BEADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1nnc(C)o1 ZINC000162538525 346527066 /nfs/dbraw/zinc/52/70/66/346527066.db2.gz HYNHHXZUJNKPSY-LBPRGKRZSA-N 1 2 246.314 2.356 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C=Cc1ccccc1 ZINC000380195377 346571873 /nfs/dbraw/zinc/57/18/73/346571873.db2.gz YWOKLUJNSZCITC-BQYQJAHWSA-N 1 2 241.294 2.048 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N(C)C[C@@H]1CC1(C)C ZINC000621043577 346585699 /nfs/dbraw/zinc/58/56/99/346585699.db2.gz FANJCYDRCVCDPI-QWRGUYRKSA-N 1 2 249.358 2.093 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N(C)C[C@@H]1CC1(C)C ZINC000621043577 346585701 /nfs/dbraw/zinc/58/57/01/346585701.db2.gz FANJCYDRCVCDPI-QWRGUYRKSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@H](C)NC(=O)C[N@H+](CC)Cc1ccoc1 ZINC000588169226 346644983 /nfs/dbraw/zinc/64/49/83/346644983.db2.gz IHLUINHBGGMWIO-NSHDSACASA-N 1 2 238.331 2.016 20 0 BEADLO CC[C@H](C)NC(=O)C[N@@H+](CC)Cc1ccoc1 ZINC000588169226 346644984 /nfs/dbraw/zinc/64/49/84/346644984.db2.gz IHLUINHBGGMWIO-NSHDSACASA-N 1 2 238.331 2.016 20 0 BEADLO CSCCNC(=O)Nc1c(C)cc[nH+]c1C ZINC000588300785 346660115 /nfs/dbraw/zinc/66/01/15/346660115.db2.gz AESQEPQALOVJGL-UHFFFAOYSA-N 1 2 239.344 2.183 20 0 BEADLO COc1ccc[nH+]c1N1CCC(SC)CC1 ZINC000601206007 346667459 /nfs/dbraw/zinc/66/74/59/346667459.db2.gz LUXCSHUHTINJBW-UHFFFAOYSA-N 1 2 238.356 2.422 20 0 BEADLO Cn1c[nH+]cc1CC(=O)Nc1cccc(Cl)c1 ZINC000188035603 346705711 /nfs/dbraw/zinc/70/57/11/346705711.db2.gz NAKQJHDNVJPETI-UHFFFAOYSA-N 1 2 249.701 2.255 20 0 BEADLO CC[N@@H+](Cc1cscn1)C[C@@H]1CCCO1 ZINC000171065259 346806335 /nfs/dbraw/zinc/80/63/35/346806335.db2.gz HGIQKJFNSSLGNC-NSHDSACASA-N 1 2 226.345 2.144 20 0 BEADLO CC[N@H+](Cc1cscn1)C[C@@H]1CCCO1 ZINC000171065259 346806338 /nfs/dbraw/zinc/80/63/38/346806338.db2.gz HGIQKJFNSSLGNC-NSHDSACASA-N 1 2 226.345 2.144 20 0 BEADLO Cc1cccc([C@@H](C)[NH2+]Cc2cn[nH]n2)c1C ZINC000284183073 179183211 /nfs/dbraw/zinc/18/32/11/179183211.db2.gz XWYXPQTUFYCOQA-LLVKDONJSA-N 1 2 230.315 2.272 20 0 BEADLO COCC1(Nc2cc[nH+]c(C(C)C)n2)CC1 ZINC000309973200 347208176 /nfs/dbraw/zinc/20/81/76/347208176.db2.gz QTRDQMNEPFDGIG-UHFFFAOYSA-N 1 2 221.304 2.191 20 0 BEADLO CCc1nc(C(C)(C)[NH2+]CC=C(C)C)no1 ZINC000309974738 347209331 /nfs/dbraw/zinc/20/93/31/347209331.db2.gz RVPFAKKRXIATFT-UHFFFAOYSA-N 1 2 223.320 2.423 20 0 BEADLO C[C@@H]([NH2+]CC(C)(F)F)c1cccnc1 ZINC000382195239 347227273 /nfs/dbraw/zinc/22/72/73/347227273.db2.gz CXHVDPHFDYANIY-MRVPVSSYSA-N 1 2 200.232 2.387 20 0 BEADLO CC(C)[N@H+](Cc1cnc(C2CC2)o1)C1COC1 ZINC000628296963 347243450 /nfs/dbraw/zinc/24/34/50/347243450.db2.gz DZJZYHMWFBMCQX-UHFFFAOYSA-N 1 2 236.315 2.161 20 0 BEADLO CC(C)[N@@H+](Cc1cnc(C2CC2)o1)C1COC1 ZINC000628296963 347243451 /nfs/dbraw/zinc/24/34/51/347243451.db2.gz DZJZYHMWFBMCQX-UHFFFAOYSA-N 1 2 236.315 2.161 20 0 BEADLO Cc1cccc([C@H](C)[NH2+]Cc2cn[nH]n2)c1C ZINC000284183077 179195979 /nfs/dbraw/zinc/19/59/79/179195979.db2.gz XWYXPQTUFYCOQA-NSHDSACASA-N 1 2 230.315 2.272 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627372829 347255860 /nfs/dbraw/zinc/25/58/60/347255860.db2.gz XWRYOGNQTCSCMA-GHMZBOCLSA-N 1 2 247.342 2.121 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627372829 347255866 /nfs/dbraw/zinc/25/58/66/347255866.db2.gz XWRYOGNQTCSCMA-GHMZBOCLSA-N 1 2 247.342 2.121 20 0 BEADLO CO[C@H]([C@@H](C)Nc1cc(C)[nH+]cn1)C1CC1 ZINC000388259926 347274241 /nfs/dbraw/zinc/27/42/41/347274241.db2.gz CPUBNRSNDCLEOZ-BXKDBHETSA-N 1 2 221.304 2.010 20 0 BEADLO CO[C@H]([C@H](C)Nc1cccc[nH+]1)C1CC1 ZINC000388268653 347279734 /nfs/dbraw/zinc/27/97/34/347279734.db2.gz GIFLFTNCMGKECM-JOYOIKCWSA-N 1 2 206.289 2.307 20 0 BEADLO CCCC[C@H](C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000300907388 347280457 /nfs/dbraw/zinc/28/04/57/347280457.db2.gz JPTDJBUIPVXWLT-JTQLQIEISA-N 1 2 223.320 2.194 20 0 BEADLO C[C@@H]1CCC[C@]1(C)C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627373475 347373511 /nfs/dbraw/zinc/37/35/11/347373511.db2.gz SIGWDTXVEHAUNH-YGRLFVJLSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@@H]1CCC[C@]1(C)C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627373475 347373513 /nfs/dbraw/zinc/37/35/13/347373513.db2.gz SIGWDTXVEHAUNH-YGRLFVJLSA-N 1 2 247.342 2.121 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)[C@H]1C[C@H]1C1CCCC1 ZINC000616921246 347450228 /nfs/dbraw/zinc/45/02/28/347450228.db2.gz KOLRHURPQTVOOH-STQMWFEESA-N 1 2 247.342 2.194 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)[C@H]1C[C@H]1C1CCCC1 ZINC000616921246 347450230 /nfs/dbraw/zinc/45/02/30/347450230.db2.gz KOLRHURPQTVOOH-STQMWFEESA-N 1 2 247.342 2.194 20 0 BEADLO CCc1ccsc1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616924656 347455522 /nfs/dbraw/zinc/45/55/22/347455522.db2.gz QZTRKRGESODKRW-UHFFFAOYSA-N 1 2 249.339 2.306 20 0 BEADLO CCc1ccsc1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616924656 347455525 /nfs/dbraw/zinc/45/55/25/347455525.db2.gz QZTRKRGESODKRW-UHFFFAOYSA-N 1 2 249.339 2.306 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)C1CCCCCC1 ZINC000616924794 347456530 /nfs/dbraw/zinc/45/65/30/347456530.db2.gz WIAWJFPBSKLDRG-UHFFFAOYSA-N 1 2 235.331 2.339 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)C1CCCCCC1 ZINC000616924794 347456532 /nfs/dbraw/zinc/45/65/32/347456532.db2.gz WIAWJFPBSKLDRG-UHFFFAOYSA-N 1 2 235.331 2.339 20 0 BEADLO C[C@H]1CCC[C@@H](C(=O)N(C)Cc2c[nH+]c[nH]2)C1 ZINC000616925599 347456895 /nfs/dbraw/zinc/45/68/95/347456895.db2.gz LABNVZPSQLGYGG-WDEREUQCSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@H]1CCC[C@@H](C(=O)N(C)Cc2c[nH]c[nH+]2)C1 ZINC000616925599 347456897 /nfs/dbraw/zinc/45/68/97/347456897.db2.gz LABNVZPSQLGYGG-WDEREUQCSA-N 1 2 235.331 2.194 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)CC1=CCCCC1 ZINC000616925661 347457128 /nfs/dbraw/zinc/45/71/28/347457128.db2.gz MLLJGOVXMYXYQV-UHFFFAOYSA-N 1 2 233.315 2.259 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)CC1=CCCCC1 ZINC000616925661 347457131 /nfs/dbraw/zinc/45/71/31/347457131.db2.gz MLLJGOVXMYXYQV-UHFFFAOYSA-N 1 2 233.315 2.259 20 0 BEADLO Cc1cccc2[nH+]c(C[S@](=O)CC3CC3)cn21 ZINC000360915541 179229479 /nfs/dbraw/zinc/22/94/79/179229479.db2.gz YLWJHNGRZZHOOB-QGZVFWFLSA-N 1 2 248.351 2.301 20 0 BEADLO CC(C)CCCC(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616928466 347494592 /nfs/dbraw/zinc/49/45/92/347494592.db2.gz AIPCFKBHLSEXIG-UHFFFAOYSA-N 1 2 223.320 2.194 20 0 BEADLO CC(C)CCCC(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616928466 347494594 /nfs/dbraw/zinc/49/45/94/347494594.db2.gz AIPCFKBHLSEXIG-UHFFFAOYSA-N 1 2 223.320 2.194 20 0 BEADLO CCCc1occc1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616928627 347494730 /nfs/dbraw/zinc/49/47/30/347494730.db2.gz HFSDCDLZTYLHQD-UHFFFAOYSA-N 1 2 247.298 2.227 20 0 BEADLO CCCc1occc1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616928627 347494732 /nfs/dbraw/zinc/49/47/32/347494732.db2.gz HFSDCDLZTYLHQD-UHFFFAOYSA-N 1 2 247.298 2.227 20 0 BEADLO CC[C@H]1CCC[C@H]1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616929022 347495961 /nfs/dbraw/zinc/49/59/61/347495961.db2.gz RGCZGFMGAZNRAM-CMPLNLGQSA-N 1 2 235.331 2.194 20 0 BEADLO CC[C@H]1CCC[C@H]1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616929022 347495963 /nfs/dbraw/zinc/49/59/63/347495963.db2.gz RGCZGFMGAZNRAM-CMPLNLGQSA-N 1 2 235.331 2.194 20 0 BEADLO CC(C)CC(C)(C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616926726 347458542 /nfs/dbraw/zinc/45/85/42/347458542.db2.gz NOJQTERMYHRTEO-UHFFFAOYSA-N 1 2 237.347 2.440 20 0 BEADLO CC(C)CC(C)(C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616926726 347458546 /nfs/dbraw/zinc/45/85/46/347458546.db2.gz NOJQTERMYHRTEO-UHFFFAOYSA-N 1 2 237.347 2.440 20 0 BEADLO C[C@H]1CCC[C@H]1CC(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616927403 347459325 /nfs/dbraw/zinc/45/93/25/347459325.db2.gz IFFCTFKUGGATRA-QWRGUYRKSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@H]1CCC[C@H]1CC(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616927403 347459327 /nfs/dbraw/zinc/45/93/27/347459327.db2.gz IFFCTFKUGGATRA-QWRGUYRKSA-N 1 2 235.331 2.194 20 0 BEADLO CC[C@H](C)N(CC)C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000616973859 347544686 /nfs/dbraw/zinc/54/46/86/347544686.db2.gz FCANZJBJJQZNSR-MNOVXSKESA-N 1 2 237.347 2.235 20 0 BEADLO CC[C@H](C)N(CC)C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000616973859 347544690 /nfs/dbraw/zinc/54/46/90/347544690.db2.gz FCANZJBJJQZNSR-MNOVXSKESA-N 1 2 237.347 2.235 20 0 BEADLO C[C@H](N[C@@H]1CCn2cc[nH+]c21)c1cscn1 ZINC000577231196 365892917 /nfs/dbraw/zinc/89/29/17/365892917.db2.gz FSYPGHWYEWZVQG-DTWKUNHWSA-N 1 2 234.328 2.135 20 0 BEADLO C[C@@H](N[C@H]1CCn2cc[nH+]c21)c1cscn1 ZINC000577231194 365893182 /nfs/dbraw/zinc/89/31/82/365893182.db2.gz FSYPGHWYEWZVQG-BDAKNGLRSA-N 1 2 234.328 2.135 20 0 BEADLO Cc1cc(C(=O)NCc2[nH+]ccn2C)c(C)s1 ZINC000590738168 347502375 /nfs/dbraw/zinc/50/23/75/347502375.db2.gz YSXNKYDZLOLBSG-UHFFFAOYSA-N 1 2 249.339 2.028 20 0 BEADLO Cc1ccccc1CCC[NH2+][C@@]1(C)CCOC1=O ZINC000289404075 179262574 /nfs/dbraw/zinc/26/25/74/179262574.db2.gz AHTCVYPXIIMFSY-HNNXBMFYSA-N 1 2 247.338 2.223 20 0 BEADLO Cc1[nH]c(C(=O)NCc2cc(C)cc(C)c2)c[nH+]1 ZINC000618160646 347624350 /nfs/dbraw/zinc/62/43/50/347624350.db2.gz LHMFKEUJIFCPBH-UHFFFAOYSA-N 1 2 243.310 2.265 20 0 BEADLO Cc1ccccc1C[N@H+](C)Cc1cnc[nH]1 ZINC000280571047 179270004 /nfs/dbraw/zinc/27/00/04/179270004.db2.gz WBMVCQYFIJUAOR-UHFFFAOYSA-N 1 2 215.300 2.350 20 0 BEADLO Cc1ccccc1C[N@@H+](C)Cc1cnc[nH]1 ZINC000280571047 179270005 /nfs/dbraw/zinc/27/00/05/179270005.db2.gz WBMVCQYFIJUAOR-UHFFFAOYSA-N 1 2 215.300 2.350 20 0 BEADLO C[N@H+](CC(=O)OC(C)(C)C)CC1=CCCC1 ZINC000592066747 347726875 /nfs/dbraw/zinc/72/68/75/347726875.db2.gz NWHLJFUZKKDLHA-UHFFFAOYSA-N 1 2 225.332 2.370 20 0 BEADLO C[N@@H+](CC(=O)OC(C)(C)C)CC1=CCCC1 ZINC000592066747 347726878 /nfs/dbraw/zinc/72/68/78/347726878.db2.gz NWHLJFUZKKDLHA-UHFFFAOYSA-N 1 2 225.332 2.370 20 0 BEADLO COC(=O)C1([NH2+]CC2=CCCC2)CCCC1 ZINC000592087212 347730634 /nfs/dbraw/zinc/73/06/34/347730634.db2.gz WUIQVIIXQLLHTG-UHFFFAOYSA-N 1 2 223.316 2.172 20 0 BEADLO CC[N@H+](CCSC)Cc1nc(C2CC2)no1 ZINC000592199955 347751641 /nfs/dbraw/zinc/75/16/41/347751641.db2.gz TXLQALQRSUWQSC-UHFFFAOYSA-N 1 2 241.360 2.132 20 0 BEADLO CC[N@@H+](CCSC)Cc1nc(C2CC2)no1 ZINC000592199955 347751646 /nfs/dbraw/zinc/75/16/46/347751646.db2.gz TXLQALQRSUWQSC-UHFFFAOYSA-N 1 2 241.360 2.132 20 0 BEADLO CC[N@H+](CCSC)[C@H](C)c1csnn1 ZINC000592201221 347752745 /nfs/dbraw/zinc/75/27/45/347752745.db2.gz DBBYKZJNZZACDO-MRVPVSSYSA-N 1 2 231.390 2.284 20 0 BEADLO CC[N@@H+](CCSC)[C@H](C)c1csnn1 ZINC000592201221 347752747 /nfs/dbraw/zinc/75/27/47/347752747.db2.gz DBBYKZJNZZACDO-MRVPVSSYSA-N 1 2 231.390 2.284 20 0 BEADLO CC[N@H+](CCSC)Cc1nnc(C2CC2)o1 ZINC000592202631 347754684 /nfs/dbraw/zinc/75/46/84/347754684.db2.gz LHPPPYMWARJOLN-UHFFFAOYSA-N 1 2 241.360 2.132 20 0 BEADLO CC[N@@H+](CCSC)Cc1nnc(C2CC2)o1 ZINC000592202631 347754686 /nfs/dbraw/zinc/75/46/86/347754686.db2.gz LHPPPYMWARJOLN-UHFFFAOYSA-N 1 2 241.360 2.132 20 0 BEADLO CC[N@H+](CCSC)Cc1nnc(C)s1 ZINC000592204359 347755869 /nfs/dbraw/zinc/75/58/69/347755869.db2.gz RBTYVRDMTIDNTG-UHFFFAOYSA-N 1 2 231.390 2.031 20 0 BEADLO CC[N@@H+](CCSC)Cc1nnc(C)s1 ZINC000592204359 347755871 /nfs/dbraw/zinc/75/58/71/347755871.db2.gz RBTYVRDMTIDNTG-UHFFFAOYSA-N 1 2 231.390 2.031 20 0 BEADLO CC[C@H](C)C[C@@H]([NH2+][C@@H]1CCSC1)C(=O)OC ZINC000592517606 347794388 /nfs/dbraw/zinc/79/43/88/347794388.db2.gz WOVSNKWDSMWAOY-HBNTYKKESA-N 1 2 245.388 2.059 20 0 BEADLO Cc1ccccc1C[C@H](C)[NH2+]CC(F)(F)CO ZINC000184696848 179291479 /nfs/dbraw/zinc/29/14/79/179291479.db2.gz KPMPQQCAZQMNFY-NSHDSACASA-N 1 2 243.297 2.143 20 0 BEADLO CCC(C)(CC)NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000577294895 365920503 /nfs/dbraw/zinc/92/05/03/365920503.db2.gz PIOBGCSJDQYGAC-JTQLQIEISA-N 1 2 237.347 2.283 20 0 BEADLO CCC(C)(CC)NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000577294895 365920510 /nfs/dbraw/zinc/92/05/10/365920510.db2.gz PIOBGCSJDQYGAC-JTQLQIEISA-N 1 2 237.347 2.283 20 0 BEADLO CCn1ccnc1[C@H](C)[NH2+]Cc1cnc(C)o1 ZINC000628300089 347847525 /nfs/dbraw/zinc/84/75/25/347847525.db2.gz OBLXLPYNZBNBLO-VIFPVBQESA-N 1 2 234.303 2.050 20 0 BEADLO CCn1ccnc1[C@H](C)[NH2+]Cc1oc(C)nc1C ZINC000628300209 347883178 /nfs/dbraw/zinc/88/31/78/347883178.db2.gz VCFGDJMHAZUGBL-JTQLQIEISA-N 1 2 248.330 2.359 20 0 BEADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1oc(C)nc1C ZINC000628300210 347883281 /nfs/dbraw/zinc/88/32/81/347883281.db2.gz VCFGDJMHAZUGBL-SNVBAGLBSA-N 1 2 248.330 2.359 20 0 BEADLO Cc1ccccc1[C@@H](C)[N@H+](C)Cc1nnc[nH]1 ZINC000178490643 179317669 /nfs/dbraw/zinc/31/76/69/179317669.db2.gz LRLJVWYGZBYVHF-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO Cc1ccccc1[C@@H](C)[N@@H+](C)Cc1nnc[nH]1 ZINC000178490643 179317672 /nfs/dbraw/zinc/31/76/72/179317672.db2.gz LRLJVWYGZBYVHF-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CC[C@H](CC2CC2)C1 ZINC000493600208 347924877 /nfs/dbraw/zinc/92/48/77/347924877.db2.gz WUOSLCDBZYOJHY-VSQXVHSFSA-N 1 2 245.326 2.072 20 0 BEADLO Cc1ccccc1[C@H](C)[N@@H+]1CCn2cnnc2C1 ZINC000137158160 179336104 /nfs/dbraw/zinc/33/61/04/179336104.db2.gz SYIRSMILFUDRAA-LBPRGKRZSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1ccccc1[C@H](C)[N@H+]1CCn2cnnc2C1 ZINC000137158160 179336107 /nfs/dbraw/zinc/33/61/07/179336107.db2.gz SYIRSMILFUDRAA-LBPRGKRZSA-N 1 2 242.326 2.163 20 0 BEADLO C[C@H]([NH2+][C@H](C(N)=O)c1ccccc1)c1ccco1 ZINC000120492371 187385221 /nfs/dbraw/zinc/38/52/21/187385221.db2.gz RPMKUSOHPMQKNU-GWCFXTLKSA-N 1 2 244.294 2.157 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccc2occc2c1)C(=O)OC ZINC000594714098 348104811 /nfs/dbraw/zinc/10/48/11/348104811.db2.gz XNNYJGSCKMSESO-GFCCVEGCSA-N 1 2 247.294 2.474 20 0 BEADLO Cc1cccn2cc(CC(=O)N(C)C(C)C)[nH+]c12 ZINC000336381586 179357153 /nfs/dbraw/zinc/35/71/53/179357153.db2.gz ANSAMPRNEVDXDI-UHFFFAOYSA-N 1 2 245.326 2.052 20 0 BEADLO CC[C@H]([NH2+]C[C@H](C)COC)C(F)(F)F ZINC000308582481 323175938 /nfs/dbraw/zinc/17/59/38/323175938.db2.gz HCDSRWHEJYNKST-YUMQZZPRSA-N 1 2 213.243 2.199 20 0 BEADLO COC(=O)[C@@H]1C[C@H]1[C@H](C)Nc1ccc(C)[nH+]c1C ZINC000594949462 348147171 /nfs/dbraw/zinc/14/71/71/348147171.db2.gz DUKSRQQTZMRXSD-ZMLRMANQSA-N 1 2 248.326 2.308 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(N)c(Cl)c1 ZINC000203801195 348219950 /nfs/dbraw/zinc/21/99/50/348219950.db2.gz LXQHTFFWNFQBIU-UHFFFAOYSA-N 1 2 207.664 2.323 20 0 BEADLO Cc1cccnc1C(C)(C)C[NH2+]Cc1ccn[nH]1 ZINC000353094904 179366562 /nfs/dbraw/zinc/36/65/62/179366562.db2.gz OKQXWMATVKBYGR-UHFFFAOYSA-N 1 2 244.342 2.181 20 0 BEADLO Cc1ccc[nH+]c1CCCNc1cnccn1 ZINC000295076958 179368296 /nfs/dbraw/zinc/36/82/96/179368296.db2.gz XEBVKHLIZZJSQK-UHFFFAOYSA-N 1 2 228.299 2.225 20 0 BEADLO CO[C@@H](CC(C)C)C[N@@H+]1CCC(F)(F)C1 ZINC000419256444 192115816 /nfs/dbraw/zinc/11/58/16/192115816.db2.gz XJQSWHKYOQJXGM-JTQLQIEISA-N 1 2 221.291 2.389 20 0 BEADLO CO[C@@H](CC(C)C)C[N@H+]1CCC(F)(F)C1 ZINC000419256444 192115817 /nfs/dbraw/zinc/11/58/17/192115817.db2.gz XJQSWHKYOQJXGM-JTQLQIEISA-N 1 2 221.291 2.389 20 0 BEADLO Cc1cccnc1C[NH2+][C@@H](CCO)c1ccco1 ZINC000185074977 179381497 /nfs/dbraw/zinc/38/14/97/179381497.db2.gz PTTOEOMGOLTXKA-LBPRGKRZSA-N 1 2 246.310 2.196 20 0 BEADLO CN(C)c1ccc(NCC2(C)CC2)[nH+]c1 ZINC000308941307 323182073 /nfs/dbraw/zinc/18/20/73/323182073.db2.gz MHKIOQFIVAHRFI-UHFFFAOYSA-N 1 2 205.305 2.360 20 0 BEADLO Cc1cccnc1SCc1c[nH+]cn1C ZINC000286543567 179397689 /nfs/dbraw/zinc/39/76/89/179397689.db2.gz OUTSTOUKLDTLCF-UHFFFAOYSA-N 1 2 219.313 2.416 20 0 BEADLO CC/C=C/CC[NH2+][C@@](C)(CCF)C(=O)OC ZINC000595776572 348338716 /nfs/dbraw/zinc/33/87/16/348338716.db2.gz TZHJONAKRFBXPT-FYJFLYSWSA-N 1 2 231.311 2.224 20 0 BEADLO CCOC(=O)[C@H](CC)[NH2+]C1(CC(C)C)CC1 ZINC000595829946 348364808 /nfs/dbraw/zinc/36/48/08/348364808.db2.gz BEJPFYSHOZOGHT-NSHDSACASA-N 1 2 227.348 2.496 20 0 BEADLO CCC[C@H]([NH2+][C@@H]1C[C@H]1C(C)C)C(=O)OCC ZINC000419329162 192129572 /nfs/dbraw/zinc/12/95/72/192129572.db2.gz OPUSIMSGSXGZPS-SDDRHHMPSA-N 1 2 227.348 2.352 20 0 BEADLO COC(=O)Cc1cc[nH+]c(NC2CCCC2)c1 ZINC000596055124 348433810 /nfs/dbraw/zinc/43/38/10/348433810.db2.gz FJLNFYPBFVLCCL-UHFFFAOYSA-N 1 2 234.299 2.152 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@H](C)C2CC2)c1 ZINC000596070458 348437210 /nfs/dbraw/zinc/43/72/10/348437210.db2.gz DFSDICKRFNUDNX-SECBINFHSA-N 1 2 234.299 2.008 20 0 BEADLO c1cn(CCSCCC2CCOCC2)c[nH+]1 ZINC000419473530 192139048 /nfs/dbraw/zinc/13/90/48/192139048.db2.gz DJEBOKJPVCJEJY-UHFFFAOYSA-N 1 2 240.372 2.433 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N2C[C@@H](C)C[C@H]2C)c1 ZINC000596135722 348447680 /nfs/dbraw/zinc/44/76/80/348447680.db2.gz KONAETDSASDBJX-WDEREUQCSA-N 1 2 248.326 2.032 20 0 BEADLO CCC1(CNc2cc(CC(=O)OC)cc[nH+]2)CC1 ZINC000596152633 348453380 /nfs/dbraw/zinc/45/33/80/348453380.db2.gz JXTZTAFPDKRFTR-UHFFFAOYSA-N 1 2 248.326 2.399 20 0 BEADLO CCCN(c1cc(CC(=O)OC)cc[nH+]1)C1CC1 ZINC000596185612 348455924 /nfs/dbraw/zinc/45/59/24/348455924.db2.gz OEXXFECLTZAFHM-UHFFFAOYSA-N 1 2 248.326 2.176 20 0 BEADLO Cc1ccnc(NCc2[nH+]ccn2C)c1Cl ZINC000335599986 179452172 /nfs/dbraw/zinc/45/21/72/179452172.db2.gz GKAXAFIOEGVZED-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO COc1cc(CSCCn2cc[nH+]c2)ccn1 ZINC000419641657 192143788 /nfs/dbraw/zinc/14/37/88/192143788.db2.gz NAVNNEPCOCTFMN-UHFFFAOYSA-N 1 2 249.339 2.220 20 0 BEADLO CC[C@H]1CCC[C@H]1Nc1[nH+]cnc2c1cnn2C ZINC000268237112 187398689 /nfs/dbraw/zinc/39/86/89/187398689.db2.gz MQLHMWRWNVOXGQ-GXSJLCMTSA-N 1 2 245.330 2.354 20 0 BEADLO Cc1cc(CSCCn2cc[nH+]c2)nc(C)n1 ZINC000596377446 348515989 /nfs/dbraw/zinc/51/59/89/348515989.db2.gz ZSQINSYDKKAOAR-UHFFFAOYSA-N 1 2 248.355 2.223 20 0 BEADLO Cc1ccoc1C(=O)Nc1cccc2[nH+]ccn21 ZINC000357445145 179510373 /nfs/dbraw/zinc/51/03/73/179510373.db2.gz AODYPQYRDLQCAR-UHFFFAOYSA-N 1 2 241.250 2.488 20 0 BEADLO FC1(F)C[C@@H]1OCCSCCn1cc[nH+]c1 ZINC000596402131 348534443 /nfs/dbraw/zinc/53/44/43/348534443.db2.gz CULDLOUVHARCCK-VIFPVBQESA-N 1 2 248.298 2.041 20 0 BEADLO Cc1cccc(CCSCC[C@H](C)O)[nH+]1 ZINC000596410527 348536757 /nfs/dbraw/zinc/53/67/57/348536757.db2.gz XRADUIKFHINNKN-NSHDSACASA-N 1 2 225.357 2.437 20 0 BEADLO Cc1cccc(CCSCC[C@@H](C)O)[nH+]1 ZINC000596410526 348536853 /nfs/dbraw/zinc/53/68/53/348536853.db2.gz XRADUIKFHINNKN-LLVKDONJSA-N 1 2 225.357 2.437 20 0 BEADLO CC[C@H](Nc1cc(CC(=O)OC)cc[nH+]1)C1CC1 ZINC000596485450 348558580 /nfs/dbraw/zinc/55/85/80/348558580.db2.gz IVQUBMFXWUVCKN-LBPRGKRZSA-N 1 2 248.326 2.398 20 0 BEADLO COC(=O)C[C@H](CNc1cccc[nH+]1)C1CC1 ZINC000596490253 348560367 /nfs/dbraw/zinc/56/03/67/348560367.db2.gz IXSHKARTIGPPMI-LLVKDONJSA-N 1 2 234.299 2.083 20 0 BEADLO COC(=O)C[N@H+](C)Cc1cc2c(cccc2C)[nH]1 ZINC000596982168 348642740 /nfs/dbraw/zinc/64/27/40/348642740.db2.gz WFXVBWMNBRAMQE-UHFFFAOYSA-N 1 2 246.310 2.081 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1cc2c(cccc2C)[nH]1 ZINC000596982168 348642744 /nfs/dbraw/zinc/64/27/44/348642744.db2.gz WFXVBWMNBRAMQE-UHFFFAOYSA-N 1 2 246.310 2.081 20 0 BEADLO COC(=O)C[N@H+](C)Cc1cc2ccc(C)cc2[nH]1 ZINC000596981234 348642993 /nfs/dbraw/zinc/64/29/93/348642993.db2.gz LPVBIAAQWUYWLF-UHFFFAOYSA-N 1 2 246.310 2.081 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1cc2ccc(C)cc2[nH]1 ZINC000596981234 348642995 /nfs/dbraw/zinc/64/29/95/348642995.db2.gz LPVBIAAQWUYWLF-UHFFFAOYSA-N 1 2 246.310 2.081 20 0 BEADLO CSC1(C[N@@H+]2CCCc3[nH]ncc3C2)CC1 ZINC000597269943 348704445 /nfs/dbraw/zinc/70/44/45/348704445.db2.gz WMMBKENWQASRLF-UHFFFAOYSA-N 1 2 237.372 2.054 20 0 BEADLO CSC1(C[N@H+]2CCCc3[nH]ncc3C2)CC1 ZINC000597269943 348704446 /nfs/dbraw/zinc/70/44/46/348704446.db2.gz WMMBKENWQASRLF-UHFFFAOYSA-N 1 2 237.372 2.054 20 0 BEADLO C[C@@H](O)CCCNc1[nH+]ccc2ccc(F)cc21 ZINC000432827209 192372925 /nfs/dbraw/zinc/37/29/25/192372925.db2.gz BBTJTVWKMZJQQP-SNVBAGLBSA-N 1 2 248.301 2.369 20 0 BEADLO CCc1cc(NCC(C)(C)CCCO)nc[nH+]1 ZINC000221192395 490194021 /nfs/dbraw/zinc/19/40/21/490194021.db2.gz FIXMINWLWODNKB-UHFFFAOYSA-N 1 2 237.347 2.250 20 0 BEADLO Cc1c[nH+]cc(NCc2c(Cl)cnn2C)c1 ZINC000128802051 179680974 /nfs/dbraw/zinc/68/09/74/179680974.db2.gz RTDAGXSJHNLGHR-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO Cc1c[nH+]cc(N[C@H](C)Cn2cccn2)c1 ZINC000123177489 179684341 /nfs/dbraw/zinc/68/43/41/179684341.db2.gz SWKOVCISLVUDAX-LLVKDONJSA-N 1 2 216.288 2.087 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1nccn1C)c1ccco1 ZINC000070007640 490194970 /nfs/dbraw/zinc/19/49/70/490194970.db2.gz PFVQAXKUTLZHLO-NXEZZACHSA-N 1 2 219.288 2.425 20 0 BEADLO c1cnc(C[NH2+][C@H]2CCc3ccccc32)nc1 ZINC000054459255 349033230 /nfs/dbraw/zinc/03/32/30/349033230.db2.gz FFJNJUWPGOPHJR-ZDUSSCGKSA-N 1 2 225.295 2.254 20 0 BEADLO COc1ccc(C)cc1CNc1cc(C)[nH+]cn1 ZINC000599457024 349190185 /nfs/dbraw/zinc/19/01/85/349190185.db2.gz KUNXOCHYSQKRKH-UHFFFAOYSA-N 1 2 243.310 2.136 20 0 BEADLO c1nn[nH]c1CC[N@@H+]1CCC[C@H](C2CCC2)CC1 ZINC000640107132 538034791 /nfs/dbraw/zinc/03/47/91/538034791.db2.gz NYNXGJBDHGPTHN-ZDUSSCGKSA-N 1 2 248.374 2.249 20 0 BEADLO c1nn[nH]c1CC[N@H+]1CCC[C@H](C2CCC2)CC1 ZINC000640107132 538034797 /nfs/dbraw/zinc/03/47/97/538034797.db2.gz NYNXGJBDHGPTHN-ZDUSSCGKSA-N 1 2 248.374 2.249 20 0 BEADLO CC[C@H]1C[C@H](CNc2c[nH]c[nH+]2)CCO1 ZINC000308960385 349202811 /nfs/dbraw/zinc/20/28/11/349202811.db2.gz RTVIYUMQJHGQPJ-ZJUUUORDSA-N 1 2 209.293 2.027 20 0 BEADLO CC(C)[C@@H]1C[C@@H]([NH2+]Cc2ccn[nH]2)CS1 ZINC000308998679 349267792 /nfs/dbraw/zinc/26/77/92/349267792.db2.gz NHSNAXNXSAKKFZ-MNOVXSKESA-N 1 2 225.361 2.029 20 0 BEADLO CC(C)[C@H]1C[C@H]([NH2+]Cc2ccn[nH]2)CS1 ZINC000308998682 349267935 /nfs/dbraw/zinc/26/79/35/349267935.db2.gz NHSNAXNXSAKKFZ-WDEREUQCSA-N 1 2 225.361 2.029 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H]2C[C@H](C)C[C@H](C)C2)c[nH+]1 ZINC000265780025 179887449 /nfs/dbraw/zinc/88/74/49/179887449.db2.gz FAOJXVJBANOCSW-JZYVYDRUSA-N 1 2 235.331 2.273 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccn(C)n1)c1ccc(F)cn1 ZINC000161352516 349427557 /nfs/dbraw/zinc/42/75/57/349427557.db2.gz MJXSWJVKVJYQEP-GFCCVEGCSA-N 1 2 248.305 2.195 20 0 BEADLO CC(C)(C)c1noc(CCCn2cc[nH+]c2)n1 ZINC000603633347 350004571 /nfs/dbraw/zinc/00/45/71/350004571.db2.gz SKRHUHSGLRZYHO-UHFFFAOYSA-N 1 2 234.303 2.196 20 0 BEADLO C[C@@H](NC(=O)CCCn1cc[nH+]c1)C1CCCC1 ZINC000603671103 350007842 /nfs/dbraw/zinc/00/78/42/350007842.db2.gz GQTQPHFCGBOLPC-GFCCVEGCSA-N 1 2 249.358 2.358 20 0 BEADLO Cc1nc(C[NH2+]Cc2ncccc2C)cs1 ZINC000070908134 179969849 /nfs/dbraw/zinc/96/98/49/179969849.db2.gz ZZAKUTCJXUTZJS-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO Cc1nc2[nH]ccc2c(NCCC[C@H](C)CO)[nH+]1 ZINC000340076129 180017207 /nfs/dbraw/zinc/01/72/07/180017207.db2.gz AECTXRNYAPTGMG-VIFPVBQESA-N 1 2 248.330 2.038 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H]2CC[C@H]2C)[nH+]1 ZINC000336729945 180023486 /nfs/dbraw/zinc/02/34/86/180023486.db2.gz DMPXNYDXTNLWFP-GMSGAONNSA-N 1 2 216.288 2.477 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@H]2CCO[C@H](C)C2)[nH+]1 ZINC000354705694 180025308 /nfs/dbraw/zinc/02/53/08/180025308.db2.gz AQHYVXHGXFDKPP-SCZZXKLOSA-N 1 2 246.314 2.246 20 0 BEADLO Cc1nc(Sc2[nH+]cnc3[nH]ccc32)[nH]c1C ZINC000338733799 180033163 /nfs/dbraw/zinc/03/31/63/180033163.db2.gz MQRUXCYDIOPKJM-UHFFFAOYSA-N 1 2 245.311 2.449 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2CCS[C@@H](C)CC2)no1 ZINC000336394944 180034610 /nfs/dbraw/zinc/03/46/10/180034610.db2.gz JQSCORQYDYVSAH-DTWKUNHWSA-N 1 2 241.360 2.266 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2CCS[C@@H](C)CC2)no1 ZINC000336394944 180034613 /nfs/dbraw/zinc/03/46/13/180034613.db2.gz JQSCORQYDYVSAH-DTWKUNHWSA-N 1 2 241.360 2.266 20 0 BEADLO Cc1c[nH]c(C[NH+]2CC3(C2)CCCCC3)n1 ZINC000628306039 350114845 /nfs/dbraw/zinc/11/48/45/350114845.db2.gz KBHIXPCZTTXNIA-UHFFFAOYSA-N 1 2 219.332 2.484 20 0 BEADLO Cc1nc([C@@H](C)NCc2[nH]cc[nH+]2)cs1 ZINC000066594152 180038254 /nfs/dbraw/zinc/03/82/54/180038254.db2.gz DRKPKTOUIZGOLQ-SSDOTTSWSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1nnc([C@@H]2CCC[N@H+](C/C=C/Cl)C2)[nH]1 ZINC000268507595 180042587 /nfs/dbraw/zinc/04/25/87/180042587.db2.gz UBDFRGZXBXJQPK-RXNUUUNCSA-N 1 2 240.738 2.045 20 0 BEADLO Cc1nnc([C@@H]2CCC[N@@H+](C/C=C/Cl)C2)[nH]1 ZINC000268507595 180042591 /nfs/dbraw/zinc/04/25/91/180042591.db2.gz UBDFRGZXBXJQPK-RXNUUUNCSA-N 1 2 240.738 2.045 20 0 BEADLO Cc1n[nH]c([C@@H]2CCC[N@H+](C/C=C/Cl)C2)n1 ZINC000268507595 180042593 /nfs/dbraw/zinc/04/25/93/180042593.db2.gz UBDFRGZXBXJQPK-RXNUUUNCSA-N 1 2 240.738 2.045 20 0 BEADLO Cc1n[nH]c([C@@H]2CCC[N@@H+](C/C=C/Cl)C2)n1 ZINC000268507595 180042595 /nfs/dbraw/zinc/04/25/95/180042595.db2.gz UBDFRGZXBXJQPK-RXNUUUNCSA-N 1 2 240.738 2.045 20 0 BEADLO Cc1nc([C@@H]2CCC[N@H+](C/C=C/Cl)C2)n[nH]1 ZINC000268507595 180042596 /nfs/dbraw/zinc/04/25/96/180042596.db2.gz UBDFRGZXBXJQPK-RXNUUUNCSA-N 1 2 240.738 2.045 20 0 BEADLO Cc1nc([C@@H]2CCC[N@@H+](C/C=C/Cl)C2)n[nH]1 ZINC000268507595 180042598 /nfs/dbraw/zinc/04/25/98/180042598.db2.gz UBDFRGZXBXJQPK-RXNUUUNCSA-N 1 2 240.738 2.045 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2CCC(C)(C)C2)no1 ZINC000336455785 180047112 /nfs/dbraw/zinc/04/71/12/180047112.db2.gz SFGOZQKNBZDZIO-QMMMGPOBSA-N 1 2 209.293 2.171 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2CCC(C)(C)C2)no1 ZINC000336455785 180047115 /nfs/dbraw/zinc/04/71/15/180047115.db2.gz SFGOZQKNBZDZIO-QMMMGPOBSA-N 1 2 209.293 2.171 20 0 BEADLO Cc1nc([C@H](C)[NH2+]Cc2cnn(C)c2)cs1 ZINC000041054735 180050746 /nfs/dbraw/zinc/05/07/46/180050746.db2.gz PPBJFMXUGZLOHM-QMMMGPOBSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1nc([C@H]2CCCC[N@@H+]2Cc2cc[nH]c2)no1 ZINC000362622357 180054515 /nfs/dbraw/zinc/05/45/15/180054515.db2.gz MWZHDQQCAFOSJY-GFCCVEGCSA-N 1 2 246.314 2.433 20 0 BEADLO Cc1nc([C@H]2CCCC[N@H+]2Cc2cc[nH]c2)no1 ZINC000362622357 180054517 /nfs/dbraw/zinc/05/45/17/180054517.db2.gz MWZHDQQCAFOSJY-GFCCVEGCSA-N 1 2 246.314 2.433 20 0 BEADLO Cc1nc(SCc2cc[nH+]c(N)c2)[nH]c1C ZINC000292690695 180030353 /nfs/dbraw/zinc/03/03/53/180030353.db2.gz PTWPBIBMOSTOBE-UHFFFAOYSA-N 1 2 234.328 2.296 20 0 BEADLO Cc1nc(NCC[C@@H](C)F)c2c([nH+]1)CCCC2 ZINC000338759366 180068087 /nfs/dbraw/zinc/06/80/87/180068087.db2.gz XUBIWEQCVZSXAK-SECBINFHSA-N 1 2 237.322 2.246 20 0 BEADLO Cc1nc(NCc2ccon2)c2c([nH+]1)CCCC2 ZINC000302059565 180070779 /nfs/dbraw/zinc/07/07/79/180070779.db2.gz BCDDMBXKKSOQNY-UHFFFAOYSA-N 1 2 244.298 2.264 20 0 BEADLO Cc1[nH+]c2ccccc2n1[C@H](C)[C@H](C)O ZINC000044184407 180102655 /nfs/dbraw/zinc/10/26/55/180102655.db2.gz ZMTRFGWKMYMZKD-BDAKNGLRSA-N 1 2 204.273 2.287 20 0 BEADLO Cc1ncc(C[N@H+]2CCO[C@@H](C)[C@@H]2C)s1 ZINC000156320947 180143243 /nfs/dbraw/zinc/14/32/43/180143243.db2.gz WVCTWPLEMJIOPS-IUCAKERBSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ncc(C[N@@H+]2CCO[C@@H](C)[C@@H]2C)s1 ZINC000156320947 180143245 /nfs/dbraw/zinc/14/32/45/180143245.db2.gz WVCTWPLEMJIOPS-IUCAKERBSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1c[nH]nc1C[N@H+](C)Cc1cnc(C)s1 ZINC000290466359 180139449 /nfs/dbraw/zinc/13/94/49/180139449.db2.gz PVXZGDKLLOPMRL-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1c[nH]nc1C[N@@H+](C)Cc1cnc(C)s1 ZINC000290466359 180139452 /nfs/dbraw/zinc/13/94/52/180139452.db2.gz PVXZGDKLLOPMRL-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2ccco2)cn1 ZINC000338977125 180141257 /nfs/dbraw/zinc/14/12/57/180141257.db2.gz JHXIVUSHAQZXEN-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2ccco2)cn1 ZINC000338977125 180141258 /nfs/dbraw/zinc/14/12/58/180141258.db2.gz JHXIVUSHAQZXEN-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H](C)c1ccsc1 ZINC000359514118 180119504 /nfs/dbraw/zinc/11/95/04/180119504.db2.gz GVMKUFWMWFBACW-MRVPVSSYSA-N 1 2 249.339 2.200 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)CCCC(F)(F)F ZINC000356250984 180120711 /nfs/dbraw/zinc/12/07/11/180120711.db2.gz ZNNJRSPXALFDFL-UHFFFAOYSA-N 1 2 249.236 2.067 20 0 BEADLO Cc1ncc(C[NH2+][C@@H]2C[C@@H](C)n3ccnc32)s1 ZINC000294133899 180157214 /nfs/dbraw/zinc/15/72/14/180157214.db2.gz OSHQIOAGMVNYGG-LDYMZIIASA-N 1 2 248.355 2.444 20 0 BEADLO C[C@@H]([NH2+][C@@H]1COc2ccc(F)cc21)c1ncc[nH]1 ZINC000334358120 538067303 /nfs/dbraw/zinc/06/73/03/538067303.db2.gz RVRSPDJAPWSDGR-LDYMZIIASA-N 1 2 247.273 2.333 20 0 BEADLO C[C@@H](N[C@@H]1COc2ccc(F)cc21)c1[nH]cc[nH+]1 ZINC000334358120 538067307 /nfs/dbraw/zinc/06/73/07/538067307.db2.gz RVRSPDJAPWSDGR-LDYMZIIASA-N 1 2 247.273 2.333 20 0 BEADLO Cn1cc(Cl)cc1C[N@H+](C)Cc1ccno1 ZINC000532644648 323286334 /nfs/dbraw/zinc/28/63/34/323286334.db2.gz SILYKKWJQCDPGY-UHFFFAOYSA-N 1 2 239.706 2.299 20 0 BEADLO Cn1cc(Cl)cc1C[N@@H+](C)Cc1ccno1 ZINC000532644648 323286336 /nfs/dbraw/zinc/28/63/36/323286336.db2.gz SILYKKWJQCDPGY-UHFFFAOYSA-N 1 2 239.706 2.299 20 0 BEADLO Cc1cnc([C@H](C)[NH2+]Cc2ccnc(C)n2)s1 ZINC000124021464 180191265 /nfs/dbraw/zinc/19/12/65/180191265.db2.gz UMNVUPMPBXJQJX-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO Cc1nc(NCCSC(F)(F)F)cc[nH+]1 ZINC000230899985 180199365 /nfs/dbraw/zinc/19/93/65/180199365.db2.gz DMNFDXOLFIWDMH-UHFFFAOYSA-N 1 2 237.250 2.450 20 0 BEADLO Cc1nc(N[C@@H](C)[C@@H](O)c2ccccc2)cc[nH+]1 ZINC000288183463 180203715 /nfs/dbraw/zinc/20/37/15/180203715.db2.gz JGLINDJHXXDOOF-IINYFYTJSA-N 1 2 243.310 2.319 20 0 BEADLO Cc1nc(N[C@@H]2[C@@H]3CCO[C@H]3C2(C)C)cc[nH+]1 ZINC000266294636 180204684 /nfs/dbraw/zinc/20/46/84/180204684.db2.gz XGIVBHPAOVWNJX-MVWJERBFSA-N 1 2 233.315 2.010 20 0 BEADLO Cc1nc(N[C@H](C)c2ccccn2)cc[nH+]1 ZINC000054935837 180206125 /nfs/dbraw/zinc/20/61/25/180206125.db2.gz ZXSAYRQHVYWTKJ-SECBINFHSA-N 1 2 214.272 2.353 20 0 BEADLO Cc1nc(NC[C@@H]2CCCC2(F)F)cc[nH+]1 ZINC000336232743 180181144 /nfs/dbraw/zinc/18/11/44/180181144.db2.gz NZUCBHZDKCKSCP-VIFPVBQESA-N 1 2 227.258 2.054 20 0 BEADLO Cc1ncccc1C[N@@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000336331295 180219272 /nfs/dbraw/zinc/21/92/72/180219272.db2.gz NVUWTCUKUQUFHS-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ncccc1C[N@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000336331295 180219275 /nfs/dbraw/zinc/21/92/75/180219275.db2.gz NVUWTCUKUQUFHS-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1[nH+]cccc1NCC[C@H]1CCOC1 ZINC000309089482 180225936 /nfs/dbraw/zinc/22/59/36/180225936.db2.gz BQWNRCCVBFYECU-NSHDSACASA-N 1 2 206.289 2.229 20 0 BEADLO CC(C)=CC[N@@H+](C)[C@H](C)C(=O)OC(C)C ZINC000129774407 191092342 /nfs/dbraw/zinc/09/23/42/191092342.db2.gz BQIPRWUKERBQCT-LLVKDONJSA-N 1 2 213.321 2.225 20 0 BEADLO CC(C)=CC[N@H+](C)[C@H](C)C(=O)OC(C)C ZINC000129774407 191092344 /nfs/dbraw/zinc/09/23/44/191092344.db2.gz BQIPRWUKERBQCT-LLVKDONJSA-N 1 2 213.321 2.225 20 0 BEADLO CC1(C)CC[N@H+](Cc2noc(C3CC3)n2)C1 ZINC000076014106 350286904 /nfs/dbraw/zinc/28/69/04/350286904.db2.gz WTAWKAMMCXHJFT-UHFFFAOYSA-N 1 2 221.304 2.179 20 0 BEADLO CC1(C)CC[N@@H+](Cc2noc(C3CC3)n2)C1 ZINC000076014106 350286907 /nfs/dbraw/zinc/28/69/07/350286907.db2.gz WTAWKAMMCXHJFT-UHFFFAOYSA-N 1 2 221.304 2.179 20 0 BEADLO Cc1ncsc1C[N@@H+](C(C)C)C1COC1 ZINC000295960901 180313214 /nfs/dbraw/zinc/31/32/14/180313214.db2.gz HVLMQSLKVGLYHC-UHFFFAOYSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ncsc1C[N@H+](C(C)C)C1COC1 ZINC000295960901 180313218 /nfs/dbraw/zinc/31/32/18/180313218.db2.gz HVLMQSLKVGLYHC-UHFFFAOYSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ncsc1C[N@H+]1CCO[C@@H](C)[C@@H]1C ZINC000093418619 180316908 /nfs/dbraw/zinc/31/69/08/180316908.db2.gz UMMOSZIQGZJNLO-UWVGGRQHSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ncsc1C[N@@H+]1CCO[C@@H](C)[C@@H]1C ZINC000093418619 180316911 /nfs/dbraw/zinc/31/69/11/180316911.db2.gz UMMOSZIQGZJNLO-UWVGGRQHSA-N 1 2 226.345 2.061 20 0 BEADLO C[C@H]([NH2+]CC(F)F)c1ccc([S@](C)=O)cc1 ZINC000309413006 350376570 /nfs/dbraw/zinc/37/65/70/350376570.db2.gz IVIGMVFOTYOKPG-PWJLMRLQSA-N 1 2 247.310 2.340 20 0 BEADLO Cc1nn(C)c(C)c1Nc1[nH+]cnc2[nH]ccc21 ZINC000263721436 180344922 /nfs/dbraw/zinc/34/49/22/180344922.db2.gz BJNQTAYGMICTPY-UHFFFAOYSA-N 1 2 242.286 2.052 20 0 BEADLO CCc1nc(C[N@H+](C)C(C)(C)CC)no1 ZINC000336653335 350420325 /nfs/dbraw/zinc/42/03/25/350420325.db2.gz YCXJLKOOFJFHNU-UHFFFAOYSA-N 1 2 211.309 2.252 20 0 BEADLO CCc1nc(C[N@@H+](C)C(C)(C)CC)no1 ZINC000336653335 350420329 /nfs/dbraw/zinc/42/03/29/350420329.db2.gz YCXJLKOOFJFHNU-UHFFFAOYSA-N 1 2 211.309 2.252 20 0 BEADLO O=C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccncc1 ZINC000054600941 1172127221 /nfs/dbraw/zinc/12/72/21/1172127221.db2.gz YFOJJRWAABHNET-BETUJISGSA-N 1 2 230.311 2.168 20 0 BEADLO O=C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccncc1 ZINC000054600941 1172127224 /nfs/dbraw/zinc/12/72/24/1172127224.db2.gz YFOJJRWAABHNET-BETUJISGSA-N 1 2 230.311 2.168 20 0 BEADLO Cc1nn(C)c(C)c1C[N@@H+]1CCC=C(F)C1 ZINC000272446504 180338130 /nfs/dbraw/zinc/33/81/30/180338130.db2.gz JDSMWFOUHCKDLN-UHFFFAOYSA-N 1 2 223.295 2.096 20 0 BEADLO Cc1nn(C)c(C)c1C[N@H+]1CCC=C(F)C1 ZINC000272446504 180338140 /nfs/dbraw/zinc/33/81/40/180338140.db2.gz JDSMWFOUHCKDLN-UHFFFAOYSA-N 1 2 223.295 2.096 20 0 BEADLO FC(F)C1C[NH+](Cc2cnc(C3CC3)o2)C1 ZINC000628307155 350449214 /nfs/dbraw/zinc/44/92/14/350449214.db2.gz RFBFDQJSHBVAQL-UHFFFAOYSA-N 1 2 228.242 2.249 20 0 BEADLO Cc1nn(C)cc1[C@@H](C)[NH2+]Cc1cscn1 ZINC000082432827 180379114 /nfs/dbraw/zinc/37/91/14/180379114.db2.gz LSWMEMLYVAWZOB-MRVPVSSYSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1nn(C)cc1[C@H](C)[NH2+]Cc1cscn1 ZINC000082432828 180382408 /nfs/dbraw/zinc/38/24/08/180382408.db2.gz LSWMEMLYVAWZOB-QMMMGPOBSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1nn(C)cc1[C@H]1CCCN1c1cccc[nH+]1 ZINC000369504357 180382797 /nfs/dbraw/zinc/38/27/97/180382797.db2.gz TYJGXADXAHANRM-CYBMUJFWSA-N 1 2 242.326 2.465 20 0 BEADLO CCn1ccc(C[NH2+][C@H](C)c2ccoc2)n1 ZINC000577470318 365962277 /nfs/dbraw/zinc/96/22/77/365962277.db2.gz SIYGGXHWLREVOT-SNVBAGLBSA-N 1 2 219.288 2.347 20 0 BEADLO CC[C@@H]([NH2+][C@H]1CCCOCC1)C(F)(F)F ZINC000336747613 350496862 /nfs/dbraw/zinc/49/68/62/350496862.db2.gz CANWGKVINIOIRK-DTWKUNHWSA-N 1 2 225.254 2.486 20 0 BEADLO Cc1[nH]ncc1C[NH2+]CCOC1CCCCC1 ZINC000070168047 350506052 /nfs/dbraw/zinc/50/60/52/350506052.db2.gz YWFYGAJEOGSHED-UHFFFAOYSA-N 1 2 237.347 2.157 20 0 BEADLO CC(C)c1cnc(C[N@@H+]2CCCOCC2)s1 ZINC000335324722 538095591 /nfs/dbraw/zinc/09/55/91/538095591.db2.gz YLMDDLUULVEHOY-UHFFFAOYSA-N 1 2 240.372 2.489 20 0 BEADLO CC(C)c1cnc(C[N@H+]2CCCOCC2)s1 ZINC000335324722 538095593 /nfs/dbraw/zinc/09/55/93/538095593.db2.gz YLMDDLUULVEHOY-UHFFFAOYSA-N 1 2 240.372 2.489 20 0 BEADLO CCCC[C@@H](C)C(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000337540983 350593921 /nfs/dbraw/zinc/59/39/21/350593921.db2.gz YZXYETZVGUJTOG-MNOVXSKESA-N 1 2 249.358 2.210 20 0 BEADLO CCCC[C@@H](C)C(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000337540983 350593922 /nfs/dbraw/zinc/59/39/22/350593922.db2.gz YZXYETZVGUJTOG-MNOVXSKESA-N 1 2 249.358 2.210 20 0 BEADLO CCCC[C@H](C)C(=O)N[C@H]1CCn2cc[nH+]c2C1 ZINC000337589690 350598306 /nfs/dbraw/zinc/59/83/06/350598306.db2.gz HKFNQCYKHCSRFF-RYUDHWBXSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1nnc(NCCCc2[nH+]cccc2C)o1 ZINC000294995190 180432913 /nfs/dbraw/zinc/43/29/13/180432913.db2.gz NOSMJVUNVRAVIU-UHFFFAOYSA-N 1 2 232.287 2.126 20 0 BEADLO Cc1nc(C[N@@H+](C)Cc2cccn2C)cs1 ZINC000156694967 191116310 /nfs/dbraw/zinc/11/63/10/191116310.db2.gz JJIGGFAGECKLPF-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1nc(C[N@H+](C)Cc2cccn2C)cs1 ZINC000156694967 191116311 /nfs/dbraw/zinc/11/63/11/191116311.db2.gz JJIGGFAGECKLPF-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO CCCC[N@@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000606899899 350626137 /nfs/dbraw/zinc/62/61/37/350626137.db2.gz HBZKHVFHERMUKV-MRVPVSSYSA-N 1 2 211.227 2.050 20 0 BEADLO CCCC[N@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000606899899 350626139 /nfs/dbraw/zinc/62/61/39/350626139.db2.gz HBZKHVFHERMUKV-MRVPVSSYSA-N 1 2 211.227 2.050 20 0 BEADLO CCCCC[N@@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000606903391 350627218 /nfs/dbraw/zinc/62/72/18/350627218.db2.gz XXIYXBVSVAFXOJ-SECBINFHSA-N 1 2 225.254 2.440 20 0 BEADLO CCCCC[N@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000606903391 350627220 /nfs/dbraw/zinc/62/72/20/350627220.db2.gz XXIYXBVSVAFXOJ-SECBINFHSA-N 1 2 225.254 2.440 20 0 BEADLO Cc1[nH]c(C(=O)NCCCC(C)(C)C)c[nH+]1 ZINC000606933508 350629462 /nfs/dbraw/zinc/62/94/62/350629462.db2.gz POFSMMMODJDBSY-UHFFFAOYSA-N 1 2 223.320 2.274 20 0 BEADLO Cc1noc(C[N@@H+]2CCC[C@@H]2c2ccncc2)n1 ZINC000162753993 180486532 /nfs/dbraw/zinc/48/65/32/180486532.db2.gz GPTJJELMIIIYRS-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1noc(C[N@H+]2CCC[C@@H]2c2ccncc2)n1 ZINC000162753993 180486534 /nfs/dbraw/zinc/48/65/34/180486534.db2.gz GPTJJELMIIIYRS-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO CCc1nc(C[NH+]2CCC(C3CC3)CC2)no1 ZINC000366399420 350761593 /nfs/dbraw/zinc/76/15/93/350761593.db2.gz KFKSBFDZVWJTLD-UHFFFAOYSA-N 1 2 235.331 2.254 20 0 BEADLO CCCCc1cc(NCc2cscn2)nc[nH+]1 ZINC000631085524 350813837 /nfs/dbraw/zinc/81/38/37/350813837.db2.gz MLSLKQYKPMKGHR-UHFFFAOYSA-N 1 2 248.355 2.310 20 0 BEADLO CC(C)CCc1noc(C[N@@H+]2C[C@@H](C)[C@@H]2C)n1 ZINC000339575365 350765392 /nfs/dbraw/zinc/76/53/92/350765392.db2.gz ZCNSVEFVEZWGHU-MNOVXSKESA-N 1 2 237.347 2.498 20 0 BEADLO CC(C)CCc1noc(C[N@H+]2C[C@@H](C)[C@@H]2C)n1 ZINC000339575365 350765393 /nfs/dbraw/zinc/76/53/93/350765393.db2.gz ZCNSVEFVEZWGHU-MNOVXSKESA-N 1 2 237.347 2.498 20 0 BEADLO CC1(C)CCC[C@@H](C(=O)Nc2cc[nH+]cc2O)C1 ZINC000339600465 350767239 /nfs/dbraw/zinc/76/72/39/350767239.db2.gz VSHQXUYORVCLDE-SNVBAGLBSA-N 1 2 248.326 2.364 20 0 BEADLO CC[C@H]([NH2+]CC(=O)OC)c1ccc(C)cc1 ZINC000019885568 350822498 /nfs/dbraw/zinc/82/24/98/350822498.db2.gz TYGWRVXQSKVZHF-LBPRGKRZSA-N 1 2 221.300 2.209 20 0 BEADLO CC[N@H+](Cc1nccn1C)Cc1ccccc1 ZINC000248160458 350856595 /nfs/dbraw/zinc/85/65/95/350856595.db2.gz XHMFLEPDFADEDI-UHFFFAOYSA-N 1 2 229.327 2.442 20 0 BEADLO CC[N@@H+](Cc1nccn1C)Cc1ccccc1 ZINC000248160458 350856599 /nfs/dbraw/zinc/85/65/99/350856599.db2.gz XHMFLEPDFADEDI-UHFFFAOYSA-N 1 2 229.327 2.442 20 0 BEADLO Cc1cc(N(C)C2CC2)nc(C2CC2)[nH+]1 ZINC000265377638 350857613 /nfs/dbraw/zinc/85/76/13/350857613.db2.gz QJXJBGIWPWAMEQ-UHFFFAOYSA-N 1 2 203.289 2.261 20 0 BEADLO CO[C@H]1CC[C@@H](Nc2cc(NC3CC3)[nH+]cn2)C1 ZINC000577599751 366012531 /nfs/dbraw/zinc/01/25/31/366012531.db2.gz PUMVQVLAJMBILN-MNOVXSKESA-N 1 2 248.330 2.030 20 0 BEADLO CO[C@H]1CC[C@@H](Nc2cc(NC3CC3)nc[nH+]2)C1 ZINC000577599751 366012541 /nfs/dbraw/zinc/01/25/41/366012541.db2.gz PUMVQVLAJMBILN-MNOVXSKESA-N 1 2 248.330 2.030 20 0 BEADLO C[C@H]([NH2+]Cc1cocn1)c1cccc(C#N)c1 ZINC000397877136 350983331 /nfs/dbraw/zinc/98/33/31/350983331.db2.gz WBIIBNLZDIYNSE-JTQLQIEISA-N 1 2 227.267 2.397 20 0 BEADLO C[C@@H]([NH2+]Cc1cocn1)c1ccc([N+](=O)[O-])cc1 ZINC000397923402 350984347 /nfs/dbraw/zinc/98/43/47/350984347.db2.gz MQXGZKALHREMBA-SECBINFHSA-N 1 2 247.254 2.434 20 0 BEADLO C[C@H]([NH2+][C@H]1CS[C@H](C)C1)C(=O)OC(C)(C)C ZINC000397918456 350990937 /nfs/dbraw/zinc/99/09/37/350990937.db2.gz FWRZAQJZFFYGPB-KXUCPTDWSA-N 1 2 245.388 2.200 20 0 BEADLO CC(C)[C@H](C)N(C)c1cc(-n2cc[nH+]c2)ncn1 ZINC000607142995 350943843 /nfs/dbraw/zinc/94/38/43/350943843.db2.gz URBWYFMPUVQZLV-NSHDSACASA-N 1 2 245.330 2.143 20 0 BEADLO C/C=C/C[NH2+]Cc1nn(C)c(C)c1Cl ZINC000623739921 351049447 /nfs/dbraw/zinc/04/94/47/351049447.db2.gz JTPUMLKKBQPWCK-SNAWJCMRSA-N 1 2 213.712 2.048 20 0 BEADLO Cc1cc(C)c(C[NH2+]Cc2c[nH]nn2)c(C)c1 ZINC000398366563 351123249 /nfs/dbraw/zinc/12/32/49/351123249.db2.gz PLBKYJYWJCHXRJ-UHFFFAOYSA-N 1 2 230.315 2.020 20 0 BEADLO Cc1cc(C)c(C[NH2+]Cc2cn[nH]n2)c(C)c1 ZINC000398366563 351123253 /nfs/dbraw/zinc/12/32/53/351123253.db2.gz PLBKYJYWJCHXRJ-UHFFFAOYSA-N 1 2 230.315 2.020 20 0 BEADLO Cc1ncc(C[NH2+][C@@H](C)c2ccccn2)o1 ZINC000398109721 363008347 /nfs/dbraw/zinc/00/83/47/363008347.db2.gz QSVZUOCRKWELCQ-VIFPVBQESA-N 1 2 217.272 2.229 20 0 BEADLO C(C[NH+]1CCOCC1)OC1CCCCCC1 ZINC000122408136 363008479 /nfs/dbraw/zinc/00/84/79/363008479.db2.gz YIYQTOYJBGIMIH-UHFFFAOYSA-N 1 2 227.348 2.058 20 0 BEADLO CC(C)[C@@H]1CC[C@@H]([NH2+]Cc2c[nH]nn2)C[C@H]1C ZINC000623577866 363009602 /nfs/dbraw/zinc/00/96/02/363009602.db2.gz JKCIJJODUJDQFY-WZRBSPASSA-N 1 2 236.363 2.355 20 0 BEADLO CC(C)[C@@H]1CC[C@@H]([NH2+]Cc2cn[nH]n2)C[C@H]1C ZINC000623577866 363009605 /nfs/dbraw/zinc/00/96/05/363009605.db2.gz JKCIJJODUJDQFY-WZRBSPASSA-N 1 2 236.363 2.355 20 0 BEADLO CC1(C)CCC[C@@H]([NH2+]Cc2c[nH]nn2)CC1 ZINC000398402729 351137283 /nfs/dbraw/zinc/13/72/83/351137283.db2.gz NJTLSPRFHOQRIA-SNVBAGLBSA-N 1 2 222.336 2.253 20 0 BEADLO CC1(C)CCC[C@@H]([NH2+]Cc2cn[nH]n2)CC1 ZINC000398402729 351137286 /nfs/dbraw/zinc/13/72/86/351137286.db2.gz NJTLSPRFHOQRIA-SNVBAGLBSA-N 1 2 222.336 2.253 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H](C)n1cccn1 ZINC000265196559 351265373 /nfs/dbraw/zinc/26/53/73/351265373.db2.gz JHFAXAUKZVHXOP-JTQLQIEISA-N 1 2 244.298 2.040 20 0 BEADLO C[C@@H](O)C[N@H+](Cc1ccon1)Cc1ccccc1 ZINC000607358813 351333230 /nfs/dbraw/zinc/33/32/30/351333230.db2.gz PWPJDSXQXXQFJQ-GFCCVEGCSA-N 1 2 246.310 2.058 20 0 BEADLO C[C@@H](O)C[N@@H+](Cc1ccon1)Cc1ccccc1 ZINC000607358813 351333233 /nfs/dbraw/zinc/33/32/33/351333233.db2.gz PWPJDSXQXXQFJQ-GFCCVEGCSA-N 1 2 246.310 2.058 20 0 BEADLO CCc1nc(CCNc2cc[nH+]c(C)n2)cs1 ZINC000266351478 351289915 /nfs/dbraw/zinc/28/99/15/351289915.db2.gz JMMWVKUGNJPIOJ-UHFFFAOYSA-N 1 2 248.355 2.459 20 0 BEADLO C[C@H]([NH2+]Cc1cnc(C2CC2)o1)c1nccn1C ZINC000628352436 351315239 /nfs/dbraw/zinc/31/52/39/351315239.db2.gz ISQTXLXEXITDRJ-VIFPVBQESA-N 1 2 246.314 2.136 20 0 BEADLO C[C@H](NCc1cnc(C2CC2)o1)c1[nH+]ccn1C ZINC000628352436 351315241 /nfs/dbraw/zinc/31/52/41/351315241.db2.gz ISQTXLXEXITDRJ-VIFPVBQESA-N 1 2 246.314 2.136 20 0 BEADLO Cc1[nH]c(CN(C)c2cccc(O)c2)[nH+]c1C ZINC000628353436 351318730 /nfs/dbraw/zinc/31/87/30/351318730.db2.gz WUDIRIQAXBHNPR-UHFFFAOYSA-N 1 2 231.299 2.369 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cc3n(n2)CCC3)o1 ZINC000631243135 351320855 /nfs/dbraw/zinc/32/08/55/351320855.db2.gz SNSAKUYISAMHAN-UHFFFAOYSA-N 1 2 231.299 2.021 20 0 BEADLO CC[C@@H](OC)C(=O)Nc1ccc(C)[nH+]c1C ZINC000267983076 351326624 /nfs/dbraw/zinc/32/66/24/351326624.db2.gz GQAVGHFLNSVDBR-LLVKDONJSA-N 1 2 222.288 2.062 20 0 BEADLO CC[N@H+](Cc1ccno1)Cc1ccccn1 ZINC000268159720 351329729 /nfs/dbraw/zinc/32/97/29/351329729.db2.gz OJRQPJSRTNHERG-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO CC[N@@H+](Cc1ccno1)Cc1ccccn1 ZINC000268159720 351329732 /nfs/dbraw/zinc/32/97/32/351329732.db2.gz OJRQPJSRTNHERG-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO CCc1cc(N[C@@H]2[C@@H]3CCO[C@H]3C2(C)C)nc[nH+]1 ZINC000607356658 351330950 /nfs/dbraw/zinc/33/09/50/351330950.db2.gz XPCNXMRKYOMCTH-CYZMBNFOSA-N 1 2 247.342 2.264 20 0 BEADLO CCc1ocnc1C(=O)Nc1cc[nH+]cc1CC ZINC000265936075 351276819 /nfs/dbraw/zinc/27/68/19/351276819.db2.gz BFYDNYPPDVPNOR-UHFFFAOYSA-N 1 2 245.282 2.447 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H]1CCCCO1 ZINC000269437679 351355626 /nfs/dbraw/zinc/35/56/26/351355626.db2.gz ZELOGQAVCFLOPE-GFCCVEGCSA-N 1 2 234.299 2.152 20 0 BEADLO CCC[C@H](C[NH2+]Cc1cn[nH]c1C)OCC ZINC000623597765 363033889 /nfs/dbraw/zinc/03/38/89/363033889.db2.gz AZDUFRSICNDPLO-GFCCVEGCSA-N 1 2 225.336 2.013 20 0 BEADLO CCc1nc(C[NH2+]Cc2ccns2)cs1 ZINC000404461498 351468506 /nfs/dbraw/zinc/46/85/06/351468506.db2.gz KPTXMBLSFOGAKI-UHFFFAOYSA-N 1 2 239.369 2.452 20 0 BEADLO C[C@@H](O)[C@@H](C)[NH2+]CC(F)(F)c1ccccc1 ZINC000386876246 363054928 /nfs/dbraw/zinc/05/49/28/363054928.db2.gz HRXWNRFPTAIMDS-NXEZZACHSA-N 1 2 229.270 2.137 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cnn[nH]2)c(Cl)c1 ZINC000404576249 351554778 /nfs/dbraw/zinc/55/47/78/351554778.db2.gz LJVNOZPOGFNUJL-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO CCc1[nH+]c(C)ccc1OCc1nc(C)no1 ZINC000276610335 351637810 /nfs/dbraw/zinc/63/78/10/351637810.db2.gz RXKZIPDKAZTJIT-UHFFFAOYSA-N 1 2 233.271 2.223 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)Cc1cccc(O)c1 ZINC000577650186 366032948 /nfs/dbraw/zinc/03/29/48/366032948.db2.gz HHFJHLZPLACLAR-UHFFFAOYSA-N 1 2 243.310 2.435 20 0 BEADLO CN(C)c1ccc(NCc2ccncc2)c[nH+]1 ZINC000036988868 358465586 /nfs/dbraw/zinc/46/55/86/358465586.db2.gz QCGUHRVOJQDPLC-UHFFFAOYSA-N 1 2 228.299 2.155 20 0 BEADLO Nc1ccc(NC(=O)[C@H]2CCCC23CC3)c[nH+]1 ZINC000637828837 351677361 /nfs/dbraw/zinc/67/73/61/351677361.db2.gz HPCBKRGOJBKEKL-SNVBAGLBSA-N 1 2 231.299 2.013 20 0 BEADLO C[C@H](CC(=O)N1CCC[C@@H](C)CC1)n1cc[nH+]c1 ZINC000577734534 366047731 /nfs/dbraw/zinc/04/77/31/366047731.db2.gz ABFOYMQZEUUWOF-CHWSQXEVSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)CC[C@H]1CCCO1 ZINC000577746746 366052161 /nfs/dbraw/zinc/05/21/61/366052161.db2.gz FFHUBDKPHFRCDS-GFCCVEGCSA-N 1 2 235.331 2.099 20 0 BEADLO C[N@H+](Cc1ccco1)Cc1ccns1 ZINC000637859267 351716264 /nfs/dbraw/zinc/71/62/64/351716264.db2.gz CNNURFXOPQGZRB-UHFFFAOYSA-N 1 2 208.286 2.368 20 0 BEADLO C[N@@H+](Cc1ccco1)Cc1ccns1 ZINC000637859267 351716268 /nfs/dbraw/zinc/71/62/68/351716268.db2.gz CNNURFXOPQGZRB-UHFFFAOYSA-N 1 2 208.286 2.368 20 0 BEADLO CC[C@@H](NC(=O)C[C@@H](C)n1cc[nH+]c1)C1CC1 ZINC000618861122 351748837 /nfs/dbraw/zinc/74/88/37/351748837.db2.gz UKXJATQQURHJAD-ZYHUDNBSSA-N 1 2 235.331 2.139 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1ccns1 ZINC000637851612 351710555 /nfs/dbraw/zinc/71/05/55/351710555.db2.gz JHYTUQUFSMJJSZ-ZJUUUORDSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1ccns1 ZINC000637851612 351710556 /nfs/dbraw/zinc/71/05/56/351710556.db2.gz JHYTUQUFSMJJSZ-ZJUUUORDSA-N 1 2 226.345 2.142 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1snnc1C ZINC000277594629 351715613 /nfs/dbraw/zinc/71/56/13/351715613.db2.gz RLYBKYKOBLQCGO-UHFFFAOYSA-N 1 2 248.311 2.056 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1[C@H](C)c1cnc(C)nc1C ZINC000637948412 351822492 /nfs/dbraw/zinc/82/24/92/351822492.db2.gz MYMASCVPVXZZSY-DGCLKSJQSA-N 1 2 249.358 2.265 20 0 BEADLO CC[C@@H]1COCC[N@H+]1[C@H](C)c1cnc(C)nc1C ZINC000637948412 351822494 /nfs/dbraw/zinc/82/24/94/351822494.db2.gz MYMASCVPVXZZSY-DGCLKSJQSA-N 1 2 249.358 2.265 20 0 BEADLO CC[C@@H]1CCC[C@@H]1NC(=O)CCc1c[nH+]cn1C ZINC000279819857 351825227 /nfs/dbraw/zinc/82/52/27/351825227.db2.gz IFFBFQFFOHDDBT-YPMHNXCESA-N 1 2 249.358 2.048 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H](C)c1ccco1 ZINC000607646595 351816552 /nfs/dbraw/zinc/81/65/52/351816552.db2.gz KVMBWOHGHYSSFI-JTQLQIEISA-N 1 2 230.267 2.147 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)C1C(C)(C)C1(C)C ZINC000072960900 351816849 /nfs/dbraw/zinc/81/68/49/351816849.db2.gz OGEYQHXXPVMOMY-JTQLQIEISA-N 1 2 249.358 2.070 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H](C)OC(C)(C)C2)sn1 ZINC000637968636 351843421 /nfs/dbraw/zinc/84/34/21/351843421.db2.gz AALUMVWYXKLBQX-SNVBAGLBSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H](C)OC(C)(C)C2)sn1 ZINC000637968636 351843422 /nfs/dbraw/zinc/84/34/22/351843422.db2.gz AALUMVWYXKLBQX-SNVBAGLBSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1CCCC[C@H]1C(=O)NCc1[nH]cc[nH+]1 ZINC000280475365 351845937 /nfs/dbraw/zinc/84/59/37/351845937.db2.gz IQDZBBJPXYUHHY-GHMZBOCLSA-N 1 2 235.331 2.242 20 0 BEADLO CCC[N@@H+](Cc1ccc(=O)[nH]c1)CC(F)F ZINC000637994609 351869465 /nfs/dbraw/zinc/86/94/65/351869465.db2.gz TYJCHZXCMRFKJJ-UHFFFAOYSA-N 1 2 230.258 2.264 20 0 BEADLO CCC[N@H+](Cc1ccc(=O)[nH]c1)CC(F)F ZINC000637994609 351869469 /nfs/dbraw/zinc/86/94/69/351869469.db2.gz TYJCHZXCMRFKJJ-UHFFFAOYSA-N 1 2 230.258 2.264 20 0 BEADLO CC[C@@](C)(C[N@H+](CCOC)CC(F)F)OC ZINC000638013777 351891115 /nfs/dbraw/zinc/89/11/15/351891115.db2.gz DYQJFXZEMQUENA-NSHDSACASA-N 1 2 239.306 2.015 20 0 BEADLO CC[C@@](C)(C[N@@H+](CCOC)CC(F)F)OC ZINC000638013777 351891116 /nfs/dbraw/zinc/89/11/16/351891116.db2.gz DYQJFXZEMQUENA-NSHDSACASA-N 1 2 239.306 2.015 20 0 BEADLO COc1ncc(C[N@@H+]2CCSC[C@@H]2C)s1 ZINC000638085370 351962366 /nfs/dbraw/zinc/96/23/66/351962366.db2.gz YIPZGUOJJIHVCC-QMMMGPOBSA-N 1 2 244.385 2.089 20 0 BEADLO COc1ncc(C[N@H+]2CCSC[C@@H]2C)s1 ZINC000638085370 351962368 /nfs/dbraw/zinc/96/23/68/351962368.db2.gz YIPZGUOJJIHVCC-QMMMGPOBSA-N 1 2 244.385 2.089 20 0 BEADLO Cc1ncc([C@H](C)[N@@H+]2CCO[C@@H](C)[C@@H]2C)c(C)n1 ZINC000638085878 351963294 /nfs/dbraw/zinc/96/32/94/351963294.db2.gz UROIPPRTYMEZJL-SRVKXCTJSA-N 1 2 249.358 2.264 20 0 BEADLO Cc1ncc([C@H](C)[N@H+]2CCO[C@@H](C)[C@@H]2C)c(C)n1 ZINC000638085878 351963296 /nfs/dbraw/zinc/96/32/96/351963296.db2.gz UROIPPRTYMEZJL-SRVKXCTJSA-N 1 2 249.358 2.264 20 0 BEADLO CC(C)CN(C(=O)C=Cc1c[nH]c[nH+]1)C(C)C ZINC000283426162 351969967 /nfs/dbraw/zinc/96/99/67/351969967.db2.gz IZFPXGDAGBXQAJ-AATRIKPKSA-N 1 2 235.331 2.316 20 0 BEADLO Cn1ccnc1[C@@H](C1CC1)[N@H+](C)Cc1ccc[nH]1 ZINC000638150805 352011997 /nfs/dbraw/zinc/01/19/97/352011997.db2.gz YGLBLRLZBKBYJA-CYBMUJFWSA-N 1 2 244.342 2.331 20 0 BEADLO Cn1ccnc1[C@@H](C1CC1)[N@@H+](C)Cc1ccc[nH]1 ZINC000638150805 352011999 /nfs/dbraw/zinc/01/19/99/352011999.db2.gz YGLBLRLZBKBYJA-CYBMUJFWSA-N 1 2 244.342 2.331 20 0 BEADLO COc1ncc(C[N@H+](C)Cc2ccc[nH]2)s1 ZINC000638150856 352012079 /nfs/dbraw/zinc/01/20/79/352012079.db2.gz ZWLWNSISIXBQQX-UHFFFAOYSA-N 1 2 237.328 2.112 20 0 BEADLO COc1ncc(C[N@@H+](C)Cc2ccc[nH]2)s1 ZINC000638150856 352012080 /nfs/dbraw/zinc/01/20/80/352012080.db2.gz ZWLWNSISIXBQQX-UHFFFAOYSA-N 1 2 237.328 2.112 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC(C)(C)[C@@H]2C)sn1 ZINC000638096717 351976563 /nfs/dbraw/zinc/97/65/63/351976563.db2.gz RCJLBVCEZLXRTC-JTQLQIEISA-N 1 2 240.372 2.451 20 0 BEADLO Cc1cc(C[N@H+]2CCOC(C)(C)[C@@H]2C)sn1 ZINC000638096717 351976565 /nfs/dbraw/zinc/97/65/65/351976565.db2.gz RCJLBVCEZLXRTC-JTQLQIEISA-N 1 2 240.372 2.451 20 0 BEADLO C[N@H+](Cc1ccon1)Cc1cccc(F)c1N ZINC000638101155 351979466 /nfs/dbraw/zinc/97/94/66/351979466.db2.gz OCURIGXWEFJWBY-UHFFFAOYSA-N 1 2 235.262 2.028 20 0 BEADLO C[N@@H+](Cc1ccon1)Cc1cccc(F)c1N ZINC000638101155 351979469 /nfs/dbraw/zinc/97/94/69/351979469.db2.gz OCURIGXWEFJWBY-UHFFFAOYSA-N 1 2 235.262 2.028 20 0 BEADLO CO[C@@](C)(CNc1ccc(N(C)C)[nH+]c1)C1CC1 ZINC000638272657 352108653 /nfs/dbraw/zinc/10/86/53/352108653.db2.gz BPKJZZLFGPRTAY-AWEZNQCLSA-N 1 2 249.358 2.375 20 0 BEADLO CCOC1CC(CNc2cccc[nH+]2)C1 ZINC000638398205 352205403 /nfs/dbraw/zinc/20/54/03/352205403.db2.gz SPDVYARXZKLZLD-UHFFFAOYSA-N 1 2 206.289 2.309 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccns2)C2(CCC2)CO1 ZINC000630072911 363155605 /nfs/dbraw/zinc/15/56/05/363155605.db2.gz MIYCQNQZENFWDS-SNVBAGLBSA-N 1 2 238.356 2.287 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccns2)C2(CCC2)CO1 ZINC000630072911 363155613 /nfs/dbraw/zinc/15/56/13/363155613.db2.gz MIYCQNQZENFWDS-SNVBAGLBSA-N 1 2 238.356 2.287 20 0 BEADLO C[C@@]1(C2CC2)C[N@H+](Cc2ccns2)CCO1 ZINC000630075976 363163108 /nfs/dbraw/zinc/16/31/08/363163108.db2.gz JLTRPYWPJJRZTL-LBPRGKRZSA-N 1 2 238.356 2.144 20 0 BEADLO C[C@@]1(C2CC2)C[N@@H+](Cc2ccns2)CCO1 ZINC000630075976 363163112 /nfs/dbraw/zinc/16/31/12/363163112.db2.gz JLTRPYWPJJRZTL-LBPRGKRZSA-N 1 2 238.356 2.144 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000294371487 352376410 /nfs/dbraw/zinc/37/64/10/352376410.db2.gz GUTHRILTEKPLHG-YNEHKIRRSA-N 1 2 249.358 2.214 20 0 BEADLO Cc1cc(NC[C@@H]2C[C@H]2C2CCC2)nc[nH+]1 ZINC000425289190 191199710 /nfs/dbraw/zinc/19/97/10/191199710.db2.gz YZOABFHAAZEGGM-RYUDHWBXSA-N 1 2 217.316 2.055 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)N1CCn2c[nH+]cc2C1 ZINC000295898911 352426669 /nfs/dbraw/zinc/42/66/69/352426669.db2.gz CYHDEQRMIWFKHA-YPMHNXCESA-N 1 2 247.342 2.052 20 0 BEADLO FC(F)[C@H]1CCC[N@@H+]1CCc1cncs1 ZINC000411725260 191207356 /nfs/dbraw/zinc/20/73/56/191207356.db2.gz NRURHBMOKLCEND-SECBINFHSA-N 1 2 232.299 2.415 20 0 BEADLO FC(F)[C@H]1CCC[N@H+]1CCc1cncs1 ZINC000411725260 191207359 /nfs/dbraw/zinc/20/73/59/191207359.db2.gz NRURHBMOKLCEND-SECBINFHSA-N 1 2 232.299 2.415 20 0 BEADLO C[C@H](O)CC[NH2+][C@H](c1ccccc1)C(F)F ZINC000411761128 191209115 /nfs/dbraw/zinc/20/91/15/191209115.db2.gz UCWFIRCSFMHOTP-GXSJLCMTSA-N 1 2 229.270 2.353 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2nccs2)n(C)n1 ZINC000084244686 352467214 /nfs/dbraw/zinc/46/72/14/352467214.db2.gz FKJMTFLEJWXUPP-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO COC[C@@H]([NH2+]Cc1ccns1)c1ccco1 ZINC000638721767 352573017 /nfs/dbraw/zinc/57/30/17/352573017.db2.gz RJMPVNVHTSCDEI-SNVBAGLBSA-N 1 2 238.312 2.213 20 0 BEADLO C[C@H]1CCC[C@@H](CCNC(=O)Cn2cc[nH+]c2)C1 ZINC000073732226 352672522 /nfs/dbraw/zinc/67/25/22/352672522.db2.gz GWGASHRHXMIQBK-STQMWFEESA-N 1 2 249.358 2.216 20 0 BEADLO Cc1ccc(NCCC[C@@H]2CCO2)c[nH+]1 ZINC000638761833 352699587 /nfs/dbraw/zinc/69/95/87/352699587.db2.gz LVBATSISESEUPK-GFCCVEGCSA-N 1 2 206.289 2.371 20 0 BEADLO CCn1nncc1C[N@H+](CC)Cc1occc1C ZINC000412023943 191238680 /nfs/dbraw/zinc/23/86/80/191238680.db2.gz DRZWUTDMJMECAE-UHFFFAOYSA-N 1 2 248.330 2.222 20 0 BEADLO CCn1nncc1C[N@@H+](CC)Cc1occc1C ZINC000412023943 191238683 /nfs/dbraw/zinc/23/86/83/191238683.db2.gz DRZWUTDMJMECAE-UHFFFAOYSA-N 1 2 248.330 2.222 20 0 BEADLO CC[N@H+](Cc1occc1C)[C@H](C)c1nncn1C ZINC000412023615 191238689 /nfs/dbraw/zinc/23/86/89/191238689.db2.gz CVFSNJFSDCMFNP-LLVKDONJSA-N 1 2 248.330 2.300 20 0 BEADLO CC[N@@H+](Cc1occc1C)[C@H](C)c1nncn1C ZINC000412023615 191238692 /nfs/dbraw/zinc/23/86/92/191238692.db2.gz CVFSNJFSDCMFNP-LLVKDONJSA-N 1 2 248.330 2.300 20 0 BEADLO CC[C@@H](C(=O)OC)[N@H+](CC)Cc1occc1C ZINC000412024477 191240329 /nfs/dbraw/zinc/24/03/29/191240329.db2.gz CDRXGXKDFWRBHG-NSHDSACASA-N 1 2 239.315 2.362 20 0 BEADLO CC[C@@H](C(=O)OC)[N@@H+](CC)Cc1occc1C ZINC000412024477 191240332 /nfs/dbraw/zinc/24/03/32/191240332.db2.gz CDRXGXKDFWRBHG-NSHDSACASA-N 1 2 239.315 2.362 20 0 BEADLO Cc1nc(N2CCNc3ccccc3C2)cc[nH+]1 ZINC000608079500 352722783 /nfs/dbraw/zinc/72/27/83/352722783.db2.gz JTSRXJQVCFENSF-UHFFFAOYSA-N 1 2 240.310 2.217 20 0 BEADLO CC(C)C[N@@H+]1CC(=O)N[C@@H]1[C@H]1CCCC[C@H]1C ZINC000342249076 352739865 /nfs/dbraw/zinc/73/98/65/352739865.db2.gz DSYPEERTJMXXRH-DYEKYZERSA-N 1 2 238.375 2.227 20 0 BEADLO CC(C)C[N@H+]1CC(=O)N[C@@H]1[C@H]1CCCC[C@H]1C ZINC000342249076 352739866 /nfs/dbraw/zinc/73/98/66/352739866.db2.gz DSYPEERTJMXXRH-DYEKYZERSA-N 1 2 238.375 2.227 20 0 BEADLO Cc1c[nH+]cc(NCCC[C@H]2CCO2)c1 ZINC000638787555 352743377 /nfs/dbraw/zinc/74/33/77/352743377.db2.gz OKJJARUZMAHCLS-LBPRGKRZSA-N 1 2 206.289 2.371 20 0 BEADLO CC1(C)C[C@@H]1C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000334179179 352765194 /nfs/dbraw/zinc/76/51/94/352765194.db2.gz CHYFHUIKWGQVFM-LLVKDONJSA-N 1 2 247.342 2.162 20 0 BEADLO CC1(C)C[C@@H]1C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000334179179 352765197 /nfs/dbraw/zinc/76/51/97/352765197.db2.gz CHYFHUIKWGQVFM-LLVKDONJSA-N 1 2 247.342 2.162 20 0 BEADLO C[C@@H]1c2ccccc2C[N@H+]1Cc1ccn(C)n1 ZINC000334217590 352818860 /nfs/dbraw/zinc/81/88/60/352818860.db2.gz WZEOKVFEHHAAEU-LLVKDONJSA-N 1 2 227.311 2.497 20 0 BEADLO C[C@@H]1c2ccccc2C[N@@H+]1Cc1ccn(C)n1 ZINC000334217590 352818863 /nfs/dbraw/zinc/81/88/63/352818863.db2.gz WZEOKVFEHHAAEU-LLVKDONJSA-N 1 2 227.311 2.497 20 0 BEADLO C(c1noc(C2CC2)n1)[N@@H+]1CCCC12CCC2 ZINC000334219673 352821191 /nfs/dbraw/zinc/82/11/91/352821191.db2.gz ZVLKHEHSLBHVCR-UHFFFAOYSA-N 1 2 233.315 2.466 20 0 BEADLO C(c1noc(C2CC2)n1)[N@H+]1CCCC12CCC2 ZINC000334219673 352821194 /nfs/dbraw/zinc/82/11/94/352821194.db2.gz ZVLKHEHSLBHVCR-UHFFFAOYSA-N 1 2 233.315 2.466 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1nncn1-c1ccccc1 ZINC000334220831 352823607 /nfs/dbraw/zinc/82/36/07/352823607.db2.gz SERVHMCKKVUJQE-NWDGAFQWSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1nncn1-c1ccccc1 ZINC000334220831 352823611 /nfs/dbraw/zinc/82/36/11/352823611.db2.gz SERVHMCKKVUJQE-NWDGAFQWSA-N 1 2 242.326 2.108 20 0 BEADLO Cc1nocc1C[N@@H+]1C[C@]2(CCCO2)[C@@H]1C1CC1 ZINC000334205431 352800338 /nfs/dbraw/zinc/80/03/38/352800338.db2.gz XTVNYGAYCDBRII-UONOGXRCSA-N 1 2 248.326 2.126 20 0 BEADLO Cc1nocc1C[N@H+]1C[C@]2(CCCO2)[C@@H]1C1CC1 ZINC000334205431 352800340 /nfs/dbraw/zinc/80/03/40/352800340.db2.gz XTVNYGAYCDBRII-UONOGXRCSA-N 1 2 248.326 2.126 20 0 BEADLO CC1(C)OCC[C@@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000296362911 187864026 /nfs/dbraw/zinc/86/40/26/187864026.db2.gz SBLIUUYXEDLDDV-JTQLQIEISA-N 1 2 233.315 2.333 20 0 BEADLO C[N@H+](Cc1noc(C2CC2)n1)[C@@H]1C=CCCC1 ZINC000412076503 191252608 /nfs/dbraw/zinc/25/26/08/191252608.db2.gz PRLBWPIRKRRMGL-LLVKDONJSA-N 1 2 233.315 2.488 20 0 BEADLO C[N@@H+](Cc1noc(C2CC2)n1)[C@@H]1C=CCCC1 ZINC000412076503 191252611 /nfs/dbraw/zinc/25/26/11/191252611.db2.gz PRLBWPIRKRRMGL-LLVKDONJSA-N 1 2 233.315 2.488 20 0 BEADLO Cc1c[nH+]c(CN2CCc3cc(F)ccc32)n1C ZINC000342855001 352876400 /nfs/dbraw/zinc/87/64/00/352876400.db2.gz HSYXDZYAQAOHHP-UHFFFAOYSA-N 1 2 245.301 2.430 20 0 BEADLO CC(C)CC(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000334247800 352839694 /nfs/dbraw/zinc/83/96/94/352839694.db2.gz NDOCDIJMVAHYDW-SNVBAGLBSA-N 1 2 221.304 2.119 20 0 BEADLO Cc1cc(F)ccc1CN1CCn2cc[nH+]c2C1 ZINC000334288643 352926999 /nfs/dbraw/zinc/92/69/99/352926999.db2.gz ZNEWXKUZEJQPNC-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO Cc1cn2cc(NC(=O)C3=CCC3)ccc2[nH+]1 ZINC000334262102 352894714 /nfs/dbraw/zinc/89/47/14/352894714.db2.gz YVRNRJHQGSJPFY-UHFFFAOYSA-N 1 2 227.267 2.301 20 0 BEADLO Cc1cc(NC(=O)N2CC(C3CCC3)C2)cc[nH+]1 ZINC000334319749 352951692 /nfs/dbraw/zinc/95/16/92/352951692.db2.gz UTZZZFAOXGZSKB-UHFFFAOYSA-N 1 2 245.326 2.076 20 0 BEADLO CCc1cccnc1C(=O)Nc1cc[nH+]c(C)c1 ZINC000334375936 353032077 /nfs/dbraw/zinc/03/20/77/353032077.db2.gz DQEYGPNENVXZGK-UHFFFAOYSA-N 1 2 241.294 2.022 20 0 BEADLO CCc1nn(C)cc1CNc1ccc(C)[nH+]c1 ZINC000092412598 538107023 /nfs/dbraw/zinc/10/70/23/538107023.db2.gz IUUFDULNFZVSRR-UHFFFAOYSA-N 1 2 230.315 2.298 20 0 BEADLO COc1ncc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)s1 ZINC000638910557 353074869 /nfs/dbraw/zinc/07/48/69/353074869.db2.gz SGWDSBIETMIWOO-SCZZXKLOSA-N 1 2 244.335 2.332 20 0 BEADLO COc1ncc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)s1 ZINC000638910557 353074872 /nfs/dbraw/zinc/07/48/72/353074872.db2.gz SGWDSBIETMIWOO-SCZZXKLOSA-N 1 2 244.335 2.332 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2ccns2)C[C@@H]1F ZINC000638910916 353075667 /nfs/dbraw/zinc/07/56/67/353075667.db2.gz WCECPHQDAVVUAV-SCZZXKLOSA-N 1 2 214.309 2.323 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2ccns2)C[C@@H]1F ZINC000638910916 353075671 /nfs/dbraw/zinc/07/56/71/353075671.db2.gz WCECPHQDAVVUAV-SCZZXKLOSA-N 1 2 214.309 2.323 20 0 BEADLO OCC(F)(F)C[NH2+]Cc1ccccc1C1CC1 ZINC000231777083 538107433 /nfs/dbraw/zinc/10/74/33/538107433.db2.gz HPIQPXIYTKRQPT-UHFFFAOYSA-N 1 2 241.281 2.281 20 0 BEADLO C[C@@H]1Oc2cc(F)ccc2[C@@H]1[NH2+]Cc1ncc[nH]1 ZINC000334430111 353104945 /nfs/dbraw/zinc/10/49/45/353104945.db2.gz UXBOAPVGSMHJLS-ISVAXAHUSA-N 1 2 247.273 2.161 20 0 BEADLO CC(C)(C)n1ncc2c1nc[nH+]c2NC1CC1 ZINC000301902839 188060008 /nfs/dbraw/zinc/06/00/08/188060008.db2.gz WUDXPAMZAMJASO-UHFFFAOYSA-N 1 2 231.303 2.156 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000360800929 188070043 /nfs/dbraw/zinc/07/00/43/188070043.db2.gz IWZGMHZKJJPQMS-GXFFZTMASA-N 1 2 235.331 2.050 20 0 BEADLO C/C(=C/c1ccccc1)C[NH+]1CCS(=O)CC1 ZINC000119417876 188073472 /nfs/dbraw/zinc/07/34/72/188073472.db2.gz IRFPIFKLMOUGFC-QBFSEMIESA-N 1 2 249.379 2.154 20 0 BEADLO CC(C)c1nc(N2CCOC[C@H](C)C2)cc[nH+]1 ZINC000378258256 188078509 /nfs/dbraw/zinc/07/85/09/188078509.db2.gz HEWVMAXDKXSNBH-LLVKDONJSA-N 1 2 235.331 2.073 20 0 BEADLO CCc1cc(NCC2(C)CCOCC2)nc[nH+]1 ZINC000227824505 538108990 /nfs/dbraw/zinc/10/89/90/538108990.db2.gz NMRKCSRMVUZCRU-UHFFFAOYSA-N 1 2 235.331 2.268 20 0 BEADLO CC(C)=CC(=O)NCc1cn2cc(C)ccc2[nH+]1 ZINC000060403364 188128566 /nfs/dbraw/zinc/12/85/66/188128566.db2.gz DEVYXMMXFXXJGG-UHFFFAOYSA-N 1 2 243.310 2.225 20 0 BEADLO CC(C)=CC(=O)NCc1cn2c(cccc2C)[nH+]1 ZINC000068571971 188128933 /nfs/dbraw/zinc/12/89/33/188128933.db2.gz YNMDAXOSOMNEKS-UHFFFAOYSA-N 1 2 243.310 2.225 20 0 BEADLO CC(C)N(C(=O)CCn1cc[nH+]c1)C1CCCC1 ZINC000264628267 188194587 /nfs/dbraw/zinc/19/45/87/188194587.db2.gz JFQDPHNBVMEFFZ-UHFFFAOYSA-N 1 2 249.358 2.453 20 0 BEADLO Cc1nc(N2CCC[C@H](C)CC2)cc[nH+]1 ZINC000266112881 188195831 /nfs/dbraw/zinc/19/58/31/188195831.db2.gz KSLQPXCQQBVJOP-JTQLQIEISA-N 1 2 205.305 2.411 20 0 BEADLO C/C(=C\C(=O)N(C)CCCn1cc[nH+]c1)C1CC1 ZINC000269003197 188198077 /nfs/dbraw/zinc/19/80/77/188198077.db2.gz VTRZUHDFUWFQON-ZRDIBKRKSA-N 1 2 247.342 2.088 20 0 BEADLO FC(F)[C@H](Cc1ccccc1)[NH2+][C@H]1CCOC1 ZINC000358246429 180910169 /nfs/dbraw/zinc/91/01/69/180910169.db2.gz DMNHZNHODLFMQL-RYUDHWBXSA-N 1 2 241.281 2.241 20 0 BEADLO CC(C)[N@H+](Cc1ncnn1C(C)(C)C)C1CC1 ZINC000338229832 188188207 /nfs/dbraw/zinc/18/82/07/188188207.db2.gz CDDZKKINKNTPIX-UHFFFAOYSA-N 1 2 236.363 2.406 20 0 BEADLO CC(C)[N@@H+](Cc1ncnn1C(C)(C)C)C1CC1 ZINC000338229832 188188209 /nfs/dbraw/zinc/18/82/09/188188209.db2.gz CDDZKKINKNTPIX-UHFFFAOYSA-N 1 2 236.363 2.406 20 0 BEADLO FC(F)CN1CC[NH+](Cc2cccs2)CC1 ZINC000106445824 180901463 /nfs/dbraw/zinc/90/14/63/180901463.db2.gz MWGZFZUSPYEZNL-UHFFFAOYSA-N 1 2 246.326 2.131 20 0 BEADLO COc1ccc(C[N@@H+]2CCC[C@@](C)(F)C2)nc1 ZINC000295313463 188213986 /nfs/dbraw/zinc/21/39/86/188213986.db2.gz GDQGFWAGVHEUEZ-CYBMUJFWSA-N 1 2 238.306 2.414 20 0 BEADLO COc1ccc(C[N@H+]2CCC[C@@](C)(F)C2)nc1 ZINC000295313463 188213987 /nfs/dbraw/zinc/21/39/87/188213987.db2.gz GDQGFWAGVHEUEZ-CYBMUJFWSA-N 1 2 238.306 2.414 20 0 BEADLO CC(C)N(CC1CCC1)C(=O)CCn1cc[nH+]c1 ZINC000277786817 188202819 /nfs/dbraw/zinc/20/28/19/188202819.db2.gz UVXJGNONGCJMCR-UHFFFAOYSA-N 1 2 249.358 2.310 20 0 BEADLO COc1ccccc1[C@H](C)[NH2+]Cc1cn(C)cn1 ZINC000311144785 538113006 /nfs/dbraw/zinc/11/30/06/538113006.db2.gz UPXOFAZBLBHKPE-NSHDSACASA-N 1 2 245.326 2.280 20 0 BEADLO CC(C)[N@H+](Cc1cscn1)[C@H]1CCOC1 ZINC000291236771 188211900 /nfs/dbraw/zinc/21/19/00/188211900.db2.gz KVVWWXXVNKIODX-NSHDSACASA-N 1 2 226.345 2.142 20 0 BEADLO CC(C)[N@@H+](Cc1cscn1)[C@H]1CCOC1 ZINC000291236771 188211901 /nfs/dbraw/zinc/21/19/01/188211901.db2.gz KVVWWXXVNKIODX-NSHDSACASA-N 1 2 226.345 2.142 20 0 BEADLO COc1ccc(NCc2csc(C)n2)[nH+]c1 ZINC000225894388 538114566 /nfs/dbraw/zinc/11/45/66/538114566.db2.gz ALXWNGBNTMBAGQ-UHFFFAOYSA-N 1 2 235.312 2.467 20 0 BEADLO Cc1nc(N[C@@H](c2nccn2C)C2CC2)cc[nH+]1 ZINC000343287606 353358841 /nfs/dbraw/zinc/35/88/41/353358841.db2.gz PDLLCJYFYAFLLP-GFCCVEGCSA-N 1 2 243.314 2.082 20 0 BEADLO C[C@H]1CCC[C@H](CC(=O)NCc2[nH+]ccn2C)C1 ZINC000343283299 353344576 /nfs/dbraw/zinc/34/45/76/353344576.db2.gz ASSFNEXCEGMDEI-RYUDHWBXSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H](C)O[C@H](C)[C@H]2C)sn1 ZINC000639085531 353425640 /nfs/dbraw/zinc/42/56/40/353425640.db2.gz HJNAYYLPNXTAMD-HBNTYKKESA-N 1 2 240.372 2.449 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H](C)O[C@H](C)[C@H]2C)sn1 ZINC000639085531 353425641 /nfs/dbraw/zinc/42/56/41/353425641.db2.gz HJNAYYLPNXTAMD-HBNTYKKESA-N 1 2 240.372 2.449 20 0 BEADLO Cc1cnc([C@H](C)Nc2cc[nH+]c(C)n2)o1 ZINC000226547902 538116708 /nfs/dbraw/zinc/11/67/08/538116708.db2.gz VGUQVMDOJNASCW-QMMMGPOBSA-N 1 2 218.260 2.255 20 0 BEADLO CCc1cc(N[C@@H]2CCCCC[C@H]2O)nc[nH+]1 ZINC000135817364 538117154 /nfs/dbraw/zinc/11/71/54/538117154.db2.gz PCERJIFWQQUUNQ-VXGBXAGGSA-N 1 2 235.331 2.145 20 0 BEADLO Cc1c[nH+]cc(N[C@@H](C)[C@H]2CCCO2)c1 ZINC000309036264 491051937 /nfs/dbraw/zinc/05/19/37/491051937.db2.gz GFYYGDACCRSVQS-CMPLNLGQSA-N 1 2 206.289 2.369 20 0 BEADLO C[C@H]([NH2+]CC(F)F)c1ccc2c(c1)OCO2 ZINC000147345288 538117587 /nfs/dbraw/zinc/11/75/87/538117587.db2.gz VXEXJTOYPMHFAZ-ZETCQYMHSA-N 1 2 229.226 2.331 20 0 BEADLO CC(C)C1(C[N@@H+]2C[C@@H](O)CC(F)(F)C2)CC1 ZINC000639095580 353475389 /nfs/dbraw/zinc/47/53/89/353475389.db2.gz QFYDNMYIFINEOA-JTQLQIEISA-N 1 2 233.302 2.125 20 0 BEADLO CC(C)C1(C[N@H+]2C[C@@H](O)CC(F)(F)C2)CC1 ZINC000639095580 353475391 /nfs/dbraw/zinc/47/53/91/353475391.db2.gz QFYDNMYIFINEOA-JTQLQIEISA-N 1 2 233.302 2.125 20 0 BEADLO Cc1cc(N[C@H](C)C2CCOCC2)nc[nH+]1 ZINC000230217581 353476210 /nfs/dbraw/zinc/47/62/10/353476210.db2.gz VIQIFFJLKLOHGL-SNVBAGLBSA-N 1 2 221.304 2.012 20 0 BEADLO CO[C@@H]1CC[C@@H](NC(=O)Nc2cc[nH+]c(C)c2)C1 ZINC000189754230 353534723 /nfs/dbraw/zinc/53/47/23/353534723.db2.gz YPUCUQFRVVFJDF-ZYHUDNBSSA-N 1 2 249.314 2.079 20 0 BEADLO CCC[C@H]([NH2+]Cc1c[nH]nn1)C1CCCC1 ZINC000398404684 363232830 /nfs/dbraw/zinc/23/28/30/363232830.db2.gz OKNOCTRJCOUBFN-LBPRGKRZSA-N 1 2 222.336 2.253 20 0 BEADLO CCC[C@H]([NH2+]Cc1cn[nH]n1)C1CCCC1 ZINC000398404684 363232833 /nfs/dbraw/zinc/23/28/33/363232833.db2.gz OKNOCTRJCOUBFN-LBPRGKRZSA-N 1 2 222.336 2.253 20 0 BEADLO CC(C)(C)OC1CC[NH+](Cc2ncccn2)CC1 ZINC000361830329 188426878 /nfs/dbraw/zinc/42/68/78/188426878.db2.gz QMOHMFLTGDEBLB-UHFFFAOYSA-N 1 2 249.358 2.256 20 0 BEADLO CNc1[nH+]cnc2c1cnn2CCC(C)(C)C ZINC000194431158 353653115 /nfs/dbraw/zinc/65/31/15/353653115.db2.gz VUSKQZSKXCODHA-UHFFFAOYSA-N 1 2 233.319 2.304 20 0 BEADLO Cn1cc[nH+]c1CSc1nccs1 ZINC000064669835 353680367 /nfs/dbraw/zinc/68/03/67/353680367.db2.gz LYQORCAUYGUILY-UHFFFAOYSA-N 1 2 211.315 2.169 20 0 BEADLO Fc1cccc(F)c1C[NH+]1CC2(C1)CCOC2 ZINC000293875317 181000705 /nfs/dbraw/zinc/00/07/05/181000705.db2.gz CTOFJXVWNRLCMK-UHFFFAOYSA-N 1 2 239.265 2.187 20 0 BEADLO Fc1cccc2c1OCC[C@@H]2[NH2+]Cc1cc[nH]n1 ZINC000191128941 181006383 /nfs/dbraw/zinc/00/63/83/181006383.db2.gz HXJYJLCYDMBWFF-LBPRGKRZSA-N 1 2 247.273 2.162 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccns2)C[C@@H](C2CC2)O1 ZINC000639116923 353742340 /nfs/dbraw/zinc/74/23/40/353742340.db2.gz AXCZWNKFFBVMEH-CABZTGNLSA-N 1 2 238.356 2.142 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccns2)C[C@@H](C2CC2)O1 ZINC000639116923 353742343 /nfs/dbraw/zinc/74/23/43/353742343.db2.gz AXCZWNKFFBVMEH-CABZTGNLSA-N 1 2 238.356 2.142 20 0 BEADLO COc1ccccc1C[NH2+][C@@H](C)c1nc(C)no1 ZINC000074071583 353742445 /nfs/dbraw/zinc/74/24/45/353742445.db2.gz YGXRMRGRVKDQSS-VIFPVBQESA-N 1 2 247.298 2.237 20 0 BEADLO Fc1ccccc1OCCOCc1[nH]cc[nH+]1 ZINC000123886174 181015131 /nfs/dbraw/zinc/01/51/31/181015131.db2.gz MKYOHMULBCRKKP-UHFFFAOYSA-N 1 2 236.246 2.144 20 0 BEADLO CCOC(=O)C[N@@H+]1CCC[C@H]1c1cccs1 ZINC000053096021 353814892 /nfs/dbraw/zinc/81/48/92/353814892.db2.gz OTLGJZISONTYKU-JTQLQIEISA-N 1 2 239.340 2.448 20 0 BEADLO CCOC(=O)C[N@H+]1CCC[C@H]1c1cccs1 ZINC000053096021 353814897 /nfs/dbraw/zinc/81/48/97/353814897.db2.gz OTLGJZISONTYKU-JTQLQIEISA-N 1 2 239.340 2.448 20 0 BEADLO Fc1cncc(CNc2cc[nH+]cc2F)c1 ZINC000309516529 181020467 /nfs/dbraw/zinc/02/04/67/181020467.db2.gz AAPSHPMKDDRONF-UHFFFAOYSA-N 1 2 221.210 2.367 20 0 BEADLO Cc1ncc([C@@H](C)[N@@H+]2CCOCC23CC3)c(C)n1 ZINC000639144266 353851052 /nfs/dbraw/zinc/85/10/52/353851052.db2.gz UJNPEIAMCDSHSY-LLVKDONJSA-N 1 2 247.342 2.019 20 0 BEADLO Cc1ncc([C@@H](C)[N@H+]2CCOCC23CC3)c(C)n1 ZINC000639144266 353851053 /nfs/dbraw/zinc/85/10/53/353851053.db2.gz UJNPEIAMCDSHSY-LLVKDONJSA-N 1 2 247.342 2.019 20 0 BEADLO O=c1ccc(C[N@H+]2CCCC[C@H]2C(F)F)c[nH]1 ZINC000639137736 353854432 /nfs/dbraw/zinc/85/44/32/353854432.db2.gz HORKRXIQGLZVLP-JTQLQIEISA-N 1 2 242.269 2.407 20 0 BEADLO O=c1ccc(C[N@@H+]2CCCC[C@H]2C(F)F)c[nH]1 ZINC000639137736 353854434 /nfs/dbraw/zinc/85/44/34/353854434.db2.gz HORKRXIQGLZVLP-JTQLQIEISA-N 1 2 242.269 2.407 20 0 BEADLO CC[C@@](C)(C[NH2+]C1(C(F)F)CC1)OC ZINC000639139335 353855980 /nfs/dbraw/zinc/85/59/80/353855980.db2.gz JIAYXGJYCXPURX-VIFPVBQESA-N 1 2 207.264 2.189 20 0 BEADLO C[C@H]1OCC[C@]1(C)Nc1cc[nH+]c(C2CC2)n1 ZINC000343493146 353910784 /nfs/dbraw/zinc/91/07/84/353910784.db2.gz BDLQVAMKIGGMJQ-RNCFNFMXSA-N 1 2 233.315 2.333 20 0 BEADLO CO[C@H]1C[C@H](Nc2cccc[nH+]2)C12CCC2 ZINC000334533977 353913382 /nfs/dbraw/zinc/91/33/82/353913382.db2.gz GKAPYFFBVWVFTL-QWRGUYRKSA-N 1 2 218.300 2.451 20 0 BEADLO Cn1ccc(C[N@@H+]2CCC[C@@H]2C(F)F)c1 ZINC000334538776 353926026 /nfs/dbraw/zinc/92/60/26/353926026.db2.gz OPADKYHGULPHNU-SNVBAGLBSA-N 1 2 214.259 2.255 20 0 BEADLO Cn1ccc(C[N@H+]2CCC[C@@H]2C(F)F)c1 ZINC000334538776 353926028 /nfs/dbraw/zinc/92/60/28/353926028.db2.gz OPADKYHGULPHNU-SNVBAGLBSA-N 1 2 214.259 2.255 20 0 BEADLO Cn1ccc(C[NH2+]C2(c3ccccc3F)CC2)n1 ZINC000343589350 353941046 /nfs/dbraw/zinc/94/10/46/353941046.db2.gz VQGYHDYYCNNLTO-UHFFFAOYSA-N 1 2 245.301 2.338 20 0 BEADLO C[C@]1(F)CCC[N@H+](CCn2cc(Cl)cn2)C1 ZINC000334549445 353976700 /nfs/dbraw/zinc/97/67/00/353976700.db2.gz DQWCVCWWBIROGW-NSHDSACASA-N 1 2 245.729 2.361 20 0 BEADLO C[C@]1(F)CCC[N@@H+](CCn2cc(Cl)cn2)C1 ZINC000334549445 353976705 /nfs/dbraw/zinc/97/67/05/353976705.db2.gz DQWCVCWWBIROGW-NSHDSACASA-N 1 2 245.729 2.361 20 0 BEADLO CC1(C[NH2+][C@@H](c2nnc[nH]2)c2ccccc2)CC1 ZINC000343650727 353954170 /nfs/dbraw/zinc/95/41/70/353954170.db2.gz BVRVSXVOERRJLD-GFCCVEGCSA-N 1 2 242.326 2.284 20 0 BEADLO C[C@H]1CC[C@H]1[NH+]=c1[nH]c2cccc(F)c2n1C ZINC000343807575 354010025 /nfs/dbraw/zinc/01/00/25/354010025.db2.gz LPAIPLOVKKVILF-WCBMZHEXSA-N 1 2 233.290 2.345 20 0 BEADLO CC(C)=CC[N@H+]1CCN(CC(C)C)C(=O)[C@@H]1C ZINC000343818556 354013854 /nfs/dbraw/zinc/01/38/54/354013854.db2.gz NFQLEAPHOVZZRB-ZDUSSCGKSA-N 1 2 238.375 2.141 20 0 BEADLO CC(C)=CC[N@@H+]1CCN(CC(C)C)C(=O)[C@@H]1C ZINC000343818556 354013858 /nfs/dbraw/zinc/01/38/58/354013858.db2.gz NFQLEAPHOVZZRB-ZDUSSCGKSA-N 1 2 238.375 2.141 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc3c(n2)CCC3)C[C@H](C)O1 ZINC000334549905 354017432 /nfs/dbraw/zinc/01/74/32/354017432.db2.gz YKMDVYROOIRRIN-TXEJJXNPSA-N 1 2 246.354 2.180 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc3c(n2)CCC3)C[C@H](C)O1 ZINC000334549905 354017435 /nfs/dbraw/zinc/01/74/35/354017435.db2.gz YKMDVYROOIRRIN-TXEJJXNPSA-N 1 2 246.354 2.180 20 0 BEADLO CC[C@]1(C)C[C@@H]1C(=O)NC[C@H](C)Cn1cc[nH+]c1 ZINC000343783117 354018188 /nfs/dbraw/zinc/01/81/88/354018188.db2.gz VDALKTPTYIIOEH-OUCADQQQSA-N 1 2 249.358 2.072 20 0 BEADLO C[C@H]1CC[N@H+](C[C@@H](O)C(C)(C)C)CC1(F)F ZINC000343938946 354048617 /nfs/dbraw/zinc/04/86/17/354048617.db2.gz UDNBDFFFHXLNRP-VHSXEESVSA-N 1 2 235.318 2.371 20 0 BEADLO C[C@H]1CC[N@@H+](C[C@@H](O)C(C)(C)C)CC1(F)F ZINC000343938946 354048619 /nfs/dbraw/zinc/04/86/19/354048619.db2.gz UDNBDFFFHXLNRP-VHSXEESVSA-N 1 2 235.318 2.371 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)CC1CC1 ZINC000334569646 354095491 /nfs/dbraw/zinc/09/54/91/354095491.db2.gz SUSKEZYAYOZDHH-UHFFFAOYSA-N 1 2 204.273 2.437 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)c1ccccn1 ZINC000334569917 354096653 /nfs/dbraw/zinc/09/66/53/354096653.db2.gz ZWLOAPJNTQTALX-UHFFFAOYSA-N 1 2 227.267 2.346 20 0 BEADLO C[C@H]1CC[C@@](C)(C(=O)NCc2c[nH+]c[nH]2)C1(C)C ZINC000334571407 354100156 /nfs/dbraw/zinc/10/01/56/354100156.db2.gz LMGKWZYODARFDI-HZMBPMFUSA-N 1 2 249.358 2.488 20 0 BEADLO C[C@H]1CC[C@@](C)(C(=O)NCc2c[nH]c[nH+]2)C1(C)C ZINC000334571407 354100160 /nfs/dbraw/zinc/10/01/60/354100160.db2.gz LMGKWZYODARFDI-HZMBPMFUSA-N 1 2 249.358 2.488 20 0 BEADLO CS[C@H]1CC[C@@H](Nc2cc(C)[nH+]cn2)C1 ZINC000230917324 363328474 /nfs/dbraw/zinc/32/84/74/363328474.db2.gz PFRGQYBKCWOZOL-ZJUUUORDSA-N 1 2 223.345 2.481 20 0 BEADLO CCC[C@H](C)CC(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000344253587 354190634 /nfs/dbraw/zinc/19/06/34/354190634.db2.gz RWIQUJJWPBWJDT-QWRGUYRKSA-N 1 2 249.358 2.210 20 0 BEADLO CCC[C@H](C)CC(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000344253587 354190636 /nfs/dbraw/zinc/19/06/36/354190636.db2.gz RWIQUJJWPBWJDT-QWRGUYRKSA-N 1 2 249.358 2.210 20 0 BEADLO COCC[N@@H+]1CCn2c(cc3ccccc32)C1 ZINC000334592981 354249149 /nfs/dbraw/zinc/24/91/49/354249149.db2.gz FYFHYORPKPMWQL-UHFFFAOYSA-N 1 2 230.311 2.103 20 0 BEADLO COCC[N@H+]1CCn2c(cc3ccccc32)C1 ZINC000334592981 354249150 /nfs/dbraw/zinc/24/91/50/354249150.db2.gz FYFHYORPKPMWQL-UHFFFAOYSA-N 1 2 230.311 2.103 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCc3ccsc3C2)n1 ZINC000334595299 354227787 /nfs/dbraw/zinc/22/77/87/354227787.db2.gz CNFNTQRMKBLKTP-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ccnc(C[N@H+]2CCc3ccsc3C2)n1 ZINC000334595299 354227790 /nfs/dbraw/zinc/22/77/90/354227790.db2.gz CNFNTQRMKBLKTP-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cc(CNc2c[nH+]cc(C)c2)n(C)n1 ZINC000334600612 354278479 /nfs/dbraw/zinc/27/84/79/354278479.db2.gz ZKNKWLBXLKYUKV-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1CC(=O)Nc1ccccc1F ZINC000334607272 354314213 /nfs/dbraw/zinc/31/42/13/354314213.db2.gz DTNJIZOLJXPQQA-AOOOYVTPSA-N 1 2 236.290 2.247 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1CC(=O)Nc1ccccc1F ZINC000334607272 354314214 /nfs/dbraw/zinc/31/42/14/354314214.db2.gz DTNJIZOLJXPQQA-AOOOYVTPSA-N 1 2 236.290 2.247 20 0 BEADLO COC[C@@H]([NH2+]Cc1cnc[nH]1)c1ccc(F)cc1 ZINC000344597381 354322994 /nfs/dbraw/zinc/32/29/94/354322994.db2.gz ZJTIDJVZWTXZAE-CYBMUJFWSA-N 1 2 249.289 2.026 20 0 BEADLO CC(C)c1nnc(C[NH2+]Cc2cccnc2)s1 ZINC000344628670 354330144 /nfs/dbraw/zinc/33/01/44/354330144.db2.gz HQTOKZBUNJALEG-UHFFFAOYSA-N 1 2 248.355 2.346 20 0 BEADLO CSCC[N@H+](C)[C@H](C)c1nnc(C)s1 ZINC000344679297 354331977 /nfs/dbraw/zinc/33/19/77/354331977.db2.gz XJZDWYXGDFVIHU-SSDOTTSWSA-N 1 2 231.390 2.202 20 0 BEADLO CSCC[N@@H+](C)[C@H](C)c1nnc(C)s1 ZINC000344679297 354331984 /nfs/dbraw/zinc/33/19/84/354331984.db2.gz XJZDWYXGDFVIHU-SSDOTTSWSA-N 1 2 231.390 2.202 20 0 BEADLO CSCC[N@H+](C)[C@@H](C)c1nnc(C)s1 ZINC000344679298 354332367 /nfs/dbraw/zinc/33/23/67/354332367.db2.gz XJZDWYXGDFVIHU-ZETCQYMHSA-N 1 2 231.390 2.202 20 0 BEADLO CSCC[N@@H+](C)[C@@H](C)c1nnc(C)s1 ZINC000344679298 354332372 /nfs/dbraw/zinc/33/23/72/354332372.db2.gz XJZDWYXGDFVIHU-ZETCQYMHSA-N 1 2 231.390 2.202 20 0 BEADLO C[C@@H](CF)[NH2+][C@H](c1nnc[nH]1)C1CCCCC1 ZINC000639182946 354340064 /nfs/dbraw/zinc/34/00/64/354340064.db2.gz NEHSKYUDDPOYJI-ONGXEEELSA-N 1 2 240.326 2.374 20 0 BEADLO Cc1cn2cc(NC(=O)c3cc[nH]c3)ccc2[nH+]1 ZINC000344757353 354351614 /nfs/dbraw/zinc/35/16/14/354351614.db2.gz XAUWSMVYRDJHGO-UHFFFAOYSA-N 1 2 240.266 2.223 20 0 BEADLO Cc1cc(N2C[C@@H](C3CC3)[C@H]2C2CC2)nc[nH+]1 ZINC000334688373 354434376 /nfs/dbraw/zinc/43/43/76/354434376.db2.gz ZUPCCPICEDMIQA-GXTWGEPZSA-N 1 2 229.327 2.410 20 0 BEADLO COC1(C)C[NH+](CC2=Cc3ccccc3OC2)C1 ZINC000334647562 354437865 /nfs/dbraw/zinc/43/78/65/354437865.db2.gz WKHNOBLVCMDANC-UHFFFAOYSA-N 1 2 245.322 2.183 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCCc2nn(C)cc21)C(C)(F)F ZINC000334668906 354409526 /nfs/dbraw/zinc/40/95/26/354409526.db2.gz CZIGWBQILBWHHZ-SCZZXKLOSA-N 1 2 243.301 2.431 20 0 BEADLO CC(C)n1ncnc1C[N@@H+]1CC(C)(C)[C@H]1C1CC1 ZINC000639190096 354410595 /nfs/dbraw/zinc/41/05/95/354410595.db2.gz KVEFTDJYDMGYCD-CYBMUJFWSA-N 1 2 248.374 2.479 20 0 BEADLO CC(C)n1ncnc1C[N@H+]1CC(C)(C)[C@H]1C1CC1 ZINC000639190096 354410597 /nfs/dbraw/zinc/41/05/97/354410597.db2.gz KVEFTDJYDMGYCD-CYBMUJFWSA-N 1 2 248.374 2.479 20 0 BEADLO CSc1ccc(C[NH+]2CCOCC2)s1 ZINC000334673057 354415725 /nfs/dbraw/zinc/41/57/25/354415725.db2.gz QVKOEHRNMZRMDQ-UHFFFAOYSA-N 1 2 229.370 2.302 20 0 BEADLO Cn1cc[nH+]c1CNc1ncnc2sccc21 ZINC000032586969 354422546 /nfs/dbraw/zinc/42/25/46/354422546.db2.gz XFIZSQDEKVSFSI-UHFFFAOYSA-N 1 2 245.311 2.037 20 0 BEADLO c1nc(C[N@@H+]2CCSC[C@@H]2C2CC2)cs1 ZINC000334679822 354426226 /nfs/dbraw/zinc/42/62/26/354426226.db2.gz UNDAFGAGPQODCF-LLVKDONJSA-N 1 2 240.397 2.471 20 0 BEADLO c1nc(C[N@H+]2CCSC[C@@H]2C2CC2)cs1 ZINC000334679822 354426229 /nfs/dbraw/zinc/42/62/29/354426229.db2.gz UNDAFGAGPQODCF-LLVKDONJSA-N 1 2 240.397 2.471 20 0 BEADLO Cc1nc(N2C[C@H](C3CC3)[C@@H]2C2CC2)cc[nH+]1 ZINC000334683238 354429147 /nfs/dbraw/zinc/42/91/47/354429147.db2.gz IZFWYHBZZGEAOS-OCCSQVGLSA-N 1 2 229.327 2.410 20 0 BEADLO CC1=C[C@H](C)C[N@@H+]([C@H](C)c2csnn2)C1 ZINC000334650772 354443067 /nfs/dbraw/zinc/44/30/67/354443067.db2.gz GKXJYOADKNTDGA-WCBMZHEXSA-N 1 2 223.345 2.497 20 0 BEADLO CC1=C[C@H](C)C[N@H+]([C@H](C)c2csnn2)C1 ZINC000334650772 354443070 /nfs/dbraw/zinc/44/30/70/354443070.db2.gz GKXJYOADKNTDGA-WCBMZHEXSA-N 1 2 223.345 2.497 20 0 BEADLO CC[C@]1(C)COCC[N@@H+]1Cc1ccncc1F ZINC000334657240 354452203 /nfs/dbraw/zinc/45/22/03/354452203.db2.gz WQKOJIJCOXMQBS-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO CC[C@]1(C)COCC[N@H+]1Cc1ccncc1F ZINC000334657240 354452206 /nfs/dbraw/zinc/45/22/06/354452206.db2.gz WQKOJIJCOXMQBS-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1nnc(C(C)(C)C)[nH]1 ZINC000334659323 354455870 /nfs/dbraw/zinc/45/58/70/354455870.db2.gz ITTQXKSVXKWUQS-RKDXNWHRSA-N 1 2 222.336 2.085 20 0 BEADLO C[C@@H]1C[N@H+](C)CCN1C[C@@H]1CCC(F)(F)C1 ZINC000334664600 354465822 /nfs/dbraw/zinc/46/58/22/354465822.db2.gz VDNBHWVVYVCODQ-GHMZBOCLSA-N 1 2 232.318 2.058 20 0 BEADLO CC(C)[C@H]1C[C@@H]1C(=O)Nc1c[nH+]c2n1CCCC2 ZINC000334665218 354466644 /nfs/dbraw/zinc/46/66/44/354466644.db2.gz DLCCSYIBPJGMGQ-MNOVXSKESA-N 1 2 247.342 2.450 20 0 BEADLO Cc1nc(SCc2c[nH+]cn2C)[nH]c1C ZINC000335925590 134008741 /nfs/dbraw/zinc/00/87/41/134008741.db2.gz IQUWNJASKBMWDT-UHFFFAOYSA-N 1 2 222.317 2.052 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nccc(C)n2)CCS1 ZINC000334699769 354491956 /nfs/dbraw/zinc/49/19/56/354491956.db2.gz STHQEHDGGGRGIM-LLVKDONJSA-N 1 2 237.372 2.112 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nccc(C)n2)CCS1 ZINC000334699769 354491957 /nfs/dbraw/zinc/49/19/57/354491957.db2.gz STHQEHDGGGRGIM-LLVKDONJSA-N 1 2 237.372 2.112 20 0 BEADLO C[C@H]1C[C@H](NC2(C(F)F)CC2)c2[nH+]ccn21 ZINC000334704058 354497954 /nfs/dbraw/zinc/49/79/54/354497954.db2.gz XDDSQMQJDBCKJO-YUMQZZPRSA-N 1 2 227.258 2.276 20 0 BEADLO c1ccc(N2CCO[C@@H](C3CCC3)C2)[nH+]c1 ZINC000334712828 354510594 /nfs/dbraw/zinc/51/05/94/354510594.db2.gz QVRMFDRSOUDOET-GFCCVEGCSA-N 1 2 218.300 2.087 20 0 BEADLO Cc1cc(C(=O)N[C@H]2C[C@H](C)n3cc[nH+]c32)co1 ZINC000334716348 354514831 /nfs/dbraw/zinc/51/48/31/354514831.db2.gz XPNPPRJFLRMILF-KWQFWETISA-N 1 2 245.282 2.220 20 0 BEADLO CC[C@H]1CCN1C(=O)NCc1c[nH+]c(C)cc1C ZINC000334716820 354515349 /nfs/dbraw/zinc/51/53/49/354515349.db2.gz XVIZXEFYGADAJW-ZDUSSCGKSA-N 1 2 247.342 2.392 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C1=CC[C@@H](C)CC1 ZINC000334716373 354515359 /nfs/dbraw/zinc/51/53/59/354515359.db2.gz YKCWKDVAVLSCDZ-SNVBAGLBSA-N 1 2 230.311 2.497 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CCO[C@@H]2CCC[C@@H]21 ZINC000334798491 354553133 /nfs/dbraw/zinc/55/31/33/354553133.db2.gz PSJHXWMLUHXULA-QWHCGFSZSA-N 1 2 249.358 2.217 20 0 BEADLO Cc1cc(N[C@H]2CS[C@@H](C)C2)nc(C2CC2)[nH+]1 ZINC000334805620 354562472 /nfs/dbraw/zinc/56/24/72/354562472.db2.gz LFSQBTPLJXMIBO-GXSJLCMTSA-N 1 2 249.383 2.390 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CC[C@H](F)C1 ZINC000334813379 354570671 /nfs/dbraw/zinc/57/06/71/354570671.db2.gz RPKKXXHNRJYYLE-JTQLQIEISA-N 1 2 211.284 2.008 20 0 BEADLO C[C@@H]1[N@H+](Cc2ccncc2F)CCOC1(C)C ZINC000334758365 354579489 /nfs/dbraw/zinc/57/94/89/354579489.db2.gz VBHQEGWONVGBQK-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H]1[N@@H+](Cc2ccncc2F)CCOC1(C)C ZINC000334758365 354579490 /nfs/dbraw/zinc/57/94/90/354579490.db2.gz VBHQEGWONVGBQK-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H]1C[C@H](NC(=O)C2CC(C)(C)C2)c2[nH+]ccn21 ZINC000334768324 354589698 /nfs/dbraw/zinc/58/96/98/354589698.db2.gz JJVNGWZUOAIOEI-ONGXEEELSA-N 1 2 247.342 2.441 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)C2CC(C)(C)C2)c2[nH+]ccn21 ZINC000334768314 354589735 /nfs/dbraw/zinc/58/97/35/354589735.db2.gz JJVNGWZUOAIOEI-GXSJLCMTSA-N 1 2 247.342 2.441 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC[C@@H]2c2ncc[nH]2)nc1 ZINC000334771498 354591093 /nfs/dbraw/zinc/59/10/93/354591093.db2.gz ZLFBQEUOLAIKDB-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc(C[N@H+]2CCC[C@@H]2c2ncc[nH]2)nc1 ZINC000334771498 354591094 /nfs/dbraw/zinc/59/10/94/354591094.db2.gz ZLFBQEUOLAIKDB-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccoc1C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000335091909 354628515 /nfs/dbraw/zinc/62/85/15/354628515.db2.gz HPUFKTIHEGOXNZ-SNVBAGLBSA-N 1 2 245.282 2.288 20 0 BEADLO CCC(CC)CC(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000345682399 354731713 /nfs/dbraw/zinc/73/17/13/354731713.db2.gz XZMKEKMQNFCQIO-NSHDSACASA-N 1 2 237.347 2.214 20 0 BEADLO CCC(=O)N1CC[N@@H+]([C@@H]2C[C@@H]2c2ccccc2)C1 ZINC000335116100 354705831 /nfs/dbraw/zinc/70/58/31/354705831.db2.gz JLEKEDFFROBRCK-ZIAGYGMSSA-N 1 2 244.338 2.054 20 0 BEADLO CCC(=O)N1CC[N@H+]([C@@H]2C[C@@H]2c2ccccc2)C1 ZINC000335116100 354705833 /nfs/dbraw/zinc/70/58/33/354705833.db2.gz JLEKEDFFROBRCK-ZIAGYGMSSA-N 1 2 244.338 2.054 20 0 BEADLO CCCC1(C(=O)NCc2[nH+]ccn2C)CCC1 ZINC000345586172 354707106 /nfs/dbraw/zinc/70/71/06/354707106.db2.gz DWJOOYVIMWBHNQ-UHFFFAOYSA-N 1 2 235.331 2.007 20 0 BEADLO CN(C(=O)CCc1[nH]cc[nH+]1)c1ccccc1 ZINC000345641277 354721946 /nfs/dbraw/zinc/72/19/46/354721946.db2.gz OLQPTCRQMJABJO-UHFFFAOYSA-N 1 2 229.283 2.005 20 0 BEADLO CCC(=O)N1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000335124491 354765988 /nfs/dbraw/zinc/76/59/88/354765988.db2.gz PZMPXGHXNMLPTN-GFCCVEGCSA-N 1 2 232.327 2.259 20 0 BEADLO CCC(=O)N1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000335124491 354765990 /nfs/dbraw/zinc/76/59/90/354765990.db2.gz PZMPXGHXNMLPTN-GFCCVEGCSA-N 1 2 232.327 2.259 20 0 BEADLO C[N@H+](Cc1ccoc1)Cc1ccc(F)cn1 ZINC000345791503 354768750 /nfs/dbraw/zinc/76/87/50/354768750.db2.gz JAEYSCYUPFBIFX-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO C[N@@H+](Cc1ccoc1)Cc1ccc(F)cn1 ZINC000345791503 354768754 /nfs/dbraw/zinc/76/87/54/354768754.db2.gz JAEYSCYUPFBIFX-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO CCc1ccc(C[N@@H+]2CCOC(C)(C)C2)cn1 ZINC000335134986 354783874 /nfs/dbraw/zinc/78/38/74/354783874.db2.gz UGJZZKYODNBUNB-UHFFFAOYSA-N 1 2 234.343 2.255 20 0 BEADLO CCc1ccc(C[N@H+]2CCOC(C)(C)C2)cn1 ZINC000335134986 354783878 /nfs/dbraw/zinc/78/38/78/354783878.db2.gz UGJZZKYODNBUNB-UHFFFAOYSA-N 1 2 234.343 2.255 20 0 BEADLO CC[C@H]([NH2+]Cc1c[nH]c2ncncc12)C(F)F ZINC000639213159 354785289 /nfs/dbraw/zinc/78/52/89/354785289.db2.gz DGRHLCPLGGTQCN-VIFPVBQESA-N 1 2 240.257 2.043 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@](C)(F)C2)cs1 ZINC000335940383 134017157 /nfs/dbraw/zinc/01/71/57/134017157.db2.gz BRHDUKGTPLBSGB-SNVBAGLBSA-N 1 2 214.309 2.385 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@](C)(F)C2)cs1 ZINC000335940383 134017158 /nfs/dbraw/zinc/01/71/58/134017158.db2.gz BRHDUKGTPLBSGB-SNVBAGLBSA-N 1 2 214.309 2.385 20 0 BEADLO CCCC1(C(=O)N(C)Cc2[nH]cc[nH+]2)CCC1 ZINC000345649909 354737364 /nfs/dbraw/zinc/73/73/64/354737364.db2.gz OSDNFKBRDYTROH-UHFFFAOYSA-N 1 2 235.331 2.339 20 0 BEADLO CCc1cc(NC[C@@]2(C)CCCO2)nc[nH+]1 ZINC000087256254 491067151 /nfs/dbraw/zinc/06/71/51/491067151.db2.gz NVFGQLLRGUFYSQ-GFCCVEGCSA-N 1 2 221.304 2.020 20 0 BEADLO CC[C@H]([NH2+]Cc1ccns1)C(F)F ZINC000639214100 354802119 /nfs/dbraw/zinc/80/21/19/354802119.db2.gz NBGJJKLBPRHMMM-ZETCQYMHSA-N 1 2 206.261 2.276 20 0 BEADLO CCCc1[nH+]c2ccccc2n1C[C@H](C)O ZINC000040389196 358490526 /nfs/dbraw/zinc/49/05/26/358490526.db2.gz OOMQPYXREBXXBT-JTQLQIEISA-N 1 2 218.300 2.370 20 0 BEADLO CC1CCC(O)(C[N@@H+]2CCC(F)(F)C2)CC1 ZINC000345972887 354825416 /nfs/dbraw/zinc/82/54/16/354825416.db2.gz XGUDIVFXZQNHIL-UHFFFAOYSA-N 1 2 233.302 2.269 20 0 BEADLO CC1CCC(O)(C[N@H+]2CCC(F)(F)C2)CC1 ZINC000345972887 354825421 /nfs/dbraw/zinc/82/54/21/354825421.db2.gz XGUDIVFXZQNHIL-UHFFFAOYSA-N 1 2 233.302 2.269 20 0 BEADLO CC[C@H]([NH2+]Cc1ccc(CO)cc1)C(F)F ZINC000639214729 354825923 /nfs/dbraw/zinc/82/59/23/354825923.db2.gz RRSVXSXQDUWRLF-NSHDSACASA-N 1 2 229.270 2.312 20 0 BEADLO CCc1cnc(CNc2cccc[nH+]2)o1 ZINC000234267299 363418304 /nfs/dbraw/zinc/41/83/04/363418304.db2.gz IBCIVMKGWKDHNO-UHFFFAOYSA-N 1 2 203.245 2.244 20 0 BEADLO Cc1cnn(CC[N@@H+]2Cc3cccc(F)c3C2)c1 ZINC000335165946 354922853 /nfs/dbraw/zinc/92/28/53/354922853.db2.gz HRPUENPWZZNCGC-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO Cc1cnn(CC[N@H+]2Cc3cccc(F)c3C2)c1 ZINC000335165946 354922857 /nfs/dbraw/zinc/92/28/57/354922857.db2.gz HRPUENPWZZNCGC-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO C[C@@H]1OCC[C@@H]1Nc1ccc(N2CCCC2)c[nH+]1 ZINC000346423074 354924616 /nfs/dbraw/zinc/92/46/16/354924616.db2.gz ZCDMIQBQHKZSNO-AAEUAGOBSA-N 1 2 247.342 2.271 20 0 BEADLO c1n[nH]nc1C[N@@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000335225234 355066340 /nfs/dbraw/zinc/06/63/40/355066340.db2.gz VJHDHUWYQHGUFU-CYBMUJFWSA-N 1 2 232.331 2.127 20 0 BEADLO c1n[nH]nc1C[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000335225234 355066344 /nfs/dbraw/zinc/06/63/44/355066344.db2.gz VJHDHUWYQHGUFU-CYBMUJFWSA-N 1 2 232.331 2.127 20 0 BEADLO Cc1cc(N[C@@H](C)COCC(F)(F)F)nc[nH+]1 ZINC000346946892 355161783 /nfs/dbraw/zinc/16/17/83/355161783.db2.gz VYEVCVITCWNVMF-QMMMGPOBSA-N 1 2 249.236 2.164 20 0 BEADLO C[N@H+](Cc1ncc(Cl)s1)[C@@H]1CCOC1 ZINC000335253412 355209918 /nfs/dbraw/zinc/20/99/18/355209918.db2.gz RHJYUZCANCBIJI-SSDOTTSWSA-N 1 2 232.736 2.017 20 0 BEADLO C[N@@H+](Cc1ncc(Cl)s1)[C@@H]1CCOC1 ZINC000335253412 355209919 /nfs/dbraw/zinc/20/99/19/355209919.db2.gz RHJYUZCANCBIJI-SSDOTTSWSA-N 1 2 232.736 2.017 20 0 BEADLO C[N@H+](Cc1ncc(Cl)s1)[C@H]1CCOC1 ZINC000335253413 355210025 /nfs/dbraw/zinc/21/00/25/355210025.db2.gz RHJYUZCANCBIJI-ZETCQYMHSA-N 1 2 232.736 2.017 20 0 BEADLO C[N@@H+](Cc1ncc(Cl)s1)[C@H]1CCOC1 ZINC000335253413 355210026 /nfs/dbraw/zinc/21/00/26/355210026.db2.gz RHJYUZCANCBIJI-ZETCQYMHSA-N 1 2 232.736 2.017 20 0 BEADLO CC(C)[C@@H]1C[C@@H]1c1nc(Cc2c[nH+]cn2C)no1 ZINC000346927977 355178332 /nfs/dbraw/zinc/17/83/32/355178332.db2.gz DLGWBQFQXPDNKR-QWRGUYRKSA-N 1 2 246.314 2.153 20 0 BEADLO Cn1c[nH+]cc1CNc1cnc2c(c1)CCCC2 ZINC000335242334 355178700 /nfs/dbraw/zinc/17/87/00/355178700.db2.gz QRXDRKBXBFQRML-UHFFFAOYSA-N 1 2 242.326 2.306 20 0 BEADLO c1nc(NC2CC2)cc(NC[C@@H]2CCCCO2)[nH+]1 ZINC000413082831 191355240 /nfs/dbraw/zinc/35/52/40/191355240.db2.gz JHVDKNZDUNOEAN-NSHDSACASA-N 1 2 248.330 2.032 20 0 BEADLO c1nc(NC[C@@H]2CCCCO2)cc(NC2CC2)[nH+]1 ZINC000413082831 191355242 /nfs/dbraw/zinc/35/52/42/191355242.db2.gz JHVDKNZDUNOEAN-NSHDSACASA-N 1 2 248.330 2.032 20 0 BEADLO CSC[C@@H](C)Nc1cc(NC2CC2)[nH+]cn1 ZINC000413153600 191356801 /nfs/dbraw/zinc/35/68/01/191356801.db2.gz HKMKDQQQJZIUBM-MRVPVSSYSA-N 1 2 238.360 2.214 20 0 BEADLO CSC[C@@H](C)Nc1cc(NC2CC2)nc[nH+]1 ZINC000413153600 191356803 /nfs/dbraw/zinc/35/68/03/191356803.db2.gz HKMKDQQQJZIUBM-MRVPVSSYSA-N 1 2 238.360 2.214 20 0 BEADLO C[C@@H]1CCN(c2cc(NC3CC3)[nH+]cn2)[C@@H]1C ZINC000413163303 191360461 /nfs/dbraw/zinc/36/04/61/191360461.db2.gz AVNPDRJHPCQJSJ-NXEZZACHSA-N 1 2 232.331 2.286 20 0 BEADLO C[C@@H]1CCN(c2cc(NC3CC3)nc[nH+]2)[C@@H]1C ZINC000413163303 191360464 /nfs/dbraw/zinc/36/04/64/191360464.db2.gz AVNPDRJHPCQJSJ-NXEZZACHSA-N 1 2 232.331 2.286 20 0 BEADLO C[C@H](F)CC[N@@H+]1CCO[C@H](c2nccs2)C1 ZINC000352007730 134035402 /nfs/dbraw/zinc/03/54/02/134035402.db2.gz YOLYUPJCBLSIND-UWVGGRQHSA-N 1 2 244.335 2.265 20 0 BEADLO C[C@H](F)CC[N@H+]1CCO[C@H](c2nccs2)C1 ZINC000352007730 134035403 /nfs/dbraw/zinc/03/54/03/134035403.db2.gz YOLYUPJCBLSIND-UWVGGRQHSA-N 1 2 244.335 2.265 20 0 BEADLO CN(Cc1ccco1)c1cc(NC2CC2)[nH+]cn1 ZINC000413027213 191345168 /nfs/dbraw/zinc/34/51/68/191345168.db2.gz LPXWETBEZJVLJY-UHFFFAOYSA-N 1 2 244.298 2.280 20 0 BEADLO CN(Cc1ccco1)c1cc(NC2CC2)nc[nH+]1 ZINC000413027213 191345170 /nfs/dbraw/zinc/34/51/70/191345170.db2.gz LPXWETBEZJVLJY-UHFFFAOYSA-N 1 2 244.298 2.280 20 0 BEADLO C[C@@H](Nc1cc(NC2CC2)[nH+]cn1)C1CC1 ZINC000413052249 191351885 /nfs/dbraw/zinc/35/18/85/191351885.db2.gz XXUGRDFAWYOBJQ-MRVPVSSYSA-N 1 2 218.304 2.261 20 0 BEADLO C[C@@H](Nc1cc(NC2CC2)nc[nH+]1)C1CC1 ZINC000413052249 191351887 /nfs/dbraw/zinc/35/18/87/191351887.db2.gz XXUGRDFAWYOBJQ-MRVPVSSYSA-N 1 2 218.304 2.261 20 0 BEADLO CC1(C)[C@@H]2CN(c3cc(NC4CC4)[nH+]cn3)C[C@@H]21 ZINC000413182075 191361626 /nfs/dbraw/zinc/36/16/26/191361626.db2.gz WZDTVPGYDDPDSD-PHIMTYICSA-N 1 2 244.342 2.143 20 0 BEADLO CC1(C)[C@@H]2CN(c3cc(NC4CC4)nc[nH+]3)C[C@@H]21 ZINC000413182075 191361628 /nfs/dbraw/zinc/36/16/28/191361628.db2.gz WZDTVPGYDDPDSD-PHIMTYICSA-N 1 2 244.342 2.143 20 0 BEADLO Cc1cc(N[C@@H]2CCC[C@@H]3C[C@@H]32)nc[nH+]1 ZINC000413464985 191382581 /nfs/dbraw/zinc/38/25/81/191382581.db2.gz UEVPHBQUYSIIHW-OUAUKWLOSA-N 1 2 203.289 2.386 20 0 BEADLO c1cc2[nH+]ccc(N3C[C@@H]4C[C@H]3CS4)c2cn1 ZINC000413447463 191384500 /nfs/dbraw/zinc/38/45/00/191384500.db2.gz FJFJWXMGBXTICC-UWVGGRQHSA-N 1 2 243.335 2.324 20 0 BEADLO Cc1nc(NC[C@H]2CCC[C@H]2C2CC2)cc[nH+]1 ZINC000413481660 191387483 /nfs/dbraw/zinc/38/74/83/191387483.db2.gz NXKMTPJTIQRAHC-OLZOCXBDSA-N 1 2 231.343 2.445 20 0 BEADLO COCC[C@H](C)CNc1cc(C)[nH+]c(C2CC2)n1 ZINC000413487718 191388295 /nfs/dbraw/zinc/38/82/95/191388295.db2.gz CQONEDSNGDXNDI-JTQLQIEISA-N 1 2 249.358 2.169 20 0 BEADLO CC(C)c1nc(NC[C@@H]2C[C@@H](C)O[C@H]2C)cc[nH+]1 ZINC000413528451 191393057 /nfs/dbraw/zinc/39/30/57/191393057.db2.gz HBLRCFRQPUDDTQ-WOPDTQHZSA-N 1 2 249.358 2.247 20 0 BEADLO Cc1nc(N2CC[C@@H](C)C(F)(F)C2)cc[nH+]1 ZINC000335292596 355269734 /nfs/dbraw/zinc/26/97/34/355269734.db2.gz GHUBUJXCVGYAHR-MRVPVSSYSA-N 1 2 227.258 2.267 20 0 BEADLO COC1([C@@H](C)Nc2cc[nH+]c(C(C)C)n2)CCC1 ZINC000413554673 191396245 /nfs/dbraw/zinc/39/62/45/191396245.db2.gz CEFLYKIQOUTSJJ-LLVKDONJSA-N 1 2 249.358 2.391 20 0 BEADLO C[C@H]1CC[C@H](C)N1c1cc(NC2CC2)[nH+]cn1 ZINC000413186934 191362418 /nfs/dbraw/zinc/36/24/18/191362418.db2.gz CWHQMIOOTJCLPS-UWVGGRQHSA-N 1 2 232.331 2.428 20 0 BEADLO C[C@H]1CC[C@H](C)N1c1cc(NC2CC2)nc[nH+]1 ZINC000413186934 191362421 /nfs/dbraw/zinc/36/24/21/191362421.db2.gz CWHQMIOOTJCLPS-UWVGGRQHSA-N 1 2 232.331 2.428 20 0 BEADLO CC[C@H]1CCN(c2cc(NC3CC3)[nH+]cn2)C1 ZINC000413185255 191362799 /nfs/dbraw/zinc/36/27/99/191362799.db2.gz LVJRGCILSJBPCW-JTQLQIEISA-N 1 2 232.331 2.287 20 0 BEADLO CC[C@H]1CCN(c2cc(NC3CC3)nc[nH+]2)C1 ZINC000413185255 191362801 /nfs/dbraw/zinc/36/28/01/191362801.db2.gz LVJRGCILSJBPCW-JTQLQIEISA-N 1 2 232.331 2.287 20 0 BEADLO FC1(F)CC(Nc2cc(NC3CC3)[nH+]cn2)C1 ZINC000413263584 191366387 /nfs/dbraw/zinc/36/63/87/191366387.db2.gz MNNFQHUDOWSKCZ-UHFFFAOYSA-N 1 2 240.257 2.261 20 0 BEADLO FC1(F)CC(Nc2cc(NC3CC3)nc[nH+]2)C1 ZINC000413263584 191366390 /nfs/dbraw/zinc/36/63/90/191366390.db2.gz MNNFQHUDOWSKCZ-UHFFFAOYSA-N 1 2 240.257 2.261 20 0 BEADLO C[C@H](F)CCNc1cc(NC2CC2)nc[nH+]1 ZINC000413291135 191369040 /nfs/dbraw/zinc/36/90/40/191369040.db2.gz DCAOTYGSIFGOIQ-QMMMGPOBSA-N 1 2 224.283 2.211 20 0 BEADLO C[C@H](F)CCNc1cc(NC2CC2)[nH+]cn1 ZINC000413291135 191369043 /nfs/dbraw/zinc/36/90/43/191369043.db2.gz DCAOTYGSIFGOIQ-QMMMGPOBSA-N 1 2 224.283 2.211 20 0 BEADLO Cc1cc(NC[C@H]2CC[C@H](C)O2)nc(C2CC2)[nH+]1 ZINC000413377051 191376672 /nfs/dbraw/zinc/37/66/72/191376672.db2.gz NVNACOMCUJBZCN-CMPLNLGQSA-N 1 2 247.342 2.064 20 0 BEADLO CCOC[C@@H]1CCCCN1c1cc[nH+]c(C)n1 ZINC000413432505 191379731 /nfs/dbraw/zinc/37/97/31/191379731.db2.gz WLGKHEBUUDTJRU-LBPRGKRZSA-N 1 2 235.331 2.180 20 0 BEADLO c1cc(C[NH2+][C@H]2CCCc3cn[nH]c32)sn1 ZINC000623225482 355288752 /nfs/dbraw/zinc/28/87/52/355288752.db2.gz SVDFZVIDGRJBDV-JTQLQIEISA-N 1 2 234.328 2.033 20 0 BEADLO c1cc(C[NH2+][C@H]2CCCc3c[nH]nc32)sn1 ZINC000623225482 355288753 /nfs/dbraw/zinc/28/87/53/355288753.db2.gz SVDFZVIDGRJBDV-JTQLQIEISA-N 1 2 234.328 2.033 20 0 BEADLO CCn1ccc(C[NH2+]Cc2cc(C3CC3)no2)n1 ZINC000639261443 355314150 /nfs/dbraw/zinc/31/41/50/355314150.db2.gz KNYKWNZMAOPVIO-UHFFFAOYSA-N 1 2 246.314 2.058 20 0 BEADLO Cc1cc(C[NH+]2CC(C(F)F)C2)sn1 ZINC000639252260 355286405 /nfs/dbraw/zinc/28/64/05/355286405.db2.gz CDTVUYQNHUFBRP-UHFFFAOYSA-N 1 2 218.272 2.148 20 0 BEADLO Nc1c(F)cccc1C[NH+]1CC(C(F)F)C1 ZINC000639252932 355286899 /nfs/dbraw/zinc/28/68/99/355286899.db2.gz WIVHAWLQSRWTHG-UHFFFAOYSA-N 1 2 230.233 2.105 20 0 BEADLO CCc1noc(C)c1C[NH2+][C@@H](C)c1ccon1 ZINC000349240760 355374352 /nfs/dbraw/zinc/37/43/52/355374352.db2.gz JVLNRIDKHRYIOL-QMMMGPOBSA-N 1 2 235.287 2.384 20 0 BEADLO CCc1ccc(C[N@@H+]2CCc3n[nH]cc3C2)o1 ZINC000623237574 355379298 /nfs/dbraw/zinc/37/92/98/355379298.db2.gz CRISCDVVFJLJHM-UHFFFAOYSA-N 1 2 231.299 2.123 20 0 BEADLO CCc1ccc(C[N@H+]2CCc3n[nH]cc3C2)o1 ZINC000623237574 355379302 /nfs/dbraw/zinc/37/93/02/355379302.db2.gz CRISCDVVFJLJHM-UHFFFAOYSA-N 1 2 231.299 2.123 20 0 BEADLO CCc1ccc(C[NH+]2CC(OC)C2)s1 ZINC000582167376 355393957 /nfs/dbraw/zinc/39/39/57/355393957.db2.gz KTZDJFAGLBFPAN-UHFFFAOYSA-N 1 2 211.330 2.141 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1C[C@H](C)C[C@@H](C)C1 ZINC000583508469 355346306 /nfs/dbraw/zinc/34/63/06/355346306.db2.gz LGMJBJLMNZISCE-IJLUTSLNSA-N 1 2 249.358 2.093 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1C[C@H](C)C[C@@H](C)C1 ZINC000583508469 355346310 /nfs/dbraw/zinc/34/63/10/355346310.db2.gz LGMJBJLMNZISCE-IJLUTSLNSA-N 1 2 249.358 2.093 20 0 BEADLO C[C@@H](N[C@H](c1[nH+]ccn1C)C1CC1)C(F)(F)F ZINC000639276837 355353304 /nfs/dbraw/zinc/35/33/04/355353304.db2.gz GSMXOHFHYWPNAX-APPZFPTMSA-N 1 2 247.264 2.412 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1CCCOC1 ZINC000335780456 355427635 /nfs/dbraw/zinc/42/76/35/355427635.db2.gz UQUJPRCIZXQQJX-NSHDSACASA-N 1 2 234.299 2.064 20 0 BEADLO Cc1ccn2cc(CNC(=O)C3(C)CC3)[nH+]c2c1 ZINC000335790411 355442425 /nfs/dbraw/zinc/44/24/25/355442425.db2.gz OMPKLMVYAATWBT-UHFFFAOYSA-N 1 2 243.310 2.059 20 0 BEADLO Fc1cccc(C[N@@H+]2CCOCC23CC3)c1 ZINC000335798161 355455597 /nfs/dbraw/zinc/45/55/97/355455597.db2.gz OOWAWJDWWJEWAU-UHFFFAOYSA-N 1 2 221.275 2.191 20 0 BEADLO Fc1cccc(C[N@H+]2CCOCC23CC3)c1 ZINC000335798161 355455600 /nfs/dbraw/zinc/45/56/00/355455600.db2.gz OOWAWJDWWJEWAU-UHFFFAOYSA-N 1 2 221.275 2.191 20 0 BEADLO CC[C@@H]([NH2+][C@H](C)c1ccon1)c1ccn(C)n1 ZINC000349836344 355489824 /nfs/dbraw/zinc/48/98/24/355489824.db2.gz RXBHYDYWZOAALB-NXEZZACHSA-N 1 2 234.303 2.210 20 0 BEADLO C[NH2+]Cc1noc(CSc2ccc(C)cc2)n1 ZINC000349932684 355531056 /nfs/dbraw/zinc/53/10/56/355531056.db2.gz FVOXCTJSEQNEJS-UHFFFAOYSA-N 1 2 249.339 2.390 20 0 BEADLO Cc1cnc(C[N@@H+]2CCCc3occc3C2)cn1 ZINC000335821700 355541255 /nfs/dbraw/zinc/54/12/55/355541255.db2.gz CNADWYUQECACHZ-UHFFFAOYSA-N 1 2 243.310 2.326 20 0 BEADLO Cc1cnc(C[N@H+]2CCCc3occc3C2)cn1 ZINC000335821700 355541257 /nfs/dbraw/zinc/54/12/57/355541257.db2.gz CNADWYUQECACHZ-UHFFFAOYSA-N 1 2 243.310 2.326 20 0 BEADLO Cc1oncc1C[N@@H+]1CCc2ccc(O)cc2C1 ZINC000335822605 355542968 /nfs/dbraw/zinc/54/29/68/355542968.db2.gz VDOGAIUKJPVBQU-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO Cc1oncc1C[N@H+]1CCc2ccc(O)cc2C1 ZINC000335822605 355542970 /nfs/dbraw/zinc/54/29/70/355542970.db2.gz VDOGAIUKJPVBQU-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1nc(-c2ccco2)no1 ZINC000335817449 355507620 /nfs/dbraw/zinc/50/76/20/355507620.db2.gz JYJUOCMHPOXKKQ-DTORHVGOSA-N 1 2 233.271 2.312 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1nc(-c2ccco2)no1 ZINC000335817449 355507623 /nfs/dbraw/zinc/50/76/23/355507623.db2.gz JYJUOCMHPOXKKQ-DTORHVGOSA-N 1 2 233.271 2.312 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1nc(C(C)(C)C)no1 ZINC000335817476 355508149 /nfs/dbraw/zinc/50/81/49/355508149.db2.gz NBENIWMZVJNFAI-RKDXNWHRSA-N 1 2 223.320 2.350 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1nccn1C(F)F ZINC000335817481 355508526 /nfs/dbraw/zinc/50/85/26/355508526.db2.gz NVBQOMNFHCKBOK-HTQZYQBOSA-N 1 2 215.247 2.261 20 0 BEADLO CC(C)c1nc(N2CCO[C@H](C(C)C)C2)cc[nH+]1 ZINC000349869231 355513183 /nfs/dbraw/zinc/51/31/83/355513183.db2.gz QMWWVLLKAZGOPD-LBPRGKRZSA-N 1 2 249.358 2.461 20 0 BEADLO C[NH2+]Cc1noc(C/C=C\c2ccc(C)cc2)n1 ZINC000349882742 355517510 /nfs/dbraw/zinc/51/75/10/355517510.db2.gz NGZFNMAGWCRFBV-ARJAWSKDSA-N 1 2 243.310 2.353 20 0 BEADLO C[NH2+]Cc1noc([C@@H](c2ccccc2)C2CC2)n1 ZINC000349886580 355519433 /nfs/dbraw/zinc/51/94/33/355519433.db2.gz XKRUOAPQSDUKGB-ZDUSSCGKSA-N 1 2 243.310 2.331 20 0 BEADLO C[NH2+]Cc1noc([C@@H](C)Oc2cccc(C)c2)n1 ZINC000349916159 355525947 /nfs/dbraw/zinc/52/59/47/355525947.db2.gz WSGNPAIZTKMFKR-SNVBAGLBSA-N 1 2 247.298 2.237 20 0 BEADLO C[NH2+]Cc1noc([C@H](C)CC2CCCC2)n1 ZINC000349917366 355526919 /nfs/dbraw/zinc/52/69/19/355526919.db2.gz ZQFWUVXGJHFDIF-SECBINFHSA-N 1 2 223.320 2.473 20 0 BEADLO C[NH2+]Cc1noc(CCCC2CCCC2)n1 ZINC000349920596 355527501 /nfs/dbraw/zinc/52/75/01/355527501.db2.gz KEPMOQFPMCBATR-UHFFFAOYSA-N 1 2 223.320 2.302 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccns2)[C@H](C)CO1 ZINC000639296799 355582086 /nfs/dbraw/zinc/58/20/86/355582086.db2.gz PVXFSPFSUFFNPF-ZJUUUORDSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccns2)[C@H](C)CO1 ZINC000639296799 355582090 /nfs/dbraw/zinc/58/20/90/355582090.db2.gz PVXFSPFSUFFNPF-ZJUUUORDSA-N 1 2 226.345 2.142 20 0 BEADLO CCc1cc[nH+]cc1NCc1snnc1C ZINC000639295992 355591567 /nfs/dbraw/zinc/59/15/67/355591567.db2.gz TUTVJLQUGXCWGU-UHFFFAOYSA-N 1 2 234.328 2.416 20 0 BEADLO COc1ccc(C)cc1C[N@H+](C)Cc1cc[nH]n1 ZINC000350033160 355578698 /nfs/dbraw/zinc/57/86/98/355578698.db2.gz GIIFIUNJOLIMSK-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1ccc(C)cc1C[N@@H+](C)Cc1cc[nH]n1 ZINC000350033160 355578704 /nfs/dbraw/zinc/57/87/04/355578704.db2.gz GIIFIUNJOLIMSK-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO CCc1nc(C)c(C[N@@H+]2CCOC(C)(C)C2)o1 ZINC000335876777 355646651 /nfs/dbraw/zinc/64/66/51/355646651.db2.gz MCLSMZLTNPNVNZ-UHFFFAOYSA-N 1 2 238.331 2.156 20 0 BEADLO CCc1nc(C)c(C[N@H+]2CCOC(C)(C)C2)o1 ZINC000335876777 355646655 /nfs/dbraw/zinc/64/66/55/355646655.db2.gz MCLSMZLTNPNVNZ-UHFFFAOYSA-N 1 2 238.331 2.156 20 0 BEADLO Cn1c2cccc(F)c2[nH]c1=[NH+]C1CCCC1 ZINC000350288040 355664151 /nfs/dbraw/zinc/66/41/51/355664151.db2.gz OBHUOPPGFOWIQA-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO CC[C@]1(C)CC[N@H+](Cc2csnn2)C1 ZINC000335866496 355631401 /nfs/dbraw/zinc/63/14/01/355631401.db2.gz DRSANLHJTYKTDJ-SNVBAGLBSA-N 1 2 211.334 2.160 20 0 BEADLO CC[C@]1(C)CC[N@@H+](Cc2csnn2)C1 ZINC000335866496 355631403 /nfs/dbraw/zinc/63/14/03/355631403.db2.gz DRSANLHJTYKTDJ-SNVBAGLBSA-N 1 2 211.334 2.160 20 0 BEADLO Cc1cnc(C[NH2+][C@H]2CCCN3CCCC[C@H]23)o1 ZINC000639301521 355639530 /nfs/dbraw/zinc/63/95/30/355639530.db2.gz GERYXDSHMCHMGJ-QWHCGFSZSA-N 1 2 249.358 2.090 20 0 BEADLO Cn1ccnc1[C@H](C1CC1)[N@@H+]1CCC[C@@H](F)C1 ZINC000639313832 355693447 /nfs/dbraw/zinc/69/34/47/355693447.db2.gz ZGQCTHURFAWDFJ-NEPJUHHUSA-N 1 2 237.322 2.305 20 0 BEADLO Cn1ccnc1[C@H](C1CC1)[N@H+]1CCC[C@@H](F)C1 ZINC000639313832 355693451 /nfs/dbraw/zinc/69/34/51/355693451.db2.gz ZGQCTHURFAWDFJ-NEPJUHHUSA-N 1 2 237.322 2.305 20 0 BEADLO CCc1ccc(C[NH2+]Cc2cc(OC)no2)o1 ZINC000639324789 355714374 /nfs/dbraw/zinc/71/43/74/355714374.db2.gz PFQSLSYVAZIWRI-UHFFFAOYSA-N 1 2 236.271 2.128 20 0 BEADLO COc1ncc(C[N@@H+]2CCC[C@@H](F)C2)s1 ZINC000639312881 355684375 /nfs/dbraw/zinc/68/43/75/355684375.db2.gz KERQSTMVALFZRB-MRVPVSSYSA-N 1 2 230.308 2.086 20 0 BEADLO COc1ncc(C[N@H+]2CCC[C@@H](F)C2)s1 ZINC000639312881 355684377 /nfs/dbraw/zinc/68/43/77/355684377.db2.gz KERQSTMVALFZRB-MRVPVSSYSA-N 1 2 230.308 2.086 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CCCC3(CC3)C2)[nH]1 ZINC000335893390 355687169 /nfs/dbraw/zinc/68/71/69/355687169.db2.gz LMVFKGUKDSMEHZ-UHFFFAOYSA-N 1 2 234.347 2.304 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CCCC3(CC3)C2)[nH]1 ZINC000335893390 355687174 /nfs/dbraw/zinc/68/71/74/355687174.db2.gz LMVFKGUKDSMEHZ-UHFFFAOYSA-N 1 2 234.347 2.304 20 0 BEADLO C[C@H]([NH2+]Cc1cc(C2CC2)no1)c1nccn1C ZINC000639328725 355741580 /nfs/dbraw/zinc/74/15/80/355741580.db2.gz YKAPXDVBJPALEI-VIFPVBQESA-N 1 2 246.314 2.136 20 0 BEADLO C[C@H](NCc1cc(C2CC2)no1)c1[nH+]ccn1C ZINC000639328725 355741581 /nfs/dbraw/zinc/74/15/81/355741581.db2.gz YKAPXDVBJPALEI-VIFPVBQESA-N 1 2 246.314 2.136 20 0 BEADLO CC(C)[C@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000113765100 355750637 /nfs/dbraw/zinc/75/06/37/355750637.db2.gz SUJDRJPYHYZNRL-FYJFLYSWSA-N 1 2 247.342 2.318 20 0 BEADLO CCc1cnc(C[N@@H+]2CCSC[C@@H]2C)o1 ZINC000608497488 355824360 /nfs/dbraw/zinc/82/43/60/355824360.db2.gz KNFUHUROQUGLMF-VIFPVBQESA-N 1 2 226.345 2.174 20 0 BEADLO CCc1cnc(C[N@H+]2CCSC[C@@H]2C)o1 ZINC000608497488 355824364 /nfs/dbraw/zinc/82/43/64/355824364.db2.gz KNFUHUROQUGLMF-VIFPVBQESA-N 1 2 226.345 2.174 20 0 BEADLO CC1=C(C)C[C@@H]([C@@H](C)[NH2+]Cc2c[nH]nn2)CC1 ZINC000639341236 355782793 /nfs/dbraw/zinc/78/27/93/355782793.db2.gz JLAWDXITKJBBBA-NEPJUHHUSA-N 1 2 234.347 2.419 20 0 BEADLO CC1=C(C)C[C@@H]([C@@H](C)[NH2+]Cc2cn[nH]n2)CC1 ZINC000639341236 355782795 /nfs/dbraw/zinc/78/27/95/355782795.db2.gz JLAWDXITKJBBBA-NEPJUHHUSA-N 1 2 234.347 2.419 20 0 BEADLO C[C@H]1CCC[C@H](C(=O)N2CCn3c[nH+]cc3C2)C1 ZINC000336019467 134054230 /nfs/dbraw/zinc/05/42/30/134054230.db2.gz KRJCCZZSXROLGB-RYUDHWBXSA-N 1 2 247.342 2.052 20 0 BEADLO C[C@H](Nc1c[nH+]cc(N(C)C)c1)[C@@H]1CCCOC1 ZINC000639366501 355844602 /nfs/dbraw/zinc/84/46/02/355844602.db2.gz WTGSBPLWELUXQW-NWDGAFQWSA-N 1 2 249.358 2.375 20 0 BEADLO c1c[nH]c(C[NH2+]Cc2scnc2C2CC2)n1 ZINC000639372721 355876734 /nfs/dbraw/zinc/87/67/34/355876734.db2.gz UBFQKNOGZHHNFK-UHFFFAOYSA-N 1 2 234.328 2.033 20 0 BEADLO CC[C@H](Cc1ccc(C)cc1)[NH2+]Cc1c[nH]nn1 ZINC000628363642 355846948 /nfs/dbraw/zinc/84/69/48/355846948.db2.gz RUWRQTIQFMIGCI-CYBMUJFWSA-N 1 2 244.342 2.224 20 0 BEADLO CC[C@H](Cc1ccc(C)cc1)[NH2+]Cc1cn[nH]n1 ZINC000628363642 355846949 /nfs/dbraw/zinc/84/69/49/355846949.db2.gz RUWRQTIQFMIGCI-CYBMUJFWSA-N 1 2 244.342 2.224 20 0 BEADLO COC(=O)[C@@H]([NH2+]Cc1csc(C)c1)C(C)C ZINC000380538251 355863492 /nfs/dbraw/zinc/86/34/92/355863492.db2.gz GKWTVFVGMAFFCF-NSHDSACASA-N 1 2 241.356 2.344 20 0 BEADLO C[C@@H]1C[C@H](Nc2c[nH+]cc(N(C)C)c2)CS1 ZINC000639363694 355829040 /nfs/dbraw/zinc/82/90/40/355829040.db2.gz FAJZNFJSUPVAFD-KOLCDFICSA-N 1 2 237.372 2.454 20 0 BEADLO CC(=O)c1c(F)cccc1N(C)Cc1[nH]cc[nH+]1 ZINC000428106106 191921417 /nfs/dbraw/zinc/92/14/17/191921417.db2.gz BJTANMDWEIPUCT-UHFFFAOYSA-N 1 2 247.273 2.388 20 0 BEADLO CC(C)[N@@H+]1C[C@@H](C)O[C@H](C(F)(F)F)C1 ZINC000608751171 355964151 /nfs/dbraw/zinc/96/41/51/355964151.db2.gz XSCWACQSHFYURQ-SFYZADRCSA-N 1 2 211.227 2.046 20 0 BEADLO CC(C)[N@H+]1C[C@@H](C)O[C@H](C(F)(F)F)C1 ZINC000608751171 355964154 /nfs/dbraw/zinc/96/41/54/355964154.db2.gz XSCWACQSHFYURQ-SFYZADRCSA-N 1 2 211.227 2.046 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2cc(O)cc(F)c2)C1 ZINC000336068190 134070939 /nfs/dbraw/zinc/07/09/39/134070939.db2.gz FATTWUFHNUPOIB-GFCCVEGCSA-N 1 2 227.254 2.465 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2cc(O)cc(F)c2)C1 ZINC000336068190 134070940 /nfs/dbraw/zinc/07/09/40/134070940.db2.gz FATTWUFHNUPOIB-GFCCVEGCSA-N 1 2 227.254 2.465 20 0 BEADLO CC1(F)CC[NH+](Cc2cscn2)CC1 ZINC000639389522 356016907 /nfs/dbraw/zinc/01/69/07/356016907.db2.gz ZXXGWJSLNMQPRG-UHFFFAOYSA-N 1 2 214.309 2.467 20 0 BEADLO C/C=C\C[C@H](CO)Nc1ccc2ccccc2[nH+]1 ZINC000351562668 356017391 /nfs/dbraw/zinc/01/73/91/356017391.db2.gz KSDCDCMUJABXSY-XQJDBVBESA-N 1 2 242.322 2.396 20 0 BEADLO CC(C)n1cc(C[NH2+][C@H](C)c2ccon2)cn1 ZINC000351591997 356023877 /nfs/dbraw/zinc/02/38/77/356023877.db2.gz IPPLYCUJNRHZNH-SNVBAGLBSA-N 1 2 234.303 2.303 20 0 BEADLO CC1(C)C[NH+](Cc2cn3cccc(F)c3n2)C1 ZINC000639393015 356062955 /nfs/dbraw/zinc/06/29/55/356062955.db2.gz FAZPKHQULRXBGH-UHFFFAOYSA-N 1 2 233.290 2.315 20 0 BEADLO Cn1ncc(C(F)(F)F)c1C[NH+]1CC(C)(C)C1 ZINC000639393344 356071630 /nfs/dbraw/zinc/07/16/30/356071630.db2.gz JXZSRMMHTXRRJX-UHFFFAOYSA-N 1 2 247.264 2.281 20 0 BEADLO CC1(C)C[NH+](Cc2cc3n(n2)CCCC3)C1 ZINC000639393382 356071687 /nfs/dbraw/zinc/07/16/87/356071687.db2.gz KZIJRYNGHFTKFK-UHFFFAOYSA-N 1 2 219.332 2.061 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1ccc[nH]1 ZINC000351732833 356073263 /nfs/dbraw/zinc/07/32/63/356073263.db2.gz TUJFPBFNLCAEAW-UHFFFAOYSA-N 1 2 219.288 2.197 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1ccc[nH]1 ZINC000351732833 356073265 /nfs/dbraw/zinc/07/32/65/356073265.db2.gz TUJFPBFNLCAEAW-UHFFFAOYSA-N 1 2 219.288 2.197 20 0 BEADLO C[C@@H]1C[C@H](C)C[N@H+]1Cc1noc(C2CC2)n1 ZINC000335917219 356160554 /nfs/dbraw/zinc/16/05/54/356160554.db2.gz GYSMNFGNHVSPHG-DTWKUNHWSA-N 1 2 221.304 2.177 20 0 BEADLO C[C@@H]1C[C@H](C)C[N@@H+]1Cc1noc(C2CC2)n1 ZINC000335917219 356160558 /nfs/dbraw/zinc/16/05/58/356160558.db2.gz GYSMNFGNHVSPHG-DTWKUNHWSA-N 1 2 221.304 2.177 20 0 BEADLO COc1ccccc1/C=C\C[N@@H+]1CCOC[C@H]1C ZINC000351893345 356160611 /nfs/dbraw/zinc/16/06/11/356160611.db2.gz UYVQSIORIKEGQC-SCXUMTSISA-N 1 2 247.338 2.429 20 0 BEADLO COc1ccccc1/C=C\C[N@H+]1CCOC[C@H]1C ZINC000351893345 356160612 /nfs/dbraw/zinc/16/06/12/356160612.db2.gz UYVQSIORIKEGQC-SCXUMTSISA-N 1 2 247.338 2.429 20 0 BEADLO c1ccc2[nH+]c(N3CCO[C@H](C4CC4)C3)[nH]c2c1 ZINC000336089082 134078235 /nfs/dbraw/zinc/07/82/35/134078235.db2.gz USLAWUNOYCDKAE-ZDUSSCGKSA-N 1 2 243.310 2.178 20 0 BEADLO Cc1nc(N2CC[C@@H]3CCC[C@H]32)cc[nH+]1 ZINC000336090949 134078549 /nfs/dbraw/zinc/07/85/49/134078549.db2.gz MWKNKFOIWPPCBI-WDEREUQCSA-N 1 2 203.289 2.164 20 0 BEADLO Cc1occc1C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000335914791 356151864 /nfs/dbraw/zinc/15/18/64/356151864.db2.gz NQQJSBKXRZONLU-LLVKDONJSA-N 1 2 245.282 2.288 20 0 BEADLO CCC(CC)(CC)C(=O)N[C@@H]1Cc2c[nH+]cn2C1 ZINC000623263938 356227787 /nfs/dbraw/zinc/22/77/87/356227787.db2.gz BDCQLIVNIASIJT-LLVKDONJSA-N 1 2 249.358 2.140 20 0 BEADLO C(c1noc(C[NH+]2CCCCC2)n1)C1CC1 ZINC000639447762 356228009 /nfs/dbraw/zinc/22/80/09/356228009.db2.gz PYVZMQRHIYYKCN-UHFFFAOYSA-N 1 2 221.304 2.008 20 0 BEADLO Cc1occc1C(=O)N[C@H](c1[nH]cc[nH+]1)C(C)C ZINC000352136306 134081474 /nfs/dbraw/zinc/08/14/74/134081474.db2.gz XUJKSMAQOYJYPJ-NSHDSACASA-N 1 2 247.298 2.438 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@@H]1[C@@H]1CCCC[C@H]1C ZINC000639426703 356208724 /nfs/dbraw/zinc/20/87/24/356208724.db2.gz HOTWEEAVRPMWIC-UTUOFQBUSA-N 1 2 238.375 2.369 20 0 BEADLO CC[C@@H](C)CCNC(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000617641460 356258061 /nfs/dbraw/zinc/25/80/61/356258061.db2.gz OQSBLOFEFPFZDK-MNOVXSKESA-N 1 2 249.358 2.067 20 0 BEADLO CC[C@@H](C)CCNC(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000617641460 356258065 /nfs/dbraw/zinc/25/80/65/356258065.db2.gz OQSBLOFEFPFZDK-MNOVXSKESA-N 1 2 249.358 2.067 20 0 BEADLO Cc1cc(N2CC(C)C2)nc(C2CC2)[nH+]1 ZINC000336111741 134086924 /nfs/dbraw/zinc/08/69/24/134086924.db2.gz MIKGNKQEUAVRMO-UHFFFAOYSA-N 1 2 203.289 2.119 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCC[C@H](OC)C1 ZINC000639473819 356266608 /nfs/dbraw/zinc/26/66/08/356266608.db2.gz OPHWWGGPVKFJGE-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CCC(F)(F)C[N@H+]1CCC[C@H](OC)C1 ZINC000639473819 356266609 /nfs/dbraw/zinc/26/66/09/356266609.db2.gz OPHWWGGPVKFJGE-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO COC[C@H](Nc1c[nH+]ccc1C)C1CC1 ZINC000087480445 491089056 /nfs/dbraw/zinc/08/90/56/491089056.db2.gz PQGZZZUAEXIBCL-LBPRGKRZSA-N 1 2 206.289 2.227 20 0 BEADLO NC(=O)Nc1cccc(CNc2cccc[nH+]2)c1 ZINC000340743367 181262654 /nfs/dbraw/zinc/26/26/54/181262654.db2.gz MEVXYCJTPDGGHW-UHFFFAOYSA-N 1 2 242.282 2.184 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCSC[C@H]1C ZINC000639497580 356325760 /nfs/dbraw/zinc/32/57/60/356325760.db2.gz SSABVIUVHXKFDO-MRVPVSSYSA-N 1 2 209.305 2.469 20 0 BEADLO CCC(F)(F)C[N@H+]1CCSC[C@H]1C ZINC000639497580 356325762 /nfs/dbraw/zinc/32/57/62/356325762.db2.gz SSABVIUVHXKFDO-MRVPVSSYSA-N 1 2 209.305 2.469 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2CCSC(C)(C)C2)no1 ZINC000336122373 134091550 /nfs/dbraw/zinc/09/15/50/134091550.db2.gz XNHZYVLNDISKEP-QMMMGPOBSA-N 1 2 241.360 2.266 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2CCSC(C)(C)C2)no1 ZINC000336122373 134091551 /nfs/dbraw/zinc/09/15/51/134091551.db2.gz XNHZYVLNDISKEP-QMMMGPOBSA-N 1 2 241.360 2.266 20 0 BEADLO CC(=O)C[N@@H+]1CCc2cccc(F)c2[C@H]1C ZINC000639498101 356326271 /nfs/dbraw/zinc/32/62/71/356326271.db2.gz WSWUSCHXJKTPKN-SNVBAGLBSA-N 1 2 221.275 2.334 20 0 BEADLO CC(=O)C[N@H+]1CCc2cccc(F)c2[C@H]1C ZINC000639498101 356326274 /nfs/dbraw/zinc/32/62/74/356326274.db2.gz WSWUSCHXJKTPKN-SNVBAGLBSA-N 1 2 221.275 2.334 20 0 BEADLO CCCC[C@H](C)[N@H+](C)Cc1noc(COC)n1 ZINC000352408158 356340946 /nfs/dbraw/zinc/34/09/46/356340946.db2.gz HFTAESMPDBNVAK-JTQLQIEISA-N 1 2 241.335 2.227 20 0 BEADLO CCCC[C@H](C)[N@@H+](C)Cc1noc(COC)n1 ZINC000352408158 356340948 /nfs/dbraw/zinc/34/09/48/356340948.db2.gz HFTAESMPDBNVAK-JTQLQIEISA-N 1 2 241.335 2.227 20 0 BEADLO C[C@@H]1CCCC[N@@H+]1Cc1nnc(C(C)(C)C)[nH]1 ZINC000336138877 134096603 /nfs/dbraw/zinc/09/66/03/134096603.db2.gz RABHBRNULSJNKK-SNVBAGLBSA-N 1 2 236.363 2.477 20 0 BEADLO C[C@@H]1CCCC[N@H+]1Cc1nnc(C(C)(C)C)[nH]1 ZINC000336138877 134096604 /nfs/dbraw/zinc/09/66/04/134096604.db2.gz RABHBRNULSJNKK-SNVBAGLBSA-N 1 2 236.363 2.477 20 0 BEADLO C[C@H]1CCCC[N@@H+]1Cc1nnc(C(C)(C)C)[nH]1 ZINC000336138876 134096810 /nfs/dbraw/zinc/09/68/10/134096810.db2.gz RABHBRNULSJNKK-JTQLQIEISA-N 1 2 236.363 2.477 20 0 BEADLO C[C@H]1CCCC[N@H+]1Cc1nnc(C(C)(C)C)[nH]1 ZINC000336138876 134096811 /nfs/dbraw/zinc/09/68/11/134096811.db2.gz RABHBRNULSJNKK-JTQLQIEISA-N 1 2 236.363 2.477 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@H](c1ccccc1)C1CC1 ZINC000042229776 356414504 /nfs/dbraw/zinc/41/45/04/356414504.db2.gz GGMDXINXOTWOCY-ZWNOBZJWSA-N 1 2 233.311 2.289 20 0 BEADLO CSCCC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000609623221 356403728 /nfs/dbraw/zinc/40/37/28/356403728.db2.gz VXSWHIFWZZNODT-UHFFFAOYSA-N 1 2 235.312 2.026 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCCOC[C@@H]1C ZINC000639543573 356404066 /nfs/dbraw/zinc/40/40/66/356404066.db2.gz KJBDIYAIDJXNCA-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CCC(F)(F)C[N@H+]1CCCOC[C@@H]1C ZINC000639543573 356404070 /nfs/dbraw/zinc/40/40/70/356404070.db2.gz KJBDIYAIDJXNCA-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CCCC[C@@H](CC)C(=O)N[C@H]1Cc2c[nH+]cn2C1 ZINC000623274822 356408413 /nfs/dbraw/zinc/40/84/13/356408413.db2.gz WBWJVGFOGITWGE-NEPJUHHUSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cscn2)nc1 ZINC000087782374 491092175 /nfs/dbraw/zinc/09/21/75/491092175.db2.gz MDBJBUAUAHYQNW-UHFFFAOYSA-N 1 2 219.313 2.136 20 0 BEADLO CC[C@H]1C[C@@H](Nc2cc[nH+]c(C(C)C)n2)CCO1 ZINC000420617056 192249631 /nfs/dbraw/zinc/24/96/31/192249631.db2.gz JFUZRTCRBSFXST-RYUDHWBXSA-N 1 2 249.358 2.391 20 0 BEADLO CC[C@H](C)CNc1cc[nH+]c(C(C)C)n1 ZINC000420650495 192254950 /nfs/dbraw/zinc/25/49/50/192254950.db2.gz HZNHBADRZATODE-JTQLQIEISA-N 1 2 207.321 2.480 20 0 BEADLO C[C@]1(F)CC[N@H+](CC(=O)Nc2ccccc2)C1 ZINC000336165970 134113154 /nfs/dbraw/zinc/11/31/54/134113154.db2.gz OKOIFJMFJQQSGZ-ZDUSSCGKSA-N 1 2 236.290 2.059 20 0 BEADLO C[C@]1(F)CC[N@@H+](CC(=O)Nc2ccccc2)C1 ZINC000336165970 134113155 /nfs/dbraw/zinc/11/31/55/134113155.db2.gz OKOIFJMFJQQSGZ-ZDUSSCGKSA-N 1 2 236.290 2.059 20 0 BEADLO CC(C)(C(=O)NCCc1[nH]cc[nH+]1)C1CCCC1 ZINC000179320304 366242334 /nfs/dbraw/zinc/24/23/34/366242334.db2.gz NFRAKBUBXRRAMS-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO CCN(Cc1ccoc1)c1cc(C)[nH+]cn1 ZINC000301221344 356511643 /nfs/dbraw/zinc/51/16/43/356511643.db2.gz BNTBKVQXRNARML-UHFFFAOYSA-N 1 2 217.272 2.405 20 0 BEADLO CC(=O)C[NH2+][C@@H](C)c1cccc(F)c1F ZINC000639568194 356493188 /nfs/dbraw/zinc/49/31/88/356493188.db2.gz JFDHSJLDSCJCMZ-QMMMGPOBSA-N 1 2 213.227 2.204 20 0 BEADLO CC[C@@H]1C[C@H]1NC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000420867976 192265499 /nfs/dbraw/zinc/26/54/99/192265499.db2.gz RPXWGQYROXWBER-CHWSQXEVSA-N 1 2 247.342 2.296 20 0 BEADLO CC[N@H+](Cc1nn(C)cc1Cl)C1CC1 ZINC000420902380 192269102 /nfs/dbraw/zinc/26/91/02/192269102.db2.gz MYSNRRRNSVYNQF-UHFFFAOYSA-N 1 2 213.712 2.058 20 0 BEADLO CC[N@@H+](Cc1nn(C)cc1Cl)C1CC1 ZINC000420902380 192269104 /nfs/dbraw/zinc/26/91/04/192269104.db2.gz MYSNRRRNSVYNQF-UHFFFAOYSA-N 1 2 213.712 2.058 20 0 BEADLO CCC(F)(F)C[N@@H+]1CC[C@H](C)[C@@H](OC)C1 ZINC000639603945 356525106 /nfs/dbraw/zinc/52/51/06/356525106.db2.gz IOOPELUITKHNCA-UWVGGRQHSA-N 1 2 221.291 2.389 20 0 BEADLO CCC(F)(F)C[N@H+]1CC[C@H](C)[C@@H](OC)C1 ZINC000639603945 356525109 /nfs/dbraw/zinc/52/51/09/356525109.db2.gz IOOPELUITKHNCA-UWVGGRQHSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@H]1C[NH+](Cc2nccc(C)n2)C[C@H](CC)O1 ZINC000420958436 192280150 /nfs/dbraw/zinc/28/01/50/192280150.db2.gz PELQMSSNQGPVFM-STQMWFEESA-N 1 2 249.358 2.174 20 0 BEADLO CCCC(C)(C)NC(=O)CCCn1cc[nH+]c1 ZINC000623294359 356530712 /nfs/dbraw/zinc/53/07/12/356530712.db2.gz PIJLVFXFJFNBHV-UHFFFAOYSA-N 1 2 237.347 2.358 20 0 BEADLO CCC(F)(F)C[NH2+][C@H](CO)c1cccc(F)c1 ZINC000639597552 356515756 /nfs/dbraw/zinc/51/57/56/356515756.db2.gz LQBPLGRQSCNMAR-LLVKDONJSA-N 1 2 247.260 2.494 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1nc(C2CCC2)no1 ZINC000639618379 356536058 /nfs/dbraw/zinc/53/60/58/356536058.db2.gz JZMGYQDSCYPBTO-IUCAKERBSA-N 1 2 221.304 2.320 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1nc(CC2CC2)no1 ZINC000639618843 356536144 /nfs/dbraw/zinc/53/61/44/356536144.db2.gz RYJJNCLPHMCIKB-RKDXNWHRSA-N 1 2 221.304 2.005 20 0 BEADLO CCc1cnc(CN(C)c2cc(C)[nH+]cn2)s1 ZINC000301482024 356541816 /nfs/dbraw/zinc/54/18/16/356541816.db2.gz SRTYKTQOWRMQNZ-UHFFFAOYSA-N 1 2 248.355 2.440 20 0 BEADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cnns1 ZINC000336196100 134126503 /nfs/dbraw/zinc/12/65/03/134126503.db2.gz RBQINUUJGKCSEC-SNVBAGLBSA-N 1 2 245.351 2.485 20 0 BEADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1cnns1 ZINC000336196100 134126504 /nfs/dbraw/zinc/12/65/04/134126504.db2.gz RBQINUUJGKCSEC-SNVBAGLBSA-N 1 2 245.351 2.485 20 0 BEADLO CCC(F)(F)C[N@H+](C)[C@H]1C[C@@H](OC)C1 ZINC000639638702 356551902 /nfs/dbraw/zinc/55/19/02/356551902.db2.gz QCGYZXIHZFMSCM-DTORHVGOSA-N 1 2 207.264 2.141 20 0 BEADLO CCC(F)(F)C[N@@H+](C)[C@H]1C[C@@H](OC)C1 ZINC000639638702 356551903 /nfs/dbraw/zinc/55/19/03/356551903.db2.gz QCGYZXIHZFMSCM-DTORHVGOSA-N 1 2 207.264 2.141 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@]23CCOC3)c(C)s1 ZINC000421023154 192306244 /nfs/dbraw/zinc/30/62/44/192306244.db2.gz QVCKYJQGMYHNGR-GFCCVEGCSA-N 1 2 238.356 2.125 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@]23CCOC3)c(C)s1 ZINC000421023154 192306247 /nfs/dbraw/zinc/30/62/47/192306247.db2.gz QVCKYJQGMYHNGR-GFCCVEGCSA-N 1 2 238.356 2.125 20 0 BEADLO Cc1c(Cl)c(C[N@H+](C)CC2CC2)nn1C ZINC000421325102 192317742 /nfs/dbraw/zinc/31/77/42/192317742.db2.gz YWBBYGQVNYDCPZ-UHFFFAOYSA-N 1 2 227.739 2.224 20 0 BEADLO Cc1c(Cl)c(C[N@@H+](C)CC2CC2)nn1C ZINC000421325102 192317745 /nfs/dbraw/zinc/31/77/45/192317745.db2.gz YWBBYGQVNYDCPZ-UHFFFAOYSA-N 1 2 227.739 2.224 20 0 BEADLO CC[N@H+](Cc1nn(C)c(C)c1Cl)C1CC1 ZINC000421329231 192317461 /nfs/dbraw/zinc/31/74/61/192317461.db2.gz NPZGTACZJGXVJS-UHFFFAOYSA-N 1 2 227.739 2.366 20 0 BEADLO CC[N@@H+](Cc1nn(C)c(C)c1Cl)C1CC1 ZINC000421329231 192317462 /nfs/dbraw/zinc/31/74/62/192317462.db2.gz NPZGTACZJGXVJS-UHFFFAOYSA-N 1 2 227.739 2.366 20 0 BEADLO C[C@@]1(CCNc2cc(CO)cc[nH+]2)CC1(F)F ZINC000630092339 363515012 /nfs/dbraw/zinc/51/50/12/363515012.db2.gz DVSPQNYBFAXCAP-LLVKDONJSA-N 1 2 242.269 2.421 20 0 BEADLO CC(C)(C)CCC(=O)N[C@@H]1CCn2c[nH+]cc2C1 ZINC000623306884 356605930 /nfs/dbraw/zinc/60/59/30/356605930.db2.gz WHCPWOVCMYBLJZ-LLVKDONJSA-N 1 2 249.358 2.140 20 0 BEADLO CCC(F)(F)C[NH+]1CCC(C2(O)CC2)CC1 ZINC000639720052 356618932 /nfs/dbraw/zinc/61/89/32/356618932.db2.gz SNYXEVSAOPDGHX-UHFFFAOYSA-N 1 2 233.302 2.269 20 0 BEADLO CC[C@@H](NC(=O)[C@H]1C[C@H]2C[C@H]2C1)c1[nH]cc[nH+]1 ZINC000613579651 363523027 /nfs/dbraw/zinc/52/30/27/363523027.db2.gz RZMLXMLAGFMNDF-VPOLOUISSA-N 1 2 233.315 2.023 20 0 BEADLO COCCC[N@H+](C)Cc1nnc(C(C)C)s1 ZINC000450290294 202120457 /nfs/dbraw/zinc/12/04/57/202120457.db2.gz QMXYJOBSNWBZKQ-UHFFFAOYSA-N 1 2 243.376 2.130 20 0 BEADLO COCCC[N@@H+](C)Cc1nnc(C(C)C)s1 ZINC000450290294 202120460 /nfs/dbraw/zinc/12/04/60/202120460.db2.gz QMXYJOBSNWBZKQ-UHFFFAOYSA-N 1 2 243.376 2.130 20 0 BEADLO CCC[N@H+](C)Cc1nnc(C2CC2)s1 ZINC000450314088 202128276 /nfs/dbraw/zinc/12/82/76/202128276.db2.gz AIGLJISPPSPOSE-UHFFFAOYSA-N 1 2 211.334 2.257 20 0 BEADLO CCC[N@@H+](C)Cc1nnc(C2CC2)s1 ZINC000450314088 202128280 /nfs/dbraw/zinc/12/82/80/202128280.db2.gz AIGLJISPPSPOSE-UHFFFAOYSA-N 1 2 211.334 2.257 20 0 BEADLO Cc1cc(C(=O)NC(C)(C)c2[nH]cc[nH+]2)c(C)o1 ZINC000578137463 366312227 /nfs/dbraw/zinc/31/22/27/366312227.db2.gz JPCVHIPGSJEOPT-UHFFFAOYSA-N 1 2 247.298 2.285 20 0 BEADLO c1nn[nH]c1C[NH+]1CCC2(CCCCC2)CC1 ZINC000450343634 202135842 /nfs/dbraw/zinc/13/58/42/202135842.db2.gz YQYJPMGHHYBYPV-UHFFFAOYSA-N 1 2 234.347 2.351 20 0 BEADLO C[C@@H](O)[C@@H](C)SCc1c[nH+]c2ccccn12 ZINC000179900501 366330691 /nfs/dbraw/zinc/33/06/91/366330691.db2.gz NEMWJGAPOHJEOR-NXEZZACHSA-N 1 2 236.340 2.337 20 0 BEADLO C[C@@H]([NH2+]Cc1ccn(C)c1)C(C)(F)F ZINC000389462792 356681392 /nfs/dbraw/zinc/68/13/92/356681392.db2.gz HIFUZOWVQZJHOF-MRVPVSSYSA-N 1 2 202.248 2.158 20 0 BEADLO COc1cccc(C[NH2+]CC(C)(F)F)c1 ZINC000378704851 356682370 /nfs/dbraw/zinc/68/23/70/356682370.db2.gz MMHAOLBLTLSDDO-UHFFFAOYSA-N 1 2 215.243 2.440 20 0 BEADLO COC[C@H](C)Nc1cc(C)[nH+]c(C(C)C)n1 ZINC000035121331 356703592 /nfs/dbraw/zinc/70/35/92/356703592.db2.gz ZTIONQXJTFLUQE-JTQLQIEISA-N 1 2 223.320 2.355 20 0 BEADLO Fc1cncc(C[N@@H+]2CCC[C@@H]2c2cn[nH]c2)c1 ZINC000639778784 356727245 /nfs/dbraw/zinc/72/72/45/356727245.db2.gz UIOSNLMDUSCJLM-CYBMUJFWSA-N 1 2 246.289 2.281 20 0 BEADLO Fc1cncc(C[N@H+]2CCC[C@@H]2c2cn[nH]c2)c1 ZINC000639778784 356727250 /nfs/dbraw/zinc/72/72/50/356727250.db2.gz UIOSNLMDUSCJLM-CYBMUJFWSA-N 1 2 246.289 2.281 20 0 BEADLO C[C@@H](c1cnccn1)[N@H+](C)Cc1ccns1 ZINC000639807703 356777851 /nfs/dbraw/zinc/77/78/51/356777851.db2.gz KPMAWBGJKYZIQN-VIFPVBQESA-N 1 2 234.328 2.126 20 0 BEADLO C[C@@H](c1cnccn1)[N@@H+](C)Cc1ccns1 ZINC000639807703 356777854 /nfs/dbraw/zinc/77/78/54/356777854.db2.gz KPMAWBGJKYZIQN-VIFPVBQESA-N 1 2 234.328 2.126 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccns2)ccn1 ZINC000639810766 356788920 /nfs/dbraw/zinc/78/89/20/356788920.db2.gz ZNVKIHQSPHPNAF-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccns2)ccn1 ZINC000639810766 356788923 /nfs/dbraw/zinc/78/89/23/356788923.db2.gz ZNVKIHQSPHPNAF-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CC1(C)C[N@H+](Cc2cocn2)[C@H]1[C@H]1CCCO1 ZINC000356239345 356791505 /nfs/dbraw/zinc/79/15/05/356791505.db2.gz PQBXZFGMQWIXSN-NEPJUHHUSA-N 1 2 236.315 2.064 20 0 BEADLO CC1(C)C[N@@H+](Cc2cocn2)[C@H]1[C@H]1CCCO1 ZINC000356239345 356791508 /nfs/dbraw/zinc/79/15/08/356791508.db2.gz PQBXZFGMQWIXSN-NEPJUHHUSA-N 1 2 236.315 2.064 20 0 BEADLO CSCC[N@H+](C)Cc1nnc(C2CC2)s1 ZINC000450494842 202185300 /nfs/dbraw/zinc/18/53/00/202185300.db2.gz PJHIJXMVGZXRNE-UHFFFAOYSA-N 1 2 243.401 2.210 20 0 BEADLO CSCC[N@@H+](C)Cc1nnc(C2CC2)s1 ZINC000450494842 202185302 /nfs/dbraw/zinc/18/53/02/202185302.db2.gz PJHIJXMVGZXRNE-UHFFFAOYSA-N 1 2 243.401 2.210 20 0 BEADLO CO[C@@H]1C[N@@H+]([C@H](C)c2ccccc2F)CCO1 ZINC000639832349 356817477 /nfs/dbraw/zinc/81/74/77/356817477.db2.gz GHJKCMXJJRSAHT-MFKMUULPSA-N 1 2 239.290 2.191 20 0 BEADLO CO[C@@H]1C[N@H+]([C@H](C)c2ccccc2F)CCO1 ZINC000639832349 356817478 /nfs/dbraw/zinc/81/74/78/356817478.db2.gz GHJKCMXJJRSAHT-MFKMUULPSA-N 1 2 239.290 2.191 20 0 BEADLO CCc1cnccc1[C@H](C)[NH2+]Cc1c[nH]cn1 ZINC000358507101 356869922 /nfs/dbraw/zinc/86/99/22/356869922.db2.gz NCIWHBKMUFRJGW-JTQLQIEISA-N 1 2 230.315 2.218 20 0 BEADLO CCc1cnccc1[C@@H](C)[NH2+]Cc1c[nH]cn1 ZINC000358507102 356870020 /nfs/dbraw/zinc/87/00/20/356870020.db2.gz NCIWHBKMUFRJGW-SNVBAGLBSA-N 1 2 230.315 2.218 20 0 BEADLO c1cnc([C@@H]2CCC[N@H+]2Cc2cccnc2)nc1 ZINC000639842142 356836671 /nfs/dbraw/zinc/83/66/71/356836671.db2.gz AKIYMKBUEXEFTG-ZDUSSCGKSA-N 1 2 240.310 2.209 20 0 BEADLO c1cnc([C@@H]2CCC[N@@H+]2Cc2cccnc2)nc1 ZINC000639842142 356836676 /nfs/dbraw/zinc/83/66/76/356836676.db2.gz AKIYMKBUEXEFTG-ZDUSSCGKSA-N 1 2 240.310 2.209 20 0 BEADLO COC1(CNc2cc[nH+]c(C3CC3)n2)CCCC1 ZINC000450546046 202193672 /nfs/dbraw/zinc/19/36/72/202193672.db2.gz DFZBAHMVYAWBBX-UHFFFAOYSA-N 1 2 247.342 2.147 20 0 BEADLO CCC[C@H](CC)NC(=O)CCc1c[nH+]c[nH]1 ZINC000352540473 538722693 /nfs/dbraw/zinc/72/26/93/538722693.db2.gz LNVBHEKPZZCQKX-JTQLQIEISA-N 1 2 223.320 2.037 20 0 BEADLO CCC[C@H](CC)NC(=O)CCc1c[nH]c[nH+]1 ZINC000352540473 538722700 /nfs/dbraw/zinc/72/27/00/538722700.db2.gz LNVBHEKPZZCQKX-JTQLQIEISA-N 1 2 223.320 2.037 20 0 BEADLO CCOCCCNc1nc(N)c2ccccc2[nH+]1 ZINC000041146488 356858780 /nfs/dbraw/zinc/85/87/80/356858780.db2.gz XZHBJZVUPHJIAM-UHFFFAOYSA-N 1 2 246.314 2.051 20 0 BEADLO Fc1ccc(C2([NH2+]Cc3cnns3)CC2)cc1 ZINC000450555587 202196873 /nfs/dbraw/zinc/19/68/73/202196873.db2.gz LUMGXHQUWHKSHW-UHFFFAOYSA-N 1 2 249.314 2.456 20 0 BEADLO CC[C@H](Nc1cc[nH+]c(C)n1)C(F)F ZINC000450564218 202198004 /nfs/dbraw/zinc/19/80/04/202198004.db2.gz MGYXLANFCARLCV-ZETCQYMHSA-N 1 2 201.220 2.241 20 0 BEADLO Cc1nocc1C[N@@H+]1CCC[C@@H]1c1ncccn1 ZINC000639864543 356900951 /nfs/dbraw/zinc/90/09/51/356900951.db2.gz DZUMGUWUZYAKQT-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1nocc1C[N@H+]1CCC[C@@H]1c1ncccn1 ZINC000639864543 356900956 /nfs/dbraw/zinc/90/09/56/356900956.db2.gz DZUMGUWUZYAKQT-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO CCC[C@@H](CNc1cc[nH+]c(C(C)C)n1)OC ZINC000450581093 202203306 /nfs/dbraw/zinc/20/33/06/202203306.db2.gz HKMMJRODJMUNCA-NSHDSACASA-N 1 2 237.347 2.249 20 0 BEADLO Cc1ccc(CCCNc2c[nH]cn2)c[nH+]1 ZINC000390555331 357103898 /nfs/dbraw/zinc/10/38/98/357103898.db2.gz QCVBWPDLGNQLJV-UHFFFAOYSA-N 1 2 216.288 2.158 20 0 BEADLO C[C@@H](CC(C)(C)C)C(=O)NCc1c[nH+]cn1C ZINC000355252140 538791466 /nfs/dbraw/zinc/79/14/66/538791466.db2.gz KTWJSFUIWHKBRZ-JTQLQIEISA-N 1 2 237.347 2.109 20 0 BEADLO CC[C@@H](CC(=O)NCc1c[nH+]cn1C)C(C)C ZINC000355256002 538791889 /nfs/dbraw/zinc/79/18/89/538791889.db2.gz NKCGRUVAYXEKFX-NSHDSACASA-N 1 2 237.347 2.109 20 0 BEADLO COC1(C[C@H](C)Nc2c[nH]c[nH+]2)CCC1 ZINC000389975293 357076748 /nfs/dbraw/zinc/07/67/48/357076748.db2.gz FBGXZIIXMBXAPB-VIFPVBQESA-N 1 2 209.293 2.169 20 0 BEADLO c1[nH]cc(N[C@@H]2CCCC23CCOCC3)[nH+]1 ZINC000390280269 357087725 /nfs/dbraw/zinc/08/77/25/357087725.db2.gz VAHUDEUMMIIGER-SNVBAGLBSA-N 1 2 221.304 2.171 20 0 BEADLO CCO[C@@H]1C[C@H](Nc2c[nH]c[nH+]2)C12CCC2 ZINC000390493581 357096618 /nfs/dbraw/zinc/09/66/18/357096618.db2.gz RDPVZMJCMKVTNM-VHSXEESVSA-N 1 2 221.304 2.169 20 0 BEADLO Fc1cc(F)c(CNc2c[nH]c[nH+]2)cc1F ZINC000390764258 357115482 /nfs/dbraw/zinc/11/54/82/357115482.db2.gz PAKOTJKXCTYCPP-UHFFFAOYSA-N 1 2 227.189 2.439 20 0 BEADLO CC(C)c1ccoc1C(=O)NCc1c[nH+]cn1C ZINC000356755984 538816113 /nfs/dbraw/zinc/81/61/13/538816113.db2.gz UIOYYLVPFGGWRY-UHFFFAOYSA-N 1 2 247.298 2.067 20 0 BEADLO C[C@@H](CCC1CC1)NC(=O)CCc1c[nH+]c[nH]1 ZINC000356249485 538809423 /nfs/dbraw/zinc/80/94/23/538809423.db2.gz FSIOHHAPOHCNPE-JTQLQIEISA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H](CCC1CC1)NC(=O)CCc1c[nH]c[nH+]1 ZINC000356249485 538809432 /nfs/dbraw/zinc/80/94/32/538809432.db2.gz FSIOHHAPOHCNPE-JTQLQIEISA-N 1 2 235.331 2.037 20 0 BEADLO FC1(F)CCC[N@H+](Cc2cocn2)CC1 ZINC000628422047 357244208 /nfs/dbraw/zinc/24/42/08/357244208.db2.gz KKNPOUSQIUFDMO-UHFFFAOYSA-N 1 2 216.231 2.296 20 0 BEADLO FC1(F)CCC[N@@H+](Cc2cocn2)CC1 ZINC000628422047 357244214 /nfs/dbraw/zinc/24/42/14/357244214.db2.gz KKNPOUSQIUFDMO-UHFFFAOYSA-N 1 2 216.231 2.296 20 0 BEADLO COc1cc(C)ccc1C[NH+]1CC2(C1)CCCO2 ZINC000628427746 357259226 /nfs/dbraw/zinc/25/92/26/357259226.db2.gz XDSGBEJYTATUGE-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO CSc1ccc(NC(=O)Cn2cc[nH+]c2)cc1 ZINC000010809914 357365217 /nfs/dbraw/zinc/36/52/17/357365217.db2.gz KECZJEVRKZCCJY-UHFFFAOYSA-N 1 2 247.323 2.244 20 0 BEADLO C[N@H+](Cc1nnc(C2CC2)o1)[C@H]1CC1(C)C ZINC000582701555 357365685 /nfs/dbraw/zinc/36/56/85/357365685.db2.gz XUXJXVKRGKAVDG-VIFPVBQESA-N 1 2 221.304 2.177 20 0 BEADLO C[N@@H+](Cc1nnc(C2CC2)o1)[C@H]1CC1(C)C ZINC000582701555 357365691 /nfs/dbraw/zinc/36/56/91/357365691.db2.gz XUXJXVKRGKAVDG-VIFPVBQESA-N 1 2 221.304 2.177 20 0 BEADLO Cc1nc(N2CCC[C@H]2[C@@H]2CCCOC2)cc[nH+]1 ZINC000582902733 357426230 /nfs/dbraw/zinc/42/62/30/357426230.db2.gz KWDNRIPBQMULBE-OLZOCXBDSA-N 1 2 247.342 2.180 20 0 BEADLO Cc1ccc(NC(=O)C[C@H](C)n2cc[nH+]c2)cn1 ZINC000582908000 357433559 /nfs/dbraw/zinc/43/35/59/357433559.db2.gz QEDKILIYGLXCOW-NSHDSACASA-N 1 2 244.298 2.176 20 0 BEADLO CCc1noc(-c2ccn3c(C)c[nH+]c3c2)n1 ZINC000582915553 357435248 /nfs/dbraw/zinc/43/52/48/357435248.db2.gz GWMDAKFJFUILRX-UHFFFAOYSA-N 1 2 228.255 2.255 20 0 BEADLO c1cn(-c2ccccc2)nc1CNc1c[nH]c[nH+]1 ZINC000583175370 357502942 /nfs/dbraw/zinc/50/29/42/357502942.db2.gz RVZDXVCAZJWSNZ-UHFFFAOYSA-N 1 2 239.282 2.208 20 0 BEADLO CCOc1cc(C)ccc1[NH2+]C[C@H](C)CO ZINC000157967504 538845118 /nfs/dbraw/zinc/84/51/18/538845118.db2.gz WQWQLODPQNFEKZ-NSHDSACASA-N 1 2 223.316 2.434 20 0 BEADLO CC[C@H](C)CC(=O)NCc1ccc[nH+]c1N(C)C ZINC000188678010 357571702 /nfs/dbraw/zinc/57/17/02/357571702.db2.gz AIRDJCMPEWKPGH-NSHDSACASA-N 1 2 249.358 2.200 20 0 BEADLO Cc1cncc(NCCc2cccc(C)[nH+]2)n1 ZINC000359830995 538858892 /nfs/dbraw/zinc/85/88/92/538858892.db2.gz AOEJLMPWWVVOAK-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO Cc1cccc2c1OCC[C@H]2[NH2+]Cc1cc[nH]n1 ZINC000188882076 357595002 /nfs/dbraw/zinc/59/50/02/357595002.db2.gz LUZWBVPCSYCTMV-CYBMUJFWSA-N 1 2 243.310 2.332 20 0 BEADLO C[C@@H](CC(=O)N1CCC[C@@H](C)[C@@H]1C)n1cc[nH+]c1 ZINC000583266498 357765291 /nfs/dbraw/zinc/76/52/91/357765291.db2.gz LXLFIRYEEDLRBE-AGIUHOORSA-N 1 2 249.358 2.481 20 0 BEADLO CCN(C)c1ccc(CNc2nncs2)c[nH+]1 ZINC000191510141 357777643 /nfs/dbraw/zinc/77/76/43/357777643.db2.gz LFZNWJOHNJIJIF-UHFFFAOYSA-N 1 2 249.343 2.001 20 0 BEADLO Cc1ccc2[nH+]c(CNCC(C)(F)F)cn2c1 ZINC000583276783 357802153 /nfs/dbraw/zinc/80/21/53/357802153.db2.gz QKZKGTVDHUHKLJ-UHFFFAOYSA-N 1 2 239.269 2.388 20 0 BEADLO C[C@H]1C[C@H](Nc2nc[nH+]c(N)c2Cl)CS1 ZINC000397998563 357821477 /nfs/dbraw/zinc/82/14/77/357821477.db2.gz RKYNSLDUQJKVFL-WDSKDSINSA-N 1 2 244.751 2.018 20 0 BEADLO C[C@H]1C[C@H](Nc2[nH+]cnc(N)c2Cl)CS1 ZINC000397998563 357821478 /nfs/dbraw/zinc/82/14/78/357821478.db2.gz RKYNSLDUQJKVFL-WDSKDSINSA-N 1 2 244.751 2.018 20 0 BEADLO COCCNc1[nH+]ccc(C)c1Br ZINC000234695235 357822209 /nfs/dbraw/zinc/82/22/09/357822209.db2.gz ZUWRBWUAQDDOSD-UHFFFAOYSA-N 1 2 245.120 2.211 20 0 BEADLO COc1cccc2c1cc[nH+]c2N[C@H](C)CCO ZINC000234918865 357836821 /nfs/dbraw/zinc/83/68/21/357836821.db2.gz CVOZEZVSDAEEAN-SNVBAGLBSA-N 1 2 246.310 2.426 20 0 BEADLO COc1cccc2c1cc[nH+]c2NCCCO ZINC000234910428 357836936 /nfs/dbraw/zinc/83/69/36/357836936.db2.gz STPRCDQWHGXLHL-UHFFFAOYSA-N 1 2 232.283 2.038 20 0 BEADLO C[C@@H]([NH2+]Cc1nc(C2CC2)no1)c1cccnc1 ZINC000193110020 357861344 /nfs/dbraw/zinc/86/13/44/357861344.db2.gz IHWOLRYXAGOSQS-SECBINFHSA-N 1 2 244.298 2.193 20 0 BEADLO C[C@@H](NC(=O)[C@@H](C)C(C)(C)C)c1[nH]cc[nH+]1 ZINC000399141571 357896612 /nfs/dbraw/zinc/89/66/12/357896612.db2.gz URLFTEVGCMKVCF-RKDXNWHRSA-N 1 2 223.320 2.269 20 0 BEADLO CC[C@@]1(C)CCCN(C(=O)Cc2c[nH+]cn2C)C1 ZINC000583771601 357940408 /nfs/dbraw/zinc/94/04/08/357940408.db2.gz HDZAJQDHJPSLNR-AWEZNQCLSA-N 1 2 249.358 2.001 20 0 BEADLO Clc1ccc(C[NH2+]Cc2ccno2)o1 ZINC000219394841 357995484 /nfs/dbraw/zinc/99/54/84/357995484.db2.gz SGRDSQFRMHUUEM-UHFFFAOYSA-N 1 2 212.636 2.211 20 0 BEADLO Cc1n[nH]cc1C[N@H+](C)Cc1cc(C2CC2)no1 ZINC000639971054 358020054 /nfs/dbraw/zinc/02/00/54/358020054.db2.gz BDNORQYLEHDAAP-UHFFFAOYSA-N 1 2 246.314 2.216 20 0 BEADLO Cc1n[nH]cc1C[N@@H+](C)Cc1cc(C2CC2)no1 ZINC000639971054 358020055 /nfs/dbraw/zinc/02/00/55/358020055.db2.gz BDNORQYLEHDAAP-UHFFFAOYSA-N 1 2 246.314 2.216 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)[C@@H]1C=CCCC1 ZINC000639970739 358024324 /nfs/dbraw/zinc/02/43/24/358024324.db2.gz RMPXFWXMXBDECT-GFCCVEGCSA-N 1 2 205.305 2.259 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)[C@@H]1C=CCCC1 ZINC000639970739 358024328 /nfs/dbraw/zinc/02/43/28/358024328.db2.gz RMPXFWXMXBDECT-GFCCVEGCSA-N 1 2 205.305 2.259 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1cc2ccccc2[nH]1 ZINC000610619735 358025470 /nfs/dbraw/zinc/02/54/70/358025470.db2.gz PDFQTZHGXKBSPY-SNVBAGLBSA-N 1 2 246.310 2.161 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1cc2ccccc2[nH]1 ZINC000610619735 358025471 /nfs/dbraw/zinc/02/54/71/358025471.db2.gz PDFQTZHGXKBSPY-SNVBAGLBSA-N 1 2 246.310 2.161 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)CC[C@@H]1CCCCO1 ZINC000639971804 358030766 /nfs/dbraw/zinc/03/07/66/358030766.db2.gz XDGOAEKYPFHVQE-ZDUSSCGKSA-N 1 2 237.347 2.109 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)CC[C@@H]1CCCCO1 ZINC000639971804 358030769 /nfs/dbraw/zinc/03/07/69/358030769.db2.gz XDGOAEKYPFHVQE-ZDUSSCGKSA-N 1 2 237.347 2.109 20 0 BEADLO Cc1ccoc1C[N@@H+]1CCO[C@H](CCF)C1 ZINC000628458097 358040431 /nfs/dbraw/zinc/04/04/31/358040431.db2.gz CLSULXFZKKLMKS-LLVKDONJSA-N 1 2 227.279 2.148 20 0 BEADLO Cc1ccoc1C[N@H+]1CCO[C@H](CCF)C1 ZINC000628458097 358040436 /nfs/dbraw/zinc/04/04/36/358040436.db2.gz CLSULXFZKKLMKS-LLVKDONJSA-N 1 2 227.279 2.148 20 0 BEADLO CCn1ccnc1[C@@H](C)NCc1[nH]c(C)c(C)[nH+]1 ZINC000584540881 358049142 /nfs/dbraw/zinc/04/91/42/358049142.db2.gz OIEZDDHGZMMPJY-LLVKDONJSA-N 1 2 247.346 2.094 20 0 BEADLO COc1ccc(C)cc1C[N@@H+]1CCC(=O)[C@@H](C)C1 ZINC000168894682 134248885 /nfs/dbraw/zinc/24/88/85/134248885.db2.gz PPNZNGKTJSLCRI-LBPRGKRZSA-N 1 2 247.338 2.415 20 0 BEADLO COc1ccc(C)cc1C[N@H+]1CCC(=O)[C@@H](C)C1 ZINC000168894682 134248886 /nfs/dbraw/zinc/24/88/86/134248886.db2.gz PPNZNGKTJSLCRI-LBPRGKRZSA-N 1 2 247.338 2.415 20 0 BEADLO Cc1occc1C[N@@H+]1CCO[C@@H](CCF)C1 ZINC000628458857 358094018 /nfs/dbraw/zinc/09/40/18/358094018.db2.gz GPIADFWTRIVIBQ-LBPRGKRZSA-N 1 2 227.279 2.148 20 0 BEADLO Cc1occc1C[N@H+]1CCO[C@@H](CCF)C1 ZINC000628458857 358094021 /nfs/dbraw/zinc/09/40/21/358094021.db2.gz GPIADFWTRIVIBQ-LBPRGKRZSA-N 1 2 227.279 2.148 20 0 BEADLO CCN(Cc1[nH+]ccn1C)[C@H](C)C(F)(F)F ZINC000640065664 358154080 /nfs/dbraw/zinc/15/40/80/358154080.db2.gz ZDQOVSITESLCIM-MRVPVSSYSA-N 1 2 235.253 2.193 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCC[C@@](O)(CC)C1 ZINC000640036829 358137153 /nfs/dbraw/zinc/13/71/53/358137153.db2.gz XWXTXYWTQHBDPP-JTQLQIEISA-N 1 2 221.291 2.269 20 0 BEADLO CCC(F)(F)C[N@H+]1CCC[C@@](O)(CC)C1 ZINC000640036829 358137157 /nfs/dbraw/zinc/13/71/57/358137157.db2.gz XWXTXYWTQHBDPP-JTQLQIEISA-N 1 2 221.291 2.269 20 0 BEADLO C[C@@H](O)CC[N@H+](CC(F)F)CC1CCC1 ZINC000450635257 202220628 /nfs/dbraw/zinc/22/06/28/202220628.db2.gz JFPMRTRHTNJBPB-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO C[C@@H](O)CC[N@@H+](CC(F)F)CC1CCC1 ZINC000450635257 202220631 /nfs/dbraw/zinc/22/06/31/202220631.db2.gz JFPMRTRHTNJBPB-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO CCN(c1cc(C)[nH+]c(C(C)C)n1)C1COC1 ZINC000450647607 202224922 /nfs/dbraw/zinc/22/49/22/202224922.db2.gz GVLFVLZJEGVIEI-UHFFFAOYSA-N 1 2 235.331 2.134 20 0 BEADLO CC[C@H]1[C@@H](CO)CCN1c1cc[nH+]c(C(C)C)n1 ZINC000450658635 202227395 /nfs/dbraw/zinc/22/73/95/202227395.db2.gz NUKASNVQZMFYMF-NEPJUHHUSA-N 1 2 249.358 2.197 20 0 BEADLO CC[C@@H]1[C@H](CO)CCN1c1cc[nH+]c(C(C)C)n1 ZINC000450658636 202228447 /nfs/dbraw/zinc/22/84/47/202228447.db2.gz NUKASNVQZMFYMF-NWDGAFQWSA-N 1 2 249.358 2.197 20 0 BEADLO CC[C@@](C)([NH2+]CC1=CCCCC1)C(=O)OC ZINC000450657305 202228502 /nfs/dbraw/zinc/22/85/02/202228502.db2.gz LFGITNDELDZZBU-CYBMUJFWSA-N 1 2 225.332 2.418 20 0 BEADLO CC[C@@H]1[C@@H](CO)CCN1c1cc[nH+]c(C(C)C)n1 ZINC000450658638 202229047 /nfs/dbraw/zinc/22/90/47/202229047.db2.gz NUKASNVQZMFYMF-VXGBXAGGSA-N 1 2 249.358 2.197 20 0 BEADLO CC/C=C\CNc1cc[nH+]c(C2CC2)n1 ZINC000450695122 202236529 /nfs/dbraw/zinc/23/65/29/202236529.db2.gz PJXALAAQFADDOG-ARJAWSKDSA-N 1 2 203.289 2.154 20 0 BEADLO CCCC[C@H]([NH2+]Cc1c[nH]nn1)C1CCC1 ZINC000450730298 202250121 /nfs/dbraw/zinc/25/01/21/202250121.db2.gz WAGCPBIVTGVUCF-LBPRGKRZSA-N 1 2 222.336 2.253 20 0 BEADLO CCCC[C@H]([NH2+]Cc1cn[nH]n1)C1CCC1 ZINC000450730298 202250123 /nfs/dbraw/zinc/25/01/23/202250123.db2.gz WAGCPBIVTGVUCF-LBPRGKRZSA-N 1 2 222.336 2.253 20 0 BEADLO CC(C)[C@@H](C)CNC(=O)c1ccc2[nH+]ccn2c1 ZINC000172450581 134266176 /nfs/dbraw/zinc/26/61/76/134266176.db2.gz SRAJSIZAZXGAEN-NSHDSACASA-N 1 2 245.326 2.356 20 0 BEADLO COc1ccnc(C[NH2+][C@@H](C)c2ccc(C)o2)n1 ZINC000450726999 202246711 /nfs/dbraw/zinc/24/67/11/202246711.db2.gz XALLCSLIGZSBTI-JTQLQIEISA-N 1 2 247.298 2.237 20 0 BEADLO CO[C@H]1CCN(c2cc(C)[nH+]cn2)CC1(C)C ZINC000450749852 202255926 /nfs/dbraw/zinc/25/59/26/202255926.db2.gz AFHZFSGTOAYYTL-NSHDSACASA-N 1 2 235.331 2.036 20 0 BEADLO COC(=O)C1(CNc2cccc[nH+]2)CCCC1 ZINC000610952967 358333298 /nfs/dbraw/zinc/33/32/98/358333298.db2.gz MXIBFQLCJRVWEJ-UHFFFAOYSA-N 1 2 234.299 2.227 20 0 BEADLO Cc1nn(C)cc1C[NH2+][C@H](C)c1cscn1 ZINC000229134478 358345823 /nfs/dbraw/zinc/34/58/23/358345823.db2.gz PLUMHILUNRSHCJ-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO CCc1nc(CCc2[nH+]cccc2C)no1 ZINC000351132930 366422943 /nfs/dbraw/zinc/42/29/43/366422943.db2.gz QCRXKBMLFMUXTN-UHFFFAOYSA-N 1 2 217.272 2.121 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)C=C1CCCCC1 ZINC000055996545 363608268 /nfs/dbraw/zinc/60/82/68/363608268.db2.gz TWFWYWSYOWRJEA-LBPRGKRZSA-N 1 2 247.342 2.278 20 0 BEADLO CSCCc1nc(Cc2ccc[nH+]c2C)no1 ZINC000351226131 366454313 /nfs/dbraw/zinc/45/43/13/366454313.db2.gz DIURJDAZVGEBTJ-UHFFFAOYSA-N 1 2 249.339 2.269 20 0 BEADLO CC[C@H]1C[N@H+](Cc2nc3ccccc3o2)CCO1 ZINC000045752493 358563197 /nfs/dbraw/zinc/56/31/97/358563197.db2.gz RUIPMSKPBFCHPX-NSHDSACASA-N 1 2 246.310 2.439 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2nc3ccccc3o2)CCO1 ZINC000045752493 358563200 /nfs/dbraw/zinc/56/32/00/358563200.db2.gz RUIPMSKPBFCHPX-NSHDSACASA-N 1 2 246.310 2.439 20 0 BEADLO CC[C@H](NC(=O)c1coc(C)c1)c1[nH]cc[nH+]1 ZINC000130669555 358639352 /nfs/dbraw/zinc/63/93/52/358639352.db2.gz HOOVYZNXTSRXGT-JTQLQIEISA-N 1 2 233.271 2.192 20 0 BEADLO CC[N@H+](C/C=C/c1ccccc1)CC(=O)OC ZINC000049949475 358707781 /nfs/dbraw/zinc/70/77/81/358707781.db2.gz XGGPSYASIONIRG-JXMROGBWSA-N 1 2 233.311 2.195 20 0 BEADLO CC[N@@H+](C/C=C/c1ccccc1)CC(=O)OC ZINC000049949475 358707782 /nfs/dbraw/zinc/70/77/82/358707782.db2.gz XGGPSYASIONIRG-JXMROGBWSA-N 1 2 233.311 2.195 20 0 BEADLO C[C@H](Cc1nc(C(C)(C)C)no1)n1cc[nH+]c1 ZINC000351396853 366522047 /nfs/dbraw/zinc/52/20/47/366522047.db2.gz FBYMFRHSWLJVFY-SECBINFHSA-N 1 2 234.303 2.367 20 0 BEADLO C[C@@H]1[C@@H](C)CC[N@@H+]1Cc1noc(C2CC2)n1 ZINC000177908959 134301777 /nfs/dbraw/zinc/30/17/77/134301777.db2.gz USLWZHWWGGJGIT-DTWKUNHWSA-N 1 2 221.304 2.177 20 0 BEADLO C[C@@H]1[C@@H](C)CC[N@H+]1Cc1noc(C2CC2)n1 ZINC000177908959 134301778 /nfs/dbraw/zinc/30/17/78/134301778.db2.gz USLWZHWWGGJGIT-DTWKUNHWSA-N 1 2 221.304 2.177 20 0 BEADLO Cc1csc(C[NH2+][C@@H](C)c2cnccn2)n1 ZINC000070025432 359039325 /nfs/dbraw/zinc/03/93/25/359039325.db2.gz DMTCSWNZGSLWQC-VIFPVBQESA-N 1 2 234.328 2.092 20 0 BEADLO CCc1ccc(C(=O)N(C)Cc2[nH]cc[nH+]2)cc1 ZINC000070979121 359067959 /nfs/dbraw/zinc/06/79/59/359067959.db2.gz IYDRAZQUQCBAJO-UHFFFAOYSA-N 1 2 243.310 2.244 20 0 BEADLO Cn1cc[nH+]c1CNc1ncnc2ccsc21 ZINC000071140341 359071998 /nfs/dbraw/zinc/07/19/98/359071998.db2.gz ZHCWLWIRWXMHSH-UHFFFAOYSA-N 1 2 245.311 2.037 20 0 BEADLO Cc1cc(NC[C@@H](O)C2CC2)nc(C(C)C)[nH+]1 ZINC000071306129 359077186 /nfs/dbraw/zinc/07/71/86/359077186.db2.gz HLCJWZIWZNRFID-LLVKDONJSA-N 1 2 235.331 2.091 20 0 BEADLO Cc1cc[nH+]cc1NCc1cccc(C(N)=O)c1 ZINC000071413883 359079481 /nfs/dbraw/zinc/07/94/81/359079481.db2.gz UPKFNAHEBJYESF-UHFFFAOYSA-N 1 2 241.294 2.101 20 0 BEADLO COc1ccccc1Cc1cn(CCF)c[nH+]1 ZINC001641480933 1172253443 /nfs/dbraw/zinc/25/34/43/1172253443.db2.gz FHQCQVYPQJHJBM-UHFFFAOYSA-N 1 2 234.274 2.452 20 0 BEADLO CC[N@H+](Cc1ccoc1)[C@@H](C(=O)OC)C1CC1 ZINC000611661561 359412243 /nfs/dbraw/zinc/41/22/43/359412243.db2.gz HULUYHDCLDLBOT-GFCCVEGCSA-N 1 2 237.299 2.053 20 0 BEADLO CC[N@@H+](Cc1ccoc1)[C@@H](C(=O)OC)C1CC1 ZINC000611661561 359412248 /nfs/dbraw/zinc/41/22/48/359412248.db2.gz HULUYHDCLDLBOT-GFCCVEGCSA-N 1 2 237.299 2.053 20 0 BEADLO CC[N@H+](Cc1ccoc1)[C@H](C(=O)OC)C1CC1 ZINC000611661562 359412276 /nfs/dbraw/zinc/41/22/76/359412276.db2.gz HULUYHDCLDLBOT-LBPRGKRZSA-N 1 2 237.299 2.053 20 0 BEADLO CC[N@@H+](Cc1ccoc1)[C@H](C(=O)OC)C1CC1 ZINC000611661562 359412282 /nfs/dbraw/zinc/41/22/82/359412282.db2.gz HULUYHDCLDLBOT-LBPRGKRZSA-N 1 2 237.299 2.053 20 0 BEADLO OC[C@@H]([C@@H](Nc1cccc[nH+]1)C1CC1)C1CC1 ZINC000450778871 202264274 /nfs/dbraw/zinc/26/42/74/202264274.db2.gz NZFYQTBJVUZNSH-OCCSQVGLSA-N 1 2 232.327 2.291 20 0 BEADLO Nc1[nH+]cnc(N[C@H]2CC[C@H](F)C2)c1Cl ZINC000308997160 491142109 /nfs/dbraw/zinc/14/21/09/491142109.db2.gz MXEIQOBTCRFODX-WDSKDSINSA-N 1 2 230.674 2.015 20 0 BEADLO Nc1nc[nH+]c(N[C@H]2CC[C@H](F)C2)c1Cl ZINC000308997160 491142110 /nfs/dbraw/zinc/14/21/10/491142110.db2.gz MXEIQOBTCRFODX-WDSKDSINSA-N 1 2 230.674 2.015 20 0 BEADLO CC(C)CC[C@@H]1CCC[C@H]1[NH2+]Cc1c[nH]nn1 ZINC000450820175 202276074 /nfs/dbraw/zinc/27/60/74/202276074.db2.gz NLQGZRARUJWODW-WCQYABFASA-N 1 2 236.363 2.499 20 0 BEADLO CC(C)CC[C@@H]1CCC[C@H]1[NH2+]Cc1cn[nH]n1 ZINC000450820175 202276077 /nfs/dbraw/zinc/27/60/77/202276077.db2.gz NLQGZRARUJWODW-WCQYABFASA-N 1 2 236.363 2.499 20 0 BEADLO C[C@@H](c1csnn1)[N@H+](C)CC[C@@H]1CCCO1 ZINC000450826218 202277448 /nfs/dbraw/zinc/27/74/48/202277448.db2.gz ZBSFOAFUZCFHRS-UWVGGRQHSA-N 1 2 241.360 2.100 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+](C)CC[C@@H]1CCCO1 ZINC000450826218 202277451 /nfs/dbraw/zinc/27/74/51/202277451.db2.gz ZBSFOAFUZCFHRS-UWVGGRQHSA-N 1 2 241.360 2.100 20 0 BEADLO CN(c1cccc[nH+]1)[C@H](CO)CC(C)(C)C ZINC000450830798 202279990 /nfs/dbraw/zinc/27/99/90/202279990.db2.gz FAQHTYDJTIBQJL-NSHDSACASA-N 1 2 222.332 2.315 20 0 BEADLO CCn1ccnc1[C@H](C)Nc1cc(C)[nH+]cn1 ZINC000450835692 202283750 /nfs/dbraw/zinc/28/37/50/202283750.db2.gz XPUUMFYDSHGPEX-JTQLQIEISA-N 1 2 231.303 2.175 20 0 BEADLO CO[C@@H]1CC[C@H](C(=O)Nc2ccc(C)[nH+]c2C)C1 ZINC000612227031 359740612 /nfs/dbraw/zinc/74/06/12/359740612.db2.gz PJSQKUKOSSPQSR-NWDGAFQWSA-N 1 2 248.326 2.452 20 0 BEADLO CC(C)c1nc(NCCC[C@@H]2CCOC2)cc[nH+]1 ZINC000450885430 202297045 /nfs/dbraw/zinc/29/70/45/202297045.db2.gz BXNBAAQCSJCYGW-GFCCVEGCSA-N 1 2 249.358 2.251 20 0 BEADLO CO[C@@H](COCc1[nH]cc[nH+]1)Cc1ccccc1 ZINC000450891875 202300465 /nfs/dbraw/zinc/30/04/65/202300465.db2.gz BUGOLKCVZJCQGL-CYBMUJFWSA-N 1 2 246.310 2.184 20 0 BEADLO CC[C@@H](O)[C@H](CC)Nc1cc[nH+]c2ccncc12 ZINC000450866673 202293491 /nfs/dbraw/zinc/29/34/91/202293491.db2.gz XODJKPGPQBVKDZ-SMDDNHRTSA-N 1 2 245.326 2.013 20 0 BEADLO COC(=O)c1ccc(C[N@@H+]2CC[C@H](F)C2)s1 ZINC000451191447 202376158 /nfs/dbraw/zinc/37/61/58/202376158.db2.gz RMHMUPWQTQLPIO-QMMMGPOBSA-N 1 2 243.303 2.079 20 0 BEADLO COC(=O)c1ccc(C[N@H+]2CC[C@H](F)C2)s1 ZINC000451191447 202376159 /nfs/dbraw/zinc/37/61/59/202376159.db2.gz RMHMUPWQTQLPIO-QMMMGPOBSA-N 1 2 243.303 2.079 20 0 BEADLO Fc1ccccc1OCC[N@H+]1CC[C@H](F)C1 ZINC000451191495 202377119 /nfs/dbraw/zinc/37/71/19/202377119.db2.gz RNZXZZYAPBNOSY-JTQLQIEISA-N 1 2 227.254 2.248 20 0 BEADLO Fc1ccccc1OCC[N@@H+]1CC[C@H](F)C1 ZINC000451191495 202377120 /nfs/dbraw/zinc/37/71/20/202377120.db2.gz RNZXZZYAPBNOSY-JTQLQIEISA-N 1 2 227.254 2.248 20 0 BEADLO CCCc1nc(C)c(C[N@@H+]2CC[C@@H](F)C2)o1 ZINC000451195519 202377182 /nfs/dbraw/zinc/37/71/82/202377182.db2.gz LXQUXBDWSHYMRE-SNVBAGLBSA-N 1 2 226.295 2.479 20 0 BEADLO CCCc1nc(C)c(C[N@H+]2CC[C@@H](F)C2)o1 ZINC000451195519 202377185 /nfs/dbraw/zinc/37/71/85/202377185.db2.gz LXQUXBDWSHYMRE-SNVBAGLBSA-N 1 2 226.295 2.479 20 0 BEADLO CC[N@H+](Cc1nc2ccccc2o1)C1COC1 ZINC000451283074 202393945 /nfs/dbraw/zinc/39/39/45/202393945.db2.gz GHPYOZAQYJVEQT-UHFFFAOYSA-N 1 2 232.283 2.049 20 0 BEADLO CC[N@@H+](Cc1nc2ccccc2o1)C1COC1 ZINC000451283074 202393949 /nfs/dbraw/zinc/39/39/49/202393949.db2.gz GHPYOZAQYJVEQT-UHFFFAOYSA-N 1 2 232.283 2.049 20 0 BEADLO Cc1cc(C(=O)Nc2cc(C)[nH+]cc2C)ns1 ZINC000578597232 366604275 /nfs/dbraw/zinc/60/42/75/366604275.db2.gz NMYRTJBFVLXKJO-UHFFFAOYSA-N 1 2 247.323 2.138 20 0 BEADLO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1cnccn1 ZINC000578615227 366607182 /nfs/dbraw/zinc/60/71/82/366607182.db2.gz ZJHXRKCBFDXSAE-HZMBPMFUSA-N 1 2 241.294 2.088 20 0 BEADLO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1cnccn1 ZINC000578615229 366607968 /nfs/dbraw/zinc/60/79/68/366607968.db2.gz ZJHXRKCBFDXSAE-QMTHXVAHSA-N 1 2 241.294 2.088 20 0 BEADLO CC(C)n1cc([C@@H](C)[NH2+]Cc2ncccn2)cn1 ZINC000578699406 366628214 /nfs/dbraw/zinc/62/82/14/366628214.db2.gz KDWZHDQDYMARAK-LLVKDONJSA-N 1 2 245.330 2.105 20 0 BEADLO CCc1sc(C(=O)NCc2c[nH+]c[nH]2)cc1C ZINC000088759123 359975761 /nfs/dbraw/zinc/97/57/61/359975761.db2.gz KZPWKGMRXIOWNP-UHFFFAOYSA-N 1 2 249.339 2.272 20 0 BEADLO CCc1sc(C(=O)NCc2c[nH]c[nH+]2)cc1C ZINC000088759123 359975762 /nfs/dbraw/zinc/97/57/62/359975762.db2.gz KZPWKGMRXIOWNP-UHFFFAOYSA-N 1 2 249.339 2.272 20 0 BEADLO CCCc1ccccc1NC(=O)Cn1cc[nH+]c1 ZINC000578929016 366675759 /nfs/dbraw/zinc/67/57/59/366675759.db2.gz BMONQOIZDPPJTA-UHFFFAOYSA-N 1 2 243.310 2.474 20 0 BEADLO Cc1ccc(O)c(CNc2ccc[nH+]c2C)n1 ZINC000091995832 360144484 /nfs/dbraw/zinc/14/44/84/360144484.db2.gz DTBARTUDWBUQNB-UHFFFAOYSA-N 1 2 229.283 2.411 20 0 BEADLO COCC[N@H+](C)Cc1nccc(Cl)c1Cl ZINC001641608594 1172274452 /nfs/dbraw/zinc/27/44/52/1172274452.db2.gz AZCRIAGXCHFAOE-UHFFFAOYSA-N 1 2 249.141 2.467 20 0 BEADLO COCC[N@@H+](C)Cc1nccc(Cl)c1Cl ZINC001641608594 1172274460 /nfs/dbraw/zinc/27/44/60/1172274460.db2.gz AZCRIAGXCHFAOE-UHFFFAOYSA-N 1 2 249.141 2.467 20 0 BEADLO Cc1[nH+]c2ccccc2n1CCC(=O)NC1CC1 ZINC000094165687 360297432 /nfs/dbraw/zinc/29/74/32/360297432.db2.gz UMIGQVACELPDPT-UHFFFAOYSA-N 1 2 243.310 2.013 20 0 BEADLO Cc1ccc(/C=C\C(=O)N[C@H](C)c2[nH]cc[nH+]2)o1 ZINC000380244201 366680950 /nfs/dbraw/zinc/68/09/50/366680950.db2.gz JTQKAGNAMKSZBM-WWQCOOJYSA-N 1 2 245.282 2.202 20 0 BEADLO c1coc(C[N@@H+]2CCO[C@H](c3ccco3)C2)c1 ZINC000093841152 360283519 /nfs/dbraw/zinc/28/35/19/360283519.db2.gz ARMDJZXRAJMLJU-ZDUSSCGKSA-N 1 2 233.267 2.446 20 0 BEADLO c1coc(C[N@H+]2CCO[C@H](c3ccco3)C2)c1 ZINC000093841152 360283522 /nfs/dbraw/zinc/28/35/22/360283522.db2.gz ARMDJZXRAJMLJU-ZDUSSCGKSA-N 1 2 233.267 2.446 20 0 BEADLO Cc1ccc(NCc2ncnn2C(C)C)c(C)[nH+]1 ZINC000631099431 360400927 /nfs/dbraw/zinc/40/09/27/360400927.db2.gz WOYJMTVXKJMDMA-UHFFFAOYSA-N 1 2 245.330 2.483 20 0 BEADLO CC(C)(C(=O)N[C@@H]1CCCC12CC2)c1c[nH]c[nH+]1 ZINC000633776301 360472623 /nfs/dbraw/zinc/47/26/23/360472623.db2.gz BODBARBGYSAIOH-SNVBAGLBSA-N 1 2 247.342 2.136 20 0 BEADLO Brc1cccc(C[NH+]2CCC2)n1 ZINC000238025704 360534331 /nfs/dbraw/zinc/53/43/31/360534331.db2.gz NHNKLRRXGHHPCG-UHFFFAOYSA-N 1 2 227.105 2.050 20 0 BEADLO CCCC[N@H+](C)Cc1csc(NC(C)=O)n1 ZINC000061757670 360660765 /nfs/dbraw/zinc/66/07/65/360660765.db2.gz FWDPQYIFRJDROF-UHFFFAOYSA-N 1 2 241.360 2.333 20 0 BEADLO CCCC[N@@H+](C)Cc1csc(NC(C)=O)n1 ZINC000061757670 360660768 /nfs/dbraw/zinc/66/07/68/360660768.db2.gz FWDPQYIFRJDROF-UHFFFAOYSA-N 1 2 241.360 2.333 20 0 BEADLO Cc1cc(C)c(C(=O)NCCc2[nH]cc[nH+]2)s1 ZINC000631207935 361022861 /nfs/dbraw/zinc/02/28/61/361022861.db2.gz LYOACXXTIVYNCR-UHFFFAOYSA-N 1 2 249.339 2.061 20 0 BEADLO Nc1[nH+]cccc1CC(=O)c1cccs1 ZINC000069943959 361175332 /nfs/dbraw/zinc/17/53/32/361175332.db2.gz JXVKKFVLPGVYOB-UHFFFAOYSA-N 1 2 218.281 2.151 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccc(Cl)cn2)on1 ZINC000631107020 361181533 /nfs/dbraw/zinc/18/15/33/361181533.db2.gz GVLKWAQLVOOHCF-UHFFFAOYSA-N 1 2 237.690 2.321 20 0 BEADLO CC1=C(C)C[N@H+](Cc2nnc(C3CC3)o2)CC1 ZINC000579184423 366728639 /nfs/dbraw/zinc/72/86/39/366728639.db2.gz ZIITVVSCHJHZFT-UHFFFAOYSA-N 1 2 233.315 2.489 20 0 BEADLO CC1=C(C)C[N@@H+](Cc2nnc(C3CC3)o2)CC1 ZINC000579184423 366728641 /nfs/dbraw/zinc/72/86/41/366728641.db2.gz ZIITVVSCHJHZFT-UHFFFAOYSA-N 1 2 233.315 2.489 20 0 BEADLO CCCC1(C(=O)Nc2ccc(N)[nH+]c2)CCC1 ZINC000428893672 201048016 /nfs/dbraw/zinc/04/80/16/201048016.db2.gz WSOLBHWHIPBDJL-UHFFFAOYSA-N 1 2 233.315 2.403 20 0 BEADLO CC[N@H+](Cc1occc1C)Cc1cnccn1 ZINC000579448604 366804086 /nfs/dbraw/zinc/80/40/86/366804086.db2.gz YKUGPNWCLNEEHI-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1occc1C)Cc1cnccn1 ZINC000579448604 366804092 /nfs/dbraw/zinc/80/40/92/366804092.db2.gz YKUGPNWCLNEEHI-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO Cc1nsc(C)c1C[N@H+]1C[C@@H](C)OC[C@H]1C ZINC000579430717 366782085 /nfs/dbraw/zinc/78/20/85/366782085.db2.gz YLCCDDJLEIXQTQ-RKDXNWHRSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nsc(C)c1C[N@@H+]1C[C@@H](C)OC[C@H]1C ZINC000579430717 366782091 /nfs/dbraw/zinc/78/20/91/366782091.db2.gz YLCCDDJLEIXQTQ-RKDXNWHRSA-N 1 2 240.372 2.369 20 0 BEADLO C[NH2+]c1ccc(NCC2=CCCOC2)cc1 ZINC000629653164 361551210 /nfs/dbraw/zinc/55/12/10/361551210.db2.gz GYRLOVDJPVBFFW-UHFFFAOYSA-N 1 2 218.300 2.487 20 0 BEADLO CNc1ccc([NH2+]C[C@H](C)COC)cc1 ZINC000629653193 361552793 /nfs/dbraw/zinc/55/27/93/361552793.db2.gz CPNJNVDKCMTSSR-JTQLQIEISA-N 1 2 208.305 2.423 20 0 BEADLO C[NH2+]c1ccc(NC[C@H](C)COC)cc1 ZINC000629653193 361552800 /nfs/dbraw/zinc/55/28/00/361552800.db2.gz CPNJNVDKCMTSSR-JTQLQIEISA-N 1 2 208.305 2.423 20 0 BEADLO CC(C)n1ncnc1C[N@H+](C(C)C)C1CC1 ZINC000434533919 201227475 /nfs/dbraw/zinc/22/74/75/201227475.db2.gz FLTAWVZQDDICKY-UHFFFAOYSA-N 1 2 222.336 2.232 20 0 BEADLO CC(C)n1ncnc1C[N@@H+](C(C)C)C1CC1 ZINC000434533919 201227479 /nfs/dbraw/zinc/22/74/79/201227479.db2.gz FLTAWVZQDDICKY-UHFFFAOYSA-N 1 2 222.336 2.232 20 0 BEADLO COCCCNc1ccc(-c2cccnc2)c[nH+]1 ZINC000629711341 361647632 /nfs/dbraw/zinc/64/76/32/361647632.db2.gz DVLPIGUDUSLPQE-UHFFFAOYSA-N 1 2 243.310 2.014 20 0 BEADLO c1cnn(Cc2c[nH+]cn2Cc2ccccc2)c1 ZINC000437605598 201362026 /nfs/dbraw/zinc/36/20/26/201362026.db2.gz RXGQCLRRPLFHPG-UHFFFAOYSA-N 1 2 238.294 2.176 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)C(C)(C)C1CCC1 ZINC000448594487 201383739 /nfs/dbraw/zinc/38/37/39/201383739.db2.gz LZHQOBCWCYIAAE-UHFFFAOYSA-N 1 2 249.358 2.205 20 0 BEADLO CC[C@@](C)(NC(=O)c1c[nH+]c(C)[nH]1)C1CC1 ZINC000618954006 363923512 /nfs/dbraw/zinc/92/35/12/363923512.db2.gz PJUHNOPNGIWGHZ-GFCCVEGCSA-N 1 2 221.304 2.027 20 0 BEADLO CCCCc1csc([C@H]2COCC[NH2+]2)n1 ZINC000630381438 364095864 /nfs/dbraw/zinc/09/58/64/364095864.db2.gz PWSLGHNYHSNDKD-SNVBAGLBSA-N 1 2 226.345 2.147 20 0 BEADLO Cn1ncc2c1nc[nH+]c2N[C@@H]1CCCC12CC2 ZINC000630385864 364100213 /nfs/dbraw/zinc/10/02/13/364100213.db2.gz QQQKQOGQGHGRCL-SNVBAGLBSA-N 1 2 243.314 2.108 20 0 BEADLO C[C@@H](CC1CCC1)Nc1[nH+]cnc2c1cnn2C ZINC000630386928 364101058 /nfs/dbraw/zinc/10/10/58/364101058.db2.gz BIGZWGZJGAQPJY-VIFPVBQESA-N 1 2 245.330 2.354 20 0 BEADLO CCC[N@@H+]1CCO[C@H](C(F)(F)F)[C@@H]1C ZINC000626017370 541341882 /nfs/dbraw/zinc/34/18/82/541341882.db2.gz JDGAPXGAJCEQSK-YUMQZZPRSA-N 1 2 211.227 2.048 20 0 BEADLO CCC[N@H+]1CCO[C@H](C(F)(F)F)[C@@H]1C ZINC000626017370 541341888 /nfs/dbraw/zinc/34/18/88/541341888.db2.gz JDGAPXGAJCEQSK-YUMQZZPRSA-N 1 2 211.227 2.048 20 0 BEADLO CC[C@](C)(NC(=O)CCCn1cc[nH+]c1)C1CC1 ZINC000618958212 364202306 /nfs/dbraw/zinc/20/23/06/364202306.db2.gz YONDXGBHOBNCEL-AWEZNQCLSA-N 1 2 249.358 2.358 20 0 BEADLO Cc1noc(C)c1[C@H](C)[NH2+]Cc1ccnc(C)n1 ZINC000092328082 541345617 /nfs/dbraw/zinc/34/56/17/541345617.db2.gz VLRTUGYPDUDVDT-QMMMGPOBSA-N 1 2 246.314 2.241 20 0 BEADLO c1nc(C[N@@H+]2CCOC3(CCCCC3)C2)co1 ZINC000432746520 192954921 /nfs/dbraw/zinc/95/49/21/192954921.db2.gz CQLCSHTWMWZBGV-UHFFFAOYSA-N 1 2 236.315 2.210 20 0 BEADLO c1nc(C[N@H+]2CCOC3(CCCCC3)C2)co1 ZINC000432746520 192954923 /nfs/dbraw/zinc/95/49/23/192954923.db2.gz CQLCSHTWMWZBGV-UHFFFAOYSA-N 1 2 236.315 2.210 20 0 BEADLO CCc1cc(N2C[C@H](C)O[C@@H](C)[C@@H]2C)nc(C)[nH+]1 ZINC000445670906 541349935 /nfs/dbraw/zinc/34/99/35/541349935.db2.gz YDRAXPHEJVSQBW-DCAQKATOSA-N 1 2 249.358 2.350 20 0 BEADLO O=C(NCC1CC1)c1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000630644302 364374474 /nfs/dbraw/zinc/37/44/74/364374474.db2.gz ZHJHUDRVLBASRE-UHFFFAOYSA-N 1 2 241.294 2.217 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC1(C(F)F)CC1 ZINC000453211652 202707696 /nfs/dbraw/zinc/70/76/96/202707696.db2.gz LAWWSUGTFQMKEV-QMMMGPOBSA-N 1 2 229.274 2.351 20 0 BEADLO Cc1cc(N)nc(S[C@H](C)C(F)(F)F)[nH+]1 ZINC000134584953 541359007 /nfs/dbraw/zinc/35/90/07/541359007.db2.gz UHIPHVRUMKBKDZ-RXMQYKEDSA-N 1 2 237.250 2.410 20 0 BEADLO C=C/C=C/CC(=O)Nc1ccc2[nH+]ccn2c1 ZINC001642038964 1172320800 /nfs/dbraw/zinc/32/08/00/1172320800.db2.gz IWVCLMXMEJSCDD-ONEGZZNKSA-N 1 2 227.267 2.405 20 0 BEADLO C[C@H](Cc1ccco1)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000615157392 364546731 /nfs/dbraw/zinc/54/67/31/364546731.db2.gz DBNZAYXBXRHVJP-NXEZZACHSA-N 1 2 247.298 2.059 20 0 BEADLO C[C@H](O)CCOc1ccccc1-n1cc[nH+]c1 ZINC000573668722 364888317 /nfs/dbraw/zinc/88/83/17/364888317.db2.gz INXUZSBMVGATPC-NSHDSACASA-N 1 2 232.283 2.022 20 0 BEADLO CCOC1(C)C[NH+](Cc2ccncc2C)C1 ZINC000574135953 364993606 /nfs/dbraw/zinc/99/36/06/364993606.db2.gz FJZRYPUKOHBKGH-UHFFFAOYSA-N 1 2 220.316 2.001 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1CCO[C@H](C)C1 ZINC000574170080 365002814 /nfs/dbraw/zinc/00/28/14/365002814.db2.gz JPWGMCAHWYBXBR-KOLCDFICSA-N 1 2 221.304 2.073 20 0 BEADLO c1[nH]cc(NCc2c[nH]nc2-c2ccccc2)[nH+]1 ZINC000574234967 365016882 /nfs/dbraw/zinc/01/68/82/365016882.db2.gz XYGBZJPQAGRFFW-UHFFFAOYSA-N 1 2 239.282 2.412 20 0 BEADLO CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]Cc1ccn[nH]1 ZINC000574389329 365049843 /nfs/dbraw/zinc/04/98/43/365049843.db2.gz GMXVMGYRNXHQIC-BXUZGUMPSA-N 1 2 245.326 2.276 20 0 BEADLO CO[C@H](c1ccccc1)[C@H](C)[NH2+]Cc1ccn[nH]1 ZINC000574389330 365049932 /nfs/dbraw/zinc/04/99/32/365049932.db2.gz GMXVMGYRNXHQIC-FZMZJTMJSA-N 1 2 245.326 2.276 20 0 BEADLO CCN(C(=O)CCn1cc[nH+]c1)[C@H](C)C(C)C ZINC000554215249 325709534 /nfs/dbraw/zinc/70/95/34/325709534.db2.gz BXVZRJRVCGKQEY-GFCCVEGCSA-N 1 2 237.347 2.166 20 0 BEADLO Cc1ccncc1NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000574815493 365151689 /nfs/dbraw/zinc/15/16/89/365151689.db2.gz YAYMCNCFULYUOL-LLVKDONJSA-N 1 2 244.298 2.176 20 0 BEADLO FC(F)(F)[C@H]1CCCN(Cc2[nH]cc[nH+]2)C1 ZINC000171808718 365242310 /nfs/dbraw/zinc/24/23/10/365242310.db2.gz YNHJWVSJWZVDRM-QMMMGPOBSA-N 1 2 233.237 2.184 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CCC[C@H](C3CC3)C2)c[nH+]1 ZINC000575742577 365348248 /nfs/dbraw/zinc/34/82/48/365348248.db2.gz MCGWEVUHXVXJCG-NWDGAFQWSA-N 1 2 247.342 2.417 20 0 BEADLO CCc1cnc(CNc2cc[nH+]cc2F)s1 ZINC000336674721 365349004 /nfs/dbraw/zinc/34/90/04/365349004.db2.gz AXLZCKWTEXHVNA-UHFFFAOYSA-N 1 2 237.303 2.274 20 0 BEADLO COC1(CNc2cc(NC3CC3)nc[nH+]2)CCC1 ZINC000580534355 365337010 /nfs/dbraw/zinc/33/70/10/365337010.db2.gz VPPYBGRJBHDSMW-UHFFFAOYSA-N 1 2 248.330 2.032 20 0 BEADLO COC1(CNc2cc(NC3CC3)[nH+]cn2)CCC1 ZINC000580534355 365337016 /nfs/dbraw/zinc/33/70/16/365337016.db2.gz VPPYBGRJBHDSMW-UHFFFAOYSA-N 1 2 248.330 2.032 20 0 BEADLO CC(C)N(C(=O)Cn1cc[nH+]c1)C1CC(C)(C)C1 ZINC000575844473 365381007 /nfs/dbraw/zinc/38/10/07/365381007.db2.gz KVXVEOOCEYUGIC-UHFFFAOYSA-N 1 2 249.358 2.309 20 0 BEADLO C[C@H](Nc1cc(NC2CC2)[nH+]cn1)c1ccon1 ZINC000576008022 365446974 /nfs/dbraw/zinc/44/69/74/365446974.db2.gz JVEBPSLICUNIJA-QMMMGPOBSA-N 1 2 245.286 2.212 20 0 BEADLO C[C@H](Nc1cc(NC2CC2)nc[nH+]1)c1ccon1 ZINC000576008022 365446978 /nfs/dbraw/zinc/44/69/78/365446978.db2.gz JVEBPSLICUNIJA-QMMMGPOBSA-N 1 2 245.286 2.212 20 0 BEADLO COCC1CCC(Nc2c[nH]c[nH+]2)CC1 ZINC000576103010 365485191 /nfs/dbraw/zinc/48/51/91/365485191.db2.gz OJMSERJREAGWCW-UHFFFAOYSA-N 1 2 209.293 2.027 20 0 BEADLO CCC[C@@H](CC)NC(=O)[C@@H]1CCc2c[nH+]cn2C1 ZINC000576111316 365491151 /nfs/dbraw/zinc/49/11/51/365491151.db2.gz UEGIWCOQFKCGFC-VXGBXAGGSA-N 1 2 249.358 2.140 20 0 BEADLO Cn1c[nH+]cc1Cc1nc(C2CCCCC2)no1 ZINC000350400049 541472738 /nfs/dbraw/zinc/47/27/38/541472738.db2.gz QBIQQUATYXCOAF-UHFFFAOYSA-N 1 2 246.314 2.442 20 0 BEADLO Cc1c(F)cccc1NC(=O)Cc1c[nH+]cn1C ZINC000185781611 367143684 /nfs/dbraw/zinc/14/36/84/367143684.db2.gz PIDGRBNXAWOVHH-UHFFFAOYSA-N 1 2 247.273 2.049 20 0 BEADLO CCN(C(=O)c1ccn2c(C)c[nH+]c2c1)C1CC1 ZINC000580722867 367151736 /nfs/dbraw/zinc/15/17/36/367151736.db2.gz IXRAVZZGRJHBMB-UHFFFAOYSA-N 1 2 243.310 2.267 20 0 BEADLO CC(C)(C)[C@@H]1CCC[C@H]1NC(=O)Cn1cc[nH+]c1 ZINC000581178437 367284128 /nfs/dbraw/zinc/28/41/28/367284128.db2.gz WBJCIDWTEGETCG-VXGBXAGGSA-N 1 2 249.358 2.214 20 0 BEADLO CCOCC[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000194041699 367243818 /nfs/dbraw/zinc/24/38/18/367243818.db2.gz FTIWWUIPDQLXFM-SECBINFHSA-N 1 2 241.335 2.054 20 0 BEADLO C=Cn1cc(C[N@@H+](C)Cc2cccnc2)cn1 ZINC000194585693 367306172 /nfs/dbraw/zinc/30/61/72/367306172.db2.gz TZZMAWSJGXTASV-UHFFFAOYSA-N 1 2 228.299 2.011 20 0 BEADLO C=Cn1cc(C[N@H+](C)Cc2cccnc2)cn1 ZINC000194585693 367306174 /nfs/dbraw/zinc/30/61/74/367306174.db2.gz TZZMAWSJGXTASV-UHFFFAOYSA-N 1 2 228.299 2.011 20 0 BEADLO CCCC[C@H](CC)CNC(=O)Cn1cc[nH+]c1 ZINC000565263310 325889186 /nfs/dbraw/zinc/88/91/86/325889186.db2.gz RFLTUXNBHNCTNH-LBPRGKRZSA-N 1 2 237.347 2.216 20 0 BEADLO Cn1cc2c(n1)CCC[C@@H]2[NH2+]CC(C)(F)F ZINC000382112458 367487294 /nfs/dbraw/zinc/48/72/94/367487294.db2.gz KXUZKYFSANPTOG-VIFPVBQESA-N 1 2 229.274 2.042 20 0 BEADLO COc1ccc[nH+]c1NC[C@@](C)(OC)C1CC1 ZINC000383750275 367652013 /nfs/dbraw/zinc/65/20/13/367652013.db2.gz JUFJBNFUJPYOBN-CYBMUJFWSA-N 1 2 236.315 2.317 20 0 BEADLO Cc1cc(NCC(C)(C)C2CCC2)nc[nH+]1 ZINC000384874869 367748152 /nfs/dbraw/zinc/74/81/52/367748152.db2.gz RWGTVWYPSDQQPE-UHFFFAOYSA-N 1 2 219.332 2.445 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1NC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000581834617 367838556 /nfs/dbraw/zinc/83/85/56/367838556.db2.gz UTEHFKZPPVJFOX-SCDSUCTJSA-N 1 2 249.358 2.139 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1NC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000581834617 367838563 /nfs/dbraw/zinc/83/85/63/367838563.db2.gz UTEHFKZPPVJFOX-SCDSUCTJSA-N 1 2 249.358 2.139 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1NC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000581834615 367838690 /nfs/dbraw/zinc/83/86/90/367838690.db2.gz UTEHFKZPPVJFOX-OSMZGAPFSA-N 1 2 249.358 2.139 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1NC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000581834615 367838696 /nfs/dbraw/zinc/83/86/96/367838696.db2.gz UTEHFKZPPVJFOX-OSMZGAPFSA-N 1 2 249.358 2.139 20 0 BEADLO CCC[C@H](O)C[N@H+](CC(F)F)C(C)C ZINC000386029011 367900661 /nfs/dbraw/zinc/90/06/61/367900661.db2.gz VARPADFPXPJUKD-VIFPVBQESA-N 1 2 209.280 2.123 20 0 BEADLO CCC[C@H](O)C[N@@H+](CC(F)F)C(C)C ZINC000386029011 367900665 /nfs/dbraw/zinc/90/06/65/367900665.db2.gz VARPADFPXPJUKD-VIFPVBQESA-N 1 2 209.280 2.123 20 0 BEADLO C[C@@H]1[C@H](C)CN(c2cc(CO)cc[nH+]2)[C@H]1C ZINC000399532591 368174738 /nfs/dbraw/zinc/17/47/38/368174738.db2.gz NRYKTFPUMJTLTD-MXWKQRLJSA-N 1 2 220.316 2.055 20 0 BEADLO Cc1nocc1CNc1c[nH+]cc(N(C)C)c1 ZINC000630957053 368153148 /nfs/dbraw/zinc/15/31/48/368153148.db2.gz ZIOBKUHWKIMLFE-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2nc(C)no2)c1 ZINC000042295352 368303008 /nfs/dbraw/zinc/30/30/08/368303008.db2.gz ZNCALXZURMXNGR-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2nc(C)no2)c1 ZINC000042295352 368303013 /nfs/dbraw/zinc/30/30/13/368303013.db2.gz ZNCALXZURMXNGR-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO CCC[C@H](C)C(=O)NCc1ccc(N(C)C)[nH+]c1 ZINC000042497958 368310728 /nfs/dbraw/zinc/31/07/28/368310728.db2.gz LMYGMMLYMIRGCT-NSHDSACASA-N 1 2 249.358 2.200 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccc(F)cc2)CCO1 ZINC000045751979 368431047 /nfs/dbraw/zinc/43/10/47/368431047.db2.gz AGFSMBLHQFXCTP-ZDUSSCGKSA-N 1 2 223.291 2.437 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccc(F)cc2)CCO1 ZINC000045751979 368431052 /nfs/dbraw/zinc/43/10/52/368431052.db2.gz AGFSMBLHQFXCTP-ZDUSSCGKSA-N 1 2 223.291 2.437 20 0 BEADLO COC(=O)c1occc1C[N@H+](C)Cc1ccco1 ZINC000057948556 368503691 /nfs/dbraw/zinc/50/36/91/368503691.db2.gz BYGUKBVRNBQOQH-UHFFFAOYSA-N 1 2 249.266 2.291 20 0 BEADLO COC(=O)c1occc1C[N@@H+](C)Cc1ccco1 ZINC000057948556 368503694 /nfs/dbraw/zinc/50/36/94/368503694.db2.gz BYGUKBVRNBQOQH-UHFFFAOYSA-N 1 2 249.266 2.291 20 0 BEADLO CC(C)n1cc(C[N@H+]2CCC[C@@H](F)C2)cn1 ZINC000566861940 326089372 /nfs/dbraw/zinc/08/93/72/326089372.db2.gz YBOJEKMQEZGMTN-GFCCVEGCSA-N 1 2 225.311 2.398 20 0 BEADLO FC(F)Oc1ccc(C[NH+]2CCOCC2)cc1 ZINC000060460159 368543010 /nfs/dbraw/zinc/54/30/10/368543010.db2.gz XPFWAOJAZFJGRD-UHFFFAOYSA-N 1 2 243.253 2.120 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2cccs2)o1 ZINC000061779561 368570149 /nfs/dbraw/zinc/57/01/49/368570149.db2.gz WCUNKNKAYSPZIF-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2cccs2)o1 ZINC000061779561 368570156 /nfs/dbraw/zinc/57/01/56/368570156.db2.gz WCUNKNKAYSPZIF-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO Cc1cc(C[N@H+](C)CCC(F)(F)F)no1 ZINC000064635190 368610110 /nfs/dbraw/zinc/61/01/10/368610110.db2.gz LOKNZNUCFPYKFK-UHFFFAOYSA-N 1 2 222.210 2.367 20 0 BEADLO Cc1cc(C[N@@H+](C)CCC(F)(F)F)no1 ZINC000064635190 368610113 /nfs/dbraw/zinc/61/01/13/368610113.db2.gz LOKNZNUCFPYKFK-UHFFFAOYSA-N 1 2 222.210 2.367 20 0 BEADLO O=C(C=C1CCCCC1)NC1=[NH+]CCS1 ZINC000065769707 368628888 /nfs/dbraw/zinc/62/88/88/368628888.db2.gz ORNRUMXJJYBLHG-UHFFFAOYSA-N 1 2 224.329 2.096 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H](C)CC(C)(C)C)c[nH+]1 ZINC000457228412 203023157 /nfs/dbraw/zinc/02/31/57/203023157.db2.gz NSMWEKZIUZYKAD-QMMMGPOBSA-N 1 2 223.320 2.273 20 0 BEADLO C[C@H]1CCCC[C@@]1(C)NC(=O)CCc1[nH]cc[nH+]1 ZINC000457237416 203024106 /nfs/dbraw/zinc/02/41/06/203024106.db2.gz CMKFOWOZUSVZPB-SMDDNHRTSA-N 1 2 249.358 2.427 20 0 BEADLO CCC[N@H+](CCn1nc(C)cc1C)CC(F)F ZINC000068817742 368737335 /nfs/dbraw/zinc/73/73/35/368737335.db2.gz SZOQOEGXYCPVDJ-UHFFFAOYSA-N 1 2 245.317 2.477 20 0 BEADLO CCC[N@@H+](CCn1nc(C)cc1C)CC(F)F ZINC000068817742 368737339 /nfs/dbraw/zinc/73/73/39/368737339.db2.gz SZOQOEGXYCPVDJ-UHFFFAOYSA-N 1 2 245.317 2.477 20 0 BEADLO CC[C@]1(C(C)C)C[C@H]1NC(=O)CCc1[nH]cc[nH+]1 ZINC000457277690 203031698 /nfs/dbraw/zinc/03/16/98/203031698.db2.gz KUGPEFQESXUDGN-BXUZGUMPSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@@H](C)C(=O)NCc1cn2c(cccc2C)[nH+]1 ZINC000068570986 368731378 /nfs/dbraw/zinc/73/13/78/368731378.db2.gz QJIIWVZZPGQYMH-SNVBAGLBSA-N 1 2 245.326 2.305 20 0 BEADLO CC[C@]1(C(C)C)C[C@H]1NC(=O)c1c[nH+]c(C)[nH]1 ZINC000457316407 203036364 /nfs/dbraw/zinc/03/63/64/203036364.db2.gz ZWALUFSRJSDJDK-DGCLKSJQSA-N 1 2 235.331 2.273 20 0 BEADLO COc1c(C)cc(C[NH+]2CCOCC2)cc1C ZINC000154517365 326148078 /nfs/dbraw/zinc/14/80/78/326148078.db2.gz SSFREDRHZRGCNK-UHFFFAOYSA-N 1 2 235.327 2.144 20 0 BEADLO CCCC[C@H](CC)C(=O)NCCn1cc[nH+]c1 ZINC000073967356 368824033 /nfs/dbraw/zinc/82/40/33/368824033.db2.gz LOGINGKTGOTRSK-LBPRGKRZSA-N 1 2 237.347 2.216 20 0 BEADLO c1cc(C[N@@H+]2CCO[C@H](c3ccccc3)C2)on1 ZINC000074159318 368831176 /nfs/dbraw/zinc/83/11/76/368831176.db2.gz UPGDWCZNTLHDHQ-AWEZNQCLSA-N 1 2 244.294 2.248 20 0 BEADLO c1cc(C[N@H+]2CCO[C@H](c3ccccc3)C2)on1 ZINC000074159318 368831179 /nfs/dbraw/zinc/83/11/79/368831179.db2.gz UPGDWCZNTLHDHQ-AWEZNQCLSA-N 1 2 244.294 2.248 20 0 BEADLO C[C@@H]1CN(C(=O)Cn2cc[nH+]c2)c2ccccc21 ZINC000072963769 368788476 /nfs/dbraw/zinc/78/84/76/368788476.db2.gz JVHXFQVADYLIDA-LLVKDONJSA-N 1 2 241.294 2.033 20 0 BEADLO CCC[C@@H](O)CNc1cc[nH+]c(C(C)C)n1 ZINC000112333794 368870962 /nfs/dbraw/zinc/87/09/62/368870962.db2.gz YWEYVDQUUVNJLN-SNVBAGLBSA-N 1 2 223.320 2.173 20 0 BEADLO Cc1cc(F)ccc1C[N@H+]1CCOC[C@@H]1C ZINC000091814922 369021879 /nfs/dbraw/zinc/02/18/79/369021879.db2.gz CTJAMVFCKJYTDO-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+]1CCOC[C@@H]1C ZINC000091814922 369021885 /nfs/dbraw/zinc/02/18/85/369021885.db2.gz CTJAMVFCKJYTDO-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H](C)CC(F)(F)F ZINC000457545060 203073316 /nfs/dbraw/zinc/07/33/16/203073316.db2.gz DWXXIZOKVVSSLK-ZETCQYMHSA-N 1 2 246.232 2.339 20 0 BEADLO C[C@@H](C(=O)NC[C@H](C)Cn1cc[nH+]c1)C1CCC1 ZINC000457568520 203075055 /nfs/dbraw/zinc/07/50/55/203075055.db2.gz FNXFDAZBBXHIJE-NWDGAFQWSA-N 1 2 249.358 2.072 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)[C@@H](C)C1CCC1 ZINC000457827859 203109115 /nfs/dbraw/zinc/10/91/15/203109115.db2.gz RNQHXENBYARWHQ-JTQLQIEISA-N 1 2 248.326 2.143 20 0 BEADLO C[C@H](C(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21)C1CCC1 ZINC000457889799 203118030 /nfs/dbraw/zinc/11/80/30/203118030.db2.gz YTGBYGKOVHRKAV-SCVCMEIPSA-N 1 2 247.342 2.441 20 0 BEADLO COC(=O)Cc1cccc(NCC2(C)CC2)[nH+]1 ZINC000618678469 369195144 /nfs/dbraw/zinc/19/51/44/369195144.db2.gz UWSCBXIMPRVLAM-UHFFFAOYSA-N 1 2 234.299 2.009 20 0 BEADLO CCC[C@@H](NC(=O)CCn1cc[nH+]c1)C1CCC1 ZINC000458336780 203163863 /nfs/dbraw/zinc/16/38/63/203163863.db2.gz QTDLGUXEMJBSDU-CYBMUJFWSA-N 1 2 249.358 2.358 20 0 BEADLO CCO[C@H](C)C(=O)Nc1c[nH+]c2c(C)cccn12 ZINC000619013252 369257292 /nfs/dbraw/zinc/25/72/92/369257292.db2.gz NYBHSDGLMQRNHV-SNVBAGLBSA-N 1 2 247.298 2.006 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N(C(=O)Cc2[nH]c[nH+]c2C)C1 ZINC000619135484 369294043 /nfs/dbraw/zinc/29/40/43/369294043.db2.gz QTUTWTAWVDYLBN-ZYHUDNBSSA-N 1 2 249.358 2.298 20 0 BEADLO CCn1nncc1C[N@H+](C)[C@@H](C)c1ccco1 ZINC000459322520 203258897 /nfs/dbraw/zinc/25/88/97/203258897.db2.gz HKAHGMGBXIMYJM-JTQLQIEISA-N 1 2 234.303 2.084 20 0 BEADLO CCn1nncc1C[N@@H+](C)[C@@H](C)c1ccco1 ZINC000459322520 203258900 /nfs/dbraw/zinc/25/89/00/203258900.db2.gz HKAHGMGBXIMYJM-JTQLQIEISA-N 1 2 234.303 2.084 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2C[C@@]2(C)C(C)C)cc[nH+]1 ZINC000459477410 203287420 /nfs/dbraw/zinc/28/74/20/203287420.db2.gz HCUJTVWNDRXVMD-OCCSQVGLSA-N 1 2 247.342 2.368 20 0 BEADLO CCC(F)(F)C[NH2+]Cc1cncs1 ZINC000623680074 369381852 /nfs/dbraw/zinc/38/18/52/369381852.db2.gz WPNBKWIBHZVQIR-UHFFFAOYSA-N 1 2 206.261 2.278 20 0 BEADLO COC1(C)C[NH+](Cc2cccc(C)c2F)C1 ZINC000459593578 203309492 /nfs/dbraw/zinc/30/94/92/203309492.db2.gz VSZSHYHUSANQIH-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO CCCCCOC1C[NH+](Cc2ccncc2)C1 ZINC000459594779 203309765 /nfs/dbraw/zinc/30/97/65/203309765.db2.gz QBMSOQBPYNVAMJ-UHFFFAOYSA-N 1 2 234.343 2.473 20 0 BEADLO COCC1(C)C[NH+](Cc2ccc(F)c(F)c2)C1 ZINC000459624112 203321339 /nfs/dbraw/zinc/32/13/39/203321339.db2.gz UIENHMNBUVEFAU-UHFFFAOYSA-N 1 2 241.281 2.433 20 0 BEADLO COCC1(C)C[NH+](Cc2ccc(Cl)o2)C1 ZINC000459625500 203321765 /nfs/dbraw/zinc/32/17/65/203321765.db2.gz WQOJXDYIWDIZHU-UHFFFAOYSA-N 1 2 229.707 2.401 20 0 BEADLO FC(F)OC1C[NH+](Cc2ccccc2)C1 ZINC000459635184 203327246 /nfs/dbraw/zinc/32/72/46/203327246.db2.gz XXUKNXHJAVTSDR-UHFFFAOYSA-N 1 2 213.227 2.110 20 0 BEADLO Cc1c[nH+]c(CN2Cc3cccc(F)c3C2)n1C ZINC000459705976 203339450 /nfs/dbraw/zinc/33/94/50/203339450.db2.gz IKBUTNCGWDUSLD-UHFFFAOYSA-N 1 2 245.301 2.383 20 0 BEADLO CC[C@@H](CO)Nc1cc2ccccc2c[nH+]1 ZINC000631031971 370970072 /nfs/dbraw/zinc/97/00/72/370970072.db2.gz OUSYWZVEKRTBEL-LBPRGKRZSA-N 1 2 216.284 2.418 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCC[C@H]1C(=O)OC(C)C ZINC000619648846 369506891 /nfs/dbraw/zinc/50/68/91/369506891.db2.gz XLMZWUFERWGYSL-MNOVXSKESA-N 1 2 231.311 2.151 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCC[C@H]1C(=O)OC(C)C ZINC000619648846 369506896 /nfs/dbraw/zinc/50/68/96/369506896.db2.gz XLMZWUFERWGYSL-MNOVXSKESA-N 1 2 231.311 2.151 20 0 BEADLO CC(C)[C@H](NC(=O)C[C@@H](C)n1cc[nH+]c1)C1CC1 ZINC000620032803 369677295 /nfs/dbraw/zinc/67/72/95/369677295.db2.gz FPPQXOGUAKMLIR-RISCZKNCSA-N 1 2 249.358 2.385 20 0 BEADLO CCC(CC)CC(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620602907 369950633 /nfs/dbraw/zinc/95/06/33/369950633.db2.gz FVQNLWVSHOSZFJ-JTQLQIEISA-N 1 2 237.347 2.424 20 0 BEADLO CCCC1(C(=O)N[C@H](C)c2[nH+]ccn2C)CC1 ZINC000620605104 369953322 /nfs/dbraw/zinc/95/33/22/369953322.db2.gz ZDTJIHOPIGCFQX-SNVBAGLBSA-N 1 2 235.331 2.178 20 0 BEADLO C[C@H](NC(=O)C1=CCCCC1)c1[nH+]ccn1C ZINC000620605880 369953960 /nfs/dbraw/zinc/95/39/60/369953960.db2.gz LZRFZGSXHYHJGR-JTQLQIEISA-N 1 2 233.315 2.098 20 0 BEADLO C=C/C(C)=C\CC(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620605892 369954557 /nfs/dbraw/zinc/95/45/57/369954557.db2.gz MFWSZRJCAIHSRO-SDKXAQGSSA-N 1 2 233.315 2.120 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620607024 369955780 /nfs/dbraw/zinc/95/57/80/369955780.db2.gz DKOQLXLRKOYGNC-TUAOUCFPSA-N 1 2 249.358 2.424 20 0 BEADLO Cc1cn2ccc(NC(=O)[C@@H]3C[C@H]3C)cc2[nH+]1 ZINC000620648010 369972488 /nfs/dbraw/zinc/97/24/88/369972488.db2.gz QMMAFEVGMXGXAJ-LDYMZIIASA-N 1 2 229.283 2.237 20 0 BEADLO CCCC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000074859400 370048062 /nfs/dbraw/zinc/04/80/62/370048062.db2.gz ONQHWJDZFWTPRP-UHFFFAOYSA-N 1 2 203.245 2.073 20 0 BEADLO CC1(C)CC(NC(=O)c2ccc3[nH+]ccn3c2)C1 ZINC000620744863 369992542 /nfs/dbraw/zinc/99/25/42/369992542.db2.gz OLNHZNXWSLJFAF-UHFFFAOYSA-N 1 2 243.310 2.253 20 0 BEADLO Cc1noc(C)c1[C@H](C)[NH2+]Cc1nccnc1C ZINC000621335237 370270064 /nfs/dbraw/zinc/27/00/64/370270064.db2.gz GQYKTTCYMOAUGX-VIFPVBQESA-N 1 2 246.314 2.241 20 0 BEADLO CCC[C@H](C)N(C)C(=O)[C@H]1CCc2[nH+]ccn2C1 ZINC000621545779 370384780 /nfs/dbraw/zinc/38/47/80/370384780.db2.gz FNHJIBGOVQESND-RYUDHWBXSA-N 1 2 249.358 2.093 20 0 BEADLO CC(C)(C)CCNC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000621561863 370388758 /nfs/dbraw/zinc/38/87/58/370388758.db2.gz ZRSLYJXUTZTBIB-UHFFFAOYSA-N 1 2 237.347 2.240 20 0 BEADLO Cc1nccnc1C[N@@H+](C)[C@H](C)c1ccccn1 ZINC000621721250 370472007 /nfs/dbraw/zinc/47/20/07/370472007.db2.gz GQMCFDPITICIKY-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1nccnc1C[N@H+](C)[C@H](C)c1ccccn1 ZINC000621721250 370472012 /nfs/dbraw/zinc/47/20/12/370472012.db2.gz GQMCFDPITICIKY-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CC(C)(c2ccccc2)C1 ZINC000621734922 370491801 /nfs/dbraw/zinc/49/18/01/370491801.db2.gz ZSGAXSPIULLELE-UHFFFAOYSA-N 1 2 241.338 2.492 20 0 BEADLO Cn1ccnc1C[NH+]1CC(C)(c2ccccc2)C1 ZINC000621734515 370491923 /nfs/dbraw/zinc/49/19/23/370491923.db2.gz ORNIOIDIUWCBAF-UHFFFAOYSA-N 1 2 241.338 2.194 20 0 BEADLO CCc1cc(NC[C@H]2CCC[C@H](O)C2)nc[nH+]1 ZINC000078304938 370549797 /nfs/dbraw/zinc/54/97/97/370549797.db2.gz VBXQRVFBJWKOES-JQWIXIFHSA-N 1 2 235.331 2.002 20 0 BEADLO CC(C)[C@H](C)CNC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000621878429 370576887 /nfs/dbraw/zinc/57/68/87/370576887.db2.gz NPZDVIVVVZFVDL-SNVBAGLBSA-N 1 2 237.347 2.096 20 0 BEADLO CCc1cc(NCc2c(C)noc2C)nc[nH+]1 ZINC000078597993 370580214 /nfs/dbraw/zinc/58/02/14/370580214.db2.gz GMMDMWZXIQDJPM-UHFFFAOYSA-N 1 2 232.287 2.256 20 0 BEADLO CCN(CCC1CC1)C(=O)C(C)(C)c1c[nH+]c[nH]1 ZINC000621953981 370618070 /nfs/dbraw/zinc/61/80/70/370618070.db2.gz DFVNQCZFDAIPJM-UHFFFAOYSA-N 1 2 249.358 2.336 20 0 BEADLO CC(C)(C(=O)NCC1CC(C)(C)C1)c1c[nH]c[nH+]1 ZINC000621965941 370625208 /nfs/dbraw/zinc/62/52/08/370625208.db2.gz KAPLJNGQTRTNMI-UHFFFAOYSA-N 1 2 249.358 2.240 20 0 BEADLO Cc1cc(C)c(CNC(=O)c2ccccn2)c[nH+]1 ZINC000622667754 371047587 /nfs/dbraw/zinc/04/75/87/371047587.db2.gz RJSCNYQFVVAADW-UHFFFAOYSA-N 1 2 241.294 2.023 20 0 BEADLO c1cc2c(nc(C3CC3)nc2-n2cc[nH+]c2)[nH]1 ZINC000631042276 371002770 /nfs/dbraw/zinc/00/27/70/371002770.db2.gz XVZFVHATPITWGY-UHFFFAOYSA-N 1 2 225.255 2.021 20 0 BEADLO Cc1ccc(F)c(C[NH2+]Cc2cocn2)c1 ZINC000390495369 371207977 /nfs/dbraw/zinc/20/79/77/371207977.db2.gz RPIJROUPWRMVPS-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO C[C@@H]([NH2+]C1(C(F)F)CC1)[C@H]1CCCCO1 ZINC000623979136 371213089 /nfs/dbraw/zinc/21/30/89/371213089.db2.gz RECWLTWGYBTOBR-RKDXNWHRSA-N 1 2 219.275 2.331 20 0 BEADLO CC[C@H]1CN(c2[nH+]cccc2OC)CCS1 ZINC000624007400 371244872 /nfs/dbraw/zinc/24/48/72/371244872.db2.gz VGNHREJGVIKAFS-JTQLQIEISA-N 1 2 238.356 2.422 20 0 BEADLO CC(C)(CNc1cc2ccccc2c[nH+]1)C(N)=O ZINC000631066690 371267430 /nfs/dbraw/zinc/26/74/30/371267430.db2.gz LGRMRVAMIKMWJM-UHFFFAOYSA-N 1 2 243.310 2.158 20 0 BEADLO COc1ccc[nH+]c1N1CCSC[C@H](C)C1 ZINC000624156496 371351146 /nfs/dbraw/zinc/35/11/46/371351146.db2.gz CMCKKWPROYEDLQ-SNVBAGLBSA-N 1 2 238.356 2.280 20 0 BEADLO COc1ccc[nH+]c1N1CCS[C@H](C)CC1 ZINC000624157454 371351893 /nfs/dbraw/zinc/35/18/93/371351893.db2.gz LWJVFYXRDBLOEG-SNVBAGLBSA-N 1 2 238.356 2.422 20 0 BEADLO CCC(F)(F)C[NH2+][C@H]1CCCc2c1cnn2C ZINC000624148040 371342759 /nfs/dbraw/zinc/34/27/59/371342759.db2.gz STMWIAVTXLIICW-JTQLQIEISA-N 1 2 243.301 2.432 20 0 BEADLO CCC(F)(F)C[NH2+][C@@H]1CCCc2c1cnn2C ZINC000624148041 371343089 /nfs/dbraw/zinc/34/30/89/371343089.db2.gz STMWIAVTXLIICW-SNVBAGLBSA-N 1 2 243.301 2.432 20 0 BEADLO COc1ccc[nH+]c1N1CCC2(CCOC2)CC1 ZINC000624183235 371373916 /nfs/dbraw/zinc/37/39/16/371373916.db2.gz IBNYZIHKSFBNQM-UHFFFAOYSA-N 1 2 248.326 2.097 20 0 BEADLO c1ccc2c(c1)cc[nH+]c2N1C[C@@H]2COC[C@@H]2C1 ZINC000624183496 371373974 /nfs/dbraw/zinc/37/39/74/371373974.db2.gz SMVVNAPSQVCNOE-BETUJISGSA-N 1 2 240.306 2.317 20 0 BEADLO CCc1cc(N[C@@]23C[C@@H]2COC3(C)C)nc[nH+]1 ZINC000624517185 371526094 /nfs/dbraw/zinc/52/60/94/371526094.db2.gz HJPOYGACZXGKEY-RNCFNFMXSA-N 1 2 233.315 2.018 20 0 BEADLO C[C@H](CC(C)(C)C)C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627370589 371588005 /nfs/dbraw/zinc/58/80/05/371588005.db2.gz FLISUSVJZSKDTM-SNVBAGLBSA-N 1 2 249.358 2.367 20 0 BEADLO C[C@H](CC(C)(C)C)C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627370589 371588006 /nfs/dbraw/zinc/58/80/06/371588006.db2.gz FLISUSVJZSKDTM-SNVBAGLBSA-N 1 2 249.358 2.367 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)NCCC1CCCC1 ZINC000283418745 181835080 /nfs/dbraw/zinc/83/50/80/181835080.db2.gz IJOHUEVWFOEDOF-AATRIKPKSA-N 1 2 233.315 2.119 20 0 BEADLO C[C@H](C1CC1)n1cc(NCc2c[nH+]cn2C)cn1 ZINC000189242046 259549645 /nfs/dbraw/zinc/54/96/45/259549645.db2.gz IFDLRLSCYUXQLE-SNVBAGLBSA-N 1 2 245.330 2.200 20 0 BEADLO C[C@H]1CN(c2cc3ccccc3c[nH+]2)CC[C@H]1O ZINC000631218566 372241851 /nfs/dbraw/zinc/24/18/51/372241851.db2.gz OBXZJHUCJBQIHO-SMDDNHRTSA-N 1 2 242.322 2.442 20 0 BEADLO CCCCc1cc(N[C@@H]2CCOC2)nc[nH+]1 ZINC000631177849 372219434 /nfs/dbraw/zinc/21/94/34/372219434.db2.gz ATCGFCQQOVPQNQ-LLVKDONJSA-N 1 2 221.304 2.020 20 0 BEADLO C[C@@H](CO)N(C)c1cc2ccccc2c[nH+]1 ZINC000631180886 372219695 /nfs/dbraw/zinc/21/96/95/372219695.db2.gz WUEAUVWOXLLLDJ-JTQLQIEISA-N 1 2 216.284 2.052 20 0 BEADLO Cc1c(Cl)c(C[NH2+]CC(C)(C)F)nn1C ZINC000631189285 372221134 /nfs/dbraw/zinc/22/11/34/372221134.db2.gz RZJGLSQUIJUPIQ-UHFFFAOYSA-N 1 2 233.718 2.220 20 0 BEADLO CCCCc1cc(N[C@@]2(C)CCOC2)nc[nH+]1 ZINC000631181302 372221494 /nfs/dbraw/zinc/22/14/94/372221494.db2.gz APVZPUNOWMNCNY-ZDUSSCGKSA-N 1 2 235.331 2.410 20 0 BEADLO COCc1cnc(C[NH2+]CC(C)(C)F)s1 ZINC000631189416 372221516 /nfs/dbraw/zinc/22/15/16/372221516.db2.gz PJEWGHCSLUALJE-UHFFFAOYSA-N 1 2 232.324 2.127 20 0 BEADLO C[C@H]1CN(c2cc3ccccc3c[nH+]2)C[C@@H]1O ZINC000631189040 372222669 /nfs/dbraw/zinc/22/26/69/372222669.db2.gz XEBOYRSRYVYUJS-GWCFXTLKSA-N 1 2 228.295 2.052 20 0 BEADLO Cc1cc(CNc2c[nH+]cc(N(C)C)c2)ccn1 ZINC000631203017 372234116 /nfs/dbraw/zinc/23/41/16/372234116.db2.gz HOBGUOHSJZEPPD-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO CCCCc1cc(N2CCC(=O)[C@@H](C)C2)nc[nH+]1 ZINC000631214380 372237285 /nfs/dbraw/zinc/23/72/85/372237285.db2.gz VPSKOSHSHFZTBT-NSHDSACASA-N 1 2 247.342 2.235 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@H](C)c2cnc(C)s2)n1 ZINC000631228918 372250474 /nfs/dbraw/zinc/25/04/74/372250474.db2.gz SCSDJRLMONWVDI-MRVPVSSYSA-N 1 2 236.344 2.334 20 0 BEADLO O=C(CC1CSC1)Nc1ccc2[nH+]ccn2c1 ZINC000631254157 372262165 /nfs/dbraw/zinc/26/21/65/372262165.db2.gz BURSHKWAFQUMJD-UHFFFAOYSA-N 1 2 247.323 2.026 20 0 BEADLO CN(CCF)c1cc[nH+]c(C(C)(C)C)n1 ZINC000631296949 372281937 /nfs/dbraw/zinc/28/19/37/372281937.db2.gz RTZPYSCFUAIDKG-UHFFFAOYSA-N 1 2 211.284 2.180 20 0 BEADLO CCc1nc(N2CC[C@H]2C(F)(F)F)cc(C)[nH+]1 ZINC000631344218 372305022 /nfs/dbraw/zinc/30/50/22/372305022.db2.gz TYCVWZSORGWNCV-QMMMGPOBSA-N 1 2 245.248 2.488 20 0 BEADLO CCc1cc(N[C@H]2CCCn3nccc32)nc[nH+]1 ZINC000631595201 372447026 /nfs/dbraw/zinc/44/70/26/372447026.db2.gz VEUYVABWPWHIMU-NSHDSACASA-N 1 2 243.314 2.183 20 0 BEADLO Cc1nocc1C(=O)Nc1ccc(C)[nH+]c1C ZINC000631742772 372544121 /nfs/dbraw/zinc/54/41/21/372544121.db2.gz DZKBSROAQZTYQW-UHFFFAOYSA-N 1 2 231.255 2.247 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2C[C@H](C)O[C@H]2C)c(C)[nH+]1 ZINC000631743435 372543182 /nfs/dbraw/zinc/54/31/82/372543182.db2.gz UQTKDMFYNOKKTI-ZMLRMANQSA-N 1 2 248.326 2.450 20 0 BEADLO CCc1noc([C@H](C)[N@@H+]2CCS[C@H](C)C2)n1 ZINC000171692478 372736262 /nfs/dbraw/zinc/73/62/62/372736262.db2.gz QTFFMAGYHJETLZ-BDAKNGLRSA-N 1 2 241.360 2.130 20 0 BEADLO CCc1noc([C@H](C)[N@H+]2CCS[C@H](C)C2)n1 ZINC000171692478 372736268 /nfs/dbraw/zinc/73/62/68/372736268.db2.gz QTFFMAGYHJETLZ-BDAKNGLRSA-N 1 2 241.360 2.130 20 0 BEADLO CCC(CC)[N@H+](CCOC)CC(F)F ZINC000171992050 372848954 /nfs/dbraw/zinc/84/89/54/372848954.db2.gz WUYNYIXJEGIPAK-UHFFFAOYSA-N 1 2 209.280 2.389 20 0 BEADLO CCC(CC)[N@@H+](CCOC)CC(F)F ZINC000171992050 372848960 /nfs/dbraw/zinc/84/89/60/372848960.db2.gz WUYNYIXJEGIPAK-UHFFFAOYSA-N 1 2 209.280 2.389 20 0 BEADLO O=C(COc1cc[nH+]cc1)Nc1ccccc1 ZINC000356089252 182004096 /nfs/dbraw/zinc/00/40/96/182004096.db2.gz GFBPQNIFTOJHHM-UHFFFAOYSA-N 1 2 228.251 2.099 20 0 BEADLO CC(C)CC(=O)N(C)c1ccc[nH+]c1N(C)C ZINC000176789253 205594973 /nfs/dbraw/zinc/59/49/73/205594973.db2.gz JYVZPNMVYFYCOC-UHFFFAOYSA-N 1 2 235.331 2.157 20 0 BEADLO O=C(NCC1CCC1)Nc1ccn2cc[nH+]c2c1 ZINC000290599286 182143528 /nfs/dbraw/zinc/14/35/28/182143528.db2.gz HCEZRLBAFABAHW-UHFFFAOYSA-N 1 2 244.298 2.256 20 0 BEADLO CCC(C)(C)CCNC(=O)CCn1cc[nH+]c1 ZINC000633966321 373865279 /nfs/dbraw/zinc/86/52/79/373865279.db2.gz BNQBLVTVNUXXEB-UHFFFAOYSA-N 1 2 237.347 2.216 20 0 BEADLO CCC(C)(C)CCNC(=O)Cc1[nH+]c[nH]c1C ZINC000633967960 373866520 /nfs/dbraw/zinc/86/65/20/373866520.db2.gz AJXNQXOUZAQSMF-UHFFFAOYSA-N 1 2 237.347 2.203 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)CCOCC1CC1 ZINC000425590691 205911173 /nfs/dbraw/zinc/91/11/73/205911173.db2.gz XDJONLMNWNOOQB-UHFFFAOYSA-N 1 2 248.326 2.454 20 0 BEADLO CC[C@@H](C)OCC(=O)Nc1c(C)cc[nH+]c1C ZINC000425586987 205911297 /nfs/dbraw/zinc/91/12/97/205911297.db2.gz MOKNRVDDTMCPHL-SNVBAGLBSA-N 1 2 236.315 2.452 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@H](C)CC1CCC1 ZINC000634370695 374219861 /nfs/dbraw/zinc/21/98/61/374219861.db2.gz BURJIFAIDLSYGA-MNOVXSKESA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@H](C)CC1CCC1 ZINC000634370695 374219873 /nfs/dbraw/zinc/21/98/73/374219873.db2.gz BURJIFAIDLSYGA-MNOVXSKESA-N 1 2 249.358 2.283 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)[C@@H]1C[C@@H]1C1CCCCC1 ZINC000120139211 182273097 /nfs/dbraw/zinc/27/30/97/182273097.db2.gz JYUANKFQPHLDHH-VXGBXAGGSA-N 1 2 247.342 2.242 20 0 BEADLO C[C@@H]1CN(c2cc[nH+]c(C3CC3)n2)[C@@H](C)[C@@H](C)O1 ZINC000445677471 206084600 /nfs/dbraw/zinc/08/46/00/206084600.db2.gz XLBCBGRXFNILOS-OUAUKWLOSA-N 1 2 247.342 2.356 20 0 BEADLO C[C@@H]1CN(c2cccc[nH+]2)[C@H](C)[C@H](C)O1 ZINC000445663522 206085379 /nfs/dbraw/zinc/08/53/79/206085379.db2.gz HOOHXNWBIIKYRQ-MXWKQRLJSA-N 1 2 206.289 2.084 20 0 BEADLO C[C@@H]1CN(c2cccc[nH+]2)[C@H](C)[C@@H](C)O1 ZINC000445663521 206085420 /nfs/dbraw/zinc/08/54/20/206085420.db2.gz HOOHXNWBIIKYRQ-GMTAPVOTSA-N 1 2 206.289 2.084 20 0 BEADLO CC[N@H+](Cc1cc(F)cc(F)c1)C1COC1 ZINC000449426027 206097827 /nfs/dbraw/zinc/09/78/27/206097827.db2.gz OKZOMJWQFSGOIV-UHFFFAOYSA-N 1 2 227.254 2.186 20 0 BEADLO CC[N@@H+](Cc1cc(F)cc(F)c1)C1COC1 ZINC000449426027 206097832 /nfs/dbraw/zinc/09/78/32/206097832.db2.gz OKZOMJWQFSGOIV-UHFFFAOYSA-N 1 2 227.254 2.186 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)c1cncs1 ZINC000358770972 182374992 /nfs/dbraw/zinc/37/49/92/182374992.db2.gz WDZCALWDSTZMQI-UHFFFAOYSA-N 1 2 244.279 2.043 20 0 BEADLO C[C@H]1C[C@@H](O)C[N@H+](C/C(Cl)=C\Cl)C1 ZINC001643446804 1172467320 /nfs/dbraw/zinc/46/73/20/1172467320.db2.gz YJPAFWVNEZKAKQ-SEGKZLOCSA-N 1 2 224.131 2.008 20 0 BEADLO C[C@H]1C[C@@H](O)C[N@@H+](C/C(Cl)=C\Cl)C1 ZINC001643446804 1172467324 /nfs/dbraw/zinc/46/73/24/1172467324.db2.gz YJPAFWVNEZKAKQ-SEGKZLOCSA-N 1 2 224.131 2.008 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1csc(C)c1 ZINC000294553875 170215094 /nfs/dbraw/zinc/21/50/94/170215094.db2.gz LDVSYSIFTSWLQN-UHFFFAOYSA-N 1 2 227.329 2.051 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1csc(C)c1 ZINC000294553875 170215095 /nfs/dbraw/zinc/21/50/95/170215095.db2.gz LDVSYSIFTSWLQN-UHFFFAOYSA-N 1 2 227.329 2.051 20 0 BEADLO CCOC(=O)C[N@H+](C)[C@H](CC)c1ccncc1 ZINC000130300466 170215545 /nfs/dbraw/zinc/21/55/45/170215545.db2.gz WCYGCTSQOSOQNH-GFCCVEGCSA-N 1 2 236.315 2.028 20 0 BEADLO CCOC(=O)C[N@@H+](C)[C@H](CC)c1ccncc1 ZINC000130300466 170215547 /nfs/dbraw/zinc/21/55/47/170215547.db2.gz WCYGCTSQOSOQNH-GFCCVEGCSA-N 1 2 236.315 2.028 20 0 BEADLO CCCCOCC(=O)Nc1cc[nH+]cc1C ZINC000118335869 168892773 /nfs/dbraw/zinc/89/27/73/168892773.db2.gz CWUZSGNGFKEKOH-UHFFFAOYSA-N 1 2 222.288 2.145 20 0 BEADLO OCC(F)(F)C[NH2+]Cc1ccc2occc2c1 ZINC000285840446 183033174 /nfs/dbraw/zinc/03/31/74/183033174.db2.gz HNDRNFNNPXYRCQ-UHFFFAOYSA-N 1 2 241.237 2.150 20 0 BEADLO OCCC[N@@H+]1Cc2ccc(Cl)cc2C1 ZINC000058012167 183055839 /nfs/dbraw/zinc/05/58/39/183055839.db2.gz AGKKZJHKGLCUNA-UHFFFAOYSA-N 1 2 211.692 2.038 20 0 BEADLO OCCC[N@H+]1Cc2ccc(Cl)cc2C1 ZINC000058012167 183055841 /nfs/dbraw/zinc/05/58/41/183055841.db2.gz AGKKZJHKGLCUNA-UHFFFAOYSA-N 1 2 211.692 2.038 20 0 BEADLO OCCN(CCc1ccccc1)c1cccc[nH+]1 ZINC000301784608 183067329 /nfs/dbraw/zinc/06/73/29/183067329.db2.gz OUQFRHPFYUPFQS-UHFFFAOYSA-N 1 2 242.322 2.123 20 0 BEADLO OCC[C@H]([NH2+]Cc1ccco1)c1ccco1 ZINC000184517464 183097264 /nfs/dbraw/zinc/09/72/64/183097264.db2.gz RXPQSFSDCFBOAE-NSHDSACASA-N 1 2 221.256 2.086 20 0 BEADLO OC[C@@H]1CCCC[N@@H+]1Cc1ncc(Cl)s1 ZINC000335737681 183116957 /nfs/dbraw/zinc/11/69/57/183116957.db2.gz QEJGISRPARGKSE-QMMMGPOBSA-N 1 2 246.763 2.143 20 0 BEADLO OC[C@@H]1CCCC[N@H+]1Cc1ncc(Cl)s1 ZINC000335737681 183116959 /nfs/dbraw/zinc/11/69/59/183116959.db2.gz QEJGISRPARGKSE-QMMMGPOBSA-N 1 2 246.763 2.143 20 0 BEADLO CCCC[C@H]([NH2+]CCSC(C)C)C(=O)OC ZINC000309400292 169011785 /nfs/dbraw/zinc/01/17/85/169011785.db2.gz UFCMMRAVPPSIJL-NSHDSACASA-N 1 2 247.404 2.449 20 0 BEADLO CCCC[C@H]([NH2+][C@@H]1CC[C@@H](F)C1)C(=O)OC ZINC000336747540 169013318 /nfs/dbraw/zinc/01/33/18/169013318.db2.gz XGSVOLIKOSHDHH-MXWKQRLJSA-N 1 2 231.311 2.198 20 0 BEADLO CCCC[S@@](=O)Cc1cn2ccccc2[nH+]1 ZINC000086969543 169016517 /nfs/dbraw/zinc/01/65/17/169016517.db2.gz SRZBQDRVFSYUFF-INIZCTEOSA-N 1 2 236.340 2.383 20 0 BEADLO OC[C@]1(F)CCC[N@H+](Cc2ccc(F)cc2)C1 ZINC000286707869 183157574 /nfs/dbraw/zinc/15/75/74/183157574.db2.gz BQWVJLBJTOTHNU-ZDUSSCGKSA-N 1 2 241.281 2.122 20 0 BEADLO OC[C@]1(F)CCC[N@@H+](Cc2ccc(F)cc2)C1 ZINC000286707869 183157576 /nfs/dbraw/zinc/15/75/76/183157576.db2.gz BQWVJLBJTOTHNU-ZDUSSCGKSA-N 1 2 241.281 2.122 20 0 BEADLO OCc1ccc(NCc2ccc(Cl)cc2)[nH+]c1 ZINC000356309061 183163496 /nfs/dbraw/zinc/16/34/96/183163496.db2.gz SSJCZTVFVORSEJ-UHFFFAOYSA-N 1 2 248.713 2.261 20 0 BEADLO OCc1ccc(CCNc2cccc[nH+]2)cc1 ZINC000302020102 183163517 /nfs/dbraw/zinc/16/35/17/183163517.db2.gz NJYCYRGREZQAHY-UHFFFAOYSA-N 1 2 228.295 2.229 20 0 BEADLO OCc1ccc(NCc2cccs2)[nH+]c1 ZINC000308908584 183166249 /nfs/dbraw/zinc/16/62/49/183166249.db2.gz FLIPKUSLLQAQMU-UHFFFAOYSA-N 1 2 220.297 2.248 20 0 BEADLO O[C@@H](C[N@@H+]1CCC=C(F)C1)c1ccc(F)cc1 ZINC000272589345 183176234 /nfs/dbraw/zinc/17/62/34/183176234.db2.gz XANUCLBRUODDLE-ZDUSSCGKSA-N 1 2 239.265 2.418 20 0 BEADLO O[C@@H](C[N@H+]1CCC=C(F)C1)c1ccc(F)cc1 ZINC000272589345 183176237 /nfs/dbraw/zinc/17/62/37/183176237.db2.gz XANUCLBRUODDLE-ZDUSSCGKSA-N 1 2 239.265 2.418 20 0 BEADLO O[C@@H](C[N@@H+]1CCC(F)(F)C1)C1CCCCC1 ZINC000313295677 183176571 /nfs/dbraw/zinc/17/65/71/183176571.db2.gz ZUKVSGFLCKPXFE-NSHDSACASA-N 1 2 233.302 2.269 20 0 BEADLO O[C@@H](C[N@H+]1CCC(F)(F)C1)C1CCCCC1 ZINC000313295677 183176572 /nfs/dbraw/zinc/17/65/72/183176572.db2.gz ZUKVSGFLCKPXFE-NSHDSACASA-N 1 2 233.302 2.269 20 0 BEADLO O[C@@H]1CC[C@@H](CNc2cc[nH+]c3ccncc23)C1 ZINC000276866923 183202602 /nfs/dbraw/zinc/20/26/02/183202602.db2.gz JCAFZECJKNBWBS-GHMZBOCLSA-N 1 2 243.310 2.203 20 0 BEADLO O[C@H]1CC[C@H](Nc2cc[nH+]c3ccncc23)CC1 ZINC000269897894 183203346 /nfs/dbraw/zinc/20/33/46/183203346.db2.gz YBKCWLZOXHRIPM-XYPYZODXSA-N 1 2 243.310 2.345 20 0 BEADLO CCCN(C)C(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000117634587 169061081 /nfs/dbraw/zinc/06/10/81/169061081.db2.gz OWBUDNRTBXMPAL-UHFFFAOYSA-N 1 2 243.310 2.354 20 0 BEADLO O[C@H](C[N@@H+]1CCC(F)(F)C1)C1CCCCC1 ZINC000313295675 183219757 /nfs/dbraw/zinc/21/97/57/183219757.db2.gz ZUKVSGFLCKPXFE-LLVKDONJSA-N 1 2 233.302 2.269 20 0 BEADLO O[C@H](C[N@H+]1CCC(F)(F)C1)C1CCCCC1 ZINC000313295675 183219759 /nfs/dbraw/zinc/21/97/59/183219759.db2.gz ZUKVSGFLCKPXFE-LLVKDONJSA-N 1 2 233.302 2.269 20 0 BEADLO CCC[N@H+](CC(N)=O)Cc1ccccc1Cl ZINC000339704669 169110176 /nfs/dbraw/zinc/11/01/76/169110176.db2.gz BOTKYGKOPSMFGY-UHFFFAOYSA-N 1 2 240.734 2.037 20 0 BEADLO CCC[N@@H+](CC(N)=O)Cc1ccccc1Cl ZINC000339704669 169110178 /nfs/dbraw/zinc/11/01/78/169110178.db2.gz BOTKYGKOPSMFGY-UHFFFAOYSA-N 1 2 240.734 2.037 20 0 BEADLO Oc1ccc(F)c(C[NH+]2CCCC2)c1F ZINC000294948434 183272696 /nfs/dbraw/zinc/27/26/96/183272696.db2.gz PYRIBSDEBZRYDS-UHFFFAOYSA-N 1 2 213.227 2.266 20 0 BEADLO CCC[N@H+](CCCn1ccnc1)CC(F)F ZINC000183170754 169156956 /nfs/dbraw/zinc/15/69/56/169156956.db2.gz MSYCNFRTAGHPIQ-UHFFFAOYSA-N 1 2 231.290 2.250 20 0 BEADLO CCC[N@@H+](CCCn1ccnc1)CC(F)F ZINC000183170754 169156958 /nfs/dbraw/zinc/15/69/58/169156958.db2.gz MSYCNFRTAGHPIQ-UHFFFAOYSA-N 1 2 231.290 2.250 20 0 BEADLO CCC[N@H+](CCc1ccnn1CC)CC(F)F ZINC000276295245 169169860 /nfs/dbraw/zinc/16/98/60/169169860.db2.gz ISVVGMDPQJHYBR-UHFFFAOYSA-N 1 2 245.317 2.423 20 0 BEADLO CCC[N@@H+](CCc1ccnn1CC)CC(F)F ZINC000276295245 169169861 /nfs/dbraw/zinc/16/98/61/169169861.db2.gz ISVVGMDPQJHYBR-UHFFFAOYSA-N 1 2 245.317 2.423 20 0 BEADLO c1c[nH+]c(CN2CCc3sccc3C2)[nH]1 ZINC000109827967 183324475 /nfs/dbraw/zinc/32/44/75/183324475.db2.gz ZMDLBDVOFQRHRT-UHFFFAOYSA-N 1 2 219.313 2.030 20 0 BEADLO CCC[N@@H+]1CCCC[C@@H]1c1noc(C)n1 ZINC000370740050 169191630 /nfs/dbraw/zinc/19/16/30/169191630.db2.gz MWUKTJMLCLFMBM-SNVBAGLBSA-N 1 2 209.293 2.315 20 0 BEADLO CCC[N@H+]1CCCC[C@@H]1c1noc(C)n1 ZINC000370740050 169191631 /nfs/dbraw/zinc/19/16/31/169191631.db2.gz MWUKTJMLCLFMBM-SNVBAGLBSA-N 1 2 209.293 2.315 20 0 BEADLO c1c[nH]c([C@H]2CCC[N@H+]2Cc2cocn2)c1 ZINC000277962731 183329896 /nfs/dbraw/zinc/32/98/96/183329896.db2.gz JENOLKFRFLMQAX-GFCCVEGCSA-N 1 2 217.272 2.340 20 0 BEADLO c1c[nH]c([C@H]2CCC[N@@H+]2Cc2cocn2)c1 ZINC000277962731 183329898 /nfs/dbraw/zinc/32/98/98/183329898.db2.gz JENOLKFRFLMQAX-GFCCVEGCSA-N 1 2 217.272 2.340 20 0 BEADLO CCCN1CC[N@H+](C)[C@@H](Cc2ccccc2)C1 ZINC000284946495 169203824 /nfs/dbraw/zinc/20/38/24/169203824.db2.gz YZXMWWBYYJJSAZ-HNNXBMFYSA-N 1 2 232.371 2.255 20 0 BEADLO CCCN1CC[N@@H+](C)[C@@H](Cc2ccccc2)C1 ZINC000284946495 169203826 /nfs/dbraw/zinc/20/38/26/169203826.db2.gz YZXMWWBYYJJSAZ-HNNXBMFYSA-N 1 2 232.371 2.255 20 0 BEADLO c1c[nH]c([C@H]2CCC[N@H+]2Cc2ccncc2)n1 ZINC000336337023 183342345 /nfs/dbraw/zinc/34/23/45/183342345.db2.gz OJTXNVZOEBSTRQ-GFCCVEGCSA-N 1 2 228.299 2.142 20 0 BEADLO c1c[nH]c([C@H]2CCC[N@@H+]2Cc2ccncc2)n1 ZINC000336337023 183342347 /nfs/dbraw/zinc/34/23/47/183342347.db2.gz OJTXNVZOEBSTRQ-GFCCVEGCSA-N 1 2 228.299 2.142 20 0 BEADLO c1cc(C[N@@H+]2CCOC3(CCCCC3)C2)no1 ZINC000075832374 183343934 /nfs/dbraw/zinc/34/39/34/183343934.db2.gz CJKCRPZOYWUOQK-UHFFFAOYSA-N 1 2 236.315 2.210 20 0 BEADLO c1cc(C[N@H+]2CCOC3(CCCCC3)C2)no1 ZINC000075832374 183343935 /nfs/dbraw/zinc/34/39/35/183343935.db2.gz CJKCRPZOYWUOQK-UHFFFAOYSA-N 1 2 236.315 2.210 20 0 BEADLO c1cc(NC[C@H]2CCCCO2)nc(C2CC2)[nH+]1 ZINC000264736028 183357830 /nfs/dbraw/zinc/35/78/30/183357830.db2.gz YBPIVMLZMLKGMP-LLVKDONJSA-N 1 2 233.315 2.335 20 0 BEADLO c1cc(N[C@@H]2C[C@@H]3OCCC[C@H]23)nc(C2CC2)[nH+]1 ZINC000302557496 183358659 /nfs/dbraw/zinc/35/86/59/183358659.db2.gz LVAMLRGELLJBQT-UTUOFQBUSA-N 1 2 245.326 2.333 20 0 BEADLO c1c[nH+]c(CNc2cccc(-c3cc[nH]n3)c2)[nH]1 ZINC000049715391 183358743 /nfs/dbraw/zinc/35/87/43/183358743.db2.gz ZPMCNAHJEHGENL-UHFFFAOYSA-N 1 2 239.282 2.412 20 0 BEADLO CCCNC(=O)[C@H](C)[N@@H+]1Cc2ccc(C)cc2C1 ZINC000361595123 169246422 /nfs/dbraw/zinc/24/64/22/169246422.db2.gz SJZCPDSJRIZSPX-LBPRGKRZSA-N 1 2 246.354 2.225 20 0 BEADLO CCCNC(=O)[C@H](C)[N@H+]1Cc2ccc(C)cc2C1 ZINC000361595123 169246425 /nfs/dbraw/zinc/24/64/25/169246425.db2.gz SJZCPDSJRIZSPX-LBPRGKRZSA-N 1 2 246.354 2.225 20 0 BEADLO c1cc([C@H]2CCC[N@@H+](CCOC3CCC3)C2)[nH]n1 ZINC000376511269 183362432 /nfs/dbraw/zinc/36/24/32/183362432.db2.gz LEBIEQGGXSXUFL-LBPRGKRZSA-N 1 2 249.358 2.158 20 0 BEADLO c1cc([C@H]2CCC[N@H+](CCOC3CCC3)C2)[nH]n1 ZINC000376511269 183362434 /nfs/dbraw/zinc/36/24/34/183362434.db2.gz LEBIEQGGXSXUFL-LBPRGKRZSA-N 1 2 249.358 2.158 20 0 BEADLO CCC[NH2+][C@H](Cc1ccc(C)cc1)C(=O)OC ZINC000281057825 169289258 /nfs/dbraw/zinc/28/92/58/169289258.db2.gz SOPYMHDFHWKDAM-CYBMUJFWSA-N 1 2 235.327 2.079 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@H+](C)Cc1occc1C ZINC000292060142 169298744 /nfs/dbraw/zinc/29/87/44/169298744.db2.gz BOHFPNKZDDMRBQ-LLVKDONJSA-N 1 2 239.315 2.362 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@@H+](C)Cc1occc1C ZINC000292060142 169298747 /nfs/dbraw/zinc/29/87/47/169298747.db2.gz BOHFPNKZDDMRBQ-LLVKDONJSA-N 1 2 239.315 2.362 20 0 BEADLO CCCOCC(=O)Nc1c(C)cc[nH+]c1C ZINC000304604990 169308188 /nfs/dbraw/zinc/30/81/88/169308188.db2.gz VXHSEMHBXZGURF-UHFFFAOYSA-N 1 2 222.288 2.064 20 0 BEADLO c1ccc2[nH+]c(CCNc3cnccn3)[nH]c2c1 ZINC000338632699 183434389 /nfs/dbraw/zinc/43/43/89/183434389.db2.gz DCGLLSDDIJDQBA-UHFFFAOYSA-N 1 2 239.282 2.008 20 0 BEADLO CCC[C@@H](C(=O)NCc1[nH+]ccn1C)C(C)C ZINC000270685308 169345505 /nfs/dbraw/zinc/34/55/05/169345505.db2.gz UMKQYVMMNAVWHW-LLVKDONJSA-N 1 2 237.347 2.109 20 0 BEADLO CCC[C@@H](C)C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000125322982 169352309 /nfs/dbraw/zinc/35/23/09/169352309.db2.gz JBHDKPFVQPWFBG-NXEZZACHSA-N 1 2 223.320 2.413 20 0 BEADLO CCC[C@@H](CC)NC(=O)CCc1c[nH+]cn1C ZINC000279678029 169376605 /nfs/dbraw/zinc/37/66/05/169376605.db2.gz OHXIFMKMQIYTMV-LLVKDONJSA-N 1 2 237.347 2.048 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1cnn(C(C)C)c1 ZINC000179814864 134323851 /nfs/dbraw/zinc/32/38/51/134323851.db2.gz JJFLVHUJYBZRPM-ZDUSSCGKSA-N 1 2 237.347 2.075 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1cnn(C(C)C)c1 ZINC000179814864 134323852 /nfs/dbraw/zinc/32/38/52/134323852.db2.gz JJFLVHUJYBZRPM-ZDUSSCGKSA-N 1 2 237.347 2.075 20 0 BEADLO CCC[C@@H](OC)C(=O)Nc1cccc2[nH+]ccn21 ZINC000295120503 169413791 /nfs/dbraw/zinc/41/37/91/169413791.db2.gz ZLAKIUPEGBRASC-SNVBAGLBSA-N 1 2 247.298 2.088 20 0 BEADLO CCC[C@H](C)C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000125322750 169473375 /nfs/dbraw/zinc/47/33/75/169473375.db2.gz JBHDKPFVQPWFBG-UWVGGRQHSA-N 1 2 223.320 2.413 20 0 BEADLO CCC[C@H](OC)C(=O)Nc1ccc(C)[nH+]c1C ZINC000294923829 169521806 /nfs/dbraw/zinc/52/18/06/169521806.db2.gz LBBHQSJIIBSYSZ-LBPRGKRZSA-N 1 2 236.315 2.452 20 0 BEADLO COc1nscc1C[N@H+](C)CCOC(C)C ZINC001644650778 1172580050 /nfs/dbraw/zinc/58/00/50/1172580050.db2.gz NCYNVBSSVCBATB-UHFFFAOYSA-N 1 2 244.360 2.009 20 0 BEADLO COc1nscc1C[N@@H+](C)CCOC(C)C ZINC001644650778 1172580053 /nfs/dbraw/zinc/58/00/53/1172580053.db2.gz NCYNVBSSVCBATB-UHFFFAOYSA-N 1 2 244.360 2.009 20 0 BEADLO CCCc1nc(C[N@@H+]2C[C@H](C)C[C@H]2C)no1 ZINC000336690342 169590188 /nfs/dbraw/zinc/59/01/88/169590188.db2.gz AUHQGUKYCWSVRN-NXEZZACHSA-N 1 2 223.320 2.252 20 0 BEADLO CCCc1nc(C[N@H+]2C[C@H](C)C[C@H]2C)no1 ZINC000336690342 169590189 /nfs/dbraw/zinc/59/01/89/169590189.db2.gz AUHQGUKYCWSVRN-NXEZZACHSA-N 1 2 223.320 2.252 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)C(C)(C)C(C)(C)C ZINC000356501178 383864685 /nfs/dbraw/zinc/86/46/85/383864685.db2.gz FTPCRPNXDCOSMR-UHFFFAOYSA-N 1 2 237.347 2.109 20 0 BEADLO Cc1ncc(CNc2cc(C)[nH+]c(C(C)C)n2)o1 ZINC000397990409 383874387 /nfs/dbraw/zinc/87/43/87/383874387.db2.gz KTSWLSSCSWLVSF-UHFFFAOYSA-N 1 2 246.314 2.239 20 0 BEADLO Cc1ccc([C@H](C)[NH2+][C@H](C)c2nncn2C)o1 ZINC000037017356 383932153 /nfs/dbraw/zinc/93/21/53/383932153.db2.gz BKUFSYRJQGBPKG-VHSXEESVSA-N 1 2 234.303 2.128 20 0 BEADLO CSC[C@H](C)C(=O)Nc1cc[nH+]c(C)c1 ZINC000066927304 383903473 /nfs/dbraw/zinc/90/34/73/383903473.db2.gz IXHGATPUDKOHHR-QMMMGPOBSA-N 1 2 224.329 2.328 20 0 BEADLO Cc1nocc1C[N@@H+]1CCOC2(CCCC2)C1 ZINC000336471625 383962243 /nfs/dbraw/zinc/96/22/43/383962243.db2.gz CQIAYUFHCSSTQL-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO Cc1nocc1C[N@H+]1CCOC2(CCCC2)C1 ZINC000336471625 383962248 /nfs/dbraw/zinc/96/22/48/383962248.db2.gz CQIAYUFHCSSTQL-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO CCCc1ccc(C(=O)NCc2[nH]cc[nH+]2)cc1 ZINC000114125259 384024449 /nfs/dbraw/zinc/02/44/49/384024449.db2.gz NDFOEWMWIGIURN-UHFFFAOYSA-N 1 2 243.310 2.292 20 0 BEADLO CN(C)c1ccc(NC[C@H]2CCSC2)[nH+]c1 ZINC000278535919 384005537 /nfs/dbraw/zinc/00/55/37/384005537.db2.gz SKYZZXPVUYAIMS-SNVBAGLBSA-N 1 2 237.372 2.313 20 0 BEADLO Cc1cn[nH]c1C[NH2+]Cc1ccc(Cl)cn1 ZINC000289484477 384009930 /nfs/dbraw/zinc/00/99/30/384009930.db2.gz KHQMNNBEXWJJKI-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO Cc1c[nH]nc1C[NH2+]Cc1ccc(Cl)cn1 ZINC000289484477 384009936 /nfs/dbraw/zinc/00/99/36/384009936.db2.gz KHQMNNBEXWJJKI-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO CC(C)(C)n1cc(C[NH2+]C(CF)CF)cn1 ZINC000449372711 384043409 /nfs/dbraw/zinc/04/34/09/384043409.db2.gz LCXLPYACCXUMJA-UHFFFAOYSA-N 1 2 231.290 2.035 20 0 BEADLO COc1ccc(OC)c(C[NH2+]C(CF)CF)c1 ZINC000449373619 384050717 /nfs/dbraw/zinc/05/07/17/384050717.db2.gz SPQFLMABDPCBRO-UHFFFAOYSA-N 1 2 245.269 2.101 20 0 BEADLO CC(C)[C@@H]1CCCCC[N@@H+]1Cc1nc[nH]n1 ZINC001645054322 1172630932 /nfs/dbraw/zinc/63/09/32/1172630932.db2.gz IRIMRDKUGZNCJM-NSHDSACASA-N 1 2 222.336 2.205 20 0 BEADLO CC(C)[C@@H]1CCCCC[N@H+]1Cc1nc[nH]n1 ZINC001645054322 1172630937 /nfs/dbraw/zinc/63/09/37/1172630937.db2.gz IRIMRDKUGZNCJM-NSHDSACASA-N 1 2 222.336 2.205 20 0 BEADLO COC(=O)[C@H]([NH2+]C1CCCC1)c1ccccc1 ZINC000037853378 384029247 /nfs/dbraw/zinc/02/92/47/384029247.db2.gz QKFQMEIUHSOGNJ-CYBMUJFWSA-N 1 2 233.311 2.433 20 0 BEADLO C[C@@H](CC1CCCC1)C(=O)NCc1[nH]cc[nH+]1 ZINC000114340047 384031108 /nfs/dbraw/zinc/03/11/08/384031108.db2.gz MUJFUFXBDGURRA-JTQLQIEISA-N 1 2 235.331 2.242 20 0 BEADLO C[C@H](CC1CCCC1)C(=O)NCc1[nH]cc[nH+]1 ZINC000114340049 384032320 /nfs/dbraw/zinc/03/23/20/384032320.db2.gz MUJFUFXBDGURRA-SNVBAGLBSA-N 1 2 235.331 2.242 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2ncn(C)n2)c(C)c1 ZINC000090969167 384087267 /nfs/dbraw/zinc/08/72/67/384087267.db2.gz BKQPJCZCVJTOOV-GFCCVEGCSA-N 1 2 244.342 2.283 20 0 BEADLO CC[C@@H](C[N@@H+]1CCOC[C@H]1c1ccco1)OC ZINC000642687308 384066552 /nfs/dbraw/zinc/06/65/52/384066552.db2.gz GIFMUKZTALCGQS-RYUDHWBXSA-N 1 2 239.315 2.078 20 0 BEADLO CC[C@@H](C[N@H+]1CCOC[C@H]1c1ccco1)OC ZINC000642687308 384066559 /nfs/dbraw/zinc/06/65/59/384066559.db2.gz GIFMUKZTALCGQS-RYUDHWBXSA-N 1 2 239.315 2.078 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1cccc(Cl)c1 ZINC000049956424 384071770 /nfs/dbraw/zinc/07/17/70/384071770.db2.gz KRDVIHULWGECEE-VIFPVBQESA-N 1 2 241.718 2.333 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1cccc(Cl)c1 ZINC000049956424 384071775 /nfs/dbraw/zinc/07/17/75/384071775.db2.gz KRDVIHULWGECEE-VIFPVBQESA-N 1 2 241.718 2.333 20 0 BEADLO Cc1cccnc1NC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000560342625 384076649 /nfs/dbraw/zinc/07/66/49/384076649.db2.gz ZVGKQMCRNGWHGP-NSHDSACASA-N 1 2 244.298 2.176 20 0 BEADLO COC(=O)[C@H]([NH2+][C@@H](C)c1ccccc1)C1CC1 ZINC000115991192 384111766 /nfs/dbraw/zinc/11/17/66/384111766.db2.gz KEQVOAWPFMVSML-GXFFZTMASA-N 1 2 233.311 2.289 20 0 BEADLO CC[C@@H]1CN(c2cc(C)[nH+]c(C3CC3)n2)CCO1 ZINC000116259942 384124467 /nfs/dbraw/zinc/12/44/67/384124467.db2.gz DJQZYSXVMLUDDR-GFCCVEGCSA-N 1 2 247.342 2.278 20 0 BEADLO CC[C@H](NC(=O)C[C@H]1C=CCC1)c1[nH]cc[nH+]1 ZINC000140606905 384156191 /nfs/dbraw/zinc/15/61/91/384156191.db2.gz FPRSVQIYHZSSRG-QWRGUYRKSA-N 1 2 233.315 2.333 20 0 BEADLO COCc1ccc(C[N@@H+]2C[C@@H](C)OC[C@H]2C)o1 ZINC000092017139 384159847 /nfs/dbraw/zinc/15/98/47/384159847.db2.gz ORJCJFYPSUQIDF-GHMZBOCLSA-N 1 2 239.315 2.035 20 0 BEADLO COCc1ccc(C[N@H+]2C[C@@H](C)OC[C@H]2C)o1 ZINC000092017139 384159855 /nfs/dbraw/zinc/15/98/55/384159855.db2.gz ORJCJFYPSUQIDF-GHMZBOCLSA-N 1 2 239.315 2.035 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cnccn2)o1 ZINC000092591016 384185739 /nfs/dbraw/zinc/18/57/39/384185739.db2.gz PODDDWZMMKINBK-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cnccn2)o1 ZINC000092591016 384185742 /nfs/dbraw/zinc/18/57/42/384185742.db2.gz PODDDWZMMKINBK-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO CC[C@@H](C[N@@H+]1CCC[C@H]1C(F)F)OC ZINC000642699295 384202707 /nfs/dbraw/zinc/20/27/07/384202707.db2.gz PHJACUMQMLMDEC-IUCAKERBSA-N 1 2 207.264 2.141 20 0 BEADLO CC[C@@H](C[N@H+]1CCC[C@H]1C(F)F)OC ZINC000642699295 384202710 /nfs/dbraw/zinc/20/27/10/384202710.db2.gz PHJACUMQMLMDEC-IUCAKERBSA-N 1 2 207.264 2.141 20 0 BEADLO Cn1cccc1C[N@@H+]1CCCC[C@H]1c1ncc[nH]1 ZINC000092729956 384192254 /nfs/dbraw/zinc/19/22/54/384192254.db2.gz WWNMKGOEOWAXOL-ZDUSSCGKSA-N 1 2 244.342 2.475 20 0 BEADLO Cn1cccc1C[N@H+]1CCCC[C@H]1c1ncc[nH]1 ZINC000092729956 384192258 /nfs/dbraw/zinc/19/22/58/384192258.db2.gz WWNMKGOEOWAXOL-ZDUSSCGKSA-N 1 2 244.342 2.475 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2c[nH]cn2)s1 ZINC000093049333 384207830 /nfs/dbraw/zinc/20/78/30/384207830.db2.gz VDPJLJXDFAPAJY-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2c[nH]cn2)s1 ZINC000093049333 384207838 /nfs/dbraw/zinc/20/78/38/384207838.db2.gz VDPJLJXDFAPAJY-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cnc[nH]2)s1 ZINC000093049333 384207841 /nfs/dbraw/zinc/20/78/41/384207841.db2.gz VDPJLJXDFAPAJY-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cnc[nH]2)s1 ZINC000093049333 384207847 /nfs/dbraw/zinc/20/78/47/384207847.db2.gz VDPJLJXDFAPAJY-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1ccc(NCC2=CCCOC2)c(C)[nH+]1 ZINC000119067968 384230500 /nfs/dbraw/zinc/23/05/00/384230500.db2.gz OXJVLRLXVBEQBB-UHFFFAOYSA-N 1 2 218.300 2.457 20 0 BEADLO CC(=O)[C@H](C)Sc1[nH+]cc2ccccn21 ZINC000072739497 384230718 /nfs/dbraw/zinc/23/07/18/384230718.db2.gz WNFLMUHGTXGNDO-VIFPVBQESA-N 1 2 220.297 2.404 20 0 BEADLO Fc1ccc2c(c1)C[N@@H+](Cc1cc[nH]n1)CC2 ZINC000093383833 384233038 /nfs/dbraw/zinc/23/30/38/384233038.db2.gz DPWQCYDLBVXXLM-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO Fc1ccc2c(c1)C[N@H+](Cc1cc[nH]n1)CC2 ZINC000093383833 384233044 /nfs/dbraw/zinc/23/30/44/384233044.db2.gz DPWQCYDLBVXXLM-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO CCc1ccc([C@@H](C)[NH2+]Cc2nncn2CC)o1 ZINC000158499541 384237885 /nfs/dbraw/zinc/23/78/85/384237885.db2.gz AEGKMVYZDNHHBR-SNVBAGLBSA-N 1 2 248.330 2.304 20 0 BEADLO CC(C)[C@H]1N(C(=O)CCc2c[nH+]c[nH]2)CC1(C)C ZINC000294072636 384215881 /nfs/dbraw/zinc/21/58/81/384215881.db2.gz WWQYWIMXGICMMV-CYBMUJFWSA-N 1 2 249.358 2.235 20 0 BEADLO CC(C)[C@H]1N(C(=O)CCc2c[nH]c[nH+]2)CC1(C)C ZINC000294072636 384215885 /nfs/dbraw/zinc/21/58/85/384215885.db2.gz WWQYWIMXGICMMV-CYBMUJFWSA-N 1 2 249.358 2.235 20 0 BEADLO C[N@H+](Cc1c(F)cccc1F)[C@H]1CCOC1 ZINC000132185402 384220134 /nfs/dbraw/zinc/22/01/34/384220134.db2.gz NNZSYSUHRZUVDV-VIFPVBQESA-N 1 2 227.254 2.186 20 0 BEADLO C[N@@H+](Cc1c(F)cccc1F)[C@H]1CCOC1 ZINC000132185402 384220137 /nfs/dbraw/zinc/22/01/37/384220137.db2.gz NNZSYSUHRZUVDV-VIFPVBQESA-N 1 2 227.254 2.186 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)C[C@@H]1CCCC(C)(C)C1 ZINC000560555168 384221189 /nfs/dbraw/zinc/22/11/89/384221189.db2.gz QGLCTRVVUMCSKI-LLVKDONJSA-N 1 2 236.363 2.453 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)C[C@@H]1CCCC(C)(C)C1 ZINC000560555168 384221197 /nfs/dbraw/zinc/22/11/97/384221197.db2.gz QGLCTRVVUMCSKI-LLVKDONJSA-N 1 2 236.363 2.453 20 0 BEADLO CCc1cc(N[C@H]2[C@@H](C)[C@@H](C)O[C@H]2C)nc[nH+]1 ZINC000624635070 384222185 /nfs/dbraw/zinc/22/21/85/384222185.db2.gz ZTDPNDDMCRQTDQ-WJZNIJOASA-N 1 2 235.331 2.263 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2ccco2)CCO1 ZINC000093508450 384244132 /nfs/dbraw/zinc/24/41/32/384244132.db2.gz PSJPEJIPTYKRRK-NSHDSACASA-N 1 2 209.289 2.281 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2ccco2)CCO1 ZINC000093508450 384244141 /nfs/dbraw/zinc/24/41/41/384244141.db2.gz PSJPEJIPTYKRRK-NSHDSACASA-N 1 2 209.289 2.281 20 0 BEADLO Cc1c(Cl)cnn1Cc1[nH+]ccn1C(F)F ZINC000158619484 384251328 /nfs/dbraw/zinc/25/13/28/384251328.db2.gz BODAPKMJGXBJJE-UHFFFAOYSA-N 1 2 246.648 2.485 20 0 BEADLO Cc1csc(C(=O)NCc2[nH]c[nH+]c2C)c1 ZINC000295402229 384259948 /nfs/dbraw/zinc/25/99/48/384259948.db2.gz URJWKYQFAJXOTL-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO Cc1ccc(C[N@@H+](C)[C@H](C)C(=O)OC(C)C)o1 ZINC000093772991 384270490 /nfs/dbraw/zinc/27/04/90/384270490.db2.gz ZBECKAWKRSDVJN-LLVKDONJSA-N 1 2 239.315 2.360 20 0 BEADLO Cc1ccc(C[N@H+](C)[C@H](C)C(=O)OC(C)C)o1 ZINC000093772991 384270497 /nfs/dbraw/zinc/27/04/97/384270497.db2.gz ZBECKAWKRSDVJN-LLVKDONJSA-N 1 2 239.315 2.360 20 0 BEADLO CCN(C(=O)Nc1cc[nH+]c(C)c1)C1CC1 ZINC000119431600 384271383 /nfs/dbraw/zinc/27/13/83/384271383.db2.gz KIZHQAJXOITOFU-UHFFFAOYSA-N 1 2 219.288 2.406 20 0 BEADLO Cc1ccc(C[N@H+]2CCC[C@@H]2c2nncn2C)o1 ZINC000093809779 384274479 /nfs/dbraw/zinc/27/44/79/384274479.db2.gz YYLXNYFLCCBJSX-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC[C@@H]2c2nncn2C)o1 ZINC000093809779 384274486 /nfs/dbraw/zinc/27/44/86/384274486.db2.gz YYLXNYFLCCBJSX-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO C/C(Cl)=C\C[NH2+][C@@H](C)c1nc(C)no1 ZINC000528446540 384242001 /nfs/dbraw/zinc/24/20/01/384242001.db2.gz ATRISZOCLKTIBQ-KNIZRNDPSA-N 1 2 215.684 2.171 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CCC[C@H](C)C1)c1[nH]cc[nH+]1 ZINC000560698854 384305503 /nfs/dbraw/zinc/30/55/03/384305503.db2.gz ZJRMDSYDDKMOCQ-AXFHLTTASA-N 1 2 235.331 2.413 20 0 BEADLO CCCC[C@@H](C)N(C)C(=O)CCc1c[nH+]c[nH]1 ZINC000291328335 384305832 /nfs/dbraw/zinc/30/58/32/384305832.db2.gz RURUTFYNPOWVPP-LLVKDONJSA-N 1 2 237.347 2.379 20 0 BEADLO CCCC[C@@H](C)N(C)C(=O)CCc1c[nH]c[nH+]1 ZINC000291328335 384305835 /nfs/dbraw/zinc/30/58/35/384305835.db2.gz RURUTFYNPOWVPP-LLVKDONJSA-N 1 2 237.347 2.379 20 0 BEADLO CCN(CCc1nccs1)c1cc[nH+]c(C)n1 ZINC000159260407 384312682 /nfs/dbraw/zinc/31/26/82/384312682.db2.gz ABNILSHWVAEYOO-UHFFFAOYSA-N 1 2 248.355 2.311 20 0 BEADLO C[C@H]1C[C@H](Nc2ccc3ccccc3[nH+]2)CO1 ZINC000335436827 384278499 /nfs/dbraw/zinc/27/84/99/384278499.db2.gz CVNXSPYNAOMRPO-JQWIXIFHSA-N 1 2 228.295 2.246 20 0 BEADLO Cc1nnc(C[NH2+]C(C)(C)c2ccccc2)o1 ZINC000299553944 384282406 /nfs/dbraw/zinc/28/24/06/384282406.db2.gz CSOHEBWFUGOLLO-UHFFFAOYSA-N 1 2 231.299 2.403 20 0 BEADLO CC[C@@H](C)NC(=O)Nc1cc[nH+]c(C)c1 ZINC000074621724 384297513 /nfs/dbraw/zinc/29/75/13/384297513.db2.gz BHHRWKAMZLPOKR-MRVPVSSYSA-N 1 2 207.277 2.310 20 0 BEADLO C[C@@H](C[C@H]1CCCO1)Nc1cccc[nH+]1 ZINC000308834066 384335042 /nfs/dbraw/zinc/33/50/42/384335042.db2.gz HKIOVOGTHDPPII-WDEREUQCSA-N 1 2 206.289 2.451 20 0 BEADLO C[C@H]1C[C@@H](CO)CN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000335571262 384335276 /nfs/dbraw/zinc/33/52/76/384335276.db2.gz ZBQDPLXWWWRZKP-WDEREUQCSA-N 1 2 245.326 2.018 20 0 BEADLO COC(=O)C[NH2+]C(C)(C)CCc1ccccc1 ZINC000134318202 384348438 /nfs/dbraw/zinc/34/84/38/384348438.db2.gz NCZBMNZBNFEBPJ-UHFFFAOYSA-N 1 2 235.327 2.160 20 0 BEADLO Cn1ccnc1C[NH+]1CCC(C(F)(F)F)CC1 ZINC000075969442 384350625 /nfs/dbraw/zinc/35/06/25/384350625.db2.gz MJMFZXYKYGHNAN-UHFFFAOYSA-N 1 2 247.264 2.194 20 0 BEADLO CC(C)CC1(C(=O)NCc2[nH]cc[nH+]2)CCC1 ZINC000120131746 384332154 /nfs/dbraw/zinc/33/21/54/384332154.db2.gz SCSSCRDBUDRCSC-UHFFFAOYSA-N 1 2 235.331 2.242 20 0 BEADLO C[C@@H]1OCC[C@@H]1Nc1ccc(N2CCCC2)[nH+]c1 ZINC000134117174 384333078 /nfs/dbraw/zinc/33/30/78/384333078.db2.gz YQQCDSHMAXGTRP-AAEUAGOBSA-N 1 2 247.342 2.271 20 0 BEADLO Cc1cnc(CCn2cc[nH+]c2)c(C)c1 ZINC000335620486 384397952 /nfs/dbraw/zinc/39/79/52/384397952.db2.gz ALPLLDGHJQYSLT-UHFFFAOYSA-N 1 2 201.273 2.138 20 0 BEADLO c1csc(N2CC[NH+](Cc3ccon3)CC2)c1 ZINC000121212998 384402590 /nfs/dbraw/zinc/40/25/90/384402590.db2.gz XKORSEZPZLRUBL-UHFFFAOYSA-N 1 2 249.339 2.058 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCc2ccccc21)c1ncn(C)n1 ZINC000275649276 384406724 /nfs/dbraw/zinc/40/67/24/384406724.db2.gz DKWDQWCCFQCLMN-MFKMUULPSA-N 1 2 242.326 2.153 20 0 BEADLO CCC[C@@H]([NH2+][C@@H]1CCC(F)(F)C1)C(=O)OCC ZINC000310556066 384411803 /nfs/dbraw/zinc/41/18/03/384411803.db2.gz IFWVJUQYXRGRLQ-NXEZZACHSA-N 1 2 249.301 2.496 20 0 BEADLO CC(C)CO[C@@H]1CC[N@H+](Cc2nccs2)C1 ZINC000135149053 384419736 /nfs/dbraw/zinc/41/97/36/384419736.db2.gz DLQCESMGGYUDEI-LLVKDONJSA-N 1 2 240.372 2.390 20 0 BEADLO CC(C)CO[C@@H]1CC[N@@H+](Cc2nccs2)C1 ZINC000135149053 384419744 /nfs/dbraw/zinc/41/97/44/384419744.db2.gz DLQCESMGGYUDEI-LLVKDONJSA-N 1 2 240.372 2.390 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2ncn(C)n2)cc1C ZINC000275844130 384420915 /nfs/dbraw/zinc/42/09/15/384420915.db2.gz QLVJYPJRBDKMFP-LBPRGKRZSA-N 1 2 244.342 2.283 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2ncn(C)n2)cc1F ZINC000275874857 384422501 /nfs/dbraw/zinc/42/25/01/384422501.db2.gz WBONFDRPZBUZJK-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO Cc1n[nH]cc1CNc1ccc(C)[nH+]c1 ZINC000096033315 384423828 /nfs/dbraw/zinc/42/38/28/384423828.db2.gz SQISZTRPAHNEBU-UHFFFAOYSA-N 1 2 202.261 2.034 20 0 BEADLO Cc1cnccc1SCc1cc[nH+]c(N)c1 ZINC000334297256 384424636 /nfs/dbraw/zinc/42/46/36/384424636.db2.gz ASHVBQOJGQAJHV-UHFFFAOYSA-N 1 2 231.324 2.490 20 0 BEADLO CC(C)c1nc(N[C@@H]2CC[C@H](F)C2)cc[nH+]1 ZINC000335607883 384387432 /nfs/dbraw/zinc/38/74/32/384387432.db2.gz KKHTUJSWKMPSRG-VHSXEESVSA-N 1 2 223.295 2.324 20 0 BEADLO CCc1nc(CNc2c[nH]c[nH+]2)cs1 ZINC000306274569 384448498 /nfs/dbraw/zinc/44/84/98/384448498.db2.gz PWEBAMGVEBVOKH-UHFFFAOYSA-N 1 2 208.290 2.041 20 0 BEADLO CC(C)(O)CNc1cc(C(F)(F)F)cc[nH+]1 ZINC000078612510 384451228 /nfs/dbraw/zinc/45/12/28/384451228.db2.gz JZHWRJANHAQAAP-UHFFFAOYSA-N 1 2 234.221 2.283 20 0 BEADLO C[C@@H]([NH2+][C@@H]1C[C@@H](C)[C@H]1C)C(=O)OC(C)(C)C ZINC000309888497 384461077 /nfs/dbraw/zinc/46/10/77/384461077.db2.gz ZKKPEVNVFFDLOY-GWOFURMSSA-N 1 2 227.348 2.351 20 0 BEADLO C[C@@H]([NH2+][C@H]1C[C@@H](C)[C@@H]1C)C(=O)OC(C)(C)C ZINC000309888500 384461361 /nfs/dbraw/zinc/46/13/61/384461361.db2.gz ZKKPEVNVFFDLOY-YTWAJWBKSA-N 1 2 227.348 2.351 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H]1CC1(C)C ZINC000122338330 384479161 /nfs/dbraw/zinc/47/91/61/384479161.db2.gz BRXOQHRABLSJJN-SECBINFHSA-N 1 2 204.273 2.375 20 0 BEADLO CCC[C@H](C)C(=O)NCCCNc1cccc[nH+]1 ZINC000136206472 384483653 /nfs/dbraw/zinc/48/36/53/384483653.db2.gz YBPJEMZDKTZOPM-LBPRGKRZSA-N 1 2 249.358 2.436 20 0 BEADLO CC(C)n1ccc(CN[C@H](C)c2[nH]cc[nH+]2)n1 ZINC000569600028 384498801 /nfs/dbraw/zinc/49/88/01/384498801.db2.gz WPHASULFPJRLBI-SNVBAGLBSA-N 1 2 233.319 2.038 20 0 BEADLO Cn1c[nH+]cc1CNc1ccccc1F ZINC000085167722 384508249 /nfs/dbraw/zinc/50/82/49/384508249.db2.gz GAURJTQAVOERHW-UHFFFAOYSA-N 1 2 205.236 2.171 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1cc(F)ccc1C ZINC000335698750 384486983 /nfs/dbraw/zinc/48/69/83/384486983.db2.gz FRAYQLROOROVHT-UHFFFAOYSA-N 1 2 247.273 2.096 20 0 BEADLO Cc1nc(N2CCc3c(F)cccc3C2)cc[nH+]1 ZINC000161683461 384514238 /nfs/dbraw/zinc/51/42/38/384514238.db2.gz MEICPCQDYRANLC-UHFFFAOYSA-N 1 2 243.285 2.487 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cscn2)o1 ZINC000050871785 384514770 /nfs/dbraw/zinc/51/47/70/384514770.db2.gz HIRHASRNFGYOEI-UHFFFAOYSA-N 1 2 208.286 2.334 20 0 BEADLO O=C(NCCCCn1cc[nH+]c1)c1ccsc1 ZINC000049002331 384515025 /nfs/dbraw/zinc/51/50/25/384515025.db2.gz MLRKGJSLYAYNDO-UHFFFAOYSA-N 1 2 249.339 2.155 20 0 BEADLO FC(F)C1(CNc2cc[nH+]c(C3CC3)n2)CC1 ZINC000359851982 384549933 /nfs/dbraw/zinc/54/99/33/384549933.db2.gz XERVUWAQISWMDI-UHFFFAOYSA-N 1 2 239.269 2.233 20 0 BEADLO Cc1nc(N[C@@H]2CCCCC2(C)C)nc(N)[nH+]1 ZINC000306075708 384569052 /nfs/dbraw/zinc/56/90/52/384569052.db2.gz FZECCWJDTOMMLZ-SECBINFHSA-N 1 2 235.335 2.143 20 0 BEADLO Cc1nc(N)nc(N[C@@H]2CCCCC2(C)C)[nH+]1 ZINC000306075708 384569057 /nfs/dbraw/zinc/56/90/57/384569057.db2.gz FZECCWJDTOMMLZ-SECBINFHSA-N 1 2 235.335 2.143 20 0 BEADLO CC(C)n1ccnc1C[N@@H+]1CCSC[C@@H]1C ZINC000172595106 384608880 /nfs/dbraw/zinc/60/88/80/384608880.db2.gz XNQCUIUVCVEZIX-NSHDSACASA-N 1 2 239.388 2.401 20 0 BEADLO CC(C)n1ccnc1C[N@H+]1CCSC[C@@H]1C ZINC000172595106 384608887 /nfs/dbraw/zinc/60/88/87/384608887.db2.gz XNQCUIUVCVEZIX-NSHDSACASA-N 1 2 239.388 2.401 20 0 BEADLO CN(C)c1ccc(NC[C@@H]2CCC=CO2)c[nH+]1 ZINC000050268326 384610641 /nfs/dbraw/zinc/61/06/41/384610641.db2.gz SEZWNZQQDUMGDF-LBPRGKRZSA-N 1 2 233.315 2.252 20 0 BEADLO Cc1ccc(C[N@@H+]2CCc3sccc3C2)nn1 ZINC000334859653 384597872 /nfs/dbraw/zinc/59/78/72/384597872.db2.gz LTOBWNQGZXGAKN-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ccc(C[N@H+]2CCc3sccc3C2)nn1 ZINC000334859653 384597880 /nfs/dbraw/zinc/59/78/80/384597880.db2.gz LTOBWNQGZXGAKN-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO CC[C@@H](C(=O)OC)[N@H+](C)Cc1ccc(C)s1 ZINC000173302638 384670288 /nfs/dbraw/zinc/67/02/88/384670288.db2.gz NXXGRWAINWMYEF-NSHDSACASA-N 1 2 241.356 2.440 20 0 BEADLO CC[C@@H](C(=O)OC)[N@@H+](C)Cc1ccc(C)s1 ZINC000173302638 384670291 /nfs/dbraw/zinc/67/02/91/384670291.db2.gz NXXGRWAINWMYEF-NSHDSACASA-N 1 2 241.356 2.440 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1ccc(F)c(Cl)c1 ZINC000258821400 384674135 /nfs/dbraw/zinc/67/41/35/384674135.db2.gz AHMKIZTUEXEIBN-UHFFFAOYSA-N 1 2 229.682 2.500 20 0 BEADLO CC(=O)C[N@H+](C)Cc1ccc(F)c(Cl)c1 ZINC000258821400 384674139 /nfs/dbraw/zinc/67/41/39/384674139.db2.gz AHMKIZTUEXEIBN-UHFFFAOYSA-N 1 2 229.682 2.500 20 0 BEADLO C[C@@H]([NH2+]CC(F)(F)CO)c1ccc(F)cc1 ZINC000184704010 384641043 /nfs/dbraw/zinc/64/10/43/384641043.db2.gz DOVPOJLLKVFNON-MRVPVSSYSA-N 1 2 233.233 2.104 20 0 BEADLO CC[C@H]([NH2+]C[C@H](SC)C(C)(C)C)C(=O)OC ZINC000336747640 384643492 /nfs/dbraw/zinc/64/34/92/384643492.db2.gz XKQJGFHQKBLNAZ-UWVGGRQHSA-N 1 2 247.404 2.305 20 0 BEADLO CCc1nocc1C[N@H+](C)CC1(F)CC1 ZINC000556946657 384675401 /nfs/dbraw/zinc/67/54/01/384675401.db2.gz LLDSALCXGFOILX-UHFFFAOYSA-N 1 2 212.268 2.171 20 0 BEADLO CCc1nocc1C[N@@H+](C)CC1(F)CC1 ZINC000556946657 384675406 /nfs/dbraw/zinc/67/54/06/384675406.db2.gz LLDSALCXGFOILX-UHFFFAOYSA-N 1 2 212.268 2.171 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+](C)CCOCC2CC2)o1 ZINC000357007333 384723115 /nfs/dbraw/zinc/72/31/15/384723115.db2.gz SYFKXRZWTMFZFB-LLVKDONJSA-N 1 2 238.331 2.402 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+](C)CCOCC2CC2)o1 ZINC000357007333 384723122 /nfs/dbraw/zinc/72/31/22/384723122.db2.gz SYFKXRZWTMFZFB-LLVKDONJSA-N 1 2 238.331 2.402 20 0 BEADLO COC(=O)Nc1cccc(NCc2[nH]cc[nH+]2)c1 ZINC000049715539 384679676 /nfs/dbraw/zinc/67/96/76/384679676.db2.gz CEOIGZLHQAZSAC-UHFFFAOYSA-N 1 2 246.270 2.200 20 0 BEADLO CCc1[nH]c(CNC(=O)CC(C)=C(C)C)c[nH+]1 ZINC001645214976 1172642042 /nfs/dbraw/zinc/64/20/42/1172642042.db2.gz DJUDPHQZDCDLNU-UHFFFAOYSA-N 1 2 235.331 2.335 20 0 BEADLO CCc1[nH]cc(CNC(=O)CC(C)=C(C)C)[nH+]1 ZINC001645214976 1172642046 /nfs/dbraw/zinc/64/20/46/1172642046.db2.gz DJUDPHQZDCDLNU-UHFFFAOYSA-N 1 2 235.331 2.335 20 0 BEADLO Cc1nnc(C[NH2+][C@H](C)c2ccc(C)c(F)c2)[nH]1 ZINC000358040600 384694717 /nfs/dbraw/zinc/69/47/17/384694717.db2.gz RYTIHSRYBROADI-SECBINFHSA-N 1 2 248.305 2.411 20 0 BEADLO Cc1nnc([C@H](C)[N@H+](C)CCC(F)(F)F)o1 ZINC000104678605 384702666 /nfs/dbraw/zinc/70/26/66/384702666.db2.gz NQFAESJLKPXEOX-LURJTMIESA-N 1 2 237.225 2.323 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+](C)CCC(F)(F)F)o1 ZINC000104678605 384702671 /nfs/dbraw/zinc/70/26/71/384702671.db2.gz NQFAESJLKPXEOX-LURJTMIESA-N 1 2 237.225 2.323 20 0 BEADLO Cc1cn2c([nH+]1)CN(C(=O)CC1CCCC1)CC2 ZINC000363701826 384712631 /nfs/dbraw/zinc/71/26/31/384712631.db2.gz QFLAXXAOAYLKTG-UHFFFAOYSA-N 1 2 247.342 2.114 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccoc1)c1ccn(C)n1 ZINC000310001499 384777816 /nfs/dbraw/zinc/77/78/16/384777816.db2.gz FBQDZUXWQSPRCW-LLVKDONJSA-N 1 2 219.288 2.254 20 0 BEADLO Fc1ccc(F)c2c1CC[N@@H+]([C@H]1CCOC1)C2 ZINC000271339570 384732008 /nfs/dbraw/zinc/73/20/08/384732008.db2.gz JKGKAJSXEHVSNX-VIFPVBQESA-N 1 2 239.265 2.112 20 0 BEADLO Fc1ccc(F)c2c1CC[N@H+]([C@H]1CCOC1)C2 ZINC000271339570 384732014 /nfs/dbraw/zinc/73/20/14/384732014.db2.gz JKGKAJSXEHVSNX-VIFPVBQESA-N 1 2 239.265 2.112 20 0 BEADLO Cc1cnc(C[N@@H+]2CCO[C@H]3CCC[C@@H]32)s1 ZINC000271441207 384736272 /nfs/dbraw/zinc/73/62/72/384736272.db2.gz CPICJAGEHMJOJJ-QWRGUYRKSA-N 1 2 238.356 2.205 20 0 BEADLO Cc1cnc(C[N@H+]2CCO[C@H]3CCC[C@@H]32)s1 ZINC000271441207 384736278 /nfs/dbraw/zinc/73/62/78/384736278.db2.gz CPICJAGEHMJOJJ-QWRGUYRKSA-N 1 2 238.356 2.205 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)[C@H]1C[C@@H]1C1CC1 ZINC000176707567 384744522 /nfs/dbraw/zinc/74/45/22/384744522.db2.gz VVOCIMXEJRMQBO-MNOVXSKESA-N 1 2 245.326 2.132 20 0 BEADLO C/C=C\C[S@@](=O)Cc1cn2cccc(C)c2[nH+]1 ZINC000255519596 384752519 /nfs/dbraw/zinc/75/25/19/384752519.db2.gz WAFPWHGBUZEUJH-CWIOURORSA-N 1 2 248.351 2.468 20 0 BEADLO O=C(/C=C\C1CCCCC1)NCCn1cc[nH+]c1 ZINC000255519102 384754601 /nfs/dbraw/zinc/75/46/01/384754601.db2.gz BYHQQPGXJLGXJY-SREVYHEPSA-N 1 2 247.342 2.136 20 0 BEADLO CCC[C@H]([NH2+][C@H]1CC[C@H](F)C1)C(=O)OCC ZINC000310007702 384779885 /nfs/dbraw/zinc/77/98/85/384779885.db2.gz HKHGAEGDENFGAD-DCAQKATOSA-N 1 2 231.311 2.198 20 0 BEADLO CC(C)CCC[N@@H+](CC(F)F)C[C@@H](C)O ZINC000449627888 384760085 /nfs/dbraw/zinc/76/00/85/384760085.db2.gz HQOBJOQUJRVOOS-SNVBAGLBSA-N 1 2 223.307 2.371 20 0 BEADLO CC(C)CCC[N@H+](CC(F)F)C[C@@H](C)O ZINC000449627888 384760091 /nfs/dbraw/zinc/76/00/91/384760091.db2.gz HQOBJOQUJRVOOS-SNVBAGLBSA-N 1 2 223.307 2.371 20 0 BEADLO CC[C@]1(C)C[C@@H]1C(=O)Nc1c[nH+]ccc1OC ZINC000126014303 384761248 /nfs/dbraw/zinc/76/12/48/384761248.db2.gz BHDKICMLOHXSIF-NOZJJQNGSA-N 1 2 234.299 2.465 20 0 BEADLO CCc1ccc([C@@H]2COCC[N@H+]2CC)o1 ZINC000126039097 384764852 /nfs/dbraw/zinc/76/48/52/384764852.db2.gz PANAWMZNNCRZKY-NSHDSACASA-N 1 2 209.289 2.235 20 0 BEADLO CCc1ccc([C@@H]2COCC[N@@H+]2CC)o1 ZINC000126039097 384764856 /nfs/dbraw/zinc/76/48/56/384764856.db2.gz PANAWMZNNCRZKY-NSHDSACASA-N 1 2 209.289 2.235 20 0 BEADLO C[C@H](C(=O)N(C)c1ccc[nH+]c1N(C)C)C1CC1 ZINC000176782606 384768422 /nfs/dbraw/zinc/76/84/22/384768422.db2.gz KVOXMYMGIFGAKZ-JTQLQIEISA-N 1 2 247.342 2.157 20 0 BEADLO Cn1c(Cl)cnc1C[N@@H+]1CCC(C)(C)C1 ZINC000174250666 384770300 /nfs/dbraw/zinc/77/03/00/384770300.db2.gz YMEZPGDCAJXVIX-UHFFFAOYSA-N 1 2 227.739 2.305 20 0 BEADLO Cn1c(Cl)cnc1C[N@H+]1CCC(C)(C)C1 ZINC000174250666 384770305 /nfs/dbraw/zinc/77/03/05/384770305.db2.gz YMEZPGDCAJXVIX-UHFFFAOYSA-N 1 2 227.739 2.305 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC12CCC(CC1)C2 ZINC000363743837 384772192 /nfs/dbraw/zinc/77/21/92/384772192.db2.gz COTRUGDRCGMOBW-UHFFFAOYSA-N 1 2 245.326 2.266 20 0 BEADLO Cc1cncc(CNc2nc[nH+]c(N)c2Cl)c1 ZINC000302825397 384819156 /nfs/dbraw/zinc/81/91/56/384819156.db2.gz GUPKORXEIACQAP-UHFFFAOYSA-N 1 2 249.705 2.028 20 0 BEADLO CC[C@@H]1CCCN(c2cc[nH+]c(C)n2)C1 ZINC000174679830 384825131 /nfs/dbraw/zinc/82/51/31/384825131.db2.gz UBJPUVTYLLMAGI-LLVKDONJSA-N 1 2 205.305 2.411 20 0 BEADLO CCc1nc(C[N@H+](CC(C)C)C2CC2)no1 ZINC000054316668 384830942 /nfs/dbraw/zinc/83/09/42/384830942.db2.gz QUTZZHBEXSGAFT-UHFFFAOYSA-N 1 2 223.320 2.252 20 0 BEADLO CCc1nc(C[N@@H+](CC(C)C)C2CC2)no1 ZINC000054316668 384830946 /nfs/dbraw/zinc/83/09/46/384830946.db2.gz QUTZZHBEXSGAFT-UHFFFAOYSA-N 1 2 223.320 2.252 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccco2)on1 ZINC000053419880 384788197 /nfs/dbraw/zinc/78/81/97/384788197.db2.gz IUSVIZRNWYGOGZ-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccco2)on1 ZINC000053419880 384788204 /nfs/dbraw/zinc/78/82/04/384788204.db2.gz IUSVIZRNWYGOGZ-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO CCc1ccc([C@@H](COC)NCc2[nH]cc[nH+]2)o1 ZINC000174477738 384797178 /nfs/dbraw/zinc/79/71/78/384797178.db2.gz MKKHUQCEUMXWOY-LLVKDONJSA-N 1 2 249.314 2.042 20 0 BEADLO CCC[C@H](CC)NC(=O)[C@@H]1CCn2c[nH+]cc2C1 ZINC000151804303 384797536 /nfs/dbraw/zinc/79/75/36/384797536.db2.gz VYKKRKZHJDXQJC-NEPJUHHUSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1ncc(C[NH2+]Cc2ccccc2F)o1 ZINC000398100598 384804747 /nfs/dbraw/zinc/80/47/47/384804747.db2.gz MMRYCBPWFMMWEU-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO CC[C@H]1C[N@H+](CCC(=O)c2ccccc2)CCO1 ZINC000053931646 384809650 /nfs/dbraw/zinc/80/96/50/384809650.db2.gz MKLONVOFNMLNKE-AWEZNQCLSA-N 1 2 247.338 2.370 20 0 BEADLO CC[C@H]1C[N@@H+](CCC(=O)c2ccccc2)CCO1 ZINC000053931646 384809656 /nfs/dbraw/zinc/80/96/56/384809656.db2.gz MKLONVOFNMLNKE-AWEZNQCLSA-N 1 2 247.338 2.370 20 0 BEADLO Cc1ccc(C(=O)CC[N@H+]2CCOC[C@@H]2C)cc1 ZINC000053935310 384809968 /nfs/dbraw/zinc/80/99/68/384809968.db2.gz WFFSNYGDBPUXHJ-ZDUSSCGKSA-N 1 2 247.338 2.289 20 0 BEADLO Cc1ccc(C(=O)CC[N@@H+]2CCOC[C@@H]2C)cc1 ZINC000053935310 384809977 /nfs/dbraw/zinc/80/99/77/384809977.db2.gz WFFSNYGDBPUXHJ-ZDUSSCGKSA-N 1 2 247.338 2.289 20 0 BEADLO CSCC[N@@H+]1CC[C@H](C)C(F)(F)C1 ZINC000306305992 384872556 /nfs/dbraw/zinc/87/25/56/384872556.db2.gz FAFNCRVMTKAGJH-QMMMGPOBSA-N 1 2 209.305 2.327 20 0 BEADLO CSCC[N@H+]1CC[C@H](C)C(F)(F)C1 ZINC000306305992 384872560 /nfs/dbraw/zinc/87/25/60/384872560.db2.gz FAFNCRVMTKAGJH-QMMMGPOBSA-N 1 2 209.305 2.327 20 0 BEADLO Cn1cc(C[N@@H+]2CCC[C@H]2c2nccs2)cn1 ZINC000370794734 384875296 /nfs/dbraw/zinc/87/52/96/384875296.db2.gz QGKNEHKPLBNBIM-NSHDSACASA-N 1 2 248.355 2.214 20 0 BEADLO Cn1cc(C[N@H+]2CCC[C@H]2c2nccs2)cn1 ZINC000370794734 384875303 /nfs/dbraw/zinc/87/53/03/384875303.db2.gz QGKNEHKPLBNBIM-NSHDSACASA-N 1 2 248.355 2.214 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1cc2ccccc2o1 ZINC000175174239 384875769 /nfs/dbraw/zinc/87/57/69/384875769.db2.gz RHFTUXXENCCYIT-JTQLQIEISA-N 1 2 247.294 2.426 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1cc2ccccc2o1 ZINC000175174239 384875776 /nfs/dbraw/zinc/87/57/76/384875776.db2.gz RHFTUXXENCCYIT-JTQLQIEISA-N 1 2 247.294 2.426 20 0 BEADLO CCOCCNc1cc[nH+]c(C(C)(C)C)n1 ZINC000301458972 384875799 /nfs/dbraw/zinc/87/57/99/384875799.db2.gz XZVFWWHGUFXHFB-UHFFFAOYSA-N 1 2 223.320 2.223 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1ncccc1C ZINC000495093091 533091277 /nfs/dbraw/zinc/09/12/77/533091277.db2.gz JYOJPSHYXPHMFA-UHFFFAOYSA-N 1 2 243.266 2.046 20 0 BEADLO C/C(Cl)=C/C[NH2+]C(C)(C)c1noc(C)n1 ZINC000528414576 384886725 /nfs/dbraw/zinc/88/67/25/384886725.db2.gz QXDKFHBWRIKQCU-ALCCZGGFSA-N 1 2 229.711 2.345 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)[C@H]1CCCc2ccccc21 ZINC000174806188 384838613 /nfs/dbraw/zinc/83/86/13/384838613.db2.gz OQNXCUUTOMWIMV-ZDUSSCGKSA-N 1 2 242.326 2.314 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)[C@H]1CCCc2ccccc21 ZINC000174806188 384838619 /nfs/dbraw/zinc/83/86/19/384838619.db2.gz OQNXCUUTOMWIMV-ZDUSSCGKSA-N 1 2 242.326 2.314 20 0 BEADLO Cc1cc(C)c(C[NH2+]CC(F)(F)CO)c(C)c1 ZINC000183889160 384840274 /nfs/dbraw/zinc/84/02/74/384840274.db2.gz GXDOYTSKFAXQQC-UHFFFAOYSA-N 1 2 243.297 2.329 20 0 BEADLO CCC[C@@H]1CCC[C@@H]1C(=O)NCc1c[nH+]c[nH]1 ZINC000449907796 384843934 /nfs/dbraw/zinc/84/39/34/384843934.db2.gz PUVQORUPDRXQBN-PWSUYJOCSA-N 1 2 235.331 2.242 20 0 BEADLO CCC[C@@H]1CCC[C@@H]1C(=O)NCc1c[nH]c[nH+]1 ZINC000449907796 384843938 /nfs/dbraw/zinc/84/39/38/384843938.db2.gz PUVQORUPDRXQBN-PWSUYJOCSA-N 1 2 235.331 2.242 20 0 BEADLO Cc1cncc(NCc2cn3ccccc3[nH+]2)n1 ZINC000358241456 384844929 /nfs/dbraw/zinc/84/49/29/384844929.db2.gz RPLYIPRUBARKBP-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO COc1cc(C[NH2+]CC(F)F)ccc1C ZINC000147708123 384851859 /nfs/dbraw/zinc/85/18/59/384851859.db2.gz YTMOHWCFVNNNDO-UHFFFAOYSA-N 1 2 215.243 2.358 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)OC(C)(C)C ZINC000497198169 384857803 /nfs/dbraw/zinc/85/78/03/384857803.db2.gz VZXKPBCRIUCMTA-SECBINFHSA-N 1 2 239.319 2.489 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCCC2(CC2)C1 ZINC000186607832 384859736 /nfs/dbraw/zinc/85/97/36/384859736.db2.gz USCPGXOAXDFSLV-UHFFFAOYSA-N 1 2 205.305 2.094 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCCC2(CC2)C1 ZINC000186607832 384859742 /nfs/dbraw/zinc/85/97/42/384859742.db2.gz USCPGXOAXDFSLV-UHFFFAOYSA-N 1 2 205.305 2.094 20 0 BEADLO C[C@H](C(=O)N1CCC(n2cc[nH+]c2)CC1)C1CC1 ZINC000175287550 384889247 /nfs/dbraw/zinc/88/92/47/384889247.db2.gz NAGLPIDBEPPONU-NSHDSACASA-N 1 2 247.342 2.093 20 0 BEADLO C[N@@H+](Cc1nccs1)C[C@@H]1CCCCO1 ZINC000175090151 384867172 /nfs/dbraw/zinc/86/71/72/384867172.db2.gz DMBCWCPUHAQYBC-JTQLQIEISA-N 1 2 226.345 2.144 20 0 BEADLO C[N@H+](Cc1nccs1)C[C@@H]1CCCCO1 ZINC000175090151 384867176 /nfs/dbraw/zinc/86/71/76/384867176.db2.gz DMBCWCPUHAQYBC-JTQLQIEISA-N 1 2 226.345 2.144 20 0 BEADLO C[C@H](C(=O)NCCCNc1cccc[nH+]1)C1CC1 ZINC000175346023 384894995 /nfs/dbraw/zinc/89/49/95/384894995.db2.gz INYNJGLDZHPEIU-NSHDSACASA-N 1 2 247.342 2.046 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000127476478 384900890 /nfs/dbraw/zinc/90/08/90/384900890.db2.gz HITBASWHJVNWJV-ZDUSSCGKSA-N 1 2 230.315 2.383 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000127476478 384900892 /nfs/dbraw/zinc/90/08/92/384900892.db2.gz HITBASWHJVNWJV-ZDUSSCGKSA-N 1 2 230.315 2.383 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1cn[nH]c1 ZINC000222510138 384918264 /nfs/dbraw/zinc/91/82/64/384918264.db2.gz RQYJSBKPMSZDPJ-SFYZADRCSA-N 1 2 222.317 2.278 20 0 BEADLO CC[C@H](Nc1cc(C)[nH+]cn1)[C@@H]1CCCO1 ZINC000301824751 384925692 /nfs/dbraw/zinc/92/56/92/384925692.db2.gz IKAHUNPVUFIZDG-QWRGUYRKSA-N 1 2 221.304 2.155 20 0 BEADLO CC[C@@H](C)OCC(=O)Nc1cc[nH+]cc1C ZINC000127700336 384933768 /nfs/dbraw/zinc/93/37/68/384933768.db2.gz OZQRYLALDCZUEA-SNVBAGLBSA-N 1 2 222.288 2.144 20 0 BEADLO Cc1noc(C[N@@H+]2CCc3ccccc3[C@@H]2C)n1 ZINC000106862231 384936991 /nfs/dbraw/zinc/93/69/91/384936991.db2.gz FBGTVPWGRDONGU-JTQLQIEISA-N 1 2 243.310 2.497 20 0 BEADLO Cc1noc(C[N@H+]2CCc3ccccc3[C@@H]2C)n1 ZINC000106862231 384936997 /nfs/dbraw/zinc/93/69/97/384936997.db2.gz FBGTVPWGRDONGU-JTQLQIEISA-N 1 2 243.310 2.497 20 0 BEADLO COC(=O)COc1ccc([NH2+]CC2CC2)c(C)c1 ZINC000127791943 384945893 /nfs/dbraw/zinc/94/58/93/384945893.db2.gz BCHGANOZDUAIHE-UHFFFAOYSA-N 1 2 249.310 2.369 20 0 BEADLO Cc1cc(NCC[C@H](C)F)nc(C(C)C)[nH+]1 ZINC000338758533 384947328 /nfs/dbraw/zinc/94/73/28/384947328.db2.gz WGWJAFANWILBAO-VIFPVBQESA-N 1 2 225.311 2.490 20 0 BEADLO CCn1c[nH+]cc1CNc1n[nH]c(C(C)C)c1C ZINC000647241467 384970040 /nfs/dbraw/zinc/97/00/40/384970040.db2.gz OSZSYOARPWZSPB-UHFFFAOYSA-N 1 2 247.346 2.092 20 0 BEADLO Cc1cc(C[NH2+][C@@H]2C[C@H](C)n3ccnc32)sn1 ZINC000404342567 384973761 /nfs/dbraw/zinc/97/37/61/384973761.db2.gz FQSALBCXLYVJRR-GXSJLCMTSA-N 1 2 248.355 2.444 20 0 BEADLO Cn1ccnc1[C@H]([NH2+]Cc1nccs1)C1CC1 ZINC000187761096 384978714 /nfs/dbraw/zinc/97/87/14/384978714.db2.gz VRMVNXXBZLBMJL-LLVKDONJSA-N 1 2 248.355 2.118 20 0 BEADLO Cc1ccc(C[N@H+]2CCc3c(ncn3C)C2)cc1 ZINC000364091142 384980691 /nfs/dbraw/zinc/98/06/91/384980691.db2.gz FISRNDZNYQRWFZ-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO Cc1ccc(C[N@@H+]2CCc3c(ncn3C)C2)cc1 ZINC000364091142 384980695 /nfs/dbraw/zinc/98/06/95/384980695.db2.gz FISRNDZNYQRWFZ-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO Cc1ccc(CN2CCc3c([nH+]cn3C)C2)cc1 ZINC000364091142 384980699 /nfs/dbraw/zinc/98/06/99/384980699.db2.gz FISRNDZNYQRWFZ-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO Cn1c[nH+]c2c1CCN(Cc1cccc(F)c1)C2 ZINC000364100889 384992335 /nfs/dbraw/zinc/99/23/35/384992335.db2.gz WWSHBBDCXSNAMJ-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO c1ccc(N[C@@H]2C[C@H]3OCCC[C@@H]23)[nH+]c1 ZINC000302441874 384992454 /nfs/dbraw/zinc/99/24/54/384992454.db2.gz NFZQQCQQPNMXBT-HBNTYKKESA-N 1 2 204.273 2.061 20 0 BEADLO CC(C)c1nc(NCCC(C)(C)O)cc[nH+]1 ZINC000302495372 384995311 /nfs/dbraw/zinc/99/53/11/384995311.db2.gz UHRFCOHOIOUXAB-UHFFFAOYSA-N 1 2 223.320 2.173 20 0 BEADLO CC(C)C1(C)CCN(C(=O)Cn2cc[nH+]c2)CC1 ZINC000557556228 385017481 /nfs/dbraw/zinc/01/74/81/385017481.db2.gz SPXCVJIWMJFPQS-UHFFFAOYSA-N 1 2 249.358 2.168 20 0 BEADLO Cc1cc(C[NH2+]Cc2nccs2)sn1 ZINC000404492604 385019573 /nfs/dbraw/zinc/01/95/73/385019573.db2.gz WLYUJZKZKKMQJJ-UHFFFAOYSA-N 1 2 225.342 2.198 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)CC[C@@H]1CCCO1 ZINC000107294002 384961824 /nfs/dbraw/zinc/96/18/24/384961824.db2.gz LKVONAXSYBJKFN-NSHDSACASA-N 1 2 234.299 2.288 20 0 BEADLO Cc1[nH]nc2ncc(C[NH2+]CC(C)(F)F)cc12 ZINC000559323657 385052674 /nfs/dbraw/zinc/05/26/74/385052674.db2.gz GBHXLBINKMRJNA-UHFFFAOYSA-N 1 2 240.257 2.011 20 0 BEADLO COC[C@H]([NH2+]Cc1nccs1)c1ccco1 ZINC000177577836 385057526 /nfs/dbraw/zinc/05/75/26/385057526.db2.gz IUKCOPQLLBKIOE-VIFPVBQESA-N 1 2 238.312 2.213 20 0 BEADLO Cc1cccc2[nH+]cc(CNCC(C)(F)F)n21 ZINC000559323097 385058038 /nfs/dbraw/zinc/05/80/38/385058038.db2.gz UBLSIPBCYLLBPT-UHFFFAOYSA-N 1 2 239.269 2.388 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H](C)OC[C@@H]2C)c(C)s1 ZINC000336324081 385060632 /nfs/dbraw/zinc/06/06/32/385060632.db2.gz TYWPMXPJSXIWLO-IUCAKERBSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H](C)OC[C@@H]2C)c(C)s1 ZINC000336324081 385060637 /nfs/dbraw/zinc/06/06/37/385060637.db2.gz TYWPMXPJSXIWLO-IUCAKERBSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1ccc(NCc2nccn2C)c(C)[nH+]1 ZINC000087151587 385078555 /nfs/dbraw/zinc/07/85/55/385078555.db2.gz NWBOPBFDYFJANK-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO Cc1cc(NC(=O)C2(O)CCCCC2)cc[nH+]1 ZINC000086586368 385028840 /nfs/dbraw/zinc/02/88/40/385028840.db2.gz JYOZNDLGHNSEOH-UHFFFAOYSA-N 1 2 234.299 2.024 20 0 BEADLO CC[C@H]([NH2+]Cc1ncn(C)n1)c1cccc(F)c1 ZINC000188295979 385035348 /nfs/dbraw/zinc/03/53/48/385035348.db2.gz WWRSQANMFVOWHI-LBPRGKRZSA-N 1 2 248.305 2.195 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2CCCOC2)c(C)[nH+]1 ZINC000176192756 385037000 /nfs/dbraw/zinc/03/70/00/385037000.db2.gz FIMXEDHJAPCMHB-LLVKDONJSA-N 1 2 234.299 2.064 20 0 BEADLO FC(F)C[N@@H+]1CCSC[C@@H]1C1CCC1 ZINC000642725834 385038800 /nfs/dbraw/zinc/03/88/00/385038800.db2.gz KROWHBUNCOCVAY-SECBINFHSA-N 1 2 221.316 2.469 20 0 BEADLO FC(F)C[N@H+]1CCSC[C@@H]1C1CCC1 ZINC000642725834 385038803 /nfs/dbraw/zinc/03/88/03/385038803.db2.gz KROWHBUNCOCVAY-SECBINFHSA-N 1 2 221.316 2.469 20 0 BEADLO Cc1cc[nH+]c(NCCCCO)c1Cl ZINC000308727582 385040682 /nfs/dbraw/zinc/04/06/82/385040682.db2.gz HKCYLKTWGBKPLC-UHFFFAOYSA-N 1 2 214.696 2.228 20 0 BEADLO CC[C@@H](O)CNc1ccc(-n2cc[nH+]c2)cc1 ZINC000644691045 385109642 /nfs/dbraw/zinc/10/96/42/385109642.db2.gz LPADZFVAGBNJJK-CYBMUJFWSA-N 1 2 231.299 2.055 20 0 BEADLO CC(C)Oc1ccc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)cc1 ZINC000644716438 385132709 /nfs/dbraw/zinc/13/27/09/385132709.db2.gz JSBGAVWHBGDQMC-LSDHHAIUSA-N 1 2 247.338 2.447 20 0 BEADLO CC(C)Oc1ccc(C[N@H+]2CCO[C@@H]3C[C@@H]32)cc1 ZINC000644716438 385132714 /nfs/dbraw/zinc/13/27/14/385132714.db2.gz JSBGAVWHBGDQMC-LSDHHAIUSA-N 1 2 247.338 2.447 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2CCCO[C@@H]2C)c(C)[nH+]1 ZINC000189232956 385137653 /nfs/dbraw/zinc/13/76/53/385137653.db2.gz LNTIDJRRWXDZEN-NEPJUHHUSA-N 1 2 248.326 2.452 20 0 BEADLO COCCc1ccccc1NCc1[nH]cc[nH+]1 ZINC000188964975 385107081 /nfs/dbraw/zinc/10/70/81/385107081.db2.gz NPMCFUOLRUVBPQ-UHFFFAOYSA-N 1 2 231.299 2.211 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCOCC23CC3)s1 ZINC000336369816 385185972 /nfs/dbraw/zinc/18/59/72/385185972.db2.gz VZTQFYWYUDTNCF-UHFFFAOYSA-N 1 2 238.356 2.125 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCOCC23CC3)s1 ZINC000336369816 385185976 /nfs/dbraw/zinc/18/59/76/385185976.db2.gz VZTQFYWYUDTNCF-UHFFFAOYSA-N 1 2 238.356 2.125 20 0 BEADLO Cc1ccnc(NCc2ccn3cc[nH+]c3c2)n1 ZINC000354392170 385186284 /nfs/dbraw/zinc/18/62/84/385186284.db2.gz OVIRCDPCHJLHRN-UHFFFAOYSA-N 1 2 239.282 2.045 20 0 BEADLO Cc1cn[nH]c1C[NH2+]Cc1ccccc1F ZINC000289687769 385190443 /nfs/dbraw/zinc/19/04/43/385190443.db2.gz BCOFIQKXONYAGA-UHFFFAOYSA-N 1 2 219.263 2.147 20 0 BEADLO Cc1c[nH]nc1C[NH2+]Cc1ccccc1F ZINC000289687769 385190449 /nfs/dbraw/zinc/19/04/49/385190449.db2.gz BCOFIQKXONYAGA-UHFFFAOYSA-N 1 2 219.263 2.147 20 0 BEADLO C[N@H+](CCOc1ccc(F)cc1)Cc1ncc[nH]1 ZINC000109827206 385194411 /nfs/dbraw/zinc/19/44/11/385194411.db2.gz OGYAZMPIDHGFCZ-UHFFFAOYSA-N 1 2 249.289 2.060 20 0 BEADLO C[N@@H+](CCOc1ccc(F)cc1)Cc1ncc[nH]1 ZINC000109827206 385194417 /nfs/dbraw/zinc/19/44/17/385194417.db2.gz OGYAZMPIDHGFCZ-UHFFFAOYSA-N 1 2 249.289 2.060 20 0 BEADLO Cc1ccc(CNc2cc[nH+]c(C)n2)cn1 ZINC000062054856 385154576 /nfs/dbraw/zinc/15/45/76/385154576.db2.gz ZQAHRFMOMJWLCL-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO CC(C)(C)OC(=O)CC[N@H+](CC(F)F)C1CC1 ZINC000106936227 385155503 /nfs/dbraw/zinc/15/55/03/385155503.db2.gz ZIIIWHKKCQYPOP-UHFFFAOYSA-N 1 2 249.301 2.448 20 0 BEADLO CC(C)(C)OC(=O)CC[N@@H+](CC(F)F)C1CC1 ZINC000106936227 385155508 /nfs/dbraw/zinc/15/55/08/385155508.db2.gz ZIIIWHKKCQYPOP-UHFFFAOYSA-N 1 2 249.301 2.448 20 0 BEADLO CC[C@@H](C)CC(=O)N(C)CCCn1cc[nH+]c1 ZINC000189526508 385162398 /nfs/dbraw/zinc/16/23/98/385162398.db2.gz FMCPMMMEVXNSFL-GFCCVEGCSA-N 1 2 237.347 2.168 20 0 BEADLO COC(=O)[C@@]1(C)CCC[N@@H+]1Cc1ccc(C)o1 ZINC000189993992 385201017 /nfs/dbraw/zinc/20/10/17/385201017.db2.gz GKXLHAKYRFVLFP-CYBMUJFWSA-N 1 2 237.299 2.116 20 0 BEADLO COC(=O)[C@@]1(C)CCC[N@H+]1Cc1ccc(C)o1 ZINC000189993992 385201025 /nfs/dbraw/zinc/20/10/25/385201025.db2.gz GKXLHAKYRFVLFP-CYBMUJFWSA-N 1 2 237.299 2.116 20 0 BEADLO CC(C)CC(C)(C)C(=O)NCCn1cc[nH+]c1 ZINC000177069140 385174824 /nfs/dbraw/zinc/17/48/24/385174824.db2.gz UMMFTIGSDCXCPI-UHFFFAOYSA-N 1 2 237.347 2.072 20 0 BEADLO CC[C@H](CCO)CNc1cc[nH+]c(C2CC2)n1 ZINC000152367552 385176213 /nfs/dbraw/zinc/17/62/13/385176213.db2.gz RUCDHTWAKFMHCB-SNVBAGLBSA-N 1 2 235.331 2.175 20 0 BEADLO C[C@H](C[C@@H]1CCCO1)Nc1cccc[nH+]1 ZINC000308834064 385201313 /nfs/dbraw/zinc/20/13/13/385201313.db2.gz HKIOVOGTHDPPII-MNOVXSKESA-N 1 2 206.289 2.451 20 0 BEADLO COC[C@@H]([NH2+]Cc1cncc(C)c1)c1ccco1 ZINC000190017224 385206918 /nfs/dbraw/zinc/20/69/18/385206918.db2.gz GZMFUCOSSDFTOA-CYBMUJFWSA-N 1 2 246.310 2.460 20 0 BEADLO CCc1cc(N)nc(SCC[C@@H](C)F)[nH+]1 ZINC000308844976 385207799 /nfs/dbraw/zinc/20/77/99/385207799.db2.gz OYRKMIPCTHDVQD-SSDOTTSWSA-N 1 2 229.324 2.461 20 0 BEADLO Cn1cc[nH+]c1CN1CCc2c(F)cccc2C1 ZINC000152728073 385208350 /nfs/dbraw/zinc/20/83/50/385208350.db2.gz AAYBFBYREMCNOP-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO CSCC[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000177280251 385213666 /nfs/dbraw/zinc/21/36/66/385213666.db2.gz HHZBNQGMQUWCKR-NSHDSACASA-N 1 2 243.397 2.484 20 0 BEADLO CSCC[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000177280251 385213671 /nfs/dbraw/zinc/21/36/71/385213671.db2.gz HHZBNQGMQUWCKR-NSHDSACASA-N 1 2 243.397 2.484 20 0 BEADLO CSCc1ccc(-n2cc[nH+]c2)nc1 ZINC000364179906 385218551 /nfs/dbraw/zinc/21/85/51/385218551.db2.gz AQJFNSBHASPXBO-UHFFFAOYSA-N 1 2 205.286 2.130 20 0 BEADLO CC1=CCC[C@@H](C)[C@@H]1C[N@H+]1CC(=O)N(C2CC2)C1 ZINC000448262920 385229294 /nfs/dbraw/zinc/22/92/94/385229294.db2.gz GNARJJWVKJRZHI-TZMCWYRMSA-N 1 2 248.370 2.243 20 0 BEADLO CC1=CCC[C@@H](C)[C@@H]1C[N@@H+]1CC(=O)N(C2CC2)C1 ZINC000448262920 385229295 /nfs/dbraw/zinc/22/92/95/385229295.db2.gz GNARJJWVKJRZHI-TZMCWYRMSA-N 1 2 248.370 2.243 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCS[C@H](C)CC1 ZINC000190699897 385257467 /nfs/dbraw/zinc/25/74/67/385257467.db2.gz OOEYNSNAVCTGFF-SECBINFHSA-N 1 2 225.361 2.046 20 0 BEADLO C[C@@]1(O)CCCN(c2[nH]c3ccccc3[nH+]2)CC1 ZINC000230372574 385245043 /nfs/dbraw/zinc/24/50/43/385245043.db2.gz JMZINNHXLAXYPM-CQSZACIVSA-N 1 2 245.326 2.304 20 0 BEADLO CC(C)n1nccc1C[NH2+]Cc1nccs1 ZINC000279803332 385206016 /nfs/dbraw/zinc/20/60/16/385206016.db2.gz FATCTOBRSJKPMW-UHFFFAOYSA-N 1 2 236.344 2.210 20 0 BEADLO C[C@H]([NH2+]c1ccc(-n2ccnn2)cc1)C1CC1 ZINC000191453148 385305055 /nfs/dbraw/zinc/30/50/55/385305055.db2.gz SBIVLIIYIWDSHE-JTQLQIEISA-N 1 2 228.299 2.478 20 0 BEADLO Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1Cc1cnc[nH]1 ZINC000191602411 385306901 /nfs/dbraw/zinc/30/69/01/385306901.db2.gz NGLIUIBUGMIEAC-LBPRGKRZSA-N 1 2 245.330 2.087 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2ccccn2)CCO1 ZINC000131236616 385322031 /nfs/dbraw/zinc/32/20/31/385322031.db2.gz HEFIDKCLAOEYSA-CYBMUJFWSA-N 1 2 220.316 2.083 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2ccccn2)CCO1 ZINC000131236616 385322035 /nfs/dbraw/zinc/32/20/35/385322035.db2.gz HEFIDKCLAOEYSA-CYBMUJFWSA-N 1 2 220.316 2.083 20 0 BEADLO CCc1ccc(C[NH2+]C(C)(C)C(=O)OC)s1 ZINC000051718021 385259199 /nfs/dbraw/zinc/25/91/99/385259199.db2.gz FZDCKAWEYBGDHE-UHFFFAOYSA-N 1 2 241.356 2.352 20 0 BEADLO CCc1cc(N)nc(S[C@H](C)CC)[nH+]1 ZINC000330363806 385262245 /nfs/dbraw/zinc/26/22/45/385262245.db2.gz UCIBQSOGRWFILI-SSDOTTSWSA-N 1 2 211.334 2.342 20 0 BEADLO C/C=C(/C=C\C(=O)N[C@H](C)Cn1cc[nH+]c1)CC ZINC000492137209 385270955 /nfs/dbraw/zinc/27/09/55/385270955.db2.gz OKCLEINQTCERDL-VNNWHGDPSA-N 1 2 247.342 2.300 20 0 BEADLO C[N@H+](Cc1cocn1)Cc1ccccc1 ZINC000191055556 385281927 /nfs/dbraw/zinc/28/19/27/385281927.db2.gz QCISNESVLBDMSD-UHFFFAOYSA-N 1 2 202.257 2.307 20 0 BEADLO C[N@@H+](Cc1cocn1)Cc1ccccc1 ZINC000191055556 385281934 /nfs/dbraw/zinc/28/19/34/385281934.db2.gz QCISNESVLBDMSD-UHFFFAOYSA-N 1 2 202.257 2.307 20 0 BEADLO CO[C@H](C)[C@H](C)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000191902069 385332091 /nfs/dbraw/zinc/33/20/91/385332091.db2.gz IZSHKTNIOPKVEO-VHSXEESVSA-N 1 2 235.331 2.498 20 0 BEADLO CC(C)[C@H](C)C(=O)N(C)CCCn1cc[nH+]c1 ZINC000178091813 385332608 /nfs/dbraw/zinc/33/26/08/385332608.db2.gz RSWHHUJMLFXHMK-LBPRGKRZSA-N 1 2 237.347 2.024 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2cc(C)ncn2)n1 ZINC000428373803 385345179 /nfs/dbraw/zinc/34/51/79/385345179.db2.gz AMFQUSWJJMILBC-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2cc(C)ncn2)n1 ZINC000428373803 385345182 /nfs/dbraw/zinc/34/51/82/385345182.db2.gz AMFQUSWJJMILBC-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1[nH+]cccc1N[C@H]1COC(C)(C)C1 ZINC000335359479 385349176 /nfs/dbraw/zinc/34/91/76/385349176.db2.gz QZDTULWLNHVUJB-SNVBAGLBSA-N 1 2 206.289 2.369 20 0 BEADLO Nc1[nH+]cnc(NC[C@@H]2CC=CCC2)c1Cl ZINC000192287286 385349884 /nfs/dbraw/zinc/34/98/84/385349884.db2.gz MBUPDNBNOGYXKS-MRVPVSSYSA-N 1 2 238.722 2.480 20 0 BEADLO Nc1nc[nH+]c(NC[C@@H]2CC=CCC2)c1Cl ZINC000192287286 385349888 /nfs/dbraw/zinc/34/98/88/385349888.db2.gz MBUPDNBNOGYXKS-MRVPVSSYSA-N 1 2 238.722 2.480 20 0 BEADLO Cc1ccc(N[C@@H]2COC(C)(C)C2)c[nH+]1 ZINC000335357059 385350726 /nfs/dbraw/zinc/35/07/26/385350726.db2.gz MNIBATHRPQYXQJ-NSHDSACASA-N 1 2 206.289 2.369 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)CC(C)(C)C ZINC000154730468 385350958 /nfs/dbraw/zinc/35/09/58/385350958.db2.gz YBAFVBVSHYDAAR-UHFFFAOYSA-N 1 2 237.347 2.168 20 0 BEADLO C[C@@H](NC(=O)CCc1c[nH+]c[nH]1)C1CCCC1 ZINC000193265124 385389624 /nfs/dbraw/zinc/38/96/24/385389624.db2.gz JOGZNNAQEALKME-SNVBAGLBSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H](NC(=O)CCc1c[nH]c[nH+]1)C1CCCC1 ZINC000193265124 385389627 /nfs/dbraw/zinc/38/96/27/385389627.db2.gz JOGZNNAQEALKME-SNVBAGLBSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H]1CCC[C@H](C(=O)NCCCn2cc[nH+]c2)C1 ZINC000158190187 385361987 /nfs/dbraw/zinc/36/19/87/385361987.db2.gz FLCRTWCYYCZCNI-OLZOCXBDSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCO[C@H](C(C)C)C1 ZINC000335965554 385367939 /nfs/dbraw/zinc/36/79/39/385367939.db2.gz VQRGRAUGNXOEBB-ZDUSSCGKSA-N 1 2 238.331 2.148 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCO[C@H](C(C)C)C1 ZINC000335965554 385367943 /nfs/dbraw/zinc/36/79/43/385367943.db2.gz VQRGRAUGNXOEBB-ZDUSSCGKSA-N 1 2 238.331 2.148 20 0 BEADLO C[C@H](C(=O)Nc1ccc[nH+]c1N(C)C)C1CC1 ZINC000178425502 385371313 /nfs/dbraw/zinc/37/13/13/385371313.db2.gz XITJNTQWIZTUIO-VIFPVBQESA-N 1 2 233.315 2.132 20 0 BEADLO CCSCC[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000309038954 385375604 /nfs/dbraw/zinc/37/56/04/385375604.db2.gz JZBZOLSHCDVMJH-VIFPVBQESA-N 1 2 233.377 2.059 20 0 BEADLO COc1cccc(C[N@@H+]2CCO[C@@H](C)C2)c1F ZINC000192938261 385375832 /nfs/dbraw/zinc/37/58/32/385375832.db2.gz YNRFFKZOCCSRRA-JTQLQIEISA-N 1 2 239.290 2.055 20 0 BEADLO COc1cccc(C[N@H+]2CCO[C@@H](C)C2)c1F ZINC000192938261 385375836 /nfs/dbraw/zinc/37/58/36/385375836.db2.gz YNRFFKZOCCSRRA-JTQLQIEISA-N 1 2 239.290 2.055 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)CCC1CCC1 ZINC000155131929 385376503 /nfs/dbraw/zinc/37/65/03/385376503.db2.gz ZNSCXEACFAJGKS-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO Cc1ccc(N[C@H](C)[C@@H]2CCCO2)c[nH+]1 ZINC000309042653 385387755 /nfs/dbraw/zinc/38/77/55/385387755.db2.gz KXJIZOVGMYNFKP-PWSUYJOCSA-N 1 2 206.289 2.369 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)NCCC(C)(C)C ZINC000492525692 385394629 /nfs/dbraw/zinc/39/46/29/385394629.db2.gz BDVYDNKGMDAJJO-VOTSOKGWSA-N 1 2 249.358 2.469 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1c[nH]nc1C(C)C ZINC000193562086 385401486 /nfs/dbraw/zinc/40/14/86/385401486.db2.gz DHOCBFQBBLKPBR-UHFFFAOYSA-N 1 2 244.298 2.489 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[NH2+]C[C@H](C)SC ZINC000181021808 385403063 /nfs/dbraw/zinc/40/30/63/385403063.db2.gz BEMKCFWEFQKLTG-WDEREUQCSA-N 1 2 247.404 2.305 20 0 BEADLO Cc1[nH]ncc1C[NH2+]C[C@@H](C)C(F)(F)F ZINC000336765432 385409110 /nfs/dbraw/zinc/40/91/10/385409110.db2.gz RDXBHGOPLQQBBE-ZCFIWIBFSA-N 1 2 221.226 2.006 20 0 BEADLO Cc1cc[nH+]c(NC[C@H](O)C(F)F)c1Cl ZINC000309164480 385444625 /nfs/dbraw/zinc/44/46/25/385444625.db2.gz IKKFYTWURKRJCC-LURJTMIESA-N 1 2 236.649 2.081 20 0 BEADLO CC1(C)COCC[N@@H+]1Cc1cccc(F)c1N ZINC000156355536 385447450 /nfs/dbraw/zinc/44/74/50/385447450.db2.gz KSAGHMSYGCVSHS-UHFFFAOYSA-N 1 2 238.306 2.019 20 0 BEADLO CC1(C)COCC[N@H+]1Cc1cccc(F)c1N ZINC000156355536 385447452 /nfs/dbraw/zinc/44/74/52/385447452.db2.gz KSAGHMSYGCVSHS-UHFFFAOYSA-N 1 2 238.306 2.019 20 0 BEADLO FC(F)(F)[C@@H]1CCC[N@H+](Cc2cc[nH]n2)C1 ZINC000179624574 385477996 /nfs/dbraw/zinc/47/79/96/385477996.db2.gz SQMITVADXVPIME-MRVPVSSYSA-N 1 2 233.237 2.184 20 0 BEADLO FC(F)(F)[C@@H]1CCC[N@@H+](Cc2cc[nH]n2)C1 ZINC000179624574 385477999 /nfs/dbraw/zinc/47/79/99/385477999.db2.gz SQMITVADXVPIME-MRVPVSSYSA-N 1 2 233.237 2.184 20 0 BEADLO CC/C=C/CC[N@@H+]1CC(F)(F)C[C@@H]1CO ZINC000364590954 385478219 /nfs/dbraw/zinc/47/82/19/385478219.db2.gz KPWQWWHMKWZMIG-HMDXOVGESA-N 1 2 219.275 2.045 20 0 BEADLO CC/C=C/CC[N@H+]1CC(F)(F)C[C@@H]1CO ZINC000364590954 385478222 /nfs/dbraw/zinc/47/82/22/385478222.db2.gz KPWQWWHMKWZMIG-HMDXOVGESA-N 1 2 219.275 2.045 20 0 BEADLO CC[C@H](CC(=O)NCCn1cc[nH+]c1)C(C)C ZINC000171435703 385485701 /nfs/dbraw/zinc/48/57/01/385485701.db2.gz GUKNSMHNZDASAN-GFCCVEGCSA-N 1 2 237.347 2.072 20 0 BEADLO CCc1cnc(NC(=O)C=Cc2c[nH]c[nH+]2)s1 ZINC000492915806 385461760 /nfs/dbraw/zinc/46/17/60/385461760.db2.gz XYNQSVJXPLVSFF-ARJAWSKDSA-N 1 2 248.311 2.081 20 0 BEADLO Cn1ncnc1C[N@@H+]1CCC[C@H]1c1cccs1 ZINC000157405307 385499944 /nfs/dbraw/zinc/49/99/44/385499944.db2.gz YCXUPQXEFJBCNW-JTQLQIEISA-N 1 2 248.355 2.214 20 0 BEADLO Cn1ncnc1C[N@H+]1CCC[C@H]1c1cccs1 ZINC000157405307 385499949 /nfs/dbraw/zinc/49/99/49/385499949.db2.gz YCXUPQXEFJBCNW-JTQLQIEISA-N 1 2 248.355 2.214 20 0 BEADLO Cc1nc(C[N@@H+]2CCS[C@H](C)C2)oc1C ZINC000171687693 385506630 /nfs/dbraw/zinc/50/66/30/385506630.db2.gz MWNQXVJTKLHWPO-MRVPVSSYSA-N 1 2 226.345 2.229 20 0 BEADLO Cc1nc(C[N@H+]2CCS[C@H](C)C2)oc1C ZINC000171687693 385506633 /nfs/dbraw/zinc/50/66/33/385506633.db2.gz MWNQXVJTKLHWPO-MRVPVSSYSA-N 1 2 226.345 2.229 20 0 BEADLO CC(C)CCCNC(=O)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000364746331 385508763 /nfs/dbraw/zinc/50/87/63/385508763.db2.gz NKWKSGRDWOTUCE-LLVKDONJSA-N 1 2 249.358 2.382 20 0 BEADLO CC(C)CCCNC(=O)[C@@H]1CCCc2[nH]c[nH+]c21 ZINC000364746331 385508767 /nfs/dbraw/zinc/50/87/67/385508767.db2.gz NKWKSGRDWOTUCE-LLVKDONJSA-N 1 2 249.358 2.382 20 0 BEADLO CC(C)c1nc(N2C[C@H](C)O[C@@H](C)C2)cc[nH+]1 ZINC000106461746 385510141 /nfs/dbraw/zinc/51/01/41/385510141.db2.gz ALKFCTOFNHTLBN-QWRGUYRKSA-N 1 2 235.331 2.214 20 0 BEADLO C[C@]1(O)CC[N@H+](Cc2cc(F)c(F)cc2F)C1 ZINC000180199014 385511197 /nfs/dbraw/zinc/51/11/97/385511197.db2.gz XZTRWMFDNOQCBZ-LBPRGKRZSA-N 1 2 245.244 2.061 20 0 BEADLO C[C@]1(O)CC[N@@H+](Cc2cc(F)c(F)cc2F)C1 ZINC000180199014 385511199 /nfs/dbraw/zinc/51/11/99/385511199.db2.gz XZTRWMFDNOQCBZ-LBPRGKRZSA-N 1 2 245.244 2.061 20 0 BEADLO CCOCC[N@@H+]1CCO[C@H](c2cccs2)C1 ZINC000157646054 385511374 /nfs/dbraw/zinc/51/13/74/385511374.db2.gz IRACFKVZAVWOMF-NSHDSACASA-N 1 2 241.356 2.158 20 0 BEADLO CCOCC[N@H+]1CCO[C@H](c2cccs2)C1 ZINC000157646054 385511379 /nfs/dbraw/zinc/51/13/79/385511379.db2.gz IRACFKVZAVWOMF-NSHDSACASA-N 1 2 241.356 2.158 20 0 BEADLO C[C@H](CCC1CC1)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493132200 385528977 /nfs/dbraw/zinc/52/89/77/385528977.db2.gz QPMHGFWRSQGVDO-VQCYPWCPSA-N 1 2 233.315 2.118 20 0 BEADLO CC[C@H](C)C[C@H](C)NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493143375 385533059 /nfs/dbraw/zinc/53/30/59/385533059.db2.gz BCSCGJNMHODIDU-PZIAFJOJSA-N 1 2 235.331 2.364 20 0 BEADLO CC[C@H](F)CSCCn1cc[nH+]c1 ZINC000308212418 385533649 /nfs/dbraw/zinc/53/36/49/385533649.db2.gz GZYXUAZDMSDKFA-VIFPVBQESA-N 1 2 202.298 2.364 20 0 BEADLO CC(C)(CNC(=O)/C=C/c1[nH]cc[nH+]1)C1CCC1 ZINC000493154872 385538281 /nfs/dbraw/zinc/53/82/81/385538281.db2.gz OTRKCLBJXXRHCZ-VOTSOKGWSA-N 1 2 247.342 2.365 20 0 BEADLO CC(C)c1nc(C[N@H+](C)[C@@H]2CCOC2)cs1 ZINC000106883372 385539916 /nfs/dbraw/zinc/53/99/16/385539916.db2.gz IIEMOZAVMAKQDS-LLVKDONJSA-N 1 2 240.372 2.487 20 0 BEADLO CC(C)c1nc(C[N@@H+](C)[C@@H]2CCOC2)cs1 ZINC000106883372 385539919 /nfs/dbraw/zinc/53/99/19/385539919.db2.gz IIEMOZAVMAKQDS-LLVKDONJSA-N 1 2 240.372 2.487 20 0 BEADLO COC[C@@H](C)CNc1cc(C)[nH+]c(C2CC2)n1 ZINC000172014706 385541755 /nfs/dbraw/zinc/54/17/55/385541755.db2.gz VEPKXSRAUYPMAM-VIFPVBQESA-N 1 2 235.331 2.357 20 0 BEADLO CO[C@@H](C)CSc1[nH+]cc2ccccn21 ZINC000180751578 385543545 /nfs/dbraw/zinc/54/35/45/385543545.db2.gz LXAKXLONDLDDJM-VIFPVBQESA-N 1 2 222.313 2.461 20 0 BEADLO c1cc(N2CC(C3CC3)C2)nc(C2CC2)[nH+]1 ZINC000643170167 385547277 /nfs/dbraw/zinc/54/72/77/385547277.db2.gz CMSULBYXAAJYJS-UHFFFAOYSA-N 1 2 215.300 2.200 20 0 BEADLO c1csc([C@H]2CN(Cc3[nH]cc[nH+]3)CCO2)c1 ZINC000157746742 385520007 /nfs/dbraw/zinc/52/00/07/385520007.db2.gz QQIGDZGLTCZGJY-SNVBAGLBSA-N 1 2 249.339 2.045 20 0 BEADLO CC[C@](C)(O)CNc1nc(C)[nH+]c2c1CCCC2 ZINC000180432590 385522398 /nfs/dbraw/zinc/52/23/98/385522398.db2.gz KJKXNIJYAVYMCC-AWEZNQCLSA-N 1 2 249.358 2.237 20 0 BEADLO Cc1cnc(C[N@@H+]2CCOC3(CCC3)C2)s1 ZINC000180849939 385550331 /nfs/dbraw/zinc/55/03/31/385550331.db2.gz ZKVXRDUFZLSWLK-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO Cc1cnc(C[N@H+]2CCOC3(CCC3)C2)s1 ZINC000180849939 385550334 /nfs/dbraw/zinc/55/03/34/385550334.db2.gz ZKVXRDUFZLSWLK-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)CCc1ccccn1 ZINC000107285181 385562854 /nfs/dbraw/zinc/56/28/54/385562854.db2.gz GQEPVIGQHLYUEQ-UHFFFAOYSA-N 1 2 241.294 2.356 20 0 BEADLO Cc1nc(C[NH2+][C@@H](C)c2ccccc2)no1 ZINC000181355901 385572644 /nfs/dbraw/zinc/57/26/44/385572644.db2.gz ZRWDWXVRPOKGJQ-VIFPVBQESA-N 1 2 217.272 2.229 20 0 BEADLO CC(=O)Nc1ccc(C[NH2+]CC(C)(F)F)cc1 ZINC000645195303 385595699 /nfs/dbraw/zinc/59/56/99/385595699.db2.gz GZFFLRCHNNAAGH-UHFFFAOYSA-N 1 2 242.269 2.390 20 0 BEADLO c1ccc(NC[C@H]2Cc3ccccc3O2)[nH+]c1 ZINC000037998899 385597926 /nfs/dbraw/zinc/59/79/26/385597926.db2.gz PMOYKYWAPMFROA-GFCCVEGCSA-N 1 2 226.279 2.497 20 0 BEADLO CC(C)c1noc(C[NH2+][C@@H](C)c2cccnc2)n1 ZINC000181632306 385590380 /nfs/dbraw/zinc/59/03/80/385590380.db2.gz WSRKPCKBPYQPNN-JTQLQIEISA-N 1 2 246.314 2.439 20 0 BEADLO C[N@H+](Cc1nccs1)[C@@H](CO)c1ccccc1 ZINC000269672143 385623312 /nfs/dbraw/zinc/62/33/12/385623312.db2.gz ASDCVTBMFFIAPS-LBPRGKRZSA-N 1 2 248.351 2.309 20 0 BEADLO C[N@@H+](Cc1nccs1)[C@@H](CO)c1ccccc1 ZINC000269672143 385623314 /nfs/dbraw/zinc/62/33/14/385623314.db2.gz ASDCVTBMFFIAPS-LBPRGKRZSA-N 1 2 248.351 2.309 20 0 BEADLO c1c(C[NH2+]Cc2ccccn2)nc2ccccn12 ZINC000020054057 385630066 /nfs/dbraw/zinc/63/00/66/385630066.db2.gz UBLIQNPJGBJEFV-UHFFFAOYSA-N 1 2 238.294 2.019 20 0 BEADLO CCCC[NH2+][C@H](Cc1ccc(C)cc1)C(=O)OC ZINC000281039807 385631029 /nfs/dbraw/zinc/63/10/29/385631029.db2.gz RDFJTSZYUPNIHB-CQSZACIVSA-N 1 2 249.354 2.469 20 0 BEADLO CC1CCC(N(C)C(=O)/C=C/c2[nH]cc[nH+]2)CC1 ZINC000493750025 385613110 /nfs/dbraw/zinc/61/31/10/385613110.db2.gz TUNOBZZGJRVEGR-BQYQJAHWSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@H]1OCC[C@H]1Sc1[nH+]cnc2[nH]ccc21 ZINC000269905198 385644080 /nfs/dbraw/zinc/64/40/80/385644080.db2.gz GQYRUFLQRIVTSY-VXNVDRBHSA-N 1 2 235.312 2.227 20 0 BEADLO Cc1cc(C)nc(NCCc2cc[nH+]cc2C)n1 ZINC000269920940 385649038 /nfs/dbraw/zinc/64/90/38/385649038.db2.gz AUWOSEZVHPUNPH-UHFFFAOYSA-N 1 2 242.326 2.451 20 0 BEADLO Cc1ccnc(NCCc2cc[nH+]cc2C)n1 ZINC000269972811 385654837 /nfs/dbraw/zinc/65/48/37/385654837.db2.gz LKDCZWDQXHHRTD-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO CC[C@]1(C)COCC[N@@H+]1Cc1ncc(C)s1 ZINC000336519122 385657730 /nfs/dbraw/zinc/65/77/30/385657730.db2.gz SDNFWNLLZYQCID-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO CC[C@]1(C)COCC[N@H+]1Cc1ncc(C)s1 ZINC000336519122 385657736 /nfs/dbraw/zinc/65/77/36/385657736.db2.gz SDNFWNLLZYQCID-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nc3ccccc3c(=O)[nH]2)[C@@H]1C ZINC000645218195 385678797 /nfs/dbraw/zinc/67/87/97/385678797.db2.gz VUUUPYGKVAPLFF-NXEZZACHSA-N 1 2 243.310 2.176 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nc3ccccc3c(=O)[nH]2)[C@@H]1C ZINC000645218195 385678803 /nfs/dbraw/zinc/67/88/03/385678803.db2.gz VUUUPYGKVAPLFF-NXEZZACHSA-N 1 2 243.310 2.176 20 0 BEADLO C[C@H]1C[N@H+](Cc2nc3ccccc3c(=O)[nH]2)[C@H]1C ZINC000645218196 385679743 /nfs/dbraw/zinc/67/97/43/385679743.db2.gz VUUUPYGKVAPLFF-UWVGGRQHSA-N 1 2 243.310 2.176 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nc3ccccc3c(=O)[nH]2)[C@H]1C ZINC000645218196 385679748 /nfs/dbraw/zinc/67/97/48/385679748.db2.gz VUUUPYGKVAPLFF-UWVGGRQHSA-N 1 2 243.310 2.176 20 0 BEADLO C[C@@H](CO)CCCNc1cc[nH+]c2ccncc12 ZINC000270286214 385694469 /nfs/dbraw/zinc/69/44/69/385694469.db2.gz NEKTZWBNVZEIOX-LLVKDONJSA-N 1 2 245.326 2.450 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]CC(F)(F)CO)s1 ZINC000184699725 385696434 /nfs/dbraw/zinc/69/64/34/385696434.db2.gz XYKUZEQVJCSPQS-QMMMGPOBSA-N 1 2 235.299 2.335 20 0 BEADLO CC(C)(C)C1=CC[N@H+](Cc2nccc(N)n2)CC1 ZINC000270395948 385703781 /nfs/dbraw/zinc/70/37/81/385703781.db2.gz UHHALDANWBDMCJ-UHFFFAOYSA-N 1 2 246.358 2.237 20 0 BEADLO CC(C)(C)C1=CC[N@@H+](Cc2nccc(N)n2)CC1 ZINC000270395948 385703784 /nfs/dbraw/zinc/70/37/84/385703784.db2.gz UHHALDANWBDMCJ-UHFFFAOYSA-N 1 2 246.358 2.237 20 0 BEADLO COCC[C@H](C)SCCn1cc[nH+]c1 ZINC000270506832 385712725 /nfs/dbraw/zinc/71/27/25/385712725.db2.gz NVYQIEGYRAZGIJ-JTQLQIEISA-N 1 2 214.334 2.041 20 0 BEADLO FC(F)(F)[C@H]([NH2+]C[C@H]1CCCOC1)C1CC1 ZINC000309531403 385666395 /nfs/dbraw/zinc/66/63/95/385666395.db2.gz DCIRCQLVFKEQDU-PSASIEDQSA-N 1 2 237.265 2.344 20 0 BEADLO c1cn(CCCN2CCOc3ccccc32)c[nH+]1 ZINC000183161480 385737706 /nfs/dbraw/zinc/73/77/06/385737706.db2.gz NSHKFGBVDCAPLP-UHFFFAOYSA-N 1 2 243.310 2.172 20 0 BEADLO CCN(CC(C)(C)O)c1cc[nH+]c2ccncc21 ZINC000270780948 385744720 /nfs/dbraw/zinc/74/47/20/385744720.db2.gz OSUGZFDNWDUGRP-UHFFFAOYSA-N 1 2 245.326 2.227 20 0 BEADLO CS[C@H](CNc1cc(C)[nH+]cn1)C(C)(C)C ZINC000336696682 385746638 /nfs/dbraw/zinc/74/66/38/385746638.db2.gz LYGVIWASYFWECJ-SNVBAGLBSA-N 1 2 239.388 2.397 20 0 BEADLO Cc1cnc(NCCc2cc[nH+]cc2C)nc1C ZINC000270815617 385748100 /nfs/dbraw/zinc/74/81/00/385748100.db2.gz XJYPDELIZLVVCE-UHFFFAOYSA-N 1 2 242.326 2.451 20 0 BEADLO Cc1n[nH]c(C)c1C[N@@H+]1CCn2cccc2[C@H]1C ZINC000270988245 385767097 /nfs/dbraw/zinc/76/70/97/385767097.db2.gz GLMCAHXMPBTDRL-GFCCVEGCSA-N 1 2 244.342 2.405 20 0 BEADLO Cc1n[nH]c(C)c1C[N@H+]1CCn2cccc2[C@H]1C ZINC000270988245 385767100 /nfs/dbraw/zinc/76/71/00/385767100.db2.gz GLMCAHXMPBTDRL-GFCCVEGCSA-N 1 2 244.342 2.405 20 0 BEADLO CC[C@@H](C)Nc1nc(N(C)C)nc(C(C)C)[nH+]1 ZINC000271003030 385769012 /nfs/dbraw/zinc/76/90/12/385769012.db2.gz YQLIKUBBTVOLML-SECBINFHSA-N 1 2 237.351 2.271 20 0 BEADLO CC[C@@H](C)Nc1nc(C(C)C)[nH+]c(N(C)C)n1 ZINC000271003030 385769019 /nfs/dbraw/zinc/76/90/19/385769019.db2.gz YQLIKUBBTVOLML-SECBINFHSA-N 1 2 237.351 2.271 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CC(C)(C)[C@@H]1C(C)C ZINC000293957821 385774924 /nfs/dbraw/zinc/77/49/24/385774924.db2.gz PMGIMBSGEPATQW-ZDUSSCGKSA-N 1 2 249.358 2.154 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@@H](C)C2)cc1F ZINC000271045502 385775685 /nfs/dbraw/zinc/77/56/85/385775685.db2.gz PYFDKSWRQVTAQP-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@@H](C)C2)cc1F ZINC000271045502 385775689 /nfs/dbraw/zinc/77/56/89/385775689.db2.gz PYFDKSWRQVTAQP-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO CO[C@@H]1CCCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000270588878 385720093 /nfs/dbraw/zinc/72/00/93/385720093.db2.gz SERRHDRANYYKLU-SNVBAGLBSA-N 1 2 231.299 2.178 20 0 BEADLO COC[C@@H]1CCCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000270601427 385721217 /nfs/dbraw/zinc/72/12/17/385721217.db2.gz VXVYJILJXPZLIC-LLVKDONJSA-N 1 2 245.326 2.426 20 0 BEADLO CO[C@H]1CCCN(c2[nH+]c3ccccc3n2C)C1 ZINC000270600292 385723083 /nfs/dbraw/zinc/72/30/83/385723083.db2.gz VTFZYWUTHPGZMD-NSHDSACASA-N 1 2 245.326 2.189 20 0 BEADLO CCOC(=O)c1coc(C[NH2+]Cc2ccoc2)c1 ZINC000354157936 385799649 /nfs/dbraw/zinc/79/96/49/385799649.db2.gz LOBLFPVTISUCPY-UHFFFAOYSA-N 1 2 249.266 2.339 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)NCC1CCCCC1 ZINC000283168967 385812135 /nfs/dbraw/zinc/81/21/35/385812135.db2.gz DBCBVLSMBUUFDM-VOTSOKGWSA-N 1 2 233.315 2.119 20 0 BEADLO COC(=O)[C@H](Cc1ccccc1)[NH2+]C[C@H]1C[C@@H]1C ZINC000488526162 385816694 /nfs/dbraw/zinc/81/66/94/385816694.db2.gz FGPJWIBQVHUJAW-YUTCNCBUSA-N 1 2 247.338 2.016 20 0 BEADLO CC(C)CCCC(=O)N1CCn2c[nH+]cc2C1 ZINC000451868262 385817541 /nfs/dbraw/zinc/81/75/41/385817541.db2.gz PEQVNVZPFWRWIX-UHFFFAOYSA-N 1 2 235.331 2.052 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2ccc(C)o2)nn1 ZINC000283460744 385820717 /nfs/dbraw/zinc/82/07/17/385820717.db2.gz HYJKLJZFCWSSKX-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2ccc(C)o2)nn1 ZINC000283460744 385820722 /nfs/dbraw/zinc/82/07/22/385820722.db2.gz HYJKLJZFCWSSKX-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO CC[C@H](CSC)N(C)c1cc[nH+]c(C)n1 ZINC000271362206 385821532 /nfs/dbraw/zinc/82/15/32/385821532.db2.gz JBXYJQIJARJTGA-SNVBAGLBSA-N 1 2 225.361 2.363 20 0 BEADLO C[C@@H]1C[C@H](Nc2cc[nH+]c(C3CC3)n2)CCO1 ZINC000271377072 385822858 /nfs/dbraw/zinc/82/28/58/385822858.db2.gz JMJAXEQXMYQLRF-MWLCHTKSSA-N 1 2 233.315 2.333 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1ccsc1C ZINC000294500379 385857916 /nfs/dbraw/zinc/85/79/16/385857916.db2.gz BMNXDKPOVYXNFR-MRVPVSSYSA-N 1 2 227.329 2.050 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1ccsc1C ZINC000294500379 385857918 /nfs/dbraw/zinc/85/79/18/385857918.db2.gz BMNXDKPOVYXNFR-MRVPVSSYSA-N 1 2 227.329 2.050 20 0 BEADLO C[C@@H](F)CCNc1cc(NC2CC2)nc[nH+]1 ZINC000413291134 385833731 /nfs/dbraw/zinc/83/37/31/385833731.db2.gz DCAOTYGSIFGOIQ-MRVPVSSYSA-N 1 2 224.283 2.211 20 0 BEADLO C[C@@H](F)CCNc1cc(NC2CC2)[nH+]cn1 ZINC000413291134 385833735 /nfs/dbraw/zinc/83/37/35/385833735.db2.gz DCAOTYGSIFGOIQ-MRVPVSSYSA-N 1 2 224.283 2.211 20 0 BEADLO c1ccc2[nH+]c(N3CCO[C@@H]4CCC[C@@H]43)[nH]c2c1 ZINC000271571076 385838090 /nfs/dbraw/zinc/83/80/90/385838090.db2.gz BTYOZWAZKOODNE-QWHCGFSZSA-N 1 2 243.310 2.321 20 0 BEADLO CCCC[C@@](C)(CO)Nc1cc(C)[nH+]cn1 ZINC000645343591 385842527 /nfs/dbraw/zinc/84/25/27/385842527.db2.gz FRYJNXDQQQLWNM-LBPRGKRZSA-N 1 2 223.320 2.138 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](CCO)c2ccccc2)o1 ZINC000271737924 385848380 /nfs/dbraw/zinc/84/83/80/385848380.db2.gz ZXOLIAIDRJPEGK-ZDUSSCGKSA-N 1 2 246.310 2.196 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@H]3C[C@H]32)cc1F ZINC000644837081 385849227 /nfs/dbraw/zinc/84/92/27/385849227.db2.gz HJVKGMSEZVCHKE-OLZOCXBDSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@H]3C[C@H]32)cc1F ZINC000644837081 385849232 /nfs/dbraw/zinc/84/92/32/385849232.db2.gz HJVKGMSEZVCHKE-OLZOCXBDSA-N 1 2 221.275 2.107 20 0 BEADLO CC(C)[C@H]1CCCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000284142356 385853894 /nfs/dbraw/zinc/85/38/94/385853894.db2.gz WANXOHOECJZVMK-KTRBRXNASA-N 1 2 247.342 2.460 20 0 BEADLO Cc1cn[nH]c1C[N@@H+](C)[C@H](C)c1ccncc1 ZINC000284139500 385853925 /nfs/dbraw/zinc/85/39/25/385853925.db2.gz QAHSYLZPPRMNCP-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO Cc1cn[nH]c1C[N@H+](C)[C@H](C)c1ccncc1 ZINC000284139500 385853928 /nfs/dbraw/zinc/85/39/28/385853928.db2.gz QAHSYLZPPRMNCP-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO Cc1c[nH]nc1C[N@@H+](C)[C@H](C)c1ccncc1 ZINC000284139500 385853930 /nfs/dbraw/zinc/85/39/30/385853930.db2.gz QAHSYLZPPRMNCP-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO Cc1c[nH]nc1C[N@H+](C)[C@H](C)c1ccncc1 ZINC000284139500 385853932 /nfs/dbraw/zinc/85/39/32/385853932.db2.gz QAHSYLZPPRMNCP-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO COCc1ccc(C[N@@H+]2CCOCC2(C)C)o1 ZINC000271138483 385793846 /nfs/dbraw/zinc/79/38/46/385793846.db2.gz NYFFQECDWJIJEG-UHFFFAOYSA-N 1 2 239.315 2.037 20 0 BEADLO COCc1ccc(C[N@H+]2CCOCC2(C)C)o1 ZINC000271138483 385793849 /nfs/dbraw/zinc/79/38/49/385793849.db2.gz NYFFQECDWJIJEG-UHFFFAOYSA-N 1 2 239.315 2.037 20 0 BEADLO Cc1ccc(NCc2cnc(C)nc2)c[nH+]1 ZINC000309700004 385794371 /nfs/dbraw/zinc/79/43/71/385794371.db2.gz MIQOHFJQBOGQCG-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO CC[C@H]1CC[N@@H+]1Cc1cn2cccc(F)c2n1 ZINC000644843665 385883925 /nfs/dbraw/zinc/88/39/25/385883925.db2.gz MFQNPJQXZHLEFG-NSHDSACASA-N 1 2 233.290 2.458 20 0 BEADLO CC[C@H]1CC[N@H+]1Cc1cn2cccc(F)c2n1 ZINC000644843665 385883929 /nfs/dbraw/zinc/88/39/29/385883929.db2.gz MFQNPJQXZHLEFG-NSHDSACASA-N 1 2 233.290 2.458 20 0 BEADLO CC1(C)C[C@H]1[NH2+][C@H](c1cccs1)c1nnc[nH]1 ZINC000294697048 385884256 /nfs/dbraw/zinc/88/42/56/385884256.db2.gz IVIQRBJKLDKJPQ-NXEZZACHSA-N 1 2 248.355 2.344 20 0 BEADLO O=C1OCC[C@@H]1[N@@H+]1CCC=C(c2ccccc2)C1 ZINC000284746635 385884626 /nfs/dbraw/zinc/88/46/26/385884626.db2.gz LEQKQFGLLFPJJG-AWEZNQCLSA-N 1 2 243.306 2.091 20 0 BEADLO O=C1OCC[C@@H]1[N@H+]1CCC=C(c2ccccc2)C1 ZINC000284746635 385884631 /nfs/dbraw/zinc/88/46/31/385884631.db2.gz LEQKQFGLLFPJJG-AWEZNQCLSA-N 1 2 243.306 2.091 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCc1ccccc1F ZINC000647848914 385898939 /nfs/dbraw/zinc/89/89/39/385898939.db2.gz ZMOGMAWCYWSRMH-UHFFFAOYSA-N 1 2 245.301 2.309 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)CCCC(C)C ZINC000294811619 385899359 /nfs/dbraw/zinc/89/93/59/385899359.db2.gz CBKUASFXASILFT-UHFFFAOYSA-N 1 2 223.320 2.161 20 0 BEADLO c1cc2c(nc[nH+]c2S[C@H]2CCCOC2)[nH]1 ZINC000272402300 385899805 /nfs/dbraw/zinc/89/98/05/385899805.db2.gz BDJQLZDQTCESAL-QMMMGPOBSA-N 1 2 235.312 2.229 20 0 BEADLO COC[C@H]1CCCCN(c2cc(C)[nH+]cn2)C1 ZINC000342016124 385910563 /nfs/dbraw/zinc/91/05/63/385910563.db2.gz HXTKGGDVCCQDRU-LBPRGKRZSA-N 1 2 235.331 2.038 20 0 BEADLO CC[C@@H](C)[C@H](C)C(=O)NCCNc1cccc[nH+]1 ZINC000272579115 385914920 /nfs/dbraw/zinc/91/49/20/385914920.db2.gz OAWWRXDGGSSJCZ-NEPJUHHUSA-N 1 2 249.358 2.292 20 0 BEADLO CC[C@@H](C(=O)OC)[N@@H+]1CCC=C(c2ccco2)C1 ZINC000285365033 385918110 /nfs/dbraw/zinc/91/81/10/385918110.db2.gz QNOHSSMTUHKQNP-LBPRGKRZSA-N 1 2 249.310 2.320 20 0 BEADLO CC[C@@H](C(=O)OC)[N@H+]1CCC=C(c2ccco2)C1 ZINC000285365033 385918111 /nfs/dbraw/zinc/91/81/11/385918111.db2.gz QNOHSSMTUHKQNP-LBPRGKRZSA-N 1 2 249.310 2.320 20 0 BEADLO Cc1nocc1C[N@@H+]1CCn2cccc2[C@H]1C ZINC000294953357 385924849 /nfs/dbraw/zinc/92/48/49/385924849.db2.gz QFQMHXFWQZMAAV-LLVKDONJSA-N 1 2 231.299 2.361 20 0 BEADLO Cc1nocc1C[N@H+]1CCn2cccc2[C@H]1C ZINC000294953357 385924854 /nfs/dbraw/zinc/92/48/54/385924854.db2.gz QFQMHXFWQZMAAV-LLVKDONJSA-N 1 2 231.299 2.361 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N)[nH+]c1 ZINC000335036460 385925982 /nfs/dbraw/zinc/92/59/82/385925982.db2.gz DTHKVBYYIMVQPZ-KOLCDFICSA-N 1 2 233.315 2.259 20 0 BEADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1cocn1)CCO2 ZINC000271994032 385865676 /nfs/dbraw/zinc/86/56/76/385865676.db2.gz HJLGGNLLGYYNSS-GFCCVEGCSA-N 1 2 248.257 2.427 20 0 BEADLO COc1nccnc1C[N@H+](C)[C@H](C)c1ccco1 ZINC000294582488 385870656 /nfs/dbraw/zinc/87/06/56/385870656.db2.gz QHBQKBLFHXYTOM-SNVBAGLBSA-N 1 2 247.298 2.271 20 0 BEADLO COc1nccnc1C[N@@H+](C)[C@H](C)c1ccco1 ZINC000294582488 385870660 /nfs/dbraw/zinc/87/06/60/385870660.db2.gz QHBQKBLFHXYTOM-SNVBAGLBSA-N 1 2 247.298 2.271 20 0 BEADLO COc1nccc(C[N@H+](C)[C@H](C)c2ccco2)n1 ZINC000294622676 385876041 /nfs/dbraw/zinc/87/60/41/385876041.db2.gz YSROFGFRSIETEK-SNVBAGLBSA-N 1 2 247.298 2.271 20 0 BEADLO COc1nccc(C[N@@H+](C)[C@H](C)c2ccco2)n1 ZINC000294622676 385876045 /nfs/dbraw/zinc/87/60/45/385876045.db2.gz YSROFGFRSIETEK-SNVBAGLBSA-N 1 2 247.298 2.271 20 0 BEADLO CCC1(CNC(=O)C=Cc2c[nH]c[nH+]2)CCC1 ZINC000284534446 385876118 /nfs/dbraw/zinc/87/61/18/385876118.db2.gz WYPMGMCFEYKINP-SNAWJCMRSA-N 1 2 233.315 2.119 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cnccn1)c1ccncc1F ZINC000338006947 385877975 /nfs/dbraw/zinc/87/79/75/385877975.db2.gz DSGJMVVHSVJPNA-ZJUUUORDSA-N 1 2 246.289 2.423 20 0 BEADLO COC(=O)[C@H](C)[N@@H+]1CCC=C(c2ccccc2)C1 ZINC000284733803 385882362 /nfs/dbraw/zinc/88/23/62/385882362.db2.gz KHKVQMFVYLJJKY-LBPRGKRZSA-N 1 2 245.322 2.337 20 0 BEADLO COC(=O)[C@H](C)[N@H+]1CCC=C(c2ccccc2)C1 ZINC000284733803 385882366 /nfs/dbraw/zinc/88/23/66/385882366.db2.gz KHKVQMFVYLJJKY-LBPRGKRZSA-N 1 2 245.322 2.337 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+]2CC[C@@](C)(F)C2)o1 ZINC000334891209 385978884 /nfs/dbraw/zinc/97/88/84/385978884.db2.gz SRRLDNAKOTVEGU-MWLCHTKSSA-N 1 2 212.268 2.478 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+]2CC[C@@](C)(F)C2)o1 ZINC000334891209 385978892 /nfs/dbraw/zinc/97/88/92/385978892.db2.gz SRRLDNAKOTVEGU-MWLCHTKSSA-N 1 2 212.268 2.478 20 0 BEADLO Cc1cc[nH+]c(NC[C@@H](C)CCO)c1Cl ZINC000336748364 385985953 /nfs/dbraw/zinc/98/59/53/385985953.db2.gz DJBCXSLTGAIOMX-QMMMGPOBSA-N 1 2 228.723 2.474 20 0 BEADLO COC[C@H]([NH2+]Cc1ccno1)c1ccc(C)o1 ZINC000273335084 385990100 /nfs/dbraw/zinc/99/01/00/385990100.db2.gz DAKULQWKBPRYQY-NSHDSACASA-N 1 2 236.271 2.053 20 0 BEADLO C[C@@H](CCO)CCNc1cc[nH+]c2ccncc12 ZINC000294993300 385937854 /nfs/dbraw/zinc/93/78/54/385937854.db2.gz QWENCVVEPUVACA-LLVKDONJSA-N 1 2 245.326 2.450 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccn(C)n1)c1ccco1 ZINC000414063778 385938491 /nfs/dbraw/zinc/93/84/91/385938491.db2.gz MUQVEJAHXPIZDM-VHSXEESVSA-N 1 2 219.288 2.425 20 0 BEADLO CC(C)(C)[C@@H](CO)Nc1cc[nH+]c(C2CC2)n1 ZINC000272856872 385941411 /nfs/dbraw/zinc/94/14/11/385941411.db2.gz HXZUNUHOMOHHMH-SNVBAGLBSA-N 1 2 235.331 2.173 20 0 BEADLO Cc1ccc(O)c(C[N@@H+]2CCC=C(F)C2)n1 ZINC000272853288 385943093 /nfs/dbraw/zinc/94/30/93/385943093.db2.gz SYAHUYQIJKQWLL-UHFFFAOYSA-N 1 2 222.263 2.155 20 0 BEADLO Cc1ccc(O)c(C[N@H+]2CCC=C(F)C2)n1 ZINC000272853288 385943099 /nfs/dbraw/zinc/94/30/99/385943099.db2.gz SYAHUYQIJKQWLL-UHFFFAOYSA-N 1 2 222.263 2.155 20 0 BEADLO CO[C@@H](C)CCC(=O)Nc1cccc2[nH+]ccn21 ZINC000272885923 385946514 /nfs/dbraw/zinc/94/65/14/385946514.db2.gz IHZFGQGDXZUURH-JTQLQIEISA-N 1 2 247.298 2.088 20 0 BEADLO C[C@H]1COc2ccccc2C[N@@H+]1Cc1ccno1 ZINC000272915284 385950685 /nfs/dbraw/zinc/95/06/85/385950685.db2.gz IDDBXPHSNUFOGE-NSHDSACASA-N 1 2 244.294 2.458 20 0 BEADLO C[C@H]1COc2ccccc2C[N@H+]1Cc1ccno1 ZINC000272915284 385950692 /nfs/dbraw/zinc/95/06/92/385950692.db2.gz IDDBXPHSNUFOGE-NSHDSACASA-N 1 2 244.294 2.458 20 0 BEADLO C[C@@H](CCO)CCNc1cc[nH+]c(C2CC2)n1 ZINC000295041486 385951041 /nfs/dbraw/zinc/95/10/41/385951041.db2.gz XBZMPLVDQIVJHN-SNVBAGLBSA-N 1 2 235.331 2.175 20 0 BEADLO Cc1ccc(NC(=O)[C@@]2(C)CCCOC2)c(C)[nH+]1 ZINC000272946457 385954795 /nfs/dbraw/zinc/95/47/95/385954795.db2.gz LEWBNMZBBPFKLI-AWEZNQCLSA-N 1 2 248.326 2.454 20 0 BEADLO CO[C@H](C)C[N@H+](C)Cc1ncc(C2CC2)o1 ZINC000272969013 385957453 /nfs/dbraw/zinc/95/74/53/385957453.db2.gz OQNZRJUEXPEHSL-SECBINFHSA-N 1 2 224.304 2.019 20 0 BEADLO CO[C@H](C)C[N@@H+](C)Cc1ncc(C2CC2)o1 ZINC000272969013 385957459 /nfs/dbraw/zinc/95/74/59/385957459.db2.gz OQNZRJUEXPEHSL-SECBINFHSA-N 1 2 224.304 2.019 20 0 BEADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1cnc[nH]1 ZINC000285732949 385959693 /nfs/dbraw/zinc/95/96/93/385959693.db2.gz QUDSYSCGMTVAPE-UHFFFAOYSA-N 1 2 234.303 2.039 20 0 BEADLO Cc1cc(C)c(CNC(=O)c2cncs2)c[nH+]1 ZINC000335059213 385960742 /nfs/dbraw/zinc/96/07/42/385960742.db2.gz RTWKTNBPBIFENO-UHFFFAOYSA-N 1 2 247.323 2.085 20 0 BEADLO CC[C@H](F)C[N@@H+]1CCCC[C@@H]1c1nnc(C)[nH]1 ZINC000338332704 385963415 /nfs/dbraw/zinc/96/34/15/385963415.db2.gz MHMAYPNWUBEKGX-WDEREUQCSA-N 1 2 240.326 2.388 20 0 BEADLO CC[C@H](F)C[N@H+]1CCCC[C@@H]1c1nnc(C)[nH]1 ZINC000338332704 385963420 /nfs/dbraw/zinc/96/34/20/385963420.db2.gz MHMAYPNWUBEKGX-WDEREUQCSA-N 1 2 240.326 2.388 20 0 BEADLO CO[C@H](C[N@H+](CC(F)F)C1CC1)C1CC1 ZINC000425401608 385964545 /nfs/dbraw/zinc/96/45/45/385964545.db2.gz HDUJHCZQOXXMTH-SNVBAGLBSA-N 1 2 219.275 2.141 20 0 BEADLO CO[C@H](C[N@@H+](CC(F)F)C1CC1)C1CC1 ZINC000425401608 385964553 /nfs/dbraw/zinc/96/45/53/385964553.db2.gz HDUJHCZQOXXMTH-SNVBAGLBSA-N 1 2 219.275 2.141 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)C[C@@H]1CCCC(F)(F)C1 ZINC000338318616 385965854 /nfs/dbraw/zinc/96/58/54/385965854.db2.gz SBLACHVTBBEJNU-SECBINFHSA-N 1 2 244.289 2.062 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)C[C@@H]1CCCC(F)(F)C1 ZINC000338318616 385965857 /nfs/dbraw/zinc/96/58/57/385965857.db2.gz SBLACHVTBBEJNU-SECBINFHSA-N 1 2 244.289 2.062 20 0 BEADLO C[C@H](C(=O)NC(C)(C)C)[N@H+](C)Cc1ccoc1 ZINC000342647785 385972986 /nfs/dbraw/zinc/97/29/86/385972986.db2.gz UPUXAEIEBBYXEY-SNVBAGLBSA-N 1 2 238.331 2.015 20 0 BEADLO C[C@H](C(=O)NC(C)(C)C)[N@@H+](C)Cc1ccoc1 ZINC000342647785 385972994 /nfs/dbraw/zinc/97/29/94/385972994.db2.gz UPUXAEIEBBYXEY-SNVBAGLBSA-N 1 2 238.331 2.015 20 0 BEADLO O=C([C@@H]1C[C@H]1C1CC1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000345066218 386001291 /nfs/dbraw/zinc/00/12/91/386001291.db2.gz VRPCSDCFIUMRBD-TUAOUCFPSA-N 1 2 245.326 2.119 20 0 BEADLO CO[C@@H](C)CN(C)c1cc(C)[nH+]c(C2CC2)n1 ZINC000286210171 386007528 /nfs/dbraw/zinc/00/75/28/386007528.db2.gz BEYVWMZAOIWQBR-JTQLQIEISA-N 1 2 235.331 2.134 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@H]1CCC[C@H]1c1ccccc1 ZINC000353176364 386008705 /nfs/dbraw/zinc/00/87/05/386008705.db2.gz TXFCNABDHJUTLC-UBHSHLNASA-N 1 2 247.338 2.474 20 0 BEADLO CCC[N@@H+]1CC(=O)N[C@]12CCC[C@@H](C1CC1)C2 ZINC000414177191 386019589 /nfs/dbraw/zinc/01/95/89/386019589.db2.gz FRMWHXZFEVWJMS-TZMCWYRMSA-N 1 2 236.359 2.125 20 0 BEADLO CCC[N@H+]1CC(=O)N[C@]12CCC[C@@H](C1CC1)C2 ZINC000414177191 386019596 /nfs/dbraw/zinc/01/95/96/386019596.db2.gz FRMWHXZFEVWJMS-TZMCWYRMSA-N 1 2 236.359 2.125 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2CC[C@H](C)[C@H](C)C2)n1 ZINC000414636383 386019755 /nfs/dbraw/zinc/01/97/55/386019755.db2.gz AFTCKDRHBVQZMU-IVZWLZJFSA-N 1 2 223.320 2.329 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2CC[C@@H](C)[C@@H](C)C2)n1 ZINC000414636384 386020026 /nfs/dbraw/zinc/02/00/26/386020026.db2.gz AFTCKDRHBVQZMU-KXUCPTDWSA-N 1 2 223.320 2.329 20 0 BEADLO CCC[N@@H+]1CC(=O)N[C@@]12CCC[C@@H](C1CC1)C2 ZINC000414177189 386021222 /nfs/dbraw/zinc/02/12/22/386021222.db2.gz FRMWHXZFEVWJMS-OCCSQVGLSA-N 1 2 236.359 2.125 20 0 BEADLO CCC[N@H+]1CC(=O)N[C@@]12CCC[C@@H](C1CC1)C2 ZINC000414177189 386021225 /nfs/dbraw/zinc/02/12/25/386021225.db2.gz FRMWHXZFEVWJMS-OCCSQVGLSA-N 1 2 236.359 2.125 20 0 BEADLO CSc1ccccc1[C@@H](C)[NH2+]Cc1cnn[nH]1 ZINC000295424451 386029176 /nfs/dbraw/zinc/02/91/76/386029176.db2.gz UKLWLXLWTVDROB-SECBINFHSA-N 1 2 248.355 2.377 20 0 BEADLO CO[C@@H](C)CN(C)c1nc(C)[nH+]c2c1CCCC2 ZINC000286374098 386032012 /nfs/dbraw/zinc/03/20/12/386032012.db2.gz LPFSFOSAUXPOAN-JTQLQIEISA-N 1 2 249.358 2.135 20 0 BEADLO O=C(CC[N@H+](C1CC1)C1COC1)c1ccccc1 ZINC000295482656 386039393 /nfs/dbraw/zinc/03/93/93/386039393.db2.gz RLPILAUZADRVFK-UHFFFAOYSA-N 1 2 245.322 2.123 20 0 BEADLO O=C(CC[N@@H+](C1CC1)C1COC1)c1ccccc1 ZINC000295482656 386039399 /nfs/dbraw/zinc/03/93/99/386039399.db2.gz RLPILAUZADRVFK-UHFFFAOYSA-N 1 2 245.322 2.123 20 0 BEADLO CCC1(C)CC[NH+](Cc2noc(C)n2)CC1 ZINC000335925778 386044686 /nfs/dbraw/zinc/04/46/86/386044686.db2.gz DQFRTFGLEBHMDP-UHFFFAOYSA-N 1 2 223.320 2.390 20 0 BEADLO Cc1cc(CNC(=O)C2=CCCC2)cc(C)[nH+]1 ZINC000335076423 386044598 /nfs/dbraw/zinc/04/45/98/386044598.db2.gz YGIPNUVGUCMIMK-UHFFFAOYSA-N 1 2 230.311 2.425 20 0 BEADLO Cc1cc(CNC(=O)C2CC=CC2)cc(C)[nH+]1 ZINC000335075656 386045547 /nfs/dbraw/zinc/04/55/47/386045547.db2.gz TVJUCBAKUQFQGN-UHFFFAOYSA-N 1 2 230.311 2.281 20 0 BEADLO COc1ccccc1C[NH2+]Cc1cc(C)n(C)n1 ZINC000414237572 386052468 /nfs/dbraw/zinc/05/24/68/386052468.db2.gz GXUZQWIBBQHACK-UHFFFAOYSA-N 1 2 245.326 2.027 20 0 BEADLO C[N@H+](Cc1c(F)ccc(O)c1F)C1CC1 ZINC000295237844 385996014 /nfs/dbraw/zinc/99/60/14/385996014.db2.gz DNDRLJILKPGCCL-UHFFFAOYSA-N 1 2 213.227 2.265 20 0 BEADLO C[N@@H+](Cc1c(F)ccc(O)c1F)C1CC1 ZINC000295237844 385996020 /nfs/dbraw/zinc/99/60/20/385996020.db2.gz DNDRLJILKPGCCL-UHFFFAOYSA-N 1 2 213.227 2.265 20 0 BEADLO Cc1cc(CNc2ccc[nH+]c2C)nn1C ZINC000414293156 386103606 /nfs/dbraw/zinc/10/36/06/386103606.db2.gz MEIONJLRNYHOKN-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO CCC[C@@H]([NH2+]Cc1ccccc1)C(=O)OC ZINC000037952627 386104303 /nfs/dbraw/zinc/10/43/03/386104303.db2.gz GGANWAJBECTELO-GFCCVEGCSA-N 1 2 221.300 2.118 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)NCC1CC1 ZINC000287409585 386120262 /nfs/dbraw/zinc/12/02/62/386120262.db2.gz FALQGKCALZZLHR-UHFFFAOYSA-N 1 2 219.288 2.230 20 0 BEADLO COC(=O)c1coc(C[N@H+](C)Cc2ccoc2)c1 ZINC000338728121 386121931 /nfs/dbraw/zinc/12/19/31/386121931.db2.gz KHZDFHKSQLBJEQ-UHFFFAOYSA-N 1 2 249.266 2.291 20 0 BEADLO COC(=O)c1coc(C[N@@H+](C)Cc2ccoc2)c1 ZINC000338728121 386121938 /nfs/dbraw/zinc/12/19/38/386121938.db2.gz KHZDFHKSQLBJEQ-UHFFFAOYSA-N 1 2 249.266 2.291 20 0 BEADLO CCC[C@H](c1nc(C[NH2+]C)no1)C(C)C ZINC000414647608 386062001 /nfs/dbraw/zinc/06/20/01/386062001.db2.gz UQCQHEXSPJJBOU-VIFPVBQESA-N 1 2 211.309 2.329 20 0 BEADLO CC[N@H+](C[C@H]1CCNC(=O)CC1)c1ccccc1 ZINC000295742338 386078845 /nfs/dbraw/zinc/07/88/45/386078845.db2.gz YJVPFZSBAZGZNS-CYBMUJFWSA-N 1 2 246.354 2.429 20 0 BEADLO CC[N@@H+](C[C@H]1CCNC(=O)CC1)c1ccccc1 ZINC000295742338 386078851 /nfs/dbraw/zinc/07/88/51/386078851.db2.gz YJVPFZSBAZGZNS-CYBMUJFWSA-N 1 2 246.354 2.429 20 0 BEADLO Cn1nccc1CC[N@@H+]1CCCC[C@@H]1C(F)F ZINC000338635655 386080891 /nfs/dbraw/zinc/08/08/91/386080891.db2.gz FOOLMSPLIIJBDS-LLVKDONJSA-N 1 2 243.301 2.082 20 0 BEADLO Cn1nccc1CC[N@H+]1CCCC[C@@H]1C(F)F ZINC000338635655 386080895 /nfs/dbraw/zinc/08/08/95/386080895.db2.gz FOOLMSPLIIJBDS-LLVKDONJSA-N 1 2 243.301 2.082 20 0 BEADLO Cc1ccc([C@H](O)CNc2cccc[nH+]2)o1 ZINC000265960343 386087967 /nfs/dbraw/zinc/08/79/67/386087967.db2.gz IWTMASWCTPEXPX-SNVBAGLBSA-N 1 2 218.256 2.129 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)N(C)CCCn2cc[nH+]c2)C1 ZINC000345287074 386091933 /nfs/dbraw/zinc/09/19/33/386091933.db2.gz OFUOUGJRJBHROD-CHWSQXEVSA-N 1 2 249.358 2.168 20 0 BEADLO CCc1ncc(CNc2ccc(C)[nH+]c2)cn1 ZINC000414286037 386096795 /nfs/dbraw/zinc/09/67/95/386096795.db2.gz BXWWYNVMYXAMEO-UHFFFAOYSA-N 1 2 228.299 2.355 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)C1=CCCCCC1 ZINC000274761771 386146017 /nfs/dbraw/zinc/14/60/17/386146017.db2.gz NOXOBXBGJMQDDN-LBPRGKRZSA-N 1 2 247.342 2.278 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCC[C@](C)(F)C1 ZINC000296196636 386147690 /nfs/dbraw/zinc/14/76/90/386147690.db2.gz YWPNITVISOZDCQ-NSHDSACASA-N 1 2 211.284 2.042 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCC[C@](C)(F)C1 ZINC000296196636 386147694 /nfs/dbraw/zinc/14/76/94/386147694.db2.gz YWPNITVISOZDCQ-NSHDSACASA-N 1 2 211.284 2.042 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CCC[C@](C)(F)C1 ZINC000296196636 386147695 /nfs/dbraw/zinc/14/76/95/386147695.db2.gz YWPNITVISOZDCQ-NSHDSACASA-N 1 2 211.284 2.042 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CCC[C@](C)(F)C1 ZINC000296196636 386147698 /nfs/dbraw/zinc/14/76/98/386147698.db2.gz YWPNITVISOZDCQ-NSHDSACASA-N 1 2 211.284 2.042 20 0 BEADLO Cc1ccc(CNc2ccc[nH+]c2C)nn1 ZINC000414364473 386149347 /nfs/dbraw/zinc/14/93/47/386149347.db2.gz YNKZYOXLQORRBE-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO Cc1cc(CNc2ccc(N(C)C)[nH+]c2)on1 ZINC000310175601 386152913 /nfs/dbraw/zinc/15/29/13/386152913.db2.gz VJMNZMJTQAZSPG-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO CC(C)c1nc(N[C@H]2CCC[C@@H]2F)cc[nH+]1 ZINC000338848020 386153636 /nfs/dbraw/zinc/15/36/36/386153636.db2.gz YXRNGIALQFKBIY-UWVGGRQHSA-N 1 2 223.295 2.324 20 0 BEADLO Nc1[nH+]cnc(N[C@@H]2CCC[C@H]2F)c1Cl ZINC000338841906 386158103 /nfs/dbraw/zinc/15/81/03/386158103.db2.gz IJVMABAKBVQCBC-PHDIDXHHSA-N 1 2 230.674 2.015 20 0 BEADLO Nc1nc[nH+]c(N[C@@H]2CCC[C@H]2F)c1Cl ZINC000338841906 386158107 /nfs/dbraw/zinc/15/81/07/386158107.db2.gz IJVMABAKBVQCBC-PHDIDXHHSA-N 1 2 230.674 2.015 20 0 BEADLO CC[N@H+](CCOC)Cc1c(F)cccc1F ZINC000263741718 386172678 /nfs/dbraw/zinc/17/26/78/386172678.db2.gz VIFXMMNWRZVFDD-UHFFFAOYSA-N 1 2 229.270 2.433 20 0 BEADLO CC[N@@H+](CCOC)Cc1c(F)cccc1F ZINC000263741718 386172684 /nfs/dbraw/zinc/17/26/84/386172684.db2.gz VIFXMMNWRZVFDD-UHFFFAOYSA-N 1 2 229.270 2.433 20 0 BEADLO Cc1cc(N2C[C@@H](C)C[C@H](O)C2)nc(C(C)C)[nH+]1 ZINC000401889783 386173034 /nfs/dbraw/zinc/17/30/34/386173034.db2.gz GSUKQPNWAPFZTQ-JQWIXIFHSA-N 1 2 249.358 2.116 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)[C@@]12C[C@@H]1CCC2 ZINC000643305658 386178676 /nfs/dbraw/zinc/17/86/76/386178676.db2.gz HDXJAFFOWZRBTL-HZMBPMFUSA-N 1 2 241.294 2.463 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)C1CCCCCC1 ZINC000263818089 386180642 /nfs/dbraw/zinc/18/06/42/386180642.db2.gz PRKADKVNBUJBBD-GFCCVEGCSA-N 1 2 249.358 2.358 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1cncc(F)c1 ZINC000275168059 386188368 /nfs/dbraw/zinc/18/83/68/386188368.db2.gz WJGBRHUBQYDBST-MFKMUULPSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1cncc(F)c1 ZINC000275168059 386188374 /nfs/dbraw/zinc/18/83/74/386188374.db2.gz WJGBRHUBQYDBST-MFKMUULPSA-N 1 2 238.306 2.220 20 0 BEADLO Cc1ccnc(CNc2cc[nH+]c(C(C)C)n2)c1 ZINC000338763343 386132139 /nfs/dbraw/zinc/13/21/39/386132139.db2.gz SXQJBOMIIZLORT-UHFFFAOYSA-N 1 2 242.326 2.337 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)NCc1[nH+]ccn1C ZINC000274631337 386132440 /nfs/dbraw/zinc/13/24/40/386132440.db2.gz YBNXOFOLGCSHMS-CSKARUKUSA-N 1 2 235.331 2.029 20 0 BEADLO CC(C)C[C@H](CO)N(C)c1cc[nH+]c(C2CC2)n1 ZINC000274654452 386137203 /nfs/dbraw/zinc/13/72/03/386137203.db2.gz DIHZEZVRCNZWDL-GFCCVEGCSA-N 1 2 249.358 2.197 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@@H](C)O[C@@H](CC)C2)cn1 ZINC000414376448 386203777 /nfs/dbraw/zinc/20/37/77/386203777.db2.gz CHYYQMSVFKSPOD-YPMHNXCESA-N 1 2 249.358 2.038 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@@H](C)O[C@@H](CC)C2)cn1 ZINC000414376448 386203782 /nfs/dbraw/zinc/20/37/82/386203782.db2.gz CHYYQMSVFKSPOD-YPMHNXCESA-N 1 2 249.358 2.038 20 0 BEADLO CC[C@@H](C)c1csc([C@H]2COCC[NH2+]2)n1 ZINC000226468324 386210232 /nfs/dbraw/zinc/21/02/32/386210232.db2.gz MKLOQTVWJNKVDU-RKDXNWHRSA-N 1 2 226.345 2.318 20 0 BEADLO CC[C@H](C)c1csc([C@H]2COCC[NH2+]2)n1 ZINC000226468329 386210316 /nfs/dbraw/zinc/21/03/16/386210316.db2.gz MKLOQTVWJNKVDU-DTWKUNHWSA-N 1 2 226.345 2.318 20 0 BEADLO c1ncc(C[NH2+]Cc2noc3c2CCCC3)s1 ZINC000288497101 386210550 /nfs/dbraw/zinc/21/05/50/386210550.db2.gz RNJIZVMFMWYVEK-UHFFFAOYSA-N 1 2 249.339 2.300 20 0 BEADLO CC(C)CC(=O)NCCCCNc1cccc[nH+]1 ZINC000264177743 386214508 /nfs/dbraw/zinc/21/45/08/386214508.db2.gz NNLLOXZDYSQLNH-UHFFFAOYSA-N 1 2 249.358 2.436 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000373536428 386215559 /nfs/dbraw/zinc/21/55/59/386215559.db2.gz WGIVJRBQFVLEFT-CQSZACIVSA-N 1 2 249.358 2.109 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000373536428 386215566 /nfs/dbraw/zinc/21/55/66/386215566.db2.gz WGIVJRBQFVLEFT-CQSZACIVSA-N 1 2 249.358 2.109 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)Cc1cncs1 ZINC000275499374 386216448 /nfs/dbraw/zinc/21/64/48/386216448.db2.gz QVMWMHWPOBXKSE-UHFFFAOYSA-N 1 2 247.323 2.282 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)NOC(C)C ZINC000297002950 386217928 /nfs/dbraw/zinc/21/79/28/386217928.db2.gz KIUCUAQHVFFKPO-UHFFFAOYSA-N 1 2 223.276 2.160 20 0 BEADLO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1nccn1C ZINC000288625743 386222505 /nfs/dbraw/zinc/22/25/05/386222505.db2.gz SEJQCGMLZCYDGI-QMTHXVAHSA-N 1 2 243.310 2.032 20 0 BEADLO CC[C@@H](CO)Nc1cc[nH+]c2c(OC)cccc12 ZINC000275659893 386226394 /nfs/dbraw/zinc/22/63/94/386226394.db2.gz YISZMRPDQMHHEG-JTQLQIEISA-N 1 2 246.310 2.426 20 0 BEADLO FC(F)(F)[C@@H](N[C@H]1CCn2cc[nH+]c21)C1CC1 ZINC000297239840 386236023 /nfs/dbraw/zinc/23/60/23/386236023.db2.gz ILVWAKZIRCCXTL-IUCAKERBSA-N 1 2 245.248 2.258 20 0 BEADLO CC(C)n1cc(C[NH2+]Cc2nccs2)cn1 ZINC000226241818 386242230 /nfs/dbraw/zinc/24/22/30/386242230.db2.gz GYOSKKZBWYLSGB-UHFFFAOYSA-N 1 2 236.344 2.210 20 0 BEADLO c1nnc([C@@H]([NH2+]CCC2CC2)c2ccccc2)[nH]1 ZINC000275822880 386242755 /nfs/dbraw/zinc/24/27/55/386242755.db2.gz KFPSTAQLRGHVMQ-ZDUSSCGKSA-N 1 2 242.326 2.284 20 0 BEADLO Cc1ccc(Cc2nc(C3CC3)no2)c[nH+]1 ZINC000264576033 386248235 /nfs/dbraw/zinc/24/82/35/386248235.db2.gz FJARCOOEBLUFOA-UHFFFAOYSA-N 1 2 215.256 2.241 20 0 BEADLO Cc1ccsc1CNC(=O)c1c[nH+]c(C)[nH]1 ZINC000264621231 386255339 /nfs/dbraw/zinc/25/53/39/386255339.db2.gz BMGCGRYGAFWSHC-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO C[N@H+](Cc1ccncc1)Cc1cncc(F)c1 ZINC000428092200 386191654 /nfs/dbraw/zinc/19/16/54/386191654.db2.gz AVKDJSLVWOOACZ-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[N@@H+](Cc1ccncc1)Cc1cncc(F)c1 ZINC000428092200 386191660 /nfs/dbraw/zinc/19/16/60/386191660.db2.gz AVKDJSLVWOOACZ-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO c1cnn(-c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC000340545269 386192216 /nfs/dbraw/zinc/19/22/16/386192216.db2.gz GCJDJSYYIGBTSR-UHFFFAOYSA-N 1 2 224.267 2.117 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H](C)CCC(C)C)c[nH+]1 ZINC000264889180 386280926 /nfs/dbraw/zinc/28/09/26/386280926.db2.gz VAVJFICSZSQDDM-VIFPVBQESA-N 1 2 223.320 2.273 20 0 BEADLO CCc1cccc(C[NH2+][C@@H](C)c2ncn(C)n2)c1 ZINC000276180052 386281591 /nfs/dbraw/zinc/28/15/91/386281591.db2.gz GSTIOGOYSIQDQG-NSHDSACASA-N 1 2 244.342 2.228 20 0 BEADLO Cc1c(C(=O)NCc2c[nH+]c[nH]2)ccn1C(C)C ZINC000340585566 386285153 /nfs/dbraw/zinc/28/51/53/386285153.db2.gz YBIITXFQONZTGI-UHFFFAOYSA-N 1 2 246.314 2.031 20 0 BEADLO Cc1c(C(=O)NCc2c[nH]c[nH+]2)ccn1C(C)C ZINC000340585566 386285158 /nfs/dbraw/zinc/28/51/58/386285158.db2.gz YBIITXFQONZTGI-UHFFFAOYSA-N 1 2 246.314 2.031 20 0 BEADLO c1cn(Cc2nc(C3CCCCC3)no2)c[nH+]1 ZINC000276246721 386290324 /nfs/dbraw/zinc/29/03/24/386290324.db2.gz VLHQSWCZLJIHAM-UHFFFAOYSA-N 1 2 232.287 2.362 20 0 BEADLO Fc1cccc(CN2CCc3[nH+]c[nH]c3C2)c1 ZINC000647933167 386324605 /nfs/dbraw/zinc/32/46/05/386324605.db2.gz DIRXOFOVAJGMSR-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO c1cn(CCSCCOC2CCC2)c[nH+]1 ZINC000289403178 386299433 /nfs/dbraw/zinc/29/94/33/386299433.db2.gz NMTXOSLFPADLCR-UHFFFAOYSA-N 1 2 226.345 2.185 20 0 BEADLO COC[C@@H]([NH2+]Cc1[nH]ncc1C)c1ccccc1 ZINC000289441603 386306568 /nfs/dbraw/zinc/30/65/68/386306568.db2.gz FZULVQCPIBOCOW-CQSZACIVSA-N 1 2 245.326 2.195 20 0 BEADLO COC[C@@H]([NH2+]Cc1n[nH]cc1C)c1ccccc1 ZINC000289441603 386306572 /nfs/dbraw/zinc/30/65/72/386306572.db2.gz FZULVQCPIBOCOW-CQSZACIVSA-N 1 2 245.326 2.195 20 0 BEADLO CC(C)(C)/C=C/C(=O)Nc1ccc(N)[nH+]c1 ZINC000236740670 386309375 /nfs/dbraw/zinc/30/93/75/386309375.db2.gz VXLZRDUNGWQDJW-VOTSOKGWSA-N 1 2 219.288 2.205 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2nonc2C)s1 ZINC000265160007 386312054 /nfs/dbraw/zinc/31/20/54/386312054.db2.gz VSELCRPAHIMWHP-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2nonc2C)s1 ZINC000265160007 386312059 /nfs/dbraw/zinc/31/20/59/386312059.db2.gz VSELCRPAHIMWHP-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO COCc1cc(C[NH2+]Cc2ccc(C)cc2)no1 ZINC000298246591 386313816 /nfs/dbraw/zinc/31/38/16/386313816.db2.gz CYTHIYSYYWHMRH-UHFFFAOYSA-N 1 2 246.310 2.419 20 0 BEADLO C[C@@H](C[NH2+][C@]1(C)CCOC1=O)c1ccccc1 ZINC000289502259 386317871 /nfs/dbraw/zinc/31/78/71/386317871.db2.gz JYKBRGXDLCEPKV-SMDDNHRTSA-N 1 2 233.311 2.085 20 0 BEADLO O=C(CCC1CC1)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000265251468 386322366 /nfs/dbraw/zinc/32/23/66/386322366.db2.gz SHIMUWJYGDRHFM-UHFFFAOYSA-N 1 2 247.342 2.306 20 0 BEADLO CC[C@@H](CSC)[N@H+](C)Cc1csnn1 ZINC000336650173 386263387 /nfs/dbraw/zinc/26/33/87/386263387.db2.gz ACJFWHPKRACGQX-VIFPVBQESA-N 1 2 231.390 2.112 20 0 BEADLO CC[C@@H](CSC)[N@@H+](C)Cc1csnn1 ZINC000336650173 386263390 /nfs/dbraw/zinc/26/33/90/386263390.db2.gz ACJFWHPKRACGQX-VIFPVBQESA-N 1 2 231.390 2.112 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H]2CCCC[C@H]2C)c[nH+]1 ZINC000264740523 386266989 /nfs/dbraw/zinc/26/69/89/386266989.db2.gz RFXNRLYAVOBCHB-SCZZXKLOSA-N 1 2 221.304 2.027 20 0 BEADLO CC[C@H]([NH2+][C@@H](C)c1cn(C)nc1C)C(F)F ZINC000453245724 386272009 /nfs/dbraw/zinc/27/20/09/386272009.db2.gz LVENWIGGYWNNMM-XVKPBYJWSA-N 1 2 231.290 2.423 20 0 BEADLO CC(C)CC[C@@H](C)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000276445375 386323914 /nfs/dbraw/zinc/32/39/14/386323914.db2.gz AFNBEJIJWIQQSY-XUIVZRPNSA-N 1 2 235.331 2.364 20 0 BEADLO Cc1cncc(C[N@@H+]2CCC=C(F)C2)c1 ZINC000276093831 386273821 /nfs/dbraw/zinc/27/38/21/386273821.db2.gz USSPQYCGJJVQLG-UHFFFAOYSA-N 1 2 206.264 2.449 20 0 BEADLO Cc1cncc(C[N@H+]2CCC=C(F)C2)c1 ZINC000276093831 386273824 /nfs/dbraw/zinc/27/38/24/386273824.db2.gz USSPQYCGJJVQLG-UHFFFAOYSA-N 1 2 206.264 2.449 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1ccn(C(C)C)n1 ZINC000264857594 386274416 /nfs/dbraw/zinc/27/44/16/386274416.db2.gz DEBKOVQMGUQORW-UHFFFAOYSA-N 1 2 244.298 2.420 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H]2CCC[C@H](C)C2)c[nH+]1 ZINC000264849989 386274517 /nfs/dbraw/zinc/27/45/17/386274517.db2.gz MUEHZHKNGZQJHN-WPRPVWTQSA-N 1 2 221.304 2.027 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CCC[C@H](C)C2)c[nH+]1 ZINC000264849988 386274753 /nfs/dbraw/zinc/27/47/53/386274753.db2.gz MUEHZHKNGZQJHN-WCBMZHEXSA-N 1 2 221.304 2.027 20 0 BEADLO CC[C@](C)(OC)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000297811621 386277616 /nfs/dbraw/zinc/27/76/16/386277616.db2.gz PJFJJDKGOWYNEJ-ZDUSSCGKSA-N 1 2 247.298 2.088 20 0 BEADLO CCOc1nnc(C[N@@H+]2CC[C@H](CC)C2)s1 ZINC000336683145 386343536 /nfs/dbraw/zinc/34/35/36/386343536.db2.gz SMDIYUMLKICQRH-VIFPVBQESA-N 1 2 241.360 2.169 20 0 BEADLO CCOc1nnc(C[N@H+]2CC[C@H](CC)C2)s1 ZINC000336683145 386343542 /nfs/dbraw/zinc/34/35/42/386343542.db2.gz SMDIYUMLKICQRH-VIFPVBQESA-N 1 2 241.360 2.169 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](Cc1cc[nH]n1)CCO2 ZINC000289691814 386345139 /nfs/dbraw/zinc/34/51/39/386345139.db2.gz OHZPRXUPKPWDFT-UHFFFAOYSA-N 1 2 243.310 2.113 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](Cc1cc[nH]n1)CCO2 ZINC000289691814 386345144 /nfs/dbraw/zinc/34/51/44/386345144.db2.gz OHZPRXUPKPWDFT-UHFFFAOYSA-N 1 2 243.310 2.113 20 0 BEADLO CC(C)(C(=O)Nc1ccccc1F)c1c[nH+]c[nH]1 ZINC000334491690 386346860 /nfs/dbraw/zinc/34/68/60/386346860.db2.gz JHMGYSMQMXYREM-UHFFFAOYSA-N 1 2 247.273 2.465 20 0 BEADLO CC(C)(C(=O)Nc1ccccc1F)c1c[nH]c[nH+]1 ZINC000334491690 386346867 /nfs/dbraw/zinc/34/68/67/386346867.db2.gz JHMGYSMQMXYREM-UHFFFAOYSA-N 1 2 247.273 2.465 20 0 BEADLO CC(C)=CCCNC(=O)c1ccc2[nH+]ccn2c1 ZINC000276576600 386346875 /nfs/dbraw/zinc/34/68/75/386346875.db2.gz ACWCSQSJFIBVPY-UHFFFAOYSA-N 1 2 243.310 2.420 20 0 BEADLO CC1(C)CCCC[C@@H]1C(=O)NCc1[nH]cc[nH+]1 ZINC000226627672 386348687 /nfs/dbraw/zinc/34/86/87/386348687.db2.gz SIRYYDJYTWEGBR-SNVBAGLBSA-N 1 2 235.331 2.242 20 0 BEADLO CC[C@H]1CCC[C@H](NC(=O)c2c[nH+]c(C)[nH]2)C1 ZINC000265960941 386386533 /nfs/dbraw/zinc/38/65/33/386386533.db2.gz XMCDCCDXWUPJCG-QWRGUYRKSA-N 1 2 235.331 2.417 20 0 BEADLO CCCCc1noc(C[N@H+](C)CCSC)n1 ZINC000336689602 386355407 /nfs/dbraw/zinc/35/54/07/386355407.db2.gz ZNZKDIUSDKWTCE-UHFFFAOYSA-N 1 2 243.376 2.207 20 0 BEADLO CCCCc1noc(C[N@@H+](C)CCSC)n1 ZINC000336689602 386355411 /nfs/dbraw/zinc/35/54/11/386355411.db2.gz ZNZKDIUSDKWTCE-UHFFFAOYSA-N 1 2 243.376 2.207 20 0 BEADLO Cc1[nH+]c2ccc(C(=O)NC(C)(C)C)cc2n1C ZINC000335271741 386357501 /nfs/dbraw/zinc/35/75/01/386357501.db2.gz ACLYSXHXLMGCRN-UHFFFAOYSA-N 1 2 245.326 2.410 20 0 BEADLO CCN(C)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000265706245 386361852 /nfs/dbraw/zinc/36/18/52/386361852.db2.gz KAEZABSPGANEJE-UHFFFAOYSA-N 1 2 232.287 2.126 20 0 BEADLO Cc1cc(N(C)Cc2ccon2)nc(C2CC2)[nH+]1 ZINC000265779186 386370704 /nfs/dbraw/zinc/37/07/04/386370704.db2.gz FPKKUZVWNPPUSL-UHFFFAOYSA-N 1 2 244.298 2.287 20 0 BEADLO CCOc1nnc(C[NH+]2C[C@@H](C)[C@H](C)C2)s1 ZINC000336697172 386377522 /nfs/dbraw/zinc/37/75/22/386377522.db2.gz IAXYMYNNFJABHB-RKDXNWHRSA-N 1 2 241.360 2.025 20 0 BEADLO Cc1ccc(F)c(C[NH2+][C@H](C)c2ncnn2C)c1 ZINC000276805645 386378138 /nfs/dbraw/zinc/37/81/38/386378138.db2.gz ZOGVFYQUNDRRTA-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO C[C@H](C(=O)OC(C)(C)C)[N@@H+]1CC[C@](C)(F)C1 ZINC000347395713 386382470 /nfs/dbraw/zinc/38/24/70/386382470.db2.gz SXPNREUBPYDCQF-SKDRFNHKSA-N 1 2 231.311 2.151 20 0 BEADLO C[C@H](C(=O)OC(C)(C)C)[N@H+]1CC[C@](C)(F)C1 ZINC000347395713 386382473 /nfs/dbraw/zinc/38/24/73/386382473.db2.gz SXPNREUBPYDCQF-SKDRFNHKSA-N 1 2 231.311 2.151 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H]2CCCC(C)(C)C2)c[nH+]1 ZINC000276863305 386384177 /nfs/dbraw/zinc/38/41/77/386384177.db2.gz CWXVXNAVJQCIAG-JTQLQIEISA-N 1 2 235.331 2.417 20 0 BEADLO COC(=O)[C@H]([NH2+]C[C@@H]1C[C@H]1C)c1cccs1 ZINC000336775423 386384677 /nfs/dbraw/zinc/38/46/77/386384677.db2.gz YYZGNEDTNVXLSK-WCABBAIRSA-N 1 2 239.340 2.208 20 0 BEADLO Cc1ccc(C[NH2+][C@@]2(C)CCOC2=O)cc1C ZINC000289602617 386331956 /nfs/dbraw/zinc/33/19/56/386331956.db2.gz QKNHGFOFRFRINW-AWEZNQCLSA-N 1 2 233.311 2.099 20 0 BEADLO CNc1[nH+]cnc2c1cnn2CCCCCF ZINC000340600795 386335010 /nfs/dbraw/zinc/33/50/10/386335010.db2.gz IEVRGVVUHSCXDG-UHFFFAOYSA-N 1 2 237.282 2.008 20 0 BEADLO Cc1nocc1C[NH2+]Cc1nccn1CC(C)C ZINC000339278985 386338135 /nfs/dbraw/zinc/33/81/35/386338135.db2.gz NRQMNXNJBZVHET-UHFFFAOYSA-N 1 2 248.330 2.125 20 0 BEADLO Cc1occc1C[N@@H+]1CCN(C)[C@H](C(C)C)C1 ZINC000414433100 386437981 /nfs/dbraw/zinc/43/79/81/386437981.db2.gz KIIBYCDKYQNOPL-AWEZNQCLSA-N 1 2 236.359 2.360 20 0 BEADLO Cc1occc1C[N@H+]1CCN(C)[C@H](C(C)C)C1 ZINC000414433100 386437985 /nfs/dbraw/zinc/43/79/85/386437985.db2.gz KIIBYCDKYQNOPL-AWEZNQCLSA-N 1 2 236.359 2.360 20 0 BEADLO Cc1nnc(C[N@@H+](Cc2ccco2)C(C)C)o1 ZINC000299345584 386443516 /nfs/dbraw/zinc/44/35/16/386443516.db2.gz FVGIBZXRPPWBDF-UHFFFAOYSA-N 1 2 235.287 2.382 20 0 BEADLO Cc1nnc(C[N@H+](Cc2ccco2)C(C)C)o1 ZINC000299345584 386443523 /nfs/dbraw/zinc/44/35/23/386443523.db2.gz FVGIBZXRPPWBDF-UHFFFAOYSA-N 1 2 235.287 2.382 20 0 BEADLO Cc1cnc(C)c(NCCNc2cccc[nH+]2)n1 ZINC000266580414 386452945 /nfs/dbraw/zinc/45/29/45/386452945.db2.gz LURTYBATDNJATK-UHFFFAOYSA-N 1 2 243.314 2.012 20 0 BEADLO Cc1c[nH]nc1C[N@H+](C)Cc1ccoc1C ZINC000290503276 386447384 /nfs/dbraw/zinc/44/73/84/386447384.db2.gz SOOGTCZQOYISMX-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO Cc1c[nH]nc1C[N@@H+](C)Cc1ccoc1C ZINC000290503276 386447392 /nfs/dbraw/zinc/44/73/92/386447392.db2.gz SOOGTCZQOYISMX-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO Cc1cn[nH]c1C[N@@H+](C)Cc1ccoc1C ZINC000290503276 386447398 /nfs/dbraw/zinc/44/73/98/386447398.db2.gz SOOGTCZQOYISMX-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO Cc1cn[nH]c1C[N@H+](C)Cc1ccoc1C ZINC000290503276 386447403 /nfs/dbraw/zinc/44/74/03/386447403.db2.gz SOOGTCZQOYISMX-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2cnns2)cc1 ZINC000290037918 386387978 /nfs/dbraw/zinc/38/79/78/386387978.db2.gz NVOIDLCOMVRGDV-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2cnns2)cc1 ZINC000290037918 386387984 /nfs/dbraw/zinc/38/79/84/386387984.db2.gz NVOIDLCOMVRGDV-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1cnns1 ZINC000290118030 386395987 /nfs/dbraw/zinc/39/59/87/386395987.db2.gz TXSHOHRNUSSZSY-GFCCVEGCSA-N 1 2 248.355 2.214 20 0 BEADLO Cn1cccc1[C@H]1CCC[N@H+]1Cc1cnns1 ZINC000290118030 386395989 /nfs/dbraw/zinc/39/59/89/386395989.db2.gz TXSHOHRNUSSZSY-GFCCVEGCSA-N 1 2 248.355 2.214 20 0 BEADLO Cc1cc(N2CC[C@H](C(C)(C)C)[C@@H](O)C2)nc[nH+]1 ZINC000347424504 386397328 /nfs/dbraw/zinc/39/73/28/386397328.db2.gz TUHOPKVMJXYMNT-RYUDHWBXSA-N 1 2 249.358 2.018 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H]2CCC[C@H](C)CC2)c[nH+]1 ZINC000276969500 386398298 /nfs/dbraw/zinc/39/82/98/386398298.db2.gz TWIQVTHFKKCTNH-ONGXEEELSA-N 1 2 235.331 2.417 20 0 BEADLO Cc1ccc(C[N@H+]2CCN(C(C)C)C(=O)C2)cc1 ZINC000356377412 386399100 /nfs/dbraw/zinc/39/91/00/386399100.db2.gz XHGCGASCYIVOTH-UHFFFAOYSA-N 1 2 246.354 2.048 20 0 BEADLO Cc1ccc(C[N@@H+]2CCN(C(C)C)C(=O)C2)cc1 ZINC000356377412 386399105 /nfs/dbraw/zinc/39/91/05/386399105.db2.gz XHGCGASCYIVOTH-UHFFFAOYSA-N 1 2 246.354 2.048 20 0 BEADLO O=C(CCn1cc[nH+]c1)N1CCC[C@@H]2CCC[C@@H]21 ZINC000266121155 386399968 /nfs/dbraw/zinc/39/99/68/386399968.db2.gz UJZZJSZOPVECJQ-STQMWFEESA-N 1 2 247.342 2.064 20 0 BEADLO CN(C)c1ccccc1C[N@H+](C)Cc1cocn1 ZINC000290169285 386401289 /nfs/dbraw/zinc/40/12/89/386401289.db2.gz MSPDQTZNBPYFRX-UHFFFAOYSA-N 1 2 245.326 2.373 20 0 BEADLO CN(C)c1ccccc1C[N@@H+](C)Cc1cocn1 ZINC000290169285 386401296 /nfs/dbraw/zinc/40/12/96/386401296.db2.gz MSPDQTZNBPYFRX-UHFFFAOYSA-N 1 2 245.326 2.373 20 0 BEADLO Cc1ccc(C)c(C[N@@H+](C)Cc2nncn2C)c1 ZINC000277153554 386414689 /nfs/dbraw/zinc/41/46/89/386414689.db2.gz WBMWKZUXEILRKV-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1ccc(C)c(C[N@H+](C)Cc2nncn2C)c1 ZINC000277153554 386414694 /nfs/dbraw/zinc/41/46/94/386414694.db2.gz WBMWKZUXEILRKV-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO CCC[C@H](C)CC(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000347491785 386422108 /nfs/dbraw/zinc/42/21/08/386422108.db2.gz GPEDOZFANZDHJD-JTQLQIEISA-N 1 2 223.320 2.194 20 0 BEADLO O=C(/C=C/C1CC1)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000266292347 386424103 /nfs/dbraw/zinc/42/41/03/386424103.db2.gz OMSPYLCLGHIDNC-NNNHXZLVSA-N 1 2 245.326 2.430 20 0 BEADLO CC[C@H]1CCN(c2cc(N3CCCC3)[nH+]cn2)C1 ZINC000277273601 386424557 /nfs/dbraw/zinc/42/45/57/386424557.db2.gz AATZDABVUHNNJJ-LBPRGKRZSA-N 1 2 246.358 2.313 20 0 BEADLO CC[C@H]1CCN(c2cc(N3CCCC3)nc[nH+]2)C1 ZINC000277273601 386424569 /nfs/dbraw/zinc/42/45/69/386424569.db2.gz AATZDABVUHNNJJ-LBPRGKRZSA-N 1 2 246.358 2.313 20 0 BEADLO Cc1cnn(C)c1C[N@@H+](C)[C@H](C)c1cccnc1 ZINC000290389134 386429164 /nfs/dbraw/zinc/42/91/64/386429164.db2.gz OMCJSJQAWKCZKY-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cnn(C)c1C[N@H+](C)[C@H](C)c1cccnc1 ZINC000290389134 386429169 /nfs/dbraw/zinc/42/91/69/386429169.db2.gz OMCJSJQAWKCZKY-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1nc(N2CCC[C@H]2C(C)C)cc[nH+]1 ZINC000266336863 386429344 /nfs/dbraw/zinc/42/93/44/386429344.db2.gz HNMWMZHEIIOWIA-NSHDSACASA-N 1 2 205.305 2.410 20 0 BEADLO Cc1occc1CN(C)c1cc[nH+]c(C)n1 ZINC000266382481 386430153 /nfs/dbraw/zinc/43/01/53/386430153.db2.gz NABVCWPTLNGJGG-UHFFFAOYSA-N 1 2 217.272 2.323 20 0 BEADLO Cc1ccc([C@@H](O)CNc2cc[nH+]c(C)n2)cc1 ZINC000266411078 386433664 /nfs/dbraw/zinc/43/36/64/386433664.db2.gz QQQWVUKTWOEZGP-ZDUSSCGKSA-N 1 2 243.310 2.239 20 0 BEADLO Cc1occc1C[N@@H+]1CCN(C)[C@@H](C(C)C)C1 ZINC000414433101 386435863 /nfs/dbraw/zinc/43/58/63/386435863.db2.gz KIIBYCDKYQNOPL-CQSZACIVSA-N 1 2 236.359 2.360 20 0 BEADLO Cc1occc1C[N@H+]1CCN(C)[C@@H](C(C)C)C1 ZINC000414433101 386435867 /nfs/dbraw/zinc/43/58/67/386435867.db2.gz KIIBYCDKYQNOPL-CQSZACIVSA-N 1 2 236.359 2.360 20 0 BEADLO CCO[C@H](C)c1noc(C[N@@H+]2C[C@@H](C)[C@H]2C)n1 ZINC000339578652 386471722 /nfs/dbraw/zinc/47/17/22/386471722.db2.gz CLGXUAXPMUQEDI-OPRDCNLKSA-N 1 2 239.319 2.007 20 0 BEADLO CCO[C@H](C)c1noc(C[N@H+]2C[C@@H](C)[C@H]2C)n1 ZINC000339578652 386471724 /nfs/dbraw/zinc/47/17/24/386471724.db2.gz CLGXUAXPMUQEDI-OPRDCNLKSA-N 1 2 239.319 2.007 20 0 BEADLO CCc1ccccc1NC(=O)CCn1cc[nH+]c1 ZINC000299610559 386472351 /nfs/dbraw/zinc/47/23/51/386472351.db2.gz HFCUQEPVYJLZFR-UHFFFAOYSA-N 1 2 243.310 2.474 20 0 BEADLO CN(Cc1nccs1)c1cc[nH+]c(C2CC2)n1 ZINC000266856919 386475849 /nfs/dbraw/zinc/47/58/49/386475849.db2.gz UPCOVOCRYLKKMW-UHFFFAOYSA-N 1 2 246.339 2.447 20 0 BEADLO Cc1csc(C[NH+]2CCSCC2)n1 ZINC000266859941 386476270 /nfs/dbraw/zinc/47/62/70/386476270.db2.gz GSCZTIWBSMWMQS-UHFFFAOYSA-N 1 2 214.359 2.000 20 0 BEADLO CN(CC1CC1)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000290828658 386478811 /nfs/dbraw/zinc/47/88/11/386478811.db2.gz XLZBLWIVQNOQAW-UHFFFAOYSA-N 1 2 244.298 2.208 20 0 BEADLO CC(C)Cn1nccc1C[NH+]1CC(C(F)F)C1 ZINC000648042619 386483238 /nfs/dbraw/zinc/48/32/38/386483238.db2.gz KDONTJRPGWAQOP-UHFFFAOYSA-N 1 2 243.301 2.236 20 0 BEADLO Cc1cc(-c2noc(Cn3cc[nH+]c3)n2)c(C)o1 ZINC000278034435 386486660 /nfs/dbraw/zinc/48/66/60/386486660.db2.gz SLADXBXJTFGJDH-UHFFFAOYSA-N 1 2 244.254 2.191 20 0 BEADLO CC(C)[C@@H](NCc1[nH+]ccn1C)C(F)(F)F ZINC000336756907 386492381 /nfs/dbraw/zinc/49/23/81/386492381.db2.gz YSCIIWOCAACOCG-SECBINFHSA-N 1 2 235.253 2.097 20 0 BEADLO Cc1ccc([C@H](C)[NH2+][C@H](C)c2nccc(N)n2)o1 ZINC000647971132 386495087 /nfs/dbraw/zinc/49/50/87/386495087.db2.gz VDSACQVEYINQSO-VHSXEESVSA-N 1 2 246.314 2.202 20 0 BEADLO CCCC(CCC)C(=O)N1CCn2c[nH+]cc2C1 ZINC000290993701 386496893 /nfs/dbraw/zinc/49/68/93/386496893.db2.gz XQNSZRVWRQWXAW-UHFFFAOYSA-N 1 2 249.358 2.442 20 0 BEADLO CO[C@H](C)c1noc(C[N@H+](C)CC=C(C)C)n1 ZINC000267118017 386497204 /nfs/dbraw/zinc/49/72/04/386497204.db2.gz SSCBALKARYRAFL-SNVBAGLBSA-N 1 2 239.319 2.175 20 0 BEADLO CO[C@H](C)c1noc(C[N@@H+](C)CC=C(C)C)n1 ZINC000267118017 386497209 /nfs/dbraw/zinc/49/72/09/386497209.db2.gz SSCBALKARYRAFL-SNVBAGLBSA-N 1 2 239.319 2.175 20 0 BEADLO c1cc(C[NH2+]Cc2ccnn2C2CCCC2)on1 ZINC000519607885 386503553 /nfs/dbraw/zinc/50/35/53/386503553.db2.gz XCHLETJGOSIFGE-UHFFFAOYSA-N 1 2 246.314 2.276 20 0 BEADLO Cc1nc(N2CC(C)(C)[C@H]2[C@H]2CCCO2)cc[nH+]1 ZINC000291141932 386514155 /nfs/dbraw/zinc/51/41/55/386514155.db2.gz OANZEDYVNUMNDI-DGCLKSJQSA-N 1 2 247.342 2.179 20 0 BEADLO c1cc2[nH+]ccc(NC[C@@H]3CCCS3)c2cn1 ZINC000335447550 386514121 /nfs/dbraw/zinc/51/41/21/386514121.db2.gz RDHFDXATGDDXNV-JTQLQIEISA-N 1 2 245.351 2.359 20 0 BEADLO CCn1nccc1C[N@@H+]1C[C@H](C)OC2(CCC2)C1 ZINC000335450029 386520298 /nfs/dbraw/zinc/52/02/98/386520298.db2.gz SDPBNPBMGXHGGM-LBPRGKRZSA-N 1 2 249.358 2.046 20 0 BEADLO CCn1nccc1C[N@H+]1C[C@H](C)OC2(CCC2)C1 ZINC000335450029 386520301 /nfs/dbraw/zinc/52/03/01/386520301.db2.gz SDPBNPBMGXHGGM-LBPRGKRZSA-N 1 2 249.358 2.046 20 0 BEADLO FC(F)(F)C[C@H]1CC[N@H+](Cc2cocn2)C1 ZINC000278413350 386523245 /nfs/dbraw/zinc/52/32/45/386523245.db2.gz QJJNKEBPVFFDMA-MRVPVSSYSA-N 1 2 234.221 2.449 20 0 BEADLO FC(F)(F)C[C@H]1CC[N@@H+](Cc2cocn2)C1 ZINC000278413350 386523248 /nfs/dbraw/zinc/52/32/48/386523248.db2.gz QJJNKEBPVFFDMA-MRVPVSSYSA-N 1 2 234.221 2.449 20 0 BEADLO CC1(C(=O)N2CCC[C@H](c3[nH]cc[nH+]3)C2)CCC1 ZINC000267327194 386527058 /nfs/dbraw/zinc/52/70/58/386527058.db2.gz ABLLOPQFUIRIQV-NSHDSACASA-N 1 2 247.342 2.306 20 0 BEADLO CC1(C(=O)N2CCC[C@@H](c3[nH]cc[nH+]3)C2)CCC1 ZINC000267327190 386527748 /nfs/dbraw/zinc/52/77/48/386527748.db2.gz ABLLOPQFUIRIQV-LLVKDONJSA-N 1 2 247.342 2.306 20 0 BEADLO CCN(CC(C)(C)C)C(=O)CCc1[nH]cc[nH+]1 ZINC000291251655 386527887 /nfs/dbraw/zinc/52/78/87/386527887.db2.gz RLRKTMYUZDPAPJ-UHFFFAOYSA-N 1 2 237.347 2.237 20 0 BEADLO C[N@H+](Cc1ccon1)[C@H](CCO)c1ccccc1 ZINC000266586800 386453207 /nfs/dbraw/zinc/45/32/07/386453207.db2.gz KJZJXTMHVUFQAC-CQSZACIVSA-N 1 2 246.310 2.230 20 0 BEADLO C[N@@H+](Cc1ccon1)[C@H](CCO)c1ccccc1 ZINC000266586800 386453216 /nfs/dbraw/zinc/45/32/16/386453216.db2.gz KJZJXTMHVUFQAC-CQSZACIVSA-N 1 2 246.310 2.230 20 0 BEADLO Cc1ccccc1C[C@H](C)[NH2+]CC(F)(F)CN ZINC000414921614 386579691 /nfs/dbraw/zinc/57/96/91/386579691.db2.gz AVNWFIBJWOXSOB-NSHDSACASA-N 1 2 242.313 2.110 20 0 BEADLO CCOc1ccc(OCc2c[nH+]cn2C)cc1 ZINC000267786632 386582999 /nfs/dbraw/zinc/58/29/99/386582999.db2.gz OWQIWLJNMVHSOS-UHFFFAOYSA-N 1 2 232.283 2.398 20 0 BEADLO CS[C@H]1CCN(c2[nH+]c(C)nc3[nH]ccc32)C1 ZINC000335423788 386598742 /nfs/dbraw/zinc/59/87/42/386598742.db2.gz WXCOABINEUVMTN-VIFPVBQESA-N 1 2 248.355 2.208 20 0 BEADLO C[C@H](CCc1ccccc1)[NH2+]CC(F)(F)CN ZINC000414922080 386590871 /nfs/dbraw/zinc/59/08/71/386590871.db2.gz BUWHRMHZHWJSGX-LLVKDONJSA-N 1 2 242.313 2.191 20 0 BEADLO Cc1cc(N[C@@H]2CCC[C@@H]2OC(F)F)nc[nH+]1 ZINC000336907555 386547374 /nfs/dbraw/zinc/54/73/74/386547374.db2.gz FYQYFRVPDHDALM-BDAKNGLRSA-N 1 2 243.257 2.357 20 0 BEADLO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ncccn1 ZINC000336615893 386556551 /nfs/dbraw/zinc/55/65/51/386556551.db2.gz OREQRIGCCAUVQN-DTWKUNHWSA-N 1 2 245.248 2.249 20 0 BEADLO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ncccn1 ZINC000336615893 386556556 /nfs/dbraw/zinc/55/65/56/386556556.db2.gz OREQRIGCCAUVQN-DTWKUNHWSA-N 1 2 245.248 2.249 20 0 BEADLO c1nc(N2CCCC2)cc(N2CCCCCC2)[nH+]1 ZINC000242976307 386556857 /nfs/dbraw/zinc/55/68/57/386556857.db2.gz HPYTUQNKIDOPKF-UHFFFAOYSA-N 1 2 246.358 2.457 20 0 BEADLO c1nc(N2CCCCCC2)cc(N2CCCC2)[nH+]1 ZINC000242976307 386556865 /nfs/dbraw/zinc/55/68/65/386556865.db2.gz HPYTUQNKIDOPKF-UHFFFAOYSA-N 1 2 246.358 2.457 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1cc(C)cc(C)c1 ZINC000278637933 386557484 /nfs/dbraw/zinc/55/74/84/386557484.db2.gz GTRJQCSYLGRTAH-LBPRGKRZSA-N 1 2 235.327 2.297 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1cc(C)cc(C)c1 ZINC000278637933 386557488 /nfs/dbraw/zinc/55/74/88/386557488.db2.gz GTRJQCSYLGRTAH-LBPRGKRZSA-N 1 2 235.327 2.297 20 0 BEADLO CC1(C)C[C@H]1[NH2+][C@@H](c1ncc[nH]1)c1ccccn1 ZINC000278639640 386557861 /nfs/dbraw/zinc/55/78/61/386557861.db2.gz HMAORADYFJEBGJ-VXGBXAGGSA-N 1 2 242.326 2.282 20 0 BEADLO Oc1cc(F)cc(C[N@H+]2CC[C@@H](F)C2)c1 ZINC000335405545 386563980 /nfs/dbraw/zinc/56/39/80/386563980.db2.gz CTZBBXCDTFNTDH-SECBINFHSA-N 1 2 213.227 2.075 20 0 BEADLO COc1ccc(F)c(C[N@@H+]2CC[C@@H](F)C2)c1 ZINC000335406868 386566671 /nfs/dbraw/zinc/56/66/71/386566671.db2.gz QBIGKZLOFADGCQ-SNVBAGLBSA-N 1 2 227.254 2.378 20 0 BEADLO COc1ccc(F)c(C[N@H+]2CC[C@@H](F)C2)c1 ZINC000335406868 386566677 /nfs/dbraw/zinc/56/66/77/386566677.db2.gz QBIGKZLOFADGCQ-SNVBAGLBSA-N 1 2 227.254 2.378 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2ccn(-c3ccccc3)n2)C1 ZINC000335408167 386568776 /nfs/dbraw/zinc/56/87/76/386568776.db2.gz WLQQRQHVCABZSQ-GFCCVEGCSA-N 1 2 245.301 2.416 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2ccn(-c3ccccc3)n2)C1 ZINC000335408167 386568781 /nfs/dbraw/zinc/56/87/81/386568781.db2.gz WLQQRQHVCABZSQ-GFCCVEGCSA-N 1 2 245.301 2.416 20 0 BEADLO c1nc(N2CCCC2)cc(NC2CCCC2)[nH+]1 ZINC000243530967 386569037 /nfs/dbraw/zinc/56/90/37/386569037.db2.gz ODIZCQFDAOLXQN-UHFFFAOYSA-N 1 2 232.331 2.431 20 0 BEADLO c1nc(NC2CCCC2)cc(N2CCCC2)[nH+]1 ZINC000243530967 386569045 /nfs/dbraw/zinc/56/90/45/386569045.db2.gz ODIZCQFDAOLXQN-UHFFFAOYSA-N 1 2 232.331 2.431 20 0 BEADLO CC(C(=O)N[C@@H](C)Cn1cc[nH+]c1)=C1CCCC1 ZINC000267901066 386597953 /nfs/dbraw/zinc/59/79/53/386597953.db2.gz ZUNCUIWWTBHYTF-NSHDSACASA-N 1 2 247.342 2.278 20 0 BEADLO Cn1c[nH+]cc1C[S@@](=O)CC1CCCCC1 ZINC000268118145 386622845 /nfs/dbraw/zinc/62/28/45/386622845.db2.gz AULINIZUDQRPRF-INIZCTEOSA-N 1 2 240.372 2.249 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H]1CCC[C@H](F)C1 ZINC000335499119 386625450 /nfs/dbraw/zinc/62/54/50/386625450.db2.gz AYBGTDYRNKSGKJ-QWRGUYRKSA-N 1 2 236.290 2.279 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H]1CCC[C@@H](F)C1 ZINC000335499121 386625916 /nfs/dbraw/zinc/62/59/16/386625916.db2.gz AYBGTDYRNKSGKJ-WDEREUQCSA-N 1 2 236.290 2.279 20 0 BEADLO CC1=C[C@@H](C)C[N@H+](Cc2nn(C)cc2Cl)C1 ZINC000335505357 386636232 /nfs/dbraw/zinc/63/62/32/386636232.db2.gz YMOUMTGHXUZJGE-SECBINFHSA-N 1 2 239.750 2.472 20 0 BEADLO CC1=C[C@@H](C)C[N@@H+](Cc2nn(C)cc2Cl)C1 ZINC000335505357 386636237 /nfs/dbraw/zinc/63/62/37/386636237.db2.gz YMOUMTGHXUZJGE-SECBINFHSA-N 1 2 239.750 2.472 20 0 BEADLO CC(C)CC1(C(=O)NCCn2cc[nH+]c2)CCC1 ZINC000268258852 386637045 /nfs/dbraw/zinc/63/70/45/386637045.db2.gz DQQKYKQVYWDCTA-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO CC[C@H]1CCC[C@H]1NC(=O)c1c[nH+]c(C)[nH]1 ZINC000268270900 386637530 /nfs/dbraw/zinc/63/75/30/386637530.db2.gz SNTOWPCZNLQUHL-VHSXEESVSA-N 1 2 221.304 2.027 20 0 BEADLO CCCCN(C(=O)Cc1[nH]c[nH+]c1C)C1CC1 ZINC000279131487 386638156 /nfs/dbraw/zinc/63/81/56/386638156.db2.gz BWDUBHWCABNKPX-UHFFFAOYSA-N 1 2 235.331 2.052 20 0 BEADLO CC(C)n1ccc(CN[C@H](C)c2[nH+]ccn2C)n1 ZINC000520267595 386641011 /nfs/dbraw/zinc/64/10/11/386641011.db2.gz RQGUAMRJRNKNSH-LLVKDONJSA-N 1 2 247.346 2.048 20 0 BEADLO CC(C)n1ccc(C[NH2+][C@H](C)c2nccn2C)n1 ZINC000520267595 386641016 /nfs/dbraw/zinc/64/10/16/386641016.db2.gz RQGUAMRJRNKNSH-LLVKDONJSA-N 1 2 247.346 2.048 20 0 BEADLO CCc1cc(N[C@@H](CO)C[C@H](C)CC)nc[nH+]1 ZINC000645355003 386642022 /nfs/dbraw/zinc/64/20/22/386642022.db2.gz FOOYZLPSTZDCHJ-ZYHUDNBSSA-N 1 2 237.347 2.248 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N([C@H](C)C1CC1)C1CC1 ZINC000279195490 386644841 /nfs/dbraw/zinc/64/48/41/386644841.db2.gz KDAUJXWOOWUIKD-SNVBAGLBSA-N 1 2 247.342 2.050 20 0 BEADLO CC(C)CC[C@@H](C)NC(=O)CCc1[nH]cc[nH+]1 ZINC000279186141 386646244 /nfs/dbraw/zinc/64/62/44/386646244.db2.gz KUUIXNKIHPYTGZ-LLVKDONJSA-N 1 2 237.347 2.283 20 0 BEADLO FC[C@H]1CCC[N@@H+]1Cc1nccs1 ZINC000292912996 386648388 /nfs/dbraw/zinc/64/83/88/386648388.db2.gz BGBCZGQGYUTFML-MRVPVSSYSA-N 1 2 200.282 2.077 20 0 BEADLO FC[C@H]1CCC[N@H+]1Cc1nccs1 ZINC000292912996 386648389 /nfs/dbraw/zinc/64/83/89/386648389.db2.gz BGBCZGQGYUTFML-MRVPVSSYSA-N 1 2 200.282 2.077 20 0 BEADLO CN(C(=O)[C@H]1CCCc2[nH+]c[nH]c21)C(C)(C)C ZINC000335513620 386649186 /nfs/dbraw/zinc/64/91/86/386649186.db2.gz PHHFYOQMEQXLPT-VIFPVBQESA-N 1 2 235.331 2.087 20 0 BEADLO CCN(C(=O)Cc1[nH]c[nH+]c1C)c1ccccc1 ZINC000279207971 386650333 /nfs/dbraw/zinc/65/03/33/386650333.db2.gz LZYZQJLMFCLTDI-UHFFFAOYSA-N 1 2 243.310 2.314 20 0 BEADLO Cc1ncsc1C[N@@H+](C)Cc1cc(C)ncn1 ZINC000292320283 386650691 /nfs/dbraw/zinc/65/06/91/386650691.db2.gz BLEVQMFBRAROHQ-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO Cc1ncsc1C[N@H+](C)Cc1cc(C)ncn1 ZINC000292320283 386650695 /nfs/dbraw/zinc/65/06/95/386650695.db2.gz BLEVQMFBRAROHQ-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO Cc1cc(C[N@H+]2CCS[C@@H](C)[C@H]2C)no1 ZINC000246383871 386651416 /nfs/dbraw/zinc/65/14/16/386651416.db2.gz NLSPRJVZVSDVQU-ZJUUUORDSA-N 1 2 226.345 2.309 20 0 BEADLO Cc1cc(C[N@@H+]2CCS[C@@H](C)[C@H]2C)no1 ZINC000246383871 386651423 /nfs/dbraw/zinc/65/14/23/386651423.db2.gz NLSPRJVZVSDVQU-ZJUUUORDSA-N 1 2 226.345 2.309 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)C[C@H]1CC[C@@H](C)C1 ZINC000268432636 386651582 /nfs/dbraw/zinc/65/15/82/386651582.db2.gz NRUNEAZKLIMWAA-AGIUHOORSA-N 1 2 249.358 2.214 20 0 BEADLO C[C@H](Nc1cc[nH+]c2ccncc12)[C@@H]1CCOC1 ZINC000278874579 386599687 /nfs/dbraw/zinc/59/96/87/386599687.db2.gz ZRWROKHHAFBPDX-WDEREUQCSA-N 1 2 243.310 2.467 20 0 BEADLO Cc1cc(C)cc(C[N@@H+](C)Cc2nncn2C)c1 ZINC000278898042 386603056 /nfs/dbraw/zinc/60/30/56/386603056.db2.gz VBRTVEXLHOEWEL-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cc(C)cc(C[N@H+](C)Cc2nncn2C)c1 ZINC000278898042 386603062 /nfs/dbraw/zinc/60/30/62/386603062.db2.gz VBRTVEXLHOEWEL-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO CO[C@H](C)CCNc1cc[nH+]c2ccncc12 ZINC000267991385 386606491 /nfs/dbraw/zinc/60/64/91/386606491.db2.gz RNPBVYZKKPAWOJ-SNVBAGLBSA-N 1 2 231.299 2.467 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC[C@H]2c2cccnc2)o1 ZINC000328688459 386611930 /nfs/dbraw/zinc/61/19/30/386611930.db2.gz ZYSWACNCOASODI-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1nnc(C[N@H+]2CCC[C@H]2c2cccnc2)o1 ZINC000328688459 386611934 /nfs/dbraw/zinc/61/19/34/386611934.db2.gz ZYSWACNCOASODI-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1ccc(NC(=O)NC[C@@H]2C[C@@H]2C)c(C)[nH+]1 ZINC000268038435 386613537 /nfs/dbraw/zinc/61/35/37/386613537.db2.gz RKQHWQZMGQNJHT-KWQFWETISA-N 1 2 233.315 2.476 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@](C)(OC)C1CC1 ZINC000292060937 386615450 /nfs/dbraw/zinc/61/54/50/386615450.db2.gz NWLVIABZKQTPML-CQSZACIVSA-N 1 2 248.326 2.398 20 0 BEADLO CC[C@H]1CN(Cc2c[nH+]cn2C(C)C)CCO1 ZINC000425329806 386660807 /nfs/dbraw/zinc/66/08/07/386660807.db2.gz UKJFQWYSOZIQLF-ZDUSSCGKSA-N 1 2 237.347 2.075 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)N[C@@H]1CC12CC2 ZINC000644999542 386661262 /nfs/dbraw/zinc/66/12/62/386661262.db2.gz JULRXVQHAHYIPL-SNVBAGLBSA-N 1 2 242.282 2.008 20 0 BEADLO Cc1cnc(NCCc2[nH+]cccc2C)s1 ZINC000450741579 386664376 /nfs/dbraw/zinc/66/43/76/386664376.db2.gz ZPRKUMGMVTYKAP-UHFFFAOYSA-N 1 2 233.340 2.231 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1CCOC[C@H]1C ZINC000335527094 386670476 /nfs/dbraw/zinc/67/04/76/386670476.db2.gz FQBQIDNRABCPNJ-ZYHUDNBSSA-N 1 2 248.326 2.310 20 0 BEADLO Cc1nc(N(C)Cc2nccs2)c(C)c(C)[nH+]1 ZINC000301705240 386670655 /nfs/dbraw/zinc/67/06/55/386670655.db2.gz VHNJOJABSYCYOL-UHFFFAOYSA-N 1 2 248.355 2.495 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CC[C@H](C)[C@@H](C)C1 ZINC000520426553 386671345 /nfs/dbraw/zinc/67/13/45/386671345.db2.gz LRXYUYZMSNQBDT-TUAOUCFPSA-N 1 2 249.358 2.093 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CC[C@H](C)[C@@H](C)C1 ZINC000520426553 386671350 /nfs/dbraw/zinc/67/13/50/386671350.db2.gz LRXYUYZMSNQBDT-TUAOUCFPSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1CO[C@H](C)C1 ZINC000335527342 386672646 /nfs/dbraw/zinc/67/26/46/386672646.db2.gz IBTNEKXJPGWHIW-KOLCDFICSA-N 1 2 234.299 2.062 20 0 BEADLO Cc1ncoc1C(=O)Nc1c(C)cc[nH+]c1C ZINC000335528356 386672756 /nfs/dbraw/zinc/67/27/56/386672756.db2.gz MXWOGUVPVIGOII-UHFFFAOYSA-N 1 2 231.255 2.247 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)C[C@@H]1CCCO1 ZINC000335528173 386673566 /nfs/dbraw/zinc/67/35/66/386673566.db2.gz BALFFGADRWPPQP-NSHDSACASA-N 1 2 234.299 2.206 20 0 BEADLO CC[C@H](F)C[NH2+][C@H](C)c1ncc(C)o1 ZINC000336648112 386679627 /nfs/dbraw/zinc/67/96/27/386679627.db2.gz GGTJCSJHNLIUOW-BDAKNGLRSA-N 1 2 200.257 2.382 20 0 BEADLO CCc1ncc(C[NH2+][C@H](C)C(C)(F)F)cn1 ZINC000414473370 386657899 /nfs/dbraw/zinc/65/78/99/386657899.db2.gz VFYBVZLJCAGTLV-MRVPVSSYSA-N 1 2 229.274 2.172 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NCC1CCCCC1 ZINC000279618005 386710191 /nfs/dbraw/zinc/71/01/91/386710191.db2.gz JSFWMOVLRWHJKT-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NCC1CCCCC1 ZINC000279618005 386710199 /nfs/dbraw/zinc/71/01/99/386710199.db2.gz JSFWMOVLRWHJKT-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2nc3ccccc3[nH]2)C1 ZINC000335483520 386711505 /nfs/dbraw/zinc/71/15/05/386711505.db2.gz XHZNHBSRTTVZQE-CYBMUJFWSA-N 1 2 233.290 2.497 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2nc3ccccc3[nH]2)C1 ZINC000335483520 386711511 /nfs/dbraw/zinc/71/15/11/386711511.db2.gz XHZNHBSRTTVZQE-CYBMUJFWSA-N 1 2 233.290 2.497 20 0 BEADLO Cc1nnc(C[N@H+]2C[C@@H](C)[C@@H]2c2ccccc2)[nH]1 ZINC000292514651 386683450 /nfs/dbraw/zinc/68/34/50/386683450.db2.gz NPYBTGXYXVWEBH-QMTHXVAHSA-N 1 2 242.326 2.306 20 0 BEADLO Cc1nnc(C[N@@H+]2C[C@@H](C)[C@@H]2c2ccccc2)[nH]1 ZINC000292514651 386683452 /nfs/dbraw/zinc/68/34/52/386683452.db2.gz NPYBTGXYXVWEBH-QMTHXVAHSA-N 1 2 242.326 2.306 20 0 BEADLO COC(=O)[C@@H](CC1CC1)[NH2+]Cc1cccs1 ZINC000414480557 386684092 /nfs/dbraw/zinc/68/40/92/386684092.db2.gz BGCQNFWTSVOTPE-LLVKDONJSA-N 1 2 239.340 2.179 20 0 BEADLO CC[C@H](NC(=O)[C@@H](C)C(C)(F)F)c1[nH]cc[nH+]1 ZINC000328534673 386685964 /nfs/dbraw/zinc/68/59/64/386685964.db2.gz ZPMTVIIPFCSALV-SFYZADRCSA-N 1 2 245.273 2.268 20 0 BEADLO c1ncc(C[NH2+][C@@H]2CCCc3cn[nH]c32)s1 ZINC000269001010 386699549 /nfs/dbraw/zinc/69/95/49/386699549.db2.gz ZOWNPVPFJVMZQG-SNVBAGLBSA-N 1 2 234.328 2.033 20 0 BEADLO OC1(CCOc2ccccc2-n2cc[nH+]c2)CC1 ZINC000526949730 386702403 /nfs/dbraw/zinc/70/24/03/386702403.db2.gz YWQCMGBUTDGQHU-UHFFFAOYSA-N 1 2 244.294 2.166 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CCC[C@@H](C)[C@@H]2C)c[nH+]1 ZINC000264603341 386706306 /nfs/dbraw/zinc/70/63/06/386706306.db2.gz FKFPTQXFWFGMEL-WCABBAIRSA-N 1 2 235.331 2.273 20 0 BEADLO CC(C)(C)c1cnc(C[N@@H+]2CC[C@H](O)C2)s1 ZINC000279756250 386730850 /nfs/dbraw/zinc/73/08/50/386730850.db2.gz DFTAANBWWFKKSJ-VIFPVBQESA-N 1 2 240.372 2.007 20 0 BEADLO CC(C)(C)c1cnc(C[N@H+]2CC[C@H](O)C2)s1 ZINC000279756250 386730856 /nfs/dbraw/zinc/73/08/56/386730856.db2.gz DFTAANBWWFKKSJ-VIFPVBQESA-N 1 2 240.372 2.007 20 0 BEADLO CC[C@H]([NH2+][C@@H]1C[C@H]1Cc1ccccc1)C(=O)OC ZINC000279739336 386732461 /nfs/dbraw/zinc/73/24/61/386732461.db2.gz KKUJVVKFINNWOC-HZSPNIEDSA-N 1 2 247.338 2.159 20 0 BEADLO CCCc1nnc(SCc2c[nH+]cn2C)o1 ZINC000269004641 386733943 /nfs/dbraw/zinc/73/39/43/386733943.db2.gz DUHSQRPOXWZLDH-UHFFFAOYSA-N 1 2 238.316 2.048 20 0 BEADLO CCN(C(=O)CCc1[nH]cc[nH+]1)C1CCCC1 ZINC000357085207 386713414 /nfs/dbraw/zinc/71/34/14/386713414.db2.gz FOOUFGPBUCFPTG-UHFFFAOYSA-N 1 2 235.331 2.133 20 0 BEADLO FC1(C[N@@H+]2CCCC[C@@H]2c2ncc[nH]2)CC1 ZINC000526971432 386714495 /nfs/dbraw/zinc/71/44/95/386714495.db2.gz FYCGROJVGLJQRT-SNVBAGLBSA-N 1 2 223.295 2.439 20 0 BEADLO FC1(C[N@H+]2CCCC[C@@H]2c2ncc[nH]2)CC1 ZINC000526971432 386714500 /nfs/dbraw/zinc/71/45/00/386714500.db2.gz FYCGROJVGLJQRT-SNVBAGLBSA-N 1 2 223.295 2.439 20 0 BEADLO CCc1ccc([C@@H](C)[NH2+]Cc2nccn2C)o1 ZINC000268925112 386720032 /nfs/dbraw/zinc/72/00/32/386720032.db2.gz RJWXNVRZLITPJL-SNVBAGLBSA-N 1 2 233.315 2.426 20 0 BEADLO CN(CC[N@H+](C)Cc1cocn1)c1ccccc1 ZINC000191941926 386723599 /nfs/dbraw/zinc/72/35/99/386723599.db2.gz QMCBOBBUCJZZGA-UHFFFAOYSA-N 1 2 245.326 2.243 20 0 BEADLO CN(CC[N@@H+](C)Cc1cocn1)c1ccccc1 ZINC000191941926 386723602 /nfs/dbraw/zinc/72/36/02/386723602.db2.gz QMCBOBBUCJZZGA-UHFFFAOYSA-N 1 2 245.326 2.243 20 0 BEADLO COC(=O)[C@@H](c1ccccc1)[N@H+](C)CCCF ZINC000268957355 386726535 /nfs/dbraw/zinc/72/65/35/386726535.db2.gz VZIKBGKSFVGTBJ-GFCCVEGCSA-N 1 2 239.290 2.192 20 0 BEADLO COC(=O)[C@@H](c1ccccc1)[N@@H+](C)CCCF ZINC000268957355 386726540 /nfs/dbraw/zinc/72/65/40/386726540.db2.gz VZIKBGKSFVGTBJ-GFCCVEGCSA-N 1 2 239.290 2.192 20 0 BEADLO COCc1cnc(C[NH+]2[C@@H](C)C[C@@H]2C)s1 ZINC000526989443 386726778 /nfs/dbraw/zinc/72/67/78/386726778.db2.gz CDUTXOZRXXGCGG-IUCAKERBSA-N 1 2 226.345 2.272 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCC[C@H]1CF ZINC000293036010 386769285 /nfs/dbraw/zinc/76/92/85/386769285.db2.gz LPBCRSULQIPXHJ-NSHDSACASA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCC[C@H]1CF ZINC000293036010 386769291 /nfs/dbraw/zinc/76/92/91/386769291.db2.gz LPBCRSULQIPXHJ-NSHDSACASA-N 1 2 225.311 2.398 20 0 BEADLO COC(=O)[C@H](C)[NH2+]C[C@H](C)Cc1ccccc1 ZINC000279873389 386749014 /nfs/dbraw/zinc/74/90/14/386749014.db2.gz JTGKLOBVCAOXSS-NEPJUHHUSA-N 1 2 235.327 2.016 20 0 BEADLO CC1(CC(=O)Nc2cc[nH+]cc2O)CCCC1 ZINC000348532099 386752620 /nfs/dbraw/zinc/75/26/20/386752620.db2.gz OMEHMLIYNGXKHW-UHFFFAOYSA-N 1 2 234.299 2.118 20 0 BEADLO CCC[C@H](CC)[S@](=O)Cc1[nH+]ccn1C ZINC000279913524 386755256 /nfs/dbraw/zinc/75/52/56/386755256.db2.gz DOHVPSGTBAXRNY-ZUZCIYMTSA-N 1 2 228.361 2.248 20 0 BEADLO CC[C@H]1CCC[C@H]1NC(=O)CCc1c[nH+]c[nH]1 ZINC000279903287 386755364 /nfs/dbraw/zinc/75/53/64/386755364.db2.gz MTHDCBIQMLRDBI-CMPLNLGQSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@H]1CCC[C@H]1NC(=O)CCc1c[nH]c[nH+]1 ZINC000279903287 386755368 /nfs/dbraw/zinc/75/53/68/386755368.db2.gz MTHDCBIQMLRDBI-CMPLNLGQSA-N 1 2 235.331 2.037 20 0 BEADLO COC(C)(C)CCSCCn1cc[nH+]c1 ZINC000344834594 386756668 /nfs/dbraw/zinc/75/66/68/386756668.db2.gz FKWGAEWHBQXESH-UHFFFAOYSA-N 1 2 228.361 2.431 20 0 BEADLO CCC[C@H](CC)[S@](=O)Cc1c[nH+]cn1C ZINC000280004385 386766811 /nfs/dbraw/zinc/76/68/11/386766811.db2.gz NDERJSDAVWCKLN-XHDPSFHLSA-N 1 2 228.361 2.248 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@H](C)c2ccccn2)ncn1 ZINC000293255731 386792154 /nfs/dbraw/zinc/79/21/54/386792154.db2.gz RRXWQENAMMJZCM-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cc(C[N@H+](C)[C@H](C)c2ccccn2)ncn1 ZINC000293255731 386792157 /nfs/dbraw/zinc/79/21/57/386792157.db2.gz RRXWQENAMMJZCM-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO CCC[C@](C)(CC)C(=O)NCCn1cc[nH+]c1 ZINC000280252732 386792775 /nfs/dbraw/zinc/79/27/75/386792775.db2.gz KTKIPTTZMPKODB-ZDUSSCGKSA-N 1 2 237.347 2.216 20 0 BEADLO COc1cc(C)nc(C[N@@H+]2CCC[C@H]2CF)c1 ZINC000293114792 386779055 /nfs/dbraw/zinc/77/90/55/386779055.db2.gz RCDFXARYYYAFNP-LBPRGKRZSA-N 1 2 238.306 2.333 20 0 BEADLO COc1cc(C)nc(C[N@H+]2CCC[C@H]2CF)c1 ZINC000293114792 386779061 /nfs/dbraw/zinc/77/90/61/386779061.db2.gz RCDFXARYYYAFNP-LBPRGKRZSA-N 1 2 238.306 2.333 20 0 BEADLO CO[C@H]1C[C@H](N(C)c2cc(C)[nH+]cn2)C12CCC2 ZINC000450861318 386779968 /nfs/dbraw/zinc/77/99/68/386779968.db2.gz PMULZQNXCCNUGS-RYUDHWBXSA-N 1 2 247.342 2.179 20 0 BEADLO Fc1ccc(C[NH2+]Cc2cocn2)c(F)c1 ZINC000336667461 386782159 /nfs/dbraw/zinc/78/21/59/386782159.db2.gz FVDHQPRJFBABQN-UHFFFAOYSA-N 1 2 224.210 2.243 20 0 BEADLO C[C@H](CC1CCCC1)C(=O)Nc1cc[nH+]cc1O ZINC000330543897 386783504 /nfs/dbraw/zinc/78/35/04/386783504.db2.gz JGZGJGHTKZUFGR-SNVBAGLBSA-N 1 2 248.326 2.364 20 0 BEADLO CC[C@H]1CCCC[C@H]1C(=O)NCc1[nH]cc[nH+]1 ZINC000280475370 386818036 /nfs/dbraw/zinc/81/80/36/386818036.db2.gz IQDZBBJPXYUHHY-WDEREUQCSA-N 1 2 235.331 2.242 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)CC2(C)CC2)c2[nH+]ccn21 ZINC000334770518 386821005 /nfs/dbraw/zinc/82/10/05/386821005.db2.gz QQUVJNKMWYGZTA-NXEZZACHSA-N 1 2 233.315 2.195 20 0 BEADLO Cn1cc2c(n1)CCC[C@H]2[NH2+]Cc1cscn1 ZINC000280256348 386797781 /nfs/dbraw/zinc/79/77/81/386797781.db2.gz WYBMRCWKWMMZQY-LLVKDONJSA-N 1 2 248.355 2.044 20 0 BEADLO CO[C@@]1(C)CCCN(c2cccc[nH+]2)CC1 ZINC000280281919 386798038 /nfs/dbraw/zinc/79/80/38/386798038.db2.gz PVAQSZPWSXOVFS-ZDUSSCGKSA-N 1 2 220.316 2.477 20 0 BEADLO CCCC[NH2+][C@@H](c1cccs1)c1nnc[nH]1 ZINC000293279223 386798317 /nfs/dbraw/zinc/79/83/17/386798317.db2.gz CUJWPKVIHUROJJ-JTQLQIEISA-N 1 2 236.344 2.345 20 0 BEADLO CC[C@H]1CCCC[C@H]1C(=O)NCc1[nH+]ccn1C ZINC000280584473 386826184 /nfs/dbraw/zinc/82/61/84/386826184.db2.gz SIKDTASIXGDUQO-NWDGAFQWSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1cnc(C[NH2+][C@@H]2CCCc3occc32)n1C ZINC000341087347 386835145 /nfs/dbraw/zinc/83/51/45/386835145.db2.gz FIRAXVHQWJLOEH-GFCCVEGCSA-N 1 2 245.326 2.489 20 0 BEADLO Cc1c[nH+]c(CN[C@@H]2CCCc3occc32)n1C ZINC000341087347 386835147 /nfs/dbraw/zinc/83/51/47/386835147.db2.gz FIRAXVHQWJLOEH-GFCCVEGCSA-N 1 2 245.326 2.489 20 0 BEADLO COCc1cccc(NCc2[nH+]cc(C)n2C)c1 ZINC000341121269 386842018 /nfs/dbraw/zinc/84/20/18/386842018.db2.gz JVEHTBBOEKJOKE-UHFFFAOYSA-N 1 2 245.326 2.487 20 0 BEADLO Nc1nc(NC2CC=CC2)[nH+]c2ccccc12 ZINC000301923773 386891513 /nfs/dbraw/zinc/89/15/13/386891513.db2.gz YELHEYRVFPHUJM-UHFFFAOYSA-N 1 2 226.283 2.343 20 0 BEADLO CSCCN(C)c1nc(N)c2ccccc2[nH+]1 ZINC000301915998 386891597 /nfs/dbraw/zinc/89/15/97/386891597.db2.gz VPPOXSMARZDUNN-UHFFFAOYSA-N 1 2 248.355 2.011 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)COCC1CC1 ZINC000331453844 386855707 /nfs/dbraw/zinc/85/57/07/386855707.db2.gz DICBIPAOCUHSCU-UHFFFAOYSA-N 1 2 234.299 2.064 20 0 BEADLO Cc1ccc(C)c(C[NH+]2CC(O)(C(F)F)C2)c1 ZINC000425345185 386857155 /nfs/dbraw/zinc/85/71/55/386857155.db2.gz FSVJDJHMSMSLFC-UHFFFAOYSA-N 1 2 241.281 2.115 20 0 BEADLO CCC1(C(=O)N2CCC(c3c[nH+]c[nH]3)CC2)CC1 ZINC000334791935 386857706 /nfs/dbraw/zinc/85/77/06/386857706.db2.gz FTPQYHFZSGTTIM-UHFFFAOYSA-N 1 2 247.342 2.306 20 0 BEADLO CCC1(C(=O)N2CCC(c3c[nH]c[nH+]3)CC2)CC1 ZINC000334791935 386857709 /nfs/dbraw/zinc/85/77/09/386857709.db2.gz FTPQYHFZSGTTIM-UHFFFAOYSA-N 1 2 247.342 2.306 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccon1)c1ccncc1 ZINC000336744527 386858840 /nfs/dbraw/zinc/85/88/40/386858840.db2.gz QCVSNASAGCUTSK-ZJUUUORDSA-N 1 2 217.272 2.481 20 0 BEADLO Cn1cc(C[N@H+](C)Cc2ccc(Cl)o2)cn1 ZINC000349542217 386860116 /nfs/dbraw/zinc/86/01/16/386860116.db2.gz LUVRJDLQJJRZSM-UHFFFAOYSA-N 1 2 239.706 2.299 20 0 BEADLO Cn1cc(C[N@@H+](C)Cc2ccc(Cl)o2)cn1 ZINC000349542217 386860121 /nfs/dbraw/zinc/86/01/21/386860121.db2.gz LUVRJDLQJJRZSM-UHFFFAOYSA-N 1 2 239.706 2.299 20 0 BEADLO CCOC[C@H]1CCN(c2nc(C)[nH+]c(C)c2C)C1 ZINC000301632125 386860341 /nfs/dbraw/zinc/86/03/41/386860341.db2.gz BUIUMNACAJIGAV-ZDUSSCGKSA-N 1 2 249.358 2.265 20 0 BEADLO Cc1nc(N(C)C[C@H]2CCCO2)c(C)c(C)[nH+]1 ZINC000301630383 386861679 /nfs/dbraw/zinc/86/16/79/386861679.db2.gz BGLPSNKZGSOKKE-GFCCVEGCSA-N 1 2 235.331 2.017 20 0 BEADLO CC[C@]1(C)C[C@@H]1c1nc(Cc2c[nH+]cn2C)no1 ZINC000357930296 386867602 /nfs/dbraw/zinc/86/76/02/386867602.db2.gz FOQMCQDCGDSXPA-ZWNOBZJWSA-N 1 2 246.314 2.298 20 0 BEADLO Cc1nocc1C[N@@H+](C)Cc1ccccn1 ZINC000293731707 386870120 /nfs/dbraw/zinc/87/01/20/386870120.db2.gz WKLNGJOQVOZEPA-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1nocc1C[N@H+](C)Cc1ccccn1 ZINC000293731707 386870124 /nfs/dbraw/zinc/87/01/24/386870124.db2.gz WKLNGJOQVOZEPA-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1nnc([C@@H](C)[NH+]2CCC(C(F)F)CC2)o1 ZINC000334833431 386873221 /nfs/dbraw/zinc/87/32/21/386873221.db2.gz NORDUNZFIWVUPL-SSDOTTSWSA-N 1 2 245.273 2.416 20 0 BEADLO C[C@H]([NH2+][C@H](c1cccs1)c1nnc[nH]1)C1CC1 ZINC000293757915 386874789 /nfs/dbraw/zinc/87/47/89/386874789.db2.gz ORBLWTQQFLWSMG-GZMMTYOYSA-N 1 2 248.355 2.344 20 0 BEADLO C[C@H]([NH2+][C@@H](c1cccs1)c1nnc[nH]1)C1CC1 ZINC000293757927 386874900 /nfs/dbraw/zinc/87/49/00/386874900.db2.gz ORBLWTQQFLWSMG-KWQFWETISA-N 1 2 248.355 2.344 20 0 BEADLO CC(C)c1nc(N(C)C)nc(NC2CC=CC2)[nH+]1 ZINC000301969013 386894687 /nfs/dbraw/zinc/89/46/87/386894687.db2.gz QAGNAJGOFBOJFY-UHFFFAOYSA-N 1 2 247.346 2.192 20 0 BEADLO CC(C)Cn1cc[nH+]c1CNc1ncc(F)cn1 ZINC000301758015 386875902 /nfs/dbraw/zinc/87/59/02/386875902.db2.gz FCCIRMCCHIBCCS-UHFFFAOYSA-N 1 2 249.293 2.080 20 0 BEADLO CC(C)c1nc(NC2CC=CC2)nc(N(C)C)[nH+]1 ZINC000301969013 386894691 /nfs/dbraw/zinc/89/46/91/386894691.db2.gz QAGNAJGOFBOJFY-UHFFFAOYSA-N 1 2 247.346 2.192 20 0 BEADLO Cc1nc(N2CCC[C@H]2C[C@H](C)O)c(C)c(C)[nH+]1 ZINC000301771026 386877733 /nfs/dbraw/zinc/87/77/33/386877733.db2.gz KSYHWUFBWQWWBJ-ZANVPECISA-N 1 2 249.358 2.142 20 0 BEADLO CN(C(=O)CCn1cc[nH+]c1)[C@H]1CCC(C)(C)C1 ZINC000358044108 386883832 /nfs/dbraw/zinc/88/38/32/386883832.db2.gz FQRPGEHASPCAPC-LBPRGKRZSA-N 1 2 249.358 2.310 20 0 BEADLO c1coc(C[N@@H+]2C[C@@]3(CCCO3)[C@@H]2C2CC2)c1 ZINC000293862122 386890998 /nfs/dbraw/zinc/89/09/98/386890998.db2.gz CBKKWDULSWSILZ-KBPBESRZSA-N 1 2 233.311 2.423 20 0 BEADLO c1coc(C[N@H+]2C[C@@]3(CCCO3)[C@@H]2C2CC2)c1 ZINC000293862122 386891005 /nfs/dbraw/zinc/89/10/05/386891005.db2.gz CBKKWDULSWSILZ-KBPBESRZSA-N 1 2 233.311 2.423 20 0 BEADLO c1ncc(C[N@@H+]2CCO[C@@H](C3CCC3)C2)s1 ZINC000334862220 386914786 /nfs/dbraw/zinc/91/47/86/386914786.db2.gz JERKTCKZHQPQOG-GFCCVEGCSA-N 1 2 238.356 2.144 20 0 BEADLO c1ncc(C[N@H+]2CCO[C@@H](C3CCC3)C2)s1 ZINC000334862220 386914789 /nfs/dbraw/zinc/91/47/89/386914789.db2.gz JERKTCKZHQPQOG-GFCCVEGCSA-N 1 2 238.356 2.144 20 0 BEADLO Cc1cnc([C@H](C)[NH2+][C@H](C)c2cnn(C)c2C)o1 ZINC000330832079 386900793 /nfs/dbraw/zinc/90/07/93/386900793.db2.gz HIIDERZVYYTKKK-ZJUUUORDSA-N 1 2 248.330 2.437 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C1CCC1)C1CCC1 ZINC000293919245 386903718 /nfs/dbraw/zinc/90/37/18/386903718.db2.gz PFSNATPDOASXIO-UHFFFAOYSA-N 1 2 247.342 2.194 20 0 BEADLO CCC1(C(=O)NCc2c[nH+]c[nH]2)CCCCC1 ZINC000330887107 386908018 /nfs/dbraw/zinc/90/80/18/386908018.db2.gz FGYAREIOAAVOBS-UHFFFAOYSA-N 1 2 235.331 2.386 20 0 BEADLO CCC1(C(=O)NCc2c[nH]c[nH+]2)CCCCC1 ZINC000330887107 386908023 /nfs/dbraw/zinc/90/80/23/386908023.db2.gz FGYAREIOAAVOBS-UHFFFAOYSA-N 1 2 235.331 2.386 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@H](C3CCC3)C2)cn1 ZINC000334861087 386912655 /nfs/dbraw/zinc/91/26/55/386912655.db2.gz BMRORWMGZYMYNV-HNNXBMFYSA-N 1 2 246.354 2.391 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@H](C3CCC3)C2)cn1 ZINC000334861087 386912659 /nfs/dbraw/zinc/91/26/59/386912659.db2.gz BMRORWMGZYMYNV-HNNXBMFYSA-N 1 2 246.354 2.391 20 0 BEADLO CC(C)c1nc(NCC2(CCO)CC2)cc[nH+]1 ZINC000302401876 386921737 /nfs/dbraw/zinc/92/17/37/386921737.db2.gz FCSINCRQBSNWLJ-UHFFFAOYSA-N 1 2 235.331 2.175 20 0 BEADLO CC(C)CCCNC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000330943272 386926667 /nfs/dbraw/zinc/92/66/67/386926667.db2.gz FKGWUDAHJAYKOC-UHFFFAOYSA-N 1 2 237.347 2.240 20 0 BEADLO CC(C)c1nccc(NCc2ccc(N)[nH+]c2)n1 ZINC000302779098 386935884 /nfs/dbraw/zinc/93/58/84/386935884.db2.gz QOGLIGFNXDZGIU-UHFFFAOYSA-N 1 2 243.314 2.189 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ccccc1F)c1ncnn1C ZINC000352900509 386954885 /nfs/dbraw/zinc/95/48/85/386954885.db2.gz JLYZANGILBGZOB-NXEZZACHSA-N 1 2 248.305 2.366 20 0 BEADLO CC(C)CCC(=O)N[C@@H](c1[nH+]ccn1C)C1CC1 ZINC000341719086 386955603 /nfs/dbraw/zinc/95/56/03/386955603.db2.gz MFJQPLMEVCNLHV-CYBMUJFWSA-N 1 2 249.358 2.424 20 0 BEADLO CC[C@@H](SC)C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000331031911 386959488 /nfs/dbraw/zinc/95/94/88/386959488.db2.gz GYAXHJJXRBTMTJ-DTWKUNHWSA-N 1 2 241.360 2.119 20 0 BEADLO CO[C@@H](C(=O)Nc1c(C)cc[nH+]c1C)C1CC1 ZINC000332180523 386966016 /nfs/dbraw/zinc/96/60/16/386966016.db2.gz WKQFGEXQRCNYRC-GFCCVEGCSA-N 1 2 234.299 2.062 20 0 BEADLO CC[C@H](F)C[NH2+]C1(c2noc(C)n2)CCCC1 ZINC000332370948 386974596 /nfs/dbraw/zinc/97/45/96/386974596.db2.gz LXZJYVGEUKZUPJ-JTQLQIEISA-N 1 2 241.310 2.485 20 0 BEADLO CC(C)[C@H](C)[N@H+](C)Cc1noc(C2CC2)n1 ZINC000341837211 386976957 /nfs/dbraw/zinc/97/69/57/386976957.db2.gz MUKLFNZDINFSEC-VIFPVBQESA-N 1 2 223.320 2.423 20 0 BEADLO CC(C)[C@H](C)[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000341837211 386976963 /nfs/dbraw/zinc/97/69/63/386976963.db2.gz MUKLFNZDINFSEC-VIFPVBQESA-N 1 2 223.320 2.423 20 0 BEADLO Cc1cc(CNc2c[nH+]ccc2C)n(C)n1 ZINC000334908649 386981904 /nfs/dbraw/zinc/98/19/04/386981904.db2.gz HQGMHGRMJHUSMA-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO Cc1cc(CNc2ccc(C)[nH+]c2C)n(C)n1 ZINC000334913069 386987926 /nfs/dbraw/zinc/98/79/26/386987926.db2.gz WLYMUPHJOKQLFL-UHFFFAOYSA-N 1 2 230.315 2.352 20 0 BEADLO CC(C)CC(C)(C)C(=O)NCc1c[nH+]c[nH]1 ZINC000331284608 386996333 /nfs/dbraw/zinc/99/63/33/386996333.db2.gz HHTJEPGKYDPERK-UHFFFAOYSA-N 1 2 223.320 2.098 20 0 BEADLO CC(C)CC(C)(C)C(=O)NCc1c[nH]c[nH+]1 ZINC000331284608 386996338 /nfs/dbraw/zinc/99/63/38/386996338.db2.gz HHTJEPGKYDPERK-UHFFFAOYSA-N 1 2 223.320 2.098 20 0 BEADLO C[C@@H]1C[N@H+](CCc2cnn[nH]2)[C@@H]1c1ccccc1 ZINC000647966391 386999207 /nfs/dbraw/zinc/99/92/07/386999207.db2.gz QSVWZASQMRQPRD-RISCZKNCSA-N 1 2 242.326 2.040 20 0 BEADLO C[C@@H]1C[N@@H+](CCc2cnn[nH]2)[C@@H]1c1ccccc1 ZINC000647966391 386999211 /nfs/dbraw/zinc/99/92/11/386999211.db2.gz QSVWZASQMRQPRD-RISCZKNCSA-N 1 2 242.326 2.040 20 0 BEADLO CC[C@H]1COCC[N@@H+]1C/C=C(\C)Cl ZINC000528378865 387037842 /nfs/dbraw/zinc/03/78/42/387037842.db2.gz BNEQCGNPCJSPQW-LLGDCAAFSA-N 1 2 203.713 2.240 20 0 BEADLO CC[C@H]1COCC[N@H+]1C/C=C(\C)Cl ZINC000528378865 387037846 /nfs/dbraw/zinc/03/78/46/387037846.db2.gz BNEQCGNPCJSPQW-LLGDCAAFSA-N 1 2 203.713 2.240 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@@H]2CCC[C@H](C)C2)c[nH+]1 ZINC000264827032 387039580 /nfs/dbraw/zinc/03/95/80/387039580.db2.gz IGIMELSKVOALJF-GXSJLCMTSA-N 1 2 235.331 2.274 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)[C@H]1CCC(C)(C)C1 ZINC000359065279 387051830 /nfs/dbraw/zinc/05/18/30/387051830.db2.gz SSDMFTFLWZNTNX-NEPJUHHUSA-N 1 2 249.358 2.214 20 0 BEADLO CCSCC[N@@H+]1CCOC[C@@H]1c1ccco1 ZINC000369624627 387058470 /nfs/dbraw/zinc/05/84/70/387058470.db2.gz ANRWWRBPEYNYEB-LLVKDONJSA-N 1 2 241.356 2.406 20 0 BEADLO CCSCC[N@H+]1CCOC[C@@H]1c1ccco1 ZINC000369624627 387058476 /nfs/dbraw/zinc/05/84/76/387058476.db2.gz ANRWWRBPEYNYEB-LLVKDONJSA-N 1 2 241.356 2.406 20 0 BEADLO CC(C)(C)n1cc(C[N@@H+]2CC[C@@H](F)C2)cn1 ZINC000336222788 387061087 /nfs/dbraw/zinc/06/10/87/387061087.db2.gz KMCDOZSASMHGLR-LLVKDONJSA-N 1 2 225.311 2.182 20 0 BEADLO CC(C)(C)n1cc(C[N@H+]2CC[C@@H](F)C2)cn1 ZINC000336222788 387061090 /nfs/dbraw/zinc/06/10/90/387061090.db2.gz KMCDOZSASMHGLR-LLVKDONJSA-N 1 2 225.311 2.182 20 0 BEADLO Cc1cc(NC[C@H]2CC23CCSCC3)nc[nH+]1 ZINC000334975111 387061990 /nfs/dbraw/zinc/06/19/90/387061990.db2.gz NYPASTOJWZQSAM-LLVKDONJSA-N 1 2 249.383 2.152 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccncc2F)C[C@H](C)O1 ZINC000336222221 387062217 /nfs/dbraw/zinc/06/22/17/387062217.db2.gz MKMRYRFZGPGKCQ-JQWIXIFHSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccncc2F)C[C@H](C)O1 ZINC000336222221 387062220 /nfs/dbraw/zinc/06/22/20/387062220.db2.gz MKMRYRFZGPGKCQ-JQWIXIFHSA-N 1 2 238.306 2.220 20 0 BEADLO CC(C)(C(=O)NC1CCCCC1)c1c[nH]c[nH+]1 ZINC000334935836 387012759 /nfs/dbraw/zinc/01/27/59/387012759.db2.gz YHXQBNNOGAQTJL-UHFFFAOYSA-N 1 2 235.331 2.136 20 0 BEADLO CSCC[N@@H+]1CCCC[C@@H]1c1noc(C)n1 ZINC000368998189 387023771 /nfs/dbraw/zinc/02/37/71/387023771.db2.gz DEDYMTDXQWMNTI-SNVBAGLBSA-N 1 2 241.360 2.268 20 0 BEADLO CSCC[N@H+]1CCCC[C@@H]1c1noc(C)n1 ZINC000368998189 387023775 /nfs/dbraw/zinc/02/37/75/387023775.db2.gz DEDYMTDXQWMNTI-SNVBAGLBSA-N 1 2 241.360 2.268 20 0 BEADLO CC(C)(C)NC(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000117562304 387024429 /nfs/dbraw/zinc/02/44/29/387024429.db2.gz GWBUESUWJMBPQP-UHFFFAOYSA-N 1 2 243.310 2.401 20 0 BEADLO CC(C)N(C)C(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000117591603 387024737 /nfs/dbraw/zinc/02/47/37/387024737.db2.gz MNZDUUFVHBUWIR-UHFFFAOYSA-N 1 2 243.310 2.353 20 0 BEADLO CCCn1cc(C[N@@H+]2CCO[C@@H]3CCC[C@H]32)cn1 ZINC000352382723 387130221 /nfs/dbraw/zinc/13/02/21/387130221.db2.gz GBVJZYYHPYUUGF-ZIAGYGMSSA-N 1 2 249.358 2.046 20 0 BEADLO CCCn1cc(C[N@H+]2CCO[C@@H]3CCC[C@H]32)cn1 ZINC000352382723 387130225 /nfs/dbraw/zinc/13/02/25/387130225.db2.gz GBVJZYYHPYUUGF-ZIAGYGMSSA-N 1 2 249.358 2.046 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@]12C[C@@H]1CCC2 ZINC000334986143 387073649 /nfs/dbraw/zinc/07/36/49/387073649.db2.gz ITBITAJBOVFHSG-FZMZJTMJSA-N 1 2 230.311 2.195 20 0 BEADLO CCc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)nc1 ZINC000336246063 387083157 /nfs/dbraw/zinc/08/31/57/387083157.db2.gz WXQWMJNQVXPHJU-VXGBXAGGSA-N 1 2 234.343 2.253 20 0 BEADLO OCC[C@@H]1CCCN(c2cccc[nH+]2)CC1 ZINC000334994032 387084051 /nfs/dbraw/zinc/08/40/51/387084051.db2.gz SDSWXGPQNVUNFU-GFCCVEGCSA-N 1 2 220.316 2.071 20 0 BEADLO Cc1cc(CNC(=O)NC2CCCC2)cc(C)[nH+]1 ZINC000334994459 387084446 /nfs/dbraw/zinc/08/44/46/387084446.db2.gz XZLPCGOPDADEJI-UHFFFAOYSA-N 1 2 247.342 2.440 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)c1cccc(Cl)c1 ZINC000070979200 387084965 /nfs/dbraw/zinc/08/49/65/387084965.db2.gz YFABMTVGJJZGEO-UHFFFAOYSA-N 1 2 249.701 2.335 20 0 BEADLO Cc1c(Cl)c(C[N@@H+]2C[C@H]3CCC[C@H]32)nn1C ZINC000334996434 387088048 /nfs/dbraw/zinc/08/80/48/387088048.db2.gz ZEZORBLNBQPGRS-MWLCHTKSSA-N 1 2 239.750 2.366 20 0 BEADLO Cc1c(Cl)c(C[N@H+]2C[C@H]3CCC[C@H]32)nn1C ZINC000334996434 387088050 /nfs/dbraw/zinc/08/80/50/387088050.db2.gz ZEZORBLNBQPGRS-MWLCHTKSSA-N 1 2 239.750 2.366 20 0 BEADLO CC[N@@H+]1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC000066849430 387092607 /nfs/dbraw/zinc/09/26/07/387092607.db2.gz ICDVVMCMBKFPKK-LBPRGKRZSA-N 1 2 227.254 2.358 20 0 BEADLO CC[N@H+]1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC000066849430 387092610 /nfs/dbraw/zinc/09/26/10/387092610.db2.gz ICDVVMCMBKFPKK-LBPRGKRZSA-N 1 2 227.254 2.358 20 0 BEADLO Cc1noc(C[N@@H+](C)Cc2ccc(F)c(C)c2)n1 ZINC000352351670 387094723 /nfs/dbraw/zinc/09/47/23/387094723.db2.gz ZKZGBENFKBUNBX-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO Cc1noc(C[N@H+](C)Cc2ccc(F)c(C)c2)n1 ZINC000352351670 387094726 /nfs/dbraw/zinc/09/47/26/387094726.db2.gz ZKZGBENFKBUNBX-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO COC(=O)C[N@H+](Cc1sccc1C)C(C)C ZINC000067460674 387096117 /nfs/dbraw/zinc/09/61/17/387096117.db2.gz IFBJJCJXAYECLR-UHFFFAOYSA-N 1 2 241.356 2.440 20 0 BEADLO COC(=O)C[N@@H+](Cc1sccc1C)C(C)C ZINC000067460674 387096123 /nfs/dbraw/zinc/09/61/23/387096123.db2.gz IFBJJCJXAYECLR-UHFFFAOYSA-N 1 2 241.356 2.440 20 0 BEADLO Cc1nc(C(C)C)oc1C[N@@H+]1CCO[C@@H](C)C1 ZINC000336267108 387102012 /nfs/dbraw/zinc/10/20/12/387102012.db2.gz UECCJHFSEXCVBF-JTQLQIEISA-N 1 2 238.331 2.327 20 0 BEADLO Cc1nc(C(C)C)oc1C[N@H+]1CCO[C@@H](C)C1 ZINC000336267108 387102017 /nfs/dbraw/zinc/10/20/17/387102017.db2.gz UECCJHFSEXCVBF-JTQLQIEISA-N 1 2 238.331 2.327 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CCC[C@](C)(F)C2)o1 ZINC000336268646 387102618 /nfs/dbraw/zinc/10/26/18/387102618.db2.gz ATPJPDMUZRBRDJ-KCJUWKMLSA-N 1 2 227.283 2.263 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CCC[C@](C)(F)C2)o1 ZINC000336268646 387102625 /nfs/dbraw/zinc/10/26/25/387102625.db2.gz ATPJPDMUZRBRDJ-KCJUWKMLSA-N 1 2 227.283 2.263 20 0 BEADLO CO[C@@H]1CCN(c2[nH]c3ccccc3[nH+]2)C[C@@H]1C ZINC000336271247 387103835 /nfs/dbraw/zinc/10/38/35/387103835.db2.gz MBXHKDCPVMYIBK-GXFFZTMASA-N 1 2 245.326 2.424 20 0 BEADLO COC(=O)[C@H](C)SCc1ccc(C)[nH+]c1C ZINC000186574597 387110487 /nfs/dbraw/zinc/11/04/87/387110487.db2.gz SOHAEZGHVBDAKJ-JTQLQIEISA-N 1 2 239.340 2.493 20 0 BEADLO Clc1cccc2c1OC[C@@H]2[NH2+]Cc1cc[nH]n1 ZINC000370462240 387119170 /nfs/dbraw/zinc/11/91/70/387119170.db2.gz GCLICORWLZPQMB-NSHDSACASA-N 1 2 249.701 2.286 20 0 BEADLO CCc1ccc(NC(=O)NCc2[nH]cc[nH+]2)cc1 ZINC000119357899 387121550 /nfs/dbraw/zinc/12/15/50/387121550.db2.gz MYLXFOBSBQUMKB-UHFFFAOYSA-N 1 2 244.298 2.294 20 0 BEADLO CC(C)c1occc1C(=O)NCc1c[nH+]c[nH]1 ZINC000359559613 387123199 /nfs/dbraw/zinc/12/31/99/387123199.db2.gz QEUVEIZYURIDHC-UHFFFAOYSA-N 1 2 233.271 2.056 20 0 BEADLO CC(C)c1occc1C(=O)NCc1c[nH]c[nH+]1 ZINC000359559613 387123201 /nfs/dbraw/zinc/12/32/01/387123201.db2.gz QEUVEIZYURIDHC-UHFFFAOYSA-N 1 2 233.271 2.056 20 0 BEADLO c1coc([C@H]2COCC[N@H+]2C[C@@H]2CCC=CO2)c1 ZINC000370526237 387124031 /nfs/dbraw/zinc/12/40/31/387124031.db2.gz CHRLZUYYWDQRRZ-QWHCGFSZSA-N 1 2 249.310 2.346 20 0 BEADLO c1coc([C@H]2COCC[N@@H+]2C[C@@H]2CCC=CO2)c1 ZINC000370526237 387124034 /nfs/dbraw/zinc/12/40/34/387124034.db2.gz CHRLZUYYWDQRRZ-QWHCGFSZSA-N 1 2 249.310 2.346 20 0 BEADLO c1cc([C@@H]2CCC[N@@H+](Cc3cccnc3)C2)[nH]n1 ZINC000072344679 387126116 /nfs/dbraw/zinc/12/61/16/387126116.db2.gz VEVKNXLZEXVDCT-CYBMUJFWSA-N 1 2 242.326 2.184 20 0 BEADLO c1cc([C@@H]2CCC[N@H+](Cc3cccnc3)C2)[nH]n1 ZINC000072344679 387126121 /nfs/dbraw/zinc/12/61/21/387126121.db2.gz VEVKNXLZEXVDCT-CYBMUJFWSA-N 1 2 242.326 2.184 20 0 BEADLO Cc1nc([C@H](C)[NH+]2C[C@H](C)S[C@@H](C)C2)no1 ZINC000571690028 387142511 /nfs/dbraw/zinc/14/25/11/387142511.db2.gz UGAYVNIPBVUYBR-CIUDSAMLSA-N 1 2 241.360 2.265 20 0 BEADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1cocn1 ZINC000353131866 387142620 /nfs/dbraw/zinc/14/26/20/387142620.db2.gz ZLPWBTRQFVWWBR-UHFFFAOYSA-N 1 2 235.287 2.304 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@@](C)(F)C2)nc1 ZINC000336322884 387151923 /nfs/dbraw/zinc/15/19/23/387151923.db2.gz LHKMZXWGQJSHRM-GFCCVEGCSA-N 1 2 224.279 2.024 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@@](C)(F)C2)nc1 ZINC000336322884 387151928 /nfs/dbraw/zinc/15/19/28/387151928.db2.gz LHKMZXWGQJSHRM-GFCCVEGCSA-N 1 2 224.279 2.024 20 0 BEADLO Cn1cc[nH+]c1CN1CC(c2ccccc2F)C1 ZINC000336339706 387165847 /nfs/dbraw/zinc/16/58/47/387165847.db2.gz YRBNVEFSBWYSOE-UHFFFAOYSA-N 1 2 245.301 2.159 20 0 BEADLO Cn1ccnc1C[NH+]1CC(c2ccccc2F)C1 ZINC000336339706 387165852 /nfs/dbraw/zinc/16/58/52/387165852.db2.gz YRBNVEFSBWYSOE-UHFFFAOYSA-N 1 2 245.301 2.159 20 0 BEADLO Cc1c[nH]nc1C[NH+]1CC(C)(CC(F)(F)F)C1 ZINC000459645530 387167449 /nfs/dbraw/zinc/16/74/49/387167449.db2.gz ZTHFSOQDKJSTLC-UHFFFAOYSA-N 1 2 247.264 2.492 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1cc2ccccc2o1 ZINC000353287372 387173194 /nfs/dbraw/zinc/17/31/94/387173194.db2.gz RKDWJGVOANCBGK-UHFFFAOYSA-N 1 2 247.294 2.428 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1cc2ccccc2o1 ZINC000353287372 387173199 /nfs/dbraw/zinc/17/31/99/387173199.db2.gz RKDWJGVOANCBGK-UHFFFAOYSA-N 1 2 247.294 2.428 20 0 BEADLO CC[C@H]1COCCN1C(=O)Nc1cc[nH+]c(C)c1 ZINC000119493626 387134592 /nfs/dbraw/zinc/13/45/92/387134592.db2.gz HVBRGGDIJUXRRR-LBPRGKRZSA-N 1 2 249.314 2.033 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccoc2C)on1 ZINC000321363084 387138206 /nfs/dbraw/zinc/13/82/06/387138206.db2.gz DWDQDSBWJITYJY-UHFFFAOYSA-N 1 2 206.245 2.174 20 0 BEADLO C[C@@H]1CC[C@H]1[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000571955891 387206319 /nfs/dbraw/zinc/20/63/19/387206319.db2.gz BEEGMFNVDPPIBJ-RAIGVLPGSA-N 1 2 242.326 2.282 20 0 BEADLO CCOc1cc(CNc2c[nH]c[nH+]2)ccc1OC ZINC000571966594 387212262 /nfs/dbraw/zinc/21/22/62/387212262.db2.gz QQLLEZVTCOADJW-UHFFFAOYSA-N 1 2 247.298 2.429 20 0 BEADLO Cc1c(N[C@@H](c2[nH+]ccn2C)C2CC2)cnn1C ZINC000187779782 387212578 /nfs/dbraw/zinc/21/25/78/387212578.db2.gz CIQGLNZPUHGGRG-GFCCVEGCSA-N 1 2 245.330 2.025 20 0 BEADLO O=C(c1cccs1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000336383958 387213513 /nfs/dbraw/zinc/21/35/13/387213513.db2.gz IWWATWCPQIDXSS-VIFPVBQESA-N 1 2 247.323 2.449 20 0 BEADLO O=C(c1cccs1)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000336383957 387214401 /nfs/dbraw/zinc/21/44/01/387214401.db2.gz IWWATWCPQIDXSS-SECBINFHSA-N 1 2 247.323 2.449 20 0 BEADLO CO[C@@H]1CCC[C@H]1NC(=O)Nc1cc[nH+]c(C)c1 ZINC000120220054 387214548 /nfs/dbraw/zinc/21/45/48/387214548.db2.gz DZYVHHDRAZSMKI-VXGBXAGGSA-N 1 2 249.314 2.079 20 0 BEADLO CO[C@]1(C)CCCN(c2cc(C)[nH+]cn2)CC1 ZINC000360094404 387227437 /nfs/dbraw/zinc/22/74/37/387227437.db2.gz SFECCHIUBAYVPW-CYBMUJFWSA-N 1 2 235.331 2.180 20 0 BEADLO CC[C@H](F)C[N@@H+]1CCC[C@@H]1c1nc(C)no1 ZINC000353549299 387227705 /nfs/dbraw/zinc/22/77/05/387227705.db2.gz JPTPMPZRYFSPDG-VHSXEESVSA-N 1 2 227.283 2.263 20 0 BEADLO CC[C@H](F)C[N@H+]1CCC[C@@H]1c1nc(C)no1 ZINC000353549299 387227712 /nfs/dbraw/zinc/22/77/12/387227712.db2.gz JPTPMPZRYFSPDG-VHSXEESVSA-N 1 2 227.283 2.263 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cc[nH]n2)cc1F ZINC000353552051 387228322 /nfs/dbraw/zinc/22/83/22/387228322.db2.gz WONKOTBBAAPRPV-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cc[nH]n2)cc1F ZINC000353552051 387228324 /nfs/dbraw/zinc/22/83/24/387228324.db2.gz WONKOTBBAAPRPV-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC2(CCC2)[C@H]1C1CC1 ZINC000336400761 387230139 /nfs/dbraw/zinc/23/01/39/387230139.db2.gz DLOXYURIZYCIRR-CYBMUJFWSA-N 1 2 231.343 2.483 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC2(CCC2)[C@H]1C1CC1 ZINC000336400761 387230140 /nfs/dbraw/zinc/23/01/40/387230140.db2.gz DLOXYURIZYCIRR-CYBMUJFWSA-N 1 2 231.343 2.483 20 0 BEADLO C[C@H]1COCC[N@@H+]1Cc1cc2ccccc2[nH]1 ZINC000648638962 387230482 /nfs/dbraw/zinc/23/04/82/387230482.db2.gz QVWVYUAYWXLAPX-NSHDSACASA-N 1 2 230.311 2.389 20 0 BEADLO C[C@H]1COCC[N@H+]1Cc1cc2ccccc2[nH]1 ZINC000648638962 387230486 /nfs/dbraw/zinc/23/04/86/387230486.db2.gz QVWVYUAYWXLAPX-NSHDSACASA-N 1 2 230.311 2.389 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NCc1cccnc1 ZINC000120364750 387234800 /nfs/dbraw/zinc/23/48/00/387234800.db2.gz GJMVXRJHDVHPJJ-UHFFFAOYSA-N 1 2 242.282 2.107 20 0 BEADLO CCC[C@H]1C[C@@H]1C(=O)Nc1cc[nH+]cc1C ZINC000360175438 387238365 /nfs/dbraw/zinc/23/83/65/387238365.db2.gz KRGKBNQZRSDXHQ-QWRGUYRKSA-N 1 2 218.300 2.187 20 0 BEADLO CO[C@@H]1CCCN(c2nc(C)[nH+]c(C)c2C)CC1 ZINC000371744795 387244539 /nfs/dbraw/zinc/24/45/39/387244539.db2.gz UKHCHZBFCBORQM-CYBMUJFWSA-N 1 2 249.358 2.407 20 0 BEADLO c1csc(C[N@@H+]2CCC[C@@H]2c2ncon2)c1 ZINC000371374165 387200471 /nfs/dbraw/zinc/20/04/71/387200471.db2.gz PTBYYPSZORVXRI-SNVBAGLBSA-N 1 2 235.312 2.468 20 0 BEADLO c1csc(C[N@H+]2CCC[C@@H]2c2ncon2)c1 ZINC000371374165 387200476 /nfs/dbraw/zinc/20/04/76/387200476.db2.gz PTBYYPSZORVXRI-SNVBAGLBSA-N 1 2 235.312 2.468 20 0 BEADLO CO[C@](C)(CNc1cc[nH+]c(C(C)C)n1)C1CC1 ZINC000359967815 387201439 /nfs/dbraw/zinc/20/14/39/387201439.db2.gz KGSLAORCZQTFQE-CQSZACIVSA-N 1 2 249.358 2.249 20 0 BEADLO CCCC[C@@H]([NH2+]CC1(SC)CC1)C(=O)OC ZINC000193331297 387201775 /nfs/dbraw/zinc/20/17/75/387201775.db2.gz ZXMORYGOXULSMW-SNVBAGLBSA-N 1 2 245.388 2.203 20 0 BEADLO CC[C@@H](C[N@H+](C)Cc1nnc[nH]1)c1ccccc1 ZINC000353712007 387262918 /nfs/dbraw/zinc/26/29/18/387262918.db2.gz NSNPITFYFYPDRA-LBPRGKRZSA-N 1 2 244.342 2.430 20 0 BEADLO CC[C@@H](C[N@@H+](C)Cc1nnc[nH]1)c1ccccc1 ZINC000353712007 387262922 /nfs/dbraw/zinc/26/29/22/387262922.db2.gz NSNPITFYFYPDRA-LBPRGKRZSA-N 1 2 244.342 2.430 20 0 BEADLO CC[C@H](C[N@H+](C)Cc1nnc[nH]1)c1ccccc1 ZINC000353712006 387262953 /nfs/dbraw/zinc/26/29/53/387262953.db2.gz NSNPITFYFYPDRA-GFCCVEGCSA-N 1 2 244.342 2.430 20 0 BEADLO CC[C@H](C[N@@H+](C)Cc1nnc[nH]1)c1ccccc1 ZINC000353712006 387262958 /nfs/dbraw/zinc/26/29/58/387262958.db2.gz NSNPITFYFYPDRA-GFCCVEGCSA-N 1 2 244.342 2.430 20 0 BEADLO CCC[C@H](C)C[N@@H+]1CC(F)(F)C[C@@H]1CO ZINC000372638884 387317505 /nfs/dbraw/zinc/31/75/05/387317505.db2.gz KRENLXVXSYBUCV-VHSXEESVSA-N 1 2 221.291 2.125 20 0 BEADLO CCC[C@H](C)C[N@H+]1CC(F)(F)C[C@@H]1CO ZINC000372638884 387317509 /nfs/dbraw/zinc/31/75/09/387317509.db2.gz KRENLXVXSYBUCV-VHSXEESVSA-N 1 2 221.291 2.125 20 0 BEADLO CCC[C@@H]1C[C@@H]1C(=O)N(C)CCCn1cc[nH+]c1 ZINC000360375496 387272511 /nfs/dbraw/zinc/27/25/11/387272511.db2.gz KIALSBCOLSEZFK-OLZOCXBDSA-N 1 2 249.358 2.168 20 0 BEADLO Fc1cc(F)c2c(c1)CN(Cc1[nH]cc[nH+]1)CC2 ZINC000120801992 387274811 /nfs/dbraw/zinc/27/48/11/387274811.db2.gz VZAFARPUPKRRKT-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2cc(C)ccc2C)[nH]1 ZINC000353822970 387280585 /nfs/dbraw/zinc/28/05/85/387280585.db2.gz VJFBOTNXFOGTCT-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2cc(C)ccc2C)[nH]1 ZINC000353822970 387280590 /nfs/dbraw/zinc/28/05/90/387280590.db2.gz VJFBOTNXFOGTCT-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO Cc1ccnc(C[N@H+]2CCS[C@@H](C)[C@H]2C)n1 ZINC000336470796 387299247 /nfs/dbraw/zinc/29/92/47/387299247.db2.gz JPOQNRBJHMESHO-MNOVXSKESA-N 1 2 237.372 2.111 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCS[C@@H](C)[C@H]2C)n1 ZINC000336470796 387299252 /nfs/dbraw/zinc/29/92/52/387299252.db2.gz JPOQNRBJHMESHO-MNOVXSKESA-N 1 2 237.372 2.111 20 0 BEADLO Cc1ccnc(C[N@H+]2CCS[C@H](C)[C@H]2C)n1 ZINC000336470795 387299640 /nfs/dbraw/zinc/29/96/40/387299640.db2.gz JPOQNRBJHMESHO-GHMZBOCLSA-N 1 2 237.372 2.111 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCS[C@H](C)[C@H]2C)n1 ZINC000336470795 387299644 /nfs/dbraw/zinc/29/96/44/387299644.db2.gz JPOQNRBJHMESHO-GHMZBOCLSA-N 1 2 237.372 2.111 20 0 BEADLO c1csc([C@H]2CCCN2Cc2c[nH+]c[nH]2)n1 ZINC000372433367 387300431 /nfs/dbraw/zinc/30/04/31/387300431.db2.gz GTSHRQCEAITDSE-SNVBAGLBSA-N 1 2 234.328 2.203 20 0 BEADLO c1csc([C@H]2CCCN2Cc2c[nH]c[nH+]2)n1 ZINC000372433367 387300436 /nfs/dbraw/zinc/30/04/36/387300436.db2.gz GTSHRQCEAITDSE-SNVBAGLBSA-N 1 2 234.328 2.203 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CCOC(C)(C)C1 ZINC000121106036 387300633 /nfs/dbraw/zinc/30/06/33/387300633.db2.gz DYXIZMDLHPMUCW-UHFFFAOYSA-N 1 2 249.314 2.033 20 0 BEADLO Cc1ccc(CCNc2cc[nH+]c(C)n2)c(C)c1 ZINC000360535865 387306248 /nfs/dbraw/zinc/30/62/48/387306248.db2.gz RYHDXBQRVDJXJS-UHFFFAOYSA-N 1 2 241.338 2.478 20 0 BEADLO Fc1cnccc1C[N@H+]1CC[C@H](OC(F)F)C1 ZINC000648574839 387355982 /nfs/dbraw/zinc/35/59/82/387355982.db2.gz PARQZOUMJPKGNW-VIFPVBQESA-N 1 2 246.232 2.034 20 0 BEADLO Fc1cnccc1C[N@@H+]1CC[C@H](OC(F)F)C1 ZINC000648574839 387355985 /nfs/dbraw/zinc/35/59/85/387355985.db2.gz PARQZOUMJPKGNW-VIFPVBQESA-N 1 2 246.232 2.034 20 0 BEADLO Cc1cc[nH+]cc1NCc1cn(C(C)C)nn1 ZINC000287055293 387357203 /nfs/dbraw/zinc/35/72/03/387357203.db2.gz XCLDIRHIWWKINV-UHFFFAOYSA-N 1 2 231.303 2.175 20 0 BEADLO CC(C)[C@H](C)C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000336537288 387360056 /nfs/dbraw/zinc/36/00/56/387360056.db2.gz OQVWNIKWWNAGBE-QWRGUYRKSA-N 1 2 235.331 2.365 20 0 BEADLO CC(C)CC[C@@H](O)C[N@@H+]1Cc2cccnc2C1 ZINC000515377117 387371188 /nfs/dbraw/zinc/37/11/88/387371188.db2.gz DDEDNYWNCKSYMA-CYBMUJFWSA-N 1 2 234.343 2.194 20 0 BEADLO CC(C)CC[C@@H](O)C[N@H+]1Cc2cccnc2C1 ZINC000515377117 387371191 /nfs/dbraw/zinc/37/11/91/387371191.db2.gz DDEDNYWNCKSYMA-CYBMUJFWSA-N 1 2 234.343 2.194 20 0 BEADLO CC(C)CC[C@H](O)C[N@@H+]1Cc2cccnc2C1 ZINC000515377118 387371325 /nfs/dbraw/zinc/37/13/25/387371325.db2.gz DDEDNYWNCKSYMA-ZDUSSCGKSA-N 1 2 234.343 2.194 20 0 BEADLO CC(C)CC[C@H](O)C[N@H+]1Cc2cccnc2C1 ZINC000515377118 387371329 /nfs/dbraw/zinc/37/13/29/387371329.db2.gz DDEDNYWNCKSYMA-ZDUSSCGKSA-N 1 2 234.343 2.194 20 0 BEADLO C[C@@H](CC(C)(C)C)C(=O)NCCn1cc[nH+]c1 ZINC000360976612 387379025 /nfs/dbraw/zinc/37/90/25/387379025.db2.gz YEXNBABUOSVRDV-NSHDSACASA-N 1 2 237.347 2.072 20 0 BEADLO CCCc1csc(C[N@@H+]2CC[C@H]2COC)n1 ZINC000354059984 387325268 /nfs/dbraw/zinc/32/52/68/387325268.db2.gz YVBSDQWLVGWROE-NSHDSACASA-N 1 2 240.372 2.316 20 0 BEADLO CCCc1csc(C[N@H+]2CC[C@H]2COC)n1 ZINC000354059984 387325276 /nfs/dbraw/zinc/32/52/76/387325276.db2.gz YVBSDQWLVGWROE-NSHDSACASA-N 1 2 240.372 2.316 20 0 BEADLO CC(C)(C)C(=O)NCCCCNc1cccc[nH+]1 ZINC000354130330 387334304 /nfs/dbraw/zinc/33/43/04/387334304.db2.gz JNXUVUOBERWCOV-UHFFFAOYSA-N 1 2 249.358 2.436 20 0 BEADLO F[C@@H]1CC[C@H](Nc2cc[nH+]c3ccncc23)C1 ZINC000336514196 387337215 /nfs/dbraw/zinc/33/72/15/387337215.db2.gz WMVCERWUKGHHEN-ZJUUUORDSA-N 1 2 231.274 2.354 20 0 BEADLO Cc1cnn(C)c1CNc1ccc([NH+](C)C)cc1 ZINC000286768065 387341706 /nfs/dbraw/zinc/34/17/06/387341706.db2.gz ZQHUXKYUAKXQIO-UHFFFAOYSA-N 1 2 244.342 2.407 20 0 BEADLO COC(=O)[C@H](CNc1cccc[nH+]1)CC1CC1 ZINC000515188858 387347915 /nfs/dbraw/zinc/34/79/15/387347915.db2.gz XOSODBYYUNSYCO-NSHDSACASA-N 1 2 234.299 2.083 20 0 BEADLO CC[C@H]1C[C@H](C)CN1C(=O)Nc1cc[nH+]cc1C ZINC000336527717 387350914 /nfs/dbraw/zinc/35/09/14/387350914.db2.gz SRAQJXOIMKWJGD-JQWIXIFHSA-N 1 2 247.342 2.464 20 0 BEADLO Cc1oncc1C[N@@H+](C)Cc1cnccc1C ZINC000361434803 387461919 /nfs/dbraw/zinc/46/19/19/387461919.db2.gz PQQRQMMSYTXWGR-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1oncc1C[N@H+](C)Cc1cnccc1C ZINC000361434803 387461921 /nfs/dbraw/zinc/46/19/21/387461921.db2.gz PQQRQMMSYTXWGR-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CC(C)c1[nH]ccc1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000352723496 387462314 /nfs/dbraw/zinc/46/23/14/387462314.db2.gz JFAPQQVNDBFYAC-UHFFFAOYSA-N 1 2 246.314 2.133 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000516076567 387455673 /nfs/dbraw/zinc/45/56/73/387455673.db2.gz NYBVLAIHGKWVMO-GHMZBOCLSA-N 1 2 249.358 2.443 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@@H]2CCCOC2)cs1 ZINC000336618027 387458113 /nfs/dbraw/zinc/45/81/13/387458113.db2.gz VYPIZURYVPYIDV-LLVKDONJSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1nc(C[N@H+](C)[C@@H]2CCCOC2)cs1 ZINC000336618027 387458143 /nfs/dbraw/zinc/45/81/43/387458143.db2.gz VYPIZURYVPYIDV-LLVKDONJSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)C[C@H]1CCCCO1 ZINC000516087784 387458401 /nfs/dbraw/zinc/45/84/01/387458401.db2.gz BGWNRYCMMSVUML-GFCCVEGCSA-N 1 2 235.331 2.099 20 0 BEADLO FC1C[NH+](CCCc2ccc3c(c2)CCO3)C1 ZINC000360996129 387385853 /nfs/dbraw/zinc/38/58/53/387385853.db2.gz OQPXPLQHVIQFDF-UHFFFAOYSA-N 1 2 235.302 2.208 20 0 BEADLO CCN(CC)C(=O)C[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000361085354 387399573 /nfs/dbraw/zinc/39/95/73/387399573.db2.gz FAKOZLOSDQEECE-LBPRGKRZSA-N 1 2 246.354 2.432 20 0 BEADLO CCN(CC)C(=O)C[N@H+]1Cc2ccccc2[C@@H]1C ZINC000361085354 387399577 /nfs/dbraw/zinc/39/95/77/387399577.db2.gz FAKOZLOSDQEECE-LBPRGKRZSA-N 1 2 246.354 2.432 20 0 BEADLO COC(=O)C(C)(C)CCNc1c[nH+]cc(C)c1 ZINC000354581733 387400441 /nfs/dbraw/zinc/40/04/41/387400441.db2.gz FWHVKSLASYGOPS-UHFFFAOYSA-N 1 2 236.315 2.391 20 0 BEADLO CSCCN(C)C(=O)Nc1cc[nH+]cc1C ZINC000121720871 387400845 /nfs/dbraw/zinc/40/08/45/387400845.db2.gz IRKHEPBZYUIRGB-UHFFFAOYSA-N 1 2 239.344 2.217 20 0 BEADLO Cc1ccnc(C[NH2+][C@H](C)c2ccccn2)n1 ZINC000361147587 387406382 /nfs/dbraw/zinc/40/63/82/387406382.db2.gz ZIRKPTCNTAYTEO-LLVKDONJSA-N 1 2 228.299 2.031 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)C1(C)CCCCC1 ZINC000336583993 387410118 /nfs/dbraw/zinc/41/01/18/387410118.db2.gz BIDVGXQDNPDPFN-UHFFFAOYSA-N 1 2 235.331 2.007 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1cc(C)ccc1C ZINC000361184058 387411699 /nfs/dbraw/zinc/41/16/99/387411699.db2.gz JRXYAZOGKSTHFS-GFCCVEGCSA-N 1 2 235.327 2.297 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1cc(C)ccc1C ZINC000361184058 387411702 /nfs/dbraw/zinc/41/17/02/387411702.db2.gz JRXYAZOGKSTHFS-GFCCVEGCSA-N 1 2 235.327 2.297 20 0 BEADLO FC1=CCC[N@H+](CCc2ccncc2)C1 ZINC000336618890 387460919 /nfs/dbraw/zinc/46/09/19/387460919.db2.gz UAOOSNGTCAMAAO-UHFFFAOYSA-N 1 2 206.264 2.183 20 0 BEADLO FC1=CCC[N@@H+](CCc2ccncc2)C1 ZINC000336618890 387460921 /nfs/dbraw/zinc/46/09/21/387460921.db2.gz UAOOSNGTCAMAAO-UHFFFAOYSA-N 1 2 206.264 2.183 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1ccc(F)c(C)c1 ZINC000361194888 387414312 /nfs/dbraw/zinc/41/43/12/387414312.db2.gz WFNZQVUFERDFSU-SNVBAGLBSA-N 1 2 239.290 2.127 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(F)c(C)c1 ZINC000361194888 387414317 /nfs/dbraw/zinc/41/43/17/387414317.db2.gz WFNZQVUFERDFSU-SNVBAGLBSA-N 1 2 239.290 2.127 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)NC(C)C ZINC000287573985 387461051 /nfs/dbraw/zinc/46/10/51/387461051.db2.gz QJTACVQAXUFCEH-UHFFFAOYSA-N 1 2 207.277 2.228 20 0 BEADLO C[C@H]1C[N@H+](Cc2cocn2)CC2(CCCC2)O1 ZINC000648076900 387502795 /nfs/dbraw/zinc/50/27/95/387502795.db2.gz OXZOKLKFMAWCTP-NSHDSACASA-N 1 2 236.315 2.208 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cocn2)CC2(CCCC2)O1 ZINC000648076900 387502799 /nfs/dbraw/zinc/50/27/99/387502799.db2.gz OXZOKLKFMAWCTP-NSHDSACASA-N 1 2 236.315 2.208 20 0 BEADLO CC[C@H](NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]21)c1[nH]cc[nH+]1 ZINC000516394268 387503804 /nfs/dbraw/zinc/50/38/04/387503804.db2.gz GZQOHQXXOSQAPK-RHYQMDGZSA-N 1 2 247.342 2.413 20 0 BEADLO OC1(CC[N@H+](CC(F)F)C2CC2)CCC1 ZINC000396914727 387513847 /nfs/dbraw/zinc/51/38/47/387513847.db2.gz MOVHMYINTXFLEO-UHFFFAOYSA-N 1 2 219.275 2.021 20 0 BEADLO OC1(CC[N@@H+](CC(F)F)C2CC2)CCC1 ZINC000396914727 387513851 /nfs/dbraw/zinc/51/38/51/387513851.db2.gz MOVHMYINTXFLEO-UHFFFAOYSA-N 1 2 219.275 2.021 20 0 BEADLO c1cc(C[N@@H+]2CCc3ccccc3C2)no1 ZINC000122384613 387515751 /nfs/dbraw/zinc/51/57/51/387515751.db2.gz PSZJGLODXODWQU-UHFFFAOYSA-N 1 2 214.268 2.233 20 0 BEADLO c1cc(C[N@H+]2CCc3ccccc3C2)no1 ZINC000122384613 387515757 /nfs/dbraw/zinc/51/57/57/387515757.db2.gz PSZJGLODXODWQU-UHFFFAOYSA-N 1 2 214.268 2.233 20 0 BEADLO CC(C)(C)CC[N@@H+]1CC(F)(F)C[C@@H]1CO ZINC000375252482 387519959 /nfs/dbraw/zinc/51/99/59/387519959.db2.gz IQLKWSHPRJBLSA-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)(C)CC[N@H+]1CC(F)(F)C[C@@H]1CO ZINC000375252482 387519963 /nfs/dbraw/zinc/51/99/63/387519963.db2.gz IQLKWSHPRJBLSA-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO Cc1cc(C)c(CNc2ncc(Cl)cn2)c[nH+]1 ZINC000397035215 387534661 /nfs/dbraw/zinc/53/46/61/387534661.db2.gz ZWLGTETXHKKTFY-UHFFFAOYSA-N 1 2 248.717 2.176 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCOCC2(CCCC2)C1 ZINC000375396439 387538189 /nfs/dbraw/zinc/53/81/89/387538189.db2.gz VEDURBPWSJHIGO-UHFFFAOYSA-N 1 2 249.358 2.111 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCOCC2(CCCC2)C1 ZINC000375396439 387538191 /nfs/dbraw/zinc/53/81/91/387538191.db2.gz VEDURBPWSJHIGO-UHFFFAOYSA-N 1 2 249.358 2.111 20 0 BEADLO CSCC[N@@H+]1CCOC[C@@H]1c1ccco1 ZINC000361478695 387466029 /nfs/dbraw/zinc/46/60/29/387466029.db2.gz NILRJZWMVVBUEX-SNVBAGLBSA-N 1 2 227.329 2.016 20 0 BEADLO CSCC[N@H+]1CCOC[C@@H]1c1ccco1 ZINC000361478695 387466035 /nfs/dbraw/zinc/46/60/35/387466035.db2.gz NILRJZWMVVBUEX-SNVBAGLBSA-N 1 2 227.329 2.016 20 0 BEADLO Cc1cnc([C@H](C)[N@H+](C)C[C@H]2CCCO2)o1 ZINC000355057202 387472161 /nfs/dbraw/zinc/47/21/61/387472161.db2.gz JPJGZHQBAHSELN-WDEREUQCSA-N 1 2 224.304 2.155 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+](C)C[C@H]2CCCO2)o1 ZINC000355057202 387472167 /nfs/dbraw/zinc/47/21/67/387472167.db2.gz JPJGZHQBAHSELN-WDEREUQCSA-N 1 2 224.304 2.155 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+](C)C[C@H]2CCCO2)o1 ZINC000355057195 387472434 /nfs/dbraw/zinc/47/24/34/387472434.db2.gz JPJGZHQBAHSELN-GHMZBOCLSA-N 1 2 224.304 2.155 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+](C)C[C@H]2CCCO2)o1 ZINC000355057195 387472439 /nfs/dbraw/zinc/47/24/39/387472439.db2.gz JPJGZHQBAHSELN-GHMZBOCLSA-N 1 2 224.304 2.155 20 0 BEADLO CO[C@H]1CCCN(c2cccc[nH+]2)CC1 ZINC000374647919 387476585 /nfs/dbraw/zinc/47/65/85/387476585.db2.gz PGHKQAZNKDIQCL-NSHDSACASA-N 1 2 206.289 2.087 20 0 BEADLO CC[C@@H](C[NH2+][C@@H](C)C(=O)OC)c1ccccc1 ZINC000355133316 387484485 /nfs/dbraw/zinc/48/44/85/387484485.db2.gz NXBLNBIDUIULIW-RYUDHWBXSA-N 1 2 235.327 2.331 20 0 BEADLO CC[C@@H](C[NH2+][C@H](C)C(=O)OC)c1ccccc1 ZINC000355133302 387485794 /nfs/dbraw/zinc/48/57/94/387485794.db2.gz NXBLNBIDUIULIW-NEPJUHHUSA-N 1 2 235.327 2.331 20 0 BEADLO Cc1cn2c(n1)C[N@H+]([C@@H]1C=CCCC1)CC2 ZINC000374708887 387485869 /nfs/dbraw/zinc/48/58/69/387485869.db2.gz DCSOWDGUDWLYRY-GFCCVEGCSA-N 1 2 217.316 2.116 20 0 BEADLO Cc1cn2c(n1)C[N@@H+]([C@@H]1C=CCCC1)CC2 ZINC000374708887 387485871 /nfs/dbraw/zinc/48/58/71/387485871.db2.gz DCSOWDGUDWLYRY-GFCCVEGCSA-N 1 2 217.316 2.116 20 0 BEADLO Cc1ccnc(C[N@H+]2CCC(F)(F)C[C@@H]2C)n1 ZINC000528765182 387595624 /nfs/dbraw/zinc/59/56/24/387595624.db2.gz ASWKNUKUKDPBPM-JTQLQIEISA-N 1 2 241.285 2.405 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCC(F)(F)C[C@@H]2C)n1 ZINC000528765182 387595629 /nfs/dbraw/zinc/59/56/29/387595629.db2.gz ASWKNUKUKDPBPM-JTQLQIEISA-N 1 2 241.285 2.405 20 0 BEADLO CCC[C@@](C)(CC)C(=O)NCCc1[nH]cc[nH+]1 ZINC000355994537 387603328 /nfs/dbraw/zinc/60/33/28/387603328.db2.gz VCNSFWWDXNFRRP-CYBMUJFWSA-N 1 2 237.347 2.285 20 0 BEADLO CCCn1ncnc1C[N@H+]1CC(C)=C[C@H](C)C1 ZINC000430266983 387603695 /nfs/dbraw/zinc/60/36/95/387603695.db2.gz ZLTWIXZPAPIREE-NSHDSACASA-N 1 2 234.347 2.086 20 0 BEADLO CCCn1ncnc1C[N@@H+]1CC(C)=C[C@H](C)C1 ZINC000430266983 387603700 /nfs/dbraw/zinc/60/37/00/387603700.db2.gz ZLTWIXZPAPIREE-NSHDSACASA-N 1 2 234.347 2.086 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H]1C[C@H]1C(C)C ZINC000356221100 387629512 /nfs/dbraw/zinc/62/95/12/387629512.db2.gz OLWIXIGNWRAQMO-RYUDHWBXSA-N 1 2 232.327 2.297 20 0 BEADLO CCC1(C(=O)N[C@H](C)Cn2cc[nH+]c2)CCCC1 ZINC000362507057 387621379 /nfs/dbraw/zinc/62/13/79/387621379.db2.gz OUVMGDXHEHBEKK-GFCCVEGCSA-N 1 2 249.358 2.358 20 0 BEADLO CC[C@H]1CCCC[C@@H]1C(=O)NCc1c[nH+]c[nH]1 ZINC000356158962 387623271 /nfs/dbraw/zinc/62/32/71/387623271.db2.gz WTRGXOVZIQTCJK-JQWIXIFHSA-N 1 2 235.331 2.242 20 0 BEADLO CC[C@H]1CCCC[C@@H]1C(=O)NCc1c[nH]c[nH+]1 ZINC000356158962 387623276 /nfs/dbraw/zinc/62/32/76/387623276.db2.gz WTRGXOVZIQTCJK-JQWIXIFHSA-N 1 2 235.331 2.242 20 0 BEADLO CC[N@H+](CCC1CC1)Cc1csnn1 ZINC000355514457 387546419 /nfs/dbraw/zinc/54/64/19/387546419.db2.gz NNHNOIXHLFIDHV-UHFFFAOYSA-N 1 2 211.334 2.160 20 0 BEADLO CC[N@@H+](CCC1CC1)Cc1csnn1 ZINC000355514457 387546422 /nfs/dbraw/zinc/54/64/22/387546422.db2.gz NNHNOIXHLFIDHV-UHFFFAOYSA-N 1 2 211.334 2.160 20 0 BEADLO Clc1ccc2nc(Cn3cc[nH+]c3)cn2c1 ZINC000122527431 387548283 /nfs/dbraw/zinc/54/82/83/387548283.db2.gz KVEFKBAJLLPEKZ-UHFFFAOYSA-N 1 2 232.674 2.233 20 0 BEADLO CC[N@H+](CC(F)F)CC(C)(C)COC ZINC000426350906 387557934 /nfs/dbraw/zinc/55/79/34/387557934.db2.gz JCCLIXICMBNVPM-UHFFFAOYSA-N 1 2 209.280 2.246 20 0 BEADLO CC[N@@H+](CC(F)F)CC(C)(C)COC ZINC000426350906 387557936 /nfs/dbraw/zinc/55/79/36/387557936.db2.gz JCCLIXICMBNVPM-UHFFFAOYSA-N 1 2 209.280 2.246 20 0 BEADLO CC(C)c1nc(N[C@@H]2CCO[C@H]2C2CC2)cc[nH+]1 ZINC000363163207 387694224 /nfs/dbraw/zinc/69/42/24/387694224.db2.gz UJXCVMWNNPICLM-YPMHNXCESA-N 1 2 247.342 2.001 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2nccs2)ccn1 ZINC000527535626 387630914 /nfs/dbraw/zinc/63/09/14/387630914.db2.gz RMAHNUFCTABHPV-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2nccs2)ccn1 ZINC000527535626 387630915 /nfs/dbraw/zinc/63/09/15/387630915.db2.gz RMAHNUFCTABHPV-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CC[C@@H](F)C[N@H+](C)[C@H](C)C(=O)OC(C)(C)C ZINC000440776226 387694728 /nfs/dbraw/zinc/69/47/28/387694728.db2.gz BRUJBFGKMFAZHO-NXEZZACHSA-N 1 2 233.327 2.397 20 0 BEADLO CC[C@@H](F)C[N@@H+](C)[C@H](C)C(=O)OC(C)(C)C ZINC000440776226 387694732 /nfs/dbraw/zinc/69/47/32/387694732.db2.gz BRUJBFGKMFAZHO-NXEZZACHSA-N 1 2 233.327 2.397 20 0 BEADLO COc1cc(C[N@@H+]2CCC(F)(F)C[C@H]2C)on1 ZINC000528767266 387635176 /nfs/dbraw/zinc/63/51/76/387635176.db2.gz GEKIDGKKMPSZGT-MRVPVSSYSA-N 1 2 246.257 2.303 20 0 BEADLO COc1cc(C[N@H+]2CCC(F)(F)C[C@H]2C)on1 ZINC000528767266 387635178 /nfs/dbraw/zinc/63/51/78/387635178.db2.gz GEKIDGKKMPSZGT-MRVPVSSYSA-N 1 2 246.257 2.303 20 0 BEADLO Cc1c[nH+]cc(NCc2cscn2)c1 ZINC000125086564 387643784 /nfs/dbraw/zinc/64/37/84/387643784.db2.gz OYFCFQWBEVLIOM-UHFFFAOYSA-N 1 2 205.286 2.459 20 0 BEADLO CCCc1nc(C[NH+]2[C@@H](C)CC[C@@H]2C)no1 ZINC000123244887 387669643 /nfs/dbraw/zinc/66/96/43/387669643.db2.gz GRUWYNYUSKOEHR-UWVGGRQHSA-N 1 2 223.320 2.395 20 0 BEADLO C[C@H]([NH+]=c1[nH]c2ccc(F)cc2n1C)C1CC1 ZINC000431029279 387669623 /nfs/dbraw/zinc/66/96/23/387669623.db2.gz ZZAJSWUARXQJEA-QMMMGPOBSA-N 1 2 233.290 2.345 20 0 BEADLO CCCN(C)C(=O)N[C@@H](C)c1[nH+]ccn1CC ZINC000451929339 387681425 /nfs/dbraw/zinc/68/14/25/387681425.db2.gz NSTPDJWCQLYOKR-JTQLQIEISA-N 1 2 238.335 2.015 20 0 BEADLO CC(C)C(C)(C)[S@](=O)Cc1c[nH+]cn1C ZINC000431187578 387685869 /nfs/dbraw/zinc/68/58/69/387685869.db2.gz PVCVJEAGDMTXGD-OAHLLOKOSA-N 1 2 228.361 2.103 20 0 BEADLO CC[C@H](F)CN1CC[N@H+](C[C@@H](F)CC)C[C@H]1C ZINC000440768660 387688558 /nfs/dbraw/zinc/68/85/58/387688558.db2.gz ZXLIGMBOLTUARW-AGIUHOORSA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@H](F)CN1CC[N@@H+](C[C@@H](F)CC)C[C@H]1C ZINC000440768660 387688565 /nfs/dbraw/zinc/68/85/65/387688565.db2.gz ZXLIGMBOLTUARW-AGIUHOORSA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@H](F)CN1CC[N@H+](C[C@@H](F)CC)[C@H](C)C1 ZINC000440768660 387688568 /nfs/dbraw/zinc/68/85/68/387688568.db2.gz ZXLIGMBOLTUARW-AGIUHOORSA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@H](F)CN1CC[N@@H+](C[C@@H](F)CC)[C@H](C)C1 ZINC000440768660 387688573 /nfs/dbraw/zinc/68/85/73/387688573.db2.gz ZXLIGMBOLTUARW-AGIUHOORSA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@@H](F)CN1CC[N@H+](C[C@@H](F)CC)C[C@H]1C ZINC000440768662 387688823 /nfs/dbraw/zinc/68/88/23/387688823.db2.gz ZXLIGMBOLTUARW-FRRDWIJNSA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@@H](F)CN1CC[N@@H+](C[C@@H](F)CC)C[C@H]1C ZINC000440768662 387688830 /nfs/dbraw/zinc/68/88/30/387688830.db2.gz ZXLIGMBOLTUARW-FRRDWIJNSA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCN(C[C@@H](F)CC)C[C@H]1C ZINC000440768662 387688836 /nfs/dbraw/zinc/68/88/36/387688836.db2.gz ZXLIGMBOLTUARW-FRRDWIJNSA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCN(C[C@@H](F)CC)C[C@H]1C ZINC000440768662 387688842 /nfs/dbraw/zinc/68/88/42/387688842.db2.gz ZXLIGMBOLTUARW-FRRDWIJNSA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CC(=O)N(C(C)C)C(C)(C)C1 ZINC000440772806 387690707 /nfs/dbraw/zinc/69/07/07/387690707.db2.gz CNFNFPJFBPUCQQ-LLVKDONJSA-N 1 2 244.354 2.066 20 0 BEADLO CC[C@@H](F)C[N@H+]1CC(=O)N(C(C)C)C(C)(C)C1 ZINC000440772806 387690710 /nfs/dbraw/zinc/69/07/10/387690710.db2.gz CNFNFPJFBPUCQQ-LLVKDONJSA-N 1 2 244.354 2.066 20 0 BEADLO CCOC(=O)C[N@H+](C[C@@H](F)CC)C(C)(C)C ZINC000440767645 387690793 /nfs/dbraw/zinc/69/07/93/387690793.db2.gz UENNXCPMUSMGCQ-JTQLQIEISA-N 1 2 233.327 2.398 20 0 BEADLO CCOC(=O)C[N@@H+](C[C@@H](F)CC)C(C)(C)C ZINC000440767645 387690797 /nfs/dbraw/zinc/69/07/97/387690797.db2.gz UENNXCPMUSMGCQ-JTQLQIEISA-N 1 2 233.327 2.398 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NC[C@H]1CC[C@@H](C)C1 ZINC000521459027 387749718 /nfs/dbraw/zinc/74/97/18/387749718.db2.gz PZAYMWGBYMXXDH-WOPDTQHZSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NC[C@H]1CC[C@@H](C)C1 ZINC000521459027 387749725 /nfs/dbraw/zinc/74/97/25/387749725.db2.gz PZAYMWGBYMXXDH-WOPDTQHZSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1cc[nH]n1 ZINC000528772027 387698203 /nfs/dbraw/zinc/69/82/03/387698203.db2.gz KBAHZDCCIPMDAN-QMMMGPOBSA-N 1 2 215.247 2.029 20 0 BEADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1cc[nH]n1 ZINC000528772027 387698208 /nfs/dbraw/zinc/69/82/08/387698208.db2.gz KBAHZDCCIPMDAN-QMMMGPOBSA-N 1 2 215.247 2.029 20 0 BEADLO CCc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)o1 ZINC000126965901 387701550 /nfs/dbraw/zinc/70/15/50/387701550.db2.gz ZYPUGZXODPDWBO-GHMZBOCLSA-N 1 2 223.316 2.451 20 0 BEADLO CC[C@H](F)C[N@H+](CC(=O)OC)C1CCCC1 ZINC000440795632 387703114 /nfs/dbraw/zinc/70/31/14/387703114.db2.gz FBYXRGNQWLYMSV-JTQLQIEISA-N 1 2 231.311 2.152 20 0 BEADLO CC[C@H](F)C[N@@H+](CC(=O)OC)C1CCCC1 ZINC000440795632 387703117 /nfs/dbraw/zinc/70/31/17/387703117.db2.gz FBYXRGNQWLYMSV-JTQLQIEISA-N 1 2 231.311 2.152 20 0 BEADLO Cc1ccoc1C(=O)N[C@H](c1[nH]cc[nH+]1)C(C)C ZINC000431411368 387708294 /nfs/dbraw/zinc/70/82/94/387708294.db2.gz YOIJMABJYCFSOI-JTQLQIEISA-N 1 2 247.298 2.438 20 0 BEADLO Cc1noc([C@H](C)[NH2+]Cc2ccc(F)cc2)n1 ZINC000356897920 387741461 /nfs/dbraw/zinc/74/14/61/387741461.db2.gz UPEMTHVKNJEDAU-QMMMGPOBSA-N 1 2 235.262 2.368 20 0 BEADLO O=[S@]1CC[C@H](Nc2[nH+]ccc3ccccc32)C1 ZINC000527908674 387763998 /nfs/dbraw/zinc/76/39/98/387763998.db2.gz FYMSBVXMZFVUOH-GTNSWQLSSA-N 1 2 246.335 2.168 20 0 BEADLO CC(C)c1nc(N2CCOC[C@@H](C)C2)cc[nH+]1 ZINC000378258257 387774560 /nfs/dbraw/zinc/77/45/60/387774560.db2.gz HEWVMAXDKXSNBH-NSHDSACASA-N 1 2 235.331 2.073 20 0 BEADLO Cc1nc(-c2ccncc2)cc(-n2cc[nH+]c2)n1 ZINC000378360492 387778455 /nfs/dbraw/zinc/77/84/55/387778455.db2.gz CGJKZAVMNRXYDQ-UHFFFAOYSA-N 1 2 237.266 2.033 20 0 BEADLO CCC[C@H]1CN(c2[nH+]cccc2OC)CCO1 ZINC000527941098 387780625 /nfs/dbraw/zinc/78/06/25/387780625.db2.gz GOLDXBUNVVBEMV-NSHDSACASA-N 1 2 236.315 2.096 20 0 BEADLO COc1cccc(CNc2cccc(CO)[nH+]2)c1 ZINC000432737008 387812804 /nfs/dbraw/zinc/81/28/04/387812804.db2.gz IBRHNRDELDHEQO-UHFFFAOYSA-N 1 2 244.294 2.195 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CCC[C@@H]2OCC[C@H]21 ZINC000527925606 387791192 /nfs/dbraw/zinc/79/11/92/387791192.db2.gz MOTCGLSXOGRHOH-TUAOUCFPSA-N 1 2 248.326 2.460 20 0 BEADLO CC[N@H+](Cc1noc(C2CC2)n1)C(C)C ZINC000193722535 387802777 /nfs/dbraw/zinc/80/27/77/387802777.db2.gz MOBFZLQDSBDWDE-UHFFFAOYSA-N 1 2 209.293 2.177 20 0 BEADLO CC[N@@H+](Cc1noc(C2CC2)n1)C(C)C ZINC000193722535 387802781 /nfs/dbraw/zinc/80/27/81/387802781.db2.gz MOBFZLQDSBDWDE-UHFFFAOYSA-N 1 2 209.293 2.177 20 0 BEADLO O=C(CCC1CC1)Nc1c[nH+]c2n1CCCC2 ZINC000452333487 387804355 /nfs/dbraw/zinc/80/43/55/387804355.db2.gz JJGBQAXQICFTMW-UHFFFAOYSA-N 1 2 233.315 2.348 20 0 BEADLO CC[C@H]1CN(c2[nH+]cccc2OC)CCCO1 ZINC000527998269 387805880 /nfs/dbraw/zinc/80/58/80/387805880.db2.gz LIRVBEPOYNXDBL-NSHDSACASA-N 1 2 236.315 2.096 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1CCOC[C@@H]1C ZINC000528018738 387824307 /nfs/dbraw/zinc/82/43/07/387824307.db2.gz KJWGVVOXCMOTOB-QWRGUYRKSA-N 1 2 236.315 2.175 20 0 BEADLO CCCc1nc(C[N@H+](C)C2CCCC2)no1 ZINC000054983856 387842438 /nfs/dbraw/zinc/84/24/38/387842438.db2.gz GVSNLJJZZDTCSD-UHFFFAOYSA-N 1 2 223.320 2.397 20 0 BEADLO CCCc1nc(C[N@@H+](C)C2CCCC2)no1 ZINC000054983856 387842440 /nfs/dbraw/zinc/84/24/40/387842440.db2.gz GVSNLJJZZDTCSD-UHFFFAOYSA-N 1 2 223.320 2.397 20 0 BEADLO CCc1ccc(C[NH2+]Cc2csnn2)s1 ZINC000163656290 387842452 /nfs/dbraw/zinc/84/24/52/387842452.db2.gz AKBRQOXBNWBONS-UHFFFAOYSA-N 1 2 239.369 2.452 20 0 BEADLO CC[C@H](NC(=O)[C@@H]1C[C@@]1(C)CC)c1[nH]cc[nH+]1 ZINC000442814518 387845317 /nfs/dbraw/zinc/84/53/17/387845317.db2.gz VAEYBUFQMCZHEV-OUJBWJOFSA-N 1 2 235.331 2.413 20 0 BEADLO OC1(CCOc2cccc(-n3cc[nH+]c3)c2)CC1 ZINC000442837066 387847919 /nfs/dbraw/zinc/84/79/19/387847919.db2.gz PDPMHTZMNXHPRO-UHFFFAOYSA-N 1 2 244.294 2.166 20 0 BEADLO COc1ccnc(C[NH2+]Cc2ccccc2C)n1 ZINC000424169123 387859420 /nfs/dbraw/zinc/85/94/20/387859420.db2.gz HIGVVKSZJANBDK-UHFFFAOYSA-N 1 2 243.310 2.083 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)CCCC(C)C ZINC000452570521 387860526 /nfs/dbraw/zinc/86/05/26/387860526.db2.gz KNPILFKXGDFPJX-UHFFFAOYSA-N 1 2 237.347 2.346 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C1=CCCCCC1 ZINC000452571023 387862290 /nfs/dbraw/zinc/86/22/90/387862290.db2.gz NFIHWYXNGGXEAU-UHFFFAOYSA-N 1 2 247.342 2.410 20 0 BEADLO Cc1nc(N2CCC(F)(F)C[C@H]2C)cc[nH+]1 ZINC000528207997 387870524 /nfs/dbraw/zinc/87/05/24/387870524.db2.gz NECRVZBZJKKXSL-MRVPVSSYSA-N 1 2 227.258 2.409 20 0 BEADLO Cc1nc(N[C@@H]2[C@H](C)O[C@H](C)[C@H]2C)cc[nH+]1 ZINC000528207202 387871385 /nfs/dbraw/zinc/87/13/85/387871385.db2.gz OZPWAMKHBGNINW-XBWDGYHZSA-N 1 2 221.304 2.009 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CCC[C@H]1CCO ZINC000527970352 387814529 /nfs/dbraw/zinc/81/45/29/387814529.db2.gz YEKFKIRXEABCPE-WDEREUQCSA-N 1 2 236.315 2.053 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)[C@]1(C)CCC[C@@H]1C ZINC000448708878 387892550 /nfs/dbraw/zinc/89/25/50/387892550.db2.gz NDWODINSWLSBIO-OUCADQQQSA-N 1 2 249.358 2.214 20 0 BEADLO CCC[N@H+](C)Cc1nc([C@@H]2CC[C@@H](C)O2)no1 ZINC000528227803 387884116 /nfs/dbraw/zinc/88/41/16/387884116.db2.gz AHIKVFVASRJRPF-ZJUUUORDSA-N 1 2 239.319 2.151 20 0 BEADLO CCC[N@@H+](C)Cc1nc([C@@H]2CC[C@@H](C)O2)no1 ZINC000528227803 387884121 /nfs/dbraw/zinc/88/41/21/387884121.db2.gz AHIKVFVASRJRPF-ZJUUUORDSA-N 1 2 239.319 2.151 20 0 BEADLO c1ccc2c(c1)cc[nH+]c2N1C[C@@H]2C[C@H]1CO2 ZINC000528268403 387888350 /nfs/dbraw/zinc/88/83/50/387888350.db2.gz SWGAOKVUKXOQBW-RYUDHWBXSA-N 1 2 226.279 2.212 20 0 BEADLO Cc1ccc(F)c(CN(C)Cc2[nH]cc[nH+]2)c1 ZINC000444743987 387918674 /nfs/dbraw/zinc/91/86/74/387918674.db2.gz KVVGHPWRAMGEIB-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO CC[C@H]1C[N@H+](C/C=C(/C)Cl)CCO1 ZINC000528354216 387909162 /nfs/dbraw/zinc/90/91/62/387909162.db2.gz WKCCHFAAEPRQLY-FWAPLPHYSA-N 1 2 203.713 2.240 20 0 BEADLO CC[C@H]1C[N@@H+](C/C=C(/C)Cl)CCO1 ZINC000528354216 387909169 /nfs/dbraw/zinc/90/91/69/387909169.db2.gz WKCCHFAAEPRQLY-FWAPLPHYSA-N 1 2 203.713 2.240 20 0 BEADLO Cc1ccc2[nH+]c(CSc3nc[nH]n3)cn2c1 ZINC000044508627 387931613 /nfs/dbraw/zinc/93/16/13/387931613.db2.gz GAJHMJPRTRHTBU-UHFFFAOYSA-N 1 2 245.311 2.053 20 0 BEADLO C[C@@H](c1ccccc1)[C@@H](O)C[N@H+](C)CC(F)F ZINC000450352230 387955632 /nfs/dbraw/zinc/95/56/32/387955632.db2.gz BNZWXUAVUZKOFP-JQWIXIFHSA-N 1 2 243.297 2.348 20 0 BEADLO C[C@@H](c1ccccc1)[C@@H](O)C[N@@H+](C)CC(F)F ZINC000450352230 387955636 /nfs/dbraw/zinc/95/56/36/387955636.db2.gz BNZWXUAVUZKOFP-JQWIXIFHSA-N 1 2 243.297 2.348 20 0 BEADLO FC(F)(F)CN1CC[C@H](Oc2cc[nH+]cc2)C1 ZINC000156382081 387965328 /nfs/dbraw/zinc/96/53/28/387965328.db2.gz DHJOVYLTEREMDB-JTQLQIEISA-N 1 2 246.232 2.097 20 0 BEADLO C[NH2+]Cc1noc([C@H]2C[C@@H]2c2ccc(C)cc2)n1 ZINC000424342054 387982268 /nfs/dbraw/zinc/98/22/68/387982268.db2.gz WSCCLWIBEJCMIU-NEPJUHHUSA-N 1 2 243.310 2.369 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCS[C@@H](C)[C@H]1C ZINC000245768313 387982797 /nfs/dbraw/zinc/98/27/97/387982797.db2.gz RFPVCHKRLZJQPS-ZJUUUORDSA-N 1 2 225.361 2.044 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCS[C@@H](C)[C@H]1C ZINC000245768313 387982799 /nfs/dbraw/zinc/98/27/99/387982799.db2.gz RFPVCHKRLZJQPS-ZJUUUORDSA-N 1 2 225.361 2.044 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@H](C)[C@H]2C)o1 ZINC000245767352 387983050 /nfs/dbraw/zinc/98/30/50/387983050.db2.gz RCIYZWGFPWZQQP-GHMZBOCLSA-N 1 2 223.316 2.451 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@H](C)[C@H]2C)o1 ZINC000245767352 387983053 /nfs/dbraw/zinc/98/30/53/387983053.db2.gz RCIYZWGFPWZQQP-GHMZBOCLSA-N 1 2 223.316 2.451 20 0 BEADLO CC(C)C(C)(C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000439529258 388007541 /nfs/dbraw/zinc/00/75/41/388007541.db2.gz WUYPAYLOHZNNJF-UHFFFAOYSA-N 1 2 223.320 2.050 20 0 BEADLO CC[C@@H]([NH2+][C@H]1CCCc2nn(C)cc21)C(F)F ZINC000453246144 388023663 /nfs/dbraw/zinc/02/36/63/388023663.db2.gz MJHRAUIZPLTEIQ-ZJUUUORDSA-N 1 2 243.301 2.431 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H](C)c2ccccc2)c[nH+]1 ZINC000082268183 388021182 /nfs/dbraw/zinc/02/11/82/388021182.db2.gz PKLQWPMPADPZDI-SECBINFHSA-N 1 2 229.283 2.209 20 0 BEADLO CC[C@H]([NH2+][C@@H]1CCCc2nn(C)cc21)C(F)F ZINC000453246142 388023623 /nfs/dbraw/zinc/02/36/23/388023623.db2.gz MJHRAUIZPLTEIQ-VHSXEESVSA-N 1 2 243.301 2.431 20 0 BEADLO Cc1nccnc1[C@@H](C)[NH2+][C@@H](C)c1ccon1 ZINC000446890302 388044277 /nfs/dbraw/zinc/04/42/77/388044277.db2.gz IYIUSNLMYMBWFL-WCBMZHEXSA-N 1 2 232.287 2.185 20 0 BEADLO CC[C@H](F)C[N@@H+]1CCC[C@@H](c2n[nH]c(C)n2)C1 ZINC000440518093 388051548 /nfs/dbraw/zinc/05/15/48/388051548.db2.gz JHJJCJYEMDMSAI-MNOVXSKESA-N 1 2 240.326 2.041 20 0 BEADLO CC[C@H](F)C[N@H+]1CCC[C@@H](c2n[nH]c(C)n2)C1 ZINC000440518093 388051552 /nfs/dbraw/zinc/05/15/52/388051552.db2.gz JHJJCJYEMDMSAI-MNOVXSKESA-N 1 2 240.326 2.041 20 0 BEADLO CC[C@H](F)CSc1[nH+]cnc2c1cnn2C ZINC000440577130 388055881 /nfs/dbraw/zinc/05/58/81/388055881.db2.gz SPLCNEYCAVRBML-ZETCQYMHSA-N 1 2 240.307 2.204 20 0 BEADLO CCC[N@@H+](CC(=O)OCC)C[C@H](F)CC ZINC000440693050 388066374 /nfs/dbraw/zinc/06/63/74/388066374.db2.gz LZCODAKBXBNOIO-SNVBAGLBSA-N 1 2 219.300 2.010 20 0 BEADLO CCC[N@H+](CC(=O)OCC)C[C@H](F)CC ZINC000440693050 388066376 /nfs/dbraw/zinc/06/63/76/388066376.db2.gz LZCODAKBXBNOIO-SNVBAGLBSA-N 1 2 219.300 2.010 20 0 BEADLO CCCC[C@@H](CC)C(=O)NCc1c[nH+]c[nH]1 ZINC000084081668 388070267 /nfs/dbraw/zinc/07/02/67/388070267.db2.gz RYUBMWFMCRJZLC-SNVBAGLBSA-N 1 2 223.320 2.242 20 0 BEADLO CCCC[C@@H](CC)C(=O)NCc1c[nH]c[nH+]1 ZINC000084081668 388070272 /nfs/dbraw/zinc/07/02/72/388070272.db2.gz RYUBMWFMCRJZLC-SNVBAGLBSA-N 1 2 223.320 2.242 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)Nc1c[nH+]ccc1OC ZINC000448834433 388114843 /nfs/dbraw/zinc/11/48/43/388114843.db2.gz GQZGKPFZHOHYGS-RKDXNWHRSA-N 1 2 220.272 2.075 20 0 BEADLO C=Cn1cc(C[N@@H+](C)Cc2cccc(C)n2)cn1 ZINC000447725493 388088291 /nfs/dbraw/zinc/08/82/91/388088291.db2.gz CIZVIZDBVQRXJV-UHFFFAOYSA-N 1 2 242.326 2.319 20 0 BEADLO C=Cn1cc(C[N@H+](C)Cc2cccc(C)n2)cn1 ZINC000447725493 388088294 /nfs/dbraw/zinc/08/82/94/388088294.db2.gz CIZVIZDBVQRXJV-UHFFFAOYSA-N 1 2 242.326 2.319 20 0 BEADLO CCC1C[NH+](Cc2ccn(C(F)F)n2)C1 ZINC000453603449 388091267 /nfs/dbraw/zinc/09/12/67/388091267.db2.gz LMTPUSPKHHJFJS-UHFFFAOYSA-N 1 2 215.247 2.120 20 0 BEADLO O=C(/C=C/C1CCCCC1)NCc1[nH]cc[nH+]1 ZINC000117800423 388091877 /nfs/dbraw/zinc/09/18/77/388091877.db2.gz QPUNBJAZRTVBBR-VOTSOKGWSA-N 1 2 233.315 2.162 20 0 BEADLO O=C(C=CC1CCCCC1)NCc1[nH]cc[nH+]1 ZINC000117800423 388091881 /nfs/dbraw/zinc/09/18/81/388091881.db2.gz QPUNBJAZRTVBBR-VOTSOKGWSA-N 1 2 233.315 2.162 20 0 BEADLO CCO[C@@H]1C[C@H]([NH2+]Cc2ccn[nH]2)C12CCCC2 ZINC000085680477 388094416 /nfs/dbraw/zinc/09/44/16/388094416.db2.gz KKCKLJCBISAYFG-QWHCGFSZSA-N 1 2 249.358 2.237 20 0 BEADLO Cc1cc(N2CCO[C@@H](C(C)(C)C)C2)nc[nH+]1 ZINC000447817509 388094677 /nfs/dbraw/zinc/09/46/77/388094677.db2.gz QUHOKBMLKVDLJI-LLVKDONJSA-N 1 2 235.331 2.036 20 0 BEADLO CCCCNC(=O)N[C@@H](C)c1[nH+]ccn1CC ZINC000454195098 388106747 /nfs/dbraw/zinc/10/67/47/388106747.db2.gz ZGFHTKLLHILCNV-JTQLQIEISA-N 1 2 238.335 2.063 20 0 BEADLO CCC[C@@H]([NH2+]Cc1ccccc1C)C(=O)OC ZINC000083362434 388048902 /nfs/dbraw/zinc/04/89/02/388048902.db2.gz HVFUNCMDXWDLAU-CYBMUJFWSA-N 1 2 235.327 2.426 20 0 BEADLO CC[C@@H](F)C[N@H+]([C@H](C)C(=O)OC)C1CCC1 ZINC000440522104 388049035 /nfs/dbraw/zinc/04/90/35/388049035.db2.gz YORQYIAAIXMEEZ-NXEZZACHSA-N 1 2 231.311 2.151 20 0 BEADLO CC[C@@H](F)C[N@@H+]([C@H](C)C(=O)OC)C1CCC1 ZINC000440522104 388049037 /nfs/dbraw/zinc/04/90/37/388049037.db2.gz YORQYIAAIXMEEZ-NXEZZACHSA-N 1 2 231.311 2.151 20 0 BEADLO CC[C@H](F)C[N@H+](CCOC)Cc1cccnc1 ZINC000440517532 388049681 /nfs/dbraw/zinc/04/96/81/388049681.db2.gz IUSWRTSYJWCTKA-ZDUSSCGKSA-N 1 2 240.322 2.278 20 0 BEADLO CC[C@H](F)C[N@@H+](CCOC)Cc1cccnc1 ZINC000440517532 388049686 /nfs/dbraw/zinc/04/96/86/388049686.db2.gz IUSWRTSYJWCTKA-ZDUSSCGKSA-N 1 2 240.322 2.278 20 0 BEADLO CC/C=C\CNC(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000455342059 388156974 /nfs/dbraw/zinc/15/69/74/388156974.db2.gz VGQLLAKALBALNJ-WQMVXFAESA-N 1 2 248.330 2.154 20 0 BEADLO CCC[C@@H]([NH2+][C@@H](C)Cc1ccoc1)C(=O)OC ZINC000449258794 388163503 /nfs/dbraw/zinc/16/35/03/388163503.db2.gz RBXBZHKECNSXOF-CMPLNLGQSA-N 1 2 239.315 2.142 20 0 BEADLO Cc1ccnc([C@@H](C)[NH2+]C(CF)CF)c1 ZINC000449378226 388188190 /nfs/dbraw/zinc/18/81/90/388188190.db2.gz DETWQBWAYBATPS-SECBINFHSA-N 1 2 214.259 2.348 20 0 BEADLO CCC[C@@H](C(=O)N1CCc2[nH]c[nH+]c2C1)C(C)C ZINC000646259033 388172304 /nfs/dbraw/zinc/17/23/04/388172304.db2.gz AYNVBQUCLMDNSA-LLVKDONJSA-N 1 2 249.358 2.367 20 0 BEADLO CCC[C@@H](C(=O)N1CCc2[nH+]c[nH]c2C1)C(C)C ZINC000646259033 388172306 /nfs/dbraw/zinc/17/23/06/388172306.db2.gz AYNVBQUCLMDNSA-LLVKDONJSA-N 1 2 249.358 2.367 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NCC1CCCCCC1 ZINC000456123914 388180014 /nfs/dbraw/zinc/18/00/14/388180014.db2.gz QEFVYWYLUOXDSB-UHFFFAOYSA-N 1 2 249.358 2.347 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)NCC1CCCCCC1 ZINC000456123914 388180018 /nfs/dbraw/zinc/18/00/18/388180018.db2.gz QEFVYWYLUOXDSB-UHFFFAOYSA-N 1 2 249.358 2.347 20 0 BEADLO CC[C@H]([NH2+]Cc1cncs1)C(F)F ZINC000449363988 388181991 /nfs/dbraw/zinc/18/19/91/388181991.db2.gz QTOAHKFYNZLWML-ZETCQYMHSA-N 1 2 206.261 2.276 20 0 BEADLO CC[C@H]([NH2+]Cc1cnn(CC)c1)C(F)F ZINC000449364758 388183685 /nfs/dbraw/zinc/18/36/85/388183685.db2.gz SYPSXOVLNWUELA-VIFPVBQESA-N 1 2 217.263 2.036 20 0 BEADLO COC(=O)[C@H](Cc1ccccc1)[NH2+]C[C@H]1C[C@H]1C ZINC000488526159 388184131 /nfs/dbraw/zinc/18/41/31/388184131.db2.gz FGPJWIBQVHUJAW-BNOWGMLFSA-N 1 2 247.338 2.016 20 0 BEADLO COc1ccccc1C1([NH2+]Cc2cc[nH]n2)CC1 ZINC000646001481 388122806 /nfs/dbraw/zinc/12/28/06/388122806.db2.gz MQLRYCBEUKERBQ-UHFFFAOYSA-N 1 2 243.310 2.197 20 0 BEADLO Cc1cc(NC(=O)C[C@@H]2CC[C@H]3C[C@H]32)cc[nH+]1 ZINC000448962692 388123555 /nfs/dbraw/zinc/12/35/55/388123555.db2.gz SGEFDWAZSGZWGE-GMXVVIOVSA-N 1 2 230.311 2.187 20 0 BEADLO CCn1nnc(C)c1C[N@H+](C)[C@H](C)c1ccco1 ZINC000449010452 388128242 /nfs/dbraw/zinc/12/82/42/388128242.db2.gz LFDMNTMFIHALPL-LLVKDONJSA-N 1 2 248.330 2.392 20 0 BEADLO CCn1nnc(C)c1C[N@@H+](C)[C@H](C)c1ccco1 ZINC000449010452 388128246 /nfs/dbraw/zinc/12/82/46/388128246.db2.gz LFDMNTMFIHALPL-LLVKDONJSA-N 1 2 248.330 2.392 20 0 BEADLO C[N@H+](Cc1ccco1)Cc1ccncc1F ZINC000449009046 388128953 /nfs/dbraw/zinc/12/89/53/388128953.db2.gz UCULKVOQWFKDCF-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO C[N@@H+](Cc1ccco1)Cc1ccncc1F ZINC000449009046 388128954 /nfs/dbraw/zinc/12/89/54/388128954.db2.gz UCULKVOQWFKDCF-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO Cc1sccc1C[N@H+]1CCc2c(ncn2C)C1 ZINC000646046163 388131676 /nfs/dbraw/zinc/13/16/76/388131676.db2.gz BNMRZILIYBFNIG-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1sccc1C[N@@H+]1CCc2c(ncn2C)C1 ZINC000646046163 388131678 /nfs/dbraw/zinc/13/16/78/388131678.db2.gz BNMRZILIYBFNIG-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1sccc1CN1CCc2c([nH+]cn2C)C1 ZINC000646046163 388131680 /nfs/dbraw/zinc/13/16/80/388131680.db2.gz BNMRZILIYBFNIG-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)C1=CC[C@@H](C)CC1 ZINC000454747771 388132411 /nfs/dbraw/zinc/13/24/11/388132411.db2.gz CJJCZFRWDYVHOR-VXGBXAGGSA-N 1 2 247.342 2.134 20 0 BEADLO Cc1nocc1C[N@@H+]1CCC[C@H](c2ccn[nH]2)C1 ZINC000646063761 388135105 /nfs/dbraw/zinc/13/51/05/388135105.db2.gz HJMZXYIIISRLIH-NSHDSACASA-N 1 2 246.314 2.086 20 0 BEADLO Cc1nocc1C[N@H+]1CCC[C@H](c2ccn[nH]2)C1 ZINC000646063761 388135107 /nfs/dbraw/zinc/13/51/07/388135107.db2.gz HJMZXYIIISRLIH-NSHDSACASA-N 1 2 246.314 2.086 20 0 BEADLO CC[C@@H]1CC[C@H]1[NH2+][C@@H](C)C(=O)OC(C)C ZINC000449658390 388249615 /nfs/dbraw/zinc/24/96/15/388249615.db2.gz AUAUHBKNBQAZPC-HBNTYKKESA-N 1 2 213.321 2.105 20 0 BEADLO CC(C)OC(=O)[C@H](C)[NH2+]C1CC(C)(C)C1 ZINC000449661349 388249830 /nfs/dbraw/zinc/24/98/30/388249830.db2.gz IFOATHVVMFVAGX-VIFPVBQESA-N 1 2 213.321 2.105 20 0 BEADLO CCCC[C@@H](COC)[NH2+][C@@H](C)C(=O)OC(C)C ZINC000449662664 388250523 /nfs/dbraw/zinc/25/05/23/388250523.db2.gz MLTHAVZYCJTVRS-RYUDHWBXSA-N 1 2 245.363 2.121 20 0 BEADLO Cc1ccc(N[C@H](C)[C@H]2CCOC2)c[nH+]1 ZINC000162931653 388254683 /nfs/dbraw/zinc/25/46/83/388254683.db2.gz VDRIBUMYDMWKEJ-MNOVXSKESA-N 1 2 206.289 2.227 20 0 BEADLO CCCn1nc(C)c(C[NH2+]C(CF)CF)c1C ZINC000449381985 388189226 /nfs/dbraw/zinc/18/92/26/388189226.db2.gz UMAHLDIDZKQNAO-UHFFFAOYSA-N 1 2 245.317 2.307 20 0 BEADLO CCOC(=O)c1ccc(C[N@@H+]2CC[C@H](F)C2)o1 ZINC000449389265 388192447 /nfs/dbraw/zinc/19/24/47/388192447.db2.gz CKEHNQWYMCWJSI-VIFPVBQESA-N 1 2 241.262 2.000 20 0 BEADLO CCOC(=O)c1ccc(C[N@H+]2CC[C@H](F)C2)o1 ZINC000449389265 388192449 /nfs/dbraw/zinc/19/24/49/388192449.db2.gz CKEHNQWYMCWJSI-VIFPVBQESA-N 1 2 241.262 2.000 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)CC(C)C ZINC000456353467 388196358 /nfs/dbraw/zinc/19/63/58/388196358.db2.gz OPANEZCWKRDYEN-JTQLQIEISA-N 1 2 223.320 2.126 20 0 BEADLO CCC(CC)C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456362317 388197737 /nfs/dbraw/zinc/19/77/37/388197737.db2.gz DXBJPEAJODJZCT-GXSJLCMTSA-N 1 2 235.331 2.441 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)C1(CC)CC1 ZINC000456365695 388197960 /nfs/dbraw/zinc/19/79/60/388197960.db2.gz WBSVNQOESVQHBX-SNVBAGLBSA-N 1 2 235.331 2.270 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)c1ccoc1C ZINC000456397221 388199429 /nfs/dbraw/zinc/19/94/29/388199429.db2.gz SOZKUGCOEILAFO-VIFPVBQESA-N 1 2 247.298 2.295 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)c1ccoc1C ZINC000456397219 388199449 /nfs/dbraw/zinc/19/94/49/388199449.db2.gz SOZKUGCOEILAFO-SECBINFHSA-N 1 2 247.298 2.295 20 0 BEADLO CC(C)[C@H](C)C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456409271 388199460 /nfs/dbraw/zinc/19/94/60/388199460.db2.gz ZNATZOKCEXXILA-OUAUKWLOSA-N 1 2 235.331 2.297 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)C(C)(C)C ZINC000456397113 388199696 /nfs/dbraw/zinc/19/96/96/388199696.db2.gz SNJUHJZPEWZGHS-VIFPVBQESA-N 1 2 223.320 2.126 20 0 BEADLO CC(C)[C@@H]1C[C@@H]1C(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456423719 388200382 /nfs/dbraw/zinc/20/03/82/388200382.db2.gz OXOADPHCNLGVQG-BJDJZHNGSA-N 1 2 247.342 2.297 20 0 BEADLO CC[N@H+](Cc1cccc(C)c1F)C1COC1 ZINC000449422729 388200471 /nfs/dbraw/zinc/20/04/71/388200471.db2.gz FDNDJBQMNHPYTG-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO CC[N@@H+](Cc1cccc(C)c1F)C1COC1 ZINC000449422729 388200473 /nfs/dbraw/zinc/20/04/73/388200473.db2.gz FDNDJBQMNHPYTG-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1nc(NCCOCC2CCCC2)cc[nH+]1 ZINC000313461605 256548978 /nfs/dbraw/zinc/54/89/78/256548978.db2.gz OQYWGAIMVXSSDH-UHFFFAOYSA-N 1 2 235.331 2.404 20 0 BEADLO Cn1c(C[N@H+](C)[C@H]2CC2(C)C)nnc1C1CCC1 ZINC000489438843 388213867 /nfs/dbraw/zinc/21/38/67/388213867.db2.gz OSGJINGQTOTCTF-NSHDSACASA-N 1 2 248.374 2.313 20 0 BEADLO Cn1c(C[N@@H+](C)[C@H]2CC2(C)C)nnc1C1CCC1 ZINC000489438843 388213869 /nfs/dbraw/zinc/21/38/69/388213869.db2.gz OSGJINGQTOTCTF-NSHDSACASA-N 1 2 248.374 2.313 20 0 BEADLO CO[C@H](C)c1noc(C[N@H+](C)[C@H]2CC2(C)C)n1 ZINC000489467981 388216498 /nfs/dbraw/zinc/21/64/98/388216498.db2.gz WYTJZQUJDBXKGW-BDAKNGLRSA-N 1 2 239.319 2.007 20 0 BEADLO CO[C@H](C)c1noc(C[N@@H+](C)[C@H]2CC2(C)C)n1 ZINC000489467981 388216500 /nfs/dbraw/zinc/21/65/00/388216500.db2.gz WYTJZQUJDBXKGW-BDAKNGLRSA-N 1 2 239.319 2.007 20 0 BEADLO CC(C)c1ccc(C[N@H+]2CC(=O)N[C@H](C)C2)cc1 ZINC000449525335 388224463 /nfs/dbraw/zinc/22/44/63/388224463.db2.gz RIJKPKAYCYUKGU-GFCCVEGCSA-N 1 2 246.354 2.130 20 0 BEADLO CC(C)c1ccc(C[N@@H+]2CC(=O)N[C@H](C)C2)cc1 ZINC000449525335 388224465 /nfs/dbraw/zinc/22/44/65/388224465.db2.gz RIJKPKAYCYUKGU-GFCCVEGCSA-N 1 2 246.354 2.130 20 0 BEADLO Cc1cc(C)c(CNC(=O)C[C@H]2C[C@H]2C)c[nH+]1 ZINC000456833969 388226145 /nfs/dbraw/zinc/22/61/45/388226145.db2.gz HEOPBURFOVVHAA-ZYHUDNBSSA-N 1 2 232.327 2.361 20 0 BEADLO Cc1cc(C)c(CNC(=O)C[C@H]2C[C@@H]2C)c[nH+]1 ZINC000456833966 388226393 /nfs/dbraw/zinc/22/63/93/388226393.db2.gz HEOPBURFOVVHAA-CMPLNLGQSA-N 1 2 232.327 2.361 20 0 BEADLO Cc1nc(N2CCC[C@H](OCC3CC3)C2)cc[nH+]1 ZINC000489935987 388228768 /nfs/dbraw/zinc/22/87/68/388228768.db2.gz XBWBULJZFPAMKP-ZDUSSCGKSA-N 1 2 247.342 2.180 20 0 BEADLO CC(=O)CCCC(=O)NCc1c[nH+]c(C)cc1C ZINC000456869911 388229859 /nfs/dbraw/zinc/22/98/59/388229859.db2.gz YVPXGTKKFDYQSM-UHFFFAOYSA-N 1 2 248.326 2.074 20 0 BEADLO FC(F)(F)[C@H]([NH2+][C@H]1CCCOCC1)C1CC1 ZINC000336661883 388259874 /nfs/dbraw/zinc/25/98/74/388259874.db2.gz CTIPWSIXXIPCRO-VHSXEESVSA-N 1 2 237.265 2.486 20 0 BEADLO CC[C@]1(O)CCN(c2cc(C)[nH+]c(C(C)C)n2)C1 ZINC000490068071 388233534 /nfs/dbraw/zinc/23/35/34/388233534.db2.gz AZBDIUAJDJYTAO-AWEZNQCLSA-N 1 2 249.358 2.260 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000646328750 388234120 /nfs/dbraw/zinc/23/41/20/388234120.db2.gz LTBKAIBGIUMFGK-SDDRHHMPSA-N 1 2 245.326 2.122 20 0 BEADLO CC[C@@H]1CN(CC)CC[N@@H+]1Cc1cccnc1C ZINC000449567096 388235099 /nfs/dbraw/zinc/23/50/99/388235099.db2.gz TZDBVPRUMXMFAP-OAHLLOKOSA-N 1 2 247.386 2.306 20 0 BEADLO CC[C@@H]1CN(CC)CC[N@H+]1Cc1cccnc1C ZINC000449567096 388235100 /nfs/dbraw/zinc/23/51/00/388235100.db2.gz TZDBVPRUMXMFAP-OAHLLOKOSA-N 1 2 247.386 2.306 20 0 BEADLO FC(F)(F)[C@@H]([NH2+][C@@H]1CCCOCC1)C1CC1 ZINC000336661884 388260092 /nfs/dbraw/zinc/26/00/92/388260092.db2.gz CTIPWSIXXIPCRO-ZJUUUORDSA-N 1 2 237.265 2.486 20 0 BEADLO CCc1ncc(C[NH2+]Cc2ccc(C)o2)o1 ZINC000449607387 388241731 /nfs/dbraw/zinc/24/17/31/388241731.db2.gz AOBKXDNGUYZKNB-UHFFFAOYSA-N 1 2 220.272 2.428 20 0 BEADLO CO[C@H]1C[C@@H]([N@H+](C)Cc2cn[nH]c2C)C12CCC2 ZINC000449637164 388246925 /nfs/dbraw/zinc/24/69/25/388246925.db2.gz YITMKWLEFOAKBB-OLZOCXBDSA-N 1 2 249.358 2.108 20 0 BEADLO CO[C@H]1C[C@@H]([N@@H+](C)Cc2cn[nH]c2C)C12CCC2 ZINC000449637164 388246926 /nfs/dbraw/zinc/24/69/26/388246926.db2.gz YITMKWLEFOAKBB-OLZOCXBDSA-N 1 2 249.358 2.108 20 0 BEADLO C[C@H](O)C[N@H+](CCC(C)(C)C)CC(F)F ZINC000449633897 388247003 /nfs/dbraw/zinc/24/70/03/388247003.db2.gz VGKRRLUUARHKLX-VIFPVBQESA-N 1 2 223.307 2.371 20 0 BEADLO C[C@H](O)C[N@@H+](CCC(C)(C)C)CC(F)F ZINC000449633897 388247004 /nfs/dbraw/zinc/24/70/04/388247004.db2.gz VGKRRLUUARHKLX-VIFPVBQESA-N 1 2 223.307 2.371 20 0 BEADLO Cc1ccc(N[C@H]2CCO[C@H](C)C2)c[nH+]1 ZINC000164812613 388248240 /nfs/dbraw/zinc/24/82/40/388248240.db2.gz DMCODAFNRHVLAK-MNOVXSKESA-N 1 2 206.289 2.369 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)[C@@H]2CC23CCC3)[nH+]1 ZINC001645476486 1172672124 /nfs/dbraw/zinc/67/21/24/1172672124.db2.gz OFEYCBPIUZGPTO-NSHDSACASA-N 1 2 247.342 2.340 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)[C@@H]2CC23CCC3)c[nH+]1 ZINC001645476486 1172672131 /nfs/dbraw/zinc/67/21/31/1172672131.db2.gz OFEYCBPIUZGPTO-NSHDSACASA-N 1 2 247.342 2.340 20 0 BEADLO C[C@H](O)C[N@H+](CC(F)F)[C@@H]1C=CCCC1 ZINC000451850082 388300752 /nfs/dbraw/zinc/30/07/52/388300752.db2.gz KFAMNMGRBYBUKD-VHSXEESVSA-N 1 2 219.275 2.043 20 0 BEADLO C[C@H](O)C[N@@H+](CC(F)F)[C@@H]1C=CCCC1 ZINC000451850082 388300754 /nfs/dbraw/zinc/30/07/54/388300754.db2.gz KFAMNMGRBYBUKD-VHSXEESVSA-N 1 2 219.275 2.043 20 0 BEADLO O=C(/C=C\C1CCCCC1)NC1=[NH+]CCS1 ZINC000491843664 388324640 /nfs/dbraw/zinc/32/46/40/388324640.db2.gz JMWBGAHVXNMVIL-SREVYHEPSA-N 1 2 238.356 2.342 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)/C=C/C1CCCCC1 ZINC000491845673 388324782 /nfs/dbraw/zinc/32/47/82/388324782.db2.gz NZMXHRXKOHGAIL-BQYQJAHWSA-N 1 2 247.342 2.173 20 0 BEADLO Cc1cnc([C@H](C)[N@H+](C)Cc2ccccn2)cn1 ZINC000451372108 388266959 /nfs/dbraw/zinc/26/69/59/388266959.db2.gz XHHJGVNVCWFONP-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+](C)Cc2ccccn2)cn1 ZINC000451372108 388266961 /nfs/dbraw/zinc/26/69/61/388266961.db2.gz XHHJGVNVCWFONP-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO FCC1CC[NH+](Cc2nc(C3CC3)no2)CC1 ZINC000451388992 388268554 /nfs/dbraw/zinc/26/85/54/388268554.db2.gz OLYRUDPRTKNUPE-UHFFFAOYSA-N 1 2 239.294 2.129 20 0 BEADLO CCCc1nc(C[NH+]2CCC(CF)CC2)no1 ZINC000451389003 388268748 /nfs/dbraw/zinc/26/87/48/388268748.db2.gz OPIOAIDFAHPALG-UHFFFAOYSA-N 1 2 241.310 2.204 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)Nc1nccs1 ZINC000492298487 388340641 /nfs/dbraw/zinc/34/06/41/388340641.db2.gz KGZRSGOQJJRFDA-ARJAWSKDSA-N 1 2 248.311 2.011 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1)c1ncn(C)n1 ZINC000275616214 388344908 /nfs/dbraw/zinc/34/49/08/388344908.db2.gz KRURIWUTXXBYKB-NXEZZACHSA-N 1 2 248.305 2.366 20 0 BEADLO CCC[C@H]([NH2+][C@@H]1C[C@@H]1CC)C(=O)OCC ZINC000233357786 388346455 /nfs/dbraw/zinc/34/64/55/388346455.db2.gz DTIRMBCFMJCAEE-GARJFASQSA-N 1 2 213.321 2.106 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccsc1)c1ncnn1C ZINC000276620280 388349771 /nfs/dbraw/zinc/34/97/71/388349771.db2.gz MGQRGAKIVRRZMG-DTWKUNHWSA-N 1 2 236.344 2.288 20 0 BEADLO C[N@H+](CCCCO)C/C(Cl)=C/Cl ZINC000276469411 388349861 /nfs/dbraw/zinc/34/98/61/388349861.db2.gz YNAXVAQNMXAWGB-VURMDHGXSA-N 1 2 212.120 2.010 20 0 BEADLO C[N@@H+](CCCCO)C/C(Cl)=C/Cl ZINC000276469411 388349862 /nfs/dbraw/zinc/34/98/62/388349862.db2.gz YNAXVAQNMXAWGB-VURMDHGXSA-N 1 2 212.120 2.010 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ncnn1C)c1ccsc1 ZINC000276620279 388350018 /nfs/dbraw/zinc/35/00/18/388350018.db2.gz MGQRGAKIVRRZMG-BDAKNGLRSA-N 1 2 236.344 2.288 20 0 BEADLO C[C@H](NCc1cn2ccccc2[nH+]1)C(F)(F)F ZINC000277236212 388353934 /nfs/dbraw/zinc/35/39/34/388353934.db2.gz PELAOVKPAKTREO-QMMMGPOBSA-N 1 2 243.232 2.375 20 0 BEADLO C[C@H]1C[C@H](C)CN(c2nc[nH+]c(N)c2Cl)C1 ZINC000227840714 388371761 /nfs/dbraw/zinc/37/17/61/388371761.db2.gz XEMVKWLQHTYCPG-YUMQZZPRSA-N 1 2 240.738 2.195 20 0 BEADLO C[C@H]1C[C@H](C)CN(c2[nH+]cnc(N)c2Cl)C1 ZINC000227840714 388371764 /nfs/dbraw/zinc/37/17/64/388371764.db2.gz XEMVKWLQHTYCPG-YUMQZZPRSA-N 1 2 240.738 2.195 20 0 BEADLO C[C@@H](CN(C)C)[NH2+]Cc1cccc(O)c1Cl ZINC000292825540 388383052 /nfs/dbraw/zinc/38/30/52/388383052.db2.gz ADVAXGBPLJCNIA-VIFPVBQESA-N 1 2 242.750 2.085 20 0 BEADLO COc1c(N)[nH+]cnc1N[C@@H](C1CC1)C1CCC1 ZINC000324967587 388391557 /nfs/dbraw/zinc/39/15/57/388391557.db2.gz KPTXOLUTVFKLAF-SNVBAGLBSA-N 1 2 248.330 2.058 20 0 BEADLO COc1c(N)nc[nH+]c1N[C@@H](C1CC1)C1CCC1 ZINC000324967587 388391559 /nfs/dbraw/zinc/39/15/59/388391559.db2.gz KPTXOLUTVFKLAF-SNVBAGLBSA-N 1 2 248.330 2.058 20 0 BEADLO Fc1ccccc1C[NH2+]Cc1cocn1 ZINC000237829097 388399121 /nfs/dbraw/zinc/39/91/21/388399121.db2.gz JLWHJBXBBCOQJG-UHFFFAOYSA-N 1 2 206.220 2.104 20 0 BEADLO O=C(/C=C\C1CCC1)NCCCCn1cc[nH+]c1 ZINC000492083492 388334002 /nfs/dbraw/zinc/33/40/02/388334002.db2.gz IQMYSLAEDIAHDY-SREVYHEPSA-N 1 2 247.342 2.136 20 0 BEADLO CN(Cc1cccc(O)c1)c1cccc[nH+]1 ZINC000527289172 388461200 /nfs/dbraw/zinc/46/12/00/388461200.db2.gz JIEXGBUEIOEJGA-UHFFFAOYSA-N 1 2 214.268 2.424 20 0 BEADLO Cc1cccn2cc(CSc3cn[nH]n3)[nH+]c12 ZINC000177364702 388481644 /nfs/dbraw/zinc/48/16/44/388481644.db2.gz DRYSGTJVDKZKMA-UHFFFAOYSA-N 1 2 245.311 2.053 20 0 BEADLO Cc1cccn2cc(CSc3c[nH]nn3)[nH+]c12 ZINC000177364702 388481648 /nfs/dbraw/zinc/48/16/48/388481648.db2.gz DRYSGTJVDKZKMA-UHFFFAOYSA-N 1 2 245.311 2.053 20 0 BEADLO C[C@@H](F)CC[NH+]=c1[nH]c2ccccc2[nH]1 ZINC000338747403 388477132 /nfs/dbraw/zinc/47/71/32/388477132.db2.gz CGULKVMHSYPCIQ-MRVPVSSYSA-N 1 2 207.252 2.145 20 0 BEADLO c1cnc(C[NH2+][C@H](c2cccnc2)C2CC2)nc1 ZINC000573037596 388411265 /nfs/dbraw/zinc/41/12/65/388411265.db2.gz BVQDXCUKQNKGNN-AWEZNQCLSA-N 1 2 240.310 2.113 20 0 BEADLO C[C@@H]([NH2+]Cc1cnn[nH]1)c1cccc(Cl)c1 ZINC000296324369 388421983 /nfs/dbraw/zinc/42/19/83/388421983.db2.gz ORJMHYXCNBJJIZ-MRVPVSSYSA-N 1 2 236.706 2.309 20 0 BEADLO C[C@@H]([NH2+]Cc1c[nH]nn1)c1cccc(Cl)c1 ZINC000296324369 388421985 /nfs/dbraw/zinc/42/19/85/388421985.db2.gz ORJMHYXCNBJJIZ-MRVPVSSYSA-N 1 2 236.706 2.309 20 0 BEADLO C[C@H](CC(=O)NC[C@@H]1CCC[C@H]1C)n1cc[nH+]c1 ZINC000573123164 388422158 /nfs/dbraw/zinc/42/21/58/388422158.db2.gz BROHGNZUFAXQQM-UPJWGTAASA-N 1 2 249.358 2.387 20 0 BEADLO CCC[C@H](CC(C)C)C(=O)NCc1[nH]cc[nH+]1 ZINC000308085995 388431762 /nfs/dbraw/zinc/43/17/62/388431762.db2.gz HEEBBIKIBNJMGQ-LLVKDONJSA-N 1 2 237.347 2.488 20 0 BEADLO Cc1[nH]c(CN[C@@H](C)c2cscn2)[nH+]c1C ZINC000573221778 388434275 /nfs/dbraw/zinc/43/42/75/388434275.db2.gz PGOMDQFTXXIOCM-VIFPVBQESA-N 1 2 236.344 2.334 20 0 BEADLO C[C@H](CC(=O)N[C@@H]1CCC[C@H]1C)n1cc[nH+]c1 ZINC000517153867 388539436 /nfs/dbraw/zinc/53/94/36/388539436.db2.gz ILPVVDGBOSJHKX-IJLUTSLNSA-N 1 2 235.331 2.139 20 0 BEADLO Cc1cccc(CN(C)c2nc(C)[nH+]cc2C)n1 ZINC000517176693 388540527 /nfs/dbraw/zinc/54/05/27/388540527.db2.gz PFINXVRREOTFQI-UHFFFAOYSA-N 1 2 242.326 2.433 20 0 BEADLO CC[C@H](C)CN(C)C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000517172215 388541064 /nfs/dbraw/zinc/54/10/64/388541064.db2.gz UZFMMTOHNZADPT-QWRGUYRKSA-N 1 2 237.347 2.093 20 0 BEADLO CC[C@H](C)CN(C)C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000517172215 388541067 /nfs/dbraw/zinc/54/10/67/388541067.db2.gz UZFMMTOHNZADPT-QWRGUYRKSA-N 1 2 237.347 2.093 20 0 BEADLO CC1(C)CCC[C@@H]1C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000547801029 388485310 /nfs/dbraw/zinc/48/53/10/388485310.db2.gz QRODSUPNMUBWTF-GFCCVEGCSA-N 1 2 247.342 2.093 20 0 BEADLO CC(C)CNc1cc(NC2CC2)nc[nH+]1 ZINC000244291131 388489833 /nfs/dbraw/zinc/48/98/33/388489833.db2.gz WVSPTGICCRPCFZ-UHFFFAOYSA-N 1 2 206.293 2.119 20 0 BEADLO CC(C)CNc1cc(NC2CC2)[nH+]cn1 ZINC000244291131 388489836 /nfs/dbraw/zinc/48/98/36/388489836.db2.gz WVSPTGICCRPCFZ-UHFFFAOYSA-N 1 2 206.293 2.119 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)C(C)(C)C(C)(F)F ZINC000406000189 388497005 /nfs/dbraw/zinc/49/70/05/388497005.db2.gz XUJAHWRXCSJPJU-UHFFFAOYSA-N 1 2 245.273 2.050 20 0 BEADLO Cc1cc(NC[C@@H]2CC[C@H](C)O2)nc(C(C)C)[nH+]1 ZINC000397856606 388506333 /nfs/dbraw/zinc/50/63/33/388506333.db2.gz BJAVGNLKGZEWNV-RYUDHWBXSA-N 1 2 249.358 2.310 20 0 BEADLO Cc1csc(C[NH2+]Cc2csnn2)c1 ZINC000344607848 388507901 /nfs/dbraw/zinc/50/79/01/388507901.db2.gz GJBNUOLCXROCAL-UHFFFAOYSA-N 1 2 225.342 2.198 20 0 BEADLO C[C@H]1CC[C@H](C(=O)NC(C)(C)c2[nH]cc[nH+]2)C1 ZINC000517380661 388549393 /nfs/dbraw/zinc/54/93/93/388549393.db2.gz DBADIYLQVLAMGR-UWVGGRQHSA-N 1 2 235.331 2.197 20 0 BEADLO COCc1nc(C[NH+]2[C@H](C)C[C@H]2C)cs1 ZINC000548097466 388510353 /nfs/dbraw/zinc/51/03/53/388510353.db2.gz URLCOSNZWWCHQJ-RKDXNWHRSA-N 1 2 226.345 2.272 20 0 BEADLO C[C@H](CC(C)(C)C)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000548128831 388515838 /nfs/dbraw/zinc/51/58/38/388515838.db2.gz MYBVTRYUBJMDLH-LLVKDONJSA-N 1 2 249.358 2.339 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)Cc1ccccn1 ZINC000516820340 388519248 /nfs/dbraw/zinc/51/92/48/388519248.db2.gz CPGXFOHCZLOTTG-UHFFFAOYSA-N 1 2 228.299 2.125 20 0 BEADLO Cc1csc(C[NH2+]Cc2cccc(C)n2)n1 ZINC000079055137 388521834 /nfs/dbraw/zinc/52/18/34/388521834.db2.gz JNNPDRZENVJJEN-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO C/C(Cl)=C/C[N@H+]1CCC[C@H]1c1nncn1C ZINC000528428306 388523324 /nfs/dbraw/zinc/52/33/24/388523324.db2.gz DIEGJLGYNFUBNG-BSKOKIOFSA-N 1 2 240.738 2.095 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1CCC[C@H]1c1nncn1C ZINC000528428306 388523327 /nfs/dbraw/zinc/52/33/27/388523327.db2.gz DIEGJLGYNFUBNG-BSKOKIOFSA-N 1 2 240.738 2.095 20 0 BEADLO C[C@H](F)CCNc1cc[nH+]c(C(C)(C)C)n1 ZINC000378864468 388526924 /nfs/dbraw/zinc/52/69/24/388526924.db2.gz XKQCYCYRDGSBRK-VIFPVBQESA-N 1 2 225.311 2.356 20 0 BEADLO CCC[C@@]1(C)C(=O)NCC[N@H+]1C/C=C(/C)Cl ZINC000528477451 388533188 /nfs/dbraw/zinc/53/31/88/388533188.db2.gz WBSIMKCJXKGOTJ-JSJZCHLLSA-N 1 2 244.766 2.120 20 0 BEADLO CCC[C@@]1(C)C(=O)NCC[N@@H+]1C/C=C(/C)Cl ZINC000528477451 388533190 /nfs/dbraw/zinc/53/31/90/388533190.db2.gz WBSIMKCJXKGOTJ-JSJZCHLLSA-N 1 2 244.766 2.120 20 0 BEADLO C/C(Cl)=C/C[N@@H+](C)Cc1cnn(C)c1C ZINC000528485238 388534457 /nfs/dbraw/zinc/53/44/57/388534457.db2.gz LYTCROCQCUIXKZ-UITAMQMPSA-N 1 2 227.739 2.303 20 0 BEADLO C/C(Cl)=C/C[N@H+](C)Cc1cnn(C)c1C ZINC000528485238 388534461 /nfs/dbraw/zinc/53/44/61/388534461.db2.gz LYTCROCQCUIXKZ-UITAMQMPSA-N 1 2 227.739 2.303 20 0 BEADLO C[C@H](c1nc(C2CC2)no1)[N@H+]1[C@H](C)C[C@@H]1C ZINC000548425958 388536581 /nfs/dbraw/zinc/53/65/81/388536581.db2.gz XFBWHSWZLSZYCU-HRDYMLBCSA-N 1 2 221.304 2.491 20 0 BEADLO C[C@H](c1nc(C2CC2)no1)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548425958 388536582 /nfs/dbraw/zinc/53/65/82/388536582.db2.gz XFBWHSWZLSZYCU-HRDYMLBCSA-N 1 2 221.304 2.491 20 0 BEADLO Cc1[nH]c(C(=O)NCC[C@H]2CC=CCC2)c[nH+]1 ZINC000529868408 388594711 /nfs/dbraw/zinc/59/47/11/388594711.db2.gz MZKGDKZFYAPTSS-NSHDSACASA-N 1 2 233.315 2.194 20 0 BEADLO CC(C)c1nc(N[C@H]2CCCC[C@@H]2O)cc[nH+]1 ZINC000106465302 388595328 /nfs/dbraw/zinc/59/53/28/388595328.db2.gz AQJCAIPIJUCESS-QWRGUYRKSA-N 1 2 235.331 2.315 20 0 BEADLO CCC(F)(F)C[NH2+]Cc1ccn(C)c1 ZINC000623678896 388614789 /nfs/dbraw/zinc/61/47/89/388614789.db2.gz AMYOZKHFLSBSEA-UHFFFAOYSA-N 1 2 202.248 2.160 20 0 BEADLO CC(C)c1nc(N(C)C[C@H]2CCC[C@H]2O)cc[nH+]1 ZINC000246059681 388614944 /nfs/dbraw/zinc/61/49/44/388614944.db2.gz BGERZQHYKUQEMZ-VXGBXAGGSA-N 1 2 249.358 2.197 20 0 BEADLO CC(C)c1nc(N(C)C[C@@H]2CCC[C@H]2O)cc[nH+]1 ZINC000246059673 388614960 /nfs/dbraw/zinc/61/49/60/388614960.db2.gz BGERZQHYKUQEMZ-NWDGAFQWSA-N 1 2 249.358 2.197 20 0 BEADLO CCCc1nc(C[N@H+](C)[C@@H](C)C2CC2)no1 ZINC000517607817 388555393 /nfs/dbraw/zinc/55/53/93/388555393.db2.gz VPLLAXUJYUJEBJ-VIFPVBQESA-N 1 2 223.320 2.252 20 0 BEADLO CCCc1nc(C[N@@H+](C)[C@@H](C)C2CC2)no1 ZINC000517607817 388555395 /nfs/dbraw/zinc/55/53/95/388555395.db2.gz VPLLAXUJYUJEBJ-VIFPVBQESA-N 1 2 223.320 2.252 20 0 BEADLO COC(=O)[C@@H]([NH2+][C@H]1CC12CCCCC2)C1CC1 ZINC000358824788 388555554 /nfs/dbraw/zinc/55/55/54/388555554.db2.gz XBXRFLKTDDYVPS-RYUDHWBXSA-N 1 2 237.343 2.250 20 0 BEADLO FC(F)(F)[C@@H]1CCCN1CCCn1cc[nH+]c1 ZINC000528671970 388557735 /nfs/dbraw/zinc/55/77/35/388557735.db2.gz XEYLNZWNKBDLQN-JTQLQIEISA-N 1 2 247.264 2.300 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1CCOC[C@H]1C ZINC000194314275 388560161 /nfs/dbraw/zinc/56/01/61/388560161.db2.gz UKESWHGGHIRMGQ-GHMZBOCLSA-N 1 2 234.299 2.001 20 0 BEADLO COc1ccc(CNc2nc(C)[nH+]cc2C)cc1 ZINC000521122161 388563125 /nfs/dbraw/zinc/56/31/25/388563125.db2.gz ACJBDWPGTDFWDT-UHFFFAOYSA-N 1 2 243.310 2.136 20 0 BEADLO CCc1cc(C[NH2+][C@H](C)c2cc(C)n(C)n2)on1 ZINC000548792299 388563465 /nfs/dbraw/zinc/56/34/65/388563465.db2.gz YBBGPASFORGRNU-SNVBAGLBSA-N 1 2 248.330 2.130 20 0 BEADLO C[C@H](C[N@H+](C)Cc1cn[nH]n1)C1CCCCC1 ZINC000528774063 388571889 /nfs/dbraw/zinc/57/18/89/388571889.db2.gz PLXIZRDALXLMNO-LLVKDONJSA-N 1 2 236.363 2.453 20 0 BEADLO Cc1cccc(Cl)c1NC(=O)Cn1cc[nH+]c1 ZINC000085296740 388665940 /nfs/dbraw/zinc/66/59/40/388665940.db2.gz UEWHAAZEWVPFHW-UHFFFAOYSA-N 1 2 249.701 2.484 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)no1 ZINC000247644749 388667026 /nfs/dbraw/zinc/66/70/26/388667026.db2.gz UEQJBNBYBVSFNZ-WDEREUQCSA-N 1 2 235.331 2.397 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)no1 ZINC000247644749 388667027 /nfs/dbraw/zinc/66/70/27/388667027.db2.gz UEQJBNBYBVSFNZ-WDEREUQCSA-N 1 2 235.331 2.397 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@H]3CCC[C@H]32)no1 ZINC000247644748 388667559 /nfs/dbraw/zinc/66/75/59/388667559.db2.gz UEQJBNBYBVSFNZ-GHMZBOCLSA-N 1 2 235.331 2.397 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@H]3CCC[C@H]32)no1 ZINC000247644748 388667561 /nfs/dbraw/zinc/66/75/61/388667561.db2.gz UEQJBNBYBVSFNZ-GHMZBOCLSA-N 1 2 235.331 2.397 20 0 BEADLO CCn1cc[nH+]c1CNc1cccnc1C ZINC000085711896 388672869 /nfs/dbraw/zinc/67/28/69/388672869.db2.gz CTEAVKXTYYVTRS-UHFFFAOYSA-N 1 2 216.288 2.219 20 0 BEADLO Cc1cc(C)c(C(=O)N[C@H](C)c2[nH]cc[nH+]2)o1 ZINC000552227799 388683173 /nfs/dbraw/zinc/68/31/73/388683173.db2.gz RUTBLGLAJBXWBS-SECBINFHSA-N 1 2 233.271 2.111 20 0 BEADLO CC1(C[NH2+][C@@H](c2cccs2)c2nnc[nH]2)CC1 ZINC000551086899 388621898 /nfs/dbraw/zinc/62/18/98/388621898.db2.gz ZVTOJEQDFPQJER-JTQLQIEISA-N 1 2 248.355 2.345 20 0 BEADLO CC[C@@H](NC(=O)[C@H]1C[C@@H]1C1CC1)c1[nH]cc[nH+]1 ZINC000551874866 388644069 /nfs/dbraw/zinc/64/40/69/388644069.db2.gz VEODRKGHDAJUCP-OUAUKWLOSA-N 1 2 233.315 2.023 20 0 BEADLO CC[C@@H](NC(=O)CC(C)(F)F)c1[nH]cc[nH+]1 ZINC000328449768 388644083 /nfs/dbraw/zinc/64/40/83/388644083.db2.gz CTSXYCPZYVDPON-SSDOTTSWSA-N 1 2 231.246 2.022 20 0 BEADLO CC1(CCNc2nc(N)c3ccccc3[nH+]2)CC1 ZINC000530376427 388653172 /nfs/dbraw/zinc/65/31/72/388653172.db2.gz WNHSCCVDOIEECR-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO CC[C@H](CC(=O)N1CC(n2cc[nH+]c2)C1)C(C)C ZINC000522258533 388738443 /nfs/dbraw/zinc/73/84/43/388738443.db2.gz KWVURFCOAZWWLY-GFCCVEGCSA-N 1 2 249.358 2.339 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CCOC[C@@H]2C)cc[nH+]1 ZINC000194802781 388743705 /nfs/dbraw/zinc/74/37/05/388743705.db2.gz REWGEUBOFANNHA-CABZTGNLSA-N 1 2 234.299 2.001 20 0 BEADLO Cn1c[nH+]cc1COc1cccc(F)c1 ZINC000090233680 388746474 /nfs/dbraw/zinc/74/64/74/388746474.db2.gz HUGMPZVGZULNSP-UHFFFAOYSA-N 1 2 206.220 2.138 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)Nc1ccnc(Cl)c1 ZINC000227686420 388754809 /nfs/dbraw/zinc/75/48/09/388754809.db2.gz FSMJXKZRJNXONX-SECBINFHSA-N 1 2 236.706 2.432 20 0 BEADLO CCc1nc(C[N@H+](C)[C@@H](C)CCSC)no1 ZINC000126509175 388697507 /nfs/dbraw/zinc/69/75/07/388697507.db2.gz PKFXFUVLRXXBLP-VIFPVBQESA-N 1 2 243.376 2.205 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@@H](C)CCSC)no1 ZINC000126509175 388697509 /nfs/dbraw/zinc/69/75/09/388697509.db2.gz PKFXFUVLRXXBLP-VIFPVBQESA-N 1 2 243.376 2.205 20 0 BEADLO Cc1ccc(NC(=O)C2(C)CC2)c(C)[nH+]1 ZINC000127110280 388715291 /nfs/dbraw/zinc/71/52/91/388715291.db2.gz FAZJPQKDNHFIOM-UHFFFAOYSA-N 1 2 204.273 2.437 20 0 BEADLO Fc1cc(F)c(C[NH2+]Cc2cc[nH]n2)cc1F ZINC000225275989 388720362 /nfs/dbraw/zinc/72/03/62/388720362.db2.gz MNAYGOOMVAVDAH-UHFFFAOYSA-N 1 2 241.216 2.117 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N[C@H]1CC2CCC1CC2 ZINC000554357244 388810785 /nfs/dbraw/zinc/81/07/85/388810785.db2.gz KWSNJTJTDXCWPI-XIVSLSHWSA-N 1 2 247.342 2.037 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N[C@H]1CC2CCC1CC2 ZINC000554357244 388810786 /nfs/dbraw/zinc/81/07/86/388810786.db2.gz KWSNJTJTDXCWPI-XIVSLSHWSA-N 1 2 247.342 2.037 20 0 BEADLO COc1ccccc1[C@@H](CO)[NH2+]Cc1ccco1 ZINC000522536543 388760260 /nfs/dbraw/zinc/76/02/60/388760260.db2.gz ULKJPXKGOZGTJV-CYBMUJFWSA-N 1 2 247.294 2.111 20 0 BEADLO Cc1cc(N[C@H]2CCC[C@H]2F)nc(C2CC2)[nH+]1 ZINC000338844829 177709770 /nfs/dbraw/zinc/70/97/70/177709770.db2.gz SECHXDBHDTXWET-MNOVXSKESA-N 1 2 235.306 2.387 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NCCCCn2cc[nH+]c2)C1 ZINC000540690022 388814835 /nfs/dbraw/zinc/81/48/35/388814835.db2.gz JNPOMDPEOAQKJB-CHWSQXEVSA-N 1 2 249.358 2.216 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N[C@H]1CC2CCC1CC2 ZINC000554508456 388817379 /nfs/dbraw/zinc/81/73/79/388817379.db2.gz AMBSXURUJZDJHG-MCIGGMRASA-N 1 2 247.342 2.037 20 0 BEADLO CC(C)(C)CCCNC(=O)CCc1[nH]cc[nH+]1 ZINC000554514857 388818688 /nfs/dbraw/zinc/81/86/88/388818688.db2.gz SGLSUXRWAPPVIY-UHFFFAOYSA-N 1 2 237.347 2.285 20 0 BEADLO CCSCC[N@H+](C)[C@H](C)C(=O)OC(C)C ZINC000129636269 388862069 /nfs/dbraw/zinc/86/20/69/388862069.db2.gz GDRPBTVEAWEOTR-SNVBAGLBSA-N 1 2 233.377 2.011 20 0 BEADLO CCSCC[N@@H+](C)[C@H](C)C(=O)OC(C)C ZINC000129636269 388862072 /nfs/dbraw/zinc/86/20/72/388862072.db2.gz GDRPBTVEAWEOTR-SNVBAGLBSA-N 1 2 233.377 2.011 20 0 BEADLO CC(C)[C@@H]([NH2+]Cc1cc[nH]n1)c1ccc(F)cn1 ZINC000541849382 388869275 /nfs/dbraw/zinc/86/92/75/388869275.db2.gz UGRQORUUQKXPQQ-CYBMUJFWSA-N 1 2 248.305 2.431 20 0 BEADLO COc1cc[nH+]cc1NC(=O)Cc1ccccc1 ZINC000194735635 388881233 /nfs/dbraw/zinc/88/12/33/388881233.db2.gz QRJUOTPPNJKKEY-UHFFFAOYSA-N 1 2 242.278 2.271 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCCCCC1 ZINC000564720155 388886261 /nfs/dbraw/zinc/88/62/61/388886261.db2.gz JBNDZTXKHZZLKP-UHFFFAOYSA-N 1 2 205.305 2.474 20 0 BEADLO COC(=O)c1coc(C[N@@H+]2CCC[C@@H](F)C2)c1 ZINC000565100198 388914576 /nfs/dbraw/zinc/91/45/76/388914576.db2.gz RAVLFCQFZVEBNG-SNVBAGLBSA-N 1 2 241.262 2.000 20 0 BEADLO COC(=O)c1coc(C[N@H+]2CCC[C@@H](F)C2)c1 ZINC000565100198 388914580 /nfs/dbraw/zinc/91/45/80/388914580.db2.gz RAVLFCQFZVEBNG-SNVBAGLBSA-N 1 2 241.262 2.000 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@H]1CC12CCCC2 ZINC000565190028 388923499 /nfs/dbraw/zinc/92/34/99/388923499.db2.gz JTVLLTWJJYMQSL-PWSUYJOCSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@H]1CC12CCCC2 ZINC000565190028 388923495 /nfs/dbraw/zinc/92/34/95/388923495.db2.gz JTVLLTWJJYMQSL-PWSUYJOCSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@@H](NC(=O)CCCC(F)(F)F)c1[nH]cc[nH+]1 ZINC000565212022 388926133 /nfs/dbraw/zinc/92/61/33/388926133.db2.gz DSWXDNHQKZJZIP-SSDOTTSWSA-N 1 2 249.236 2.320 20 0 BEADLO CC[C@@H](CC(F)F)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000565215762 388926774 /nfs/dbraw/zinc/92/67/74/388926774.db2.gz NTVVZNIYOLWFST-SFYZADRCSA-N 1 2 245.273 2.268 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1CS[C@H](C)C1 ZINC000565225198 388928047 /nfs/dbraw/zinc/92/80/47/388928047.db2.gz BYXNOMRCXHLPQX-PSASIEDQSA-N 1 2 223.345 2.399 20 0 BEADLO COCc1ccc(C[N@H+]2CCC[C@@H](F)C2)o1 ZINC000565544051 388952178 /nfs/dbraw/zinc/95/21/78/388952178.db2.gz QFWJEIAPMGFLAS-SNVBAGLBSA-N 1 2 227.279 2.360 20 0 BEADLO COCc1ccc(C[N@@H+]2CCC[C@@H](F)C2)o1 ZINC000565544051 388952174 /nfs/dbraw/zinc/95/21/74/388952174.db2.gz QFWJEIAPMGFLAS-SNVBAGLBSA-N 1 2 227.279 2.360 20 0 BEADLO COc1cccc(C[NH2+]CC(C)(F)F)c1OC ZINC000565963875 388982442 /nfs/dbraw/zinc/98/24/42/388982442.db2.gz IASBCQFVTCFNOP-UHFFFAOYSA-N 1 2 245.269 2.449 20 0 BEADLO CO[C@H](C)CCNc1cc[nH+]c(C2CC2)n1 ZINC000264645459 388992720 /nfs/dbraw/zinc/99/27/20/388992720.db2.gz HEHSJPAYPXGJQI-SECBINFHSA-N 1 2 221.304 2.191 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1cc(C)ccc1C ZINC000267282179 388999233 /nfs/dbraw/zinc/99/92/33/388999233.db2.gz XXKXBVSMLDWVBA-UHFFFAOYSA-N 1 2 243.310 2.265 20 0 BEADLO CC(C)[C@@H](O)C1(CNc2cccc[nH+]2)CC1 ZINC000271807748 389023434 /nfs/dbraw/zinc/02/34/34/389023434.db2.gz LQKPGXCJTAIETC-GFCCVEGCSA-N 1 2 220.316 2.291 20 0 BEADLO CO[C@H]1CCC[C@H]1Sc1nc(N)cc(C)[nH+]1 ZINC000273074398 389036501 /nfs/dbraw/zinc/03/65/01/389036501.db2.gz FNIHQUJGLASMME-DTWKUNHWSA-N 1 2 239.344 2.027 20 0 BEADLO C[C@@H]1C[NH+](Cc2cocn2)C[C@@H](C)S1 ZINC000530516520 322822730 /nfs/dbraw/zinc/82/27/30/322822730.db2.gz RCVJCSCNVFWGLI-RKDXNWHRSA-N 1 2 212.318 2.000 20 0 BEADLO Cc1nc(N2CCC[C@H](C)[C@H]2C)cc[nH+]1 ZINC000266185470 132184279 /nfs/dbraw/zinc/18/42/79/132184279.db2.gz ANUIULGQHDYLFY-VHSXEESVSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1nc(N2C[C@H](C)C[C@@H](C)C2)cc[nH+]1 ZINC000266146429 132184670 /nfs/dbraw/zinc/18/46/70/132184670.db2.gz RZBLRUVKQRJTAD-NXEZZACHSA-N 1 2 205.305 2.267 20 0 BEADLO Cc1ccnc(N2CCCC[C@@H]2c2[nH]cc[nH+]2)n1 ZINC000268063929 132191029 /nfs/dbraw/zinc/19/10/29/132191029.db2.gz ZUHLEBFIXQCSFP-LLVKDONJSA-N 1 2 243.314 2.240 20 0 BEADLO COCC1=CCN(c2cc[nH+]c(C3CC3)n2)CC1 ZINC000274632882 132203705 /nfs/dbraw/zinc/20/37/05/132203705.db2.gz ODGYNEQRSKRADE-UHFFFAOYSA-N 1 2 245.326 2.137 20 0 BEADLO CO[C@@H]1CN(c2cc[nH+]c(C3CC3)n2)CC[C@H]1C ZINC000276013998 132205911 /nfs/dbraw/zinc/20/59/11/132205911.db2.gz MKMRQUQPGGXAFV-ZYHUDNBSSA-N 1 2 247.342 2.215 20 0 BEADLO Cc1nc(N2CCC([C@@H]3CCCO3)CC2)cc[nH+]1 ZINC000276099117 132206169 /nfs/dbraw/zinc/20/61/69/132206169.db2.gz WFNKCKDJWUJRLY-ZDUSSCGKSA-N 1 2 247.342 2.180 20 0 BEADLO C[C@@H]1CN(c2cccc[nH+]2)C[C@@H](C2CC2)O1 ZINC000280132571 132209881 /nfs/dbraw/zinc/20/98/81/132209881.db2.gz BFWVDCLDTOTPNB-PWSUYJOCSA-N 1 2 218.300 2.085 20 0 BEADLO CCc1nc(N2CCO[C@](C)(CC)C2)cc(C)[nH+]1 ZINC000286765159 132215440 /nfs/dbraw/zinc/21/54/40/132215440.db2.gz SROXSTQARSMHLZ-CQSZACIVSA-N 1 2 249.358 2.353 20 0 BEADLO CCc1nc(N2CCO[C@H]3CCC[C@@H]32)cc(C)[nH+]1 ZINC000288218676 132216215 /nfs/dbraw/zinc/21/62/15/132216215.db2.gz DNTCNSBJAVPHCQ-RYUDHWBXSA-N 1 2 247.342 2.105 20 0 BEADLO Cc1cc(N2CC[C@H](O)C[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000292396816 132218878 /nfs/dbraw/zinc/21/88/78/132218878.db2.gz UNZFNOKWLCKCPD-JQWIXIFHSA-N 1 2 247.342 2.012 20 0 BEADLO Cc1nc(N2CCC[C@@](C)(F)C2)cc[nH+]1 ZINC000294914997 132219795 /nfs/dbraw/zinc/21/97/95/132219795.db2.gz JHUXBAWDITUBIK-LLVKDONJSA-N 1 2 209.268 2.113 20 0 BEADLO Cc1cc2ccccc2[nH+]c1N1CCOCC1 ZINC000301557621 132224204 /nfs/dbraw/zinc/22/42/04/132224204.db2.gz JDLFZBGMVDRCHZ-UHFFFAOYSA-N 1 2 228.295 2.380 20 0 BEADLO Cc1nc(N2CCOC(C)(C)C2)c(C)c(C)[nH+]1 ZINC000301431396 132253501 /nfs/dbraw/zinc/25/35/01/132253501.db2.gz GUQFISIUYAABGT-UHFFFAOYSA-N 1 2 235.331 2.017 20 0 BEADLO Cc1cc(N2CCC[C@@H](C)[C@H]2C)nc[nH+]1 ZINC000301437855 132253744 /nfs/dbraw/zinc/25/37/44/132253744.db2.gz SMUUHYRALKGFPN-MWLCHTKSSA-N 1 2 205.305 2.410 20 0 BEADLO CCC[C@@H]1CN(c2nc(C)[nH+]c(C)c2C)CCO1 ZINC000301826559 132258253 /nfs/dbraw/zinc/25/82/53/132258253.db2.gz FFEBIFBBXVXCDQ-CYBMUJFWSA-N 1 2 249.358 2.407 20 0 BEADLO CC1(C)CN(c2cc[nH+]c3ccncc32)CCO1 ZINC000362839323 132281724 /nfs/dbraw/zinc/28/17/24/132281724.db2.gz QDCPNYHMOHLBAI-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO OCCCC1CCN(c2cccc[nH+]2)CC1 ZINC000272902663 132305916 /nfs/dbraw/zinc/30/59/16/132305916.db2.gz MHYLDUSRORXGNE-UHFFFAOYSA-N 1 2 220.316 2.071 20 0 BEADLO Cn1c[nH+]cc1CN1CCCc2ccccc21 ZINC000000024966 132312399 /nfs/dbraw/zinc/31/23/99/132312399.db2.gz QKBQWOFDHWQUDH-UHFFFAOYSA-N 1 2 227.311 2.373 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)C2CCCC2)c2[nH+]ccn21 ZINC000334744480 133746408 /nfs/dbraw/zinc/74/64/08/133746408.db2.gz SGNUOYPAARLOSM-GXSJLCMTSA-N 1 2 233.315 2.195 20 0 BEADLO Cc1ncsc1CN(C)c1cc(C)[nH+]cn1 ZINC000347118399 133804595 /nfs/dbraw/zinc/80/45/95/133804595.db2.gz AWFKGRMCPGTANA-UHFFFAOYSA-N 1 2 234.328 2.186 20 0 BEADLO CO[C@@H]1CC[C@H](Nc2[nH+]c(C)nc3[nH]ccc32)C1 ZINC000350683743 133957213 /nfs/dbraw/zinc/95/72/13/133957213.db2.gz HHKHEITVCMHWFH-VHSXEESVSA-N 1 2 246.314 2.246 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nc(C(C)(C)C)no2)[C@@H]1C ZINC000335931177 134010708 /nfs/dbraw/zinc/01/07/08/134010708.db2.gz NCPXEICCFHFELP-RKDXNWHRSA-N 1 2 223.320 2.207 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nc(C(C)(C)C)no2)[C@@H]1C ZINC000335931177 134010709 /nfs/dbraw/zinc/01/07/09/134010709.db2.gz NCPXEICCFHFELP-RKDXNWHRSA-N 1 2 223.320 2.207 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1nc(C(C)(C)C)no1 ZINC000335931175 134010773 /nfs/dbraw/zinc/01/07/73/134010773.db2.gz NCPXEICCFHFELP-DTWKUNHWSA-N 1 2 223.320 2.207 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1nc(C(C)(C)C)no1 ZINC000335931175 134010774 /nfs/dbraw/zinc/01/07/74/134010774.db2.gz NCPXEICCFHFELP-DTWKUNHWSA-N 1 2 223.320 2.207 20 0 BEADLO Cc1nc(N2CC(C3CCC3)C2)cc[nH+]1 ZINC000335954003 134022409 /nfs/dbraw/zinc/02/24/09/134022409.db2.gz VVWQMHVHTDRHRB-UHFFFAOYSA-N 1 2 203.289 2.021 20 0 BEADLO Cc1cnc([C@H](C)[NH2+]Cc2cnc(C)nc2)s1 ZINC000351987571 134025887 /nfs/dbraw/zinc/02/58/87/134025887.db2.gz WSLCXKYRCWZYJU-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO C[C@@H](c1nncn1C)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000335961981 134026802 /nfs/dbraw/zinc/02/68/02/134026802.db2.gz RSNDNOHNOFYMJJ-QWRGUYRKSA-N 1 2 242.326 2.453 20 0 BEADLO C[C@@H](c1nncn1C)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000335961981 134026803 /nfs/dbraw/zinc/02/68/03/134026803.db2.gz RSNDNOHNOFYMJJ-QWRGUYRKSA-N 1 2 242.326 2.453 20 0 BEADLO C[C@@H](c1nncn1C)[N@@H+]1Cc2ccccc2[C@H]1C ZINC000335961980 134026960 /nfs/dbraw/zinc/02/69/60/134026960.db2.gz RSNDNOHNOFYMJJ-MNOVXSKESA-N 1 2 242.326 2.453 20 0 BEADLO C[C@@H](c1nncn1C)[N@H+]1Cc2ccccc2[C@H]1C ZINC000335961980 134026961 /nfs/dbraw/zinc/02/69/61/134026961.db2.gz RSNDNOHNOFYMJJ-MNOVXSKESA-N 1 2 242.326 2.453 20 0 BEADLO Cc1cc(C(=O)C[N@H+]2C[C@@H](C)[C@H]2C)c(C)[nH]1 ZINC000335980137 134037379 /nfs/dbraw/zinc/03/73/79/134037379.db2.gz VSABTIZKBXWHII-LDYMZIIASA-N 1 2 220.316 2.154 20 0 BEADLO Cc1cc(C(=O)C[N@@H+]2C[C@@H](C)[C@H]2C)c(C)[nH]1 ZINC000335980137 134037380 /nfs/dbraw/zinc/03/73/80/134037380.db2.gz VSABTIZKBXWHII-LDYMZIIASA-N 1 2 220.316 2.154 20 0 BEADLO C[C@@H]1c2ccccc2C[N@H+]1CC(=O)N1CCCC1 ZINC000335989620 134039769 /nfs/dbraw/zinc/03/97/69/134039769.db2.gz JDSZBTCGHNGXAM-GFCCVEGCSA-N 1 2 244.338 2.186 20 0 BEADLO C[C@@H]1c2ccccc2C[N@@H+]1CC(=O)N1CCCC1 ZINC000335989620 134039770 /nfs/dbraw/zinc/03/97/70/134039770.db2.gz JDSZBTCGHNGXAM-GFCCVEGCSA-N 1 2 244.338 2.186 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1nnc(C2CCC2)n1C ZINC000336056035 134066320 /nfs/dbraw/zinc/06/63/20/134066320.db2.gz RBRXMZGTLCZMBA-UWVGGRQHSA-N 1 2 234.347 2.065 20 0 BEADLO CCOC[C@H]([NH2+][C@@H](C)c1noc(C)n1)C(C)C ZINC000352114713 134069828 /nfs/dbraw/zinc/06/98/28/134069828.db2.gz CCPPLMMJZSJNFB-ONGXEEELSA-N 1 2 241.335 2.090 20 0 BEADLO Fc1cccc(CN2CCn3cc[nH+]c3C2)c1F ZINC000336117245 134089076 /nfs/dbraw/zinc/08/90/76/134089076.db2.gz SKUPOMPIMAORRI-UHFFFAOYSA-N 1 2 249.264 2.177 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CC2(C1)CCCC2 ZINC000336121224 134091633 /nfs/dbraw/zinc/09/16/33/134091633.db2.gz NDXZSMOFNADZRU-UHFFFAOYSA-N 1 2 245.326 2.220 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CC[C@@H]2CCC[C@@H]21 ZINC000336121697 134091790 /nfs/dbraw/zinc/09/17/90/134091790.db2.gz QTOWAMUAQKDMJT-AAEUAGOBSA-N 1 2 245.326 2.218 20 0 BEADLO CC1=C[C@@H](C)C[N@@H+](Cc2nnc(C(C)C)[nH]2)C1 ZINC000336124910 134092373 /nfs/dbraw/zinc/09/23/73/134092373.db2.gz JXZKVFSRRMCNAP-SNVBAGLBSA-N 1 2 234.347 2.326 20 0 BEADLO CC1=C[C@@H](C)C[N@H+](Cc2nnc(C(C)C)[nH]2)C1 ZINC000336124910 134092374 /nfs/dbraw/zinc/09/23/74/134092374.db2.gz JXZKVFSRRMCNAP-SNVBAGLBSA-N 1 2 234.347 2.326 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@H]1CC[C@H](C)C1 ZINC000336183917 134120885 /nfs/dbraw/zinc/12/08/85/134120885.db2.gz GDLUTQHQBCLYQS-GXSJLCMTSA-N 1 2 233.315 2.122 20 0 BEADLO COc1cc(F)cc(C[N@@H+]2CCOC[C@H]2C)c1 ZINC000336213450 134135625 /nfs/dbraw/zinc/13/56/25/134135625.db2.gz YIOHJXOHQTVTSD-SNVBAGLBSA-N 1 2 239.290 2.055 20 0 BEADLO COc1cc(F)cc(C[N@H+]2CCOC[C@H]2C)c1 ZINC000336213450 134135626 /nfs/dbraw/zinc/13/56/26/134135626.db2.gz YIOHJXOHQTVTSD-SNVBAGLBSA-N 1 2 239.290 2.055 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@@](C)(F)C2)cn1 ZINC000336215276 134136051 /nfs/dbraw/zinc/13/60/51/134136051.db2.gz GDAPTKGOZZCGCE-GFCCVEGCSA-N 1 2 223.295 2.109 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@@](C)(F)C2)cn1 ZINC000336215276 134136052 /nfs/dbraw/zinc/13/60/52/134136052.db2.gz GDAPTKGOZZCGCE-GFCCVEGCSA-N 1 2 223.295 2.109 20 0 BEADLO CCCNC(=O)c1ccc2[nH+]c(C)n(C)c2c1 ZINC000336217298 134137356 /nfs/dbraw/zinc/13/73/56/134137356.db2.gz CJEGGSXZUWBCOS-UHFFFAOYSA-N 1 2 231.299 2.022 20 0 BEADLO CC[C@@H](CO)Nc1ccc2cc(OC)ccc2[nH+]1 ZINC000172971891 134271485 /nfs/dbraw/zinc/27/14/85/134271485.db2.gz SOJLOIXLKMJUOS-NSHDSACASA-N 1 2 246.310 2.426 20 0 BEADLO CC1(C)CCC(C(=O)NCCc2[nH]cc[nH+]2)CC1 ZINC000178338404 134308749 /nfs/dbraw/zinc/30/87/49/134308749.db2.gz XMEQVJZQWUQFLX-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H]1CCC[C@@H](C[N@H+](C)Cc2nnc[nH]2)C1 ZINC000179359584 134316615 /nfs/dbraw/zinc/31/66/15/134316615.db2.gz JOPSJYNUIQJZES-WDEREUQCSA-N 1 2 222.336 2.063 20 0 BEADLO C[C@H]1CCC[C@@H](C[N@@H+](C)Cc2nnc[nH]2)C1 ZINC000179359584 134316616 /nfs/dbraw/zinc/31/66/16/134316616.db2.gz JOPSJYNUIQJZES-WDEREUQCSA-N 1 2 222.336 2.063 20 0 BEADLO COC1CC(Nc2ccc(C)[nH+]c2C)C1 ZINC000221244459 134322589 /nfs/dbraw/zinc/32/25/89/134322589.db2.gz NRLJHIXEMDFWRZ-UHFFFAOYSA-N 1 2 206.289 2.288 20 0 BEADLO Cc1cccc(OCC[N@@H+](C)Cc2cnc[nH]2)c1 ZINC000179771999 134323309 /nfs/dbraw/zinc/32/33/09/134323309.db2.gz MNOXEYVRCCREPX-UHFFFAOYSA-N 1 2 245.326 2.229 20 0 BEADLO Cc1cccc(OCC[N@H+](C)Cc2cnc[nH]2)c1 ZINC000179771999 134323310 /nfs/dbraw/zinc/32/33/10/134323310.db2.gz MNOXEYVRCCREPX-UHFFFAOYSA-N 1 2 245.326 2.229 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1cccc(O)c1 ZINC000182265599 134343695 /nfs/dbraw/zinc/34/36/95/134343695.db2.gz WJHYXQBACOWUPM-UHFFFAOYSA-N 1 2 244.250 2.048 20 0 BEADLO CCCC[N@H+](C)Cc1ncnn1CC(C)C ZINC000182594161 134345794 /nfs/dbraw/zinc/34/57/94/134345794.db2.gz CYVXMWLVUBSNFN-UHFFFAOYSA-N 1 2 224.352 2.166 20 0 BEADLO CCCC[N@@H+](C)Cc1ncnn1CC(C)C ZINC000182594161 134345795 /nfs/dbraw/zinc/34/57/95/134345795.db2.gz CYVXMWLVUBSNFN-UHFFFAOYSA-N 1 2 224.352 2.166 20 0 BEADLO C[C@H]1CC(C(=O)NCCn2cc[nH+]c2)C[C@@H](C)C1 ZINC000182532675 134345932 /nfs/dbraw/zinc/34/59/32/134345932.db2.gz XDRARPFMHQIBQN-FUNVUKJBSA-N 1 2 249.358 2.072 20 0 BEADLO O=C(OCC1CC1)N1CCC(n2cc[nH+]c2)CC1 ZINC000184412979 134360817 /nfs/dbraw/zinc/36/08/17/134360817.db2.gz KBBVTMSQEDCLNZ-UHFFFAOYSA-N 1 2 249.314 2.067 20 0 BEADLO Cc1cc(C[N@H+](C)C[C@H]2CCC(C)(C)O2)no1 ZINC000184650727 134367281 /nfs/dbraw/zinc/36/72/81/134367281.db2.gz BWYGROCRXXNJQT-GFCCVEGCSA-N 1 2 238.331 2.372 20 0 BEADLO Cc1cc(C[N@@H+](C)C[C@H]2CCC(C)(C)O2)no1 ZINC000184650727 134367282 /nfs/dbraw/zinc/36/72/82/134367282.db2.gz BWYGROCRXXNJQT-GFCCVEGCSA-N 1 2 238.331 2.372 20 0 BEADLO CSC1(C[NH2+][C@H](C)C(=O)OC(C)(C)C)CC1 ZINC000227936054 134399373 /nfs/dbraw/zinc/39/93/73/134399373.db2.gz HKZYLZPLPNRLNB-SECBINFHSA-N 1 2 245.388 2.202 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1cnccn1)c1ccccn1 ZINC000070477507 134919348 /nfs/dbraw/zinc/91/93/48/134919348.db2.gz YPWDTFOYACRBRN-QWRGUYRKSA-N 1 2 228.299 2.283 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccnn1C)c1nccs1 ZINC000070717131 135010879 /nfs/dbraw/zinc/01/08/79/135010879.db2.gz DRJDHWZWHDVILC-SNVBAGLBSA-N 1 2 236.344 2.118 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H](C)c2cccs2)c[nH+]1 ZINC000264896690 135140294 /nfs/dbraw/zinc/14/02/94/135140294.db2.gz WLEWBOFMKRPMLT-ZETCQYMHSA-N 1 2 235.312 2.271 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CC[C@H](C)C[C@H]2C)c[nH+]1 ZINC000265086698 135142149 /nfs/dbraw/zinc/14/21/49/135142149.db2.gz RYMUVXGOFNHNAK-IQJOONFLSA-N 1 2 235.331 2.273 20 0 BEADLO Cc1cccc2[nH+]c(CSc3nc[nH]n3)cn21 ZINC000078712051 135143790 /nfs/dbraw/zinc/14/37/90/135143790.db2.gz DOOGDWLTPODGEL-UHFFFAOYSA-N 1 2 245.311 2.053 20 0 BEADLO Cc1cc(NCC[C@@H](C)O)nc(C(C)C)[nH+]1 ZINC000078771800 135150135 /nfs/dbraw/zinc/15/01/35/135150135.db2.gz UBFFNVOEZRXUKK-SNVBAGLBSA-N 1 2 223.320 2.091 20 0 BEADLO Cc1cc(NC[C@@]2(C)CCCS2)nc[nH+]1 ZINC000087620149 135159732 /nfs/dbraw/zinc/15/97/32/135159732.db2.gz OKWFYVWXQMFYEO-LLVKDONJSA-N 1 2 223.345 2.483 20 0 BEADLO F[C@@H]1C[NH2+][C@@H](c2nc(C3CCCC3)no2)C1 ZINC000261783616 135252520 /nfs/dbraw/zinc/25/25/20/135252520.db2.gz NZDTWGJVZPFTEM-DTWKUNHWSA-N 1 2 225.267 2.100 20 0 BEADLO Cc1c[nH+]c(CN[C@@H](C2CC2)C(F)(F)F)n1C ZINC000342322593 135264053 /nfs/dbraw/zinc/26/40/53/135264053.db2.gz MZKXBMQMIAWZRJ-JTQLQIEISA-N 1 2 247.264 2.159 20 0 BEADLO Cc1cc(C(=O)Nc2ccc(C)[nH+]c2C)cnn1 ZINC000342402825 135271651 /nfs/dbraw/zinc/27/16/51/135271651.db2.gz QVQDTEDIOYIVGX-UHFFFAOYSA-N 1 2 242.282 2.049 20 0 BEADLO CCC(CC)[C@@H](C)C(=O)Nc1cc[nH+]cc1O ZINC000342463379 135277211 /nfs/dbraw/zinc/27/72/11/135277211.db2.gz OZCKPDXMKSDUGU-SECBINFHSA-N 1 2 236.315 2.220 20 0 BEADLO C[C@@H]1CC[C@@H](C)N1c1cc(N2CCCC2)[nH+]cn1 ZINC000342556543 135288065 /nfs/dbraw/zinc/28/80/65/135288065.db2.gz XSQDVSFMGFHZRE-VXGBXAGGSA-N 1 2 246.358 2.454 20 0 BEADLO C[C@@H]1CC[C@@H](C)N1c1cc(N2CCCC2)nc[nH+]1 ZINC000342556543 135288067 /nfs/dbraw/zinc/28/80/67/135288067.db2.gz XSQDVSFMGFHZRE-VXGBXAGGSA-N 1 2 246.358 2.454 20 0 BEADLO CC[C@@H](C)NC(=O)[C@H](C)[N@H+](C)Cc1ccoc1 ZINC000342635429 135298188 /nfs/dbraw/zinc/29/81/88/135298188.db2.gz KMUKYNQBNLUFRY-MNOVXSKESA-N 1 2 238.331 2.015 20 0 BEADLO CC[C@@H](C)NC(=O)[C@H](C)[N@@H+](C)Cc1ccoc1 ZINC000342635429 135298190 /nfs/dbraw/zinc/29/81/90/135298190.db2.gz KMUKYNQBNLUFRY-MNOVXSKESA-N 1 2 238.331 2.015 20 0 BEADLO CC[C@H](C)NC(=O)[C@@H](C)[N@H+](C)Cc1ccoc1 ZINC000342635434 135298352 /nfs/dbraw/zinc/29/83/52/135298352.db2.gz KMUKYNQBNLUFRY-WDEREUQCSA-N 1 2 238.331 2.015 20 0 BEADLO CC[C@H](C)NC(=O)[C@@H](C)[N@@H+](C)Cc1ccoc1 ZINC000342635434 135298354 /nfs/dbraw/zinc/29/83/54/135298354.db2.gz KMUKYNQBNLUFRY-WDEREUQCSA-N 1 2 238.331 2.015 20 0 BEADLO CO[C@@H]1[C@@H](C)[C@H](Nc2cc(C)[nH+]cn2)C1(C)C ZINC000342779639 135317104 /nfs/dbraw/zinc/31/71/04/135317104.db2.gz FAKDVYRMHSMNIR-ZMLRMANQSA-N 1 2 235.331 2.256 20 0 BEADLO Cc1c[nH+]c(CN(C)[C@@H](C)c2ccccn2)n1C ZINC000342795663 135319669 /nfs/dbraw/zinc/31/96/69/135319669.db2.gz HCIPAYJYJQKEEX-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1c[nH+]c(CN(C)[C@@H](C)c2ccncc2)n1C ZINC000342797523 135320447 /nfs/dbraw/zinc/32/04/47/135320447.db2.gz PCYSSUICXWVELM-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO OC[C@@H]1C[C@H](F)C[N@@H+]1Cc1cc(Cl)cs1 ZINC000334222707 135327988 /nfs/dbraw/zinc/32/79/88/135327988.db2.gz VWSQPXFELCBYCY-IUCAKERBSA-N 1 2 249.738 2.306 20 0 BEADLO OC[C@@H]1C[C@H](F)C[N@H+]1Cc1cc(Cl)cs1 ZINC000334222707 135327990 /nfs/dbraw/zinc/32/79/90/135327990.db2.gz VWSQPXFELCBYCY-IUCAKERBSA-N 1 2 249.738 2.306 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+]1Cc2ccccc2[C@H]1C ZINC000334278281 135333279 /nfs/dbraw/zinc/33/32/79/135333279.db2.gz DVSSENGBJWNDQB-NXEZZACHSA-N 1 2 219.284 2.125 20 0 BEADLO COC(=O)[C@@H](C)[N@H+]1Cc2ccccc2[C@H]1C ZINC000334278281 135333281 /nfs/dbraw/zinc/33/32/81/135333281.db2.gz DVSSENGBJWNDQB-NXEZZACHSA-N 1 2 219.284 2.125 20 0 BEADLO Cc1cc[nH+]c(NCCc2cnccn2)c1Cl ZINC000342939334 135336681 /nfs/dbraw/zinc/33/66/81/135336681.db2.gz PIYJMWLMIJGZFQ-UHFFFAOYSA-N 1 2 248.717 2.488 20 0 BEADLO C[C@@H](c1nncn1C)[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000334320708 135352479 /nfs/dbraw/zinc/35/24/79/135352479.db2.gz WAAVAMFWEDMDDA-WCQYABFASA-N 1 2 242.326 2.323 20 0 BEADLO C[C@@H](c1nncn1C)[N@H+]1CC[C@@H]1c1ccccc1 ZINC000334320708 135352480 /nfs/dbraw/zinc/35/24/80/135352480.db2.gz WAAVAMFWEDMDDA-WCQYABFASA-N 1 2 242.326 2.323 20 0 BEADLO C[C@@H]1CCN(c2ccccn2)C[C@H]1n1cc[nH+]c1 ZINC000268230014 135363817 /nfs/dbraw/zinc/36/38/17/135363817.db2.gz FNCKMIASIUHESB-CHWSQXEVSA-N 1 2 242.326 2.366 20 0 BEADLO Cc1cccc(NC(=O)NCc2[nH]cc[nH+]2)c1F ZINC000334350691 135368865 /nfs/dbraw/zinc/36/88/65/135368865.db2.gz FNUCLPVTDDAWFT-UHFFFAOYSA-N 1 2 248.261 2.179 20 0 BEADLO Cn1cccc1C[N@H+]1CCC[C@H]1[C@@H]1CCCO1 ZINC000334357711 135370405 /nfs/dbraw/zinc/37/04/05/135370405.db2.gz QRDRJNROPHUUFY-KBPBESRZSA-N 1 2 234.343 2.169 20 0 BEADLO CC(C)n1cccc1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000080526535 135378794 /nfs/dbraw/zinc/37/87/94/135378794.db2.gz NRGUNDVECWIJCM-UHFFFAOYSA-N 1 2 246.314 2.064 20 0 BEADLO c1snnc1C[N@@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC000334385312 135382326 /nfs/dbraw/zinc/38/23/26/135382326.db2.gz MMDQVXLTNURJBI-NSHDSACASA-N 1 2 235.356 2.303 20 0 BEADLO c1snnc1C[N@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC000334385312 135382328 /nfs/dbraw/zinc/38/23/28/135382328.db2.gz MMDQVXLTNURJBI-NSHDSACASA-N 1 2 235.356 2.303 20 0 BEADLO Cc1cc(N2CC(F)C2)nc(C(C)C)[nH+]1 ZINC000334400592 135389863 /nfs/dbraw/zinc/38/98/63/135389863.db2.gz FCKIEWAWAQGAKR-UHFFFAOYSA-N 1 2 209.268 2.067 20 0 BEADLO C[C@H](C(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1)C(C)(C)C ZINC000334417399 135398740 /nfs/dbraw/zinc/39/87/40/135398740.db2.gz OMIIPHLNSGDDMW-NXEZZACHSA-N 1 2 249.358 2.065 20 0 BEADLO C[C@H](C(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1)C(C)(C)C ZINC000334417399 135398741 /nfs/dbraw/zinc/39/87/41/135398741.db2.gz OMIIPHLNSGDDMW-NXEZZACHSA-N 1 2 249.358 2.065 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CC2(C1)CCCC2 ZINC000334511815 135549523 /nfs/dbraw/zinc/54/95/23/135549523.db2.gz BLARYWJDXWLNTD-UHFFFAOYSA-N 1 2 205.305 2.094 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+]1CCS[C@H](C)CC1 ZINC000334620364 135793930 /nfs/dbraw/zinc/79/39/30/135793930.db2.gz QKTOFYPJKWJVMH-BDAKNGLRSA-N 1 2 243.401 2.427 20 0 BEADLO C[C@@H](c1csnn1)[N@H+]1CCS[C@H](C)CC1 ZINC000334620364 135793931 /nfs/dbraw/zinc/79/39/31/135793931.db2.gz QKTOFYPJKWJVMH-BDAKNGLRSA-N 1 2 243.401 2.427 20 0 BEADLO Cc1ccc(CSc2nncn2C)c(C)[nH+]1 ZINC000334624060 135795587 /nfs/dbraw/zinc/79/55/87/135795587.db2.gz ONBGMWGXJIGYHR-UHFFFAOYSA-N 1 2 234.328 2.119 20 0 BEADLO C[C@H]1CC[C@H](C(=O)N(C)CCCn2cc[nH+]c2)C1 ZINC000345287078 135894613 /nfs/dbraw/zinc/89/46/13/135894613.db2.gz OFUOUGJRJBHROD-STQMWFEESA-N 1 2 249.358 2.168 20 0 BEADLO FC(F)n1ccc(C[NH+]2CCCCC2)n1 ZINC000347708737 136002517 /nfs/dbraw/zinc/00/25/17/136002517.db2.gz SGBKHRKWTQMMRT-UHFFFAOYSA-N 1 2 215.247 2.264 20 0 BEADLO C[C@@H]1CCC[C@H](C)CN1C(=O)CCc1[nH]cc[nH+]1 ZINC000335316065 136024657 /nfs/dbraw/zinc/02/46/57/136024657.db2.gz ORFSIJFHJDPIFM-NWDGAFQWSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)CCn2cc[nH+]c2)C[C@H]1C ZINC000348083387 136035064 /nfs/dbraw/zinc/03/50/64/136035064.db2.gz WYCSRORCQNWGPL-UPJWGTAASA-N 1 2 249.358 2.214 20 0 BEADLO C[C@H](c1cnccn1)[N@@H+]1C[C@@H](C)O[C@@H](C2CC2)C1 ZINC000348206466 136054046 /nfs/dbraw/zinc/05/40/46/136054046.db2.gz PGJUOJNNQQJIEG-JTNHKYCSSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H](c1cnccn1)[N@H+]1C[C@@H](C)O[C@@H](C2CC2)C1 ZINC000348206466 136054047 /nfs/dbraw/zinc/05/40/47/136054047.db2.gz PGJUOJNNQQJIEG-JTNHKYCSSA-N 1 2 247.342 2.037 20 0 BEADLO Cc1csc(C[N@@H+]2CCO[C@H](C(C)C)C2)n1 ZINC000335335101 136055434 /nfs/dbraw/zinc/05/54/34/136055434.db2.gz DNRCIEXJODMKLA-NSHDSACASA-N 1 2 240.372 2.308 20 0 BEADLO Cc1csc(C[N@H+]2CCO[C@H](C(C)C)C2)n1 ZINC000335335101 136055435 /nfs/dbraw/zinc/05/54/35/136055435.db2.gz DNRCIEXJODMKLA-NSHDSACASA-N 1 2 240.372 2.308 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CCC=C(F)C2)[nH+]1 ZINC000335342128 136064119 /nfs/dbraw/zinc/06/41/19/136064119.db2.gz FLYZLKFPTAGMQF-UHFFFAOYSA-N 1 2 232.262 2.330 20 0 BEADLO CO[C@H]1CCN(c2cc(C)[nH+]c(C(C)C)n2)C1 ZINC000348362390 136072736 /nfs/dbraw/zinc/07/27/36/136072736.db2.gz IAUDWKHEFZEZBS-NSHDSACASA-N 1 2 235.331 2.134 20 0 BEADLO CC1=C(C)C[C@H](C(=O)NCc2[nH]cc[nH+]2)CC1 ZINC000335361063 136080783 /nfs/dbraw/zinc/08/07/83/136080783.db2.gz VVGVWSJUIRRTCP-LLVKDONJSA-N 1 2 233.315 2.162 20 0 BEADLO Cc1cc(N[C@H]2CCC[C@@H](F)C2)nc[nH+]1 ZINC000335382118 136087740 /nfs/dbraw/zinc/08/77/40/136087740.db2.gz YHPDVXZPNNRZOU-ZJUUUORDSA-N 1 2 209.268 2.478 20 0 BEADLO Cc1nc(C[NH+]2CC(C)(C(N)=O)C2)c(C)s1 ZINC000335393042 136091477 /nfs/dbraw/zinc/09/14/77/136091477.db2.gz ARJZCWWIPZXDBZ-UHFFFAOYSA-N 1 2 239.344 2.117 20 0 BEADLO COc1cc(F)cc(C[N@@H+]2CC[C@@H](F)C2)c1 ZINC000335397902 136093003 /nfs/dbraw/zinc/09/30/03/136093003.db2.gz GJXIBCWGRJSAQR-SNVBAGLBSA-N 1 2 227.254 2.378 20 0 BEADLO COc1cc(F)cc(C[N@H+]2CC[C@@H](F)C2)c1 ZINC000335397902 136093004 /nfs/dbraw/zinc/09/30/04/136093004.db2.gz GJXIBCWGRJSAQR-SNVBAGLBSA-N 1 2 227.254 2.378 20 0 BEADLO Cn1c2cc(F)ccc2[nH+]c1N1CC[C@H](F)C1 ZINC000335398624 136093512 /nfs/dbraw/zinc/09/35/12/136093512.db2.gz BSIPBNQECLMLQM-VIFPVBQESA-N 1 2 237.253 2.261 20 0 BEADLO Cc1nc(N2CC(CC(F)F)C2)c(C)c(C)[nH+]1 ZINC000335588697 136102850 /nfs/dbraw/zinc/10/28/50/136102850.db2.gz DKEPUTUKMVFPNA-UHFFFAOYSA-N 1 2 241.285 2.493 20 0 BEADLO Cc1cc(C)c(NC(=O)N[C@H](C)CF)c(C)[nH+]1 ZINC000335589882 136103176 /nfs/dbraw/zinc/10/31/76/136103176.db2.gz MPEUXFVSZMORMG-SECBINFHSA-N 1 2 239.294 2.486 20 0 BEADLO OC1CCN(c2[nH+]ccc3cc(F)ccc32)CC1 ZINC000335591744 136103386 /nfs/dbraw/zinc/10/33/86/136103386.db2.gz YPHKLAKKNZUFKD-UHFFFAOYSA-N 1 2 246.285 2.335 20 0 BEADLO Fc1ccc2c(cc[nH+]c2N2CCOCC2)c1 ZINC000335596292 136105204 /nfs/dbraw/zinc/10/52/04/136105204.db2.gz IZAXFOMEXUUMJO-UHFFFAOYSA-N 1 2 232.258 2.211 20 0 BEADLO Cc1ccc(Cn2cnc(C3CC3)n2)c(C)[nH+]1 ZINC000335597547 136105603 /nfs/dbraw/zinc/10/56/03/136105603.db2.gz SFJWRKMGPAFZJE-UHFFFAOYSA-N 1 2 228.299 2.216 20 0 BEADLO Cc1cc(C)c(CNC(=O)N2C[C@@H](C)[C@H]2C)c[nH+]1 ZINC000335579463 136111998 /nfs/dbraw/zinc/11/19/98/136111998.db2.gz KBMBAWYWYDKHRX-ZYHUDNBSSA-N 1 2 247.342 2.248 20 0 BEADLO CCCC1CCN(c2cc(N)nc[nH+]2)CC1 ZINC000087826640 1172741540 /nfs/dbraw/zinc/74/15/40/1172741540.db2.gz YBMTVGCVAQTXSP-UHFFFAOYSA-N 1 2 220.320 2.075 20 0 BEADLO CC(C)=CC[N@@H+]1CCNC(=O)[C@H]1c1ccccc1 ZINC000156240947 397756363 /nfs/dbraw/zinc/75/63/63/397756363.db2.gz SEJIOUBIUSGQGJ-CQSZACIVSA-N 1 2 244.338 2.126 20 0 BEADLO CC(C)=CC[N@H+]1CCNC(=O)[C@H]1c1ccccc1 ZINC000156240947 397756375 /nfs/dbraw/zinc/75/63/75/397756375.db2.gz SEJIOUBIUSGQGJ-CQSZACIVSA-N 1 2 244.338 2.126 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC1(C2CCC2)CC1 ZINC000650107293 397927127 /nfs/dbraw/zinc/92/71/27/397927127.db2.gz MXSVSCIROPVKSD-UHFFFAOYSA-N 1 2 245.326 2.266 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CCC12CCCC2 ZINC000650107422 397927733 /nfs/dbraw/zinc/92/77/33/397927733.db2.gz OPYCBYLQHCWTOK-UHFFFAOYSA-N 1 2 245.326 2.362 20 0 BEADLO COc1cccc2c1C[N@H+](Cc1ccon1)CC2 ZINC000650107920 397927770 /nfs/dbraw/zinc/92/77/70/397927770.db2.gz WZACAGSFKPDIKF-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1cccc2c1C[N@@H+](Cc1ccon1)CC2 ZINC000650107920 397927776 /nfs/dbraw/zinc/92/77/76/397927776.db2.gz WZACAGSFKPDIKF-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO CC[C@H](F)CN(C)Cc1cn2c([nH+]1)CCCC2 ZINC000440528485 397931475 /nfs/dbraw/zinc/93/14/75/397931475.db2.gz BXYPEAZJIAKMRZ-NSHDSACASA-N 1 2 239.338 2.399 20 0 BEADLO Cc1nnsc1C[N@H+](C)CCOC(C)(C)C ZINC000649552608 397943989 /nfs/dbraw/zinc/94/39/89/397943989.db2.gz OVNFGQGVGAEYMB-UHFFFAOYSA-N 1 2 243.376 2.093 20 0 BEADLO Cc1nnsc1C[N@@H+](C)CCOC(C)(C)C ZINC000649552608 397943993 /nfs/dbraw/zinc/94/39/93/397943993.db2.gz OVNFGQGVGAEYMB-UHFFFAOYSA-N 1 2 243.376 2.093 20 0 BEADLO CCC1(C(=O)N2CCC[C@@H](c3[nH]cc[nH+]3)C2)CC1 ZINC000267273483 397946155 /nfs/dbraw/zinc/94/61/55/397946155.db2.gz SKWUGOLIZPSWPR-LLVKDONJSA-N 1 2 247.342 2.306 20 0 BEADLO Cc1cncc(CC[N@H+](CC(F)F)C(C)C)n1 ZINC000649552314 397947166 /nfs/dbraw/zinc/94/71/66/397947166.db2.gz DUQUEBPPGMWHQX-UHFFFAOYSA-N 1 2 243.301 2.303 20 0 BEADLO Cc1cncc(CC[N@@H+](CC(F)F)C(C)C)n1 ZINC000649552314 397947168 /nfs/dbraw/zinc/94/71/68/397947168.db2.gz DUQUEBPPGMWHQX-UHFFFAOYSA-N 1 2 243.301 2.303 20 0 BEADLO CCO[C@@H]1CCC[C@H]1Nc1cc(CC)[nH+]cn1 ZINC000649555365 397947875 /nfs/dbraw/zinc/94/78/75/397947875.db2.gz VNFAGMYYPQGSJM-VXGBXAGGSA-N 1 2 235.331 2.409 20 0 BEADLO CCO/C=C/C(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000493528019 397955796 /nfs/dbraw/zinc/95/57/96/397955796.db2.gz PJNBRESRYHNZSA-RUYJGKKWSA-N 1 2 249.314 2.014 20 0 BEADLO CCO/C=C\C(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000493528021 397955905 /nfs/dbraw/zinc/95/59/05/397955905.db2.gz PJNBRESRYHNZSA-YAEJEKNGSA-N 1 2 249.314 2.014 20 0 BEADLO Cc1nc(NC[C@H]2CCC[C@@H](C)C2)nc(N)[nH+]1 ZINC000302631032 397957453 /nfs/dbraw/zinc/95/74/53/397957453.db2.gz QOAGAYHKKVIKAV-SCZZXKLOSA-N 1 2 235.335 2.000 20 0 BEADLO Cc1nc(N)nc(NC[C@H]2CCC[C@@H](C)C2)[nH+]1 ZINC000302631032 397957455 /nfs/dbraw/zinc/95/74/55/397957455.db2.gz QOAGAYHKKVIKAV-SCZZXKLOSA-N 1 2 235.335 2.000 20 0 BEADLO C[C@@H](CC(=O)N1CC(C)(C)C[C@H]1C)n1cc[nH+]c1 ZINC000650098567 397921095 /nfs/dbraw/zinc/92/10/95/397921095.db2.gz JIKDYAGSMGJHTA-NWDGAFQWSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1n[nH]cc1[C@@H](C)[NH2+]CC(C)(F)F ZINC000382205902 397921817 /nfs/dbraw/zinc/92/18/17/397921817.db2.gz GABCEKDZQDHDAJ-ZCFIWIBFSA-N 1 2 203.236 2.024 20 0 BEADLO CCCC[N@@H+]1CC(=O)NC12C[C@@H](C)C[C@H](C)C2 ZINC000439142894 397923423 /nfs/dbraw/zinc/92/34/23/397923423.db2.gz QONGPTRRBVMPST-RYUDHWBXSA-N 1 2 238.375 2.371 20 0 BEADLO CCCC[N@H+]1CC(=O)NC12C[C@@H](C)C[C@H](C)C2 ZINC000439142894 397923424 /nfs/dbraw/zinc/92/34/24/397923424.db2.gz QONGPTRRBVMPST-RYUDHWBXSA-N 1 2 238.375 2.371 20 0 BEADLO O[C@@H]1CCCC[C@@H]1C[N@H+](CC(F)F)C1CC1 ZINC000382218990 397924326 /nfs/dbraw/zinc/92/43/26/397924326.db2.gz MNYOFRTYIUDJAU-MWLCHTKSSA-N 1 2 233.302 2.267 20 0 BEADLO O[C@@H]1CCCC[C@@H]1C[N@@H+](CC(F)F)C1CC1 ZINC000382218990 397924337 /nfs/dbraw/zinc/92/43/37/397924337.db2.gz MNYOFRTYIUDJAU-MWLCHTKSSA-N 1 2 233.302 2.267 20 0 BEADLO CO[C@H]1CC[N@H+](Cc2cc(F)c(F)cc2F)C1 ZINC000271163771 397964642 /nfs/dbraw/zinc/96/46/42/397964642.db2.gz FIPKIMZWTTWTOY-VIFPVBQESA-N 1 2 245.244 2.325 20 0 BEADLO CO[C@H]1CC[N@@H+](Cc2cc(F)c(F)cc2F)C1 ZINC000271163771 397964643 /nfs/dbraw/zinc/96/46/43/397964643.db2.gz FIPKIMZWTTWTOY-VIFPVBQESA-N 1 2 245.244 2.325 20 0 BEADLO CCC[C@H]1CCC[C@@H]1c1nc(C[NH2+]C)no1 ZINC000414648106 398001270 /nfs/dbraw/zinc/00/12/70/398001270.db2.gz VECLUDGCDSAGTD-UWVGGRQHSA-N 1 2 223.320 2.473 20 0 BEADLO Cc1nnsc1C[N@@H+](C)Cc1ccc(C)cn1 ZINC000649621287 398003792 /nfs/dbraw/zinc/00/37/92/398003792.db2.gz UNQAWVWRLDJLIS-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO Cc1nnsc1C[N@H+](C)Cc1ccc(C)cn1 ZINC000649621287 398003797 /nfs/dbraw/zinc/00/37/97/398003797.db2.gz UNQAWVWRLDJLIS-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO CCn1nnc(C)c1CNc1cc(C)c[nH+]c1C ZINC000650242731 398004050 /nfs/dbraw/zinc/00/40/50/398004050.db2.gz WSQRAXYUPSQOPJ-UHFFFAOYSA-N 1 2 245.330 2.230 20 0 BEADLO CCc1cc[nH+]cc1NCc1cc(C)n(C)n1 ZINC000650243179 398005092 /nfs/dbraw/zinc/00/50/92/398005092.db2.gz NCUPQRDDQKEIRG-UHFFFAOYSA-N 1 2 230.315 2.298 20 0 BEADLO CCn1nccc1CNc1cc(COC)cc[nH+]1 ZINC000650243566 398006531 /nfs/dbraw/zinc/00/65/31/398006531.db2.gz FNKALUYQWVFBEE-UHFFFAOYSA-N 1 2 246.314 2.057 20 0 BEADLO COCc1cc[nH+]c(NCC(C)(C)COC)c1 ZINC000650243490 398006634 /nfs/dbraw/zinc/00/66/34/398006634.db2.gz AVALXFLQSWGCCL-UHFFFAOYSA-N 1 2 238.331 2.313 20 0 BEADLO COC1(C)C[NH+](Cc2cnc(C3CC3)s2)C1 ZINC000556787658 398047043 /nfs/dbraw/zinc/04/70/43/398047043.db2.gz CZGLKVKCPAQDGI-UHFFFAOYSA-N 1 2 238.356 2.241 20 0 BEADLO C[C@H]([NH2+]Cc1cccc(O)c1)C(F)F ZINC000383913321 398048791 /nfs/dbraw/zinc/04/87/91/398048791.db2.gz FWNFOERORZQQQT-ZETCQYMHSA-N 1 2 201.216 2.135 20 0 BEADLO Fc1ccc(NCc2c[nH+]c[nH]2)cc1F ZINC000054763245 398039280 /nfs/dbraw/zinc/03/92/80/398039280.db2.gz BKJHJTTZWPGNMI-UHFFFAOYSA-N 1 2 209.199 2.300 20 0 BEADLO Fc1ccc(NCc2c[nH]c[nH+]2)cc1F ZINC000054763245 398039284 /nfs/dbraw/zinc/03/92/84/398039284.db2.gz BKJHJTTZWPGNMI-UHFFFAOYSA-N 1 2 209.199 2.300 20 0 BEADLO COCC[C@H](C)[N@@H+]1CCCC(F)(F)C1 ZINC000649693798 398041460 /nfs/dbraw/zinc/04/14/60/398041460.db2.gz RHOHESQASCVAQJ-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO COCC[C@H](C)[N@H+]1CCCC(F)(F)C1 ZINC000649693798 398041461 /nfs/dbraw/zinc/04/14/61/398041461.db2.gz RHOHESQASCVAQJ-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1CCO[C@@H](C)C1 ZINC000271979896 397976449 /nfs/dbraw/zinc/97/64/49/397976449.db2.gz OKNHGVWTPMKADM-WDEREUQCSA-N 1 2 234.299 2.144 20 0 BEADLO CCCC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000281297760 398059825 /nfs/dbraw/zinc/05/98/25/398059825.db2.gz YKOUSXPEZAFEEK-UHFFFAOYSA-N 1 2 203.245 2.073 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1Cc1ccno1 ZINC000649718938 398061438 /nfs/dbraw/zinc/06/14/38/398061438.db2.gz JIQHBRQDVQUKQJ-MNOVXSKESA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@H+]1Cc1ccno1 ZINC000649718938 398061440 /nfs/dbraw/zinc/06/14/40/398061440.db2.gz JIQHBRQDVQUKQJ-MNOVXSKESA-N 1 2 224.304 2.064 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ncc(C)cn2)[C@@H](CC)CO1 ZINC000649719820 398062517 /nfs/dbraw/zinc/06/25/17/398062517.db2.gz XZQZQZOSBZIYJQ-QWHCGFSZSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ncc(C)cn2)[C@@H](CC)CO1 ZINC000649719820 398062518 /nfs/dbraw/zinc/06/25/18/398062518.db2.gz XZQZQZOSBZIYJQ-QWHCGFSZSA-N 1 2 249.358 2.174 20 0 BEADLO Nc1c(F)cccc1C[N@@H+]1CCC=C(F)C1 ZINC000384165972 398067854 /nfs/dbraw/zinc/06/78/54/398067854.db2.gz RYFJJNAPFAVRFZ-UHFFFAOYSA-N 1 2 224.254 2.467 20 0 BEADLO Nc1c(F)cccc1C[N@H+]1CCC=C(F)C1 ZINC000384165972 398067856 /nfs/dbraw/zinc/06/78/56/398067856.db2.gz RYFJJNAPFAVRFZ-UHFFFAOYSA-N 1 2 224.254 2.467 20 0 BEADLO C[C@H]1CC[N@H+](Cc2ccncc2F)C[C@@H]1F ZINC000648504852 398073727 /nfs/dbraw/zinc/07/37/27/398073727.db2.gz GDYUGJVXVLQKCK-CABZTGNLSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2ccncc2F)C[C@@H]1F ZINC000648504852 398073732 /nfs/dbraw/zinc/07/37/32/398073732.db2.gz GDYUGJVXVLQKCK-CABZTGNLSA-N 1 2 226.270 2.401 20 0 BEADLO CC(C)[C@@H]1CCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000283474162 398073827 /nfs/dbraw/zinc/07/38/27/398073827.db2.gz MPCNDNOLGPQPGM-FYJFLYSWSA-N 1 2 233.315 2.070 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ncc(C)s2)[C@H](C)CO1 ZINC000649735307 398077128 /nfs/dbraw/zinc/07/71/28/398077128.db2.gz JFDVWAGVRKDWKQ-KOLCDFICSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ncc(C)s2)[C@H](C)CO1 ZINC000649735307 398077130 /nfs/dbraw/zinc/07/71/30/398077130.db2.gz JFDVWAGVRKDWKQ-KOLCDFICSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC3(CCC3)C2)sn1 ZINC000638116480 398077257 /nfs/dbraw/zinc/07/72/57/398077257.db2.gz YTAHDJSNGVUPMO-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO Cc1cc(C[N@H+]2CCOC3(CCC3)C2)sn1 ZINC000638116480 398077259 /nfs/dbraw/zinc/07/72/59/398077259.db2.gz YTAHDJSNGVUPMO-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO CC(C)[C@@H](Nc1ncc(F)cn1)c1[nH]cc[nH+]1 ZINC000291205065 398090920 /nfs/dbraw/zinc/09/09/20/398090920.db2.gz UUYXICFBSOHMON-SECBINFHSA-N 1 2 235.266 2.148 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@@H+]1Cc1cc(C)on1 ZINC000649714813 398056655 /nfs/dbraw/zinc/05/66/55/398056655.db2.gz MXPOTLUAQKAXQV-GFCCVEGCSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@H+]1Cc1cc(C)on1 ZINC000649714813 398056659 /nfs/dbraw/zinc/05/66/59/398056659.db2.gz MXPOTLUAQKAXQV-GFCCVEGCSA-N 1 2 238.331 2.372 20 0 BEADLO Cc1cccc(C[NH2+]Cc2ncc[nH]2)c1F ZINC000384581833 398098329 /nfs/dbraw/zinc/09/83/29/398098329.db2.gz XICOBUFKNWUVGW-UHFFFAOYSA-N 1 2 219.263 2.147 20 0 BEADLO CC1(C)CCC(NCC(F)(F)C[NH3+])CC1 ZINC000414924488 398101081 /nfs/dbraw/zinc/10/10/81/398101081.db2.gz GNEMOMGANCLXCM-UHFFFAOYSA-N 1 2 220.307 2.139 20 0 BEADLO Cc1ccoc1C[N@@H+](C)Cc1c(C)cnn1C ZINC000292222740 398102830 /nfs/dbraw/zinc/10/28/30/398102830.db2.gz AIKYONMYUQRMEL-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO Cc1ccoc1C[N@H+](C)Cc1c(C)cnn1C ZINC000292222740 398102833 /nfs/dbraw/zinc/10/28/33/398102833.db2.gz AIKYONMYUQRMEL-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO CCn1cc[nH+]c1CN[C@@H](C)C(C)(F)F ZINC000389473896 398096923 /nfs/dbraw/zinc/09/69/23/398096923.db2.gz WDNUKXGRKHXAKK-QMMMGPOBSA-N 1 2 217.263 2.036 20 0 BEADLO CCc1cc(N[C@@H](C)CC(C)(C)O)nc[nH+]1 ZINC000384908234 398116101 /nfs/dbraw/zinc/11/61/01/398116101.db2.gz PJHOVFSVJPITDI-VIFPVBQESA-N 1 2 223.320 2.000 20 0 BEADLO CCn1cc(C[N@H+](Cc2ccon2)C(C)C)cn1 ZINC000649812877 398119116 /nfs/dbraw/zinc/11/91/16/398119116.db2.gz MFXYAJOYBOGKRI-UHFFFAOYSA-N 1 2 248.330 2.302 20 0 BEADLO CCn1cc(C[N@@H+](Cc2ccon2)C(C)C)cn1 ZINC000649812877 398119121 /nfs/dbraw/zinc/11/91/21/398119121.db2.gz MFXYAJOYBOGKRI-UHFFFAOYSA-N 1 2 248.330 2.302 20 0 BEADLO C[C@H]([NH2+]Cc1c[nH]nn1)[C@H]1CCCC[C@H]1C ZINC000649831504 398130686 /nfs/dbraw/zinc/13/06/86/398130686.db2.gz VUQJMCABTVQSJQ-SCVCMEIPSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@H]([NH2+]Cc1cn[nH]n1)[C@H]1CCCC[C@H]1C ZINC000649831504 398130690 /nfs/dbraw/zinc/13/06/90/398130690.db2.gz VUQJMCABTVQSJQ-SCVCMEIPSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@@H]1CC(=O)CC[N@@H+]1Cc1ccsc1 ZINC000063153008 1172801774 /nfs/dbraw/zinc/80/17/74/1172801774.db2.gz LLOWSHZTZJAAMQ-SECBINFHSA-N 1 2 209.314 2.302 20 0 BEADLO C[C@@H]1CC(=O)CC[N@H+]1Cc1ccsc1 ZINC000063153008 1172801775 /nfs/dbraw/zinc/80/17/75/1172801775.db2.gz LLOWSHZTZJAAMQ-SECBINFHSA-N 1 2 209.314 2.302 20 0 BEADLO C[N@@H+](Cc1ncccn1)C[C@@H]1CCC2(CCC2)O1 ZINC001648162171 1172804801 /nfs/dbraw/zinc/80/48/01/1172804801.db2.gz UFEAZQPGROVFDM-LBPRGKRZSA-N 1 2 247.342 2.010 20 0 BEADLO C[N@H+](Cc1ncccn1)C[C@@H]1CCC2(CCC2)O1 ZINC001648162171 1172804810 /nfs/dbraw/zinc/80/48/10/1172804810.db2.gz UFEAZQPGROVFDM-LBPRGKRZSA-N 1 2 247.342 2.010 20 0 BEADLO COCC[N@H+](C)Cc1ccnc(Cl)c1Cl ZINC000290445192 174279915 /nfs/dbraw/zinc/27/99/15/174279915.db2.gz OCFNATDHVPGECQ-UHFFFAOYSA-N 1 2 249.141 2.467 20 0 BEADLO COCC[N@@H+](C)Cc1ccnc(Cl)c1Cl ZINC000290445192 174279917 /nfs/dbraw/zinc/27/99/17/174279917.db2.gz OCFNATDHVPGECQ-UHFFFAOYSA-N 1 2 249.141 2.467 20 0 BEADLO COCCSCc1cc(OC)cc(C)[nH+]1 ZINC000270141661 174376215 /nfs/dbraw/zinc/37/62/15/174376215.db2.gz PDJAUHDNAGLNPW-UHFFFAOYSA-N 1 2 227.329 2.278 20 0 BEADLO Cc1nc(N[C@@H]2C[C@H]2C(F)(F)F)cc[nH+]1 ZINC000382008362 487529341 /nfs/dbraw/zinc/52/93/41/487529341.db2.gz LOTLZXAVDIJXIS-RNFRBKRXSA-N 1 2 217.194 2.148 20 0 BEADLO Cc1cc(F)c(C[N@@H+](C)C2(CO)CC2)c(F)c1 ZINC000668798594 487557970 /nfs/dbraw/zinc/55/79/70/487557970.db2.gz PXRQIHXCMAHWSP-UHFFFAOYSA-N 1 2 241.281 2.230 20 0 BEADLO Cc1cc(F)c(C[N@H+](C)C2(CO)CC2)c(F)c1 ZINC000668798594 487557979 /nfs/dbraw/zinc/55/79/79/487557979.db2.gz PXRQIHXCMAHWSP-UHFFFAOYSA-N 1 2 241.281 2.230 20 0 BEADLO CCc1noc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)n1 ZINC000685591170 487560755 /nfs/dbraw/zinc/56/07/55/487560755.db2.gz SEZSLIKGUZRFFF-QMMMGPOBSA-N 1 2 245.273 2.109 20 0 BEADLO CCc1noc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)n1 ZINC000685591170 487560759 /nfs/dbraw/zinc/56/07/59/487560759.db2.gz SEZSLIKGUZRFFF-QMMMGPOBSA-N 1 2 245.273 2.109 20 0 BEADLO C[C@@H]1CSCC[N@@H+]1Cc1cscn1 ZINC000172435359 176351812 /nfs/dbraw/zinc/35/18/12/176351812.db2.gz WSRVUSSFLORPLT-MRVPVSSYSA-N 1 2 214.359 2.080 20 0 BEADLO C[C@@H]1CSCC[N@H+]1Cc1cscn1 ZINC000172435359 176351814 /nfs/dbraw/zinc/35/18/14/176351814.db2.gz WSRVUSSFLORPLT-MRVPVSSYSA-N 1 2 214.359 2.080 20 0 BEADLO Cc1nnc([C@H]2CCCN(c3cccc[nH+]3)C2)o1 ZINC000680329261 487563461 /nfs/dbraw/zinc/56/34/61/487563461.db2.gz NOSIOHUIMSCELW-NSHDSACASA-N 1 2 244.298 2.157 20 0 BEADLO CCc1cnc(C[N@@H+]2CCCOC[C@H]2C)s1 ZINC000680330498 487564582 /nfs/dbraw/zinc/56/45/82/487564582.db2.gz ZWAKEFANTAEYQA-SNVBAGLBSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1cnc(C[N@H+]2CCCOC[C@H]2C)s1 ZINC000680330498 487564587 /nfs/dbraw/zinc/56/45/87/487564587.db2.gz ZWAKEFANTAEYQA-SNVBAGLBSA-N 1 2 240.372 2.316 20 0 BEADLO Cc1nc(N2CCC(OC(C)C)CC2)cc[nH+]1 ZINC000530676159 322889762 /nfs/dbraw/zinc/88/97/62/322889762.db2.gz VANYHHKJHONVRR-UHFFFAOYSA-N 1 2 235.331 2.179 20 0 BEADLO c1nc(C[NH+]2CC(C3CCOCC3)C2)cs1 ZINC000669715819 487568672 /nfs/dbraw/zinc/56/86/72/487568672.db2.gz NCRSLYJWGWAEJI-UHFFFAOYSA-N 1 2 238.356 2.002 20 0 BEADLO COc1cc[nH+]cc1NCc1cnsc1 ZINC001650814941 1172900632 /nfs/dbraw/zinc/90/06/32/1172900632.db2.gz OUEOXVZOQSFKRL-UHFFFAOYSA-N 1 2 221.285 2.159 20 0 BEADLO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1ncc(C)cn1 ZINC000680383015 487580407 /nfs/dbraw/zinc/58/04/07/487580407.db2.gz NRWMZQQDBICKBL-SECBINFHSA-N 1 2 246.314 2.241 20 0 BEADLO C[C@@H]([NH2+]Cc1nnc(C2CC2)[nH]1)c1ccoc1 ZINC000680422939 487591243 /nfs/dbraw/zinc/59/12/43/487591243.db2.gz AMUGRYRPUUBEIH-MRVPVSSYSA-N 1 2 232.287 2.126 20 0 BEADLO Cc1ccc2[nH]c(NCc3c[nH]cn3)[nH+]c2c1 ZINC001651474671 1172954863 /nfs/dbraw/zinc/95/48/63/1172954863.db2.gz ACPOWRQDCMRPPF-UHFFFAOYSA-N 1 2 227.271 2.207 20 0 BEADLO C[C@H]1C[N@H+](CC2(F)CC2)C[C@@](C)(C(F)F)O1 ZINC000668821631 487597260 /nfs/dbraw/zinc/59/72/60/487597260.db2.gz IRUXMNXZKQSZIP-WPRPVWTQSA-N 1 2 237.265 2.233 20 0 BEADLO C[C@H]1C[N@@H+](CC2(F)CC2)C[C@@](C)(C(F)F)O1 ZINC000668821631 487597264 /nfs/dbraw/zinc/59/72/64/487597264.db2.gz IRUXMNXZKQSZIP-WPRPVWTQSA-N 1 2 237.265 2.233 20 0 BEADLO Cc1nc(NCC2(O)CCC(C)CC2)cc[nH+]1 ZINC000087066696 487603594 /nfs/dbraw/zinc/60/35/94/487603594.db2.gz FGZIIBIBIUSHPK-UHFFFAOYSA-N 1 2 235.331 2.138 20 0 BEADLO CC1(CC(F)(F)F)C[NH+](Cc2cnccn2)C1 ZINC000556780208 322923637 /nfs/dbraw/zinc/92/36/37/322923637.db2.gz RPLFZUMPXDXGJO-UHFFFAOYSA-N 1 2 245.248 2.251 20 0 BEADLO C[C@@H](c1csnn1)[N@H+](C)CC1=CCSC1 ZINC000662267615 409568040 /nfs/dbraw/zinc/56/80/40/409568040.db2.gz WFTVJCRSVSANEX-QMMMGPOBSA-N 1 2 241.385 2.204 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+](C)CC1=CCSC1 ZINC000662267615 409568047 /nfs/dbraw/zinc/56/80/47/409568047.db2.gz WFTVJCRSVSANEX-QMMMGPOBSA-N 1 2 241.385 2.204 20 0 BEADLO C[C@H](CC(=O)N[C@]1(C)CC=CCC1)n1cc[nH+]c1 ZINC000650092807 409526659 /nfs/dbraw/zinc/52/66/59/409526659.db2.gz VVLSUMMDVGNHMI-TZMCWYRMSA-N 1 2 247.342 2.449 20 0 BEADLO CCn1cc([C@H](C)[NH2+]Cc2nc(C)oc2C)cn1 ZINC000660742613 409696918 /nfs/dbraw/zinc/69/69/18/409696918.db2.gz XGDUXDGULSKHNS-VIFPVBQESA-N 1 2 248.330 2.359 20 0 BEADLO CN(C(=O)CCCn1cc[nH+]c1)C1CC(C)(C)C1 ZINC000655335473 409911272 /nfs/dbraw/zinc/91/12/72/409911272.db2.gz HTAFFJNRKPKIHD-UHFFFAOYSA-N 1 2 249.358 2.310 20 0 BEADLO Cn1c[nH+]cc1CSc1ccc(O)cc1 ZINC000085191884 409915136 /nfs/dbraw/zinc/91/51/36/409915136.db2.gz MXXDALCFDHHPND-UHFFFAOYSA-N 1 2 220.297 2.418 20 0 BEADLO CC(=O)c1cc(NC(=O)[C@H](C)[NH+](C)C)ccc1C ZINC000655320833 409893726 /nfs/dbraw/zinc/89/37/26/409893726.db2.gz AYYZGHGFWPLCFP-JTQLQIEISA-N 1 2 248.326 2.086 20 0 BEADLO CCc1nocc1C[N@H+]1C[C@H](CC)OC[C@H]1C ZINC000660912259 409960266 /nfs/dbraw/zinc/96/02/66/409960266.db2.gz IHDYZMIGJSSYOE-PWSUYJOCSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1nocc1C[N@@H+]1C[C@H](CC)OC[C@H]1C ZINC000660912259 409960271 /nfs/dbraw/zinc/96/02/71/409960271.db2.gz IHDYZMIGJSSYOE-PWSUYJOCSA-N 1 2 238.331 2.236 20 0 BEADLO CCn1nccc1C[N@@H+]1C[C@@H](C)OCC12CCC2 ZINC000651974930 409964122 /nfs/dbraw/zinc/96/41/22/409964122.db2.gz UVJXVISYCTYBMB-GFCCVEGCSA-N 1 2 249.358 2.046 20 0 BEADLO CCn1nccc1C[N@H+]1C[C@@H](C)OCC12CCC2 ZINC000651974930 409964129 /nfs/dbraw/zinc/96/41/29/409964129.db2.gz UVJXVISYCTYBMB-GFCCVEGCSA-N 1 2 249.358 2.046 20 0 BEADLO CSc1ccc[nH+]c1N[C@@H]1CCOC1 ZINC000651971742 409942550 /nfs/dbraw/zinc/94/25/50/409942550.db2.gz SNXDXBBDCLIWCE-MRVPVSSYSA-N 1 2 210.302 2.004 20 0 BEADLO COC[C@H](C)Nc1[nH+]cccc1SC ZINC000651971390 409943524 /nfs/dbraw/zinc/94/35/24/409943524.db2.gz CIBQJRRPJVNTFR-QMMMGPOBSA-N 1 2 212.318 2.250 20 0 BEADLO Cc1nn(C)cc1[C@@H](C)[NH2+][C@H](C)C(F)F ZINC000389902630 410019426 /nfs/dbraw/zinc/01/94/26/410019426.db2.gz DHNRFIGCELQNQB-HTRCEHHLSA-N 1 2 217.263 2.033 20 0 BEADLO FC1(F)C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ncccn1 ZINC000625678931 410060940 /nfs/dbraw/zinc/06/09/40/410060940.db2.gz KFBDDOUKEVLTDW-AOOOYVTPSA-N 1 2 239.269 2.239 20 0 BEADLO FC1(F)C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ncccn1 ZINC000625678931 410060945 /nfs/dbraw/zinc/06/09/45/410060945.db2.gz KFBDDOUKEVLTDW-AOOOYVTPSA-N 1 2 239.269 2.239 20 0 BEADLO COCc1ccc(C[N@H+](C)Cc2cnc[nH]2)cc1 ZINC000661090222 410160553 /nfs/dbraw/zinc/16/05/53/410160553.db2.gz NWUJZBCAKYJVHM-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO COCc1ccc(C[N@@H+](C)Cc2cnc[nH]2)cc1 ZINC000661090222 410160556 /nfs/dbraw/zinc/16/05/56/410160556.db2.gz NWUJZBCAKYJVHM-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO COCc1ccc(C[N@H+](C)Cc2c[nH]cn2)cc1 ZINC000661090222 410160563 /nfs/dbraw/zinc/16/05/63/410160563.db2.gz NWUJZBCAKYJVHM-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO COCc1ccc(C[N@@H+](C)Cc2c[nH]cn2)cc1 ZINC000661090222 410160566 /nfs/dbraw/zinc/16/05/66/410160566.db2.gz NWUJZBCAKYJVHM-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO CCC(C)(C)CC(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000655401788 410205962 /nfs/dbraw/zinc/20/59/62/410205962.db2.gz DSSGIIJFNQCUPM-SECBINFHSA-N 1 2 223.320 2.413 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1C[C@@H]1C1CCCC1)c1[nH]cc[nH+]1 ZINC000655402742 410207884 /nfs/dbraw/zinc/20/78/84/410207884.db2.gz PIWNMOXDFYZQCC-YUSALJHKSA-N 1 2 247.342 2.413 20 0 BEADLO CC[C@@H](C)NC(=O)c1ccn2cc(C)[nH+]c2c1 ZINC000071540713 410416727 /nfs/dbraw/zinc/41/67/27/410416727.db2.gz VMDFEFVZVONKSD-SECBINFHSA-N 1 2 231.299 2.171 20 0 BEADLO CCC1(Nc2nc(N(C)C)nc(C)[nH+]2)CCCC1 ZINC000663959854 410405608 /nfs/dbraw/zinc/40/56/08/410405608.db2.gz QIKWWLIAESFHSG-UHFFFAOYSA-N 1 2 249.362 2.381 20 0 BEADLO CCC1(Nc2nc(C)[nH+]c(N(C)C)n2)CCCC1 ZINC000663959854 410405610 /nfs/dbraw/zinc/40/56/10/410405610.db2.gz QIKWWLIAESFHSG-UHFFFAOYSA-N 1 2 249.362 2.381 20 0 BEADLO C[C@H](CCO)N(C)c1[nH+]ccc2c(N)cccc21 ZINC000664071059 410452591 /nfs/dbraw/zinc/45/25/91/410452591.db2.gz RWJPGVPXUOXFSU-SNVBAGLBSA-N 1 2 245.326 2.024 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)c1cc(C(C)(C)C)ncn1 ZINC000664128436 410462524 /nfs/dbraw/zinc/46/25/24/410462524.db2.gz YFRSZEFUBTZIRH-UHFFFAOYSA-N 1 2 245.330 2.134 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)c1cc(C(C)(C)C)ncn1 ZINC000664128436 410462530 /nfs/dbraw/zinc/46/25/30/410462530.db2.gz YFRSZEFUBTZIRH-UHFFFAOYSA-N 1 2 245.330 2.134 20 0 BEADLO C[C@]1(CNc2nc[nH+]c(N)c2Cl)CC1(F)F ZINC000664400789 410577458 /nfs/dbraw/zinc/57/74/58/410577458.db2.gz OHPDYNLNQPCUOC-MRVPVSSYSA-N 1 2 248.664 2.169 20 0 BEADLO C[C@]1(CNc2[nH+]cnc(N)c2Cl)CC1(F)F ZINC000664400789 410577463 /nfs/dbraw/zinc/57/74/63/410577463.db2.gz OHPDYNLNQPCUOC-MRVPVSSYSA-N 1 2 248.664 2.169 20 0 BEADLO O[C@@H]1C[C@H](Nc2cc[nH+]c(C3CC3)n2)C12CCC2 ZINC000664465149 410586063 /nfs/dbraw/zinc/58/60/63/410586063.db2.gz GKEJQRHRQDILDQ-WDEREUQCSA-N 1 2 245.326 2.069 20 0 BEADLO CC(C(=O)N(C)Cc1[nH+]ccn1C)=C1CCCC1 ZINC000267875003 166495698 /nfs/dbraw/zinc/49/56/98/166495698.db2.gz RJKLOMYORPTRNI-UHFFFAOYSA-N 1 2 247.342 2.269 20 0 BEADLO CC(C)(C)CC(=O)NCCCNc1cccc[nH+]1 ZINC000115162137 166548555 /nfs/dbraw/zinc/54/85/55/166548555.db2.gz FTFJJCUIDBAFHS-UHFFFAOYSA-N 1 2 249.358 2.436 20 0 BEADLO C[C@@H](C(N)=O)[N@@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000661437825 410659209 /nfs/dbraw/zinc/65/92/09/410659209.db2.gz PLQHDUZPRLFJGL-CMPLNLGQSA-N 1 2 248.326 2.071 20 0 BEADLO C[C@@H](C(N)=O)[N@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000661437825 410659212 /nfs/dbraw/zinc/65/92/12/410659212.db2.gz PLQHDUZPRLFJGL-CMPLNLGQSA-N 1 2 248.326 2.071 20 0 BEADLO CC(C)NC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000106509444 167070231 /nfs/dbraw/zinc/07/02/31/167070231.db2.gz LHFGCOGNBWTZHI-JTQLQIEISA-N 1 2 236.319 2.055 20 0 BEADLO CC(C)Nc1ccccc1C[NH+]1CCOCC1 ZINC000121593676 167150367 /nfs/dbraw/zinc/15/03/67/167150367.db2.gz OLAQGEACVDLMTC-UHFFFAOYSA-N 1 2 234.343 2.339 20 0 BEADLO CC(C)OC(=O)NCCc1cn2ccccc2[nH+]1 ZINC000279281388 167164633 /nfs/dbraw/zinc/16/46/33/167164633.db2.gz OKULCIAKQLNCAJ-UHFFFAOYSA-N 1 2 247.298 2.011 20 0 BEADLO CC(C)OC(=O)[C@H]1CN(c2cccc[nH+]2)C[C@H]1C ZINC000353637057 167170012 /nfs/dbraw/zinc/17/00/12/167170012.db2.gz JNMXBZOVQKEKRX-NEPJUHHUSA-N 1 2 248.326 2.106 20 0 BEADLO CC(C)O[C@@H]1C[C@@H]([NH2+]Cc2ccn[nH]2)C1(C)C ZINC000361238164 167281689 /nfs/dbraw/zinc/28/16/89/167281689.db2.gz SIOBFOVLFCHGQV-VXGBXAGGSA-N 1 2 237.347 2.091 20 0 BEADLO CC(C)SCCNc1nc[nH+]c(N)c1Cl ZINC000286381941 167334377 /nfs/dbraw/zinc/33/43/77/167334377.db2.gz KMOSENLSLYOKJF-UHFFFAOYSA-N 1 2 246.767 2.266 20 0 BEADLO CC(C)SCCNc1[nH+]cnc(N)c1Cl ZINC000286381941 167334380 /nfs/dbraw/zinc/33/43/80/167334380.db2.gz KMOSENLSLYOKJF-UHFFFAOYSA-N 1 2 246.767 2.266 20 0 BEADLO CC(C)[C@@H](C)C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000264988868 167349059 /nfs/dbraw/zinc/34/90/59/167349059.db2.gz JMJJYARNJQRQRG-LLVKDONJSA-N 1 2 249.358 2.408 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CSC[C@H]1C ZINC000397949622 410938261 /nfs/dbraw/zinc/93/82/61/410938261.db2.gz WAAXOWTYQFMSHD-BDAKNGLRSA-N 1 2 224.329 2.254 20 0 BEADLO CC(C)[C@@H](C)C(=O)Nc1ccc[nH+]c1N(C)C ZINC000171921957 167354743 /nfs/dbraw/zinc/35/47/43/167354743.db2.gz ULRRHVDCCUFREB-SNVBAGLBSA-N 1 2 235.331 2.378 20 0 BEADLO CCC[C@@H](C)[C@H](CO)Nc1cc(CC)[nH+]cn1 ZINC000651384261 410967636 /nfs/dbraw/zinc/96/76/36/410967636.db2.gz IIPRAEXDZPUKLU-PWSUYJOCSA-N 1 2 237.347 2.248 20 0 BEADLO CC[C@H](C)[C@H](C[NH2+][C@@H](C)c1cn[nH]c1C)OC ZINC000651387845 410971127 /nfs/dbraw/zinc/97/11/27/410971127.db2.gz AYNWCZVYIFCRLA-KWBADKCTSA-N 1 2 239.363 2.430 20 0 BEADLO CC[C@H]1COC(C)(C)CN1c1cc(C)[nH+]cn1 ZINC000651396863 410978206 /nfs/dbraw/zinc/97/82/06/410978206.db2.gz FMOCKJCPIXHWLW-NSHDSACASA-N 1 2 235.331 2.179 20 0 BEADLO CC[C@@H]1CN(c2cc[nH+]c(C)n2)[C@@H](CC)CO1 ZINC000651397596 410979394 /nfs/dbraw/zinc/97/93/94/410979394.db2.gz TVDTUIRPWXKZMK-NWDGAFQWSA-N 1 2 235.331 2.179 20 0 BEADLO Nc1[nH+]cnc(NC2CC3(CCC3)C2)c1Cl ZINC000651473225 411055813 /nfs/dbraw/zinc/05/58/13/411055813.db2.gz CUOXHWKMQAQHPD-UHFFFAOYSA-N 1 2 238.722 2.457 20 0 BEADLO Nc1nc[nH+]c(NC2CC3(CCC3)C2)c1Cl ZINC000651473225 411055818 /nfs/dbraw/zinc/05/58/18/411055818.db2.gz CUOXHWKMQAQHPD-UHFFFAOYSA-N 1 2 238.722 2.457 20 0 BEADLO C[C@H](COCC1CC1)Nc1cccc[nH+]1 ZINC000651458492 411040951 /nfs/dbraw/zinc/04/09/51/411040951.db2.gz HNNSDPLZXRCAFO-SNVBAGLBSA-N 1 2 206.289 2.309 20 0 BEADLO Cc1cc(N[C@@H](C)COCC2CC2)nc[nH+]1 ZINC000651459056 411043237 /nfs/dbraw/zinc/04/32/37/411043237.db2.gz ZPUMUHUYPFUMER-JTQLQIEISA-N 1 2 221.304 2.012 20 0 BEADLO Cc1[nH]ncc1C[NH2+]Cc1cccc2c1CCC2 ZINC000651716590 411138432 /nfs/dbraw/zinc/13/84/32/411138432.db2.gz AYMSZULGXHCCLC-UHFFFAOYSA-N 1 2 241.338 2.497 20 0 BEADLO COC1(C)C[NH+](Cc2cc3cnccc3o2)C1 ZINC000651812189 411144960 /nfs/dbraw/zinc/14/49/60/411144960.db2.gz PELAXLURUZDJGO-UHFFFAOYSA-N 1 2 232.283 2.049 20 0 BEADLO CCOC1C[NH+](Cc2cc3cnccc3o2)C1 ZINC000651828565 411146681 /nfs/dbraw/zinc/14/66/81/411146681.db2.gz RDTPPKBCYHQCFM-UHFFFAOYSA-N 1 2 232.283 2.049 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@H](OC(C)C)C1 ZINC000651897379 411149365 /nfs/dbraw/zinc/14/93/65/411149365.db2.gz ZPYHTMYOQWUCRV-ZDUSSCGKSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@H](OC(C)C)C1 ZINC000651897379 411149366 /nfs/dbraw/zinc/14/93/66/411149366.db2.gz ZPYHTMYOQWUCRV-ZDUSSCGKSA-N 1 2 237.347 2.108 20 0 BEADLO COCc1cc(CNc2cc(C)c[nH+]c2C)no1 ZINC000651924443 411150516 /nfs/dbraw/zinc/15/05/16/411150516.db2.gz GAAZHOILPDGKIB-UHFFFAOYSA-N 1 2 247.298 2.445 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@H](CC)OC[C@@H]2C)cn1 ZINC000651932182 411150761 /nfs/dbraw/zinc/15/07/61/411150761.db2.gz NKBPJSUWYNRQLL-AAEUAGOBSA-N 1 2 249.358 2.038 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@H](CC)OC[C@@H]2C)cn1 ZINC000651932182 411150762 /nfs/dbraw/zinc/15/07/62/411150762.db2.gz NKBPJSUWYNRQLL-AAEUAGOBSA-N 1 2 249.358 2.038 20 0 BEADLO COCc1cc[nH+]c(NC[C@@H]2C[C@@H]2C)c1 ZINC000652067801 411105213 /nfs/dbraw/zinc/10/52/13/411105213.db2.gz HYAGSHADZYNDEP-ONGXEEELSA-N 1 2 206.289 2.296 20 0 BEADLO CCOC1CC(Nc2cc(COC)cc[nH+]2)C1 ZINC000652069059 411106539 /nfs/dbraw/zinc/10/65/39/411106539.db2.gz YIYCUDJOXACRPX-UHFFFAOYSA-N 1 2 236.315 2.207 20 0 BEADLO CC(C)Cn1nccc1C[N@@H+]1CCC[C@@H](F)C1 ZINC000652076224 411107867 /nfs/dbraw/zinc/10/78/67/411107867.db2.gz UKAJYBAUWKYGGR-GFCCVEGCSA-N 1 2 239.338 2.473 20 0 BEADLO CC(C)Cn1nccc1C[N@H+]1CCC[C@@H](F)C1 ZINC000652076224 411107868 /nfs/dbraw/zinc/10/78/68/411107868.db2.gz UKAJYBAUWKYGGR-GFCCVEGCSA-N 1 2 239.338 2.473 20 0 BEADLO F[C@H]1CCC[N@H+](Cc2cncs2)C1 ZINC000652076865 411108952 /nfs/dbraw/zinc/10/89/52/411108952.db2.gz BQOSBAIYBNTIBF-QMMMGPOBSA-N 1 2 200.282 2.077 20 0 BEADLO F[C@H]1CCC[N@@H+](Cc2cncs2)C1 ZINC000652076865 411108955 /nfs/dbraw/zinc/10/89/55/411108955.db2.gz BQOSBAIYBNTIBF-QMMMGPOBSA-N 1 2 200.282 2.077 20 0 BEADLO CCc1nn(C)cc1N[C@@H]1CCCn2cc[nH+]c21 ZINC000655748852 411161885 /nfs/dbraw/zinc/16/18/85/411161885.db2.gz LSHJRICMVULZDN-LLVKDONJSA-N 1 2 245.330 2.126 20 0 BEADLO CCc1nn(C)cc1N[C@H]1CCCn2cc[nH+]c21 ZINC000655748853 411162020 /nfs/dbraw/zinc/16/20/20/411162020.db2.gz LSHJRICMVULZDN-NSHDSACASA-N 1 2 245.330 2.126 20 0 BEADLO c1cc2n(n1)CCC[C@H]2Nc1cccc[nH+]1 ZINC000657940202 411175088 /nfs/dbraw/zinc/17/50/88/411175088.db2.gz HZNLPRDLWKXNLQ-SNVBAGLBSA-N 1 2 214.272 2.225 20 0 BEADLO COc1ccc(N[C@@H]2CCCn3nccc32)[nH+]c1 ZINC000657949003 411177541 /nfs/dbraw/zinc/17/75/41/411177541.db2.gz DIIYHCGGSIHRTL-LLVKDONJSA-N 1 2 244.298 2.234 20 0 BEADLO COc1c(C)[nH+]cnc1N(C)Cc1cccs1 ZINC000656105136 411178914 /nfs/dbraw/zinc/17/89/14/411178914.db2.gz MNAHPRYVJDAMOT-UHFFFAOYSA-N 1 2 249.339 2.492 20 0 BEADLO COc1c(C)[nH+]cnc1N1CCC[C@H](C)C1 ZINC000656103734 411178954 /nfs/dbraw/zinc/17/89/54/411178954.db2.gz CLFBXOUQOHPUDF-VIFPVBQESA-N 1 2 221.304 2.030 20 0 BEADLO COc1c(C)[nH+]cnc1NCC1CCC1 ZINC000656108094 411179394 /nfs/dbraw/zinc/17/93/94/411179394.db2.gz NPLABNWWIZNICL-UHFFFAOYSA-N 1 2 207.277 2.006 20 0 BEADLO COc1c(C)[nH+]cnc1NCCOC(C)(C)C ZINC000656113187 411180306 /nfs/dbraw/zinc/18/03/06/411180306.db2.gz KVHAGYAHUUERDP-UHFFFAOYSA-N 1 2 239.319 2.021 20 0 BEADLO Cc1cccc(CNc2nc(C)[nH+]cc2C)n1 ZINC000656110344 411180529 /nfs/dbraw/zinc/18/05/29/411180529.db2.gz IPLPJATVRMUYMA-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO CCOCCCCNc1nc(C)[nH+]cc1C ZINC000656110472 411180658 /nfs/dbraw/zinc/18/06/58/411180658.db2.gz YANLTOXPADTIHQ-UHFFFAOYSA-N 1 2 223.320 2.322 20 0 BEADLO COc1c(C)[nH+]cnc1NCc1c(C)noc1C ZINC000656111691 411181850 /nfs/dbraw/zinc/18/18/50/411181850.db2.gz ZIIWMDCBKSMNHY-UHFFFAOYSA-N 1 2 248.286 2.011 20 0 BEADLO COc1c(C)[nH+]cnc1N1CCC[C@H](C)CC1 ZINC000656112544 411181964 /nfs/dbraw/zinc/18/19/64/411181964.db2.gz BDUDNHWRZBNKAU-JTQLQIEISA-N 1 2 235.331 2.420 20 0 BEADLO COc1c(C)[nH+]cnc1N1CCCC(C)(C)C1 ZINC000656125631 411183265 /nfs/dbraw/zinc/18/32/65/411183265.db2.gz UTFSIUICCQLKGM-UHFFFAOYSA-N 1 2 235.331 2.420 20 0 BEADLO COc1c(C)[nH+]cnc1NC[C@H](C)C(C)C ZINC000656128679 411183868 /nfs/dbraw/zinc/18/38/68/411183868.db2.gz ZERVETVNIXOUEK-VIFPVBQESA-N 1 2 223.320 2.498 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@H]1CCCSC1 ZINC000656137418 411185554 /nfs/dbraw/zinc/18/55/54/411185554.db2.gz FHRYGFODIVWQBW-VIFPVBQESA-N 1 2 239.344 2.101 20 0 BEADLO COc1c(C)[nH+]cnc1N1CC[C@H](C2CC2)C1 ZINC000656152016 411187146 /nfs/dbraw/zinc/18/71/46/411187146.db2.gz BOGCBTLYRYKAEN-NSHDSACASA-N 1 2 233.315 2.030 20 0 BEADLO COc1c(C)[nH+]cnc1N1CC[C@H](C)[C@H](C)C1 ZINC000656152041 411187516 /nfs/dbraw/zinc/18/75/16/411187516.db2.gz CYPLTCRLIOQUBW-VHSXEESVSA-N 1 2 235.331 2.276 20 0 BEADLO c1cnc(C[N@@H+]2CCC[C@@H](OC3CCC3)C2)nc1 ZINC000653811276 411188548 /nfs/dbraw/zinc/18/85/48/411188548.db2.gz CEBXJPBARFHGQY-CYBMUJFWSA-N 1 2 247.342 2.010 20 0 BEADLO c1cnc(C[N@H+]2CCC[C@@H](OC3CCC3)C2)nc1 ZINC000653811276 411188549 /nfs/dbraw/zinc/18/85/49/411188549.db2.gz CEBXJPBARFHGQY-CYBMUJFWSA-N 1 2 247.342 2.010 20 0 BEADLO CO[C@@H]1CC[C@H](Nc2nc(C)[nH+]cc2C)C1 ZINC000656176048 411193004 /nfs/dbraw/zinc/19/30/04/411193004.db2.gz UIMXELKVCZBALL-WDEREUQCSA-N 1 2 221.304 2.073 20 0 BEADLO CNc1ccc(-c2cccc(CO)c2)c[nH+]1 ZINC000061896451 411195390 /nfs/dbraw/zinc/19/53/90/411195390.db2.gz VTFVOXWDODQKRD-UHFFFAOYSA-N 1 2 214.268 2.283 20 0 BEADLO CO[C@H](C)C[NH+]1Cc2cc(F)c(F)cc2C1 ZINC000653831198 411195668 /nfs/dbraw/zinc/19/56/68/411195668.db2.gz YZTPFSVOEAYPJF-MRVPVSSYSA-N 1 2 227.254 2.315 20 0 BEADLO C[C@H](O)CCC[NH+]1Cc2cc(F)c(F)cc2C1 ZINC000653830803 411195879 /nfs/dbraw/zinc/19/58/79/411195879.db2.gz KREHYQMLCLBLLA-VIFPVBQESA-N 1 2 241.281 2.441 20 0 BEADLO Cc1cc(CNc2nc(C)[nH+]cc2C)nc(C)n1 ZINC000656186444 411196335 /nfs/dbraw/zinc/19/63/35/411196335.db2.gz ZSMVJWBTDHENQJ-UHFFFAOYSA-N 1 2 243.314 2.112 20 0 BEADLO COc1c(C)[nH+]cnc1NCC1CC(F)(F)C1 ZINC000656189352 411197618 /nfs/dbraw/zinc/19/76/18/411197618.db2.gz RPWWMVYONLDEFR-UHFFFAOYSA-N 1 2 243.257 2.251 20 0 BEADLO FC1(F)CCC[C@@H]1[NH2+][C@@H]1CCCn2nccc21 ZINC000658016345 411198864 /nfs/dbraw/zinc/19/88/64/411198864.db2.gz XAGIKRLIRNRDCX-KOLCDFICSA-N 1 2 241.285 2.495 20 0 BEADLO COCCC[C@H](C)Nc1cc(COC)cc[nH+]1 ZINC000652330718 411202022 /nfs/dbraw/zinc/20/20/22/411202022.db2.gz NKHRGADFSFJQKZ-NSHDSACASA-N 1 2 238.331 2.455 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](C)[C@H](C)OC)c1 ZINC000652330482 411202205 /nfs/dbraw/zinc/20/22/05/411202205.db2.gz HUJQIZFOXHZGIB-UWVGGRQHSA-N 1 2 224.304 2.063 20 0 BEADLO COCc1cc[nH+]c(N[C@H](COC)C2CC2)c1 ZINC000652330436 411202451 /nfs/dbraw/zinc/20/24/51/411202451.db2.gz GECMARYQHGDFNC-GFCCVEGCSA-N 1 2 236.315 2.065 20 0 BEADLO C[C@@H]([NH2+]Cc1c[nH]nn1)C1CCC(F)(F)CC1 ZINC000653872041 411203035 /nfs/dbraw/zinc/20/30/35/411203035.db2.gz NGYYMFJJQZJAEI-MRVPVSSYSA-N 1 2 244.289 2.108 20 0 BEADLO C[C@@H]([NH2+]Cc1cn[nH]n1)C1CCC(F)(F)CC1 ZINC000653872041 411203038 /nfs/dbraw/zinc/20/30/38/411203038.db2.gz NGYYMFJJQZJAEI-MRVPVSSYSA-N 1 2 244.289 2.108 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@H]1CS[C@H](C)C1 ZINC000656202142 411206806 /nfs/dbraw/zinc/20/68/06/411206806.db2.gz USWKWRCESOHMLN-VXNVDRBHSA-N 1 2 239.344 2.100 20 0 BEADLO Cc1cc(N(C[C@@H](C)O)C2CC2)nc(C2CC2)[nH+]1 ZINC000656229941 411216520 /nfs/dbraw/zinc/21/65/20/411216520.db2.gz IDLPTBWIERUNAH-SNVBAGLBSA-N 1 2 247.342 2.012 20 0 BEADLO Cc1cc(C)c(CNC(=O)N2CC[C@H]2C)c[nH+]1 ZINC000656254071 411218275 /nfs/dbraw/zinc/21/82/75/411218275.db2.gz XNSLYXDPKYWPQP-LLVKDONJSA-N 1 2 233.315 2.002 20 0 BEADLO CC(C)n1cncc1C[NH+]1CC2(CC2(F)F)C1 ZINC000656265212 411220411 /nfs/dbraw/zinc/22/04/11/411220411.db2.gz DDGVYFWFYTVDBG-UHFFFAOYSA-N 1 2 241.285 2.305 20 0 BEADLO CC(C)n1c[nH+]cc1CN1CC2(CC2(F)F)C1 ZINC000656265212 411220413 /nfs/dbraw/zinc/22/04/13/411220413.db2.gz DDGVYFWFYTVDBG-UHFFFAOYSA-N 1 2 241.285 2.305 20 0 BEADLO CCc1nocc1C[NH+]1CC2(CC2(F)F)C1 ZINC000656265575 411221806 /nfs/dbraw/zinc/22/18/06/411221806.db2.gz SXYFNRDIPPNXQI-UHFFFAOYSA-N 1 2 228.242 2.078 20 0 BEADLO C[C@H]1CC(C)(C)CN1C(=O)CCCn1cc[nH+]c1 ZINC000665662902 411224337 /nfs/dbraw/zinc/22/43/37/411224337.db2.gz OKLBMDJLUPJCCB-LBPRGKRZSA-N 1 2 249.358 2.310 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCCn2ccnc21)c1ccccn1 ZINC000655684657 411226116 /nfs/dbraw/zinc/22/61/16/411226116.db2.gz UEQWWKZWNMWJPO-YPMHNXCESA-N 1 2 242.326 2.464 20 0 BEADLO COCCc1ccc(-c2[nH+]ccn2C)cc1 ZINC000656371717 411237620 /nfs/dbraw/zinc/23/76/20/411237620.db2.gz QLRSPFOFGHEEGI-UHFFFAOYSA-N 1 2 216.284 2.276 20 0 BEADLO CCc1cc(NCC2(OC)CCCC2)nc[nH+]1 ZINC000310480530 411239556 /nfs/dbraw/zinc/23/95/56/411239556.db2.gz LHFWEOGPXMKXQI-UHFFFAOYSA-N 1 2 235.331 2.410 20 0 BEADLO Cc1occc1C[NH2+]Cc1cc2n(n1)CCCC2 ZINC000655716424 411271221 /nfs/dbraw/zinc/27/12/21/411271221.db2.gz XHEDECVUZNXWMS-UHFFFAOYSA-N 1 2 245.326 2.411 20 0 BEADLO CCCC(CCC)[NH2+]Cc1nnc(COC)[nH]1 ZINC000658162590 411276334 /nfs/dbraw/zinc/27/63/34/411276334.db2.gz UYZZBCMRMONNMY-UHFFFAOYSA-N 1 2 240.351 2.010 20 0 BEADLO CC(=O)C[N@@H+](C)[C@@H](C)c1ccccc1F ZINC000062015758 411283263 /nfs/dbraw/zinc/28/32/63/411283263.db2.gz NAOAIMRJRPIIAB-JTQLQIEISA-N 1 2 209.264 2.408 20 0 BEADLO CC(=O)C[N@H+](C)[C@@H](C)c1ccccc1F ZINC000062015758 411283265 /nfs/dbraw/zinc/28/32/65/411283265.db2.gz NAOAIMRJRPIIAB-JTQLQIEISA-N 1 2 209.264 2.408 20 0 BEADLO CC1(C(=O)NCc2cn3ccccc3[nH+]2)CCC1 ZINC000267316234 167871469 /nfs/dbraw/zinc/87/14/69/167871469.db2.gz BTVSQAHRWKXZFW-UHFFFAOYSA-N 1 2 243.310 2.141 20 0 BEADLO CCOC(=O)[C@@H]1CCC[N@H+](CC(F)(F)CC)C1 ZINC000602755183 411298963 /nfs/dbraw/zinc/29/89/63/411298963.db2.gz APHKUSVHRMOXSQ-SNVBAGLBSA-N 1 2 249.301 2.307 20 0 BEADLO CCOC(=O)[C@@H]1CCC[N@@H+](CC(F)(F)CC)C1 ZINC000602755183 411298964 /nfs/dbraw/zinc/29/89/64/411298964.db2.gz APHKUSVHRMOXSQ-SNVBAGLBSA-N 1 2 249.301 2.307 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc(C3CC3)no2)[C@@H](C)CO1 ZINC000659822556 411305890 /nfs/dbraw/zinc/30/58/90/411305890.db2.gz OGUDZIGCQOKBGI-VHSXEESVSA-N 1 2 236.315 2.161 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc(C3CC3)no2)[C@@H](C)CO1 ZINC000659822556 411305892 /nfs/dbraw/zinc/30/58/92/411305892.db2.gz OGUDZIGCQOKBGI-VHSXEESVSA-N 1 2 236.315 2.161 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@H]1CC12CCC2 ZINC000654002465 411310671 /nfs/dbraw/zinc/31/06/71/411310671.db2.gz AWILWDCGZBNFIN-WDEREUQCSA-N 1 2 247.342 2.270 20 0 BEADLO Clc1cccc(CC[N@@H+]2CCO[C@H]3C[C@H]32)c1 ZINC000656630582 411311067 /nfs/dbraw/zinc/31/10/67/411311067.db2.gz ZTEISLFEQCRIMD-OLZOCXBDSA-N 1 2 237.730 2.356 20 0 BEADLO Clc1cccc(CC[N@H+]2CCO[C@H]3C[C@H]32)c1 ZINC000656630582 411311070 /nfs/dbraw/zinc/31/10/70/411311070.db2.gz ZTEISLFEQCRIMD-OLZOCXBDSA-N 1 2 237.730 2.356 20 0 BEADLO C[C@H](O)CC[NH2+]c1ccc(-n2cccn2)cc1 ZINC000656640201 411313780 /nfs/dbraw/zinc/31/37/80/411313780.db2.gz GVAJQETYDHBAHI-NSHDSACASA-N 1 2 231.299 2.055 20 0 BEADLO Fc1cnccc1C[NH+]1CC2(CC(F)C2)C1 ZINC000656693618 411331822 /nfs/dbraw/zinc/33/18/22/411331822.db2.gz NPYDTYGUKCNFJP-UHFFFAOYSA-N 1 2 224.254 2.155 20 0 BEADLO C[C@H](CC(=O)NC1(C)CC=CC1)n1cc[nH+]c1 ZINC000654013023 411315927 /nfs/dbraw/zinc/31/59/27/411315927.db2.gz PGWRDFSQGIJRMN-LLVKDONJSA-N 1 2 233.315 2.059 20 0 BEADLO Cc1ccn(-c2ccc([NH2+]CC[C@H](C)O)cc2)n1 ZINC000656654372 411317467 /nfs/dbraw/zinc/31/74/67/411317467.db2.gz YNKMDPRDGRNABP-LBPRGKRZSA-N 1 2 245.326 2.364 20 0 BEADLO C[C@H]([NH2+][C@@H]1C[C@H](C)n2ncnc21)c1cccnc1 ZINC000656679785 411320606 /nfs/dbraw/zinc/32/06/06/411320606.db2.gz KLOYSSDFIQZNGD-JBLDHEPKSA-N 1 2 243.314 2.030 20 0 BEADLO FC1(F)COCC[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1 ZINC000660561668 411321375 /nfs/dbraw/zinc/32/13/75/411321375.db2.gz ZDUKWDSEFJWIOH-UTUOFQBUSA-N 1 2 245.313 2.390 20 0 BEADLO FC1(F)COCC[N@@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1 ZINC000660561668 411321380 /nfs/dbraw/zinc/32/13/80/411321380.db2.gz ZDUKWDSEFJWIOH-UTUOFQBUSA-N 1 2 245.313 2.390 20 0 BEADLO CC[C@H](N[C@@H]1CCCn2cc[nH+]c21)C(F)F ZINC000655771451 411253887 /nfs/dbraw/zinc/25/38/87/411253887.db2.gz LGGVOSWHBHXLIQ-DTWKUNHWSA-N 1 2 229.274 2.351 20 0 BEADLO C=C/C(C)=C/CC(=O)NCc1[nH+]ccn1CC ZINC000653770458 411350430 /nfs/dbraw/zinc/35/04/30/411350430.db2.gz QUXXPSWZLBUQPS-IZZDOVSWSA-N 1 2 233.315 2.042 20 0 BEADLO Cc1cc[nH+]cc1Cc1nc([C@@H]2C[C@H]2C)no1 ZINC000656754604 411351528 /nfs/dbraw/zinc/35/15/28/411351528.db2.gz MOZQRIWBHAKNCH-MWLCHTKSSA-N 1 2 229.283 2.487 20 0 BEADLO CC(C)n1ccnc1CNc1cc[nH+]cc1F ZINC000656772026 411355461 /nfs/dbraw/zinc/35/54/61/411355461.db2.gz LHAINJSIRWZMQX-UHFFFAOYSA-N 1 2 234.278 2.032 20 0 BEADLO Cn1ccnc1CNc1c[nH+]cc2c1CCCC2 ZINC000656777064 411356224 /nfs/dbraw/zinc/35/62/24/411356224.db2.gz ZNHKHBPANXAAKB-UHFFFAOYSA-N 1 2 242.326 2.306 20 0 BEADLO Cc1cc[nH+]cc1NCc1cnn2c1CCC2 ZINC000656771375 411364345 /nfs/dbraw/zinc/36/43/45/411364345.db2.gz PRKGYFNARBDTLE-UHFFFAOYSA-N 1 2 228.299 2.145 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1nccn1C)c1cncs1 ZINC000658337671 411344485 /nfs/dbraw/zinc/34/44/85/411344485.db2.gz VNLFIQNVAGCFFZ-RKDXNWHRSA-N 1 2 236.344 2.288 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCC(=O)CC23CCC3)c1 ZINC000653764922 411345305 /nfs/dbraw/zinc/34/53/05/411345305.db2.gz HVOJMTRBVSKLLT-UHFFFAOYSA-N 1 2 244.338 2.478 20 0 BEADLO Cc1ccnc(C[N@H+]2CCC(=O)CC23CCC3)c1 ZINC000653764922 411345308 /nfs/dbraw/zinc/34/53/08/411345308.db2.gz HVOJMTRBVSKLLT-UHFFFAOYSA-N 1 2 244.338 2.478 20 0 BEADLO CC1(CC(=O)NCCn2cc[nH+]c2)CCCCC1 ZINC000163881223 168017024 /nfs/dbraw/zinc/01/70/24/168017024.db2.gz YKOLJBDBQTXRTK-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO CC1(CO)C[NH+](Cc2ccsc2Cl)C1 ZINC000334648085 168052048 /nfs/dbraw/zinc/05/20/48/168052048.db2.gz UJNQREGVTCACPJ-UHFFFAOYSA-N 1 2 231.748 2.216 20 0 BEADLO CC1(O)CC[NH+](Cc2cnc(Cl)s2)CC1 ZINC000087781426 168066901 /nfs/dbraw/zinc/06/69/01/168066901.db2.gz XGOZJXRYANJHPI-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO C[C@@H](CC(=O)NC1CC2(CCC2)C1)n1cc[nH+]c1 ZINC000652968491 411378435 /nfs/dbraw/zinc/37/84/35/411378435.db2.gz UDFKDDKVJGICEA-NSHDSACASA-N 1 2 247.342 2.283 20 0 BEADLO C[C@H](CC(=O)NC1CC2(CCC2)C1)n1cc[nH+]c1 ZINC000652968490 411378493 /nfs/dbraw/zinc/37/84/93/411378493.db2.gz UDFKDDKVJGICEA-LLVKDONJSA-N 1 2 247.342 2.283 20 0 BEADLO CC1=CC[N@H+](Cc2nc(C3CC3)no2)CC1 ZINC000270096014 168116338 /nfs/dbraw/zinc/11/63/38/168116338.db2.gz BEGRGJQQGYGEJW-UHFFFAOYSA-N 1 2 219.288 2.099 20 0 BEADLO CC1=CC[N@@H+](Cc2nc(C3CC3)no2)CC1 ZINC000270096014 168116341 /nfs/dbraw/zinc/11/63/41/168116341.db2.gz BEGRGJQQGYGEJW-UHFFFAOYSA-N 1 2 219.288 2.099 20 0 BEADLO CC(C)(C(=O)NC1CC2(CCC2)C1)c1c[nH]c[nH+]1 ZINC000652969427 411380438 /nfs/dbraw/zinc/38/04/38/411380438.db2.gz ALMOBSYAARDNCX-UHFFFAOYSA-N 1 2 247.342 2.136 20 0 BEADLO CCC(=CC(=O)N(C)Cc1[nH+]ccn1C)CC ZINC000128342816 168193460 /nfs/dbraw/zinc/19/34/60/168193460.db2.gz BQNJLMAETHUJCW-UHFFFAOYSA-N 1 2 235.331 2.125 20 0 BEADLO CCC(=CC(=O)N[C@@H](C)Cn1cc[nH+]c1)CC ZINC000268394480 168193922 /nfs/dbraw/zinc/19/39/22/168193922.db2.gz DMKLGXKPZSLNLW-NSHDSACASA-N 1 2 235.331 2.134 20 0 BEADLO CCC(=CC(=O)NCc1[nH+]ccn1CC)CC ZINC000295722655 168194049 /nfs/dbraw/zinc/19/40/49/168194049.db2.gz KUXARHXREKBUCV-UHFFFAOYSA-N 1 2 235.331 2.266 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)CC1CC(C)(C)C1 ZINC000339874381 411391138 /nfs/dbraw/zinc/39/11/38/411391138.db2.gz VRCQAGRIZRNKOH-UHFFFAOYSA-N 1 2 249.358 2.205 20 0 BEADLO CCC(C)(C)C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000102638902 168261826 /nfs/dbraw/zinc/26/18/26/168261826.db2.gz HNRVYFWFUSDFFL-UHFFFAOYSA-N 1 2 249.358 2.483 20 0 BEADLO CCC(C)(C)C(=O)NCc1c[nH+]ccc1OC ZINC000294347501 168266654 /nfs/dbraw/zinc/26/66/54/168266654.db2.gz AYMRSMVAARWYOM-UHFFFAOYSA-N 1 2 236.315 2.143 20 0 BEADLO CCC(C)(C)N(C)C(=O)[C@H]1CCc2[nH+]ccn2C1 ZINC000364958686 168284691 /nfs/dbraw/zinc/28/46/91/168284691.db2.gz QVMQLLVZWDZNSU-NSHDSACASA-N 1 2 249.358 2.093 20 0 BEADLO CCC(C)(C)NC(=O)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000336533031 168295316 /nfs/dbraw/zinc/29/53/16/168295316.db2.gz MUIILAGLIOOGTQ-VIFPVBQESA-N 1 2 235.331 2.134 20 0 BEADLO CCC(C)(C)NC(=O)[C@H]1CCCc2[nH]c[nH+]c21 ZINC000336533031 168295318 /nfs/dbraw/zinc/29/53/18/168295318.db2.gz MUIILAGLIOOGTQ-VIFPVBQESA-N 1 2 235.331 2.134 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@@H]2CCCc3occc32)n1 ZINC000657308222 411458241 /nfs/dbraw/zinc/45/82/41/411458241.db2.gz YCCARMCSBRZEHK-LLVKDONJSA-N 1 2 231.299 2.478 20 0 BEADLO CCC1(CNC(=O)[C@H](C)Cc2c[nH+]c[nH]2)CCC1 ZINC000654877612 411459605 /nfs/dbraw/zinc/45/96/05/411459605.db2.gz YOXNVJMTGWEACS-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO CCC1(CNC(=O)[C@H](C)Cc2c[nH]c[nH+]2)CCC1 ZINC000654877612 411459607 /nfs/dbraw/zinc/45/96/07/411459607.db2.gz YOXNVJMTGWEACS-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO Nc1ccc(NC(=O)[C@@H]2C[C@H]2C2CCCC2)c[nH+]1 ZINC000653048573 411404429 /nfs/dbraw/zinc/40/44/29/411404429.db2.gz JMFZDCPAGSIZNW-NWDGAFQWSA-N 1 2 245.326 2.259 20 0 BEADLO CCOC[C@@H]1CCCC[N@@H+]1CC(F)F ZINC000657140207 411409723 /nfs/dbraw/zinc/40/97/23/411409723.db2.gz DFWLUPZQBHCKSE-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CCOC[C@@H]1CCCC[N@H+]1CC(F)F ZINC000657140207 411409725 /nfs/dbraw/zinc/40/97/25/411409725.db2.gz DFWLUPZQBHCKSE-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO COc1cccc(NCc2[nH]cc(C)[nH+]2)c1 ZINC000657319924 411461904 /nfs/dbraw/zinc/46/19/04/411461904.db2.gz PUYCSECQQULPPV-UHFFFAOYSA-N 1 2 217.272 2.339 20 0 BEADLO OC1(C[N@@H+]2CCCC(F)(F)C2)CCCC1 ZINC000405069661 411415496 /nfs/dbraw/zinc/41/54/96/411415496.db2.gz GEEMZCFTKRTWFX-UHFFFAOYSA-N 1 2 219.275 2.023 20 0 BEADLO OC1(C[N@H+]2CCCC(F)(F)C2)CCCC1 ZINC000405069661 411415498 /nfs/dbraw/zinc/41/54/98/411415498.db2.gz GEEMZCFTKRTWFX-UHFFFAOYSA-N 1 2 219.275 2.023 20 0 BEADLO Cc1cc(N)nc(S[C@H]2COC(C)(C)C2)[nH+]1 ZINC000657237705 411423405 /nfs/dbraw/zinc/42/34/05/411423405.db2.gz UUACVOQCESTJFX-MRVPVSSYSA-N 1 2 239.344 2.027 20 0 BEADLO CC(C)[NH+](Cc1nnn(C(C)(C)C)n1)C(C)C ZINC000653596794 411430419 /nfs/dbraw/zinc/43/04/19/411430419.db2.gz NCYJZLVCLABFSA-UHFFFAOYSA-N 1 2 239.367 2.047 20 0 BEADLO c1c[nH+]c(COCCOCc2ccccc2)[nH]1 ZINC000657256093 411430541 /nfs/dbraw/zinc/43/05/41/411430541.db2.gz VNQIBVIHICZYHN-UHFFFAOYSA-N 1 2 232.283 2.143 20 0 BEADLO CO[C@H](Cn1cc[nH+]c1)C1CCCCC1 ZINC000657254959 411435472 /nfs/dbraw/zinc/43/54/72/411435472.db2.gz FZNLGZGNRILKKV-GFCCVEGCSA-N 1 2 208.305 2.478 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H](C)CC(C)C ZINC000274326483 411438029 /nfs/dbraw/zinc/43/80/29/411438029.db2.gz YJECBOIWWUOJMI-SECBINFHSA-N 1 2 223.320 2.017 20 0 BEADLO CCc1[nH+]c(C)ccc1OC[C@@H](C)OC ZINC000276422268 411441888 /nfs/dbraw/zinc/44/18/88/411441888.db2.gz AUSIDYQIHAPJOR-SNVBAGLBSA-N 1 2 209.289 2.366 20 0 BEADLO Fc1cccnc1C[NH2+][C@H]1CCCn2ccnc21 ZINC000655737388 411444260 /nfs/dbraw/zinc/44/42/60/411444260.db2.gz MZBQJWPBBLLXOX-NSHDSACASA-N 1 2 246.289 2.042 20 0 BEADLO Fc1cccnc1CN[C@H]1CCCn2cc[nH+]c21 ZINC000655737388 411444262 /nfs/dbraw/zinc/44/42/62/411444262.db2.gz MZBQJWPBBLLXOX-NSHDSACASA-N 1 2 246.289 2.042 20 0 BEADLO Cc1nn(C)c(C)c1N[C@H]1CCCn2cc[nH+]c21 ZINC000655748173 411447795 /nfs/dbraw/zinc/44/77/95/411447795.db2.gz RNQFIVPEZSYIBN-NSHDSACASA-N 1 2 245.330 2.180 20 0 BEADLO Fc1ccccc1C[NH2+]Cc1cc2n(n1)CCC2 ZINC000657289195 411450361 /nfs/dbraw/zinc/45/03/61/411450361.db2.gz DFPQOHSEHINFAY-UHFFFAOYSA-N 1 2 245.301 2.258 20 0 BEADLO COC(=O)[C@@H](c1ccsc1)[N@H+](C)CC1CC1 ZINC000280187410 411451832 /nfs/dbraw/zinc/45/18/32/411451832.db2.gz ZQLXIEQKJLCAHC-LLVKDONJSA-N 1 2 239.340 2.304 20 0 BEADLO COC(=O)[C@@H](c1ccsc1)[N@@H+](C)CC1CC1 ZINC000280187410 411451836 /nfs/dbraw/zinc/45/18/36/411451836.db2.gz ZQLXIEQKJLCAHC-LLVKDONJSA-N 1 2 239.340 2.304 20 0 BEADLO Cc1nc(N2CCOC[C@@H](C3CCC3)C2)cc[nH+]1 ZINC000292149629 411468787 /nfs/dbraw/zinc/46/87/87/411468787.db2.gz CDCPOVIIKSEQIS-ZDUSSCGKSA-N 1 2 247.342 2.038 20 0 BEADLO Cc1c[nH]c(C[NH2+]Cc2ccc(F)cc2F)n1 ZINC000657336477 411471567 /nfs/dbraw/zinc/47/15/67/411471567.db2.gz SLNPKNUJABBGIM-UHFFFAOYSA-N 1 2 237.253 2.286 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1nc(C)oc1C ZINC000659841327 411472628 /nfs/dbraw/zinc/47/26/28/411472628.db2.gz QIDTYIJOUHQPDR-CABZTGNLSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1nc(C)oc1C ZINC000659841327 411472630 /nfs/dbraw/zinc/47/26/30/411472630.db2.gz QIDTYIJOUHQPDR-CABZTGNLSA-N 1 2 238.331 2.291 20 0 BEADLO Cc1ncsc1C[N@@H+](C)Cc1conc1C ZINC000295438438 411477600 /nfs/dbraw/zinc/47/76/00/411477600.db2.gz UJKFEUMYSDHMPE-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1ncsc1C[N@H+](C)Cc1conc1C ZINC000295438438 411477603 /nfs/dbraw/zinc/47/76/03/411477603.db2.gz UJKFEUMYSDHMPE-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO COc1cc(C[N@H+](C)Cc2ccoc2C)on1 ZINC000659853392 411478068 /nfs/dbraw/zinc/47/80/68/411478068.db2.gz RFKZRVPFNJDMKZ-UHFFFAOYSA-N 1 2 236.271 2.217 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2ccoc2C)on1 ZINC000659853392 411478071 /nfs/dbraw/zinc/47/80/71/411478071.db2.gz RFKZRVPFNJDMKZ-UHFFFAOYSA-N 1 2 236.271 2.217 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@@H]2COCc3ccccc32)n1 ZINC000657493564 411533656 /nfs/dbraw/zinc/53/36/56/411533656.db2.gz FFIFMSUXEDDCLM-CYBMUJFWSA-N 1 2 243.310 2.079 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@@H](n3ccnc3)C2)co1 ZINC000659882538 411490255 /nfs/dbraw/zinc/49/02/55/411490255.db2.gz ISKSNBIVNWFLGN-CYBMUJFWSA-N 1 2 246.314 2.017 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@@H](n3ccnc3)C2)co1 ZINC000659882538 411490257 /nfs/dbraw/zinc/49/02/57/411490257.db2.gz ISKSNBIVNWFLGN-CYBMUJFWSA-N 1 2 246.314 2.017 20 0 BEADLO Cc1cncc(C[NH2+]Cc2nccn2C(C)C)c1 ZINC000657418027 411501038 /nfs/dbraw/zinc/50/10/38/411501038.db2.gz HNACFPPXVUWRHS-UHFFFAOYSA-N 1 2 244.342 2.457 20 0 BEADLO COCC[C@@H]([NH2+]Cc1nc(C)c[nH]1)c1ccco1 ZINC000657429151 411507039 /nfs/dbraw/zinc/50/70/39/411507039.db2.gz FKROLDPRWDKPHJ-LLVKDONJSA-N 1 2 249.314 2.179 20 0 BEADLO COCc1csc(C[NH2+]CC(F)F)c1 ZINC000657464664 411518537 /nfs/dbraw/zinc/51/85/37/411518537.db2.gz QIJRRSDNUHPJJK-UHFFFAOYSA-N 1 2 221.272 2.249 20 0 BEADLO CC(C)n1cc[nH+]c1CNCC(C)(F)F ZINC000657474869 411524180 /nfs/dbraw/zinc/52/41/80/411524180.db2.gz GKZJPIKUMBTCKF-UHFFFAOYSA-N 1 2 217.263 2.209 20 0 BEADLO CCCn1nccc1C[NH2+][C@@H](CC)C(F)F ZINC000657477582 411525689 /nfs/dbraw/zinc/52/56/89/411525689.db2.gz WHCRXMXAWFLWFX-JTQLQIEISA-N 1 2 231.290 2.426 20 0 BEADLO Cc1[nH]c(CN[C@@H]2C[C@H](C)n3ccnc32)[nH+]c1C ZINC000657483604 411528597 /nfs/dbraw/zinc/52/85/97/411528597.db2.gz MIZNYYPUSWIXBF-GZMMTYOYSA-N 1 2 245.330 2.019 20 0 BEADLO COc1c(C)cccc1C[NH2+]Cc1cocn1 ZINC000655833136 411529056 /nfs/dbraw/zinc/52/90/56/411529056.db2.gz KRDSPUOYHPDEIZ-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO CC[N@@H+]1CCOC[C@H]1CC(=O)c1cccs1 ZINC000119540059 170003354 /nfs/dbraw/zinc/00/33/54/170003354.db2.gz HDUVQONSVUWRAA-SNVBAGLBSA-N 1 2 239.340 2.042 20 0 BEADLO CC[N@H+]1CCOC[C@H]1CC(=O)c1cccs1 ZINC000119540059 170003355 /nfs/dbraw/zinc/00/33/55/170003355.db2.gz HDUVQONSVUWRAA-SNVBAGLBSA-N 1 2 239.340 2.042 20 0 BEADLO Cc1nc(C[NH2+]Cc2ccoc2C)[nH]c1C ZINC000657326673 411466351 /nfs/dbraw/zinc/46/63/51/411466351.db2.gz PRGXTVYENFGHCX-UHFFFAOYSA-N 1 2 219.288 2.218 20 0 BEADLO Cc1[nH]c(CNCc2ccoc2C)[nH+]c1C ZINC000657326673 411466356 /nfs/dbraw/zinc/46/63/56/411466356.db2.gz PRGXTVYENFGHCX-UHFFFAOYSA-N 1 2 219.288 2.218 20 0 BEADLO CC[N@@H+]1C[C@H]([NH2+]CCCCOC(C)C)[C@@H](C)C1 ZINC000361030921 170035566 /nfs/dbraw/zinc/03/55/66/170035566.db2.gz LUGIRRALJDNLBR-KBPBESRZSA-N 1 2 242.407 2.121 20 0 BEADLO CCNC(=O)COc1cc(C)[nH+]c2ccccc21 ZINC000192192390 170067557 /nfs/dbraw/zinc/06/75/57/170067557.db2.gz BDEZWRZXYNRKLW-UHFFFAOYSA-N 1 2 244.294 2.058 20 0 BEADLO CO[C@H](C[N@H+](C)Cc1ncc[nH]1)C1CCCC1 ZINC000660142474 411544419 /nfs/dbraw/zinc/54/44/19/411544419.db2.gz ZQZJFGJLTAERFM-GFCCVEGCSA-N 1 2 237.347 2.047 20 0 BEADLO CO[C@H](C[N@@H+](C)Cc1ncc[nH]1)C1CCCC1 ZINC000660142474 411544421 /nfs/dbraw/zinc/54/44/21/411544421.db2.gz ZQZJFGJLTAERFM-GFCCVEGCSA-N 1 2 237.347 2.047 20 0 BEADLO Cc1c[nH]c(CNc2n[nH]c(C(C)C)c2C)[nH+]1 ZINC000657499004 411535925 /nfs/dbraw/zinc/53/59/25/411535925.db2.gz REJZJHVJLRGHLK-UHFFFAOYSA-N 1 2 233.319 2.485 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@H](C)[C@H](F)C2)nc(C)n1 ZINC000660220438 411555013 /nfs/dbraw/zinc/55/50/13/411555013.db2.gz IKLMVONHSAFLAV-TVQRCGJNSA-N 1 2 237.322 2.273 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)nc(C)n1 ZINC000660220438 411555015 /nfs/dbraw/zinc/55/50/15/411555015.db2.gz IKLMVONHSAFLAV-TVQRCGJNSA-N 1 2 237.322 2.273 20 0 BEADLO CCCc1nc(C)c(CN(C)Cc2[nH]cc[nH+]2)o1 ZINC000660142110 411544991 /nfs/dbraw/zinc/54/49/91/411544991.db2.gz NXGSLZXOEMJKLN-UHFFFAOYSA-N 1 2 248.330 2.291 20 0 BEADLO COC[C@@H](C)Nc1c[nH+]cc2c1CCCC2 ZINC000657532658 411544993 /nfs/dbraw/zinc/54/49/93/411544993.db2.gz DTBPAZNQZINDLQ-SNVBAGLBSA-N 1 2 220.316 2.407 20 0 BEADLO COC[C@H](C)Nc1c[nH+]cc2c1CCCC2 ZINC000657532656 411545222 /nfs/dbraw/zinc/54/52/22/411545222.db2.gz DTBPAZNQZINDLQ-JTQLQIEISA-N 1 2 220.316 2.407 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1cccc2[nH]ccc21 ZINC000128604863 170214493 /nfs/dbraw/zinc/21/44/93/170214493.db2.gz OYESOUSSWSMIAR-UHFFFAOYSA-N 1 2 246.310 2.163 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1cccc2[nH]ccc21 ZINC000128604863 170214494 /nfs/dbraw/zinc/21/44/94/170214494.db2.gz OYESOUSSWSMIAR-UHFFFAOYSA-N 1 2 246.310 2.163 20 0 BEADLO CCOC(=O)C[N@H+](C)[C@@H](C)c1cccs1 ZINC000042227127 170216146 /nfs/dbraw/zinc/21/61/46/170216146.db2.gz ZDYDRAFGFKHEON-VIFPVBQESA-N 1 2 227.329 2.304 20 0 BEADLO CCOC(=O)C[N@@H+](C)[C@@H](C)c1cccs1 ZINC000042227127 170216147 /nfs/dbraw/zinc/21/61/47/170216147.db2.gz ZDYDRAFGFKHEON-VIFPVBQESA-N 1 2 227.329 2.304 20 0 BEADLO CCOC(=O)C[NH2+][C@@H]1CCC[C@@H]1c1ccccc1 ZINC000133497003 170226161 /nfs/dbraw/zinc/22/61/61/170226161.db2.gz LJMKGKDCPHFXQJ-ZIAGYGMSSA-N 1 2 247.338 2.475 20 0 BEADLO C[C@H]([NH2+]Cc1cnn2c1CCC2)c1cscn1 ZINC000657600829 411558434 /nfs/dbraw/zinc/55/84/34/411558434.db2.gz VIJXELFHLYXTPF-VIFPVBQESA-N 1 2 248.355 2.137 20 0 BEADLO CCOC(=O)[C@@H](CC)[N@H+](C)Cc1ccco1 ZINC000077901429 170249776 /nfs/dbraw/zinc/24/97/76/170249776.db2.gz YMRYLTIKCQUBMR-LLVKDONJSA-N 1 2 225.288 2.053 20 0 BEADLO CCOC(=O)[C@@H](CC)[N@@H+](C)Cc1ccco1 ZINC000077901429 170249778 /nfs/dbraw/zinc/24/97/78/170249778.db2.gz YMRYLTIKCQUBMR-LLVKDONJSA-N 1 2 225.288 2.053 20 0 BEADLO COc1cncc(C[NH2+][C@H](C)c2cscn2)c1 ZINC000657599943 411558459 /nfs/dbraw/zinc/55/84/59/411558459.db2.gz FFYDGIIQWBBMGA-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO Cc1ccc(O)c(C[NH2+][C@H](C)c2cscn2)n1 ZINC000657599476 411558718 /nfs/dbraw/zinc/55/87/18/411558718.db2.gz HNDYIUIDPAHLJD-SECBINFHSA-N 1 2 249.339 2.403 20 0 BEADLO COc1cncc(C[NH2+][C@@H](C)c2cscn2)c1 ZINC000657599944 411558763 /nfs/dbraw/zinc/55/87/63/411558763.db2.gz FFYDGIIQWBBMGA-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO CCOC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccco1 ZINC000071928394 170256947 /nfs/dbraw/zinc/25/69/47/170256947.db2.gz MEZCIQXJZAUUFE-LBPRGKRZSA-N 1 2 237.299 2.197 20 0 BEADLO CCOC(=O)[C@@H]1CCCC[N@H+]1Cc1ccco1 ZINC000071928394 170256948 /nfs/dbraw/zinc/25/69/48/170256948.db2.gz MEZCIQXJZAUUFE-LBPRGKRZSA-N 1 2 237.299 2.197 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@@H]1CCc2ccccc2C1 ZINC000049371571 170268321 /nfs/dbraw/zinc/26/83/21/170268321.db2.gz JFCMNFRBDVBLKX-SMDDNHRTSA-N 1 2 247.338 2.085 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H](C)O[C@H](C)[C@H]2C)c(C)o1 ZINC000660373883 411574288 /nfs/dbraw/zinc/57/42/88/411574288.db2.gz CQJASJRVNQTQSW-IVZWLZJFSA-N 1 2 238.331 2.289 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H](C)O[C@H](C)[C@H]2C)c(C)o1 ZINC000660373883 411574289 /nfs/dbraw/zinc/57/42/89/411574289.db2.gz CQJASJRVNQTQSW-IVZWLZJFSA-N 1 2 238.331 2.289 20 0 BEADLO CCOC1CC2(C1)CCN(c1cc[nH+]c(C)n1)C2 ZINC000286212822 170333023 /nfs/dbraw/zinc/33/30/23/170333023.db2.gz BQJBNRNNVYOAKH-UHFFFAOYSA-N 1 2 247.342 2.180 20 0 BEADLO CCc1nocc1C[N@@H+]1C[C@H](C)O[C@H](C)[C@@H]1C ZINC000660375859 411574924 /nfs/dbraw/zinc/57/49/24/411574924.db2.gz ZNVLETMTJMZVCF-GARJFASQSA-N 1 2 238.331 2.235 20 0 BEADLO CCc1nocc1C[N@H+]1C[C@H](C)O[C@H](C)[C@@H]1C ZINC000660375859 411574925 /nfs/dbraw/zinc/57/49/25/411574925.db2.gz ZNVLETMTJMZVCF-GARJFASQSA-N 1 2 238.331 2.235 20 0 BEADLO CCOCC(C)(C)CNc1cc(C)[nH+]cn1 ZINC000309283748 170352146 /nfs/dbraw/zinc/35/21/46/170352146.db2.gz HIXFMNSFEISUBX-UHFFFAOYSA-N 1 2 223.320 2.260 20 0 BEADLO CCOCC[N@H+](C)[C@H](C)c1ncc(C)o1 ZINC000357524708 170391699 /nfs/dbraw/zinc/39/16/99/170391699.db2.gz CDNLCWWWJDCLSG-SNVBAGLBSA-N 1 2 212.293 2.012 20 0 BEADLO CCOCC[N@@H+](C)[C@H](C)c1ncc(C)o1 ZINC000357524708 170391701 /nfs/dbraw/zinc/39/17/01/170391701.db2.gz CDNLCWWWJDCLSG-SNVBAGLBSA-N 1 2 212.293 2.012 20 0 BEADLO CCc1nnc([C@H](C)[N@@H+]2CCC(C)=C(C)C2)[nH]1 ZINC000660454643 411587137 /nfs/dbraw/zinc/58/71/37/411587137.db2.gz AEFJWSIESIWBSS-NSHDSACASA-N 1 2 234.347 2.470 20 0 BEADLO CCc1nnc([C@H](C)[N@H+]2CCC(C)=C(C)C2)[nH]1 ZINC000660454643 411587138 /nfs/dbraw/zinc/58/71/38/411587138.db2.gz AEFJWSIESIWBSS-NSHDSACASA-N 1 2 234.347 2.470 20 0 BEADLO Cc1cccc(C[NH2+]Cc2ncccn2)c1C ZINC000657734947 411587645 /nfs/dbraw/zinc/58/76/45/411587645.db2.gz XIYFXSKYVHFVPO-UHFFFAOYSA-N 1 2 227.311 2.383 20 0 BEADLO COCc1ccc(C[NH2+][C@H](C)c2nccn2C)o1 ZINC000657793224 411598599 /nfs/dbraw/zinc/59/85/99/411598599.db2.gz GYTDHFVSOMUZFI-SNVBAGLBSA-N 1 2 249.314 2.010 20 0 BEADLO CC(C)=CCC[N@@H+]1CCOCC(F)(F)C1 ZINC000660561414 411600648 /nfs/dbraw/zinc/60/06/48/411600648.db2.gz VPSYCIXAVZFHBX-UHFFFAOYSA-N 1 2 219.275 2.310 20 0 BEADLO CC(C)=CCC[N@H+]1CCOCC(F)(F)C1 ZINC000660561414 411600649 /nfs/dbraw/zinc/60/06/49/411600649.db2.gz VPSYCIXAVZFHBX-UHFFFAOYSA-N 1 2 219.275 2.310 20 0 BEADLO Cc1nc(C[NH2+][C@@H]2CCc3c2cccc3O)co1 ZINC000660649989 411613135 /nfs/dbraw/zinc/61/31/35/411613135.db2.gz OTWMPUMTLPNYLU-CYBMUJFWSA-N 1 2 244.294 2.466 20 0 BEADLO CC(C)C[N@H+](C)[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000660761120 411622262 /nfs/dbraw/zinc/62/22/62/411622262.db2.gz OGZFUTMZRNTHIW-CYBMUJFWSA-N 1 2 244.342 2.482 20 0 BEADLO CC(C)C[N@@H+](C)[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000660761120 411622265 /nfs/dbraw/zinc/62/22/65/411622265.db2.gz OGZFUTMZRNTHIW-CYBMUJFWSA-N 1 2 244.342 2.482 20 0 BEADLO CC(C)C[N@H+](C)[C@@H](c1nc[nH]n1)c1ccccc1 ZINC000660761120 411622266 /nfs/dbraw/zinc/62/22/66/411622266.db2.gz OGZFUTMZRNTHIW-CYBMUJFWSA-N 1 2 244.342 2.482 20 0 BEADLO CC(C)C[N@@H+](C)[C@@H](c1nc[nH]n1)c1ccccc1 ZINC000660761120 411622268 /nfs/dbraw/zinc/62/22/68/411622268.db2.gz OGZFUTMZRNTHIW-CYBMUJFWSA-N 1 2 244.342 2.482 20 0 BEADLO C[C@H]1CCC[C@@H](C[N@H+](C)Cc2n[nH]c(=O)o2)C1 ZINC000660843634 411653229 /nfs/dbraw/zinc/65/32/29/411653229.db2.gz BKKPLWCESVVJKC-VHSXEESVSA-N 1 2 239.319 2.033 20 0 BEADLO C[C@H]1CCC[C@@H](C[N@@H+](C)Cc2n[nH]c(=O)o2)C1 ZINC000660843634 411653232 /nfs/dbraw/zinc/65/32/32/411653232.db2.gz BKKPLWCESVVJKC-VHSXEESVSA-N 1 2 239.319 2.033 20 0 BEADLO C[N@H+](Cc1n[nH]c(=O)o1)[C@H]1C=CCCCCC1 ZINC000660843058 411654336 /nfs/dbraw/zinc/65/43/36/411654336.db2.gz SZHNSFROINDHIB-JTQLQIEISA-N 1 2 237.303 2.096 20 0 BEADLO C[N@@H+](Cc1n[nH]c(=O)o1)[C@H]1C=CCCCCC1 ZINC000660843058 411654339 /nfs/dbraw/zinc/65/43/39/411654339.db2.gz SZHNSFROINDHIB-JTQLQIEISA-N 1 2 237.303 2.096 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C[N@H+](C)Cc1n[nH]c(=O)o1 ZINC000660844601 411656701 /nfs/dbraw/zinc/65/67/01/411656701.db2.gz QNSKJTCRSMFRKA-NXEZZACHSA-N 1 2 239.319 2.033 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C[N@@H+](C)Cc1n[nH]c(=O)o1 ZINC000660844601 411656703 /nfs/dbraw/zinc/65/67/03/411656703.db2.gz QNSKJTCRSMFRKA-NXEZZACHSA-N 1 2 239.319 2.033 20 0 BEADLO Cc1nc(C[N@H+]2C[C@@H](C)OC3(CCC3)C2)co1 ZINC000660907355 411667620 /nfs/dbraw/zinc/66/76/20/411667620.db2.gz XSXPJWWNGMCUAK-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@@H](C)OC3(CCC3)C2)co1 ZINC000660907355 411667623 /nfs/dbraw/zinc/66/76/23/411667623.db2.gz XSXPJWWNGMCUAK-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO C(c1nc(C2CC2)no1)[N@@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660927516 411678137 /nfs/dbraw/zinc/67/81/37/411678137.db2.gz COQXNJOCCCECTF-QWRGUYRKSA-N 1 2 233.315 2.321 20 0 BEADLO C(c1nc(C2CC2)no1)[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660927516 411678140 /nfs/dbraw/zinc/67/81/40/411678140.db2.gz COQXNJOCCCECTF-QWRGUYRKSA-N 1 2 233.315 2.321 20 0 BEADLO CC(=O)c1cc(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)on1 ZINC000660930393 411681147 /nfs/dbraw/zinc/68/11/47/411681147.db2.gz GRZRRXVVOAZWAO-GWCFXTLKSA-N 1 2 234.299 2.252 20 0 BEADLO CC(=O)c1cc(C[N@H+]2C[C@@H]3CCCC[C@@H]32)on1 ZINC000660930393 411681151 /nfs/dbraw/zinc/68/11/51/411681151.db2.gz GRZRRXVVOAZWAO-GWCFXTLKSA-N 1 2 234.299 2.252 20 0 BEADLO Cn1nc(C2CC2)nc1C[N@@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660935004 411684575 /nfs/dbraw/zinc/68/45/75/411684575.db2.gz XNIGSVWDKIKWAX-RYUDHWBXSA-N 1 2 246.358 2.067 20 0 BEADLO Cn1nc(C2CC2)nc1C[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660935004 411684580 /nfs/dbraw/zinc/68/45/80/411684580.db2.gz XNIGSVWDKIKWAX-RYUDHWBXSA-N 1 2 246.358 2.067 20 0 BEADLO Cc1nc(CN(C)Cc2c[nH+]c[nH]2)sc1C ZINC000661085323 411697827 /nfs/dbraw/zinc/69/78/27/411697827.db2.gz LFKHYGNNRUUBTG-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1nc(CN(C)Cc2c[nH]c[nH+]2)sc1C ZINC000661085323 411697830 /nfs/dbraw/zinc/69/78/30/411697830.db2.gz LFKHYGNNRUUBTG-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Clc1cnc(N2CCc3[nH+]c[nH]c3C2)s1 ZINC000663920123 411769578 /nfs/dbraw/zinc/76/95/78/411769578.db2.gz SEEABNRSBSKTOB-UHFFFAOYSA-N 1 2 240.719 2.082 20 0 BEADLO c1coc(C2CC[NH+](Cc3ncc[nH]3)CC2)c1 ZINC000661162093 411723532 /nfs/dbraw/zinc/72/35/32/411723532.db2.gz GNMYNBCUDYECCS-UHFFFAOYSA-N 1 2 231.299 2.382 20 0 BEADLO Cc1ccc(N2CCCC[C@@H]2c2[nH]cc[nH+]2)nn1 ZINC000663691897 411724412 /nfs/dbraw/zinc/72/44/12/411724412.db2.gz CAKPYOOIWWXONC-LLVKDONJSA-N 1 2 243.314 2.240 20 0 BEADLO CN(c1cccc[nH+]1)[C@H](CO)Cc1ccccc1 ZINC000664131645 411864069 /nfs/dbraw/zinc/86/40/69/411864069.db2.gz SHKGPNDGYYKHMG-AWEZNQCLSA-N 1 2 242.322 2.121 20 0 BEADLO CCc1ccc(C[NH+]2C[C@@H](C)C(=O)[C@H](C)C2)nc1 ZINC000661539798 411797922 /nfs/dbraw/zinc/79/79/22/411797922.db2.gz TXRRVGYUHIRBEQ-VXGBXAGGSA-N 1 2 246.354 2.301 20 0 BEADLO Cc1ncsc1C[NH+]1C[C@@H](C)C(=O)[C@H](C)C1 ZINC000661538354 411798574 /nfs/dbraw/zinc/79/85/74/411798574.db2.gz ICPUNACGHOVHKO-RKDXNWHRSA-N 1 2 238.356 2.108 20 0 BEADLO Cc1ncc(C[NH+]2C[C@@H](C)C(=O)[C@H](C)C2)s1 ZINC000661545061 411799619 /nfs/dbraw/zinc/79/96/19/411799619.db2.gz PYFMKZQDAHQGEZ-RKDXNWHRSA-N 1 2 238.356 2.108 20 0 BEADLO Cc1cncc(C[NH+]2C[C@@H](C)C(=O)[C@H](C)C2)c1 ZINC000661544630 411800104 /nfs/dbraw/zinc/80/01/04/411800104.db2.gz IFQWWBQVFCMZRT-VXGBXAGGSA-N 1 2 232.327 2.047 20 0 BEADLO C[C@@H]1C[NH+](Cc2cccc(F)c2)C[C@@H](C)C1=O ZINC000661553320 411800656 /nfs/dbraw/zinc/80/06/56/411800656.db2.gz IFAXMYXOTINNPI-GHMZBOCLSA-N 1 2 235.302 2.483 20 0 BEADLO Cc1cccc(C)c1C[N@@H+](C)Cc1cn(C)nn1 ZINC000661747626 411865424 /nfs/dbraw/zinc/86/54/24/411865424.db2.gz RZUPARHMJJTVTO-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cccc(C)c1C[N@H+](C)Cc1cn(C)nn1 ZINC000661747626 411865430 /nfs/dbraw/zinc/86/54/30/411865430.db2.gz RZUPARHMJJTVTO-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO CC(C)(C)n1cc(COc2cc[nH+]cc2)nn1 ZINC000664016475 411810613 /nfs/dbraw/zinc/81/06/13/411810613.db2.gz OULGBXOIAVSCHS-UHFFFAOYSA-N 1 2 232.287 2.007 20 0 BEADLO COCCCOc1ccc2c(c1)[nH+]c(C)n2C ZINC000664046714 411826677 /nfs/dbraw/zinc/82/66/77/411826677.db2.gz NFYPJUKMPTZJRD-UHFFFAOYSA-N 1 2 234.299 2.297 20 0 BEADLO Cc1[nH+]c2cc(OCCC[C@@H](C)O)ccc2n1C ZINC000664046426 411827191 /nfs/dbraw/zinc/82/71/91/411827191.db2.gz DLBVSHCWAQKGOR-SNVBAGLBSA-N 1 2 248.326 2.422 20 0 BEADLO CCc1cnc(C[N@H+](C)CC2=CCCOC2)o1 ZINC000661656016 411830658 /nfs/dbraw/zinc/83/06/58/411830658.db2.gz VLGUSWXVZQUKNB-UHFFFAOYSA-N 1 2 236.315 2.016 20 0 BEADLO CCc1cnc(C[N@@H+](C)CC2=CCCOC2)o1 ZINC000661656016 411830661 /nfs/dbraw/zinc/83/06/61/411830661.db2.gz VLGUSWXVZQUKNB-UHFFFAOYSA-N 1 2 236.315 2.016 20 0 BEADLO Nc1[nH+]cnc(N2C[C@@H]3CCCC[C@@H]32)c1Cl ZINC000664082865 411845418 /nfs/dbraw/zinc/84/54/18/411845418.db2.gz LDRIICYARBVPJN-YUMQZZPRSA-N 1 2 238.722 2.091 20 0 BEADLO Nc1nc[nH+]c(N2C[C@@H]3CCCC[C@@H]32)c1Cl ZINC000664082865 411845421 /nfs/dbraw/zinc/84/54/21/411845421.db2.gz LDRIICYARBVPJN-YUMQZZPRSA-N 1 2 238.722 2.091 20 0 BEADLO CC[C@H](C)CCNc1nc(N(C)C)nc(C)[nH+]1 ZINC000664229822 411890997 /nfs/dbraw/zinc/89/09/97/411890997.db2.gz HYJBBYJJCXQTPM-VIFPVBQESA-N 1 2 237.351 2.094 20 0 BEADLO CC[C@H](C)CCNc1nc(C)[nH+]c(N(C)C)n1 ZINC000664229822 411891001 /nfs/dbraw/zinc/89/10/01/411891001.db2.gz HYJBBYJJCXQTPM-VIFPVBQESA-N 1 2 237.351 2.094 20 0 BEADLO OC/C=C/CNc1cc(C(F)(F)F)cc[nH+]1 ZINC000664235896 411891842 /nfs/dbraw/zinc/89/18/42/411891842.db2.gz KQNIXMPSYKTNHD-OWOJBTEDSA-N 1 2 232.205 2.061 20 0 BEADLO Cc1cc(N[C@@H](C)c2cscn2)nc[nH+]1 ZINC000664260386 411902248 /nfs/dbraw/zinc/90/22/48/411902248.db2.gz JDYBBGYJUIXWFB-QMMMGPOBSA-N 1 2 220.301 2.415 20 0 BEADLO CC(C)c1cc(N2C[C@@H](C)C(=O)[C@H](C)C2)nc[nH+]1 ZINC000664308788 411917837 /nfs/dbraw/zinc/91/78/37/411917837.db2.gz TYCYGOSQCMGCFY-GHMZBOCLSA-N 1 2 247.342 2.261 20 0 BEADLO Cc1nc(NC[C@@H]2CCC[C@@H](C)O2)cc[nH+]1 ZINC000664393785 411940931 /nfs/dbraw/zinc/94/09/31/411940931.db2.gz HSNIEZBNYFYSQI-KOLCDFICSA-N 1 2 221.304 2.155 20 0 BEADLO C[C@H](O)[C@H]1CCC[N@@H+]1Cc1ncc(Cl)s1 ZINC000661764404 411874091 /nfs/dbraw/zinc/87/40/91/411874091.db2.gz DBSKGGSWDGRACO-JGVFFNPUSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@H](O)[C@H]1CCC[N@H+]1Cc1ncc(Cl)s1 ZINC000661764404 411874095 /nfs/dbraw/zinc/87/40/95/411874095.db2.gz DBSKGGSWDGRACO-JGVFFNPUSA-N 1 2 246.763 2.142 20 0 BEADLO CCc1cc(N[C@]23C[C@H]2CCC3)nc[nH+]1 ZINC000664162099 411876444 /nfs/dbraw/zinc/87/64/44/411876444.db2.gz UKIYZQXHBHCROX-BXKDBHETSA-N 1 2 203.289 2.394 20 0 BEADLO CC[C@@H](C[C@@H](C)CO)Nc1cccc[nH+]1 ZINC000309164756 170853583 /nfs/dbraw/zinc/85/35/83/170853583.db2.gz IMSVGXNGKPKPKR-MNOVXSKESA-N 1 2 208.305 2.291 20 0 BEADLO CC[C@@H](COCC1CC1)Nc1cc(C)[nH+]cn1 ZINC000664176138 411880961 /nfs/dbraw/zinc/88/09/61/411880961.db2.gz XFGXSGVKGPTCRT-LBPRGKRZSA-N 1 2 235.331 2.402 20 0 BEADLO Cc1ccc(Cc2noc(CCCF)n2)c[nH+]1 ZINC000664768860 412019282 /nfs/dbraw/zinc/01/92/82/412019282.db2.gz KLVWYRSZLJYABL-UHFFFAOYSA-N 1 2 235.262 2.266 20 0 BEADLO Cc1cc(N2CC3(CCCC3)OC[C@H]2C)nc[nH+]1 ZINC000664529667 411978734 /nfs/dbraw/zinc/97/87/34/411978734.db2.gz CCRXAOTXKRVMTC-GFCCVEGCSA-N 1 2 247.342 2.323 20 0 BEADLO CC(C)(C)N1C[C@H](CNc2cccc[nH+]2)CC1=O ZINC000664544956 411982059 /nfs/dbraw/zinc/98/20/59/411982059.db2.gz AQEFJZRWXWGZQO-NSHDSACASA-N 1 2 247.342 2.141 20 0 BEADLO Cc1nc(N(C)C)nc(N[C@@H](C(C)C)C2CC2)[nH+]1 ZINC000664547434 411983404 /nfs/dbraw/zinc/98/34/04/411983404.db2.gz WUFDEKYBTXAEJC-NSHDSACASA-N 1 2 249.362 2.093 20 0 BEADLO Cc1nc(N[C@@H](C(C)C)C2CC2)nc(N(C)C)[nH+]1 ZINC000664547434 411983407 /nfs/dbraw/zinc/98/34/07/411983407.db2.gz WUFDEKYBTXAEJC-NSHDSACASA-N 1 2 249.362 2.093 20 0 BEADLO c1ccc2[nH+]c(N3CC[C@H]4COC[C@@H]4C3)[nH]c2c1 ZINC000664557149 411986132 /nfs/dbraw/zinc/98/61/32/411986132.db2.gz PSSFLDSHCHSRIU-QWRGUYRKSA-N 1 2 243.310 2.036 20 0 BEADLO CCc1ncnc(N[C@@H](C)c2[nH+]ccn2C)c1F ZINC000664609046 411997858 /nfs/dbraw/zinc/99/78/58/411997858.db2.gz ULQFJBYPOYOGJS-QMMMGPOBSA-N 1 2 249.293 2.085 20 0 BEADLO C[C@@H](Nc1ncc(Cl)cn1)c1[nH+]ccn1C ZINC000664609011 411998518 /nfs/dbraw/zinc/99/85/18/411998518.db2.gz SMKVQKHVZZSCJK-SSDOTTSWSA-N 1 2 237.694 2.037 20 0 BEADLO NC(=O)CC1(CNc2cccc[nH+]2)CCCCC1 ZINC000664614380 412000590 /nfs/dbraw/zinc/00/05/90/412000590.db2.gz IJBRMSRYPHNJEO-UHFFFAOYSA-N 1 2 247.342 2.319 20 0 BEADLO COc1c(C)[nH+]cnc1NC1CC(C)(C)C1 ZINC000664629201 412001693 /nfs/dbraw/zinc/00/16/93/412001693.db2.gz VCLRDPGJJWZGFO-UHFFFAOYSA-N 1 2 221.304 2.394 20 0 BEADLO O[C@H]1C[C@H](Nc2cc(C(F)(F)F)cc[nH+]2)C1 ZINC000664642582 412002734 /nfs/dbraw/zinc/00/27/34/412002734.db2.gz ZONUJHKMPFVBPJ-ZKCHVHJHSA-N 1 2 232.205 2.036 20 0 BEADLO COc1c(C)[nH+]cnc1N(C)C[C@H]1CC1(C)C ZINC000664670014 412007637 /nfs/dbraw/zinc/00/76/37/412007637.db2.gz JRTJLVTYPHIGMZ-SNVBAGLBSA-N 1 2 235.331 2.276 20 0 BEADLO CC12CC(C1)CN2c1cc[nH+]c(C2CC2)n1 ZINC000664693379 412010954 /nfs/dbraw/zinc/01/09/54/412010954.db2.gz LNRXPBHTGBOIAN-UHFFFAOYSA-N 1 2 215.300 2.343 20 0 BEADLO C[C@@]12COC[C@@H]1CN(c1[nH]c3ccccc3[nH+]1)C2 ZINC000664421417 411951275 /nfs/dbraw/zinc/95/12/75/411951275.db2.gz JZSFKMUBFVYWGO-IINYFYTJSA-N 1 2 243.310 2.036 20 0 BEADLO Cc1cc(N2CCC[C@@H]2[C@H](C)O)nc(C2CC2)[nH+]1 ZINC000664438204 411957514 /nfs/dbraw/zinc/95/75/14/411957514.db2.gz FGISWHFSMVGHMQ-CMPLNLGQSA-N 1 2 247.342 2.012 20 0 BEADLO CCC/C=C\c1nc(Cc2c[nH+]cn2C)no1 ZINC000664824466 412025982 /nfs/dbraw/zinc/02/59/82/412025982.db2.gz NESYAWWKSMZKMT-WAYWQWQTSA-N 1 2 232.287 2.207 20 0 BEADLO CCCCC[N@H+](C)Cc1nnc(C)s1 ZINC000662255573 412050953 /nfs/dbraw/zinc/05/09/53/412050953.db2.gz FBDKAIWFLSZTNQ-UHFFFAOYSA-N 1 2 213.350 2.469 20 0 BEADLO CCCCC[N@@H+](C)Cc1nnc(C)s1 ZINC000662255573 412050955 /nfs/dbraw/zinc/05/09/55/412050955.db2.gz FBDKAIWFLSZTNQ-UHFFFAOYSA-N 1 2 213.350 2.469 20 0 BEADLO CC(C)=CC[N@@H+](C)Cc1nnc(C)s1 ZINC000662257727 412051913 /nfs/dbraw/zinc/05/19/13/412051913.db2.gz UUSQSZWIWKNCMD-UHFFFAOYSA-N 1 2 211.334 2.245 20 0 BEADLO CC(C)=CC[N@H+](C)Cc1nnc(C)s1 ZINC000662257727 412051916 /nfs/dbraw/zinc/05/19/16/412051916.db2.gz UUSQSZWIWKNCMD-UHFFFAOYSA-N 1 2 211.334 2.245 20 0 BEADLO CCc1cn(C[C@@H]2COc3ccccc3O2)c[nH+]1 ZINC001652206012 1173043579 /nfs/dbraw/zinc/04/35/79/1173043579.db2.gz PWHUTNVBSNAPHK-GFCCVEGCSA-N 1 2 244.294 2.286 20 0 BEADLO CC[C@@H]1CCN(c2nc(N)c3ccccc3[nH+]2)C1 ZINC000301863322 171015712 /nfs/dbraw/zinc/01/57/12/171015712.db2.gz CTVJKYKSCWUDHG-SNVBAGLBSA-N 1 2 242.326 2.448 20 0 BEADLO CC[C@@H]1CC[N@@H+]1Cc1nn(C)c(C)c1Cl ZINC000335173713 171024313 /nfs/dbraw/zinc/02/43/13/171024313.db2.gz GBGUPGJAOKPANP-SECBINFHSA-N 1 2 227.739 2.366 20 0 BEADLO CC[C@@H]1CC[N@H+]1Cc1nn(C)c(C)c1Cl ZINC000335173713 171024316 /nfs/dbraw/zinc/02/43/16/171024316.db2.gz GBGUPGJAOKPANP-SECBINFHSA-N 1 2 227.739 2.366 20 0 BEADLO CC[C@@H]1CCN1c1cc[nH+]c(C2CC2)n1 ZINC000292383592 171027874 /nfs/dbraw/zinc/02/78/74/171027874.db2.gz SUBRNNJBJLPYDN-SNVBAGLBSA-N 1 2 203.289 2.343 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cncc(F)c2)C[C@@H](C)O1 ZINC000275121095 171092065 /nfs/dbraw/zinc/09/20/65/171092065.db2.gz JDQOSLBKVXKGAX-ZWNOBZJWSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cncc(F)c2)C[C@@H](C)O1 ZINC000275121095 171092068 /nfs/dbraw/zinc/09/20/68/171092068.db2.gz JDQOSLBKVXKGAX-ZWNOBZJWSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1nccs1 ZINC000269676390 171111036 /nfs/dbraw/zinc/11/10/36/171111036.db2.gz SKGUBCCQGILTEI-VHSXEESVSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1nccs1 ZINC000269676390 171111040 /nfs/dbraw/zinc/11/10/40/171111040.db2.gz SKGUBCCQGILTEI-VHSXEESVSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@](C)([NH2+]Cc1cncnc1)c1nccs1 ZINC000152619125 171175731 /nfs/dbraw/zinc/17/57/31/171175731.db2.gz AQGGUCFUOTWIMQ-GFCCVEGCSA-N 1 2 248.355 2.348 20 0 BEADLO CC[C@@](C)(O)CNc1cc(C)[nH+]c(C2CC2)n1 ZINC000116260695 171186284 /nfs/dbraw/zinc/18/62/84/171186284.db2.gz ZCFDGHXVQSOJNZ-CYBMUJFWSA-N 1 2 235.331 2.235 20 0 BEADLO CC[C@H](C(=O)OC)[N@@H+]1Cc2ccc(C)cc2C1 ZINC000361602352 171241779 /nfs/dbraw/zinc/24/17/79/171241779.db2.gz MQMBSZUOUPKRFS-CYBMUJFWSA-N 1 2 233.311 2.262 20 0 BEADLO CC[C@H](C(=O)OC)[N@H+]1Cc2ccc(C)cc2C1 ZINC000361602352 171241780 /nfs/dbraw/zinc/24/17/80/171241780.db2.gz MQMBSZUOUPKRFS-CYBMUJFWSA-N 1 2 233.311 2.262 20 0 BEADLO CC[C@H](C)CC(=O)NCCCNc1cccc[nH+]1 ZINC000191913622 171260489 /nfs/dbraw/zinc/26/04/89/171260489.db2.gz CPMCDTKHDMTIMY-LBPRGKRZSA-N 1 2 249.358 2.436 20 0 BEADLO CC[C@H](C)CC(=O)N[C@H](c1[nH+]ccn1C)C1CC1 ZINC000341691365 171262158 /nfs/dbraw/zinc/26/21/58/171262158.db2.gz PKZDRHLXPQQOHT-GWCFXTLKSA-N 1 2 249.358 2.424 20 0 BEADLO CC[C@H](C)[N@H+](CC(=O)OC)Cc1occc1C ZINC000281190192 171312199 /nfs/dbraw/zinc/31/21/99/171312199.db2.gz IGNMGXXRXRVKCV-NSHDSACASA-N 1 2 239.315 2.362 20 0 BEADLO CC[C@H](C)[N@@H+](CC(=O)OC)Cc1occc1C ZINC000281190192 171312200 /nfs/dbraw/zinc/31/22/00/171312200.db2.gz IGNMGXXRXRVKCV-NSHDSACASA-N 1 2 239.315 2.362 20 0 BEADLO CC[C@H](C)NC(=O)Nc1cc[nH+]cc1C ZINC000121180116 171331722 /nfs/dbraw/zinc/33/17/22/171331722.db2.gz IPFLAHZUQLPXIH-VIFPVBQESA-N 1 2 207.277 2.310 20 0 BEADLO CC[C@H](C)[C@@H]([NH2+]CCSC(C)C)C(=O)OC ZINC000310036778 171374201 /nfs/dbraw/zinc/37/42/01/171374201.db2.gz UOAUSJHBIFSBEL-WDEREUQCSA-N 1 2 247.404 2.305 20 0 BEADLO CC[C@H](C)[C@@H]([NH2+][C@@H]1C=CCCC1)C(=O)OC ZINC000336749764 171374932 /nfs/dbraw/zinc/37/49/32/171374932.db2.gz YYLOMFSMLSZTJJ-QJPTWQEYSA-N 1 2 225.332 2.272 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000272502566 171384862 /nfs/dbraw/zinc/38/48/62/171384862.db2.gz DUZZZFWKYJQWHZ-SRVKXCTJSA-N 1 2 237.347 2.070 20 0 BEADLO CCc1cn(C[C@H]2COc3ccccc3O2)c[nH+]1 ZINC001652206017 1173044660 /nfs/dbraw/zinc/04/46/60/1173044660.db2.gz PWHUTNVBSNAPHK-LBPRGKRZSA-N 1 2 244.294 2.286 20 0 BEADLO CCc1nnc(C[N@@H+]2CC3CC2(C)C3)s1 ZINC000662384900 412136786 /nfs/dbraw/zinc/13/67/86/412136786.db2.gz APVXXERYVNAWAR-UHFFFAOYSA-N 1 2 223.345 2.085 20 0 BEADLO CCc1nnc(C[N@H+]2CC3CC2(C)C3)s1 ZINC000662384900 412136789 /nfs/dbraw/zinc/13/67/89/412136789.db2.gz APVXXERYVNAWAR-UHFFFAOYSA-N 1 2 223.345 2.085 20 0 BEADLO CC[C@H](Cc1ccc(C)cc1)[NH2+][C@H](C)C(=O)OC ZINC000193097927 171470382 /nfs/dbraw/zinc/47/03/82/171470382.db2.gz UZRQTGSJAUPMRA-TZMCWYRMSA-N 1 2 249.354 2.467 20 0 BEADLO CC[C@H]1CCC[C@@H](NC(=O)CCc2[nH]cc[nH+]2)C1 ZINC000287770077 171622938 /nfs/dbraw/zinc/62/29/38/171622938.db2.gz UWKSUDNDKPIRQC-NWDGAFQWSA-N 1 2 249.358 2.427 20 0 BEADLO CCc1cn(CC(=O)c2cccc(OC)c2)c[nH+]1 ZINC001652208207 1173045628 /nfs/dbraw/zinc/04/56/28/1173045628.db2.gz WHNLEKVOLAMJCM-UHFFFAOYSA-N 1 2 244.294 2.337 20 0 BEADLO CCc1cn(CC(=O)[C@@H]2Cc3ccccc32)c[nH+]1 ZINC001652206622 1173045908 /nfs/dbraw/zinc/04/59/08/1173045908.db2.gz ZKLJVFMQYSBCCI-CQSZACIVSA-N 1 2 240.306 2.355 20 0 BEADLO CCc1cnc(C[NH2+][C@@H](C)CF)s1 ZINC000308298188 171915115 /nfs/dbraw/zinc/91/51/15/171915115.db2.gz YHWQPVFTHLMRBJ-ZETCQYMHSA-N 1 2 202.298 2.153 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1CCCCO1 ZINC000269437680 171925361 /nfs/dbraw/zinc/92/53/61/171925361.db2.gz ZELOGQAVCFLOPE-LBPRGKRZSA-N 1 2 234.299 2.152 20 0 BEADLO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccco2)[nH]1 ZINC000271502193 172002378 /nfs/dbraw/zinc/00/23/78/172002378.db2.gz MEPNXTWBPMTDQM-DTWKUNHWSA-N 1 2 234.303 2.372 20 0 BEADLO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccccn2)[nH]1 ZINC000271569086 172002614 /nfs/dbraw/zinc/00/26/14/172002614.db2.gz VKJMHXXUZNENTF-VHSXEESVSA-N 1 2 245.330 2.174 20 0 BEADLO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2cccnc2)[nH]1 ZINC000271492990 172003186 /nfs/dbraw/zinc/00/31/86/172003186.db2.gz LFBGOTWKUZQWRV-NXEZZACHSA-N 1 2 245.330 2.174 20 0 BEADLO CCc1[nH+]c2ccccc2n1CC(C)(C)O ZINC000062807773 172013524 /nfs/dbraw/zinc/01/35/24/172013524.db2.gz LMPCDVATTLVXDK-UHFFFAOYSA-N 1 2 218.300 2.370 20 0 BEADLO CCc1ncc(C[NH+]2C[C@@H](C)O[C@H](C)C2)s1 ZINC000269474438 172016607 /nfs/dbraw/zinc/01/66/07/172016607.db2.gz LQPQKPPZIJMZHP-NXEZZACHSA-N 1 2 240.372 2.315 20 0 BEADLO CCc1ncsc1C(=O)Nc1cc[nH+]cc1O ZINC000123731769 172035450 /nfs/dbraw/zinc/03/54/50/172035450.db2.gz GRIVMDXIQLPHFE-UHFFFAOYSA-N 1 2 249.295 2.058 20 0 BEADLO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2cccnc2)o1 ZINC000361099275 172064947 /nfs/dbraw/zinc/06/49/47/172064947.db2.gz ZMTRYUFOJKKXCV-VHSXEESVSA-N 1 2 246.314 2.439 20 0 BEADLO CCc1noc(C)c1C[NH2+][C@@H](C)c1cnccn1 ZINC000340441898 172079895 /nfs/dbraw/zinc/07/98/95/172079895.db2.gz IOJSILHIRUYQCB-VIFPVBQESA-N 1 2 246.314 2.186 20 0 BEADLO CCc1noc(C)c1C[NH2+][C@H](C)c1ncc[nH]1 ZINC000293691789 172080413 /nfs/dbraw/zinc/08/04/13/172080413.db2.gz LERHCTDHGNRXMW-MRVPVSSYSA-N 1 2 234.303 2.119 20 0 BEADLO CCc1noc(CCc2[nH]c3ccccc3[nH+]2)n1 ZINC000264672497 172082980 /nfs/dbraw/zinc/08/29/80/172082980.db2.gz XFHATGMIHIJGLT-UHFFFAOYSA-N 1 2 242.282 2.294 20 0 BEADLO CCc1noc([C@@H](C)[N@@H+]2CCC=C(C)C2)n1 ZINC000280963526 172089086 /nfs/dbraw/zinc/08/90/86/172089086.db2.gz ZCOYZEXCODDKQM-SNVBAGLBSA-N 1 2 221.304 2.345 20 0 BEADLO CCc1noc([C@@H](C)[N@H+]2CCC=C(C)C2)n1 ZINC000280963526 172089088 /nfs/dbraw/zinc/08/90/88/172089088.db2.gz ZCOYZEXCODDKQM-SNVBAGLBSA-N 1 2 221.304 2.345 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1conc1C ZINC000293670417 172096524 /nfs/dbraw/zinc/09/65/24/172096524.db2.gz OSTRBUAQEMHBAE-UHFFFAOYSA-N 1 2 235.287 2.165 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1conc1C ZINC000293670417 172096526 /nfs/dbraw/zinc/09/65/26/172096526.db2.gz OSTRBUAQEMHBAE-UHFFFAOYSA-N 1 2 235.287 2.165 20 0 BEADLO CCc1nocc1C[NH2+]Cc1ccco1 ZINC000339174601 172101697 /nfs/dbraw/zinc/10/16/97/172101697.db2.gz VJSDOUBXAZRARK-UHFFFAOYSA-N 1 2 206.245 2.120 20 0 BEADLO CCc1nsc(N[C@H](CC)c2[nH]cc[nH+]2)n1 ZINC000125232890 172107580 /nfs/dbraw/zinc/10/75/80/172107580.db2.gz FBSIKOZMGNNQBO-SSDOTTSWSA-N 1 2 237.332 2.387 20 0 BEADLO CCn1cc([C@@H](C)[NH2+]Cc2cscn2)cn1 ZINC000082625980 172193966 /nfs/dbraw/zinc/19/39/66/172193966.db2.gz IJABZPINANBTSF-SECBINFHSA-N 1 2 236.344 2.210 20 0 BEADLO CCn1cc[nH+]c1CN(CC(F)F)C1CC1 ZINC000106872098 172219983 /nfs/dbraw/zinc/21/99/83/172219983.db2.gz HIBRHXDAACLKAM-UHFFFAOYSA-N 1 2 229.274 2.133 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C[C@@H]1CCC[C@@H]1C ZINC000295592390 172222077 /nfs/dbraw/zinc/22/20/77/172222077.db2.gz HUGHSCIQNCUSIG-RYUDHWBXSA-N 1 2 249.358 2.346 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)c1ccc(C)s1 ZINC000295715830 172222283 /nfs/dbraw/zinc/22/22/83/172222283.db2.gz KFGSMVLXMGFKAY-UHFFFAOYSA-N 1 2 249.339 2.203 20 0 BEADLO CCn1ccnc1C[NH2+][C@H](C)c1ccccn1 ZINC000051921039 172223895 /nfs/dbraw/zinc/22/38/95/172223895.db2.gz HASQFSUDQZCXHF-LLVKDONJSA-N 1 2 230.315 2.149 20 0 BEADLO CCn1cc[nH+]c1CNc1ncc(C)s1 ZINC000309041703 172226732 /nfs/dbraw/zinc/22/67/32/172226732.db2.gz LOZMXMORKCFYRG-UHFFFAOYSA-N 1 2 222.317 2.280 20 0 BEADLO CCn1nccc1C[NH+]1CC2(CCC2(F)F)C1 ZINC000336617781 172266795 /nfs/dbraw/zinc/26/67/95/172266795.db2.gz ALGXBRVAOGJCNZ-UHFFFAOYSA-N 1 2 241.285 2.134 20 0 BEADLO CCn1ncnc1C[NH2+][C@@H](C)c1cc(C)c(C)o1 ZINC000337475802 172281475 /nfs/dbraw/zinc/28/14/75/172281475.db2.gz OZQDSXIOFQOEMN-JTQLQIEISA-N 1 2 248.330 2.359 20 0 BEADLO CCn1ncnc1C[NH2+]Cc1ccc(F)c(C)c1 ZINC000355601680 172282462 /nfs/dbraw/zinc/28/24/62/172282462.db2.gz SZURQGDYKDLBLE-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO CCn1c2ccccc2nc1C[NH+]1CC(CF)C1 ZINC000556893874 322930418 /nfs/dbraw/zinc/93/04/18/322930418.db2.gz MNHQTIXOALKJDQ-UHFFFAOYSA-N 1 2 247.317 2.458 20 0 BEADLO CN(C[C@H](O)Cc1ccccc1)c1cccc[nH+]1 ZINC000292884821 172825089 /nfs/dbraw/zinc/82/50/89/172825089.db2.gz ZGDVUUJMZYCJFM-CQSZACIVSA-N 1 2 242.322 2.121 20 0 BEADLO COCC1(CNc2cc(C)[nH+]cn2)CCCCC1 ZINC000357810249 174099707 /nfs/dbraw/zinc/09/97/07/174099707.db2.gz DNBLUMJARWNJAN-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO COCC1(O)C[NH+](Cc2ccc(C(C)C)cc2)C1 ZINC000297441062 174113544 /nfs/dbraw/zinc/11/35/44/174113544.db2.gz PMASDGKMEATYCS-UHFFFAOYSA-N 1 2 249.354 2.003 20 0 BEADLO COCCC(C)(C)CNc1cc(C)[nH+]cn1 ZINC000230839577 174144266 /nfs/dbraw/zinc/14/42/66/174144266.db2.gz DUGQOIDAZUNKLB-UHFFFAOYSA-N 1 2 223.320 2.260 20 0 BEADLO COCCC1(C(=O)Nc2ccc(C)[nH+]c2C)CC1 ZINC000269437226 174151539 /nfs/dbraw/zinc/15/15/39/174151539.db2.gz OUQUGEVPHYGMFQ-UHFFFAOYSA-N 1 2 248.326 2.454 20 0 BEADLO COCCC1(C)CN(c2cc[nH+]c(C(C)C)n2)C1 ZINC000341111197 174155029 /nfs/dbraw/zinc/15/50/29/174155029.db2.gz DOHCGUHPMMITPF-UHFFFAOYSA-N 1 2 249.358 2.463 20 0 BEADLO COCCC1(CNc2cc[nH+]c(C)n2)CCC1 ZINC000151938223 174157220 /nfs/dbraw/zinc/15/72/20/174157220.db2.gz AMSBWYUOMBTPHQ-UHFFFAOYSA-N 1 2 235.331 2.404 20 0 BEADLO COCCCCC(=O)Nc1cc[nH+]cc1C ZINC000107285163 174175284 /nfs/dbraw/zinc/17/52/84/174175284.db2.gz GWEKRZNICKQLPP-UHFFFAOYSA-N 1 2 222.288 2.145 20 0 BEADLO COCC[N@H+](CCC1CC1)CC(F)F ZINC000360065248 174289561 /nfs/dbraw/zinc/28/95/61/174289561.db2.gz ZSXDEPYARZBEHW-UHFFFAOYSA-N 1 2 207.264 2.000 20 0 BEADLO COCC[N@@H+](CCC1CC1)CC(F)F ZINC000360065248 174289562 /nfs/dbraw/zinc/28/95/62/174289562.db2.gz ZSXDEPYARZBEHW-UHFFFAOYSA-N 1 2 207.264 2.000 20 0 BEADLO COCCc1ccc(OCc2c[nH+]cn2C)cc1 ZINC000267733999 174422482 /nfs/dbraw/zinc/42/24/82/174422482.db2.gz DKUZNOWOQMUZHR-UHFFFAOYSA-N 1 2 246.310 2.188 20 0 BEADLO CO[C@H]1CC[N@H+](Cc2ncc(Cl)s2)C1 ZINC000336532887 174890995 /nfs/dbraw/zinc/89/09/95/174890995.db2.gz YONAZRPOKUOTMS-ZETCQYMHSA-N 1 2 232.736 2.017 20 0 BEADLO CO[C@H]1CC[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000336532887 174890996 /nfs/dbraw/zinc/89/09/96/174890996.db2.gz YONAZRPOKUOTMS-ZETCQYMHSA-N 1 2 232.736 2.017 20 0 BEADLO COc1cc(NCc2[nH+]cc(C)n2C)ccc1F ZINC000341346648 175003159 /nfs/dbraw/zinc/00/31/59/175003159.db2.gz FTNCXFSTFHGQDH-UHFFFAOYSA-N 1 2 249.289 2.488 20 0 BEADLO COc1cc(OC)cc(OCc2c[nH+]cn2C)c1 ZINC000267803149 175010233 /nfs/dbraw/zinc/01/02/33/175010233.db2.gz QNDSQXNFMNKRIE-UHFFFAOYSA-N 1 2 248.282 2.016 20 0 BEADLO COc1cc([C@@H](C)Nc2cc(C)[nH+]cn2)ccn1 ZINC000340934387 175014437 /nfs/dbraw/zinc/01/44/37/175014437.db2.gz GUJHEEMUUZFXJY-SNVBAGLBSA-N 1 2 244.298 2.362 20 0 BEADLO COc1ccc(-c2ccc(N)[nH+]c2)cc1F ZINC000052886429 175033634 /nfs/dbraw/zinc/03/36/34/175033634.db2.gz DPHULKBYRVSKKD-UHFFFAOYSA-N 1 2 218.231 2.479 20 0 BEADLO COc1ccc(CCNc2cc[nH+]c(C)n2)cc1 ZINC000054935675 175093050 /nfs/dbraw/zinc/09/30/50/175093050.db2.gz OCRZFFPIXWFIMX-UHFFFAOYSA-N 1 2 243.310 2.448 20 0 BEADLO COc1ccc(C[N@@H+]2CCC(=O)C[C@@H]2C)cc1 ZINC000049707619 175098039 /nfs/dbraw/zinc/09/80/39/175098039.db2.gz BLFLEJAPQIIBBW-NSHDSACASA-N 1 2 233.311 2.249 20 0 BEADLO COc1ccc(C[N@H+]2CCC(=O)C[C@@H]2C)cc1 ZINC000049707619 175098040 /nfs/dbraw/zinc/09/80/40/175098040.db2.gz BLFLEJAPQIIBBW-NSHDSACASA-N 1 2 233.311 2.249 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@@H](F)C2)cc1F ZINC000336222940 175102356 /nfs/dbraw/zinc/10/23/56/175102356.db2.gz WYQQVBGTSSSLNX-SNVBAGLBSA-N 1 2 227.254 2.378 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@@H](F)C2)cc1F ZINC000336222940 175102358 /nfs/dbraw/zinc/10/23/58/175102358.db2.gz WYQQVBGTSSSLNX-SNVBAGLBSA-N 1 2 227.254 2.378 20 0 BEADLO COc1ccc(C[NH2+]Cc2cc(C)on2)cc1 ZINC000044294724 175108294 /nfs/dbraw/zinc/10/82/94/175108294.db2.gz NHIFXYNVSFBBLI-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO COc1ccc(F)c(NCc2c[nH+]cn2C)c1 ZINC000094854182 175126335 /nfs/dbraw/zinc/12/63/35/175126335.db2.gz MLCCODPUQKAKIL-UHFFFAOYSA-N 1 2 235.262 2.180 20 0 BEADLO COc1ccc([NH2+]CC2(C)COC2)cc1 ZINC000070616830 175150777 /nfs/dbraw/zinc/15/07/77/175150777.db2.gz SESDDXXPMVREGE-UHFFFAOYSA-N 1 2 207.273 2.144 20 0 BEADLO COc1ccc(Nc2ccc(N)[nH+]c2)cc1OC ZINC000019952044 175156240 /nfs/dbraw/zinc/15/62/40/175156240.db2.gz ONIKECGZVSTDLI-UHFFFAOYSA-N 1 2 245.282 2.425 20 0 BEADLO COc1ccc(OC)c(C[N@H+](C)CCF)c1 ZINC000268275469 175165649 /nfs/dbraw/zinc/16/56/49/175165649.db2.gz DHXCISAKOCRDIQ-UHFFFAOYSA-N 1 2 227.279 2.105 20 0 BEADLO COc1ccc(OC)c(C[N@@H+](C)CCF)c1 ZINC000268275469 175165650 /nfs/dbraw/zinc/16/56/50/175165650.db2.gz DHXCISAKOCRDIQ-UHFFFAOYSA-N 1 2 227.279 2.105 20 0 BEADLO COc1ccc([C@@H](C)[NH2+]Cc2nnc(C)o2)cc1 ZINC000223628278 175177075 /nfs/dbraw/zinc/17/70/75/175177075.db2.gz LLMFAECXFLGGQG-SECBINFHSA-N 1 2 247.298 2.237 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2cccnc2)n1 ZINC000179522447 175255182 /nfs/dbraw/zinc/25/51/82/175255182.db2.gz REOQQZCXRCRSIX-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2cccnc2)n1 ZINC000179522447 175255184 /nfs/dbraw/zinc/25/51/84/175255184.db2.gz REOQQZCXRCRSIX-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2ccccn2)n1 ZINC000188963155 175255244 /nfs/dbraw/zinc/25/52/44/175255244.db2.gz JQQRVQJUHYJWRK-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2ccccn2)n1 ZINC000188963155 175255246 /nfs/dbraw/zinc/25/52/46/175255246.db2.gz JQQRVQJUHYJWRK-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2ccco2)n1 ZINC000172007263 175255916 /nfs/dbraw/zinc/25/59/16/175255916.db2.gz IULPJQKEFKBNAA-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2ccco2)n1 ZINC000172007263 175255917 /nfs/dbraw/zinc/25/59/17/175255917.db2.gz IULPJQKEFKBNAA-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1cccc(C[N@@H+]2CCC[C@H]2CF)n1 ZINC000292964232 175258300 /nfs/dbraw/zinc/25/83/00/175258300.db2.gz FXUCVVVSTYPOIH-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO COc1cccc(C[N@H+]2CCC[C@H]2CF)n1 ZINC000292964232 175258301 /nfs/dbraw/zinc/25/83/01/175258301.db2.gz FXUCVVVSTYPOIH-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO COc1cccc(NCc2[nH+]cc(C)n2C)c1 ZINC000341143091 175278822 /nfs/dbraw/zinc/27/88/22/175278822.db2.gz FDHSRRHQCVAJRT-UHFFFAOYSA-N 1 2 231.299 2.349 20 0 BEADLO COc1cccc(Nc2ccc(N)[nH+]c2)c1 ZINC000019952320 175281005 /nfs/dbraw/zinc/28/10/05/175281005.db2.gz ILMMFUXDVMDNCV-UHFFFAOYSA-N 1 2 215.256 2.416 20 0 BEADLO COc1cccc2c(NCC[C@H](C)O)cc[nH+]c12 ZINC000275632838 175299723 /nfs/dbraw/zinc/29/97/23/175299723.db2.gz UGIFVNZROOGMMC-JTQLQIEISA-N 1 2 246.310 2.426 20 0 BEADLO COc1cccc2c(N[C@@H]3CCOC3)cc[nH+]c12 ZINC000302497403 175300512 /nfs/dbraw/zinc/30/05/12/175300512.db2.gz BVGHDFFTHBOZDU-SNVBAGLBSA-N 1 2 244.294 2.444 20 0 BEADLO COc1ccccc1C[N@H+](C)Cc1cnccn1 ZINC000092591558 175325136 /nfs/dbraw/zinc/32/51/36/175325136.db2.gz VMQVTAQFUJQXCO-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1ccccc1C[N@@H+](C)Cc1cnccn1 ZINC000092591558 175325138 /nfs/dbraw/zinc/32/51/38/175325138.db2.gz VMQVTAQFUJQXCO-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1ccccc1C[N@H+](C)Cc1cncn1C ZINC000176983845 175325266 /nfs/dbraw/zinc/32/52/66/175325266.db2.gz NTLPHIMZMBUACV-UHFFFAOYSA-N 1 2 245.326 2.061 20 0 BEADLO COc1ccccc1C[N@@H+](C)Cc1cncn1C ZINC000176983845 175325267 /nfs/dbraw/zinc/32/52/67/175325267.db2.gz NTLPHIMZMBUACV-UHFFFAOYSA-N 1 2 245.326 2.061 20 0 BEADLO COc1ccccc1CN(C)Cc1c[nH+]cn1C ZINC000176983845 175325268 /nfs/dbraw/zinc/32/52/68/175325268.db2.gz NTLPHIMZMBUACV-UHFFFAOYSA-N 1 2 245.326 2.061 20 0 BEADLO COc1ccccc1[C@@H](C)[NH2+]Cc1nnc(C)o1 ZINC000234887110 175346254 /nfs/dbraw/zinc/34/62/54/175346254.db2.gz BJOAMTNCXLPRAY-SECBINFHSA-N 1 2 247.298 2.237 20 0 BEADLO COc1ccccc1[C@H](C)[NH2+]Cc1nnc(C)o1 ZINC000234901662 175352297 /nfs/dbraw/zinc/35/22/97/175352297.db2.gz BJOAMTNCXLPRAY-VIFPVBQESA-N 1 2 247.298 2.237 20 0 BEADLO COc1ccnc(C[N@@H+]2CCC[C@](C)(F)C2)c1 ZINC000295539486 175359092 /nfs/dbraw/zinc/35/90/92/175359092.db2.gz WCHFOMANYPPTNC-ZDUSSCGKSA-N 1 2 238.306 2.414 20 0 BEADLO COc1ccnc(C[N@H+]2CCC[C@](C)(F)C2)c1 ZINC000295539486 175359095 /nfs/dbraw/zinc/35/90/95/175359095.db2.gz WCHFOMANYPPTNC-ZDUSSCGKSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cc[nH+]c(CN2CCC[C@](C)(F)C2)c1 ZINC000295539486 175359097 /nfs/dbraw/zinc/35/90/97/175359097.db2.gz WCHFOMANYPPTNC-ZDUSSCGKSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cc[nH+]cc1COC(=O)[C@H]1CC1(C)C ZINC000286854945 175373208 /nfs/dbraw/zinc/37/32/08/175373208.db2.gz BJRVTPDUENZGJK-SNVBAGLBSA-N 1 2 235.283 2.180 20 0 BEADLO COc1ccncc1C[NH2+][C@H](C)c1nccs1 ZINC000287911439 175373984 /nfs/dbraw/zinc/37/39/84/175373984.db2.gz VNQGZJSBJLTTIY-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@H]1CC=CCC1 ZINC000299467922 175374343 /nfs/dbraw/zinc/37/43/43/175374343.db2.gz FTLHUPANPROPPB-JTQLQIEISA-N 1 2 232.283 2.385 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H](C)C(C)(F)F ZINC000293475869 175375746 /nfs/dbraw/zinc/37/57/46/175375746.db2.gz RMBPJCXSBRZQBD-SSDOTTSWSA-N 1 2 244.241 2.320 20 0 BEADLO COc1cc[nH+]cc1NCc1ccnn1C(C)C ZINC000280393309 175376035 /nfs/dbraw/zinc/37/60/35/175376035.db2.gz VEBVQTJJSAOHSN-UHFFFAOYSA-N 1 2 246.314 2.480 20 0 BEADLO COc1cc[nH+]cc1NCc1cccn1C ZINC000119138240 175376295 /nfs/dbraw/zinc/37/62/95/175376295.db2.gz PIWHLGBNSDVXKH-UHFFFAOYSA-N 1 2 217.272 2.041 20 0 BEADLO COc1ccsc1C[N@@H+]1C[C@H](C)OC[C@@H]1C ZINC000271082319 175377656 /nfs/dbraw/zinc/37/76/56/175377656.db2.gz WYRHBEDYBJQTJB-UWVGGRQHSA-N 1 2 241.356 2.366 20 0 BEADLO COc1ccsc1C[N@H+]1C[C@H](C)OC[C@@H]1C ZINC000271082319 175377658 /nfs/dbraw/zinc/37/76/58/175377658.db2.gz WYRHBEDYBJQTJB-UWVGGRQHSA-N 1 2 241.356 2.366 20 0 BEADLO COc1nccc(CNc2ccc(C)[nH+]c2C)n1 ZINC000295698426 175403293 /nfs/dbraw/zinc/40/32/93/175403293.db2.gz MDOONOCKWOITPD-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CCC[C@@H](F)C1 ZINC000668294369 487631421 /nfs/dbraw/zinc/63/14/21/487631421.db2.gz VVGREIYRLLZTDK-LLVKDONJSA-N 1 2 225.311 2.398 20 0 BEADLO C[C@@H](CO)CSCc1cn2ccccc2[nH+]1 ZINC000085138660 175745376 /nfs/dbraw/zinc/74/53/76/175745376.db2.gz UYRUNUJEMZCCPP-JTQLQIEISA-N 1 2 236.340 2.196 20 0 BEADLO C[C@@H](O)[C@@H]1CCCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000301882492 175994066 /nfs/dbraw/zinc/99/40/66/175994066.db2.gz MXWDVJXPQPHCRR-GHMZBOCLSA-N 1 2 245.326 2.160 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCOC1=O)[C@@H](C)c1ccccc1 ZINC000177482556 176022859 /nfs/dbraw/zinc/02/28/59/176022859.db2.gz BLBCZHDKRBIHSU-NQBHXWOUSA-N 1 2 233.311 2.084 20 0 BEADLO C[C@@H](c1ccccc1)[S@@](=O)Cc1c[nH+]cn1C ZINC000268201195 176022917 /nfs/dbraw/zinc/02/29/17/176022917.db2.gz YSJMPQLTZKLPDC-GTNSWQLSSA-N 1 2 248.351 2.430 20 0 BEADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1cncn1C ZINC000162455168 176028492 /nfs/dbraw/zinc/02/84/92/176028492.db2.gz JBCGAWZMOHYXGB-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1cncn1C ZINC000162455168 176028493 /nfs/dbraw/zinc/02/84/93/176028493.db2.gz JBCGAWZMOHYXGB-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1cccnc1)N(C)Cc1c[nH+]cn1C ZINC000162455168 176028495 /nfs/dbraw/zinc/02/84/95/176028495.db2.gz JBCGAWZMOHYXGB-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+]1CCSC[C@H](C)C1 ZINC000336259155 176037620 /nfs/dbraw/zinc/03/76/20/176037620.db2.gz PORDQFHJOKBCHC-BDAKNGLRSA-N 1 2 243.401 2.284 20 0 BEADLO C[C@@H](c1csnn1)[N@H+]1CCSC[C@H](C)C1 ZINC000336259155 176037622 /nfs/dbraw/zinc/03/76/22/176037622.db2.gz PORDQFHJOKBCHC-BDAKNGLRSA-N 1 2 243.401 2.284 20 0 BEADLO C[C@@H](c1nc(C2CC2)no1)[N@@H+]1C[C@@H](C)[C@@H]1C ZINC000339573301 176038365 /nfs/dbraw/zinc/03/83/65/176038365.db2.gz AWQBQYAJEAXREU-VGMNWLOBSA-N 1 2 221.304 2.348 20 0 BEADLO C[C@@H](c1nc(C2CC2)no1)[N@H+]1C[C@@H](C)[C@@H]1C ZINC000339573301 176038366 /nfs/dbraw/zinc/03/83/66/176038366.db2.gz AWQBQYAJEAXREU-VGMNWLOBSA-N 1 2 221.304 2.348 20 0 BEADLO C[C@@H](c1noc(CCn2cc[nH+]c2)n1)C1CC1 ZINC000273930261 176041394 /nfs/dbraw/zinc/04/13/94/176041394.db2.gz IOGCDNHTWWJHHZ-SECBINFHSA-N 1 2 232.287 2.022 20 0 BEADLO C[C@@H]1CC(NC(=O)CCn2cc[nH+]c2)C[C@@H](C)C1 ZINC000265722597 176053107 /nfs/dbraw/zinc/05/31/07/176053107.db2.gz NGVROCMMFUFNFG-RYUDHWBXSA-N 1 2 249.358 2.214 20 0 BEADLO C[C@@H]1CCCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000283294578 176063787 /nfs/dbraw/zinc/06/37/87/176063787.db2.gz WZHOLOZKCARPOQ-MVIFTORASA-N 1 2 233.315 2.072 20 0 BEADLO C[C@@H]1CCCC[C@H]1CNC(=O)CCc1c[nH+]c[nH]1 ZINC000192903270 176084242 /nfs/dbraw/zinc/08/42/42/176084242.db2.gz VYLZGZGKAOUJOP-NEPJUHHUSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1CCCC[C@H]1CNC(=O)CCc1c[nH]c[nH+]1 ZINC000192903270 176084244 /nfs/dbraw/zinc/08/42/44/176084244.db2.gz VYLZGZGKAOUJOP-NEPJUHHUSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1CCCC[C@H]1N(C)C(=O)CCc1[nH]cc[nH+]1 ZINC000279259321 176085332 /nfs/dbraw/zinc/08/53/32/176085332.db2.gz SZNCSSDGWJCADP-VXGBXAGGSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H]1CCCC[C@H]1NC(=O)CCc1[nH]cc[nH+]1 ZINC000279265923 176086491 /nfs/dbraw/zinc/08/64/91/176086491.db2.gz VOJCUYAOJDJVDO-GHMZBOCLSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H]1CCC[C@@H](C)C1NC(=O)CCc1c[nH+]c[nH]1 ZINC000193285147 176113832 /nfs/dbraw/zinc/11/38/32/176113832.db2.gz IDHVBTHKKBUEQO-GHMZBOCLSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CCC[C@@H](C)C1NC(=O)CCc1c[nH]c[nH+]1 ZINC000193285147 176113833 /nfs/dbraw/zinc/11/38/33/176113833.db2.gz IDHVBTHKKBUEQO-GHMZBOCLSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CCC[C@@H]1[NH2+]c1ccc(OCC(N)=O)cc1 ZINC000086673349 176132699 /nfs/dbraw/zinc/13/26/99/176132699.db2.gz BCXGEBSNDASSLL-MFKMUULPSA-N 1 2 248.326 2.151 20 0 BEADLO C[C@@H]1CCC[C@H](N(C)C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000283600914 176139369 /nfs/dbraw/zinc/13/93/69/176139369.db2.gz YJSRCLNRQJTJPT-VKYBYORPSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)CCc2[nH]cc[nH+]2)C1 ZINC000279289514 176141335 /nfs/dbraw/zinc/14/13/35/176141335.db2.gz YNCXMXCWEUWYMQ-MNOVXSKESA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H]1CCC[C@H]1[NH2+]c1ccc(OCC(N)=O)cc1 ZINC000086673351 176151044 /nfs/dbraw/zinc/15/10/44/176151044.db2.gz BCXGEBSNDASSLL-ZWNOBZJWSA-N 1 2 248.326 2.151 20 0 BEADLO C[C@@H]1CCC[C@H]1Nc1nc[nH+]c(N)c1Cl ZINC000235272758 176151154 /nfs/dbraw/zinc/15/11/54/176151154.db2.gz RIHYDDFAFVJAFV-RNFRBKRXSA-N 1 2 226.711 2.313 20 0 BEADLO C[C@@H]1CCC[C@H]1Nc1[nH+]cnc(N)c1Cl ZINC000235272758 176151156 /nfs/dbraw/zinc/15/11/56/176151156.db2.gz RIHYDDFAFVJAFV-RNFRBKRXSA-N 1 2 226.711 2.313 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2csnn2)[C@H](C)C1 ZINC000127179592 176177656 /nfs/dbraw/zinc/17/76/56/176177656.db2.gz SQDHKMSQHVPNCK-RKDXNWHRSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2csnn2)[C@H](C)C1 ZINC000127179592 176177658 /nfs/dbraw/zinc/17/76/58/176177658.db2.gz SQDHKMSQHVPNCK-RKDXNWHRSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]1CN(C(=O)C=Cc2c[nH]c[nH+]2)C(C)(C)C1 ZINC000284289611 176241396 /nfs/dbraw/zinc/24/13/96/176241396.db2.gz FZVFEEMWYBHROB-YEZKRMTDSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@@H]1C[N@H+](C/C=C/c2ccccc2)CC[S@]1=O ZINC000336413372 176280891 /nfs/dbraw/zinc/28/08/91/176280891.db2.gz VLTUBPJDDGOVAV-KULBWLNLSA-N 1 2 249.379 2.153 20 0 BEADLO C[C@@H]1C[N@@H+](C/C=C/c2ccccc2)CC[S@]1=O ZINC000336413372 176280893 /nfs/dbraw/zinc/28/08/93/176280893.db2.gz VLTUBPJDDGOVAV-KULBWLNLSA-N 1 2 249.379 2.153 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc(F)cc2)CCC1=O ZINC000049693606 176304201 /nfs/dbraw/zinc/30/42/01/176304201.db2.gz YIQUUFWWEAQOPA-SNVBAGLBSA-N 1 2 221.275 2.237 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc(F)cc2)CCC1=O ZINC000049693606 176304202 /nfs/dbraw/zinc/30/42/02/176304202.db2.gz YIQUUFWWEAQOPA-SNVBAGLBSA-N 1 2 221.275 2.237 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cncs2)C[C@H](C2CC2)O1 ZINC000280646234 176310407 /nfs/dbraw/zinc/31/04/07/176310407.db2.gz RRQNGXDFCMGPDX-BXKDBHETSA-N 1 2 238.356 2.142 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cncs2)C[C@H](C2CC2)O1 ZINC000280646234 176310408 /nfs/dbraw/zinc/31/04/08/176310408.db2.gz RRQNGXDFCMGPDX-BXKDBHETSA-N 1 2 238.356 2.142 20 0 BEADLO C[C@@H]1COCC[N@H+](Cc2cnc(Cl)s2)C1 ZINC000307128823 176332796 /nfs/dbraw/zinc/33/27/96/176332796.db2.gz JRVXJLXZOQTYTQ-QMMMGPOBSA-N 1 2 246.763 2.265 20 0 BEADLO C[C@@H]1COCC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC000307128823 176332797 /nfs/dbraw/zinc/33/27/97/176332797.db2.gz JRVXJLXZOQTYTQ-QMMMGPOBSA-N 1 2 246.763 2.265 20 0 BEADLO C[C@@H]1COCC[C@H]1Nc1cc[nH+]c2ccncc12 ZINC000277390931 176345748 /nfs/dbraw/zinc/34/57/48/176345748.db2.gz GISMNONSXQPIIE-ZYHUDNBSSA-N 1 2 243.310 2.467 20 0 BEADLO C[C@@H]1COc2ccccc2C[N@@H+]1Cc1ccon1 ZINC000272935171 176348616 /nfs/dbraw/zinc/34/86/16/176348616.db2.gz KKMYHDMLTFHRSV-LLVKDONJSA-N 1 2 244.294 2.458 20 0 BEADLO C[C@@H]1COc2ccccc2C[N@H+]1Cc1ccon1 ZINC000272935171 176348617 /nfs/dbraw/zinc/34/86/17/176348617.db2.gz KKMYHDMLTFHRSV-LLVKDONJSA-N 1 2 244.294 2.458 20 0 BEADLO C[C@@H]1CSCC[N@@H+]1Cc1nccs1 ZINC000179221405 176351717 /nfs/dbraw/zinc/35/17/17/176351717.db2.gz YZPKBTFRCSSDRD-MRVPVSSYSA-N 1 2 214.359 2.080 20 0 BEADLO C[C@@H]1CSCC[N@H+]1Cc1nccs1 ZINC000179221405 176351718 /nfs/dbraw/zinc/35/17/18/176351718.db2.gz YZPKBTFRCSSDRD-MRVPVSSYSA-N 1 2 214.359 2.080 20 0 BEADLO C[C@@H]1CSC[C@H]1Nc1cc[nH+]c2ccncc12 ZINC000336617582 176354559 /nfs/dbraw/zinc/35/45/59/176354559.db2.gz VWLOAPYPNOFDIM-NOZJJQNGSA-N 1 2 245.351 2.215 20 0 BEADLO C[C@@H]1C[C@@H](C)CN(C(=O)CCCn2cc[nH+]c2)C1 ZINC000125288526 176359733 /nfs/dbraw/zinc/35/97/33/176359733.db2.gz FSWRHKLCFYSWFT-CHWSQXEVSA-N 1 2 249.358 2.168 20 0 BEADLO C[C@@H]1C[C@@H](CSCCn2cc[nH+]c2)CCO1 ZINC000362457241 176369893 /nfs/dbraw/zinc/36/98/93/176369893.db2.gz PJCXYEJSAVDMQP-NEPJUHHUSA-N 1 2 240.372 2.431 20 0 BEADLO C[C@@H]1C[C@@H]([NH2+]Cc2ccco2)c2nccn21 ZINC000294284778 176377375 /nfs/dbraw/zinc/37/73/75/176377375.db2.gz YTKSHRXZNVNENH-MWLCHTKSSA-N 1 2 217.272 2.272 20 0 BEADLO C[C@@H]1C[C@@H]1C[NH2+][C@@H](c1cccs1)c1nnc[nH]1 ZINC000293679552 176397905 /nfs/dbraw/zinc/39/79/05/176397905.db2.gz KHADLTZUZPNVPS-KKZNHRDASA-N 1 2 248.355 2.201 20 0 BEADLO Cc1ccc(NC(=O)c2ccc[nH]c2=O)c(C)[nH+]1 ZINC000674848007 487634236 /nfs/dbraw/zinc/63/42/36/487634236.db2.gz DWOUCJOBOAPYAR-UHFFFAOYSA-N 1 2 243.266 2.051 20 0 BEADLO Cc1occc1C[N@@H+]1CCCc2[nH]ncc2C1 ZINC000668841632 487634758 /nfs/dbraw/zinc/63/47/58/487634758.db2.gz LXFDVYZIIQVDHQ-UHFFFAOYSA-N 1 2 231.299 2.260 20 0 BEADLO Cc1occc1C[N@H+]1CCCc2[nH]ncc2C1 ZINC000668841632 487634761 /nfs/dbraw/zinc/63/47/61/487634761.db2.gz LXFDVYZIIQVDHQ-UHFFFAOYSA-N 1 2 231.299 2.260 20 0 BEADLO C[C@H]([NH2+]Cc1cocn1)c1ccc2n[nH]cc2c1 ZINC000353114663 176882224 /nfs/dbraw/zinc/88/22/24/176882224.db2.gz WHGNSJSWMCEXII-VIFPVBQESA-N 1 2 242.282 2.402 20 0 BEADLO C[C@H]([NH2+][C@@H](C1CC1)C(F)(F)F)[C@@H]1CCOC1 ZINC000336735618 176890760 /nfs/dbraw/zinc/89/07/60/176890760.db2.gz IFHRILGCVYPFAD-SFGNSQDASA-N 1 2 237.265 2.342 20 0 BEADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1cnns1 ZINC000290131674 177038069 /nfs/dbraw/zinc/03/80/69/177038069.db2.gz VBBCISFAWYBPQM-SECBINFHSA-N 1 2 249.339 2.437 20 0 BEADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1cnns1 ZINC000290131674 177038070 /nfs/dbraw/zinc/03/80/70/177038070.db2.gz VBBCISFAWYBPQM-SECBINFHSA-N 1 2 249.339 2.437 20 0 BEADLO C[C@H](c1ccco1)[N@H+](C)Cc1cnns1 ZINC000336693629 177048260 /nfs/dbraw/zinc/04/82/60/177048260.db2.gz NJOYFNKJNCBPTE-MRVPVSSYSA-N 1 2 223.301 2.324 20 0 BEADLO C[C@H](c1ccco1)[N@@H+](C)Cc1cnns1 ZINC000336693629 177048262 /nfs/dbraw/zinc/04/82/62/177048262.db2.gz NJOYFNKJNCBPTE-MRVPVSSYSA-N 1 2 223.301 2.324 20 0 BEADLO C[C@H](c1cnccn1)[N@H+](C)Cc1cccnc1 ZINC000184690519 177051610 /nfs/dbraw/zinc/05/16/10/177051610.db2.gz NSCIVSQRUILBEX-LLVKDONJSA-N 1 2 228.299 2.065 20 0 BEADLO C[C@H](c1cnccn1)[N@@H+](C)Cc1cccnc1 ZINC000184690519 177051612 /nfs/dbraw/zinc/05/16/12/177051612.db2.gz NSCIVSQRUILBEX-LLVKDONJSA-N 1 2 228.299 2.065 20 0 BEADLO C[C@H]1CC(NC(=O)CCc2c[nH+]c[nH]2)C[C@H](C)C1 ZINC000193324435 177064739 /nfs/dbraw/zinc/06/47/39/177064739.db2.gz IDVFGUUGUCQZDS-GHMZBOCLSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H]1CC(NC(=O)CCc2c[nH]c[nH+]2)C[C@H](C)C1 ZINC000193324435 177064740 /nfs/dbraw/zinc/06/47/40/177064740.db2.gz IDVFGUUGUCQZDS-GHMZBOCLSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H]1CC/C(=C\C(=O)N(C)Cc2[nH+]ccn2C)C1 ZINC000267835850 177067036 /nfs/dbraw/zinc/06/70/36/177067036.db2.gz FXNFDKQFZHWINO-UTEVDWOZSA-N 1 2 247.342 2.125 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)C1(CF)CCC1 ZINC000335471070 487636916 /nfs/dbraw/zinc/63/69/16/487636916.db2.gz BZXSTFRCAWABFS-UHFFFAOYSA-N 1 2 247.273 2.413 20 0 BEADLO C[C@H]1CCCC[C@H]1NC(=O)CCc1c[nH+]cn1C ZINC000188422383 177087896 /nfs/dbraw/zinc/08/78/96/177087896.db2.gz SHYMUKBYTWFYJC-WCQYABFASA-N 1 2 249.358 2.048 20 0 BEADLO C[C@@H]1CCC[C@H](C)N(C(=O)CCn2cc[nH+]c2)C1 ZINC000336578796 177113763 /nfs/dbraw/zinc/11/37/63/177113763.db2.gz GLRBTIKCVMYFNC-OLZOCXBDSA-N 1 2 249.358 2.310 20 0 BEADLO C[C@H]1CCC[C@@H](CC(=O)NCCc2[nH]cc[nH+]2)C1 ZINC000330895165 177118579 /nfs/dbraw/zinc/11/85/79/177118579.db2.gz KMHADLKHOOYDLM-NWDGAFQWSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H]1CCC[C@@H](N(C)C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000283600918 177120893 /nfs/dbraw/zinc/12/08/93/177120893.db2.gz YJSRCLNRQJTJPT-YRDGOHCCSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@H]1CCC[C@H](CC(=O)NCc2c[nH+]c[nH]2)C1 ZINC000330896959 177132287 /nfs/dbraw/zinc/13/22/87/177132287.db2.gz LSPFODLDWBFPLD-QWRGUYRKSA-N 1 2 235.331 2.242 20 0 BEADLO C[C@H]1CCC[C@H](CC(=O)NCc2c[nH]c[nH+]2)C1 ZINC000330896959 177132288 /nfs/dbraw/zinc/13/22/88/177132288.db2.gz LSPFODLDWBFPLD-QWRGUYRKSA-N 1 2 235.331 2.242 20 0 BEADLO C[C@H]1CCC[C@H](N(C)C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000283600916 177134619 /nfs/dbraw/zinc/13/46/19/177134619.db2.gz YJSRCLNRQJTJPT-XTYWZOAOSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@H]1CCN(C(=O)C2CCC2)C[C@@H]1n1cc[nH+]c1 ZINC000123053911 177146308 /nfs/dbraw/zinc/14/63/08/177146308.db2.gz XPXIVKFKUHBXJE-AAEUAGOBSA-N 1 2 247.342 2.093 20 0 BEADLO C[C@H]1CC[N@H+](Cc2csnn2)CC1(C)C ZINC000336320733 177166960 /nfs/dbraw/zinc/16/69/60/177166960.db2.gz HLMUROYJGYAXIB-VIFPVBQESA-N 1 2 225.361 2.406 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2csnn2)CC1(C)C ZINC000336320733 177166962 /nfs/dbraw/zinc/16/69/62/177166962.db2.gz HLMUROYJGYAXIB-VIFPVBQESA-N 1 2 225.361 2.406 20 0 BEADLO C[C@@H]1CC[C@H](C)CN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000284156145 177184357 /nfs/dbraw/zinc/18/43/57/177184357.db2.gz WVJGQZXQIQYKLD-PFDYWKIBSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@H]1CC[C@H](CC(=O)Nc2ccc(N)[nH+]c2)C1 ZINC000151668185 177201303 /nfs/dbraw/zinc/20/13/03/177201303.db2.gz PHSWGSGRLYPDBR-UWVGGRQHSA-N 1 2 233.315 2.429 20 0 BEADLO C[C@H]1C[N@H+](Cc2cnn(C)n2)[C@H]1c1ccccc1 ZINC000289790241 177269410 /nfs/dbraw/zinc/26/94/10/177269410.db2.gz LOURMEDZNSWIAC-SMDDNHRTSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cnn(C)n2)[C@H]1c1ccccc1 ZINC000289790241 177269412 /nfs/dbraw/zinc/26/94/12/177269412.db2.gz LOURMEDZNSWIAC-SMDDNHRTSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@H]1C[N@H+](Cc2cnc(Cl)s2)CCCO1 ZINC000086776839 177270005 /nfs/dbraw/zinc/27/00/05/177270005.db2.gz BMWSQPKUYPIHPL-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cnc(Cl)s2)CCCO1 ZINC000086776839 177270006 /nfs/dbraw/zinc/27/00/06/177270006.db2.gz BMWSQPKUYPIHPL-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@H]1C[N@H+](Cc2nc(CC(F)(F)F)no2)[C@H]1C ZINC000339572612 177271120 /nfs/dbraw/zinc/27/11/20/177271120.db2.gz AQQCGXWFVYCIGK-BQBZGAKWSA-N 1 2 249.236 2.015 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nc(CC(F)(F)F)no2)[C@H]1C ZINC000339572612 177271122 /nfs/dbraw/zinc/27/11/22/177271122.db2.gz AQQCGXWFVYCIGK-BQBZGAKWSA-N 1 2 249.236 2.015 20 0 BEADLO C[C@H]1CN(c2[nH+]ccc3ccc(F)cc32)C[C@@H]1O ZINC000354874044 177277972 /nfs/dbraw/zinc/27/79/72/177277972.db2.gz GRAIBNXIBSEVIA-ZANVPECISA-N 1 2 246.285 2.191 20 0 BEADLO C[C@H]1COCC[N@@H+]1Cc1cnc2ccccc2c1 ZINC000271107703 177293409 /nfs/dbraw/zinc/29/34/09/177293409.db2.gz XRYTYFKBDXSSFI-LBPRGKRZSA-N 1 2 242.322 2.456 20 0 BEADLO C[C@H]1COCC[N@H+]1Cc1cnc2ccccc2c1 ZINC000271107703 177293411 /nfs/dbraw/zinc/29/34/11/177293411.db2.gz XRYTYFKBDXSSFI-LBPRGKRZSA-N 1 2 242.322 2.456 20 0 BEADLO C[C@H](c1csnn1)[N@@H+]1CCSC[C@H](C)C1 ZINC000336259252 177304080 /nfs/dbraw/zinc/30/40/80/177304080.db2.gz PORDQFHJOKBCHC-RKDXNWHRSA-N 1 2 243.401 2.284 20 0 BEADLO C[C@H](c1csnn1)[N@H+]1CCSC[C@H](C)C1 ZINC000336259252 177304082 /nfs/dbraw/zinc/30/40/82/177304082.db2.gz PORDQFHJOKBCHC-RKDXNWHRSA-N 1 2 243.401 2.284 20 0 BEADLO C[C@H]1CCN(C(=O)CCc2[nH]cc[nH+]2)C[C@@H](C)C1 ZINC000287586367 177309454 /nfs/dbraw/zinc/30/94/54/177309454.db2.gz GUPZQAVOTSUADI-RYUDHWBXSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@H]1C[C@H](NC(=O)CCc2c[nH+]c[nH]2)C[C@@H](C)C1 ZINC000249083818 177318039 /nfs/dbraw/zinc/31/80/39/177318039.db2.gz IDVFGUUGUCQZDS-PJXYFTJBSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H]1C[C@H](NC(=O)CCc2c[nH]c[nH+]2)C[C@@H](C)C1 ZINC000249083818 177318040 /nfs/dbraw/zinc/31/80/40/177318040.db2.gz IDVFGUUGUCQZDS-PJXYFTJBSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1ncn(-c2ccccc2)n1 ZINC000335756734 177319892 /nfs/dbraw/zinc/31/98/92/177319892.db2.gz BNNWQAGURUIWBT-TXEJJXNPSA-N 1 2 242.326 2.250 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1ncn(-c2ccccc2)n1 ZINC000335756734 177319894 /nfs/dbraw/zinc/31/98/94/177319894.db2.gz BNNWQAGURUIWBT-TXEJJXNPSA-N 1 2 242.326 2.250 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1nncn1-c1ccccc1 ZINC000336460985 177320054 /nfs/dbraw/zinc/32/00/54/177320054.db2.gz VEGNHOUQGHDZIN-TXEJJXNPSA-N 1 2 242.326 2.250 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1nncn1-c1ccccc1 ZINC000336460985 177320056 /nfs/dbraw/zinc/32/00/56/177320056.db2.gz VEGNHOUQGHDZIN-TXEJJXNPSA-N 1 2 242.326 2.250 20 0 BEADLO C[C@H]1C[C@@H]([NH2+]Cc2cncs2)c2nccn21 ZINC000345365607 177333002 /nfs/dbraw/zinc/33/30/02/177333002.db2.gz YRVAAGPDAUSEAJ-WCBMZHEXSA-N 1 2 234.328 2.135 20 0 BEADLO C[C@H]1C[C@@H](Nc2cc(NC3CC3)[nH+]cn2)CCO1 ZINC000334027497 177334551 /nfs/dbraw/zinc/33/45/51/177334551.db2.gz IHBPYBVXSMNHJS-ONGXEEELSA-N 1 2 248.330 2.030 20 0 BEADLO C[C@H]1C[C@@H](Nc2cc(NC3CC3)nc[nH+]2)CCO1 ZINC000334027497 177334553 /nfs/dbraw/zinc/33/45/53/177334553.db2.gz IHBPYBVXSMNHJS-ONGXEEELSA-N 1 2 248.330 2.030 20 0 BEADLO C[C@H]1C[C@@H]1c1ccc(C[NH+]2CCN(C)CC2)o1 ZINC000137072067 177351788 /nfs/dbraw/zinc/35/17/88/177351788.db2.gz GQNGWWJECPJDLP-AAEUAGOBSA-N 1 2 234.343 2.150 20 0 BEADLO C[C@@H]1CC[C@@H](NC(=O)CCn2cc[nH+]c2)[C@@H](C)C1 ZINC000264967655 177356594 /nfs/dbraw/zinc/35/65/94/177356594.db2.gz FQBBKGYFUHTUHY-FRRDWIJNSA-N 1 2 249.358 2.214 20 0 BEADLO C[C@H]1C[C@H]([NH2+]Cc2ncn(C)n2)c2ccccc21 ZINC000290234466 177371607 /nfs/dbraw/zinc/37/16/07/177371607.db2.gz IWASJAPDIFSPQX-GWCFXTLKSA-N 1 2 242.326 2.153 20 0 BEADLO C[C@H]1C[C@H](Nc2ncc(Cl)cn2)c2[nH+]ccn21 ZINC000333642703 177372387 /nfs/dbraw/zinc/37/23/87/177372387.db2.gz CKSVTRADPPLRQL-CBAPKCEASA-N 1 2 249.705 2.444 20 0 BEADLO C[C@@H]1Cc2[nH+]cn(Cc3nccn3C)c2C[C@@H]1C ZINC000296142648 177387850 /nfs/dbraw/zinc/38/78/50/177387850.db2.gz ZVNNMBFXJHRDDP-MNOVXSKESA-N 1 2 244.342 2.036 20 0 BEADLO C[C@H]1OCCN(c2[nH+]c3ccccc3n2C)[C@@H]1C ZINC000179317376 177399319 /nfs/dbraw/zinc/39/93/19/177399319.db2.gz JAXXBSPLXPIBJM-GHMZBOCLSA-N 1 2 245.326 2.187 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C[C@@H]1CCC[C@@H]1C ZINC000274458684 177529052 /nfs/dbraw/zinc/52/90/52/177529052.db2.gz UPLAAXWWPRMOAP-ONGXEEELSA-N 1 2 235.331 2.161 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@H](C)C2CCC2)c[nH+]1 ZINC001652464365 1173085224 /nfs/dbraw/zinc/08/52/24/1173085224.db2.gz ZOBMHPMHFMPDQF-SECBINFHSA-N 1 2 235.331 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@H](C)C2CCC2)[nH+]1 ZINC001652464365 1173085228 /nfs/dbraw/zinc/08/52/28/1173085228.db2.gz ZOBMHPMHFMPDQF-SECBINFHSA-N 1 2 235.331 2.025 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H](C)C2CCC2)c[nH+]1 ZINC001652464366 1173084630 /nfs/dbraw/zinc/08/46/30/1173084630.db2.gz ZOBMHPMHFMPDQF-VIFPVBQESA-N 1 2 235.331 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H](C)C2CCC2)[nH+]1 ZINC001652464366 1173084636 /nfs/dbraw/zinc/08/46/36/1173084636.db2.gz ZOBMHPMHFMPDQF-VIFPVBQESA-N 1 2 235.331 2.025 20 0 BEADLO Cc1ccsc1[C@@H](CO)Nc1cc(C)[nH+]cn1 ZINC000487633044 225319373 /nfs/dbraw/zinc/31/93/73/225319373.db2.gz KWBMAMVMSZVKFZ-SNVBAGLBSA-N 1 2 249.339 2.300 20 0 BEADLO OC[C@H](CNc1cccc[nH+]1)c1ccccc1 ZINC000487660035 225320610 /nfs/dbraw/zinc/32/06/10/225320610.db2.gz CCKRBBOUKVFLGS-ZDUSSCGKSA-N 1 2 228.295 2.270 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N[C@H]1CC2CCC1CC2 ZINC000492774185 226050019 /nfs/dbraw/zinc/05/00/19/226050019.db2.gz WQVBKWYNJAZPQF-VBUVTPCQSA-N 1 2 245.326 2.118 20 0 BEADLO C[C@H]1CC(NC(=O)C=Cc2c[nH]c[nH+]2)C[C@@H](C)C1 ZINC000492775474 226050174 /nfs/dbraw/zinc/05/01/74/226050174.db2.gz XVKDBZJRDJEBBY-QEXTWPGQSA-N 1 2 247.342 2.364 20 0 BEADLO C[C@H](C1CC1)N(C(=O)C=Cc1c[nH]c[nH+]1)C1CC1 ZINC000492808793 226057557 /nfs/dbraw/zinc/05/75/57/226057557.db2.gz DZCIFEWRTFQWGX-ISGFRBBESA-N 1 2 245.326 2.212 20 0 BEADLO C[C@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000492814287 226058209 /nfs/dbraw/zinc/05/82/09/226058209.db2.gz UGVCPFRUHYUHQF-WYGGZMRJSA-N 1 2 233.315 2.072 20 0 BEADLO Cc1nc(C)c(NC(=O)C=Cc2c[nH]c[nH+]2)s1 ZINC000492820243 226060093 /nfs/dbraw/zinc/06/00/93/226060093.db2.gz ATADREKDDPVRSR-ONEGZZNKSA-N 1 2 248.311 2.135 20 0 BEADLO C[C@H]1CC2(CCC2)CN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492856263 226066392 /nfs/dbraw/zinc/06/63/92/226066392.db2.gz BLBCSHZLKITXSD-BYCRGOAPSA-N 1 2 245.326 2.214 20 0 BEADLO C[C@@H]1C[C@H](C)CCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492856569 226066693 /nfs/dbraw/zinc/06/66/93/226066693.db2.gz BYMVNYWLHHYFRJ-BLDJZWNYSA-N 1 2 247.342 2.318 20 0 BEADLO Cc1ccccc1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492867099 226069801 /nfs/dbraw/zinc/06/98/01/226069801.db2.gz WZZJVUGGFFNYEK-VOTSOKGWSA-N 1 2 227.267 2.370 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)NC1CCCCCC1 ZINC000492866539 226070785 /nfs/dbraw/zinc/07/07/85/226070785.db2.gz QGCIGESAMMGSRP-FPLPWBNLSA-N 1 2 233.315 2.262 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)/C=C/C2CCCC2)S1 ZINC000493049083 226112874 /nfs/dbraw/zinc/11/28/74/226112874.db2.gz MZEDEKLKZYDMPM-XCODYQFDSA-N 1 2 238.356 2.340 20 0 BEADLO Cc1ccc(NC(=O)/C=C/[C@@H]2CCOC2)c(C)[nH+]1 ZINC000493111984 226129970 /nfs/dbraw/zinc/12/99/70/226129970.db2.gz CUULOAVDVNXVLD-FVOPLDGLSA-N 1 2 246.310 2.230 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)/C=C/c2[nH]cc[nH+]2)[C@@H](C)C1 ZINC000493181944 226146523 /nfs/dbraw/zinc/14/65/23/226146523.db2.gz CQDATUSFRFAIDP-JXSGWAFGSA-N 1 2 247.342 2.364 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)/C=C/c2[nH]cc[nH+]2)C[C@@H]1C ZINC000493197226 226153200 /nfs/dbraw/zinc/15/32/00/226153200.db2.gz AJIDXXRFOPXCNW-JXSGWAFGSA-N 1 2 247.342 2.364 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)/C=C\C(C)(C)C)S1 ZINC000493240375 226164581 /nfs/dbraw/zinc/16/45/81/226164581.db2.gz OYOKMWQLQNVXHQ-RPSMYOMKSA-N 1 2 226.345 2.196 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)/C=C\C2CC2)[nH+]1 ZINC000493274302 226172556 /nfs/dbraw/zinc/17/25/56/226172556.db2.gz SLLUULLJYFTSIS-SREVYHEPSA-N 1 2 233.315 2.036 20 0 BEADLO Cn1c[nH+]cc1Cc1noc([C@@H]2CC23CCC3)n1 ZINC000680808475 487649004 /nfs/dbraw/zinc/64/90/04/487649004.db2.gz ZCQDDMTWSHQGIN-JTQLQIEISA-N 1 2 244.298 2.052 20 0 BEADLO C[C@H](N(C)C(=O)C=Cc1c[nH]c[nH+]1)C(C)(C)C ZINC000493577170 226244103 /nfs/dbraw/zinc/24/41/03/226244103.db2.gz DHGDYKQLSUJCIO-FGEFZZPRSA-N 1 2 235.331 2.316 20 0 BEADLO C[C@H](NC(=O)C=Cc1c[nH]c[nH+]1)c1ccccc1 ZINC000493612224 226245986 /nfs/dbraw/zinc/24/59/86/226245986.db2.gz NLRDQPWBXISNQK-TVRMLOFPSA-N 1 2 241.294 2.300 20 0 BEADLO CN(C(=O)/C=C/c1[nH]cc[nH+]1)[C@@H]1CCC(C)(C)C1 ZINC000493697218 226249908 /nfs/dbraw/zinc/24/99/08/226249908.db2.gz YQDGILNEKBATSK-SGUJLRQBSA-N 1 2 247.342 2.460 20 0 BEADLO O=C(/C=C\c1[nH]cc[nH+]1)N(CC1CC1)C1CCC1 ZINC000493793133 226254428 /nfs/dbraw/zinc/25/44/28/226254428.db2.gz RIHKKKFJUCEGAI-SREVYHEPSA-N 1 2 245.326 2.214 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)Nc1ccc(F)cc1F ZINC000493806891 226254904 /nfs/dbraw/zinc/25/49/04/226254904.db2.gz CWRFECKTEPFARS-DUXPYHPUSA-N 1 2 249.220 2.340 20 0 BEADLO C[C@H](F)CCSc1[nH+]cnc2c1cnn2C ZINC000505690698 226358789 /nfs/dbraw/zinc/35/87/89/226358789.db2.gz VDRWBDJKMCJENM-ZETCQYMHSA-N 1 2 240.307 2.204 20 0 BEADLO CC(C)(C)C1CC(NC(=O)/C=C\c2[nH]cc[nH+]2)C1 ZINC000493111198 262741555 /nfs/dbraw/zinc/74/15/55/262741555.db2.gz CFLXCCSJALCBIF-PLNGDYQASA-N 1 2 247.342 2.364 20 0 BEADLO Cc1cnn(C)c1C[NH2+]C1(C(F)F)CCCC1 ZINC000674135690 487669952 /nfs/dbraw/zinc/66/99/52/487669952.db2.gz ZHZZODFQDCDODX-UHFFFAOYSA-N 1 2 243.301 2.396 20 0 BEADLO C[C@@H](Cc1nc(C2(C)CC2)no1)n1cc[nH+]c1 ZINC000351458473 487670012 /nfs/dbraw/zinc/67/00/12/487670012.db2.gz SSLNISWJMVFXLY-VIFPVBQESA-N 1 2 232.287 2.121 20 0 BEADLO CC(C)CCCNC(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000666153590 487690812 /nfs/dbraw/zinc/69/08/12/487690812.db2.gz DYMSLTQPRHDZOK-VXGBXAGGSA-N 1 2 249.358 2.076 20 0 BEADLO FC[C@H]1CCC[N@@H+]1Cc1ccncc1F ZINC000336217824 487693932 /nfs/dbraw/zinc/69/39/32/487693932.db2.gz SSTMAOFAPQIYPS-SNVBAGLBSA-N 1 2 212.243 2.155 20 0 BEADLO FC[C@H]1CCC[N@H+]1Cc1ccncc1F ZINC000336217824 487693934 /nfs/dbraw/zinc/69/39/34/487693934.db2.gz SSTMAOFAPQIYPS-SNVBAGLBSA-N 1 2 212.243 2.155 20 0 BEADLO CCCc1ccc(C[NH2+]CC(F)(F)CO)cc1 ZINC000681008657 487694564 /nfs/dbraw/zinc/69/45/64/487694564.db2.gz KWVCJZZXJMDDLS-UHFFFAOYSA-N 1 2 243.297 2.356 20 0 BEADLO CN(CCc1ccncc1)c1cccc[nH+]1 ZINC000071711368 262922933 /nfs/dbraw/zinc/92/29/33/262922933.db2.gz BZMIXUCRXSFKFY-UHFFFAOYSA-N 1 2 213.284 2.156 20 0 BEADLO c1csc(C[N@@H+]2CCC[C@@H](n3ccnc3)C2)n1 ZINC000676714701 487724227 /nfs/dbraw/zinc/72/42/27/487724227.db2.gz OQAUYOUZWLQTAT-LLVKDONJSA-N 1 2 248.355 2.177 20 0 BEADLO c1csc(C[N@H+]2CCC[C@@H](n3ccnc3)C2)n1 ZINC000676714701 487724232 /nfs/dbraw/zinc/72/42/32/487724232.db2.gz OQAUYOUZWLQTAT-LLVKDONJSA-N 1 2 248.355 2.177 20 0 BEADLO CCc1cc(N[C@H](COC)c2ccco2)nc[nH+]1 ZINC000674248573 487731581 /nfs/dbraw/zinc/73/15/81/487731581.db2.gz OHCZWBXLAXZMKI-LLVKDONJSA-N 1 2 247.298 2.432 20 0 BEADLO O=C(C1=CCCC1)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000675452398 487733936 /nfs/dbraw/zinc/73/39/36/487733936.db2.gz HZJWIVSASKGJKK-ZDUSSCGKSA-N 1 2 245.326 2.157 20 0 BEADLO CC(C)n1ncnc1C[NH2+]Cc1ccccc1F ZINC000088588722 487738054 /nfs/dbraw/zinc/73/80/54/487738054.db2.gz ZXHRVNCJUVAIAH-UHFFFAOYSA-N 1 2 248.305 2.288 20 0 BEADLO CCc1cc(N[C@@H](CO)c2ccsc2)nc[nH+]1 ZINC000681153501 487738939 /nfs/dbraw/zinc/73/89/39/487738939.db2.gz XQRMJSUTCCXKNW-NSHDSACASA-N 1 2 249.339 2.246 20 0 BEADLO COc1cc2cc[nH+]cc2cc1OC[C@@H](C)O ZINC000666144794 487741124 /nfs/dbraw/zinc/74/11/24/487741124.db2.gz YGSDPAXFLTUMHS-SECBINFHSA-N 1 2 233.267 2.003 20 0 BEADLO CC1(C)[NH2+][C@H](C2CC2)N(c2ccccc2)C1=O ZINC000666182224 487749354 /nfs/dbraw/zinc/74/93/54/487749354.db2.gz NPAADICIFMDYCX-LBPRGKRZSA-N 1 2 230.311 2.138 20 0 BEADLO C[C@H]1C[N@H+](Cc2cccc(F)c2N)[C@@H](C)CO1 ZINC000226470112 487752484 /nfs/dbraw/zinc/75/24/84/487752484.db2.gz MXMONYHUSKVQCX-UWVGGRQHSA-N 1 2 238.306 2.017 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cccc(F)c2N)[C@@H](C)CO1 ZINC000226470112 487752488 /nfs/dbraw/zinc/75/24/88/487752488.db2.gz MXMONYHUSKVQCX-UWVGGRQHSA-N 1 2 238.306 2.017 20 0 BEADLO CCc1cc(NCc2ccc(F)cn2)nc[nH+]1 ZINC000675638548 487757451 /nfs/dbraw/zinc/75/74/51/487757451.db2.gz KGKOEBIYQRYKEJ-UHFFFAOYSA-N 1 2 232.262 2.185 20 0 BEADLO Cc1nc(C[N@@H+](C)Cc2cn[nH]c2)sc1C ZINC000675647829 487760251 /nfs/dbraw/zinc/76/02/51/487760251.db2.gz YWNXSIQVZXBPDI-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1nc(C[N@H+](C)Cc2cn[nH]c2)sc1C ZINC000675647829 487760252 /nfs/dbraw/zinc/76/02/52/487760252.db2.gz YWNXSIQVZXBPDI-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2cnc(C)nc2C)no1 ZINC000675770977 487777137 /nfs/dbraw/zinc/77/71/37/487777137.db2.gz CHABFOQAPLLMLG-SECBINFHSA-N 1 2 246.314 2.241 20 0 BEADLO CCC[C@@H]1CCC[C@@H]1C(=O)NCCn1cc[nH+]c1 ZINC000294624002 487777901 /nfs/dbraw/zinc/77/79/01/487777901.db2.gz WQZCQDXQTJMDHQ-OLZOCXBDSA-N 1 2 249.358 2.216 20 0 BEADLO CCOC1C[NH+](Cc2scnc2C2CC2)C1 ZINC000459604791 487778143 /nfs/dbraw/zinc/77/81/43/487778143.db2.gz KEYTWSBTLLCPKE-UHFFFAOYSA-N 1 2 238.356 2.241 20 0 BEADLO CCc1noc(C[NH+]2CCC(C(F)F)CC2)n1 ZINC000675903401 487790453 /nfs/dbraw/zinc/79/04/53/487790453.db2.gz DWVXWUBHLSJUSQ-UHFFFAOYSA-N 1 2 245.273 2.109 20 0 BEADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1ccon1)CCO2 ZINC000675928333 487793262 /nfs/dbraw/zinc/79/32/62/487793262.db2.gz VLWHFHFJVXBKST-GFCCVEGCSA-N 1 2 248.257 2.427 20 0 BEADLO CCOc1ccccc1-c1[nH+]ccn1C ZINC000041211099 487795577 /nfs/dbraw/zinc/79/55/77/487795577.db2.gz FPLGZGLOAFZKMC-UHFFFAOYSA-N 1 2 202.257 2.486 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1cc(C)n(C)n1 ZINC000676040447 487802810 /nfs/dbraw/zinc/80/28/10/487802810.db2.gz ZXQFOSFIGOEDFB-UHFFFAOYSA-N 1 2 233.315 2.344 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1cc(C)n(C)n1 ZINC000676040447 487802813 /nfs/dbraw/zinc/80/28/13/487802813.db2.gz ZXQFOSFIGOEDFB-UHFFFAOYSA-N 1 2 233.315 2.344 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccc(O)c2)nn1C ZINC000676040706 487803082 /nfs/dbraw/zinc/80/30/82/487803082.db2.gz NUWXVMLJXHNVLT-UHFFFAOYSA-N 1 2 245.326 2.066 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccc(O)c2)nn1C ZINC000676040706 487803088 /nfs/dbraw/zinc/80/30/88/487803088.db2.gz NUWXVMLJXHNVLT-UHFFFAOYSA-N 1 2 245.326 2.066 20 0 BEADLO Cc1noc(C[N@@H+](C)[C@@H]2C[C@H]2c2ccccc2)n1 ZINC000676043928 487804337 /nfs/dbraw/zinc/80/43/37/487804337.db2.gz RVQCKAKXXRTOHW-QWHCGFSZSA-N 1 2 243.310 2.366 20 0 BEADLO Cc1noc(C[N@H+](C)[C@@H]2C[C@H]2c2ccccc2)n1 ZINC000676043928 487804342 /nfs/dbraw/zinc/80/43/42/487804342.db2.gz RVQCKAKXXRTOHW-QWHCGFSZSA-N 1 2 243.310 2.366 20 0 BEADLO COc1ccc(-c2[nH+]ccn2C)c(OC)c1 ZINC000041231037 487812633 /nfs/dbraw/zinc/81/26/33/487812633.db2.gz BXAPLGKALHOKMP-UHFFFAOYSA-N 1 2 218.256 2.104 20 0 BEADLO Cc1cc(NC(=O)N2CC3CC2(C)C3)c(C)c[nH+]1 ZINC000666495548 487822279 /nfs/dbraw/zinc/82/22/79/487822279.db2.gz JJOOGQGYUOUFNX-UHFFFAOYSA-N 1 2 245.326 2.137 20 0 BEADLO CCc1nnc(C[N@H+]2CCC2(C)C)s1 ZINC000784190689 585852582 /nfs/dbraw/zinc/85/25/82/585852582.db2.gz DKUKHMOCOZVIQI-UHFFFAOYSA-N 1 2 211.334 2.085 20 0 BEADLO Cc1ncc([C@H](C)[NH+]2C[C@@H](C)O[C@H](C)C2)c(C)n1 ZINC000681640155 487829273 /nfs/dbraw/zinc/82/92/73/487829273.db2.gz YSZDGJKMXINSSN-FOGDFJRCSA-N 1 2 249.358 2.264 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@@H](C)c2cnc(C)nc2C)CCO1 ZINC000681658040 487833106 /nfs/dbraw/zinc/83/31/06/487833106.db2.gz VNPOBPCIDDUPHP-WCQYABFASA-N 1 2 249.358 2.265 20 0 BEADLO CC[C@@H]1C[N@H+]([C@@H](C)c2cnc(C)nc2C)CCO1 ZINC000681658040 487833107 /nfs/dbraw/zinc/83/31/07/487833107.db2.gz VNPOBPCIDDUPHP-WCQYABFASA-N 1 2 249.358 2.265 20 0 BEADLO CC(C)C1C[NH+](Cc2cn(C3CCC3)nn2)C1 ZINC000668090195 487833173 /nfs/dbraw/zinc/83/31/73/487833173.db2.gz HXUCRSKYXVGEIM-UHFFFAOYSA-N 1 2 234.347 2.091 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]CC=C(Cl)Cl)o1 ZINC000851931942 588645080 /nfs/dbraw/zinc/64/50/80/588645080.db2.gz GGAAQGPZERCPDX-YFKPBYRVSA-N 1 2 236.102 2.348 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCc1cccc(F)c1 ZINC000558519844 322951356 /nfs/dbraw/zinc/95/13/56/322951356.db2.gz GLTRTERTUVIQLW-UHFFFAOYSA-N 1 2 245.301 2.309 20 0 BEADLO Cc1cn2ccc(NC(=O)N[C@@H]3C[C@H]3C)cc2[nH+]1 ZINC000668153219 487854429 /nfs/dbraw/zinc/85/44/29/487854429.db2.gz JXEMSHZJRDXTKC-LDYMZIIASA-N 1 2 244.298 2.173 20 0 BEADLO O[C@H]1CC[N@H+](C[C@H]2CC=CCC2)CC1(F)F ZINC000668500484 487857653 /nfs/dbraw/zinc/85/76/53/487857653.db2.gz ZTBWGUTVCMEJOE-QWRGUYRKSA-N 1 2 231.286 2.045 20 0 BEADLO O[C@H]1CC[N@@H+](C[C@H]2CC=CCC2)CC1(F)F ZINC000668500484 487857655 /nfs/dbraw/zinc/85/76/55/487857655.db2.gz ZTBWGUTVCMEJOE-QWRGUYRKSA-N 1 2 231.286 2.045 20 0 BEADLO O[C@H]1CC[N@H+](C[C@@H]2CC=CCC2)CC1(F)F ZINC000668500483 487857311 /nfs/dbraw/zinc/85/73/11/487857311.db2.gz ZTBWGUTVCMEJOE-MNOVXSKESA-N 1 2 231.286 2.045 20 0 BEADLO O[C@H]1CC[N@@H+](C[C@@H]2CC=CCC2)CC1(F)F ZINC000668500483 487857318 /nfs/dbraw/zinc/85/73/18/487857318.db2.gz ZTBWGUTVCMEJOE-MNOVXSKESA-N 1 2 231.286 2.045 20 0 BEADLO COCc1csc(C[NH+]2CC(C)(OC)C2)c1 ZINC000668172805 487863404 /nfs/dbraw/zinc/86/34/04/487863404.db2.gz ULJVYNCRGRZYMO-UHFFFAOYSA-N 1 2 241.356 2.115 20 0 BEADLO CCc1cc(N[C@@H]2CCC[C@@H]3OCC[C@H]32)nc[nH+]1 ZINC000675449121 487870360 /nfs/dbraw/zinc/87/03/60/487870360.db2.gz PYASTYBZJJZZRX-XQQFMLRXSA-N 1 2 247.342 2.409 20 0 BEADLO CC[C@@H](NC(=O)[C@@H](C)c1ccco1)c1[nH]cc[nH+]1 ZINC000682040956 487888110 /nfs/dbraw/zinc/88/81/10/487888110.db2.gz BTNLRHMNBCCGBI-VHSXEESVSA-N 1 2 247.298 2.374 20 0 BEADLO O=C(NCCc1[nH]cc[nH+]1)[C@H]1CCCC2(CC2)C1 ZINC000668536841 487901264 /nfs/dbraw/zinc/90/12/64/487901264.db2.gz ZANBNWZIKNFESE-NSHDSACASA-N 1 2 247.342 2.039 20 0 BEADLO Cc1nc(N2CCC[C@H]3C[C@H]32)c(C)c(C)[nH+]1 ZINC000672323849 487919439 /nfs/dbraw/zinc/91/94/39/487919439.db2.gz UFAMJFLMBJOSJE-NWDGAFQWSA-N 1 2 217.316 2.391 20 0 BEADLO COCc1cc[nH+]c(N[C@H]2CCOC2(C)C)c1 ZINC000652331541 487921298 /nfs/dbraw/zinc/92/12/98/487921298.db2.gz KFFMWWKNVBVHRI-NSHDSACASA-N 1 2 236.315 2.207 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](C)c2ccn(C)n2)c1 ZINC000652331323 487921019 /nfs/dbraw/zinc/92/10/19/487921019.db2.gz DEEJNFPEEZYLDZ-JTQLQIEISA-N 1 2 246.314 2.135 20 0 BEADLO Cc1cc(C[N@@H+]2CCOCC23CCC3)sn1 ZINC000671126358 487923277 /nfs/dbraw/zinc/92/32/77/487923277.db2.gz RMVXKTKETPQTFG-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO Cc1cc(C[N@H+]2CCOCC23CCC3)sn1 ZINC000671126358 487923280 /nfs/dbraw/zinc/92/32/80/487923280.db2.gz RMVXKTKETPQTFG-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO Fc1cccc(C[N@@H+]2CCc3c[nH]nc3C2)c1 ZINC000676792464 487928608 /nfs/dbraw/zinc/92/86/08/487928608.db2.gz JFCKBRLVDPOLHN-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO Fc1cccc(C[N@H+]2CCc3c[nH]nc3C2)c1 ZINC000676792464 487928613 /nfs/dbraw/zinc/92/86/13/487928613.db2.gz JFCKBRLVDPOLHN-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CC=CCC2)s1 ZINC000669932856 487936522 /nfs/dbraw/zinc/93/65/22/487936522.db2.gz PTHMREUALGEQHZ-MRVPVSSYSA-N 1 2 209.318 2.169 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CC=CCC2)s1 ZINC000669932856 487936527 /nfs/dbraw/zinc/93/65/27/487936527.db2.gz PTHMREUALGEQHZ-MRVPVSSYSA-N 1 2 209.318 2.169 20 0 BEADLO CC[C@H](C)CN(C)C(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000668564787 487941180 /nfs/dbraw/zinc/94/11/80/487941180.db2.gz ATDSROYPJSPPQD-QJPTWQEYSA-N 1 2 249.358 2.028 20 0 BEADLO CC[C@@H](C)CN(C)C(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000668565963 487941826 /nfs/dbraw/zinc/94/18/26/487941826.db2.gz PASRIDOODYGYSC-MNOVXSKESA-N 1 2 249.358 2.019 20 0 BEADLO CC[C@@H](C)CN(C)C(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000668565963 487941829 /nfs/dbraw/zinc/94/18/29/487941829.db2.gz PASRIDOODYGYSC-MNOVXSKESA-N 1 2 249.358 2.019 20 0 BEADLO C[C@H](C[C@H](C)O)Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000679934149 487945112 /nfs/dbraw/zinc/94/51/12/487945112.db2.gz YXFXIUYEEYQXQD-ZJUUUORDSA-N 1 2 237.347 2.345 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000667142212 487945174 /nfs/dbraw/zinc/94/51/74/487945174.db2.gz ORZSFVXGBCAYER-AXFHLTTASA-N 1 2 249.358 2.065 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000667142212 487945178 /nfs/dbraw/zinc/94/51/78/487945178.db2.gz ORZSFVXGBCAYER-AXFHLTTASA-N 1 2 249.358 2.065 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000667142230 487946178 /nfs/dbraw/zinc/94/61/78/487946178.db2.gz OWGPJLORJPOPIA-NNYUYHANSA-N 1 2 249.358 2.074 20 0 BEADLO C[C@H]1CCCCN(C(=O)CCCn2cc[nH+]c2)C1 ZINC000681251586 487951020 /nfs/dbraw/zinc/95/10/20/487951020.db2.gz JNTZCIPGQPIIJR-ZDUSSCGKSA-N 1 2 249.358 2.312 20 0 BEADLO O=C(C1CCCCCC1)N1CC(n2cc[nH+]c2)C1 ZINC000530703271 322890787 /nfs/dbraw/zinc/89/07/87/322890787.db2.gz CKFYSHGYBRIMAB-UHFFFAOYSA-N 1 2 247.342 2.237 20 0 BEADLO CCNC(=O)/C=C\c1ccc(-n2cc[nH+]c2)cc1 ZINC000255514102 322932890 /nfs/dbraw/zinc/93/28/90/322932890.db2.gz ZPZRSCOXMLCEIT-YVMONPNESA-N 1 2 241.294 2.022 20 0 BEADLO COc1cc([C@H](C)[NH2+][C@H](C)c2ccon2)ccn1 ZINC000569589979 322971352 /nfs/dbraw/zinc/97/13/52/322971352.db2.gz DDADDJZVADTHAM-VHSXEESVSA-N 1 2 247.298 2.490 20 0 BEADLO Cc1ccc(NC(=O)CCc2c[nH+]c[nH]2)cc1 ZINC000074727059 323002701 /nfs/dbraw/zinc/00/27/01/323002701.db2.gz UZFILMPXLGCYGE-UHFFFAOYSA-N 1 2 229.283 2.289 20 0 BEADLO Cc1ccc(NC(=O)CCc2c[nH]c[nH+]2)cc1 ZINC000074727059 323002702 /nfs/dbraw/zinc/00/27/02/323002702.db2.gz UZFILMPXLGCYGE-UHFFFAOYSA-N 1 2 229.283 2.289 20 0 BEADLO Cc1ccc(CNc2ccc(N(C)C)c[nH+]2)nc1 ZINC000150914841 323002797 /nfs/dbraw/zinc/00/27/97/323002797.db2.gz XRDSSYRQQUTEAF-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO C[C@H](CC(=O)NC1C(C)(C)C1(C)C)n1cc[nH+]c1 ZINC000565046037 323005941 /nfs/dbraw/zinc/00/59/41/323005941.db2.gz HWMNWUYHCAGLDU-SNVBAGLBSA-N 1 2 249.358 2.385 20 0 BEADLO Cc1nc(N[C@@H]2C[C@@H](C)O[C@@H](C)C2)cc[nH+]1 ZINC000245592816 323006726 /nfs/dbraw/zinc/00/67/26/323006726.db2.gz KZPYJNCSWMSGCO-DOFRTFSJSA-N 1 2 221.304 2.153 20 0 BEADLO C[C@H](N(C)C(=O)CCc1c[nH+]c[nH]1)C(C)(C)C ZINC000562255626 323013980 /nfs/dbraw/zinc/01/39/80/323013980.db2.gz XLXXFGQHJIFBBB-JTQLQIEISA-N 1 2 237.347 2.235 20 0 BEADLO C[C@H](N(C)C(=O)CCc1c[nH]c[nH+]1)C(C)(C)C ZINC000562255626 323013981 /nfs/dbraw/zinc/01/39/81/323013981.db2.gz XLXXFGQHJIFBBB-JTQLQIEISA-N 1 2 237.347 2.235 20 0 BEADLO CC[C@@H]1CN(c2[nH+]ccc3ccccc32)C[C@@H]1O ZINC000400275872 323015845 /nfs/dbraw/zinc/01/58/45/323015845.db2.gz GFVDLPCYGQLQBD-RISCZKNCSA-N 1 2 242.322 2.442 20 0 BEADLO CCCc1nc(C)c(C[NH2+]Cc2cncnc2)o1 ZINC000562338176 323016948 /nfs/dbraw/zinc/01/69/48/323016948.db2.gz KSCYDGGJQTVXSX-UHFFFAOYSA-N 1 2 246.314 2.015 20 0 BEADLO Cc1cc(NC(=O)N2CC[C@H]2C2CC2)c(C)c[nH+]1 ZINC000562596055 323025442 /nfs/dbraw/zinc/02/54/42/323025442.db2.gz AVBBUPTVDWNOBY-ZDUSSCGKSA-N 1 2 245.326 2.137 20 0 BEADLO CC(C)[N@H+](Cc1ccc(Cl)cn1)C1COC1 ZINC000562714946 323028865 /nfs/dbraw/zinc/02/88/65/323028865.db2.gz KHYXWHOYPWZEOT-UHFFFAOYSA-N 1 2 240.734 2.344 20 0 BEADLO CC(C)[N@@H+](Cc1ccc(Cl)cn1)C1COC1 ZINC000562714946 323028866 /nfs/dbraw/zinc/02/88/66/323028866.db2.gz KHYXWHOYPWZEOT-UHFFFAOYSA-N 1 2 240.734 2.344 20 0 BEADLO CCCc1csc(C[NH+]2CC(CF)C2)n1 ZINC000562738651 323029282 /nfs/dbraw/zinc/02/92/82/323029282.db2.gz UWAGEROQFPDOAT-UHFFFAOYSA-N 1 2 228.336 2.497 20 0 BEADLO CC[C@@H](NC(=O)Cn1cc[nH+]c1)c1ccccc1 ZINC000562733444 323029358 /nfs/dbraw/zinc/02/93/58/323029358.db2.gz DHBGCTBNYWQPBE-CYBMUJFWSA-N 1 2 243.310 2.151 20 0 BEADLO c1ccc(NCc2nnc(C3CC3)s2)[nH+]c1 ZINC000562732588 323029486 /nfs/dbraw/zinc/02/94/86/323029486.db2.gz ZZLFMGLLGBPCDH-UHFFFAOYSA-N 1 2 232.312 2.423 20 0 BEADLO C[C@H]1C[C@@H](NCC(C)(F)F)c2[nH+]ccn21 ZINC000562794101 323030866 /nfs/dbraw/zinc/03/08/66/323030866.db2.gz BMYNCUAVSGWGJN-JGVFFNPUSA-N 1 2 215.247 2.134 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N[C@H](C1CC1)C1CCC1 ZINC000562962934 323036793 /nfs/dbraw/zinc/03/67/93/323036793.db2.gz FGZUQZSDILXVSR-AWEZNQCLSA-N 1 2 247.342 2.037 20 0 BEADLO c1nc(C[N@@H+]2CCC[C@H]2c2ccccn2)c[nH]1 ZINC000569780496 323040373 /nfs/dbraw/zinc/04/03/73/323040373.db2.gz RVYWZJLUNSNCNN-ZDUSSCGKSA-N 1 2 228.299 2.142 20 0 BEADLO c1nc(C[N@H+]2CCC[C@H]2c2ccccn2)c[nH]1 ZINC000569780496 323040374 /nfs/dbraw/zinc/04/03/74/323040374.db2.gz RVYWZJLUNSNCNN-ZDUSSCGKSA-N 1 2 228.299 2.142 20 0 BEADLO c1ncc(C[N@@H+]2CCC[C@H]2c2ccccn2)[nH]1 ZINC000569780496 323040375 /nfs/dbraw/zinc/04/03/75/323040375.db2.gz RVYWZJLUNSNCNN-ZDUSSCGKSA-N 1 2 228.299 2.142 20 0 BEADLO c1ncc(C[N@H+]2CCC[C@H]2c2ccccn2)[nH]1 ZINC000569780496 323040376 /nfs/dbraw/zinc/04/03/76/323040376.db2.gz RVYWZJLUNSNCNN-ZDUSSCGKSA-N 1 2 228.299 2.142 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000570051535 323048834 /nfs/dbraw/zinc/04/88/34/323048834.db2.gz ZOIBNECCFSNEGF-DYEKYZERSA-N 1 2 249.358 2.385 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000570051533 323048925 /nfs/dbraw/zinc/04/89/25/323048925.db2.gz ZOIBNECCFSNEGF-BZPMIXESSA-N 1 2 249.358 2.385 20 0 BEADLO COCC1(CCNc2cc[nH+]c(C3CC3)n2)CC1 ZINC000570206188 323052768 /nfs/dbraw/zinc/05/27/68/323052768.db2.gz CLMZJRVAIWQKTE-UHFFFAOYSA-N 1 2 247.342 2.005 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CC[C@@H]3C[C@@H]3C2)c(C)c[nH+]1 ZINC000570318904 323056042 /nfs/dbraw/zinc/05/60/42/323056042.db2.gz XROKFVLKQAVPLJ-JHJVBQTASA-N 1 2 244.338 2.495 20 0 BEADLO CC[C@@H]1CN(c2nc(C)[nH+]cc2C)C[C@@H](C)O1 ZINC000570408949 323058839 /nfs/dbraw/zinc/05/88/39/323058839.db2.gz CMAFAGGRGQYNOD-ZYHUDNBSSA-N 1 2 235.331 2.097 20 0 BEADLO C[C@@H]1CC[C@H](CNc2cc(NC3CC3)nc[nH+]2)O1 ZINC000570421041 323059049 /nfs/dbraw/zinc/05/90/49/323059049.db2.gz DTPSAJJFTHWJEM-MWLCHTKSSA-N 1 2 248.330 2.030 20 0 BEADLO C[C@@H]1CC[C@H](CNc2cc(NC3CC3)[nH+]cn2)O1 ZINC000570421041 323059050 /nfs/dbraw/zinc/05/90/50/323059050.db2.gz DTPSAJJFTHWJEM-MWLCHTKSSA-N 1 2 248.330 2.030 20 0 BEADLO Cc1cscc1NC(=O)[C@@H](C)[NH+]1CC(C)C1 ZINC000570643011 323065824 /nfs/dbraw/zinc/06/58/24/323065824.db2.gz JOOZVOOGMBPNIV-SNVBAGLBSA-N 1 2 238.356 2.335 20 0 BEADLO CCc1cnn(Cc2c[nH+]ccc2C)c1 ZINC000570645720 323066013 /nfs/dbraw/zinc/06/60/13/323066013.db2.gz HKVOPINJKUJJRG-UHFFFAOYSA-N 1 2 201.273 2.197 20 0 BEADLO COc1ccc(C[N@@H+]2CCC[C@H](F)C2)cn1 ZINC000570689876 323067244 /nfs/dbraw/zinc/06/72/44/323067244.db2.gz YFIPTDVZKXGXLY-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO COc1ccc(C[N@H+]2CCC[C@H](F)C2)cn1 ZINC000570689876 323067245 /nfs/dbraw/zinc/06/72/45/323067245.db2.gz YFIPTDVZKXGXLY-NSHDSACASA-N 1 2 224.279 2.024 20 0 BEADLO C[C@@H]1CC[C@@H]1NC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000570733286 323068958 /nfs/dbraw/zinc/06/89/58/323068958.db2.gz KILYZNYJQSCAJM-KOLCDFICSA-N 1 2 244.298 2.254 20 0 BEADLO Cc1nc(N[C@H]2CO[C@@H](C)C2)c2c([nH+]1)CCCC2 ZINC000563053022 323082928 /nfs/dbraw/zinc/08/29/28/323082928.db2.gz UGKAYNGMYSXSCK-GXSJLCMTSA-N 1 2 247.342 2.253 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)[C@@H]1CCCC[C@@H]1C1CC1 ZINC000563180003 323100328 /nfs/dbraw/zinc/10/03/28/323100328.db2.gz IARMCWMQBXNPGZ-VXGBXAGGSA-N 1 2 247.342 2.242 20 0 BEADLO C[C@@H](CC(=O)N1C[C@@H]2CCC[C@@H]2C1)n1cc[nH+]c1 ZINC000563216446 323103078 /nfs/dbraw/zinc/10/30/78/323103078.db2.gz GTZJFBOWVANDME-RWMBFGLXSA-N 1 2 247.342 2.093 20 0 BEADLO C[C@@H](N(C)C(=O)C[C@H](C)n1cc[nH+]c1)C1(C)CC1 ZINC000563216214 323103085 /nfs/dbraw/zinc/10/30/85/323103085.db2.gz GPEIEHRNEZAXGD-NWDGAFQWSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@H](CC(=O)N[C@@H]1CCC1(C)C)n1cc[nH+]c1 ZINC000563220184 323104670 /nfs/dbraw/zinc/10/46/70/323104670.db2.gz GYFBEGPYYGBKNE-GHMZBOCLSA-N 1 2 235.331 2.139 20 0 BEADLO C[C@@H](CC(=O)N[C@@H]1CCC1(C)C)n1cc[nH+]c1 ZINC000563220187 323104689 /nfs/dbraw/zinc/10/46/89/323104689.db2.gz GYFBEGPYYGBKNE-WDEREUQCSA-N 1 2 235.331 2.139 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@H]1CCCC[C@H]1C ZINC000565434103 323107027 /nfs/dbraw/zinc/10/70/27/323107027.db2.gz SVSZOBQJUSYBQL-NQBHXWOUSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@H]1CCCC[C@H]1C ZINC000565434103 323107028 /nfs/dbraw/zinc/10/70/28/323107028.db2.gz SVSZOBQJUSYBQL-NQBHXWOUSA-N 1 2 249.358 2.283 20 0 BEADLO Cc1ncc(C(=O)Nc2cc(C)[nH+]cc2C)s1 ZINC000534300378 323115777 /nfs/dbraw/zinc/11/57/77/323115777.db2.gz XLFHELOXWRIEQB-UHFFFAOYSA-N 1 2 247.323 2.138 20 0 BEADLO Cc1cc(NC(=O)C2CC=CC2)c(C)c[nH+]1 ZINC000534300243 323115784 /nfs/dbraw/zinc/11/57/84/323115784.db2.gz USKFNRYGUAWTCH-UHFFFAOYSA-N 1 2 216.284 2.025 20 0 BEADLO CC(C)[C@H](C)[NH2+]Cc1[nH]ncc1Br ZINC000308147642 323131864 /nfs/dbraw/zinc/13/18/64/323131864.db2.gz MPOZEOPUMVHGCT-ZETCQYMHSA-N 1 2 246.152 2.306 20 0 BEADLO CC1(C)C[C@@H]1[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000571412575 323144137 /nfs/dbraw/zinc/14/41/37/323144137.db2.gz BVMSZFXLQAFGBB-RYUDHWBXSA-N 1 2 242.326 2.282 20 0 BEADLO Cc1cc(NC(=O)N2CCC[C@H]2C)c(C)c[nH+]1 ZINC000535059875 323164860 /nfs/dbraw/zinc/16/48/60/323164860.db2.gz XGHFOADIWODAKT-LLVKDONJSA-N 1 2 233.315 2.137 20 0 BEADLO CC[C@@](C)(NCc1[nH+]ccn1C)C(F)(F)F ZINC000309991493 323169803 /nfs/dbraw/zinc/16/98/03/323169803.db2.gz BDNOOIWDAACVIW-SECBINFHSA-N 1 2 235.253 2.241 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@H+]1[C@H](C)C[C@@H]1C ZINC000532064173 323170589 /nfs/dbraw/zinc/17/05/89/323170589.db2.gz QYAWXCKLROMKNV-NGZCFLSTSA-N 1 2 239.340 2.445 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000532064173 323170590 /nfs/dbraw/zinc/17/05/90/323170590.db2.gz QYAWXCKLROMKNV-NGZCFLSTSA-N 1 2 239.340 2.445 20 0 BEADLO C[C@@H]1[C@@H](C)CC[N@@H+]1Cc1nnsc1Cl ZINC000306159319 323172478 /nfs/dbraw/zinc/17/24/78/323172478.db2.gz NOQIMBTXNZPWPQ-NKWVEPMBSA-N 1 2 231.752 2.422 20 0 BEADLO C[C@@H]1[C@@H](C)CC[N@H+]1Cc1nnsc1Cl ZINC000306159319 323172479 /nfs/dbraw/zinc/17/24/79/323172479.db2.gz NOQIMBTXNZPWPQ-NKWVEPMBSA-N 1 2 231.752 2.422 20 0 BEADLO C[C@@H](C(=O)NC(C)(C)c1[nH]cc[nH+]1)C1CCC1 ZINC000563721519 323175808 /nfs/dbraw/zinc/17/58/08/323175808.db2.gz GZWHDJDWHQRNKP-SECBINFHSA-N 1 2 235.331 2.197 20 0 BEADLO Cc1cncc([C@@H](C)[NH2+]Cc2ncccn2)c1 ZINC000563821384 323179396 /nfs/dbraw/zinc/17/93/96/323179396.db2.gz HUXCJCBZLRGESH-LLVKDONJSA-N 1 2 228.299 2.031 20 0 BEADLO Cc1cc(C)cc(C[NH2+][C@H](C)c2ncn(C)n2)c1 ZINC000391843669 323183362 /nfs/dbraw/zinc/18/33/62/323183362.db2.gz NLIMTBAICODDJM-GFCCVEGCSA-N 1 2 244.342 2.283 20 0 BEADLO COc1cccc(C[NH2+][C@@H](C)c2csnn2)c1 ZINC000398483506 323185896 /nfs/dbraw/zinc/18/58/96/323185896.db2.gz SSNNDCCCEHOSRB-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO C[C@@H](CC(=O)N1CCC2(CCC2)C1)n1cc[nH+]c1 ZINC000563890570 323186737 /nfs/dbraw/zinc/18/67/37/323186737.db2.gz RMCCEFZFYPMMGR-LBPRGKRZSA-N 1 2 247.342 2.237 20 0 BEADLO CC(C)[C@@H](C)CNc1nc(N)c2ccccc2[nH+]1 ZINC000535720928 323189170 /nfs/dbraw/zinc/18/91/70/323189170.db2.gz IARWVTJOHGIBQC-JTQLQIEISA-N 1 2 244.342 2.168 20 0 BEADLO Cc1ccc(C(=O)Nc2cc(C)[nH+]cc2C)cn1 ZINC000535747884 323190286 /nfs/dbraw/zinc/19/02/86/323190286.db2.gz OHVGYKFQMQSNCR-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO Cc1cc(N(C)Cc2cccc(O)c2)nc[nH+]1 ZINC000535795490 323191721 /nfs/dbraw/zinc/19/17/21/323191721.db2.gz ISGDCJCIDWWLIK-UHFFFAOYSA-N 1 2 229.283 2.127 20 0 BEADLO C[N@@H+](Cc1noc(C(C)(C)C)n1)CC1CC1 ZINC000052128379 323192504 /nfs/dbraw/zinc/19/25/04/323192504.db2.gz WYHIUVYCPWAIJR-UHFFFAOYSA-N 1 2 223.320 2.209 20 0 BEADLO C[N@H+](Cc1noc(C(C)(C)C)n1)CC1CC1 ZINC000052128379 323192505 /nfs/dbraw/zinc/19/25/05/323192505.db2.gz WYHIUVYCPWAIJR-UHFFFAOYSA-N 1 2 223.320 2.209 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2C[C@@H]2C2CC2)c(C)c[nH+]1 ZINC000536574325 323197994 /nfs/dbraw/zinc/19/79/94/323197994.db2.gz BNYWAXLZRNUDCM-VXGBXAGGSA-N 1 2 230.311 2.105 20 0 BEADLO Cc1cc(NC(=O)NCC(C)(C)C)c(C)c[nH+]1 ZINC000536619201 323198631 /nfs/dbraw/zinc/19/86/31/323198631.db2.gz MHLUBBKJQLPCBH-UHFFFAOYSA-N 1 2 235.331 2.288 20 0 BEADLO Cc1cc(NC(=O)N(C)C2CCC2)c(C)c[nH+]1 ZINC000536619461 323198823 /nfs/dbraw/zinc/19/88/23/323198823.db2.gz GWXGNTQPLGUTEK-UHFFFAOYSA-N 1 2 233.315 2.137 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2CCC[C@@H]2C)c(C)c[nH+]1 ZINC000536619809 323198933 /nfs/dbraw/zinc/19/89/33/323198933.db2.gz CXLMLMSDYDMVRD-CABZTGNLSA-N 1 2 247.342 2.430 20 0 BEADLO CCOc1cccc(C[NH2+]Cc2cc(C)on2)n1 ZINC000532168762 323208257 /nfs/dbraw/zinc/20/82/57/323208257.db2.gz OVXJKPFCWSWZSY-UHFFFAOYSA-N 1 2 247.298 2.067 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@H](C)c1ccccc1C ZINC000042210576 323243388 /nfs/dbraw/zinc/24/33/88/323243388.db2.gz AHPWAAINTFLQLH-GHMZBOCLSA-N 1 2 221.300 2.207 20 0 BEADLO CCN(C(=O)Cc1c[nH+]cn1C)C1CCCCC1 ZINC000547603930 323253397 /nfs/dbraw/zinc/25/33/97/323253397.db2.gz ADCLFCAYKXZZJY-UHFFFAOYSA-N 1 2 249.358 2.144 20 0 BEADLO Cc1nccnc1[C@@H](C)[NH2+]Cc1ncccc1F ZINC000530370838 323383230 /nfs/dbraw/zinc/38/32/30/323383230.db2.gz HNUQBVJXRLUDKO-SNVBAGLBSA-N 1 2 246.289 2.170 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CCC(C)(C)O2)c(C)c[nH+]1 ZINC000571973230 323514457 /nfs/dbraw/zinc/51/44/57/323514457.db2.gz MZPRPQFRWFQSBB-GFCCVEGCSA-N 1 2 248.326 2.016 20 0 BEADLO c1csc(-c2n[nH]cc2CNc2c[nH]c[nH+]2)c1 ZINC000572335759 323598884 /nfs/dbraw/zinc/59/88/84/323598884.db2.gz MOHFLVVKPHLRJD-UHFFFAOYSA-N 1 2 245.311 2.473 20 0 BEADLO COc1ccc[nH+]c1N1C[C@@H]2[C@H](C1)C2(C)C ZINC000527912309 323720169 /nfs/dbraw/zinc/72/01/69/323720169.db2.gz IKZAJILNRMGQCN-AOOOYVTPSA-N 1 2 218.300 2.182 20 0 BEADLO CCn1ncc(C[NH2+][C@H](C)c2cc(C)c(C)o2)n1 ZINC000527924030 323730818 /nfs/dbraw/zinc/73/08/18/323730818.db2.gz NISRIBZFUCXMNA-SNVBAGLBSA-N 1 2 248.330 2.359 20 0 BEADLO COc1ccc[nH+]c1N1C[C@H](C)OC2(CCC2)C1 ZINC000528038651 323744828 /nfs/dbraw/zinc/74/48/28/323744828.db2.gz ATUWSTXZQVKYNS-NSHDSACASA-N 1 2 248.326 2.238 20 0 BEADLO COCCC1CCN(c2cc(C)[nH+]cn2)CC1 ZINC000528086262 323761328 /nfs/dbraw/zinc/76/13/28/323761328.db2.gz LYBLDCIQZVQVJX-UHFFFAOYSA-N 1 2 235.331 2.038 20 0 BEADLO CC(C)c1nc(N[C@@H]2[C@H](C)O[C@H](C)[C@H]2C)cc[nH+]1 ZINC000528204667 323780487 /nfs/dbraw/zinc/78/04/87/323780487.db2.gz IPTYNTPQDIGINW-DCQANWLSSA-N 1 2 249.358 2.246 20 0 BEADLO CC[N@H+](Cc1ccoc1)[C@H](C)c1nccc(N)n1 ZINC000653536510 487960655 /nfs/dbraw/zinc/96/06/55/487960655.db2.gz YDIRYPIYAGPDPT-SNVBAGLBSA-N 1 2 246.314 2.065 20 0 BEADLO CC[N@@H+](Cc1ccoc1)[C@H](C)c1nccc(N)n1 ZINC000653536510 487960661 /nfs/dbraw/zinc/96/06/61/487960661.db2.gz YDIRYPIYAGPDPT-SNVBAGLBSA-N 1 2 246.314 2.065 20 0 BEADLO CCn1cc(C[N@H+](C)Cc2c(C)noc2C)cn1 ZINC000072982058 324070489 /nfs/dbraw/zinc/07/04/89/324070489.db2.gz JVMNSEXCEJVRDH-UHFFFAOYSA-N 1 2 248.330 2.140 20 0 BEADLO CCn1cc(C[N@@H+](C)Cc2c(C)noc2C)cn1 ZINC000072982058 324070492 /nfs/dbraw/zinc/07/04/92/324070492.db2.gz JVMNSEXCEJVRDH-UHFFFAOYSA-N 1 2 248.330 2.140 20 0 BEADLO Cc1ncc(C[NH2+]Cc2cncn2C(C)C)o1 ZINC000398009511 324216045 /nfs/dbraw/zinc/21/60/45/324216045.db2.gz ZFQQIQRCIXWRBM-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO C[C@H](CC(=O)N[C@H](C)c1[nH]cc[nH+]1)c1ccco1 ZINC000529411716 324290249 /nfs/dbraw/zinc/29/02/49/324290249.db2.gz GDALRXPQVMBRMF-NXEZZACHSA-N 1 2 247.298 2.374 20 0 BEADLO Cc1cocc1C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000529457823 324304966 /nfs/dbraw/zinc/30/49/66/324304966.db2.gz MDAXUQMJPODNEP-GXSJLCMTSA-N 1 2 245.282 2.220 20 0 BEADLO C[N@H+](CCO)Cc1c(F)ccc(F)c1Cl ZINC000529516396 324321644 /nfs/dbraw/zinc/32/16/44/324321644.db2.gz JDEOKZLPKNFTBI-UHFFFAOYSA-N 1 2 235.661 2.042 20 0 BEADLO C[N@@H+](CCO)Cc1c(F)ccc(F)c1Cl ZINC000529516396 324321650 /nfs/dbraw/zinc/32/16/50/324321650.db2.gz JDEOKZLPKNFTBI-UHFFFAOYSA-N 1 2 235.661 2.042 20 0 BEADLO C[C@H]1C[C@@H]([NH2+]Cc2ccc(F)cn2)c2nccn21 ZINC000529594661 324357220 /nfs/dbraw/zinc/35/72/20/324357220.db2.gz FGGISTXTAFRXJM-JOYOIKCWSA-N 1 2 246.289 2.213 20 0 BEADLO CCn1ccnc1[C@H](C)[NH2+]Cc1ccc(F)cn1 ZINC000529597518 324358082 /nfs/dbraw/zinc/35/80/82/324358082.db2.gz VDSSMLHIAMNXHH-JTQLQIEISA-N 1 2 248.305 2.288 20 0 BEADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1ccc(F)cn1 ZINC000529597519 324358166 /nfs/dbraw/zinc/35/81/66/324358166.db2.gz VDSSMLHIAMNXHH-SNVBAGLBSA-N 1 2 248.305 2.288 20 0 BEADLO CCc1ncc(C[NH2+]Cc2ccc(F)cn2)o1 ZINC000529597550 324358889 /nfs/dbraw/zinc/35/88/89/324358889.db2.gz VYMATUGJABYKGK-UHFFFAOYSA-N 1 2 235.262 2.061 20 0 BEADLO COCCC1(C)C[NH+](Cc2ccc(F)cn2)C1 ZINC000529603742 324361940 /nfs/dbraw/zinc/36/19/40/324361940.db2.gz ALOGAQOWTDUVEZ-UHFFFAOYSA-N 1 2 238.306 2.079 20 0 BEADLO c1cc(CNc2c[nH+]c3c(c2)CCCC3)n[nH]1 ZINC000542924556 325063427 /nfs/dbraw/zinc/06/34/27/325063427.db2.gz RKIQYTBMDZJXKV-UHFFFAOYSA-N 1 2 228.299 2.296 20 0 BEADLO Cc1ccccc1[C@@H](C)[NH+]1CCS(=O)CC1 ZINC000131033098 325109900 /nfs/dbraw/zinc/10/99/00/325109900.db2.gz KDYOBWHAPFYYRI-GFCCVEGCSA-N 1 2 237.368 2.120 20 0 BEADLO COC(=O)C(C)(C)[NH2+]CCCc1ccc(C)cc1 ZINC000544142445 325132693 /nfs/dbraw/zinc/13/26/93/325132693.db2.gz ODTIBLWXAQHKSC-UHFFFAOYSA-N 1 2 249.354 2.469 20 0 BEADLO CCc1cnc(C[NH2+][C@@H](C)c2cnn(C)c2C)o1 ZINC000544485439 325145041 /nfs/dbraw/zinc/14/50/41/325145041.db2.gz CNYZKLKZDRFEIL-VIFPVBQESA-N 1 2 248.330 2.130 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2cccc(F)c2)o1 ZINC000544513962 325146282 /nfs/dbraw/zinc/14/62/82/325146282.db2.gz VHRGFURNJXIFFJ-QMMMGPOBSA-N 1 2 235.262 2.368 20 0 BEADLO C/C=C/C=C/C(=O)NCc1[nH+]ccn1CC(C)C ZINC000131532952 325161862 /nfs/dbraw/zinc/16/18/62/325161862.db2.gz IQKZPSSEBQYNLQ-YTXTXJHMSA-N 1 2 247.342 2.288 20 0 BEADLO Clc1snnc1C[NH+]1C[C@H]2CCC[C@@H]2C1 ZINC000132035360 325195938 /nfs/dbraw/zinc/19/59/38/325195938.db2.gz OTHMMOSNAZKVET-HTQZYQBOSA-N 1 2 243.763 2.423 20 0 BEADLO Cc1cc(NC(=O)CC2(O)CCCC2)cc[nH+]1 ZINC000073610120 325205922 /nfs/dbraw/zinc/20/59/22/325205922.db2.gz OFFYPSLGUZGYCS-UHFFFAOYSA-N 1 2 234.299 2.024 20 0 BEADLO COC(=O)[C@H]([NH2+]CCc1ccc(C)cc1)C(C)C ZINC000545885650 325241877 /nfs/dbraw/zinc/24/18/77/325241877.db2.gz URORYHHHMJGAKY-CQSZACIVSA-N 1 2 249.354 2.325 20 0 BEADLO CC[N@H+](C)Cc1nc([C@@H](C)OCC(C)C)no1 ZINC000074989957 325273175 /nfs/dbraw/zinc/27/31/75/325273175.db2.gz XNFMPQTWNCGNEF-SNVBAGLBSA-N 1 2 241.335 2.255 20 0 BEADLO CC[N@@H+](C)Cc1nc([C@@H](C)OCC(C)C)no1 ZINC000074989957 325273177 /nfs/dbraw/zinc/27/31/77/325273177.db2.gz XNFMPQTWNCGNEF-SNVBAGLBSA-N 1 2 241.335 2.255 20 0 BEADLO CC1=C(c2nc(Cc3c[nH+]cn3C)no2)CCC1 ZINC000546549384 325286290 /nfs/dbraw/zinc/28/62/90/325286290.db2.gz IFTKETONXBHPAD-UHFFFAOYSA-N 1 2 244.298 2.351 20 0 BEADLO c1c[nH+]c(CNc2ccn(-c3ccccc3)n2)[nH]1 ZINC000133698633 325310558 /nfs/dbraw/zinc/31/05/58/325310558.db2.gz SCDHOOVIXWFSTB-UHFFFAOYSA-N 1 2 239.282 2.208 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)no1 ZINC000075768774 325311181 /nfs/dbraw/zinc/31/11/81/325311181.db2.gz UEQJBNBYBVSFNZ-QWRGUYRKSA-N 1 2 235.331 2.397 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)no1 ZINC000075768774 325311183 /nfs/dbraw/zinc/31/11/83/325311183.db2.gz UEQJBNBYBVSFNZ-QWRGUYRKSA-N 1 2 235.331 2.397 20 0 BEADLO Cc1c[nH+]cc(N[C@@H](C)[C@@H]2CCOC2)c1 ZINC000134342647 325354524 /nfs/dbraw/zinc/35/45/24/325354524.db2.gz IXYGSTPDKSFWPZ-WDEREUQCSA-N 1 2 206.289 2.227 20 0 BEADLO COC[C@@H]([NH2+]Cc1ccc(C)cn1)c1ccco1 ZINC000134384603 325356372 /nfs/dbraw/zinc/35/63/72/325356372.db2.gz BHZVLLSNOPIOSU-CYBMUJFWSA-N 1 2 246.310 2.460 20 0 BEADLO CCCCC(=O)N(C)c1ccc[nH+]c1N(C)C ZINC000079725700 325464980 /nfs/dbraw/zinc/46/49/80/325464980.db2.gz CHCQKUIHBJVNPX-UHFFFAOYSA-N 1 2 235.331 2.301 20 0 BEADLO CC1(CNC(=O)Cn2cc[nH+]c2)CCCCCC1 ZINC000554142971 325708205 /nfs/dbraw/zinc/70/82/05/325708205.db2.gz QWJKUAJXDKHZIB-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO c1[nH]cc(N[C@@H]2Cc3[nH]c4ccccc4c3C2)[nH+]1 ZINC000555104928 325746989 /nfs/dbraw/zinc/74/69/89/325746989.db2.gz WFSREGHFHFOQMP-VIFPVBQESA-N 1 2 238.294 2.470 20 0 BEADLO CC(F)(F)C[NH2+]Cc1ccc(-c2cc[nH]n2)o1 ZINC000555609396 325764671 /nfs/dbraw/zinc/76/46/71/325764671.db2.gz KHZQNZVGGIRYNX-UHFFFAOYSA-N 1 2 241.241 2.415 20 0 BEADLO CC[C@@H](C)[C@@H](C)N(C(=O)Cn1cc[nH+]c1)C1CC1 ZINC000564639848 325799026 /nfs/dbraw/zinc/79/90/26/325799026.db2.gz ICWBHMWFCGLZMK-VXGBXAGGSA-N 1 2 249.358 2.309 20 0 BEADLO CC(C)(NC(=O)CCC(F)(F)F)c1[nH]cc[nH+]1 ZINC000565105970 325858471 /nfs/dbraw/zinc/85/84/71/325858471.db2.gz CCFVSVRQVWDNOR-UHFFFAOYSA-N 1 2 249.236 2.104 20 0 BEADLO CCC1(NC(=O)Cn2cc[nH+]c2)CCCCC1 ZINC000565464581 325914335 /nfs/dbraw/zinc/91/43/35/325914335.db2.gz OBUGNDGXUXUSHG-UHFFFAOYSA-N 1 2 235.331 2.112 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2C[C@H]2C2CCC2)cc[nH+]1 ZINC000566012616 325984270 /nfs/dbraw/zinc/98/42/70/325984270.db2.gz LOBMTEGVHKMTIZ-QWHCGFSZSA-N 1 2 230.311 2.187 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@H]1C[C@H]1C1CCC1 ZINC000566144087 326002383 /nfs/dbraw/zinc/00/23/83/326002383.db2.gz RJLODSUBKNOMLD-WCQYABFASA-N 1 2 245.326 2.122 20 0 BEADLO Cn1ncc2c1nc[nH+]c2N[C@H]1CCC[C@H](F)C1 ZINC000566161494 326004484 /nfs/dbraw/zinc/00/44/84/326004484.db2.gz ZUYXNYXUZRRBGK-IUCAKERBSA-N 1 2 249.293 2.056 20 0 BEADLO COc1cc(C[N@@H+]2CCC(=O)[C@@H](C)C2)ccc1C ZINC000566415711 326041593 /nfs/dbraw/zinc/04/15/93/326041593.db2.gz INEKAWNUXCSLTF-LBPRGKRZSA-N 1 2 247.338 2.415 20 0 BEADLO COc1cc(C[N@H+]2CCC(=O)[C@@H](C)C2)ccc1C ZINC000566415711 326041597 /nfs/dbraw/zinc/04/15/97/326041597.db2.gz INEKAWNUXCSLTF-LBPRGKRZSA-N 1 2 247.338 2.415 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1NC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000566467583 326052317 /nfs/dbraw/zinc/05/23/17/326052317.db2.gz VUWPBZJMOGYFCQ-NQBHXWOUSA-N 1 2 249.358 2.139 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1NC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000566467583 326052320 /nfs/dbraw/zinc/05/23/20/326052320.db2.gz VUWPBZJMOGYFCQ-NQBHXWOUSA-N 1 2 249.358 2.139 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CC[C@@](C)(F)C1 ZINC000566483366 326056460 /nfs/dbraw/zinc/05/64/60/326056460.db2.gz SRISWCGEAKISKY-LLVKDONJSA-N 1 2 209.268 2.032 20 0 BEADLO Cc1cc(N[C@@H]2CCCc3nn(C)cc32)nc[nH+]1 ZINC000566690776 326075238 /nfs/dbraw/zinc/07/52/38/326075238.db2.gz IJUHUXUKSNMNIC-LLVKDONJSA-N 1 2 243.314 2.008 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CCC[C@@H](F)C2)cn1 ZINC000566861940 326089371 /nfs/dbraw/zinc/08/93/71/326089371.db2.gz YBOJEKMQEZGMTN-GFCCVEGCSA-N 1 2 225.311 2.398 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccc(C)nc2)CCO1 ZINC000153727263 326110504 /nfs/dbraw/zinc/11/05/04/326110504.db2.gz KQVFYSMPFXVFJD-CYBMUJFWSA-N 1 2 220.316 2.001 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccc(C)nc2)CCO1 ZINC000153727263 326110506 /nfs/dbraw/zinc/11/05/06/326110506.db2.gz KQVFYSMPFXVFJD-CYBMUJFWSA-N 1 2 220.316 2.001 20 0 BEADLO C[C@@H](NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]21)c1[nH]cc[nH+]1 ZINC000567123414 326120227 /nfs/dbraw/zinc/12/02/27/326120227.db2.gz HGONURMIFWPFPR-ZNSHCXBVSA-N 1 2 233.315 2.023 20 0 BEADLO Cc1cc([NH2+]C[C@@H]2C[C@@H]2C)ccc1-n1cnnn1 ZINC000567302529 326159033 /nfs/dbraw/zinc/15/90/33/326159033.db2.gz ODGDXJQYRDRJBU-ONGXEEELSA-N 1 2 243.314 2.039 20 0 BEADLO CC[C@H]1CCCCN1C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000567403350 326183998 /nfs/dbraw/zinc/18/39/98/326183998.db2.gz MPAHAPKYTMFOTC-AAEUAGOBSA-N 1 2 249.358 2.379 20 0 BEADLO CC[C@H]1CCCCN1C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000567403350 326184000 /nfs/dbraw/zinc/18/40/00/326184000.db2.gz MPAHAPKYTMFOTC-AAEUAGOBSA-N 1 2 249.358 2.379 20 0 BEADLO CC[C@@H]1CCCCN1C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000567403351 326184043 /nfs/dbraw/zinc/18/40/43/326184043.db2.gz MPAHAPKYTMFOTC-DGCLKSJQSA-N 1 2 249.358 2.379 20 0 BEADLO CC[C@@H]1CCCCN1C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000567403351 326184045 /nfs/dbraw/zinc/18/40/45/326184045.db2.gz MPAHAPKYTMFOTC-DGCLKSJQSA-N 1 2 249.358 2.379 20 0 BEADLO Cc1cc(F)ccc1C(=O)Nc1cc[nH+]cc1O ZINC000155872174 326213854 /nfs/dbraw/zinc/21/38/54/326213854.db2.gz WSRSYNAKVXQOOV-UHFFFAOYSA-N 1 2 246.241 2.487 20 0 BEADLO C[C@@H](CC(=O)N1C[C@H](C)CC1(C)C)n1cc[nH+]c1 ZINC000568021436 326296975 /nfs/dbraw/zinc/29/69/75/326296975.db2.gz UHCMTHMSQXNRNG-NEPJUHHUSA-N 1 2 249.358 2.481 20 0 BEADLO CN(C)c1ncc(C[N@@H+]2CCC[C@H](F)C2)s1 ZINC000568054592 326301676 /nfs/dbraw/zinc/30/16/76/326301676.db2.gz WYCRCCCMKICOBC-VIFPVBQESA-N 1 2 243.351 2.143 20 0 BEADLO CN(C)c1ncc(C[N@H+]2CCC[C@H](F)C2)s1 ZINC000568054592 326301678 /nfs/dbraw/zinc/30/16/78/326301678.db2.gz WYCRCCCMKICOBC-VIFPVBQESA-N 1 2 243.351 2.143 20 0 BEADLO CCC(CC)C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000568069006 326303488 /nfs/dbraw/zinc/30/34/88/326303488.db2.gz YSLKOBWMDVHZET-UHFFFAOYSA-N 1 2 223.320 2.197 20 0 BEADLO CC[C@@H]1CCC[C@@H]1NC(=O)C[NH+]1CC(C)(C)C1 ZINC000568197178 326325031 /nfs/dbraw/zinc/32/50/31/326325031.db2.gz YOARZUGXQQYAOY-NEPJUHHUSA-N 1 2 238.375 2.023 20 0 BEADLO CC[C@@H]1CCC[C@H]1NC(=O)C[NH+]1CC(C)(C)C1 ZINC000568197181 326325046 /nfs/dbraw/zinc/32/50/46/326325046.db2.gz YOARZUGXQQYAOY-VXGBXAGGSA-N 1 2 238.375 2.023 20 0 BEADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1ncccn1)CC2 ZINC000568276947 326339967 /nfs/dbraw/zinc/33/99/67/326339967.db2.gz RKRJCBYNMQSKME-ZDUSSCGKSA-N 1 2 243.285 2.393 20 0 BEADLO CC[C@@H]1OCC[C@H]1Nc1cc(NC2CC2)[nH+]cn1 ZINC000568843833 326379042 /nfs/dbraw/zinc/37/90/42/326379042.db2.gz NYCCSEJNUBNELM-MNOVXSKESA-N 1 2 248.330 2.030 20 0 BEADLO CC[C@@H]1OCC[C@H]1Nc1cc(NC2CC2)nc[nH+]1 ZINC000568843833 326379043 /nfs/dbraw/zinc/37/90/43/326379043.db2.gz NYCCSEJNUBNELM-MNOVXSKESA-N 1 2 248.330 2.030 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NCCC1=CCCC1 ZINC000568880513 326380939 /nfs/dbraw/zinc/38/09/39/326380939.db2.gz LMMKMMSCEISFAN-NSHDSACASA-N 1 2 247.342 2.205 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NCCC1=CCCC1 ZINC000568880513 326380940 /nfs/dbraw/zinc/38/09/40/326380940.db2.gz LMMKMMSCEISFAN-NSHDSACASA-N 1 2 247.342 2.205 20 0 BEADLO C[C@H](NC(=O)Cn1cc[nH+]c1)[C@H]1CCC[C@@H](C)C1 ZINC000568956342 326383684 /nfs/dbraw/zinc/38/36/84/326383684.db2.gz BXQUSMSMRNBAJT-AGIUHOORSA-N 1 2 249.358 2.214 20 0 BEADLO Cc1cc([NH2+][C@H](C)[C@@H](C)O)cc(C)c1O ZINC000569096350 326389538 /nfs/dbraw/zinc/38/95/38/326389538.db2.gz ZRORLTALUAOKEU-NXEZZACHSA-N 1 2 209.289 2.190 20 0 BEADLO Cc1cc([NH2+][C@@H](C)[C@H](C)O)cc(C)c1O ZINC000569096351 326389674 /nfs/dbraw/zinc/38/96/74/326389674.db2.gz ZRORLTALUAOKEU-UWVGGRQHSA-N 1 2 209.289 2.190 20 0 BEADLO CC/C=C/CC[N@@H+]1C[C@H](O)CC(F)(F)C1 ZINC000682546800 487984674 /nfs/dbraw/zinc/98/46/74/487984674.db2.gz OFSYFNGKIXIPTJ-HMDXOVGESA-N 1 2 219.275 2.045 20 0 BEADLO CC/C=C/CC[N@H+]1C[C@H](O)CC(F)(F)C1 ZINC000682546800 487984679 /nfs/dbraw/zinc/98/46/79/487984679.db2.gz OFSYFNGKIXIPTJ-HMDXOVGESA-N 1 2 219.275 2.045 20 0 BEADLO CC1=CC[C@](C)(C(=O)NCc2[nH]cc[nH+]2)CC1 ZINC000668604520 487996771 /nfs/dbraw/zinc/99/67/71/487996771.db2.gz QADHDRNTIXXSNA-ZDUSSCGKSA-N 1 2 233.315 2.162 20 0 BEADLO CCc1cc(NC[C@H]2CCOC[C@H]2C)nc[nH+]1 ZINC000672329356 487997208 /nfs/dbraw/zinc/99/72/08/487997208.db2.gz BCDLDBZTHNIOFR-GHMZBOCLSA-N 1 2 235.331 2.124 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)C1[C@H]2CCCCCC[C@H]12 ZINC000668604282 487997367 /nfs/dbraw/zinc/99/73/67/487997367.db2.gz MWUWMKZGBJMYRS-QWRGUYRKSA-N 1 2 247.342 2.242 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccnc2)sn1 ZINC000682673925 488010695 /nfs/dbraw/zinc/01/06/95/488010695.db2.gz ZLVVMKFMYKSZIT-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccnc2)sn1 ZINC000682673925 488010699 /nfs/dbraw/zinc/01/06/99/488010699.db2.gz ZLVVMKFMYKSZIT-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CC(C)=CCSc1nc(N)cc(C)[nH+]1 ZINC000106004039 488012181 /nfs/dbraw/zinc/01/21/81/488012181.db2.gz UJQMZIXRVIOTQA-UHFFFAOYSA-N 1 2 209.318 2.426 20 0 BEADLO C[C@@H]1CC[C@H](C)N1c1cc(-n2cc[nH+]c2)ncn1 ZINC000675121030 488025749 /nfs/dbraw/zinc/02/57/49/488025749.db2.gz XQXMGSNNGZKZMM-PHIMTYICSA-N 1 2 243.314 2.040 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cnc(N)s2)nc1 ZINC000682787650 488042175 /nfs/dbraw/zinc/04/21/75/488042175.db2.gz CFCXJPHDSPLYIA-UHFFFAOYSA-N 1 2 248.355 2.061 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cnc(N)s2)nc1 ZINC000682787650 488042178 /nfs/dbraw/zinc/04/21/78/488042178.db2.gz CFCXJPHDSPLYIA-UHFFFAOYSA-N 1 2 248.355 2.061 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1CCC[C@@H]1C ZINC000656119829 488052695 /nfs/dbraw/zinc/05/26/95/488052695.db2.gz BGAJSGZYCJGEGU-WCBMZHEXSA-N 1 2 221.304 2.394 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1CCC[C@H]1C ZINC000656119827 488052780 /nfs/dbraw/zinc/05/27/80/488052780.db2.gz BGAJSGZYCJGEGU-PSASIEDQSA-N 1 2 221.304 2.394 20 0 BEADLO CC[C@H](Nc1cc2c(nn1)CCC2)c1[nH]cc[nH+]1 ZINC000682919378 488064286 /nfs/dbraw/zinc/06/42/86/488064286.db2.gz JXEOHYQIRYVWGZ-JTQLQIEISA-N 1 2 243.314 2.252 20 0 BEADLO CCc1cc(N[C@@H](C(C)C)C(C)(C)O)nc[nH+]1 ZINC000682922597 488065019 /nfs/dbraw/zinc/06/50/19/488065019.db2.gz PCRYRSGOFOIUDJ-LBPRGKRZSA-N 1 2 237.347 2.246 20 0 BEADLO CC1=CC[N@H+](Cc2cn(C3CCC3)nn2)CC1 ZINC000667650241 488073157 /nfs/dbraw/zinc/07/31/57/488073157.db2.gz QNBFOOQUYYCSEH-UHFFFAOYSA-N 1 2 232.331 2.155 20 0 BEADLO CC1=CC[N@@H+](Cc2cn(C3CCC3)nn2)CC1 ZINC000667650241 488073162 /nfs/dbraw/zinc/07/31/62/488073162.db2.gz QNBFOOQUYYCSEH-UHFFFAOYSA-N 1 2 232.331 2.155 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCOC(C)(C)C2)c1 ZINC000683001315 488083242 /nfs/dbraw/zinc/08/32/42/488083242.db2.gz NXWBZKHLCQOGJA-UHFFFAOYSA-N 1 2 220.316 2.001 20 0 BEADLO Cc1ccnc(C[N@H+]2CCOC(C)(C)C2)c1 ZINC000683001315 488083244 /nfs/dbraw/zinc/08/32/44/488083244.db2.gz NXWBZKHLCQOGJA-UHFFFAOYSA-N 1 2 220.316 2.001 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@H]1C[C@H]2C[C@H]2C1 ZINC000667679729 488084257 /nfs/dbraw/zinc/08/42/57/488084257.db2.gz MPHMMSOBJUPLCW-MYJAWHEDSA-N 1 2 232.283 2.075 20 0 BEADLO C[N@H+](Cc1ccsc1)Cc1ncccn1 ZINC000683003237 488085247 /nfs/dbraw/zinc/08/52/47/488085247.db2.gz OOBGFPDIKQSUTA-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO C[N@@H+](Cc1ccsc1)Cc1ncccn1 ZINC000683003237 488085257 /nfs/dbraw/zinc/08/52/57/488085257.db2.gz OOBGFPDIKQSUTA-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1cc(C)ccn1 ZINC000683010090 488089097 /nfs/dbraw/zinc/08/90/97/488089097.db2.gz WPHXSBWERIAYSU-ZDUSSCGKSA-N 1 2 220.316 2.001 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1cc(C)ccn1 ZINC000683010090 488089098 /nfs/dbraw/zinc/08/90/98/488089098.db2.gz WPHXSBWERIAYSU-ZDUSSCGKSA-N 1 2 220.316 2.001 20 0 BEADLO CCc1nnc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)o1 ZINC000677713906 488098153 /nfs/dbraw/zinc/09/81/53/488098153.db2.gz NEJDPFJADZUUBO-SSDOTTSWSA-N 1 2 249.236 2.016 20 0 BEADLO CCc1nnc(C[N@H+]2CC[C@@H](C(F)(F)F)C2)o1 ZINC000677713906 488098155 /nfs/dbraw/zinc/09/81/55/488098155.db2.gz NEJDPFJADZUUBO-SSDOTTSWSA-N 1 2 249.236 2.016 20 0 BEADLO CCCc1noc(C[N@@H+]2CC[C@@H](C(F)F)C2)n1 ZINC000677734552 488112293 /nfs/dbraw/zinc/11/22/93/488112293.db2.gz OGRMGDSOKIIJRZ-MRVPVSSYSA-N 1 2 245.273 2.109 20 0 BEADLO CCCc1noc(C[N@H+]2CC[C@@H](C(F)F)C2)n1 ZINC000677734552 488112297 /nfs/dbraw/zinc/11/22/97/488112297.db2.gz OGRMGDSOKIIJRZ-MRVPVSSYSA-N 1 2 245.273 2.109 20 0 BEADLO CC[C@@H](CC(C)C)C(=O)NCc1c[nH+]cn1C ZINC000451812928 488114308 /nfs/dbraw/zinc/11/43/08/488114308.db2.gz HVSGAEOWSOEGEG-NSHDSACASA-N 1 2 237.347 2.109 20 0 BEADLO Cc1nc(C)c(C[N@@H+](C)Cc2cccnc2)o1 ZINC000685569516 487551683 /nfs/dbraw/zinc/55/16/83/487551683.db2.gz NSUOMFFQMGQOBO-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1nc(C)c(C[N@H+](C)Cc2cccnc2)o1 ZINC000685569516 487551684 /nfs/dbraw/zinc/55/16/84/487551684.db2.gz NSUOMFFQMGQOBO-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cn1c2ccccc2[nH+]c1N1CC[C@@H]2C[C@@H]2C1 ZINC000664524208 487552799 /nfs/dbraw/zinc/55/27/99/487552799.db2.gz KJMCHPMKRWKYPK-GHMZBOCLSA-N 1 2 227.311 2.420 20 0 BEADLO CC(C)n1cc[nH+]c1CN(C)Cc1ccc[nH]1 ZINC000673897017 487472709 /nfs/dbraw/zinc/47/27/09/487472709.db2.gz COLGGXMAQSKMGE-UHFFFAOYSA-N 1 2 232.331 2.424 20 0 BEADLO Cn1ccc(C[NH2+]Cc2n[nH]c3ccccc32)c1 ZINC000673930455 487483019 /nfs/dbraw/zinc/48/30/19/487483019.db2.gz WFGLWDKVSDNNEY-UHFFFAOYSA-N 1 2 240.310 2.191 20 0 BEADLO Cc1cn2c(n1)C[N@H+]([C@H](C)c1ccncc1)CC2 ZINC000679870811 487478954 /nfs/dbraw/zinc/47/89/54/487478954.db2.gz FNYHJOGESMNDAT-GFCCVEGCSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1cn2c(n1)C[N@@H+]([C@H](C)c1ccncc1)CC2 ZINC000679870811 487478957 /nfs/dbraw/zinc/47/89/57/487478957.db2.gz FNYHJOGESMNDAT-GFCCVEGCSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1cn2c(n1)C[N@H+]([C@@H](C)c1ccncc1)CC2 ZINC000679870812 487479511 /nfs/dbraw/zinc/47/95/11/487479511.db2.gz FNYHJOGESMNDAT-LBPRGKRZSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1cn2c(n1)C[N@@H+]([C@@H](C)c1ccncc1)CC2 ZINC000679870812 487479513 /nfs/dbraw/zinc/47/95/13/487479513.db2.gz FNYHJOGESMNDAT-LBPRGKRZSA-N 1 2 242.326 2.163 20 0 BEADLO CCCC1(C(=O)N[C@H](C)c2[nH]cc[nH+]2)CC1 ZINC000380784426 487486281 /nfs/dbraw/zinc/48/62/81/487486281.db2.gz CNPVOCHFZREBGY-SECBINFHSA-N 1 2 221.304 2.167 20 0 BEADLO CC(C)C[C@H](C)C[N@@H+]1C[C@H](O)CC(F)(F)C1 ZINC000685004704 487486623 /nfs/dbraw/zinc/48/66/23/487486623.db2.gz KBOREBHMMGSCQX-WDEREUQCSA-N 1 2 235.318 2.371 20 0 BEADLO CC(C)C[C@H](C)C[N@H+]1C[C@H](O)CC(F)(F)C1 ZINC000685004704 487486625 /nfs/dbraw/zinc/48/66/25/487486625.db2.gz KBOREBHMMGSCQX-WDEREUQCSA-N 1 2 235.318 2.371 20 0 BEADLO CC(C)C[C@@H](C)C[N@@H+]1C[C@H](O)CC(F)(F)C1 ZINC000685004701 487491488 /nfs/dbraw/zinc/49/14/88/487491488.db2.gz KBOREBHMMGSCQX-GHMZBOCLSA-N 1 2 235.318 2.371 20 0 BEADLO CC(C)C[C@@H](C)C[N@H+]1C[C@H](O)CC(F)(F)C1 ZINC000685004701 487491490 /nfs/dbraw/zinc/49/14/90/487491490.db2.gz KBOREBHMMGSCQX-GHMZBOCLSA-N 1 2 235.318 2.371 20 0 BEADLO CC(C)CCO[C@@H]1CC[N@H+](Cc2cocn2)C1 ZINC000191943940 487490312 /nfs/dbraw/zinc/49/03/12/487490312.db2.gz KLAPWWCVYMPDPS-CYBMUJFWSA-N 1 2 238.331 2.312 20 0 BEADLO CC(C)CCO[C@@H]1CC[N@@H+](Cc2cocn2)C1 ZINC000191943940 487490320 /nfs/dbraw/zinc/49/03/20/487490320.db2.gz KLAPWWCVYMPDPS-CYBMUJFWSA-N 1 2 238.331 2.312 20 0 BEADLO CCC1C[NH+](Cc2cc(C(F)(F)F)nn2C)C1 ZINC000668229231 487490451 /nfs/dbraw/zinc/49/04/51/487490451.db2.gz BILDWWCXGGASOG-UHFFFAOYSA-N 1 2 247.264 2.281 20 0 BEADLO CC[C@](C)(NCc1[nH+]ccn1C)C(F)(F)F ZINC000309991494 487494871 /nfs/dbraw/zinc/49/48/71/487494871.db2.gz BDNOOIWDAACVIW-VIFPVBQESA-N 1 2 235.253 2.241 20 0 BEADLO CO[C@@H]1CCCN(c2cc[nH+]c(C3CC3)n2)CC1 ZINC000679933262 487497158 /nfs/dbraw/zinc/49/71/58/487497158.db2.gz GHGBBCKRLGAWJQ-GFCCVEGCSA-N 1 2 247.342 2.359 20 0 BEADLO CC(C)(C)c1nc(NC2CCOCC2)cc[nH+]1 ZINC000674064032 487506528 /nfs/dbraw/zinc/50/65/28/487506528.db2.gz ISUJBBZOTGMWKA-UHFFFAOYSA-N 1 2 235.331 2.365 20 0 BEADLO CCc1cc(N[C@H](C)C[C@H]2CCOC2)nc[nH+]1 ZINC000675291707 487503807 /nfs/dbraw/zinc/50/38/07/487503807.db2.gz XLBIIXFFXAUVRJ-GHMZBOCLSA-N 1 2 235.331 2.266 20 0 BEADLO Cc1cc(NC[C@@H](C)c2ccncc2)nc[nH+]1 ZINC000674067051 487508486 /nfs/dbraw/zinc/50/84/86/487508486.db2.gz YSFYOWLSBZRIJM-SNVBAGLBSA-N 1 2 228.299 2.396 20 0 BEADLO CCc1cc(N[C@H](C)Cc2ccncc2)nc[nH+]1 ZINC000674068130 487508904 /nfs/dbraw/zinc/50/89/04/487508904.db2.gz SKTSMZFOCOEATF-LLVKDONJSA-N 1 2 242.326 2.477 20 0 BEADLO CC[C@H](C)CN(CC)c1cc(CO)cc[nH+]1 ZINC000086438251 487509774 /nfs/dbraw/zinc/50/97/74/487509774.db2.gz VVKFVSLHYCCJAE-NSHDSACASA-N 1 2 222.332 2.446 20 0 BEADLO CCC1(C(=O)N2CCC[C@H](n3cc[nH+]c3)C2)CC1 ZINC000674090432 487516727 /nfs/dbraw/zinc/51/67/27/487516727.db2.gz YNLBHRKOMWHUPH-LBPRGKRZSA-N 1 2 247.342 2.237 20 0 BEADLO CC(C)(C)n1cc(N[C@@H]2CCn3cc[nH+]c32)cn1 ZINC000334542811 487521731 /nfs/dbraw/zinc/52/17/31/487521731.db2.gz AWIRYDOXTLXTFE-LLVKDONJSA-N 1 2 245.330 2.392 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H](C)C1CCCC1 ZINC000674136195 487525682 /nfs/dbraw/zinc/52/56/82/487525682.db2.gz LGUJPHFLBFNHKF-SECBINFHSA-N 1 2 235.331 2.161 20 0 BEADLO CCC[N@H+](Cc1nnc(CC)s1)C1CC1 ZINC000680050112 487527194 /nfs/dbraw/zinc/52/71/94/487527194.db2.gz NYXNJDJYNFGBFR-UHFFFAOYSA-N 1 2 225.361 2.475 20 0 BEADLO CCC[N@@H+](Cc1nnc(CC)s1)C1CC1 ZINC000680050112 487527198 /nfs/dbraw/zinc/52/71/98/487527198.db2.gz NYXNJDJYNFGBFR-UHFFFAOYSA-N 1 2 225.361 2.475 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1ncnn1C(C)C ZINC000383464361 487588438 /nfs/dbraw/zinc/58/84/38/487588438.db2.gz KBZHWQVNLKPGRX-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO Cc1ccc(Cc2noc(-c3cocn3)n2)c[nH+]1 ZINC000680713009 487638697 /nfs/dbraw/zinc/63/86/97/487638697.db2.gz NZHYUPDMXAJGDD-UHFFFAOYSA-N 1 2 242.238 2.019 20 0 BEADLO Cc1cc(N2CC[C@H](C3CCC3)C2)nc[nH+]1 ZINC000665755807 487766727 /nfs/dbraw/zinc/76/67/27/487766727.db2.gz RMUQXOGGOPFCGM-LBPRGKRZSA-N 1 2 217.316 2.411 20 0 BEADLO CCc1cc(N[C@@H]2CCC[C@@H]3OCC[C@@H]32)nc[nH+]1 ZINC000675449119 487870643 /nfs/dbraw/zinc/87/06/43/487870643.db2.gz PYASTYBZJJZZRX-UPJWGTAASA-N 1 2 247.342 2.409 20 0 BEADLO c1[nH+]c2n(c1CN1Cc3ccccc3C1)CCC2 ZINC000667602141 488057151 /nfs/dbraw/zinc/05/71/51/488057151.db2.gz UDXUUKOFPAZHMK-UHFFFAOYSA-N 1 2 239.322 2.345 20 0 BEADLO Cc1cnc(Nc2ccc3c(c2)[nH+]cn3C)nc1 ZINC000677509175 488058838 /nfs/dbraw/zinc/05/88/38/488058838.db2.gz JHVRYNDMQJPTSI-UHFFFAOYSA-N 1 2 239.282 2.415 20 0 BEADLO C[C@H]([NH2+]Cc1c[nH]cn1)c1ccsc1 ZINC000061361767 488092952 /nfs/dbraw/zinc/09/29/52/488092952.db2.gz XXDHFWCXZZKJBN-QMMMGPOBSA-N 1 2 207.302 2.322 20 0 BEADLO Cc1ccc(F)c(C[NH2+]Cc2ncc[nH]2)c1 ZINC000235906178 488141014 /nfs/dbraw/zinc/14/10/14/488141014.db2.gz NPUXTUKJTBTPJE-UHFFFAOYSA-N 1 2 219.263 2.147 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@H]2CCOC[C@H]2C)[nH+]1 ZINC000683354415 488152671 /nfs/dbraw/zinc/15/26/71/488152671.db2.gz ZUHOWFDJJYYYTP-KCJUWKMLSA-N 1 2 246.314 2.103 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CCC(c2ccon2)CC1 ZINC000668714430 488156673 /nfs/dbraw/zinc/15/66/73/488156673.db2.gz WYBDPSBKKLADSQ-UHFFFAOYSA-N 1 2 246.314 2.086 20 0 BEADLO CCn1cc(C[NH2+]Cc2cccc(C)c2F)nn1 ZINC000404457221 488162771 /nfs/dbraw/zinc/16/27/71/488162771.db2.gz QBVWJRBSYGDAPN-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO Oc1ccc2c(c1)C[N@@H+](Cc1ccco1)CCO2 ZINC000668725220 488167032 /nfs/dbraw/zinc/16/70/32/488167032.db2.gz PEPUQKYCQXRNJE-UHFFFAOYSA-N 1 2 245.278 2.380 20 0 BEADLO Oc1ccc2c(c1)C[N@H+](Cc1ccco1)CCO2 ZINC000668725220 488167040 /nfs/dbraw/zinc/16/70/40/488167040.db2.gz PEPUQKYCQXRNJE-UHFFFAOYSA-N 1 2 245.278 2.380 20 0 BEADLO COc1ccc(N[C@@H]2CS[C@@H](C)C2)[nH+]c1 ZINC000397908524 488169152 /nfs/dbraw/zinc/16/91/52/488169152.db2.gz YQMRXBYYFBBYGD-IUCAKERBSA-N 1 2 224.329 2.396 20 0 BEADLO Cc1oncc1NCc1[nH+]ccn1C(C)C ZINC000667964710 488169248 /nfs/dbraw/zinc/16/92/48/488169248.db2.gz OGMIPKJBKKKKFN-UHFFFAOYSA-N 1 2 220.276 2.373 20 0 BEADLO CCc1cc(N[C@H]2CC[C@H](CO)CC2)nc[nH+]1 ZINC000675229389 488175669 /nfs/dbraw/zinc/17/56/69/488175669.db2.gz MGFFWPYLUTTXOV-UMSPYCQHSA-N 1 2 235.331 2.002 20 0 BEADLO CCC[C@H](C)NC(=O)Nc1cc[nH+]c(C)c1 ZINC000678096782 488197741 /nfs/dbraw/zinc/19/77/41/488197741.db2.gz YTMFRFGLAJAAIK-VIFPVBQESA-N 1 2 221.304 2.122 20 0 BEADLO C=Cn1cc(C[NH2+]Cc2cc(C(C)C)no2)cn1 ZINC000683702753 488210756 /nfs/dbraw/zinc/21/07/56/488210756.db2.gz BAHLZGYTPBGAAZ-UHFFFAOYSA-N 1 2 246.314 2.385 20 0 BEADLO CC1(C)C[N@H+](Cc2[nH]nc3ccccc32)CCO1 ZINC000678178545 488213924 /nfs/dbraw/zinc/21/39/24/488213924.db2.gz MHESTVQSBMQJIK-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO CC1(C)C[N@@H+](Cc2[nH]nc3ccccc32)CCO1 ZINC000678178545 488213929 /nfs/dbraw/zinc/21/39/29/488213929.db2.gz MHESTVQSBMQJIK-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO CC1(C)C[N@H+](Cc2n[nH]c3ccccc32)CCO1 ZINC000678178545 488213935 /nfs/dbraw/zinc/21/39/35/488213935.db2.gz MHESTVQSBMQJIK-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO CC1(C)C[N@@H+](Cc2n[nH]c3ccccc32)CCO1 ZINC000678178545 488213939 /nfs/dbraw/zinc/21/39/39/488213939.db2.gz MHESTVQSBMQJIK-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO Cc1ncc(C[NH+]2CC3(C2)CC(F)(F)C3)cn1 ZINC000677731590 488214805 /nfs/dbraw/zinc/21/48/05/488214805.db2.gz ABJJLZPPSLBHFT-UHFFFAOYSA-N 1 2 239.269 2.016 20 0 BEADLO Cc1nc(CN(C)Cc2[nH]cc[nH+]2)sc1C ZINC000678218261 488219073 /nfs/dbraw/zinc/21/90/73/488219073.db2.gz OISDWWJFCKBGKY-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO COc1ncccc1C[N@@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000683787071 488221912 /nfs/dbraw/zinc/22/19/12/488221912.db2.gz YRCQTKDOKQZTOZ-JQWIXIFHSA-N 1 2 238.306 2.270 20 0 BEADLO COc1ncccc1C[N@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000683787071 488221915 /nfs/dbraw/zinc/22/19/15/488221915.db2.gz YRCQTKDOKQZTOZ-JQWIXIFHSA-N 1 2 238.306 2.270 20 0 BEADLO CC1(C[N@@H+]2CCO[C@@H](C(F)(F)F)C2)CC1 ZINC000683830327 488228643 /nfs/dbraw/zinc/22/86/43/488228643.db2.gz LYELKVYRXDGVNE-MRVPVSSYSA-N 1 2 223.238 2.050 20 0 BEADLO CC1(C[N@H+]2CCO[C@@H](C(F)(F)F)C2)CC1 ZINC000683830327 488228647 /nfs/dbraw/zinc/22/86/47/488228647.db2.gz LYELKVYRXDGVNE-MRVPVSSYSA-N 1 2 223.238 2.050 20 0 BEADLO C[N@@H+](Cc1cn[nH]c1)Cc1cnc(C2CC2)s1 ZINC000678266835 488230122 /nfs/dbraw/zinc/23/01/22/488230122.db2.gz UXNLXJIAESSGSH-UHFFFAOYSA-N 1 2 248.355 2.376 20 0 BEADLO C[N@H+](Cc1cn[nH]c1)Cc1cnc(C2CC2)s1 ZINC000678266835 488230123 /nfs/dbraw/zinc/23/01/23/488230123.db2.gz UXNLXJIAESSGSH-UHFFFAOYSA-N 1 2 248.355 2.376 20 0 BEADLO COc1ccsc1C[N@@H+]1CCc2c[nH]nc2C1 ZINC000678273931 488234661 /nfs/dbraw/zinc/23/46/61/488234661.db2.gz XDXZGDRJFPWEJJ-UHFFFAOYSA-N 1 2 249.339 2.038 20 0 BEADLO COc1ccsc1C[N@H+]1CCc2c[nH]nc2C1 ZINC000678273931 488234663 /nfs/dbraw/zinc/23/46/63/488234663.db2.gz XDXZGDRJFPWEJJ-UHFFFAOYSA-N 1 2 249.339 2.038 20 0 BEADLO FC(F)(F)C1=CC[N@H+](Cc2cn[nH]c2)CC1 ZINC000678277316 488235794 /nfs/dbraw/zinc/23/57/94/488235794.db2.gz IOAVJCXLSFMXAE-UHFFFAOYSA-N 1 2 231.221 2.104 20 0 BEADLO FC(F)(F)C1=CC[N@@H+](Cc2cn[nH]c2)CC1 ZINC000678277316 488235795 /nfs/dbraw/zinc/23/57/95/488235795.db2.gz IOAVJCXLSFMXAE-UHFFFAOYSA-N 1 2 231.221 2.104 20 0 BEADLO C[C@@H](c1ccco1)[N@H+](C)Cc1cn(C)cn1 ZINC000683898435 488240376 /nfs/dbraw/zinc/24/03/76/488240376.db2.gz OZBWFYPHWARHNZ-JTQLQIEISA-N 1 2 219.288 2.206 20 0 BEADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1cn(C)cn1 ZINC000683898435 488240378 /nfs/dbraw/zinc/24/03/78/488240378.db2.gz OZBWFYPHWARHNZ-JTQLQIEISA-N 1 2 219.288 2.206 20 0 BEADLO C[C@H](c1ccncc1)[N@H+](C)Cc1cn(C)cn1 ZINC000683899704 488241614 /nfs/dbraw/zinc/24/16/14/488241614.db2.gz IOSRTJRQXXEABT-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1cn(C)cn1 ZINC000683899704 488241618 /nfs/dbraw/zinc/24/16/18/488241618.db2.gz IOSRTJRQXXEABT-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO COc1ccncc1C[NH+]1CCC(F)(F)CC1 ZINC000672555377 488259524 /nfs/dbraw/zinc/25/95/24/488259524.db2.gz SYCUULAMJRODBF-UHFFFAOYSA-N 1 2 242.269 2.321 20 0 BEADLO C[C@@H](NC(=O)CCc1[nH]cc[nH+]1)c1ccsc1 ZINC000673154493 488277759 /nfs/dbraw/zinc/27/77/59/488277759.db2.gz AVFKQRLNYPQYRY-SECBINFHSA-N 1 2 249.339 2.281 20 0 BEADLO Fc1c[nH+]ccc1N1C[C@@H]2CCC[C@@H]2C1 ZINC000678787367 488282634 /nfs/dbraw/zinc/28/26/34/488282634.db2.gz LDECZAJRGPLUQV-AOOOYVTPSA-N 1 2 206.264 2.457 20 0 BEADLO COCc1ccccc1CNc1cc[nH+]cc1F ZINC000678788236 488283170 /nfs/dbraw/zinc/28/31/70/488283170.db2.gz GCEHWDVGIZUGJS-UHFFFAOYSA-N 1 2 246.285 2.401 20 0 BEADLO Fc1ccccc1CCNc1cc[nH+]cc1F ZINC000678789399 488284138 /nfs/dbraw/zinc/28/41/38/488284138.db2.gz ZGPRSJBCOXJRHI-UHFFFAOYSA-N 1 2 234.249 2.436 20 0 BEADLO CC(C)(C)c1nc(N[C@@H]2CCCOC2)cc[nH+]1 ZINC000673498446 488287781 /nfs/dbraw/zinc/28/77/81/488287781.db2.gz BOQJKOVNSSWXDU-SNVBAGLBSA-N 1 2 235.331 2.365 20 0 BEADLO COc1ccc(N[C@H]2CCC[C@H](OC)C2)[nH+]c1 ZINC000684385303 488303824 /nfs/dbraw/zinc/30/38/24/488303824.db2.gz JKXSBXNBGWBMOE-QWRGUYRKSA-N 1 2 236.315 2.460 20 0 BEADLO COc1ccc(N[C@@H](C)c2cn(C)nc2C)[nH+]c1 ZINC000679069186 488305414 /nfs/dbraw/zinc/30/54/14/488305414.db2.gz ZNGVIGMWQKWCLH-VIFPVBQESA-N 1 2 246.314 2.305 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)CCC(F)F ZINC000684404966 488306924 /nfs/dbraw/zinc/30/69/24/488306924.db2.gz BGHXTRHEUNCBCA-UHFFFAOYSA-N 1 2 243.257 2.131 20 0 BEADLO C[C@H]1CC[N@H+](Cc2nccs2)C[C@@H]1F ZINC000679218168 488315245 /nfs/dbraw/zinc/31/52/45/488315245.db2.gz CEZJPICTZSJVNM-IUCAKERBSA-N 1 2 214.309 2.323 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)no1 ZINC000679220626 488319408 /nfs/dbraw/zinc/31/94/08/488319408.db2.gz IDXBDTCGFUIWRF-KCJUWKMLSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)no1 ZINC000679220626 488319409 /nfs/dbraw/zinc/31/94/09/488319409.db2.gz IDXBDTCGFUIWRF-KCJUWKMLSA-N 1 2 212.268 2.163 20 0 BEADLO COc1ccnc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)c1 ZINC000679223603 488320575 /nfs/dbraw/zinc/32/05/75/488320575.db2.gz QZNBAOLXWZZGDW-GXFFZTMASA-N 1 2 238.306 2.270 20 0 BEADLO COc1ccnc(C[N@H+]2CC[C@H](C)[C@H](F)C2)c1 ZINC000679223603 488320576 /nfs/dbraw/zinc/32/05/76/488320576.db2.gz QZNBAOLXWZZGDW-GXFFZTMASA-N 1 2 238.306 2.270 20 0 BEADLO COc1cc[nH+]c(CN2CC[C@H](C)[C@H](F)C2)c1 ZINC000679223603 488320578 /nfs/dbraw/zinc/32/05/78/488320578.db2.gz QZNBAOLXWZZGDW-GXFFZTMASA-N 1 2 238.306 2.270 20 0 BEADLO Cc1n[nH]cc1[C@H](C)[NH2+]Cc1ncccc1F ZINC000679357216 488344048 /nfs/dbraw/zinc/34/40/48/488344048.db2.gz ZFSKPQUUCSRHAI-QMMMGPOBSA-N 1 2 234.278 2.103 20 0 BEADLO CC(=O)CCCC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000684854587 488349309 /nfs/dbraw/zinc/34/93/09/488349309.db2.gz VYUXGFFPYQFNLO-UHFFFAOYSA-N 1 2 245.282 2.032 20 0 BEADLO COc1ccc(N[C@@H](C)CCn2cccn2)[nH+]c1 ZINC000679389974 488349411 /nfs/dbraw/zinc/34/94/11/488349411.db2.gz SFOUIVAVAFGPHH-NSHDSACASA-N 1 2 246.314 2.177 20 0 BEADLO CCc1cccnc1[C@H](C)[NH2+]Cc1cocn1 ZINC000679577642 488358971 /nfs/dbraw/zinc/35/89/71/488358971.db2.gz UGFXFYUKBDQGEI-JTQLQIEISA-N 1 2 231.299 2.483 20 0 BEADLO Cc1nc(N2CC[C@H]2C)c2c([nH+]1)CCCC2 ZINC000679837450 488367514 /nfs/dbraw/zinc/36/75/14/488367514.db2.gz RKRWOMOEBCWVOV-SECBINFHSA-N 1 2 217.316 2.262 20 0 BEADLO Cc1nc(NCc2cocn2)c2c([nH+]1)CCCC2 ZINC000679838114 488367706 /nfs/dbraw/zinc/36/77/06/488367706.db2.gz IGGGQFMWBQSCFB-UHFFFAOYSA-N 1 2 244.298 2.264 20 0 BEADLO Cc1nc(NCC(C)(C)CO)c2c([nH+]1)CCCC2 ZINC000679839217 488367808 /nfs/dbraw/zinc/36/78/08/488367808.db2.gz QWMKXVWFCLSWJE-UHFFFAOYSA-N 1 2 249.358 2.094 20 0 BEADLO Cc1cn2c([nH+]1)CN(c1ncccc1Cl)CC2 ZINC000679845995 488368407 /nfs/dbraw/zinc/36/84/07/488368407.db2.gz QAQFHIUEMATFMK-UHFFFAOYSA-N 1 2 248.717 2.260 20 0 BEADLO CCN1CC[N@H+](Cc2ccoc2C)C[C@@H]1C ZINC000666308251 490136845 /nfs/dbraw/zinc/13/68/45/490136845.db2.gz TVYUTEOAQCUWLG-NSHDSACASA-N 1 2 222.332 2.114 20 0 BEADLO CCN1CC[N@@H+](Cc2ccoc2C)C[C@@H]1C ZINC000666308251 490136851 /nfs/dbraw/zinc/13/68/51/490136851.db2.gz TVYUTEOAQCUWLG-NSHDSACASA-N 1 2 222.332 2.114 20 0 BEADLO CCc1cc(N[C@@H]2CCC[C@H](CO)C2)nc[nH+]1 ZINC000384089122 490179476 /nfs/dbraw/zinc/17/94/76/490179476.db2.gz YOROYXVTHOEJNF-CMPLNLGQSA-N 1 2 235.331 2.002 20 0 BEADLO c1cn(-c2cccc(N[C@H]3CCCOC3)c2)c[nH+]1 ZINC000070464094 490216091 /nfs/dbraw/zinc/21/60/91/490216091.db2.gz OOVMOIXBYYVVDO-ZDUSSCGKSA-N 1 2 243.310 2.463 20 0 BEADLO CCCCC(=O)Nc1c[nH+]ccc1OC ZINC000072051315 490281400 /nfs/dbraw/zinc/28/14/00/490281400.db2.gz YKYSAQUQUCGVLL-UHFFFAOYSA-N 1 2 208.261 2.219 20 0 BEADLO Cc1cc(NC(=O)c2nccs2)cc[nH+]1 ZINC000074720214 490501287 /nfs/dbraw/zinc/50/12/87/490501287.db2.gz JUVRTAUSWSPKOI-UHFFFAOYSA-N 1 2 219.269 2.099 20 0 BEADLO CO[C@@]1(C)C[C@H]([N@H+](C)CC(F)F)C1(C)C ZINC000076151944 490550563 /nfs/dbraw/zinc/55/05/63/490550563.db2.gz XNTPRFORDVFLST-KWQFWETISA-N 1 2 221.291 2.387 20 0 BEADLO CO[C@@]1(C)C[C@H]([N@@H+](C)CC(F)F)C1(C)C ZINC000076151944 490550569 /nfs/dbraw/zinc/55/05/69/490550569.db2.gz XNTPRFORDVFLST-KWQFWETISA-N 1 2 221.291 2.387 20 0 BEADLO CCc1cc(N[C@H]2CCO[C@@H](C)C2)nc[nH+]1 ZINC000220082155 490589005 /nfs/dbraw/zinc/58/90/05/490589005.db2.gz OEVPXRUPRBGFEY-ONGXEEELSA-N 1 2 221.304 2.018 20 0 BEADLO Cc1ccncc1[C@@H](C)[NH2+]Cc1ccon1 ZINC000129232068 490610509 /nfs/dbraw/zinc/61/05/09/490610509.db2.gz HBDPKMUCBJKMNT-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO C[C@@H]1CC[C@H]1NC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000672668756 490615898 /nfs/dbraw/zinc/61/58/98/490615898.db2.gz PIYSPQRGLJOZJA-MWLCHTKSSA-N 1 2 244.298 2.254 20 0 BEADLO CCc1noc([C@H](C)[N@@H+]2CC[C@@H](C(F)F)C2)n1 ZINC000677735474 490655050 /nfs/dbraw/zinc/65/50/50/490655050.db2.gz QVNKNWUSELZNCX-JGVFFNPUSA-N 1 2 245.273 2.280 20 0 BEADLO CCc1noc([C@H](C)[N@H+]2CC[C@@H](C(F)F)C2)n1 ZINC000677735474 490655055 /nfs/dbraw/zinc/65/50/55/490655055.db2.gz QVNKNWUSELZNCX-JGVFFNPUSA-N 1 2 245.273 2.280 20 0 BEADLO COC(=O)[C@@H]([NH2+]CC1=CCCC1)C(C)(C)C ZINC000592081556 491072412 /nfs/dbraw/zinc/07/24/12/491072412.db2.gz ACPBCTYKDANLMO-LLVKDONJSA-N 1 2 225.332 2.274 20 0 BEADLO CC(C)[C@](C)(O)CNc1cc[nH+]c2ccncc12 ZINC000085686644 491052212 /nfs/dbraw/zinc/05/22/12/491052212.db2.gz OVXFUZDMZLOXMC-CQSZACIVSA-N 1 2 245.326 2.449 20 0 BEADLO Cc1[nH+]cccc1NCc1nccs1 ZINC000085726779 491052472 /nfs/dbraw/zinc/05/24/72/491052472.db2.gz HHHFPOLTXHJFSI-UHFFFAOYSA-N 1 2 205.286 2.459 20 0 BEADLO C[N@H+](Cc1cn[nH]c1)Cc1ccc(F)cc1F ZINC000085825596 491053676 /nfs/dbraw/zinc/05/36/76/491053676.db2.gz LTLQMWZHVNQEDH-UHFFFAOYSA-N 1 2 237.253 2.320 20 0 BEADLO C[N@@H+](Cc1cn[nH]c1)Cc1ccc(F)cc1F ZINC000085825596 491053677 /nfs/dbraw/zinc/05/36/77/491053677.db2.gz LTLQMWZHVNQEDH-UHFFFAOYSA-N 1 2 237.253 2.320 20 0 BEADLO CCc1cc(NCC[C@H]2CCCCO2)nc[nH+]1 ZINC000227315571 491058339 /nfs/dbraw/zinc/05/83/39/491058339.db2.gz IKZUJGFCRCNSFL-GFCCVEGCSA-N 1 2 235.331 2.410 20 0 BEADLO COc1ccc(NCc2ccc(O)cc2)[nH+]c1 ZINC000227541372 491062870 /nfs/dbraw/zinc/06/28/70/491062870.db2.gz PQEWBXJDXOTPIB-UHFFFAOYSA-N 1 2 230.267 2.408 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616927972 491069037 /nfs/dbraw/zinc/06/90/37/491069037.db2.gz VBKJHMKXWGGTEI-AAEUAGOBSA-N 1 2 235.331 2.050 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616927972 491069038 /nfs/dbraw/zinc/06/90/38/491069038.db2.gz VBKJHMKXWGGTEI-AAEUAGOBSA-N 1 2 235.331 2.050 20 0 BEADLO CCc1cc(NCc2ccncc2C)nc[nH+]1 ZINC000228704532 491101832 /nfs/dbraw/zinc/10/18/32/491101832.db2.gz FGMUBIYLQFOVLS-UHFFFAOYSA-N 1 2 228.299 2.355 20 0 BEADLO COC[C@@H]1CCCN1C(=O)Nc1cc[nH+]cc1C ZINC000121221474 491102304 /nfs/dbraw/zinc/10/23/04/491102304.db2.gz SCAHWMDZVVEDMM-NSHDSACASA-N 1 2 249.314 2.033 20 0 BEADLO CC[C@@](C)(C[NH2+]C(C)(C)c1noc(C)n1)OC ZINC000638523380 491114299 /nfs/dbraw/zinc/11/42/99/491114299.db2.gz GAJZYYWMHRPJMX-LBPRGKRZSA-N 1 2 241.335 2.018 20 0 BEADLO Cc1ncc(C[NH+]2Cc3ccccc3C2)o1 ZINC000628164707 491129443 /nfs/dbraw/zinc/12/94/43/491129443.db2.gz ZRBHLKGYRVOYTI-UHFFFAOYSA-N 1 2 214.268 2.499 20 0 BEADLO CC[C@H](Nc1ncc(C)cn1)c1[nH]cc[nH+]1 ZINC000125217314 491131936 /nfs/dbraw/zinc/13/19/36/491131936.db2.gz TZLRSQLGAWXXNP-VIFPVBQESA-N 1 2 217.276 2.071 20 0 BEADLO Cc1sccc1C[N@@H+]1CCc2nccnc2C1 ZINC000668734984 491132895 /nfs/dbraw/zinc/13/28/95/491132895.db2.gz VNXHUTWDZHZQMC-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1sccc1C[N@H+]1CCc2nccnc2C1 ZINC000668734984 491132896 /nfs/dbraw/zinc/13/28/96/491132896.db2.gz VNXHUTWDZHZQMC-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ccc(NCc2cn[nH]c2)c(C)[nH+]1 ZINC000309088931 491144374 /nfs/dbraw/zinc/14/43/74/491144374.db2.gz BKYUHBMLMWKTIK-UHFFFAOYSA-N 1 2 202.261 2.034 20 0 BEADLO COc1ccc(F)c(NCc2cn(C)c[nH+]2)c1 ZINC000310099340 491160367 /nfs/dbraw/zinc/16/03/67/491160367.db2.gz AYKFWOUMTGOBFI-UHFFFAOYSA-N 1 2 235.262 2.180 20 0 BEADLO c1cn(-c2csc(CNc3c[nH]cn3)c2)c[nH+]1 ZINC000515024974 491160401 /nfs/dbraw/zinc/16/04/01/491160401.db2.gz VYXQVCSJZFMTDM-UHFFFAOYSA-N 1 2 245.311 2.269 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493146455 533762560 /nfs/dbraw/zinc/76/25/60/533762560.db2.gz HBMMRBPZGUJHFI-ADRPCIBZSA-N 1 2 233.315 2.118 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493146456 533859273 /nfs/dbraw/zinc/85/92/73/533859273.db2.gz HBMMRBPZGUJHFI-MXFLAHGMSA-N 1 2 233.315 2.118 20 0 BEADLO COc1ccc(NC(=O)C=Cc2c[nH]c[nH+]2)cc1 ZINC000493550522 534024922 /nfs/dbraw/zinc/02/49/22/534024922.db2.gz IVAVRZWHNUZROK-QPJJXVBHSA-N 1 2 243.266 2.070 20 0 BEADLO CCOc1ccc(C[N@H+]2CCO[C@H](CC)C2)o1 ZINC000891561367 582697506 /nfs/dbraw/zinc/69/75/06/582697506.db2.gz ALOVXUMSBZPWQD-LLVKDONJSA-N 1 2 239.315 2.289 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)/C=C/C1CCCC1 ZINC000493238940 534272052 /nfs/dbraw/zinc/27/20/52/534272052.db2.gz YCTOCVJJRLBOHT-SYTKJHMZSA-N 1 2 247.342 2.134 20 0 BEADLO COC[C@H](Nc1cc(C)[nH+]cn1)c1ccc(C)o1 ZINC000301529059 518093189 /nfs/dbraw/zinc/09/31/89/518093189.db2.gz GZSIICYUHHRBRW-NSHDSACASA-N 1 2 247.298 2.486 20 0 BEADLO c1cn(-c2cccc(Oc3cccnn3)c2)c[nH+]1 ZINC000561231336 518203956 /nfs/dbraw/zinc/20/39/56/518203956.db2.gz BIQYOGHGXITUEC-UHFFFAOYSA-N 1 2 238.250 2.455 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2nc(C(C)(C)C)co2)C1 ZINC000892069053 582783903 /nfs/dbraw/zinc/78/39/03/582783903.db2.gz DYFLTZYKZPEMRC-SNVBAGLBSA-N 1 2 238.331 2.193 20 0 BEADLO O=C(/C=C/C1CC1)Nc1c[nH+]c2n1CCCC2 ZINC000493822853 534768792 /nfs/dbraw/zinc/76/87/92/534768792.db2.gz YDHPUINPCSZQOC-VOTSOKGWSA-N 1 2 231.299 2.124 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N(C1CCC1)C1CCC1 ZINC000492927034 534801467 /nfs/dbraw/zinc/80/14/67/534801467.db2.gz WDTCZYAXNZAMOA-FPLPWBNLSA-N 1 2 245.326 2.357 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N[C@@H](C1CC1)C1CCC1 ZINC000493427875 534802820 /nfs/dbraw/zinc/80/28/20/534802820.db2.gz RIWCHEJIMFRKSK-LMVHVUTASA-N 1 2 245.326 2.118 20 0 BEADLO CC(C)c1nc(N2CCO[C@@H](C3CC3)C2)cc[nH+]1 ZINC000375329969 534909273 /nfs/dbraw/zinc/90/92/73/534909273.db2.gz WYUHWRWWBBOXEW-GFCCVEGCSA-N 1 2 247.342 2.215 20 0 BEADLO CC(C)c1nc(N(C)Cc2ccon2)cc[nH+]1 ZINC000352263360 534905310 /nfs/dbraw/zinc/90/53/10/534905310.db2.gz CMDMEKSNQARUKG-UHFFFAOYSA-N 1 2 232.287 2.224 20 0 BEADLO CC(C)c1nc(N2CCCO[C@@H](C)C2)cc[nH+]1 ZINC000171918009 534906906 /nfs/dbraw/zinc/90/69/06/534906906.db2.gz RVVRIRQNRDIWDD-NSHDSACASA-N 1 2 235.331 2.215 20 0 BEADLO CC(C)c1nc(N2CC[C@@H](F)C2)cc[nH+]1 ZINC000336189327 534910580 /nfs/dbraw/zinc/91/05/80/534910580.db2.gz PVJWUSHBAZLBCM-SECBINFHSA-N 1 2 209.268 2.148 20 0 BEADLO CC(C)c1nc(NCC(F)F)cc[nH+]1 ZINC000173988017 534912418 /nfs/dbraw/zinc/91/24/18/534912418.db2.gz ARNKDBBOKLEEPX-UHFFFAOYSA-N 1 2 201.220 2.277 20 0 BEADLO C/C=C(/C=C\C(=O)N[C@@H](C)Cn1cc[nH+]c1)CC ZINC000492137208 527562102 /nfs/dbraw/zinc/56/21/02/527562102.db2.gz OKCLEINQTCERDL-RVBSPQKGSA-N 1 2 247.342 2.300 20 0 BEADLO C/C=C/C=C/C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000493090146 527583708 /nfs/dbraw/zinc/58/37/08/527583708.db2.gz ULEZPLAEHICHGG-LPJSFPNVSA-N 1 2 231.299 2.137 20 0 BEADLO CC(C)C1CCN(C(=O)/C=C/c2[nH]cc[nH+]2)CC1 ZINC000493112445 527645546 /nfs/dbraw/zinc/64/55/46/527645546.db2.gz DMSMDACQUDMMTP-ONEGZZNKSA-N 1 2 247.342 2.318 20 0 BEADLO CC(C)CC1(CNC(=O)/C=C\c2[nH]cc[nH+]2)CC1 ZINC000493714568 527689843 /nfs/dbraw/zinc/68/98/43/527689843.db2.gz BCVRYSCEUCLOID-ARJAWSKDSA-N 1 2 247.342 2.365 20 0 BEADLO CCC[C@@H]1C[C@H]1NC(=O)/C=C\c1[nH+]ccn1CC ZINC000493426663 527851053 /nfs/dbraw/zinc/85/10/53/527851053.db2.gz QHVCNVKVEXIXFR-UXFRKABBSA-N 1 2 247.342 2.221 20 0 BEADLO CC(C)CN(C(=O)/C=C\c1[nH]cc[nH+]1)C(C)C ZINC000493591327 527889473 /nfs/dbraw/zinc/88/94/73/527889473.db2.gz PQYQSMRRUDROEI-WAYWQWQTSA-N 1 2 235.331 2.316 20 0 BEADLO CCC[C@H](CC)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493755019 528091863 /nfs/dbraw/zinc/09/18/63/528091863.db2.gz NRNPBCUPTHTYMM-FGEFZZPRSA-N 1 2 221.304 2.118 20 0 BEADLO CCCCN(C)C(=O)/C=C/c1[nH+]ccn1CC ZINC000493075608 528315961 /nfs/dbraw/zinc/31/59/61/528315961.db2.gz WNTRKTWBOFVKFF-BQYQJAHWSA-N 1 2 235.331 2.175 20 0 BEADLO CC(C)c1nc(N(C)C[C@H]2CCOC2)cc[nH+]1 ZINC000174919944 528363393 /nfs/dbraw/zinc/36/33/93/528363393.db2.gz GTRXYWZLASTLMV-LLVKDONJSA-N 1 2 235.331 2.073 20 0 BEADLO CC(C)[C@@H](NC(=O)OCC1CC1)c1[nH]cc[nH+]1 ZINC000496828823 528564604 /nfs/dbraw/zinc/56/46/04/528564604.db2.gz PHXUHPWGUGHIGD-SNVBAGLBSA-N 1 2 237.303 2.243 20 0 BEADLO CC(C)[C@@H]1CCCN(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493698262 528655812 /nfs/dbraw/zinc/65/58/12/528655812.db2.gz SXIUQIGSASFPKN-BTDICHCPSA-N 1 2 247.342 2.318 20 0 BEADLO CCCC[C@@H](C)N(C)C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493195632 528756701 /nfs/dbraw/zinc/75/67/01/528756701.db2.gz VXHYQTWHNBVKHA-WSKFYRRCSA-N 1 2 235.331 2.460 20 0 BEADLO CCOCC[N@@H+]1CC[C@H](C)C(F)(F)C1 ZINC000494210908 528757307 /nfs/dbraw/zinc/75/73/07/528757307.db2.gz CFPBXHBCPGFQIU-VIFPVBQESA-N 1 2 207.264 2.000 20 0 BEADLO CCOCC[N@H+]1CC[C@H](C)C(F)(F)C1 ZINC000494210908 528757313 /nfs/dbraw/zinc/75/73/13/528757313.db2.gz CFPBXHBCPGFQIU-VIFPVBQESA-N 1 2 207.264 2.000 20 0 BEADLO CCN(C(=O)/C=C\c1[nH+]ccn1CC)C1CCC1 ZINC000492538491 528911552 /nfs/dbraw/zinc/91/15/52/528911552.db2.gz SDVLOMMWGCFHKO-HJWRWDBZSA-N 1 2 247.342 2.317 20 0 BEADLO CC1(C)CCCN(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493304061 528923450 /nfs/dbraw/zinc/92/34/50/528923450.db2.gz QJYNLTKHZNXXKV-SNAWJCMRSA-N 1 2 233.315 2.072 20 0 BEADLO CC1(C)CCN(C(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000493748453 529001501 /nfs/dbraw/zinc/00/15/01/529001501.db2.gz COCYRYRUHCXVFR-ONEGZZNKSA-N 1 2 233.315 2.072 20 0 BEADLO CC[C@@H]1CCC[C@@H]1CNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493066203 529307617 /nfs/dbraw/zinc/30/76/17/529307617.db2.gz RXTURYDQOLSWIF-UXFRKABBSA-N 1 2 247.342 2.365 20 0 BEADLO CC[C@@H]1CCC[C@H]1CNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493066202 529318703 /nfs/dbraw/zinc/31/87/03/529318703.db2.gz RXTURYDQOLSWIF-PBWNMSGQSA-N 1 2 247.342 2.365 20 0 BEADLO CCCCC(=O)Nc1ccc[nH+]c1N(C)C ZINC000047976190 534956333 /nfs/dbraw/zinc/95/63/33/534956333.db2.gz ISEFBRDLBLNDCW-UHFFFAOYSA-N 1 2 221.304 2.276 20 0 BEADLO CC(C)(C)[C@H]1CCN(c2cccc[nH+]2)C[C@@H]1O ZINC000273310868 535097208 /nfs/dbraw/zinc/09/72/08/535097208.db2.gz NKNLEPKECNSXLY-RYUDHWBXSA-N 1 2 234.343 2.315 20 0 BEADLO CCCCc1nc(C[N@@H+]2CCC[C@H]2C)no1 ZINC000076117155 535099097 /nfs/dbraw/zinc/09/90/97/535099097.db2.gz PXHGQWCXYZSCJO-SNVBAGLBSA-N 1 2 223.320 2.397 20 0 BEADLO CCCCc1nc(C[N@H+]2CCC[C@H]2C)no1 ZINC000076117155 535099101 /nfs/dbraw/zinc/09/91/01/535099101.db2.gz PXHGQWCXYZSCJO-SNVBAGLBSA-N 1 2 223.320 2.397 20 0 BEADLO CC[N@@H+](Cc1nccs1)C[C@H]1CCCO1 ZINC000179204584 535392582 /nfs/dbraw/zinc/39/25/82/535392582.db2.gz IZYMQWGHEARUCW-SNVBAGLBSA-N 1 2 226.345 2.144 20 0 BEADLO CC[N@H+](Cc1nccs1)C[C@H]1CCCO1 ZINC000179204584 535392585 /nfs/dbraw/zinc/39/25/85/535392585.db2.gz IZYMQWGHEARUCW-SNVBAGLBSA-N 1 2 226.345 2.144 20 0 BEADLO CCS[C@@H](c1nc(C[NH2+]C)no1)C(C)C ZINC000261539151 535700472 /nfs/dbraw/zinc/70/04/72/535700472.db2.gz BSGFDWCSKXBJNS-SECBINFHSA-N 1 2 229.349 2.239 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1ccccc1F ZINC000172012750 535835843 /nfs/dbraw/zinc/83/58/43/535835843.db2.gz BRVQUQOTQPPIRH-GFCCVEGCSA-N 1 2 223.291 2.437 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1ccccc1F ZINC000172012750 535835846 /nfs/dbraw/zinc/83/58/46/535835846.db2.gz BRVQUQOTQPPIRH-GFCCVEGCSA-N 1 2 223.291 2.437 20 0 BEADLO CC[C@@]1(C)C[C@@H]1C(=O)NCc1c[nH+]ccc1OC ZINC000348266913 536064438 /nfs/dbraw/zinc/06/44/38/536064438.db2.gz CJOUBCUUCVWKND-RISCZKNCSA-N 1 2 248.326 2.143 20 0 BEADLO CC[C@H]1C[N@@H+]([C@@H](C)c2csnn2)CCS1 ZINC000335579081 536158199 /nfs/dbraw/zinc/15/81/99/536158199.db2.gz IMGHZNUCLBFILY-IUCAKERBSA-N 1 2 243.401 2.427 20 0 BEADLO CC[C@H]1C[N@H+]([C@@H](C)c2csnn2)CCS1 ZINC000335579081 536158202 /nfs/dbraw/zinc/15/82/02/536158202.db2.gz IMGHZNUCLBFILY-IUCAKERBSA-N 1 2 243.401 2.427 20 0 BEADLO CN(C)c1cc(N[C@H]2CC=CCC2)[nH+]cn1 ZINC000892606026 582927357 /nfs/dbraw/zinc/92/73/57/582927357.db2.gz WEGOKIUQIHEKQT-JTQLQIEISA-N 1 2 218.304 2.063 20 0 BEADLO CN(C)c1cc(N[C@H]2CC=CCC2)nc[nH+]1 ZINC000892606026 582927359 /nfs/dbraw/zinc/92/73/59/582927359.db2.gz WEGOKIUQIHEKQT-JTQLQIEISA-N 1 2 218.304 2.063 20 0 BEADLO C[N@H+](Cc1cccc(F)c1)Cc1cnccn1 ZINC000080965315 536476967 /nfs/dbraw/zinc/47/69/67/536476967.db2.gz UYTJPKDHIDGSDG-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[N@@H+](Cc1cccc(F)c1)Cc1cnccn1 ZINC000080965315 536476970 /nfs/dbraw/zinc/47/69/70/536476970.db2.gz UYTJPKDHIDGSDG-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO COC1(C[N@@H+]2CCn3ccnc3C2)CCCCC1 ZINC000336627176 536629492 /nfs/dbraw/zinc/62/94/92/536629492.db2.gz TYZNLSYBOOQTMA-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO COC1(C[N@H+]2CCn3ccnc3C2)CCCCC1 ZINC000336627176 536629501 /nfs/dbraw/zinc/62/95/01/536629501.db2.gz TYZNLSYBOOQTMA-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO COC1(CNC(=O)Nc2cc[nH+]c(C)c2)CCC1 ZINC000184140623 536665902 /nfs/dbraw/zinc/66/59/02/536665902.db2.gz ABOUDCIDRNNNGU-UHFFFAOYSA-N 1 2 249.314 2.081 20 0 BEADLO CCc1cc(NC[C@@H](O)C(C)C)nc(CC)[nH+]1 ZINC000892642284 582936621 /nfs/dbraw/zinc/93/66/21/582936621.db2.gz POOIJCTURFQOFX-LLVKDONJSA-N 1 2 237.347 2.030 20 0 BEADLO O=C(Cc1ccco1)Nc1cccc2[nH+]ccn21 ZINC000340637905 537931773 /nfs/dbraw/zinc/93/17/73/537931773.db2.gz IFSKZDNNYIKJPC-UHFFFAOYSA-N 1 2 241.250 2.109 20 0 BEADLO CC1(C)OC[C@H](C[N@@H+]2CCCC[C@@H]2C(F)F)O1 ZINC000852016022 582993351 /nfs/dbraw/zinc/99/33/51/582993351.db2.gz SJNSRQMXUGGDJJ-VHSXEESVSA-N 1 2 249.301 2.258 20 0 BEADLO CC1(C)OC[C@H](C[N@H+]2CCCC[C@@H]2C(F)F)O1 ZINC000852016022 582993354 /nfs/dbraw/zinc/99/33/54/582993354.db2.gz SJNSRQMXUGGDJJ-VHSXEESVSA-N 1 2 249.301 2.258 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CC[C@H](C)[C@H]2C)c1C ZINC000894084301 583295624 /nfs/dbraw/zinc/29/56/24/583295624.db2.gz KCSCZJYNXFUVEL-GZMMTYOYSA-N 1 2 207.321 2.257 20 0 BEADLO c1c(C[NH+]2CC3(CC3)C2)onc1C1CC1 ZINC000877555958 583328522 /nfs/dbraw/zinc/32/85/22/583328522.db2.gz HTOFTIDRYUNTIK-UHFFFAOYSA-N 1 2 204.273 2.148 20 0 BEADLO Cc1ccc(CS(=O)(=O)C(C)(C)C)c(C)[nH+]1 ZINC000853022720 588716348 /nfs/dbraw/zinc/71/63/48/588716348.db2.gz VVGKLVPPJZQQCJ-UHFFFAOYSA-N 1 2 241.356 2.412 20 0 BEADLO O=C1CCCN1C[N@H+]1CC[C@H]1c1ccc(F)cc1 ZINC000853544594 588748284 /nfs/dbraw/zinc/74/82/84/588748284.db2.gz WOWRNBDAACWBSJ-ZDUSSCGKSA-N 1 2 248.301 2.152 20 0 BEADLO O=C1CCCN1C[N@@H+]1CC[C@H]1c1ccc(F)cc1 ZINC000853544594 588748285 /nfs/dbraw/zinc/74/82/85/588748285.db2.gz WOWRNBDAACWBSJ-ZDUSSCGKSA-N 1 2 248.301 2.152 20 0 BEADLO CC(C)c1nc(N2C[C@H](C)[C@H]2C)cc[nH+]1 ZINC000853650810 588752401 /nfs/dbraw/zinc/75/24/01/588752401.db2.gz WSRKHRVEPBDUAK-VHSXEESVSA-N 1 2 205.305 2.445 20 0 BEADLO Cc1ccc[nH+]c1CCCNc1cnc(F)cn1 ZINC000853663020 588753770 /nfs/dbraw/zinc/75/37/70/588753770.db2.gz YNVYEQKIWSYFIT-UHFFFAOYSA-N 1 2 246.289 2.364 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)Nc1cc(F)ncn1 ZINC000853667922 588754205 /nfs/dbraw/zinc/75/42/05/588754205.db2.gz DGCVHRUVYXXPQO-QMMMGPOBSA-N 1 2 235.266 2.005 20 0 BEADLO CC(C)[C@H](C)O[NH+]=C(N)COC(C)(C)C ZINC000853689192 588756484 /nfs/dbraw/zinc/75/64/84/588756484.db2.gz ZQNFGKDVCWZXAU-VIFPVBQESA-N 1 2 216.325 2.344 20 0 BEADLO CC(C)=CCCO[NH+]=C(N)[C@@H]1CCCO1 ZINC000853697463 588757412 /nfs/dbraw/zinc/75/74/12/588757412.db2.gz ICRUGIXJQNINHT-JTQLQIEISA-N 1 2 212.293 2.020 20 0 BEADLO Clc1nc(COCc2[nH]cc[nH+]2)cs1 ZINC000853700615 588757576 /nfs/dbraw/zinc/75/75/76/588757576.db2.gz PRXRJSBMIKAVSZ-UHFFFAOYSA-N 1 2 229.692 2.236 20 0 BEADLO CC(C)c1nc(N2C[C@@H](C)C(O)[C@H](C)C2)cc[nH+]1 ZINC000853833667 588765218 /nfs/dbraw/zinc/76/52/18/588765218.db2.gz KKDQVBCPOJJASI-GHMZBOCLSA-N 1 2 249.358 2.053 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2CCC2(C)C)n1 ZINC000854132178 588775720 /nfs/dbraw/zinc/77/57/20/588775720.db2.gz OEKBTUKEKCIWOE-QMMMGPOBSA-N 1 2 209.293 2.083 20 0 BEADLO CC[NH2+]Cc1noc(/C=C(\C)c2ccco2)n1 ZINC000854132004 588775731 /nfs/dbraw/zinc/77/57/31/588775731.db2.gz HAEQHYXJWMORCV-VQHVLOKHSA-N 1 2 233.271 2.333 20 0 BEADLO CC[N@H+](CC1CC1)Cn1ncsc1=S ZINC000112200116 588785269 /nfs/dbraw/zinc/78/52/69/588785269.db2.gz QEEGKEOKUDLMMG-UHFFFAOYSA-N 1 2 229.374 2.363 20 0 BEADLO CC[N@@H+](CC1CC1)Cn1ncsc1=S ZINC000112200116 588785270 /nfs/dbraw/zinc/78/52/70/588785270.db2.gz QEEGKEOKUDLMMG-UHFFFAOYSA-N 1 2 229.374 2.363 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1CNC(=O)Cc1[nH]cc[nH+]1 ZINC000854741180 588804815 /nfs/dbraw/zinc/80/48/15/588804815.db2.gz KEAYUZRFSQKQOM-VXGBXAGGSA-N 1 2 249.358 2.285 20 0 BEADLO CCC(F)(F)C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000854845192 588813142 /nfs/dbraw/zinc/81/31/42/588813142.db2.gz KTHNYJNUVIFKCR-HTQZYQBOSA-N 1 2 243.257 2.050 20 0 BEADLO Cc1cccc([C@H](C)NC(=O)Cc2[nH]cc[nH+]2)c1 ZINC000854893066 588815735 /nfs/dbraw/zinc/81/57/35/588815735.db2.gz IMOJKWJWALYTCR-NSHDSACASA-N 1 2 243.310 2.138 20 0 BEADLO CC(C)(CNC(=O)Cc1[nH]cc[nH+]1)C1=CCCC1 ZINC000854900285 588816157 /nfs/dbraw/zinc/81/61/57/588816157.db2.gz UYDXLAAWDSNVAI-UHFFFAOYSA-N 1 2 247.342 2.205 20 0 BEADLO C/C(=C/C(C)(C)C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000855135995 588822733 /nfs/dbraw/zinc/82/27/33/588822733.db2.gz KSJMASGOHAQORL-POHAHGRESA-N 1 2 235.331 2.361 20 0 BEADLO C/C(=C/C(C)(C)C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000855135995 588822734 /nfs/dbraw/zinc/82/27/34/588822734.db2.gz KSJMASGOHAQORL-POHAHGRESA-N 1 2 235.331 2.361 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)/C=C\C1CCCC1 ZINC000855135632 588823102 /nfs/dbraw/zinc/82/31/02/588823102.db2.gz RDROHMYPVMAOIF-SREVYHEPSA-N 1 2 233.315 2.115 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)/C=C\C1CCCC1 ZINC000855135632 588823103 /nfs/dbraw/zinc/82/31/03/588823103.db2.gz RDROHMYPVMAOIF-SREVYHEPSA-N 1 2 233.315 2.115 20 0 BEADLO Cc1cc(CNc2cc3cc[nH]c3c[nH+]2)n(C)n1 ZINC000804697058 582529914 /nfs/dbraw/zinc/52/99/14/582529914.db2.gz JMMYHYOBQPBXOK-UHFFFAOYSA-N 1 2 241.298 2.217 20 0 BEADLO C[C@@H]1CC=CC[C@H]1NC(=O)CCCn1cc[nH+]c1 ZINC000890769125 582546284 /nfs/dbraw/zinc/54/62/84/582546284.db2.gz IPPISCOQNJSIEB-CHWSQXEVSA-N 1 2 247.342 2.134 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccc(F)cn2)[C@H](C)CO1 ZINC000844391623 582580564 /nfs/dbraw/zinc/58/05/64/582580564.db2.gz SCGSQCKPAUESCF-ZWNOBZJWSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccc(F)cn2)[C@H](C)CO1 ZINC000844391623 582580567 /nfs/dbraw/zinc/58/05/67/582580567.db2.gz SCGSQCKPAUESCF-ZWNOBZJWSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H](C)C(=O)NCc1c(C)[nH+]c2ccccn21 ZINC000890853760 582581069 /nfs/dbraw/zinc/58/10/69/582581069.db2.gz QIUCMPKGVGRPGG-JTQLQIEISA-N 1 2 245.326 2.305 20 0 BEADLO C[C@@H]1C[C@@H](C)CN(c2nccn3c[nH+]cc23)C1 ZINC000891405031 582679234 /nfs/dbraw/zinc/67/92/34/582679234.db2.gz AKEYWZLPEPAGKB-GHMZBOCLSA-N 1 2 230.315 2.212 20 0 BEADLO OCCCNc1cc(C2CC2)[nH+]c(C2CC2)n1 ZINC000891410245 582680057 /nfs/dbraw/zinc/68/00/57/582680057.db2.gz NLHIAZAHMSIJFZ-UHFFFAOYSA-N 1 2 233.315 2.026 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCO[C@H](CC)C2)o1 ZINC000891561367 582697504 /nfs/dbraw/zinc/69/75/04/582697504.db2.gz ALOVXUMSBZPWQD-LLVKDONJSA-N 1 2 239.315 2.289 20 0 BEADLO C[C@@H](O)c1cccc(NCC[C@H]2CCCO2)[nH+]1 ZINC000891678729 582709316 /nfs/dbraw/zinc/70/93/16/582709316.db2.gz VNWLBWWHHZQQLY-GHMZBOCLSA-N 1 2 236.315 2.116 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCOC(C)(C)C2)o1 ZINC000891705896 582711001 /nfs/dbraw/zinc/71/10/01/582711001.db2.gz LPXGXOHFYYDDLU-UHFFFAOYSA-N 1 2 239.315 2.289 20 0 BEADLO CCOc1ccc(C[N@H+]2CCOC(C)(C)C2)o1 ZINC000891705896 582711002 /nfs/dbraw/zinc/71/10/02/582711002.db2.gz LPXGXOHFYYDDLU-UHFFFAOYSA-N 1 2 239.315 2.289 20 0 BEADLO CN(C)c1cc(NCCc2ccsc2)[nH+]cn1 ZINC000891753193 582717031 /nfs/dbraw/zinc/71/70/31/582717031.db2.gz VCASGNSPYJREDH-UHFFFAOYSA-N 1 2 248.355 2.259 20 0 BEADLO CN(C)c1cc(NCCc2ccsc2)nc[nH+]1 ZINC000891753193 582717032 /nfs/dbraw/zinc/71/70/32/582717032.db2.gz VCASGNSPYJREDH-UHFFFAOYSA-N 1 2 248.355 2.259 20 0 BEADLO C[C@H]1CC[N@H+](Cc2nc(Br)c[nH]2)C1 ZINC000891797490 582724216 /nfs/dbraw/zinc/72/42/16/582724216.db2.gz KTLBDBWNWROTMV-ZETCQYMHSA-N 1 2 244.136 2.014 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2nc(Br)c[nH]2)C1 ZINC000891797490 582724218 /nfs/dbraw/zinc/72/42/18/582724218.db2.gz KTLBDBWNWROTMV-ZETCQYMHSA-N 1 2 244.136 2.014 20 0 BEADLO Cc1ccc(CNc2cccc([C@@H](C)O)[nH+]2)cn1 ZINC000891871892 582732729 /nfs/dbraw/zinc/73/27/29/582732729.db2.gz XSNPUOINWRPFRE-LLVKDONJSA-N 1 2 243.310 2.450 20 0 BEADLO O=C(/C=C\C1CC1)Nc1ccc2[nH+]ccn2c1 ZINC000742667408 582735380 /nfs/dbraw/zinc/73/53/80/582735380.db2.gz UCLQOZOWYZHMKN-UTCJRWHESA-N 1 2 227.267 2.239 20 0 BEADLO C[N@H+](Cc1nc(C(C)(C)C)co1)[C@@H]1CCOC1 ZINC000891934649 582740540 /nfs/dbraw/zinc/74/05/40/582740540.db2.gz ITHUNEVBDBGJNY-SNVBAGLBSA-N 1 2 238.331 2.193 20 0 BEADLO C[N@@H+](Cc1nc(C(C)(C)C)co1)[C@@H]1CCOC1 ZINC000891934649 582740542 /nfs/dbraw/zinc/74/05/42/582740542.db2.gz ITHUNEVBDBGJNY-SNVBAGLBSA-N 1 2 238.331 2.193 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2cc[nH]n2)c(C)c1 ZINC000892012288 582760879 /nfs/dbraw/zinc/76/08/79/582760879.db2.gz NPJJSQOFBUZZEE-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2cc[nH]n2)c(C)c1 ZINC000892012288 582760882 /nfs/dbraw/zinc/76/08/82/582760882.db2.gz NPJJSQOFBUZZEE-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2cnn(C3CCC3)c2)[C@H]1C ZINC000892049176 582774309 /nfs/dbraw/zinc/77/43/09/582774309.db2.gz PGBJRCCIKAQHQV-NWDGAFQWSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2cnn(C3CCC3)c2)[C@H]1C ZINC000892049176 582774311 /nfs/dbraw/zinc/77/43/11/582774311.db2.gz PGBJRCCIKAQHQV-NWDGAFQWSA-N 1 2 249.358 2.217 20 0 BEADLO CO[C@@H]1CC[N@H+](Cc2nc(C(C)(C)C)co2)C1 ZINC000892069053 582783901 /nfs/dbraw/zinc/78/39/01/582783901.db2.gz DYFLTZYKZPEMRC-SNVBAGLBSA-N 1 2 238.331 2.193 20 0 BEADLO C[C@@H](O)c1cccc(NCCc2nccs2)[nH+]1 ZINC000892153615 582802102 /nfs/dbraw/zinc/80/21/02/582802102.db2.gz QYUKUTWUIUZFFF-SECBINFHSA-N 1 2 249.339 2.246 20 0 BEADLO CCc1cc(NCC2CCOCC2)nc(CC)[nH+]1 ZINC000892174215 582805517 /nfs/dbraw/zinc/80/55/17/582805517.db2.gz ZZELBUKNMRIDCW-UHFFFAOYSA-N 1 2 249.358 2.440 20 0 BEADLO CCc1cc(N2CCCO[C@H](C)C2)nc(CC)[nH+]1 ZINC000892295496 582829923 /nfs/dbraw/zinc/82/99/23/582829923.db2.gz LQJXNHXMAHNARV-LLVKDONJSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@H]1CC[N@H+](Cn2nc3ccccn3c2=S)C1 ZINC000725778268 582848536 /nfs/dbraw/zinc/84/85/36/582848536.db2.gz DFFNYNQJJKROJM-JTQLQIEISA-N 1 2 248.355 2.165 20 0 BEADLO C[C@H]1CC[N@@H+](Cn2nc3ccccn3c2=S)C1 ZINC000725778268 582848539 /nfs/dbraw/zinc/84/85/39/582848539.db2.gz DFFNYNQJJKROJM-JTQLQIEISA-N 1 2 248.355 2.165 20 0 BEADLO C[C@H]1CC[N@H+](Cn2sc3ccccc3c2=O)C1 ZINC000725777377 582848721 /nfs/dbraw/zinc/84/87/21/582848721.db2.gz FQMYGFYWWBAIQR-JTQLQIEISA-N 1 2 248.351 2.362 20 0 BEADLO C[C@H]1CC[N@@H+](Cn2sc3ccccc3c2=O)C1 ZINC000725777377 582848722 /nfs/dbraw/zinc/84/87/22/582848722.db2.gz FQMYGFYWWBAIQR-JTQLQIEISA-N 1 2 248.351 2.362 20 0 BEADLO COc1ccc(CNc2ccc(N(C)C)[nH+]c2)o1 ZINC000892402579 582876561 /nfs/dbraw/zinc/87/65/61/582876561.db2.gz QNGPLDVBIKBFHO-UHFFFAOYSA-N 1 2 247.298 2.361 20 0 BEADLO CCc1cc(NC[C@@](C)(O)C2CC2)nc(CC)[nH+]1 ZINC000892481773 582896227 /nfs/dbraw/zinc/89/62/27/582896227.db2.gz QAFRLVYQMOYMAV-CQSZACIVSA-N 1 2 249.358 2.174 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)C1CC2(CC2)C1 ZINC000850214389 582907738 /nfs/dbraw/zinc/90/77/38/582907738.db2.gz JCWLFPHJJUMSET-UHFFFAOYSA-N 1 2 234.299 2.007 20 0 BEADLO CC1(C)C[C@]1(C)NC(=O)c1cccc2[nH+]ccn21 ZINC000856135776 588862552 /nfs/dbraw/zinc/86/25/52/588862552.db2.gz WYPNEOOFRBVMIQ-AWEZNQCLSA-N 1 2 243.310 2.253 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2cscn2)ncn1 ZINC000393761415 582922807 /nfs/dbraw/zinc/92/28/07/582922807.db2.gz WZSNNFXUBHRLJJ-VIFPVBQESA-N 1 2 234.328 2.092 20 0 BEADLO CCn1cc(CNc2cccc[nH+]2)c(C)n1 ZINC000892636110 582934992 /nfs/dbraw/zinc/93/49/92/582934992.db2.gz DBJNSQJNNOIETO-UHFFFAOYSA-N 1 2 216.288 2.219 20 0 BEADLO Cc1cc(C[NH2+]Cc2nccs2)cnc1F ZINC000892641927 582936602 /nfs/dbraw/zinc/93/66/02/582936602.db2.gz ZSKHVFLPEMCFBU-UHFFFAOYSA-N 1 2 237.303 2.275 20 0 BEADLO C[C@@H](Nc1cccc([C@H](C)O)[nH+]1)c1cnn(C)c1 ZINC000892663746 582944531 /nfs/dbraw/zinc/94/45/31/582944531.db2.gz ULHMQFCZWQAONM-ZJUUUORDSA-N 1 2 246.314 2.042 20 0 BEADLO C[C@@H](O)c1cccc(NCCC2CC2)[nH+]1 ZINC000892704924 582961184 /nfs/dbraw/zinc/96/11/84/582961184.db2.gz QYSLKUYAUFRISR-SECBINFHSA-N 1 2 206.289 2.347 20 0 BEADLO C[C@@H](NC(=O)C[C@H](C)C1CC1)c1[nH+]ccn1C ZINC000856278118 588866494 /nfs/dbraw/zinc/86/64/94/588866494.db2.gz XUFIRLVKTZCYHC-VHSXEESVSA-N 1 2 235.331 2.034 20 0 BEADLO CCN(CCCO)c1cc(C)[nH+]c(C2CCC2)n1 ZINC000892734346 582971863 /nfs/dbraw/zinc/97/18/63/582971863.db2.gz XCEIFZMKYPBYCB-UHFFFAOYSA-N 1 2 249.358 2.261 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2cccc(F)n2)CCO1 ZINC000851871887 582974550 /nfs/dbraw/zinc/97/45/50/582974550.db2.gz XNMXIMAZERSVCX-GFCCVEGCSA-N 1 2 238.306 2.222 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2cccc(F)n2)CCO1 ZINC000851871887 582974551 /nfs/dbraw/zinc/97/45/51/582974551.db2.gz XNMXIMAZERSVCX-GFCCVEGCSA-N 1 2 238.306 2.222 20 0 BEADLO CCC(=CC(=O)N[C@H](C)c1[nH+]ccn1C)CC ZINC000856278097 588866733 /nfs/dbraw/zinc/86/67/33/588866733.db2.gz XOTCFWYFJHHQOA-SNVBAGLBSA-N 1 2 235.331 2.344 20 0 BEADLO CC(C)[C@@H](F)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000784112495 582978639 /nfs/dbraw/zinc/97/86/39/582978639.db2.gz LHVZESIVYKACJL-LLVKDONJSA-N 1 2 235.262 2.267 20 0 BEADLO C[C@H]([NH2+]Cc1cnon1)c1cccc(F)c1F ZINC000851904840 582979521 /nfs/dbraw/zinc/97/95/21/582979521.db2.gz CYPYJFMDVOYWNO-ZETCQYMHSA-N 1 2 239.225 2.199 20 0 BEADLO Cc1cc(NCC2(CO)CC2)nc(C2CCC2)[nH+]1 ZINC000892778121 582981003 /nfs/dbraw/zinc/98/10/03/582981003.db2.gz IHTQBNFQKQNFRT-UHFFFAOYSA-N 1 2 247.342 2.237 20 0 BEADLO C[C@@H](NC(=O)C1CC(C)(C)C1)c1[nH+]ccn1C ZINC000856282153 588867211 /nfs/dbraw/zinc/86/72/11/588867211.db2.gz VHNWBBKVKURXPT-SECBINFHSA-N 1 2 235.331 2.034 20 0 BEADLO Cc1cn2ccc(NC(=O)C3(F)CC3)cc2[nH+]1 ZINC000856288546 588867405 /nfs/dbraw/zinc/86/74/05/588867405.db2.gz WQEXCMKTZFNIJQ-UHFFFAOYSA-N 1 2 233.246 2.083 20 0 BEADLO CCc1cc(N(C)C[C@@H]2CCOC2)nc(CC)[nH+]1 ZINC000892821333 582988238 /nfs/dbraw/zinc/98/82/38/582988238.db2.gz HNGNRWUJRQKHRB-NSHDSACASA-N 1 2 249.358 2.074 20 0 BEADLO c1csc(N2CCC(c3c[nH]c[nH+]3)CC2)n1 ZINC000892854830 582997635 /nfs/dbraw/zinc/99/76/35/582997635.db2.gz GBMIKOXQARKKQF-UHFFFAOYSA-N 1 2 234.328 2.250 20 0 BEADLO c1csc(N2CCC(c3c[nH+]c[nH]3)CC2)n1 ZINC000892854830 582997637 /nfs/dbraw/zinc/99/76/37/582997637.db2.gz GBMIKOXQARKKQF-UHFFFAOYSA-N 1 2 234.328 2.250 20 0 BEADLO CCc1cc(N2CCO[C@H](C)[C@H]2C)nc(CC)[nH+]1 ZINC000892941661 583013337 /nfs/dbraw/zinc/01/33/37/583013337.db2.gz GJJGZHQASXVGQS-GHMZBOCLSA-N 1 2 249.358 2.215 20 0 BEADLO C[C@H]1CN(c2cc(N(C)C)[nH+]cn2)CC[C@@H]1C ZINC000893055486 583038376 /nfs/dbraw/zinc/03/83/76/583038376.db2.gz FCTAZIREGCACLP-QWRGUYRKSA-N 1 2 234.347 2.025 20 0 BEADLO C[C@H]1CN(c2cc(N(C)C)nc[nH+]2)CC[C@@H]1C ZINC000893055486 583038378 /nfs/dbraw/zinc/03/83/78/583038378.db2.gz FCTAZIREGCACLP-QWRGUYRKSA-N 1 2 234.347 2.025 20 0 BEADLO C[C@H]1CN(c2nccn3c[nH+]cc23)CC[C@@H]1C ZINC000893055415 583038704 /nfs/dbraw/zinc/03/87/04/583038704.db2.gz CHWBWVPWGMISTO-QWRGUYRKSA-N 1 2 230.315 2.212 20 0 BEADLO C[C@@H](O)c1cccc(N[C@@H]2CCO[C@H](C)C2)[nH+]1 ZINC000893087587 583046275 /nfs/dbraw/zinc/04/62/75/583046275.db2.gz CXJIRMFIWIFKGU-GMTAPVOTSA-N 1 2 236.315 2.114 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1c1cc(N(C)C)[nH+]cn1 ZINC000893092810 583048483 /nfs/dbraw/zinc/04/84/83/583048483.db2.gz RWZZLNSTPQNULS-MNOVXSKESA-N 1 2 234.347 2.310 20 0 BEADLO CC[C@H]1CC[C@@H](C)N1c1cc(N(C)C)nc[nH+]1 ZINC000893092810 583048485 /nfs/dbraw/zinc/04/84/85/583048485.db2.gz RWZZLNSTPQNULS-MNOVXSKESA-N 1 2 234.347 2.310 20 0 BEADLO c1csc(N2CCC[C@H]2c2[nH]cc[nH+]2)n1 ZINC000893100344 583049756 /nfs/dbraw/zinc/04/97/56/583049756.db2.gz GPLZWTGQOYGBHA-QMMMGPOBSA-N 1 2 220.301 2.208 20 0 BEADLO CC(C)c1nc(N2CC[C@@H](C)[C@H](CO)C2)cc[nH+]1 ZINC000856780659 588877520 /nfs/dbraw/zinc/87/75/20/588877520.db2.gz NWNJPJGDYGMNCW-NEPJUHHUSA-N 1 2 249.358 2.055 20 0 BEADLO Cc1c[nH+]c2n1CC[C@@H]2OC(=O)c1ccco1 ZINC000893516399 583155736 /nfs/dbraw/zinc/15/57/36/583155736.db2.gz KUDYRLZDBUKAIP-VIFPVBQESA-N 1 2 232.239 2.086 20 0 BEADLO Cc1ccoc1C(=O)O[C@@H]1CCn2c(C)c[nH+]c21 ZINC000893518218 583156187 /nfs/dbraw/zinc/15/61/87/583156187.db2.gz JQVXATBPJVPUJY-SNVBAGLBSA-N 1 2 246.266 2.395 20 0 BEADLO Cc1c[nH+]c2n1CC[C@@H]2OC(=O)Cc1ccco1 ZINC000893522800 583156579 /nfs/dbraw/zinc/15/65/79/583156579.db2.gz FZDDXPZJGXHBPW-NSHDSACASA-N 1 2 246.266 2.015 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2nncn2C)cc1F ZINC000094837550 583170267 /nfs/dbraw/zinc/17/02/67/583170267.db2.gz QEMDAIXVDDBXBF-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO CC1=C(C)CN(c2nccn3c[nH+]cc23)CC1 ZINC000893641368 583184152 /nfs/dbraw/zinc/18/41/52/583184152.db2.gz FZCLEOIZLYQTQT-UHFFFAOYSA-N 1 2 228.299 2.276 20 0 BEADLO CCC1(C)C[NH+](Cc2cn(C)nc2Cl)C1 ZINC000857047595 588884219 /nfs/dbraw/zinc/88/42/19/588884219.db2.gz NSQRCNCWUNPQCI-UHFFFAOYSA-N 1 2 227.739 2.305 20 0 BEADLO COc1ccc2ccc(N(C)[C@H](C)CO)[nH+]c2c1 ZINC000893739942 583216123 /nfs/dbraw/zinc/21/61/23/583216123.db2.gz KVVFWUURDRKJSO-SNVBAGLBSA-N 1 2 246.310 2.060 20 0 BEADLO CC[C@H]1CN(Cc2[nH]cc(C(C)C)[nH+]2)CCO1 ZINC000893918708 583247220 /nfs/dbraw/zinc/24/72/20/583247220.db2.gz CXRJOFOTLYPLRT-NSHDSACASA-N 1 2 237.347 2.144 20 0 BEADLO Cc1[nH]nc(C[NH+]2C3CCC2CC3)c1C ZINC000893918185 583247420 /nfs/dbraw/zinc/24/74/20/583247420.db2.gz IBUGSNOCXPXROZ-UHFFFAOYSA-N 1 2 205.305 2.153 20 0 BEADLO COC(=O)c1cnc(C[N@H+](C)CC(C)C)s1 ZINC000893925601 583248894 /nfs/dbraw/zinc/24/88/94/583248894.db2.gz VRHUMNWONITQDO-UHFFFAOYSA-N 1 2 242.344 2.018 20 0 BEADLO COC(=O)c1cnc(C[N@@H+](C)CC(C)C)s1 ZINC000893925601 583248896 /nfs/dbraw/zinc/24/88/96/583248896.db2.gz VRHUMNWONITQDO-UHFFFAOYSA-N 1 2 242.344 2.018 20 0 BEADLO CC[N@H+](CCOC)Cc1nc(C(C)C)c[nH]1 ZINC000893927935 583250794 /nfs/dbraw/zinc/25/07/94/583250794.db2.gz SKZPKRIVMHVPEG-UHFFFAOYSA-N 1 2 225.336 2.001 20 0 BEADLO CC[N@@H+](CCOC)Cc1nc(C(C)C)c[nH]1 ZINC000893927935 583250796 /nfs/dbraw/zinc/25/07/96/583250796.db2.gz SKZPKRIVMHVPEG-UHFFFAOYSA-N 1 2 225.336 2.001 20 0 BEADLO Cc1ccoc1CNc1cc(N(C)C)nc[nH+]1 ZINC000893952218 583260189 /nfs/dbraw/zinc/26/01/89/583260189.db2.gz VUABBLXONZNFDA-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO Cc1ccoc1CNc1cc(N(C)C)[nH+]cn1 ZINC000893952218 583260190 /nfs/dbraw/zinc/26/01/90/583260190.db2.gz VUABBLXONZNFDA-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO CC[C@@H]1CCC[N@@H+]1Cc1n[nH]c(C)c1C ZINC000893974677 583265404 /nfs/dbraw/zinc/26/54/04/583265404.db2.gz VYFRYYVIFYYLBG-LLVKDONJSA-N 1 2 207.321 2.401 20 0 BEADLO CC[C@@H]1CCC[N@H+]1Cc1n[nH]c(C)c1C ZINC000893974677 583265405 /nfs/dbraw/zinc/26/54/05/583265405.db2.gz VYFRYYVIFYYLBG-LLVKDONJSA-N 1 2 207.321 2.401 20 0 BEADLO Cc1coc(C[N@@H+](C)Cc2cnccn2)c1 ZINC000893978171 583266087 /nfs/dbraw/zinc/26/60/87/583266087.db2.gz QHVSAQPDTCUBAI-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1coc(C[N@H+](C)Cc2cnccn2)c1 ZINC000893978171 583266090 /nfs/dbraw/zinc/26/60/90/583266090.db2.gz QHVSAQPDTCUBAI-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ncoc1CN1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000893986716 583269059 /nfs/dbraw/zinc/26/90/59/583269059.db2.gz LPELTNFAUYSFPM-LLVKDONJSA-N 1 2 246.314 2.433 20 0 BEADLO CC[C@H](CO)N(C)c1cc(C)[nH+]c(C2CCC2)n1 ZINC000894016025 583275941 /nfs/dbraw/zinc/27/59/41/583275941.db2.gz HIOIIMAIICODOH-GFCCVEGCSA-N 1 2 249.358 2.260 20 0 BEADLO CCc1cc(N2CC[C@H](F)C2)nc(CC)[nH+]1 ZINC000894023700 583280540 /nfs/dbraw/zinc/28/05/40/583280540.db2.gz RXFOIXOQUVDPSA-VIFPVBQESA-N 1 2 223.295 2.150 20 0 BEADLO CC(C)c1c[nH]c(CN2CCO[C@@H](C)[C@H]2C)[nH+]1 ZINC000894026544 583281136 /nfs/dbraw/zinc/28/11/36/583281136.db2.gz MMKRSCDIVNHIKR-MNOVXSKESA-N 1 2 237.347 2.142 20 0 BEADLO Cc1cc(CNc2cccc([C@@H](C)O)[nH+]2)ccn1 ZINC000894028323 583282183 /nfs/dbraw/zinc/28/21/83/583282183.db2.gz NIZKQSAAVKYKMQ-LLVKDONJSA-N 1 2 243.310 2.450 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)[C@H]1C[C@H]2C[C@H]2C1 ZINC000857140490 588890356 /nfs/dbraw/zinc/89/03/56/588890356.db2.gz IEBKULWFPYZNFO-URLYPYJESA-N 1 2 241.294 2.319 20 0 BEADLO Cc1ncoc1C[N@@H+](C)Cc1cccc(C)n1 ZINC000894050139 583288543 /nfs/dbraw/zinc/28/85/43/583288543.db2.gz PKSOLLFFWYUOQS-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ncoc1C[N@H+](C)Cc1cccc(C)n1 ZINC000894050139 583288544 /nfs/dbraw/zinc/28/85/44/583288544.db2.gz PKSOLLFFWYUOQS-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CC[C@@H]1C[C@H]1CNc1cc(N(C)C)nc[nH+]1 ZINC000894056044 583290732 /nfs/dbraw/zinc/29/07/32/583290732.db2.gz GZFOKCGEAXJVDZ-ZJUUUORDSA-N 1 2 220.320 2.001 20 0 BEADLO CC[C@@H]1C[C@H]1CNc1cc(N(C)C)[nH+]cn1 ZINC000894056044 583290734 /nfs/dbraw/zinc/29/07/34/583290734.db2.gz GZFOKCGEAXJVDZ-ZJUUUORDSA-N 1 2 220.320 2.001 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CC[C@H](C3CC3)C2)c1C ZINC000894071915 583296685 /nfs/dbraw/zinc/29/66/85/583296685.db2.gz LLUSXYVUXCGXAJ-LBPRGKRZSA-N 1 2 219.332 2.258 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CC[C@H](C3CC3)C2)c1C ZINC000894071915 583296688 /nfs/dbraw/zinc/29/66/88/583296688.db2.gz LLUSXYVUXCGXAJ-LBPRGKRZSA-N 1 2 219.332 2.258 20 0 BEADLO Cc1coc(COC(=O)CCCn2cc[nH+]c2)c1 ZINC000894137427 583315284 /nfs/dbraw/zinc/31/52/84/583315284.db2.gz QCQNOHUTPIQBCE-UHFFFAOYSA-N 1 2 248.282 2.308 20 0 BEADLO FC1(F)CC[NH+](Cc2nccn2C2CC2)CC1 ZINC000894178187 583328726 /nfs/dbraw/zinc/32/87/26/583328726.db2.gz IDBSSIPARBVXDZ-UHFFFAOYSA-N 1 2 241.285 2.449 20 0 BEADLO CNc1cc(N2CC[C@H](C3CCC3)C2)nc[nH+]1 ZINC000894227092 583383580 /nfs/dbraw/zinc/38/35/80/583383580.db2.gz PJEKOVJGZVXKGS-NSHDSACASA-N 1 2 232.331 2.145 20 0 BEADLO CNc1cc(N2CC[C@H](C3CCC3)C2)[nH+]cn1 ZINC000894227092 583383582 /nfs/dbraw/zinc/38/35/82/583383582.db2.gz PJEKOVJGZVXKGS-NSHDSACASA-N 1 2 232.331 2.145 20 0 BEADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1cnc[nH]1)CCO2 ZINC000894231324 583384352 /nfs/dbraw/zinc/38/43/52/583384352.db2.gz QOMWCHUJEOXMQD-GFCCVEGCSA-N 1 2 247.273 2.162 20 0 BEADLO C[C@H]1[C@@H](C)N(c2nccn3c[nH+]cc23)C[C@H]1C ZINC000894234406 583385396 /nfs/dbraw/zinc/38/53/96/583385396.db2.gz IMBRPNPNRUDBTB-GMTAPVOTSA-N 1 2 230.315 2.210 20 0 BEADLO CCC[C@@H](C)CC(=O)OCc1c[nH+]cn1C ZINC000747781424 583388504 /nfs/dbraw/zinc/38/85/04/583388504.db2.gz KXBBHXURRCUOHZ-SNVBAGLBSA-N 1 2 224.304 2.290 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+]CCc1ccc(C)cc1 ZINC000204328201 583388512 /nfs/dbraw/zinc/38/85/12/583388512.db2.gz GVARBRKTLGTMFY-LBPRGKRZSA-N 1 2 235.327 2.079 20 0 BEADLO CCOc1cc(C)ccc1C[NH2+]Cc1cnc[nH]1 ZINC000894333054 583426242 /nfs/dbraw/zinc/42/62/42/583426242.db2.gz UEXRQFOBYKCNJJ-UHFFFAOYSA-N 1 2 245.326 2.407 20 0 BEADLO CCOc1cc(C)ccc1C[NH2+]Cc1c[nH]cn1 ZINC000894333054 583426244 /nfs/dbraw/zinc/42/62/44/583426244.db2.gz UEXRQFOBYKCNJJ-UHFFFAOYSA-N 1 2 245.326 2.407 20 0 BEADLO CN(C)c1cc(N2CC[C@@H]3CCCC[C@@H]32)nc[nH+]1 ZINC000894341769 583428814 /nfs/dbraw/zinc/42/88/14/583428814.db2.gz GLLHLAGUCQSWAU-RYUDHWBXSA-N 1 2 246.358 2.312 20 0 BEADLO CN(C)c1cc(N2CC[C@@H]3CCCC[C@@H]32)[nH+]cn1 ZINC000894341769 583428817 /nfs/dbraw/zinc/42/88/17/583428817.db2.gz GLLHLAGUCQSWAU-RYUDHWBXSA-N 1 2 246.358 2.312 20 0 BEADLO CCc1cc(N[C@@H]2CO[C@H](C)C2)nc(CC)[nH+]1 ZINC000894362556 583437786 /nfs/dbraw/zinc/43/77/86/583437786.db2.gz WXEGFWBRKYXQDZ-KOLCDFICSA-N 1 2 235.331 2.191 20 0 BEADLO Cc1ncoc1C[N@@H+](C)Cc1cccnc1 ZINC000894420975 583455475 /nfs/dbraw/zinc/45/54/75/583455475.db2.gz BBCQJWBBHCZKAP-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ncoc1C[N@H+](C)Cc1cccnc1 ZINC000894420975 583455476 /nfs/dbraw/zinc/45/54/76/583455476.db2.gz BBCQJWBBHCZKAP-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO CO[C@H]1Cc2ccc(NCc3c[nH+]c[nH]3)cc2C1 ZINC000894445266 583460534 /nfs/dbraw/zinc/46/05/34/583460534.db2.gz PPRVAABQWSVEEK-AWEZNQCLSA-N 1 2 243.310 2.135 20 0 BEADLO CO[C@H]1Cc2ccc(NCc3c[nH]c[nH+]3)cc2C1 ZINC000894445266 583460535 /nfs/dbraw/zinc/46/05/35/583460535.db2.gz PPRVAABQWSVEEK-AWEZNQCLSA-N 1 2 243.310 2.135 20 0 BEADLO Cc1n[nH]c(C[N@@H+](C)Cc2ccncc2)c1C ZINC000894448360 583462482 /nfs/dbraw/zinc/46/24/82/583462482.db2.gz GDSHUDUYKQILQP-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO Cc1n[nH]c(C[N@H+](C)Cc2ccncc2)c1C ZINC000894448360 583462486 /nfs/dbraw/zinc/46/24/86/583462486.db2.gz GDSHUDUYKQILQP-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO C[C@H](C1CC1)n1cc(NCc2c[nH+]c[nH]2)cn1 ZINC000894496718 583474041 /nfs/dbraw/zinc/47/40/41/583474041.db2.gz VRGPZQINIRKXRR-SECBINFHSA-N 1 2 231.303 2.189 20 0 BEADLO C[C@H](C1CC1)n1cc(NCc2c[nH]c[nH+]2)cn1 ZINC000894496718 583474043 /nfs/dbraw/zinc/47/40/43/583474043.db2.gz VRGPZQINIRKXRR-SECBINFHSA-N 1 2 231.303 2.189 20 0 BEADLO FC(F)(CNCc1c[nH+]c[nH]1)c1ccccc1 ZINC000894540756 583480762 /nfs/dbraw/zinc/48/07/62/583480762.db2.gz MXNDVGCXSWBMGM-UHFFFAOYSA-N 1 2 237.253 2.291 20 0 BEADLO FC(F)(CNCc1c[nH]c[nH+]1)c1ccccc1 ZINC000894540756 583480763 /nfs/dbraw/zinc/48/07/63/583480763.db2.gz MXNDVGCXSWBMGM-UHFFFAOYSA-N 1 2 237.253 2.291 20 0 BEADLO C[C@H](O)c1cccc(NCCc2ccoc2)[nH+]1 ZINC000894554663 583483482 /nfs/dbraw/zinc/48/34/82/583483482.db2.gz LQPDWNSMMYWPBQ-JTQLQIEISA-N 1 2 232.283 2.383 20 0 BEADLO CC[C@@H](Nc1cc(N(C)C)nc[nH+]1)C1CC1 ZINC000894571883 583485569 /nfs/dbraw/zinc/48/55/69/583485569.db2.gz BHGMSEKQPILJDY-SNVBAGLBSA-N 1 2 220.320 2.143 20 0 BEADLO CC[C@@H](Nc1cc(N(C)C)[nH+]cn1)C1CC1 ZINC000894571883 583485573 /nfs/dbraw/zinc/48/55/73/583485573.db2.gz BHGMSEKQPILJDY-SNVBAGLBSA-N 1 2 220.320 2.143 20 0 BEADLO CC[C@H](Nc1cc(N(C)C)nc[nH+]1)C1CC1 ZINC000894571881 583485862 /nfs/dbraw/zinc/48/58/62/583485862.db2.gz BHGMSEKQPILJDY-JTQLQIEISA-N 1 2 220.320 2.143 20 0 BEADLO CC[C@H](Nc1cc(N(C)C)[nH+]cn1)C1CC1 ZINC000894571881 583485864 /nfs/dbraw/zinc/48/58/64/583485864.db2.gz BHGMSEKQPILJDY-JTQLQIEISA-N 1 2 220.320 2.143 20 0 BEADLO CC1C[C@H]2CC[C@@H](C1)N2c1cc(N(C)C)[nH+]cn1 ZINC000894625064 583496073 /nfs/dbraw/zinc/49/60/73/583496073.db2.gz YWHRQAHSNNTZGM-YOGCLGLASA-N 1 2 246.358 2.310 20 0 BEADLO CC1C[C@H]2CC[C@@H](C1)N2c1cc(N(C)C)nc[nH+]1 ZINC000894625064 583496076 /nfs/dbraw/zinc/49/60/76/583496076.db2.gz YWHRQAHSNNTZGM-YOGCLGLASA-N 1 2 246.358 2.310 20 0 BEADLO O[C@H]1C[C@H](Nc2cc(C3CC3)[nH+]c(C3CC3)n2)C1 ZINC000894640438 583499522 /nfs/dbraw/zinc/49/95/22/583499522.db2.gz DDDJNXDNRFLEIR-XYPYZODXSA-N 1 2 245.326 2.167 20 0 BEADLO CCOC1C[NH+](Cc2ccc3c(c2)CCCO3)C1 ZINC000894820225 583524927 /nfs/dbraw/zinc/52/49/27/583524927.db2.gz SFZZLGTVTRPPMI-UHFFFAOYSA-N 1 2 247.338 2.232 20 0 BEADLO CCOC1C[NH+](Cc2ccc(OC)cc2C)C1 ZINC000894820199 583525057 /nfs/dbraw/zinc/52/50/57/583525057.db2.gz RSEMQDYUTCGEGC-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO CO[C@@H](C)CC(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000726945347 583532891 /nfs/dbraw/zinc/53/28/91/583532891.db2.gz OECHZJLSQUUUMB-JTQLQIEISA-N 1 2 247.298 2.006 20 0 BEADLO CCOc1ccc(C[NH2+][C@@H](C)c2ccn(C)n2)o1 ZINC000894866371 583537951 /nfs/dbraw/zinc/53/79/51/583537951.db2.gz UWZQBJNNDVZMSH-JTQLQIEISA-N 1 2 249.314 2.263 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2CCC[C@@](C)(F)C2)c1C ZINC000894869002 583539072 /nfs/dbraw/zinc/53/90/72/583539072.db2.gz LDQLGIWRFHEPOI-GFCCVEGCSA-N 1 2 225.311 2.351 20 0 BEADLO Cc1n[nH]c(C[N@H+]2CCC[C@@](C)(F)C2)c1C ZINC000894869002 583539074 /nfs/dbraw/zinc/53/90/74/583539074.db2.gz LDQLGIWRFHEPOI-GFCCVEGCSA-N 1 2 225.311 2.351 20 0 BEADLO FCC(CF)[NH2+]Cc1cccc2c1NCCC2 ZINC000894871741 583540356 /nfs/dbraw/zinc/54/03/56/583540356.db2.gz BAKKXNXMLUCKMY-UHFFFAOYSA-N 1 2 240.297 2.442 20 0 BEADLO CCNc1cc(CNc2nccnc2F)cc[nH+]1 ZINC000894871921 583540586 /nfs/dbraw/zinc/54/05/86/583540586.db2.gz GVADGTCDYHCPOZ-UHFFFAOYSA-N 1 2 247.277 2.055 20 0 BEADLO CCNc1cc(CNc2cnc(F)cn2)cc[nH+]1 ZINC000894874374 583540767 /nfs/dbraw/zinc/54/07/67/583540767.db2.gz YLZCQWSHHUFJIF-UHFFFAOYSA-N 1 2 247.277 2.055 20 0 BEADLO Cc1coc(C)c1C(=O)OCCCn1cc[nH+]c1 ZINC000792759115 583545686 /nfs/dbraw/zinc/54/56/86/583545686.db2.gz UOZNAZOSCPJNMX-UHFFFAOYSA-N 1 2 248.282 2.340 20 0 BEADLO COCC1(C)C[NH+](Cc2ccc(Cl)cn2)C1 ZINC000894979810 583563326 /nfs/dbraw/zinc/56/33/26/583563326.db2.gz ABIQCULWWSUSRH-UHFFFAOYSA-N 1 2 240.734 2.203 20 0 BEADLO Cc1ncoc1C[NH2+]Cc1ccc(C)c(C)n1 ZINC000894986467 583565086 /nfs/dbraw/zinc/56/50/86/583565086.db2.gz PLBGHHSATLCXSG-UHFFFAOYSA-N 1 2 231.299 2.285 20 0 BEADLO CCOc1ccc(CNc2cc(CO)cc[nH+]2)o1 ZINC000894988647 583565191 /nfs/dbraw/zinc/56/51/91/583565191.db2.gz IGHQBJNVUIOFFQ-UHFFFAOYSA-N 1 2 248.282 2.178 20 0 BEADLO F[C@@]1(c2ccccc2)C[C@H]1[NH2+]Cc1cnc[nH]1 ZINC000895053582 583574516 /nfs/dbraw/zinc/57/45/16/583574516.db2.gz OIFFKTWROVEUGO-CHWSQXEVSA-N 1 2 231.274 2.137 20 0 BEADLO Fc1cccnc1C[NH2+][C@H]1CCCc2cn[nH]c21 ZINC000857857588 588914439 /nfs/dbraw/zinc/91/44/39/588914439.db2.gz FVWOENKFGKHOMH-NSHDSACASA-N 1 2 246.289 2.111 20 0 BEADLO Fc1cccnc1C[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000857857588 588914440 /nfs/dbraw/zinc/91/44/40/588914440.db2.gz FVWOENKFGKHOMH-NSHDSACASA-N 1 2 246.289 2.111 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2CCC[C@@H]2CCO)c1C ZINC000882214741 583598446 /nfs/dbraw/zinc/59/84/46/583598446.db2.gz ZAWNANSUNUUIMZ-NEPJUHHUSA-N 1 2 235.331 2.056 20 0 BEADLO COc1ccc(N[C@H]2CCCc3c[nH]nc32)[nH+]c1 ZINC000857861931 588915383 /nfs/dbraw/zinc/91/53/83/588915383.db2.gz WWTGAQIQTIPILN-NSHDSACASA-N 1 2 244.298 2.303 20 0 BEADLO CCc1cc[nH+]cc1N[C@H]1CC[C@H](C(=O)OC)C1 ZINC000895142956 583603655 /nfs/dbraw/zinc/60/36/55/583603655.db2.gz YKRHEPKMCBKCTG-RYUDHWBXSA-N 1 2 248.326 2.398 20 0 BEADLO CN(C)c1cc(F)cc(NCc2[nH+]ccn2C)c1 ZINC000895172768 583613301 /nfs/dbraw/zinc/61/33/01/583613301.db2.gz RSKKSBHLRIRPPG-UHFFFAOYSA-N 1 2 248.305 2.237 20 0 BEADLO F[C@H]1CCCN(Cc2[nH+]ccn2C2CC2)C1 ZINC000895191893 583621753 /nfs/dbraw/zinc/62/17/53/583621753.db2.gz ULAVSPQAKKKQLR-JTQLQIEISA-N 1 2 223.295 2.152 20 0 BEADLO Cc1[nH]c([C@@H]2CCCN2c2ncccn2)[nH+]c1C ZINC000895192855 583622145 /nfs/dbraw/zinc/62/21/45/583622145.db2.gz JXLLWSSXQHSHEK-NSHDSACASA-N 1 2 243.314 2.158 20 0 BEADLO Cc1coc(C[N@@H+]2CCO[C@](C)(C(F)F)C2)c1 ZINC000895359171 583659366 /nfs/dbraw/zinc/65/93/66/583659366.db2.gz AVVVCSXMOAMIGK-LBPRGKRZSA-N 1 2 245.269 2.444 20 0 BEADLO Cc1coc(C[N@H+]2CCO[C@](C)(C(F)F)C2)c1 ZINC000895359171 583659367 /nfs/dbraw/zinc/65/93/67/583659367.db2.gz AVVVCSXMOAMIGK-LBPRGKRZSA-N 1 2 245.269 2.444 20 0 BEADLO O=C(CCCn1cc[nH+]c1)NC1(C2CC2)CCC1 ZINC000895361052 583659897 /nfs/dbraw/zinc/65/98/97/583659897.db2.gz XGXWLLNQFCSIOY-UHFFFAOYSA-N 1 2 247.342 2.112 20 0 BEADLO CCC(F)(F)CNCc1c(C)cc[nH+]c1N ZINC000895393769 583664681 /nfs/dbraw/zinc/66/46/81/583664681.db2.gz NGBCAMPAXIIORD-UHFFFAOYSA-N 1 2 229.274 2.107 20 0 BEADLO CC[C@](C)(C[N@@H+]1CC[C@@H]1C(F)F)OC ZINC000895431990 583670965 /nfs/dbraw/zinc/67/09/65/583670965.db2.gz SEOPWMIPDJSXIK-PSASIEDQSA-N 1 2 207.264 2.141 20 0 BEADLO CC[C@](C)(C[N@H+]1CC[C@@H]1C(F)F)OC ZINC000895431990 583670966 /nfs/dbraw/zinc/67/09/66/583670966.db2.gz SEOPWMIPDJSXIK-PSASIEDQSA-N 1 2 207.264 2.141 20 0 BEADLO CC[C@H](C)[C@@H](C[N@@H+]1CC[C@H]1C(F)F)OC ZINC000895431430 583671019 /nfs/dbraw/zinc/67/10/19/583671019.db2.gz MOFWGNPRCJXJDR-LPEHRKFASA-N 1 2 221.291 2.387 20 0 BEADLO CC[C@H](C)[C@@H](C[N@H+]1CC[C@H]1C(F)F)OC ZINC000895431430 583671021 /nfs/dbraw/zinc/67/10/21/583671021.db2.gz MOFWGNPRCJXJDR-LPEHRKFASA-N 1 2 221.291 2.387 20 0 BEADLO Cc1[nH]nc(C[NH+]2CCC(C)(F)CC2)c1C ZINC000895447564 583675951 /nfs/dbraw/zinc/67/59/51/583675951.db2.gz ONAALCWUTRSZBT-UHFFFAOYSA-N 1 2 225.311 2.351 20 0 BEADLO C[N@H+](Cc1ccns1)CC1(F)CC1 ZINC000895452523 583676361 /nfs/dbraw/zinc/67/63/61/583676361.db2.gz NXQFMEMBFDBYOC-UHFFFAOYSA-N 1 2 200.282 2.077 20 0 BEADLO C[N@@H+](Cc1ccns1)CC1(F)CC1 ZINC000895452523 583676363 /nfs/dbraw/zinc/67/63/63/583676363.db2.gz NXQFMEMBFDBYOC-UHFFFAOYSA-N 1 2 200.282 2.077 20 0 BEADLO Cc1ncoc1C[N@H+](C)Cc1ccns1 ZINC000895452648 583677085 /nfs/dbraw/zinc/67/70/85/583677085.db2.gz RJPVZDRPYAZBJG-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO Cc1ncoc1C[N@@H+](C)Cc1ccns1 ZINC000895452648 583677086 /nfs/dbraw/zinc/67/70/86/583677086.db2.gz RJPVZDRPYAZBJG-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO Cc1oc(C(C)(C)C)cc1C[NH2+]Cc1cnn[nH]1 ZINC000895530395 583685067 /nfs/dbraw/zinc/68/50/67/583685067.db2.gz HXEKGCRDRFMXSW-UHFFFAOYSA-N 1 2 248.330 2.293 20 0 BEADLO Cc1nc(N[C@@H]2C[C@H]2[C@@H]2C[C@H]2C)cc[nH+]1 ZINC000895540206 583687942 /nfs/dbraw/zinc/68/79/42/583687942.db2.gz DDBLRKJUUORJKX-CZULRBLNSA-N 1 2 203.289 2.241 20 0 BEADLO C[C@@H](O)c1ccc(N[C@@H]2CCO[C@H]2C2CC2)[nH+]c1 ZINC000895543288 583688370 /nfs/dbraw/zinc/68/83/70/583688370.db2.gz HSPCCHOCDSYVLW-IUPBHXKESA-N 1 2 248.326 2.114 20 0 BEADLO Cn1cc(C[NH+]2CCC(F)CC2)c(Cl)n1 ZINC000895545054 583689096 /nfs/dbraw/zinc/68/90/96/583689096.db2.gz AHUQCVLURYEQDO-UHFFFAOYSA-N 1 2 231.702 2.007 20 0 BEADLO Cc1c(Cl)c(C[NH+]2CCC(F)CC2)nn1C ZINC000895545813 583689850 /nfs/dbraw/zinc/68/98/50/583689850.db2.gz HVISJEVENXIMOZ-UHFFFAOYSA-N 1 2 245.729 2.316 20 0 BEADLO Cc1nnc(C[NH+]2CC(Cc3ccco3)C2)s1 ZINC000895597149 583695358 /nfs/dbraw/zinc/69/53/58/583695358.db2.gz FAVUQDWTGSQFTR-UHFFFAOYSA-N 1 2 249.339 2.114 20 0 BEADLO CCc1ccc(C[N@@H+]2CCc3ncncc3C2)o1 ZINC000895722307 583712190 /nfs/dbraw/zinc/71/21/90/583712190.db2.gz GZPZHYIBNOEXOY-UHFFFAOYSA-N 1 2 243.310 2.190 20 0 BEADLO CCc1ccc(C[N@H+]2CCc3ncncc3C2)o1 ZINC000895722307 583712193 /nfs/dbraw/zinc/71/21/93/583712193.db2.gz GZPZHYIBNOEXOY-UHFFFAOYSA-N 1 2 243.310 2.190 20 0 BEADLO Cc1nc(N2CCO[C@@H](C)CC2)c(C)c(C)[nH+]1 ZINC000895758181 583721136 /nfs/dbraw/zinc/72/11/36/583721136.db2.gz NHKAZNWHXJIUOZ-VIFPVBQESA-N 1 2 235.331 2.017 20 0 BEADLO Cc1cc(N2CCO[C@H](C)CC2)nc(C2CC2)[nH+]1 ZINC000895758846 583721364 /nfs/dbraw/zinc/72/13/64/583721364.db2.gz ZGIGSJMOPMXCRZ-LLVKDONJSA-N 1 2 247.342 2.278 20 0 BEADLO CCc1nc(N[C@H](C)C(C)(C)OC)cc[nH+]1 ZINC000895785512 583727254 /nfs/dbraw/zinc/72/72/54/583727254.db2.gz HXQLXDKSJWAZAI-SECBINFHSA-N 1 2 223.320 2.264 20 0 BEADLO CCc1[nH]nc(Cl)c1C[NH+]1CC(C)(C)C1 ZINC000895825858 583734486 /nfs/dbraw/zinc/73/44/86/583734486.db2.gz POOQKECBIYDVPP-UHFFFAOYSA-N 1 2 227.739 2.467 20 0 BEADLO COc1cccc(C[NH+]2CC(OC(C)C)C2)c1 ZINC000895952836 583751689 /nfs/dbraw/zinc/75/16/89/583751689.db2.gz QBLDLHCTCWBTAZ-UHFFFAOYSA-N 1 2 235.327 2.304 20 0 BEADLO CC(C)OC1C[NH+](Cc2ccsc2)C1 ZINC000895951057 583751798 /nfs/dbraw/zinc/75/17/98/583751798.db2.gz BRUOEVBBISBJRT-UHFFFAOYSA-N 1 2 211.330 2.357 20 0 BEADLO Cc1nc(C)c(C[NH+]2CC(OC(C)C)C2)s1 ZINC000895954778 583751856 /nfs/dbraw/zinc/75/18/56/583751856.db2.gz FUOMMVAODQKLFX-UHFFFAOYSA-N 1 2 240.372 2.369 20 0 BEADLO CC(C)OC1C[NH+](Cc2cc3cnccc3o2)C1 ZINC000895956650 583752597 /nfs/dbraw/zinc/75/25/97/583752597.db2.gz QVDSGOREHAHTCE-UHFFFAOYSA-N 1 2 246.310 2.437 20 0 BEADLO CCCc1cccc(C[N@@H+]2CCO[C@@H](OC)C2)c1 ZINC000895968689 583755137 /nfs/dbraw/zinc/75/51/37/583755137.db2.gz QYUPTPNEQLNBQG-OAHLLOKOSA-N 1 2 249.354 2.444 20 0 BEADLO CCCc1cccc(C[N@H+]2CCO[C@@H](OC)C2)c1 ZINC000895968689 583755138 /nfs/dbraw/zinc/75/51/38/583755138.db2.gz QYUPTPNEQLNBQG-OAHLLOKOSA-N 1 2 249.354 2.444 20 0 BEADLO O=C(CCCC1CC1)N[C@H]1CCn2c[nH+]cc21 ZINC000857977330 588926968 /nfs/dbraw/zinc/92/69/68/588926968.db2.gz CLYGAHVWSGHHGY-NSHDSACASA-N 1 2 233.315 2.024 20 0 BEADLO CC1(C)CCC[C@H]1C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857982205 588927843 /nfs/dbraw/zinc/92/78/43/588927843.db2.gz NOPVWHDUMFYNSA-QWRGUYRKSA-N 1 2 247.342 2.270 20 0 BEADLO O=C(C[C@H]1C=CCCC1)N[C@H]1CCn2c[nH+]cc21 ZINC000857981123 588927980 /nfs/dbraw/zinc/92/79/80/588927980.db2.gz ACBZNPGYURUWSO-RYUDHWBXSA-N 1 2 245.326 2.191 20 0 BEADLO C[C@H](C(=O)N[C@@H]1CCn2c[nH+]cc21)C1CCCC1 ZINC000857982023 588928082 /nfs/dbraw/zinc/92/80/82/588928082.db2.gz DJESFHPQWTXCKV-CMPLNLGQSA-N 1 2 247.342 2.270 20 0 BEADLO CCC/C(C)=C\C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857982619 588928111 /nfs/dbraw/zinc/92/81/11/588928111.db2.gz KJOYHPGHVHMECZ-BRNRAETOSA-N 1 2 233.315 2.191 20 0 BEADLO CC1(C(=O)N[C@H]2CCn3c[nH+]cc32)CCCC1 ZINC000857985040 588928482 /nfs/dbraw/zinc/92/84/82/588928482.db2.gz GVKAVFXGSWKYEB-JTQLQIEISA-N 1 2 233.315 2.024 20 0 BEADLO C[C@@]1(CNc2cc[nH+]cc2F)CCCCO1 ZINC000896183222 583778988 /nfs/dbraw/zinc/77/89/88/583778988.db2.gz WUGYKZXHSCHVGK-LBPRGKRZSA-N 1 2 224.279 2.014 20 0 BEADLO C[C@@H]1CC[C@H](CC(=O)N[C@@H]2CCn3c[nH+]cc32)C1 ZINC000857984376 588928815 /nfs/dbraw/zinc/92/88/15/588928815.db2.gz ZGCXOTPUEQHKRQ-GRYCIOLGSA-N 1 2 247.342 2.270 20 0 BEADLO Cc1cscc1C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857983579 588928846 /nfs/dbraw/zinc/92/88/46/588928846.db2.gz STMBGAFLFSCLRO-JTQLQIEISA-N 1 2 247.323 2.128 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N[C@H]2CCC[C@@H]2C)c[nH+]1 ZINC000896187510 583780760 /nfs/dbraw/zinc/78/07/60/583780760.db2.gz PUOGSRMEIAGJQF-JQWIXIFHSA-N 1 2 249.358 2.231 20 0 BEADLO CNc1cc(N[C@@H]2CCS[C@H](C)C2)[nH+]cn1 ZINC000896245977 583785033 /nfs/dbraw/zinc/78/50/33/583785033.db2.gz KBYJYEWWKWFZBV-RKDXNWHRSA-N 1 2 238.360 2.214 20 0 BEADLO C/C=C(/C=C\C(=O)N[C@H]1CCn2c[nH+]cc21)CC ZINC000857987630 588929390 /nfs/dbraw/zinc/92/93/90/588929390.db2.gz XDJLMNLFBHJOAT-ZBQQSJNQSA-N 1 2 245.326 2.357 20 0 BEADLO O=C(CC1CCCCC1)N[C@@H]1CCn2c[nH+]cc21 ZINC000857991164 588929837 /nfs/dbraw/zinc/92/98/37/588929837.db2.gz VIFIDHPPJZMDGN-GFCCVEGCSA-N 1 2 247.342 2.415 20 0 BEADLO CS/C=C/C(=O)N1CCNc2[nH+]cc(C)cc21 ZINC000857996713 588929941 /nfs/dbraw/zinc/92/99/41/588929941.db2.gz DMOBSLNBEMLUMT-ZZXKWVIFSA-N 1 2 249.339 2.025 20 0 BEADLO Cc1ccsc1C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857990049 588929995 /nfs/dbraw/zinc/92/99/95/588929995.db2.gz MDVWNDCLSZSEOE-VIFPVBQESA-N 1 2 247.323 2.128 20 0 BEADLO C/C=C/C=C/C(=O)N1CCNc2[nH+]cc(C)cc21 ZINC000857995082 588930091 /nfs/dbraw/zinc/93/00/91/588930091.db2.gz ZKSNDVFYOMRGEL-VNKDHWASSA-N 1 2 243.310 2.281 20 0 BEADLO C[C@H]([NH2+]Cc1ccc2c[nH]nc2c1)C(F)F ZINC000883407321 583799488 /nfs/dbraw/zinc/79/94/88/583799488.db2.gz RRHSWPMQVQIUIM-ZETCQYMHSA-N 1 2 225.242 2.306 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N2C[C@H](C)[C@@H](C)C2)c[nH+]1 ZINC000896755824 583830600 /nfs/dbraw/zinc/83/06/00/583830600.db2.gz CISHFSOBIALDRG-QWRGUYRKSA-N 1 2 249.358 2.041 20 0 BEADLO Cc1cc(C[N@@H+]2CCn3cccc3C2)sn1 ZINC000896760523 583831366 /nfs/dbraw/zinc/83/13/66/583831366.db2.gz BHBLHCMMOMNVGS-UHFFFAOYSA-N 1 2 233.340 2.269 20 0 BEADLO Cc1cc(C[N@H+]2CCn3cccc3C2)sn1 ZINC000896760523 583831368 /nfs/dbraw/zinc/83/13/68/583831368.db2.gz BHBLHCMMOMNVGS-UHFFFAOYSA-N 1 2 233.340 2.269 20 0 BEADLO CSC1(c2noc([C@H](C)[NH+](C)C)n2)CC1 ZINC000896780891 583832692 /nfs/dbraw/zinc/83/26/92/583832692.db2.gz HNEAWSIRQCAWEQ-ZETCQYMHSA-N 1 2 227.333 2.044 20 0 BEADLO CSC1(c2noc(C[N@H+](C)C(C)C)n2)CC1 ZINC000896788314 583833669 /nfs/dbraw/zinc/83/36/69/583833669.db2.gz VQEFZQPYEMWJPS-UHFFFAOYSA-N 1 2 241.360 2.262 20 0 BEADLO CSC1(c2noc(C[N@@H+](C)C(C)C)n2)CC1 ZINC000896788314 583833673 /nfs/dbraw/zinc/83/36/73/583833673.db2.gz VQEFZQPYEMWJPS-UHFFFAOYSA-N 1 2 241.360 2.262 20 0 BEADLO Cc1nc(NCC[C@@H]2CCCC[C@@H]2O)cc[nH+]1 ZINC000896816002 583835977 /nfs/dbraw/zinc/83/59/77/583835977.db2.gz MOGQWIJTZFIVRX-RYUDHWBXSA-N 1 2 235.331 2.138 20 0 BEADLO CCn1ccnc1[C@H](C)[NH2+]Cc1ccnc(F)c1 ZINC000858172035 588936518 /nfs/dbraw/zinc/93/65/18/588936518.db2.gz HKNUFRKLNVCGCX-JTQLQIEISA-N 1 2 248.305 2.288 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@H]2CCC(C)(C)C2)[nH+]c1C ZINC000896913414 583853857 /nfs/dbraw/zinc/85/38/57/583853857.db2.gz SUGYQTVLMYXCID-NSHDSACASA-N 1 2 249.358 2.469 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@H]2[C@@H]3CCCC[C@@H]32)[nH+]c1C ZINC000896915342 583854444 /nfs/dbraw/zinc/85/44/44/583854444.db2.gz JOGMDWZWGGRNNO-PJXYFTJBSA-N 1 2 247.342 2.079 20 0 BEADLO Cc1[nH]c(CNC(=O)/C=C2/CC[C@@H](C)C2)[nH+]c1C ZINC000896916365 583854879 /nfs/dbraw/zinc/85/48/79/583854879.db2.gz DEWCTYRHERZCCG-JBBGTMGVSA-N 1 2 247.342 2.389 20 0 BEADLO Cc1[nH]c(CNC(=O)C=C2CC[C@@H](C)C2)[nH+]c1C ZINC000896916365 583854881 /nfs/dbraw/zinc/85/48/81/583854881.db2.gz DEWCTYRHERZCCG-JBBGTMGVSA-N 1 2 247.342 2.389 20 0 BEADLO Cc1[nH]c(CNC(=O)C[C@@H]2CC[C@H](C)C2)[nH+]c1C ZINC000896917184 583855461 /nfs/dbraw/zinc/85/54/61/583855461.db2.gz QXTBMVXERSSLLB-JOYOIKCWSA-N 1 2 249.358 2.469 20 0 BEADLO Cc1[nH]c(CNC(=O)CCC(C)(C)C)[nH+]c1C ZINC000896919637 583855844 /nfs/dbraw/zinc/85/58/44/583855844.db2.gz VWSYCMSIQGTGFW-UHFFFAOYSA-N 1 2 237.347 2.469 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H]2CCC[C@H](C)C2)[nH+]c1C ZINC000896918704 583856114 /nfs/dbraw/zinc/85/61/14/583856114.db2.gz FJSVYOFZJNHDHN-JOYOIKCWSA-N 1 2 249.358 2.469 20 0 BEADLO CC[C@@H](C)Cc1noc(C2([NH+](C)C)CC2)n1 ZINC000896948747 583863615 /nfs/dbraw/zinc/86/36/15/583863615.db2.gz LGWRWLSBCGAEDP-SECBINFHSA-N 1 2 223.320 2.209 20 0 BEADLO CCCCc1cc(NC2CC(CCO)C2)nc[nH+]1 ZINC000897236428 583900122 /nfs/dbraw/zinc/90/01/22/583900122.db2.gz JHISRWJEWNRKDG-UHFFFAOYSA-N 1 2 249.358 2.392 20 0 BEADLO Fc1c[nH+]ccc1N[C@H]1CCOC12CCCC2 ZINC000897322943 583922465 /nfs/dbraw/zinc/92/24/65/583922465.db2.gz SVZRCXMZISELIT-LBPRGKRZSA-N 1 2 236.290 2.156 20 0 BEADLO CCn1c[nH+]c2c1CCN(Cc1ccoc1)C2 ZINC000897336509 583925198 /nfs/dbraw/zinc/92/51/98/583925198.db2.gz HQUMNKIBWZFYMK-UHFFFAOYSA-N 1 2 231.299 2.054 20 0 BEADLO O=C(CCn1cc[nH+]c1)OCc1ccccc1 ZINC000006650405 583966608 /nfs/dbraw/zinc/96/66/08/583966608.db2.gz WJAXPBMVGNQJLY-UHFFFAOYSA-N 1 2 230.267 2.017 20 0 BEADLO C[C@]12CSC[C@H]1CN(c1cccc[nH+]1)C2 ZINC000897497955 583997200 /nfs/dbraw/zinc/99/72/00/583997200.db2.gz GEVCASXGFVDAPX-PWSUYJOCSA-N 1 2 220.341 2.271 20 0 BEADLO C[C@H](O)c1cccc(N2CC3CC2(C)C3)[nH+]1 ZINC000864093104 584001487 /nfs/dbraw/zinc/00/14/87/584001487.db2.gz GQCTZKOTNRSHIX-JBLZRFIASA-N 1 2 218.300 2.124 20 0 BEADLO CC[C@H](NC(=O)C=C1CCC1)c1[nH]cc[nH+]1 ZINC000785420952 584007179 /nfs/dbraw/zinc/00/71/79/584007179.db2.gz HGKDTSPTIVOWNY-JTQLQIEISA-N 1 2 219.288 2.087 20 0 BEADLO COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccon1)CC2 ZINC000148752506 584040893 /nfs/dbraw/zinc/04/08/93/584040893.db2.gz LAKXLASPNKLFPA-AWEZNQCLSA-N 1 2 244.294 2.460 20 0 BEADLO CC(C)c1c[nH+]cc(N[C@@H](C)CCO)c1 ZINC000897706640 584041623 /nfs/dbraw/zinc/04/16/23/584041623.db2.gz QLYWAGQUZIWSHN-JTQLQIEISA-N 1 2 208.305 2.388 20 0 BEADLO CC(C)c1c[nH+]cc(NC2CCN(C=O)CC2)c1 ZINC000897707557 584042287 /nfs/dbraw/zinc/04/22/87/584042287.db2.gz RVQUOYATEXRLNA-UHFFFAOYSA-N 1 2 247.342 2.238 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N[C@@H]2CCC2(C)C)c[nH+]1 ZINC000897758176 584044357 /nfs/dbraw/zinc/04/43/57/584044357.db2.gz KFPBYYDWDKUINX-LLVKDONJSA-N 1 2 249.358 2.231 20 0 BEADLO Cc1[nH]c(CN2CC(Cc3ccoc3)C2)[nH+]c1C ZINC000898160216 584087857 /nfs/dbraw/zinc/08/78/57/584087857.db2.gz VXJHYJXDBASSDP-UHFFFAOYSA-N 1 2 245.326 2.294 20 0 BEADLO O[C@@H]1CC[N@H+](Cc2ccc3occc3c2)C[C@@H]1F ZINC000898187554 584094409 /nfs/dbraw/zinc/09/44/09/584094409.db2.gz GVQBUEOSCKIMSQ-QWHCGFSZSA-N 1 2 249.285 2.338 20 0 BEADLO O[C@@H]1CC[N@@H+](Cc2ccc3occc3c2)C[C@@H]1F ZINC000898187554 584094411 /nfs/dbraw/zinc/09/44/11/584094411.db2.gz GVQBUEOSCKIMSQ-QWHCGFSZSA-N 1 2 249.285 2.338 20 0 BEADLO COc1ccc([NH2+]C[C@@H]2C[C@@H]2C)cc1NC(N)=O ZINC000787317111 584118343 /nfs/dbraw/zinc/11/83/43/584118343.db2.gz YLLKJSGCWNVIDY-IUCAKERBSA-N 1 2 249.314 2.254 20 0 BEADLO C[C@H](c1ccncc1)[N@@H+]1CCO[C@@H](C(F)F)C1 ZINC000801567070 584128292 /nfs/dbraw/zinc/12/82/92/584128292.db2.gz HLUIGYAHWUWTJT-MWLCHTKSSA-N 1 2 242.269 2.109 20 0 BEADLO C[C@H](c1ccncc1)[N@H+]1CCO[C@@H](C(F)F)C1 ZINC000801567070 584128293 /nfs/dbraw/zinc/12/82/93/584128293.db2.gz HLUIGYAHWUWTJT-MWLCHTKSSA-N 1 2 242.269 2.109 20 0 BEADLO OC[C@@]12C[C@@H]1CN(c1[nH+]ccc3ccccc31)C2 ZINC000858505037 588961064 /nfs/dbraw/zinc/96/10/64/588961064.db2.gz DNIVDAYMOZBCNI-DOMZBBRYSA-N 1 2 240.306 2.053 20 0 BEADLO CC(C)(C)[C@@H]1C[C@H]1C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000898811394 584160055 /nfs/dbraw/zinc/16/00/55/584160055.db2.gz SRIMOTFNBHCXIF-MXWKQRLJSA-N 1 2 247.342 2.126 20 0 BEADLO CC(C)(CNC(=O)[C@H]1CC=CCC1)n1cc[nH+]c1 ZINC000898893712 584164967 /nfs/dbraw/zinc/16/49/67/584164967.db2.gz QEAKCNNFGOZWOL-LBPRGKRZSA-N 1 2 247.342 2.091 20 0 BEADLO Cc1cn(C(C)(C)C(=O)NC[C@H]2C=CCC2)c[nH+]1 ZINC000899200083 584180827 /nfs/dbraw/zinc/18/08/27/584180827.db2.gz MSHRMQXYFIBZAW-LBPRGKRZSA-N 1 2 247.342 2.009 20 0 BEADLO CCn1c[nH+]c(/C=C(/C)c2cnccn2)c1 ZINC000899366103 584207493 /nfs/dbraw/zinc/20/74/93/584207493.db2.gz IISYGJHFOPTSAO-POHAHGRESA-N 1 2 214.272 2.254 20 0 BEADLO C[C@H]1CCCC[C@H]1NC(=O)CNc1cccc[nH+]1 ZINC000899937330 584258555 /nfs/dbraw/zinc/25/85/55/584258555.db2.gz OVHQEDMSSSTGQZ-NWDGAFQWSA-N 1 2 247.342 2.188 20 0 BEADLO C[C@@H]1CCCC[C@H]1NC(=O)CNc1cccc[nH+]1 ZINC000899937332 584258615 /nfs/dbraw/zinc/25/86/15/584258615.db2.gz OVHQEDMSSSTGQZ-VXGBXAGGSA-N 1 2 247.342 2.188 20 0 BEADLO CCC[C@H](CC)C(=O)OCCc1c[nH+]cn1C ZINC000873422426 584267756 /nfs/dbraw/zinc/26/77/56/584267756.db2.gz YKZRQCDJUNHRCA-NSHDSACASA-N 1 2 238.331 2.332 20 0 BEADLO CC(C)(C)CC(C)(C)NC(=O)Cc1c[nH]c[nH+]1 ZINC000900093419 584272719 /nfs/dbraw/zinc/27/27/19/584272719.db2.gz YHPJXRQKZNCRET-UHFFFAOYSA-N 1 2 237.347 2.283 20 0 BEADLO CC(C)(C)CC(C)(C)NC(=O)Cc1c[nH+]c[nH]1 ZINC000900093419 584272721 /nfs/dbraw/zinc/27/27/21/584272721.db2.gz YHPJXRQKZNCRET-UHFFFAOYSA-N 1 2 237.347 2.283 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)NCCC1CCCCC1 ZINC000900162969 584281164 /nfs/dbraw/zinc/28/11/64/584281164.db2.gz FZVWKMMUNUSFNI-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)NCCC1CCCCC1 ZINC000900162969 584281165 /nfs/dbraw/zinc/28/11/65/584281165.db2.gz FZVWKMMUNUSFNI-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO CCC1CCC(CNC(=O)Cc2c[nH]c[nH+]2)CC1 ZINC000900308204 584293554 /nfs/dbraw/zinc/29/35/54/584293554.db2.gz ZXDRQPOARXZYEV-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO CCC1CCC(CNC(=O)Cc2c[nH+]c[nH]2)CC1 ZINC000900308204 584293556 /nfs/dbraw/zinc/29/35/56/584293556.db2.gz ZXDRQPOARXZYEV-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)N1CCC[C@@H]1C1CCCC1 ZINC000900312249 584293913 /nfs/dbraw/zinc/29/39/13/584293913.db2.gz ASTCMZSXNPSKOJ-CYBMUJFWSA-N 1 2 247.342 2.133 20 0 BEADLO CCC[C@@H]1CCCC[C@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000900555860 584323078 /nfs/dbraw/zinc/32/30/78/584323078.db2.gz GYHOBPQIFRKPSX-DGCLKSJQSA-N 1 2 249.358 2.427 20 0 BEADLO CCC[C@@H]1CCCC[C@H]1NC(=O)Cc1c[nH+]c[nH]1 ZINC000900555860 584323079 /nfs/dbraw/zinc/32/30/79/584323079.db2.gz GYHOBPQIFRKPSX-DGCLKSJQSA-N 1 2 249.358 2.427 20 0 BEADLO CCCCN(C(=O)Cc1c[nH+]c[nH]1)[C@H](C)CC ZINC000900631504 584334334 /nfs/dbraw/zinc/33/43/34/584334334.db2.gz MBPUDFIECIBZSN-LLVKDONJSA-N 1 2 237.347 2.379 20 0 BEADLO C[C@H]1CCC[C@H](CCNC(=O)Cc2c[nH]c[nH+]2)C1 ZINC000900733159 584346893 /nfs/dbraw/zinc/34/68/93/584346893.db2.gz ZCRWBOPIZFXDFF-NWDGAFQWSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H]1CCC[C@H](CCNC(=O)Cc2c[nH+]c[nH]2)C1 ZINC000900733159 584346896 /nfs/dbraw/zinc/34/68/96/584346896.db2.gz ZCRWBOPIZFXDFF-NWDGAFQWSA-N 1 2 249.358 2.285 20 0 BEADLO CC(C)(NC(=O)Cc1c[nH]c[nH+]1)c1cccs1 ZINC000900742164 584348351 /nfs/dbraw/zinc/34/83/51/584348351.db2.gz QVOZVOCEOXLQMO-UHFFFAOYSA-N 1 2 249.339 2.065 20 0 BEADLO CC(C)(NC(=O)Cc1c[nH+]c[nH]1)c1cccs1 ZINC000900742164 584348353 /nfs/dbraw/zinc/34/83/53/584348353.db2.gz QVOZVOCEOXLQMO-UHFFFAOYSA-N 1 2 249.339 2.065 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)N1CCC2(CCCC2)CC1 ZINC000900785174 584351727 /nfs/dbraw/zinc/35/17/27/584351727.db2.gz YDUYQOBWUSJTDS-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO CC[C@@H]1CCC[C@@H](NC(=O)Cc2c[nH]c[nH+]2)C1 ZINC000900806911 584353567 /nfs/dbraw/zinc/35/35/67/584353567.db2.gz OGYJYAPCUJXFIM-GHMZBOCLSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@@H]1CCC[C@@H](NC(=O)Cc2c[nH+]c[nH]2)C1 ZINC000900806911 584353570 /nfs/dbraw/zinc/35/35/70/584353570.db2.gz OGYJYAPCUJXFIM-GHMZBOCLSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@H]1CCC[C@@H](NC(=O)Cc2c[nH]c[nH+]2)C1 ZINC000900806922 584353707 /nfs/dbraw/zinc/35/37/07/584353707.db2.gz OGYJYAPCUJXFIM-WDEREUQCSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@H]1CCC[C@@H](NC(=O)Cc2c[nH+]c[nH]2)C1 ZINC000900806922 584353708 /nfs/dbraw/zinc/35/37/08/584353708.db2.gz OGYJYAPCUJXFIM-WDEREUQCSA-N 1 2 235.331 2.037 20 0 BEADLO CC(C)c1nc(NCc2ccc[nH]c2=O)cc[nH+]1 ZINC000858822619 588977686 /nfs/dbraw/zinc/97/76/86/588977686.db2.gz HUTPPLIVBHBFIB-UHFFFAOYSA-N 1 2 244.298 2.313 20 0 BEADLO CO[C@H]1C[C@H](Nc2cc[nH+]c(C(C)C)n2)C1 ZINC000858837965 588977991 /nfs/dbraw/zinc/97/79/91/588977991.db2.gz WXZBZYWZMVDCKB-MGCOHNPYSA-N 1 2 221.304 2.189 20 0 BEADLO CCCC1(CNC(=O)CNc2cccc[nH+]2)CC1 ZINC000901047267 584378671 /nfs/dbraw/zinc/37/86/71/584378671.db2.gz AJPZTVLLCNGTLX-UHFFFAOYSA-N 1 2 247.342 2.190 20 0 BEADLO CC(C)C[C@H](C)NC(=O)CNc1cccc[nH+]1 ZINC000901180901 584392043 /nfs/dbraw/zinc/39/20/43/584392043.db2.gz XVVREIDJZLTJKC-NSHDSACASA-N 1 2 235.331 2.044 20 0 BEADLO CNc1[nH+]c(C)ccc1C(=O)N1CC[C@@H]1C(C)C ZINC000901329156 584423765 /nfs/dbraw/zinc/42/37/65/584423765.db2.gz BXKIDGBDTYWCBO-GFCCVEGCSA-N 1 2 247.342 2.302 20 0 BEADLO CC(C)c1c[nH]c(C=Cc2cnccn2)[nH+]1 ZINC000901462481 584451112 /nfs/dbraw/zinc/45/11/12/584451112.db2.gz VTDVJNNRIUWNBD-ARJAWSKDSA-N 1 2 214.272 2.494 20 0 BEADLO CCCc1nnc(NCc2[nH+]ccn2C2CC2)o1 ZINC000902043054 584515583 /nfs/dbraw/zinc/51/55/83/584515583.db2.gz DTJTZPAARZTYBM-UHFFFAOYSA-N 1 2 247.302 2.166 20 0 BEADLO CNc1ccccc1C[NH2+]Cc1cn[nH]c1C ZINC000902064557 584522479 /nfs/dbraw/zinc/52/24/79/584522479.db2.gz VGDWIPJNNUYVCW-UHFFFAOYSA-N 1 2 230.315 2.050 20 0 BEADLO Fc1c[nH+]ccc1NCc1ccnn1C1CCC1 ZINC000902067317 584522870 /nfs/dbraw/zinc/52/28/70/584522870.db2.gz WVRAXMPLGSXTRM-UHFFFAOYSA-N 1 2 246.289 2.176 20 0 BEADLO CNc1ccccc1C[NH2+]Cc1cc(C)on1 ZINC000902104276 584523665 /nfs/dbraw/zinc/52/36/65/584523665.db2.gz OANHVUXJRJHTNB-UHFFFAOYSA-N 1 2 231.299 2.315 20 0 BEADLO CCn1c[nH+]cc1CNc1cnc(C2CC2)nc1 ZINC000902090125 584524610 /nfs/dbraw/zinc/52/46/10/584524610.db2.gz KHMUZHJNIVXHPV-UHFFFAOYSA-N 1 2 243.314 2.183 20 0 BEADLO Cc1nc(NCc2nccn2C(C)C)cc[nH+]1 ZINC000902124764 584529047 /nfs/dbraw/zinc/52/90/47/584529047.db2.gz KKDUYEQWJZLARL-UHFFFAOYSA-N 1 2 231.303 2.175 20 0 BEADLO Cc1nc(NCc2ccc(F)nc2C)cc[nH+]1 ZINC000902124781 584529128 /nfs/dbraw/zinc/52/91/28/584529128.db2.gz KZMSICWAHJJAIM-UHFFFAOYSA-N 1 2 232.262 2.240 20 0 BEADLO Cc1nn(C(C)C)cc1CNc1cc[nH+]c(C)n1 ZINC000902125128 584529356 /nfs/dbraw/zinc/52/93/56/584529356.db2.gz NHONTNLCOCGSDB-UHFFFAOYSA-N 1 2 245.330 2.483 20 0 BEADLO Cc1[nH]c(CNc2nccnc2C2CC2)[nH+]c1C ZINC000902167786 584534665 /nfs/dbraw/zinc/53/46/65/584534665.db2.gz XILIWECGIAJLGT-UHFFFAOYSA-N 1 2 243.314 2.306 20 0 BEADLO COCc1ccc(CNc2cc(C)[nH+]cn2)o1 ZINC000902197250 584536634 /nfs/dbraw/zinc/53/66/34/584536634.db2.gz ZQQXDSZSAQYUQY-UHFFFAOYSA-N 1 2 233.271 2.137 20 0 BEADLO CC(C)OCC(N)=[NH+]OC1CC2(CCC2)C1 ZINC000902221897 584540670 /nfs/dbraw/zinc/54/06/70/584540670.db2.gz VCMQZPFYXQZFQU-UHFFFAOYSA-N 1 2 226.320 2.243 20 0 BEADLO Cc1cc(C)n(Cc2ccc(N(C)C)[nH+]c2)n1 ZINC000902257752 584544676 /nfs/dbraw/zinc/54/46/76/584544676.db2.gz VWEZGJCRKZHOCH-UHFFFAOYSA-N 1 2 230.315 2.009 20 0 BEADLO CCn1c[nH+]c(CNc2ccccc2CO)c1 ZINC000902344971 584558021 /nfs/dbraw/zinc/55/80/21/584558021.db2.gz HKYLKYYPVPSSQL-UHFFFAOYSA-N 1 2 231.299 2.007 20 0 BEADLO Cc1cccc(OCc2ccc(N(C)C)[nH+]c2)n1 ZINC000902326879 584561215 /nfs/dbraw/zinc/56/12/15/584561215.db2.gz ZEMDWGMBKAGRIM-UHFFFAOYSA-N 1 2 243.310 2.430 20 0 BEADLO CCc1[nH+]c(C)ccc1OCc1cnns1 ZINC000902355869 584570020 /nfs/dbraw/zinc/57/00/20/584570020.db2.gz UYKVSHHONBWWLF-UHFFFAOYSA-N 1 2 235.312 2.383 20 0 BEADLO CC(F)(F)CCCO[NH+]=C(N)[C@@H]1CCCO1 ZINC000902383984 584577195 /nfs/dbraw/zinc/57/71/95/584577195.db2.gz WXXSWSADXLGWJQ-QMMMGPOBSA-N 1 2 236.262 2.099 20 0 BEADLO CNc1ccc(C)cc1C[NH2+]CC(F)F ZINC000902559484 584634573 /nfs/dbraw/zinc/63/45/73/584634573.db2.gz PKNFYYASHPPYRA-UHFFFAOYSA-N 1 2 214.259 2.391 20 0 BEADLO CCCc1ncc(C[NH2+]Cc2cn(CC)cn2)o1 ZINC000902585870 584639764 /nfs/dbraw/zinc/63/97/64/584639764.db2.gz SOWQHRDTRFMKGR-UHFFFAOYSA-N 1 2 248.330 2.133 20 0 BEADLO CCCc1ncc(CNCc2cn(CC)c[nH+]2)o1 ZINC000902585870 584639765 /nfs/dbraw/zinc/63/97/65/584639765.db2.gz SOWQHRDTRFMKGR-UHFFFAOYSA-N 1 2 248.330 2.133 20 0 BEADLO CC(C)O[NH+]=C(N)Cc1ccccc1F ZINC000902622571 584645361 /nfs/dbraw/zinc/64/53/61/584645361.db2.gz GOWMLBONMJQKBL-UHFFFAOYSA-N 1 2 210.252 2.275 20 0 BEADLO C[C@H](O)CCOc1ccc2c[nH+]ccc2c1 ZINC000902637030 584647997 /nfs/dbraw/zinc/64/79/97/584647997.db2.gz GMXAZUSHUVRIAG-JTQLQIEISA-N 1 2 217.268 2.385 20 0 BEADLO CCCNC(=O)COc1ccc2c[nH+]ccc2c1 ZINC000902636298 584648599 /nfs/dbraw/zinc/64/85/99/584648599.db2.gz BKDPSHDMJKHSCW-UHFFFAOYSA-N 1 2 244.294 2.140 20 0 BEADLO CCNc1ccccc1C[NH2+]Cc1nonc1C ZINC000902640638 584649628 /nfs/dbraw/zinc/64/96/28/584649628.db2.gz HEOCGQSVIPCGGF-UHFFFAOYSA-N 1 2 246.314 2.100 20 0 BEADLO CC[C@@H]1c2ccccc2C[N@H+]1CN1CCC1=O ZINC000902669819 584654501 /nfs/dbraw/zinc/65/45/01/584654501.db2.gz KWDQAQJEOCNRIN-CYBMUJFWSA-N 1 2 230.311 2.143 20 0 BEADLO CC[C@@H]1c2ccccc2C[N@@H+]1CN1CCC1=O ZINC000902669819 584654503 /nfs/dbraw/zinc/65/45/03/584654503.db2.gz KWDQAQJEOCNRIN-CYBMUJFWSA-N 1 2 230.311 2.143 20 0 BEADLO CC[C@H](COc1ccc2c(c1)[nH+]cn2C)OC ZINC000902781070 584670311 /nfs/dbraw/zinc/67/03/11/584670311.db2.gz DFNZCWNPQTUBBD-SNVBAGLBSA-N 1 2 234.299 2.377 20 0 BEADLO CCC(CC)NC(=O)[C@@H](C)[N@@H+]1CCC[C@@H](F)C1 ZINC000903001360 584715387 /nfs/dbraw/zinc/71/53/87/584715387.db2.gz NMKYFCYUALRJAJ-GHMZBOCLSA-N 1 2 244.354 2.114 20 0 BEADLO CCC(CC)NC(=O)[C@@H](C)[N@H+]1CCC[C@@H](F)C1 ZINC000903001360 584715388 /nfs/dbraw/zinc/71/53/88/584715388.db2.gz NMKYFCYUALRJAJ-GHMZBOCLSA-N 1 2 244.354 2.114 20 0 BEADLO CCC(CC)NC(=O)[C@@H](C)[N@@H+]1CCC[C@H](F)C1 ZINC000903001361 584715614 /nfs/dbraw/zinc/71/56/14/584715614.db2.gz NMKYFCYUALRJAJ-MNOVXSKESA-N 1 2 244.354 2.114 20 0 BEADLO CCC(CC)NC(=O)[C@@H](C)[N@H+]1CCC[C@H](F)C1 ZINC000903001361 584715615 /nfs/dbraw/zinc/71/56/15/584715615.db2.gz NMKYFCYUALRJAJ-MNOVXSKESA-N 1 2 244.354 2.114 20 0 BEADLO CCC[C@H](C)NC(=O)[C@@H](C)[N@@H+]1CCC[C@@H](F)C1 ZINC000903002184 584715887 /nfs/dbraw/zinc/71/58/87/584715887.db2.gz XLQVWWRJZVADSR-QJPTWQEYSA-N 1 2 244.354 2.114 20 0 BEADLO CCC[C@H](C)NC(=O)[C@@H](C)[N@H+]1CCC[C@@H](F)C1 ZINC000903002184 584715888 /nfs/dbraw/zinc/71/58/88/584715888.db2.gz XLQVWWRJZVADSR-QJPTWQEYSA-N 1 2 244.354 2.114 20 0 BEADLO CCC[C@H](C)NC(=O)[C@H](C)[N@@H+]1CCC[C@H](F)C1 ZINC000903002186 584716086 /nfs/dbraw/zinc/71/60/86/584716086.db2.gz XLQVWWRJZVADSR-SRVKXCTJSA-N 1 2 244.354 2.114 20 0 BEADLO CCC[C@H](C)NC(=O)[C@H](C)[N@H+]1CCC[C@H](F)C1 ZINC000903002186 584716087 /nfs/dbraw/zinc/71/60/87/584716087.db2.gz XLQVWWRJZVADSR-SRVKXCTJSA-N 1 2 244.354 2.114 20 0 BEADLO CC(C)N(C(=O)C[N@@H+]1CCC[C@H](F)C1)C(C)C ZINC000903002918 584716168 /nfs/dbraw/zinc/71/61/68/584716168.db2.gz ICBHQSSANONJHS-LBPRGKRZSA-N 1 2 244.354 2.066 20 0 BEADLO CC(C)N(C(=O)C[N@H+]1CCC[C@H](F)C1)C(C)C ZINC000903002918 584716169 /nfs/dbraw/zinc/71/61/69/584716169.db2.gz ICBHQSSANONJHS-LBPRGKRZSA-N 1 2 244.354 2.066 20 0 BEADLO C[C@H]1C[N@H+](C[C@@H]2CC2(Cl)Cl)CCC1=O ZINC000801944660 584726821 /nfs/dbraw/zinc/72/68/21/584726821.db2.gz HBCDLKUVVLYKSA-YUMQZZPRSA-N 1 2 236.142 2.091 20 0 BEADLO C[C@H]1C[N@@H+](C[C@@H]2CC2(Cl)Cl)CCC1=O ZINC000801944660 584726822 /nfs/dbraw/zinc/72/68/22/584726822.db2.gz HBCDLKUVVLYKSA-YUMQZZPRSA-N 1 2 236.142 2.091 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2CCC[C@H]2OC)c1 ZINC000903196139 584734399 /nfs/dbraw/zinc/73/43/99/584734399.db2.gz IGZQYEQPJSSNLQ-VXGBXAGGSA-N 1 2 236.315 2.207 20 0 BEADLO Cc1nonc1[C@@H](C)[NH2+][C@H](C)c1cncs1 ZINC000903309710 584748227 /nfs/dbraw/zinc/74/82/27/584748227.db2.gz HBRAPAPTHFHNDX-RNFRBKRXSA-N 1 2 238.316 2.246 20 0 BEADLO COc1nn(C)cc1C[NH2+][C@H](C)c1ccc(C)o1 ZINC000903336895 584751679 /nfs/dbraw/zinc/75/16/79/584751679.db2.gz RJTIFDGEFLSRAK-SNVBAGLBSA-N 1 2 249.314 2.181 20 0 BEADLO COc1nn(C)cc1C[NH2+][C@@H](C)c1ccc(C)o1 ZINC000903336894 584751794 /nfs/dbraw/zinc/75/17/94/584751794.db2.gz RJTIFDGEFLSRAK-JTQLQIEISA-N 1 2 249.314 2.181 20 0 BEADLO CCn1cc(C[N@H+](C)Cc2ccnc(F)c2)cn1 ZINC000859141279 589008124 /nfs/dbraw/zinc/00/81/24/589008124.db2.gz FODPQVYJUWERFA-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO CCn1cc(C[N@@H+](C)Cc2ccnc(F)c2)cn1 ZINC000859141279 589008125 /nfs/dbraw/zinc/00/81/25/589008125.db2.gz FODPQVYJUWERFA-UHFFFAOYSA-N 1 2 248.305 2.069 20 0 BEADLO CCn1nc(C)c([C@@H](C)[NH2+]C/C=C/Cl)n1 ZINC000903445187 584769657 /nfs/dbraw/zinc/76/96/57/584769657.db2.gz SEMZYBIQPLRLPR-HQZHTGGTSA-N 1 2 228.727 2.010 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+]1CC[C@H]2CC[C@]21C[NH3+] ZINC000903856425 584808770 /nfs/dbraw/zinc/80/87/70/584808770.db2.gz QWYWNCLFZNXYFE-HIFRSBDPSA-N 1 2 248.345 2.447 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1noc(C2(C)CC2)n1 ZINC000904269832 584858394 /nfs/dbraw/zinc/85/83/94/584858394.db2.gz SYDZZKUDAAPXFG-UHFFFAOYSA-N 1 2 230.271 2.074 20 0 BEADLO Cc1[nH+]c(N)ccc1-c1noc([C@@H]2C[C@@H]2C)n1 ZINC000904256565 584859039 /nfs/dbraw/zinc/85/90/39/584859039.db2.gz BWKYNPXARUBABL-IMTBSYHQSA-N 1 2 230.271 2.146 20 0 BEADLO Cc1[nH+]c(N)ccc1-c1noc([C@H]2C[C@@H]2C)n1 ZINC000904256567 584859050 /nfs/dbraw/zinc/85/90/50/584859050.db2.gz BWKYNPXARUBABL-RCOVLWMOSA-N 1 2 230.271 2.146 20 0 BEADLO CCC1(c2nc(-c3ccc(N)[nH+]c3C)no2)CC1 ZINC000904261189 584859482 /nfs/dbraw/zinc/85/94/82/584859482.db2.gz YDVTVKMTMZGSNU-UHFFFAOYSA-N 1 2 244.298 2.464 20 0 BEADLO CCCOC(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000859180923 589014947 /nfs/dbraw/zinc/01/49/47/589014947.db2.gz RPMNNWGWERXWRW-BDAKNGLRSA-N 1 2 223.276 2.025 20 0 BEADLO Cc1ccc(C[N@@H+](C)[C@H]2CCOC2=O)cc1C ZINC000832634903 584911841 /nfs/dbraw/zinc/91/18/41/584911841.db2.gz XGJUHYZDGSVMTL-ZDUSSCGKSA-N 1 2 233.311 2.051 20 0 BEADLO Cc1ccc(C[N@H+](C)[C@H]2CCOC2=O)cc1C ZINC000832634903 584911842 /nfs/dbraw/zinc/91/18/42/584911842.db2.gz XGJUHYZDGSVMTL-ZDUSSCGKSA-N 1 2 233.311 2.051 20 0 BEADLO CCCC(C)=CC(=O)Nc1cc[nH+]cc1C ZINC000730565415 584912726 /nfs/dbraw/zinc/91/27/26/584912726.db2.gz FKIRJLJJBZSFAA-CSKARUKUSA-N 1 2 218.300 2.497 20 0 BEADLO CCc1cc(CNc2cc[nH+]c(C(C)C)n2)[nH]n1 ZINC000732804024 584941310 /nfs/dbraw/zinc/94/13/10/584941310.db2.gz CVRQPOCYOKZKGA-UHFFFAOYSA-N 1 2 245.330 2.498 20 0 BEADLO CC(C)c1cnc(C[N@H+](C)CCn2cccn2)o1 ZINC000733310182 584946681 /nfs/dbraw/zinc/94/66/81/584946681.db2.gz NUUYNKNJSITNMZ-UHFFFAOYSA-N 1 2 248.330 2.127 20 0 BEADLO CC(C)c1cnc(C[N@@H+](C)CCn2cccn2)o1 ZINC000733310182 584946682 /nfs/dbraw/zinc/94/66/82/584946682.db2.gz NUUYNKNJSITNMZ-UHFFFAOYSA-N 1 2 248.330 2.127 20 0 BEADLO CC(C)Cc1noc(CCCn2cc[nH+]c2)n1 ZINC000733735184 584952993 /nfs/dbraw/zinc/95/29/93/584952993.db2.gz HBIINOGQYMSQPQ-UHFFFAOYSA-N 1 2 234.303 2.097 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)Cc1ccnc(Cl)c1 ZINC000733996386 584956079 /nfs/dbraw/zinc/95/60/79/584956079.db2.gz GFGJBWSNONFHHU-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)Cc1ccnc(Cl)c1 ZINC000733996386 584956080 /nfs/dbraw/zinc/95/60/80/584956080.db2.gz GFGJBWSNONFHHU-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2nonc2C)on1 ZINC000734147747 584957360 /nfs/dbraw/zinc/95/73/60/584957360.db2.gz YDBDWVSPFALXAA-LLVKDONJSA-N 1 2 248.286 2.012 20 0 BEADLO Cc1cc([C@H]2CCC[N@H+]2Cc2nonc2C)on1 ZINC000734147747 584957361 /nfs/dbraw/zinc/95/73/61/584957361.db2.gz YDBDWVSPFALXAA-LLVKDONJSA-N 1 2 248.286 2.012 20 0 BEADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1cnn[nH]1 ZINC000734558603 584964322 /nfs/dbraw/zinc/96/43/22/584964322.db2.gz NEHNDWMDUCFBEY-AWEZNQCLSA-N 1 2 242.326 2.314 20 0 BEADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1cnn[nH]1 ZINC000734558603 584964323 /nfs/dbraw/zinc/96/43/23/584964323.db2.gz NEHNDWMDUCFBEY-AWEZNQCLSA-N 1 2 242.326 2.314 20 0 BEADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1c[nH]nn1 ZINC000734558603 584964324 /nfs/dbraw/zinc/96/43/24/584964324.db2.gz NEHNDWMDUCFBEY-AWEZNQCLSA-N 1 2 242.326 2.314 20 0 BEADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1c[nH]nn1 ZINC000734558603 584964325 /nfs/dbraw/zinc/96/43/25/584964325.db2.gz NEHNDWMDUCFBEY-AWEZNQCLSA-N 1 2 242.326 2.314 20 0 BEADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1cn[nH]n1 ZINC000734558603 584964326 /nfs/dbraw/zinc/96/43/26/584964326.db2.gz NEHNDWMDUCFBEY-AWEZNQCLSA-N 1 2 242.326 2.314 20 0 BEADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1cn[nH]n1 ZINC000734558603 584964327 /nfs/dbraw/zinc/96/43/27/584964327.db2.gz NEHNDWMDUCFBEY-AWEZNQCLSA-N 1 2 242.326 2.314 20 0 BEADLO CS[C@@H](C)CCC(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819775444 585006762 /nfs/dbraw/zinc/00/67/62/585006762.db2.gz GIRCJEQAMMJRCT-YUMQZZPRSA-N 1 2 246.401 2.126 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)C[C@H]2CCC[C@H]2C)S1 ZINC000819775813 585006813 /nfs/dbraw/zinc/00/68/13/585006813.db2.gz JNOWCEHMULUONU-OPRDCNLKSA-N 1 2 240.372 2.420 20 0 BEADLO COc1c(C)c[nH+]c(COC(=O)C2CC2)c1C ZINC000736742073 585011333 /nfs/dbraw/zinc/01/13/33/585011333.db2.gz BIYGDVJTMAEHCP-UHFFFAOYSA-N 1 2 235.283 2.160 20 0 BEADLO CC(C)(NC(=O)CCC1(C)CC1)c1[nH]cc[nH+]1 ZINC000821756764 585017236 /nfs/dbraw/zinc/01/72/36/585017236.db2.gz AAXKZXFHPVBAFO-UHFFFAOYSA-N 1 2 235.331 2.341 20 0 BEADLO CCC(CC)C(=O)O[C@@H]1CC[N@H+](CCF)C1 ZINC000788081455 585027548 /nfs/dbraw/zinc/02/75/48/585027548.db2.gz QINNATWQMHSMBS-LLVKDONJSA-N 1 2 231.311 2.010 20 0 BEADLO CCC(CC)C(=O)O[C@@H]1CC[N@@H+](CCF)C1 ZINC000788081455 585027549 /nfs/dbraw/zinc/02/75/49/585027549.db2.gz QINNATWQMHSMBS-LLVKDONJSA-N 1 2 231.311 2.010 20 0 BEADLO C/C=C\C(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000737823770 585038683 /nfs/dbraw/zinc/03/86/83/585038683.db2.gz ZNSBRMUBEBQFJF-XJIUSYNZSA-N 1 2 219.288 2.039 20 0 BEADLO CC[C@H](CC(F)F)C(=O)OCCn1cc[nH+]c1 ZINC000838399029 585056401 /nfs/dbraw/zinc/05/64/01/585056401.db2.gz XAUXECNBGLBBEF-SECBINFHSA-N 1 2 246.257 2.108 20 0 BEADLO CCOC(=O)CC(C)(C)C[N@H+](C)CC(F)F ZINC000838807139 585068807 /nfs/dbraw/zinc/06/88/07/585068807.db2.gz XAIFVAGKVKQJJA-UHFFFAOYSA-N 1 2 237.290 2.163 20 0 BEADLO CCOC(=O)CC(C)(C)C[N@@H+](C)CC(F)F ZINC000838807139 585068808 /nfs/dbraw/zinc/06/88/08/585068808.db2.gz XAIFVAGKVKQJJA-UHFFFAOYSA-N 1 2 237.290 2.163 20 0 BEADLO CCn1ncc(C[N@H+](Cc2ccco2)C(C)C)n1 ZINC000838791101 585070265 /nfs/dbraw/zinc/07/02/65/585070265.db2.gz OGNJNHLTDWEFTN-UHFFFAOYSA-N 1 2 248.330 2.302 20 0 BEADLO CCn1ncc(C[N@@H+](Cc2ccco2)C(C)C)n1 ZINC000838791101 585070266 /nfs/dbraw/zinc/07/02/66/585070266.db2.gz OGNJNHLTDWEFTN-UHFFFAOYSA-N 1 2 248.330 2.302 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1ccc(C)nc1Cl ZINC000839026475 585088232 /nfs/dbraw/zinc/08/82/32/585088232.db2.gz XPQSBHJIVQFBBB-LLVKDONJSA-N 1 2 240.734 2.264 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1ccc(C)nc1Cl ZINC000839026475 585088233 /nfs/dbraw/zinc/08/82/33/585088233.db2.gz XPQSBHJIVQFBBB-LLVKDONJSA-N 1 2 240.734 2.264 20 0 BEADLO CCOCOc1ccc(C[NH2+]CC(F)F)cc1 ZINC000839090483 585090390 /nfs/dbraw/zinc/09/03/90/585090390.db2.gz FHDNESPSYPBSMA-UHFFFAOYSA-N 1 2 245.269 2.414 20 0 BEADLO Fc1ccc(C[NH+]2CC3(CC(F)C3)C2)cn1 ZINC000839140987 585094428 /nfs/dbraw/zinc/09/44/28/585094428.db2.gz WWZHTKQHMWMLTR-UHFFFAOYSA-N 1 2 224.254 2.155 20 0 BEADLO Clc1ncccc1C[N@@H+]1C[C@@H]2C[C@H]1CS2 ZINC000839190827 585097279 /nfs/dbraw/zinc/09/72/79/585097279.db2.gz DMKGRCLUCVHJBR-UWVGGRQHSA-N 1 2 240.759 2.425 20 0 BEADLO Clc1ncccc1C[N@H+]1C[C@@H]2C[C@H]1CS2 ZINC000839190827 585097280 /nfs/dbraw/zinc/09/72/80/585097280.db2.gz DMKGRCLUCVHJBR-UWVGGRQHSA-N 1 2 240.759 2.425 20 0 BEADLO C[C@H](CC(=O)NC[C@H](C)Cn1cc[nH+]c1)C1CC1 ZINC000740727504 585105969 /nfs/dbraw/zinc/10/59/69/585105969.db2.gz RGQHPLBMHSOZLD-NWDGAFQWSA-N 1 2 249.358 2.072 20 0 BEADLO Cc1[nH]nc(NCc2cn(C3CC3)c[nH+]2)c1C ZINC000886198136 585112328 /nfs/dbraw/zinc/11/23/28/585112328.db2.gz ZGEDZHMLPMWQAK-UHFFFAOYSA-N 1 2 231.303 2.170 20 0 BEADLO CCCOC(=O)[C@H](C)[N@@H+]1CCS[C@H](C)[C@@H]1C ZINC000741796480 585119323 /nfs/dbraw/zinc/11/93/23/585119323.db2.gz GARYZDVFRSQOKG-GARJFASQSA-N 1 2 245.388 2.154 20 0 BEADLO CCCOC(=O)[C@H](C)[N@H+]1CCS[C@H](C)[C@@H]1C ZINC000741796480 585119324 /nfs/dbraw/zinc/11/93/24/585119324.db2.gz GARYZDVFRSQOKG-GARJFASQSA-N 1 2 245.388 2.154 20 0 BEADLO Cc1nonc1C[N@H+]1Cc2ccccc2C[C@@H]1C ZINC000741797165 585119467 /nfs/dbraw/zinc/11/94/67/585119467.db2.gz HYUNIUFIPMCWTM-JTQLQIEISA-N 1 2 243.310 2.325 20 0 BEADLO Cc1nonc1C[N@@H+]1Cc2ccccc2C[C@@H]1C ZINC000741797165 585119468 /nfs/dbraw/zinc/11/94/68/585119468.db2.gz HYUNIUFIPMCWTM-JTQLQIEISA-N 1 2 243.310 2.325 20 0 BEADLO C/C(=C\C(=O)N(C)Cc1[nH+]ccn1C)C(C)(C)C ZINC000742631573 585129256 /nfs/dbraw/zinc/12/92/56/585129256.db2.gz ZCTLJODIOFFCAJ-PKNBQFBNSA-N 1 2 249.358 2.371 20 0 BEADLO CCCCCCO[NH+]=C(N)[C@H]1CCCO1 ZINC000789613065 585177362 /nfs/dbraw/zinc/17/73/62/585177362.db2.gz UCSRRKIUMZXHNH-SNVBAGLBSA-N 1 2 214.309 2.244 20 0 BEADLO CCCCCCO[NH+]=C(N)[C@@H]1CCCO1 ZINC000789613051 585177464 /nfs/dbraw/zinc/17/74/64/585177464.db2.gz UCSRRKIUMZXHNH-JTQLQIEISA-N 1 2 214.309 2.244 20 0 BEADLO NC(=[NH+]OCc1cccc(F)c1)[C@@H]1CCCO1 ZINC000789626059 585178240 /nfs/dbraw/zinc/17/82/40/585178240.db2.gz DJAGCVMMUCKJRF-NSHDSACASA-N 1 2 238.262 2.003 20 0 BEADLO C[C@H]1c2ccccc2C[N@H+]1CN1CCOC1=S ZINC000747461606 585179042 /nfs/dbraw/zinc/17/90/42/585179042.db2.gz GIRFNQFOPJDUQP-JTQLQIEISA-N 1 2 248.351 2.138 20 0 BEADLO C[C@H]1c2ccccc2C[N@@H+]1CN1CCOC1=S ZINC000747461606 585179043 /nfs/dbraw/zinc/17/90/43/585179043.db2.gz GIRFNQFOPJDUQP-JTQLQIEISA-N 1 2 248.351 2.138 20 0 BEADLO Cc1ccc([C@H](C)C(=O)OCc2c[nH+]cn2C)o1 ZINC000747780712 585184200 /nfs/dbraw/zinc/18/42/00/585184200.db2.gz HORUKKWYBNXJDY-JTQLQIEISA-N 1 2 248.282 2.168 20 0 BEADLO C[C@H]1CCC[C@@H](C(=O)OCc2c[nH+]cn2C)C1 ZINC000747779912 585184298 /nfs/dbraw/zinc/18/42/98/585184298.db2.gz HGWZOWFTRGCHGS-WDEREUQCSA-N 1 2 236.315 2.290 20 0 BEADLO Cn1c[nH+]cc1COC(=O)/C=C/c1ccsc1 ZINC000747780768 585184313 /nfs/dbraw/zinc/18/43/13/585184313.db2.gz IYMRVFCASYVYGU-NSCUHMNNSA-N 1 2 248.307 2.238 20 0 BEADLO CCOC[C@@H]1CC[N@H+](CC(F)(F)C(F)F)C1 ZINC000747965929 585185818 /nfs/dbraw/zinc/18/58/18/585185818.db2.gz FSPIKOJLFPJSSY-MRVPVSSYSA-N 1 2 243.244 2.245 20 0 BEADLO CCOC[C@@H]1CC[N@@H+](CC(F)(F)C(F)F)C1 ZINC000747965929 585185819 /nfs/dbraw/zinc/18/58/19/585185819.db2.gz FSPIKOJLFPJSSY-MRVPVSSYSA-N 1 2 243.244 2.245 20 0 BEADLO Cc1nonc1CNc1cc[nH+]c(C(C)(C)C)n1 ZINC000749283316 585201022 /nfs/dbraw/zinc/20/10/22/585201022.db2.gz NKLSGZXSCWRPNF-UHFFFAOYSA-N 1 2 247.302 2.078 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2ccsc2)cn1 ZINC000749435521 585202453 /nfs/dbraw/zinc/20/24/53/585202453.db2.gz BJGFLJLTCQSXTE-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2ccsc2)cn1 ZINC000749435521 585202454 /nfs/dbraw/zinc/20/24/54/585202454.db2.gz BJGFLJLTCQSXTE-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cc([C@@H]2CCCN2Cc2[nH+]ccn2C)no1 ZINC000750517930 585216405 /nfs/dbraw/zinc/21/64/05/585216405.db2.gz LBIVQWMICQZAEG-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO Cl/C=C(\Cl)C[N@@H+]1CCc2cn[nH]c2C1 ZINC000750722574 585218643 /nfs/dbraw/zinc/21/86/43/585218643.db2.gz RTKSBFPLVNXYOT-BAQGIRSFSA-N 1 2 232.114 2.087 20 0 BEADLO Cl/C=C(\Cl)C[N@H+]1CCc2cn[nH]c2C1 ZINC000750722574 585218644 /nfs/dbraw/zinc/21/86/44/585218644.db2.gz RTKSBFPLVNXYOT-BAQGIRSFSA-N 1 2 232.114 2.087 20 0 BEADLO CC(C)=C(C)C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000751377167 585228261 /nfs/dbraw/zinc/22/82/61/585228261.db2.gz VBTDHEFCUQKDRW-GFCCVEGCSA-N 1 2 247.342 2.472 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C(C)=C(C)C ZINC000751381792 585228777 /nfs/dbraw/zinc/22/87/77/585228777.db2.gz OSRRBVGCJKNEBV-UHFFFAOYSA-N 1 2 218.300 2.361 20 0 BEADLO CCC/C=C/C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000751426507 585230139 /nfs/dbraw/zinc/23/01/39/585230139.db2.gz ZDLNSOGCBVMIDT-SNAWJCMRSA-N 1 2 247.342 2.472 20 0 BEADLO CCC/C=C/C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000751426507 585230140 /nfs/dbraw/zinc/23/01/40/585230140.db2.gz ZDLNSOGCBVMIDT-SNAWJCMRSA-N 1 2 247.342 2.472 20 0 BEADLO CCC/C=C\C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000751426506 585230276 /nfs/dbraw/zinc/23/02/76/585230276.db2.gz ZDLNSOGCBVMIDT-PLNGDYQASA-N 1 2 247.342 2.472 20 0 BEADLO CCC/C=C\C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000751426506 585230277 /nfs/dbraw/zinc/23/02/77/585230277.db2.gz ZDLNSOGCBVMIDT-PLNGDYQASA-N 1 2 247.342 2.472 20 0 BEADLO CC[C@H](C)COC(=O)CCc1ccc(N)[nH+]c1 ZINC000751439834 585230368 /nfs/dbraw/zinc/23/03/68/585230368.db2.gz OZXPRLBINSFZHD-JTQLQIEISA-N 1 2 236.315 2.186 20 0 BEADLO C[C@@H]1CCC[N@@H+]1Cn1nc2ccccn2c1=S ZINC000751926792 585239254 /nfs/dbraw/zinc/23/92/54/585239254.db2.gz WRQWLVYUEKEWTB-SNVBAGLBSA-N 1 2 248.355 2.307 20 0 BEADLO C[C@@H]1CCC[N@H+]1Cn1nc2ccccn2c1=S ZINC000751926792 585239255 /nfs/dbraw/zinc/23/92/55/585239255.db2.gz WRQWLVYUEKEWTB-SNVBAGLBSA-N 1 2 248.355 2.307 20 0 BEADLO CO[C@@H]1CC[N@H+](Cc2ncc(C(C)C)o2)C1 ZINC000752089674 585242149 /nfs/dbraw/zinc/24/21/49/585242149.db2.gz XKRBKPNLYFGSTG-SNVBAGLBSA-N 1 2 224.304 2.019 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2ncc(C(C)C)o2)C1 ZINC000752089674 585242150 /nfs/dbraw/zinc/24/21/50/585242150.db2.gz XKRBKPNLYFGSTG-SNVBAGLBSA-N 1 2 224.304 2.019 20 0 BEADLO CC1(C)C(NC(=O)CCCn2cc[nH+]c2)C1(C)C ZINC000752396111 585245290 /nfs/dbraw/zinc/24/52/90/585245290.db2.gz WPRQJKDHSOYCOD-UHFFFAOYSA-N 1 2 249.358 2.214 20 0 BEADLO CC1CC(NC(=O)Nc2ccc3[nH+]ccn3c2)C1 ZINC000752690763 585248763 /nfs/dbraw/zinc/24/87/63/585248763.db2.gz DNMQOORVDIIJFA-UHFFFAOYSA-N 1 2 244.298 2.254 20 0 BEADLO Cn1c[nH+]cc1CSc1nccn1C1CC1 ZINC000753062209 585252651 /nfs/dbraw/zinc/25/26/51/585252651.db2.gz URZWAOFYZXZMCK-UHFFFAOYSA-N 1 2 234.328 2.244 20 0 BEADLO CC(C)c1cnc(C[N@@H+]2CCOC[C@H](C)C2)o1 ZINC000754386362 585283946 /nfs/dbraw/zinc/28/39/46/585283946.db2.gz WEORJYLQIOMAOB-LLVKDONJSA-N 1 2 238.331 2.266 20 0 BEADLO CC(C)c1cnc(C[N@H+]2CCOC[C@H](C)C2)o1 ZINC000754386362 585283947 /nfs/dbraw/zinc/28/39/47/585283947.db2.gz WEORJYLQIOMAOB-LLVKDONJSA-N 1 2 238.331 2.266 20 0 BEADLO FCC[N@@H+]1CCO[C@H](CCc2ccccc2)C1 ZINC000755261037 585296813 /nfs/dbraw/zinc/29/68/13/585296813.db2.gz IDPJYVWDHPADQB-CQSZACIVSA-N 1 2 237.318 2.290 20 0 BEADLO FCC[N@H+]1CCO[C@H](CCc2ccccc2)C1 ZINC000755261037 585296814 /nfs/dbraw/zinc/29/68/14/585296814.db2.gz IDPJYVWDHPADQB-CQSZACIVSA-N 1 2 237.318 2.290 20 0 BEADLO O=C(C=C1CCC1)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000755322962 585297555 /nfs/dbraw/zinc/29/75/55/585297555.db2.gz XMDMIZGZANMOEW-CYBMUJFWSA-N 1 2 245.326 2.157 20 0 BEADLO O=C(C=C1CCC1)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000755322965 585297654 /nfs/dbraw/zinc/29/76/54/585297654.db2.gz XMDMIZGZANMOEW-ZDUSSCGKSA-N 1 2 245.326 2.157 20 0 BEADLO C/C=C(\C)C(=O)OCc1cc[nH+]c(N(C)C)c1 ZINC000755895652 585309470 /nfs/dbraw/zinc/30/94/70/585309470.db2.gz YHQRTCNGDOLBEU-BJMVGYQFSA-N 1 2 234.299 2.157 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CC[C@@H](C(F)(F)F)C2)[nH]1 ZINC000839534489 585329376 /nfs/dbraw/zinc/32/93/76/585329376.db2.gz STILTFHCQAWSGC-POYBYMJQSA-N 1 2 248.252 2.058 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CC[C@@H](C(F)(F)F)C2)[nH]1 ZINC000839534489 585329377 /nfs/dbraw/zinc/32/93/77/585329377.db2.gz STILTFHCQAWSGC-POYBYMJQSA-N 1 2 248.252 2.058 20 0 BEADLO O=C1C[C@@]2(CC[N@@H+](CCF)C2)Oc2ccccc21 ZINC000839642193 585334995 /nfs/dbraw/zinc/33/49/95/585334995.db2.gz FKTPLKHEIABDHJ-CQSZACIVSA-N 1 2 249.285 2.066 20 0 BEADLO O=C1C[C@@]2(CC[N@H+](CCF)C2)Oc2ccccc21 ZINC000839642193 585334996 /nfs/dbraw/zinc/33/49/96/585334996.db2.gz FKTPLKHEIABDHJ-CQSZACIVSA-N 1 2 249.285 2.066 20 0 BEADLO Cc1ccc2[nH+]c(COC(=O)[C@H]3C[C@H]3C)cn2c1 ZINC000758031819 585348433 /nfs/dbraw/zinc/34/84/33/585348433.db2.gz ZQQLSZYXRZICGA-PWSUYJOCSA-N 1 2 244.294 2.342 20 0 BEADLO CCN(C)c1ccccc1C[NH2+]Cc1cocn1 ZINC000758345303 585354455 /nfs/dbraw/zinc/35/44/55/585354455.db2.gz YVCXFWUMZFNJAL-UHFFFAOYSA-N 1 2 245.326 2.421 20 0 BEADLO C[C@@H](c1ccc([S@@](C)=O)cc1)[N@H+](C)CCF ZINC000759345652 585370017 /nfs/dbraw/zinc/37/00/17/585370017.db2.gz JYGRNOAFXMZFPE-MGPLVRAMSA-N 1 2 243.347 2.386 20 0 BEADLO C[C@@H](c1ccc([S@@](C)=O)cc1)[N@@H+](C)CCF ZINC000759345652 585370018 /nfs/dbraw/zinc/37/00/18/585370018.db2.gz JYGRNOAFXMZFPE-MGPLVRAMSA-N 1 2 243.347 2.386 20 0 BEADLO C[C@@H]1C[N@H+](CCF)[C@@H](c2ccccc2)CO1 ZINC000759347595 585370742 /nfs/dbraw/zinc/37/07/42/585370742.db2.gz REKRESIGWJJLKV-DGCLKSJQSA-N 1 2 223.291 2.418 20 0 BEADLO C[C@@H]1C[N@@H+](CCF)[C@@H](c2ccccc2)CO1 ZINC000759347595 585370743 /nfs/dbraw/zinc/37/07/43/585370743.db2.gz REKRESIGWJJLKV-DGCLKSJQSA-N 1 2 223.291 2.418 20 0 BEADLO CCC[C@H]([NH2+][C@H](C)c1ccc[nH]1)C(=O)OCC ZINC000760249070 585387397 /nfs/dbraw/zinc/38/73/97/585387397.db2.gz KYJSXITTXOGXGX-PWSUYJOCSA-N 1 2 238.331 2.397 20 0 BEADLO CC(C)CC1CCN(C(=O)Cn2cc[nH+]c2)CC1 ZINC000760939158 585402313 /nfs/dbraw/zinc/40/23/13/585402313.db2.gz DDFFHEGNGZSKLY-UHFFFAOYSA-N 1 2 249.358 2.168 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CC[C@H](C(F)(F)F)C2)o1 ZINC000761053944 585404559 /nfs/dbraw/zinc/40/45/59/585404559.db2.gz IFJVCAOXTJXZRD-SVRRBLITSA-N 1 2 249.236 2.323 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CC[C@H](C(F)(F)F)C2)o1 ZINC000761053944 585404560 /nfs/dbraw/zinc/40/45/60/585404560.db2.gz IFJVCAOXTJXZRD-SVRRBLITSA-N 1 2 249.236 2.323 20 0 BEADLO COC(=O)[C@H](c1ccccc1F)[N@@H+]1CC[C@H]2C[C@H]21 ZINC000761098337 585408721 /nfs/dbraw/zinc/40/87/21/585408721.db2.gz UUXWTGMTNCRNCK-BIMULSAOSA-N 1 2 249.285 2.134 20 0 BEADLO COC(=O)[C@H](c1ccccc1F)[N@H+]1CC[C@H]2C[C@H]21 ZINC000761098337 585408722 /nfs/dbraw/zinc/40/87/22/585408722.db2.gz UUXWTGMTNCRNCK-BIMULSAOSA-N 1 2 249.285 2.134 20 0 BEADLO CO[C@H](C)c1nc(C[N@@H+]2CC[C@@H]3C[C@@H]32)cs1 ZINC000761102377 585409493 /nfs/dbraw/zinc/40/94/93/585409493.db2.gz YSDIUWNGDJDIQE-KKZNHRDASA-N 1 2 238.356 2.445 20 0 BEADLO CO[C@H](C)c1nc(C[N@H+]2CC[C@@H]3C[C@@H]32)cs1 ZINC000761102377 585409494 /nfs/dbraw/zinc/40/94/94/585409494.db2.gz YSDIUWNGDJDIQE-KKZNHRDASA-N 1 2 238.356 2.445 20 0 BEADLO Fc1cc(CN2CCC[C@@H]2c2[nH]cc[nH+]2)ccn1 ZINC000859223033 589021811 /nfs/dbraw/zinc/02/18/11/589021811.db2.gz PKKGVJKAHDXXIO-LLVKDONJSA-N 1 2 246.289 2.281 20 0 BEADLO C[C@H](CCO)SCc1cc[nH+]c(N(C)C)c1 ZINC000762482878 585432981 /nfs/dbraw/zinc/43/29/81/585432981.db2.gz ZXFLMUJPJJQKGM-SNVBAGLBSA-N 1 2 240.372 2.152 20 0 BEADLO Cc1ccc(C(=O)OCCn2cc[nH+]c2)c(C)c1 ZINC000763115200 585443261 /nfs/dbraw/zinc/44/32/61/585443261.db2.gz LCRCGRVDTWTHSA-UHFFFAOYSA-N 1 2 244.294 2.357 20 0 BEADLO COc1ccc(C[NH2+]Cc2cn[nH]c2C)c(C)c1 ZINC000765259605 585483316 /nfs/dbraw/zinc/48/33/16/585483316.db2.gz HUTJQLKTQLWALW-UHFFFAOYSA-N 1 2 245.326 2.325 20 0 BEADLO CCCOC(=O)[C@@H](C)[NH+]1CCC(C(F)F)CC1 ZINC000766190681 585498761 /nfs/dbraw/zinc/49/87/61/585498761.db2.gz POWGSCWFPREJDE-SECBINFHSA-N 1 2 249.301 2.305 20 0 BEADLO CC(=O)CC[N@@H+]1CCc2ccc(F)c(F)c2C1 ZINC000767907052 585528291 /nfs/dbraw/zinc/52/82/91/585528291.db2.gz XCVSOVUGMPQPDV-UHFFFAOYSA-N 1 2 239.265 2.302 20 0 BEADLO CC(=O)CC[N@H+]1CCc2ccc(F)c(F)c2C1 ZINC000767907052 585528292 /nfs/dbraw/zinc/52/82/92/585528292.db2.gz XCVSOVUGMPQPDV-UHFFFAOYSA-N 1 2 239.265 2.302 20 0 BEADLO Cc1cc(NC(=O)NCCC2CCC2)c(C)c[nH+]1 ZINC000767948618 585528758 /nfs/dbraw/zinc/52/87/58/585528758.db2.gz SUEHEANLRJMQLZ-UHFFFAOYSA-N 1 2 247.342 2.432 20 0 BEADLO c1ccc2c(c1)cncc2C[NH+]1CCOCC1 ZINC000768128987 585532501 /nfs/dbraw/zinc/53/25/01/585532501.db2.gz BCPLXTLSQMUAJJ-UHFFFAOYSA-N 1 2 228.295 2.067 20 0 BEADLO Cc1ccc2c(c1)CC[C@@H]2[NH2+]CC(F)(F)CO ZINC000768286520 585535085 /nfs/dbraw/zinc/53/50/85/585535085.db2.gz MKPVEMPEZMYLOB-LBPRGKRZSA-N 1 2 241.281 2.200 20 0 BEADLO C[C@H](CC(=O)N(C)CCCn1cc[nH+]c1)C1CC1 ZINC000768323249 585535917 /nfs/dbraw/zinc/53/59/17/585535917.db2.gz GGEMGKFVCOCTJA-GFCCVEGCSA-N 1 2 249.358 2.168 20 0 BEADLO CC[C@H](C)CO[NH+]=C(N)COC(C)(C)C ZINC000768931308 585546191 /nfs/dbraw/zinc/54/61/91/585546191.db2.gz KBXXHFORDVUJCU-VIFPVBQESA-N 1 2 216.325 2.346 20 0 BEADLO C[C@H]1C[C@@H]1C(=O)OCc1cccc2[nH+]ccn21 ZINC000769314220 585553597 /nfs/dbraw/zinc/55/35/97/585553597.db2.gz MLKPAYMRYUKYFU-ONGXEEELSA-N 1 2 230.267 2.034 20 0 BEADLO COC1CC([NH2+]c2ccc3c(c2)N(C)CCO3)C1 ZINC000769545052 585559356 /nfs/dbraw/zinc/55/93/56/585559356.db2.gz ZVRCULANOBPQOX-UHFFFAOYSA-N 1 2 248.326 2.105 20 0 BEADLO CCc1noc(C)c1[C@H](C)[NH2+]Cc1ccon1 ZINC000769873451 585565846 /nfs/dbraw/zinc/56/58/46/585565846.db2.gz IBAWOFNMKRYTTE-QMMMGPOBSA-N 1 2 235.287 2.384 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2ccnc(F)c2)C[C@@H]1F ZINC000859240150 589023403 /nfs/dbraw/zinc/02/34/03/589023403.db2.gz UMNPDLGHJAMSDC-KOLCDFICSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2ccnc(F)c2)C[C@@H]1F ZINC000859240150 589023404 /nfs/dbraw/zinc/02/34/04/589023404.db2.gz UMNPDLGHJAMSDC-KOLCDFICSA-N 1 2 226.270 2.401 20 0 BEADLO CC1(C)CCC[C@H]1C(=O)NC1=[NH+]CCS1 ZINC000771926655 585604722 /nfs/dbraw/zinc/60/47/22/585604722.db2.gz HIDRBRMKPQNPOD-QMMMGPOBSA-N 1 2 226.345 2.032 20 0 BEADLO Cc1cc(F)cc(C(=O)OCCn2cc[nH+]c2)c1 ZINC000771975070 585605771 /nfs/dbraw/zinc/60/57/71/585605771.db2.gz FXVHAPIFMOXLTN-UHFFFAOYSA-N 1 2 248.257 2.188 20 0 BEADLO Cc1ccc([C@H](C)C(=O)OCCn2cc[nH+]c2)o1 ZINC000771983970 585606121 /nfs/dbraw/zinc/60/61/21/585606121.db2.gz CRMGHOKQXBAETO-NSHDSACASA-N 1 2 248.282 2.131 20 0 BEADLO CCCN(C)C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000772937790 585627835 /nfs/dbraw/zinc/62/78/35/585627835.db2.gz KBNNQAXLLAAREW-JTQLQIEISA-N 1 2 236.319 2.008 20 0 BEADLO C/C(=C/C(C)(C)C)C(=O)NCc1c[nH+]c[nH]1 ZINC000773102552 585631585 /nfs/dbraw/zinc/63/15/85/585631585.db2.gz YWBLGRINLGJHFK-UITAMQMPSA-N 1 2 221.304 2.018 20 0 BEADLO CC(=CC(C)(C)C)C(=O)NCc1c[nH]c[nH+]1 ZINC000773102552 585631586 /nfs/dbraw/zinc/63/15/86/585631586.db2.gz YWBLGRINLGJHFK-UITAMQMPSA-N 1 2 221.304 2.018 20 0 BEADLO CCC(=CC(=O)Nc1cc[nH+]cc1N(C)C)CC ZINC000774096152 585650473 /nfs/dbraw/zinc/65/04/73/585650473.db2.gz OQTZPYLWKUSPGZ-UHFFFAOYSA-N 1 2 247.342 2.254 20 0 BEADLO COc1cc[nH+]cc1COC(=O)/C=C\SC ZINC000805502247 585651494 /nfs/dbraw/zinc/65/14/94/585651494.db2.gz AKHGFHOZTOVKLS-XQRVVYSFSA-N 1 2 239.296 2.010 20 0 BEADLO O=C(OCCn1cc[nH+]c1)C1=CCCCCC1 ZINC000775063884 585671490 /nfs/dbraw/zinc/67/14/90/585671490.db2.gz LDFLNEWNTQLASK-UHFFFAOYSA-N 1 2 234.299 2.317 20 0 BEADLO Cc1noc(C)c1CN(C)c1cc[nH+]cc1F ZINC000775484445 585678482 /nfs/dbraw/zinc/67/84/82/585678482.db2.gz WKMPBAIRDBEAAB-UHFFFAOYSA-N 1 2 235.262 2.462 20 0 BEADLO CC(C)COC(=O)C[NH+]1C[C@@H](C)S[C@H](C)C1 ZINC000776587421 585701966 /nfs/dbraw/zinc/70/19/66/585701966.db2.gz GCCWKWFVCGOXAD-GHMZBOCLSA-N 1 2 245.388 2.011 20 0 BEADLO CCc1onc(C)c1NCc1[nH+]ccn1CC ZINC000776723729 585703601 /nfs/dbraw/zinc/70/36/01/585703601.db2.gz UQGOLABJNXMQOR-UHFFFAOYSA-N 1 2 234.303 2.374 20 0 BEADLO CN(C(=O)c1cccc2[nH+]ccn21)C1CCCC1 ZINC000776755588 585703898 /nfs/dbraw/zinc/70/38/98/585703898.db2.gz NCBGSRWRQZWQCA-UHFFFAOYSA-N 1 2 243.310 2.349 20 0 BEADLO CCN(C(=O)c1cccc2[nH+]ccn21)C1CCC1 ZINC000776939025 585707048 /nfs/dbraw/zinc/70/70/48/585707048.db2.gz QKUMFDQELIVBEI-UHFFFAOYSA-N 1 2 243.310 2.349 20 0 BEADLO C[C@@H]1CCN(C(=O)c2cccc3[nH+]ccn32)[C@H]1C ZINC000776982266 585707100 /nfs/dbraw/zinc/70/71/00/585707100.db2.gz FJGNNKRDZGNKKP-MNOVXSKESA-N 1 2 243.310 2.205 20 0 BEADLO COc1ccc(N[C@@H](C)C[C@@H]2CCOC2)[nH+]c1 ZINC000777199871 585709226 /nfs/dbraw/zinc/70/92/26/585709226.db2.gz CMBOMYWDCWNYQB-QWRGUYRKSA-N 1 2 236.315 2.317 20 0 BEADLO CCn1cc(NCc2cc(OC)cc(C)[nH+]2)cn1 ZINC000777436662 585711930 /nfs/dbraw/zinc/71/19/30/585711930.db2.gz TYDYWLQGGBELSR-UHFFFAOYSA-N 1 2 246.314 2.227 20 0 BEADLO C/C(=C/C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1)C1CC1 ZINC000777454097 585712435 /nfs/dbraw/zinc/71/24/35/585712435.db2.gz RYMNWBGDEGWYFN-PRDAAYKISA-N 1 2 245.326 2.430 20 0 BEADLO O=C([C@H]1CC12CCC2)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000777455189 585712564 /nfs/dbraw/zinc/71/25/64/585712564.db2.gz NLWXDKJRSDJEHG-GHMZBOCLSA-N 1 2 245.326 2.263 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OCc1ccc(CF)cc1 ZINC000777543023 585714678 /nfs/dbraw/zinc/71/46/78/585714678.db2.gz WWVCCZSANZBMQV-SECBINFHSA-N 1 2 240.278 2.189 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1ccc(CF)cc1 ZINC000777573987 585715537 /nfs/dbraw/zinc/71/55/37/585715537.db2.gz DOIPLSOEJZDGFD-UHFFFAOYSA-N 1 2 239.290 2.151 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1ccc(CF)cc1 ZINC000777573987 585715538 /nfs/dbraw/zinc/71/55/38/585715538.db2.gz DOIPLSOEJZDGFD-UHFFFAOYSA-N 1 2 239.290 2.151 20 0 BEADLO CCCCOC(=O)[C@H](C)[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000778230843 585728577 /nfs/dbraw/zinc/72/85/77/585728577.db2.gz CKZMGMPOVPXPBY-WOPDTQHZSA-N 1 2 245.338 2.398 20 0 BEADLO CCCCOC(=O)[C@H](C)[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000778230843 585728578 /nfs/dbraw/zinc/72/85/78/585728578.db2.gz CKZMGMPOVPXPBY-WOPDTQHZSA-N 1 2 245.338 2.398 20 0 BEADLO Cl/C=C\C[N@@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000778229252 585728595 /nfs/dbraw/zinc/72/85/95/585728595.db2.gz RBFJYLUQPMCBGX-FIFYQCSRSA-N 1 2 211.696 2.299 20 0 BEADLO Cl/C=C\C[N@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000778229252 585728596 /nfs/dbraw/zinc/72/85/96/585728596.db2.gz RBFJYLUQPMCBGX-FIFYQCSRSA-N 1 2 211.696 2.299 20 0 BEADLO Cl/C=C\CN1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000778229252 585728597 /nfs/dbraw/zinc/72/85/97/585728597.db2.gz RBFJYLUQPMCBGX-FIFYQCSRSA-N 1 2 211.696 2.299 20 0 BEADLO Cn1c[nH+]cc1COC(=O)C[C@@H]1C=CCCC1 ZINC000778657243 585738526 /nfs/dbraw/zinc/73/85/26/585738526.db2.gz GIAXJLZHWNOIBE-LLVKDONJSA-N 1 2 234.299 2.210 20 0 BEADLO O[C@H](C[N@@H+]1CCC=C(F)C1)c1ccccc1F ZINC000778961409 585743201 /nfs/dbraw/zinc/74/32/01/585743201.db2.gz UXSLTVHRQYVEBI-CYBMUJFWSA-N 1 2 239.265 2.418 20 0 BEADLO O[C@H](C[N@H+]1CCC=C(F)C1)c1ccccc1F ZINC000778961409 585743202 /nfs/dbraw/zinc/74/32/02/585743202.db2.gz UXSLTVHRQYVEBI-CYBMUJFWSA-N 1 2 239.265 2.418 20 0 BEADLO C[C@H]1CC[N@H+](Cc2ccc(F)nc2)C[C@H]1F ZINC000779166730 585746602 /nfs/dbraw/zinc/74/66/02/585746602.db2.gz UYUPTLQGWBVXGU-GXSJLCMTSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2ccc(F)nc2)C[C@H]1F ZINC000779166730 585746603 /nfs/dbraw/zinc/74/66/03/585746603.db2.gz UYUPTLQGWBVXGU-GXSJLCMTSA-N 1 2 226.270 2.401 20 0 BEADLO COc1ccc([NH2+][C@@H](C)CCO)c(C)c1 ZINC000779422597 585754681 /nfs/dbraw/zinc/75/46/81/585754681.db2.gz JODBCVAFIHHFRO-JTQLQIEISA-N 1 2 209.289 2.186 20 0 BEADLO CCOCC[N@H+](C)Cc1coc(C2CC2)n1 ZINC000779598534 585756740 /nfs/dbraw/zinc/75/67/40/585756740.db2.gz LCOQGFKSNXQFAF-UHFFFAOYSA-N 1 2 224.304 2.020 20 0 BEADLO CCOCC[N@@H+](C)Cc1coc(C2CC2)n1 ZINC000779598534 585756741 /nfs/dbraw/zinc/75/67/41/585756741.db2.gz LCOQGFKSNXQFAF-UHFFFAOYSA-N 1 2 224.304 2.020 20 0 BEADLO CC[NH+]1CCN(C[C@@H]2CCc3ccccc32)CC1 ZINC000780286735 585776791 /nfs/dbraw/zinc/77/67/91/585776791.db2.gz KHEIACCOLRYRGX-HNNXBMFYSA-N 1 2 244.382 2.354 20 0 BEADLO CC/C(C)=C(\C)C(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000780986522 585787845 /nfs/dbraw/zinc/78/78/45/585787845.db2.gz NIZRIIMNMLMHIA-PBQZMEPESA-N 1 2 247.342 2.130 20 0 BEADLO CCC(C)=C(C)C(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000780986522 585787846 /nfs/dbraw/zinc/78/78/46/585787846.db2.gz NIZRIIMNMLMHIA-PBQZMEPESA-N 1 2 247.342 2.130 20 0 BEADLO Cc1cc2c(cc1NCc1[nH+]ccn1C)OCO2 ZINC000781128749 585791015 /nfs/dbraw/zinc/79/10/15/585791015.db2.gz UKMSTNYOULWWKT-UHFFFAOYSA-N 1 2 245.282 2.069 20 0 BEADLO CC1(C)CC[C@@H](C(=O)NC2=[NH+]CCS2)C1 ZINC000781600300 585800189 /nfs/dbraw/zinc/80/01/89/585800189.db2.gz DZHTWBRAABZUDZ-MRVPVSSYSA-N 1 2 226.345 2.032 20 0 BEADLO CCC(=O)OCc1c[nH+]cn1Cc1ccccc1 ZINC000782024077 585806809 /nfs/dbraw/zinc/80/68/09/585806809.db2.gz NJUZTIUJCPAVPO-UHFFFAOYSA-N 1 2 244.294 2.385 20 0 BEADLO CCCCC(=O)OCc1cc[nH+]c(N(C)C)c1 ZINC000782147686 585808574 /nfs/dbraw/zinc/80/85/74/585808574.db2.gz SOJFHRQJLXXDPJ-UHFFFAOYSA-N 1 2 236.315 2.381 20 0 BEADLO CO[C@H](C)CO[NH+]=C(N)Cc1ccccc1C ZINC000782337078 585815610 /nfs/dbraw/zinc/81/56/10/585815610.db2.gz NDXBLNSYGCMCTH-LLVKDONJSA-N 1 2 236.315 2.071 20 0 BEADLO Cc1oncc1C[N@H+]1CC[C@H](C)[C@H](F)C1 ZINC000782532164 585819765 /nfs/dbraw/zinc/81/97/65/585819765.db2.gz YZTJILAGOVSHGD-GZMMTYOYSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1oncc1C[N@@H+]1CC[C@H](C)[C@H](F)C1 ZINC000782532164 585819766 /nfs/dbraw/zinc/81/97/66/585819766.db2.gz YZTJILAGOVSHGD-GZMMTYOYSA-N 1 2 212.268 2.163 20 0 BEADLO CC/C(C)=C(/C)C(=O)N1CCn2cc(C)[nH+]c2C1 ZINC000782821762 585824611 /nfs/dbraw/zinc/82/46/11/585824611.db2.gz GFARSKDIDALNBI-BENRWUELSA-N 1 2 247.342 2.280 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OCCCc1ccsc1 ZINC000782947136 585826465 /nfs/dbraw/zinc/82/64/65/585826465.db2.gz CCJABJAASGMCEY-VIFPVBQESA-N 1 2 242.344 2.214 20 0 BEADLO CCCO[NH+]=C(N)Cc1cccc(F)c1 ZINC000783151276 585828422 /nfs/dbraw/zinc/82/84/22/585828422.db2.gz ILXGIKLCKQHZLL-UHFFFAOYSA-N 1 2 210.252 2.277 20 0 BEADLO CC(C)O[NH+]=C(N)Cc1cccc(F)c1 ZINC000783155547 585828646 /nfs/dbraw/zinc/82/86/46/585828646.db2.gz HFWDUDVLRIZJMP-UHFFFAOYSA-N 1 2 210.252 2.275 20 0 BEADLO CC(C)CO[C@H](C)C(N)=[NH+]OCCC1CC1 ZINC000783558977 585836869 /nfs/dbraw/zinc/83/68/69/585836869.db2.gz HZFSORRSKQJAOR-SNVBAGLBSA-N 1 2 228.336 2.346 20 0 BEADLO C[C@@H]1CC[C@H]1[NH2+]c1ccc(-n2ccnn2)cc1 ZINC000783585019 585837583 /nfs/dbraw/zinc/83/75/83/585837583.db2.gz IHSSGBWBBLEDCI-ZWNOBZJWSA-N 1 2 228.299 2.478 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc(F)nc2)[C@@H](C)[C@@H](C)O1 ZINC000783737986 585841614 /nfs/dbraw/zinc/84/16/14/585841614.db2.gz RNABITIHBITZLR-OUAUKWLOSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc(F)nc2)[C@@H](C)[C@@H](C)O1 ZINC000783737986 585841615 /nfs/dbraw/zinc/84/16/15/585841615.db2.gz RNABITIHBITZLR-OUAUKWLOSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H](C(=O)OCCCn1cc[nH+]c1)c1ccco1 ZINC000783837711 585844325 /nfs/dbraw/zinc/84/43/25/585844325.db2.gz FVOFQGVOLTXXGG-LLVKDONJSA-N 1 2 248.282 2.213 20 0 BEADLO Cc1cc(C)c(C(=O)OCCCn2cc[nH+]c2)o1 ZINC000783998749 585846389 /nfs/dbraw/zinc/84/63/89/585846389.db2.gz QEFLAYYVUZOYIX-UHFFFAOYSA-N 1 2 248.282 2.340 20 0 BEADLO CCc1nnc(C[N@@H+]2CCC2(C)C)s1 ZINC000784190689 585852581 /nfs/dbraw/zinc/85/25/81/585852581.db2.gz DKUKHMOCOZVIQI-UHFFFAOYSA-N 1 2 211.334 2.085 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)C1=CCCCC1 ZINC000784860991 585866997 /nfs/dbraw/zinc/86/69/97/585866997.db2.gz CKUQFOMPHAFYCM-UHFFFAOYSA-N 1 2 234.299 2.317 20 0 BEADLO C/C=C(\CC)C(=O)OCCCn1cc[nH+]c1 ZINC000784903313 585868247 /nfs/dbraw/zinc/86/82/47/585868247.db2.gz DOCDFFTWKUMTJT-QDEBKDIKSA-N 1 2 222.288 2.173 20 0 BEADLO CC[N@@H+]1CCCC[C@H]1C(=O)OCC(C)(C)F ZINC000785918847 585883359 /nfs/dbraw/zinc/88/33/59/585883359.db2.gz IEAAXWRPXATFLI-JTQLQIEISA-N 1 2 231.311 2.152 20 0 BEADLO CC[N@H+]1CCCC[C@H]1C(=O)OCC(C)(C)F ZINC000785918847 585883360 /nfs/dbraw/zinc/88/33/60/585883360.db2.gz IEAAXWRPXATFLI-JTQLQIEISA-N 1 2 231.311 2.152 20 0 BEADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)C(F)F ZINC000786841198 585897725 /nfs/dbraw/zinc/89/77/25/585897725.db2.gz ZGHACLPIRQFJCB-UHFFFAOYSA-N 1 2 237.209 2.076 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1ccc(F)nc1C ZINC000787111242 585901501 /nfs/dbraw/zinc/90/15/01/585901501.db2.gz CRPJTPBGADXSDF-GFCCVEGCSA-N 1 2 238.306 2.140 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1ccc(F)nc1C ZINC000787111242 585901502 /nfs/dbraw/zinc/90/15/02/585901502.db2.gz CRPJTPBGADXSDF-GFCCVEGCSA-N 1 2 238.306 2.140 20 0 BEADLO C[C@H]1CC[N@H+](Cc2ccc(F)cn2)C[C@H]1F ZINC000787279164 585904728 /nfs/dbraw/zinc/90/47/28/585904728.db2.gz HVEJQSSOJXMLNB-JOYOIKCWSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2ccc(F)cn2)C[C@H]1F ZINC000787279164 585904729 /nfs/dbraw/zinc/90/47/29/585904729.db2.gz HVEJQSSOJXMLNB-JOYOIKCWSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccnc(F)c2)[C@H](C)[C@@H](C)O1 ZINC000859270277 589026631 /nfs/dbraw/zinc/02/66/31/589026631.db2.gz NYSDYSNANDFHFN-GMTAPVOTSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccnc(F)c2)[C@H](C)[C@@H](C)O1 ZINC000859270277 589026633 /nfs/dbraw/zinc/02/66/33/589026633.db2.gz NYSDYSNANDFHFN-GMTAPVOTSA-N 1 2 238.306 2.218 20 0 BEADLO Nc1cc(COC(=O)c2ccc(F)cc2)cc[nH+]1 ZINC000787578520 585912233 /nfs/dbraw/zinc/91/22/33/585912233.db2.gz KQGFOAOYGLEZOA-UHFFFAOYSA-N 1 2 246.241 2.160 20 0 BEADLO Cc1cccc(C(=O)OCc2cc[nH+]c(N)c2)c1 ZINC000787594007 585912675 /nfs/dbraw/zinc/91/26/75/585912675.db2.gz ZAFVDKVGXNCEEU-UHFFFAOYSA-N 1 2 242.278 2.329 20 0 BEADLO FC(F)C1C[NH+](Cc2ccc(Cl)cn2)C1 ZINC000787993069 585918347 /nfs/dbraw/zinc/91/83/47/585918347.db2.gz TZCMSCZITUKHIO-UHFFFAOYSA-N 1 2 232.661 2.432 20 0 BEADLO CC(C)c1nc(N2CC(C)(C)C2)cc[nH+]1 ZINC000788579355 585927319 /nfs/dbraw/zinc/92/73/19/585927319.db2.gz YMYDMSIOJWXCEW-UHFFFAOYSA-N 1 2 205.305 2.446 20 0 BEADLO CCc1[nH+]c(C)ccc1OCc1ccnn1C ZINC000788789585 585930310 /nfs/dbraw/zinc/93/03/10/585930310.db2.gz AJWVPKQGWCEVAB-UHFFFAOYSA-N 1 2 231.299 2.265 20 0 BEADLO Cc1ccc(C(=O)OCCc2c[nH+]cn2C)cc1 ZINC000789776562 585949646 /nfs/dbraw/zinc/94/96/46/585949646.db2.gz JAJJZHUCNBUITB-UHFFFAOYSA-N 1 2 244.294 2.128 20 0 BEADLO Cc1cccc(C(=O)OCCc2c[nH+]cn2C)c1 ZINC000789777305 585949762 /nfs/dbraw/zinc/94/97/62/585949762.db2.gz SISHTPXCOXQYAG-UHFFFAOYSA-N 1 2 244.294 2.128 20 0 BEADLO C/C=C(\C)C(=O)N1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000790152422 585958856 /nfs/dbraw/zinc/95/88/56/585958856.db2.gz DGHLHOWGGOPKRO-LXRBDXNZSA-N 1 2 246.310 2.028 20 0 BEADLO CC(C)=CCNC(=O)c1cccc2[nH+]ccn21 ZINC000791006539 585972192 /nfs/dbraw/zinc/97/21/92/585972192.db2.gz LZCBAEGDULUPHA-UHFFFAOYSA-N 1 2 229.283 2.030 20 0 BEADLO C[C@@H](C(=O)OCc1cc[nH+]c(N)c1)c1ccco1 ZINC000791943139 585992191 /nfs/dbraw/zinc/99/21/91/585992191.db2.gz DRSZNEIATZOBRZ-SECBINFHSA-N 1 2 246.266 2.104 20 0 BEADLO Nc1cc(COC(=O)CCC2CCC2)cc[nH+]1 ZINC000791990396 585992736 /nfs/dbraw/zinc/99/27/36/585992736.db2.gz HZMLNGMWCVYQRS-UHFFFAOYSA-N 1 2 234.299 2.287 20 0 BEADLO CC1(C)C(C(=O)OCc2cc[nH+]c(N)c2)C1(C)C ZINC000791980524 585992760 /nfs/dbraw/zinc/99/27/60/585992760.db2.gz YJJMBFGMGNFAAG-UHFFFAOYSA-N 1 2 248.326 2.389 20 0 BEADLO CC/C(C)=C(\C)C(=O)OCc1cc[nH+]c(N)c1 ZINC000792117048 585995792 /nfs/dbraw/zinc/99/57/92/585995792.db2.gz GTZZKFAOSLZCCQ-MDZDMXLPSA-N 1 2 234.299 2.453 20 0 BEADLO CC(C)C[C@@H](C)C(=O)OCc1cc[nH+]c(N)c1 ZINC000792130517 585996323 /nfs/dbraw/zinc/99/63/23/585996323.db2.gz CDXPJGRYETZUDN-SNVBAGLBSA-N 1 2 236.315 2.389 20 0 BEADLO CC(C)c1ccoc1C(=O)OCCn1cc[nH+]c1 ZINC000792619141 586003386 /nfs/dbraw/zinc/00/33/86/586003386.db2.gz YTKOCWMGVMKVDF-UHFFFAOYSA-N 1 2 248.282 2.457 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1C(=O)NC1=[NH+]CCS1 ZINC000792857353 586005934 /nfs/dbraw/zinc/00/59/34/586005934.db2.gz YOKPZOOELATYDZ-ZJUUUORDSA-N 1 2 240.372 2.422 20 0 BEADLO Cc1cc(C(=O)OCCc2c[nH+]cn2C)oc1C ZINC000793251698 586014932 /nfs/dbraw/zinc/01/49/32/586014932.db2.gz UIEOVLQYBVRIMB-UHFFFAOYSA-N 1 2 248.282 2.029 20 0 BEADLO CC(C)C[C@H](C)C(=O)OCCc1c[nH+]cn1C ZINC000793251123 586014941 /nfs/dbraw/zinc/01/49/41/586014941.db2.gz PCWWIEOLXOXQMY-NSHDSACASA-N 1 2 238.331 2.188 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)[C@H]1CC12CCCC2 ZINC000793251729 586015059 /nfs/dbraw/zinc/01/50/59/586015059.db2.gz VQIPWRNRWUCRIE-GFCCVEGCSA-N 1 2 248.326 2.086 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)C=C1CCCCC1 ZINC000793249066 586015061 /nfs/dbraw/zinc/01/50/61/586015061.db2.gz DHKOVVYGIHNAEG-UHFFFAOYSA-N 1 2 248.326 2.396 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)C1=CCCCCC1 ZINC000793251321 586015208 /nfs/dbraw/zinc/01/52/08/586015208.db2.gz WOKAVIIPCYJZLA-UHFFFAOYSA-N 1 2 248.326 2.396 20 0 BEADLO Cn1ncc(Cl)c1C[NH+]1CCC(F)(F)CC1 ZINC000793357987 586017185 /nfs/dbraw/zinc/01/71/85/586017185.db2.gz AIFOSZLEHBJYPS-UHFFFAOYSA-N 1 2 249.692 2.305 20 0 BEADLO CC[C@H](O)C[N@@H+]1CCn2c(Cl)ccc2[C@@H]1C ZINC000794442851 586039825 /nfs/dbraw/zinc/03/98/25/586039825.db2.gz HVOHQQRYIMCIIC-UWVGGRQHSA-N 1 2 242.750 2.289 20 0 BEADLO CC[C@H](O)C[N@H+]1CCn2c(Cl)ccc2[C@@H]1C ZINC000794442851 586039826 /nfs/dbraw/zinc/03/98/26/586039826.db2.gz HVOHQQRYIMCIIC-UWVGGRQHSA-N 1 2 242.750 2.289 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1cc(Cl)n(C)n1 ZINC000859283849 589027692 /nfs/dbraw/zinc/02/76/92/589027692.db2.gz HTPWMJFKVLLRRB-OCAPTIKFSA-N 1 2 213.712 2.056 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1cc(Cl)n(C)n1 ZINC000859283849 589027694 /nfs/dbraw/zinc/02/76/94/589027694.db2.gz HTPWMJFKVLLRRB-OCAPTIKFSA-N 1 2 213.712 2.056 20 0 BEADLO CC[N@H+](CC1CCC1)Cn1ncn(C)c1=S ZINC000794682783 586046656 /nfs/dbraw/zinc/04/66/56/586046656.db2.gz KLCOFJXWFBSKMU-UHFFFAOYSA-N 1 2 240.376 2.031 20 0 BEADLO CC[N@@H+](CC1CCC1)Cn1ncn(C)c1=S ZINC000794682783 586046657 /nfs/dbraw/zinc/04/66/57/586046657.db2.gz KLCOFJXWFBSKMU-UHFFFAOYSA-N 1 2 240.376 2.031 20 0 BEADLO CC[C@@H](C)CCC(=O)NC1=[NH+]CCS1 ZINC000794823922 586049734 /nfs/dbraw/zinc/04/97/34/586049734.db2.gz MTTCAKDLIHJANE-MRVPVSSYSA-N 1 2 214.334 2.032 20 0 BEADLO CC[C@H]([NH2+]Cc1cccnc1F)c1ccn(C)n1 ZINC000794833581 586050057 /nfs/dbraw/zinc/05/00/57/586050057.db2.gz GTYIFFOTLNISIN-NSHDSACASA-N 1 2 248.305 2.195 20 0 BEADLO C[C@H]1CN(c2cccc(F)c2)CC[N@@H+]1CCF ZINC000795187089 586070586 /nfs/dbraw/zinc/07/05/86/586070586.db2.gz FPAOUBSMSOEMPA-NSHDSACASA-N 1 2 240.297 2.306 20 0 BEADLO C[C@H]1CN(c2cccc(F)c2)CC[N@H+]1CCF ZINC000795187089 586070588 /nfs/dbraw/zinc/07/05/88/586070588.db2.gz FPAOUBSMSOEMPA-NSHDSACASA-N 1 2 240.297 2.306 20 0 BEADLO Fc1cccc(C2([NH2+]Cc3c[nH]cn3)CC2)c1 ZINC000796449699 586103513 /nfs/dbraw/zinc/10/35/13/586103513.db2.gz KPAJXIDGGJOKTR-UHFFFAOYSA-N 1 2 231.274 2.328 20 0 BEADLO C[N@H+](CCOc1cccc(F)c1)Cc1cnc[nH]1 ZINC000796459536 586104268 /nfs/dbraw/zinc/10/42/68/586104268.db2.gz YGPGXHAZJSIIDS-UHFFFAOYSA-N 1 2 249.289 2.060 20 0 BEADLO C[N@@H+](CCOc1cccc(F)c1)Cc1cnc[nH]1 ZINC000796459536 586104269 /nfs/dbraw/zinc/10/42/69/586104269.db2.gz YGPGXHAZJSIIDS-UHFFFAOYSA-N 1 2 249.289 2.060 20 0 BEADLO Cc1noc([C@H](C)[NH+]2CCC(F)(F)CC2)n1 ZINC000796540231 586106244 /nfs/dbraw/zinc/10/62/44/586106244.db2.gz HUGGQIUWTMYRAW-ZETCQYMHSA-N 1 2 231.246 2.170 20 0 BEADLO CCc1noc([C@@H](C)[NH+]2CCC(F)(F)CC2)n1 ZINC000796542259 586106545 /nfs/dbraw/zinc/10/65/45/586106545.db2.gz DDRNEJQKBVWAQQ-MRVPVSSYSA-N 1 2 245.273 2.424 20 0 BEADLO COc1ccc(N[C@@H]2CCCc3n[nH]cc32)[nH+]c1 ZINC000796890230 586116334 /nfs/dbraw/zinc/11/63/34/586116334.db2.gz NVDHLPDRAOHMMY-LLVKDONJSA-N 1 2 244.298 2.303 20 0 BEADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)OC ZINC000797776112 586130946 /nfs/dbraw/zinc/13/09/46/586130946.db2.gz NFWNOYBGTLBHMX-SNVBAGLBSA-N 1 2 237.303 2.196 20 0 BEADLO C[C@@H]1C[C@@H]1COC(=O)[C@@H](c1ccccc1)[NH+](C)C ZINC000798820557 586150541 /nfs/dbraw/zinc/15/05/41/586150541.db2.gz JECRTCVGPCIDBG-MRVWCRGKSA-N 1 2 247.338 2.489 20 0 BEADLO OCC[C@@H](Cc1ccccc1)Nc1cccc[nH+]1 ZINC000799332102 586171858 /nfs/dbraw/zinc/17/18/58/586171858.db2.gz UFPMGRBDQLVNDD-AWEZNQCLSA-N 1 2 242.322 2.487 20 0 BEADLO FC(F)[C@@H]1CCCC[N@@H+]1CCC1OCCCO1 ZINC000800447571 586220304 /nfs/dbraw/zinc/22/03/04/586220304.db2.gz IXDPMKQFECJVGP-JTQLQIEISA-N 1 2 249.301 2.259 20 0 BEADLO FC(F)[C@@H]1CCCC[N@H+]1CCC1OCCCO1 ZINC000800447571 586220305 /nfs/dbraw/zinc/22/03/05/586220305.db2.gz IXDPMKQFECJVGP-JTQLQIEISA-N 1 2 249.301 2.259 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2cccc(F)n2)nn1C ZINC000800481814 586221982 /nfs/dbraw/zinc/22/19/82/586221982.db2.gz GNJDUWKIRKDYNF-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO Cn1c[nH+]c(/C=C2\C(=O)Nc3ccc(F)cc32)c1 ZINC000800795118 586229252 /nfs/dbraw/zinc/22/92/52/586229252.db2.gz YYVGMMMFLRABAN-WZUFQYTHSA-N 1 2 243.241 2.052 20 0 BEADLO Cc1cc(C)nc(C(=O)Nc2cc[nH+]c(C)c2)c1 ZINC000800931041 586237256 /nfs/dbraw/zinc/23/72/56/586237256.db2.gz XFZZTSNZDNDHLO-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO C[C@@H](c1ccccn1)[N@@H+]1CCO[C@H](C(F)F)C1 ZINC000801559174 586262038 /nfs/dbraw/zinc/26/20/38/586262038.db2.gz FBCQQLRYLZMBER-ONGXEEELSA-N 1 2 242.269 2.109 20 0 BEADLO C[C@@H](c1ccccn1)[N@H+]1CCO[C@H](C(F)F)C1 ZINC000801559174 586262039 /nfs/dbraw/zinc/26/20/39/586262039.db2.gz FBCQQLRYLZMBER-ONGXEEELSA-N 1 2 242.269 2.109 20 0 BEADLO Oc1ccc2c(c1)C[N@@H+](C/C=C/Cl)C2 ZINC000859475830 589040182 /nfs/dbraw/zinc/04/01/82/589040182.db2.gz KCSGUPALEISYEO-DAFODLJHSA-N 1 2 209.676 2.460 20 0 BEADLO Oc1ccc2c(c1)C[N@H+](C/C=C/Cl)C2 ZINC000859475830 589040184 /nfs/dbraw/zinc/04/01/84/589040184.db2.gz KCSGUPALEISYEO-DAFODLJHSA-N 1 2 209.676 2.460 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc3c(c2)COC3)CCC1=O ZINC000801943829 586281482 /nfs/dbraw/zinc/28/14/82/586281482.db2.gz IZVYZVRPRAQEFY-LLVKDONJSA-N 1 2 245.322 2.128 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc3c(c2)COC3)CCC1=O ZINC000801943829 586281484 /nfs/dbraw/zinc/28/14/84/586281484.db2.gz IZVYZVRPRAQEFY-LLVKDONJSA-N 1 2 245.322 2.128 20 0 BEADLO Cc1ccccc1OCC[N@@H+]1CCOCC12CC2 ZINC000801980763 586284781 /nfs/dbraw/zinc/28/47/81/586284781.db2.gz JNYDWEYYHDBVNY-UHFFFAOYSA-N 1 2 247.338 2.239 20 0 BEADLO Cc1ccccc1OCC[N@H+]1CCOCC12CC2 ZINC000801980763 586284783 /nfs/dbraw/zinc/28/47/83/586284783.db2.gz JNYDWEYYHDBVNY-UHFFFAOYSA-N 1 2 247.338 2.239 20 0 BEADLO c1cc(C[N@@H+]2CCOCC23CC3)cc2c1COC2 ZINC000801982451 586285388 /nfs/dbraw/zinc/28/53/88/586285388.db2.gz QEOWNDUDJRTNCQ-UHFFFAOYSA-N 1 2 245.322 2.082 20 0 BEADLO c1cc(C[N@H+]2CCOCC23CC3)cc2c1COC2 ZINC000801982451 586285389 /nfs/dbraw/zinc/28/53/89/586285389.db2.gz QEOWNDUDJRTNCQ-UHFFFAOYSA-N 1 2 245.322 2.082 20 0 BEADLO C[C@@H](C(=O)O[C@H]1CC[N@H+](CCF)C1)C(C)(C)C ZINC000802235052 586295504 /nfs/dbraw/zinc/29/55/04/586295504.db2.gz VPHNSSDNRFQWHG-QWRGUYRKSA-N 1 2 245.338 2.256 20 0 BEADLO C[C@@H](C(=O)O[C@H]1CC[N@@H+](CCF)C1)C(C)(C)C ZINC000802235052 586295507 /nfs/dbraw/zinc/29/55/07/586295507.db2.gz VPHNSSDNRFQWHG-QWRGUYRKSA-N 1 2 245.338 2.256 20 0 BEADLO CCC(C)(CC)C(=O)O[C@@H]1CC[N@H+](CCF)C1 ZINC000802241285 586299336 /nfs/dbraw/zinc/29/93/36/586299336.db2.gz LESCBRDHMWLKLX-LLVKDONJSA-N 1 2 245.338 2.400 20 0 BEADLO CCC(C)(CC)C(=O)O[C@@H]1CC[N@@H+](CCF)C1 ZINC000802241285 586299337 /nfs/dbraw/zinc/29/93/37/586299337.db2.gz LESCBRDHMWLKLX-LLVKDONJSA-N 1 2 245.338 2.400 20 0 BEADLO FC(F)[C@H]1C[N@H+](Cc2ccsc2)CCO1 ZINC000802653158 586308092 /nfs/dbraw/zinc/30/80/92/586308092.db2.gz IUBHUAQFZXESDZ-SECBINFHSA-N 1 2 233.283 2.214 20 0 BEADLO FC(F)[C@H]1C[N@@H+](Cc2ccsc2)CCO1 ZINC000802653158 586308093 /nfs/dbraw/zinc/30/80/93/586308093.db2.gz IUBHUAQFZXESDZ-SECBINFHSA-N 1 2 233.283 2.214 20 0 BEADLO CCC(C)(C)C(=O)OCCCc1[nH+]ccn1C ZINC000802783612 586314246 /nfs/dbraw/zinc/31/42/46/586314246.db2.gz ZFAFFXYZQWFVGN-UHFFFAOYSA-N 1 2 238.331 2.332 20 0 BEADLO Cn1cc[nH+]c1CCCOC(=O)[C@H]1CC12CCC2 ZINC000802786806 586314274 /nfs/dbraw/zinc/31/42/74/586314274.db2.gz ZELRRMDXYOBKJD-LLVKDONJSA-N 1 2 248.326 2.086 20 0 BEADLO CC[C@@H](C)CC(=O)OCCCc1[nH+]ccn1C ZINC000802786527 586314496 /nfs/dbraw/zinc/31/44/96/586314496.db2.gz SYACKTFCMDRLJS-LLVKDONJSA-N 1 2 238.331 2.332 20 0 BEADLO C[N@H+](C/C(Cl)=C\Cl)CC1(C)COC1 ZINC000859571067 589044339 /nfs/dbraw/zinc/04/43/39/589044339.db2.gz NAKHRUICKXTNJT-FPYGCLRLSA-N 1 2 224.131 2.274 20 0 BEADLO C[N@@H+](C/C(Cl)=C\Cl)CC1(C)COC1 ZINC000859571067 589044341 /nfs/dbraw/zinc/04/43/41/589044341.db2.gz NAKHRUICKXTNJT-FPYGCLRLSA-N 1 2 224.131 2.274 20 0 BEADLO CC(C)SCCOC(=O)[C@H]1CCCC[N@@H+]1C ZINC000803360397 586347470 /nfs/dbraw/zinc/34/74/70/586347470.db2.gz AIJVWVLCATXJEQ-LLVKDONJSA-N 1 2 245.388 2.156 20 0 BEADLO CC(C)SCCOC(=O)[C@H]1CCCC[N@H+]1C ZINC000803360397 586347473 /nfs/dbraw/zinc/34/74/73/586347473.db2.gz AIJVWVLCATXJEQ-LLVKDONJSA-N 1 2 245.388 2.156 20 0 BEADLO CCC/C(C)=C\C(=O)N[C@@H]1CCc2c[nH+]cn2C1 ZINC000804335652 586390968 /nfs/dbraw/zinc/39/09/68/586390968.db2.gz CSZLQOYHTUMSQG-SEVUFMINSA-N 1 2 247.342 2.061 20 0 BEADLO CC/C(C)=C(\C)C(=O)N[C@H]1CCc2c[nH+]cn2C1 ZINC000804331885 586391174 /nfs/dbraw/zinc/39/11/74/586391174.db2.gz FEZHEBGVYMZGJW-IIANPFDCSA-N 1 2 247.342 2.061 20 0 BEADLO c1cc2cc(NC[C@H]3CCCOC3)[nH+]cc2[nH]1 ZINC000804365183 586392926 /nfs/dbraw/zinc/39/29/26/586392926.db2.gz HAGKAAYJHOLGSZ-SNVBAGLBSA-N 1 2 231.299 2.401 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)NCc1ccon1 ZINC000806535382 586413296 /nfs/dbraw/zinc/41/32/96/586413296.db2.gz RUTMSKSFXHDWKN-UHFFFAOYSA-N 1 2 246.270 2.008 20 0 BEADLO CC1(C)CCN(C[N@@H+]2CCC[C@@](C)(F)C2)C1=O ZINC000840097148 586445568 /nfs/dbraw/zinc/44/55/68/586445568.db2.gz AVOMMNCWKZQXOP-CYBMUJFWSA-N 1 2 242.338 2.026 20 0 BEADLO CC1(C)CCN(C[N@H+]2CCC[C@@](C)(F)C2)C1=O ZINC000840097148 586445570 /nfs/dbraw/zinc/44/55/70/586445570.db2.gz AVOMMNCWKZQXOP-CYBMUJFWSA-N 1 2 242.338 2.026 20 0 BEADLO C[C@@H]1CC[N@H+](CN2C(=O)CCC2(C)C)C[C@H]1F ZINC000808177589 586466624 /nfs/dbraw/zinc/46/66/24/586466624.db2.gz VFZMKCLOXPWNOF-GHMZBOCLSA-N 1 2 242.338 2.025 20 0 BEADLO C[C@@H]1CC[N@@H+](CN2C(=O)CCC2(C)C)C[C@H]1F ZINC000808177589 586466625 /nfs/dbraw/zinc/46/66/25/586466625.db2.gz VFZMKCLOXPWNOF-GHMZBOCLSA-N 1 2 242.338 2.025 20 0 BEADLO Cn1cnc(C[NH2+]C2(c3ccccc3F)CC2)c1 ZINC000808389857 586469992 /nfs/dbraw/zinc/46/99/92/586469992.db2.gz XDVJAUMARHXECX-UHFFFAOYSA-N 1 2 245.301 2.338 20 0 BEADLO Cc1nonc1C[NH2+]Cc1ccc(F)c(C)c1 ZINC000809744843 586516792 /nfs/dbraw/zinc/51/67/92/586516792.db2.gz GAENLWVGEWTGHT-UHFFFAOYSA-N 1 2 235.262 2.115 20 0 BEADLO Cc1cc(C)cc(C[N@@H+](C)Cc2cnn(C)n2)c1 ZINC000809989361 586529312 /nfs/dbraw/zinc/52/93/12/586529312.db2.gz VEZTWPDWJQAQMK-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cc(C)cc(C[N@H+](C)Cc2cnn(C)n2)c1 ZINC000809989361 586529313 /nfs/dbraw/zinc/52/93/13/586529313.db2.gz VEZTWPDWJQAQMK-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO CC[C@H](O)c1nccn1Cc1ccc[nH+]c1C ZINC000810005238 586530805 /nfs/dbraw/zinc/53/08/05/586530805.db2.gz KBAOCLPLVQRPKS-LBPRGKRZSA-N 1 2 231.299 2.078 20 0 BEADLO CCc1cc(C[NH2+][C@H](C)c2cc(C)on2)[nH]n1 ZINC000810218071 586536957 /nfs/dbraw/zinc/53/69/57/586536957.db2.gz OIDYJVOLOSAHTE-SECBINFHSA-N 1 2 234.303 2.119 20 0 BEADLO CCC[C@@H](C)c1noc(Cc2c[nH+]cn2C)n1 ZINC000810283990 586538130 /nfs/dbraw/zinc/53/81/30/586538130.db2.gz HPAVYNYWLRRAKY-SECBINFHSA-N 1 2 234.303 2.298 20 0 BEADLO COCC1(CO[NH+]=C(N)c2ccccc2)CCC1 ZINC000812304442 586573205 /nfs/dbraw/zinc/57/32/05/586573205.db2.gz MQBLQRFCOZQDEJ-UHFFFAOYSA-N 1 2 248.326 2.350 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)C[C@H](C)C1CC1 ZINC000814327901 586621421 /nfs/dbraw/zinc/62/14/21/586621421.db2.gz UTOVYJDANBTBSB-JTQLQIEISA-N 1 2 248.326 2.143 20 0 BEADLO Fc1cc(F)c(C[NH2+]Cc2cn[nH]c2)c(F)c1 ZINC000815152538 586670376 /nfs/dbraw/zinc/67/03/76/586670376.db2.gz PPUWUOSOKDOWIT-UHFFFAOYSA-N 1 2 241.216 2.117 20 0 BEADLO CCCCCCNC(=O)[C@@H]1CCc2c[nH+]cn2C1 ZINC000816839375 586767389 /nfs/dbraw/zinc/76/73/89/586767389.db2.gz CRADMRSCLHZZSJ-GFCCVEGCSA-N 1 2 249.358 2.142 20 0 BEADLO CC(C)CCC[C@@H](C)NC(=O)Cc1[nH]cc[nH+]1 ZINC000816839754 586767965 /nfs/dbraw/zinc/76/79/65/586767965.db2.gz OWMOGEPTRBSJQM-LLVKDONJSA-N 1 2 237.347 2.283 20 0 BEADLO C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)Cc1[nH]cc[nH+]1 ZINC000816926769 586771866 /nfs/dbraw/zinc/77/18/66/586771866.db2.gz GYUULNFJLNFCBC-UTUOFQBUSA-N 1 2 247.342 2.132 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)C(C)=C(C)C ZINC000817085686 586781362 /nfs/dbraw/zinc/78/13/62/586781362.db2.gz ATCKCKJPZZZHEO-UHFFFAOYSA-N 1 2 234.299 2.063 20 0 BEADLO Cn1cnc(C[NH2+][C@H]2C[C@]2(F)c2ccccc2)c1 ZINC000818229932 586880902 /nfs/dbraw/zinc/88/09/02/586880902.db2.gz IMGMUZVDUKWIFM-KBPBESRZSA-N 1 2 245.301 2.147 20 0 BEADLO C[C@H]1CCCC[C@H]1C(=O)NC1=[NH+]CCS1 ZINC000819031584 586925669 /nfs/dbraw/zinc/92/56/69/586925669.db2.gz SSRSSIUEFLBDBR-DTWKUNHWSA-N 1 2 226.345 2.032 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccns1)c1csnn1 ZINC000860061551 589076875 /nfs/dbraw/zinc/07/68/75/589076875.db2.gz LCGNBFITVIWDDI-RQJHMYQMSA-N 1 2 240.357 2.406 20 0 BEADLO Cc1noc([C@H](C)[NH2+][C@H](C)c2ccns2)n1 ZINC000860053208 589077151 /nfs/dbraw/zinc/07/71/51/589077151.db2.gz SPRSTHRKNMTWER-RQJHMYQMSA-N 1 2 238.316 2.246 20 0 BEADLO Cc1noc([C@@H](C)[NH2+][C@H](C)c2ccns2)n1 ZINC000860053207 589077238 /nfs/dbraw/zinc/07/72/38/589077238.db2.gz SPRSTHRKNMTWER-RNFRBKRXSA-N 1 2 238.316 2.246 20 0 BEADLO CC[C@H](O)CNc1ccc([NH+](C)C)cc1C ZINC000819409670 586961950 /nfs/dbraw/zinc/96/19/50/586961950.db2.gz SFWBPEGCLZZRQT-LBPRGKRZSA-N 1 2 222.332 2.244 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000819544686 586976065 /nfs/dbraw/zinc/97/60/65/586976065.db2.gz TYUAEHLDQDHDHJ-GRYCIOLGSA-N 1 2 247.342 2.270 20 0 BEADLO CSCCCCC(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819773721 586991558 /nfs/dbraw/zinc/99/15/58/586991558.db2.gz MOJWEOYBQOELST-QMMMGPOBSA-N 1 2 246.401 2.127 20 0 BEADLO CCCC[C@H](C)C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819777134 586992123 /nfs/dbraw/zinc/99/21/23/586992123.db2.gz HRTIMDYYWPYXCW-DTWKUNHWSA-N 1 2 228.361 2.420 20 0 BEADLO CCCC[C@H](C)C(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819777137 586992222 /nfs/dbraw/zinc/99/22/22/586992222.db2.gz HRTIMDYYWPYXCW-IUCAKERBSA-N 1 2 228.361 2.420 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)CCCC2CC2)S1 ZINC000819780702 586993817 /nfs/dbraw/zinc/99/38/17/586993817.db2.gz IOIFYDMQSNUAGP-MRVPVSSYSA-N 1 2 226.345 2.174 20 0 BEADLO C[C@H](CNC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C(C)(C)C ZINC000820023560 587013429 /nfs/dbraw/zinc/01/34/29/587013429.db2.gz RJCGALLOSDIKOE-GMTAPVOTSA-N 1 2 249.358 2.312 20 0 BEADLO C[C@H](CNC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C(C)(C)C ZINC000820023560 587013432 /nfs/dbraw/zinc/01/34/32/587013432.db2.gz RJCGALLOSDIKOE-GMTAPVOTSA-N 1 2 249.358 2.312 20 0 BEADLO C[C@@H](NC(=O)C[C@@H]1CC=CCC1)c1[nH]cc[nH+]1 ZINC000820191361 587033893 /nfs/dbraw/zinc/03/38/93/587033893.db2.gz CHTOGMOTNKNOSF-GHMZBOCLSA-N 1 2 233.315 2.333 20 0 BEADLO C[C@@H](NC(=O)/C=C\C(C)(C)C)c1[nH]cc[nH+]1 ZINC000820267842 587039494 /nfs/dbraw/zinc/03/94/94/587039494.db2.gz KHSIQLKLOXBYDO-SSJHQANKSA-N 1 2 221.304 2.189 20 0 BEADLO C[C@@H](NC(=O)C=CC(C)(C)C)c1[nH]cc[nH+]1 ZINC000820267842 587039496 /nfs/dbraw/zinc/03/94/96/587039496.db2.gz KHSIQLKLOXBYDO-SSJHQANKSA-N 1 2 221.304 2.189 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)C1(C)CC=CC1 ZINC000820414873 587047216 /nfs/dbraw/zinc/04/72/16/587047216.db2.gz CFVJMRGHYQIKMD-UHFFFAOYSA-N 1 2 246.310 2.063 20 0 BEADLO CCC[C@H](CC)C(=O)NCc1[nH]c[nH+]c1C ZINC000820511070 587052033 /nfs/dbraw/zinc/05/20/33/587052033.db2.gz VAAIBVOWJJODJY-JTQLQIEISA-N 1 2 223.320 2.161 20 0 BEADLO C[C@H]1CN(C(=O)c2cc3c[nH+]ccc3[nH]2)[C@H]1C ZINC000820657776 587063521 /nfs/dbraw/zinc/06/35/21/587063521.db2.gz YAVBKGXRNDSKGD-IUCAKERBSA-N 1 2 229.283 2.043 20 0 BEADLO O=C(C[C@@H]1CC=CCC1)N[C@@H]1CCn2cc[nH+]c21 ZINC000820947580 587083723 /nfs/dbraw/zinc/08/37/23/587083723.db2.gz FOORGIFIEFKDHU-VXGBXAGGSA-N 1 2 245.326 2.191 20 0 BEADLO Cc1ccc([C@@H](C)NC(=O)Cc2[nH]cc[nH+]2)cc1 ZINC000821023907 587089533 /nfs/dbraw/zinc/08/95/33/587089533.db2.gz WPNHOPYCZFTNSD-LLVKDONJSA-N 1 2 243.310 2.138 20 0 BEADLO CCC[C@@H](CC)C(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000821105670 587095963 /nfs/dbraw/zinc/09/59/63/587095963.db2.gz DBFCNZWGWDMSSY-GHMZBOCLSA-N 1 2 249.358 2.210 20 0 BEADLO CCC[C@@H](CC)C(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000821105670 587095965 /nfs/dbraw/zinc/09/59/65/587095965.db2.gz DBFCNZWGWDMSSY-GHMZBOCLSA-N 1 2 249.358 2.210 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)[C@@H]1CCCC12CC2 ZINC000860173615 589086228 /nfs/dbraw/zinc/08/62/28/589086228.db2.gz FMMZMARAKJUMJQ-LBPRGKRZSA-N 1 2 248.326 2.397 20 0 BEADLO CCCC(=O)OCCc1cn2ccccc2[nH+]1 ZINC000821595952 587131549 /nfs/dbraw/zinc/13/15/49/587131549.db2.gz RTWOMOGRASMFPY-UHFFFAOYSA-N 1 2 232.283 2.220 20 0 BEADLO CN(C)c1[nH+]cccc1COC(=O)[C@H]1CC1(C)C ZINC000821608938 587132526 /nfs/dbraw/zinc/13/25/26/587132526.db2.gz AQTYAXBQBDVCJY-LLVKDONJSA-N 1 2 248.326 2.237 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)NC1=[NH+]CCS1 ZINC000822234393 587158375 /nfs/dbraw/zinc/15/83/75/587158375.db2.gz RNZOIPGZCGQFJB-RKDXNWHRSA-N 1 2 226.345 2.032 20 0 BEADLO CCC[C@@H]1CCC[C@@H]1C(=O)NC1=[NH+]CCS1 ZINC000822234365 587158923 /nfs/dbraw/zinc/15/89/23/587158923.db2.gz PVQPDHMFTCYTAN-ZJUUUORDSA-N 1 2 240.372 2.422 20 0 BEADLO C[C@H]1CCC[C@@]1(C)C(=O)NC1=[NH+]CCS1 ZINC000822234475 587159112 /nfs/dbraw/zinc/15/91/12/587159112.db2.gz VSVBKUDAUSDUMV-GZMMTYOYSA-N 1 2 226.345 2.032 20 0 BEADLO C[C@H]1C[C@@H]1C(=O)OCc1[nH]c[nH+]c1C(C)(C)C ZINC000822307958 587161507 /nfs/dbraw/zinc/16/15/07/587161507.db2.gz JAXBFWXXJSJSIA-IUCAKERBSA-N 1 2 236.315 2.406 20 0 BEADLO CCC1CN(C(=O)c2cc3c[nH+]ccc3[nH]2)C1 ZINC000822310113 587161769 /nfs/dbraw/zinc/16/17/69/587161769.db2.gz JGZQYNAOGQDKKR-UHFFFAOYSA-N 1 2 229.283 2.045 20 0 BEADLO CN(C(=O)/C=C/c1cn(C)c[nH+]1)C1CC(C)(C)C1 ZINC000822456932 587169225 /nfs/dbraw/zinc/16/92/25/587169225.db2.gz HUEFFLNDEPJZEH-AATRIKPKSA-N 1 2 247.342 2.080 20 0 BEADLO Cc1ccc(N(C)C(=O)Cc2[nH]cc[nH+]2)cc1C ZINC000822884794 587191680 /nfs/dbraw/zinc/19/16/80/587191680.db2.gz YNCQJXJMIGECKL-UHFFFAOYSA-N 1 2 243.310 2.232 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)C[C@@H]2CC=CCC2)S1 ZINC000823307401 587215215 /nfs/dbraw/zinc/21/52/15/587215215.db2.gz SXUSZPOJGBYOSG-NXEZZACHSA-N 1 2 238.356 2.340 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)C[C@H]2CC=CCC2)S1 ZINC000823307403 587215610 /nfs/dbraw/zinc/21/56/10/587215610.db2.gz SXUSZPOJGBYOSG-UWVGGRQHSA-N 1 2 238.356 2.340 20 0 BEADLO CCCC1CCC(NC(=O)Cc2[nH]cc[nH+]2)CC1 ZINC000823337542 587217245 /nfs/dbraw/zinc/21/72/45/587217245.db2.gz PWSKLMJFYHXBJQ-UHFFFAOYSA-N 1 2 249.358 2.427 20 0 BEADLO O[C@@H]1CC[N@H+](CCF)[C@@H]1c1ccc(Cl)cc1 ZINC000823628996 587233205 /nfs/dbraw/zinc/23/32/05/587233205.db2.gz BRFGNVOCYYJVFK-VXGBXAGGSA-N 1 2 243.709 2.417 20 0 BEADLO O[C@@H]1CC[N@@H+](CCF)[C@@H]1c1ccc(Cl)cc1 ZINC000823628996 587233207 /nfs/dbraw/zinc/23/32/07/587233207.db2.gz BRFGNVOCYYJVFK-VXGBXAGGSA-N 1 2 243.709 2.417 20 0 BEADLO CCC[C@@H](CC)C(=O)N[C@H]1CCn2c[nH+]cc2C1 ZINC000824046120 587251474 /nfs/dbraw/zinc/25/14/74/587251474.db2.gz JDAANBUPZXNNAH-NEPJUHHUSA-N 1 2 249.358 2.140 20 0 BEADLO CC1(NC(=O)c2cc3c[nH+]ccc3[nH]2)CC=CC1 ZINC000824253983 587263315 /nfs/dbraw/zinc/26/33/15/587263315.db2.gz JRGLVEVURAAWHJ-UHFFFAOYSA-N 1 2 241.294 2.401 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1cc(F)ncc1F ZINC000824314218 587265781 /nfs/dbraw/zinc/26/57/81/587265781.db2.gz HVXJPIIZDJEMLV-HTQZYQBOSA-N 1 2 212.243 2.343 20 0 BEADLO Fc1cnccc1C[NH+]1CCC(F)(F)CC1 ZINC000824321384 587266002 /nfs/dbraw/zinc/26/60/02/587266002.db2.gz RFGPCMORTNCKKV-UHFFFAOYSA-N 1 2 230.233 2.452 20 0 BEADLO Cn1ncc(C[N@@H+]2CCC[C@@](C)(F)C2)c1Cl ZINC000824471773 587271218 /nfs/dbraw/zinc/27/12/18/587271218.db2.gz HIPXUQJAJNDPEW-LLVKDONJSA-N 1 2 245.729 2.398 20 0 BEADLO Cn1ncc(C[N@H+]2CCC[C@@](C)(F)C2)c1Cl ZINC000824471773 587271220 /nfs/dbraw/zinc/27/12/20/587271220.db2.gz HIPXUQJAJNDPEW-LLVKDONJSA-N 1 2 245.729 2.398 20 0 BEADLO CC(C)CN(C(=O)Cc1[nH]cc[nH+]1)C1CCCC1 ZINC000824567450 587276705 /nfs/dbraw/zinc/27/67/05/587276705.db2.gz TUZFWUUNYNHHRB-UHFFFAOYSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H]1C[C@@H]2C[C@@H]2C[C@H]1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000824629273 587280405 /nfs/dbraw/zinc/28/04/05/587280405.db2.gz RMLOMYPFOFBNKU-PRULPYPASA-N 1 2 247.342 2.050 20 0 BEADLO C[C@@H]1C[C@@H]2C[C@@H]2C[C@H]1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000824629273 587280407 /nfs/dbraw/zinc/28/04/07/587280407.db2.gz RMLOMYPFOFBNKU-PRULPYPASA-N 1 2 247.342 2.050 20 0 BEADLO Cc1ccc(NC(=O)C23CC(C2)C3)c(N(C)C)[nH+]1 ZINC000860344373 589095288 /nfs/dbraw/zinc/09/52/88/589095288.db2.gz NMTVZSLWRGZADK-UHFFFAOYSA-N 1 2 245.326 2.195 20 0 BEADLO C[C@@H](NC(=O)CCC1(C)CC1)c1[nH+]ccn1C ZINC000825545719 587324549 /nfs/dbraw/zinc/32/45/49/587324549.db2.gz XKQWDRLLHLVLED-SNVBAGLBSA-N 1 2 235.331 2.178 20 0 BEADLO O=C(CCCn1cc[nH+]c1)NCCCCC1CC1 ZINC000825680236 587331752 /nfs/dbraw/zinc/33/17/52/587331752.db2.gz GNECUKQNPWBWKG-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO CCC[C@@H]1CCCC[C@@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000825928111 587346061 /nfs/dbraw/zinc/34/60/61/587346061.db2.gz MUQDBYIKUWZOGB-NEPJUHHUSA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@H](C)[C@H](C)N(C(=O)Cc1[nH]cc[nH+]1)C1CC1 ZINC000826564071 587355113 /nfs/dbraw/zinc/35/51/13/587355113.db2.gz ARQYLYMGFXZKPF-QWRGUYRKSA-N 1 2 249.358 2.378 20 0 BEADLO C[N@@H+]1Cc2ccccc2[C@@H]1CNC(=O)C1(C)CC1 ZINC000826708812 587359771 /nfs/dbraw/zinc/35/97/71/587359771.db2.gz FTHFHSCAMRDSBB-ZDUSSCGKSA-N 1 2 244.338 2.089 20 0 BEADLO C[N@H+]1Cc2ccccc2[C@@H]1CNC(=O)C1(C)CC1 ZINC000826708812 587359772 /nfs/dbraw/zinc/35/97/72/587359772.db2.gz FTHFHSCAMRDSBB-ZDUSSCGKSA-N 1 2 244.338 2.089 20 0 BEADLO CCCC[C@](C)(F)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000826834376 587363592 /nfs/dbraw/zinc/36/35/92/587363592.db2.gz QQPNYWCFLNGIJL-LBPRGKRZSA-N 1 2 241.310 2.287 20 0 BEADLO C[C@@H]1CCCC[C@@H]1CCNC(=O)Cc1[nH]cc[nH+]1 ZINC000827787846 587402583 /nfs/dbraw/zinc/40/25/83/587402583.db2.gz PXPJUELKPWAOBX-VXGBXAGGSA-N 1 2 249.358 2.285 20 0 BEADLO Cc1cc(C[NH2+][C@@H](c2ccccc2)[C@@H](C)O)no1 ZINC000827855597 587405705 /nfs/dbraw/zinc/40/57/05/587405705.db2.gz FULOQCQMRJMVLI-BXUZGUMPSA-N 1 2 246.310 2.195 20 0 BEADLO C[C@H](CC1CCC1)NC(=O)/C=C/c1cn(C)c[nH+]1 ZINC000828271487 587429804 /nfs/dbraw/zinc/42/98/04/587429804.db2.gz ZODULWHRXUOGRL-XUIVZRPNSA-N 1 2 247.342 2.128 20 0 BEADLO CC(C)c1cc(N[C@H]2CCn3cc[nH+]c32)ncn1 ZINC000828358538 587438039 /nfs/dbraw/zinc/43/80/39/587438039.db2.gz RPYNZCJLDHASRU-JTQLQIEISA-N 1 2 243.314 2.353 20 0 BEADLO Cc1nc(Cl)cc(N[C@@H]2CCn3cc[nH+]c32)n1 ZINC000828357597 587438223 /nfs/dbraw/zinc/43/82/23/587438223.db2.gz KOSRGEFLLSIMHE-MRVPVSSYSA-N 1 2 249.705 2.192 20 0 BEADLO CCc1cc(C)nc(N[C@@H]2CCn3cc[nH+]c32)n1 ZINC000828359187 587438459 /nfs/dbraw/zinc/43/84/59/587438459.db2.gz YPDPCLGMAKMMGH-LLVKDONJSA-N 1 2 243.314 2.101 20 0 BEADLO CC(C)c1nc(N[C@H]2CCn3ccnc32)cc[nH+]1 ZINC000828359010 587438486 /nfs/dbraw/zinc/43/84/86/587438486.db2.gz XSYUHACURSGXSP-JTQLQIEISA-N 1 2 243.314 2.353 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)N1CCC2(CCCC2)CC1 ZINC000828396782 587440096 /nfs/dbraw/zinc/44/00/96/587440096.db2.gz AILWYAIRRVFWQM-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO Cc1ncccc1C[NH+]1CC(C(F)(F)F)C1 ZINC000828415349 587441190 /nfs/dbraw/zinc/44/11/90/587441190.db2.gz MOFRBCHZGZEATK-UHFFFAOYSA-N 1 2 230.233 2.384 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CC[C@@H]3C[C@@H]32)s1 ZINC000828533819 587448574 /nfs/dbraw/zinc/44/85/74/587448574.db2.gz MZQYWGFGPKKZKT-BDAKNGLRSA-N 1 2 223.345 2.256 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CC[C@@H]3C[C@@H]32)s1 ZINC000828533819 587448575 /nfs/dbraw/zinc/44/85/75/587448575.db2.gz MZQYWGFGPKKZKT-BDAKNGLRSA-N 1 2 223.345 2.256 20 0 BEADLO CC1(C)CCC(NC(=O)Cc2[nH]cc[nH+]2)CC1 ZINC000828606105 587453466 /nfs/dbraw/zinc/45/34/66/587453466.db2.gz BXMIINXXBXOGMX-UHFFFAOYSA-N 1 2 235.331 2.037 20 0 BEADLO CCC(CC)(CC)NC(=O)Cc1[nH]cc[nH+]1 ZINC000828666248 587456590 /nfs/dbraw/zinc/45/65/90/587456590.db2.gz OJWWGHDLPYFRCS-UHFFFAOYSA-N 1 2 223.320 2.037 20 0 BEADLO CCCCC(=O)N1CCc2[nH]c[nH+]c2C12CCC2 ZINC000829099532 587483096 /nfs/dbraw/zinc/48/30/96/587483096.db2.gz LKAQOBFAJOUEAU-UHFFFAOYSA-N 1 2 247.342 2.364 20 0 BEADLO CC(C)=CC(=O)N1CCc2[nH]c[nH+]c2C12CCC2 ZINC000829111256 587483351 /nfs/dbraw/zinc/48/33/51/587483351.db2.gz ODVVGIUANFCTIF-UHFFFAOYSA-N 1 2 245.326 2.140 20 0 BEADLO C[C@@H]1C[C@@H](Nc2cncc(Cl)n2)c2[nH+]ccn21 ZINC000829126840 587483803 /nfs/dbraw/zinc/48/38/03/587483803.db2.gz OHNNGAKDCBLDQU-HTQZYQBOSA-N 1 2 249.705 2.444 20 0 BEADLO CCC[C@@H](C)CCNC(=O)/C=C\c1cn(C)c[nH+]1 ZINC000829165417 587485977 /nfs/dbraw/zinc/48/59/77/587485977.db2.gz QIIBFQWVLCOJMJ-ZHRWSRJISA-N 1 2 249.358 2.376 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)NCCCCC1CCCC1 ZINC000829176650 587486838 /nfs/dbraw/zinc/48/68/38/587486838.db2.gz WNPMXTZJYIDOAK-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO C[C@@H]1c2ccccc2CN1C(=O)Cc1[nH]cc[nH+]1 ZINC000829476601 587499732 /nfs/dbraw/zinc/49/97/32/587499732.db2.gz HJAJGQZGPIZWFK-SNVBAGLBSA-N 1 2 241.294 2.056 20 0 BEADLO CCCC[C@H](CCC)NC(=O)Cc1[nH]cc[nH+]1 ZINC000829678454 587508887 /nfs/dbraw/zinc/50/88/87/587508887.db2.gz IZUVQZGJVFUZNM-NSHDSACASA-N 1 2 237.347 2.427 20 0 BEADLO C[C@]1([NH2+]CC/C=C\c2ccccc2)CCOC1=O ZINC000829962589 587530439 /nfs/dbraw/zinc/53/04/39/587530439.db2.gz LGLIVTVOPKRRAU-ZHMISCPASA-N 1 2 245.322 2.385 20 0 BEADLO CCCOC(=O)[C@H](C)[N@@H+]1CCC[C@](C)(F)C1 ZINC000830212699 587541131 /nfs/dbraw/zinc/54/11/31/587541131.db2.gz TZWQDSSHLONTIA-JQWIXIFHSA-N 1 2 231.311 2.152 20 0 BEADLO CCCOC(=O)[C@H](C)[N@H+]1CCC[C@](C)(F)C1 ZINC000830212699 587541132 /nfs/dbraw/zinc/54/11/32/587541132.db2.gz TZWQDSSHLONTIA-JQWIXIFHSA-N 1 2 231.311 2.152 20 0 BEADLO O[C@H](C[N@@H+]1CC[C@H](F)C1)c1ccc(F)c(F)c1 ZINC000830467364 587552293 /nfs/dbraw/zinc/55/22/93/587552293.db2.gz KIAQXVVULFAHQW-JOYOIKCWSA-N 1 2 245.244 2.042 20 0 BEADLO O[C@H](C[N@H+]1CC[C@H](F)C1)c1ccc(F)c(F)c1 ZINC000830467364 587552295 /nfs/dbraw/zinc/55/22/95/587552295.db2.gz KIAQXVVULFAHQW-JOYOIKCWSA-N 1 2 245.244 2.042 20 0 BEADLO C[N@H+](C/C(Cl)=C/Cl)CC(C)(C)CO ZINC000830703576 587564301 /nfs/dbraw/zinc/56/43/01/587564301.db2.gz FDSUBFJHBIFHQD-YWEYNIOJSA-N 1 2 226.147 2.256 20 0 BEADLO C[N@@H+](C/C(Cl)=C/Cl)CC(C)(C)CO ZINC000830703576 587564302 /nfs/dbraw/zinc/56/43/02/587564302.db2.gz FDSUBFJHBIFHQD-YWEYNIOJSA-N 1 2 226.147 2.256 20 0 BEADLO Nc1cc(COC(=O)/C=C\C2CCCC2)cc[nH+]1 ZINC000830788567 587570242 /nfs/dbraw/zinc/57/02/42/587570242.db2.gz REBFLQJUGPFLIT-WAYWQWQTSA-N 1 2 246.310 2.453 20 0 BEADLO Cc1ccc(COC(=O)[C@H]2CCC(=O)C2)c(C)[nH+]1 ZINC000830896675 587576108 /nfs/dbraw/zinc/57/61/08/587576108.db2.gz KFRYZHVOJCLOEI-NSHDSACASA-N 1 2 247.294 2.111 20 0 BEADLO CC(C)C1(C)CCN(C(=O)Cc2[nH]cc[nH+]2)CC1 ZINC000832517024 587664591 /nfs/dbraw/zinc/66/45/91/587664591.db2.gz BVNRRSUTZQKMNG-UHFFFAOYSA-N 1 2 249.358 2.237 20 0 BEADLO CC(C)C(C)(C)C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833278189 587703283 /nfs/dbraw/zinc/70/32/83/587703283.db2.gz OVYZKRDMNZJBMA-SNVBAGLBSA-N 1 2 235.331 2.126 20 0 BEADLO CC(C)C[C@H](C)C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833278037 587703306 /nfs/dbraw/zinc/70/33/06/587703306.db2.gz LZTZEPKSCASIME-WDEREUQCSA-N 1 2 235.331 2.126 20 0 BEADLO CCC(C)(CC)C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833279025 587703627 /nfs/dbraw/zinc/70/36/27/587703627.db2.gz XMQYMEUDKQUYSG-SNVBAGLBSA-N 1 2 235.331 2.270 20 0 BEADLO CCCC[C@@H](C)C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833273087 587703836 /nfs/dbraw/zinc/70/38/36/587703836.db2.gz XLFIMOIKQYBVIM-MNOVXSKESA-N 1 2 235.331 2.270 20 0 BEADLO CC(C)(CC(=O)N[C@@H]1CCn2cc[nH+]c21)C1CC1 ZINC000833270862 587703920 /nfs/dbraw/zinc/70/39/20/587703920.db2.gz BQNIPVKPWXSOPG-LLVKDONJSA-N 1 2 247.342 2.270 20 0 BEADLO O=C(N[C@@H]1CCn2cc[nH+]c21)[C@H]1CC12CCCC2 ZINC000833284488 587704438 /nfs/dbraw/zinc/70/44/38/587704438.db2.gz JKMRQYRIZIKBFE-GHMZBOCLSA-N 1 2 245.326 2.024 20 0 BEADLO C[C@@H]1CC[C@H](CC(=O)N[C@@H]2CCn3cc[nH+]c32)C1 ZINC000833283216 587704479 /nfs/dbraw/zinc/70/44/79/587704479.db2.gz ASOXLRSIBUSKEP-GRYCIOLGSA-N 1 2 247.342 2.270 20 0 BEADLO O=C(N[C@H]1CCn2cc[nH+]c21)C(F)=C1CCCC1 ZINC000833286460 587704517 /nfs/dbraw/zinc/70/45/17/587704517.db2.gz XOTQHPPLBQVLML-JTQLQIEISA-N 1 2 249.289 2.242 20 0 BEADLO Cc1ccc(C(=O)N[C@H]2CCn3cc[nH+]c32)s1 ZINC000833305146 587705140 /nfs/dbraw/zinc/70/51/40/587705140.db2.gz KOXPYIGSVPXZLT-VIFPVBQESA-N 1 2 247.323 2.128 20 0 BEADLO Cc1cccc(C(=O)N[C@@H]2CCn3cc[nH+]c32)c1 ZINC000833303940 587705346 /nfs/dbraw/zinc/70/53/46/587705346.db2.gz CEEGYZGMRHMIQV-GFCCVEGCSA-N 1 2 241.294 2.066 20 0 BEADLO Cc1cccc(C(=O)N[C@H]2CCn3cc[nH+]c32)c1 ZINC000833303942 587705473 /nfs/dbraw/zinc/70/54/73/587705473.db2.gz CEEGYZGMRHMIQV-LBPRGKRZSA-N 1 2 241.294 2.066 20 0 BEADLO C[C@@H](C1CCCCC1)N(C)C(=O)Cc1[nH]cc[nH+]1 ZINC000834638488 587762414 /nfs/dbraw/zinc/76/24/14/587762414.db2.gz WAZSKUODYPQERK-NSHDSACASA-N 1 2 249.358 2.379 20 0 BEADLO CCCC[NH2+]c1ccc(O[C@@H]2CC(=O)N2)cc1 ZINC000834664311 587763268 /nfs/dbraw/zinc/76/32/68/587763268.db2.gz ONYKIUBHSZRHMM-CYBMUJFWSA-N 1 2 234.299 2.123 20 0 BEADLO CCCC[NH2+]c1ccc(O[C@H]2CC(=O)N2)cc1 ZINC000834664312 587763354 /nfs/dbraw/zinc/76/33/54/587763354.db2.gz ONYKIUBHSZRHMM-ZDUSSCGKSA-N 1 2 234.299 2.123 20 0 BEADLO c1cn2c([nH+]1)[C@H](Nc1cccc3c1OCO3)CC2 ZINC000834759382 587766017 /nfs/dbraw/zinc/76/60/17/587766017.db2.gz BDBCUZGTCUZEFL-SNVBAGLBSA-N 1 2 243.266 2.169 20 0 BEADLO Cn1c[nH+]cc1COC(=O)C(C)(C)C(C)(F)F ZINC000835194610 587788276 /nfs/dbraw/zinc/78/82/76/587788276.db2.gz TZMXHYHLHLWDAJ-UHFFFAOYSA-N 1 2 246.257 2.145 20 0 BEADLO C/C=C(/C=C\C(=O)OCCc1c[nH+]cn1C)CC ZINC000837580157 587883744 /nfs/dbraw/zinc/88/37/44/587883744.db2.gz APABKFXLODIFDF-WLWVQNKQSA-N 1 2 248.326 2.418 20 0 BEADLO CC/C(C)=C(\C)C(=O)OCCc1c[nH+]cn1C ZINC000837621318 587886004 /nfs/dbraw/zinc/88/60/04/587886004.db2.gz KGBAYINLKYVXFA-ZHACJKMWSA-N 1 2 236.315 2.252 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ccc(C)nn2)nc1 ZINC000840942032 587931180 /nfs/dbraw/zinc/93/11/80/587931180.db2.gz PYPVOHDAXRJOKT-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ccc(C)nn2)nc1 ZINC000840942032 587931181 /nfs/dbraw/zinc/93/11/81/587931181.db2.gz PYPVOHDAXRJOKT-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1occc1C[N@@H+]1CCO[C@@H](C(F)F)C1 ZINC000840942831 587931185 /nfs/dbraw/zinc/93/11/85/587931185.db2.gz HAIMAQHMOFLHOZ-SNVBAGLBSA-N 1 2 231.242 2.054 20 0 BEADLO Cc1occc1C[N@H+]1CCO[C@@H](C(F)F)C1 ZINC000840942831 587931186 /nfs/dbraw/zinc/93/11/86/587931186.db2.gz HAIMAQHMOFLHOZ-SNVBAGLBSA-N 1 2 231.242 2.054 20 0 BEADLO COc1ccc([NH2+]C[C@@H]2C[C@H]2C)cc1N ZINC000841040386 587938269 /nfs/dbraw/zinc/93/82/69/587938269.db2.gz LPTVVUMIZXIFIA-BDAKNGLRSA-N 1 2 206.289 2.345 20 0 BEADLO CCn1cc[nH+]c1CNc1ccc(OC)c(N)c1 ZINC000841039955 587938532 /nfs/dbraw/zinc/93/85/32/587938532.db2.gz FKJLPEPXHXZJMO-UHFFFAOYSA-N 1 2 246.314 2.106 20 0 BEADLO C[C@@H](C[NH3+])[NH2+]Cc1ccc(SC(F)F)cc1 ZINC000841063551 587941379 /nfs/dbraw/zinc/94/13/79/587941379.db2.gz MXCZUJXNQHTNKA-QMMMGPOBSA-N 1 2 246.326 2.438 20 0 BEADLO CCn1c[nH+]cc1CN(C)Cc1c(C)noc1C ZINC000841833779 587976828 /nfs/dbraw/zinc/97/68/28/587976828.db2.gz ZPCVSHBDJKPRKW-UHFFFAOYSA-N 1 2 248.330 2.140 20 0 BEADLO COC1(CCO[NH+]=C(N)c2ccccc2)CCC1 ZINC000842013404 587989120 /nfs/dbraw/zinc/98/91/20/587989120.db2.gz MEELTCBJPQRZCJ-UHFFFAOYSA-N 1 2 248.326 2.492 20 0 BEADLO COC1(CO[NH+]=C(N)Cc2ccccc2)CCC1 ZINC000842021365 587989525 /nfs/dbraw/zinc/98/95/25/587989525.db2.gz HCYYNUGTVCGLOZ-UHFFFAOYSA-N 1 2 248.326 2.297 20 0 BEADLO NC(=[NH+]OC[C@@H]1CCC(F)(F)C1)[C@H]1CCCO1 ZINC000842046282 587992391 /nfs/dbraw/zinc/99/23/91/587992391.db2.gz BBCQNNCBMNNPGY-RKDXNWHRSA-N 1 2 248.273 2.099 20 0 BEADLO COCCCC[N@H+](C)CC(F)(F)C(F)F ZINC000842173665 588006121 /nfs/dbraw/zinc/00/61/21/588006121.db2.gz RRNHESXDITZSBY-UHFFFAOYSA-N 1 2 231.233 2.245 20 0 BEADLO COCCCC[N@@H+](C)CC(F)(F)C(F)F ZINC000842173665 588006123 /nfs/dbraw/zinc/00/61/23/588006123.db2.gz RRNHESXDITZSBY-UHFFFAOYSA-N 1 2 231.233 2.245 20 0 BEADLO CCCCC(=O)OCC1CN(c2cccc[nH+]2)C1 ZINC000842891591 588071040 /nfs/dbraw/zinc/07/10/40/588071040.db2.gz YDIJEDRHQPCPRH-UHFFFAOYSA-N 1 2 248.326 2.251 20 0 BEADLO C/C=C(/C)C(=O)OCC1CN(c2cccc[nH+]2)C1 ZINC000842889306 588071116 /nfs/dbraw/zinc/07/11/16/588071116.db2.gz YKLCHDSDHYDGNO-JYOAFUTRSA-N 1 2 246.310 2.027 20 0 BEADLO CCCC1(c2nc(C[NH2+]CC)no2)CCC1 ZINC000843144625 588083226 /nfs/dbraw/zinc/08/32/26/588083226.db2.gz FBJHFSVFKNFMBV-UHFFFAOYSA-N 1 2 223.320 2.401 20 0 BEADLO CC[NH2+]Cc1noc(/C=C\c2ccc(C)nc2)n1 ZINC000843140774 588086207 /nfs/dbraw/zinc/08/62/07/588086207.db2.gz DCWCIVGZQCSTJY-SREVYHEPSA-N 1 2 244.298 2.053 20 0 BEADLO CC[NH2+]Cc1noc([C@H](C)OCCC(C)C)n1 ZINC000843145461 588086537 /nfs/dbraw/zinc/08/65/37/588086537.db2.gz MOCGYJQNWUUXGP-JTQLQIEISA-N 1 2 241.335 2.303 20 0 BEADLO CCCCO[C@H](C)c1nc(C[NH2+]CC)no1 ZINC000843145306 588086767 /nfs/dbraw/zinc/08/67/67/588086767.db2.gz IWBJXMAYLVOLFY-SECBINFHSA-N 1 2 227.308 2.057 20 0 BEADLO Cc1cc(-c2ccc3c(c2)C[C@H](CO)O3)cc[nH+]1 ZINC000844232916 588175817 /nfs/dbraw/zinc/17/58/17/588175817.db2.gz VTQMLKSKGADATD-CQSZACIVSA-N 1 2 241.290 2.353 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)OC(C)(C)C)[N@@H+]1CCF ZINC000844364764 588187941 /nfs/dbraw/zinc/18/79/41/588187941.db2.gz VOZSIRIEFUCLAF-NXEZZACHSA-N 1 2 231.311 2.151 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)OC(C)(C)C)[N@H+]1CCF ZINC000844364764 588187943 /nfs/dbraw/zinc/18/79/43/588187943.db2.gz VOZSIRIEFUCLAF-NXEZZACHSA-N 1 2 231.311 2.151 20 0 BEADLO FC1(F)C[C@@]12CCC[N@H+](Cc1ncccn1)C2 ZINC000844438805 588193719 /nfs/dbraw/zinc/19/37/19/588193719.db2.gz FNFYJZOVMKGMKO-LLVKDONJSA-N 1 2 239.269 2.098 20 0 BEADLO FC1(F)C[C@@]12CCC[N@@H+](Cc1ncccn1)C2 ZINC000844438805 588193721 /nfs/dbraw/zinc/19/37/21/588193721.db2.gz FNFYJZOVMKGMKO-LLVKDONJSA-N 1 2 239.269 2.098 20 0 BEADLO CC(C)n1ccc(C[N@@H+]2C[C@H]3[C@@H](C2)C3(F)F)n1 ZINC000844448484 588194720 /nfs/dbraw/zinc/19/47/20/588194720.db2.gz AYDHMPXITUBCQU-PHIMTYICSA-N 1 2 241.285 2.161 20 0 BEADLO CC(C)n1ccc(C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)n1 ZINC000844448484 588194722 /nfs/dbraw/zinc/19/47/22/588194722.db2.gz AYDHMPXITUBCQU-PHIMTYICSA-N 1 2 241.285 2.161 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H]3[C@@H](C2)C3(F)F)cs1 ZINC000844455510 588196179 /nfs/dbraw/zinc/19/61/79/588196179.db2.gz VIBBJEZVPRHIAT-DTORHVGOSA-N 1 2 230.283 2.148 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)cs1 ZINC000844455510 588196180 /nfs/dbraw/zinc/19/61/80/588196180.db2.gz VIBBJEZVPRHIAT-DTORHVGOSA-N 1 2 230.283 2.148 20 0 BEADLO C[C@H](CC(=O)O[C@H]1C=CCCC1)n1cc[nH+]c1 ZINC000845282335 588225343 /nfs/dbraw/zinc/22/53/43/588225343.db2.gz NZHIKTJMVSFOIK-NEPJUHHUSA-N 1 2 234.299 2.486 20 0 BEADLO C[C@@H](CC(=O)OCCCCF)n1cc[nH+]c1 ZINC000845286163 588225864 /nfs/dbraw/zinc/22/58/64/588225864.db2.gz WBNVJTOQLJTATN-JTQLQIEISA-N 1 2 228.267 2.127 20 0 BEADLO CCCC(C)(C)C(=O)O[C@H]1CC[N@H+](CCF)C1 ZINC000845544079 588232625 /nfs/dbraw/zinc/23/26/25/588232625.db2.gz NPPLFABAPSEWCR-NSHDSACASA-N 1 2 245.338 2.400 20 0 BEADLO CCCC(C)(C)C(=O)O[C@H]1CC[N@@H+](CCF)C1 ZINC000845544079 588232626 /nfs/dbraw/zinc/23/26/26/588232626.db2.gz NPPLFABAPSEWCR-NSHDSACASA-N 1 2 245.338 2.400 20 0 BEADLO CS[C@@H](C)COC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000845585583 588234124 /nfs/dbraw/zinc/23/41/24/588234124.db2.gz GIKQTUNGOYOHDE-UWVGGRQHSA-N 1 2 242.344 2.129 20 0 BEADLO Cc1cc(N2CCC[C@]3(CC3(F)F)C2)nc[nH+]1 ZINC000845741493 588243416 /nfs/dbraw/zinc/24/34/16/588243416.db2.gz GBAOVRMWEFNPTK-NSHDSACASA-N 1 2 239.269 2.411 20 0 BEADLO COc1cc(F)c(C[N@H+](C)CCF)cc1OC ZINC000845976968 588252421 /nfs/dbraw/zinc/25/24/21/588252421.db2.gz NINSQBHBQZOWLV-UHFFFAOYSA-N 1 2 245.269 2.244 20 0 BEADLO COc1cc(F)c(C[N@@H+](C)CCF)cc1OC ZINC000845976968 588252422 /nfs/dbraw/zinc/25/24/22/588252422.db2.gz NINSQBHBQZOWLV-UHFFFAOYSA-N 1 2 245.269 2.244 20 0 BEADLO CCCC[C@H]1CCC[C@H]1[NH2+]CC(=O)NOCC ZINC000846090499 588256377 /nfs/dbraw/zinc/25/63/77/588256377.db2.gz BMTSMTKAYWGHEU-NWDGAFQWSA-N 1 2 242.363 2.003 20 0 BEADLO C[C@@H](COCC1CC1)[NH2+][C@H]1CCCc2[nH]ncc21 ZINC000846204120 588260160 /nfs/dbraw/zinc/26/01/60/588260160.db2.gz DQEAKWBAIGAXEO-GWCFXTLKSA-N 1 2 249.358 2.192 20 0 BEADLO CCON(C(=O)C[C@H](C)n1cc[nH+]c1)C(C)C ZINC000846276980 588263782 /nfs/dbraw/zinc/26/37/82/588263782.db2.gz CDVPPZKPMXJPTJ-NSHDSACASA-N 1 2 239.319 2.023 20 0 BEADLO CC[C@@H](C)N(OC)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000846637634 588280428 /nfs/dbraw/zinc/28/04/28/588280428.db2.gz CYZAIVAHZKYRRQ-GHMZBOCLSA-N 1 2 239.319 2.023 20 0 BEADLO C[C@H]1Cc2cc(NCc3[nH+]ccn3C)ccc2O1 ZINC000846747183 588284278 /nfs/dbraw/zinc/28/42/78/588284278.db2.gz BMLJEDQSDYAZSZ-JTQLQIEISA-N 1 2 243.310 2.356 20 0 BEADLO CCc1nnc(CNc2c[nH+]ccc2C)s1 ZINC000846749378 588284790 /nfs/dbraw/zinc/28/47/90/588284790.db2.gz IGJLKNIJIFFZQE-UHFFFAOYSA-N 1 2 234.328 2.416 20 0 BEADLO CC[C@H]1C[N@H+](CC2(Br)CC2)CCO1 ZINC000846769291 588286804 /nfs/dbraw/zinc/28/68/04/588286804.db2.gz IRLCNOJETCHBPW-VIFPVBQESA-N 1 2 248.164 2.025 20 0 BEADLO CC[C@H]1C[N@@H+](CC2(Br)CC2)CCO1 ZINC000846769291 588286805 /nfs/dbraw/zinc/28/68/05/588286805.db2.gz IRLCNOJETCHBPW-VIFPVBQESA-N 1 2 248.164 2.025 20 0 BEADLO C[C@@H]1CCC[N@H+](Cc2cnsn2)[C@H]1C ZINC000846806956 588289927 /nfs/dbraw/zinc/28/99/27/588289927.db2.gz RTJKHMWEPOZLDB-BDAKNGLRSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]1CCC[N@@H+](Cc2cnsn2)[C@H]1C ZINC000846806956 588289928 /nfs/dbraw/zinc/28/99/28/588289928.db2.gz RTJKHMWEPOZLDB-BDAKNGLRSA-N 1 2 211.334 2.159 20 0 BEADLO CS[C@H]1CCCC[N@H+](Cc2cnsn2)C1 ZINC000846830971 588291490 /nfs/dbraw/zinc/29/14/90/588291490.db2.gz FXGTWXMNCGEBKS-JTQLQIEISA-N 1 2 243.401 2.256 20 0 BEADLO CS[C@H]1CCCC[N@@H+](Cc2cnsn2)C1 ZINC000846830971 588291491 /nfs/dbraw/zinc/29/14/91/588291491.db2.gz FXGTWXMNCGEBKS-JTQLQIEISA-N 1 2 243.401 2.256 20 0 BEADLO C[C@H]1CC[N@H+](Cc2cnsn2)C[C@H]1C ZINC000846841468 588292802 /nfs/dbraw/zinc/29/28/02/588292802.db2.gz OEVYOQSYDYFSKQ-DTWKUNHWSA-N 1 2 211.334 2.016 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2cnsn2)C[C@H]1C ZINC000846841468 588292803 /nfs/dbraw/zinc/29/28/03/588292803.db2.gz OEVYOQSYDYFSKQ-DTWKUNHWSA-N 1 2 211.334 2.016 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cnsn2)CC1(C)C ZINC000846856721 588293854 /nfs/dbraw/zinc/29/38/54/588293854.db2.gz SAPUNRCJCZZERR-SECBINFHSA-N 1 2 225.361 2.406 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cnsn2)CC1(C)C ZINC000846856721 588293855 /nfs/dbraw/zinc/29/38/55/588293855.db2.gz SAPUNRCJCZZERR-SECBINFHSA-N 1 2 225.361 2.406 20 0 BEADLO CC1(NC(=O)c2cccc3[nH+]ccn32)CC=CC1 ZINC000847162001 588308011 /nfs/dbraw/zinc/30/80/11/588308011.db2.gz SOFRKELNDFELID-UHFFFAOYSA-N 1 2 241.294 2.173 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1ccnc(F)c1 ZINC000107038573 588323606 /nfs/dbraw/zinc/32/36/06/588323606.db2.gz OATKZYLVMNFGKV-UHFFFAOYSA-N 1 2 231.230 2.176 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OCCC(C)(C)C1CC1 ZINC000848510886 588388509 /nfs/dbraw/zinc/38/85/09/588388509.db2.gz XNYMHGJZCWXCRA-VIFPVBQESA-N 1 2 228.336 2.346 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1CC[C@@H](C)C1 ZINC000848686310 588405384 /nfs/dbraw/zinc/40/53/84/588405384.db2.gz BJJQEYQUQDHTFB-PSASIEDQSA-N 1 2 221.304 2.394 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@H]1CCC1(C)C ZINC000848704946 588406826 /nfs/dbraw/zinc/40/68/26/588406826.db2.gz BZNFQNGACVCFQP-VIFPVBQESA-N 1 2 221.304 2.394 20 0 BEADLO Cc1ccc(NC(=S)NCC2CC2)c(C)[nH+]1 ZINC000849259773 588466210 /nfs/dbraw/zinc/46/62/10/588466210.db2.gz NJPPXJQYMGQISX-UHFFFAOYSA-N 1 2 235.356 2.395 20 0 BEADLO CC1(C)CC[C@H]1C(=O)OCCCn1cc[nH+]c1 ZINC000850071191 588518156 /nfs/dbraw/zinc/51/81/56/588518156.db2.gz OJSHHZBPMBREMC-NSHDSACASA-N 1 2 236.315 2.253 20 0 BEADLO Cc1nocc1C[NH2+]Cc1cccnc1Cl ZINC000850351429 588538246 /nfs/dbraw/zinc/53/82/46/588538246.db2.gz CBRBXTRRIYRKLX-UHFFFAOYSA-N 1 2 237.690 2.321 20 0 BEADLO Cn1c[nH+]c(CNc2ccc3c(c2)CCOC3)c1 ZINC000850382383 588542473 /nfs/dbraw/zinc/54/24/73/588542473.db2.gz UXPFEZUDMNIVIP-UHFFFAOYSA-N 1 2 243.310 2.105 20 0 BEADLO c1c[nH]c([C@@H]([NH2+][C@@H]2C=CCC2)c2cccnc2)n1 ZINC000850510896 588555206 /nfs/dbraw/zinc/55/52/06/588555206.db2.gz XEZOMNMLGSRNMU-OLZOCXBDSA-N 1 2 240.310 2.202 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@H]1CCCC2(CC2)C1 ZINC000850869538 588572208 /nfs/dbraw/zinc/57/22/08/588572208.db2.gz XHBPJQCSNCBNHR-NSHDSACASA-N 1 2 248.326 2.434 20 0 BEADLO C[C@@H](CC(=O)OC[C@@H]1C[C@H]2C[C@H]2C1)n1cc[nH+]c1 ZINC000851218574 588597189 /nfs/dbraw/zinc/59/71/89/588597189.db2.gz XYUXRBRMPYCRRT-RVMXOQNASA-N 1 2 248.326 2.424 20 0 BEADLO Cc1cc([C@@H]2CCCN2Cc2cn(C)c[nH+]2)no1 ZINC000851715992 588616375 /nfs/dbraw/zinc/61/63/75/588616375.db2.gz GNGSTHXDJPINBX-ZDUSSCGKSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc([C@H]2CCC[N@@H+]2CCOC(F)F)no1 ZINC000851715845 588616489 /nfs/dbraw/zinc/61/64/89/588616489.db2.gz CNUAJDMTAJBMGO-SNVBAGLBSA-N 1 2 246.257 2.359 20 0 BEADLO Cc1cc([C@H]2CCC[N@H+]2CCOC(F)F)no1 ZINC000851715845 588616490 /nfs/dbraw/zinc/61/64/90/588616490.db2.gz CNUAJDMTAJBMGO-SNVBAGLBSA-N 1 2 246.257 2.359 20 0 BEADLO CCc1ccc(C[N@H+](C)Cc2cnon2)cc1 ZINC000851718582 588616760 /nfs/dbraw/zinc/61/67/60/588616760.db2.gz LSJRBLYJWXVWJL-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1ccc(C[N@@H+](C)Cc2cnon2)cc1 ZINC000851718582 588616761 /nfs/dbraw/zinc/61/67/61/588616761.db2.gz LSJRBLYJWXVWJL-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1cccc(F)n1 ZINC000851729246 588618867 /nfs/dbraw/zinc/61/88/67/588618867.db2.gz IXIITCKJMJUTOD-ZYHUDNBSSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1cccc(F)n1 ZINC000851729246 588618868 /nfs/dbraw/zinc/61/88/68/588618868.db2.gz IXIITCKJMJUTOD-ZYHUDNBSSA-N 1 2 238.306 2.220 20 0 BEADLO c1nonc1C[NH2+]C1(c2ccccc2)CCC1 ZINC000851820956 588633593 /nfs/dbraw/zinc/63/35/93/588633593.db2.gz KYFBIKPQNZNOTQ-UHFFFAOYSA-N 1 2 229.283 2.239 20 0 BEADLO CC(C)(C)C1=CC[N@H+](Cc2cnon2)CC1 ZINC000851870045 588637189 /nfs/dbraw/zinc/63/71/89/588637189.db2.gz YSNQWGVBTSAENP-UHFFFAOYSA-N 1 2 221.304 2.248 20 0 BEADLO CC(C)(C)C1=CC[N@@H+](Cc2cnon2)CC1 ZINC000851870045 588637190 /nfs/dbraw/zinc/63/71/90/588637190.db2.gz YSNQWGVBTSAENP-UHFFFAOYSA-N 1 2 221.304 2.248 20 0 BEADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1cnon1 ZINC000851878588 588638944 /nfs/dbraw/zinc/63/89/44/588638944.db2.gz OPLJGFVJVGHMMK-GFCCVEGCSA-N 1 2 232.287 2.048 20 0 BEADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1cnon1 ZINC000851878588 588638945 /nfs/dbraw/zinc/63/89/45/588638945.db2.gz OPLJGFVJVGHMMK-GFCCVEGCSA-N 1 2 232.287 2.048 20 0 BEADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1cnon1 ZINC000851893503 588641259 /nfs/dbraw/zinc/64/12/59/588641259.db2.gz LBJWCRGTVOJHEX-JTQLQIEISA-N 1 2 247.298 2.237 20 0 BEADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1cnon1 ZINC000851912628 588643104 /nfs/dbraw/zinc/64/31/04/588643104.db2.gz OCIRFAXYFLCASR-JGVFFNPUSA-N 1 2 249.236 2.232 20 0 BEADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1cnon1 ZINC000851912628 588643105 /nfs/dbraw/zinc/64/31/05/588643105.db2.gz OCIRFAXYFLCASR-JGVFFNPUSA-N 1 2 249.236 2.232 20 0 BEADLO Cc1cn2c(n1)C[N@@H+](CC=C(Cl)Cl)CC2 ZINC000851919882 588643659 /nfs/dbraw/zinc/64/36/59/588643659.db2.gz QAFKWRHVAORDAL-UHFFFAOYSA-N 1 2 246.141 2.326 20 0 BEADLO Cc1cn2c(n1)C[N@H+](CC=C(Cl)Cl)CC2 ZINC000851919882 588643660 /nfs/dbraw/zinc/64/36/60/588643660.db2.gz QAFKWRHVAORDAL-UHFFFAOYSA-N 1 2 246.141 2.326 20 0 BEADLO C[C@H]1C[C@H](c2cccnc2)[N@H+](Cc2cnon2)C1 ZINC000851934195 588645422 /nfs/dbraw/zinc/64/54/22/588645422.db2.gz GCTBLZZCMBRUFZ-GXFFZTMASA-N 1 2 244.298 2.048 20 0 BEADLO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2cnon2)C1 ZINC000851934195 588645423 /nfs/dbraw/zinc/64/54/23/588645423.db2.gz GCTBLZZCMBRUFZ-GXFFZTMASA-N 1 2 244.298 2.048 20 0 BEADLO c1nn[nH]c1CC[N@@H+]1CCCC2(CCCC2)C1 ZINC000851968688 588649308 /nfs/dbraw/zinc/64/93/08/588649308.db2.gz PNKVQKPCBCNYPR-UHFFFAOYSA-N 1 2 234.347 2.003 20 0 BEADLO c1nn[nH]c1CC[N@H+]1CCCC2(CCCC2)C1 ZINC000851968688 588649309 /nfs/dbraw/zinc/64/93/09/588649309.db2.gz PNKVQKPCBCNYPR-UHFFFAOYSA-N 1 2 234.347 2.003 20 0 BEADLO Fc1cccc(C[N@@H+]2CCC[C@H]2c2cc[nH]n2)n1 ZINC000851995688 588653486 /nfs/dbraw/zinc/65/34/86/588653486.db2.gz WAEVMLHDCDAADR-LBPRGKRZSA-N 1 2 246.289 2.281 20 0 BEADLO Fc1cccc(C[N@H+]2CCC[C@H]2c2cc[nH]n2)n1 ZINC000851995688 588653487 /nfs/dbraw/zinc/65/34/87/588653487.db2.gz WAEVMLHDCDAADR-LBPRGKRZSA-N 1 2 246.289 2.281 20 0 BEADLO FC(F)OCC[N@@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000852040141 588656951 /nfs/dbraw/zinc/65/69/51/588656951.db2.gz RDLLKIVQAFXUPF-SNVBAGLBSA-N 1 2 245.273 2.176 20 0 BEADLO FC(F)OCC[N@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000852040141 588656952 /nfs/dbraw/zinc/65/69/52/588656952.db2.gz RDLLKIVQAFXUPF-SNVBAGLBSA-N 1 2 245.273 2.176 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2cnon2)c1C ZINC000852074315 588658943 /nfs/dbraw/zinc/65/89/43/588658943.db2.gz CUIFHRSJEYSBEN-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2cnon2)c1C ZINC000852074315 588658944 /nfs/dbraw/zinc/65/89/44/588658944.db2.gz CUIFHRSJEYSBEN-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cc(=O)[nH]c(C(C)(C)[NH2+]C/C=C\Cl)n1 ZINC000852147395 588667364 /nfs/dbraw/zinc/66/73/64/588667364.db2.gz QGGJNIAGJOOUJX-PLNGDYQASA-N 1 2 241.722 2.068 20 0 BEADLO c1coc(C2CC[NH+](Cc3cnon3)CC2)c1 ZINC000852321421 588678248 /nfs/dbraw/zinc/67/82/48/588678248.db2.gz NJTDGJFGWSWOLR-UHFFFAOYSA-N 1 2 233.271 2.042 20 0 BEADLO Cc1cc(C)c(CNC(=O)N[C@@H]2C=CCC2)c[nH+]1 ZINC000852374171 588680417 /nfs/dbraw/zinc/68/04/17/588680417.db2.gz KQTMNRBGPQXGKN-CYBMUJFWSA-N 1 2 245.326 2.216 20 0 BEADLO COCC[N@H+](CCF)Cc1csc(C)c1 ZINC000852479305 588683356 /nfs/dbraw/zinc/68/33/56/588683356.db2.gz BXUWWKCVVJZCON-UHFFFAOYSA-N 1 2 231.336 2.474 20 0 BEADLO COCC[N@@H+](CCF)Cc1csc(C)c1 ZINC000852479305 588683357 /nfs/dbraw/zinc/68/33/57/588683357.db2.gz BXUWWKCVVJZCON-UHFFFAOYSA-N 1 2 231.336 2.474 20 0 BEADLO COCC[N@H+](CCF)Cc1sc(C)nc1C ZINC000852483768 588684475 /nfs/dbraw/zinc/68/44/75/588684475.db2.gz RCLZCVLHPBSFKJ-UHFFFAOYSA-N 1 2 246.351 2.178 20 0 BEADLO COCC[N@@H+](CCF)Cc1sc(C)nc1C ZINC000852483768 588684476 /nfs/dbraw/zinc/68/44/76/588684476.db2.gz RCLZCVLHPBSFKJ-UHFFFAOYSA-N 1 2 246.351 2.178 20 0 BEADLO COCC[N@H+](CCF)Cc1cccc(F)c1F ZINC000852484937 588684882 /nfs/dbraw/zinc/68/48/82/588684882.db2.gz OHFBPUQKYDGAMT-UHFFFAOYSA-N 1 2 247.260 2.383 20 0 BEADLO COCC[N@@H+](CCF)Cc1cccc(F)c1F ZINC000852484937 588684883 /nfs/dbraw/zinc/68/48/83/588684883.db2.gz OHFBPUQKYDGAMT-UHFFFAOYSA-N 1 2 247.260 2.383 20 0 BEADLO Cl/C=C(/Cl)C[N@@H+]1CCC2(COC2)C1 ZINC000852683377 588695682 /nfs/dbraw/zinc/69/56/82/588695682.db2.gz JKXVFQKXNFBJFV-FPYGCLRLSA-N 1 2 222.115 2.028 20 0 BEADLO Cl/C=C(/Cl)C[N@H+]1CCC2(COC2)C1 ZINC000852683377 588695683 /nfs/dbraw/zinc/69/56/83/588695683.db2.gz JKXVFQKXNFBJFV-FPYGCLRLSA-N 1 2 222.115 2.028 20 0 BEADLO C[C@@H]1C[N@H+](C/C=C/Cl)C[C@@](C)(C(F)F)O1 ZINC000852781002 588702269 /nfs/dbraw/zinc/70/22/69/588702269.db2.gz QLIZFYUTNJBSMQ-ZFZAZDQESA-N 1 2 239.693 2.483 20 0 BEADLO C[C@@H]1C[N@@H+](C/C=C/Cl)C[C@@](C)(C(F)F)O1 ZINC000852781002 588702270 /nfs/dbraw/zinc/70/22/70/588702270.db2.gz QLIZFYUTNJBSMQ-ZFZAZDQESA-N 1 2 239.693 2.483 20 0 BEADLO C[C@@H](CC(=O)OCC(C)(F)F)n1cc[nH+]c1 ZINC000861219342 589151348 /nfs/dbraw/zinc/15/13/48/589151348.db2.gz ALGWZJAMYRAARF-QMMMGPOBSA-N 1 2 232.230 2.033 20 0 BEADLO O=C(/C=C\C1CCCC1)N1CCc2[nH]c[nH+]c2C1 ZINC000861763491 589177184 /nfs/dbraw/zinc/17/71/84/589177184.db2.gz ROEAOCAOKMANLL-WAYWQWQTSA-N 1 2 245.326 2.041 20 0 BEADLO O=C(/C=C\C1CCCC1)N1CCc2[nH+]c[nH]c2C1 ZINC000861763491 589177186 /nfs/dbraw/zinc/17/71/86/589177186.db2.gz ROEAOCAOKMANLL-WAYWQWQTSA-N 1 2 245.326 2.041 20 0 BEADLO Cc1c(F)nccc1C[NH2+]Cc1nccs1 ZINC000862271813 589198199 /nfs/dbraw/zinc/19/81/99/589198199.db2.gz CRKZUIJYWXOXLY-UHFFFAOYSA-N 1 2 237.303 2.275 20 0 BEADLO Cc1c[nH]c(CN2CCOc3cc(C)ccc32)[nH+]1 ZINC000862325101 589200636 /nfs/dbraw/zinc/20/06/36/589200636.db2.gz BSSONGAAWVEYMN-UHFFFAOYSA-N 1 2 243.310 2.426 20 0 BEADLO Cc1nc(C)c(C[NH2+]Cc2cccnc2F)o1 ZINC000862350692 589201665 /nfs/dbraw/zinc/20/16/65/589201665.db2.gz FLLFJQHLCTVCAJ-UHFFFAOYSA-N 1 2 235.262 2.115 20 0 BEADLO Cc1cc(=O)[nH]c(C(C)(C)[NH2+]Cc2ccoc2)n1 ZINC000862433287 589212469 /nfs/dbraw/zinc/21/24/69/589212469.db2.gz VGHPQOVNWHOMLE-UHFFFAOYSA-N 1 2 247.298 2.109 20 0 BEADLO COc1ccc(COCc2[nH]cc[nH+]2)cc1C ZINC000863315080 589278743 /nfs/dbraw/zinc/27/87/43/589278743.db2.gz KQTHXVXVTOPLDQ-UHFFFAOYSA-N 1 2 232.283 2.444 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OCc1ccc(C)c(F)c1 ZINC000863458743 589290078 /nfs/dbraw/zinc/29/00/78/589290078.db2.gz FMAWRRKCNAXHIM-SECBINFHSA-N 1 2 240.278 2.167 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OCc1ccc(C)c(F)c1 ZINC000863458778 589290094 /nfs/dbraw/zinc/29/00/94/589290094.db2.gz FMAWRRKCNAXHIM-VIFPVBQESA-N 1 2 240.278 2.167 20 0 BEADLO COc1cccc(C(N)=[NH+]OC[C@H]2C[C@H]2C)c1 ZINC000863458268 589290112 /nfs/dbraw/zinc/29/01/12/589290112.db2.gz XUGPJQSWBCWRTP-MWLCHTKSSA-N 1 2 234.299 2.198 20 0 BEADLO CCC[C@H](OCC)c1nc(C[NH2+]CC)no1 ZINC000863655161 589308276 /nfs/dbraw/zinc/30/82/76/589308276.db2.gz AUYCVRONTUPIHV-VIFPVBQESA-N 1 2 227.308 2.057 20 0 BEADLO COc1cccc([C@H]([NH3+])c2nc(C(C)C)no2)c1 ZINC000863658079 589308469 /nfs/dbraw/zinc/30/84/69/589308469.db2.gz JXVOOCDNXVDWDU-NSHDSACASA-N 1 2 247.298 2.250 20 0 BEADLO Cc1[nH+]cc(-c2cnc(C3CC3)o2)n1C ZINC000863976424 589331416 /nfs/dbraw/zinc/33/14/16/589331416.db2.gz DSSLYVKESUZIKN-UHFFFAOYSA-N 1 2 203.245 2.261 20 0 BEADLO OC1(c2ccc(-c3[nH]cc[nH+]3)cc2)CCC1 ZINC000863977718 589332045 /nfs/dbraw/zinc/33/20/45/589332045.db2.gz LZUGLQOTYCJFLG-UHFFFAOYSA-N 1 2 214.268 2.448 20 0 BEADLO CC1=NO[C@H](CNc2cc(CC(C)C)[nH+]cn2)C1 ZINC000864234083 589348335 /nfs/dbraw/zinc/34/83/35/589348335.db2.gz PSFMSGYZGVTCOZ-LBPRGKRZSA-N 1 2 248.330 2.252 20 0 BEADLO C[C@H](C[S@@](=O)Cc1c[nH+]cn1C)C(C)(C)C ZINC000864472042 589373382 /nfs/dbraw/zinc/37/33/82/589373382.db2.gz HPKSBNLUXJVNSS-QLJPJBMISA-N 1 2 242.388 2.351 20 0 BEADLO Cc1nnsc1Cn1c[nH+]c(C(C)(C)C)c1 ZINC000865376159 589428227 /nfs/dbraw/zinc/42/82/27/589428227.db2.gz BONHAGFKBHIEDO-UHFFFAOYSA-N 1 2 236.344 2.389 20 0 BEADLO CC[C@@H](C)NC(=O)Cn1c[nH+]c(C(C)(C)C)c1 ZINC000865374791 589428243 /nfs/dbraw/zinc/42/82/43/589428243.db2.gz KUEFIIIGZBSNSQ-SNVBAGLBSA-N 1 2 237.347 2.095 20 0 BEADLO CCOC(=O)/C=C/Cn1c[nH+]c(C(C)(C)C)c1 ZINC000865376580 589428690 /nfs/dbraw/zinc/42/86/90/589428690.db2.gz UYDKERWPDAHLSP-VOTSOKGWSA-N 1 2 236.315 2.300 20 0 BEADLO Cc1csc(C[NH2+]Cc2cn(C3CC3)cn2)n1 ZINC000865409539 589434544 /nfs/dbraw/zinc/43/45/44/589434544.db2.gz JUPPPZPGPILZOO-UHFFFAOYSA-N 1 2 248.355 2.273 20 0 BEADLO Cc1csc(CNCc2cn(C3CC3)c[nH+]2)n1 ZINC000865409539 589434546 /nfs/dbraw/zinc/43/45/46/589434546.db2.gz JUPPPZPGPILZOO-UHFFFAOYSA-N 1 2 248.355 2.273 20 0 BEADLO Nc1nc(NCC2CCC2)nc(C2CCCC2)[nH+]1 ZINC000865439625 589436053 /nfs/dbraw/zinc/43/60/53/589436053.db2.gz YBQYUGDHNDYZKJ-UHFFFAOYSA-N 1 2 247.346 2.323 20 0 BEADLO Nc1nc(NCC2CCC2)[nH+]c(C2CCCC2)n1 ZINC000865439625 589436055 /nfs/dbraw/zinc/43/60/55/589436055.db2.gz YBQYUGDHNDYZKJ-UHFFFAOYSA-N 1 2 247.346 2.323 20 0 BEADLO c1ccc2cc(NC[C@H]3COCCO3)[nH+]cc2c1 ZINC000865457549 589437238 /nfs/dbraw/zinc/43/72/38/589437238.db2.gz WGURJQCRFCFDQE-ZDUSSCGKSA-N 1 2 244.294 2.062 20 0 BEADLO COc1ccc(NCc2cn(C3CC3)c[nH+]2)nc1 ZINC000865495151 589440914 /nfs/dbraw/zinc/44/09/14/589440914.db2.gz GMKJTKZXOSWAOV-UHFFFAOYSA-N 1 2 244.298 2.234 20 0 BEADLO Fc1cccnc1CNCc1cn(C2CC2)c[nH+]1 ZINC000865510266 589442235 /nfs/dbraw/zinc/44/22/35/589442235.db2.gz YYAGLQJCNLBXLV-UHFFFAOYSA-N 1 2 246.289 2.042 20 0 BEADLO Fc1cccc(C[NH2+]Cc2cn(C3CC3)cn2)n1 ZINC000865509907 589442565 /nfs/dbraw/zinc/44/25/65/589442565.db2.gz VDUCYOQWFOSKQM-UHFFFAOYSA-N 1 2 246.289 2.042 20 0 BEADLO CCn1cc(NCc2cn(C3CC3)c[nH+]2)cn1 ZINC000865513676 589442996 /nfs/dbraw/zinc/44/29/96/589442996.db2.gz STIHWQPXYOYYLX-UHFFFAOYSA-N 1 2 231.303 2.047 20 0 BEADLO Nc1nc(NC2CCC2)nc(C2CCCC2)[nH+]1 ZINC000865525927 589443783 /nfs/dbraw/zinc/44/37/83/589443783.db2.gz IQDDYHKQRKASMD-UHFFFAOYSA-N 1 2 233.319 2.076 20 0 BEADLO Nc1nc(NC2CCC2)[nH+]c(C2CCCC2)n1 ZINC000865525927 589443784 /nfs/dbraw/zinc/44/37/84/589443784.db2.gz IQDDYHKQRKASMD-UHFFFAOYSA-N 1 2 233.319 2.076 20 0 BEADLO CCc1cc(CNc2ccc([C@@H](C)O)c[nH+]2)[nH]n1 ZINC000865536658 589444036 /nfs/dbraw/zinc/44/40/36/589444036.db2.gz GWWDXZSSPSUCTE-SECBINFHSA-N 1 2 246.314 2.033 20 0 BEADLO CCc1cc(CNc2ccc([C@@H](C)O)c[nH+]2)n[nH]1 ZINC000865536658 589444037 /nfs/dbraw/zinc/44/40/37/589444037.db2.gz GWWDXZSSPSUCTE-SECBINFHSA-N 1 2 246.314 2.033 20 0 BEADLO CC(C)Cc1cc(NC[C@@](C)(O)C2CC2)nc[nH+]1 ZINC000865535807 589444068 /nfs/dbraw/zinc/44/40/68/589444068.db2.gz SPHJDVDNABBGCD-CQSZACIVSA-N 1 2 249.358 2.248 20 0 BEADLO CCCCc1cc(N[C@H](CO)C2CC2)nc[nH+]1 ZINC000865540695 589444622 /nfs/dbraw/zinc/44/46/22/589444622.db2.gz WPUZMBCZCXBAQD-GFCCVEGCSA-N 1 2 235.331 2.002 20 0 BEADLO CCC=C(F)C(=O)Nc1cc[nH+]cc1C ZINC000865574914 589448099 /nfs/dbraw/zinc/44/80/99/589448099.db2.gz GMECBAFCTKVWNR-RUDMXATFSA-N 1 2 208.236 2.014 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C ZINC000865574962 589448163 /nfs/dbraw/zinc/44/81/63/589448163.db2.gz HVAYMSFKWLIERV-OHBODLIOSA-N 1 2 230.311 2.043 20 0 BEADLO CC1CC(Nc2[nH+]cnc3[nH]c(Cl)cc32)C1 ZINC000865578349 589448384 /nfs/dbraw/zinc/44/83/84/589448384.db2.gz AGODBUVXYMZRMF-UHFFFAOYSA-N 1 2 236.706 2.244 20 0 BEADLO CC(=O)Nc1cccc(C[NH2+]C(CF)CF)c1 ZINC000865582678 589448581 /nfs/dbraw/zinc/44/85/81/589448581.db2.gz GBLNTLPZEIBEBR-UHFFFAOYSA-N 1 2 242.269 2.042 20 0 BEADLO CN(C)c1ccc(F)cc1C[NH2+]C(CF)CF ZINC000865583851 589449026 /nfs/dbraw/zinc/44/90/26/589449026.db2.gz WNEGMFFDLKRZGV-UHFFFAOYSA-N 1 2 246.276 2.289 20 0 BEADLO CCCCc1cc(N[C@@](C)(CO)C2CC2)nc[nH+]1 ZINC000865614273 589451528 /nfs/dbraw/zinc/45/15/28/589451528.db2.gz BYVPIMRWFCTELX-AWEZNQCLSA-N 1 2 249.358 2.392 20 0 BEADLO CC(C)Cc1cc(N[C@H]2CC[C@H](O)CC2)nc[nH+]1 ZINC000865636988 589453535 /nfs/dbraw/zinc/45/35/35/589453535.db2.gz LEDIOMZLFBRMLQ-AULYBMBSSA-N 1 2 249.358 2.391 20 0 BEADLO CC(C)n1cc(C[NH2+][C@@H]2CCCC[C@@H]2F)nn1 ZINC000865697054 589456993 /nfs/dbraw/zinc/45/69/93/589456993.db2.gz QLWZMLANYQMMEX-NWDGAFQWSA-N 1 2 240.326 2.229 20 0 BEADLO CCCNc1cc(N[C@@H](C)[C@@H](C)OC)nc[nH+]1 ZINC000865717416 589458202 /nfs/dbraw/zinc/45/82/02/589458202.db2.gz YEQNLVQJGZULQY-VHSXEESVSA-N 1 2 238.335 2.134 20 0 BEADLO CCCNc1cc(N[C@@H](C)[C@@H](C)OC)[nH+]cn1 ZINC000865717416 589458203 /nfs/dbraw/zinc/45/82/03/589458203.db2.gz YEQNLVQJGZULQY-VHSXEESVSA-N 1 2 238.335 2.134 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cn(C3CC3)cn2)o1 ZINC000865723601 589458481 /nfs/dbraw/zinc/45/84/81/589458481.db2.gz OLKXBZWUKCLCBW-UHFFFAOYSA-N 1 2 231.299 2.409 20 0 BEADLO Cc1cc(NC(=O)[C@@]23C[C@@H]2CCCC3)cc[nH+]1 ZINC000865741121 589460117 /nfs/dbraw/zinc/46/01/17/589460117.db2.gz MPFUJFXFAKYCCH-FZMZJTMJSA-N 1 2 230.311 2.331 20 0 BEADLO Cc1[nH]ncc1C[NH2+]C(C)(C)[C@H]1CCCCO1 ZINC000865748020 589460801 /nfs/dbraw/zinc/46/08/01/589460801.db2.gz YIOPIEOKKLUDLJ-GFCCVEGCSA-N 1 2 237.347 2.155 20 0 BEADLO C[C@@H]1CN(c2[nH+]cnc3[nH]c(Cl)cc32)[C@H]1C ZINC000865839216 589464513 /nfs/dbraw/zinc/46/45/13/589464513.db2.gz JRSFOMYUASFLOF-RQJHMYQMSA-N 1 2 236.706 2.408 20 0 BEADLO CN(C)c1ccc(NCc2[nH]cc[nH+]2)cc1F ZINC000865865353 589465766 /nfs/dbraw/zinc/46/57/66/589465766.db2.gz QFDKJGAMSMBFOX-UHFFFAOYSA-N 1 2 234.278 2.227 20 0 BEADLO COCC[C@@H](C)CNc1ccc([C@H](C)O)c[nH+]1 ZINC000865874327 589466779 /nfs/dbraw/zinc/46/67/79/589466779.db2.gz BPOJYQXYBIPDRD-MNOVXSKESA-N 1 2 238.331 2.219 20 0 BEADLO CCO[C@H]1C[C@H](Nc2ccc([C@@H](C)O)c[nH+]2)C1 ZINC000865937980 589469511 /nfs/dbraw/zinc/46/95/11/589469511.db2.gz HKEJPCOOJOJLNP-YUSALJHKSA-N 1 2 236.315 2.114 20 0 BEADLO Nc1nc(N[C@H]2C=CCC2)nc(C2CCCC2)[nH+]1 ZINC000865938962 589469564 /nfs/dbraw/zinc/46/95/64/589469564.db2.gz MRQVAZPLFBWOMJ-JTQLQIEISA-N 1 2 245.330 2.242 20 0 BEADLO Nc1nc(N[C@H]2C=CCC2)[nH+]c(C2CCCC2)n1 ZINC000865938962 589469565 /nfs/dbraw/zinc/46/95/65/589469565.db2.gz MRQVAZPLFBWOMJ-JTQLQIEISA-N 1 2 245.330 2.242 20 0 BEADLO Clc1cc2c(nc[nH+]c2N2CC[C@@H]3C[C@@H]3C2)[nH]1 ZINC000865948208 589470000 /nfs/dbraw/zinc/47/00/00/589470000.db2.gz BRHMGZAWZXQBBJ-HTQZYQBOSA-N 1 2 248.717 2.409 20 0 BEADLO CC(C)Cc1cc(NCCOCCF)nc[nH+]1 ZINC000865957396 589470321 /nfs/dbraw/zinc/47/03/21/589470321.db2.gz AGUZBYNGCDHAAR-UHFFFAOYSA-N 1 2 241.310 2.073 20 0 BEADLO C[C@H](O)c1ccc(N[C@@H](C)c2ccnn2C)[nH+]c1 ZINC000866253407 589483276 /nfs/dbraw/zinc/48/32/76/589483276.db2.gz YIJQLHBECNTHQL-UWVGGRQHSA-N 1 2 246.314 2.042 20 0 BEADLO CC[C@H](C[C@@H](C)O)Nc1cc[nH+]c(C2CC2)n1 ZINC000866299381 589484756 /nfs/dbraw/zinc/48/47/56/589484756.db2.gz JRBSIXNSUWSGCM-MWLCHTKSSA-N 1 2 235.331 2.315 20 0 BEADLO Cc1nc(NCC[C@@H](O)C2CCCC2)cc[nH+]1 ZINC000866304222 589485366 /nfs/dbraw/zinc/48/53/66/589485366.db2.gz WBYITWVPTVCIHT-GFCCVEGCSA-N 1 2 235.331 2.138 20 0 BEADLO C[C@H](NC(=O)[C@@H]1C[C@H]1C(C)(C)C)c1[nH+]ccn1C ZINC000869302289 589597525 /nfs/dbraw/zinc/59/75/25/589597525.db2.gz UGGUFFGJYXGASS-HBNTYKKESA-N 1 2 249.358 2.280 20 0 BEADLO Cn1c[nH+]cc1CNc1cccc(Cl)n1 ZINC000122904688 589643239 /nfs/dbraw/zinc/64/32/39/589643239.db2.gz NMVYXYMURNBBID-UHFFFAOYSA-N 1 2 222.679 2.081 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)[C@@H](C)C2CC2)c1 ZINC000122997596 589647944 /nfs/dbraw/zinc/64/79/44/589647944.db2.gz PGKOWONNIUATGF-JTQLQIEISA-N 1 2 249.310 2.488 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)[C@H](C)C2CC2)c1 ZINC000122997787 589648001 /nfs/dbraw/zinc/64/80/01/589648001.db2.gz PGKOWONNIUATGF-SNVBAGLBSA-N 1 2 249.310 2.488 20 0 BEADLO COCCOc1ccccc1NCc1[nH]cc[nH+]1 ZINC000123194766 589672473 /nfs/dbraw/zinc/67/24/73/589672473.db2.gz HEHFGOWNQZCBRC-UHFFFAOYSA-N 1 2 247.298 2.047 20 0 BEADLO Clc1ncsc1COCc1[nH]cc[nH+]1 ZINC000871664557 589785240 /nfs/dbraw/zinc/78/52/40/589785240.db2.gz ZOMBUYGBJJSJEM-UHFFFAOYSA-N 1 2 229.692 2.236 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OC[C@@H](C)C(C)(C)C ZINC000871735571 589801133 /nfs/dbraw/zinc/80/11/33/589801133.db2.gz ULBYKKXCLBATNB-RKDXNWHRSA-N 1 2 216.325 2.202 20 0 BEADLO NC(COC1CCC1)=[NH+]OCCCCCF ZINC000871778555 589813541 /nfs/dbraw/zinc/81/35/41/589813541.db2.gz NKSNKTISFLWVAH-UHFFFAOYSA-N 1 2 232.299 2.194 20 0 BEADLO CCCCCO[NH+]=C(N)COC1CCC1 ZINC000871775329 589813611 /nfs/dbraw/zinc/81/36/11/589813611.db2.gz LLUWEGYMJWBWRQ-UHFFFAOYSA-N 1 2 214.309 2.244 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[NH2+][C@H]1CC12CCC2 ZINC000871937993 589834835 /nfs/dbraw/zinc/83/48/35/589834835.db2.gz KFRTWZREQONIAN-NEPJUHHUSA-N 1 2 239.359 2.496 20 0 BEADLO C[C@@H]([NH2+]Cc1ccon1)c1cccc(O)c1F ZINC000872040119 589859076 /nfs/dbraw/zinc/85/90/76/589859076.db2.gz KGDOJNHXQNWDMK-MRVPVSSYSA-N 1 2 236.246 2.370 20 0 BEADLO C[C@@H]([NH2+]Cc1ccn(C)n1)c1cccc(O)c1F ZINC000872053768 589861566 /nfs/dbraw/zinc/86/15/66/589861566.db2.gz MQOXEHNYNWOVJP-SECBINFHSA-N 1 2 249.289 2.116 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@@H]1C[C@@H]2CCC[C@H]2O1 ZINC000872110060 589874327 /nfs/dbraw/zinc/87/43/27/589874327.db2.gz VLQKHDUGYGVYHT-QVSJOPQTSA-N 1 2 249.358 2.326 20 0 BEADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1nonc1C ZINC000872137375 589879131 /nfs/dbraw/zinc/87/91/31/589879131.db2.gz SITRJJOPMPJMSO-SNVBAGLBSA-N 1 2 246.314 2.186 20 0 BEADLO CCCCC(=O)N1CCN(C)c2[nH+]cccc2C1 ZINC000872295786 589907323 /nfs/dbraw/zinc/90/73/23/589907323.db2.gz YLEDCDBDXBWSSG-UHFFFAOYSA-N 1 2 247.342 2.050 20 0 BEADLO CC(=O)C1CCN(c2[nH]c3ccccc3[nH+]2)CC1 ZINC000872668641 589960128 /nfs/dbraw/zinc/96/01/28/589960128.db2.gz UCFAYZVCLCGNQS-UHFFFAOYSA-N 1 2 243.310 2.368 20 0 BEADLO c1ccc(NC[C@@H]2C[C@H]3CCC[C@@H]3O2)[nH+]c1 ZINC000872699879 589962990 /nfs/dbraw/zinc/96/29/90/589962990.db2.gz VJUYCHDSVDOBPM-WOPDTQHZSA-N 1 2 218.300 2.451 20 0 BEADLO FC(F)(F)[C@H]1CCN(c2cccc[nH+]2)CCO1 ZINC000872751757 589966435 /nfs/dbraw/zinc/96/64/35/589966435.db2.gz ROEDWBHXHLEYMW-SECBINFHSA-N 1 2 246.232 2.239 20 0 BEADLO Cc1nc(N[C@H](C)c2nccnc2C)cc[nH+]1 ZINC000872768148 589966937 /nfs/dbraw/zinc/96/69/37/589966937.db2.gz DIENBWKARLQTQC-SECBINFHSA-N 1 2 229.287 2.057 20 0 BEADLO c1nc(N2CCCC2)cc(N[C@H]2CC23CCC3)[nH+]1 ZINC000872775297 589968340 /nfs/dbraw/zinc/96/83/40/589968340.db2.gz RCQCDBFHVFIKEG-NSHDSACASA-N 1 2 244.342 2.431 20 0 BEADLO c1nc(N[C@H]2CC23CCC3)cc(N2CCCC2)[nH+]1 ZINC000872775297 589968342 /nfs/dbraw/zinc/96/83/42/589968342.db2.gz RCQCDBFHVFIKEG-NSHDSACASA-N 1 2 244.342 2.431 20 0 BEADLO CSCC[C@@H](C)Nc1cc(C)[nH+]cn1 ZINC000124768445 590084897 /nfs/dbraw/zinc/08/48/97/590084897.db2.gz RCFBDVDTGZUJOX-MRVPVSSYSA-N 1 2 211.334 2.339 20 0 BEADLO CCC[C@@H](CC)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000874445059 590111198 /nfs/dbraw/zinc/11/11/98/590111198.db2.gz UHNQHUMAUKRKRO-SNVBAGLBSA-N 1 2 223.320 2.194 20 0 BEADLO CCC1(CC)CCCN1C(=O)CCn1cc[nH+]c1 ZINC000874628142 590119182 /nfs/dbraw/zinc/11/91/82/590119182.db2.gz HIPPKZVLTDQLQU-UHFFFAOYSA-N 1 2 249.358 2.454 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@H]1CCCC2(CC2)C1 ZINC000888695938 590185918 /nfs/dbraw/zinc/18/59/18/590185918.db2.gz KILYEEOGQILFRU-LLVKDONJSA-N 1 2 247.342 2.100 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@@H]1CCCC2(CC2)C1 ZINC000888695938 590185919 /nfs/dbraw/zinc/18/59/19/590185919.db2.gz KILYEEOGQILFRU-LLVKDONJSA-N 1 2 247.342 2.100 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N[C@H]1CCCC2(CC2)C1 ZINC000888696844 590185975 /nfs/dbraw/zinc/18/59/75/590185975.db2.gz WZKITXFJFLANLJ-NSHDSACASA-N 1 2 247.342 2.181 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N[C@H]1CCCC2(CC2)C1 ZINC000888696844 590185977 /nfs/dbraw/zinc/18/59/77/590185977.db2.gz WZKITXFJFLANLJ-NSHDSACASA-N 1 2 247.342 2.181 20 0 BEADLO O=C(CCCn1cc[nH+]c1)O[C@H]1C=CCCC1 ZINC000876308510 590194369 /nfs/dbraw/zinc/19/43/69/590194369.db2.gz NLLXYINRZQZSLB-LBPRGKRZSA-N 1 2 234.299 2.315 20 0 BEADLO OC[C@H]1CCC[N@H+](Cc2nc(Cl)cs2)C1 ZINC000876509771 590202059 /nfs/dbraw/zinc/20/20/59/590202059.db2.gz JIIIEXACANSNBE-QMMMGPOBSA-N 1 2 246.763 2.001 20 0 BEADLO OC[C@H]1CCC[N@@H+](Cc2nc(Cl)cs2)C1 ZINC000876509771 590202060 /nfs/dbraw/zinc/20/20/60/590202060.db2.gz JIIIEXACANSNBE-QMMMGPOBSA-N 1 2 246.763 2.001 20 0 BEADLO Cc1cc(C)cc(CC[N@@H+](C)Cc2nnc[nH]2)c1 ZINC000876749141 590237411 /nfs/dbraw/zinc/23/74/11/590237411.db2.gz KOAVPDBVUSDBLD-UHFFFAOYSA-N 1 2 244.342 2.096 20 0 BEADLO Cc1cc(C)cc(CC[N@H+](C)Cc2nnc[nH]2)c1 ZINC000876749141 590237412 /nfs/dbraw/zinc/23/74/12/590237412.db2.gz KOAVPDBVUSDBLD-UHFFFAOYSA-N 1 2 244.342 2.096 20 0 BEADLO C[N@H+](Cc1ccc[nH]1)Cc1ccc(Cl)nn1 ZINC000876790493 590241327 /nfs/dbraw/zinc/24/13/27/590241327.db2.gz KJFBUVDYSMQGQH-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO C[N@@H+](Cc1ccc[nH]1)Cc1ccc(Cl)nn1 ZINC000876790493 590241328 /nfs/dbraw/zinc/24/13/28/590241328.db2.gz KJFBUVDYSMQGQH-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO C[C@H]([NH2+]Cc1ccc(Cl)nn1)c1ccccn1 ZINC000876887702 590254143 /nfs/dbraw/zinc/25/41/43/590254143.db2.gz DQWSCMRKGAQMBO-VIFPVBQESA-N 1 2 248.717 2.376 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](C)c2ccc[nH]2)o1 ZINC000877124080 590289473 /nfs/dbraw/zinc/28/94/73/590289473.db2.gz HJSNPBJHQVHONC-VIFPVBQESA-N 1 2 205.261 2.162 20 0 BEADLO Cc1cc(C[NH2+]Cc2nc(Cl)cs2)on1 ZINC000877149827 590292643 /nfs/dbraw/zinc/29/26/43/590292643.db2.gz HOZYVBMSPYXNSY-UHFFFAOYSA-N 1 2 243.719 2.383 20 0 BEADLO Clc1csc(C[NH2+]Cc2ccno2)n1 ZINC000877322199 590316522 /nfs/dbraw/zinc/31/65/22/590316522.db2.gz YNUJNJWNVNHIJB-UHFFFAOYSA-N 1 2 229.692 2.074 20 0 BEADLO OCC[C@H]1CCC[N@@H+]1Cc1nc(Cl)cs1 ZINC000877435020 590327231 /nfs/dbraw/zinc/32/72/31/590327231.db2.gz MOVZMXSOTXCCGR-MRVPVSSYSA-N 1 2 246.763 2.143 20 0 BEADLO OCC[C@H]1CCC[N@H+]1Cc1nc(Cl)cs1 ZINC000877435020 590327234 /nfs/dbraw/zinc/32/72/34/590327234.db2.gz MOVZMXSOTXCCGR-MRVPVSSYSA-N 1 2 246.763 2.143 20 0 BEADLO CC[C@@]1(O)CC[N@H+](Cc2nc(Cl)cs2)C1 ZINC000877440667 590328027 /nfs/dbraw/zinc/32/80/27/590328027.db2.gz GSPMQSVEJCMPEI-SNVBAGLBSA-N 1 2 246.763 2.143 20 0 BEADLO CC[C@@]1(O)CC[N@@H+](Cc2nc(Cl)cs2)C1 ZINC000877440667 590328029 /nfs/dbraw/zinc/32/80/29/590328029.db2.gz GSPMQSVEJCMPEI-SNVBAGLBSA-N 1 2 246.763 2.143 20 0 BEADLO CC(C)COC(=O)[C@H](C)[NH2+][C@@H]1CS[C@@H](C)C1 ZINC000877469723 590331351 /nfs/dbraw/zinc/33/13/51/590331351.db2.gz SNWNQDVCOOKBMF-DCAQKATOSA-N 1 2 245.388 2.058 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1ccc(Cl)nn1 ZINC000877486030 590338774 /nfs/dbraw/zinc/33/87/74/590338774.db2.gz CLHXBZPKBHISSB-HTQZYQBOSA-N 1 2 211.696 2.113 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@H](C)Cc1cccc(C)c1 ZINC000877492233 590340208 /nfs/dbraw/zinc/34/02/08/590340208.db2.gz HKDXRWGQQVHJPU-VXGBXAGGSA-N 1 2 235.327 2.077 20 0 BEADLO CO[C@H](C)C[N@H+](C)Cc1nc(Cl)cs1 ZINC000877524318 590347200 /nfs/dbraw/zinc/34/72/00/590347200.db2.gz UVYGEXMDQRDGTM-SSDOTTSWSA-N 1 2 234.752 2.263 20 0 BEADLO CO[C@H](C)C[N@@H+](C)Cc1nc(Cl)cs1 ZINC000877524318 590347202 /nfs/dbraw/zinc/34/72/02/590347202.db2.gz UVYGEXMDQRDGTM-SSDOTTSWSA-N 1 2 234.752 2.263 20 0 BEADLO CC[C@@H]1CC[N@@H+]1Cc1ccc(Cl)nn1 ZINC000877548517 590353691 /nfs/dbraw/zinc/35/36/91/590353691.db2.gz ZHUBIWHNWNCSOA-SECBINFHSA-N 1 2 211.696 2.114 20 0 BEADLO CC[C@@H]1CC[N@H+]1Cc1ccc(Cl)nn1 ZINC000877548517 590353694 /nfs/dbraw/zinc/35/36/94/590353694.db2.gz ZHUBIWHNWNCSOA-SECBINFHSA-N 1 2 211.696 2.114 20 0 BEADLO COc1ncc(C[N@@H+]2CCC[C@@](C)(F)C2)s1 ZINC000877557737 590358513 /nfs/dbraw/zinc/35/85/13/590358513.db2.gz PKMSASNNQZOZTO-LLVKDONJSA-N 1 2 244.335 2.476 20 0 BEADLO COc1ncc(C[N@H+]2CCC[C@@](C)(F)C2)s1 ZINC000877557737 590358516 /nfs/dbraw/zinc/35/85/16/590358516.db2.gz PKMSASNNQZOZTO-LLVKDONJSA-N 1 2 244.335 2.476 20 0 BEADLO Cc1nocc1C[NH2+]Cc1nc(Cl)cs1 ZINC000877564131 590360900 /nfs/dbraw/zinc/36/09/00/590360900.db2.gz ZJAUBJYMOQXTCU-UHFFFAOYSA-N 1 2 243.719 2.383 20 0 BEADLO CCOC1(C)C[NH+](C[C@@H]2CC2(Cl)Cl)C1 ZINC000877581440 590365256 /nfs/dbraw/zinc/36/52/56/590365256.db2.gz DMGVOGWNDOKVSM-QMMMGPOBSA-N 1 2 238.158 2.291 20 0 BEADLO FC(F)OC1C[NH+](C[C@@H]2CC2(Cl)Cl)C1 ZINC000877581790 590365546 /nfs/dbraw/zinc/36/55/46/590365546.db2.gz SPSVEQYOFGAGEW-YFKPBYRVSA-N 1 2 246.084 2.104 20 0 BEADLO CCC1(C)C[NH+](Cc2cc(OC)cnc2F)C1 ZINC000877582141 590365570 /nfs/dbraw/zinc/36/55/70/590365570.db2.gz KJXVZHDSJBFNLJ-UHFFFAOYSA-N 1 2 238.306 2.461 20 0 BEADLO COc1cccc2cc(C[NH+]3CC(C)(O)C3)oc21 ZINC000877581213 590366045 /nfs/dbraw/zinc/36/60/45/590366045.db2.gz QYHYCRXATFJZNP-UHFFFAOYSA-N 1 2 247.294 2.008 20 0 BEADLO c1cc(C[NH2+]Cc2cc(C3CC3)no2)sn1 ZINC000877648784 590383942 /nfs/dbraw/zinc/38/39/42/590383942.db2.gz VKGFPEBTVSCQQH-UHFFFAOYSA-N 1 2 235.312 2.298 20 0 BEADLO Clc1csc(C[N@@H+]2C[C@@H]3C[C@@H]3C2)n1 ZINC000877649664 590384603 /nfs/dbraw/zinc/38/46/03/590384603.db2.gz DQYULSPLPWQYHA-KNVOCYPGSA-N 1 2 214.721 2.248 20 0 BEADLO Clc1csc(C[N@H+]2C[C@@H]3C[C@@H]3C2)n1 ZINC000877649664 590384606 /nfs/dbraw/zinc/38/46/06/590384606.db2.gz DQYULSPLPWQYHA-KNVOCYPGSA-N 1 2 214.721 2.248 20 0 BEADLO C[C@H]1CC[C@H]1Nc1c[nH+]cc(N(C)C)c1 ZINC000877667156 590389094 /nfs/dbraw/zinc/38/90/94/590389094.db2.gz DSUOFFOJQBALMH-JOYOIKCWSA-N 1 2 205.305 2.358 20 0 BEADLO CCOc1cccc(F)c1CNCc1[nH]cc[nH+]1 ZINC000877673825 590390032 /nfs/dbraw/zinc/39/00/32/590390032.db2.gz SIECSUNKEJWVLL-UHFFFAOYSA-N 1 2 249.289 2.237 20 0 BEADLO Cc1nc(C)c(C[NH+]2CC(OC(C)(C)C)C2)o1 ZINC000877769873 590421291 /nfs/dbraw/zinc/42/12/91/590421291.db2.gz MFHYAPLPCZSOBZ-UHFFFAOYSA-N 1 2 238.331 2.291 20 0 BEADLO CCC[N@@H+]1CC(=O)N[C@]12C[C@H](C)CC(C)(C)C2 ZINC000877857777 590433200 /nfs/dbraw/zinc/43/32/00/590433200.db2.gz ZUMUFPZHEFKCSV-BXUZGUMPSA-N 1 2 238.375 2.371 20 0 BEADLO CCC[N@H+]1CC(=O)N[C@]12C[C@H](C)CC(C)(C)C2 ZINC000877857777 590433201 /nfs/dbraw/zinc/43/32/01/590433201.db2.gz ZUMUFPZHEFKCSV-BXUZGUMPSA-N 1 2 238.375 2.371 20 0 BEADLO CC1CC[NH+](Cc2nccn2CC(F)F)CC1 ZINC000877935015 590451771 /nfs/dbraw/zinc/45/17/71/590451771.db2.gz KCTXSCDBQIAZLP-UHFFFAOYSA-N 1 2 243.301 2.380 20 0 BEADLO C[N@H+](Cc1nc2c(o1)CCCC2)C1CC1 ZINC000877966653 590460949 /nfs/dbraw/zinc/46/09/49/590460949.db2.gz SAIQCQJEAAFOAI-UHFFFAOYSA-N 1 2 206.289 2.148 20 0 BEADLO C[N@@H+](Cc1nc2c(o1)CCCC2)C1CC1 ZINC000877966653 590460950 /nfs/dbraw/zinc/46/09/50/590460950.db2.gz SAIQCQJEAAFOAI-UHFFFAOYSA-N 1 2 206.289 2.148 20 0 BEADLO C[N@@H+](Cc1scnc1Cl)C[C@@H]1CCCO1 ZINC000877973224 590462867 /nfs/dbraw/zinc/46/28/67/590462867.db2.gz WWYTUTXWYDCCMI-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO C[N@H+](Cc1scnc1Cl)C[C@@H]1CCCO1 ZINC000877973224 590462869 /nfs/dbraw/zinc/46/28/69/590462869.db2.gz WWYTUTXWYDCCMI-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO C=C/C=C\CC[N@@H+](CCOC)CC(F)F ZINC000878052777 590484074 /nfs/dbraw/zinc/48/40/74/590484074.db2.gz XWDUZSHDBWRYJY-PLNGDYQASA-N 1 2 219.275 2.332 20 0 BEADLO C=C/C=C\CC[N@H+](CCOC)CC(F)F ZINC000878052777 590484075 /nfs/dbraw/zinc/48/40/75/590484075.db2.gz XWDUZSHDBWRYJY-PLNGDYQASA-N 1 2 219.275 2.332 20 0 BEADLO CC(=O)C[N@@H+]1[C@H](C)CO[C@@H](c2ccccc2)[C@H]1C ZINC000878096092 590492339 /nfs/dbraw/zinc/49/23/39/590492339.db2.gz LGDVTIYKTRHRQO-UXIGCNINSA-N 1 2 247.338 2.426 20 0 BEADLO CC(=O)C[N@H+]1[C@H](C)CO[C@@H](c2ccccc2)[C@H]1C ZINC000878096092 590492340 /nfs/dbraw/zinc/49/23/40/590492340.db2.gz LGDVTIYKTRHRQO-UXIGCNINSA-N 1 2 247.338 2.426 20 0 BEADLO CCC(F)(F)C[NH+]1CCC(c2nnc[nH]2)CC1 ZINC000878176975 590516552 /nfs/dbraw/zinc/51/65/52/590516552.db2.gz QMMVQCWGROMUHM-UHFFFAOYSA-N 1 2 244.289 2.029 20 0 BEADLO Cc1conc1C[N@@H+]1CCOC2(CCCC2)C1 ZINC000878196449 590521378 /nfs/dbraw/zinc/52/13/78/590521378.db2.gz BJTIUINMFQEQPA-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO Cc1conc1C[N@H+]1CCOC2(CCCC2)C1 ZINC000878196449 590521381 /nfs/dbraw/zinc/52/13/81/590521381.db2.gz BJTIUINMFQEQPA-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO CC[C@@H]1CCC[C@@]1(C)C(=O)NCCn1cc[nH+]c1 ZINC000878223189 590525669 /nfs/dbraw/zinc/52/56/69/590525669.db2.gz LXZPRZNGRSZDRI-TZMCWYRMSA-N 1 2 249.358 2.216 20 0 BEADLO FC1(F)CC[N@H+](C[C@@H]2C[C@@H]3CCC[C@@H]3O2)C1 ZINC000878380300 590555974 /nfs/dbraw/zinc/55/59/74/590555974.db2.gz WGUGAIJFMFTHTC-DCAQKATOSA-N 1 2 231.286 2.285 20 0 BEADLO FC1(F)CC[N@@H+](C[C@@H]2C[C@@H]3CCC[C@@H]3O2)C1 ZINC000878380300 590555976 /nfs/dbraw/zinc/55/59/76/590555976.db2.gz WGUGAIJFMFTHTC-DCAQKATOSA-N 1 2 231.286 2.285 20 0 BEADLO OC[C@H]1CC(F)(F)C[N@@H+]1CC1CC2(CCC2)C1 ZINC000878476348 590574950 /nfs/dbraw/zinc/57/49/50/590574950.db2.gz IBPJVQSGSOIJPC-LLVKDONJSA-N 1 2 245.313 2.269 20 0 BEADLO OC[C@H]1CC(F)(F)C[N@H+]1CC1CC2(CCC2)C1 ZINC000878476348 590574951 /nfs/dbraw/zinc/57/49/51/590574951.db2.gz IBPJVQSGSOIJPC-LLVKDONJSA-N 1 2 245.313 2.269 20 0 BEADLO c1cc2c(cn1)C[N@H+](C[C@@H]1CC3(CCC3)CO1)C2 ZINC000878608885 590595756 /nfs/dbraw/zinc/59/57/56/590595756.db2.gz HFVPDZPWSLBMLE-AWEZNQCLSA-N 1 2 244.338 2.356 20 0 BEADLO c1cc2c(cn1)C[N@@H+](C[C@@H]1CC3(CCC3)CO1)C2 ZINC000878608885 590595757 /nfs/dbraw/zinc/59/57/57/590595757.db2.gz HFVPDZPWSLBMLE-AWEZNQCLSA-N 1 2 244.338 2.356 20 0 BEADLO c1cc2c(cn1)C[N@H+](C[C@@H]1C[C@@H]3CCC[C@@H]3O1)C2 ZINC000878609314 590595895 /nfs/dbraw/zinc/59/58/95/590595895.db2.gz XBPOJYAAMCCKKO-CQDKDKBSSA-N 1 2 244.338 2.355 20 0 BEADLO c1cc2c(cn1)C[N@@H+](C[C@@H]1C[C@@H]3CCC[C@@H]3O1)C2 ZINC000878609314 590595896 /nfs/dbraw/zinc/59/58/96/590595896.db2.gz XBPOJYAAMCCKKO-CQDKDKBSSA-N 1 2 244.338 2.355 20 0 BEADLO CO[C@H](C)C[N@H+](C)Cc1nc2c(o1)CCCC2 ZINC000878613290 590596066 /nfs/dbraw/zinc/59/60/66/590596066.db2.gz JZWIWLHYODLCQZ-SNVBAGLBSA-N 1 2 238.331 2.020 20 0 BEADLO CO[C@H](C)C[N@@H+](C)Cc1nc2c(o1)CCCC2 ZINC000878613290 590596067 /nfs/dbraw/zinc/59/60/67/590596067.db2.gz JZWIWLHYODLCQZ-SNVBAGLBSA-N 1 2 238.331 2.020 20 0 BEADLO C=C/C=C/CC[N@@H+](C)Cc1nncn1C(C)C ZINC000878645515 590600974 /nfs/dbraw/zinc/60/09/74/590600974.db2.gz LLMNVILKGQEPKE-VOTSOKGWSA-N 1 2 234.347 2.423 20 0 BEADLO C=C/C=C/CC[N@H+](C)Cc1nncn1C(C)C ZINC000878645515 590600975 /nfs/dbraw/zinc/60/09/75/590600975.db2.gz LLMNVILKGQEPKE-VOTSOKGWSA-N 1 2 234.347 2.423 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nc3c(o2)CCCC3)[C@@H]1C ZINC000878652125 590602655 /nfs/dbraw/zinc/60/26/55/590602655.db2.gz MGPMEPAUPHIMJW-NXEZZACHSA-N 1 2 220.316 2.394 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nc3c(o2)CCCC3)[C@@H]1C ZINC000878652125 590602656 /nfs/dbraw/zinc/60/26/56/590602656.db2.gz MGPMEPAUPHIMJW-NXEZZACHSA-N 1 2 220.316 2.394 20 0 BEADLO Cc1cc(C[N@@H+]2CCC=C(Cl)C2)on1 ZINC000878790079 590622616 /nfs/dbraw/zinc/62/26/16/590622616.db2.gz DGLKJAWCLJBIHQ-UHFFFAOYSA-N 1 2 212.680 2.311 20 0 BEADLO Cc1cc(C[N@H+]2CCC=C(Cl)C2)on1 ZINC000878790079 590622618 /nfs/dbraw/zinc/62/26/18/590622618.db2.gz DGLKJAWCLJBIHQ-UHFFFAOYSA-N 1 2 212.680 2.311 20 0 BEADLO CC(C)N(C)C(=O)[C@H](C)[N@@H+]1CCC=C(Cl)C1 ZINC000878792442 590622918 /nfs/dbraw/zinc/62/29/18/590622918.db2.gz MEJCDVQTTGCBRL-JTQLQIEISA-N 1 2 244.766 2.070 20 0 BEADLO CC(C)N(C)C(=O)[C@H](C)[N@H+]1CCC=C(Cl)C1 ZINC000878792442 590622919 /nfs/dbraw/zinc/62/29/19/590622919.db2.gz MEJCDVQTTGCBRL-JTQLQIEISA-N 1 2 244.766 2.070 20 0 BEADLO COc1ncccc1C[N@@H+]1CCC=C(Cl)C1 ZINC000878792284 590623417 /nfs/dbraw/zinc/62/34/17/590623417.db2.gz YYRNMYBPXZNZMB-UHFFFAOYSA-N 1 2 238.718 2.419 20 0 BEADLO COc1ncccc1C[N@H+]1CCC=C(Cl)C1 ZINC000878792284 590623419 /nfs/dbraw/zinc/62/34/19/590623419.db2.gz YYRNMYBPXZNZMB-UHFFFAOYSA-N 1 2 238.718 2.419 20 0 BEADLO COc1cccc(C[N@@H+]2CCC=C(Cl)C2)n1 ZINC000878793763 590624620 /nfs/dbraw/zinc/62/46/20/590624620.db2.gz LHNIRFJJNPYHOR-UHFFFAOYSA-N 1 2 238.718 2.419 20 0 BEADLO COc1cccc(C[N@H+]2CCC=C(Cl)C2)n1 ZINC000878793763 590624621 /nfs/dbraw/zinc/62/46/21/590624621.db2.gz LHNIRFJJNPYHOR-UHFFFAOYSA-N 1 2 238.718 2.419 20 0 BEADLO C[N@@H+](Cc1cnc[nH]1)C[C@@H]1CCCC(C)(C)O1 ZINC000878884778 590640519 /nfs/dbraw/zinc/64/05/19/590640519.db2.gz LTWSIIZMEFBJPQ-LBPRGKRZSA-N 1 2 237.347 2.189 20 0 BEADLO C[N@H+](Cc1cnc[nH]1)C[C@@H]1CCCC(C)(C)O1 ZINC000878884778 590640521 /nfs/dbraw/zinc/64/05/21/590640521.db2.gz LTWSIIZMEFBJPQ-LBPRGKRZSA-N 1 2 237.347 2.189 20 0 BEADLO C[N@@H+](Cc1c[nH]cn1)C[C@@H]1CCCC(C)(C)O1 ZINC000878884778 590640522 /nfs/dbraw/zinc/64/05/22/590640522.db2.gz LTWSIIZMEFBJPQ-LBPRGKRZSA-N 1 2 237.347 2.189 20 0 BEADLO C[N@H+](Cc1c[nH]cn1)C[C@@H]1CCCC(C)(C)O1 ZINC000878884778 590640523 /nfs/dbraw/zinc/64/05/23/590640523.db2.gz LTWSIIZMEFBJPQ-LBPRGKRZSA-N 1 2 237.347 2.189 20 0 BEADLO C[N@H+](C/C=C\Cl)Cc1ccns1 ZINC000878899514 590643186 /nfs/dbraw/zinc/64/31/86/590643186.db2.gz SDVNCZKKFPQJNZ-RQOWECAXSA-N 1 2 202.710 2.327 20 0 BEADLO C[N@@H+](C/C=C\Cl)Cc1ccns1 ZINC000878899514 590643190 /nfs/dbraw/zinc/64/31/90/590643190.db2.gz SDVNCZKKFPQJNZ-RQOWECAXSA-N 1 2 202.710 2.327 20 0 BEADLO C[N@@H+](Cc1ccns1)Cc1cccc(F)n1 ZINC000878899830 590643661 /nfs/dbraw/zinc/64/36/61/590643661.db2.gz PPIWCYLZIOXPGQ-UHFFFAOYSA-N 1 2 237.303 2.309 20 0 BEADLO C[N@H+](Cc1ccns1)Cc1cccc(F)n1 ZINC000878899830 590643658 /nfs/dbraw/zinc/64/36/58/590643658.db2.gz PPIWCYLZIOXPGQ-UHFFFAOYSA-N 1 2 237.303 2.309 20 0 BEADLO CC[C@H]1CCC[C@@]1(C)C(=O)NCc1c[nH+]c[nH]1 ZINC000878907882 590645709 /nfs/dbraw/zinc/64/57/09/590645709.db2.gz RJIWCVUNGJAZFI-GXFFZTMASA-N 1 2 235.331 2.242 20 0 BEADLO CC[C@H]1CCC[C@@]1(C)C(=O)NCc1c[nH]c[nH+]1 ZINC000878907882 590645710 /nfs/dbraw/zinc/64/57/10/590645710.db2.gz RJIWCVUNGJAZFI-GXFFZTMASA-N 1 2 235.331 2.242 20 0 BEADLO Cl/C=C/C[N@@H+]1CCC[C@@H]1c1ncccn1 ZINC000878976422 590666317 /nfs/dbraw/zinc/66/63/17/590666317.db2.gz DFIQKCNKVCAGFP-JYBNPQIESA-N 1 2 223.707 2.366 20 0 BEADLO Cl/C=C/C[N@H+]1CCC[C@@H]1c1ncccn1 ZINC000878976422 590666319 /nfs/dbraw/zinc/66/63/19/590666319.db2.gz DFIQKCNKVCAGFP-JYBNPQIESA-N 1 2 223.707 2.366 20 0 BEADLO Cc1conc1C[N@@H+]1CCc2c(O)cccc2C1 ZINC000879055280 590688010 /nfs/dbraw/zinc/68/80/10/590688010.db2.gz DPBSCAREEOZYTL-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO Cc1conc1C[N@H+]1CCc2c(O)cccc2C1 ZINC000879055280 590688011 /nfs/dbraw/zinc/68/80/11/590688011.db2.gz DPBSCAREEOZYTL-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2CC23CCC3)c(C)c[nH+]1 ZINC000879075867 590693662 /nfs/dbraw/zinc/69/36/62/590693662.db2.gz ROOXIPOWPCKCGZ-LBPRGKRZSA-N 1 2 245.326 2.184 20 0 BEADLO CSCC[N@@H+]1CCO[C@](C)(C(F)(F)F)C1 ZINC000879501681 590782546 /nfs/dbraw/zinc/78/25/46/590782546.db2.gz PPRCNRSHQSWFPC-QMMMGPOBSA-N 1 2 243.294 2.003 20 0 BEADLO CSCC[N@H+]1CCO[C@](C)(C(F)(F)F)C1 ZINC000879501681 590782550 /nfs/dbraw/zinc/78/25/50/590782550.db2.gz PPRCNRSHQSWFPC-QMMMGPOBSA-N 1 2 243.294 2.003 20 0 BEADLO COC(C[NH2+][C@H](CF)c1ccc(F)cc1)OC ZINC000879659641 590844508 /nfs/dbraw/zinc/84/45/08/590844508.db2.gz DRAMUVHBEQHOBZ-LLVKDONJSA-N 1 2 245.269 2.045 20 0 BEADLO C[C@@H]([NH2+]C/C(Cl)=C\Cl)c1ccnn1C ZINC000879686101 590847972 /nfs/dbraw/zinc/84/79/72/590847972.db2.gz SOPGEAVOUKMHDR-KBUNYLKBSA-N 1 2 234.130 2.390 20 0 BEADLO CO[C@H]1CC[C@@H]([N@@H+]2OC3CCC2CC3)C1 ZINC000879799139 590877311 /nfs/dbraw/zinc/87/73/11/590877311.db2.gz GLYAKONWQAHMEA-RSJDFQLWSA-N 1 2 211.305 2.112 20 0 BEADLO CO[C@H]1CC[C@@H]([N@H+]2OC3CCC2CC3)C1 ZINC000879799139 590877313 /nfs/dbraw/zinc/87/73/13/590877313.db2.gz GLYAKONWQAHMEA-RSJDFQLWSA-N 1 2 211.305 2.112 20 0 BEADLO OCCCCCCC[N@@H+]1OC2CCC1CC2 ZINC000879799759 590877345 /nfs/dbraw/zinc/87/73/45/590877345.db2.gz IPXQTYLRTGUACZ-UHFFFAOYSA-N 1 2 227.348 2.488 20 0 BEADLO OCCCCCCC[N@H+]1OC2CCC1CC2 ZINC000879799759 590877348 /nfs/dbraw/zinc/87/73/48/590877348.db2.gz IPXQTYLRTGUACZ-UHFFFAOYSA-N 1 2 227.348 2.488 20 0 BEADLO CCOC(=O)[C@H](CC1CC1)[NH2+][C@@H]1C=CCCC1 ZINC000879982563 590904167 /nfs/dbraw/zinc/90/41/67/590904167.db2.gz GYQSUFUBUXMFDX-OLZOCXBDSA-N 1 2 237.343 2.417 20 0 BEADLO CC[C@@H]1CCC[C@]1(C)C(=O)NCc1c[nH+]cn1C ZINC000880026141 590911507 /nfs/dbraw/zinc/91/15/07/590911507.db2.gz FSPRWURQGKLOKR-RISCZKNCSA-N 1 2 249.358 2.253 20 0 BEADLO CCc1nocc1C[NH2+][C@H](C)c1nccnc1C ZINC000880108575 590926200 /nfs/dbraw/zinc/92/62/00/590926200.db2.gz BOKJHDWHKVBSIJ-SNVBAGLBSA-N 1 2 246.314 2.186 20 0 BEADLO CCc1nocc1C[NH2+][C@@H](C)c1nccnc1C ZINC000880108574 590926240 /nfs/dbraw/zinc/92/62/40/590926240.db2.gz BOKJHDWHKVBSIJ-JTQLQIEISA-N 1 2 246.314 2.186 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)c1cc(C)co1 ZINC000880191673 590955489 /nfs/dbraw/zinc/95/54/89/590955489.db2.gz MZZOGHFBEZOKKD-JTQLQIEISA-N 1 2 247.298 2.295 20 0 BEADLO CCCc1nc(C[N@@H+]2CCC[C@H](CF)C2)no1 ZINC000880232016 590961913 /nfs/dbraw/zinc/96/19/13/590961913.db2.gz DRWDGXZLPCLGHX-SNVBAGLBSA-N 1 2 241.310 2.204 20 0 BEADLO CCCc1nc(C[N@H+]2CCC[C@H](CF)C2)no1 ZINC000880232016 590961916 /nfs/dbraw/zinc/96/19/16/590961916.db2.gz DRWDGXZLPCLGHX-SNVBAGLBSA-N 1 2 241.310 2.204 20 0 BEADLO Cn1nc(C[N@@H+]2CCC[C@@H](CF)C2)cc1Cl ZINC000880238061 590970064 /nfs/dbraw/zinc/97/00/64/590970064.db2.gz NOYWTRPVPQVEJI-VIFPVBQESA-N 1 2 245.729 2.255 20 0 BEADLO Cn1nc(C[N@H+]2CCC[C@@H](CF)C2)cc1Cl ZINC000880238061 590970067 /nfs/dbraw/zinc/97/00/67/590970067.db2.gz NOYWTRPVPQVEJI-VIFPVBQESA-N 1 2 245.729 2.255 20 0 BEADLO Cc1nnc([C@H](C)[NH+]2CCC(F)CC2)s1 ZINC000880240241 590973891 /nfs/dbraw/zinc/97/38/91/590973891.db2.gz QZPMYHRAPGKSLC-ZETCQYMHSA-N 1 2 229.324 2.341 20 0 BEADLO COc1cc(C)[nH+]c(CN2CCC(F)CC2)c1 ZINC000880240232 590974067 /nfs/dbraw/zinc/97/40/67/590974067.db2.gz QRUUBKFZFHRWJP-UHFFFAOYSA-N 1 2 238.306 2.333 20 0 BEADLO Cc1nnc([C@@H](C)[NH+]2CCC(F)CC2)s1 ZINC000880240240 590974172 /nfs/dbraw/zinc/97/41/72/590974172.db2.gz QZPMYHRAPGKSLC-SSDOTTSWSA-N 1 2 229.324 2.341 20 0 BEADLO CC(C)c1noc(C[NH+]2CCC(F)CC2)n1 ZINC000880243839 590976960 /nfs/dbraw/zinc/97/69/60/590976960.db2.gz WKEQMXQWFUXYJC-UHFFFAOYSA-N 1 2 227.283 2.127 20 0 BEADLO Cc1nnc(C[N@@H+]2CCc3ccsc3[C@@H]2C)[nH]1 ZINC000880377493 591016211 /nfs/dbraw/zinc/01/62/11/591016211.db2.gz XLSIEXALCCRBGO-QMMMGPOBSA-N 1 2 248.355 2.294 20 0 BEADLO Cc1nnc(C[N@H+]2CCc3ccsc3[C@@H]2C)[nH]1 ZINC000880377493 591016217 /nfs/dbraw/zinc/01/62/17/591016217.db2.gz XLSIEXALCCRBGO-QMMMGPOBSA-N 1 2 248.355 2.294 20 0 BEADLO OC[C@H]1C=CC[N@@H+]1Cc1ccc(F)cc1Cl ZINC000880484908 591058064 /nfs/dbraw/zinc/05/80/64/591058064.db2.gz VREIFXGEGJJWBQ-LLVKDONJSA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@H]1C=CC[N@H+]1Cc1ccc(F)cc1Cl ZINC000880484908 591058069 /nfs/dbraw/zinc/05/80/69/591058069.db2.gz VREIFXGEGJJWBQ-LLVKDONJSA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@H]1C=CC[N@@H+]1Cc1cccc(F)c1Cl ZINC000880488535 591063139 /nfs/dbraw/zinc/06/31/39/591063139.db2.gz HAAJKZVDEPBXRZ-SNVBAGLBSA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@H]1C=CC[N@H+]1Cc1cccc(F)c1Cl ZINC000880488535 591063141 /nfs/dbraw/zinc/06/31/41/591063141.db2.gz HAAJKZVDEPBXRZ-SNVBAGLBSA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@H]1C=CC[N@@H+]1Cc1ccc(Cl)s1 ZINC000880487445 591065036 /nfs/dbraw/zinc/06/50/36/591065036.db2.gz ZKKVCIQXJRVEMS-MRVPVSSYSA-N 1 2 229.732 2.134 20 0 BEADLO OC[C@H]1C=CC[N@H+]1Cc1ccc(Cl)s1 ZINC000880487445 591065040 /nfs/dbraw/zinc/06/50/40/591065040.db2.gz ZKKVCIQXJRVEMS-MRVPVSSYSA-N 1 2 229.732 2.134 20 0 BEADLO OC[C@@H]1C=CC[N@@H+]1Cc1ccc(F)c(Cl)c1 ZINC000880489274 591066250 /nfs/dbraw/zinc/06/62/50/591066250.db2.gz RDVKMPSQLKKCDA-JTQLQIEISA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@@H]1C=CC[N@H+]1Cc1ccc(F)c(Cl)c1 ZINC000880489274 591066254 /nfs/dbraw/zinc/06/62/54/591066254.db2.gz RDVKMPSQLKKCDA-JTQLQIEISA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@@H]1C=CC[N@@H+]1Cc1nsc2ccccc21 ZINC000880493079 591070329 /nfs/dbraw/zinc/07/03/29/591070329.db2.gz YQVPVGCUCXYCKP-JTQLQIEISA-N 1 2 246.335 2.029 20 0 BEADLO OC[C@@H]1C=CC[N@H+]1Cc1nsc2ccccc21 ZINC000880493079 591070333 /nfs/dbraw/zinc/07/03/33/591070333.db2.gz YQVPVGCUCXYCKP-JTQLQIEISA-N 1 2 246.335 2.029 20 0 BEADLO Fc1ccc(C[N@@H+]2CCc3ncncc3C2)cc1 ZINC000880592774 591102976 /nfs/dbraw/zinc/10/29/76/591102976.db2.gz ASOABMIDMSASRD-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1ccc(C[N@H+]2CCc3ncncc3C2)cc1 ZINC000880592774 591102980 /nfs/dbraw/zinc/10/29/80/591102980.db2.gz ASOABMIDMSASRD-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO O=C(NC[C@H]1C=CCC1)c1ccc2[nH+]ccn2c1 ZINC000881491853 591215214 /nfs/dbraw/zinc/21/52/14/591215214.db2.gz BGFJEAKGGBCMRU-NSHDSACASA-N 1 2 241.294 2.030 20 0 BEADLO CCC[C@@H](C)CCNC(=O)c1c[nH+]c(C)[nH]1 ZINC000881530368 591231392 /nfs/dbraw/zinc/23/13/92/591231392.db2.gz QOHXZYWHDHDSSK-SECBINFHSA-N 1 2 223.320 2.274 20 0 BEADLO Cc1ncnc(Nc2ccc(N(C)C)[nH+]c2)c1C ZINC000881786188 591271038 /nfs/dbraw/zinc/27/10/38/591271038.db2.gz FGBAFFXMXGFXGJ-UHFFFAOYSA-N 1 2 243.314 2.298 20 0 BEADLO CNc1ccc(Nc2nc(C)cnc2C)c[nH+]1 ZINC000881818679 591272913 /nfs/dbraw/zinc/27/29/13/591272913.db2.gz QAYRJGOZAQCSGA-UHFFFAOYSA-N 1 2 229.287 2.274 20 0 BEADLO CNc1ccc(Nc2ncnc(C)c2C)c[nH+]1 ZINC000881816706 591273044 /nfs/dbraw/zinc/27/30/44/591273044.db2.gz ARALKKHHFUUXPC-UHFFFAOYSA-N 1 2 229.287 2.274 20 0 BEADLO Cc1cc(CNc2nc[nH+]c(C)c2C)no1 ZINC000881844479 591274158 /nfs/dbraw/zinc/27/41/58/591274158.db2.gz NMLCXRUZFQSYDV-UHFFFAOYSA-N 1 2 218.260 2.002 20 0 BEADLO CC[C@@H](C)[C@](C)(O)CNc1nc[nH+]c(C)c1C ZINC000881978070 591284923 /nfs/dbraw/zinc/28/49/23/591284923.db2.gz XNLNNJLOACZUEJ-NOZJJQNGSA-N 1 2 237.347 2.302 20 0 BEADLO Cc1ccc([C@H](O)CNc2nc[nH+]c(C)c2C)o1 ZINC000882011296 591287402 /nfs/dbraw/zinc/28/74/02/591287402.db2.gz ZTEKHCNOYQHINL-LLVKDONJSA-N 1 2 247.298 2.140 20 0 BEADLO CC[C@H](O)CCCNc1nc[nH+]c(C)c1C ZINC000882015349 591288001 /nfs/dbraw/zinc/28/80/01/591288001.db2.gz UDXYNWSAFRHCLQ-NSHDSACASA-N 1 2 223.320 2.056 20 0 BEADLO Cc1[nH+]cnc(NCCC(F)(F)F)c1C ZINC000882035684 591290309 /nfs/dbraw/zinc/29/03/09/591290309.db2.gz OQESMWUVVNNEOV-UHFFFAOYSA-N 1 2 219.210 2.458 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2CCCSC2)c1C ZINC000882054579 591292225 /nfs/dbraw/zinc/29/22/25/591292225.db2.gz PXIOQASKWXEWBW-JTQLQIEISA-N 1 2 223.345 2.401 20 0 BEADLO Cc1[nH+]cnc(N[C@H](C)C[C@H]2CCOC2)c1C ZINC000882088805 591295793 /nfs/dbraw/zinc/29/57/93/591295793.db2.gz MSGVRTGZSZOHQA-BXKDBHETSA-N 1 2 235.331 2.320 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2CCC[C@@H]3OCC[C@@H]32)c1C ZINC000882092920 591296441 /nfs/dbraw/zinc/29/64/41/591296441.db2.gz NPLXRIJROZJYKR-UPJWGTAASA-N 1 2 247.342 2.463 20 0 BEADLO Cc1[nH+]cnc(N2CC3(CC(F)C3)C2)c1C ZINC000882126702 591302156 /nfs/dbraw/zinc/30/21/56/591302156.db2.gz BZPMNULQHTXMJS-UHFFFAOYSA-N 1 2 221.279 2.032 20 0 BEADLO Cc1ocnc1CNc1nc[nH+]c(C)c1C ZINC000882140029 591304812 /nfs/dbraw/zinc/30/48/12/591304812.db2.gz FUWVVWFEPALBOA-UHFFFAOYSA-N 1 2 218.260 2.002 20 0 BEADLO Cc1[nH+]cnc(N2CC[C@@H](C3CC3)C2)c1C ZINC000882144030 591305453 /nfs/dbraw/zinc/30/54/53/591305453.db2.gz AMTBHDIWIAWTLE-GFCCVEGCSA-N 1 2 217.316 2.330 20 0 BEADLO Cc1[nH+]cnc(NC2C[C@H](C)O[C@@H](C)C2)c1C ZINC000882148622 591306266 /nfs/dbraw/zinc/30/62/66/591306266.db2.gz FQNRSNCSZXGKTJ-IUCAKERBSA-N 1 2 235.331 2.461 20 0 BEADLO COC1(CNc2nc[nH+]c(C)c2C)CCC1 ZINC000882168520 591310565 /nfs/dbraw/zinc/31/05/65/591310565.db2.gz HDWPKDROQNHPSI-UHFFFAOYSA-N 1 2 221.304 2.074 20 0 BEADLO Cc1cnccc1CNc1nc[nH+]c(C)c1C ZINC000882213304 591317451 /nfs/dbraw/zinc/31/74/51/591317451.db2.gz GQTCIWRFVUJHQY-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2CCC=CO2)c1C ZINC000882229489 591317700 /nfs/dbraw/zinc/31/77/00/591317700.db2.gz MQQRQAULRWUGMG-NSHDSACASA-N 1 2 219.288 2.198 20 0 BEADLO C[C@H]1CC[C@@H](Nc2cc(CO)cc[nH+]2)C1 ZINC000882228925 591317962 /nfs/dbraw/zinc/31/79/62/591317962.db2.gz GIFYAVGETHNDRA-GXSJLCMTSA-N 1 2 206.289 2.174 20 0 BEADLO CCC(O)(CC)CCNc1nc[nH+]c(C)c1C ZINC000882243149 591320576 /nfs/dbraw/zinc/32/05/76/591320576.db2.gz UTIJDINYSVRIFN-UHFFFAOYSA-N 1 2 237.347 2.447 20 0 BEADLO CCC[C@]1(CO)CCN(c2nc[nH+]c(C)c2C)C1 ZINC000882381230 591340432 /nfs/dbraw/zinc/34/04/32/591340432.db2.gz SOGXMYCHKZWWHB-AWEZNQCLSA-N 1 2 249.358 2.082 20 0 BEADLO CCc1nocc1CN(C)c1nc[nH+]c(C)c1C ZINC000882402619 591343064 /nfs/dbraw/zinc/34/30/64/591343064.db2.gz NYSLDEVVVKKFKD-UHFFFAOYSA-N 1 2 246.314 2.280 20 0 BEADLO Cc1[nH+]cnc(N[C@H](C)CCCCO)c1C ZINC000882410879 591344378 /nfs/dbraw/zinc/34/43/78/591344378.db2.gz NNVYUBYQRFSQBU-SECBINFHSA-N 1 2 223.320 2.056 20 0 BEADLO CC[C@@](C)(CNc1nc[nH+]c(C)c1C)OC ZINC000882417555 591345439 /nfs/dbraw/zinc/34/54/39/591345439.db2.gz YLBNZHDADLAKGS-LBPRGKRZSA-N 1 2 223.320 2.320 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2CC23CCOCC3)c1C ZINC000882423386 591345897 /nfs/dbraw/zinc/34/58/97/591345897.db2.gz RFICLCLOPRPKHA-NSHDSACASA-N 1 2 233.315 2.074 20 0 BEADLO Cc1ncnc(N[C@@H]2C[C@@H](C)n3cc[nH+]c32)c1C ZINC000882426685 591346418 /nfs/dbraw/zinc/34/64/18/591346418.db2.gz PFUMMVSKLSUQOV-LDYMZIIASA-N 1 2 243.314 2.408 20 0 BEADLO Cc1cnc(C)c(N[C@H]2C[C@H](C)n3cc[nH+]c32)n1 ZINC000882426598 591346427 /nfs/dbraw/zinc/34/64/27/591346427.db2.gz NBATXDMUWAAUSG-ONGXEEELSA-N 1 2 243.314 2.408 20 0 BEADLO Cc1[nH+]cnc(NC[C@H]2CC[C@H](C)O2)c1C ZINC000882438458 591348981 /nfs/dbraw/zinc/34/89/81/591348981.db2.gz FRBQIANGCZWMHB-GZMMTYOYSA-N 1 2 221.304 2.073 20 0 BEADLO CO[C@H]1C[C@H](Nc2nc[nH+]c(C)c2C)C12CCC2 ZINC000882443121 591349588 /nfs/dbraw/zinc/34/95/88/591349588.db2.gz QMQLJSSZIJXOFM-RYUDHWBXSA-N 1 2 247.342 2.463 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2CS[C@H](C)C2)c1C ZINC000882456337 591351736 /nfs/dbraw/zinc/35/17/36/591351736.db2.gz JOPSHOSZLCGCQS-XCBNKYQSSA-N 1 2 223.345 2.399 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2C[C@@H](C)O[C@@H]2C)c1C ZINC000882459683 591352423 /nfs/dbraw/zinc/35/24/23/591352423.db2.gz MEVHJDNJICVPOP-FXAINCCUSA-N 1 2 235.331 2.319 20 0 BEADLO CC[C@@H]1C[C@H](Nc2nc[nH+]c(C)c2C)CCO1 ZINC000882472524 591353882 /nfs/dbraw/zinc/35/38/82/591353882.db2.gz RIVDPAPZCREKQQ-VXGBXAGGSA-N 1 2 235.331 2.463 20 0 BEADLO Cc1[nH+]cnc(NC[C@H]2CCC[C@H](C)O2)c1C ZINC000882620673 591401555 /nfs/dbraw/zinc/40/15/55/591401555.db2.gz RLOUKODRNWXBNA-JOYOIKCWSA-N 1 2 235.331 2.463 20 0 BEADLO CC(C)(C)c1nc(NC2CSC2)cc[nH+]1 ZINC000882626233 591402582 /nfs/dbraw/zinc/40/25/82/591402582.db2.gz WHCXUEBATBMHDZ-UHFFFAOYSA-N 1 2 223.345 2.301 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2CCOC2(C)C)c1C ZINC000882635407 591404502 /nfs/dbraw/zinc/40/45/02/591404502.db2.gz GDBLIMQAUJUVHR-NSHDSACASA-N 1 2 235.331 2.320 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@H]2CSC[C@@H]2C1 ZINC000882697416 591413724 /nfs/dbraw/zinc/41/37/24/591413724.db2.gz FLOPJDIBSMWDOA-UWVGGRQHSA-N 1 2 238.331 2.410 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2C[C@H]2C2CCOCC2)c1C ZINC000882707014 591415795 /nfs/dbraw/zinc/41/57/95/591415795.db2.gz XWDQDJXZNNUICN-QWHCGFSZSA-N 1 2 247.342 2.320 20 0 BEADLO Cc1[nH+]cnc(NCCc2ccns2)c1C ZINC000882759426 591431791 /nfs/dbraw/zinc/43/17/91/591431791.db2.gz BMMOERYDLKYAAL-UHFFFAOYSA-N 1 2 234.328 2.205 20 0 BEADLO c1coc(C[NH+]2CCN(c3nccs3)CC2)c1 ZINC000130127528 591440299 /nfs/dbraw/zinc/44/02/99/591440299.db2.gz ZEULMIXIRBNJOU-UHFFFAOYSA-N 1 2 249.339 2.058 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CCC[C@@H](CF)C2)[nH+]1 ZINC000882802121 591443778 /nfs/dbraw/zinc/44/37/78/591443778.db2.gz QLKHWXWQSPLVJT-JTQLQIEISA-N 1 2 248.305 2.452 20 0 BEADLO Cc1[nH+]cnc(N2CCC[C@H](CF)C2)c1C ZINC000882804018 591444689 /nfs/dbraw/zinc/44/46/89/591444689.db2.gz OVUKOUQPVZPXHZ-LLVKDONJSA-N 1 2 223.295 2.279 20 0 BEADLO FC1CCN(c2cc[nH+]c(C3CC3)n2)CC1 ZINC000882807051 591446476 /nfs/dbraw/zinc/44/64/76/591446476.db2.gz DIBRDWJCEQBLND-UHFFFAOYSA-N 1 2 221.279 2.292 20 0 BEADLO Nc1nc(N2CC[C@H](CF)C2)[nH+]c2ccccc12 ZINC000882840631 591451291 /nfs/dbraw/zinc/45/12/91/591451291.db2.gz AEUAQAARAUHXNR-SECBINFHSA-N 1 2 246.289 2.008 20 0 BEADLO Cc1nc(N2CC[C@@H](c3nccs3)C2)cc[nH+]1 ZINC000882859567 591455447 /nfs/dbraw/zinc/45/54/47/591455447.db2.gz IRWCVPPAKHQCCF-SNVBAGLBSA-N 1 2 246.339 2.235 20 0 BEADLO CC(C)c1c[nH]c(C[NH2+]Cc2cccnc2)n1 ZINC000882878761 591460034 /nfs/dbraw/zinc/46/00/34/591460034.db2.gz QZRYXZFOKVOTGA-UHFFFAOYSA-N 1 2 230.315 2.218 20 0 BEADLO OCc1cc[nH+]c(NC[C@H]2CCC3(CCC3)O2)c1 ZINC000882972701 591489059 /nfs/dbraw/zinc/48/90/59/591489059.db2.gz VFWDUJVXVWGTPG-GFCCVEGCSA-N 1 2 248.326 2.088 20 0 BEADLO CC(C)c1c[nH]c(C[NH2+][C@H](C)c2cnn(C)c2)n1 ZINC000883017070 591515383 /nfs/dbraw/zinc/51/53/83/591515383.db2.gz VUWKYQFIAQGEDP-SNVBAGLBSA-N 1 2 247.346 2.117 20 0 BEADLO C[C@@H]1CCC[C@H](CC(=O)NC2=[NH+]CCS2)C1 ZINC000130764618 591518397 /nfs/dbraw/zinc/51/83/97/591518397.db2.gz CZJPYORGIISZCN-ZJUUUORDSA-N 1 2 240.372 2.422 20 0 BEADLO Cc1cc(C[NH2+]Cc2cc(C)nc(C)c2)no1 ZINC000883146869 591550935 /nfs/dbraw/zinc/55/09/35/591550935.db2.gz BWYSOLRNASJNSU-UHFFFAOYSA-N 1 2 231.299 2.285 20 0 BEADLO Cc1cc(NCc2cn[nH]c2)c[nH+]c1C ZINC000883341527 591620314 /nfs/dbraw/zinc/62/03/14/591620314.db2.gz RXOWIBUXKLQLDA-UHFFFAOYSA-N 1 2 202.261 2.034 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]C[C@H]1CCC2(CCC2)O1 ZINC000883356117 591627503 /nfs/dbraw/zinc/62/75/03/591627503.db2.gz GAYWIELZOKGCAL-ZYHUDNBSSA-N 1 2 249.358 2.470 20 0 BEADLO CC(=O)CCC(=O)OCc1ccc(C)[nH+]c1C ZINC000800096932 591821797 /nfs/dbraw/zinc/82/17/97/591821797.db2.gz PYLXLNPVFDCLLJ-UHFFFAOYSA-N 1 2 235.283 2.111 20 0 BEADLO Cc1nc(N[C@H](C)C[C@H](O)c2ccco2)cc[nH+]1 ZINC000133669327 591845803 /nfs/dbraw/zinc/84/58/03/591845803.db2.gz BUHQDFBAXHFZGU-KOLCDFICSA-N 1 2 247.298 2.302 20 0 BEADLO CCc1nc(NC2CC(F)(F)C2)cc[nH+]1 ZINC000884486035 591954555 /nfs/dbraw/zinc/95/45/55/591954555.db2.gz MOQCMCGLVAZGSF-UHFFFAOYSA-N 1 2 213.231 2.249 20 0 BEADLO CCc1nc(NCc2ccc(OC)cn2)cc[nH+]1 ZINC000884488079 591954686 /nfs/dbraw/zinc/95/46/86/591954686.db2.gz NNJKTMCUZVELKX-UHFFFAOYSA-N 1 2 244.298 2.055 20 0 BEADLO CCc1nc(N[C@@H]2C[C@H]2C2CC2)cc[nH+]1 ZINC000884494694 591955739 /nfs/dbraw/zinc/95/57/39/591955739.db2.gz ALCNRWQBGBYYNW-VHSXEESVSA-N 1 2 203.289 2.249 20 0 BEADLO CCc1nc(N[C@@H](CO)CC2CCC2)cc[nH+]1 ZINC000884493036 591956221 /nfs/dbraw/zinc/95/62/21/591956221.db2.gz KHWPZSJHNJIXFP-LLVKDONJSA-N 1 2 235.331 2.002 20 0 BEADLO CCc1nc(N2CCC(F)(F)CC2)cc[nH+]1 ZINC000884493943 591956384 /nfs/dbraw/zinc/95/63/84/591956384.db2.gz HARDYFKDUXMCAH-UHFFFAOYSA-N 1 2 227.258 2.275 20 0 BEADLO CCc1nc(N2CCC3(CC3)C2)cc[nH+]1 ZINC000884497396 591957211 /nfs/dbraw/zinc/95/72/11/591957211.db2.gz XHMRIHQYTBYJPO-UHFFFAOYSA-N 1 2 203.289 2.029 20 0 BEADLO CCc1nc(N[C@@H]2CSC[C@@H]2C)cc[nH+]1 ZINC000884505285 591960113 /nfs/dbraw/zinc/96/01/13/591960113.db2.gz CWLUHWKBABYEQN-DTWKUNHWSA-N 1 2 223.345 2.202 20 0 BEADLO CCc1nc(N[C@H]2CSC[C@H]2C)cc[nH+]1 ZINC000884505284 591960392 /nfs/dbraw/zinc/96/03/92/591960392.db2.gz CWLUHWKBABYEQN-BDAKNGLRSA-N 1 2 223.345 2.202 20 0 BEADLO CCc1nc(N2CCCO[C@@H](C(C)C)C2)cc[nH+]1 ZINC000884517184 591964115 /nfs/dbraw/zinc/96/41/15/591964115.db2.gz GXJZMJFEFDXQCI-GFCCVEGCSA-N 1 2 249.358 2.290 20 0 BEADLO CCc1nc(N2CC[C@@H](O)CC(C)(C)C2)cc[nH+]1 ZINC000884523240 591965895 /nfs/dbraw/zinc/96/58/95/591965895.db2.gz SFHCSXAENMHJMN-LLVKDONJSA-N 1 2 249.358 2.026 20 0 BEADLO CCc1nc(N[C@@H](C)c2nccc(C)n2)cc[nH+]1 ZINC000884533573 591969849 /nfs/dbraw/zinc/96/98/49/591969849.db2.gz LXSSECCNHROLOA-JTQLQIEISA-N 1 2 243.314 2.311 20 0 BEADLO CCc1nc(N2CCC[C@@H](CCO)CC2)cc[nH+]1 ZINC000884534537 591970717 /nfs/dbraw/zinc/97/07/17/591970717.db2.gz IVNUWPWLUJRBJJ-GFCCVEGCSA-N 1 2 249.358 2.028 20 0 BEADLO CCc1nc(N2CC(CC(F)F)C2)cc[nH+]1 ZINC000884537385 591971548 /nfs/dbraw/zinc/97/15/48/591971548.db2.gz ZCCJCVVWVJZEGK-UHFFFAOYSA-N 1 2 227.258 2.130 20 0 BEADLO CCc1nc(NCc2ccc(CO)cc2)cc[nH+]1 ZINC000884541802 591972218 /nfs/dbraw/zinc/97/22/18/591972218.db2.gz OHZFWNPYIXTLRS-UHFFFAOYSA-N 1 2 243.310 2.143 20 0 BEADLO CCc1nc(N2C[C@@H](CC)OC[C@@H]2C)cc[nH+]1 ZINC000884544588 591973179 /nfs/dbraw/zinc/97/31/79/591973179.db2.gz KPFJYHVQKIBFIW-WDEREUQCSA-N 1 2 235.331 2.043 20 0 BEADLO CCc1nc(N(CC)[C@H]2CCCOC2)cc[nH+]1 ZINC000884545062 591974121 /nfs/dbraw/zinc/97/41/21/591974121.db2.gz XPASUMDVILGKNI-NSHDSACASA-N 1 2 235.331 2.044 20 0 BEADLO CCc1nc(N2C[C@@H](CC)OC[C@@H]2CC)cc[nH+]1 ZINC000884545158 591974565 /nfs/dbraw/zinc/97/45/65/591974565.db2.gz ZTKMWMKQKQGLEQ-NWDGAFQWSA-N 1 2 249.358 2.433 20 0 BEADLO CCc1nc(N2C[C@@H]3CCCC[C@@H]32)cc[nH+]1 ZINC000884549731 591976504 /nfs/dbraw/zinc/97/65/04/591976504.db2.gz MYCHSGSPHYYCPF-QWRGUYRKSA-N 1 2 217.316 2.418 20 0 BEADLO CCc1nc(N[C@@H](C)c2cnccn2)cc[nH+]1 ZINC000884552392 591976539 /nfs/dbraw/zinc/97/65/39/591976539.db2.gz ZHYAUNMPSYGHNS-VIFPVBQESA-N 1 2 229.287 2.002 20 0 BEADLO CCc1nc(NC[C@H]2CCC[C@H](C)O2)cc[nH+]1 ZINC000884557159 591978394 /nfs/dbraw/zinc/97/83/94/591978394.db2.gz ISTCULGMZLCUPC-WDEREUQCSA-N 1 2 235.331 2.409 20 0 BEADLO CCc1nc(NC[C@@H]2CCC[C@@H](C)O2)cc[nH+]1 ZINC000884557157 591978614 /nfs/dbraw/zinc/97/86/14/591978614.db2.gz ISTCULGMZLCUPC-MNOVXSKESA-N 1 2 235.331 2.409 20 0 BEADLO CCc1nc(NCC2(O)CCC(C)CC2)cc[nH+]1 ZINC000884561199 591980167 /nfs/dbraw/zinc/98/01/67/591980167.db2.gz SGRLBFMWXXQKGR-UHFFFAOYSA-N 1 2 249.358 2.392 20 0 BEADLO CCc1nc(N2CC3CC2(C)C3)cc[nH+]1 ZINC000884561681 591980254 /nfs/dbraw/zinc/98/02/54/591980254.db2.gz HLKIPINHKMFZDF-UHFFFAOYSA-N 1 2 203.289 2.028 20 0 BEADLO CCc1nc(NC[C@@H]2CCOC2(C)C)cc[nH+]1 ZINC000884560384 591980365 /nfs/dbraw/zinc/98/03/65/591980365.db2.gz WOPYBRMCLUAMLZ-JTQLQIEISA-N 1 2 235.331 2.266 20 0 BEADLO CCc1nc(N[C@H]2[C@@H](C)[C@H](C)O[C@H]2C)cc[nH+]1 ZINC000884565729 591981847 /nfs/dbraw/zinc/98/18/47/591981847.db2.gz RKAFNRCTKWVCSN-YVNDNENWSA-N 1 2 235.331 2.263 20 0 BEADLO CCc1nc(N[C@@H]2C[C@@H](C)O[C@H]2C)cc[nH+]1 ZINC000884570711 591982227 /nfs/dbraw/zinc/98/22/27/591982227.db2.gz WQIOLNLCQUOGSL-KXUCPTDWSA-N 1 2 221.304 2.017 20 0 BEADLO CCc1nc(N[C@@H]2CO[C@H](C3CC3)C2)cc[nH+]1 ZINC000884566136 591982566 /nfs/dbraw/zinc/98/25/66/591982566.db2.gz CIHZOCVXBRCRDM-QWRGUYRKSA-N 1 2 233.315 2.018 20 0 BEADLO CCc1nc(N[C@@H]2CO[C@@H](C3CC3)C2)cc[nH+]1 ZINC000884566137 591982688 /nfs/dbraw/zinc/98/26/88/591982688.db2.gz CIHZOCVXBRCRDM-WDEREUQCSA-N 1 2 233.315 2.018 20 0 BEADLO CCc1nc(N[C@H]2C[C@H](SC)C2)cc[nH+]1 ZINC000884571002 591983930 /nfs/dbraw/zinc/98/39/30/591983930.db2.gz DWQDWDXFMDCCJV-KYZUINATSA-N 1 2 223.345 2.345 20 0 BEADLO CCc1nc(N[C@H]2CC23CCC3)cc[nH+]1 ZINC000884579501 591986018 /nfs/dbraw/zinc/98/60/18/591986018.db2.gz BBGIFRUCMUAPPL-VIFPVBQESA-N 1 2 203.289 2.394 20 0 BEADLO c1cc2[nH+]ccc(N3C[C@@H]4C[C@@H]4C3)c2cn1 ZINC000884588368 591988528 /nfs/dbraw/zinc/98/85/28/591988528.db2.gz GMUFAPSISSDLAM-AOOOYVTPSA-N 1 2 211.268 2.086 20 0 BEADLO CNc1nc(N2C[C@@H]3C[C@@H]3C2)[nH+]c2ccccc21 ZINC000884591175 591990044 /nfs/dbraw/zinc/99/00/44/591990044.db2.gz MTSFXMDZKDQCMG-AOOOYVTPSA-N 1 2 240.310 2.128 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1CC2(CCC2)CO1 ZINC000884659926 592006186 /nfs/dbraw/zinc/00/61/86/592006186.db2.gz HECORPFJODSUKE-LLVKDONJSA-N 1 2 248.326 2.461 20 0 BEADLO OCc1cc[nH+]c(NC[C@@H]2C[C@H]3C[C@H]3C2)c1 ZINC000884675702 592009223 /nfs/dbraw/zinc/00/92/23/592009223.db2.gz MUMFPLVFMNZMII-ZSBIGDGJSA-N 1 2 218.300 2.032 20 0 BEADLO c1ccc(N2CC[C@@H]([C@@H]3CCCO3)C2)[nH+]c1 ZINC000884731306 592015917 /nfs/dbraw/zinc/01/59/17/592015917.db2.gz WLNGAVBOFNSYMA-NEPJUHHUSA-N 1 2 218.300 2.087 20 0 BEADLO Cc1cc(N(C)CCCF)nc(C2CC2)[nH+]1 ZINC000884856754 592024315 /nfs/dbraw/zinc/02/43/15/592024315.db2.gz KITZRIQOOYMAMT-UHFFFAOYSA-N 1 2 223.295 2.458 20 0 BEADLO CN(CCCF)c1[nH+]cnc2[nH]c(Cl)cc21 ZINC000884857090 592024900 /nfs/dbraw/zinc/02/49/00/592024900.db2.gz PCJCDOVTJVDMJA-UHFFFAOYSA-N 1 2 242.685 2.359 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@@H+]1CCSC(F)(F)F ZINC000885940460 592110482 /nfs/dbraw/zinc/11/04/82/592110482.db2.gz KBCKFXDZXLCGBJ-SFYZADRCSA-N 1 2 243.294 2.349 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@H+]1CCSC(F)(F)F ZINC000885940460 592110484 /nfs/dbraw/zinc/11/04/84/592110484.db2.gz KBCKFXDZXLCGBJ-SFYZADRCSA-N 1 2 243.294 2.349 20 0 BEADLO COC(=O)c1ccc(C[NH2+]Cc2cc(C)co2)o1 ZINC000885989203 592122847 /nfs/dbraw/zinc/12/28/47/592122847.db2.gz YCDGMESWLAEAHY-UHFFFAOYSA-N 1 2 249.266 2.257 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NCC1CCC=CCC1 ZINC000886018244 592131881 /nfs/dbraw/zinc/13/18/81/592131881.db2.gz YGGUVPDNDPVQJF-UHFFFAOYSA-N 1 2 247.342 2.123 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)NCC1CCC=CCC1 ZINC000886018244 592131884 /nfs/dbraw/zinc/13/18/84/592131884.db2.gz YGGUVPDNDPVQJF-UHFFFAOYSA-N 1 2 247.342 2.123 20 0 BEADLO Cc1n[nH]c(CNc2ccc(C)[nH+]c2)c1C ZINC000886025013 592134709 /nfs/dbraw/zinc/13/47/09/592134709.db2.gz BQBOCCKZXWIJDM-UHFFFAOYSA-N 1 2 216.288 2.342 20 0 BEADLO FC(F)(F)SCC[N@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC000886028260 592135757 /nfs/dbraw/zinc/13/57/57/592135757.db2.gz OCJCZJSDXYUMAN-OCAPTIKFSA-N 1 2 241.278 2.103 20 0 BEADLO FC(F)(F)SCC[N@@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC000886028260 592135759 /nfs/dbraw/zinc/13/57/59/592135759.db2.gz OCJCZJSDXYUMAN-OCAPTIKFSA-N 1 2 241.278 2.103 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000886092299 592146511 /nfs/dbraw/zinc/14/65/11/592146511.db2.gz SWGBLNGPKZFWOO-MRVPVSSYSA-N 1 2 233.237 2.102 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000886092299 592146513 /nfs/dbraw/zinc/14/65/13/592146513.db2.gz SWGBLNGPKZFWOO-MRVPVSSYSA-N 1 2 233.237 2.102 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000886092299 592146514 /nfs/dbraw/zinc/14/65/14/592146514.db2.gz SWGBLNGPKZFWOO-MRVPVSSYSA-N 1 2 233.237 2.102 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000886092299 592146516 /nfs/dbraw/zinc/14/65/16/592146516.db2.gz SWGBLNGPKZFWOO-MRVPVSSYSA-N 1 2 233.237 2.102 20 0 BEADLO Clc1ccc(C[NH2+][C@H]2CCn3ccnc32)nc1 ZINC000886130224 592160086 /nfs/dbraw/zinc/16/00/86/592160086.db2.gz YXAFWAFHIPVZGF-NSHDSACASA-N 1 2 248.717 2.166 20 0 BEADLO CCn1ccc(C[NH2+]Cc2cc(C)co2)n1 ZINC000886144688 592162618 /nfs/dbraw/zinc/16/26/18/592162618.db2.gz DNTYJFHMLWLPID-UHFFFAOYSA-N 1 2 219.288 2.094 20 0 BEADLO c1cnc2c(c1)C[N@@H+](C[C@@H]1CC[C@@H](C3CC3)O1)C2 ZINC000886186216 592172416 /nfs/dbraw/zinc/17/24/16/592172416.db2.gz SCYRIOGXHXLMQY-ZFWWWQNUSA-N 1 2 244.338 2.355 20 0 BEADLO c1cnc2c(c1)C[N@H+](C[C@@H]1CC[C@@H](C3CC3)O1)C2 ZINC000886186216 592172418 /nfs/dbraw/zinc/17/24/18/592172418.db2.gz SCYRIOGXHXLMQY-ZFWWWQNUSA-N 1 2 244.338 2.355 20 0 BEADLO FC(F)(F)SCC[N@@H+]1CCOCC12CC2 ZINC000886194590 592173696 /nfs/dbraw/zinc/17/36/96/592173696.db2.gz VFXLJMFHDRRCPJ-UHFFFAOYSA-N 1 2 241.278 2.104 20 0 BEADLO FC(F)(F)SCC[N@H+]1CCOCC12CC2 ZINC000886194590 592173697 /nfs/dbraw/zinc/17/36/97/592173697.db2.gz VFXLJMFHDRRCPJ-UHFFFAOYSA-N 1 2 241.278 2.104 20 0 BEADLO Cc1occc1C[NH2+][C@H](C)c1ncco1 ZINC000886272034 592192782 /nfs/dbraw/zinc/19/27/82/592192782.db2.gz FINOBXIYTXEXSE-MRVPVSSYSA-N 1 2 206.245 2.427 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2ncco2)cn1 ZINC000886274615 592194670 /nfs/dbraw/zinc/19/46/70/592194670.db2.gz XMRCEFSJNJHKGL-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO COc1cccc(NCc2cn(C)c[nH+]2)c1OC ZINC000886276166 592195431 /nfs/dbraw/zinc/19/54/31/592195431.db2.gz ZIMLQOYQZHKZCR-UHFFFAOYSA-N 1 2 247.298 2.049 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)C[C@@H]1CC[C@@H](C2CC2)O1 ZINC000886305997 592203525 /nfs/dbraw/zinc/20/35/25/592203525.db2.gz WFFXKPAYOQPLMX-KBPBESRZSA-N 1 2 249.358 2.108 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)C[C@@H]1CC[C@@H](C2CC2)O1 ZINC000886305997 592203526 /nfs/dbraw/zinc/20/35/26/592203526.db2.gz WFFXKPAYOQPLMX-KBPBESRZSA-N 1 2 249.358 2.108 20 0 BEADLO Cc1cc(C[N@@H+]2CCCn3nncc3C2)cs1 ZINC000886466944 592229170 /nfs/dbraw/zinc/22/91/70/592229170.db2.gz PMVIEJVLHYLGNZ-UHFFFAOYSA-N 1 2 248.355 2.054 20 0 BEADLO Cc1cc(C[N@H+]2CCCn3nncc3C2)cs1 ZINC000886466944 592229173 /nfs/dbraw/zinc/22/91/73/592229173.db2.gz PMVIEJVLHYLGNZ-UHFFFAOYSA-N 1 2 248.355 2.054 20 0 BEADLO COC(=O)[C@H]1CC[C@H]([NH2+]c2ccc(OC)cc2)C1 ZINC000886564228 592260999 /nfs/dbraw/zinc/26/09/99/592260999.db2.gz QLWKKMFWOKQQMT-JQWIXIFHSA-N 1 2 249.310 2.449 20 0 BEADLO CCC/C=C/C(=O)N1CCc2c([nH+]cn2CC)C1 ZINC000886607955 592274064 /nfs/dbraw/zinc/27/40/64/592274064.db2.gz DDNLLGGUSVYELF-VOTSOKGWSA-N 1 2 247.342 2.144 20 0 BEADLO CCC/C=C\C(=O)N1CCc2c([nH+]cn2CC)C1 ZINC000886607954 592274808 /nfs/dbraw/zinc/27/48/08/592274808.db2.gz DDNLLGGUSVYELF-SREVYHEPSA-N 1 2 247.342 2.144 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCc2cccnc21)c1ccn(C)n1 ZINC000886625718 592281652 /nfs/dbraw/zinc/28/16/52/592281652.db2.gz YJCQEAJGRMXHIY-MFKMUULPSA-N 1 2 242.326 2.153 20 0 BEADLO COC(=O)[C@@H]1CC[C@@H](Nc2c[nH+]c(C)c(C)c2)C1 ZINC000886651771 592290192 /nfs/dbraw/zinc/29/01/92/592290192.db2.gz QOSNVBOFRAPQEO-VXGBXAGGSA-N 1 2 248.326 2.452 20 0 BEADLO Fc1cccc2c1CC[C@@H]2[NH2+]Cc1cnsn1 ZINC000886924114 592397557 /nfs/dbraw/zinc/39/75/57/592397557.db2.gz JNRWJVYAGDTVGB-LBPRGKRZSA-N 1 2 249.314 2.454 20 0 BEADLO O=c1cc(C[N@@H+](CC(F)F)C2CCC2)cc[nH]1 ZINC000887102272 592443401 /nfs/dbraw/zinc/44/34/01/592443401.db2.gz JKFQWKDFKHKENB-UHFFFAOYSA-N 1 2 242.269 2.407 20 0 BEADLO O=c1cc(C[N@H+](CC(F)F)C2CCC2)cc[nH]1 ZINC000887102272 592443402 /nfs/dbraw/zinc/44/34/02/592443402.db2.gz JKFQWKDFKHKENB-UHFFFAOYSA-N 1 2 242.269 2.407 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@@]12C[C@@H]1CC[C@@H](C1)C2 ZINC000887330039 592481707 /nfs/dbraw/zinc/48/17/07/592481707.db2.gz WRAUFORZLUKSLT-YABSGUDNSA-N 1 2 236.359 2.123 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)NC[C@H]1CCC=CCCC1 ZINC000890047232 592671072 /nfs/dbraw/zinc/67/10/72/592671072.db2.gz MKKPJRDEOOYRPW-LBPRGKRZSA-N 1 2 247.342 2.205 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)NC[C@H]1CCC=CCCC1 ZINC000890047232 592671073 /nfs/dbraw/zinc/67/10/73/592671073.db2.gz MKKPJRDEOOYRPW-LBPRGKRZSA-N 1 2 247.342 2.205 20 0 BEADLO Cn1c[nH+]c(CNC(=O)C2(C3CCC3)CCC2)c1 ZINC000890105119 592681251 /nfs/dbraw/zinc/68/12/51/592681251.db2.gz WPNBHMZOPPXYLE-UHFFFAOYSA-N 1 2 247.342 2.007 20 0 BEADLO CC[C@H]1CC[C@H](C(=O)NCc2cn(C)c[nH+]2)CC1 ZINC000890106724 592682055 /nfs/dbraw/zinc/68/20/55/592682055.db2.gz BVPIGZUVHSIULQ-HAQNSBGRSA-N 1 2 249.358 2.253 20 0 BEADLO C[C@@H]1CCCC[C@@H]1CC(=O)NCc1cn(C)c[nH+]1 ZINC000890114588 592686049 /nfs/dbraw/zinc/68/60/49/592686049.db2.gz QMELHMGMDCXVNV-VXGBXAGGSA-N 1 2 249.358 2.253 20 0 BEADLO Cn1c[nH+]c(CNC(=O)CCC2CCCCC2)c1 ZINC000890119971 592686439 /nfs/dbraw/zinc/68/64/39/592686439.db2.gz QXJSBENHZOJGEY-UHFFFAOYSA-N 1 2 249.358 2.397 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1C[C@H](C)CO1 ZINC000890492715 592703150 /nfs/dbraw/zinc/70/31/50/592703150.db2.gz PSFDQPYPVRHXIX-KWQFWETISA-N 1 2 234.299 2.062 20 0 BEADLO CO[C@@H](C[NH2+][C@@H](C)C(F)F)Cc1ccccc1 ZINC000895725730 636175017 /nfs/dbraw/zinc/17/50/17/636175017.db2.gz SEWBLJZCZKBDCG-CMPLNLGQSA-N 1 2 243.297 2.487 20 0 BEADLO Oc1cccc2sc(C[NH+]3CCOCC3)cc21 ZINC000258002617 634539935 /nfs/dbraw/zinc/53/99/35/634539935.db2.gz LDPUCCJAJKRRAW-UHFFFAOYSA-N 1 2 249.335 2.439 20 0 BEADLO C#C[C@@H](C)OC(=O)[C@H](c1ccccc1)[N@@H+](C)CC ZINC000245878272 634614365 /nfs/dbraw/zinc/61/43/65/634614365.db2.gz MXSLMBDURDGBNC-OCCSQVGLSA-N 1 2 245.322 2.244 20 0 BEADLO C#C[C@@H](C)OC(=O)[C@H](c1ccccc1)[N@H+](C)CC ZINC000245878272 634614366 /nfs/dbraw/zinc/61/43/66/634614366.db2.gz MXSLMBDURDGBNC-OCCSQVGLSA-N 1 2 245.322 2.244 20 0 BEADLO O=C(C[C@H]1CC=CCC1)OCCn1cc[nH+]c1 ZINC000924244761 635537960 /nfs/dbraw/zinc/53/79/60/635537960.db2.gz HPDMQZMTCDCJMZ-LBPRGKRZSA-N 1 2 234.299 2.173 20 0 BEADLO Nc1ccc(COC(=O)C[C@@H]2CC=CCC2)c[nH+]1 ZINC000924252137 635572220 /nfs/dbraw/zinc/57/22/20/635572220.db2.gz UVTCGOPXWCIVHQ-LLVKDONJSA-N 1 2 246.310 2.453 20 0 BEADLO COC[C@H]1COCC[N@@H+]1C/C=C\c1ccccc1 ZINC000933334147 631269783 /nfs/dbraw/zinc/26/97/83/631269783.db2.gz DYYUJSXECBZVER-KKTNHOPESA-N 1 2 247.338 2.047 20 0 BEADLO COC[C@H]1COCC[N@H+]1C/C=C\c1ccccc1 ZINC000933334147 631269787 /nfs/dbraw/zinc/26/97/87/631269787.db2.gz DYYUJSXECBZVER-KKTNHOPESA-N 1 2 247.338 2.047 20 0 BEADLO CCCC[C@@H](CC)C(=O)NCc1ccc(N)[nH+]c1 ZINC000308382878 631306130 /nfs/dbraw/zinc/30/61/30/631306130.db2.gz YFMLJKFMHUMYAR-GFCCVEGCSA-N 1 2 249.358 2.496 20 0 BEADLO CN(C)c1cc(N(C)Cc2cccs2)nc[nH+]1 ZINC000891472576 631373005 /nfs/dbraw/zinc/37/30/05/631373005.db2.gz UCVJYOKZKLYIRJ-UHFFFAOYSA-N 1 2 248.355 2.241 20 0 BEADLO CN(C)c1cc(N(C)Cc2cccs2)[nH+]cn1 ZINC000891472576 631373011 /nfs/dbraw/zinc/37/30/11/631373011.db2.gz UCVJYOKZKLYIRJ-UHFFFAOYSA-N 1 2 248.355 2.241 20 0 BEADLO C[C@@H]1Cc2cc(C[N@@H+]3CCOC[C@H]3C)ccc2O1 ZINC000891696882 631451306 /nfs/dbraw/zinc/45/13/06/631451306.db2.gz ZCTGAOKSSZBGKM-VXGBXAGGSA-N 1 2 247.338 2.231 20 0 BEADLO C[C@@H]1Cc2cc(C[N@H+]3CCOC[C@H]3C)ccc2O1 ZINC000891696882 631451317 /nfs/dbraw/zinc/45/13/17/631451317.db2.gz ZCTGAOKSSZBGKM-VXGBXAGGSA-N 1 2 247.338 2.231 20 0 BEADLO C[C@H]1Cc2cc(C[N@@H+]3CCOC[C@H]3C)ccc2O1 ZINC000891696879 631452370 /nfs/dbraw/zinc/45/23/70/631452370.db2.gz ZCTGAOKSSZBGKM-NEPJUHHUSA-N 1 2 247.338 2.231 20 0 BEADLO C[C@H]1Cc2cc(C[N@H+]3CCOC[C@H]3C)ccc2O1 ZINC000891696879 631452372 /nfs/dbraw/zinc/45/23/72/631452372.db2.gz ZCTGAOKSSZBGKM-NEPJUHHUSA-N 1 2 247.338 2.231 20 0 BEADLO C[C@H]1CCCN1C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000933815530 631515335 /nfs/dbraw/zinc/51/53/35/631515335.db2.gz WPUYIEZIUQIQHS-VIFPVBQESA-N 1 2 229.283 2.187 20 0 BEADLO OC[C@@H]1CC[N@@H+]1Cc1ccc(F)c(Cl)c1 ZINC000934010494 631583725 /nfs/dbraw/zinc/58/37/25/631583725.db2.gz DGRWLPGPVWXVHR-VIFPVBQESA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@@H]1CC[N@H+]1Cc1ccc(F)c(Cl)c1 ZINC000934010494 631583729 /nfs/dbraw/zinc/58/37/29/631583729.db2.gz DGRWLPGPVWXVHR-VIFPVBQESA-N 1 2 229.682 2.046 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1[nH]nc(C)c1C ZINC000893897201 635639892 /nfs/dbraw/zinc/63/98/92/635639892.db2.gz PNDPZOASNOKBQY-BXKDBHETSA-N 1 2 237.347 2.026 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1[nH]nc(C)c1C ZINC000893897201 635639897 /nfs/dbraw/zinc/63/98/97/635639897.db2.gz PNDPZOASNOKBQY-BXKDBHETSA-N 1 2 237.347 2.026 20 0 BEADLO C[C@@H](c1ccc(F)cc1F)[N@@H+]1CC[C@H]1CO ZINC000934028761 631628241 /nfs/dbraw/zinc/62/82/41/631628241.db2.gz ZMFGMWCPTCWCQT-WPRPVWTQSA-N 1 2 227.254 2.092 20 0 BEADLO C[C@@H](c1ccc(F)cc1F)[N@H+]1CC[C@H]1CO ZINC000934028761 631628244 /nfs/dbraw/zinc/62/82/44/631628244.db2.gz ZMFGMWCPTCWCQT-WPRPVWTQSA-N 1 2 227.254 2.092 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@H+](C)[C@@H](C)c1nnc(C)s1 ZINC000934113685 631688875 /nfs/dbraw/zinc/68/88/75/631688875.db2.gz DMTCAZOMOUNCHV-UJNFCWOMSA-N 1 2 241.360 2.017 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@@H+](C)[C@@H](C)c1nnc(C)s1 ZINC000934113685 631688877 /nfs/dbraw/zinc/68/88/77/631688877.db2.gz DMTCAZOMOUNCHV-UJNFCWOMSA-N 1 2 241.360 2.017 20 0 BEADLO C[C@@H]1OCC[C@@]1(C)[NH2+]CC(F)(F)C(F)F ZINC000308867281 631697174 /nfs/dbraw/zinc/69/71/74/631697174.db2.gz LKXPZCWUMDNMAT-POYBYMJQSA-N 1 2 229.217 2.044 20 0 BEADLO C[C@@]1(C(=O)OCCCn2cc[nH+]c2)C=CCC1 ZINC000924408064 631741504 /nfs/dbraw/zinc/74/15/04/631741504.db2.gz NJTGUOGFKLIJDB-CYBMUJFWSA-N 1 2 234.299 2.173 20 0 BEADLO CCC[C@@H]1C[N@H+](C/C=C\Cl)CCO1 ZINC000255504505 631834993 /nfs/dbraw/zinc/83/49/93/631834993.db2.gz RHHHWYIFSBWWBN-TZGMSPROSA-N 1 2 203.713 2.240 20 0 BEADLO CCC[C@@H]1C[N@@H+](C/C=C\Cl)CCO1 ZINC000255504505 631834995 /nfs/dbraw/zinc/83/49/95/631834995.db2.gz RHHHWYIFSBWWBN-TZGMSPROSA-N 1 2 203.713 2.240 20 0 BEADLO C[C@H](c1ccccc1F)[N@@H+]1CC[C@H](O)[C@@H](F)C1 ZINC000934584891 631955700 /nfs/dbraw/zinc/95/57/00/631955700.db2.gz ZUTGULGWGFLYFA-ICCXJUOJSA-N 1 2 241.281 2.291 20 0 BEADLO C[C@H](c1ccccc1F)[N@H+]1CC[C@H](O)[C@@H](F)C1 ZINC000934584891 631955709 /nfs/dbraw/zinc/95/57/09/631955709.db2.gz ZUTGULGWGFLYFA-ICCXJUOJSA-N 1 2 241.281 2.291 20 0 BEADLO CCC(CC)C(=O)OCc1cc[nH+]c(N)c1 ZINC000309298980 631994590 /nfs/dbraw/zinc/99/45/90/631994590.db2.gz SMFZKYLPNURPEQ-UHFFFAOYSA-N 1 2 222.288 2.143 20 0 BEADLO C[C@@H]([N@H+](C)Cn1ncn(C)c1=S)C1(C)CC1 ZINC000176831496 632532987 /nfs/dbraw/zinc/53/29/87/632532987.db2.gz RHAQQMARAXEWBT-SECBINFHSA-N 1 2 240.376 2.029 20 0 BEADLO C[C@@H]([N@@H+](C)Cn1ncn(C)c1=S)C1(C)CC1 ZINC000176831496 632533000 /nfs/dbraw/zinc/53/30/00/632533000.db2.gz RHAQQMARAXEWBT-SECBINFHSA-N 1 2 240.376 2.029 20 0 BEADLO Cc1nc(N[C@H](C)c2ccc[nH]2)cc[nH+]1 ZINC000309103324 632638555 /nfs/dbraw/zinc/63/85/55/632638555.db2.gz GVVQWDJDNLFODI-MRVPVSSYSA-N 1 2 202.261 2.286 20 0 BEADLO Cc1occc1C[NH2+][C@H](C)c1ncc[nH]1 ZINC000309154796 632649519 /nfs/dbraw/zinc/64/95/19/632649519.db2.gz XCXIQAZVDOYZCM-MRVPVSSYSA-N 1 2 205.261 2.162 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)C1CCCCCCC1 ZINC000291277491 632651228 /nfs/dbraw/zinc/65/12/28/632651228.db2.gz QRRXDKWAIMHONX-UHFFFAOYSA-N 1 2 249.358 2.397 20 0 BEADLO CN(C)c1cc(NC2CC3(CCC3)C2)[nH+]cn1 ZINC000894405261 635892168 /nfs/dbraw/zinc/89/21/68/635892168.db2.gz COINBOHTHLKHCO-UHFFFAOYSA-N 1 2 232.331 2.287 20 0 BEADLO CN(C)c1cc(NC2CC3(CCC3)C2)nc[nH+]1 ZINC000894405261 635892175 /nfs/dbraw/zinc/89/21/75/635892175.db2.gz COINBOHTHLKHCO-UHFFFAOYSA-N 1 2 232.331 2.287 20 0 BEADLO Cc1n[nH]c(C[N@H+]2CC[C@H](C)[C@H](F)C2)c1C ZINC000894415919 635896839 /nfs/dbraw/zinc/89/68/39/635896839.db2.gz QRJSAZYNXNJITL-GZMMTYOYSA-N 1 2 225.311 2.206 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2CC[C@H](C)[C@H](F)C2)c1C ZINC000894415919 635896842 /nfs/dbraw/zinc/89/68/42/635896842.db2.gz QRJSAZYNXNJITL-GZMMTYOYSA-N 1 2 225.311 2.206 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2cnn(C)n2)ccc1F ZINC000924592292 633124517 /nfs/dbraw/zinc/12/45/17/633124517.db2.gz BBXUIRDVOSEUOY-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO Cc1ncoc1C[N@@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000894741825 635919495 /nfs/dbraw/zinc/91/94/95/635919495.db2.gz YYEYHEJDUZQNNU-LBPRGKRZSA-N 1 2 246.314 2.433 20 0 BEADLO Cc1ncoc1C[N@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000894741825 635919497 /nfs/dbraw/zinc/91/94/97/635919497.db2.gz YYEYHEJDUZQNNU-LBPRGKRZSA-N 1 2 246.314 2.433 20 0 BEADLO c1[nH+]cn2ccnc(N3CCC4(CCC4)C3)c12 ZINC000892902275 633241805 /nfs/dbraw/zinc/24/18/05/633241805.db2.gz VVFUOFBSESEQJO-UHFFFAOYSA-N 1 2 228.299 2.110 20 0 BEADLO C[C@@H]1COCCC[N@@H+]1Cc1cnc(Cl)s1 ZINC000306974321 635978729 /nfs/dbraw/zinc/97/87/29/635978729.db2.gz MDVSWKUGKMMPJM-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@@H]1COCCC[N@H+]1Cc1cnc(Cl)s1 ZINC000306974321 635978734 /nfs/dbraw/zinc/97/87/34/635978734.db2.gz MDVSWKUGKMMPJM-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO Cc1cn(C)nc1C[N@@H+]1CCCc2occc2C1 ZINC000930506102 633854141 /nfs/dbraw/zinc/85/41/41/633854141.db2.gz IYGBSGCZGVWFNQ-UHFFFAOYSA-N 1 2 245.326 2.270 20 0 BEADLO Cc1cn(C)nc1C[N@H+]1CCCc2occc2C1 ZINC000930506102 633854149 /nfs/dbraw/zinc/85/41/49/633854149.db2.gz IYGBSGCZGVWFNQ-UHFFFAOYSA-N 1 2 245.326 2.270 20 0 BEADLO O[C@@H](Cn1cc[nH+]c1)c1ccc(F)cc1Cl ZINC000184910253 634025616 /nfs/dbraw/zinc/02/56/16/634025616.db2.gz ZJRJHMJXPCSDOM-NSHDSACASA-N 1 2 240.665 2.409 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)Cc1cnoc1C ZINC000185178690 634036939 /nfs/dbraw/zinc/03/69/39/634036939.db2.gz HFQFUFGMCXIGIC-UHFFFAOYSA-N 1 2 235.287 2.220 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)Cc1cnoc1C ZINC000185178690 634036947 /nfs/dbraw/zinc/03/69/47/634036947.db2.gz HFQFUFGMCXIGIC-UHFFFAOYSA-N 1 2 235.287 2.220 20 0 BEADLO CC(C)SCC[NH2+][C@]1(C)CC(C)(C)OC1=O ZINC000930872014 634147318 /nfs/dbraw/zinc/14/73/18/634147318.db2.gz IMPHBHDHJTYMOO-GFCCVEGCSA-N 1 2 245.388 2.202 20 0 BEADLO CCOc1ccc(C[NH2+]Cc2cc(C)no2)o1 ZINC000893345778 634234920 /nfs/dbraw/zinc/23/49/20/634234920.db2.gz XHASPICYZCWXSY-UHFFFAOYSA-N 1 2 236.271 2.265 20 0 BEADLO c1cn(CCCCCCn2cc[nH+]c2)cn1 ZINC000053683994 634309038 /nfs/dbraw/zinc/30/90/38/634309038.db2.gz CHRPUSCNMSNSKL-UHFFFAOYSA-N 1 2 218.304 2.340 20 0 in-vivo BEADLO C[C@H]([NH2+]C1(c2ccccc2)CC1)c1cnn(C)n1 ZINC000925827012 635448651 /nfs/dbraw/zinc/44/86/51/635448651.db2.gz RHAKDPAMNPNUCS-NSHDSACASA-N 1 2 242.326 2.155 20 0 BEADLO CCC[C@@H](C)CC(=O)NCc1ccc(N)[nH+]c1 ZINC000927778844 635748155 /nfs/dbraw/zinc/74/81/55/635748155.db2.gz ONKFJIRCZLRWJG-SNVBAGLBSA-N 1 2 235.331 2.106 20 0 BEADLO C[C@H]([NH2+]C[C@@H]1CC1(Cl)Cl)C(F)F ZINC000895726087 636174704 /nfs/dbraw/zinc/17/47/04/636174704.db2.gz ZRYNXHVOJMZYRK-WHFBIAKZSA-N 1 2 218.074 2.423 20 0 BEADLO C[C@@H]1CCCC[C@]1(C)NC(=O)Cc1c[nH]c[nH+]1 ZINC000909566635 636255296 /nfs/dbraw/zinc/25/52/96/636255296.db2.gz IZHIHPRAZHOSLQ-MFKMUULPSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H](c1nc(CCc2ccco2)no1)[NH+](C)C ZINC000350604634 636433606 /nfs/dbraw/zinc/43/36/06/636433606.db2.gz XYTIVKHGBMTPBK-VIFPVBQESA-N 1 2 235.287 2.070 20 0 BEADLO CCc1onc(C)c1C[NH2+][C@H](C)c1nccn1C ZINC000927141917 637051938 /nfs/dbraw/zinc/05/19/38/637051938.db2.gz ZTUCFFOBIHSCJH-SNVBAGLBSA-N 1 2 248.330 2.130 20 0 BEADLO CCc1onc(C)c1C[NH2+][C@@H](C)c1nccn1C ZINC000927141912 637052931 /nfs/dbraw/zinc/05/29/31/637052931.db2.gz ZTUCFFOBIHSCJH-JTQLQIEISA-N 1 2 248.330 2.130 20 0 BEADLO Cc1ccccc1CC(N)=[NH+]OCCOC1CC1 ZINC000902283829 637286669 /nfs/dbraw/zinc/28/66/69/637286669.db2.gz JZYFXIIJOSROHO-UHFFFAOYSA-N 1 2 248.326 2.215 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1noc(C(C)(C)F)n1 ZINC000904269291 637394760 /nfs/dbraw/zinc/39/47/60/637394760.db2.gz ABTPKQUYXPDHFS-UHFFFAOYSA-N 1 2 236.250 2.227 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1noc([C@H]2C[C@@H]2C)n1 ZINC000904268232 637395283 /nfs/dbraw/zinc/39/52/83/637395283.db2.gz FMLSWESRIDRHSS-XPUUQOCRSA-N 1 2 230.271 2.146 20 0 BEADLO CCC1(c2nc(-c3c[nH+]c(N)cc3C)no2)CC1 ZINC000904269358 637395744 /nfs/dbraw/zinc/39/57/44/637395744.db2.gz CPDXGMYAYKCSRQ-UHFFFAOYSA-N 1 2 244.298 2.464 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1noc(C23CC(C2)C3)n1 ZINC000904264861 637395844 /nfs/dbraw/zinc/39/58/44/637395844.db2.gz AVLMMBFODUJHOB-UHFFFAOYSA-N 1 2 242.282 2.074 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2CC[C@@H]3C[C@@H]3CC2)n1 ZINC000904494292 637422603 /nfs/dbraw/zinc/42/26/03/637422603.db2.gz JKCWOBMVHSUBAZ-RTCCRHLQSA-N 1 2 235.331 2.473 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2C[C@@H]3C[C@@H]3C[C@@H]2C)n1 ZINC000904501132 637430621 /nfs/dbraw/zinc/43/06/21/637430621.db2.gz UVKJULMNPLSCFS-XWLWVQCSSA-N 1 2 235.331 2.329 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@]12C[C@H]1CCC[C@H]1C2 ZINC000905026382 637574764 /nfs/dbraw/zinc/57/47/64/637574764.db2.gz CNWQJKMWFFHWQA-GNXNZQSNSA-N 1 2 236.359 2.123 20 0 BEADLO CCn1c[nH+]cc1/C=C(\C)c1ncccn1 ZINC000905077778 637578998 /nfs/dbraw/zinc/57/89/98/637578998.db2.gz DXGJRTQFTYKKLO-JXMROGBWSA-N 1 2 214.272 2.254 20 0 BEADLO Cc1ccc(NCc2cnn(CCF)c2)c(C)[nH+]1 ZINC000905411177 637799991 /nfs/dbraw/zinc/79/99/91/637799991.db2.gz IJVLQJLGKOGNNX-UHFFFAOYSA-N 1 2 248.305 2.477 20 0 BEADLO CSc1cncc(NCc2c[nH+]cn2C)c1 ZINC000905415239 637802630 /nfs/dbraw/zinc/80/26/30/637802630.db2.gz VMKFUWUXSLYDAU-UHFFFAOYSA-N 1 2 234.328 2.149 20 0 BEADLO OCc1ccc(-c2c[nH+]c3c(c2)CCCN3)cc1 ZINC000906168302 638084161 /nfs/dbraw/zinc/08/41/61/638084161.db2.gz JLXGSSXGMUCDAR-UHFFFAOYSA-N 1 2 240.306 2.242 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)NCCC1=CCCCCC1 ZINC000907417597 638378942 /nfs/dbraw/zinc/37/89/42/638378942.db2.gz LPMIWWGTWXHSEK-UHFFFAOYSA-N 1 2 247.342 2.349 20 0 BEADLO CC[C@H]1[C@H](C)CCN1C(=O)CNc1cccc[nH+]1 ZINC000907488240 638389515 /nfs/dbraw/zinc/38/95/15/638389515.db2.gz OYFCNBYDQISYLQ-NEPJUHHUSA-N 1 2 247.342 2.141 20 0 BEADLO CC1(C)CCC[C@@H](NC(=O)Cc2c[nH]c[nH+]2)C1 ZINC000907629131 638424212 /nfs/dbraw/zinc/42/42/12/638424212.db2.gz SGIIPCUTKDCDBA-SNVBAGLBSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H]1CC[C@H](CNC(=O)CNc2cccc[nH+]2)C1 ZINC000907914086 638510124 /nfs/dbraw/zinc/51/01/24/638510124.db2.gz SRSIKUQILRRYLF-NEPJUHHUSA-N 1 2 247.342 2.046 20 0 BEADLO CCN(C(=O)CNc1cccc[nH+]1)[C@@H](C)C(C)C ZINC000908273961 638629054 /nfs/dbraw/zinc/62/90/54/638629054.db2.gz HMAZRNOTORWIPZ-LBPRGKRZSA-N 1 2 249.358 2.387 20 0 BEADLO CC[C@@H]1CCCC[C@H]1CNC(=O)Cc1c[nH]c[nH+]1 ZINC000908551238 639011633 /nfs/dbraw/zinc/01/16/33/639011633.db2.gz JTXFLORZWBIKDC-NEPJUHHUSA-N 1 2 249.358 2.285 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1NC(=O)CNc1cccc[nH+]1 ZINC000909903660 639266416 /nfs/dbraw/zinc/26/64/16/639266416.db2.gz RHVKBUNTAOZKHF-SMDDNHRTSA-N 1 2 247.342 2.044 20 0 BEADLO CCc1ncc(C[N@H+](C)Cc2ccccn2)o1 ZINC000930615217 639822919 /nfs/dbraw/zinc/82/29/19/639822919.db2.gz OOGHETYLKNWQBZ-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1ncc(C[N@@H+](C)Cc2ccccn2)o1 ZINC000930615217 639822921 /nfs/dbraw/zinc/82/29/21/639822921.db2.gz OOGHETYLKNWQBZ-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N(C)c1ccsc1 ZINC000912003726 639921110 /nfs/dbraw/zinc/92/11/10/639921110.db2.gz NQAHYZXUAYCBFW-SECBINFHSA-N 1 2 249.339 2.313 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N(C)c1ccsc1 ZINC000912003726 639921119 /nfs/dbraw/zinc/92/11/19/639921119.db2.gz NQAHYZXUAYCBFW-SECBINFHSA-N 1 2 249.339 2.313 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@H](CC)OC[C@@H]2C)o1 ZINC000930851757 639948544 /nfs/dbraw/zinc/94/85/44/639948544.db2.gz JQWJKZLBCXXEGP-QWRGUYRKSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@H](CC)OC[C@@H]2C)o1 ZINC000930851757 639948548 /nfs/dbraw/zinc/94/85/48/639948548.db2.gz JQWJKZLBCXXEGP-QWRGUYRKSA-N 1 2 238.331 2.236 20 0 BEADLO CCC[N@H+](Cc1nnc(OC)s1)C(C)C ZINC000930887006 639955871 /nfs/dbraw/zinc/95/58/71/639955871.db2.gz VNJGDDSDNBBJLK-UHFFFAOYSA-N 1 2 229.349 2.167 20 0 BEADLO CCC[N@@H+](Cc1nnc(OC)s1)C(C)C ZINC000930887006 639955877 /nfs/dbraw/zinc/95/58/77/639955877.db2.gz VNJGDDSDNBBJLK-UHFFFAOYSA-N 1 2 229.349 2.167 20 0 BEADLO CC[C@@H](C)CCNC(=O)CNc1cccc[nH+]1 ZINC000912385024 640038799 /nfs/dbraw/zinc/03/87/99/640038799.db2.gz RNZJTCXYWXBBLI-LLVKDONJSA-N 1 2 235.331 2.046 20 0 BEADLO CC(C)N(C(=O)C[C@H]([NH3+])C(F)F)C1CCCC1 ZINC000912466889 640071836 /nfs/dbraw/zinc/07/18/36/640071836.db2.gz TZJWFLUJFLLQGY-JTQLQIEISA-N 1 2 248.317 2.149 20 0 BEADLO c1nnc([C@@H]2CCC[N@H+]2CCc2ccccc2)[nH]1 ZINC000931137958 640073296 /nfs/dbraw/zinc/07/32/96/640073296.db2.gz UWBBXDCLRMENPK-ZDUSSCGKSA-N 1 2 242.326 2.184 20 0 BEADLO c1nnc([C@@H]2CCC[N@@H+]2CCc2ccccc2)[nH]1 ZINC000931137958 640073304 /nfs/dbraw/zinc/07/33/04/640073304.db2.gz UWBBXDCLRMENPK-ZDUSSCGKSA-N 1 2 242.326 2.184 20 0 BEADLO c1nc([C@@H]2CCC[N@H+]2CCc2ccccc2)n[nH]1 ZINC000931137958 640073314 /nfs/dbraw/zinc/07/33/14/640073314.db2.gz UWBBXDCLRMENPK-ZDUSSCGKSA-N 1 2 242.326 2.184 20 0 BEADLO c1nc([C@@H]2CCC[N@@H+]2CCc2ccccc2)n[nH]1 ZINC000931137958 640073323 /nfs/dbraw/zinc/07/33/23/640073323.db2.gz UWBBXDCLRMENPK-ZDUSSCGKSA-N 1 2 242.326 2.184 20 0 BEADLO CC/C(C)=C(\C)C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000912616147 640139188 /nfs/dbraw/zinc/13/91/88/640139188.db2.gz ZCTJXGNLLDPFDC-VAWYXSNFSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1ccc(F)c(C[N@@H+]2CC=C[C@@H]2CO)c1F ZINC000931702393 640326499 /nfs/dbraw/zinc/32/64/99/640326499.db2.gz CLFUKDCPLNRJOV-SNVBAGLBSA-N 1 2 239.265 2.006 20 0 BEADLO Cc1ccc(F)c(C[N@H+]2CC=C[C@@H]2CO)c1F ZINC000931702393 640326504 /nfs/dbraw/zinc/32/65/04/640326504.db2.gz CLFUKDCPLNRJOV-SNVBAGLBSA-N 1 2 239.265 2.006 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N1CC=CC12CCCC2 ZINC000913204854 640332700 /nfs/dbraw/zinc/33/27/00/640332700.db2.gz OOVWTKXGZGYPJO-UHFFFAOYSA-N 1 2 245.326 2.054 20 0 BEADLO C[C@@H]1CCC[C@@H]1NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000932058639 640420135 /nfs/dbraw/zinc/42/01/35/640420135.db2.gz RAYCRBHXYDZODI-KOLCDFICSA-N 1 2 243.310 2.481 20 0 BEADLO Cn1nccc1[C@@H]1CCC[N@@H+]1Cc1ccns1 ZINC000932262118 640461238 /nfs/dbraw/zinc/46/12/38/640461238.db2.gz MEFALJIQEPZJDN-LBPRGKRZSA-N 1 2 248.355 2.214 20 0 BEADLO Cn1nccc1[C@@H]1CCC[N@H+]1Cc1ccns1 ZINC000932262118 640461240 /nfs/dbraw/zinc/46/12/40/640461240.db2.gz MEFALJIQEPZJDN-LBPRGKRZSA-N 1 2 248.355 2.214 20 0 BEADLO Cn1nccc1[C@H]1CCC[N@@H+]1Cc1cncs1 ZINC000932262919 640463471 /nfs/dbraw/zinc/46/34/71/640463471.db2.gz XTZVVLLIDZFGRS-GFCCVEGCSA-N 1 2 248.355 2.214 20 0 BEADLO Cn1nccc1[C@H]1CCC[N@H+]1Cc1cncs1 ZINC000932262919 640463479 /nfs/dbraw/zinc/46/34/79/640463479.db2.gz XTZVVLLIDZFGRS-GFCCVEGCSA-N 1 2 248.355 2.214 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2ccc(Cl)cn2)CCO1 ZINC000932336123 640474629 /nfs/dbraw/zinc/47/46/29/640474629.db2.gz PBWBTETWVKDUSH-SNVBAGLBSA-N 1 2 240.734 2.346 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2ccc(Cl)cn2)CCO1 ZINC000932336123 640474632 /nfs/dbraw/zinc/47/46/32/640474632.db2.gz PBWBTETWVKDUSH-SNVBAGLBSA-N 1 2 240.734 2.346 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cncc(Cl)c2)CCO1 ZINC000932337603 640474655 /nfs/dbraw/zinc/47/46/55/640474655.db2.gz YBEUINKUYJSEQJ-SNVBAGLBSA-N 1 2 240.734 2.346 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cncc(Cl)c2)CCO1 ZINC000932337603 640474658 /nfs/dbraw/zinc/47/46/58/640474658.db2.gz YBEUINKUYJSEQJ-SNVBAGLBSA-N 1 2 240.734 2.346 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CCO[C@H](C)CC2)s1 ZINC000932346483 640487302 /nfs/dbraw/zinc/48/73/02/640487302.db2.gz IPIPNVBRLXKLLA-RKDXNWHRSA-N 1 2 241.360 2.018 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CCO[C@H](C)CC2)s1 ZINC000932346483 640487309 /nfs/dbraw/zinc/48/73/09/640487309.db2.gz IPIPNVBRLXKLLA-RKDXNWHRSA-N 1 2 241.360 2.018 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2ncc(C3CC3)o2)CCO1 ZINC000932348941 640489605 /nfs/dbraw/zinc/48/96/05/640489605.db2.gz VMAVKAAZXILCJX-SNVBAGLBSA-N 1 2 236.315 2.163 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2ncc(C3CC3)o2)CCO1 ZINC000932348941 640489607 /nfs/dbraw/zinc/48/96/07/640489607.db2.gz VMAVKAAZXILCJX-SNVBAGLBSA-N 1 2 236.315 2.163 20 0 BEADLO C[C@H]1CC[N@H+](Cc2ncc(C3CC3)o2)CCO1 ZINC000932348940 640491140 /nfs/dbraw/zinc/49/11/40/640491140.db2.gz VMAVKAAZXILCJX-JTQLQIEISA-N 1 2 236.315 2.163 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2ncc(C3CC3)o2)CCO1 ZINC000932348940 640491143 /nfs/dbraw/zinc/49/11/43/640491143.db2.gz VMAVKAAZXILCJX-JTQLQIEISA-N 1 2 236.315 2.163 20 0 BEADLO CCc1nc(C[N@@H+]2CCO[C@@H](C)CC2)cs1 ZINC000932349178 640493856 /nfs/dbraw/zinc/49/38/56/640493856.db2.gz JSJPIZYVSAKDGQ-JTQLQIEISA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nc(C[N@H+]2CCO[C@@H](C)CC2)cs1 ZINC000932349178 640493861 /nfs/dbraw/zinc/49/38/61/640493861.db2.gz JSJPIZYVSAKDGQ-JTQLQIEISA-N 1 2 240.372 2.316 20 0 BEADLO Cl/C=C\C[NH2+][C@@H](c1ncccn1)C1CC1 ZINC000932360479 640498634 /nfs/dbraw/zinc/49/86/34/640498634.db2.gz LXYYEQVYRRQZCJ-LMQQOLRNSA-N 1 2 223.707 2.270 20 0 BEADLO Cl/C=C/C[NH2+][C@H](c1ncccn1)C1CC1 ZINC000932360481 640499354 /nfs/dbraw/zinc/49/93/54/640499354.db2.gz LXYYEQVYRRQZCJ-OKEWEERVSA-N 1 2 223.707 2.270 20 0 BEADLO CCCCOC(=O)[C@H](C)[NH2+][C@H](C)C(C)(C)OC ZINC000932368596 640500822 /nfs/dbraw/zinc/50/08/22/640500822.db2.gz HWLDJASTPAKUCK-WDEREUQCSA-N 1 2 245.363 2.121 20 0 BEADLO Cc1cc(C)c(NC(=O)c2cnsn2)c(C)[nH+]1 ZINC000129632469 640502149 /nfs/dbraw/zinc/50/21/49/640502149.db2.gz PGHLJFQXRHAAQM-UHFFFAOYSA-N 1 2 248.311 2.111 20 0 BEADLO CO[C@@H](C[N@@H+]1CCCC(=O)[C@@H]1C)C1CCCC1 ZINC000932845171 640617878 /nfs/dbraw/zinc/61/78/78/640617878.db2.gz JBMSLWNLSYDDBH-FZMZJTMJSA-N 1 2 239.359 2.245 20 0 BEADLO CO[C@@H](C[N@H+]1CCCC(=O)[C@@H]1C)C1CCCC1 ZINC000932845171 640617882 /nfs/dbraw/zinc/61/78/82/640617882.db2.gz JBMSLWNLSYDDBH-FZMZJTMJSA-N 1 2 239.359 2.245 20 0 BEADLO CCO[C@H]1CC[N@@H+]([C@@H](C)c2nnc(C)s2)C1 ZINC000932969865 640656479 /nfs/dbraw/zinc/65/64/79/640656479.db2.gz QZMYCLOFUXCLLR-WPRPVWTQSA-N 1 2 241.360 2.018 20 0 BEADLO CCO[C@H]1CC[N@H+]([C@@H](C)c2nnc(C)s2)C1 ZINC000932969865 640656481 /nfs/dbraw/zinc/65/64/81/640656481.db2.gz QZMYCLOFUXCLLR-WPRPVWTQSA-N 1 2 241.360 2.018 20 0 BEADLO COc1cc([NH2+]C[C@H]2C[C@H]2C)ccc1N ZINC000166747533 640668971 /nfs/dbraw/zinc/66/89/71/640668971.db2.gz WMTXIQGARUQFGU-RKDXNWHRSA-N 1 2 206.289 2.345 20 0 BEADLO c1cc(C[N@H+]2CCOC[C@@H]2CC2CC2)sn1 ZINC000933208172 640679466 /nfs/dbraw/zinc/67/94/66/640679466.db2.gz FEGJLJIHALCWGV-NSHDSACASA-N 1 2 238.356 2.144 20 0 BEADLO c1cc(C[N@@H+]2CCOC[C@@H]2CC2CC2)sn1 ZINC000933208172 640679470 /nfs/dbraw/zinc/67/94/70/640679470.db2.gz FEGJLJIHALCWGV-NSHDSACASA-N 1 2 238.356 2.144 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)Cc1cccc(=O)[nH]1 ZINC000933395942 640713497 /nfs/dbraw/zinc/71/34/97/640713497.db2.gz MSFFERCSPRRPQP-UHFFFAOYSA-N 1 2 247.298 2.024 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)Cc1cccc(=O)[nH]1 ZINC000933395942 640713502 /nfs/dbraw/zinc/71/35/02/640713502.db2.gz MSFFERCSPRRPQP-UHFFFAOYSA-N 1 2 247.298 2.024 20 0 BEADLO CCCCC1(C(=O)NCc2[nH]c[nH+]c2C)CC1 ZINC000933993657 640800911 /nfs/dbraw/zinc/80/09/11/640800911.db2.gz NFYPLKPPZKWWGG-UHFFFAOYSA-N 1 2 235.331 2.305 20 0 BEADLO Cc1ccc2sc(C[N@@H+]3CC[C@H]3CO)nc2c1 ZINC000934011652 640809346 /nfs/dbraw/zinc/80/93/46/640809346.db2.gz MESGYNLUDRKWTL-JTQLQIEISA-N 1 2 248.351 2.171 20 0 BEADLO Cc1ccc2sc(C[N@H+]3CC[C@H]3CO)nc2c1 ZINC000934011652 640809350 /nfs/dbraw/zinc/80/93/50/640809350.db2.gz MESGYNLUDRKWTL-JTQLQIEISA-N 1 2 248.351 2.171 20 0 BEADLO O[C@@H](C[NH2+]CC(F)(F)c1ccccc1)C1CC1 ZINC000227901786 640852449 /nfs/dbraw/zinc/85/24/49/640852449.db2.gz UCPTVKQKGOAMJG-LBPRGKRZSA-N 1 2 241.281 2.139 20 0 BEADLO C[N@@H+]1Cc2cccc(NC(=O)C(F)(F)F)c2C1 ZINC000169812864 640877540 /nfs/dbraw/zinc/87/75/40/640877540.db2.gz RCCQUALWTDCVCD-UHFFFAOYSA-N 1 2 244.216 2.133 20 0 BEADLO C[N@H+]1Cc2cccc(NC(=O)C(F)(F)F)c2C1 ZINC000169812864 640877542 /nfs/dbraw/zinc/87/75/42/640877542.db2.gz RCCQUALWTDCVCD-UHFFFAOYSA-N 1 2 244.216 2.133 20 0 BEADLO CCC[C@@H]1CCC[C@@H]1C(=O)NC1C[NH+](CC)C1 ZINC001030568574 640920755 /nfs/dbraw/zinc/92/07/55/640920755.db2.gz FQUGRNFEQPXHAU-YPMHNXCESA-N 1 2 238.375 2.023 20 0 BEADLO CCCNc1cc(N2CCCCC2)nc[nH+]1 ZINC000087806214 641050703 /nfs/dbraw/zinc/05/07/03/641050703.db2.gz YEDZLWSAUALMKD-UHFFFAOYSA-N 1 2 220.320 2.289 20 0 BEADLO CCCNc1cc(N2CCCCC2)[nH+]cn1 ZINC000087806214 641050710 /nfs/dbraw/zinc/05/07/10/641050710.db2.gz YEDZLWSAUALMKD-UHFFFAOYSA-N 1 2 220.320 2.289 20 0 BEADLO CNc1cc(N(C)Cc2cccs2)nc[nH+]1 ZINC000087811756 641051250 /nfs/dbraw/zinc/05/12/50/641051250.db2.gz RXOYIJCGCSTFKH-UHFFFAOYSA-N 1 2 234.328 2.216 20 0 BEADLO CNc1cc(N(C)Cc2cccs2)[nH+]cn1 ZINC000087811756 641051254 /nfs/dbraw/zinc/05/12/54/641051254.db2.gz RXOYIJCGCSTFKH-UHFFFAOYSA-N 1 2 234.328 2.216 20 0 BEADLO CCCNc1cc(N2CCC[C@H]2C)nc[nH+]1 ZINC000087820194 641055176 /nfs/dbraw/zinc/05/51/76/641055176.db2.gz PDHNQTIIJCKNAP-SNVBAGLBSA-N 1 2 220.320 2.287 20 0 BEADLO CCCNc1cc(N2CCC[C@H]2C)[nH+]cn1 ZINC000087820194 641055179 /nfs/dbraw/zinc/05/51/79/641055179.db2.gz PDHNQTIIJCKNAP-SNVBAGLBSA-N 1 2 220.320 2.287 20 0 BEADLO CNc1cc(N2CCC(C)(C)CC2)nc[nH+]1 ZINC000087828781 641057541 /nfs/dbraw/zinc/05/75/41/641057541.db2.gz ONJWPZYJAHSZCH-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO CNc1cc(N2CCC(C)(C)CC2)[nH+]cn1 ZINC000087828781 641057546 /nfs/dbraw/zinc/05/75/46/641057546.db2.gz ONJWPZYJAHSZCH-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO CCc1nc(C[N@H+](C)[C@@H]2CC[C@@H]2OC)cs1 ZINC000934128181 641086116 /nfs/dbraw/zinc/08/61/16/641086116.db2.gz QKXWKMIIGLEBRB-MNOVXSKESA-N 1 2 240.372 2.315 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@@H]2CC[C@@H]2OC)cs1 ZINC000934128181 641086121 /nfs/dbraw/zinc/08/61/21/641086121.db2.gz QKXWKMIIGLEBRB-MNOVXSKESA-N 1 2 240.372 2.315 20 0 BEADLO CCCCC1([NH2+][C@H](C(=O)OC)C2CC2)CC1 ZINC000934205600 641101174 /nfs/dbraw/zinc/10/11/74/641101174.db2.gz PHVNCVGUZSEDDI-NSHDSACASA-N 1 2 225.332 2.250 20 0 BEADLO CCCCC1([NH2+]Cc2noc(COC)n2)CC1 ZINC000934205247 641101182 /nfs/dbraw/zinc/10/11/82/641101182.db2.gz KSUPZHSWKWXWRW-UHFFFAOYSA-N 1 2 239.319 2.028 20 0 BEADLO CCCC(=O)NCc1[nH+]cc(C)c(OC)c1C ZINC000050449415 641149667 /nfs/dbraw/zinc/14/96/67/641149667.db2.gz JZZQIPSCPATGJG-UHFFFAOYSA-N 1 2 236.315 2.123 20 0 BEADLO C[C@@]1(C2CC2)COCC[N@@H+]1Cc1cncs1 ZINC000934474779 641167149 /nfs/dbraw/zinc/16/71/49/641167149.db2.gz HNTDFMCTEMXMTF-LBPRGKRZSA-N 1 2 238.356 2.144 20 0 BEADLO C[C@@]1(C2CC2)COCC[N@H+]1Cc1cncs1 ZINC000934474779 641167151 /nfs/dbraw/zinc/16/71/51/641167151.db2.gz HNTDFMCTEMXMTF-LBPRGKRZSA-N 1 2 238.356 2.144 20 0 BEADLO C[C@@H]1[C@H](C)SCC[N@@H+]1Cn1cc[nH]c1=S ZINC000173351523 641172198 /nfs/dbraw/zinc/17/21/98/641172198.db2.gz ZJWIGUAVCRLCCL-BDAKNGLRSA-N 1 2 243.401 2.329 20 0 BEADLO C[C@@H]1[C@H](C)SCC[N@H+]1Cn1cc[nH]c1=S ZINC000173351523 641172203 /nfs/dbraw/zinc/17/22/03/641172203.db2.gz ZJWIGUAVCRLCCL-BDAKNGLRSA-N 1 2 243.401 2.329 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+]1CC[C@H](O)[C@@H](F)C1 ZINC000934574995 641202909 /nfs/dbraw/zinc/20/29/09/641202909.db2.gz VSJMPTPBINNNFY-STQMWFEESA-N 1 2 241.281 2.039 20 0 BEADLO Cc1ccc(F)cc1C[N@H+]1CC[C@H](O)[C@@H](F)C1 ZINC000934574995 641202911 /nfs/dbraw/zinc/20/29/11/641202911.db2.gz VSJMPTPBINNNFY-STQMWFEESA-N 1 2 241.281 2.039 20 0 BEADLO CSCC(C)(C)[NH2+]Cc1noc(C2CC2)n1 ZINC000934673102 641241174 /nfs/dbraw/zinc/24/11/74/641241174.db2.gz FAYBQQJTLMTNRP-UHFFFAOYSA-N 1 2 241.360 2.178 20 0 BEADLO CC1(C)C[N@H+](Cc2ccc(O)c(F)c2)CCO1 ZINC000232449678 641272494 /nfs/dbraw/zinc/27/24/94/641272494.db2.gz KUSOCZNWFRGVMS-UHFFFAOYSA-N 1 2 239.290 2.142 20 0 BEADLO CC1(C)C[N@@H+](Cc2ccc(O)c(F)c2)CCO1 ZINC000232449678 641272500 /nfs/dbraw/zinc/27/25/00/641272500.db2.gz KUSOCZNWFRGVMS-UHFFFAOYSA-N 1 2 239.290 2.142 20 0 BEADLO Cc1ccc(F)c(C[N@@H+](C)[C@@H]2CCOC2)c1F ZINC000929602160 641374936 /nfs/dbraw/zinc/37/49/36/641374936.db2.gz UYCJRYLDZGWJED-SNVBAGLBSA-N 1 2 241.281 2.494 20 0 BEADLO Cc1ccc(F)c(C[N@H+](C)[C@@H]2CCOC2)c1F ZINC000929602160 641374939 /nfs/dbraw/zinc/37/49/39/641374939.db2.gz UYCJRYLDZGWJED-SNVBAGLBSA-N 1 2 241.281 2.494 20 0 BEADLO O=C(c1cc2c[nH+]ccc2[nH]1)N1C2CCC1CC2 ZINC000929676309 641393249 /nfs/dbraw/zinc/39/32/49/641393249.db2.gz NBBCGHZHQOWTNO-UHFFFAOYSA-N 1 2 241.294 2.330 20 0 BEADLO Cc1cc(C)[nH+]c(CN(C)Cc2ccon2)c1 ZINC000929698000 641404218 /nfs/dbraw/zinc/40/42/18/641404218.db2.gz XCCNVIUNDCITEI-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CCc1ccc(N2CC[NH+](CCF)CC2)cc1 ZINC000759348448 641421746 /nfs/dbraw/zinc/42/17/46/641421746.db2.gz WURPKMWSUSUXPF-UHFFFAOYSA-N 1 2 236.334 2.341 20 0 BEADLO C[C@H](CC1CCC1)NC(=O)CNc1cccc[nH+]1 ZINC000913718643 641462410 /nfs/dbraw/zinc/46/24/10/641462410.db2.gz AFCZUAGKMZBDPN-LLVKDONJSA-N 1 2 247.342 2.188 20 0 BEADLO C[C@@H]1C[C@@H](C)N1C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000935737229 641472677 /nfs/dbraw/zinc/47/26/77/641472677.db2.gz JAZRCGXCYIUNQO-RKDXNWHRSA-N 1 2 229.283 2.186 20 0 BEADLO C[C@H](CN(C)C(=O)Cc1c[nH+]c[nH]1)C(C)(C)C ZINC000913805561 641481223 /nfs/dbraw/zinc/48/12/23/641481223.db2.gz RZIVTKJKULXSPR-SNVBAGLBSA-N 1 2 237.347 2.093 20 0 BEADLO C[C@@H](CN(C)C(=O)Cc1c[nH+]c[nH]1)C(C)(C)C ZINC000913805560 641481755 /nfs/dbraw/zinc/48/17/55/641481755.db2.gz RZIVTKJKULXSPR-JTQLQIEISA-N 1 2 237.347 2.093 20 0 BEADLO CC1(C)CC[C@@H]1NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000935975703 641512075 /nfs/dbraw/zinc/51/20/75/641512075.db2.gz XLGWCTWNWRKUNB-LBPRGKRZSA-N 1 2 243.310 2.481 20 0 BEADLO CCC[C@H](C)CCNC(=O)Cc1[nH]c[nH+]c1C ZINC000914363728 641645571 /nfs/dbraw/zinc/64/55/71/641645571.db2.gz HAWLMRMVXYRUQW-JTQLQIEISA-N 1 2 237.347 2.203 20 0 BEADLO CCc1cccc(C)c1NC(=O)Cc1c[nH]c[nH+]1 ZINC000074673477 641718742 /nfs/dbraw/zinc/71/87/42/641718742.db2.gz QABBGZWWBPVDRA-UHFFFAOYSA-N 1 2 243.310 2.462 20 0 BEADLO CCCCC[C@@H]([NH2+][C@@H]1CCSC1)C(=O)OC ZINC000187886336 641732121 /nfs/dbraw/zinc/73/21/21/641732121.db2.gz RWOAVTKSDDKHOA-GHMZBOCLSA-N 1 2 245.388 2.203 20 0 BEADLO CCCCC[C@H]([NH2+][C@@H]1CCSC1)C(=O)OC ZINC000187886309 641732436 /nfs/dbraw/zinc/73/24/36/641732436.db2.gz RWOAVTKSDDKHOA-MNOVXSKESA-N 1 2 245.388 2.203 20 0 BEADLO Cc1ccc(N(C)C(=O)CCc2c[nH]c[nH+]2)cc1 ZINC000188846631 641770261 /nfs/dbraw/zinc/77/02/61/641770261.db2.gz FTYANWWYZOCHDU-UHFFFAOYSA-N 1 2 243.310 2.314 20 0 BEADLO Cc1ccc(N(C)C(=O)CCc2c[nH+]c[nH]2)cc1 ZINC000188846631 641770267 /nfs/dbraw/zinc/77/02/67/641770267.db2.gz FTYANWWYZOCHDU-UHFFFAOYSA-N 1 2 243.310 2.314 20 0 BEADLO C[N@H+](Cc1cccnc1)Cc1ccc(F)nc1 ZINC000189563760 641809045 /nfs/dbraw/zinc/80/90/45/641809045.db2.gz ZPJFFZYGOJUNLU-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[N@@H+](Cc1cccnc1)Cc1ccc(F)nc1 ZINC000189563760 641809051 /nfs/dbraw/zinc/80/90/51/641809051.db2.gz ZPJFFZYGOJUNLU-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO CCn1cnn(C[N@H+](C)[C@@H](C)C(C)C)c1=S ZINC000915208887 641809362 /nfs/dbraw/zinc/80/93/62/641809362.db2.gz IKKUCMYFTBCPKD-JTQLQIEISA-N 1 2 242.392 2.368 20 0 BEADLO CCn1cnn(C[N@@H+](C)[C@@H](C)C(C)C)c1=S ZINC000915208887 641809364 /nfs/dbraw/zinc/80/93/64/641809364.db2.gz IKKUCMYFTBCPKD-JTQLQIEISA-N 1 2 242.392 2.368 20 0 BEADLO CC[NH+]1CC(NC(=O)c2ccc(C(C)C)cc2)C1 ZINC001031301111 641875493 /nfs/dbraw/zinc/87/54/93/641875493.db2.gz HMUWZWCQUSCCBE-UHFFFAOYSA-N 1 2 246.354 2.244 20 0 BEADLO Cc1nc(CC(=O)Nc2cc[nH+]c(C)c2)cs1 ZINC000078228337 641905867 /nfs/dbraw/zinc/90/58/67/641905867.db2.gz VZAYCDVJFRBQST-UHFFFAOYSA-N 1 2 247.323 2.336 20 0 BEADLO c1ccc(NCc2cccc3c2OCCO3)[nH+]c1 ZINC000078823879 641959233 /nfs/dbraw/zinc/95/92/33/641959233.db2.gz HGPKHWYJUXLSGH-UHFFFAOYSA-N 1 2 242.278 2.465 20 0 BEADLO C/C(=C/C(=O)NCCCCn1cc[nH+]c1)C1CC1 ZINC000918706773 642253385 /nfs/dbraw/zinc/25/33/85/642253385.db2.gz ZGYPVXYCHUWZBR-BENRWUELSA-N 1 2 247.342 2.136 20 0 BEADLO O=C(C=C1CCCC1)NCCCCn1cc[nH+]c1 ZINC000918706738 642253654 /nfs/dbraw/zinc/25/36/54/642253654.db2.gz WYBYLUKVNWQVDL-UHFFFAOYSA-N 1 2 247.342 2.280 20 0 BEADLO CC[C@@H]1C[N@H+](C/C=C\Cl)C[C@@H](C)O1 ZINC000255265419 642320663 /nfs/dbraw/zinc/32/06/63/642320663.db2.gz FTYIRQAPPWSEQP-BYIQDMNASA-N 1 2 203.713 2.238 20 0 BEADLO CC[C@@H]1C[N@@H+](C/C=C\Cl)C[C@@H](C)O1 ZINC000255265419 642320671 /nfs/dbraw/zinc/32/06/71/642320671.db2.gz FTYIRQAPPWSEQP-BYIQDMNASA-N 1 2 203.713 2.238 20 0 BEADLO Cc1ccc(F)cc1NC(=O)CCc1c[nH]c[nH+]1 ZINC000188410863 642386240 /nfs/dbraw/zinc/38/62/40/642386240.db2.gz ZFXZYFFUXJVWSJ-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO Cc1ccc(F)cc1NC(=O)CCc1c[nH+]c[nH]1 ZINC000188410863 642386249 /nfs/dbraw/zinc/38/62/49/642386249.db2.gz ZFXZYFFUXJVWSJ-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO Cc1nonc1C[NH2+]Cc1ccc(Cl)cc1 ZINC000069794719 642412196 /nfs/dbraw/zinc/41/21/96/642412196.db2.gz BJQXSJXCUYRVDE-UHFFFAOYSA-N 1 2 237.690 2.321 20 0 BEADLO CCC(=O)CCCN1CCc2c([nH+]cn2CC)C1 ZINC000933256072 642426044 /nfs/dbraw/zinc/42/60/44/642426044.db2.gz VRAOHZWHPZEIHM-UHFFFAOYSA-N 1 2 249.358 2.020 20 0 BEADLO COc1nnc(C[N@H+]2C[C@H](C)C[C@H](C)C2)s1 ZINC000920257339 642462540 /nfs/dbraw/zinc/46/25/40/642462540.db2.gz NYTVZLKIMQTRTJ-DTORHVGOSA-N 1 2 241.360 2.025 20 0 BEADLO COc1nnc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)s1 ZINC000920257339 642462545 /nfs/dbraw/zinc/46/25/45/642462545.db2.gz NYTVZLKIMQTRTJ-DTORHVGOSA-N 1 2 241.360 2.025 20 0 BEADLO CCCCCC[C@@H](C)NC(=O)Cn1cc[nH+]c1 ZINC000072558645 642495253 /nfs/dbraw/zinc/49/52/53/642495253.db2.gz MKPVRGLKWVDMMK-GFCCVEGCSA-N 1 2 237.347 2.358 20 0 BEADLO CCC(CC)NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000929202142 642573439 /nfs/dbraw/zinc/57/34/39/642573439.db2.gz YTVQVCGZGIWUNS-UHFFFAOYSA-N 1 2 231.299 2.481 20 0 BEADLO c1ccc(NCC2CCC3(CC2)OCCO3)[nH+]c1 ZINC000180440094 642796224 /nfs/dbraw/zinc/79/62/24/642796224.db2.gz BPVODBNZIQWMLV-UHFFFAOYSA-N 1 2 248.326 2.427 20 0 BEADLO C=CCCOC(=O)[C@@H](c1ccccc1)[NH+](C)C ZINC000181980663 642935261 /nfs/dbraw/zinc/93/52/61/642935261.db2.gz PKOINWFYHMGXBW-CYBMUJFWSA-N 1 2 233.311 2.409 20 0 BEADLO C[NH+](C)[C@H](C(=O)OCCCC#N)c1ccccc1 ZINC000181982971 642938614 /nfs/dbraw/zinc/93/86/14/642938614.db2.gz FWKCEACJGHEKFT-ZDUSSCGKSA-N 1 2 246.310 2.136 20 0 BEADLO c1cn(Cc2ccc3ccccc3n2)c[nH+]1 ZINC000070163099 642981979 /nfs/dbraw/zinc/98/19/79/642981979.db2.gz YZRAHPJHGZVIMR-UHFFFAOYSA-N 1 2 209.252 2.480 20 0 BEADLO C[C@H](CC(=O)NCCNc1cccc[nH+]1)C1CC1 ZINC000063703832 643102008 /nfs/dbraw/zinc/10/20/08/643102008.db2.gz MRDZYRMTUDXVLZ-LLVKDONJSA-N 1 2 247.342 2.046 20 0 BEADLO CC(C)Oc1ccccc1C[NH2+]Cc1cnc[nH]1 ZINC000112342007 643333383 /nfs/dbraw/zinc/33/33/83/643333383.db2.gz VKKUNCWCBFLVGB-UHFFFAOYSA-N 1 2 245.326 2.487 20 0 BEADLO C[C@@H]1CC[N@H+](Cn2ncsc2=S)[C@H]1C ZINC000247094813 643351439 /nfs/dbraw/zinc/35/14/39/643351439.db2.gz VXEFICNLXFNHIZ-SFYZADRCSA-N 1 2 229.374 2.362 20 0 BEADLO C[C@@H]1CC[N@@H+](Cn2ncsc2=S)[C@H]1C ZINC000247094813 643351445 /nfs/dbraw/zinc/35/14/45/643351445.db2.gz VXEFICNLXFNHIZ-SFYZADRCSA-N 1 2 229.374 2.362 20 0 BEADLO Cc1nonc1C[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC000733897770 643478464 /nfs/dbraw/zinc/47/84/64/643478464.db2.gz VZKXGWOZPGQTIX-CQSZACIVSA-N 1 2 243.310 2.497 20 0 BEADLO Cc1nonc1C[N@H+](C)[C@@H]1CCc2ccccc21 ZINC000733897770 643478470 /nfs/dbraw/zinc/47/84/70/643478470.db2.gz VZKXGWOZPGQTIX-CQSZACIVSA-N 1 2 243.310 2.497 20 0 BEADLO Fc1cccc(NCCCCn2cc[nH+]c2)n1 ZINC000045112740 643551151 /nfs/dbraw/zinc/55/11/51/643551151.db2.gz FKCRZSCLGCCTEX-UHFFFAOYSA-N 1 2 234.278 2.310 20 0 BEADLO CS/C=C/C(=O)Nc1cc[nH+]c(C)c1 ZINC000083609500 643597717 /nfs/dbraw/zinc/59/77/17/643597717.db2.gz NOCJPKSGLMNHCU-GQCTYLIASA-N 1 2 208.286 2.205 20 0 BEADLO c1csc(C[NH2+]Cc2cnn(C3CCC3)c2)n1 ZINC000921564062 643609664 /nfs/dbraw/zinc/60/96/64/643609664.db2.gz YWPCJMUCIUXJMR-UHFFFAOYSA-N 1 2 248.355 2.354 20 0 BEADLO CNc1cc(N2CC[C@@H](CC(C)C)C2)nc[nH+]1 ZINC000307793238 643648620 /nfs/dbraw/zinc/64/86/20/643648620.db2.gz JFXXDNUCIIAMNA-NSHDSACASA-N 1 2 234.347 2.391 20 0 BEADLO CNc1cc(N2CC[C@@H](CC(C)C)C2)[nH+]cn1 ZINC000307793238 643648637 /nfs/dbraw/zinc/64/86/37/643648637.db2.gz JFXXDNUCIIAMNA-NSHDSACASA-N 1 2 234.347 2.391 20 0 BEADLO CC[C@H](C)CN(C)c1cc(NC)[nH+]cn1 ZINC000087809573 643674623 /nfs/dbraw/zinc/67/46/23/643674623.db2.gz LVBMXVZDTMCOHK-VIFPVBQESA-N 1 2 208.309 2.001 20 0 BEADLO CC[C@H](C)CN(C)c1cc(NC)nc[nH+]1 ZINC000087809573 643674631 /nfs/dbraw/zinc/67/46/31/643674631.db2.gz LVBMXVZDTMCOHK-VIFPVBQESA-N 1 2 208.309 2.001 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cc(C)cc(C)n2)CCO1 ZINC000929258376 643832527 /nfs/dbraw/zinc/83/25/27/643832527.db2.gz XTOAFCAIPKIOPB-AWEZNQCLSA-N 1 2 234.343 2.309 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cc(C)cc(C)n2)CCO1 ZINC000929258376 643832530 /nfs/dbraw/zinc/83/25/30/643832530.db2.gz XTOAFCAIPKIOPB-AWEZNQCLSA-N 1 2 234.343 2.309 20 0 BEADLO CCC[C@H](C)C(=O)OCc1ccc[nH+]c1N ZINC000922352695 643980109 /nfs/dbraw/zinc/98/01/09/643980109.db2.gz PBESANJDHLIFQJ-VIFPVBQESA-N 1 2 222.288 2.143 20 0 BEADLO CCC[C@@H](C)C(=O)OCc1ccc(N)[nH+]c1 ZINC000922352805 643980301 /nfs/dbraw/zinc/98/03/01/643980301.db2.gz SVSPGXIWEFZPJP-SECBINFHSA-N 1 2 222.288 2.143 20 0 BEADLO CCC(CC)C(=O)OCc1ccc[nH+]c1N ZINC000922352385 643980713 /nfs/dbraw/zinc/98/07/13/643980713.db2.gz DIWUTOYXVNDFJH-UHFFFAOYSA-N 1 2 222.288 2.143 20 0 BEADLO C/C(=C\C(=O)OCc1ccc[nH+]c1N)C1CC1 ZINC000922371081 643981300 /nfs/dbraw/zinc/98/13/00/643981300.db2.gz UWTYCTIWVKLWJM-VQHVLOKHSA-N 1 2 232.283 2.063 20 0 BEADLO CCC/C(C)=C/C(=O)OCc1ccc[nH+]c1N ZINC000922381485 643983535 /nfs/dbraw/zinc/98/35/35/643983535.db2.gz DIPAUFFGRXXNSK-CSKARUKUSA-N 1 2 234.299 2.453 20 0 BEADLO CCC(C)(C)C(=O)OCc1ccc[nH+]c1N ZINC000922408265 643990894 /nfs/dbraw/zinc/99/08/94/643990894.db2.gz KTOCRSYHNIYQRQ-UHFFFAOYSA-N 1 2 222.288 2.143 20 0 BEADLO CC(C)(C)/C=C/C(=O)OCc1ccc[nH+]c1N ZINC000922437300 643993696 /nfs/dbraw/zinc/99/36/96/643993696.db2.gz JFZABCPYHAVZMA-VOTSOKGWSA-N 1 2 234.299 2.309 20 0 BEADLO C[C@H](C(=O)OCc1ccc(N)[nH+]c1)C(C)(C)C ZINC000922461770 643998298 /nfs/dbraw/zinc/99/82/98/643998298.db2.gz MQUPHHBSJNWUNH-SECBINFHSA-N 1 2 236.315 2.389 20 0 BEADLO Nc1ccc(COC(=O)CCC(F)(F)F)c[nH+]1 ZINC000922495773 644003640 /nfs/dbraw/zinc/00/36/40/644003640.db2.gz VZHSCNAEJHZXAX-UHFFFAOYSA-N 1 2 248.204 2.050 20 0 BEADLO Nc1[nH+]cccc1COC(=O)CCC1CCC1 ZINC000922511331 644010157 /nfs/dbraw/zinc/01/01/57/644010157.db2.gz ZZBQSPGBPSFBRC-UHFFFAOYSA-N 1 2 234.299 2.287 20 0 BEADLO C[C@H]1CC[C@@H](C(=O)OCc2ccc[nH+]c2N)C1 ZINC000922586782 644035473 /nfs/dbraw/zinc/03/54/73/644035473.db2.gz JOKUYEYINAQXFG-VHSXEESVSA-N 1 2 234.299 2.143 20 0 BEADLO C[C@@H]1CCC[C@H]1C(=O)OCc1ccc[nH+]c1N ZINC000922605005 644040316 /nfs/dbraw/zinc/04/03/16/644040316.db2.gz DTFFARUVJMAHQU-MWLCHTKSSA-N 1 2 234.299 2.143 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1C(=O)OCc1ccc(N)[nH+]c1 ZINC000922624028 644042616 /nfs/dbraw/zinc/04/26/16/644042616.db2.gz LLAQWQPTOXGZAG-BXUZGUMPSA-N 1 2 248.326 2.389 20 0 BEADLO CC[C@@H](C)CC(=O)OCc1ccc[nH+]c1N ZINC000922639792 644047135 /nfs/dbraw/zinc/04/71/35/644047135.db2.gz AVLFYOCPPJWBNK-SECBINFHSA-N 1 2 222.288 2.143 20 0 BEADLO CCn1nc(C)c(C[NH2+]C(C)(C)/C=C\Cl)n1 ZINC000922644368 644049355 /nfs/dbraw/zinc/04/93/55/644049355.db2.gz HNCHBOHDUHZJOX-SREVYHEPSA-N 1 2 242.754 2.227 20 0 BEADLO CC[C@@H](C)CC(=O)OCc1ccc(N)[nH+]c1 ZINC000922640472 644054766 /nfs/dbraw/zinc/05/47/66/644054766.db2.gz DNKWLDQWJDCMQG-SECBINFHSA-N 1 2 222.288 2.143 20 0 BEADLO C[C@@]1(C(=O)OCc2ccc(N)[nH+]c2)CC=CCC1 ZINC000922782217 644095646 /nfs/dbraw/zinc/09/56/46/644095646.db2.gz PKPTUOIFVXGOOU-CQSZACIVSA-N 1 2 246.310 2.453 20 0 BEADLO Nc1ccc(COC(=O)[C@@H]2C[C@H]2C2CCC2)c[nH+]1 ZINC000922835160 644113304 /nfs/dbraw/zinc/11/33/04/644113304.db2.gz BXKKLUOQUFVOPY-NWDGAFQWSA-N 1 2 246.310 2.143 20 0 BEADLO Nc1[nH+]cccc1COC(=O)/C=C/C1CCCC1 ZINC000922837543 644114922 /nfs/dbraw/zinc/11/49/22/644114922.db2.gz ALNVPSCXELGZOW-BQYQJAHWSA-N 1 2 246.310 2.453 20 0 BEADLO CC[C@@H]1C[C@H]1COC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000922841894 644116731 /nfs/dbraw/zinc/11/67/31/644116731.db2.gz DYWQPSURWGLTOV-TUAOUCFPSA-N 1 2 236.315 2.424 20 0 BEADLO Nc1ccc(COC(=O)[C@H]2CCCC23CC3)c[nH+]1 ZINC000922897581 644186223 /nfs/dbraw/zinc/18/62/23/644186223.db2.gz NSIJKLVVGGDFID-LLVKDONJSA-N 1 2 246.310 2.287 20 0 BEADLO Cn1nc(C2CC2)cc1C[NH2+]Cc1cscn1 ZINC000922948904 644199174 /nfs/dbraw/zinc/19/91/74/644199174.db2.gz ZGIRQZJQDDCNOK-UHFFFAOYSA-N 1 2 248.355 2.044 20 0 BEADLO Cc1coc(C[NH2+]Cc2cc(C3CC3)n(C)n2)c1 ZINC000922956533 644200253 /nfs/dbraw/zinc/20/02/53/644200253.db2.gz VVQOMVSDUISGDH-UHFFFAOYSA-N 1 2 245.326 2.489 20 0 BEADLO Cn1nc(C[NH2+]Cc2ccoc2)cc1C1CC1 ZINC000922956898 644200683 /nfs/dbraw/zinc/20/06/83/644200683.db2.gz DLJVFQLQNNCRHH-UHFFFAOYSA-N 1 2 231.299 2.180 20 0 BEADLO C[C@]1([NH2+]Cc2ncc[nH]2)CCOc2ccccc21 ZINC000923023867 644236453 /nfs/dbraw/zinc/23/64/53/644236453.db2.gz CLJGMGGUCCZTAV-AWEZNQCLSA-N 1 2 243.310 2.197 20 0 BEADLO CC1CCN(C(=O)c2cccc3[nH+]ccn32)CC1 ZINC000082301800 644365647 /nfs/dbraw/zinc/36/56/47/644365647.db2.gz REHAAELZMAVPCM-UHFFFAOYSA-N 1 2 243.310 2.206 20 0 BEADLO CCCCOC(=O)C[N@@H+]1CCSC(C)(C)C1 ZINC000083690440 644406356 /nfs/dbraw/zinc/40/63/56/644406356.db2.gz TVPWHSGFKQCRCU-UHFFFAOYSA-N 1 2 245.388 2.157 20 0 BEADLO CCCCOC(=O)C[N@H+]1CCSC(C)(C)C1 ZINC000083690440 644406364 /nfs/dbraw/zinc/40/63/64/644406364.db2.gz TVPWHSGFKQCRCU-UHFFFAOYSA-N 1 2 245.388 2.157 20 0 BEADLO OC[C@@H]1CCC[N@H+](C/C(Cl)=C/Cl)C1 ZINC000086001403 644454814 /nfs/dbraw/zinc/45/48/14/644454814.db2.gz LJJCDSSTSBJTKP-HMXLAXJASA-N 1 2 224.131 2.010 20 0 BEADLO OC[C@@H]1CCC[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000086001403 644454819 /nfs/dbraw/zinc/45/48/19/644454819.db2.gz LJJCDSSTSBJTKP-HMXLAXJASA-N 1 2 224.131 2.010 20 0 BEADLO CC[NH2+]Cc1noc(C2(CC)CCCC2)n1 ZINC000087318898 644489630 /nfs/dbraw/zinc/48/96/30/644489630.db2.gz LLGBQVRYGOSIAU-UHFFFAOYSA-N 1 2 223.320 2.401 20 0 BEADLO C[C@H]([NH2+][C@H]1CCOC1=O)[C@@H](C)c1ccccc1 ZINC000245456618 644526345 /nfs/dbraw/zinc/52/63/45/644526345.db2.gz BLBCZHDKRBIHSU-MDZLAQPJSA-N 1 2 233.311 2.084 20 0 BEADLO Cc1cnc(C(=O)Nc2cc[nH+]c(C)c2)c(C)c1 ZINC000780016118 644723539 /nfs/dbraw/zinc/72/35/39/644723539.db2.gz FDYHVEGSPYPXLN-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)OCc1c[nH+]cn1C ZINC000780400777 644730039 /nfs/dbraw/zinc/73/00/39/644730039.db2.gz LTZYNZMVDYEORE-UWVGGRQHSA-N 1 2 224.304 2.146 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)OCc1c[nH+]cn1C ZINC000780400778 644730374 /nfs/dbraw/zinc/73/03/74/644730374.db2.gz LTZYNZMVDYEORE-VHSXEESVSA-N 1 2 224.304 2.146 20 0 BEADLO CCC/C=C/C(=O)OCCCn1cc[nH+]c1 ZINC000782991316 644749069 /nfs/dbraw/zinc/74/90/69/644749069.db2.gz OMBSVQJFZACCNJ-GQCTYLIASA-N 1 2 222.288 2.173 20 0 BEADLO C[C@H](CNc1[nH+]cnc2c1cnn2C)C(C)(C)C ZINC000096609870 644827228 /nfs/dbraw/zinc/82/72/28/644827228.db2.gz ZVOXGGBNLKYBPQ-SECBINFHSA-N 1 2 247.346 2.457 20 0 BEADLO COc1ncncc1C[NH2+][C@@H](C)c1ccc(C)o1 ZINC000647168439 644838935 /nfs/dbraw/zinc/83/89/35/644838935.db2.gz VQIRHSUFZJYGAQ-JTQLQIEISA-N 1 2 247.298 2.237 20 0 BEADLO COc1ncncc1C[NH2+][C@H](C)c1ccc(C)o1 ZINC000647168440 644839349 /nfs/dbraw/zinc/83/93/49/644839349.db2.gz VQIRHSUFZJYGAQ-SNVBAGLBSA-N 1 2 247.298 2.237 20 0 BEADLO Cc1cc(CNC(=O)C2=CCCCO2)cc(C)[nH+]1 ZINC000817458905 644984083 /nfs/dbraw/zinc/98/40/83/644984083.db2.gz NBGKVDKASAQRER-UHFFFAOYSA-N 1 2 246.310 2.009 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)NCCC[C@@H]1C=CCC1 ZINC000834326683 645138455 /nfs/dbraw/zinc/13/84/55/645138455.db2.gz ILVVPULGAIBWME-GFCCVEGCSA-N 1 2 247.342 2.205 20 0 BEADLO O=C(Cn1cc[nH+]c1)N1CCCCCCCC1 ZINC000836924074 645181770 /nfs/dbraw/zinc/18/17/70/645181770.db2.gz YZBAFHBYWHSBAO-UHFFFAOYSA-N 1 2 235.331 2.066 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2ncc[nH]2)nc1C ZINC000926570648 645290606 /nfs/dbraw/zinc/29/06/06/645290606.db2.gz XWHXEOYOAZTZAP-NSHDSACASA-N 1 2 230.315 2.272 20 0 BEADLO C[C@@H](CC(=O)OCc1ccoc1)n1cc[nH+]c1 ZINC000845448646 645361211 /nfs/dbraw/zinc/36/12/11/645361211.db2.gz KVGOQGAPBVJKOU-JTQLQIEISA-N 1 2 234.255 2.171 20 0 BEADLO C/C=C(\C)COC(=O)Cc1cn2c([nH+]1)CCCC2 ZINC000845612911 645370807 /nfs/dbraw/zinc/37/08/07/645370807.db2.gz RJNHKWPGCCJZBQ-QDEBKDIKSA-N 1 2 248.326 2.271 20 0 BEADLO C[C@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H]2F)c2ncnn21 ZINC000926783883 645431738 /nfs/dbraw/zinc/43/17/38/645431738.db2.gz CHSAKCCRMSAKNH-MMWGEVLESA-N 1 2 238.310 2.154 20 0 BEADLO COc1cc([C@@H](C)[NH2+]Cc2ccc(C)o2)on1 ZINC000926788459 645433076 /nfs/dbraw/zinc/43/30/76/645433076.db2.gz GOMGZRPVYHKXJA-SECBINFHSA-N 1 2 236.271 2.435 20 0 BEADLO C[C@H]([NH2+][C@@H]1C[C@H]1C(F)(F)F)c1ncco1 ZINC000926799259 645437705 /nfs/dbraw/zinc/43/77/05/645437705.db2.gz PSLLNLOWKGYJMF-RRKCRQDMSA-N 1 2 220.194 2.276 20 0 BEADLO Cc1noc([C@H](C)[N@H+](C)C[C@H]2CCC=CO2)n1 ZINC000848926572 645445553 /nfs/dbraw/zinc/44/55/53/645445553.db2.gz ZTNVGIKOAOFOIW-GXSJLCMTSA-N 1 2 237.303 2.064 20 0 BEADLO Cc1noc([C@H](C)[N@@H+](C)C[C@H]2CCC=CO2)n1 ZINC000848926572 645445564 /nfs/dbraw/zinc/44/55/64/645445564.db2.gz ZTNVGIKOAOFOIW-GXSJLCMTSA-N 1 2 237.303 2.064 20 0 BEADLO Cc1cc(N[C@H]2COC[C@@H]2C)c[nH+]c1C ZINC000926854615 645457201 /nfs/dbraw/zinc/45/72/01/645457201.db2.gz DGMGBWROZDEETD-CABZTGNLSA-N 1 2 206.289 2.145 20 0 BEADLO CC(C)[C@H]([NH2+][C@@H](C)c1ncco1)c1cnn(C)c1 ZINC000927072959 645537158 /nfs/dbraw/zinc/53/71/58/645537158.db2.gz ZUFNKYPGAIXRLI-JQWIXIFHSA-N 1 2 248.330 2.456 20 0 BEADLO CCc1onc(C)c1C[NH2+][C@@H](C)c1cn(C)cn1 ZINC000927130064 645562723 /nfs/dbraw/zinc/56/27/23/645562723.db2.gz BTUYHGAWLPTKBY-JTQLQIEISA-N 1 2 248.330 2.130 20 0 BEADLO CC(C)(C)CCCC(=O)NCc1ccc(N)[nH+]c1 ZINC000927780596 645657999 /nfs/dbraw/zinc/65/79/99/645657999.db2.gz KRIDUNDADFJISQ-UHFFFAOYSA-N 1 2 249.358 2.496 20 0 BEADLO CC(C)C[C@H](C)CC(=O)NCc1ccc(N)[nH+]c1 ZINC000927780850 645658918 /nfs/dbraw/zinc/65/89/18/645658918.db2.gz PAERFVQZANHKHY-NSHDSACASA-N 1 2 249.358 2.352 20 0 BEADLO CCCOC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000859195323 645676816 /nfs/dbraw/zinc/67/68/16/645676816.db2.gz ZUCRSELBUDMCIP-UHFFFAOYSA-N 1 2 222.288 2.335 20 0 BEADLO CCc1ncc(C[N@H+](C)Cc2ccco2)o1 ZINC000929138261 645966553 /nfs/dbraw/zinc/96/65/53/645966553.db2.gz JZNXRKINSYVDSK-UHFFFAOYSA-N 1 2 220.272 2.462 20 0 BEADLO CCc1ncc(C[N@@H+](C)Cc2ccco2)o1 ZINC000929138261 645966555 /nfs/dbraw/zinc/96/65/55/645966555.db2.gz JZNXRKINSYVDSK-UHFFFAOYSA-N 1 2 220.272 2.462 20 0 BEADLO CCCC[N@H+](CC)Cc1nnc(OC)s1 ZINC000929143990 645969793 /nfs/dbraw/zinc/96/97/93/645969793.db2.gz ZCUGQCUUSQBGDJ-UHFFFAOYSA-N 1 2 229.349 2.169 20 0 BEADLO CCCC[N@@H+](CC)Cc1nnc(OC)s1 ZINC000929143990 645969797 /nfs/dbraw/zinc/96/97/97/645969797.db2.gz ZCUGQCUUSQBGDJ-UHFFFAOYSA-N 1 2 229.349 2.169 20 0 BEADLO c1[nH]cc([C@@H]2C[C@H]2c2nc([C@@H]3CC34CC4)no2)[nH+]1 ZINC000924105305 645980460 /nfs/dbraw/zinc/98/04/60/645980460.db2.gz YHGGJYHNLPTFHF-HLTSFMKQSA-N 1 2 242.282 2.331 20 0 BEADLO Cc1cc(C)nc(C[N@H+]2C[C@@H](C)OC[C@H]2C)c1 ZINC000929181779 645989794 /nfs/dbraw/zinc/98/97/94/645989794.db2.gz HFTGGYUOAIBEMP-CHWSQXEVSA-N 1 2 234.343 2.308 20 0 BEADLO Cc1cc(C)nc(C[N@@H+]2C[C@@H](C)OC[C@H]2C)c1 ZINC000929181779 645989799 /nfs/dbraw/zinc/98/97/99/645989799.db2.gz HFTGGYUOAIBEMP-CHWSQXEVSA-N 1 2 234.343 2.308 20 0 BEADLO CC[C@@H](C)Cc1noc([C@@H](C)[NH+](C)C)n1 ZINC000924152425 645998881 /nfs/dbraw/zinc/99/88/81/645998881.db2.gz KNAYVIKASCOWIR-RKDXNWHRSA-N 1 2 211.309 2.281 20 0 BEADLO CC1(C(=O)OCCCn2cc[nH+]c2)CC=CC1 ZINC000924200631 646003682 /nfs/dbraw/zinc/00/36/82/646003682.db2.gz BWSIUNCFCNDAKN-UHFFFAOYSA-N 1 2 234.299 2.173 20 0 BEADLO C[C@]1(C(=O)OCc2ccc[nH+]c2N)C=CCC1 ZINC000924411402 646031694 /nfs/dbraw/zinc/03/16/94/646031694.db2.gz FRAOXLRMNDURST-ZDUSSCGKSA-N 1 2 232.283 2.063 20 0 BEADLO Fc1cncc(F)c1C[NH+]1C2CCC1CC2 ZINC000929247850 646031663 /nfs/dbraw/zinc/03/16/63/646031663.db2.gz CIXBNBZIHODLME-UHFFFAOYSA-N 1 2 224.254 2.487 20 0 BEADLO C[C@H](c1ncccn1)[N@H+](C)C[C@@H]1CCCCO1 ZINC000929331339 646085961 /nfs/dbraw/zinc/08/59/61/646085961.db2.gz WQDUXVLFMKRKCP-NEPJUHHUSA-N 1 2 235.331 2.039 20 0 BEADLO C[C@H](c1ncccn1)[N@@H+](C)C[C@@H]1CCCCO1 ZINC000929331339 646085968 /nfs/dbraw/zinc/08/59/68/646085968.db2.gz WQDUXVLFMKRKCP-NEPJUHHUSA-N 1 2 235.331 2.039 20 0 BEADLO CC(C)n1cc([C@H](C)[NH2+]Cc2ccoc2)nn1 ZINC000924747828 646101209 /nfs/dbraw/zinc/10/12/09/646101209.db2.gz MCFZNJLEBBLZBN-JTQLQIEISA-N 1 2 234.303 2.303 20 0 BEADLO CCn1nc(C)c([C@H](C)[NH2+]Cc2ccoc2C)n1 ZINC000924826933 646112071 /nfs/dbraw/zinc/11/20/71/646112071.db2.gz RFEZHQDSVHMIPA-VIFPVBQESA-N 1 2 248.330 2.359 20 0 BEADLO C[C@H]([NH2+]Cc1cccc(CO)c1)c1ncco1 ZINC000924972646 646146127 /nfs/dbraw/zinc/14/61/27/646146127.db2.gz NQEBMTANPHCZCF-JTQLQIEISA-N 1 2 232.283 2.018 20 0 BEADLO Cc1cc(C[NH2+][C@@H]2CCCc3oc(C)nc32)[nH]n1 ZINC000925104120 646186619 /nfs/dbraw/zinc/18/66/19/646186619.db2.gz RVDGYCFETJMYAE-LLVKDONJSA-N 1 2 246.314 2.182 20 0 BEADLO C[N@H+](Cc1coc(C(C)(C)C)n1)[C@H]1CCOC1 ZINC000929600500 646193603 /nfs/dbraw/zinc/19/36/03/646193603.db2.gz IMVMHAUOMZTEHK-NSHDSACASA-N 1 2 238.331 2.193 20 0 BEADLO C[N@@H+](Cc1coc(C(C)(C)C)n1)[C@H]1CCOC1 ZINC000929600500 646193606 /nfs/dbraw/zinc/19/36/06/646193606.db2.gz IMVMHAUOMZTEHK-NSHDSACASA-N 1 2 238.331 2.193 20 0 BEADLO CCc1cnc(C[NH2+][C@H](C)c2ccnnc2)s1 ZINC000925162134 646197552 /nfs/dbraw/zinc/19/75/52/646197552.db2.gz FMYRBYKNCDAXKT-SECBINFHSA-N 1 2 248.355 2.346 20 0 BEADLO C[C@H]([NH2+]Cc1ccon1)c1cnn(C2CCC2)c1 ZINC000925211650 646209460 /nfs/dbraw/zinc/20/94/60/646209460.db2.gz LXELVOMVAGUJCF-JTQLQIEISA-N 1 2 246.314 2.447 20 0 BEADLO C[C@@H]([NH2+]Cc1ccon1)c1cnn(C2CCC2)c1 ZINC000925211651 646210218 /nfs/dbraw/zinc/21/02/18/646210218.db2.gz LXELVOMVAGUJCF-SNVBAGLBSA-N 1 2 246.314 2.447 20 0 BEADLO COc1nnc(C[N@@H+]2CCCCC[C@H]2C)s1 ZINC000929651579 646222411 /nfs/dbraw/zinc/22/24/11/646222411.db2.gz ZIYMUCMCJXUXLZ-SECBINFHSA-N 1 2 241.360 2.311 20 0 BEADLO COc1nnc(C[N@H+]2CCCCC[C@H]2C)s1 ZINC000929651579 646222421 /nfs/dbraw/zinc/22/24/21/646222421.db2.gz ZIYMUCMCJXUXLZ-SECBINFHSA-N 1 2 241.360 2.311 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1cc(C)cc(C)n1 ZINC000929659954 646228423 /nfs/dbraw/zinc/22/84/23/646228423.db2.gz NFFUWAGNXXYQFG-CQSZACIVSA-N 1 2 234.343 2.309 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1cc(C)cc(C)n1 ZINC000929659954 646228424 /nfs/dbraw/zinc/22/84/24/646228424.db2.gz NFFUWAGNXXYQFG-CQSZACIVSA-N 1 2 234.343 2.309 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)C[C@H]1CC2CCC1CC2 ZINC000929811016 646329306 /nfs/dbraw/zinc/32/93/06/646329306.db2.gz FRFQMYBMNHOZGY-HTAVTVPLSA-N 1 2 234.347 2.063 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)C[C@H]1CC2CCC1CC2 ZINC000929811016 646329309 /nfs/dbraw/zinc/32/93/09/646329309.db2.gz FRFQMYBMNHOZGY-HTAVTVPLSA-N 1 2 234.347 2.063 20 0 BEADLO FC(F)(F)[C@H]1CCC[C@@H](Cn2cc[nH+]c2)O1 ZINC000929865361 646365601 /nfs/dbraw/zinc/36/56/01/646365601.db2.gz CWGUBLIJXVBSNR-DTWKUNHWSA-N 1 2 234.221 2.383 20 0 BEADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@H](C)c1cn[nH]c1 ZINC000925633242 646377997 /nfs/dbraw/zinc/37/79/97/646377997.db2.gz COJTVKCGNCIJLP-LDYMZIIASA-N 1 2 246.314 2.434 20 0 BEADLO Cc1nonc1[C@H](C)[NH2+][C@H](C)c1ccc[nH]1 ZINC000925644973 646386647 /nfs/dbraw/zinc/38/66/47/646386647.db2.gz NSPDSWSFIPQGMJ-SFYZADRCSA-N 1 2 220.276 2.118 20 0 BEADLO Cc1nonc1[C@H](C)[NH2+][C@@H](C)c1ccc[nH]1 ZINC000925644975 646387775 /nfs/dbraw/zinc/38/77/75/646387775.db2.gz NSPDSWSFIPQGMJ-YUMQZZPRSA-N 1 2 220.276 2.118 20 0 BEADLO C[N@H+](Cc1c(F)cncc1F)[C@@H]1CCSC1 ZINC000930094787 646431765 /nfs/dbraw/zinc/43/17/65/646431765.db2.gz UKVIHCWURXXJGF-MRVPVSSYSA-N 1 2 244.310 2.297 20 0 BEADLO C[N@@H+](Cc1c(F)cncc1F)[C@@H]1CCSC1 ZINC000930094787 646431767 /nfs/dbraw/zinc/43/17/67/646431767.db2.gz UKVIHCWURXXJGF-MRVPVSSYSA-N 1 2 244.310 2.297 20 0 BEADLO Cc1cn(C)nc1C[N@@H+](C)[C@@H](C)c1cccnc1 ZINC000930120205 646440486 /nfs/dbraw/zinc/44/04/86/646440486.db2.gz ZAAMRUVPFCPPJN-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cn(C)nc1C[N@H+](C)[C@@H](C)c1cccnc1 ZINC000930120205 646440489 /nfs/dbraw/zinc/44/04/89/646440489.db2.gz ZAAMRUVPFCPPJN-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO CCc1noc(C)c1C[NH2+][C@@H](C)c1cn(C)cn1 ZINC000926482158 646654515 /nfs/dbraw/zinc/65/45/15/646654515.db2.gz OWYORRDULBIKCC-VIFPVBQESA-N 1 2 248.330 2.130 20 0 BEADLO Cc1ccc(C)c(NC(=O)C[C@@H]([NH3+])C(F)F)c1 ZINC000724758393 711610645 /nfs/dbraw/zinc/61/06/45/711610645.db2.gz CFGZYZOKVILYQI-SECBINFHSA-N 1 2 242.269 2.224 20 0 BEADLO [NH3+][C@@H](CC(=O)NCCCC1CCCC1)C(F)F ZINC000724759548 711610664 /nfs/dbraw/zinc/61/06/64/711610664.db2.gz QXZZWKIPYYWVEY-JTQLQIEISA-N 1 2 248.317 2.056 20 0 BEADLO OCCC[N@H+](Cc1scnc1Cl)C1CC1 ZINC000721957231 711947998 /nfs/dbraw/zinc/94/79/98/711947998.db2.gz UVNKVJZPVDBHJL-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO OCCC[N@@H+](Cc1scnc1Cl)C1CC1 ZINC000721957231 711948001 /nfs/dbraw/zinc/94/80/01/711948001.db2.gz UVNKVJZPVDBHJL-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO Cc1conc1C[NH2+][C@H](C)c1cncs1 ZINC000708237704 712184187 /nfs/dbraw/zinc/18/41/87/712184187.db2.gz YOEAMRNPDNUPHX-MRVPVSSYSA-N 1 2 223.301 2.290 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cn(C)cn1)c1cncs1 ZINC000710184228 712247341 /nfs/dbraw/zinc/24/73/41/712247341.db2.gz NIRNQPGZVICMHB-DTWKUNHWSA-N 1 2 236.344 2.288 20 0 BEADLO Cn1cc(Cl)cc1C[N@H+](C)CCF ZINC000379388284 712381072 /nfs/dbraw/zinc/38/10/72/712381072.db2.gz JESAAOULLXGVNJ-UHFFFAOYSA-N 1 2 204.676 2.080 20 0 BEADLO Cn1cc(Cl)cc1C[N@@H+](C)CCF ZINC000379388284 712381073 /nfs/dbraw/zinc/38/10/73/712381073.db2.gz JESAAOULLXGVNJ-UHFFFAOYSA-N 1 2 204.676 2.080 20 0 BEADLO Cc1nc(NCC[C@@H]2CCCS2)cc[nH+]1 ZINC000715619175 712528171 /nfs/dbraw/zinc/52/81/71/712528171.db2.gz GRMBFXVPRVJGCE-JTQLQIEISA-N 1 2 223.345 2.483 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2ccc(Cl)nc2)CCO1 ZINC000720495355 712847282 /nfs/dbraw/zinc/84/72/82/712847282.db2.gz KTKGNGKRZQRTHR-SNVBAGLBSA-N 1 2 240.734 2.346 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2ccc(Cl)nc2)CCO1 ZINC000720495355 712847283 /nfs/dbraw/zinc/84/72/83/712847283.db2.gz KTKGNGKRZQRTHR-SNVBAGLBSA-N 1 2 240.734 2.346 20 0 BEADLO Cc1cc(-c2cnc3ccnn3c2)c2[nH+]ccn2c1 ZINC001240429278 1169009361 /nfs/dbraw/zinc/00/93/61/1169009361.db2.gz RHSLRPNIWAUANV-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO Cc1nonc1C[NH2+]C(C)(C)c1cccs1 ZINC000381363291 710627590 /nfs/dbraw/zinc/62/75/90/710627590.db2.gz GBRVEPGREYDCRZ-UHFFFAOYSA-N 1 2 237.328 2.464 20 0 BEADLO CC[C@@](C)([NH2+]CCc1cccs1)C(=O)OC ZINC000381395452 710631538 /nfs/dbraw/zinc/63/15/38/710631538.db2.gz PLRFKKMITHCBRO-GFCCVEGCSA-N 1 2 241.356 2.222 20 0 BEADLO C[C@@H]1CCC[C@@H](N(C)C(=O)C[C@H]([NH3+])C(F)F)C1 ZINC000724757044 710746327 /nfs/dbraw/zinc/74/63/27/710746327.db2.gz AMMKAMDIYFDTPR-BBBLOLIVSA-N 1 2 248.317 2.006 20 0 BEADLO CCn1ccnc1C[NH2+][C@@H]1CCc2cccnc21 ZINC000385328520 711011922 /nfs/dbraw/zinc/01/19/22/711011922.db2.gz KCLIJGJRMLDWPK-GFCCVEGCSA-N 1 2 242.326 2.075 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2cnn(C)n2)cc1F ZINC000386147122 711023646 /nfs/dbraw/zinc/02/36/46/711023646.db2.gz BYTBYECJEAQIFK-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO FC(F)C1([NH2+]C[C@H]2CCC=CO2)CC1 ZINC000389212940 711073256 /nfs/dbraw/zinc/07/32/56/711073256.db2.gz JIMISSRXOAYURW-MRVPVSSYSA-N 1 2 203.232 2.066 20 0 BEADLO Fc1ncccc1C[NH2+]Cc1ccco1 ZINC000389878645 711094721 /nfs/dbraw/zinc/09/47/21/711094721.db2.gz MYAVTZCLKSZIIY-UHFFFAOYSA-N 1 2 206.220 2.104 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@@H](C)CSC(C)(C)C ZINC000390425753 711116416 /nfs/dbraw/zinc/11/64/16/711116416.db2.gz MHAVXLGRTGFNJO-UWVGGRQHSA-N 1 2 247.404 2.448 20 0 BEADLO Cn1c[nH+]cc1CNc1sccc1[N+](=O)[O-] ZINC000390764280 711133652 /nfs/dbraw/zinc/13/36/52/711133652.db2.gz PAOKIXCGBHXJMD-UHFFFAOYSA-N 1 2 238.272 2.002 20 0 BEADLO COc1ccc(C[NH2+]Cc2nnc(C)s2)cc1 ZINC000391766453 711140602 /nfs/dbraw/zinc/14/06/02/711140602.db2.gz AKEDMXSECUUPSK-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO Cc1nccnc1[C@@H](C)Nc1cccc[nH+]1 ZINC000393753872 711172837 /nfs/dbraw/zinc/17/28/37/711172837.db2.gz GJVBCGUMFLBMFA-SNVBAGLBSA-N 1 2 214.272 2.353 20 0 BEADLO c1[nH]nnc1C[NH2+][C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC000398303473 711406798 /nfs/dbraw/zinc/40/67/98/711406798.db2.gz SQYQQWGQIUBXEZ-IJLUTSLNSA-N 1 2 234.347 2.253 20 0 BEADLO c1n[nH]nc1C[NH2+][C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC000398303473 711406800 /nfs/dbraw/zinc/40/68/00/711406800.db2.gz SQYQQWGQIUBXEZ-IJLUTSLNSA-N 1 2 234.347 2.253 20 0 BEADLO CC[C@]1(C)CCN(c2cc(NC)[nH+]cn2)C1 ZINC000399454593 711430204 /nfs/dbraw/zinc/43/02/04/711430204.db2.gz ZRXXUOUXJJIFRI-GFCCVEGCSA-N 1 2 220.320 2.145 20 0 BEADLO CC[C@]1(C)CCN(c2cc(NC)nc[nH+]2)C1 ZINC000399454593 711430205 /nfs/dbraw/zinc/43/02/05/711430205.db2.gz ZRXXUOUXJJIFRI-GFCCVEGCSA-N 1 2 220.320 2.145 20 0 BEADLO Cc1nc(NC[C@H]2CC[C@H](C3CC3)O2)cc[nH+]1 ZINC000722307562 710705117 /nfs/dbraw/zinc/70/51/17/710705117.db2.gz CHYIDJAZZRQEKV-VXGBXAGGSA-N 1 2 233.315 2.155 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2nnc(C)[nH]2)cs1 ZINC000392472906 711148400 /nfs/dbraw/zinc/14/84/00/711148400.db2.gz RFJLONCOKUZSOK-MRVPVSSYSA-N 1 2 236.344 2.334 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccc(C)c(F)c2)[nH]1 ZINC000392459705 711148000 /nfs/dbraw/zinc/14/80/00/711148000.db2.gz MDKJYHOZKOEQSU-SECBINFHSA-N 1 2 248.305 2.411 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccsc2)[nH]1 ZINC000392476269 711148288 /nfs/dbraw/zinc/14/82/88/711148288.db2.gz SOUOHXBBENVTAA-SSDOTTSWSA-N 1 2 222.317 2.025 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2CCC[C@H](C)C2)n1 ZINC000383224462 711476968 /nfs/dbraw/zinc/47/69/68/711476968.db2.gz GFKXKNGGWWVWCQ-VHSXEESVSA-N 1 2 223.320 2.473 20 0 BEADLO CCCCC[C@H](C)NC(=O)C[C@H]([NH3+])C(F)F ZINC000724693122 711609253 /nfs/dbraw/zinc/60/92/53/711609253.db2.gz OLPFAJAQEWKIGP-IUCAKERBSA-N 1 2 236.306 2.054 20 0 BEADLO COc1cccnc1C[NH2+][C@H](C)c1ccns1 ZINC000926549418 711637243 /nfs/dbraw/zinc/63/72/43/711637243.db2.gz HSXJFMYBHGZOON-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO OCC[C@H](Nc1cccc[nH+]1)C1CCCC1 ZINC000725033893 711645646 /nfs/dbraw/zinc/64/56/46/711645646.db2.gz PMIFMQDFMDGISG-LBPRGKRZSA-N 1 2 220.316 2.435 20 0 BEADLO OCC[C@@H](Nc1cccc[nH+]1)C1CCCC1 ZINC000725033891 711645774 /nfs/dbraw/zinc/64/57/74/711645774.db2.gz PMIFMQDFMDGISG-GFCCVEGCSA-N 1 2 220.316 2.435 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2cccnc2)o1 ZINC000893418594 711720969 /nfs/dbraw/zinc/72/09/69/711720969.db2.gz KMFXXERQQOCUIG-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2cccnc2)o1 ZINC000893418594 711720970 /nfs/dbraw/zinc/72/09/70/711720970.db2.gz KMFXXERQQOCUIG-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO c1ccc(NC[C@@H]2CC[C@@H](C3CC3)O2)[nH+]c1 ZINC000722335468 711739349 /nfs/dbraw/zinc/73/93/49/711739349.db2.gz HXKNACPPBZBNPW-RYUDHWBXSA-N 1 2 218.300 2.451 20 0 BEADLO CCCNc1cc(NC[C@@H](CC)OC)nc[nH+]1 ZINC000310178750 711751401 /nfs/dbraw/zinc/75/14/01/711751401.db2.gz SJDKFUYFBFETCL-SNVBAGLBSA-N 1 2 238.335 2.135 20 0 BEADLO CCCNc1cc(NC[C@@H](CC)OC)[nH+]cn1 ZINC000310178750 711751402 /nfs/dbraw/zinc/75/14/02/711751402.db2.gz SJDKFUYFBFETCL-SNVBAGLBSA-N 1 2 238.335 2.135 20 0 BEADLO Cc1[nH]c(CNC(=O)C2C(C)(C)C2(C)C)[nH+]c1C ZINC000896915012 711783934 /nfs/dbraw/zinc/78/39/34/711783934.db2.gz FQWNDKIFPIYBMD-UHFFFAOYSA-N 1 2 249.358 2.325 20 0 BEADLO CC(C)=CC[NH+]1CC(NC(=O)[C@]2(C)C=CCC2)C1 ZINC001030798878 711843113 /nfs/dbraw/zinc/84/31/13/711843113.db2.gz UVDULNADUMFEIV-OAHLLOKOSA-N 1 2 248.370 2.109 20 0 BEADLO CCOC1CC2(C[C@H]2Nc2cccc[nH+]2)C1 ZINC000721296528 711959650 /nfs/dbraw/zinc/95/96/50/711959650.db2.gz DJPHDKGZAPVKOM-QWKFWESOSA-N 1 2 218.300 2.451 20 0 BEADLO CC(F)(F)C[NH2+]C[C@H](O)c1cccc(F)c1 ZINC000700055177 711984884 /nfs/dbraw/zinc/98/48/84/711984884.db2.gz DOHOKASMISTICI-JTQLQIEISA-N 1 2 233.233 2.104 20 0 BEADLO CNc1cc(N2CCCC[C@H](C)C2)nc[nH+]1 ZINC000703291091 712070649 /nfs/dbraw/zinc/07/06/49/712070649.db2.gz MQCWTCPXPCECSI-JTQLQIEISA-N 1 2 220.320 2.145 20 0 BEADLO CNc1cc(N2CCCC[C@H](C)C2)[nH+]cn1 ZINC000703291091 712070652 /nfs/dbraw/zinc/07/06/52/712070652.db2.gz MQCWTCPXPCECSI-JTQLQIEISA-N 1 2 220.320 2.145 20 0 BEADLO Cn1ncc2c1nc[nH+]c2NC[C@@]1(C)CC1(C)C ZINC000705287825 712127750 /nfs/dbraw/zinc/12/77/50/712127750.db2.gz FXNQUHXIAPDPGA-CYBMUJFWSA-N 1 2 245.330 2.211 20 0 BEADLO Cc1nc(N[C@@H](C2CCC2)[C@@H]2CCOC2)cc[nH+]1 ZINC000711869898 712337578 /nfs/dbraw/zinc/33/75/78/712337578.db2.gz MDHWWOHFPVOOMH-OCCSQVGLSA-N 1 2 247.342 2.402 20 0 BEADLO C[N@H+](C/C(Cl)=C\Cl)CC1(CO)CC1 ZINC000379353819 712374952 /nfs/dbraw/zinc/37/49/52/712374952.db2.gz GLMZGSYAIHCIKE-XBXARRHUSA-N 1 2 224.131 2.010 20 0 BEADLO C[N@@H+](C/C(Cl)=C\Cl)CC1(CO)CC1 ZINC000379353819 712374954 /nfs/dbraw/zinc/37/49/54/712374954.db2.gz GLMZGSYAIHCIKE-XBXARRHUSA-N 1 2 224.131 2.010 20 0 BEADLO C[C@H]1CCC(C)(C)C[C@H]1[NH2+]Cc1c[nH]nn1 ZINC000713096955 712452492 /nfs/dbraw/zinc/45/24/92/712452492.db2.gz PBPLFYCSSBBQPK-GXSJLCMTSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@H]1CCC(C)(C)C[C@H]1[NH2+]Cc1cn[nH]n1 ZINC000713096955 712452493 /nfs/dbraw/zinc/45/24/93/712452493.db2.gz PBPLFYCSSBBQPK-GXSJLCMTSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@H]1CCCC[C@H]1C(=O)NCc1ccc(N)[nH+]c1 ZINC000714404287 712485034 /nfs/dbraw/zinc/48/50/34/712485034.db2.gz LBTNWJXSGXPDIA-CMPLNLGQSA-N 1 2 247.342 2.106 20 0 BEADLO Fc1c[nH+]ccc1NCC[C@@H]1CCCS1 ZINC000715654059 712529621 /nfs/dbraw/zinc/52/96/21/712529621.db2.gz ATBRIZYMZXLDDL-VIFPVBQESA-N 1 2 226.320 2.340 20 0 BEADLO Cc1nc(N[C@@H](C)c2ccns2)cc[nH+]1 ZINC000715907817 712541649 /nfs/dbraw/zinc/54/16/49/712541649.db2.gz HJIMLUVYHDAQKD-ZETCQYMHSA-N 1 2 220.301 2.415 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](C)c2ccns2)cn1 ZINC000715968950 712546176 /nfs/dbraw/zinc/54/61/76/712546176.db2.gz WMRDKLPPAIRYDE-VIFPVBQESA-N 1 2 234.328 2.092 20 0 BEADLO CCC[C@@H]([NH2+]C[C@H]1CCC=CO1)C(=O)OCC ZINC000379919835 712626940 /nfs/dbraw/zinc/62/69/40/712626940.db2.gz QCOKUEZLKWHZFK-VXGBXAGGSA-N 1 2 241.331 2.001 20 0 BEADLO C=C/C=C/CC[N@@H+]1CCC[C@H]1c1nnc[nH]1 ZINC000931142781 712713711 /nfs/dbraw/zinc/71/37/11/712713711.db2.gz FPIGBPLMDGXUIL-UFFNRZRYSA-N 1 2 218.304 2.074 20 0 BEADLO C=C/C=C/CC[N@H+]1CCC[C@H]1c1nnc[nH]1 ZINC000931142781 712713714 /nfs/dbraw/zinc/71/37/14/712713714.db2.gz FPIGBPLMDGXUIL-UFFNRZRYSA-N 1 2 218.304 2.074 20 0 BEADLO CCC1CCC(OCC[NH+]2CCOCC2)CC1 ZINC001210225817 957689659 /nfs/dbraw/zinc/68/96/59/957689659.db2.gz ZYZOSVNFAHMXEF-UHFFFAOYSA-N 1 2 241.375 2.304 20 0 BEADLO Cc1ccc(F)cc1C[N@H+]1C[C@@H]2C[C@H]1CO2 ZINC001140592785 960449899 /nfs/dbraw/zinc/44/98/99/960449899.db2.gz COQBXQAKIOPKTN-STQMWFEESA-N 1 2 221.275 2.107 20 0 BEADLO C[N@H+](Cc1cc(Cl)ncc1F)[C@@H]1CCOC1 ZINC001140610767 960461200 /nfs/dbraw/zinc/46/12/00/960461200.db2.gz MLDAFYWENLIRKE-SECBINFHSA-N 1 2 244.697 2.095 20 0 BEADLO C[N@@H+](Cc1cc(Cl)ncc1F)[C@@H]1CCOC1 ZINC001140610767 960461217 /nfs/dbraw/zinc/46/12/17/960461217.db2.gz MLDAFYWENLIRKE-SECBINFHSA-N 1 2 244.697 2.095 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@H](F)CC2)n[nH]1 ZINC001203069775 960618290 /nfs/dbraw/zinc/61/82/90/960618290.db2.gz CXCSSTQPELPYOA-SNVBAGLBSA-N 1 2 211.284 2.042 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@H](F)CC2)n[nH]1 ZINC001203069775 960618295 /nfs/dbraw/zinc/61/82/95/960618295.db2.gz CXCSSTQPELPYOA-SNVBAGLBSA-N 1 2 211.284 2.042 20 0 BEADLO Cc1c[nH]c(C[N@H+](C)Cc2ccno2)c1C ZINC001140864181 960645934 /nfs/dbraw/zinc/64/59/34/960645934.db2.gz KPLAGNVVNPYZIV-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO Cc1c[nH]c(C[N@@H+](C)Cc2ccno2)c1C ZINC001140864181 960645951 /nfs/dbraw/zinc/64/59/51/960645951.db2.gz KPLAGNVVNPYZIV-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO CC[N@H+](Cc1[nH]cc(C)c1C)[C@@H](C)C(=O)OC ZINC001140867222 960654852 /nfs/dbraw/zinc/65/48/52/960654852.db2.gz WCNHBHSKPJAWJX-NSHDSACASA-N 1 2 238.331 2.015 20 0 BEADLO CC[N@@H+](Cc1[nH]cc(C)c1C)[C@@H](C)C(=O)OC ZINC001140867222 960654865 /nfs/dbraw/zinc/65/48/65/960654865.db2.gz WCNHBHSKPJAWJX-NSHDSACASA-N 1 2 238.331 2.015 20 0 BEADLO CC[N@H+](C)Cc1ccc(O)c(F)c1F ZINC001140890237 960664693 /nfs/dbraw/zinc/66/46/93/960664693.db2.gz ZRIQJKMQACYQFV-UHFFFAOYSA-N 1 2 201.216 2.122 20 0 BEADLO CC[N@@H+](C)Cc1ccc(O)c(F)c1F ZINC001140890237 960664708 /nfs/dbraw/zinc/66/47/08/960664708.db2.gz ZRIQJKMQACYQFV-UHFFFAOYSA-N 1 2 201.216 2.122 20 0 BEADLO FC1(F)CCC[N@H+](Cc2ncco2)CC1 ZINC001141004407 960796450 /nfs/dbraw/zinc/79/64/50/960796450.db2.gz FFJHYMCGVOIJGK-UHFFFAOYSA-N 1 2 216.231 2.296 20 0 BEADLO FC1(F)CCC[N@@H+](Cc2ncco2)CC1 ZINC001141004407 960796460 /nfs/dbraw/zinc/79/64/60/960796460.db2.gz FFJHYMCGVOIJGK-UHFFFAOYSA-N 1 2 216.231 2.296 20 0 BEADLO COC1CCC(Oc2cc[nH+]cc2)CC1 ZINC001225290596 962053015 /nfs/dbraw/zinc/05/30/15/962053015.db2.gz CCYMLTPFIGBDQL-UHFFFAOYSA-N 1 2 207.273 2.418 20 0 BEADLO CC(C)(C)C(=[NH2+])Nc1cnc2cc[nH]c2n1 ZINC001155176086 963002078 /nfs/dbraw/zinc/00/20/78/963002078.db2.gz PDCHLCRFVFIVIU-UHFFFAOYSA-N 1 2 217.276 2.393 20 0 BEADLO COCC(C)(C)Nc1[nH+]cc(C)cc1OC ZINC001156457102 963357490 /nfs/dbraw/zinc/35/74/90/963357490.db2.gz HVWOBPSQHXWJQE-UHFFFAOYSA-N 1 2 224.304 2.236 20 0 BEADLO COc1c[nH+]c(NC2(CO)CCCC2)c(C)c1 ZINC001157004557 963514194 /nfs/dbraw/zinc/51/41/94/963514194.db2.gz ZTTIKIFPPLRZIE-UHFFFAOYSA-N 1 2 236.315 2.116 20 0 BEADLO Cc1cc(NC[C@H]2C[C@@](C)(O)C2)c[nH+]c1C ZINC001168346033 964486569 /nfs/dbraw/zinc/48/65/69/964486569.db2.gz NIUVRIGEGJSFHO-BJHJDKERSA-N 1 2 220.316 2.271 20 0 BEADLO Cc1c(F)cc[nH+]c1NCCc1nncs1 ZINC001161729737 964720507 /nfs/dbraw/zinc/72/05/07/964720507.db2.gz UFOGNZKPIKEGLO-UHFFFAOYSA-N 1 2 238.291 2.035 20 0 BEADLO Cc1cc(NCC2COC2)[nH+]cc1C(F)(F)F ZINC001161946530 964829487 /nfs/dbraw/zinc/82/94/87/964829487.db2.gz SDEZDVJKJBXDDA-UHFFFAOYSA-N 1 2 246.232 2.467 20 0 BEADLO Cc1cc(N2CC(C)(F)C2)nc(C(C)C)[nH+]1 ZINC001164588949 965930972 /nfs/dbraw/zinc/93/09/72/965930972.db2.gz DKWBRWYBSURBOX-UHFFFAOYSA-N 1 2 223.295 2.457 20 0 BEADLO CC(C)COc1cc(N[C@@H](C)CCO)cc[nH+]1 ZINC001165965441 966215123 /nfs/dbraw/zinc/21/51/23/966215123.db2.gz BAMKSVNNYXETNH-NSHDSACASA-N 1 2 238.331 2.299 20 0 BEADLO O=C1CC[N@H+](CCCCc2ccccc2)C1 ZINC000396563516 1165747377 /nfs/dbraw/zinc/74/73/77/1165747377.db2.gz ZDMSAJGOPYQLCH-UHFFFAOYSA-N 1 2 217.312 2.284 20 0 BEADLO O=C1CC[N@@H+](CCCCc2ccccc2)C1 ZINC000396563516 1165747384 /nfs/dbraw/zinc/74/73/84/1165747384.db2.gz ZDMSAJGOPYQLCH-UHFFFAOYSA-N 1 2 217.312 2.284 20 0 BEADLO Fc1cnccc1C[NH+]1CC(c2cccnc2)C1 ZINC001206790025 1165765406 /nfs/dbraw/zinc/76/54/06/1165765406.db2.gz XQEFSXITTQLHEQ-UHFFFAOYSA-N 1 2 243.285 2.215 20 0 BEADLO CCc1cc(C[N@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)on1 ZINC001203219559 966565437 /nfs/dbraw/zinc/56/54/37/966565437.db2.gz VAHNRSMBVQMTSG-KPXOXKRLSA-N 1 2 224.279 2.027 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2ccc[nH]2)C[C@H]1F ZINC001204006849 966843498 /nfs/dbraw/zinc/84/34/98/966843498.db2.gz MKIFAJBBVOOPSJ-MNOVXSKESA-N 1 2 214.259 2.287 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2ccc[nH]2)C[C@H]1F ZINC001204006849 966843502 /nfs/dbraw/zinc/84/35/02/966843502.db2.gz MKIFAJBBVOOPSJ-MNOVXSKESA-N 1 2 214.259 2.287 20 0 BEADLO COC1(C)C[NH+](Cc2cc(C)c(C)o2)C1 ZINC001204531697 967029942 /nfs/dbraw/zinc/02/99/42/967029942.db2.gz LUFBKHGOJCFSAC-UHFFFAOYSA-N 1 2 209.289 2.117 20 0 BEADLO Cc1[nH+]cc(Nc2c(N)ccnc2Cl)cc1N ZINC001210287002 1165863923 /nfs/dbraw/zinc/86/39/23/1165863923.db2.gz JBQQEPWDTIXTAS-UHFFFAOYSA-N 1 2 249.705 2.346 20 0 BEADLO Cc1[nH+]cc(Nc2cncc(F)c2)cc1N ZINC001210287553 1165864870 /nfs/dbraw/zinc/86/48/70/1165864870.db2.gz WWDNFYCKKPJAGY-UHFFFAOYSA-N 1 2 218.235 2.250 20 0 BEADLO COc1ccc(-c2ccc[nH+]c2N)cc1F ZINC000069841376 1165906540 /nfs/dbraw/zinc/90/65/40/1165906540.db2.gz MHLYWMJOUDIPAW-UHFFFAOYSA-N 1 2 218.231 2.479 20 0 BEADLO COc1cccc(-c2ccc[nH+]c2N)c1 ZINC000069841329 1165906987 /nfs/dbraw/zinc/90/69/87/1165906987.db2.gz LRPROQDCEZGOJZ-UHFFFAOYSA-N 1 2 200.241 2.339 20 0 BEADLO c1csc([C@H]([NH2+]Cc2nnc[nH]2)C2CC2)c1 ZINC000042331476 1165917373 /nfs/dbraw/zinc/91/73/73/1165917373.db2.gz VXKNPBJHRUIPLV-LLVKDONJSA-N 1 2 234.328 2.107 20 0 BEADLO CCN(Cc1cccc(N)[nH+]1)CC(F)(F)F ZINC000086115580 1165925786 /nfs/dbraw/zinc/92/57/86/1165925786.db2.gz BDALLNWNBQFAPS-UHFFFAOYSA-N 1 2 233.237 2.048 20 0 BEADLO CCCC[C@H](O)CNc1cc[nH+]c(OC)c1 ZINC001252079021 968497567 /nfs/dbraw/zinc/49/75/67/968497567.db2.gz GCIDOJWNDMBEQB-NSHDSACASA-N 1 2 224.304 2.053 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1ccc(F)cn1 ZINC001207038484 968568789 /nfs/dbraw/zinc/56/87/89/968568789.db2.gz OUEYTOUKQWFOPX-SCZZXKLOSA-N 1 2 212.243 2.153 20 0 BEADLO C[C@H]1CC[N@@H+]1CCc1c(Cl)ncnc1Cl ZINC001207325669 968722510 /nfs/dbraw/zinc/72/25/10/968722510.db2.gz DVLOCHYVNNXOLT-ZETCQYMHSA-N 1 2 246.141 2.420 20 0 BEADLO C[C@H]1CC[N@H+]1CCc1c(Cl)ncnc1Cl ZINC001207325669 968722519 /nfs/dbraw/zinc/72/25/19/968722519.db2.gz DVLOCHYVNNXOLT-ZETCQYMHSA-N 1 2 246.141 2.420 20 0 BEADLO CSCC[C@H](C)[NH2+]CC(=O)OC(C)(C)C ZINC000130162860 1166149991 /nfs/dbraw/zinc/14/99/91/1166149991.db2.gz DPWTWQCQGLYZER-VIFPVBQESA-N 1 2 233.377 2.059 20 0 BEADLO CCOC(=O)C1([NH2+]CCSC)CCCCC1 ZINC000089912503 969213196 /nfs/dbraw/zinc/21/31/96/969213196.db2.gz MWTLSEVKWMJLNZ-UHFFFAOYSA-N 1 2 245.388 2.205 20 0 BEADLO C[C@@H](C[N@@H+]1CCC(=O)[C@H](F)CC1)C(F)(F)F ZINC001208896578 969285880 /nfs/dbraw/zinc/28/58/80/969285880.db2.gz XFRIYSFHKLVEKZ-JGVFFNPUSA-N 1 2 241.228 2.188 20 0 BEADLO CN1CC[C@H](Nc2ccc(C(C)(C)C)c[nH+]2)C1=O ZINC000230275215 1166332982 /nfs/dbraw/zinc/33/29/82/1166332982.db2.gz PZJSFLAMQKEBHP-NSHDSACASA-N 1 2 247.342 2.022 20 0 BEADLO C[NH+](C)Cc1ncc(Cl)cc1Cl ZINC000238333895 1166339536 /nfs/dbraw/zinc/33/95/36/1166339536.db2.gz XIFGYETUEWJGMH-UHFFFAOYSA-N 1 2 205.088 2.450 20 0 BEADLO Cc1ccc(C[NH2+]Cc2ncccc2F)nc1 ZINC000126294077 1166360275 /nfs/dbraw/zinc/36/02/75/1166360275.db2.gz RPRNZJIPGFGILT-UHFFFAOYSA-N 1 2 231.274 2.214 20 0 BEADLO Cc1ccc(NC[C@@H](O)C(C)C)c(C)[nH+]1 ZINC001253748620 969367177 /nfs/dbraw/zinc/36/71/77/969367177.db2.gz KLVSXXFNRWDQNN-GFCCVEGCSA-N 1 2 208.305 2.127 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@H](F)CC1 ZINC001209555298 969543187 /nfs/dbraw/zinc/54/31/87/969543187.db2.gz ZGKLWNQAICHRLM-NSHDSACASA-N 1 2 211.284 2.042 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@H](F)CC1 ZINC001209555298 969543192 /nfs/dbraw/zinc/54/31/92/969543192.db2.gz ZGKLWNQAICHRLM-NSHDSACASA-N 1 2 211.284 2.042 20 0 BEADLO Cc1csc(C[NH2+]Cc2cc(C)ccn2)n1 ZINC000328095836 1166455426 /nfs/dbraw/zinc/45/54/26/1166455426.db2.gz JRIUULRYGCKJCW-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO CC[C@@H]1CCC[C@H](C[NH2+]Cc2ncn[nH]2)C1 ZINC000394534717 1166597319 /nfs/dbraw/zinc/59/73/19/1166597319.db2.gz CCSLWPJIGXRAAB-MNOVXSKESA-N 1 2 222.336 2.111 20 0 BEADLO Cc1ccc(Nc2ccc(N)[nH+]c2)c(O)c1 ZINC000019952310 1166652278 /nfs/dbraw/zinc/65/22/78/1166652278.db2.gz XRFWETWHQYRNIT-UHFFFAOYSA-N 1 2 215.256 2.421 20 0 BEADLO Cc1cc([NH2+][C@H]2CCOC[C@@H]2C)ccc1N ZINC000301026092 970312290 /nfs/dbraw/zinc/31/22/90/970312290.db2.gz PKBBBVKYJVXMRM-GWCFXTLKSA-N 1 2 220.316 2.414 20 0 BEADLO Cc1cc(Nc2c[nH+]c(C)cc2C)nn1C ZINC001213503680 970333138 /nfs/dbraw/zinc/33/31/38/970333138.db2.gz SDOAMVQCYJFZGT-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO Fc1c[nH+]ccc1NC[C@@H]1CC[C@@H](C2CC2)O1 ZINC000722321310 1166784478 /nfs/dbraw/zinc/78/44/78/1166784478.db2.gz MCOMLNLUJDUDOS-GWCFXTLKSA-N 1 2 236.290 2.012 20 0 BEADLO CCCC[C@H](C)N(C)c1cc(N)nc[nH+]1 ZINC000379861414 1166803452 /nfs/dbraw/zinc/80/34/52/1166803452.db2.gz MCOUSLNUBLPTCM-VIFPVBQESA-N 1 2 208.309 2.074 20 0 BEADLO CC[NH+](CC)CC[C@H](C)[NH2+]C1=CC=C[CH]1 ZINC001255951017 970582214 /nfs/dbraw/zinc/58/22/14/970582214.db2.gz LPTBJAILUZADET-LBPRGKRZSA-N 1 2 207.341 2.354 20 0 BEADLO CSc1nc(C[NH+]2CC=CC2)ccc1C#N ZINC000220027658 1166829212 /nfs/dbraw/zinc/82/92/12/1166829212.db2.gz UFMIHVRVCVWIRX-UHFFFAOYSA-N 1 2 231.324 2.047 20 0 BEADLO CC[C@H]1C[C@H]([N@H+](C)CC(F)F)CCO1 ZINC001170240067 970615990 /nfs/dbraw/zinc/61/59/90/970615990.db2.gz CQXPZBCHAUSCDX-BDAKNGLRSA-N 1 2 207.264 2.141 20 0 BEADLO CC[C@H]1C[C@H]([N@@H+](C)CC(F)F)CCO1 ZINC001170240067 970615996 /nfs/dbraw/zinc/61/59/96/970615996.db2.gz CQXPZBCHAUSCDX-BDAKNGLRSA-N 1 2 207.264 2.141 20 0 BEADLO CCOC(=O)C1([NH2+]CC=C(C)C)CCCC1 ZINC000381575471 1166946163 /nfs/dbraw/zinc/94/61/63/1166946163.db2.gz ZQWFCMHGZHMPRQ-UHFFFAOYSA-N 1 2 225.332 2.418 20 0 BEADLO Cc1c[nH+]c(Nc2cc(N)ccc2F)c(N)c1 ZINC001211821665 1166961203 /nfs/dbraw/zinc/96/12/03/1166961203.db2.gz HDHPUWPXSBFHPF-UHFFFAOYSA-N 1 2 232.262 2.437 20 0 BEADLO Cc1ccc(OC2C[NH+](C)C2)c2c1CCC2 ZINC001227231126 975319278 /nfs/dbraw/zinc/31/92/78/975319278.db2.gz BFKLTTOCXOELPB-UHFFFAOYSA-N 1 2 217.312 2.177 20 0 BEADLO Fc1cc(Cl)cc(C[NH2+]Cc2ncc[nH]2)c1 ZINC000168261800 1167149707 /nfs/dbraw/zinc/14/97/07/1167149707.db2.gz ZEWJARQUHPZHQA-UHFFFAOYSA-N 1 2 239.681 2.492 20 0 BEADLO COC(=O)CCCC[C@H](C)[N@H+](C)CC(F)F ZINC001173457828 975397342 /nfs/dbraw/zinc/39/73/42/975397342.db2.gz CHIVWXBDNOYATD-VIFPVBQESA-N 1 2 237.290 2.305 20 0 BEADLO COC(=O)CCCC[C@H](C)[N@@H+](C)CC(F)F ZINC001173457828 975397352 /nfs/dbraw/zinc/39/73/52/975397352.db2.gz CHIVWXBDNOYATD-VIFPVBQESA-N 1 2 237.290 2.305 20 0 BEADLO CC[C@@H](C)[C@@H](C)[N@H+](Cc1nnc[nH]1)C1CC1 ZINC001333583189 975865927 /nfs/dbraw/zinc/86/59/27/975865927.db2.gz QCYKTEYFRJCAIN-NXEZZACHSA-N 1 2 222.336 2.204 20 0 BEADLO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1nnc[nH]1)C1CC1 ZINC001333583189 975865934 /nfs/dbraw/zinc/86/59/34/975865934.db2.gz QCYKTEYFRJCAIN-NXEZZACHSA-N 1 2 222.336 2.204 20 0 BEADLO COc1cc[nH+]cc1-c1ccc(N)cc1 ZINC000309101635 1167251578 /nfs/dbraw/zinc/25/15/78/1167251578.db2.gz JODMXYNJRJWPQV-UHFFFAOYSA-N 1 2 200.241 2.339 20 0 BEADLO CCCC[C@H]1CCC[C@@H]1[NH2+]Cc1ncn[nH]1 ZINC000309451778 1167305843 /nfs/dbraw/zinc/30/58/43/1167305843.db2.gz LIRJNBITABMUJK-QWRGUYRKSA-N 1 2 222.336 2.253 20 0 BEADLO Cc1cccc(C[NH2+][C@@H](C)c2nncn2C)c1F ZINC000384402030 1167306486 /nfs/dbraw/zinc/30/64/86/1167306486.db2.gz CSWSSUAQDDCDGW-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO CCc1cc(N[C@@H](C)[C@H]2CCOC2)nc(CC)[nH+]1 ZINC001355242600 1167330794 /nfs/dbraw/zinc/33/07/94/1167330794.db2.gz DKIRRCOLNMGXSZ-QWRGUYRKSA-N 1 2 249.358 2.438 20 0 BEADLO CCCC(=O)N(C)C[C@@H]1CC[N@@H+]1C/C=C\Cl ZINC001230633904 977279022 /nfs/dbraw/zinc/27/90/22/977279022.db2.gz MJHLCQHLIGEXQX-IBHLPDHGSA-N 1 2 244.766 2.072 20 0 BEADLO CCCC(=O)N(C)C[C@@H]1CC[N@H+]1C/C=C\Cl ZINC001230633904 977279032 /nfs/dbraw/zinc/27/90/32/977279032.db2.gz MJHLCQHLIGEXQX-IBHLPDHGSA-N 1 2 244.766 2.072 20 0 BEADLO COc1cc(F)ccc1C[N@@H+]1CC[C@H](F)C1 ZINC001231600853 977650179 /nfs/dbraw/zinc/65/01/79/977650179.db2.gz YCBLJLMERTWADD-NSHDSACASA-N 1 2 227.254 2.378 20 0 BEADLO COc1cc(F)ccc1C[N@H+]1CC[C@H](F)C1 ZINC001231600853 977650185 /nfs/dbraw/zinc/65/01/85/977650185.db2.gz YCBLJLMERTWADD-NSHDSACASA-N 1 2 227.254 2.378 20 0 BEADLO COC[C@@]1(C)CCN(c2cc(F)cc(C)[nH+]2)C1 ZINC001336646433 977825583 /nfs/dbraw/zinc/82/55/83/977825583.db2.gz JEGUNCFHDZVAHO-ZDUSSCGKSA-N 1 2 238.306 2.392 20 0 BEADLO F[C@@H]1CSC2(C[NH+](Cc3ccns3)C2)C1 ZINC001232192529 977916481 /nfs/dbraw/zinc/91/64/81/977916481.db2.gz MVTHJOZLXQNYBA-QMMMGPOBSA-N 1 2 244.360 2.173 20 0 BEADLO Cc1scnc1C[N@@H+](C)[C@H]1CCCOC1 ZINC001232208031 977936577 /nfs/dbraw/zinc/93/65/77/977936577.db2.gz SNJJAKMODGGQIN-JTQLQIEISA-N 1 2 226.345 2.062 20 0 BEADLO Cc1scnc1C[N@H+](C)[C@H]1CCCOC1 ZINC001232208031 977936586 /nfs/dbraw/zinc/93/65/86/977936586.db2.gz SNJJAKMODGGQIN-JTQLQIEISA-N 1 2 226.345 2.062 20 0 BEADLO Cc1nnc(C[N@@H+](C)C2CC(C)C2)s1 ZINC001232242525 977971254 /nfs/dbraw/zinc/97/12/54/977971254.db2.gz MGVFGDWYAAUYJI-UHFFFAOYSA-N 1 2 211.334 2.077 20 0 BEADLO Cc1nnc(C[N@H+](C)C2CC(C)C2)s1 ZINC001232242525 977971263 /nfs/dbraw/zinc/97/12/63/977971263.db2.gz MGVFGDWYAAUYJI-UHFFFAOYSA-N 1 2 211.334 2.077 20 0 BEADLO Clc1csc(C[NH+]2CC3(COC3)C2)c1 ZINC001232277396 977986200 /nfs/dbraw/zinc/98/62/00/977986200.db2.gz XNRNHRAYKBMAJG-UHFFFAOYSA-N 1 2 229.732 2.234 20 0 BEADLO Cc1[nH]c(CN2CCCCC(F)(F)C2)c[nH+]1 ZINC001232459108 978076838 /nfs/dbraw/zinc/07/68/38/978076838.db2.gz ZQKJJIKOBMEWIB-UHFFFAOYSA-N 1 2 229.274 2.339 20 0 BEADLO Cc1[nH]cc(CN2CCCCC(F)(F)C2)[nH+]1 ZINC001232459108 978076846 /nfs/dbraw/zinc/07/68/46/978076846.db2.gz ZQKJJIKOBMEWIB-UHFFFAOYSA-N 1 2 229.274 2.339 20 0 BEADLO Cc1[nH]c(CN2CCC[C@H]2C(F)(F)F)c[nH+]1 ZINC001232460991 978093108 /nfs/dbraw/zinc/09/31/08/978093108.db2.gz XLYACJCWJQRZTC-VIFPVBQESA-N 1 2 233.237 2.245 20 0 BEADLO Cc1[nH]cc(CN2CCC[C@H]2C(F)(F)F)[nH+]1 ZINC001232460991 978093118 /nfs/dbraw/zinc/09/31/18/978093118.db2.gz XLYACJCWJQRZTC-VIFPVBQESA-N 1 2 233.237 2.245 20 0 BEADLO CC1(C)C[N@H+](Cc2cccc(CF)n2)CCO1 ZINC001232532766 978162367 /nfs/dbraw/zinc/16/23/67/978162367.db2.gz ADKAYTGCOQKCBU-UHFFFAOYSA-N 1 2 238.306 2.162 20 0 BEADLO CC1(C)C[N@@H+](Cc2cccc(CF)n2)CCO1 ZINC001232532766 978162378 /nfs/dbraw/zinc/16/23/78/978162378.db2.gz ADKAYTGCOQKCBU-UHFFFAOYSA-N 1 2 238.306 2.162 20 0 BEADLO FCc1cccc(C[NH+]2CC(C(F)F)C2)n1 ZINC001232541699 978169150 /nfs/dbraw/zinc/16/91/50/978169150.db2.gz ZBBFIFOXWAENLF-UHFFFAOYSA-N 1 2 230.233 2.248 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1cc(C)c(F)cc1F ZINC001232785052 978276029 /nfs/dbraw/zinc/27/60/29/978276029.db2.gz UAGQZQUMQQCAHR-LLVKDONJSA-N 1 2 241.281 2.494 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1cc(C)c(F)cc1F ZINC001232785052 978276038 /nfs/dbraw/zinc/27/60/38/978276038.db2.gz UAGQZQUMQQCAHR-LLVKDONJSA-N 1 2 241.281 2.494 20 0 BEADLO CCc1cccc(C[N@@H+]2CCOCC23CCC3)n1 ZINC001235261246 1167784767 /nfs/dbraw/zinc/78/47/67/1167784767.db2.gz QQEAKICREOXLAP-UHFFFAOYSA-N 1 2 246.354 2.399 20 0 BEADLO CCc1cccc(C[N@H+]2CCOCC23CCC3)n1 ZINC001235261246 1167784769 /nfs/dbraw/zinc/78/47/69/1167784769.db2.gz QQEAKICREOXLAP-UHFFFAOYSA-N 1 2 246.354 2.399 20 0 BEADLO Nc1cc(F)c(F)cc1C[NH+]1CCSCC1 ZINC001233378780 978593572 /nfs/dbraw/zinc/59/35/72/978593572.db2.gz GGSFRSGCHNLZMC-UHFFFAOYSA-N 1 2 244.310 2.096 20 0 BEADLO CC[NH+]1CC(Oc2ccc(OC(F)F)cc2)C1 ZINC001233648530 978659581 /nfs/dbraw/zinc/65/95/81/978659581.db2.gz GPNQWFLPRBIPFP-UHFFFAOYSA-N 1 2 243.253 2.371 20 0 BEADLO CCOC(=[NH2+])c1ccc(O[C@H](C)C(C)=O)cc1 ZINC001234587802 978865278 /nfs/dbraw/zinc/86/52/78/978865278.db2.gz DBRXISOYEFPSLD-SNVBAGLBSA-N 1 2 235.283 2.405 20 0 BEADLO Cc1noc(C)c1[C@H](C)[NH2+][C@@H]1CCn2ccnc21 ZINC000382312059 1168241885 /nfs/dbraw/zinc/24/18/85/1168241885.db2.gz SIXLYLZCCDHDDY-GZMMTYOYSA-N 1 2 246.314 2.284 20 0 BEADLO Cc1csc(NC(=O)[C@@H]2CC[N@H+]2C(C)C)c1 ZINC001182828622 979655249 /nfs/dbraw/zinc/65/52/49/979655249.db2.gz IMBCTECFVDLHJS-JTQLQIEISA-N 1 2 238.356 2.478 20 0 BEADLO Cc1csc(NC(=O)[C@@H]2CC[N@@H+]2C(C)C)c1 ZINC001182828622 979655256 /nfs/dbraw/zinc/65/52/56/979655256.db2.gz IMBCTECFVDLHJS-JTQLQIEISA-N 1 2 238.356 2.478 20 0 BEADLO COc1cc(C[NH+]2CC(C)C2)c(F)cc1F ZINC001236815795 979745287 /nfs/dbraw/zinc/74/52/87/979745287.db2.gz AHPXBBILJQEZBB-UHFFFAOYSA-N 1 2 227.254 2.425 20 0 BEADLO CCN(CCC[NH+](C)C)CC1OC=CC1=S ZINC001237186819 979838190 /nfs/dbraw/zinc/83/81/90/979838190.db2.gz SBPGZWFVRWSQDP-UHFFFAOYSA-N 1 2 242.388 2.342 20 0 BEADLO Cc1nc(C[N@H+]2C[C@@H](F)C[C@H]2C)ccc1F ZINC001237815855 980067717 /nfs/dbraw/zinc/06/77/17/980067717.db2.gz YMKQBQSMDAFZAU-SCZZXKLOSA-N 1 2 226.270 2.461 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@@H](F)C[C@H]2C)ccc1F ZINC001237815855 980067731 /nfs/dbraw/zinc/06/77/31/980067731.db2.gz YMKQBQSMDAFZAU-SCZZXKLOSA-N 1 2 226.270 2.461 20 0 BEADLO CC(C)[C@H](C)N(C(=O)C[C@H]([NH3+])C(F)F)C1CC1 ZINC001343528100 980142630 /nfs/dbraw/zinc/14/26/30/980142630.db2.gz WHOOMOHFZALHDQ-WPRPVWTQSA-N 1 2 248.317 2.004 20 0 BEADLO Cc1ccc(C[C@@H]2COC(C)(C)O2)c(C)[nH+]1 ZINC001250186095 980226700 /nfs/dbraw/zinc/22/67/00/980226700.db2.gz OUMBZKYYPKAZRM-GFCCVEGCSA-N 1 2 221.300 2.392 20 0 BEADLO Cc1cc2c[nH+]c(C=CC(C)(C)O)nc2[nH]1 ZINC001239139355 980459823 /nfs/dbraw/zinc/45/98/23/980459823.db2.gz IIHBCDIFQVVWOQ-SNAWJCMRSA-N 1 2 217.272 2.002 20 0 BEADLO CC[C@H](C)OC(=O)N(CC)CCn1cc[nH+]c1 ZINC001195111820 982095803 /nfs/dbraw/zinc/09/58/03/982095803.db2.gz KEUKQFJUSWTOSA-NSHDSACASA-N 1 2 239.319 2.140 20 0 BEADLO Cc1c[nH+]ccc1NC(=S)Nc1cccnc1 ZINC001199889017 1168832898 /nfs/dbraw/zinc/83/28/98/1168832898.db2.gz VQRFFJSGMZXIHM-UHFFFAOYSA-N 1 2 244.323 2.016 20 0 BEADLO Cc1c(N)cc[nH+]c1-c1ncccc1F ZINC001241527453 982694164 /nfs/dbraw/zinc/69/41/64/982694164.db2.gz JABSRHLHEIQRRN-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO C[N@@H+]1CCC=C(c2nc(F)c(F)cc2F)C1 ZINC001241569538 982817441 /nfs/dbraw/zinc/81/74/41/982817441.db2.gz FMBMBBCKXCVQDY-UHFFFAOYSA-N 1 2 228.217 2.218 20 0 BEADLO C[N@H+]1CCC=C(c2nc(F)c(F)cc2F)C1 ZINC001241569538 982817442 /nfs/dbraw/zinc/81/74/42/982817442.db2.gz FMBMBBCKXCVQDY-UHFFFAOYSA-N 1 2 228.217 2.218 20 0 BEADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cc[nH]n2)cn1 ZINC001137131046 1168930159 /nfs/dbraw/zinc/93/01/59/1168930159.db2.gz SNWGCGDDNJABEI-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cc[nH]n2)cn1 ZINC001137131046 1168930164 /nfs/dbraw/zinc/93/01/64/1168930164.db2.gz SNWGCGDDNJABEI-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Nc1ccc(Nc2cccc(Cl)n2)c[nH+]1 ZINC001201272389 983172983 /nfs/dbraw/zinc/17/29/83/983172983.db2.gz MNJUQUWWKKDNHU-UHFFFAOYSA-N 1 2 220.663 2.456 20 0 BEADLO c1c[nH+]c(-c2cccc(C3COC3)c2)[nH]1 ZINC001242018196 983219964 /nfs/dbraw/zinc/21/99/64/983219964.db2.gz GHLRIMLEVUKNMC-UHFFFAOYSA-N 1 2 200.241 2.191 20 0 BEADLO CC(C)c1ocnc1C[NH+]1CCSCC1 ZINC000092794230 1169004093 /nfs/dbraw/zinc/00/40/93/1169004093.db2.gz GOBVVWQRYUNPTM-UHFFFAOYSA-N 1 2 226.345 2.347 20 0 BEADLO CCOc1ccc[nH+]c1NCC1(CO)CCC1 ZINC000717670833 1169028487 /nfs/dbraw/zinc/02/84/87/1169028487.db2.gz RIUAMZYYAYEYBI-UHFFFAOYSA-N 1 2 236.315 2.055 20 0 BEADLO CC(C)CN1CC[C@@H]([NH+]2CCCC2)C(F)(F)C1 ZINC001201482092 983286501 /nfs/dbraw/zinc/28/65/01/983286501.db2.gz DKDFIODLEQIIJR-GFCCVEGCSA-N 1 2 246.345 2.448 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)C1=CCCC1 ZINC001355036756 983401110 /nfs/dbraw/zinc/40/11/10/983401110.db2.gz UDJHDWKSXHRPOW-UHFFFAOYSA-N 1 2 216.284 2.169 20 0 BEADLO CCc1nnc(C[NH2+][C@@H](C)c2ccc[nH]2)s1 ZINC001355275212 983455209 /nfs/dbraw/zinc/45/52/09/983455209.db2.gz SIPOLEHOHGAVGK-QMMMGPOBSA-N 1 2 236.344 2.279 20 0 BEADLO Cc1ccc(NC(=O)C2=CCC2)c(N(C)C)[nH+]1 ZINC000779995279 1169169925 /nfs/dbraw/zinc/16/99/25/1169169925.db2.gz MKJXWQKXVBUZPH-UHFFFAOYSA-N 1 2 231.299 2.115 20 0 BEADLO Cc1csc(C[N@@H+]2CCO[C@H]3C[C@H]32)c1 ZINC001137160343 984003459 /nfs/dbraw/zinc/00/34/59/984003459.db2.gz VUKCLCPBZIHTAL-MNOVXSKESA-N 1 2 209.314 2.030 20 0 BEADLO Cc1csc(C[N@H+]2CCO[C@H]3C[C@H]32)c1 ZINC001137160343 984003466 /nfs/dbraw/zinc/00/34/66/984003466.db2.gz VUKCLCPBZIHTAL-MNOVXSKESA-N 1 2 209.314 2.030 20 0 BEADLO CC[N@H+](C)Cc1cc(F)cnc1Cl ZINC001138888619 1169196747 /nfs/dbraw/zinc/19/67/47/1169196747.db2.gz LTMFQVUZHVMTON-UHFFFAOYSA-N 1 2 202.660 2.326 20 0 BEADLO CC[N@@H+](C)Cc1cc(F)cnc1Cl ZINC001138888619 1169196754 /nfs/dbraw/zinc/19/67/54/1169196754.db2.gz LTMFQVUZHVMTON-UHFFFAOYSA-N 1 2 202.660 2.326 20 0 BEADLO CC[C@@H]1CCCC[C@H]1NC(=O)Cc1[nH]c[nH+]c1C ZINC001464080626 1169255341 /nfs/dbraw/zinc/25/53/41/1169255341.db2.gz YFXGXMMTYAEKSX-VXGBXAGGSA-N 1 2 249.358 2.346 20 0 BEADLO CC[C@H]1CCCC[C@H]1NC(=O)Cc1[nH]c[nH+]c1C ZINC001464080444 1169256122 /nfs/dbraw/zinc/25/61/22/1169256122.db2.gz YFXGXMMTYAEKSX-NWDGAFQWSA-N 1 2 249.358 2.346 20 0 BEADLO CC[NH+]1CC(Oc2cnc(Cl)c(C)c2)C1 ZINC001225822731 974696688 /nfs/dbraw/zinc/69/66/88/974696688.db2.gz QBMSEBCOHUTQDX-UHFFFAOYSA-N 1 2 226.707 2.126 20 0 BEADLO CC(C)OCC[C@H](C)[N@H+](C)CC(F)F ZINC001172458219 974823481 /nfs/dbraw/zinc/82/34/81/974823481.db2.gz BTZVNPHDPCTPNS-VIFPVBQESA-N 1 2 209.280 2.387 20 0 BEADLO CC(C)OCC[C@H](C)[N@@H+](C)CC(F)F ZINC001172458219 974823487 /nfs/dbraw/zinc/82/34/87/974823487.db2.gz BTZVNPHDPCTPNS-VIFPVBQESA-N 1 2 209.280 2.387 20 0 BEADLO C[C@H](OCc1c[nH+]cn1C)c1ccccn1 ZINC001222595032 972590924 /nfs/dbraw/zinc/59/09/24/972590924.db2.gz MEGYFMYRTCTYBV-JTQLQIEISA-N 1 2 217.272 2.093 20 0 BEADLO Cc1cc(C[N@@H+]2CCC23COC3)c(C)s1 ZINC001138567861 1169360579 /nfs/dbraw/zinc/36/05/79/1169360579.db2.gz MALVLPVLJIRFEA-UHFFFAOYSA-N 1 2 223.341 2.340 20 0 BEADLO Cc1cc(C[N@H+]2CCC23COC3)c(C)s1 ZINC001138567861 1169360582 /nfs/dbraw/zinc/36/05/82/1169360582.db2.gz MALVLPVLJIRFEA-UHFFFAOYSA-N 1 2 223.341 2.340 20 0 BEADLO COc1ncc(C[NH+]2CC(C)(C)C2)cc1F ZINC001144451171 972828285 /nfs/dbraw/zinc/82/82/85/972828285.db2.gz OIDKIKVYGSSNOQ-UHFFFAOYSA-N 1 2 224.279 2.071 20 0 BEADLO Nc1cnc2cc(-c3ccc[nH+]c3N)ccc2c1 ZINC001243474526 970765982 /nfs/dbraw/zinc/76/59/82/970765982.db2.gz YPCHAXUJJGIXCO-UHFFFAOYSA-N 1 2 236.278 2.461 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H]3[C@@H](C2)C3(F)F)c(C)s1 ZINC001328619459 973178343 /nfs/dbraw/zinc/17/83/43/973178343.db2.gz JJAREVAKZNKKQF-DTORHVGOSA-N 1 2 244.310 2.457 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)c(C)s1 ZINC001328619459 973178355 /nfs/dbraw/zinc/17/83/55/973178355.db2.gz JJAREVAKZNKKQF-DTORHVGOSA-N 1 2 244.310 2.457 20 0 BEADLO Cc1cn2c(cccc2-c2cccnc2N)[nH+]1 ZINC001243474748 970767561 /nfs/dbraw/zinc/76/75/61/970767561.db2.gz QOWBSNYFAOHQEZ-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO Nc1[nH+]cccc1-c1cnc2scnc2c1 ZINC001243475341 970769189 /nfs/dbraw/zinc/76/91/89/970769189.db2.gz VSNNVVGBZIXRPV-UHFFFAOYSA-N 1 2 228.280 2.336 20 0 BEADLO Nc1[nH+]cccc1-c1cnc2[nH]cc(F)c2c1 ZINC001243475545 970772717 /nfs/dbraw/zinc/77/27/17/970772717.db2.gz KVJYJZOWKYBJBH-UHFFFAOYSA-N 1 2 228.230 2.346 20 0 BEADLO Nc1[nH+]cccc1-c1ccccc1C1OCCO1 ZINC001243475934 970777529 /nfs/dbraw/zinc/77/75/29/970777529.db2.gz MUAJKCQSWDVJAT-UHFFFAOYSA-N 1 2 242.278 2.376 20 0 BEADLO CC(C)CC1=NNC(=c2ccnc3c2=CC=[NH+]3)O1 ZINC001256457216 970848383 /nfs/dbraw/zinc/84/83/83/970848383.db2.gz JVKGOUDIMAZDQB-SNVBAGLBSA-N 1 2 242.282 2.288 20 0 BEADLO C[C@@H]1C[C@H]1C1=NNC(=c2ccnc3c2=CC=[NH+]3)O1 ZINC001256688987 970920137 /nfs/dbraw/zinc/92/01/37/970920137.db2.gz BWFUMCMSVWBRKV-FKTZTGRPSA-N 1 2 240.266 2.213 20 0 BEADLO Cc1cc(-c2ccnc(F)c2C)c[nH+]c1N ZINC001243778746 970921926 /nfs/dbraw/zinc/92/19/26/970921926.db2.gz RACOIELKUZYPCZ-UHFFFAOYSA-N 1 2 217.247 2.482 20 0 BEADLO O=C1CC[N@@H+]([C@H]2CCO[C@@H](c3ccccc3)C2)C1 ZINC001256817249 970990701 /nfs/dbraw/zinc/99/07/01/970990701.db2.gz LDSRAKHVQAWOBR-DZGCQCFKSA-N 1 2 245.322 2.182 20 0 BEADLO O=C1CC[N@H+]([C@H]2CCO[C@@H](c3ccccc3)C2)C1 ZINC001256817249 970990711 /nfs/dbraw/zinc/99/07/11/970990711.db2.gz LDSRAKHVQAWOBR-DZGCQCFKSA-N 1 2 245.322 2.182 20 0 BEADLO COc1ccc(N(C)c2[nH+]cccc2N)cc1N ZINC001216254286 971001477 /nfs/dbraw/zinc/00/14/77/971001477.db2.gz FWZVOOUASINZQM-UHFFFAOYSA-N 1 2 244.298 2.023 20 0 BEADLO CCC1CCC(N2CC[NH2+]CC(F)(F)C2)CC1 ZINC001256870521 971007413 /nfs/dbraw/zinc/00/74/13/971007413.db2.gz GRVKRLZTTXULCM-UHFFFAOYSA-N 1 2 246.345 2.496 20 0 BEADLO COc1cc[nH+]c(Nc2ccc(CO)cc2F)c1 ZINC001216270520 971010683 /nfs/dbraw/zinc/01/06/83/971010683.db2.gz RXWPAWHCLUOIKN-UHFFFAOYSA-N 1 2 248.257 2.465 20 0 BEADLO CC(C)OC(=O)C[N@@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC001329597477 973846329 /nfs/dbraw/zinc/84/63/29/973846329.db2.gz RHDNKTOZWIQPKK-LLVKDONJSA-N 1 2 247.285 2.059 20 0 BEADLO CC(C)OC(=O)C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC001329597477 973846335 /nfs/dbraw/zinc/84/63/35/973846335.db2.gz RHDNKTOZWIQPKK-LLVKDONJSA-N 1 2 247.285 2.059 20 0 BEADLO Cc1c(O)cccc1Nc1[nH+]cccc1N ZINC001216317081 971031811 /nfs/dbraw/zinc/03/18/11/971031811.db2.gz HEAXZWRIVFRQFB-UHFFFAOYSA-N 1 2 215.256 2.421 20 0 BEADLO C[NH+](C)Cc1nnc(CC2CCCCC2)o1 ZINC001256995937 971055003 /nfs/dbraw/zinc/05/50/03/971055003.db2.gz LNOBMCZNLRQJRN-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO Cc1c[nH+]c(NC2=CCCOC2)c(C)c1 ZINC001216505528 971104804 /nfs/dbraw/zinc/10/48/04/971104804.db2.gz FJSQCBANEOPEOK-UHFFFAOYSA-N 1 2 204.273 2.415 20 0 BEADLO COc1cc[nH+]cc1Nc1ccc(C(C)=O)nc1 ZINC001210269806 1169520637 /nfs/dbraw/zinc/52/06/37/1169520637.db2.gz ADUVWNZVSQXATJ-UHFFFAOYSA-N 1 2 243.266 2.431 20 0 BEADLO COCn1cc(Nc2[nH+]c(C)ccc2C)cn1 ZINC001216574960 971128577 /nfs/dbraw/zinc/12/85/77/971128577.db2.gz XAHVNDOUSOZQHE-UHFFFAOYSA-N 1 2 232.287 2.242 20 0 BEADLO CC(C)(C)OC[C@H]([NH3+])c1nnc(C2CCC2)o1 ZINC001217697436 971333265 /nfs/dbraw/zinc/33/32/65/971333265.db2.gz KSOPBRZWQPNCKK-VIFPVBQESA-N 1 2 239.319 2.152 20 0 BEADLO C[Si](C)(C)CCO[C@H]1C[NH2+]CC(F)(F)C1 ZINC001217855236 971446276 /nfs/dbraw/zinc/44/62/76/971446276.db2.gz LBPJMUWVSLRGKV-SECBINFHSA-N 1 2 237.366 2.338 20 0 BEADLO Fc1cccc(O[C@H]2CC[NH2+]CC2(F)F)c1 ZINC001218007566 971568656 /nfs/dbraw/zinc/56/86/56/971568656.db2.gz YZMCDYQGYWNWLG-JTQLQIEISA-N 1 2 231.217 2.202 20 0 BEADLO CCOC(=O)C1([NH2+][C@@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170721801 971645398 /nfs/dbraw/zinc/64/53/98/971645398.db2.gz ZEZQIZILCUEQLT-RTCCRHLQSA-N 1 2 237.343 2.106 20 0 BEADLO c1cn2cc(C3=CCCOC3)ccc2[nH+]1 ZINC001245157716 971709328 /nfs/dbraw/zinc/70/93/28/971709328.db2.gz HQSCCASEQMFPFG-UHFFFAOYSA-N 1 2 200.241 2.138 20 0 BEADLO CCC=CNc1cc[nH+]c(N2CCCC2)n1 ZINC001170766327 971760138 /nfs/dbraw/zinc/76/01/38/971760138.db2.gz GNEHOVDGBDGYOS-XVNBXDOJSA-N 1 2 218.304 2.412 20 0 BEADLO Cc1cc(S)ccc1O[C@H]1[C@@H]2CC[C@H]1[NH2+]C2 ZINC001218443991 971822333 /nfs/dbraw/zinc/82/23/33/971822333.db2.gz DYQBIMOLYHUMTC-XWIASGKRSA-N 1 2 235.352 2.413 20 0 BEADLO C[N@H+](Cc1ccc(Cl)c(F)c1)C1COC1 ZINC001137653535 971829113 /nfs/dbraw/zinc/82/91/13/971829113.db2.gz WRCGOHVCBSNFFG-UHFFFAOYSA-N 1 2 229.682 2.310 20 0 BEADLO C[N@@H+](Cc1ccc(Cl)c(F)c1)C1COC1 ZINC001137653535 971829120 /nfs/dbraw/zinc/82/91/20/971829120.db2.gz WRCGOHVCBSNFFG-UHFFFAOYSA-N 1 2 229.682 2.310 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@H](C)CCO[C@@H](C)CC ZINC001172319395 974526467 /nfs/dbraw/zinc/52/64/67/974526467.db2.gz QKPIVYCMXJBOFH-WOPDTQHZSA-N 1 2 245.363 2.121 20 0 BEADLO C[N@H+](CCF)Cc1cnc(-c2cccnc2)o1 ZINC001232134677 1169682524 /nfs/dbraw/zinc/68/25/24/1169682524.db2.gz HTANLDHMKWEKMN-UHFFFAOYSA-N 1 2 235.262 2.138 20 0 BEADLO C[N@@H+](CCF)Cc1cnc(-c2cccnc2)o1 ZINC001232134677 1169682527 /nfs/dbraw/zinc/68/25/27/1169682527.db2.gz HTANLDHMKWEKMN-UHFFFAOYSA-N 1 2 235.262 2.138 20 0 BEADLO C[C@@H]1COCC[C@H]1Nc1ccc2[nH+]cn(C)c2c1 ZINC001170819570 971909417 /nfs/dbraw/zinc/90/94/17/971909417.db2.gz OLXUECJHNSCPBS-ZYHUDNBSSA-N 1 2 245.326 2.410 20 0 BEADLO CCOc1ccccc1NC(=O)[C@@H]1CC[N@@H+]1CC ZINC001135999527 972022391 /nfs/dbraw/zinc/02/23/91/972022391.db2.gz PBYWVGIFHKAAMO-LBPRGKRZSA-N 1 2 248.326 2.118 20 0 BEADLO CCOc1ccccc1NC(=O)[C@@H]1CC[N@H+]1CC ZINC001135999527 972022400 /nfs/dbraw/zinc/02/24/00/972022400.db2.gz PBYWVGIFHKAAMO-LBPRGKRZSA-N 1 2 248.326 2.118 20 0 BEADLO c1n[nH]c(C[NH2+][C@H]2CCCC23CCCCC3)n1 ZINC000313123427 972054985 /nfs/dbraw/zinc/05/49/85/972054985.db2.gz SPTIBNNOIALKIQ-NSHDSACASA-N 1 2 234.347 2.397 20 0 BEADLO C/C(=C\C=C\[NH3+])NCC(F)(F)c1ccccn1 ZINC001170908276 972081251 /nfs/dbraw/zinc/08/12/51/972081251.db2.gz SPJRIOAXMFDNCX-HOZCHFDZSA-N 1 2 239.269 2.139 20 0 BEADLO C[C@H]1C[C@H](c2ccccc2)[N@H+](Cc2nnc[nH]2)C1 ZINC001329895281 972092762 /nfs/dbraw/zinc/09/27/62/972092762.db2.gz ORFNCQZWFDFLSI-WCQYABFASA-N 1 2 242.326 2.388 20 0 BEADLO C[C@H]1C[C@H](c2ccccc2)[N@@H+](Cc2nnc[nH]2)C1 ZINC001329895281 972092766 /nfs/dbraw/zinc/09/27/66/972092766.db2.gz ORFNCQZWFDFLSI-WCQYABFASA-N 1 2 242.326 2.388 20 0 BEADLO CCOC(=O)[C@H]1CCC[C@@H]1Nc1cccc[nH+]1 ZINC001170953522 972143241 /nfs/dbraw/zinc/14/32/41/972143241.db2.gz GJDXJFFBCJHXLB-QWRGUYRKSA-N 1 2 234.299 2.225 20 0 BEADLO CCCNC(=O)c1ccccc1-n1cc[nH+]c1 ZINC001220236246 972192637 /nfs/dbraw/zinc/19/26/37/972192637.db2.gz WAMGWGDKAKGHAR-UHFFFAOYSA-N 1 2 229.283 2.012 20 0 BEADLO O=C1CC[NH+]([C@@H]2CCc3cccc(F)c3C2)CC1 ZINC001170986661 972207486 /nfs/dbraw/zinc/20/74/86/972207486.db2.gz WLWGXSCBIQCPLI-GFCCVEGCSA-N 1 2 247.313 2.348 20 0 BEADLO Oc1cccc(C[NH2+]CCF)c1Br ZINC000315246673 972225339 /nfs/dbraw/zinc/22/53/39/972225339.db2.gz VHRKHGNTCRJGNJ-UHFFFAOYSA-N 1 2 248.095 2.214 20 0 BEADLO Cc1c(F)cc[nH+]c1N1C[C@@H]2[C@H]3CC[C@H](O3)[C@@H]2C1 ZINC001167076267 957113595 /nfs/dbraw/zinc/11/35/95/957113595.db2.gz ODBYWJPXDZTXDU-QZHINBJYSA-N 1 2 248.301 2.143 20 0 BEADLO C[N@H+](CC1=NOCC1)Cc1ccccc1F ZINC001167078299 957116988 /nfs/dbraw/zinc/11/69/88/957116988.db2.gz QDWGHRURZCEWHO-UHFFFAOYSA-N 1 2 222.263 2.034 20 0 BEADLO C[N@@H+](CC1=NOCC1)Cc1ccccc1F ZINC001167078299 957116999 /nfs/dbraw/zinc/11/69/99/957116999.db2.gz QDWGHRURZCEWHO-UHFFFAOYSA-N 1 2 222.263 2.034 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@]3(CCO3)C2)cs1 ZINC001206802396 957234517 /nfs/dbraw/zinc/23/45/17/957234517.db2.gz HGJNUERAHIWSBL-LBPRGKRZSA-N 1 2 238.356 2.206 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@]3(CCO3)C2)cs1 ZINC001206802396 957234526 /nfs/dbraw/zinc/23/45/26/957234526.db2.gz HGJNUERAHIWSBL-LBPRGKRZSA-N 1 2 238.356 2.206 20 0 BEADLO CC(=O)OC(C)(C)CCC[N@@H+](C)CC(F)F ZINC001209159928 957338784 /nfs/dbraw/zinc/33/87/84/957338784.db2.gz VCZYXRVQUZTGFL-UHFFFAOYSA-N 1 2 237.290 2.305 20 0 BEADLO CC(=O)OC(C)(C)CCC[N@H+](C)CC(F)F ZINC001209159928 957338796 /nfs/dbraw/zinc/33/87/96/957338796.db2.gz VCZYXRVQUZTGFL-UHFFFAOYSA-N 1 2 237.290 2.305 20 0 BEADLO C1=C(Nc2ccc(N3CCCC3)[nH+]c2)COC1 ZINC001203386972 957412073 /nfs/dbraw/zinc/41/20/73/957412073.db2.gz SLOBCGWEBSNRJN-UHFFFAOYSA-N 1 2 231.299 2.008 20 0 BEADLO c1cn(-c2ccc(Nc3ccnnc3)cc2)c[nH+]1 ZINC001209959300 957582239 /nfs/dbraw/zinc/58/22/39/957582239.db2.gz PBMMCIXDJUBTJJ-UHFFFAOYSA-N 1 2 237.266 2.406 20 0 BEADLO CC(C)C(OCC[NH+]1CCOCC1)C(C)C ZINC001210207938 957672569 /nfs/dbraw/zinc/67/25/69/957672569.db2.gz PZCDPLOEBDDEJP-UHFFFAOYSA-N 1 2 229.364 2.016 20 0 BEADLO Cc1ncnc(C)c1Nc1c[nH+]c(C)c(N)c1 ZINC001210286767 957714724 /nfs/dbraw/zinc/71/47/24/957714724.db2.gz BLCYBMNWQUNYQZ-UHFFFAOYSA-N 1 2 229.287 2.123 20 0 BEADLO CN(C)c1cc[nH+]c(-c2ccc(F)cn2)c1 ZINC001241805983 1169746222 /nfs/dbraw/zinc/74/62/22/1169746222.db2.gz WBAGWPQCLFRFKA-UHFFFAOYSA-N 1 2 217.247 2.349 20 0 BEADLO Cc1cc(NCc2cccnn2)[nH+]c2cc[nH]c21 ZINC001167330303 957779580 /nfs/dbraw/zinc/77/95/80/957779580.db2.gz BJSUZRVMUBXBMS-UHFFFAOYSA-N 1 2 239.282 2.273 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1cccc(F)c1C ZINC001204512000 957792773 /nfs/dbraw/zinc/79/27/73/957792773.db2.gz CXCMEFFYJBLRRT-SNVBAGLBSA-N 1 2 239.290 2.127 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1cccc(F)c1C ZINC001204512000 957792778 /nfs/dbraw/zinc/79/27/78/957792778.db2.gz CXCMEFFYJBLRRT-SNVBAGLBSA-N 1 2 239.290 2.127 20 0 BEADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2c[nH]cn2)cn1 ZINC001136871916 972293015 /nfs/dbraw/zinc/29/30/15/972293015.db2.gz SOHQQOWDOMWMJP-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2c[nH]cn2)cn1 ZINC001136871916 972293016 /nfs/dbraw/zinc/29/30/16/972293016.db2.gz SOHQQOWDOMWMJP-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO O=C1CC(Nc2ccc(C3CC3)c[nH+]2)C1 ZINC001167344386 957817651 /nfs/dbraw/zinc/81/76/51/957817651.db2.gz IRDJFFZAUHNCLU-UHFFFAOYSA-N 1 2 202.257 2.102 20 0 BEADLO CCCN(C)Cc1[nH+]cc2ccccn21 ZINC001207048177 957842277 /nfs/dbraw/zinc/84/22/77/957842277.db2.gz BXVNJWKDOVTMNY-UHFFFAOYSA-N 1 2 203.289 2.176 20 0 BEADLO CC[NH2+]Cc1noc([C@]23C[C@H]2CCCC3)n1 ZINC000693214424 957925034 /nfs/dbraw/zinc/92/50/34/957925034.db2.gz ZAYAQZPCTZUQQM-BXKDBHETSA-N 1 2 221.304 2.011 20 0 BEADLO COC(=O)C[N@H+](C)Cc1c[nH]c2cc(C)ccc12 ZINC001136975979 972308469 /nfs/dbraw/zinc/30/84/69/972308469.db2.gz VTQBTSDHPXKIFX-UHFFFAOYSA-N 1 2 246.310 2.081 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1c[nH]c2cc(C)ccc12 ZINC001136975979 972308475 /nfs/dbraw/zinc/30/84/75/972308475.db2.gz VTQBTSDHPXKIFX-UHFFFAOYSA-N 1 2 246.310 2.081 20 0 BEADLO CSc1cc(Nc2cncc(CO)c2)cc[nH+]1 ZINC001211101287 958030637 /nfs/dbraw/zinc/03/06/37/958030637.db2.gz WZMJCKLONUWHBB-UHFFFAOYSA-N 1 2 247.323 2.434 20 0 BEADLO COc1cccc(Nc2cccc3[nH+]ccn32)n1 ZINC001211296837 958143067 /nfs/dbraw/zinc/14/30/67/958143067.db2.gz WSOYWRGEJKGAOZ-UHFFFAOYSA-N 1 2 240.266 2.482 20 0 BEADLO COc1cccc(Nc2cccn3cc[nH+]c23)n1 ZINC001211297143 958143090 /nfs/dbraw/zinc/14/30/90/958143090.db2.gz IMRFLKUILFGSHR-UHFFFAOYSA-N 1 2 240.266 2.482 20 0 BEADLO COc1ncc(C[N@H+](C)Cc2ccno2)cc1C ZINC001137009537 972324155 /nfs/dbraw/zinc/32/41/55/972324155.db2.gz GZQCUFYGCVPIJN-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1ncc(C[N@@H+](C)Cc2ccno2)cc1C ZINC001137009537 972324159 /nfs/dbraw/zinc/32/41/59/972324159.db2.gz GZQCUFYGCVPIJN-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO C[C@H]1CC[N@@H+]1Cc1ncccc1Br ZINC000706777983 958197815 /nfs/dbraw/zinc/19/78/15/958197815.db2.gz UXYVEWYBEAOBLK-QMMMGPOBSA-N 1 2 241.132 2.438 20 0 BEADLO C[C@H]1CC[N@H+]1Cc1ncccc1Br ZINC000706777983 958197819 /nfs/dbraw/zinc/19/78/19/958197819.db2.gz UXYVEWYBEAOBLK-QMMMGPOBSA-N 1 2 241.132 2.438 20 0 BEADLO COc1ncc(Nc2c[nH+]cc(C)c2C)cn1 ZINC001213525465 958204229 /nfs/dbraw/zinc/20/42/29/958204229.db2.gz YCMAOUGLOVKTID-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO CCCOC1C[NH+](Cc2ccc3c(c2)COC3)C1 ZINC001137027097 972329973 /nfs/dbraw/zinc/32/99/73/972329973.db2.gz BFHIQRZOAYYREV-UHFFFAOYSA-N 1 2 247.338 2.328 20 0 BEADLO C[C@@H]1C[C@@H](N[C@H]2C[NH2+]CC2(F)F)CC(C)(C)C1 ZINC001246462164 972332523 /nfs/dbraw/zinc/33/25/23/972332523.db2.gz QXAQMHDSLXEQIX-MXWKQRLJSA-N 1 2 246.345 2.398 20 0 BEADLO COc1ccc(C[N@@H+]2CCCC[C@@H]2C(C)=O)cn1 ZINC001137037619 972336650 /nfs/dbraw/zinc/33/66/50/972336650.db2.gz MLJDHAGZEPBKIL-CYBMUJFWSA-N 1 2 248.326 2.034 20 0 BEADLO COc1ccc(C[N@H+]2CCCC[C@@H]2C(C)=O)cn1 ZINC001137037619 972336653 /nfs/dbraw/zinc/33/66/53/972336653.db2.gz MLJDHAGZEPBKIL-CYBMUJFWSA-N 1 2 248.326 2.034 20 0 BEADLO FC1(F)C[NH2+]C[C@H]1NC1CCCCCCC1 ZINC001246467790 972345512 /nfs/dbraw/zinc/34/55/12/972345512.db2.gz ZSOYHJANXBOMQE-LLVKDONJSA-N 1 2 232.318 2.296 20 0 BEADLO c1cn(CCOC2Cc3ccccc3C2)c[nH+]1 ZINC001222128619 972378453 /nfs/dbraw/zinc/37/84/53/972378453.db2.gz AEZSLTDASQCOJP-UHFFFAOYSA-N 1 2 228.295 2.067 20 0 BEADLO C[C@@H](COC(C)(C)C)OCCn1cc[nH+]c1 ZINC001222129311 972378928 /nfs/dbraw/zinc/37/89/28/972378928.db2.gz NFFLGLJQNALUCW-NSHDSACASA-N 1 2 226.320 2.103 20 0 BEADLO CC1(C)CC(=O)CC[C@H]1OCCn1cc[nH+]c1 ZINC001222134333 972382398 /nfs/dbraw/zinc/38/23/98/972382398.db2.gz CTACVWIRPIUSFC-GFCCVEGCSA-N 1 2 236.315 2.048 20 0 BEADLO CC(=O)[C@@H](OCCn1cc[nH+]c1)c1ccccc1 ZINC001222138948 972386598 /nfs/dbraw/zinc/38/65/98/972386598.db2.gz MLWMCMHINKONOX-CQSZACIVSA-N 1 2 244.294 2.230 20 0 BEADLO FC1(F)CC[C@@H](OCCn2cc[nH+]c2)C1 ZINC001222138779 972388496 /nfs/dbraw/zinc/38/84/96/972388496.db2.gz KFWUMUMGJJZSIT-SECBINFHSA-N 1 2 216.231 2.088 20 0 BEADLO C[C@@H](OCCn1cc[nH+]c1)c1cccnc1F ZINC001222138652 972389101 /nfs/dbraw/zinc/38/91/01/972389101.db2.gz JDJGZRQISBGLON-SNVBAGLBSA-N 1 2 235.262 2.195 20 0 BEADLO Nc1cc(CNc2cccc3c2CCN3)cc[nH+]1 ZINC001167616222 959075465 /nfs/dbraw/zinc/07/54/65/959075465.db2.gz AIPSMVODMHXYDM-UHFFFAOYSA-N 1 2 240.310 2.244 20 0 BEADLO Nc1cc(CNc2cnc3c(c2)CN=N3)cc[nH+]1 ZINC001167617922 959088093 /nfs/dbraw/zinc/08/80/93/959088093.db2.gz AGKZCSPUHZWXAO-UHFFFAOYSA-N 1 2 240.270 2.268 20 0 BEADLO C[C@H]1[C@@H](O)CCC[N@@H+]1C/C(Cl)=C/Cl ZINC000307327748 959183216 /nfs/dbraw/zinc/18/32/16/959183216.db2.gz JQCVFKDFEPSIIH-FUMWUMAXSA-N 1 2 224.131 2.151 20 0 BEADLO C[C@H]1[C@@H](O)CCC[N@H+]1C/C(Cl)=C/Cl ZINC000307327748 959183220 /nfs/dbraw/zinc/18/32/20/959183220.db2.gz JQCVFKDFEPSIIH-FUMWUMAXSA-N 1 2 224.131 2.151 20 0 BEADLO CC(C)[C@@H]1CCCCN1C(=O)C[C@H]([NH3+])C(F)F ZINC000724710706 959228682 /nfs/dbraw/zinc/22/86/82/959228682.db2.gz HDQNPYQJYNYFLF-UWVGGRQHSA-N 1 2 248.317 2.006 20 0 BEADLO O[C@H](C[N@@H+]1CCC=C(Cl)C1)CC(F)(F)F ZINC000404406072 959253996 /nfs/dbraw/zinc/25/39/96/959253996.db2.gz WVHYGTKWAITEKM-QMMMGPOBSA-N 1 2 243.656 2.128 20 0 BEADLO O[C@H](C[N@H+]1CCC=C(Cl)C1)CC(F)(F)F ZINC000404406072 959254006 /nfs/dbraw/zinc/25/40/06/959254006.db2.gz WVHYGTKWAITEKM-QMMMGPOBSA-N 1 2 243.656 2.128 20 0 BEADLO FCC[NH2+][C@@H]1COCc2cccc(Cl)c21 ZINC000308899639 959285462 /nfs/dbraw/zinc/28/54/62/959285462.db2.gz BKNDWGNCAAMXEA-SNVBAGLBSA-N 1 2 229.682 2.470 20 0 BEADLO Cc1cc(C)cc(NC(=O)C[C@@H]([NH3+])C(F)F)c1 ZINC000724762667 959302026 /nfs/dbraw/zinc/30/20/26/959302026.db2.gz SCEWLHQRCDSJMF-SNVBAGLBSA-N 1 2 242.269 2.224 20 0 BEADLO CC[C@@H](CSC)N(C)c1cc(NC)[nH+]cn1 ZINC000167843453 959423428 /nfs/dbraw/zinc/42/34/28/959423428.db2.gz RHNHPYCZEUMNNL-VIFPVBQESA-N 1 2 240.376 2.096 20 0 BEADLO CC[C@@H](CSC)N(C)c1cc(NC)nc[nH+]1 ZINC000167843453 959423435 /nfs/dbraw/zinc/42/34/35/959423435.db2.gz RHNHPYCZEUMNNL-VIFPVBQESA-N 1 2 240.376 2.096 20 0 BEADLO CCOc1ccc(F)c(F)c1C[NH+](C)C ZINC001143485677 960126786 /nfs/dbraw/zinc/12/67/86/960126786.db2.gz GPAMHJLOTLZIFO-UHFFFAOYSA-N 1 2 215.243 2.425 20 0 BEADLO Cn1c2ccccc2[nH+]c1NC=CC(C)(C)O ZINC001203209217 960290628 /nfs/dbraw/zinc/29/06/28/960290628.db2.gz GFFRLSKCHKFVGT-CMDGGOBGSA-N 1 2 231.299 2.270 20 0 BEADLO CCn1c(C)nn(C[N@@H+]2CCC[C@@H]2C)c1=S ZINC000173521225 960356083 /nfs/dbraw/zinc/35/60/83/960356083.db2.gz VBKKNBCNCAAXLJ-VIFPVBQESA-N 1 2 240.376 2.184 20 0 BEADLO CCn1c(C)nn(C[N@H+]2CCC[C@@H]2C)c1=S ZINC000173521225 960356091 /nfs/dbraw/zinc/35/60/91/960356091.db2.gz VBKKNBCNCAAXLJ-VIFPVBQESA-N 1 2 240.376 2.184 20 0 BEADLO CC(C)(CCO)Nc1ccc(-n2cccc2)c[nH+]1 ZINC001167739833 960367894 /nfs/dbraw/zinc/36/78/94/960367894.db2.gz WQQLVFRCMLSEQU-UHFFFAOYSA-N 1 2 245.326 2.445 20 0 BEADLO Cc1cc(NC(C)(C)CCO)[nH+]c2cc[nH]c21 ZINC001167740262 960381581 /nfs/dbraw/zinc/38/15/81/960381581.db2.gz JMQRKGFCHHLUGU-UHFFFAOYSA-N 1 2 233.315 2.444 20 0 BEADLO Cc1cc2cc(NC(C)(C)CCO)[nH+]cc2[nH]1 ZINC001167741427 960391170 /nfs/dbraw/zinc/39/11/70/960391170.db2.gz UIHSCWCHISRUAF-UHFFFAOYSA-N 1 2 233.315 2.444 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+]1C[C@@H]2C[C@H]1CO2 ZINC001140592785 960449887 /nfs/dbraw/zinc/44/98/87/960449887.db2.gz COQBXQAKIOPKTN-STQMWFEESA-N 1 2 221.275 2.107 20 0 BEADLO F[C@H]1C[N@H+](Cc2cc[nH]c2)CCC1(F)F ZINC001140704994 960515323 /nfs/dbraw/zinc/51/53/23/960515323.db2.gz SJQMTKZGOLMTNG-VIFPVBQESA-N 1 2 218.222 2.194 20 0 BEADLO F[C@H]1C[N@@H+](Cc2cc[nH]c2)CCC1(F)F ZINC001140704994 960515341 /nfs/dbraw/zinc/51/53/41/960515341.db2.gz SJQMTKZGOLMTNG-VIFPVBQESA-N 1 2 218.222 2.194 20 0 BEADLO CC(C)n1ccnc1C[NH2+]C(C)(C)CF ZINC001327240727 972513352 /nfs/dbraw/zinc/51/33/52/972513352.db2.gz QAWVURCUKNQTOH-UHFFFAOYSA-N 1 2 213.300 2.302 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2c[nH]c3ccncc23)C1 ZINC001140802553 960588529 /nfs/dbraw/zinc/58/85/29/960588529.db2.gz YSHSTIMSLXTANS-SNVBAGLBSA-N 1 2 219.263 2.107 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2c[nH]c3ccncc23)C1 ZINC001140802553 960588538 /nfs/dbraw/zinc/58/85/38/960588538.db2.gz YSHSTIMSLXTANS-SNVBAGLBSA-N 1 2 219.263 2.107 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@](C)(F)C2)[nH]n1 ZINC001203070139 960620865 /nfs/dbraw/zinc/62/08/65/960620865.db2.gz ILNONVSHFBBLTD-NSHDSACASA-N 1 2 211.284 2.042 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@](C)(F)C2)[nH]n1 ZINC001203070139 960620875 /nfs/dbraw/zinc/62/08/75/960620875.db2.gz ILNONVSHFBBLTD-NSHDSACASA-N 1 2 211.284 2.042 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@](C)(F)C2)[nH]n1 ZINC001203070138 960625880 /nfs/dbraw/zinc/62/58/80/960625880.db2.gz ILNONVSHFBBLTD-LLVKDONJSA-N 1 2 211.284 2.042 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@](C)(F)C2)[nH]n1 ZINC001203070138 960625893 /nfs/dbraw/zinc/62/58/93/960625893.db2.gz ILNONVSHFBBLTD-LLVKDONJSA-N 1 2 211.284 2.042 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@H](c3ccccn3)C2)n[nH]1 ZINC001203077089 960686878 /nfs/dbraw/zinc/68/68/78/960686878.db2.gz RLKKUMZWMFHGNE-LBPRGKRZSA-N 1 2 242.326 2.103 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@H](c3ccccn3)C2)n[nH]1 ZINC001203077089 960686890 /nfs/dbraw/zinc/68/68/90/960686890.db2.gz RLKKUMZWMFHGNE-LBPRGKRZSA-N 1 2 242.326 2.103 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cnco2)cn1 ZINC001140933131 960709134 /nfs/dbraw/zinc/70/91/34/960709134.db2.gz MDJKRVRWQVNNIX-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cnco2)cn1 ZINC001140933131 960709152 /nfs/dbraw/zinc/70/91/52/960709152.db2.gz MDJKRVRWQVNNIX-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO c1coc(C[N@H+](Cc2cnco2)C2CC2)c1 ZINC001140933936 960720710 /nfs/dbraw/zinc/72/07/10/960720710.db2.gz NJMKNCKNGLHLHZ-UHFFFAOYSA-N 1 2 218.256 2.432 20 0 BEADLO c1coc(C[N@@H+](Cc2cnco2)C2CC2)c1 ZINC001140933936 960720726 /nfs/dbraw/zinc/72/07/26/960720726.db2.gz NJMKNCKNGLHLHZ-UHFFFAOYSA-N 1 2 218.256 2.432 20 0 BEADLO C[C@@H]1C(=O)CC[N@H+](Cc2cnco2)C12CCCC2 ZINC001140935660 960730296 /nfs/dbraw/zinc/73/02/96/960730296.db2.gz WKMWMTRWQIHEHT-LLVKDONJSA-N 1 2 248.326 2.398 20 0 BEADLO C[C@@H]1C(=O)CC[N@@H+](Cc2cnco2)C12CCCC2 ZINC001140935660 960730310 /nfs/dbraw/zinc/73/03/10/960730310.db2.gz WKMWMTRWQIHEHT-LLVKDONJSA-N 1 2 248.326 2.398 20 0 BEADLO c1nc(C[NH+]2CCC(OC3CCC3)CC2)co1 ZINC001141126712 960871503 /nfs/dbraw/zinc/87/15/03/960871503.db2.gz RULHQMJZLAPRRG-UHFFFAOYSA-N 1 2 236.315 2.208 20 0 BEADLO Cc1ccnn1C1CC[NH+](Cc2cocn2)CC1 ZINC001141132920 960886022 /nfs/dbraw/zinc/88/60/22/960886022.db2.gz SPOYXIGWLRXYPR-UHFFFAOYSA-N 1 2 246.314 2.017 20 0 BEADLO [NH2+]=CNc1nc(-c2ccccn2)nc2c1CCC2 ZINC001167864770 961338810 /nfs/dbraw/zinc/33/88/10/961338810.db2.gz JOEAIYCLLZOKSQ-UHFFFAOYSA-N 1 2 239.282 2.046 20 0 BEADLO CN(c1ccc2c(c1)NCC2)c1[nH+]cccc1N ZINC001213146201 961740732 /nfs/dbraw/zinc/74/07/32/961740732.db2.gz PKXVKTKIQRECSP-UHFFFAOYSA-N 1 2 240.310 2.400 20 0 BEADLO FC1(F)CCN(Cc2ccc3[nH+]ccn3c2)C1 ZINC001143018478 961863027 /nfs/dbraw/zinc/86/30/27/961863027.db2.gz KUYDPINLCMRHLI-UHFFFAOYSA-N 1 2 237.253 2.175 20 0 BEADLO CCCCC[C@H](CC)C(=O)NC1C[NH+](CC)C1 ZINC001268483509 961866489 /nfs/dbraw/zinc/86/64/89/961866489.db2.gz NCVHKCSSBREEGW-LBPRGKRZSA-N 1 2 240.391 2.413 20 0 BEADLO CC[NH2+]Cc1noc([C@H](C)c2ccsc2)n1 ZINC000843144344 961877079 /nfs/dbraw/zinc/87/70/79/961877079.db2.gz AWOYZSGLKMBGTD-MRVPVSSYSA-N 1 2 237.328 2.392 20 0 BEADLO CCOC1C[NH+](Cc2cc(C)cc(OC)c2)C1 ZINC001143150133 961887060 /nfs/dbraw/zinc/88/70/60/961887060.db2.gz MISKPOLRPLBTQE-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO Cc1cc(N[C@@H]2CCC[C@H]2O)nc(C2CCC2)[nH+]1 ZINC000894148919 961969939 /nfs/dbraw/zinc/96/99/39/961969939.db2.gz RNTZXBMHYOUKEE-VXGBXAGGSA-N 1 2 247.342 2.378 20 0 BEADLO Cc1nn(C)cc1[C@@H](C)Oc1cc[nH+]cc1 ZINC001225290264 962042886 /nfs/dbraw/zinc/04/28/86/962042886.db2.gz WXWSDOUJTWUGHP-SNVBAGLBSA-N 1 2 217.272 2.264 20 0 BEADLO CC1(C)OC[C@H](CCOc2cc[nH+]cc2)O1 ZINC001225290610 962046556 /nfs/dbraw/zinc/04/65/56/962046556.db2.gz CSJWIOIJHOAASY-NSHDSACASA-N 1 2 223.272 2.002 20 0 BEADLO CCOC(=O)[C@H]1CCC[C@@H]1Oc1cc[nH+]cc1 ZINC001225290545 962047162 /nfs/dbraw/zinc/04/71/62/962047162.db2.gz AMSFVRRCRQXILM-RYUDHWBXSA-N 1 2 235.283 2.192 20 0 BEADLO CCOC(=O)[C@@H]1CCC[C@@H]1Oc1cc[nH+]cc1 ZINC001225290541 962047388 /nfs/dbraw/zinc/04/73/88/962047388.db2.gz AMSFVRRCRQXILM-NEPJUHHUSA-N 1 2 235.283 2.192 20 0 BEADLO c1ccc2c(c1)C[C@@H](COc1cc[nH+]cc1)O2 ZINC001225291412 962050953 /nfs/dbraw/zinc/05/09/53/962050953.db2.gz ULCODWUNILRTJB-ZDUSSCGKSA-N 1 2 227.263 2.464 20 0 BEADLO CC1CC(N(C)C(=O)c2cccc3[nH+]ccn32)C1 ZINC001154520468 962795350 /nfs/dbraw/zinc/79/53/50/962795350.db2.gz QZTVCZIMNSWWJF-UHFFFAOYSA-N 1 2 243.310 2.205 20 0 BEADLO CSc1cc[nH+]c(NCc2nccn2C)c1 ZINC001154617516 962812374 /nfs/dbraw/zinc/81/23/74/962812374.db2.gz QEIWVWNNUQCQAC-UHFFFAOYSA-N 1 2 234.328 2.149 20 0 BEADLO CC[C@H]1CCN(C(=O)C(C)(C)c2c[nH+]c[nH]2)[C@H]1C ZINC001154802040 962852546 /nfs/dbraw/zinc/85/25/46/962852546.db2.gz OCTGTJWUSVUGNG-QWRGUYRKSA-N 1 2 249.358 2.334 20 0 BEADLO Cc1oncc1CNc1nc(C)[nH+]c2c1CCC2 ZINC001154884445 962884607 /nfs/dbraw/zinc/88/46/07/962884607.db2.gz MJZMCGQXPDELKC-UHFFFAOYSA-N 1 2 244.298 2.182 20 0 BEADLO Cc1oncc1CNc1[nH+]ccc(F)c1C ZINC001154884968 962884905 /nfs/dbraw/zinc/88/49/05/962884905.db2.gz WTNRCAZKMSSDMD-UHFFFAOYSA-N 1 2 221.235 2.438 20 0 BEADLO C[C@H](c1nc(CC2=CCCC2)no1)[NH+](C)C ZINC000923746766 962964343 /nfs/dbraw/zinc/96/43/43/962964343.db2.gz CXWZCZCGBALAHP-SECBINFHSA-N 1 2 221.304 2.345 20 0 BEADLO CCOc1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001143565062 962980053 /nfs/dbraw/zinc/98/00/53/962980053.db2.gz RCAGUPRFNCQXQI-UHFFFAOYSA-N 1 2 215.243 2.425 20 0 BEADLO CSc1nc(NCc2cccn2C)cc(C)[nH+]1 ZINC001155210591 963021982 /nfs/dbraw/zinc/02/19/82/963021982.db2.gz KXPITQSKOPYMRG-UHFFFAOYSA-N 1 2 248.355 2.458 20 0 BEADLO COC1(C)C[NH+](Cc2cc(C)cc(F)c2)C1 ZINC001143580266 963149558 /nfs/dbraw/zinc/14/95/58/963149558.db2.gz BYPQBHVCMNCPMS-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cc(F)cc(C[N@H+]2CCOC[C@@H]2C)c1 ZINC001143580608 963163896 /nfs/dbraw/zinc/16/38/96/963163896.db2.gz PLOQUPFRMAQLFD-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cc(F)cc(C[N@@H+]2CCOC[C@@H]2C)c1 ZINC001143580608 963163907 /nfs/dbraw/zinc/16/39/07/963163907.db2.gz PLOQUPFRMAQLFD-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO COc1ccc(NCCCn2cc[nH+]c2)c(C)n1 ZINC001161684718 963201741 /nfs/dbraw/zinc/20/17/41/963201741.db2.gz KTYGVKRSTGFZTB-UHFFFAOYSA-N 1 2 246.314 2.097 20 0 BEADLO CC[C@H](C)Nc1cc[nH+]c(OCCOC)c1 ZINC001168003954 963245823 /nfs/dbraw/zinc/24/58/23/963245823.db2.gz SECXHIYZAYQIOL-JTQLQIEISA-N 1 2 224.304 2.317 20 0 BEADLO CC[NH+]1CC(Oc2nc(C)nc3ccccc32)C1 ZINC001226553059 963250169 /nfs/dbraw/zinc/25/01/69/963250169.db2.gz GCYBIJPYAILNBI-UHFFFAOYSA-N 1 2 243.310 2.021 20 0 BEADLO CCOc1ccc[nH+]c1NCCn1cccc1 ZINC001156302559 963305438 /nfs/dbraw/zinc/30/54/38/963305438.db2.gz BEILLBZHVOUIFF-UHFFFAOYSA-N 1 2 231.299 2.394 20 0 BEADLO COCc1cc[nH+]c(NCC(C)(C)OC)c1 ZINC001156439428 963345396 /nfs/dbraw/zinc/34/53/96/963345396.db2.gz ITKCSQTVVZYWGH-UHFFFAOYSA-N 1 2 224.304 2.065 20 0 BEADLO COCC(C)(C)Nc1[nH+]ccc(F)c1C ZINC001156456770 963358361 /nfs/dbraw/zinc/35/83/61/963358361.db2.gz BHOHOFZRCDAMLS-UHFFFAOYSA-N 1 2 212.268 2.366 20 0 BEADLO CCc1[nH]c(CNC(=O)C2CC(C)(C)C2)c[nH+]1 ZINC001156538579 963382147 /nfs/dbraw/zinc/38/21/47/963382147.db2.gz XCJHVHGSUCWQNA-UHFFFAOYSA-N 1 2 235.331 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)C2CC(C)(C)C2)[nH+]1 ZINC001156538579 963382156 /nfs/dbraw/zinc/38/21/56/963382156.db2.gz XCJHVHGSUCWQNA-UHFFFAOYSA-N 1 2 235.331 2.025 20 0 BEADLO Cc1cc(NCc2cc[nH+]c(N)c2)ncc1F ZINC001156755991 963453069 /nfs/dbraw/zinc/45/30/69/963453069.db2.gz MXMHCJALDOLIAP-UHFFFAOYSA-N 1 2 232.262 2.118 20 0 BEADLO CCOc1ccc(NCc2cc[nH+]c(N)c2)nc1 ZINC001156755997 963454821 /nfs/dbraw/zinc/45/48/21/963454821.db2.gz NBISSMWABFYVEB-UHFFFAOYSA-N 1 2 244.298 2.070 20 0 BEADLO CCCCN(C(=O)[C@H](C)n1cc[nH+]c1)C1CC1 ZINC000052513218 963471984 /nfs/dbraw/zinc/47/19/84/963471984.db2.gz MDUAZFOTHQBJHS-NSHDSACASA-N 1 2 235.331 2.235 20 0 BEADLO CCc1cc(N2Cc3ncsc3C2)nc(C)[nH+]1 ZINC001156833715 963473474 /nfs/dbraw/zinc/47/34/74/963473474.db2.gz VOFBQQSULIAHLF-UHFFFAOYSA-N 1 2 246.339 2.324 20 0 BEADLO CCc1nc(N2Cc3ncsc3C2)cc(C)[nH+]1 ZINC001156839976 963473538 /nfs/dbraw/zinc/47/35/38/963473538.db2.gz HQEZZXXUVWNZGZ-UHFFFAOYSA-N 1 2 246.339 2.324 20 0 BEADLO [NH2+]=CNc1ccc2nccc(Cl)c2n1 ZINC001157077634 963521756 /nfs/dbraw/zinc/52/17/56/963521756.db2.gz GXXDKLOJLQIQTI-UHFFFAOYSA-N 1 2 206.636 2.302 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@H]2CCCC[C@H]2C)[nH+]c1C ZINC000896910872 963522535 /nfs/dbraw/zinc/52/25/35/963522535.db2.gz ZUFIFXAYVGIWNV-SKDRFNHKSA-N 1 2 249.358 2.469 20 0 BEADLO [NH2+]=CNc1cc2c(Cl)ccnc2cn1 ZINC001157079345 963525954 /nfs/dbraw/zinc/52/59/54/963525954.db2.gz YNEQDWJLXPPYLC-UHFFFAOYSA-N 1 2 206.636 2.302 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)[C@H](C)C(C)C)[nH+]1 ZINC001157120283 963537549 /nfs/dbraw/zinc/53/75/49/963537549.db2.gz TZVMCYACDBDFEW-SNVBAGLBSA-N 1 2 237.347 2.441 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)[C@H](C)C(C)C)c[nH+]1 ZINC001157120283 963537558 /nfs/dbraw/zinc/53/75/58/963537558.db2.gz TZVMCYACDBDFEW-SNVBAGLBSA-N 1 2 237.347 2.441 20 0 BEADLO Cc1cc(N(C)CCO)[nH+]c2c(C)cccc12 ZINC001157387285 963590665 /nfs/dbraw/zinc/59/06/65/963590665.db2.gz ZKNXVTMGHXGDMS-UHFFFAOYSA-N 1 2 230.311 2.280 20 0 BEADLO C[C@H]1C[C@H]([NH2+]CC(F)(F)C(F)(F)F)CCO1 ZINC001168072663 963600950 /nfs/dbraw/zinc/60/09/50/963600950.db2.gz VXDKRICAZSCEND-NKWVEPMBSA-N 1 2 247.207 2.341 20 0 BEADLO CCN(CCn1cc[nH+]c1)c1nccc(C)c1F ZINC001157462376 963620950 /nfs/dbraw/zinc/62/09/50/963620950.db2.gz FXZDWRQAWWTLRP-UHFFFAOYSA-N 1 2 248.305 2.252 20 0 BEADLO CCCCC(C)(C)C(=O)N1CC2(CC[N@@H+]2C)C1 ZINC001271765720 963632338 /nfs/dbraw/zinc/63/23/38/963632338.db2.gz PEORZAAVENPXAS-UHFFFAOYSA-N 1 2 238.375 2.119 20 0 BEADLO CCCCC(C)(C)C(=O)N1CC2(CC[N@H+]2C)C1 ZINC001271765720 963632342 /nfs/dbraw/zinc/63/23/42/963632342.db2.gz PEORZAAVENPXAS-UHFFFAOYSA-N 1 2 238.375 2.119 20 0 BEADLO CSCc1ccc(NC2CSC2)[nH+]c1 ZINC001157579701 963668457 /nfs/dbraw/zinc/66/84/57/963668457.db2.gz RVSGOPCCGCCMPK-UHFFFAOYSA-N 1 2 226.370 2.472 20 0 BEADLO Cc1ncc(CNc2[nH+]ccc(F)c2C)cn1 ZINC001157603490 963675324 /nfs/dbraw/zinc/67/53/24/963675324.db2.gz XKKADYAJRFVLDV-UHFFFAOYSA-N 1 2 232.262 2.240 20 0 BEADLO CCOc1ccc[nH+]c1NC[C@H]1CC(C)(C)O1 ZINC001157663756 963694830 /nfs/dbraw/zinc/69/48/30/963694830.db2.gz LGBBMXNUWYORJB-SNVBAGLBSA-N 1 2 236.315 2.460 20 0 BEADLO COc1c[nH+]c(NC[C@@H]2CC(C)(C)O2)c(C)c1 ZINC001157662317 963695728 /nfs/dbraw/zinc/69/57/28/963695728.db2.gz DBIZRTXLGXAPPX-NSHDSACASA-N 1 2 236.315 2.378 20 0 BEADLO Cc1c(F)cc[nH+]c1NCCOc1cccnc1 ZINC001157814208 963737456 /nfs/dbraw/zinc/73/74/56/963737456.db2.gz SGFPDCFTDYWNDI-UHFFFAOYSA-N 1 2 247.273 2.415 20 0 BEADLO C[C@@H](Nc1ccc(Cl)c(N)[nH+]1)c1cnccn1 ZINC001158611953 963892334 /nfs/dbraw/zinc/89/23/34/963892334.db2.gz YXXQRJJHLALQFX-SSDOTTSWSA-N 1 2 249.705 2.280 20 0 BEADLO Cn1c[nH+]cc1CN1Cc2ccc(F)cc2C1 ZINC001204387429 963954535 /nfs/dbraw/zinc/95/45/35/963954535.db2.gz GULRRHXRTMBHJA-UHFFFAOYSA-N 1 2 231.274 2.075 20 0 BEADLO Cc1c(F)cc[nH+]c1NC[C@@H]1COC(C)(C)O1 ZINC001158924185 963956563 /nfs/dbraw/zinc/95/65/63/963956563.db2.gz PWNHMTYUSRDFFZ-SECBINFHSA-N 1 2 240.278 2.093 20 0 BEADLO CC(=O)Nc1c(C)cc[nH+]c1N(C)CC(F)F ZINC001158934765 963957777 /nfs/dbraw/zinc/95/77/77/963957777.db2.gz SSRNTUGVQGWVKV-UHFFFAOYSA-N 1 2 243.257 2.050 20 0 BEADLO Cc1c(F)cc[nH+]c1N(C)CC(F)F ZINC001158926972 963960044 /nfs/dbraw/zinc/96/00/44/963960044.db2.gz RXZQYXJCEOGFIN-UHFFFAOYSA-N 1 2 204.195 2.230 20 0 BEADLO CSCC[C@@H](Nc1cccc[nH+]1)C(C)(C)O ZINC001168212477 963992740 /nfs/dbraw/zinc/99/27/40/963992740.db2.gz RIGDRSCTBQJYGZ-SNVBAGLBSA-N 1 2 240.372 2.386 20 0 BEADLO Cc1nc2c(ccn2C)c(NC[C@H]2C[C@H](F)C2)[nH+]1 ZINC001168234389 964024743 /nfs/dbraw/zinc/02/47/43/964024743.db2.gz WUJMHBBYBIAORW-MGCOHNPYSA-N 1 2 248.305 2.437 20 0 BEADLO CC(C)CCOC(=O)NCCCn1cc[nH+]c1 ZINC000586476702 964310177 /nfs/dbraw/zinc/31/01/77/964310177.db2.gz QXLNDEAUHKTRSP-UHFFFAOYSA-N 1 2 239.319 2.046 20 0 BEADLO CCc1ccc(C[N@H+]2C[C@@H](OC)[C@@H](F)C2)o1 ZINC001204389464 964339178 /nfs/dbraw/zinc/33/91/78/964339178.db2.gz PGKMRWDFUMHLCG-NWDGAFQWSA-N 1 2 227.279 2.011 20 0 BEADLO CCc1ccc(C[N@@H+]2C[C@@H](OC)[C@@H](F)C2)o1 ZINC001204389464 964339188 /nfs/dbraw/zinc/33/91/88/964339188.db2.gz PGKMRWDFUMHLCG-NWDGAFQWSA-N 1 2 227.279 2.011 20 0 BEADLO CCC(F)(F)C[NH2+]C[C@@H](O)c1ccccc1 ZINC000697628737 964361052 /nfs/dbraw/zinc/36/10/52/964361052.db2.gz DXYZBXZKUIVPTK-LLVKDONJSA-N 1 2 229.270 2.355 20 0 BEADLO Cc1nn(C)cc1Nc1cccc2[nH+]c[nH]c21 ZINC001213025983 964403854 /nfs/dbraw/zinc/40/38/54/964403854.db2.gz CPZSFVBYSYHBKZ-UHFFFAOYSA-N 1 2 227.271 2.348 20 0 BEADLO O=c1cc(Nc2cccc3[nH+]c[nH]c32)cc[nH]1 ZINC001213027248 964436794 /nfs/dbraw/zinc/43/67/94/964436794.db2.gz QFLGPPBEFKEQSZ-UHFFFAOYSA-N 1 2 226.239 2.407 20 0 BEADLO CC[C@H](COC)Nc1nc(C)[nH+]c2c1CCC2 ZINC001160936869 964449807 /nfs/dbraw/zinc/44/98/07/964449807.db2.gz AOTIGSQFJLYKNS-SNVBAGLBSA-N 1 2 235.331 2.111 20 0 BEADLO CCC1(CNc2ccc3[nH+]cn(C)c3c2)COC1 ZINC001168327071 964455672 /nfs/dbraw/zinc/45/56/72/964455672.db2.gz HXLBTCDJWJJFLS-UHFFFAOYSA-N 1 2 245.326 2.412 20 0 BEADLO Cc1cc2cc(NC[C@H]3C[C@@](C)(O)C3)[nH+]cc2[nH]1 ZINC001168340135 964475320 /nfs/dbraw/zinc/47/53/20/964475320.db2.gz KVWVPPZALVFOBI-WJONMLJTSA-N 1 2 245.326 2.444 20 0 BEADLO C[C@@]1(O)C[C@H](CNc2c[nH+]c3c(c2)CCC3)C1 ZINC001168345406 964485300 /nfs/dbraw/zinc/48/53/00/964485300.db2.gz FEXAECLPNPUDQJ-WJONMLJTSA-N 1 2 232.327 2.143 20 0 BEADLO OCc1cncc(Nc2cccc3[nH+]c[nH]c32)c1 ZINC001213029448 964499266 /nfs/dbraw/zinc/49/92/66/964499266.db2.gz MDDPNFBRWUYWHX-UHFFFAOYSA-N 1 2 240.266 2.194 20 0 BEADLO Cc1cncc(NCc2c[nH+]cn2C(C)C)n1 ZINC001161563311 964643310 /nfs/dbraw/zinc/64/33/10/964643310.db2.gz YRQXIKZQPDPVFM-UHFFFAOYSA-N 1 2 231.303 2.175 20 0 BEADLO CCc1nccc(NCc2c[nH+]cn2C(C)C)n1 ZINC001161565008 964643522 /nfs/dbraw/zinc/64/35/22/964643522.db2.gz ITVYKEUQLCAMQQ-UHFFFAOYSA-N 1 2 245.330 2.429 20 0 BEADLO Cc1ncnc(NCc2c[nH+]cn2C(C)C)c1C ZINC001161565685 964644999 /nfs/dbraw/zinc/64/49/99/964644999.db2.gz PWHBUFDVOZJUJE-UHFFFAOYSA-N 1 2 245.330 2.483 20 0 BEADLO COc1c[nH+]c(N[C@@H]2CCO[C@H](C)C2)c(C)c1 ZINC001161690617 964688062 /nfs/dbraw/zinc/68/80/62/964688062.db2.gz JEUIMAAPDBQDAQ-GHMZBOCLSA-N 1 2 236.315 2.378 20 0 BEADLO CCC[C@H](C)Nc1ccc(Cn2cncn2)c[nH+]1 ZINC001161719854 964710106 /nfs/dbraw/zinc/71/01/06/964710106.db2.gz WZUIPQQRLMBTOV-NSHDSACASA-N 1 2 245.330 2.322 20 0 BEADLO COc1c[nH+]c(NCCOC(C)C)c2[nH]ccc21 ZINC001161788340 964756331 /nfs/dbraw/zinc/75/63/31/964756331.db2.gz SJRDXGQIMFHSRB-UHFFFAOYSA-N 1 2 249.314 2.408 20 0 BEADLO Cc1cc2cc(NCc3nccn3C)[nH+]cc2[nH]1 ZINC001161910486 964814718 /nfs/dbraw/zinc/81/47/18/964814718.db2.gz XTXSVQANWAWJFA-UHFFFAOYSA-N 1 2 241.298 2.217 20 0 BEADLO Cc1cc(NCC2COC2)ccc1[NH+](C)C ZINC001161951596 964836464 /nfs/dbraw/zinc/83/64/64/964836464.db2.gz XNOAXVBAEZBJJF-UHFFFAOYSA-N 1 2 220.316 2.119 20 0 BEADLO Cc1cc([NH2+]CC2COC2)ccc1N(C)C ZINC001161951596 964836468 /nfs/dbraw/zinc/83/64/68/964836468.db2.gz XNOAXVBAEZBJJF-UHFFFAOYSA-N 1 2 220.316 2.119 20 0 BEADLO Nc1ccc(NCc2nc3ccccc3o2)c[nH+]1 ZINC001161969381 964838781 /nfs/dbraw/zinc/83/87/81/964838781.db2.gz VFVYVEDOVXLOQZ-UHFFFAOYSA-N 1 2 240.266 2.417 20 0 BEADLO Cc1cnc(CCNc2c[nH+]c(C)c(C)c2)nc1 ZINC001162246262 964891032 /nfs/dbraw/zinc/89/10/32/964891032.db2.gz QFILOMJTUGNFID-UHFFFAOYSA-N 1 2 242.326 2.451 20 0 BEADLO Cc1cc([NH2+]CCN2CCCCO2)ccc1N ZINC001162422622 964973112 /nfs/dbraw/zinc/97/31/12/964973112.db2.gz PYGQUNKAAWVKDM-UHFFFAOYSA-N 1 2 235.331 2.017 20 0 BEADLO CC(C)([NH2+]c1c[nH]c2cc(=O)[nH]c-2c1)C1CC1 ZINC001162517805 965013895 /nfs/dbraw/zinc/01/38/95/965013895.db2.gz JECZDXVDPHXALB-UHFFFAOYSA-N 1 2 231.299 2.177 20 0 BEADLO Cc1c(F)cc[nH+]c1NC[C@H](O)c1ccncc1 ZINC001162547015 965037022 /nfs/dbraw/zinc/03/70/22/965037022.db2.gz HHTDBNZZSYYCLY-LBPRGKRZSA-N 1 2 247.273 2.070 20 0 BEADLO CC(C)(C)C(=[NH2+])Nc1nnc(Cl)cc1N ZINC001162657190 965093092 /nfs/dbraw/zinc/09/30/92/965093092.db2.gz IODQNVUGXIRENR-UHFFFAOYSA-N 1 2 227.699 2.147 20 0 BEADLO CC(C)(C)C(=[NH2+])Nc1cncc2nc[nH]c21 ZINC001162664951 965102736 /nfs/dbraw/zinc/10/27/36/965102736.db2.gz YJLCZIDPSXBRMU-UHFFFAOYSA-N 1 2 217.276 2.393 20 0 BEADLO Cc1ccc2c(c1)[C@@H](Nc1cc(N)nc[nH+]1)CC2 ZINC001162824251 965194502 /nfs/dbraw/zinc/19/45/02/965194502.db2.gz QQBYJOPCOMQRAP-LBPRGKRZSA-N 1 2 240.310 2.467 20 0 BEADLO COC1CC(CNc2ccc(Cl)c(N)[nH+]2)C1 ZINC001162998221 965223387 /nfs/dbraw/zinc/22/33/87/965223387.db2.gz ZTVQPOLAWIDGPS-UHFFFAOYSA-N 1 2 241.722 2.154 20 0 BEADLO Cc1[nH]c(CN(C)CC(=O)c2ccccc2)c[nH+]1 ZINC001232464745 965358195 /nfs/dbraw/zinc/35/81/95/965358195.db2.gz KLTJZXLPSPMVJV-UHFFFAOYSA-N 1 2 243.310 2.033 20 0 BEADLO Cc1[nH]cc(CN(C)CC(=O)c2ccccc2)[nH+]1 ZINC001232464745 965358203 /nfs/dbraw/zinc/35/82/03/965358203.db2.gz KLTJZXLPSPMVJV-UHFFFAOYSA-N 1 2 243.310 2.033 20 0 BEADLO COC(=O)c1c(C)cc(C)[nH+]c1N(C)C(C)C ZINC001163621788 965483841 /nfs/dbraw/zinc/48/38/41/965483841.db2.gz MAUXNKHTXHBYKL-UHFFFAOYSA-N 1 2 236.315 2.330 20 0 BEADLO CC1(C)CN(c2cc(N3CCCCC3)[nH+]cn2)C1 ZINC001163727063 965540929 /nfs/dbraw/zinc/54/09/29/965540929.db2.gz IFUCSMYQRGTJCH-UHFFFAOYSA-N 1 2 246.358 2.313 20 0 BEADLO CC1(C)CN(c2cc(N3CCCCC3)nc[nH+]2)C1 ZINC001163727063 965540930 /nfs/dbraw/zinc/54/09/30/965540930.db2.gz IFUCSMYQRGTJCH-UHFFFAOYSA-N 1 2 246.358 2.313 20 0 BEADLO OC1CC2(C1)CN(c1[nH+]ccc3ccccc31)C2 ZINC001163735125 965551419 /nfs/dbraw/zinc/55/14/19/965551419.db2.gz ICTYYAYGZQEBBW-UHFFFAOYSA-N 1 2 240.306 2.196 20 0 BEADLO CCSc1cc[nH+]c(N2CC(COC)C2)c1 ZINC001163734575 965553651 /nfs/dbraw/zinc/55/36/51/965553651.db2.gz MIEUJVIDMVWGIY-UHFFFAOYSA-N 1 2 238.356 2.276 20 0 BEADLO C[C@H]([NH2+]Cc1ccc[nH]c1=O)c1cscn1 ZINC000714978996 965573006 /nfs/dbraw/zinc/57/30/06/965573006.db2.gz ZNTYUHRJUMMLHO-QMMMGPOBSA-N 1 2 235.312 2.095 20 0 BEADLO Nc1ccc[nH+]c1N1CCC(=O)[C@@H]2CCCC[C@@H]21 ZINC001163790575 965589774 /nfs/dbraw/zinc/58/97/74/965589774.db2.gz NLDTXJWCZDJUSW-PWSUYJOCSA-N 1 2 245.326 2.002 20 0 BEADLO CSc1cc[nH+]c(N2CCCO[C@@H](C)C2)c1 ZINC001163963209 965666493 /nfs/dbraw/zinc/66/64/93/965666493.db2.gz YNTBIYORGKTOQW-JTQLQIEISA-N 1 2 238.356 2.419 20 0 BEADLO CC[NH+]1CC(Oc2ccc(OC)c(Cl)c2)C1 ZINC001234218347 965715671 /nfs/dbraw/zinc/71/56/71/965715671.db2.gz UHCIGPKPUTXZQQ-UHFFFAOYSA-N 1 2 241.718 2.432 20 0 BEADLO CCOc1ccc(F)cc1OC1C[NH+](CC)C1 ZINC001234226827 965723456 /nfs/dbraw/zinc/72/34/56/965723456.db2.gz CSLXHFOEEGKZMS-UHFFFAOYSA-N 1 2 239.290 2.307 20 0 BEADLO Cc1nonc1CNc1c(C)cc[nH+]c1C ZINC001164061888 965723836 /nfs/dbraw/zinc/72/38/36/965723836.db2.gz TVSXYXSPCCRYSX-UHFFFAOYSA-N 1 2 218.260 2.002 20 0 BEADLO CSc1cc[nH+]c(N2C[C@H](O)CC[C@H]2C)c1 ZINC001164123754 965747103 /nfs/dbraw/zinc/74/71/03/965747103.db2.gz GWHQCVCQVVVSCC-NXEZZACHSA-N 1 2 238.356 2.153 20 0 BEADLO Cc1c(F)cc[nH+]c1N1CCC[C@H](O)[C@@H](C)C1 ZINC001164217036 965799725 /nfs/dbraw/zinc/79/97/25/965799725.db2.gz AFNVKTUDYRRQIM-CABZTGNLSA-N 1 2 238.306 2.126 20 0 BEADLO OCC1(CNc2c[nH+]c3c(c2)CCC3)CCC1 ZINC001164363682 965858616 /nfs/dbraw/zinc/85/86/16/965858616.db2.gz GESSAVPTKJRFLG-UHFFFAOYSA-N 1 2 232.327 2.145 20 0 BEADLO CCc1cccc(OC2C[NH+](CC)C2)c1OC ZINC001234645520 965867088 /nfs/dbraw/zinc/86/70/88/965867088.db2.gz OZBOKMZIPKDNMP-UHFFFAOYSA-N 1 2 235.327 2.341 20 0 BEADLO CSc1cc[nH+]c(N2CC(C)(F)C2)c1 ZINC001164588940 965929908 /nfs/dbraw/zinc/92/99/08/965929908.db2.gz CVJGOFWERWIFKB-UHFFFAOYSA-N 1 2 212.293 2.352 20 0 BEADLO c1cc2c([nH+]c1NC[C@@H]1CCCCO1)CCOC2 ZINC001164689952 965947557 /nfs/dbraw/zinc/94/75/57/965947557.db2.gz VLQJOFUFUUTMNU-LBPRGKRZSA-N 1 2 248.326 2.135 20 0 BEADLO Cc1c(F)cc[nH+]c1N(C)[C@H]1CC[C@H](O)CC1 ZINC001165226262 965988058 /nfs/dbraw/zinc/98/80/58/965988058.db2.gz ZHJMIQMYMVQBDW-XYPYZODXSA-N 1 2 238.306 2.269 20 0 BEADLO Cc1cc(N2CC[C@](C)(O)C2)nc(C(C)(C)C)[nH+]1 ZINC001165232387 965997698 /nfs/dbraw/zinc/99/76/98/965997698.db2.gz ZFPIIJBSPDBSIU-AWEZNQCLSA-N 1 2 249.358 2.044 20 0 BEADLO COc1cc(C)c[nH+]c1N1CC[C@@]2(CCOC2)C1 ZINC001165254258 966009871 /nfs/dbraw/zinc/00/98/71/966009871.db2.gz NWFAKTZQZJZKDJ-CQSZACIVSA-N 1 2 248.326 2.015 20 0 BEADLO CNc1ccc(Nc2cnccc2F)c[nH+]1 ZINC001203452497 966043586 /nfs/dbraw/zinc/04/35/86/966043586.db2.gz NSUOLCSRNSSKAQ-UHFFFAOYSA-N 1 2 218.235 2.401 20 0 BEADLO Cc1c(F)cc[nH+]c1N1CC2(C1)CCCOC2 ZINC001165306648 966044890 /nfs/dbraw/zinc/04/48/90/966044890.db2.gz SBNOIGYHTPDACC-UHFFFAOYSA-N 1 2 236.290 2.146 20 0 BEADLO Nc1cc(Cl)[nH+]c(N2C[C@@H]3C[C@@H]3[C@H](F)C2)c1 ZINC001165365074 966063155 /nfs/dbraw/zinc/06/31/55/966063155.db2.gz JGFZDZVZBKTLDE-CNUIFLNQSA-N 1 2 241.697 2.111 20 0 BEADLO C[C@@H]1C[NH2+][C@@H](C)CN1Cc1ccc(S)cc1 ZINC001235449553 966063647 /nfs/dbraw/zinc/06/36/47/966063647.db2.gz AOFHADDGQNLZIT-WDEREUQCSA-N 1 2 236.384 2.158 20 0 BEADLO Cc1ncn(C)c1C[N@H+](Cc1ccco1)C1CC1 ZINC001235546612 966082347 /nfs/dbraw/zinc/08/23/47/966082347.db2.gz DQXNMLLRGUOXDW-UHFFFAOYSA-N 1 2 245.326 2.486 20 0 BEADLO Cc1ncn(C)c1C[N@@H+](Cc1ccco1)C1CC1 ZINC001235546612 966082364 /nfs/dbraw/zinc/08/23/64/966082364.db2.gz DQXNMLLRGUOXDW-UHFFFAOYSA-N 1 2 245.326 2.486 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2C[C@H]2C(C)(C)C)n1 ZINC000699781984 966084275 /nfs/dbraw/zinc/08/42/75/966084275.db2.gz HPVRPXPWJABGPY-RKDXNWHRSA-N 1 2 223.320 2.329 20 0 BEADLO C[C@@H](CCO)Nc1ccc(-n2cccc2)c[nH+]1 ZINC001165893295 966192445 /nfs/dbraw/zinc/19/24/45/966192445.db2.gz HYTYDSIITFNXKH-NSHDSACASA-N 1 2 231.299 2.055 20 0 BEADLO Nc1ccc(-c2ccc3c(c2)C(=O)OC3)c[nH+]1 ZINC001236313581 966362705 /nfs/dbraw/zinc/36/27/05/966362705.db2.gz VOTXHNBJNRAZKK-UHFFFAOYSA-N 1 2 226.235 2.001 20 0 BEADLO CCc1cn(Cc2cnc3ccccc3n2)c[nH+]1 ZINC001166822572 966426993 /nfs/dbraw/zinc/42/69/93/966426993.db2.gz MRLYSZLEOBHJTD-UHFFFAOYSA-N 1 2 238.294 2.437 20 0 BEADLO c1ccc2c(c1)cc[nH+]c2N1CC2(CCO2)C1 ZINC001166939789 966458707 /nfs/dbraw/zinc/45/87/07/966458707.db2.gz NGHVCYJPGLZFPM-UHFFFAOYSA-N 1 2 226.279 2.214 20 0 BEADLO Cc1cc(-c2cncc(O)c2)c2[nH+]ccn2c1 ZINC001236580530 966460886 /nfs/dbraw/zinc/46/08/86/966460886.db2.gz MSNYOPJZQGOQRC-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCCC(=O)[C@@H](C)C2)o1 ZINC001236590329 966472966 /nfs/dbraw/zinc/47/29/66/966472966.db2.gz ZZRXNCQGZVNPEW-VIFPVBQESA-N 1 2 236.315 2.092 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCCC(=O)[C@@H](C)C2)o1 ZINC001236590329 966472977 /nfs/dbraw/zinc/47/29/77/966472977.db2.gz ZZRXNCQGZVNPEW-VIFPVBQESA-N 1 2 236.315 2.092 20 0 BEADLO CN(c1ccc(F)c(N)c1)c1[nH+]cccc1N ZINC001212328028 966488746 /nfs/dbraw/zinc/48/87/46/966488746.db2.gz HUVRRYKZRVASEF-UHFFFAOYSA-N 1 2 232.262 2.153 20 0 BEADLO CC(C)C[N@H+](Cc1cnn[nH]1)Cc1ccccc1 ZINC001203198425 966543112 /nfs/dbraw/zinc/54/31/12/966543112.db2.gz KVGMFJKJCGTPPH-UHFFFAOYSA-N 1 2 244.342 2.463 20 0 BEADLO CC(C)C[N@@H+](Cc1cnn[nH]1)Cc1ccccc1 ZINC001203198425 966543119 /nfs/dbraw/zinc/54/31/19/966543119.db2.gz KVGMFJKJCGTPPH-UHFFFAOYSA-N 1 2 244.342 2.463 20 0 BEADLO CC(C)C[N@H+](Cc1c[nH]nn1)Cc1ccccc1 ZINC001203198425 966543124 /nfs/dbraw/zinc/54/31/24/966543124.db2.gz KVGMFJKJCGTPPH-UHFFFAOYSA-N 1 2 244.342 2.463 20 0 BEADLO CC(C)C[N@@H+](Cc1c[nH]nn1)Cc1ccccc1 ZINC001203198425 966543130 /nfs/dbraw/zinc/54/31/30/966543130.db2.gz KVGMFJKJCGTPPH-UHFFFAOYSA-N 1 2 244.342 2.463 20 0 BEADLO CC(C)C[N@@H+](Cc1cn[nH]n1)Cc1ccccc1 ZINC001203198425 966543147 /nfs/dbraw/zinc/54/31/47/966543147.db2.gz KVGMFJKJCGTPPH-UHFFFAOYSA-N 1 2 244.342 2.463 20 0 BEADLO CCc1cc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)on1 ZINC001203219559 966565429 /nfs/dbraw/zinc/56/54/29/966565429.db2.gz VAHNRSMBVQMTSG-KPXOXKRLSA-N 1 2 224.279 2.027 20 0 BEADLO COc1ccc(N)c(Nc2ccc(C)[nH+]c2C)n1 ZINC001203370779 966619468 /nfs/dbraw/zinc/61/94/68/966619468.db2.gz UYZCRBBWVAEKPL-UHFFFAOYSA-N 1 2 244.298 2.428 20 0 BEADLO Clc1cc(NC2=CCOC2)cn2cc[nH+]c12 ZINC001203387594 966624185 /nfs/dbraw/zinc/62/41/85/966624185.db2.gz ZWHSEIHWKQXULE-UHFFFAOYSA-N 1 2 235.674 2.314 20 0 BEADLO CNc1ccc(Nc2cnc(Cl)nc2)c[nH+]1 ZINC001203446566 966646365 /nfs/dbraw/zinc/64/63/65/966646365.db2.gz DQHRWNFXHCSYRV-UHFFFAOYSA-N 1 2 235.678 2.310 20 0 BEADLO CCn1cc(Nc2ccc(NC)[nH+]c2)cn1 ZINC001203448965 966647358 /nfs/dbraw/zinc/64/73/58/966647358.db2.gz SNTSPKLDVOYLRZ-UHFFFAOYSA-N 1 2 217.276 2.083 20 0 BEADLO COc1ccccc1C[N@@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001203439540 966649438 /nfs/dbraw/zinc/64/94/38/966649438.db2.gz JINBZOVNAXBNBK-CHWSQXEVSA-N 1 2 233.311 2.058 20 0 BEADLO COc1ccccc1C[N@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001203439540 966649447 /nfs/dbraw/zinc/64/94/47/966649447.db2.gz JINBZOVNAXBNBK-CHWSQXEVSA-N 1 2 233.311 2.058 20 0 BEADLO CNc1ccc(Nc2c(C)noc2C)c[nH+]1 ZINC001203448696 966650715 /nfs/dbraw/zinc/65/07/15/966650715.db2.gz GDYYHWMBMKXBOP-UHFFFAOYSA-N 1 2 218.260 2.472 20 0 BEADLO CNc1ccc(Nc2cc(N)ccc2OC)c[nH+]1 ZINC001203457875 966652584 /nfs/dbraw/zinc/65/25/84/966652584.db2.gz CQBCAFBYELWQGE-UHFFFAOYSA-N 1 2 244.298 2.458 20 0 BEADLO CCc1nccnc1Nc1ccc(NC)[nH+]c1 ZINC001203449611 966652852 /nfs/dbraw/zinc/65/28/52/966652852.db2.gz KXXZBROCCZLROR-UHFFFAOYSA-N 1 2 229.287 2.219 20 0 BEADLO CNc1ccc(Nc2cn(CCF)cn2)c[nH+]1 ZINC001203453272 966653941 /nfs/dbraw/zinc/65/39/41/966653941.db2.gz ZUXBANUYBQSVSF-UHFFFAOYSA-N 1 2 235.266 2.033 20 0 BEADLO CCOc1ccccc1C[N@H+](C)C1(C)COC1 ZINC001203544045 966666461 /nfs/dbraw/zinc/66/64/61/966666461.db2.gz QQSGZOMIDLLNLU-UHFFFAOYSA-N 1 2 235.327 2.306 20 0 BEADLO CCOc1ccccc1C[N@@H+](C)C1(C)COC1 ZINC001203544045 966666467 /nfs/dbraw/zinc/66/64/67/966666467.db2.gz QQSGZOMIDLLNLU-UHFFFAOYSA-N 1 2 235.327 2.306 20 0 BEADLO COc1nccc(Nc2cc(C)c[nH+]c2C)n1 ZINC001203654912 966718422 /nfs/dbraw/zinc/71/84/22/966718422.db2.gz RXGSJOOUQGBSOT-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO Cc1c(Nc2cc(C)c[nH+]c2C)ncn1C ZINC001203657625 966730382 /nfs/dbraw/zinc/73/03/82/966730382.db2.gz SCAVUSKEBJVGAK-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO CNc1ccc(Nc2cc(OC)ccc2N)c[nH+]1 ZINC001203456579 966827563 /nfs/dbraw/zinc/82/75/63/966827563.db2.gz KXPBSRMTGCALOM-UHFFFAOYSA-N 1 2 244.298 2.458 20 0 BEADLO Clc1cnc2c(c1)C[N@@H+](Cc1ncc[nH]1)CC2 ZINC001203979738 966839771 /nfs/dbraw/zinc/83/97/71/966839771.db2.gz CMHZGFMBMGELAX-UHFFFAOYSA-N 1 2 248.717 2.016 20 0 BEADLO Clc1cnc2c(c1)C[N@H+](Cc1ncc[nH]1)CC2 ZINC001203979738 966839778 /nfs/dbraw/zinc/83/97/78/966839778.db2.gz CMHZGFMBMGELAX-UHFFFAOYSA-N 1 2 248.717 2.016 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2ccncc2)C[C@H]1F ZINC001204080021 966885770 /nfs/dbraw/zinc/88/57/70/966885770.db2.gz DLLVUMOPDBULQT-VXGBXAGGSA-N 1 2 226.270 2.354 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2ccncc2)C[C@H]1F ZINC001204080021 966885775 /nfs/dbraw/zinc/88/57/75/966885775.db2.gz DLLVUMOPDBULQT-VXGBXAGGSA-N 1 2 226.270 2.354 20 0 BEADLO c1cc2c(o1)CC[N@@H+](Cc1ccncc1)C2 ZINC001204081943 966886375 /nfs/dbraw/zinc/88/63/75/966886375.db2.gz VCOKWJYJDPYGNC-UHFFFAOYSA-N 1 2 214.268 2.233 20 0 BEADLO c1cc2c(o1)CC[N@H+](Cc1ccncc1)C2 ZINC001204081943 966886379 /nfs/dbraw/zinc/88/63/79/966886379.db2.gz VCOKWJYJDPYGNC-UHFFFAOYSA-N 1 2 214.268 2.233 20 0 BEADLO CCCOC1C[NH+](Cc2ccc(O)cc2)C1 ZINC001204094083 966889655 /nfs/dbraw/zinc/88/96/55/966889655.db2.gz XFFXAJGVQOEQNE-UHFFFAOYSA-N 1 2 221.300 2.003 20 0 BEADLO CSc1ccc(C[N@@H+]2C[C@@H]3C[C@H]2CO3)cc1 ZINC001204142306 966903491 /nfs/dbraw/zinc/90/34/91/966903491.db2.gz MPBPOPJNIAAUCB-RYUDHWBXSA-N 1 2 235.352 2.382 20 0 BEADLO CSc1ccc(C[N@H+]2C[C@@H]3C[C@H]2CO3)cc1 ZINC001204142306 966903497 /nfs/dbraw/zinc/90/34/97/966903497.db2.gz MPBPOPJNIAAUCB-RYUDHWBXSA-N 1 2 235.352 2.382 20 0 BEADLO C[N@H+](Cc1cc(F)cc(F)c1)Cc1ccncn1 ZINC001204233708 966934326 /nfs/dbraw/zinc/93/43/26/966934326.db2.gz UNUHCXOXWVJYNU-UHFFFAOYSA-N 1 2 249.264 2.387 20 0 BEADLO C[N@@H+](Cc1cc(F)cc(F)c1)Cc1ccncn1 ZINC001204233708 966934334 /nfs/dbraw/zinc/93/43/34/966934334.db2.gz UNUHCXOXWVJYNU-UHFFFAOYSA-N 1 2 249.264 2.387 20 0 BEADLO CCc1ccc(C[N@H+](C)Cc2cncnc2)o1 ZINC001204394911 966990279 /nfs/dbraw/zinc/99/02/79/966990279.db2.gz VSNRTUGVGQXXRN-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1ccc(C[N@@H+](C)Cc2cncnc2)o1 ZINC001204394911 966990286 /nfs/dbraw/zinc/99/02/86/966990286.db2.gz VSNRTUGVGQXXRN-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO COc1cc2[nH+]ccn2cc1-c1cccnc1 ZINC001239569016 967004659 /nfs/dbraw/zinc/00/46/59/967004659.db2.gz MQDJMPSZLBOBSI-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO C[N@H+](Cc1ccc2ccccc2n1)C1COC1 ZINC001204503346 967010000 /nfs/dbraw/zinc/01/00/00/967010000.db2.gz RJERSWAUMDELJV-UHFFFAOYSA-N 1 2 228.295 2.065 20 0 BEADLO C[N@@H+](Cc1ccc2ccccc2n1)C1COC1 ZINC001204503346 967010006 /nfs/dbraw/zinc/01/00/06/967010006.db2.gz RJERSWAUMDELJV-UHFFFAOYSA-N 1 2 228.295 2.065 20 0 BEADLO Cc1c(F)cccc1CN1CCn2c[nH+]cc2C1 ZINC001204509265 967020930 /nfs/dbraw/zinc/02/09/30/967020930.db2.gz AGTKRAFXCIJACV-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO COc1cc[nH+]cc1Nc1ccc(N)c(OC)c1 ZINC001249716441 967036952 /nfs/dbraw/zinc/03/69/52/967036952.db2.gz JZIDMBQNAXWKTE-UHFFFAOYSA-N 1 2 245.282 2.425 20 0 BEADLO Nc1ncc(Nc2ccn3cc[nH+]c3c2)cc1F ZINC001249759643 967047102 /nfs/dbraw/zinc/04/71/02/967047102.db2.gz HIBDDZKMXWGFSI-UHFFFAOYSA-N 1 2 243.245 2.194 20 0 BEADLO COc1cc(Nc2cnc(N)c(F)c2)cc(C)[nH+]1 ZINC001249761895 967049508 /nfs/dbraw/zinc/04/95/08/967049508.db2.gz ZNSSWGSROSXDQO-UHFFFAOYSA-N 1 2 248.261 2.259 20 0 BEADLO Cc1c(C[N@@H+]2CC[C@](C)(F)[C@H](F)C2)cnn1C ZINC001204570038 967053753 /nfs/dbraw/zinc/05/37/53/967053753.db2.gz ZDIXXOGKNMFQMN-NEPJUHHUSA-N 1 2 243.301 2.001 20 0 BEADLO Cc1c(C[N@H+]2CC[C@](C)(F)[C@H](F)C2)cnn1C ZINC001204570038 967053767 /nfs/dbraw/zinc/05/37/67/967053767.db2.gz ZDIXXOGKNMFQMN-NEPJUHHUSA-N 1 2 243.301 2.001 20 0 BEADLO CO[C@H]1CC[N@H+](Cc2scnc2Cl)C1 ZINC001137817666 967110619 /nfs/dbraw/zinc/11/06/19/967110619.db2.gz ZZPRMMMHTKDNIA-ZETCQYMHSA-N 1 2 232.736 2.017 20 0 BEADLO CO[C@H]1CC[N@@H+](Cc2scnc2Cl)C1 ZINC001137817666 967110626 /nfs/dbraw/zinc/11/06/26/967110626.db2.gz ZZPRMMMHTKDNIA-ZETCQYMHSA-N 1 2 232.736 2.017 20 0 BEADLO Cc1cc(C)c(Nc2cnc3ccnn3c2)c[nH+]1 ZINC001204780594 967165838 /nfs/dbraw/zinc/16/58/38/967165838.db2.gz FNPIAFCZUSZHTA-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO [NH3+]Cc1cncc(-c2cccc(S)c2)c1 ZINC001239797675 967193326 /nfs/dbraw/zinc/19/33/26/967193326.db2.gz UIPCLSNTZKKZJN-UHFFFAOYSA-N 1 2 216.309 2.496 20 0 BEADLO Cc1cncc(Nc2ccn3cc[nH+]c3c2)n1 ZINC001204951493 967252322 /nfs/dbraw/zinc/25/23/22/967252322.db2.gz UJEHTWDBNHIPDY-UHFFFAOYSA-N 1 2 225.255 2.176 20 0 BEADLO Cc1cc(-c2ccc3nonc3c2)c[nH+]c1N ZINC001204952337 967255892 /nfs/dbraw/zinc/25/58/92/967255892.db2.gz XKZXZNUMLOVZEX-UHFFFAOYSA-N 1 2 226.239 2.175 20 0 BEADLO Oc1ccc(Nc2ccn3cc[nH+]c3c2)c(O)c1 ZINC001204977253 967273187 /nfs/dbraw/zinc/27/31/87/967273187.db2.gz DEVFGJTVGZFBFG-UHFFFAOYSA-N 1 2 241.250 2.489 20 0 BEADLO c1cn2cc(C[C@H]3CCCO3)ccc2[nH+]1 ZINC001250101284 967370810 /nfs/dbraw/zinc/37/08/10/967370810.db2.gz XJCFPYYNKATLOK-LLVKDONJSA-N 1 2 202.257 2.056 20 0 BEADLO c1cn2cc(-c3cccn4cnnc34)ccc2[nH+]1 ZINC001240219607 967428056 /nfs/dbraw/zinc/42/80/56/967428056.db2.gz PYKGKDLZFONMPT-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO CCn1nccc1Nc1cccc2[nH+]ccn21 ZINC001205268132 967461401 /nfs/dbraw/zinc/46/14/01/967461401.db2.gz KZSNYNBGQFPBKB-UHFFFAOYSA-N 1 2 227.271 2.294 20 0 BEADLO CCn1nccc1Nc1cc(C)cc[nH+]1 ZINC001205268105 967462598 /nfs/dbraw/zinc/46/25/98/967462598.db2.gz JNEZDGAFHBZVAT-UHFFFAOYSA-N 1 2 202.261 2.350 20 0 BEADLO CN(C)c1ccc(Cc2cccnc2)c[nH+]1 ZINC001250170363 967468434 /nfs/dbraw/zinc/46/84/34/967468434.db2.gz PSBBOIXGRZBNRZ-UHFFFAOYSA-N 1 2 213.284 2.133 20 0 BEADLO COc1cc[nH+]cc1Cc1csc(C)n1 ZINC001250195845 967502533 /nfs/dbraw/zinc/50/25/33/967502533.db2.gz VRZDSLDUYMYDOQ-UHFFFAOYSA-N 1 2 220.297 2.446 20 0 BEADLO Clc1ccsc1C[NH+]1CC2(COC2)C1 ZINC001205312581 967515960 /nfs/dbraw/zinc/51/59/60/967515960.db2.gz WUNSOVIMRQOOJB-UHFFFAOYSA-N 1 2 229.732 2.234 20 0 BEADLO Cc1cn2cc(-c3cn(C)nc3C)ccc2[nH+]1 ZINC001240302884 967522456 /nfs/dbraw/zinc/52/24/56/967522456.db2.gz VRFGNLXUMKBGQX-UHFFFAOYSA-N 1 2 226.283 2.352 20 0 BEADLO Cc1[nH]c2ccc(CCCCCC(N)=O)cc2[nH+]1 ZINC001250272369 967596237 /nfs/dbraw/zinc/59/62/37/967596237.db2.gz MLOVVMSYKHASGJ-UHFFFAOYSA-N 1 2 245.326 2.460 20 0 BEADLO CCCn1cncc1C[N@H+](C)Cc1ccncc1 ZINC001205365668 967598587 /nfs/dbraw/zinc/59/85/87/967598587.db2.gz BTMFLHHCARDZEH-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CCCn1cncc1C[N@@H+](C)Cc1ccncc1 ZINC001205365668 967598608 /nfs/dbraw/zinc/59/86/08/967598608.db2.gz BTMFLHHCARDZEH-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO c1cn(CCc2ccc3c(c2)CCCO3)c[nH+]1 ZINC001250315852 967676375 /nfs/dbraw/zinc/67/63/75/967676375.db2.gz TXSIPGZOWSMEQN-UHFFFAOYSA-N 1 2 228.295 2.451 20 0 BEADLO COc1ccc(C)cc1CCn1cc[nH+]c1 ZINC001250315834 967682704 /nfs/dbraw/zinc/68/27/04/967682704.db2.gz SGCZPIYHVZDHFS-UHFFFAOYSA-N 1 2 216.284 2.443 20 0 BEADLO c1cn(CCc2cnn(C3CCC3)c2)c[nH+]1 ZINC001250316725 967683832 /nfs/dbraw/zinc/68/38/32/967683832.db2.gz UWNUEJJEQUZHRW-UHFFFAOYSA-N 1 2 216.288 2.047 20 0 BEADLO Oc1c(F)cc(F)cc1CCn1cc[nH+]c1 ZINC001250318358 967686420 /nfs/dbraw/zinc/68/64/20/967686420.db2.gz DTFOSPNQHMZGAL-UHFFFAOYSA-N 1 2 224.210 2.110 20 0 BEADLO CCOc1ncc(CCn2cc[nH+]c2)cc1F ZINC001250318360 967686874 /nfs/dbraw/zinc/68/68/74/967686874.db2.gz DTZLGFBQRLVFDM-UHFFFAOYSA-N 1 2 235.262 2.059 20 0 BEADLO Cc1nn(C)c2ccc(CCn3cc[nH+]c3)cc12 ZINC001250316798 967691025 /nfs/dbraw/zinc/69/10/25/967691025.db2.gz YKAZQRYJGSEGHF-UHFFFAOYSA-N 1 2 240.310 2.321 20 0 BEADLO c1cn(CCc2ccc3cncnc3c2)c[nH+]1 ZINC001250316734 967691387 /nfs/dbraw/zinc/69/13/87/967691387.db2.gz VECDMRJNIGVDLM-UHFFFAOYSA-N 1 2 224.267 2.069 20 0 BEADLO Cc1cc2n[nH]cc2cc1CCn1cc[nH+]c1 ZINC001250319425 967693545 /nfs/dbraw/zinc/69/35/45/967693545.db2.gz RABPHVVPKNECLP-UHFFFAOYSA-N 1 2 226.283 2.311 20 0 BEADLO COc1ccc(CCn2cc[nH+]c2)c2c[nH]nc21 ZINC001250320450 967696677 /nfs/dbraw/zinc/69/66/77/967696677.db2.gz MAVOAEBYNIDHNO-UHFFFAOYSA-N 1 2 242.282 2.011 20 0 BEADLO c1cn(CCc2ccc(OCC3CC3)nc2)c[nH+]1 ZINC001250320125 967696860 /nfs/dbraw/zinc/69/68/60/967696860.db2.gz YPEYIXRVLJPOCS-UHFFFAOYSA-N 1 2 243.310 2.310 20 0 BEADLO CNc1ccc(-n2cc(N)c3cccnc32)c[nH+]1 ZINC001203448619 967714792 /nfs/dbraw/zinc/71/47/92/967714792.db2.gz BWZOKVOSJBMCKZ-UHFFFAOYSA-N 1 2 239.282 2.044 20 0 BEADLO Clc1cccc2c1C[C@H]([N@@H+]1CCO[C@@H]3C[C@@H]31)C2 ZINC001168744439 967720704 /nfs/dbraw/zinc/72/07/04/967720704.db2.gz PTOXMWJMRGUEBV-DDTOSNHZSA-N 1 2 249.741 2.280 20 0 BEADLO Clc1cccc2c1C[C@H]([N@H+]1CCO[C@@H]3C[C@@H]31)C2 ZINC001168744439 967720718 /nfs/dbraw/zinc/72/07/18/967720718.db2.gz PTOXMWJMRGUEBV-DDTOSNHZSA-N 1 2 249.741 2.280 20 0 BEADLO c1c[nH+]c(-c2ccc(Cc3ncccn3)cc2)[nH]1 ZINC001250344600 967738711 /nfs/dbraw/zinc/73/87/11/967738711.db2.gz LWEFHCFLRVJZHZ-UHFFFAOYSA-N 1 2 236.278 2.458 20 0 BEADLO Cc1ccc(F)c(C[N@@H+]2C[C@H]3CC[C@@H]2CO3)c1 ZINC001205670846 967756220 /nfs/dbraw/zinc/75/62/20/967756220.db2.gz XWJXOQSTFOVAEA-CHWSQXEVSA-N 1 2 235.302 2.497 20 0 BEADLO Cc1ccc(F)c(C[N@H+]2C[C@H]3CC[C@@H]2CO3)c1 ZINC001205670846 967756236 /nfs/dbraw/zinc/75/62/36/967756236.db2.gz XWJXOQSTFOVAEA-CHWSQXEVSA-N 1 2 235.302 2.497 20 0 BEADLO CC[N@H+](Cc1cnoc1)Cc1ccncc1 ZINC001205670278 967759697 /nfs/dbraw/zinc/75/96/97/967759697.db2.gz MMZUPGZVSJUWJF-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO CC[N@@H+](Cc1cnoc1)Cc1ccncc1 ZINC001205670278 967759708 /nfs/dbraw/zinc/75/97/08/967759708.db2.gz MMZUPGZVSJUWJF-UHFFFAOYSA-N 1 2 217.272 2.092 20 0 BEADLO CNc1ccc(NCC(C)(F)F)c[nH+]1 ZINC001162234386 967768630 /nfs/dbraw/zinc/76/86/30/967768630.db2.gz SSPYZRGLQRLVFR-UHFFFAOYSA-N 1 2 201.220 2.190 20 0 BEADLO C[C@@H](CO)[N@H+](C)Cc1cncc(Cl)c1Cl ZINC001205685207 967776553 /nfs/dbraw/zinc/77/65/53/967776553.db2.gz RKEMLLDHUNEKPI-ZETCQYMHSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@@H](CO)[N@@H+](C)Cc1cncc(Cl)c1Cl ZINC001205685207 967776555 /nfs/dbraw/zinc/77/65/55/967776555.db2.gz RKEMLLDHUNEKPI-ZETCQYMHSA-N 1 2 249.141 2.201 20 0 BEADLO Cc1ncc(-c2cc(-n3ccnc3)cc[nH+]2)cn1 ZINC001205841127 967847230 /nfs/dbraw/zinc/84/72/30/967847230.db2.gz WENMEBFGPGGYOO-UHFFFAOYSA-N 1 2 237.266 2.033 20 0 BEADLO Cc1ncc(-c2ccn3cc[nH+]c3c2)cn1 ZINC001205847503 967851448 /nfs/dbraw/zinc/85/14/48/967851448.db2.gz WBXZXFVTFQPVEO-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO Cc1cnccc1C[N@@H+]1CCC(=O)C(C)(C)C1 ZINC001205863168 967862117 /nfs/dbraw/zinc/86/21/17/967862117.db2.gz ZCFSQFNTCZUURD-UHFFFAOYSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1cnccc1C[N@H+]1CCC(=O)C(C)(C)C1 ZINC001205863168 967862118 /nfs/dbraw/zinc/86/21/18/967862118.db2.gz ZCFSQFNTCZUURD-UHFFFAOYSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)co1 ZINC001206047954 968014496 /nfs/dbraw/zinc/01/44/96/968014496.db2.gz BNCAXTQKVKVEFP-AOOOYVTPSA-N 1 2 242.269 2.460 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)co1 ZINC001206047954 968014514 /nfs/dbraw/zinc/01/45/14/968014514.db2.gz BNCAXTQKVKVEFP-AOOOYVTPSA-N 1 2 242.269 2.460 20 0 BEADLO Cc1ccc(Nc2ccn(C)c(=O)c2)c(C)[nH+]1 ZINC001206070988 968039875 /nfs/dbraw/zinc/03/98/75/968039875.db2.gz LFZPWAREZKVJPD-UHFFFAOYSA-N 1 2 229.283 2.141 20 0 BEADLO c1c2c(cc3[nH+]c([C@H]4CCCOC4)[nH]c13)OCC2 ZINC001250551229 968056491 /nfs/dbraw/zinc/05/64/91/968056491.db2.gz LWPKLKSHIOUSDU-JTQLQIEISA-N 1 2 244.294 2.392 20 0 BEADLO Cc1cc(O)cc(-c2cc[nH+]c(N)c2)c1 ZINC001206233914 968157709 /nfs/dbraw/zinc/15/77/09/968157709.db2.gz DEPLELZDHPNULX-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO Cn1cnc(C[N@@H+]2CC[C@H]2c2ccccc2)c1 ZINC001206237068 968162185 /nfs/dbraw/zinc/16/21/85/968162185.db2.gz KCYFCVHSSTUMKO-AWEZNQCLSA-N 1 2 227.311 2.367 20 0 BEADLO Cn1cnc(C[N@H+]2CC[C@H]2c2ccccc2)c1 ZINC001206237068 968162189 /nfs/dbraw/zinc/16/21/89/968162189.db2.gz KCYFCVHSSTUMKO-AWEZNQCLSA-N 1 2 227.311 2.367 20 0 BEADLO C[C@@H]1C[C@H]1c1[nH]c2cc3c(cc2[nH+]1)OCC(=O)N3 ZINC001250616110 968164917 /nfs/dbraw/zinc/16/49/17/968164917.db2.gz WXFIFHPZKSMDNL-RNFRBKRXSA-N 1 2 243.266 2.017 20 0 BEADLO C[C@H]1C[C@H]1c1[nH]c2cc3c(cc2[nH+]1)OCC(=O)N3 ZINC001250616109 968165065 /nfs/dbraw/zinc/16/50/65/968165065.db2.gz WXFIFHPZKSMDNL-NKWVEPMBSA-N 1 2 243.266 2.017 20 0 BEADLO COc1cnccc1C[N@@H+]1C[C@@H](F)C[C@H]1C ZINC001206438034 968302854 /nfs/dbraw/zinc/30/28/54/968302854.db2.gz KKXIAGKJBKXESV-KOLCDFICSA-N 1 2 224.279 2.023 20 0 BEADLO COc1cnccc1C[N@H+]1C[C@@H](F)C[C@H]1C ZINC001206438034 968302860 /nfs/dbraw/zinc/30/28/60/968302860.db2.gz KKXIAGKJBKXESV-KOLCDFICSA-N 1 2 224.279 2.023 20 0 BEADLO COc1cnccc1C[N@H+](C)C1CC(F)(F)C1 ZINC001206438007 968304219 /nfs/dbraw/zinc/30/42/19/968304219.db2.gz JHVRSKWBICJKAK-UHFFFAOYSA-N 1 2 242.269 2.320 20 0 BEADLO COc1cnccc1C[N@@H+](C)C1CC(F)(F)C1 ZINC001206438007 968304227 /nfs/dbraw/zinc/30/42/27/968304227.db2.gz JHVRSKWBICJKAK-UHFFFAOYSA-N 1 2 242.269 2.320 20 0 BEADLO Nc1[nH+]cccc1-c1cc2n[nH]cc2c(F)c1 ZINC001206572197 968394169 /nfs/dbraw/zinc/39/41/69/968394169.db2.gz SUXLXFLKJDASHI-UHFFFAOYSA-N 1 2 228.230 2.346 20 0 BEADLO Nc1ccc(-c2cc3n[nH]cc3c(F)c2)c[nH+]1 ZINC001206579122 968400622 /nfs/dbraw/zinc/40/06/22/968400622.db2.gz DHGSYWBTYJYGNS-UHFFFAOYSA-N 1 2 228.230 2.346 20 0 BEADLO Cc1nc(N(C)C2(C)COC2)cc(C(C)C)[nH+]1 ZINC001166984448 968413246 /nfs/dbraw/zinc/41/32/46/968413246.db2.gz KVRLGWIDBWOSFV-UHFFFAOYSA-N 1 2 235.331 2.134 20 0 BEADLO CCCCOC1C[NH+](C[C@H](O)c2ccccc2)C1 ZINC001251989285 968428009 /nfs/dbraw/zinc/42/80/09/968428009.db2.gz UHOMOAVVBFIAQH-HNNXBMFYSA-N 1 2 249.354 2.221 20 0 BEADLO CNc1ccc(Nc2ccoc2C(=O)OC)c[nH+]1 ZINC001203449038 968435263 /nfs/dbraw/zinc/43/52/63/968435263.db2.gz WZAUSNUWMNTJRE-UHFFFAOYSA-N 1 2 247.254 2.247 20 0 BEADLO CNc1ccc(Nc2cnccc2C(C)=O)c[nH+]1 ZINC001203449064 968439796 /nfs/dbraw/zinc/43/97/96/968439796.db2.gz YKISGRQYBHWACY-UHFFFAOYSA-N 1 2 242.282 2.465 20 0 BEADLO C[C@H]1C[C@@H](CF)[N@H+](Cc2ccncc2F)C1 ZINC001206783310 968468310 /nfs/dbraw/zinc/46/83/10/968468310.db2.gz BWERRCXGBXHBBQ-ONGXEEELSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@H]1C[C@@H](CF)[N@@H+](Cc2ccncc2F)C1 ZINC001206783310 968468317 /nfs/dbraw/zinc/46/83/17/968468317.db2.gz BWERRCXGBXHBBQ-ONGXEEELSA-N 1 2 226.270 2.401 20 0 BEADLO Cc1nc(C[NH+]2CC3(CCC3)C2)cs1 ZINC001206799088 968481334 /nfs/dbraw/zinc/48/13/34/968481334.db2.gz VZPOZUPMSBHMJP-UHFFFAOYSA-N 1 2 208.330 2.437 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCC(=O)[C@@H](C)CC2)c1 ZINC001206847920 968496860 /nfs/dbraw/zinc/49/68/60/968496860.db2.gz VBICZPIPSNNJPR-LBPRGKRZSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1ccnc(C[N@H+]2CCC(=O)[C@@H](C)CC2)c1 ZINC001206847920 968496865 /nfs/dbraw/zinc/49/68/65/968496865.db2.gz VBICZPIPSNNJPR-LBPRGKRZSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1ccnc(C[NH+]2CC(C(F)F)C2)c1 ZINC001206853374 968500176 /nfs/dbraw/zinc/50/01/76/968500176.db2.gz QKUSVXMCDDULIB-UHFFFAOYSA-N 1 2 212.243 2.087 20 0 BEADLO Cc1ncsc1C[N@@H+]1CCC(=O)[C@H](C)CC1 ZINC001206862721 968503912 /nfs/dbraw/zinc/50/39/12/968503912.db2.gz FBUJYTCTUVCMGT-SECBINFHSA-N 1 2 238.356 2.253 20 0 BEADLO Cc1ncsc1C[N@H+]1CCC(=O)[C@H](C)CC1 ZINC001206862721 968503917 /nfs/dbraw/zinc/50/39/17/968503917.db2.gz FBUJYTCTUVCMGT-SECBINFHSA-N 1 2 238.356 2.253 20 0 BEADLO COc1cncc(C[N@H+](C)Cc2cncs2)c1 ZINC001206998677 968530432 /nfs/dbraw/zinc/53/04/32/968530432.db2.gz WJULEMXHOJOEII-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1cncc(C[N@@H+](C)Cc2cncs2)c1 ZINC001206998677 968530437 /nfs/dbraw/zinc/53/04/37/968530437.db2.gz WJULEMXHOJOEII-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO c1ccc(C2C[NH+](Cc3ncccn3)C2)cc1 ZINC001207016423 968554092 /nfs/dbraw/zinc/55/40/92/968554092.db2.gz WERISIKMOCXWNK-UHFFFAOYSA-N 1 2 225.295 2.076 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1ccc(F)cn1 ZINC001207038484 968568781 /nfs/dbraw/zinc/56/87/81/968568781.db2.gz OUEYTOUKQWFOPX-SCZZXKLOSA-N 1 2 212.243 2.153 20 0 BEADLO CN(Cc1[nH+]cc2ccccn21)CC1CC1 ZINC001207047886 968580624 /nfs/dbraw/zinc/58/06/24/968580624.db2.gz CTVBMWYTEJLDCO-UHFFFAOYSA-N 1 2 215.300 2.176 20 0 BEADLO c1[nH+]c(CN2C[C@H]3CC[C@@H]2C3)n2ccccc12 ZINC001207057835 968585278 /nfs/dbraw/zinc/58/52/78/968585278.db2.gz RPBXEOHLTCLCEM-NWDGAFQWSA-N 1 2 227.311 2.319 20 0 BEADLO c1[nH+]c(CN2CCC[C@H]3C[C@H]32)n2ccccc12 ZINC001207055487 968587694 /nfs/dbraw/zinc/58/76/94/968587694.db2.gz YLSRWPDSLDUIPI-WCQYABFASA-N 1 2 227.311 2.319 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCCCC12COC2 ZINC001207173189 968677696 /nfs/dbraw/zinc/67/76/96/968677696.db2.gz IFCMJQKUYTUBPA-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCCCC12COC2 ZINC001207173189 968677705 /nfs/dbraw/zinc/67/77/05/968677705.db2.gz IFCMJQKUYTUBPA-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO Cc1nc(NCC(C)(F)F)c2c([nH+]1)CCC2 ZINC001154858923 968695080 /nfs/dbraw/zinc/69/50/80/968695080.db2.gz ZLCLGRGHOWVREB-UHFFFAOYSA-N 1 2 227.258 2.341 20 0 BEADLO C[C@H](CCC1CC1)NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001324037538 968886143 /nfs/dbraw/zinc/88/61/43/968886143.db2.gz JSLUIAVQURSDOF-GHMZBOCLSA-N 1 2 235.331 2.139 20 0 BEADLO C[C@@H]1CN(CC2(c3ccccc3)CC2)CC[N@@H+]1C ZINC001207838295 968896670 /nfs/dbraw/zinc/89/66/70/968896670.db2.gz GHZHNWXGHZCNFS-CQSZACIVSA-N 1 2 244.382 2.354 20 0 BEADLO C[C@@H]1CN(CC2(c3ccccc3)CC2)CC[N@H+]1C ZINC001207838295 968896673 /nfs/dbraw/zinc/89/66/73/968896673.db2.gz GHZHNWXGHZCNFS-CQSZACIVSA-N 1 2 244.382 2.354 20 0 BEADLO CCC[C@@H](O)CNc1ccc(C)[nH+]c1C ZINC001252770758 968938209 /nfs/dbraw/zinc/93/82/09/968938209.db2.gz KYHGOAPRKQMCKH-LLVKDONJSA-N 1 2 208.305 2.271 20 0 BEADLO Cc1cc2c(cn1)C[N@H+](C[C@H]1CCCCO1)C2 ZINC001207961196 968959158 /nfs/dbraw/zinc/95/91/58/968959158.db2.gz YZINODXYPCCHMC-CQSZACIVSA-N 1 2 232.327 2.275 20 0 BEADLO Cc1cc2c(cn1)C[N@@H+](C[C@H]1CCCCO1)C2 ZINC001207961196 968959161 /nfs/dbraw/zinc/95/91/61/968959161.db2.gz YZINODXYPCCHMC-CQSZACIVSA-N 1 2 232.327 2.275 20 0 BEADLO CC1(C[N@@H+]2CCC(F)(F)C2)CCOCC1 ZINC001207964703 968964506 /nfs/dbraw/zinc/96/45/06/968964506.db2.gz QCGSDNMENBERHU-UHFFFAOYSA-N 1 2 219.275 2.144 20 0 BEADLO CC1(C[N@H+]2CCC(F)(F)C2)CCOCC1 ZINC001207964703 968964512 /nfs/dbraw/zinc/96/45/12/968964512.db2.gz QCGSDNMENBERHU-UHFFFAOYSA-N 1 2 219.275 2.144 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc([S@@](C)=O)cc1 ZINC001241484421 969005407 /nfs/dbraw/zinc/00/54/07/969005407.db2.gz JXLQCKQYGDUJMD-YVPSAZRESA-N 1 2 221.325 2.300 20 0 BEADLO Cc1[nH]c[nH+]c1NC[C@H](O)c1ccc(F)cc1 ZINC001252838118 969035177 /nfs/dbraw/zinc/03/51/77/969035177.db2.gz IEEXYNXAVWRKAC-NSHDSACASA-N 1 2 235.262 2.003 20 0 BEADLO CCCCC[C@@H](O)C[N@@H+]1Cc2cccnc2C1 ZINC001253521108 969197205 /nfs/dbraw/zinc/19/72/05/969197205.db2.gz ZOGHPUHMNMOJPP-CYBMUJFWSA-N 1 2 234.343 2.338 20 0 BEADLO CCCCC[C@@H](O)C[N@H+]1Cc2cccnc2C1 ZINC001253521108 969197208 /nfs/dbraw/zinc/19/72/08/969197208.db2.gz ZOGHPUHMNMOJPP-CYBMUJFWSA-N 1 2 234.343 2.338 20 0 BEADLO CC(C)Oc1ccc[nH+]c1NC1CSC1 ZINC000389928755 969205784 /nfs/dbraw/zinc/20/57/84/969205784.db2.gz YJZHESVWXZMSTB-UHFFFAOYSA-N 1 2 224.329 2.396 20 0 BEADLO C[C@@H](C[N@H+]1CCC(=O)[C@H](F)CC1)C(F)(F)F ZINC001208896578 969285878 /nfs/dbraw/zinc/28/58/78/969285878.db2.gz XFRIYSFHKLVEKZ-JGVFFNPUSA-N 1 2 241.228 2.188 20 0 BEADLO Cc1cn2c(cccc2NC[C@@H](O)C(C)(C)C)[nH+]1 ZINC001253714422 969340651 /nfs/dbraw/zinc/34/06/51/969340651.db2.gz YXWWZYXFUDPBNI-LLVKDONJSA-N 1 2 247.342 2.462 20 0 BEADLO CC(C)[C@@H](O)CNc1ccc(-n2cc[nH+]c2)cc1 ZINC001253752875 969369573 /nfs/dbraw/zinc/36/95/73/969369573.db2.gz XOKCFGUZSZCTES-AWEZNQCLSA-N 1 2 245.326 2.301 20 0 BEADLO CCCc1nnc(CN(C)c2cccc[nH+]2)o1 ZINC001253958196 969430902 /nfs/dbraw/zinc/43/09/02/969430902.db2.gz YUXOSIZEYJGWCP-UHFFFAOYSA-N 1 2 232.287 2.054 20 0 BEADLO FC1(F)CCCC[N@H+](CCCC2OCCO2)C1 ZINC001209304464 969433081 /nfs/dbraw/zinc/43/30/81/969433081.db2.gz RZRWWVULTXLQDG-UHFFFAOYSA-N 1 2 249.301 2.261 20 0 BEADLO FC1(F)CCCC[N@@H+](CCCC2OCCO2)C1 ZINC001209304464 969433086 /nfs/dbraw/zinc/43/30/86/969433086.db2.gz RZRWWVULTXLQDG-UHFFFAOYSA-N 1 2 249.301 2.261 20 0 BEADLO CCCC1=NNC(=c2ccnc3c2=CC=[NH+]3)O1 ZINC001253981934 969437922 /nfs/dbraw/zinc/43/79/22/969437922.db2.gz AVQHSWWONIIAIW-VIFPVBQESA-N 1 2 228.255 2.042 20 0 BEADLO CCCc1nnc([C@@H]2CC[N@@H+]2C(C)C)o1 ZINC001253990037 969438643 /nfs/dbraw/zinc/43/86/43/969438643.db2.gz MEQGUAOQPBDEJB-VIFPVBQESA-N 1 2 209.293 2.177 20 0 BEADLO CCCc1nnc([C@@H]2CC[N@H+]2C(C)C)o1 ZINC001253990037 969438654 /nfs/dbraw/zinc/43/86/54/969438654.db2.gz MEQGUAOQPBDEJB-VIFPVBQESA-N 1 2 209.293 2.177 20 0 BEADLO c1[nH+]c2ccccn2c1Cc1nnc(C2CC2)o1 ZINC001254087525 969486304 /nfs/dbraw/zinc/48/63/04/969486304.db2.gz JWSNPJSQGFKXIQ-UHFFFAOYSA-N 1 2 240.266 2.186 20 0 BEADLO CC(C)(C)[N@@H+]1CC[C@@H]1c1nnc(C2CC2)o1 ZINC001254087832 969486924 /nfs/dbraw/zinc/48/69/24/969486924.db2.gz XXXSJJAVGCTJPC-SECBINFHSA-N 1 2 221.304 2.492 20 0 BEADLO CC(C)(C)[N@H+]1CC[C@@H]1c1nnc(C2CC2)o1 ZINC001254087832 969486933 /nfs/dbraw/zinc/48/69/33/969486933.db2.gz XXXSJJAVGCTJPC-SECBINFHSA-N 1 2 221.304 2.492 20 0 BEADLO CC(=O)[C@H]1CC[N@H+](Cc2cnc(Cl)s2)C1 ZINC001209471621 969522009 /nfs/dbraw/zinc/52/20/09/969522009.db2.gz CUDWXJBVGOVEGH-QMMMGPOBSA-N 1 2 244.747 2.207 20 0 BEADLO CC(=O)[C@H]1CC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC001209471621 969522013 /nfs/dbraw/zinc/52/20/13/969522013.db2.gz CUDWXJBVGOVEGH-QMMMGPOBSA-N 1 2 244.747 2.207 20 0 BEADLO Cc1ccc2[nH]cc(C[NH+]3CC4(CCO4)C3)c2c1 ZINC001209495410 969526125 /nfs/dbraw/zinc/52/61/25/969526125.db2.gz UDOZZZLJNVNBMK-UHFFFAOYSA-N 1 2 242.322 2.451 20 0 BEADLO Fc1cccc(-c2nnc(C[NH+]3CCC3)o2)c1 ZINC001254180638 969537115 /nfs/dbraw/zinc/53/71/15/969537115.db2.gz ROUWYJHVEPDAAD-UHFFFAOYSA-N 1 2 233.246 2.081 20 0 BEADLO Cc1cc(N[C@H]2CCC[C@@H](O)C2)c[nH+]c1C ZINC001169250345 969539919 /nfs/dbraw/zinc/53/99/19/969539919.db2.gz CIRJOGHYNUIYDA-WCQYABFASA-N 1 2 220.316 2.414 20 0 BEADLO Cc1n[nH]cc1C[N@@H+]1CCC(=O)[C@H]2CCCC[C@H]21 ZINC001209554910 969542230 /nfs/dbraw/zinc/54/22/30/969542230.db2.gz QQKKSUJUSBZCCN-QWHCGFSZSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1n[nH]cc1C[N@H+]1CCC(=O)[C@H]2CCCC[C@H]21 ZINC001209554910 969542234 /nfs/dbraw/zinc/54/22/34/969542234.db2.gz QQKKSUJUSBZCCN-QWHCGFSZSA-N 1 2 247.342 2.052 20 0 BEADLO COc1cncc(CCNc2cccc[nH+]2)c1 ZINC001169259538 969549117 /nfs/dbraw/zinc/54/91/17/969549117.db2.gz NJVVXCWSTICHDR-UHFFFAOYSA-N 1 2 229.283 2.140 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC[C@H]2c2ncccn2)[nH]1 ZINC001209576922 969560342 /nfs/dbraw/zinc/56/03/42/969560342.db2.gz IEAXTVHUPWYZEB-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc(C[N@H+]2CCC[C@H]2c2ncccn2)[nH]1 ZINC001209576922 969560347 /nfs/dbraw/zinc/56/03/47/969560347.db2.gz IEAXTVHUPWYZEB-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC[C@@H]2c2ncccn2)[nH]1 ZINC001209576919 969561108 /nfs/dbraw/zinc/56/11/08/969561108.db2.gz IEAXTVHUPWYZEB-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc(C[N@H+]2CCC[C@@H]2c2ncccn2)[nH]1 ZINC001209576919 969561111 /nfs/dbraw/zinc/56/11/11/969561111.db2.gz IEAXTVHUPWYZEB-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccnc(CCNc2cc[nH+]c(C)n2)c1 ZINC001169318631 969566369 /nfs/dbraw/zinc/56/63/69/969566369.db2.gz RELWBJSNVHVCMA-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO COc1cc(C[N@H+](C)Cc2cncs2)ccn1 ZINC001209644490 969569391 /nfs/dbraw/zinc/56/93/91/969569391.db2.gz ZUXIKVGWWQAMTH-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2cncs2)ccn1 ZINC001209644490 969569394 /nfs/dbraw/zinc/56/93/94/969569394.db2.gz ZUXIKVGWWQAMTH-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1cc(C[N@@H+]2CCCC[C@@H]2C(C)=O)ccn1 ZINC001209640566 969571181 /nfs/dbraw/zinc/57/11/81/969571181.db2.gz GRMKVESYAUGGJZ-CYBMUJFWSA-N 1 2 248.326 2.034 20 0 BEADLO COc1cc(C[N@H+]2CCCC[C@@H]2C(C)=O)ccn1 ZINC001209640566 969571185 /nfs/dbraw/zinc/57/11/85/969571185.db2.gz GRMKVESYAUGGJZ-CYBMUJFWSA-N 1 2 248.326 2.034 20 0 BEADLO C[C@H]1CC(=O)CC[N@@H+]1Cc1ccccc1N(C)C ZINC001209773933 969611541 /nfs/dbraw/zinc/61/15/41/969611541.db2.gz XEWOMYMFOJUDBX-LBPRGKRZSA-N 1 2 246.354 2.306 20 0 BEADLO C[C@H]1CC(=O)CC[N@H+]1Cc1ccccc1N(C)C ZINC001209773933 969611545 /nfs/dbraw/zinc/61/15/45/969611545.db2.gz XEWOMYMFOJUDBX-LBPRGKRZSA-N 1 2 246.354 2.306 20 0 BEADLO Oc1cccnc1Nc1ccc2[nH]c[nH+]c2c1 ZINC001209842425 969655732 /nfs/dbraw/zinc/65/57/32/969655732.db2.gz JOGVGRIISMTVPJ-UHFFFAOYSA-N 1 2 226.239 2.407 20 0 BEADLO C[NH+](C)Cc1nnc([C@@H]2C[C@@H]2c2ccccc2)o1 ZINC001254501735 969665491 /nfs/dbraw/zinc/66/54/91/969665491.db2.gz FKXWFAJPZUIMPS-VXGBXAGGSA-N 1 2 243.310 2.402 20 0 BEADLO CCOc1cc[nH+]cc1Nc1ccnnc1 ZINC001209957900 969714879 /nfs/dbraw/zinc/71/48/79/969714879.db2.gz WGSDVDFVCKFBGI-UHFFFAOYSA-N 1 2 216.244 2.014 20 0 BEADLO Cc1cc(-n2cccc2N)ccc1[NH+](C)C ZINC001210043681 969774310 /nfs/dbraw/zinc/77/43/10/969774310.db2.gz YKUHNVRNHIRFBB-UHFFFAOYSA-N 1 2 215.300 2.434 20 0 BEADLO Cc1nc(C)c(C[NH2+]Cc2cc(C)ccn2)o1 ZINC000723613862 969786939 /nfs/dbraw/zinc/78/69/39/969786939.db2.gz IZTRMYJYKVOKBH-UHFFFAOYSA-N 1 2 231.299 2.285 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1oc(C)nc1C ZINC000723623157 969791346 /nfs/dbraw/zinc/79/13/46/969791346.db2.gz IRJRPAWNHBWNLV-LBPRGKRZSA-N 1 2 236.315 2.235 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@H+]1Cc1oc(C)nc1C ZINC000723623157 969791351 /nfs/dbraw/zinc/79/13/51/969791351.db2.gz IRJRPAWNHBWNLV-LBPRGKRZSA-N 1 2 236.315 2.235 20 0 BEADLO O=C1C[C@H]2C[C@H]([N@@H+]3CCCC(F)(F)C3)C[C@H]2C1 ZINC001254946430 969833141 /nfs/dbraw/zinc/83/31/41/969833141.db2.gz NVAJFSGMLMFKLW-URLYPYJESA-N 1 2 243.297 2.475 20 0 BEADLO O=C1C[C@H]2C[C@H]([N@H+]3CCCC(F)(F)C3)C[C@H]2C1 ZINC001254946430 969833144 /nfs/dbraw/zinc/83/31/44/969833144.db2.gz NVAJFSGMLMFKLW-URLYPYJESA-N 1 2 243.297 2.475 20 0 BEADLO O=c1[nH]cncc1Nc1cccc2cc[nH+]cc21 ZINC001210224506 969838152 /nfs/dbraw/zinc/83/81/52/969838152.db2.gz QKRGMHVEAUKVHE-UHFFFAOYSA-N 1 2 238.250 2.474 20 0 BEADLO COCc1cc[nH+]c(NC[C@H]2CCCCO2)c1 ZINC001156370871 969838316 /nfs/dbraw/zinc/83/83/16/969838316.db2.gz AQIYXFZAHPEWDJ-GFCCVEGCSA-N 1 2 236.315 2.209 20 0 BEADLO CO[C@@H](C)CNc1ccc(-n2cccc2)c[nH+]1 ZINC001169773450 969846198 /nfs/dbraw/zinc/84/61/98/969846198.db2.gz SBGVLYSLPLZLAH-NSHDSACASA-N 1 2 231.299 2.319 20 0 BEADLO Cc1nc(NC[C@@H]2CCCCO2)c2c([nH+]1)CCC2 ZINC001156377685 969847872 /nfs/dbraw/zinc/84/78/72/969847872.db2.gz PBLIHZVQHMLGTJ-NSHDSACASA-N 1 2 247.342 2.255 20 0 BEADLO COc1c[nH+]c(NC[C@H](C)OC)c2[nH]ccc21 ZINC001169772483 969848076 /nfs/dbraw/zinc/84/80/76/969848076.db2.gz KFDCOIRUNVORCI-QMMMGPOBSA-N 1 2 235.287 2.018 20 0 BEADLO Cc1[nH+]cc(Nc2nccs2)cc1N ZINC001210285210 969852284 /nfs/dbraw/zinc/85/22/84/969852284.db2.gz MFBSXHIRHRXPMO-UHFFFAOYSA-N 1 2 206.274 2.172 20 0 BEADLO Cc1[nH+]cc(Nc2cnncc2Cl)cc1N ZINC001210286877 969855208 /nfs/dbraw/zinc/85/52/08/969855208.db2.gz FEXOIBZVXPCFSI-UHFFFAOYSA-N 1 2 235.678 2.159 20 0 BEADLO Cc1[nH+]cc(Nc2cc([C@H](C)O)ccn2)cc1N ZINC001210288011 969855666 /nfs/dbraw/zinc/85/56/66/969855666.db2.gz GYZLMRKIKALOQN-VIFPVBQESA-N 1 2 244.298 2.164 20 0 BEADLO Cc1[nH+]cc(Nc2ccc(O)cc2O)cc1N ZINC001210288683 969856042 /nfs/dbraw/zinc/85/60/42/969856042.db2.gz SEPRHRFJSDKTHH-UHFFFAOYSA-N 1 2 231.255 2.127 20 0 BEADLO Cc1[nH+]cc(Nc2ccc(CO)cc2F)cc1N ZINC001210288655 969856143 /nfs/dbraw/zinc/85/61/43/969856143.db2.gz UZTHMTMTIIKVCV-UHFFFAOYSA-N 1 2 247.273 2.347 20 0 BEADLO Cc1[nH+]cc(Nc2cc3ccccn3n2)cc1N ZINC001210288085 969856280 /nfs/dbraw/zinc/85/62/80/969856280.db2.gz KKCMONPVIGYGAC-UHFFFAOYSA-N 1 2 239.282 2.364 20 0 BEADLO Cc1[nH+]cc(N(C)c2ccccc2N)cc1N ZINC001210288966 969856507 /nfs/dbraw/zinc/85/65/07/969856507.db2.gz ZJSQUSWMKKZZMP-UHFFFAOYSA-N 1 2 228.299 2.322 20 0 BEADLO COc1ccc(N)c(Nc2c[nH+]c(C)c(N)c2)c1 ZINC001210288219 969856862 /nfs/dbraw/zinc/85/68/62/969856862.db2.gz NXIJKFWZRWSNGQ-UHFFFAOYSA-N 1 2 244.298 2.307 20 0 BEADLO Cc1[nH+]cc(Nc2cnsc2)cc1N ZINC001210288222 969857395 /nfs/dbraw/zinc/85/73/95/969857395.db2.gz DRVVAKUHVKACHI-UHFFFAOYSA-N 1 2 206.274 2.172 20 0 BEADLO CSc1cc(Nc2c[nH+]c(C)c(N)c2)nn1C ZINC001210288194 969857843 /nfs/dbraw/zinc/85/78/43/969857843.db2.gz CZWGAOKETXJEBF-UHFFFAOYSA-N 1 2 249.343 2.171 20 0 BEADLO Cc1[nH+]cc(Nc2nc(F)ccc2F)cc1N ZINC001210289135 969857949 /nfs/dbraw/zinc/85/79/49/969857949.db2.gz WAFDCVJYWQPMHK-UHFFFAOYSA-N 1 2 236.225 2.389 20 0 BEADLO Cc1cc(Nc2c[nH+]c(C)c(N)c2)n(CCF)n1 ZINC001210288429 969858057 /nfs/dbraw/zinc/85/80/57/969858057.db2.gz IJWVHAGIUABGAI-UHFFFAOYSA-N 1 2 249.293 2.190 20 0 BEADLO Cc1[nH+]cc(Nc2cc(F)ccc2CO)cc1N ZINC001210289374 969858106 /nfs/dbraw/zinc/85/81/06/969858106.db2.gz IRVWGVOOXLRMIF-UHFFFAOYSA-N 1 2 247.273 2.347 20 0 BEADLO Cc1[nH+]cc(N(C)c2cccc(N)c2)cc1N ZINC001210293214 969859528 /nfs/dbraw/zinc/85/95/28/969859528.db2.gz GRDZHWYIOCYIST-UHFFFAOYSA-N 1 2 228.299 2.322 20 0 BEADLO Cc1[nH+]cc(N2CCc3c2cccc3N)cc1N ZINC001210293244 969860687 /nfs/dbraw/zinc/86/06/87/969860687.db2.gz IHEVDFGOTQXKOQ-UHFFFAOYSA-N 1 2 240.310 2.249 20 0 BEADLO Cn1ccc(Nc2ccccc2-n2cc[nH+]c2)n1 ZINC001210350817 969875729 /nfs/dbraw/zinc/87/57/29/969875729.db2.gz FCSIAWLPSYBKJJ-UHFFFAOYSA-N 1 2 239.282 2.349 20 0 BEADLO Cc1cc(C)c(Nc2cncc(N)c2)c[nH+]1 ZINC001210437460 969887187 /nfs/dbraw/zinc/88/71/87/969887187.db2.gz INUYCBKJNVVJLF-UHFFFAOYSA-N 1 2 214.272 2.419 20 0 BEADLO COc1c[nH+]c(NCC(C)(C)OC)c(C)c1 ZINC001156439120 969894535 /nfs/dbraw/zinc/89/45/35/969894535.db2.gz MITVETHWKCYVGZ-UHFFFAOYSA-N 1 2 224.304 2.236 20 0 BEADLO COc1ncc(/C(C)=C/C=C/[NH3+])cc1C ZINC001242433476 969929572 /nfs/dbraw/zinc/92/95/72/969929572.db2.gz FTJKNXXOHDVAAE-REZHQCRGSA-N 1 2 204.273 2.274 20 0 BEADLO C1CC(c2nnc([C@H]3CC4CC[NH+]3CC4)o2)C1 ZINC001255150884 969956885 /nfs/dbraw/zinc/95/68/85/969956885.db2.gz UMVKMOYOMFTBQY-LLVKDONJSA-N 1 2 233.315 2.494 20 0 BEADLO COc1cc(Nc2c[nH]c(=O)c(F)c2)cc(C)[nH+]1 ZINC001210599697 969972639 /nfs/dbraw/zinc/97/26/39/969972639.db2.gz NPFYEWTVXFCWAX-UHFFFAOYSA-N 1 2 249.245 2.382 20 0 BEADLO Cc1nc(NCc2cc[nH+]c(N)c2)ccc1F ZINC001156756000 969992807 /nfs/dbraw/zinc/99/28/07/969992807.db2.gz NDEATOHSENUERV-UHFFFAOYSA-N 1 2 232.262 2.118 20 0 BEADLO Nc1cc(-c2cncc(N3CCCC3)c2)cc[nH+]1 ZINC001242619939 970022157 /nfs/dbraw/zinc/02/21/57/970022157.db2.gz OOQGEOXSICRVEB-UHFFFAOYSA-N 1 2 240.310 2.326 20 0 BEADLO Cc1cocc1C(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001157123740 970094869 /nfs/dbraw/zinc/09/48/69/970094869.db2.gz AADITFHWGNIDRL-UHFFFAOYSA-N 1 2 247.298 2.365 20 0 BEADLO Cc1cocc1C(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001157123740 970094882 /nfs/dbraw/zinc/09/48/82/970094882.db2.gz AADITFHWGNIDRL-UHFFFAOYSA-N 1 2 247.298 2.365 20 0 BEADLO CCCC[C@H](C)[N@@H+]1CC(F)(F)C[C@H]1CO ZINC001255323963 970104241 /nfs/dbraw/zinc/10/42/41/970104241.db2.gz XFAHYBKECLDUFE-UWVGGRQHSA-N 1 2 221.291 2.267 20 0 BEADLO CCCC[C@H](C)[N@H+]1CC(F)(F)C[C@H]1CO ZINC001255323963 970104264 /nfs/dbraw/zinc/10/42/64/970104264.db2.gz XFAHYBKECLDUFE-UWVGGRQHSA-N 1 2 221.291 2.267 20 0 BEADLO [NH3+]Cc1ccc(-c2cccc(S)c2)cn1 ZINC001242867333 970118961 /nfs/dbraw/zinc/11/89/61/970118961.db2.gz OCVXEUCBZWHQAC-UHFFFAOYSA-N 1 2 216.309 2.496 20 0 BEADLO COc1ccc(Nc2[nH+]cccc2N)c(C)n1 ZINC001211039351 970129712 /nfs/dbraw/zinc/12/97/12/970129712.db2.gz IBHFKHXDDXCZIE-UHFFFAOYSA-N 1 2 230.271 2.119 20 0 BEADLO Cc1c(CO)cccc1Nc1[nH+]cccc1N ZINC001211162190 970166076 /nfs/dbraw/zinc/16/60/76/970166076.db2.gz QRMCKXIQYGHXBG-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO OCCc1ccc[nH+]c1Nc1ccc(F)c(O)c1 ZINC001211216464 970175172 /nfs/dbraw/zinc/17/51/72/970175172.db2.gz FPHFKIDVDJNVNQ-UHFFFAOYSA-N 1 2 248.257 2.205 20 0 BEADLO CCCNc1nc(NC(C)C)c(OC)c[nH+]1 ZINC001157358151 970208450 /nfs/dbraw/zinc/20/84/50/970208450.db2.gz MMLMEQIOMPQLES-UHFFFAOYSA-N 1 2 224.308 2.127 20 0 BEADLO Cc1cc(N)n(-c2ccc(-c3[nH]cc[nH+]3)cc2)n1 ZINC001213085630 970273361 /nfs/dbraw/zinc/27/33/61/970273361.db2.gz OUJAWQTVZUYCQL-UHFFFAOYSA-N 1 2 239.282 2.153 20 0 BEADLO CC(C)c1nnc2ccc(-c3c[nH+]cn3C)cn21 ZINC001243071075 970279228 /nfs/dbraw/zinc/27/92/28/970279228.db2.gz KPFNTWSDKOICPZ-UHFFFAOYSA-N 1 2 241.298 2.253 20 0 BEADLO Cc1cc([NH2+][C@H]2CCOC[C@H]2C)ccc1N ZINC000301026094 970310456 /nfs/dbraw/zinc/31/04/56/970310456.db2.gz PKBBBVKYJVXMRM-MFKMUULPSA-N 1 2 220.316 2.414 20 0 BEADLO COc1ccc(Nc2c[nH+]c(C)cc2C)nn1 ZINC001213503581 970324703 /nfs/dbraw/zinc/32/47/03/970324703.db2.gz NHMFCTTZIRZEKR-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO Cc1[nH+]cc(C2CC2)cc1Nc1cnc(N)cn1 ZINC001213495272 970327435 /nfs/dbraw/zinc/32/74/35/970327435.db2.gz ZDQXRKGZEOUBLM-UHFFFAOYSA-N 1 2 241.298 2.383 20 0 BEADLO Cc1cc(C)c(Nc2nc(N)cnc2Cl)c[nH+]1 ZINC001213508325 970327755 /nfs/dbraw/zinc/32/77/55/970327755.db2.gz QCUDGMKBNLPBAC-UHFFFAOYSA-N 1 2 249.705 2.468 20 0 BEADLO Cc1[nH+]cc(C2CC2)cc1Nc1cnn(C)n1 ZINC001213494652 970328693 /nfs/dbraw/zinc/32/86/93/970328693.db2.gz DJMBPWSUBQJQQV-UHFFFAOYSA-N 1 2 229.287 2.140 20 0 BEADLO Cc1cnn(C)c1Nc1c[nH+]c(C)cc1C ZINC001213508636 970330872 /nfs/dbraw/zinc/33/08/72/970330872.db2.gz YABHNLRUWREARO-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO Cc1cc(C)c(Nc2cnn3c2OCCC3)c[nH+]1 ZINC001213513396 970336705 /nfs/dbraw/zinc/33/67/05/970336705.db2.gz IJABNECSLPWIQV-UHFFFAOYSA-N 1 2 244.298 2.421 20 0 BEADLO COCCn1nccc1Nc1c[nH+]cc(C)c1C ZINC001213527523 970344446 /nfs/dbraw/zinc/34/44/46/970344446.db2.gz QRFPGKVREQMVFF-UHFFFAOYSA-N 1 2 246.314 2.285 20 0 BEADLO Cc1c[nH+]cc(Nc2cnc3ccnn3c2)c1C ZINC001213525326 970345610 /nfs/dbraw/zinc/34/56/10/970345610.db2.gz RKGIIZFOPYBWGF-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cc1c[nH+]cc(Nc2cc3n(n2)CCO3)c1C ZINC001213529067 970354841 /nfs/dbraw/zinc/35/48/41/970354841.db2.gz UVCZLYQIYFVJMT-UHFFFAOYSA-N 1 2 230.271 2.031 20 0 BEADLO Cc1ccc(C[C@H](C)[NH2+]CC(F)(F)CO)cc1 ZINC001255781249 970486105 /nfs/dbraw/zinc/48/61/05/970486105.db2.gz YNLZOWOTPNPRLS-NSHDSACASA-N 1 2 243.297 2.143 20 0 BEADLO Nc1[nH+]cccc1-c1ccncc1Cl ZINC001243384776 970523066 /nfs/dbraw/zinc/52/30/66/970523066.db2.gz LCOXQBYHVDGNBV-UHFFFAOYSA-N 1 2 205.648 2.379 20 0 BEADLO CCCCCc1nnc([C@H](C)[NH+](C)C)o1 ZINC001256093814 970654419 /nfs/dbraw/zinc/65/44/19/970654419.db2.gz SKQGADUFIKUWSV-VIFPVBQESA-N 1 2 211.309 2.425 20 0 BEADLO C[C@@H](Cc1ccccc1)c1nnc(C[NH+](C)C)o1 ZINC001327355077 972559487 /nfs/dbraw/zinc/55/94/87/972559487.db2.gz RWJWIYYNFIASMY-NSHDSACASA-N 1 2 245.326 2.477 20 0 BEADLO Cc1c(O)cccc1C[N@@H+]1CCC(=O)[C@@H](C)C1 ZINC001144108009 972573638 /nfs/dbraw/zinc/57/36/38/972573638.db2.gz RTMALBAAKYFMAR-JTQLQIEISA-N 1 2 233.311 2.112 20 0 BEADLO Cc1c(O)cccc1C[N@H+]1CCC(=O)[C@@H](C)C1 ZINC001144108009 972573641 /nfs/dbraw/zinc/57/36/41/972573641.db2.gz RTMALBAAKYFMAR-JTQLQIEISA-N 1 2 233.311 2.112 20 0 BEADLO CCCOC1C[NH+](Cc2cccc(O)c2C)C1 ZINC001144118684 972592303 /nfs/dbraw/zinc/59/23/03/972592303.db2.gz GEJRNZUNBKAKMV-UHFFFAOYSA-N 1 2 235.327 2.311 20 0 BEADLO C[C@@H](OCc1c[nH+]cn1C)c1ccccn1 ZINC001222595033 972594008 /nfs/dbraw/zinc/59/40/08/972594008.db2.gz MEGYFMYRTCTYBV-SNVBAGLBSA-N 1 2 217.272 2.093 20 0 BEADLO CO[C@@H](COCc1c[nH+]cn1C)c1ccccc1 ZINC001222594558 972594121 /nfs/dbraw/zinc/59/41/21/972594121.db2.gz GORQKJUMFZCTBM-AWEZNQCLSA-N 1 2 246.310 2.324 20 0 BEADLO C[C@H](Cc1ccco1)OCc1c[nH+]cn1C ZINC001222599776 972596707 /nfs/dbraw/zinc/59/67/07/972596707.db2.gz FPAJYPJOZGVZDO-SNVBAGLBSA-N 1 2 220.272 2.161 20 0 BEADLO Cn1c[nH+]cc1CO[C@H]1CCc2ccccc2C1 ZINC001222600581 972597233 /nfs/dbraw/zinc/59/72/33/972597233.db2.gz QRKUHJJRCOBQFO-HNNXBMFYSA-N 1 2 242.322 2.494 20 0 BEADLO C[C@@H](OCc1c[nH+]cn1C)c1nccs1 ZINC001222599433 972598233 /nfs/dbraw/zinc/59/82/33/972598233.db2.gz AYZXMKVWQNUEMJ-MRVPVSSYSA-N 1 2 223.301 2.154 20 0 BEADLO C[C@@H](OCc1c[nH+]cn1C)c1ncccc1F ZINC001222600087 972598627 /nfs/dbraw/zinc/59/86/27/972598627.db2.gz IHZVBBVPPMNNNB-SECBINFHSA-N 1 2 235.262 2.232 20 0 BEADLO CCC[C@@H]1CCCC[C@H]1[NH2+]Cc1ncn[nH]1 ZINC001327554328 972633907 /nfs/dbraw/zinc/63/39/07/972633907.db2.gz NTXLBSOGEMFHDJ-GHMZBOCLSA-N 1 2 222.336 2.253 20 0 BEADLO Cc1cc(C[N@@H+]2CC3(CCC3)[C@H]2C2CC2)n[nH]1 ZINC001327573700 972650015 /nfs/dbraw/zinc/65/00/15/972650015.db2.gz TXASZUNWWLZCAS-CYBMUJFWSA-N 1 2 231.343 2.483 20 0 BEADLO Cc1cc(C[N@H+]2CC3(CCC3)[C@H]2C2CC2)n[nH]1 ZINC001327573700 972650019 /nfs/dbraw/zinc/65/00/19/972650019.db2.gz TXASZUNWWLZCAS-CYBMUJFWSA-N 1 2 231.343 2.483 20 0 BEADLO CC(C)[NH+]1CC(OCc2nc3ccccc3o2)C1 ZINC001222913656 972744305 /nfs/dbraw/zinc/74/43/05/972744305.db2.gz UJLRUXGBPCZZFS-UHFFFAOYSA-N 1 2 246.310 2.437 20 0 BEADLO C[C@H](Cc1ccccc1)c1nnc(C[NH+](C)C)o1 ZINC001327866226 972769523 /nfs/dbraw/zinc/76/95/23/972769523.db2.gz RWJWIYYNFIASMY-LLVKDONJSA-N 1 2 245.326 2.477 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nnc[nH]2)[C@@H]2CCCC[C@@H]12 ZINC001327866408 972770401 /nfs/dbraw/zinc/77/04/01/972770401.db2.gz XBKXNKGYSSAKBK-GRYCIOLGSA-N 1 2 234.347 2.205 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nnc[nH]2)[C@@H]2CCCC[C@@H]12 ZINC001327866408 972770414 /nfs/dbraw/zinc/77/04/14/972770414.db2.gz XBKXNKGYSSAKBK-GRYCIOLGSA-N 1 2 234.347 2.205 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nc[nH]n2)[C@@H]2CCCC[C@@H]12 ZINC001327866408 972770426 /nfs/dbraw/zinc/77/04/26/972770426.db2.gz XBKXNKGYSSAKBK-GRYCIOLGSA-N 1 2 234.347 2.205 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nc[nH]n2)[C@@H]2CCCC[C@@H]12 ZINC001327866408 972770432 /nfs/dbraw/zinc/77/04/32/972770432.db2.gz XBKXNKGYSSAKBK-GRYCIOLGSA-N 1 2 234.347 2.205 20 0 BEADLO FC(F)(F)c1ncccc1C[NH+]1CCC1 ZINC001144520150 972853283 /nfs/dbraw/zinc/85/32/83/972853283.db2.gz HPVMWHXBQAHJRC-UHFFFAOYSA-N 1 2 216.206 2.306 20 0 BEADLO O=C(O[C@H]1CCc2[nH+]ccn2C1)c1ccccc1 ZINC001223149880 972855673 /nfs/dbraw/zinc/85/56/73/972855673.db2.gz UKAHVXTVOIOFMN-LBPRGKRZSA-N 1 2 242.278 2.055 20 0 BEADLO C=Cc1ccc(COC2C[NH+](C)C2)cc1 ZINC001223148192 972856477 /nfs/dbraw/zinc/85/64/77/972856477.db2.gz CDKIAPLHVCNIAP-UHFFFAOYSA-N 1 2 203.285 2.160 20 0 BEADLO C[C@@H](C(=O)N[C@H]1CC[C@@H](C)C[C@H]1C)n1cc[nH+]c1 ZINC001328074861 972867180 /nfs/dbraw/zinc/86/71/80/972867180.db2.gz FHFDMTZPFAXPAT-NDBYEHHHSA-N 1 2 249.358 2.385 20 0 BEADLO F[C@H]1C[C@@H]2C[C@H]1CN2Cc1[nH+]cn2ccccc12 ZINC001144625844 972892042 /nfs/dbraw/zinc/89/20/42/972892042.db2.gz WKVKGLVIELBFRP-SRVKXCTJSA-N 1 2 245.301 2.267 20 0 BEADLO CC1CCC([N@H+](Cc2nnc[nH]2)C2CC2)CC1 ZINC001328380301 973001169 /nfs/dbraw/zinc/00/11/69/973001169.db2.gz ATNIMSNQACNHCO-UHFFFAOYSA-N 1 2 234.347 2.348 20 0 BEADLO CC1CCC([N@@H+](Cc2nnc[nH]2)C2CC2)CC1 ZINC001328380301 973001180 /nfs/dbraw/zinc/00/11/80/973001180.db2.gz ATNIMSNQACNHCO-UHFFFAOYSA-N 1 2 234.347 2.348 20 0 BEADLO Cc1nnc(C[NH2+][C@@H](C)c2ccccc2F)n1C ZINC000042337919 973023377 /nfs/dbraw/zinc/02/33/77/973023377.db2.gz RRAOQPXIFBYIPT-VIFPVBQESA-N 1 2 248.305 2.113 20 0 BEADLO Cc1cc(COC[C@@H]2CCCO2)cc(C)[nH+]1 ZINC001223420062 973054387 /nfs/dbraw/zinc/05/43/87/973054387.db2.gz HIIJFTZREUSGEA-ZDUSSCGKSA-N 1 2 221.300 2.394 20 0 BEADLO CO[C@H](C)COCc1cc(C)[nH+]c(C)c1 ZINC001223421154 973055390 /nfs/dbraw/zinc/05/53/90/973055390.db2.gz NTPCNQJMVLQZRP-LLVKDONJSA-N 1 2 209.289 2.250 20 0 BEADLO CC[C@@H](OCc1cc(C)[nH+]c(C)c1)C(=O)OC ZINC001223424330 973067032 /nfs/dbraw/zinc/06/70/32/973067032.db2.gz KOKIGSASIWRAGJ-GFCCVEGCSA-N 1 2 237.299 2.167 20 0 BEADLO C[NH+]1CC(OCc2ccc3cnccc3c2)C1 ZINC001223931038 973335456 /nfs/dbraw/zinc/33/54/56/973335456.db2.gz FCOLXBAJIRCOMV-UHFFFAOYSA-N 1 2 228.295 2.065 20 0 BEADLO C[C@H](OC1C[NH+](C)C1)c1ccc(F)cc1 ZINC001224007157 973402000 /nfs/dbraw/zinc/40/20/00/973402000.db2.gz QZRSGWTVTSZOGJ-VIFPVBQESA-N 1 2 209.264 2.217 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)NOC(C)(C)C)ccn12 ZINC001329088782 973471024 /nfs/dbraw/zinc/47/10/24/973471024.db2.gz IWFSNJBBDWPOGN-UHFFFAOYSA-N 1 2 247.298 2.103 20 0 BEADLO Cc1ccc([C@H](C)c2nnc(C[NH+](C)C)o2)o1 ZINC001329269676 973623146 /nfs/dbraw/zinc/62/31/46/973623146.db2.gz HDTJTXUCOIENKW-VIFPVBQESA-N 1 2 235.287 2.184 20 0 BEADLO C[C@@H](C(=O)N(C)CCC(C)(C)C)n1cc[nH+]c1 ZINC001329547830 973822986 /nfs/dbraw/zinc/82/29/86/973822986.db2.gz OFPZZLHQWMBBHE-NSHDSACASA-N 1 2 237.347 2.339 20 0 BEADLO CC(C)OC(=O)C[N@@H+]1CCC[C@]2(CC2(F)F)C1 ZINC001329597478 973845829 /nfs/dbraw/zinc/84/58/29/973845829.db2.gz RHDNKTOZWIQPKK-NSHDSACASA-N 1 2 247.285 2.059 20 0 BEADLO CC(C)OC(=O)C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC001329597478 973845834 /nfs/dbraw/zinc/84/58/34/973845834.db2.gz RHDNKTOZWIQPKK-NSHDSACASA-N 1 2 247.285 2.059 20 0 BEADLO C[C@H]1C[C@H](C)CN(c2cc(N(C)C)[nH+]cn2)C1 ZINC000585414999 973910517 /nfs/dbraw/zinc/91/05/17/973910517.db2.gz GWZWTNOQYREQDX-QWRGUYRKSA-N 1 2 234.347 2.025 20 0 BEADLO C[C@H]1C[C@H](C)CN(c2cc(N(C)C)nc[nH+]2)C1 ZINC000585414999 973910533 /nfs/dbraw/zinc/91/05/33/973910533.db2.gz GWZWTNOQYREQDX-QWRGUYRKSA-N 1 2 234.347 2.025 20 0 BEADLO Cc1oncc1C[N@@H+]1CCOc2ccccc2C1 ZINC000585381272 973910980 /nfs/dbraw/zinc/91/09/80/973910980.db2.gz IAHHYHKPYPUUER-UHFFFAOYSA-N 1 2 244.294 2.378 20 0 BEADLO Cc1oncc1C[N@H+]1CCOc2ccccc2C1 ZINC000585381272 973910999 /nfs/dbraw/zinc/91/09/99/973910999.db2.gz IAHHYHKPYPUUER-UHFFFAOYSA-N 1 2 244.294 2.378 20 0 BEADLO CN(C)c1cc(N2Cc3ccccc3C2)nc[nH+]1 ZINC000585416318 973914002 /nfs/dbraw/zinc/91/40/02/973914002.db2.gz YCZXFZYGXARGQJ-UHFFFAOYSA-N 1 2 240.310 2.063 20 0 BEADLO CN(C)c1cc(N2Cc3ccccc3C2)[nH+]cn1 ZINC000585416318 973914006 /nfs/dbraw/zinc/91/40/06/973914006.db2.gz YCZXFZYGXARGQJ-UHFFFAOYSA-N 1 2 240.310 2.063 20 0 BEADLO Cc1cc(C[NH+]2CCC(c3ncco3)CC2)no1 ZINC000585576901 973926625 /nfs/dbraw/zinc/92/66/25/973926625.db2.gz HDYOBDSHABFNIT-UHFFFAOYSA-N 1 2 247.298 2.351 20 0 BEADLO CC(C)C[C@@H](C(=O)NC1(C)CC1)n1cc[nH+]c1 ZINC001329794299 973936022 /nfs/dbraw/zinc/93/60/22/973936022.db2.gz ZTNFFKWZEILAEP-NSHDSACASA-N 1 2 235.331 2.139 20 0 BEADLO c1nnc(C[N@@H+]2CCC[C@@]3(CC=CCC3)C2)[nH]1 ZINC001329878301 973998382 /nfs/dbraw/zinc/99/83/82/973998382.db2.gz RJFBWIXGFIBKGR-ZDUSSCGKSA-N 1 2 232.331 2.127 20 0 BEADLO c1nnc(C[N@H+]2CCC[C@@]3(CC=CCC3)C2)[nH]1 ZINC001329878301 973998393 /nfs/dbraw/zinc/99/83/93/973998393.db2.gz RJFBWIXGFIBKGR-ZDUSSCGKSA-N 1 2 232.331 2.127 20 0 BEADLO Cc1ccc2[nH]c(C[NH+]3CCOCC3)cc2c1 ZINC000257866346 974189785 /nfs/dbraw/zinc/18/97/85/974189785.db2.gz GXUXLLZJTSZIPU-UHFFFAOYSA-N 1 2 230.311 2.309 20 0 BEADLO CC[C@H](C)[C@H](C)[N@@H+]1CC[C@H](O)C(F)(F)C1 ZINC001171847475 974213313 /nfs/dbraw/zinc/21/33/13/974213313.db2.gz MFRUOJLVQLRPLN-GUBZILKMSA-N 1 2 221.291 2.123 20 0 BEADLO CC[C@H](C)[C@H](C)[N@H+]1CC[C@H](O)C(F)(F)C1 ZINC001171847475 974213325 /nfs/dbraw/zinc/21/33/25/974213325.db2.gz MFRUOJLVQLRPLN-GUBZILKMSA-N 1 2 221.291 2.123 20 0 BEADLO COC(=O)[C@H]1CCC[C@@H](Oc2cc[nH+]cc2)C1 ZINC001225295330 974369503 /nfs/dbraw/zinc/36/95/03/974369503.db2.gz KRDHEBHMYBHFHP-CMPLNLGQSA-N 1 2 235.283 2.192 20 0 BEADLO c1ccc2c(c1)C[C@H]([NH+]1CC3(CCO3)C1)CS2 ZINC001172207031 974435108 /nfs/dbraw/zinc/43/51/08/974435108.db2.gz VPZSGLGMZICEMA-LBPRGKRZSA-N 1 2 247.363 2.178 20 0 BEADLO c1ccc2c(c1)C[C@H]([N@@H+]1CCO[C@H]3C[C@H]31)CS2 ZINC001172208882 974440185 /nfs/dbraw/zinc/44/01/85/974440185.db2.gz LXBYTICJFVZUSM-XQQFMLRXSA-N 1 2 247.363 2.177 20 0 BEADLO c1ccc2c(c1)C[C@H]([N@H+]1CCO[C@H]3C[C@H]31)CS2 ZINC001172208882 974440196 /nfs/dbraw/zinc/44/01/96/974440196.db2.gz LXBYTICJFVZUSM-XQQFMLRXSA-N 1 2 247.363 2.177 20 0 BEADLO CCc1ncccc1OC1C[NH+](C(C)C)C1 ZINC001225454431 974502663 /nfs/dbraw/zinc/50/26/63/974502663.db2.gz WYJDYNVXHBYWBV-UHFFFAOYSA-N 1 2 220.316 2.115 20 0 BEADLO C[NH+](C)Cc1nnc([C@@H]2C[C@H]2c2ccsc2)o1 ZINC001335383548 1169979225 /nfs/dbraw/zinc/97/92/25/1169979225.db2.gz TUAOCXZOYUUGEM-VHSXEESVSA-N 1 2 249.339 2.464 20 0 BEADLO CCCOC(=O)C[NH2+][C@H](C)CCO[C@@H](C)CC ZINC001172353811 974624094 /nfs/dbraw/zinc/62/40/94/974624094.db2.gz YDXXHTVSRMQXOO-NEPJUHHUSA-N 1 2 245.363 2.123 20 0 BEADLO Cc1cc[nH+]c(N)c1CN(C)Cc1nccs1 ZINC001331532423 974751144 /nfs/dbraw/zinc/75/11/44/974751144.db2.gz WFAYFXPPTOOQEC-UHFFFAOYSA-N 1 2 248.355 2.061 20 0 BEADLO CC(C)OCC[C@H](C)[N@@H+]1CCC[C@@H](F)C(=O)C1 ZINC001172444683 974804415 /nfs/dbraw/zinc/80/44/15/974804415.db2.gz VFDYNEHAKUWRRS-NWDGAFQWSA-N 1 2 245.338 2.193 20 0 BEADLO CC(C)OCC[C@H](C)[N@H+]1CCC[C@@H](F)C(=O)C1 ZINC001172444683 974804416 /nfs/dbraw/zinc/80/44/16/974804416.db2.gz VFDYNEHAKUWRRS-NWDGAFQWSA-N 1 2 245.338 2.193 20 0 BEADLO CC(C)OCC[C@@H](C)[N@@H+]1CCCC(=O)[C@@H](F)C1 ZINC001172445243 974807731 /nfs/dbraw/zinc/80/77/31/974807731.db2.gz XVJDCRSTCWIZSF-NEPJUHHUSA-N 1 2 245.338 2.193 20 0 BEADLO CC(C)OCC[C@@H](C)[N@H+]1CCCC(=O)[C@@H](F)C1 ZINC001172445243 974807735 /nfs/dbraw/zinc/80/77/35/974807735.db2.gz XVJDCRSTCWIZSF-NEPJUHHUSA-N 1 2 245.338 2.193 20 0 BEADLO Cc1cc(OCCCc2cncn2C)cc[nH+]1 ZINC001331951995 974884650 /nfs/dbraw/zinc/88/46/50/974884650.db2.gz JXSRFVFYOSQUBW-UHFFFAOYSA-N 1 2 231.299 2.135 20 0 BEADLO Cc1cc(OCCCc2c[nH+]cn2C)ccn1 ZINC001331951995 974884653 /nfs/dbraw/zinc/88/46/53/974884653.db2.gz JXSRFVFYOSQUBW-UHFFFAOYSA-N 1 2 231.299 2.135 20 0 BEADLO CCc1nn(C[N@H+](C)CC(C)C)c(=S)o1 ZINC001332122718 974961577 /nfs/dbraw/zinc/96/15/77/974961577.db2.gz LNBBZLFXZIHDPG-UHFFFAOYSA-N 1 2 229.349 2.313 20 0 BEADLO CCc1nn(C[N@@H+](C)CC(C)C)c(=S)o1 ZINC001332122718 974961584 /nfs/dbraw/zinc/96/15/84/974961584.db2.gz LNBBZLFXZIHDPG-UHFFFAOYSA-N 1 2 229.349 2.313 20 0 BEADLO C=C/C=C/CCOC(=O)CCc1ccc(N)[nH+]c1 ZINC001332216190 975008347 /nfs/dbraw/zinc/00/83/47/975008347.db2.gz MZMBHSIHGJZPPW-ONEGZZNKSA-N 1 2 246.310 2.272 20 0 BEADLO CC[C@@H]1CC[C@H](N2CC[NH2+]CC(F)(F)C2)C1 ZINC001173272931 975152230 /nfs/dbraw/zinc/15/22/30/975152230.db2.gz LKLFJBICKDGKDV-MNOVXSKESA-N 1 2 232.318 2.106 20 0 BEADLO CC[C@H]1CC[C@@H]([N@H+](C)Cc2noc(C)n2)C1 ZINC001173273769 975155690 /nfs/dbraw/zinc/15/56/90/975155690.db2.gz OPLRBNXSVLCQEY-WDEREUQCSA-N 1 2 223.320 2.389 20 0 BEADLO CC[C@H]1CC[C@@H]([N@@H+](C)Cc2noc(C)n2)C1 ZINC001173273769 975155698 /nfs/dbraw/zinc/15/56/98/975155698.db2.gz OPLRBNXSVLCQEY-WDEREUQCSA-N 1 2 223.320 2.389 20 0 BEADLO CCCCOC(=O)[C@H](C)[NH2+][C@@H](C)CSCC ZINC001173286604 975248208 /nfs/dbraw/zinc/24/82/08/975248208.db2.gz BWNJYPFJDNLXCY-QWRGUYRKSA-N 1 2 247.404 2.449 20 0 BEADLO Cc1cc[nH+]c(C)c1O[C@H]1COC[C@@H]1C ZINC001227259119 975335855 /nfs/dbraw/zinc/33/58/55/975335855.db2.gz DLXRWODZEOVLBC-ONGXEEELSA-N 1 2 207.273 2.112 20 0 BEADLO CCOC(=O)[C@H]1C[C@@H](Oc2c(C)cc[nH+]c2C)C1 ZINC001227264488 975339017 /nfs/dbraw/zinc/33/90/17/975339017.db2.gz MRVOHWRWPSJNPE-TXEJJXNPSA-N 1 2 249.310 2.419 20 0 BEADLO CCOC(=O)[C@H](Oc1c(C)cc[nH+]c1C)C1CC1 ZINC001227262725 975341119 /nfs/dbraw/zinc/34/11/19/975341119.db2.gz VFLIPIZMIMFERC-CYBMUJFWSA-N 1 2 249.310 2.419 20 0 BEADLO COC(=O)[C@H]1C[C@H](Oc2c(C)cc[nH+]c2C)C1 ZINC001227266183 975342050 /nfs/dbraw/zinc/34/20/50/975342050.db2.gz XRHUVYXGKDDRPS-XYPYZODXSA-N 1 2 235.283 2.029 20 0 BEADLO C[NH+]1CC(Oc2ccc(O)cc2C(C)(C)C)C1 ZINC001227445221 975420720 /nfs/dbraw/zinc/42/07/20/975420720.db2.gz NFBROPFGTCCUNW-UHFFFAOYSA-N 1 2 235.327 2.383 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1c1nnc(C[NH+](C)C)o1 ZINC001333123104 975464794 /nfs/dbraw/zinc/46/47/94/975464794.db2.gz XQNIWBPSGQFKMT-NXEZZACHSA-N 1 2 223.320 2.281 20 0 BEADLO Cc1cc(CO)cc(Nc2[nH+]cccc2N)c1 ZINC001212751436 975521661 /nfs/dbraw/zinc/52/16/61/975521661.db2.gz GZVNJEJUUDFOSE-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO CC(C)c1ocnc1C[N@@H+]1CCO[C@@H](C)CC1 ZINC001333304229 975633260 /nfs/dbraw/zinc/63/32/60/975633260.db2.gz MBLRPKXXPRSWED-NSHDSACASA-N 1 2 238.331 2.409 20 0 BEADLO CC(C)c1ocnc1C[N@H+]1CCO[C@@H](C)CC1 ZINC001333304229 975633275 /nfs/dbraw/zinc/63/32/75/975633275.db2.gz MBLRPKXXPRSWED-NSHDSACASA-N 1 2 238.331 2.409 20 0 BEADLO c1n[nH]c(C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)n1 ZINC001333437771 975769839 /nfs/dbraw/zinc/76/98/39/975769839.db2.gz DLUUYSUBEJQBBD-CHWSQXEVSA-N 1 2 242.326 2.231 20 0 BEADLO CNc1cc(N[C@H]2CCOC3(CCC3)C2)[nH+]cn1 ZINC001333670111 975958558 /nfs/dbraw/zinc/95/85/58/975958558.db2.gz DLVVCTYNTWHADW-JTQLQIEISA-N 1 2 248.330 2.032 20 0 BEADLO CCC(=O)Nc1nc(C[NH+](CC)CC)cs1 ZINC001333814868 976102508 /nfs/dbraw/zinc/10/25/08/976102508.db2.gz AONFOSKZZCNIAZ-UHFFFAOYSA-N 1 2 241.360 2.333 20 0 BEADLO CC(=O)[C@@H](C)Oc1ccc2[nH]c(C)[nH+]c2c1 ZINC001228326104 976119331 /nfs/dbraw/zinc/11/93/31/976119331.db2.gz FLGYFFBBVMGBFD-MRVPVSSYSA-N 1 2 218.256 2.228 20 0 BEADLO Cc1[nH]c2ccc(OC[C@H]3CCO3)cc2[nH+]1 ZINC001228327979 976119761 /nfs/dbraw/zinc/11/97/61/976119761.db2.gz YORMCJCQGHSTBJ-SNVBAGLBSA-N 1 2 218.256 2.039 20 0 BEADLO Cc1cccc(Nc2cccc(C(N)=O)c2)[nH+]1 ZINC001174056316 976207469 /nfs/dbraw/zinc/20/74/69/976207469.db2.gz FLZYRPOAXQRLBB-UHFFFAOYSA-N 1 2 227.267 2.233 20 0 BEADLO Cc1cc(F)ncc1OC1C[NH+](C(C)C)C1 ZINC001228589483 976361240 /nfs/dbraw/zinc/36/12/40/976361240.db2.gz IMWAGHHAAVWVHJ-UHFFFAOYSA-N 1 2 224.279 2.001 20 0 BEADLO C[C@@H]1CCN(c2cc(N(C)C)[nH+]cn2)[C@H](C)C1 ZINC001334271739 976415713 /nfs/dbraw/zinc/41/57/13/976415713.db2.gz QOKJOBMRCSXNDE-GHMZBOCLSA-N 1 2 234.347 2.167 20 0 BEADLO C[C@@H]1CCN(c2cc(N(C)C)nc[nH+]2)[C@H](C)C1 ZINC001334271739 976415724 /nfs/dbraw/zinc/41/57/24/976415724.db2.gz QOKJOBMRCSXNDE-GHMZBOCLSA-N 1 2 234.347 2.167 20 0 BEADLO C[N@@H+]1CCO[C@@H](COc2ccc3ccoc3c2)C1 ZINC001228727995 976461815 /nfs/dbraw/zinc/46/18/15/976461815.db2.gz SYCQJUMPSKFTLA-CYBMUJFWSA-N 1 2 247.294 2.142 20 0 BEADLO C[N@H+]1CCO[C@@H](COc2ccc3ccoc3c2)C1 ZINC001228727995 976461825 /nfs/dbraw/zinc/46/18/25/976461825.db2.gz SYCQJUMPSKFTLA-CYBMUJFWSA-N 1 2 247.294 2.142 20 0 BEADLO COc1cc(Nc2cccn3cc[nH+]c23)ccn1 ZINC001174303014 976490988 /nfs/dbraw/zinc/49/09/88/976490988.db2.gz DLHCUTHNEYDUFD-UHFFFAOYSA-N 1 2 240.266 2.482 20 0 BEADLO Cc1cn2cccc(Nc3cnn(C)c3)c2[nH+]1 ZINC001174327841 976524572 /nfs/dbraw/zinc/52/45/72/976524572.db2.gz CFNTXKUSEQCYGV-UHFFFAOYSA-N 1 2 227.271 2.120 20 0 BEADLO Cc1nn(C)cc1Nc1cccn2cc[nH+]c12 ZINC001174333665 976546666 /nfs/dbraw/zinc/54/66/66/976546666.db2.gz VFNONWXUITZPLQ-UHFFFAOYSA-N 1 2 227.271 2.120 20 0 BEADLO Cc1cn2cccc(Nc3cn(C)nc3C)c2[nH+]1 ZINC001174333408 976547085 /nfs/dbraw/zinc/54/70/85/976547085.db2.gz OAZWTVFHNYXQGZ-UHFFFAOYSA-N 1 2 241.298 2.428 20 0 BEADLO C[C@@H](C(=O)NC1CCC=CCC1)n1cc[nH+]c1 ZINC001334735734 976608289 /nfs/dbraw/zinc/60/82/89/976608289.db2.gz YJCMXXJYFMPDAP-NSHDSACASA-N 1 2 233.315 2.059 20 0 BEADLO Cc1ccncc1[C@@H](C)[NH2+]Cc1nncs1 ZINC001334747824 976621241 /nfs/dbraw/zinc/62/12/41/976621241.db2.gz TVPIDMYWQRGBHE-SECBINFHSA-N 1 2 234.328 2.092 20 0 BEADLO c1cn(-c2ccccc2Nc2cncnc2)c[nH+]1 ZINC001174384801 976622219 /nfs/dbraw/zinc/62/22/19/976622219.db2.gz OWXQJQJCIQQMIJ-UHFFFAOYSA-N 1 2 237.266 2.406 20 0 BEADLO Cn1c[nH+]c2cc(Nc3cncnc3)ccc21 ZINC001174386552 976631890 /nfs/dbraw/zinc/63/18/90/976631890.db2.gz DBIKKHOQJJUWEJ-UHFFFAOYSA-N 1 2 225.255 2.107 20 0 BEADLO Cc1cccc2c1ccnc2OC1C[NH+](C)C1 ZINC001229042183 976671094 /nfs/dbraw/zinc/67/10/94/976671094.db2.gz BQVKFQQTCHLBGB-UHFFFAOYSA-N 1 2 228.295 2.236 20 0 BEADLO O=c1ccc(Nc2cc[nH+]c3[nH]ccc32)c[nH]1 ZINC001174409737 976698286 /nfs/dbraw/zinc/69/82/86/976698286.db2.gz WAGXVTLRKYVMEW-UHFFFAOYSA-N 1 2 226.239 2.359 20 0 BEADLO Cc1cn2c(cccc2Nc2c[nH]nc2C)[nH+]1 ZINC001174471090 976775647 /nfs/dbraw/zinc/77/56/47/976775647.db2.gz LAMQDEVGQGCKLQ-UHFFFAOYSA-N 1 2 227.271 2.418 20 0 BEADLO Cc1cc(O)ccc1NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001334936486 976800067 /nfs/dbraw/zinc/80/00/67/976800067.db2.gz MCRAIOYYGPBYTO-SNVBAGLBSA-N 1 2 245.282 2.097 20 0 BEADLO COCCn1cc(Nc2[nH+]c(C)ccc2C)cn1 ZINC001174550442 976851148 /nfs/dbraw/zinc/85/11/48/976851148.db2.gz QFZXLJQVNCAATM-UHFFFAOYSA-N 1 2 246.314 2.285 20 0 BEADLO Cc1cc(O)ccc1Nc1[nH+]cccc1CCO ZINC001174565304 976882368 /nfs/dbraw/zinc/88/23/68/976882368.db2.gz XERPPTIHARHYBK-UHFFFAOYSA-N 1 2 244.294 2.374 20 0 BEADLO CC[NH+]1CC(Oc2nccc3ccc(F)cc32)C1 ZINC001229513653 976887693 /nfs/dbraw/zinc/88/76/93/976887693.db2.gz AWAREQQXFMUNAM-UHFFFAOYSA-N 1 2 246.285 2.457 20 0 BEADLO Cc1cc(NC(=S)c2cccc(N)c2)cc[nH+]1 ZINC001174656902 976954201 /nfs/dbraw/zinc/95/42/01/976954201.db2.gz VKYWBWIDYJJVSU-UHFFFAOYSA-N 1 2 243.335 2.182 20 0 BEADLO C[C@H]1COC[C@@H]1Oc1ccc(-n2cc[nH+]c2)cc1 ZINC001229950488 977032032 /nfs/dbraw/zinc/03/20/32/977032032.db2.gz LHUICOKQVOLTNW-FZMZJTMJSA-N 1 2 244.294 2.286 20 0 BEADLO c1cn(-c2ccc(OC3CCOCC3)cc2)c[nH+]1 ZINC001229952205 977038929 /nfs/dbraw/zinc/03/89/29/977038929.db2.gz ZRYRJAYUGLYLFW-UHFFFAOYSA-N 1 2 244.294 2.430 20 0 BEADLO CCc1ccc(O)cc1OC1C[NH+](CC)C1 ZINC001230287663 977165486 /nfs/dbraw/zinc/16/54/86/977165486.db2.gz VIIDALOMKMLINY-UHFFFAOYSA-N 1 2 221.300 2.038 20 0 BEADLO COc1cc[nH+]c(Nc2cc(CO)ccc2F)c1 ZINC001175129027 977282580 /nfs/dbraw/zinc/28/25/80/977282580.db2.gz VEPRCGBFKFHFNY-UHFFFAOYSA-N 1 2 248.257 2.465 20 0 BEADLO c1cc(Nc2ccc(N3CCCC3)[nH+]c2)cnn1 ZINC001175346247 977364817 /nfs/dbraw/zinc/36/48/17/977364817.db2.gz PTOVSNMAFVZJSM-UHFFFAOYSA-N 1 2 241.298 2.215 20 0 BEADLO Cc1nc(N[C@H](C)c2cncs2)cc[nH+]1 ZINC001355358150 1170018965 /nfs/dbraw/zinc/01/89/65/1170018965.db2.gz INEDXBGUBVDABI-SSDOTTSWSA-N 1 2 220.301 2.415 20 0 BEADLO Oc1cc2c(cc1OC1CC=CC1)CC[NH+]=C2 ZINC001230920874 977384241 /nfs/dbraw/zinc/38/42/41/977384241.db2.gz WTFBKOQFCICIGT-UHFFFAOYSA-N 1 2 229.279 2.465 20 0 BEADLO Cc1cnc(Nc2ccc(N(C)C)[nH+]c2)nc1C ZINC001175338634 977387107 /nfs/dbraw/zinc/38/71/07/977387107.db2.gz ZMNOYLJADQHXEI-UHFFFAOYSA-N 1 2 243.314 2.298 20 0 BEADLO COc1cccnc1Nc1ccc(N(C)C)[nH+]c1 ZINC001175338551 977387517 /nfs/dbraw/zinc/38/75/17/977387517.db2.gz HTNKSJZZACDJBD-UHFFFAOYSA-N 1 2 244.298 2.295 20 0 BEADLO CN(C)c1ccc(Nc2cccnc2F)c[nH+]1 ZINC001175338546 977388958 /nfs/dbraw/zinc/38/89/58/977388958.db2.gz HSCYNQRNZBDFIJ-UHFFFAOYSA-N 1 2 232.262 2.425 20 0 BEADLO C[NH+]1CC(Oc2ccc(-c3cnco3)cc2)C1 ZINC001231049047 977441952 /nfs/dbraw/zinc/44/19/52/977441952.db2.gz USVBBYZHLDKFDF-UHFFFAOYSA-N 1 2 230.267 2.034 20 0 BEADLO CN(C)c1ccc[nH+]c1Nc1cccc(CO)c1 ZINC001175513755 977490895 /nfs/dbraw/zinc/49/08/95/977490895.db2.gz JOIPAFBEOMYYIM-UHFFFAOYSA-N 1 2 243.310 2.384 20 0 BEADLO CC[NH+]1CC(Oc2cnc3c(F)cccc3c2)C1 ZINC001231144404 977509626 /nfs/dbraw/zinc/50/96/26/977509626.db2.gz ZYCBKMMIJNNHOU-UHFFFAOYSA-N 1 2 246.285 2.457 20 0 BEADLO CCC[C@@H]1CCCN1C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001336161622 977545763 /nfs/dbraw/zinc/54/57/63/977545763.db2.gz BJMSQLMHOKOXBB-VXGBXAGGSA-N 1 2 235.331 2.235 20 0 BEADLO CCC[C@H]1CCCN1C(=O)CCCn1cc[nH+]c1 ZINC001336162600 977548517 /nfs/dbraw/zinc/54/85/17/977548517.db2.gz IXHHRNMEQKDQLL-ZDUSSCGKSA-N 1 2 249.358 2.454 20 0 BEADLO Cc1ncc(NC2=CCC[N@@H+](C)C2)c(Cl)n1 ZINC001175575163 977571385 /nfs/dbraw/zinc/57/13/85/977571385.db2.gz MLXCPVMOUYWTHT-UHFFFAOYSA-N 1 2 238.722 2.070 20 0 BEADLO Cc1ncc(NC2=CCC[N@H+](C)C2)c(Cl)n1 ZINC001175575163 977571401 /nfs/dbraw/zinc/57/14/01/977571401.db2.gz MLXCPVMOUYWTHT-UHFFFAOYSA-N 1 2 238.722 2.070 20 0 BEADLO C[N@@H+]1CCCC(=Nc2nsc3ncccc23)C1 ZINC001175577058 977585990 /nfs/dbraw/zinc/58/59/90/977585990.db2.gz OZPMGVIZHRCOKB-UHFFFAOYSA-N 1 2 246.339 2.323 20 0 BEADLO C[N@H+]1CCCC(=Nc2nsc3ncccc23)C1 ZINC001175577058 977585998 /nfs/dbraw/zinc/58/59/98/977585998.db2.gz OZPMGVIZHRCOKB-UHFFFAOYSA-N 1 2 246.339 2.323 20 0 BEADLO CCOc1ccc(C[NH+]2CC(C(F)F)C2)cn1 ZINC001231655482 977663165 /nfs/dbraw/zinc/66/31/65/977663165.db2.gz DHCIFBPEDHZJOR-UHFFFAOYSA-N 1 2 242.269 2.177 20 0 BEADLO C[N@H+](Cc1ccno1)Cc1cc2cc[nH]c2cn1 ZINC001231673380 977684286 /nfs/dbraw/zinc/68/42/86/977684286.db2.gz OVSGKBILLDPYCR-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO C[N@@H+](Cc1ccno1)Cc1cc2cc[nH]c2cn1 ZINC001231673380 977684291 /nfs/dbraw/zinc/68/42/91/977684291.db2.gz OVSGKBILLDPYCR-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO COCc1ccc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)o1 ZINC001231689972 977692833 /nfs/dbraw/zinc/69/28/33/977692833.db2.gz ZFVQSGUVRFVQPO-TVYUQYBPSA-N 1 2 239.290 2.216 20 0 BEADLO COCc1ccc(C[N@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)o1 ZINC001231689972 977692851 /nfs/dbraw/zinc/69/28/51/977692851.db2.gz ZFVQSGUVRFVQPO-TVYUQYBPSA-N 1 2 239.290 2.216 20 0 BEADLO Oc1cc(C[NH+]2CC=CC2)ccc1Cl ZINC001231733568 977715896 /nfs/dbraw/zinc/71/58/96/977715896.db2.gz YVFASHGINDRKKK-UHFFFAOYSA-N 1 2 209.676 2.417 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H](C)[C@@H](F)C2)cnc1F ZINC001231925457 977800514 /nfs/dbraw/zinc/80/05/14/977800514.db2.gz QCAKTGQLWQWUFB-KOLCDFICSA-N 1 2 226.270 2.319 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H](C)[C@@H](F)C2)cnc1F ZINC001231925457 977800515 /nfs/dbraw/zinc/80/05/15/977800515.db2.gz QCAKTGQLWQWUFB-KOLCDFICSA-N 1 2 226.270 2.319 20 0 BEADLO Cc1cc(C[NH+]2CC3(CSC3)C2)cnc1F ZINC001231931027 977803310 /nfs/dbraw/zinc/80/33/10/977803310.db2.gz SHLSYZUVSHXLMH-UHFFFAOYSA-N 1 2 238.331 2.078 20 0 BEADLO COc1cc[nH+]c(Nc2cnn(C3CC3)c2)c1 ZINC001175959132 977827197 /nfs/dbraw/zinc/82/71/97/977827197.db2.gz QGQDYALBQPGLGP-UHFFFAOYSA-N 1 2 230.271 2.365 20 0 BEADLO CO[C@H]1CCN(c2cc(F)cc(C)[nH+]2)C[C@@H]1C ZINC001336649727 977829406 /nfs/dbraw/zinc/82/94/06/977829406.db2.gz WYMYMGAZDIJZNT-CABZTGNLSA-N 1 2 238.306 2.390 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cnccn2)cc(C)n1 ZINC001232000021 977829580 /nfs/dbraw/zinc/82/95/80/977829580.db2.gz DCULMFGPHSQUIN-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cnccn2)cc(C)n1 ZINC001232000021 977829584 /nfs/dbraw/zinc/82/95/84/977829584.db2.gz DCULMFGPHSQUIN-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cncnc2)cc(C)n1 ZINC001232005337 977834661 /nfs/dbraw/zinc/83/46/61/977834661.db2.gz VQUVLFIMJFXPGJ-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cncnc2)cc(C)n1 ZINC001232005337 977834667 /nfs/dbraw/zinc/83/46/67/977834667.db2.gz VQUVLFIMJFXPGJ-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccc(CN(C)c2cc(N)nc[nH+]2)cc1C ZINC001336665479 977843880 /nfs/dbraw/zinc/84/38/80/977843880.db2.gz KIHSAKWNWSPDJL-UHFFFAOYSA-N 1 2 242.326 2.312 20 0 BEADLO CC(=O)N1CC=C(Nc2c[nH+]c(C)cc2C)CC1 ZINC001176029209 977864759 /nfs/dbraw/zinc/86/47/59/977864759.db2.gz DVWRSPPIWXXJFF-UHFFFAOYSA-N 1 2 245.326 2.246 20 0 BEADLO CC(=O)N1CC=C(Nc2[nH+]cc(C)cc2C)CC1 ZINC001176029461 977865012 /nfs/dbraw/zinc/86/50/12/977865012.db2.gz VRLJMNBCXBKBPH-UHFFFAOYSA-N 1 2 245.326 2.246 20 0 BEADLO Cc1[nH]c([C@@H]2CCCN2Cc2ccno2)[nH+]c1C ZINC001176077295 977871623 /nfs/dbraw/zinc/87/16/23/977871623.db2.gz JUKIFYHFJOUXTH-LBPRGKRZSA-N 1 2 246.314 2.352 20 0 BEADLO CC1(C)C[N@H+](Cc2cc3ncccc3[nH]2)CCO1 ZINC001232064906 977879410 /nfs/dbraw/zinc/87/94/10/977879410.db2.gz ZIGFEERLMSBXIR-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO CC1(C)C[N@@H+](Cc2cc3ncccc3[nH]2)CCO1 ZINC001232064906 977879420 /nfs/dbraw/zinc/87/94/20/977879420.db2.gz ZIGFEERLMSBXIR-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO Cc1cn(-c2[nH]cc[nH+]2)c2cccc(N)c12 ZINC001176085046 977886896 /nfs/dbraw/zinc/88/68/96/977886896.db2.gz CSPLUXWUIANNTB-UHFFFAOYSA-N 1 2 212.256 2.244 20 0 BEADLO Cc1cc(Nc2nnc(C(C)C)o2)cc(C)[nH+]1 ZINC001176051339 977896092 /nfs/dbraw/zinc/89/60/92/977896092.db2.gz FJUZMAUVAIERRK-UHFFFAOYSA-N 1 2 232.287 2.370 20 0 BEADLO c1cc(C[N@@H+]2CCC[C@H]2c2cnccn2)sn1 ZINC001232192047 977918722 /nfs/dbraw/zinc/91/87/22/977918722.db2.gz SCIKWOJGOITDEY-LBPRGKRZSA-N 1 2 246.339 2.270 20 0 BEADLO c1cc(C[N@H+]2CCC[C@H]2c2cnccn2)sn1 ZINC001232192047 977918734 /nfs/dbraw/zinc/91/87/34/977918734.db2.gz SCIKWOJGOITDEY-LBPRGKRZSA-N 1 2 246.339 2.270 20 0 BEADLO Cc1scnc1C[NH+]1CC(c2cccnc2)C1 ZINC001232207052 977932448 /nfs/dbraw/zinc/93/24/48/977932448.db2.gz UNHMLMIQSCOZNO-UHFFFAOYSA-N 1 2 245.351 2.446 20 0 BEADLO COc1cc[nH+]cc1Nc1cnc(Cl)nc1 ZINC001176116822 977944816 /nfs/dbraw/zinc/94/48/16/977944816.db2.gz LMAOLFUCTDSLAU-UHFFFAOYSA-N 1 2 236.662 2.277 20 0 BEADLO COc1cc[nH+]cc1Nc1c2c(nn1C)CCC2 ZINC001176116735 977947404 /nfs/dbraw/zinc/94/74/04/977947404.db2.gz KRARXKCPNGUXCY-UHFFFAOYSA-N 1 2 244.298 2.056 20 0 BEADLO COc1cc[nH+]cc1Nc1ccc(F)nc1 ZINC001176117162 977947549 /nfs/dbraw/zinc/94/75/49/977947549.db2.gz UNGUTACSIRKDQD-UHFFFAOYSA-N 1 2 219.219 2.368 20 0 BEADLO COc1cc[nH+]cc1Nc1cc(F)cnc1OC ZINC001176118516 977947592 /nfs/dbraw/zinc/94/75/92/977947592.db2.gz MVCJYYQMOXDTGJ-UHFFFAOYSA-N 1 2 249.245 2.377 20 0 BEADLO COc1cc[nH+]cc1Nc1ncc(O)cc1C ZINC001176117272 977947982 /nfs/dbraw/zinc/94/79/82/977947982.db2.gz YYDZAVUIIAQNKR-UHFFFAOYSA-N 1 2 231.255 2.243 20 0 BEADLO COc1cc[nH+]cc1N[C@H](C)Cc1cc(C)no1 ZINC001176118816 977949543 /nfs/dbraw/zinc/94/95/43/977949543.db2.gz JIQMIZMLBYXYTN-SECBINFHSA-N 1 2 247.298 2.430 20 0 BEADLO CCc1nnc(Nc2c[nH+]ccc2OC)s1 ZINC001176118812 977950206 /nfs/dbraw/zinc/95/02/06/977950206.db2.gz JBPXJLIVTAPBDW-UHFFFAOYSA-N 1 2 236.300 2.248 20 0 BEADLO COc1cc[nH+]cc1Nc1ccc(F)c(CO)c1 ZINC001176120586 977953456 /nfs/dbraw/zinc/95/34/56/977953456.db2.gz GKKJELVBTLWFJO-UHFFFAOYSA-N 1 2 248.257 2.465 20 0 BEADLO COc1cc[nH+]cc1Nc1ccc(F)cc1CO ZINC001176124057 977956574 /nfs/dbraw/zinc/95/65/74/977956574.db2.gz HAKUEDUYDQLWBN-UHFFFAOYSA-N 1 2 248.257 2.465 20 0 BEADLO Cc1cc(C)c(Nc2cnc(N(C)C)nc2)c[nH+]1 ZINC001176329610 978027784 /nfs/dbraw/zinc/02/77/84/978027784.db2.gz XGGIVLMUKZQBEC-UHFFFAOYSA-N 1 2 243.314 2.298 20 0 BEADLO COc1cc(C)c(C[N@@H+]2CCC[C@H](F)C2)cn1 ZINC001232352524 978030405 /nfs/dbraw/zinc/03/04/05/978030405.db2.gz OPZCZMAJBTWHGG-LBPRGKRZSA-N 1 2 238.306 2.333 20 0 BEADLO COc1cc(C)c(C[N@H+]2CCC[C@H](F)C2)cn1 ZINC001232352524 978030411 /nfs/dbraw/zinc/03/04/11/978030411.db2.gz OPZCZMAJBTWHGG-LBPRGKRZSA-N 1 2 238.306 2.333 20 0 BEADLO COc1cc[nH+]cc1Nc1csc(CO)c1 ZINC001176366180 978051728 /nfs/dbraw/zinc/05/17/28/978051728.db2.gz KWZBKODWTWFGOD-UHFFFAOYSA-N 1 2 236.296 2.388 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1cc(F)c(C)c(F)c1 ZINC001232419884 978060042 /nfs/dbraw/zinc/06/00/42/978060042.db2.gz KXYHSSJQWDEVNC-UHFFFAOYSA-N 1 2 227.254 2.294 20 0 BEADLO CC(=O)C[N@H+](C)Cc1cc(F)c(C)c(F)c1 ZINC001232419884 978060057 /nfs/dbraw/zinc/06/00/57/978060057.db2.gz KXYHSSJQWDEVNC-UHFFFAOYSA-N 1 2 227.254 2.294 20 0 BEADLO Cc1ncc(Nc2cccn3cc[nH+]c23)cn1 ZINC001176393757 978060738 /nfs/dbraw/zinc/06/07/38/978060738.db2.gz NKJKZGPWZPJAAT-UHFFFAOYSA-N 1 2 225.255 2.176 20 0 BEADLO c1ccc2c(c1)C[NH+](Cc1[nH]nc3c1CCC3)C2 ZINC001232428927 978073339 /nfs/dbraw/zinc/07/33/39/978073339.db2.gz XSBDTOUTNAEWDB-UHFFFAOYSA-N 1 2 239.322 2.414 20 0 BEADLO c1c(C[NH+]2CCC2)onc1OCc1ccccc1 ZINC001232448255 978079453 /nfs/dbraw/zinc/07/94/53/978079453.db2.gz MVDOMQIIYJBCGL-UHFFFAOYSA-N 1 2 244.294 2.459 20 0 BEADLO Cc1cc([C@H]2CCCN2Cc2c[nH+]c(C)[nH]2)no1 ZINC001232457951 978085199 /nfs/dbraw/zinc/08/51/99/978085199.db2.gz AVIJAMMYNMSQJR-CYBMUJFWSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1cc([C@H]2CCCN2Cc2c[nH]c(C)[nH+]2)no1 ZINC001232457951 978085211 /nfs/dbraw/zinc/08/52/11/978085211.db2.gz AVIJAMMYNMSQJR-CYBMUJFWSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1cc([C@@H]2CCCN2Cc2c[nH+]c(C)[nH]2)no1 ZINC001232457956 978086430 /nfs/dbraw/zinc/08/64/30/978086430.db2.gz AVIJAMMYNMSQJR-ZDUSSCGKSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1cc([C@@H]2CCCN2Cc2c[nH]c(C)[nH+]2)no1 ZINC001232457956 978086441 /nfs/dbraw/zinc/08/64/41/978086441.db2.gz AVIJAMMYNMSQJR-ZDUSSCGKSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1[nH]c(CN2CCC(=O)[C@H]3CCCC[C@H]32)c[nH+]1 ZINC001232458662 978087162 /nfs/dbraw/zinc/08/71/62/978087162.db2.gz PTQDAMWKUVHQHN-QWHCGFSZSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1[nH]cc(CN2CCC(=O)[C@H]3CCCC[C@H]32)[nH+]1 ZINC001232458662 978087178 /nfs/dbraw/zinc/08/71/78/978087178.db2.gz PTQDAMWKUVHQHN-QWHCGFSZSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1[nH]c(CN2Cc3cnc(Cl)cc3C2)c[nH+]1 ZINC001232469744 978119476 /nfs/dbraw/zinc/11/94/76/978119476.db2.gz YXVAUFXTDZDAAE-UHFFFAOYSA-N 1 2 248.717 2.282 20 0 BEADLO Cc1[nH]cc(CN2Cc3cnc(Cl)cc3C2)[nH+]1 ZINC001232469744 978119485 /nfs/dbraw/zinc/11/94/85/978119485.db2.gz YXVAUFXTDZDAAE-UHFFFAOYSA-N 1 2 248.717 2.282 20 0 BEADLO Cc1cc(C)[nH+]c(Nc2cnc3nonc3c2)c1 ZINC001176688034 978149314 /nfs/dbraw/zinc/14/93/14/978149314.db2.gz DTKHPLFXPZFRQY-UHFFFAOYSA-N 1 2 241.254 2.373 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1cccc(CF)n1 ZINC001232534454 978162320 /nfs/dbraw/zinc/16/23/20/978162320.db2.gz DISUUSDOPOGDNV-ZJUUUORDSA-N 1 2 226.270 2.483 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1cccc(CF)n1 ZINC001232534454 978162330 /nfs/dbraw/zinc/16/23/30/978162330.db2.gz DISUUSDOPOGDNV-ZJUUUORDSA-N 1 2 226.270 2.483 20 0 BEADLO FCc1cccc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)n1 ZINC001232533810 978163768 /nfs/dbraw/zinc/16/37/68/978163768.db2.gz SLEACJMMFKXUAK-XDTLVQLUSA-N 1 2 238.281 2.341 20 0 BEADLO FCc1cccc(C[N@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)n1 ZINC001232533810 978163774 /nfs/dbraw/zinc/16/37/74/978163774.db2.gz SLEACJMMFKXUAK-XDTLVQLUSA-N 1 2 238.281 2.341 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc3ccoc3cn2)C[C@H](C)O1 ZINC001232549307 978169622 /nfs/dbraw/zinc/16/96/22/978169622.db2.gz FCVJTBWDYJQJES-PHIMTYICSA-N 1 2 246.310 2.437 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc3ccoc3cn2)C[C@H](C)O1 ZINC001232549307 978169630 /nfs/dbraw/zinc/16/96/30/978169630.db2.gz FCVJTBWDYJQJES-PHIMTYICSA-N 1 2 246.310 2.437 20 0 BEADLO c1coc(Nc2ccc[nH+]c2N2CCCC2)n1 ZINC001176744703 978169983 /nfs/dbraw/zinc/16/99/83/978169983.db2.gz XTKPIXJZGJTNAC-UHFFFAOYSA-N 1 2 230.271 2.413 20 0 BEADLO COc1cccc(C)c1C[N@@H+]1CCC(=O)[C@@H](C)C1 ZINC001232619613 978194384 /nfs/dbraw/zinc/19/43/84/978194384.db2.gz FHLCRFMGEAPYAP-LBPRGKRZSA-N 1 2 247.338 2.415 20 0 BEADLO COc1cccc(C)c1C[N@H+]1CCC(=O)[C@@H](C)C1 ZINC001232619613 978194393 /nfs/dbraw/zinc/19/43/93/978194393.db2.gz FHLCRFMGEAPYAP-LBPRGKRZSA-N 1 2 247.338 2.415 20 0 BEADLO OC1C[NH+](Cc2ccc3ccsc3c2)C1 ZINC001232610392 978196295 /nfs/dbraw/zinc/19/62/95/978196295.db2.gz PHNJDULPHHAYRT-UHFFFAOYSA-N 1 2 219.309 2.078 20 0 BEADLO C[C@H]1C[C@H](NC(=O)Cc2c[nH]c[nH+]2)CC(C)(C)C1 ZINC001176836865 978207533 /nfs/dbraw/zinc/20/75/33/978207533.db2.gz RBWQWVOBGSFCIJ-QWRGUYRKSA-N 1 2 249.358 2.283 20 0 BEADLO Cc1cc(F)cc(N2CCO[C@H](C)CC2)[nH+]1 ZINC001337267069 978254681 /nfs/dbraw/zinc/25/46/81/978254681.db2.gz OEPPUZFYUGAPGQ-SNVBAGLBSA-N 1 2 224.279 2.144 20 0 BEADLO c1nc2cccc(C[N@@H+]3CCO[C@H]4C[C@H]43)c2s1 ZINC001232736954 978257083 /nfs/dbraw/zinc/25/70/83/978257083.db2.gz TVCKHGLHSXQDOD-NEPJUHHUSA-N 1 2 246.335 2.269 20 0 BEADLO c1nc2cccc(C[N@H+]3CCO[C@H]4C[C@H]43)c2s1 ZINC001232736954 978257091 /nfs/dbraw/zinc/25/70/91/978257091.db2.gz TVCKHGLHSXQDOD-NEPJUHHUSA-N 1 2 246.335 2.269 20 0 BEADLO Oc1cccc(C[NH+]2CC=CC2)c1Cl ZINC001232784851 978276395 /nfs/dbraw/zinc/27/63/95/978276395.db2.gz WMWUPJHISMDNTJ-UHFFFAOYSA-N 1 2 209.676 2.417 20 0 BEADLO COc1cc(O)cc(C[N@H+](C)Cc2ccno2)c1 ZINC001232807177 978301401 /nfs/dbraw/zinc/30/14/01/978301401.db2.gz PVJXUPVWLLVDEV-UHFFFAOYSA-N 1 2 248.282 2.021 20 0 BEADLO COc1cc(O)cc(C[N@@H+](C)Cc2ccno2)c1 ZINC001232807177 978301411 /nfs/dbraw/zinc/30/14/11/978301411.db2.gz PVJXUPVWLLVDEV-UHFFFAOYSA-N 1 2 248.282 2.021 20 0 BEADLO CCC[C@@H](C)CC(=O)NCc1c[nH]c(CC)[nH+]1 ZINC001597251203 978303249 /nfs/dbraw/zinc/30/32/49/978303249.db2.gz QVXPCCRSVHKACF-SNVBAGLBSA-N 1 2 237.347 2.415 20 0 BEADLO CCC[C@@H](C)CC(=O)NCc1c[nH+]c(CC)[nH]1 ZINC001597251203 978303234 /nfs/dbraw/zinc/30/32/34/978303234.db2.gz QVXPCCRSVHKACF-SNVBAGLBSA-N 1 2 237.347 2.415 20 0 BEADLO Cc1cc(O)cc(C[NH+]2CC3(C2)CCCCO3)c1 ZINC001232878832 978313039 /nfs/dbraw/zinc/31/30/39/978313039.db2.gz VEMONLTYLBNPJB-UHFFFAOYSA-N 1 2 247.338 2.456 20 0 BEADLO Cn1nccc1C[C@@H]1CCCN1c1cccc[nH+]1 ZINC001337416356 978332887 /nfs/dbraw/zinc/33/28/87/978332887.db2.gz YFILRNNDWCBFMO-ZDUSSCGKSA-N 1 2 242.326 2.027 20 0 BEADLO CN(CC(=O)Nc1ccsc1)c1cccc[nH+]1 ZINC001177408380 978349915 /nfs/dbraw/zinc/34/99/15/978349915.db2.gz FPLAUJXQXMZSKX-UHFFFAOYSA-N 1 2 247.323 2.218 20 0 BEADLO c1nc2ccc(C[N@@H+]3C[C@H]4CC[C@@H]3CO4)cc2o1 ZINC001232945683 978354852 /nfs/dbraw/zinc/35/48/52/978354852.db2.gz HUCPUKCDHMOOPA-VXGBXAGGSA-N 1 2 244.294 2.191 20 0 BEADLO c1nc2ccc(C[N@H+]3C[C@H]4CC[C@@H]3CO4)cc2o1 ZINC001232945683 978354866 /nfs/dbraw/zinc/35/48/66/978354866.db2.gz HUCPUKCDHMOOPA-VXGBXAGGSA-N 1 2 244.294 2.191 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)CCC(C)C ZINC001337508747 978381265 /nfs/dbraw/zinc/38/12/65/978381265.db2.gz GIHPYYAONQTABV-UHFFFAOYSA-N 1 2 220.316 2.495 20 0 BEADLO CC=C(CC)C(=O)Nc1c(C)c[nH+]cc1C ZINC001337508713 978381943 /nfs/dbraw/zinc/38/19/43/978381943.db2.gz FCZCUHOKYHOTGR-WZUFQYTHSA-N 1 2 218.300 2.415 20 0 BEADLO Oc1cnc(Cl)cc1C[N@@H+]1CCC[C@@H]2C[C@@H]21 ZINC001233038595 978422508 /nfs/dbraw/zinc/42/25/08/978422508.db2.gz WKPPEHITZACACJ-SCZZXKLOSA-N 1 2 238.718 2.425 20 0 BEADLO Oc1cnc(Cl)cc1C[N@H+]1CCC[C@@H]2C[C@@H]21 ZINC001233038595 978422517 /nfs/dbraw/zinc/42/25/17/978422517.db2.gz WKPPEHITZACACJ-SCZZXKLOSA-N 1 2 238.718 2.425 20 0 BEADLO C[C@H]1C[C@@H](O)CC[N@@H+]1Cc1scnc1Cl ZINC000721941849 978429590 /nfs/dbraw/zinc/42/95/90/978429590.db2.gz JENKJWFKBHZJKK-YUMQZZPRSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@H]1C[C@@H](O)CC[N@H+]1Cc1scnc1Cl ZINC000721941849 978429598 /nfs/dbraw/zinc/42/95/98/978429598.db2.gz JENKJWFKBHZJKK-YUMQZZPRSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H](CC(=O)N1CC[C@H]1C(C)(C)C)n1cc[nH+]c1 ZINC001337663510 978443809 /nfs/dbraw/zinc/44/38/09/978443809.db2.gz ZIHMIEIAJPOOQS-RYUDHWBXSA-N 1 2 249.358 2.481 20 0 BEADLO C[N@@H+]1Cc2ccccc2[C@@H]1CNc1nncs1 ZINC001337683364 978455857 /nfs/dbraw/zinc/45/58/57/978455857.db2.gz SHCNKDDWBWMIHQ-NSHDSACASA-N 1 2 246.339 2.137 20 0 BEADLO C[N@H+]1Cc2ccccc2[C@@H]1CNc1nncs1 ZINC001337683364 978455862 /nfs/dbraw/zinc/45/58/62/978455862.db2.gz SHCNKDDWBWMIHQ-NSHDSACASA-N 1 2 246.339 2.137 20 0 BEADLO CN(C)c1ccc(C[NH+]2CC(C)(C)C2)c(F)n1 ZINC001233115011 978469782 /nfs/dbraw/zinc/46/97/82/978469782.db2.gz SZESLCIKSAAYNE-UHFFFAOYSA-N 1 2 237.322 2.129 20 0 BEADLO C[C@H](C(=O)N1[C@@H](C)CCC[C@@H]1C)n1cc[nH+]c1 ZINC001177922400 978471406 /nfs/dbraw/zinc/47/14/06/978471406.db2.gz ULAXRTAKVIFVGI-SDDRHHMPSA-N 1 2 235.331 2.234 20 0 BEADLO C[N@H+](CCF)Cc1[nH]nc2cc(F)ccc21 ZINC001233124040 978473411 /nfs/dbraw/zinc/47/34/11/978473411.db2.gz DJIWVCDVBYKKPI-UHFFFAOYSA-N 1 2 225.242 2.103 20 0 BEADLO C[N@@H+](CCF)Cc1[nH]nc2cc(F)ccc21 ZINC001233124040 978473417 /nfs/dbraw/zinc/47/34/17/978473417.db2.gz DJIWVCDVBYKKPI-UHFFFAOYSA-N 1 2 225.242 2.103 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccno2)cnc1C ZINC001233162721 978482854 /nfs/dbraw/zinc/48/28/54/978482854.db2.gz JYFAUJFLVMCFNX-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccno2)cnc1C ZINC001233162721 978482862 /nfs/dbraw/zinc/48/28/62/978482862.db2.gz JYFAUJFLVMCFNX-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1csc(NC(=O)CCc2[nH]cc[nH+]2)c1 ZINC001177994320 978492699 /nfs/dbraw/zinc/49/26/99/978492699.db2.gz VIKCCLSIYBDFGE-UHFFFAOYSA-N 1 2 235.312 2.351 20 0 BEADLO Cc1c[nH]c(=O)c(C[N@H+](C)Cc2cscn2)c1 ZINC001233194887 978494814 /nfs/dbraw/zinc/49/48/14/978494814.db2.gz FYTPPABHOSZYAA-UHFFFAOYSA-N 1 2 249.339 2.184 20 0 BEADLO Cc1c[nH]c(=O)c(C[N@@H+](C)Cc2cscn2)c1 ZINC001233194887 978494822 /nfs/dbraw/zinc/49/48/22/978494822.db2.gz FYTPPABHOSZYAA-UHFFFAOYSA-N 1 2 249.339 2.184 20 0 BEADLO CCc1ccc(N(C)Cc2cnn(C)c2C)[nH+]c1 ZINC001337859955 978528425 /nfs/dbraw/zinc/52/84/25/978528425.db2.gz WAXVEZVTOQANMK-UHFFFAOYSA-N 1 2 244.342 2.322 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)sn1 ZINC001233310588 978535422 /nfs/dbraw/zinc/53/54/22/978535422.db2.gz NCIFZQDJULPZJB-LSJOCFKGSA-N 1 2 226.320 2.241 20 0 BEADLO Cc1cc(C[N@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)sn1 ZINC001233310588 978535433 /nfs/dbraw/zinc/53/54/33/978535433.db2.gz NCIFZQDJULPZJB-LSJOCFKGSA-N 1 2 226.320 2.241 20 0 BEADLO CCc1ccc(N2CCC[C@H](CO)CC2)[nH+]c1 ZINC001337894662 978553823 /nfs/dbraw/zinc/55/38/23/978553823.db2.gz LGDCFRPXBQMOOI-ZDUSSCGKSA-N 1 2 234.343 2.243 20 0 BEADLO CC(=O)C1CCN(c2cc(F)cc(C)[nH+]2)CC1 ZINC001337943762 978574394 /nfs/dbraw/zinc/57/43/94/978574394.db2.gz XGAWZFUCQVBSTC-UHFFFAOYSA-N 1 2 236.290 2.335 20 0 BEADLO Cc1cc(F)cc(N2C3CCC2(CO)CC3)[nH+]1 ZINC001337998296 978587077 /nfs/dbraw/zinc/58/70/77/978587077.db2.gz WRUBEJGZTSEAKA-UHFFFAOYSA-N 1 2 236.290 2.023 20 0 BEADLO Clc1ccn2cc(C[NH+]3CCC3)nc2c1 ZINC001233388306 978598785 /nfs/dbraw/zinc/59/87/85/978598785.db2.gz UQWVRJANVRFWQX-UHFFFAOYSA-N 1 2 221.691 2.193 20 0 BEADLO CCc1nc(C[NH2+]Cc2cccc(O)c2)co1 ZINC001178737191 978622592 /nfs/dbraw/zinc/62/25/92/978622592.db2.gz PBONIGZUFAWPQU-UHFFFAOYSA-N 1 2 232.283 2.232 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H]1CC[C@@H](C)C1 ZINC001338243448 978642966 /nfs/dbraw/zinc/64/29/66/978642966.db2.gz OMSUDWAKPRIHJN-SKDRFNHKSA-N 1 2 232.327 2.495 20 0 BEADLO CC[N@@H+]1CC[C@H](Oc2cc3[nH]ncc3c(C)c2)C1 ZINC001233740812 978684781 /nfs/dbraw/zinc/68/47/81/978684781.db2.gz WSHCBHLMSUGJOR-NSHDSACASA-N 1 2 245.326 2.344 20 0 BEADLO CC[N@H+]1CC[C@H](Oc2cc3[nH]ncc3c(C)c2)C1 ZINC001233740812 978684783 /nfs/dbraw/zinc/68/47/83/978684783.db2.gz WSHCBHLMSUGJOR-NSHDSACASA-N 1 2 245.326 2.344 20 0 BEADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1cc[nH]n1)CCO2 ZINC000068985281 978689079 /nfs/dbraw/zinc/68/90/79/978689079.db2.gz IJYGFTCNBDQFJK-LBPRGKRZSA-N 1 2 247.273 2.162 20 0 BEADLO CC[C@@H](F)C(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC001338919964 978754127 /nfs/dbraw/zinc/75/41/27/978754127.db2.gz YCUDROIJMDAUPD-SECBINFHSA-N 1 2 239.294 2.143 20 0 BEADLO CC[NH+]1CC(Oc2ccccc2OC(F)F)C1 ZINC001234022926 978754957 /nfs/dbraw/zinc/75/49/57/978754957.db2.gz SNRBJFDAAKRFIX-UHFFFAOYSA-N 1 2 243.253 2.371 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)C[C@@H]1CCCCO1 ZINC001338993851 978769040 /nfs/dbraw/zinc/76/90/40/978769040.db2.gz XTIRMWIJRRVPHY-LBPRGKRZSA-N 1 2 248.326 2.018 20 0 BEADLO CN(C)c1ccnc(Cl)c1C[NH+]1CC=CC1 ZINC001234097755 978774432 /nfs/dbraw/zinc/77/44/32/978774432.db2.gz ZKSZPULCPWAWQF-UHFFFAOYSA-N 1 2 237.734 2.173 20 0 BEADLO CC(C)=CCc1ccc(C[NH+]2CC(O)C2)cc1 ZINC001249953497 978806110 /nfs/dbraw/zinc/80/61/10/978806110.db2.gz KWCNRBXMXZQRFK-UHFFFAOYSA-N 1 2 231.339 2.372 20 0 BEADLO Cc1cc(OC2C[NH+](C)C2)ccc1OC(C)C ZINC001234284389 978813267 /nfs/dbraw/zinc/81/32/67/978813267.db2.gz CZYYFQMZNROICY-UHFFFAOYSA-N 1 2 235.327 2.475 20 0 BEADLO C=C(F)C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001180110930 978819547 /nfs/dbraw/zinc/81/95/47/978819547.db2.gz FUJTYUYOPLQRLX-UHFFFAOYSA-N 1 2 231.230 2.294 20 0 BEADLO CCCn1c[nH+]cc1CN1CCOCC12CCC2 ZINC001180203632 978838964 /nfs/dbraw/zinc/83/89/64/978838964.db2.gz WILGPQODCVZNDW-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CCOC(=[NH2+])c1ccc(OC[C@H]2CCO2)cc1 ZINC001234584977 978864506 /nfs/dbraw/zinc/86/45/06/978864506.db2.gz LIJLZUSWUABLBX-GFCCVEGCSA-N 1 2 235.283 2.216 20 0 BEADLO CCC[C@@H](C)[C@H]1CCCN1c1cc(N)nc[nH+]1 ZINC001339629161 978882022 /nfs/dbraw/zinc/88/20/22/978882022.db2.gz ONHBBXGFFFZFTN-GHMZBOCLSA-N 1 2 234.347 2.464 20 0 BEADLO CCC[C@@H](C)[C@@H]1CCCN1c1cc(N)nc[nH+]1 ZINC001339629162 978882525 /nfs/dbraw/zinc/88/25/25/978882525.db2.gz ONHBBXGFFFZFTN-MNOVXSKESA-N 1 2 234.347 2.464 20 0 BEADLO CCc1ccc(N2CC[C@@H](C(=O)OC)[C@@H]2C)[nH+]c1 ZINC001339685129 978893229 /nfs/dbraw/zinc/89/32/29/978893229.db2.gz DFZKAXKCLAJUSA-CMPLNLGQSA-N 1 2 248.326 2.032 20 0 BEADLO CCc1ccc(N2CCO[C@@H](C(F)F)C2)[nH+]c1 ZINC001339706907 978896624 /nfs/dbraw/zinc/89/66/24/978896624.db2.gz PIXPXBUSMPLPIR-SNVBAGLBSA-N 1 2 242.269 2.114 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@@H](CO)CC2)[nH+]1 ZINC001339731262 978900273 /nfs/dbraw/zinc/90/02/73/978900273.db2.gz XLKSLMKFHUSUDU-LLVKDONJSA-N 1 2 238.306 2.128 20 0 BEADLO CCc1ccc(N(C)Cc2nnc(C)s2)[nH+]c1 ZINC001339773564 978908714 /nfs/dbraw/zinc/90/87/14/978908714.db2.gz KIOYFUNWGJPOJM-UHFFFAOYSA-N 1 2 248.355 2.440 20 0 BEADLO Nc1cc(N2CCC[C@H](C3CCCC3)C2)[nH+]cn1 ZINC001340014406 978957213 /nfs/dbraw/zinc/95/72/13/978957213.db2.gz AWCBWOWVAHAKTR-LBPRGKRZSA-N 1 2 246.358 2.465 20 0 BEADLO C[C@H](C(=O)N(C)[C@H](C)C1(C)CC1)n1cc[nH+]c1 ZINC001340074922 978964863 /nfs/dbraw/zinc/96/48/63/978964863.db2.gz PRYUWVYELXMRRC-GHMZBOCLSA-N 1 2 235.331 2.091 20 0 BEADLO C[N@H+](Cc1cc2cccc(F)c2[nH]1)C1COC1 ZINC001235243949 979002590 /nfs/dbraw/zinc/00/25/90/979002590.db2.gz AAEPXPNQNWZQKF-UHFFFAOYSA-N 1 2 234.274 2.138 20 0 BEADLO C[N@@H+](Cc1cc2cccc(F)c2[nH]1)C1COC1 ZINC001235243949 979002592 /nfs/dbraw/zinc/00/25/92/979002592.db2.gz AAEPXPNQNWZQKF-UHFFFAOYSA-N 1 2 234.274 2.138 20 0 BEADLO Cc1cnc(F)c(C[N@@H+]2CCn3cccc3C2)c1 ZINC001235335956 979029631 /nfs/dbraw/zinc/02/96/31/979029631.db2.gz WDBGSJJUSHCALA-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO Cc1cnc(F)c(C[N@H+]2CCn3cccc3C2)c1 ZINC001235335956 979029635 /nfs/dbraw/zinc/02/96/35/979029635.db2.gz WDBGSJJUSHCALA-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO COc1cc(C[NH+]2CCC2)cc(F)c1F ZINC001235434443 979045370 /nfs/dbraw/zinc/04/53/70/979045370.db2.gz QNMHEOLEMMXBNG-UHFFFAOYSA-N 1 2 213.227 2.179 20 0 BEADLO Fc1cncc(C[NH+]2CCCC2)c1Cl ZINC001235490206 979057044 /nfs/dbraw/zinc/05/70/44/979057044.db2.gz ALGYIQGZQICARU-UHFFFAOYSA-N 1 2 214.671 2.470 20 0 BEADLO COc1ncc(C[NH+]2CC=CC2)cc1Cl ZINC001235696414 979125155 /nfs/dbraw/zinc/12/51/55/979125155.db2.gz BTSRTNGLMVVTSN-UHFFFAOYSA-N 1 2 224.691 2.115 20 0 BEADLO C[C@@H]1C[C@H]1C[N@@H+]1CCNC[C@H]1c1ccccc1F ZINC001235743207 979141053 /nfs/dbraw/zinc/14/10/53/979141053.db2.gz LPUQADKNMCQVOL-XUJVJEKNSA-N 1 2 248.345 2.428 20 0 BEADLO C[C@@H]1C[C@H]1C[N@H+]1CCNC[C@H]1c1ccccc1F ZINC001235743207 979141062 /nfs/dbraw/zinc/14/10/62/979141062.db2.gz LPUQADKNMCQVOL-XUJVJEKNSA-N 1 2 248.345 2.428 20 0 BEADLO Cc1ccc(Nc2cnc3nccn3c2)c(C)[nH+]1 ZINC001203369374 979420179 /nfs/dbraw/zinc/42/01/79/979420179.db2.gz PNMBGIYLCZWKAD-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cc1ccc(Nc2nccn3ccnc23)c(C)[nH+]1 ZINC001203369564 979450008 /nfs/dbraw/zinc/45/00/08/979450008.db2.gz AEDOASCDBKQCNI-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC[C@@H]1CCCC[C@@H]1C ZINC001603422081 979452682 /nfs/dbraw/zinc/45/26/82/979452682.db2.gz MNTJYBGFHSCHIW-JQWIXIFHSA-N 1 2 249.358 2.203 20 0 BEADLO CS[C@H]1CC[C@H]([N@H+](C)Cc2csnn2)C1 ZINC001341570437 979458743 /nfs/dbraw/zinc/45/87/43/979458743.db2.gz WQYFTEKRSDANBT-UWVGGRQHSA-N 1 2 243.401 2.254 20 0 BEADLO CS[C@H]1CC[C@H]([N@@H+](C)Cc2csnn2)C1 ZINC001341570437 979458747 /nfs/dbraw/zinc/45/87/47/979458747.db2.gz WQYFTEKRSDANBT-UWVGGRQHSA-N 1 2 243.401 2.254 20 0 BEADLO Cc1ccc(Nc2cc3n(n2)CCO3)c(C)[nH+]1 ZINC001203369663 979462618 /nfs/dbraw/zinc/46/26/18/979462618.db2.gz RNEAXOWOTOCVQM-UHFFFAOYSA-N 1 2 230.271 2.031 20 0 BEADLO C[N@H+](CCO)Cc1c(F)ccc(Cl)c1F ZINC001236254268 979471832 /nfs/dbraw/zinc/47/18/32/979471832.db2.gz VQEYYSFOYJKZTC-UHFFFAOYSA-N 1 2 235.661 2.042 20 0 BEADLO C[N@@H+](CCO)Cc1c(F)ccc(Cl)c1F ZINC001236254268 979471838 /nfs/dbraw/zinc/47/18/38/979471838.db2.gz VQEYYSFOYJKZTC-UHFFFAOYSA-N 1 2 235.661 2.042 20 0 BEADLO C[C@H](c1nnc(C[NH+](C)C)o1)c1cccc(F)c1 ZINC001341627817 979496478 /nfs/dbraw/zinc/49/64/78/979496478.db2.gz PATIXIPSPHOKBG-VIFPVBQESA-N 1 2 249.289 2.422 20 0 BEADLO Nc1ccc(-c2ccc3cnoc3c2)c[nH+]1 ZINC001236313335 979520787 /nfs/dbraw/zinc/52/07/87/979520787.db2.gz OLSVOPXJKPYROT-UHFFFAOYSA-N 1 2 211.224 2.472 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1ccc(N)nc1 ZINC001236313741 979523421 /nfs/dbraw/zinc/52/34/21/979523421.db2.gz ZPSRUDOIDNGEMS-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO Nc1cnc2cc(-c3ccc(N)[nH+]c3)ccc2c1 ZINC001236318448 979532369 /nfs/dbraw/zinc/53/23/69/979532369.db2.gz XMPAYUADBMSUDN-UHFFFAOYSA-N 1 2 236.278 2.461 20 0 BEADLO CC(C)N(CC1CCC1)C(=O)C[C@H]([NH3+])C(F)F ZINC001341928425 979595468 /nfs/dbraw/zinc/59/54/68/979595468.db2.gz JNEGMDMPVABVOK-JTQLQIEISA-N 1 2 248.317 2.006 20 0 BEADLO Cc1ccc(-c2c[nH+]cn2C)c2c[nH]nc21 ZINC001236487367 979608986 /nfs/dbraw/zinc/60/89/86/979608986.db2.gz SMVJLMOSZRLDHR-UHFFFAOYSA-N 1 2 212.256 2.272 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)o1 ZINC001236593265 979672483 /nfs/dbraw/zinc/67/24/83/979672483.db2.gz ANLXWRPSGFOJLN-DCAQKATOSA-N 1 2 224.279 2.081 20 0 BEADLO Cc1nc(C)c(C[N@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)o1 ZINC001236593265 979672488 /nfs/dbraw/zinc/67/24/88/979672488.db2.gz ANLXWRPSGFOJLN-DCAQKATOSA-N 1 2 224.279 2.081 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCc3occc3C2)o1 ZINC001236595877 979673023 /nfs/dbraw/zinc/67/30/23/979673023.db2.gz YZDZBMROYFFNGO-UHFFFAOYSA-N 1 2 232.283 2.443 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCc3occc3C2)o1 ZINC001236595877 979673026 /nfs/dbraw/zinc/67/30/26/979673026.db2.gz YZDZBMROYFFNGO-UHFFFAOYSA-N 1 2 232.283 2.443 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCc3cccnc3C2)o1 ZINC001236592543 979673812 /nfs/dbraw/zinc/67/38/12/979673812.db2.gz CTULTIXJLCOTFQ-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCc3cccnc3C2)o1 ZINC001236592543 979673819 /nfs/dbraw/zinc/67/38/19/979673819.db2.gz CTULTIXJLCOTFQ-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCCCC23COC3)o1 ZINC001236590434 979673927 /nfs/dbraw/zinc/67/39/27/979673927.db2.gz AJFHOPJWMTVYCD-UHFFFAOYSA-N 1 2 236.315 2.046 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCCCC23COC3)o1 ZINC001236590434 979673938 /nfs/dbraw/zinc/67/39/38/979673938.db2.gz AJFHOPJWMTVYCD-UHFFFAOYSA-N 1 2 236.315 2.046 20 0 BEADLO Oc1cc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)ccc1F ZINC001236700291 979699037 /nfs/dbraw/zinc/69/90/37/979699037.db2.gz VTGCESNSPJBHGL-NHCYSSNCSA-N 1 2 239.265 2.321 20 0 BEADLO Oc1cc(C[N@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)ccc1F ZINC001236700291 979699044 /nfs/dbraw/zinc/69/90/44/979699044.db2.gz VTGCESNSPJBHGL-NHCYSSNCSA-N 1 2 239.265 2.321 20 0 BEADLO Cc1c(F)ccc(C[NH+]2CC(CO)C2)c1Cl ZINC001236712003 979704868 /nfs/dbraw/zinc/70/48/68/979704868.db2.gz PKCYXLLZUJDJDC-UHFFFAOYSA-N 1 2 243.709 2.212 20 0 BEADLO c1cc2c(cccc2C[N@@H+]2CCO[C@H]3C[C@H]32)o1 ZINC001236738973 979716764 /nfs/dbraw/zinc/71/67/64/979716764.db2.gz JVYFWKNWYXLOOX-OCCSQVGLSA-N 1 2 229.279 2.406 20 0 BEADLO c1cc2c(cccc2C[N@H+]2CCO[C@H]3C[C@H]32)o1 ZINC001236738973 979716774 /nfs/dbraw/zinc/71/67/74/979716774.db2.gz JVYFWKNWYXLOOX-OCCSQVGLSA-N 1 2 229.279 2.406 20 0 BEADLO c1cc(N2CCCC2)[nH+]cc1C[C@@H]1CCCO1 ZINC001250105132 979780522 /nfs/dbraw/zinc/78/05/22/979780522.db2.gz XPXWCKACWJSDNB-ZDUSSCGKSA-N 1 2 232.327 2.403 20 0 BEADLO COC(=O)C[N@H+](C)Cc1ccc2cccccc1-2 ZINC001237192050 979842172 /nfs/dbraw/zinc/84/21/72/979842172.db2.gz BVKRDQJYDMXYEQ-UHFFFAOYSA-N 1 2 243.306 2.396 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1ccc2cccccc1-2 ZINC001237192050 979842179 /nfs/dbraw/zinc/84/21/79/979842179.db2.gz BVKRDQJYDMXYEQ-UHFFFAOYSA-N 1 2 243.306 2.396 20 0 BEADLO COc1c(C)cccc1C[N@@H+]1CCC(=O)[C@H](C)C1 ZINC001237500335 979921063 /nfs/dbraw/zinc/92/10/63/979921063.db2.gz JIHVQSJMMZUZPL-GFCCVEGCSA-N 1 2 247.338 2.415 20 0 BEADLO COc1c(C)cccc1C[N@H+]1CCC(=O)[C@H](C)C1 ZINC001237500335 979921070 /nfs/dbraw/zinc/92/10/70/979921070.db2.gz JIHVQSJMMZUZPL-GFCCVEGCSA-N 1 2 247.338 2.415 20 0 BEADLO COc1c(C)cccc1C[N@@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001237505564 979923904 /nfs/dbraw/zinc/92/39/04/979923904.db2.gz HUFCHEVRECJJQP-ZIAGYGMSSA-N 1 2 247.338 2.367 20 0 BEADLO COc1c(C)cccc1C[N@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001237505564 979923910 /nfs/dbraw/zinc/92/39/10/979923910.db2.gz HUFCHEVRECJJQP-ZIAGYGMSSA-N 1 2 247.338 2.367 20 0 BEADLO c1[nH+]cn2ccnc(N3CC4CCC3CC4)c12 ZINC001342959849 979956032 /nfs/dbraw/zinc/95/60/32/979956032.db2.gz JJQKDYAYNTVMOO-UHFFFAOYSA-N 1 2 228.299 2.108 20 0 BEADLO Cc1coc(C[N@@H+]2CCC[C@@H](C(F)F)C2)n1 ZINC001237645343 979975407 /nfs/dbraw/zinc/97/54/07/979975407.db2.gz KRJATZOCCKHKGI-SECBINFHSA-N 1 2 230.258 2.460 20 0 BEADLO Cc1coc(C[N@H+]2CCC[C@@H](C(F)F)C2)n1 ZINC001237645343 979975416 /nfs/dbraw/zinc/97/54/16/979975416.db2.gz KRJATZOCCKHKGI-SECBINFHSA-N 1 2 230.258 2.460 20 0 BEADLO CCc1[nH]ncc1C[NH+]1CC2(C1)CCCC2 ZINC001237647707 980000104 /nfs/dbraw/zinc/00/01/04/980000104.db2.gz TVMCELTYVJNVBB-UHFFFAOYSA-N 1 2 219.332 2.348 20 0 BEADLO CCc1[nH]ncc1C[NH+]1CCC(C)(F)CC1 ZINC001237651248 980006282 /nfs/dbraw/zinc/00/62/82/980006282.db2.gz IUUZUQRDSKYKEB-UHFFFAOYSA-N 1 2 225.311 2.296 20 0 BEADLO CCc1[nH]ncc1C[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC001237652295 980011156 /nfs/dbraw/zinc/01/11/56/980011156.db2.gz QZNJJJWGTZUMAL-VIFPVBQESA-N 1 2 243.301 2.449 20 0 BEADLO CCc1[nH]ncc1C[N@@H+]1CCC(F)(F)[C@@H](C)C1 ZINC001237652295 980011144 /nfs/dbraw/zinc/01/11/44/980011144.db2.gz QZNJJJWGTZUMAL-VIFPVBQESA-N 1 2 243.301 2.449 20 0 BEADLO COc1nc(Cl)c(C[NH+]2CCCCC2)n1C ZINC001343143098 980020736 /nfs/dbraw/zinc/02/07/36/980020736.db2.gz MHUAOPHXEBLYGA-UHFFFAOYSA-N 1 2 243.738 2.068 20 0 BEADLO COc1ccc(C)c(C[NH+]2CC3(C2)CCCO3)c1 ZINC001237709751 980035211 /nfs/dbraw/zinc/03/52/11/980035211.db2.gz PUTISRRCKLHCDW-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO Cn1cc[nH+]c1CCCOC(=O)C1(C2CC2)CC1 ZINC001343419721 980101748 /nfs/dbraw/zinc/10/17/48/980101748.db2.gz DDHPKMDVUAOQGR-UHFFFAOYSA-N 1 2 248.326 2.086 20 0 BEADLO Cc1c[nH]c(CCNC(=O)[C@H]2CCC[C@H](C)C2)[nH+]1 ZINC001184510396 980102047 /nfs/dbraw/zinc/10/20/47/980102047.db2.gz FUNTXABHQLGLID-JQWIXIFHSA-N 1 2 249.358 2.203 20 0 BEADLO C[N@H+](Cc1cnc(F)cc1Cl)C1CC1 ZINC001238017075 980123183 /nfs/dbraw/zinc/12/31/83/980123183.db2.gz JXRPBSGTGNOLRL-UHFFFAOYSA-N 1 2 214.671 2.468 20 0 BEADLO C[N@@H+](Cc1cnc(F)cc1Cl)C1CC1 ZINC001238017075 980123191 /nfs/dbraw/zinc/12/31/91/980123191.db2.gz JXRPBSGTGNOLRL-UHFFFAOYSA-N 1 2 214.671 2.468 20 0 BEADLO Fc1cc(Cl)c(C[N@@H+]2C[C@@H]3C[C@@H]3C2)cn1 ZINC001238017545 980123794 /nfs/dbraw/zinc/12/37/94/980123794.db2.gz MDGSOUKDDHSETD-OCAPTIKFSA-N 1 2 226.682 2.326 20 0 BEADLO Fc1cc(Cl)c(C[N@H+]2C[C@@H]3C[C@@H]3C2)cn1 ZINC001238017545 980123798 /nfs/dbraw/zinc/12/37/98/980123798.db2.gz MDGSOUKDDHSETD-OCAPTIKFSA-N 1 2 226.682 2.326 20 0 BEADLO CC[N@H+](CCOC)Cc1cnc(F)cc1Cl ZINC001238021318 980129105 /nfs/dbraw/zinc/12/91/05/980129105.db2.gz BSDBTQOCHGGQDA-UHFFFAOYSA-N 1 2 246.713 2.342 20 0 BEADLO CC[N@@H+](CCOC)Cc1cnc(F)cc1Cl ZINC001238021318 980129107 /nfs/dbraw/zinc/12/91/07/980129107.db2.gz BSDBTQOCHGGQDA-UHFFFAOYSA-N 1 2 246.713 2.342 20 0 BEADLO CCOc1cc(C[NH+]2CCOCC2)ccc1C ZINC001238066852 980136186 /nfs/dbraw/zinc/13/61/86/980136186.db2.gz AHZJDDFGCSQBKZ-UHFFFAOYSA-N 1 2 235.327 2.226 20 0 BEADLO Cc1ncncc1C[NH+]1Cc2ccccc2C1 ZINC001238164637 980190135 /nfs/dbraw/zinc/19/01/35/980190135.db2.gz MZGPCFGXAPKFQG-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO Cc1ncncc1C[NH+]1CC2(C1)CC(F)(F)C2 ZINC001238162853 980193460 /nfs/dbraw/zinc/19/34/60/980193460.db2.gz CFSILZXSYICMFA-UHFFFAOYSA-N 1 2 239.269 2.016 20 0 BEADLO Cc1cocc1C(=O)OCCCc1c[nH+]cn1C ZINC001343733569 980227641 /nfs/dbraw/zinc/22/76/41/980227641.db2.gz OGVQKIOXWOVAKZ-UHFFFAOYSA-N 1 2 248.282 2.111 20 0 BEADLO Cc1cc(C[N@@H+]2CCCOCC2)ncc1Cl ZINC001238427239 980255947 /nfs/dbraw/zinc/25/59/47/980255947.db2.gz PASTUTCHFCDRLE-UHFFFAOYSA-N 1 2 240.734 2.266 20 0 BEADLO Cc1cc(C[N@H+]2CCCOCC2)ncc1Cl ZINC001238427239 980255954 /nfs/dbraw/zinc/25/59/54/980255954.db2.gz PASTUTCHFCDRLE-UHFFFAOYSA-N 1 2 240.734 2.266 20 0 BEADLO Cc1cnc(C[N@@H+]2C[C@H]3CC[C@@H]2CO3)c(C)c1 ZINC001238437344 980261064 /nfs/dbraw/zinc/26/10/64/980261064.db2.gz LWVBAPUZLPBKRR-CHWSQXEVSA-N 1 2 232.327 2.062 20 0 BEADLO Cc1cnc(C[N@H+]2C[C@H]3CC[C@@H]2CO3)c(C)c1 ZINC001238437344 980261076 /nfs/dbraw/zinc/26/10/76/980261076.db2.gz LWVBAPUZLPBKRR-CHWSQXEVSA-N 1 2 232.327 2.062 20 0 BEADLO CCc1cc(C[N@@H+]2CCC[C@@H]2CF)on1 ZINC001203232130 980305448 /nfs/dbraw/zinc/30/54/48/980305448.db2.gz PKULSARQNKVSLH-SNVBAGLBSA-N 1 2 212.268 2.171 20 0 BEADLO CCc1cc(C[N@H+]2CCC[C@@H]2CF)on1 ZINC001203232130 980305455 /nfs/dbraw/zinc/30/54/55/980305455.db2.gz PKULSARQNKVSLH-SNVBAGLBSA-N 1 2 212.268 2.171 20 0 BEADLO C[NH+]1CC(NC(=O)CC2CCC(C)(C)CC2)C1 ZINC001185974937 980309155 /nfs/dbraw/zinc/30/91/55/980309155.db2.gz HKJCHTBUHKJCIS-UHFFFAOYSA-N 1 2 238.375 2.023 20 0 BEADLO CCOc1ccc(C)c(C[N@H+]2C[C@H]3C[C@@H](C2)O3)c1 ZINC001238707742 980313071 /nfs/dbraw/zinc/31/30/71/980313071.db2.gz JYERFMWSENPGQK-GASCZTMLSA-N 1 2 247.338 2.367 20 0 BEADLO CCOc1ccc(C)c(C[N@@H+]2C[C@H]3C[C@@H](C2)O3)c1 ZINC001238707742 980313084 /nfs/dbraw/zinc/31/30/84/980313084.db2.gz JYERFMWSENPGQK-GASCZTMLSA-N 1 2 247.338 2.367 20 0 BEADLO Cc1cn2cc(/C=C/C(C)(C)O)ccc2[nH+]1 ZINC001239157147 980471345 /nfs/dbraw/zinc/47/13/45/980471345.db2.gz XXYLKRYGOMFMKI-VOTSOKGWSA-N 1 2 216.284 2.427 20 0 BEADLO CCn1c[nH+]cc1COC(=O)C[C@@H](C)C1CC1 ZINC001344971233 980509419 /nfs/dbraw/zinc/50/94/19/980509419.db2.gz HUWHRUYKWNQMQY-SNVBAGLBSA-N 1 2 236.315 2.382 20 0 BEADLO CCCSCC(=O)OCc1c[nH+]cn1CC ZINC001344970641 980509575 /nfs/dbraw/zinc/50/95/75/980509575.db2.gz CSDUDRZXWIWRGX-UHFFFAOYSA-N 1 2 242.344 2.089 20 0 BEADLO c1cn(Cc2ccccc2C2=CCOC2)c[nH+]1 ZINC001239486914 980639653 /nfs/dbraw/zinc/63/96/53/980639653.db2.gz VQUSNPLPZAFUHH-UHFFFAOYSA-N 1 2 226.279 2.345 20 0 BEADLO CCn1c[nH+]cc1COC(=O)C1CC2(CC2)C1 ZINC001345609516 980645929 /nfs/dbraw/zinc/64/59/29/980645929.db2.gz FEFYSYXRANGMPT-UHFFFAOYSA-N 1 2 234.299 2.136 20 0 BEADLO COc1ncc(-c2c[nH+]c(N)c(C)c2)cc1F ZINC001239511749 980683904 /nfs/dbraw/zinc/68/39/04/980683904.db2.gz HJZYOBZSIGJQGD-UHFFFAOYSA-N 1 2 233.246 2.182 20 0 BEADLO CNc1cc(-c2cnc(OC)c(F)c2)cc[nH+]1 ZINC001239518033 980689918 /nfs/dbraw/zinc/68/99/18/980689918.db2.gz GJFSWPKXZLJXJT-UHFFFAOYSA-N 1 2 233.246 2.333 20 0 BEADLO Cc1cc(NC(=O)N[C@H](C)C2(C)CC2)c(C)c[nH+]1 ZINC001345842168 980696020 /nfs/dbraw/zinc/69/60/20/980696020.db2.gz FFTNGQKTFQFBEY-LLVKDONJSA-N 1 2 247.342 2.430 20 0 BEADLO C[NH+]1CC(NC(=O)c2cccc(C(C)(C)C)c2)C1 ZINC001188984481 980727553 /nfs/dbraw/zinc/72/75/53/980727553.db2.gz OBWRMVLFVUSBHO-UHFFFAOYSA-N 1 2 246.354 2.028 20 0 BEADLO COCc1cccc(CCn2cc[nH+]c2)c1 ZINC001250314979 980752692 /nfs/dbraw/zinc/75/26/92/980752692.db2.gz AERNTRDJTYCGQO-UHFFFAOYSA-N 1 2 216.284 2.272 20 0 BEADLO Cn1cc(CCn2cc[nH+]c2)c2ccncc21 ZINC001250320568 980762567 /nfs/dbraw/zinc/76/25/67/980762567.db2.gz PFDRAFOVVBMWOG-UHFFFAOYSA-N 1 2 226.283 2.013 20 0 BEADLO C[C@@H]1CC/C(=C\c2nnc(C[NH+](C)C)o2)C1 ZINC001346624928 980870321 /nfs/dbraw/zinc/87/03/21/980870321.db2.gz CZEUWDUPRIECIJ-YIXGCBLDSA-N 1 2 221.304 2.335 20 0 BEADLO C[C@@H]1CC/C(=C/c2nnc(C[NH+](C)C)o2)C1 ZINC001346624926 980870740 /nfs/dbraw/zinc/87/07/40/980870740.db2.gz CZEUWDUPRIECIJ-SBMLRHLQSA-N 1 2 221.304 2.335 20 0 BEADLO CCc1nc(OC)ccc1-c1c[nH+]cn1C ZINC001239772854 980908759 /nfs/dbraw/zinc/90/87/59/980908759.db2.gz QMNZGBKMVKERAM-UHFFFAOYSA-N 1 2 217.272 2.053 20 0 BEADLO CC(C)OCCc1ccc2[nH+]ccn2c1 ZINC001250403574 980940455 /nfs/dbraw/zinc/94/04/55/980940455.db2.gz DYDHRZQQHMWWIM-UHFFFAOYSA-N 1 2 204.273 2.302 20 0 BEADLO C[C@H]([NH2+]Cc1ncn[nH]1)[C@H]1CCC[C@@H](C)C1 ZINC001347122099 980981328 /nfs/dbraw/zinc/98/13/28/980981328.db2.gz VXGHEVCKOKRGFR-VWYCJHECSA-N 1 2 222.336 2.109 20 0 BEADLO NC(=O)c1cccc(-c2ccn3cc[nH+]c3c2)c1 ZINC001239882296 981018782 /nfs/dbraw/zinc/01/87/82/981018782.db2.gz AIBWADGBCSYQCY-UHFFFAOYSA-N 1 2 237.262 2.100 20 0 BEADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)NC1CC1 ZINC001191442138 981034743 /nfs/dbraw/zinc/03/47/43/981034743.db2.gz GDJHNEXRIHQSIM-UHFFFAOYSA-N 1 2 242.282 2.156 20 0 BEADLO Cc1ccncc1-c1ccn2cc(N)[nH+]c2c1 ZINC001239974713 981078443 /nfs/dbraw/zinc/07/84/43/981078443.db2.gz YWNSGAWBVKCVCM-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO c1c2c(cc3[nH+]c([C@H]4CCOC4)[nH]c13)OCC2 ZINC001250432809 981079651 /nfs/dbraw/zinc/07/96/51/981079651.db2.gz AJVFAWGPPDVTGC-VIFPVBQESA-N 1 2 230.267 2.002 20 0 BEADLO Cc1nn(C)c(C)c1-c1c[nH+]c(N(C)C)cc1C ZINC001240143940 981143899 /nfs/dbraw/zinc/14/38/99/981143899.db2.gz GDYZTYRXTGKWPN-UHFFFAOYSA-N 1 2 244.342 2.473 20 0 BEADLO CCc1nccc(-c2ccc3[nH+]ccn3c2)n1 ZINC001240213316 981160795 /nfs/dbraw/zinc/16/07/95/981160795.db2.gz CDPKPMCJPWDTPD-UHFFFAOYSA-N 1 2 224.267 2.354 20 0 BEADLO COc1ccc(-c2ccc3[nH+]ccn3c2)nc1 ZINC001240213867 981161436 /nfs/dbraw/zinc/16/14/36/981161436.db2.gz DXFBBZNGIABWAG-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO CN(C)c1ccc(-c2ccc3[nH+]ccn3c2)cn1 ZINC001240217983 981164412 /nfs/dbraw/zinc/16/44/12/981164412.db2.gz VANMQFHUFHLFLW-UHFFFAOYSA-N 1 2 238.294 2.462 20 0 BEADLO c1cn2cc(-c3cccc4n[nH]nc43)ccc2[nH+]1 ZINC001240218125 981167220 /nfs/dbraw/zinc/16/72/20/981167220.db2.gz BTVRIXXLAWLVRW-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO Cn1nnc2cc(-c3ccc4[nH+]ccn4c3)ccc21 ZINC001240218751 981169290 /nfs/dbraw/zinc/16/92/90/981169290.db2.gz XJEKLHMRQUKAHV-UHFFFAOYSA-N 1 2 249.277 2.283 20 0 BEADLO CCc1ncc(-c2ccc3[nH+]ccn3c2)cn1 ZINC001240219569 981169715 /nfs/dbraw/zinc/16/97/15/981169715.db2.gz NZSAKKXAAWRLBE-UHFFFAOYSA-N 1 2 224.267 2.354 20 0 BEADLO CN(C)c1ncccc1-c1ccc2[nH+]ccn2c1 ZINC001240218629 981171770 /nfs/dbraw/zinc/17/17/70/981171770.db2.gz GSDPBFVMAVLDJP-UHFFFAOYSA-N 1 2 238.294 2.462 20 0 BEADLO Cn1c[nH+]cc1-c1cccc(-c2cn[nH]c2)c1 ZINC001240241282 981212659 /nfs/dbraw/zinc/21/26/59/981212659.db2.gz LHPJIBOJLOGSQF-UHFFFAOYSA-N 1 2 224.267 2.477 20 0 BEADLO CCn1c[nH+]cc1COC(=O)CCC(C)C ZINC001347973662 981231950 /nfs/dbraw/zinc/23/19/50/981231950.db2.gz VHRBJCFBAFSYLL-UHFFFAOYSA-N 1 2 224.304 2.382 20 0 BEADLO Cn1cc(-c2ccc(-c3c[nH+]cn3C)cc2)cn1 ZINC001240296176 981248217 /nfs/dbraw/zinc/24/82/17/981248217.db2.gz IJTIXLWHGPXTOX-UHFFFAOYSA-N 1 2 238.294 2.488 20 0 BEADLO CCc1ccc(N2CCC[C@@](C)(O)CC2)[nH+]c1 ZINC001348136870 981294019 /nfs/dbraw/zinc/29/40/19/981294019.db2.gz CVQMVQNNPJFTLC-CQSZACIVSA-N 1 2 234.343 2.385 20 0 BEADLO Cn1cc[nH+]c1CCC(=O)N[C@H]1CCC(C)(C)C1 ZINC001348186928 981306665 /nfs/dbraw/zinc/30/66/65/981306665.db2.gz AWHHTIQWWBDFKT-NSHDSACASA-N 1 2 249.358 2.048 20 0 BEADLO CCc1ccc(N2CCC[C@H](CO)[C@@H]2C)[nH+]c1 ZINC001348214939 981310997 /nfs/dbraw/zinc/31/09/97/981310997.db2.gz PJHXKYPNYZXXAI-WCQYABFASA-N 1 2 234.343 2.241 20 0 BEADLO CCc1ccc(N2CCC[C@@H](CO)[C@@H]2C)[nH+]c1 ZINC001348214937 981311706 /nfs/dbraw/zinc/31/17/06/981311706.db2.gz PJHXKYPNYZXXAI-AAEUAGOBSA-N 1 2 234.343 2.241 20 0 BEADLO c1cn2c(cccc2-c2ccc3ncnn3c2)[nH+]1 ZINC001240354781 981311915 /nfs/dbraw/zinc/31/19/15/981311915.db2.gz CSLUMBCRVUTVSV-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO Cc1[nH]c(CNc2nc(C)ncc2C)[nH+]c1C ZINC001348310982 981331461 /nfs/dbraw/zinc/33/14/61/981331461.db2.gz GBBJPDDAGGHVGS-UHFFFAOYSA-N 1 2 231.303 2.045 20 0 BEADLO CCc1ccc(N2C3CCC2(CO)CC3)[nH+]c1 ZINC001348323475 981334332 /nfs/dbraw/zinc/33/43/32/981334332.db2.gz ITSLAFCKOZDWQX-UHFFFAOYSA-N 1 2 232.327 2.138 20 0 BEADLO Cc1cn2c(cccc2-c2cnn(C)c2C)[nH+]1 ZINC001240381115 981339147 /nfs/dbraw/zinc/33/91/47/981339147.db2.gz XILSOIOPMFKVBH-UHFFFAOYSA-N 1 2 226.283 2.352 20 0 BEADLO c1cc(C[NH2+][C@H]2CCCc3ncccc32)no1 ZINC001348559089 981391797 /nfs/dbraw/zinc/39/17/97/981391797.db2.gz CGQGRXRDIBILHJ-ZDUSSCGKSA-N 1 2 229.283 2.237 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C)n[nH]2)C[C@H](CC)O1 ZINC001348634647 981412968 /nfs/dbraw/zinc/41/29/68/981412968.db2.gz VOTFCJNBXWBLEZ-BETUJISGSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C)n[nH]2)C[C@H](CC)O1 ZINC001348634647 981412971 /nfs/dbraw/zinc/41/29/71/981412971.db2.gz VOTFCJNBXWBLEZ-BETUJISGSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1cc(C)c(-c2ccn3cc[nH+]c3c2)nn1 ZINC001240496035 981415725 /nfs/dbraw/zinc/41/57/25/981415725.db2.gz DJHPGYTXGDJZLM-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO CCCCOC(=O)NCc1c[nH+]cn1C(C)C ZINC001193727534 981416294 /nfs/dbraw/zinc/41/62/94/981416294.db2.gz RNGXEYYIYMVJCJ-UHFFFAOYSA-N 1 2 239.319 2.490 20 0 BEADLO Cc1ncnc(-c2ccn3cc[nH+]c3c2)c1F ZINC001240496719 981417167 /nfs/dbraw/zinc/41/71/67/981417167.db2.gz RLBDWFWCUIZQFJ-UHFFFAOYSA-N 1 2 228.230 2.239 20 0 BEADLO CCc1nc(-c2ccn3cc[nH+]c3c2)ncc1F ZINC001240496746 981417758 /nfs/dbraw/zinc/41/77/58/981417758.db2.gz HRAJAORRLFMURV-UHFFFAOYSA-N 1 2 242.257 2.493 20 0 BEADLO COc1cccc(-c2ccn3cc[nH+]c3c2)n1 ZINC001240496443 981418722 /nfs/dbraw/zinc/41/87/22/981418722.db2.gz OFAWVWBQQYMRGX-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO Cc1ccnnc1-c1ccn2cc[nH+]c2c1 ZINC001240496705 981418772 /nfs/dbraw/zinc/41/87/72/981418772.db2.gz RCWNEYXALURRID-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO C[N@H+](CCCO)Cc1nccc(Cl)c1Cl ZINC001193743175 981423781 /nfs/dbraw/zinc/42/37/81/981423781.db2.gz KCPNWYJVHVMMKB-UHFFFAOYSA-N 1 2 249.141 2.203 20 0 BEADLO C[N@@H+](CCCO)Cc1nccc(Cl)c1Cl ZINC001193743175 981423786 /nfs/dbraw/zinc/42/37/86/981423786.db2.gz KCPNWYJVHVMMKB-UHFFFAOYSA-N 1 2 249.141 2.203 20 0 BEADLO c1cn2ccc(-c3cccn4ncnc34)cc2[nH+]1 ZINC001240502980 981431928 /nfs/dbraw/zinc/43/19/28/981431928.db2.gz DCYOLECZJGPKBJ-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO O=C1Cc2ccc(-c3ccn4cc[nH+]c4c3)cc2N1 ZINC001240509122 981433544 /nfs/dbraw/zinc/43/35/44/981433544.db2.gz RRAOZWWPQFDUIV-UHFFFAOYSA-N 1 2 249.273 2.496 20 0 BEADLO c1cn2ccc(-c3cccc4n[nH]nc43)cc2[nH+]1 ZINC001240510273 981434346 /nfs/dbraw/zinc/43/43/46/981434346.db2.gz GLDZNUKRFGSYOC-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO c1cn2ccc(-c3cccc4ncnn43)cc2[nH+]1 ZINC001240508881 981434597 /nfs/dbraw/zinc/43/45/97/981434597.db2.gz OABMWJUYFNZBMG-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO c1cn2ccc(-c3ccnc4[nH]cnc43)cc2[nH+]1 ZINC001240510484 981436076 /nfs/dbraw/zinc/43/60/76/981436076.db2.gz LYMKDMXFQJNKCI-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO C=Cc1ncc(-c2ccn3cc[nH+]c3c2)cn1 ZINC001240517932 981447653 /nfs/dbraw/zinc/44/76/53/981447653.db2.gz IZALKAJYQXMRSB-UHFFFAOYSA-N 1 2 222.251 2.434 20 0 BEADLO Cc1n[nH]cc1-c1ccc2[nH+]ccn2c1C ZINC001240522896 981455267 /nfs/dbraw/zinc/45/52/67/981455267.db2.gz LKZMKIGYTHLBJA-UHFFFAOYSA-N 1 2 212.256 2.341 20 0 BEADLO CNC(=O)c1ccc(-c2cc[nH+]c(NC)c2)cc1 ZINC001240570783 981485691 /nfs/dbraw/zinc/48/56/91/981485691.db2.gz IDQKUBVJXZIIHF-UHFFFAOYSA-N 1 2 241.294 2.150 20 0 BEADLO CCCC1(C(=O)NCCc2[nH+]ccn2C)CCC1 ZINC001349264693 981522642 /nfs/dbraw/zinc/52/26/42/981522642.db2.gz QFBJGBDJOYFTAU-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO CCCOC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001194094443 981567571 /nfs/dbraw/zinc/56/75/71/981567571.db2.gz ZSWIDEPNOHIWTP-UHFFFAOYSA-N 1 2 219.244 2.293 20 0 BEADLO c1cc(-c2cnc(C3CC3)nc2)c2c([nH+]1)NCC2 ZINC001240685753 981590075 /nfs/dbraw/zinc/59/00/75/981590075.db2.gz BYFZTGHLIPRNPF-UHFFFAOYSA-N 1 2 238.294 2.384 20 0 BEADLO CCn1nccc1-c1ccn2cc[nH+]c2c1 ZINC001240695501 981603381 /nfs/dbraw/zinc/60/33/81/981603381.db2.gz KFRVHRXJVIKKBB-UHFFFAOYSA-N 1 2 212.256 2.218 20 0 BEADLO C/C(=C\C=C\[NH3+])C1=CCC2(CC1)OCCO2 ZINC001240707588 981668138 /nfs/dbraw/zinc/66/81/38/981668138.db2.gz KMRMSOUGNSGNRB-GGBREQKCSA-N 1 2 221.300 2.259 20 0 BEADLO CCN(C(=O)Oc1ccc(C)cc1)C1C[NH+](C)C1 ZINC001194452759 981811326 /nfs/dbraw/zinc/81/13/26/981811326.db2.gz XJSPEUJRKFVFNN-UHFFFAOYSA-N 1 2 248.326 2.130 20 0 BEADLO C[N@H+](Cc1cnoc1)Cc1cccc(O)c1 ZINC001205670628 981846168 /nfs/dbraw/zinc/84/61/68/981846168.db2.gz RUQAZUCUUDELGP-UHFFFAOYSA-N 1 2 218.256 2.012 20 0 BEADLO C[N@@H+](Cc1cnoc1)Cc1cccc(O)c1 ZINC001205670628 981846178 /nfs/dbraw/zinc/84/61/78/981846178.db2.gz RUQAZUCUUDELGP-UHFFFAOYSA-N 1 2 218.256 2.012 20 0 BEADLO Nc1cc(COC(=O)[C@@H]2CCC[C@@H]3C[C@@H]32)cc[nH+]1 ZINC001350087652 981865672 /nfs/dbraw/zinc/86/56/72/981865672.db2.gz AMCFKLZQMDXTHC-UTUOFQBUSA-N 1 2 246.310 2.143 20 0 BEADLO CCn1c[nH+]cc1COC(=O)CCCSC ZINC001350333567 981930169 /nfs/dbraw/zinc/93/01/69/981930169.db2.gz JNUQNMSIWAPWIH-UHFFFAOYSA-N 1 2 242.344 2.089 20 0 BEADLO CC1(C)C[C@H]1CNC(=O)c1cccc2[nH+]ccn21 ZINC001585740293 981942593 /nfs/dbraw/zinc/94/25/93/981942593.db2.gz INFOPNPMMHABDO-JTQLQIEISA-N 1 2 243.310 2.110 20 0 BEADLO C[C@@H](O)[C@H](C)[NH2+]CC(F)(F)c1ccc(F)cc1 ZINC001350434900 981977012 /nfs/dbraw/zinc/97/70/12/981977012.db2.gz ZORYPNOILYDGOX-DTWKUNHWSA-N 1 2 247.260 2.276 20 0 BEADLO c1cn2cc(-c3cnn4cccnc34)ccc2[nH+]1 ZINC001240928814 982003451 /nfs/dbraw/zinc/00/34/51/982003451.db2.gz IRKJKXWQLCTBAD-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO Cc1coc(C(=O)Nc2ccc3[nH+]ccn3c2)c1 ZINC001586807961 982024879 /nfs/dbraw/zinc/02/48/79/982024879.db2.gz IEMAHPCHGVPZCZ-UHFFFAOYSA-N 1 2 241.250 2.488 20 0 BEADLO COC(=[NH2+])c1cccc(-c2ccn(C)c(=O)c2)c1 ZINC001240991729 982079916 /nfs/dbraw/zinc/07/99/16/982079916.db2.gz TVMAKVDTDVWNEC-UHFFFAOYSA-N 1 2 242.278 2.024 20 0 BEADLO CCC[C@@H](C)CCNC(=O)[C@H](C)n1cc[nH+]c1 ZINC001350847082 982102555 /nfs/dbraw/zinc/10/25/55/982102555.db2.gz GNNGOFGHKISKHK-NEPJUHHUSA-N 1 2 237.347 2.387 20 0 BEADLO Cc1ccc(-c2ccc[nH+]c2N)c(O)c1 ZINC001241037717 982141702 /nfs/dbraw/zinc/14/17/02/982141702.db2.gz GLPAYRQHVIEYOZ-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO Cc1ccc(-c2cc[nH+]c(N)c2)c(O)c1 ZINC001241043850 982146035 /nfs/dbraw/zinc/14/60/35/982146035.db2.gz ZUDJGSSINIRMKJ-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO c1cnc(C[NH+]2CCC(OC3CCC3)CC2)nc1 ZINC001195269703 982164434 /nfs/dbraw/zinc/16/44/34/982164434.db2.gz OSRZWVSBNCPBDG-UHFFFAOYSA-N 1 2 247.342 2.010 20 0 BEADLO Cc1ccc(-c2ccc(O)cc2)[nH+]c1N ZINC001241061439 982165488 /nfs/dbraw/zinc/16/54/88/982165488.db2.gz IMQUXFRVVCMSLZ-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO Cc1cc(-c2ccc[nH]c2=O)c2[nH+]ccn2c1 ZINC001241118687 982241526 /nfs/dbraw/zinc/24/15/26/982241526.db2.gz HJWUJVBFTSZIMJ-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO Cc1ccccc1N(C)C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001351279670 982257515 /nfs/dbraw/zinc/25/75/15/982257515.db2.gz QSNBZGJHCLGART-GFCCVEGCSA-N 1 2 243.310 2.416 20 0 BEADLO CCCCC1(C(=O)N[C@H](C)Cn2cc[nH+]c2)CC1 ZINC001351289356 982266928 /nfs/dbraw/zinc/26/69/28/982266928.db2.gz SNKJBINQRXLHNK-GFCCVEGCSA-N 1 2 249.358 2.358 20 0 BEADLO Nc1cc(-c2ccc3cnncc3c2)cc[nH+]1 ZINC001241163607 982308229 /nfs/dbraw/zinc/30/82/29/982308229.db2.gz WZMKSGGSQHETJY-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO C[S@@](=N)(=O)c1ccc(-c2cc[nH+]c(N)c2)cc1 ZINC001241169913 982312847 /nfs/dbraw/zinc/31/28/47/982312847.db2.gz QXQRINGEXYEXQV-QGZVFWFLSA-N 1 2 247.323 2.366 20 0 BEADLO Nc1cc(-c2ccc(=O)n(C3CCC3)c2)cc[nH+]1 ZINC001241175745 982321661 /nfs/dbraw/zinc/32/16/61/982321661.db2.gz LDBGCENOZPVRRI-UHFFFAOYSA-N 1 2 241.294 2.218 20 0 BEADLO Nc1cc(-c2ccccc2C2OCCO2)cc[nH+]1 ZINC001241171183 982323575 /nfs/dbraw/zinc/32/35/75/982323575.db2.gz WZAXTDUKARDXNJ-UHFFFAOYSA-N 1 2 242.278 2.376 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@H+](C)Cc1ncoc1C(C)C ZINC001351737554 982368010 /nfs/dbraw/zinc/36/80/10/982368010.db2.gz YNASGILCDQZOGG-VXGBXAGGSA-N 1 2 238.331 2.407 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@@H+](C)Cc1ncoc1C(C)C ZINC001351737554 982368019 /nfs/dbraw/zinc/36/80/19/982368019.db2.gz YNASGILCDQZOGG-VXGBXAGGSA-N 1 2 238.331 2.407 20 0 BEADLO Nc1cn2ccc(-c3ccncc3F)cc2[nH+]1 ZINC001241226193 982370611 /nfs/dbraw/zinc/37/06/11/982370611.db2.gz PTGPQYGDMMPMSC-UHFFFAOYSA-N 1 2 228.230 2.118 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1ncccc1N ZINC001241228849 982381931 /nfs/dbraw/zinc/38/19/31/982381931.db2.gz TWWXWONLBJTFNW-UHFFFAOYSA-N 1 2 228.299 2.100 20 0 BEADLO CC[C@@H](C)C[C@@H](C)NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC000080691988 982486256 /nfs/dbraw/zinc/48/62/56/982486256.db2.gz NEZJMMYIHAFUEI-IJLUTSLNSA-N 1 2 237.347 2.385 20 0 BEADLO CN(C)c1ccc(-c2ccn3cc[nH+]c3c2)cn1 ZINC001241369513 982530292 /nfs/dbraw/zinc/53/02/92/982530292.db2.gz FCJBPJGELDBLEU-UHFFFAOYSA-N 1 2 238.294 2.462 20 0 BEADLO Nc1[nH+]cccc1-c1cnc2cccnc2c1 ZINC001241384389 982544032 /nfs/dbraw/zinc/54/40/32/982544032.db2.gz TXAQNXMPIXJQMO-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO COc1cc(-c2c[nH+]cn2C)ccc1F ZINC001241418182 982555822 /nfs/dbraw/zinc/55/58/22/982555822.db2.gz GFFAEGOYEYXMTO-UHFFFAOYSA-N 1 2 206.220 2.235 20 0 BEADLO COc1ncc(-c2cccc3[nH+]ccn32)s1 ZINC001241413303 982560908 /nfs/dbraw/zinc/56/09/08/982560908.db2.gz RSBYRPMLIYZLJZ-UHFFFAOYSA-N 1 2 231.280 2.466 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cccc2c1cnn2C ZINC001241451048 982605279 /nfs/dbraw/zinc/60/52/79/982605279.db2.gz ZOENSWGFFSMVCE-DXNUHORPSA-N 1 2 213.284 2.449 20 0 BEADLO C[S@@](=O)c1ccc(-c2ccc[nH+]c2N)cc1 ZINC001241483673 982637352 /nfs/dbraw/zinc/63/73/52/982637352.db2.gz YNPXBOCSUNTXQR-MRXNPFEDSA-N 1 2 232.308 2.068 20 0 BEADLO Cc1cc(-c2c[nH+]cn2C)cc2c[nH]nc21 ZINC001241513956 982675530 /nfs/dbraw/zinc/67/55/30/982675530.db2.gz GKXYRLGDZWQEKJ-UHFFFAOYSA-N 1 2 212.256 2.272 20 0 BEADLO CC[C@@H](C)CNC(=S)Nc1cc[nH+]c(C)c1 ZINC001200242817 982736783 /nfs/dbraw/zinc/73/67/83/982736783.db2.gz UBJMQEWAPLSAJD-SECBINFHSA-N 1 2 237.372 2.144 20 0 BEADLO C[C@H]1CCC(F)(F)C[N@@H+]1CCC1(O)CCC1 ZINC001198642454 982814524 /nfs/dbraw/zinc/81/45/24/982814524.db2.gz ZRIONOQOLUWYSZ-JTQLQIEISA-N 1 2 233.302 2.411 20 0 BEADLO C[C@H]1CCC(F)(F)C[N@H+]1CCC1(O)CCC1 ZINC001198642454 982814526 /nfs/dbraw/zinc/81/45/26/982814526.db2.gz ZRIONOQOLUWYSZ-JTQLQIEISA-N 1 2 233.302 2.411 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc(C(=O)NC2CC2)cc1 ZINC001241595168 982836062 /nfs/dbraw/zinc/83/60/62/982836062.db2.gz LEIWFNSZWMESRY-NXOFHUPFSA-N 1 2 242.322 2.455 20 0 BEADLO Cn1cc2ccc(-c3nc4[nH]ccc4c[nH+]3)cc2n1 ZINC001241598628 982840101 /nfs/dbraw/zinc/84/01/01/982840101.db2.gz WRWNNUKZKNLNRV-UHFFFAOYSA-N 1 2 249.277 2.463 20 0 BEADLO CC(C)CC[C@H](O)C[NH2+]CC(F)(F)C(F)F ZINC001353338215 982841549 /nfs/dbraw/zinc/84/15/49/982841549.db2.gz DHZHCBKOJHHREH-QMMMGPOBSA-N 1 2 245.260 2.274 20 0 BEADLO CCOc1ccc(-c2c[nH+]c(N)c(C)c2)cn1 ZINC001241704545 982965192 /nfs/dbraw/zinc/96/51/92/982965192.db2.gz NSTVNWRIKZVUQJ-UHFFFAOYSA-N 1 2 229.283 2.433 20 0 BEADLO CCOc1ccc(/C(C)=C/C=C/[NH3+])cn1 ZINC001241704505 982967665 /nfs/dbraw/zinc/96/76/65/982967665.db2.gz LOXVKSRUNAVWGQ-DXNUHORPSA-N 1 2 204.273 2.356 20 0 BEADLO O=C(C1=CC=CC1)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC001199694385 982995521 /nfs/dbraw/zinc/99/55/21/982995521.db2.gz ZLXYDHAYQPJQLP-GFCCVEGCSA-N 1 2 243.310 2.002 20 0 BEADLO CCc1cc(NC(=S)N[C@@H](C)CC)cc[nH+]1 ZINC001200475176 983039414 /nfs/dbraw/zinc/03/94/14/983039414.db2.gz OVIOWEZDHHTVNC-VIFPVBQESA-N 1 2 237.372 2.151 20 0 BEADLO Nc1cn2ccc(-c3ccc(F)cn3)cc2[nH+]1 ZINC001241808308 983063770 /nfs/dbraw/zinc/06/37/70/983063770.db2.gz YIJNKAQRPGSWJY-UHFFFAOYSA-N 1 2 228.230 2.118 20 0 BEADLO COc1cc[nH+]cc1NC[C@H](O)c1ccccc1 ZINC001251979306 983065376 /nfs/dbraw/zinc/06/53/76/983065376.db2.gz GFEPIGKOMCXOHH-ZDUSSCGKSA-N 1 2 244.294 2.236 20 0 BEADLO c1cn(-c2ccnc(-c3cscn3)c2)c[nH+]1 ZINC001241889751 983103472 /nfs/dbraw/zinc/10/34/72/983103472.db2.gz ZLAQYGYTDDHGPI-UHFFFAOYSA-N 1 2 228.280 2.391 20 0 BEADLO CC(C)(C)NC(=S)Nc1cccc2[nH+]ccn21 ZINC001200893203 983106250 /nfs/dbraw/zinc/10/62/50/983106250.db2.gz ZSNRGEGEXBAQOD-UHFFFAOYSA-N 1 2 248.355 2.419 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1CC[C@H]1C(C)(C)C ZINC001353979576 983108683 /nfs/dbraw/zinc/10/86/83/983108683.db2.gz VPEATUXGFXNESD-JQWIXIFHSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1CC[C@H]1C(C)(C)C ZINC001353979576 983108690 /nfs/dbraw/zinc/10/86/90/983108690.db2.gz VPEATUXGFXNESD-JQWIXIFHSA-N 1 2 249.358 2.235 20 0 BEADLO Nc1ccc(Nc2c(O)cc(F)cc2F)c[nH+]1 ZINC001201283673 983155876 /nfs/dbraw/zinc/15/58/76/983155876.db2.gz CXHMWHSZWBOTMB-UHFFFAOYSA-N 1 2 237.209 2.391 20 0 BEADLO C[C@H](O)c1cccc(Nc2ccc(N)[nH+]c2)c1 ZINC001201284162 983156044 /nfs/dbraw/zinc/15/60/44/983156044.db2.gz KRQVRGCNBSWUCV-VIFPVBQESA-N 1 2 229.283 2.461 20 0 BEADLO Nc1ccc(Nc2ccc(F)cc2O)c[nH+]1 ZINC001201284728 983156863 /nfs/dbraw/zinc/15/68/63/983156863.db2.gz YNLOPGMLHPIJNO-UHFFFAOYSA-N 1 2 219.219 2.252 20 0 BEADLO Cc1cc(N)cc2c1ccn2-c1ccc(N)[nH+]c1 ZINC001201285195 983160313 /nfs/dbraw/zinc/16/03/13/983160313.db2.gz CGJXTZFMQZYHMT-UHFFFAOYSA-N 1 2 238.294 2.498 20 0 BEADLO Cc1cccc(O)c1Nc1ccc(N)[nH+]c1 ZINC001201285560 983160505 /nfs/dbraw/zinc/16/05/05/983160505.db2.gz LKDKDJHYZZNBBG-UHFFFAOYSA-N 1 2 215.256 2.421 20 0 BEADLO CCOc1ccc(N)cc1Nc1ccc(N)[nH+]c1 ZINC001201285454 983161937 /nfs/dbraw/zinc/16/19/37/983161937.db2.gz ILHBPLZWPJEQND-UHFFFAOYSA-N 1 2 244.298 2.388 20 0 BEADLO COc1ccc(O)c(Nc2ccc(N)[nH+]c2)c1 ZINC001201286969 983163413 /nfs/dbraw/zinc/16/34/13/983163413.db2.gz KWCBVBNXPQDWTE-UHFFFAOYSA-N 1 2 231.255 2.122 20 0 BEADLO Nc1ccc2c(c1)N(c1ccc(N)[nH+]c1)CCC2 ZINC001201291317 983167904 /nfs/dbraw/zinc/16/79/04/983167904.db2.gz GBKPRDZXSHVOIT-UHFFFAOYSA-N 1 2 240.310 2.330 20 0 BEADLO Cc1ccc(N)c(N(C)c2ccc(N)[nH+]c2)c1 ZINC001201291780 983169334 /nfs/dbraw/zinc/16/93/34/983169334.db2.gz CERYIAIUWXTXRZ-UHFFFAOYSA-N 1 2 228.299 2.322 20 0 BEADLO Cc1ccc(N)cc1Nc1ccc(N)[nH+]c1 ZINC001201292477 983170275 /nfs/dbraw/zinc/17/02/75/983170275.db2.gz OLVOYUAEQJRQGC-UHFFFAOYSA-N 1 2 214.272 2.298 20 0 BEADLO Cc1cccc(Nc2ccc(N)nc2)[nH+]1 ZINC001201271878 983171316 /nfs/dbraw/zinc/17/13/16/983171316.db2.gz GALGUSNIARINPJ-UHFFFAOYSA-N 1 2 200.245 2.111 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@H]2C[C@H](C)O)[nH+]1 ZINC001354141350 983171726 /nfs/dbraw/zinc/17/17/26/983171726.db2.gz OQFLVRXXMQWKJW-JQWIXIFHSA-N 1 2 238.306 2.269 20 0 BEADLO Nc1ccc(Nc2c(F)cnc(F)c2F)c[nH+]1 ZINC001201271792 983173534 /nfs/dbraw/zinc/17/35/34/983173534.db2.gz CUFAYFXPFIPGDQ-UHFFFAOYSA-N 1 2 240.188 2.220 20 0 BEADLO Cc1cncc(Nc2ccc(N)[nH+]c2)c1 ZINC001201273023 983175597 /nfs/dbraw/zinc/17/55/97/983175597.db2.gz YSJZUQZXVACJJG-UHFFFAOYSA-N 1 2 200.245 2.111 20 0 BEADLO Cc1cn2cccc(Nc3ccc(N)[nH+]c3)c2n1 ZINC001201276584 983176016 /nfs/dbraw/zinc/17/60/16/983176016.db2.gz WQROFSGFFDSZQL-UHFFFAOYSA-N 1 2 239.282 2.364 20 0 BEADLO Cc1ccnc(F)c1Nc1ccc(N)[nH+]c1 ZINC001201275893 983176251 /nfs/dbraw/zinc/17/62/51/983176251.db2.gz MLAGSISUBHGMCP-UHFFFAOYSA-N 1 2 218.235 2.250 20 0 BEADLO COC(=O)c1sccc1Nc1ccc(N)[nH+]c1 ZINC001201272913 983177456 /nfs/dbraw/zinc/17/74/56/983177456.db2.gz WHJZAQLODMLNCV-UHFFFAOYSA-N 1 2 249.295 2.256 20 0 BEADLO Nc1ccc(Nc2ccn3nccc3c2)c[nH+]1 ZINC001201278792 983178284 /nfs/dbraw/zinc/17/82/84/983178284.db2.gz OARXOBCFBYWUKM-UHFFFAOYSA-N 1 2 225.255 2.055 20 0 BEADLO Cc1nc(Cl)c(Nc2ccc(N)[nH+]c2)nc1C ZINC001201278861 983178682 /nfs/dbraw/zinc/17/86/82/983178682.db2.gz OUXDQAMACYMMJD-UHFFFAOYSA-N 1 2 249.705 2.468 20 0 BEADLO Nc1ccc(-n2ccc3c2c(N)ccc3F)c[nH+]1 ZINC001201295875 983180892 /nfs/dbraw/zinc/18/08/92/983180892.db2.gz VKZZMCWDMKXRAU-UHFFFAOYSA-N 1 2 242.257 2.329 20 0 BEADLO Nc1ccc(Nc2ccc3c(c2)[C@H](O)CC3)c[nH+]1 ZINC001201299781 983181247 /nfs/dbraw/zinc/18/12/47/983181247.db2.gz JCRLCDINPBVTIZ-CYBMUJFWSA-N 1 2 241.294 2.387 20 0 BEADLO Nc1ccc2c(c1)CCCN2c1ccc(N)[nH+]c1 ZINC001201295209 983182521 /nfs/dbraw/zinc/18/25/21/983182521.db2.gz MBZCNODOLMCBEC-UHFFFAOYSA-N 1 2 240.310 2.330 20 0 BEADLO O=C1CSc2cc(-c3[nH]cc[nH+]3)ccc2N1 ZINC001242017327 983218153 /nfs/dbraw/zinc/21/81/53/983218153.db2.gz KHPFIXJTDRJLCQ-UHFFFAOYSA-N 1 2 231.280 2.121 20 0 BEADLO c1c[nH+]c(-c2ccc3c(c2)COCC3)[nH]1 ZINC001242018612 983221808 /nfs/dbraw/zinc/22/18/08/983221808.db2.gz LVFBVWPFZHUNQV-UHFFFAOYSA-N 1 2 200.241 2.149 20 0 BEADLO CCC[C@@H](C)C[N@@H+]1C[C@@H](F)C[C@H]1C(=O)OC ZINC001201538493 983292959 /nfs/dbraw/zinc/29/29/59/983292959.db2.gz HECTYQGCCAZPMW-VWYCJHECSA-N 1 2 231.311 2.008 20 0 BEADLO CCC[C@@H](C)C[N@H+]1C[C@@H](F)C[C@H]1C(=O)OC ZINC001201538493 983292966 /nfs/dbraw/zinc/29/29/66/983292966.db2.gz HECTYQGCCAZPMW-VWYCJHECSA-N 1 2 231.311 2.008 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1ccc(C2CC2)nn1 ZINC001242073110 983311613 /nfs/dbraw/zinc/31/16/13/983311613.db2.gz YBAALFRXFQXISY-UHFFFAOYSA-N 1 2 226.283 2.307 20 0 BEADLO Cc1cn2cc(C3=CCOCC3)ccc2[nH+]1 ZINC001242076566 983322118 /nfs/dbraw/zinc/32/21/18/983322118.db2.gz XCFNFIYEWNUHOK-UHFFFAOYSA-N 1 2 214.268 2.446 20 0 BEADLO CCc1cc(C)nc(-c2c[nH+]c(N)cc2C)n1 ZINC001242077618 983325676 /nfs/dbraw/zinc/32/56/76/983325676.db2.gz GYFVDRZRORJIDC-UHFFFAOYSA-N 1 2 228.299 2.300 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1ncc(F)cc1F ZINC001242083687 983331508 /nfs/dbraw/zinc/33/15/08/983331508.db2.gz CSJFEZGLCSOLII-UHFFFAOYSA-N 1 2 221.210 2.312 20 0 BEADLO c1ccc(CC[N@@H+]2Cc3cncnc3C2)cc1 ZINC001201595091 983355109 /nfs/dbraw/zinc/35/51/09/983355109.db2.gz KIWOAIKGHUKWLK-UHFFFAOYSA-N 1 2 225.295 2.035 20 0 BEADLO c1ccc(CC[N@H+]2Cc3cncnc3C2)cc1 ZINC001201595091 983355113 /nfs/dbraw/zinc/35/51/13/983355113.db2.gz KIWOAIKGHUKWLK-UHFFFAOYSA-N 1 2 225.295 2.035 20 0 BEADLO COCOc1ccc(-c2ccc[nH+]c2N)cc1F ZINC001242114202 983360520 /nfs/dbraw/zinc/36/05/20/983360520.db2.gz PGCCSNPIDNAZNW-UHFFFAOYSA-N 1 2 248.257 2.453 20 0 BEADLO CCCC[C@H](O)CNc1[nH+]cccc1OC ZINC001252079752 983381553 /nfs/dbraw/zinc/38/15/53/983381553.db2.gz QWFOWYJGADUFJT-JTQLQIEISA-N 1 2 224.304 2.053 20 0 BEADLO COc1ccc(/C(C)=C/C=C/[NH3+])cc1O ZINC001242173062 983389172 /nfs/dbraw/zinc/38/91/72/983389172.db2.gz QXKNOUWDQGWZCA-DDEWIXKASA-N 1 2 205.257 2.277 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2c(c1)OCCCO2 ZINC001242206543 983408117 /nfs/dbraw/zinc/40/81/17/983408117.db2.gz LERBOPZFBCGGSA-UHFFFAOYSA-N 1 2 230.267 2.248 20 0 BEADLO Nc1cn2ccc(-c3ccc(F)cc3O)cc2[nH+]1 ZINC001242218132 983417759 /nfs/dbraw/zinc/41/77/59/983417759.db2.gz UFJUBJWWKJLQPV-UHFFFAOYSA-N 1 2 243.241 2.428 20 0 BEADLO C=CC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001356509691 983614847 /nfs/dbraw/zinc/61/48/47/983614847.db2.gz ZROHTLNIXIPSIU-UHFFFAOYSA-N 1 2 213.240 2.201 20 0 BEADLO Cc1ccc(-c2ccc(N)[nH+]c2)cc1CO ZINC001242385008 983675419 /nfs/dbraw/zinc/67/54/19/983675419.db2.gz XNUJLGRZIDQAKK-UHFFFAOYSA-N 1 2 214.268 2.132 20 0 BEADLO Cc1ncc(-c2ccn3cc[nH+]c3c2)cc1N ZINC001242409802 983716903 /nfs/dbraw/zinc/71/69/03/983716903.db2.gz HQBHKEBHRUPULR-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1cnc(C)c(N)c1 ZINC001242411079 983720203 /nfs/dbraw/zinc/72/02/03/983720203.db2.gz XYPMQMBBWKQTNU-UHFFFAOYSA-N 1 2 242.326 2.409 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc(-n2ccnn2)cc1 ZINC001242416143 983726577 /nfs/dbraw/zinc/72/65/77/983726577.db2.gz TYAOYRKJSRWUJO-GGBREQKCSA-N 1 2 226.283 2.143 20 0 BEADLO COc1ncc(-c2ccc(C)c(N)[nH+]2)cc1C ZINC001242430109 983730609 /nfs/dbraw/zinc/73/06/09/983730609.db2.gz FRQVSOFSAWKQFG-UHFFFAOYSA-N 1 2 229.283 2.351 20 0 BEADLO COc1c(F)cccc1-c1ccc[nH+]c1N ZINC001242482874 983810219 /nfs/dbraw/zinc/81/02/19/983810219.db2.gz GXJNWOVLPVMICC-UHFFFAOYSA-N 1 2 218.231 2.479 20 0 BEADLO Cc1cc(-c2cncc(N)c2)c2[nH+]ccn2c1 ZINC001242501023 983824633 /nfs/dbraw/zinc/82/46/33/983824633.db2.gz ZZCNNLHGEICYEZ-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO C[C@@H](O)c1cccc(-c2cc[nH+]c(N)c2)c1 ZINC001242550416 983871918 /nfs/dbraw/zinc/87/19/18/983871918.db2.gz SAKGNQFLBQWZRC-SECBINFHSA-N 1 2 214.268 2.384 20 0 BEADLO Nc1[nH+]cccc1-c1cnc(C(F)(F)F)nc1 ZINC001242663144 984027449 /nfs/dbraw/zinc/02/74/49/984027449.db2.gz ZWUPELSBUUPUHH-UHFFFAOYSA-N 1 2 240.188 2.140 20 0 BEADLO Cc1ccc2c(Nc3cnnn3C)cccc2[nH+]1 ZINC001212796037 984047640 /nfs/dbraw/zinc/04/76/40/984047640.db2.gz OXHRXCBSEZAMJF-UHFFFAOYSA-N 1 2 239.282 2.415 20 0 BEADLO COc1cc(-c2cc[nH+]c3c2CCN3)cc(C)n1 ZINC001242750579 984109313 /nfs/dbraw/zinc/10/93/13/984109313.db2.gz LFLVFBYGYWJRMS-UHFFFAOYSA-N 1 2 241.294 2.429 20 0 BEADLO Cc1[nH+]cc(NC(=O)NC2CCCCC2)n1C ZINC001202607510 984122593 /nfs/dbraw/zinc/12/25/93/984122593.db2.gz VNEIHXURXYADNT-UHFFFAOYSA-N 1 2 236.319 2.183 20 0 BEADLO Cc1ccc2nc(C[NH+]3CC(C)(O)C3)ccc2c1 ZINC001137209600 984172384 /nfs/dbraw/zinc/17/23/84/984172384.db2.gz LHYZAHORURRVGS-UHFFFAOYSA-N 1 2 242.322 2.110 20 0 BEADLO CCc1[nH]nc2ncc(C(C)=CC=C[NH3+])cc12 ZINC001242823763 984183605 /nfs/dbraw/zinc/18/36/05/984183605.db2.gz LHOVZBKNRSGKKB-REZHQCRGSA-N 1 2 228.299 2.396 20 0 BEADLO CCCn1nccc1-c1cc[nH+]c2c1CCN2 ZINC001242845590 984195526 /nfs/dbraw/zinc/19/55/26/984195526.db2.gz ASHBDENKCTZLQZ-UHFFFAOYSA-N 1 2 228.299 2.323 20 0 BEADLO C[N@H+](Cc1cnccc1Cl)[C@@H]1CCCOC1 ZINC001137240512 984206064 /nfs/dbraw/zinc/20/60/64/984206064.db2.gz GZRKTGRQOBVVCG-LLVKDONJSA-N 1 2 240.734 2.346 20 0 BEADLO C[N@@H+](Cc1cnccc1Cl)[C@@H]1CCCOC1 ZINC001137240512 984206073 /nfs/dbraw/zinc/20/60/73/984206073.db2.gz GZRKTGRQOBVVCG-LLVKDONJSA-N 1 2 240.734 2.346 20 0 BEADLO COC(=O)c1ccc(-c2c[nH+]cn2C)cc1C ZINC001243019687 984374258 /nfs/dbraw/zinc/37/42/58/984374258.db2.gz SUOCYDNTYRKVEW-UHFFFAOYSA-N 1 2 230.267 2.182 20 0 BEADLO Nc1ccc(-c2ccc(F)c(O)c2)c[nH+]1 ZINC001243049612 984403363 /nfs/dbraw/zinc/40/33/63/984403363.db2.gz RWLWJHXVRGLHPW-UHFFFAOYSA-N 1 2 204.204 2.176 20 0 BEADLO Cn1c[nH+]cc1-c1cc(F)c2nccnc2c1 ZINC001243068492 984486610 /nfs/dbraw/zinc/48/66/10/984486610.db2.gz ZQXZBVZWZMATEZ-UHFFFAOYSA-N 1 2 228.230 2.169 20 0 BEADLO COC(=O)c1cc(-c2c[nH+]cn2C)c(C)cc1F ZINC001243069474 984490918 /nfs/dbraw/zinc/49/09/18/984490918.db2.gz RYFFPYZFBGWJEQ-UHFFFAOYSA-N 1 2 248.257 2.321 20 0 BEADLO COCc1cc(-c2c[nH+]cn2C)ccc1F ZINC001243069885 984492869 /nfs/dbraw/zinc/49/28/69/984492869.db2.gz NESZQMACNLTOHM-UHFFFAOYSA-N 1 2 220.247 2.373 20 0 BEADLO CCOc1ccc(-c2c[nH+]cn2C)cc1OC ZINC001243070334 984493607 /nfs/dbraw/zinc/49/36/07/984493607.db2.gz SBOGJYIHXLNVCW-UHFFFAOYSA-N 1 2 232.283 2.494 20 0 BEADLO COC(=O)c1cc(F)cc(-c2c[nH+]cn2C)c1C ZINC001243070008 984494489 /nfs/dbraw/zinc/49/44/89/984494489.db2.gz DSZDSKHNSMTULT-UHFFFAOYSA-N 1 2 248.257 2.321 20 0 BEADLO CNc1cccc(-c2c[nH+]cn2C)c1C ZINC001243071896 984502870 /nfs/dbraw/zinc/50/28/70/984502870.db2.gz IGEBNDYHNCUHOP-UHFFFAOYSA-N 1 2 201.273 2.437 20 0 BEADLO COC(=O)c1cc(C)c(-c2c[nH+]cn2C)cc1C ZINC001243072512 984504713 /nfs/dbraw/zinc/50/47/13/984504713.db2.gz QMDGFBDLEALPEU-UHFFFAOYSA-N 1 2 244.294 2.491 20 0 BEADLO CCc1cc(-c2c[nH+]cn2C)ccc1C(=O)OC ZINC001243071775 984504996 /nfs/dbraw/zinc/50/49/96/984504996.db2.gz FRHHGCACHWEBDI-UHFFFAOYSA-N 1 2 244.294 2.436 20 0 BEADLO C=CC(=O)Oc1ccc(-c2c[nH+]cn2C)cc1 ZINC001243073115 984509783 /nfs/dbraw/zinc/50/97/83/984509783.db2.gz ZFXYMJSEJGLZSO-UHFFFAOYSA-N 1 2 228.251 2.179 20 0 BEADLO C=C/C=C\CC(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC001443386653 984523195 /nfs/dbraw/zinc/52/31/95/984523195.db2.gz ITFPCNIQAQZUPG-SCOBNMCVSA-N 1 2 245.326 2.179 20 0 BEADLO COC(=O)c1ccc(F)cc1/C(C)=C/C=C/[NH3+] ZINC001243120825 984589103 /nfs/dbraw/zinc/58/91/03/984589103.db2.gz OFCRMZBIWHVUHC-DDEWIXKASA-N 1 2 235.258 2.488 20 0 BEADLO COCC=CC(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC001445734374 984612658 /nfs/dbraw/zinc/61/26/58/984612658.db2.gz BXFGTGQASMIEAA-ARJAWSKDSA-N 1 2 245.282 2.012 20 0 BEADLO COCOc1ccccc1-c1ccc[nH+]c1N ZINC001243183689 984644133 /nfs/dbraw/zinc/64/41/33/984644133.db2.gz YTOFKEABKYAPDF-UHFFFAOYSA-N 1 2 230.267 2.314 20 0 BEADLO CC[C@H]1CC[C@H](C)N1C(=O)Cc1[nH]c[nH+]c1C ZINC001446877981 984711261 /nfs/dbraw/zinc/71/12/61/984711261.db2.gz IGTRZEQNNWGYJP-ONGXEEELSA-N 1 2 235.331 2.050 20 0 BEADLO Cc1ccc(-c2ccc(N)[nH+]c2)cc1O ZINC001243227001 984728538 /nfs/dbraw/zinc/72/85/38/984728538.db2.gz HHUOIENDZPGBAD-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO Cc1ccc(-c2ccc[nH+]c2N)cc1O ZINC001243226729 984740277 /nfs/dbraw/zinc/74/02/77/984740277.db2.gz OJJLQDFNKJOZQW-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO CC[NH2+][C@H](C)C(=O)OCc1ccccc1C ZINC001577814357 984790439 /nfs/dbraw/zinc/79/04/39/984790439.db2.gz XXULQWYJHALOBO-LLVKDONJSA-N 1 2 221.300 2.036 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)Nc1ccc2cc[nH]c2c1 ZINC001448536306 984814303 /nfs/dbraw/zinc/81/43/03/984814303.db2.gz GMPDBVHKPYIFBE-UHFFFAOYSA-N 1 2 240.266 2.072 20 0 BEADLO COC(=[NH2+])c1cccc(-c2cc[nH]c(=O)c2)c1 ZINC001243427813 984918614 /nfs/dbraw/zinc/91/86/14/984918614.db2.gz KEMJOLGSZWPEDJ-UHFFFAOYSA-N 1 2 228.251 2.426 20 0 BEADLO CC(C)(C)OC(=O)N1CC[N@@H+](C2CCCC2)C1 ZINC001257354884 984919459 /nfs/dbraw/zinc/91/94/59/984919459.db2.gz PIMGRWPYICCMNM-UHFFFAOYSA-N 1 2 240.347 2.439 20 0 BEADLO CC(C)(C)OC(=O)N1CC[N@H+](C2CCCC2)C1 ZINC001257354884 984919479 /nfs/dbraw/zinc/91/94/79/984919479.db2.gz PIMGRWPYICCMNM-UHFFFAOYSA-N 1 2 240.347 2.439 20 0 BEADLO Nc1ccc(-c2ccc(F)c(N)c2)c[nH+]1 ZINC001243454921 984962744 /nfs/dbraw/zinc/96/27/44/984962744.db2.gz HCWQOWGUKDFQCA-UHFFFAOYSA-N 1 2 203.220 2.052 20 0 BEADLO COC(=O)c1cc(-c2ccc[nH+]c2N)ccc1C ZINC001243472955 985016870 /nfs/dbraw/zinc/01/68/70/985016870.db2.gz PWNPGDDGLNBCRO-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO Cc1ncc(F)cc1-c1ccc[nH+]c1N ZINC001243472941 985017105 /nfs/dbraw/zinc/01/71/05/985017105.db2.gz CQVUTMNHROGVEA-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO COC(=O)c1cc(F)cc(-c2ccc[nH+]c2N)c1 ZINC001243473030 985018482 /nfs/dbraw/zinc/01/84/82/985018482.db2.gz DZZSHWSPXXMVEQ-UHFFFAOYSA-N 1 2 246.241 2.257 20 0 BEADLO COC(=O)c1c(C)cccc1-c1ccc[nH+]c1N ZINC001243473505 985025519 /nfs/dbraw/zinc/02/55/19/985025519.db2.gz WGZOLZQRBDFURA-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO Nc1[nH+]cccc1-c1ccc(C2OCCO2)cc1 ZINC001243475395 985031300 /nfs/dbraw/zinc/03/13/00/985031300.db2.gz YFTPJYVRFJOXKJ-UHFFFAOYSA-N 1 2 242.278 2.376 20 0 BEADLO CC(C)Cn1cc(-c2ccc[nH+]c2N)ccc1=O ZINC001243477239 985035757 /nfs/dbraw/zinc/03/57/57/985035757.db2.gz NNNDVYHIDLBSTD-UHFFFAOYSA-N 1 2 243.310 2.149 20 0 BEADLO CSc1ncc(-c2ccc[nH+]c2N)c(C)n1 ZINC001243477029 985036880 /nfs/dbraw/zinc/03/68/80/985036880.db2.gz HXUREINJVKZUHM-UHFFFAOYSA-N 1 2 232.312 2.151 20 0 BEADLO CC(=O)Oc1cccc(-c2ccc[nH+]c2N)c1 ZINC001243477031 985039476 /nfs/dbraw/zinc/03/94/76/985039476.db2.gz XUSYFUDNMNKHGT-UHFFFAOYSA-N 1 2 228.251 2.256 20 0 BEADLO Cc1c(-c2cccc(=O)[nH]2)ccc2[nH+]ccn21 ZINC001243738728 985278381 /nfs/dbraw/zinc/27/83/81/985278381.db2.gz UYJSKHIHESRVNY-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO CCCCCCNC(=O)Cn1c[nH+]c(CC)c1 ZINC001459261616 985401581 /nfs/dbraw/zinc/40/15/81/985401581.db2.gz NMYJCRQXGKLERN-UHFFFAOYSA-N 1 2 237.347 2.142 20 0 BEADLO CCc1cn(Cc2ccnc(F)c2)c[nH+]1 ZINC001459259813 985416960 /nfs/dbraw/zinc/41/69/60/985416960.db2.gz JNEBDTMTZVUDQX-UHFFFAOYSA-N 1 2 205.236 2.028 20 0 BEADLO CC(C)(C)OC1C[NH+](Cc2ccc(CO)cc2)C1 ZINC000687910944 985422383 /nfs/dbraw/zinc/42/23/83/985422383.db2.gz BJMALRYIOXPKIW-UHFFFAOYSA-N 1 2 249.354 2.178 20 0 BEADLO CCn1cc(-c2cccc3[nH+]ccn32)ccc1=O ZINC001243834166 985435568 /nfs/dbraw/zinc/43/55/68/985435568.db2.gz AUSVRACIUWNBHM-UHFFFAOYSA-N 1 2 239.278 2.183 20 0 BEADLO Cc1ccc(C[N@@H+](C)[C@H]2CCOC2)c(Cl)n1 ZINC000688550301 985677847 /nfs/dbraw/zinc/67/78/47/985677847.db2.gz HBBYUZKYMITHFX-NSHDSACASA-N 1 2 240.734 2.264 20 0 BEADLO Cc1ccc(C[N@H+](C)[C@H]2CCOC2)c(Cl)n1 ZINC000688550301 985677854 /nfs/dbraw/zinc/67/78/54/985677854.db2.gz HBBYUZKYMITHFX-NSHDSACASA-N 1 2 240.734 2.264 20 0 BEADLO COc1cc(O)ccc1-c1cc[nH+]c(N)c1 ZINC001243979247 985706852 /nfs/dbraw/zinc/70/68/52/985706852.db2.gz QFKFLIRTEFCQFT-UHFFFAOYSA-N 1 2 216.240 2.045 20 0 BEADLO COC(=O)c1ccc(OC)c(/C(C)=C/C=C/[NH3+])c1 ZINC001244052663 985786824 /nfs/dbraw/zinc/78/68/24/985786824.db2.gz CEJMHNMMZSOKDJ-DXNUHORPSA-N 1 2 247.294 2.358 20 0 BEADLO Cc1ccccc1C(F)(F)C[NH2+][C@H](C)[C@@H](C)O ZINC001327641977 985834497 /nfs/dbraw/zinc/83/44/97/985834497.db2.gz VVLUNNFPRQIXCB-GHMZBOCLSA-N 1 2 243.297 2.446 20 0 BEADLO C[N@H+](CCOC1CCCCC1)Cc1ncccn1 ZINC001460684718 985876092 /nfs/dbraw/zinc/87/60/92/985876092.db2.gz DJUDKZGXEPYBRV-UHFFFAOYSA-N 1 2 249.358 2.258 20 0 BEADLO C[N@@H+](CCOC1CCCCC1)Cc1ncccn1 ZINC001460684718 985876096 /nfs/dbraw/zinc/87/60/96/985876096.db2.gz DJUDKZGXEPYBRV-UHFFFAOYSA-N 1 2 249.358 2.258 20 0 BEADLO Cc1ccc(CNc2cc(CO)cc[nH+]2)cc1 ZINC001461595786 986094481 /nfs/dbraw/zinc/09/44/81/986094481.db2.gz RTFAVFRUISTFQO-UHFFFAOYSA-N 1 2 228.295 2.494 20 0 BEADLO Cc1cnn(C)c1CNc1cc2cc[nH]c2c[nH+]1 ZINC001461606266 986094813 /nfs/dbraw/zinc/09/48/13/986094813.db2.gz JWXGEQYONQBNKK-UHFFFAOYSA-N 1 2 241.298 2.217 20 0 BEADLO COC(=O)c1cnc([C@@H](C)[NH+]2CCCC2)s1 ZINC001462007885 986262152 /nfs/dbraw/zinc/26/21/52/986262152.db2.gz LXWLTWZJDPISFG-MRVPVSSYSA-N 1 2 240.328 2.087 20 0 BEADLO C[C@H](O)C[N@H+](C)Cc1cncc(Cl)c1Cl ZINC001462075548 986276745 /nfs/dbraw/zinc/27/67/45/986276745.db2.gz OKDDTXAEPDRVFO-ZETCQYMHSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@H](O)C[N@@H+](C)Cc1cncc(Cl)c1Cl ZINC001462075548 986276759 /nfs/dbraw/zinc/27/67/59/986276759.db2.gz OKDDTXAEPDRVFO-ZETCQYMHSA-N 1 2 249.141 2.201 20 0 BEADLO COc1ncc(-c2cccc3[nH+]ccn32)cc1O ZINC001244845666 986392556 /nfs/dbraw/zinc/39/25/56/986392556.db2.gz KJRPGRAYZNLIKR-UHFFFAOYSA-N 1 2 241.250 2.111 20 0 BEADLO COc1ncc(-c2ccc3[nH+]ccn3c2)cc1O ZINC001244847576 986396821 /nfs/dbraw/zinc/39/68/21/986396821.db2.gz YDGLZVWMVZKVAB-UHFFFAOYSA-N 1 2 241.250 2.111 20 0 BEADLO Cc1c(O)cccc1-c1ccc[nH+]c1N ZINC001244958075 986491649 /nfs/dbraw/zinc/49/16/49/986491649.db2.gz KSZWEYZSICBDGH-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO CNc1cc(-c2ccc(NC(C)=O)nc2)cc[nH+]1 ZINC001244971983 986547600 /nfs/dbraw/zinc/54/76/00/986547600.db2.gz BEHBEFFDWUARCR-UHFFFAOYSA-N 1 2 242.282 2.144 20 0 BEADLO CNc1cc(-c2cccc(NC(N)=O)c2)cc[nH+]1 ZINC001244974382 986558743 /nfs/dbraw/zinc/55/87/43/986558743.db2.gz XSBOPUNDVZYRCS-UHFFFAOYSA-N 1 2 242.282 2.281 20 0 BEADLO COc1cnc(F)c(-c2cc(N(C)C)cc[nH+]2)c1 ZINC001245060983 986616030 /nfs/dbraw/zinc/61/60/30/986616030.db2.gz GSVLOCITZWTYHG-UHFFFAOYSA-N 1 2 247.273 2.357 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1ccc(C)cc1OC ZINC001464605875 986648041 /nfs/dbraw/zinc/64/80/41/986648041.db2.gz QMIQWWBVVYUSQO-LBPRGKRZSA-N 1 2 248.326 2.036 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1ccc(C)cc1OC ZINC001464605875 986648049 /nfs/dbraw/zinc/64/80/49/986648049.db2.gz QMIQWWBVVYUSQO-LBPRGKRZSA-N 1 2 248.326 2.036 20 0 BEADLO Cc1cc(NCC(C)(C)O)[nH+]c2ccccc12 ZINC000379754302 986680164 /nfs/dbraw/zinc/68/01/64/986680164.db2.gz RKSZFBAUIAMSPJ-UHFFFAOYSA-N 1 2 230.311 2.148 20 0 BEADLO Cc1c(C2=CCCOC2)ccc2[nH+]ccn21 ZINC001245160371 986704359 /nfs/dbraw/zinc/70/43/59/986704359.db2.gz LBJBFEPLTHKPSO-UHFFFAOYSA-N 1 2 214.268 2.446 20 0 BEADLO CCn1ncc2cc(-c3c[nH+]cn3C)ccc21 ZINC001245236683 986757927 /nfs/dbraw/zinc/75/79/27/986757927.db2.gz RCHCLUQEBFXWDI-UHFFFAOYSA-N 1 2 226.283 2.457 20 0 BEADLO CCCOC1C[NH+](Cc2[nH]c(C)cc2C)C1 ZINC001137327635 986779336 /nfs/dbraw/zinc/77/93/36/986779336.db2.gz ACINDZKCSREPPW-UHFFFAOYSA-N 1 2 222.332 2.242 20 0 BEADLO CC(=O)OCc1cc(-c2c[nH+]cn2C)ccc1C ZINC001245378675 986826673 /nfs/dbraw/zinc/82/66/73/986826673.db2.gz ZNQWPIUUTVWKOB-UHFFFAOYSA-N 1 2 244.294 2.459 20 0 BEADLO C[N@H+](Cc1ccc(C(C)(C)C)[nH]1)C1COC1 ZINC001137376267 986840400 /nfs/dbraw/zinc/84/04/00/986840400.db2.gz BTNYXRQGZCRJCV-UHFFFAOYSA-N 1 2 222.332 2.143 20 0 BEADLO C[N@@H+](Cc1ccc(C(C)(C)C)[nH]1)C1COC1 ZINC001137376267 986840403 /nfs/dbraw/zinc/84/04/03/986840403.db2.gz BTNYXRQGZCRJCV-UHFFFAOYSA-N 1 2 222.332 2.143 20 0 BEADLO Cc1cc[nH+]c(C)c1-c1ccccc1CC(N)=O ZINC001245448628 986853012 /nfs/dbraw/zinc/85/30/12/986853012.db2.gz JTUNGAHJQVSSAV-UHFFFAOYSA-N 1 2 240.306 2.393 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccno2)ccn1 ZINC001137418186 986887674 /nfs/dbraw/zinc/88/76/74/986887674.db2.gz PCNILWTZCZNDKH-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccno2)ccn1 ZINC001137418186 986887677 /nfs/dbraw/zinc/88/76/77/986887677.db2.gz PCNILWTZCZNDKH-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO CCCC[C@@H](C)[NH2+]CC(F)(F)C(=O)OCC ZINC001255313543 986906516 /nfs/dbraw/zinc/90/65/16/986906516.db2.gz NGPMBZOUYGJCHZ-SECBINFHSA-N 1 2 237.290 2.353 20 0 BEADLO Cc1cc(-c2ncnc3occc32)c[nH+]c1N ZINC001245535585 986906632 /nfs/dbraw/zinc/90/66/32/986906632.db2.gz FRKFYAORHUJKMD-UHFFFAOYSA-N 1 2 226.239 2.175 20 0 BEADLO CSc1cc(-c2c[nH+]c(N)c(C)c2)ncn1 ZINC001245536361 986913303 /nfs/dbraw/zinc/91/33/03/986913303.db2.gz PCEGQWOYQWAZSZ-UHFFFAOYSA-N 1 2 232.312 2.151 20 0 BEADLO COc1ccnc(-c2c[nH+]c(N)c(C)c2)c1 ZINC001245535975 986913531 /nfs/dbraw/zinc/91/35/31/986913531.db2.gz JGHKIXAZFAMEEV-UHFFFAOYSA-N 1 2 215.256 2.043 20 0 BEADLO COc1ccc(-c2c[nH+]c(N)c(C)c2)nc1OC ZINC001245537012 986914152 /nfs/dbraw/zinc/91/41/52/986914152.db2.gz DLHKXDRPCLGPHW-UHFFFAOYSA-N 1 2 245.282 2.051 20 0 BEADLO CCOc1cccc(-c2c[nH+]c(N)c(C)c2)n1 ZINC001245535924 986914207 /nfs/dbraw/zinc/91/42/07/986914207.db2.gz IDOZKHQYGCDESQ-UHFFFAOYSA-N 1 2 229.283 2.433 20 0 BEADLO C[N@H+](Cc1ccc(Cl)nc1F)[C@@H]1CCOC1 ZINC001137476488 986920645 /nfs/dbraw/zinc/92/06/45/986920645.db2.gz GHGWUGUZWVIZMW-SECBINFHSA-N 1 2 244.697 2.095 20 0 BEADLO C[N@@H+](Cc1ccc(Cl)nc1F)[C@@H]1CCOC1 ZINC001137476488 986920655 /nfs/dbraw/zinc/92/06/55/986920655.db2.gz GHGWUGUZWVIZMW-SECBINFHSA-N 1 2 244.697 2.095 20 0 BEADLO Cc1cc(-c2cccc(NC(N)=O)c2)c[nH+]c1N ZINC001245538494 986920606 /nfs/dbraw/zinc/92/06/06/986920606.db2.gz LUFGYWYIZHCBMU-UHFFFAOYSA-N 1 2 242.282 2.130 20 0 BEADLO Cc1ncc(-c2c[nH+]c(N)c(C)c2)c(C)n1 ZINC001245537974 986921402 /nfs/dbraw/zinc/92/14/02/986921402.db2.gz IGWFXROATXHVSS-UHFFFAOYSA-N 1 2 214.272 2.046 20 0 BEADLO COC[C@@H](C)[N@@H+]1CCc2nc(Cl)ccc2C1 ZINC001255575576 987024639 /nfs/dbraw/zinc/02/46/39/987024639.db2.gz AOPPMGDKJMCIEQ-SECBINFHSA-N 1 2 240.734 2.128 20 0 BEADLO COC[C@@H](C)[N@H+]1CCc2nc(Cl)ccc2C1 ZINC001255575576 987024654 /nfs/dbraw/zinc/02/46/54/987024654.db2.gz AOPPMGDKJMCIEQ-SECBINFHSA-N 1 2 240.734 2.128 20 0 BEADLO COC1(C)C[NH+]([C@H](C)CC(F)(F)F)C1 ZINC001255646356 987042988 /nfs/dbraw/zinc/04/29/88/987042988.db2.gz NLYAYAQLEOCECP-SSDOTTSWSA-N 1 2 211.227 2.048 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1ccc2nncn2c1 ZINC001245660002 987050723 /nfs/dbraw/zinc/05/07/23/987050723.db2.gz MSUBPYVAZORGOW-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO CN(CCCNC(=O)C(C)(C)C)c1cccc[nH+]1 ZINC001471491267 987094495 /nfs/dbraw/zinc/09/44/95/987094495.db2.gz SBKQNKWAROQGSC-UHFFFAOYSA-N 1 2 249.358 2.070 20 0 BEADLO c1nc2c(ccnc2-c2ccc3c[nH+]cn3c2)[nH]1 ZINC001245895393 987105978 /nfs/dbraw/zinc/10/59/78/987105978.db2.gz YMEJQFUBABNTKL-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO CCc1[nH]c(CNC(=O)CC[C@@H](C)CC)c[nH+]1 ZINC001472021216 987155890 /nfs/dbraw/zinc/15/58/90/987155890.db2.gz SPPGXATVQJHBEL-JTQLQIEISA-N 1 2 237.347 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)CC[C@@H](C)CC)[nH+]1 ZINC001472021216 987155906 /nfs/dbraw/zinc/15/59/06/987155906.db2.gz SPPGXATVQJHBEL-JTQLQIEISA-N 1 2 237.347 2.415 20 0 BEADLO CCC(C)(C)N1N=C(C2CC[NH2+]CC2)CC1=O ZINC001245918631 987159992 /nfs/dbraw/zinc/15/99/92/987159992.db2.gz ZSRVNVJQGTXQTD-UHFFFAOYSA-N 1 2 237.347 2.201 20 0 BEADLO Cc1occc1C(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001472092126 987178267 /nfs/dbraw/zinc/17/82/67/987178267.db2.gz GGROXQLPZHNOEK-UHFFFAOYSA-N 1 2 247.298 2.365 20 0 BEADLO Cc1occc1C(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001472092126 987178287 /nfs/dbraw/zinc/17/82/87/987178287.db2.gz GGROXQLPZHNOEK-UHFFFAOYSA-N 1 2 247.298 2.365 20 0 BEADLO C[C@@H]1C[C@@H]1c1nnc([C@@H]2CCCc3[nH]c[nH+]c32)o1 ZINC001256661077 987261774 /nfs/dbraw/zinc/26/17/74/987261774.db2.gz YWNZMIWOQHGKPN-HLTSFMKQSA-N 1 2 244.298 2.384 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@H](C)c2cncs2)n1 ZINC000693484873 987310915 /nfs/dbraw/zinc/31/09/15/987310915.db2.gz JVFQXDPMNDGBGU-MRVPVSSYSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1ccc(C[C@@H](C)[N@H+](C)Cc2nnc[nH]2)cc1 ZINC001473177311 987357724 /nfs/dbraw/zinc/35/77/24/987357724.db2.gz BTSRHGMZTNOJDW-GFCCVEGCSA-N 1 2 244.342 2.176 20 0 BEADLO Cc1ccc(C[C@@H](C)[N@@H+](C)Cc2nnc[nH]2)cc1 ZINC001473177311 987357728 /nfs/dbraw/zinc/35/77/28/987357728.db2.gz BTSRHGMZTNOJDW-GFCCVEGCSA-N 1 2 244.342 2.176 20 0 BEADLO CC(C)(C)[C@@H](Cn1cc[nH+]c1)NC(=O)CC1CC1 ZINC001115994329 987425444 /nfs/dbraw/zinc/42/54/44/987425444.db2.gz VJFVPCMYQZQNSR-GFCCVEGCSA-N 1 2 249.358 2.214 20 0 BEADLO CC(C)(C)[C@H](Cn1cc[nH+]c1)NC(=O)CC1CC1 ZINC001115994330 987425613 /nfs/dbraw/zinc/42/56/13/987425613.db2.gz VJFVPCMYQZQNSR-LBPRGKRZSA-N 1 2 249.358 2.214 20 0 BEADLO CC[C@@H](C)[C@@H](C)[N@@H+]1CCOCC(F)(F)C1 ZINC001473526866 987465910 /nfs/dbraw/zinc/46/59/10/987465910.db2.gz LGGXNBUUWCHIBP-NXEZZACHSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@@H](C)[C@@H](C)[N@H+]1CCOCC(F)(F)C1 ZINC001473526866 987465916 /nfs/dbraw/zinc/46/59/16/987465916.db2.gz LGGXNBUUWCHIBP-NXEZZACHSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@@H]1CCC[C@H]1NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001116252933 987492663 /nfs/dbraw/zinc/49/26/63/987492663.db2.gz QXTHZJKYVPNNCQ-IJLUTSLNSA-N 1 2 235.331 2.139 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001116464205 987591299 /nfs/dbraw/zinc/59/12/99/987591299.db2.gz TYLPUJOIPHAJJM-QJPTWQEYSA-N 1 2 235.331 2.234 20 0 BEADLO C[C@@H]1CC[C@@H](N[C@H]2C[NH2+]CC[C@H]2F)C[C@H]1C ZINC001246218275 987616064 /nfs/dbraw/zinc/61/60/64/987616064.db2.gz RUKUIMGTZSITBT-VEGXAWMVSA-N 1 2 228.355 2.101 20 0 BEADLO C[C@@H]1CC[C@@H]([NH2+][C@H]2CNCC[C@H]2F)C[C@H]1C ZINC001246218275 987616070 /nfs/dbraw/zinc/61/60/70/987616070.db2.gz RUKUIMGTZSITBT-VEGXAWMVSA-N 1 2 228.355 2.101 20 0 BEADLO c1nc(C[NH2+]Cc2cc3ccccc3[nH]2)c[nH]1 ZINC001474145250 987649643 /nfs/dbraw/zinc/64/96/43/987649643.db2.gz LICTUIUJYPDPDE-UHFFFAOYSA-N 1 2 226.283 2.181 20 0 BEADLO COCc1ccc(C[NH2+][C@@H](C)c2ccn(C)n2)o1 ZINC001474175729 987652353 /nfs/dbraw/zinc/65/23/53/987652353.db2.gz VBFYHRDVMDBVIF-JTQLQIEISA-N 1 2 249.314 2.010 20 0 BEADLO CCn1ccnc1C[NH2+][C@H](C)c1ncccc1C ZINC001474298187 987679169 /nfs/dbraw/zinc/67/91/69/987679169.db2.gz NPQTVHKTNNWAPC-GFCCVEGCSA-N 1 2 244.342 2.457 20 0 BEADLO C[N@H+](Cc1cncnc1)Cc1cc(F)cc(F)c1 ZINC001116811677 987717806 /nfs/dbraw/zinc/71/78/06/987717806.db2.gz KKIVEVNBZLJERP-UHFFFAOYSA-N 1 2 249.264 2.387 20 0 BEADLO C[N@@H+](Cc1cncnc1)Cc1cc(F)cc(F)c1 ZINC001116811677 987717810 /nfs/dbraw/zinc/71/78/10/987717810.db2.gz KKIVEVNBZLJERP-UHFFFAOYSA-N 1 2 249.264 2.387 20 0 BEADLO CC(C)Oc1ccc[nH+]c1N[C@H]1C[C@@H]2COC[C@@H]21 ZINC001474451047 987726759 /nfs/dbraw/zinc/72/67/59/987726759.db2.gz CXMKXSPGVYHHLL-WOPDTQHZSA-N 1 2 248.326 2.316 20 0 BEADLO COc1ccc(NCc2ccc[nH+]c2N)c(F)c1 ZINC001474667001 987796110 /nfs/dbraw/zinc/79/61/10/987796110.db2.gz VYBOVAILFFHLQS-UHFFFAOYSA-N 1 2 247.273 2.424 20 0 BEADLO Cc1noc(NCCCCNc2cccc[nH+]2)n1 ZINC001321656396 987965262 /nfs/dbraw/zinc/96/52/62/987965262.db2.gz QBIAVGSZIHJJPZ-UHFFFAOYSA-N 1 2 247.302 2.077 20 0 BEADLO C[C@H](C(=O)N1CCCC(C)(C)CC1)n1cc[nH+]c1 ZINC001322143777 988138263 /nfs/dbraw/zinc/13/82/63/988138263.db2.gz FEIUTVOJBTVKIP-GFCCVEGCSA-N 1 2 249.358 2.483 20 0 BEADLO C[NH+](C)Cc1nnc(/C=C/c2ccccc2F)o1 ZINC001322338331 988211819 /nfs/dbraw/zinc/21/18/19/988211819.db2.gz BHRGMEHMLYRKAE-BQYQJAHWSA-N 1 2 247.273 2.441 20 0 BEADLO C[C@@H]1CC[C@@H](c2nnc(C[NH+](C)C)o2)C1 ZINC001118419375 988314818 /nfs/dbraw/zinc/31/48/18/988314818.db2.gz VRSRDGZFFSHUDF-RKDXNWHRSA-N 1 2 209.293 2.035 20 0 BEADLO CCCC1(CNC(=O)[C@@H](C)n2cc[nH+]c2)CC1 ZINC001322541630 988318726 /nfs/dbraw/zinc/31/87/26/988318726.db2.gz RFCNFONUVPILAV-LLVKDONJSA-N 1 2 235.331 2.141 20 0 BEADLO CCCCC[N@H+](Cc1nnc[nH]1)C(C)C ZINC001118492031 988380446 /nfs/dbraw/zinc/38/04/46/988380446.db2.gz DVJWWGUEIMOIRA-UHFFFAOYSA-N 1 2 210.325 2.205 20 0 BEADLO CCCCC[N@@H+](Cc1nnc[nH]1)C(C)C ZINC001118492031 988380454 /nfs/dbraw/zinc/38/04/54/988380454.db2.gz DVJWWGUEIMOIRA-UHFFFAOYSA-N 1 2 210.325 2.205 20 0 BEADLO C[NH+](C)Cc1nnc(CCCC(C)(C)C)o1 ZINC001322984229 988424241 /nfs/dbraw/zinc/42/42/41/988424241.db2.gz UUNAVNUCAPFUFR-UHFFFAOYSA-N 1 2 225.336 2.500 20 0 BEADLO C[C@@H](C(=O)N1CCC[C@@H](C)[C@@H]1C)n1cc[nH+]c1 ZINC001323146512 988457630 /nfs/dbraw/zinc/45/76/30/988457630.db2.gz QDDPVDAGJGGBAZ-WOPDTQHZSA-N 1 2 235.331 2.091 20 0 BEADLO C[C@H](C(=O)N1CCC[C@@H]1C(C)(C)C)n1cc[nH+]c1 ZINC001323203628 988474024 /nfs/dbraw/zinc/47/40/24/988474024.db2.gz CXGWJHCUSSRXJF-VXGBXAGGSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@@H]1CC[C@H]([N@@H+]2CC[C@@H](N)C(F)(F)C2)C[C@@H]1C ZINC001246839882 988549383 /nfs/dbraw/zinc/54/93/83/988549383.db2.gz ZWSAGFYHCGDJNC-NOOOWODRSA-N 1 2 246.345 2.479 20 0 BEADLO C[C@@H]1CC[C@H]([N@H+]2CC[C@@H](N)C(F)(F)C2)C[C@@H]1C ZINC001246839882 988549396 /nfs/dbraw/zinc/54/93/96/988549396.db2.gz ZWSAGFYHCGDJNC-NOOOWODRSA-N 1 2 246.345 2.479 20 0 BEADLO CC(C)(C)c1cn(C[C@H]2COC(C)(C)O2)c[nH+]1 ZINC001118927481 988711072 /nfs/dbraw/zinc/71/10/72/988711072.db2.gz QJHRGKQEPAQOCE-JTQLQIEISA-N 1 2 238.331 2.332 20 0 BEADLO CCCCSCCc1nnc(C[NH+](C)C)o1 ZINC001324177256 988736701 /nfs/dbraw/zinc/73/67/01/988736701.db2.gz BKPPIKQIVODNHG-UHFFFAOYSA-N 1 2 243.376 2.207 20 0 BEADLO C[C@H](C(=O)N1CC2(C1)CCCCC2)n1cc[nH+]c1 ZINC001324313636 988792090 /nfs/dbraw/zinc/79/20/90/988792090.db2.gz XQWZJRJDKIEHRC-GFCCVEGCSA-N 1 2 247.342 2.237 20 0 BEADLO CO[C@H]1C[C@@H]([N@H+](C)Cc2cc(C)[nH]n2)C12CCC2 ZINC001324439371 988841707 /nfs/dbraw/zinc/84/17/07/988841707.db2.gz VWSAHNBHPDYWKE-OLZOCXBDSA-N 1 2 249.358 2.108 20 0 BEADLO CO[C@H]1C[C@@H]([N@@H+](C)Cc2cc(C)[nH]n2)C12CCC2 ZINC001324439371 988841712 /nfs/dbraw/zinc/84/17/12/988841712.db2.gz VWSAHNBHPDYWKE-OLZOCXBDSA-N 1 2 249.358 2.108 20 0 BEADLO C[C@@H](C(=O)NC1CC(C(C)(C)C)C1)n1cc[nH+]c1 ZINC001324455435 988846678 /nfs/dbraw/zinc/84/66/78/988846678.db2.gz WAKOVFTWOYHMHW-UNXYVOJBSA-N 1 2 249.358 2.385 20 0 BEADLO CCCOc1ccc2[nH+]c(CCCO)n(C)c2c1 ZINC001247043720 988847844 /nfs/dbraw/zinc/84/78/44/988847844.db2.gz YCDOFATWMZCDJV-UHFFFAOYSA-N 1 2 248.326 2.287 20 0 BEADLO Fc1cccc(-c2noc(Cc3c[nH]c[nH+]3)n2)c1 ZINC001247137059 988852458 /nfs/dbraw/zinc/85/24/58/988852458.db2.gz FRERDBCAZKACPT-UHFFFAOYSA-N 1 2 244.229 2.190 20 0 BEADLO Cc1cc(C[NH2+]Cc2cccn2C2CC2)no1 ZINC001119282302 988885350 /nfs/dbraw/zinc/88/53/50/988885350.db2.gz DEEAPOGMUBXALA-UHFFFAOYSA-N 1 2 231.299 2.409 20 0 BEADLO CC(C)C[C@@H]1CCN(C(=O)[C@H](C)n2cc[nH+]c2)C1 ZINC001324675556 988924393 /nfs/dbraw/zinc/92/43/93/988924393.db2.gz AIEGKEOVTAVYNL-STQMWFEESA-N 1 2 249.358 2.339 20 0 BEADLO CCc1nccc(NCCCCn2cc[nH+]c2)n1 ZINC001119353775 989001249 /nfs/dbraw/zinc/00/12/49/989001249.db2.gz RIEUJVSPWSGRHS-UHFFFAOYSA-N 1 2 245.330 2.128 20 0 BEADLO CC[C@H](C)CC(=O)OCCCc1c[nH+]cn1C ZINC001515350726 989032256 /nfs/dbraw/zinc/03/22/56/989032256.db2.gz IJLSTKJDGAEGAT-NSHDSACASA-N 1 2 238.331 2.332 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@@H]2C(C)(C)O)[nH+]1 ZINC001515595945 989074594 /nfs/dbraw/zinc/07/45/94/989074594.db2.gz STNVVCIKBRKCFY-LLVKDONJSA-N 1 2 238.306 2.269 20 0 BEADLO Nc1ccc[nH+]c1Nc1cc2cccnc2[nH]1 ZINC001248694547 989129691 /nfs/dbraw/zinc/12/96/91/989129691.db2.gz MWHUFYSXKZPWJH-UHFFFAOYSA-N 1 2 225.255 2.284 20 0 BEADLO C[C@H](C(=O)N1CC(C)(C)C[C@H]1C)n1cc[nH+]c1 ZINC001325251005 989131835 /nfs/dbraw/zinc/13/18/35/989131835.db2.gz ZPBOHGJJMLQGFV-GHMZBOCLSA-N 1 2 235.331 2.091 20 0 BEADLO CC[N@H+](C)Cc1c(Cl)ccnc1OC ZINC001248791840 989141492 /nfs/dbraw/zinc/14/14/92/989141492.db2.gz WSWUDYCVFAJZKE-UHFFFAOYSA-N 1 2 214.696 2.195 20 0 BEADLO CC[N@@H+](C)Cc1c(Cl)ccnc1OC ZINC001248791840 989141495 /nfs/dbraw/zinc/14/14/95/989141495.db2.gz WSWUDYCVFAJZKE-UHFFFAOYSA-N 1 2 214.696 2.195 20 0 BEADLO CC[C@H](C)[C@@H]([NH2+]C/C=C\C1CC1)C(=O)OC ZINC001119560400 989164517 /nfs/dbraw/zinc/16/45/17/989164517.db2.gz QSNWMURMAMKWBP-UHGNHILRSA-N 1 2 225.332 2.130 20 0 BEADLO CC[C@H](NC(=O)[C@@H](C)n1cc[nH+]c1)[C@H]1CC1(C)C ZINC001325341434 989167017 /nfs/dbraw/zinc/16/70/17/989167017.db2.gz GXXXJZAHJIVDGK-UTUOFQBUSA-N 1 2 249.358 2.385 20 0 BEADLO Cc1ccc2[nH]c(C[NH+]3CCC3)nc2c1 ZINC001248839752 989192364 /nfs/dbraw/zinc/19/23/64/989192364.db2.gz WSZDRLCWTGUWRT-UHFFFAOYSA-N 1 2 201.273 2.077 20 0 BEADLO Cc1ccc2[nH]c(C[N@@H+](C)[C@@H]3CCOC3)nc2c1 ZINC001248842190 989192965 /nfs/dbraw/zinc/19/29/65/989192965.db2.gz JXQYLBXVZJBGAQ-LLVKDONJSA-N 1 2 245.326 2.092 20 0 BEADLO Cc1ccc2[nH]c(C[N@H+](C)[C@@H]3CCOC3)nc2c1 ZINC001248842190 989192969 /nfs/dbraw/zinc/19/29/69/989192969.db2.gz JXQYLBXVZJBGAQ-LLVKDONJSA-N 1 2 245.326 2.092 20 0 BEADLO Cc1ccc2nc(C[N@@H+](C)[C@@H]3CCOC3)[nH]c2c1 ZINC001248842190 989192974 /nfs/dbraw/zinc/19/29/74/989192974.db2.gz JXQYLBXVZJBGAQ-LLVKDONJSA-N 1 2 245.326 2.092 20 0 BEADLO Cc1ccc2nc(C[N@H+](C)[C@@H]3CCOC3)[nH]c2c1 ZINC001248842190 989192976 /nfs/dbraw/zinc/19/29/76/989192976.db2.gz JXQYLBXVZJBGAQ-LLVKDONJSA-N 1 2 245.326 2.092 20 0 BEADLO c1nc(N2CC3CCC2CC3)cc(NC2CC2)[nH+]1 ZINC001325566065 989207909 /nfs/dbraw/zinc/20/79/09/989207909.db2.gz VMANTSAFNPNDSI-UHFFFAOYSA-N 1 2 244.342 2.430 20 0 BEADLO c1nc(NC2CC2)cc(N2CC3CCC2CC3)[nH+]1 ZINC001325566065 989207916 /nfs/dbraw/zinc/20/79/16/989207916.db2.gz VMANTSAFNPNDSI-UHFFFAOYSA-N 1 2 244.342 2.430 20 0 BEADLO Cc1nc(C[NH+]2CC=CC2)ccc1Cl ZINC001248869185 989208729 /nfs/dbraw/zinc/20/87/29/989208729.db2.gz LIDQCIAMUNLYQW-UHFFFAOYSA-N 1 2 208.692 2.415 20 0 BEADLO C[C@H](C(=O)NC1[C@H](C)CCC[C@H]1C)n1cc[nH+]c1 ZINC001325556112 989211441 /nfs/dbraw/zinc/21/14/41/989211441.db2.gz UBXKNKBWYHPTGY-IJLUTSLNSA-N 1 2 249.358 2.385 20 0 BEADLO COc1ccc2nc(C[N@@H+]3CC[C@H](C)C3)[nH]c2c1 ZINC001249412094 989278011 /nfs/dbraw/zinc/27/80/11/989278011.db2.gz UKMVIYDFKAELPA-JTQLQIEISA-N 1 2 245.326 2.413 20 0 BEADLO COc1ccc2nc(C[N@H+]3CC[C@H](C)C3)[nH]c2c1 ZINC001249412094 989278023 /nfs/dbraw/zinc/27/80/23/989278023.db2.gz UKMVIYDFKAELPA-JTQLQIEISA-N 1 2 245.326 2.413 20 0 BEADLO CCn1c[nH+]cc1COC(=O)CCC(C)(F)F ZINC001518047617 989278276 /nfs/dbraw/zinc/27/82/76/989278276.db2.gz GZPWNYBAOHWSSH-UHFFFAOYSA-N 1 2 246.257 2.382 20 0 BEADLO CC(C)(C)c1c[nH]c(C[NH+]2CC3(COC3)C2)c1 ZINC001249476351 989287211 /nfs/dbraw/zinc/28/72/11/989287211.db2.gz OSHQEYMXFCYFLH-UHFFFAOYSA-N 1 2 234.343 2.144 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1cc(C(C)(C)C)c[nH]1 ZINC001249477171 989288408 /nfs/dbraw/zinc/28/84/08/989288408.db2.gz UNCDYBXKMKKJQF-UHFFFAOYSA-N 1 2 222.332 2.333 20 0 BEADLO CC(=O)C[N@H+](C)Cc1cc(C(C)(C)C)c[nH]1 ZINC001249477171 989288423 /nfs/dbraw/zinc/28/84/23/989288423.db2.gz UNCDYBXKMKKJQF-UHFFFAOYSA-N 1 2 222.332 2.333 20 0 BEADLO CC1C[NH+](Cc2nc(C3CC3)cs2)C1 ZINC001249526660 989296705 /nfs/dbraw/zinc/29/67/05/989296705.db2.gz RQNCMQFTSFZVLT-UHFFFAOYSA-N 1 2 208.330 2.472 20 0 BEADLO COC1C[NH+](Cc2cc(F)cc3cc[nH]c32)C1 ZINC001249522360 989300609 /nfs/dbraw/zinc/30/06/09/989300609.db2.gz XXKHQQPLJOSICA-UHFFFAOYSA-N 1 2 234.274 2.138 20 0 BEADLO Cc1cc(C[NH+]2CC3(C2)CCOCC3)ns1 ZINC001249578027 989310529 /nfs/dbraw/zinc/31/05/29/989310529.db2.gz CZZJMQKDOCCHOI-UHFFFAOYSA-N 1 2 238.356 2.064 20 0 BEADLO CC[NH2+]Cc1noc([C@H]2CCC[C@@H](F)C2)n1 ZINC001326236885 989445177 /nfs/dbraw/zinc/44/51/77/989445177.db2.gz RMWBSACZNMPLDX-DTWKUNHWSA-N 1 2 227.283 2.175 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@H](C)c1ccco1 ZINC001520442840 989562776 /nfs/dbraw/zinc/56/27/76/989562776.db2.gz UBKJEYKRKYCMHC-SNVBAGLBSA-N 1 2 248.282 2.343 20 0 BEADLO CCc1cc(NC2CCOCC2)nc(CC)[nH+]1 ZINC001120013930 989562812 /nfs/dbraw/zinc/56/28/12/989562812.db2.gz JZJRFRMHOITZLE-UHFFFAOYSA-N 1 2 235.331 2.192 20 0 BEADLO COc1ccc(C[NH2+]Cc2ncc(C)s2)nc1 ZINC001120033345 989572031 /nfs/dbraw/zinc/57/20/31/989572031.db2.gz NNPHOYVANFKYIR-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@H](OC(C)C)C2)n[nH]1 ZINC001326519056 989596473 /nfs/dbraw/zinc/59/64/73/989596473.db2.gz MFKSMCICJFBVOC-ZDUSSCGKSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@H](OC(C)C)C2)n[nH]1 ZINC001326519056 989596478 /nfs/dbraw/zinc/59/64/78/989596478.db2.gz MFKSMCICJFBVOC-ZDUSSCGKSA-N 1 2 237.347 2.108 20 0 BEADLO CN(C(=O)CCc1[nH+]ccn1C)c1ccsc1 ZINC001521722308 989785418 /nfs/dbraw/zinc/78/54/18/989785418.db2.gz UVIYAASQLAQVRP-UHFFFAOYSA-N 1 2 249.339 2.077 20 0 BEADLO CCC[C@@H]1CCCN1C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC001120712758 989844086 /nfs/dbraw/zinc/84/40/86/989844086.db2.gz SUESBZDIXOHWNV-WCQYABFASA-N 1 2 249.358 2.379 20 0 BEADLO CCC[C@@H]1CCCN1C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC001120712758 989844089 /nfs/dbraw/zinc/84/40/89/989844089.db2.gz SUESBZDIXOHWNV-WCQYABFASA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H](NC(=O)c1cccc2[nH+]ccn21)C1(C)CC1 ZINC001120806462 989892349 /nfs/dbraw/zinc/89/23/49/989892349.db2.gz WFUKRAZRYPQVJG-SNVBAGLBSA-N 1 2 243.310 2.253 20 0 BEADLO CCc1ccc(N2CCOC(C)(C)C2)[nH+]c1 ZINC001120881349 989943085 /nfs/dbraw/zinc/94/30/85/989943085.db2.gz BJSLNNBQPXBORQ-UHFFFAOYSA-N 1 2 220.316 2.259 20 0 BEADLO CC[C@@H](Nc1cc(N)nc[nH+]1)c1c(C)noc1C ZINC001120913092 989963768 /nfs/dbraw/zinc/96/37/68/989963768.db2.gz HNEKOOKAIULZKS-SECBINFHSA-N 1 2 247.302 2.227 20 0 BEADLO Cc1cc(F)cc(N2CC[C@@H](O)C(C)(C)C2)[nH+]1 ZINC001120926052 989970122 /nfs/dbraw/zinc/97/01/22/989970122.db2.gz OZHUMZZXKAMCJU-LLVKDONJSA-N 1 2 238.306 2.126 20 0 BEADLO CCc1ccc(N2CCC[C@](O)(C3CC3)C2)[nH+]c1 ZINC001120947066 989984000 /nfs/dbraw/zinc/98/40/00/989984000.db2.gz WHTRDKHQFPWKOI-OAHLLOKOSA-N 1 2 246.354 2.385 20 0 BEADLO CCc1ccc(N2CCC([C@@H](C)O)CC2)[nH+]c1 ZINC001120956358 989986228 /nfs/dbraw/zinc/98/62/28/989986228.db2.gz ZRFPQTLPMVXDNN-LLVKDONJSA-N 1 2 234.343 2.241 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC001121138534 990021247 /nfs/dbraw/zinc/02/12/47/990021247.db2.gz COBJHDQPUJNBQY-UPJWGTAASA-N 1 2 244.338 2.495 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)CCC(F)(F)F ZINC001121138997 990022601 /nfs/dbraw/zinc/02/26/01/990022601.db2.gz GZBRBORCGLSIAW-UHFFFAOYSA-N 1 2 246.232 2.401 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC001527011414 990198312 /nfs/dbraw/zinc/19/83/12/990198312.db2.gz CTQBHQRKCUWKMP-RTXFEEFZSA-N 1 2 248.326 2.382 20 0 BEADLO C/C=C(/C)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001527996011 990257921 /nfs/dbraw/zinc/25/79/21/990257921.db2.gz NJKIWTJBPYVXMB-OQFOIZHKSA-N 1 2 215.256 2.239 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@H]1[C@@H]2CCCC[C@@H]21 ZINC001123473552 990589371 /nfs/dbraw/zinc/58/93/71/990589371.db2.gz TZUKVNHUTVEUSP-ITGUQSILSA-N 1 2 248.326 2.382 20 0 BEADLO CCn1c[nH+]cc1COC(=O)C[C@@H]1C=CCC1 ZINC001123469877 990590102 /nfs/dbraw/zinc/59/01/02/990590102.db2.gz OJGLKYFBSMBLKY-LLVKDONJSA-N 1 2 234.299 2.303 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)Nc1ccccc1F ZINC001540393033 990614639 /nfs/dbraw/zinc/61/46/39/990614639.db2.gz USZDPQAIEKTPSK-SECBINFHSA-N 1 2 247.273 2.366 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)Nc1ccccc1F ZINC001540393033 990614645 /nfs/dbraw/zinc/61/46/45/990614645.db2.gz USZDPQAIEKTPSK-SECBINFHSA-N 1 2 247.273 2.366 20 0 BEADLO CSc1ccc(NC(=O)Cc2c[nH]c[nH+]2)cc1 ZINC001540538123 990623917 /nfs/dbraw/zinc/62/39/17/990623917.db2.gz ZQFFYKUTVSOSKF-UHFFFAOYSA-N 1 2 247.323 2.313 20 0 BEADLO O=C(Nc1ccccc1-n1cc[nH+]c1)[C@H]1C[C@H]1F ZINC001540721369 990643493 /nfs/dbraw/zinc/64/34/93/990643493.db2.gz ZRADVOFQUAZQLQ-VHSXEESVSA-N 1 2 245.257 2.169 20 0 BEADLO Cn1cc[nH+]c1CCNC(=O)C1CCCCCC1 ZINC001123919384 990704465 /nfs/dbraw/zinc/70/44/65/990704465.db2.gz YSIHKKOUCNTCIG-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO CC[C@H]1CCCCCN1C(=O)Cc1[nH]c[nH+]c1C ZINC001544115916 990713606 /nfs/dbraw/zinc/71/36/06/990713606.db2.gz WGJBXJHLDYEIBO-LBPRGKRZSA-N 1 2 249.358 2.442 20 0 BEADLO CCCCC(=O)N1CCC(Cc2c[nH]c[nH+]2)CC1 ZINC001123991528 990725892 /nfs/dbraw/zinc/72/58/92/990725892.db2.gz WMYPVPQYMFQVOR-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO CC[C@@H]1CCN(C(=O)C[C@@H](C)n2cc[nH+]c2)[C@@H]1C ZINC001556272952 990758153 /nfs/dbraw/zinc/75/81/53/990758153.db2.gz JMMDUMQWHOCDHF-JHJVBQTASA-N 1 2 249.358 2.481 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CCC[C@H](C(C)C)C1 ZINC001556234272 990811580 /nfs/dbraw/zinc/81/15/80/990811580.db2.gz QVSIKFGPHUHLKS-LBPRGKRZSA-N 1 2 249.358 2.155 20 0 BEADLO Cc1nn(C)c(Cl)c1C[NH+]1CC2(CCC2)C1 ZINC001137746201 990847912 /nfs/dbraw/zinc/84/79/12/990847912.db2.gz HIXADORXOQCKOL-UHFFFAOYSA-N 1 2 239.750 2.368 20 0 BEADLO CC(=O)OC1C[NH+](Cc2c(C)cccc2C)C1 ZINC001137851737 990861310 /nfs/dbraw/zinc/86/13/10/990861310.db2.gz SDBOTXNTQHOUTE-UHFFFAOYSA-N 1 2 233.311 2.051 20 0 BEADLO C[C@@]1(O)CC[N@H+](Cc2cc(F)cc(F)c2F)C1 ZINC001137868833 990862050 /nfs/dbraw/zinc/86/20/50/990862050.db2.gz TTYZRQNQNBOIKA-GFCCVEGCSA-N 1 2 245.244 2.061 20 0 BEADLO C[C@@]1(O)CC[N@@H+](Cc2cc(F)cc(F)c2F)C1 ZINC001137868833 990862053 /nfs/dbraw/zinc/86/20/53/990862053.db2.gz TTYZRQNQNBOIKA-GFCCVEGCSA-N 1 2 245.244 2.061 20 0 BEADLO C[C@@H]1C[C@@H](O)C[N@@H+]1Cc1cc(F)cc(F)c1F ZINC001137869002 990862159 /nfs/dbraw/zinc/86/21/59/990862159.db2.gz YTOFSXZVRAVIJX-GMSGAONNSA-N 1 2 245.244 2.059 20 0 BEADLO C[C@@H]1C[C@@H](O)C[N@H+]1Cc1cc(F)cc(F)c1F ZINC001137869002 990862163 /nfs/dbraw/zinc/86/21/63/990862163.db2.gz YTOFSXZVRAVIJX-GMSGAONNSA-N 1 2 245.244 2.059 20 0 BEADLO OC[C@H]1CCC[N@@H+]1Cc1c(F)ccc(F)c1F ZINC001137926845 990870215 /nfs/dbraw/zinc/87/02/15/990870215.db2.gz DIFHHJUQBQQPEW-MRVPVSSYSA-N 1 2 245.244 2.061 20 0 BEADLO OC[C@H]1CCC[N@H+]1Cc1c(F)ccc(F)c1F ZINC001137926845 990870216 /nfs/dbraw/zinc/87/02/16/990870216.db2.gz DIFHHJUQBQQPEW-MRVPVSSYSA-N 1 2 245.244 2.061 20 0 BEADLO Cn1nc(C(F)(F)F)c(C[NH+](C)C)c1Cl ZINC001137942429 990870493 /nfs/dbraw/zinc/87/04/93/990870493.db2.gz KSXLDHQRMMSXKR-UHFFFAOYSA-N 1 2 241.644 2.154 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)C1CC2(CCC2)C1 ZINC000830625165 990881161 /nfs/dbraw/zinc/88/11/61/990881161.db2.gz ADWFLRGOCCPIPJ-UHFFFAOYSA-N 1 2 248.326 2.397 20 0 BEADLO FC1(F)Oc2cccc(C[NH+]3CC=CC3)c2O1 ZINC001138063977 990881198 /nfs/dbraw/zinc/88/11/98/990881198.db2.gz PKWSKDLILZXQBG-UHFFFAOYSA-N 1 2 239.221 2.380 20 0 BEADLO CC(C)=CCNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001138229069 990902260 /nfs/dbraw/zinc/90/22/60/990902260.db2.gz TUCMHDMDCCCYNO-UHFFFAOYSA-N 1 2 229.283 2.259 20 0 BEADLO COC1C[NH+](Cc2[nH]c3ccccc3c2C)C1 ZINC001138396850 990933195 /nfs/dbraw/zinc/93/31/95/990933195.db2.gz GULJEKQRIFXEGV-UHFFFAOYSA-N 1 2 230.311 2.307 20 0 BEADLO CCOC1C[NH+](Cc2ccc(N(C)C)s2)C1 ZINC001138490093 990958717 /nfs/dbraw/zinc/95/87/17/990958717.db2.gz ZVCIWUVCRQVFKJ-UHFFFAOYSA-N 1 2 240.372 2.035 20 0 BEADLO CCCn1c[nH+]cc1CNc1n[nH]c(CC)c1C ZINC001308325636 990967532 /nfs/dbraw/zinc/96/75/32/990967532.db2.gz NDJADINWTANYDA-UHFFFAOYSA-N 1 2 247.346 2.499 20 0 BEADLO CC(C)C[C@@H](C)C[C@@H](C)[N@@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001258075096 990972959 /nfs/dbraw/zinc/97/29/59/990972959.db2.gz RCTMZUPEDLDRRA-NDBYEHHHSA-N 1 2 239.359 2.447 20 0 BEADLO CC(C)C[C@@H](C)C[C@@H](C)[N@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001258075096 990972965 /nfs/dbraw/zinc/97/29/65/990972965.db2.gz RCTMZUPEDLDRRA-NDBYEHHHSA-N 1 2 239.359 2.447 20 0 BEADLO Cc1ccc2[nH+]c(NCc3cnn(C)c3)[nH]c2c1 ZINC001308501367 991009459 /nfs/dbraw/zinc/00/94/59/991009459.db2.gz MNEPKIBNGVSNDK-UHFFFAOYSA-N 1 2 241.298 2.217 20 0 BEADLO CSc1ncc(C[NH+]2CC3(CCC3)C2)cn1 ZINC001138701438 991013775 /nfs/dbraw/zinc/01/37/75/991013775.db2.gz MRYBBPQTBPQNBO-UHFFFAOYSA-N 1 2 235.356 2.184 20 0 BEADLO C[C@@H]1CC(=O)CC[N@@H+]1Cc1cnc2[nH]ccc2c1 ZINC001138736936 991020652 /nfs/dbraw/zinc/02/06/52/991020652.db2.gz KFHHKRIJYIQRGO-SNVBAGLBSA-N 1 2 243.310 2.116 20 0 BEADLO C[C@@H]1CC(=O)CC[N@H+]1Cc1cnc2[nH]ccc2c1 ZINC001138736936 991020661 /nfs/dbraw/zinc/02/06/61/991020661.db2.gz KFHHKRIJYIQRGO-SNVBAGLBSA-N 1 2 243.310 2.116 20 0 BEADLO CCCOC1C[NH+](Cc2cnc3[nH]ccc3c2)C1 ZINC001138740549 991029367 /nfs/dbraw/zinc/02/93/67/991029367.db2.gz BXOOAEPDPZYUEL-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO Cc1c[nH]c(Nc2c(F)c(F)nc(F)c2F)[nH+]1 ZINC001559135303 991037637 /nfs/dbraw/zinc/03/76/37/991037637.db2.gz FCOAKWBMHFQIKX-UHFFFAOYSA-N 1 2 246.167 2.413 20 0 BEADLO Cc1nc(N2C[C@H]3[C@H]4C=C[C@H](C4)[C@@]3(C)C2)cc[nH+]1 ZINC001559292074 991065700 /nfs/dbraw/zinc/06/57/00/991065700.db2.gz AHLQDAMSFXAXQQ-SFDCQRBFSA-N 1 2 241.338 2.433 20 0 BEADLO Clc1cc(C[NH+]2CC3(CSC3)C2)ccn1 ZINC001138821408 991075367 /nfs/dbraw/zinc/07/53/67/991075367.db2.gz QFGULYLNNJBCJX-UHFFFAOYSA-N 1 2 240.759 2.284 20 0 BEADLO Cc1cc(C[N@@H+]2CCCC[C@@](C)(F)C2)nn1C ZINC001138826665 991082687 /nfs/dbraw/zinc/08/26/87/991082687.db2.gz NOZAKEXGYGYWKB-CYBMUJFWSA-N 1 2 239.338 2.443 20 0 BEADLO Cc1cc(C[N@H+]2CCCC[C@@](C)(F)C2)nn1C ZINC001138826665 991082695 /nfs/dbraw/zinc/08/26/95/991082695.db2.gz NOZAKEXGYGYWKB-CYBMUJFWSA-N 1 2 239.338 2.443 20 0 BEADLO CC[N@H+](CCOC)Cc1cc(F)cnc1Cl ZINC001138888750 991093110 /nfs/dbraw/zinc/09/31/10/991093110.db2.gz PYICDQODYIJDDJ-UHFFFAOYSA-N 1 2 246.713 2.342 20 0 BEADLO CC[N@@H+](CCOC)Cc1cc(F)cnc1Cl ZINC001138888750 991093115 /nfs/dbraw/zinc/09/31/15/991093115.db2.gz PYICDQODYIJDDJ-UHFFFAOYSA-N 1 2 246.713 2.342 20 0 BEADLO CSCC[C@@H](C)[NH2+][C@@H](C)C(=O)OC(C)C ZINC001258199012 991116061 /nfs/dbraw/zinc/11/60/61/991116061.db2.gz AZIGQQHMSNKBTP-ZJUUUORDSA-N 1 2 233.377 2.058 20 0 BEADLO C[C@@H](O)C[N@H+](C)Cc1cncc(Cl)c1Cl ZINC001308786781 991130636 /nfs/dbraw/zinc/13/06/36/991130636.db2.gz OKDDTXAEPDRVFO-SSDOTTSWSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@@H](O)C[N@@H+](C)Cc1cncc(Cl)c1Cl ZINC001308786781 991130642 /nfs/dbraw/zinc/13/06/42/991130642.db2.gz OKDDTXAEPDRVFO-SSDOTTSWSA-N 1 2 249.141 2.201 20 0 BEADLO C[N@H+](Cc1cc2ccccc2o1)C1COC1 ZINC001139066388 991137063 /nfs/dbraw/zinc/13/70/63/991137063.db2.gz SFPLPLCTCQVBJT-UHFFFAOYSA-N 1 2 217.268 2.263 20 0 BEADLO C[N@@H+](Cc1cc2ccccc2o1)C1COC1 ZINC001139066388 991137072 /nfs/dbraw/zinc/13/70/72/991137072.db2.gz SFPLPLCTCQVBJT-UHFFFAOYSA-N 1 2 217.268 2.263 20 0 BEADLO Clc1cc(C[NH+]2CCC2)cc2c1OCO2 ZINC001139071660 991137770 /nfs/dbraw/zinc/13/77/70/991137770.db2.gz NQLCTJDIQUTVHJ-UHFFFAOYSA-N 1 2 225.675 2.274 20 0 BEADLO Cn1cc(C[NH+]2CC3(CCC3)C2)c(Cl)n1 ZINC001308808249 991143724 /nfs/dbraw/zinc/14/37/24/991143724.db2.gz RYTIBPJVOJYUBK-UHFFFAOYSA-N 1 2 225.723 2.059 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NCC1C(C)(C)C1(C)C ZINC001139128269 991157903 /nfs/dbraw/zinc/15/79/03/991157903.db2.gz OXIDKGUJXPWCOB-UHFFFAOYSA-N 1 2 249.358 2.059 20 0 BEADLO COc1cc(O)ccc1C[N@@H+]1CCC[C@@H](F)C1 ZINC001139139776 991160277 /nfs/dbraw/zinc/16/02/77/991160277.db2.gz AQLTXBGYMJVDRP-LLVKDONJSA-N 1 2 239.290 2.335 20 0 BEADLO COc1cc(O)ccc1C[N@H+]1CCC[C@@H](F)C1 ZINC001139139776 991160288 /nfs/dbraw/zinc/16/02/88/991160288.db2.gz AQLTXBGYMJVDRP-LLVKDONJSA-N 1 2 239.290 2.335 20 0 BEADLO COc1cc(O)ccc1C[N@H+](C)Cc1ccno1 ZINC001139145159 991163041 /nfs/dbraw/zinc/16/30/41/991163041.db2.gz SFVDQKYMWYDUHU-UHFFFAOYSA-N 1 2 248.282 2.021 20 0 BEADLO COc1cc(O)ccc1C[N@@H+](C)Cc1ccno1 ZINC001139145159 991163044 /nfs/dbraw/zinc/16/30/44/991163044.db2.gz SFVDQKYMWYDUHU-UHFFFAOYSA-N 1 2 248.282 2.021 20 0 BEADLO c1cnc2cc(C[N@@H+]3CCO[C@@H]4C[C@@H]43)ccc2c1 ZINC001139170323 991178687 /nfs/dbraw/zinc/17/86/87/991178687.db2.gz CJNAKBCSAUDVKI-LSDHHAIUSA-N 1 2 240.306 2.208 20 0 BEADLO c1cnc2cc(C[N@H+]3CCO[C@@H]4C[C@@H]43)ccc2c1 ZINC001139170323 991178700 /nfs/dbraw/zinc/17/87/00/991178700.db2.gz CJNAKBCSAUDVKI-LSDHHAIUSA-N 1 2 240.306 2.208 20 0 BEADLO F[C@H]1CC[N@H+](Cc2ccc3nsnc3c2)C1 ZINC001139210199 991196739 /nfs/dbraw/zinc/19/67/39/991196739.db2.gz HPFWGMCMRGGJQJ-VIFPVBQESA-N 1 2 237.303 2.235 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2ccc3nsnc3c2)C1 ZINC001139210199 991196745 /nfs/dbraw/zinc/19/67/45/991196745.db2.gz HPFWGMCMRGGJQJ-VIFPVBQESA-N 1 2 237.303 2.235 20 0 BEADLO CCC1(C[N@@H+]2CC[C@@H](C)C(F)(F)C2)COC1 ZINC001202927082 991234317 /nfs/dbraw/zinc/23/43/17/991234317.db2.gz PDCLQGOGOMAUHV-SNVBAGLBSA-N 1 2 233.302 2.390 20 0 BEADLO CCC1(C[N@H+]2CC[C@@H](C)C(F)(F)C2)COC1 ZINC001202927082 991234329 /nfs/dbraw/zinc/23/43/29/991234329.db2.gz PDCLQGOGOMAUHV-SNVBAGLBSA-N 1 2 233.302 2.390 20 0 BEADLO CSC(C)(C)C[C@@H](C)[NH2+]CC(=O)OC(C)C ZINC001258314995 991240047 /nfs/dbraw/zinc/24/00/47/991240047.db2.gz JCWAJKWHHHVVDA-SNVBAGLBSA-N 1 2 247.404 2.448 20 0 BEADLO COc1ccc(C[NH+]2CC(C)(O)C2)cc1C(C)C ZINC001139616156 991290185 /nfs/dbraw/zinc/29/01/85/991290185.db2.gz BCYPWBNRAYYWNC-UHFFFAOYSA-N 1 2 249.354 2.385 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1ccnc(F)c1 ZINC001139830490 991384765 /nfs/dbraw/zinc/38/47/65/991384765.db2.gz BVZFOGKBTZAKKU-SCZZXKLOSA-N 1 2 212.243 2.153 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1ccnc(F)c1 ZINC001139830490 991384777 /nfs/dbraw/zinc/38/47/77/991384777.db2.gz BVZFOGKBTZAKKU-SCZZXKLOSA-N 1 2 212.243 2.153 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC(=O)[C@@H](C)CC2)nc1 ZINC001139839709 991401157 /nfs/dbraw/zinc/40/11/57/991401157.db2.gz POOPBBUBPIGEEW-LBPRGKRZSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1ccc(C[N@H+]2CCC(=O)[C@@H](C)CC2)nc1 ZINC001139839709 991401159 /nfs/dbraw/zinc/40/11/59/991401159.db2.gz POOPBBUBPIGEEW-LBPRGKRZSA-N 1 2 232.327 2.191 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1cc2ccccc2n1C ZINC001139868067 991406369 /nfs/dbraw/zinc/40/63/69/991406369.db2.gz GHPHJWGHMZVGBT-UHFFFAOYSA-N 1 2 230.311 2.199 20 0 BEADLO CC(=O)C[N@H+](C)Cc1cc2ccccc2n1C ZINC001139868067 991406374 /nfs/dbraw/zinc/40/63/74/991406374.db2.gz GHPHJWGHMZVGBT-UHFFFAOYSA-N 1 2 230.311 2.199 20 0 BEADLO c1ccc2c(c1)cncc2C[NH+]1CC2(CCO2)C1 ZINC001139894923 991414996 /nfs/dbraw/zinc/41/49/96/991414996.db2.gz KMHAOCUFRWCTLJ-UHFFFAOYSA-N 1 2 240.306 2.210 20 0 BEADLO Cc1ccc(C[N@@H+]2CCc3cccnc3C2)cn1 ZINC001139933309 991423462 /nfs/dbraw/zinc/42/34/62/991423462.db2.gz XETSCGYVOPWSCT-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1ccc(C[N@H+]2CCc3cccnc3C2)cn1 ZINC001139933309 991423472 /nfs/dbraw/zinc/42/34/72/991423472.db2.gz XETSCGYVOPWSCT-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO c1cnnc(C[N@@H+]2CCOC3(CCCCC3)C2)c1 ZINC001139972602 991444532 /nfs/dbraw/zinc/44/45/32/991444532.db2.gz VTLPMXXQBVSLDS-UHFFFAOYSA-N 1 2 247.342 2.012 20 0 BEADLO c1cnnc(C[N@H+]2CCOC3(CCCCC3)C2)c1 ZINC001139972602 991444538 /nfs/dbraw/zinc/44/45/38/991444538.db2.gz VTLPMXXQBVSLDS-UHFFFAOYSA-N 1 2 247.342 2.012 20 0 BEADLO Fc1cccc2c1CC[N@H+](Cc1ccnnc1)C2 ZINC001139985378 991467153 /nfs/dbraw/zinc/46/71/53/991467153.db2.gz PRVHMMRFXSKVBO-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1cccc2c1CC[N@@H+](Cc1ccnnc1)C2 ZINC001139985378 991467154 /nfs/dbraw/zinc/46/71/54/991467154.db2.gz PRVHMMRFXSKVBO-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO C[N@H+](Cc1cnc(Cl)nc1)Cc1ccccn1 ZINC001139987567 991468995 /nfs/dbraw/zinc/46/89/95/991468995.db2.gz XUBAQXGNBOEUCK-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[N@@H+](Cc1cnc(Cl)nc1)Cc1ccccn1 ZINC001139987567 991469001 /nfs/dbraw/zinc/46/90/01/991469001.db2.gz XUBAQXGNBOEUCK-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO F[C@H]1C[C@@H]2C[C@H]1C[N@@H+]2Cc1cnc(Cl)nc1 ZINC001139991435 991469724 /nfs/dbraw/zinc/46/97/24/991469724.db2.gz KFQYKZHCDKIASC-GUBZILKMSA-N 1 2 241.697 2.062 20 0 BEADLO F[C@H]1C[C@@H]2C[C@H]1C[N@H+]2Cc1cnc(Cl)nc1 ZINC001139991435 991469727 /nfs/dbraw/zinc/46/97/27/991469727.db2.gz KFQYKZHCDKIASC-GUBZILKMSA-N 1 2 241.697 2.062 20 0 BEADLO C[N@H+](Cc1cc2ccccc2cn1)C1COC1 ZINC001139999452 991472025 /nfs/dbraw/zinc/47/20/25/991472025.db2.gz UCRAWYXGGGTAKK-UHFFFAOYSA-N 1 2 228.295 2.065 20 0 BEADLO C[N@@H+](Cc1cc2ccccc2cn1)C1COC1 ZINC001139999452 991472032 /nfs/dbraw/zinc/47/20/32/991472032.db2.gz UCRAWYXGGGTAKK-UHFFFAOYSA-N 1 2 228.295 2.065 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1cc2ccccc2cn1 ZINC001139994947 991474441 /nfs/dbraw/zinc/47/44/41/991474441.db2.gz FAADMEKSQZKZQI-UHFFFAOYSA-N 1 2 228.295 2.256 20 0 BEADLO CC(=O)C[N@H+](C)Cc1cc2ccccc2cn1 ZINC001139994947 991474450 /nfs/dbraw/zinc/47/44/50/991474450.db2.gz FAADMEKSQZKZQI-UHFFFAOYSA-N 1 2 228.295 2.256 20 0 BEADLO CCCC1CCC([N@@H+]2CCOC(=O)C2)CC1 ZINC001258534388 991484355 /nfs/dbraw/zinc/48/43/55/991484355.db2.gz ZAYUXPMGQQNAIB-UHFFFAOYSA-N 1 2 225.332 2.204 20 0 BEADLO CCCC1CCC([N@H+]2CCOC(=O)C2)CC1 ZINC001258534388 991484362 /nfs/dbraw/zinc/48/43/62/991484362.db2.gz ZAYUXPMGQQNAIB-UHFFFAOYSA-N 1 2 225.332 2.204 20 0 BEADLO COc1ccc2n[nH]c(C[N@@H+]3CC[C@@H](F)C3)c2c1 ZINC001140065020 991514701 /nfs/dbraw/zinc/51/47/01/991514701.db2.gz WJNLWVVWTHJWTK-SECBINFHSA-N 1 2 249.289 2.115 20 0 BEADLO COc1ccc2n[nH]c(C[N@H+]3CC[C@@H](F)C3)c2c1 ZINC001140065020 991514709 /nfs/dbraw/zinc/51/47/09/991514709.db2.gz WJNLWVVWTHJWTK-SECBINFHSA-N 1 2 249.289 2.115 20 0 BEADLO CC[C@@H](NCc1c[nH+]cn1CC)C(F)(F)F ZINC001560626181 991532467 /nfs/dbraw/zinc/53/24/67/991532467.db2.gz FJPSECXZECGQER-SECBINFHSA-N 1 2 235.253 2.334 20 0 BEADLO C[C@H]1c2cccn2CC[N@H+]1Cc1ccncc1O ZINC001140276433 991584558 /nfs/dbraw/zinc/58/45/58/991584558.db2.gz FDEFWVPBJLEMRJ-NSHDSACASA-N 1 2 243.310 2.166 20 0 BEADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1ccncc1O ZINC001140276433 991584568 /nfs/dbraw/zinc/58/45/68/991584568.db2.gz FDEFWVPBJLEMRJ-NSHDSACASA-N 1 2 243.310 2.166 20 0 BEADLO Cc1ccc2n[nH]c(C[N@@H+]3CC[C@@H](F)C3)c2c1 ZINC001140328837 991607255 /nfs/dbraw/zinc/60/72/55/991607255.db2.gz MMWKEDAMJIKXET-SNVBAGLBSA-N 1 2 233.290 2.415 20 0 BEADLO Cc1ccc2n[nH]c(C[N@H+]3CC[C@@H](F)C3)c2c1 ZINC001140328837 991607259 /nfs/dbraw/zinc/60/72/59/991607259.db2.gz MMWKEDAMJIKXET-SNVBAGLBSA-N 1 2 233.290 2.415 20 0 BEADLO C[C@H](C(=O)N1CCC[C@H]1C1CCC1)n1cc[nH+]c1 ZINC001318227882 991636834 /nfs/dbraw/zinc/63/68/34/991636834.db2.gz YYADYUBLEDNNPN-YPMHNXCESA-N 1 2 247.342 2.235 20 0 BEADLO C[C@@H]1C[C@H](O)C[N@@H+]1Cc1c(F)cc(F)cc1F ZINC001140529989 991661540 /nfs/dbraw/zinc/66/15/40/991661540.db2.gz LLELNCSVWCQROF-APPZFPTMSA-N 1 2 245.244 2.059 20 0 BEADLO C[C@@H]1C[C@H](O)C[N@H+]1Cc1c(F)cc(F)cc1F ZINC001140529989 991661545 /nfs/dbraw/zinc/66/15/45/991661545.db2.gz LLELNCSVWCQROF-APPZFPTMSA-N 1 2 245.244 2.059 20 0 BEADLO Cc1ccc(-c2nnc(C[NH+]3CCC3)o2)cc1F ZINC001258768675 991731350 /nfs/dbraw/zinc/73/13/50/991731350.db2.gz MJZKVNBHKRVPKN-UHFFFAOYSA-N 1 2 247.273 2.390 20 0 BEADLO C[C@@H](C(=O)N1C[C@H](C)CC[C@H]1C)n1cc[nH+]c1 ZINC001318913620 991735126 /nfs/dbraw/zinc/73/51/26/991735126.db2.gz UDKSVJJIAMNFKV-UTUOFQBUSA-N 1 2 235.331 2.091 20 0 BEADLO CCOC=CC(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC001566328975 991840731 /nfs/dbraw/zinc/84/07/31/991840731.db2.gz KDXPBCBPPSGDCA-VOTSOKGWSA-N 1 2 245.282 2.360 20 0 BEADLO Cc1cscc1NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001319384175 991853153 /nfs/dbraw/zinc/85/31/53/991853153.db2.gz XIJIOSNYDRAKGL-SECBINFHSA-N 1 2 235.312 2.453 20 0 BEADLO C[C@H](C(=O)NCC1(C2CC2)CCC1)n1cc[nH+]c1 ZINC001319530945 991887443 /nfs/dbraw/zinc/88/74/43/991887443.db2.gz NNSYWXRNCUAGBH-LLVKDONJSA-N 1 2 247.342 2.141 20 0 BEADLO COC(=O)C[N@@H+](Cc1ccsc1)CC(C)C ZINC001319714973 991945826 /nfs/dbraw/zinc/94/58/26/991945826.db2.gz HSBQSKGHDHHHKA-UHFFFAOYSA-N 1 2 241.356 2.379 20 0 BEADLO COC(=O)C[N@H+](Cc1ccsc1)CC(C)C ZINC001319714973 991945839 /nfs/dbraw/zinc/94/58/39/991945839.db2.gz HSBQSKGHDHHHKA-UHFFFAOYSA-N 1 2 241.356 2.379 20 0 BEADLO C[C@H](C(=O)NC1(C)CCCCC1)n1cc[nH+]c1 ZINC001320178577 992123519 /nfs/dbraw/zinc/12/35/19/992123519.db2.gz CLCZRKGMSWGFBB-LLVKDONJSA-N 1 2 235.331 2.283 20 0 BEADLO CC(C)(CF)[NH2+]Cc1cnn(-c2ccccc2)n1 ZINC001320334996 992174922 /nfs/dbraw/zinc/17/49/22/992174922.db2.gz KYPXJVUOJLEHCJ-UHFFFAOYSA-N 1 2 248.305 2.105 20 0 BEADLO C[C@H](c1noc([C@H](C)n2cc[nH+]c2)n1)C1CC1 ZINC001320500289 992223110 /nfs/dbraw/zinc/22/31/10/992223110.db2.gz QKOGVGDOJYBFEQ-IUCAKERBSA-N 1 2 232.287 2.389 20 0 BEADLO C[NH+](C)Cc1nnc([C@@H]2CCCC(F)(F)C2)o1 ZINC001261432374 992300692 /nfs/dbraw/zinc/30/06/92/992300692.db2.gz LQBQJZQZKQCYMY-MRVPVSSYSA-N 1 2 245.273 2.424 20 0 BEADLO CN(C)c1cc(COC(=O)CC2(C)CC2)cc[nH+]1 ZINC001320882171 992387166 /nfs/dbraw/zinc/38/71/66/992387166.db2.gz NLNOAMTZXYHESX-UHFFFAOYSA-N 1 2 248.326 2.381 20 0 BEADLO C[C@@H](C(=O)NC1CCC2(CC2)CC1)n1cc[nH+]c1 ZINC001320917716 992403550 /nfs/dbraw/zinc/40/35/50/992403550.db2.gz KNFCHDCLBMGZTE-NSHDSACASA-N 1 2 247.342 2.283 20 0 BEADLO CCC[C@@H](CC)C(=O)N1CCn2c[nH+]cc2C1 ZINC001262016408 992607110 /nfs/dbraw/zinc/60/71/10/992607110.db2.gz UEFGCUHWDMFEHM-LLVKDONJSA-N 1 2 235.331 2.052 20 0 BEADLO CCc1nccc(Nc2ccc(N(C)C)[nH+]c2)n1 ZINC001262057332 992638060 /nfs/dbraw/zinc/63/80/60/992638060.db2.gz QVLJDKQZLNCIOA-UHFFFAOYSA-N 1 2 243.314 2.244 20 0 BEADLO C[C@@H]1CC=CC[C@@H]1COC(=O)[C@H]1CCCC[NH2+]1 ZINC001573633775 992662920 /nfs/dbraw/zinc/66/29/20/992662920.db2.gz BBKBOMLGSVSCEX-JHJVBQTASA-N 1 2 237.343 2.274 20 0 BEADLO CC1(C)CC[N@H+](Cc2nncs2)CCS1 ZINC001262278311 992834570 /nfs/dbraw/zinc/83/45/70/992834570.db2.gz AGGYOVLJUIRJAO-UHFFFAOYSA-N 1 2 243.401 2.256 20 0 BEADLO CC1(C)CC[N@@H+](Cc2nncs2)CCS1 ZINC001262278311 992834572 /nfs/dbraw/zinc/83/45/72/992834572.db2.gz AGGYOVLJUIRJAO-UHFFFAOYSA-N 1 2 243.401 2.256 20 0 BEADLO Cc1cc(F)cc(N(C)CCOCC2CC2)[nH+]1 ZINC001262686708 993025958 /nfs/dbraw/zinc/02/59/58/993025958.db2.gz RXFPFIUSJMLZLP-UHFFFAOYSA-N 1 2 238.306 2.392 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@H]([C@H](C)O)C2)[nH+]1 ZINC001262688401 993028972 /nfs/dbraw/zinc/02/89/72/993028972.db2.gz PNKIEYFRYHZEGD-QWRGUYRKSA-N 1 2 238.306 2.126 20 0 BEADLO C[C@@H]1CCC[C@H](C)N(C(=O)C[C@@H]([NH3+])C(F)F)C1 ZINC001263085651 993104591 /nfs/dbraw/zinc/10/45/91/993104591.db2.gz HZXXCRCNQYXWJZ-KXUCPTDWSA-N 1 2 248.317 2.006 20 0 BEADLO CCC[C@@H](C)C(=O)OCCCc1c[nH+]cn1C ZINC001263509805 993351733 /nfs/dbraw/zinc/35/17/33/993351733.db2.gz HXBUWDAFTYIJRJ-LLVKDONJSA-N 1 2 238.331 2.332 20 0 BEADLO Cn1c[nH+]cc1CCCOC(=O)CC(C)(C)C ZINC001263509758 993352021 /nfs/dbraw/zinc/35/20/21/993352021.db2.gz GPPCGJKYVXPMBE-UHFFFAOYSA-N 1 2 238.331 2.332 20 0 BEADLO C[N@@H+](Cc1cn[nH]n1)C[C@H]1CCCC(C)(C)C1 ZINC001576859576 993439420 /nfs/dbraw/zinc/43/94/20/993439420.db2.gz KDEACQXSQITBDQ-NSHDSACASA-N 1 2 236.363 2.453 20 0 BEADLO C[N@H+](Cc1cn[nH]n1)C[C@H]1CCCC(C)(C)C1 ZINC001576859576 993439423 /nfs/dbraw/zinc/43/94/23/993439423.db2.gz KDEACQXSQITBDQ-NSHDSACASA-N 1 2 236.363 2.453 20 0 BEADLO CCC[C@H](CC)NC(=O)CCc1[nH+]ccn1C ZINC001263721043 993477582 /nfs/dbraw/zinc/47/75/82/993477582.db2.gz GMVIEDJVVJRTLT-NSHDSACASA-N 1 2 237.347 2.048 20 0 BEADLO Cc1ccnc(C[NH2+][C@H]2C[C@H](C)n3ccnc32)c1 ZINC000385979372 993674595 /nfs/dbraw/zinc/67/45/95/993674595.db2.gz NWYYTBWSTFVRQS-AAEUAGOBSA-N 1 2 242.326 2.382 20 0 BEADLO CN(C)c1ccc(Nc2cnccc2C#N)c[nH+]1 ZINC000387179053 993700385 /nfs/dbraw/zinc/70/03/85/993700385.db2.gz DALWJSPFGQRNLY-UHFFFAOYSA-N 1 2 239.282 2.158 20 0 BEADLO CCO[C@@H]1CC[N@H+](Cc2cnc(Cl)s2)C1 ZINC000701693988 993900194 /nfs/dbraw/zinc/90/01/94/993900194.db2.gz ZGQVHGXLLVMMLI-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO CCO[C@@H]1CC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC000701693988 993900203 /nfs/dbraw/zinc/90/02/03/993900203.db2.gz ZGQVHGXLLVMMLI-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO Cc1[nH]c(CN2CCOc3ccccc3C2)c[nH+]1 ZINC000724780565 994077375 /nfs/dbraw/zinc/07/73/75/994077375.db2.gz AHTOANKMDHKGPH-UHFFFAOYSA-N 1 2 243.310 2.113 20 0 BEADLO Cc1[nH]cc(CN2CCOc3ccccc3C2)[nH+]1 ZINC000724780565 994077377 /nfs/dbraw/zinc/07/73/77/994077377.db2.gz AHTOANKMDHKGPH-UHFFFAOYSA-N 1 2 243.310 2.113 20 0 BEADLO CC(=O)[C@@H]1CCC[N@@H+]1Cc1ccccc1F ZINC000725329575 994102834 /nfs/dbraw/zinc/10/28/34/994102834.db2.gz AMZBVLUXYQTFIU-ZDUSSCGKSA-N 1 2 221.275 2.379 20 0 BEADLO CC(=O)[C@@H]1CCC[N@H+]1Cc1ccccc1F ZINC000725329575 994102840 /nfs/dbraw/zinc/10/28/40/994102840.db2.gz AMZBVLUXYQTFIU-ZDUSSCGKSA-N 1 2 221.275 2.379 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)c1cccnc1C ZINC001288770405 994478776 /nfs/dbraw/zinc/47/87/76/994478776.db2.gz GFDMIMNLJDATPA-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO CC(=O)CCC(C)(C)C(=O)Nc1cc[nH+]c(C)c1 ZINC001293449561 994654113 /nfs/dbraw/zinc/65/41/13/994654113.db2.gz BUVIWNGCDDJOHB-UHFFFAOYSA-N 1 2 248.326 2.146 20 0 BEADLO Cc1nc(N(C)C[C@]23CCC[C@H]2OCC3)cc[nH+]1 ZINC001337430096 995178817 /nfs/dbraw/zinc/17/88/17/995178817.db2.gz SWLYJFDUXMYAQL-TZMCWYRMSA-N 1 2 247.342 2.180 20 0 BEADLO CCC(F)(F)C(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001304107220 995190521 /nfs/dbraw/zinc/19/05/21/995190521.db2.gz GXRVYBJUUQMJHB-UHFFFAOYSA-N 1 2 245.273 2.195 20 0 BEADLO CCC(F)(F)C(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001304107220 995190517 /nfs/dbraw/zinc/19/05/17/995190517.db2.gz GXRVYBJUUQMJHB-UHFFFAOYSA-N 1 2 245.273 2.195 20 0 BEADLO CC(C)n1cc([C@H](C)Nc2cc(N)nc[nH+]2)cn1 ZINC001337772544 995218135 /nfs/dbraw/zinc/21/81/35/995218135.db2.gz ZBLKCWIWFHLOAN-VIFPVBQESA-N 1 2 246.318 2.009 20 0 BEADLO Cc1cc(N2CC[C@H](O)[C@@H]2C)nc(C2CCC2)[nH+]1 ZINC001307119090 995289885 /nfs/dbraw/zinc/28/98/85/995289885.db2.gz CLEQRSASMGTLOU-JQWIXIFHSA-N 1 2 247.342 2.012 20 0 BEADLO Cc1cnc(C[N@@H+]2CC[C@@H]3[C@H](C2)C3(F)F)o1 ZINC001307597187 995410779 /nfs/dbraw/zinc/41/07/79/995410779.db2.gz MHVHKYYVQLWNHB-BDAKNGLRSA-N 1 2 228.242 2.070 20 0 BEADLO Cc1cnc(C[N@H+]2CC[C@@H]3[C@H](C2)C3(F)F)o1 ZINC001307597187 995410784 /nfs/dbraw/zinc/41/07/84/995410784.db2.gz MHVHKYYVQLWNHB-BDAKNGLRSA-N 1 2 228.242 2.070 20 0 BEADLO CCc1ccc(C[NH+]2CCC(=O)CC2)cc1 ZINC000019729411 1170131514 /nfs/dbraw/zinc/13/15/14/1170131514.db2.gz DKOJCLLZPXDVQQ-UHFFFAOYSA-N 1 2 217.312 2.414 20 0 BEADLO O=C1CC[NH+](Cc2cccc3cccnc32)CC1 ZINC000020246589 1170149980 /nfs/dbraw/zinc/14/99/80/1170149980.db2.gz RSNBRZCQCXXUPJ-UHFFFAOYSA-N 1 2 240.306 2.400 20 0 BEADLO Cc1cnc(C[NH2+]Cc2cccc(F)n2)s1 ZINC001620867862 1170163126 /nfs/dbraw/zinc/16/31/26/1170163126.db2.gz FDILHJBMXTYAIH-UHFFFAOYSA-N 1 2 237.303 2.275 20 0 BEADLO Cc1nonc1C[NH2+]Cc1cccc2ccoc21 ZINC001621053629 1170190976 /nfs/dbraw/zinc/19/09/76/1170190976.db2.gz BZGIZQZMDAHTRO-UHFFFAOYSA-N 1 2 243.266 2.414 20 0 BEADLO CC[C@@H]1CCN(C(=O)[C@H](C)Cc2c[nH]c[nH+]2)[C@H]1C ZINC001616974291 1170575316 /nfs/dbraw/zinc/57/53/16/1170575316.db2.gz LCWLXNQAAQNFNE-GRYCIOLGSA-N 1 2 249.358 2.235 20 0 BEADLO CC[C@@H]1CCN(C(=O)[C@H](C)Cc2c[nH+]c[nH]2)[C@H]1C ZINC001616974291 1170575319 /nfs/dbraw/zinc/57/53/19/1170575319.db2.gz LCWLXNQAAQNFNE-GRYCIOLGSA-N 1 2 249.358 2.235 20 0 BEADLO Cc1ccccc1[C@@H](CO)[NH2+]Cc1cscn1 ZINC001617153235 1170582157 /nfs/dbraw/zinc/58/21/57/1170582157.db2.gz ASXXXPOZAYYVCS-CYBMUJFWSA-N 1 2 248.351 2.275 20 0 BEADLO C[C@@H]([NH2+]Cc1cc[nH]n1)c1cc2cnccc2o1 ZINC001620528309 1170678319 /nfs/dbraw/zinc/67/83/19/1170678319.db2.gz HYAWWXFSIYKGFG-SECBINFHSA-N 1 2 242.282 2.402 20 0 BEADLO Cc1cc([C@@H]2CCCC[N@@H+]2CCF)[nH]n1 ZINC001620614780 1170688051 /nfs/dbraw/zinc/68/80/51/1170688051.db2.gz BYCMUNMFMHBJCX-NSHDSACASA-N 1 2 211.284 2.215 20 0 BEADLO Cc1cc([C@@H]2CCCC[N@H+]2CCF)[nH]n1 ZINC001620614780 1170688063 /nfs/dbraw/zinc/68/80/63/1170688063.db2.gz BYCMUNMFMHBJCX-NSHDSACASA-N 1 2 211.284 2.215 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)Nc1ccc(Cl)cc1 ZINC000030913468 1170875604 /nfs/dbraw/zinc/87/56/04/1170875604.db2.gz BVNKIUPLGRGSKK-UHFFFAOYSA-N 1 2 235.674 2.244 20 0 BEADLO COc1cc2[nH]c([C@H]3CCOC3)[nH+]c2cc1OC ZINC000042173533 1171210700 /nfs/dbraw/zinc/21/07/00/1171210700.db2.gz JUWAUABNZPBJCU-QMMMGPOBSA-N 1 2 248.282 2.084 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1ccc(C)cc1C ZINC001628533471 1171249769 /nfs/dbraw/zinc/24/97/69/1171249769.db2.gz QEGSWMOPFQUYID-ZDUSSCGKSA-N 1 2 232.327 2.336 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1ccc(C)cc1C ZINC001628533471 1171249772 /nfs/dbraw/zinc/24/97/72/1171249772.db2.gz QEGSWMOPFQUYID-ZDUSSCGKSA-N 1 2 232.327 2.336 20 0 BEADLO Cc1ccc(NC(=O)[C@@H](C)n2cc[nH+]c2)c(O)c1 ZINC000044982649 1171431691 /nfs/dbraw/zinc/43/16/91/1171431691.db2.gz YBOUMFZFVNQRQJ-SNVBAGLBSA-N 1 2 245.282 2.097 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1C[C@H](C)CC(C)(C)C1 ZINC001632651177 1171519125 /nfs/dbraw/zinc/51/91/25/1171519125.db2.gz MSDWFKGPBYLJGM-SNVBAGLBSA-N 1 2 249.358 2.155 20 0 BEADLO C[C@H](C(=O)N[C@@H](C)c1ccccc1)n1cc[nH+]c1 ZINC000049215267 1171683040 /nfs/dbraw/zinc/68/30/40/1171683040.db2.gz XCGSALJTLKMEAL-NWDGAFQWSA-N 1 2 243.310 2.322 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H]2CC23CCCC3)c[nH+]1 ZINC001635606201 1171744331 /nfs/dbraw/zinc/74/43/31/1171744331.db2.gz DXSAIMAFFNLFCJ-NSHDSACASA-N 1 2 247.342 2.169 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H]2CC23CCCC3)[nH+]1 ZINC001635606201 1171744340 /nfs/dbraw/zinc/74/43/40/1171744340.db2.gz DXSAIMAFFNLFCJ-NSHDSACASA-N 1 2 247.342 2.169 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)Nc1ccc2occc2c1 ZINC001635720615 1171757327 /nfs/dbraw/zinc/75/73/27/1171757327.db2.gz DOKAEMBAMCKPFJ-UHFFFAOYSA-N 1 2 241.250 2.337 20 0 BEADLO CCC1(C(=O)NCc2c[nH]c(C(C)C)[nH+]2)CC1 ZINC001636012362 1171783421 /nfs/dbraw/zinc/78/34/21/1171783421.db2.gz DJVRGSIQSMERGZ-UHFFFAOYSA-N 1 2 235.331 2.340 20 0 BEADLO CCC1(C(=O)NCc2c[nH+]c(C(C)C)[nH]2)CC1 ZINC001636012362 1171783430 /nfs/dbraw/zinc/78/34/30/1171783430.db2.gz DJVRGSIQSMERGZ-UHFFFAOYSA-N 1 2 235.331 2.340 20 0 BEADLO Cc1[nH]ccc1C(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001636017005 1171785407 /nfs/dbraw/zinc/78/54/07/1171785407.db2.gz VAIKXZXRMGUGIX-UHFFFAOYSA-N 1 2 246.314 2.100 20 0 BEADLO Cc1[nH]ccc1C(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001636017005 1171785413 /nfs/dbraw/zinc/78/54/13/1171785413.db2.gz VAIKXZXRMGUGIX-UHFFFAOYSA-N 1 2 246.314 2.100 20 0 BEADLO Cc1csc(C[NH2+]Cc2ccc(F)cn2)n1 ZINC000336729255 398135991 /nfs/dbraw/zinc/13/59/91/398135991.db2.gz HREIXNPOLUBZIY-UHFFFAOYSA-N 1 2 237.303 2.275 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[NH2+][C@@H]1C[C@H]1CC ZINC000378683976 346807242 /nfs/dbraw/zinc/80/72/42/346807242.db2.gz ZWIHJYOUZVVMLW-IJLUTSLNSA-N 1 2 227.348 2.352 20 0 BEADLO COCC(C)(C)[N@H+](C)Cc1noc(C(C)C)n1 ZINC000429239029 192025669 /nfs/dbraw/zinc/02/56/69/192025669.db2.gz SNQBNEZCPAYIDD-UHFFFAOYSA-N 1 2 241.335 2.050 20 0 BEADLO COCC(C)(C)[N@@H+](C)Cc1noc(C(C)C)n1 ZINC000429239029 192025671 /nfs/dbraw/zinc/02/56/71/192025671.db2.gz SNQBNEZCPAYIDD-UHFFFAOYSA-N 1 2 241.335 2.050 20 0 BEADLO CC(C)n1cc([C@@H](C)[NH2+]Cc2ncc[nH]2)cn1 ZINC000602285494 349491980 /nfs/dbraw/zinc/49/19/80/349491980.db2.gz BXMLCHOTGTUKDO-SNVBAGLBSA-N 1 2 233.319 2.038 20 0 BEADLO C[C@H](CC(=O)N[C@H](C)C1CCC1)n1cc[nH+]c1 ZINC000649865337 398145987 /nfs/dbraw/zinc/14/59/87/398145987.db2.gz UHOARQODSNWBKC-GHMZBOCLSA-N 1 2 235.331 2.139 20 0 BEADLO C[C@H]1CC[C@H](C)N1C(=O)CCCn1cc[nH+]c1 ZINC000161789892 538918671 /nfs/dbraw/zinc/91/86/71/538918671.db2.gz AKXNNVYQAUGPEA-RYUDHWBXSA-N 1 2 235.331 2.063 20 0 BEADLO C[C@H](N[C@@H]1C[C@@H](C)n2cc[nH+]c21)C(F)F ZINC000389922563 398149433 /nfs/dbraw/zinc/14/94/33/398149433.db2.gz SMGOEBVAINIDGO-GJMOJQLCSA-N 1 2 215.247 2.132 20 0 BEADLO Cc1cc(C[N@@H+]2CCn3cccc3[C@@H]2C)n(C)n1 ZINC000335153325 178005136 /nfs/dbraw/zinc/00/51/36/178005136.db2.gz HNMKXZIADPJFCA-LBPRGKRZSA-N 1 2 244.342 2.107 20 0 BEADLO Cc1cc(C[N@H+]2CCn3cccc3[C@@H]2C)n(C)n1 ZINC000335153325 178005138 /nfs/dbraw/zinc/00/51/38/178005138.db2.gz HNMKXZIADPJFCA-LBPRGKRZSA-N 1 2 244.342 2.107 20 0 BEADLO CC[C@H]1CCCC[C@@H]1NC(=O)CCn1cc[nH+]c1 ZINC000299694454 398152133 /nfs/dbraw/zinc/15/21/33/398152133.db2.gz XKJSRMMXDAEXHH-STQMWFEESA-N 1 2 249.358 2.358 20 0 BEADLO Cc1cc(CN2CCn3c[nH+]cc3C2)cs1 ZINC000296040265 178006446 /nfs/dbraw/zinc/00/64/46/178006446.db2.gz NWAFTDQRMJWKRR-UHFFFAOYSA-N 1 2 233.340 2.269 20 0 BEADLO Cc1cc(C[NH+]2Cc3ccccc3C2)on1 ZINC000171573805 178009239 /nfs/dbraw/zinc/00/92/39/178009239.db2.gz KIJCWONJLZEZPK-UHFFFAOYSA-N 1 2 214.268 2.499 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccn[nH]2)ccc1F ZINC000050545651 178024911 /nfs/dbraw/zinc/02/49/11/178024911.db2.gz QXJMQMFZADLUET-UHFFFAOYSA-N 1 2 219.263 2.147 20 0 BEADLO CC(C)c1nc(N2CC([C@@H]3CCOC3)C2)cc[nH+]1 ZINC000366493107 398168417 /nfs/dbraw/zinc/16/84/17/398168417.db2.gz NVFVNVOZEOWJJU-LLVKDONJSA-N 1 2 247.342 2.073 20 0 BEADLO Cc1cc(C[NH2+]Cc2nnc(C3CC3)[nH]2)cs1 ZINC000294870078 178028972 /nfs/dbraw/zinc/02/89/72/178028972.db2.gz UOTQGDLRKIIRBK-UHFFFAOYSA-N 1 2 248.355 2.342 20 0 BEADLO F[C@]1(c2ccccc2)C[C@H]1NCc1[nH]cc[nH+]1 ZINC000424204297 398174991 /nfs/dbraw/zinc/17/49/91/398174991.db2.gz VIGWXFKGHTUWLB-YPMHNXCESA-N 1 2 231.274 2.137 20 0 BEADLO F[C@]1(c2ccccc2)C[C@H]1[NH2+]Cc1ncc[nH]1 ZINC000424204297 398174992 /nfs/dbraw/zinc/17/49/92/398174992.db2.gz VIGWXFKGHTUWLB-YPMHNXCESA-N 1 2 231.274 2.137 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccc(C)cn2)nn1C ZINC000649901967 398175840 /nfs/dbraw/zinc/17/58/40/398175840.db2.gz PKQIXQGEPPWKPW-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccc(C)cn2)nn1C ZINC000649901967 398175842 /nfs/dbraw/zinc/17/58/42/398175842.db2.gz PKQIXQGEPPWKPW-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1nc(C[N@H+]2CCS[C@H](C)[C@@H]2C)co1 ZINC000647964530 398177818 /nfs/dbraw/zinc/17/78/18/398177818.db2.gz NKEFLABERFUGDM-DTWKUNHWSA-N 1 2 226.345 2.309 20 0 BEADLO Cc1nc(C[N@@H+]2CCS[C@H](C)[C@@H]2C)co1 ZINC000647964530 398177820 /nfs/dbraw/zinc/17/78/20/398177820.db2.gz NKEFLABERFUGDM-DTWKUNHWSA-N 1 2 226.345 2.309 20 0 BEADLO C[C@H](c1csnn1)[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000649907990 398182489 /nfs/dbraw/zinc/18/24/89/398182489.db2.gz DNBLWHIPKNEYJO-VXNVDRBHSA-N 1 2 245.298 2.330 20 0 BEADLO C[C@H](c1csnn1)[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000649907990 398182493 /nfs/dbraw/zinc/18/24/93/398182493.db2.gz DNBLWHIPKNEYJO-VXNVDRBHSA-N 1 2 245.298 2.330 20 0 BEADLO Cc1cc(Cl)nc(C[NH2+]Cc2cc[nH]n2)c1 ZINC000282125060 178072010 /nfs/dbraw/zinc/07/20/10/178072010.db2.gz VCNHMFPGDBFHTD-UHFFFAOYSA-N 1 2 236.706 2.056 20 0 BEADLO Cc1nc(C)c(C[NH2+][C@@H]2C[C@@H](C)n3ccnc32)o1 ZINC000385926204 398191538 /nfs/dbraw/zinc/19/15/38/398191538.db2.gz AXOGGUODIUZZQN-LDYMZIIASA-N 1 2 246.314 2.284 20 0 BEADLO Cc1cc(N(C)[C@@H]2CCC[C@H]2O)nc(C2CC2)[nH+]1 ZINC000286483043 178099993 /nfs/dbraw/zinc/09/99/93/178099993.db2.gz WTPUKVKBMGTGQX-VXGBXAGGSA-N 1 2 247.342 2.012 20 0 BEADLO Cc1cc(N(C)[C@H](C)C2(C)CC2)nc[nH+]1 ZINC000301537919 178101066 /nfs/dbraw/zinc/10/10/66/178101066.db2.gz BBCFIJRXOMSSTA-SNVBAGLBSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1cc(N)nc(SCCCOC(C)C)[nH+]1 ZINC000171505550 178109629 /nfs/dbraw/zinc/10/96/29/178109629.db2.gz CGYZJDHOIDPTFA-UHFFFAOYSA-N 1 2 241.360 2.274 20 0 BEADLO Cc1cc(N)nc(SC[C@@H]2CC[C@H](C)O2)[nH+]1 ZINC000188525257 178109953 /nfs/dbraw/zinc/10/99/53/178109953.db2.gz XLJYUMLFRAYKJM-IUCAKERBSA-N 1 2 239.344 2.027 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@@H+]1Cc1cccc(F)c1N ZINC000380586052 398201394 /nfs/dbraw/zinc/20/13/94/398201394.db2.gz QSBKJKVSVHDJFC-ZJUUUORDSA-N 1 2 238.306 2.017 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1cccc(F)c1N ZINC000380586052 398201396 /nfs/dbraw/zinc/20/13/96/398201396.db2.gz QSBKJKVSVHDJFC-ZJUUUORDSA-N 1 2 238.306 2.017 20 0 BEADLO Cc1cc(N2CC[C@H](C3CCOCC3)C2)nc[nH+]1 ZINC000339053935 178119574 /nfs/dbraw/zinc/11/95/74/178119574.db2.gz GLJWHJHUEKYAGK-ZDUSSCGKSA-N 1 2 247.342 2.038 20 0 BEADLO Cc1cc(N2CC[C@H](CO)[C@@H]2C)nc(C(C)C)[nH+]1 ZINC000362671597 178120085 /nfs/dbraw/zinc/12/00/85/178120085.db2.gz XUVWIAMKGZGKQK-NWDGAFQWSA-N 1 2 249.358 2.116 20 0 BEADLO Cc1cc(N2C[C@H](C)CC2(C)C)nc[nH+]1 ZINC000336415078 178121039 /nfs/dbraw/zinc/12/10/39/178121039.db2.gz HDPVZFHFOWSEFT-SECBINFHSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1cc(N2C[C@@H](F)[C@@H](F)C2)nc(C2CC2)[nH+]1 ZINC000295026818 178121951 /nfs/dbraw/zinc/12/19/51/178121951.db2.gz RGJAHSHOJFMTSC-AOOOYVTPSA-N 1 2 239.269 2.159 20 0 BEADLO Cc1cc(N2C[C@@H]3CCCC[C@@H]3C2)nc[nH+]1 ZINC000301547641 178122704 /nfs/dbraw/zinc/12/27/04/178122704.db2.gz LNLHODSUOWZCJD-TXEJJXNPSA-N 1 2 217.316 2.411 20 0 BEADLO Cc1cc(NC(=O)NCC2CCC2)cc[nH+]1 ZINC000179828812 178139738 /nfs/dbraw/zinc/13/97/38/178139738.db2.gz DLEOJJYRCZYCAB-UHFFFAOYSA-N 1 2 219.288 2.312 20 0 BEADLO C[C@@H]1CC[C@@H](CNC(=O)C(C)(C)c2c[nH]c[nH+]2)C1 ZINC000621987457 370645210 /nfs/dbraw/zinc/64/52/10/370645210.db2.gz WDJOPDRWIZRKOD-GHMZBOCLSA-N 1 2 249.358 2.240 20 0 BEADLO Cc1cc(NC(=O)N(C)C(C)C)cc[nH+]1 ZINC000119190072 178135409 /nfs/dbraw/zinc/13/54/09/178135409.db2.gz ZHOLFMUYJWFCTH-UHFFFAOYSA-N 1 2 207.277 2.262 20 0 BEADLO Cc1cc(NC(=O)NC2(C)CCC2)cc[nH+]1 ZINC000119850719 178136891 /nfs/dbraw/zinc/13/68/91/178136891.db2.gz HUFCZGIFDLMKSZ-UHFFFAOYSA-N 1 2 219.288 2.454 20 0 BEADLO Cc1cc(NC(=O)N2C[C@@H](C)O[C@@H](C)C2)cc[nH+]1 ZINC000119448431 178137803 /nfs/dbraw/zinc/13/78/03/178137803.db2.gz MYEIBKHAICZBGZ-PHIMTYICSA-N 1 2 249.314 2.031 20 0 BEADLO Cc1cc(NC(=O)N2CCOC(C)(C)C2)cc[nH+]1 ZINC000119425704 178138010 /nfs/dbraw/zinc/13/80/10/178138010.db2.gz JSDVCGBIPWLWBE-UHFFFAOYSA-N 1 2 249.314 2.033 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2CC2(C)C)cc[nH+]1 ZINC000270994628 178142604 /nfs/dbraw/zinc/14/26/04/178142604.db2.gz CJJYQFORKLGKQB-JTQLQIEISA-N 1 2 219.288 2.310 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CCO[C@H](C)C2)cc[nH+]1 ZINC000271837133 178145369 /nfs/dbraw/zinc/14/53/69/178145369.db2.gz AKHBDNTZRVQGOS-GHMZBOCLSA-N 1 2 234.299 2.144 20 0 BEADLO C[C@H](CC(=O)N(C)CC1CCCC1)n1cc[nH+]c1 ZINC000576349373 365573437 /nfs/dbraw/zinc/57/34/37/365573437.db2.gz HNKJWXJLKRQZJK-GFCCVEGCSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1cc(NC(=O)c2cc(F)ccc2N)cc[nH+]1 ZINC000082698014 178150702 /nfs/dbraw/zinc/15/07/02/178150702.db2.gz RIDBRRQIDOJDSK-UHFFFAOYSA-N 1 2 245.257 2.364 20 0 BEADLO Cc1cc(NC2CC2)nc(-c2ccncc2)[nH+]1 ZINC000057824920 178152580 /nfs/dbraw/zinc/15/25/80/178152580.db2.gz OYYGPPXBMAZIDP-UHFFFAOYSA-N 1 2 226.283 2.421 20 0 BEADLO Cc1nc(C(=O)Nc2cc[nH+]c(C)c2)c(C)o1 ZINC000293807244 178153647 /nfs/dbraw/zinc/15/36/47/178153647.db2.gz RIURFKCOHCJBBG-UHFFFAOYSA-N 1 2 231.255 2.247 20 0 BEADLO Cc1cc(NC[C@@H](C)CCO)nc(C(C)C)[nH+]1 ZINC000097442929 178165753 /nfs/dbraw/zinc/16/57/53/178165753.db2.gz YYKTXZSDRDMCID-JTQLQIEISA-N 1 2 237.347 2.339 20 0 BEADLO Cc1cc(NCC2(CO)CCC2)nc(C(C)C)[nH+]1 ZINC000302144512 178156464 /nfs/dbraw/zinc/15/64/64/178156464.db2.gz KIYWLZSWGRMERP-UHFFFAOYSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1cc(NC[C@@H](O)C(C)C)nc(C2CC2)[nH+]1 ZINC000172641611 178165799 /nfs/dbraw/zinc/16/57/99/178165799.db2.gz RKSXMUSDNHDOAA-LLVKDONJSA-N 1 2 235.331 2.091 20 0 BEADLO CSCCCSCc1[nH+]ccn1C ZINC000413014003 398211458 /nfs/dbraw/zinc/21/14/58/398211458.db2.gz ZBUYZVHDGVHJTL-UHFFFAOYSA-N 1 2 216.375 2.406 20 0 BEADLO Cc1cc(NCCC[C@H](C)CO)nc(C2CC2)[nH+]1 ZINC000270278247 178159984 /nfs/dbraw/zinc/15/99/84/178159984.db2.gz LMRPWBNULWZPSJ-JTQLQIEISA-N 1 2 249.358 2.483 20 0 BEADLO CCc1cc(N[C@H]2CC23CCOCC3)nc[nH+]1 ZINC000386971136 398224629 /nfs/dbraw/zinc/22/46/29/398224629.db2.gz BPEXNQWFBYCSCP-NSHDSACASA-N 1 2 233.315 2.020 20 0 BEADLO CCC(CC)CC(=O)Nc1ccc(N)[nH+]c1 ZINC000236633131 168346681 /nfs/dbraw/zinc/34/66/81/168346681.db2.gz LSYKHNXZVLLAEE-UHFFFAOYSA-N 1 2 221.304 2.429 20 0 BEADLO Cc1cc(NCc2c[nH+]c[nH]2)ccc1F ZINC000061116845 178171137 /nfs/dbraw/zinc/17/11/37/178171137.db2.gz MYVZHKRIXORJBJ-UHFFFAOYSA-N 1 2 205.236 2.469 20 0 BEADLO Cc1cc(NCc2c[nH]c[nH+]2)ccc1F ZINC000061116845 178171140 /nfs/dbraw/zinc/17/11/40/178171140.db2.gz MYVZHKRIXORJBJ-UHFFFAOYSA-N 1 2 205.236 2.469 20 0 BEADLO Cc1cc(C)c(CNc2cc(C)[nH+]cn2)c(=O)[nH]1 ZINC000301226855 178171419 /nfs/dbraw/zinc/17/14/19/178171419.db2.gz FFNYEWGOQWVELD-UHFFFAOYSA-N 1 2 244.298 2.115 20 0 BEADLO Cc1cc(N[C@H]2CCC(=O)N[C@@H]2C2CC2)nc[nH+]1 ZINC000329185945 178189160 /nfs/dbraw/zinc/18/91/60/178189160.db2.gz GHIJYIHFJYBMDN-GXFFZTMASA-N 1 2 246.314 2.094 20 0 BEADLO Cc1cc(NCc2cccnn2)nc(C2CC2)[nH+]1 ZINC000277503887 178175800 /nfs/dbraw/zinc/17/58/00/178175800.db2.gz BCDBMACEEBVPGL-UHFFFAOYSA-N 1 2 241.298 2.065 20 0 BEADLO Cc1cc(N[C@H]2CCC[C@@H]2OC(F)F)nc[nH+]1 ZINC000336907561 178188868 /nfs/dbraw/zinc/18/88/68/178188868.db2.gz FYQYFRVPDHDALM-IUCAKERBSA-N 1 2 243.257 2.357 20 0 BEADLO Cc1cc(N[C@H]2CCCOC2)nc(C(C)C)[nH+]1 ZINC000109548287 178188651 /nfs/dbraw/zinc/18/86/51/178188651.db2.gz CNGPLMVYAMAFEP-NSHDSACASA-N 1 2 235.331 2.499 20 0 BEADLO Cc1cc(N[C@@H]2CS[C@H](C)C2)nc[nH+]1 ZINC000307563379 178182226 /nfs/dbraw/zinc/18/22/26/178182226.db2.gz CCHDWUNPZVZLCJ-BDAKNGLRSA-N 1 2 209.318 2.091 20 0 BEADLO Cc1cc(N[C@@H]2COc3ccc(F)cc32)nc[nH+]1 ZINC000341669663 178182611 /nfs/dbraw/zinc/18/26/11/178182611.db2.gz VJRVJGLPJPMWFF-LLVKDONJSA-N 1 2 245.257 2.470 20 0 BEADLO Cc1cc(N[C@H](C)[C@@H](C)CO)nc(C2CC2)[nH+]1 ZINC000265813903 178185408 /nfs/dbraw/zinc/18/54/08/178185408.db2.gz GGDQXWAWOCRWST-WCBMZHEXSA-N 1 2 235.331 2.091 20 0 BEADLO Cc1cc(N[C@H](CO)C(C)C)nc(C2CC2)[nH+]1 ZINC000267332906 178187929 /nfs/dbraw/zinc/18/79/29/178187929.db2.gz CBOXQWCOAXMEHA-LLVKDONJSA-N 1 2 235.331 2.091 20 0 BEADLO c1[nH]cc(-c2ccc(O[C@H]3CCOC3)cc2)[nH+]1 ZINC000649427873 398229328 /nfs/dbraw/zinc/22/93/28/398229328.db2.gz ANBUPSJHPHJPLA-LBPRGKRZSA-N 1 2 230.267 2.244 20 0 BEADLO Cc1cc(N[C@H]2CSC2(C)C)nc[nH+]1 ZINC000306633510 178190759 /nfs/dbraw/zinc/19/07/59/178190759.db2.gz RQMSIQFSLDDABY-QMMMGPOBSA-N 1 2 209.318 2.091 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2cn(C)nc2C)no1 ZINC000337568781 178230731 /nfs/dbraw/zinc/23/07/31/178230731.db2.gz ZSVNOTKVGHSNFF-GXSJLCMTSA-N 1 2 248.330 2.437 20 0 BEADLO COCCOCc1cccc(-c2c[nH]c[nH+]2)c1 ZINC000649434112 398235483 /nfs/dbraw/zinc/23/54/83/398235483.db2.gz XIHOVXVEMTXZCV-UHFFFAOYSA-N 1 2 232.283 2.240 20 0 BEADLO c1[nH]cc(CCc2nc(C3CCCC3)no2)[nH+]1 ZINC000280722963 538937458 /nfs/dbraw/zinc/93/74/58/538937458.db2.gz CHHINLZMYHLPGT-UHFFFAOYSA-N 1 2 232.287 2.236 20 0 BEADLO c1[nH]c(CCc2nc(C3CCCC3)no2)c[nH+]1 ZINC000280722963 538937461 /nfs/dbraw/zinc/93/74/61/538937461.db2.gz CHHINLZMYHLPGT-UHFFFAOYSA-N 1 2 232.287 2.236 20 0 BEADLO CC(C)(C)[C@@H]1CCCN1C(=O)CCc1c[nH+]c[nH]1 ZINC000280650521 538937575 /nfs/dbraw/zinc/93/75/75/538937575.db2.gz ZHRHAFHLWNIOSQ-LBPRGKRZSA-N 1 2 249.358 2.379 20 0 BEADLO CC(C)(C)[C@@H]1CCCN1C(=O)CCc1c[nH]c[nH+]1 ZINC000280650521 538937576 /nfs/dbraw/zinc/93/75/76/538937576.db2.gz ZHRHAFHLWNIOSQ-LBPRGKRZSA-N 1 2 249.358 2.379 20 0 BEADLO Cc1cc([C@H](C)[NH2+]CC(F)(F)CO)cs1 ZINC000294212964 178245424 /nfs/dbraw/zinc/24/54/24/178245424.db2.gz MSIQJDLCWGOFLY-QMMMGPOBSA-N 1 2 235.299 2.335 20 0 BEADLO COC[C@@H](N[C@@H](C)c1[nH]cc[nH+]1)c1ccc(C)o1 ZINC000279104070 538935593 /nfs/dbraw/zinc/93/55/93/538935593.db2.gz VNOYMLQWWMHRLG-WDEREUQCSA-N 1 2 249.314 2.349 20 0 BEADLO CCC1(C)CCN(C(=O)CCc2c[nH+]c[nH]2)CC1 ZINC000279665331 538935899 /nfs/dbraw/zinc/93/58/99/538935899.db2.gz GXHVZDVKCMIVQV-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO CCC1(C)CCN(C(=O)CCc2c[nH]c[nH+]2)CC1 ZINC000279665331 538935900 /nfs/dbraw/zinc/93/59/00/538935900.db2.gz GXHVZDVKCMIVQV-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2ccn(C)n2)c(C)o1 ZINC000112344362 178251795 /nfs/dbraw/zinc/25/17/95/178251795.db2.gz AGQQSUUEIAJITC-JTQLQIEISA-N 1 2 233.315 2.481 20 0 BEADLO Cc1cc([C@H]2CCCN2Cc2c[nH+]c[nH]2)no1 ZINC000367229241 178265933 /nfs/dbraw/zinc/26/59/33/178265933.db2.gz PLRSKQCQFJQWQE-GFCCVEGCSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1cc([C@H]2CCCN2Cc2c[nH]c[nH+]2)no1 ZINC000367229241 178265934 /nfs/dbraw/zinc/26/59/34/178265934.db2.gz PLRSKQCQFJQWQE-GFCCVEGCSA-N 1 2 232.287 2.043 20 0 BEADLO CCc1cc(N[C@H]2CCS[C@@H]2C)nc[nH+]1 ZINC000379916092 398242590 /nfs/dbraw/zinc/24/25/90/398242590.db2.gz CGVLMKUKEFTYRM-SCZZXKLOSA-N 1 2 223.345 2.345 20 0 BEADLO CC(C)[C@H]1CCCN(C(=O)Cn2cc[nH+]c2)CC1 ZINC000073726736 343993597 /nfs/dbraw/zinc/99/35/97/343993597.db2.gz XHBNBTQSGYZUIG-ZDUSSCGKSA-N 1 2 249.358 2.168 20 0 BEADLO FC(F)(F)[C@H]1CCC[N@H+](Cc2ccon2)C1 ZINC000172647307 398240677 /nfs/dbraw/zinc/24/06/77/398240677.db2.gz RXVWPRKGJWSIBB-QMMMGPOBSA-N 1 2 234.221 2.449 20 0 BEADLO FC(F)(F)[C@H]1CCC[N@@H+](Cc2ccon2)C1 ZINC000172647307 398240681 /nfs/dbraw/zinc/24/06/81/398240681.db2.gz RXVWPRKGJWSIBB-QMMMGPOBSA-N 1 2 234.221 2.449 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCC[C@@H]1CCCCO1 ZINC000576648630 365650604 /nfs/dbraw/zinc/65/06/04/365650604.db2.gz RBGMWKWLFVVGBM-ZDUSSCGKSA-N 1 2 249.358 2.277 20 0 BEADLO C[C@@H](NC(=O)C[C@H]1CCC[C@H]1C)c1[nH]cc[nH+]1 ZINC000580901874 398250978 /nfs/dbraw/zinc/25/09/78/398250978.db2.gz DDGGURZPKHQMHP-GMTAPVOTSA-N 1 2 235.331 2.413 20 0 BEADLO COc1ccc(NCc2csc(C)c2)[nH+]c1 ZINC000381219392 398253196 /nfs/dbraw/zinc/25/31/96/398253196.db2.gz PZQKGEUMPDEJJT-UHFFFAOYSA-N 1 2 234.324 2.494 20 0 BEADLO CC(C)c1cc(C[NH2+][C@@H](C)c2cnccn2)on1 ZINC000169241424 538946788 /nfs/dbraw/zinc/94/67/88/538946788.db2.gz BKZZOHHCGHGIFE-JTQLQIEISA-N 1 2 246.314 2.439 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](Cc1ccn(C)n1)C2 ZINC000334538728 136230816 /nfs/dbraw/zinc/23/08/16/136230816.db2.gz JYUCGOMDSLWLQP-UHFFFAOYSA-N 1 2 227.311 2.244 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](Cc1ccn(C)n1)C2 ZINC000334538728 136230817 /nfs/dbraw/zinc/23/08/17/136230817.db2.gz JYUCGOMDSLWLQP-UHFFFAOYSA-N 1 2 227.311 2.244 20 0 BEADLO Cc1cccc(CCNc2nccnc2C)[nH+]1 ZINC000290933001 538947053 /nfs/dbraw/zinc/94/70/53/538947053.db2.gz KEJHHJMWKQLBCS-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO CCc1cc(NC[C@@H]2CCCC2(F)F)nc[nH+]1 ZINC000390964588 398260708 /nfs/dbraw/zinc/26/07/08/398260708.db2.gz OGNBQJMXCGVDKP-VIFPVBQESA-N 1 2 241.285 2.308 20 0 BEADLO CC(C)c1[nH]ccc1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000576766961 365680521 /nfs/dbraw/zinc/68/05/21/365680521.db2.gz COOBEVNJTOOJPI-SECBINFHSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1ccc(NC(=O)[C@@]2(C)C[C@@H]2F)c(C)[nH+]1 ZINC000335088372 136232950 /nfs/dbraw/zinc/23/29/50/136232950.db2.gz XSHGITGNLQRNKG-JQWIXIFHSA-N 1 2 222.263 2.385 20 0 BEADLO CC[C@@H]([NH2+]CC(C)(F)F)c1cnn(C)c1 ZINC000378778663 346830640 /nfs/dbraw/zinc/83/06/40/346830640.db2.gz GINWUNWKYMYWTP-SECBINFHSA-N 1 2 217.263 2.116 20 0 BEADLO CCc1nn(C)cc1C[N@H+](C)Cc1ccco1 ZINC000179582293 538955413 /nfs/dbraw/zinc/95/54/13/538955413.db2.gz UOCIQMWVIMIYMW-UHFFFAOYSA-N 1 2 233.315 2.208 20 0 BEADLO CCc1nn(C)cc1C[N@@H+](C)Cc1ccco1 ZINC000179582293 538955415 /nfs/dbraw/zinc/95/54/15/538955415.db2.gz UOCIQMWVIMIYMW-UHFFFAOYSA-N 1 2 233.315 2.208 20 0 BEADLO CCc1cc(N[C@@H]2C[C@@H](C)n3cc[nH+]c32)ncn1 ZINC000649471107 398271684 /nfs/dbraw/zinc/27/16/84/398271684.db2.gz NNIPWZLBNIFTEI-MWLCHTKSSA-N 1 2 243.314 2.353 20 0 BEADLO Cc1ccc(C(=O)N[C@@H](C)Cn2cc[nH+]c2)cc1 ZINC000042511624 178421224 /nfs/dbraw/zinc/42/12/24/178421224.db2.gz LIZRITPHAANGIV-LBPRGKRZSA-N 1 2 243.310 2.010 20 0 BEADLO CCC(CC)NC(=O)Cc1cn2ccccc2[nH+]1 ZINC000068372665 168378691 /nfs/dbraw/zinc/37/86/91/168378691.db2.gz VRZILVSNAYFRCX-UHFFFAOYSA-N 1 2 245.326 2.182 20 0 BEADLO Cc1ccc(NC(=O)c2cccnc2)c(C)[nH+]1 ZINC000176196289 365686753 /nfs/dbraw/zinc/68/67/53/365686753.db2.gz QMSPDXIOOUMOAR-UHFFFAOYSA-N 1 2 227.267 2.346 20 0 BEADLO O[C@@H]1CC[C@H]1Nc1[nH+]ccc2ccc(F)cc21 ZINC000335603416 136235542 /nfs/dbraw/zinc/23/55/42/136235542.db2.gz IFLKNIRTSLQITD-VXGBXAGGSA-N 1 2 232.258 2.309 20 0 BEADLO Cn1nccc1Cn1c[nH+]c2cc(F)c(F)cc21 ZINC000181876706 538961402 /nfs/dbraw/zinc/96/14/02/538961402.db2.gz MOTPJDNJFSMJRD-UHFFFAOYSA-N 1 2 248.236 2.096 20 0 BEADLO FC(F)c1noc(C[N@@H+]2CCC3(CCC3)C2)n1 ZINC000335606103 136236190 /nfs/dbraw/zinc/23/61/90/136236190.db2.gz VNECKSXHAZDZIM-UHFFFAOYSA-N 1 2 243.257 2.383 20 0 BEADLO FC(F)c1noc(C[N@H+]2CCC3(CCC3)C2)n1 ZINC000335606103 136236191 /nfs/dbraw/zinc/23/61/91/136236191.db2.gz VNECKSXHAZDZIM-UHFFFAOYSA-N 1 2 243.257 2.383 20 0 BEADLO CCOc1ccccc1C[NH2+]Cc1ccno1 ZINC000231881882 342742895 /nfs/dbraw/zinc/74/28/95/342742895.db2.gz WZFCTANDRRRPJL-UHFFFAOYSA-N 1 2 232.283 2.363 20 0 BEADLO O=C(CCCn1cc[nH+]c1)NCC1=CCCCC1 ZINC000650517842 398279472 /nfs/dbraw/zinc/27/94/72/398279472.db2.gz NOCNJJVKUBUHSP-UHFFFAOYSA-N 1 2 247.342 2.280 20 0 BEADLO COC(=O)[C@@H](CC(C)C)[NH2+]Cc1ccccc1 ZINC000034751643 342731722 /nfs/dbraw/zinc/73/17/22/342731722.db2.gz LITWZVHRFAQHQA-CYBMUJFWSA-N 1 2 235.327 2.364 20 0 BEADLO CCC[C@@H](C)NC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000649488486 398283785 /nfs/dbraw/zinc/28/37/85/398283785.db2.gz PEYNSWRRCJDWSD-MNOVXSKESA-N 1 2 223.320 2.139 20 0 BEADLO CCC(CC)NC(=O)c1ccc2[nH+]ccn2c1 ZINC000075464904 168386167 /nfs/dbraw/zinc/38/61/67/168386167.db2.gz VWNXZUMQZREUTP-UHFFFAOYSA-N 1 2 231.299 2.253 20 0 BEADLO OCC(F)(F)C[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000184698553 538969420 /nfs/dbraw/zinc/96/94/20/538969420.db2.gz SRRXDXADRKQNCM-LLVKDONJSA-N 1 2 245.244 2.030 20 0 BEADLO CCCC(=O)NCc1ccc(N2CCCC2)[nH+]c1 ZINC000045076133 342790601 /nfs/dbraw/zinc/79/06/01/342790601.db2.gz QATWMTSELAUXPT-UHFFFAOYSA-N 1 2 247.342 2.098 20 0 BEADLO Cc1cnc([C@H](C)[NH2+][C@@H]2CCCn3nccc32)o1 ZINC000634581948 342797678 /nfs/dbraw/zinc/79/76/78/342797678.db2.gz HVMAQJYECRFCGS-WDEREUQCSA-N 1 2 246.314 2.365 20 0 BEADLO COc1ccc(-c2c[nH+]c3n2CCCC3)cn1 ZINC000630049904 361912648 /nfs/dbraw/zinc/91/26/48/361912648.db2.gz JXTMQIMGMNVRCP-UHFFFAOYSA-N 1 2 229.283 2.290 20 0 BEADLO CC1(C)C[N@H+](Cc2ccon2)[C@@H]2CCC[C@H]2O1 ZINC000336591357 342813054 /nfs/dbraw/zinc/81/30/54/342813054.db2.gz ZNXXVKMODCAYSG-VXGBXAGGSA-N 1 2 236.315 2.207 20 0 BEADLO CC1(C)C[N@@H+](Cc2ccon2)[C@@H]2CCC[C@H]2O1 ZINC000336591357 342813055 /nfs/dbraw/zinc/81/30/55/342813055.db2.gz ZNXXVKMODCAYSG-VXGBXAGGSA-N 1 2 236.315 2.207 20 0 BEADLO c1ccc(N[C@H]2CO[C@H](C3CC3)C2)[nH+]c1 ZINC000624672326 342816431 /nfs/dbraw/zinc/81/64/31/342816431.db2.gz ISGMSUYCRQYALN-MNOVXSKESA-N 1 2 204.273 2.061 20 0 BEADLO C[NH+](C)Cc1nc(C2C(C)(C)C2(C)C)no1 ZINC000624745553 342824035 /nfs/dbraw/zinc/82/40/35/342824035.db2.gz MAILHQPENYAPHD-UHFFFAOYSA-N 1 2 223.320 2.281 20 0 BEADLO Cc1nc(NC[C@@H]2CCCC23CC3)cc[nH+]1 ZINC000624758131 342825827 /nfs/dbraw/zinc/82/58/27/342825827.db2.gz UVSUVQXYFPHNFL-NSHDSACASA-N 1 2 217.316 2.199 20 0 BEADLO C[N@H+](Cc1ccoc1)Cc1cc2n(n1)CCCC2 ZINC000649494466 398289677 /nfs/dbraw/zinc/28/96/77/398289677.db2.gz PLRZVUAJZBVVDP-UHFFFAOYSA-N 1 2 245.326 2.444 20 0 BEADLO C[N@@H+](Cc1ccoc1)Cc1cc2n(n1)CCCC2 ZINC000649494466 398289680 /nfs/dbraw/zinc/28/96/80/398289680.db2.gz PLRZVUAJZBVVDP-UHFFFAOYSA-N 1 2 245.326 2.444 20 0 BEADLO C[N@H+](CC(F)F)CC1(O)CCCCCC1 ZINC000187342508 538975882 /nfs/dbraw/zinc/97/58/82/538975882.db2.gz BZEMQETZSDDRKK-UHFFFAOYSA-N 1 2 221.291 2.269 20 0 BEADLO C[N@@H+](CC(F)F)CC1(O)CCCCCC1 ZINC000187342508 538975884 /nfs/dbraw/zinc/97/58/84/538975884.db2.gz BZEMQETZSDDRKK-UHFFFAOYSA-N 1 2 221.291 2.269 20 0 BEADLO Cc1ncc([C@@H](C)[NH2+]Cc2cocn2)s1 ZINC000380253288 538987814 /nfs/dbraw/zinc/98/78/14/538987814.db2.gz PRQBUIHJAWDKID-SSDOTTSWSA-N 1 2 223.301 2.290 20 0 BEADLO Fc1c[nH+]ccc1NCC1(C(F)F)CC1 ZINC000380348037 538989431 /nfs/dbraw/zinc/98/94/31/538989431.db2.gz UNQNZTFAVNKKOJ-UHFFFAOYSA-N 1 2 216.206 2.100 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)CCc2c[nH+]c[nH]2)C1 ZINC000189058905 538980506 /nfs/dbraw/zinc/98/05/06/538980506.db2.gz VGYZFKXWLOVFFL-MNOVXSKESA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)CCc2c[nH]c[nH+]2)C1 ZINC000189058905 538980507 /nfs/dbraw/zinc/98/05/07/538980507.db2.gz VGYZFKXWLOVFFL-MNOVXSKESA-N 1 2 235.331 2.037 20 0 BEADLO CCC(CC)[C@@H](C)C(=O)NCCn1cc[nH+]c1 ZINC000341718260 168397795 /nfs/dbraw/zinc/39/77/95/168397795.db2.gz XSMZZTHMRQYRQW-LLVKDONJSA-N 1 2 237.347 2.072 20 0 BEADLO C[C@@H](NC(=O)CCc1c[nH+]c[nH]1)C1CCCCC1 ZINC000193338729 539004870 /nfs/dbraw/zinc/00/48/70/539004870.db2.gz UXVKTAHAMVGVFH-LLVKDONJSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@@H](NC(=O)CCc1c[nH]c[nH+]1)C1CCCCC1 ZINC000193338729 539004871 /nfs/dbraw/zinc/00/48/71/539004871.db2.gz UXVKTAHAMVGVFH-LLVKDONJSA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@@]1(C)CCCN(C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000193386904 539005285 /nfs/dbraw/zinc/00/52/85/539005285.db2.gz YMRMBWNAAJTKSI-AWEZNQCLSA-N 1 2 249.358 2.381 20 0 BEADLO CC[C@@]1(C)CCCN(C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000193386904 539005287 /nfs/dbraw/zinc/00/52/87/539005287.db2.gz YMRMBWNAAJTKSI-AWEZNQCLSA-N 1 2 249.358 2.381 20 0 BEADLO C[C@@H]1CC[C@@H](NC(=O)CCc2c[nH+]c[nH]2)C[C@@H]1C ZINC000193809928 539007547 /nfs/dbraw/zinc/00/75/47/539007547.db2.gz SKAXGMBKNFXYEQ-GRYCIOLGSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CC[C@@H](NC(=O)CCc2c[nH]c[nH+]2)C[C@@H]1C ZINC000193809928 539007548 /nfs/dbraw/zinc/00/75/48/539007548.db2.gz SKAXGMBKNFXYEQ-GRYCIOLGSA-N 1 2 249.358 2.283 20 0 BEADLO CCc1cc(NC(=O)Nc2cc[nH+]cc2C)n[nH]1 ZINC000192288740 538994774 /nfs/dbraw/zinc/99/47/74/538994774.db2.gz DNHNOFGBWLREGS-UHFFFAOYSA-N 1 2 245.286 2.320 20 0 BEADLO Cc1ccc(O)c(C[NH2+]C(C)(C)C(F)F)n1 ZINC000381388388 538999762 /nfs/dbraw/zinc/99/97/62/538999762.db2.gz NIZFJWHYUTTXEX-UHFFFAOYSA-N 1 2 230.258 2.229 20 0 BEADLO CC(C)[C@H](NC(=O)CCC(F)F)c1[nH]cc[nH+]1 ZINC000640730840 361964272 /nfs/dbraw/zinc/96/42/72/361964272.db2.gz WSYANADKRNPXIM-JTQLQIEISA-N 1 2 245.273 2.268 20 0 BEADLO CC[C@@H](C)NC(=O)[C@@H](C)[N@H+](C)Cc1ccco1 ZINC000042334347 361980790 /nfs/dbraw/zinc/98/07/90/361980790.db2.gz LZBADLYMKNYQRR-GHMZBOCLSA-N 1 2 238.331 2.015 20 0 BEADLO CC[C@@H](C)NC(=O)[C@@H](C)[N@@H+](C)Cc1ccco1 ZINC000042334347 361980794 /nfs/dbraw/zinc/98/07/94/361980794.db2.gz LZBADLYMKNYQRR-GHMZBOCLSA-N 1 2 238.331 2.015 20 0 BEADLO C[C@@H](N[C@@H]1CCCC1(F)F)c1[nH+]ccn1C ZINC000390645506 539026619 /nfs/dbraw/zinc/02/66/19/539026619.db2.gz NTMABPJNYTZTER-RKDXNWHRSA-N 1 2 229.274 2.259 20 0 BEADLO C=Cn1cc(C[NH2+][C@@H]2CCCC2(F)F)cn1 ZINC000390816397 539027527 /nfs/dbraw/zinc/02/75/27/539027527.db2.gz LOYNJXSUUIWWFZ-SNVBAGLBSA-N 1 2 227.258 2.261 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2ccc(C)cn2)s1 ZINC000391869992 539027705 /nfs/dbraw/zinc/02/77/05/539027705.db2.gz YMXNBKBHEHYFAL-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccc(O)cc2)s1 ZINC000391939440 539027741 /nfs/dbraw/zinc/02/77/41/539027741.db2.gz MZAJAAVZDDTNGM-MRVPVSSYSA-N 1 2 249.339 2.403 20 0 BEADLO C[C@@H]1[C@H](O)CCN1c1[nH+]ccc2ccc(F)cc21 ZINC000649502222 398297529 /nfs/dbraw/zinc/29/75/29/398297529.db2.gz UBNGHGQZKUXMAH-NOZJJQNGSA-N 1 2 246.285 2.333 20 0 BEADLO COc1ccc(N[C@@H](C)[C@H]2CCCOC2)[nH+]c1 ZINC000389101823 539015437 /nfs/dbraw/zinc/01/54/37/539015437.db2.gz LIDULUPBPNLAOB-QWRGUYRKSA-N 1 2 236.315 2.317 20 0 BEADLO CC[C@@H](C)N(C)C(=O)[C@@H]1CCn2cc(C)[nH+]c2C1 ZINC000624983751 342840510 /nfs/dbraw/zinc/84/05/10/342840510.db2.gz UKHBGQLNVOVDSW-VXGBXAGGSA-N 1 2 249.358 2.011 20 0 BEADLO C[C@@H]1CCC[C@H](C)N1C(=O)CCCn1cc[nH+]c1 ZINC000073320927 342846006 /nfs/dbraw/zinc/84/60/06/342846006.db2.gz PDSTULSZSAUJNQ-BETUJISGSA-N 1 2 249.358 2.453 20 0 BEADLO CCc1cc(NCc2ccc(O)cc2)nc[nH+]1 ZINC000134587573 342871216 /nfs/dbraw/zinc/87/12/16/342871216.db2.gz ONDRFPBZVKLLDZ-UHFFFAOYSA-N 1 2 229.283 2.357 20 0 BEADLO Cc1cnc([C@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)o1 ZINC000348896437 136243600 /nfs/dbraw/zinc/24/36/00/136243600.db2.gz VDBIECJXDMKQBJ-AXFHLTTASA-N 1 2 224.304 2.153 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)o1 ZINC000348896437 136243601 /nfs/dbraw/zinc/24/36/01/136243601.db2.gz VDBIECJXDMKQBJ-AXFHLTTASA-N 1 2 224.304 2.153 20 0 BEADLO FC[C@H]1C[N@H+](Cc2ccc(Cl)o2)CCCO1 ZINC000335644887 136243623 /nfs/dbraw/zinc/24/36/23/136243623.db2.gz XGCQTNZOEBJJTC-JTQLQIEISA-N 1 2 247.697 2.493 20 0 BEADLO FC[C@H]1C[N@@H+](Cc2ccc(Cl)o2)CCCO1 ZINC000335644887 136243624 /nfs/dbraw/zinc/24/36/24/136243624.db2.gz XGCQTNZOEBJJTC-JTQLQIEISA-N 1 2 247.697 2.493 20 0 BEADLO CCC[N@H+](C)CC(=O)c1ccccc1F ZINC000037335573 398316078 /nfs/dbraw/zinc/31/60/78/398316078.db2.gz XNDXZJVQQFGPLQ-UHFFFAOYSA-N 1 2 209.264 2.350 20 0 BEADLO CCC[N@@H+](C)CC(=O)c1ccccc1F ZINC000037335573 398316080 /nfs/dbraw/zinc/31/60/80/398316080.db2.gz XNDXZJVQQFGPLQ-UHFFFAOYSA-N 1 2 209.264 2.350 20 0 BEADLO CN(Cc1[nH+]ccn1C)c1nc(Cl)cs1 ZINC000165181635 342880597 /nfs/dbraw/zinc/88/05/97/342880597.db2.gz VCCVUAFYAWWEAY-UHFFFAOYSA-N 1 2 242.735 2.166 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC23CCC3)n1C1CC1 ZINC000336474603 398319359 /nfs/dbraw/zinc/31/93/59/398319359.db2.gz PLOHNAVRZZSVBK-UHFFFAOYSA-N 1 2 232.331 2.050 20 0 BEADLO Cc1nnc(C[N@H+]2CCC23CCC3)n1C1CC1 ZINC000336474603 398319361 /nfs/dbraw/zinc/31/93/61/398319361.db2.gz PLOHNAVRZZSVBK-UHFFFAOYSA-N 1 2 232.331 2.050 20 0 BEADLO COC(=O)[C@@H]([NH2+]CC(C)C)c1cccs1 ZINC000041672545 398320886 /nfs/dbraw/zinc/32/08/86/398320886.db2.gz KTOHLLLAOCVVSU-JTQLQIEISA-N 1 2 227.329 2.208 20 0 BEADLO CC[C@H](C)C[NH2+]Cc1[nH]ncc1Br ZINC000388664813 342884875 /nfs/dbraw/zinc/88/48/75/342884875.db2.gz WKARUNUAWINOPN-ZETCQYMHSA-N 1 2 246.152 2.308 20 0 BEADLO C[C@H]([NH2+]Cc1ccon1)c1ccc2c(c1)OCO2 ZINC000148653277 398313588 /nfs/dbraw/zinc/31/35/88/398313588.db2.gz RNSNBFFDEYBXRP-VIFPVBQESA-N 1 2 246.266 2.254 20 0 BEADLO CCc1[nH+]c(C)ccc1OCCC[C@@H](C)O ZINC000309738969 398322322 /nfs/dbraw/zinc/32/23/22/398322322.db2.gz HGMWHSOFIJMJOV-LLVKDONJSA-N 1 2 223.316 2.492 20 0 BEADLO CCCCc1cc(N[C@@H]2CCCOC2)nc[nH+]1 ZINC000631109299 342911227 /nfs/dbraw/zinc/91/12/27/342911227.db2.gz PLLJZTZBNRLUMO-GFCCVEGCSA-N 1 2 235.331 2.410 20 0 BEADLO CC[C@H]([NH2+]CCc1ccc(C)cc1C)C(=O)OC ZINC000192841033 398323977 /nfs/dbraw/zinc/32/39/77/398323977.db2.gz INSJFRAGCUJFNA-AWEZNQCLSA-N 1 2 249.354 2.387 20 0 BEADLO c1cc(C[NH2+][C@@H](c2cccnc2)C2CC2)no1 ZINC000351599399 136247395 /nfs/dbraw/zinc/24/73/95/136247395.db2.gz XTLZRGWZVZELQY-CYBMUJFWSA-N 1 2 229.283 2.311 20 0 BEADLO Cc1ccc(C(C)(C)[NH2+]Cc2ccon2)cn1 ZINC000351599168 136247571 /nfs/dbraw/zinc/24/75/71/136247571.db2.gz CMFOXCAWSPDMJH-UHFFFAOYSA-N 1 2 231.299 2.403 20 0 BEADLO COC(=O)C(C)(C)[NH2+]Cc1sccc1C ZINC000037085309 342918233 /nfs/dbraw/zinc/91/82/33/342918233.db2.gz YVKZAUNKZRUEJS-UHFFFAOYSA-N 1 2 227.329 2.098 20 0 BEADLO COC(=O)[C@H](C)[NH2+]C[C@@]1(C)C[C@@H]1c1ccccc1 ZINC000602633849 349649693 /nfs/dbraw/zinc/64/96/93/349649693.db2.gz IURWDFZLHXOIKL-NJZAAPMLSA-N 1 2 247.338 2.331 20 0 BEADLO CC[C@@H]1C[C@H](C)CN1C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493189659 529437129 /nfs/dbraw/zinc/43/71/29/529437129.db2.gz NRZMSTOCIBKITC-BXXZLRJFSA-N 1 2 233.315 2.070 20 0 BEADLO Cc1noc(C[N@@H+](C)Cc2ccc(F)cc2C)n1 ZINC000351651769 136249250 /nfs/dbraw/zinc/24/92/50/136249250.db2.gz RJJUQWKWCNFXIG-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO Cc1noc(C[N@H+](C)Cc2ccc(F)cc2C)n1 ZINC000351651769 136249251 /nfs/dbraw/zinc/24/92/51/136249251.db2.gz RJJUQWKWCNFXIG-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO CC[C@@H](NC(=O)C1CC(C)(C)C1)c1[nH]cc[nH+]1 ZINC000354774302 398330149 /nfs/dbraw/zinc/33/01/49/398330149.db2.gz VCXBHVPZJSAXIZ-SNVBAGLBSA-N 1 2 235.331 2.413 20 0 BEADLO CCn1c[nH+]cc1CNc1cnoc1C1CC1 ZINC000561199947 398338180 /nfs/dbraw/zinc/33/81/80/398338180.db2.gz WIZTWHUXDUXVMY-UHFFFAOYSA-N 1 2 232.287 2.381 20 0 BEADLO CC[C@H](NC(=O)/C=C/c1[nH]cc[nH+]1)C(C)(C)C ZINC000493813303 529457058 /nfs/dbraw/zinc/45/70/58/529457058.db2.gz CRFZBGJBXIPYNT-FGEFZZPRSA-N 1 2 235.331 2.364 20 0 BEADLO c1cc2c(nc(C3CC3)[nH+]c2NC2CCC2)[nH]1 ZINC000631109413 342938908 /nfs/dbraw/zinc/93/89/08/342938908.db2.gz ANANQZHRWPVKBB-UHFFFAOYSA-N 1 2 228.299 2.222 20 0 BEADLO O=c1[nH]c2ccccc2cc1C[NH2+]CC(F)F ZINC000136578556 398342758 /nfs/dbraw/zinc/34/27/58/398342758.db2.gz WCWMBLMXDMRHTL-UHFFFAOYSA-N 1 2 238.237 2.295 20 0 BEADLO O=C(CCC1CC1)NCCCNc1cccc[nH+]1 ZINC000136197909 398344447 /nfs/dbraw/zinc/34/44/47/398344447.db2.gz IKFIJKVRESGWTR-UHFFFAOYSA-N 1 2 247.342 2.190 20 0 BEADLO CCc1cnc(C[N@H+](C)C[C@@H]2CCCO2)s1 ZINC000175522082 346897721 /nfs/dbraw/zinc/89/77/21/346897721.db2.gz WVBDILAQFDAFKH-JTQLQIEISA-N 1 2 240.372 2.316 20 0 BEADLO CCc1cnc(C[N@@H+](C)C[C@@H]2CCCO2)s1 ZINC000175522082 346897725 /nfs/dbraw/zinc/89/77/25/346897725.db2.gz WVBDILAQFDAFKH-JTQLQIEISA-N 1 2 240.372 2.316 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)NC1(C(C)C)CC1 ZINC000493205813 529552681 /nfs/dbraw/zinc/55/26/81/529552681.db2.gz LIYQAXXVMQTUQE-AATRIKPKSA-N 1 2 247.342 2.221 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N1CCCC1(C)C ZINC000492684512 529556955 /nfs/dbraw/zinc/55/69/55/529556955.db2.gz VBFYKACVOXITMQ-SREVYHEPSA-N 1 2 247.342 2.317 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)NCCC1(C)CC1 ZINC000492706601 529558450 /nfs/dbraw/zinc/55/84/50/529558450.db2.gz NOOMQNUCLOZVKW-PLNGDYQASA-N 1 2 247.342 2.223 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)NCC(C)(C)CC ZINC000493248269 529558968 /nfs/dbraw/zinc/55/89/68/529558968.db2.gz AZHGVGHUEVIGJL-FPLPWBNLSA-N 1 2 249.358 2.469 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N(C(C)C)C1CC1 ZINC000492450121 529549614 /nfs/dbraw/zinc/54/96/14/529549614.db2.gz QAIGHPLHJVPNAP-BQYQJAHWSA-N 1 2 247.342 2.316 20 0 BEADLO CCN(C#N)CC[N@H+](Cc1ccc(C)o1)C1CC1 ZINC000602768147 349723445 /nfs/dbraw/zinc/72/34/45/349723445.db2.gz WLPJWAYEJJQRNU-UHFFFAOYSA-N 1 2 247.342 2.355 20 0 BEADLO CCN(C#N)CC[N@@H+](Cc1ccc(C)o1)C1CC1 ZINC000602768147 349723446 /nfs/dbraw/zinc/72/34/46/349723446.db2.gz WLPJWAYEJJQRNU-UHFFFAOYSA-N 1 2 247.342 2.355 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCCC[C@H]1CC(=O)OC ZINC000602772068 349726058 /nfs/dbraw/zinc/72/60/58/349726058.db2.gz NXXXBXRJASJOKV-JTQLQIEISA-N 1 2 249.301 2.449 20 0 BEADLO CCC(F)(F)C[N@H+]1CCCC[C@H]1CC(=O)OC ZINC000602772068 349726060 /nfs/dbraw/zinc/72/60/60/349726060.db2.gz NXXXBXRJASJOKV-JTQLQIEISA-N 1 2 249.301 2.449 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)/C=C\C1CC1 ZINC000493066663 529587701 /nfs/dbraw/zinc/58/77/01/529587701.db2.gz UFPUJBOBOZIEGT-JYESYGNLSA-N 1 2 233.315 2.046 20 0 BEADLO C[C@H]1C[NH+](Cc2nccn2C)C[C@H](C)C1(F)F ZINC000625650848 344023775 /nfs/dbraw/zinc/02/37/75/344023775.db2.gz SFPGQQJDFUFGPM-UWVGGRQHSA-N 1 2 243.301 2.143 20 0 BEADLO CCn1ccnc1CNc1cc[nH+]cc1F ZINC000309453771 259343398 /nfs/dbraw/zinc/34/33/98/259343398.db2.gz LVIAQILORYYKIG-UHFFFAOYSA-N 1 2 220.251 2.049 20 0 BEADLO CC1(C)[C@H](O)CC[N@@H+]1Cc1ncc(Cl)s1 ZINC000336626929 136264466 /nfs/dbraw/zinc/26/44/66/136264466.db2.gz HRWAOUQNYJHEJT-SSDOTTSWSA-N 1 2 246.763 2.142 20 0 BEADLO CC1(C)[C@H](O)CC[N@H+]1Cc1ncc(Cl)s1 ZINC000336626929 136264467 /nfs/dbraw/zinc/26/44/67/136264467.db2.gz HRWAOUQNYJHEJT-SSDOTTSWSA-N 1 2 246.763 2.142 20 0 BEADLO Cc1[nH]ncc1C[NH2+]CC(C)(C)C(F)(F)F ZINC000309887124 343083183 /nfs/dbraw/zinc/08/31/83/343083183.db2.gz YXRBWTKHMVDYPK-UHFFFAOYSA-N 1 2 235.253 2.396 20 0 BEADLO Cn1c2ccc(Cl)cc2nc1Cn1cc[nH+]c1 ZINC000049236436 343096837 /nfs/dbraw/zinc/09/68/37/343096837.db2.gz QOUNHARHPJTMOI-UHFFFAOYSA-N 1 2 246.701 2.472 20 0 BEADLO COc1cc(F)cc(OC)c1C[NH2+][C@@H](C)CF ZINC000631136862 343099670 /nfs/dbraw/zinc/09/96/70/343099670.db2.gz RGIGKJFSDNRNAZ-QMMMGPOBSA-N 1 2 245.269 2.291 20 0 BEADLO CC[C@H](C)[C@@H](O)CNc1cc[nH+]c(C(C)C)n1 ZINC000112334465 343129151 /nfs/dbraw/zinc/12/91/51/343129151.db2.gz OZSRTNHWTYSYRU-QWRGUYRKSA-N 1 2 237.347 2.419 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCC(C)CC1 ZINC000576911167 365720099 /nfs/dbraw/zinc/72/00/99/365720099.db2.gz IWWVAJSYGZVXIW-UHFFFAOYSA-N 1 2 205.305 2.330 20 0 BEADLO Cc1cc(CNC(=O)[C@@H]2CC2(C)C)cc(C)[nH+]1 ZINC000421579318 192355454 /nfs/dbraw/zinc/35/54/54/192355454.db2.gz UFAHCKWZMWJXIF-LBPRGKRZSA-N 1 2 232.327 2.361 20 0 BEADLO CC[C@H]([NH2+][C@H]1CCSC1)C(=O)OC(C)(C)C ZINC000310015497 343179145 /nfs/dbraw/zinc/17/91/45/343179145.db2.gz KSDNUDOKHYRRDY-UWVGGRQHSA-N 1 2 245.388 2.202 20 0 BEADLO CCC(C)(C)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000125383397 343173013 /nfs/dbraw/zinc/17/30/13/343173013.db2.gz AXIPLDZEECYCFT-MRVPVSSYSA-N 1 2 209.293 2.023 20 0 BEADLO COc1c(N)[nH+]cnc1N[C@@H]1CCC[C@H](C)C1 ZINC000134822262 343195588 /nfs/dbraw/zinc/19/55/88/343195588.db2.gz GSRCCJHCMFWTER-DTWKUNHWSA-N 1 2 236.319 2.058 20 0 BEADLO COc1c(N)nc[nH+]c1N[C@@H]1CCC[C@H](C)C1 ZINC000134822262 343195590 /nfs/dbraw/zinc/19/55/90/343195590.db2.gz GSRCCJHCMFWTER-DTWKUNHWSA-N 1 2 236.319 2.058 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2noc(C3CC3)n2)[C@@H]1C ZINC000177908946 136274197 /nfs/dbraw/zinc/27/41/97/136274197.db2.gz USLWZHWWGGJGIT-RKDXNWHRSA-N 1 2 221.304 2.177 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2noc(C3CC3)n2)[C@@H]1C ZINC000177908946 136274198 /nfs/dbraw/zinc/27/41/98/136274198.db2.gz USLWZHWWGGJGIT-RKDXNWHRSA-N 1 2 221.304 2.177 20 0 BEADLO COc1c(N)[nH+]cnc1N[C@H]1CCC[C@H](C)C1 ZINC000134822220 343195379 /nfs/dbraw/zinc/19/53/79/343195379.db2.gz GSRCCJHCMFWTER-IUCAKERBSA-N 1 2 236.319 2.058 20 0 BEADLO COc1c(N)nc[nH+]c1N[C@H]1CCC[C@H](C)C1 ZINC000134822220 343195380 /nfs/dbraw/zinc/19/53/80/343195380.db2.gz GSRCCJHCMFWTER-IUCAKERBSA-N 1 2 236.319 2.058 20 0 BEADLO COc1c(N)[nH+]cnc1N[C@@H]1CCCC[C@@H]1C ZINC000134816505 343195494 /nfs/dbraw/zinc/19/54/94/343195494.db2.gz FSOXOVWWILWUAF-DTWKUNHWSA-N 1 2 236.319 2.058 20 0 BEADLO COc1c(N)nc[nH+]c1N[C@@H]1CCCC[C@@H]1C ZINC000134816505 343195496 /nfs/dbraw/zinc/19/54/96/343195496.db2.gz FSOXOVWWILWUAF-DTWKUNHWSA-N 1 2 236.319 2.058 20 0 BEADLO CCC1(C(=O)N2CCn3cc(C)[nH+]c3C2)CCC1 ZINC000374682710 168431776 /nfs/dbraw/zinc/43/17/76/168431776.db2.gz LKHPJPBKPYOMNH-UHFFFAOYSA-N 1 2 247.342 2.114 20 0 BEADLO COC(=O)[C@@H](CC(C)C)[NH2+]Cc1cccs1 ZINC000035036629 343283092 /nfs/dbraw/zinc/28/30/92/343283092.db2.gz ZKHYBXOKUYJFFF-LLVKDONJSA-N 1 2 241.356 2.425 20 0 BEADLO Cc1nc(N[C@@H]2CCCC[C@H]2F)cc[nH+]1 ZINC000334723559 343260350 /nfs/dbraw/zinc/26/03/50/343260350.db2.gz YTUGUOVLAMDURE-NXEZZACHSA-N 1 2 209.268 2.478 20 0 BEADLO COC(=O)[C@@H]1CCC[N@@H+]1C/C=C/c1ccccc1 ZINC000033915391 343262596 /nfs/dbraw/zinc/26/25/96/343262596.db2.gz IOAVDOFCHUVINQ-KVEVGEHQSA-N 1 2 245.322 2.337 20 0 BEADLO COC(=O)[C@@H]1CCC[N@H+]1C/C=C/c1ccccc1 ZINC000033915391 343262597 /nfs/dbraw/zinc/26/25/97/343262597.db2.gz IOAVDOFCHUVINQ-KVEVGEHQSA-N 1 2 245.322 2.337 20 0 BEADLO c1[nH]cc(Cn2cc(C3CCCCC3)nn2)[nH+]1 ZINC000641036500 362148450 /nfs/dbraw/zinc/14/84/50/362148450.db2.gz OYTPNFVKRQXHGY-UHFFFAOYSA-N 1 2 231.303 2.097 20 0 BEADLO CCn1cc(Nc2nc(C)[nH+]c(C)c2C)cn1 ZINC000348744875 136296188 /nfs/dbraw/zinc/29/61/88/136296188.db2.gz VFOZSBBZUILOPR-UHFFFAOYSA-N 1 2 231.303 2.362 20 0 BEADLO COC(=O)[C@@H](Cc1ccccc1)[NH2+]CC(C)C ZINC000037965903 343362696 /nfs/dbraw/zinc/36/26/96/343362696.db2.gz TUCABHZWGGZAAF-CYBMUJFWSA-N 1 2 235.327 2.016 20 0 BEADLO CCOc1ccc(C[NH2+]Cc2cn[nH]c2C)cc1 ZINC000037989193 343364329 /nfs/dbraw/zinc/36/43/29/343364329.db2.gz QRCWSJUUZUIWBG-UHFFFAOYSA-N 1 2 245.326 2.407 20 0 BEADLO CC[C@@H]([NH2+]Cc1cc[nH]n1)c1nccs1 ZINC000070633944 343336484 /nfs/dbraw/zinc/33/64/84/343336484.db2.gz OJVPFTJOPFYZIZ-SECBINFHSA-N 1 2 222.317 2.107 20 0 BEADLO COc1ccc(C[NH2+]CC(F)F)cc1OC ZINC000037755913 343353500 /nfs/dbraw/zinc/35/35/00/343353500.db2.gz FKUWTQMXVRXXGQ-UHFFFAOYSA-N 1 2 231.242 2.059 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2csnn2)cn1 ZINC000398288689 488214571 /nfs/dbraw/zinc/21/45/71/488214571.db2.gz OOMUQOLJAUQSFI-VIFPVBQESA-N 1 2 234.328 2.092 20 0 BEADLO CCN(Cc1[nH+]cc(C)n1C)Cc1ccncc1 ZINC000348933681 136309322 /nfs/dbraw/zinc/30/93/22/136309322.db2.gz JYYDPAOEOWWLID-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CCCC[C@H](C)C(=O)N1CCn2cc(C)[nH+]c2C1 ZINC000367073437 136322796 /nfs/dbraw/zinc/32/27/96/136322796.db2.gz SKSVVBFJMYUQPP-NSHDSACASA-N 1 2 249.358 2.360 20 0 BEADLO C[NH2+]Cc1noc(C2CCC(C)(C)CC2)n1 ZINC000335692502 136325957 /nfs/dbraw/zinc/32/59/57/136325957.db2.gz DZKNMNLNWOFUBH-UHFFFAOYSA-N 1 2 223.320 2.473 20 0 BEADLO CCn1cc[nH+]c1CN1CC[C@H](C)C(F)(F)C1 ZINC000335696211 136327113 /nfs/dbraw/zinc/32/71/13/136327113.db2.gz XPJFCNGCIUTJKB-JTQLQIEISA-N 1 2 243.301 2.380 20 0 BEADLO Cc1c[nH+]c(CN(C)Cc2ccc(O)cc2)n1C ZINC000349388616 136344794 /nfs/dbraw/zinc/34/47/94/136344794.db2.gz ZZMGBUPSMTZLCW-UHFFFAOYSA-N 1 2 245.326 2.066 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2ccc(O)cc2)n1C ZINC000349388616 136344795 /nfs/dbraw/zinc/34/47/95/136344795.db2.gz ZZMGBUPSMTZLCW-UHFFFAOYSA-N 1 2 245.326 2.066 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2ccc(O)cc2)n1C ZINC000349388616 136344796 /nfs/dbraw/zinc/34/47/96/136344796.db2.gz ZZMGBUPSMTZLCW-UHFFFAOYSA-N 1 2 245.326 2.066 20 0 BEADLO C[C@@H]1C[C@@H]1CC(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000335722183 136346114 /nfs/dbraw/zinc/34/61/14/136346114.db2.gz PDBFXQZCENTSNY-ZYHUDNBSSA-N 1 2 247.342 2.162 20 0 BEADLO C[C@H]1C[C@H]1CC(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000335722181 136346195 /nfs/dbraw/zinc/34/61/95/136346195.db2.gz PDBFXQZCENTSNY-JQWIXIFHSA-N 1 2 247.342 2.162 20 0 BEADLO CC[C@H]([NH2+]C[C@@H]1CCCCC1(F)F)C(=O)OC ZINC000394501457 259360491 /nfs/dbraw/zinc/36/04/91/259360491.db2.gz NSKFYILKECUXAS-UWVGGRQHSA-N 1 2 249.301 2.353 20 0 BEADLO CC[C@H]([NH2+]C[C@H]1CCCCC1(F)F)C(=O)OC ZINC000394501461 259360535 /nfs/dbraw/zinc/36/05/35/259360535.db2.gz NSKFYILKECUXAS-ZJUUUORDSA-N 1 2 249.301 2.353 20 0 BEADLO CC[C@H]([NH2+]Cc1c(C)noc1C)c1ccn(C)n1 ZINC000349457827 136351988 /nfs/dbraw/zinc/35/19/88/136351988.db2.gz PCDPCMAUESPFKZ-LBPRGKRZSA-N 1 2 248.330 2.266 20 0 BEADLO Cc1nc(C[N@H+]2[C@H](C)COC[C@@H]2C)c(C)s1 ZINC000335704368 136335112 /nfs/dbraw/zinc/33/51/12/136335112.db2.gz BRRQSUOSJZLCMP-DTORHVGOSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nc(C[N@@H+]2[C@H](C)COC[C@@H]2C)c(C)s1 ZINC000335704368 136335113 /nfs/dbraw/zinc/33/51/13/136335113.db2.gz BRRQSUOSJZLCMP-DTORHVGOSA-N 1 2 240.372 2.369 20 0 BEADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ncc[nH]1 ZINC000335714878 136338927 /nfs/dbraw/zinc/33/89/27/136338927.db2.gz SRKNYTQNAFUZRK-SFYZADRCSA-N 1 2 233.237 2.182 20 0 BEADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ncc[nH]1 ZINC000335714878 136338928 /nfs/dbraw/zinc/33/89/28/136338928.db2.gz SRKNYTQNAFUZRK-SFYZADRCSA-N 1 2 233.237 2.182 20 0 BEADLO COC(=O)[C@@H](C)[NH2+]Cc1c(C)cc(C)cc1C ZINC000042303921 343434064 /nfs/dbraw/zinc/43/40/64/343434064.db2.gz WJWHHBSCZSGJDK-GFCCVEGCSA-N 1 2 235.327 2.263 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+]2CCO[C@@H](C3CC3)C2)o1 ZINC000335853999 136355965 /nfs/dbraw/zinc/35/59/65/136355965.db2.gz CSUJNNGRZOVUIN-ZYHUDNBSSA-N 1 2 236.315 2.155 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+]2CCO[C@@H](C3CC3)C2)o1 ZINC000335853999 136355966 /nfs/dbraw/zinc/35/59/66/136355966.db2.gz CSUJNNGRZOVUIN-ZYHUDNBSSA-N 1 2 236.315 2.155 20 0 BEADLO CC(C)(C)c1nnc(C[N@@H+]2CCC(C)(C)C2)[nH]1 ZINC000335898996 136359948 /nfs/dbraw/zinc/35/99/48/136359948.db2.gz BZKLRFCQTLSYPJ-UHFFFAOYSA-N 1 2 236.363 2.334 20 0 BEADLO CC(C)(C)c1nnc(C[N@H+]2CCC(C)(C)C2)[nH]1 ZINC000335898996 136359949 /nfs/dbraw/zinc/35/99/49/136359949.db2.gz BZKLRFCQTLSYPJ-UHFFFAOYSA-N 1 2 236.363 2.334 20 0 BEADLO CC(C)[C@@H]1N(C(=O)CCc2[nH]cc[nH+]2)CC1(C)C ZINC000350748475 136362754 /nfs/dbraw/zinc/36/27/54/136362754.db2.gz NISWXMFPDCIJAW-ZDUSSCGKSA-N 1 2 249.358 2.235 20 0 BEADLO CCCc1csc(CNc2c[nH]c[nH+]2)n1 ZINC000379967009 365769286 /nfs/dbraw/zinc/76/92/86/365769286.db2.gz ZLTALIKIXRGMNZ-UHFFFAOYSA-N 1 2 222.317 2.431 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)C1CCCC1 ZINC000047976232 343569233 /nfs/dbraw/zinc/56/92/33/343569233.db2.gz JRHMYAJHZGBSCR-UHFFFAOYSA-N 1 2 233.315 2.276 20 0 BEADLO CC(NC(=O)CCc1[nH]cc[nH+]1)(C1CC1)C1CC1 ZINC000620025031 343570810 /nfs/dbraw/zinc/57/08/10/343570810.db2.gz FIEGMFUSBQCPHJ-UHFFFAOYSA-N 1 2 247.342 2.037 20 0 BEADLO COC(=O)[C@H]([NH2+]CCc1ccccc1)C(C)(C)C ZINC000083381225 343591726 /nfs/dbraw/zinc/59/17/26/343591726.db2.gz KQLDMKWJEYPVDP-ZDUSSCGKSA-N 1 2 249.354 2.406 20 0 BEADLO Cc1c[nH]c(CN2CC(c3ccccc3F)C2)[nH+]1 ZINC000628290333 346948146 /nfs/dbraw/zinc/94/81/46/346948146.db2.gz ZJBUWUUTPLKZKY-UHFFFAOYSA-N 1 2 245.301 2.457 20 0 BEADLO Cc1cc(C(=O)N(C)Cc2[nH]cc[nH+]2)c(C)s1 ZINC000070979177 343580573 /nfs/dbraw/zinc/58/05/73/343580573.db2.gz BZFJVIWTTWWSFG-UHFFFAOYSA-N 1 2 249.339 2.360 20 0 BEADLO Cc1cc(F)ccc1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000622745667 343605368 /nfs/dbraw/zinc/60/53/68/343605368.db2.gz SDNFQDFMQYTCKX-UHFFFAOYSA-N 1 2 247.273 2.129 20 0 BEADLO Cc1cc(F)ccc1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000622745667 343605371 /nfs/dbraw/zinc/60/53/71/343605371.db2.gz SDNFQDFMQYTCKX-UHFFFAOYSA-N 1 2 247.273 2.129 20 0 BEADLO O=C(Nc1c[nH+]c2n1CCCC2)[C@]12C[C@H]1CCC2 ZINC000421570208 192363361 /nfs/dbraw/zinc/36/33/61/192363361.db2.gz QAJUAVSLHSMLSF-QMTHXVAHSA-N 1 2 245.326 2.348 20 0 BEADLO COC(=O)C[N@H+](C)[C@@H](C)c1ccc(C)cc1 ZINC000047960156 343675578 /nfs/dbraw/zinc/67/55/78/343675578.db2.gz NOPTUBKSOJSRMD-NSHDSACASA-N 1 2 221.300 2.161 20 0 BEADLO COC(=O)C[N@@H+](C)[C@@H](C)c1ccc(C)cc1 ZINC000047960156 343675581 /nfs/dbraw/zinc/67/55/81/343675581.db2.gz NOPTUBKSOJSRMD-NSHDSACASA-N 1 2 221.300 2.161 20 0 BEADLO Cc1cc(N2CC[C@H](c3ccncc3)C2)nc[nH+]1 ZINC000624358623 343737139 /nfs/dbraw/zinc/73/71/39/343737139.db2.gz PHTZJBARWKURAW-ZDUSSCGKSA-N 1 2 240.310 2.174 20 0 BEADLO CC(C)(C)OC(=O)C[NH+]1CCC(C)(F)CC1 ZINC000602992192 349846969 /nfs/dbraw/zinc/84/69/69/349846969.db2.gz BFAGZMMEQGIEBT-UHFFFAOYSA-N 1 2 231.311 2.152 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CC[C@@H](C)C1)c1[nH]cc[nH+]1 ZINC000570409671 323058857 /nfs/dbraw/zinc/05/88/57/323058857.db2.gz CJHMATYIJNCDHX-OPRDCNLKSA-N 1 2 221.304 2.023 20 0 BEADLO CN(CC1CCCC1)C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493511647 529863280 /nfs/dbraw/zinc/86/32/80/529863280.db2.gz ADTYSFQCWKHESF-VOTSOKGWSA-N 1 2 233.315 2.072 20 0 BEADLO CN(CC1CCCC1)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492764865 529863333 /nfs/dbraw/zinc/86/33/33/529863333.db2.gz KXCBJUGYBWUKLK-SREVYHEPSA-N 1 2 233.315 2.072 20 0 BEADLO CCN(Cc1ccccc1)c1cc(N)nc[nH+]1 ZINC000127310094 343787319 /nfs/dbraw/zinc/78/73/19/343787319.db2.gz IABXPKBPXUZPQC-UHFFFAOYSA-N 1 2 228.299 2.085 20 0 BEADLO CNc1cc(NCc2ccc(F)cc2)nc[nH+]1 ZINC000128529797 343787848 /nfs/dbraw/zinc/78/78/48/343787848.db2.gz ANADMMBLMFXXNW-UHFFFAOYSA-N 1 2 232.262 2.270 20 0 BEADLO CNc1cc(NCc2ccc(F)cc2)[nH+]cn1 ZINC000128529797 343787850 /nfs/dbraw/zinc/78/78/50/343787850.db2.gz ANADMMBLMFXXNW-UHFFFAOYSA-N 1 2 232.262 2.270 20 0 BEADLO CNc1cc(N2Cc3ccccc3C2)nc[nH+]1 ZINC000132577326 343788066 /nfs/dbraw/zinc/78/80/66/343788066.db2.gz KOHNTKREMQPAIE-UHFFFAOYSA-N 1 2 226.283 2.039 20 0 BEADLO CNc1cc(N2Cc3ccccc3C2)[nH+]cn1 ZINC000132577326 343788067 /nfs/dbraw/zinc/78/80/67/343788067.db2.gz KOHNTKREMQPAIE-UHFFFAOYSA-N 1 2 226.283 2.039 20 0 BEADLO Cn1ccc(C[NH2+][C@H]2CSc3ccccc32)n1 ZINC000096693115 343878646 /nfs/dbraw/zinc/87/86/46/343878646.db2.gz GXLBVFRPCMEYEU-LBPRGKRZSA-N 1 2 245.351 2.357 20 0 BEADLO Cc1[nH]c(CN[C@H](C)C(F)(F)F)[nH+]c1C ZINC000582132957 347000004 /nfs/dbraw/zinc/00/00/04/347000004.db2.gz DNZIJMMVKCYWIY-SSDOTTSWSA-N 1 2 221.226 2.067 20 0 BEADLO C[C@@H]([NH2+]CC(C)(F)F)c1ccncc1 ZINC000393421645 343869676 /nfs/dbraw/zinc/86/96/76/343869676.db2.gz JHXNXWBOEGMIFW-MRVPVSSYSA-N 1 2 200.232 2.387 20 0 BEADLO c1c(C[NH+]2CC(CC3CC3)C2)nnn1C1CCC1 ZINC000621740310 343886427 /nfs/dbraw/zinc/88/64/27/343886427.db2.gz JMPIQPFANPGLQS-UHFFFAOYSA-N 1 2 246.358 2.235 20 0 BEADLO CO[C@@H](CNc1cccc[nH+]1)C(F)(F)F ZINC000393776965 343927512 /nfs/dbraw/zinc/92/75/12/343927512.db2.gz NYSWXEASAMGUKM-ZETCQYMHSA-N 1 2 220.194 2.071 20 0 BEADLO Cc1c[nH]c(CN2CCn3cccc3[C@H]2C)[nH+]1 ZINC000628119371 343970795 /nfs/dbraw/zinc/97/07/95/343970795.db2.gz OSUQGRZBCVIRNM-LLVKDONJSA-N 1 2 230.315 2.096 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCn3cccc3[C@H]2C)n1 ZINC000628119371 343970796 /nfs/dbraw/zinc/97/07/96/343970796.db2.gz OSUQGRZBCVIRNM-LLVKDONJSA-N 1 2 230.315 2.096 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCn3cccc3[C@H]2C)n1 ZINC000628119371 343970797 /nfs/dbraw/zinc/97/07/97/343970797.db2.gz OSUQGRZBCVIRNM-LLVKDONJSA-N 1 2 230.315 2.096 20 0 BEADLO Cc1ncc(C[N@@H+]2CCn3cccc3[C@@H]2C)o1 ZINC000628119459 343971364 /nfs/dbraw/zinc/97/13/64/343971364.db2.gz UECXGFQMXFVSNT-JTQLQIEISA-N 1 2 231.299 2.361 20 0 BEADLO Cc1ncc(C[N@H+]2CCn3cccc3[C@@H]2C)o1 ZINC000628119459 343971365 /nfs/dbraw/zinc/97/13/65/343971365.db2.gz UECXGFQMXFVSNT-JTQLQIEISA-N 1 2 231.299 2.361 20 0 BEADLO CC[C@H](F)C[NH+]1CCN(c2nccs2)CC1 ZINC000570632053 323065210 /nfs/dbraw/zinc/06/52/10/323065210.db2.gz SDGRBUSNMSJIQP-JTQLQIEISA-N 1 2 243.351 2.013 20 0 BEADLO Cc1cccn2c(NC(=O)C34CC(C3)C4)c[nH+]c12 ZINC000628108741 343963333 /nfs/dbraw/zinc/96/33/33/343963333.db2.gz QCYUUOPVSHDYJT-UHFFFAOYSA-N 1 2 241.294 2.381 20 0 BEADLO Cc1c[nH]c(C[N@@H+](C)Cc2ccccc2)n1 ZINC000628116920 343965661 /nfs/dbraw/zinc/96/56/61/343965661.db2.gz KFYADXHGZYWABX-UHFFFAOYSA-N 1 2 215.300 2.350 20 0 BEADLO Cc1c[nH]c(C[N@H+](C)Cc2ccccc2)n1 ZINC000628116920 343965662 /nfs/dbraw/zinc/96/56/62/343965662.db2.gz KFYADXHGZYWABX-UHFFFAOYSA-N 1 2 215.300 2.350 20 0 BEADLO FC1(F)CCC[N@H+](Cc2ncccn2)CC1 ZINC000625770088 344065276 /nfs/dbraw/zinc/06/52/76/344065276.db2.gz FSIQLRKQNDGVIR-UHFFFAOYSA-N 1 2 227.258 2.098 20 0 BEADLO FC1(F)CCC[N@@H+](Cc2ncccn2)CC1 ZINC000625770088 344065280 /nfs/dbraw/zinc/06/52/80/344065280.db2.gz FSIQLRKQNDGVIR-UHFFFAOYSA-N 1 2 227.258 2.098 20 0 BEADLO CCCCOCCCNc1cc[nH+]cc1F ZINC000641252907 362330897 /nfs/dbraw/zinc/33/08/97/362330897.db2.gz AYSWMTYEXBCVAM-UHFFFAOYSA-N 1 2 226.295 2.261 20 0 BEADLO Cc1cc(C[NH2+]Cc2cocn2)cs1 ZINC000395204988 362349367 /nfs/dbraw/zinc/34/93/67/362349367.db2.gz SZRNPBYUJVKABE-UHFFFAOYSA-N 1 2 208.286 2.334 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1C[C@@H](C)C[C@@H]1C ZINC000335912318 344084694 /nfs/dbraw/zinc/08/46/94/344084694.db2.gz RUMKWBDRGKSUDW-ONGXEEELSA-N 1 2 233.315 2.074 20 0 BEADLO CC(C)Cc1noc(C[NH+](C2CC2)C2CC2)n1 ZINC000625835490 344089195 /nfs/dbraw/zinc/08/91/95/344089195.db2.gz ZQTGWXYTXOZPRU-UHFFFAOYSA-N 1 2 235.331 2.395 20 0 BEADLO Cc1nc(NCC(C)(F)F)c2c([nH+]1)CCCC2 ZINC000558949926 344089760 /nfs/dbraw/zinc/08/97/60/344089760.db2.gz VBIACRLXVIFBKX-UHFFFAOYSA-N 1 2 241.285 2.153 20 0 BEADLO Cn1c(C[NH+](C2CC2)C2CC2)nnc1C1CCC1 ZINC000625842418 344093617 /nfs/dbraw/zinc/09/36/17/344093617.db2.gz IWKWVBMKKICWIH-UHFFFAOYSA-N 1 2 246.358 2.209 20 0 BEADLO CC(C)c1noc(Cc2cn3ccccc3[nH+]2)n1 ZINC000130586152 344150248 /nfs/dbraw/zinc/15/02/48/344150248.db2.gz QMDFZKPIRLEZHQ-UHFFFAOYSA-N 1 2 242.282 2.432 20 0 BEADLO Cc1c[nH]c(CN2CCc3sccc3C2)[nH+]1 ZINC000628128264 344156806 /nfs/dbraw/zinc/15/68/06/344156806.db2.gz XBAVDNPYGJCDKM-UHFFFAOYSA-N 1 2 233.340 2.338 20 0 BEADLO CC[C@@H]([NH2+]c1ccc(OCC(N)=O)cc1)C1CC1 ZINC000086117592 344211888 /nfs/dbraw/zinc/21/18/88/344211888.db2.gz CHXRUCHAQRYRGD-CYBMUJFWSA-N 1 2 248.326 2.151 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@@H](C)CC(F)(F)F ZINC000130138221 344219138 /nfs/dbraw/zinc/21/91/38/344219138.db2.gz AXKJVCHHNZHXJY-LURJTMIESA-N 1 2 221.226 2.149 20 0 BEADLO CCN(Cc1ccoc1)c1cc(CO)cc[nH+]1 ZINC000641334134 362367664 /nfs/dbraw/zinc/36/76/64/362367664.db2.gz VWTRBCGLANBADB-UHFFFAOYSA-N 1 2 232.283 2.193 20 0 BEADLO C[C@H](CO)CSCc1ccc(N(C)C)[nH+]c1 ZINC000600524417 344256529 /nfs/dbraw/zinc/25/65/29/344256529.db2.gz KWHOROCXISQBJQ-SNVBAGLBSA-N 1 2 240.372 2.009 20 0 BEADLO C[C@H]([NH2+]C1(C2CC2)CC1)C(=O)OC(C)(C)C ZINC000309375691 347043995 /nfs/dbraw/zinc/04/39/95/347043995.db2.gz COUYDDAKKOUMML-VIFPVBQESA-N 1 2 225.332 2.249 20 0 BEADLO Cn1c[nH+]cc1CSCc1ccccn1 ZINC000600572934 344287736 /nfs/dbraw/zinc/28/77/36/344287736.db2.gz AJFGLMCEQDOIFB-UHFFFAOYSA-N 1 2 219.313 2.249 20 0 BEADLO Cc1ccc(C(=O)N[C@@H](C)c2[nH+]ccn2C)s1 ZINC000620592285 344325620 /nfs/dbraw/zinc/32/56/20/344325620.db2.gz ODYCSUWJWYXACF-VIFPVBQESA-N 1 2 249.339 2.281 20 0 BEADLO C[C@H](NC(=O)[C@H]1CCC[C@@H](C)C1)c1[nH+]ccn1C ZINC000620598910 344334109 /nfs/dbraw/zinc/33/41/09/344334109.db2.gz AAMWNVGMNRDFGV-WOPDTQHZSA-N 1 2 249.358 2.424 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CCC[C@@H](C)C1)c1[nH+]ccn1C ZINC000620598908 344334122 /nfs/dbraw/zinc/33/41/22/344334122.db2.gz AAMWNVGMNRDFGV-UTUOFQBUSA-N 1 2 249.358 2.424 20 0 BEADLO COc1ccc(C)cc1CN(C)Cc1[nH]cc[nH+]1 ZINC000600619912 344340550 /nfs/dbraw/zinc/34/05/50/344340550.db2.gz MVMXKALWHZRYRT-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO CC1(C)CN(c2cc[nH+]cc2F)CCCO1 ZINC000641381957 362384381 /nfs/dbraw/zinc/38/43/81/362384381.db2.gz MFOKJNJARSPXCL-UHFFFAOYSA-N 1 2 224.279 2.226 20 0 BEADLO CC(C)C[C@H](C)C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620603471 344353568 /nfs/dbraw/zinc/35/35/68/344353568.db2.gz IOPWQEMYJLGZES-WDEREUQCSA-N 1 2 237.347 2.280 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620603646 344353670 /nfs/dbraw/zinc/35/36/70/344353670.db2.gz JSPUFUBYFPSNRP-MISXGVKJSA-N 1 2 249.358 2.280 20 0 BEADLO C[C@@H](NC(=O)[C@@H](C)C1CCCC1)c1[nH+]ccn1C ZINC000620603639 344353736 /nfs/dbraw/zinc/35/37/36/344353736.db2.gz MEAYXXWZPSRZSE-WDEREUQCSA-N 1 2 249.358 2.424 20 0 BEADLO CCOC[C@@H]1CCCN(c2cc[nH+]cc2F)C1 ZINC000641376206 362380644 /nfs/dbraw/zinc/38/06/44/362380644.db2.gz AYLCDSHXDIEFHU-LLVKDONJSA-N 1 2 238.306 2.474 20 0 BEADLO C[C@@H](NC(=O)[C@]1(C)C[C@H]2C[C@H]2C1)c1[nH+]ccn1C ZINC000620610082 344358536 /nfs/dbraw/zinc/35/85/36/344358536.db2.gz VHDCWPGNWCKJTH-NJBDSQKTSA-N 1 2 247.342 2.034 20 0 BEADLO Cc1noc(C)c1[C@H](C)Nc1cc(CO)cc[nH+]1 ZINC000641376995 362380810 /nfs/dbraw/zinc/38/08/10/362380810.db2.gz OUJRZADRCTYJBK-QMMMGPOBSA-N 1 2 247.298 2.352 20 0 BEADLO C[C@@H](C(=O)N[C@@H](C)c1[nH+]ccn1C)C1CCC1 ZINC000620612642 344368870 /nfs/dbraw/zinc/36/88/70/344368870.db2.gz ZXQLQYVOINRLDD-ZJUUUORDSA-N 1 2 235.331 2.034 20 0 BEADLO COc1ccc(NCC(F)(F)F)[nH+]c1 ZINC000234895007 344448741 /nfs/dbraw/zinc/44/87/41/344448741.db2.gz DJFUEFKXASHXHF-UHFFFAOYSA-N 1 2 206.167 2.064 20 0 BEADLO CC[C@H]([NH2+][C@H](C)C(=O)OC)c1cccs1 ZINC000042303745 344450360 /nfs/dbraw/zinc/45/03/60/344450360.db2.gz ZOSUOAUYYZFIKL-BDAKNGLRSA-N 1 2 227.329 2.350 20 0 BEADLO Cc1csc(C[N@@H+]2CCOCC23CCC3)n1 ZINC000135511543 344505958 /nfs/dbraw/zinc/50/59/58/344505958.db2.gz ZWWRYJNGPZYRJF-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO Cc1csc(C[N@H+]2CCOCC23CCC3)n1 ZINC000135511543 344505961 /nfs/dbraw/zinc/50/59/61/344505961.db2.gz ZWWRYJNGPZYRJF-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO CC1(CNc2ccc(CO)c[nH+]2)CCC1 ZINC000336759758 537845894 /nfs/dbraw/zinc/84/58/94/537845894.db2.gz LOTSFEZXYJRVNG-UHFFFAOYSA-N 1 2 206.289 2.176 20 0 BEADLO COC(C)(C)C[C@H](C)Nc1cc(CO)cc[nH+]1 ZINC000641398922 362394002 /nfs/dbraw/zinc/39/40/02/362394002.db2.gz LBSLSLKEJQCQLJ-JTQLQIEISA-N 1 2 238.331 2.189 20 0 BEADLO COc1ccc[nH+]c1N1CC[C@H](C)[C@@H](F)C1 ZINC000624088897 344493941 /nfs/dbraw/zinc/49/39/41/344493941.db2.gz ZOHQNCSQBJJVKH-UWVGGRQHSA-N 1 2 224.279 2.275 20 0 BEADLO COCC(C)(C)CNc1[nH+]cccc1OC ZINC000381272601 344494010 /nfs/dbraw/zinc/49/40/10/344494010.db2.gz WAJOGGIIMKGPBE-UHFFFAOYSA-N 1 2 224.304 2.175 20 0 BEADLO CCn1ccnc1C[NH2+]Cc1ccoc1C ZINC000381336294 344496370 /nfs/dbraw/zinc/49/63/70/344496370.db2.gz VUGZKMGGBIRCTA-UHFFFAOYSA-N 1 2 219.288 2.094 20 0 BEADLO Cc1ccc(SCCCn2cc[nH+]c2)nn1 ZINC000641417859 362405658 /nfs/dbraw/zinc/40/56/58/362405658.db2.gz XGTSYNUTFYSIOH-UHFFFAOYSA-N 1 2 234.328 2.164 20 0 BEADLO CCc1nc(C[N@H+](C(C)C)C2CCC2)no1 ZINC000119787075 344547201 /nfs/dbraw/zinc/54/72/01/344547201.db2.gz JBZNSGUBMOPULU-UHFFFAOYSA-N 1 2 223.320 2.395 20 0 BEADLO CCc1nc(C[N@@H+](C(C)C)C2CCC2)no1 ZINC000119787075 344547205 /nfs/dbraw/zinc/54/72/05/344547205.db2.gz JBZNSGUBMOPULU-UHFFFAOYSA-N 1 2 223.320 2.395 20 0 BEADLO CCC1(CNc2cc[nH+]cc2F)CCOCC1 ZINC000641407902 362400068 /nfs/dbraw/zinc/40/00/68/362400068.db2.gz FWSYTNRSUMINDX-UHFFFAOYSA-N 1 2 238.306 2.261 20 0 BEADLO CO[C@H](CNc1cc[nH+]cc1F)C(C)(C)C ZINC000641407656 362400223 /nfs/dbraw/zinc/40/02/23/362400223.db2.gz AAEVYWZYQOFEFW-LLVKDONJSA-N 1 2 226.295 2.116 20 0 BEADLO CC1(C)CN(c2cccc[nH+]2)CCCO1 ZINC000370911335 344567385 /nfs/dbraw/zinc/56/73/85/344567385.db2.gz MGHFEJUFRLGURY-UHFFFAOYSA-N 1 2 206.289 2.087 20 0 BEADLO OCc1cc[nH+]c(N[C@H]2CCOC3(CCC3)C2)c1 ZINC000641447634 362424810 /nfs/dbraw/zinc/42/48/10/362424810.db2.gz PNGJMYRBNXRLIJ-LBPRGKRZSA-N 1 2 248.326 2.088 20 0 BEADLO CN(CCc1nccs1)c1cc[nH+]cc1F ZINC000641459531 362433052 /nfs/dbraw/zinc/43/30/52/362433052.db2.gz FZUUYEZMIWOXCL-UHFFFAOYSA-N 1 2 237.303 2.356 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1[C@@H]2CCO[C@H]2C12CCC2 ZINC000641461973 362436620 /nfs/dbraw/zinc/43/66/20/362436620.db2.gz ZNZLDZFAMIPKQN-ZWKOPEQDSA-N 1 2 248.301 2.012 20 0 BEADLO Cc1coc(SCc2cn(C)c[nH+]2)n1 ZINC000641477601 362446354 /nfs/dbraw/zinc/44/63/54/362446354.db2.gz DEZYQBHZTMTGBF-UHFFFAOYSA-N 1 2 209.274 2.009 20 0 BEADLO C[C@@]1(CNc2cc[nH+]cc2F)CCCS1 ZINC000641433390 362416550 /nfs/dbraw/zinc/41/65/50/362416550.db2.gz UPPLRZHBWMNPFM-NSHDSACASA-N 1 2 226.320 2.340 20 0 BEADLO C[C@H](CNc1cc(CO)cc[nH+]1)c1nccs1 ZINC000641487675 362455338 /nfs/dbraw/zinc/45/53/38/362455338.db2.gz BFXVFMZMRLTUPA-SECBINFHSA-N 1 2 249.339 2.246 20 0 BEADLO CO[C@H]1CCCN(c2cc[nH+]cc2F)CC1 ZINC000641488497 362455458 /nfs/dbraw/zinc/45/54/58/362455458.db2.gz SWLGQQTWPSBARI-JTQLQIEISA-N 1 2 224.279 2.226 20 0 BEADLO CC1(CCNc2cc(CO)cc[nH+]2)CC1 ZINC000641545540 362492584 /nfs/dbraw/zinc/49/25/84/362492584.db2.gz NYZJKIAOKOWIOP-UHFFFAOYSA-N 1 2 206.289 2.176 20 0 BEADLO Fc1c[nH+]ccc1N1CCOCC2(CCC2)C1 ZINC000641509820 362469743 /nfs/dbraw/zinc/46/97/43/362469743.db2.gz BDXSYNIIWOQTCC-UHFFFAOYSA-N 1 2 236.290 2.228 20 0 BEADLO CC(C)[C@@H]1CCCN(c2cc(CO)cc[nH+]2)C1 ZINC000641521525 362479340 /nfs/dbraw/zinc/47/93/40/362479340.db2.gz NUJVDJLJTTZJHW-CYBMUJFWSA-N 1 2 234.343 2.446 20 0 BEADLO Oc1cccc2c1CC[N@H+](Cc1nccs1)C2 ZINC000626027590 344679466 /nfs/dbraw/zinc/67/94/66/344679466.db2.gz DBWZUDDNPDASOC-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO Oc1cccc2c1CC[N@@H+](Cc1nccs1)C2 ZINC000626027590 344679468 /nfs/dbraw/zinc/67/94/68/344679468.db2.gz DBWZUDDNPDASOC-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO Cc1ccc(NC(=O)C23CC(C2)C3)c(C)[nH+]1 ZINC000626061039 344707476 /nfs/dbraw/zinc/70/74/76/344707476.db2.gz XECOEANPSCLSBT-UHFFFAOYSA-N 1 2 216.284 2.437 20 0 BEADLO Cc1ncc(C[NH+]2C[C@H](C)O[C@@H](C)C2)s1 ZINC000128020132 344712803 /nfs/dbraw/zinc/71/28/03/344712803.db2.gz QTSKYPSGSHRFNB-IUCAKERBSA-N 1 2 226.345 2.061 20 0 BEADLO OCCC1(CNc2cccc[nH+]2)CCCC1 ZINC000075064178 344764554 /nfs/dbraw/zinc/76/45/54/344764554.db2.gz GNDMFVXVBAUJCP-UHFFFAOYSA-N 1 2 220.316 2.436 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)/C=C/C1CCCC1 ZINC000493743758 530025895 /nfs/dbraw/zinc/02/58/95/530025895.db2.gz DSJMVYYBQMMOLW-VOTSOKGWSA-N 1 2 233.315 2.115 20 0 BEADLO CCc1nnc(C[NH+]2[C@@H](C)C[C@@H]2C)s1 ZINC000684208056 488272054 /nfs/dbraw/zinc/27/20/54/488272054.db2.gz GOOQMEWGZRFVRF-YUMQZZPRSA-N 1 2 211.334 2.083 20 0 BEADLO CC(C)c1nc(C[N@@H+](C)CC2CC2)no1 ZINC000053611019 323077421 /nfs/dbraw/zinc/07/74/21/323077421.db2.gz HUIYOGVAZDJOEW-UHFFFAOYSA-N 1 2 209.293 2.035 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnc(C3CC3)o2)[C@@H](C)CO1 ZINC000628140511 344805558 /nfs/dbraw/zinc/80/55/58/344805558.db2.gz NOQUEDDGNQNDRM-VHSXEESVSA-N 1 2 236.315 2.161 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnc(C3CC3)o2)[C@@H](C)CO1 ZINC000628140511 344805559 /nfs/dbraw/zinc/80/55/59/344805559.db2.gz NOQUEDDGNQNDRM-VHSXEESVSA-N 1 2 236.315 2.161 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2cnc(C)s2)o1 ZINC000628148937 344835516 /nfs/dbraw/zinc/83/55/16/344835516.db2.gz GFIRSKMAUOVALA-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2cnc(C)s2)o1 ZINC000628148937 344835518 /nfs/dbraw/zinc/83/55/18/344835518.db2.gz GFIRSKMAUOVALA-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CCCC12CC2)c1[nH+]ccn1C ZINC000628148858 344835596 /nfs/dbraw/zinc/83/55/96/344835596.db2.gz CDIRXGOOGZDPDR-MNOVXSKESA-N 1 2 247.342 2.178 20 0 BEADLO CO[C@@H]1CCCC[C@H]1Nc1cccc[nH+]1 ZINC000078427358 344867545 /nfs/dbraw/zinc/86/75/45/344867545.db2.gz DGKMEVVBNAVDRC-GHMZBOCLSA-N 1 2 206.289 2.451 20 0 BEADLO CO[C@@H]1CCCC[C@H]1Nc1cc[nH+]c(C)n1 ZINC000078426993 344867626 /nfs/dbraw/zinc/86/76/26/344867626.db2.gz UGFOXJUMQPRABG-GHMZBOCLSA-N 1 2 221.304 2.155 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nc(C)c[nH]2)CCS1 ZINC000628178953 344913116 /nfs/dbraw/zinc/91/31/16/344913116.db2.gz JFSBNRISCSBUOY-SNVBAGLBSA-N 1 2 225.361 2.046 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nc(C)c[nH]2)CCS1 ZINC000628178953 344913120 /nfs/dbraw/zinc/91/31/20/344913120.db2.gz JFSBNRISCSBUOY-SNVBAGLBSA-N 1 2 225.361 2.046 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@@H+]1Cc1cnc(C2CC2)o1 ZINC000628175916 344899992 /nfs/dbraw/zinc/89/99/92/344899992.db2.gz NVOWFTFMNMYNDV-ZJUUUORDSA-N 1 2 236.315 2.161 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1cnc(C2CC2)o1 ZINC000628175916 344899993 /nfs/dbraw/zinc/89/99/93/344899993.db2.gz NVOWFTFMNMYNDV-ZJUUUORDSA-N 1 2 236.315 2.161 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2cnc(C3CC3)o2)[C@H]1C ZINC000628175915 344900064 /nfs/dbraw/zinc/90/00/64/344900064.db2.gz NVOWFTFMNMYNDV-VHSXEESVSA-N 1 2 236.315 2.161 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2cnc(C3CC3)o2)[C@H]1C ZINC000628175915 344900065 /nfs/dbraw/zinc/90/00/65/344900065.db2.gz NVOWFTFMNMYNDV-VHSXEESVSA-N 1 2 236.315 2.161 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2cccc(C)n2)o1 ZINC000628182701 344926673 /nfs/dbraw/zinc/92/66/73/344926673.db2.gz FDYCNCUOHNIEHD-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2cccc(C)n2)o1 ZINC000628182701 344926677 /nfs/dbraw/zinc/92/66/77/344926677.db2.gz FDYCNCUOHNIEHD-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1nc(C[N@@H+]2CCSC(C)(C)C2)[nH]c1C ZINC000628178775 344913393 /nfs/dbraw/zinc/91/33/93/344913393.db2.gz BOMOWRLDSUCHKA-UHFFFAOYSA-N 1 2 239.388 2.354 20 0 BEADLO Cc1nc(C[N@H+]2CCSC(C)(C)C2)[nH]c1C ZINC000628178775 344913395 /nfs/dbraw/zinc/91/33/95/344913395.db2.gz BOMOWRLDSUCHKA-UHFFFAOYSA-N 1 2 239.388 2.354 20 0 BEADLO Cc1[nH]c(CN2CCSC(C)(C)C2)[nH+]c1C ZINC000628178775 344913397 /nfs/dbraw/zinc/91/33/97/344913397.db2.gz BOMOWRLDSUCHKA-UHFFFAOYSA-N 1 2 239.388 2.354 20 0 BEADLO CC[C@H]1CCCC[C@H]1C[N@H+](C)Cc1nnc[nH]1 ZINC000628179659 344915762 /nfs/dbraw/zinc/91/57/62/344915762.db2.gz JPZRSERYJYDDEP-RYUDHWBXSA-N 1 2 236.363 2.453 20 0 BEADLO CC[C@H]1CCCC[C@H]1C[N@@H+](C)Cc1nnc[nH]1 ZINC000628179659 344915763 /nfs/dbraw/zinc/91/57/63/344915763.db2.gz JPZRSERYJYDDEP-RYUDHWBXSA-N 1 2 236.363 2.453 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1C[N@H+](C)Cc1nnc[nH]1 ZINC000628179660 344915865 /nfs/dbraw/zinc/91/58/65/344915865.db2.gz JPZRSERYJYDDEP-VXGBXAGGSA-N 1 2 236.363 2.453 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1C[N@@H+](C)Cc1nnc[nH]1 ZINC000628179660 344915868 /nfs/dbraw/zinc/91/58/68/344915868.db2.gz JPZRSERYJYDDEP-VXGBXAGGSA-N 1 2 236.363 2.453 20 0 BEADLO Fc1c[nH+]ccc1N1CCC[C@H]1[C@H]1CCCO1 ZINC000641560655 362500520 /nfs/dbraw/zinc/50/05/20/362500520.db2.gz FNTCRIUWYVRJOV-QWHCGFSZSA-N 1 2 236.290 2.369 20 0 BEADLO CCc1nc(COCc2[nH]cc[nH+]2)cs1 ZINC000123773110 345015594 /nfs/dbraw/zinc/01/55/94/345015594.db2.gz MYHVBKXOWFCLQR-UHFFFAOYSA-N 1 2 223.301 2.145 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@H](C)C(F)(F)F ZINC000079843619 345043288 /nfs/dbraw/zinc/04/32/88/345043288.db2.gz YSNBPLNGXSRJIL-LURJTMIESA-N 1 2 248.204 2.227 20 0 BEADLO CN(c1cc[nH+]cc1F)[C@H](CO)CC(C)(C)C ZINC000641621067 362552934 /nfs/dbraw/zinc/55/29/34/362552934.db2.gz AUFHDNCJUKSUPK-JTQLQIEISA-N 1 2 240.322 2.454 20 0 BEADLO OCc1cc[nH+]c(NC[C@H]2CCCC2(F)F)c1 ZINC000641618874 362553266 /nfs/dbraw/zinc/55/32/66/362553266.db2.gz LFJIPPGMFMQYGN-SNVBAGLBSA-N 1 2 242.269 2.421 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)Nc1ncncc1C ZINC000641622297 362554442 /nfs/dbraw/zinc/55/44/42/362554442.db2.gz QBCVZBCDBHSUGQ-JTQLQIEISA-N 1 2 231.303 2.175 20 0 BEADLO Cc1cnn([C@@H]2CCN(c3cc[nH+]cc3F)C2)c1 ZINC000641603440 362541138 /nfs/dbraw/zinc/54/11/38/362541138.db2.gz AMSHDHOBHHIYSW-LLVKDONJSA-N 1 2 246.289 2.177 20 0 BEADLO Cc1cnn([C@H]2CCN(c3cc[nH+]cc3F)C2)c1 ZINC000641603441 362541407 /nfs/dbraw/zinc/54/14/07/362541407.db2.gz AMSHDHOBHHIYSW-NSHDSACASA-N 1 2 246.289 2.177 20 0 BEADLO CCc1nc(C)c(CNc2cc[nH+]cc2F)o1 ZINC000641609520 362544053 /nfs/dbraw/zinc/54/40/53/362544053.db2.gz WOKVJYAYMZSJAL-UHFFFAOYSA-N 1 2 235.262 2.114 20 0 BEADLO OCc1ccc(C[NH+]2CC(C(F)(F)F)C2)cc1 ZINC000579554811 345066300 /nfs/dbraw/zinc/06/63/00/345066300.db2.gz ATPGMPWVRUQKIG-UHFFFAOYSA-N 1 2 245.244 2.173 20 0 BEADLO C[C@H](Cc1ccccn1)Nc1cc(CO)cc[nH+]1 ZINC000641655688 362580281 /nfs/dbraw/zinc/58/02/81/362580281.db2.gz VMXJEOIHQBFSHK-LLVKDONJSA-N 1 2 243.310 2.012 20 0 BEADLO Cc1cc(NC(=O)/C=C/C2CC2)cc[nH+]1 ZINC000080220738 345122711 /nfs/dbraw/zinc/12/27/11/345122711.db2.gz VWEPXISXPFZQPD-SNAWJCMRSA-N 1 2 202.257 2.295 20 0 BEADLO CCC(C)(C)OCCNc1cc(CO)cc[nH+]1 ZINC000641628052 362557752 /nfs/dbraw/zinc/55/77/52/362557752.db2.gz XMPIOJMKQBSBEB-UHFFFAOYSA-N 1 2 238.331 2.191 20 0 BEADLO Cc1ccc(CNc2cc(CO)cc[nH+]2)nc1C ZINC000641628631 362559597 /nfs/dbraw/zinc/55/95/97/362559597.db2.gz PFGMEBGAJQISAI-UHFFFAOYSA-N 1 2 243.310 2.198 20 0 BEADLO CO[C@@H]1C[C@H](Nc2cc[nH+]cc2F)C12CCC2 ZINC000641630329 362560219 /nfs/dbraw/zinc/56/02/19/362560219.db2.gz UCPVLIVAYIZJFV-NWDGAFQWSA-N 1 2 236.290 2.012 20 0 BEADLO CC(C)(CNc1cc[nH+]cc1F)OCC1CC1 ZINC000641632429 362562544 /nfs/dbraw/zinc/56/25/44/362562544.db2.gz OBHHBOKTQBFICN-UHFFFAOYSA-N 1 2 238.306 2.260 20 0 BEADLO OCc1cc[nH+]c(N[C@@H]2C[C@H]2c2ccco2)c1 ZINC000641640054 362566413 /nfs/dbraw/zinc/56/64/13/362566413.db2.gz ZQVVSJDNCOZQAL-GHMZBOCLSA-N 1 2 230.267 2.135 20 0 BEADLO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1ccon1 ZINC000634981071 345164592 /nfs/dbraw/zinc/16/45/92/345164592.db2.gz WJRYQAPBJMFKQX-ZANVPECISA-N 1 2 230.267 2.286 20 0 BEADLO F[C@@]1(c2ccccc2)C[C@H]1[NH2+]Cc1ccon1 ZINC000634983966 345167320 /nfs/dbraw/zinc/16/73/20/345167320.db2.gz DBIZXFLQCMZFGY-CHWSQXEVSA-N 1 2 232.258 2.402 20 0 BEADLO COC[C@@H]([NH2+]Cc1ccc(C)nc1)c1ccco1 ZINC000156131748 345126597 /nfs/dbraw/zinc/12/65/97/345126597.db2.gz NVLUTPLNUMMKOB-CYBMUJFWSA-N 1 2 246.310 2.460 20 0 BEADLO CC(C)Oc1ccc(C[NH2+]Cc2ccon2)cn1 ZINC000634952701 345128651 /nfs/dbraw/zinc/12/86/51/345128651.db2.gz GRKBYOQYABPVHQ-UHFFFAOYSA-N 1 2 247.298 2.147 20 0 BEADLO CCCOc1ccc(C[NH2+]Cc2ccon2)cn1 ZINC000634960667 345134556 /nfs/dbraw/zinc/13/45/56/345134556.db2.gz YVIQGSMSFKYCAW-UHFFFAOYSA-N 1 2 247.298 2.148 20 0 BEADLO COc1cc(C)cc(C[NH2+]Cc2ccon2)c1 ZINC000634972997 345151751 /nfs/dbraw/zinc/15/17/51/345151751.db2.gz NCIAHDBEWJGAHU-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO Cc1ccccc1NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635061449 345233562 /nfs/dbraw/zinc/23/35/62/345233562.db2.gz HZJZPWHBWJVXSB-GHMZBOCLSA-N 1 2 241.294 2.460 20 0 BEADLO Cc1ccccc1NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635061449 345233564 /nfs/dbraw/zinc/23/35/64/345233564.db2.gz HZJZPWHBWJVXSB-GHMZBOCLSA-N 1 2 241.294 2.460 20 0 BEADLO C[C@H]1C[C@H](C)CN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635066571 345238600 /nfs/dbraw/zinc/23/86/00/345238600.db2.gz ZQOZRMFFNAZIEL-NNYUYHANSA-N 1 2 247.342 2.018 20 0 BEADLO C[C@H]1C[C@H](C)CN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635066571 345238601 /nfs/dbraw/zinc/23/86/01/345238601.db2.gz ZQOZRMFFNAZIEL-NNYUYHANSA-N 1 2 247.342 2.018 20 0 BEADLO C[C@@H]1CCCC[C@@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635077883 345241979 /nfs/dbraw/zinc/24/19/79/345241979.db2.gz JTAVVZDDTQJRPI-KKOKHZNYSA-N 1 2 247.342 2.208 20 0 BEADLO C[C@@H]1CCCC[C@@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635077883 345241981 /nfs/dbraw/zinc/24/19/81/345241981.db2.gz JTAVVZDDTQJRPI-KKOKHZNYSA-N 1 2 247.342 2.208 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@@H]2CCCC[C@H]2C)[nH+]1 ZINC000635080265 345242140 /nfs/dbraw/zinc/24/21/40/345242140.db2.gz ZMZMLIAHDNSSEB-ZYHUDNBSSA-N 1 2 249.358 2.210 20 0 BEADLO Cc1cc(C)c(C[N@@H+]2CCC[C@H]2C(=O)[O-])c(C)[nH+]1 ZINC000635014714 345219230 /nfs/dbraw/zinc/21/92/30/345219230.db2.gz DXAXTZDBNBKYEY-ZDUSSCGKSA-N 1 2 248.326 2.056 20 0 BEADLO Cc1cc(C)c(C[N@H+]2CCC[C@H]2C(=O)[O-])c(C)[nH+]1 ZINC000635014714 345219233 /nfs/dbraw/zinc/21/92/33/345219233.db2.gz DXAXTZDBNBKYEY-ZDUSSCGKSA-N 1 2 248.326 2.056 20 0 BEADLO CC(C)C[C@@H](C(=O)NC(C)(C)C)n1cc[nH+]c1 ZINC000635201039 345269989 /nfs/dbraw/zinc/26/99/89/345269989.db2.gz KAFAIOHHODYTPV-NSHDSACASA-N 1 2 237.347 2.385 20 0 BEADLO CC(C)C[C@@H](C(=O)NCC1CCC1)n1cc[nH+]c1 ZINC000635268028 345291315 /nfs/dbraw/zinc/29/13/15/345291315.db2.gz WTEUMBSVOQPBGW-ZDUSSCGKSA-N 1 2 249.358 2.387 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CCC[C@@H](CC)C2)[nH+]1 ZINC000635268188 345291386 /nfs/dbraw/zinc/29/13/86/345291386.db2.gz YGQDKIGGYFQAKE-LLVKDONJSA-N 1 2 249.358 2.163 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635281415 345293716 /nfs/dbraw/zinc/29/37/16/345293716.db2.gz ZAXSZCAVZNTPSS-GMTAPVOTSA-N 1 2 235.331 2.160 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635281415 345293717 /nfs/dbraw/zinc/29/37/17/345293717.db2.gz ZAXSZCAVZNTPSS-GMTAPVOTSA-N 1 2 235.331 2.160 20 0 BEADLO CC(C)C[C@H](C(=O)NC[C@H]1C[C@H]1C)n1cc[nH+]c1 ZINC000635300965 345299247 /nfs/dbraw/zinc/29/92/47/345299247.db2.gz QPHCUMHDNUSUOY-JHJVBQTASA-N 1 2 249.358 2.243 20 0 BEADLO CCc1c[nH]c(CC(=O)NC2(C)CCCCC2)[nH+]1 ZINC000635405457 345347847 /nfs/dbraw/zinc/34/78/47/345347847.db2.gz CXUINAWLINESRY-UHFFFAOYSA-N 1 2 249.358 2.354 20 0 BEADLO CC(C)C[C@@H](C(=O)N[C@H]1CC1(C)C)n1cc[nH+]c1 ZINC000635406985 345351119 /nfs/dbraw/zinc/35/11/19/345351119.db2.gz PRRDWCKZVCITMN-RYUDHWBXSA-N 1 2 249.358 2.385 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CCC[C@H]2C(C)C)[nH+]1 ZINC000635426259 345362553 /nfs/dbraw/zinc/36/25/53/345362553.db2.gz YUQCVEFBLTUERM-LBPRGKRZSA-N 1 2 249.358 2.162 20 0 BEADLO CCc1c[nH]c(CC(=O)N2[C@H](C)CCC[C@H]2C)[nH+]1 ZINC000635514031 345407706 /nfs/dbraw/zinc/40/77/06/345407706.db2.gz YTWNSXAKXKYMFV-GHMZBOCLSA-N 1 2 249.358 2.304 20 0 BEADLO Cc1nc(N2C[C@@H](C)CC2(C)C)cc[nH+]1 ZINC000080684391 345430356 /nfs/dbraw/zinc/43/03/56/345430356.db2.gz BEOJCYFSYMIFED-VIFPVBQESA-N 1 2 205.305 2.410 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CCCSCC2)[nH+]1 ZINC000080948549 345454154 /nfs/dbraw/zinc/45/41/54/345454154.db2.gz OMGGDRCPDLCQQU-UHFFFAOYSA-N 1 2 248.355 2.210 20 0 BEADLO Cc1nc2[nH]ccc2c(NCc2nccs2)[nH+]1 ZINC000080948487 345454175 /nfs/dbraw/zinc/45/41/75/345454175.db2.gz DVXXKDZFYQKEMU-UHFFFAOYSA-N 1 2 245.311 2.335 20 0 BEADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1cnccn1 ZINC000080964827 345455099 /nfs/dbraw/zinc/45/50/99/345455099.db2.gz DRHURDZDKFEVOW-NSHDSACASA-N 1 2 228.299 2.065 20 0 BEADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1cnccn1 ZINC000080964827 345455101 /nfs/dbraw/zinc/45/51/01/345455101.db2.gz DRHURDZDKFEVOW-NSHDSACASA-N 1 2 228.299 2.065 20 0 BEADLO CC(C)(C)c1nc(N[C@@H]2CCCC[C@H]2O)cc[nH+]1 ZINC000080787129 345447411 /nfs/dbraw/zinc/44/74/11/345447411.db2.gz HOSBULQEVKFXAO-GHMZBOCLSA-N 1 2 249.358 2.490 20 0 BEADLO CC(C)(C)c1nc(NC[C@H]2CCCO2)cc[nH+]1 ZINC000080761664 345449506 /nfs/dbraw/zinc/44/95/06/345449506.db2.gz ITGFIKRRIUYKEP-SNVBAGLBSA-N 1 2 235.331 2.365 20 0 BEADLO CCC(CC)CNC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635502659 345403106 /nfs/dbraw/zinc/40/31/06/345403106.db2.gz CWELOWZJTAHDRL-GHMZBOCLSA-N 1 2 235.331 2.066 20 0 BEADLO CCC(CC)CNC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635502659 345403109 /nfs/dbraw/zinc/40/31/09/345403109.db2.gz CWELOWZJTAHDRL-GHMZBOCLSA-N 1 2 235.331 2.066 20 0 BEADLO C[C@@]1(CNc2cc[nH+]cc2F)CC1(F)F ZINC000641659661 362585730 /nfs/dbraw/zinc/58/57/30/362585730.db2.gz QJGVPUDVAZQPRZ-VIFPVBQESA-N 1 2 216.206 2.100 20 0 BEADLO OCC[N@@H+]1CCc2cc(Cl)cc(Cl)c2C1 ZINC000084133136 345511305 /nfs/dbraw/zinc/51/13/05/345511305.db2.gz MDXYIDGYRDOGGH-UHFFFAOYSA-N 1 2 246.137 2.344 20 0 BEADLO OCC[N@H+]1CCc2cc(Cl)cc(Cl)c2C1 ZINC000084133136 345511307 /nfs/dbraw/zinc/51/13/07/345511307.db2.gz MDXYIDGYRDOGGH-UHFFFAOYSA-N 1 2 246.137 2.344 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)CC1(O)CCCC1 ZINC000081365436 345471231 /nfs/dbraw/zinc/47/12/31/345471231.db2.gz FSRFFOGNTIJQDJ-UHFFFAOYSA-N 1 2 234.299 2.024 20 0 BEADLO COC(=O)c1ccoc1C[N@@H+]1CCC12CCC2 ZINC000081563847 345478630 /nfs/dbraw/zinc/47/86/30/345478630.db2.gz VXELUBOPQROAPQ-UHFFFAOYSA-N 1 2 235.283 2.195 20 0 BEADLO COC(=O)c1ccoc1C[N@H+]1CCC12CCC2 ZINC000081563847 345478635 /nfs/dbraw/zinc/47/86/35/345478635.db2.gz VXELUBOPQROAPQ-UHFFFAOYSA-N 1 2 235.283 2.195 20 0 BEADLO CC[C@@H](C)[C@H](O)CNc1cc[nH+]c2ccncc12 ZINC000085686786 345529040 /nfs/dbraw/zinc/52/90/40/345529040.db2.gz GTKXLNHWGGEJHP-QMTHXVAHSA-N 1 2 245.326 2.449 20 0 BEADLO CC(C)[C@H](CCO)Nc1cc[nH+]c2ccncc12 ZINC000085688567 345529049 /nfs/dbraw/zinc/52/90/49/345529049.db2.gz APWSPMCNMUSKEC-LBPRGKRZSA-N 1 2 245.326 2.449 20 0 BEADLO CCC[C@@H](O)CNc1cc[nH+]c2ccncc12 ZINC000085686752 345529065 /nfs/dbraw/zinc/52/90/65/345529065.db2.gz JPOPVGGTLXRXLI-SNVBAGLBSA-N 1 2 231.299 2.203 20 0 BEADLO c1cc2[nH+]ccc(N[C@H]3CCCOC3)c2cn1 ZINC000085684759 345529099 /nfs/dbraw/zinc/52/90/99/345529099.db2.gz KPIAANDZPOIUGZ-JTQLQIEISA-N 1 2 229.283 2.221 20 0 BEADLO COC(=O)C1([NH2+]CCSC)CCC(C)CC1 ZINC000089912511 345565449 /nfs/dbraw/zinc/56/54/49/345565449.db2.gz NPOUSGUAQOPPOJ-UHFFFAOYSA-N 1 2 245.388 2.061 20 0 BEADLO C[C@H]([NH2+]Cc1ncccc1F)c1ccccn1 ZINC000090720929 345574700 /nfs/dbraw/zinc/57/47/00/345574700.db2.gz OAWOXZVQUKHNEG-JTQLQIEISA-N 1 2 231.274 2.467 20 0 BEADLO Fc1cccnc1NCCNc1cccc[nH+]1 ZINC000084482891 345513956 /nfs/dbraw/zinc/51/39/56/345513956.db2.gz QFNMHORULUUCEY-UHFFFAOYSA-N 1 2 232.262 2.140 20 0 BEADLO Cc1ccoc1C[N@@H+](C)[C@@H](C)C(=O)OC(C)C ZINC000093773248 345664193 /nfs/dbraw/zinc/66/41/93/345664193.db2.gz GUXZXJCDPSUJFJ-NSHDSACASA-N 1 2 239.315 2.360 20 0 BEADLO Cc1ccoc1C[N@H+](C)[C@@H](C)C(=O)OC(C)C ZINC000093773248 345664196 /nfs/dbraw/zinc/66/41/96/345664196.db2.gz GUXZXJCDPSUJFJ-NSHDSACASA-N 1 2 239.315 2.360 20 0 BEADLO CCn1cc[nH+]c1CNc1c(C)nn(CC)c1C ZINC000092567823 345639488 /nfs/dbraw/zinc/63/94/88/345639488.db2.gz GHUAUWZIYGDOGV-UHFFFAOYSA-N 1 2 247.346 2.348 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2ncnn2C)cc1F ZINC000094955582 178895037 /nfs/dbraw/zinc/89/50/37/178895037.db2.gz JQEALJQJUGMQMP-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO CCOCCN(C)c1cc[nH+]c(C(C)(C)C)n1 ZINC000092963124 345649613 /nfs/dbraw/zinc/64/96/13/345649613.db2.gz GNXQRBVYIKPSJJ-UHFFFAOYSA-N 1 2 237.347 2.247 20 0 BEADLO CCOCCN(C)c1[nH]c2ccccc2[nH+]1 ZINC000092963104 345649844 /nfs/dbraw/zinc/64/98/44/345649844.db2.gz OHIBUKHKGAGIGP-UHFFFAOYSA-N 1 2 219.288 2.036 20 0 BEADLO OCc1cc[nH+]c(NCC[C@@H]2CC=CCC2)c1 ZINC000641678406 362599840 /nfs/dbraw/zinc/59/98/40/362599840.db2.gz OWBOQKGROLXXAS-GFCCVEGCSA-N 1 2 232.327 2.154 20 0 BEADLO CCC[C@@H](CNc1cc[nH+]cc1F)OCC ZINC000641676432 362602496 /nfs/dbraw/zinc/60/24/96/362602496.db2.gz OZVOBSDZZFDLHH-JTQLQIEISA-N 1 2 226.295 2.260 20 0 BEADLO Cc1cc(N[C@@H](C)C(F)F)nc(C2CC2)[nH+]1 ZINC000641729441 362643760 /nfs/dbraw/zinc/64/37/60/362643760.db2.gz BIRWMNLDWAXBOH-ZETCQYMHSA-N 1 2 227.258 2.150 20 0 BEADLO C=Cn1cc(C[NH2+]Cc2csc(C)n2)cn1 ZINC000235936150 537906884 /nfs/dbraw/zinc/90/68/84/537906884.db2.gz UMHOLFHLRMXCPH-UHFFFAOYSA-N 1 2 234.328 2.038 20 0 BEADLO CC(C)[C@H]1CCCN(C(=O)CCn2cc[nH+]c2)C1 ZINC000215609782 345742352 /nfs/dbraw/zinc/74/23/52/345742352.db2.gz GGLWCQXTXKXSIP-ZDUSSCGKSA-N 1 2 249.358 2.168 20 0 BEADLO c1nc2c(s1)C[N@H+](Cc1cccnc1)CC2 ZINC000219595377 345745840 /nfs/dbraw/zinc/74/58/40/345745840.db2.gz DCVQKFAAOFVNJF-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1nc2c(s1)C[N@@H+](Cc1cccnc1)CC2 ZINC000219595377 345745842 /nfs/dbraw/zinc/74/58/42/345745842.db2.gz DCVQKFAAOFVNJF-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO Cc1cc([C@@H]2CCCN2c2cc[nH+]c(C)n2)no1 ZINC000203940897 345732371 /nfs/dbraw/zinc/73/23/71/345732371.db2.gz HZZXUWHGUGMKMJ-LBPRGKRZSA-N 1 2 244.298 2.423 20 0 BEADLO Clc1snnc1C[N@@H+]1CC[C@H](C2CC2)C1 ZINC000307536028 345808465 /nfs/dbraw/zinc/80/84/65/345808465.db2.gz KQXNAZKOUKIWDM-QMMMGPOBSA-N 1 2 243.763 2.423 20 0 BEADLO Clc1snnc1C[N@H+]1CC[C@H](C2CC2)C1 ZINC000307536028 345808468 /nfs/dbraw/zinc/80/84/68/345808468.db2.gz KQXNAZKOUKIWDM-QMMMGPOBSA-N 1 2 243.763 2.423 20 0 BEADLO C[C@@H]1OCC[C@H]1SCc1ccc[nH+]c1N ZINC000300336729 345785135 /nfs/dbraw/zinc/78/51/35/345785135.db2.gz KRLLODBSPHNWLA-WCBMZHEXSA-N 1 2 224.329 2.074 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000668420255 537912356 /nfs/dbraw/zinc/91/23/56/537912356.db2.gz YTIKCFYFMGGFBT-UTUOFQBUSA-N 1 2 230.311 2.187 20 0 BEADLO Cc1cc(C(=O)NCc2[nH]cc[nH+]2)c(C)s1 ZINC000070651447 345794797 /nfs/dbraw/zinc/79/47/97/345794797.db2.gz QYTHZXVWOOBIPU-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO CC(C)n1cccc1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000141037711 345831567 /nfs/dbraw/zinc/83/15/67/345831567.db2.gz UBYGSTVLGFUXLA-SNVBAGLBSA-N 1 2 246.314 2.283 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H]2C[C@H](C)O[C@H]2C)[nH+]1 ZINC000631466777 345920337 /nfs/dbraw/zinc/92/03/37/345920337.db2.gz WVYJZWOWMRGWNH-DKCNOQQISA-N 1 2 246.314 2.244 20 0 BEADLO C[C@H](N(C)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C1(C)CC1 ZINC000635662007 345944254 /nfs/dbraw/zinc/94/42/54/345944254.db2.gz RPZVZNBLUFTXHB-HBNTYKKESA-N 1 2 247.342 2.160 20 0 BEADLO C[C@H](N(C)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C1(C)CC1 ZINC000635662007 345944257 /nfs/dbraw/zinc/94/42/57/345944257.db2.gz RPZVZNBLUFTXHB-HBNTYKKESA-N 1 2 247.342 2.160 20 0 BEADLO CC(C)[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635667265 345973063 /nfs/dbraw/zinc/97/30/63/345973063.db2.gz NQBOEFRDZDJNBX-QJPTWQEYSA-N 1 2 247.342 2.018 20 0 BEADLO CC(C)[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635667265 345973064 /nfs/dbraw/zinc/97/30/64/345973064.db2.gz NQBOEFRDZDJNBX-QJPTWQEYSA-N 1 2 247.342 2.018 20 0 BEADLO CC(C)[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635667264 345973079 /nfs/dbraw/zinc/97/30/79/345973079.db2.gz NQBOEFRDZDJNBX-IJLUTSLNSA-N 1 2 247.342 2.018 20 0 BEADLO CC(C)[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635667264 345973080 /nfs/dbraw/zinc/97/30/80/345973080.db2.gz NQBOEFRDZDJNBX-IJLUTSLNSA-N 1 2 247.342 2.018 20 0 BEADLO COCCCCN(C)c1[nH]c2ccccc2[nH+]1 ZINC000419015419 192093884 /nfs/dbraw/zinc/09/38/84/192093884.db2.gz BUWKMTPDCNUXIB-UHFFFAOYSA-N 1 2 233.315 2.426 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@]2(C)CCC[C@@H]2C)c[nH+]1 ZINC001639097828 1172072563 /nfs/dbraw/zinc/07/25/63/1172072563.db2.gz QNMMKAWHBPZTKY-IINYFYTJSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@]2(C)CCC[C@@H]2C)[nH+]1 ZINC001639097828 1172072571 /nfs/dbraw/zinc/07/25/71/1172072571.db2.gz QNMMKAWHBPZTKY-IINYFYTJSA-N 1 2 249.358 2.415 20 0 BEADLO CC(C)=C(C)CC(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000635714209 346026060 /nfs/dbraw/zinc/02/60/60/346026060.db2.gz AZDPIEZKMLEFPJ-LLVKDONJSA-N 1 2 247.342 2.130 20 0 BEADLO CC(C)=C(C)CC(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000635714209 346026064 /nfs/dbraw/zinc/02/60/64/346026064.db2.gz AZDPIEZKMLEFPJ-LLVKDONJSA-N 1 2 247.342 2.130 20 0 BEADLO CC(C)C[C@H](C(=O)N1[C@H](C)C[C@@H]1C)n1cc[nH+]c1 ZINC000635876002 346096094 /nfs/dbraw/zinc/09/60/94/346096094.db2.gz SLOYKRHAFSLZGX-FRRDWIJNSA-N 1 2 249.358 2.480 20 0 BEADLO CCc1c[nH]c(CC(=O)NC[C@@H]2CC[C@@H](C)C2)[nH+]1 ZINC000635882150 346101114 /nfs/dbraw/zinc/10/11/14/346101114.db2.gz SYAGQEQXKXTJNV-GHMZBOCLSA-N 1 2 249.358 2.067 20 0 BEADLO C[C@H]1CCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635892857 346104174 /nfs/dbraw/zinc/10/41/74/346104174.db2.gz DMEAZWMIQCALAB-IRCOFANPSA-N 1 2 247.342 2.066 20 0 BEADLO C[C@H]1CCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635892857 346104177 /nfs/dbraw/zinc/10/41/77/346104177.db2.gz DMEAZWMIQCALAB-IRCOFANPSA-N 1 2 247.342 2.066 20 0 BEADLO CC(C)=C(C)CC(=O)N[C@@H]1CCc2c[nH+]cn2C1 ZINC000635918692 346109719 /nfs/dbraw/zinc/10/97/19/346109719.db2.gz SKRGHPXBYMXUIM-GFCCVEGCSA-N 1 2 247.342 2.061 20 0 BEADLO Cc1nc(N[C@H]2COCc3ccccc32)cc[nH+]1 ZINC000418999143 192096637 /nfs/dbraw/zinc/09/66/37/192096637.db2.gz QPRCLDKRPYEHRM-ZDUSSCGKSA-N 1 2 241.294 2.468 20 0 BEADLO CC(C)C[C@H](C(=O)N[C@H]1CC[C@@H]1C)n1cc[nH+]c1 ZINC000635926474 346116793 /nfs/dbraw/zinc/11/67/93/346116793.db2.gz SYSDKVRHQGRKKK-RWMBFGLXSA-N 1 2 249.358 2.385 20 0 BEADLO Cc1cn2ccc(C(=O)N3C[C@H](C)[C@@H]3C)cc2[nH+]1 ZINC000635966537 346125547 /nfs/dbraw/zinc/12/55/47/346125547.db2.gz RBUCDNOEHIHTCG-ONGXEEELSA-N 1 2 243.310 2.123 20 0 BEADLO CC(C)C[C@H](C(=O)N1C[C@@H](C)[C@@H]1C)n1cc[nH+]c1 ZINC000635966530 346125893 /nfs/dbraw/zinc/12/58/93/346125893.db2.gz QYPICUVDMXHHSS-FRRDWIJNSA-N 1 2 249.358 2.337 20 0 BEADLO COC[C@H]([NH2+]Cc1cnc(C)o1)c1ccco1 ZINC000628226411 346173034 /nfs/dbraw/zinc/17/30/34/346173034.db2.gz MUXZLLWIKMXDJG-NSHDSACASA-N 1 2 236.271 2.053 20 0 BEADLO CCc1c[nH]c(CC(=O)N2[C@H](C)CCC2(C)C)[nH+]1 ZINC000636011852 346153037 /nfs/dbraw/zinc/15/30/37/346153037.db2.gz NQPWJMGNMJCJHU-SNVBAGLBSA-N 1 2 249.358 2.304 20 0 BEADLO C[C@@H]1CC(C)(C)CN1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636025632 346162249 /nfs/dbraw/zinc/16/22/49/346162249.db2.gz FIIJKDCMVHSOSY-GMTAPVOTSA-N 1 2 247.342 2.160 20 0 BEADLO C[C@@H]1CC(C)(C)CN1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636025632 346162252 /nfs/dbraw/zinc/16/22/52/346162252.db2.gz FIIJKDCMVHSOSY-GMTAPVOTSA-N 1 2 247.342 2.160 20 0 BEADLO Cc1ncc(CNc2ccc[nH+]c2C)o1 ZINC000628229988 346179556 /nfs/dbraw/zinc/17/95/56/346179556.db2.gz ORHWMHMKRXXIMA-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO c1nc(C2CC2)oc1C[NH2+]Cc1ccccn1 ZINC000628231773 346184528 /nfs/dbraw/zinc/18/45/28/346184528.db2.gz AELUTWKUYYERJC-UHFFFAOYSA-N 1 2 229.283 2.237 20 0 BEADLO Cc1c[nH]c(CN(C)[C@@H](C)c2ccccn2)[nH+]1 ZINC000628234490 346187888 /nfs/dbraw/zinc/18/78/88/346187888.db2.gz CIFQTLLDDXKQCL-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO Cc1[nH]c(CN2CC[C@@H](C)[C@H](F)C2)[nH+]c1C ZINC000628234832 346188170 /nfs/dbraw/zinc/18/81/70/346188170.db2.gz OLHFTTZEXFQPAJ-LDYMZIIASA-N 1 2 225.311 2.206 20 0 BEADLO Cc1ncc(C[N@H+]2CC[C@H](C)[C@H](F)C2)o1 ZINC000628235095 346188684 /nfs/dbraw/zinc/18/86/84/346188684.db2.gz YOJCQNBGHOAEFG-GZMMTYOYSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1ncc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)o1 ZINC000628235095 346188685 /nfs/dbraw/zinc/18/86/85/346188685.db2.gz YOJCQNBGHOAEFG-GZMMTYOYSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1c[nH]c(CN(C)[C@@H](C)c2cccnc2)[nH+]1 ZINC000628237379 346193383 /nfs/dbraw/zinc/19/33/83/346193383.db2.gz LLWDDHBANAUNCG-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO Cc1[nH]c(CN(C)Cc2ccccn2)[nH+]c1C ZINC000628238335 346195092 /nfs/dbraw/zinc/19/50/92/346195092.db2.gz URJOVOHGRYMBHQ-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO CCCc1[nH+]c(C)cc(OC)c1C(=O)OC ZINC000419044810 192098913 /nfs/dbraw/zinc/09/89/13/192098913.db2.gz MEZBAOBHSLHGOQ-UHFFFAOYSA-N 1 2 223.272 2.138 20 0 BEADLO CC[C@@H]([NH2+][C@H]1CCCC(F)(F)C1)C(=O)OC ZINC000309505294 347089353 /nfs/dbraw/zinc/08/93/53/347089353.db2.gz BTVHDPNBJUHDKU-DTWKUNHWSA-N 1 2 235.274 2.106 20 0 BEADLO COC(=O)C[N@H+](CCCF)Cc1ccccc1 ZINC000531732033 323112570 /nfs/dbraw/zinc/11/25/70/323112570.db2.gz NIBITVGAQJMREO-UHFFFAOYSA-N 1 2 239.290 2.021 20 0 BEADLO COC(=O)C[N@@H+](CCCF)Cc1ccccc1 ZINC000531732033 323112571 /nfs/dbraw/zinc/11/25/71/323112571.db2.gz NIBITVGAQJMREO-UHFFFAOYSA-N 1 2 239.290 2.021 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)n1 ZINC000628255609 346249290 /nfs/dbraw/zinc/24/92/90/346249290.db2.gz SEWHQYGTIWKAQU-RKDXNWHRSA-N 1 2 247.264 2.491 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)n1 ZINC000628255609 346249292 /nfs/dbraw/zinc/24/92/92/346249292.db2.gz SEWHQYGTIWKAQU-RKDXNWHRSA-N 1 2 247.264 2.491 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CC(C)(C)[C@@H]2[C@@H]2CCCO2)n1 ZINC000628284204 346295980 /nfs/dbraw/zinc/29/59/80/346295980.db2.gz CQSKTCLHSPAGLM-AAEUAGOBSA-N 1 2 249.358 2.108 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CC(C)(C)[C@@H]2[C@@H]2CCCO2)n1 ZINC000628284204 346295983 /nfs/dbraw/zinc/29/59/83/346295983.db2.gz CQSKTCLHSPAGLM-AAEUAGOBSA-N 1 2 249.358 2.108 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CC(C)(C)[C@@H]2[C@H]2CCCO2)n1 ZINC000628284207 346296278 /nfs/dbraw/zinc/29/62/78/346296278.db2.gz CQSKTCLHSPAGLM-YPMHNXCESA-N 1 2 249.358 2.108 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CC(C)(C)[C@@H]2[C@H]2CCCO2)n1 ZINC000628284207 346296280 /nfs/dbraw/zinc/29/62/80/346296280.db2.gz CQSKTCLHSPAGLM-YPMHNXCESA-N 1 2 249.358 2.108 20 0 BEADLO CC[N@H+](Cc1ccccc1Cl)[C@@H](C)C(N)=O ZINC000153590891 346301763 /nfs/dbraw/zinc/30/17/63/346301763.db2.gz DXOLDFAKNBUCKL-VIFPVBQESA-N 1 2 240.734 2.036 20 0 BEADLO CC[N@@H+](Cc1ccccc1Cl)[C@@H](C)C(N)=O ZINC000153590891 346301764 /nfs/dbraw/zinc/30/17/64/346301764.db2.gz DXOLDFAKNBUCKL-VIFPVBQESA-N 1 2 240.734 2.036 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CC[C@@H](C)C[C@H]2C)[nH+]1 ZINC000636056832 346303959 /nfs/dbraw/zinc/30/39/59/346303959.db2.gz AHBJLTMKIIVODM-GHMZBOCLSA-N 1 2 249.358 2.162 20 0 BEADLO Cc1cccc(C)c1C[NH2+][C@@]1(C)CCOC1=O ZINC000289654595 179037273 /nfs/dbraw/zinc/03/72/73/179037273.db2.gz TYBQIAQPCHJGLX-AWEZNQCLSA-N 1 2 233.311 2.099 20 0 BEADLO Cc1ccc(C[N@@H+]2CCOC(C)(C)C2)cn1 ZINC000153768521 346307944 /nfs/dbraw/zinc/30/79/44/346307944.db2.gz KFFYZNWVJZHDAT-UHFFFAOYSA-N 1 2 220.316 2.001 20 0 BEADLO Cc1ccc(C[N@H+]2CCOC(C)(C)C2)cn1 ZINC000153768521 346307946 /nfs/dbraw/zinc/30/79/46/346307946.db2.gz KFFYZNWVJZHDAT-UHFFFAOYSA-N 1 2 220.316 2.001 20 0 BEADLO CCc1cnc(CNc2cc(CO)cc[nH+]2)s1 ZINC000641762150 362686994 /nfs/dbraw/zinc/68/69/94/362686994.db2.gz GVNYVEKGHWJMLH-UHFFFAOYSA-N 1 2 249.339 2.205 20 0 BEADLO CCc1c[nH]c(CC(=O)NCC[C@@H](C)CC)[nH+]1 ZINC000636169058 346344974 /nfs/dbraw/zinc/34/49/74/346344974.db2.gz GXWIWSLIVAEAHB-JTQLQIEISA-N 1 2 237.347 2.067 20 0 BEADLO CC(C)CNC(=O)[C@@H](C)[NH+]1Cc2ccccc2C1 ZINC000155543720 346349917 /nfs/dbraw/zinc/34/99/17/346349917.db2.gz BUSXGBZYJIORKO-GFCCVEGCSA-N 1 2 246.354 2.163 20 0 BEADLO C[C@@H](NC(=O)C1CCC=CCC1)c1[nH+]ccn1C ZINC000636211607 346354635 /nfs/dbraw/zinc/35/46/35/346354635.db2.gz LRVRBMRUOJLTFR-LLVKDONJSA-N 1 2 247.342 2.344 20 0 BEADLO CC[C@H](C)CCNC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636170899 346344398 /nfs/dbraw/zinc/34/43/98/346344398.db2.gz VEMHREGXBGPCNF-HBNTYKKESA-N 1 2 235.331 2.066 20 0 BEADLO CC[C@H](C)CCNC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636170899 346344402 /nfs/dbraw/zinc/34/44/02/346344402.db2.gz VEMHREGXBGPCNF-HBNTYKKESA-N 1 2 235.331 2.066 20 0 BEADLO CCc1nnc(C[N@H+](C)Cc2ccccc2C)[nH]1 ZINC000157462671 346382650 /nfs/dbraw/zinc/38/26/50/346382650.db2.gz WIVKPMUGYPFUJO-UHFFFAOYSA-N 1 2 244.342 2.308 20 0 BEADLO CCc1nnc(C[N@@H+](C)Cc2ccccc2C)[nH]1 ZINC000157462671 346382653 /nfs/dbraw/zinc/38/26/53/346382653.db2.gz WIVKPMUGYPFUJO-UHFFFAOYSA-N 1 2 244.342 2.308 20 0 BEADLO CCN(CC1CCC1)C(=O)C(C)(C)c1c[nH+]c[nH]1 ZINC000621988071 370646944 /nfs/dbraw/zinc/64/69/44/370646944.db2.gz QRBTZOQGFPNZIZ-UHFFFAOYSA-N 1 2 249.358 2.336 20 0 BEADLO Cc1cccc(C[N@@H+](C)[C@@H](C)c2cnccn2)n1 ZINC000341317806 179069671 /nfs/dbraw/zinc/06/96/71/179069671.db2.gz LTADHLKOEIXECE-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cccc(C[N@H+](C)[C@@H](C)c2cnccn2)n1 ZINC000341317806 179069673 /nfs/dbraw/zinc/06/96/73/179069673.db2.gz LTADHLKOEIXECE-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccc(C)n2)nn1C ZINC000336712366 179066718 /nfs/dbraw/zinc/06/67/18/179066718.db2.gz OICZIHFBUQMUTN-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccc(C)n2)nn1C ZINC000336712366 179066719 /nfs/dbraw/zinc/06/67/19/179066719.db2.gz OICZIHFBUQMUTN-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO COc1cc([C@H](C)[NH2+][C@@H](C)C(F)F)ccn1 ZINC000641792468 362727504 /nfs/dbraw/zinc/72/75/04/362727504.db2.gz VUXDNCGOSMFGHM-YUMQZZPRSA-N 1 2 230.258 2.394 20 0 BEADLO Cc1cccc(C[N@@H+]2CCn3cncc3C2)c1 ZINC000291489470 179081635 /nfs/dbraw/zinc/08/16/35/179081635.db2.gz GLRYSQVWINUVSK-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO Cc1cccc(C[N@H+]2CCn3cncc3C2)c1 ZINC000291489470 179081636 /nfs/dbraw/zinc/08/16/36/179081636.db2.gz GLRYSQVWINUVSK-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO Cc1cccc(CN2CCn3c[nH+]cc3C2)c1 ZINC000291489470 179081637 /nfs/dbraw/zinc/08/16/37/179081637.db2.gz GLRYSQVWINUVSK-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO CC(C)n1cc[nH+]c1CN[C@H](C)C(F)F ZINC000641795333 362737199 /nfs/dbraw/zinc/73/71/99/362737199.db2.gz XLTPLHBJFLLXBZ-MRVPVSSYSA-N 1 2 217.263 2.207 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)C(F)F)c1cccc(CO)c1 ZINC000641791597 362731535 /nfs/dbraw/zinc/73/15/35/362731535.db2.gz KXEBQJMKXSDEEX-BDAKNGLRSA-N 1 2 229.270 2.483 20 0 BEADLO Cc1cccn2c(CN[C@@H](C)C(F)F)c[nH+]c12 ZINC000641794236 362733860 /nfs/dbraw/zinc/73/38/60/362733860.db2.gz SXXCXEODJYUBAP-VIFPVBQESA-N 1 2 239.269 2.386 20 0 BEADLO C[C@H]([NH2+]Cc1ccc2[nH]c(=O)[nH]c2c1)C(F)F ZINC000641794266 362733872 /nfs/dbraw/zinc/73/38/72/362733872.db2.gz UPLBDPRVSZTBFS-LURJTMIESA-N 1 2 241.241 2.012 20 0 BEADLO Cc1cccn2c(CN[C@H](C)C(F)F)c[nH+]c12 ZINC000641794235 362733928 /nfs/dbraw/zinc/73/39/28/362733928.db2.gz SXXCXEODJYUBAP-SECBINFHSA-N 1 2 239.269 2.386 20 0 BEADLO C[C@@H]([NH2+]Cc1[nH]nc2ccccc21)C(F)F ZINC000641793333 362735490 /nfs/dbraw/zinc/73/54/90/362735490.db2.gz IZAXVBSAOKATGD-SSDOTTSWSA-N 1 2 225.242 2.306 20 0 BEADLO COCCOc1ccccc1CNc1c[nH]c[nH+]1 ZINC000574968769 346475222 /nfs/dbraw/zinc/47/52/22/346475222.db2.gz WWVUBMKUNAPVIV-UHFFFAOYSA-N 1 2 247.298 2.047 20 0 BEADLO Cc1cccc(C[NH2+][C@H](C)c2ncn(C)n2)c1C ZINC000275749131 179099420 /nfs/dbraw/zinc/09/94/20/179099420.db2.gz CZZGWOXESZOVSY-GFCCVEGCSA-N 1 2 244.342 2.283 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)on1 ZINC000679227230 488322451 /nfs/dbraw/zinc/32/24/51/488322451.db2.gz YENOPGCNZFXNHH-KCJUWKMLSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)on1 ZINC000679227230 488322452 /nfs/dbraw/zinc/32/24/52/488322452.db2.gz YENOPGCNZFXNHH-KCJUWKMLSA-N 1 2 212.268 2.163 20 0 BEADLO CC[C@@H]([NH2+]Cc1nncn1C)c1ccccc1F ZINC000163468078 346561869 /nfs/dbraw/zinc/56/18/69/346561869.db2.gz LFQBNYWTWNZCKP-GFCCVEGCSA-N 1 2 248.305 2.195 20 0 BEADLO Cc1cccc(N(C)C(=O)CCc2[nH]cc[nH+]2)c1 ZINC000279470537 179112137 /nfs/dbraw/zinc/11/21/37/179112137.db2.gz PTDGRSWFMZIXFZ-UHFFFAOYSA-N 1 2 243.310 2.314 20 0 BEADLO Cc1ccc(NC(=O)Cc2c[nH+]cn2C)cc1C ZINC000186743713 346533048 /nfs/dbraw/zinc/53/30/48/346533048.db2.gz XNOMCHNZBHAZHT-UHFFFAOYSA-N 1 2 243.310 2.218 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N(C)C[C@H]1CC1(C)C ZINC000621043580 346585820 /nfs/dbraw/zinc/58/58/20/346585820.db2.gz FANJCYDRCVCDPI-WDEREUQCSA-N 1 2 249.358 2.093 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N(C)C[C@H]1CC1(C)C ZINC000621043580 346585823 /nfs/dbraw/zinc/58/58/23/346585823.db2.gz FANJCYDRCVCDPI-WDEREUQCSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1cccc(NC(=O)CCc2c[nH+]cn2C)c1 ZINC000188388220 179127153 /nfs/dbraw/zinc/12/71/53/179127153.db2.gz ZSOVZZZWRPKKIG-UHFFFAOYSA-N 1 2 243.310 2.300 20 0 BEADLO Cc1cccc(NC(=O)CCc2[nH]cc[nH+]2)c1F ZINC000355774079 179127259 /nfs/dbraw/zinc/12/72/59/179127259.db2.gz FUFRHAFSEDMTAA-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO Cc1cc(CSc2nc(N)cc(C)[nH+]2)ccn1 ZINC000621993086 370648804 /nfs/dbraw/zinc/64/88/04/370648804.db2.gz VILKXUACUNNEJO-UHFFFAOYSA-N 1 2 246.339 2.193 20 0 BEADLO C[C@@H]1CN(c2[nH+]ccc3ccccc32)C[C@H]1O ZINC000387846226 347109633 /nfs/dbraw/zinc/10/96/33/347109633.db2.gz CCMGQNNJWQEPSH-ZWNOBZJWSA-N 1 2 228.295 2.052 20 0 BEADLO CC[N@@H+](Cc1cscn1)C[C@H]1CCCO1 ZINC000171065266 346806658 /nfs/dbraw/zinc/80/66/58/346806658.db2.gz HGIQKJFNSSLGNC-LLVKDONJSA-N 1 2 226.345 2.144 20 0 BEADLO CC[N@H+](Cc1cscn1)C[C@H]1CCCO1 ZINC000171065266 346806661 /nfs/dbraw/zinc/80/66/61/346806661.db2.gz HGIQKJFNSSLGNC-LLVKDONJSA-N 1 2 226.345 2.144 20 0 BEADLO Cc1cccc([C@@H](C)[NH2+][C@H]2CCOC2=O)c1C ZINC000115603295 179183847 /nfs/dbraw/zinc/18/38/47/179183847.db2.gz RLELPJIYXOYHKM-YPMHNXCESA-N 1 2 233.311 2.270 20 0 BEADLO Cc1ncc(C[N@@H+]2C[C@]3(CCCO3)[C@@H]2C2CC2)o1 ZINC000628297120 347244351 /nfs/dbraw/zinc/24/43/51/347244351.db2.gz KMXQKJQYNOLDCR-UONOGXRCSA-N 1 2 248.326 2.126 20 0 BEADLO Cc1ncc(C[N@H+]2C[C@]3(CCCO3)[C@@H]2C2CC2)o1 ZINC000628297120 347244354 /nfs/dbraw/zinc/24/43/54/347244354.db2.gz KMXQKJQYNOLDCR-UONOGXRCSA-N 1 2 248.326 2.126 20 0 BEADLO CC1(C)CC(CC(=O)N2CCc3[nH]c[nH+]c3C2)C1 ZINC000627372857 347271628 /nfs/dbraw/zinc/27/16/28/347271628.db2.gz YLWMKFCNUWNBFU-UHFFFAOYSA-N 1 2 247.342 2.121 20 0 BEADLO CC1(C)CC(CC(=O)N2CCc3[nH+]c[nH]c3C2)C1 ZINC000627372857 347271631 /nfs/dbraw/zinc/27/16/31/347271631.db2.gz YLWMKFCNUWNBFU-UHFFFAOYSA-N 1 2 247.342 2.121 20 0 BEADLO CO[C@@H]([C@H](C)Nc1cccc[nH+]1)C1CC1 ZINC000388268650 347279464 /nfs/dbraw/zinc/27/94/64/347279464.db2.gz GIFLFTNCMGKECM-CABZTGNLSA-N 1 2 206.289 2.307 20 0 BEADLO C/C=C(\CC)C(=O)Nc1c[nH+]ccc1OC ZINC000190595548 347332574 /nfs/dbraw/zinc/33/25/74/347332574.db2.gz BKQIVKKJRVMYSY-RUDMXATFSA-N 1 2 220.272 2.385 20 0 BEADLO Cc1cccc2c1C[N@H+](Cc1nccn1C)CC2 ZINC000277157260 179217149 /nfs/dbraw/zinc/21/71/49/179217149.db2.gz JZZZXOGADHVDQC-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO Cc1cccc2c1C[N@@H+](Cc1nccn1C)CC2 ZINC000277157260 179217152 /nfs/dbraw/zinc/21/71/52/179217152.db2.gz JZZZXOGADHVDQC-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO CC[C@@H]1CCC[C@H](NC(=O)CCc2c[nH+]c[nH]2)C1 ZINC000193329423 347395648 /nfs/dbraw/zinc/39/56/48/347395648.db2.gz QOOTWIFGZBGBHM-NEPJUHHUSA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@@H]1CCC[C@H](NC(=O)CCc2c[nH]c[nH+]2)C1 ZINC000193329423 347395652 /nfs/dbraw/zinc/39/56/52/347395652.db2.gz QOOTWIFGZBGBHM-NEPJUHHUSA-N 1 2 249.358 2.427 20 0 BEADLO CCCC(C)(C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616921057 347450007 /nfs/dbraw/zinc/45/00/07/347450007.db2.gz DJIQLNQERZCJCJ-UHFFFAOYSA-N 1 2 223.320 2.194 20 0 BEADLO CCCC(C)(C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616921057 347450009 /nfs/dbraw/zinc/45/00/09/347450009.db2.gz DJIQLNQERZCJCJ-UHFFFAOYSA-N 1 2 223.320 2.194 20 0 BEADLO C[C@H]1CCCC[C@H]1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616921606 347451766 /nfs/dbraw/zinc/45/17/66/347451766.db2.gz XGMBTBSSKKSOTQ-CMPLNLGQSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@H]1CCCC[C@H]1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616921606 347451770 /nfs/dbraw/zinc/45/17/70/347451770.db2.gz XGMBTBSSKKSOTQ-CMPLNLGQSA-N 1 2 235.331 2.194 20 0 BEADLO CC[C@@H](C)[C@H]([NH2+]Cc1cccs1)C(=O)OC ZINC000035036738 358453262 /nfs/dbraw/zinc/45/32/62/358453262.db2.gz CDJAKAAQQBSCCG-KOLCDFICSA-N 1 2 241.356 2.425 20 0 BEADLO Cc1nc(C[NH2+]Cc2ccncc2)cs1 ZINC000020253305 347436773 /nfs/dbraw/zinc/43/67/73/347436773.db2.gz KWXICQSJRJRPPA-UHFFFAOYSA-N 1 2 219.313 2.136 20 0 BEADLO C[C@H](C(=O)N(C)Cc1c[nH+]c[nH]1)C(C)(C)C ZINC000616925783 347457045 /nfs/dbraw/zinc/45/70/45/347457045.db2.gz QABSQYGNAWYDLV-SECBINFHSA-N 1 2 223.320 2.050 20 0 BEADLO C[C@H](C(=O)N(C)Cc1c[nH]c[nH+]1)C(C)(C)C ZINC000616925783 347457048 /nfs/dbraw/zinc/45/70/48/347457048.db2.gz QABSQYGNAWYDLV-SECBINFHSA-N 1 2 223.320 2.050 20 0 BEADLO CCc1cc(C)c(C(=O)N(C)Cc2c[nH+]c[nH]2)o1 ZINC000616926513 347457907 /nfs/dbraw/zinc/45/79/07/347457907.db2.gz FZIVGYZLOKZKDF-UHFFFAOYSA-N 1 2 247.298 2.146 20 0 BEADLO CCc1cc(C)c(C(=O)N(C)Cc2c[nH]c[nH+]2)o1 ZINC000616926513 347457908 /nfs/dbraw/zinc/45/79/08/347457908.db2.gz FZIVGYZLOKZKDF-UHFFFAOYSA-N 1 2 247.298 2.146 20 0 BEADLO CC[C@@H](C)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000590728994 347497589 /nfs/dbraw/zinc/49/75/89/347497589.db2.gz NXORRQRGTLMKQN-NEPJUHHUSA-N 1 2 235.331 2.093 20 0 BEADLO CCc1nc(C[N@@H+](C)C[C@@H](C)CC)no1 ZINC000111253332 347472949 /nfs/dbraw/zinc/47/29/49/347472949.db2.gz ANPNALBXGQMBAB-VIFPVBQESA-N 1 2 211.309 2.110 20 0 BEADLO CCc1nc(C[N@H+](C)C[C@@H](C)CC)no1 ZINC000111253332 347472952 /nfs/dbraw/zinc/47/29/52/347472952.db2.gz ANPNALBXGQMBAB-VIFPVBQESA-N 1 2 211.309 2.110 20 0 BEADLO CCc1nnc(C[N@@H+]2CC[C@H](SC)C2)s1 ZINC000590749921 347503834 /nfs/dbraw/zinc/50/38/34/347503834.db2.gz DKFLAPWDCDGZHB-QMMMGPOBSA-N 1 2 243.401 2.038 20 0 BEADLO CCc1nnc(C[N@H+]2CC[C@H](SC)C2)s1 ZINC000590749921 347503837 /nfs/dbraw/zinc/50/38/37/347503837.db2.gz DKFLAPWDCDGZHB-QMMMGPOBSA-N 1 2 243.401 2.038 20 0 BEADLO CC(C)(C)C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000196412578 347503974 /nfs/dbraw/zinc/50/39/74/347503974.db2.gz AWLNBAHUFDZRFR-UHFFFAOYSA-N 1 2 235.331 2.162 20 0 BEADLO CC(C)(C)C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000196412578 347503978 /nfs/dbraw/zinc/50/39/78/347503978.db2.gz AWLNBAHUFDZRFR-UHFFFAOYSA-N 1 2 235.331 2.162 20 0 BEADLO COCCCC[N@H+](C)Cc1noc(C(C)C)n1 ZINC000412970484 323149727 /nfs/dbraw/zinc/14/97/27/323149727.db2.gz FAEVMZOOAABAKO-UHFFFAOYSA-N 1 2 241.335 2.051 20 0 BEADLO COCCCC[N@@H+](C)Cc1noc(C(C)C)n1 ZINC000412970484 323149728 /nfs/dbraw/zinc/14/97/28/323149728.db2.gz FAEVMZOOAABAKO-UHFFFAOYSA-N 1 2 241.335 2.051 20 0 BEADLO Cc1ccccc1C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000042511560 179252479 /nfs/dbraw/zinc/25/24/79/179252479.db2.gz LSZHLASKAVYLNR-GFCCVEGCSA-N 1 2 243.310 2.010 20 0 BEADLO C[C@@H](N[C@@H]1CCn2cc[nH+]c21)c1cscn1 ZINC000577231198 365892777 /nfs/dbraw/zinc/89/27/77/365892777.db2.gz FSYPGHWYEWZVQG-RKDXNWHRSA-N 1 2 234.328 2.135 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)CCCn1cc[nH+]c1 ZINC000616981302 347563260 /nfs/dbraw/zinc/56/32/60/347563260.db2.gz YYDGCWKNFPGSCY-GFCCVEGCSA-N 1 2 237.347 2.310 20 0 BEADLO Cc1ccccc1C[N@H+](C)Cc1cnns1 ZINC000296638446 179270110 /nfs/dbraw/zinc/27/01/10/179270110.db2.gz WIIVYOPCTGIJIH-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ccccc1C[N@@H+](C)Cc1cnns1 ZINC000296638446 179270113 /nfs/dbraw/zinc/27/01/13/179270113.db2.gz WIIVYOPCTGIJIH-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO O=C(CCCn1cc[nH+]c1)N1CCC[C@@H]1C1CC1 ZINC000591202712 347630025 /nfs/dbraw/zinc/63/00/25/347630025.db2.gz VUYJPTMGUBTCCQ-CYBMUJFWSA-N 1 2 247.342 2.064 20 0 BEADLO CC[C@H]([NH2+]C1CC(C)C1)C(=O)OC(C)(C)C ZINC000592399965 347777083 /nfs/dbraw/zinc/77/70/83/347777083.db2.gz KPKFIQBHHUWCMC-ILDUYXDCSA-N 1 2 227.348 2.495 20 0 BEADLO CC[C@H](COC)[NH2+][C@@H](CC)C(=O)OC(C)(C)C ZINC000592399942 347777119 /nfs/dbraw/zinc/77/71/19/347777119.db2.gz JNWIWJROWBMBOW-MNOVXSKESA-N 1 2 245.363 2.121 20 0 BEADLO Cc1cc(NC(=O)C2CCCC2)c(C)c[nH+]1 ZINC000535035529 323164154 /nfs/dbraw/zinc/16/41/54/323164154.db2.gz ANTUBIZZTPFAET-UHFFFAOYSA-N 1 2 218.300 2.249 20 0 BEADLO CC[C@@H]([NH2+][C@@H]1C[C@H]1c1ccccc1C)C(=O)OC ZINC000593182138 347868767 /nfs/dbraw/zinc/86/87/67/347868767.db2.gz XVSYEPHNYJADII-BFHYXJOUSA-N 1 2 247.338 2.392 20 0 BEADLO CCc1cc[nH+]cc1NC1CC(CC(=O)OC)C1 ZINC000593680102 347932257 /nfs/dbraw/zinc/93/22/57/347932257.db2.gz OYECXKQNRHCQNX-UHFFFAOYSA-N 1 2 248.326 2.398 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCC1CC(F)(F)C1 ZINC000577410416 365948174 /nfs/dbraw/zinc/94/81/74/365948174.db2.gz AHXNEZUUGLYODL-UHFFFAOYSA-N 1 2 241.285 2.363 20 0 BEADLO Cc1cccn2cc(CSC[C@H](C)O)[nH+]c12 ZINC000298261790 179356827 /nfs/dbraw/zinc/35/68/27/179356827.db2.gz OMLPDXQXIUPCIY-JTQLQIEISA-N 1 2 236.340 2.257 20 0 BEADLO Cc1ccccc1[S@@](=O)Cc1c[nH+]cn1C ZINC000268213683 179351950 /nfs/dbraw/zinc/35/19/50/179351950.db2.gz QZNBMRBJWWVTRF-INIZCTEOSA-N 1 2 234.324 2.036 20 0 BEADLO Cc1c[nH]c(CNc2cccc([S@@](C)=O)c2)[nH+]1 ZINC000594932919 348140687 /nfs/dbraw/zinc/14/06/87/348140687.db2.gz CWDFXINKFBJAGW-QGZVFWFLSA-N 1 2 249.339 2.068 20 0 BEADLO CCOC(=O)C[N@H+](C)[C@@H]1C[C@@H]1c1ccccc1 ZINC000595297428 348215881 /nfs/dbraw/zinc/21/58/81/348215881.db2.gz FSHGPYJZWPRLJK-CHWSQXEVSA-N 1 2 233.311 2.037 20 0 BEADLO CCOC(=O)C[N@@H+](C)[C@@H]1C[C@@H]1c1ccccc1 ZINC000595297428 348215883 /nfs/dbraw/zinc/21/58/83/348215883.db2.gz FSHGPYJZWPRLJK-CHWSQXEVSA-N 1 2 233.311 2.037 20 0 BEADLO Cc1cccnc1C[N@@H+]1CCC=C(F)C1 ZINC000272514926 179373490 /nfs/dbraw/zinc/37/34/90/179373490.db2.gz PEBBPZGKJAHQRC-UHFFFAOYSA-N 1 2 206.264 2.449 20 0 BEADLO Cc1cccnc1C[N@H+]1CCC=C(F)C1 ZINC000272514926 179373496 /nfs/dbraw/zinc/37/34/96/179373496.db2.gz PEBBPZGKJAHQRC-UHFFFAOYSA-N 1 2 206.264 2.449 20 0 BEADLO Cc1ccc[nH+]c1CCCNc1ncc(F)cn1 ZINC000294884004 179368099 /nfs/dbraw/zinc/36/80/99/179368099.db2.gz CGSDOZBPLZEDPW-UHFFFAOYSA-N 1 2 246.289 2.364 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@@H+]1CCCC1CCC1 ZINC000595468329 348258649 /nfs/dbraw/zinc/25/86/49/348258649.db2.gz YHNZLVIJIZYMPH-RYUDHWBXSA-N 1 2 243.322 2.152 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@H+]1CCCC1CCC1 ZINC000595468329 348258650 /nfs/dbraw/zinc/25/86/50/348258650.db2.gz YHNZLVIJIZYMPH-RYUDHWBXSA-N 1 2 243.322 2.152 20 0 BEADLO CCC[C@H]([NH2+]Cc1ncc[nH]1)c1ccccn1 ZINC000595626813 348292922 /nfs/dbraw/zinc/29/29/22/348292922.db2.gz ZFGBYBPIRQRPES-NSHDSACASA-N 1 2 230.315 2.436 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+]1CCc2ccc(C)cc2C1 ZINC000595657490 348298110 /nfs/dbraw/zinc/29/81/10/348298110.db2.gz KRKWRISFVKSHDT-LBPRGKRZSA-N 1 2 247.338 2.305 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+]1CCc2ccc(C)cc2C1 ZINC000595657490 348298111 /nfs/dbraw/zinc/29/81/11/348298111.db2.gz KRKWRISFVKSHDT-LBPRGKRZSA-N 1 2 247.338 2.305 20 0 BEADLO COC(=O)[C@@](C)(CCF)[NH2+]CCCCCF ZINC000595772724 348337297 /nfs/dbraw/zinc/33/72/97/348337297.db2.gz AJOJCHXIIMGWAP-LLVKDONJSA-N 1 2 237.290 2.007 20 0 BEADLO CCSCC[N@H+](C)Cc1nnc(C)s1 ZINC000595886765 348389318 /nfs/dbraw/zinc/38/93/18/348389318.db2.gz YQQOKHQJGJMJGQ-UHFFFAOYSA-N 1 2 231.390 2.031 20 0 BEADLO CCSCC[N@@H+](C)Cc1nnc(C)s1 ZINC000595886765 348389319 /nfs/dbraw/zinc/38/93/19/348389319.db2.gz YQQOKHQJGJMJGQ-UHFFFAOYSA-N 1 2 231.390 2.031 20 0 BEADLO C[C@@H]1C[NH+](CC(=O)OC(C)(C)C)C[C@@H](C)S1 ZINC000075891351 349988408 /nfs/dbraw/zinc/98/84/08/349988408.db2.gz GTMNTJSVDSIQTM-NXEZZACHSA-N 1 2 245.388 2.154 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@@H]2C[C@H]3C[C@H]3C2)c1 ZINC000596280970 348487468 /nfs/dbraw/zinc/48/74/68/348487468.db2.gz GPSWKJNVTYPEMH-ZSBIGDGJSA-N 1 2 246.310 2.008 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N[C@H]2CC2(C)C)c1 ZINC000596087012 348443095 /nfs/dbraw/zinc/44/30/95/348443095.db2.gz HEFKTVBWQXWFCA-JTQLQIEISA-N 1 2 234.299 2.008 20 0 BEADLO CC[C@H]1CCN(c2cc(CC(=O)OC)cc[nH+]2)C1 ZINC000596165911 348460448 /nfs/dbraw/zinc/46/04/48/348460448.db2.gz VCLWQMKUEIHCLY-NSHDSACASA-N 1 2 248.326 2.033 20 0 BEADLO CSCC1(CCNc2cc[nH+]c(C)n2)CC1 ZINC000596430604 348545030 /nfs/dbraw/zinc/54/50/30/348545030.db2.gz VYAFWPMKSRBIMS-UHFFFAOYSA-N 1 2 237.372 2.152 20 0 BEADLO C[S@](=O)[C@H]1CCC[C@@H](Nc2cccc[nH+]2)C1 ZINC000596372862 348514242 /nfs/dbraw/zinc/51/42/42/348514242.db2.gz GUZDSWCDDZCWOO-GDLVEWKHSA-N 1 2 238.356 2.183 20 0 BEADLO COc1cc(C)[nH+]c(CSCC[C@H](C)O)c1 ZINC000596352363 348519641 /nfs/dbraw/zinc/51/96/41/348519641.db2.gz MOVZMIQIOXSSSZ-JTQLQIEISA-N 1 2 241.356 2.403 20 0 BEADLO CSCCc1nc(Cc2c[nH+]ccc2C)no1 ZINC000596616280 348594232 /nfs/dbraw/zinc/59/42/32/348594232.db2.gz GERKKFGVLJHOHX-UHFFFAOYSA-N 1 2 249.339 2.269 20 0 BEADLO CCOC(=O)[C@H](CC)[N@H+](CC)Cc1ccoc1 ZINC000075684156 348571890 /nfs/dbraw/zinc/57/18/90/348571890.db2.gz XVTKMWBLRQJCNT-LBPRGKRZSA-N 1 2 239.315 2.443 20 0 BEADLO CCOC(=O)[C@H](CC)[N@@H+](CC)Cc1ccoc1 ZINC000075684156 348571895 /nfs/dbraw/zinc/57/18/95/348571895.db2.gz XVTKMWBLRQJCNT-LBPRGKRZSA-N 1 2 239.315 2.443 20 0 BEADLO COC(=O)Cc1cc[nH+]c(NCC2=CCCC2)c1 ZINC000596517801 348576165 /nfs/dbraw/zinc/57/61/65/348576165.db2.gz OLAMXLMOFHKDQW-UHFFFAOYSA-N 1 2 246.310 2.319 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NCc1ccccn1 ZINC000120772549 179710705 /nfs/dbraw/zinc/71/07/05/179710705.db2.gz LYODXDQCCCMCMW-UHFFFAOYSA-N 1 2 242.282 2.107 20 0 BEADLO CSCCC(=O)Nc1ccn2cc(C)[nH+]c2c1 ZINC000598469319 348979549 /nfs/dbraw/zinc/97/95/49/348979549.db2.gz QAZKENMLSTXTCH-UHFFFAOYSA-N 1 2 249.339 2.334 20 0 BEADLO CC(C)c1nc(C[N@@H+](C)C[C@@H](C)O)cs1 ZINC000051822100 348984512 /nfs/dbraw/zinc/98/45/12/348984512.db2.gz ZFLZNNGCTULYQZ-SECBINFHSA-N 1 2 228.361 2.079 20 0 BEADLO CC(C)c1nc(C[N@H+](C)C[C@@H](C)O)cs1 ZINC000051822100 348984515 /nfs/dbraw/zinc/98/45/15/348984515.db2.gz ZFLZNNGCTULYQZ-SECBINFHSA-N 1 2 228.361 2.079 20 0 BEADLO CCc1nc(C[N@H+](C)C2CCCC2)no1 ZINC000054316142 323204167 /nfs/dbraw/zinc/20/41/67/323204167.db2.gz YDNYNGTZBWOJSZ-UHFFFAOYSA-N 1 2 209.293 2.006 20 0 BEADLO CCc1nc(C[N@@H+](C)C2CCCC2)no1 ZINC000054316142 323204168 /nfs/dbraw/zinc/20/41/68/323204168.db2.gz YDNYNGTZBWOJSZ-UHFFFAOYSA-N 1 2 209.293 2.006 20 0 BEADLO CC[C@@H](C)CN(C)C(=O)CCCn1cc[nH+]c1 ZINC000599590483 349222011 /nfs/dbraw/zinc/22/20/11/349222011.db2.gz VJLLSORSZZQVBF-GFCCVEGCSA-N 1 2 237.347 2.168 20 0 BEADLO C[C@@H]1CC(F)(F)CC[N@@H+]1CC(=O)OC(C)(C)C ZINC000599621781 349229774 /nfs/dbraw/zinc/22/97/74/349229774.db2.gz FTAIBVXIRQYVHO-SECBINFHSA-N 1 2 249.301 2.448 20 0 BEADLO C[C@@H]1CC(F)(F)CC[N@H+]1CC(=O)OC(C)(C)C ZINC000599621781 349229778 /nfs/dbraw/zinc/22/97/78/349229778.db2.gz FTAIBVXIRQYVHO-SECBINFHSA-N 1 2 249.301 2.448 20 0 BEADLO CCSCC[NH2+]C(C)(C)C(=O)OC(C)(C)C ZINC000599649280 349233685 /nfs/dbraw/zinc/23/36/85/349233685.db2.gz MGMBTHBFEIOZPX-UHFFFAOYSA-N 1 2 247.404 2.449 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@H]2CCCC[C@H]2C)c[nH+]1 ZINC000264864160 179884398 /nfs/dbraw/zinc/88/43/98/179884398.db2.gz PYWSSWJRPBNLGS-MWLCHTKSSA-N 1 2 235.331 2.274 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@H]2CCC[C@H](C)C2)c[nH+]1 ZINC000264827035 179886173 /nfs/dbraw/zinc/88/61/73/179886173.db2.gz IGIMELSKVOALJF-ONGXEEELSA-N 1 2 235.331 2.274 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H]2CCCCC2(C)C)c[nH+]1 ZINC000268133010 179889906 /nfs/dbraw/zinc/88/99/06/179889906.db2.gz BUYBXDHGODFYCX-NSHDSACASA-N 1 2 235.331 2.417 20 0 BEADLO Cc1nc(C)c(COCc2[nH]cc[nH+]2)s1 ZINC000272105341 179914303 /nfs/dbraw/zinc/91/43/03/179914303.db2.gz XQMITCZMFNRPOV-UHFFFAOYSA-N 1 2 223.301 2.200 20 0 BEADLO O=[S@@](Cc1cn2ccccc2[nH+]1)CC1CCC1 ZINC000601913667 349378680 /nfs/dbraw/zinc/37/86/80/349378680.db2.gz SZBOLAFUPVKDPF-QGZVFWFLSA-N 1 2 248.351 2.383 20 0 BEADLO CC[C@@H](C)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000603784900 350032679 /nfs/dbraw/zinc/03/26/79/350032679.db2.gz BKOLTMKHWGVKOZ-SECBINFHSA-N 1 2 217.272 2.319 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)c1cscn1 ZINC000603785617 350032913 /nfs/dbraw/zinc/03/29/13/350032913.db2.gz GKKOMFFBVUDQPD-UHFFFAOYSA-N 1 2 244.279 2.043 20 0 BEADLO CCc1nnc(C[N@@H+]2CC[C@H]2c2ccccc2)[nH]1 ZINC000354856422 349410961 /nfs/dbraw/zinc/41/09/61/349410961.db2.gz RNJNGRCOWZQYOZ-LBPRGKRZSA-N 1 2 242.326 2.314 20 0 BEADLO CCc1nnc(C[N@H+]2CC[C@H]2c2ccccc2)[nH]1 ZINC000354856422 349410967 /nfs/dbraw/zinc/41/09/67/349410967.db2.gz RNJNGRCOWZQYOZ-LBPRGKRZSA-N 1 2 242.326 2.314 20 0 BEADLO CCc1nnc(C[N@@H+]2CC[C@@H]2c2ccccc2)[nH]1 ZINC000354856417 349416084 /nfs/dbraw/zinc/41/60/84/349416084.db2.gz RNJNGRCOWZQYOZ-GFCCVEGCSA-N 1 2 242.326 2.314 20 0 BEADLO CCc1nnc(C[N@H+]2CC[C@@H]2c2ccccc2)[nH]1 ZINC000354856417 349416087 /nfs/dbraw/zinc/41/60/87/349416087.db2.gz RNJNGRCOWZQYOZ-GFCCVEGCSA-N 1 2 242.326 2.314 20 0 BEADLO O=C(CC(F)(F)F)Nc1ccc2[nH+]ccn2c1 ZINC000603881804 350047726 /nfs/dbraw/zinc/04/77/26/350047726.db2.gz NYYPMESSRKTYBI-UHFFFAOYSA-N 1 2 243.188 2.225 20 0 BEADLO O=C(CCC1CC1)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000604326312 350102813 /nfs/dbraw/zinc/10/28/13/350102813.db2.gz QMNYTSDEHRYSHX-CYBMUJFWSA-N 1 2 247.342 2.237 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CC[C@@H](C)C2)[nH+]1 ZINC000336483041 180003803 /nfs/dbraw/zinc/00/38/03/180003803.db2.gz DKBBGKWBFUKXGZ-MRVPVSSYSA-N 1 2 216.288 2.113 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CC[C@@](C)(F)C2)[nH+]1 ZINC000336326293 180003923 /nfs/dbraw/zinc/00/39/23/180003923.db2.gz CAGDPFFIAJBQKB-GFCCVEGCSA-N 1 2 234.278 2.205 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H]2C[C@H]3C[C@H]3C2)[nH+]1 ZINC000333428096 180025691 /nfs/dbraw/zinc/02/56/91/180025691.db2.gz KMPFOIXAPVDWLN-ILWJIGKKSA-N 1 2 228.299 2.477 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@H]2CCO[C@@H](C)C2)[nH+]1 ZINC000354705701 180025736 /nfs/dbraw/zinc/02/57/36/180025736.db2.gz AQHYVXHGXFDKPP-WPRPVWTQSA-N 1 2 246.314 2.246 20 0 BEADLO Cc1nc(SCCCn2cc[nH+]c2)[nH]c1C ZINC000292762441 180031097 /nfs/dbraw/zinc/03/10/97/180031097.db2.gz WTELCZMTOZXJOW-UHFFFAOYSA-N 1 2 236.344 2.405 20 0 BEADLO Cc1nc([C@@H](C)[NH+]2CCC(C)CC2)no1 ZINC000336419032 180032820 /nfs/dbraw/zinc/03/28/20/180032820.db2.gz VROQUEVFNQEJQW-SECBINFHSA-N 1 2 209.293 2.171 20 0 BEADLO Cc1nc([C@@H](C)[N@H+](C)CCc2ccncc2)no1 ZINC000278625631 180033171 /nfs/dbraw/zinc/03/31/71/180033171.db2.gz NQTZSNZDLOAZHB-SNVBAGLBSA-N 1 2 246.314 2.009 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+](C)CCc2ccncc2)no1 ZINC000278625631 180033172 /nfs/dbraw/zinc/03/31/72/180033172.db2.gz NQTZSNZDLOAZHB-SNVBAGLBSA-N 1 2 246.314 2.009 20 0 BEADLO Cc1nc([C@@H]2CCCC[N@@H+]2CCCF)no1 ZINC000363784233 180041509 /nfs/dbraw/zinc/04/15/09/180041509.db2.gz APYIYPRYBXGREV-JTQLQIEISA-N 1 2 227.283 2.265 20 0 BEADLO Cc1nc([C@@H]2CCCC[N@H+]2CCCF)no1 ZINC000363784233 180041512 /nfs/dbraw/zinc/04/15/12/180041512.db2.gz APYIYPRYBXGREV-JTQLQIEISA-N 1 2 227.283 2.265 20 0 BEADLO Cc1nc([C@H](C)[NH+]2CCC(C(F)F)CC2)no1 ZINC000336347880 180047575 /nfs/dbraw/zinc/04/75/75/180047575.db2.gz NBQIUDMAWZUUGW-ZETCQYMHSA-N 1 2 245.273 2.416 20 0 BEADLO Cc1nc([C@H](C)[NH+]2CCC(C)CC2)no1 ZINC000336419033 180047768 /nfs/dbraw/zinc/04/77/68/180047768.db2.gz VROQUEVFNQEJQW-VIFPVBQESA-N 1 2 209.293 2.171 20 0 BEADLO Cc1nc([C@H](C)[NH2+]Cc2cc[nH]n2)cs1 ZINC000041015143 180048974 /nfs/dbraw/zinc/04/89/74/180048974.db2.gz JAHPSSDFOAOAQM-ZETCQYMHSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1nc2[nH]ccc2c(NCCC2(C)CC2)[nH+]1 ZINC000359852908 180060515 /nfs/dbraw/zinc/06/05/15/180060515.db2.gz ZRXFWFSFRUGKJA-UHFFFAOYSA-N 1 2 230.315 2.290 20 0 BEADLO Cc1nc2c(cccc2OCc2c[nH+]cn2C)o1 ZINC000340594208 180066350 /nfs/dbraw/zinc/06/63/50/180066350.db2.gz DZXHDHOLAYXPGO-UHFFFAOYSA-N 1 2 243.266 2.449 20 0 BEADLO Cc1[nH]c2ccc(NC(=O)c3ccon3)cc2[nH+]1 ZINC000352534344 180095511 /nfs/dbraw/zinc/09/55/11/180095511.db2.gz FPSXJBROMXAXGB-UHFFFAOYSA-N 1 2 242.238 2.112 20 0 BEADLO Cc1nc(N[C@H](C)[C@H](C)CO)c2c([nH+]1)CCCC2 ZINC000272822232 180070450 /nfs/dbraw/zinc/07/04/50/180070450.db2.gz FJPQYYJRNXWPEQ-NXEZZACHSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1nc(N[C@@H]2CCCOC2)c2c([nH+]1)CCCC2 ZINC000272924377 180070892 /nfs/dbraw/zinc/07/08/92/180070892.db2.gz UIKXSWVQPYQXQT-LLVKDONJSA-N 1 2 247.342 2.255 20 0 BEADLO CC(C)Cn1cc[nH+]c1CNC(=O)C1(C)CCC1 ZINC000426935000 191048878 /nfs/dbraw/zinc/04/88/78/191048878.db2.gz AQGFOZNTIKBPMS-UHFFFAOYSA-N 1 2 249.358 2.346 20 0 BEADLO COC(=O)C1([NH2+]CC=C(C)C)CCCC1 ZINC000133755990 191042369 /nfs/dbraw/zinc/04/23/69/191042369.db2.gz NIGUGFIRRSKLIM-UHFFFAOYSA-N 1 2 211.305 2.028 20 0 BEADLO Cc1[nH]c(C(=O)NCC2CCCCCC2)c[nH+]1 ZINC000331608686 180130612 /nfs/dbraw/zinc/13/06/12/180130612.db2.gz VQEPGMMEYDIKFT-UHFFFAOYSA-N 1 2 235.331 2.418 20 0 BEADLO Cc1ncc(C[N@@H+](C)[C@H](C)c2cnccn2)s1 ZINC000184454496 180140267 /nfs/dbraw/zinc/14/02/67/180140267.db2.gz DHNZTFWSILUKHT-SECBINFHSA-N 1 2 248.355 2.435 20 0 BEADLO Cc1ncc(C[N@H+](C)[C@H](C)c2cnccn2)s1 ZINC000184454496 180140268 /nfs/dbraw/zinc/14/02/68/180140268.db2.gz DHNZTFWSILUKHT-SECBINFHSA-N 1 2 248.355 2.435 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H](C)c1ccsc1 ZINC000359514121 180118481 /nfs/dbraw/zinc/11/84/81/180118481.db2.gz GVMKUFWMWFBACW-QMMMGPOBSA-N 1 2 249.339 2.200 20 0 BEADLO Cc1[nH+]cc(-c2cccc(O)c2)cc1N ZINC000035570496 180122530 /nfs/dbraw/zinc/12/25/30/180122530.db2.gz AAZVBWFRIKZWFH-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO C[C@@H]([NH2+][C@H]1COc2ccc(F)cc21)c1ncc[nH]1 ZINC000334358118 538066373 /nfs/dbraw/zinc/06/63/73/538066373.db2.gz RVRSPDJAPWSDGR-KCJUWKMLSA-N 1 2 247.273 2.333 20 0 BEADLO C[C@@H](N[C@H]1COc2ccc(F)cc21)c1[nH]cc[nH+]1 ZINC000334358118 538066380 /nfs/dbraw/zinc/06/63/80/538066380.db2.gz RVRSPDJAPWSDGR-KCJUWKMLSA-N 1 2 247.273 2.333 20 0 BEADLO Cc1ncc(C[NH2+][C@@H](C)c2ncc[nH]2)s1 ZINC000124659585 180154797 /nfs/dbraw/zinc/15/47/97/180154797.db2.gz OIWPLRJXWWIRJB-ZETCQYMHSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1ncc([C@H](C)[NH2+]Cc2nccs2)c(C)n1 ZINC000128157248 180174342 /nfs/dbraw/zinc/17/43/42/180174342.db2.gz APYDVOCFDAAYDN-QMMMGPOBSA-N 1 2 248.355 2.401 20 0 BEADLO Cc1ncc(C[N@H+]2C[C@@H](C)OC[C@@H]2C)s1 ZINC000098132589 180146685 /nfs/dbraw/zinc/14/66/85/180146685.db2.gz SVBKLHFXSGFWPN-DTWKUNHWSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ncc(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)s1 ZINC000098132589 180146687 /nfs/dbraw/zinc/14/66/87/180146687.db2.gz SVBKLHFXSGFWPN-DTWKUNHWSA-N 1 2 226.345 2.061 20 0 BEADLO Fc1cccc(F)c1C[N@@H+]1CCCOCC1 ZINC000334406208 538069269 /nfs/dbraw/zinc/06/92/69/538069269.db2.gz JUGJEYSOSKAAOO-UHFFFAOYSA-N 1 2 227.254 2.187 20 0 BEADLO Fc1cccc(F)c1C[N@H+]1CCCOCC1 ZINC000334406208 538069282 /nfs/dbraw/zinc/06/92/82/538069282.db2.gz JUGJEYSOSKAAOO-UHFFFAOYSA-N 1 2 227.254 2.187 20 0 BEADLO Cc1nc(N2CC[C@@H](C3CCOCC3)C2)cc[nH+]1 ZINC000371370699 180194192 /nfs/dbraw/zinc/19/41/92/180194192.db2.gz OVARUMSWJMDYOT-CYBMUJFWSA-N 1 2 247.342 2.038 20 0 BEADLO Cc1nc(N2CC[C@@H](OCC(C)C)C2)cc[nH+]1 ZINC000133326869 180194842 /nfs/dbraw/zinc/19/48/42/180194842.db2.gz YKKXGGNIUIZRIP-GFCCVEGCSA-N 1 2 235.331 2.036 20 0 BEADLO Cc1nc(NCC2(C)CCOCC2)cc[nH+]1 ZINC000227825083 180198459 /nfs/dbraw/zinc/19/84/59/180198459.db2.gz ARKSVUCULSHTBZ-UHFFFAOYSA-N 1 2 221.304 2.014 20 0 BEADLO Cc1nc(NCCCOCC2CC2)cc[nH+]1 ZINC000229943357 180198938 /nfs/dbraw/zinc/19/89/38/180198938.db2.gz JGBQHYRKEIDFSP-UHFFFAOYSA-N 1 2 221.304 2.014 20 0 BEADLO Cc1noc(C)c1CCNc1cc[nH+]c(C)n1 ZINC000266461049 180201290 /nfs/dbraw/zinc/20/12/90/180201290.db2.gz YPRIVOGTDVMEBY-UHFFFAOYSA-N 1 2 232.287 2.044 20 0 BEADLO Cc1nc(NCC[C@H]2CCCCO2)cc[nH+]1 ZINC000227315787 180201517 /nfs/dbraw/zinc/20/15/17/180201517.db2.gz GEBIBLOBAHZZTF-LLVKDONJSA-N 1 2 221.304 2.156 20 0 BEADLO Cc1nc(N[C@@H](C)C[C@H]2CCCO2)cc[nH+]1 ZINC000309761117 180201946 /nfs/dbraw/zinc/20/19/46/180201946.db2.gz MOZNSBFOTDJNLX-GXSJLCMTSA-N 1 2 221.304 2.155 20 0 BEADLO Cc1nc(N[C@@H](CO)c2cccc(F)c2)cc[nH+]1 ZINC000361034872 180201991 /nfs/dbraw/zinc/20/19/91/180201991.db2.gz XUXGKUQETNZOPX-LBPRGKRZSA-N 1 2 247.273 2.070 20 0 BEADLO Cc1nc(N[C@@H]2CCCSC2)cc[nH+]1 ZINC000129210605 180202863 /nfs/dbraw/zinc/20/28/63/180202863.db2.gz QBIIVXLVOQNUIV-SECBINFHSA-N 1 2 209.318 2.093 20 0 BEADLO Cc1nc(CNc2cc[nH+]c(C)n2)cs1 ZINC000054936123 180203467 /nfs/dbraw/zinc/20/34/67/180203467.db2.gz JAAPSRUASHPLKX-UHFFFAOYSA-N 1 2 220.301 2.162 20 0 BEADLO Cc1nc(N[C@@H](CO)c2ccc(F)cc2)cc[nH+]1 ZINC000361026615 180203729 /nfs/dbraw/zinc/20/37/29/180203729.db2.gz SSPONWSVVYFGGK-LBPRGKRZSA-N 1 2 247.273 2.070 20 0 BEADLO Cc1nc(N[C@H]2CCCc3nn(C)cc32)cc[nH+]1 ZINC000374587608 180204811 /nfs/dbraw/zinc/20/48/11/180204811.db2.gz XEQNCEDASQTBAT-NSHDSACASA-N 1 2 243.314 2.008 20 0 BEADLO Cc1nc(N[C@H]2CCCc3c2cnn3C)cc[nH+]1 ZINC000266106604 180204998 /nfs/dbraw/zinc/20/49/98/180204998.db2.gz IZKVONWKPIQDJH-NSHDSACASA-N 1 2 243.314 2.008 20 0 BEADLO Cc1nc(N[C@H](C)c2cccnc2)cc[nH+]1 ZINC000054935830 180205304 /nfs/dbraw/zinc/20/53/04/180205304.db2.gz IYBMTMNPNDFWDE-SECBINFHSA-N 1 2 214.272 2.353 20 0 BEADLO Cc1nc(N[C@H]2CCC[C@@H]2OC(F)F)cc[nH+]1 ZINC000336919286 180205423 /nfs/dbraw/zinc/20/54/23/180205423.db2.gz PXCLJMGNZHPWTK-IUCAKERBSA-N 1 2 243.257 2.357 20 0 BEADLO Cc1[nH+]cccc1N[C@@H](C)CCn1cccn1 ZINC000159329309 180226209 /nfs/dbraw/zinc/22/62/09/180226209.db2.gz IWYKMXXAZYVWBI-NSHDSACASA-N 1 2 230.315 2.477 20 0 BEADLO Cc1cnc([C@@H](C)SCCn2cc[nH+]c2)cn1 ZINC000427682221 191087698 /nfs/dbraw/zinc/08/76/98/191087698.db2.gz ICPGSLJMNJMWDM-LLVKDONJSA-N 1 2 248.355 2.476 20 0 BEADLO Cc1cnc([C@H](C)SCCn2cc[nH+]c2)cn1 ZINC000427682222 191087735 /nfs/dbraw/zinc/08/77/35/191087735.db2.gz ICPGSLJMNJMWDM-NSHDSACASA-N 1 2 248.355 2.476 20 0 BEADLO CCOc1nnc(C[NH+]2CCCCCC2)s1 ZINC000049982609 350273108 /nfs/dbraw/zinc/27/31/08/350273108.db2.gz JYZHAYJPHLPGRR-UHFFFAOYSA-N 1 2 241.360 2.313 20 0 BEADLO CCO[C@H](C(=O)Nc1c(C)cc[nH+]c1C)C1CC1 ZINC000637241761 350339579 /nfs/dbraw/zinc/33/95/79/350339579.db2.gz AOKSLXPYTLTJGX-ZDUSSCGKSA-N 1 2 248.326 2.452 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1C[C@@H](C)O[C@@H]1C ZINC000637243781 350342128 /nfs/dbraw/zinc/34/21/28/350342128.db2.gz WYWUFQKXORRAKR-YUSALJHKSA-N 1 2 248.326 2.450 20 0 BEADLO Cc1ncsc1C[N@@H+]1CCOCC1(C)C ZINC000179557021 180317120 /nfs/dbraw/zinc/31/71/20/180317120.db2.gz NGJMFRZVVRDQEJ-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1ncsc1C[N@H+]1CCOCC1(C)C ZINC000179557021 180317121 /nfs/dbraw/zinc/31/71/21/180317121.db2.gz NGJMFRZVVRDQEJ-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO CCc1cc(NCCc2ccc(O)cc2)nc[nH+]1 ZINC000040765252 350395564 /nfs/dbraw/zinc/39/55/64/350395564.db2.gz SPMUMBXTAUKETB-UHFFFAOYSA-N 1 2 243.310 2.399 20 0 BEADLO Cc1ncsc1C[NH2+]Cc1nccs1 ZINC000082433042 180322310 /nfs/dbraw/zinc/32/23/10/180322310.db2.gz UEYMXUVSKQOOOY-UHFFFAOYSA-N 1 2 225.342 2.198 20 0 BEADLO FC1CC2(C1)C[NH+](Cc1cnc(C3CC3)o1)C2 ZINC000628307033 350439450 /nfs/dbraw/zinc/43/94/50/350439450.db2.gz JXDOCGNKHJASGD-UHFFFAOYSA-N 1 2 236.290 2.486 20 0 BEADLO Cc1cc(C[N@H+](C)CCC(F)(F)F)ncn1 ZINC000428224908 191104100 /nfs/dbraw/zinc/10/41/00/191104100.db2.gz DLOZMKLHPUDHID-UHFFFAOYSA-N 1 2 233.237 2.169 20 0 BEADLO Cc1cc(C[N@@H+](C)CCC(F)(F)F)ncn1 ZINC000428224908 191104101 /nfs/dbraw/zinc/10/41/01/191104101.db2.gz DLOZMKLHPUDHID-UHFFFAOYSA-N 1 2 233.237 2.169 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCC1(C)C)C(=O)OC(C)(C)C ZINC000309304428 323341291 /nfs/dbraw/zinc/34/12/91/323341291.db2.gz MUCLJXACQWOCJU-VHSXEESVSA-N 1 2 227.348 2.495 20 0 BEADLO CC[N@H+](Cc1csc(C)n1)[C@@H]1CCOC1 ZINC000336702595 350457981 /nfs/dbraw/zinc/45/79/81/350457981.db2.gz QABVACXBGGYPDI-LLVKDONJSA-N 1 2 226.345 2.062 20 0 BEADLO CC[N@@H+](Cc1csc(C)n1)[C@@H]1CCOC1 ZINC000336702595 350457985 /nfs/dbraw/zinc/45/79/85/350457985.db2.gz QABVACXBGGYPDI-LLVKDONJSA-N 1 2 226.345 2.062 20 0 BEADLO CCc1nc(C)c(C[N@H+]2CCOC[C@@H]2CC)o1 ZINC000428225079 191104450 /nfs/dbraw/zinc/10/44/50/191104450.db2.gz MRDGXPASKHWRSL-NSHDSACASA-N 1 2 238.331 2.156 20 0 BEADLO CCc1nc(C)c(C[N@@H+]2CCOC[C@@H]2CC)o1 ZINC000428225079 191104451 /nfs/dbraw/zinc/10/44/51/191104451.db2.gz MRDGXPASKHWRSL-NSHDSACASA-N 1 2 238.331 2.156 20 0 BEADLO Cc1ncc(C[NH2+][C@@H](C)c2nccn2C)s1 ZINC000070007960 350491315 /nfs/dbraw/zinc/49/13/15/350491315.db2.gz QAEYHOMOIVSCMW-QMMMGPOBSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1nn(C)cc1CNc1ccc([NH+](C)C)cc1 ZINC000126074780 180375249 /nfs/dbraw/zinc/37/52/49/180375249.db2.gz BCNZXGJUGCNGKW-UHFFFAOYSA-N 1 2 244.342 2.407 20 0 BEADLO Cc1nn(C)cc1[C@@H](C)[NH2+]Cc1nccs1 ZINC000082432821 180379472 /nfs/dbraw/zinc/37/94/72/180379472.db2.gz IISVDRAMMYGUMK-MRVPVSSYSA-N 1 2 236.344 2.036 20 0 BEADLO CC(C)(C)[C@H]1C[C@@H]([NH2+]Cc2ccn[nH]2)CS1 ZINC000309397260 323372444 /nfs/dbraw/zinc/37/24/44/323372444.db2.gz VQFJPWHTDPOBLO-GHMZBOCLSA-N 1 2 239.388 2.420 20 0 BEADLO CCCC[N@@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000606899900 350626161 /nfs/dbraw/zinc/62/61/61/350626161.db2.gz HBZKHVFHERMUKV-QMMMGPOBSA-N 1 2 211.227 2.050 20 0 BEADLO CCCC[N@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000606899900 350626162 /nfs/dbraw/zinc/62/61/62/350626162.db2.gz HBZKHVFHERMUKV-QMMMGPOBSA-N 1 2 211.227 2.050 20 0 BEADLO Cc1csc(C[NH2+]Cc2cnc(C)o2)n1 ZINC000397979620 362976274 /nfs/dbraw/zinc/97/62/74/362976274.db2.gz GZOPILNBASNIAG-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO Cc1nocc1C[NH2+]Cc1ccc(Cl)cn1 ZINC000293270349 180508240 /nfs/dbraw/zinc/50/82/40/180508240.db2.gz NIUULLUGXPUYSV-UHFFFAOYSA-N 1 2 237.690 2.321 20 0 BEADLO CCn1ccc(C[NH2+]Cc2cnc(C3CC3)o2)n1 ZINC000628310302 350789359 /nfs/dbraw/zinc/78/93/59/350789359.db2.gz XFEOHJVLKJZTGW-UHFFFAOYSA-N 1 2 246.314 2.058 20 0 BEADLO C[C@@H](c1nc(C2CC2)no1)[NH+]1CCSCC1 ZINC000051914901 350870462 /nfs/dbraw/zinc/87/04/62/350870462.db2.gz AGHBUZXIPHVXGI-QMMMGPOBSA-N 1 2 239.344 2.057 20 0 BEADLO Cc1nocc1C[NH2+]Cc1ccc(C#N)cc1F ZINC000397860350 350979922 /nfs/dbraw/zinc/97/99/22/350979922.db2.gz DAFNNHXDVYJYKX-UHFFFAOYSA-N 1 2 245.257 2.284 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CS[C@@H](C)C1 ZINC000397901968 350988515 /nfs/dbraw/zinc/98/85/15/350988515.db2.gz VMMXAJXVWHXDTA-IUCAKERBSA-N 1 2 224.329 2.396 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CS[C@@H](C)C1 ZINC000397901966 350988546 /nfs/dbraw/zinc/98/85/46/350988546.db2.gz VMMXAJXVWHXDTA-DTWKUNHWSA-N 1 2 224.329 2.396 20 0 BEADLO CC[C@H](C)CN(C)c1cc(-n2cc[nH+]c2)ncn1 ZINC000607145698 350944240 /nfs/dbraw/zinc/94/42/40/350944240.db2.gz SZDKSVTVAZGTMT-NSHDSACASA-N 1 2 245.330 2.145 20 0 BEADLO C[C@H]([NH2+]Cc1csnn1)c1cccc(C#N)c1 ZINC000398364914 351123262 /nfs/dbraw/zinc/12/32/62/351123262.db2.gz NHBWIWDJAAOEFC-VIFPVBQESA-N 1 2 244.323 2.261 20 0 BEADLO C[C@H]1CCC[N@H+](Cc2ncc(Cl)n2C)C1 ZINC000052867256 351074652 /nfs/dbraw/zinc/07/46/52/351074652.db2.gz UHQMOHHGLFBTLN-VIFPVBQESA-N 1 2 227.739 2.305 20 0 BEADLO C[C@H]1CCC[N@@H+](Cc2ncc(Cl)n2C)C1 ZINC000052867256 351074657 /nfs/dbraw/zinc/07/46/57/351074657.db2.gz UHQMOHHGLFBTLN-VIFPVBQESA-N 1 2 227.739 2.305 20 0 BEADLO CC(C)C[C@@H]1CCC[C@H]([NH2+]Cc2c[nH]nn2)C1 ZINC000398423247 351150370 /nfs/dbraw/zinc/15/03/70/351150370.db2.gz ZODKSRLTJASWCL-RYUDHWBXSA-N 1 2 236.363 2.499 20 0 BEADLO CC(C)C[C@@H]1CCC[C@H]([NH2+]Cc2cn[nH]n2)C1 ZINC000398423247 351150372 /nfs/dbraw/zinc/15/03/72/351150372.db2.gz ZODKSRLTJASWCL-RYUDHWBXSA-N 1 2 236.363 2.499 20 0 BEADLO Cc1c[nH]c(CN2CC(C)(CC(F)F)C2)[nH+]1 ZINC000628321767 351188321 /nfs/dbraw/zinc/18/83/21/351188321.db2.gz BGKADCXUZSXKDG-UHFFFAOYSA-N 1 2 229.274 2.195 20 0 BEADLO CC[C@@H]1CCC[C@H](C[NH2+]Cc2c[nH]nn2)C1 ZINC000398388076 351128327 /nfs/dbraw/zinc/12/83/27/351128327.db2.gz JMAXQJFXERURNL-MNOVXSKESA-N 1 2 222.336 2.111 20 0 BEADLO CC[C@@H]1CCC[C@H](C[NH2+]Cc2cn[nH]n2)C1 ZINC000398388076 351128330 /nfs/dbraw/zinc/12/83/30/351128330.db2.gz JMAXQJFXERURNL-MNOVXSKESA-N 1 2 222.336 2.111 20 0 BEADLO Cc1ccccc1C[N@@H+](C)Cc1nccn1C ZINC000070978337 351137855 /nfs/dbraw/zinc/13/78/55/351137855.db2.gz LSZTULYPYCQJPP-UHFFFAOYSA-N 1 2 229.327 2.361 20 0 BEADLO Cc1ccccc1C[N@H+](C)Cc1nccn1C ZINC000070978337 351137857 /nfs/dbraw/zinc/13/78/57/351137857.db2.gz LSZTULYPYCQJPP-UHFFFAOYSA-N 1 2 229.327 2.361 20 0 BEADLO CC(C)[C@H]1CCC[C@H]([NH2+]Cc2c[nH]nn2)C1 ZINC000398413605 351141227 /nfs/dbraw/zinc/14/12/27/351141227.db2.gz ROALTWSCYWFCSV-QWRGUYRKSA-N 1 2 222.336 2.109 20 0 BEADLO CC(C)[C@H]1CCC[C@H]([NH2+]Cc2cn[nH]n2)C1 ZINC000398413605 351141229 /nfs/dbraw/zinc/14/12/29/351141229.db2.gz ROALTWSCYWFCSV-QWRGUYRKSA-N 1 2 222.336 2.109 20 0 BEADLO CC[C@H]1CCC[C@@H]([NH2+]Cc2c[nH]nn2)CC1 ZINC000398415822 351142360 /nfs/dbraw/zinc/14/23/60/351142360.db2.gz SJUMMKZETJTDBA-WDEREUQCSA-N 1 2 222.336 2.253 20 0 BEADLO CC[C@H]1CCC[C@@H]([NH2+]Cc2cn[nH]n2)CC1 ZINC000398415822 351142364 /nfs/dbraw/zinc/14/23/64/351142364.db2.gz SJUMMKZETJTDBA-WDEREUQCSA-N 1 2 222.336 2.253 20 0 BEADLO CCCC[C@@H](CC)C(=O)NCc1[nH+]ccn1C ZINC000264329690 351233506 /nfs/dbraw/zinc/23/35/06/351233506.db2.gz SKASSWXDBMGDNF-LLVKDONJSA-N 1 2 237.347 2.253 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC[C@H](OC(C)C)C2)n1 ZINC000628323844 351234638 /nfs/dbraw/zinc/23/46/38/351234638.db2.gz QRSBVJGSAHNLSD-LBPRGKRZSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC[C@H](OC(C)C)C2)n1 ZINC000628323844 351234639 /nfs/dbraw/zinc/23/46/39/351234639.db2.gz QRSBVJGSAHNLSD-LBPRGKRZSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H]1CN(Cc2[nH]c(C)c(C)[nH+]2)[C@H](C)CO1 ZINC000628324468 351236719 /nfs/dbraw/zinc/23/67/19/351236719.db2.gz VFQANFPPFNRAAH-BXKDBHETSA-N 1 2 237.347 2.026 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)CN1Cc1[nH]cc(C)[nH+]1 ZINC000628324303 351236834 /nfs/dbraw/zinc/23/68/34/351236834.db2.gz NICODYCMCDLYBW-NEPJUHHUSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@H]([NH2+]Cc1cnns1)c1nccs1 ZINC000379894476 351247164 /nfs/dbraw/zinc/24/71/64/351247164.db2.gz BOJIHZQWRKQANB-QMMMGPOBSA-N 1 2 240.357 2.236 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)Cc1cc(C)on1 ZINC000266866009 351295480 /nfs/dbraw/zinc/29/54/80/351295480.db2.gz VXIMKFGAJQIVBJ-UHFFFAOYSA-N 1 2 245.282 2.122 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@]2(C)CCCS2)no1 ZINC000628352454 351315677 /nfs/dbraw/zinc/31/56/77/351315677.db2.gz JLYRKETYPIJISW-NSHDSACASA-N 1 2 241.360 2.096 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@]2(C)CCCS2)no1 ZINC000628352454 351315680 /nfs/dbraw/zinc/31/56/80/351315680.db2.gz JLYRKETYPIJISW-NSHDSACASA-N 1 2 241.360 2.096 20 0 BEADLO CCN(Cc1c[nH+]cn1C)c1cccc(OC)c1 ZINC000267626872 351317453 /nfs/dbraw/zinc/31/74/53/351317453.db2.gz ROUFOTKNFGEESI-UHFFFAOYSA-N 1 2 245.326 2.455 20 0 BEADLO CCc1cc(N[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)nc[nH+]1 ZINC000607356660 351330753 /nfs/dbraw/zinc/33/07/53/351330753.db2.gz XPCNXMRKYOMCTH-RTXFEEFZSA-N 1 2 247.342 2.264 20 0 BEADLO CC1(C)C[C@@H]1C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000269744767 351366458 /nfs/dbraw/zinc/36/64/58/351366458.db2.gz MXLVKWAZMYBVJZ-WDEREUQCSA-N 1 2 247.342 2.162 20 0 BEADLO CC[C@@H](O)CCNc1cc[nH+]c2ccncc12 ZINC000268723868 351339937 /nfs/dbraw/zinc/33/99/37/351339937.db2.gz WHAKMXHFSDXNLC-SNVBAGLBSA-N 1 2 231.299 2.203 20 0 BEADLO CC[C@@H](SC)C(=O)Nc1cccc2[nH+]ccn21 ZINC000269526636 351359324 /nfs/dbraw/zinc/35/93/24/351359324.db2.gz FVKLPNAEOHYUFN-SECBINFHSA-N 1 2 249.339 2.414 20 0 BEADLO Brc1ccc(CNc2c[nH]c[nH+]2)o1 ZINC000307070012 351463526 /nfs/dbraw/zinc/46/35/26/351463526.db2.gz UZYMKIHCWWLDDF-UHFFFAOYSA-N 1 2 242.076 2.377 20 0 BEADLO CCc1nc(C[N@H+](C)C[C@H](C)OC)cs1 ZINC000272812944 351496779 /nfs/dbraw/zinc/49/67/79/351496779.db2.gz NLGAZTAHOZUHEO-VIFPVBQESA-N 1 2 228.361 2.172 20 0 BEADLO CCc1nc(C[N@@H+](C)C[C@H](C)OC)cs1 ZINC000272812944 351496783 /nfs/dbraw/zinc/49/67/83/351496783.db2.gz NLGAZTAHOZUHEO-VIFPVBQESA-N 1 2 228.361 2.172 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)CC[C@@H](C)OC ZINC000272872552 351499466 /nfs/dbraw/zinc/49/94/66/351499466.db2.gz DLLFUOPZGPLSLT-SNVBAGLBSA-N 1 2 236.315 2.398 20 0 BEADLO CC(=O)Nc1ccc(C[NH2+]CCCCF)cc1 ZINC000310271552 187486299 /nfs/dbraw/zinc/48/62/99/187486299.db2.gz NNTOGYFNBBGEAP-UHFFFAOYSA-N 1 2 238.306 2.484 20 0 BEADLO Cc1c[nH+]c(C)nc1NC1C[C@H](C)O[C@@H](C)C1 ZINC000577626375 366024561 /nfs/dbraw/zinc/02/45/61/366024561.db2.gz CAQVUABFOSIRNT-UWVGGRQHSA-N 1 2 235.331 2.461 20 0 BEADLO OCc1ccc(C[NH2+][C@@H]2CCCC2(F)F)cc1 ZINC000398183741 363076283 /nfs/dbraw/zinc/07/62/83/363076283.db2.gz IFNCNWQPNJCFLU-GFCCVEGCSA-N 1 2 241.281 2.456 20 0 BEADLO Clc1snnc1C[NH2+]C1(C2CC2)CC1 ZINC000388747415 351557593 /nfs/dbraw/zinc/55/75/93/351557593.db2.gz MODWDIGFIDELNU-UHFFFAOYSA-N 1 2 229.736 2.224 20 0 BEADLO Nc1ccc(NC(=O)C2CCC=CCC2)c[nH+]1 ZINC000637828724 351676839 /nfs/dbraw/zinc/67/68/39/351676839.db2.gz GIWNONMLBRNVNF-UHFFFAOYSA-N 1 2 231.299 2.179 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)CC[C@@H]1CCCO1 ZINC000577746747 366052050 /nfs/dbraw/zinc/05/20/50/366052050.db2.gz FFHUBDKPHFRCDS-LBPRGKRZSA-N 1 2 235.331 2.099 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1cc(C)ns1 ZINC000637853159 351709073 /nfs/dbraw/zinc/70/90/73/351709073.db2.gz RHGVUFSSKQKOHY-QWRGUYRKSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1cc(C)ns1 ZINC000637853159 351709075 /nfs/dbraw/zinc/70/90/75/351709075.db2.gz RHGVUFSSKQKOHY-QWRGUYRKSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)Cc1ccns1 ZINC000637943735 351820278 /nfs/dbraw/zinc/82/02/78/351820278.db2.gz QYXJWOLPXMZDEE-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)Cc1ccns1 ZINC000637943735 351820281 /nfs/dbraw/zinc/82/02/81/351820281.db2.gz QYXJWOLPXMZDEE-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1ncc([C@H](C)[N@@H+]2CCOCC2(C)C)c(C)n1 ZINC000637964152 351836775 /nfs/dbraw/zinc/83/67/75/351836775.db2.gz HMZZSQAUKKYLOZ-NSHDSACASA-N 1 2 249.358 2.265 20 0 BEADLO Cc1ncc([C@H](C)[N@H+]2CCOCC2(C)C)c(C)n1 ZINC000637964152 351836777 /nfs/dbraw/zinc/83/67/77/351836777.db2.gz HMZZSQAUKKYLOZ-NSHDSACASA-N 1 2 249.358 2.265 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccns2)CC(C)(C)O1 ZINC000637971944 351847333 /nfs/dbraw/zinc/84/73/33/351847333.db2.gz VPJKFYPRERRYOQ-VIFPVBQESA-N 1 2 226.345 2.142 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccns2)CC(C)(C)O1 ZINC000637971944 351847336 /nfs/dbraw/zinc/84/73/36/351847336.db2.gz VPJKFYPRERRYOQ-VIFPVBQESA-N 1 2 226.345 2.142 20 0 BEADLO FC(F)C[N@H+](CCC[C@H]1CCO1)C1CC1 ZINC000638057424 351933716 /nfs/dbraw/zinc/93/37/16/351933716.db2.gz VQSSYVOKSIUXMY-JTQLQIEISA-N 1 2 219.275 2.285 20 0 BEADLO FC(F)C[N@@H+](CCC[C@H]1CCO1)C1CC1 ZINC000638057424 351933718 /nfs/dbraw/zinc/93/37/18/351933718.db2.gz VQSSYVOKSIUXMY-JTQLQIEISA-N 1 2 219.275 2.285 20 0 BEADLO COc1cccc(C)c1C[N@H+](C)Cc1cc[nH]n1 ZINC000638063723 351934363 /nfs/dbraw/zinc/93/43/63/351934363.db2.gz GKMLVUMTETURIP-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1cccc(C)c1C[N@@H+](C)Cc1cc[nH]n1 ZINC000638063723 351934364 /nfs/dbraw/zinc/93/43/64/351934364.db2.gz GKMLVUMTETURIP-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cc[nH]n2)c(F)c1 ZINC000638063780 351937133 /nfs/dbraw/zinc/93/71/33/351937133.db2.gz HDXCRQMGIIAWBM-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cc[nH]n2)c(F)c1 ZINC000638063780 351937135 /nfs/dbraw/zinc/93/71/35/351937135.db2.gz HDXCRQMGIIAWBM-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO CCCC[C@H](C)C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000281900627 351914602 /nfs/dbraw/zinc/91/46/02/351914602.db2.gz BLUGIWWKQQFBOI-NWDGAFQWSA-N 1 2 237.347 2.214 20 0 BEADLO CCCC[C@@H](C)C(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000281900626 351914953 /nfs/dbraw/zinc/91/49/53/351914953.db2.gz BLUGIWWKQQFBOI-NEPJUHHUSA-N 1 2 237.347 2.214 20 0 BEADLO CCCC[C@H](C)C(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000281900629 351915658 /nfs/dbraw/zinc/91/56/58/351915658.db2.gz BLUGIWWKQQFBOI-RYUDHWBXSA-N 1 2 237.347 2.214 20 0 BEADLO CC[C@@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000284023942 351989697 /nfs/dbraw/zinc/98/96/97/351989697.db2.gz OVDUTWWGMBIFIR-BTDICHCPSA-N 1 2 247.342 2.462 20 0 BEADLO CC[N@H+](Cc1cnn[nH]1)Cc1ccccc1C ZINC000284415932 351997446 /nfs/dbraw/zinc/99/74/46/351997446.db2.gz XMRVFNSOKOKDNT-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CC[N@@H+](Cc1cnn[nH]1)Cc1ccccc1C ZINC000284415932 351997448 /nfs/dbraw/zinc/99/74/48/351997448.db2.gz XMRVFNSOKOKDNT-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CC[N@H+](Cc1c[nH]nn1)Cc1ccccc1C ZINC000284415932 351997449 /nfs/dbraw/zinc/99/74/49/351997449.db2.gz XMRVFNSOKOKDNT-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CC[N@@H+](Cc1c[nH]nn1)Cc1ccccc1C ZINC000284415932 351997451 /nfs/dbraw/zinc/99/74/51/351997451.db2.gz XMRVFNSOKOKDNT-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CC[N@H+](Cc1cn[nH]n1)Cc1ccccc1C ZINC000284415932 351997453 /nfs/dbraw/zinc/99/74/53/351997453.db2.gz XMRVFNSOKOKDNT-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CC[N@@H+](Cc1cn[nH]n1)Cc1ccccc1C ZINC000284415932 351997455 /nfs/dbraw/zinc/99/74/55/351997455.db2.gz XMRVFNSOKOKDNT-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CC[N@H+](Cc1ccccc1)[C@H](C)c1nncn1C ZINC000286721126 352103022 /nfs/dbraw/zinc/10/30/22/352103022.db2.gz DIZLVGPLINNCGT-GFCCVEGCSA-N 1 2 244.342 2.398 20 0 BEADLO CC[N@@H+](Cc1ccccc1)[C@H](C)c1nncn1C ZINC000286721126 352103024 /nfs/dbraw/zinc/10/30/24/352103024.db2.gz DIZLVGPLINNCGT-GFCCVEGCSA-N 1 2 244.342 2.398 20 0 BEADLO C[C@@H]1C[N@@H+]([C@@H]2C[C@H]2c2cccc(F)c2)CCO1 ZINC000411126914 191161201 /nfs/dbraw/zinc/16/12/01/191161201.db2.gz QJECXBIHOVIFMF-DDTOSNHZSA-N 1 2 235.302 2.402 20 0 BEADLO C[C@@H]1C[N@H+]([C@@H]2C[C@H]2c2cccc(F)c2)CCO1 ZINC000411126914 191161204 /nfs/dbraw/zinc/16/12/04/191161204.db2.gz QJECXBIHOVIFMF-DDTOSNHZSA-N 1 2 235.302 2.402 20 0 BEADLO CC[N@H+](Cc1ccn(C)n1)[C@@H](C)c1cccnc1 ZINC000290568649 352230315 /nfs/dbraw/zinc/23/03/15/352230315.db2.gz SYXUDWCQKSKTLI-LBPRGKRZSA-N 1 2 244.342 2.398 20 0 BEADLO CC[N@@H+](Cc1ccn(C)n1)[C@@H](C)c1cccnc1 ZINC000290568649 352230319 /nfs/dbraw/zinc/23/03/19/352230319.db2.gz SYXUDWCQKSKTLI-LBPRGKRZSA-N 1 2 244.342 2.398 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+](C)Cc2ccc(F)cc2)[nH]1 ZINC000411130103 191162394 /nfs/dbraw/zinc/16/23/94/191162394.db2.gz GGEBCKPAAWPXQN-SECBINFHSA-N 1 2 248.305 2.445 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+](C)Cc2ccc(F)cc2)[nH]1 ZINC000411130103 191162397 /nfs/dbraw/zinc/16/23/97/191162397.db2.gz GGEBCKPAAWPXQN-SECBINFHSA-N 1 2 248.305 2.445 20 0 BEADLO CCCC[C@H](C)N(C)C(=O)CCn1cc[nH+]c1 ZINC000291071121 352259992 /nfs/dbraw/zinc/25/99/92/352259992.db2.gz XEBLRSDLPAXTOG-LBPRGKRZSA-N 1 2 237.347 2.310 20 0 BEADLO CCCC[C@H](C)N(C)c1[nH+]cnc2c1cnn2C ZINC000290927609 352249800 /nfs/dbraw/zinc/24/98/00/352249800.db2.gz YJTVKTNPEUMGMQ-JTQLQIEISA-N 1 2 247.346 2.378 20 0 BEADLO CCCC[C@H](CC)C(=O)N1CCn2c[nH+]cc2C1 ZINC000290972821 352253211 /nfs/dbraw/zinc/25/32/11/352253211.db2.gz UDZZYDPJTDZFTH-LBPRGKRZSA-N 1 2 249.358 2.442 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000294371480 352376561 /nfs/dbraw/zinc/37/65/61/352376561.db2.gz GUTHRILTEKPLHG-XQQFMLRXSA-N 1 2 249.358 2.214 20 0 BEADLO CCC[N@H+](C[C@@H](F)CC)[C@H](C)C(=O)OCC ZINC000411653211 191201635 /nfs/dbraw/zinc/20/16/35/191201635.db2.gz WHWYHYDBVUVMDQ-MNOVXSKESA-N 1 2 233.327 2.398 20 0 BEADLO CCC[N@@H+](C[C@@H](F)CC)[C@H](C)C(=O)OCC ZINC000411653211 191201636 /nfs/dbraw/zinc/20/16/36/191201636.db2.gz WHWYHYDBVUVMDQ-MNOVXSKESA-N 1 2 233.327 2.398 20 0 BEADLO CN(C)c1ccc(NCc2ccns2)[nH+]c1 ZINC000638760478 352695134 /nfs/dbraw/zinc/69/51/34/352695134.db2.gz SMHHMLYEVDYJKY-UHFFFAOYSA-N 1 2 234.328 2.216 20 0 BEADLO CCC[C@H](CNc1ccc(SC)c[nH+]1)OC ZINC000638760780 352695883 /nfs/dbraw/zinc/69/58/83/352695883.db2.gz VNJVTZVZZMVVLE-SNVBAGLBSA-N 1 2 240.372 2.452 20 0 BEADLO Cc1ccc(NC2CC(n3cccn3)C2)c[nH+]1 ZINC000638762034 352699304 /nfs/dbraw/zinc/69/93/04/352699304.db2.gz QHHHMHRITDBVFD-UHFFFAOYSA-N 1 2 228.299 2.402 20 0 BEADLO CC[N@H+](Cc1cncn1C)Cc1occc1C ZINC000412028313 191240144 /nfs/dbraw/zinc/24/01/44/191240144.db2.gz RTUNTDTWCYRNJJ-UHFFFAOYSA-N 1 2 233.315 2.344 20 0 BEADLO CC[N@@H+](Cc1cncn1C)Cc1occc1C ZINC000412028313 191240146 /nfs/dbraw/zinc/24/01/46/191240146.db2.gz RTUNTDTWCYRNJJ-UHFFFAOYSA-N 1 2 233.315 2.344 20 0 BEADLO Fc1cccnc1C[NH2+]Cc1cc(C2CC2)no1 ZINC000638780569 352731427 /nfs/dbraw/zinc/73/14/27/352731427.db2.gz SQLLZTPEWAFTLY-UHFFFAOYSA-N 1 2 247.273 2.376 20 0 BEADLO CC(C)C[N@@H+]1CC(=O)N[C@@H]1[C@@H]1CCCC[C@@H]1C ZINC000342249078 352739598 /nfs/dbraw/zinc/73/95/98/352739598.db2.gz DSYPEERTJMXXRH-SCRDCRAPSA-N 1 2 238.375 2.227 20 0 BEADLO CC(C)C[N@H+]1CC(=O)N[C@@H]1[C@@H]1CCCC[C@@H]1C ZINC000342249078 352739601 /nfs/dbraw/zinc/73/96/01/352739601.db2.gz DSYPEERTJMXXRH-SCRDCRAPSA-N 1 2 238.375 2.227 20 0 BEADLO Cn1c[nH+]cc1C[S@@](=O)C1CCCCC1 ZINC000268184725 180789907 /nfs/dbraw/zinc/78/99/07/180789907.db2.gz LWBOPNQVXIEFHY-OAHLLOKOSA-N 1 2 226.345 2.002 20 0 BEADLO Cc1cc(N2CC[C@@H](C3CC3)C2)nc[nH+]1 ZINC000334186755 352776528 /nfs/dbraw/zinc/77/65/28/352776528.db2.gz GVIYWGXDPDRDHG-LLVKDONJSA-N 1 2 203.289 2.021 20 0 BEADLO c1cc(C[N@@H+]2CC[C@@H]2c2ccccc2)n[nH]1 ZINC000334183548 352772193 /nfs/dbraw/zinc/77/21/93/352772193.db2.gz AAPPYQRHYRIWEQ-CYBMUJFWSA-N 1 2 213.284 2.357 20 0 BEADLO c1cc(C[N@H+]2CC[C@@H]2c2ccccc2)n[nH]1 ZINC000334183548 352772198 /nfs/dbraw/zinc/77/21/98/352772198.db2.gz AAPPYQRHYRIWEQ-CYBMUJFWSA-N 1 2 213.284 2.357 20 0 BEADLO C[N@H+](CCCCF)Cc1noc(C2CC2)n1 ZINC000412070117 191251618 /nfs/dbraw/zinc/25/16/18/191251618.db2.gz ICGXZIUFQCKMHF-UHFFFAOYSA-N 1 2 227.283 2.129 20 0 BEADLO C[N@@H+](CCCCF)Cc1noc(C2CC2)n1 ZINC000412070117 191251620 /nfs/dbraw/zinc/25/16/20/191251620.db2.gz ICGXZIUFQCKMHF-UHFFFAOYSA-N 1 2 227.283 2.129 20 0 BEADLO Cc1nccc(C[N@@H+]2CCc3sccc3C2)n1 ZINC000334203981 352797488 /nfs/dbraw/zinc/79/74/88/352797488.db2.gz ROSZRLVNJDRFEI-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1nccc(C[N@H+]2CCc3sccc3C2)n1 ZINC000334203981 352797491 /nfs/dbraw/zinc/79/74/91/352797491.db2.gz ROSZRLVNJDRFEI-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO c1cc(C[N@@H+]2CCC[C@H]2c2cccnc2)no1 ZINC000334239605 352858767 /nfs/dbraw/zinc/85/87/67/352858767.db2.gz LCNMTLGTWVQCED-ZDUSSCGKSA-N 1 2 229.283 2.407 20 0 BEADLO c1cc(C[N@H+]2CCC[C@H]2c2cccnc2)no1 ZINC000334239605 352858770 /nfs/dbraw/zinc/85/87/70/352858770.db2.gz LCNMTLGTWVQCED-ZDUSSCGKSA-N 1 2 229.283 2.407 20 0 BEADLO Cc1c[nH+]c(CN2CCSC(C)(C)C2)n1C ZINC000342807739 352861277 /nfs/dbraw/zinc/86/12/77/352861277.db2.gz OZLCHQDFJDWELR-UHFFFAOYSA-N 1 2 239.388 2.056 20 0 BEADLO Cc1c[nH+]c(CN(C)Cc2cnccc2C)n1C ZINC000342853465 352874918 /nfs/dbraw/zinc/87/49/18/352874918.db2.gz FADVNYSGROTENC-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO CC(C)CC(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000334247799 352839595 /nfs/dbraw/zinc/83/95/95/352839595.db2.gz NDOCDIJMVAHYDW-JTQLQIEISA-N 1 2 221.304 2.119 20 0 BEADLO O=C(C[C@@H]1C=CCC1)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000334248028 352840039 /nfs/dbraw/zinc/84/00/39/352840039.db2.gz OKWALANASWPOHD-VXGBXAGGSA-N 1 2 245.326 2.430 20 0 BEADLO C[C@H](C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1)C1CC1 ZINC000334249594 352842889 /nfs/dbraw/zinc/84/28/89/352842889.db2.gz WHBRBWVSGFUKEQ-ONGXEEELSA-N 1 2 233.315 2.119 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000334281326 352921883 /nfs/dbraw/zinc/92/18/83/352921883.db2.gz HJZSUSMXYUXSIP-GFCCVEGCSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000334281326 352921885 /nfs/dbraw/zinc/92/18/85/352921885.db2.gz HJZSUSMXYUXSIP-GFCCVEGCSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1noc(C)c1CN1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000334281326 352921886 /nfs/dbraw/zinc/92/18/86/352921886.db2.gz HJZSUSMXYUXSIP-GFCCVEGCSA-N 1 2 246.314 2.352 20 0 BEADLO COc1cc(C[N@H+](C)Cc2ccoc2)ccn1 ZINC000342863883 352881353 /nfs/dbraw/zinc/88/13/53/352881353.db2.gz KATUSRHIDZSJOD-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2ccoc2)ccn1 ZINC000342863883 352881354 /nfs/dbraw/zinc/88/13/54/352881354.db2.gz KATUSRHIDZSJOD-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@H]2C[C@@H]2C(F)F)[nH+]1 ZINC000334252440 352888817 /nfs/dbraw/zinc/88/88/17/352888817.db2.gz WFZLFKQEZMAZQN-YUMQZZPRSA-N 1 2 238.241 2.332 20 0 BEADLO Cc1ccc(C[N@@H+]2CC[S@@](=O)[C@H](C)C2)s1 ZINC000334263437 352897000 /nfs/dbraw/zinc/89/70/00/352897000.db2.gz WGDRGZLJTHZMCH-MEBBXXQBSA-N 1 2 243.397 2.009 20 0 BEADLO Cc1ccc(C[N@H+]2CC[S@@](=O)[C@H](C)C2)s1 ZINC000334263437 352897001 /nfs/dbraw/zinc/89/70/01/352897001.db2.gz WGDRGZLJTHZMCH-MEBBXXQBSA-N 1 2 243.397 2.009 20 0 BEADLO Cc1ccc(C[N@@H+]2CC[S@](=O)[C@@H](C)C2)s1 ZINC000334263436 352897075 /nfs/dbraw/zinc/89/70/75/352897075.db2.gz WGDRGZLJTHZMCH-BONVTDFDSA-N 1 2 243.397 2.009 20 0 BEADLO Cc1ccc(C[N@H+]2CC[S@](=O)[C@@H](C)C2)s1 ZINC000334263436 352897077 /nfs/dbraw/zinc/89/70/77/352897077.db2.gz WGDRGZLJTHZMCH-BONVTDFDSA-N 1 2 243.397 2.009 20 0 BEADLO Cc1cc(F)cc2c1C[N@H+]([C@H](C)C(N)=O)CC2 ZINC000334339744 352975078 /nfs/dbraw/zinc/97/50/78/352975078.db2.gz BPHSLQOKLNWMGK-SECBINFHSA-N 1 2 236.290 2.416 20 0 BEADLO Cc1cc(F)cc2c1C[N@@H+]([C@H](C)C(N)=O)CC2 ZINC000334339744 352975079 /nfs/dbraw/zinc/97/50/79/352975079.db2.gz BPHSLQOKLNWMGK-SECBINFHSA-N 1 2 236.290 2.416 20 0 BEADLO C[C@@H](CO)N(C)c1[nH+]ccc2ccc(F)cc21 ZINC000334354511 352990130 /nfs/dbraw/zinc/99/01/30/352990130.db2.gz ZOSXBGSWFDKRCI-VIFPVBQESA-N 1 2 234.274 2.191 20 0 BEADLO Cc1cc(CN2CCC[C@@H]2c2[nH]cc[nH+]2)no1 ZINC000334300335 352937530 /nfs/dbraw/zinc/93/75/30/352937530.db2.gz UESJIMHNEHUIJP-LLVKDONJSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1cc(CN2CCC[C@H]2c2[nH]cc[nH+]2)no1 ZINC000334300336 352937838 /nfs/dbraw/zinc/93/78/38/352937838.db2.gz UESJIMHNEHUIJP-NSHDSACASA-N 1 2 232.287 2.043 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nc(C)sc2C)CCO1 ZINC000334311365 352942557 /nfs/dbraw/zinc/94/25/57/352942557.db2.gz RFIFCJBCOWLQAE-LLVKDONJSA-N 1 2 240.372 2.371 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nc(C)sc2C)CCO1 ZINC000334311365 352942560 /nfs/dbraw/zinc/94/25/60/352942560.db2.gz RFIFCJBCOWLQAE-LLVKDONJSA-N 1 2 240.372 2.371 20 0 BEADLO Oc1cccc(C[N@@H+]2CCC[C@@H]2c2ncc[nH]2)c1 ZINC000334327726 352963902 /nfs/dbraw/zinc/96/39/02/352963902.db2.gz CDUYOPMPDDRCAW-CYBMUJFWSA-N 1 2 243.310 2.452 20 0 BEADLO Oc1cccc(C[N@H+]2CCC[C@@H]2c2ncc[nH]2)c1 ZINC000334327726 352963905 /nfs/dbraw/zinc/96/39/05/352963905.db2.gz CDUYOPMPDDRCAW-CYBMUJFWSA-N 1 2 243.310 2.452 20 0 BEADLO CC[C@H](C)[C@H](C[N@@H+]1CCC(F)(F)C1)OC ZINC000638842359 353018394 /nfs/dbraw/zinc/01/83/94/353018394.db2.gz PXPNIUUTXXAENI-UWVGGRQHSA-N 1 2 221.291 2.389 20 0 BEADLO CC[C@H](C)[C@H](C[N@H+]1CCC(F)(F)C1)OC ZINC000638842359 353018397 /nfs/dbraw/zinc/01/83/97/353018397.db2.gz PXPNIUUTXXAENI-UWVGGRQHSA-N 1 2 221.291 2.389 20 0 BEADLO Cc1cnc(CNCc2[nH+]ccn2CC(C)C)o1 ZINC000638869668 353037062 /nfs/dbraw/zinc/03/70/62/353037062.db2.gz KGUSNNGSWKLLNS-UHFFFAOYSA-N 1 2 248.330 2.125 20 0 BEADLO CC(C)([NH2+]Cc1cccnc1)C(F)F ZINC000379579528 538107454 /nfs/dbraw/zinc/10/74/54/538107454.db2.gz WTWTWUFZCOAWEY-UHFFFAOYSA-N 1 2 200.232 2.215 20 0 BEADLO Cc1cc(N[C@@H]2CSC[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000334408190 353089948 /nfs/dbraw/zinc/08/99/48/353089948.db2.gz HVOKWKSQEZVOPS-GZMMTYOYSA-N 1 2 249.383 2.248 20 0 BEADLO CC(=O)c1c(C)[nH]c(C(=O)C[NH+]2CCCC2)c1C ZINC000007785898 188104433 /nfs/dbraw/zinc/10/44/33/188104433.db2.gz APZHDUJYOXQPNH-UHFFFAOYSA-N 1 2 248.326 2.113 20 0 BEADLO CC(C)(C)[C@@H]1CCCC[C@@H]1[NH2+]Cc1ncn[nH]1 ZINC000037919136 188114552 /nfs/dbraw/zinc/11/45/52/188114552.db2.gz XWMIEKQERYGZCO-MNOVXSKESA-N 1 2 236.363 2.499 20 0 BEADLO CC(C)=CC(=O)NCc1cn2ccc(C)cc2[nH+]1 ZINC000071435603 188131105 /nfs/dbraw/zinc/13/11/05/188131105.db2.gz KPDRKLIQAWXYAP-UHFFFAOYSA-N 1 2 243.310 2.225 20 0 BEADLO Cc1ccc(OCC[N@@H+](C)Cc2ccon2)cc1 ZINC000172383707 188162288 /nfs/dbraw/zinc/16/22/88/188162288.db2.gz LFHIHLBBCBXYON-UHFFFAOYSA-N 1 2 246.310 2.494 20 0 BEADLO Cc1ccc(OCC[N@H+](C)Cc2ccon2)cc1 ZINC000172383707 188162290 /nfs/dbraw/zinc/16/22/90/188162290.db2.gz LFHIHLBBCBXYON-UHFFFAOYSA-N 1 2 246.310 2.494 20 0 BEADLO Cc1csc(C[NH2+][C@@H](C)c2ccnn2C)n1 ZINC000192250384 188173726 /nfs/dbraw/zinc/17/37/26/188173726.db2.gz WPAHZFBFYYERQV-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO C=Cn1cc(CNc2ccc[nH+]c2C)cn1 ZINC000194354395 188174815 /nfs/dbraw/zinc/17/48/15/188174815.db2.gz WPDMYNKEWYTZBJ-UHFFFAOYSA-N 1 2 214.272 2.299 20 0 BEADLO COc1nccc(C[N@H+](C)[C@@H](C)c2ccco2)n1 ZINC000294622668 188213347 /nfs/dbraw/zinc/21/33/47/188213347.db2.gz YSROFGFRSIETEK-JTQLQIEISA-N 1 2 247.298 2.271 20 0 BEADLO COc1nccc(C[N@@H+](C)[C@@H](C)c2ccco2)n1 ZINC000294622668 188213348 /nfs/dbraw/zinc/21/33/48/188213348.db2.gz YSROFGFRSIETEK-JTQLQIEISA-N 1 2 247.298 2.271 20 0 BEADLO Cc1cc(N[C@@H]2CCCSC2)nc[nH+]1 ZINC000129211996 188221040 /nfs/dbraw/zinc/22/10/40/188221040.db2.gz CLYCWZPJISRFDZ-SECBINFHSA-N 1 2 209.318 2.093 20 0 BEADLO CC(C)C[C@H](C)C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000274245099 188201546 /nfs/dbraw/zinc/20/15/46/188201546.db2.gz SRLNLWGGNNVZEZ-NWDGAFQWSA-N 1 2 237.347 2.070 20 0 BEADLO CC[C@@]1(C)C[N@H+](Cc2cncc(F)c2)CCO1 ZINC000276711522 188202647 /nfs/dbraw/zinc/20/26/47/188202647.db2.gz GTNYCGPDHYIXMZ-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO CC[C@@]1(C)C[N@@H+](Cc2cncc(F)c2)CCO1 ZINC000276711522 188202649 /nfs/dbraw/zinc/20/26/49/188202649.db2.gz GTNYCGPDHYIXMZ-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO Cn1c[nH+]c2cc(Nc3ncccn3)ccc21 ZINC000340050084 188205369 /nfs/dbraw/zinc/20/53/69/188205369.db2.gz QNOWXVBMNCFTJB-UHFFFAOYSA-N 1 2 225.255 2.107 20 0 BEADLO CCCCOCC[NH2+][C@@H](C)c1cn[nH]c1C ZINC000134554630 538113230 /nfs/dbraw/zinc/11/32/30/538113230.db2.gz YJZXKGKZNDZCHU-JTQLQIEISA-N 1 2 225.336 2.185 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)NC[C@H]1C[C@@H]1C ZINC000287445140 188209195 /nfs/dbraw/zinc/20/91/95/188209195.db2.gz HRPVACGWLXRSPB-GXSJLCMTSA-N 1 2 233.315 2.476 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)NC1CCC1 ZINC000287427266 188209258 /nfs/dbraw/zinc/20/92/58/188209258.db2.gz GHZFKKZDWLJGNN-UHFFFAOYSA-N 1 2 219.288 2.372 20 0 BEADLO Cc1nn(C(C)C)cc1C[N@@H+]1CCOCC12CC2 ZINC000336364623 188229506 /nfs/dbraw/zinc/22/95/06/188229506.db2.gz GOCAYISTKRFECP-UHFFFAOYSA-N 1 2 249.358 2.137 20 0 BEADLO Cc1nn(C(C)C)cc1C[N@H+]1CCOCC12CC2 ZINC000336364623 188229507 /nfs/dbraw/zinc/22/95/07/188229507.db2.gz GOCAYISTKRFECP-UHFFFAOYSA-N 1 2 249.358 2.137 20 0 BEADLO COc1ccc(N[C@H]2CCSC2)[nH+]c1 ZINC000225834451 538114244 /nfs/dbraw/zinc/11/42/44/538114244.db2.gz GYNWVSDWDYASHP-QMMMGPOBSA-N 1 2 210.302 2.008 20 0 BEADLO CC(C)[C@H](NC(=O)[C@H](C)C1CC1)c1[nH]cc[nH+]1 ZINC000331704060 188226421 /nfs/dbraw/zinc/22/64/21/188226421.db2.gz XMRVVLHGPPJUCK-KOLCDFICSA-N 1 2 235.331 2.269 20 0 BEADLO C[C@@H]1CCC[C@@H](CC(=O)NCc2[nH+]ccn2C)C1 ZINC000343283300 353344231 /nfs/dbraw/zinc/34/42/31/353344231.db2.gz ASSFNEXCEGMDEI-VXGBXAGGSA-N 1 2 249.358 2.253 20 0 BEADLO C[C@H](C(N)=O)[N@@H+]1CCO[C@@H](C2CCCCC2)C1 ZINC000334503728 353351149 /nfs/dbraw/zinc/35/11/49/353351149.db2.gz XJBRRAYLMLVQBQ-ZYHUDNBSSA-N 1 2 240.347 2.191 20 0 BEADLO C[C@H](C(N)=O)[N@H+]1CCO[C@@H](C2CCCCC2)C1 ZINC000334503728 353351150 /nfs/dbraw/zinc/35/11/50/353351150.db2.gz XJBRRAYLMLVQBQ-ZYHUDNBSSA-N 1 2 240.347 2.191 20 0 BEADLO C[C@@H](C(N)=O)[N@@H+]1CCO[C@H](C2CCCCC2)C1 ZINC000334503726 353351153 /nfs/dbraw/zinc/35/11/53/353351153.db2.gz XJBRRAYLMLVQBQ-JQWIXIFHSA-N 1 2 240.347 2.191 20 0 BEADLO C[C@@H](C(N)=O)[N@H+]1CCO[C@H](C2CCCCC2)C1 ZINC000334503726 353351154 /nfs/dbraw/zinc/35/11/54/353351154.db2.gz XJBRRAYLMLVQBQ-JQWIXIFHSA-N 1 2 240.347 2.191 20 0 BEADLO O=C(Nc1cscc1Cl)[C@H]1CSC[NH2+]1 ZINC000639073742 353391502 /nfs/dbraw/zinc/39/15/02/353391502.db2.gz QABKJPKBLGRLHD-SSDOTTSWSA-N 1 2 248.760 2.003 20 0 BEADLO Cc1ccc(C2CC([NH2+]Cc3c[nH]nn3)C2)cc1 ZINC000398365459 363225911 /nfs/dbraw/zinc/22/59/11/363225911.db2.gz ZMAUQRNZGHWQNI-UHFFFAOYSA-N 1 2 242.326 2.149 20 0 BEADLO Cc1ccc(C2CC([NH2+]Cc3cn[nH]n3)C2)cc1 ZINC000398365459 363225914 /nfs/dbraw/zinc/22/59/14/363225914.db2.gz ZMAUQRNZGHWQNI-UHFFFAOYSA-N 1 2 242.326 2.149 20 0 BEADLO c1ccc2c(c1)ccnc2C[NH+]1CCOCC1 ZINC000200081774 538117679 /nfs/dbraw/zinc/11/76/79/538117679.db2.gz BCAXJYOQQMVQOK-UHFFFAOYSA-N 1 2 228.295 2.067 20 0 BEADLO Cc1cc(NC[C@@H](C)c2nccs2)nc[nH+]1 ZINC000230610817 353514237 /nfs/dbraw/zinc/51/42/37/353514237.db2.gz RNSJPYMREOXHGJ-MRVPVSSYSA-N 1 2 234.328 2.457 20 0 BEADLO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2cnn(C)c2)o1 ZINC000230639956 353519209 /nfs/dbraw/zinc/51/92/09/353519209.db2.gz RHZVGGOAWIGNAP-UWVGGRQHSA-N 1 2 234.303 2.128 20 0 BEADLO CCc1cnc(CNc2cc(C)[nH+]cn2)s1 ZINC000230920290 353548880 /nfs/dbraw/zinc/54/88/80/353548880.db2.gz JFRQYUZOIDWTET-UHFFFAOYSA-N 1 2 234.328 2.416 20 0 BEADLO C[C@H]1CC[C@@H](CNc2[nH+]cnc3c2cnn3C)C1 ZINC000230434244 353497656 /nfs/dbraw/zinc/49/76/56/353497656.db2.gz DNQFIEDJTFEURJ-VHSXEESVSA-N 1 2 245.330 2.211 20 0 BEADLO CC1(C)CCCC[C@@H]1NC(=O)CCc1c[nH+]c[nH]1 ZINC000193512180 353590713 /nfs/dbraw/zinc/59/07/13/353590713.db2.gz BGTMLDOCSRCFTB-LBPRGKRZSA-N 1 2 249.358 2.427 20 0 BEADLO CC1(C)CCCC[C@@H]1NC(=O)CCc1c[nH]c[nH+]1 ZINC000193512180 353590717 /nfs/dbraw/zinc/59/07/17/353590717.db2.gz BGTMLDOCSRCFTB-LBPRGKRZSA-N 1 2 249.358 2.427 20 0 BEADLO Fc1cccc2c1N(CCCn1cc[nH+]c1)CC2 ZINC000343311936 353592300 /nfs/dbraw/zinc/59/23/00/353592300.db2.gz QDRYUMSAHAMFCX-UHFFFAOYSA-N 1 2 245.301 2.475 20 0 BEADLO CCC[C@H](CC)NC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000577862735 366090107 /nfs/dbraw/zinc/09/01/07/366090107.db2.gz HKLVEXZLXWLDAX-MNOVXSKESA-N 1 2 237.347 2.283 20 0 BEADLO CCC[C@H](CC)NC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000577862735 366090110 /nfs/dbraw/zinc/09/01/10/366090110.db2.gz HKLVEXZLXWLDAX-MNOVXSKESA-N 1 2 237.347 2.283 20 0 BEADLO CCCOCC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000194551636 353670541 /nfs/dbraw/zinc/67/05/41/353670541.db2.gz NQGFDPMIKGQMAF-UHFFFAOYSA-N 1 2 236.315 2.372 20 0 BEADLO Fc1cccc2c1CC[N@H+](Cc1cc[nH]n1)C2 ZINC000123816613 181005813 /nfs/dbraw/zinc/00/58/13/181005813.db2.gz RAQPPHVFQAYFTO-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO Fc1cccc2c1CC[N@@H+](Cc1cc[nH]n1)C2 ZINC000123816613 181005814 /nfs/dbraw/zinc/00/58/14/181005814.db2.gz RAQPPHVFQAYFTO-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO OCC[C@H]1CCCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000051895310 188482203 /nfs/dbraw/zinc/48/22/03/188482203.db2.gz CCOKNSVFQHVAHW-LLVKDONJSA-N 1 2 245.326 2.162 20 0 BEADLO C[C@H]1CCCN1c1nc(N)c2ccccc2[nH+]1 ZINC000152421099 353726295 /nfs/dbraw/zinc/72/62/95/353726295.db2.gz OIIZEZUKEZLCKA-VIFPVBQESA-N 1 2 228.299 2.201 20 0 BEADLO Fc1ccccc1C[NH2+][C@@H]1CCn2ccnc21 ZINC000294040671 181012782 /nfs/dbraw/zinc/01/27/82/181012782.db2.gz IPKGXPZAHZJKQE-GFCCVEGCSA-N 1 2 231.274 2.257 20 0 BEADLO COc1ccc(C[NH2+][C@@H](C)c2nc(C)no2)cc1 ZINC000074071551 353742225 /nfs/dbraw/zinc/74/22/25/353742225.db2.gz WNMOQRVEJLNALX-VIFPVBQESA-N 1 2 247.298 2.237 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccns2)C[C@H](C2CC2)O1 ZINC000639116924 353742364 /nfs/dbraw/zinc/74/23/64/353742364.db2.gz AXCZWNKFFBVMEH-JOYOIKCWSA-N 1 2 238.356 2.142 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccns2)C[C@H](C2CC2)O1 ZINC000639116924 353742369 /nfs/dbraw/zinc/74/23/69/353742369.db2.gz AXCZWNKFFBVMEH-JOYOIKCWSA-N 1 2 238.356 2.142 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccns2)C[C@@H](C2CC2)O1 ZINC000639116925 353742388 /nfs/dbraw/zinc/74/23/88/353742388.db2.gz AXCZWNKFFBVMEH-SKDRFNHKSA-N 1 2 238.356 2.142 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccns2)C[C@@H](C2CC2)O1 ZINC000639116925 353742392 /nfs/dbraw/zinc/74/23/92/353742392.db2.gz AXCZWNKFFBVMEH-SKDRFNHKSA-N 1 2 238.356 2.142 20 0 BEADLO Cc1cc(NCC2(O)CCC2)nc(C(C)C)[nH+]1 ZINC000220206359 353826808 /nfs/dbraw/zinc/82/68/08/353826808.db2.gz IVIBIWIFXZCFDO-UHFFFAOYSA-N 1 2 235.331 2.235 20 0 BEADLO CO[C@@H](CNc1ccc(CO)c[nH+]1)CC(C)C ZINC000639132360 353842028 /nfs/dbraw/zinc/84/20/28/353842028.db2.gz MRNYPKLAFDRKGR-GFCCVEGCSA-N 1 2 238.331 2.047 20 0 BEADLO Cc1cc(N[C@@H]2CCCOC2)nc(C2CC2)[nH+]1 ZINC000172015331 188520492 /nfs/dbraw/zinc/52/04/92/188520492.db2.gz OMOPVAZTCIMQDD-LLVKDONJSA-N 1 2 233.315 2.253 20 0 BEADLO CC[C@H](C)[C@H](C[NH2+]C1(C(F)F)CC1)OC ZINC000639139599 353856066 /nfs/dbraw/zinc/85/60/66/353856066.db2.gz MTYIWRKNRLAESC-IUCAKERBSA-N 1 2 221.291 2.435 20 0 BEADLO CC[C@H]1C[C@@H](Nc2cccc[nH+]2)CCO1 ZINC000334534125 353913963 /nfs/dbraw/zinc/91/39/63/353913963.db2.gz LCKSCNQNWBJBTJ-QWRGUYRKSA-N 1 2 206.289 2.451 20 0 BEADLO CC[C@H](C)[C@H](CN1CC[N@@H+](CC)C[C@H]1C)OC ZINC000639161161 353942229 /nfs/dbraw/zinc/94/22/29/353942229.db2.gz WTMREEXTYHPEHN-MJBXVCDLSA-N 1 2 242.407 2.074 20 0 BEADLO CCOC(=O)C[N@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000053422596 363279276 /nfs/dbraw/zinc/27/92/76/363279276.db2.gz DYZPQBATAAIVGQ-JTQLQIEISA-N 1 2 239.290 2.382 20 0 BEADLO CCOC(=O)C[N@@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000053422596 363279278 /nfs/dbraw/zinc/27/92/78/363279278.db2.gz DYZPQBATAAIVGQ-JTQLQIEISA-N 1 2 239.290 2.382 20 0 BEADLO Cc1cccc(C[N@@H+]2CCO[C@@H](C3CC3)C2)n1 ZINC000334552163 353993106 /nfs/dbraw/zinc/99/31/06/353993106.db2.gz RZEVOFYTRLXSLV-CQSZACIVSA-N 1 2 232.327 2.001 20 0 BEADLO Cc1cccc(C[N@H+]2CCO[C@@H](C3CC3)C2)n1 ZINC000334552163 353993109 /nfs/dbraw/zinc/99/31/09/353993109.db2.gz RZEVOFYTRLXSLV-CQSZACIVSA-N 1 2 232.327 2.001 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2cnc(C3CC3)nc2)C1 ZINC000334559194 354008320 /nfs/dbraw/zinc/00/83/20/354008320.db2.gz MNEUUGZFYXSIDE-ZDUSSCGKSA-N 1 2 235.306 2.288 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2cnc(C3CC3)nc2)C1 ZINC000334559194 354008324 /nfs/dbraw/zinc/00/83/24/354008324.db2.gz MNEUUGZFYXSIDE-ZDUSSCGKSA-N 1 2 235.306 2.288 20 0 BEADLO Cc1nc(N(C)CCc2ccccc2O)cc[nH+]1 ZINC000343855120 354023168 /nfs/dbraw/zinc/02/31/68/354023168.db2.gz XVQKKWZJZLSMPH-UHFFFAOYSA-N 1 2 243.310 2.170 20 0 BEADLO Fc1ccc2c(c1)C[N@@H+](Cc1cnccn1)CC2 ZINC000334568188 354091238 /nfs/dbraw/zinc/09/12/38/354091238.db2.gz ZTFDEFULRSMIAC-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1ccc2c(c1)C[N@H+](Cc1cnccn1)CC2 ZINC000334568188 354091242 /nfs/dbraw/zinc/09/12/42/354091242.db2.gz ZTFDEFULRSMIAC-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO CC[C@H]1C[N@@H+]([C@@H](C)c2nnc(C)[nH]2)CCS1 ZINC000334561750 354116471 /nfs/dbraw/zinc/11/64/71/354116471.db2.gz FAKRYPYEWZUXOZ-WPRPVWTQSA-N 1 2 240.376 2.002 20 0 BEADLO CC[C@H]1C[N@H+]([C@@H](C)c2nnc(C)[nH]2)CCS1 ZINC000334561750 354116474 /nfs/dbraw/zinc/11/64/74/354116474.db2.gz FAKRYPYEWZUXOZ-WPRPVWTQSA-N 1 2 240.376 2.002 20 0 BEADLO C[N@H+](CCc1ccccc1O)Cc1ccon1 ZINC000344174646 354173268 /nfs/dbraw/zinc/17/32/68/354173268.db2.gz WOKSTJLNHNWXJK-UHFFFAOYSA-N 1 2 232.283 2.055 20 0 BEADLO C[N@@H+](CCc1ccccc1O)Cc1ccon1 ZINC000344174646 354173273 /nfs/dbraw/zinc/17/32/73/354173273.db2.gz WOKSTJLNHNWXJK-UHFFFAOYSA-N 1 2 232.283 2.055 20 0 BEADLO CC(C)(C)[C@H]1CCN(C(=O)CCn2cc[nH+]c2)C1 ZINC000344099128 354140036 /nfs/dbraw/zinc/14/00/36/354140036.db2.gz NCSGKDONABPVEH-LBPRGKRZSA-N 1 2 249.358 2.168 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)Nc1ccc(F)cc1 ZINC000344124187 354145434 /nfs/dbraw/zinc/14/54/34/354145434.db2.gz FBCPBHHGIMMJOX-UHFFFAOYSA-N 1 2 233.246 2.120 20 0 BEADLO CCC[C@@H](C)CC(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000344253580 354190720 /nfs/dbraw/zinc/19/07/20/354190720.db2.gz RWIQUJJWPBWJDT-GHMZBOCLSA-N 1 2 249.358 2.210 20 0 BEADLO CCC[C@@H](C)CC(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000344253580 354190722 /nfs/dbraw/zinc/19/07/22/354190722.db2.gz RWIQUJJWPBWJDT-GHMZBOCLSA-N 1 2 249.358 2.210 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2ccc(O)cc2)o1 ZINC000639175505 354197181 /nfs/dbraw/zinc/19/71/81/354197181.db2.gz PFIZNNBYADQQBN-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2ccc(O)cc2)o1 ZINC000639175505 354197183 /nfs/dbraw/zinc/19/71/83/354197183.db2.gz PFIZNNBYADQQBN-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CCC(F)(F)[C@H](C)C2)[nH]1 ZINC000334580751 354197263 /nfs/dbraw/zinc/19/72/63/354197263.db2.gz AZGONDBBFQAAAH-HTQZYQBOSA-N 1 2 244.289 2.151 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CCC(F)(F)[C@H](C)C2)[nH]1 ZINC000334580751 354197266 /nfs/dbraw/zinc/19/72/66/354197266.db2.gz AZGONDBBFQAAAH-HTQZYQBOSA-N 1 2 244.289 2.151 20 0 BEADLO COCC1(C)C[NH+](Cc2ccncc2Cl)C1 ZINC000529608217 324363054 /nfs/dbraw/zinc/36/30/54/324363054.db2.gz LJVXIPPBRHAXII-UHFFFAOYSA-N 1 2 240.734 2.203 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](Cc1cnn(C)c1)C2 ZINC000334603436 354283352 /nfs/dbraw/zinc/28/33/52/354283352.db2.gz YBFUXSOPEZBBTP-UHFFFAOYSA-N 1 2 227.311 2.244 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](Cc1cnn(C)c1)C2 ZINC000334603436 354283355 /nfs/dbraw/zinc/28/33/55/354283355.db2.gz YBFUXSOPEZBBTP-UHFFFAOYSA-N 1 2 227.311 2.244 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)C(C)(C)C2CC2)c2[nH+]ccn21 ZINC000334611023 354294242 /nfs/dbraw/zinc/29/42/42/354294242.db2.gz HYVQSCCHXVAJAN-KOLCDFICSA-N 1 2 247.342 2.441 20 0 BEADLO C[C@H]1C[C@H](NC(=O)C(C)(C)C2CC2)c2[nH+]ccn21 ZINC000334611027 354294540 /nfs/dbraw/zinc/29/45/40/354294540.db2.gz HYVQSCCHXVAJAN-ONGXEEELSA-N 1 2 247.342 2.441 20 0 BEADLO Cc1c[nH]nc1C[NH+]1CC(C)(C)OC(C)(C)C1 ZINC000334615534 354301726 /nfs/dbraw/zinc/30/17/26/354301726.db2.gz LWXIFGCVTXWBEF-UHFFFAOYSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1cn[nH]c1C[NH+]1CC(C)(C)OC(C)(C)C1 ZINC000334615534 354301728 /nfs/dbraw/zinc/30/17/28/354301728.db2.gz LWXIFGCVTXWBEF-UHFFFAOYSA-N 1 2 237.347 2.108 20 0 BEADLO COC[C@@H]([NH2+]Cc1cc[nH]n1)c1ccc(F)cc1 ZINC000344583401 354310730 /nfs/dbraw/zinc/31/07/30/354310730.db2.gz UANKPVWRVZTNGQ-CYBMUJFWSA-N 1 2 249.289 2.026 20 0 BEADLO Fc1cccc(C[NH2+]Cc2ccon2)c1 ZINC000086452718 491061784 /nfs/dbraw/zinc/06/17/84/491061784.db2.gz VHNGRMRCAYDRHT-UHFFFAOYSA-N 1 2 206.220 2.104 20 0 BEADLO CC[C@@H](C)C(=O)Nc1c[nH+]c2n1CCCC2 ZINC000334633985 354378774 /nfs/dbraw/zinc/37/87/74/354378774.db2.gz OMPNWYPMYVZGLM-SECBINFHSA-N 1 2 221.304 2.204 20 0 BEADLO Cc1cc(N2CC[C@H](C(C)C)C2)nc[nH+]1 ZINC000334624457 354364428 /nfs/dbraw/zinc/36/44/28/354364428.db2.gz STISVPCBSPDWIO-NSHDSACASA-N 1 2 205.305 2.267 20 0 BEADLO CCn1ccnc1C[N@@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000334669020 354409215 /nfs/dbraw/zinc/40/92/15/354409215.db2.gz OUFMVLPXFCDMPG-JTQLQIEISA-N 1 2 243.301 2.380 20 0 BEADLO CCn1ccnc1C[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000334669020 354409217 /nfs/dbraw/zinc/40/92/17/354409217.db2.gz OUFMVLPXFCDMPG-JTQLQIEISA-N 1 2 243.301 2.380 20 0 BEADLO C[C@@H]1CCC[N@H+](Cc2nnc(C(C)(C)C)[nH]2)C1 ZINC000334677130 354421119 /nfs/dbraw/zinc/42/11/19/354421119.db2.gz QBBLUPUSTAWTJS-SNVBAGLBSA-N 1 2 236.363 2.334 20 0 BEADLO C[C@@H]1CCC[N@@H+](Cc2nnc(C(C)(C)C)[nH]2)C1 ZINC000334677130 354421120 /nfs/dbraw/zinc/42/11/20/354421120.db2.gz QBBLUPUSTAWTJS-SNVBAGLBSA-N 1 2 236.363 2.334 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCC(F)(F)[C@H](C)C2)n1 ZINC000334683871 354429625 /nfs/dbraw/zinc/42/96/25/354429625.db2.gz OBQCBMLBDIDCLU-SECBINFHSA-N 1 2 241.285 2.262 20 0 BEADLO Cc1ccnc(C[N@H+]2CCC(F)(F)[C@H](C)C2)n1 ZINC000334683871 354429626 /nfs/dbraw/zinc/42/96/26/354429626.db2.gz OBQCBMLBDIDCLU-SECBINFHSA-N 1 2 241.285 2.262 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@H](C(C)(C)C)C2)on1 ZINC000334683651 354429845 /nfs/dbraw/zinc/42/98/45/354429845.db2.gz CZKVVHPDZAXVCG-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@H](C(C)(C)C)C2)on1 ZINC000334683651 354429846 /nfs/dbraw/zinc/42/98/46/354429846.db2.gz CZKVVHPDZAXVCG-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO c1n[nH]nc1C[N@@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000334652678 354445821 /nfs/dbraw/zinc/44/58/21/354445821.db2.gz RSFLESITQVIWOG-CYBMUJFWSA-N 1 2 242.326 2.184 20 0 BEADLO c1n[nH]nc1C[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000334652678 354445824 /nfs/dbraw/zinc/44/58/24/354445824.db2.gz RSFLESITQVIWOG-CYBMUJFWSA-N 1 2 242.326 2.184 20 0 BEADLO CC[C@]1(C)COCC[N@@H+]1Cc1nc(C)cs1 ZINC000334659103 354454903 /nfs/dbraw/zinc/45/49/03/354454903.db2.gz WMKAFRITHYGCCS-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO CC[C@]1(C)COCC[N@H+]1Cc1nc(C)cs1 ZINC000334659103 354454906 /nfs/dbraw/zinc/45/49/06/354454906.db2.gz WMKAFRITHYGCCS-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO Cc1nc2[nH]ccc2c(N(C)C2CCC2)[nH+]1 ZINC000334660227 354459399 /nfs/dbraw/zinc/45/93/99/354459399.db2.gz FOGNHUYDIYOVJF-UHFFFAOYSA-N 1 2 216.288 2.255 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@@H](F)C1 ZINC000334689514 354477563 /nfs/dbraw/zinc/47/75/63/354477563.db2.gz LUZMATFMHLRJAL-SNVBAGLBSA-N 1 2 237.278 2.274 20 0 BEADLO Cc1sccc1CC(=O)Nc1cc[nH+]cc1C ZINC000334690409 354479337 /nfs/dbraw/zinc/47/93/37/354479337.db2.gz DLJZBLXAQCGBEC-UHFFFAOYSA-N 1 2 246.335 2.363 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)C2(C)CCC2)c2[nH+]ccn21 ZINC000334752013 354483475 /nfs/dbraw/zinc/48/34/75/354483475.db2.gz OAPZMQTXAWEOPZ-VHSXEESVSA-N 1 2 233.315 2.195 20 0 BEADLO Cc1nc(N2CCC(C)(C)CC2)cc[nH+]1 ZINC000334737294 354539186 /nfs/dbraw/zinc/53/91/86/354539186.db2.gz GAZATFMNHPQQKK-UHFFFAOYSA-N 1 2 205.305 2.411 20 0 BEADLO C[C@H]1CC[C@@H](NC(=O)c2ccc3[nH+]ccn3c2)C1 ZINC000334699718 354492043 /nfs/dbraw/zinc/49/20/43/354492043.db2.gz RTBDDFMOFZUDOM-CMPLNLGQSA-N 1 2 243.310 2.253 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@@H](C)CC(F)(F)F)c[nH+]1 ZINC000412666701 191303420 /nfs/dbraw/zinc/30/34/20/191303420.db2.gz ZALINLWDGSPCNE-LURJTMIESA-N 1 2 249.236 2.036 20 0 BEADLO Cc1cc(C(=O)N[C@H]2C[C@@H](C)n3cc[nH+]c32)co1 ZINC000334716347 354514878 /nfs/dbraw/zinc/51/48/78/354514878.db2.gz XPNPPRJFLRMILF-KCJUWKMLSA-N 1 2 245.282 2.220 20 0 BEADLO C[C@H]1C[C@@H](Nc2cc[nH+]c(C3CC3)n2)CS1 ZINC000334808229 354564816 /nfs/dbraw/zinc/56/48/16/354564816.db2.gz WTDYAOFLNPCCTE-WCBMZHEXSA-N 1 2 235.356 2.082 20 0 BEADLO CCc1nc(C)c(C[N@@H+]2CCO[C@@H](C)[C@H]2C)o1 ZINC000334762322 354582153 /nfs/dbraw/zinc/58/21/53/354582153.db2.gz KLIBOXNISWFPMX-MNOVXSKESA-N 1 2 238.331 2.155 20 0 BEADLO CCc1nc(C)c(C[N@H+]2CCO[C@@H](C)[C@H]2C)o1 ZINC000334762322 354582155 /nfs/dbraw/zinc/58/21/55/354582155.db2.gz KLIBOXNISWFPMX-MNOVXSKESA-N 1 2 238.331 2.155 20 0 BEADLO C[C@@H]1CCCN(C(=O)[C@@H]2CCCc3[nH+]c[nH]c32)C1 ZINC000334761991 354582190 /nfs/dbraw/zinc/58/21/90/354582190.db2.gz DAHLBGUJISTYFA-GHMZBOCLSA-N 1 2 247.342 2.088 20 0 BEADLO C[C@H]1CC(C(=O)N(C)Cc2[nH]cc[nH+]2)C[C@H](C)C1 ZINC000334816022 354590345 /nfs/dbraw/zinc/59/03/45/354590345.db2.gz DFZJUPQAHJEFCZ-GHMZBOCLSA-N 1 2 249.358 2.440 20 0 BEADLO CC(C)CC(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000334743790 354547715 /nfs/dbraw/zinc/54/77/15/354547715.db2.gz NADHBEBYZVILIZ-NXEZZACHSA-N 1 2 221.304 2.051 20 0 BEADLO CCc1noc(Cc2cn3cccc(C)c3[nH+]2)n1 ZINC000349795278 366228342 /nfs/dbraw/zinc/22/83/42/366228342.db2.gz QCBXKVGBIITLAY-UHFFFAOYSA-N 1 2 242.282 2.179 20 0 BEADLO Cc1ccoc1C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000335091907 354628461 /nfs/dbraw/zinc/62/84/61/354628461.db2.gz HPUFKTIHEGOXNZ-JTQLQIEISA-N 1 2 245.282 2.288 20 0 BEADLO Cc1ccsc1C[N@@H+]1CC[S@](=O)[C@H](C)C1 ZINC000335085423 354618673 /nfs/dbraw/zinc/61/86/73/354618673.db2.gz LCAKKYAHMNJFBI-BMIGLBTASA-N 1 2 243.397 2.009 20 0 BEADLO Cc1ccsc1C[N@H+]1CC[S@](=O)[C@H](C)C1 ZINC000335085423 354618675 /nfs/dbraw/zinc/61/86/75/354618675.db2.gz LCAKKYAHMNJFBI-BMIGLBTASA-N 1 2 243.397 2.009 20 0 BEADLO FC(F)c1noc(C[N@@H+]2CCCC3(CC3)C2)n1 ZINC000335115008 354703602 /nfs/dbraw/zinc/70/36/02/354703602.db2.gz FGPYDELFAUPSIS-UHFFFAOYSA-N 1 2 243.257 2.383 20 0 BEADLO FC(F)c1noc(C[N@H+]2CCCC3(CC3)C2)n1 ZINC000335115008 354703604 /nfs/dbraw/zinc/70/36/04/354703604.db2.gz FGPYDELFAUPSIS-UHFFFAOYSA-N 1 2 243.257 2.383 20 0 BEADLO C[C@H]1CC[N@H+](Cc2nc(C(F)F)no2)[C@H]1C ZINC000335100384 354709077 /nfs/dbraw/zinc/70/90/77/354709077.db2.gz SLVWBUFCTZFBSW-BQBZGAKWSA-N 1 2 231.246 2.238 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2nc(C(F)F)no2)[C@H]1C ZINC000335100384 354709079 /nfs/dbraw/zinc/70/90/79/354709079.db2.gz SLVWBUFCTZFBSW-BQBZGAKWSA-N 1 2 231.246 2.238 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nc(C(F)F)no2)C[C@H]1C ZINC000335119086 354724610 /nfs/dbraw/zinc/72/46/10/354724610.db2.gz RNPMOSZYBHZMFF-HTQZYQBOSA-N 1 2 245.273 2.485 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nc(C(F)F)no2)C[C@H]1C ZINC000335119086 354724616 /nfs/dbraw/zinc/72/46/16/354724616.db2.gz RNPMOSZYBHZMFF-HTQZYQBOSA-N 1 2 245.273 2.485 20 0 BEADLO CC[C@@H]([NH2+]Cc1c[nH]c2ncncc12)C(F)F ZINC000639213158 354785252 /nfs/dbraw/zinc/78/52/52/354785252.db2.gz DGRHLCPLGGTQCN-SECBINFHSA-N 1 2 240.257 2.043 20 0 BEADLO CCCC1(C(=O)N[C@@H](C)Cn2cc[nH+]c2)CCC1 ZINC000345651455 354737411 /nfs/dbraw/zinc/73/74/11/354737411.db2.gz CBYMJTWIQYTBDF-LBPRGKRZSA-N 1 2 249.358 2.358 20 0 BEADLO Cc1cc(NC(=O)N(C)[C@H](C)C(C)C)cc[nH+]1 ZINC000335940749 134017352 /nfs/dbraw/zinc/01/73/52/134017352.db2.gz KWGQJYGWLRHFFG-LLVKDONJSA-N 1 2 235.331 2.320 20 0 BEADLO CC(C)c1nc(C[N@@H+]2CCC[C@H](C)C2)no1 ZINC000053602281 363416803 /nfs/dbraw/zinc/41/68/03/363416803.db2.gz ILFWKYRAYTUNLB-JTQLQIEISA-N 1 2 223.320 2.425 20 0 BEADLO CC(C)c1nc(C[N@H+]2CCC[C@H](C)C2)no1 ZINC000053602281 363416806 /nfs/dbraw/zinc/41/68/06/363416806.db2.gz ILFWKYRAYTUNLB-JTQLQIEISA-N 1 2 223.320 2.425 20 0 BEADLO OC[C@@]1(F)CCC[N@H+](Cc2ccc(Cl)o2)C1 ZINC000335147623 354861913 /nfs/dbraw/zinc/86/19/13/354861913.db2.gz KRPMQEMHHTZMJZ-LLVKDONJSA-N 1 2 247.697 2.229 20 0 BEADLO OC[C@@]1(F)CCC[N@@H+](Cc2ccc(Cl)o2)C1 ZINC000335147623 354861916 /nfs/dbraw/zinc/86/19/16/354861916.db2.gz KRPMQEMHHTZMJZ-LLVKDONJSA-N 1 2 247.697 2.229 20 0 BEADLO Cc1cc(C[NH+]2CC3(C2)CCCC3)no1 ZINC000335168278 354929342 /nfs/dbraw/zinc/92/93/42/354929342.db2.gz HNAGNAOOKIEAPB-UHFFFAOYSA-N 1 2 206.289 2.359 20 0 BEADLO C[C@H]1CC=C(C(=O)N(C)Cc2[nH+]ccn2C)CC1 ZINC000335163868 354950097 /nfs/dbraw/zinc/95/00/97/354950097.db2.gz LVWJOGJXMHOYFQ-NSHDSACASA-N 1 2 247.342 2.125 20 0 BEADLO C[C@@H](CNC(=O)[C@@H]1CC[C@@H](C)C1)Cn1cc[nH+]c1 ZINC000346525656 354975703 /nfs/dbraw/zinc/97/57/03/354975703.db2.gz LAYQNEMLEDKZLQ-FRRDWIJNSA-N 1 2 249.358 2.072 20 0 BEADLO C[C@H]1CC(C)(C)C[N@@H+]1Cc1csnn1 ZINC000335193000 355026039 /nfs/dbraw/zinc/02/60/39/355026039.db2.gz SOVHSMZAXNFAAW-QMMMGPOBSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@H]1CC(C)(C)C[N@H+]1Cc1csnn1 ZINC000335193000 355026041 /nfs/dbraw/zinc/02/60/41/355026041.db2.gz SOVHSMZAXNFAAW-QMMMGPOBSA-N 1 2 211.334 2.159 20 0 BEADLO Cc1ncc(CN(C)c2cc(C)[nH+]cn2)s1 ZINC000346736681 355089492 /nfs/dbraw/zinc/08/94/92/355089492.db2.gz MROJKPDUAJXJCG-UHFFFAOYSA-N 1 2 234.328 2.186 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CC23CCCC3)cc[nH+]1 ZINC000346847865 355136789 /nfs/dbraw/zinc/13/67/89/355136789.db2.gz VHYIVYMERLBMAJ-GFCCVEGCSA-N 1 2 230.311 2.331 20 0 BEADLO CC(C)[C@H]1C[C@@H]1c1nc(Cc2c[nH+]cn2C)no1 ZINC000346927975 355178345 /nfs/dbraw/zinc/17/83/45/355178345.db2.gz DLGWBQFQXPDNKR-MNOVXSKESA-N 1 2 246.314 2.153 20 0 BEADLO CC(C)CN(C)c1cc(NC2CC2)[nH+]cn1 ZINC000413095791 191356017 /nfs/dbraw/zinc/35/60/17/191356017.db2.gz NSZGLBXEQLVSBC-UHFFFAOYSA-N 1 2 220.320 2.143 20 0 BEADLO CC(C)CN(C)c1cc(NC2CC2)nc[nH+]1 ZINC000413095791 191356019 /nfs/dbraw/zinc/35/60/19/191356019.db2.gz NSZGLBXEQLVSBC-UHFFFAOYSA-N 1 2 220.320 2.143 20 0 BEADLO c1nc(N2C[C@H]3CCC[C@@H]3C2)cc(NC2CC2)[nH+]1 ZINC000413177517 191361445 /nfs/dbraw/zinc/36/14/45/191361445.db2.gz AXNRWFUBNIUQBW-GHMZBOCLSA-N 1 2 244.342 2.287 20 0 BEADLO c1nc(NC2CC2)cc(N2C[C@H]3CCC[C@@H]3C2)[nH+]1 ZINC000413177517 191361448 /nfs/dbraw/zinc/36/14/48/191361448.db2.gz AXNRWFUBNIUQBW-GHMZBOCLSA-N 1 2 244.342 2.287 20 0 BEADLO c1c[nH+]c(COCCOCC2CCCC2)[nH]1 ZINC000413005737 191338232 /nfs/dbraw/zinc/33/82/32/191338232.db2.gz ZVHBQKLYQMCBFI-UHFFFAOYSA-N 1 2 224.304 2.133 20 0 BEADLO C[C@@H]1C[C@@H]1CNc1cc(NC2CC2)nc[nH+]1 ZINC000413055406 191351745 /nfs/dbraw/zinc/35/17/45/191351745.db2.gz QUZYLLHYJOYJJV-RKDXNWHRSA-N 1 2 218.304 2.119 20 0 BEADLO C[C@@H]1C[C@@H]1CNc1cc(NC2CC2)[nH+]cn1 ZINC000413055406 191351747 /nfs/dbraw/zinc/35/17/47/191351747.db2.gz QUZYLLHYJOYJJV-RKDXNWHRSA-N 1 2 218.304 2.119 20 0 BEADLO Cc1nc(NC[C@H]2CCC[C@@H]2C2CC2)cc[nH+]1 ZINC000413481658 191387500 /nfs/dbraw/zinc/38/75/00/191387500.db2.gz NXKMTPJTIQRAHC-CHWSQXEVSA-N 1 2 231.343 2.445 20 0 BEADLO C[C@@H]1C[C@@H](CNc2cccc[nH+]2)[C@H](C)O1 ZINC000413539441 191394265 /nfs/dbraw/zinc/39/42/65/191394265.db2.gz UBNIGBSDNOTLNU-VWYCJHECSA-N 1 2 206.289 2.307 20 0 BEADLO C[C@H]1CC[C@@H](CNc2cc[nH+]c3ccncc23)O1 ZINC000413370854 191377061 /nfs/dbraw/zinc/37/70/61/191377061.db2.gz DGNHBBLETUFKBB-QWRGUYRKSA-N 1 2 243.310 2.031 20 0 BEADLO Cc1cc(N[C@H]2C[C@@H](OC(C)C)C2)nc[nH+]1 ZINC000413383311 191378476 /nfs/dbraw/zinc/37/84/76/191378476.db2.gz BHLHRNPNMQUPBA-PHIMTYICSA-N 1 2 221.304 2.153 20 0 BEADLO Cc1cnc(C[NH+]2CC(CC(F)(F)F)C2)o1 ZINC000639252691 355289629 /nfs/dbraw/zinc/28/96/29/355289629.db2.gz PYDOINSFMLDTHF-UHFFFAOYSA-N 1 2 234.221 2.367 20 0 BEADLO CSc1ccc(C[NH+]2CC(C)(O)C2)s1 ZINC000639253249 355290214 /nfs/dbraw/zinc/29/02/14/355290214.db2.gz BVIVIGHOTNYQDQ-UHFFFAOYSA-N 1 2 229.370 2.037 20 0 BEADLO Cc1cc(C[NH+]2CC(C)(O)C2)ccc1Cl ZINC000639253697 355291801 /nfs/dbraw/zinc/29/18/01/355291801.db2.gz NXRHDFZDRPBOND-UHFFFAOYSA-N 1 2 225.719 2.215 20 0 BEADLO CCOC1(C)C[NH+](Cc2cc(C)ns2)C1 ZINC000639254540 355295496 /nfs/dbraw/zinc/29/54/96/355295496.db2.gz YVZIRABHNDOERH-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO COc1ccc[nH+]c1N[C@H](C)[C@H]1CCCOC1 ZINC000388856712 355301747 /nfs/dbraw/zinc/30/17/47/355301747.db2.gz GRVXFGGBPBVBDB-MNOVXSKESA-N 1 2 236.315 2.317 20 0 BEADLO c1cc(C[N@@H+]2CCO[C@@H](C3CCC3)C2)sn1 ZINC000639261047 355310957 /nfs/dbraw/zinc/31/09/57/355310957.db2.gz KJICMKUGZCBSQI-GFCCVEGCSA-N 1 2 238.356 2.144 20 0 BEADLO c1cc(C[N@H+]2CCO[C@@H](C3CCC3)C2)sn1 ZINC000639261047 355310958 /nfs/dbraw/zinc/31/09/58/355310958.db2.gz KJICMKUGZCBSQI-GFCCVEGCSA-N 1 2 238.356 2.144 20 0 BEADLO CCOC1(C)C[NH+]([C@H](C)c2cnc(C)nc2C)C1 ZINC000639269050 355330511 /nfs/dbraw/zinc/33/05/11/355330511.db2.gz ZVOSUEGNPCFDCI-LLVKDONJSA-N 1 2 249.358 2.265 20 0 BEADLO CC(C)c1nc(N2CCC[C@H](CO)[C@H]2C)cc[nH+]1 ZINC000413599835 191398918 /nfs/dbraw/zinc/39/89/18/191398918.db2.gz XKAXXVPRAOSCGP-VXGBXAGGSA-N 1 2 249.358 2.197 20 0 BEADLO COc1cc(C[NH+]2CC3(CC(F)C3)C2)sn1 ZINC000639252194 355286429 /nfs/dbraw/zinc/28/64/29/355286429.db2.gz AMEIACBFDYQZQS-UHFFFAOYSA-N 1 2 242.319 2.086 20 0 BEADLO CC(C)[C@H](C)N(C)C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000583508978 355345756 /nfs/dbraw/zinc/34/57/56/355345756.db2.gz ZPLFPPMOOCPQMM-QWRGUYRKSA-N 1 2 237.347 2.091 20 0 BEADLO CC(C)[C@H](C)N(C)C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000583508978 355345760 /nfs/dbraw/zinc/34/57/60/355345760.db2.gz ZPLFPPMOOCPQMM-QWRGUYRKSA-N 1 2 237.347 2.091 20 0 BEADLO C[C@H](N[C@H](c1[nH+]ccn1C)C1CC1)C(F)(F)F ZINC000639276838 355353467 /nfs/dbraw/zinc/35/34/67/355353467.db2.gz GSMXOHFHYWPNAX-CBAPKCEASA-N 1 2 247.264 2.412 20 0 BEADLO Cc1ccc(CN2CCn3c[nH+]cc3C2)cc1F ZINC000335779263 355406412 /nfs/dbraw/zinc/40/64/12/355406412.db2.gz JPNKYMGUOJJGBE-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO CCc1cncc(C(=O)Nc2cc[nH+]cc2C)c1 ZINC000335815902 355505025 /nfs/dbraw/zinc/50/50/25/355505025.db2.gz FJXHKAQGTWUURE-UHFFFAOYSA-N 1 2 241.294 2.022 20 0 BEADLO C[C@H]([NH2+][C@H]1CCCc2c1cnn2C)c1ccon1 ZINC000349830955 355488206 /nfs/dbraw/zinc/48/82/06/355488206.db2.gz GMLSQDIPJAGAKY-CABZTGNLSA-N 1 2 246.314 2.136 20 0 BEADLO C[NH2+]Cc1noc(Cc2ccccc2SC)n1 ZINC000349939310 355532767 /nfs/dbraw/zinc/53/27/67/355532767.db2.gz ZXAUFGABBZHJKX-UHFFFAOYSA-N 1 2 249.339 2.102 20 0 BEADLO CCc1cc[nH+]cc1N[C@H](C)Cc1cnccn1 ZINC000639293507 355533906 /nfs/dbraw/zinc/53/39/06/355533906.db2.gz CVLFVLXXGLZWHG-LLVKDONJSA-N 1 2 242.326 2.477 20 0 BEADLO C[NH2+]Cc1noc(C[C@H](C)c2cccc(F)c2)n1 ZINC000349878338 355515720 /nfs/dbraw/zinc/51/57/20/355515720.db2.gz ITSSRIUCYFQCHV-VIFPVBQESA-N 1 2 249.289 2.274 20 0 BEADLO C[NH2+]Cc1noc(C[C@H](C)c2ccc(F)cc2)n1 ZINC000349899618 355522290 /nfs/dbraw/zinc/52/22/90/355522290.db2.gz WILLCCFSCJUPBS-VIFPVBQESA-N 1 2 249.289 2.274 20 0 BEADLO C[NH2+]Cc1noc(C2(c3cccc(C)c3)CC2)n1 ZINC000349920638 355527447 /nfs/dbraw/zinc/52/74/47/355527447.db2.gz KRPYMOBMZDYQCK-UHFFFAOYSA-N 1 2 243.310 2.177 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cc(C)ns2)[C@H](C)CO1 ZINC000639298615 355613524 /nfs/dbraw/zinc/61/35/24/355613524.db2.gz ZZHRLVSJTFKBCV-MNOVXSKESA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cc(C)ns2)[C@H](C)CO1 ZINC000639298615 355613527 /nfs/dbraw/zinc/61/35/27/355613527.db2.gz ZZHRLVSJTFKBCV-MNOVXSKESA-N 1 2 240.372 2.451 20 0 BEADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2[nH]ncc2C)on1 ZINC000335835713 355563147 /nfs/dbraw/zinc/56/31/47/355563147.db2.gz IKRWSGJOMFDHNZ-LBPRGKRZSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2[nH]ncc2C)on1 ZINC000335835713 355563152 /nfs/dbraw/zinc/56/31/52/355563152.db2.gz IKRWSGJOMFDHNZ-LBPRGKRZSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2n[nH]cc2C)on1 ZINC000335835713 355563154 /nfs/dbraw/zinc/56/31/54/355563154.db2.gz IKRWSGJOMFDHNZ-LBPRGKRZSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2n[nH]cc2C)on1 ZINC000335835713 355563158 /nfs/dbraw/zinc/56/31/58/355563158.db2.gz IKRWSGJOMFDHNZ-LBPRGKRZSA-N 1 2 246.314 2.352 20 0 BEADLO C[C@@H]1[N@H+](Cc2ccc(F)cn2)CCOC1(C)C ZINC000335837749 355566556 /nfs/dbraw/zinc/56/65/56/355566556.db2.gz FLLKMJYXDTZUQP-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H]1[N@@H+](Cc2ccc(F)cn2)CCOC1(C)C ZINC000335837749 355566558 /nfs/dbraw/zinc/56/65/58/355566558.db2.gz FLLKMJYXDTZUQP-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H]1[N@H+](Cc2ccc(F)cn2)CCOC1(C)C ZINC000335837752 355566585 /nfs/dbraw/zinc/56/65/85/355566585.db2.gz FLLKMJYXDTZUQP-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H]1[N@@H+](Cc2ccc(F)cn2)CCOC1(C)C ZINC000335837752 355566589 /nfs/dbraw/zinc/56/65/89/355566589.db2.gz FLLKMJYXDTZUQP-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO CC1=CCC[N@@H+](Cc2ncnn2C(C)C)C1 ZINC000335873278 355640713 /nfs/dbraw/zinc/64/07/13/355640713.db2.gz BEWPOVKWOQRMJA-UHFFFAOYSA-N 1 2 220.320 2.011 20 0 BEADLO CC1=CCC[N@H+](Cc2ncnn2C(C)C)C1 ZINC000335873278 355640717 /nfs/dbraw/zinc/64/07/17/355640717.db2.gz BEWPOVKWOQRMJA-UHFFFAOYSA-N 1 2 220.320 2.011 20 0 BEADLO CCc1nocc1C[N@H+]1C[C@H](C)OC[C@H]1CC ZINC000350240532 355654307 /nfs/dbraw/zinc/65/43/07/355654307.db2.gz LYLQYJIJTUJHII-CMPLNLGQSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1nocc1C[N@@H+]1C[C@H](C)OC[C@H]1CC ZINC000350240532 355654311 /nfs/dbraw/zinc/65/43/11/355654311.db2.gz LYLQYJIJTUJHII-CMPLNLGQSA-N 1 2 238.331 2.236 20 0 BEADLO CCC[C@H](CNc1cc(COC)cc[nH+]1)OC ZINC000639310023 355666573 /nfs/dbraw/zinc/66/65/73/355666573.db2.gz BBYBKVIEIXDAGT-GFCCVEGCSA-N 1 2 238.331 2.455 20 0 BEADLO CC[C@](C)(CNc1cc(COC)cc[nH+]1)OC ZINC000639313650 355691470 /nfs/dbraw/zinc/69/14/70/355691470.db2.gz UZAWTBPBZJORDJ-CYBMUJFWSA-N 1 2 238.331 2.455 20 0 BEADLO C[C@@H](Cc1ccsc1)[N@@H+]1Cc2cnn(C)c2C1 ZINC000639321708 355722760 /nfs/dbraw/zinc/72/27/60/355722760.db2.gz YGBNCDJBQUESCT-JTQLQIEISA-N 1 2 247.367 2.428 20 0 BEADLO C[C@@H](Cc1ccsc1)[N@H+]1Cc2cnn(C)c2C1 ZINC000639321708 355722763 /nfs/dbraw/zinc/72/27/63/355722763.db2.gz YGBNCDJBQUESCT-JTQLQIEISA-N 1 2 247.367 2.428 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@@H]2C(N)=O)c(C)s1 ZINC000335882876 355672933 /nfs/dbraw/zinc/67/29/33/355672933.db2.gz YVYUNOWMZDLKMP-SNVBAGLBSA-N 1 2 239.344 2.260 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@@H]2C(N)=O)c(C)s1 ZINC000335882876 355672936 /nfs/dbraw/zinc/67/29/36/355672936.db2.gz YVYUNOWMZDLKMP-SNVBAGLBSA-N 1 2 239.344 2.260 20 0 BEADLO COc1ncc(C[N@@H+]2CCC[C@H](F)C2)s1 ZINC000639312882 355684495 /nfs/dbraw/zinc/68/44/95/355684495.db2.gz KERQSTMVALFZRB-QMMMGPOBSA-N 1 2 230.308 2.086 20 0 BEADLO COc1ncc(C[N@H+]2CCC[C@H](F)C2)s1 ZINC000639312882 355684496 /nfs/dbraw/zinc/68/44/96/355684496.db2.gz KERQSTMVALFZRB-QMMMGPOBSA-N 1 2 230.308 2.086 20 0 BEADLO CCc1nc(C[N@H+](C)[C@@H](C)C(C)C)no1 ZINC000350629038 355734496 /nfs/dbraw/zinc/73/44/96/355734496.db2.gz LBBYRMZCNQBYTN-VIFPVBQESA-N 1 2 211.309 2.108 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@@H](C)C(C)C)no1 ZINC000350629038 355734499 /nfs/dbraw/zinc/73/44/99/355734499.db2.gz LBBYRMZCNQBYTN-VIFPVBQESA-N 1 2 211.309 2.108 20 0 BEADLO CCC[C@H](C[N@H+](C)Cc1nnc(C)s1)OC ZINC000639332239 355757818 /nfs/dbraw/zinc/75/78/18/355757818.db2.gz HBPYBMSBBKBNJS-SNVBAGLBSA-N 1 2 243.376 2.093 20 0 BEADLO CCC[C@H](C[N@@H+](C)Cc1nnc(C)s1)OC ZINC000639332239 355757820 /nfs/dbraw/zinc/75/78/20/355757820.db2.gz HBPYBMSBBKBNJS-SNVBAGLBSA-N 1 2 243.376 2.093 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CC(C)(C)O[C@@H]2CCC[C@H]21 ZINC000336011865 134051906 /nfs/dbraw/zinc/05/19/06/134051906.db2.gz IVMIHEZNRRATQB-CHWSQXEVSA-N 1 2 249.358 2.250 20 0 BEADLO COC(=O)[C@H](CC(C)C)[NH2+][C@@H]1CC[C@@H]1SC ZINC000425343500 191816166 /nfs/dbraw/zinc/81/61/66/191816166.db2.gz RSXFETVJYMUQBI-VWYCJHECSA-N 1 2 245.388 2.058 20 0 BEADLO CN(C)c1c[nH+]cc(N[C@@H]2CO[C@@H](C3CC3)C2)c1 ZINC000639362935 355818774 /nfs/dbraw/zinc/81/87/74/355818774.db2.gz MXOBPJBWSZZBGH-GXTWGEPZSA-N 1 2 247.342 2.127 20 0 BEADLO CCC[C@@H](CNc1c[nH+]cc(N(C)C)c1)OC ZINC000639365647 355838608 /nfs/dbraw/zinc/83/86/08/355838608.db2.gz QNBYXOFGOTVWRX-ZDUSSCGKSA-N 1 2 237.347 2.375 20 0 BEADLO C[C@H]1CSC[C@H]1Nc1c[nH+]cc(N(C)C)c1 ZINC000639365877 355841251 /nfs/dbraw/zinc/84/12/51/355841251.db2.gz SJUYESWYSYLHDA-JOYOIKCWSA-N 1 2 237.372 2.311 20 0 BEADLO CCCC[C@@H](C)[C@H](C)[NH2+]Cc1c[nH]nn1 ZINC000628363808 355850275 /nfs/dbraw/zinc/85/02/75/355850275.db2.gz YHPWVTXHJFDCLW-ZJUUUORDSA-N 1 2 210.325 2.109 20 0 BEADLO CCCC[C@@H](C)[C@H](C)[NH2+]Cc1cn[nH]n1 ZINC000628363808 355850279 /nfs/dbraw/zinc/85/02/79/355850279.db2.gz YHPWVTXHJFDCLW-ZJUUUORDSA-N 1 2 210.325 2.109 20 0 BEADLO C[C@H](O)C[N@@H+]1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000192756308 134061423 /nfs/dbraw/zinc/06/14/23/134061423.db2.gz VPJUGPWUQPCJSZ-VIFPVBQESA-N 1 2 248.301 2.046 20 0 BEADLO C[C@H](O)C[N@H+]1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000192756308 134061424 /nfs/dbraw/zinc/06/14/24/134061424.db2.gz VPJUGPWUQPCJSZ-VIFPVBQESA-N 1 2 248.301 2.046 20 0 BEADLO CC(C)CCCNC(=O)CCCn1cc[nH+]c1 ZINC000623254410 355854296 /nfs/dbraw/zinc/85/42/96/355854296.db2.gz RJETXFDFXYHTEG-UHFFFAOYSA-N 1 2 237.347 2.216 20 0 BEADLO C[C@H]1C[C@@H](Nc2c[nH+]cc(N(C)C)c2)CS1 ZINC000639363693 355829303 /nfs/dbraw/zinc/82/93/03/355829303.db2.gz FAJZNFJSUPVAFD-GXSJLCMTSA-N 1 2 237.372 2.454 20 0 BEADLO CC(C)C1(CNC(=O)[C@@H](C)Cc2c[nH+]c[nH]2)CC1 ZINC000583639558 355940511 /nfs/dbraw/zinc/94/05/11/355940511.db2.gz KELREHKYCLQJSI-NSHDSACASA-N 1 2 249.358 2.141 20 0 BEADLO CC(C)C1(CNC(=O)[C@@H](C)Cc2c[nH]c[nH+]2)CC1 ZINC000583639558 355940514 /nfs/dbraw/zinc/94/05/14/355940514.db2.gz KELREHKYCLQJSI-NSHDSACASA-N 1 2 249.358 2.141 20 0 BEADLO CC(C)CCCCC(=O)N[C@H]1Cc2c[nH+]cn2C1 ZINC000623256715 355973531 /nfs/dbraw/zinc/97/35/31/355973531.db2.gz RLQFAHHIDRHCSX-LBPRGKRZSA-N 1 2 249.358 2.140 20 0 BEADLO CCc1ccc(CNc2cccc(CO)[nH+]2)o1 ZINC000351323705 355979416 /nfs/dbraw/zinc/97/94/16/355979416.db2.gz FKUUYCURLRPHHV-UHFFFAOYSA-N 1 2 232.283 2.341 20 0 BEADLO Cc1ccccc1CNc1cccc(CO)[nH+]1 ZINC000351403149 355984323 /nfs/dbraw/zinc/98/43/23/355984323.db2.gz BIOFXFYFBREVOP-UHFFFAOYSA-N 1 2 228.295 2.494 20 0 BEADLO CCC[N@H+](C)Cc1noc(C)c1C(=O)OCC ZINC000351441794 355992682 /nfs/dbraw/zinc/99/26/82/355992682.db2.gz KCEPNUHOMFOUAF-UHFFFAOYSA-N 1 2 240.303 2.002 20 0 BEADLO CCC[N@@H+](C)Cc1noc(C)c1C(=O)OCC ZINC000351441794 355992685 /nfs/dbraw/zinc/99/26/85/355992685.db2.gz KCEPNUHOMFOUAF-UHFFFAOYSA-N 1 2 240.303 2.002 20 0 BEADLO Cc1cc(N2CC[C@@H](O)[C@H](C)C2)nc(C(C)C)[nH+]1 ZINC000167094007 355955989 /nfs/dbraw/zinc/95/59/89/355955989.db2.gz BMGACAWZFPIHOB-ZYHUDNBSSA-N 1 2 249.358 2.116 20 0 BEADLO Cc1nc([C@H](C)[N@H+](C)CCc2ccccn2)no1 ZINC000351714127 356067910 /nfs/dbraw/zinc/06/79/10/356067910.db2.gz ZICRUJKZUKZELG-JTQLQIEISA-N 1 2 246.314 2.009 20 0 BEADLO Cc1nc([C@H](C)[N@@H+](C)CCc2ccccn2)no1 ZINC000351714127 356067915 /nfs/dbraw/zinc/06/79/15/356067915.db2.gz ZICRUJKZUKZELG-JTQLQIEISA-N 1 2 246.314 2.009 20 0 BEADLO Cc1ncc(C[NH2+]C(C)(C)c2nccs2)cn1 ZINC000351891921 356158226 /nfs/dbraw/zinc/15/82/26/356158226.db2.gz RKECEKOJLZHKIN-UHFFFAOYSA-N 1 2 248.355 2.266 20 0 BEADLO C[N@H+](Cc1nnc2n1CCCCC2)[C@@H]1CC1(C)C ZINC000336092604 134078786 /nfs/dbraw/zinc/07/87/86/134078786.db2.gz FQOMMHDUVJADMD-LLVKDONJSA-N 1 2 248.374 2.235 20 0 BEADLO C[N@@H+](Cc1nnc2n1CCCCC2)[C@@H]1CC1(C)C ZINC000336092604 134078787 /nfs/dbraw/zinc/07/87/87/134078787.db2.gz FQOMMHDUVJADMD-LLVKDONJSA-N 1 2 248.374 2.235 20 0 BEADLO CCCCN(C)C(=O)Cc1cn2ccccc2[nH+]1 ZINC000041292162 168760349 /nfs/dbraw/zinc/76/03/49/168760349.db2.gz GYQWFPZQBREUMN-UHFFFAOYSA-N 1 2 245.326 2.135 20 0 BEADLO C[C@H](c1ccccc1)[N@@H+]1CC[S@](=O)[C@H](C)C1 ZINC000351898276 356170187 /nfs/dbraw/zinc/17/01/87/356170187.db2.gz PEQRKMGCQCDXAU-HSMVNMDESA-N 1 2 237.368 2.200 20 0 BEADLO C[C@H](c1ccccc1)[N@H+]1CC[S@](=O)[C@H](C)C1 ZINC000351898276 356170191 /nfs/dbraw/zinc/17/01/91/356170191.db2.gz PEQRKMGCQCDXAU-HSMVNMDESA-N 1 2 237.368 2.200 20 0 BEADLO CC[C@H]1CCN1c1[nH+]c(C)nc2[nH]ccc21 ZINC000336093844 134079382 /nfs/dbraw/zinc/07/93/82/134079382.db2.gz JBSPYVNPTSYBBL-VIFPVBQESA-N 1 2 216.288 2.255 20 0 BEADLO CCOC1CC(C(=O)Nc2c(C)cc[nH+]c2C)C1 ZINC000425595883 192019004 /nfs/dbraw/zinc/01/90/04/192019004.db2.gz KHGDCPMNWZYDOR-UHFFFAOYSA-N 1 2 248.326 2.452 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@@H]1[C@H]1CCC[C@H](C)C1 ZINC000639428939 356208918 /nfs/dbraw/zinc/20/89/18/356208918.db2.gz ZJDMZAPBADQWHG-SRVKXCTJSA-N 1 2 238.375 2.369 20 0 BEADLO CC[C@H](C)CCNC(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000617641462 356257378 /nfs/dbraw/zinc/25/73/78/356257378.db2.gz OQSBLOFEFPFZDK-WDEREUQCSA-N 1 2 249.358 2.067 20 0 BEADLO CC[C@H](C)CCNC(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000617641462 356257380 /nfs/dbraw/zinc/25/73/80/356257380.db2.gz OQSBLOFEFPFZDK-WDEREUQCSA-N 1 2 249.358 2.067 20 0 BEADLO CC[C@@H](C)CCNC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000617643205 356258769 /nfs/dbraw/zinc/25/87/69/356258769.db2.gz OUYWXXRNUQELDO-GHMZBOCLSA-N 1 2 237.347 2.141 20 0 BEADLO CC[C@@H](C)CCNC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000617643205 356258770 /nfs/dbraw/zinc/25/87/70/356258770.db2.gz OUYWXXRNUQELDO-GHMZBOCLSA-N 1 2 237.347 2.141 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)c1ncccc1Cl ZINC000336111956 134086782 /nfs/dbraw/zinc/08/67/82/134086782.db2.gz RTURJCYGSHRYFA-UHFFFAOYSA-N 1 2 222.679 2.095 20 0 BEADLO CCc1cncc(C(=O)Nc2cc[nH+]c(C)c2)c1 ZINC000336252043 356323539 /nfs/dbraw/zinc/32/35/39/356323539.db2.gz GGPAPJZRNKHTRM-UHFFFAOYSA-N 1 2 241.294 2.022 20 0 BEADLO CCC(F)(F)C[NH+]1CCC(CCO)CC1 ZINC000639493563 356315601 /nfs/dbraw/zinc/31/56/01/356315601.db2.gz NORJVEFDDOAUFH-UHFFFAOYSA-N 1 2 221.291 2.126 20 0 BEADLO C[C@@H]1CCC[N@@H+]1Cc1nnc(C(C)(C)C)[nH]1 ZINC000336137330 134096323 /nfs/dbraw/zinc/09/63/23/134096323.db2.gz KOQUGDLAYBQTLX-SECBINFHSA-N 1 2 222.336 2.087 20 0 BEADLO C[C@@H]1CCC[N@H+]1Cc1nnc(C(C)(C)C)[nH]1 ZINC000336137330 134096324 /nfs/dbraw/zinc/09/63/24/134096324.db2.gz KOQUGDLAYBQTLX-SECBINFHSA-N 1 2 222.336 2.087 20 0 BEADLO C[C@H]1CCC[N@@H+]1Cc1nnc(C(C)(C)C)[nH]1 ZINC000336137331 134096427 /nfs/dbraw/zinc/09/64/27/134096427.db2.gz KOQUGDLAYBQTLX-VIFPVBQESA-N 1 2 222.336 2.087 20 0 BEADLO C[C@H]1CCC[N@H+]1Cc1nnc(C(C)(C)C)[nH]1 ZINC000336137331 134096428 /nfs/dbraw/zinc/09/64/28/134096428.db2.gz KOQUGDLAYBQTLX-VIFPVBQESA-N 1 2 222.336 2.087 20 0 BEADLO FC(F)C[C@@H]1COCC[N@@H+]1CCC(F)(F)F ZINC000353267329 134097715 /nfs/dbraw/zinc/09/77/15/134097715.db2.gz LWYWRBRGWQWCJJ-SSDOTTSWSA-N 1 2 247.207 2.295 20 0 BEADLO FC(F)C[C@@H]1COCC[N@H+]1CCC(F)(F)F ZINC000353267329 134097716 /nfs/dbraw/zinc/09/77/16/134097716.db2.gz LWYWRBRGWQWCJJ-SSDOTTSWSA-N 1 2 247.207 2.295 20 0 BEADLO CCc1[nH+]c(C)ccc1OCCC1(O)CC1 ZINC000352542321 356378137 /nfs/dbraw/zinc/37/81/37/356378137.db2.gz MEEAHTGUIROPIN-UHFFFAOYSA-N 1 2 221.300 2.246 20 0 BEADLO CC(=O)C[NH2+]C1(c2nc(C)cs2)CCCC1 ZINC000639534795 356386965 /nfs/dbraw/zinc/38/69/65/356386965.db2.gz DOODLFRJLZXQIS-UHFFFAOYSA-N 1 2 238.356 2.399 20 0 BEADLO CC1(C)C[N@H+](Cc2csnn2)[C@H]1C1CC1 ZINC000336561865 356392474 /nfs/dbraw/zinc/39/24/74/356392474.db2.gz IQRAIXUSLKSIJI-JTQLQIEISA-N 1 2 223.345 2.159 20 0 BEADLO CC1(C)C[N@@H+](Cc2csnn2)[C@H]1C1CC1 ZINC000336561865 356392478 /nfs/dbraw/zinc/39/24/78/356392478.db2.gz IQRAIXUSLKSIJI-JTQLQIEISA-N 1 2 223.345 2.159 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCC[C@H]([C@H](C)O)C1 ZINC000639543730 356403198 /nfs/dbraw/zinc/40/31/98/356403198.db2.gz OCMSLYHMDJVXFQ-UWVGGRQHSA-N 1 2 221.291 2.125 20 0 BEADLO CCC(F)(F)C[N@H+]1CCC[C@H]([C@H](C)O)C1 ZINC000639543730 356403200 /nfs/dbraw/zinc/40/32/00/356403200.db2.gz OCMSLYHMDJVXFQ-UWVGGRQHSA-N 1 2 221.291 2.125 20 0 BEADLO Clc1ccc(NCCn2cc[nH+]c2)nc1 ZINC000041050998 358504951 /nfs/dbraw/zinc/50/49/51/358504951.db2.gz AXCSBNUVPUMJQC-UHFFFAOYSA-N 1 2 222.679 2.044 20 0 BEADLO CC[C@@H]1C[C@@H](Nc2cc(C)[nH+]cn2)CCO1 ZINC000420616764 192248956 /nfs/dbraw/zinc/24/89/56/192248956.db2.gz ICCNBFURPPXNCZ-WDEREUQCSA-N 1 2 221.304 2.155 20 0 BEADLO CC[C@H]1C[C@@H](Nc2cc(C)[nH+]cn2)CCO1 ZINC000420616763 192248983 /nfs/dbraw/zinc/24/89/83/192248983.db2.gz ICCNBFURPPXNCZ-QWRGUYRKSA-N 1 2 221.304 2.155 20 0 BEADLO CCCc1csc(C[NH2+]CCF)n1 ZINC000379372897 356448307 /nfs/dbraw/zinc/44/83/07/356448307.db2.gz KDQPERCPFSDOSU-UHFFFAOYSA-N 1 2 202.298 2.155 20 0 BEADLO CC(C)c1nc(N2C[C@H](C)C[C@@H](CO)C2)cc[nH+]1 ZINC000420640575 192253961 /nfs/dbraw/zinc/25/39/61/192253961.db2.gz YVKUOISKPZGSNE-VXGBXAGGSA-N 1 2 249.358 2.055 20 0 BEADLO Cc1cc(CNc2ncccn2)cc(C)[nH+]1 ZINC000420655975 192256171 /nfs/dbraw/zinc/25/61/71/192256171.db2.gz SRZVDMCSHKKWTN-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO C[C@H](C[N@H+](CCO)CC(F)F)c1ccccc1 ZINC000193029134 356494082 /nfs/dbraw/zinc/49/40/82/356494082.db2.gz SECQHFWXSRSZCA-LLVKDONJSA-N 1 2 243.297 2.350 20 0 BEADLO C[C@H](C[N@@H+](CCO)CC(F)F)c1ccccc1 ZINC000193029134 356494085 /nfs/dbraw/zinc/49/40/85/356494085.db2.gz SECQHFWXSRSZCA-LLVKDONJSA-N 1 2 243.297 2.350 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCOCC2(CC2)C1 ZINC000639575247 356498392 /nfs/dbraw/zinc/49/83/92/356498392.db2.gz AFSZFDUONZOKLX-UHFFFAOYSA-N 1 2 219.275 2.144 20 0 BEADLO CCC(F)(F)C[N@H+]1CCOCC2(CC2)C1 ZINC000639575247 356498395 /nfs/dbraw/zinc/49/83/95/356498395.db2.gz AFSZFDUONZOKLX-UHFFFAOYSA-N 1 2 219.275 2.144 20 0 BEADLO C[C@@H]1CCCN(C(=O)CCCn2cc[nH+]c2)CC1 ZINC000623290965 356505386 /nfs/dbraw/zinc/50/53/86/356505386.db2.gz LGPKBYALSCOBNT-CYBMUJFWSA-N 1 2 249.358 2.312 20 0 BEADLO Cn1cc(Cl)c(C[N@H+](C)CC2CCC2)n1 ZINC000420910138 192270424 /nfs/dbraw/zinc/27/04/24/192270424.db2.gz DVOQCKCUNJIPBT-UHFFFAOYSA-N 1 2 227.739 2.305 20 0 BEADLO Cn1cc(Cl)c(C[N@@H+](C)CC2CCC2)n1 ZINC000420910138 192270427 /nfs/dbraw/zinc/27/04/27/192270427.db2.gz DVOQCKCUNJIPBT-UHFFFAOYSA-N 1 2 227.739 2.305 20 0 BEADLO CCC(F)(F)C[N@H+]1CC=C(COC)CC1 ZINC000639592058 356509161 /nfs/dbraw/zinc/50/91/61/356509161.db2.gz JBPSVXHSNDLPBS-UHFFFAOYSA-N 1 2 219.275 2.310 20 0 BEADLO CCC(F)(F)C[N@@H+]1CC=C(COC)CC1 ZINC000639592058 356509165 /nfs/dbraw/zinc/50/91/65/356509165.db2.gz JBPSVXHSNDLPBS-UHFFFAOYSA-N 1 2 219.275 2.310 20 0 BEADLO CC(=O)C[N@@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000639592376 356509810 /nfs/dbraw/zinc/50/98/10/356509810.db2.gz JRAOVSSCKPZBIK-OAHLLOKOSA-N 1 2 245.322 2.097 20 0 BEADLO CC(=O)C[N@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000639592376 356509814 /nfs/dbraw/zinc/50/98/14/356509814.db2.gz JRAOVSSCKPZBIK-OAHLLOKOSA-N 1 2 245.322 2.097 20 0 BEADLO C[C@@H](N(C)c1cc(CO)cc[nH+]1)C1(C)CC1 ZINC000385330741 491094320 /nfs/dbraw/zinc/09/43/20/491094320.db2.gz QJGLUWJHTFUWAS-SNVBAGLBSA-N 1 2 220.316 2.199 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccnc(C)n2)C[C@H](CC)O1 ZINC000420959698 192281407 /nfs/dbraw/zinc/28/14/07/192281407.db2.gz QPLWAMJUAQYQMR-OKILXGFUSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccnc(C)n2)C[C@H](CC)O1 ZINC000420959698 192281410 /nfs/dbraw/zinc/28/14/10/192281410.db2.gz QPLWAMJUAQYQMR-OKILXGFUSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[NH+](Cc2cc(C)no2)C[C@@H](CC)O1 ZINC000420964305 192282925 /nfs/dbraw/zinc/28/29/25/192282925.db2.gz WQMJDBWHEARWGV-VXGBXAGGSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C)no2)C[C@H](CC)O1 ZINC000420964304 192283758 /nfs/dbraw/zinc/28/37/58/192283758.db2.gz WQMJDBWHEARWGV-TXEJJXNPSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C)no2)C[C@H](CC)O1 ZINC000420964304 192283761 /nfs/dbraw/zinc/28/37/61/192283761.db2.gz WQMJDBWHEARWGV-TXEJJXNPSA-N 1 2 238.331 2.372 20 0 BEADLO Fc1cccc(F)c1C[N@@H+]1CC[C@@]12CCOC2 ZINC000421028631 192309058 /nfs/dbraw/zinc/30/90/58/192309058.db2.gz WNVWDTNNQNZAKD-ZDUSSCGKSA-N 1 2 239.265 2.330 20 0 BEADLO Fc1cccc(F)c1C[N@H+]1CC[C@@]12CCOC2 ZINC000421028631 192309059 /nfs/dbraw/zinc/30/90/59/192309059.db2.gz WNVWDTNNQNZAKD-ZDUSSCGKSA-N 1 2 239.265 2.330 20 0 BEADLO CC[C@@H](C)CCC(=O)N[C@H]1CCn2c[nH+]cc2C1 ZINC000623299828 356560032 /nfs/dbraw/zinc/56/00/32/356560032.db2.gz DISBQNLPTOQKLB-NEPJUHHUSA-N 1 2 249.358 2.140 20 0 BEADLO O[C@H]1C[C@@H](C[NH2+]c2ccc(-n3cccn3)cc2)C1 ZINC000421193681 192314062 /nfs/dbraw/zinc/31/40/62/192314062.db2.gz YXLVLLVIOIBNMD-VDISTLRHSA-N 1 2 243.310 2.055 20 0 BEADLO C[C@H]1C[N@H+](Cc2nc(C3CCC3)no2)[C@H]1C ZINC000639657460 356572535 /nfs/dbraw/zinc/57/25/35/356572535.db2.gz ZFNPBKCNOJXZRY-IUCAKERBSA-N 1 2 221.304 2.177 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nc(C3CCC3)no2)[C@H]1C ZINC000639657460 356572537 /nfs/dbraw/zinc/57/25/37/356572537.db2.gz ZFNPBKCNOJXZRY-IUCAKERBSA-N 1 2 221.304 2.177 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)NCc2c[nH+]c[nH]2)C[C@H]1C ZINC000449908394 202050917 /nfs/dbraw/zinc/05/09/17/202050917.db2.gz UKZDRIIRTDGVJX-MXWKQRLJSA-N 1 2 235.331 2.098 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)NCc2c[nH]c[nH+]2)C[C@H]1C ZINC000449908394 202050922 /nfs/dbraw/zinc/05/09/22/202050922.db2.gz UKZDRIIRTDGVJX-MXWKQRLJSA-N 1 2 235.331 2.098 20 0 BEADLO Fc1cc(F)cc(C[NH2+][C@H]2CCn3ccnc32)c1 ZINC000336208371 134133434 /nfs/dbraw/zinc/13/34/34/134133434.db2.gz FWUTZEKXCIIYNS-LBPRGKRZSA-N 1 2 249.264 2.396 20 0 BEADLO CC(C)n1cc[nH+]c1CN1C[C@H](C)OC[C@@H]1C ZINC000336208977 134134041 /nfs/dbraw/zinc/13/40/41/134134041.db2.gz VGSITOOHKNKRIO-RYUDHWBXSA-N 1 2 237.347 2.073 20 0 BEADLO CCC[N@H+](C)Cc1nn(C)c(C)c1Cl ZINC000421320126 192316917 /nfs/dbraw/zinc/31/69/17/192316917.db2.gz AJRLVEGGVNEDLR-UHFFFAOYSA-N 1 2 215.728 2.224 20 0 BEADLO CCC[N@@H+](C)Cc1nn(C)c(C)c1Cl ZINC000421320126 192316919 /nfs/dbraw/zinc/31/69/19/192316919.db2.gz AJRLVEGGVNEDLR-UHFFFAOYSA-N 1 2 215.728 2.224 20 0 BEADLO O[C@@H]1CCC[C@H](Nc2ccc3ccccc3[nH+]2)C1 ZINC000613537819 363478421 /nfs/dbraw/zinc/47/84/21/363478421.db2.gz JIWFSKGSEFHCIU-QWHCGFSZSA-N 1 2 242.322 2.372 20 0 BEADLO CCC(F)(F)C[N@@H+]1CC[C@H](OC)[C@H](C)C1 ZINC000639661910 356575954 /nfs/dbraw/zinc/57/59/54/356575954.db2.gz BPJZUCXINASALZ-ZJUUUORDSA-N 1 2 221.291 2.389 20 0 BEADLO CCC(F)(F)C[N@H+]1CC[C@H](OC)[C@H](C)C1 ZINC000639661910 356575956 /nfs/dbraw/zinc/57/59/56/356575956.db2.gz BPJZUCXINASALZ-ZJUUUORDSA-N 1 2 221.291 2.389 20 0 BEADLO CCCC[C@@H](C)C(=O)N[C@@H]1CCn2c[nH+]cc2C1 ZINC000623301921 356577373 /nfs/dbraw/zinc/57/73/73/356577373.db2.gz WHNHSDYMYBYHGV-VXGBXAGGSA-N 1 2 249.358 2.140 20 0 BEADLO CCC[C@H](C)CC(=O)N[C@@H]1CCn2c[nH+]cc2C1 ZINC000623304028 356594384 /nfs/dbraw/zinc/59/43/84/356594384.db2.gz PMWCMDTZLMMZSJ-NWDGAFQWSA-N 1 2 249.358 2.140 20 0 BEADLO CCC(F)(F)C[N@@H+]1C[C@@H]2C[C@H]1CS2 ZINC000639670643 356586089 /nfs/dbraw/zinc/58/60/89/356586089.db2.gz FBGGBQWIVYXUDD-YUMQZZPRSA-N 1 2 207.289 2.221 20 0 BEADLO CCC(F)(F)C[N@H+]1C[C@@H]2C[C@H]1CS2 ZINC000639670643 356586091 /nfs/dbraw/zinc/58/60/91/356586091.db2.gz FBGGBQWIVYXUDD-YUMQZZPRSA-N 1 2 207.289 2.221 20 0 BEADLO Fc1cccc2c1C[N@H+](CCc1cnccn1)C2 ZINC000639670317 356586135 /nfs/dbraw/zinc/58/61/35/356586135.db2.gz GBVIGZWXNLBHMZ-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1cccc2c1C[N@@H+](CCc1cnccn1)C2 ZINC000639670317 356586140 /nfs/dbraw/zinc/58/61/40/356586140.db2.gz GBVIGZWXNLBHMZ-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO COc1ccc2[nH+]c(N(C)[C@H](C)CO)ccc2c1 ZINC000152962890 538465793 /nfs/dbraw/zinc/46/57/93/538465793.db2.gz MNKAUIUWJNJJDJ-SNVBAGLBSA-N 1 2 246.310 2.060 20 0 BEADLO COc1ccc2[nH+]c(N(C)[C@@H](C)CO)ccc2c1 ZINC000152962778 538465827 /nfs/dbraw/zinc/46/58/27/538465827.db2.gz MNKAUIUWJNJJDJ-JTQLQIEISA-N 1 2 246.310 2.060 20 0 BEADLO CCC[C@@H](C)[C@@H](CO)Nc1cccc[nH+]1 ZINC000578136524 366311068 /nfs/dbraw/zinc/31/10/68/366311068.db2.gz RJEUPSXJXXMCQC-GHMZBOCLSA-N 1 2 208.305 2.291 20 0 BEADLO C[C@H](c1noc(C[NH+](C)C)n1)C(C)(C)C ZINC000350641846 366312601 /nfs/dbraw/zinc/31/26/01/366312601.db2.gz CAKSGYIPIYLPHF-MRVPVSSYSA-N 1 2 211.309 2.281 20 0 BEADLO CN(C)c1nc(NC2CCC2)[nH+]c2ccccc21 ZINC000450326319 202129353 /nfs/dbraw/zinc/12/93/53/202129353.db2.gz XYISAQBDBAYODS-UHFFFAOYSA-N 1 2 242.326 2.082 20 0 BEADLO C[C@@H](N[C@H](C)C(C)(F)F)c1[nH+]ccn1C ZINC000389458873 356678870 /nfs/dbraw/zinc/67/88/70/356678870.db2.gz DBIQZQRVFCZGFG-HTQZYQBOSA-N 1 2 217.263 2.114 20 0 BEADLO CC[C@@H]1CN(C(=O)Nc2cc[nH+]c(C)c2)CCO1 ZINC000179835268 366320178 /nfs/dbraw/zinc/32/01/78/366320178.db2.gz RMLDNOKCJLESIS-GFCCVEGCSA-N 1 2 249.314 2.033 20 0 BEADLO C[C@@H](c1nccc(N)n1)[N@H+](C)Cc1cccs1 ZINC000578140749 366320394 /nfs/dbraw/zinc/32/03/94/366320394.db2.gz SJBPSAXQKDQTDH-VIFPVBQESA-N 1 2 248.355 2.144 20 0 BEADLO C[C@@H](c1nccc(N)n1)[N@@H+](C)Cc1cccs1 ZINC000578140749 366320396 /nfs/dbraw/zinc/32/03/96/366320396.db2.gz SJBPSAXQKDQTDH-VIFPVBQESA-N 1 2 248.355 2.144 20 0 BEADLO C[C@H](O)[C@H](C)SCc1c[nH+]c2ccccn12 ZINC000179900519 366331188 /nfs/dbraw/zinc/33/11/88/366331188.db2.gz NEMWJGAPOHJEOR-UWVGGRQHSA-N 1 2 236.340 2.337 20 0 BEADLO CCn1nccc1C[NH2+][C@H](C)C(C)(F)F ZINC000389471620 356684022 /nfs/dbraw/zinc/68/40/22/356684022.db2.gz RTRNNXVXQSUASU-MRVPVSSYSA-N 1 2 217.263 2.036 20 0 BEADLO Cc1cc(N[C@H]2CCCC2(F)F)c(C#N)c[nH+]1 ZINC000399460299 356703344 /nfs/dbraw/zinc/70/33/44/356703344.db2.gz VBTDAUKAUJTFBA-NSHDSACASA-N 1 2 237.253 2.283 20 0 BEADLO CCn1cc[nH+]c1CNc1cnccc1C ZINC000070958470 325047488 /nfs/dbraw/zinc/04/74/88/325047488.db2.gz RBRDKBZAZXXOCV-UHFFFAOYSA-N 1 2 216.288 2.219 20 0 BEADLO CCn1ccnc1CNc1c[nH+]ccc1C ZINC000070958470 325047490 /nfs/dbraw/zinc/04/74/90/325047490.db2.gz RBRDKBZAZXXOCV-UHFFFAOYSA-N 1 2 216.288 2.219 20 0 BEADLO CCc1nc(C[NH+]2CCC(CC)CC2)no1 ZINC000054337583 363567243 /nfs/dbraw/zinc/56/72/43/363567243.db2.gz TZEUVJCABXPVPH-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO C[C@@H](CO)CSc1[nH+]cc2ccccn21 ZINC000154738923 538652783 /nfs/dbraw/zinc/65/27/83/538652783.db2.gz IFDDDVRZWQVMCT-VIFPVBQESA-N 1 2 222.313 2.055 20 0 BEADLO CC1(C)CC[C@H](NC(=O)CCc2[nH]cc[nH+]2)C1 ZINC000355724135 356771465 /nfs/dbraw/zinc/77/14/65/356771465.db2.gz DDQDXKZXUIRQGT-JTQLQIEISA-N 1 2 235.331 2.037 20 0 BEADLO CSCC[N@H+](C)Cc1nnc(C(C)C)s1 ZINC000450493175 202185664 /nfs/dbraw/zinc/18/56/64/202185664.db2.gz ACIUDWIMWDWICA-UHFFFAOYSA-N 1 2 245.417 2.456 20 0 BEADLO CSCC[N@@H+](C)Cc1nnc(C(C)C)s1 ZINC000450493175 202185666 /nfs/dbraw/zinc/18/56/66/202185666.db2.gz ACIUDWIMWDWICA-UHFFFAOYSA-N 1 2 245.417 2.456 20 0 BEADLO CCc1cnc(CNc2ccc(CO)c[nH+]2)s1 ZINC000356289191 356792378 /nfs/dbraw/zinc/79/23/78/356792378.db2.gz AJZIXAFMDMYHGC-UHFFFAOYSA-N 1 2 249.339 2.205 20 0 BEADLO CO[C@H]1C[N@@H+]([C@H](C)c2ccccc2F)CCO1 ZINC000639832351 356817063 /nfs/dbraw/zinc/81/70/63/356817063.db2.gz GHJKCMXJJRSAHT-ZWNOBZJWSA-N 1 2 239.290 2.191 20 0 BEADLO CO[C@H]1C[N@H+]([C@H](C)c2ccccc2F)CCO1 ZINC000639832351 356817064 /nfs/dbraw/zinc/81/70/64/356817064.db2.gz GHJKCMXJJRSAHT-ZWNOBZJWSA-N 1 2 239.290 2.191 20 0 BEADLO CO[C@@H]1C[N@@H+]([C@H](C)c2ccc(F)cc2)CCO1 ZINC000639836594 356821980 /nfs/dbraw/zinc/82/19/80/356821980.db2.gz UZFMGBDJIUPTFB-MFKMUULPSA-N 1 2 239.290 2.191 20 0 BEADLO CO[C@@H]1C[N@H+]([C@H](C)c2ccc(F)cc2)CCO1 ZINC000639836594 356821983 /nfs/dbraw/zinc/82/19/83/356821983.db2.gz UZFMGBDJIUPTFB-MFKMUULPSA-N 1 2 239.290 2.191 20 0 BEADLO CO[C@H]1C[N@H+](Cc2cc3ccccc3o2)CCO1 ZINC000639835006 356824764 /nfs/dbraw/zinc/82/47/64/356824764.db2.gz ALZUNXYZPIHHSM-CQSZACIVSA-N 1 2 247.294 2.238 20 0 BEADLO CO[C@H]1C[N@@H+](Cc2cc3ccccc3o2)CCO1 ZINC000639835006 356824767 /nfs/dbraw/zinc/82/47/67/356824767.db2.gz ALZUNXYZPIHHSM-CQSZACIVSA-N 1 2 247.294 2.238 20 0 BEADLO CC(C)C(C)(C)CNC(=O)CCc1c[nH+]c[nH]1 ZINC000281992152 538719532 /nfs/dbraw/zinc/71/95/32/538719532.db2.gz VSMTXTHFSKEDMZ-UHFFFAOYSA-N 1 2 237.347 2.141 20 0 BEADLO CC(C)C(C)(C)CNC(=O)CCc1c[nH]c[nH+]1 ZINC000281992152 538719537 /nfs/dbraw/zinc/71/95/37/538719537.db2.gz VSMTXTHFSKEDMZ-UHFFFAOYSA-N 1 2 237.347 2.141 20 0 BEADLO CC(C)C[C@@H]1CCCN1C(=O)CCc1c[nH+]c[nH]1 ZINC000352739455 538725694 /nfs/dbraw/zinc/72/56/94/538725694.db2.gz NCCBNZAPKXWCIG-ZDUSSCGKSA-N 1 2 249.358 2.379 20 0 BEADLO CC(C)C[C@@H]1CCCN1C(=O)CCc1c[nH]c[nH+]1 ZINC000352739455 538725699 /nfs/dbraw/zinc/72/56/99/538725699.db2.gz NCCBNZAPKXWCIG-ZDUSSCGKSA-N 1 2 249.358 2.379 20 0 BEADLO CC[C@@H](O)CCCNc1cc(C)[nH+]c(C2CC2)n1 ZINC000361097525 356917515 /nfs/dbraw/zinc/91/75/15/356917515.db2.gz PJOMIJLXJBWZSK-GFCCVEGCSA-N 1 2 249.358 2.047 20 0 BEADLO CC[C@H](Nc1cc[nH+]c(C(C)C)n1)C(F)F ZINC000450570507 202201097 /nfs/dbraw/zinc/20/10/97/202201097.db2.gz QIKFFSARFPTAAS-QMMMGPOBSA-N 1 2 229.274 2.478 20 0 BEADLO CC[N@@H+](Cc1nc(C(C)C)no1)C[C@@H](C)OC ZINC000361557635 356932631 /nfs/dbraw/zinc/93/26/31/356932631.db2.gz BMDVZMRXWFFOMG-SNVBAGLBSA-N 1 2 241.335 2.050 20 0 BEADLO CC[N@H+](Cc1nc(C(C)C)no1)C[C@@H](C)OC ZINC000361557635 356932634 /nfs/dbraw/zinc/93/26/34/356932634.db2.gz BMDVZMRXWFFOMG-SNVBAGLBSA-N 1 2 241.335 2.050 20 0 BEADLO CCN(c1cc(C)[nH+]c(C2CC2)n1)[C@H]1CCOC1 ZINC000359967942 356898874 /nfs/dbraw/zinc/89/88/74/356898874.db2.gz LPECKHWOXYMQEX-LBPRGKRZSA-N 1 2 247.342 2.278 20 0 BEADLO COc1ccc[nH+]c1N[C@H](C)COC(C)C ZINC000390673396 357111108 /nfs/dbraw/zinc/11/11/08/357111108.db2.gz WEURLUPYZQJIPG-SNVBAGLBSA-N 1 2 224.304 2.316 20 0 BEADLO CCC(CC)[C@H](C)C(=O)NCc1c[nH+]cn1C ZINC000355264904 538792173 /nfs/dbraw/zinc/79/21/73/538792173.db2.gz KNFHAEHTASKMDL-JTQLQIEISA-N 1 2 237.347 2.109 20 0 BEADLO CCO[C@H]1C[C@H](Nc2c[nH]c[nH+]2)C12CCC2 ZINC000390493580 357096582 /nfs/dbraw/zinc/09/65/82/357096582.db2.gz RDPVZMJCMKVTNM-UWVGGRQHSA-N 1 2 221.304 2.169 20 0 BEADLO CCc1nc(C[N@@H+]2CC[C@@H](c3ccco3)C2)no1 ZINC000374003350 357152582 /nfs/dbraw/zinc/15/25/82/357152582.db2.gz PKTPJIFNGOKGOL-SNVBAGLBSA-N 1 2 247.298 2.215 20 0 BEADLO CCc1nc(C[N@H+]2CC[C@@H](c3ccco3)C2)no1 ZINC000374003350 357152585 /nfs/dbraw/zinc/15/25/85/357152585.db2.gz PKTPJIFNGOKGOL-SNVBAGLBSA-N 1 2 247.298 2.215 20 0 BEADLO CC(=O)C[NH2+][C@H](C(F)F)C1CCCCC1 ZINC000639884039 357157478 /nfs/dbraw/zinc/15/74/78/357157478.db2.gz IEBSHSUERIFKSR-JTQLQIEISA-N 1 2 219.275 2.379 20 0 BEADLO CCc1nc(C[NH+]2[C@@H](C)CC[C@@H]2C)no1 ZINC000123032556 357205174 /nfs/dbraw/zinc/20/51/74/357205174.db2.gz PCGIIDJRFJJWNL-IUCAKERBSA-N 1 2 209.293 2.005 20 0 BEADLO Clc1cnc(C[N@@H+]2C[C@@H]3C[C@@H]3C2)s1 ZINC000628411096 357219889 /nfs/dbraw/zinc/21/98/89/357219889.db2.gz YDSYUCSNSRTIER-KNVOCYPGSA-N 1 2 214.721 2.248 20 0 BEADLO Clc1cnc(C[N@H+]2C[C@@H]3C[C@@H]3C2)s1 ZINC000628411096 357219892 /nfs/dbraw/zinc/21/98/92/357219892.db2.gz YDSYUCSNSRTIER-KNVOCYPGSA-N 1 2 214.721 2.248 20 0 BEADLO CC(C)(F)CN[C@H](c1[nH]cc[nH+]1)c1cccnc1 ZINC000631663864 357231498 /nfs/dbraw/zinc/23/14/98/357231498.db2.gz QCHBQLPZMOSEED-NSHDSACASA-N 1 2 248.305 2.232 20 0 BEADLO CC(C)(F)C[NH2+][C@H](c1ncc[nH]1)c1cccnc1 ZINC000631663864 357231499 /nfs/dbraw/zinc/23/14/99/357231499.db2.gz QCHBQLPZMOSEED-NSHDSACASA-N 1 2 248.305 2.232 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cocn2)C[C@H](C)C1(F)F ZINC000628392291 357188479 /nfs/dbraw/zinc/18/84/79/357188479.db2.gz NPHGQTCGUCXDKD-DTORHVGOSA-N 1 2 230.258 2.398 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cocn2)C[C@H](C)C1(F)F ZINC000628392291 357188484 /nfs/dbraw/zinc/18/84/84/357188484.db2.gz NPHGQTCGUCXDKD-DTORHVGOSA-N 1 2 230.258 2.398 20 0 BEADLO Cc1c[nH]c(C[NH+]2C[C@H](C)C(F)(F)[C@@H](C)C2)n1 ZINC000628392699 357189436 /nfs/dbraw/zinc/18/94/36/357189436.db2.gz VEOLLVOCLIWGSO-IUCAKERBSA-N 1 2 243.301 2.441 20 0 BEADLO CCOc1ccccc1C[NH+]1CC2(C1)CCCO2 ZINC000628426642 357255082 /nfs/dbraw/zinc/25/50/82/357255082.db2.gz CNSHJQPNWVHVJV-UHFFFAOYSA-N 1 2 247.338 2.450 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2CCCC23CC3)cc[nH+]1 ZINC000639900151 357312314 /nfs/dbraw/zinc/31/23/14/357312314.db2.gz IYFMOJRJHDNVOS-GFCCVEGCSA-N 1 2 245.326 2.266 20 0 BEADLO Cc1cscc1CNC(=O)CCc1c[nH+]c[nH]1 ZINC000357401727 538828442 /nfs/dbraw/zinc/82/84/42/538828442.db2.gz GXIPBQXMPZONNO-UHFFFAOYSA-N 1 2 249.339 2.029 20 0 BEADLO Cc1cscc1CNC(=O)CCc1c[nH]c[nH+]1 ZINC000357401727 538828445 /nfs/dbraw/zinc/82/84/45/538828445.db2.gz GXIPBQXMPZONNO-UHFFFAOYSA-N 1 2 249.339 2.029 20 0 BEADLO CN(C(=O)CCc1c[nH+]c[nH]1)[C@H]1CCC(C)(C)C1 ZINC000357675467 538832227 /nfs/dbraw/zinc/83/22/27/538832227.db2.gz NCGADMHDWLCSGF-LBPRGKRZSA-N 1 2 249.358 2.379 20 0 BEADLO CN(C(=O)CCc1c[nH]c[nH+]1)[C@H]1CCC(C)(C)C1 ZINC000357675467 538832231 /nfs/dbraw/zinc/83/22/31/538832231.db2.gz NCGADMHDWLCSGF-LBPRGKRZSA-N 1 2 249.358 2.379 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)c2ccsc2)[nH+]1 ZINC000582612819 357352483 /nfs/dbraw/zinc/35/24/83/357352483.db2.gz YGNMBZLJVDPKNW-UHFFFAOYSA-N 1 2 249.339 2.445 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000582735418 357376912 /nfs/dbraw/zinc/37/69/12/357376912.db2.gz GZYYUNMQETUXFN-GIPNMCIBSA-N 1 2 235.331 2.269 20 0 BEADLO COC1(CNc2nc(C)[nH+]cc2C)CCCCC1 ZINC000582616764 357354087 /nfs/dbraw/zinc/35/40/87/357354087.db2.gz QIIYYMMIMKGSPY-UHFFFAOYSA-N 1 2 249.358 2.277 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CC(C)=C[C@@H](C)C1 ZINC000582855975 357421293 /nfs/dbraw/zinc/42/12/93/357421293.db2.gz HOMRVKJCOHLKSG-SECBINFHSA-N 1 2 217.316 2.496 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000583005206 357455610 /nfs/dbraw/zinc/45/56/10/357455610.db2.gz OWCFGPDOKODNTK-YPMHNXCESA-N 1 2 247.342 2.093 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+](CC)Cc1ccoc1 ZINC000102517435 357477546 /nfs/dbraw/zinc/47/75/46/357477546.db2.gz QSVRWXZWSLSDIS-JTQLQIEISA-N 1 2 225.288 2.053 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+](CC)Cc1ccoc1 ZINC000102517435 357477548 /nfs/dbraw/zinc/47/75/48/357477548.db2.gz QSVRWXZWSLSDIS-JTQLQIEISA-N 1 2 225.288 2.053 20 0 BEADLO C[C@H]1CCC[C@H]1CNc1[nH+]cnc2c1cnn2C ZINC000230695541 357566975 /nfs/dbraw/zinc/56/69/75/357566975.db2.gz YVJWIVFYIPFDFD-UWVGGRQHSA-N 1 2 245.330 2.211 20 0 BEADLO Cc1ccc(F)c(C[NH2+]Cc2ccn(C)n2)c1 ZINC000231608756 357611570 /nfs/dbraw/zinc/61/15/70/357611570.db2.gz DVFYGXOGRQNKRP-UHFFFAOYSA-N 1 2 233.290 2.157 20 0 BEADLO CCc1[nH+]c(C)ccc1OCCC(C)(C)O ZINC000232204093 357653546 /nfs/dbraw/zinc/65/35/46/357653546.db2.gz RABUOBPXBYVONN-UHFFFAOYSA-N 1 2 223.316 2.492 20 0 BEADLO CCC(=O)CC[N@@H+]1CCO[C@@H](c2ccco2)C1 ZINC000190272868 357698257 /nfs/dbraw/zinc/69/82/57/357698257.db2.gz VAPVCAPDPBAKFK-CYBMUJFWSA-N 1 2 237.299 2.022 20 0 BEADLO CCC(=O)CC[N@H+]1CCO[C@@H](c2ccco2)C1 ZINC000190272868 357698260 /nfs/dbraw/zinc/69/82/60/357698260.db2.gz VAPVCAPDPBAKFK-CYBMUJFWSA-N 1 2 237.299 2.022 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@H]1CCC[C@@H]1SCC ZINC000233699556 357732934 /nfs/dbraw/zinc/73/29/34/357732934.db2.gz PMIZLZJHJCDLEV-DCAQKATOSA-N 1 2 245.388 2.202 20 0 BEADLO C[C@H](CC(=O)N1CCC[C@@H](C)[C@H]1C)n1cc[nH+]c1 ZINC000583266500 357765162 /nfs/dbraw/zinc/76/51/62/357765162.db2.gz LXLFIRYEEDLRBE-JHJVBQTASA-N 1 2 249.358 2.481 20 0 BEADLO Cc1nocc1C[NH2+][C@@H](C)c1cscn1 ZINC000397932939 357801951 /nfs/dbraw/zinc/80/19/51/357801951.db2.gz VLXIGUPIYVNMMD-QMMMGPOBSA-N 1 2 223.301 2.290 20 0 BEADLO C[C@H]1C[C@@H](Nc2nc[nH+]c(N)c2Cl)CS1 ZINC000397998560 357821366 /nfs/dbraw/zinc/82/13/66/357821366.db2.gz RKYNSLDUQJKVFL-NTSWFWBYSA-N 1 2 244.751 2.018 20 0 BEADLO C[C@H]1C[C@@H](Nc2[nH+]cnc(N)c2Cl)CS1 ZINC000397998560 357821368 /nfs/dbraw/zinc/82/13/68/357821368.db2.gz RKYNSLDUQJKVFL-NTSWFWBYSA-N 1 2 244.751 2.018 20 0 BEADLO CC[C@H]([NH2+]Cc1ncccn1)c1c(C)noc1C ZINC000192179676 357826362 /nfs/dbraw/zinc/82/63/62/357826362.db2.gz LATUVDCLLWDMAK-NSHDSACASA-N 1 2 246.314 2.322 20 0 BEADLO COc1cccc2c1cc[nH+]c2NC[C@H](C)O ZINC000234914060 357836642 /nfs/dbraw/zinc/83/66/42/357836642.db2.gz BBXDJHOMYCPGNS-VIFPVBQESA-N 1 2 232.283 2.036 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@H](C)[C@@H](C)c1ccccc1 ZINC000193097293 357867272 /nfs/dbraw/zinc/86/72/72/357867272.db2.gz GLWJGVMAWUBBFY-IJLUTSLNSA-N 1 2 235.327 2.330 20 0 BEADLO COc1ncccc1C[N@H+](C)Cc1ccco1 ZINC000193292669 357873373 /nfs/dbraw/zinc/87/33/73/357873373.db2.gz ZQONWAMZLQCZEA-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1ncccc1C[N@@H+](C)Cc1ccco1 ZINC000193292669 357873375 /nfs/dbraw/zinc/87/33/75/357873375.db2.gz ZQONWAMZLQCZEA-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO CCCc1ncc(CNCc2[nH]c(C)c(C)[nH+]2)o1 ZINC000583764572 357938476 /nfs/dbraw/zinc/93/84/76/357938476.db2.gz MKZYBWFVMJQMEI-UHFFFAOYSA-N 1 2 248.330 2.257 20 0 BEADLO c1ccc([C@@H]2CCC[N@H+]2Cc2ncccn2)nc1 ZINC000583787826 357942600 /nfs/dbraw/zinc/94/26/00/357942600.db2.gz XGAFYJGFVPTRGV-ZDUSSCGKSA-N 1 2 240.310 2.209 20 0 BEADLO c1ccc([C@@H]2CCC[N@@H+]2Cc2ncccn2)nc1 ZINC000583787826 357942603 /nfs/dbraw/zinc/94/26/03/357942603.db2.gz XGAFYJGFVPTRGV-ZDUSSCGKSA-N 1 2 240.310 2.209 20 0 BEADLO CC[N@H+](Cc1snnc1C)Cc1ccccn1 ZINC000583790849 357946095 /nfs/dbraw/zinc/94/60/95/357946095.db2.gz RDUAXFVBFAESMT-UHFFFAOYSA-N 1 2 248.355 2.264 20 0 BEADLO CC[N@@H+](Cc1snnc1C)Cc1ccccn1 ZINC000583790849 357946097 /nfs/dbraw/zinc/94/60/97/357946097.db2.gz RDUAXFVBFAESMT-UHFFFAOYSA-N 1 2 248.355 2.264 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1cc2ccccc2[nH]1 ZINC000610619734 358025640 /nfs/dbraw/zinc/02/56/40/358025640.db2.gz PDFQTZHGXKBSPY-JTQLQIEISA-N 1 2 246.310 2.161 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1cc2ccccc2[nH]1 ZINC000610619734 358025643 /nfs/dbraw/zinc/02/56/43/358025643.db2.gz PDFQTZHGXKBSPY-JTQLQIEISA-N 1 2 246.310 2.161 20 0 BEADLO CCc1nnc(C[NH+]2CCC(CCF)CC2)o1 ZINC000639987990 358027120 /nfs/dbraw/zinc/02/71/20/358027120.db2.gz UTOFEHBMWQGHMK-UHFFFAOYSA-N 1 2 241.310 2.204 20 0 BEADLO CC[C@@H](C)C[NH2+]c1ccc(-n2cnnn2)c(C)c1 ZINC000037103987 358065370 /nfs/dbraw/zinc/06/53/70/358065370.db2.gz YMRAWOOXNQYCQK-SNVBAGLBSA-N 1 2 245.330 2.429 20 0 BEADLO CC(C)[N@H+](Cc1ccccn1)Cc1ncccn1 ZINC000584564799 358066154 /nfs/dbraw/zinc/06/61/54/358066154.db2.gz XANHKXPUOKHRDS-UHFFFAOYSA-N 1 2 242.326 2.282 20 0 BEADLO CC(C)[N@@H+](Cc1ccccn1)Cc1ncccn1 ZINC000584564799 358066158 /nfs/dbraw/zinc/06/61/58/358066158.db2.gz XANHKXPUOKHRDS-UHFFFAOYSA-N 1 2 242.326 2.282 20 0 BEADLO CCOC1CCN(c2nc(C)[nH+]c(C)c2C)CC1 ZINC000301700546 535400680 /nfs/dbraw/zinc/40/06/80/535400680.db2.gz SDVMXRVCHXBFOY-UHFFFAOYSA-N 1 2 249.358 2.407 20 0 BEADLO CCOC1CCN(c2cc[nH+]c(C3CC3)n2)CC1 ZINC000301231003 535400705 /nfs/dbraw/zinc/40/07/05/535400705.db2.gz HNYWEMWVFHENAC-UHFFFAOYSA-N 1 2 247.342 2.359 20 0 BEADLO Cc1ccc(-c2noc(CCn3cc[nH+]c3)n2)o1 ZINC000350808837 358143472 /nfs/dbraw/zinc/14/34/72/358143472.db2.gz OCESZTLWOSUQSA-UHFFFAOYSA-N 1 2 244.254 2.077 20 0 BEADLO CCOCc1nc(CCc2[nH+]cccc2C)no1 ZINC000351126327 358158030 /nfs/dbraw/zinc/15/80/30/358158030.db2.gz DGDLQBVSKAITKB-UHFFFAOYSA-N 1 2 247.298 2.095 20 0 BEADLO Cc1nc([C@@H](C)[NH+]2CCC(C)(F)CC2)no1 ZINC000640071280 358155111 /nfs/dbraw/zinc/15/51/11/358155111.db2.gz HVVVFRKHBYDCEL-MRVPVSSYSA-N 1 2 227.283 2.263 20 0 BEADLO Cn1cc(Cl)c(C[NH+]2CCC(C)(F)CC2)n1 ZINC000640073098 358172136 /nfs/dbraw/zinc/17/21/36/358172136.db2.gz LKJVRFORWLVQKZ-UHFFFAOYSA-N 1 2 245.729 2.398 20 0 BEADLO C[C@@H](c1csnn1)[N@H+](C)CCc1ccncc1 ZINC000450651161 202224633 /nfs/dbraw/zinc/22/46/33/202224633.db2.gz MNQLZUGTTXVLDL-JTQLQIEISA-N 1 2 248.355 2.169 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+](C)CCc1ccncc1 ZINC000450651161 202224636 /nfs/dbraw/zinc/22/46/36/202224636.db2.gz MNQLZUGTTXVLDL-JTQLQIEISA-N 1 2 248.355 2.169 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC=CC1 ZINC000640129386 358206965 /nfs/dbraw/zinc/20/69/65/358206965.db2.gz XZZHDRPXEJCYHU-UHFFFAOYSA-N 1 2 217.272 2.102 20 0 BEADLO Cc1cc(C[NH2+]Cc2cc(O)cc(F)c2)no1 ZINC000223123296 358221425 /nfs/dbraw/zinc/22/14/25/358221425.db2.gz FTBGONGAQLFQEP-UHFFFAOYSA-N 1 2 236.246 2.118 20 0 BEADLO Cc1nc(NC[C@@H]2CCO[C@@H](C(C)C)C2)cc[nH+]1 ZINC000450733834 202248860 /nfs/dbraw/zinc/24/88/60/202248860.db2.gz ANLFJWBCXMLOMR-CHWSQXEVSA-N 1 2 249.358 2.070 20 0 BEADLO CC[C@](C)(CNc1cc(C)[nH+]c(C2CC2)n1)OC ZINC000450712871 202240890 /nfs/dbraw/zinc/24/08/90/202240890.db2.gz JJDIZGCDZQKELZ-CQSZACIVSA-N 1 2 249.358 2.311 20 0 BEADLO CC(C)N1CC[N@H+](CC2=CCCCC2)CC1=O ZINC000450710880 202241850 /nfs/dbraw/zinc/24/18/50/202241850.db2.gz QSLUNNGHWXMUKE-UHFFFAOYSA-N 1 2 236.359 2.039 20 0 BEADLO CC(C)N1CC[N@@H+](CC2=CCCCC2)CC1=O ZINC000450710880 202241853 /nfs/dbraw/zinc/24/18/53/202241853.db2.gz QSLUNNGHWXMUKE-UHFFFAOYSA-N 1 2 236.359 2.039 20 0 BEADLO O=C(C1CC1)[C@@H]1C[N@H+](CC2=CCCCC2)CCO1 ZINC000450758580 202257803 /nfs/dbraw/zinc/25/78/03/202257803.db2.gz NQBIKYCAOGMRSH-AWEZNQCLSA-N 1 2 249.354 2.167 20 0 BEADLO O=C(C1CC1)[C@@H]1C[N@@H+](CC2=CCCCC2)CCO1 ZINC000450758580 202257805 /nfs/dbraw/zinc/25/78/05/202257805.db2.gz NQBIKYCAOGMRSH-AWEZNQCLSA-N 1 2 249.354 2.167 20 0 BEADLO FC1(F)CC[NH+](Cc2cncc(Cl)n2)CC1 ZINC000584648188 358302868 /nfs/dbraw/zinc/30/28/68/358302868.db2.gz BSFNOBCYKJFHGJ-UHFFFAOYSA-N 1 2 247.676 2.361 20 0 BEADLO O=C(C1CC1)[C@H]1C[N@H+](CC2=CCCCC2)CCO1 ZINC000450758581 202258863 /nfs/dbraw/zinc/25/88/63/202258863.db2.gz NQBIKYCAOGMRSH-CQSZACIVSA-N 1 2 249.354 2.167 20 0 BEADLO Cc1cc(NC[C@@H]2CCO[C@@H](C(C)C)C2)nc[nH+]1 ZINC000450741388 202251685 /nfs/dbraw/zinc/25/16/85/202251685.db2.gz WYNLTPBRGVLFRN-CHWSQXEVSA-N 1 2 249.358 2.070 20 0 BEADLO O=C(C1CC1)[C@H]1C[N@@H+](CC2=CCCCC2)CCO1 ZINC000450758581 202258867 /nfs/dbraw/zinc/25/88/67/202258867.db2.gz NQBIKYCAOGMRSH-CQSZACIVSA-N 1 2 249.354 2.167 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCCO[C@H](C(C)C)C1 ZINC000578206471 366391283 /nfs/dbraw/zinc/39/12/83/366391283.db2.gz UAORWNNHEPZOHA-ZDUSSCGKSA-N 1 2 249.358 2.345 20 0 BEADLO CC(C)c1nc(C[NH+]2CCC(O)CC2)cs1 ZINC000048334999 358628369 /nfs/dbraw/zinc/62/83/69/358628369.db2.gz PSPVFXQJGKLUJU-UHFFFAOYSA-N 1 2 240.372 2.223 20 0 BEADLO Cc1ncc(C(=O)Nc2cc[nH+]cc2C)c(C)n1 ZINC000180469818 366458724 /nfs/dbraw/zinc/45/87/24/366458724.db2.gz UPOUKUQPJKUCHJ-UHFFFAOYSA-N 1 2 242.282 2.049 20 0 BEADLO COc1c(C[NH2+][C@@H](C)c2ccco2)c(C)nn1C ZINC000134108176 358780902 /nfs/dbraw/zinc/78/09/02/358780902.db2.gz SOMHNZVCHMOUQP-JTQLQIEISA-N 1 2 249.314 2.181 20 0 BEADLO Cc1nc(CN(C)Cc2cc[nH+]c(N)c2)cs1 ZINC000052726701 358791476 /nfs/dbraw/zinc/79/14/76/358791476.db2.gz SNNGLYXMJPQRDE-UHFFFAOYSA-N 1 2 248.355 2.061 20 0 BEADLO Cc1nc(C[NH2+][C@@H]2CCCn3nccc32)oc1C ZINC000640217069 358856320 /nfs/dbraw/zinc/85/63/20/358856320.db2.gz IMGMTCYPRCJUJG-LLVKDONJSA-N 1 2 246.314 2.113 20 0 BEADLO CS[C@@H](C)CC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000611134764 358856599 /nfs/dbraw/zinc/85/65/99/358856599.db2.gz MKAVAJXRRZFLAP-VIFPVBQESA-N 1 2 249.339 2.414 20 0 BEADLO Cc1nc(C[NH2+][C@@H]2CCCn3nccc32)c(C)o1 ZINC000640219321 358887186 /nfs/dbraw/zinc/88/71/86/358887186.db2.gz DIIVNHNQCJCIJH-LLVKDONJSA-N 1 2 246.314 2.113 20 0 BEADLO CC[C@@H](NC(=O)CCc1ccco1)c1[nH]cc[nH+]1 ZINC000140472759 358922364 /nfs/dbraw/zinc/92/23/64/358922364.db2.gz NLRARMSJIBCAFA-LLVKDONJSA-N 1 2 247.298 2.203 20 0 BEADLO CC[C@@H](NC(=O)c1ccoc1C)c1[nH]cc[nH+]1 ZINC000140665807 358923872 /nfs/dbraw/zinc/92/38/72/358923872.db2.gz VGLSBZMZZUMKDD-SNVBAGLBSA-N 1 2 233.271 2.192 20 0 BEADLO C[C@@H](Cc1nc([C@@H]2C[C@H]2C)no1)n1cc[nH+]c1 ZINC000351425885 366526282 /nfs/dbraw/zinc/52/62/82/366526282.db2.gz PGLQJEXHSPQWHN-KXUCPTDWSA-N 1 2 232.287 2.193 20 0 BEADLO C[C@@H](Cc1nc([C@H]2C[C@H]2C)no1)n1cc[nH+]c1 ZINC000351425887 366526569 /nfs/dbraw/zinc/52/65/69/366526569.db2.gz PGLQJEXHSPQWHN-UTLUCORTSA-N 1 2 232.287 2.193 20 0 BEADLO COCCCCC[N@@H+]1OC2CCC1CC2 ZINC000640229996 358942449 /nfs/dbraw/zinc/94/24/49/358942449.db2.gz WORCIBAMQMWYJC-UHFFFAOYSA-N 1 2 213.321 2.362 20 0 BEADLO COCCCCC[N@H+]1OC2CCC1CC2 ZINC000640229996 358942450 /nfs/dbraw/zinc/94/24/50/358942450.db2.gz WORCIBAMQMWYJC-UHFFFAOYSA-N 1 2 213.321 2.362 20 0 BEADLO Cc1[nH]c(CN2OC3CCC2CC3)[nH+]c1C ZINC000640231491 358945617 /nfs/dbraw/zinc/94/56/17/358945617.db2.gz DALGAAFWSGYPCT-UHFFFAOYSA-N 1 2 221.304 2.085 20 0 BEADLO Cc1ccc(F)c(C(=O)N(C)Cc2[nH]cc[nH+]2)c1 ZINC000070981002 359068623 /nfs/dbraw/zinc/06/86/23/359068623.db2.gz YAKHSBPLNKVRPV-UHFFFAOYSA-N 1 2 247.273 2.129 20 0 BEADLO CSc1ccc(C(=O)NCc2[nH]cc[nH+]2)cc1 ZINC000070991064 359069929 /nfs/dbraw/zinc/06/99/29/359069929.db2.gz LDWPAYOLJWHLPQ-UHFFFAOYSA-N 1 2 247.323 2.062 20 0 BEADLO Cc1ccc(NC(=O)CCn2cc[nH+]c2)cc1 ZINC000072615579 359086839 /nfs/dbraw/zinc/08/68/39/359086839.db2.gz GGELIVUKQDTPIP-UHFFFAOYSA-N 1 2 229.283 2.220 20 0 BEADLO CC[C@H]1C[N@H+](Cc2nc(C)c(C)o2)C[C@@H](C)O1 ZINC000247500612 359228550 /nfs/dbraw/zinc/22/85/50/359228550.db2.gz IDMCTOJZUMSNSW-SKDRFNHKSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2nc(C)c(C)o2)C[C@@H](C)O1 ZINC000247500612 359228555 /nfs/dbraw/zinc/22/85/55/359228555.db2.gz IDMCTOJZUMSNSW-SKDRFNHKSA-N 1 2 238.331 2.291 20 0 BEADLO c1csc(CC2C[NH+](Cc3cc[nH]n3)C2)c1 ZINC000628479030 359313579 /nfs/dbraw/zinc/31/35/79/359313579.db2.gz XLMXAOYVZKHWRT-UHFFFAOYSA-N 1 2 233.340 2.146 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2noc(C3CC3)n2)[C@H]1C ZINC000248368016 359271320 /nfs/dbraw/zinc/27/13/20/359271320.db2.gz USLWZHWWGGJGIT-BDAKNGLRSA-N 1 2 221.304 2.177 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2noc(C3CC3)n2)[C@H]1C ZINC000248368016 359271322 /nfs/dbraw/zinc/27/13/22/359271322.db2.gz USLWZHWWGGJGIT-BDAKNGLRSA-N 1 2 221.304 2.177 20 0 BEADLO CC1(C)CC[C@H]1Nc1nc[nH+]c(N)c1Cl ZINC000286256734 359354576 /nfs/dbraw/zinc/35/45/76/359354576.db2.gz CQFOKPPHQKHAPG-ZCFIWIBFSA-N 1 2 226.711 2.313 20 0 BEADLO CC1(C)CC[C@H]1Nc1[nH+]cnc(N)c1Cl ZINC000286256734 359354578 /nfs/dbraw/zinc/35/45/78/359354578.db2.gz CQFOKPPHQKHAPG-ZCFIWIBFSA-N 1 2 226.711 2.313 20 0 BEADLO CCOC(=O)[C@H](CC)[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000611502436 359385241 /nfs/dbraw/zinc/38/52/41/359385241.db2.gz SGPQOYNWENQQBC-MXWKQRLJSA-N 1 2 231.311 2.008 20 0 BEADLO CCOC(=O)[C@H](CC)[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000611502436 359385244 /nfs/dbraw/zinc/38/52/44/359385244.db2.gz SGPQOYNWENQQBC-MXWKQRLJSA-N 1 2 231.311 2.008 20 0 BEADLO CCc1nc(C[N@H+](CCCO)C2CC2)cs1 ZINC000404314200 359494184 /nfs/dbraw/zinc/49/41/84/359494184.db2.gz SOCBATQNBRQJAT-UHFFFAOYSA-N 1 2 240.372 2.052 20 0 BEADLO CCc1nc(C[N@@H+](CCCO)C2CC2)cs1 ZINC000404314200 359494189 /nfs/dbraw/zinc/49/41/89/359494189.db2.gz SOCBATQNBRQJAT-UHFFFAOYSA-N 1 2 240.372 2.052 20 0 BEADLO COC(=O)[C@H]([NH2+]CC1=CCCCC1)C1CC1 ZINC000379582405 359554012 /nfs/dbraw/zinc/55/40/12/359554012.db2.gz OOOJWYLTMBJILD-GFCCVEGCSA-N 1 2 223.316 2.028 20 0 BEADLO COC(=O)[C@@H]([NH2+]CCc1ccccc1)C(C)(C)C ZINC000152557468 359643911 /nfs/dbraw/zinc/64/39/11/359643911.db2.gz KQLDMKWJEYPVDP-CYBMUJFWSA-N 1 2 249.354 2.406 20 0 BEADLO Cc1c[nH+]cc(N[C@H](C)[C@H]2CCCO2)c1 ZINC000309036267 491143013 /nfs/dbraw/zinc/14/30/13/491143013.db2.gz GFYYGDACCRSVQS-ZYHUDNBSSA-N 1 2 206.289 2.369 20 0 BEADLO C[C@@H](c1csnn1)[N@H+](C)CC[C@H]1CCCO1 ZINC000450826219 202275937 /nfs/dbraw/zinc/27/59/37/202275937.db2.gz ZBSFOAFUZCFHRS-VHSXEESVSA-N 1 2 241.360 2.100 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+](C)CC[C@H]1CCCO1 ZINC000450826219 202275940 /nfs/dbraw/zinc/27/59/40/202275940.db2.gz ZBSFOAFUZCFHRS-VHSXEESVSA-N 1 2 241.360 2.100 20 0 BEADLO CC[C@H](Nc1nc(C)[nH+]c2c1CCCC2)[C@H](C)O ZINC000450804273 202269987 /nfs/dbraw/zinc/26/99/87/202269987.db2.gz XYTZEOVEYGKCJN-CABZTGNLSA-N 1 2 249.358 2.235 20 0 BEADLO Cc1ccc(F)c(CCNc2cc(C)[nH+]cn2)c1 ZINC000450811582 202273797 /nfs/dbraw/zinc/27/37/97/202273797.db2.gz NVXUDGAZNIVKNK-UHFFFAOYSA-N 1 2 245.301 2.309 20 0 BEADLO C[C@H]1C[C@H](Nc2ncncc2Cl)c2[nH+]ccn21 ZINC000450833880 202280400 /nfs/dbraw/zinc/28/04/00/202280400.db2.gz UFNSMQORIBRMFP-CBAPKCEASA-N 1 2 249.705 2.444 20 0 BEADLO C/C=C/C=C/C(=O)Nc1cc[nH+]cc1C ZINC000107289857 359737845 /nfs/dbraw/zinc/73/78/45/359737845.db2.gz ZJNAYOIGFWSEDF-VNKDHWASSA-N 1 2 202.257 2.461 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@@H](C)c2csnn2)CCCO1 ZINC000450902504 202302483 /nfs/dbraw/zinc/30/24/83/202302483.db2.gz KYBYQVVPYRHTAF-VHSXEESVSA-N 1 2 241.360 2.100 20 0 BEADLO CC[C@@H]1C[N@H+]([C@@H](C)c2csnn2)CCCO1 ZINC000450902504 202302485 /nfs/dbraw/zinc/30/24/85/202302485.db2.gz KYBYQVVPYRHTAF-VHSXEESVSA-N 1 2 241.360 2.100 20 0 BEADLO Cc1cncc(NCc2c[nH+]c(C)cc2C)n1 ZINC000450906385 202306461 /nfs/dbraw/zinc/30/64/61/202306461.db2.gz IOOXMDAXFCUENU-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO CC[C@H](O)[C@H](CC)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000450866564 202293442 /nfs/dbraw/zinc/29/34/42/202293442.db2.gz XFCQEKLZHDTIPD-RYUDHWBXSA-N 1 2 249.358 2.046 20 0 BEADLO CC[C@@H](O)[C@@H](CC)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000450866565 202293976 /nfs/dbraw/zinc/29/39/76/202293976.db2.gz XFCQEKLZHDTIPD-VXGBXAGGSA-N 1 2 249.358 2.046 20 0 BEADLO CC(=O)c1cc(C[N@@H+]2CCC(C)=C(C)C2)on1 ZINC000578519310 366588436 /nfs/dbraw/zinc/58/84/36/366588436.db2.gz WBXJJZUWWORZRD-UHFFFAOYSA-N 1 2 234.299 2.419 20 0 BEADLO CC(=O)c1cc(C[N@H+]2CCC(C)=C(C)C2)on1 ZINC000578519310 366588439 /nfs/dbraw/zinc/58/84/39/366588439.db2.gz WBXJJZUWWORZRD-UHFFFAOYSA-N 1 2 234.299 2.419 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[N@@H+]1CC[C@H](F)C1 ZINC000451194923 202373564 /nfs/dbraw/zinc/37/35/64/202373564.db2.gz LAQGZIAXMYRWIH-QWRGUYRKSA-N 1 2 231.311 2.008 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[N@H+]1CC[C@H](F)C1 ZINC000451194923 202373568 /nfs/dbraw/zinc/37/35/68/202373568.db2.gz LAQGZIAXMYRWIH-QWRGUYRKSA-N 1 2 231.311 2.008 20 0 BEADLO COC(=O)c1ccc(C[N@@H+]2CC[C@@H](F)C2)s1 ZINC000451191446 202374738 /nfs/dbraw/zinc/37/47/38/202374738.db2.gz RMHMUPWQTQLPIO-MRVPVSSYSA-N 1 2 243.303 2.079 20 0 BEADLO COC(=O)c1ccc(C[N@H+]2CC[C@@H](F)C2)s1 ZINC000451191446 202374741 /nfs/dbraw/zinc/37/47/41/202374741.db2.gz RMHMUPWQTQLPIO-MRVPVSSYSA-N 1 2 243.303 2.079 20 0 BEADLO COC(=O)c1ccc([C@@H](C)[N@@H+]2CC[C@@H](F)C2)o1 ZINC000451192887 202377071 /nfs/dbraw/zinc/37/70/71/202377071.db2.gz UGCDPXULJZNGAC-RKDXNWHRSA-N 1 2 241.262 2.171 20 0 BEADLO COC(=O)c1ccc([C@@H](C)[N@H+]2CC[C@@H](F)C2)o1 ZINC000451192887 202377075 /nfs/dbraw/zinc/37/70/75/202377075.db2.gz UGCDPXULJZNGAC-RKDXNWHRSA-N 1 2 241.262 2.171 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)[C@H]1CCC1(C)C ZINC000612583236 359895818 /nfs/dbraw/zinc/89/58/18/359895818.db2.gz ZCXAYQOUSNVAPS-GFCCVEGCSA-N 1 2 249.358 2.168 20 0 BEADLO CCc1cc(C[NH2+]Cc2ccoc2C)on1 ZINC000578725803 366632196 /nfs/dbraw/zinc/63/21/96/366632196.db2.gz GTOOCNORIRHAND-UHFFFAOYSA-N 1 2 220.272 2.428 20 0 BEADLO CC(C)c1ccc(C(=O)NCc2c[nH+]c[nH]2)cc1 ZINC000088753794 359975011 /nfs/dbraw/zinc/97/50/11/359975011.db2.gz FIJZONWUJHFJSL-UHFFFAOYSA-N 1 2 243.310 2.463 20 0 BEADLO CC(C)c1ccc(C(=O)NCc2c[nH]c[nH+]2)cc1 ZINC000088753794 359975014 /nfs/dbraw/zinc/97/50/14/359975014.db2.gz FIJZONWUJHFJSL-UHFFFAOYSA-N 1 2 243.310 2.463 20 0 BEADLO CSc1ccc(C(=O)NCc2c[nH+]c[nH]2)cc1 ZINC000088753469 359975727 /nfs/dbraw/zinc/97/57/27/359975727.db2.gz RWMSKGJWMGXDKD-UHFFFAOYSA-N 1 2 247.323 2.062 20 0 BEADLO CSc1ccc(C(=O)NCc2c[nH]c[nH+]2)cc1 ZINC000088753469 359975730 /nfs/dbraw/zinc/97/57/30/359975730.db2.gz RWMSKGJWMGXDKD-UHFFFAOYSA-N 1 2 247.323 2.062 20 0 BEADLO Cc1ccoc1CC(=O)Nc1cc(C)[nH+]cc1C ZINC000612748227 360041556 /nfs/dbraw/zinc/04/15/56/360041556.db2.gz RYQULJIRZCTSBN-UHFFFAOYSA-N 1 2 244.294 2.203 20 0 BEADLO CN(C)c1ccccc1NCc1c[nH+]cn1C ZINC000090166040 360060206 /nfs/dbraw/zinc/06/02/06/360060206.db2.gz RBZHFAOJYGTCID-UHFFFAOYSA-N 1 2 230.315 2.098 20 0 BEADLO Cn1c[nH+]cc1CNc1c(F)cc(F)cc1F ZINC000090167238 360060398 /nfs/dbraw/zinc/06/03/98/360060398.db2.gz YVEUSRWNQSFHIX-UHFFFAOYSA-N 1 2 241.216 2.450 20 0 BEADLO COc1ccc(NCc2c[nH+]cn2C(C)C)cn1 ZINC000090207456 360064421 /nfs/dbraw/zinc/06/44/21/360064421.db2.gz DEUXELZWJNBJAD-UHFFFAOYSA-N 1 2 246.314 2.480 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1cccc2c1OCO2 ZINC000091980571 360140221 /nfs/dbraw/zinc/14/02/21/360140221.db2.gz OAGBJPJHOPHCKI-GFCCVEGCSA-N 1 2 249.310 2.026 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1cccc2c1OCO2 ZINC000091980571 360140223 /nfs/dbraw/zinc/14/02/23/360140223.db2.gz OAGBJPJHOPHCKI-GFCCVEGCSA-N 1 2 249.310 2.026 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1csc(C)c1 ZINC001641608540 1172273277 /nfs/dbraw/zinc/27/32/77/1172273277.db2.gz AJFZQPQJNJKBRQ-SNVBAGLBSA-N 1 2 224.329 2.089 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1csc(C)c1 ZINC001641608540 1172273280 /nfs/dbraw/zinc/27/32/80/1172273280.db2.gz AJFZQPQJNJKBRQ-SNVBAGLBSA-N 1 2 224.329 2.089 20 0 BEADLO COc1cccc(NCc2cn(C)c[nH+]2)c1 ZINC000309306845 491147355 /nfs/dbraw/zinc/14/73/55/491147355.db2.gz VYFAWHZCONUGKA-UHFFFAOYSA-N 1 2 217.272 2.041 20 0 BEADLO CC(C)c1ncc(C[N@@H+]2CCOC[C@H]2C)s1 ZINC000091800696 360131991 /nfs/dbraw/zinc/13/19/91/360131991.db2.gz MFZCQURQWJKXCC-SNVBAGLBSA-N 1 2 240.372 2.487 20 0 BEADLO CC(C)c1ncc(C[N@H+]2CCOC[C@H]2C)s1 ZINC000091800696 360131993 /nfs/dbraw/zinc/13/19/93/360131993.db2.gz MFZCQURQWJKXCC-SNVBAGLBSA-N 1 2 240.372 2.487 20 0 BEADLO CCOC(=O)C(C)(C)[N@H+](C)Cc1ccc(C)o1 ZINC000093359451 360236943 /nfs/dbraw/zinc/23/69/43/360236943.db2.gz OYCMMYARKHPPAC-UHFFFAOYSA-N 1 2 239.315 2.362 20 0 BEADLO CCOC(=O)C(C)(C)[N@@H+](C)Cc1ccc(C)o1 ZINC000093359451 360236947 /nfs/dbraw/zinc/23/69/47/360236947.db2.gz OYCMMYARKHPPAC-UHFFFAOYSA-N 1 2 239.315 2.362 20 0 BEADLO FC1(F)CC[N@@H+]([C@H]2CCCSC2)C1 ZINC000306533555 360394334 /nfs/dbraw/zinc/39/43/34/360394334.db2.gz KHOKPSOYBLKGAU-QMMMGPOBSA-N 1 2 207.289 2.223 20 0 BEADLO FC1(F)CC[N@H+]([C@H]2CCCSC2)C1 ZINC000306533555 360394337 /nfs/dbraw/zinc/39/43/37/360394337.db2.gz KHOKPSOYBLKGAU-QMMMGPOBSA-N 1 2 207.289 2.223 20 0 BEADLO CN(C)c1ccc(CSc2ncccn2)c[nH+]1 ZINC000629088594 360874919 /nfs/dbraw/zinc/87/49/19/360874919.db2.gz KBBLTJIDXAOLKA-UHFFFAOYSA-N 1 2 246.339 2.230 20 0 BEADLO CCO[C@H](COc1cc[nH+]cc1)C1CC1 ZINC000629361702 361010869 /nfs/dbraw/zinc/01/08/69/361010869.db2.gz KMFZEXJUKSJQKK-GFCCVEGCSA-N 1 2 207.273 2.276 20 0 BEADLO CCOc1nnc(C[N@H+](C)CC(C)C)s1 ZINC000065960999 361084537 /nfs/dbraw/zinc/08/45/37/361084537.db2.gz MYYQDCBDJFHHFQ-UHFFFAOYSA-N 1 2 229.349 2.025 20 0 BEADLO CCOc1nnc(C[N@@H+](C)CC(C)C)s1 ZINC000065960999 361084542 /nfs/dbraw/zinc/08/45/42/361084542.db2.gz MYYQDCBDJFHHFQ-UHFFFAOYSA-N 1 2 229.349 2.025 20 0 BEADLO COC(=O)[C@@H]([NH2+]Cc1cccs1)C(C)(C)C ZINC000041051870 361206667 /nfs/dbraw/zinc/20/66/67/361206667.db2.gz BRFBLNUIWHCCJO-SNVBAGLBSA-N 1 2 241.356 2.425 20 0 BEADLO CCCCc1cc(NC2(CO)CCC2)nc[nH+]1 ZINC000631169754 361175211 /nfs/dbraw/zinc/17/52/11/361175211.db2.gz IHNKUTUPTDSLOS-UHFFFAOYSA-N 1 2 235.331 2.146 20 0 BEADLO C[C@@H](CO)[N@H+](C)Cc1c(F)cccc1Cl ZINC000158881879 361213845 /nfs/dbraw/zinc/21/38/45/361213845.db2.gz SHKZBGZJWNLYGN-QMMMGPOBSA-N 1 2 231.698 2.292 20 0 BEADLO C[C@@H](CO)[N@@H+](C)Cc1c(F)cccc1Cl ZINC000158881879 361213850 /nfs/dbraw/zinc/21/38/50/361213850.db2.gz SHKZBGZJWNLYGN-QMMMGPOBSA-N 1 2 231.698 2.292 20 0 BEADLO Cc1nc(CNc2nc(C)[nH+]cc2C)sc1C ZINC000579003804 366692634 /nfs/dbraw/zinc/69/26/34/366692634.db2.gz BYVQYYQXEFIZGK-UHFFFAOYSA-N 1 2 248.355 2.201 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2CC[C@H]2C)c(C)c[nH+]1 ZINC000579095799 366708728 /nfs/dbraw/zinc/70/87/28/366708728.db2.gz PSVNWLSDEJQYNE-LDYMZIIASA-N 1 2 233.315 2.040 20 0 BEADLO CCc1cnccc1[C@H](C)[NH2+]Cc1cocn1 ZINC000428887397 201048687 /nfs/dbraw/zinc/04/86/87/201048687.db2.gz LIIIWXPFHNISNU-JTQLQIEISA-N 1 2 231.299 2.483 20 0 BEADLO CC(C)c1nnc(C[N@H+](C)[C@@H]2CC2(C)C)[nH]1 ZINC000428946566 201051840 /nfs/dbraw/zinc/05/18/40/201051840.db2.gz KIRBQNZCRCXQQR-SECBINFHSA-N 1 2 222.336 2.158 20 0 BEADLO CC(C)c1nnc(C[N@@H+](C)[C@@H]2CC2(C)C)[nH]1 ZINC000428946566 201051843 /nfs/dbraw/zinc/05/18/43/201051843.db2.gz KIRBQNZCRCXQQR-SECBINFHSA-N 1 2 222.336 2.158 20 0 BEADLO CC(C)c1nnc(C[N@H+](C)[C@H]2CC2(C)C)[nH]1 ZINC000428946567 201052553 /nfs/dbraw/zinc/05/25/53/201052553.db2.gz KIRBQNZCRCXQQR-VIFPVBQESA-N 1 2 222.336 2.158 20 0 BEADLO CC(C)c1nnc(C[N@@H+](C)[C@H]2CC2(C)C)[nH]1 ZINC000428946567 201052554 /nfs/dbraw/zinc/05/25/54/201052554.db2.gz KIRBQNZCRCXQQR-VIFPVBQESA-N 1 2 222.336 2.158 20 0 BEADLO CCC[C@@H]([NH2+]C[C@@H]1CCCS1)C(=O)OCC ZINC000148046890 201079076 /nfs/dbraw/zinc/07/90/76/201079076.db2.gz BNLAOXWEQXQGMU-WDEREUQCSA-N 1 2 245.388 2.203 20 0 BEADLO CCC1(CNC(=O)Cc2c[nH+]cn2C)CCCC1 ZINC000579391068 366775487 /nfs/dbraw/zinc/77/54/87/366775487.db2.gz MQLPPEOFOKKNPR-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO Cc1c(NCc2c[nH+]cn2C)cccc1N(C)C ZINC000181161013 366791971 /nfs/dbraw/zinc/79/19/71/366791971.db2.gz XXPOHJCBNLBGBI-UHFFFAOYSA-N 1 2 244.342 2.407 20 0 BEADLO CC(C)[C@@H](O)C[N@@H+]1CCCC[C@H]1C(F)F ZINC000433189897 201165743 /nfs/dbraw/zinc/16/57/43/201165743.db2.gz TXLDWYMAPAYOHY-UWVGGRQHSA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)[C@@H](O)C[N@H+]1CCCC[C@H]1C(F)F ZINC000433189897 201165746 /nfs/dbraw/zinc/16/57/46/201165746.db2.gz TXLDWYMAPAYOHY-UWVGGRQHSA-N 1 2 221.291 2.123 20 0 BEADLO CC[C@H]1CC[N@@H+]1Cc1ncc(COC)s1 ZINC000430197603 201151490 /nfs/dbraw/zinc/15/14/90/201151490.db2.gz VPHFFLQRZOJSEV-VIFPVBQESA-N 1 2 226.345 2.274 20 0 BEADLO CC[C@H]1CC[N@H+]1Cc1ncc(COC)s1 ZINC000430197603 201151494 /nfs/dbraw/zinc/15/14/94/201151494.db2.gz VPHFFLQRZOJSEV-VIFPVBQESA-N 1 2 226.345 2.274 20 0 BEADLO c1ccc(C[NH2+]Cc2noc(C3CC3)n2)cc1 ZINC000433904262 201197851 /nfs/dbraw/zinc/19/78/51/201197851.db2.gz QKERDTGDJDQMBC-UHFFFAOYSA-N 1 2 229.283 2.237 20 0 BEADLO CS[C@@H]1CC[N@H+](Cc2nnc(C(C)C)o2)C1 ZINC000448545657 201197876 /nfs/dbraw/zinc/19/78/76/201197876.db2.gz IMYOTXSDHLRKLM-SECBINFHSA-N 1 2 241.360 2.130 20 0 BEADLO CS[C@@H]1CC[N@@H+](Cc2nnc(C(C)C)o2)C1 ZINC000448545657 201197879 /nfs/dbraw/zinc/19/78/79/201197879.db2.gz IMYOTXSDHLRKLM-SECBINFHSA-N 1 2 241.360 2.130 20 0 BEADLO C[C@H]1CN(c2cc(N3CCCC3)[nH+]cn2)C[C@H]1C ZINC000433772594 201192734 /nfs/dbraw/zinc/19/27/34/201192734.db2.gz AXYDRWXKDVCZIX-TXEJJXNPSA-N 1 2 246.358 2.169 20 0 BEADLO C[C@H]1CN(c2cc(N3CCCC3)nc[nH+]2)C[C@H]1C ZINC000433772594 201192735 /nfs/dbraw/zinc/19/27/35/201192735.db2.gz AXYDRWXKDVCZIX-TXEJJXNPSA-N 1 2 246.358 2.169 20 0 BEADLO Cc1nc2[nH]ccc2c(N2C[C@@H]3[C@H](C2)C3(C)C)[nH+]1 ZINC000433779526 201193522 /nfs/dbraw/zinc/19/35/22/201193522.db2.gz LNEFPOOLAADROY-PHIMTYICSA-N 1 2 242.326 2.359 20 0 BEADLO CCOCCCCNc1[nH+]c(C)nc2[nH]ccc21 ZINC000433780432 201193589 /nfs/dbraw/zinc/19/35/89/201193589.db2.gz BZAKAEZCSHVTKZ-UHFFFAOYSA-N 1 2 248.330 2.447 20 0 BEADLO CC(C)n1ncnc1C[N@H+](C)[C@@H]1CC1(C)C ZINC000434507100 201223148 /nfs/dbraw/zinc/22/31/48/201223148.db2.gz GIYHCYBTFWTWFW-SNVBAGLBSA-N 1 2 222.336 2.089 20 0 BEADLO CC(C)n1ncnc1C[N@@H+](C)[C@@H]1CC1(C)C ZINC000434507100 201223151 /nfs/dbraw/zinc/22/31/51/201223151.db2.gz GIYHCYBTFWTWFW-SNVBAGLBSA-N 1 2 222.336 2.089 20 0 BEADLO CNc1ccc(-c2ccc(CCOC)cc2)c[nH+]1 ZINC000629700169 361630608 /nfs/dbraw/zinc/63/06/08/361630608.db2.gz HJGMWRMSURSGNW-UHFFFAOYSA-N 1 2 242.322 2.401 20 0 BEADLO CC[C@H](CO)Nc1ccc(-c2cnoc2C)c[nH+]1 ZINC000629713790 361654981 /nfs/dbraw/zinc/65/49/81/361654981.db2.gz UTYOJDGSTGHMDG-LLVKDONJSA-N 1 2 247.298 2.228 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)NCCCn1cc[nH+]c1 ZINC000448565629 201290058 /nfs/dbraw/zinc/29/00/58/201290058.db2.gz MQFORUIHWXGIPT-OLZOCXBDSA-N 1 2 249.358 2.216 20 0 BEADLO CCC[C@@H]([NH2+]C[C@@H](C)SC)C(=O)OCC ZINC000155097499 201300273 /nfs/dbraw/zinc/30/02/73/201300273.db2.gz FPCJUPJSNLIDHJ-NXEZZACHSA-N 1 2 233.377 2.059 20 0 BEADLO C[C@@]1(C(=O)NCCCn2cc[nH+]c2)CC=CCC1 ZINC000448567661 201304776 /nfs/dbraw/zinc/30/47/76/201304776.db2.gz ZCONEXDTWYBTCB-CQSZACIVSA-N 1 2 247.342 2.136 20 0 BEADLO CCn1c[nH+]cc1CNc1cnn2c1CCCC2 ZINC000631230398 361705839 /nfs/dbraw/zinc/70/58/39/361705839.db2.gz PVGXGPFXHHNGRJ-UHFFFAOYSA-N 1 2 245.330 2.048 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@@H]2CCCC23CC3)c[nH+]1 ZINC000629830597 361729576 /nfs/dbraw/zinc/72/95/76/361729576.db2.gz CJORNGZQFBAPEG-JTQLQIEISA-N 1 2 233.315 2.028 20 0 BEADLO Fc1ccc(NCc2cccc3[nH+]ccn32)nc1 ZINC000181571373 366827992 /nfs/dbraw/zinc/82/79/92/366827992.db2.gz NPIPWXJENJCDOJ-UHFFFAOYSA-N 1 2 242.257 2.481 20 0 BEADLO CC[C@@](C)(NC(=O)CCCn1cc[nH+]c1)C1CC1 ZINC000618958223 364201967 /nfs/dbraw/zinc/20/19/67/364201967.db2.gz YONDXGBHOBNCEL-CQSZACIVSA-N 1 2 249.358 2.358 20 0 BEADLO C[C@@H](NC(=O)[C@@]1(C)CCC[C@@H]1C)c1[nH]cc[nH+]1 ZINC000615157668 364547933 /nfs/dbraw/zinc/54/79/33/364547933.db2.gz FGMOKXJFARTYOB-CWSCBRNRSA-N 1 2 235.331 2.413 20 0 BEADLO Cc1ncncc1[C@@H](C)[NH2+][C@@H](C)c1ccon1 ZINC000566472794 364716243 /nfs/dbraw/zinc/71/62/43/364716243.db2.gz BLBNHYHXFRRERK-ZJUUUORDSA-N 1 2 232.287 2.185 20 0 BEADLO Cc1ncncc1[C@@H](C)[NH2+][C@H](C)c1ccon1 ZINC000566472791 364716371 /nfs/dbraw/zinc/71/63/71/364716371.db2.gz BLBNHYHXFRRERK-NXEZZACHSA-N 1 2 232.287 2.185 20 0 BEADLO CC(C)n1cncc1C[N@@H+]1CCC[C@@H](F)C1 ZINC000573498508 364847829 /nfs/dbraw/zinc/84/78/29/364847829.db2.gz GYZUIKBTJWHTGC-LLVKDONJSA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1cncc1C[N@H+]1CCC[C@@H](F)C1 ZINC000573498508 364847832 /nfs/dbraw/zinc/84/78/32/364847832.db2.gz GYZUIKBTJWHTGC-LLVKDONJSA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1c[nH+]cc1CN1CCC[C@@H](F)C1 ZINC000573498508 364847837 /nfs/dbraw/zinc/84/78/37/364847837.db2.gz GYZUIKBTJWHTGC-LLVKDONJSA-N 1 2 225.311 2.398 20 0 BEADLO Cc1[nH]c(CNCc2ccc(C)nc2)[nH+]c1C ZINC000573506476 364851493 /nfs/dbraw/zinc/85/14/93/364851493.db2.gz MOSIRWPROODJDM-UHFFFAOYSA-N 1 2 230.315 2.020 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)c2coc(C)c2)[nH+]1 ZINC000573616550 364875485 /nfs/dbraw/zinc/87/54/85/364875485.db2.gz JZCKGWYXJSVNHQ-UHFFFAOYSA-N 1 2 247.298 2.285 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ccn(C)n1)c1ccoc1 ZINC000573901465 364940167 /nfs/dbraw/zinc/94/01/67/364940167.db2.gz MRGLKNIGJGZRCB-UWVGGRQHSA-N 1 2 219.288 2.425 20 0 BEADLO Cc1cc(N2CCC[C@H]([C@@H]3CCOC3)C2)nc[nH+]1 ZINC000439082639 201433993 /nfs/dbraw/zinc/43/39/93/201433993.db2.gz DRXJBEFFUAMATM-QWHCGFSZSA-N 1 2 247.342 2.038 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N[C@@H](C)C3CC3)ccn12 ZINC000574099022 364987773 /nfs/dbraw/zinc/98/77/73/364987773.db2.gz AHVGAFFBUFOONR-JTQLQIEISA-N 1 2 243.310 2.171 20 0 BEADLO Cc1nc2ccccn2c1C[NH2+]CC(C)(F)F ZINC000574058150 364980118 /nfs/dbraw/zinc/98/01/18/364980118.db2.gz HMWDVGKPHZCFKA-UHFFFAOYSA-N 1 2 239.269 2.388 20 0 BEADLO C[C@@H](C[S@](C)=O)Nc1[nH+]ccc2ccccc21 ZINC000169068289 365068459 /nfs/dbraw/zinc/06/84/59/365068459.db2.gz BWSFCUKPECDVLV-DYZYQPBXSA-N 1 2 248.351 2.414 20 0 BEADLO Cc1ccncc1CN(C)c1nc(C)[nH+]cc1C ZINC000574530871 365085476 /nfs/dbraw/zinc/08/54/76/365085476.db2.gz GPIHPEUGVIQTNT-UHFFFAOYSA-N 1 2 242.326 2.433 20 0 BEADLO Cc1cc(NC(=O)N(C)c2ccccc2)cc[nH+]1 ZINC000574592557 365099003 /nfs/dbraw/zinc/09/90/03/365099003.db2.gz QFMRFFLJKGKTPV-UHFFFAOYSA-N 1 2 241.294 2.480 20 0 BEADLO CC[C@@H](C)[C@@H](C)C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000574817723 365151401 /nfs/dbraw/zinc/15/14/01/365151401.db2.gz QLVHHWRVUGAOIP-NXEZZACHSA-N 1 2 237.347 2.443 20 0 BEADLO C[C@@H](CC(=O)N1CC(CC2CC2)C1)n1cc[nH+]c1 ZINC000622246387 370795385 /nfs/dbraw/zinc/79/53/85/370795385.db2.gz POOULRTVLKVSCS-NSHDSACASA-N 1 2 247.342 2.093 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)Cc1ccc(F)cc1 ZINC000171946768 365260171 /nfs/dbraw/zinc/26/01/71/365260171.db2.gz IKKQGDKXDMTZKB-UHFFFAOYSA-N 1 2 219.263 2.181 20 0 BEADLO C[N@H+](Cc1ncc[nH]1)Cc1ccc(F)cc1 ZINC000171946768 365260175 /nfs/dbraw/zinc/26/01/75/365260175.db2.gz IKKQGDKXDMTZKB-UHFFFAOYSA-N 1 2 219.263 2.181 20 0 BEADLO C[N@@H+](Cc1ncc[nH]1)Cc1ccc(F)cc1 ZINC000171946768 365260177 /nfs/dbraw/zinc/26/01/77/365260177.db2.gz IKKQGDKXDMTZKB-UHFFFAOYSA-N 1 2 219.263 2.181 20 0 BEADLO C[C@@H](NC(=O)c1ccc2[nH+]ccn2c1)C(C)(C)C ZINC000171999891 365267912 /nfs/dbraw/zinc/26/79/12/365267912.db2.gz TVCVGARSFKTVOL-SNVBAGLBSA-N 1 2 245.326 2.499 20 0 BEADLO Cc1nsc(C)c1C[N@@H+]1CCC(=O)[C@@H](C)C1 ZINC000575326453 365290855 /nfs/dbraw/zinc/29/08/55/365290855.db2.gz WSJDRCGRZBMLJI-QMMMGPOBSA-N 1 2 238.356 2.171 20 0 BEADLO Cc1nsc(C)c1C[N@H+]1CCC(=O)[C@@H](C)C1 ZINC000575326453 365290861 /nfs/dbraw/zinc/29/08/61/365290861.db2.gz WSJDRCGRZBMLJI-QMMMGPOBSA-N 1 2 238.356 2.171 20 0 BEADLO CCCn1nc(C)c(CNc2c[nH]c[nH+]2)c1C ZINC000575455601 365324544 /nfs/dbraw/zinc/32/45/44/365324544.db2.gz BQESCGFIDIGFKN-UHFFFAOYSA-N 1 2 233.319 2.245 20 0 BEADLO CC1=C(C)CN(C(=O)C[C@@H](C)n2cc[nH+]c2)CC1 ZINC000575928449 365418126 /nfs/dbraw/zinc/41/81/26/365418126.db2.gz LXIYBUBDXFCKQY-CYBMUJFWSA-N 1 2 247.342 2.403 20 0 BEADLO Cc1nsc(C)c1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000575884284 365404612 /nfs/dbraw/zinc/40/46/12/365404612.db2.gz OIIFPXWGXZXGGF-DTORHVGOSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nsc(C)c1C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000575884284 365404617 /nfs/dbraw/zinc/40/46/17/365404617.db2.gz OIIFPXWGXZXGGF-DTORHVGOSA-N 1 2 240.372 2.369 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)C[C@H]1CCC2(CCCC2)O1 ZINC000575884075 365405019 /nfs/dbraw/zinc/40/50/19/365405019.db2.gz KEVQBMGIJPUCQC-CYBMUJFWSA-N 1 2 249.358 2.333 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)C[C@H]1CCC2(CCCC2)O1 ZINC000575884075 365405021 /nfs/dbraw/zinc/40/50/21/365405021.db2.gz KEVQBMGIJPUCQC-CYBMUJFWSA-N 1 2 249.358 2.333 20 0 BEADLO CC(C)[C@@H]1C[C@H]1CNC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000579599022 366900093 /nfs/dbraw/zinc/90/00/93/366900093.db2.gz WCLSJKZNOTTYBZ-AGIUHOORSA-N 1 2 249.358 2.243 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NC1CCCCCC1 ZINC000579728719 366994659 /nfs/dbraw/zinc/99/46/59/366994659.db2.gz IYLOMOASAHAJLT-NSHDSACASA-N 1 2 249.358 2.427 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NC1CCCCCC1 ZINC000579728719 366994666 /nfs/dbraw/zinc/99/46/66/366994666.db2.gz IYLOMOASAHAJLT-NSHDSACASA-N 1 2 249.358 2.427 20 0 BEADLO COc1ccc(NCC2(OC)CCCC2)[nH+]c1 ZINC000383729192 541514229 /nfs/dbraw/zinc/51/42/29/541514229.db2.gz ZVPZMCFQRGSNKZ-UHFFFAOYSA-N 1 2 236.315 2.461 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000579850445 367050179 /nfs/dbraw/zinc/05/01/79/367050179.db2.gz XNCSKPGEHUEJNP-WDEREUQCSA-N 1 2 237.347 2.235 20 0 BEADLO CCC[C@@H](C)N(C)C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000579850445 367050182 /nfs/dbraw/zinc/05/01/82/367050182.db2.gz XNCSKPGEHUEJNP-WDEREUQCSA-N 1 2 237.347 2.235 20 0 BEADLO CCC[C@H](C)N(C)C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000579850444 367050457 /nfs/dbraw/zinc/05/04/57/367050457.db2.gz XNCSKPGEHUEJNP-QWRGUYRKSA-N 1 2 237.347 2.235 20 0 BEADLO CCC[C@H](C)N(C)C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000579850444 367050463 /nfs/dbraw/zinc/05/04/63/367050463.db2.gz XNCSKPGEHUEJNP-QWRGUYRKSA-N 1 2 237.347 2.235 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CC(C)(C)C[C@@H]1C ZINC000579978005 367114726 /nfs/dbraw/zinc/11/47/26/367114726.db2.gz NDGGUEUEINYQEI-MNOVXSKESA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CC(C)(C)C[C@@H]1C ZINC000579978005 367114730 /nfs/dbraw/zinc/11/47/30/367114730.db2.gz NDGGUEUEINYQEI-MNOVXSKESA-N 1 2 249.358 2.235 20 0 BEADLO Cc1oncc1C[N@H+](C)Cc1ccco1 ZINC000185150363 367120679 /nfs/dbraw/zinc/12/06/79/367120679.db2.gz BRZFLJLGOUILKS-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO Cc1oncc1C[N@@H+](C)Cc1ccco1 ZINC000185150363 367120685 /nfs/dbraw/zinc/12/06/85/367120685.db2.gz BRZFLJLGOUILKS-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO Cc1ccccc1[C@@H]1C[N@@H+]([C@@H]2CCOC2)CCO1 ZINC000580730334 367152498 /nfs/dbraw/zinc/15/24/98/367152498.db2.gz MRUMERYPIJIKLO-HIFRSBDPSA-N 1 2 247.338 2.157 20 0 BEADLO Cc1ccccc1[C@@H]1C[N@H+]([C@@H]2CCOC2)CCO1 ZINC000580730334 367152503 /nfs/dbraw/zinc/15/25/03/367152503.db2.gz MRUMERYPIJIKLO-HIFRSBDPSA-N 1 2 247.338 2.157 20 0 BEADLO Cc1ncc(C[N@@H+]2CCOCC2(C)C)s1 ZINC000193496529 367183478 /nfs/dbraw/zinc/18/34/78/367183478.db2.gz IJNGKNDMYVWDDH-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1ncc(C[N@H+]2CCOCC2(C)C)s1 ZINC000193496529 367183486 /nfs/dbraw/zinc/18/34/86/367183486.db2.gz IJNGKNDMYVWDDH-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO CC(C)(C)[C@H]1CCC[C@H]1NC(=O)Cn1cc[nH+]c1 ZINC000581178435 367284271 /nfs/dbraw/zinc/28/42/71/367284271.db2.gz WBJCIDWTEGETCG-NWDGAFQWSA-N 1 2 249.358 2.214 20 0 BEADLO Cc1cc(NC(=O)N[C@H](C)C2CC2)c(C)c[nH+]1 ZINC000581054883 367247265 /nfs/dbraw/zinc/24/72/65/367247265.db2.gz HPOYGTZNFUOXPK-SNVBAGLBSA-N 1 2 233.315 2.040 20 0 BEADLO CO[C@]1(C)CCCN(c2nc(C)[nH+]cc2C)CC1 ZINC000581321645 367348991 /nfs/dbraw/zinc/34/89/91/367348991.db2.gz SPACNIGRXDCUSU-CQSZACIVSA-N 1 2 249.358 2.489 20 0 BEADLO CC[N@H+](CCCNC(=O)N(C)C)c1ccccc1 ZINC000194470453 367296443 /nfs/dbraw/zinc/29/64/43/367296443.db2.gz UASPMKHKAYJAMD-UHFFFAOYSA-N 1 2 249.358 2.174 20 0 BEADLO CC[N@@H+](CCCNC(=O)N(C)C)c1ccccc1 ZINC000194470453 367296449 /nfs/dbraw/zinc/29/64/49/367296449.db2.gz UASPMKHKAYJAMD-UHFFFAOYSA-N 1 2 249.358 2.174 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCC[C@@H](F)C1 ZINC000581255962 367310771 /nfs/dbraw/zinc/31/07/71/367310771.db2.gz LCLQBPDJYFJIDM-LLVKDONJSA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCC[C@@H](F)C1 ZINC000581255962 367310777 /nfs/dbraw/zinc/31/07/77/367310777.db2.gz LCLQBPDJYFJIDM-LLVKDONJSA-N 1 2 225.311 2.398 20 0 BEADLO CCc1ncc(C[NH2+]CC(C)(F)F)s1 ZINC000381977281 367475297 /nfs/dbraw/zinc/47/52/97/367475297.db2.gz DHVRKZCDKKVEPO-UHFFFAOYSA-N 1 2 220.288 2.450 20 0 BEADLO CCOCC(C)(C)[NH2+]Cc1nnsc1Cl ZINC000382175365 367493813 /nfs/dbraw/zinc/49/38/13/367493813.db2.gz XSJRZVZVXQXCLQ-UHFFFAOYSA-N 1 2 249.767 2.096 20 0 BEADLO C[C@@H]([NH2+][C@H]1CSC[C@H]1C)C(=O)OC(C)(C)C ZINC000381557506 367430282 /nfs/dbraw/zinc/43/02/82/367430282.db2.gz PSOZXBFVFMZCNU-BBBLOLIVSA-N 1 2 245.388 2.058 20 0 BEADLO Cc1c[nH+]c(CN[C@@H]2CCCC[C@H]2F)n1C ZINC000382232213 367501206 /nfs/dbraw/zinc/50/12/06/367501206.db2.gz PVSHDMFDDBVUNY-GHMZBOCLSA-N 1 2 225.311 2.099 20 0 BEADLO CC(=O)c1cc(C[N@@H+](C)[C@H]2CC2(C)C)on1 ZINC000581556238 367586789 /nfs/dbraw/zinc/58/67/89/367586789.db2.gz ZKAOXYLHKWCJIZ-NSHDSACASA-N 1 2 222.288 2.108 20 0 BEADLO CC(=O)c1cc(C[N@H+](C)[C@H]2CC2(C)C)on1 ZINC000581556238 367586791 /nfs/dbraw/zinc/58/67/91/367586791.db2.gz ZKAOXYLHKWCJIZ-NSHDSACASA-N 1 2 222.288 2.108 20 0 BEADLO COc1cc(CNc2c[nH+]cc(C)c2)sn1 ZINC000399123433 367596213 /nfs/dbraw/zinc/59/62/13/367596213.db2.gz NCEGZCLPWRCVEQ-UHFFFAOYSA-N 1 2 235.312 2.467 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CCC[C@@H](C)[C@@H]1C ZINC000581616755 367636464 /nfs/dbraw/zinc/63/64/64/367636464.db2.gz XHGPFHHRZGBKRC-UTUOFQBUSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CCC[C@@H](C)[C@@H]1C ZINC000581616755 367636468 /nfs/dbraw/zinc/63/64/68/367636468.db2.gz XHGPFHHRZGBKRC-UTUOFQBUSA-N 1 2 249.358 2.235 20 0 BEADLO COc1ccc[nH+]c1NC[C@](C)(OC)C1CC1 ZINC000383750284 367651936 /nfs/dbraw/zinc/65/19/36/367651936.db2.gz JUFJBNFUJPYOBN-ZDUSSCGKSA-N 1 2 236.315 2.317 20 0 BEADLO COc1ccc(F)cc1C[NH2+]Cc1ccno1 ZINC000383765170 367652826 /nfs/dbraw/zinc/65/28/26/367652826.db2.gz MFGAYADPYDXSQS-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO CC/C=C/C[NH2+][C@H](CCC)C(=O)OCC ZINC000384710598 367719648 /nfs/dbraw/zinc/71/96/48/367719648.db2.gz DIMZYQVIWFONSP-WSKFYRRCSA-N 1 2 213.321 2.274 20 0 BEADLO CCn1cc[nH+]c1CN[C@H](C)c1cscn1 ZINC000385472751 367832330 /nfs/dbraw/zinc/83/23/30/367832330.db2.gz MSUZBYCJVBACNU-SECBINFHSA-N 1 2 236.344 2.210 20 0 BEADLO Cc1[nH]c(CNCc2ccc(C)c(C)n2)[nH+]c1C ZINC000581835668 367841101 /nfs/dbraw/zinc/84/11/01/367841101.db2.gz GTJVTSGUONAQOU-UHFFFAOYSA-N 1 2 244.342 2.328 20 0 BEADLO Cc1nc(C[NH2+]Cc2ccc(C)c(C)n2)[nH]c1C ZINC000581835668 367841109 /nfs/dbraw/zinc/84/11/09/367841109.db2.gz GTJVTSGUONAQOU-UHFFFAOYSA-N 1 2 244.342 2.328 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N[C@@H](C1CC1)C1CCC1 ZINC000581987372 368052048 /nfs/dbraw/zinc/05/20/48/368052048.db2.gz MKDGLPYJZCBCJV-CQSZACIVSA-N 1 2 247.342 2.037 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N[C@@H](C1CC1)C1CCC1 ZINC000581987372 368052058 /nfs/dbraw/zinc/05/20/58/368052058.db2.gz MKDGLPYJZCBCJV-CQSZACIVSA-N 1 2 247.342 2.037 20 0 BEADLO CC[C@@H](Nc1ccc2ccccc2[nH+]1)[C@H](C)O ZINC000386714655 368011791 /nfs/dbraw/zinc/01/17/91/368011791.db2.gz QJZHWHLMEHZFQH-CMPLNLGQSA-N 1 2 230.311 2.228 20 0 BEADLO COc1c(N)[nH+]cnc1N[C@H]1CC12CCCCC2 ZINC000386904301 368032227 /nfs/dbraw/zinc/03/22/27/368032227.db2.gz BSEOOZPPDKEIAH-VIFPVBQESA-N 1 2 248.330 2.202 20 0 BEADLO COc1c(N)nc[nH+]c1N[C@H]1CC12CCCCC2 ZINC000386904301 368032232 /nfs/dbraw/zinc/03/22/32/368032232.db2.gz BSEOOZPPDKEIAH-VIFPVBQESA-N 1 2 248.330 2.202 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCC[C@@H](F)C1 ZINC000566352858 326035823 /nfs/dbraw/zinc/03/58/23/326035823.db2.gz AEACVBIMRSLWAQ-SNVBAGLBSA-N 1 2 212.268 2.225 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCC[C@@H](F)C1 ZINC000566352858 326035825 /nfs/dbraw/zinc/03/58/25/326035825.db2.gz AEACVBIMRSLWAQ-SNVBAGLBSA-N 1 2 212.268 2.225 20 0 BEADLO Cc1ccc(CNc2c[nH+]cc(N(C)C)c2)nc1 ZINC000630955908 368149625 /nfs/dbraw/zinc/14/96/25/368149625.db2.gz HHNJYUZHKXYNDU-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NCC1(C)CCCC1 ZINC000582011384 368151973 /nfs/dbraw/zinc/15/19/73/368151973.db2.gz AGENJBQLISZRGY-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NCC1(C)CCCC1 ZINC000582011384 368151979 /nfs/dbraw/zinc/15/19/79/368151979.db2.gz AGENJBQLISZRGY-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)[C@@]1(C)CCC[C@H]1C ZINC000448708877 201611689 /nfs/dbraw/zinc/61/16/89/201611689.db2.gz NDWODINSWLSBIO-BZPMIXESSA-N 1 2 249.358 2.214 20 0 BEADLO CCCC(C)(C)NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000566437353 326047178 /nfs/dbraw/zinc/04/71/78/326047178.db2.gz AMGKDWQBRXBRHY-JTQLQIEISA-N 1 2 237.347 2.283 20 0 BEADLO CCCC(C)(C)NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000566437353 326047181 /nfs/dbraw/zinc/04/71/81/326047181.db2.gz AMGKDWQBRXBRHY-JTQLQIEISA-N 1 2 237.347 2.283 20 0 BEADLO C[C@H]1CCN(c2cc(CO)cc[nH+]2)C[C@H]1C ZINC000253069014 368444746 /nfs/dbraw/zinc/44/47/46/368444746.db2.gz LGNFOJCWVYRSMF-WDEREUQCSA-N 1 2 220.316 2.056 20 0 BEADLO Cc1nc(CN(C)c2cccc[nH+]2)cs1 ZINC000065202687 368619241 /nfs/dbraw/zinc/61/92/41/368619241.db2.gz XJDSEZUWXVBHQQ-UHFFFAOYSA-N 1 2 219.313 2.483 20 0 BEADLO CC[C@@H](NCc1[nH+]ccn1CC)C(F)F ZINC000567120252 326119602 /nfs/dbraw/zinc/11/96/02/326119602.db2.gz SBKDKUJDVDKCGG-MRVPVSSYSA-N 1 2 217.263 2.036 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ccno2)o1 ZINC000066561414 368652770 /nfs/dbraw/zinc/65/27/70/368652770.db2.gz KEJICDNTPMYTJD-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ccno2)o1 ZINC000066561414 368652776 /nfs/dbraw/zinc/65/27/76/368652776.db2.gz KEJICDNTPMYTJD-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO Cc1ccc2c(c1C)OC[C@@H]2[NH2+]Cc1ncc[nH]1 ZINC000066594057 368655350 /nfs/dbraw/zinc/65/53/50/368655350.db2.gz RGLAQGFJUTWTIF-LBPRGKRZSA-N 1 2 243.310 2.250 20 0 BEADLO CC[C@@]1(C(C)C)C[C@@H]1NC(=O)CCc1[nH]cc[nH+]1 ZINC000457277691 203031448 /nfs/dbraw/zinc/03/14/48/203031448.db2.gz KUGPEFQESXUDGN-FZMZJTMJSA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)(NC(=O)[C@@H]1CCC1(C)C)c1[nH]cc[nH+]1 ZINC000615952870 368762306 /nfs/dbraw/zinc/76/23/06/368762306.db2.gz IKAAGRZHPQWSIF-VIFPVBQESA-N 1 2 235.331 2.197 20 0 BEADLO CC(C)CC[C@H](C)NC(=O)CCn1cc[nH+]c1 ZINC000072619969 368775675 /nfs/dbraw/zinc/77/56/75/368775675.db2.gz ZCYBECPJEOMHMC-LBPRGKRZSA-N 1 2 237.347 2.214 20 0 BEADLO CC[NH+](CC)[C@H](C(=O)OC)c1ccc(F)cc1 ZINC000072557609 368773815 /nfs/dbraw/zinc/77/38/15/368773815.db2.gz MWDPXZPHWUBDCB-LBPRGKRZSA-N 1 2 239.290 2.382 20 0 BEADLO c1cc(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)on1 ZINC000074159319 368831552 /nfs/dbraw/zinc/83/15/52/368831552.db2.gz UPGDWCZNTLHDHQ-CQSZACIVSA-N 1 2 244.294 2.248 20 0 BEADLO c1cc(C[N@H+]2CCO[C@@H](c3ccccc3)C2)on1 ZINC000074159319 368831559 /nfs/dbraw/zinc/83/15/59/368831559.db2.gz UPGDWCZNTLHDHQ-CQSZACIVSA-N 1 2 244.294 2.248 20 0 BEADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccno2)no1 ZINC000074255569 368835208 /nfs/dbraw/zinc/83/52/08/368835208.db2.gz XOIGUGYZJVMEKF-LBPRGKRZSA-N 1 2 233.271 2.308 20 0 BEADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccno2)no1 ZINC000074255569 368835210 /nfs/dbraw/zinc/83/52/10/368835210.db2.gz XOIGUGYZJVMEKF-LBPRGKRZSA-N 1 2 233.271 2.308 20 0 BEADLO CCC(C)(C)CC(=O)NCCCn1cc[nH+]c1 ZINC000072934375 368785661 /nfs/dbraw/zinc/78/56/61/368785661.db2.gz PTSNWUPYOGJILY-UHFFFAOYSA-N 1 2 237.347 2.216 20 0 BEADLO CCN(C(=O)Cn1cc[nH+]c1)[C@H]1CCCC[C@H]1C ZINC000073306492 368799781 /nfs/dbraw/zinc/79/97/81/368799781.db2.gz MTKVJUIBYAWVJT-OLZOCXBDSA-N 1 2 249.358 2.310 20 0 BEADLO Cc1nc(NC(C)C)c2c([nH+]1)CCCC2 ZINC000114626793 368945236 /nfs/dbraw/zinc/94/52/36/368945236.db2.gz ZOWAFAYJWKPVOK-UHFFFAOYSA-N 1 2 205.305 2.484 20 0 BEADLO Cc1cc(C)c(CNC(=O)CCCF)c[nH+]1 ZINC000616115760 368960846 /nfs/dbraw/zinc/96/08/46/368960846.db2.gz MGIUCEMDLSZKGH-UHFFFAOYSA-N 1 2 224.279 2.064 20 0 BEADLO Cc1cc(C)c(CNC(=O)[C@H]2C[C@H]3C[C@H]3C2)c[nH+]1 ZINC000616116682 368961039 /nfs/dbraw/zinc/96/10/39/368961039.db2.gz TYALSJMHXCNURY-ITGUQSILSA-N 1 2 244.338 2.361 20 0 BEADLO C[C@@H]1CCC(C)(C)N1C(=O)CCc1c[nH+]c[nH]1 ZINC000616164911 368999859 /nfs/dbraw/zinc/99/98/59/368999859.db2.gz KMLFBMANMRMEIH-SNVBAGLBSA-N 1 2 235.331 2.132 20 0 BEADLO C[C@@H]1CCC(C)(C)N1C(=O)CCc1c[nH]c[nH+]1 ZINC000616164911 368999860 /nfs/dbraw/zinc/99/98/60/368999860.db2.gz KMLFBMANMRMEIH-SNVBAGLBSA-N 1 2 235.331 2.132 20 0 BEADLO CC[C@@H](CC(F)F)C(=O)Nc1cc[nH+]cc1C ZINC000457556417 203073709 /nfs/dbraw/zinc/07/37/09/203073709.db2.gz UOZJELXIHKZQAB-VIFPVBQESA-N 1 2 242.269 2.432 20 0 BEADLO CC(C)(C)C1CC(C(=O)NCCc2[nH]cc[nH+]2)C1 ZINC000457549273 203074270 /nfs/dbraw/zinc/07/42/70/203074270.db2.gz CHGSOHBKBQTIEO-UHFFFAOYSA-N 1 2 249.358 2.141 20 0 BEADLO CC[C@@H](CC(F)F)C(=O)Nc1cc[nH+]c(C)c1 ZINC000457557217 203074578 /nfs/dbraw/zinc/07/45/78/203074578.db2.gz IFTKQILMNIYJAA-VIFPVBQESA-N 1 2 242.269 2.432 20 0 BEADLO CC(C)(C)C1CC(C(=O)Nc2cc[nH+]cc2O)C1 ZINC000457681199 203088549 /nfs/dbraw/zinc/08/85/49/203088549.db2.gz HVULZXHAYYKAPA-UHFFFAOYSA-N 1 2 248.326 2.220 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)[C@H](C)C1CCC1 ZINC000457827861 203108549 /nfs/dbraw/zinc/10/85/49/203108549.db2.gz RNQHXENBYARWHQ-SNVBAGLBSA-N 1 2 248.326 2.143 20 0 BEADLO C[C@H](C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21)C1CCC1 ZINC000457889795 203118245 /nfs/dbraw/zinc/11/82/45/203118245.db2.gz YTGBYGKOVHRKAV-JBLDHEPKSA-N 1 2 247.342 2.441 20 0 BEADLO CCn1nncc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000459351534 203266044 /nfs/dbraw/zinc/26/60/44/203266044.db2.gz HCVIOTAEHLMTJU-AWEZNQCLSA-N 1 2 242.326 2.245 20 0 BEADLO CCn1nncc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000459351534 203266045 /nfs/dbraw/zinc/26/60/45/203266045.db2.gz HCVIOTAEHLMTJU-AWEZNQCLSA-N 1 2 242.326 2.245 20 0 BEADLO Cc1cc(NC(=O)N[C@]2(C)CC=CCC2)cc[nH+]1 ZINC000459479052 203288548 /nfs/dbraw/zinc/28/85/48/203288548.db2.gz JHFVNKAKECHAAO-CQSZACIVSA-N 1 2 245.326 2.432 20 0 BEADLO CCC(F)(F)C[NH2+]Cc1c(C2CC2)cnn1C ZINC000623679465 369380420 /nfs/dbraw/zinc/38/04/20/369380420.db2.gz YSACMSIXQPITOQ-UHFFFAOYSA-N 1 2 243.301 2.432 20 0 BEADLO COC1(C)C[NH+](Cc2cc(C)ccc2F)C1 ZINC000459583457 203306318 /nfs/dbraw/zinc/30/63/18/203306318.db2.gz NEOOZYONTMVLQO-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO CCC(F)(F)C[NH2+]Cc1nc(C)ccc1O ZINC000623679864 369381865 /nfs/dbraw/zinc/38/18/65/369381865.db2.gz NITJZYYCHOCZGA-UHFFFAOYSA-N 1 2 230.258 2.231 20 0 BEADLO FC(F)COC1C[NH+](Cc2cccs2)C1 ZINC000459588000 203307010 /nfs/dbraw/zinc/30/70/10/203307010.db2.gz HEMYLNATQAWSIE-UHFFFAOYSA-N 1 2 233.283 2.214 20 0 BEADLO CCC(F)(F)C[NH2+]Cc1cccnc1 ZINC000623680196 369387535 /nfs/dbraw/zinc/38/75/35/369387535.db2.gz AEDJBVJKZITNKV-UHFFFAOYSA-N 1 2 200.232 2.217 20 0 BEADLO CCCOc1cccc(C[NH+]2CC(OC)C2)c1 ZINC000459588926 203310146 /nfs/dbraw/zinc/31/01/46/203310146.db2.gz WZEQECZJTJFECN-UHFFFAOYSA-N 1 2 235.327 2.306 20 0 BEADLO OCCC1C[NH+](Cc2ccc(F)c(Cl)c2)C1 ZINC000459589637 203310512 /nfs/dbraw/zinc/31/05/12/203310512.db2.gz IFHHSQSCVZMTKF-UHFFFAOYSA-N 1 2 243.709 2.293 20 0 BEADLO CCOC1(C)C[NH+](Cc2ccnn2C(C)C)C1 ZINC000459611630 203312565 /nfs/dbraw/zinc/31/25/65/203312565.db2.gz AUJZKBYTXCAJDJ-UHFFFAOYSA-N 1 2 237.347 2.075 20 0 BEADLO COC1C[NH+](Cc2ccc(OCC3CC3)cc2)C1 ZINC000459572952 203305020 /nfs/dbraw/zinc/30/50/20/203305020.db2.gz BMSDWYNYECKGMK-UHFFFAOYSA-N 1 2 247.338 2.306 20 0 BEADLO CCOC1(C)C[NH+](Cc2cnc(CC)s2)C1 ZINC000459615640 203316923 /nfs/dbraw/zinc/31/69/23/203316923.db2.gz FSFSLXXUXOQGEW-UHFFFAOYSA-N 1 2 240.372 2.316 20 0 BEADLO CCC[C@@H](C)NC(=O)[C@H]1CCn2cc(C)[nH+]c2C1 ZINC000623685906 369404598 /nfs/dbraw/zinc/40/45/98/369404598.db2.gz YDBFMSAAFGXZEG-PWSUYJOCSA-N 1 2 249.358 2.059 20 0 BEADLO COCC1(C)C[NH+](Cc2c(F)cccc2F)C1 ZINC000459619884 203319461 /nfs/dbraw/zinc/31/94/61/203319461.db2.gz JNISVQHWIBDWLB-UHFFFAOYSA-N 1 2 241.281 2.433 20 0 BEADLO CC(C)c1ncc(C[NH+]2CC(C)(CO)C2)s1 ZINC000459625158 203321654 /nfs/dbraw/zinc/32/16/54/203321654.db2.gz XCBSBFNWRZWXKX-UHFFFAOYSA-N 1 2 240.372 2.081 20 0 BEADLO Cc1cc(C[NH+]2CC(OC(F)F)C2)cs1 ZINC000459633898 203326973 /nfs/dbraw/zinc/32/69/73/203326973.db2.gz VZULQTYTQJVRCN-UHFFFAOYSA-N 1 2 233.283 2.480 20 0 BEADLO CCc1cc(N(C)CCCSC)nc[nH+]1 ZINC000619589994 369488667 /nfs/dbraw/zinc/48/86/67/369488667.db2.gz MNMTVOMEFHZPMK-UHFFFAOYSA-N 1 2 225.361 2.228 20 0 BEADLO CCc1ccc(C[NH2+][C@H](C)c2ccn(C)n2)o1 ZINC000459740575 203350193 /nfs/dbraw/zinc/35/01/93/203350193.db2.gz FAEPCSHQEIJNAE-SNVBAGLBSA-N 1 2 233.315 2.426 20 0 BEADLO CC(C)(C)C(=O)NCC[NH+]1Cc2ccccc2C1 ZINC000619973291 369646317 /nfs/dbraw/zinc/64/63/17/369646317.db2.gz KZWCWPJPUQLDHD-UHFFFAOYSA-N 1 2 246.354 2.165 20 0 BEADLO CC(C)[C@H](NC(=O)C[C@H](C)n1cc[nH+]c1)C1CC1 ZINC000620032802 369677699 /nfs/dbraw/zinc/67/76/99/369677699.db2.gz FPPQXOGUAKMLIR-FZMZJTMJSA-N 1 2 249.358 2.385 20 0 BEADLO CC(C)C[C@@H](CO)Nc1cc[nH+]c(C(C)C)n1 ZINC000110587304 369870939 /nfs/dbraw/zinc/87/09/39/369870939.db2.gz AAUZMNAKJSQHBN-NSHDSACASA-N 1 2 237.347 2.419 20 0 BEADLO C[C@H](NC(=O)CCC(C)(C)C)c1[nH+]ccn1C ZINC000620600834 369950671 /nfs/dbraw/zinc/95/06/71/369950671.db2.gz QRVZZUWNMAYCNB-JTQLQIEISA-N 1 2 237.347 2.424 20 0 BEADLO C[C@@H](NC(=O)C(C1CC1)C1CC1)c1[nH+]ccn1C ZINC000620603814 369952103 /nfs/dbraw/zinc/95/21/03/369952103.db2.gz NNNASCUURBOHNE-SECBINFHSA-N 1 2 247.342 2.034 20 0 BEADLO C[C@@H](NC(=O)C[C@H]1C=CCCC1)c1[nH+]ccn1C ZINC000620604570 369953369 /nfs/dbraw/zinc/95/33/69/369953369.db2.gz SQIDQDPBXYDDDL-NEPJUHHUSA-N 1 2 247.342 2.344 20 0 BEADLO CC(C)C(C)(C)C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620605736 369953944 /nfs/dbraw/zinc/95/39/44/369953944.db2.gz JOSQNDKQSBSPAX-SNVBAGLBSA-N 1 2 237.347 2.280 20 0 BEADLO CC(C)C(C)(C)C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620605735 369954230 /nfs/dbraw/zinc/95/42/30/369954230.db2.gz JOSQNDKQSBSPAX-JTQLQIEISA-N 1 2 237.347 2.280 20 0 BEADLO CCCC[C@H](C)C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620606492 369954393 /nfs/dbraw/zinc/95/43/93/369954393.db2.gz UQKZMVSXJPDUEJ-QWRGUYRKSA-N 1 2 237.347 2.424 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1C[C@H]1C1CCC1)c1[nH+]ccn1C ZINC000620610871 369956803 /nfs/dbraw/zinc/95/68/03/369956803.db2.gz HZMOLBLXEXRYNQ-ADEWGFFLSA-N 1 2 247.342 2.034 20 0 BEADLO C[C@H](NC(=O)[C@@]1(C)CC=CCC1)c1[nH+]ccn1C ZINC000620609015 369957139 /nfs/dbraw/zinc/95/71/39/369957139.db2.gz AKHQLZPQTTZRFC-FZMZJTMJSA-N 1 2 247.342 2.344 20 0 BEADLO C[C@@H](NC(=O)CC(C)(C)C1CC1)c1[nH+]ccn1C ZINC000620609500 369957193 /nfs/dbraw/zinc/95/71/93/369957193.db2.gz RLGQVSHZMIZREM-SNVBAGLBSA-N 1 2 249.358 2.424 20 0 BEADLO C[C@H](NC(=O)C(C)(C)C1CCC1)c1[nH+]ccn1C ZINC000620612623 369957981 /nfs/dbraw/zinc/95/79/81/369957981.db2.gz ZOAUCWBCPJAUFA-JTQLQIEISA-N 1 2 249.358 2.424 20 0 BEADLO Cc1cn2ccc(NC(=O)COC(C)C)cc2[nH+]1 ZINC000620648644 369972775 /nfs/dbraw/zinc/97/27/75/369972775.db2.gz HLCIKTFXKZYQRZ-UHFFFAOYSA-N 1 2 247.298 2.006 20 0 BEADLO COC(C)(C)C(=O)Nc1ccn2cc(C)[nH+]c2c1 ZINC000620650073 369972844 /nfs/dbraw/zinc/97/28/44/369972844.db2.gz KZPOJISOKTZUKA-UHFFFAOYSA-N 1 2 247.298 2.006 20 0 BEADLO C[C@H](NC(=O)CC1CCCC1)c1[nH+]ccn1C ZINC000620592768 369945377 /nfs/dbraw/zinc/94/53/77/369945377.db2.gz XKUSXOVZQVPFPK-JTQLQIEISA-N 1 2 235.331 2.178 20 0 BEADLO CCC[C@H](C)CC(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620594312 369946511 /nfs/dbraw/zinc/94/65/11/369946511.db2.gz BXPQXERKYXPIDR-QWRGUYRKSA-N 1 2 237.347 2.424 20 0 BEADLO CCc1cc(NCCc2nc(C)cs2)nc[nH+]1 ZINC000063134385 370135810 /nfs/dbraw/zinc/13/58/10/370135810.db2.gz NAQDYQNQEULNLY-UHFFFAOYSA-N 1 2 248.355 2.459 20 0 BEADLO Cc1cc(C[NH+]2C[C@@H](C)C(=O)[C@H](C)C2)ccn1 ZINC000621315880 370241883 /nfs/dbraw/zinc/24/18/83/370241883.db2.gz NXVKOSKQULOGNH-GHMZBOCLSA-N 1 2 232.327 2.047 20 0 BEADLO C[N@H+](Cc1cncc(Cl)c1)Cc1cnccn1 ZINC000621261583 370194637 /nfs/dbraw/zinc/19/46/37/370194637.db2.gz WENLUCUASLFZBH-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[N@@H+](Cc1cncc(Cl)c1)Cc1cnccn1 ZINC000621261583 370194639 /nfs/dbraw/zinc/19/46/39/370194639.db2.gz WENLUCUASLFZBH-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO CCc1cc(N[C@H](C)c2nccc(C)n2)nc[nH+]1 ZINC000621330079 370263318 /nfs/dbraw/zinc/26/33/18/370263318.db2.gz YLICXQSPVISGCS-SNVBAGLBSA-N 1 2 243.314 2.311 20 0 BEADLO CCO[C@@H](CC)C(=O)Nc1cc[nH+]c(C)c1 ZINC000112298649 370275112 /nfs/dbraw/zinc/27/51/12/370275112.db2.gz FPFXXZYAYZMONF-NSHDSACASA-N 1 2 222.288 2.144 20 0 BEADLO C[C@H]1CCN(c2[nH]c3ccccc3[nH+]2)C[C@H]1CO ZINC000621347738 370282204 /nfs/dbraw/zinc/28/22/04/370282204.db2.gz KXOVISMBJMZJAJ-QWRGUYRKSA-N 1 2 245.326 2.018 20 0 BEADLO COC[C@H]1C[N@H+](C/C=C\c2ccccc2)CCO1 ZINC000254950758 370370552 /nfs/dbraw/zinc/37/05/52/370370552.db2.gz VXFKXTZAKWDARV-GTBONMDNSA-N 1 2 247.338 2.047 20 0 BEADLO COC[C@H]1C[N@@H+](C/C=C\c2ccccc2)CCO1 ZINC000254950758 370370554 /nfs/dbraw/zinc/37/05/54/370370554.db2.gz VXFKXTZAKWDARV-GTBONMDNSA-N 1 2 247.338 2.047 20 0 BEADLO CCC[C@H](C)N(C)C(=O)[C@@H]1CCc2[nH+]ccn2C1 ZINC000621545778 370384744 /nfs/dbraw/zinc/38/47/44/370384744.db2.gz FNHJIBGOVQESND-NWDGAFQWSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@@H]([NH2+][C@H](C(F)F)C1CCCCC1)C(N)=O ZINC000621403975 370340545 /nfs/dbraw/zinc/34/05/45/370340545.db2.gz FBOPAIOJTYJIFD-ZJUUUORDSA-N 1 2 248.317 2.054 20 0 BEADLO Cc1nc(C)c(CNc2cc(C)[nH+]cn2)o1 ZINC000311650379 370417593 /nfs/dbraw/zinc/41/75/93/370417593.db2.gz CEYOINIGCMZLJB-UHFFFAOYSA-N 1 2 218.260 2.002 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2nccnc2C)n1 ZINC000621717431 370466497 /nfs/dbraw/zinc/46/64/97/370466497.db2.gz DCLPCBCKUSZVHY-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2nccnc2C)n1 ZINC000621717431 370466499 /nfs/dbraw/zinc/46/64/99/370466499.db2.gz DCLPCBCKUSZVHY-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO CCO[C@@H]1CCCN(c2[nH+]cccc2OC)C1 ZINC000623890696 371141822 /nfs/dbraw/zinc/14/18/22/371141822.db2.gz UHROYHVUIPZIKK-LLVKDONJSA-N 1 2 236.315 2.096 20 0 BEADLO C[C@H]1CCN1c1nc2ccccc2n2c[nH+]cc12 ZINC000623889065 371141975 /nfs/dbraw/zinc/14/19/75/371141975.db2.gz BVLHXXNLXGBUSA-JTQLQIEISA-N 1 2 238.294 2.481 20 0 BEADLO Cn1nccc1C[NH2+][C@@H]1CCCc2scnc21 ZINC000623861497 371129600 /nfs/dbraw/zinc/12/96/00/371129600.db2.gz ZLGUTOMGILNLCU-SNVBAGLBSA-N 1 2 248.355 2.044 20 0 BEADLO CN(c1[nH+]c(C2CC2)nc2[nH]ccc21)C1CC1 ZINC000631056672 371181046 /nfs/dbraw/zinc/18/10/46/371181046.db2.gz NEZKLYLSMVTYMT-UHFFFAOYSA-N 1 2 228.299 2.434 20 0 BEADLO COC(=O)[C@H]([NH2+][C@@H]1C=CCCC1)C(C)(C)C ZINC000390649786 371224753 /nfs/dbraw/zinc/22/47/53/371224753.db2.gz OWZSPBKQXDFOSN-MNOVXSKESA-N 1 2 225.332 2.272 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2nncn2C)c(F)c1 ZINC000631063570 371238179 /nfs/dbraw/zinc/23/81/79/371238179.db2.gz MGPRZPQTHSTTCD-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO CCCC[NH2+][C@@H](Cc1ccccc1)C(=O)OC ZINC000125214558 371302202 /nfs/dbraw/zinc/30/22/02/371302202.db2.gz KSSYFLBKFSTZDB-ZDUSSCGKSA-N 1 2 235.327 2.160 20 0 BEADLO C[C@H](CO)CNc1cc2ccccc2c[nH+]1 ZINC000631072073 371337529 /nfs/dbraw/zinc/33/75/29/371337529.db2.gz UAIBPHGDSYGRRZ-JTQLQIEISA-N 1 2 216.284 2.275 20 0 BEADLO CCC(F)(F)C[NH2+][C@H](C)c1cnn(C)c1 ZINC000624147834 371341828 /nfs/dbraw/zinc/34/18/28/371341828.db2.gz LZZWJHGBMHNNOJ-MRVPVSSYSA-N 1 2 217.263 2.116 20 0 BEADLO COC(=O)[C@H](Cc1ccccc1)[NH2+]CCC1CC1 ZINC000125772103 371395224 /nfs/dbraw/zinc/39/52/24/371395224.db2.gz BJUIGFURARMJPW-AWEZNQCLSA-N 1 2 247.338 2.160 20 0 BEADLO COc1ccc[nH+]c1N1CCC[C@@H]2C[C@@H]21 ZINC000624210689 371397012 /nfs/dbraw/zinc/39/70/12/371397012.db2.gz URCWWHXCEILAFO-ZJUUUORDSA-N 1 2 204.273 2.079 20 0 BEADLO Fc1cccc2nc(N3CCCC[NH2+]3)oc21 ZINC000624214341 371401489 /nfs/dbraw/zinc/40/14/89/371401489.db2.gz AMRDJQJKEPXYHB-UHFFFAOYSA-N 1 2 221.235 2.072 20 0 BEADLO COCC1(CCNc2[nH+]cccc2OC)CC1 ZINC000624329103 371484230 /nfs/dbraw/zinc/48/42/30/371484230.db2.gz MFMKGGQXFMRZRK-UHFFFAOYSA-N 1 2 236.315 2.319 20 0 BEADLO CC(C)c1nc(NC[C@H](C)C[C@@H](C)O)cc[nH+]1 ZINC000156708947 371492532 /nfs/dbraw/zinc/49/25/32/371492532.db2.gz HHCOZSOVPWPIPP-GHMZBOCLSA-N 1 2 237.347 2.419 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1CCC[C@@H](C)O1 ZINC000624399632 371500926 /nfs/dbraw/zinc/50/09/26/371500926.db2.gz RASKYRUOUVPZOG-MNOVXSKESA-N 1 2 236.315 2.460 20 0 BEADLO CC[C@H](CCO)Nc1cc[nH+]c(C(C)C)n1 ZINC000156809234 371503265 /nfs/dbraw/zinc/50/32/65/371503265.db2.gz SDHSKTIWZBZDHQ-SNVBAGLBSA-N 1 2 223.320 2.173 20 0 BEADLO CSCC[C@H](C)N(C)c1cc(CO)cc[nH+]1 ZINC000157134932 371526228 /nfs/dbraw/zinc/52/62/28/371526228.db2.gz HZJCNWOINFSDPL-JTQLQIEISA-N 1 2 240.372 2.152 20 0 BEADLO CCC(F)(F)CNc1[nH+]c(C)nc2[nH]ccc21 ZINC000624560817 371541734 /nfs/dbraw/zinc/54/17/34/371541734.db2.gz XIHKNZWGHULCDW-UHFFFAOYSA-N 1 2 240.257 2.145 20 0 BEADLO COc1ccc(NCc2ccco2)[nH+]c1 ZINC000226947730 371759048 /nfs/dbraw/zinc/75/90/48/371759048.db2.gz QQMWBRKUYGOSCD-UHFFFAOYSA-N 1 2 204.229 2.295 20 0 BEADLO CCc1cc(NC[C@H](O)CC(C)(C)C)nc[nH+]1 ZINC000227356948 371842560 /nfs/dbraw/zinc/84/25/60/371842560.db2.gz DVQRQKGPRYLFEF-LLVKDONJSA-N 1 2 237.347 2.248 20 0 BEADLO COC(=O)c1coc(C[NH2+]Cc2ccc(C)o2)c1 ZINC000228171201 371999666 /nfs/dbraw/zinc/99/96/66/371999666.db2.gz DLFPFPSDFJBZQV-UHFFFAOYSA-N 1 2 249.266 2.257 20 0 BEADLO C[C@@H]1CN(c2cc3ccccc3c[nH+]2)C[C@H]1O ZINC000631189043 372223320 /nfs/dbraw/zinc/22/33/20/372223320.db2.gz XEBOYRSRYVYUJS-ZWNOBZJWSA-N 1 2 228.295 2.052 20 0 BEADLO CN(C)c1c[nH+]cc(N[C@@H]2CCCSC2)c1 ZINC000631204003 372233636 /nfs/dbraw/zinc/23/36/36/372233636.db2.gz WRWQGCFCRQTTEV-SNVBAGLBSA-N 1 2 237.372 2.455 20 0 BEADLO CCCCc1cc(N[C@@H](C)C[C@H](C)O)nc[nH+]1 ZINC000631203342 372233669 /nfs/dbraw/zinc/23/36/69/372233669.db2.gz OVDQBNGRLRUCMG-QWRGUYRKSA-N 1 2 237.347 2.391 20 0 BEADLO Cc1[nH]c(CNc2cnn3c2CCCC3)[nH+]c1C ZINC000631230474 372251390 /nfs/dbraw/zinc/25/13/90/372251390.db2.gz RFGPWFDMHBETHP-UHFFFAOYSA-N 1 2 245.330 2.171 20 0 BEADLO CCCCc1cc(NC[C@H]2C[C@@H](OC)C2)nc[nH+]1 ZINC000631394599 372333838 /nfs/dbraw/zinc/33/38/38/372333838.db2.gz QVCAKXABMUQXOZ-BJHJDKERSA-N 1 2 249.358 2.078 20 0 BEADLO CC(C)(F)CNc1cc(N2CCCC2)nc[nH+]1 ZINC000631408995 372343050 /nfs/dbraw/zinc/34/30/50/372343050.db2.gz WYXPHYJXODYNPA-UHFFFAOYSA-N 1 2 238.310 2.237 20 0 BEADLO CC(C)(F)CNc1cc(N2CCCC2)[nH+]cn1 ZINC000631408995 372343056 /nfs/dbraw/zinc/34/30/56/372343056.db2.gz WYXPHYJXODYNPA-UHFFFAOYSA-N 1 2 238.310 2.237 20 0 BEADLO CCC[C@@H](CCO)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000631427107 372357953 /nfs/dbraw/zinc/35/79/53/372357953.db2.gz MFMDTHQXQOVHES-LBPRGKRZSA-N 1 2 249.358 2.047 20 0 BEADLO CCC[C@H](CCO)Nc1[nH+]cccc1OC ZINC000631427226 372358066 /nfs/dbraw/zinc/35/80/66/372358066.db2.gz QHCTYYHQKPWPMX-SNVBAGLBSA-N 1 2 224.304 2.053 20 0 BEADLO Cc1ncc([C@H](C)Nc2cc[nH+]c(C)n2)s1 ZINC000631472299 372382708 /nfs/dbraw/zinc/38/27/08/372382708.db2.gz QCLKABPGXCBQLI-ZETCQYMHSA-N 1 2 234.328 2.145 20 0 BEADLO Cc1nc(N[C@@H](C)CC2CCC2)cc[nH+]1 ZINC000631518766 372405033 /nfs/dbraw/zinc/40/50/33/372405033.db2.gz WFBLBEYEUCKALP-VIFPVBQESA-N 1 2 205.305 2.198 20 0 BEADLO CCCCc1cc(NCc2conc2C)nc[nH+]1 ZINC000631439346 372364588 /nfs/dbraw/zinc/36/45/88/372364588.db2.gz DJUJXIVGNUHCAJ-UHFFFAOYSA-N 1 2 246.314 2.150 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@H]1CCCc2ncccc21 ZINC000631598648 372449401 /nfs/dbraw/zinc/44/94/01/372449401.db2.gz LFNYJCHEITYZKX-AWEZNQCLSA-N 1 2 242.326 2.280 20 0 BEADLO Cc1cc(NC2CCOCC2)nc(C2CC2)[nH+]1 ZINC000172014582 372857190 /nfs/dbraw/zinc/85/71/90/372857190.db2.gz OIJBFTHQWCPQGZ-UHFFFAOYSA-N 1 2 233.315 2.253 20 0 BEADLO O=C(Cc1cccc(F)c1)Nc1cc[nH+]cc1O ZINC000109891204 182041964 /nfs/dbraw/zinc/04/19/64/182041964.db2.gz XNRICPDOFQNBPK-UHFFFAOYSA-N 1 2 246.241 2.108 20 0 BEADLO O=C(NC1CCC1)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000336234021 182103164 /nfs/dbraw/zinc/10/31/64/182103164.db2.gz MNPSPOOXFFSPHF-LLVKDONJSA-N 1 2 248.330 2.199 20 0 BEADLO O=C(NCC1CC1)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000171707472 182137645 /nfs/dbraw/zinc/13/76/45/182137645.db2.gz SPPQAVNRSQHOMH-NSHDSACASA-N 1 2 248.330 2.056 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)NCC(C)(C)F)ccn12 ZINC000633720789 373708334 /nfs/dbraw/zinc/70/83/34/373708334.db2.gz SBZHHELJOZKTSM-UHFFFAOYSA-N 1 2 249.289 2.121 20 0 BEADLO CCNc1ccc(Nc2ncccn2)c[nH+]1 ZINC001643324225 1172453701 /nfs/dbraw/zinc/45/37/01/1172453701.db2.gz YGCNRBJLHNWVAI-UHFFFAOYSA-N 1 2 215.260 2.047 20 0 BEADLO Cc1cc(NC(=O)CCc2c[nH+]cn2C)cs1 ZINC000634424321 374248426 /nfs/dbraw/zinc/24/84/26/374248426.db2.gz TZHWVNXFSACQJG-UHFFFAOYSA-N 1 2 249.339 2.361 20 0 BEADLO CCc1[nH+]c(C)ccc1OCCc1ccnn1C ZINC000634548173 374302745 /nfs/dbraw/zinc/30/27/45/374302745.db2.gz UDJKNJQKQIILNA-UHFFFAOYSA-N 1 2 245.326 2.307 20 0 BEADLO F[C@]1(c2ccccc2)C[C@@H]1[NH2+]Cc1cc[nH]n1 ZINC000424194291 206034784 /nfs/dbraw/zinc/03/47/84/206034784.db2.gz LHKRUYXHNQIRRY-STQMWFEESA-N 1 2 231.274 2.137 20 0 BEADLO C[N@H+](Cc1cn(C(C)(C)C)nn1)[C@@H]1CC1(C)C ZINC000426577575 206051317 /nfs/dbraw/zinc/05/13/17/206051317.db2.gz CYIOSESPCHBSKG-LLVKDONJSA-N 1 2 236.363 2.263 20 0 BEADLO C[N@@H+](Cc1cn(C(C)(C)C)nn1)[C@@H]1CC1(C)C ZINC000426577575 206051320 /nfs/dbraw/zinc/05/13/20/206051320.db2.gz CYIOSESPCHBSKG-LLVKDONJSA-N 1 2 236.363 2.263 20 0 BEADLO C=Cn1cc(C[NH2+]Cc2csc(CC)n2)cn1 ZINC000194302387 206087159 /nfs/dbraw/zinc/08/71/59/206087159.db2.gz AGMUWCBGMLQUGQ-UHFFFAOYSA-N 1 2 248.355 2.292 20 0 BEADLO CC(C)Cn1cc(C[N@@H+]2CC[C@@H](F)C2)cn1 ZINC000449392313 206096282 /nfs/dbraw/zinc/09/62/82/206096282.db2.gz JQGPHGBREGVOQM-GFCCVEGCSA-N 1 2 225.311 2.083 20 0 BEADLO CC(C)Cn1cc(C[N@H+]2CC[C@@H](F)C2)cn1 ZINC000449392313 206096286 /nfs/dbraw/zinc/09/62/86/206096286.db2.gz JQGPHGBREGVOQM-GFCCVEGCSA-N 1 2 225.311 2.083 20 0 BEADLO COC1C[NH+](C/C(C)=C\c2ccccc2)C1 ZINC000459578412 206135828 /nfs/dbraw/zinc/13/58/28/206135828.db2.gz IFKPSUMHVHQZDC-WQLSENKSSA-N 1 2 217.312 2.421 20 0 BEADLO COC1(C)C[NH+](Cc2ccc(C)c(F)c2)C1 ZINC000459580769 206136318 /nfs/dbraw/zinc/13/63/18/206136318.db2.gz KFGBINXRTGOUMF-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO O=C(Nc1cc[nH+]cc1O)c1cc(Cl)c[nH]1 ZINC000109891419 182387969 /nfs/dbraw/zinc/38/79/69/182387969.db2.gz PHYANNRFUBBHPU-UHFFFAOYSA-N 1 2 237.646 2.021 20 0 BEADLO CCOCCC[N@@H+]1CCC[C@@H]1C(F)F ZINC000353177177 170373926 /nfs/dbraw/zinc/37/39/26/170373926.db2.gz VNZOPFVHSIXQAM-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CCOCCC[N@H+]1CCC[C@@H]1C(F)F ZINC000353177177 170373927 /nfs/dbraw/zinc/37/39/27/170373927.db2.gz VNZOPFVHSIXQAM-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO OC1(CNc2cccc[nH+]2)CCCCC1 ZINC000083466775 183021032 /nfs/dbraw/zinc/02/10/32/183021032.db2.gz XAHFSWVDWPSUFQ-UHFFFAOYSA-N 1 2 206.289 2.189 20 0 BEADLO OC1(COc2ccc(-n3cc[nH+]c3)cc2)CCC1 ZINC000339318997 183021995 /nfs/dbraw/zinc/02/19/95/183021995.db2.gz DCHQEPASRCDHLT-UHFFFAOYSA-N 1 2 244.294 2.166 20 0 BEADLO OCC(F)(F)C[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000184707166 183035113 /nfs/dbraw/zinc/03/51/13/183035113.db2.gz RFBJUNRELFCGBW-LBPRGKRZSA-N 1 2 241.281 2.355 20 0 BEADLO OCC(F)(F)C[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000184700663 183035301 /nfs/dbraw/zinc/03/53/01/183035301.db2.gz ZFHCTYGMRWPAJO-NSHDSACASA-N 1 2 245.244 2.030 20 0 BEADLO OCCC[N@H+](Cc1ccon1)Cc1ccccc1 ZINC000268968599 183054084 /nfs/dbraw/zinc/05/40/84/183054084.db2.gz LAXHCJAHUZFHHN-UHFFFAOYSA-N 1 2 246.310 2.059 20 0 BEADLO OCCC[N@@H+](Cc1ccon1)Cc1ccccc1 ZINC000268968599 183054087 /nfs/dbraw/zinc/05/40/87/183054087.db2.gz LAXHCJAHUZFHHN-UHFFFAOYSA-N 1 2 246.310 2.059 20 0 BEADLO OCC[N@H+](CCCCC(F)(F)F)CC(F)F ZINC000361345783 183065535 /nfs/dbraw/zinc/06/55/35/183065535.db2.gz KHXBUKCNQQCBEV-UHFFFAOYSA-N 1 2 249.223 2.278 20 0 BEADLO OCC[N@@H+](CCCCC(F)(F)F)CC(F)F ZINC000361345783 183065537 /nfs/dbraw/zinc/06/55/37/183065537.db2.gz KHXBUKCNQQCBEV-UHFFFAOYSA-N 1 2 249.223 2.278 20 0 BEADLO OCC[N@H+](Cc1cccc(O)c1Cl)C1CC1 ZINC000295225781 183070907 /nfs/dbraw/zinc/07/09/07/183070907.db2.gz CFHSFFBOZCJCNS-UHFFFAOYSA-N 1 2 241.718 2.002 20 0 BEADLO OCC[N@@H+](Cc1cccc(O)c1Cl)C1CC1 ZINC000295225781 183070909 /nfs/dbraw/zinc/07/09/09/183070909.db2.gz CFHSFFBOZCJCNS-UHFFFAOYSA-N 1 2 241.718 2.002 20 0 BEADLO OCCNc1[nH+]c2ccccc2n1CC1CCC1 ZINC000269886493 183081231 /nfs/dbraw/zinc/08/12/31/183081231.db2.gz UQGPRLQJZFEEHY-UHFFFAOYSA-N 1 2 245.326 2.241 20 0 BEADLO OC[C@@H](Cc1ccccc1)Nc1cccc[nH+]1 ZINC000063218580 183105859 /nfs/dbraw/zinc/10/58/59/183105859.db2.gz ZMFYVFSEJJNFNM-CYBMUJFWSA-N 1 2 228.295 2.097 20 0 BEADLO OC[C@@H](Nc1cccc[nH+]1)c1ccsc1 ZINC000302288607 183111267 /nfs/dbraw/zinc/11/12/67/183111267.db2.gz WGKYGHJUQKCQHY-SNVBAGLBSA-N 1 2 220.297 2.289 20 0 BEADLO OCc1ccc(C[N@@H+]2CCC=C(F)C2)cc1 ZINC000272498870 183162723 /nfs/dbraw/zinc/16/27/23/183162723.db2.gz NSQBWQDSMGHSJE-UHFFFAOYSA-N 1 2 221.275 2.238 20 0 BEADLO OCc1ccc(C[N@H+]2CCC=C(F)C2)cc1 ZINC000272498870 183162724 /nfs/dbraw/zinc/16/27/24/183162724.db2.gz NSQBWQDSMGHSJE-UHFFFAOYSA-N 1 2 221.275 2.238 20 0 BEADLO O[C@@H](CNc1cc(C(F)(F)F)cc[nH+]1)C1CC1 ZINC000078612430 183180853 /nfs/dbraw/zinc/18/08/53/183180853.db2.gz KZERCFXLKZQJNN-VIFPVBQESA-N 1 2 246.232 2.283 20 0 BEADLO O[C@@H](CNc1ccc2ccccc2[nH+]1)C1CC1 ZINC000071306206 183182372 /nfs/dbraw/zinc/18/23/72/183182372.db2.gz SOIGOMOFKFZHKK-ZDUSSCGKSA-N 1 2 228.295 2.418 20 0 BEADLO OCc1ccc(NCc2ccsc2)[nH+]c1 ZINC000308949744 183166404 /nfs/dbraw/zinc/16/64/04/183166404.db2.gz UNFDFTQERWMVQO-UHFFFAOYSA-N 1 2 220.297 2.248 20 0 BEADLO OCc1ccc(NC[C@H]2CC=CCC2)[nH+]c1 ZINC000284310923 183166582 /nfs/dbraw/zinc/16/65/82/183166582.db2.gz VSFOITYAZCGUKS-NSHDSACASA-N 1 2 218.300 2.342 20 0 BEADLO O[C@@H](CC1CCCC1)C[N@@H+]1CCC(F)(F)C1 ZINC000313268370 183172838 /nfs/dbraw/zinc/17/28/38/183172838.db2.gz IPWUSCZWECHEPD-NSHDSACASA-N 1 2 233.302 2.269 20 0 BEADLO O[C@@H](CC1CCCC1)C[N@H+]1CCC(F)(F)C1 ZINC000313268370 183172840 /nfs/dbraw/zinc/17/28/40/183172840.db2.gz IPWUSCZWECHEPD-NSHDSACASA-N 1 2 233.302 2.269 20 0 BEADLO O[C@@H](C[N@@H+]1CCC=C(F)C1)c1ccccc1 ZINC000272489340 183175846 /nfs/dbraw/zinc/17/58/46/183175846.db2.gz MYGNEMPLARVOTJ-ZDUSSCGKSA-N 1 2 221.275 2.279 20 0 BEADLO O[C@@H](C[N@H+]1CCC=C(F)C1)c1ccccc1 ZINC000272489340 183175848 /nfs/dbraw/zinc/17/58/48/183175848.db2.gz MYGNEMPLARVOTJ-ZDUSSCGKSA-N 1 2 221.275 2.279 20 0 BEADLO O[C@@H]1CCC[N@H+](Cc2csc(Cl)n2)CC1 ZINC000294103417 183194174 /nfs/dbraw/zinc/19/41/74/183194174.db2.gz SHDRIFQFDIUGEA-SECBINFHSA-N 1 2 246.763 2.143 20 0 BEADLO O[C@@H]1CCC[N@@H+](Cc2csc(Cl)n2)CC1 ZINC000294103417 183194176 /nfs/dbraw/zinc/19/41/76/183194176.db2.gz SHDRIFQFDIUGEA-SECBINFHSA-N 1 2 246.763 2.143 20 0 BEADLO O[C@H](CNc1cc(C(F)(F)F)cc[nH+]1)C1CC1 ZINC000078612433 183224912 /nfs/dbraw/zinc/22/49/12/183224912.db2.gz KZERCFXLKZQJNN-SECBINFHSA-N 1 2 246.232 2.283 20 0 BEADLO O[C@H](CNc1cccc[nH+]1)c1ccccc1F ZINC000301499965 183226515 /nfs/dbraw/zinc/22/65/15/183226515.db2.gz DFMITXFNRABPQH-GFCCVEGCSA-N 1 2 232.258 2.366 20 0 BEADLO O[C@H](Cc1cccc(Cl)c1)Cn1cc[nH+]c1 ZINC000287563829 183227641 /nfs/dbraw/zinc/22/76/41/183227641.db2.gz BIBSZETUXYFMKW-GFCCVEGCSA-N 1 2 236.702 2.140 20 0 BEADLO CCCN(CC(C)C)C(=O)CCn1cc[nH+]c1 ZINC000299602656 169104190 /nfs/dbraw/zinc/10/41/90/169104190.db2.gz NADAKZLIBRVSIR-UHFFFAOYSA-N 1 2 237.347 2.168 20 0 BEADLO CCC[N@H+](CC)[C@H](C(=O)OC)c1cccnc1 ZINC000270683008 169131500 /nfs/dbraw/zinc/13/15/00/169131500.db2.gz CUSPEOXEDMGPTK-LBPRGKRZSA-N 1 2 236.315 2.028 20 0 BEADLO CCC[N@@H+](CC)[C@H](C(=O)OC)c1cccnc1 ZINC000270683008 169131503 /nfs/dbraw/zinc/13/15/03/169131503.db2.gz CUSPEOXEDMGPTK-LBPRGKRZSA-N 1 2 236.315 2.028 20 0 BEADLO Oc1ccc2c(c1)OCC[N@@H+](Cc1ccco1)C2 ZINC000289791970 183281732 /nfs/dbraw/zinc/28/17/32/183281732.db2.gz SAXIDGRSYYSHBJ-UHFFFAOYSA-N 1 2 245.278 2.380 20 0 BEADLO Oc1ccc2c(c1)OCC[N@H+](Cc1ccco1)C2 ZINC000289791970 183281734 /nfs/dbraw/zinc/28/17/34/183281734.db2.gz SAXIDGRSYYSHBJ-UHFFFAOYSA-N 1 2 245.278 2.380 20 0 BEADLO Oc1cc(F)cc(C[N@@H+]2CCC[C@H]2CF)c1 ZINC000294044097 183259278 /nfs/dbraw/zinc/25/92/78/183259278.db2.gz PBQOIMKPQQJULT-NSHDSACASA-N 1 2 227.254 2.465 20 0 BEADLO Oc1cc(F)cc(C[N@H+]2CCC[C@H]2CF)c1 ZINC000294044097 183259280 /nfs/dbraw/zinc/25/92/80/183259280.db2.gz PBQOIMKPQQJULT-NSHDSACASA-N 1 2 227.254 2.465 20 0 BEADLO Oc1cccc2c1CC[C@H]2[NH2+]Cc1cocn1 ZINC000277068586 183296548 /nfs/dbraw/zinc/29/65/48/183296548.db2.gz SDJNLPDGMRPICL-GFCCVEGCSA-N 1 2 230.267 2.157 20 0 BEADLO c1c[nH+]c(CNCc2nc(C3CC3)cs2)[nH]1 ZINC000131072391 183324567 /nfs/dbraw/zinc/32/45/67/183324567.db2.gz WYONJJXQOHCMRU-UHFFFAOYSA-N 1 2 234.328 2.033 20 0 BEADLO c1c[nH]c([C@H]2CCC[N@H+]2Cc2cnc[nH]2)c1 ZINC000274882937 183328873 /nfs/dbraw/zinc/32/88/73/183328873.db2.gz XGAQUFFOVWXXRY-GFCCVEGCSA-N 1 2 216.288 2.075 20 0 BEADLO c1c[nH]c([C@H]2CCC[N@@H+]2Cc2cnc[nH]2)c1 ZINC000274882937 183328877 /nfs/dbraw/zinc/32/88/77/183328877.db2.gz XGAQUFFOVWXXRY-GFCCVEGCSA-N 1 2 216.288 2.075 20 0 BEADLO CCCN(Cc1cc[nH+]c(N)c1)CC(F)F ZINC000298031270 169179097 /nfs/dbraw/zinc/17/90/97/169179097.db2.gz FNCYMSGFCSQOGM-UHFFFAOYSA-N 1 2 229.274 2.141 20 0 BEADLO c1cc(CCNc2cc[nH+]c(C3CC3)n2)ccn1 ZINC000268616729 183337961 /nfs/dbraw/zinc/33/79/61/183337961.db2.gz XRICZFHVKDSPON-UHFFFAOYSA-N 1 2 240.310 2.404 20 0 BEADLO c1cn(-c2cccc(N[C@@H]3CCOC3)c2)c[nH+]1 ZINC000109429745 183359151 /nfs/dbraw/zinc/35/91/51/183359151.db2.gz IYXUJAUZZOVROY-GFCCVEGCSA-N 1 2 229.283 2.073 20 0 BEADLO c1nnnn1-c1ccc([NH2+]C2CCCCC2)cc1 ZINC000020094434 183334278 /nfs/dbraw/zinc/33/42/78/183334278.db2.gz FTXPCBJEUBFCQI-UHFFFAOYSA-N 1 2 243.314 2.407 20 0 BEADLO c1cc(C[N@@H+]2CCC[C@H]2c2ccncc2)no1 ZINC000153839670 183360840 /nfs/dbraw/zinc/36/08/40/183360840.db2.gz AFMSCTICMABQNG-ZDUSSCGKSA-N 1 2 229.283 2.407 20 0 BEADLO c1cc(C[N@H+]2CCC[C@H]2c2ccncc2)no1 ZINC000153839670 183360845 /nfs/dbraw/zinc/36/08/45/183360845.db2.gz AFMSCTICMABQNG-ZDUSSCGKSA-N 1 2 229.283 2.407 20 0 BEADLO c1ccc(-c2noc([C@H]3CSC[NH2+]3)n2)cc1 ZINC000229002692 183385433 /nfs/dbraw/zinc/38/54/33/183385433.db2.gz QEVUCQYUKRIQSM-SECBINFHSA-N 1 2 233.296 2.072 20 0 BEADLO CCCOc1ccc(C[NH2+]Cc2ccn[nH]2)cc1 ZINC000041014661 169318735 /nfs/dbraw/zinc/31/87/35/169318735.db2.gz BXEPHYUZYYVXAO-UHFFFAOYSA-N 1 2 245.326 2.488 20 0 BEADLO CCC[C@@H](C(=O)NCc1[nH]cc[nH+]1)C(C)C ZINC000155452996 169345447 /nfs/dbraw/zinc/34/54/47/169345447.db2.gz KBVOFABXSDZDIR-SNVBAGLBSA-N 1 2 223.320 2.098 20 0 BEADLO CCC[C@@H](C)C(=O)N(C)CCCn1cc[nH+]c1 ZINC000154848035 169347775 /nfs/dbraw/zinc/34/77/75/169347775.db2.gz QSRMYKHOIGOOIG-GFCCVEGCSA-N 1 2 237.347 2.168 20 0 BEADLO CCC[C@@H](C(=O)OCC)[N@H+](C)Cc1ccco1 ZINC000096593396 169347779 /nfs/dbraw/zinc/34/77/79/169347779.db2.gz KSKTWYTYJINRTQ-LBPRGKRZSA-N 1 2 239.315 2.443 20 0 BEADLO CCC[C@@H](C(=O)OCC)[N@@H+](C)Cc1ccco1 ZINC000096593396 169347781 /nfs/dbraw/zinc/34/77/81/169347781.db2.gz KSKTWYTYJINRTQ-LBPRGKRZSA-N 1 2 239.315 2.443 20 0 BEADLO CCC[C@@H](C)C(=O)NC[C@@H](C)Cn1cc[nH+]c1 ZINC000265778304 169350238 /nfs/dbraw/zinc/35/02/38/169350238.db2.gz GJHHEENMRVXIDS-VXGBXAGGSA-N 1 2 237.347 2.072 20 0 BEADLO CCC[C@@H](C)C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000125322529 169351891 /nfs/dbraw/zinc/35/18/91/169351891.db2.gz JBHDKPFVQPWFBG-ZJUUUORDSA-N 1 2 223.320 2.413 20 0 BEADLO c1cn(CCSCc2cccnc2)c[nH+]1 ZINC000341991195 183496426 /nfs/dbraw/zinc/49/64/26/183496426.db2.gz BTMBEXPNCLUCPG-UHFFFAOYSA-N 1 2 219.313 2.212 20 0 BEADLO CCC[C@@H](CC)[S@@](=O)Cc1c[nH+]cn1C ZINC000280004374 169381355 /nfs/dbraw/zinc/38/13/55/169381355.db2.gz NDERJSDAVWCKLN-ABAIWWIYSA-N 1 2 228.361 2.248 20 0 BEADLO CCc1cn(Cc2c(C)nn(C)c2Cl)c[nH+]1 ZINC001644228028 1172534047 /nfs/dbraw/zinc/53/40/47/1172534047.db2.gz SYZJVGIEJVLGOM-UHFFFAOYSA-N 1 2 238.722 2.189 20 0 BEADLO CCc1cn(C[C@@H]2CC3(CCC3)CO2)c[nH+]1 ZINC001644227334 1172534812 /nfs/dbraw/zinc/53/48/12/1172534812.db2.gz KAGNDKREUADEFQ-LBPRGKRZSA-N 1 2 220.316 2.405 20 0 BEADLO CCC[C@@H]1C[C@@H]1C(=O)Nc1cc[nH+]cc1CC ZINC000361788394 169425388 /nfs/dbraw/zinc/42/53/88/169425388.db2.gz RNDGREYXSULSIQ-NEPJUHHUSA-N 1 2 232.327 2.441 20 0 BEADLO c1cc2c(nc[nH+]c2SC[C@H]2CCCO2)[nH]1 ZINC000276859439 183535415 /nfs/dbraw/zinc/53/54/15/183535415.db2.gz GEKGLFQRWGQENC-MRVPVSSYSA-N 1 2 235.312 2.229 20 0 BEADLO CC(C)(C)OC(=O)[C@H]1CCN(c2cccc[nH+]2)C1 ZINC000176957699 166673441 /nfs/dbraw/zinc/67/34/41/166673441.db2.gz YKEDCNWYZSQMMZ-NSHDSACASA-N 1 2 248.326 2.250 20 0 BEADLO CC1(C[N@@H+]2CCCC[C@@H]2C(F)F)COC1 ZINC000337402376 168025046 /nfs/dbraw/zinc/02/50/46/168025046.db2.gz LGIQCXZMEGOAPY-SECBINFHSA-N 1 2 219.275 2.143 20 0 BEADLO CC1(C[N@H+]2CCCC[C@@H]2C(F)F)COC1 ZINC000337402376 168025048 /nfs/dbraw/zinc/02/50/48/168025048.db2.gz LGIQCXZMEGOAPY-SECBINFHSA-N 1 2 219.275 2.143 20 0 BEADLO CCN(C(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21)C1CC1 ZINC000334074420 169645483 /nfs/dbraw/zinc/64/54/83/169645483.db2.gz JFUIOKVDBAXAQF-KOLCDFICSA-N 1 2 248.330 2.083 20 0 BEADLO Cc1nc(N2C[C@H](C)CC[C@H]2C)cc[nH+]1 ZINC000247448127 383839720 /nfs/dbraw/zinc/83/97/20/383839720.db2.gz OOARHCISJMQYCZ-NXEZZACHSA-N 1 2 205.305 2.410 20 0 BEADLO c1cn(C2CC[NH+](Cc3cscn3)CC2)cn1 ZINC000111243046 383844472 /nfs/dbraw/zinc/84/44/72/383844472.db2.gz XTJOAXWFMVMTKN-UHFFFAOYSA-N 1 2 248.355 2.177 20 0 BEADLO c1snnc1C[NH2+][C@H]1CCc2ccccc21 ZINC000036902049 383919423 /nfs/dbraw/zinc/91/94/23/383919423.db2.gz YRBOUKVFKZQHKN-LBPRGKRZSA-N 1 2 231.324 2.315 20 0 BEADLO C[C@@H](NC(=O)/C=C/c1ccsc1)c1[nH]cc[nH+]1 ZINC000493690311 533018181 /nfs/dbraw/zinc/01/81/81/533018181.db2.gz RPDMGLVDSQYOFD-GKQMSVHHSA-N 1 2 247.323 2.362 20 0 BEADLO CCc1ccc([C@H](C)[NH2+][C@@H](C)C(=O)OC)cc1 ZINC000037073942 383935158 /nfs/dbraw/zinc/93/51/58/383935158.db2.gz PNSZGMKLSPPBTQ-QWRGUYRKSA-N 1 2 235.327 2.461 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1ccc(C)cn1 ZINC000119843426 383897630 /nfs/dbraw/zinc/89/76/30/383897630.db2.gz GOGRJRHMQQKKIS-ZDUSSCGKSA-N 1 2 220.316 2.001 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1ccc(C)cn1 ZINC000119843426 383897634 /nfs/dbraw/zinc/89/76/34/383897634.db2.gz GOGRJRHMQQKKIS-ZDUSSCGKSA-N 1 2 220.316 2.001 20 0 BEADLO CC[C@H]1CC[C@H](C)N1c1nc[nH+]c(N)c1Cl ZINC000234077230 383903350 /nfs/dbraw/zinc/90/33/50/383903350.db2.gz RMFLBDXBXMQVEK-YUMQZZPRSA-N 1 2 240.738 2.480 20 0 BEADLO c1cc(C[NH2+][C@@H]2CCOc3ccccc32)n[nH]1 ZINC000037074414 383934327 /nfs/dbraw/zinc/93/43/27/383934327.db2.gz YVIYWWZIIAUFRK-GFCCVEGCSA-N 1 2 229.283 2.023 20 0 BEADLO CCC(CC)CN(CC)C(=O)Cn1cc[nH+]c1 ZINC000569402239 383989624 /nfs/dbraw/zinc/98/96/24/383989624.db2.gz VKEOVHUUZNKCPJ-UHFFFAOYSA-N 1 2 237.347 2.168 20 0 BEADLO CC[C@H]([NH2+][C@@H]1C[C@H](C)N(C2CC2)C1)C(F)F ZINC000449364814 383991236 /nfs/dbraw/zinc/99/12/36/383991236.db2.gz UJUBUVYZYQVSTE-NGZCFLSTSA-N 1 2 232.318 2.245 20 0 BEADLO C[C@@H]1C[C@H](NCc2cscn2)c2[nH+]ccn21 ZINC000345345018 383942455 /nfs/dbraw/zinc/94/24/55/383942455.db2.gz BKNFOYGAADFFFB-SCZZXKLOSA-N 1 2 234.328 2.135 20 0 BEADLO C[C@@H]([NH2+]Cc1cccnc1)c1nccs1 ZINC000070621421 383944798 /nfs/dbraw/zinc/94/47/98/383944798.db2.gz YNYAWUULYVAZSY-SECBINFHSA-N 1 2 219.313 2.389 20 0 BEADLO Cc1csc(C[N@@H+]2CCO[C@H]3CCC[C@H]32)n1 ZINC000268000105 383950993 /nfs/dbraw/zinc/95/09/93/383950993.db2.gz CQILQUYEOOJKSH-MNOVXSKESA-N 1 2 238.356 2.205 20 0 BEADLO Cc1csc(C[N@H+]2CCO[C@H]3CCC[C@H]32)n1 ZINC000268000105 383951003 /nfs/dbraw/zinc/95/10/03/383951003.db2.gz CQILQUYEOOJKSH-MNOVXSKESA-N 1 2 238.356 2.205 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@H](C)CCc1ccsc1 ZINC000309445239 384045102 /nfs/dbraw/zinc/04/51/02/384045102.db2.gz JOXXCHFORZBSQD-NXEZZACHSA-N 1 2 241.356 2.220 20 0 BEADLO CC(C)n1cc([C@H](C)[NH2+]Cc2ccn(C)n2)cn1 ZINC000558467982 384030058 /nfs/dbraw/zinc/03/00/58/384030058.db2.gz MQKGZVAUBHWZSU-NSHDSACASA-N 1 2 247.346 2.048 20 0 BEADLO CC(C)C(C[N@H+](CCO)CC(F)F)C(C)C ZINC000560273304 384031625 /nfs/dbraw/zinc/03/16/25/384031625.db2.gz ICSMIVAYZFUMIJ-UHFFFAOYSA-N 1 2 237.334 2.474 20 0 BEADLO CC(C)C(C[N@@H+](CCO)CC(F)F)C(C)C ZINC000560273304 384031633 /nfs/dbraw/zinc/03/16/33/384031633.db2.gz ICSMIVAYZFUMIJ-UHFFFAOYSA-N 1 2 237.334 2.474 20 0 BEADLO CC[C@H](CC(=O)NCc1[nH]cc[nH+]1)C(C)C ZINC000114336859 384032161 /nfs/dbraw/zinc/03/21/61/384032161.db2.gz BSUXCWWBUUUZFF-SNVBAGLBSA-N 1 2 223.320 2.098 20 0 BEADLO CO[C@H]1C[C@H](Nc2cccc[nH+]2)C1(C)C ZINC000227822583 134389192 /nfs/dbraw/zinc/38/91/92/134389192.db2.gz YPIWFZKNIILKMY-UWVGGRQHSA-N 1 2 206.289 2.307 20 0 BEADLO CO[C@@H]1C[C@H](Nc2cc(C)[nH+]cn2)C1(C)C ZINC000227822023 134389253 /nfs/dbraw/zinc/38/92/53/134389253.db2.gz GAIPUMOONUHYPJ-VHSXEESVSA-N 1 2 221.304 2.010 20 0 BEADLO CC(C)CCN(C(=O)CCn1cc[nH+]c1)C1CC1 ZINC000299693064 384069131 /nfs/dbraw/zinc/06/91/31/384069131.db2.gz WXCPHPHAPNYPIG-UHFFFAOYSA-N 1 2 249.358 2.310 20 0 BEADLO COCc1ccc(C[NH2+]C(CF)CF)cc1 ZINC000449381833 384103863 /nfs/dbraw/zinc/10/38/63/384103863.db2.gz TWHMLUXWZWQKOP-UHFFFAOYSA-N 1 2 229.270 2.230 20 0 BEADLO Cn1c[nH+]cc1COc1cccc2c1CCC2=O ZINC000091278521 384112261 /nfs/dbraw/zinc/11/22/61/384112261.db2.gz ZSOISTMUMSEORV-UHFFFAOYSA-N 1 2 242.278 2.128 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1CCCOCC1 ZINC000569500936 384133636 /nfs/dbraw/zinc/13/36/36/384133636.db2.gz BXBAVWISXKYRJK-NSHDSACASA-N 1 2 221.304 2.074 20 0 BEADLO Cc1nc(C[NH+]2C[C@H](C)O[C@@H](C)C2)c(C)s1 ZINC000336555928 384135195 /nfs/dbraw/zinc/13/51/95/384135195.db2.gz JLPZIKBPQMGZDO-IUCAKERBSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1cc(NC(=O)NC2(C3(C)CC3)CC2)cc[nH+]1 ZINC000560412372 384126015 /nfs/dbraw/zinc/12/60/15/384126015.db2.gz ZFVNYGOILKQHPP-UHFFFAOYSA-N 1 2 245.326 2.266 20 0 BEADLO CC[C@H](NC(=O)CCC(F)(F)F)c1[nH]cc[nH+]1 ZINC000140518131 384131633 /nfs/dbraw/zinc/13/16/33/384131633.db2.gz QAMVSEGQUBKYFU-ZETCQYMHSA-N 1 2 249.236 2.320 20 0 BEADLO Cc1cc(C[N@H+]2CCOC[C@@H]2C)ccc1F ZINC000091814849 384148148 /nfs/dbraw/zinc/14/81/48/384148148.db2.gz GZRKVYPMMDDJLI-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC[C@@H]2C)ccc1F ZINC000091814849 384148153 /nfs/dbraw/zinc/14/81/53/384148153.db2.gz GZRKVYPMMDDJLI-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO CCc1nnc(C[N@@H+]2CCSC[C@H]2C)s1 ZINC000680052862 487528497 /nfs/dbraw/zinc/52/84/97/487528497.db2.gz BDUQMNGCHYMRBA-MRVPVSSYSA-N 1 2 243.401 2.038 20 0 BEADLO CCc1nnc(C[N@H+]2CCSC[C@H]2C)s1 ZINC000680052862 487528500 /nfs/dbraw/zinc/52/85/00/487528500.db2.gz BDUQMNGCHYMRBA-MRVPVSSYSA-N 1 2 243.401 2.038 20 0 BEADLO Cc1n[nH]cc1CNc1c[nH+]ccc1C ZINC000070958351 384143740 /nfs/dbraw/zinc/14/37/40/384143740.db2.gz MWNKXRRPADYVEX-UHFFFAOYSA-N 1 2 202.261 2.034 20 0 BEADLO Cc1cc(NC(=O)N2C[C@@H](C)C[C@@H]2C)cc[nH+]1 ZINC000336587493 384184716 /nfs/dbraw/zinc/18/47/16/384184716.db2.gz DMDDUPVAEPQSNY-ONGXEEELSA-N 1 2 233.315 2.074 20 0 BEADLO CN(CC(C)(C)O)c1cc(C(F)(F)F)cc[nH+]1 ZINC000092969890 384203212 /nfs/dbraw/zinc/20/32/12/384203212.db2.gz JNJDKGWIHABIAX-UHFFFAOYSA-N 1 2 248.248 2.308 20 0 BEADLO c1coc(-c2cc(C[N@@H+]3CCCOCC3)no2)c1 ZINC000336379240 384213521 /nfs/dbraw/zinc/21/35/21/384213521.db2.gz ZQIRNDPLQNIGIQ-UHFFFAOYSA-N 1 2 248.282 2.157 20 0 BEADLO c1coc(-c2cc(C[N@H+]3CCCOCC3)no2)c1 ZINC000336379240 384213524 /nfs/dbraw/zinc/21/35/24/384213524.db2.gz ZQIRNDPLQNIGIQ-UHFFFAOYSA-N 1 2 248.282 2.157 20 0 BEADLO CCc1ccc([C@H](C)[NH2+][C@H](C)C(=O)OC)cc1 ZINC000042304178 384213893 /nfs/dbraw/zinc/21/38/93/384213893.db2.gz PNSZGMKLSPPBTQ-WDEREUQCSA-N 1 2 235.327 2.461 20 0 BEADLO CC[C@@H](C)C[NH2+]c1ccc2c(c1)N(C)C(=O)CO2 ZINC000158258569 384214586 /nfs/dbraw/zinc/21/45/86/384214586.db2.gz JEBWYPRISTVJIW-SNVBAGLBSA-N 1 2 248.326 2.500 20 0 BEADLO C[N@H+](Cc1c(F)cccc1F)[C@@H]1CCOC1 ZINC000132185180 384220025 /nfs/dbraw/zinc/22/00/25/384220025.db2.gz NNZSYSUHRZUVDV-SECBINFHSA-N 1 2 227.254 2.186 20 0 BEADLO C[N@@H+](Cc1c(F)cccc1F)[C@@H]1CCOC1 ZINC000132185180 384220030 /nfs/dbraw/zinc/22/00/30/384220030.db2.gz NNZSYSUHRZUVDV-SECBINFHSA-N 1 2 227.254 2.186 20 0 BEADLO CS[C@@H](C)C(=O)Nc1ccc(C)[nH+]c1C ZINC000119196796 384244400 /nfs/dbraw/zinc/24/44/00/384244400.db2.gz PGYIQZSQLJTYPP-VIFPVBQESA-N 1 2 224.329 2.388 20 0 BEADLO CS[C@H](C)C(=O)Nc1ccc(C)[nH+]c1C ZINC000119196682 384245585 /nfs/dbraw/zinc/24/55/85/384245585.db2.gz PGYIQZSQLJTYPP-SECBINFHSA-N 1 2 224.329 2.388 20 0 BEADLO Cn1ccc(C[N@H+](C)Cc2nccs2)c1 ZINC000093582349 384250462 /nfs/dbraw/zinc/25/04/62/384250462.db2.gz NFMGNSJWJXWTEZ-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO Cn1ccc(C[N@@H+](C)Cc2nccs2)c1 ZINC000093582349 384250466 /nfs/dbraw/zinc/25/04/66/384250466.db2.gz NFMGNSJWJXWTEZ-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO CC(=O)CSCc1cn2cccc(C)c2[nH+]1 ZINC000081273351 384254984 /nfs/dbraw/zinc/25/49/84/384254984.db2.gz FYAYUXISVUPYNP-UHFFFAOYSA-N 1 2 234.324 2.465 20 0 BEADLO CCO[C@@H](C)C(=O)Nc1ccc(C)[nH+]c1C ZINC000119323701 384256669 /nfs/dbraw/zinc/25/66/69/384256669.db2.gz AWAIAPMMZFSNTL-JTQLQIEISA-N 1 2 222.288 2.062 20 0 BEADLO CCO[C@H](C)C(=O)Nc1ccc(C)[nH+]c1C ZINC000119323812 384258747 /nfs/dbraw/zinc/25/87/47/384258747.db2.gz AWAIAPMMZFSNTL-SNVBAGLBSA-N 1 2 222.288 2.062 20 0 BEADLO Cc1cc(C)cc(NC(=O)NCc2[nH]cc[nH+]2)c1 ZINC000119336602 384261085 /nfs/dbraw/zinc/26/10/85/384261085.db2.gz YTYMVJDMJBSCGI-UHFFFAOYSA-N 1 2 244.298 2.348 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCS[C@@H](C(C)C)C1 ZINC000093869368 384277951 /nfs/dbraw/zinc/27/79/51/384277951.db2.gz CFVGVGSWPLJWSC-GFCCVEGCSA-N 1 2 239.388 2.292 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCS[C@@H](C(C)C)C1 ZINC000093869368 384277954 /nfs/dbraw/zinc/27/79/54/384277954.db2.gz CFVGVGSWPLJWSC-GFCCVEGCSA-N 1 2 239.388 2.292 20 0 BEADLO Cc1ccc(NCc2ccc(CO)o2)c(C)[nH+]1 ZINC000094664183 384309363 /nfs/dbraw/zinc/30/93/63/384309363.db2.gz VBDDDNOPNJCSMP-UHFFFAOYSA-N 1 2 232.283 2.396 20 0 BEADLO Cc1ccc(NC(=O)C(F)(F)F)c(C)[nH+]1 ZINC000094667170 384309708 /nfs/dbraw/zinc/30/97/08/384309708.db2.gz PFTMGTVCYZSIJC-UHFFFAOYSA-N 1 2 218.178 2.199 20 0 BEADLO Cc1cnc(C[N@H+]2CCS[C@H](C)[C@@H]2C)o1 ZINC000075748948 384336410 /nfs/dbraw/zinc/33/64/10/384336410.db2.gz JTTHPDBOZDSYHQ-VHSXEESVSA-N 1 2 226.345 2.309 20 0 BEADLO Cc1cnc(C[N@@H+]2CCS[C@H](C)[C@@H]2C)o1 ZINC000075748948 384336418 /nfs/dbraw/zinc/33/64/18/384336418.db2.gz JTTHPDBOZDSYHQ-VHSXEESVSA-N 1 2 226.345 2.309 20 0 BEADLO C[C@@H](C(=O)NC1=[NH+]CCS1)c1ccccc1 ZINC000120205539 384336711 /nfs/dbraw/zinc/33/67/11/384336711.db2.gz SWJIFIMLKBZSOW-SECBINFHSA-N 1 2 234.324 2.009 20 0 BEADLO C[C@H](C(=O)NC1=[NH+]CCS1)c1ccccc1 ZINC000120205374 384337105 /nfs/dbraw/zinc/33/71/05/384337105.db2.gz SWJIFIMLKBZSOW-VIFPVBQESA-N 1 2 234.324 2.009 20 0 BEADLO O=C(C1CCC1)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000120206284 384337346 /nfs/dbraw/zinc/33/73/46/384337346.db2.gz KDUNJEAZYOHQTQ-LLVKDONJSA-N 1 2 233.315 2.263 20 0 BEADLO CS[C@@H](C)C(=O)Nc1cc[nH+]c(C)c1 ZINC000075936837 384346833 /nfs/dbraw/zinc/34/68/33/384346833.db2.gz HALMEBZKXMNBHH-QMMMGPOBSA-N 1 2 210.302 2.080 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnns2)C[C@H](C)C1(F)F ZINC000625652355 384366662 /nfs/dbraw/zinc/36/66/62/384366662.db2.gz IYTGDKRVBXZDSY-OCAPTIKFSA-N 1 2 247.314 2.261 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnns2)C[C@H](C)C1(F)F ZINC000625652355 384366667 /nfs/dbraw/zinc/36/66/67/384366667.db2.gz IYTGDKRVBXZDSY-OCAPTIKFSA-N 1 2 247.314 2.261 20 0 BEADLO C[C@@H](Nc1cccc[nH+]1)[C@@H](O)Cc1ccccc1 ZINC000120645557 384367342 /nfs/dbraw/zinc/36/73/42/384367342.db2.gz GPPLTSRQQCLKMN-OCCSQVGLSA-N 1 2 242.322 2.486 20 0 BEADLO COCC[C@H](C)[NH2+]c1ccc2c(c1)CCO2 ZINC000045023984 384368685 /nfs/dbraw/zinc/36/86/85/384368685.db2.gz TXRMWEYIOPWWQM-JTQLQIEISA-N 1 2 221.300 2.458 20 0 BEADLO FC(F)n1ccc(C[N@@H+]2CC[C@H]2C2CC2)n1 ZINC000449424101 384328307 /nfs/dbraw/zinc/32/83/07/384328307.db2.gz CKOXYGOZVHHWSH-JTQLQIEISA-N 1 2 227.258 2.263 20 0 BEADLO FC(F)n1ccc(C[N@H+]2CC[C@H]2C2CC2)n1 ZINC000449424101 384328312 /nfs/dbraw/zinc/32/83/12/384328312.db2.gz CKOXYGOZVHHWSH-JTQLQIEISA-N 1 2 227.258 2.263 20 0 BEADLO CCc1ccccc1C[NH2+][C@@H](CC)C(=O)OC ZINC000134976943 384404270 /nfs/dbraw/zinc/40/42/70/384404270.db2.gz QITIJKSTXVYJGE-ZDUSSCGKSA-N 1 2 235.327 2.290 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCc2ccccc21)c1ncn(C)n1 ZINC000275649278 384406889 /nfs/dbraw/zinc/40/68/89/384406889.db2.gz DKWDQWCCFQCLMN-ZWNOBZJWSA-N 1 2 242.326 2.153 20 0 BEADLO CC(C)C[C@H]1COCC[N@@H+]1Cc1nccs1 ZINC000135080601 384412349 /nfs/dbraw/zinc/41/23/49/384412349.db2.gz KTTVJPILPHXNSE-NSHDSACASA-N 1 2 240.372 2.390 20 0 BEADLO CC(C)C[C@H]1COCC[N@H+]1Cc1nccs1 ZINC000135080601 384412355 /nfs/dbraw/zinc/41/23/55/384412355.db2.gz KTTVJPILPHXNSE-NSHDSACASA-N 1 2 240.372 2.390 20 0 BEADLO CCOc1ccccc1C[N@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC000363344194 384417481 /nfs/dbraw/zinc/41/74/81/384417481.db2.gz BHQCIWAOWJQDEK-OKILXGFUSA-N 1 2 247.338 2.449 20 0 BEADLO CCOc1ccccc1C[N@@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC000363344194 384417487 /nfs/dbraw/zinc/41/74/87/384417487.db2.gz BHQCIWAOWJQDEK-OKILXGFUSA-N 1 2 247.338 2.449 20 0 BEADLO Cc1ccc(NCc2cncs2)c[nH+]1 ZINC000096033336 384424114 /nfs/dbraw/zinc/42/41/14/384424114.db2.gz ZSRMUUJEHPEQBP-UHFFFAOYSA-N 1 2 205.286 2.459 20 0 BEADLO Cc1cc(N2CCC(C)=C(C)C2)nc[nH+]1 ZINC000336076849 384449966 /nfs/dbraw/zinc/44/99/66/384449966.db2.gz JIBIVPLXECZNHC-UHFFFAOYSA-N 1 2 203.289 2.332 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000292841151 384432301 /nfs/dbraw/zinc/43/23/01/384432301.db2.gz SEAZCFSQTYRXDM-WDEREUQCSA-N 1 2 241.285 2.195 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000292841151 384432308 /nfs/dbraw/zinc/43/23/08/384432308.db2.gz SEAZCFSQTYRXDM-WDEREUQCSA-N 1 2 241.285 2.195 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCCc2c1cnn2C)C(C)(F)F ZINC000335658697 384462894 /nfs/dbraw/zinc/46/28/94/384462894.db2.gz WJXDNRNDFRCIBK-SCZZXKLOSA-N 1 2 243.301 2.431 20 0 BEADLO COc1cc(F)ccc1NCc1c[nH+]cn1C ZINC000078779817 384464452 /nfs/dbraw/zinc/46/44/52/384464452.db2.gz NWDSFWSESPRETH-UHFFFAOYSA-N 1 2 235.262 2.180 20 0 BEADLO C[C@H]([NH2+][C@H]1CCCc2c1cnn2C)C(C)(F)F ZINC000335658699 384464731 /nfs/dbraw/zinc/46/47/31/384464731.db2.gz WJXDNRNDFRCIBK-WPRPVWTQSA-N 1 2 243.301 2.431 20 0 BEADLO COCc1cccc(NCc2c[nH+]cn2C)c1 ZINC000078780006 384465825 /nfs/dbraw/zinc/46/58/25/384465825.db2.gz YTBWJJNRFQASHF-UHFFFAOYSA-N 1 2 231.299 2.179 20 0 BEADLO CC[C@@H]([NH2+]Cc1ncccc1F)c1nccn1C ZINC000530529420 384479130 /nfs/dbraw/zinc/47/91/30/384479130.db2.gz KEUNKCDJJQKRNB-LLVKDONJSA-N 1 2 248.305 2.195 20 0 BEADLO CC[C@@H](NCc1ncccc1F)c1[nH+]ccn1C ZINC000530529420 384479138 /nfs/dbraw/zinc/47/91/38/384479138.db2.gz KEUNKCDJJQKRNB-LLVKDONJSA-N 1 2 248.305 2.195 20 0 BEADLO CC[C@H](NC(=O)CC1CCC1)c1[nH]cc[nH+]1 ZINC000221512841 384486117 /nfs/dbraw/zinc/48/61/17/384486117.db2.gz TWAMEISCIMODDD-JTQLQIEISA-N 1 2 221.304 2.167 20 0 BEADLO CC[C@H]([NH2+]Cc1cc(C)cc(C)c1)C(=O)OC ZINC000083362424 384502303 /nfs/dbraw/zinc/50/23/03/384502303.db2.gz IIWKEIHVFGMVHF-ZDUSSCGKSA-N 1 2 235.327 2.345 20 0 BEADLO Cn1c[nH+]cc1CNc1ccc(F)cc1 ZINC000085167716 384507891 /nfs/dbraw/zinc/50/78/91/384507891.db2.gz JWJAEXUXKMVOLQ-UHFFFAOYSA-N 1 2 205.236 2.171 20 0 BEADLO C[C@H]1C[C@H]1c1ccc(C[NH+]2CCN(C)CC2)o1 ZINC000137072160 384518287 /nfs/dbraw/zinc/51/82/87/384518287.db2.gz GQNGWWJECPJDLP-WCQYABFASA-N 1 2 234.343 2.150 20 0 BEADLO Cc1cc(N2CC[C@@H](O)[C@@H](C)C2)nc(C(C)C)[nH+]1 ZINC000229432032 384523266 /nfs/dbraw/zinc/52/32/66/384523266.db2.gz BMGACAWZFPIHOB-CMPLNLGQSA-N 1 2 249.358 2.116 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)o1 ZINC000097491847 384528867 /nfs/dbraw/zinc/52/88/67/384528867.db2.gz GTEFDZDPUQREIQ-NSHDSACASA-N 1 2 232.287 2.043 20 0 BEADLO Cc1nnc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)o1 ZINC000097491847 384528874 /nfs/dbraw/zinc/52/88/74/384528874.db2.gz GTEFDZDPUQREIQ-NSHDSACASA-N 1 2 232.287 2.043 20 0 BEADLO Cc1cnc(C(C)(C)[NH2+]Cc2cc[nH]n2)s1 ZINC000080346112 384545507 /nfs/dbraw/zinc/54/55/07/384545507.db2.gz IALUOKMQBQWORF-UHFFFAOYSA-N 1 2 236.344 2.200 20 0 BEADLO Cc1nnc([C@H](C)[NH+]2CCC(C(F)F)CC2)o1 ZINC000334833432 384572134 /nfs/dbraw/zinc/57/21/34/384572134.db2.gz NORDUNZFIWVUPL-ZETCQYMHSA-N 1 2 245.273 2.416 20 0 BEADLO Cc1nc(NCCCC2CCCC2)nc(N)[nH+]1 ZINC000306112994 384573496 /nfs/dbraw/zinc/57/34/96/384573496.db2.gz VBINVKHAEKIGCK-UHFFFAOYSA-N 1 2 235.335 2.145 20 0 BEADLO Cc1nc(N)nc(NCCCC2CCCC2)[nH+]1 ZINC000306112994 384573501 /nfs/dbraw/zinc/57/35/01/384573501.db2.gz VBINVKHAEKIGCK-UHFFFAOYSA-N 1 2 235.335 2.145 20 0 BEADLO Cc1cnc(C[NH2+][C@H](CO)c2ccccc2)s1 ZINC000183772906 384582206 /nfs/dbraw/zinc/58/22/06/384582206.db2.gz QVDVJSIPGWZWET-GFCCVEGCSA-N 1 2 248.351 2.275 20 0 BEADLO COc1cc(C[N@H+](C)Cc2ccon2)ccc1O ZINC000080847913 384586979 /nfs/dbraw/zinc/58/69/79/384586979.db2.gz SXUGVCDNSZQSTR-UHFFFAOYSA-N 1 2 248.282 2.021 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2ccon2)ccc1O ZINC000080847913 384586985 /nfs/dbraw/zinc/58/69/85/384586985.db2.gz SXUGVCDNSZQSTR-UHFFFAOYSA-N 1 2 248.282 2.021 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@H](c1ccccc1)C1CC1 ZINC000041075548 384607168 /nfs/dbraw/zinc/60/71/68/384607168.db2.gz GGMDXINXOTWOCY-GXFFZTMASA-N 1 2 233.311 2.289 20 0 BEADLO C[C@@H]([NH2+]Cc1ccc(F)cn1)c1ccon1 ZINC000309784924 384608678 /nfs/dbraw/zinc/60/86/78/384608678.db2.gz NVANAPLZWQXRLA-MRVPVSSYSA-N 1 2 221.235 2.060 20 0 BEADLO Cc1nc(N2CCc3cccc(F)c3C2)cc[nH+]1 ZINC000162402303 384615896 /nfs/dbraw/zinc/61/58/96/384615896.db2.gz QLQZDUOFLYNKOV-UHFFFAOYSA-N 1 2 243.285 2.487 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccc(O)c2)no1 ZINC000080921445 384591470 /nfs/dbraw/zinc/59/14/70/384591470.db2.gz APAZBTPSNFCWAI-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccc(O)c2)no1 ZINC000080921445 384591479 /nfs/dbraw/zinc/59/14/79/384591479.db2.gz APAZBTPSNFCWAI-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO Cc1c[nH+]c(C)nc1N1C[C@@H]2CCC[C@@H]21 ZINC000517960325 384594205 /nfs/dbraw/zinc/59/42/05/384594205.db2.gz HJHHQPRKIPJKRT-QWRGUYRKSA-N 1 2 203.289 2.082 20 0 BEADLO C[C@@H]1C[C@H]([NH2+][C@H](C2CC2)C(F)(F)F)CCO1 ZINC000309805483 384634163 /nfs/dbraw/zinc/63/41/63/384634163.db2.gz SAUQQNCHNUGGTE-SZEHBUNVSA-N 1 2 237.265 2.484 20 0 BEADLO CCC[C@@H]1C[N@@H+]([C@@H](C)c2cnccn2)CCO1 ZINC000184694900 384636051 /nfs/dbraw/zinc/63/60/51/384636051.db2.gz KSVKCJSJRXCDBG-NWDGAFQWSA-N 1 2 235.331 2.039 20 0 BEADLO CCC[C@@H]1C[N@H+]([C@@H](C)c2cnccn2)CCO1 ZINC000184694900 384636060 /nfs/dbraw/zinc/63/60/60/384636060.db2.gz KSVKCJSJRXCDBG-NWDGAFQWSA-N 1 2 235.331 2.039 20 0 BEADLO C[C@@H]([NH2+]CC(F)(F)CO)c1cccc(F)c1 ZINC000184690442 384637539 /nfs/dbraw/zinc/63/75/39/384637539.db2.gz OFGAILZYNGVPMG-MRVPVSSYSA-N 1 2 233.233 2.104 20 0 BEADLO Cc1ccc2c(c1)[C@H]([NH2+]CC(F)(F)CO)CC2 ZINC000184713138 384640866 /nfs/dbraw/zinc/64/08/66/384640866.db2.gz BHPVGRCCCXWWQM-GFCCVEGCSA-N 1 2 241.281 2.200 20 0 BEADLO Cn1c[nH+]cc1CNc1nccc(C(C)(C)C)n1 ZINC000293130946 384642389 /nfs/dbraw/zinc/64/23/89/384642389.db2.gz RSQBAGVIMVZOAA-UHFFFAOYSA-N 1 2 245.330 2.120 20 0 BEADLO C[C@@H]1COCC[C@@H]1[NH2+][C@H](C1CC1)C(F)(F)F ZINC000309822855 384643251 /nfs/dbraw/zinc/64/32/51/384643251.db2.gz WRUOAWDFUVYGAO-FKTZTGRPSA-N 1 2 237.265 2.342 20 0 BEADLO O=C(c1ccco1)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000082277788 384659767 /nfs/dbraw/zinc/65/97/67/384659767.db2.gz OPXONYXSULIVMC-JTQLQIEISA-N 1 2 245.282 2.370 20 0 BEADLO CC(C)CC(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000082277312 384660661 /nfs/dbraw/zinc/66/06/61/384660661.db2.gz LPIVAMZBROCRLQ-UHFFFAOYSA-N 1 2 235.331 2.093 20 0 BEADLO C[C@@H]1CN(c2cc[nH+]c(C3CC3)n2)[C@@H](C)[C@H](C)O1 ZINC000445677472 384699387 /nfs/dbraw/zinc/69/93/87/384699387.db2.gz XLBCBGRXFNILOS-VWYCJHECSA-N 1 2 247.342 2.356 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+]Cc2ccn(C)n2)s1 ZINC000125181990 384701027 /nfs/dbraw/zinc/70/10/27/384701027.db2.gz LGTJULXDLWTQAY-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO CC[C@H]1CC[C@H](NC(=O)Cc2c[nH+]cn2C)CC1 ZINC000554492174 384708418 /nfs/dbraw/zinc/70/84/18/384708418.db2.gz ACLJVUPNBXJBIY-HAQNSBGRSA-N 1 2 249.358 2.048 20 0 BEADLO C[C@H](O)CNc1[nH+]ccc2ccc(F)cc21 ZINC000309919973 384715846 /nfs/dbraw/zinc/71/58/46/384715846.db2.gz RKNBGLIWPYGOBQ-QMMMGPOBSA-N 1 2 220.247 2.167 20 0 BEADLO CCS[C@@H]1CCC[C@H]1[NH2+]Cc1noc(C)n1 ZINC000300380090 384732822 /nfs/dbraw/zinc/73/28/22/384732822.db2.gz CRZIVBQCEUVDCM-NXEZZACHSA-N 1 2 241.360 2.142 20 0 BEADLO Fc1ccc(F)c2c1CC[N@@H+]([C@@H]1CCOC1)C2 ZINC000271339560 384733841 /nfs/dbraw/zinc/73/38/41/384733841.db2.gz JKGKAJSXEHVSNX-SECBINFHSA-N 1 2 239.265 2.112 20 0 BEADLO Fc1ccc(F)c2c1CC[N@H+]([C@@H]1CCOC1)C2 ZINC000271339560 384733843 /nfs/dbraw/zinc/73/38/43/384733843.db2.gz JKGKAJSXEHVSNX-SECBINFHSA-N 1 2 239.265 2.112 20 0 BEADLO C[C@@H]1OCC[C@@H]1SCCCn1cc[nH+]c1 ZINC000185635267 384751213 /nfs/dbraw/zinc/75/12/13/384751213.db2.gz NOFSLMDLGNYFAU-QWRGUYRKSA-N 1 2 226.345 2.184 20 0 BEADLO CC(C)=CCCNc1nc[nH+]c(N)c1Cl ZINC000277710132 384815620 /nfs/dbraw/zinc/81/56/20/384815620.db2.gz HBANYRBQCGYOCB-UHFFFAOYSA-N 1 2 226.711 2.480 20 0 BEADLO CC(C)=CCCNc1[nH+]cnc(N)c1Cl ZINC000277710132 384815629 /nfs/dbraw/zinc/81/56/29/384815629.db2.gz HBANYRBQCGYOCB-UHFFFAOYSA-N 1 2 226.711 2.480 20 0 BEADLO CCc1cc(N)nc(SCCCCOC)[nH+]1 ZINC000279110602 384828343 /nfs/dbraw/zinc/82/83/43/384828343.db2.gz RMKNFEWVHWYZOH-UHFFFAOYSA-N 1 2 241.360 2.140 20 0 BEADLO CCC[C@@H](CC)NC(=O)[C@H]1CCn2c[nH+]cc2C1 ZINC000151804370 384797105 /nfs/dbraw/zinc/79/71/05/384797105.db2.gz VYKKRKZHJDXQJC-NWDGAFQWSA-N 1 2 249.358 2.140 20 0 BEADLO CC[N@H+](CCCNC(=O)C1CC1)c1ccccc1 ZINC000053639433 384799549 /nfs/dbraw/zinc/79/95/49/384799549.db2.gz YUFAOMDPDCRELS-UHFFFAOYSA-N 1 2 246.354 2.429 20 0 BEADLO CC[N@@H+](CCCNC(=O)C1CC1)c1ccccc1 ZINC000053639433 384799559 /nfs/dbraw/zinc/79/95/59/384799559.db2.gz YUFAOMDPDCRELS-UHFFFAOYSA-N 1 2 246.354 2.429 20 0 BEADLO C[N@H+](CCc1ccccc1)Cc1csnn1 ZINC000126464050 384802878 /nfs/dbraw/zinc/80/28/78/384802878.db2.gz CIHXDWCZXAUCFV-UHFFFAOYSA-N 1 2 233.340 2.213 20 0 BEADLO C[N@@H+](CCc1ccccc1)Cc1csnn1 ZINC000126464050 384802885 /nfs/dbraw/zinc/80/28/85/384802885.db2.gz CIHXDWCZXAUCFV-UHFFFAOYSA-N 1 2 233.340 2.213 20 0 BEADLO Fc1ccc(CC2C[NH+](Cc3ccon3)C2)cc1 ZINC000371182679 384810161 /nfs/dbraw/zinc/81/01/61/384810161.db2.gz FLHCWFWMWADYIM-UHFFFAOYSA-N 1 2 246.285 2.488 20 0 BEADLO O=C1OCC[C@@]12CCC[N@H+]2Cc1ccccc1F ZINC000186716377 384872244 /nfs/dbraw/zinc/87/22/44/384872244.db2.gz DQRCQTVEHLGLOJ-AWEZNQCLSA-N 1 2 249.285 2.107 20 0 BEADLO O=C1OCC[C@@]12CCC[N@@H+]2Cc1ccccc1F ZINC000186716377 384872252 /nfs/dbraw/zinc/87/22/52/384872252.db2.gz DQRCQTVEHLGLOJ-AWEZNQCLSA-N 1 2 249.285 2.107 20 0 BEADLO C[C@H]1COCC[N@@H+]1CCc1ccc(F)c(F)c1 ZINC000151924793 384875155 /nfs/dbraw/zinc/87/51/55/384875155.db2.gz WARYUZJLVHQRAS-JTQLQIEISA-N 1 2 241.281 2.228 20 0 BEADLO C[C@H]1COCC[N@H+]1CCc1ccc(F)c(F)c1 ZINC000151924793 384875160 /nfs/dbraw/zinc/87/51/60/384875160.db2.gz WARYUZJLVHQRAS-JTQLQIEISA-N 1 2 241.281 2.228 20 0 BEADLO CO[C@@H]1CCCC[C@H]1Nc1cc(C)[nH+]cn1 ZINC000301475220 384875544 /nfs/dbraw/zinc/87/55/44/384875544.db2.gz VVUUSXKNXXGTOV-GHMZBOCLSA-N 1 2 221.304 2.155 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)C1CCCCCC1 ZINC000101852455 384884352 /nfs/dbraw/zinc/88/43/52/384884352.db2.gz WBXIJIXBIAEGJW-UHFFFAOYSA-N 1 2 249.358 2.349 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1CC12CC2 ZINC000335510510 384885479 /nfs/dbraw/zinc/88/54/79/384885479.db2.gz FUAQHCPGGGFCMX-JTQLQIEISA-N 1 2 216.284 2.437 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ccncc1)c1csnn1 ZINC000398286494 384885869 /nfs/dbraw/zinc/88/58/69/384885869.db2.gz NMBGTUOLOJLHGI-RKDXNWHRSA-N 1 2 234.328 2.345 20 0 BEADLO COCC(C)(C)C[N@@H+]1CCC(F)(F)C1 ZINC000426364656 384844645 /nfs/dbraw/zinc/84/46/45/384844645.db2.gz ZWLWZYTYGKKXAI-UHFFFAOYSA-N 1 2 207.264 2.000 20 0 BEADLO COCC(C)(C)C[N@H+]1CCC(F)(F)C1 ZINC000426364656 384844650 /nfs/dbraw/zinc/84/46/50/384844650.db2.gz ZWLWZYTYGKKXAI-UHFFFAOYSA-N 1 2 207.264 2.000 20 0 BEADLO Cc1c[nH+]cc(NCc2ccn(C)c2)c1 ZINC000127292005 384847412 /nfs/dbraw/zinc/84/74/12/384847412.db2.gz MCVHDKCFRKLQIF-UHFFFAOYSA-N 1 2 201.273 2.341 20 0 BEADLO COCc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)o1 ZINC000126967595 384849703 /nfs/dbraw/zinc/84/97/03/384849703.db2.gz ZGWGPJCCLIINCT-GHMZBOCLSA-N 1 2 239.315 2.035 20 0 BEADLO C[N@H+](CCOCC1CC1)Cc1nccs1 ZINC000175100356 384868203 /nfs/dbraw/zinc/86/82/03/384868203.db2.gz AJDXYHWPUQSPPC-UHFFFAOYSA-N 1 2 226.345 2.002 20 0 BEADLO C[N@@H+](CCOCC1CC1)Cc1nccs1 ZINC000175100356 384868210 /nfs/dbraw/zinc/86/82/10/384868210.db2.gz AJDXYHWPUQSPPC-UHFFFAOYSA-N 1 2 226.345 2.002 20 0 BEADLO CC(C)CCOCC[NH2+][C@@H](C)c1csnn1 ZINC000398259417 384868864 /nfs/dbraw/zinc/86/88/64/384868864.db2.gz AXAKBWJNUIEOOP-JTQLQIEISA-N 1 2 243.376 2.251 20 0 BEADLO CC(C)CCOCC[NH2+][C@H](C)c1csnn1 ZINC000398259418 384869564 /nfs/dbraw/zinc/86/95/64/384869564.db2.gz AXAKBWJNUIEOOP-SNVBAGLBSA-N 1 2 243.376 2.251 20 0 BEADLO COC(=O)[C@H](C)[N@@H+]1CCc2c(C)cc(C)cc2C1 ZINC000186708732 384869707 /nfs/dbraw/zinc/86/97/07/384869707.db2.gz OXYWFOWQVBKODK-LBPRGKRZSA-N 1 2 247.338 2.223 20 0 BEADLO COC(=O)[C@H](C)[N@H+]1CCc2c(C)cc(C)cc2C1 ZINC000186708732 384869713 /nfs/dbraw/zinc/86/97/13/384869713.db2.gz OXYWFOWQVBKODK-LBPRGKRZSA-N 1 2 247.338 2.223 20 0 BEADLO CC[C@H](CO)Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000085486154 384953795 /nfs/dbraw/zinc/95/37/95/384953795.db2.gz KXDUICMXVFMDAA-MRVPVSSYSA-N 1 2 234.221 2.283 20 0 BEADLO C[C@H]1c2cccn2CC[N@H+]1Cc1cccn1C ZINC000175326153 384892728 /nfs/dbraw/zinc/89/27/28/384892728.db2.gz WHUKXHAKNJGWLA-LBPRGKRZSA-N 1 2 229.327 2.403 20 0 BEADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1cccn1C ZINC000175326153 384892735 /nfs/dbraw/zinc/89/27/35/384892735.db2.gz WHUKXHAKNJGWLA-LBPRGKRZSA-N 1 2 229.327 2.403 20 0 BEADLO CC(C)(C)/C=C\C(=O)NCCCCn1cc[nH+]c1 ZINC000491837662 384896443 /nfs/dbraw/zinc/89/64/43/384896443.db2.gz ILSFCWFRKAQHSO-SREVYHEPSA-N 1 2 249.358 2.382 20 0 BEADLO O=C(CCCC1CC1)NCCNc1cccc[nH+]1 ZINC000643140364 384905147 /nfs/dbraw/zinc/90/51/47/384905147.db2.gz ITWICNZUABNRNE-UHFFFAOYSA-N 1 2 247.342 2.190 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635765686 384906100 /nfs/dbraw/zinc/90/61/00/384906100.db2.gz SOQMPKJYCLLFQP-IRCOFANPSA-N 1 2 247.342 2.303 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635765686 384906109 /nfs/dbraw/zinc/90/61/09/384906109.db2.gz SOQMPKJYCLLFQP-IRCOFANPSA-N 1 2 247.342 2.303 20 0 BEADLO C[C@H](CF)[NH2+]Cc1csc(C2CC2)n1 ZINC000308667750 384908836 /nfs/dbraw/zinc/90/88/36/384908836.db2.gz UAKRBZKEVSOLBW-SSDOTTSWSA-N 1 2 214.309 2.468 20 0 BEADLO CCC(CC)n1ccc(Cn2cc[nH+]c2)n1 ZINC000085192908 384924872 /nfs/dbraw/zinc/92/48/72/384924872.db2.gz QFZNXKRASDDQIW-UHFFFAOYSA-N 1 2 218.304 2.489 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1C[C@H]1CC(C)C ZINC000448934297 384931207 /nfs/dbraw/zinc/93/12/07/384931207.db2.gz UYCJBOUUXLALPV-VXGBXAGGSA-N 1 2 232.327 2.433 20 0 BEADLO COC(=O)[C@H](c1cccnc1)[N@@H+]1CCC[C@@H](C)C1 ZINC000127685457 384934500 /nfs/dbraw/zinc/93/45/00/384934500.db2.gz KOYMGDWDHNZTHE-YPMHNXCESA-N 1 2 248.326 2.028 20 0 BEADLO COC(=O)[C@H](c1cccnc1)[N@H+]1CCC[C@@H](C)C1 ZINC000127685457 384934505 /nfs/dbraw/zinc/93/45/05/384934505.db2.gz KOYMGDWDHNZTHE-YPMHNXCESA-N 1 2 248.326 2.028 20 0 BEADLO CCCc1nc(C[N@H+](C)[C@@H]2CCOC2)cs1 ZINC000106936989 384944442 /nfs/dbraw/zinc/94/44/42/384944442.db2.gz GSKGTSOHGVERCE-LLVKDONJSA-N 1 2 240.372 2.316 20 0 BEADLO CCCc1nc(C[N@@H+](C)[C@@H]2CCOC2)cs1 ZINC000106936989 384944445 /nfs/dbraw/zinc/94/44/45/384944445.db2.gz GSKGTSOHGVERCE-LLVKDONJSA-N 1 2 240.372 2.316 20 0 BEADLO O=C(c1ccc2[nH+]ccn2c1)N1CCCCCC1 ZINC000057825178 384966843 /nfs/dbraw/zinc/96/68/43/384966843.db2.gz SVDHCNHMIPDIOQ-UHFFFAOYSA-N 1 2 243.310 2.351 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C1=COCCC1 ZINC000107598795 384987479 /nfs/dbraw/zinc/98/74/79/384987479.db2.gz CIBNMWNKLYCOGS-UHFFFAOYSA-N 1 2 218.256 2.023 20 0 BEADLO CO[C@H](C)CNc1cc[nH+]c(C(C)C)n1 ZINC000302613804 385001742 /nfs/dbraw/zinc/00/17/42/385001742.db2.gz CAHIIGHHKWYQKW-SECBINFHSA-N 1 2 209.293 2.047 20 0 BEADLO CO[C@@H](C)CNc1cc[nH+]c(C(C)C)n1 ZINC000302613806 385003525 /nfs/dbraw/zinc/00/35/25/385003525.db2.gz CAHIIGHHKWYQKW-VIFPVBQESA-N 1 2 209.293 2.047 20 0 BEADLO Cc1cc(C[NH2+]Cc2cc(C)ns2)on1 ZINC000404459863 385003780 /nfs/dbraw/zinc/00/37/80/385003780.db2.gz NEWGDUWUJZHKPZ-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO CCN(C)C(=O)Nc1ccc(C)[nH+]c1C ZINC000130114076 385023386 /nfs/dbraw/zinc/02/33/86/385023386.db2.gz ZZJMARSZJMJWGO-UHFFFAOYSA-N 1 2 207.277 2.182 20 0 BEADLO CC[C@H]1CCN(C(=O)C[C@H](C)n2cc[nH+]c2)C1 ZINC000564662394 384963310 /nfs/dbraw/zinc/96/33/10/384963310.db2.gz YTBMSQZYDKWLKF-RYUDHWBXSA-N 1 2 235.331 2.093 20 0 BEADLO CO[C@H](C)CCNc1cc(C)[nH+]c(C(C)C)n1 ZINC000336653784 385051224 /nfs/dbraw/zinc/05/12/24/385051224.db2.gz GMTXUPRZMKHIND-LLVKDONJSA-N 1 2 237.347 2.167 20 0 BEADLO Cc1noc(C[N@@H+]2CCC[C@@H]2c2ccccn2)n1 ZINC000530724148 385024449 /nfs/dbraw/zinc/02/44/49/385024449.db2.gz WZIQKCZIEAGSPH-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1noc(C[N@H+]2CCC[C@@H]2c2ccccn2)n1 ZINC000530724148 385024458 /nfs/dbraw/zinc/02/44/58/385024458.db2.gz WZIQKCZIEAGSPH-GFCCVEGCSA-N 1 2 244.298 2.110 20 0 BEADLO C/C=C(\CC)C(=O)NCc1ccn2cc[nH+]c2c1 ZINC000188258106 385032442 /nfs/dbraw/zinc/03/24/42/385032442.db2.gz PXIDSLSJGVKIAW-KGVSQERTSA-N 1 2 243.310 2.307 20 0 BEADLO Cc1cc(C(=O)Nc2ccc(C)[nH+]c2C)no1 ZINC000176190856 385037530 /nfs/dbraw/zinc/03/75/30/385037530.db2.gz CZCLFTTXUCEQIM-UHFFFAOYSA-N 1 2 231.255 2.247 20 0 BEADLO Cc1cc(NC[C@@H]2C[C@H]2C2CC2)nc[nH+]1 ZINC000309142348 385109293 /nfs/dbraw/zinc/10/92/93/385109293.db2.gz HNXMTZXXMPABOS-QWRGUYRKSA-N 1 2 203.289 2.243 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCCCO1 ZINC000287631357 385111980 /nfs/dbraw/zinc/11/19/80/385111980.db2.gz UYSADMRKPKKMNE-UHFFFAOYSA-N 1 2 235.287 2.258 20 0 BEADLO CC[C@H](O)C[NH2+]c1cc(C)c(O)c(C)c1 ZINC000644699850 385114003 /nfs/dbraw/zinc/11/40/03/385114003.db2.gz WAASQNHQZLVSKW-NSHDSACASA-N 1 2 209.289 2.192 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+]Cc2[nH]ncc2C)s1 ZINC000289669873 385141798 /nfs/dbraw/zinc/14/17/98/385141798.db2.gz ZMTGIQXFJZUVPW-SECBINFHSA-N 1 2 236.344 2.334 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+]Cc2n[nH]cc2C)s1 ZINC000289669873 385141804 /nfs/dbraw/zinc/14/18/04/385141804.db2.gz ZMTGIQXFJZUVPW-SECBINFHSA-N 1 2 236.344 2.334 20 0 BEADLO CSCCCCC(=O)Nc1ccc(N)[nH+]c1 ZINC000151621327 385119825 /nfs/dbraw/zinc/11/98/25/385119825.db2.gz QUSFNCFVWYUDLH-UHFFFAOYSA-N 1 2 239.344 2.136 20 0 BEADLO Cc1ccc([S@](=O)Cc2[nH+]ccn2C)c(C)c1 ZINC000129244419 385125465 /nfs/dbraw/zinc/12/54/65/385125465.db2.gz ZSEGJAFLPBUYLQ-KRWDZBQOSA-N 1 2 248.351 2.345 20 0 BEADLO Cc1ccc(C)c([S@](=O)Cc2[nH+]ccn2C)c1 ZINC000129243524 385126419 /nfs/dbraw/zinc/12/64/19/385126419.db2.gz MBXOFTWGRYCATB-KRWDZBQOSA-N 1 2 248.351 2.345 20 0 BEADLO CC(C)[N@H+](Cc1noc(C2CC2)n1)C1CC1 ZINC000064931834 385128694 /nfs/dbraw/zinc/12/86/94/385128694.db2.gz KUNPQQNILJTTGE-UHFFFAOYSA-N 1 2 221.304 2.320 20 0 BEADLO CC(C)[N@@H+](Cc1noc(C2CC2)n1)C1CC1 ZINC000064931834 385128698 /nfs/dbraw/zinc/12/86/98/385128698.db2.gz KUNPQQNILJTTGE-UHFFFAOYSA-N 1 2 221.304 2.320 20 0 BEADLO Cc1cc(C[NH+]2CC3(C2)CC(F)(F)C3)ncn1 ZINC000644679963 385093901 /nfs/dbraw/zinc/09/39/01/385093901.db2.gz DWPLWKUSARNWIJ-UHFFFAOYSA-N 1 2 239.269 2.016 20 0 BEADLO Cc1nc(C[NH2+][C@@H](CO)c2ccccc2)cs1 ZINC000062999755 385202449 /nfs/dbraw/zinc/20/24/49/385202449.db2.gz QNROREVIKDJULC-ZDUSSCGKSA-N 1 2 248.351 2.275 20 0 BEADLO C[C@@H]1CCN(C(=O)c2ccc3[nH+]ccn3c2)[C@H]1C ZINC000177060819 385175469 /nfs/dbraw/zinc/17/54/69/385175469.db2.gz HDDCZHLKQLBOIU-MNOVXSKESA-N 1 2 243.310 2.205 20 0 BEADLO Cn1c[nH+]cc1CNc1ccc2c(c1)CCCO2 ZINC000178219363 385213328 /nfs/dbraw/zinc/21/33/28/385213328.db2.gz AHAUGYHFFYUKTR-UHFFFAOYSA-N 1 2 243.310 2.357 20 0 BEADLO C=C/C(C)=C/CC(=O)NCc1c[nH+]ccc1OC ZINC000647068887 385214866 /nfs/dbraw/zinc/21/48/66/385214866.db2.gz DHPXVLMMOYTNFT-VZUCSPMQSA-N 1 2 246.310 2.229 20 0 BEADLO Cc1ccc([C@H](C)[N@H+](C)Cc2ncnn2C)cc1 ZINC000157695156 385244803 /nfs/dbraw/zinc/24/48/03/385244803.db2.gz ZHTJMGKQKBOPEA-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2ncnn2C)cc1 ZINC000157695156 385244810 /nfs/dbraw/zinc/24/48/10/385244810.db2.gz ZHTJMGKQKBOPEA-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO C[C@H](c1ccccc1)[C@H](C)[NH2+][C@@H]1CCOC1=O ZINC000177482611 385249781 /nfs/dbraw/zinc/24/97/81/385249781.db2.gz BLBCZHDKRBIHSU-GMXVVIOVSA-N 1 2 233.311 2.084 20 0 BEADLO CCC1CC[NH+](Cc2csnn2)CC1 ZINC000335866455 385304508 /nfs/dbraw/zinc/30/45/08/385304508.db2.gz POLXBKJRDJZPRB-UHFFFAOYSA-N 1 2 211.334 2.160 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@]1(C)C[C@H]2CC[C@@H]1O2 ZINC000191457458 385305575 /nfs/dbraw/zinc/30/55/75/385305575.db2.gz VQMPEVBWTNHSDL-SCDSUCTJSA-N 1 2 246.310 2.286 20 0 BEADLO CN(CCn1cc[nH+]c1)c1ccccc1 ZINC000154315939 385316895 /nfs/dbraw/zinc/31/68/95/385316895.db2.gz HKELQEVYSISTJW-UHFFFAOYSA-N 1 2 201.273 2.020 20 0 BEADLO COC(=O)c1occc1C[NH2+]Cc1occc1C ZINC000311106115 385321293 /nfs/dbraw/zinc/32/12/93/385321293.db2.gz LKCKKPXOZHONPJ-UHFFFAOYSA-N 1 2 249.266 2.257 20 0 BEADLO COC[C@H](C)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000153530019 385261862 /nfs/dbraw/zinc/26/18/62/385261862.db2.gz LQMBBWZZXMPGFY-JTQLQIEISA-N 1 2 249.289 2.458 20 0 BEADLO COC[C@@H]([NH2+]Cc1ccno1)c1ccccc1 ZINC000223718556 385267394 /nfs/dbraw/zinc/26/73/94/385267394.db2.gz CCMLNSPNYYQDSO-CYBMUJFWSA-N 1 2 232.283 2.152 20 0 BEADLO Cc1cc(C[N@H+](C)C[C@H]2CCC=CO2)no1 ZINC000191066521 385280554 /nfs/dbraw/zinc/28/05/54/385280554.db2.gz VFMXKHVNSRVRCB-GFCCVEGCSA-N 1 2 222.288 2.108 20 0 BEADLO Cc1cc(C[N@@H+](C)C[C@H]2CCC=CO2)no1 ZINC000191066521 385280556 /nfs/dbraw/zinc/28/05/56/385280556.db2.gz VFMXKHVNSRVRCB-GFCCVEGCSA-N 1 2 222.288 2.108 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2cocn2)cc1 ZINC000191920402 385334354 /nfs/dbraw/zinc/33/43/54/385334354.db2.gz XVCSEYVKEDLTGD-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2cocn2)cc1 ZINC000191920402 385334360 /nfs/dbraw/zinc/33/43/60/385334360.db2.gz XVCSEYVKEDLTGD-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO C[N@H+](Cc1cocn1)Cc1cccc(F)c1 ZINC000191920625 385334883 /nfs/dbraw/zinc/33/48/83/385334883.db2.gz YKMUTHBGZWJFSS-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO C[N@@H+](Cc1cocn1)Cc1cccc(F)c1 ZINC000191920625 385334887 /nfs/dbraw/zinc/33/48/87/385334887.db2.gz YKMUTHBGZWJFSS-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO c1cc2c(s1)CC[N@@H+](Cc1cocn1)C2 ZINC000191924625 385335166 /nfs/dbraw/zinc/33/51/66/385335166.db2.gz LSJNMZQFKXTMHB-UHFFFAOYSA-N 1 2 220.297 2.294 20 0 BEADLO c1cc2c(s1)CC[N@H+](Cc1cocn1)C2 ZINC000191924625 385335170 /nfs/dbraw/zinc/33/51/70/385335170.db2.gz LSJNMZQFKXTMHB-UHFFFAOYSA-N 1 2 220.297 2.294 20 0 BEADLO CC(C)[C@H]1C[N@H+](Cc2cocn2)CCS1 ZINC000191949276 385337319 /nfs/dbraw/zinc/33/73/19/385337319.db2.gz MUVCQJLDBCHMKX-LLVKDONJSA-N 1 2 226.345 2.248 20 0 BEADLO CC(C)[C@H]1C[N@@H+](Cc2cocn2)CCS1 ZINC000191949276 385337324 /nfs/dbraw/zinc/33/73/24/385337324.db2.gz MUVCQJLDBCHMKX-LLVKDONJSA-N 1 2 226.345 2.248 20 0 BEADLO CCC[C@H](C(=O)NCc1[nH]cc[nH+]1)C(C)C ZINC000155452887 385391313 /nfs/dbraw/zinc/39/13/13/385391313.db2.gz KBVOFABXSDZDIR-JTQLQIEISA-N 1 2 223.320 2.098 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)c1cccs1 ZINC000154965656 385366501 /nfs/dbraw/zinc/36/65/01/385366501.db2.gz MDCMHIGMQDVCKA-UHFFFAOYSA-N 1 2 249.339 2.107 20 0 BEADLO CCc1ccc(C[NH2+][C@@H](CC)C(=O)OC)s1 ZINC000192833983 385372716 /nfs/dbraw/zinc/37/27/16/385372716.db2.gz OAPOFUPKLWLWKE-NSHDSACASA-N 1 2 241.356 2.352 20 0 BEADLO C[C@H]1CCC[C@@H](C[N@H+](CCO)CC(F)F)C1 ZINC000193026737 385381345 /nfs/dbraw/zinc/38/13/45/385381345.db2.gz BAGXLTMXBNVGAC-WDEREUQCSA-N 1 2 235.318 2.372 20 0 BEADLO C[C@H]1CCC[C@@H](C[N@@H+](CCO)CC(F)F)C1 ZINC000193026737 385381349 /nfs/dbraw/zinc/38/13/49/385381349.db2.gz BAGXLTMXBNVGAC-WDEREUQCSA-N 1 2 235.318 2.372 20 0 BEADLO COC(=O)[C@@H](C)[NH2+]C[C@H](C)Cc1ccccc1 ZINC000193097601 385385009 /nfs/dbraw/zinc/38/50/09/385385009.db2.gz JTGKLOBVCAOXSS-VXGBXAGGSA-N 1 2 235.327 2.016 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H](C)CCc1ccc(C)cc1 ZINC000193098946 385385931 /nfs/dbraw/zinc/38/59/31/385385931.db2.gz RSVGOMYAHFLMFY-QWHCGFSZSA-N 1 2 249.354 2.467 20 0 BEADLO Cc1ccc(C[NH+]2CCOCC2)cc1Cl ZINC000193575443 385402009 /nfs/dbraw/zinc/40/20/09/385402009.db2.gz NHMZEOBGVYIXJV-UHFFFAOYSA-N 1 2 225.719 2.481 20 0 BEADLO C[N@@H+](Cc1cscn1)C[C@H]1CCC=CO1 ZINC000193803549 385413054 /nfs/dbraw/zinc/41/30/54/385413054.db2.gz SJEMXIXAEVIQSJ-LLVKDONJSA-N 1 2 224.329 2.268 20 0 BEADLO C[N@H+](Cc1cscn1)C[C@H]1CCC=CO1 ZINC000193803549 385413055 /nfs/dbraw/zinc/41/30/55/385413055.db2.gz SJEMXIXAEVIQSJ-LLVKDONJSA-N 1 2 224.329 2.268 20 0 BEADLO C[C@@H]1OCCN(c2[nH+]c3ccccc3n2C)[C@H]1C ZINC000179317369 385458438 /nfs/dbraw/zinc/45/84/38/385458438.db2.gz JAXXBSPLXPIBJM-QWRGUYRKSA-N 1 2 245.326 2.187 20 0 BEADLO CCN(C(=O)c1ccc2[nH+]ccn2c1)C(C)C ZINC000170871325 385453371 /nfs/dbraw/zinc/45/33/71/385453371.db2.gz IYDIYAIKZIHATR-UHFFFAOYSA-N 1 2 231.299 2.205 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1cc(C2CC2)[nH]n1 ZINC000170955912 385457514 /nfs/dbraw/zinc/45/75/14/385457514.db2.gz JWQNMNBDLUFKHV-UHFFFAOYSA-N 1 2 242.282 2.243 20 0 BEADLO COC(=O)C[N@H+](C)Cc1cc(C)c(C)cc1C ZINC000179392599 385465113 /nfs/dbraw/zinc/46/51/13/385465113.db2.gz JJYAEJXFENSSQL-UHFFFAOYSA-N 1 2 235.327 2.217 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1cc(C)c(C)cc1C ZINC000179392599 385465115 /nfs/dbraw/zinc/46/51/15/385465115.db2.gz JJYAEJXFENSSQL-UHFFFAOYSA-N 1 2 235.327 2.217 20 0 BEADLO C[N@H+](Cc1cnc[nH]1)Cc1cccc(F)c1 ZINC000179591275 385476330 /nfs/dbraw/zinc/47/63/30/385476330.db2.gz DKUFKCVUIOCGCX-UHFFFAOYSA-N 1 2 219.263 2.181 20 0 BEADLO C[N@@H+](Cc1cnc[nH]1)Cc1cccc(F)c1 ZINC000179591275 385476333 /nfs/dbraw/zinc/47/63/33/385476333.db2.gz DKUFKCVUIOCGCX-UHFFFAOYSA-N 1 2 219.263 2.181 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616927888 385488860 /nfs/dbraw/zinc/48/88/60/385488860.db2.gz SGWYIFWZTMRTSM-VHSXEESVSA-N 1 2 223.320 2.050 20 0 BEADLO C[C@H]([NH2+]Cc1ncn[nH]1)C1CCCCCC1 ZINC001645240980 1172646007 /nfs/dbraw/zinc/64/60/07/1172646007.db2.gz FABFOFWIRJTILE-JTQLQIEISA-N 1 2 222.336 2.253 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cnc[nH]2)cc1 ZINC000179602138 385477249 /nfs/dbraw/zinc/47/72/49/385477249.db2.gz NPXCZKTUTBDKOV-UHFFFAOYSA-N 1 2 215.300 2.350 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cnc[nH]2)cc1 ZINC000179602138 385477251 /nfs/dbraw/zinc/47/72/51/385477251.db2.gz NPXCZKTUTBDKOV-UHFFFAOYSA-N 1 2 215.300 2.350 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616927888 385488863 /nfs/dbraw/zinc/48/88/63/385488863.db2.gz SGWYIFWZTMRTSM-VHSXEESVSA-N 1 2 223.320 2.050 20 0 BEADLO Cc1ccc(C(=O)Nc2cc[nH+]cc2O)cc1 ZINC000109890421 385490690 /nfs/dbraw/zinc/49/06/90/385490690.db2.gz HBXAHGXYGYOEBF-UHFFFAOYSA-N 1 2 228.251 2.348 20 0 BEADLO Cc1c[nH]nc1CNc1ccc(C)[nH+]c1 ZINC000289441600 385493772 /nfs/dbraw/zinc/49/37/72/385493772.db2.gz FZTWUUGWKJARIP-UHFFFAOYSA-N 1 2 202.261 2.034 20 0 BEADLO Cc1ccoc1C[N@@H+](C)Cc1cccnc1N ZINC000295205894 385495362 /nfs/dbraw/zinc/49/53/62/385495362.db2.gz OHHSHTNYQKHFKG-UHFFFAOYSA-N 1 2 231.299 2.197 20 0 BEADLO Cc1ccoc1C[N@H+](C)Cc1cccnc1N ZINC000295205894 385495365 /nfs/dbraw/zinc/49/53/65/385495365.db2.gz OHHSHTNYQKHFKG-UHFFFAOYSA-N 1 2 231.299 2.197 20 0 BEADLO COCc1noc(C[NH2+][C@@H](C)c2ccccc2)n1 ZINC000180233685 385514234 /nfs/dbraw/zinc/51/42/34/385514234.db2.gz GWCCACBORWTWBP-JTQLQIEISA-N 1 2 247.298 2.067 20 0 BEADLO CC(C)CC(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000334217015 385519553 /nfs/dbraw/zinc/51/95/53/385519553.db2.gz GRXJSWHYDYJEFK-UHFFFAOYSA-N 1 2 235.331 2.162 20 0 BEADLO CC(C)CC(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000334217015 385519555 /nfs/dbraw/zinc/51/95/55/385519555.db2.gz GRXJSWHYDYJEFK-UHFFFAOYSA-N 1 2 235.331 2.162 20 0 BEADLO CC(C)c1nc(C[NH2+][C@@H]2CSC[C@@H]2C)no1 ZINC000309316968 385528679 /nfs/dbraw/zinc/52/86/79/385528679.db2.gz DHYBSBVENBZAJR-DTWKUNHWSA-N 1 2 241.360 2.034 20 0 BEADLO CSCC[N@@H+]1CCOC[C@@H]1c1ccc(C)o1 ZINC000172098462 385550067 /nfs/dbraw/zinc/55/00/67/385550067.db2.gz KPLAFQHTVXIGRE-LLVKDONJSA-N 1 2 241.356 2.324 20 0 BEADLO CSCC[N@H+]1CCOC[C@@H]1c1ccc(C)o1 ZINC000172098462 385550069 /nfs/dbraw/zinc/55/00/69/385550069.db2.gz KPLAFQHTVXIGRE-LLVKDONJSA-N 1 2 241.356 2.324 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1cscn1 ZINC000107038822 385552882 /nfs/dbraw/zinc/55/28/82/385552882.db2.gz QMZNRNLZTGPDFK-UHFFFAOYSA-N 1 2 219.269 2.099 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)CCOCC(C)C ZINC000107290487 385561922 /nfs/dbraw/zinc/56/19/22/385561922.db2.gz ONIQIXZJRRETOZ-UHFFFAOYSA-N 1 2 236.315 2.391 20 0 BEADLO CO[C@@H](C)CCC(=O)Nc1ccc(C)[nH+]c1C ZINC000181685011 385593885 /nfs/dbraw/zinc/59/38/85/385593885.db2.gz MMDDOGVBOBHFBB-JTQLQIEISA-N 1 2 236.315 2.452 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1cccc(C)c1C ZINC000280752718 385601624 /nfs/dbraw/zinc/60/16/24/385601624.db2.gz DVUVPTNAZYNQGN-LBPRGKRZSA-N 1 2 235.327 2.297 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1cccc(C)c1C ZINC000280752718 385601630 /nfs/dbraw/zinc/60/16/30/385601630.db2.gz DVUVPTNAZYNQGN-LBPRGKRZSA-N 1 2 235.327 2.297 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCOC1=O)C(C)(C)c1ccccc1 ZINC000181770624 385603074 /nfs/dbraw/zinc/60/30/74/385603074.db2.gz LTEKMUJAVFRKIV-YPMHNXCESA-N 1 2 247.338 2.258 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1ncccc1C ZINC000335418661 385605098 /nfs/dbraw/zinc/60/50/98/385605098.db2.gz FATZWCWHCVNZLO-UHFFFAOYSA-N 1 2 241.294 2.022 20 0 BEADLO CO[C@@H](C)CCNc1cc[nH+]c(C(C)C)n1 ZINC000309450248 385583820 /nfs/dbraw/zinc/58/38/20/385583820.db2.gz KWULLAMYBUFSPV-JTQLQIEISA-N 1 2 223.320 2.437 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H](C)CCc1ccsc1 ZINC000309445242 385587048 /nfs/dbraw/zinc/58/70/48/385587048.db2.gz JOXXCHFORZBSQD-VHSXEESVSA-N 1 2 241.356 2.220 20 0 BEADLO CC(C)N(CC1CC1)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493647725 385588762 /nfs/dbraw/zinc/58/87/62/385588762.db2.gz IWKMSWBQSCMPLT-WAYWQWQTSA-N 1 2 233.315 2.070 20 0 BEADLO Cc1ccc2[nH+]cc(CN3CC[C@@H](F)C3)n2c1 ZINC000335405561 385591349 /nfs/dbraw/zinc/59/13/49/385591349.db2.gz DWBSPNMLSXVGBM-LLVKDONJSA-N 1 2 233.290 2.187 20 0 BEADLO Cc1ccc2ncc(C[N@@H+]3CC[C@@H](F)C3)n2c1 ZINC000335405561 385591352 /nfs/dbraw/zinc/59/13/52/385591352.db2.gz DWBSPNMLSXVGBM-LLVKDONJSA-N 1 2 233.290 2.187 20 0 BEADLO Cc1ccc2ncc(C[N@H+]3CC[C@@H](F)C3)n2c1 ZINC000335405561 385591356 /nfs/dbraw/zinc/59/13/56/385591356.db2.gz DWBSPNMLSXVGBM-LLVKDONJSA-N 1 2 233.290 2.187 20 0 BEADLO CC[C@@H]1CCC[C@@H]1NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493664606 385591640 /nfs/dbraw/zinc/59/16/40/385591640.db2.gz ZWCQOCMUDLKTQV-JNQBIPAQSA-N 1 2 233.315 2.118 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)Cc1c(F)cccc1F ZINC000280937611 385619039 /nfs/dbraw/zinc/61/90/39/385619039.db2.gz HPABMWGQNHHBLG-UHFFFAOYSA-N 1 2 237.253 2.320 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1nccs1 ZINC000269676388 385623799 /nfs/dbraw/zinc/62/37/99/385623799.db2.gz SKGUBCCQGILTEI-UWVGGRQHSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1nccs1 ZINC000269676388 385623802 /nfs/dbraw/zinc/62/38/02/385623802.db2.gz SKGUBCCQGILTEI-UWVGGRQHSA-N 1 2 226.345 2.142 20 0 BEADLO Cc1nnc(C[N@H+]2CCS[C@H](C)[C@H]2C)s1 ZINC000334750366 385624448 /nfs/dbraw/zinc/62/44/48/385624448.db2.gz VOZTWJCYGDGBCN-HTQZYQBOSA-N 1 2 243.401 2.172 20 0 BEADLO Cc1nnc(C[N@@H+]2CCS[C@H](C)[C@H]2C)s1 ZINC000334750366 385624453 /nfs/dbraw/zinc/62/44/53/385624453.db2.gz VOZTWJCYGDGBCN-HTQZYQBOSA-N 1 2 243.401 2.172 20 0 BEADLO C[N@H+](Cc1cncs1)Cc1cccnc1 ZINC000182030388 385629904 /nfs/dbraw/zinc/62/99/04/385629904.db2.gz SSCRCSYDMSKGMY-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO C[N@@H+](Cc1cncs1)Cc1cccnc1 ZINC000182030388 385629909 /nfs/dbraw/zinc/62/99/09/385629909.db2.gz SSCRCSYDMSKGMY-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO CC(C)(C)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000280811386 385608147 /nfs/dbraw/zinc/60/81/47/385608147.db2.gz RIJMXAALZCSSFC-UHFFFAOYSA-N 1 2 217.272 2.319 20 0 BEADLO CCc1ccccc1C[N@H+](C)[C@H](C)C(=O)OC ZINC000280842185 385609237 /nfs/dbraw/zinc/60/92/37/385609237.db2.gz XDZVKZCWMXDSJU-LLVKDONJSA-N 1 2 235.327 2.242 20 0 BEADLO CCc1ccccc1C[N@@H+](C)[C@H](C)C(=O)OC ZINC000280842185 385609242 /nfs/dbraw/zinc/60/92/42/385609242.db2.gz XDZVKZCWMXDSJU-LLVKDONJSA-N 1 2 235.327 2.242 20 0 BEADLO CCCCOCC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000280852144 385609323 /nfs/dbraw/zinc/60/93/23/385609323.db2.gz WTPJPVDGEQUWTK-UHFFFAOYSA-N 1 2 247.298 2.090 20 0 BEADLO C[C@H](O)CCC[N@@H+]1CCCC[C@@H]1C(F)F ZINC000337411803 385643493 /nfs/dbraw/zinc/64/34/93/385643493.db2.gz PGNOYKXGQCVWEE-VHSXEESVSA-N 1 2 221.291 2.267 20 0 BEADLO C[C@H](O)CCC[N@H+]1CCCC[C@@H]1C(F)F ZINC000337411803 385643494 /nfs/dbraw/zinc/64/34/94/385643494.db2.gz PGNOYKXGQCVWEE-VHSXEESVSA-N 1 2 221.291 2.267 20 0 BEADLO CC[C@@H](C)[N@H+](CC(=O)OC)Cc1ccc(C)o1 ZINC000281289201 385652431 /nfs/dbraw/zinc/65/24/31/385652431.db2.gz OYWANYXEDRWIDG-SNVBAGLBSA-N 1 2 239.315 2.362 20 0 BEADLO CC[C@@H](C)[N@@H+](CC(=O)OC)Cc1ccc(C)o1 ZINC000281289201 385652435 /nfs/dbraw/zinc/65/24/35/385652435.db2.gz OYWANYXEDRWIDG-SNVBAGLBSA-N 1 2 239.315 2.362 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1ccoc1C(C)C ZINC000281493607 385675557 /nfs/dbraw/zinc/67/55/57/385675557.db2.gz OFAJJOJZKMOCIJ-UHFFFAOYSA-N 1 2 247.298 2.365 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1nc2ccccc2c(=O)[nH]1 ZINC000645218197 385678851 /nfs/dbraw/zinc/67/88/51/385678851.db2.gz VUUUPYGKVAPLFF-VHSXEESVSA-N 1 2 243.310 2.176 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1nc2ccccc2c(=O)[nH]1 ZINC000645218197 385678860 /nfs/dbraw/zinc/67/88/60/385678860.db2.gz VUUUPYGKVAPLFF-VHSXEESVSA-N 1 2 243.310 2.176 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1cccnc1)c1ccon1 ZINC000309544281 385680020 /nfs/dbraw/zinc/68/00/20/385680020.db2.gz GNHXSWZTJHENQT-UWVGGRQHSA-N 1 2 217.272 2.481 20 0 BEADLO Cc1[nH]c2nc[nH+]c(S[C@H]3CCOC3)c2c1C ZINC000645224106 385688781 /nfs/dbraw/zinc/68/87/81/385688781.db2.gz UTSNFYFTFMCTCW-VIFPVBQESA-N 1 2 249.339 2.456 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1oc(C)nc1C ZINC000645226896 385690685 /nfs/dbraw/zinc/69/06/85/385690685.db2.gz DAADCQPJWYUBMP-UHFFFAOYSA-N 1 2 249.314 2.474 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1oc(C)nc1C ZINC000645226896 385690693 /nfs/dbraw/zinc/69/06/93/385690693.db2.gz DAADCQPJWYUBMP-UHFFFAOYSA-N 1 2 249.314 2.474 20 0 BEADLO CC[C@H](O)CNc1cc(C(F)(F)F)cc[nH+]1 ZINC000229995490 385696436 /nfs/dbraw/zinc/69/64/36/385696436.db2.gz CLZVZPDINHNRNI-QMMMGPOBSA-N 1 2 234.221 2.283 20 0 BEADLO CC(C)C[C@@H]1CCCN1C(=O)CCn1cc[nH+]c1 ZINC000337535218 385696561 /nfs/dbraw/zinc/69/65/61/385696561.db2.gz HDEFPEAZADPMAD-ZDUSSCGKSA-N 1 2 249.358 2.310 20 0 BEADLO CC[C@H]([NH2+]CC(F)(F)CO)c1cccs1 ZINC000184704358 385698103 /nfs/dbraw/zinc/69/81/03/385698103.db2.gz MQCROFPNMQDIFG-QMMMGPOBSA-N 1 2 235.299 2.416 20 0 BEADLO CO[C@](C)(CNc1cccc[nH+]1)C1CC1 ZINC000292378596 385702992 /nfs/dbraw/zinc/70/29/92/385702992.db2.gz QAHDSNOEBUEFKR-GFCCVEGCSA-N 1 2 206.289 2.309 20 0 BEADLO FC(F)(F)C1(C[NH2+]Cc2ccn[nH]2)CCC1 ZINC000336687054 385705929 /nfs/dbraw/zinc/70/59/29/385705929.db2.gz ULCVJMGXVLWICX-UHFFFAOYSA-N 1 2 233.237 2.232 20 0 BEADLO Cc1cn[nH]c1CNc1cc2c(c[nH+]1)CCC2 ZINC000645212680 385671046 /nfs/dbraw/zinc/67/10/46/385671046.db2.gz DJMWQLMXBNTIAN-UHFFFAOYSA-N 1 2 228.299 2.214 20 0 BEADLO Cn1nccc1[C@@H]1CCCC[N@@H+]1Cc1ccon1 ZINC000281446728 385671629 /nfs/dbraw/zinc/67/16/29/385671629.db2.gz QGVXVWXZMBKUGX-ZDUSSCGKSA-N 1 2 246.314 2.135 20 0 BEADLO Cn1nccc1[C@@H]1CCCC[N@H+]1Cc1ccon1 ZINC000281446728 385671635 /nfs/dbraw/zinc/67/16/35/385671635.db2.gz QGVXVWXZMBKUGX-ZDUSSCGKSA-N 1 2 246.314 2.135 20 0 BEADLO CN(C)c1ccccc1CN(C)Cc1[nH]cc[nH+]1 ZINC000270691677 385731207 /nfs/dbraw/zinc/73/12/07/385731207.db2.gz XULSXNJJBJQZII-UHFFFAOYSA-N 1 2 244.342 2.108 20 0 BEADLO CN(C)c1ccccc1C[N@H+](C)Cc1ncc[nH]1 ZINC000270691677 385731213 /nfs/dbraw/zinc/73/12/13/385731213.db2.gz XULSXNJJBJQZII-UHFFFAOYSA-N 1 2 244.342 2.108 20 0 BEADLO CN(C)c1ccccc1C[N@@H+](C)Cc1ncc[nH]1 ZINC000270691677 385731217 /nfs/dbraw/zinc/73/12/17/385731217.db2.gz XULSXNJJBJQZII-UHFFFAOYSA-N 1 2 244.342 2.108 20 0 BEADLO Cn1ccc(C[N@H+](C)Cc2cccc(F)c2)n1 ZINC000270791224 385744099 /nfs/dbraw/zinc/74/40/99/385744099.db2.gz LYYJNNFCWNOVHX-UHFFFAOYSA-N 1 2 233.290 2.191 20 0 BEADLO Cn1ccc(C[N@@H+](C)Cc2cccc(F)c2)n1 ZINC000270791224 385744104 /nfs/dbraw/zinc/74/41/04/385744104.db2.gz LYYJNNFCWNOVHX-UHFFFAOYSA-N 1 2 233.290 2.191 20 0 BEADLO C[C@H](C1CCCCC1)N(C)C(=O)Cn1cc[nH+]c1 ZINC000282531377 385768400 /nfs/dbraw/zinc/76/84/00/385768400.db2.gz QKVLIARTEQCJIC-GFCCVEGCSA-N 1 2 249.358 2.310 20 0 BEADLO C[C@@H](C1CCCCC1)N(C)C(=O)Cn1cc[nH+]c1 ZINC000282531380 385769303 /nfs/dbraw/zinc/76/93/03/385769303.db2.gz QKVLIARTEQCJIC-LBPRGKRZSA-N 1 2 249.358 2.310 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@H]1CC1(C)C ZINC000271000120 385770522 /nfs/dbraw/zinc/77/05/22/385770522.db2.gz DHXSPDAIBRNHJK-JTQLQIEISA-N 1 2 219.288 2.310 20 0 BEADLO CC[C@H]([NH2+]CCc1sccc1C)C(=O)OC ZINC000336737408 385771347 /nfs/dbraw/zinc/77/13/47/385771347.db2.gz NLCCSEPXNQPGFA-JTQLQIEISA-N 1 2 241.356 2.140 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccc(COC)o2)CCO1 ZINC000271049294 385780038 /nfs/dbraw/zinc/78/00/38/385780038.db2.gz UGSRDCPLAHXLEV-NSHDSACASA-N 1 2 239.315 2.037 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccc(COC)o2)CCO1 ZINC000271049294 385780042 /nfs/dbraw/zinc/78/00/42/385780042.db2.gz UGSRDCPLAHXLEV-NSHDSACASA-N 1 2 239.315 2.037 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC[C@@H]1C[C@@H]1C ZINC000271108242 385788088 /nfs/dbraw/zinc/78/80/88/385788088.db2.gz FOVQSGBZWBQWHJ-WPRPVWTQSA-N 1 2 219.288 2.168 20 0 BEADLO CC[C@H]1CC[C@H](C)N1c1[nH+]cnc2c1cnn2C ZINC000337784969 385784154 /nfs/dbraw/zinc/78/41/54/385784154.db2.gz AQQLPRAAYDKPNR-UWVGGRQHSA-N 1 2 245.330 2.131 20 0 BEADLO c1oc2ccccc2c1C[N@@H+]1CCO[C@H]2C[C@H]21 ZINC000644838786 385856683 /nfs/dbraw/zinc/85/66/83/385856683.db2.gz SUOXXOUANBVQJO-OCCSQVGLSA-N 1 2 229.279 2.406 20 0 BEADLO c1oc2ccccc2c1C[N@H+]1CCO[C@H]2C[C@H]21 ZINC000644838786 385856686 /nfs/dbraw/zinc/85/66/86/385856686.db2.gz SUOXXOUANBVQJO-OCCSQVGLSA-N 1 2 229.279 2.406 20 0 BEADLO Fc1cccc(Cl)c1CNCC[NH+]1CCC1 ZINC000336716738 385816216 /nfs/dbraw/zinc/81/62/16/385816216.db2.gz WKHCUMUZGOYKAX-UHFFFAOYSA-N 1 2 242.725 2.274 20 0 BEADLO Cc1nsc(N2CCCC[C@@H]2c2[nH]cc[nH+]2)n1 ZINC000271344908 385819577 /nfs/dbraw/zinc/81/95/77/385819577.db2.gz NAQDOQKSLHRIMT-SECBINFHSA-N 1 2 249.343 2.301 20 0 BEADLO COc1nccnc1C[N@H+](C)Cc1ccccc1 ZINC000294188093 385820585 /nfs/dbraw/zinc/82/05/85/385820585.db2.gz KTBLEIYRGLKHRH-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1nccnc1C[N@@H+](C)Cc1ccccc1 ZINC000294188093 385820593 /nfs/dbraw/zinc/82/05/93/385820593.db2.gz KTBLEIYRGLKHRH-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO CN(CC1CCCCC1)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000283571432 385822522 /nfs/dbraw/zinc/82/25/22/385822522.db2.gz VRLPJKMVERUVBI-BQYQJAHWSA-N 1 2 247.342 2.462 20 0 BEADLO CC1(C)C[N@H+](Cc2cn[nH]c2)[C@@H]1c1cccnc1 ZINC000644835300 385829731 /nfs/dbraw/zinc/82/97/31/385829731.db2.gz JYBBRJLPVUUCNN-CYBMUJFWSA-N 1 2 242.326 2.388 20 0 BEADLO CC1(C)C[N@@H+](Cc2cn[nH]c2)[C@@H]1c1cccnc1 ZINC000644835300 385829734 /nfs/dbraw/zinc/82/97/34/385829734.db2.gz JYBBRJLPVUUCNN-CYBMUJFWSA-N 1 2 242.326 2.388 20 0 BEADLO CC(C)C[C@@H](C)OC(=O)NCCn1cc[nH+]c1 ZINC000294288260 385833111 /nfs/dbraw/zinc/83/31/11/385833111.db2.gz HBAJUPAMIRNQCE-LLVKDONJSA-N 1 2 239.319 2.044 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1ncc(C)s1 ZINC000271501847 385833726 /nfs/dbraw/zinc/83/37/26/385833726.db2.gz KRWHDGWKZNKSBA-ONGXEEELSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1ncc(C)s1 ZINC000271501847 385833730 /nfs/dbraw/zinc/83/37/30/385833730.db2.gz KRWHDGWKZNKSBA-ONGXEEELSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC(C)(C)C ZINC000121375910 385840229 /nfs/dbraw/zinc/84/02/29/385840229.db2.gz WIGXBSFVOJSGOK-UHFFFAOYSA-N 1 2 207.277 2.310 20 0 BEADLO Cc1noc(C(C)(C)[NH2+]Cc2ccsc2)n1 ZINC000284058763 385847100 /nfs/dbraw/zinc/84/71/00/385847100.db2.gz PVYCCBKCIUKGJX-UHFFFAOYSA-N 1 2 237.328 2.464 20 0 BEADLO CC(C)(C)[C@H]1CCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000284051045 385847706 /nfs/dbraw/zinc/84/77/06/385847706.db2.gz QLJNOFCCXOBPHO-NNNHXZLVSA-N 1 2 247.342 2.460 20 0 BEADLO Cc1nc(C[NH2+]C(C)(C)CF)cs1 ZINC000308303220 385848155 /nfs/dbraw/zinc/84/81/55/385848155.db2.gz LZCSBGHQVTVQSO-UHFFFAOYSA-N 1 2 202.298 2.289 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1occc1C(C)C ZINC000284192252 385854985 /nfs/dbraw/zinc/85/49/85/385854985.db2.gz BROSCFYJLMLEGB-UHFFFAOYSA-N 1 2 247.298 2.365 20 0 BEADLO CC(=O)NCc1ccc2c(c1)[nH+]c(C)n2C1CC1 ZINC000282822900 385788860 /nfs/dbraw/zinc/78/88/60/385788860.db2.gz CNHZEJIQZAMIEH-UHFFFAOYSA-N 1 2 243.310 2.316 20 0 BEADLO CC(C)COCC[N@H+](C)Cc1cscn1 ZINC000282823459 385789710 /nfs/dbraw/zinc/78/97/10/385789710.db2.gz YURYZZUZXZGLOE-UHFFFAOYSA-N 1 2 228.361 2.248 20 0 BEADLO CC(C)COCC[N@@H+](C)Cc1cscn1 ZINC000282823459 385789716 /nfs/dbraw/zinc/78/97/16/385789716.db2.gz YURYZZUZXZGLOE-UHFFFAOYSA-N 1 2 228.361 2.248 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1cccc2cc[nH]c21 ZINC000271139826 385792805 /nfs/dbraw/zinc/79/28/05/385792805.db2.gz CFDBYQCHVUFUOE-UHFFFAOYSA-N 1 2 246.310 2.163 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1cccc2cc[nH]c21 ZINC000271139826 385792811 /nfs/dbraw/zinc/79/28/11/385792811.db2.gz CFDBYQCHVUFUOE-UHFFFAOYSA-N 1 2 246.310 2.163 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CC[C@@H](C)C1 ZINC000271151104 385793924 /nfs/dbraw/zinc/79/39/24/385793924.db2.gz SSRYWMMLRRDXSN-SECBINFHSA-N 1 2 219.288 2.264 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@H]1CCSC1 ZINC000271138710 385793938 /nfs/dbraw/zinc/79/39/38/385793938.db2.gz PMKSDJSSXLDWHO-SECBINFHSA-N 1 2 237.328 2.017 20 0 BEADLO C[C@H]([NH2+]Cc1ncnn1C(C)(C)C)c1ccco1 ZINC000282917855 385796758 /nfs/dbraw/zinc/79/67/58/385796758.db2.gz XSKAXJHOOFJKHD-JTQLQIEISA-N 1 2 248.330 2.477 20 0 BEADLO CC(C)(C)OCC(=O)Nc1cccc2[nH+]ccn21 ZINC000272210562 385884534 /nfs/dbraw/zinc/88/45/34/385884534.db2.gz LTLCAYKWQCUUNU-UHFFFAOYSA-N 1 2 247.298 2.088 20 0 BEADLO C[NH+](C)Cc1nc([C@H]2C[C@@H]2c2ccccc2)no1 ZINC000338066300 385885789 /nfs/dbraw/zinc/88/57/89/385885789.db2.gz AQXJQFXHJOKWEX-NEPJUHHUSA-N 1 2 243.310 2.402 20 0 BEADLO C[C@@H]1CCCC[C@@H]1Nc1nc[nH+]c2c1OCCN2 ZINC000647845912 385886940 /nfs/dbraw/zinc/88/69/40/385886940.db2.gz FKXIKBJBFCHEGQ-ZJUUUORDSA-N 1 2 248.330 2.272 20 0 BEADLO C[C@@H]1CCCC[C@@H]1Nc1[nH+]cnc2c1OCCN2 ZINC000647845912 385886945 /nfs/dbraw/zinc/88/69/45/385886945.db2.gz FKXIKBJBFCHEGQ-ZJUUUORDSA-N 1 2 248.330 2.272 20 0 BEADLO Cc1ccc2oc(=N[C@H](C)c3[nH]cc[nH+]3)[nH]c2c1 ZINC000647843275 385892756 /nfs/dbraw/zinc/89/27/56/385892756.db2.gz DEYAFHIGDLXFKM-SECBINFHSA-N 1 2 242.282 2.454 20 0 BEADLO COC(=O)[C@H](C)[NH2+]C/C(C)=C/c1ccccc1 ZINC000272448855 385903910 /nfs/dbraw/zinc/90/39/10/385903910.db2.gz VLELLKMPGBILOX-ZKQHCESOSA-N 1 2 233.311 2.241 20 0 BEADLO Cc1cn2c([nH+]1)CN(C(=O)CCCC1CC1)CC2 ZINC000643241964 385904508 /nfs/dbraw/zinc/90/45/08/385904508.db2.gz WOWIYUZQKAPDTR-UHFFFAOYSA-N 1 2 247.342 2.114 20 0 BEADLO CCN(CCO)c1[nH+]ccc2ccc(F)cc21 ZINC000340201425 385907527 /nfs/dbraw/zinc/90/75/27/385907527.db2.gz KPWMASMHRBBEKR-UHFFFAOYSA-N 1 2 234.274 2.193 20 0 BEADLO COC[C@]1(C)CCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000294879261 385907568 /nfs/dbraw/zinc/90/75/68/385907568.db2.gz DYYNSUUNTBBFJV-CQSZACIVSA-N 1 2 245.326 2.426 20 0 BEADLO CSc1ccc(NCc2c(C)cnn2C)[nH+]c1 ZINC000285211679 385907673 /nfs/dbraw/zinc/90/76/73/385907673.db2.gz UFLUPRRPQFISEF-UHFFFAOYSA-N 1 2 248.355 2.458 20 0 BEADLO CCc1cc(NC[C@@H]2C[C@H]2C2CCC2)nc[nH+]1 ZINC000644878348 385907781 /nfs/dbraw/zinc/90/77/81/385907781.db2.gz UPAOXYMSTADBND-AAEUAGOBSA-N 1 2 231.343 2.309 20 0 BEADLO COC(=O)C(C)(C)[NH2+]CCCc1cccc(C)c1 ZINC000272530813 385910076 /nfs/dbraw/zinc/91/00/76/385910076.db2.gz MIWPBGKOGFNCBY-UHFFFAOYSA-N 1 2 249.354 2.469 20 0 BEADLO CS[C@H]1CCN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000294903686 385910919 /nfs/dbraw/zinc/91/09/19/385910919.db2.gz FBBFAQMCSIXBBT-JTQLQIEISA-N 1 2 235.356 2.296 20 0 BEADLO CCCCOCC[N@H+](C)CC(=O)OC(C)(C)C ZINC000338220469 385918768 /nfs/dbraw/zinc/91/87/68/385918768.db2.gz JBUZWFJCEJDMIC-UHFFFAOYSA-N 1 2 245.363 2.077 20 0 BEADLO CCCCOCC[N@@H+](C)CC(=O)OC(C)(C)C ZINC000338220469 385918774 /nfs/dbraw/zinc/91/87/74/385918774.db2.gz JBUZWFJCEJDMIC-UHFFFAOYSA-N 1 2 245.363 2.077 20 0 BEADLO Fc1cccc(C2([NH2+]Cc3cnns3)CC2)c1 ZINC000294950264 385925003 /nfs/dbraw/zinc/92/50/03/385925003.db2.gz IZHNGTYHLOGZLL-UHFFFAOYSA-N 1 2 249.314 2.456 20 0 BEADLO CCC[C@@H]1CCC[C@@H]1C(=O)NCc1[nH+]ccn1C ZINC000294503168 385859968 /nfs/dbraw/zinc/85/99/68/385859968.db2.gz HCIGBTDEPAZVNV-NEPJUHHUSA-N 1 2 249.358 2.253 20 0 BEADLO CC[C@H]1CCC[C@H]1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000284335074 385864434 /nfs/dbraw/zinc/86/44/34/385864434.db2.gz IYNDCNVKCCJPRC-SKBQGCEYSA-N 1 2 233.315 2.118 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N[C@H]1CC12CCCCC2 ZINC000284442005 385868746 /nfs/dbraw/zinc/86/87/46/385868746.db2.gz QDSRNUJFQHVIBX-ITKZLYELSA-N 1 2 245.326 2.262 20 0 BEADLO Fc1ccc([C@H]([NH2+]C2CCC2)c2nnc[nH]2)cc1 ZINC000294564474 385869325 /nfs/dbraw/zinc/86/93/25/385869325.db2.gz BPUZWKLUXZINHH-LBPRGKRZSA-N 1 2 246.289 2.175 20 0 BEADLO CCCC[NH2+][C@@H](c1cn[nH]n1)c1ccc(F)cc1 ZINC000340470440 385871175 /nfs/dbraw/zinc/87/11/75/385871175.db2.gz OJJOQBFFPLEYSH-CYBMUJFWSA-N 1 2 248.305 2.423 20 0 BEADLO CCCC[NH2+][C@@H](c1c[nH]nn1)c1ccc(F)cc1 ZINC000340470440 385871178 /nfs/dbraw/zinc/87/11/78/385871178.db2.gz OJJOQBFFPLEYSH-CYBMUJFWSA-N 1 2 248.305 2.423 20 0 BEADLO CCC[C@H]1CCC[C@@H]1C(=O)NCc1[nH]cc[nH+]1 ZINC000294617532 385875562 /nfs/dbraw/zinc/87/55/62/385875562.db2.gz NJPRFAXWDOXQEF-QWRGUYRKSA-N 1 2 235.331 2.242 20 0 BEADLO C[C@H](CO)[N@H+](C)Cc1nc(Cl)ccc1Cl ZINC000124054859 385980361 /nfs/dbraw/zinc/98/03/61/385980361.db2.gz FBFIXLURZNWFGM-SSDOTTSWSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@H](CO)[N@@H+](C)Cc1nc(Cl)ccc1Cl ZINC000124054859 385980365 /nfs/dbraw/zinc/98/03/65/385980365.db2.gz FBFIXLURZNWFGM-SSDOTTSWSA-N 1 2 249.141 2.201 20 0 BEADLO Cc1occc1C[NH2+][C@@H](C)c1ccn(C)n1 ZINC000414060807 385937404 /nfs/dbraw/zinc/93/74/04/385937404.db2.gz AEUOWEMAUNBQHD-VIFPVBQESA-N 1 2 219.288 2.172 20 0 BEADLO Cc1noc([C@@H]2CCC[N@@H+]2Cc2cccnc2)n1 ZINC000285599832 385947647 /nfs/dbraw/zinc/94/76/47/385947647.db2.gz JQUXFAJHBPQYOV-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1noc([C@@H]2CCC[N@H+]2Cc2cccnc2)n1 ZINC000285599832 385947656 /nfs/dbraw/zinc/94/76/56/385947656.db2.gz JQUXFAJHBPQYOV-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO CO[C@H]1CCC[N@@H+]([C@H](C)c2nnc(C)s2)C1 ZINC000338284542 385949743 /nfs/dbraw/zinc/94/97/43/385949743.db2.gz QXSGUBLOYGBFGF-SCZZXKLOSA-N 1 2 241.360 2.018 20 0 BEADLO CO[C@H]1CCC[N@H+]([C@H](C)c2nnc(C)s2)C1 ZINC000338284542 385949748 /nfs/dbraw/zinc/94/97/48/385949748.db2.gz QXSGUBLOYGBFGF-SCZZXKLOSA-N 1 2 241.360 2.018 20 0 BEADLO Cc1cc[nH+]c(NCc2n[nH]c(C(C)C)n2)c1 ZINC000295036824 385950242 /nfs/dbraw/zinc/95/02/42/385950242.db2.gz WDYGODIDIZPKIY-UHFFFAOYSA-N 1 2 231.303 2.244 20 0 BEADLO C[C@H]([NH2+]c1ccc2c(c1)CCN2)[C@@H]1CCOC1 ZINC000335052721 385951561 /nfs/dbraw/zinc/95/15/61/385951561.db2.gz GYONJAHVPPEKAP-CMPLNLGQSA-N 1 2 232.327 2.492 20 0 BEADLO C[C@H](Nc1ccc2c(c1)CC[NH2+]2)[C@@H]1CCOC1 ZINC000335052721 385951569 /nfs/dbraw/zinc/95/15/69/385951569.db2.gz GYONJAHVPPEKAP-CMPLNLGQSA-N 1 2 232.327 2.492 20 0 BEADLO C[C@@H](CC(C)(C)O)Nc1cc[nH+]c(C2CC2)n1 ZINC000295040424 385951918 /nfs/dbraw/zinc/95/19/18/385951918.db2.gz SRXYGGDHXSAQLF-VIFPVBQESA-N 1 2 235.331 2.315 20 0 BEADLO COC(=O)[C@@H]([NH2+]Cc1c(C)cccc1C)C1CC1 ZINC000273022589 385960261 /nfs/dbraw/zinc/96/02/61/385960261.db2.gz XBIGRMLGLZOPSR-AWEZNQCLSA-N 1 2 247.338 2.345 20 0 BEADLO CC(C)n1cc(C[NH2+]Cc2ccsc2)nn1 ZINC000289900488 385963363 /nfs/dbraw/zinc/96/33/63/385963363.db2.gz YHRPEAFGXQEMQO-UHFFFAOYSA-N 1 2 236.344 2.210 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCCC[C@@H]1c1nnc(C)[nH]1 ZINC000338332701 385964173 /nfs/dbraw/zinc/96/41/73/385964173.db2.gz MHMAYPNWUBEKGX-GHMZBOCLSA-N 1 2 240.326 2.388 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCCC[C@@H]1c1nnc(C)[nH]1 ZINC000338332701 385964176 /nfs/dbraw/zinc/96/41/76/385964176.db2.gz MHMAYPNWUBEKGX-GHMZBOCLSA-N 1 2 240.326 2.388 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CCCO[C@H](C)C2)s1 ZINC000338318026 385966551 /nfs/dbraw/zinc/96/65/51/385966551.db2.gz UHJOKRZDSUFRQZ-RKDXNWHRSA-N 1 2 241.360 2.018 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CCCO[C@H](C)C2)s1 ZINC000338318026 385966558 /nfs/dbraw/zinc/96/65/58/385966558.db2.gz UHJOKRZDSUFRQZ-RKDXNWHRSA-N 1 2 241.360 2.018 20 0 BEADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cocn1 ZINC000355208521 385974391 /nfs/dbraw/zinc/97/43/91/385974391.db2.gz ZFXNSWIWONUEOP-CBAPKCEASA-N 1 2 234.221 2.447 20 0 BEADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1cocn1 ZINC000355208521 385974392 /nfs/dbraw/zinc/97/43/92/385974392.db2.gz ZFXNSWIWONUEOP-CBAPKCEASA-N 1 2 234.221 2.447 20 0 BEADLO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cocn1 ZINC000355208522 385974730 /nfs/dbraw/zinc/97/47/30/385974730.db2.gz ZFXNSWIWONUEOP-IONNQARKSA-N 1 2 234.221 2.447 20 0 BEADLO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cocn1 ZINC000355208522 385974733 /nfs/dbraw/zinc/97/47/33/385974733.db2.gz ZFXNSWIWONUEOP-IONNQARKSA-N 1 2 234.221 2.447 20 0 BEADLO Fc1ccc(C[N@@H+]2CCC[C@@H]2c2cc[nH]n2)nc1 ZINC000286175571 386006054 /nfs/dbraw/zinc/00/60/54/386006054.db2.gz OXDHPHDMNNMVPZ-CYBMUJFWSA-N 1 2 246.289 2.281 20 0 BEADLO Fc1ccc(C[N@H+]2CCC[C@@H]2c2cc[nH]n2)nc1 ZINC000286175571 386006057 /nfs/dbraw/zinc/00/60/57/386006057.db2.gz OXDHPHDMNNMVPZ-CYBMUJFWSA-N 1 2 246.289 2.281 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@](C)(F)C2)o1 ZINC000295336865 386013674 /nfs/dbraw/zinc/01/36/74/386013674.db2.gz HUPYDQJAGIWCIS-NSHDSACASA-N 1 2 212.268 2.307 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@](C)(F)C2)o1 ZINC000295336865 386013677 /nfs/dbraw/zinc/01/36/77/386013677.db2.gz HUPYDQJAGIWCIS-NSHDSACASA-N 1 2 212.268 2.307 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1ncnn1C(C)(C)C ZINC000335068662 386015676 /nfs/dbraw/zinc/01/56/76/386015676.db2.gz VGJLZGQWSUCSCO-UWVGGRQHSA-N 1 2 222.336 2.016 20 0 BEADLO Cc1noc([C@H](C)[NH2+]C/C=C/c2ccncc2)n1 ZINC000425997464 386016072 /nfs/dbraw/zinc/01/60/72/386016072.db2.gz BWUXLYBSPJKSDD-FSIBCCDJSA-N 1 2 244.298 2.137 20 0 BEADLO CCCC(C)(C)Cc1nc(C[NH2+]C)no1 ZINC000414636477 386018714 /nfs/dbraw/zinc/01/87/14/386018714.db2.gz APPFDMXKZQUREC-UHFFFAOYSA-N 1 2 211.309 2.158 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1 ZINC000295364261 386020780 /nfs/dbraw/zinc/02/07/80/386020780.db2.gz REEILFGECZOKPC-HOSYDEDBSA-N 1 2 249.358 2.407 20 0 BEADLO CC[C@H]1CCC[C@]2(C1)NC(=O)C[N@@H+]2CC(C)C ZINC000414178817 386022777 /nfs/dbraw/zinc/02/27/77/386022777.db2.gz KHTWKASGGYZSOH-JSGCOSHPSA-N 1 2 238.375 2.371 20 0 BEADLO CC[C@H]1CCC[C@]2(C1)NC(=O)C[N@H+]2CC(C)C ZINC000414178817 386022781 /nfs/dbraw/zinc/02/27/81/386022781.db2.gz KHTWKASGGYZSOH-JSGCOSHPSA-N 1 2 238.375 2.371 20 0 BEADLO CCC[N@@H+]1CC(=O)N[C@@]12CCCC(C)(C)C2 ZINC000414179716 386023652 /nfs/dbraw/zinc/02/36/52/386023652.db2.gz IYCHODJOLKXDQA-ZDUSSCGKSA-N 1 2 224.348 2.125 20 0 BEADLO CCC[N@H+]1CC(=O)N[C@@]12CCCC(C)(C)C2 ZINC000414179716 386023657 /nfs/dbraw/zinc/02/36/57/386023657.db2.gz IYCHODJOLKXDQA-ZDUSSCGKSA-N 1 2 224.348 2.125 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@]12CCC[C@H](C)C2 ZINC000414196455 386035702 /nfs/dbraw/zinc/03/57/02/386035702.db2.gz OWYDLMAUSMLGBO-GXFFZTMASA-N 1 2 224.348 2.123 20 0 BEADLO C[N@H+](CC[C@@H](O)c1ccccc1)Cc1ccon1 ZINC000286392482 386035873 /nfs/dbraw/zinc/03/58/73/386035873.db2.gz KXIRDKVWCGKLKS-CQSZACIVSA-N 1 2 246.310 2.230 20 0 BEADLO C[N@@H+](CC[C@@H](O)c1ccccc1)Cc1ccon1 ZINC000286392482 386035879 /nfs/dbraw/zinc/03/58/79/386035879.db2.gz KXIRDKVWCGKLKS-CQSZACIVSA-N 1 2 246.310 2.230 20 0 BEADLO Cc1coc(C)c1C(=O)Nc1cc[nH+]c(C)c1 ZINC000334437351 386043222 /nfs/dbraw/zinc/04/32/22/386043222.db2.gz RDFMONSOXFDOBY-UHFFFAOYSA-N 1 2 230.267 2.274 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2cn[nH]c2)o1 ZINC000303741079 386045264 /nfs/dbraw/zinc/04/52/64/386045264.db2.gz HDOCNZKAGWOYBE-DTWKUNHWSA-N 1 2 220.276 2.118 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2ccn(C)n2)nc1C ZINC000414160726 386045654 /nfs/dbraw/zinc/04/56/54/386045654.db2.gz DMAYPIPHKPFDGR-LBPRGKRZSA-N 1 2 244.342 2.283 20 0 BEADLO CCc1ccc(C[N@@H+]2C[C@@H](C)OC[C@H]2C)nc1 ZINC000335930001 386048704 /nfs/dbraw/zinc/04/87/04/386048704.db2.gz ATXVKSXJHREOBZ-VXGBXAGGSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1ccc(C[N@H+]2C[C@@H](C)OC[C@H]2C)nc1 ZINC000335930001 386048708 /nfs/dbraw/zinc/04/87/08/386048708.db2.gz ATXVKSXJHREOBZ-VXGBXAGGSA-N 1 2 234.343 2.253 20 0 BEADLO Cc1ccc(Cc2noc(CC3CC3)n2)c[nH+]1 ZINC000273922472 386051060 /nfs/dbraw/zinc/05/10/60/386051060.db2.gz LFNKEUKAYUVKNX-UHFFFAOYSA-N 1 2 229.283 2.316 20 0 BEADLO C[NH2+]Cc1noc([C@H]2C[C@@]2(F)c2ccccc2)n1 ZINC000414645983 386055356 /nfs/dbraw/zinc/05/53/56/386055356.db2.gz RETBPNNXAWLGIZ-ZWNOBZJWSA-N 1 2 247.273 2.141 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@](C)(F)C2)on1 ZINC000295584995 386055467 /nfs/dbraw/zinc/05/54/67/386055467.db2.gz ZUSKYGSNTNSLAW-NSHDSACASA-N 1 2 212.268 2.307 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@](C)(F)C2)on1 ZINC000295584995 386055471 /nfs/dbraw/zinc/05/54/71/386055471.db2.gz ZUSKYGSNTNSLAW-NSHDSACASA-N 1 2 212.268 2.307 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2ccoc2)cn1 ZINC000345101269 385996323 /nfs/dbraw/zinc/99/63/23/385996323.db2.gz UVVFWKZJEWCEIN-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2ccoc2)cn1 ZINC000345101269 385996326 /nfs/dbraw/zinc/99/63/26/385996326.db2.gz UVVFWKZJEWCEIN-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO CC[C@H]1CCC[C@@H]1C(=O)N1CCn2c[nH+]cc2C1 ZINC000295898908 386104268 /nfs/dbraw/zinc/10/42/68/386104268.db2.gz CYHDEQRMIWFKHA-AAEUAGOBSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1noc(C[NH2+][C@H](C)c2ccccc2)n1 ZINC000037980605 386108558 /nfs/dbraw/zinc/10/85/58/386108558.db2.gz DVDZNGGBAPVKFN-SECBINFHSA-N 1 2 217.272 2.229 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2nccn2C)o1 ZINC000037979147 386110357 /nfs/dbraw/zinc/11/03/57/386110357.db2.gz ZGHASULMXZISEM-SNVBAGLBSA-N 1 2 219.288 2.172 20 0 BEADLO CC(C)CC(=O)N1CC(C)(C)[C@@H]1c1[nH+]ccn1C ZINC000295945466 386112474 /nfs/dbraw/zinc/11/24/74/386112474.db2.gz QMPZIIPVXPVVPC-LBPRGKRZSA-N 1 2 249.358 2.376 20 0 BEADLO CCC1(C(=O)N[C@H]2C[C@H](C)n3cc[nH+]c32)CC1 ZINC000335139306 386115196 /nfs/dbraw/zinc/11/51/96/386115196.db2.gz IILJVWMDJOLVOS-UWVGGRQHSA-N 1 2 233.315 2.195 20 0 BEADLO CC(C)=CC(=O)N1CC(C)(C)[C@H]1c1[nH+]ccn1C ZINC000296011179 386121190 /nfs/dbraw/zinc/12/11/90/386121190.db2.gz WHHVDXDADAYIMJ-GFCCVEGCSA-N 1 2 247.342 2.296 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+]1Cc2ccccc2C(C)(C)C1 ZINC000340234600 386058806 /nfs/dbraw/zinc/05/88/06/386058806.db2.gz ASBWOKCQYKITMB-LLVKDONJSA-N 1 2 247.338 2.341 20 0 BEADLO COC(=O)[C@@H](C)[N@H+]1Cc2ccccc2C(C)(C)C1 ZINC000340234600 386058810 /nfs/dbraw/zinc/05/88/10/386058810.db2.gz ASBWOKCQYKITMB-LLVKDONJSA-N 1 2 247.338 2.341 20 0 BEADLO CCn1ccc(C[NH2+][C@H](C)c2ccco2)n1 ZINC000414208326 386062245 /nfs/dbraw/zinc/06/22/45/386062245.db2.gz LQORQHHXRGNSBJ-SNVBAGLBSA-N 1 2 219.288 2.347 20 0 BEADLO Cc1nocc1C[N@H+]1CC[C@@H](C)C[C@H]1C(N)=O ZINC000334444049 386066316 /nfs/dbraw/zinc/06/63/16/386066316.db2.gz MTOIEHMYEXCDMA-KCJUWKMLSA-N 1 2 237.303 2.119 20 0 BEADLO Cc1nocc1C[N@@H+]1CC[C@@H](C)C[C@H]1C(N)=O ZINC000334444049 386066321 /nfs/dbraw/zinc/06/63/21/386066321.db2.gz MTOIEHMYEXCDMA-KCJUWKMLSA-N 1 2 237.303 2.119 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCOCC23CC3)cc1 ZINC000338596484 386069547 /nfs/dbraw/zinc/06/95/47/386069547.db2.gz KNEXFAOBWKXEJV-UHFFFAOYSA-N 1 2 247.338 2.450 20 0 BEADLO CCOc1ccc(C[N@H+]2CCOCC23CC3)cc1 ZINC000338596484 386069550 /nfs/dbraw/zinc/06/95/50/386069550.db2.gz KNEXFAOBWKXEJV-UHFFFAOYSA-N 1 2 247.338 2.450 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)NCC1CCCCC1 ZINC000287027641 386092250 /nfs/dbraw/zinc/09/22/50/386092250.db2.gz HQYMIQXHMXPODO-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO CC(C)(C)c1nc(N[C@@H]2C[C@H]3C[C@H]3C2)cc[nH+]1 ZINC000644883912 386092893 /nfs/dbraw/zinc/09/28/93/386092893.db2.gz ONZGKKGNCWJHTO-JGPRNRPPSA-N 1 2 231.343 2.406 20 0 BEADLO C[C@H]1CC[C@@H](C(=O)NCCNc2cccc[nH+]2)C1 ZINC000345307886 386098536 /nfs/dbraw/zinc/09/85/36/386098536.db2.gz FZFSQIKEEABVQW-NWDGAFQWSA-N 1 2 247.342 2.046 20 0 BEADLO CCCC1(CNC(=O)CCc2[nH]cc[nH+]2)CC1 ZINC000287894193 386152756 /nfs/dbraw/zinc/15/27/56/386152756.db2.gz BZQBUSYHKURTRC-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)CCCSC ZINC000346123096 386155977 /nfs/dbraw/zinc/15/59/77/386155977.db2.gz PTFYPUJLBXMXCR-UHFFFAOYSA-N 1 2 238.356 2.148 20 0 BEADLO CC(C)[C@@H](NC(=O)N(C)C(C)C)c1[nH]cc[nH+]1 ZINC000296261001 386156309 /nfs/dbraw/zinc/15/63/09/386156309.db2.gz YHWMJZHZXPNLKS-SNVBAGLBSA-N 1 2 238.335 2.157 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1C[C@@]1(C)C(C)C ZINC000274884182 386160579 /nfs/dbraw/zinc/16/05/79/386160579.db2.gz HKYJCCUKAALPLR-GWCFXTLKSA-N 1 2 235.331 2.017 20 0 BEADLO c1nnc([C@@H]([NH2+]C2CCCC2)c2ccccc2)[nH]1 ZINC000274876538 386160722 /nfs/dbraw/zinc/16/07/22/386160722.db2.gz XUSCPVVRAVBMDH-ZDUSSCGKSA-N 1 2 242.326 2.426 20 0 BEADLO C[C@H](CCCCO)Nc1cc[nH+]c(C2CC2)n1 ZINC000296358000 386166020 /nfs/dbraw/zinc/16/60/20/386166020.db2.gz RRCDVAXRVCAHSH-SNVBAGLBSA-N 1 2 235.331 2.317 20 0 BEADLO C[C@@H]1CCCCCN1C(=O)CCn1cc[nH+]c1 ZINC000335317005 386173504 /nfs/dbraw/zinc/17/35/04/386173504.db2.gz UZXROZXJFHGLLS-GFCCVEGCSA-N 1 2 235.331 2.064 20 0 BEADLO CCCCCNC(=O)C[N@H+](C)Cc1ccco1 ZINC000263785603 386175155 /nfs/dbraw/zinc/17/51/55/386175155.db2.gz HNEYUWSIJINAEE-UHFFFAOYSA-N 1 2 238.331 2.018 20 0 BEADLO CCCCCNC(=O)C[N@@H+](C)Cc1ccco1 ZINC000263785603 386175160 /nfs/dbraw/zinc/17/51/60/386175160.db2.gz HNEYUWSIJINAEE-UHFFFAOYSA-N 1 2 238.331 2.018 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@H](C)OC[C@H]2CC)cn1 ZINC000414372618 386175577 /nfs/dbraw/zinc/17/55/77/386175577.db2.gz PXTCMZBAWFEZRD-WCQYABFASA-N 1 2 249.358 2.038 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@H](C)OC[C@H]2CC)cn1 ZINC000414372618 386175580 /nfs/dbraw/zinc/17/55/80/386175580.db2.gz PXTCMZBAWFEZRD-WCQYABFASA-N 1 2 249.358 2.038 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)C[C@H]1C=CCCC1 ZINC000275124460 386182184 /nfs/dbraw/zinc/18/21/84/386182184.db2.gz WKTPLSSMYGQLIM-LBPRGKRZSA-N 1 2 247.342 2.125 20 0 BEADLO CC(=O)c1cccc(C[N@H+]2C[C@H](C)OC[C@@H]2C)c1 ZINC000296586819 386187424 /nfs/dbraw/zinc/18/74/24/386187424.db2.gz ROBPQYUQZXWMRL-RYUDHWBXSA-N 1 2 247.338 2.498 20 0 BEADLO CC(=O)c1cccc(C[N@@H+]2C[C@H](C)OC[C@@H]2C)c1 ZINC000296586819 386187428 /nfs/dbraw/zinc/18/74/28/386187428.db2.gz ROBPQYUQZXWMRL-RYUDHWBXSA-N 1 2 247.338 2.498 20 0 BEADLO Cc1csc(C2(NCc3[nH]cc[nH+]3)CCC2)n1 ZINC000263891119 386187751 /nfs/dbraw/zinc/18/77/51/386187751.db2.gz NAUWUSDYFDIWML-UHFFFAOYSA-N 1 2 248.355 2.344 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)NCCC1CCCCC1 ZINC000287493880 386128434 /nfs/dbraw/zinc/12/84/34/386128434.db2.gz ZUDXCXCSHRAQCF-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO CCC1(CC)CCN(C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000287597373 386136688 /nfs/dbraw/zinc/13/66/88/386136688.db2.gz GUTBMIFGRRHNKN-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO CC(C)(O)C1C[NH+](Cc2c(F)cccc2F)C1 ZINC000297464656 386259446 /nfs/dbraw/zinc/25/94/46/386259446.db2.gz RVEQMKYDKSJDLU-UHFFFAOYSA-N 1 2 241.281 2.168 20 0 BEADLO CC(=O)c1ccc(C[N@H+]2CCO[C@@H](C)[C@H]2C)cc1 ZINC000296840629 386205924 /nfs/dbraw/zinc/20/59/24/386205924.db2.gz STEGSHWCUBNVBN-YPMHNXCESA-N 1 2 247.338 2.498 20 0 BEADLO CC(=O)c1ccc(C[N@@H+]2CCO[C@@H](C)[C@H]2C)cc1 ZINC000296840629 386205928 /nfs/dbraw/zinc/20/59/28/386205928.db2.gz STEGSHWCUBNVBN-YPMHNXCESA-N 1 2 247.338 2.498 20 0 BEADLO C[N@H+](Cc1cscn1)[C@H](CO)c1ccccc1 ZINC000264051037 386206471 /nfs/dbraw/zinc/20/64/71/386206471.db2.gz VFSYLQUKYBJNBW-CYBMUJFWSA-N 1 2 248.351 2.309 20 0 BEADLO C[N@@H+](Cc1cscn1)[C@H](CO)c1ccccc1 ZINC000264051037 386206475 /nfs/dbraw/zinc/20/64/75/386206475.db2.gz VFSYLQUKYBJNBW-CYBMUJFWSA-N 1 2 248.351 2.309 20 0 BEADLO c1cncc(C[NH2+]Cc2noc3c2CCCC3)c1 ZINC000288484875 386206880 /nfs/dbraw/zinc/20/68/80/386206880.db2.gz QEFNDGBMNLFCEH-UHFFFAOYSA-N 1 2 243.310 2.238 20 0 BEADLO CC[C@@H](CC(=O)NCc1[nH+]ccn1C)C(C)C ZINC000264200491 386214417 /nfs/dbraw/zinc/21/44/17/386214417.db2.gz POOOLWHRMHMWHN-NSHDSACASA-N 1 2 237.347 2.109 20 0 BEADLO C[C@H](NCc1cccc2[nH+]ccn21)C(F)(F)F ZINC000288560994 386215741 /nfs/dbraw/zinc/21/57/41/386215741.db2.gz YPIAOMHAULRHGM-QMMMGPOBSA-N 1 2 243.232 2.375 20 0 BEADLO Cc1nc(C(C)(C)[NH2+]Cc2ccccc2)no1 ZINC000264290930 386224942 /nfs/dbraw/zinc/22/49/42/386224942.db2.gz HUHWNNMZWOMBCD-UHFFFAOYSA-N 1 2 231.299 2.403 20 0 BEADLO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1cc[nH]n1 ZINC000288649049 386225355 /nfs/dbraw/zinc/22/53/55/386225355.db2.gz UYYOFSIJSZCDQH-NOZJJQNGSA-N 1 2 229.283 2.022 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+]1CCc2n[nH]cc2C1 ZINC000275682230 386230762 /nfs/dbraw/zinc/23/07/62/386230762.db2.gz ZDZADOXBMNERJC-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1ccc(F)cc1C[N@H+]1CCc2n[nH]cc2C1 ZINC000275682230 386230764 /nfs/dbraw/zinc/23/07/64/386230764.db2.gz ZDZADOXBMNERJC-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO CC[C@@H]1CCC[C@@H]1CNC(=O)CCn1cc[nH+]c1 ZINC000452523543 386232938 /nfs/dbraw/zinc/23/29/38/386232938.db2.gz GGGLLQAQLURPSZ-CHWSQXEVSA-N 1 2 249.358 2.216 20 0 BEADLO CCc1ncc(C[N@H+](C)CCC(F)(F)F)cn1 ZINC000414384040 386234199 /nfs/dbraw/zinc/23/41/99/386234199.db2.gz TWMYXPLUYAXKMW-UHFFFAOYSA-N 1 2 247.264 2.423 20 0 BEADLO CCc1ncc(C[N@@H+](C)CCC(F)(F)F)cn1 ZINC000414384040 386234201 /nfs/dbraw/zinc/23/42/01/386234201.db2.gz TWMYXPLUYAXKMW-UHFFFAOYSA-N 1 2 247.264 2.423 20 0 BEADLO Cc1occc1CNc1ccc(N(C)C)c[nH+]1 ZINC000414386513 386236294 /nfs/dbraw/zinc/23/62/94/386236294.db2.gz YMKOMWWTCYXBTL-UHFFFAOYSA-N 1 2 231.299 2.083 20 0 BEADLO C[C@@H](C[N@H+](C)Cc1nnc[nH]1)c1ccc(F)cc1 ZINC000275745921 386236656 /nfs/dbraw/zinc/23/66/56/386236656.db2.gz RSUNCEUKUUVJTK-JTQLQIEISA-N 1 2 248.305 2.179 20 0 BEADLO C[C@@H](C[N@@H+](C)Cc1nnc[nH]1)c1ccc(F)cc1 ZINC000275745921 386236661 /nfs/dbraw/zinc/23/66/61/386236661.db2.gz RSUNCEUKUUVJTK-JTQLQIEISA-N 1 2 248.305 2.179 20 0 BEADLO CCc1cc(N2CCC2)nc(-c2ccncc2)[nH+]1 ZINC000264571592 386248690 /nfs/dbraw/zinc/24/86/90/386248690.db2.gz UXOBRNQBFNYEER-UHFFFAOYSA-N 1 2 240.310 2.311 20 0 BEADLO CC[C@H](CO)Nc1cc[nH+]c2c(OC)cccc12 ZINC000275893375 386248825 /nfs/dbraw/zinc/24/88/25/386248825.db2.gz YISZMRPDQMHHEG-SNVBAGLBSA-N 1 2 246.310 2.426 20 0 BEADLO CCCC[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000275901411 386250300 /nfs/dbraw/zinc/25/03/00/386250300.db2.gz VDSWNHQCNDLOKP-LBPRGKRZSA-N 1 2 230.315 2.284 20 0 BEADLO c1ccc(OC2CC2)c(C[NH+]2CCOCC2)c1 ZINC000289036811 386253396 /nfs/dbraw/zinc/25/33/96/386253396.db2.gz BGPVTWMIPCUXAG-UHFFFAOYSA-N 1 2 233.311 2.060 20 0 BEADLO CC[C@H](NC(=O)CCc1[nH]cc[nH+]1)[C@@H]1CC1(C)C ZINC000416279136 386255824 /nfs/dbraw/zinc/25/58/24/386255824.db2.gz SSZMTQUYBTUFSF-QWRGUYRKSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@H](NC(=O)c1c[nH+]c(C)[nH]1)[C@@H]1CC1(C)C ZINC000416280768 386255915 /nfs/dbraw/zinc/25/59/15/386255915.db2.gz ZJWOVAVVIKKYIG-UWVGGRQHSA-N 1 2 235.331 2.273 20 0 BEADLO CC(C)(O)C1C[NH+](Cc2cc(F)ccc2F)C1 ZINC000297461477 386256212 /nfs/dbraw/zinc/25/62/12/386256212.db2.gz RPBVSALURZNDMP-UHFFFAOYSA-N 1 2 241.281 2.168 20 0 BEADLO CCOC(=O)C(C)(C)[N@H+](C)Cc1ccoc1C ZINC000414390427 386256836 /nfs/dbraw/zinc/25/68/36/386256836.db2.gz XDZKEZAOHGBHBD-UHFFFAOYSA-N 1 2 239.315 2.362 20 0 BEADLO CCOC(=O)C(C)(C)[N@@H+](C)Cc1ccoc1C ZINC000414390427 386256841 /nfs/dbraw/zinc/25/68/41/386256841.db2.gz XDZKEZAOHGBHBD-UHFFFAOYSA-N 1 2 239.315 2.362 20 0 BEADLO CCc1ncc(C[N@@H+]2CCOC(C)(C)[C@H]2C)cn1 ZINC000414390688 386257071 /nfs/dbraw/zinc/25/70/71/386257071.db2.gz AROMIJUQASVLKN-LLVKDONJSA-N 1 2 249.358 2.038 20 0 BEADLO CCc1ncc(C[N@H+]2CCOC(C)(C)[C@H]2C)cn1 ZINC000414390688 386257077 /nfs/dbraw/zinc/25/70/77/386257077.db2.gz AROMIJUQASVLKN-LLVKDONJSA-N 1 2 249.358 2.038 20 0 BEADLO CCOc1cccc(C[NH+]2CC(OCC)C2)c1 ZINC000297435556 386257865 /nfs/dbraw/zinc/25/78/65/386257865.db2.gz NTHALXQFJGWPET-UHFFFAOYSA-N 1 2 235.327 2.306 20 0 BEADLO c1cnn(CSc2[nH+]cc3ccccn32)c1 ZINC000339117110 386257928 /nfs/dbraw/zinc/25/79/28/386257928.db2.gz BGGCJUWAFLKVIK-UHFFFAOYSA-N 1 2 230.296 2.281 20 0 BEADLO CC(C)Cn1nccc1C[NH+]1CCSCC1 ZINC000648000772 386192796 /nfs/dbraw/zinc/19/27/96/386192796.db2.gz BNBDUABTAHJCDH-UHFFFAOYSA-N 1 2 239.388 2.088 20 0 BEADLO CC(C)=CC(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000263938802 386194039 /nfs/dbraw/zinc/19/40/39/386194039.db2.gz IDPAOGCNZOJUET-LLVKDONJSA-N 1 2 233.315 2.082 20 0 BEADLO C[C@@H]([NH2+]Cc1cocn1)c1ccc2n[nH]cc2c1 ZINC000353114662 386194807 /nfs/dbraw/zinc/19/48/07/386194807.db2.gz WHGNSJSWMCEXII-SECBINFHSA-N 1 2 242.282 2.402 20 0 BEADLO COc1ncncc1C[N@H+](C)[C@@H](C)c1ccco1 ZINC000648001275 386199268 /nfs/dbraw/zinc/19/92/68/386199268.db2.gz FLNKFELZYVPEAF-JTQLQIEISA-N 1 2 247.298 2.271 20 0 BEADLO COc1ncncc1C[N@@H+](C)[C@@H](C)c1ccco1 ZINC000648001275 386199272 /nfs/dbraw/zinc/19/92/72/386199272.db2.gz FLNKFELZYVPEAF-JTQLQIEISA-N 1 2 247.298 2.271 20 0 BEADLO Cc1cnn(C)c1C[NH+]1Cc2ccccc2C1 ZINC000289328516 386285717 /nfs/dbraw/zinc/28/57/17/386285717.db2.gz KSWMZJXFPNSCGG-UHFFFAOYSA-N 1 2 227.311 2.244 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cnns2)cc1 ZINC000289354333 386289712 /nfs/dbraw/zinc/28/97/12/386289712.db2.gz NIIAGMXDWDJOMR-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cnns2)cc1 ZINC000289354333 386289720 /nfs/dbraw/zinc/28/97/20/386289720.db2.gz NIIAGMXDWDJOMR-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CC(C)[C@H](C)C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000264968033 386290339 /nfs/dbraw/zinc/29/03/39/386290339.db2.gz GHMGIAWGHCMDBS-NWDGAFQWSA-N 1 2 249.358 2.408 20 0 BEADLO C[C@H]([NH2+][C@@H]1/C=C/CCCCC1)c1ncn(C)n1 ZINC000334480536 386295102 /nfs/dbraw/zinc/29/51/02/386295102.db2.gz VDKZOMHBZJFHBX-TXBNAWBVSA-N 1 2 234.347 2.355 20 0 BEADLO COc1cnccc1[C@@H](C)[NH2+]Cc1cc(C)on1 ZINC000187068135 386295321 /nfs/dbraw/zinc/29/53/21/386295321.db2.gz WNKIVVUKCLIMSF-SNVBAGLBSA-N 1 2 247.298 2.237 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@@H]2CC[C@@H](C)O2)cs1 ZINC000336667653 386295413 /nfs/dbraw/zinc/29/54/13/386295413.db2.gz MPCMMISPRXNHOX-SKDRFNHKSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@@H]2CC[C@@H](C)O2)cs1 ZINC000336667653 386295420 /nfs/dbraw/zinc/29/54/20/386295420.db2.gz MPCMMISPRXNHOX-SKDRFNHKSA-N 1 2 240.372 2.451 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2ccc(F)cn2)CCO1 ZINC000276282735 386296111 /nfs/dbraw/zinc/29/61/11/386296111.db2.gz UKUJABLRQCMILR-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2ccc(F)cn2)CCO1 ZINC000276282735 386296117 /nfs/dbraw/zinc/29/61/17/386296117.db2.gz UKUJABLRQCMILR-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO Cc1nonc1C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000265017898 386296506 /nfs/dbraw/zinc/29/65/06/386296506.db2.gz IKNDKBUOKQYOEA-GFCCVEGCSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1nonc1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000265017898 386296512 /nfs/dbraw/zinc/29/65/12/386296512.db2.gz IKNDKBUOKQYOEA-GFCCVEGCSA-N 1 2 232.287 2.043 20 0 BEADLO CCn1c[nH+]cc1CNc1ccc(SC)cn1 ZINC000416426948 386303551 /nfs/dbraw/zinc/30/35/51/386303551.db2.gz NZDHYFPBYKFXCE-UHFFFAOYSA-N 1 2 248.355 2.054 20 0 BEADLO CCn1c[nH+]cc1CNc1cc(C)cnc1OC ZINC000416427926 386304014 /nfs/dbraw/zinc/30/40/14/386304014.db2.gz RMRLGFFIVBWCQR-UHFFFAOYSA-N 1 2 246.314 2.227 20 0 BEADLO Cc1cn[nH]c1C[NH2+]C(C)(C)c1c(C)noc1C ZINC000289445965 386308687 /nfs/dbraw/zinc/30/86/87/386308687.db2.gz BDHMDJGSYSDKOA-UHFFFAOYSA-N 1 2 248.330 2.348 20 0 BEADLO Cc1c[nH]nc1C[NH2+]C(C)(C)c1c(C)noc1C ZINC000289445965 386308692 /nfs/dbraw/zinc/30/86/92/386308692.db2.gz BDHMDJGSYSDKOA-UHFFFAOYSA-N 1 2 248.330 2.348 20 0 BEADLO CC[C@@H](F)C[N@H+](CCOC)Cc1ccccn1 ZINC000347276038 386312658 /nfs/dbraw/zinc/31/26/58/386312658.db2.gz QQXGBVBQECMFBB-GFCCVEGCSA-N 1 2 240.322 2.278 20 0 BEADLO CC[C@@H](F)C[N@@H+](CCOC)Cc1ccccn1 ZINC000347276038 386312663 /nfs/dbraw/zinc/31/26/63/386312663.db2.gz QQXGBVBQECMFBB-GFCCVEGCSA-N 1 2 240.322 2.278 20 0 BEADLO CCCCN(CCOC)c1cc(C)[nH+]cn1 ZINC000347278051 386315291 /nfs/dbraw/zinc/31/52/91/386315291.db2.gz DCQNTLNLZLDNLS-UHFFFAOYSA-N 1 2 223.320 2.038 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)CCC1CC1 ZINC000265181501 386316462 /nfs/dbraw/zinc/31/64/62/386316462.db2.gz KVJYHYKJOGFGTE-UHFFFAOYSA-N 1 2 233.315 2.276 20 0 BEADLO c1snnc1C[N@@H+]1CC[C@@H]1Cc1ccccc1 ZINC000336678407 386318876 /nfs/dbraw/zinc/31/88/76/386318876.db2.gz AOBGUDZWJMTKMM-CYBMUJFWSA-N 1 2 245.351 2.355 20 0 BEADLO c1snnc1C[N@H+]1CC[C@@H]1Cc1ccccc1 ZINC000336678407 386318881 /nfs/dbraw/zinc/31/88/81/386318881.db2.gz AOBGUDZWJMTKMM-CYBMUJFWSA-N 1 2 245.351 2.355 20 0 BEADLO C[C@@H](C(=O)NCCNc1cccc[nH+]1)C(C)(C)C ZINC000265212555 386319755 /nfs/dbraw/zinc/31/97/55/386319755.db2.gz UXVKCZLSHRNLGB-NSHDSACASA-N 1 2 249.358 2.292 20 0 BEADLO Cc1cc(CNC(=O)N2CC(C)(C)C2)cc(C)[nH+]1 ZINC000643384226 386320601 /nfs/dbraw/zinc/32/06/01/386320601.db2.gz GRBIWEVOVSIKRG-UHFFFAOYSA-N 1 2 247.342 2.250 20 0 BEADLO CC(C)(C)c1noc(COc2cc[nH+]cc2)n1 ZINC000276436089 386321712 /nfs/dbraw/zinc/32/17/12/386321712.db2.gz JNQUORGQKCMDQK-UHFFFAOYSA-N 1 2 233.271 2.341 20 0 BEADLO CCc1ccc(C[N@H+](C)Cc2ccnn2C)nc1 ZINC000339142526 386262029 /nfs/dbraw/zinc/26/20/29/386262029.db2.gz OJLJTUXGRJOQAF-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO CCc1ccc(C[N@@H+](C)Cc2ccnn2C)nc1 ZINC000339142526 386262032 /nfs/dbraw/zinc/26/20/32/386262032.db2.gz OJLJTUXGRJOQAF-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO CC[C@H](CSC)[N@H+](C)Cc1csnn1 ZINC000336650172 386263695 /nfs/dbraw/zinc/26/36/95/386263695.db2.gz ACJFWHPKRACGQX-SECBINFHSA-N 1 2 231.390 2.112 20 0 BEADLO CC[C@H](CSC)[N@@H+](C)Cc1csnn1 ZINC000336650172 386263697 /nfs/dbraw/zinc/26/36/97/386263697.db2.gz ACJFWHPKRACGQX-SECBINFHSA-N 1 2 231.390 2.112 20 0 BEADLO CC[C@@H](C)C(=O)NCc1cn2cccc(C)c2[nH+]1 ZINC000264791799 386271516 /nfs/dbraw/zinc/27/15/16/386271516.db2.gz XSZREHUOEZVNOX-SNVBAGLBSA-N 1 2 245.326 2.305 20 0 BEADLO CC/C=C/CNC(=O)Nc1cc[nH+]c(C)c1 ZINC000297664198 386272840 /nfs/dbraw/zinc/27/28/40/386272840.db2.gz FLEUWLQCWIHYAJ-SNAWJCMRSA-N 1 2 219.288 2.478 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cncc(F)c2)[C@H](C)[C@H](C)O1 ZINC000347181066 386273178 /nfs/dbraw/zinc/27/31/78/386273178.db2.gz JTVDTSWPNZCXTD-MXWKQRLJSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cncc(F)c2)[C@H](C)[C@H](C)O1 ZINC000347181066 386273180 /nfs/dbraw/zinc/27/31/80/386273180.db2.gz JTVDTSWPNZCXTD-MXWKQRLJSA-N 1 2 238.306 2.218 20 0 BEADLO CCC1(NC(=O)Nc2cc[nH+]cc2C)CC1 ZINC000297739587 386276550 /nfs/dbraw/zinc/27/65/50/386276550.db2.gz KXCXFRCOAWTYCT-UHFFFAOYSA-N 1 2 219.288 2.454 20 0 BEADLO CCOc1nnc(C[N@@H+]2CC[C@H](C)[C@@H]2C)s1 ZINC000336659581 386276935 /nfs/dbraw/zinc/27/69/35/386276935.db2.gz ADAIPPBRZIWPSQ-IUCAKERBSA-N 1 2 241.360 2.167 20 0 BEADLO CCOc1nnc(C[N@H+]2CC[C@H](C)[C@@H]2C)s1 ZINC000336659581 386276936 /nfs/dbraw/zinc/27/69/36/386276936.db2.gz ADAIPPBRZIWPSQ-IUCAKERBSA-N 1 2 241.360 2.167 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@H]2CCCC[C@@H]2C)c[nH+]1 ZINC000264864158 386278811 /nfs/dbraw/zinc/27/88/11/386278811.db2.gz PYWSSWJRPBNLGS-GXSJLCMTSA-N 1 2 235.331 2.274 20 0 BEADLO CC[C@@H](C)CC(=O)NCc1cn2ccccc2[nH+]1 ZINC000276539179 386341676 /nfs/dbraw/zinc/34/16/76/386341676.db2.gz DTCZOXCRVKCEKF-LLVKDONJSA-N 1 2 245.326 2.387 20 0 BEADLO CCOc1nnc(C[N@@H+]2CC[C@@H](CC)C2)s1 ZINC000336683144 386343246 /nfs/dbraw/zinc/34/32/46/386343246.db2.gz SMDIYUMLKICQRH-SECBINFHSA-N 1 2 241.360 2.169 20 0 BEADLO CCOc1nnc(C[N@H+]2CC[C@@H](CC)C2)s1 ZINC000336683144 386343252 /nfs/dbraw/zinc/34/32/52/386343252.db2.gz SMDIYUMLKICQRH-SECBINFHSA-N 1 2 241.360 2.169 20 0 BEADLO Cc1[nH+]cccc1Cc1nc([C@H]2C[C@H]2C)no1 ZINC000334491681 386347899 /nfs/dbraw/zinc/34/78/99/386347899.db2.gz JIYBESACRWDCRA-KCJUWKMLSA-N 1 2 229.283 2.487 20 0 BEADLO Cc1ccc([C@H](C)[N@H+](C)Cc2cnn(C)n2)cc1 ZINC000290054315 386386460 /nfs/dbraw/zinc/38/64/60/386386460.db2.gz SAMYCHPQLDPHRM-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2cnn(C)n2)cc1 ZINC000290054315 386386464 /nfs/dbraw/zinc/38/64/64/386386464.db2.gz SAMYCHPQLDPHRM-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C(F)(F)C(F)F ZINC000226641743 386350851 /nfs/dbraw/zinc/35/08/51/386350851.db2.gz OZTMTEVNSZMWNI-UHFFFAOYSA-N 1 2 236.168 2.229 20 0 BEADLO CC[N@H+](CCOC)Cc1ncc(C(C)(C)C)o1 ZINC000336688390 386352346 /nfs/dbraw/zinc/35/23/46/386352346.db2.gz HDJSTQBPMMWOGP-UHFFFAOYSA-N 1 2 240.347 2.440 20 0 BEADLO CC[N@@H+](CCOC)Cc1ncc(C(C)(C)C)o1 ZINC000336688390 386352351 /nfs/dbraw/zinc/35/23/51/386352351.db2.gz HDJSTQBPMMWOGP-UHFFFAOYSA-N 1 2 240.347 2.440 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1ccc2occc2c1 ZINC000289777452 386354257 /nfs/dbraw/zinc/35/42/57/386354257.db2.gz REEXJQDLBRGKCO-JTQLQIEISA-N 1 2 247.294 2.426 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1ccc2occc2c1 ZINC000289777452 386354259 /nfs/dbraw/zinc/35/42/59/386354259.db2.gz REEXJQDLBRGKCO-JTQLQIEISA-N 1 2 247.294 2.426 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2ccc(F)cn2)C1 ZINC000334493534 386359948 /nfs/dbraw/zinc/35/99/48/386359948.db2.gz DNNUZORRRRNKRV-NSHDSACASA-N 1 2 212.243 2.155 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2ccc(F)cn2)C1 ZINC000334493534 386359956 /nfs/dbraw/zinc/35/99/56/386359956.db2.gz DNNUZORRRRNKRV-NSHDSACASA-N 1 2 212.243 2.155 20 0 BEADLO Cc1cnc(C[N@@H+](C)[C@H](C)c2ccccn2)cn1 ZINC000336692458 386362714 /nfs/dbraw/zinc/36/27/14/386362714.db2.gz CSLPILTYRDLKQC-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cnc(C[N@H+](C)[C@H](C)c2ccccn2)cn1 ZINC000336692458 386362718 /nfs/dbraw/zinc/36/27/18/386362718.db2.gz CSLPILTYRDLKQC-GFCCVEGCSA-N 1 2 242.326 2.373 20 0 BEADLO Fc1cc(F)cc(CN2CCc3[nH+]c[nH]c3C2)c1 ZINC000647933536 386366065 /nfs/dbraw/zinc/36/60/65/386366065.db2.gz SDIJAMSHLNPPMF-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO Cc1occc1C[N@@H+](C)[C@@H](C)C(=O)OC(C)C ZINC000414419534 386366869 /nfs/dbraw/zinc/36/68/69/386366869.db2.gz ZUNZZXVBUITEHE-JTQLQIEISA-N 1 2 239.315 2.360 20 0 BEADLO Cc1occc1C[N@H+](C)[C@@H](C)C(=O)OC(C)C ZINC000414419534 386366873 /nfs/dbraw/zinc/36/68/73/386366873.db2.gz ZUNZZXVBUITEHE-JTQLQIEISA-N 1 2 239.315 2.360 20 0 BEADLO Cc1ccc(F)cc1C[NH2+][C@H](C)c1ncnn1C ZINC000276707634 386368697 /nfs/dbraw/zinc/36/86/97/386368697.db2.gz OMJUHXLZVNSTSZ-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO CCCc1nc(C[N@@H+]2C[C@@H](C)C[C@@H]2C)no1 ZINC000336690345 386370204 /nfs/dbraw/zinc/37/02/04/386370204.db2.gz AUHQGUKYCWSVRN-UWVGGRQHSA-N 1 2 223.320 2.252 20 0 BEADLO CCCc1nc(C[N@H+]2C[C@@H](C)C[C@@H]2C)no1 ZINC000336690345 386370210 /nfs/dbraw/zinc/37/02/10/386370210.db2.gz AUHQGUKYCWSVRN-UWVGGRQHSA-N 1 2 223.320 2.252 20 0 BEADLO CC(C)(C)CCC(=O)NCCNc1cccc[nH+]1 ZINC000265822713 386376498 /nfs/dbraw/zinc/37/64/98/386376498.db2.gz SDDQWRABRGEUNF-UHFFFAOYSA-N 1 2 249.358 2.436 20 0 BEADLO Cc1cc(C)c(C[NH2+][C@]2(C)CCOC2=O)cc1C ZINC000289960466 386377085 /nfs/dbraw/zinc/37/70/85/386377085.db2.gz YEZUAUBFMPEPIZ-OAHLLOKOSA-N 1 2 247.338 2.407 20 0 BEADLO Cc1ccc(C[N@@H+]2CCOC[C@@H]2CC(F)F)o1 ZINC000289972859 386378987 /nfs/dbraw/zinc/37/89/87/386378987.db2.gz ZMLIPPZDHNIXDQ-JTQLQIEISA-N 1 2 245.269 2.444 20 0 BEADLO Cc1ccc(C[N@H+]2CCOC[C@@H]2CC(F)F)o1 ZINC000289972859 386378994 /nfs/dbraw/zinc/37/89/94/386378994.db2.gz ZMLIPPZDHNIXDQ-JTQLQIEISA-N 1 2 245.269 2.444 20 0 BEADLO O=C1OCC[C@@H]1[N@@H+]1CCC[C@H]1c1ccsc1 ZINC000298737208 386379265 /nfs/dbraw/zinc/37/92/65/386379265.db2.gz IWGOMGDTFNTYNL-QWRGUYRKSA-N 1 2 237.324 2.201 20 0 BEADLO O=C1OCC[C@@H]1[N@H+]1CCC[C@H]1c1ccsc1 ZINC000298737208 386379269 /nfs/dbraw/zinc/37/92/69/386379269.db2.gz IWGOMGDTFNTYNL-QWRGUYRKSA-N 1 2 237.324 2.201 20 0 BEADLO c1cc2c(nc[nH+]c2SC[C@@H]2CCCO2)[nH]1 ZINC000276859440 386382991 /nfs/dbraw/zinc/38/29/91/386382991.db2.gz GEKGLFQRWGQENC-QMMMGPOBSA-N 1 2 235.312 2.229 20 0 BEADLO CCCC(=O)N[C@H](c1[nH]cc[nH+]1)C(C)C ZINC000276446228 386325815 /nfs/dbraw/zinc/32/58/15/386325815.db2.gz AJKBJUBMWUCPCN-JTQLQIEISA-N 1 2 209.293 2.023 20 0 BEADLO COC(=O)c1ccc(CNc2ccc(C)[nH+]c2)[nH]1 ZINC000164815800 386326374 /nfs/dbraw/zinc/32/63/74/386326374.db2.gz XAQQBYKWZVFXGN-UHFFFAOYSA-N 1 2 245.282 2.117 20 0 BEADLO O=C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ncc(C2CC2)o1 ZINC000289596567 386331848 /nfs/dbraw/zinc/33/18/48/386331848.db2.gz SQJZSHSDGCXHLC-PHIMTYICSA-N 1 2 246.310 2.248 20 0 BEADLO O=C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ncc(C2CC2)o1 ZINC000289596567 386331858 /nfs/dbraw/zinc/33/18/58/386331858.db2.gz SQJZSHSDGCXHLC-PHIMTYICSA-N 1 2 246.310 2.248 20 0 BEADLO Cc1ccc(C[NH2+][C@]2(C)CCOC2=O)cc1C ZINC000289602621 386332364 /nfs/dbraw/zinc/33/23/64/386332364.db2.gz QKNHGFOFRFRINW-CQSZACIVSA-N 1 2 233.311 2.099 20 0 BEADLO CC(C)c1nc(NC[C@@H]2C[C@H]2C)cc[nH+]1 ZINC000336773776 386333118 /nfs/dbraw/zinc/33/31/18/386333118.db2.gz ZCPUOJGCNGWLKE-ZJUUUORDSA-N 1 2 205.305 2.090 20 0 BEADLO CC[C@@H](C)C[NH2+][C@H](Cc1ccccc1)C(=O)OC ZINC000276493663 386333595 /nfs/dbraw/zinc/33/35/95/386333595.db2.gz QMMOVPDDAZYCNY-TZMCWYRMSA-N 1 2 249.354 2.406 20 0 BEADLO CC[N@H+](CCOC)Cc1ncc(Cl)s1 ZINC000347341480 386337848 /nfs/dbraw/zinc/33/78/48/386337848.db2.gz OUPGQNVLAMQNAK-UHFFFAOYSA-N 1 2 234.752 2.265 20 0 BEADLO CC[N@@H+](CCOC)Cc1ncc(Cl)s1 ZINC000347341480 386337853 /nfs/dbraw/zinc/33/78/53/386337853.db2.gz OUPGQNVLAMQNAK-UHFFFAOYSA-N 1 2 234.752 2.265 20 0 BEADLO Cc1nnsc1C(=O)Nc1ccc(C)[nH+]c1C ZINC000277560357 386447586 /nfs/dbraw/zinc/44/75/86/386447586.db2.gz NQDSDMVNAHEPKT-UHFFFAOYSA-N 1 2 248.311 2.111 20 0 BEADLO COC(=O)C[N@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC000265981515 386388958 /nfs/dbraw/zinc/38/89/58/386388958.db2.gz FKCNTAFHRICVJA-NSHDSACASA-N 1 2 233.311 2.385 20 0 BEADLO COC(=O)C[N@@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC000265981515 386388964 /nfs/dbraw/zinc/38/89/64/386388964.db2.gz FKCNTAFHRICVJA-NSHDSACASA-N 1 2 233.311 2.385 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cc(C)n(C)n2)o1 ZINC000336703565 386389300 /nfs/dbraw/zinc/38/93/00/386389300.db2.gz MRJGQLJNLOHRES-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cc(C)n(C)n2)o1 ZINC000336703565 386389305 /nfs/dbraw/zinc/38/93/05/386389305.db2.gz MRJGQLJNLOHRES-UHFFFAOYSA-N 1 2 233.315 2.262 20 0 BEADLO CCCC(=O)Nc1cccc2[nH+]ccn21 ZINC000266007053 386390000 /nfs/dbraw/zinc/39/00/00/386390000.db2.gz AFEWKLVUNMMNKG-UHFFFAOYSA-N 1 2 203.245 2.073 20 0 BEADLO c1cc2c(o1)CCC[N@@H+](Cc1cocn1)C2 ZINC000290093395 386393706 /nfs/dbraw/zinc/39/37/06/386393706.db2.gz HFDWTRBNBYFKLL-UHFFFAOYSA-N 1 2 218.256 2.216 20 0 BEADLO c1cc2c(o1)CCC[N@H+](Cc1cocn1)C2 ZINC000290093395 386393710 /nfs/dbraw/zinc/39/37/10/386393710.db2.gz HFDWTRBNBYFKLL-UHFFFAOYSA-N 1 2 218.256 2.216 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H]2CCC[C@@H](C)CC2)c[nH+]1 ZINC000276969490 386396795 /nfs/dbraw/zinc/39/67/95/386396795.db2.gz TWIQVTHFKKCTNH-KOLCDFICSA-N 1 2 235.331 2.417 20 0 BEADLO CCCCOCC(=O)Nc1cccc2[nH+]ccn21 ZINC000266163201 386405959 /nfs/dbraw/zinc/40/59/59/386405959.db2.gz XJYQAPVFOBRREI-UHFFFAOYSA-N 1 2 247.298 2.090 20 0 BEADLO CO[C@@H]1CC[N@H+](Cc2csc(C3CC3)n2)C1 ZINC000336702934 386407536 /nfs/dbraw/zinc/40/75/36/386407536.db2.gz OHGVBTNATBFAJF-LLVKDONJSA-N 1 2 238.356 2.241 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2csc(C3CC3)n2)C1 ZINC000336702934 386407543 /nfs/dbraw/zinc/40/75/43/386407543.db2.gz OHGVBTNATBFAJF-LLVKDONJSA-N 1 2 238.356 2.241 20 0 BEADLO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1csnn1 ZINC000290200861 386408073 /nfs/dbraw/zinc/40/80/73/386408073.db2.gz PPCBFLVAZZKXSM-UFBFGSQYSA-N 1 2 247.323 2.150 20 0 BEADLO Cc1nc(C)c(C[N@H+](C)Cc2cc[nH]n2)s1 ZINC000336707215 386410460 /nfs/dbraw/zinc/41/04/60/386410460.db2.gz SGDBMLXANYIECP-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1nc(C)c(C[N@@H+](C)Cc2cc[nH]n2)s1 ZINC000336707215 386410463 /nfs/dbraw/zinc/41/04/63/386410463.db2.gz SGDBMLXANYIECP-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO c1cc(N[C@@H]2CC[C@H]3C[C@H]3C2)nc(C2CC2)[nH+]1 ZINC000645400395 386412979 /nfs/dbraw/zinc/41/29/79/386412979.db2.gz OUXXSCDZAWCEHS-SDDRHHMPSA-N 1 2 229.327 2.376 20 0 BEADLO CCOc1nnc(C[NH+]2[C@@H](C)CC[C@@H]2C)s1 ZINC000336707693 386414361 /nfs/dbraw/zinc/41/43/61/386414361.db2.gz TZKGFCZTOSTCKD-IUCAKERBSA-N 1 2 241.360 2.310 20 0 BEADLO CCC=CC[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000453323896 386416818 /nfs/dbraw/zinc/41/68/18/386416818.db2.gz QHOXJJDUXOWBPZ-QTEJZOKPSA-N 1 2 242.326 2.450 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)C=C1CCCCC1 ZINC000299134401 386418399 /nfs/dbraw/zinc/41/83/99/386418399.db2.gz FKDAOENJYPQLSQ-UHFFFAOYSA-N 1 2 247.342 2.269 20 0 BEADLO Cc1csc([C@H](C)[NH2+]Cc2[nH]ncc2C)n1 ZINC000336777282 386419954 /nfs/dbraw/zinc/41/99/54/386419954.db2.gz HYXGCPWNPLUIJD-VIFPVBQESA-N 1 2 236.344 2.334 20 0 BEADLO Cc1csc([C@H](C)[NH2+]Cc2n[nH]cc2C)n1 ZINC000336777282 386419957 /nfs/dbraw/zinc/41/99/57/386419957.db2.gz HYXGCPWNPLUIJD-VIFPVBQESA-N 1 2 236.344 2.334 20 0 BEADLO Cc1nc(N(C)[C@H](C)c2cccnc2)cc[nH+]1 ZINC000266317056 386425575 /nfs/dbraw/zinc/42/55/75/386425575.db2.gz FEEJDAUMEUDKQP-SNVBAGLBSA-N 1 2 228.299 2.377 20 0 BEADLO CC1(C)C[C@@H]1Nc1cc(N2CCCC2)nc[nH+]1 ZINC000277629138 386452225 /nfs/dbraw/zinc/45/22/25/386452225.db2.gz WXLUYTGGCYYEHC-JTQLQIEISA-N 1 2 232.331 2.287 20 0 BEADLO CC1(C)C[C@@H]1Nc1cc(N2CCCC2)[nH+]cn1 ZINC000277629138 386452234 /nfs/dbraw/zinc/45/22/34/386452234.db2.gz WXLUYTGGCYYEHC-JTQLQIEISA-N 1 2 232.331 2.287 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)Cc1ccc(O)cc1 ZINC000290409465 386428906 /nfs/dbraw/zinc/42/89/06/386428906.db2.gz JYVABYOMFRRLMV-UHFFFAOYSA-N 1 2 231.299 2.056 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)Cc1ccc(O)cc1 ZINC000290409465 386428908 /nfs/dbraw/zinc/42/89/08/386428908.db2.gz JYVABYOMFRRLMV-UHFFFAOYSA-N 1 2 231.299 2.056 20 0 BEADLO Cc1nc(N2CCC[C@@H]2C(C)C)cc[nH+]1 ZINC000266335113 386429186 /nfs/dbraw/zinc/42/91/86/386429186.db2.gz HNMWMZHEIIOWIA-LLVKDONJSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1C[C@H](C)[C@H](C)[C@H]1C ZINC000416963164 386430497 /nfs/dbraw/zinc/43/04/97/386430497.db2.gz VHMIAVDEIXFKJL-SDDRHHMPSA-N 1 2 247.342 2.320 20 0 BEADLO CC[S@@](=O)Cc1[nH+]ccn1-c1ccccc1 ZINC000277426749 386433544 /nfs/dbraw/zinc/43/35/44/386433544.db2.gz FWFQUQCZXGYZIF-MRXNPFEDSA-N 1 2 234.324 2.141 20 0 BEADLO Cc1occc1C[N@@H+]1CCOC[C@@H]1CC(F)F ZINC000414432750 386434612 /nfs/dbraw/zinc/43/46/12/386434612.db2.gz AETALSAOKGXENJ-NSHDSACASA-N 1 2 245.269 2.444 20 0 BEADLO Cc1occc1C[N@H+]1CCOC[C@@H]1CC(F)F ZINC000414432750 386434615 /nfs/dbraw/zinc/43/46/15/386434615.db2.gz AETALSAOKGXENJ-NSHDSACASA-N 1 2 245.269 2.444 20 0 BEADLO Cc1nc(N(C)CCc2ccccc2)cc[nH+]1 ZINC000266435826 386436502 /nfs/dbraw/zinc/43/65/02/386436502.db2.gz VFDAAVGJIUFDIH-UHFFFAOYSA-N 1 2 227.311 2.464 20 0 BEADLO CCOc1cccc(C[N@H+](C)Cc2cc[nH]n2)c1 ZINC000353527727 386466867 /nfs/dbraw/zinc/46/68/67/386466867.db2.gz LYHAUANFYLNZIE-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO CCOc1cccc(C[N@@H+](C)Cc2cc[nH]n2)c1 ZINC000353527727 386466873 /nfs/dbraw/zinc/46/68/73/386466873.db2.gz LYHAUANFYLNZIE-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO COCc1nc(C[N@@H+]2C[C@H](C)[C@@H]2C)cs1 ZINC000339574022 386471918 /nfs/dbraw/zinc/47/19/18/386471918.db2.gz OWDHOJXPDSVHOZ-IUCAKERBSA-N 1 2 226.345 2.130 20 0 BEADLO COCc1nc(C[N@H+]2C[C@H](C)[C@@H]2C)cs1 ZINC000339574022 386471921 /nfs/dbraw/zinc/47/19/21/386471921.db2.gz OWDHOJXPDSVHOZ-IUCAKERBSA-N 1 2 226.345 2.130 20 0 BEADLO Cc1cc(N2C[C@@H](O)CC[C@@H]2C)nc(C(C)C)[nH+]1 ZINC000399268022 386472861 /nfs/dbraw/zinc/47/28/61/386472861.db2.gz SMRFCNWIWROLCO-RYUDHWBXSA-N 1 2 249.358 2.258 20 0 BEADLO C[N@H+](CCF)Cc1ccc(F)cc1F ZINC000266875010 386476372 /nfs/dbraw/zinc/47/63/72/386476372.db2.gz LYRCMKBHVQOLSS-UHFFFAOYSA-N 1 2 203.207 2.366 20 0 BEADLO C[N@@H+](CCF)Cc1ccc(F)cc1F ZINC000266875010 386476375 /nfs/dbraw/zinc/47/63/75/386476375.db2.gz LYRCMKBHVQOLSS-UHFFFAOYSA-N 1 2 203.207 2.366 20 0 BEADLO CNc1[nH+]cnc2c1cnn2CC1=CCCCC1 ZINC000519533229 386478610 /nfs/dbraw/zinc/47/86/10/386478610.db2.gz XOWUEJWZPLGPCA-UHFFFAOYSA-N 1 2 243.314 2.368 20 0 BEADLO CC(C)c1nc(N[C@@H]2C[C@H]3C[C@H]3C2)cc[nH+]1 ZINC000425303033 386528892 /nfs/dbraw/zinc/52/88/92/386528892.db2.gz ODUCDQDYIMUIEO-JGPRNRPPSA-N 1 2 217.316 2.232 20 0 BEADLO CC[C@](C)([NH2+]Cc1ccc(C)cc1)C(=O)OC ZINC000299724704 386483006 /nfs/dbraw/zinc/48/30/06/386483006.db2.gz UCTJFZNEUOARON-AWEZNQCLSA-N 1 2 235.327 2.426 20 0 BEADLO C[C@@H](C[NH2+][C@]1(C)CCOC1=O)Cc1ccccc1 ZINC000290864115 386483647 /nfs/dbraw/zinc/48/36/47/386483647.db2.gz JVRVBYHLXFREHF-IUODEOHRSA-N 1 2 247.338 2.160 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000278124758 386492808 /nfs/dbraw/zinc/49/28/08/386492808.db2.gz BJOMSKCCVASEHM-VIFPVBQESA-N 1 2 247.264 2.492 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000278124758 386492811 /nfs/dbraw/zinc/49/28/11/386492811.db2.gz BJOMSKCCVASEHM-VIFPVBQESA-N 1 2 247.264 2.492 20 0 BEADLO COC(=O)[C@H]([NH2+]CCCc1ccccc1)C1CC1 ZINC000227766930 386510176 /nfs/dbraw/zinc/51/01/76/386510176.db2.gz URDSOTKUBRBLCF-CQSZACIVSA-N 1 2 247.338 2.160 20 0 BEADLO Cc1[nH]c(C(=O)NCC(C(C)C)C(C)C)c[nH+]1 ZINC000278331101 386511406 /nfs/dbraw/zinc/51/14/06/386511406.db2.gz MAGWAJDUXDOZBE-UHFFFAOYSA-N 1 2 237.347 2.376 20 0 BEADLO Cc1c[nH+]ccc1CCNc1nnc(C2CC2)o1 ZINC000278354491 386514536 /nfs/dbraw/zinc/51/45/36/386514536.db2.gz JVTFQYXFDZGJON-UHFFFAOYSA-N 1 2 244.298 2.305 20 0 BEADLO Cc1nc(N2CCCCC[C@H]2C[C@H](C)O)cc[nH+]1 ZINC000286516987 386517003 /nfs/dbraw/zinc/51/70/03/386517003.db2.gz ZIBRBAVRXWZBQC-AAEUAGOBSA-N 1 2 249.358 2.305 20 0 BEADLO Cc1nc(N2CCCCC[C@H]2C[C@@H](C)O)cc[nH+]1 ZINC000286517000 386517704 /nfs/dbraw/zinc/51/77/04/386517704.db2.gz ZIBRBAVRXWZBQC-YPMHNXCESA-N 1 2 249.358 2.305 20 0 BEADLO Cc1nocc1C[N@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC000335450445 386522352 /nfs/dbraw/zinc/52/23/52/386522352.db2.gz YOPDJMNWVSGHNT-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1nocc1C[N@@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC000335450445 386522360 /nfs/dbraw/zinc/52/23/60/386522360.db2.gz YOPDJMNWVSGHNT-SNVBAGLBSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2nncn2C)c(C)c1 ZINC000299543410 386464422 /nfs/dbraw/zinc/46/44/22/386464422.db2.gz AUCQGIOYXFMCEQ-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2nncn2C)c(C)c1 ZINC000299543410 386464427 /nfs/dbraw/zinc/46/44/27/386464427.db2.gz AUCQGIOYXFMCEQ-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO CC(C)=CCNc1cc(N2CCCC2)nc[nH+]1 ZINC000277778721 386465172 /nfs/dbraw/zinc/46/51/72/386465172.db2.gz LTHSKGJFFALKRY-UHFFFAOYSA-N 1 2 232.331 2.455 20 0 BEADLO CC(C)=CCNc1cc(N2CCCC2)[nH+]cn1 ZINC000277778721 386465179 /nfs/dbraw/zinc/46/51/79/386465179.db2.gz LTHSKGJFFALKRY-UHFFFAOYSA-N 1 2 232.331 2.455 20 0 BEADLO CC(C)[C@H]([NH2+]C1CCC(O)CC1)C(F)(F)F ZINC000336756909 386575392 /nfs/dbraw/zinc/57/53/92/386575392.db2.gz YSJKMHVKWQWERZ-RTBKNWGFSA-N 1 2 239.281 2.466 20 0 BEADLO CCC[C@@H]([NH2+]CC=C(C)C)C(=O)OCC ZINC000190721007 386580380 /nfs/dbraw/zinc/58/03/80/386580380.db2.gz FLUIUXGDQXPVNK-LLVKDONJSA-N 1 2 213.321 2.274 20 0 BEADLO C/C=C/C[C@@H]([NH2+]C1CC(C)C1)C(=O)OCC ZINC000336781258 386581732 /nfs/dbraw/zinc/58/17/32/386581732.db2.gz UEVIXANQVTYDQS-OWZLBQIQSA-N 1 2 225.332 2.272 20 0 BEADLO COc1ccc(OCc2c[nH+]cn2C)cc1C ZINC000267763445 386581979 /nfs/dbraw/zinc/58/19/79/386581979.db2.gz JQVLLNWGFCPFTI-UHFFFAOYSA-N 1 2 232.283 2.316 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2cc(C(N)=O)co2)o1 ZINC000187732985 386588043 /nfs/dbraw/zinc/58/80/43/386588043.db2.gz YWJSUVWYJXYACX-SECBINFHSA-N 1 2 248.282 2.131 20 0 BEADLO COc1cc(C)ccc1OCc1c[nH+]cn1C ZINC000267822265 386588900 /nfs/dbraw/zinc/58/89/00/386588900.db2.gz XONGPMRUHSHLGH-UHFFFAOYSA-N 1 2 232.283 2.316 20 0 BEADLO CCN(Cc1c[nH+]cn1CC)CC(F)(F)F ZINC000417724046 386592708 /nfs/dbraw/zinc/59/27/08/386592708.db2.gz HXYGQKJYSMFKLK-UHFFFAOYSA-N 1 2 235.253 2.287 20 0 BEADLO CC(C)C(C)(C)CNc1[nH+]cnc2c1cnn2C ZINC000187776866 386596209 /nfs/dbraw/zinc/59/62/09/386596209.db2.gz ABNMGPYTQNXYJO-UHFFFAOYSA-N 1 2 247.346 2.457 20 0 BEADLO O=C(CC1CC1)Nc1ccn2cc[nH+]c2c1 ZINC000291400631 386541531 /nfs/dbraw/zinc/54/15/31/386541531.db2.gz DXVXVPCUOAUFJT-UHFFFAOYSA-N 1 2 215.256 2.073 20 0 BEADLO Fc1cccc(CN2CCn3c[nH+]cc3C2)c1F ZINC000291443247 386546383 /nfs/dbraw/zinc/54/63/83/386546383.db2.gz BYMGGSHFLNEDAC-UHFFFAOYSA-N 1 2 249.264 2.177 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@H](C)CCC(C)C ZINC000278588246 386552446 /nfs/dbraw/zinc/55/24/46/386552446.db2.gz KGRKWQRTXFSKOO-SNVBAGLBSA-N 1 2 237.347 2.202 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@H](C)CCC(C)C ZINC000278588246 386552452 /nfs/dbraw/zinc/55/24/52/386552452.db2.gz KGRKWQRTXFSKOO-SNVBAGLBSA-N 1 2 237.347 2.202 20 0 BEADLO Cc1ccoc1C[N@@H+](C)Cc1ccc(C)nn1 ZINC000414454507 386555284 /nfs/dbraw/zinc/55/52/84/386555284.db2.gz QXZOMZIBJZYIBC-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ccoc1C[N@H+](C)Cc1ccc(C)nn1 ZINC000414454507 386555286 /nfs/dbraw/zinc/55/52/86/386555286.db2.gz QXZOMZIBJZYIBC-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000291538186 386556924 /nfs/dbraw/zinc/55/69/24/386556924.db2.gz KZXBQIJMBBIXFL-VIFPVBQESA-N 1 2 247.264 2.492 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000291538186 386556932 /nfs/dbraw/zinc/55/69/32/386556932.db2.gz KZXBQIJMBBIXFL-VIFPVBQESA-N 1 2 247.264 2.492 20 0 BEADLO CC1(C)C[C@@H]1[NH2+][C@@H](c1ncc[nH]1)c1ccccn1 ZINC000278639630 386558631 /nfs/dbraw/zinc/55/86/31/386558631.db2.gz HMAORADYFJEBGJ-NWDGAFQWSA-N 1 2 242.326 2.282 20 0 BEADLO COCC[N@H+](C)Cc1c(F)cc(C)cc1F ZINC000425321735 386559938 /nfs/dbraw/zinc/55/99/38/386559938.db2.gz GBQSWUHZVBWCRO-UHFFFAOYSA-N 1 2 229.270 2.351 20 0 BEADLO COCC[N@@H+](C)Cc1c(F)cc(C)cc1F ZINC000425321735 386559943 /nfs/dbraw/zinc/55/99/43/386559943.db2.gz GBQSWUHZVBWCRO-UHFFFAOYSA-N 1 2 229.270 2.351 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2ccnn2-c2ccccc2)C1 ZINC000335405459 386562745 /nfs/dbraw/zinc/56/27/45/386562745.db2.gz ALTGMYNLFKALGX-GFCCVEGCSA-N 1 2 245.301 2.416 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2ccnn2-c2ccccc2)C1 ZINC000335405459 386562752 /nfs/dbraw/zinc/56/27/52/386562752.db2.gz ALTGMYNLFKALGX-GFCCVEGCSA-N 1 2 245.301 2.416 20 0 BEADLO Oc1cc(F)cc(C[N@H+]2CC[C@H](F)C2)c1 ZINC000335405546 386563420 /nfs/dbraw/zinc/56/34/20/386563420.db2.gz CTZBBXCDTFNTDH-VIFPVBQESA-N 1 2 213.227 2.075 20 0 BEADLO CC(C)(C)c1ncc(C[N@@H+]2CC[C@@H](F)C2)cn1 ZINC000335406716 386565259 /nfs/dbraw/zinc/56/52/59/386565259.db2.gz NDWCIHUNJDGLOK-LLVKDONJSA-N 1 2 237.322 2.318 20 0 BEADLO CC(C)(C)c1ncc(C[N@H+]2CC[C@@H](F)C2)cn1 ZINC000335406716 386565267 /nfs/dbraw/zinc/56/52/67/386565267.db2.gz NDWCIHUNJDGLOK-LLVKDONJSA-N 1 2 237.322 2.318 20 0 BEADLO CN(Cc1c[nH+]cn1C)c1c(F)cccc1F ZINC000267642042 386565418 /nfs/dbraw/zinc/56/54/18/386565418.db2.gz VSZDEAHNEIYNLM-UHFFFAOYSA-N 1 2 237.253 2.335 20 0 BEADLO Cc1noc([C@H](C)[N@H+](C)Cc2cccnc2C)n1 ZINC000520248306 386625707 /nfs/dbraw/zinc/62/57/07/386625707.db2.gz YHNLLQRYCILYPW-JTQLQIEISA-N 1 2 246.314 2.274 20 0 BEADLO Cc1noc([C@H](C)[N@@H+](C)Cc2cccnc2C)n1 ZINC000520248306 386625709 /nfs/dbraw/zinc/62/57/09/386625709.db2.gz YHNLLQRYCILYPW-JTQLQIEISA-N 1 2 246.314 2.274 20 0 BEADLO Cc1ncccc1C[N@@H+]1Cc2cccnc2C1 ZINC000644932830 386629528 /nfs/dbraw/zinc/62/95/28/386629528.db2.gz OCFNNTRCSHRGQE-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO Cc1ncccc1C[N@H+]1Cc2cccnc2C1 ZINC000644932830 386629530 /nfs/dbraw/zinc/62/95/30/386629530.db2.gz OCFNNTRCSHRGQE-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO Cc1ccc(C)c([S@@](=O)Cc2c[nH+]cn2C)c1 ZINC000268228554 386634088 /nfs/dbraw/zinc/63/40/88/386634088.db2.gz UYSLHTGLUXXDLM-KRWDZBQOSA-N 1 2 248.351 2.345 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@H](C)CC(C)C)no1 ZINC000337183152 386655896 /nfs/dbraw/zinc/65/58/96/386655896.db2.gz NMTOOPLPGQAXRR-SNVBAGLBSA-N 1 2 225.336 2.492 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@H](C)CC(C)C)no1 ZINC000337183152 386655902 /nfs/dbraw/zinc/65/59/02/386655902.db2.gz NMTOOPLPGQAXRR-SNVBAGLBSA-N 1 2 225.336 2.492 20 0 BEADLO CCC(=O)N1CC[N@@H+]([C@@H]2CCc3ccccc32)C1 ZINC000644950817 386639241 /nfs/dbraw/zinc/63/92/41/386639241.db2.gz UNDXFCUVLCSBLW-CQSZACIVSA-N 1 2 244.338 2.186 20 0 BEADLO CCC(=O)N1CC[N@H+]([C@@H]2CCc3ccccc32)C1 ZINC000644950817 386639247 /nfs/dbraw/zinc/63/92/47/386639247.db2.gz UNDXFCUVLCSBLW-CQSZACIVSA-N 1 2 244.338 2.186 20 0 BEADLO CC[C@@]1(C(C)C)C[C@H]1NC(=O)c1c[nH+]c(C)[nH]1 ZINC000457316409 386643758 /nfs/dbraw/zinc/64/37/58/386643758.db2.gz ZWALUFSRJSDJDK-YPMHNXCESA-N 1 2 235.331 2.273 20 0 BEADLO C[C@H](C1CC1)N(C(=O)CCc1[nH]cc[nH+]1)C1CC1 ZINC000279175515 386643936 /nfs/dbraw/zinc/64/39/36/386643936.db2.gz HOFKFYZNYAHMHD-SNVBAGLBSA-N 1 2 247.342 2.132 20 0 BEADLO Cc1occc1C[N@@H+](C)Cc1cc(C)ncn1 ZINC000292276135 386644238 /nfs/dbraw/zinc/64/42/38/386644238.db2.gz XGEAYALWYUSYLN-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1occc1C[N@H+](C)Cc1cc(C)ncn1 ZINC000292276135 386644243 /nfs/dbraw/zinc/64/42/43/386644243.db2.gz XGEAYALWYUSYLN-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@H]1CCC[C@@H](C)[C@H]1C ZINC000279195588 386646099 /nfs/dbraw/zinc/64/60/99/386646099.db2.gz KEXPZUPKNHHOPX-CKYFFXLPSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@@H]1CCC[C@@H](C)[C@H]1C ZINC000279195588 386646107 /nfs/dbraw/zinc/64/61/07/386646107.db2.gz KEXPZUPKNHHOPX-CKYFFXLPSA-N 1 2 249.358 2.202 20 0 BEADLO Cc1cc(C[N@H+](C)CCC(F)(F)F)n(C)n1 ZINC000417748579 386647793 /nfs/dbraw/zinc/64/77/93/386647793.db2.gz DRPMMQHTPJOKIU-UHFFFAOYSA-N 1 2 235.253 2.113 20 0 BEADLO Cc1cc(C[N@@H+](C)CCC(F)(F)F)n(C)n1 ZINC000417748579 386647800 /nfs/dbraw/zinc/64/78/00/386647800.db2.gz DRPMMQHTPJOKIU-UHFFFAOYSA-N 1 2 235.253 2.113 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N1CC[C@@H]2CCCC[C@@H]21 ZINC000335512009 386647945 /nfs/dbraw/zinc/64/79/45/386647945.db2.gz IVALPNWKLKUBSQ-RYUDHWBXSA-N 1 2 247.342 2.133 20 0 BEADLO CCCC1(CNC(=O)c2c[nH+]c(C)[nH]2)CCC1 ZINC000268398911 386648824 /nfs/dbraw/zinc/64/88/24/386648824.db2.gz FPRMLKNNPAIEJF-UHFFFAOYSA-N 1 2 235.331 2.418 20 0 BEADLO CCOCCNc1nc(C)[nH+]c2c1CCCC2 ZINC000267965799 386603806 /nfs/dbraw/zinc/60/38/06/386603806.db2.gz MJBYRWBQBMBGRZ-UHFFFAOYSA-N 1 2 235.331 2.112 20 0 BEADLO Cc1cc(N[C@@H](C)CCCO)nc(C2CC2)[nH+]1 ZINC000268000320 386606419 /nfs/dbraw/zinc/60/64/19/386606419.db2.gz BJBXWIPPVQKXQC-VIFPVBQESA-N 1 2 235.331 2.235 20 0 BEADLO Cc1cc(C[NH+]2CC(C)(CC(F)F)C2)nn1C ZINC000648058885 386682067 /nfs/dbraw/zinc/68/20/67/386682067.db2.gz JKMUMSIDCJIZEW-UHFFFAOYSA-N 1 2 243.301 2.206 20 0 BEADLO CC1(C(=O)NCc2ccn3cc[nH+]c3c2)CCC1 ZINC000268536960 386660819 /nfs/dbraw/zinc/66/08/19/386660819.db2.gz RSEYBFPVXSSNPY-UHFFFAOYSA-N 1 2 243.310 2.141 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1CCOC[C@H]1C ZINC000335527092 386670488 /nfs/dbraw/zinc/67/04/88/386670488.db2.gz FQBQIDNRABCPNJ-PWSUYJOCSA-N 1 2 248.326 2.310 20 0 BEADLO CC[C@@H]([NH2+]C[C@H]1CCc2ccccc21)C(=O)OC ZINC000192847978 386678455 /nfs/dbraw/zinc/67/84/55/386678455.db2.gz HBFMHUIUURKIHT-TZMCWYRMSA-N 1 2 247.338 2.258 20 0 BEADLO Cc1nnc(C[N@@H+]2CCc3ccccc3[C@H]2C)[nH]1 ZINC000292511574 386681769 /nfs/dbraw/zinc/68/17/69/386681769.db2.gz NJOKIJBRKBHTHB-SNVBAGLBSA-N 1 2 242.326 2.232 20 0 BEADLO Cc1nnc(C[N@H+]2CCc3ccccc3[C@H]2C)[nH]1 ZINC000292511574 386681778 /nfs/dbraw/zinc/68/17/78/386681778.db2.gz NJOKIJBRKBHTHB-SNVBAGLBSA-N 1 2 242.326 2.232 20 0 BEADLO CCC[C@@H](OC)C(=O)Nc1c(C)cc[nH+]c1C ZINC000425577767 386657196 /nfs/dbraw/zinc/65/71/96/386657196.db2.gz AWOGCKGTAPKJQJ-LLVKDONJSA-N 1 2 236.315 2.452 20 0 BEADLO Cc1nnc(C[N@H+]2C[C@@H](C)[C@H]2c2ccccc2)[nH]1 ZINC000292514654 386683092 /nfs/dbraw/zinc/68/30/92/386683092.db2.gz NPYBTGXYXVWEBH-YGRLFVJLSA-N 1 2 242.326 2.306 20 0 BEADLO Cc1nnc(C[N@@H+]2C[C@@H](C)[C@H]2c2ccccc2)[nH]1 ZINC000292514654 386683097 /nfs/dbraw/zinc/68/30/97/386683097.db2.gz NPYBTGXYXVWEBH-YGRLFVJLSA-N 1 2 242.326 2.306 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N(C)[C@H](C)C1CCC1 ZINC000357020669 386694019 /nfs/dbraw/zinc/69/40/19/386694019.db2.gz OLQWGJUALBKKIF-LLVKDONJSA-N 1 2 247.342 2.464 20 0 BEADLO O=C(CCn1cc[nH+]c1)N(C1CCC1)C1CCC1 ZINC000292577852 386694153 /nfs/dbraw/zinc/69/41/53/386694153.db2.gz PHFHSKXXWJUZFN-UHFFFAOYSA-N 1 2 247.342 2.207 20 0 BEADLO CO[C@H](CNc1cc[nH+]c(C(C)(C)C)n1)C1CC1 ZINC000645054370 386694792 /nfs/dbraw/zinc/69/47/92/386694792.db2.gz OVYMGYGZJLNHNN-LLVKDONJSA-N 1 2 249.358 2.033 20 0 BEADLO Cc1c[nH+]ccc1CCN1CCC(F)(F)C1 ZINC000335476170 386698477 /nfs/dbraw/zinc/69/84/77/386698477.db2.gz LXWVDPOCZDGFRG-UHFFFAOYSA-N 1 2 226.270 2.274 20 0 BEADLO CC[C@H]1C[N@H+](Cc2csc(C)n2)C[C@@H](C)O1 ZINC000247073273 386699115 /nfs/dbraw/zinc/69/91/15/386699115.db2.gz YSDBXIONNCANPA-SKDRFNHKSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2csc(C)n2)C[C@@H](C)O1 ZINC000247073273 386699126 /nfs/dbraw/zinc/69/91/26/386699126.db2.gz YSDBXIONNCANPA-SKDRFNHKSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1csc(C)n1 ZINC000268813630 386699154 /nfs/dbraw/zinc/69/91/54/386699154.db2.gz HEWOZQBXETWWRZ-CABZTGNLSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1csc(C)n1 ZINC000268813630 386699164 /nfs/dbraw/zinc/69/91/64/386699164.db2.gz HEWOZQBXETWWRZ-CABZTGNLSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NCC1(C)CCCCC1 ZINC000292630901 386699896 /nfs/dbraw/zinc/69/98/96/386699896.db2.gz JUCZUSKVKFFXKX-UHFFFAOYSA-N 1 2 249.358 2.347 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)NCC1(C)CCCCC1 ZINC000292630901 386699900 /nfs/dbraw/zinc/69/99/00/386699900.db2.gz JUCZUSKVKFFXKX-UHFFFAOYSA-N 1 2 249.358 2.347 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@]3(CC[C@H](C)C3)C2)no1 ZINC000334140556 386739723 /nfs/dbraw/zinc/73/97/23/386739723.db2.gz HFGZVYGXALLNHA-GXFFZTMASA-N 1 2 235.331 2.390 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@]3(CC[C@H](C)C3)C2)no1 ZINC000334140556 386739729 /nfs/dbraw/zinc/73/97/29/386739729.db2.gz HFGZVYGXALLNHA-GXFFZTMASA-N 1 2 235.331 2.390 20 0 BEADLO CN(CC[C@H]1CCCO1)c1cc[nH+]c(C2CC2)n1 ZINC000302712521 386716213 /nfs/dbraw/zinc/71/62/13/386716213.db2.gz LSAJKSWETDPDLX-GFCCVEGCSA-N 1 2 247.342 2.359 20 0 BEADLO CO[C@@H](CNc1cc[nH+]c2ccncc12)C1CC1 ZINC000292754144 386721914 /nfs/dbraw/zinc/72/19/14/386721914.db2.gz JUTJNMKCHMARHO-AWEZNQCLSA-N 1 2 243.310 2.467 20 0 BEADLO c1nc(N2CCCC2)cc(N[C@@H]2C[C@H]3C[C@H]3C2)[nH+]1 ZINC000425296475 386751811 /nfs/dbraw/zinc/75/18/11/386751811.db2.gz GZBREEJLVDUSOX-ZSBIGDGJSA-N 1 2 244.342 2.287 20 0 BEADLO c1nc(N[C@@H]2C[C@H]3C[C@H]3C2)cc(N2CCCC2)[nH+]1 ZINC000425296475 386751821 /nfs/dbraw/zinc/75/18/21/386751821.db2.gz GZBREEJLVDUSOX-ZSBIGDGJSA-N 1 2 244.342 2.287 20 0 BEADLO C[C@H](C(=O)N(C)Cc1[nH]cc[nH+]1)c1ccsc1 ZINC000348533500 386752881 /nfs/dbraw/zinc/75/28/81/386752881.db2.gz KXKRQEQDKIGLFD-VIFPVBQESA-N 1 2 249.339 2.233 20 0 BEADLO COC(=O)c1coc(C[N@@H+]2CCC[C@H]2CF)c1 ZINC000292969630 386757950 /nfs/dbraw/zinc/75/79/50/386757950.db2.gz GLBCCGJBUAUHDR-JTQLQIEISA-N 1 2 241.262 2.000 20 0 BEADLO COC(=O)c1coc(C[N@H+]2CCC[C@H]2CF)c1 ZINC000292969630 386757954 /nfs/dbraw/zinc/75/79/54/386757954.db2.gz GLBCCGJBUAUHDR-JTQLQIEISA-N 1 2 241.262 2.000 20 0 BEADLO Cc1nnc(C[N@@H+](C)[C@@H](C)c2cccc(O)c2)[nH]1 ZINC000293023916 386767858 /nfs/dbraw/zinc/76/78/58/386767858.db2.gz CQLXSZVBTZHESO-VIFPVBQESA-N 1 2 246.314 2.012 20 0 BEADLO Cc1nnc(C[N@H+](C)[C@@H](C)c2cccc(O)c2)[nH]1 ZINC000293023916 386767861 /nfs/dbraw/zinc/76/78/61/386767861.db2.gz CQLXSZVBTZHESO-VIFPVBQESA-N 1 2 246.314 2.012 20 0 BEADLO Cc1ccoc1C[N@@H+](C)Cc1cncnc1 ZINC000292882667 386743668 /nfs/dbraw/zinc/74/36/68/386743668.db2.gz XXBACHBGSGVUER-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ccoc1C[N@H+](C)Cc1cncnc1 ZINC000292882667 386743670 /nfs/dbraw/zinc/74/36/70/386743670.db2.gz XXBACHBGSGVUER-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1nnc(C)[nH]1 ZINC000293259175 386792589 /nfs/dbraw/zinc/79/25/89/386792589.db2.gz RWPGQABQUVISAX-GFCCVEGCSA-N 1 2 245.330 2.091 20 0 BEADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1nnc(C)[nH]1 ZINC000293259175 386792592 /nfs/dbraw/zinc/79/25/92/386792592.db2.gz RWPGQABQUVISAX-GFCCVEGCSA-N 1 2 245.330 2.091 20 0 BEADLO FC(F)(F)[C@H]([NH2+]CC[C@@H]1CCOC1)C1CC1 ZINC000336668791 386793653 /nfs/dbraw/zinc/79/36/53/386793653.db2.gz GJMZTLCTAGEIFP-PSASIEDQSA-N 1 2 237.265 2.344 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@@H](C)c2ccccn2)n(C)n1 ZINC000417981162 386787815 /nfs/dbraw/zinc/78/78/15/386787815.db2.gz JPRKUYBGSNOYAR-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cc(C[N@H+](C)[C@@H](C)c2ccccn2)n(C)n1 ZINC000417981162 386787821 /nfs/dbraw/zinc/78/78/21/386787821.db2.gz JPRKUYBGSNOYAR-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@H](C)c2ccccn2)n(C)n1 ZINC000417981161 386788002 /nfs/dbraw/zinc/78/80/02/386788002.db2.gz JPRKUYBGSNOYAR-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cc(C[N@H+](C)[C@H](C)c2ccccn2)n(C)n1 ZINC000417981161 386788008 /nfs/dbraw/zinc/78/80/08/386788008.db2.gz JPRKUYBGSNOYAR-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO CC[C@H](OC)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000330671084 386819291 /nfs/dbraw/zinc/81/92/91/386819291.db2.gz MMTRKHAAETZJFR-NSHDSACASA-N 1 2 236.315 2.370 20 0 BEADLO CCC[C@H]([NH2+][C@H]1CSC[C@@H]1C)C(=O)OCC ZINC000336672951 386820415 /nfs/dbraw/zinc/82/04/15/386820415.db2.gz AXCZHLFQYPAXRL-DCAQKATOSA-N 1 2 245.388 2.059 20 0 BEADLO C[C@H]1C[C@H](NC(=O)CC2(C)CC2)c2[nH+]ccn21 ZINC000334770521 386821692 /nfs/dbraw/zinc/82/16/92/386821692.db2.gz QQUVJNKMWYGZTA-UWVGGRQHSA-N 1 2 233.315 2.195 20 0 BEADLO Cc1cc(N[C@@H]2CCCC[C@@H]2O)nc(C2CC2)[nH+]1 ZINC000264674378 386803681 /nfs/dbraw/zinc/80/36/81/386803681.db2.gz VCKYLNYOUAWSJG-NEPJUHHUSA-N 1 2 247.342 2.378 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@H]1CCC[C@H]1c1ccccc1 ZINC000280353755 386807764 /nfs/dbraw/zinc/80/77/64/386807764.db2.gz TXFCNABDHJUTLC-XBFCOCLRSA-N 1 2 247.338 2.474 20 0 BEADLO CC(C)[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000357577768 386809571 /nfs/dbraw/zinc/80/95/71/386809571.db2.gz DUEAKSSIXDEMER-SRVKXCTJSA-N 1 2 247.342 2.365 20 0 BEADLO CC(C)(C(=O)NC[C@@H]1CC=CCC1)c1c[nH]c[nH+]1 ZINC000330679183 386827108 /nfs/dbraw/zinc/82/71/08/386827108.db2.gz CXILBZRLCYCJKA-LLVKDONJSA-N 1 2 247.342 2.160 20 0 BEADLO CSCCC[N@H+](C)[C@@H](C)c1csnn1 ZINC000450902028 386827256 /nfs/dbraw/zinc/82/72/56/386827256.db2.gz KKDPWZHLUFWVEF-QMMMGPOBSA-N 1 2 231.390 2.284 20 0 BEADLO CSCCC[N@@H+](C)[C@@H](C)c1csnn1 ZINC000450902028 386827260 /nfs/dbraw/zinc/82/72/60/386827260.db2.gz KKDPWZHLUFWVEF-QMMMGPOBSA-N 1 2 231.390 2.284 20 0 BEADLO Cc1nc(C(C)C)ccc1C[NH+]1CCOCC1 ZINC000293525525 386829785 /nfs/dbraw/zinc/82/97/85/386829785.db2.gz PBGFJZCFPBBLOG-UHFFFAOYSA-N 1 2 234.343 2.346 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ncc(C3CC3)o2)[C@H]1C ZINC000293522027 386830077 /nfs/dbraw/zinc/83/00/77/386830077.db2.gz WDFWBOSOUOHJJB-BDAKNGLRSA-N 1 2 206.289 2.392 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ncc(C3CC3)o2)[C@H]1C ZINC000293522027 386830079 /nfs/dbraw/zinc/83/00/79/386830079.db2.gz WDFWBOSOUOHJJB-BDAKNGLRSA-N 1 2 206.289 2.392 20 0 BEADLO CC(C)[C@H](O)CCNc1cc[nH+]c(C2CC2)n1 ZINC000301430554 386842719 /nfs/dbraw/zinc/84/27/19/386842719.db2.gz QGYJVGMLLLETOL-LLVKDONJSA-N 1 2 235.331 2.173 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1cccc(F)c1F ZINC000293588873 386842895 /nfs/dbraw/zinc/84/28/95/386842895.db2.gz OEKMJTJDVCUYRY-JTQLQIEISA-N 1 2 227.254 2.186 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1cccc(F)c1F ZINC000293588873 386842904 /nfs/dbraw/zinc/84/29/04/386842904.db2.gz OEKMJTJDVCUYRY-JTQLQIEISA-N 1 2 227.254 2.186 20 0 BEADLO CN(C[C@H]1CCCO1)c1cc[nH+]c(C(C)(C)C)n1 ZINC000301497584 386848602 /nfs/dbraw/zinc/84/86/02/386848602.db2.gz BUJOCCOLEWSFTQ-LLVKDONJSA-N 1 2 249.358 2.389 20 0 BEADLO Cc1cc(N(C)C[C@@H]2CCOC2)nc(C(C)C)[nH+]1 ZINC000301519181 386851146 /nfs/dbraw/zinc/85/11/46/386851146.db2.gz HGJZOSNTSQHCET-LBPRGKRZSA-N 1 2 249.358 2.381 20 0 BEADLO CC[C@](C)(CO)Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000301539646 386852850 /nfs/dbraw/zinc/85/28/50/386852850.db2.gz MYRDFZFOVMBMEE-CYBMUJFWSA-N 1 2 237.347 2.347 20 0 BEADLO c1csc([C@H]([NH2+]CC2CCC2)c2nnc[nH]2)c1 ZINC000293875372 386893355 /nfs/dbraw/zinc/89/33/55/386893355.db2.gz VDPXRZYLFSAGPZ-NSHDSACASA-N 1 2 248.355 2.345 20 0 BEADLO Cc1cc(C)cc(C[NH+]2CC(O)(C(F)F)C2)c1 ZINC000425344138 386855864 /nfs/dbraw/zinc/85/58/64/386855864.db2.gz BLIMJQDTGASKGG-UHFFFAOYSA-N 1 2 241.281 2.115 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H]1CCC(F)(F)C1 ZINC000334790839 386856762 /nfs/dbraw/zinc/85/67/62/386856762.db2.gz MTHTWGGKUREODK-VIFPVBQESA-N 1 2 240.253 2.186 20 0 BEADLO C[C@H](C[NH+]1CC(O)(C(F)F)C1)c1ccccc1 ZINC000425345343 386856914 /nfs/dbraw/zinc/85/69/14/386856914.db2.gz GKLXHIJGMSXRFA-SNVBAGLBSA-N 1 2 241.281 2.102 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccc3c(n2)CCC3)[C@@H](C)CO1 ZINC000334791907 386858138 /nfs/dbraw/zinc/85/81/38/386858138.db2.gz DXOPUUQDRXPNIQ-RYUDHWBXSA-N 1 2 246.354 2.180 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccc3c(n2)CCC3)[C@@H](C)CO1 ZINC000334791907 386858142 /nfs/dbraw/zinc/85/81/42/386858142.db2.gz DXOPUUQDRXPNIQ-RYUDHWBXSA-N 1 2 246.354 2.180 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+]1CCO[C@H](CF)C1 ZINC000334828689 386864441 /nfs/dbraw/zinc/86/44/41/386864441.db2.gz KOXVQVROIVFGMN-CYBMUJFWSA-N 1 2 241.281 2.304 20 0 BEADLO Cc1cc(F)ccc1C[N@H+]1CCO[C@H](CF)C1 ZINC000334828689 386864442 /nfs/dbraw/zinc/86/44/42/386864442.db2.gz KOXVQVROIVFGMN-CYBMUJFWSA-N 1 2 241.281 2.304 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1C[C@@]1(C)CC ZINC000341264408 386870143 /nfs/dbraw/zinc/87/01/43/386870143.db2.gz ARIJOHAAWLMPIS-SMDDNHRTSA-N 1 2 232.327 2.441 20 0 BEADLO CO[C@H](C)C[N@H+](C)Cc1c(F)ccc(O)c1F ZINC000293793379 386878712 /nfs/dbraw/zinc/87/87/12/386878712.db2.gz CRNGGGYUWBFGAF-MRVPVSSYSA-N 1 2 245.269 2.137 20 0 BEADLO CO[C@H](C)C[N@@H+](C)Cc1c(F)ccc(O)c1F ZINC000293793379 386878717 /nfs/dbraw/zinc/87/87/17/386878717.db2.gz CRNGGGYUWBFGAF-MRVPVSSYSA-N 1 2 245.269 2.137 20 0 BEADLO CC(C)C[C@@H](C)CC(=O)Nc1cc[nH+]cc1O ZINC000330778519 386883123 /nfs/dbraw/zinc/88/31/23/386883123.db2.gz BMCMCVAACIMNBX-SNVBAGLBSA-N 1 2 236.315 2.220 20 0 BEADLO CC[C@H]1CCN(c2nc(N)c3ccccc3[nH+]2)C1 ZINC000301863319 386887275 /nfs/dbraw/zinc/88/72/75/386887275.db2.gz CTVJKYKSCWUDHG-JTQLQIEISA-N 1 2 242.326 2.448 20 0 BEADLO CSCCN(C)c1[nH]c2ccccc2[nH+]1 ZINC000301878413 386887586 /nfs/dbraw/zinc/88/75/86/386887586.db2.gz LAHPBOVRMYZVRP-UHFFFAOYSA-N 1 2 221.329 2.362 20 0 BEADLO c1cncc(C[N@@H+]2C[C@@]3(CCCO3)[C@H]2C2CC2)c1 ZINC000293839677 386889325 /nfs/dbraw/zinc/88/93/25/386889325.db2.gz AZRRLLASOACCIM-CABCVRRESA-N 1 2 244.338 2.225 20 0 BEADLO c1cncc(C[N@H+]2C[C@@]3(CCCO3)[C@H]2C2CC2)c1 ZINC000293839677 386889330 /nfs/dbraw/zinc/88/93/30/386889330.db2.gz AZRRLLASOACCIM-CABCVRRESA-N 1 2 244.338 2.225 20 0 BEADLO c1cncc(C[N@@H+]2C[C@]3(CCCO3)[C@@H]2C2CC2)c1 ZINC000293839713 386889466 /nfs/dbraw/zinc/88/94/66/386889466.db2.gz AZRRLLASOACCIM-LSDHHAIUSA-N 1 2 244.338 2.225 20 0 BEADLO c1cncc(C[N@H+]2C[C@]3(CCCO3)[C@@H]2C2CC2)c1 ZINC000293839713 386889471 /nfs/dbraw/zinc/88/94/71/386889471.db2.gz AZRRLLASOACCIM-LSDHHAIUSA-N 1 2 244.338 2.225 20 0 BEADLO c1ccc(C[N@@H+]2CCc3ncccc3C2)nc1 ZINC000367846739 386913661 /nfs/dbraw/zinc/91/36/61/386913661.db2.gz CHJPSBOJYHHNEI-UHFFFAOYSA-N 1 2 225.295 2.035 20 0 BEADLO c1ccc(C[N@H+]2CCc3ncccc3C2)nc1 ZINC000367846739 386913667 /nfs/dbraw/zinc/91/36/67/386913667.db2.gz CHJPSBOJYHHNEI-UHFFFAOYSA-N 1 2 225.295 2.035 20 0 BEADLO C[C@H]1CC[C@H]([N@H+](C)Cc2csnn2)C1 ZINC000334863664 386919202 /nfs/dbraw/zinc/91/92/02/386919202.db2.gz JNQFGQRKHACMFH-WPRPVWTQSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@H]1CC[C@H]([N@@H+](C)Cc2csnn2)C1 ZINC000334863664 386919205 /nfs/dbraw/zinc/91/92/05/386919205.db2.gz JNQFGQRKHACMFH-WPRPVWTQSA-N 1 2 211.334 2.159 20 0 BEADLO CC[C@H]1CN(c2nc(C)[nH+]c(C)c2C)CCCO1 ZINC000341379036 386896792 /nfs/dbraw/zinc/89/67/92/386896792.db2.gz DOJJBUSPGHXLLK-ZDUSSCGKSA-N 1 2 249.358 2.407 20 0 BEADLO Cc1cc[nH]c1C(=O)Nc1c[nH+]c2n1CCCC2 ZINC000334847548 386897292 /nfs/dbraw/zinc/89/72/92/386897292.db2.gz VVLIHVKIKPGBSG-UHFFFAOYSA-N 1 2 244.298 2.108 20 0 BEADLO CCc1cc(N2CCC[C@H]2C(C)(C)O)nc(C)[nH+]1 ZINC000302109637 386903622 /nfs/dbraw/zinc/90/36/22/386903622.db2.gz TVQLHKVKUTWRRF-LBPRGKRZSA-N 1 2 249.358 2.087 20 0 BEADLO CC(C)c1nc(NCC2(CO)CCC2)cc[nH+]1 ZINC000302120530 386905356 /nfs/dbraw/zinc/90/53/56/386905356.db2.gz DGZJWSQQAYLMQZ-UHFFFAOYSA-N 1 2 235.331 2.175 20 0 BEADLO Cc1ccc(C[S@](=O)C2CCC2)c(C)[nH+]1 ZINC000334854885 386906937 /nfs/dbraw/zinc/90/69/37/386906937.db2.gz HDAJTSGXEAHHRS-HNNXBMFYSA-N 1 2 223.341 2.500 20 0 BEADLO C/C=C/C[C@@H](CO)Nc1cc[nH+]c(C(C)C)n1 ZINC000302249264 386920461 /nfs/dbraw/zinc/92/04/61/386920461.db2.gz MEUJBRJNEUEUQC-ZWNMCFTASA-N 1 2 235.331 2.339 20 0 BEADLO Cc1nocc1C[N@@H+]1CCc2ccc(O)cc2C1 ZINC000335773250 386922411 /nfs/dbraw/zinc/92/24/11/386922411.db2.gz RKQXKTZBWWFVKJ-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO Cc1nocc1C[N@H+]1CCc2ccc(O)cc2C1 ZINC000335773250 386922416 /nfs/dbraw/zinc/92/24/16/386922416.db2.gz RKQXKTZBWWFVKJ-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO CC[C@H]1[C@@H](C)CCN1c1cc(C)[nH+]cn1 ZINC000302465132 386924448 /nfs/dbraw/zinc/92/44/48/386924448.db2.gz VTRCQWKSTWVEDB-ONGXEEELSA-N 1 2 205.305 2.410 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)Cc1ccsc1 ZINC000358297574 386928348 /nfs/dbraw/zinc/92/83/48/386928348.db2.gz ZVQCHZOMOHKWMX-UHFFFAOYSA-N 1 2 246.335 2.309 20 0 BEADLO Cc1ccc(C[C@H](CO)Nc2cccc[nH+]2)cc1 ZINC000302726998 386934102 /nfs/dbraw/zinc/93/41/02/386934102.db2.gz SNDFNVSMBOYWMV-CQSZACIVSA-N 1 2 242.322 2.406 20 0 BEADLO OC[C@@]1(F)CC[N@H+](Cc2ccsc2Cl)C1 ZINC000334873510 386935168 /nfs/dbraw/zinc/93/51/68/386935168.db2.gz XDZJAKRBPJYUDQ-SNVBAGLBSA-N 1 2 249.738 2.308 20 0 BEADLO OC[C@@]1(F)CC[N@@H+](Cc2ccsc2Cl)C1 ZINC000334873510 386935171 /nfs/dbraw/zinc/93/51/71/386935171.db2.gz XDZJAKRBPJYUDQ-SNVBAGLBSA-N 1 2 249.738 2.308 20 0 BEADLO CC(C)c1nc(N2C[C@@H]3C[C@H]2CS3)cc[nH+]1 ZINC000334818639 386947837 /nfs/dbraw/zinc/94/78/37/386947837.db2.gz NYXGDGTZMOFXCP-UWVGGRQHSA-N 1 2 235.356 2.294 20 0 BEADLO CCc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)nc1 ZINC000334877702 386939513 /nfs/dbraw/zinc/93/95/13/386939513.db2.gz WXQWMJNQVXPHJU-TXEJJXNPSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)nc1 ZINC000334877702 386939518 /nfs/dbraw/zinc/93/95/18/386939518.db2.gz WXQWMJNQVXPHJU-TXEJJXNPSA-N 1 2 234.343 2.253 20 0 BEADLO CC(C)CCC(=O)N[C@H](c1[nH+]ccn1C)C1CC1 ZINC000341719087 386955137 /nfs/dbraw/zinc/95/51/37/386955137.db2.gz MFJQPLMEVCNLHV-ZDUSSCGKSA-N 1 2 249.358 2.424 20 0 BEADLO COC(=O)[C@H](C)[NH2+]CCc1cccc(Cl)c1 ZINC000336763654 386961198 /nfs/dbraw/zinc/96/11/98/386961198.db2.gz MMZCVOPFAVWRFQ-VIFPVBQESA-N 1 2 241.718 2.034 20 0 BEADLO c1ccc2ncc(C[N@@H+]3CCO[C@H]4C[C@H]43)cc2c1 ZINC000368335821 386963250 /nfs/dbraw/zinc/96/32/50/386963250.db2.gz ZUFATSQXQZIFHL-CABCVRRESA-N 1 2 240.306 2.208 20 0 BEADLO c1ccc2ncc(C[N@H+]3CCO[C@H]4C[C@H]43)cc2c1 ZINC000368335821 386963253 /nfs/dbraw/zinc/96/32/53/386963253.db2.gz ZUFATSQXQZIFHL-CABCVRRESA-N 1 2 240.306 2.208 20 0 BEADLO C[C@@H](C(N)=O)[N@H+](C)Cc1cc(C(C)(C)C)n[nH]1 ZINC000331339565 387008064 /nfs/dbraw/zinc/00/80/64/387008064.db2.gz MJZFBDMAFTVXRX-QMMMGPOBSA-N 1 2 238.335 2.063 20 0 BEADLO C[C@@H](C(N)=O)[N@@H+](C)Cc1cc(C(C)(C)C)n[nH]1 ZINC000331339565 387008068 /nfs/dbraw/zinc/00/80/68/387008068.db2.gz MJZFBDMAFTVXRX-QMMMGPOBSA-N 1 2 238.335 2.063 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+]1CCO[C@@H]2C[C@@H]21 ZINC000368636126 386996187 /nfs/dbraw/zinc/99/61/87/386996187.db2.gz HGTZRYHVJZWMIO-QWHCGFSZSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1ccc(F)cc1C[N@H+]1CCO[C@@H]2C[C@@H]21 ZINC000368636126 386996191 /nfs/dbraw/zinc/99/61/91/386996191.db2.gz HGTZRYHVJZWMIO-QWHCGFSZSA-N 1 2 221.275 2.107 20 0 BEADLO CC[C@@H](NC(=O)[C@H](C)C(F)(F)F)c1[nH]cc[nH+]1 ZINC000331262855 387000088 /nfs/dbraw/zinc/00/00/88/387000088.db2.gz DXFRAGHNRQYXNA-NKWVEPMBSA-N 1 2 249.236 2.175 20 0 BEADLO CC(C)(C)C(C)(C)NC(=O)CCc1[nH]cc[nH+]1 ZINC000350832608 387033298 /nfs/dbraw/zinc/03/32/98/387033298.db2.gz GMDBSZKGURPAKA-UHFFFAOYSA-N 1 2 237.347 2.283 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1CCCOCC1 ZINC000333439035 387035645 /nfs/dbraw/zinc/03/56/45/387035645.db2.gz WDEZVJCJIOQEGW-LBPRGKRZSA-N 1 2 248.326 2.454 20 0 BEADLO CCn1c[nH+]cc1CN1CCc2ccccc21 ZINC000334956679 387036064 /nfs/dbraw/zinc/03/60/64/387036064.db2.gz ZLCMGPNXARPEMZ-UHFFFAOYSA-N 1 2 227.311 2.466 20 0 BEADLO Cc1nc(SCc2[nH+]ccn2C)[nH]c1C ZINC000334971897 387057112 /nfs/dbraw/zinc/05/71/12/387057112.db2.gz BFMXVPGQAXXBGS-UHFFFAOYSA-N 1 2 222.317 2.052 20 0 BEADLO COC(=O)[C@H]([NH2+]C[C@H](C)c1ccccc1)C1CC1 ZINC000227767559 387058251 /nfs/dbraw/zinc/05/82/51/387058251.db2.gz SDENMVSLCUULOD-SMDDNHRTSA-N 1 2 247.338 2.331 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccncc2F)C[C@@H](C)O1 ZINC000336222222 387061497 /nfs/dbraw/zinc/06/14/97/387061497.db2.gz MKMRYRFZGPGKCQ-PWSUYJOCSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccncc2F)C[C@@H](C)O1 ZINC000336222222 387061498 /nfs/dbraw/zinc/06/14/98/387061498.db2.gz MKMRYRFZGPGKCQ-PWSUYJOCSA-N 1 2 238.306 2.220 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2ccc(Cl)o2)C1 ZINC000336222850 387061884 /nfs/dbraw/zinc/06/18/84/387061884.db2.gz PGYSLDXPAXPQOZ-SSDOTTSWSA-N 1 2 203.644 2.477 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2ccc(Cl)o2)C1 ZINC000336222850 387061888 /nfs/dbraw/zinc/06/18/88/387061888.db2.gz PGYSLDXPAXPQOZ-SSDOTTSWSA-N 1 2 203.644 2.477 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@H](F)C2)cc1F ZINC000336222939 387064396 /nfs/dbraw/zinc/06/43/96/387064396.db2.gz WYQQVBGTSSSLNX-JTQLQIEISA-N 1 2 227.254 2.378 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@H](F)C2)cc1F ZINC000336222939 387064398 /nfs/dbraw/zinc/06/43/98/387064398.db2.gz WYQQVBGTSSSLNX-JTQLQIEISA-N 1 2 227.254 2.378 20 0 BEADLO Cc1ccc(CSCC(=O)N(C)C)c(C)[nH+]1 ZINC000341998944 387012702 /nfs/dbraw/zinc/01/27/02/387012702.db2.gz OIGAFLGBCZSPTA-UHFFFAOYSA-N 1 2 238.356 2.020 20 0 BEADLO COC(=O)[C@@H]([NH2+]C/C=C\c1ccccc1)C1CC1 ZINC000358817622 387017544 /nfs/dbraw/zinc/01/75/44/387017544.db2.gz PSRPDVQWIQLUDR-PODYEWJSSA-N 1 2 245.322 2.241 20 0 BEADLO Cc1ccc(N[C@@H]2CCOC[C@@H]2C)c[nH+]1 ZINC000192631479 387029826 /nfs/dbraw/zinc/02/98/26/387029826.db2.gz WUPINFZODLKAKR-JOYOIKCWSA-N 1 2 206.289 2.227 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1C[C@@]12CCOC2 ZINC000333361680 387029912 /nfs/dbraw/zinc/02/99/12/387029912.db2.gz HHPZSGGRYGWVSY-SMDDNHRTSA-N 1 2 246.310 2.064 20 0 BEADLO Cc1nc(N(C)C2CCCCC2)nc(N(C)C)[nH+]1 ZINC000359251108 387074124 /nfs/dbraw/zinc/07/41/24/387074124.db2.gz MIDPQSRRAQDNRT-UHFFFAOYSA-N 1 2 249.362 2.015 20 0 BEADLO Cc1nc(N(C)C)nc(N(C)C2CCCCC2)[nH+]1 ZINC000359251108 387074129 /nfs/dbraw/zinc/07/41/29/387074129.db2.gz MIDPQSRRAQDNRT-UHFFFAOYSA-N 1 2 249.362 2.015 20 0 BEADLO Cc1noc([C@H]2CCC[N@H+]2Cc2cccn2C)n1 ZINC000334987522 387075008 /nfs/dbraw/zinc/07/50/08/387075008.db2.gz CFVFGQQAYYQVON-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1noc([C@H]2CCC[N@@H+]2Cc2cccn2C)n1 ZINC000334987522 387075012 /nfs/dbraw/zinc/07/50/12/387075012.db2.gz CFVFGQQAYYQVON-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@]1(C)CC1(F)F ZINC000334995308 387086703 /nfs/dbraw/zinc/08/67/03/387086703.db2.gz IRFCCRLTDYGWII-SNVBAGLBSA-N 1 2 242.225 2.074 20 0 BEADLO Cc1cc(CNC(=O)N[C@H]2CC[C@H]2C)cc(C)[nH+]1 ZINC000334997332 387088449 /nfs/dbraw/zinc/08/84/49/387088449.db2.gz HQHVPTXEJRVKQW-RNCFNFMXSA-N 1 2 247.342 2.296 20 0 BEADLO C[C@@H](C(=O)Nc1ccccc1)[N@@H+]1CC[C@@H](F)C1 ZINC000336259616 387089347 /nfs/dbraw/zinc/08/93/47/387089347.db2.gz OSJPRSWSKOCETO-WDEREUQCSA-N 1 2 236.290 2.057 20 0 BEADLO C[C@@H](C(=O)Nc1ccccc1)[N@H+]1CC[C@@H](F)C1 ZINC000336259616 387089350 /nfs/dbraw/zinc/08/93/50/387089350.db2.gz OSJPRSWSKOCETO-WDEREUQCSA-N 1 2 236.290 2.057 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2nnc(-c3ccccc3)o2)C1 ZINC000336259588 387089824 /nfs/dbraw/zinc/08/98/24/387089824.db2.gz NAUVOGJRFYTMRS-LLVKDONJSA-N 1 2 247.273 2.280 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2nnc(-c3ccccc3)o2)C1 ZINC000336259588 387089828 /nfs/dbraw/zinc/08/98/28/387089828.db2.gz NAUVOGJRFYTMRS-LLVKDONJSA-N 1 2 247.273 2.280 20 0 BEADLO CCc1nc(C[N@H+]2[C@H](C)CCC[C@@H]2C)no1 ZINC000066665442 387090237 /nfs/dbraw/zinc/09/02/37/387090237.db2.gz DADBCUDNYMLVKZ-AOOOYVTPSA-N 1 2 223.320 2.395 20 0 BEADLO CCc1nc(C[N@@H+]2[C@H](C)CCC[C@@H]2C)no1 ZINC000066665442 387090243 /nfs/dbraw/zinc/09/02/43/387090243.db2.gz DADBCUDNYMLVKZ-AOOOYVTPSA-N 1 2 223.320 2.395 20 0 BEADLO CC(C)(C(=O)Nc1cccc(O)c1)c1c[nH+]c[nH]1 ZINC000336260221 387094910 /nfs/dbraw/zinc/09/49/10/387094910.db2.gz YGPJODYINHLYMT-UHFFFAOYSA-N 1 2 245.282 2.032 20 0 BEADLO CC(C)(C(=O)Nc1cccc(O)c1)c1c[nH]c[nH+]1 ZINC000336260221 387094911 /nfs/dbraw/zinc/09/49/11/387094911.db2.gz YGPJODYINHLYMT-UHFFFAOYSA-N 1 2 245.282 2.032 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2C[C@@H]2c2ccccc2)c[nH+]1 ZINC000335002049 387096180 /nfs/dbraw/zinc/09/61/80/387096180.db2.gz BKTOWWMSZIFNIU-VXGBXAGGSA-N 1 2 241.294 2.004 20 0 BEADLO Cc1nc(N2CC3(C[C@@H]2C)CCOCC3)cc[nH+]1 ZINC000645381369 387098154 /nfs/dbraw/zinc/09/81/54/387098154.db2.gz FJRWLBDCUVYXDA-NSHDSACASA-N 1 2 247.342 2.180 20 0 BEADLO Cc1ccc(NC(=O)NCc2[nH]cc[nH+]2)c(C)c1 ZINC000119125176 387099752 /nfs/dbraw/zinc/09/97/52/387099752.db2.gz NPKUAYRRWOBPGA-UHFFFAOYSA-N 1 2 244.298 2.348 20 0 BEADLO CC[C@@H]1CC[C@H](C)N(C(=O)Cc2[nH]c[nH+]c2C)C1 ZINC000335007566 387103469 /nfs/dbraw/zinc/10/34/69/387103469.db2.gz QTUTWTAWVDYLBN-CMPLNLGQSA-N 1 2 249.358 2.298 20 0 BEADLO Cc1ccc(NC(=O)c2ccncc2)c(C)[nH+]1 ZINC000119295266 387114460 /nfs/dbraw/zinc/11/44/60/387114460.db2.gz PRUVMCIJFIGVQO-UHFFFAOYSA-N 1 2 227.267 2.346 20 0 BEADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc[nH]n1 ZINC000336284536 387118963 /nfs/dbraw/zinc/11/89/63/387118963.db2.gz ZIXSULGYJOJFSA-APPZFPTMSA-N 1 2 233.237 2.182 20 0 BEADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1cc[nH]n1 ZINC000336284536 387118965 /nfs/dbraw/zinc/11/89/65/387118965.db2.gz ZIXSULGYJOJFSA-APPZFPTMSA-N 1 2 233.237 2.182 20 0 BEADLO CO[C@H]([C@@H](C)Nc1cc[nH+]c(C(C)C)n1)C1CC1 ZINC000450867735 533211018 /nfs/dbraw/zinc/21/10/18/533211018.db2.gz ZTWKYUHJKHYBRB-ZWNOBZJWSA-N 1 2 249.358 2.247 20 0 BEADLO FCCCC[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000352401188 387147949 /nfs/dbraw/zinc/14/79/49/387147949.db2.gz HCYQVHPIKITZHL-LBPRGKRZSA-N 1 2 248.305 2.233 20 0 BEADLO C[C@@H]1C[C@H](Nc2cc(NC3CC3)[nH+]cn2)CCO1 ZINC000334027496 387149502 /nfs/dbraw/zinc/14/95/02/387149502.db2.gz IHBPYBVXSMNHJS-MWLCHTKSSA-N 1 2 248.330 2.030 20 0 BEADLO C[C@@H]1C[C@H](Nc2cc(NC3CC3)nc[nH+]2)CCO1 ZINC000334027496 387149505 /nfs/dbraw/zinc/14/95/05/387149505.db2.gz IHBPYBVXSMNHJS-MWLCHTKSSA-N 1 2 248.330 2.030 20 0 BEADLO FC(F)[C@@H]1CCC[N@@H+]1CCc1ccncc1 ZINC000353192855 387153082 /nfs/dbraw/zinc/15/30/82/387153082.db2.gz MKDFXIOVRMAQIQ-NSHDSACASA-N 1 2 226.270 2.354 20 0 BEADLO FC(F)[C@@H]1CCC[N@H+]1CCc1ccncc1 ZINC000353192855 387153086 /nfs/dbraw/zinc/15/30/86/387153086.db2.gz MKDFXIOVRMAQIQ-NSHDSACASA-N 1 2 226.270 2.354 20 0 BEADLO CC(C)(NC(=O)c1ccc2[nH+]ccn2c1)C1CC1 ZINC000336326724 387154448 /nfs/dbraw/zinc/15/44/48/387154448.db2.gz KKHNACNHOKRDEL-UHFFFAOYSA-N 1 2 243.310 2.253 20 0 BEADLO Oc1cccnc1C[N@@H+]1CCC[C@@H]1C(F)F ZINC000571841720 387180626 /nfs/dbraw/zinc/18/06/26/387180626.db2.gz JVTPWKJSKKEUSG-SECBINFHSA-N 1 2 228.242 2.017 20 0 BEADLO Oc1cccnc1C[N@H+]1CCC[C@@H]1C(F)F ZINC000571841720 387180631 /nfs/dbraw/zinc/18/06/31/387180631.db2.gz JVTPWKJSKKEUSG-SECBINFHSA-N 1 2 228.242 2.017 20 0 BEADLO Cc1ccc(C[S@@](=O)CC2CC2)c(C)[nH+]1 ZINC000187229129 387180754 /nfs/dbraw/zinc/18/07/54/387180754.db2.gz LDIUYXJUACHJMC-HNNXBMFYSA-N 1 2 223.341 2.357 20 0 BEADLO CC(=O)Nc1ccccc1-c1[nH]cc(C)[nH+]1 ZINC000336309979 387138888 /nfs/dbraw/zinc/13/88/88/387138888.db2.gz XXKOPBOABWHIPY-UHFFFAOYSA-N 1 2 215.256 2.344 20 0 BEADLO CCC[C@@H]1C[C@@H]1C(=O)NCCNc1cccc[nH+]1 ZINC000360000613 387209486 /nfs/dbraw/zinc/20/94/86/387209486.db2.gz LOLSHGMLJYAVBS-NEPJUHHUSA-N 1 2 247.342 2.046 20 0 BEADLO CCC[C@H]1C[C@H]1C(=O)NCCNc1cccc[nH+]1 ZINC000360000614 387209657 /nfs/dbraw/zinc/20/96/57/387209657.db2.gz LOLSHGMLJYAVBS-NWDGAFQWSA-N 1 2 247.342 2.046 20 0 BEADLO O=S1CC[NH+](CCCC2CCCC2)CC1 ZINC000120270601 387217717 /nfs/dbraw/zinc/21/77/17/387217717.db2.gz LQVBBTNBMILIBX-UHFFFAOYSA-N 1 2 229.389 2.021 20 0 BEADLO c1ccc(N2CCOCC3(CCC3)C2)[nH+]c1 ZINC000336393356 387222269 /nfs/dbraw/zinc/22/22/69/387222269.db2.gz STNHPPLVMOPICJ-UHFFFAOYSA-N 1 2 218.300 2.089 20 0 BEADLO c1nc(C[N@@H+]2Cc3ccccc3C3(CC3)C2)c[nH]1 ZINC000187677242 387224005 /nfs/dbraw/zinc/22/40/05/387224005.db2.gz QIDJRHPQQJHPPB-UHFFFAOYSA-N 1 2 239.322 2.457 20 0 BEADLO c1nc(C[N@H+]2Cc3ccccc3C3(CC3)C2)c[nH]1 ZINC000187677242 387224009 /nfs/dbraw/zinc/22/40/09/387224009.db2.gz QIDJRHPQQJHPPB-UHFFFAOYSA-N 1 2 239.322 2.457 20 0 BEADLO c1ncc(C[N@@H+]2Cc3ccccc3C3(CC3)C2)[nH]1 ZINC000187677242 387224016 /nfs/dbraw/zinc/22/40/16/387224016.db2.gz QIDJRHPQQJHPPB-UHFFFAOYSA-N 1 2 239.322 2.457 20 0 BEADLO c1ncc(C[N@H+]2Cc3ccccc3C3(CC3)C2)[nH]1 ZINC000187677242 387224020 /nfs/dbraw/zinc/22/40/20/387224020.db2.gz QIDJRHPQQJHPPB-UHFFFAOYSA-N 1 2 239.322 2.457 20 0 BEADLO Cc1noc([C@H]2CCC[N@@H+]2Cc2cnoc2C)n1 ZINC000353553817 387228068 /nfs/dbraw/zinc/22/80/68/387228068.db2.gz GUGDWPYTCTZOAR-LLVKDONJSA-N 1 2 248.286 2.012 20 0 BEADLO Cc1noc([C@H]2CCC[N@H+]2Cc2cnoc2C)n1 ZINC000353553817 387228071 /nfs/dbraw/zinc/22/80/71/387228071.db2.gz GUGDWPYTCTZOAR-LLVKDONJSA-N 1 2 248.286 2.012 20 0 BEADLO FC(F)C[NH2+][C@@H]1CCO[C@H]1c1ccccc1 ZINC000191940674 387232587 /nfs/dbraw/zinc/23/25/87/387232587.db2.gz KPHAQUOXPWRQJY-PWSUYJOCSA-N 1 2 227.254 2.371 20 0 BEADLO c1coc(-c2noc(C[N@@H+]3CCC34CCC4)n2)c1 ZINC000336408498 387238367 /nfs/dbraw/zinc/23/83/67/387238367.db2.gz HQNOIWJSPUOKNB-UHFFFAOYSA-N 1 2 245.282 2.458 20 0 BEADLO c1coc(-c2noc(C[N@H+]3CCC34CCC4)n2)c1 ZINC000336408498 387238371 /nfs/dbraw/zinc/23/83/71/387238371.db2.gz HQNOIWJSPUOKNB-UHFFFAOYSA-N 1 2 245.282 2.458 20 0 BEADLO CO[C@H]1CCCN(c2nc(C)[nH+]c(C)c2C)CC1 ZINC000371744796 387245105 /nfs/dbraw/zinc/24/51/05/387245105.db2.gz UKHCHZBFCBORQM-ZDUSSCGKSA-N 1 2 249.358 2.407 20 0 BEADLO CCN(C[C@H](C)OC)c1cc[nH+]c(C(C)C)n1 ZINC000360238577 387248865 /nfs/dbraw/zinc/24/88/65/387248865.db2.gz NJWIZBAJPOBTQD-NSHDSACASA-N 1 2 237.347 2.461 20 0 BEADLO CCN(CC1CCC1)C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000571894645 387195176 /nfs/dbraw/zinc/19/51/76/387195176.db2.gz HMHAUKKCBNRXRB-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO CCN(CC1CCC1)C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000571894645 387195182 /nfs/dbraw/zinc/19/51/82/387195182.db2.gz HMHAUKKCBNRXRB-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO Cc1cc(NCc2cc(F)cc(F)c2)nc[nH+]1 ZINC000336365010 387196548 /nfs/dbraw/zinc/19/65/48/387196548.db2.gz BRAQAVLLROIJER-UHFFFAOYSA-N 1 2 235.237 2.097 20 0 BEADLO CC[C@@H]1[C@@H](C)CCN1C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000514949019 387311880 /nfs/dbraw/zinc/31/18/80/387311880.db2.gz FUZILWVMIASIRQ-DMDPSCGWSA-N 1 2 249.358 2.235 20 0 BEADLO CC[C@@H]1[C@@H](C)CCN1C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000514949019 387311884 /nfs/dbraw/zinc/31/18/84/387311884.db2.gz FUZILWVMIASIRQ-DMDPSCGWSA-N 1 2 249.358 2.235 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@@H](c3ccco3)C2)on1 ZINC000336485048 387313495 /nfs/dbraw/zinc/31/34/95/387313495.db2.gz HONNCIWNKGKBIF-CYBMUJFWSA-N 1 2 248.282 2.150 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@@H](c3ccco3)C2)on1 ZINC000336485048 387313499 /nfs/dbraw/zinc/31/34/99/387313499.db2.gz HONNCIWNKGKBIF-CYBMUJFWSA-N 1 2 248.282 2.150 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)n1 ZINC000336445857 387272567 /nfs/dbraw/zinc/27/25/67/387272567.db2.gz XJMDPEPOTMGFCS-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccnc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)n1 ZINC000336445857 387272572 /nfs/dbraw/zinc/27/25/72/387272572.db2.gz XJMDPEPOTMGFCS-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)nc1 ZINC000336445835 387272641 /nfs/dbraw/zinc/27/26/41/387272641.db2.gz MFBCHSISDHIWIV-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)nc1 ZINC000336445835 387272643 /nfs/dbraw/zinc/27/26/43/387272643.db2.gz MFBCHSISDHIWIV-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1[nH]c(C(=O)NC2[C@H](C)CCC[C@H]2C)c[nH+]1 ZINC000267159261 387278368 /nfs/dbraw/zinc/27/83/68/387278368.db2.gz YOBSJUZVLCTKED-RKDXNWHRSA-N 1 2 235.331 2.273 20 0 BEADLO C[C@@H](N[C@H](C1CC1)C(F)(F)F)c1[nH+]ccn1C ZINC000352519737 387286160 /nfs/dbraw/zinc/28/61/60/387286160.db2.gz RGUMQLZNLQXPNA-VXNVDRBHSA-N 1 2 247.264 2.412 20 0 BEADLO CCc1ccc(C[N@H+](C)Cc2ncnn2C)cc1 ZINC000354041182 387318075 /nfs/dbraw/zinc/31/80/75/387318075.db2.gz RDYXEPYESHEQCC-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO CCc1ccc(C[N@@H+](C)Cc2ncnn2C)cc1 ZINC000354041182 387318080 /nfs/dbraw/zinc/31/80/80/387318080.db2.gz RDYXEPYESHEQCC-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO O=C(CC(F)(F)F)Nc1cccc2[nH+]ccn21 ZINC000336476357 387304114 /nfs/dbraw/zinc/30/41/14/387304114.db2.gz OVOQEHIJGZBBRW-UHFFFAOYSA-N 1 2 243.188 2.225 20 0 BEADLO O=C(CC(F)(F)F)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000336532677 387354705 /nfs/dbraw/zinc/35/47/05/387354705.db2.gz LRVXKCIDHAEVGW-SSDOTTSWSA-N 1 2 247.220 2.026 20 0 BEADLO COc1nccnc1C[NH2+][C@@H](C)c1ccsc1 ZINC000648571072 387355212 /nfs/dbraw/zinc/35/52/12/387355212.db2.gz BQQCUDWIUGGCPQ-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO Cc1noc(C[N@@H+]2CC[C@@H]2c2ccccc2)n1 ZINC000336553385 387374142 /nfs/dbraw/zinc/37/41/42/387374142.db2.gz YKJGFWIEFFHAMK-GFCCVEGCSA-N 1 2 229.283 2.325 20 0 BEADLO Cc1noc(C[N@H+]2CC[C@@H]2c2ccccc2)n1 ZINC000336553385 387374146 /nfs/dbraw/zinc/37/41/46/387374146.db2.gz YKJGFWIEFFHAMK-GFCCVEGCSA-N 1 2 229.283 2.325 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H]1C[C@@H](c2ccccc2)[C@@H]1C ZINC000373491670 387374663 /nfs/dbraw/zinc/37/46/63/387374663.db2.gz XBLAYPWFCOLABJ-OIMNJJJWSA-N 1 2 247.338 2.330 20 0 BEADLO Cc1noc(C[N@@H+]2CC[C@H]2c2ccccc2)n1 ZINC000336553386 387375108 /nfs/dbraw/zinc/37/51/08/387375108.db2.gz YKJGFWIEFFHAMK-LBPRGKRZSA-N 1 2 229.283 2.325 20 0 BEADLO Cc1noc(C[N@H+]2CC[C@H]2c2ccccc2)n1 ZINC000336553386 387375112 /nfs/dbraw/zinc/37/51/12/387375112.db2.gz YKJGFWIEFFHAMK-LBPRGKRZSA-N 1 2 229.283 2.325 20 0 BEADLO Cc1ccc(CCC(=O)NCc2c[nH+]c[nH]2)s1 ZINC000354453564 387378733 /nfs/dbraw/zinc/37/87/33/387378733.db2.gz NOZZIQRABULVNH-UHFFFAOYSA-N 1 2 249.339 2.029 20 0 BEADLO Cc1ccc(CCC(=O)NCc2c[nH]c[nH+]2)s1 ZINC000354453564 387378737 /nfs/dbraw/zinc/37/87/37/387378737.db2.gz NOZZIQRABULVNH-UHFFFAOYSA-N 1 2 249.339 2.029 20 0 BEADLO COC(=O)[C@@H]1CCCCC[N@@H+]1C/C=C/Cl ZINC000360987136 387381967 /nfs/dbraw/zinc/38/19/67/387381967.db2.gz YZSCJELCCNNABD-STUBTGCMSA-N 1 2 231.723 2.157 20 0 BEADLO COC(=O)[C@@H]1CCCCC[N@H+]1C/C=C/Cl ZINC000360987136 387381969 /nfs/dbraw/zinc/38/19/69/387381969.db2.gz YZSCJELCCNNABD-STUBTGCMSA-N 1 2 231.723 2.157 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2CCO[C@@H]2C)c(C)[nH+]1 ZINC000336494264 387321256 /nfs/dbraw/zinc/32/12/56/387321256.db2.gz JUKBHIUZQUONLK-GHMZBOCLSA-N 1 2 234.299 2.062 20 0 BEADLO C/C=C(\CC)C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000372765319 387324146 /nfs/dbraw/zinc/32/41/46/387324146.db2.gz ITPNZPZYQZFRDK-LFJXOHPOSA-N 1 2 233.315 2.430 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2CO[C@H](C)C2)c(C)[nH+]1 ZINC000336502370 387327802 /nfs/dbraw/zinc/32/78/02/387327802.db2.gz BETSMAVZQSCZPF-MWLCHTKSSA-N 1 2 234.299 2.062 20 0 BEADLO CCc1ccc(C[N@@H+]2CCOCC23CC3)nc1 ZINC000336511220 387336643 /nfs/dbraw/zinc/33/66/43/387336643.db2.gz ZLSKIFYESALACG-UHFFFAOYSA-N 1 2 232.327 2.009 20 0 BEADLO CCc1ccc(C[N@H+]2CCOCC23CC3)nc1 ZINC000336511220 387336646 /nfs/dbraw/zinc/33/66/46/387336646.db2.gz ZLSKIFYESALACG-UHFFFAOYSA-N 1 2 232.327 2.009 20 0 BEADLO COc1cc(C)ccc1C[NH2+]Cc1ccon1 ZINC000648466721 387353002 /nfs/dbraw/zinc/35/30/02/387353002.db2.gz QZNMEYFLEWEPNG-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO FCCC[N@@H+]1CCOC[C@H]1c1ccco1 ZINC000361247053 387424505 /nfs/dbraw/zinc/42/45/05/387424505.db2.gz UNNRWJWOGSNOGW-JTQLQIEISA-N 1 2 213.252 2.013 20 0 BEADLO FCCC[N@H+]1CCOC[C@H]1c1ccco1 ZINC000361247053 387424508 /nfs/dbraw/zinc/42/45/08/387424508.db2.gz UNNRWJWOGSNOGW-JTQLQIEISA-N 1 2 213.252 2.013 20 0 BEADLO C[N@H+](CCCO[C@H]1CCCCO1)CC(F)F ZINC000361273706 387429266 /nfs/dbraw/zinc/42/92/66/387429266.db2.gz OYQXTJJAIYIASB-NSHDSACASA-N 1 2 237.290 2.117 20 0 BEADLO C[N@@H+](CCCO[C@H]1CCCCO1)CC(F)F ZINC000361273706 387429273 /nfs/dbraw/zinc/42/92/73/387429273.db2.gz OYQXTJJAIYIASB-NSHDSACASA-N 1 2 237.290 2.117 20 0 BEADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ncccn1 ZINC000336615892 387457048 /nfs/dbraw/zinc/45/70/48/387457048.db2.gz OREQRIGCCAUVQN-BDAKNGLRSA-N 1 2 245.248 2.249 20 0 BEADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ncccn1 ZINC000336615892 387457053 /nfs/dbraw/zinc/45/70/53/387457053.db2.gz OREQRIGCCAUVQN-BDAKNGLRSA-N 1 2 245.248 2.249 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1C[C@H](C)OC[C@H]1C ZINC000336617987 387459400 /nfs/dbraw/zinc/45/94/00/387459400.db2.gz PCEBOLIUXLOJLX-NEPJUHHUSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)n1nccc1C[N@H+]1C[C@H](C)OC[C@H]1C ZINC000336617987 387459406 /nfs/dbraw/zinc/45/94/06/387459406.db2.gz PCEBOLIUXLOJLX-NEPJUHHUSA-N 1 2 237.347 2.073 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC000336562507 387388883 /nfs/dbraw/zinc/38/88/83/387388883.db2.gz BCOFZTDOVLKAEM-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000336562507 387388886 /nfs/dbraw/zinc/38/88/86/387388886.db2.gz BCOFZTDOVLKAEM-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccncn1)c1cscn1 ZINC000515500517 387391186 /nfs/dbraw/zinc/39/11/86/387391186.db2.gz LQIUWNILHKWPQB-DTWKUNHWSA-N 1 2 234.328 2.345 20 0 BEADLO CCCCNC(=O)C[N@@H+]1Cc2ccccc2[C@H]1C ZINC000361072671 387395851 /nfs/dbraw/zinc/39/58/51/387395851.db2.gz FSVLUGHXUBTPMY-GFCCVEGCSA-N 1 2 246.354 2.480 20 0 BEADLO CCCCNC(=O)C[N@H+]1Cc2ccccc2[C@H]1C ZINC000361072671 387395855 /nfs/dbraw/zinc/39/58/55/387395855.db2.gz FSVLUGHXUBTPMY-GFCCVEGCSA-N 1 2 246.354 2.480 20 0 BEADLO CCCCNC(=O)C[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000361072672 387396681 /nfs/dbraw/zinc/39/66/81/387396681.db2.gz FSVLUGHXUBTPMY-LBPRGKRZSA-N 1 2 246.354 2.480 20 0 BEADLO CCCCNC(=O)C[N@H+]1Cc2ccccc2[C@@H]1C ZINC000361072672 387396685 /nfs/dbraw/zinc/39/66/85/387396685.db2.gz FSVLUGHXUBTPMY-LBPRGKRZSA-N 1 2 246.354 2.480 20 0 BEADLO CO[C@H]1CCCC[C@H]1Nc1cc[nH+]c(C(C)C)n1 ZINC000361137790 387404382 /nfs/dbraw/zinc/40/43/82/387404382.db2.gz AZCCOXOIMBWVJY-NEPJUHHUSA-N 1 2 249.358 2.391 20 0 BEADLO CC[C@H]([NH2+]C/C=C/c1ccccc1)C(=O)OC ZINC000083360011 387404825 /nfs/dbraw/zinc/40/48/25/387404825.db2.gz WNODKHWMYPYSNS-RSPDNQDQSA-N 1 2 233.311 2.241 20 0 BEADLO Cc1cnc(C[NH2+][C@H](C)c2ccccn2)nc1 ZINC000361149975 387407261 /nfs/dbraw/zinc/40/72/61/387407261.db2.gz XDVPEHDZVXXHSG-LLVKDONJSA-N 1 2 228.299 2.031 20 0 BEADLO CC(C)C[C@@H](C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000361212053 387417737 /nfs/dbraw/zinc/41/77/37/387417737.db2.gz SBIOZTADAYIEAS-SNVBAGLBSA-N 1 2 223.320 2.050 20 0 BEADLO Cc1nc(N2CCC3(CCOCC3)[C@H]2C)cc[nH+]1 ZINC000374926306 387498708 /nfs/dbraw/zinc/49/87/08/387498708.db2.gz FGUPFZBYRQPFAY-LLVKDONJSA-N 1 2 247.342 2.180 20 0 BEADLO CC[C@H](NC(=O)C[C@@H]1CC[C@H]2C[C@H]21)c1[nH]cc[nH+]1 ZINC000516394269 387504449 /nfs/dbraw/zinc/50/44/49/387504449.db2.gz GZQOHQXXOSQAPK-YFKTTZPYSA-N 1 2 247.342 2.413 20 0 BEADLO Cc1c[nH+]cc(N[C@@H]2CCOC[C@@H]2C)c1 ZINC000192645206 387509992 /nfs/dbraw/zinc/50/99/92/387509992.db2.gz UFVQMUOVDJYWFY-CMPLNLGQSA-N 1 2 206.289 2.227 20 0 BEADLO COC(=O)[C@H]([NH2+]C/C=C/c1ccccc1)C(C)C ZINC000043442148 387510604 /nfs/dbraw/zinc/51/06/04/387510604.db2.gz WZVAHTHYFHJSIE-DNGMOHDESA-N 1 2 247.338 2.487 20 0 BEADLO COc1cccc2c(N[C@@H]3CC[C@H]3O)cc[nH+]c12 ZINC000425290766 387522991 /nfs/dbraw/zinc/52/29/91/387522991.db2.gz YALFIHQKKAPKSS-VXGBXAGGSA-N 1 2 244.294 2.179 20 0 BEADLO Cc1cnc(CNc2[nH+]c3ccccc3n2C)o1 ZINC000192732537 387532642 /nfs/dbraw/zinc/53/26/42/387532642.db2.gz DIRWGCVPNBFIEP-UHFFFAOYSA-N 1 2 242.282 2.482 20 0 BEADLO C[C@H](CO)CSCc1c[nH+]c2ccccn12 ZINC000305064037 387544640 /nfs/dbraw/zinc/54/46/40/387544640.db2.gz HHOUMAUJDJGREK-SNVBAGLBSA-N 1 2 236.340 2.196 20 0 BEADLO Cc1cn2c([nH+]1)CN(C(=O)CCC1CCC1)CC2 ZINC000374663555 387478468 /nfs/dbraw/zinc/47/84/68/387478468.db2.gz NIXKPJYSPWEHPW-UHFFFAOYSA-N 1 2 247.342 2.114 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCc3ccccc3C2)n1 ZINC000336627755 387481132 /nfs/dbraw/zinc/48/11/32/387481132.db2.gz DWJJFMNTIHTMPU-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1ccnc(C[N@H+]2CCc3ccccc3C2)n1 ZINC000336627755 387481136 /nfs/dbraw/zinc/48/11/36/387481136.db2.gz DWJJFMNTIHTMPU-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO COC(=O)C[N@@H+]1CCC[C@H]1/C=C/c1ccccc1 ZINC000374768508 387490408 /nfs/dbraw/zinc/49/04/08/387490408.db2.gz RZWYGUBMAMPRSK-HBWSCVEGSA-N 1 2 245.322 2.337 20 0 BEADLO COC(=O)C[N@H+]1CCC[C@H]1/C=C/c1ccccc1 ZINC000374768508 387490417 /nfs/dbraw/zinc/49/04/17/387490417.db2.gz RZWYGUBMAMPRSK-HBWSCVEGSA-N 1 2 245.322 2.337 20 0 BEADLO Cn1ccc(CNc2ccc3c(c2)CCC[NH2+]3)n1 ZINC000516258109 387490651 /nfs/dbraw/zinc/49/06/51/387490651.db2.gz KPBYSEGZWRQTAA-UHFFFAOYSA-N 1 2 242.326 2.390 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H]1C[C@@H](c2ccccc2)[C@@H]1C ZINC000355171982 387492075 /nfs/dbraw/zinc/49/20/75/387492075.db2.gz XBLAYPWFCOLABJ-CDGCEXEKSA-N 1 2 247.338 2.330 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000362186410 387582045 /nfs/dbraw/zinc/58/20/45/387582045.db2.gz YRMNBKFBHICABT-DGCLKSJQSA-N 1 2 233.311 2.385 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+]1CC[C@@H]1c1ccccc1 ZINC000362186410 387582051 /nfs/dbraw/zinc/58/20/51/387582051.db2.gz YRMNBKFBHICABT-DGCLKSJQSA-N 1 2 233.311 2.385 20 0 BEADLO c1cc(C[NH2+]Cc2cccc3cccnc32)[nH]n1 ZINC000041014649 387588565 /nfs/dbraw/zinc/58/85/65/387588565.db2.gz LFRBZEQKVSJUEM-UHFFFAOYSA-N 1 2 238.294 2.248 20 0 BEADLO c1c[nH+]c(COCCCOc2ccccc2)[nH]1 ZINC000123843687 387595764 /nfs/dbraw/zinc/59/57/64/387595764.db2.gz FWYFJVASCNEKMJ-UHFFFAOYSA-N 1 2 232.283 2.395 20 0 BEADLO CC1=C[C@@H](C)C[N@@H+](Cc2ncnn2CC(C)C)C1 ZINC000430258781 387600742 /nfs/dbraw/zinc/60/07/42/387600742.db2.gz DCWDRSXJUSIORS-GFCCVEGCSA-N 1 2 248.374 2.332 20 0 BEADLO CC1=C[C@@H](C)C[N@H+](Cc2ncnn2CC(C)C)C1 ZINC000430258781 387600749 /nfs/dbraw/zinc/60/07/49/387600749.db2.gz DCWDRSXJUSIORS-GFCCVEGCSA-N 1 2 248.374 2.332 20 0 BEADLO Cc1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000355989496 387603046 /nfs/dbraw/zinc/60/30/46/387603046.db2.gz PVHJCGOUVTUYCE-UHFFFAOYSA-N 1 2 240.266 2.290 20 0 BEADLO CCc1occc1C(=O)Nc1c[nH+]ccc1OC ZINC000430401992 387615343 /nfs/dbraw/zinc/61/53/43/387615343.db2.gz RBYSTLYAKDWJRV-UHFFFAOYSA-N 1 2 246.266 2.498 20 0 BEADLO CCO[C@@H](C)c1noc(COc2cc[nH+]cc2)n1 ZINC000356102438 387615951 /nfs/dbraw/zinc/61/59/51/387615951.db2.gz WTKNDHZNBPFTBR-VIFPVBQESA-N 1 2 249.270 2.141 20 0 BEADLO CC[C@H]1CCCC[C@H]1C(=O)NCc1c[nH+]c[nH]1 ZINC000356158960 387623091 /nfs/dbraw/zinc/62/30/91/387623091.db2.gz WTRGXOVZIQTCJK-CMPLNLGQSA-N 1 2 235.331 2.242 20 0 BEADLO CC[C@H]1CCCC[C@H]1C(=O)NCc1c[nH]c[nH+]1 ZINC000356158960 387623094 /nfs/dbraw/zinc/62/30/94/387623094.db2.gz WTRGXOVZIQTCJK-CMPLNLGQSA-N 1 2 235.331 2.242 20 0 BEADLO COCC[N@H+](Cc1ccccn1)CC1(F)CC1 ZINC000580483522 387546483 /nfs/dbraw/zinc/54/64/83/387546483.db2.gz JBIYASYHVMWCMP-UHFFFAOYSA-N 1 2 238.306 2.032 20 0 BEADLO COCC[N@@H+](Cc1ccccn1)CC1(F)CC1 ZINC000580483522 387546487 /nfs/dbraw/zinc/54/64/87/387546487.db2.gz JBIYASYHVMWCMP-UHFFFAOYSA-N 1 2 238.306 2.032 20 0 BEADLO C[C@@H](Nc1cc[nH+]c(C2CC2)n1)[C@@H]1CCCOC1 ZINC000355568914 387553256 /nfs/dbraw/zinc/55/32/56/387553256.db2.gz SKELKIDFCAOJKO-ZYHUDNBSSA-N 1 2 247.342 2.003 20 0 BEADLO FC(F)(F)CC[N@@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000376495656 387643681 /nfs/dbraw/zinc/64/36/81/387643681.db2.gz PTIYSDXCEYENCC-QMMMGPOBSA-N 1 2 233.237 2.499 20 0 BEADLO FC(F)(F)CC[N@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000376495656 387643686 /nfs/dbraw/zinc/64/36/86/387643686.db2.gz PTIYSDXCEYENCC-QMMMGPOBSA-N 1 2 233.237 2.499 20 0 BEADLO Cn1c2cc(F)ccc2[nH]c1=[NH+]CC1(C)CC1 ZINC000362644921 387643946 /nfs/dbraw/zinc/64/39/46/387643946.db2.gz WUJCGFUEXGLNLR-UHFFFAOYSA-N 1 2 233.290 2.346 20 0 BEADLO CC[C@@H](NC(=O)c1ccsc1)c1[nH]cc[nH+]1 ZINC000125332038 387651326 /nfs/dbraw/zinc/65/13/26/387651326.db2.gz FGEXOQJAENKGKM-SECBINFHSA-N 1 2 235.312 2.352 20 0 BEADLO CC(C)CC(=O)N1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000125578251 387661007 /nfs/dbraw/zinc/66/10/07/387661007.db2.gz SAHZZSJOYLQGIY-OLZOCXBDSA-N 1 2 249.358 2.339 20 0 BEADLO CCCc1nc(C[N@@H+]2CC[C@H](CC)C2)no1 ZINC000125564662 387661052 /nfs/dbraw/zinc/66/10/52/387661052.db2.gz JVBWBXMMUFXNKG-JTQLQIEISA-N 1 2 223.320 2.254 20 0 BEADLO CCCc1nc(C[N@H+]2CC[C@H](CC)C2)no1 ZINC000125564662 387661056 /nfs/dbraw/zinc/66/10/56/387661056.db2.gz JVBWBXMMUFXNKG-JTQLQIEISA-N 1 2 223.320 2.254 20 0 BEADLO c1coc(CNc2cc[nH+]c3ccncc23)c1 ZINC000362848197 387664080 /nfs/dbraw/zinc/66/40/80/387664080.db2.gz APEQNFPJCACTGX-UHFFFAOYSA-N 1 2 225.251 2.257 20 0 BEADLO c1nc(C[N@@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)co1 ZINC000356516642 387667412 /nfs/dbraw/zinc/66/74/12/387667412.db2.gz FCVLCOHJTVVASC-STQMWFEESA-N 1 2 248.326 2.208 20 0 BEADLO c1nc(C[N@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)co1 ZINC000356516642 387667419 /nfs/dbraw/zinc/66/74/19/387667419.db2.gz FCVLCOHJTVVASC-STQMWFEESA-N 1 2 248.326 2.208 20 0 BEADLO CC[C@H](Cc1cccs1)[NH2+]CC(F)(F)CN ZINC000643519958 387674834 /nfs/dbraw/zinc/67/48/34/387674834.db2.gz NUYXXVSOZOAHDJ-SECBINFHSA-N 1 2 248.342 2.253 20 0 BEADLO CC[C@H](F)C[N@@H+]1CC(=O)N(C(C)C)C(C)(C)C1 ZINC000440772807 387688802 /nfs/dbraw/zinc/68/88/02/387688802.db2.gz CNFNFPJFBPUCQQ-NSHDSACASA-N 1 2 244.354 2.066 20 0 BEADLO CC[C@H](F)C[N@H+]1CC(=O)N(C(C)C)C(C)(C)C1 ZINC000440772807 387688809 /nfs/dbraw/zinc/68/88/09/387688809.db2.gz CNFNFPJFBPUCQQ-NSHDSACASA-N 1 2 244.354 2.066 20 0 BEADLO CCCn1cc(C[N@@H+]2CCOCC23CCC3)cn1 ZINC000128226039 387743199 /nfs/dbraw/zinc/74/31/99/387743199.db2.gz MHVUTIWUINUPEA-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CCCn1cc(C[N@H+]2CCOCC23CCC3)cn1 ZINC000128226039 387743206 /nfs/dbraw/zinc/74/32/06/387743206.db2.gz MHVUTIWUINUPEA-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO COc1ccc[nH+]c1N(C)CCc1ccccn1 ZINC000527823775 387746351 /nfs/dbraw/zinc/74/63/51/387746351.db2.gz LFOLOSBDVQKRNW-UHFFFAOYSA-N 1 2 243.310 2.164 20 0 BEADLO CC[C@H](F)C[N@@H+]1C[C@H](C)N(CC)C[C@@H]1C ZINC000440790281 387698837 /nfs/dbraw/zinc/69/88/37/387698837.db2.gz KKWDGQLPJRDZAQ-SRVKXCTJSA-N 1 2 216.344 2.149 20 0 BEADLO CC[C@H](F)C[N@H+]1C[C@H](C)N(CC)C[C@@H]1C ZINC000440790281 387698839 /nfs/dbraw/zinc/69/88/39/387698839.db2.gz KKWDGQLPJRDZAQ-SRVKXCTJSA-N 1 2 216.344 2.149 20 0 BEADLO C[C@H]1CC[C@@H]1[NH+]=c1[nH]c2ccc(F)cc2n1C ZINC000431414998 387708136 /nfs/dbraw/zinc/70/81/36/387708136.db2.gz PKGVDYAQWWMUBI-WPRPVWTQSA-N 1 2 233.290 2.345 20 0 BEADLO CCCOc1cncc(NCc2cn(C)c[nH+]2)c1 ZINC000527780881 387709599 /nfs/dbraw/zinc/70/95/99/387709599.db2.gz HMGRDXJRYXBSJI-UHFFFAOYSA-N 1 2 246.314 2.216 20 0 BEADLO COc1cncc(COc2cc[nH+]cc2)c1 ZINC000431507939 387710707 /nfs/dbraw/zinc/71/07/07/387710707.db2.gz WAEWMSMHJUHMRR-UHFFFAOYSA-N 1 2 216.240 2.064 20 0 BEADLO CCO[C@@]1(C)C[C@H]1[NH2+]Cc1n[nH]c2ccccc21 ZINC000527783738 387712417 /nfs/dbraw/zinc/71/24/17/387712417.db2.gz RVJFPCPEEGFMOL-KGLIPLIRSA-N 1 2 245.326 2.220 20 0 BEADLO Cc1cc(C)c(CNC(=O)N(C)CC(C)C)c[nH+]1 ZINC000452046358 387714303 /nfs/dbraw/zinc/71/43/03/387714303.db2.gz VTQCQGLRBZOQQW-UHFFFAOYSA-N 1 2 249.358 2.496 20 0 BEADLO Cc1noc([C@H](C)[NH2+]Cc2ccccc2F)n1 ZINC000356871422 387734768 /nfs/dbraw/zinc/73/47/68/387734768.db2.gz UYSLZZBLNGXGLF-QMMMGPOBSA-N 1 2 235.262 2.368 20 0 BEADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1ccn(C)n1 ZINC000356881135 387738937 /nfs/dbraw/zinc/73/89/37/387738937.db2.gz UOKXXTFRHPDTPE-LLVKDONJSA-N 1 2 244.342 2.228 20 0 BEADLO Cc1noc([C@H](C)[NH2+]Cc2cccc(F)c2)n1 ZINC000356890202 387742073 /nfs/dbraw/zinc/74/20/73/387742073.db2.gz FUECEKZCYQKHED-QMMMGPOBSA-N 1 2 235.262 2.368 20 0 BEADLO CC[C@@H]1CN(c2[nH+]cccc2OC)C[C@H](C)O1 ZINC000527890163 387774248 /nfs/dbraw/zinc/77/42/48/387774248.db2.gz MZQGJWJNMMDFCB-WDEREUQCSA-N 1 2 236.315 2.094 20 0 BEADLO Cc1cc(NC(=O)N2CC3CCC2CC3)cc[nH+]1 ZINC000378389103 387780557 /nfs/dbraw/zinc/78/05/57/387780557.db2.gz LPQLBUXROGECKE-UHFFFAOYSA-N 1 2 245.326 2.218 20 0 BEADLO CO[C@@H](CSCCn1cc[nH+]c1)C1CC1 ZINC000424148643 387786739 /nfs/dbraw/zinc/78/67/39/387786739.db2.gz FSCUMFCPAHWGOY-NSHDSACASA-N 1 2 226.345 2.041 20 0 BEADLO Cc1nc(C[NH2+]Cc2ccccn2)sc1C ZINC000049825645 387788189 /nfs/dbraw/zinc/78/81/89/387788189.db2.gz GTZPCWOCZMZKKY-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]Cc1cccnc1C ZINC000527986324 387802354 /nfs/dbraw/zinc/80/23/54/387802354.db2.gz KPIHXNZBYYSGJM-JTQLQIEISA-N 1 2 230.315 2.272 20 0 BEADLO CC[C@]1(C)CN(c2[nH+]cccc2OC)CCO1 ZINC000527984437 387802756 /nfs/dbraw/zinc/80/27/56/387802756.db2.gz WWHSZOFMHXXQKJ-CYBMUJFWSA-N 1 2 236.315 2.096 20 0 BEADLO CCc1nc(C[N@H+](C)[C@H](C)COC)cs1 ZINC000193897958 387807427 /nfs/dbraw/zinc/80/74/27/387807427.db2.gz UKXMAKURYZABJJ-SECBINFHSA-N 1 2 228.361 2.172 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@H](C)COC)cs1 ZINC000193897958 387807430 /nfs/dbraw/zinc/80/74/30/387807430.db2.gz UKXMAKURYZABJJ-SECBINFHSA-N 1 2 228.361 2.172 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ncccc1F)c1ccncn1 ZINC000528038671 387820596 /nfs/dbraw/zinc/82/05/96/387820596.db2.gz WVJKDPHDCORZQS-ZJUUUORDSA-N 1 2 246.289 2.423 20 0 BEADLO CCC[C@@H](C)[NH2+]Cc1[nH]ncc1Br ZINC000379418833 387829486 /nfs/dbraw/zinc/82/94/86/387829486.db2.gz WVDQTVSLWJIVAL-SSDOTTSWSA-N 1 2 246.152 2.450 20 0 BEADLO CCc1ncc(CNc2[nH+]cccc2OC)o1 ZINC000528028828 387832406 /nfs/dbraw/zinc/83/24/06/387832406.db2.gz HQXLNZMMPFDJKY-UHFFFAOYSA-N 1 2 233.271 2.253 20 0 BEADLO O[C@@H]1C[C@H]2CN(c3[nH+]ccc4ccccc43)C[C@H]12 ZINC000528057379 387838802 /nfs/dbraw/zinc/83/88/02/387838802.db2.gz HFZDWJZDFPUIPP-FPMFFAJLSA-N 1 2 240.306 2.052 20 0 BEADLO CCCSCC(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000442802425 387843770 /nfs/dbraw/zinc/84/37/70/387843770.db2.gz RAUPVFHNOPKPEN-VIFPVBQESA-N 1 2 241.360 2.120 20 0 BEADLO CC(C)c1nc(N(C)CCCCCO)cc[nH+]1 ZINC000432943614 387846137 /nfs/dbraw/zinc/84/61/37/387846137.db2.gz IUDGVCKLSZQPMA-UHFFFAOYSA-N 1 2 237.347 2.199 20 0 BEADLO C1=CCC(CNc2cc[nH+]c3ccncc23)C1 ZINC000528112921 387848559 /nfs/dbraw/zinc/84/85/59/387848559.db2.gz FXXPGVFLKJQYHI-UHFFFAOYSA-N 1 2 225.295 2.430 20 0 BEADLO CCC(C)(C)OC1CN(c2cc[nH+]c(C)n2)C1 ZINC000528127771 387849925 /nfs/dbraw/zinc/84/99/25/387849925.db2.gz KSZWNXQISOOKDP-UHFFFAOYSA-N 1 2 235.331 2.179 20 0 BEADLO CCCC1(C(=O)NCc2[nH+]ccn2CC)CCC1 ZINC000452571067 387861828 /nfs/dbraw/zinc/86/18/28/387861828.db2.gz NLBGFGBBKGDJIC-UHFFFAOYSA-N 1 2 249.358 2.490 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)c1cc(C)oc1C ZINC000452574699 387862730 /nfs/dbraw/zinc/86/27/30/387862730.db2.gz NUTAESPYDDVZLV-UHFFFAOYSA-N 1 2 247.298 2.043 20 0 BEADLO COc1ccc[nH+]c1N1CCO[C@H](C2CCC2)C1 ZINC000528033345 387817746 /nfs/dbraw/zinc/81/77/46/387817746.db2.gz AYEARGWTJYUWPA-ZDUSSCGKSA-N 1 2 248.326 2.096 20 0 BEADLO C[C@H]1CCC[C@H](C(=O)Nc2ccc(N)[nH+]c2)C1 ZINC000151669617 387875246 /nfs/dbraw/zinc/87/52/46/387875246.db2.gz WUSSOXLFDHCXPT-UWVGGRQHSA-N 1 2 233.315 2.429 20 0 BEADLO CC(C)n1c[nH+]cc1CNC1(C(F)F)CC1 ZINC000424174092 387875333 /nfs/dbraw/zinc/87/53/33/387875333.db2.gz FJUHGECMPQMTBB-UHFFFAOYSA-N 1 2 229.274 2.351 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2C[C@@H]2C2CCCCC2)c[nH+]1 ZINC000266597354 387878842 /nfs/dbraw/zinc/87/88/42/387878842.db2.gz RNISHEYURSOWMY-VXGBXAGGSA-N 1 2 247.342 2.417 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)[C@]1(C)CC=CCC1 ZINC000448706930 387889161 /nfs/dbraw/zinc/88/91/61/387889161.db2.gz BFYHHETVXAHUJG-GXTWGEPZSA-N 1 2 247.342 2.134 20 0 BEADLO C1=C(C[NH+]2CCN(CC3CC3)CC2)CCC1 ZINC000645778580 387904613 /nfs/dbraw/zinc/90/46/13/387904613.db2.gz AOUOIVXQSWACNQ-UHFFFAOYSA-N 1 2 220.360 2.124 20 0 BEADLO CCCC1(CNc2[nH+]cnc3c2cnn3C)CC1 ZINC000177080673 387914692 /nfs/dbraw/zinc/91/46/92/387914692.db2.gz FTLQGZZHAXJSHV-UHFFFAOYSA-N 1 2 245.330 2.356 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cncs2)[C@@H](C)[C@H](C)O1 ZINC000438363942 387928093 /nfs/dbraw/zinc/92/80/93/387928093.db2.gz MOLVBLHXTZXZJW-UTLUCORTSA-N 1 2 226.345 2.141 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cncs2)[C@@H](C)[C@H](C)O1 ZINC000438363942 387928096 /nfs/dbraw/zinc/92/80/96/387928096.db2.gz MOLVBLHXTZXZJW-UTLUCORTSA-N 1 2 226.345 2.141 20 0 BEADLO FC(F)(F)[C@H]1C[N@H+](CC2=CCCC2)CCO1 ZINC000645807599 387953760 /nfs/dbraw/zinc/95/37/60/387953760.db2.gz PNDJNVQRSGUSIW-SNVBAGLBSA-N 1 2 235.249 2.360 20 0 BEADLO FC(F)(F)[C@H]1C[N@@H+](CC2=CCCC2)CCO1 ZINC000645807599 387953763 /nfs/dbraw/zinc/95/37/63/387953763.db2.gz PNDJNVQRSGUSIW-SNVBAGLBSA-N 1 2 235.249 2.360 20 0 BEADLO Cc1nc(N2CCC[C@H]([C@H]3CCOC3)C2)cc[nH+]1 ZINC000439073514 387978416 /nfs/dbraw/zinc/97/84/16/387978416.db2.gz CPUKMSPBMIBMRC-STQMWFEESA-N 1 2 247.342 2.038 20 0 BEADLO CO[C@@H](C)[C@H](C)Nc1ccc2c(c1)CC[NH2+]2 ZINC000423214212 387997127 /nfs/dbraw/zinc/99/71/27/387997127.db2.gz KYWBXKYZUDONIT-UWVGGRQHSA-N 1 2 220.316 2.490 20 0 BEADLO Cc1cc(NC(=O)NC[C@H]2CCC[C@@H]2C)cc[nH+]1 ZINC000439453912 387998759 /nfs/dbraw/zinc/99/87/59/387998759.db2.gz PELVVBQLAPICBM-CMPLNLGQSA-N 1 2 247.342 2.370 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1nnc(C2CC2)n1C1CC1 ZINC000548754608 388009358 /nfs/dbraw/zinc/00/93/58/388009358.db2.gz AYOFVANKICTVLS-AOOOYVTPSA-N 1 2 246.358 2.473 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1nnc(C2CC2)n1C1CC1 ZINC000548754608 388009361 /nfs/dbraw/zinc/00/93/61/388009361.db2.gz AYOFVANKICTVLS-AOOOYVTPSA-N 1 2 246.358 2.473 20 0 BEADLO Cc1cccc(CN(C)c2cc[nH+]c(C)n2)n1 ZINC000439598212 388009932 /nfs/dbraw/zinc/00/99/32/388009932.db2.gz PLVBGGVBLZLYQQ-UHFFFAOYSA-N 1 2 228.299 2.125 20 0 BEADLO Cc1cc(N2CCC(OCC3CC3)CC2)nc[nH+]1 ZINC000439699708 388014777 /nfs/dbraw/zinc/01/47/77/388014777.db2.gz YPRSABSKUVLMHD-UHFFFAOYSA-N 1 2 247.342 2.180 20 0 BEADLO Cc1ccc(NC(=O)c2cncnc2C)c(C)[nH+]1 ZINC000446434606 388020673 /nfs/dbraw/zinc/02/06/73/388020673.db2.gz MAFBKWZKRZWXAV-UHFFFAOYSA-N 1 2 242.282 2.049 20 0 BEADLO COC[C@H](C)CC(=O)Nc1ccc(C)[nH+]c1C ZINC000446436580 388020892 /nfs/dbraw/zinc/02/08/92/388020892.db2.gz TWNPBXTXPUFFBZ-SECBINFHSA-N 1 2 236.315 2.310 20 0 BEADLO CSCCN(C)c1cc[nH+]c2ccncc21 ZINC000446852802 388042059 /nfs/dbraw/zinc/04/20/59/388042059.db2.gz LQNVBWNRLUMQRE-UHFFFAOYSA-N 1 2 233.340 2.429 20 0 BEADLO CSCCN(C)c1cc(C)[nH+]c(C2CC2)n1 ZINC000446852770 388042669 /nfs/dbraw/zinc/04/26/69/388042669.db2.gz QUUFYDNYIMXFBO-UHFFFAOYSA-N 1 2 237.372 2.462 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CC[S@@](=O)C(CC)(CC)C1 ZINC000440497532 388044634 /nfs/dbraw/zinc/04/46/34/388044634.db2.gz HUXZXRHBNGUPBA-BDJLRTHQSA-N 1 2 249.395 2.358 20 0 BEADLO CC[C@@H](F)C[N@H+]1CC[S@@](=O)C(CC)(CC)C1 ZINC000440497532 388044636 /nfs/dbraw/zinc/04/46/36/388044636.db2.gz HUXZXRHBNGUPBA-BDJLRTHQSA-N 1 2 249.395 2.358 20 0 BEADLO CC[C@@H](N[C@H](C)c1[nH+]ccn1C)C(F)F ZINC000453252160 388027187 /nfs/dbraw/zinc/02/71/87/388027187.db2.gz UUUWTQOAIWGRHZ-HTQZYQBOSA-N 1 2 217.263 2.114 20 0 BEADLO CC[C@@H](F)CN1CC[NH+](C[C@H](F)CC)CC1 ZINC000440694991 388069881 /nfs/dbraw/zinc/06/98/81/388069881.db2.gz SIJJBQHKLMWWSK-VXGBXAGGSA-N 1 2 234.334 2.100 20 0 BEADLO CCOC(=O)[C@@H]1CCCC[N@@H+]1C[C@H](F)CC ZINC000440704071 388071823 /nfs/dbraw/zinc/07/18/23/388071823.db2.gz UQZXRAMLKONVMG-MNOVXSKESA-N 1 2 231.311 2.152 20 0 BEADLO CCOC(=O)[C@@H]1CCCC[N@H+]1C[C@H](F)CC ZINC000440704071 388071828 /nfs/dbraw/zinc/07/18/28/388071828.db2.gz UQZXRAMLKONVMG-MNOVXSKESA-N 1 2 231.311 2.152 20 0 BEADLO CSCC[N@@H+]1CCCC[C@@H]1C(F)F ZINC000336657721 388073594 /nfs/dbraw/zinc/07/35/94/388073594.db2.gz RFMDBOXOPHDLMA-MRVPVSSYSA-N 1 2 209.305 2.469 20 0 BEADLO CSCC[N@H+]1CCCC[C@@H]1C(F)F ZINC000336657721 388073597 /nfs/dbraw/zinc/07/35/97/388073597.db2.gz RFMDBOXOPHDLMA-MRVPVSSYSA-N 1 2 209.305 2.469 20 0 BEADLO Cc1cscc1C[NH2+]Cc1cocn1 ZINC000336659087 388084123 /nfs/dbraw/zinc/08/41/23/388084123.db2.gz QTKXFDKRXXZHCK-UHFFFAOYSA-N 1 2 208.286 2.334 20 0 BEADLO Cc1ccc(NCc2c[nH+]cn2C)cc1F ZINC000085167740 388084846 /nfs/dbraw/zinc/08/48/46/388084846.db2.gz WRTCUMJHKJBDSQ-UHFFFAOYSA-N 1 2 219.263 2.480 20 0 BEADLO O=C1C[N@H+](CC2CCCCCC2)CN1C1CC1 ZINC000447908978 388101853 /nfs/dbraw/zinc/10/18/53/388101853.db2.gz VSMKZGKIWJCFMY-UHFFFAOYSA-N 1 2 236.359 2.221 20 0 BEADLO O=C1C[N@@H+](CC2CCCCCC2)CN1C1CC1 ZINC000447908978 388101855 /nfs/dbraw/zinc/10/18/55/388101855.db2.gz VSMKZGKIWJCFMY-UHFFFAOYSA-N 1 2 236.359 2.221 20 0 BEADLO CCOCCCC(=O)Nc1ccc(C)[nH+]c1C ZINC000119100783 388103936 /nfs/dbraw/zinc/10/39/36/388103936.db2.gz RCZDCPBXEAWLGU-UHFFFAOYSA-N 1 2 236.315 2.454 20 0 BEADLO CC[C@H](C)NC(=O)N[C@H](C)c1[nH+]ccn1CC ZINC000454185529 388104580 /nfs/dbraw/zinc/10/45/80/388104580.db2.gz IHFPTOAMTVWLFT-VHSXEESVSA-N 1 2 238.335 2.062 20 0 BEADLO Cc1cc(C)c(CNC(=O)N[C@@H](C)C2CC2)c[nH+]1 ZINC000454187153 388105170 /nfs/dbraw/zinc/10/51/70/388105170.db2.gz CNDPSUHARHCHTI-NSHDSACASA-N 1 2 247.342 2.296 20 0 BEADLO CCCCNC(=O)N[C@H](C)c1[nH+]ccn1CC ZINC000454195099 388107089 /nfs/dbraw/zinc/10/70/89/388107089.db2.gz ZGFHTKLLHILCNV-SNVBAGLBSA-N 1 2 238.335 2.063 20 0 BEADLO Nc1ncc(C[NH+]2Cc3ccccc3C2)s1 ZINC000086766144 388107677 /nfs/dbraw/zinc/10/76/77/388107677.db2.gz QGMDYHWKBXHIIP-UHFFFAOYSA-N 1 2 231.324 2.241 20 0 BEADLO CC[C@@H](CSC)Nc1cc(C)[nH+]cn1 ZINC000162139592 388116039 /nfs/dbraw/zinc/11/60/39/388116039.db2.gz FISIYHMWVNSQNR-VIFPVBQESA-N 1 2 211.334 2.339 20 0 BEADLO Cc1cc(C)c(CNC(=O)NC[C@H]2C[C@H]2C)c[nH+]1 ZINC000454263824 388110703 /nfs/dbraw/zinc/11/07/03/388110703.db2.gz GBSYWSTZXRREIH-ZYHUDNBSSA-N 1 2 247.342 2.154 20 0 BEADLO Cn1nc(C[N@@H+]2CC[C@H](F)C2)c2ccccc21 ZINC000648720667 388157809 /nfs/dbraw/zinc/15/78/09/388157809.db2.gz MJPNNZUEEJRAED-JTQLQIEISA-N 1 2 233.290 2.117 20 0 BEADLO Cn1nc(C[N@H+]2CC[C@H](F)C2)c2ccccc21 ZINC000648720667 388157811 /nfs/dbraw/zinc/15/78/11/388157811.db2.gz MJPNNZUEEJRAED-JTQLQIEISA-N 1 2 233.290 2.117 20 0 BEADLO C[C@H](c1cnn(C)c1)[N@H+](C)Cc1ccncc1F ZINC000449252921 388162473 /nfs/dbraw/zinc/16/24/73/388162473.db2.gz RQRNULBFGYVUBV-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO C[C@H](c1cnn(C)c1)[N@@H+](C)Cc1ccncc1F ZINC000449252921 388162475 /nfs/dbraw/zinc/16/24/75/388162475.db2.gz RQRNULBFGYVUBV-SNVBAGLBSA-N 1 2 248.305 2.147 20 0 BEADLO Cc1cnc(C[NH2+]C(C)(C)CF)s1 ZINC000449253523 388163758 /nfs/dbraw/zinc/16/37/58/388163758.db2.gz YOUMBZOSFQRHPK-UHFFFAOYSA-N 1 2 202.298 2.289 20 0 BEADLO CC[C@@H]1CN(Cc2[nH+]ccn2C(C)C)CCO1 ZINC000195514402 388165404 /nfs/dbraw/zinc/16/54/04/388165404.db2.gz JQRJRGIWVBLWMQ-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO CCn1cc[nH+]c1CN(C)Cc1ccoc1C ZINC000195515179 388165515 /nfs/dbraw/zinc/16/55/15/388165515.db2.gz RNBUJKPNDXADQS-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO Cc1cc(NC(=O)C2=CC[C@@H](C)CC2)cc[nH+]1 ZINC000455642119 388165628 /nfs/dbraw/zinc/16/56/28/388165628.db2.gz MBFRWYKBYHOIAG-SNVBAGLBSA-N 1 2 230.311 2.497 20 0 BEADLO CC[N@@H+](Cc1cnn(C)c1)Cc1nc(C)c(C)o1 ZINC000195519056 388165762 /nfs/dbraw/zinc/16/57/62/388165762.db2.gz LWSKSQROJFDTBX-UHFFFAOYSA-N 1 2 248.330 2.047 20 0 BEADLO CC[N@H+](Cc1cnn(C)c1)Cc1nc(C)c(C)o1 ZINC000195519056 388165764 /nfs/dbraw/zinc/16/57/64/388165764.db2.gz LWSKSQROJFDTBX-UHFFFAOYSA-N 1 2 248.330 2.047 20 0 BEADLO CCn1nnc(C)c1C[N@H+](C)Cc1occc1C ZINC000449333235 388174097 /nfs/dbraw/zinc/17/40/97/388174097.db2.gz AREKGXWSTVGPKX-UHFFFAOYSA-N 1 2 248.330 2.140 20 0 BEADLO CCn1nnc(C)c1C[N@@H+](C)Cc1occc1C ZINC000449333235 388174098 /nfs/dbraw/zinc/17/40/98/388174098.db2.gz AREKGXWSTVGPKX-UHFFFAOYSA-N 1 2 248.330 2.140 20 0 BEADLO CCC1(NC(=O)Cc2[nH]c[nH+]c2C)CCCCC1 ZINC000456241287 388188455 /nfs/dbraw/zinc/18/84/55/388188455.db2.gz XUMXHVISDIRALO-UHFFFAOYSA-N 1 2 249.358 2.490 20 0 BEADLO CCC1(NC(=O)Cc2[nH+]c[nH]c2C)CCCCC1 ZINC000456241287 388188456 /nfs/dbraw/zinc/18/84/56/388188456.db2.gz XUMXHVISDIRALO-UHFFFAOYSA-N 1 2 249.358 2.490 20 0 BEADLO Cc1nc(N2CCCC[C@@H]2c2ncc[nH]2)cc[nH+]1 ZINC000152233376 388177693 /nfs/dbraw/zinc/17/76/93/388177693.db2.gz XISBNOVMJPKZHU-LLVKDONJSA-N 1 2 243.314 2.240 20 0 BEADLO CC(C)(C)n1cc(C[N@H+](C2CC2)C2COC2)cn1 ZINC000449349316 388178501 /nfs/dbraw/zinc/17/85/01/388178501.db2.gz FDQMGEJTYQRGHK-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO CC(C)(C)n1cc(C[N@@H+](C2CC2)C2COC2)cn1 ZINC000449349316 388178503 /nfs/dbraw/zinc/17/85/03/388178503.db2.gz FDQMGEJTYQRGHK-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO COc1cccc(C[N@@H+]2CC[C@H](F)C2)c1F ZINC000648721126 388178983 /nfs/dbraw/zinc/17/89/83/388178983.db2.gz GPHLYKRAAXTSJZ-JTQLQIEISA-N 1 2 227.254 2.378 20 0 BEADLO COc1cccc(C[N@H+]2CC[C@H](F)C2)c1F ZINC000648721126 388178984 /nfs/dbraw/zinc/17/89/84/388178984.db2.gz GPHLYKRAAXTSJZ-JTQLQIEISA-N 1 2 227.254 2.378 20 0 BEADLO CCCn1cc(C[NH2+][C@H](CC)C(F)F)cn1 ZINC000449357388 388181498 /nfs/dbraw/zinc/18/14/98/388181498.db2.gz CUMRNMBBJGFTBH-SNVBAGLBSA-N 1 2 231.290 2.426 20 0 BEADLO CC[C@H]([NH2+]Cc1cccnc1)C(F)F ZINC000449366574 388182808 /nfs/dbraw/zinc/18/28/08/388182808.db2.gz ZCGRVRVWMKNBSN-VIFPVBQESA-N 1 2 200.232 2.215 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000448937798 388121579 /nfs/dbraw/zinc/12/15/79/388121579.db2.gz RJRHQAVLEDSKCO-MNOVXSKESA-N 1 2 235.331 2.194 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NCCc2[nH]cc[nH+]2)C[C@@H]1C ZINC000448947991 388121863 /nfs/dbraw/zinc/12/18/63/388121863.db2.gz BFLSIFJZXIRVPF-GRYCIOLGSA-N 1 2 249.358 2.141 20 0 BEADLO COc1ccc(C)cc1C[NH2+]C(CF)CF ZINC000449374483 388186007 /nfs/dbraw/zinc/18/60/07/388186007.db2.gz ZUYSJIJPXSYRHU-UHFFFAOYSA-N 1 2 229.270 2.401 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC[C@@H]1C[C@H]1C(C)C ZINC000455039050 388146125 /nfs/dbraw/zinc/14/61/25/388146125.db2.gz UQXGFXWGZCHSFQ-RYUDHWBXSA-N 1 2 247.342 2.226 20 0 BEADLO CCCC(C)(C)NC(=O)[C@@H]1CCn2cc[nH+]c2C1 ZINC000455228276 388153474 /nfs/dbraw/zinc/15/34/74/388153474.db2.gz JEXRQYVJXWBWAF-LLVKDONJSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1ccc(N[C@H]2CCO[C@@H](C)C2)c[nH+]1 ZINC000164812837 388248604 /nfs/dbraw/zinc/24/86/04/388248604.db2.gz DMCODAFNRHVLAK-QWRGUYRKSA-N 1 2 206.289 2.369 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2cnccn2)o1 ZINC000070025782 388254973 /nfs/dbraw/zinc/25/49/73/388254973.db2.gz MGRXQPABQHORPJ-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO Cc1ncccc1CNc1ccc(N(C)C)[nH+]c1 ZINC000162963577 388255197 /nfs/dbraw/zinc/25/51/97/388255197.db2.gz RVQMOCDNCGILNJ-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)c1cccs1 ZINC000456340391 388195783 /nfs/dbraw/zinc/19/57/83/388195783.db2.gz DIJPTLIYKKHKIW-VIFPVBQESA-N 1 2 249.339 2.456 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)C1CC=CC1 ZINC000456351808 388196878 /nfs/dbraw/zinc/19/68/78/388196878.db2.gz LFTXSVUQTGIQGF-SNVBAGLBSA-N 1 2 233.315 2.046 20 0 BEADLO CCCCC(=O)N[C@@H](C)c1[nH+]ccn1CC ZINC000456368800 388197625 /nfs/dbraw/zinc/19/76/25/388197625.db2.gz CRCIVVOAAODOOW-JTQLQIEISA-N 1 2 223.320 2.270 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)C[C@H]1C=CCC1 ZINC000456375230 388198265 /nfs/dbraw/zinc/19/82/65/388198265.db2.gz GUEOXAYIWQFCFM-RYUDHWBXSA-N 1 2 247.342 2.437 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)C[C@H]1C=CCC1 ZINC000456375228 388198882 /nfs/dbraw/zinc/19/88/82/388198882.db2.gz GUEOXAYIWQFCFM-NEPJUHHUSA-N 1 2 247.342 2.437 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)[C@@H]2CC=CCC2)c2[nH+]ccn21 ZINC000456408593 388199415 /nfs/dbraw/zinc/19/94/15/388199415.db2.gz ZEPBFELIRXKVRA-IJLUTSLNSA-N 1 2 245.326 2.361 20 0 BEADLO CCCCC(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456407915 388199462 /nfs/dbraw/zinc/19/94/62/388199462.db2.gz YWEWUJRULVZUCW-ZJUUUORDSA-N 1 2 221.304 2.195 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)C(C)(C)C ZINC000456397111 388199507 /nfs/dbraw/zinc/19/95/07/388199507.db2.gz SNJUHJZPEWZGHS-SECBINFHSA-N 1 2 223.320 2.126 20 0 BEADLO CC[C@]1(C)C[C@@H]1C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456419149 388200020 /nfs/dbraw/zinc/20/00/20/388200020.db2.gz LMMCJPJLDJYPCY-ICUOPCATSA-N 1 2 247.342 2.441 20 0 BEADLO CC[C@H](C)CC(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456417596 388200465 /nfs/dbraw/zinc/20/04/65/388200465.db2.gz KSEXIYMGPLMKGA-HBNTYKKESA-N 1 2 235.331 2.441 20 0 BEADLO CSCC[N@H+](C)[C@@H](C)C(=O)OC(C)(C)C ZINC000162522419 388205741 /nfs/dbraw/zinc/20/57/41/388205741.db2.gz NBEDAUMVNPOESE-VIFPVBQESA-N 1 2 233.377 2.011 20 0 BEADLO CSCC[N@@H+](C)[C@@H](C)C(=O)OC(C)(C)C ZINC000162522419 388205742 /nfs/dbraw/zinc/20/57/42/388205742.db2.gz NBEDAUMVNPOESE-VIFPVBQESA-N 1 2 233.377 2.011 20 0 BEADLO CC(C)c1nnc(C[N@H+](C)[C@H]2CC2(C)C)n1C ZINC000489447825 388215330 /nfs/dbraw/zinc/21/53/30/388215330.db2.gz KYLGEZOMWAZRBX-JTQLQIEISA-N 1 2 236.363 2.169 20 0 BEADLO CC(C)c1nnc(C[N@@H+](C)[C@H]2CC2(C)C)n1C ZINC000489447825 388215332 /nfs/dbraw/zinc/21/53/32/388215332.db2.gz KYLGEZOMWAZRBX-JTQLQIEISA-N 1 2 236.363 2.169 20 0 BEADLO C[N@H+](Cc1nc(C2CC2)no1)[C@H]1CC1(C)C ZINC000489504054 388220184 /nfs/dbraw/zinc/22/01/84/388220184.db2.gz WRTLOFRVRNIMNJ-VIFPVBQESA-N 1 2 221.304 2.177 20 0 BEADLO C[N@@H+](Cc1nc(C2CC2)no1)[C@H]1CC1(C)C ZINC000489504054 388220185 /nfs/dbraw/zinc/22/01/85/388220185.db2.gz WRTLOFRVRNIMNJ-VIFPVBQESA-N 1 2 221.304 2.177 20 0 BEADLO CC[C@@H]1CC[C@H](C)N(C(=O)CCn2cc[nH+]c2)C1 ZINC000456801405 388222833 /nfs/dbraw/zinc/22/28/33/388222833.db2.gz PPCJHYOADKZQGO-QWHCGFSZSA-N 1 2 249.358 2.310 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000646328748 388234534 /nfs/dbraw/zinc/23/45/34/388234534.db2.gz LTBKAIBGIUMFGK-IJLUTSLNSA-N 1 2 245.326 2.122 20 0 BEADLO CN(C(=O)CCn1cc[nH+]c1)C1(C)CCCC1 ZINC000490595456 388241701 /nfs/dbraw/zinc/24/17/01/388241701.db2.gz SSZZVAIUEXXOHJ-UHFFFAOYSA-N 1 2 235.331 2.064 20 0 BEADLO C/C=C/C=C\C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000491462169 388296372 /nfs/dbraw/zinc/29/63/72/388296372.db2.gz FIUBIOAHEJUWFF-KNGNPWSXSA-N 1 2 245.326 2.248 20 0 BEADLO CC(C)SCC[N@@H+](CC(F)F)C[C@H](C)O ZINC000451844835 388300535 /nfs/dbraw/zinc/30/05/35/388300535.db2.gz WKFVQAWFSNDBFQ-VIFPVBQESA-N 1 2 241.347 2.076 20 0 BEADLO CC(C)SCC[N@H+](CC(F)F)C[C@H](C)O ZINC000451844835 388300537 /nfs/dbraw/zinc/30/05/37/388300537.db2.gz WKFVQAWFSNDBFQ-VIFPVBQESA-N 1 2 241.347 2.076 20 0 BEADLO CC[C@H](CC(C)C)C(=O)N1CCn2c[nH+]cc2C1 ZINC000451873029 388302495 /nfs/dbraw/zinc/30/24/95/388302495.db2.gz ZCNSXYYJEMJKKG-GFCCVEGCSA-N 1 2 249.358 2.298 20 0 BEADLO C[C@H](CNC(=O)/C=C\C(C)(C)C)Cn1cc[nH+]c1 ZINC000492038661 388332297 /nfs/dbraw/zinc/33/22/97/388332297.db2.gz HGNIXQVJDVBNOW-FOQNGQEVSA-N 1 2 249.358 2.238 20 0 BEADLO Cc1cc(NC(=O)C=CC2CCC2)cc[nH+]1 ZINC000492049298 388332774 /nfs/dbraw/zinc/33/27/74/388332774.db2.gz OBGVPTZSAJZOOQ-AATRIKPKSA-N 1 2 216.284 2.107 20 0 BEADLO C/C=C/C=C\C(=O)NCc1[nH+]ccn1CC(C)C ZINC000491912167 388327505 /nfs/dbraw/zinc/32/75/05/388327505.db2.gz IQKZPSSEBQYNLQ-DEQVHDEQSA-N 1 2 247.342 2.288 20 0 BEADLO c1cnc(C[N@@H+]2CCc3ccccc3C2)nc1 ZINC000191870103 388268827 /nfs/dbraw/zinc/26/88/27/388268827.db2.gz PZRPXXIGGOSTQT-UHFFFAOYSA-N 1 2 225.295 2.035 20 0 BEADLO c1cnc(C[N@H+]2CCc3ccccc3C2)nc1 ZINC000191870103 388268830 /nfs/dbraw/zinc/26/88/30/388268830.db2.gz PZRPXXIGGOSTQT-UHFFFAOYSA-N 1 2 225.295 2.035 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N1CCCC[C@@H]1C ZINC000492299099 388340773 /nfs/dbraw/zinc/34/07/73/388340773.db2.gz LVUUISKMXGIRFF-KRZKBDHCSA-N 1 2 247.342 2.317 20 0 BEADLO CC[C@H](C)N(C)C(=O)/C=C/c1[nH+]ccn1CC ZINC000492301012 388340855 /nfs/dbraw/zinc/34/08/55/388340855.db2.gz SNLHMSMBLUFPAD-AEZGRPFRSA-N 1 2 235.331 2.173 20 0 BEADLO CCN(CC(C)C)C(=O)/C=C/c1[nH+]ccn1CC ZINC000492300048 388340916 /nfs/dbraw/zinc/34/09/16/388340916.db2.gz PPUYDCCZYFWIDV-BQYQJAHWSA-N 1 2 249.358 2.421 20 0 BEADLO CCc1ccccc1C[NH2+][C@@H](C)c1ncn(C)n1 ZINC000275580747 388344816 /nfs/dbraw/zinc/34/48/16/388344816.db2.gz IANXZHDAHDAEDB-NSHDSACASA-N 1 2 244.342 2.228 20 0 BEADLO Cc1nc(N2CCC3(CCC3)C2)cc[nH+]1 ZINC000131375962 388345389 /nfs/dbraw/zinc/34/53/89/388345389.db2.gz XCYDOFVRGQSAJN-UHFFFAOYSA-N 1 2 203.289 2.165 20 0 BEADLO CO[C@H](C)[C@H](C)Nc1cc[nH+]c(C2CC2)n1 ZINC000276169150 388347387 /nfs/dbraw/zinc/34/73/87/388347387.db2.gz SXTJFPPKEKLPSX-DTWKUNHWSA-N 1 2 221.304 2.189 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2[nH]nc3ccccc32)C1 ZINC000648721369 388352523 /nfs/dbraw/zinc/35/25/23/388352523.db2.gz LQBYQDWQBXTHKT-SECBINFHSA-N 1 2 219.263 2.107 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2[nH]nc3ccccc32)C1 ZINC000648721369 388352524 /nfs/dbraw/zinc/35/25/24/388352524.db2.gz LQBYQDWQBXTHKT-SECBINFHSA-N 1 2 219.263 2.107 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2n[nH]c3ccccc32)C1 ZINC000648721369 388352528 /nfs/dbraw/zinc/35/25/28/388352528.db2.gz LQBYQDWQBXTHKT-SECBINFHSA-N 1 2 219.263 2.107 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2n[nH]c3ccccc32)C1 ZINC000648721369 388352529 /nfs/dbraw/zinc/35/25/29/388352529.db2.gz LQBYQDWQBXTHKT-SECBINFHSA-N 1 2 219.263 2.107 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCCc2occc21)c1ncn(C)n1 ZINC000278391817 388354717 /nfs/dbraw/zinc/35/47/17/388354717.db2.gz DVHONCZLZSKZPF-GXSJLCMTSA-N 1 2 246.314 2.136 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCCc2occc21)c1ncn(C)n1 ZINC000278391819 388354985 /nfs/dbraw/zinc/35/49/85/388354985.db2.gz DVHONCZLZSKZPF-KOLCDFICSA-N 1 2 246.314 2.136 20 0 BEADLO C[C@@H](CC(=O)N1C[C@@H](C)[C@@H](C)[C@@H]1C)n1cc[nH+]c1 ZINC000573005366 388405309 /nfs/dbraw/zinc/40/53/09/388405309.db2.gz NABPLNVNGHMWIZ-XQHKEYJVSA-N 1 2 249.358 2.337 20 0 BEADLO C[C@@H]1C[C@H](C)CN(c2nc[nH+]c(N)c2Cl)C1 ZINC000227840706 388371500 /nfs/dbraw/zinc/37/15/00/388371500.db2.gz XEMVKWLQHTYCPG-OCAPTIKFSA-N 1 2 240.738 2.195 20 0 BEADLO C[C@@H]1C[C@H](C)CN(c2[nH+]cnc(N)c2Cl)C1 ZINC000227840706 388371502 /nfs/dbraw/zinc/37/15/02/388371502.db2.gz XEMVKWLQHTYCPG-OCAPTIKFSA-N 1 2 240.738 2.195 20 0 BEADLO Nc1[nH+]cnc(N2CCCCCC2)c1Cl ZINC000227840334 388371589 /nfs/dbraw/zinc/37/15/89/388371589.db2.gz DMCFPSVHAOREIR-UHFFFAOYSA-N 1 2 226.711 2.093 20 0 BEADLO Nc1nc[nH+]c(N2CCCCCC2)c1Cl ZINC000227840334 388371591 /nfs/dbraw/zinc/37/15/91/388371591.db2.gz DMCFPSVHAOREIR-UHFFFAOYSA-N 1 2 226.711 2.093 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@@H]2CCC[C@H]2C2CC2)c[nH+]1 ZINC000572847305 388381034 /nfs/dbraw/zinc/38/10/34/388381034.db2.gz GTTKIAGBQIRJPI-RYUDHWBXSA-N 1 2 247.342 2.274 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CCCC[C@@H]1C)c1[nH]cc[nH+]1 ZINC000572854951 388381764 /nfs/dbraw/zinc/38/17/64/388381764.db2.gz SBAJCIIQILXPBK-AXFHLTTASA-N 1 2 235.331 2.413 20 0 BEADLO C[C@H]1CCCC[C@@H]1NC(=O)C[NH+]1CC(C)(C)C1 ZINC000646574861 388386492 /nfs/dbraw/zinc/38/64/92/388386492.db2.gz GJQLXPLXXVJBDQ-RYUDHWBXSA-N 1 2 238.375 2.023 20 0 BEADLO COCc1ccc(C[NH2+]Cc2cocn2)cc1 ZINC000237218848 388391098 /nfs/dbraw/zinc/39/10/98/388391098.db2.gz VUSBAYOOTBVDBH-UHFFFAOYSA-N 1 2 232.283 2.111 20 0 BEADLO c1cn2c([nH+]1)[C@H](Nc1ccc3c(c1)OCO3)CC2 ZINC000294076441 388394533 /nfs/dbraw/zinc/39/45/33/388394533.db2.gz LFERLIOXDHTAMK-SNVBAGLBSA-N 1 2 243.266 2.169 20 0 BEADLO CCCN(C)c1[nH+]c(C)nc2[nH]ccc21 ZINC000238215590 388401473 /nfs/dbraw/zinc/40/14/73/388401473.db2.gz WJKZCRUSJQOANZ-UHFFFAOYSA-N 1 2 204.277 2.113 20 0 BEADLO COC[C@@H]1CCCN(c2nc(C)[nH+]cc2C)CC1 ZINC000572975298 388401638 /nfs/dbraw/zinc/40/16/38/388401638.db2.gz SFRAAANDXZMLKC-CYBMUJFWSA-N 1 2 249.358 2.346 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N(C)CC(C)C ZINC000492264379 388339624 /nfs/dbraw/zinc/33/96/24/388339624.db2.gz WQOGZXJAJFOORR-SREVYHEPSA-N 1 2 235.331 2.031 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)NCC(C)(C)C ZINC000492280313 388340111 /nfs/dbraw/zinc/34/01/11/388340111.db2.gz VYBMMINKCVBWHD-VOTSOKGWSA-N 1 2 235.331 2.079 20 0 BEADLO CO[C@H](C)c1noc(C[N@@H+]2CCCC[C@H]2C)n1 ZINC000175063141 388439833 /nfs/dbraw/zinc/43/98/33/388439833.db2.gz WPQHNULQTOTSHQ-NXEZZACHSA-N 1 2 239.319 2.151 20 0 BEADLO CO[C@H](C)c1noc(C[N@H+]2CCCC[C@H]2C)n1 ZINC000175063141 388439835 /nfs/dbraw/zinc/43/98/35/388439835.db2.gz WPQHNULQTOTSHQ-NXEZZACHSA-N 1 2 239.319 2.151 20 0 BEADLO CCCC[C@@H]([NH2+]C[C@](C)(CC)OC)C(=O)OC ZINC000322616368 388440775 /nfs/dbraw/zinc/44/07/75/388440775.db2.gz MHXXDHJCFJXVTB-YPMHNXCESA-N 1 2 245.363 2.123 20 0 BEADLO CO[C@@H](C)Cn1c[nH+]c2cc(F)c(F)cc21 ZINC000167328386 388440924 /nfs/dbraw/zinc/44/09/24/388440924.db2.gz OSUTXGZWOFFPFQ-ZETCQYMHSA-N 1 2 226.226 2.349 20 0 BEADLO Cc1cnn(C)c1C[NH2+][C@@H](C)c1cscn1 ZINC000394059106 388449907 /nfs/dbraw/zinc/44/99/07/388449907.db2.gz JANDDZJZBWETRC-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO Cn1ccnc1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC000072381907 388457916 /nfs/dbraw/zinc/45/79/16/388457916.db2.gz OIYFEUIJSZKAJW-CYBMUJFWSA-N 1 2 242.326 2.152 20 0 BEADLO Cn1ccnc1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000072381907 388457917 /nfs/dbraw/zinc/45/79/17/388457917.db2.gz OIYFEUIJSZKAJW-CYBMUJFWSA-N 1 2 242.326 2.152 20 0 BEADLO CCO[C@H](CC)C(=O)Nc1cccc2[nH+]ccn21 ZINC000525103437 388415409 /nfs/dbraw/zinc/41/54/09/388415409.db2.gz FDSIUFJRMOUWIV-SNVBAGLBSA-N 1 2 247.298 2.088 20 0 BEADLO C[C@@H](CC(=O)N1CCCC[C@H]1C)n1cc[nH+]c1 ZINC000517154935 388539893 /nfs/dbraw/zinc/53/98/93/388539893.db2.gz TZLJGLHLTAXVAP-NEPJUHHUSA-N 1 2 235.331 2.235 20 0 BEADLO CC[C@@H](C)CN(C)C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000517172214 388540345 /nfs/dbraw/zinc/54/03/45/388540345.db2.gz UZFMMTOHNZADPT-MNOVXSKESA-N 1 2 237.347 2.093 20 0 BEADLO CC[C@@H](C)CN(C)C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000517172214 388540346 /nfs/dbraw/zinc/54/03/46/388540346.db2.gz UZFMMTOHNZADPT-MNOVXSKESA-N 1 2 237.347 2.093 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1CC[S@](=O)C(C)(C)CC1 ZINC000528520206 388540697 /nfs/dbraw/zinc/54/06/97/388540697.db2.gz PKTGNRHAMNONKB-SHBKCBRUSA-N 1 2 249.807 2.362 20 0 BEADLO C/C(Cl)=C\C[N@H+]1CC[S@](=O)C(C)(C)CC1 ZINC000528520206 388540699 /nfs/dbraw/zinc/54/06/99/388540699.db2.gz PKTGNRHAMNONKB-SHBKCBRUSA-N 1 2 249.807 2.362 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2cccnc2)s1 ZINC000079600003 388541279 /nfs/dbraw/zinc/54/12/79/388541279.db2.gz WIYSNTVOZQQTNM-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2cccnc2)s1 ZINC000079600003 388541281 /nfs/dbraw/zinc/54/12/81/388541281.db2.gz WIYSNTVOZQQTNM-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)NC(C)(C)c2[nH]cc[nH+]2)C1 ZINC000517380664 388548842 /nfs/dbraw/zinc/54/88/42/388548842.db2.gz DBADIYLQVLAMGR-ZJUUUORDSA-N 1 2 235.331 2.197 20 0 BEADLO C[C@@H](O)CCN(C)c1[nH+]ccc2ccccc21 ZINC000135629056 388502459 /nfs/dbraw/zinc/50/24/59/388502459.db2.gz PMFPDLRKVQPIMO-LLVKDONJSA-N 1 2 230.311 2.442 20 0 BEADLO COc1ccc(C[NH2+]Cc2cocn2)c(F)c1 ZINC000397877949 388508561 /nfs/dbraw/zinc/50/85/61/388508561.db2.gz ISYVYSMHZMAJQN-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1cnccn1 ZINC000576887950 388508797 /nfs/dbraw/zinc/50/87/97/388508797.db2.gz XVWQJZCLFRSTKY-BDAKNGLRSA-N 1 2 234.328 2.345 20 0 BEADLO CCCCc1noc(C[NH+]2[C@H](C)C[C@H]2C)n1 ZINC000548097939 388509688 /nfs/dbraw/zinc/50/96/88/388509688.db2.gz STUFJLNMGPDYPH-NXEZZACHSA-N 1 2 223.320 2.395 20 0 BEADLO COC(=O)c1occc1C[N@H+]1[C@H](C)C[C@@H]1C ZINC000548097736 388512000 /nfs/dbraw/zinc/51/20/00/388512000.db2.gz RARQXENACFNQQG-DTORHVGOSA-N 1 2 223.272 2.049 20 0 BEADLO COC(=O)c1occc1C[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548097736 388512003 /nfs/dbraw/zinc/51/20/03/388512003.db2.gz RARQXENACFNQQG-DTORHVGOSA-N 1 2 223.272 2.049 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1cnns1 ZINC000649280495 388513544 /nfs/dbraw/zinc/51/35/44/388513544.db2.gz BLJFAIXBWAUVOC-UHFFFAOYSA-N 1 2 223.301 2.153 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1cnns1 ZINC000649280495 388513547 /nfs/dbraw/zinc/51/35/47/388513547.db2.gz BLJFAIXBWAUVOC-UHFFFAOYSA-N 1 2 223.301 2.153 20 0 BEADLO C/C(Cl)=C\C[N@@H+](C)Cc1cnccn1 ZINC000528399194 388518998 /nfs/dbraw/zinc/51/89/98/388518998.db2.gz RQVVLPBLSVNYOW-YCRREMRBSA-N 1 2 211.696 2.051 20 0 BEADLO C/C(Cl)=C\C[N@H+](C)Cc1cnccn1 ZINC000528399194 388519000 /nfs/dbraw/zinc/51/90/00/388519000.db2.gz RQVVLPBLSVNYOW-YCRREMRBSA-N 1 2 211.696 2.051 20 0 BEADLO C[C@@H]1CCCC[C@@H]1CC(=O)NCCn1cc[nH+]c1 ZINC000516840744 388520152 /nfs/dbraw/zinc/52/01/52/388520152.db2.gz DHBNOSSSVGWOSK-CHWSQXEVSA-N 1 2 249.358 2.216 20 0 BEADLO CO[C@@H](Cn1cc[nH+]c1)c1ccc(F)cc1 ZINC000528406824 388521139 /nfs/dbraw/zinc/52/11/39/388521139.db2.gz ZBZWSQIJNZCNJE-LBPRGKRZSA-N 1 2 220.247 2.410 20 0 BEADLO CCc1ncc(CNc2[nH+]cccc2OC)cn1 ZINC000516854427 388521475 /nfs/dbraw/zinc/52/14/75/388521475.db2.gz FIWXFGBHGJGIDJ-UHFFFAOYSA-N 1 2 244.298 2.055 20 0 BEADLO C[C@@H](O)[C@H](C)SCc1cn2ccccc2[nH+]1 ZINC000079039996 388521755 /nfs/dbraw/zinc/52/17/55/388521755.db2.gz SPWLZJXOCODYPQ-ZJUUUORDSA-N 1 2 236.340 2.337 20 0 BEADLO C/C(Cl)=C\C[N@H+]1CCC[C@H]1c1nncn1C ZINC000528428308 388523519 /nfs/dbraw/zinc/52/35/19/388523519.db2.gz DIEGJLGYNFUBNG-CYNRKNSPSA-N 1 2 240.738 2.095 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1CCC[C@H]1c1nncn1C ZINC000528428308 388523522 /nfs/dbraw/zinc/52/35/22/388523522.db2.gz DIEGJLGYNFUBNG-CYNRKNSPSA-N 1 2 240.738 2.095 20 0 BEADLO Cc1noc([C@@H](C)[N@H+](C)CCOC(C)(C)C)n1 ZINC000516902504 388524160 /nfs/dbraw/zinc/52/41/60/388524160.db2.gz CPYPTGVMXOFUAJ-SECBINFHSA-N 1 2 241.335 2.186 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+](C)CCOC(C)(C)C)n1 ZINC000516902504 388524162 /nfs/dbraw/zinc/52/41/62/388524162.db2.gz CPYPTGVMXOFUAJ-SECBINFHSA-N 1 2 241.335 2.186 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1CCO[C@H](C2CC2)C1 ZINC000528456993 388528589 /nfs/dbraw/zinc/52/85/89/388528589.db2.gz BRKXEDKNJPYROW-NJHLSQGMSA-N 1 2 215.724 2.240 20 0 BEADLO C/C(Cl)=C/C[N@H+]1CCO[C@H](C2CC2)C1 ZINC000528456993 388528592 /nfs/dbraw/zinc/52/85/92/388528592.db2.gz BRKXEDKNJPYROW-NJHLSQGMSA-N 1 2 215.724 2.240 20 0 BEADLO CCOC(=O)CCCC[N@@H+]1Cc2cccnc2C1 ZINC000564348428 388530109 /nfs/dbraw/zinc/53/01/09/388530109.db2.gz NFEGZCDRGRRVSB-UHFFFAOYSA-N 1 2 248.326 2.131 20 0 BEADLO CCOC(=O)CCCC[N@H+]1Cc2cccnc2C1 ZINC000564348428 388530113 /nfs/dbraw/zinc/53/01/13/388530113.db2.gz NFEGZCDRGRRVSB-UHFFFAOYSA-N 1 2 248.326 2.131 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+]2CC[C@H](OC(F)F)C2)o1 ZINC000517397640 388550318 /nfs/dbraw/zinc/55/03/18/388550318.db2.gz SZAMNTPBPPFPAU-IUCAKERBSA-N 1 2 246.257 2.358 20 0 BEADLO Cc1cnc([C@H](C)[N@H+]2CC[C@H](OC(F)F)C2)o1 ZINC000517397640 388550320 /nfs/dbraw/zinc/55/03/20/388550320.db2.gz SZAMNTPBPPFPAU-IUCAKERBSA-N 1 2 246.257 2.358 20 0 BEADLO CCc1noc([C@H](C)[N@H+]2[C@H](C)C[C@@H]2C)n1 ZINC000548424817 388535599 /nfs/dbraw/zinc/53/55/99/388535599.db2.gz XAYXOJYEPPKIBM-YIZRAAEISA-N 1 2 209.293 2.176 20 0 BEADLO CCc1noc([C@H](C)[N@@H+]2[C@H](C)C[C@@H]2C)n1 ZINC000548424817 388535602 /nfs/dbraw/zinc/53/56/02/388535602.db2.gz XAYXOJYEPPKIBM-YIZRAAEISA-N 1 2 209.293 2.176 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1CCOC[C@@H]1CC(F)F ZINC000528502937 388536842 /nfs/dbraw/zinc/53/68/42/388536842.db2.gz JJQVPSRBQGCNDF-WWQRDVDESA-N 1 2 239.693 2.485 20 0 BEADLO C/C(Cl)=C\C[N@H+]1CCOC[C@@H]1CC(F)F ZINC000528502937 388536846 /nfs/dbraw/zinc/53/68/46/388536846.db2.gz JJQVPSRBQGCNDF-WWQRDVDESA-N 1 2 239.693 2.485 20 0 BEADLO Cc1cc(F)ccc1NC(=O)Cc1c[nH+]cn1C ZINC000186858122 388604525 /nfs/dbraw/zinc/60/45/25/388604525.db2.gz BAJGOMVJYTVANM-UHFFFAOYSA-N 1 2 247.273 2.049 20 0 BEADLO C(c1nnc(C2CC2)[nH]1)[N@@H+]1CCCC2(CC2)C1 ZINC000186954561 388605229 /nfs/dbraw/zinc/60/52/29/388605229.db2.gz UFMAJDDGXBHNDB-UHFFFAOYSA-N 1 2 232.331 2.058 20 0 BEADLO C(c1nnc(C2CC2)[nH]1)[N@H+]1CCCC2(CC2)C1 ZINC000186954561 388605230 /nfs/dbraw/zinc/60/52/30/388605230.db2.gz UFMAJDDGXBHNDB-UHFFFAOYSA-N 1 2 232.331 2.058 20 0 BEADLO COC(=O)c1ccoc1C[N@H+]1[C@H](C)C[C@@H]1C ZINC000548754218 388557368 /nfs/dbraw/zinc/55/73/68/388557368.db2.gz IYFAEJFRSMCNCC-DTORHVGOSA-N 1 2 223.272 2.049 20 0 BEADLO COC(=O)c1ccoc1C[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548754218 388557371 /nfs/dbraw/zinc/55/73/71/388557371.db2.gz IYFAEJFRSMCNCC-DTORHVGOSA-N 1 2 223.272 2.049 20 0 BEADLO CCc1cc(OC)ccc1C[NH2+]Cc1ccn[nH]1 ZINC000548786396 388561749 /nfs/dbraw/zinc/56/17/49/388561749.db2.gz UZWLZBCNCQCDJB-UHFFFAOYSA-N 1 2 245.326 2.271 20 0 BEADLO CCCC[C@H](C)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000548870527 388567071 /nfs/dbraw/zinc/56/70/71/388567071.db2.gz MBJIXWAUDIFDIH-NSHDSACASA-N 1 2 235.331 2.093 20 0 BEADLO CCc1nnc(C[N@@H+]2CCC(F)(F)C[C@H]2C)o1 ZINC000528764210 388569405 /nfs/dbraw/zinc/56/94/05/388569405.db2.gz DFPHRPPIDPXXBN-MRVPVSSYSA-N 1 2 245.273 2.252 20 0 BEADLO CCc1nnc(C[N@H+]2CCC(F)(F)C[C@H]2C)o1 ZINC000528764210 388569406 /nfs/dbraw/zinc/56/94/06/388569406.db2.gz DFPHRPPIDPXXBN-MRVPVSSYSA-N 1 2 245.273 2.252 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ncccc2F)ncn1 ZINC000528825453 388576971 /nfs/dbraw/zinc/57/69/71/388576971.db2.gz ROOAVWWLSSWFKD-JTQLQIEISA-N 1 2 246.289 2.170 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](CCO)c2ccco2)o1 ZINC000184520082 388579204 /nfs/dbraw/zinc/57/92/04/388579204.db2.gz SFERGESAUKLENA-LBPRGKRZSA-N 1 2 235.283 2.394 20 0 BEADLO C[C@H]1COC2(CCC2)C[N@@H+]1Cc1ccns1 ZINC000630076766 388626800 /nfs/dbraw/zinc/62/68/00/388626800.db2.gz NVACVFYZYYXHFF-JTQLQIEISA-N 1 2 238.356 2.287 20 0 BEADLO C[C@H]1COC2(CCC2)C[N@H+]1Cc1ccns1 ZINC000630076766 388626802 /nfs/dbraw/zinc/62/68/02/388626802.db2.gz NVACVFYZYYXHFF-JTQLQIEISA-N 1 2 238.356 2.287 20 0 BEADLO COC(=O)[C@@H](c1cccnc1)[N@@H+]1CCC[C@H](C)C1 ZINC000246406794 388635601 /nfs/dbraw/zinc/63/56/01/388635601.db2.gz KOYMGDWDHNZTHE-WCQYABFASA-N 1 2 248.326 2.028 20 0 BEADLO COC(=O)[C@@H](c1cccnc1)[N@H+]1CCC[C@H](C)C1 ZINC000246406794 388635603 /nfs/dbraw/zinc/63/56/03/388635603.db2.gz KOYMGDWDHNZTHE-WCQYABFASA-N 1 2 248.326 2.028 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1nccs1)c1cn[nH]c1 ZINC000222481407 388637417 /nfs/dbraw/zinc/63/74/17/388637417.db2.gz GHKSYTWQPGTCOP-SFYZADRCSA-N 1 2 222.317 2.278 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1nccs1)c1cn[nH]c1 ZINC000222481519 388637521 /nfs/dbraw/zinc/63/75/21/388637521.db2.gz GHKSYTWQPGTCOP-HTQZYQBOSA-N 1 2 222.317 2.278 20 0 BEADLO Cc1ccc(NC(=O)C[C@H](C)n2cc[nH+]c2)nc1 ZINC000551771492 388640207 /nfs/dbraw/zinc/64/02/07/388640207.db2.gz VSTDVRYRVZVLRK-NSHDSACASA-N 1 2 244.298 2.176 20 0 BEADLO O=C(CCCn1cc[nH+]c1)Nc1ccccc1 ZINC000620409449 388646897 /nfs/dbraw/zinc/64/68/97/388646897.db2.gz SRBIXMXBSWEDCI-UHFFFAOYSA-N 1 2 229.283 2.302 20 0 BEADLO CCC[C@H](C)CC(=O)N1CC(n2cc[nH+]c2)C1 ZINC000522258486 388738727 /nfs/dbraw/zinc/73/87/27/388738727.db2.gz DPNIHBKDGTVFJZ-NSHDSACASA-N 1 2 235.331 2.093 20 0 BEADLO CCn1cc(C[N@H+](C)Cc2ncccc2C)cn1 ZINC000538967107 388743280 /nfs/dbraw/zinc/74/32/80/388743280.db2.gz XFGNXJUKOYUQDO-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1cc(C[N@@H+](C)Cc2ncccc2C)cn1 ZINC000538967107 388743284 /nfs/dbraw/zinc/74/32/84/388743284.db2.gz XFGNXJUKOYUQDO-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO C[N@H+](Cc1noc(-c2ccsc2)n1)C1CC1 ZINC000193055040 388747679 /nfs/dbraw/zinc/74/76/79/388747679.db2.gz QEZCHIHIIJDGND-UHFFFAOYSA-N 1 2 235.312 2.392 20 0 BEADLO C[N@@H+](Cc1noc(-c2ccsc2)n1)C1CC1 ZINC000193055040 388747681 /nfs/dbraw/zinc/74/76/81/388747681.db2.gz QEZCHIHIIJDGND-UHFFFAOYSA-N 1 2 235.312 2.392 20 0 BEADLO c1ccc(NCC[C@H]2CCCCO2)[nH+]c1 ZINC000227315653 388747869 /nfs/dbraw/zinc/74/78/69/388747869.db2.gz JFFGRAKTMOXEGL-LLVKDONJSA-N 1 2 206.289 2.453 20 0 BEADLO CCc1cc(C[NH2+][C@H](CC)c2nccn2C)on1 ZINC000539317935 388753417 /nfs/dbraw/zinc/75/34/17/388753417.db2.gz JPAFNKDISJFGNX-GFCCVEGCSA-N 1 2 248.330 2.211 20 0 BEADLO CCc1cccc(C[NH2+]Cc2ccn[nH]2)c1 ZINC000564217479 388753879 /nfs/dbraw/zinc/75/38/79/388753879.db2.gz NHKPOVUXVXAWEC-UHFFFAOYSA-N 1 2 215.300 2.262 20 0 BEADLO FC(F)n1ccnc1C[NH+]1CCCCC1 ZINC000193141572 388694136 /nfs/dbraw/zinc/69/41/36/388694136.db2.gz JCHZGNWSTNRULG-UHFFFAOYSA-N 1 2 215.247 2.264 20 0 BEADLO c1ccc2[nH+]c(N3CC[C@]4(CCOC4)C3)[nH]c2c1 ZINC000301898933 388698268 /nfs/dbraw/zinc/69/82/68/388698268.db2.gz XKNKOGPQWGLNMF-AWEZNQCLSA-N 1 2 243.310 2.180 20 0 BEADLO CC[C@H]1CN(C)CC[N@@H+]1Cc1cccc(F)c1 ZINC000552406866 388703574 /nfs/dbraw/zinc/70/35/74/388703574.db2.gz UIEHMSAVJUFQFK-AWEZNQCLSA-N 1 2 236.334 2.352 20 0 BEADLO CC[C@H]1CN(C)CC[N@H+]1Cc1cccc(F)c1 ZINC000552406866 388703577 /nfs/dbraw/zinc/70/35/77/388703577.db2.gz UIEHMSAVJUFQFK-AWEZNQCLSA-N 1 2 236.334 2.352 20 0 BEADLO Cc1nc(NC[C@H]2CCCS2)cc[nH+]1 ZINC000087475377 388707231 /nfs/dbraw/zinc/70/72/31/388707231.db2.gz RIEQDNDLCFKZMC-SECBINFHSA-N 1 2 209.318 2.093 20 0 BEADLO COC(=O)c1occc1C[N@@H+]1CCC1(C)C ZINC000538737979 388715601 /nfs/dbraw/zinc/71/56/01/388715601.db2.gz PALWZKVRPFIPEH-UHFFFAOYSA-N 1 2 223.272 2.051 20 0 BEADLO COC(=O)c1occc1C[N@H+]1CCC1(C)C ZINC000538737979 388715605 /nfs/dbraw/zinc/71/56/05/388715605.db2.gz PALWZKVRPFIPEH-UHFFFAOYSA-N 1 2 223.272 2.051 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H]1CCOC[C@H]1C ZINC000194314289 388728769 /nfs/dbraw/zinc/72/87/69/388728769.db2.gz UKESWHGGHIRMGQ-MNOVXSKESA-N 1 2 234.299 2.001 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@H]2CCC[C@@H](C)C2)no1 ZINC000249705088 388731695 /nfs/dbraw/zinc/73/16/95/388731695.db2.gz AFBHZJKCEYYVRU-KOLCDFICSA-N 1 2 223.320 2.389 20 0 BEADLO Cc1nc(C[N@H+](C)[C@H]2CCC[C@@H](C)C2)no1 ZINC000249705088 388731698 /nfs/dbraw/zinc/73/16/98/388731698.db2.gz AFBHZJKCEYYVRU-KOLCDFICSA-N 1 2 223.320 2.389 20 0 BEADLO C[C@H]1CN(c2[nH+]ccc3ccccc32)CC[C@H]1O ZINC000253171318 388806489 /nfs/dbraw/zinc/80/64/89/388806489.db2.gz AICDUZRHWPLHLW-SMDDNHRTSA-N 1 2 242.322 2.442 20 0 BEADLO c1[nH+]c2ccccn2c1CSc1cnccn1 ZINC000540729589 388814339 /nfs/dbraw/zinc/81/43/39/388814339.db2.gz RDOMXNIRTGTNNB-UHFFFAOYSA-N 1 2 242.307 2.417 20 0 BEADLO C[N@H+](Cc1ccc(Cl)cn1)Cc1cnccn1 ZINC000554496314 388817269 /nfs/dbraw/zinc/81/72/69/388817269.db2.gz SCOLPFQFVUCOQH-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO C[N@@H+](Cc1ccc(Cl)cn1)Cc1cnccn1 ZINC000554496314 388817271 /nfs/dbraw/zinc/81/72/71/388817271.db2.gz SCOLPFQFVUCOQH-UHFFFAOYSA-N 1 2 248.717 2.157 20 0 BEADLO CC1(C)CC[C@H](C(=O)N2CC(n3cc[nH+]c3)C2)C1 ZINC000541043543 388836063 /nfs/dbraw/zinc/83/60/63/388836063.db2.gz UENIVLAUTNWRHN-NSHDSACASA-N 1 2 247.342 2.093 20 0 BEADLO CCN(C)c1ccc(C[NH2+]CC(C)(F)F)cn1 ZINC000555610076 388857436 /nfs/dbraw/zinc/85/74/36/388857436.db2.gz ORGFCWQREPYRLI-UHFFFAOYSA-N 1 2 243.301 2.283 20 0 BEADLO CCCCOCC[N@H+](C)[C@@H](C)C(=O)OC(C)C ZINC000129808536 388870941 /nfs/dbraw/zinc/87/09/41/388870941.db2.gz XGPXBGJHCKWPGI-LBPRGKRZSA-N 1 2 245.363 2.075 20 0 BEADLO CCCCOCC[N@@H+](C)[C@@H](C)C(=O)OC(C)C ZINC000129808536 388870942 /nfs/dbraw/zinc/87/09/42/388870942.db2.gz XGPXBGJHCKWPGI-LBPRGKRZSA-N 1 2 245.363 2.075 20 0 BEADLO Cc1cc(NC[C@@H]2CC[C@@H]3C[C@@H]3C2)nc[nH+]1 ZINC000403508153 388888236 /nfs/dbraw/zinc/88/82/36/388888236.db2.gz AMRHXBXESNQWCJ-UTUOFQBUSA-N 1 2 217.316 2.055 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2ncccc2F)nn1C ZINC000564784423 388888807 /nfs/dbraw/zinc/88/88/07/388888807.db2.gz FIELUAGEVLTGHB-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO CC[C@H](NC(=O)CCc1c[nH+]c[nH]1)C1CCCC1 ZINC000564539198 388877084 /nfs/dbraw/zinc/87/70/84/388877084.db2.gz YXGQNYBNVLQUBF-ZDUSSCGKSA-N 1 2 249.358 2.427 20 0 BEADLO CC[C@H](NC(=O)CCc1c[nH]c[nH+]1)C1CCCC1 ZINC000564539198 388877087 /nfs/dbraw/zinc/87/70/87/388877087.db2.gz YXGQNYBNVLQUBF-ZDUSSCGKSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@H](CC(=O)NCC1(C2CC2)CC1)n1cc[nH+]c1 ZINC000565049129 388910705 /nfs/dbraw/zinc/91/07/05/388910705.db2.gz YXWJESMRSYJKIS-LLVKDONJSA-N 1 2 247.342 2.141 20 0 BEADLO CC1=C[C@H](C)CN(C(=O)C[C@H](C)n2cc[nH+]c2)C1 ZINC000565094482 388914063 /nfs/dbraw/zinc/91/40/63/388914063.db2.gz MEVFDAZMNVZWSE-AAEUAGOBSA-N 1 2 247.342 2.259 20 0 BEADLO Cc1cc(C(=O)N[C@H](C)c2[nH]cc[nH+]2)oc1C ZINC000565212440 388926078 /nfs/dbraw/zinc/92/60/78/388926078.db2.gz BCMJGUBLTFFIRN-MRVPVSSYSA-N 1 2 233.271 2.111 20 0 BEADLO COc1cc([C@@H](C)[NH2+]CC(C)(F)F)ccn1 ZINC000565216348 388926803 /nfs/dbraw/zinc/92/68/03/388926803.db2.gz FCCUJAAZOCRKMI-MRVPVSSYSA-N 1 2 230.258 2.396 20 0 BEADLO Cc1c[nH+]c(C)nc1NC[C@@H]1CCCCS1 ZINC000565228263 388929712 /nfs/dbraw/zinc/92/97/12/388929712.db2.gz DXAXCCLFBUSTFC-NSHDSACASA-N 1 2 237.372 2.213 20 0 BEADLO CC[C@@H]1CN(c2nc(C)[nH+]cc2C)C[C@@H](CC)O1 ZINC000565435143 388944506 /nfs/dbraw/zinc/94/45/06/388944506.db2.gz YMOMBEWYTBTFOX-CHWSQXEVSA-N 1 2 249.358 2.487 20 0 BEADLO c1ccc(CC[N@@H+]2Cc3cccnc3C2)nc1 ZINC000566064527 388985841 /nfs/dbraw/zinc/98/58/41/388985841.db2.gz HFNAREQEFDXPTD-UHFFFAOYSA-N 1 2 225.295 2.035 20 0 BEADLO c1ccc(CC[N@H+]2Cc3cccnc3C2)nc1 ZINC000566064527 388985843 /nfs/dbraw/zinc/98/58/43/388985843.db2.gz HFNAREQEFDXPTD-UHFFFAOYSA-N 1 2 225.295 2.035 20 0 BEADLO CCC1(C(=O)NCc2[nH]c[nH+]c2C)CCCC1 ZINC000268135096 389002083 /nfs/dbraw/zinc/00/20/83/389002083.db2.gz UEQXYSFXTWJYNW-UHFFFAOYSA-N 1 2 235.331 2.305 20 0 BEADLO c1nc(NC2CCC2)cc(NCC2CC2)[nH+]1 ZINC000270277014 389011071 /nfs/dbraw/zinc/01/10/71/389011071.db2.gz IHTAAVWXRJJPSU-UHFFFAOYSA-N 1 2 218.304 2.263 20 0 BEADLO c1nc(NCC2CC2)cc(NC2CCC2)[nH+]1 ZINC000270277014 389011074 /nfs/dbraw/zinc/01/10/74/389011074.db2.gz IHTAAVWXRJJPSU-UHFFFAOYSA-N 1 2 218.304 2.263 20 0 BEADLO COc1ccc2c(c1)[nH+]ccc2OCC[C@@H](C)O ZINC000418891172 533312834 /nfs/dbraw/zinc/31/28/34/533312834.db2.gz WWDVJZQGEBBMGS-SNVBAGLBSA-N 1 2 247.294 2.393 20 0 BEADLO C[C@@H](CCC1CC1)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493132198 533522057 /nfs/dbraw/zinc/52/20/57/533522057.db2.gz QPMHGFWRSQGVDO-GFVADAIESA-N 1 2 233.315 2.118 20 0 BEADLO C[C@@H]([NH2+]Cc1ncc(C2CC2)o1)c1cn[nH]c1 ZINC000494705019 533472806 /nfs/dbraw/zinc/47/28/06/533472806.db2.gz VILBEQVOIYRQTG-MRVPVSSYSA-N 1 2 232.287 2.126 20 0 BEADLO COC(=O)C[N@H+](C)C/C(C)=C\c1ccccc1 ZINC000507311114 533477606 /nfs/dbraw/zinc/47/76/06/533477606.db2.gz XYVFPMFKYVGGTL-XFXZXTDPSA-N 1 2 233.311 2.195 20 0 BEADLO COC(=O)C[N@@H+](C)C/C(C)=C\c1ccccc1 ZINC000507311114 533477608 /nfs/dbraw/zinc/47/76/08/533477608.db2.gz XYVFPMFKYVGGTL-XFXZXTDPSA-N 1 2 233.311 2.195 20 0 BEADLO C[C@@H]1CCCN(C(=O)/C=C/c2[nH]cc[nH+]2)CC1 ZINC000493348498 533636758 /nfs/dbraw/zinc/63/67/58/533636758.db2.gz FPFRBQAEPYOVGF-SGUJLRQBSA-N 1 2 233.315 2.072 20 0 BEADLO CC[C@@H]1CN(c2cccc[nH+]2)C[C@@H](C)O1 ZINC000264714562 132179796 /nfs/dbraw/zinc/17/97/96/132179796.db2.gz GVKSIAFRQBDHQS-GHMZBOCLSA-N 1 2 206.289 2.085 20 0 BEADLO CCOC[C@H]1CCCN(c2cccc[nH+]2)C1 ZINC000265061123 132181527 /nfs/dbraw/zinc/18/15/27/132181527.db2.gz NFHCGADXOBRQPG-LBPRGKRZSA-N 1 2 220.316 2.335 20 0 BEADLO Cc1cc(N2C[C@H](C)OC[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000265297509 132182152 /nfs/dbraw/zinc/18/21/52/132182152.db2.gz CKQWCXJVSXPIGH-QWRGUYRKSA-N 1 2 247.342 2.276 20 0 BEADLO C[C@@H]1CN(c2cc[nH+]c3ccncc32)C[C@@H](C)O1 ZINC000267196073 132188694 /nfs/dbraw/zinc/18/86/94/132188694.db2.gz IHOCYCSZORLJLU-GHMZBOCLSA-N 1 2 243.310 2.243 20 0 BEADLO Fc1cccnc1N1CCC(n2cc[nH+]c2)CC1 ZINC000267812675 132190431 /nfs/dbraw/zinc/19/04/31/132190431.db2.gz UOOPSOQDEXAKTM-UHFFFAOYSA-N 1 2 246.289 2.259 20 0 BEADLO C[C@H]1COc2ccccc2N1Cc1c[nH+]cn1C ZINC000267651406 132190489 /nfs/dbraw/zinc/19/04/89/132190489.db2.gz XQVIZOIRNKVKNL-NSHDSACASA-N 1 2 243.310 2.208 20 0 BEADLO Clc1cccnc1N1CC[NH+](C2CC2)CC1 ZINC000268049836 132191312 /nfs/dbraw/zinc/19/13/12/132191312.db2.gz SALPYOPEEFCHDR-UHFFFAOYSA-N 1 2 237.734 2.019 20 0 BEADLO c1ccc(N2CCOC3(CCCC3)C2)[nH+]c1 ZINC000268821467 132193695 /nfs/dbraw/zinc/19/36/95/132193695.db2.gz KBLZBNLIVUKZAP-UHFFFAOYSA-N 1 2 218.300 2.231 20 0 BEADLO C[C@H]1CN(c2cccc[nH+]2)C[C@H](C2CC2)O1 ZINC000280132564 132209944 /nfs/dbraw/zinc/20/99/44/132209944.db2.gz BFWVDCLDTOTPNB-CMPLNLGQSA-N 1 2 218.300 2.085 20 0 BEADLO CO[C@]1(C)CCCN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000280397327 132210195 /nfs/dbraw/zinc/21/01/95/132210195.db2.gz IBRKNXISFVRCAA-CQSZACIVSA-N 1 2 247.342 2.359 20 0 BEADLO Cc1nc(N2CC[C@]3(C)[C@H](C2)C3(F)F)cc[nH+]1 ZINC000291910170 132218493 /nfs/dbraw/zinc/21/84/93/132218493.db2.gz KTUXGODFAARHDM-GXSJLCMTSA-N 1 2 239.269 2.267 20 0 BEADLO c1coc([C@@H]2CN(c3cccc[nH+]3)CCO2)c1 ZINC000133441016 132237876 /nfs/dbraw/zinc/23/78/76/132237876.db2.gz YAJDZOYKMBQGQF-LBPRGKRZSA-N 1 2 230.267 2.253 20 0 BEADLO CC[C@H]1CCCN(c2cc(C)[nH+]cn2)C1 ZINC000301222546 132251621 /nfs/dbraw/zinc/25/16/21/132251621.db2.gz BHZZVEVKHDMJGR-NSHDSACASA-N 1 2 205.305 2.411 20 0 BEADLO Cc1cc(N2CCC(OCC(C)C)CC2)nc[nH+]1 ZINC000301227791 132251752 /nfs/dbraw/zinc/25/17/52/132251752.db2.gz FUUJEYIKKZWHJV-UHFFFAOYSA-N 1 2 249.358 2.426 20 0 BEADLO CC[C@H]1CN(c2cc(C)[nH+]cn2)CCS1 ZINC000301447796 132253715 /nfs/dbraw/zinc/25/37/15/132253715.db2.gz OUIKABSVNATHQQ-JTQLQIEISA-N 1 2 223.345 2.117 20 0 BEADLO Cc1cc(N2CCS[C@@H](C(C)C)C2)nc[nH+]1 ZINC000301476952 132253972 /nfs/dbraw/zinc/25/39/72/132253972.db2.gz TWOPPTGTQZEIPO-LLVKDONJSA-N 1 2 237.372 2.363 20 0 BEADLO Cc1nc(N2C[C@H](C)O[C@@H](C)C2)c(C)c(C)[nH+]1 ZINC000301452625 132254071 /nfs/dbraw/zinc/25/40/71/132254071.db2.gz UVVKORBILMJYLM-IUCAKERBSA-N 1 2 235.331 2.015 20 0 BEADLO Cc1cc(N2CCOC[C@H]2CC(C)C)nc[nH+]1 ZINC000301544858 132254632 /nfs/dbraw/zinc/25/46/32/132254632.db2.gz DPBOAOIXUJMGGZ-GFCCVEGCSA-N 1 2 235.331 2.036 20 0 BEADLO CC(C)c1nc(N2CCCCC2)nc(N(C)C)[nH+]1 ZINC000301926132 132259072 /nfs/dbraw/zinc/25/90/72/132259072.db2.gz MSAUCTZZXFOSDP-UHFFFAOYSA-N 1 2 249.362 2.051 20 0 BEADLO CC(C)c1nc(N(C)C)nc(N2CCCCC2)[nH+]1 ZINC000301926132 132259076 /nfs/dbraw/zinc/25/90/76/132259076.db2.gz MSAUCTZZXFOSDP-UHFFFAOYSA-N 1 2 249.362 2.051 20 0 BEADLO Cc1nc(N2CC[C@H]3OCC[C@H]3C2)c(C)c(C)[nH+]1 ZINC000369698891 132284389 /nfs/dbraw/zinc/28/43/89/132284389.db2.gz YOSDFYQRGRKJHO-QWHCGFSZSA-N 1 2 247.342 2.017 20 0 BEADLO CCc1cc(N2C[C@H](C)OC(C)(C)C2)nc(C)[nH+]1 ZINC000172711603 132446226 /nfs/dbraw/zinc/44/62/26/132446226.db2.gz ILYDDARIPJOXBY-JTQLQIEISA-N 1 2 249.358 2.351 20 0 BEADLO C[C@H]1OCC[C@@]1(C)Nc1cc[nH+]c(C2CC2)n1 ZINC000343493145 133688873 /nfs/dbraw/zinc/68/88/73/133688873.db2.gz BDLQVAMKIGGMJQ-NOZJJQNGSA-N 1 2 233.315 2.333 20 0 BEADLO C[C@@H]1CCCC[C@H]1C(=O)N1CCn2cc[nH+]c2C1 ZINC000335089894 133761175 /nfs/dbraw/zinc/76/11/75/133761175.db2.gz GUZLHUHYUMJBHI-VXGBXAGGSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1ccc(NC(=O)CCc2[nH]cc[nH+]2)c(F)c1 ZINC000351917269 134004525 /nfs/dbraw/zinc/00/45/25/134004525.db2.gz OFUZRAMMAORPSE-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO Cc1sccc1C[N@@H+]1CC[S@](=O)[C@H](C)C1 ZINC000335942416 134018410 /nfs/dbraw/zinc/01/84/10/134018410.db2.gz MZSHBQOSOUVZBX-PSLIRLAXSA-N 1 2 243.397 2.009 20 0 BEADLO Cc1sccc1C[N@H+]1CC[S@](=O)[C@H](C)C1 ZINC000335942416 134018411 /nfs/dbraw/zinc/01/84/11/134018411.db2.gz MZSHBQOSOUVZBX-PSLIRLAXSA-N 1 2 243.397 2.009 20 0 BEADLO CC[N@H+](CCCO)Cc1ncc(Cl)s1 ZINC000351996604 134033391 /nfs/dbraw/zinc/03/33/91/134033391.db2.gz PVIOQSIRDSXJNN-UHFFFAOYSA-N 1 2 234.752 2.001 20 0 BEADLO CC[N@@H+](CCCO)Cc1ncc(Cl)s1 ZINC000351996604 134033392 /nfs/dbraw/zinc/03/33/92/134033392.db2.gz PVIOQSIRDSXJNN-UHFFFAOYSA-N 1 2 234.752 2.001 20 0 BEADLO C[C@H]1C[C@@H]1CC(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000336002559 134047807 /nfs/dbraw/zinc/04/78/07/134047807.db2.gz NYEXSBWJYSMMCZ-NWDGAFQWSA-N 1 2 247.342 2.093 20 0 BEADLO Cc1cn[nH]c1C[NH2+][C@@H]1COc2ccc(F)cc21 ZINC000336007086 134049290 /nfs/dbraw/zinc/04/92/90/134049290.db2.gz OPKWQWHQDLYNSJ-GFCCVEGCSA-N 1 2 247.273 2.081 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@@H]1COc2ccc(F)cc21 ZINC000336007086 134049291 /nfs/dbraw/zinc/04/92/91/134049291.db2.gz OPKWQWHQDLYNSJ-GFCCVEGCSA-N 1 2 247.273 2.081 20 0 BEADLO c1cc(C[N@@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)no1 ZINC000336007679 134049716 /nfs/dbraw/zinc/04/97/16/134049716.db2.gz ULZYUABJSVGFPA-CHWSQXEVSA-N 1 2 248.326 2.208 20 0 BEADLO c1cc(C[N@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)no1 ZINC000336007679 134049717 /nfs/dbraw/zinc/04/97/17/134049717.db2.gz ULZYUABJSVGFPA-CHWSQXEVSA-N 1 2 248.326 2.208 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CC(C)(C)O[C@@H]2CCC[C@H]21 ZINC000336011865 134051907 /nfs/dbraw/zinc/05/19/07/134051907.db2.gz IVMIHEZNRRATQB-CHWSQXEVSA-N 1 2 249.358 2.250 20 0 BEADLO CC(C)c1cnc(N2CCn3c[nH+]cc3C2)s1 ZINC000336022940 134056325 /nfs/dbraw/zinc/05/63/25/134056325.db2.gz RZTJRLHBAYKFOI-UHFFFAOYSA-N 1 2 248.355 2.483 20 0 BEADLO OCC1CC[NH+](Cc2ncc(Cl)s2)CC1 ZINC000336068255 134071296 /nfs/dbraw/zinc/07/12/96/134071296.db2.gz KYQTTYDHESVSIW-UHFFFAOYSA-N 1 2 246.763 2.001 20 0 BEADLO C[C@@H]1C[NH+](Cc2ccsc2)C[C@@H](C)S1=O ZINC000336089302 134077806 /nfs/dbraw/zinc/07/78/06/134077806.db2.gz YJKDWADJQZINSX-NXEZZACHSA-N 1 2 243.397 2.089 20 0 BEADLO CC1=C(C)C[N@H+](Cc2noc(C3CC3)n2)CC1 ZINC000336089801 134077867 /nfs/dbraw/zinc/07/78/67/134077867.db2.gz NGLBBSKURCLLDM-UHFFFAOYSA-N 1 2 233.315 2.489 20 0 BEADLO CC1=C(C)C[N@@H+](Cc2noc(C3CC3)n2)CC1 ZINC000336089801 134077868 /nfs/dbraw/zinc/07/78/68/134077868.db2.gz NGLBBSKURCLLDM-UHFFFAOYSA-N 1 2 233.315 2.489 20 0 BEADLO Cc1ccc2c(c1)CC[N@@H+](Cc1cc[nH]n1)C2 ZINC000336089191 134078064 /nfs/dbraw/zinc/07/80/64/134078064.db2.gz UTHCMHQWRKYTJJ-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1ccc2c(c1)CC[N@H+](Cc1cc[nH]n1)C2 ZINC000336089191 134078065 /nfs/dbraw/zinc/07/80/65/134078065.db2.gz UTHCMHQWRKYTJJ-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1cc(N2CC[C@@H]3CCC[C@H]32)nc[nH+]1 ZINC000336091218 134078515 /nfs/dbraw/zinc/07/85/15/134078515.db2.gz WFDCFXKWYIJSAX-WDEREUQCSA-N 1 2 203.289 2.164 20 0 BEADLO Cc1cc(N2CC[C@@H]3CCC[C@@H]32)nc[nH+]1 ZINC000336091217 134078636 /nfs/dbraw/zinc/07/86/36/134078636.db2.gz WFDCFXKWYIJSAX-QWRGUYRKSA-N 1 2 203.289 2.164 20 0 BEADLO Cc1cc(NC(=O)N(C)[C@@H]2CC2(C)C)cc[nH+]1 ZINC000336095845 134080083 /nfs/dbraw/zinc/08/00/83/134080083.db2.gz UJLXBZGQTNVNAE-LLVKDONJSA-N 1 2 233.315 2.074 20 0 BEADLO CCc1nc(C)c(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)o1 ZINC000336116408 134088733 /nfs/dbraw/zinc/08/87/33/134088733.db2.gz XKOLIOOGRCEAOR-VHSXEESVSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1nc(C)c(C[N@H+]2C[C@@H](C)OC[C@@H]2C)o1 ZINC000336116408 134088734 /nfs/dbraw/zinc/08/87/34/134088734.db2.gz XKOLIOOGRCEAOR-VHSXEESVSA-N 1 2 238.331 2.155 20 0 BEADLO Cc1cc(NC(=O)N2CC[C@H]3CCC[C@H]32)cc[nH+]1 ZINC000336119289 134089687 /nfs/dbraw/zinc/08/96/87/134089687.db2.gz VWFQZSCDBSHFSM-DGCLKSJQSA-N 1 2 245.326 2.218 20 0 BEADLO c1nnsc1CSc1[nH+]cc2ccccn21 ZINC000352165146 134090458 /nfs/dbraw/zinc/09/04/58/134090458.db2.gz BQRIQFWLBDLHOR-UHFFFAOYSA-N 1 2 248.336 2.478 20 0 BEADLO CCN(C)C(=O)C[NH2+]C1(C(F)F)CCCCC1 ZINC000352186538 134099727 /nfs/dbraw/zinc/09/97/27/134099727.db2.gz MSZFCMFMTMEIDB-UHFFFAOYSA-N 1 2 248.317 2.022 20 0 BEADLO Cc1ccn2c(CNCC(F)(F)F)c[nH+]c2c1 ZINC000352241446 134118171 /nfs/dbraw/zinc/11/81/71/134118171.db2.gz MNNIERSWTFLDLZ-UHFFFAOYSA-N 1 2 243.232 2.295 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+]1CCC[C@H](C)C1 ZINC000336189621 134123172 /nfs/dbraw/zinc/12/31/72/134123172.db2.gz IDEBEWODGPXZLQ-IUCAKERBSA-N 1 2 211.334 2.331 20 0 BEADLO C[C@@H](c1csnn1)[N@H+]1CCC[C@H](C)C1 ZINC000336189621 134123173 /nfs/dbraw/zinc/12/31/73/134123173.db2.gz IDEBEWODGPXZLQ-IUCAKERBSA-N 1 2 211.334 2.331 20 0 BEADLO CC(C)[C@@H]1CCC[N@H+](Cc2cn[nH]n2)CC1 ZINC000336190486 134123442 /nfs/dbraw/zinc/12/34/42/134123442.db2.gz JMGJEFPCWPFRLS-LLVKDONJSA-N 1 2 222.336 2.063 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CC[C@H]2C2CC2)[nH+]1 ZINC000336198299 134127288 /nfs/dbraw/zinc/12/72/88/134127288.db2.gz FUJXPZBCHFKROQ-NSHDSACASA-N 1 2 228.299 2.255 20 0 BEADLO OC[C@@H]1C[C@@H](F)C[N@@H+]1Cc1ccccc1Cl ZINC000336208591 134133313 /nfs/dbraw/zinc/13/33/13/134133313.db2.gz CRYJVKBDTMLYKN-MNOVXSKESA-N 1 2 243.709 2.245 20 0 BEADLO OC[C@@H]1C[C@@H](F)C[N@H+]1Cc1ccccc1Cl ZINC000336208591 134133314 /nfs/dbraw/zinc/13/33/14/134133314.db2.gz CRYJVKBDTMLYKN-MNOVXSKESA-N 1 2 243.709 2.245 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)[C@@H]1CC12CCCCC2 ZINC000336213603 134135424 /nfs/dbraw/zinc/13/54/24/134135424.db2.gz JJWXNXFRVWNVRL-NSHDSACASA-N 1 2 247.342 2.339 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)[C@H]1CC12CCCCC2 ZINC000336213602 134135720 /nfs/dbraw/zinc/13/57/20/134135720.db2.gz JJWXNXFRVWNVRL-LLVKDONJSA-N 1 2 247.342 2.339 20 0 BEADLO Cc1nc(N2C[C@@H]3CCCC[C@@H]3C2)cc[nH+]1 ZINC000176974284 134295185 /nfs/dbraw/zinc/29/51/85/134295185.db2.gz CWYRHPRXWKARKS-TXEJJXNPSA-N 1 2 217.316 2.411 20 0 BEADLO CCc1ncnc(N[C@@H](CC)c2[nH]cc[nH+]2)c1F ZINC000221225472 134322507 /nfs/dbraw/zinc/32/25/07/134322507.db2.gz KOGHINIFJZGMCM-VIFPVBQESA-N 1 2 249.293 2.464 20 0 BEADLO Cc1cc(NC(=O)N2CCCO[C@@H](C)C2)cc[nH+]1 ZINC000179822302 134324331 /nfs/dbraw/zinc/32/43/31/134324331.db2.gz RBCNLMWZWNWOSZ-NSHDSACASA-N 1 2 249.314 2.033 20 0 BEADLO CCc1nc(CC)n(Cc2ccc(C)[nH+]c2C)n1 ZINC000185374791 134377411 /nfs/dbraw/zinc/37/74/11/134377411.db2.gz RSMJHFAQBFRVHR-UHFFFAOYSA-N 1 2 244.342 2.463 20 0 BEADLO COc1cccc([C@H](C)[NH2+]Cc2ncccn2)c1 ZINC000148320784 134446218 /nfs/dbraw/zinc/44/62/18/134446218.db2.gz PZDRISSWQZMXBX-NSHDSACASA-N 1 2 243.310 2.336 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@@H](C)c2cnccn2)C[C@@H](C)O1 ZINC000248599798 135016017 /nfs/dbraw/zinc/01/60/17/135016017.db2.gz BWWLMARARKZAJW-GRYCIOLGSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@@H]1C[N@H+]([C@@H](C)c2cnccn2)C[C@@H](C)O1 ZINC000248599798 135016020 /nfs/dbraw/zinc/01/60/20/135016020.db2.gz BWWLMARARKZAJW-GRYCIOLGSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H]1C[C@H](C(=O)NCCc2[nH]cc[nH+]2)C[C@@H](C)C1 ZINC000248593454 135016072 /nfs/dbraw/zinc/01/60/72/135016072.db2.gz SFYIOIIVAWFAKV-GDNZZTSVSA-N 1 2 249.358 2.141 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@H](C)c2cnccn2)C[C@@H](C)O1 ZINC000248599799 135016333 /nfs/dbraw/zinc/01/63/33/135016333.db2.gz BWWLMARARKZAJW-IJLUTSLNSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@@H]1C[N@H+]([C@H](C)c2cnccn2)C[C@@H](C)O1 ZINC000248599799 135016334 /nfs/dbraw/zinc/01/63/34/135016334.db2.gz BWWLMARARKZAJW-IJLUTSLNSA-N 1 2 235.331 2.037 20 0 BEADLO CCC(C)(C)c1csc([C@H]2COCC[NH2+]2)n1 ZINC000261571741 135110355 /nfs/dbraw/zinc/11/03/55/135110355.db2.gz HURXEXLCCPNRGN-SECBINFHSA-N 1 2 240.372 2.492 20 0 BEADLO c1coc([C@H]2C[N@H+](C[C@H]3CCC=CO3)CCO2)c1 ZINC000253309345 135126042 /nfs/dbraw/zinc/12/60/42/135126042.db2.gz DNPKBLFWVIZNIV-TZMCWYRMSA-N 1 2 249.310 2.346 20 0 BEADLO c1coc([C@H]2C[N@@H+](C[C@H]3CCC=CO3)CCO2)c1 ZINC000253309345 135126043 /nfs/dbraw/zinc/12/60/43/135126043.db2.gz DNPKBLFWVIZNIV-TZMCWYRMSA-N 1 2 249.310 2.346 20 0 BEADLO CN(c1[nH]c2ccccc2[nH+]1)C1CCOCC1 ZINC000258755660 135133969 /nfs/dbraw/zinc/13/39/69/135133969.db2.gz IUOHVWYUOSFCRD-UHFFFAOYSA-N 1 2 231.299 2.178 20 0 BEADLO C[NH2+]Cc1noc([C@H](C)c2cccs2)n1 ZINC000261558156 135198548 /nfs/dbraw/zinc/19/85/48/135198548.db2.gz XXMCWOFBNIFGME-SSDOTTSWSA-N 1 2 223.301 2.002 20 0 BEADLO Cc1ccc([C@H]([NH3+])c2nc(CC3CC3)no2)cc1 ZINC000261716643 135247502 /nfs/dbraw/zinc/24/75/02/135247502.db2.gz JIDILDTYVBIIJC-ZDUSSCGKSA-N 1 2 243.310 2.379 20 0 BEADLO CCCC[N@@H+]1CC(=O)N[C@@H]1[C@H]1CCCC[C@H]1C ZINC000342256386 135258543 /nfs/dbraw/zinc/25/85/43/135258543.db2.gz ZSEOFMNTTOGRNP-DYEKYZERSA-N 1 2 238.375 2.371 20 0 BEADLO CCCC[N@H+]1CC(=O)N[C@@H]1[C@H]1CCCC[C@H]1C ZINC000342256386 135258545 /nfs/dbraw/zinc/25/85/45/135258545.db2.gz ZSEOFMNTTOGRNP-DYEKYZERSA-N 1 2 238.375 2.371 20 0 BEADLO C[C@H]1C[C@H](C)N(c2cc(N3CCCC3)[nH+]cn2)C1 ZINC000342350543 135261609 /nfs/dbraw/zinc/26/16/09/135261609.db2.gz PKUNQXTWXVFHCV-RYUDHWBXSA-N 1 2 246.358 2.312 20 0 BEADLO C[C@H]1C[C@H](C)N(c2cc(N3CCCC3)nc[nH+]2)C1 ZINC000342350543 135261610 /nfs/dbraw/zinc/26/16/10/135261610.db2.gz PKUNQXTWXVFHCV-RYUDHWBXSA-N 1 2 246.358 2.312 20 0 BEADLO CO[C@@H](CNc1cc[nH+]c(C(C)C)n1)C(C)C ZINC000342436263 135274104 /nfs/dbraw/zinc/27/41/04/135274104.db2.gz KJIDOXXRRLBPJI-NSHDSACASA-N 1 2 237.347 2.105 20 0 BEADLO CCCCNC(=O)[C@@H](C)[N@H+](C)Cc1ccoc1 ZINC000342638618 135299244 /nfs/dbraw/zinc/29/92/44/135299244.db2.gz OBFZNXNCQCZZMR-LLVKDONJSA-N 1 2 238.331 2.016 20 0 BEADLO CCCCNC(=O)[C@@H](C)[N@@H+](C)Cc1ccoc1 ZINC000342638618 135299245 /nfs/dbraw/zinc/29/92/45/135299245.db2.gz OBFZNXNCQCZZMR-LLVKDONJSA-N 1 2 238.331 2.016 20 0 BEADLO Cc1[nH]c2ccc(Cn3ccsc3=O)cc2[nH+]1 ZINC000342652959 135306892 /nfs/dbraw/zinc/30/68/92/135306892.db2.gz KTVCEUSMLRNFLU-UHFFFAOYSA-N 1 2 245.307 2.143 20 0 BEADLO Cc1[nH]c2cc(Cn3ccsc3=O)ccc2[nH+]1 ZINC000342652959 135306894 /nfs/dbraw/zinc/30/68/94/135306894.db2.gz KTVCEUSMLRNFLU-UHFFFAOYSA-N 1 2 245.307 2.143 20 0 BEADLO Cc1c[nH+]c(CN(C)[C@H](C)c2cccnc2)n1C ZINC000342796278 135320103 /nfs/dbraw/zinc/32/01/03/135320103.db2.gz JUJBOYHIRUJTIK-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1c[nH+]c(CN(C)Cc2cccs2)n1C ZINC000342801803 135322134 /nfs/dbraw/zinc/32/21/34/135322134.db2.gz YWPFYNUEVRAZHK-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)C(C)(C)c2c[nH]c[nH+]2)C1 ZINC000334307301 135350111 /nfs/dbraw/zinc/35/01/11/135350111.db2.gz HQJPANRVURFXRF-MNOVXSKESA-N 1 2 249.358 2.382 20 0 BEADLO C[C@H]1CCN(c2ccccn2)C[C@H]1n1cc[nH+]c1 ZINC000268230017 135364144 /nfs/dbraw/zinc/36/41/44/135364144.db2.gz FNCKMIASIUHESB-QWHCGFSZSA-N 1 2 242.326 2.366 20 0 BEADLO CC(C)[C@H]1CC[C@H](C(=O)NCc2[nH]cc[nH+]2)CC1 ZINC000269971049 135364661 /nfs/dbraw/zinc/36/46/61/135364661.db2.gz KYBRWURYGLOERW-HAQNSBGRSA-N 1 2 249.358 2.488 20 0 BEADLO O[C@H]1CC[C@H](Nc2cc[nH+]c(C3CC3)n2)CC1 ZINC000269835952 135364818 /nfs/dbraw/zinc/36/48/18/135364818.db2.gz AQAOMZXDWAHHST-XYPYZODXSA-N 1 2 233.315 2.069 20 0 BEADLO CCc1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)nc1 ZINC000334384989 135381005 /nfs/dbraw/zinc/38/10/05/135381005.db2.gz MQCFIUKEJKJKBC-OKILXGFUSA-N 1 2 232.327 2.007 20 0 BEADLO CCc1ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)nc1 ZINC000334384989 135381006 /nfs/dbraw/zinc/38/10/06/135381006.db2.gz MQCFIUKEJKJKBC-OKILXGFUSA-N 1 2 232.327 2.007 20 0 BEADLO C[N@H+](Cc1cnccn1)Cc1ccccc1F ZINC000080966043 135385207 /nfs/dbraw/zinc/38/52/07/135385207.db2.gz RKUOULXOQNQWKC-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[N@@H+](Cc1cnccn1)Cc1ccccc1F ZINC000080966043 135385208 /nfs/dbraw/zinc/38/52/08/135385208.db2.gz RKUOULXOQNQWKC-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[C@H]1CCC[C@@H](C(=O)N(C)Cc2[nH+]ccn2C)C1 ZINC000334418936 135399614 /nfs/dbraw/zinc/39/96/14/135399614.db2.gz PWGSZDYVCAXGMR-NWDGAFQWSA-N 1 2 249.358 2.205 20 0 BEADLO Cc1ccc(NC[C@H]2CCCOC2)c[nH+]1 ZINC000164688749 135434419 /nfs/dbraw/zinc/43/44/19/135434419.db2.gz RQQMGMNSZTWLFN-LLVKDONJSA-N 1 2 206.289 2.229 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)C(C)(C)C2CC2)c2[nH+]ccn21 ZINC000334611025 135779225 /nfs/dbraw/zinc/77/92/25/135779225.db2.gz HYVQSCCHXVAJAN-MWLCHTKSSA-N 1 2 247.342 2.441 20 0 BEADLO C[NH2+]Cc1noc(C2C[C@H](C)C[C@@H](C)C2)n1 ZINC000334778286 135810337 /nfs/dbraw/zinc/81/03/37/135810337.db2.gz OJWNSPDMMGBYFA-RKDXNWHRSA-N 1 2 223.320 2.329 20 0 BEADLO CC1(C)C[C@@H]1C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000334829160 135816331 /nfs/dbraw/zinc/81/63/31/135816331.db2.gz RIMGQICJISLHFJ-NXEZZACHSA-N 1 2 233.315 2.119 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1ncnn1C(C)(C)C ZINC000335068653 135884166 /nfs/dbraw/zinc/88/41/66/135884166.db2.gz VGJLZGQWSUCSCO-NXEZZACHSA-N 1 2 222.336 2.016 20 0 BEADLO C[C@]12CC[N@H+](Cc3csnn3)C[C@H]1C2(F)F ZINC000335283645 136001474 /nfs/dbraw/zinc/00/14/74/136001474.db2.gz FBFOCTPMHYLDEA-BDAKNGLRSA-N 1 2 245.298 2.015 20 0 BEADLO C[C@]12CC[N@@H+](Cc3csnn3)C[C@H]1C2(F)F ZINC000335283645 136001475 /nfs/dbraw/zinc/00/14/75/136001475.db2.gz FBFOCTPMHYLDEA-BDAKNGLRSA-N 1 2 245.298 2.015 20 0 BEADLO C[C@@H]1CCC[C@H]1CC(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000347711647 136003288 /nfs/dbraw/zinc/00/32/88/136003288.db2.gz UTYABCUHKQJQTG-MNOVXSKESA-N 1 2 235.331 2.194 20 0 BEADLO CCc1ccc(C[N@H+](C)Cc2cnccn2)cn1 ZINC000347838764 136015068 /nfs/dbraw/zinc/01/50/68/136015068.db2.gz BBSUDEYNZCXWLT-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO CCc1ccc(C[N@@H+](C)Cc2cnccn2)cn1 ZINC000347838764 136015069 /nfs/dbraw/zinc/01/50/69/136015069.db2.gz BBSUDEYNZCXWLT-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N(C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000335316074 136024581 /nfs/dbraw/zinc/02/45/81/136024581.db2.gz ORFSIJFHJDPIFM-VXGBXAGGSA-N 1 2 249.358 2.379 20 0 BEADLO Cc1nnc(C[N@@H+]2CC[C@@H]2c2ccccc2)[nH]1 ZINC000335337562 136044654 /nfs/dbraw/zinc/04/46/54/136044654.db2.gz WRBYGHFKJAUTQB-GFCCVEGCSA-N 1 2 228.299 2.060 20 0 BEADLO Cc1nnc(C[N@H+]2CC[C@@H]2c2ccccc2)[nH]1 ZINC000335337562 136044655 /nfs/dbraw/zinc/04/46/55/136044655.db2.gz WRBYGHFKJAUTQB-GFCCVEGCSA-N 1 2 228.299 2.060 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CC[C@H](C)[C@H](C)C2)c[nH+]1 ZINC000348197387 136051368 /nfs/dbraw/zinc/05/13/68/136051368.db2.gz CZBVENQGJDGERN-IQJOONFLSA-N 1 2 235.331 2.273 20 0 BEADLO CC[NH2+][C@@H](C)c1noc(Cc2ccccc2)n1 ZINC000348283646 136059863 /nfs/dbraw/zinc/05/98/63/136059863.db2.gz DHMSLNSPIKNWLQ-JTQLQIEISA-N 1 2 231.299 2.331 20 0 BEADLO Cc1nnc(C[NH+]2C[C@@H](C)S[C@H](C)C2)s1 ZINC000335350954 136068863 /nfs/dbraw/zinc/06/88/63/136068863.db2.gz YJABJCIIFFGTLG-HTQZYQBOSA-N 1 2 243.401 2.172 20 0 BEADLO Cc1cnn(C)c1C[N@H+](C)Cc1cnccc1C ZINC000348356726 136072695 /nfs/dbraw/zinc/07/26/95/136072695.db2.gz GCLMISLXOZXKAY-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cnn(C)c1C[N@@H+](C)Cc1cnccc1C ZINC000348356726 136072696 /nfs/dbraw/zinc/07/26/96/136072696.db2.gz GCLMISLXOZXKAY-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO CCc1ccc(C[NH2+][C@@H](C)c2nc(C)no2)cn1 ZINC000348410336 136077330 /nfs/dbraw/zinc/07/73/30/136077330.db2.gz OPERSAVXIFUNQE-VIFPVBQESA-N 1 2 246.314 2.186 20 0 BEADLO Cc1n[nH]cc1Nc1nc(C)[nH+]c(C)c1C ZINC000348705553 136116384 /nfs/dbraw/zinc/11/63/84/136116384.db2.gz LWKNKEKGYRVISO-UHFFFAOYSA-N 1 2 217.276 2.177 20 0 BEADLO CCc1[nH]c(CNC(=O)C2CCCCC2)c[nH+]1 ZINC001646317575 1172728720 /nfs/dbraw/zinc/72/87/20/1172728720.db2.gz LTNIDOBOIPDKSU-UHFFFAOYSA-N 1 2 235.331 2.169 20 0 BEADLO CCc1[nH]cc(CNC(=O)C2CCCCC2)[nH+]1 ZINC001646317575 1172728729 /nfs/dbraw/zinc/72/87/29/1172728729.db2.gz LTNIDOBOIPDKSU-UHFFFAOYSA-N 1 2 235.331 2.169 20 0 BEADLO CNc1cc(N2CC[C@@H](C)C[C@H]2C)nc[nH+]1 ZINC000087826663 1172742235 /nfs/dbraw/zinc/74/22/35/1172742235.db2.gz CXISNOXFZXKXMO-NXEZZACHSA-N 1 2 220.320 2.143 20 0 BEADLO CNc1cc(N2CC[C@@H](C)C[C@H]2C)[nH+]cn1 ZINC000087826663 1172742241 /nfs/dbraw/zinc/74/22/41/1172742241.db2.gz CXISNOXFZXKXMO-NXEZZACHSA-N 1 2 220.320 2.143 20 0 BEADLO CCc1ncc(C[NH2+]Cc2ncc(C)s2)cn1 ZINC001647019311 1172749498 /nfs/dbraw/zinc/74/94/98/1172749498.db2.gz LKCTZBWGBCXMQI-UHFFFAOYSA-N 1 2 248.355 2.094 20 0 BEADLO Nc1ccc(-c2ccc3c(c2)COC3)c[nH+]1 ZINC000062334284 1172755679 /nfs/dbraw/zinc/75/56/79/1172755679.db2.gz ZONNRTZLNFVIIF-UHFFFAOYSA-N 1 2 212.252 2.361 20 0 BEADLO CC(C)=CC[N@@H+]1CCNC(=O)[C@@H]1c1ccccc1 ZINC000156240815 397756811 /nfs/dbraw/zinc/75/68/11/397756811.db2.gz SEJIOUBIUSGQGJ-AWEZNQCLSA-N 1 2 244.338 2.126 20 0 BEADLO CC(C)=CC[N@H+]1CCNC(=O)[C@@H]1c1ccccc1 ZINC000156240815 397756813 /nfs/dbraw/zinc/75/68/13/397756813.db2.gz SEJIOUBIUSGQGJ-AWEZNQCLSA-N 1 2 244.338 2.126 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@@H+]1Cc1ccccc1F ZINC000156323346 397758222 /nfs/dbraw/zinc/75/82/22/397758222.db2.gz JSAGUKYBDWHQNO-MNOVXSKESA-N 1 2 223.291 2.435 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1ccccc1F ZINC000156323346 397758224 /nfs/dbraw/zinc/75/82/24/397758224.db2.gz JSAGUKYBDWHQNO-MNOVXSKESA-N 1 2 223.291 2.435 20 0 BEADLO CC(C)n1cc(C[NH2+][C@H](C)c2ccccn2)nn1 ZINC000289693993 397739435 /nfs/dbraw/zinc/73/94/35/397739435.db2.gz KHLHBFCERLMDMW-LLVKDONJSA-N 1 2 245.330 2.105 20 0 BEADLO CCC1CC([NH2+][C@@H](C)C(=O)OC(C)(C)C)C1 ZINC000310017981 397875474 /nfs/dbraw/zinc/87/54/74/397875474.db2.gz LTACNCXFLKCVTM-WHXUTIOJSA-N 1 2 227.348 2.495 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC1CC2(CCC2)C1 ZINC000650107495 397927667 /nfs/dbraw/zinc/92/76/67/397927667.db2.gz ROSCZVGKMDUWMP-UHFFFAOYSA-N 1 2 245.326 2.266 20 0 BEADLO CC[C@@H](C)[C@@H](C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000356556779 397931414 /nfs/dbraw/zinc/93/14/14/397931414.db2.gz YVUBSDZUMAZHNX-NXEZZACHSA-N 1 2 223.320 2.050 20 0 BEADLO CC(F)(F)CNc1cc[nH+]c(C(C)(C)C)n1 ZINC000382333311 397936440 /nfs/dbraw/zinc/93/64/40/397936440.db2.gz XFTYRKLMWZFSKD-UHFFFAOYSA-N 1 2 229.274 2.263 20 0 BEADLO CN(CCCCO)c1cc2ccccc2c[nH+]1 ZINC000631241441 397941660 /nfs/dbraw/zinc/94/16/60/397941660.db2.gz XHKQVQAXKQDKPF-UHFFFAOYSA-N 1 2 230.311 2.444 20 0 BEADLO COC(=O)C[N@H+](C/C=C/c1ccccc1)C1CC1 ZINC000267705131 397949007 /nfs/dbraw/zinc/94/90/07/397949007.db2.gz VHBGHSCGHHVUTK-VMPITWQZSA-N 1 2 245.322 2.337 20 0 BEADLO COC(=O)C[N@@H+](C/C=C/c1ccccc1)C1CC1 ZINC000267705131 397949009 /nfs/dbraw/zinc/94/90/09/397949009.db2.gz VHBGHSCGHHVUTK-VMPITWQZSA-N 1 2 245.322 2.337 20 0 BEADLO C=Cn1cc(CNc2ccc(SC)c[nH+]2)cn1 ZINC000446963022 397949607 /nfs/dbraw/zinc/94/96/07/397949607.db2.gz SNAIKJSGHMRZHD-UHFFFAOYSA-N 1 2 246.339 2.135 20 0 BEADLO CC[C@@H]([NH2+][C@@H]1C[C@H]1CC(C)(C)C)C(=O)OC ZINC000593182558 397956527 /nfs/dbraw/zinc/95/65/27/397956527.db2.gz UBUVCBBYPLBNLN-HBNTYKKESA-N 1 2 227.348 2.352 20 0 BEADLO Cc1cnc(C[N@H+](C)C[C@H]2CCCCO2)s1 ZINC000271434313 397967966 /nfs/dbraw/zinc/96/79/66/397967966.db2.gz BRAFRLUKVGWEEF-LLVKDONJSA-N 1 2 240.372 2.452 20 0 BEADLO Cc1cnc(C[N@@H+](C)C[C@H]2CCCCO2)s1 ZINC000271434313 397967969 /nfs/dbraw/zinc/96/79/69/397967969.db2.gz BRAFRLUKVGWEEF-LLVKDONJSA-N 1 2 240.372 2.452 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CCC2(CCC2)CC1 ZINC000367680915 397897805 /nfs/dbraw/zinc/89/78/05/397897805.db2.gz APSHGBNIPANMND-UHFFFAOYSA-N 1 2 219.332 2.484 20 0 BEADLO CCCc1nc(C[N@H+](C)CC2CCC2)no1 ZINC000111296873 397907513 /nfs/dbraw/zinc/90/75/13/397907513.db2.gz FGTOVEOQJQBAOO-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO CCCc1nc(C[N@@H+](C)CC2CCC2)no1 ZINC000111296873 397907515 /nfs/dbraw/zinc/90/75/15/397907515.db2.gz FGTOVEOQJQBAOO-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO CCN(CC(C)C)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000649599200 397990794 /nfs/dbraw/zinc/99/07/94/397990794.db2.gz RQYMOQZPJACWIO-LBPRGKRZSA-N 1 2 237.347 2.339 20 0 BEADLO CCc1ncc(C[NH2+][C@@H](C)C(F)F)s1 ZINC000389936646 397999106 /nfs/dbraw/zinc/99/91/06/397999106.db2.gz NHFKXVKIFCDNOU-LURJTMIESA-N 1 2 220.288 2.449 20 0 BEADLO Cc1c[nH+]c(C)c(NCc2cn[nH]c2)c1 ZINC000650241660 398003323 /nfs/dbraw/zinc/00/33/23/398003323.db2.gz FGMLXLNCHDSMKU-UHFFFAOYSA-N 1 2 202.261 2.034 20 0 BEADLO COCc1cc[nH+]c(NCc2ccco2)c1 ZINC000650244574 398005137 /nfs/dbraw/zinc/00/51/37/398005137.db2.gz FJECXNJGVPJCEC-UHFFFAOYSA-N 1 2 218.256 2.433 20 0 BEADLO COCc1cc[nH+]c(NCc2conc2C)c1 ZINC000650243806 398006072 /nfs/dbraw/zinc/00/60/72/398006072.db2.gz PYXCZOOEMHYOTH-UHFFFAOYSA-N 1 2 233.271 2.137 20 0 BEADLO CCc1cc[nH+]cc1NCc1ccc(CO)o1 ZINC000650243461 398006226 /nfs/dbraw/zinc/00/62/26/398006226.db2.gz ZXSXJDAGTIJGKI-UHFFFAOYSA-N 1 2 232.283 2.341 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CCC=C(F)C1 ZINC000274664768 398012386 /nfs/dbraw/zinc/01/23/86/398012386.db2.gz QQALDIUVUCBLIE-UHFFFAOYSA-N 1 2 235.262 2.481 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)NCc1[nH]cc[nH+]1 ZINC000274690962 398013744 /nfs/dbraw/zinc/01/37/44/398013744.db2.gz PYJNUJNVVJYYDH-VQHVLOKHSA-N 1 2 221.304 2.018 20 0 BEADLO CC(=CC(C)(C)C)C(=O)NCc1[nH]cc[nH+]1 ZINC000274690962 398013746 /nfs/dbraw/zinc/01/37/46/398013746.db2.gz PYJNUJNVVJYYDH-VQHVLOKHSA-N 1 2 221.304 2.018 20 0 BEADLO Cn1nc(C2CC2)nc1C[N@@H+]1CCC12CCCC2 ZINC000649658524 398027969 /nfs/dbraw/zinc/02/79/69/398027969.db2.gz OLMNNPOKNDINIV-UHFFFAOYSA-N 1 2 246.358 2.211 20 0 BEADLO Cn1nc(C2CC2)nc1C[N@H+]1CCC12CCCC2 ZINC000649658524 398027974 /nfs/dbraw/zinc/02/79/74/398027974.db2.gz OLMNNPOKNDINIV-UHFFFAOYSA-N 1 2 246.358 2.211 20 0 BEADLO CCn1cc[nH+]c1CN1CCCC(F)(F)C1 ZINC000649692933 398040281 /nfs/dbraw/zinc/04/02/81/398040281.db2.gz KNWLIUYCWPNIKJ-UHFFFAOYSA-N 1 2 229.274 2.134 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H]1CCO[C@@H](C)C1 ZINC000271979893 397976373 /nfs/dbraw/zinc/97/63/73/397976373.db2.gz OKNHGVWTPMKADM-QWRGUYRKSA-N 1 2 234.299 2.144 20 0 BEADLO COCC[C@H]([NH2+]Cc1ncc[nH]1)c1ccc(C)o1 ZINC000272388626 397978917 /nfs/dbraw/zinc/97/89/17/397978917.db2.gz ZBUHSQQSDXYQOJ-NSHDSACASA-N 1 2 249.314 2.179 20 0 BEADLO C[C@@H]1CC[C@H](C[N@@H+]2CCCC(F)(F)C2)O1 ZINC000649695282 398042697 /nfs/dbraw/zinc/04/26/97/398042697.db2.gz PQQWJEYSARXHOS-NXEZZACHSA-N 1 2 219.275 2.285 20 0 BEADLO C[C@@H]1CC[C@H](C[N@H+]2CCCC(F)(F)C2)O1 ZINC000649695282 398042701 /nfs/dbraw/zinc/04/27/01/398042701.db2.gz PQQWJEYSARXHOS-NXEZZACHSA-N 1 2 219.275 2.285 20 0 BEADLO C[C@@H]1CC[C@@H](C[N@@H+]2CCCC(F)(F)C2)O1 ZINC000649695285 398042887 /nfs/dbraw/zinc/04/28/87/398042887.db2.gz PQQWJEYSARXHOS-ZJUUUORDSA-N 1 2 219.275 2.285 20 0 BEADLO C[C@@H]1CC[C@@H](C[N@H+]2CCCC(F)(F)C2)O1 ZINC000649695285 398042891 /nfs/dbraw/zinc/04/28/91/398042891.db2.gz PQQWJEYSARXHOS-ZJUUUORDSA-N 1 2 219.275 2.285 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cnc(C)s2)[C@@H](C)CO1 ZINC000649731033 398069040 /nfs/dbraw/zinc/06/90/40/398069040.db2.gz BOPYDDSZFIZMIN-GXSJLCMTSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cnc(C)s2)[C@@H](C)CO1 ZINC000649731033 398069044 /nfs/dbraw/zinc/06/90/44/398069044.db2.gz BOPYDDSZFIZMIN-GXSJLCMTSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2c(C)noc2C)[C@@H](C)CO1 ZINC000649731512 398071266 /nfs/dbraw/zinc/07/12/66/398071266.db2.gz INGGTLSKVQLRQB-JOYOIKCWSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2c(C)noc2C)[C@@H](C)CO1 ZINC000649731512 398071271 /nfs/dbraw/zinc/07/12/71/398071271.db2.gz INGGTLSKVQLRQB-JOYOIKCWSA-N 1 2 238.331 2.291 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2ccncc2F)C[C@@H]1F ZINC000648504854 398073370 /nfs/dbraw/zinc/07/33/70/398073370.db2.gz GDYUGJVXVLQKCK-SKDRFNHKSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2ccncc2F)C[C@@H]1F ZINC000648504854 398073373 /nfs/dbraw/zinc/07/33/73/398073373.db2.gz GDYUGJVXVLQKCK-SKDRFNHKSA-N 1 2 226.270 2.401 20 0 BEADLO CC[C@H]1C[N@H+](Cc2nc(C)cs2)[C@@H](C)CO1 ZINC000649734452 398075059 /nfs/dbraw/zinc/07/50/59/398075059.db2.gz WWGOVWJFBPSQMR-QWRGUYRKSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2nc(C)cs2)[C@@H](C)CO1 ZINC000649734452 398075062 /nfs/dbraw/zinc/07/50/62/398075062.db2.gz WWGOVWJFBPSQMR-QWRGUYRKSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2oc(C)nc2C)[C@H](C)CO1 ZINC000649735805 398077145 /nfs/dbraw/zinc/07/71/45/398077145.db2.gz QSPKNDPLIMUJOE-BXKDBHETSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2oc(C)nc2C)[C@H](C)CO1 ZINC000649735805 398077148 /nfs/dbraw/zinc/07/71/48/398077148.db2.gz QSPKNDPLIMUJOE-BXKDBHETSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cncc(F)c2)[C@H](C)CO1 ZINC000649736174 398077609 /nfs/dbraw/zinc/07/76/09/398077609.db2.gz XJSBDGBSLOQQLL-MFKMUULPSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cncc(F)c2)[C@H](C)CO1 ZINC000649736174 398077611 /nfs/dbraw/zinc/07/76/11/398077611.db2.gz XJSBDGBSLOQQLL-MFKMUULPSA-N 1 2 238.306 2.220 20 0 BEADLO CC[N@H+](Cc1cscn1)[C@@H]1CCCOC1 ZINC000649758964 398089037 /nfs/dbraw/zinc/08/90/37/398089037.db2.gz BGALRERYWTXISE-LLVKDONJSA-N 1 2 226.345 2.144 20 0 BEADLO CC[N@@H+](Cc1cscn1)[C@@H]1CCCOC1 ZINC000649758964 398089039 /nfs/dbraw/zinc/08/90/39/398089039.db2.gz BGALRERYWTXISE-LLVKDONJSA-N 1 2 226.345 2.144 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1C[C@H]1C1CCC1 ZINC000649704271 398052308 /nfs/dbraw/zinc/05/23/08/398052308.db2.gz AVNFNWMQEVNRCR-NWDGAFQWSA-N 1 2 230.311 2.187 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1cc(Cl)cs1 ZINC000280195391 398054641 /nfs/dbraw/zinc/05/46/41/398054641.db2.gz BBZJBEKEGOVRMU-ZETCQYMHSA-N 1 2 247.747 2.395 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1cc(Cl)cs1 ZINC000280195391 398054643 /nfs/dbraw/zinc/05/46/43/398054643.db2.gz BBZJBEKEGOVRMU-ZETCQYMHSA-N 1 2 247.747 2.395 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@@H+]1Cc1cnc(C)nc1 ZINC000649716908 398057920 /nfs/dbraw/zinc/05/79/20/398057920.db2.gz QLWRVOVTIKTDST-CYBMUJFWSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@H+]1Cc1cnc(C)nc1 ZINC000649716908 398057924 /nfs/dbraw/zinc/05/79/24/398057924.db2.gz QLWRVOVTIKTDST-CYBMUJFWSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1Cc1cc(C)no1 ZINC000649717767 398059152 /nfs/dbraw/zinc/05/91/52/398059152.db2.gz MEONBTUOTZSPLV-NEPJUHHUSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@H+]1Cc1cc(C)no1 ZINC000649717767 398059155 /nfs/dbraw/zinc/05/91/55/398059155.db2.gz MEONBTUOTZSPLV-NEPJUHHUSA-N 1 2 238.331 2.372 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1cccc(O)c1Cl ZINC000293678816 398117220 /nfs/dbraw/zinc/11/72/20/398117220.db2.gz PNKHDZAWOZJKHW-SNVBAGLBSA-N 1 2 241.718 2.266 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1cccc(O)c1Cl ZINC000293678816 398117223 /nfs/dbraw/zinc/11/72/23/398117223.db2.gz PNKHDZAWOZJKHW-SNVBAGLBSA-N 1 2 241.718 2.266 20 0 BEADLO CC[C@H](C)[N@@H+](C)Cc1noc(C(C)C)n1 ZINC000104688289 171310156 /nfs/dbraw/zinc/31/01/56/171310156.db2.gz GQOZUKUEJBDTBF-VIFPVBQESA-N 1 2 211.309 2.423 20 0 BEADLO Cc1ccoc1C[NH2+][C@@H](C)c1cc(C)n(C)n1 ZINC000294339585 398126241 /nfs/dbraw/zinc/12/62/41/398126241.db2.gz PHUBDEFWSCRXMU-NSHDSACASA-N 1 2 233.315 2.481 20 0 BEADLO Fc1ccc(C[NH+]2CC3(C2)CCOC3)cc1F ZINC000294110924 398122760 /nfs/dbraw/zinc/12/27/60/398122760.db2.gz SPHSJKOERUFCNC-UHFFFAOYSA-N 1 2 239.265 2.187 20 0 BEADLO CC(C)C[NH2+][C@H](c1cccs1)c1nnc[nH]1 ZINC000293615633 167011954 /nfs/dbraw/zinc/01/19/54/167011954.db2.gz GWIXFEGBVONXFM-SNVBAGLBSA-N 1 2 236.344 2.201 20 0 BEADLO CCCCCC[N@@H+]1CCSC[C@@H]1C(=O)OC ZINC001648336456 1172826105 /nfs/dbraw/zinc/82/61/05/1172826105.db2.gz KUNNFAOPKKIOCA-LLVKDONJSA-N 1 2 245.388 2.157 20 0 BEADLO CCCCCC[N@H+]1CCSC[C@@H]1C(=O)OC ZINC001648336456 1172826113 /nfs/dbraw/zinc/82/61/13/1172826113.db2.gz KUNNFAOPKKIOCA-LLVKDONJSA-N 1 2 245.388 2.157 20 0 BEADLO CCSCC[N@H+](C)Cc1csnc1OC ZINC001648429774 1172832958 /nfs/dbraw/zinc/83/29/58/1172832958.db2.gz SKTRLXJMKRVCBA-UHFFFAOYSA-N 1 2 246.401 2.337 20 0 BEADLO CCSCC[N@@H+](C)Cc1csnc1OC ZINC001648429774 1172832961 /nfs/dbraw/zinc/83/29/61/1172832961.db2.gz SKTRLXJMKRVCBA-UHFFFAOYSA-N 1 2 246.401 2.337 20 0 BEADLO c1n[nH]nc1C[N@@H+]1CCC[C@@H](C2CCCC2)C1 ZINC001648624368 1172858457 /nfs/dbraw/zinc/85/84/57/1172858457.db2.gz LCHLFJXOXDYOOA-GFCCVEGCSA-N 1 2 234.347 2.207 20 0 BEADLO c1n[nH]nc1C[N@H+]1CCC[C@@H](C2CCCC2)C1 ZINC001648624368 1172858464 /nfs/dbraw/zinc/85/84/64/1172858464.db2.gz LCHLFJXOXDYOOA-GFCCVEGCSA-N 1 2 234.347 2.207 20 0 BEADLO Cc1cc(N2CC3(CC3)C2)nc(C2CC2)[nH+]1 ZINC000334793732 487559612 /nfs/dbraw/zinc/55/96/12/487559612.db2.gz RPNIPNKIGUGQJB-UHFFFAOYSA-N 1 2 215.300 2.263 20 0 BEADLO Cc1cc(NC2(CO)CCCC2)nc(C2CC2)[nH+]1 ZINC000674338339 487561373 /nfs/dbraw/zinc/56/13/73/487561373.db2.gz IOQCUIYOJCIFCF-UHFFFAOYSA-N 1 2 247.342 2.379 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C(C1CC1)C1CC1 ZINC000120702817 490067711 /nfs/dbraw/zinc/06/77/11/490067711.db2.gz RRCFJHMSCSNWGL-UHFFFAOYSA-N 1 2 246.310 2.465 20 0 BEADLO CC(=O)CSCCc1[nH+]c2ccccc2n1C ZINC000530664943 322889513 /nfs/dbraw/zinc/88/95/13/322889513.db2.gz NEJHVHPLIRPJRZ-UHFFFAOYSA-N 1 2 248.351 2.438 20 0 BEADLO CCc1cc(C[NH2+]Cc2c(C)noc2C)on1 ZINC001650374120 1172884709 /nfs/dbraw/zinc/88/47/09/1172884709.db2.gz HRAZXTPRDQHVTB-UHFFFAOYSA-N 1 2 235.287 2.132 20 0 BEADLO CCc1cnc(C[N@H+]2CC=CCC2)s1 ZINC000680335009 487566928 /nfs/dbraw/zinc/56/69/28/487566928.db2.gz QDLQJYYTWWLAII-UHFFFAOYSA-N 1 2 208.330 2.467 20 0 BEADLO CCc1cnc(C[N@@H+]2CC=CCC2)s1 ZINC000680335009 487566931 /nfs/dbraw/zinc/56/69/31/487566931.db2.gz QDLQJYYTWWLAII-UHFFFAOYSA-N 1 2 208.330 2.467 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]CC1=CCCC1 ZINC000658290539 487579081 /nfs/dbraw/zinc/57/90/81/487579081.db2.gz BSHCHPWZYGQICI-SECBINFHSA-N 1 2 205.305 2.479 20 0 BEADLO Cc1cc(CNc2c[nH+]ccc2C)on1 ZINC000393746036 487579976 /nfs/dbraw/zinc/57/99/76/487579976.db2.gz NYQOCCPSFREHBK-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO CC(C)OCC[N@@H+]1CCO[C@@H](c2ccco2)C1 ZINC000121247060 167234357 /nfs/dbraw/zinc/23/43/57/167234357.db2.gz USZYKZPBIYYWTO-CYBMUJFWSA-N 1 2 239.315 2.078 20 0 BEADLO CC(C)OCC[N@H+]1CCO[C@@H](c2ccco2)C1 ZINC000121247060 167234361 /nfs/dbraw/zinc/23/43/61/167234361.db2.gz USZYKZPBIYYWTO-CYBMUJFWSA-N 1 2 239.315 2.078 20 0 BEADLO OCc1cc[nH+]c(NCc2ccc(Cl)o2)c1 ZINC001651239709 1172934740 /nfs/dbraw/zinc/93/47/40/1172934740.db2.gz YLEYJBADXNMMPY-UHFFFAOYSA-N 1 2 238.674 2.432 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NCC(C)(F)F ZINC000556455250 322913151 /nfs/dbraw/zinc/91/31/51/322913151.db2.gz FTFSMFFESUMQCL-MRVPVSSYSA-N 1 2 217.263 2.209 20 0 BEADLO CCC1(NC(=O)CCCn2cc[nH+]c2)CCC1 ZINC000674508131 487589254 /nfs/dbraw/zinc/58/92/54/487589254.db2.gz MLIYCDIAEWUKIJ-UHFFFAOYSA-N 1 2 235.331 2.112 20 0 BEADLO C[C@@H]1C[N@H+](CC2(F)CC2)C[C@@](C)(C(F)F)O1 ZINC000668821629 487597571 /nfs/dbraw/zinc/59/75/71/487597571.db2.gz IRUXMNXZKQSZIP-SCZZXKLOSA-N 1 2 237.265 2.233 20 0 BEADLO C[C@@H]1C[N@@H+](CC2(F)CC2)C[C@@](C)(C(F)F)O1 ZINC000668821629 487597574 /nfs/dbraw/zinc/59/75/74/487597574.db2.gz IRUXMNXZKQSZIP-SCZZXKLOSA-N 1 2 237.265 2.233 20 0 BEADLO Cc1cc(NC[C@@H](CO)C2CC2)nc(C2CC2)[nH+]1 ZINC000685931652 487599607 /nfs/dbraw/zinc/59/96/07/487599607.db2.gz VMDLJRZKGQDUMN-LBPRGKRZSA-N 1 2 247.342 2.093 20 0 BEADLO FCCNc1nc2ccccc2n2c[nH+]cc12 ZINC001651806431 1172990767 /nfs/dbraw/zinc/99/07/67/1172990767.db2.gz PICSFTCZFIQCJP-UHFFFAOYSA-N 1 2 230.246 2.264 20 0 BEADLO C[N@@H+](Cc1cscn1)CC1=CCSC1 ZINC000662270893 409573345 /nfs/dbraw/zinc/57/33/45/409573345.db2.gz QUCYYMXBYUECSC-UHFFFAOYSA-N 1 2 226.370 2.248 20 0 BEADLO C[N@H+](Cc1cscn1)CC1=CCSC1 ZINC000662270893 409573353 /nfs/dbraw/zinc/57/33/53/409573353.db2.gz QUCYYMXBYUECSC-UHFFFAOYSA-N 1 2 226.370 2.248 20 0 BEADLO CCc1nocc1C[N@H+]1C[C@@H](CC)OC[C@@H]1C ZINC000660912249 409961042 /nfs/dbraw/zinc/96/10/42/409961042.db2.gz IHDYZMIGJSSYOE-CMPLNLGQSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1nocc1C[N@@H+]1C[C@@H](CC)OC[C@@H]1C ZINC000660912249 409961049 /nfs/dbraw/zinc/96/10/49/409961049.db2.gz IHDYZMIGJSSYOE-CMPLNLGQSA-N 1 2 238.331 2.236 20 0 BEADLO CCn1cc(C[N@@H+]2C[C@@H](C)OCC23CCC3)cn1 ZINC000651975441 409966682 /nfs/dbraw/zinc/96/66/82/409966682.db2.gz DCTIKJKWRHFZPH-GFCCVEGCSA-N 1 2 249.358 2.046 20 0 BEADLO CCn1cc(C[N@H+]2C[C@@H](C)OCC23CCC3)cn1 ZINC000651975441 409966688 /nfs/dbraw/zinc/96/66/88/409966688.db2.gz DCTIKJKWRHFZPH-GFCCVEGCSA-N 1 2 249.358 2.046 20 0 BEADLO CC(C)n1ncnc1C[N@@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660931887 409978589 /nfs/dbraw/zinc/97/85/89/409978589.db2.gz RYXNITTVNVZHSD-RYUDHWBXSA-N 1 2 234.347 2.233 20 0 BEADLO CC(C)n1ncnc1C[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660931887 409978594 /nfs/dbraw/zinc/97/85/94/409978594.db2.gz RYXNITTVNVZHSD-RYUDHWBXSA-N 1 2 234.347 2.233 20 0 BEADLO COC1CC(Nc2[nH+]cccc2SC)C1 ZINC000651971727 409942861 /nfs/dbraw/zinc/94/28/61/409942861.db2.gz RXSCMGLSILEMJK-UHFFFAOYSA-N 1 2 224.329 2.393 20 0 BEADLO Cc1nn(C)cc1[C@@H](C)[NH2+][C@@H](C)C(F)F ZINC000389902635 410019511 /nfs/dbraw/zinc/01/95/11/410019511.db2.gz DHNRFIGCELQNQB-SVRRBLITSA-N 1 2 217.263 2.033 20 0 BEADLO Cc1cn2ccc(C(=O)NC(C)(C)C)cc2[nH+]1 ZINC000071540722 410417419 /nfs/dbraw/zinc/41/74/19/410417419.db2.gz MPXFQPKMXBWAAX-UHFFFAOYSA-N 1 2 231.299 2.171 20 0 BEADLO CC[C@@H]1CN(c2cc[nH+]c3ccncc32)CCO1 ZINC000085655300 410466542 /nfs/dbraw/zinc/46/65/42/410466542.db2.gz ZVTZWFIZCZZLNV-LLVKDONJSA-N 1 2 243.310 2.245 20 0 BEADLO c1csc(C[NH2+]Cc2cnc(C3CC3)o2)n1 ZINC000628206890 410439445 /nfs/dbraw/zinc/43/94/45/410439445.db2.gz XYLMIKKBBROYEI-UHFFFAOYSA-N 1 2 235.312 2.298 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC[C@H]2c2cc[nH]n2)nc1 ZINC000664198702 410515509 /nfs/dbraw/zinc/51/55/09/410515509.db2.gz AFQCFJIEYMMWQK-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc(C[N@H+]2CCC[C@H]2c2cc[nH]n2)nc1 ZINC000664198702 410515515 /nfs/dbraw/zinc/51/55/15/410515515.db2.gz AFQCFJIEYMMWQK-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO OC[C@@H](CNc1cc[nH+]c(C2CC2)n1)CC1CC1 ZINC000664462918 410586367 /nfs/dbraw/zinc/58/63/67/410586367.db2.gz RRAQYFGGIXHBCY-LLVKDONJSA-N 1 2 247.342 2.175 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CC[C@H]3C[C@H]3C2)[nH+]1 ZINC000664525209 410594889 /nfs/dbraw/zinc/59/48/89/410594889.db2.gz NJXLDKFPWADOBR-UWVGGRQHSA-N 1 2 228.299 2.113 20 0 BEADLO C[C@@H](CC(=O)N1CCC[C@@H](C)C1)n1cc[nH+]c1 ZINC000650985524 410673307 /nfs/dbraw/zinc/67/33/07/410673307.db2.gz SSCNGPSGRXQJKQ-NEPJUHHUSA-N 1 2 235.331 2.093 20 0 BEADLO Cc1ccc(C[NH2+][C@H]2CCn3ccnc32)o1 ZINC000393874799 410763808 /nfs/dbraw/zinc/76/38/08/410763808.db2.gz PSMLEGGROFIOLT-NSHDSACASA-N 1 2 217.272 2.019 20 0 BEADLO CC(C)CCC[N@@H+]1CC(F)(F)C[C@H]1CO ZINC000364844326 166802724 /nfs/dbraw/zinc/80/27/24/166802724.db2.gz NGRODYYQURWYKM-JTQLQIEISA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)CCC[N@H+]1CC(F)(F)C[C@H]1CO ZINC000364844326 166802727 /nfs/dbraw/zinc/80/27/27/166802727.db2.gz NGRODYYQURWYKM-JTQLQIEISA-N 1 2 221.291 2.125 20 0 BEADLO C[C@H](c1ccccc1)[C@@H](O)C[NH+]1CC(C)(F)C1 ZINC000651136250 410832822 /nfs/dbraw/zinc/83/28/22/410832822.db2.gz UAOXWQMHTICURL-YPMHNXCESA-N 1 2 237.318 2.195 20 0 BEADLO C[C@@H](CC(=O)N1CCC[C@H]1C1CC1)n1cc[nH+]c1 ZINC000651254347 410887068 /nfs/dbraw/zinc/88/70/68/410887068.db2.gz MUYIGLMTAICCHL-AAEUAGOBSA-N 1 2 247.342 2.235 20 0 BEADLO CN(Cc1ccsc1)c1cc(CO)cc[nH+]1 ZINC000040877890 410894378 /nfs/dbraw/zinc/89/43/78/410894378.db2.gz BJGQANWWMFXYFL-UHFFFAOYSA-N 1 2 234.324 2.272 20 0 BEADLO CC[C@H]1CCCN(c2cc(CO)cc[nH+]2)C1 ZINC000040878481 410894485 /nfs/dbraw/zinc/89/44/85/410894485.db2.gz HRZRRUOXHKNLHF-NSHDSACASA-N 1 2 220.316 2.200 20 0 BEADLO OCc1cc[nH+]c(N2CCc3ccccc3C2)c1 ZINC000040864486 410897227 /nfs/dbraw/zinc/89/72/27/410897227.db2.gz LVKKWEMBWWTIQV-UHFFFAOYSA-N 1 2 240.306 2.137 20 0 BEADLO CC(C)C[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000273821369 167012999 /nfs/dbraw/zinc/01/29/99/167012999.db2.gz XOCBGLMDCZJXIU-GFCCVEGCSA-N 1 2 230.315 2.140 20 0 BEADLO CC(C)CNc1nc(N(C)C)nc(C(C)C)[nH+]1 ZINC000301947420 167019207 /nfs/dbraw/zinc/01/92/07/167019207.db2.gz XYSDQFYJGXCFDP-UHFFFAOYSA-N 1 2 237.351 2.129 20 0 BEADLO CC(C)CNc1nc(C(C)C)[nH+]c(N(C)C)n1 ZINC000301947420 167019208 /nfs/dbraw/zinc/01/92/08/167019208.db2.gz XYSDQFYJGXCFDP-UHFFFAOYSA-N 1 2 237.351 2.129 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)[C@H]1C[C@H]1C1CCCC1 ZINC000651292534 410902707 /nfs/dbraw/zinc/90/27/07/410902707.db2.gz NVTNZKVYSJXCJI-RYUDHWBXSA-N 1 2 247.342 2.194 20 0 BEADLO CC(C)OC[C@@H](C)[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000337245512 167257448 /nfs/dbraw/zinc/25/74/48/167257448.db2.gz HGFQLYOCWOFFBG-MNOVXSKESA-N 1 2 245.363 2.120 20 0 BEADLO CC(C)OCc1nc([C@@H](C)[NH2+]CCCF)no1 ZINC000352621108 167271167 /nfs/dbraw/zinc/27/11/67/167271167.db2.gz LXBRCFWXHZVNGE-SECBINFHSA-N 1 2 245.298 2.005 20 0 BEADLO CC(C)[C@@H](C)C(=O)NCc1cn2ccccc2[nH+]1 ZINC000264820149 167353101 /nfs/dbraw/zinc/35/31/01/167353101.db2.gz DDAOOAQMDLCEJA-LLVKDONJSA-N 1 2 245.326 2.243 20 0 BEADLO CC(C)[C@@H](C)N(C(=O)CCc1[nH]cc[nH+]1)C1CC1 ZINC000279179430 167361514 /nfs/dbraw/zinc/36/15/14/167361514.db2.gz IBJAVYCZMTYDFP-LLVKDONJSA-N 1 2 249.358 2.378 20 0 BEADLO FC1(F)CCC[C@@H]1N[C@@H]1CCn2cc[nH+]c21 ZINC000398068927 410940320 /nfs/dbraw/zinc/94/03/20/410940320.db2.gz DCHXUSZJONNXSS-BDAKNGLRSA-N 1 2 227.258 2.105 20 0 BEADLO CC(C)O[C@H]1CCCN(c2cccc[nH+]2)C1 ZINC000651385680 410968499 /nfs/dbraw/zinc/96/84/99/410968499.db2.gz OHVNICAIFHKJOI-LBPRGKRZSA-N 1 2 220.316 2.475 20 0 BEADLO CC[C@@H]1COC(C)(C)CN1c1cc[nH+]c(C)n1 ZINC000651396967 410978877 /nfs/dbraw/zinc/97/88/77/410978877.db2.gz HYAQWTJCLHBKNY-LLVKDONJSA-N 1 2 235.331 2.179 20 0 BEADLO CC[C@@H]1CN(c2cc[nH+]c(C)n2)[C@H](CC)CO1 ZINC000651397598 410979888 /nfs/dbraw/zinc/97/98/88/410979888.db2.gz TVDTUIRPWXKZMK-VXGBXAGGSA-N 1 2 235.331 2.179 20 0 BEADLO COc1ccc[nH+]c1N[C@H](C)[C@@H]1CCCCO1 ZINC000393625025 410985015 /nfs/dbraw/zinc/98/50/15/410985015.db2.gz VRRCATJEFWKZKG-MNOVXSKESA-N 1 2 236.315 2.460 20 0 BEADLO CC[C@@H]1CN(c2cc[nH+]c(C3CC3)n2)[C@H](C)CO1 ZINC000651405343 410987137 /nfs/dbraw/zinc/98/71/37/410987137.db2.gz OFAPGABJAVICHN-ZYHUDNBSSA-N 1 2 247.342 2.358 20 0 BEADLO Cc1nc(N2CCC3(CC3(F)F)CC2)cc[nH+]1 ZINC000651424093 411011721 /nfs/dbraw/zinc/01/17/21/411011721.db2.gz CYJKESDFYSPNSE-UHFFFAOYSA-N 1 2 239.269 2.411 20 0 BEADLO C[C@@H]1COCC[N@@H+]1Cc1cc2cnccc2o1 ZINC000651786676 411143891 /nfs/dbraw/zinc/14/38/91/411143891.db2.gz HVDWMMNDGKWRBE-SNVBAGLBSA-N 1 2 232.283 2.049 20 0 BEADLO C[C@@H]1COCC[N@H+]1Cc1cc2cnccc2o1 ZINC000651786676 411143892 /nfs/dbraw/zinc/14/38/92/411143892.db2.gz HVDWMMNDGKWRBE-SNVBAGLBSA-N 1 2 232.283 2.049 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2nc(C)no2)c(C)o1 ZINC000038034227 411146813 /nfs/dbraw/zinc/14/68/13/411146813.db2.gz AVGJISTUHVKIQA-MRVPVSSYSA-N 1 2 235.287 2.439 20 0 BEADLO CC(C)O[C@@H]1CCC[N@H+](Cc2cocn2)C1 ZINC000651897945 411149663 /nfs/dbraw/zinc/14/96/63/411149663.db2.gz OTJKNMLXYZJVKW-GFCCVEGCSA-N 1 2 224.304 2.064 20 0 BEADLO CC(C)O[C@@H]1CCC[N@@H+](Cc2cocn2)C1 ZINC000651897945 411149664 /nfs/dbraw/zinc/14/96/64/411149664.db2.gz OTJKNMLXYZJVKW-GFCCVEGCSA-N 1 2 224.304 2.064 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@H](CC)OC[C@H]2C)cn1 ZINC000651932185 411150717 /nfs/dbraw/zinc/15/07/17/411150717.db2.gz NKBPJSUWYNRQLL-YPMHNXCESA-N 1 2 249.358 2.038 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@H](CC)OC[C@H]2C)cn1 ZINC000651932185 411150718 /nfs/dbraw/zinc/15/07/18/411150718.db2.gz NKBPJSUWYNRQLL-YPMHNXCESA-N 1 2 249.358 2.038 20 0 BEADLO CC(=O)c1cc(C[N@@H+]2CC(C)=C[C@H](C)C2)on1 ZINC000653656867 411160079 /nfs/dbraw/zinc/16/00/79/411160079.db2.gz WVPZEPLWGNSBDX-VIFPVBQESA-N 1 2 234.299 2.275 20 0 BEADLO CC(=O)c1cc(C[N@H+]2CC(C)=C[C@H](C)C2)on1 ZINC000653656867 411160083 /nfs/dbraw/zinc/16/00/83/411160083.db2.gz WVPZEPLWGNSBDX-VIFPVBQESA-N 1 2 234.299 2.275 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2CSC[C@H]2C)c1 ZINC000652068287 411104717 /nfs/dbraw/zinc/10/47/17/411104717.db2.gz XYBOBYDLDRDUIB-MWLCHTKSSA-N 1 2 238.356 2.391 20 0 BEADLO COCC[C@H](C)Nc1cc(COC)cc[nH+]1 ZINC000652067955 411105068 /nfs/dbraw/zinc/10/50/68/411105068.db2.gz MRGKWYRKHGVUPE-JTQLQIEISA-N 1 2 224.304 2.065 20 0 BEADLO COCc1cc[nH+]c(NCCCC(C)C)c1 ZINC000652068126 411105255 /nfs/dbraw/zinc/10/52/55/411105255.db2.gz SIJKHRZQDVVHSE-UHFFFAOYSA-N 1 2 222.332 2.498 20 0 BEADLO COc1c(C)[nH+]cnc1NC(C1CC1)C1CC1 ZINC000656107229 411179366 /nfs/dbraw/zinc/17/93/66/411179366.db2.gz YYYUDXYZTBUKBX-UHFFFAOYSA-N 1 2 233.315 2.394 20 0 BEADLO COc1c(C)[nH+]cnc1NCCc1ccc(C)o1 ZINC000656108575 411179797 /nfs/dbraw/zinc/17/97/97/411179797.db2.gz AWZVSKMFCTVBSP-UHFFFAOYSA-N 1 2 247.298 2.350 20 0 BEADLO COc1c(C)[nH+]cnc1NCc1ccc(C)nc1 ZINC000656109789 411180521 /nfs/dbraw/zinc/18/05/21/411180521.db2.gz GEWQKNVIXPUTGZ-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO COc1c(C)[nH+]cnc1N(C)CC1CCCC1 ZINC000656112896 411181344 /nfs/dbraw/zinc/18/13/44/411181344.db2.gz MXBWIPWRGSOKCC-UHFFFAOYSA-N 1 2 235.331 2.420 20 0 BEADLO COc1c(C)[nH+]cnc1NC[C@H]1CC1(C)C ZINC000656125211 411183442 /nfs/dbraw/zinc/18/34/42/411183442.db2.gz AQSZACNPUVQHAF-SECBINFHSA-N 1 2 221.304 2.252 20 0 BEADLO CCC[N@H+](Cc1nnn(C(C)(C)C)n1)C(C)C ZINC000653798983 411183670 /nfs/dbraw/zinc/18/36/70/411183670.db2.gz GATCIBZCKFONTE-UHFFFAOYSA-N 1 2 239.367 2.049 20 0 BEADLO CCC[N@@H+](Cc1nnn(C(C)(C)C)n1)C(C)C ZINC000653798983 411183671 /nfs/dbraw/zinc/18/36/71/411183671.db2.gz GATCIBZCKFONTE-UHFFFAOYSA-N 1 2 239.367 2.049 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@H](C)COCC1CC1 ZINC000652287524 411188840 /nfs/dbraw/zinc/18/88/40/411188840.db2.gz ZHZVPUNVFBLXOU-ZJUUUORDSA-N 1 2 237.347 2.184 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H](C)COCC1CC1 ZINC000652287522 411189363 /nfs/dbraw/zinc/18/93/63/411189363.db2.gz ZHZVPUNVFBLXOU-UWVGGRQHSA-N 1 2 237.347 2.184 20 0 BEADLO FC(F)C[N@@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000653812240 411190653 /nfs/dbraw/zinc/19/06/53/411190653.db2.gz GIKANKJVSZUSMF-SNVBAGLBSA-N 1 2 219.275 2.285 20 0 BEADLO FC(F)C[N@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000653812240 411190655 /nfs/dbraw/zinc/19/06/55/411190655.db2.gz GIKANKJVSZUSMF-SNVBAGLBSA-N 1 2 219.275 2.285 20 0 BEADLO c1cc(C[N@@H+]2CCC[C@@H](OC3CCC3)C2)no1 ZINC000653812185 411190825 /nfs/dbraw/zinc/19/08/25/411190825.db2.gz DNSWZNYFPJPFBE-CYBMUJFWSA-N 1 2 236.315 2.208 20 0 BEADLO c1cc(C[N@H+]2CCC[C@@H](OC3CCC3)C2)no1 ZINC000653812185 411190826 /nfs/dbraw/zinc/19/08/26/411190826.db2.gz DNSWZNYFPJPFBE-CYBMUJFWSA-N 1 2 236.315 2.208 20 0 BEADLO COc1c(C)[nH+]cnc1NCCC1(C)CC1 ZINC000656182386 411194560 /nfs/dbraw/zinc/19/45/60/411194560.db2.gz GLMQACWFZRWPGA-UHFFFAOYSA-N 1 2 221.304 2.396 20 0 BEADLO FC(F)C1([NH2+][C@H]2COC3(CCC3)C2)CC1 ZINC000658003026 411194886 /nfs/dbraw/zinc/19/48/86/411194886.db2.gz HKFFWZOYHJLUCC-MRVPVSSYSA-N 1 2 217.259 2.085 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1CC[C@H]1C ZINC000656188211 411197149 /nfs/dbraw/zinc/19/71/49/411197149.db2.gz ZRZUPVIJTNGIEP-VXNVDRBHSA-N 1 2 207.277 2.004 20 0 BEADLO COc1c(C)[nH+]cnc1NCc1occc1C ZINC000656190832 411197359 /nfs/dbraw/zinc/19/73/59/411197359.db2.gz SOIJBMBKOIOXJX-UHFFFAOYSA-N 1 2 233.271 2.307 20 0 BEADLO Cc1cc(CNc2nc(C)[nH+]cc2C)ccn1 ZINC000656193087 411198047 /nfs/dbraw/zinc/19/80/47/411198047.db2.gz MGVRRMCGHYUEEM-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO CC/C=C\CNc1nc[nH+]c(C)c1OC ZINC000656194530 411200011 /nfs/dbraw/zinc/20/00/11/411200011.db2.gz HLJCBYQDZHXSAF-WAYWQWQTSA-N 1 2 207.277 2.172 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1C[C@@H](C)n2ccnc21 ZINC000656196850 411202320 /nfs/dbraw/zinc/20/23/20/411202320.db2.gz OTXUFBQMIQIWQD-MWLCHTKSSA-N 1 2 243.314 2.408 20 0 BEADLO CC[C@@H]1C[C@@H](Nc2nc(C)[nH+]cc2C)CCO1 ZINC000656204959 411207564 /nfs/dbraw/zinc/20/75/64/411207564.db2.gz RTNGGYIIRMLQJX-NWDGAFQWSA-N 1 2 235.331 2.463 20 0 BEADLO Cc1nnc(NCCc2[nH+]cc(C)cc2C)o1 ZINC000656211184 411210730 /nfs/dbraw/zinc/21/07/30/411210730.db2.gz SJRNPYCZGZSJLV-UHFFFAOYSA-N 1 2 232.287 2.044 20 0 BEADLO Cc1c[nH+]c(CCNc2cccnn2)c(C)c1 ZINC000656210938 411210857 /nfs/dbraw/zinc/21/08/57/411210857.db2.gz LJBNUFHWELSMQB-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO Cc1cc(N[C@H](C)Cc2ccccn2)nc[nH+]1 ZINC000656221132 411212725 /nfs/dbraw/zinc/21/27/25/411212725.db2.gz FRAIEVMIJMIJEJ-LLVKDONJSA-N 1 2 228.299 2.223 20 0 BEADLO CC[C@H](C)C(=O)NCc1cn2ccc(C)cc2[nH+]1 ZINC000048750350 411213070 /nfs/dbraw/zinc/21/30/70/411213070.db2.gz CVEGULFXCYGTCC-NSHDSACASA-N 1 2 245.326 2.305 20 0 BEADLO Cc1cc(N(C[C@H](C)O)C2CC2)nc(C2CC2)[nH+]1 ZINC000656229940 411216635 /nfs/dbraw/zinc/21/66/35/411216635.db2.gz IDLPTBWIERUNAH-JTQLQIEISA-N 1 2 247.342 2.012 20 0 BEADLO CCCn1cc(C[NH+]2CC3(CC3(F)F)C2)cn1 ZINC000656265826 411221398 /nfs/dbraw/zinc/22/13/98/411221398.db2.gz KFANHEICLZFRPM-UHFFFAOYSA-N 1 2 241.285 2.134 20 0 BEADLO C[C@@H](C(=O)NC(C)(C)c1[nH]cc[nH+]1)c1ccco1 ZINC000652411343 411232589 /nfs/dbraw/zinc/23/25/89/411232589.db2.gz APNTVRADCSRALJ-SECBINFHSA-N 1 2 247.298 2.158 20 0 BEADLO Cn1cc[nH+]c1-c1ccc(N2CCCC2=O)cc1 ZINC000656371631 411236519 /nfs/dbraw/zinc/23/65/19/411236519.db2.gz LKCUNVIEQYESHL-UHFFFAOYSA-N 1 2 241.294 2.214 20 0 BEADLO Cn1cc[nH+]c1-c1ccc2c(c1)OCC2 ZINC000656371653 411238286 /nfs/dbraw/zinc/23/82/86/411238286.db2.gz MPQGWDMIIHHXPT-UHFFFAOYSA-N 1 2 200.241 2.022 20 0 BEADLO COCCOc1cccc(-c2[nH+]ccn2C)c1 ZINC000656371280 411239564 /nfs/dbraw/zinc/23/95/64/411239564.db2.gz BVFGSYPGSZMUMH-UHFFFAOYSA-N 1 2 232.283 2.112 20 0 BEADLO Cc1c[nH+]cc(NCCCc2cnn(C)c2)c1 ZINC000653464425 411282101 /nfs/dbraw/zinc/28/21/01/411282101.db2.gz YBMVSSKCAZKAHJ-UHFFFAOYSA-N 1 2 230.315 2.168 20 0 BEADLO COc1cc(F)cc(C[NH2+]Cc2ccon2)c1 ZINC000312275308 411282765 /nfs/dbraw/zinc/28/27/65/411282765.db2.gz KJPUZNXGROIROH-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO C[C@@H]1CC[N@H+](CCn2cc(Cl)cn2)C[C@H]1F ZINC000656494606 411284100 /nfs/dbraw/zinc/28/41/00/411284100.db2.gz VYBHCSBFRGIAIH-MWLCHTKSSA-N 1 2 245.729 2.216 20 0 BEADLO C[C@@H]1CC[N@@H+](CCn2cc(Cl)cn2)C[C@H]1F ZINC000656494606 411284101 /nfs/dbraw/zinc/28/41/01/411284101.db2.gz VYBHCSBFRGIAIH-MWLCHTKSSA-N 1 2 245.729 2.216 20 0 BEADLO Cc1c[nH]nc1C[NH+]1CC(CC(F)(F)F)C1 ZINC000656688848 411328871 /nfs/dbraw/zinc/32/88/71/411328871.db2.gz XFWWSNJDXOQVFS-UHFFFAOYSA-N 1 2 233.237 2.102 20 0 BEADLO FC(F)C1C[NH+](Cc2cccc3c2OCO3)C1 ZINC000656688368 411329247 /nfs/dbraw/zinc/32/92/47/411329247.db2.gz LNAMMWXPOOXETD-UHFFFAOYSA-N 1 2 241.237 2.112 20 0 BEADLO C[C@H]1C[N@H+](Cc2cc(C3CC3)no2)[C@@H](C)CO1 ZINC000659822555 411305279 /nfs/dbraw/zinc/30/52/79/411305279.db2.gz OGUDZIGCQOKBGI-UWVGGRQHSA-N 1 2 236.315 2.161 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cc(C3CC3)no2)[C@@H](C)CO1 ZINC000659822555 411305281 /nfs/dbraw/zinc/30/52/81/411305281.db2.gz OGUDZIGCQOKBGI-UWVGGRQHSA-N 1 2 236.315 2.161 20 0 BEADLO COc1cc(C[N@H+](C)Cc2ccc(C)o2)on1 ZINC000659826351 411308593 /nfs/dbraw/zinc/30/85/93/411308593.db2.gz GNOOYFNEPHJCIG-UHFFFAOYSA-N 1 2 236.271 2.217 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2ccc(C)o2)on1 ZINC000659826351 411308597 /nfs/dbraw/zinc/30/85/97/411308597.db2.gz GNOOYFNEPHJCIG-UHFFFAOYSA-N 1 2 236.271 2.217 20 0 BEADLO CC1(C)CCC[C@H](NC(=O)CCc2[nH]cc[nH+]2)C1 ZINC000289121045 167911571 /nfs/dbraw/zinc/91/15/71/167911571.db2.gz QJCFSIWVKMNQJD-NSHDSACASA-N 1 2 249.358 2.427 20 0 BEADLO Cc1ccn(-c2ccc([NH2+]CC[C@@H](C)O)cc2)n1 ZINC000656654371 411317645 /nfs/dbraw/zinc/31/76/45/411317645.db2.gz YNKMDPRDGRNABP-GFCCVEGCSA-N 1 2 245.326 2.364 20 0 BEADLO C[C@H]([NH2+][C@@H]1C[C@H](C)n2ncnc21)c1ccncc1 ZINC000656678559 411322439 /nfs/dbraw/zinc/32/24/39/411322439.db2.gz ADYAQZGPUIPXBY-JBLDHEPKSA-N 1 2 243.314 2.030 20 0 BEADLO CN(C(=O)Cc1cn2c([nH+]1)CCCC2)C(C)(C)C ZINC000652493484 411258295 /nfs/dbraw/zinc/25/82/95/411258295.db2.gz BWEQKVOJGJLMLZ-UHFFFAOYSA-N 1 2 249.358 2.019 20 0 BEADLO Cc1cc[nH+]cc1Cc1nc(C(C)C)no1 ZINC000656753794 411349409 /nfs/dbraw/zinc/34/94/09/411349409.db2.gz SNWBYCFQBNVLMG-UHFFFAOYSA-N 1 2 217.272 2.487 20 0 BEADLO CCc1cc[nH+]cc1NCc1cc2n(n1)CCC2 ZINC000656776213 411357128 /nfs/dbraw/zinc/35/71/28/411357128.db2.gz JEUJOBPEZNMYAF-UHFFFAOYSA-N 1 2 242.326 2.399 20 0 BEADLO Cn1c[nH+]cc1CNc1ccc(C(F)F)nc1 ZINC000656779277 411359033 /nfs/dbraw/zinc/35/90/33/411359033.db2.gz KIIZMNRQYUJUJJ-UHFFFAOYSA-N 1 2 238.241 2.365 20 0 BEADLO C[C@@H](NC(=O)C1(C)CCCC1)c1[nH]cc[nH+]1 ZINC000125388157 411368973 /nfs/dbraw/zinc/36/89/73/411368973.db2.gz FEHZHHAOEMPWEY-SECBINFHSA-N 1 2 221.304 2.167 20 0 BEADLO C(c1nnc(C2CC2)s1)[N@@H+]1CC[C@H]2C[C@H]2C1 ZINC000661968298 411336899 /nfs/dbraw/zinc/33/68/99/411336899.db2.gz XDMBBUQYHLVDMF-UWVGGRQHSA-N 1 2 235.356 2.257 20 0 BEADLO C(c1nnc(C2CC2)s1)[N@H+]1CC[C@H]2C[C@H]2C1 ZINC000661968298 411336904 /nfs/dbraw/zinc/33/69/04/411336904.db2.gz XDMBBUQYHLVDMF-UWVGGRQHSA-N 1 2 235.356 2.257 20 0 BEADLO CC1(CNc2c[nH+]c3c(c2)CCCC3)COC1 ZINC000336345410 168047734 /nfs/dbraw/zinc/04/77/34/168047734.db2.gz NUEDYHHDOZFXSP-UHFFFAOYSA-N 1 2 232.327 2.409 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cn1)c1nccn1C ZINC000658338432 411345866 /nfs/dbraw/zinc/34/58/66/411345866.db2.gz XWKZAPOWOCJSDQ-VHSXEESVSA-N 1 2 248.305 2.366 20 0 BEADLO CC(C)(C(=O)NCC1(C)CCCC1)c1c[nH]c[nH+]1 ZINC000330947507 168028806 /nfs/dbraw/zinc/02/88/06/168028806.db2.gz IGPLSJLJQKEKLP-UHFFFAOYSA-N 1 2 249.358 2.384 20 0 BEADLO CC1(NC(=O)c2ccc3[nH+]ccn3c2)CCC1 ZINC000179275951 168060686 /nfs/dbraw/zinc/06/06/86/168060686.db2.gz YQLCQGGRVBOJTA-UHFFFAOYSA-N 1 2 229.283 2.007 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC(C)=C(C)C1 ZINC000280762964 168085655 /nfs/dbraw/zinc/08/56/55/168085655.db2.gz FNTFYUANDHEYEL-UHFFFAOYSA-N 1 2 205.305 2.260 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC(C)=C(C)C1 ZINC000280762964 168085658 /nfs/dbraw/zinc/08/56/58/168085658.db2.gz FNTFYUANDHEYEL-UHFFFAOYSA-N 1 2 205.305 2.260 20 0 BEADLO CC1=CCC[N@@H+]([C@H](C(N)=O)c2ccc(F)cc2)C1 ZINC000280809106 168099929 /nfs/dbraw/zinc/09/99/29/168099929.db2.gz LSUGLTQEGLXYFD-ZDUSSCGKSA-N 1 2 248.301 2.004 20 0 BEADLO CC1=CCC[N@H+]([C@H](C(N)=O)c2ccc(F)cc2)C1 ZINC000280809106 168099930 /nfs/dbraw/zinc/09/99/30/168099930.db2.gz LSUGLTQEGLXYFD-ZDUSSCGKSA-N 1 2 248.301 2.004 20 0 BEADLO CC1=CCC[C@H](C)[C@@H]1C[N@H+](C)Cc1nnc[nH]1 ZINC000191074522 168101935 /nfs/dbraw/zinc/10/19/35/168101935.db2.gz VXBFXEZHMLBRDA-NWDGAFQWSA-N 1 2 234.347 2.229 20 0 BEADLO CC1=CCC[C@H](C)[C@@H]1C[N@@H+](C)Cc1nnc[nH]1 ZINC000191074522 168101939 /nfs/dbraw/zinc/10/19/39/168101939.db2.gz VXBFXEZHMLBRDA-NWDGAFQWSA-N 1 2 234.347 2.229 20 0 BEADLO CC1=CC[N@H+](CC(=O)Nc2cccc(F)c2)CC1 ZINC000270086763 168110777 /nfs/dbraw/zinc/11/07/77/168110777.db2.gz ACRUDIQCQUEZOK-UHFFFAOYSA-N 1 2 248.301 2.416 20 0 BEADLO CC1=CC[N@@H+](CC(=O)Nc2cccc(F)c2)CC1 ZINC000270086763 168110779 /nfs/dbraw/zinc/11/07/79/168110779.db2.gz ACRUDIQCQUEZOK-UHFFFAOYSA-N 1 2 248.301 2.416 20 0 BEADLO CC1=CC[N@@H+](Cc2ncc(Cl)n2C)CC1 ZINC000270093944 168114562 /nfs/dbraw/zinc/11/45/62/168114562.db2.gz AYDVFRIJZDZDID-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO CC1=CC[N@H+](Cc2ncc(Cl)n2C)CC1 ZINC000270093944 168114560 /nfs/dbraw/zinc/11/45/60/168114560.db2.gz AYDVFRIJZDZDID-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO CC1=CC[N@H+](Cc2nccn2C(F)F)CC1 ZINC000270130715 168116441 /nfs/dbraw/zinc/11/64/41/168116441.db2.gz GYULDOPCCSDHHN-UHFFFAOYSA-N 1 2 227.258 2.430 20 0 BEADLO CC1=CC[N@@H+](Cc2nccn2C(F)F)CC1 ZINC000270130715 168116443 /nfs/dbraw/zinc/11/64/43/168116443.db2.gz GYULDOPCCSDHHN-UHFFFAOYSA-N 1 2 227.258 2.430 20 0 BEADLO CC1=C[C@@H](C)C[N@H+](Cc2nc(C3CC3)no2)C1 ZINC000334148677 168123074 /nfs/dbraw/zinc/12/30/74/168123074.db2.gz BYYMQVGSHRISQC-SECBINFHSA-N 1 2 233.315 2.345 20 0 BEADLO CC1=C[C@@H](C)C[N@@H+](Cc2nc(C3CC3)no2)C1 ZINC000334148677 168123077 /nfs/dbraw/zinc/12/30/77/168123077.db2.gz BYYMQVGSHRISQC-SECBINFHSA-N 1 2 233.315 2.345 20 0 BEADLO CC1CC(NC(=O)Nc2ccn3cc[nH+]c3c2)C1 ZINC000290056778 168144333 /nfs/dbraw/zinc/14/43/33/168144333.db2.gz CFYSASFRXAKKGJ-UHFFFAOYSA-N 1 2 244.298 2.254 20 0 BEADLO C[C@H]([NH2+]C1CC(C)C1)C(=O)OC(C)(C)C ZINC000123438982 168146496 /nfs/dbraw/zinc/14/64/96/168146496.db2.gz HJVGRYPNCFKAEK-KYHHOPLUSA-N 1 2 213.321 2.105 20 0 BEADLO CC(C)c1nnc(C[NH+]2CCC(C)CC2)[nH]1 ZINC000336118778 168184783 /nfs/dbraw/zinc/18/47/83/168184783.db2.gz KZJGLPVMZZYZKK-UHFFFAOYSA-N 1 2 222.336 2.160 20 0 BEADLO CCC(=O)CC[N@@H+]1CCOC[C@@H]1c1ccco1 ZINC000364606925 168201880 /nfs/dbraw/zinc/20/18/80/168201880.db2.gz MTQFGQKBBSNKDA-GFCCVEGCSA-N 1 2 237.299 2.022 20 0 BEADLO CCC(=O)CC[N@H+]1CCOC[C@@H]1c1ccco1 ZINC000364606925 168201881 /nfs/dbraw/zinc/20/18/81/168201881.db2.gz MTQFGQKBBSNKDA-GFCCVEGCSA-N 1 2 237.299 2.022 20 0 BEADLO CCC(C)(C)CC(=O)N(C)Cc1[nH+]ccn1C ZINC000339432295 168271338 /nfs/dbraw/zinc/27/13/38/168271338.db2.gz FKVKEXGLVAVNET-UHFFFAOYSA-N 1 2 237.347 2.205 20 0 BEADLO CCC[NH+](CCC)Cc1nnn(C(C)(C)C)n1 ZINC000653493886 411387825 /nfs/dbraw/zinc/38/78/25/411387825.db2.gz IYFWZCTWUWFHDO-UHFFFAOYSA-N 1 2 239.367 2.050 20 0 BEADLO Cc1nc(N[C@H]2CCS[C@H]2C)cc[nH+]1 ZINC000306676181 411456312 /nfs/dbraw/zinc/45/63/12/411456312.db2.gz VIUBBWXFVMYCQD-CBAPKCEASA-N 1 2 209.318 2.091 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@H]2CCCc3occc32)n1 ZINC000657308223 411458375 /nfs/dbraw/zinc/45/83/75/411458375.db2.gz YCCARMCSBRZEHK-NSHDSACASA-N 1 2 231.299 2.478 20 0 BEADLO CCCC(C)(C)C(=O)NCCNc1cccc[nH+]1 ZINC000653015935 411395797 /nfs/dbraw/zinc/39/57/97/411395797.db2.gz KHKUMWGAEQSICZ-UHFFFAOYSA-N 1 2 249.358 2.436 20 0 BEADLO CC(C)(C)[C@@H](O)C[N@@H+]1CCCC(F)(F)C1 ZINC000405074227 411415305 /nfs/dbraw/zinc/41/53/05/411415305.db2.gz KSBSLWUANOVUDF-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)(C)[C@@H](O)C[N@H+]1CCCC(F)(F)C1 ZINC000405074227 411415309 /nfs/dbraw/zinc/41/53/09/411415309.db2.gz KSBSLWUANOVUDF-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO c1csc(C[NH2+]Cc2ccnn2CC2CC2)n1 ZINC000657317751 411462308 /nfs/dbraw/zinc/46/23/08/411462308.db2.gz DZKYNVSMXRWCNA-UHFFFAOYSA-N 1 2 248.355 2.039 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1nc(C)oc1C ZINC000659841329 411472854 /nfs/dbraw/zinc/47/28/54/411472854.db2.gz QIDTYIJOUHQPDR-SKDRFNHKSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1nc(C)oc1C ZINC000659841329 411472856 /nfs/dbraw/zinc/47/28/56/411472856.db2.gz QIDTYIJOUHQPDR-SKDRFNHKSA-N 1 2 238.331 2.291 20 0 BEADLO COc1nccnc1C[N@H+](C)Cc1cccs1 ZINC000294624102 411474151 /nfs/dbraw/zinc/47/41/51/411474151.db2.gz YWMNLUSLTRBVOT-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1nccnc1C[N@@H+](C)Cc1cccs1 ZINC000294624102 411474154 /nfs/dbraw/zinc/47/41/54/411474154.db2.gz YWMNLUSLTRBVOT-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@H](C)CCC1CC1 ZINC000655003739 411475058 /nfs/dbraw/zinc/47/50/58/411475058.db2.gz UHYPGICMXAQHMB-MNOVXSKESA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@H](C)CCC1CC1 ZINC000655003739 411475063 /nfs/dbraw/zinc/47/50/63/411475063.db2.gz UHYPGICMXAQHMB-MNOVXSKESA-N 1 2 249.358 2.283 20 0 BEADLO Cc1nc(C[N@H+]2C[C@@H](C)OC(C)(C)C2)c(C)o1 ZINC000659855884 411478239 /nfs/dbraw/zinc/47/82/39/411478239.db2.gz ODFZPXIDAJJDLE-SECBINFHSA-N 1 2 238.331 2.291 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@@H](C)OC(C)(C)C2)c(C)o1 ZINC000659855884 411478242 /nfs/dbraw/zinc/47/82/42/411478242.db2.gz ODFZPXIDAJJDLE-SECBINFHSA-N 1 2 238.331 2.291 20 0 BEADLO Cc1noc(C)c1[C@H](C)NCc1[nH]c(C)c(C)[nH+]1 ZINC000657369119 411480164 /nfs/dbraw/zinc/48/01/64/411480164.db2.gz YTEQFXIMCGELJM-VIFPVBQESA-N 1 2 248.330 2.482 20 0 BEADLO Cc1noc(C)c1[C@H](C)[NH2+]Cc1nc(C)c(C)[nH]1 ZINC000657369119 411480167 /nfs/dbraw/zinc/48/01/67/411480167.db2.gz YTEQFXIMCGELJM-VIFPVBQESA-N 1 2 248.330 2.482 20 0 BEADLO CCC[N@H+](C)Cc1nnc(C(F)(F)F)s1 ZINC000659860400 411480971 /nfs/dbraw/zinc/48/09/71/411480971.db2.gz ZQJYYYGUSLNRRK-UHFFFAOYSA-N 1 2 239.266 2.399 20 0 BEADLO CCC[N@@H+](C)Cc1nnc(C(F)(F)F)s1 ZINC000659860400 411480974 /nfs/dbraw/zinc/48/09/74/411480974.db2.gz ZQJYYYGUSLNRRK-UHFFFAOYSA-N 1 2 239.266 2.399 20 0 BEADLO COc1ccc(C[NH2+]Cc2nc(C)c[nH]2)c(F)c1 ZINC000657393322 411489871 /nfs/dbraw/zinc/48/98/71/411489871.db2.gz AJVPAXJMLRACIF-UHFFFAOYSA-N 1 2 249.289 2.156 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@H](n3ccnc3)C2)co1 ZINC000659882543 411490122 /nfs/dbraw/zinc/49/01/22/411490122.db2.gz ISKSNBIVNWFLGN-ZDUSSCGKSA-N 1 2 246.314 2.017 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@H](n3ccnc3)C2)co1 ZINC000659882543 411490125 /nfs/dbraw/zinc/49/01/25/411490125.db2.gz ISKSNBIVNWFLGN-ZDUSSCGKSA-N 1 2 246.314 2.017 20 0 BEADLO O[C@@H]1CC[N@H+](CC(F)F)C[C@H]1C1CCCC1 ZINC000657388844 411491168 /nfs/dbraw/zinc/49/11/68/411491168.db2.gz JXYKRTDVOZCUHS-WDEREUQCSA-N 1 2 233.302 2.125 20 0 BEADLO O[C@@H]1CC[N@@H+](CC(F)F)C[C@H]1C1CCCC1 ZINC000657388844 411491172 /nfs/dbraw/zinc/49/11/72/411491172.db2.gz JXYKRTDVOZCUHS-WDEREUQCSA-N 1 2 233.302 2.125 20 0 BEADLO Cc1c[nH]c(CNc2cncc(C)c2)[nH+]1 ZINC000657412630 411498681 /nfs/dbraw/zinc/49/86/81/411498681.db2.gz HXENMOKYXQKESW-UHFFFAOYSA-N 1 2 202.261 2.034 20 0 BEADLO CC[C@H]1C[C@@H](Nc2c[nH+]cc(C)c2)CO1 ZINC000657412549 411498839 /nfs/dbraw/zinc/49/88/39/411498839.db2.gz GRYMUYWYYUFAGZ-NEPJUHHUSA-N 1 2 206.289 2.369 20 0 BEADLO CCCn1nccc1CNc1c[nH+]ccc1OC ZINC000657413803 411499683 /nfs/dbraw/zinc/49/96/83/411499683.db2.gz SSOKJHYZIDNTMR-UHFFFAOYSA-N 1 2 246.314 2.309 20 0 BEADLO CC(C)[C@@H]1CCC[N@H+](CCc2cnn[nH]2)CC1 ZINC000659931004 411501602 /nfs/dbraw/zinc/50/16/02/411501602.db2.gz JACNREPJSCMCOU-GFCCVEGCSA-N 1 2 236.363 2.105 20 0 BEADLO CC(C)[C@@H]1CCC[N@@H+](CCc2cnn[nH]2)CC1 ZINC000659931004 411501605 /nfs/dbraw/zinc/50/16/05/411501605.db2.gz JACNREPJSCMCOU-GFCCVEGCSA-N 1 2 236.363 2.105 20 0 BEADLO CCCn1nccc1CNc1[nH+]cccc1OC ZINC000657420628 411501993 /nfs/dbraw/zinc/50/19/93/411501993.db2.gz FIJWGQFJVBPSGS-UHFFFAOYSA-N 1 2 246.314 2.309 20 0 BEADLO Cc1c[nH]c(CNc2cnn(CC(C)C)c2C)[nH+]1 ZINC000657427975 411503795 /nfs/dbraw/zinc/50/37/95/411503795.db2.gz WXVNTHZTHFHXFE-UHFFFAOYSA-N 1 2 247.346 2.491 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CCC12CCCC2 ZINC000655162111 411508884 /nfs/dbraw/zinc/50/88/84/411508884.db2.gz IXLVZKGOPWZHMS-LLVKDONJSA-N 1 2 247.342 2.133 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CCC12CCCC2 ZINC000655162111 411508887 /nfs/dbraw/zinc/50/88/87/411508887.db2.gz IXLVZKGOPWZHMS-LLVKDONJSA-N 1 2 247.342 2.133 20 0 BEADLO CC[C@H](NCc1[nH]cc(C)[nH+]1)C(F)(F)F ZINC000657445091 411512530 /nfs/dbraw/zinc/51/25/30/411512530.db2.gz YHSORYGAXGKSRX-ZETCQYMHSA-N 1 2 221.226 2.149 20 0 BEADLO C[N@H+](Cc1nccs1)[C@@H]1COC(C)(C)C1 ZINC000659976542 411516682 /nfs/dbraw/zinc/51/66/82/411516682.db2.gz CCKGQDNBZBAPLS-VIFPVBQESA-N 1 2 226.345 2.142 20 0 BEADLO C[N@@H+](Cc1nccs1)[C@@H]1COC(C)(C)C1 ZINC000659976542 411516684 /nfs/dbraw/zinc/51/66/84/411516684.db2.gz CCKGQDNBZBAPLS-VIFPVBQESA-N 1 2 226.345 2.142 20 0 BEADLO CC(C)(C)n1nnc(C[NH2+]CC2=CCCCC2)n1 ZINC000657477728 411526154 /nfs/dbraw/zinc/52/61/54/411526154.db2.gz SEZYDZSAGQRUOJ-UHFFFAOYSA-N 1 2 249.362 2.018 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2cc(C3CC3)no2)[C@@H]1C ZINC000660009928 411527142 /nfs/dbraw/zinc/52/71/42/411527142.db2.gz DBZCYOVXEYHFGX-NXEZZACHSA-N 1 2 236.315 2.161 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2cc(C3CC3)no2)[C@@H]1C ZINC000660009928 411527144 /nfs/dbraw/zinc/52/71/44/411527144.db2.gz DBZCYOVXEYHFGX-NXEZZACHSA-N 1 2 236.315 2.161 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2cc(C3CC3)no2)[C@H]1C ZINC000660009930 411527590 /nfs/dbraw/zinc/52/75/90/411527590.db2.gz DBZCYOVXEYHFGX-VHSXEESVSA-N 1 2 236.315 2.161 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2cc(C3CC3)no2)[C@H]1C ZINC000660009930 411527593 /nfs/dbraw/zinc/52/75/93/411527593.db2.gz DBZCYOVXEYHFGX-VHSXEESVSA-N 1 2 236.315 2.161 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC(C)(C)[C@@H]2C)nc(C)n1 ZINC000660006594 411527910 /nfs/dbraw/zinc/52/79/10/411527910.db2.gz PVPDZMXADDPAKO-NSHDSACASA-N 1 2 249.358 2.093 20 0 BEADLO Cc1cc(C[N@H+]2CCOC(C)(C)[C@@H]2C)nc(C)n1 ZINC000660006594 411527911 /nfs/dbraw/zinc/52/79/11/411527911.db2.gz PVPDZMXADDPAKO-NSHDSACASA-N 1 2 249.358 2.093 20 0 BEADLO CCCCC[C@@H]1CCC[N@@H+]1CCc1cnn[nH]1 ZINC000660013000 411528539 /nfs/dbraw/zinc/52/85/39/411528539.db2.gz OSNUYOSCRQUMIX-CYBMUJFWSA-N 1 2 236.363 2.392 20 0 BEADLO CCCCC[C@@H]1CCC[N@H+]1CCc1cnn[nH]1 ZINC000660013000 411528540 /nfs/dbraw/zinc/52/85/40/411528540.db2.gz OSNUYOSCRQUMIX-CYBMUJFWSA-N 1 2 236.363 2.392 20 0 BEADLO CC(C)[N@H+](CCO[C@@H]1CC1(F)F)CC(F)F ZINC000660017965 411528576 /nfs/dbraw/zinc/52/85/76/411528576.db2.gz POIOPEZIVWWCAF-MRVPVSSYSA-N 1 2 243.244 2.386 20 0 BEADLO CC(C)[N@@H+](CCO[C@@H]1CC1(F)F)CC(F)F ZINC000660017965 411528578 /nfs/dbraw/zinc/52/85/78/411528578.db2.gz POIOPEZIVWWCAF-MRVPVSSYSA-N 1 2 243.244 2.386 20 0 BEADLO CC[N@@H+]1C[C@H]([NH2+]CCC2CCCC2)[C@@H](C)C1 ZINC000309678125 170035591 /nfs/dbraw/zinc/03/55/91/170035591.db2.gz YMBATAXDOBFODO-JSGCOSHPSA-N 1 2 224.392 2.497 20 0 BEADLO CC[N@@H+]1C[C@H]([NH2+]C[C@@H]2CCCSC2)[C@@H](C)C1 ZINC000309922710 170036056 /nfs/dbraw/zinc/03/60/56/170036056.db2.gz TTWFTDQYIWIJPJ-AVGNSLFASA-N 1 2 242.432 2.059 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2cc(C)nc(C)n2)CCO1 ZINC000660131760 411543162 /nfs/dbraw/zinc/54/31/62/411543162.db2.gz BQPFHWSMPQCHGS-AWEZNQCLSA-N 1 2 249.358 2.094 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2cc(C)nc(C)n2)CCO1 ZINC000660131760 411543164 /nfs/dbraw/zinc/54/31/64/411543164.db2.gz BQPFHWSMPQCHGS-AWEZNQCLSA-N 1 2 249.358 2.094 20 0 BEADLO Cc1c[nH]c(CNc2cc(C)n(C(C)C)n2)[nH+]1 ZINC000657496451 411535657 /nfs/dbraw/zinc/53/56/57/411535657.db2.gz SZGQJLALSZXHOL-UHFFFAOYSA-N 1 2 233.319 2.416 20 0 BEADLO Cn1c[nH+]c(CN[C@H](C(C)(C)C)C(F)(F)F)c1 ZINC000660212519 411554271 /nfs/dbraw/zinc/55/42/71/411554271.db2.gz KZNBOADBRMXOJW-SECBINFHSA-N 1 2 249.280 2.487 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@H](C)[C@H](F)C2)c(C)o1 ZINC000660222080 411556180 /nfs/dbraw/zinc/55/61/80/411556180.db2.gz TUBBPFQVAZMETJ-GZMMTYOYSA-N 1 2 226.295 2.471 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)c(C)o1 ZINC000660222080 411556182 /nfs/dbraw/zinc/55/61/82/411556182.db2.gz TUBBPFQVAZMETJ-GZMMTYOYSA-N 1 2 226.295 2.471 20 0 BEADLO Cn1c[nH+]c(CN2CCc3cccc(F)c3C2)c1 ZINC000660160026 411549166 /nfs/dbraw/zinc/54/91/66/411549166.db2.gz KAELMBUGPZQTSV-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO CCOC(=O)C[N@@H+]1CCC(C)=C(c2ccco2)C1 ZINC000374512837 170219118 /nfs/dbraw/zinc/21/91/18/170219118.db2.gz HXAPHUYXNFQCLD-UHFFFAOYSA-N 1 2 249.310 2.322 20 0 BEADLO CCOC(=O)C[N@H+]1CCC(C)=C(c2ccco2)C1 ZINC000374512837 170219119 /nfs/dbraw/zinc/21/91/19/170219119.db2.gz HXAPHUYXNFQCLD-UHFFFAOYSA-N 1 2 249.310 2.322 20 0 BEADLO Fc1cccc(C(F)(F)C[NH2+][C@H]2CCOC2)c1 ZINC000657584898 411557413 /nfs/dbraw/zinc/55/74/13/411557413.db2.gz ZOSQTZKLQIFTSG-NSHDSACASA-N 1 2 245.244 2.296 20 0 BEADLO CCOC(=O)[C@@H](CC)[N@H+](C)Cc1ccoc1 ZINC000082761051 170249483 /nfs/dbraw/zinc/24/94/83/170249483.db2.gz WOKTYZOSZLPWPF-LLVKDONJSA-N 1 2 225.288 2.053 20 0 BEADLO CCOC(=O)[C@@H](CC)[N@@H+](C)Cc1ccoc1 ZINC000082761051 170249484 /nfs/dbraw/zinc/24/94/84/170249484.db2.gz WOKTYZOSZLPWPF-LLVKDONJSA-N 1 2 225.288 2.053 20 0 BEADLO C[C@@H]([NH2+]Cc1cnn2c1CCC2)c1cscn1 ZINC000657600825 411558561 /nfs/dbraw/zinc/55/85/61/411558561.db2.gz VIJXELFHLYXTPF-SECBINFHSA-N 1 2 248.355 2.137 20 0 BEADLO CCn1cncc1C[NH2+][C@H](C)c1cscn1 ZINC000657601064 411558633 /nfs/dbraw/zinc/55/86/33/411558633.db2.gz XQECCUMKEAHTHM-SECBINFHSA-N 1 2 236.344 2.210 20 0 BEADLO C[C@@H](NCc1c[nH+]c2n1CCC2)c1cscn1 ZINC000657600000 411558753 /nfs/dbraw/zinc/55/87/53/411558753.db2.gz HQWBWCBRPOKCIU-SECBINFHSA-N 1 2 248.355 2.137 20 0 BEADLO CCOC(=O)[C@@](C)([NH2+]CC1CC1)c1ccccc1 ZINC000037968103 170261661 /nfs/dbraw/zinc/26/16/61/170261661.db2.gz YFLLLSDLDYUFBE-HNNXBMFYSA-N 1 2 247.338 2.465 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+](C)Cc1ccccc1C ZINC000043638669 170265291 /nfs/dbraw/zinc/26/52/91/170265291.db2.gz APNOHLQZGAUOSZ-LBPRGKRZSA-N 1 2 235.327 2.378 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+](C)Cc1ccccc1C ZINC000043638669 170265292 /nfs/dbraw/zinc/26/52/92/170265292.db2.gz APNOHLQZGAUOSZ-LBPRGKRZSA-N 1 2 235.327 2.378 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+](C)Cc1ccc(C)s1 ZINC000102772946 170265503 /nfs/dbraw/zinc/26/55/03/170265503.db2.gz IWCPQWQPRCTJFE-JTQLQIEISA-N 1 2 241.356 2.440 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+](C)Cc1ccc(C)s1 ZINC000102772946 170265505 /nfs/dbraw/zinc/26/55/05/170265505.db2.gz IWCPQWQPRCTJFE-JTQLQIEISA-N 1 2 241.356 2.440 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+](C)Cc1cccs1 ZINC000041392525 170265576 /nfs/dbraw/zinc/26/55/76/170265576.db2.gz VKCPAIGQOQDPBX-VIFPVBQESA-N 1 2 227.329 2.132 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+](C)Cc1cccs1 ZINC000041392525 170265577 /nfs/dbraw/zinc/26/55/77/170265577.db2.gz VKCPAIGQOQDPBX-VIFPVBQESA-N 1 2 227.329 2.132 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+]Cc1cc(C)ccc1C ZINC000049372370 170268825 /nfs/dbraw/zinc/26/88/25/170268825.db2.gz SEGNBHAKAAOTSW-LBPRGKRZSA-N 1 2 235.327 2.345 20 0 BEADLO Cc1nc(C[NH2+]C(C)(C)c2cnn(C)c2)c(C)o1 ZINC000660270164 411562213 /nfs/dbraw/zinc/56/22/13/411562213.db2.gz RQQDYQBWIDRRFX-UHFFFAOYSA-N 1 2 248.330 2.050 20 0 BEADLO CCOC1CC(N(C)c2cccc[nH+]2)C1 ZINC000340875166 170328353 /nfs/dbraw/zinc/32/83/53/170328353.db2.gz LQJJRXUKNHAFJN-UHFFFAOYSA-N 1 2 206.289 2.085 20 0 BEADLO Cn1ncc2c1nc[nH+]c2NCCC(C)(C)C ZINC000131613845 411574823 /nfs/dbraw/zinc/57/48/23/411574823.db2.gz IIELPIDENRUMOD-UHFFFAOYSA-N 1 2 233.319 2.211 20 0 BEADLO CCOCCCC(=O)Nc1cc[nH+]cc1CC ZINC000264978085 170366597 /nfs/dbraw/zinc/36/65/97/170366597.db2.gz GLOWPPKBFVPWOX-UHFFFAOYSA-N 1 2 236.315 2.399 20 0 BEADLO CC(C)C1(C)CC[NH+](CCc2cnn[nH]2)CC1 ZINC000660328067 411569564 /nfs/dbraw/zinc/56/95/64/411569564.db2.gz XCMPAADUGSLDAR-UHFFFAOYSA-N 1 2 236.363 2.105 20 0 BEADLO CCOCC[N@H+](C)Cc1c(F)ccc(O)c1F ZINC000281152142 170389526 /nfs/dbraw/zinc/38/95/26/170389526.db2.gz ZWYOOSDVIDPGOE-UHFFFAOYSA-N 1 2 245.269 2.139 20 0 BEADLO CCOCC[N@@H+](C)Cc1c(F)ccc(O)c1F ZINC000281152142 170389528 /nfs/dbraw/zinc/38/95/28/170389528.db2.gz ZWYOOSDVIDPGOE-UHFFFAOYSA-N 1 2 245.269 2.139 20 0 BEADLO C[N@H+](CCCF)[C@H](c1nnc[nH]1)c1ccccc1 ZINC000660763708 411623147 /nfs/dbraw/zinc/62/31/47/411623147.db2.gz KJTTZAFMFXWBFG-LBPRGKRZSA-N 1 2 248.305 2.186 20 0 BEADLO C[N@@H+](CCCF)[C@H](c1nnc[nH]1)c1ccccc1 ZINC000660763708 411623149 /nfs/dbraw/zinc/62/31/49/411623149.db2.gz KJTTZAFMFXWBFG-LBPRGKRZSA-N 1 2 248.305 2.186 20 0 BEADLO CCOCC[N@@H+]1CCCC[C@@H]1C(F)F ZINC000337519884 170398313 /nfs/dbraw/zinc/39/83/13/170398313.db2.gz OLRGSPDBVIAOLS-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CCOCC[N@H+]1CCCC[C@@H]1C(F)F ZINC000337519884 170398314 /nfs/dbraw/zinc/39/83/14/170398314.db2.gz OLRGSPDBVIAOLS-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO C[C@@H]1CN(c2[nH+]ccc3c(N)cccc32)CCO1 ZINC000663363468 411637495 /nfs/dbraw/zinc/63/74/95/411637495.db2.gz COAFCRXMEOEZBA-SNVBAGLBSA-N 1 2 243.310 2.042 20 0 BEADLO CC[C@@H](O)C[NH2+]CC(F)(F)c1ccc(F)cc1 ZINC000663367249 411639094 /nfs/dbraw/zinc/63/90/94/411639094.db2.gz OLRMTYZQJVJNSZ-LLVKDONJSA-N 1 2 247.260 2.278 20 0 BEADLO Oc1ccc2c(c1)[C@@H]([NH2+]Cc1cocn1)CC2 ZINC000657693123 411580095 /nfs/dbraw/zinc/58/00/95/411580095.db2.gz JPKLRPSWQBHYAS-ZDUSSCGKSA-N 1 2 230.267 2.157 20 0 BEADLO c1cc([C@@H]2CCC[N@H+]2Cc2cncs2)n[nH]1 ZINC000660431753 411584545 /nfs/dbraw/zinc/58/45/45/411584545.db2.gz LWTZJQKBIGCOKN-NSHDSACASA-N 1 2 234.328 2.203 20 0 BEADLO c1cc([C@@H]2CCC[N@@H+]2Cc2cncs2)n[nH]1 ZINC000660431753 411584547 /nfs/dbraw/zinc/58/45/47/411584547.db2.gz LWTZJQKBIGCOKN-NSHDSACASA-N 1 2 234.328 2.203 20 0 BEADLO CO[C@@H](C[NH2+]Cc1cn[nH]c1C)C1CCCC1 ZINC000657768087 411593780 /nfs/dbraw/zinc/59/37/80/411593780.db2.gz VGAFGZVNOMKHSQ-ZDUSSCGKSA-N 1 2 237.347 2.013 20 0 BEADLO Cc1n[nH]cc1C[NH2+]CC(F)(F)C(C)(C)C ZINC000657792245 411598222 /nfs/dbraw/zinc/59/82/22/411598222.db2.gz AKTBAGWGTSSWGY-UHFFFAOYSA-N 1 2 231.290 2.489 20 0 BEADLO COc1cccc(C[NH2+]Cc2cn[nH]c2C)c1C ZINC000657805479 411600169 /nfs/dbraw/zinc/60/01/69/411600169.db2.gz XVESFZFUFDSGFO-UHFFFAOYSA-N 1 2 245.326 2.325 20 0 BEADLO COc1cc[nH+]c(CN2CC[C@@H]2C(F)(F)F)c1 ZINC000660576909 411603426 /nfs/dbraw/zinc/60/34/26/411603426.db2.gz JRDIMKGURVRXTH-SNVBAGLBSA-N 1 2 246.232 2.227 20 0 BEADLO C[C@@H](O)[C@H]([NH2+]Cc1cscn1)c1ccccc1 ZINC000657815031 411604072 /nfs/dbraw/zinc/60/40/72/411604072.db2.gz HBKKCOFQYGOJKS-MFKMUULPSA-N 1 2 248.351 2.355 20 0 BEADLO F[C@H]1CC[N@H+](Cc2cc(C3CC3)no2)C1 ZINC000660692332 411617798 /nfs/dbraw/zinc/61/77/98/411617798.db2.gz OHLZILWMYPBGSN-VIFPVBQESA-N 1 2 210.252 2.096 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2cc(C3CC3)no2)C1 ZINC000660692332 411617799 /nfs/dbraw/zinc/61/77/99/411617799.db2.gz OHLZILWMYPBGSN-VIFPVBQESA-N 1 2 210.252 2.096 20 0 BEADLO CCn1cc([C@@H](C)[NH2+]Cc2coc(C)n2)cn1 ZINC000660738379 411620131 /nfs/dbraw/zinc/62/01/31/411620131.db2.gz BMVCLGRNNJJTOF-SECBINFHSA-N 1 2 234.303 2.050 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2coc(C)n2)C[C@H](CC)O1 ZINC000660834603 411651304 /nfs/dbraw/zinc/65/13/04/411651304.db2.gz ZLTYBPRYGOZCBD-BETUJISGSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2coc(C)n2)C[C@H](CC)O1 ZINC000660834603 411651307 /nfs/dbraw/zinc/65/13/07/411651307.db2.gz ZLTYBPRYGOZCBD-BETUJISGSA-N 1 2 238.331 2.372 20 0 BEADLO C[C@@H]1CCCC[C@H]1C[N@H+](C)Cc1n[nH]c(=O)o1 ZINC000660844604 411656769 /nfs/dbraw/zinc/65/67/69/411656769.db2.gz QNSKJTCRSMFRKA-ZJUUUORDSA-N 1 2 239.319 2.033 20 0 BEADLO C[C@@H]1CCCC[C@H]1C[N@@H+](C)Cc1n[nH]c(=O)o1 ZINC000660844604 411656770 /nfs/dbraw/zinc/65/67/70/411656770.db2.gz QNSKJTCRSMFRKA-ZJUUUORDSA-N 1 2 239.319 2.033 20 0 BEADLO C[C@H]1CCCC[C@@H]1C[N@H+](C)Cc1n[nH]c(=O)o1 ZINC000660844603 411657677 /nfs/dbraw/zinc/65/76/77/411657677.db2.gz QNSKJTCRSMFRKA-VHSXEESVSA-N 1 2 239.319 2.033 20 0 BEADLO C[C@H]1CCCC[C@@H]1C[N@@H+](C)Cc1n[nH]c(=O)o1 ZINC000660844603 411657681 /nfs/dbraw/zinc/65/76/81/411657681.db2.gz QNSKJTCRSMFRKA-VHSXEESVSA-N 1 2 239.319 2.033 20 0 BEADLO CCOc1cc(Nc2ccc(NC)[nH+]c2)ncn1 ZINC000136062444 170527534 /nfs/dbraw/zinc/52/75/34/170527534.db2.gz NLHAKYZGLHRBED-UHFFFAOYSA-N 1 2 245.286 2.056 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nc(C)oc2C)[C@H](C)CO1 ZINC000660912326 411668610 /nfs/dbraw/zinc/66/86/10/411668610.db2.gz JCPWJOLYWYLEIH-BXKDBHETSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nc(C)oc2C)[C@H](C)CO1 ZINC000660912326 411668613 /nfs/dbraw/zinc/66/86/13/411668613.db2.gz JCPWJOLYWYLEIH-BXKDBHETSA-N 1 2 238.331 2.291 20 0 BEADLO C(c1nnc(C2CC2)o1)[N@@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660932356 411682412 /nfs/dbraw/zinc/68/24/12/411682412.db2.gz ZDGRAIWIXXXGRG-QWRGUYRKSA-N 1 2 233.315 2.321 20 0 BEADLO C(c1nnc(C2CC2)o1)[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660932356 411682417 /nfs/dbraw/zinc/68/24/17/411682417.db2.gz ZDGRAIWIXXXGRG-QWRGUYRKSA-N 1 2 233.315 2.321 20 0 BEADLO Cc1ncc2c(n1)CC[C@@H](Nc1cccc[nH+]1)C2 ZINC000663500783 411683515 /nfs/dbraw/zinc/68/35/15/411683515.db2.gz VUCOTDCFKDBZME-GFCCVEGCSA-N 1 2 240.310 2.149 20 0 BEADLO Cc1nc(C[NH+]2CCC(C3CCC3)CC2)no1 ZINC000661376454 411760055 /nfs/dbraw/zinc/76/00/55/411760055.db2.gz KFWKTDYZYSNEJL-UHFFFAOYSA-N 1 2 235.331 2.390 20 0 BEADLO CC(C)C[C@H](C)C[N@@H+]1CC[C@H](O)C(F)(F)C1 ZINC000661406159 411768995 /nfs/dbraw/zinc/76/89/95/411768995.db2.gz INPAQYKNHWWMLC-QWRGUYRKSA-N 1 2 235.318 2.371 20 0 BEADLO CC(C)C[C@H](C)C[N@H+]1CC[C@H](O)C(F)(F)C1 ZINC000661406159 411769000 /nfs/dbraw/zinc/76/90/00/411769000.db2.gz INPAQYKNHWWMLC-QWRGUYRKSA-N 1 2 235.318 2.371 20 0 BEADLO O[C@H]1CC[N@H+](CCC2CCCC2)CC1(F)F ZINC000661401029 411769071 /nfs/dbraw/zinc/76/90/71/411769071.db2.gz NCPKMMYNLICMFF-NSHDSACASA-N 1 2 233.302 2.269 20 0 BEADLO O[C@H]1CC[N@@H+](CCC2CCCC2)CC1(F)F ZINC000661401029 411769075 /nfs/dbraw/zinc/76/90/75/411769075.db2.gz NCPKMMYNLICMFF-NSHDSACASA-N 1 2 233.302 2.269 20 0 BEADLO O[C@@H]1CC[N@H+](CC23CCC(CC2)C3)CC1(F)F ZINC000661407549 411769618 /nfs/dbraw/zinc/76/96/18/411769618.db2.gz NBILAGVCMKZWEE-MOENNCHZSA-N 1 2 245.313 2.269 20 0 BEADLO O[C@@H]1CC[N@@H+](CC23CCC(CC2)C3)CC1(F)F ZINC000661407549 411769620 /nfs/dbraw/zinc/76/96/20/411769620.db2.gz NBILAGVCMKZWEE-MOENNCHZSA-N 1 2 245.313 2.269 20 0 BEADLO CCc1cc(N2CC[C@H]2C(F)F)nc(C)[nH+]1 ZINC000663944608 411784278 /nfs/dbraw/zinc/78/42/78/411784278.db2.gz DRLWCNACOLVOOK-VIFPVBQESA-N 1 2 227.258 2.191 20 0 BEADLO Cc1[nH+]c(C(C)C)ccc1Cn1cccnc1=O ZINC000663957284 411790637 /nfs/dbraw/zinc/79/06/37/411790637.db2.gz FKCFGKCLIPJFJN-UHFFFAOYSA-N 1 2 243.310 2.118 20 0 BEADLO Cc1cnc([C@@H](C)[NH+]2C[C@@H](C)C(=O)[C@H](C)C2)cn1 ZINC000661538840 411798699 /nfs/dbraw/zinc/79/86/99/411798699.db2.gz LBVGXIFXHBOCPI-CKYFFXLPSA-N 1 2 247.342 2.003 20 0 BEADLO Cc1ccnc(C[NH+]2C[C@@H](C)C(=O)[C@H](C)C2)c1 ZINC000661545467 411800070 /nfs/dbraw/zinc/80/00/70/411800070.db2.gz ZBPHKKGHLPDLTP-VXGBXAGGSA-N 1 2 232.327 2.047 20 0 BEADLO C[C@H](c1cccnc1)[NH+]1C[C@@H](C)C(=O)[C@H](C)C1 ZINC000661552034 411801150 /nfs/dbraw/zinc/80/11/50/411801150.db2.gz YXBRBOOVDLVOJB-IJLUTSLNSA-N 1 2 232.327 2.300 20 0 BEADLO CNc1[nH+]cnc2c1cnn2CCC=C(C)C ZINC000663999742 411808189 /nfs/dbraw/zinc/80/81/89/411808189.db2.gz MLUHMQITZPEDOO-UHFFFAOYSA-N 1 2 231.303 2.224 20 0 BEADLO CCc1ccccc1C[N@H+](C)Cc1cn(C)nn1 ZINC000661746572 411865387 /nfs/dbraw/zinc/86/53/87/411865387.db2.gz ZOKZPMRGLNKDDI-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO CCc1ccccc1C[N@@H+](C)Cc1cn(C)nn1 ZINC000661746572 411865390 /nfs/dbraw/zinc/86/53/90/411865390.db2.gz ZOKZPMRGLNKDDI-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO Cc1cnc([C@H](C)[N@H+](C)CC2=CCCOC2)o1 ZINC000661652806 411831753 /nfs/dbraw/zinc/83/17/53/411831753.db2.gz CROOBAVTXKFLNZ-NSHDSACASA-N 1 2 236.315 2.323 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+](C)CC2=CCCOC2)o1 ZINC000661652806 411831757 /nfs/dbraw/zinc/83/17/57/411831757.db2.gz CROOBAVTXKFLNZ-NSHDSACASA-N 1 2 236.315 2.323 20 0 BEADLO Cc1nc(N2C[C@@H]3CCCC[C@@H]32)cc[nH+]1 ZINC000664083182 411845131 /nfs/dbraw/zinc/84/51/31/411845131.db2.gz OPTXDYBRZQGVNL-QWRGUYRKSA-N 1 2 203.289 2.164 20 0 BEADLO Cc1[nH+]cccc1Cn1cnc(C(C)C)n1 ZINC000664106240 411856985 /nfs/dbraw/zinc/85/69/85/411856985.db2.gz DJLHJZUZCGDTOH-UHFFFAOYSA-N 1 2 216.288 2.153 20 0 BEADLO CC[C@@H](C)[C@H]([NH2+]CCC(F)(F)F)C(=O)OC ZINC000336732220 170797781 /nfs/dbraw/zinc/79/77/81/170797781.db2.gz JHBKWAXCDJIZGX-SFYZADRCSA-N 1 2 241.253 2.116 20 0 BEADLO CCO[C@H]1C[C@H](Nc2cc[nH+]c(C3CC3)n2)C1 ZINC000664281714 411911599 /nfs/dbraw/zinc/91/15/99/411911599.db2.gz UQDZVCJFFQOZKE-XYPYZODXSA-N 1 2 233.315 2.333 20 0 BEADLO CC[C@H]([NH2+]CCF)c1nnc2n1CCCCC2 ZINC000661940274 411916121 /nfs/dbraw/zinc/91/61/21/411916121.db2.gz SFWASOXUKWIJJI-JTQLQIEISA-N 1 2 240.326 2.015 20 0 BEADLO C[C@@H]1CN(c2cc[nH+]c(C3CC3)n2)C[C@@H](C)C1=O ZINC000664309043 411918396 /nfs/dbraw/zinc/91/83/96/411918396.db2.gz VESAWRLNKQJOLX-NXEZZACHSA-N 1 2 245.326 2.015 20 0 BEADLO Cc1nc(NCCCOC(C)(C)C)cc[nH+]1 ZINC000664360262 411931187 /nfs/dbraw/zinc/93/11/87/411931187.db2.gz ZINALQZFPCCECV-UHFFFAOYSA-N 1 2 223.320 2.402 20 0 BEADLO CC(C)(C)c1noc(C[N@@H+]2CC[C@H]3C[C@H]3C2)n1 ZINC000661978912 411934221 /nfs/dbraw/zinc/93/42/21/411934221.db2.gz SFVSBGKUMYNVOJ-UWVGGRQHSA-N 1 2 235.331 2.209 20 0 BEADLO CC(C)(C)c1noc(C[N@H+]2CC[C@H]3C[C@H]3C2)n1 ZINC000661978912 411934222 /nfs/dbraw/zinc/93/42/22/411934222.db2.gz SFVSBGKUMYNVOJ-UWVGGRQHSA-N 1 2 235.331 2.209 20 0 BEADLO c1cc(CCNc2cc(NC3CC3)nc[nH+]2)co1 ZINC000664381605 411935950 /nfs/dbraw/zinc/93/59/50/411935950.db2.gz UUBHPQAGCYLLJN-UHFFFAOYSA-N 1 2 244.298 2.299 20 0 BEADLO c1cc(CCNc2cc(NC3CC3)[nH+]cn2)co1 ZINC000664381605 411935956 /nfs/dbraw/zinc/93/59/56/411935956.db2.gz UUBHPQAGCYLLJN-UHFFFAOYSA-N 1 2 244.298 2.299 20 0 BEADLO Cc1nc(NCc2c(C3CC3)cnn2C)cc[nH+]1 ZINC000664393037 411939681 /nfs/dbraw/zinc/93/96/81/411939681.db2.gz PRDHKKORZQAWGA-UHFFFAOYSA-N 1 2 243.314 2.008 20 0 BEADLO Cc1nc(NC[C@@H]2CCC[C@H](C)O2)cc[nH+]1 ZINC000664393787 411940752 /nfs/dbraw/zinc/94/07/52/411940752.db2.gz HSNIEZBNYFYSQI-ONGXEEELSA-N 1 2 221.304 2.155 20 0 BEADLO Cn1c2ccccc2[nH+]c1N[C@@H](CO)C1CCC1 ZINC000664172542 411879191 /nfs/dbraw/zinc/87/91/91/411879191.db2.gz WMFQLAPYZVJFEP-LBPRGKRZSA-N 1 2 245.326 2.146 20 0 BEADLO Cc1nc(N2CC[C@@H](C)O[C@@H](C)C2)c(C)c(C)[nH+]1 ZINC000664471882 411968628 /nfs/dbraw/zinc/96/86/28/411968628.db2.gz XUKKCPDOPAQVEB-ZJUUUORDSA-N 1 2 249.358 2.406 20 0 BEADLO Cc1nc(N2CCC3(CCCC3=O)CC2)cc[nH+]1 ZINC000664515690 411973484 /nfs/dbraw/zinc/97/34/84/411973484.db2.gz HDSWZOCBRJDQAJ-UHFFFAOYSA-N 1 2 245.326 2.125 20 0 BEADLO Cc1cc(NC[C@@H]2C(C)(C)C2(F)F)nc[nH+]1 ZINC000664525159 411977641 /nfs/dbraw/zinc/97/76/41/411977641.db2.gz VWZLFTHNMOLNIE-MRVPVSSYSA-N 1 2 227.258 2.488 20 0 BEADLO COc1c(C)[nH+]cnc1NCC1=CCCC1 ZINC000664541394 411980793 /nfs/dbraw/zinc/98/07/93/411980793.db2.gz BUDVLDDQOUPGCA-UHFFFAOYSA-N 1 2 219.288 2.316 20 0 BEADLO CC[C@@H](NC(=O)[C@H](C)C1CC1)c1[nH]cc[nH+]1 ZINC000125330089 170882058 /nfs/dbraw/zinc/88/20/58/170882058.db2.gz UJJVGHUCUCBPNO-PSASIEDQSA-N 1 2 221.304 2.023 20 0 BEADLO Cc1cc(C)nc(N[C@H](C)c2[nH+]ccn2C)n1 ZINC000664608991 411998568 /nfs/dbraw/zinc/99/85/68/411998568.db2.gz RXGJKWNYIXZFNQ-SNVBAGLBSA-N 1 2 231.303 2.000 20 0 BEADLO Cc1nc(N[C@H](c2ccccc2)[C@@H](C)O)cc[nH+]1 ZINC000664658126 412006264 /nfs/dbraw/zinc/00/62/64/412006264.db2.gz QYMQTFULFVNMMM-YGRLFVJLSA-N 1 2 243.310 2.319 20 0 BEADLO CC12CC(C1)CN2c1cc(N2CCCC2)[nH+]cn1 ZINC000664692826 412010109 /nfs/dbraw/zinc/01/01/09/412010109.db2.gz DZFJMLDJBKDAPV-UHFFFAOYSA-N 1 2 244.342 2.066 20 0 BEADLO CC12CC(C1)CN2c1cc(N2CCCC2)nc[nH+]1 ZINC000664692826 412010112 /nfs/dbraw/zinc/01/01/12/412010112.db2.gz DZFJMLDJBKDAPV-UHFFFAOYSA-N 1 2 244.342 2.066 20 0 BEADLO Cc1cnc(C[N@H+](C)CC2=CCSC2)o1 ZINC000662268997 412059510 /nfs/dbraw/zinc/05/95/10/412059510.db2.gz SVPGZGSKRDCYKN-UHFFFAOYSA-N 1 2 224.329 2.088 20 0 BEADLO Cc1cnc(C[N@@H+](C)CC2=CCSC2)o1 ZINC000662268997 412059513 /nfs/dbraw/zinc/05/95/13/412059513.db2.gz SVPGZGSKRDCYKN-UHFFFAOYSA-N 1 2 224.329 2.088 20 0 BEADLO Cc1ccc[nH+]c1CCc1noc(CCCF)n1 ZINC000664897857 412041873 /nfs/dbraw/zinc/04/18/73/412041873.db2.gz ODEWNXMRLJZLRG-UHFFFAOYSA-N 1 2 249.289 2.460 20 0 BEADLO Cc1cc[nH+]cc1Cc1noc([C@@H]2CCCO2)n1 ZINC000664979775 412055281 /nfs/dbraw/zinc/05/52/81/412055281.db2.gz BKRVOGKWUFYDJW-NSHDSACASA-N 1 2 245.282 2.215 20 0 BEADLO O[C@H]1C[C@@H](c2ccccc2)[N@H+](CC(F)F)C1 ZINC000665029834 412056935 /nfs/dbraw/zinc/05/69/35/412056935.db2.gz ZTUNNUUEXOKJQG-QWRGUYRKSA-N 1 2 227.254 2.059 20 0 BEADLO O[C@H]1C[C@@H](c2ccccc2)[N@@H+](CC(F)F)C1 ZINC000665029834 412056939 /nfs/dbraw/zinc/05/69/39/412056939.db2.gz ZTUNNUUEXOKJQG-QWRGUYRKSA-N 1 2 227.254 2.059 20 0 BEADLO Cc1cc[nH+]cc1Cc1noc(C2(F)CC2)n1 ZINC000664984458 412057232 /nfs/dbraw/zinc/05/72/32/412057232.db2.gz NRULUHJNGYUXOU-UHFFFAOYSA-N 1 2 233.246 2.322 20 0 BEADLO CC[C@@H]1CCN1C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000333157699 171018173 /nfs/dbraw/zinc/01/81/73/171018173.db2.gz GRNQWLSLCTUSME-GMTAPVOTSA-N 1 2 248.330 2.083 20 0 BEADLO CC[C@@H]1CC[N@@H+]1Cc1cnn(-c2ccccc2)n1 ZINC000292413280 171024392 /nfs/dbraw/zinc/02/43/92/171024392.db2.gz MFLQZJDKSQOUKN-CYBMUJFWSA-N 1 2 242.326 2.252 20 0 BEADLO CC[C@@H]1CC[N@H+]1Cc1cnn(-c2ccccc2)n1 ZINC000292413280 171024394 /nfs/dbraw/zinc/02/43/94/171024394.db2.gz MFLQZJDKSQOUKN-CYBMUJFWSA-N 1 2 242.326 2.252 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccc(F)nc2C)CCO1 ZINC000278368843 171088336 /nfs/dbraw/zinc/08/83/36/171088336.db2.gz BPADCJJVQVYDAV-GFCCVEGCSA-N 1 2 238.306 2.140 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccc(F)nc2C)CCO1 ZINC000278368843 171088339 /nfs/dbraw/zinc/08/83/39/171088339.db2.gz BPADCJJVQVYDAV-GFCCVEGCSA-N 1 2 238.306 2.140 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1ccnn1C(C)C ZINC000337194885 171106354 /nfs/dbraw/zinc/10/63/54/171106354.db2.gz VPVAPYNYNAMCGK-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1ccnn1C(C)C ZINC000337194885 171106355 /nfs/dbraw/zinc/10/63/55/171106355.db2.gz VPVAPYNYNAMCGK-GFCCVEGCSA-N 1 2 237.347 2.075 20 0 BEADLO CCO[C@H](CC)c1noc(C[NH+](CC)CC)n1 ZINC000665038470 412064397 /nfs/dbraw/zinc/06/43/97/412064397.db2.gz HSKUMYIDXQBSLA-SNVBAGLBSA-N 1 2 241.335 2.399 20 0 BEADLO CC[C@@](C)([NH2+]Cc1ccccc1C)C(=O)OC ZINC000265434634 171176290 /nfs/dbraw/zinc/17/62/90/171176290.db2.gz NZKUPPZKAUBSQP-CQSZACIVSA-N 1 2 235.327 2.426 20 0 BEADLO CC[C@@](C)(OC)C(=O)Nc1cc[nH+]c(C)c1 ZINC000280972550 171191036 /nfs/dbraw/zinc/19/10/36/171191036.db2.gz LMHWPVAAHOBDCM-GFCCVEGCSA-N 1 2 222.288 2.144 20 0 BEADLO CC[C@@]1(C)CCCN(C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000288294390 171197429 /nfs/dbraw/zinc/19/74/29/171197429.db2.gz YCGGHSLLMBIIIE-AWEZNQCLSA-N 1 2 249.358 2.381 20 0 BEADLO CC[C@H](C)CC(=O)NC[C@H](C)Cn1cc[nH+]c1 ZINC000276563422 171260184 /nfs/dbraw/zinc/26/01/84/171260184.db2.gz AEAFHZIRTZPGBB-RYUDHWBXSA-N 1 2 237.347 2.072 20 0 BEADLO CC[C@H](C)CCC(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000285292667 171268555 /nfs/dbraw/zinc/26/85/55/171268555.db2.gz VMWZEYUBXDYUOK-NWDGAFQWSA-N 1 2 237.347 2.214 20 0 BEADLO CC[C@H](C)CN1CC[NH+](C2CCC2)CC1 ZINC000336649969 171280492 /nfs/dbraw/zinc/28/04/92/171280492.db2.gz SBEFVIUHVGLSJL-LBPRGKRZSA-N 1 2 210.365 2.203 20 0 BEADLO CC[C@H](C)C[NH2+][C@H](Cc1ccccc1)C(=O)OC ZINC000276493656 171288342 /nfs/dbraw/zinc/28/83/42/171288342.db2.gz QMMOVPDDAZYCNY-GXTWGEPZSA-N 1 2 249.354 2.406 20 0 BEADLO CC[C@H](C)[N@H+](C)Cc1noc(C(C)C)n1 ZINC000104688289 171310153 /nfs/dbraw/zinc/31/01/53/171310153.db2.gz GQOZUKUEJBDTBF-VIFPVBQESA-N 1 2 211.309 2.423 20 0 BEADLO CC[C@H](C)OCC(=O)Nc1ccc(C)[nH+]c1C ZINC000178914181 171354527 /nfs/dbraw/zinc/35/45/27/171354527.db2.gz OBDNTYGTEZEDDH-JTQLQIEISA-N 1 2 236.315 2.452 20 0 BEADLO CC[C@H](C)[C@@H](C)C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000272502562 171359835 /nfs/dbraw/zinc/35/98/35/171359835.db2.gz DUZZZFWKYJQWHZ-QJPTWQEYSA-N 1 2 237.347 2.070 20 0 BEADLO CCc1nc(C[N@H+](C)C[C@@H]2CC2(C)C)no1 ZINC000662349024 412120165 /nfs/dbraw/zinc/12/01/65/412120165.db2.gz ZMOOXAYNJJKPQW-VIFPVBQESA-N 1 2 223.320 2.110 20 0 BEADLO CCc1nc(C[N@@H+](C)C[C@@H]2CC2(C)C)no1 ZINC000662349024 412120167 /nfs/dbraw/zinc/12/01/67/412120167.db2.gz ZMOOXAYNJJKPQW-VIFPVBQESA-N 1 2 223.320 2.110 20 0 BEADLO c1[nH]cc(-c2ccc3c(c2)CCCO3)[nH+]1 ZINC000665183688 412122322 /nfs/dbraw/zinc/12/23/22/412122322.db2.gz DHSSVRXEVVRWSQ-UHFFFAOYSA-N 1 2 200.241 2.402 20 0 BEADLO CC(C)Oc1cc(N)cc(-c2[nH+]ccn2C)c1 ZINC000665181288 412122573 /nfs/dbraw/zinc/12/25/73/412122573.db2.gz NMNZPLQLOPEXLF-UHFFFAOYSA-N 1 2 231.299 2.457 20 0 BEADLO CCC(=O)CCC[N@@H+]1CCO[C@](C)(C(F)F)C1 ZINC000662369286 412128145 /nfs/dbraw/zinc/12/81/45/412128145.db2.gz OOVKKAPRBHNIOP-LBPRGKRZSA-N 1 2 249.301 2.102 20 0 BEADLO CCC(=O)CCC[N@H+]1CCO[C@](C)(C(F)F)C1 ZINC000662369286 412128149 /nfs/dbraw/zinc/12/81/49/412128149.db2.gz OOVKKAPRBHNIOP-LBPRGKRZSA-N 1 2 249.301 2.102 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H]1CCO[C@H](C)C1 ZINC000271867805 171926094 /nfs/dbraw/zinc/92/60/94/171926094.db2.gz FYMQNHZEBJUQPU-PWSUYJOCSA-N 1 2 248.326 2.398 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@@H](OC)C2)cs1 ZINC000076344949 171976603 /nfs/dbraw/zinc/97/66/03/171976603.db2.gz UTAYMYYGVDKFTG-LLVKDONJSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@@H](OC)C2)cs1 ZINC000076344949 171976606 /nfs/dbraw/zinc/97/66/06/171976606.db2.gz UTAYMYYGVDKFTG-LLVKDONJSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2ccco2)[nH]1 ZINC000271502199 172003085 /nfs/dbraw/zinc/00/30/85/172003085.db2.gz MEPNXTWBPMTDQM-RKDXNWHRSA-N 1 2 234.303 2.372 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)s1 ZINC000336507121 172017084 /nfs/dbraw/zinc/01/70/84/172017084.db2.gz KDJONYPVYMJVQD-AOOOYVTPSA-N 1 2 238.356 2.069 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)s1 ZINC000336507121 172017086 /nfs/dbraw/zinc/01/70/86/172017086.db2.gz KDJONYPVYMJVQD-AOOOYVTPSA-N 1 2 238.356 2.069 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)s1 ZINC000269474435 172017526 /nfs/dbraw/zinc/01/75/26/172017526.db2.gz LQPQKPPZIJMZHP-AOOOYVTPSA-N 1 2 240.372 2.315 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)s1 ZINC000269474435 172017527 /nfs/dbraw/zinc/01/75/27/172017527.db2.gz LQPQKPPZIJMZHP-AOOOYVTPSA-N 1 2 240.372 2.315 20 0 BEADLO CCc1nnc(C[NH2+]Cc2cccs2)s1 ZINC000289860157 172052486 /nfs/dbraw/zinc/05/24/86/172052486.db2.gz QIYQUISSBBHZTR-UHFFFAOYSA-N 1 2 239.369 2.452 20 0 BEADLO CCc1nnc(C[NH2+][C@@H](C)c2ccccn2)s1 ZINC000273133828 172054448 /nfs/dbraw/zinc/05/44/48/172054448.db2.gz JAZHCVNNFLSVQI-VIFPVBQESA-N 1 2 248.355 2.346 20 0 BEADLO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2cccnc2)o1 ZINC000361099274 172066503 /nfs/dbraw/zinc/06/65/03/172066503.db2.gz ZMTRYUFOJKKXCV-UWVGGRQHSA-N 1 2 246.314 2.439 20 0 BEADLO CCc1noc([C@H](C)[N@@H+]2C[C@H](C)[C@@H]2C)n1 ZINC000339567464 172091722 /nfs/dbraw/zinc/09/17/22/172091722.db2.gz JAPZASPBJLHXGX-CIUDSAMLSA-N 1 2 209.293 2.033 20 0 BEADLO CCc1noc([C@H](C)[N@H+]2C[C@H](C)[C@@H]2C)n1 ZINC000339567464 172091724 /nfs/dbraw/zinc/09/17/24/172091724.db2.gz JAPZASPBJLHXGX-CIUDSAMLSA-N 1 2 209.293 2.033 20 0 BEADLO CCc1noc([C@H](C)[NH2+][C@H](C)c2cccnc2)n1 ZINC000182885699 172092238 /nfs/dbraw/zinc/09/22/38/172092238.db2.gz RIRIZYIRFIJLIO-ZJUUUORDSA-N 1 2 246.314 2.439 20 0 BEADLO CCc1nocc1C[N@@H+](C)C[C@H](F)CC ZINC000339608240 172096242 /nfs/dbraw/zinc/09/62/42/172096242.db2.gz PVBZNRATCVBBKK-SNVBAGLBSA-N 1 2 214.284 2.417 20 0 BEADLO CCc1nocc1C[N@H+](C)C[C@H](F)CC ZINC000339608240 172096244 /nfs/dbraw/zinc/09/62/44/172096244.db2.gz PVBZNRATCVBBKK-SNVBAGLBSA-N 1 2 214.284 2.417 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1c(C)n[nH]c1C ZINC000293693632 172096257 /nfs/dbraw/zinc/09/62/57/172096257.db2.gz QVAJFZBAOGUGCN-UHFFFAOYSA-N 1 2 248.330 2.209 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1c(C)n[nH]c1C ZINC000293693632 172096258 /nfs/dbraw/zinc/09/62/58/172096258.db2.gz QVAJFZBAOGUGCN-UHFFFAOYSA-N 1 2 248.330 2.209 20 0 BEADLO CCc1nsc(N[C@@H](CC)c2[nH]cc[nH+]2)n1 ZINC000125232631 172106648 /nfs/dbraw/zinc/10/66/48/172106648.db2.gz FBSIKOZMGNNQBO-ZETCQYMHSA-N 1 2 237.332 2.387 20 0 BEADLO CCn1cc(C[NH2+][C@@H](C)c2cc(C)on2)cn1 ZINC000282767627 172173274 /nfs/dbraw/zinc/17/32/74/172173274.db2.gz UPLALZCJOYYZQN-JTQLQIEISA-N 1 2 234.303 2.050 20 0 BEADLO CCn1cc(C[NH2+][C@H](C)c2nccs2)cn1 ZINC000070650901 172173492 /nfs/dbraw/zinc/17/34/92/172173492.db2.gz DDRNTAJRHCBFKT-SECBINFHSA-N 1 2 236.344 2.210 20 0 BEADLO CCn1cc[nH+]c1CN(C)Cc1cccc(C)n1 ZINC000336710050 172217262 /nfs/dbraw/zinc/21/72/62/172217262.db2.gz MOYPHRXJMGSHPK-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1cc[nH+]c1CN(C)Cc1occc1C ZINC000336704428 172217961 /nfs/dbraw/zinc/21/79/61/172217961.db2.gz KOVUPUIYGVPZIL-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C[C@@H]1CC[C@@H](C)C1 ZINC000295828831 172221863 /nfs/dbraw/zinc/22/18/63/172221863.db2.gz USSRLCZZDPJAGO-VXGBXAGGSA-N 1 2 249.358 2.346 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)/C=C1/CC[C@H](C)C1 ZINC000295718417 172222458 /nfs/dbraw/zinc/22/24/58/172222458.db2.gz KKBBYSWFDNBLKQ-AWPPVZKDSA-N 1 2 247.342 2.266 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C[C@H]1CC[C@H](C)C1 ZINC000295828829 172222567 /nfs/dbraw/zinc/22/25/67/172222567.db2.gz USSRLCZZDPJAGO-RYUDHWBXSA-N 1 2 249.358 2.346 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@@H]1CC=CC[C@H]1C ZINC000295743542 172222742 /nfs/dbraw/zinc/22/27/42/172222742.db2.gz TXYHIJAQLYQWQK-VXGBXAGGSA-N 1 2 247.342 2.122 20 0 BEADLO CCn1cc[nH+]c1CN=c1[nH]c2ccccc2o1 ZINC000341335692 172223189 /nfs/dbraw/zinc/22/31/89/172223189.db2.gz APZVCGQNXQZRPN-UHFFFAOYSA-N 1 2 242.282 2.078 20 0 BEADLO CCn1cc[nH+]c1CNc1cccc2c1CCO2 ZINC000355484408 172225996 /nfs/dbraw/zinc/22/59/96/172225996.db2.gz JIPIAWANAWOHAU-UHFFFAOYSA-N 1 2 243.310 2.450 20 0 BEADLO CCn1cc[nH+]c1CNc1ccnc(C2CC2)n1 ZINC000294968248 172226143 /nfs/dbraw/zinc/22/61/43/172226143.db2.gz KRLXTNXYHXYZRU-UHFFFAOYSA-N 1 2 243.314 2.183 20 0 BEADLO CCn1ccnc1[C@H](C)[NH2+]Cc1ccoc1 ZINC000295350324 172229593 /nfs/dbraw/zinc/22/95/93/172229593.db2.gz YUVAPDRKQFQNOM-JTQLQIEISA-N 1 2 219.288 2.347 20 0 BEADLO CCn1c[nH+]cc1CNc1ccn(C(C)C)n1 ZINC000306035964 172232959 /nfs/dbraw/zinc/23/29/59/172232959.db2.gz XNXHGGXSMVSPNW-UHFFFAOYSA-N 1 2 233.319 2.293 20 0 BEADLO CCn1nccc1C[N@H+](C)Cc1cccc(C)n1 ZINC000353766842 172263389 /nfs/dbraw/zinc/26/33/89/172263389.db2.gz JBXUHGXZPWBLAK-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1nccc1C[N@@H+](C)Cc1cccc(C)n1 ZINC000353766842 172263392 /nfs/dbraw/zinc/26/33/92/172263392.db2.gz JBXUHGXZPWBLAK-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1nccc1C[N@H+](C)CCC(F)(F)F ZINC000119754889 172263506 /nfs/dbraw/zinc/26/35/06/172263506.db2.gz DPNPMSONEVMVIW-UHFFFAOYSA-N 1 2 235.253 2.287 20 0 BEADLO CCn1nccc1C[N@@H+](C)CCC(F)(F)F ZINC000119754889 172263508 /nfs/dbraw/zinc/26/35/08/172263508.db2.gz DPNPMSONEVMVIW-UHFFFAOYSA-N 1 2 235.253 2.287 20 0 BEADLO CCn1nccc1C[N@@H+]1CCn2cccc2[C@H]1C ZINC000179566347 172268040 /nfs/dbraw/zinc/26/80/40/172268040.db2.gz OROUIFPESSNOAI-GFCCVEGCSA-N 1 2 244.342 2.281 20 0 BEADLO CCn1nccc1C[N@H+]1CCn2cccc2[C@H]1C ZINC000179566347 172268042 /nfs/dbraw/zinc/26/80/42/172268042.db2.gz OROUIFPESSNOAI-GFCCVEGCSA-N 1 2 244.342 2.281 20 0 BEADLO CCn1nccc1CNc1ccc(C)[nH+]c1 ZINC000119648592 172274622 /nfs/dbraw/zinc/27/46/22/172274622.db2.gz IUXZTHGIHSDBNH-UHFFFAOYSA-N 1 2 216.288 2.219 20 0 BEADLO CCn1ncnc1C[N@H+]1CC=C(C(C)(C)C)CC1 ZINC000278880504 172279584 /nfs/dbraw/zinc/27/95/84/172279584.db2.gz PDOHNSXYVSXXCQ-UHFFFAOYSA-N 1 2 248.374 2.476 20 0 BEADLO CCn1ncnc1C[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000278880504 172279587 /nfs/dbraw/zinc/27/95/87/172279587.db2.gz PDOHNSXYVSXXCQ-UHFFFAOYSA-N 1 2 248.374 2.476 20 0 BEADLO CN(C(=O)CCc1c[nH+]cn1C)c1ccccc1 ZINC000276754730 172306429 /nfs/dbraw/zinc/30/64/29/172306429.db2.gz WLHITTXLVKAPKT-UHFFFAOYSA-N 1 2 243.310 2.016 20 0 BEADLO C[N@@H+]1CCC[C@@H]1C(=O)Nc1ccsc1Cl ZINC000275900332 173028287 /nfs/dbraw/zinc/02/82/87/173028287.db2.gz QVWVRGPZUXZTFR-MRVPVSSYSA-N 1 2 244.747 2.434 20 0 BEADLO C[N@H+]1CCC[C@@H]1C(=O)Nc1ccsc1Cl ZINC000275900332 173028288 /nfs/dbraw/zinc/02/82/88/173028288.db2.gz QVWVRGPZUXZTFR-MRVPVSSYSA-N 1 2 244.747 2.434 20 0 BEADLO COC(=O)[C@@H](Cc1ccc(C)cc1)[NH2+]C(C)C ZINC000280921305 173702754 /nfs/dbraw/zinc/70/27/54/173702754.db2.gz IIRDXQRFFNZHFL-CYBMUJFWSA-N 1 2 235.327 2.077 20 0 BEADLO COC(=O)[C@H](Cc1ccc(C)cc1)[NH2+]C(C)C ZINC000280921308 173798003 /nfs/dbraw/zinc/79/80/03/173798003.db2.gz IIRDXQRFFNZHFL-ZDUSSCGKSA-N 1 2 235.327 2.077 20 0 BEADLO COC1CCC(C)(CNc2cc(C)[nH+]cn2)CC1 ZINC000359840840 174019634 /nfs/dbraw/zinc/01/96/34/174019634.db2.gz TXZKLFMASBLIIQ-UHFFFAOYSA-N 1 2 249.358 2.214 20 0 BEADLO COC1CCC(C)(CNc2cc[nH+]c(C)n2)CC1 ZINC000359830908 174019716 /nfs/dbraw/zinc/01/97/16/174019716.db2.gz AJPKRABZVPCVTG-UHFFFAOYSA-N 1 2 249.358 2.214 20 0 BEADLO COC1CCC(N(C)c2cc(C)[nH+]cn2)CC1 ZINC000360332864 174022971 /nfs/dbraw/zinc/02/29/71/174022971.db2.gz DBATYPAAVNRUTL-UHFFFAOYSA-N 1 2 235.331 2.179 20 0 BEADLO COCC1(CCNc2cc[nH+]c(C)n2)CCC1 ZINC000292712276 174096658 /nfs/dbraw/zinc/09/66/58/174096658.db2.gz GUDIEEJQBUFSHA-UHFFFAOYSA-N 1 2 235.331 2.404 20 0 BEADLO COCCC(C)(C)CNc1cc[nH+]c(C)n1 ZINC000184050044 174143861 /nfs/dbraw/zinc/14/38/61/174143861.db2.gz WOEGXZNEWKYTTB-UHFFFAOYSA-N 1 2 223.320 2.260 20 0 BEADLO COCCC1(C)C[NH+](Cc2nc(C)cs2)C1 ZINC000297468508 174152881 /nfs/dbraw/zinc/15/28/81/174152881.db2.gz SFUCORABZYASAP-UHFFFAOYSA-N 1 2 240.372 2.310 20 0 BEADLO COCCC1(C)C[NH+](Cc2cscn2)C1 ZINC000297408927 174153006 /nfs/dbraw/zinc/15/30/06/174153006.db2.gz MEKVPVWTJIEWAO-UHFFFAOYSA-N 1 2 226.345 2.002 20 0 BEADLO COCCCCC(=O)Nc1cc[nH+]c(C)c1 ZINC000123344259 174175279 /nfs/dbraw/zinc/17/52/79/174175279.db2.gz UPEUBKXKMFRIQM-UHFFFAOYSA-N 1 2 222.288 2.145 20 0 BEADLO COCCCCCSc1nc(N)cc(C)[nH+]1 ZINC000103231272 174186199 /nfs/dbraw/zinc/18/61/99/174186199.db2.gz OQNKRQVFRUWDLL-UHFFFAOYSA-N 1 2 241.360 2.276 20 0 BEADLO COCCCC[N@H+](CC(F)F)C1CC1 ZINC000117881144 174190431 /nfs/dbraw/zinc/19/04/31/174190431.db2.gz AQQWALJSQWUHRN-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO COCCCC[N@@H+](CC(F)F)C1CC1 ZINC000117881144 174190432 /nfs/dbraw/zinc/19/04/32/174190432.db2.gz AQQWALJSQWUHRN-UHFFFAOYSA-N 1 2 207.264 2.143 20 0 BEADLO COCCCN(C)c1nc(C)[nH+]c2c1CCCC2 ZINC000302049138 174221063 /nfs/dbraw/zinc/22/10/63/174221063.db2.gz MRPXQBLJRMIPKX-UHFFFAOYSA-N 1 2 249.358 2.137 20 0 BEADLO COCCC[C@@H](C)C(=O)Nc1cc[nH+]cc1C ZINC000182796531 174260964 /nfs/dbraw/zinc/26/09/64/174260964.db2.gz UDHFCJWENUGHGX-SNVBAGLBSA-N 1 2 236.315 2.391 20 0 BEADLO COCCCn1c(C)[nH+]c2ccccc21 ZINC000040389389 174266709 /nfs/dbraw/zinc/26/67/09/174266709.db2.gz GPCYHKWBFNPSNS-UHFFFAOYSA-N 1 2 204.273 2.381 20 0 BEADLO COCCN(Cc1ccco1)c1cc(C)[nH+]cn1 ZINC000301667645 174301066 /nfs/dbraw/zinc/30/10/66/174301066.db2.gz XKZCMDILJSLTIO-UHFFFAOYSA-N 1 2 247.298 2.031 20 0 BEADLO COCC[N@H+](Cc1nccn1C(C)C)C1CC1 ZINC000336688197 174302409 /nfs/dbraw/zinc/30/24/09/174302409.db2.gz GYMFGRSOODXGEI-UHFFFAOYSA-N 1 2 237.347 2.075 20 0 BEADLO COCC[N@@H+](Cc1nccn1C(C)C)C1CC1 ZINC000336688197 174302411 /nfs/dbraw/zinc/30/24/11/174302411.db2.gz GYMFGRSOODXGEI-UHFFFAOYSA-N 1 2 237.347 2.075 20 0 BEADLO COCC[N@H+]1C[C@@H](c2ccsc2)O[C@@H](C)C1 ZINC000246346339 174318649 /nfs/dbraw/zinc/31/86/49/174318649.db2.gz FIRSGEGUMGLERD-JQWIXIFHSA-N 1 2 241.356 2.156 20 0 BEADLO COCC[N@@H+]1C[C@@H](c2ccsc2)O[C@@H](C)C1 ZINC000246346339 174318651 /nfs/dbraw/zinc/31/86/51/174318651.db2.gz FIRSGEGUMGLERD-JQWIXIFHSA-N 1 2 241.356 2.156 20 0 BEADLO CO[C@H](C)[C@@H](C)Nc1cc[nH+]c2ccncc12 ZINC000290807735 174845625 /nfs/dbraw/zinc/84/56/25/174845625.db2.gz ZIMPCGQLTXZSNW-NXEZZACHSA-N 1 2 231.299 2.465 20 0 BEADLO COc1ccc(-c2cccc(N)[nH+]2)cc1F ZINC000038069497 175035121 /nfs/dbraw/zinc/03/51/21/175035121.db2.gz BGFPTCLQYBAERQ-UHFFFAOYSA-N 1 2 218.231 2.479 20 0 BEADLO COc1ccc(-c2ccc[nH+]c2N)c(F)c1 ZINC000082729953 175035295 /nfs/dbraw/zinc/03/52/95/175035295.db2.gz CKILWBLTSMNREA-UHFFFAOYSA-N 1 2 218.231 2.479 20 0 BEADLO COc1ccc(-c2cccc(N)[nH+]2)cc1OC ZINC000038068991 175035331 /nfs/dbraw/zinc/03/53/31/175035331.db2.gz SGGUWJIPXLHOHH-UHFFFAOYSA-N 1 2 230.267 2.348 20 0 BEADLO COc1ccc(C)cc1C[NH2+]Cc1ccn(C)n1 ZINC000112343236 175076167 /nfs/dbraw/zinc/07/61/67/175076167.db2.gz ZJPLQHKZXZIYJF-UHFFFAOYSA-N 1 2 245.326 2.027 20 0 BEADLO COc1ccc(C[N@@H+]2CCC(=O)[C@@H](C)C2)cc1 ZINC000049693459 175098124 /nfs/dbraw/zinc/09/81/24/175098124.db2.gz AKXMOGXOTQJMHF-NSHDSACASA-N 1 2 233.311 2.106 20 0 BEADLO COc1ccc(C[N@H+]2CCC(=O)[C@@H](C)C2)cc1 ZINC000049693459 175098125 /nfs/dbraw/zinc/09/81/25/175098125.db2.gz AKXMOGXOTQJMHF-NSHDSACASA-N 1 2 233.311 2.106 20 0 BEADLO COc1ccc(C[NH2+][C@H](C)c2cc(C)on2)cn1 ZINC000337308928 175111114 /nfs/dbraw/zinc/11/11/14/175111114.db2.gz TWKBROBBDVYLBP-SNVBAGLBSA-N 1 2 247.298 2.237 20 0 BEADLO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1cnc[nH]1 ZINC000054764776 175132658 /nfs/dbraw/zinc/13/26/58/175132658.db2.gz VUTZANFFKGKAKH-SECBINFHSA-N 1 2 249.289 2.408 20 0 BEADLO COc1ccc(NCc2[nH]cc[nH+]2)cc1 ZINC000049714598 175152930 /nfs/dbraw/zinc/15/29/30/175152930.db2.gz UCGAWWFSIMHMAS-UHFFFAOYSA-N 1 2 203.245 2.030 20 0 BEADLO COc1ccc(OC)c(Nc2ccc(N)[nH+]c2)c1 ZINC000019952157 175166810 /nfs/dbraw/zinc/16/68/10/175166810.db2.gz WEOMHOGNKKGUNS-UHFFFAOYSA-N 1 2 245.282 2.425 20 0 BEADLO COc1ccc([C@@H](C)[NH2+]Cc2noc(C)n2)cc1 ZINC000223627924 175176598 /nfs/dbraw/zinc/17/65/98/175176598.db2.gz ZWDBWLCCAMCHFZ-SECBINFHSA-N 1 2 247.298 2.237 20 0 BEADLO COc1ccc2[nH+]c(N[C@H]3CCOC3)ccc2c1 ZINC000301780259 175228250 /nfs/dbraw/zinc/22/82/50/175228250.db2.gz RIQCEBTUCBDPBS-NSHDSACASA-N 1 2 244.294 2.444 20 0 BEADLO COc1ccc2[nH+]c(N[C@H](C)CO)ccc2c1 ZINC000301518124 175228902 /nfs/dbraw/zinc/22/89/02/175228902.db2.gz FYJKIRAPAMLHLC-SECBINFHSA-N 1 2 232.283 2.036 20 0 BEADLO COc1cccc(-c2ccc(N)[nH+]c2)c1F ZINC000075877988 175234740 /nfs/dbraw/zinc/23/47/40/175234740.db2.gz PTARKPOBOCAEOM-UHFFFAOYSA-N 1 2 218.231 2.479 20 0 BEADLO COc1cccc(C[N@@H+]2CCC(=O)C[C@@H]2C)c1 ZINC000049713130 175257241 /nfs/dbraw/zinc/25/72/41/175257241.db2.gz GBTNYPVEEPDRNF-NSHDSACASA-N 1 2 233.311 2.249 20 0 BEADLO COc1cccc(C[N@H+]2CCC(=O)C[C@@H]2C)c1 ZINC000049713130 175257242 /nfs/dbraw/zinc/25/72/42/175257242.db2.gz GBTNYPVEEPDRNF-NSHDSACASA-N 1 2 233.311 2.249 20 0 BEADLO COc1cccc(C[N@@H+]2CC[C@@](C)(F)C2)n1 ZINC000336437440 175260079 /nfs/dbraw/zinc/26/00/79/175260079.db2.gz GFNIAVVQWVQAGS-GFCCVEGCSA-N 1 2 224.279 2.024 20 0 BEADLO COc1cccc(C[N@H+]2CC[C@@](C)(F)C2)n1 ZINC000336437440 175260080 /nfs/dbraw/zinc/26/00/80/175260080.db2.gz GFNIAVVQWVQAGS-GFCCVEGCSA-N 1 2 224.279 2.024 20 0 BEADLO COc1cccc(C[N@@H+]2CC[C@](C)(F)C2)n1 ZINC000336437441 175260320 /nfs/dbraw/zinc/26/03/20/175260320.db2.gz GFNIAVVQWVQAGS-LBPRGKRZSA-N 1 2 224.279 2.024 20 0 BEADLO COc1cccc(C[N@H+]2CC[C@](C)(F)C2)n1 ZINC000336437441 175260321 /nfs/dbraw/zinc/26/03/21/175260321.db2.gz GFNIAVVQWVQAGS-LBPRGKRZSA-N 1 2 224.279 2.024 20 0 BEADLO COc1cccc([C@H](C)[NH2+]Cc2csnn2)c1 ZINC000037771545 175293662 /nfs/dbraw/zinc/29/36/62/175293662.db2.gz VIUCPAFYZRZGBW-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO COc1cccc2c(NCC(C)(C)O)cc[nH+]c12 ZINC000275483613 175299825 /nfs/dbraw/zinc/29/98/25/175299825.db2.gz KEFOLRMSNMXMJA-UHFFFAOYSA-N 1 2 246.310 2.426 20 0 BEADLO COc1cccc2c(NC[C@@H](C)O)cc[nH+]c12 ZINC000275478790 175300313 /nfs/dbraw/zinc/30/03/13/175300313.db2.gz JPOXZTRACBUAFL-SECBINFHSA-N 1 2 232.283 2.036 20 0 BEADLO COc1ccccc1/C=C\C[NH+]1CC(C)(OC)C1 ZINC000362313362 175315594 /nfs/dbraw/zinc/31/55/94/175315594.db2.gz SUERPWZCMJTNKY-VURMDHGXSA-N 1 2 247.338 2.429 20 0 BEADLO COc1ccccc1C[N@H+](C)Cc1ccon1 ZINC000172647117 175324836 /nfs/dbraw/zinc/32/48/36/175324836.db2.gz DNWVGSKWFGMVQB-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1ccccc1C[N@@H+](C)Cc1ccon1 ZINC000172647117 175324838 /nfs/dbraw/zinc/32/48/38/175324838.db2.gz DNWVGSKWFGMVQB-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1ccccc1CN(C)c1cc[nH+]c(C)n1 ZINC000266136195 175326508 /nfs/dbraw/zinc/32/65/08/175326508.db2.gz FTTLQTZFHDDKAP-UHFFFAOYSA-N 1 2 243.310 2.430 20 0 BEADLO COc1ccccc1C[NH2+]Cc1nccs1 ZINC000022864311 175329753 /nfs/dbraw/zinc/32/97/53/175329753.db2.gz FYSSYLHHTALWSH-UHFFFAOYSA-N 1 2 234.324 2.442 20 0 BEADLO COc1ccccc1CNc1cc(C)[nH+]cn1 ZINC000040727004 175331641 /nfs/dbraw/zinc/33/16/41/175331641.db2.gz VYYDAFALWUKOME-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO COc1ccccc1[C@@H](C)[NH2+]Cc1nccn1C ZINC000049856601 175346062 /nfs/dbraw/zinc/34/60/62/175346062.db2.gz XZUQIWDIDKWFMR-LLVKDONJSA-N 1 2 245.326 2.280 20 0 BEADLO COc1ccccc1[C@H](C)[NH2+]Cc1nonc1C ZINC000149198310 175352307 /nfs/dbraw/zinc/35/23/07/175352307.db2.gz AEVGYLZVHCYSBS-VIFPVBQESA-N 1 2 247.298 2.237 20 0 BEADLO COc1ccncc1C[NH2+][C@@H](C)c1nccs1 ZINC000287911443 175372538 /nfs/dbraw/zinc/37/25/38/175372538.db2.gz VNQGZJSBJLTTIY-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO COc1cc[nH+]cc1CS[C@H](C)C(C)=O ZINC000286579064 175372767 /nfs/dbraw/zinc/37/27/67/175372767.db2.gz RGUHPRMNZDDKOS-SECBINFHSA-N 1 2 225.313 2.301 20 0 BEADLO COc1cc[nH+]cc1CSc1nccn1C ZINC000286420440 175372919 /nfs/dbraw/zinc/37/29/19/175372919.db2.gz DBWZEDACQCFPJV-UHFFFAOYSA-N 1 2 235.312 2.116 20 0 BEADLO COc1cc[nH+]cc1COC(=O)[C@@H]1CC1(C)C ZINC000286854942 175372978 /nfs/dbraw/zinc/37/29/78/175372978.db2.gz BJRVTPDUENZGJK-JTQLQIEISA-N 1 2 235.283 2.180 20 0 BEADLO COc1cc[nH+]cc1COC(=O)C1CCCC1 ZINC000287074865 175373740 /nfs/dbraw/zinc/37/37/40/175373740.db2.gz KJDYOADKSSMALI-UHFFFAOYSA-N 1 2 235.283 2.324 20 0 BEADLO COc1cc[nH+]cc1NC(=O)CCC1CC1 ZINC000115049664 175375265 /nfs/dbraw/zinc/37/52/65/175375265.db2.gz CGNDACJXHWJLPQ-UHFFFAOYSA-N 1 2 220.272 2.219 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@H](C)C(C)(F)F ZINC000293475871 175375621 /nfs/dbraw/zinc/37/56/21/175375621.db2.gz RMBPJCXSBRZQBD-ZETCQYMHSA-N 1 2 244.241 2.320 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C[C@@H]1C=CCC1 ZINC000299502870 175375667 /nfs/dbraw/zinc/37/56/67/175375667.db2.gz QVEMINVQXHBCHQ-SNVBAGLBSA-N 1 2 232.283 2.385 20 0 BEADLO COc1cc[nH+]cc1NC[C@@H]1CCSC1 ZINC000278298216 175376135 /nfs/dbraw/zinc/37/61/35/175376135.db2.gz BYVLUJRRMNJYBI-VIFPVBQESA-N 1 2 224.329 2.255 20 0 BEADLO COc1ccsc1C[N@@H+]1C[C@@H](C)OC[C@@H]1C ZINC000271082320 175378293 /nfs/dbraw/zinc/37/82/93/175378293.db2.gz WYRHBEDYBJQTJB-VHSXEESVSA-N 1 2 241.356 2.366 20 0 BEADLO COc1ccsc1C[N@H+]1C[C@@H](C)OC[C@@H]1C ZINC000271082320 175378294 /nfs/dbraw/zinc/37/82/94/175378294.db2.gz WYRHBEDYBJQTJB-VHSXEESVSA-N 1 2 241.356 2.366 20 0 BEADLO COc1cncc(C[N@@H+]2CCC[C@](C)(F)C2)c1 ZINC000295405370 175385534 /nfs/dbraw/zinc/38/55/34/175385534.db2.gz MJEQHVPJOFEUIT-ZDUSSCGKSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cncc(C[N@H+]2CCC[C@](C)(F)C2)c1 ZINC000295405370 175385535 /nfs/dbraw/zinc/38/55/35/175385535.db2.gz MJEQHVPJOFEUIT-ZDUSSCGKSA-N 1 2 238.306 2.414 20 0 BEADLO C[C@@H](CF)[NH2+]Cc1ccn(-c2ccccc2)n1 ZINC000288508792 175693620 /nfs/dbraw/zinc/69/36/20/175693620.db2.gz STJSPHMHWPWZFD-NSHDSACASA-N 1 2 233.290 2.320 20 0 BEADLO c1cn(CCCc2nc(C3CCC3)no2)c[nH+]1 ZINC000680696359 487632032 /nfs/dbraw/zinc/63/20/32/487632032.db2.gz ZZZMHFCUSNUPKZ-UHFFFAOYSA-N 1 2 232.287 2.166 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1cccs1)c1ncn(C)n1 ZINC000275663343 175921691 /nfs/dbraw/zinc/92/16/91/175921691.db2.gz GFWODZBTKLHJKA-RKDXNWHRSA-N 1 2 236.344 2.288 20 0 BEADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1cnns1 ZINC000290131678 176019206 /nfs/dbraw/zinc/01/92/06/176019206.db2.gz VBBCISFAWYBPQM-VIFPVBQESA-N 1 2 249.339 2.437 20 0 BEADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1cnns1 ZINC000290131678 176019207 /nfs/dbraw/zinc/01/92/07/176019207.db2.gz VBBCISFAWYBPQM-VIFPVBQESA-N 1 2 249.339 2.437 20 0 BEADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1ccno1 ZINC000271477423 176028484 /nfs/dbraw/zinc/02/84/84/176028484.db2.gz GSFLLKSCSQHDLG-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1ccno1 ZINC000271477423 176028486 /nfs/dbraw/zinc/02/84/86/176028486.db2.gz GSFLLKSCSQHDLG-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@@H](c1ccco1)[N@H+](C)Cc1cc[nH]n1 ZINC000131143825 176031320 /nfs/dbraw/zinc/03/13/20/176031320.db2.gz RDOXKCXCVUZLED-VIFPVBQESA-N 1 2 205.261 2.196 20 0 BEADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1cc[nH]n1 ZINC000131143825 176031322 /nfs/dbraw/zinc/03/13/22/176031322.db2.gz RDOXKCXCVUZLED-VIFPVBQESA-N 1 2 205.261 2.196 20 0 BEADLO C[C@@H](c1ccncc1)N(C)Cc1c[nH+]cn1C ZINC000179259495 176034985 /nfs/dbraw/zinc/03/49/85/176034985.db2.gz SDGQPMUAWZYHCB-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H]1CCCN1C(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000333227590 176105474 /nfs/dbraw/zinc/10/54/74/176105474.db2.gz XKCJOXFVAUJZFD-MXWKQRLJSA-N 1 2 248.330 2.083 20 0 BEADLO C[C@@H]1CCC[C@@H](CNC(=O)CCc2[nH]cc[nH+]2)C1 ZINC000287363519 176118962 /nfs/dbraw/zinc/11/89/62/176118962.db2.gz YONSZYGBUFASNX-VXGBXAGGSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)CCc2[nH]cc[nH+]2)[C@@H]1C ZINC000279213485 176121532 /nfs/dbraw/zinc/12/15/32/176121532.db2.gz MSOATDINGRWLDZ-IJLUTSLNSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CCC[C@H](CNC(=O)CCc2[nH]cc[nH+]2)C1 ZINC000287363511 176138215 /nfs/dbraw/zinc/13/82/15/176138215.db2.gz YONSZYGBUFASNX-NEPJUHHUSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1CCC[C@H]1NC(=O)c1ccc2[nH+]ccn2c1 ZINC000264394446 176149476 /nfs/dbraw/zinc/14/94/76/176149476.db2.gz TWQPTLJNNGKWCQ-ZYHUDNBSSA-N 1 2 243.310 2.253 20 0 BEADLO C[C@@H]1CC[C@@H](CC(=O)N(C)Cc2[nH+]ccn2C)C1 ZINC000268299931 176201513 /nfs/dbraw/zinc/20/15/13/176201513.db2.gz XQGSXQNZPURHSB-VXGBXAGGSA-N 1 2 249.358 2.205 20 0 BEADLO C[C@H]1CC[C@H](NC(=O)CCc2c[nH+]c[nH]2)CC1 ZINC000249105164 176210104 /nfs/dbraw/zinc/21/01/04/176210104.db2.gz PDKKCJRCQVVUSN-XYPYZODXSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H]1CC[C@H](NC(=O)CCc2c[nH]c[nH+]2)CC1 ZINC000249105164 176210106 /nfs/dbraw/zinc/21/01/06/176210106.db2.gz PDKKCJRCQVVUSN-XYPYZODXSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H]1CC[C@@H](NC(=O)CCc2c[nH+]c[nH]2)[C@H](C)C1 ZINC000193254737 176210665 /nfs/dbraw/zinc/21/06/65/176210665.db2.gz VAJRNFSZXOTYIM-NQBHXWOUSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CC[C@@H](NC(=O)CCc2c[nH]c[nH+]2)[C@H](C)C1 ZINC000193254737 176210666 /nfs/dbraw/zinc/21/06/66/176210666.db2.gz VAJRNFSZXOTYIM-NQBHXWOUSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1C[N@H+](CC2=Cc3ccccc3OC2)CCO1 ZINC000179864299 176286420 /nfs/dbraw/zinc/28/64/20/176286420.db2.gz WQOSWUXLRVVEGM-GFCCVEGCSA-N 1 2 245.322 2.183 20 0 BEADLO C[C@@H]1C[N@@H+](CC2=Cc3ccccc3OC2)CCO1 ZINC000179864299 176286421 /nfs/dbraw/zinc/28/64/21/176286421.db2.gz WQOSWUXLRVVEGM-GFCCVEGCSA-N 1 2 245.322 2.183 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cscn2)CCS1 ZINC000171691895 176310448 /nfs/dbraw/zinc/31/04/48/176310448.db2.gz XJVGAWWELSVYIQ-MRVPVSSYSA-N 1 2 214.359 2.080 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cscn2)CCS1 ZINC000171691895 176310449 /nfs/dbraw/zinc/31/04/49/176310449.db2.gz XJVGAWWELSVYIQ-MRVPVSSYSA-N 1 2 214.359 2.080 20 0 BEADLO C[C@@H]1C[NH+](Cc2nc(C(F)F)no2)C[C@H]1C ZINC000335101014 176312744 /nfs/dbraw/zinc/31/27/44/176312744.db2.gz VLIYMUQGPMDXJN-RNFRBKRXSA-N 1 2 231.246 2.095 20 0 BEADLO C[C@@H]1C[N@H+](Cc2scnc2C2CC2)CCO1 ZINC000335150883 176313477 /nfs/dbraw/zinc/31/34/77/176313477.db2.gz AAEIZMQBIQMJIR-SECBINFHSA-N 1 2 238.356 2.241 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2scnc2C2CC2)CCO1 ZINC000335150883 176313478 /nfs/dbraw/zinc/31/34/78/176313478.db2.gz AAEIZMQBIQMJIR-SECBINFHSA-N 1 2 238.356 2.241 20 0 BEADLO C[C@@H]1CN(c2[nH]c3ccccc3[nH+]2)CCCO1 ZINC000179289847 176320834 /nfs/dbraw/zinc/32/08/34/176320834.db2.gz WOAREHZELVVXJH-SNVBAGLBSA-N 1 2 231.299 2.178 20 0 BEADLO C[C@@H]1CN(c2[nH+]c3ccccc3n2C)CCCO1 ZINC000179289816 176320853 /nfs/dbraw/zinc/32/08/53/176320853.db2.gz KDYJWPNEFRKQRM-LLVKDONJSA-N 1 2 245.326 2.189 20 0 BEADLO C[C@@H]1COc2ccccc2C[N@@H+]1Cc1cocn1 ZINC000277682973 176348610 /nfs/dbraw/zinc/34/86/10/176348610.db2.gz QJGCGXAWZINBET-LLVKDONJSA-N 1 2 244.294 2.458 20 0 BEADLO C[C@@H]1COc2ccccc2C[N@H+]1Cc1cocn1 ZINC000277682973 176348611 /nfs/dbraw/zinc/34/86/11/176348611.db2.gz QJGCGXAWZINBET-LLVKDONJSA-N 1 2 244.294 2.458 20 0 BEADLO C[C@@H]1CSCC[N@@H+]1Cc1cc(F)ncc1F ZINC000294864643 176351274 /nfs/dbraw/zinc/35/12/74/176351274.db2.gz PTOLFFXPVAUTPA-MRVPVSSYSA-N 1 2 244.310 2.297 20 0 BEADLO C[C@@H]1CSCC[N@H+]1Cc1cc(F)ncc1F ZINC000294864643 176351275 /nfs/dbraw/zinc/35/12/75/176351275.db2.gz PTOLFFXPVAUTPA-MRVPVSSYSA-N 1 2 244.310 2.297 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1cn(-c2ccccc2)nn1 ZINC000336565526 176363664 /nfs/dbraw/zinc/36/36/64/176363664.db2.gz PZLBMYAMPNAOHG-VXGBXAGGSA-N 1 2 242.326 2.250 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1cc(C(F)(F)F)n[nH]1 ZINC000335702701 176364097 /nfs/dbraw/zinc/36/40/97/176364097.db2.gz ATFKDQDXRTYLIA-RNFRBKRXSA-N 1 2 233.237 2.411 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)NC2CCCC2)c2[nH+]ccn21 ZINC000333880548 176373466 /nfs/dbraw/zinc/37/34/66/176373466.db2.gz WFPJDWMMMKHCDU-MWLCHTKSSA-N 1 2 248.330 2.131 20 0 BEADLO C[C@@H]1C[C@@H]1CNc1ccc(N(C)C)c[nH+]1 ZINC000309104920 176397526 /nfs/dbraw/zinc/39/75/26/176397526.db2.gz HONVWVCKTDYUFH-NXEZZACHSA-N 1 2 205.305 2.216 20 0 BEADLO C[C@@H]1C[C@@H]1C[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000277200550 176397842 /nfs/dbraw/zinc/39/78/42/176397842.db2.gz JLIYHBVCZAQGKP-RTXFEEFZSA-N 1 2 242.326 2.140 20 0 BEADLO C[C@@H]1OCC[C@H]1Nc1ccc([NH+](C)C)cc1 ZINC000134086147 176481563 /nfs/dbraw/zinc/48/15/63/176481563.db2.gz CVTSBAJUQSYEHV-GXFFZTMASA-N 1 2 220.316 2.342 20 0 BEADLO C[C@H]([NH2+][C@H]1CCn2ccnc21)c1ccccn1 ZINC000345355663 176928702 /nfs/dbraw/zinc/92/87/02/176928702.db2.gz SVTDCUYMBSBRFE-JQWIXIFHSA-N 1 2 228.299 2.074 20 0 BEADLO C[C@H](O)c1cc(NCc2c[nH+]cn2C)ccc1F ZINC000285389739 177016569 /nfs/dbraw/zinc/01/65/69/177016569.db2.gz DFBMOLWTZJZDKQ-VIFPVBQESA-N 1 2 249.289 2.225 20 0 BEADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1cnc[nH]1 ZINC000093315686 177037283 /nfs/dbraw/zinc/03/72/83/177037283.db2.gz DMFRNXUEDULGEY-SNVBAGLBSA-N 1 2 231.299 2.308 20 0 BEADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1cnc[nH]1 ZINC000093315686 177037284 /nfs/dbraw/zinc/03/72/84/177037284.db2.gz DMFRNXUEDULGEY-SNVBAGLBSA-N 1 2 231.299 2.308 20 0 BEADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1c[nH]cn1 ZINC000093315686 177037287 /nfs/dbraw/zinc/03/72/87/177037287.db2.gz DMFRNXUEDULGEY-SNVBAGLBSA-N 1 2 231.299 2.308 20 0 BEADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1c[nH]cn1 ZINC000093315686 177037289 /nfs/dbraw/zinc/03/72/89/177037289.db2.gz DMFRNXUEDULGEY-SNVBAGLBSA-N 1 2 231.299 2.308 20 0 BEADLO C[C@H](c1cccnc1)[N@H+](C)Cc1ccon1 ZINC000150871235 177045435 /nfs/dbraw/zinc/04/54/35/177045435.db2.gz FEJZKKHVXONHKG-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1ccon1 ZINC000150871235 177045438 /nfs/dbraw/zinc/04/54/38/177045438.db2.gz FEJZKKHVXONHKG-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H]1CC(NC(=O)C=Cc2c[nH]c[nH+]2)C[C@H](C)C1 ZINC000284172186 177064869 /nfs/dbraw/zinc/06/48/69/177064869.db2.gz XVKDBZJRDJEBBY-YIZUVKHSSA-N 1 2 247.342 2.364 20 0 BEADLO C[C@H]1CC2(CCC2)CN1C(=O)CCn1cc[nH+]c1 ZINC000336574080 177067567 /nfs/dbraw/zinc/06/75/67/177067567.db2.gz PBAYABARZAIFGV-LBPRGKRZSA-N 1 2 247.342 2.064 20 0 BEADLO C[C@H]1CCCC[C@H]1CNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000283532789 177084914 /nfs/dbraw/zinc/08/49/14/177084914.db2.gz RMQXKEVXHSDSPR-KZQRZKTQSA-N 1 2 247.342 2.365 20 0 BEADLO C[C@H]1CCCN1c1cc(NCC2CC2)[nH+]cn1 ZINC000112074917 177112077 /nfs/dbraw/zinc/11/20/77/177112077.db2.gz DBXNOLQXJVZIAT-JTQLQIEISA-N 1 2 232.331 2.287 20 0 BEADLO C[C@H]1CCCN1c1cc(NCC2CC2)nc[nH+]1 ZINC000112074917 177112079 /nfs/dbraw/zinc/11/20/79/177112079.db2.gz DBXNOLQXJVZIAT-JTQLQIEISA-N 1 2 232.331 2.287 20 0 BEADLO C[C@@H]1CCC[C@H](C)[C@H]1NC(=O)CCc1c[nH+]c[nH]1 ZINC000249083806 177116869 /nfs/dbraw/zinc/11/68/69/177116869.db2.gz IDHVBTHKKBUEQO-YABSGUDNSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CCC[C@H](C)[C@H]1NC(=O)CCc1c[nH]c[nH+]1 ZINC000249083806 177116872 /nfs/dbraw/zinc/11/68/72/177116872.db2.gz IDHVBTHKKBUEQO-YABSGUDNSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H]1CCC[C@@H](CC(=O)NCc2[nH]cc[nH+]2)C1 ZINC000114335526 177118581 /nfs/dbraw/zinc/11/85/81/177118581.db2.gz IHWNKGJJVBFPSL-WDEREUQCSA-N 1 2 235.331 2.242 20 0 BEADLO C[C@H]1CCC[C@@H](CNC(=O)CCn2cc[nH+]c2)C1 ZINC000338052617 177119732 /nfs/dbraw/zinc/11/97/32/177119732.db2.gz QABSIQAWSVTQJI-QWHCGFSZSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@H]1CCC[C@H](C)C1NC(=O)CCc1[nH]cc[nH+]1 ZINC000289338460 177129403 /nfs/dbraw/zinc/12/94/03/177129403.db2.gz ZFMFNFHFQAWQAU-QWRGUYRKSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H]1CC[C@@H]([NH2+]c2ccc(-n3cnnn3)cc2)C1 ZINC000080427170 177194160 /nfs/dbraw/zinc/19/41/60/177194160.db2.gz VJQAHMLQZAINEC-CMPLNLGQSA-N 1 2 243.314 2.263 20 0 BEADLO C[C@H]1C[NH+](Cc2cccc(Cl)n2)C[C@H](C)O1 ZINC000085696682 177264223 /nfs/dbraw/zinc/26/42/23/177264223.db2.gz JCKOISLJLUDFIC-UWVGGRQHSA-N 1 2 240.734 2.344 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccccc2OC2CC2)CCO1 ZINC000289272155 177266347 /nfs/dbraw/zinc/26/63/47/177266347.db2.gz FFLVPELCFYGIOF-LBPRGKRZSA-N 1 2 247.338 2.449 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccccc2OC2CC2)CCO1 ZINC000289272155 177266349 /nfs/dbraw/zinc/26/63/49/177266349.db2.gz FFLVPELCFYGIOF-LBPRGKRZSA-N 1 2 247.338 2.449 20 0 BEADLO C[C@H]1C[N@H+](Cc2nnc(-c3ccco3)o2)[C@H]1C ZINC000293043561 177271681 /nfs/dbraw/zinc/27/16/81/177271681.db2.gz QXOBHCAZMNJYKH-IUCAKERBSA-N 1 2 233.271 2.170 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nnc(-c3ccco3)o2)[C@H]1C ZINC000293043561 177271682 /nfs/dbraw/zinc/27/16/82/177271682.db2.gz QXOBHCAZMNJYKH-IUCAKERBSA-N 1 2 233.271 2.170 20 0 BEADLO C[C@H]1C[N@H+](Cc2nnc(C3CC3)n2C2CC2)[C@H]1C ZINC000339572849 177272211 /nfs/dbraw/zinc/27/22/11/177272211.db2.gz YZZICTICTRNNLQ-UWVGGRQHSA-N 1 2 246.358 2.331 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nnc(C3CC3)n2C2CC2)[C@H]1C ZINC000339572849 177272212 /nfs/dbraw/zinc/27/22/12/177272212.db2.gz YZZICTICTRNNLQ-UWVGGRQHSA-N 1 2 246.358 2.331 20 0 BEADLO C[C@H]1CN(c2[nH+]c3ccccc3n2C)CCCO1 ZINC000179289831 177277860 /nfs/dbraw/zinc/27/78/60/177277860.db2.gz KDYJWPNEFRKQRM-NSHDSACASA-N 1 2 245.326 2.189 20 0 BEADLO C[C@H]1CSCC[N@@H+]1Cc1ncc(C2CC2)o1 ZINC000270607930 177304652 /nfs/dbraw/zinc/30/46/52/177304652.db2.gz MTDGPEIIISVFQX-VIFPVBQESA-N 1 2 238.356 2.489 20 0 BEADLO C[C@H]1CSCC[N@H+]1Cc1ncc(C2CC2)o1 ZINC000270607930 177304654 /nfs/dbraw/zinc/30/46/54/177304654.db2.gz MTDGPEIIISVFQX-VIFPVBQESA-N 1 2 238.356 2.489 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1cn(-c2ccccc2)nn1 ZINC000336565525 177319644 /nfs/dbraw/zinc/31/96/44/177319644.db2.gz PZLBMYAMPNAOHG-TXEJJXNPSA-N 1 2 242.326 2.250 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1cn(-c2ccccc2)nn1 ZINC000336565525 177319646 /nfs/dbraw/zinc/31/96/46/177319646.db2.gz PZLBMYAMPNAOHG-TXEJJXNPSA-N 1 2 242.326 2.250 20 0 BEADLO C[C@H]1C[C@@H](NCc2cscn2)c2[nH+]ccn21 ZINC000345345019 177333855 /nfs/dbraw/zinc/33/38/55/177333855.db2.gz BKNFOYGAADFFFB-WCBMZHEXSA-N 1 2 234.328 2.135 20 0 BEADLO C[C@H]1C[C@@H]1c1ccc(C[NH+]2CCOCC2)o1 ZINC000154508472 177351618 /nfs/dbraw/zinc/35/16/18/177351618.db2.gz SXUPWQQWIVCMKT-JQWIXIFHSA-N 1 2 221.300 2.235 20 0 BEADLO C[C@@H]1CC[C@@H](NC(=O)CCc2c[nH+]c[nH]2)[C@@H](C)C1 ZINC000249152005 177357122 /nfs/dbraw/zinc/35/71/22/177357122.db2.gz VAJRNFSZXOTYIM-NTZNESFSSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CC[C@@H](NC(=O)CCc2c[nH]c[nH+]2)[C@@H](C)C1 ZINC000249152005 177357124 /nfs/dbraw/zinc/35/71/24/177357124.db2.gz VAJRNFSZXOTYIM-NTZNESFSSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1nccn1C(F)F ZINC000335818239 177360222 /nfs/dbraw/zinc/36/02/22/177360222.db2.gz NVBQOMNFHCKBOK-YUMQZZPRSA-N 1 2 215.247 2.261 20 0 BEADLO C[C@H]1C[C@H](NC(=O)NC2CCCC2)c2[nH+]ccn21 ZINC000333880549 177367168 /nfs/dbraw/zinc/36/71/68/177367168.db2.gz WFPJDWMMMKHCDU-ONGXEEELSA-N 1 2 248.330 2.131 20 0 BEADLO C[C@H]1C[C@H]([NH2+]Cc2ccoc2)c2nccn21 ZINC000293853267 177370694 /nfs/dbraw/zinc/37/06/94/177370694.db2.gz CVCOGGMHUDVCEZ-ONGXEEELSA-N 1 2 217.272 2.272 20 0 BEADLO C[C@H]1C[C@H](NCc2cscn2)c2[nH+]ccn21 ZINC000345345021 177371344 /nfs/dbraw/zinc/37/13/44/177371344.db2.gz BKNFOYGAADFFFB-WPRPVWTQSA-N 1 2 234.328 2.135 20 0 BEADLO C[C@@H]1C[C@@H]1CNc1cc(NC[C@@H]2C[C@@H]2C)nc[nH+]1 ZINC000357314257 177381769 /nfs/dbraw/zinc/38/17/69/177381769.db2.gz LLNWTMGKRLUQJI-BKUVIOGVSA-N 1 2 246.358 2.034 20 0 BEADLO C[C@@H]1C[C@@H]1CNc1cc(NC[C@@H]2C[C@@H]2C)[nH+]cn1 ZINC000357314257 177381771 /nfs/dbraw/zinc/38/17/71/177381771.db2.gz LLNWTMGKRLUQJI-BKUVIOGVSA-N 1 2 246.358 2.034 20 0 BEADLO Cc1ccc(Cc2noc([C@H]3C[C@H]3C)n2)c[nH+]1 ZINC000680712792 487638569 /nfs/dbraw/zinc/63/85/69/487638569.db2.gz MXTMXDGDMUODRO-KCJUWKMLSA-N 1 2 229.283 2.487 20 0 BEADLO CCc1[nH]c(CNC(=O)C[C@@H]2CC[C@H](C)C2)c[nH+]1 ZINC001652464151 1173085906 /nfs/dbraw/zinc/08/59/06/1173085906.db2.gz VOZSITWNEPMGTC-WDEREUQCSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)C[C@@H]2CC[C@H](C)C2)[nH+]1 ZINC001652464151 1173085912 /nfs/dbraw/zinc/08/59/12/1173085912.db2.gz VOZSITWNEPMGTC-WDEREUQCSA-N 1 2 249.358 2.415 20 0 BEADLO Cc1cc(C[NH+]2Cc3ccccc3C2)nn1C ZINC000487381697 225302750 /nfs/dbraw/zinc/30/27/50/225302750.db2.gz YDHKHHJTLYJVKE-UHFFFAOYSA-N 1 2 227.311 2.244 20 0 BEADLO COCCSCCC[N@@H+]1CCC(F)(F)C1 ZINC000488103557 225347301 /nfs/dbraw/zinc/34/73/01/225347301.db2.gz KWKOEDLTSSPSTG-UHFFFAOYSA-N 1 2 239.331 2.097 20 0 BEADLO COCCSCCC[N@H+]1CCC(F)(F)C1 ZINC000488103557 225347303 /nfs/dbraw/zinc/34/73/03/225347303.db2.gz KWKOEDLTSSPSTG-UHFFFAOYSA-N 1 2 239.331 2.097 20 0 BEADLO C/C=C\C[S@](=O)Cc1cn2cccc(C)c2[nH+]1 ZINC000255519601 322933266 /nfs/dbraw/zinc/93/32/66/322933266.db2.gz WAFPWHGBUZEUJH-LIMHQNJXSA-N 1 2 248.351 2.468 20 0 BEADLO FC(F)C1(NCc2c[nH+]c3ccccn23)CC1 ZINC000669686707 487648027 /nfs/dbraw/zinc/64/80/27/487648027.db2.gz XVXRUUQJSPTASQ-UHFFFAOYSA-N 1 2 237.253 2.222 20 0 BEADLO C[C@@H]1CC[C@@H](N(C)C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492761516 226047149 /nfs/dbraw/zinc/04/71/49/226047149.db2.gz GLYSIONMQYCTNJ-INCYKZHSSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@H]1CN(C(=O)C=Cc2c[nH]c[nH+]2)C(C)(C)C1 ZINC000492761236 226048030 /nfs/dbraw/zinc/04/80/30/226048030.db2.gz FZVFEEMWYBHROB-UMCURTJPSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@@H]1CC[C@@H](N(C)C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492761517 226048148 /nfs/dbraw/zinc/04/81/48/226048148.db2.gz GLYSIONMQYCTNJ-QQHVKIJGSA-N 1 2 233.315 2.070 20 0 BEADLO Cc1cscc1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492812464 226058265 /nfs/dbraw/zinc/05/82/65/226058265.db2.gz MVGWPCDEGOWCDT-NSCUHMNNSA-N 1 2 233.296 2.432 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)C=Cc2c[nH]c[nH+]2)[C@@H](C)C1 ZINC000492815710 226060856 /nfs/dbraw/zinc/06/08/56/226060856.db2.gz XPISVJSKZSMGKA-JMPPTMAVSA-N 1 2 247.342 2.364 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)NC1(C2CCC2)CCC1 ZINC000493019645 226105670 /nfs/dbraw/zinc/10/56/70/226105670.db2.gz KMXAVCDNOVDGRG-WAYWQWQTSA-N 1 2 245.326 2.262 20 0 BEADLO C[C@H]1CN(C(=O)/C=C/c2[nH]cc[nH+]2)CC(C)(C)C1 ZINC000493111063 226129649 /nfs/dbraw/zinc/12/96/49/226129649.db2.gz BHYRMCIAFVRJKB-SGUJLRQBSA-N 1 2 247.342 2.318 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)/C=C/c2[nH]cc[nH+]2)[C@H](C)C1 ZINC000493181945 226146700 /nfs/dbraw/zinc/14/67/00/226146700.db2.gz CQDATUSFRFAIDP-QEPQOOGFSA-N 1 2 247.342 2.364 20 0 BEADLO Cc1cc(C)nc(NC(=O)C=Cc2c[nH]c[nH+]2)c1 ZINC000493238030 226163403 /nfs/dbraw/zinc/16/34/03/226163403.db2.gz KBGLWVKKQWVEFN-ARJAWSKDSA-N 1 2 242.282 2.073 20 0 BEADLO C[C@H](N(C)C(=O)C=Cc1c[nH]c[nH+]1)C1(C)CC1 ZINC000493380396 226199798 /nfs/dbraw/zinc/19/97/98/226199798.db2.gz FPUZUYSNYVKSFJ-YEZKRMTDSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@H](c1ccco1)N(C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493448195 226218285 /nfs/dbraw/zinc/21/82/85/226218285.db2.gz HZPQICBNVCTHJB-BRAIEQGRSA-N 1 2 245.282 2.236 20 0 BEADLO Cc1cc(NC(=O)C=Cc2c[nH]c[nH+]2)ccc1O ZINC000493494233 226233090 /nfs/dbraw/zinc/23/30/90/226233090.db2.gz UBJHJTHKCFOJRA-HYXAFXHYSA-N 1 2 243.266 2.076 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1C[C@@H]2CCCC[C@@H]2C1 ZINC000493517211 226238157 /nfs/dbraw/zinc/23/81/57/226238157.db2.gz FQAFDDGKRUXJQD-DLXAAPBESA-N 1 2 245.326 2.072 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)Nc1cccc(F)c1 ZINC000493557210 226243361 /nfs/dbraw/zinc/24/33/61/226243361.db2.gz OTOJHAVOIUUGJY-SNAWJCMRSA-N 1 2 231.230 2.201 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)N(CC1CC1)CC1CC1 ZINC000493610145 226245845 /nfs/dbraw/zinc/24/58/45/226245845.db2.gz JLXJVGFZBZEBMI-AATRIKPKSA-N 1 2 245.326 2.072 20 0 BEADLO O=C(/C=C\c1[nH]cc[nH+]1)N(C1CC1)C1CCCC1 ZINC000493613005 226245937 /nfs/dbraw/zinc/24/59/37/226245937.db2.gz FUOZFRTYMUJPDT-FPLPWBNLSA-N 1 2 245.326 2.357 20 0 BEADLO C[C@@H]1CCCC[C@@H]1CNC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493694830 226249648 /nfs/dbraw/zinc/24/96/48/226249648.db2.gz OYSAZWDENCONGW-BYAJROORSA-N 1 2 247.342 2.365 20 0 BEADLO CN(C(=O)C=Cc1c[nH]c[nH+]1)C(C1CC1)C1CC1 ZINC000493696944 226249785 /nfs/dbraw/zinc/24/97/85/226249785.db2.gz UQMXRGGZZIOWHO-VOTSOKGWSA-N 1 2 245.326 2.070 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)OC2CCC2)c2[nH+]ccn21 ZINC000496828902 226315175 /nfs/dbraw/zinc/31/51/75/226315175.db2.gz PVYHDOOANXHNLV-SCZZXKLOSA-N 1 2 235.287 2.168 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)OCC2CC2)c2[nH+]ccn21 ZINC000497104367 226322546 /nfs/dbraw/zinc/32/25/46/226322546.db2.gz BQULKPMGCQLEEF-SCZZXKLOSA-N 1 2 235.287 2.025 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)OCC2CC2)c2[nH+]ccn21 ZINC000497104368 226322579 /nfs/dbraw/zinc/32/25/79/226322579.db2.gz BQULKPMGCQLEEF-WCBMZHEXSA-N 1 2 235.287 2.025 20 0 BEADLO c1ccc2[nH]c(=[NH+]CCC[C@@H]3CCOC3)[nH]c2c1 ZINC000402021378 226364254 /nfs/dbraw/zinc/36/42/54/226364254.db2.gz FHNGZAUWSQTRKA-LLVKDONJSA-N 1 2 245.326 2.213 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)OC1CCC1 ZINC000495865742 226290642 /nfs/dbraw/zinc/29/06/42/226290642.db2.gz BRBHAOCWWPAGFA-VIFPVBQESA-N 1 2 237.303 2.243 20 0 BEADLO C[C@H]([NH2+][C@@H](C)C(F)F)c1cccnc1 ZINC000228483490 487656724 /nfs/dbraw/zinc/65/67/24/487656724.db2.gz YGNASSQUHAMFFZ-YUMQZZPRSA-N 1 2 200.232 2.386 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)C(F)F)c1ccncc1 ZINC000228482548 487656794 /nfs/dbraw/zinc/65/67/94/487656794.db2.gz NJIUIJWKHHNXAZ-SFYZADRCSA-N 1 2 200.232 2.386 20 0 BEADLO CO[C@@H](CC(C)C)C[N@H+]1CC[C@@H]1C(F)F ZINC000895432051 583670993 /nfs/dbraw/zinc/67/09/93/583670993.db2.gz TZQIPIOCLRYNGG-VHSXEESVSA-N 1 2 221.291 2.387 20 0 BEADLO O=C(CCn1cc[nH+]c1)N(C1CC1)C1CCCC1 ZINC000557450071 322937514 /nfs/dbraw/zinc/93/75/14/322937514.db2.gz ZPPJTPMFDUHSJB-UHFFFAOYSA-N 1 2 247.342 2.207 20 0 BEADLO Cc1nc(N2C[C@@H](C)OC(C)(C)C2)c(C)c(C)[nH+]1 ZINC000174422110 229381592 /nfs/dbraw/zinc/38/15/92/229381592.db2.gz OKWAIAYILJRWLT-SECBINFHSA-N 1 2 249.358 2.406 20 0 BEADLO Cc1nsc(C)c1CN(C)Cc1[nH]cc[nH+]1 ZINC000660142206 487685394 /nfs/dbraw/zinc/68/53/94/487685394.db2.gz QWQKJIARWJGGJC-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO C[C@H]1C[N@H+](CCCCF)C[C@@H](C(F)(F)F)O1 ZINC000671683134 487688549 /nfs/dbraw/zinc/68/85/49/487688549.db2.gz DKSXMNVPVJKGRF-IUCAKERBSA-N 1 2 243.244 2.388 20 0 BEADLO C[C@H]1C[N@@H+](CCCCF)C[C@@H](C(F)(F)F)O1 ZINC000671683134 487688551 /nfs/dbraw/zinc/68/85/51/487688551.db2.gz DKSXMNVPVJKGRF-IUCAKERBSA-N 1 2 243.244 2.388 20 0 BEADLO Cc1nnsc1C[N@H+]1CCC(F)(F)C[C@H]1C ZINC000528768260 262864742 /nfs/dbraw/zinc/86/47/42/262864742.db2.gz IRLODABFFXUDKC-SSDOTTSWSA-N 1 2 247.314 2.466 20 0 BEADLO Cc1nnsc1C[N@@H+]1CCC(F)(F)C[C@H]1C ZINC000528768260 262864743 /nfs/dbraw/zinc/86/47/43/262864743.db2.gz IRLODABFFXUDKC-SSDOTTSWSA-N 1 2 247.314 2.466 20 0 BEADLO Cc1cc(N2CC(Cc3ccco3)C2)nc[nH+]1 ZINC000528154815 262907158 /nfs/dbraw/zinc/90/71/58/262907158.db2.gz AQDQEIAZLFZRSD-UHFFFAOYSA-N 1 2 229.283 2.057 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C[C@H](C)n1cccc1 ZINC000523653158 262918350 /nfs/dbraw/zinc/91/83/50/262918350.db2.gz UXSQYHVYNBTFJG-LBPRGKRZSA-N 1 2 243.310 2.203 20 0 BEADLO CCC[N@@H+]1C[C@@H](C(F)(F)F)OC[C@H]1C ZINC000671714124 487703876 /nfs/dbraw/zinc/70/38/76/487703876.db2.gz NEZYHUCOQSAECT-SFYZADRCSA-N 1 2 211.227 2.048 20 0 BEADLO CCC[N@H+]1C[C@@H](C(F)(F)F)OC[C@H]1C ZINC000671714124 487703877 /nfs/dbraw/zinc/70/38/77/487703877.db2.gz NEZYHUCOQSAECT-SFYZADRCSA-N 1 2 211.227 2.048 20 0 BEADLO Cc1occc1CNC(=O)Nc1cc[nH+]c(C)c1 ZINC000678095379 487704271 /nfs/dbraw/zinc/70/42/71/487704271.db2.gz VUZPVIZYZJLQSD-UHFFFAOYSA-N 1 2 245.282 2.035 20 0 BEADLO CCO[C@@H](C)Sc1nc(N)cc(CC)[nH+]1 ZINC000901547784 584464427 /nfs/dbraw/zinc/46/44/27/584464427.db2.gz LOAIZFWLDYWFRO-SSDOTTSWSA-N 1 2 227.333 2.096 20 0 BEADLO CCCn1nc(C)c(C[NH2+]Cc2cocn2)c1C ZINC000675342642 487714618 /nfs/dbraw/zinc/71/46/18/487714618.db2.gz FYUBTUYZKVTVLL-UHFFFAOYSA-N 1 2 248.330 2.188 20 0 BEADLO COc1cccc(CN(C)Cc2c[nH+]c[nH]2)c1F ZINC000668422131 487725387 /nfs/dbraw/zinc/72/53/87/487725387.db2.gz RECMDILDPNOMSL-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO COc1cccc(CN(C)Cc2c[nH]c[nH+]2)c1F ZINC000668422131 487725393 /nfs/dbraw/zinc/72/53/93/487725393.db2.gz RECMDILDPNOMSL-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO Nc1cccc2c1cc[nH+]c2N1CCCC1 ZINC000082753937 487725471 /nfs/dbraw/zinc/72/54/71/487725471.db2.gz CPSUKYRJYBSPCV-UHFFFAOYSA-N 1 2 213.284 2.417 20 0 BEADLO FC[C@H]1C[N@H+](CCc2ccccc2F)CCO1 ZINC000411855974 487726266 /nfs/dbraw/zinc/72/62/66/487726266.db2.gz ZSDLUSZUMXUWFN-LBPRGKRZSA-N 1 2 241.281 2.039 20 0 BEADLO FC[C@H]1C[N@@H+](CCc2ccccc2F)CCO1 ZINC000411855974 487726270 /nfs/dbraw/zinc/72/62/70/487726270.db2.gz ZSDLUSZUMXUWFN-LBPRGKRZSA-N 1 2 241.281 2.039 20 0 BEADLO CCC(CC)(CC)C(=O)NCCn1cc[nH+]c1 ZINC000675434623 487728969 /nfs/dbraw/zinc/72/89/69/487728969.db2.gz QWGSPHFNBMYYJY-UHFFFAOYSA-N 1 2 237.347 2.216 20 0 BEADLO CC(C)CCN(C)C(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000666182074 487748305 /nfs/dbraw/zinc/74/83/05/487748305.db2.gz CSEDJRIRWGURRK-VXGBXAGGSA-N 1 2 249.358 2.028 20 0 BEADLO CCc1cc(N[C@@H](CC)[C@@H](O)C(C)C)nc[nH+]1 ZINC000665749167 487754731 /nfs/dbraw/zinc/75/47/31/487754731.db2.gz TXOXHPZCEPVNAM-AAEUAGOBSA-N 1 2 237.347 2.246 20 0 BEADLO CCc1cc(N[C@@H](C)C2(OC)CCC2)nc[nH+]1 ZINC000665750763 487758802 /nfs/dbraw/zinc/75/88/02/487758802.db2.gz WNJWWADCDZCJJS-JTQLQIEISA-N 1 2 235.331 2.409 20 0 BEADLO FC(F)C[NH2+]Cc1scnc1C1CC1 ZINC000459543446 487770972 /nfs/dbraw/zinc/77/09/72/487770972.db2.gz JFBZWIYAAIBNMO-UHFFFAOYSA-N 1 2 218.272 2.375 20 0 BEADLO CC1(C)C[C@H]1[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000675877082 487785081 /nfs/dbraw/zinc/78/50/81/487785081.db2.gz BVMSZFXLQAFGBB-NEPJUHHUSA-N 1 2 242.326 2.282 20 0 BEADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1ccon1)CCO2 ZINC000675928334 487793189 /nfs/dbraw/zinc/79/31/89/487793189.db2.gz VLWHFHFJVXBKST-LBPRGKRZSA-N 1 2 248.257 2.427 20 0 BEADLO Cc1ncccc1C[NH2+][C@@H](C)C(F)F ZINC000389970105 487802058 /nfs/dbraw/zinc/80/20/58/487802058.db2.gz SUWNXZVEJIYRTM-QMMMGPOBSA-N 1 2 200.232 2.133 20 0 BEADLO Cc1cc(NC(=O)N[C@H](C(C)C)C2CC2)cc[nH+]1 ZINC000666490430 487821116 /nfs/dbraw/zinc/82/11/16/487821116.db2.gz QNEWXANZWNWFIS-CYBMUJFWSA-N 1 2 247.342 2.368 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N(C)C[C@@H]1CC1(C)C ZINC000666494743 487821433 /nfs/dbraw/zinc/82/14/33/487821433.db2.gz VZBLBLIZQSBFSF-NSHDSACASA-N 1 2 247.342 2.322 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N(C)C[C@H]1CC1(C)C ZINC000666494742 487821445 /nfs/dbraw/zinc/82/14/45/487821445.db2.gz VZBLBLIZQSBFSF-LLVKDONJSA-N 1 2 247.342 2.322 20 0 BEADLO CO[C@H]1CCC[N@H+](CC(F)(F)C(F)F)CC1 ZINC000783011618 585826920 /nfs/dbraw/zinc/82/69/20/585826920.db2.gz BLMAWZJURNMWGH-QMMMGPOBSA-N 1 2 243.244 2.388 20 0 BEADLO CO[C@H]1CCC[N@@H+](CC(F)(F)C(F)F)CC1 ZINC000783011618 585826921 /nfs/dbraw/zinc/82/69/21/585826921.db2.gz BLMAWZJURNMWGH-QMMMGPOBSA-N 1 2 243.244 2.388 20 0 BEADLO CCC[N@H+](CCF)[C@H](CC)C(=O)OCC ZINC000792374410 586000329 /nfs/dbraw/zinc/00/03/29/586000329.db2.gz ARLDEKZZEFMIQN-SNVBAGLBSA-N 1 2 219.300 2.010 20 0 BEADLO CCC[N@@H+](CCF)[C@H](CC)C(=O)OCC ZINC000792374410 586000330 /nfs/dbraw/zinc/00/03/30/586000330.db2.gz ARLDEKZZEFMIQN-SNVBAGLBSA-N 1 2 219.300 2.010 20 0 BEADLO Cc1ncc([C@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)c(C)n1 ZINC000681640158 487828894 /nfs/dbraw/zinc/82/88/94/487828894.db2.gz YSZDGJKMXINSSN-UMNHJUIQSA-N 1 2 249.358 2.264 20 0 BEADLO Cc1ncc([C@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c(C)n1 ZINC000681640158 487828900 /nfs/dbraw/zinc/82/89/00/487828900.db2.gz YSZDGJKMXINSSN-UMNHJUIQSA-N 1 2 249.358 2.264 20 0 BEADLO CSCCC[N@H+](C)Cn1ncsc1=S ZINC000799160884 586162543 /nfs/dbraw/zinc/16/25/43/586162543.db2.gz YWZOGDJFOVTGMR-UHFFFAOYSA-N 1 2 249.430 2.316 20 0 BEADLO CSCCC[N@@H+](C)Cn1ncsc1=S ZINC000799160884 586162545 /nfs/dbraw/zinc/16/25/45/586162545.db2.gz YWZOGDJFOVTGMR-UHFFFAOYSA-N 1 2 249.430 2.316 20 0 BEADLO COCC[N@@H+](CCF)Cc1occc1C ZINC000827054119 587369309 /nfs/dbraw/zinc/36/93/09/587369309.db2.gz MEQNPMBMVFNTAL-UHFFFAOYSA-N 1 2 215.268 2.006 20 0 BEADLO C[NH2+]Cc1noc([C@H]2[C@@H](C=C(C)C)C2(C)C)n1 ZINC000666572908 487833231 /nfs/dbraw/zinc/83/32/31/487833231.db2.gz VCECYPSHNFZPHI-MWLCHTKSSA-N 1 2 235.331 2.495 20 0 BEADLO CN(C/C(Cl)=C/Cl)Cc1c[nH+]c[nH]1 ZINC000852288684 588676269 /nfs/dbraw/zinc/67/62/69/588676269.db2.gz RTVFUDUTHRQBRR-UQCOIBPSSA-N 1 2 220.103 2.161 20 0 BEADLO CN(C/C(Cl)=C/Cl)Cc1c[nH]c[nH+]1 ZINC000852288684 588676270 /nfs/dbraw/zinc/67/62/70/588676270.db2.gz RTVFUDUTHRQBRR-UQCOIBPSSA-N 1 2 220.103 2.161 20 0 BEADLO O=C(NCc1c[nH+]c[nH]1)[C@H]1[C@@H]2CCCCCC[C@@H]21 ZINC000668996332 487844964 /nfs/dbraw/zinc/84/49/64/487844964.db2.gz YUVUHDOLKNCKQA-ITGUQSILSA-N 1 2 247.342 2.242 20 0 BEADLO O=C(NCc1c[nH]c[nH+]1)[C@H]1[C@@H]2CCCCCC[C@@H]21 ZINC000668996332 487844969 /nfs/dbraw/zinc/84/49/69/487844969.db2.gz YUVUHDOLKNCKQA-ITGUQSILSA-N 1 2 247.342 2.242 20 0 BEADLO CCN(C[C@@H]1CCOC1)c1cc[nH+]c(C2CC2)n1 ZINC000676491757 487856071 /nfs/dbraw/zinc/85/60/71/487856071.db2.gz KRCILVVCCJHZEU-NSHDSACASA-N 1 2 247.342 2.217 20 0 BEADLO CC1(CNc2ccc(N3CCOCC3)c[nH+]2)CC1 ZINC000558916657 322956642 /nfs/dbraw/zinc/95/66/42/322956642.db2.gz BBCLMHXVNSBXAB-UHFFFAOYSA-N 1 2 247.342 2.130 20 0 BEADLO CCc1cc(N(C)CCC2CC2)nc[nH+]1 ZINC000676566405 487875226 /nfs/dbraw/zinc/87/52/26/487875226.db2.gz GBNOXKXWKMVLCC-UHFFFAOYSA-N 1 2 205.305 2.275 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2ccsc2C)o1 ZINC000668520440 487886974 /nfs/dbraw/zinc/88/69/74/487886974.db2.gz ORIBNOFVOMPCMH-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2ccsc2C)o1 ZINC000668520440 487886979 /nfs/dbraw/zinc/88/69/79/487886979.db2.gz ORIBNOFVOMPCMH-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO CC[C@H](NC(=O)[C@@H]1CC12CCC2)c1[nH]cc[nH+]1 ZINC000682041452 487887630 /nfs/dbraw/zinc/88/76/30/487887630.db2.gz QVOIFWDDZQNQSC-UWVGGRQHSA-N 1 2 233.315 2.167 20 0 BEADLO CC1=CC[C@@](C)(C(=O)NCCc2[nH]cc[nH+]2)CC1 ZINC000668535254 487898054 /nfs/dbraw/zinc/89/80/54/487898054.db2.gz DPWQFONAIDQPJV-CQSZACIVSA-N 1 2 247.342 2.205 20 0 BEADLO Cc1nc(C[N@H+]2CCCOC[C@H]2C)cs1 ZINC000676715122 487903840 /nfs/dbraw/zinc/90/38/40/487903840.db2.gz YWXUARHKSGIPHE-SECBINFHSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1nc(C[N@@H+]2CCCOC[C@H]2C)cs1 ZINC000676715122 487903844 /nfs/dbraw/zinc/90/38/44/487903844.db2.gz YWXUARHKSGIPHE-SECBINFHSA-N 1 2 226.345 2.062 20 0 BEADLO CCC[C@H]([NH2+]CCC(C)(F)F)C(=O)OCC ZINC000357696324 487917440 /nfs/dbraw/zinc/91/74/40/487917440.db2.gz GOORMBUHHZFCNG-VIFPVBQESA-N 1 2 237.290 2.353 20 0 BEADLO C[C@@H](NC(=O)CCc1c[nH+]c[nH]1)c1ccsc1 ZINC000669919322 487924183 /nfs/dbraw/zinc/92/41/83/487924183.db2.gz UBBGIAXNNFKEHT-SECBINFHSA-N 1 2 249.339 2.281 20 0 BEADLO C[C@@H](NC(=O)CCc1c[nH]c[nH+]1)c1ccsc1 ZINC000669919322 487924188 /nfs/dbraw/zinc/92/41/88/487924188.db2.gz UBBGIAXNNFKEHT-SECBINFHSA-N 1 2 249.339 2.281 20 0 BEADLO COCc1cc(C[NH2+]Cc2ccccc2)no1 ZINC000090253574 487925628 /nfs/dbraw/zinc/92/56/28/487925628.db2.gz XTIAZEXWPSKINU-UHFFFAOYSA-N 1 2 232.283 2.111 20 0 BEADLO CCn1cc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)cn1 ZINC000679357783 487932211 /nfs/dbraw/zinc/93/22/11/487932211.db2.gz AZVCYFUGFNMEDH-PWSUYJOCSA-N 1 2 225.311 2.083 20 0 BEADLO CCn1cc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)cn1 ZINC000679357783 487932216 /nfs/dbraw/zinc/93/22/16/487932216.db2.gz AZVCYFUGFNMEDH-PWSUYJOCSA-N 1 2 225.311 2.083 20 0 BEADLO Clc1cnccc1C[N@@H+]1CCc2cn[nH]c2C1 ZINC000676798663 487933009 /nfs/dbraw/zinc/93/30/09/487933009.db2.gz VHJHECQUFDLZPX-UHFFFAOYSA-N 1 2 248.717 2.016 20 0 BEADLO Clc1cnccc1C[N@H+]1CCc2cn[nH]c2C1 ZINC000676798663 487933015 /nfs/dbraw/zinc/93/30/15/487933015.db2.gz VHJHECQUFDLZPX-UHFFFAOYSA-N 1 2 248.717 2.016 20 0 BEADLO CCc1cc[nH+]cc1NCc1cocn1 ZINC000651979501 487939119 /nfs/dbraw/zinc/93/91/19/487939119.db2.gz VTMFGWLRTKXALH-UHFFFAOYSA-N 1 2 203.245 2.244 20 0 BEADLO C1=C[C@H]2CC[C@@H](C1)[N@H+]2Cc1nnc(C2CC2)o1 ZINC000676906546 487945182 /nfs/dbraw/zinc/94/51/82/487945182.db2.gz DCXYVNKBWFUZBM-WDEREUQCSA-N 1 2 231.299 2.240 20 0 BEADLO C1=C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1nnc(C2CC2)o1 ZINC000676906546 487945186 /nfs/dbraw/zinc/94/51/86/487945186.db2.gz DCXYVNKBWFUZBM-WDEREUQCSA-N 1 2 231.299 2.240 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000667142229 487946383 /nfs/dbraw/zinc/94/63/83/487946383.db2.gz OWGPJLORJPOPIA-IRCOFANPSA-N 1 2 249.358 2.074 20 0 BEADLO C[C@@H]([NH2+]Cc1cccs1)c1csnn1 ZINC000398258878 322868064 /nfs/dbraw/zinc/86/80/64/322868064.db2.gz KFZGLHKGQZUQNA-SSDOTTSWSA-N 1 2 225.342 2.450 20 0 BEADLO C[C@H](C1CC1)[N@H+](C)Cc1nn(C)cc1Cl ZINC000561469393 323002260 /nfs/dbraw/zinc/00/22/60/323002260.db2.gz FVYJAZIDVGDERK-MRVPVSSYSA-N 1 2 227.739 2.304 20 0 BEADLO C[C@H](C1CC1)[N@@H+](C)Cc1nn(C)cc1Cl ZINC000561469393 323002261 /nfs/dbraw/zinc/00/22/61/323002261.db2.gz FVYJAZIDVGDERK-MRVPVSSYSA-N 1 2 227.739 2.304 20 0 BEADLO CC[C@@]1(C(C)C)C[C@H]1NC(=O)Cc1[nH]c[nH+]c1C ZINC000516954552 323005304 /nfs/dbraw/zinc/00/53/04/323005304.db2.gz ULJBHHHALLUVGY-OCCSQVGLSA-N 1 2 249.358 2.202 20 0 BEADLO CC[C@@]1(C(C)C)C[C@H]1NC(=O)Cc1[nH+]c[nH]c1C ZINC000516954552 323005305 /nfs/dbraw/zinc/00/53/05/323005305.db2.gz ULJBHHHALLUVGY-OCCSQVGLSA-N 1 2 249.358 2.202 20 0 BEADLO CCC(C)(C)[C@H]1CCCN1C(=O)Cn1cc[nH+]c1 ZINC000562346345 323017399 /nfs/dbraw/zinc/01/73/99/323017399.db2.gz XWKVTVIXWWATOM-GFCCVEGCSA-N 1 2 249.358 2.310 20 0 BEADLO c1nc(C[N@@H+]2CCC[C@H]2c2ccccn2)co1 ZINC000562418417 323019386 /nfs/dbraw/zinc/01/93/86/323019386.db2.gz WYKWFZVQKICEBH-ZDUSSCGKSA-N 1 2 229.283 2.407 20 0 BEADLO c1nc(C[N@H+]2CCC[C@H]2c2ccccn2)co1 ZINC000562418417 323019387 /nfs/dbraw/zinc/01/93/87/323019387.db2.gz WYKWFZVQKICEBH-ZDUSSCGKSA-N 1 2 229.283 2.407 20 0 BEADLO Cc1cnccc1C[NH2+]C1(C(F)F)CC1 ZINC000562667130 323026983 /nfs/dbraw/zinc/02/69/83/323026983.db2.gz BDIUOVWUMWAVGW-UHFFFAOYSA-N 1 2 212.243 2.277 20 0 BEADLO Cc1cc(NC(=O)[C@@]23C[C@@H]2CCC3)c(C)c[nH+]1 ZINC000562944463 323034579 /nfs/dbraw/zinc/03/45/79/323034579.db2.gz MFJVGCCJWOSRGL-FZMZJTMJSA-N 1 2 230.311 2.249 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CCC[C@@H](C)CC1 ZINC000569707246 323037915 /nfs/dbraw/zinc/03/79/15/323037915.db2.gz WRPMAAMQMRJQBJ-VXGBXAGGSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CCC[C@@H](C)CC1 ZINC000569707246 323037916 /nfs/dbraw/zinc/03/79/16/323037916.db2.gz WRPMAAMQMRJQBJ-VXGBXAGGSA-N 1 2 249.358 2.237 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)NC[C@H]3C[C@H]3C)ccn12 ZINC000569739846 323039565 /nfs/dbraw/zinc/03/95/65/323039565.db2.gz KOQMIZCNWFVBMN-BXKDBHETSA-N 1 2 243.310 2.029 20 0 BEADLO CCOC1(C)C[NH+](Cc2ccc3c(n2)CCC3)C1 ZINC000572605232 323047782 /nfs/dbraw/zinc/04/77/82/323047782.db2.gz LTXPBQUTTPGUIX-UHFFFAOYSA-N 1 2 246.354 2.181 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)NC(C)(C)C)ccn12 ZINC000570057278 323048728 /nfs/dbraw/zinc/04/87/28/323048728.db2.gz YKVBCTLKBWKJTC-UHFFFAOYSA-N 1 2 231.299 2.171 20 0 BEADLO Cc1csc(C[N@@H+]2CCC[C@@H](F)C2)n1 ZINC000570051664 323048871 /nfs/dbraw/zinc/04/88/71/323048871.db2.gz XANKHCVMOQAKTD-SECBINFHSA-N 1 2 214.309 2.385 20 0 BEADLO Cc1csc(C[N@H+]2CCC[C@@H](F)C2)n1 ZINC000570051664 323048872 /nfs/dbraw/zinc/04/88/72/323048872.db2.gz XANKHCVMOQAKTD-SECBINFHSA-N 1 2 214.309 2.385 20 0 BEADLO CC[C@@H]1CN(c2nc(C)[nH+]cc2C)C[C@H](C)O1 ZINC000570408946 323058846 /nfs/dbraw/zinc/05/88/46/323058846.db2.gz CMAFAGGRGQYNOD-CMPLNLGQSA-N 1 2 235.331 2.097 20 0 BEADLO C[C@@H]1CC[C@@H](CNc2cc(NC3CC3)nc[nH+]2)O1 ZINC000570421040 323059089 /nfs/dbraw/zinc/05/90/89/323059089.db2.gz DTPSAJJFTHWJEM-KOLCDFICSA-N 1 2 248.330 2.030 20 0 BEADLO C[C@@H]1CC[C@@H](CNc2cc(NC3CC3)[nH+]cn2)O1 ZINC000570421040 323059090 /nfs/dbraw/zinc/05/90/90/323059090.db2.gz DTPSAJJFTHWJEM-KOLCDFICSA-N 1 2 248.330 2.030 20 0 BEADLO CC(C)[C@@H]1CN(C(=O)Cn2cc[nH+]c2)[C@@H]1C(C)C ZINC000570533425 323062311 /nfs/dbraw/zinc/06/23/11/323062311.db2.gz OWGOPCBJHDJZSX-GXTWGEPZSA-N 1 2 249.358 2.022 20 0 BEADLO c1cc(C[NH2+][C@H](c2cccnc2)C2CCC2)[nH]n1 ZINC000570565989 323063025 /nfs/dbraw/zinc/06/30/25/323063025.db2.gz XODCOISSSMXWOV-AWEZNQCLSA-N 1 2 242.326 2.436 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1c(C)nsc1C ZINC000570579455 323063653 /nfs/dbraw/zinc/06/36/53/323063653.db2.gz UPQGEXMPILVRMW-LLVKDONJSA-N 1 2 240.372 2.371 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1c(C)nsc1C ZINC000570579455 323063654 /nfs/dbraw/zinc/06/36/54/323063654.db2.gz UPQGEXMPILVRMW-LLVKDONJSA-N 1 2 240.372 2.371 20 0 BEADLO C[C@H](CC(=O)Nc1ccccc1O)n1cc[nH+]c1 ZINC000570832473 323072206 /nfs/dbraw/zinc/07/22/06/323072206.db2.gz CCGNICSVOCUEKN-SNVBAGLBSA-N 1 2 245.282 2.179 20 0 BEADLO CCC1(NC(=O)C[C@H](C)n2cc[nH+]c2)CCC1 ZINC000570846682 323072667 /nfs/dbraw/zinc/07/26/67/323072667.db2.gz CHORYXGCYFPKFL-NSHDSACASA-N 1 2 235.331 2.283 20 0 BEADLO CC(C)c1nc(C[N@H+](C)CC2CC2)no1 ZINC000053611019 323077420 /nfs/dbraw/zinc/07/74/20/323077420.db2.gz HUIYOGVAZDJOEW-UHFFFAOYSA-N 1 2 209.293 2.035 20 0 BEADLO C[C@@H](c1ccccc1)[C@@H](O)C[NH2+]CC(C)(F)F ZINC000563001504 323079241 /nfs/dbraw/zinc/07/92/41/323079241.db2.gz VSRCGGSSAAQLRC-JQWIXIFHSA-N 1 2 243.297 2.396 20 0 BEADLO COc1ccc[nH+]c1NCC1(OC)CCC1 ZINC000234948138 323105694 /nfs/dbraw/zinc/10/56/94/323105694.db2.gz VTSDVYSAUARZEP-UHFFFAOYSA-N 1 2 222.288 2.071 20 0 BEADLO O=C(Nc1cc[nH+]cc1O)[C@H]1CC12CCCCC2 ZINC000531673977 323111400 /nfs/dbraw/zinc/11/14/00/323111400.db2.gz QBRXOUPIOVULKS-SNVBAGLBSA-N 1 2 246.310 2.118 20 0 BEADLO Cn1cnnc1C[N@@H+]1CCC[C@@H]1c1ccsc1 ZINC000534079029 323113426 /nfs/dbraw/zinc/11/34/26/323113426.db2.gz DZUADIWNAKDMRP-LLVKDONJSA-N 1 2 248.355 2.214 20 0 BEADLO Cn1cnnc1C[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000534079029 323113427 /nfs/dbraw/zinc/11/34/27/323113427.db2.gz DZUADIWNAKDMRP-LLVKDONJSA-N 1 2 248.355 2.214 20 0 BEADLO COCCCOc1ccccc1-n1cc[nH+]c1 ZINC000531838567 323115196 /nfs/dbraw/zinc/11/51/96/323115196.db2.gz WAJDFKZWNFBKDA-UHFFFAOYSA-N 1 2 232.283 2.288 20 0 BEADLO C[C@@H]1C[C@H](C)N(c2nc(N)c3ccccc3[nH+]2)C1 ZINC000534272776 323115340 /nfs/dbraw/zinc/11/53/40/323115340.db2.gz YIRZTOFQZYJYTI-ZJUUUORDSA-N 1 2 242.326 2.277 20 0 BEADLO CC[C@@H](C)NC(=O)Nc1cc(C)[nH+]cc1C ZINC000534323697 323116505 /nfs/dbraw/zinc/11/65/05/323116505.db2.gz AVROTJYQPIGYEN-SECBINFHSA-N 1 2 221.304 2.040 20 0 BEADLO Cc1cc(NC(=O)N2C[C@@H](C)C[C@@H]2C)c(C)c[nH+]1 ZINC000534324423 323116569 /nfs/dbraw/zinc/11/65/69/323116569.db2.gz VDKQCWXBEVNEIP-CABZTGNLSA-N 1 2 247.342 2.383 20 0 BEADLO CCCNC(=O)CCC[N@@H+]1CCC[C@@H]1C(F)F ZINC000563366331 323121418 /nfs/dbraw/zinc/12/14/18/323121418.db2.gz TXBLIATZLMBRNX-SNVBAGLBSA-N 1 2 248.317 2.022 20 0 BEADLO CCCNC(=O)CCC[N@H+]1CCC[C@@H]1C(F)F ZINC000563366331 323121419 /nfs/dbraw/zinc/12/14/19/323121419.db2.gz TXBLIATZLMBRNX-SNVBAGLBSA-N 1 2 248.317 2.022 20 0 BEADLO CCCN(C(=O)C[C@@H](C)n1cc[nH+]c1)C1CC1 ZINC000571214660 323138161 /nfs/dbraw/zinc/13/81/61/323138161.db2.gz REDKCZBSZZZANW-LLVKDONJSA-N 1 2 235.331 2.235 20 0 BEADLO CC(C)(C(=O)NCC1=CCCCC1)c1c[nH]c[nH+]1 ZINC000571375820 323142923 /nfs/dbraw/zinc/14/29/23/323142923.db2.gz VSGHGJHSYVPTCB-UHFFFAOYSA-N 1 2 247.342 2.304 20 0 BEADLO CC(C)(NC(=O)[C@@H]1CC[C@@H]2C[C@@H]2C1)c1[nH]cc[nH+]1 ZINC000571454919 323145228 /nfs/dbraw/zinc/14/52/28/323145228.db2.gz FOESNUMWYLSXDW-GMTAPVOTSA-N 1 2 247.342 2.197 20 0 BEADLO CCc1cc(C[NH2+][C@H](C)c2ccccn2)on1 ZINC000535041618 323163928 /nfs/dbraw/zinc/16/39/28/323163928.db2.gz PXQVNCZJIJLBGY-SNVBAGLBSA-N 1 2 231.299 2.483 20 0 BEADLO Cc1cc(NC(=O)Cc2ccccc2)c(C)c[nH+]1 ZINC000535035239 323164079 /nfs/dbraw/zinc/16/40/79/323164079.db2.gz RROXOZFEJKQZSU-UHFFFAOYSA-N 1 2 240.306 2.302 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[NH+]1[C@H](C)C[C@H]1C ZINC000532064163 323170689 /nfs/dbraw/zinc/17/06/89/323170689.db2.gz QYAWXCKLROMKNV-KKZNHRDASA-N 1 2 239.340 2.445 20 0 BEADLO CCc1nc(CN(C)Cc2[nH]cc[nH+]2)cs1 ZINC000532059099 323170738 /nfs/dbraw/zinc/17/07/38/323170738.db2.gz NKSNYMZBPHOMMC-UHFFFAOYSA-N 1 2 236.344 2.061 20 0 BEADLO Brc1cn[nH]c1C[NH2+]C1CCCC1 ZINC000306380766 323172866 /nfs/dbraw/zinc/17/28/66/323172866.db2.gz OKXVOVCJSHRUJE-UHFFFAOYSA-N 1 2 244.136 2.204 20 0 BEADLO CCC[C@@H]([NH2+]CCOC(C)(C)C)C(=O)OCC ZINC000308594748 323176160 /nfs/dbraw/zinc/17/61/60/323176160.db2.gz XVQGBKQJWHUIJN-LLVKDONJSA-N 1 2 245.363 2.123 20 0 BEADLO C[C@@H]([NH2+]C/C=C\c1ccccc1)c1ncn(C)n1 ZINC000391979518 323183874 /nfs/dbraw/zinc/18/38/74/323183874.db2.gz MINDPUYBRGVTNO-OJIASSBASA-N 1 2 242.326 2.179 20 0 BEADLO CC[C@]1(C)C[C@H]1C(=O)Nc1cc(C)[nH+]cc1C ZINC000535748095 323190239 /nfs/dbraw/zinc/19/02/39/323190239.db2.gz VAMNQZSGZNPHIT-SMDDNHRTSA-N 1 2 232.327 2.495 20 0 BEADLO CCc1cnc(C[N@@H+]2CC[C@](C)(F)C2)o1 ZINC000535756666 323190508 /nfs/dbraw/zinc/19/05/08/323190508.db2.gz GXMITTXYTSAKPL-NSHDSACASA-N 1 2 212.268 2.171 20 0 BEADLO CCc1cnc(C[N@H+]2CC[C@](C)(F)C2)o1 ZINC000535756666 323190509 /nfs/dbraw/zinc/19/05/09/323190509.db2.gz GXMITTXYTSAKPL-NSHDSACASA-N 1 2 212.268 2.171 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2CC=CCC2)c(C)c[nH+]1 ZINC000535773003 323190815 /nfs/dbraw/zinc/19/08/15/323190815.db2.gz ZMZWIFHNMSPSOX-LBPRGKRZSA-N 1 2 245.326 2.351 20 0 BEADLO Cc1cc(NC(=O)NCC2(C)CC2)c(C)c[nH+]1 ZINC000535773632 323190877 /nfs/dbraw/zinc/19/08/77/323190877.db2.gz AWHMELZUHKVXNH-UHFFFAOYSA-N 1 2 233.315 2.042 20 0 BEADLO C[N@@H+](Cc1cscn1)C[C@H]1CCCCO1 ZINC000052460362 323193321 /nfs/dbraw/zinc/19/33/21/323193321.db2.gz MVCGYIIYMYQWOI-LLVKDONJSA-N 1 2 226.345 2.144 20 0 BEADLO C[N@H+](Cc1cscn1)C[C@H]1CCCCO1 ZINC000052460362 323193322 /nfs/dbraw/zinc/19/33/22/323193322.db2.gz MVCGYIIYMYQWOI-LLVKDONJSA-N 1 2 226.345 2.144 20 0 BEADLO CC(C)=CC[NH+]1CCN(CC(F)(F)F)CC1 ZINC000054171021 323203223 /nfs/dbraw/zinc/20/32/23/323203223.db2.gz MMNAMQFHHWBKDR-UHFFFAOYSA-N 1 2 236.281 2.133 20 0 BEADLO CCCn1ccc(CNc2c[nH]c[nH+]2)c1 ZINC000309046759 323205516 /nfs/dbraw/zinc/20/55/16/323205516.db2.gz PCCYGHRIUUPXES-UHFFFAOYSA-N 1 2 204.277 2.233 20 0 BEADLO Cc1nn(C)cc1[C@@H](C)[NH2+]Cc1ncccc1F ZINC000530418917 323386032 /nfs/dbraw/zinc/38/60/32/323386032.db2.gz NDBRYFZTZXVSAI-SECBINFHSA-N 1 2 248.305 2.113 20 0 BEADLO CC[C@@H]([NH2+]CC(C)(C)C(F)(F)F)C(=O)OC ZINC000309622981 323436937 /nfs/dbraw/zinc/43/69/37/323436937.db2.gz DZLAJHOHSLATII-SSDOTTSWSA-N 1 2 241.253 2.116 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1C[C@H](C)O[C@@H]1C ZINC000528034133 323742552 /nfs/dbraw/zinc/74/25/52/323742552.db2.gz GNZSPLCSUCCVMO-AXFHLTTASA-N 1 2 236.315 2.316 20 0 BEADLO CCn1c[nH+]cc1CNc1cnn(C(C)(C)C)c1 ZINC000417954918 487960551 /nfs/dbraw/zinc/96/05/51/487960551.db2.gz QJKVUUAHMHXSCH-UHFFFAOYSA-N 1 2 247.346 2.467 20 0 BEADLO Cc1nc(C[N@H+](C2CC2)C2CCCC2)no1 ZINC000060562615 324041799 /nfs/dbraw/zinc/04/17/99/324041799.db2.gz ZNFAJNWIYJCCMO-UHFFFAOYSA-N 1 2 221.304 2.285 20 0 BEADLO Cc1nc(C[N@@H+](C2CC2)C2CCCC2)no1 ZINC000060562615 324041804 /nfs/dbraw/zinc/04/18/04/324041804.db2.gz ZNFAJNWIYJCCMO-UHFFFAOYSA-N 1 2 221.304 2.285 20 0 BEADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1ccno1 ZINC000537677187 324095740 /nfs/dbraw/zinc/09/57/40/324095740.db2.gz CEXLTJVHFSPFDN-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1ccno1 ZINC000537677187 324095745 /nfs/dbraw/zinc/09/57/45/324095745.db2.gz CEXLTJVHFSPFDN-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO CC1(C)CC[C@@H]1[NH2+]Cc1nnsc1Cl ZINC000572494387 324131915 /nfs/dbraw/zinc/13/19/15/324131915.db2.gz UIQCKDOEUQPTJK-ZETCQYMHSA-N 1 2 231.752 2.470 20 0 BEADLO CCOC1(C)C[NH+](Cc2ccnc(C)c2)C1 ZINC000529600741 324359687 /nfs/dbraw/zinc/35/96/87/324359687.db2.gz AUGPWVSGTDUQNN-UHFFFAOYSA-N 1 2 220.316 2.001 20 0 BEADLO CCC(C)(C)OC1C[NH+](Cc2ccccn2)C1 ZINC000529641602 324369872 /nfs/dbraw/zinc/36/98/72/324369872.db2.gz NWUONERJRHNBKG-UHFFFAOYSA-N 1 2 234.343 2.471 20 0 BEADLO CCC(C)(C)OC1C[NH+](Cc2ccncc2)C1 ZINC000529641764 324369993 /nfs/dbraw/zinc/36/99/93/324369993.db2.gz QGWLYCAHEXQQHM-UHFFFAOYSA-N 1 2 234.343 2.471 20 0 BEADLO CC1(C)C[C@@H]1C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000677083876 487964291 /nfs/dbraw/zinc/96/42/91/487964291.db2.gz BZUQNUFDQSWBIS-VXGBXAGGSA-N 1 2 247.342 2.093 20 0 BEADLO CCC[C@@H]([NH2+][C@H](C)CSC)C(=O)OCC ZINC000128047879 324802369 /nfs/dbraw/zinc/80/23/69/324802369.db2.gz YPAJEHPQQSIEJP-NXEZZACHSA-N 1 2 233.377 2.059 20 0 BEADLO CC[C@](C)(CO)Nc1nc(C)[nH+]c2c1CCCC2 ZINC000541089232 324945960 /nfs/dbraw/zinc/94/59/60/324945960.db2.gz GCCBETMRJPMYDJ-CQSZACIVSA-N 1 2 249.358 2.237 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)/C=C/c1ccccc1 ZINC000070979512 325048178 /nfs/dbraw/zinc/04/81/78/325048178.db2.gz HOUGQSNZTNONLY-BQYQJAHWSA-N 1 2 241.294 2.082 20 0 BEADLO CCc1cc(N(CC)CC(F)F)nc(C)[nH+]1 ZINC000543451650 325089517 /nfs/dbraw/zinc/08/95/17/325089517.db2.gz HLBFUBWJPNPMKU-UHFFFAOYSA-N 1 2 229.274 2.439 20 0 BEADLO CC[C@H]([NH2+]Cc1cccc(C)n1)c1ccn(C)n1 ZINC000543603836 325096717 /nfs/dbraw/zinc/09/67/17/325096717.db2.gz XCFWKHBQUMCVQS-ZDUSSCGKSA-N 1 2 244.342 2.364 20 0 BEADLO CC(C)C1CC[NH+](Cc2csnn2)CC1 ZINC000131121180 325119357 /nfs/dbraw/zinc/11/93/57/325119357.db2.gz AXBLPTMBZIPKED-UHFFFAOYSA-N 1 2 225.361 2.406 20 0 BEADLO Cn1c[nH+]cc1CN[C@@H](C(C)(C)C)C(F)(F)F ZINC000545215129 325194146 /nfs/dbraw/zinc/19/41/46/325194146.db2.gz OIOXSHZPOUPBFO-VIFPVBQESA-N 1 2 249.280 2.487 20 0 BEADLO Cc1ccc(C)c([C@@H](C)[NH2+]Cc2ncn(C)n2)c1 ZINC000134197613 325348125 /nfs/dbraw/zinc/34/81/25/325348125.db2.gz XVIKNVSNBDSMGR-GFCCVEGCSA-N 1 2 244.342 2.283 20 0 BEADLO O=C(CCC1CCCC1)NCCc1[nH]cc[nH+]1 ZINC000134496790 325361389 /nfs/dbraw/zinc/36/13/89/325361389.db2.gz LZXCOZSGILDVFE-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO O=C(NCCc1[nH]cc[nH+]1)c1cccc(Cl)c1 ZINC000134496703 325361463 /nfs/dbraw/zinc/36/14/63/325361463.db2.gz RJLPGEFLQZFPAQ-UHFFFAOYSA-N 1 2 249.701 2.036 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2nc(C)no2)s1 ZINC000077211335 325369709 /nfs/dbraw/zinc/36/97/09/325369709.db2.gz KKGAXWNIQZRNCC-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2nc(C)no2)s1 ZINC000077211335 325369711 /nfs/dbraw/zinc/36/97/11/325369711.db2.gz KKGAXWNIQZRNCC-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO CCc1ccc(C[NH2+]Cc2nnc(C)s2)o1 ZINC000134663974 325370850 /nfs/dbraw/zinc/37/08/50/325370850.db2.gz YTYPACJKMRRLSV-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO CCN(C(=O)Cc1c[nH+]cn1C)c1ccccc1 ZINC000547603534 325373712 /nfs/dbraw/zinc/37/37/12/325373712.db2.gz PHUAPWWSSVWELR-UHFFFAOYSA-N 1 2 243.310 2.016 20 0 BEADLO O=C(C1=CCCCCC1)N1CC(n2cc[nH+]c2)C1 ZINC000547845790 325408513 /nfs/dbraw/zinc/40/85/13/325408513.db2.gz KBMYGSUINYYPFU-UHFFFAOYSA-N 1 2 245.326 2.157 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N[C@@H]1CCC[C@@H]1C ZINC000136950331 325472662 /nfs/dbraw/zinc/47/26/62/325472662.db2.gz JQVBOTGJCRXPPS-ADYIUWEDSA-N 1 2 247.342 2.221 20 0 BEADLO Cc1ccc2[nH+]cc(CNCC(C)(F)F)n2c1 ZINC000549863924 325517900 /nfs/dbraw/zinc/51/79/00/325517900.db2.gz KEUZORAJSQXRSS-UHFFFAOYSA-N 1 2 239.269 2.388 20 0 BEADLO CC(C)c1nc(N2CCC[C@@H]2C[C@H](C)O)cc[nH+]1 ZINC000246842504 325580149 /nfs/dbraw/zinc/58/01/49/325580149.db2.gz VHECGHRPKJQVCI-NWDGAFQWSA-N 1 2 249.358 2.340 20 0 BEADLO CC[C@H]1CCCC[C@H]1NC(=O)Cc1c[nH+]cn1C ZINC000554501153 325722406 /nfs/dbraw/zinc/72/24/06/325722406.db2.gz IPOVUQVFRKQMQL-WCQYABFASA-N 1 2 249.358 2.048 20 0 BEADLO Nc1nc(N[C@H]2CCC[C@H]2F)[nH+]c2ccccc12 ZINC000555269948 325751583 /nfs/dbraw/zinc/75/15/83/325751583.db2.gz YOSMAJFHNCOANO-KOLCDFICSA-N 1 2 246.289 2.345 20 0 BEADLO CCCN(CC1CC1)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000564660186 325802052 /nfs/dbraw/zinc/80/20/52/325802052.db2.gz GIVKLCXFWAXZRL-LBPRGKRZSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1ccc(C(=O)NC(C)(C)c2[nH]cc[nH+]2)s1 ZINC000565108814 325859176 /nfs/dbraw/zinc/85/91/76/325859176.db2.gz RYFLEWDNQWHKTL-UHFFFAOYSA-N 1 2 249.339 2.445 20 0 BEADLO Cc1ccn(-c2ccc([NH2+]C[C@@H](C)CO)cc2)n1 ZINC000671148118 487970378 /nfs/dbraw/zinc/97/03/78/487970378.db2.gz PBCWINGSMQQFOU-LLVKDONJSA-N 1 2 245.326 2.221 20 0 BEADLO Cn1ncc2c1nc[nH+]c2N[C@H]1CCC[C@@H](F)C1 ZINC000566161486 326004703 /nfs/dbraw/zinc/00/47/03/326004703.db2.gz ZUYXNYXUZRRBGK-BDAKNGLRSA-N 1 2 249.293 2.056 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1C[C@@H]2OCCC[C@@H]12 ZINC000566484922 326057134 /nfs/dbraw/zinc/05/71/34/326057134.db2.gz UAGJJNRIGALENN-TUAOUCFPSA-N 1 2 233.315 2.073 20 0 BEADLO CCCN(C(=O)Nc1cc[nH+]cc1C)C(C)C ZINC000566628033 326070043 /nfs/dbraw/zinc/07/00/43/326070043.db2.gz GHMRIPAZWZZBMG-UHFFFAOYSA-N 1 2 235.331 2.464 20 0 BEADLO CCC(=O)N(Cc1[nH]cc[nH+]1)c1cncc(C)c1 ZINC000566632950 326070752 /nfs/dbraw/zinc/07/07/52/326070752.db2.gz MTRGELSOJHUIOD-UHFFFAOYSA-N 1 2 244.298 2.056 20 0 BEADLO F[C@H]1CCC[C@H](Nc2cc[nH+]c(C3CC3)n2)C1 ZINC000566971403 326097995 /nfs/dbraw/zinc/09/79/95/326097995.db2.gz KYMLESUONRDZIE-QWRGUYRKSA-N 1 2 235.306 2.469 20 0 BEADLO CC(F)(F)C[NH2+]CCC(=O)Nc1ccccc1 ZINC000566969165 326098000 /nfs/dbraw/zinc/09/80/00/326098000.db2.gz WVYJZNFJKXNYDW-UHFFFAOYSA-N 1 2 242.269 2.260 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCOc1ccccc1 ZINC000567089382 326113590 /nfs/dbraw/zinc/11/35/90/326113590.db2.gz VATGIVIACKWAOF-UHFFFAOYSA-N 1 2 243.310 2.006 20 0 BEADLO C[C@H]1CCCC[C@H]1CC(=O)NCc1c[nH+]cn1C ZINC000567287324 326156381 /nfs/dbraw/zinc/15/63/81/326156381.db2.gz VDBPVYCRHWYALA-RYUDHWBXSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CC[C@@H](O)CC(C)(C)C1 ZINC000567291309 326157050 /nfs/dbraw/zinc/15/70/50/326157050.db2.gz XOJKEILBRZSXOZ-GFCCVEGCSA-N 1 2 249.358 2.081 20 0 BEADLO CC(C)(C)C(C)(C)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000567338565 326165870 /nfs/dbraw/zinc/16/58/70/326165870.db2.gz SWYVQYPKEJOMLM-UHFFFAOYSA-N 1 2 249.358 2.339 20 0 BEADLO CCC(CC)C(=O)N(C)CCCn1cc[nH+]c1 ZINC000155020993 326179675 /nfs/dbraw/zinc/17/96/75/326179675.db2.gz XRNIYDDNAWCQOG-UHFFFAOYSA-N 1 2 237.347 2.168 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2nc3ccccc3o2)[C@H]1C ZINC000156082940 326218364 /nfs/dbraw/zinc/21/83/64/326218364.db2.gz DBIGTKLFXGIYRR-WDEREUQCSA-N 1 2 246.310 2.437 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2nc3ccccc3o2)[C@H]1C ZINC000156082940 326218367 /nfs/dbraw/zinc/21/83/67/326218367.db2.gz DBIGTKLFXGIYRR-WDEREUQCSA-N 1 2 246.310 2.437 20 0 BEADLO CN(C)c1ccc(CNc2ccc(F)cn2)c[nH+]1 ZINC000156771450 326241721 /nfs/dbraw/zinc/24/17/21/326241721.db2.gz PUJFUESHXKBETC-UHFFFAOYSA-N 1 2 246.289 2.294 20 0 BEADLO CSCCCCC(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000567750879 326255416 /nfs/dbraw/zinc/25/54/16/326255416.db2.gz LCVVCPIBVCHAPX-SECBINFHSA-N 1 2 241.360 2.120 20 0 BEADLO COc1ccc(F)c(C[NH2+]Cc2ccno2)c1 ZINC000567887586 326276647 /nfs/dbraw/zinc/27/66/47/326276647.db2.gz NOTGBNPAXZUPCM-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO CCc1coc(NC(=O)C[C@H](C)n2cc[nH+]c2)n1 ZINC000568174345 326320060 /nfs/dbraw/zinc/32/00/60/326320060.db2.gz VVDYANFQKCZXPT-VIFPVBQESA-N 1 2 248.286 2.023 20 0 BEADLO CC[C@@H]1C[C@H](C)CN1C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000568519454 326362008 /nfs/dbraw/zinc/36/20/08/326362008.db2.gz GTGFDYRQNVCJCP-RWMBFGLXSA-N 1 2 249.358 2.481 20 0 BEADLO Oc1cc(F)cc(C[N@H+]2CCC[C@H](F)C2)c1 ZINC000568757478 326375207 /nfs/dbraw/zinc/37/52/07/326375207.db2.gz KLWYENVGPGLGBV-JTQLQIEISA-N 1 2 227.254 2.465 20 0 BEADLO Oc1cc(F)cc(C[N@@H+]2CCC[C@H](F)C2)c1 ZINC000568757478 326375206 /nfs/dbraw/zinc/37/52/06/326375206.db2.gz KLWYENVGPGLGBV-JTQLQIEISA-N 1 2 227.254 2.465 20 0 BEADLO CCCN(C(=O)[C@H]1CCn2cc[nH+]c2C1)C(C)C ZINC000568764183 326376273 /nfs/dbraw/zinc/37/62/73/326376273.db2.gz VSINLALRYLSYKL-LBPRGKRZSA-N 1 2 249.358 2.093 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CC[C@@H](C)C[C@H]1C ZINC000568880915 326381039 /nfs/dbraw/zinc/38/10/39/326381039.db2.gz LTWWKLSTXSFGIY-IJLUTSLNSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CC[C@@H](C)C[C@H]1C ZINC000568880915 326381040 /nfs/dbraw/zinc/38/10/40/326381040.db2.gz LTWWKLSTXSFGIY-IJLUTSLNSA-N 1 2 249.358 2.235 20 0 BEADLO COc1ccc(C[C@@H](C)Nc2c[nH]c[nH+]2)cc1 ZINC000569044959 326387595 /nfs/dbraw/zinc/38/75/95/326387595.db2.gz XSBGSPNYAHXUQS-SNVBAGLBSA-N 1 2 231.299 2.461 20 0 BEADLO c1[nH]cc(N[C@@H]2CCC[C@H]([C@@H]3CCOC3)C2)[nH+]1 ZINC000569161463 326393242 /nfs/dbraw/zinc/39/32/42/326393242.db2.gz AGVDQWDLXUNRDE-QJPTWQEYSA-N 1 2 235.331 2.417 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)CCC2CC2)[nH+]1 ZINC000572889383 326417184 /nfs/dbraw/zinc/41/71/84/326417184.db2.gz LVWOYPVDWZCBGT-UHFFFAOYSA-N 1 2 235.331 2.260 20 0 BEADLO Cc1ccccc1CNc1nc(C)[nH+]cc1C ZINC000572893751 326417360 /nfs/dbraw/zinc/41/73/60/326417360.db2.gz VKEGEQUNMXQODY-UHFFFAOYSA-N 1 2 227.311 2.436 20 0 BEADLO c1cnc(C[NH2+][C@@H](c2cccnc2)C2CC2)nc1 ZINC000573037597 326426417 /nfs/dbraw/zinc/42/64/17/326426417.db2.gz BVQDXCUKQNKGNN-CQSZACIVSA-N 1 2 240.310 2.113 20 0 BEADLO CC(C)c1nc(N(C)C[C@H]2CCC[C@@H]2O)cc[nH+]1 ZINC000166884804 326436487 /nfs/dbraw/zinc/43/64/87/326436487.db2.gz BGERZQHYKUQEMZ-NEPJUHHUSA-N 1 2 249.358 2.197 20 0 BEADLO O[C@@H]1C[N@H+](CC2CCCCC2)CC(F)(F)C1 ZINC000682544540 487983460 /nfs/dbraw/zinc/98/34/60/487983460.db2.gz RXRMUGZLYQJNSA-NSHDSACASA-N 1 2 233.302 2.269 20 0 BEADLO O[C@@H]1C[N@@H+](CC2CCCCC2)CC(F)(F)C1 ZINC000682544540 487983465 /nfs/dbraw/zinc/98/34/65/487983465.db2.gz RXRMUGZLYQJNSA-NSHDSACASA-N 1 2 233.302 2.269 20 0 BEADLO CC(C)[C@H](C)N(C)C(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000666027480 487985938 /nfs/dbraw/zinc/98/59/38/487985938.db2.gz RZDGHVVWMYBBHK-QWRGUYRKSA-N 1 2 249.358 2.018 20 0 BEADLO CC(C)[C@H](C)N(C)C(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000666027480 487985946 /nfs/dbraw/zinc/98/59/46/487985946.db2.gz RZDGHVVWMYBBHK-QWRGUYRKSA-N 1 2 249.358 2.018 20 0 BEADLO O[C@H]1C[N@H+](CCC2CCCC2)CC(F)(F)C1 ZINC000682548866 487986331 /nfs/dbraw/zinc/98/63/31/487986331.db2.gz RQYOMPIYHHZGOR-LLVKDONJSA-N 1 2 233.302 2.269 20 0 BEADLO O[C@H]1C[N@@H+](CCC2CCCC2)CC(F)(F)C1 ZINC000682548866 487986342 /nfs/dbraw/zinc/98/63/42/487986342.db2.gz RQYOMPIYHHZGOR-LLVKDONJSA-N 1 2 233.302 2.269 20 0 BEADLO O[C@@H]1C[N@H+](C[C@H]2CC=CCC2)CC(F)(F)C1 ZINC000682559384 487988875 /nfs/dbraw/zinc/98/88/75/487988875.db2.gz UYIJULDDOXHYMN-QWRGUYRKSA-N 1 2 231.286 2.045 20 0 BEADLO O[C@@H]1C[N@@H+](C[C@H]2CC=CCC2)CC(F)(F)C1 ZINC000682559384 487988881 /nfs/dbraw/zinc/98/88/81/487988881.db2.gz UYIJULDDOXHYMN-QWRGUYRKSA-N 1 2 231.286 2.045 20 0 BEADLO CC1=CC[C@@](C)(C(=O)NCc2[nH]cc[nH+]2)CC1 ZINC000668604518 487996855 /nfs/dbraw/zinc/99/68/55/487996855.db2.gz QADHDRNTIXXSNA-CYBMUJFWSA-N 1 2 233.315 2.162 20 0 BEADLO Cc1nnsc1CNc1c[nH+]ccc1C ZINC000394707234 487996994 /nfs/dbraw/zinc/99/69/94/487996994.db2.gz AMNDLDXWEBVYKQ-UHFFFAOYSA-N 1 2 220.301 2.162 20 0 BEADLO c1nc(NC2CC2)cc(N2CCC[C@@H]3C[C@@H]32)[nH+]1 ZINC000665719023 487999090 /nfs/dbraw/zinc/99/90/90/487999090.db2.gz WTDGTTNKEODNMJ-KOLCDFICSA-N 1 2 230.315 2.040 20 0 BEADLO COc1c(N)[nH+]cnc1NC1CCCCCC1 ZINC000134818841 487999392 /nfs/dbraw/zinc/99/93/92/487999392.db2.gz IBAIXPYQKQTKJA-UHFFFAOYSA-N 1 2 236.319 2.202 20 0 BEADLO COc1c(N)nc[nH+]c1NC1CCCCCC1 ZINC000134818841 487999398 /nfs/dbraw/zinc/99/93/98/487999398.db2.gz IBAIXPYQKQTKJA-UHFFFAOYSA-N 1 2 236.319 2.202 20 0 BEADLO c1nc(N2CCC[C@@H]3C[C@@H]32)cc(NC2CC2)[nH+]1 ZINC000665719023 487999080 /nfs/dbraw/zinc/99/90/80/487999080.db2.gz WTDGTTNKEODNMJ-KOLCDFICSA-N 1 2 230.315 2.040 20 0 BEADLO CCC[C@H](CC)NC(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000667423586 488000522 /nfs/dbraw/zinc/00/05/22/488000522.db2.gz QHIMPFSONRYPBS-QWRGUYRKSA-N 1 2 249.358 2.210 20 0 BEADLO CCC[C@H](CC)NC(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000667423586 488000526 /nfs/dbraw/zinc/00/05/26/488000526.db2.gz QHIMPFSONRYPBS-QWRGUYRKSA-N 1 2 249.358 2.210 20 0 BEADLO COCC1([NH2+]Cc2n[nH]c3ccccc32)CCC1 ZINC000671195171 488008835 /nfs/dbraw/zinc/00/88/35/488008835.db2.gz AGFVEJHIPIDLJH-UHFFFAOYSA-N 1 2 245.326 2.222 20 0 BEADLO COCc1csc(C[N@@H+]2CCO[C@H](C)C2)c1 ZINC000667492358 488025649 /nfs/dbraw/zinc/02/56/49/488025649.db2.gz FNAHMXRWZOWJNG-SNVBAGLBSA-N 1 2 241.356 2.115 20 0 BEADLO COCc1csc(C[N@H+]2CCO[C@H](C)C2)c1 ZINC000667492358 488025651 /nfs/dbraw/zinc/02/56/51/488025651.db2.gz FNAHMXRWZOWJNG-SNVBAGLBSA-N 1 2 241.356 2.115 20 0 BEADLO FC(F)(C[NH2+]Cc1cn[nH]c1)c1ccccc1 ZINC000682730401 488027761 /nfs/dbraw/zinc/02/77/61/488027761.db2.gz AGXJJSNTMRCLKG-UHFFFAOYSA-N 1 2 237.253 2.291 20 0 BEADLO C[C@H]1CC[C@@H](C[N@@H+]2CCC[C@H]2C(F)F)O1 ZINC000682767572 488034062 /nfs/dbraw/zinc/03/40/62/488034062.db2.gz AXQVIPFQLMUBLQ-GUBZILKMSA-N 1 2 219.275 2.283 20 0 BEADLO C[C@H]1CC[C@@H](C[N@H+]2CCC[C@H]2C(F)F)O1 ZINC000682767572 488034065 /nfs/dbraw/zinc/03/40/65/488034065.db2.gz AXQVIPFQLMUBLQ-GUBZILKMSA-N 1 2 219.275 2.283 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CCC[C@H]3C[C@H]32)cc[nH+]1 ZINC000668636105 488034814 /nfs/dbraw/zinc/03/48/14/488034814.db2.gz QQRGOXUNQATCIF-CYZMBNFOSA-N 1 2 230.311 2.187 20 0 BEADLO CCn1ccc(C[N@H+](C)Cc2ccon2)c1 ZINC000682778365 488039183 /nfs/dbraw/zinc/03/91/83/488039183.db2.gz CUHGHQDDHFSIMM-UHFFFAOYSA-N 1 2 219.288 2.128 20 0 BEADLO CCn1ccc(C[N@@H+](C)Cc2ccon2)c1 ZINC000682778365 488039185 /nfs/dbraw/zinc/03/91/85/488039185.db2.gz CUHGHQDDHFSIMM-UHFFFAOYSA-N 1 2 219.288 2.128 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccccn2)sn1 ZINC000682805884 488043507 /nfs/dbraw/zinc/04/35/07/488043507.db2.gz OGQXQWWOZBAUPO-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccccn2)sn1 ZINC000682805884 488043508 /nfs/dbraw/zinc/04/35/08/488043508.db2.gz OGQXQWWOZBAUPO-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@H]1CCC[C@H]1C ZINC000656119828 488052541 /nfs/dbraw/zinc/05/25/41/488052541.db2.gz BGAJSGZYCJGEGU-SCZZXKLOSA-N 1 2 221.304 2.394 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)Cc1ccc(Cl)cn1 ZINC000682843083 488052813 /nfs/dbraw/zinc/05/28/13/488052813.db2.gz YAFXUQIAWSUOPZ-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO Cc1ccnc(CSc2nc(N)cc(C)[nH+]2)c1 ZINC000682849357 488053371 /nfs/dbraw/zinc/05/33/71/488053371.db2.gz SFEFPGUVBHXQTD-UHFFFAOYSA-N 1 2 246.339 2.363 20 0 BEADLO CC[C@@H](C)CC(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000682891572 488061183 /nfs/dbraw/zinc/06/11/83/488061183.db2.gz ITLRIPZPRHOWDK-OLZOCXBDSA-N 1 2 249.358 2.483 20 0 BEADLO CC[C@@H](NC(=O)[C@@H]1CC=CCC1)c1[nH]cc[nH+]1 ZINC000140543688 488064084 /nfs/dbraw/zinc/06/40/84/488064084.db2.gz WTODVSICCOVMFP-GHMZBOCLSA-N 1 2 233.315 2.333 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1C[C@@H](OC(C)C)C1 ZINC000656200575 488066230 /nfs/dbraw/zinc/06/62/30/488066230.db2.gz RWCZWXHCEPGLDH-TXEJJXNPSA-N 1 2 235.331 2.461 20 0 BEADLO CO[C@H]1CC[N@H+](Cc2ccc(F)c(F)c2F)C1 ZINC000667649107 488071092 /nfs/dbraw/zinc/07/10/92/488071092.db2.gz JDOQGTZUUBYWJE-VIFPVBQESA-N 1 2 245.244 2.325 20 0 BEADLO CO[C@H]1CC[N@@H+](Cc2ccc(F)c(F)c2F)C1 ZINC000667649107 488071094 /nfs/dbraw/zinc/07/10/94/488071094.db2.gz JDOQGTZUUBYWJE-VIFPVBQESA-N 1 2 245.244 2.325 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C)ccn2)CCO1 ZINC000683003306 488084169 /nfs/dbraw/zinc/08/41/69/488084169.db2.gz OWDJLRAOZXKBNS-CYBMUJFWSA-N 1 2 220.316 2.001 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C)ccn2)CCO1 ZINC000683003306 488084172 /nfs/dbraw/zinc/08/41/72/488084172.db2.gz OWDJLRAOZXKBNS-CYBMUJFWSA-N 1 2 220.316 2.001 20 0 BEADLO C[C@]1(O)CC[N@H+](Cc2ccc(F)c(F)c2F)C1 ZINC000667688546 488087867 /nfs/dbraw/zinc/08/78/67/488087867.db2.gz WNBFFYJBOCNVRS-LBPRGKRZSA-N 1 2 245.244 2.061 20 0 BEADLO C[C@]1(O)CC[N@@H+](Cc2ccc(F)c(F)c2F)C1 ZINC000667688546 488087872 /nfs/dbraw/zinc/08/78/72/488087872.db2.gz WNBFFYJBOCNVRS-LBPRGKRZSA-N 1 2 245.244 2.061 20 0 BEADLO Cc1cccc2[nH]c(C[NH+]3CCOCC3)cc21 ZINC000257860552 488090470 /nfs/dbraw/zinc/09/04/70/488090470.db2.gz FLSYMPPZZHGQJJ-UHFFFAOYSA-N 1 2 230.311 2.309 20 0 BEADLO Cc1ccnc(C[NH+](C)[C@@H]2CC[N@H+](C)[C@H](C)C2)c1 ZINC000683010617 488090810 /nfs/dbraw/zinc/09/08/10/488090810.db2.gz CIFDNNGOQCENOW-UKRRQHHQSA-N 1 2 247.386 2.305 20 0 BEADLO Cc1ccnc(C[NH+](C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1 ZINC000683010617 488090817 /nfs/dbraw/zinc/09/08/17/488090817.db2.gz CIFDNNGOQCENOW-UKRRQHHQSA-N 1 2 247.386 2.305 20 0 BEADLO CC(C)=CCNC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000683031621 488102327 /nfs/dbraw/zinc/10/23/27/488102327.db2.gz USJLGAOPHCWWST-UHFFFAOYSA-N 1 2 244.298 2.422 20 0 BEADLO Cc1cc(C[NH+]2CC3(C2)CC(F)(F)C3)on1 ZINC000677733453 488111083 /nfs/dbraw/zinc/11/10/83/488111083.db2.gz OXGJNIZMCOMRCF-UHFFFAOYSA-N 1 2 228.242 2.214 20 0 BEADLO c1nc(C[N@@H+]2CCOC(C3CC3)(C3CC3)C2)co1 ZINC000668684853 488114123 /nfs/dbraw/zinc/11/41/23/488114123.db2.gz WHSNIKSATQFJFT-UHFFFAOYSA-N 1 2 248.326 2.066 20 0 BEADLO c1nc(C[N@H+]2CCOC(C3CC3)(C3CC3)C2)co1 ZINC000668684853 488114129 /nfs/dbraw/zinc/11/41/29/488114129.db2.gz WHSNIKSATQFJFT-UHFFFAOYSA-N 1 2 248.326 2.066 20 0 BEADLO CC1(C)CC[C@@H]1C(=O)NCCCCn1cc[nH+]c1 ZINC000668686172 488114545 /nfs/dbraw/zinc/11/45/45/488114545.db2.gz ISFMIRSZMFNERZ-GFCCVEGCSA-N 1 2 249.358 2.216 20 0 BEADLO CCO[C@H]1C[C@@H](Nc2cc(CC)[nH+]cn2)C1 ZINC000665730716 487541480 /nfs/dbraw/zinc/54/14/80/487541480.db2.gz SWKRGESNPNJPTE-PHIMTYICSA-N 1 2 221.304 2.018 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2CC[C@H](C(F)F)C2)no1 ZINC000685570160 487541831 /nfs/dbraw/zinc/54/18/31/487541831.db2.gz WRLXHGQKEBYBHI-SVRRBLITSA-N 1 2 231.246 2.026 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2CC[C@H](C(F)F)C2)no1 ZINC000685570160 487541835 /nfs/dbraw/zinc/54/18/35/487541835.db2.gz WRLXHGQKEBYBHI-SVRRBLITSA-N 1 2 231.246 2.026 20 0 BEADLO Cc1[nH]ccc1C(=O)Nc1cc(N(C)C)cc[nH+]1 ZINC000680259166 487554650 /nfs/dbraw/zinc/55/46/50/487554650.db2.gz ZWUBNWQHYAVLPG-UHFFFAOYSA-N 1 2 244.298 2.036 20 0 BEADLO CC1(C(=O)N2CCC[C@@H](n3cc[nH+]c3)C2)CCC1 ZINC000674240232 487531266 /nfs/dbraw/zinc/53/12/66/487531266.db2.gz HSKINYRSFNWHHJ-GFCCVEGCSA-N 1 2 247.342 2.237 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@@H](C)C(C)(C)C)no1 ZINC000668798421 487556777 /nfs/dbraw/zinc/55/67/77/487556777.db2.gz LBTRGLVOTPCSLK-SECBINFHSA-N 1 2 225.336 2.492 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@@H](C)C(C)(C)C)no1 ZINC000668798421 487556782 /nfs/dbraw/zinc/55/67/82/487556782.db2.gz LBTRGLVOTPCSLK-SECBINFHSA-N 1 2 225.336 2.492 20 0 BEADLO CC1(C(=O)Nc2ccc3[nH+]ccn3c2)CCC1 ZINC000674241828 487532521 /nfs/dbraw/zinc/53/25/21/487532521.db2.gz FDCJNIZTWAWZJU-UHFFFAOYSA-N 1 2 229.283 2.463 20 0 BEADLO CC(C)(C)c1nc(NCC2(CO)CCC2)cc[nH+]1 ZINC000680074705 487533053 /nfs/dbraw/zinc/53/30/53/487533053.db2.gz XLSAFOWHDSWNQB-UHFFFAOYSA-N 1 2 249.358 2.349 20 0 BEADLO Cc1nnc(C[NH2+][C@H](C)c2ccsc2)n1C ZINC000061363033 487472949 /nfs/dbraw/zinc/47/29/49/487472949.db2.gz DAOCUXMDLZHFSD-MRVPVSSYSA-N 1 2 236.344 2.036 20 0 BEADLO COc1ccccc1N(C)Cc1c[nH+]cn1C ZINC000673927308 487481394 /nfs/dbraw/zinc/48/13/94/487481394.db2.gz SKVRKGHHJXLMQQ-UHFFFAOYSA-N 1 2 231.299 2.065 20 0 BEADLO CC(C)c1noc([C@H](C)N(C)Cc2[nH]cc[nH+]2)n1 ZINC000677802319 487496113 /nfs/dbraw/zinc/49/61/13/487496113.db2.gz QHVIKBOACHIOAB-VIFPVBQESA-N 1 2 249.318 2.109 20 0 BEADLO CC(C)c1noc([C@@H](C)N(C)Cc2[nH]cc[nH+]2)n1 ZINC000677802318 487496377 /nfs/dbraw/zinc/49/63/77/487496377.db2.gz QHVIKBOACHIOAB-SECBINFHSA-N 1 2 249.318 2.109 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2cncs2)s1 ZINC000391822924 487497957 /nfs/dbraw/zinc/49/79/57/487497957.db2.gz UTNGAWUCULTEQU-ZCFIWIBFSA-N 1 2 240.357 2.154 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](C)c2cnccc2C)nc1 ZINC000679945855 487499459 /nfs/dbraw/zinc/49/94/59/487499459.db2.gz OAQWOADUMUHFHG-LBPRGKRZSA-N 1 2 242.326 2.339 20 0 BEADLO C[C@@H](Nc1cc[nH+]c(C(C)(C)C)n1)C(C)(C)O ZINC000674064207 487503686 /nfs/dbraw/zinc/50/36/86/487503686.db2.gz LPNJHMXWPYWIET-SECBINFHSA-N 1 2 237.347 2.345 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)[C@H](C)C1CCCC1 ZINC000674082101 487513520 /nfs/dbraw/zinc/51/35/20/487513520.db2.gz ATZDCMSUGOQEFP-VXGBXAGGSA-N 1 2 249.358 2.214 20 0 BEADLO Cc1cnn(C)c1C[N@H+](C)Cc1ccc(C)cn1 ZINC000685429350 487521850 /nfs/dbraw/zinc/52/18/50/487521850.db2.gz OKIBADBNKSEMRO-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cnn(C)c1C[N@@H+](C)Cc1ccc(C)cn1 ZINC000685429350 487521851 /nfs/dbraw/zinc/52/18/51/487521851.db2.gz OKIBADBNKSEMRO-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO CC1(C)C[N@H+](Cc2cocn2)C(C)(C)CO1 ZINC000683352143 488150654 /nfs/dbraw/zinc/15/06/54/488150654.db2.gz YGNPMTHEVCFOPQ-UHFFFAOYSA-N 1 2 224.304 2.064 20 0 BEADLO CC1(C)C[N@@H+](Cc2cocn2)C(C)(C)CO1 ZINC000683352143 488150659 /nfs/dbraw/zinc/15/06/59/488150659.db2.gz YGNPMTHEVCFOPQ-UHFFFAOYSA-N 1 2 224.304 2.064 20 0 BEADLO c1cc(-c2ccc(CNc3c[nH]c[nH+]3)o2)n[nH]1 ZINC000685845887 487586795 /nfs/dbraw/zinc/58/67/95/487586795.db2.gz JNHPGDHXBSVGCW-UHFFFAOYSA-N 1 2 229.243 2.005 20 0 BEADLO CC(C)=CCC[N@H+](CC(F)F)C[C@H](C)O ZINC000660737636 487590929 /nfs/dbraw/zinc/59/09/29/487590929.db2.gz MTIGQNPFZKKCJO-JTQLQIEISA-N 1 2 221.291 2.291 20 0 BEADLO CC(C)=CCC[N@@H+](CC(F)F)C[C@H](C)O ZINC000660737636 487590935 /nfs/dbraw/zinc/59/09/35/487590935.db2.gz MTIGQNPFZKKCJO-JTQLQIEISA-N 1 2 221.291 2.291 20 0 BEADLO c1cn(-c2ccccc2)c(C[NH+]2CC3(CC3)C2)n1 ZINC000335382747 487621611 /nfs/dbraw/zinc/62/16/11/487621611.db2.gz GLQYWSIMMBYXSQ-UHFFFAOYSA-N 1 2 239.322 2.468 20 0 BEADLO CCn1c2ccccc2[nH+]c1NCc1cn[nH]c1 ZINC000680851180 487658738 /nfs/dbraw/zinc/65/87/38/487658738.db2.gz BBQBCTVDFWLMQA-UHFFFAOYSA-N 1 2 241.298 2.391 20 0 BEADLO O=C(CCCn1cc[nH+]c1)N1CCCC2(CC2)C1 ZINC000681205782 487747938 /nfs/dbraw/zinc/74/79/38/487747938.db2.gz LRNUABZJLVLHNY-UHFFFAOYSA-N 1 2 247.342 2.066 20 0 BEADLO c1c2cnccc2oc1C[N@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC000651641632 487808853 /nfs/dbraw/zinc/80/88/53/487808853.db2.gz YPVGNOSVBGJORC-TXEJJXNPSA-N 1 2 244.294 2.191 20 0 BEADLO c1c2cnccc2oc1C[N@@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC000651641632 487808856 /nfs/dbraw/zinc/80/88/56/487808856.db2.gz YPVGNOSVBGJORC-TXEJJXNPSA-N 1 2 244.294 2.191 20 0 BEADLO c1n[nH]c2c1CC[N@@H+]([C@H]1CCc3ccccc31)C2 ZINC000682070373 487891967 /nfs/dbraw/zinc/89/19/67/487891967.db2.gz COPGIHZRIJSUFQ-HNNXBMFYSA-N 1 2 239.322 2.455 20 0 BEADLO c1n[nH]c2c1CC[N@H+]([C@H]1CCc3ccccc31)C2 ZINC000682070373 487891969 /nfs/dbraw/zinc/89/19/69/487891969.db2.gz COPGIHZRIJSUFQ-HNNXBMFYSA-N 1 2 239.322 2.455 20 0 BEADLO Cc1cc(C)c(NCc2[nH+]ccn2C)cc1CO ZINC000682459291 487967777 /nfs/dbraw/zinc/96/77/77/487967777.db2.gz JYAQNZHLQVLFPZ-UHFFFAOYSA-N 1 2 245.326 2.141 20 0 BEADLO CC(C)(CCNC(=O)CCc1c[nH+]c[nH]1)C1CC1 ZINC000294030356 488141838 /nfs/dbraw/zinc/14/18/38/488141838.db2.gz CYJKUIUPJFNSQD-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO CC(C)(CCNC(=O)CCc1c[nH]c[nH+]1)C1CC1 ZINC000294030356 488141842 /nfs/dbraw/zinc/14/18/42/488141842.db2.gz CYJKUIUPJFNSQD-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO CCc1cc(NCC2=CCCCC2)nc[nH+]1 ZINC000379755152 488149632 /nfs/dbraw/zinc/14/96/32/488149632.db2.gz UFTBLINRGMMCAU-UHFFFAOYSA-N 1 2 217.316 2.373 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H]2CCOC[C@H]2C)[nH+]1 ZINC000683354417 488152476 /nfs/dbraw/zinc/15/24/76/488152476.db2.gz ZUHOWFDJJYYYTP-LDYMZIIASA-N 1 2 246.314 2.103 20 0 BEADLO Cc1cccn2c(NC(=O)NC(C)C)c[nH+]c12 ZINC000667948047 488165675 /nfs/dbraw/zinc/16/56/75/488165675.db2.gz LUYLGTOPLGPWGZ-UHFFFAOYSA-N 1 2 232.287 2.173 20 0 BEADLO CCCn1nccc1C[N@H+](C)Cc1ccccn1 ZINC000667978066 488174123 /nfs/dbraw/zinc/17/41/23/488174123.db2.gz SKPOZINXWZJONW-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CCCn1nccc1C[N@@H+](C)Cc1ccccn1 ZINC000667978066 488174128 /nfs/dbraw/zinc/17/41/28/488174128.db2.gz SKPOZINXWZJONW-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO C[C@@H]1C[N@H+](CCOCc2ccccc2)CCC1=O ZINC000390741548 488176800 /nfs/dbraw/zinc/17/68/00/488176800.db2.gz MIXVDIXIGSXJNJ-CYBMUJFWSA-N 1 2 247.338 2.114 20 0 BEADLO C[C@@H]1C[N@@H+](CCOCc2ccccc2)CCC1=O ZINC000390741548 488176805 /nfs/dbraw/zinc/17/68/05/488176805.db2.gz MIXVDIXIGSXJNJ-CYBMUJFWSA-N 1 2 247.338 2.114 20 0 BEADLO C[C@@H]1C[C@H](O)C[N@@H+]1Cc1ccc(F)c(F)c1F ZINC000668045226 488194442 /nfs/dbraw/zinc/19/44/42/488194442.db2.gz LNTYFJIKZSCVHU-APPZFPTMSA-N 1 2 245.244 2.059 20 0 BEADLO C[C@@H]1C[C@H](O)C[N@H+]1Cc1ccc(F)c(F)c1F ZINC000668045226 488194443 /nfs/dbraw/zinc/19/44/43/488194443.db2.gz LNTYFJIKZSCVHU-APPZFPTMSA-N 1 2 245.244 2.059 20 0 BEADLO Cc1cc(NC(=O)NC[C@H](C)C2CC2)c(C)c[nH+]1 ZINC000678097544 488197504 /nfs/dbraw/zinc/19/75/04/488197504.db2.gz IUDADAHAKBESCF-VIFPVBQESA-N 1 2 247.342 2.288 20 0 BEADLO Cc1ccc(C[N@@H+](Cc2ccn(C)n2)C2CC2)o1 ZINC000678134949 488198577 /nfs/dbraw/zinc/19/85/77/488198577.db2.gz CFAKYPKKAVTWSK-UHFFFAOYSA-N 1 2 245.326 2.486 20 0 BEADLO Cc1ccc(C[N@H+](Cc2ccn(C)n2)C2CC2)o1 ZINC000678134949 488198581 /nfs/dbraw/zinc/19/85/81/488198581.db2.gz CFAKYPKKAVTWSK-UHFFFAOYSA-N 1 2 245.326 2.486 20 0 BEADLO Cc1ccc(C[N@@H+](Cc2ccnn2C)C2CC2)o1 ZINC000678135893 488203724 /nfs/dbraw/zinc/20/37/24/488203724.db2.gz VMNTUNCNRTUZDD-UHFFFAOYSA-N 1 2 245.326 2.486 20 0 BEADLO Cc1ccc(C[N@H+](Cc2ccnn2C)C2CC2)o1 ZINC000678135893 488203727 /nfs/dbraw/zinc/20/37/27/488203727.db2.gz VMNTUNCNRTUZDD-UHFFFAOYSA-N 1 2 245.326 2.486 20 0 BEADLO CC1(C)CC[C@H](NC(=O)CCCn2cc[nH+]c2)C1 ZINC000678184175 488215079 /nfs/dbraw/zinc/21/50/79/488215079.db2.gz BQTMICKRFYPDBG-LBPRGKRZSA-N 1 2 249.358 2.358 20 0 BEADLO Cc1ccc2cc(C[N@@H+]3CCO[C@@H]4C[C@@H]43)[nH]c2c1 ZINC000668186229 488216843 /nfs/dbraw/zinc/21/68/43/488216843.db2.gz FCQYGEOOVDDQSO-LSDHHAIUSA-N 1 2 242.322 2.449 20 0 BEADLO Cc1ccc2cc(C[N@H+]3CCO[C@@H]4C[C@@H]43)[nH]c2c1 ZINC000668186229 488216845 /nfs/dbraw/zinc/21/68/45/488216845.db2.gz FCQYGEOOVDDQSO-LSDHHAIUSA-N 1 2 242.322 2.449 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000668746735 488225742 /nfs/dbraw/zinc/22/57/42/488225742.db2.gz UHAZLGKEFXGJAX-UPJWGTAASA-N 1 2 244.338 2.441 20 0 BEADLO CC(C)C[C@@H](C)NC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000683919784 488244966 /nfs/dbraw/zinc/24/49/66/488244966.db2.gz OKTWASYEJMETKX-SNVBAGLBSA-N 1 2 237.347 2.238 20 0 BEADLO C[C@H](O)CCCNc1cc[nH+]c(C(C)(C)C)n1 ZINC000683937895 488248230 /nfs/dbraw/zinc/24/82/30/488248230.db2.gz RZPKOFHPXMMAKV-JTQLQIEISA-N 1 2 237.347 2.347 20 0 BEADLO FC(F)C[N@@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000678637154 488275044 /nfs/dbraw/zinc/27/50/44/488275044.db2.gz BOISTYOXHJAIOD-QWRGUYRKSA-N 1 2 233.302 2.390 20 0 BEADLO FC(F)C[N@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000678637154 488275045 /nfs/dbraw/zinc/27/50/45/488275045.db2.gz BOISTYOXHJAIOD-QWRGUYRKSA-N 1 2 233.302 2.390 20 0 BEADLO C[C@H](NC(=O)CCc1[nH]cc[nH+]1)c1ccsc1 ZINC000673154494 488277919 /nfs/dbraw/zinc/27/79/19/488277919.db2.gz AVFKQRLNYPQYRY-VIFPVBQESA-N 1 2 249.339 2.281 20 0 BEADLO OCC[C@@H](Nc1cc[nH+]cc1F)c1ccccc1 ZINC000678787780 488283586 /nfs/dbraw/zinc/28/35/86/488283586.db2.gz YYWZRQVKRDHBPD-CYBMUJFWSA-N 1 2 246.285 2.178 20 0 BEADLO Cc1ccc(NC(=O)C[N@H+]2CC=CCC2)c(F)c1 ZINC000679322992 488336447 /nfs/dbraw/zinc/33/64/47/488336447.db2.gz PULIDLVCARIFST-UHFFFAOYSA-N 1 2 248.301 2.335 20 0 BEADLO Cc1ccc(NC(=O)C[N@@H+]2CC=CCC2)c(F)c1 ZINC000679322992 488336448 /nfs/dbraw/zinc/33/64/48/488336448.db2.gz PULIDLVCARIFST-UHFFFAOYSA-N 1 2 248.301 2.335 20 0 BEADLO C1=CC[N@H+](Cc2noc3c2CCCC3)CC1 ZINC000679322561 488336493 /nfs/dbraw/zinc/33/64/93/488336493.db2.gz BWAJNVSRHKDTEJ-UHFFFAOYSA-N 1 2 218.300 2.315 20 0 BEADLO C1=CC[N@@H+](Cc2noc3c2CCCC3)CC1 ZINC000679322561 488336494 /nfs/dbraw/zinc/33/64/94/488336494.db2.gz BWAJNVSRHKDTEJ-UHFFFAOYSA-N 1 2 218.300 2.315 20 0 BEADLO CC(C)Cc1noc(C[N@H+]2CC=CCC2)n1 ZINC000679322904 488336612 /nfs/dbraw/zinc/33/66/12/488336612.db2.gz CNBUSYXCRXJBOG-UHFFFAOYSA-N 1 2 221.304 2.030 20 0 BEADLO CC(C)Cc1noc(C[N@@H+]2CC=CCC2)n1 ZINC000679322904 488336613 /nfs/dbraw/zinc/33/66/13/488336613.db2.gz CNBUSYXCRXJBOG-UHFFFAOYSA-N 1 2 221.304 2.030 20 0 BEADLO CC[C@@H](Nc1ccc(N(C)CCO)c[nH+]1)C1CC1 ZINC000679069056 488305638 /nfs/dbraw/zinc/30/56/38/488305638.db2.gz AYPVKWYPOGMYOU-CYBMUJFWSA-N 1 2 249.358 2.111 20 0 BEADLO CC(C)(NCc1c[nH+]c2ccccn12)C(F)F ZINC000684414028 488309365 /nfs/dbraw/zinc/30/93/65/488309365.db2.gz QEPXSYPVEUHIJH-UHFFFAOYSA-N 1 2 239.269 2.468 20 0 BEADLO CC(C)([NH2+]Cc1cnc2ccccn12)C(F)F ZINC000684414028 488309367 /nfs/dbraw/zinc/30/93/67/488309367.db2.gz QEPXSYPVEUHIJH-UHFFFAOYSA-N 1 2 239.269 2.468 20 0 BEADLO COc1cc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)ccn1 ZINC000679223574 488320353 /nfs/dbraw/zinc/32/03/53/488320353.db2.gz QSCXSNBICZDTFQ-PWSUYJOCSA-N 1 2 238.306 2.270 20 0 BEADLO COc1cc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)ccn1 ZINC000679223574 488320355 /nfs/dbraw/zinc/32/03/55/488320355.db2.gz QSCXSNBICZDTFQ-PWSUYJOCSA-N 1 2 238.306 2.270 20 0 BEADLO C[C@@H]1CC[C@H](CNC(=O)CCCn2cc[nH+]c2)C1 ZINC000684515133 488324725 /nfs/dbraw/zinc/32/47/25/488324725.db2.gz QNUYCJRCZNGEFX-OLZOCXBDSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1cc(N2CC(C)(F)C2)nc(C2CC2)[nH+]1 ZINC000684591912 488329549 /nfs/dbraw/zinc/32/95/49/488329549.db2.gz DMCLKLIGOVSNQU-UHFFFAOYSA-N 1 2 221.279 2.211 20 0 BEADLO CC1=C[C@@H](C)CN(C(=O)CCCn2cc[nH+]c2)C1 ZINC000684709264 488339279 /nfs/dbraw/zinc/33/92/79/488339279.db2.gz MJZQYOUTMBJENL-GFCCVEGCSA-N 1 2 247.342 2.088 20 0 BEADLO Fc1cccn2cc(C[N@H+]3CC=CCC3)nc12 ZINC000679357553 488344314 /nfs/dbraw/zinc/34/43/14/488344314.db2.gz ZVEMSGFGUOEDLW-UHFFFAOYSA-N 1 2 231.274 2.235 20 0 BEADLO Fc1cccn2cc(C[N@@H+]3CC=CCC3)nc12 ZINC000679357553 488344315 /nfs/dbraw/zinc/34/43/15/488344315.db2.gz ZVEMSGFGUOEDLW-UHFFFAOYSA-N 1 2 231.274 2.235 20 0 BEADLO Fc1ccc2c(c1)CC[N@@H+](Cc1cn[nH]c1)C2 ZINC000679420794 488351499 /nfs/dbraw/zinc/35/14/99/488351499.db2.gz HKDGXRCPMGNSSO-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO Fc1ccc2c(c1)CC[N@H+](Cc1cn[nH]c1)C2 ZINC000679420794 488351500 /nfs/dbraw/zinc/35/15/00/488351500.db2.gz HKDGXRCPMGNSSO-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO C[C@H]1CCC[C@H]1CNC(=O)CCCn1cc[nH+]c1 ZINC000684945477 488354747 /nfs/dbraw/zinc/35/47/47/488354747.db2.gz FQNRLJJQWBBICJ-STQMWFEESA-N 1 2 249.358 2.216 20 0 BEADLO CO[C@@H](C)CCC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000679845312 488368448 /nfs/dbraw/zinc/36/84/48/488368448.db2.gz RPZHSZGTOIGALS-JTQLQIEISA-N 1 2 247.298 2.088 20 0 BEADLO CCc1nc(C[N@H+]2CC=CCC2)cs1 ZINC000679322155 490114054 /nfs/dbraw/zinc/11/40/54/490114054.db2.gz CPHRHQCVNSJQPM-UHFFFAOYSA-N 1 2 208.330 2.467 20 0 BEADLO CCc1nc(C[N@@H+]2CC=CCC2)cs1 ZINC000679322155 490114060 /nfs/dbraw/zinc/11/40/60/490114060.db2.gz CPHRHQCVNSJQPM-UHFFFAOYSA-N 1 2 208.330 2.467 20 0 BEADLO CCCC(C)(C)C(=O)N1CCn2cc(C)[nH+]c2C1 ZINC000651700730 490134083 /nfs/dbraw/zinc/13/40/83/490134083.db2.gz QRRUVTKKLNLSHC-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO C[C@H]1CN(Cc2[nH]cc[nH+]2)CC2(CCCCC2)O1 ZINC000653906676 490156360 /nfs/dbraw/zinc/15/63/60/490156360.db2.gz WOLORTYILOSBFE-LBPRGKRZSA-N 1 2 249.358 2.333 20 0 BEADLO C[C@H]1C[N@H+](Cc2ncc[nH]2)CC2(CCCCC2)O1 ZINC000653906676 490156363 /nfs/dbraw/zinc/15/63/63/490156363.db2.gz WOLORTYILOSBFE-LBPRGKRZSA-N 1 2 249.358 2.333 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ncc[nH]2)CC2(CCCCC2)O1 ZINC000653906676 490156368 /nfs/dbraw/zinc/15/63/68/490156368.db2.gz WOLORTYILOSBFE-LBPRGKRZSA-N 1 2 249.358 2.333 20 0 BEADLO Cc1cc(NCC2(CO)CCCCC2)nc[nH+]1 ZINC000122848279 490178436 /nfs/dbraw/zinc/17/84/36/490178436.db2.gz LEMVUBAHWVHYFE-UHFFFAOYSA-N 1 2 235.331 2.140 20 0 BEADLO C[C@H](c1csnn1)[NH+]1C2CCC1CC2 ZINC000649242782 490182858 /nfs/dbraw/zinc/18/28/58/490182858.db2.gz PIBFPCVXTWOOEI-AFPNSQJFSA-N 1 2 209.318 2.226 20 0 BEADLO C[C@@H](c1csnn1)[NH+]1C2CCC1CC2 ZINC000649242783 490183034 /nfs/dbraw/zinc/18/30/34/490183034.db2.gz PIBFPCVXTWOOEI-UEJVZZJDSA-N 1 2 209.318 2.226 20 0 BEADLO Cc1nc(N[C@@H]2C[C@H]2C2CCC2)cc[nH+]1 ZINC000425269940 490195191 /nfs/dbraw/zinc/19/51/91/490195191.db2.gz DTWMZCVMSPOINV-WDEREUQCSA-N 1 2 203.289 2.386 20 0 BEADLO COc1ccc(C[NH2+]Cc2cocn2)c(C)c1 ZINC000580810662 490230503 /nfs/dbraw/zinc/23/05/03/490230503.db2.gz HBTIWKFNKTYMIQ-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO C[C@H](N[C@@H](C)c1[nH+]ccn1C)c1nccs1 ZINC000070732294 490236770 /nfs/dbraw/zinc/23/67/70/490236770.db2.gz CFYQEMPSNRQLMA-IUCAKERBSA-N 1 2 236.344 2.288 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1nccn1C)c1nccs1 ZINC000070732294 490236774 /nfs/dbraw/zinc/23/67/74/490236774.db2.gz CFYQEMPSNRQLMA-IUCAKERBSA-N 1 2 236.344 2.288 20 0 BEADLO FC1CC2(C1)C[NH+](Cc1cnc(C3CC3)nc1)C2 ZINC000656693597 490278758 /nfs/dbraw/zinc/27/87/58/490278758.db2.gz MSEPGOSKPIQIHP-UHFFFAOYSA-N 1 2 247.317 2.288 20 0 BEADLO C[C@H]1C[C@@H]([NH2+]Cc2ccsc2)c2ncnn21 ZINC000657571111 490285962 /nfs/dbraw/zinc/28/59/62/490285962.db2.gz WATUXQXACFSRGZ-WCBMZHEXSA-N 1 2 234.328 2.135 20 0 BEADLO C[C@@H]1C[C@H]([NH2+]Cc2ccsc2)c2ncnn21 ZINC000657571110 490286172 /nfs/dbraw/zinc/28/61/72/490286172.db2.gz WATUXQXACFSRGZ-SCZZXKLOSA-N 1 2 234.328 2.135 20 0 BEADLO Cc1noc(C[N@@H+]2CCc3cccc(C)c3C2)n1 ZINC000277347515 490293014 /nfs/dbraw/zinc/29/30/14/490293014.db2.gz WKSWLZGHUGADTN-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1noc(C[N@H+]2CCc3cccc(C)c3C2)n1 ZINC000277347515 490293018 /nfs/dbraw/zinc/29/30/18/490293018.db2.gz WKSWLZGHUGADTN-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO CC(C)[C@@H](NC(=O)Cc1ccco1)c1[nH]cc[nH+]1 ZINC000283012798 490353685 /nfs/dbraw/zinc/35/36/85/490353685.db2.gz MYLHQDDHZGRESX-GFCCVEGCSA-N 1 2 247.298 2.059 20 0 BEADLO COc1ccc[nH+]c1NCc1ncccc1C ZINC000128053665 490568875 /nfs/dbraw/zinc/56/88/75/490568875.db2.gz BSVSUDMZOBZJKA-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO Cc1nc(C[N@H+]2CC3(CCC3)OC[C@@H]2C)co1 ZINC000661462785 490681144 /nfs/dbraw/zinc/68/11/44/490681144.db2.gz KCQSUACJXHUHDR-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO Cc1nc(C[N@@H+]2CC3(CCC3)OC[C@@H]2C)co1 ZINC000661462785 490681147 /nfs/dbraw/zinc/68/11/47/490681147.db2.gz KCQSUACJXHUHDR-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO Cc1ncsc1C[NH2+][C@@H](C)C(F)F ZINC000228513239 491095511 /nfs/dbraw/zinc/09/55/11/491095511.db2.gz SHDGPZZTMQKORP-LURJTMIESA-N 1 2 206.261 2.195 20 0 BEADLO Cc1ncsc1C[NH2+][C@H](C)C(F)F ZINC000228513243 491095521 /nfs/dbraw/zinc/09/55/21/491095521.db2.gz SHDGPZZTMQKORP-ZCFIWIBFSA-N 1 2 206.261 2.195 20 0 BEADLO C[C@H](CC(=O)NCc1c[nH+]c[nH]1)CC(C)(C)C ZINC000088753606 491108276 /nfs/dbraw/zinc/10/82/76/491108276.db2.gz XIAPFAZWTGRRGE-SNVBAGLBSA-N 1 2 237.347 2.488 20 0 BEADLO C[C@H](CC(=O)NCc1c[nH]c[nH+]1)CC(C)(C)C ZINC000088753606 491108278 /nfs/dbraw/zinc/10/82/78/491108278.db2.gz XIAPFAZWTGRRGE-SNVBAGLBSA-N 1 2 237.347 2.488 20 0 BEADLO CCc1nnc(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)s1 ZINC000660931526 491117926 /nfs/dbraw/zinc/11/79/26/491117926.db2.gz OTKGBXILRBNBRN-UWVGGRQHSA-N 1 2 237.372 2.475 20 0 BEADLO CCc1nnc(C[N@H+]2C[C@@H]3CCCC[C@@H]32)s1 ZINC000660931526 491117927 /nfs/dbraw/zinc/11/79/27/491117927.db2.gz OTKGBXILRBNBRN-UWVGGRQHSA-N 1 2 237.372 2.475 20 0 BEADLO Cc1ncc([C@@H](C)[NH2+]Cc2nccn2C)s1 ZINC000090407849 491126320 /nfs/dbraw/zinc/12/63/20/491126320.db2.gz GBDJWXPWSVKVMM-MRVPVSSYSA-N 1 2 236.344 2.036 20 0 BEADLO C[C@@H]([NH2+]Cc1ccccc1F)c1ncc[nH]1 ZINC000124814779 491128619 /nfs/dbraw/zinc/12/86/19/491128619.db2.gz CDNQZECFKMEXDU-SECBINFHSA-N 1 2 219.263 2.400 20 0 BEADLO CCCc1csc(C[N@@H+]2CCCOCC2)n1 ZINC000426397132 491131146 /nfs/dbraw/zinc/13/11/46/491131146.db2.gz QYQZQYOYGXQTIP-UHFFFAOYSA-N 1 2 240.372 2.318 20 0 BEADLO CCCc1csc(C[N@H+]2CCCOCC2)n1 ZINC000426397132 491131147 /nfs/dbraw/zinc/13/11/47/491131147.db2.gz QYQZQYOYGXQTIP-UHFFFAOYSA-N 1 2 240.372 2.318 20 0 BEADLO Cc1cc(N[C@@H](C)C[C@@H]2CCOC2)nc[nH+]1 ZINC000309525014 491149958 /nfs/dbraw/zinc/14/99/58/491149958.db2.gz CLYLERLXVZGSOR-QWRGUYRKSA-N 1 2 221.304 2.012 20 0 BEADLO Fc1c[nH+]ccc1NCCc1ccccn1 ZINC000309501927 491150459 /nfs/dbraw/zinc/15/04/59/491150459.db2.gz LUXHOJHRLQLTNB-UHFFFAOYSA-N 1 2 217.247 2.270 20 0 BEADLO Cc1nc2[nH]ccc2c(NCCC2CC2)[nH+]1 ZINC000309838677 491156959 /nfs/dbraw/zinc/15/69/59/491156959.db2.gz CAEFIRCOXXMVCY-UHFFFAOYSA-N 1 2 216.288 2.478 20 0 BEADLO c1[nH]cc(NCc2cccc3c2OCCCO3)[nH+]1 ZINC000515160674 491160741 /nfs/dbraw/zinc/16/07/41/491160741.db2.gz VVAMUWDAEVFAPF-UHFFFAOYSA-N 1 2 245.282 2.183 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)O[C@H]1CC[N@@H+](CCF)C1 ZINC000813094539 582577933 /nfs/dbraw/zinc/57/79/33/582577933.db2.gz TVNSWYXSWLCNOS-GRYCIOLGSA-N 1 2 243.322 2.010 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493862497 533730836 /nfs/dbraw/zinc/73/08/36/533730836.db2.gz YKKDRZUYJUVWGB-BYAJROORSA-N 1 2 247.342 2.460 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)/C=C/c2[nH]cc[nH+]2)[C@H]1C ZINC000493136970 533860772 /nfs/dbraw/zinc/86/07/72/533860772.db2.gz ZKJCMJKDEGBFJV-VRYWAUBISA-N 1 2 247.342 2.364 20 0 BEADLO C[C@H]([NH2+]Cc1ncc(C2CC2)o1)c1cn[nH]c1 ZINC000494705020 533947422 /nfs/dbraw/zinc/94/74/22/533947422.db2.gz VILBEQVOIYRQTG-QMMMGPOBSA-N 1 2 232.287 2.126 20 0 BEADLO C[C@H](O)CCC[N@@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000494229616 534054707 /nfs/dbraw/zinc/05/47/07/534054707.db2.gz DNHBZKXOEJUNOS-ZJUUUORDSA-N 1 2 221.291 2.125 20 0 BEADLO C[C@H](O)CCC[N@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000494229616 534054713 /nfs/dbraw/zinc/05/47/13/534054713.db2.gz DNHBZKXOEJUNOS-ZJUUUORDSA-N 1 2 221.291 2.125 20 0 BEADLO C[C@@H]1CC2(CCC2)CN1C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493676216 534152663 /nfs/dbraw/zinc/15/26/63/534152663.db2.gz SGPBJCSZUNZAAI-PGLGOXFNSA-N 1 2 245.326 2.214 20 0 BEADLO C[C@@H]1CN(C(=O)C=Cc2c[nH]c[nH+]2)CC(C)(C)C1 ZINC000492776532 534276884 /nfs/dbraw/zinc/27/68/84/534276884.db2.gz ZWBJANUFIRYUMS-WYGGZMRJSA-N 1 2 247.342 2.318 20 0 BEADLO CCc1nc(N2C[C@@H](C)O[C@@H](CC)C2)cc(C)[nH+]1 ZINC000342228239 536126597 /nfs/dbraw/zinc/12/65/97/536126597.db2.gz WRHGWJVIIRMCJS-NEPJUHHUSA-N 1 2 249.358 2.351 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)Nc1ccccc1F ZINC000478686813 534496767 /nfs/dbraw/zinc/49/67/67/534496767.db2.gz JZWWHFAQCZKPDE-UHFFFAOYSA-N 1 2 233.246 2.120 20 0 BEADLO CCc1nn(C[N@@H+]2CCC[C@H](C)C2)c(=S)o1 ZINC001332112364 974955535 /nfs/dbraw/zinc/95/55/35/974955535.db2.gz QHSGPWVZKLISAV-VIFPVBQESA-N 1 2 241.360 2.457 20 0 BEADLO CCc1nn(C[N@H+]2CCC[C@H](C)C2)c(=S)o1 ZINC001332112364 974955541 /nfs/dbraw/zinc/95/55/41/974955541.db2.gz QHSGPWVZKLISAV-VIFPVBQESA-N 1 2 241.360 2.457 20 0 BEADLO CCc1nn(C[N@@H+]2CCC[C@@H](C)C2)c(=S)o1 ZINC001332112362 974957029 /nfs/dbraw/zinc/95/70/29/974957029.db2.gz QHSGPWVZKLISAV-SECBINFHSA-N 1 2 241.360 2.457 20 0 BEADLO CCc1nn(C[N@H+]2CCC[C@@H](C)C2)c(=S)o1 ZINC001332112362 974957037 /nfs/dbraw/zinc/95/70/37/974957037.db2.gz QHSGPWVZKLISAV-SECBINFHSA-N 1 2 241.360 2.457 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)/C=C\C1CCCC1 ZINC000493495921 534718748 /nfs/dbraw/zinc/71/87/48/534718748.db2.gz WBOZODWYFLNWTI-SREVYHEPSA-N 1 2 233.315 2.081 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)N1CCC[C@H]1C1CCC1 ZINC000493588516 534786472 /nfs/dbraw/zinc/78/64/72/534786472.db2.gz MEPMBYKZEXMING-SYTKJHMZSA-N 1 2 245.326 2.214 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N(CC1CC1)CC1CC1 ZINC000493820218 534800807 /nfs/dbraw/zinc/80/08/07/534800807.db2.gz KVRSTLYWJYVEDR-WAYWQWQTSA-N 1 2 245.326 2.072 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CCC[C@@H]2CCC[C@@H]21 ZINC000493698708 534801015 /nfs/dbraw/zinc/80/10/15/534801015.db2.gz UPHKWSRSTCMZCO-XZNJXGJCSA-N 1 2 245.326 2.214 20 0 BEADLO CC(=O)c1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)cc1 ZINC000336196383 534843807 /nfs/dbraw/zinc/84/38/07/534843807.db2.gz YXNJPRUWRPGERT-GASCZTMLSA-N 1 2 245.322 2.252 20 0 BEADLO CC(=O)c1ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)cc1 ZINC000336196383 534843808 /nfs/dbraw/zinc/84/38/08/534843808.db2.gz YXNJPRUWRPGERT-GASCZTMLSA-N 1 2 245.322 2.252 20 0 BEADLO CC1(C)C[C@H]1C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000347997255 534902282 /nfs/dbraw/zinc/90/22/82/534902282.db2.gz RIMGQICJISLHFJ-UWVGGRQHSA-N 1 2 233.315 2.119 20 0 BEADLO CC(C)c1nc(N2CCCO[C@H](C)C2)cc[nH+]1 ZINC000171918004 534906930 /nfs/dbraw/zinc/90/69/30/534906930.db2.gz RVVRIRQNRDIWDD-LLVKDONJSA-N 1 2 235.331 2.215 20 0 BEADLO CC(C)(C)[C@H]1CCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493161640 526729650 /nfs/dbraw/zinc/72/96/50/526729650.db2.gz TWPYABURWWGDHK-ZWNMCFTASA-N 1 2 247.342 2.318 20 0 BEADLO CC(C)(NC(=O)C=Cc1c[nH]c[nH+]1)C1CCC1 ZINC000493252747 527262504 /nfs/dbraw/zinc/26/25/04/527262504.db2.gz HKCRPBGDXGAKIL-VOTSOKGWSA-N 1 2 233.315 2.118 20 0 BEADLO CC(C)(C)C1CC(NC(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493237715 527624831 /nfs/dbraw/zinc/62/48/31/527624831.db2.gz JIASVTSTJIOHOI-SNAWJCMRSA-N 1 2 247.342 2.364 20 0 BEADLO CCC1(NC(=O)C=Cc2c[nH]c[nH+]2)CCCC1 ZINC000493316091 527771397 /nfs/dbraw/zinc/77/13/97/527771397.db2.gz GOAJLDOACOBEEC-WAYWQWQTSA-N 1 2 233.315 2.262 20 0 BEADLO CC(C)[C@H]1CCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492899764 527780080 /nfs/dbraw/zinc/78/00/80/527780080.db2.gz MPCNDNOLGPQPGM-FOQNGQEVSA-N 1 2 233.315 2.070 20 0 BEADLO CC(C)CN(C(=O)/C=C/c1[nH]cc[nH+]1)C1CC1 ZINC000493672426 527888114 /nfs/dbraw/zinc/88/81/14/527888114.db2.gz GZMLOMKGLVEWLG-AATRIKPKSA-N 1 2 233.315 2.070 20 0 BEADLO CC(C)C[C@@H](C)CC(=O)NCCc1[nH]cc[nH+]1 ZINC000174759073 528247878 /nfs/dbraw/zinc/24/78/78/528247878.db2.gz AFFIFYYYOMNMQU-LLVKDONJSA-N 1 2 237.347 2.141 20 0 BEADLO CCCCN(C(=O)/C=C\c1[nH]cc[nH+]1)C1CC1 ZINC000493186392 528298079 /nfs/dbraw/zinc/29/80/79/528298079.db2.gz IYLWPJIHMQJSEY-SREVYHEPSA-N 1 2 233.315 2.214 20 0 BEADLO CC(C)C[C@H](C)CC(=O)NCCc1[nH]cc[nH+]1 ZINC000174759084 528456878 /nfs/dbraw/zinc/45/68/78/528456878.db2.gz AFFIFYYYOMNMQU-NSHDSACASA-N 1 2 237.347 2.141 20 0 BEADLO CC(C)C[C@H]1CCCN1C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493157148 528589461 /nfs/dbraw/zinc/58/94/61/528589461.db2.gz PZELDZZUPCXMKI-BTDICHCPSA-N 1 2 247.342 2.460 20 0 BEADLO CC(C)C[C@H]1CCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493196956 528589604 /nfs/dbraw/zinc/58/96/04/528589604.db2.gz YCAYOPDEFXFKEQ-CFHLNLSMSA-N 1 2 247.342 2.460 20 0 BEADLO CC(C)N(CC1CCC1)C(=O)/C=C\c1[nH]cc[nH+]1 ZINC000493124544 528871850 /nfs/dbraw/zinc/87/18/50/528871850.db2.gz WPPRRHLGIZTPKN-SREVYHEPSA-N 1 2 247.342 2.460 20 0 BEADLO CCN(C(=O)/C=C\c1[nH]cc[nH+]1)C1CCCC1 ZINC000493584426 528911407 /nfs/dbraw/zinc/91/14/07/528911407.db2.gz LNDCGCPIJIFQEN-FPLPWBNLSA-N 1 2 233.315 2.214 20 0 BEADLO CC1(C)CCCN(C(=O)/C=C/c2[nH]cc[nH+]2)CC1 ZINC000493807644 528923551 /nfs/dbraw/zinc/92/35/51/528923551.db2.gz DSRAEVWGYDGHHJ-SNAWJCMRSA-N 1 2 247.342 2.462 20 0 BEADLO CCC1(C)CCN(C(=O)/C=C/c2[nH]cc[nH+]2)CC1 ZINC000493611364 529016728 /nfs/dbraw/zinc/01/67/28/529016728.db2.gz BZEMQZXVMQSFKH-SNAWJCMRSA-N 1 2 247.342 2.462 20 0 BEADLO CCC1(CC)CN(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493568659 529060409 /nfs/dbraw/zinc/06/04/09/529060409.db2.gz PGXJDJJUTRIUTF-AATRIKPKSA-N 1 2 233.315 2.072 20 0 BEADLO CC1(C)CN(C(=O)/C=C/c2[nH]cc[nH+]2)[C@@H]1C1CC1 ZINC000493646068 529061041 /nfs/dbraw/zinc/06/10/41/529061041.db2.gz FOHAUVGCHSJMDT-URWSZGRFSA-N 1 2 245.326 2.070 20 0 BEADLO CC[C@H]1CC[C@H](NC(=O)CCc2[nH]cc[nH+]2)CC1 ZINC000479654653 529254272 /nfs/dbraw/zinc/25/42/72/529254272.db2.gz HHDAEKKYMMTMRX-HAQNSBGRSA-N 1 2 249.358 2.427 20 0 BEADLO CCCNC(=O)c1cc(C)ccc1-n1cc[nH+]c1 ZINC000074167376 535123690 /nfs/dbraw/zinc/12/36/90/535123690.db2.gz XVHRJRRMRPXFGG-UHFFFAOYSA-N 1 2 243.310 2.321 20 0 BEADLO CCCCN(C(=O)CCc1c[nH+]cn1C)C1CC1 ZINC000276544441 535177420 /nfs/dbraw/zinc/17/74/20/535177420.db2.gz GRTRAPJLQLPQIN-UHFFFAOYSA-N 1 2 249.358 2.144 20 0 BEADLO CC1([C@@H]2CCCN(c3cccc[nH+]3)C2)OCCO1 ZINC000273022017 535205206 /nfs/dbraw/zinc/20/52/06/535205206.db2.gz CBFZVXBAVWLVEO-GFCCVEGCSA-N 1 2 248.326 2.061 20 0 BEADLO CC1=C(C(=O)Nc2cc[nH+]c(C)c2)CCC1 ZINC000336146415 535220018 /nfs/dbraw/zinc/22/00/18/535220018.db2.gz GEUWUFTYLPZGHK-UHFFFAOYSA-N 1 2 216.284 2.251 20 0 BEADLO CC1(C)CCCC[C@H]1C(=O)NCCc1[nH]cc[nH+]1 ZINC000192585159 535294615 /nfs/dbraw/zinc/29/46/15/535294615.db2.gz XYDGFHQPSNLRJX-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO CC[C@@H](C)CC(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000164502938 535475332 /nfs/dbraw/zinc/47/53/32/535475332.db2.gz HHGLVIWKRZIQRW-ZJUUUORDSA-N 1 2 223.320 2.413 20 0 BEADLO CC[N@H+](CCOC)Cc1cc(C(C)(C)C)on1 ZINC000351474837 535748214 /nfs/dbraw/zinc/74/82/14/535748214.db2.gz HILDTNPHCVFBQY-UHFFFAOYSA-N 1 2 240.347 2.440 20 0 BEADLO CC[N@@H+](CCOC)Cc1cc(C(C)(C)C)on1 ZINC000351474837 535748224 /nfs/dbraw/zinc/74/82/24/535748224.db2.gz HILDTNPHCVFBQY-UHFFFAOYSA-N 1 2 240.347 2.440 20 0 BEADLO CCC[C@H]1C[C@H]1C(=O)NCc1c[nH+]ccc1OC ZINC000348414413 535749727 /nfs/dbraw/zinc/74/97/27/535749727.db2.gz ROKMTZCOFBHCOR-CMPLNLGQSA-N 1 2 248.326 2.143 20 0 BEADLO CCc1noc([C@H](C)[N@@H+]2CC[C@](C)(F)C2)n1 ZINC000335940437 535898812 /nfs/dbraw/zinc/89/88/12/535898812.db2.gz HPNULLPGYSWVML-KWQFWETISA-N 1 2 227.283 2.127 20 0 BEADLO CCc1noc([C@H](C)[N@H+]2CC[C@](C)(F)C2)n1 ZINC000335940437 535898817 /nfs/dbraw/zinc/89/88/17/535898817.db2.gz HPNULLPGYSWVML-KWQFWETISA-N 1 2 227.283 2.127 20 0 BEADLO CCc1nc(N2C[C@@H](C)OC[C@@H]2CC)cc(C)[nH+]1 ZINC000287802633 536125719 /nfs/dbraw/zinc/12/57/19/536125719.db2.gz JUTAMUFAXBLPEZ-NEPJUHHUSA-N 1 2 249.358 2.351 20 0 BEADLO CCc1nc(N2C[C@H](C)O[C@H](C)[C@H]2C)cc(C)[nH+]1 ZINC000342959622 536127018 /nfs/dbraw/zinc/12/70/18/536127018.db2.gz KVWUWISCXJNTTK-QJPTWQEYSA-N 1 2 249.358 2.350 20 0 BEADLO CSCC[C@@H](C)Nc1cc(N(C)C)nc[nH+]1 ZINC000892605695 582926955 /nfs/dbraw/zinc/92/69/55/582926955.db2.gz VFJVAVZCFZAPEF-SECBINFHSA-N 1 2 240.376 2.096 20 0 BEADLO CSCC[C@@H](C)Nc1cc(N(C)C)[nH+]cn1 ZINC000892605695 582926957 /nfs/dbraw/zinc/92/69/57/582926957.db2.gz VFJVAVZCFZAPEF-SECBINFHSA-N 1 2 240.376 2.096 20 0 BEADLO Cn1cc(Cl)c(C[N@H+](C)C2CCC2)n1 ZINC000335547340 536486616 /nfs/dbraw/zinc/48/66/16/536486616.db2.gz DXUCGEPNBWGYRS-UHFFFAOYSA-N 1 2 213.712 2.058 20 0 BEADLO Cn1cc(Cl)c(C[N@@H+](C)C2CCC2)n1 ZINC000335547340 536486617 /nfs/dbraw/zinc/48/66/17/536486617.db2.gz DXUCGEPNBWGYRS-UHFFFAOYSA-N 1 2 213.712 2.058 20 0 BEADLO COC(=O)[C@H]([NH2+]CCc1ccccc1C)C1CC1 ZINC000227767724 536736442 /nfs/dbraw/zinc/73/64/42/536736442.db2.gz QLSHLWXTCRJUCK-CQSZACIVSA-N 1 2 247.338 2.079 20 0 BEADLO COC(=O)c1sccc1C[N@@H+]1C[C@@H](C)[C@@H]1C ZINC000339582863 566373694 /nfs/dbraw/zinc/37/36/94/566373694.db2.gz RZDSGDIQQOUORC-BDAKNGLRSA-N 1 2 239.340 2.375 20 0 BEADLO COC(=O)c1sccc1C[N@H+]1C[C@@H](C)[C@@H]1C ZINC000339582863 566373699 /nfs/dbraw/zinc/37/36/99/566373699.db2.gz RZDSGDIQQOUORC-BDAKNGLRSA-N 1 2 239.340 2.375 20 0 BEADLO CC[C@H](C)C(=O)O[C@@H]1CCn2c(C)c[nH+]c21 ZINC000893519454 583156222 /nfs/dbraw/zinc/15/62/22/583156222.db2.gz QALUUQNSDOEYCW-WCBMZHEXSA-N 1 2 222.288 2.226 20 0 BEADLO C[C@@H](O)c1cccc(NCCCOC(F)F)[nH+]1 ZINC000893718556 583212410 /nfs/dbraw/zinc/21/24/10/583212410.db2.gz SRIGIMSBWWMXQJ-MRVPVSSYSA-N 1 2 246.257 2.176 20 0 BEADLO CN(C)c1cc(N[C@H]2CCC2(C)C)[nH+]cn1 ZINC000893859087 583233774 /nfs/dbraw/zinc/23/37/74/583233774.db2.gz HNPODLXLVUDSFA-VIFPVBQESA-N 1 2 220.320 2.143 20 0 BEADLO CN(C)c1cc(N[C@H]2CCC2(C)C)nc[nH+]1 ZINC000893859087 583233775 /nfs/dbraw/zinc/23/37/75/583233775.db2.gz HNPODLXLVUDSFA-VIFPVBQESA-N 1 2 220.320 2.143 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cc(C)co2)CCO1 ZINC000893921052 583247668 /nfs/dbraw/zinc/24/76/68/583247668.db2.gz ZOTIUBVAVRMNSB-NSHDSACASA-N 1 2 209.289 2.199 20 0 BEADLO CCN1CC[N@H+](Cc2cc(C)co2)C[C@H]1C ZINC000894014078 583275448 /nfs/dbraw/zinc/27/54/48/583275448.db2.gz IEMMGDYUJCHEKS-GFCCVEGCSA-N 1 2 222.332 2.114 20 0 BEADLO CCN1CC[N@@H+](Cc2cc(C)co2)C[C@H]1C ZINC000894014078 583275450 /nfs/dbraw/zinc/27/54/50/583275450.db2.gz IEMMGDYUJCHEKS-GFCCVEGCSA-N 1 2 222.332 2.114 20 0 BEADLO CCN1CC[N@H+](Cc2cc(C)co2)C[C@@H]1C ZINC000894014079 583275715 /nfs/dbraw/zinc/27/57/15/583275715.db2.gz IEMMGDYUJCHEKS-LBPRGKRZSA-N 1 2 222.332 2.114 20 0 BEADLO CCN1CC[N@@H+](Cc2cc(C)co2)C[C@@H]1C ZINC000894014079 583275717 /nfs/dbraw/zinc/27/57/17/583275717.db2.gz IEMMGDYUJCHEKS-LBPRGKRZSA-N 1 2 222.332 2.114 20 0 BEADLO ClC1(C2=CSC3=[NH+]CCN23)CC1 ZINC000853000635 588714885 /nfs/dbraw/zinc/71/48/85/588714885.db2.gz GBLSOGVHKXCZGI-UHFFFAOYSA-N 1 2 200.694 2.018 20 0 BEADLO CO[C@H](CO[NH+]=C(N)c1ccccc1)C1CCC1 ZINC000853637497 588751283 /nfs/dbraw/zinc/75/12/83/588751283.db2.gz UFDRYQCSDRZWQH-CYBMUJFWSA-N 1 2 248.326 2.348 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OC[C@H]1CCCC[C@@H]1C ZINC000853673129 588754702 /nfs/dbraw/zinc/75/47/02/588754702.db2.gz AZPKVQMZYSLDPB-HBNTYKKESA-N 1 2 228.336 2.346 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OCc1ccsc1Cl ZINC000853674049 588754990 /nfs/dbraw/zinc/75/49/90/588754990.db2.gz PTMWKCGDYGXPAN-ZCFIWIBFSA-N 1 2 248.735 2.435 20 0 BEADLO CC(C)[C@@H](C)O[NH+]=C(N)COC(C)(C)C ZINC000853689191 588756518 /nfs/dbraw/zinc/75/65/18/588756518.db2.gz ZQNFGKDVCWZXAU-SECBINFHSA-N 1 2 216.325 2.344 20 0 BEADLO Cc1nc(C)c(COc2cc[nH+]cc2)o1 ZINC000853691541 588756843 /nfs/dbraw/zinc/75/68/43/588756843.db2.gz XCCJEYMTDPZOGJ-UHFFFAOYSA-N 1 2 204.229 2.265 20 0 BEADLO CC(C)=CCCO[NH+]=C(N)[C@H]1CCCO1 ZINC000853697464 588757487 /nfs/dbraw/zinc/75/74/87/588757487.db2.gz ICRUGIXJQNINHT-SNVBAGLBSA-N 1 2 212.293 2.020 20 0 BEADLO C[C@@H]1CCCC[C@H]1CO[NH+]=C(N)[C@@H]1CCCO1 ZINC000853698886 588757707 /nfs/dbraw/zinc/75/77/07/588757707.db2.gz URQNCCAUYDVGBB-WOPDTQHZSA-N 1 2 240.347 2.490 20 0 BEADLO CC(C)c1nc(N[C@H](C)C2(CO)CC2)cc[nH+]1 ZINC000853803843 588764292 /nfs/dbraw/zinc/76/42/92/588764292.db2.gz LJVXUQKSRYXTAS-SNVBAGLBSA-N 1 2 235.331 2.173 20 0 BEADLO Cn1cc[nH+]c1-c1ccc(N=S(C)(C)=O)cc1 ZINC000854185611 588778427 /nfs/dbraw/zinc/77/84/27/588778427.db2.gz DMOZTWZFIUSEQG-UHFFFAOYSA-N 1 2 249.339 2.446 20 0 BEADLO CC[C@@H](NC(=O)Cc1[nH]cc[nH+]1)C1CCCC1 ZINC000854854170 588813493 /nfs/dbraw/zinc/81/34/93/588813493.db2.gz OGRQCGCPMBDALE-LLVKDONJSA-N 1 2 235.331 2.037 20 0 BEADLO CC1(C)CCC[C@H](CNC(=O)Cc2[nH]cc[nH+]2)C1 ZINC000854890502 588815613 /nfs/dbraw/zinc/81/56/13/588815613.db2.gz ZWMFHWRFCIEVMI-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO CC(C)(C)C[C@@H]1CCN(C(=O)Cc2[nH]cc[nH+]2)C1 ZINC000854892784 588815709 /nfs/dbraw/zinc/81/57/09/588815709.db2.gz FBUWGVRIIZUNAM-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H]1CC/C(=C/C(=O)N(C)Cc2c[nH+]c[nH]2)C1 ZINC000855134169 588822769 /nfs/dbraw/zinc/82/27/69/588822769.db2.gz HNVSSYNUZTYHTG-CHPNCVJKSA-N 1 2 233.315 2.115 20 0 BEADLO C[C@@H]1CC/C(=C/C(=O)N(C)Cc2c[nH]c[nH+]2)C1 ZINC000855134169 588822770 /nfs/dbraw/zinc/82/27/70/588822770.db2.gz HNVSSYNUZTYHTG-CHPNCVJKSA-N 1 2 233.315 2.115 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)C=C(C1CC1)C1CC1 ZINC000855134750 588822907 /nfs/dbraw/zinc/82/29/07/588822907.db2.gz ZAPPIRVAEILYIV-UHFFFAOYSA-N 1 2 245.326 2.115 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)C=C(C1CC1)C1CC1 ZINC000855134750 588822908 /nfs/dbraw/zinc/82/29/08/588822908.db2.gz ZAPPIRVAEILYIV-UHFFFAOYSA-N 1 2 245.326 2.115 20 0 BEADLO Cc1ccc([C@@H](C)C(=O)N(C)Cc2c[nH+]c[nH]2)o1 ZINC000855134399 588822984 /nfs/dbraw/zinc/82/29/84/588822984.db2.gz MWTYITICOWKJQE-SNVBAGLBSA-N 1 2 247.298 2.073 20 0 BEADLO Cc1ccc([C@@H](C)C(=O)N(C)Cc2c[nH]c[nH+]2)o1 ZINC000855134399 588822985 /nfs/dbraw/zinc/82/29/85/588822985.db2.gz MWTYITICOWKJQE-SNVBAGLBSA-N 1 2 247.298 2.073 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000855135996 588823024 /nfs/dbraw/zinc/82/30/24/588823024.db2.gz KSJMASGOHAQORL-UXBLZVDNSA-N 1 2 235.331 2.361 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000855135996 588823025 /nfs/dbraw/zinc/82/30/25/588823025.db2.gz KSJMASGOHAQORL-UXBLZVDNSA-N 1 2 235.331 2.361 20 0 BEADLO Cc1nc(N2CC[C@@H]3C[C@@H]32)c(C)c(C)[nH+]1 ZINC000804689403 582526997 /nfs/dbraw/zinc/52/69/97/582526997.db2.gz OIPMQLUIACHPNQ-MNOVXSKESA-N 1 2 203.289 2.000 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)O[C@H]1CC[N@H+](CCF)C1 ZINC000813094539 582577930 /nfs/dbraw/zinc/57/79/30/582577930.db2.gz TVNSWYXSWLCNOS-GRYCIOLGSA-N 1 2 243.322 2.010 20 0 BEADLO Cc1[nH+]c2ccccn2c1CNC(=O)CCCF ZINC000890849066 582581066 /nfs/dbraw/zinc/58/10/66/582581066.db2.gz GBBYJBRWDDUEIP-UHFFFAOYSA-N 1 2 249.289 2.009 20 0 BEADLO CC1(C)C(C)(C)C1(C)NC(=O)CCc1[nH]cc[nH+]1 ZINC000891161149 582617299 /nfs/dbraw/zinc/61/72/99/582617299.db2.gz BABWLRAEFWOAMS-UHFFFAOYSA-N 1 2 249.358 2.283 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)NC1(C2CCCCC2)CC1 ZINC000891277308 582651819 /nfs/dbraw/zinc/65/18/19/582651819.db2.gz ZRQOQHFJJQMUFJ-UHFFFAOYSA-N 1 2 247.342 2.181 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccnn2C2CCC2)CCO1 ZINC000891561380 582697471 /nfs/dbraw/zinc/69/74/71/582697471.db2.gz ATAWWJZNDFJWOR-AWEZNQCLSA-N 1 2 249.358 2.219 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccnn2C2CCC2)CCO1 ZINC000891561380 582697472 /nfs/dbraw/zinc/69/74/72/582697472.db2.gz ATAWWJZNDFJWOR-AWEZNQCLSA-N 1 2 249.358 2.219 20 0 BEADLO CCC[C@H](C)Nc1cc(N(C)C)nc[nH+]1 ZINC000891667875 582707755 /nfs/dbraw/zinc/70/77/55/582707755.db2.gz JHNPWOXTFWUTMY-VIFPVBQESA-N 1 2 208.309 2.143 20 0 BEADLO CCC[C@H](C)Nc1cc(N(C)C)[nH+]cn1 ZINC000891667875 582707757 /nfs/dbraw/zinc/70/77/57/582707757.db2.gz JHNPWOXTFWUTMY-VIFPVBQESA-N 1 2 208.309 2.143 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnn(C3CCC3)c2)[C@@H](C)CO1 ZINC000891672933 582708795 /nfs/dbraw/zinc/70/87/95/582708795.db2.gz ZIFZNLFCIKJHJQ-NWDGAFQWSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnn(C3CCC3)c2)[C@@H](C)CO1 ZINC000891672933 582708797 /nfs/dbraw/zinc/70/87/97/582708797.db2.gz ZIFZNLFCIKJHJQ-NWDGAFQWSA-N 1 2 249.358 2.217 20 0 BEADLO CN(Cc1ccoc1)Cc1[nH+]ccn1C1CC1 ZINC000891779471 582718907 /nfs/dbraw/zinc/71/89/07/582718907.db2.gz KYEOCCDBDYIQNW-UHFFFAOYSA-N 1 2 231.299 2.443 20 0 BEADLO C[C@H]1CN(Cc2[nH+]ccn2C2CC2)CC(C)(C)O1 ZINC000891796018 582723120 /nfs/dbraw/zinc/72/31/20/582723120.db2.gz AANSVDATLUQLSG-NSHDSACASA-N 1 2 249.358 2.217 20 0 BEADLO C[C@H]1C[N@H+](Cc2nccn2C2CC2)CC(C)(C)O1 ZINC000891796018 582723124 /nfs/dbraw/zinc/72/31/24/582723124.db2.gz AANSVDATLUQLSG-NSHDSACASA-N 1 2 249.358 2.217 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nccn2C2CC2)CC(C)(C)O1 ZINC000891796018 582723127 /nfs/dbraw/zinc/72/31/27/582723127.db2.gz AANSVDATLUQLSG-NSHDSACASA-N 1 2 249.358 2.217 20 0 BEADLO C[C@@H](O)c1cccc(NCc2nccs2)[nH+]1 ZINC000891862434 582731463 /nfs/dbraw/zinc/73/14/63/582731463.db2.gz SWWDKNPYFYZYDD-MRVPVSSYSA-N 1 2 235.312 2.204 20 0 BEADLO COCCN(C)c1cc(C2CC2)[nH+]c(C2CC2)n1 ZINC000891941347 582741979 /nfs/dbraw/zinc/74/19/79/582741979.db2.gz WVJWANBXPIVDAC-UHFFFAOYSA-N 1 2 247.342 2.314 20 0 BEADLO C[C@H](O)c1cccc(NCc2ccoc2)[nH+]1 ZINC000891995777 582757408 /nfs/dbraw/zinc/75/74/08/582757408.db2.gz MAQCHNMSBIFVFG-VIFPVBQESA-N 1 2 218.256 2.340 20 0 BEADLO Nc1nc(NC[C@@H]2CC=CCC2)nc(C2CC2)[nH+]1 ZINC000892035190 582768290 /nfs/dbraw/zinc/76/82/90/582768290.db2.gz ADEAHDMOVSMPGN-SECBINFHSA-N 1 2 245.330 2.099 20 0 BEADLO Nc1nc(NC[C@@H]2CC=CCC2)[nH+]c(C2CC2)n1 ZINC000892035190 582768293 /nfs/dbraw/zinc/76/82/93/582768293.db2.gz ADEAHDMOVSMPGN-SECBINFHSA-N 1 2 245.330 2.099 20 0 BEADLO C[N@H+](Cc1ccon1)Cc1ccc(O)c(F)c1 ZINC000892083381 582787785 /nfs/dbraw/zinc/78/77/85/582787785.db2.gz PNYZGQQTPFRLFQ-UHFFFAOYSA-N 1 2 236.246 2.151 20 0 BEADLO C[N@@H+](Cc1ccon1)Cc1ccc(O)c(F)c1 ZINC000892083381 582787786 /nfs/dbraw/zinc/78/77/86/582787786.db2.gz PNYZGQQTPFRLFQ-UHFFFAOYSA-N 1 2 236.246 2.151 20 0 BEADLO CN(Cc1nccs1)Cc1[nH+]ccn1C1CC1 ZINC000892093404 582789036 /nfs/dbraw/zinc/78/90/36/582789036.db2.gz CFMNRTFWDRJOJV-UHFFFAOYSA-N 1 2 248.355 2.307 20 0 BEADLO C[C@H](O)c1cccc(NCCOC(C)(C)C)[nH+]1 ZINC000892131731 582797290 /nfs/dbraw/zinc/79/72/90/582797290.db2.gz NFUGPNPCXHTLQX-JTQLQIEISA-N 1 2 238.331 2.362 20 0 BEADLO CCc1cc(N[C@H]2CCCC[C@@H]2O)nc(CC)[nH+]1 ZINC000892243851 582812862 /nfs/dbraw/zinc/81/28/62/582812862.db2.gz DMQYWYLDEIGTIE-RYUDHWBXSA-N 1 2 249.358 2.317 20 0 BEADLO Cc1cc(NC[C@@H](O)C2CC2)nc(C2CCC2)[nH+]1 ZINC000892318129 582841716 /nfs/dbraw/zinc/84/17/16/582841716.db2.gz CENHVNPAEYVQPQ-GFCCVEGCSA-N 1 2 247.342 2.235 20 0 BEADLO Cc1cc(NC[C@H](O)C2CC2)nc(C2CCC2)[nH+]1 ZINC000892318130 582841792 /nfs/dbraw/zinc/84/17/92/582841792.db2.gz CENHVNPAEYVQPQ-LBPRGKRZSA-N 1 2 247.342 2.235 20 0 BEADLO CO[C@H](C)CC(=O)Nc1ccn2cc(C)[nH+]c2c1 ZINC000856288739 588867508 /nfs/dbraw/zinc/86/75/08/588867508.db2.gz XOGGULMFWBXLTB-SNVBAGLBSA-N 1 2 247.298 2.006 20 0 BEADLO COc1ccc2ccc(NCC[C@H](C)O)[nH+]c2c1 ZINC000892540704 582908676 /nfs/dbraw/zinc/90/86/76/582908676.db2.gz PVRDRPYNEMDYBP-JTQLQIEISA-N 1 2 246.310 2.426 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2cscn2)ncn1 ZINC000393761414 582922688 /nfs/dbraw/zinc/92/26/88/582922688.db2.gz WZSNNFXUBHRLJJ-SECBINFHSA-N 1 2 234.328 2.092 20 0 BEADLO CCC(CC)C(=O)OCCCn1cc[nH+]c1 ZINC000782987616 582935810 /nfs/dbraw/zinc/93/58/10/582935810.db2.gz RWHZIUCECUNCQZ-UHFFFAOYSA-N 1 2 224.304 2.253 20 0 BEADLO CCc1cc(NC[C@H](O)C(C)C)nc(CC)[nH+]1 ZINC000892642285 582936405 /nfs/dbraw/zinc/93/64/05/582936405.db2.gz POOIJCTURFQOFX-NSHDSACASA-N 1 2 237.347 2.030 20 0 BEADLO Cc1cc(NC[C@@H](O)C(C)C)nc(C2CCC2)[nH+]1 ZINC000892642389 582936617 /nfs/dbraw/zinc/93/66/17/582936617.db2.gz SKUZBYBDFZSRMO-GFCCVEGCSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@H](O)c1cccc(N[C@@H]2CCSC2)[nH+]1 ZINC000892702674 582960523 /nfs/dbraw/zinc/96/05/23/582960523.db2.gz GODTZHDYFAHZCS-DTWKUNHWSA-N 1 2 224.329 2.052 20 0 BEADLO C[C@H](O)c1cccc(NCCC2CC2)[nH+]1 ZINC000892704926 582961180 /nfs/dbraw/zinc/96/11/80/582961180.db2.gz QYSLKUYAUFRISR-VIFPVBQESA-N 1 2 206.289 2.347 20 0 BEADLO C[C@H](CC(=O)N[C@@H](C)c1[nH+]ccn1C)C1CC1 ZINC000856278119 588866454 /nfs/dbraw/zinc/86/64/54/588866454.db2.gz XUFIRLVKTZCYHC-ZJUUUORDSA-N 1 2 235.331 2.034 20 0 BEADLO CC/C(C)=C(\C)C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000856281388 588867077 /nfs/dbraw/zinc/86/70/77/588867077.db2.gz OBWJODKDMSNIAG-USKTWTLRSA-N 1 2 235.331 2.344 20 0 BEADLO Cc1cc(N2CC[C@](C)(O)C2)nc(C2CCC2)[nH+]1 ZINC000892807045 582986605 /nfs/dbraw/zinc/98/66/05/582986605.db2.gz PTOYAEOIKSRENE-AWEZNQCLSA-N 1 2 247.342 2.014 20 0 BEADLO CCc1nnc([C@H](C)[NH+]2CCC(F)(F)CC2)[nH]1 ZINC000852002103 582992501 /nfs/dbraw/zinc/99/25/01/582992501.db2.gz SPVQDTBVVVQDBK-QMMMGPOBSA-N 1 2 244.289 2.159 20 0 BEADLO C[C@H](N(C)c1nccn2c[nH+]cc12)C1(C)CC1 ZINC000892872149 583000028 /nfs/dbraw/zinc/00/00/28/583000028.db2.gz CLZQOVCOJHYHIY-JTQLQIEISA-N 1 2 230.315 2.354 20 0 BEADLO CCc1cc(N[C@H](C)CCCO)nc(CC)[nH+]1 ZINC000892884326 583005213 /nfs/dbraw/zinc/00/52/13/583005213.db2.gz XPDRXGXRNKTDTJ-SNVBAGLBSA-N 1 2 237.347 2.174 20 0 BEADLO CCc1cc(N[C@@H](COC)C2CC2)nc(CC)[nH+]1 ZINC000892951719 583017331 /nfs/dbraw/zinc/01/73/31/583017331.db2.gz VVGSTTOTNFTUKG-LBPRGKRZSA-N 1 2 249.358 2.438 20 0 BEADLO COc1cccc2c[nH+]c(N[C@@H]3CCOC3)cc21 ZINC000892954214 583018541 /nfs/dbraw/zinc/01/85/41/583018541.db2.gz UYZBIAVEIITEJK-LLVKDONJSA-N 1 2 244.294 2.444 20 0 BEADLO OCC1(Nc2cc(C3CC3)[nH+]c(C3CC3)n2)CC1 ZINC000892955780 583020706 /nfs/dbraw/zinc/02/07/06/583020706.db2.gz LSMJCENEIXPKAX-UHFFFAOYSA-N 1 2 245.326 2.168 20 0 BEADLO C[C@@H](Nc1cc(N(C)C)nc[nH+]1)C1CCC1 ZINC000892983889 583025345 /nfs/dbraw/zinc/02/53/45/583025345.db2.gz PGKMMSMPYNTYSS-SECBINFHSA-N 1 2 220.320 2.143 20 0 BEADLO C[C@@H](Nc1cc(N(C)C)[nH+]cn1)C1CCC1 ZINC000892983889 583025348 /nfs/dbraw/zinc/02/53/48/583025348.db2.gz PGKMMSMPYNTYSS-SECBINFHSA-N 1 2 220.320 2.143 20 0 BEADLO Cc1csc(C(C)(C)[NH2+]Cc2cnccn2)n1 ZINC000856769836 588876859 /nfs/dbraw/zinc/87/68/59/588876859.db2.gz DXAWXUQEKBGJFS-UHFFFAOYSA-N 1 2 248.355 2.266 20 0 BEADLO CCn1cc(C[NH2+]Cc2c(C)cccc2F)nn1 ZINC000893084914 583046943 /nfs/dbraw/zinc/04/69/43/583046943.db2.gz AXWPOCOKFNHANN-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO COC1(CNc2cccc([C@@H](C)O)[nH+]2)CCC1 ZINC000893108259 583050320 /nfs/dbraw/zinc/05/03/20/583050320.db2.gz NAEYSCPXFJNPOW-SNVBAGLBSA-N 1 2 236.315 2.116 20 0 BEADLO CCc1cc(N[C@H](C)C[C@@H](C)O)nc(CC)[nH+]1 ZINC000893127875 583054056 /nfs/dbraw/zinc/05/40/56/583054056.db2.gz QXAVHDNYGNBFOE-NXEZZACHSA-N 1 2 237.347 2.173 20 0 BEADLO COc1ccc(NCc2[nH+]ccn2C2CC2)nc1 ZINC000893134040 583055345 /nfs/dbraw/zinc/05/53/45/583055345.db2.gz FSYBHWPEABWXLL-UHFFFAOYSA-N 1 2 244.298 2.234 20 0 BEADLO COc1ccc(C[NH2+]Cc2ncccc2F)o1 ZINC000893181732 583065416 /nfs/dbraw/zinc/06/54/16/583065416.db2.gz HRAZINVISFMZJU-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO COCCOC[C@@H](C)Nc1ccc(C)[nH+]c1C ZINC000893197615 583069337 /nfs/dbraw/zinc/06/93/37/583069337.db2.gz HYBVRYJKZFJFRF-LLVKDONJSA-N 1 2 238.331 2.162 20 0 BEADLO Cc1cc(N2CC[C@H](O)C2(C)C)nc(C2CC2)[nH+]1 ZINC000853899131 583070476 /nfs/dbraw/zinc/07/04/76/583070476.db2.gz REOFJXUSYORQMG-NSHDSACASA-N 1 2 247.342 2.012 20 0 BEADLO COc1ccc2c(c1)[C@@H]([NH2+]Cc1cocn1)CC2 ZINC000397738607 583107798 /nfs/dbraw/zinc/10/77/98/583107798.db2.gz CLBLROXIXVRBFA-AWEZNQCLSA-N 1 2 244.294 2.460 20 0 BEADLO CCc1cc(NC[C@@H]2CC[C@@H](O)C2)nc(CC)[nH+]1 ZINC000893435052 583142440 /nfs/dbraw/zinc/14/24/40/583142440.db2.gz NWHGNCXBNYEKCJ-ZYHUDNBSSA-N 1 2 249.358 2.174 20 0 BEADLO Cn1cc(C[N@@H+]2CCC=C(F)C2)c(C2CC2)n1 ZINC000893435355 583142830 /nfs/dbraw/zinc/14/28/30/583142830.db2.gz AUNVJWSSZNQDPI-UHFFFAOYSA-N 1 2 235.306 2.357 20 0 BEADLO Cn1cc(C[N@H+]2CCC=C(F)C2)c(C2CC2)n1 ZINC000893435355 583142832 /nfs/dbraw/zinc/14/28/32/583142832.db2.gz AUNVJWSSZNQDPI-UHFFFAOYSA-N 1 2 235.306 2.357 20 0 BEADLO C[C@H]1CCN(c2nccn3c[nH+]cc23)CCS1 ZINC000893480963 583151931 /nfs/dbraw/zinc/15/19/31/583151931.db2.gz SEJNFMVZDLDUDF-JTQLQIEISA-N 1 2 248.355 2.061 20 0 BEADLO C[C@H]1CC2(CCC2)CN1c1cc(N(C)C)[nH+]cn1 ZINC000893500633 583154277 /nfs/dbraw/zinc/15/42/77/583154277.db2.gz YXHGDBIASGVOSC-NSHDSACASA-N 1 2 246.358 2.312 20 0 BEADLO C[C@H]1CC2(CCC2)CN1c1cc(N(C)C)nc[nH+]1 ZINC000893500633 583154278 /nfs/dbraw/zinc/15/42/78/583154278.db2.gz YXHGDBIASGVOSC-NSHDSACASA-N 1 2 246.358 2.312 20 0 BEADLO Cc1c[nH+]c2n1CC[C@H]2OC(=O)c1ccoc1C ZINC000893517091 583155845 /nfs/dbraw/zinc/15/58/45/583155845.db2.gz CSPRBRYPVGWQAM-LLVKDONJSA-N 1 2 246.266 2.395 20 0 BEADLO C/C=C(\C)C(=O)O[C@H]1CCn2c(C)c[nH+]c21 ZINC000893524699 583157485 /nfs/dbraw/zinc/15/74/85/583157485.db2.gz KKCZJUGGYHHKOB-GOJXHPMJSA-N 1 2 220.272 2.146 20 0 BEADLO COc1cccc2c[nH+]c(NCCCCO)cc21 ZINC000893545975 583161675 /nfs/dbraw/zinc/16/16/75/583161675.db2.gz ZMIRSKJDMNITKG-UHFFFAOYSA-N 1 2 246.310 2.428 20 0 BEADLO Cn1cc(C[N@@H+]2CCC[C@@](C)(F)C2)c(Cl)n1 ZINC000857049522 588883912 /nfs/dbraw/zinc/88/39/12/588883912.db2.gz XCONFRUFUXXEBC-LLVKDONJSA-N 1 2 245.729 2.398 20 0 BEADLO Cn1cc(C[N@H+]2CCC[C@@](C)(F)C2)c(Cl)n1 ZINC000857049522 588883913 /nfs/dbraw/zinc/88/39/13/588883913.db2.gz XCONFRUFUXXEBC-LLVKDONJSA-N 1 2 245.729 2.398 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cc(C)co2)CCO1 ZINC000893921052 583247667 /nfs/dbraw/zinc/24/76/67/583247667.db2.gz ZOTIUBVAVRMNSB-NSHDSACASA-N 1 2 209.289 2.199 20 0 BEADLO Cc1ncoc1C[N@@H+](C)Cc1c(C)noc1C ZINC000893962811 583257782 /nfs/dbraw/zinc/25/77/82/583257782.db2.gz RVSCFRAFVZGLSX-UHFFFAOYSA-N 1 2 235.287 2.220 20 0 BEADLO Cc1ncoc1C[N@H+](C)Cc1c(C)noc1C ZINC000893962811 583257785 /nfs/dbraw/zinc/25/77/85/583257785.db2.gz RVSCFRAFVZGLSX-UHFFFAOYSA-N 1 2 235.287 2.220 20 0 BEADLO CCOC1CN(c2cc(C)[nH+]c(C3CCC3)n2)C1 ZINC000894000074 583271526 /nfs/dbraw/zinc/27/15/26/583271526.db2.gz IAQBXMNRNKQZLD-UHFFFAOYSA-N 1 2 247.342 2.278 20 0 BEADLO CCc1cc(N2C[C@@H](C)[C@@H]2C)nc(CC)[nH+]1 ZINC000894001419 583272758 /nfs/dbraw/zinc/27/27/58/583272758.db2.gz WLEMAYSHPUGCKS-ZJUUUORDSA-N 1 2 219.332 2.446 20 0 BEADLO CCC[C@@H](CNc1cccc([C@@H](C)O)[nH+]1)OC ZINC000894017127 583273277 /nfs/dbraw/zinc/27/32/77/583273277.db2.gz XUDAGIHUSIZNEZ-MNOVXSKESA-N 1 2 238.331 2.362 20 0 BEADLO Cc1[nH]nc(C[NH+]2C[C@H](C)[C@@H](C)C2)c1C ZINC000894034297 583278780 /nfs/dbraw/zinc/27/87/80/583278780.db2.gz PBALZDOQUJWZRS-IUCAKERBSA-N 1 2 207.321 2.114 20 0 BEADLO CC(C)c1c[nH]c(CN2CCO[C@@H](C)[C@@H]2C)[nH+]1 ZINC000894026545 583280787 /nfs/dbraw/zinc/28/07/87/583280787.db2.gz MMKRSCDIVNHIKR-QWRGUYRKSA-N 1 2 237.347 2.142 20 0 BEADLO C[C@H](O)c1cccc(N[C@@H](C)CCCCO)[nH+]1 ZINC000894037464 583282834 /nfs/dbraw/zinc/28/28/34/583282834.db2.gz NLUFRYFZIXVQHR-QWRGUYRKSA-N 1 2 238.331 2.098 20 0 BEADLO O=C(CCCF)Nc1cccc2[nH+]ccn21 ZINC000857140473 588890394 /nfs/dbraw/zinc/89/03/94/588890394.db2.gz HUPSNWGZVUXHCJ-UHFFFAOYSA-N 1 2 221.235 2.023 20 0 BEADLO CCc1cc(NC[C@H]2CC(C)=NO2)nc(CC)[nH+]1 ZINC000894051514 583289301 /nfs/dbraw/zinc/28/93/01/583289301.db2.gz MTCODBUOPJIOOS-LLVKDONJSA-N 1 2 248.330 2.178 20 0 BEADLO CN(Cc1nc(C(C)(C)C)co1)Cc1[nH]cc[nH+]1 ZINC000894090660 583298530 /nfs/dbraw/zinc/29/85/30/583298530.db2.gz MLLZKNKVZZHXNG-UHFFFAOYSA-N 1 2 248.330 2.327 20 0 BEADLO CN(C)c1cc(NC[C@@H]2C[C@H]2C2CC2)[nH+]cn1 ZINC000894118674 583310267 /nfs/dbraw/zinc/31/02/67/583310267.db2.gz KIRFNWPUGLZJSR-QWRGUYRKSA-N 1 2 232.331 2.001 20 0 BEADLO CN(C)c1cc(NC[C@@H]2C[C@H]2C2CC2)nc[nH+]1 ZINC000894118674 583310269 /nfs/dbraw/zinc/31/02/69/583310269.db2.gz KIRFNWPUGLZJSR-QWRGUYRKSA-N 1 2 232.331 2.001 20 0 BEADLO C[C@@H](O)c1cccc(N[C@@H]2CS[C@H](C)C2)[nH+]1 ZINC000894194059 583333951 /nfs/dbraw/zinc/33/39/51/583333951.db2.gz JHGZQVQWHSEPQL-BBBLOLIVSA-N 1 2 238.356 2.441 20 0 BEADLO CN(C)c1cc(N[C@@H]2CCCC[C@H]2F)[nH+]cn1 ZINC000894200524 583338025 /nfs/dbraw/zinc/33/80/25/583338025.db2.gz BHTCOMKXCWYURJ-NXEZZACHSA-N 1 2 238.310 2.235 20 0 BEADLO CN(C)c1cc(N[C@@H]2CCCC[C@H]2F)nc[nH+]1 ZINC000894200524 583338027 /nfs/dbraw/zinc/33/80/27/583338027.db2.gz BHTCOMKXCWYURJ-NXEZZACHSA-N 1 2 238.310 2.235 20 0 BEADLO CNc1cc(N2CC(C)(C)C[C@H]2C)nc[nH+]1 ZINC000894205115 583341569 /nfs/dbraw/zinc/34/15/69/583341569.db2.gz HOTPPJKFMHTUEK-SECBINFHSA-N 1 2 220.320 2.143 20 0 BEADLO CNc1cc(N2CC(C)(C)C[C@H]2C)[nH+]cn1 ZINC000894205115 583341571 /nfs/dbraw/zinc/34/15/71/583341571.db2.gz HOTPPJKFMHTUEK-SECBINFHSA-N 1 2 220.320 2.143 20 0 BEADLO C[C@H]1CC(C)(C)CN1c1cc(N(C)C)[nH+]cn1 ZINC000894206141 583347588 /nfs/dbraw/zinc/34/75/88/583347588.db2.gz TWJYTJZDAVMYRT-JTQLQIEISA-N 1 2 234.347 2.167 20 0 BEADLO C[C@H]1CC(C)(C)CN1c1cc(N(C)C)nc[nH+]1 ZINC000894206141 583347589 /nfs/dbraw/zinc/34/75/89/583347589.db2.gz TWJYTJZDAVMYRT-JTQLQIEISA-N 1 2 234.347 2.167 20 0 BEADLO FC1(F)CC[N@H+](C[C@H]2CCC3(CCC3)O2)C1 ZINC000878380404 583371391 /nfs/dbraw/zinc/37/13/91/583371391.db2.gz ZTASEJBQICRHGH-SNVBAGLBSA-N 1 2 231.286 2.429 20 0 BEADLO FC1(F)CC[N@@H+](C[C@H]2CCC3(CCC3)O2)C1 ZINC000878380404 583371393 /nfs/dbraw/zinc/37/13/93/583371393.db2.gz ZTASEJBQICRHGH-SNVBAGLBSA-N 1 2 231.286 2.429 20 0 BEADLO CN(C)c1cc(N2CC[C@H](C3CCC3)C2)nc[nH+]1 ZINC000894226516 583383683 /nfs/dbraw/zinc/38/36/83/583383683.db2.gz JQBRMZGFUTUPRY-LBPRGKRZSA-N 1 2 246.358 2.169 20 0 BEADLO CN(C)c1cc(N2CC[C@H](C3CCC3)C2)[nH+]cn1 ZINC000894226516 583383684 /nfs/dbraw/zinc/38/36/84/583383684.db2.gz JQBRMZGFUTUPRY-LBPRGKRZSA-N 1 2 246.358 2.169 20 0 BEADLO C[C@@H]1[C@H](C)CN(c2nccn3c[nH+]cc23)[C@H]1C ZINC000894234408 583385174 /nfs/dbraw/zinc/38/51/74/583385174.db2.gz IMBRPNPNRUDBTB-MXWKQRLJSA-N 1 2 230.315 2.210 20 0 BEADLO CCC[C@@H]([NH2+]Cc1c[nH]cn1)c1ccccn1 ZINC000894234024 583385540 /nfs/dbraw/zinc/38/55/40/583385540.db2.gz CNSWJINSHCBFCM-GFCCVEGCSA-N 1 2 230.315 2.436 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nc3c(o2)CCCC3)[C@H]1C ZINC000878652128 583389200 /nfs/dbraw/zinc/38/92/00/583389200.db2.gz MGPMEPAUPHIMJW-ZJUUUORDSA-N 1 2 220.316 2.394 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nc3c(o2)CCCC3)[C@H]1C ZINC000878652128 583389202 /nfs/dbraw/zinc/38/92/02/583389202.db2.gz MGPMEPAUPHIMJW-ZJUUUORDSA-N 1 2 220.316 2.394 20 0 BEADLO CC(C)CCn1ccc(NCc2c[nH+]c[nH]2)n1 ZINC000894353158 583433440 /nfs/dbraw/zinc/43/34/40/583433440.db2.gz ZUDYNEIFWLVYDX-UHFFFAOYSA-N 1 2 233.319 2.264 20 0 BEADLO CC(C)CCn1ccc(NCc2c[nH]c[nH+]2)n1 ZINC000894353158 583433443 /nfs/dbraw/zinc/43/34/43/583433443.db2.gz ZUDYNEIFWLVYDX-UHFFFAOYSA-N 1 2 233.319 2.264 20 0 BEADLO CC(C)COc1ccc(NCc2c[nH+]c[nH]2)cn1 ZINC000894359578 583436297 /nfs/dbraw/zinc/43/62/97/583436297.db2.gz OUAJJHXQYAFAHM-UHFFFAOYSA-N 1 2 246.314 2.452 20 0 BEADLO CC(C)COc1ccc(NCc2c[nH]c[nH+]2)cn1 ZINC000894359578 583436299 /nfs/dbraw/zinc/43/62/99/583436299.db2.gz OUAJJHXQYAFAHM-UHFFFAOYSA-N 1 2 246.314 2.452 20 0 BEADLO CN(C)c1cc(N[C@@H]2CC[C@@H]3C[C@@H]3C2)[nH+]cn1 ZINC000894362835 583437876 /nfs/dbraw/zinc/43/78/76/583437876.db2.gz GNKZIBIEINHZPF-GMTAPVOTSA-N 1 2 232.331 2.143 20 0 BEADLO CN(C)c1cc(N[C@@H]2CC[C@@H]3C[C@@H]3C2)nc[nH+]1 ZINC000894362835 583437880 /nfs/dbraw/zinc/43/78/80/583437880.db2.gz GNKZIBIEINHZPF-GMTAPVOTSA-N 1 2 232.331 2.143 20 0 BEADLO CCC[C@@H]([NH2+]Cc1sccc1C)C(=O)OC ZINC000336741494 583439685 /nfs/dbraw/zinc/43/96/85/583439685.db2.gz RGSAVKZUULXLPQ-SNVBAGLBSA-N 1 2 241.356 2.488 20 0 BEADLO O=c1oc2ccc(C[N@H+]3CCC=C(F)C3)cc2o1 ZINC000894427874 583456802 /nfs/dbraw/zinc/45/68/02/583456802.db2.gz UTRINMNVMKEECN-UHFFFAOYSA-N 1 2 249.241 2.445 20 0 BEADLO O=c1oc2ccc(C[N@@H+]3CCC=C(F)C3)cc2o1 ZINC000894427874 583456806 /nfs/dbraw/zinc/45/68/06/583456806.db2.gz UTRINMNVMKEECN-UHFFFAOYSA-N 1 2 249.241 2.445 20 0 BEADLO CO[C@H](C)C[N@H+](C)Cc1nc(C(C)(C)C)co1 ZINC000894434553 583458651 /nfs/dbraw/zinc/45/86/51/583458651.db2.gz GAGFXZZADAOTJD-SNVBAGLBSA-N 1 2 240.347 2.439 20 0 BEADLO CO[C@H](C)C[N@@H+](C)Cc1nc(C(C)(C)C)co1 ZINC000894434553 583458654 /nfs/dbraw/zinc/45/86/54/583458654.db2.gz GAGFXZZADAOTJD-SNVBAGLBSA-N 1 2 240.347 2.439 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+]2CCOCC3(CC3)C2)n1 ZINC000894438046 583460051 /nfs/dbraw/zinc/46/00/51/583460051.db2.gz VSQPOFDXELCFHC-UHFFFAOYSA-N 1 2 249.358 2.146 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+]2CCOCC3(CC3)C2)n1 ZINC000894438046 583460052 /nfs/dbraw/zinc/46/00/52/583460052.db2.gz VSQPOFDXELCFHC-UHFFFAOYSA-N 1 2 249.358 2.146 20 0 BEADLO C[C@@H](C1CC1)n1cc(NCc2c[nH+]c[nH]2)cn1 ZINC000894496719 583473794 /nfs/dbraw/zinc/47/37/94/583473794.db2.gz VRGPZQINIRKXRR-VIFPVBQESA-N 1 2 231.303 2.189 20 0 BEADLO C[C@@H](C1CC1)n1cc(NCc2c[nH]c[nH+]2)cn1 ZINC000894496719 583473795 /nfs/dbraw/zinc/47/37/95/583473795.db2.gz VRGPZQINIRKXRR-VIFPVBQESA-N 1 2 231.303 2.189 20 0 BEADLO CCn1cc(C[NH2+][C@@H]2CCCC2(F)F)c(C)n1 ZINC000894513668 583476020 /nfs/dbraw/zinc/47/60/20/583476020.db2.gz MPVFKEWFGNPZEE-LLVKDONJSA-N 1 2 243.301 2.489 20 0 BEADLO C[C@H](O)c1cccc(N[C@H]2COC3(CCC3)C2)[nH+]1 ZINC000894541100 583480805 /nfs/dbraw/zinc/48/08/05/583480805.db2.gz HDYOAKQWBNNHGY-WDEREUQCSA-N 1 2 248.326 2.258 20 0 BEADLO C[C@H](O)c1cccc(N[C@@H]2COC3(CCC3)C2)[nH+]1 ZINC000894541098 583481209 /nfs/dbraw/zinc/48/12/09/583481209.db2.gz HDYOAKQWBNNHGY-QWRGUYRKSA-N 1 2 248.326 2.258 20 0 BEADLO Cc1nnc(C[N@@H+]2CC(C)(C)[C@@H]2C2CC2)s1 ZINC000894544811 583481857 /nfs/dbraw/zinc/48/18/57/583481857.db2.gz PHGNCYWNVDKRBJ-NSHDSACASA-N 1 2 237.372 2.467 20 0 BEADLO Cc1nnc(C[N@H+]2CC(C)(C)[C@@H]2C2CC2)s1 ZINC000894544811 583481859 /nfs/dbraw/zinc/48/18/59/583481859.db2.gz PHGNCYWNVDKRBJ-NSHDSACASA-N 1 2 237.372 2.467 20 0 BEADLO Cc1cccc(CN(C)Cc2[nH]cc[nH+]2)c1F ZINC000894587243 583490007 /nfs/dbraw/zinc/49/00/07/583490007.db2.gz WSUIBXPROKJHFW-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO CO[C@]1(C)CCC[N@H+](Cc2n[nH]c(C)c2C)C1 ZINC000894597043 583492864 /nfs/dbraw/zinc/49/28/64/583492864.db2.gz IMGDHQSMGWFIRE-CYBMUJFWSA-N 1 2 237.347 2.027 20 0 BEADLO CO[C@]1(C)CCC[N@@H+](Cc2n[nH]c(C)c2C)C1 ZINC000894597043 583492866 /nfs/dbraw/zinc/49/28/66/583492866.db2.gz IMGDHQSMGWFIRE-CYBMUJFWSA-N 1 2 237.347 2.027 20 0 BEADLO COc1nccc(C[N@@H+]2C[C@H](C)[C@@H]2C)c1F ZINC000894628638 583496953 /nfs/dbraw/zinc/49/69/53/583496953.db2.gz QBYQSUWZUMGSIP-IUCAKERBSA-N 1 2 224.279 2.070 20 0 BEADLO COc1nccc(C[N@H+]2C[C@H](C)[C@@H]2C)c1F ZINC000894628638 583496956 /nfs/dbraw/zinc/49/69/56/583496956.db2.gz QBYQSUWZUMGSIP-IUCAKERBSA-N 1 2 224.279 2.070 20 0 BEADLO COc1cccc2c[nH+]c(N[C@H]3C[C@H](O)C3)cc21 ZINC000894641247 583499413 /nfs/dbraw/zinc/49/94/13/583499413.db2.gz PABLZBWYZSSWOF-XYPYZODXSA-N 1 2 244.294 2.179 20 0 BEADLO CCc1[nH]nc(Cl)c1C[NH+]1CC2(CC2)C1 ZINC000894663017 583501063 /nfs/dbraw/zinc/50/10/63/583501063.db2.gz DVMPVDIGTDXHLW-UHFFFAOYSA-N 1 2 225.723 2.221 20 0 BEADLO COC(=O)c1sccc1C[NH+]1CC2(CC2)C1 ZINC000894663681 583502208 /nfs/dbraw/zinc/50/22/08/583502208.db2.gz NLZZODKYJWHTRJ-UHFFFAOYSA-N 1 2 237.324 2.131 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@@H](F)C2)cnc1F ZINC000894673260 583503844 /nfs/dbraw/zinc/50/38/44/583503844.db2.gz YOAYZCVLPJXABS-SNVBAGLBSA-N 1 2 212.243 2.073 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@@H](F)C2)cnc1F ZINC000894673260 583503846 /nfs/dbraw/zinc/50/38/46/583503846.db2.gz YOAYZCVLPJXABS-SNVBAGLBSA-N 1 2 212.243 2.073 20 0 BEADLO COc1ccc(C[NH+]2CC(C(F)(F)F)C2)o1 ZINC000894710278 583512115 /nfs/dbraw/zinc/51/21/15/583512115.db2.gz CYRKKFRFLXSKJT-UHFFFAOYSA-N 1 2 235.205 2.282 20 0 BEADLO CCc1ncc(C[NH2+]Cc2nccn2C2CC2)o1 ZINC000894753533 583516156 /nfs/dbraw/zinc/51/61/56/583516156.db2.gz JIDSSPQVKXSXPE-UHFFFAOYSA-N 1 2 246.314 2.058 20 0 BEADLO CCc1ncc(CNCc2[nH+]ccn2C2CC2)o1 ZINC000894753533 583516157 /nfs/dbraw/zinc/51/61/57/583516157.db2.gz JIDSSPQVKXSXPE-UHFFFAOYSA-N 1 2 246.314 2.058 20 0 BEADLO CCC1C[NH+](Cc2c(Cl)c(C)nn2C)C1 ZINC000894812697 583523725 /nfs/dbraw/zinc/52/37/25/583523725.db2.gz GRSPFOYIFSIMJC-UHFFFAOYSA-N 1 2 227.739 2.224 20 0 BEADLO CCC1C[NH+](Cc2ccnc(OC)c2F)C1 ZINC000894813197 583523855 /nfs/dbraw/zinc/52/38/55/583523855.db2.gz NZIQWYADCQWFCL-UHFFFAOYSA-N 1 2 224.279 2.071 20 0 BEADLO COC1C[NH+](Cc2ccc(CC(C)C)nc2)C1 ZINC000894820205 583524710 /nfs/dbraw/zinc/52/47/10/583524710.db2.gz RYWABULYTLMBPD-UHFFFAOYSA-N 1 2 234.343 2.111 20 0 BEADLO CCOC1C[NH+](Cc2ccc3c(c2)C[C@@H](C)O3)C1 ZINC000894819756 583525069 /nfs/dbraw/zinc/52/50/69/583525069.db2.gz QDLCFCLAKOATAX-LLVKDONJSA-N 1 2 247.338 2.231 20 0 BEADLO Cc1cc(C[NH+]2CC3(CC(F)C3)C2)cnc1F ZINC000894829644 583527067 /nfs/dbraw/zinc/52/70/67/583527067.db2.gz BZGVBIBCUOIUIA-UHFFFAOYSA-N 1 2 238.281 2.463 20 0 BEADLO CCC1(C)C[NH+](Cc2ccnc(OC)c2F)C1 ZINC000894839922 583530011 /nfs/dbraw/zinc/53/00/11/583530011.db2.gz KRJMQMWDPRZHRA-UHFFFAOYSA-N 1 2 238.306 2.461 20 0 BEADLO Cc1nnc(C[NH+]2CC(C(C)(C)C)C2)s1 ZINC000894844278 583530861 /nfs/dbraw/zinc/53/08/61/583530861.db2.gz YNAJULUTNRYUSI-UHFFFAOYSA-N 1 2 225.361 2.324 20 0 BEADLO CCc1noc(C)c1C[NH2+]Cc1ocnc1C ZINC000894858060 583532918 /nfs/dbraw/zinc/53/29/18/583532918.db2.gz WKNITMFVOKFVGB-UHFFFAOYSA-N 1 2 235.287 2.132 20 0 BEADLO COc1cnc(F)c(C[N@@H+]2C[C@@H](C)[C@H]2C)c1 ZINC000894862604 583536985 /nfs/dbraw/zinc/53/69/85/583536985.db2.gz ZVISETQRJAJAEJ-RKDXNWHRSA-N 1 2 224.279 2.070 20 0 BEADLO COc1cnc(F)c(C[N@H+]2C[C@@H](C)[C@H]2C)c1 ZINC000894862604 583536986 /nfs/dbraw/zinc/53/69/86/583536986.db2.gz ZVISETQRJAJAEJ-RKDXNWHRSA-N 1 2 224.279 2.070 20 0 BEADLO COC(=O)c1cc(C[NH+]2CC3(CC3)C2)cs1 ZINC000894871500 583539555 /nfs/dbraw/zinc/53/95/55/583539555.db2.gz WFVIHPAWHCGUKT-UHFFFAOYSA-N 1 2 237.324 2.131 20 0 BEADLO FCCOc1ccccc1NCc1c[nH+]c[nH]1 ZINC000894871748 583540376 /nfs/dbraw/zinc/54/03/76/583540376.db2.gz BHSYHJDOIUUTHT-UHFFFAOYSA-N 1 2 235.262 2.370 20 0 BEADLO FCCOc1ccccc1NCc1c[nH]c[nH+]1 ZINC000894871748 583540377 /nfs/dbraw/zinc/54/03/77/583540377.db2.gz BHSYHJDOIUUTHT-UHFFFAOYSA-N 1 2 235.262 2.370 20 0 BEADLO Cc1nnc(C[N@@H+]2Cc3ccccc3[C@H](C)C2)o1 ZINC000726956047 583550620 /nfs/dbraw/zinc/55/06/20/583550620.db2.gz ZTMFIROGZUNDQW-SNVBAGLBSA-N 1 2 243.310 2.497 20 0 BEADLO Cc1nnc(C[N@H+]2Cc3ccccc3[C@H](C)C2)o1 ZINC000726956047 583550621 /nfs/dbraw/zinc/55/06/21/583550621.db2.gz ZTMFIROGZUNDQW-SNVBAGLBSA-N 1 2 243.310 2.497 20 0 BEADLO CCc1nc(N2Cc3nc(C)sc3C2)cc[nH+]1 ZINC000894907538 583554237 /nfs/dbraw/zinc/55/42/37/583554237.db2.gz PZFMZEFNPTWMLG-UHFFFAOYSA-N 1 2 246.339 2.324 20 0 BEADLO CCc1nnc(C[NH2+][C@@H]2CCCC[C@H]2F)s1 ZINC000894909653 583555067 /nfs/dbraw/zinc/55/50/67/583555067.db2.gz QZQNHJLGYFBMOY-RKDXNWHRSA-N 1 2 243.351 2.471 20 0 BEADLO Cc1cc(NC[C@H]2C[C@H](O)C2)nc(C2CCC2)[nH+]1 ZINC000895074680 583580361 /nfs/dbraw/zinc/58/03/61/583580361.db2.gz MXCBCTVXYWQZSJ-UMSPYCQHSA-N 1 2 247.342 2.235 20 0 BEADLO C[C@@H](O)c1cccc(N[C@@H]2CC23CCC3)[nH+]1 ZINC000895090459 583586567 /nfs/dbraw/zinc/58/65/67/583586567.db2.gz MLSDJAQRRDCMFU-MWLCHTKSSA-N 1 2 218.300 2.489 20 0 BEADLO C=C/C=C/CCNc1cc(N(C)C)nc[nH+]1 ZINC000895131780 583601165 /nfs/dbraw/zinc/60/11/65/583601165.db2.gz KSDCNHXEJFFWND-AATRIKPKSA-N 1 2 218.304 2.087 20 0 BEADLO C=C/C=C/CCNc1cc(N(C)C)[nH+]cn1 ZINC000895131780 583601166 /nfs/dbraw/zinc/60/11/66/583601166.db2.gz KSDCNHXEJFFWND-AATRIKPKSA-N 1 2 218.304 2.087 20 0 BEADLO CCc1cc[nH+]cc1N[C@@H]1CC[C@@H](C(=O)OC)C1 ZINC000895142957 583603531 /nfs/dbraw/zinc/60/35/31/583603531.db2.gz YKRHEPKMCBKCTG-VXGBXAGGSA-N 1 2 248.326 2.398 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccc(OC)o2)[C@@H](C)CO1 ZINC000895147112 583605053 /nfs/dbraw/zinc/60/50/53/583605053.db2.gz NNTUEZBFRAEXTA-QWRGUYRKSA-N 1 2 239.315 2.288 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccc(OC)o2)[C@@H](C)CO1 ZINC000895147112 583605056 /nfs/dbraw/zinc/60/50/56/583605056.db2.gz NNTUEZBFRAEXTA-QWRGUYRKSA-N 1 2 239.315 2.288 20 0 BEADLO COCc1cc[nH+]c(NCc2ccc(OC)o2)c1 ZINC000895188091 583619842 /nfs/dbraw/zinc/61/98/42/583619842.db2.gz XSUDBRLVRJVGPD-UHFFFAOYSA-N 1 2 248.282 2.442 20 0 BEADLO CC1(C)OC[C@H](CNc2cc3cc[nH]c3c[nH+]2)O1 ZINC000895199560 583624418 /nfs/dbraw/zinc/62/44/18/583624418.db2.gz BIMHPHXPNBESQO-JTQLQIEISA-N 1 2 247.298 2.126 20 0 BEADLO COc1ccc(C[NH+]2CC3(CC3(F)F)C2)o1 ZINC000895200985 583624491 /nfs/dbraw/zinc/62/44/91/583624491.db2.gz WFIDEIIDVMFEGT-UHFFFAOYSA-N 1 2 229.226 2.129 20 0 BEADLO C[C@@H](CC(=O)NC1CCC=CCC1)n1cc[nH+]c1 ZINC000895213847 583628297 /nfs/dbraw/zinc/62/82/97/583628297.db2.gz UUYLWGASSQGFEH-LBPRGKRZSA-N 1 2 247.342 2.449 20 0 BEADLO COCC[N@H+](CCF)Cc1ccc(SC)o1 ZINC000895251023 583633410 /nfs/dbraw/zinc/63/34/10/583633410.db2.gz LFVFKDKIDVVSLE-UHFFFAOYSA-N 1 2 247.335 2.419 20 0 BEADLO COCC[N@@H+](CCF)Cc1ccc(SC)o1 ZINC000895251023 583633412 /nfs/dbraw/zinc/63/34/12/583633412.db2.gz LFVFKDKIDVVSLE-UHFFFAOYSA-N 1 2 247.335 2.419 20 0 BEADLO CCc1cc(NCc2cc[nH+]c(NC)c2)ncn1 ZINC000895254685 583633507 /nfs/dbraw/zinc/63/35/07/583633507.db2.gz FFDRPTHKCZGUIF-UHFFFAOYSA-N 1 2 243.314 2.088 20 0 BEADLO CNc1cc(CNc2nc(C)cnc2C)cc[nH+]1 ZINC000895255963 583633954 /nfs/dbraw/zinc/63/39/54/583633954.db2.gz VMBANYGNFMLLSS-UHFFFAOYSA-N 1 2 243.314 2.142 20 0 BEADLO CC1=NO[C@@H](C[NH2+]Cc2ncc(Cl)s2)C1 ZINC000895303116 583644871 /nfs/dbraw/zinc/64/48/71/583644871.db2.gz DBTQSMKGXTZMGO-SSDOTTSWSA-N 1 2 245.735 2.051 20 0 BEADLO CCSCC[N@@H+]1Cc2ccncc2C1 ZINC000857876035 588919160 /nfs/dbraw/zinc/91/91/60/588919160.db2.gz KXTHGYLWALGHAB-UHFFFAOYSA-N 1 2 208.330 2.150 20 0 BEADLO CCSCC[N@H+]1Cc2ccncc2C1 ZINC000857876035 588919162 /nfs/dbraw/zinc/91/91/62/588919162.db2.gz KXTHGYLWALGHAB-UHFFFAOYSA-N 1 2 208.330 2.150 20 0 BEADLO CC[C@@](C)(C[N@@H+]1CC[C@@H]1C(F)F)OC ZINC000895431991 583670761 /nfs/dbraw/zinc/67/07/61/583670761.db2.gz SEOPWMIPDJSXIK-SCZZXKLOSA-N 1 2 207.264 2.141 20 0 BEADLO CC[C@@](C)(C[N@H+]1CC[C@@H]1C(F)F)OC ZINC000895431991 583670763 /nfs/dbraw/zinc/67/07/63/583670763.db2.gz SEOPWMIPDJSXIK-SCZZXKLOSA-N 1 2 207.264 2.141 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N2CCCCCC2)c[nH+]1 ZINC000895429115 583668935 /nfs/dbraw/zinc/66/89/35/583668935.db2.gz ZTUKGIIAMMVZEP-UHFFFAOYSA-N 1 2 249.358 2.329 20 0 BEADLO FC(F)[C@H]1CCN1Cc1cccc2[nH+]ccn21 ZINC000895431039 583670349 /nfs/dbraw/zinc/67/03/49/583670349.db2.gz JVDDHUOIBRJNRA-SNVBAGLBSA-N 1 2 237.253 2.174 20 0 BEADLO CCC[C@@H](C[N@@H+]1CC[C@H]1C(F)F)OC ZINC000895431962 583670547 /nfs/dbraw/zinc/67/05/47/583670547.db2.gz RZEGVSRCAIUWET-IUCAKERBSA-N 1 2 207.264 2.141 20 0 BEADLO CCC[C@@H](C[N@H+]1CC[C@H]1C(F)F)OC ZINC000895431962 583670548 /nfs/dbraw/zinc/67/05/48/583670548.db2.gz RZEGVSRCAIUWET-IUCAKERBSA-N 1 2 207.264 2.141 20 0 BEADLO CC[C@H](C)[C@@H](C[N@@H+]1CC[C@@H]1C(F)F)OC ZINC000895431429 583670877 /nfs/dbraw/zinc/67/08/77/583670877.db2.gz MOFWGNPRCJXJDR-IVZWLZJFSA-N 1 2 221.291 2.387 20 0 BEADLO CC[C@H](C)[C@@H](C[N@H+]1CC[C@@H]1C(F)F)OC ZINC000895431429 583670878 /nfs/dbraw/zinc/67/08/78/583670878.db2.gz MOFWGNPRCJXJDR-IVZWLZJFSA-N 1 2 221.291 2.387 20 0 BEADLO FC(F)[C@@H]1CC[N@@H+]1CC1CCSCC1 ZINC000895432266 583670981 /nfs/dbraw/zinc/67/09/81/583670981.db2.gz YCLQIZCEWRTIEC-VIFPVBQESA-N 1 2 221.316 2.469 20 0 BEADLO FC(F)[C@@H]1CC[N@H+]1CC1CCSCC1 ZINC000895432266 583670982 /nfs/dbraw/zinc/67/09/82/583670982.db2.gz YCLQIZCEWRTIEC-VIFPVBQESA-N 1 2 221.316 2.469 20 0 BEADLO CO[C@@H](CC(C)C)C[N@@H+]1CC[C@@H]1C(F)F ZINC000895432051 583670990 /nfs/dbraw/zinc/67/09/90/583670990.db2.gz TZQIPIOCLRYNGG-VHSXEESVSA-N 1 2 221.291 2.387 20 0 BEADLO FC(F)[C@H]1CCN1Cc1c[nH+]c2ccccn12 ZINC000895435577 583673153 /nfs/dbraw/zinc/67/31/53/583673153.db2.gz GXDHRDSGUYGLCM-SNVBAGLBSA-N 1 2 237.253 2.174 20 0 BEADLO C=Cn1cc(C[N@H+](C)Cc2ccns2)cn1 ZINC000895451651 583676285 /nfs/dbraw/zinc/67/62/85/583676285.db2.gz BTWCLQOVRGXTMV-UHFFFAOYSA-N 1 2 234.328 2.072 20 0 BEADLO C=Cn1cc(C[N@@H+](C)Cc2ccns2)cn1 ZINC000895451651 583676286 /nfs/dbraw/zinc/67/62/86/583676286.db2.gz BTWCLQOVRGXTMV-UHFFFAOYSA-N 1 2 234.328 2.072 20 0 BEADLO CN(C)c1ccc(NCc2c[nH+]c[nH]2)cc1F ZINC000895466669 583678512 /nfs/dbraw/zinc/67/85/12/583678512.db2.gz YWEGLHSQMZDGFQ-UHFFFAOYSA-N 1 2 234.278 2.227 20 0 BEADLO CN(C)c1ccc(NCc2c[nH]c[nH+]2)cc1F ZINC000895466669 583678514 /nfs/dbraw/zinc/67/85/14/583678514.db2.gz YWEGLHSQMZDGFQ-UHFFFAOYSA-N 1 2 234.278 2.227 20 0 BEADLO OC[C@@H](CCc1ccccc1)Nc1cccc[nH+]1 ZINC000895678426 583704828 /nfs/dbraw/zinc/70/48/28/583704828.db2.gz DIKBFUDBZUTLNY-CQSZACIVSA-N 1 2 242.322 2.487 20 0 BEADLO CN(C)c1c[nH+]cc(N[C@@H]2COC3(CCC3)C2)c1 ZINC000895699067 583710957 /nfs/dbraw/zinc/71/09/57/583710957.db2.gz HRBDBJZFRGDELF-LBPRGKRZSA-N 1 2 247.342 2.271 20 0 BEADLO Cc1nc(N2CCO[C@H](C)CC2)c(C)c(C)[nH+]1 ZINC000895758180 583721245 /nfs/dbraw/zinc/72/12/45/583721245.db2.gz NHKAZNWHXJIUOZ-SECBINFHSA-N 1 2 235.331 2.017 20 0 BEADLO CC(C)c1nc(N2CCO[C@H](C)CC2)cc[nH+]1 ZINC000895758051 583721574 /nfs/dbraw/zinc/72/15/74/583721574.db2.gz LUQRMXFMPYUCQX-LLVKDONJSA-N 1 2 235.331 2.215 20 0 BEADLO CC/C(C)=C(\C)C(=O)N[C@@H]1CCn2c[nH+]cc2C1 ZINC000857946639 588924787 /nfs/dbraw/zinc/92/47/87/588924787.db2.gz XJBDJLFCTHIJNI-HCRIHEDKSA-N 1 2 247.342 2.061 20 0 BEADLO Cc1nc(N[C@H](c2ncccn2)C2CC2)cc[nH+]1 ZINC000895779831 583728905 /nfs/dbraw/zinc/72/89/05/583728905.db2.gz WLMSAGHWJKPSAY-LBPRGKRZSA-N 1 2 241.298 2.138 20 0 BEADLO CC[C@H](C[NH2+][C@H]1CCOC1=O)c1ccccc1 ZINC000895802515 583731443 /nfs/dbraw/zinc/73/14/43/583731443.db2.gz ULALDONPOCMBKU-YPMHNXCESA-N 1 2 233.311 2.085 20 0 BEADLO CC(C)c1ccc(CC[NH2+][C@H]2CCOC2=O)cc1 ZINC000895803845 583731542 /nfs/dbraw/zinc/73/15/42/583731542.db2.gz LPBPGNXJOSJHON-AWEZNQCLSA-N 1 2 247.338 2.258 20 0 BEADLO CC(C)c1nc(N[C@H]2COC[C@@H]2C)cc[nH+]1 ZINC000895905059 583742936 /nfs/dbraw/zinc/74/29/36/583742936.db2.gz HOHGRGPPMXXOQC-UWVGGRQHSA-N 1 2 221.304 2.047 20 0 BEADLO CCc1cc(N[C@H]2COC[C@H]2C)nc(CC)[nH+]1 ZINC000895909597 583745130 /nfs/dbraw/zinc/74/51/30/583745130.db2.gz PPIQGQRRHZOKFX-KOLCDFICSA-N 1 2 235.331 2.048 20 0 BEADLO Cc1nc(N[C@@H]2COC[C@@H]2C)c2c([nH+]1)CCCC2 ZINC000895908667 583745341 /nfs/dbraw/zinc/74/53/41/583745341.db2.gz JNMLPNAZGROAHL-TVQRCGJNSA-N 1 2 247.342 2.111 20 0 BEADLO CCCCc1cc(N[C@H]2COC[C@H]2C)nc[nH+]1 ZINC000895910774 583745908 /nfs/dbraw/zinc/74/59/08/583745908.db2.gz WBTOPSIOOULPHH-PWSUYJOCSA-N 1 2 235.331 2.266 20 0 BEADLO O=C(N[C@H]1CCn2c[nH+]cc21)C1CC2(CCC2)C1 ZINC000857976826 588926094 /nfs/dbraw/zinc/92/60/94/588926094.db2.gz MSDWVFIZKXZFRJ-NSHDSACASA-N 1 2 245.326 2.024 20 0 BEADLO CO[C@H]1CC[C@@H](C)[N@H+](Cc2n[nH]c(C)c2C)C1 ZINC000895927654 583748703 /nfs/dbraw/zinc/74/87/03/583748703.db2.gz OJCVYCJGTHCDLX-SKDRFNHKSA-N 1 2 237.347 2.026 20 0 BEADLO CO[C@H]1CC[C@@H](C)[N@@H+](Cc2n[nH]c(C)c2C)C1 ZINC000895927654 583748705 /nfs/dbraw/zinc/74/87/05/583748705.db2.gz OJCVYCJGTHCDLX-SKDRFNHKSA-N 1 2 237.347 2.026 20 0 BEADLO C[C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857976565 588926262 /nfs/dbraw/zinc/92/62/62/588926262.db2.gz HGCHLQMUAOCCNL-GRYCIOLGSA-N 1 2 247.342 2.270 20 0 BEADLO C[C@@H](C(=O)N[C@@H]1CCn2c[nH+]cc21)C(C)(C)C ZINC000857987647 588926275 /nfs/dbraw/zinc/92/62/75/588926275.db2.gz XMUJXGBCECTMPC-VHSXEESVSA-N 1 2 235.331 2.126 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857976501 588926420 /nfs/dbraw/zinc/92/64/20/588926420.db2.gz FWMSYXPWXUUCOB-IJLUTSLNSA-N 1 2 247.342 2.126 20 0 BEADLO CCc1ncc(C[NH+]2CC(OC(C)C)C2)s1 ZINC000895955846 583752688 /nfs/dbraw/zinc/75/26/88/583752688.db2.gz VWNZVOOGKBCIEF-UHFFFAOYSA-N 1 2 240.372 2.315 20 0 BEADLO CC[C@@H](C)CCC(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857977149 588926594 /nfs/dbraw/zinc/92/65/94/588926594.db2.gz AUVDIKKSXUEGFC-MNOVXSKESA-N 1 2 235.331 2.270 20 0 BEADLO CO[C@@H]1C[N@H+](Cc2csc(C)c2C)CCO1 ZINC000895964572 583754149 /nfs/dbraw/zinc/75/41/49/583754149.db2.gz YIVXCQCBVMZUCL-LBPRGKRZSA-N 1 2 241.356 2.170 20 0 BEADLO CO[C@@H]1C[N@@H+](Cc2csc(C)c2C)CCO1 ZINC000895964572 583754151 /nfs/dbraw/zinc/75/41/51/583754151.db2.gz YIVXCQCBVMZUCL-LBPRGKRZSA-N 1 2 241.356 2.170 20 0 BEADLO COCC1C[NH+](Cc2cc(F)c(F)c(F)c2)C1 ZINC000895971918 583756307 /nfs/dbraw/zinc/75/63/07/583756307.db2.gz XBPKCGQWDRDVLY-UHFFFAOYSA-N 1 2 245.244 2.182 20 0 BEADLO C[NH+](C)C1(c2nc(C3CCCC3)no2)CC1 ZINC000895997599 583759628 /nfs/dbraw/zinc/75/96/28/583759628.db2.gz MGPQIJNFWNHDLW-UHFFFAOYSA-N 1 2 221.304 2.278 20 0 BEADLO CC(=O)OC[C@@H](C)Nc1c[nH+]c(C)c(C)c1 ZINC000896020762 583763920 /nfs/dbraw/zinc/76/39/20/583763920.db2.gz CRFSDUVPCCARHG-SECBINFHSA-N 1 2 222.288 2.062 20 0 BEADLO CC(=O)OC[C@H](C)Nc1c[nH+]c(C)c(C)c1 ZINC000896020763 583763981 /nfs/dbraw/zinc/76/39/81/583763981.db2.gz CRFSDUVPCCARHG-VIFPVBQESA-N 1 2 222.288 2.062 20 0 BEADLO CC(C)C(C)(C)C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857980119 588927532 /nfs/dbraw/zinc/92/75/32/588927532.db2.gz ULGSKDWJKFTHRA-JTQLQIEISA-N 1 2 235.331 2.126 20 0 BEADLO Cc1cc(F)ncc1C[NH2+][C@@H](C)C(F)F ZINC000896038572 583766039 /nfs/dbraw/zinc/76/60/39/583766039.db2.gz SNJANRJKAIZJMK-ZETCQYMHSA-N 1 2 218.222 2.272 20 0 BEADLO CC1(C(=O)N[C@@H]2CCn3c[nH+]cc32)CCCCC1 ZINC000857982989 588927739 /nfs/dbraw/zinc/92/77/39/588927739.db2.gz UOMJFAFODPDWTO-LLVKDONJSA-N 1 2 247.342 2.415 20 0 BEADLO CC(C)C[C@@H](C)C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857982587 588927808 /nfs/dbraw/zinc/92/78/08/588927808.db2.gz QMZYSIPIFVDYJA-GHMZBOCLSA-N 1 2 235.331 2.126 20 0 BEADLO CCC(C)(CC)C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857981218 588928145 /nfs/dbraw/zinc/92/81/45/588928145.db2.gz BZNWCTNTKDBILK-SNVBAGLBSA-N 1 2 235.331 2.270 20 0 BEADLO CCC(=CC(=O)N[C@H]1CCn2c[nH+]cc21)CC ZINC000857981917 588928175 /nfs/dbraw/zinc/92/81/75/588928175.db2.gz CHERVVDTNWTSOF-NSHDSACASA-N 1 2 233.315 2.191 20 0 BEADLO O=C(N[C@H]1CCn2c[nH+]cc21)C12CCC(CC1)C2 ZINC000857983052 588928547 /nfs/dbraw/zinc/92/85/47/588928547.db2.gz VMKPCCRWTWDVMK-CVZZAPKMSA-N 1 2 245.326 2.024 20 0 BEADLO C[C@@H]1CCC[C@@H]1CC(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857983295 588928554 /nfs/dbraw/zinc/92/85/54/588928554.db2.gz ZPJNQBFYGWTROI-IJLUTSLNSA-N 1 2 247.342 2.270 20 0 BEADLO COc1ccc[nH+]c1NC[C@@]1(C)CCCCO1 ZINC000896182948 583778688 /nfs/dbraw/zinc/77/86/88/583778688.db2.gz VKCRNJHYFJHAHV-CYBMUJFWSA-N 1 2 236.315 2.461 20 0 BEADLO C[C@@H]1CC[C@@H](CC(=O)N[C@@H]2CCn3c[nH+]cc32)C1 ZINC000857984377 588928669 /nfs/dbraw/zinc/92/86/69/588928669.db2.gz ZGCXOTPUEQHKRQ-IJLUTSLNSA-N 1 2 247.342 2.270 20 0 BEADLO CCC[C@@H](C)CC(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857983545 588928831 /nfs/dbraw/zinc/92/88/31/588928831.db2.gz BMGBVXDMWGGXKF-GHMZBOCLSA-N 1 2 235.331 2.270 20 0 BEADLO CCC[C@H](O)CCNc1[nH+]c(C)nc2[nH]ccc21 ZINC000896187600 583781319 /nfs/dbraw/zinc/78/13/19/583781319.db2.gz RMIRUWGBFLCBCW-JTQLQIEISA-N 1 2 248.330 2.181 20 0 BEADLO O=C(N[C@@H]1CCn2c[nH+]cc21)C12CCC(CC1)C2 ZINC000857983053 588928929 /nfs/dbraw/zinc/92/89/29/588928929.db2.gz VMKPCCRWTWDVMK-IQLKVPPVSA-N 1 2 245.326 2.024 20 0 BEADLO O=C(CC1CCCC1)N[C@H]1CCn2c[nH+]cc21 ZINC000857991411 588929911 /nfs/dbraw/zinc/92/99/11/588929911.db2.gz XQDNACSSTXWEET-NSHDSACASA-N 1 2 233.315 2.024 20 0 BEADLO CCCCCC(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857990500 588930161 /nfs/dbraw/zinc/93/01/61/588930161.db2.gz WDFZFLNXILRISV-JTQLQIEISA-N 1 2 221.304 2.024 20 0 BEADLO F[C@H]1COc2ccccc2[C@H]1[NH2+]C1CSC1 ZINC000896421911 583801714 /nfs/dbraw/zinc/80/17/14/583801714.db2.gz DVPUMNGVRZBENH-CMPLNLGQSA-N 1 2 239.315 2.163 20 0 BEADLO F[C@H]1COc2ccccc2[C@@H]1[NH2+]C1CSC1 ZINC000896421912 583801975 /nfs/dbraw/zinc/80/19/75/583801975.db2.gz DVPUMNGVRZBENH-JQWIXIFHSA-N 1 2 239.315 2.163 20 0 BEADLO COC[C@H](CNc1cc[nH+]c(C)n1)C(C)C ZINC000896503047 583807854 /nfs/dbraw/zinc/80/78/54/583807854.db2.gz MNYXKVZXNNJAGS-NSHDSACASA-N 1 2 223.320 2.116 20 0 BEADLO CCc1nc(N2CCOC[C@@H]2CC2CC2)cc[nH+]1 ZINC000896637486 583819462 /nfs/dbraw/zinc/81/94/62/583819462.db2.gz NFHYZULWYCUYIU-LBPRGKRZSA-N 1 2 247.342 2.044 20 0 BEADLO Fc1cc(C[N@@H+]2CCn3cccc3C2)c(F)cn1 ZINC000896761943 583831235 /nfs/dbraw/zinc/83/12/35/583831235.db2.gz WVZMLWZRQHDTQO-UHFFFAOYSA-N 1 2 249.264 2.177 20 0 BEADLO Fc1cc(C[N@H+]2CCn3cccc3C2)c(F)cn1 ZINC000896761943 583831237 /nfs/dbraw/zinc/83/12/37/583831237.db2.gz WVZMLWZRQHDTQO-UHFFFAOYSA-N 1 2 249.264 2.177 20 0 BEADLO OC1(C2(CNc3cccc[nH+]3)CC2)CCC1 ZINC000896808819 583835211 /nfs/dbraw/zinc/83/52/11/583835211.db2.gz ZBWAENQDSMLJEP-UHFFFAOYSA-N 1 2 218.300 2.189 20 0 BEADLO CCc1nc(NCC[C@@H]2CCCC[C@@H]2O)cc[nH+]1 ZINC000896812142 583835975 /nfs/dbraw/zinc/83/59/75/583835975.db2.gz FYZMDXDLFALTJD-RYUDHWBXSA-N 1 2 249.358 2.392 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H]2CC[C@H](C)C2)[nH+]c1C ZINC000896913263 583853837 /nfs/dbraw/zinc/85/38/37/583853837.db2.gz QASYSNRRJCSNAX-GZMMTYOYSA-N 1 2 235.331 2.079 20 0 BEADLO CCC(C)(C)CC(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000896916531 583854849 /nfs/dbraw/zinc/85/48/49/583854849.db2.gz YOOFXJKHOBERLJ-UHFFFAOYSA-N 1 2 237.347 2.469 20 0 BEADLO CONC(=O)C[NH2+]CC[C@@H](C)CCC=C(C)C ZINC000896927700 583859333 /nfs/dbraw/zinc/85/93/33/583859333.db2.gz UVITYJYMNAQADQ-LBPRGKRZSA-N 1 2 242.363 2.026 20 0 BEADLO Cc1[nH]c(CNC(=O)c2ccc(C)cc2)[nH+]c1C ZINC000896929054 583859844 /nfs/dbraw/zinc/85/98/44/583859844.db2.gz BUMDVIKZODFNIC-UHFFFAOYSA-N 1 2 243.310 2.265 20 0 BEADLO Cc1[nH]c(CNC(=O)C2CCCCC2)[nH+]c1C ZINC000896929612 583860145 /nfs/dbraw/zinc/86/01/45/583860145.db2.gz KPKBVWNKLURTEE-UHFFFAOYSA-N 1 2 235.331 2.223 20 0 BEADLO CC[C@@H]1CCN(C(=O)C(C)(C)n2c[nH+]c(C)c2)C1 ZINC000896942869 583862837 /nfs/dbraw/zinc/86/28/37/583862837.db2.gz AOVWCKDZKLWUQS-GFCCVEGCSA-N 1 2 249.358 2.185 20 0 BEADLO CC1(C[N@@H+]2CCn3nc(C4CC4)cc3C2)CC1 ZINC000896940112 583862931 /nfs/dbraw/zinc/86/29/31/583862931.db2.gz SQWPUZVPYCQXJW-UHFFFAOYSA-N 1 2 231.343 2.376 20 0 BEADLO CC1(C[N@H+]2CCn3nc(C4CC4)cc3C2)CC1 ZINC000896940112 583862934 /nfs/dbraw/zinc/86/29/34/583862934.db2.gz SQWPUZVPYCQXJW-UHFFFAOYSA-N 1 2 231.343 2.376 20 0 BEADLO Cc1cc(NC2CC3(C2)CO[C@@H](C)C3)nc[nH+]1 ZINC000897043840 583874004 /nfs/dbraw/zinc/87/40/04/583874004.db2.gz MSGBMKIXWNDPPY-ZBOXLXRLSA-N 1 2 233.315 2.155 20 0 BEADLO CCO[C@H]1CC[N@H+](Cc2nc(C(C)C)c[nH]2)C1 ZINC000897061532 583875433 /nfs/dbraw/zinc/87/54/33/583875433.db2.gz JZHRDUUFBOMYLI-NSHDSACASA-N 1 2 237.347 2.144 20 0 BEADLO CCO[C@H]1CC[N@@H+](Cc2nc(C(C)C)c[nH]2)C1 ZINC000897061532 583875436 /nfs/dbraw/zinc/87/54/36/583875436.db2.gz JZHRDUUFBOMYLI-NSHDSACASA-N 1 2 237.347 2.144 20 0 BEADLO Cc1occc1C[NH2+][C@H]1CCCc2[nH]ncc21 ZINC000796719642 583878941 /nfs/dbraw/zinc/87/89/41/583878941.db2.gz HVZJCWHOLZIRTO-LBPRGKRZSA-N 1 2 231.299 2.478 20 0 BEADLO CO[C@H]1CC[C@H]1N(C)c1cc[nH+]c(C(C)C)n1 ZINC000897149066 583884332 /nfs/dbraw/zinc/88/43/32/583884332.db2.gz NQDLCLKNCZNGHR-MNOVXSKESA-N 1 2 235.331 2.214 20 0 BEADLO CO[C@@H]1CC[C@@H]1N(C)c1cc[nH+]c(C(C)C)n1 ZINC000897149068 583884777 /nfs/dbraw/zinc/88/47/77/583884777.db2.gz NQDLCLKNCZNGHR-WDEREUQCSA-N 1 2 235.331 2.214 20 0 BEADLO CO[C@@H]1CC[C@@H]1N(C)c1[nH+]c2ccccc2n1C ZINC000897147604 583885916 /nfs/dbraw/zinc/88/59/16/583885916.db2.gz OHWGFJQIIKASCD-QWHCGFSZSA-N 1 2 245.326 2.187 20 0 BEADLO CN(C)c1cc(N[C@@H]2C[C@H]3CCC[C@H]32)[nH+]cn1 ZINC000897176625 583888928 /nfs/dbraw/zinc/88/89/28/583888928.db2.gz ASTYJCVRVDJBSB-GMTAPVOTSA-N 1 2 232.331 2.143 20 0 BEADLO CN(C)c1cc(N[C@@H]2C[C@H]3CCC[C@H]32)nc[nH+]1 ZINC000897176625 583888931 /nfs/dbraw/zinc/88/89/31/583888931.db2.gz ASTYJCVRVDJBSB-GMTAPVOTSA-N 1 2 232.331 2.143 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1C[C@H]2CCC[C@H]21 ZINC000897177011 583890114 /nfs/dbraw/zinc/89/01/14/583890114.db2.gz IMQROFMZRAFLGU-KBVBSXBZSA-N 1 2 206.264 2.243 20 0 BEADLO OCc1cc[nH+]c(N[C@@H]2C[C@H]3CCC[C@@H]32)c1 ZINC000897177629 583890309 /nfs/dbraw/zinc/89/03/09/583890309.db2.gz SKTPZDDISDVOML-GRYCIOLGSA-N 1 2 218.300 2.174 20 0 BEADLO OCc1cc[nH+]c(N[C@@H]2C[C@H]3CCC[C@H]32)c1 ZINC000897177630 583890615 /nfs/dbraw/zinc/89/06/15/583890615.db2.gz SKTPZDDISDVOML-IJLUTSLNSA-N 1 2 218.300 2.174 20 0 BEADLO Nc1[nH+]cnc(N[C@@H]2C[C@H]3CCC[C@@H]32)c1Cl ZINC000897179712 583891310 /nfs/dbraw/zinc/89/13/10/583891310.db2.gz JUZNCGIBWWBFSS-GJMOJQLCSA-N 1 2 238.722 2.313 20 0 BEADLO Nc1nc[nH+]c(N[C@@H]2C[C@H]3CCC[C@@H]32)c1Cl ZINC000897179712 583891312 /nfs/dbraw/zinc/89/13/12/583891312.db2.gz JUZNCGIBWWBFSS-GJMOJQLCSA-N 1 2 238.722 2.313 20 0 BEADLO Cc1cc(N[C@@H](C)Cc2cccnc2)nc[nH+]1 ZINC000897196079 583893714 /nfs/dbraw/zinc/89/37/14/583893714.db2.gz MLMISBFWZUMFHL-NSHDSACASA-N 1 2 228.299 2.223 20 0 BEADLO CC(C)=CC(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000728543355 583896551 /nfs/dbraw/zinc/89/65/51/583896551.db2.gz WOVPXNZRQPKLLX-GFCCVEGCSA-N 1 2 233.315 2.013 20 0 BEADLO Fc1c[nH+]ccc1NC[C@]12C[C@H]1COC21CCC1 ZINC000897260539 583905765 /nfs/dbraw/zinc/90/57/65/583905765.db2.gz FRNGVRXMNZGMGZ-GXFFZTMASA-N 1 2 248.301 2.014 20 0 BEADLO Cc1cc(N[C@@H]2CCOC23CCCC3)nc[nH+]1 ZINC000897320000 583920996 /nfs/dbraw/zinc/92/09/96/583920996.db2.gz GVXDRUYCVTXRQF-LLVKDONJSA-N 1 2 233.315 2.299 20 0 BEADLO CC/C=C(/C)C(=O)N1CC(Oc2cc[nH+]cc2)C1 ZINC000729247270 583979221 /nfs/dbraw/zinc/97/92/21/583979221.db2.gz FZXGANPDITUBAW-WCIBSUBMSA-N 1 2 246.310 2.028 20 0 BEADLO c1cc(N[C@@H]2COC[C@H]2C2CC2)nc(C2CC2)[nH+]1 ZINC000897448811 583986990 /nfs/dbraw/zinc/98/69/90/583986990.db2.gz YDKHNLHYYJNSCK-NWDGAFQWSA-N 1 2 245.326 2.191 20 0 BEADLO CC(C)=CCCNC(=O)C(C)(C)n1c[nH+]c(C)c1 ZINC000897546586 584016051 /nfs/dbraw/zinc/01/60/51/584016051.db2.gz COOKUUVQJDHGCJ-UHFFFAOYSA-N 1 2 249.358 2.399 20 0 BEADLO CC(C)Cc1cc(NC[C@H]2CCCO2)nc[nH+]1 ZINC000865398562 584017938 /nfs/dbraw/zinc/01/79/38/584017938.db2.gz YRHWMZZXZXXCQJ-GFCCVEGCSA-N 1 2 235.331 2.266 20 0 BEADLO Cn1ccc(C[NH2+][C@H]2CCCc3scnc32)n1 ZINC000858384770 588950337 /nfs/dbraw/zinc/95/03/37/588950337.db2.gz VMBLSJCSLQAQTB-JTQLQIEISA-N 1 2 248.355 2.044 20 0 BEADLO CC(C)Cc1cc(N[C@@H](C)C[C@@H](C)O)nc[nH+]1 ZINC000865669704 584025698 /nfs/dbraw/zinc/02/56/98/584025698.db2.gz JBJJGCGFBWKSPG-WDEREUQCSA-N 1 2 237.347 2.246 20 0 BEADLO COc1ccc2c(c1)[C@H]([NH2+]Cc1ccon1)CC2 ZINC000148752323 584041244 /nfs/dbraw/zinc/04/12/44/584041244.db2.gz LAKXLASPNKLFPA-CQSZACIVSA-N 1 2 244.294 2.460 20 0 BEADLO COc1ccc[nH+]c1N(C)CC1CCC1 ZINC000858406524 588951850 /nfs/dbraw/zinc/95/18/50/588951850.db2.gz NOWGROPLQLLIEM-UHFFFAOYSA-N 1 2 206.289 2.327 20 0 BEADLO Cn1cncc1CNc1ccc(C2CC2)c[nH+]1 ZINC000897711996 584042735 /nfs/dbraw/zinc/04/27/35/584042735.db2.gz KECCXTGVYDDCKU-UHFFFAOYSA-N 1 2 228.299 2.305 20 0 BEADLO CCC[C@@H]([NH2+][C@H]1CC[C@H](C)SC1)C(=O)OC ZINC000897834061 584052472 /nfs/dbraw/zinc/05/24/72/584052472.db2.gz GJOMBWQAFZTMCK-GARJFASQSA-N 1 2 245.388 2.202 20 0 BEADLO Cc1[nH]ncc1C[NH2+]C[C@@H]1CCCC(C)(C)O1 ZINC000898049574 584073763 /nfs/dbraw/zinc/07/37/63/584073763.db2.gz JGHSYLITYUCHLA-LBPRGKRZSA-N 1 2 237.347 2.155 20 0 BEADLO c1nc(C[NH2+][C@H](c2ccncc2)C2CC2)co1 ZINC000898322842 584107080 /nfs/dbraw/zinc/10/70/80/584107080.db2.gz SDJSPJWBCKMMCB-ZDUSSCGKSA-N 1 2 229.283 2.311 20 0 BEADLO COC(=O)[C@@H]([NH2+][C@H]1CC[C@@H]1C)c1ccccc1 ZINC000898336589 584111714 /nfs/dbraw/zinc/11/17/14/584111714.db2.gz UJHICBNIEKQRAU-DRZSPHRISA-N 1 2 233.311 2.289 20 0 BEADLO CC(C)c1cncc(NC(=O)Cc2c[nH+]c[nH]2)c1 ZINC000888235298 584118678 /nfs/dbraw/zinc/11/86/78/584118678.db2.gz JQIOJGTZHGDDII-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO CC(C)c1cncc(NC(=O)Cc2c[nH]c[nH+]2)c1 ZINC000888235298 584118680 /nfs/dbraw/zinc/11/86/80/584118680.db2.gz JQIOJGTZHGDDII-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO Cc1c(Cl)c(C[NH2+]C/C=C\Cl)nn1C ZINC000898429527 584133744 /nfs/dbraw/zinc/13/37/44/584133744.db2.gz PLZLHKBFJNLVSL-ARJAWSKDSA-N 1 2 234.130 2.224 20 0 BEADLO CC(C)(C)[C@@H]1C[C@H]1C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000898811393 584159995 /nfs/dbraw/zinc/15/99/95/584159995.db2.gz SRIMOTFNBHCXIF-GMTAPVOTSA-N 1 2 247.342 2.126 20 0 BEADLO O=C(N[C@@H]1CCn2c[nH+]cc21)[C@@]12C[C@@H]1CCCC2 ZINC000898809993 584160274 /nfs/dbraw/zinc/16/02/74/584160274.db2.gz GOOFMYSMMKZMQQ-WDMOLILDSA-N 1 2 245.326 2.024 20 0 BEADLO CCCCCC(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000898900202 584165376 /nfs/dbraw/zinc/16/53/76/584165376.db2.gz ZEKDASZNDMWEFK-UHFFFAOYSA-N 1 2 237.347 2.315 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)Nc1nccnc1F ZINC000858563509 588966145 /nfs/dbraw/zinc/96/61/45/588966145.db2.gz WIYLSFRECUNQJP-MRVPVSSYSA-N 1 2 235.266 2.005 20 0 BEADLO CCn1cc(C[N@H+](CC)Cc2occc2C)nn1 ZINC000899870426 584244557 /nfs/dbraw/zinc/24/45/57/584244557.db2.gz VCHWYPFRJHUOPT-UHFFFAOYSA-N 1 2 248.330 2.222 20 0 BEADLO CCn1cc(C[N@@H+](CC)Cc2occc2C)nn1 ZINC000899870426 584244560 /nfs/dbraw/zinc/24/45/60/584244560.db2.gz VCHWYPFRJHUOPT-UHFFFAOYSA-N 1 2 248.330 2.222 20 0 BEADLO O=C(CNc1cccc[nH+]1)NCC1CCCCC1 ZINC000899920095 584252444 /nfs/dbraw/zinc/25/24/44/584252444.db2.gz IXTMJVQFKPLYQW-UHFFFAOYSA-N 1 2 247.342 2.190 20 0 BEADLO C[C@H]1CCCC[C@@H]1NC(=O)CNc1cccc[nH+]1 ZINC000899937331 584258267 /nfs/dbraw/zinc/25/82/67/584258267.db2.gz OVHQEDMSSSTGQZ-RYUDHWBXSA-N 1 2 247.342 2.188 20 0 BEADLO Cc1ccc([C@H](C)NC(=O)Cc2c[nH]c[nH+]2)cc1 ZINC000900122516 584275325 /nfs/dbraw/zinc/27/53/25/584275325.db2.gz DQHZJJBTJWDLMK-NSHDSACASA-N 1 2 243.310 2.138 20 0 BEADLO Cc1ccc([C@H](C)NC(=O)Cc2c[nH+]c[nH]2)cc1 ZINC000900122516 584275327 /nfs/dbraw/zinc/27/53/27/584275327.db2.gz DQHZJJBTJWDLMK-NSHDSACASA-N 1 2 243.310 2.138 20 0 BEADLO Cc1ccc([C@@H](C)NC(=O)Cc2c[nH]c[nH+]2)cc1 ZINC000900122515 584275616 /nfs/dbraw/zinc/27/56/16/584275616.db2.gz DQHZJJBTJWDLMK-LLVKDONJSA-N 1 2 243.310 2.138 20 0 BEADLO Cc1ccc([C@@H](C)NC(=O)Cc2c[nH+]c[nH]2)cc1 ZINC000900122515 584275618 /nfs/dbraw/zinc/27/56/18/584275618.db2.gz DQHZJJBTJWDLMK-LLVKDONJSA-N 1 2 243.310 2.138 20 0 BEADLO CCCN(CC(C)C)C(=O)CNc1cccc[nH+]1 ZINC000900144465 584277016 /nfs/dbraw/zinc/27/70/16/584277016.db2.gz FMERYSKIXVPTLC-UHFFFAOYSA-N 1 2 249.358 2.388 20 0 BEADLO CC[C@@H]1CCCC[C@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000900189276 584284707 /nfs/dbraw/zinc/28/47/07/584284707.db2.gz XFZRNHNNCSOUKP-ZYHUDNBSSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@@H]1CCCC[C@H]1NC(=O)Cc1c[nH+]c[nH]1 ZINC000900189276 584284708 /nfs/dbraw/zinc/28/47/08/584284708.db2.gz XFZRNHNNCSOUKP-ZYHUDNBSSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@H]1CCCC[C@@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000900189274 584284897 /nfs/dbraw/zinc/28/48/97/584284897.db2.gz XFZRNHNNCSOUKP-JQWIXIFHSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@H]1CCCC[C@@H]1NC(=O)Cc1c[nH+]c[nH]1 ZINC000900189274 584284898 /nfs/dbraw/zinc/28/48/98/584284898.db2.gz XFZRNHNNCSOUKP-JQWIXIFHSA-N 1 2 235.331 2.037 20 0 BEADLO CC1CCC(C)(NC(=O)Cc2c[nH]c[nH+]2)CC1 ZINC000900477932 584315464 /nfs/dbraw/zinc/31/54/64/584315464.db2.gz ZSODOZBNOZIEDG-UHFFFAOYSA-N 1 2 235.331 2.037 20 0 BEADLO CC1CCC(C)(NC(=O)Cc2c[nH+]c[nH]2)CC1 ZINC000900477932 584315465 /nfs/dbraw/zinc/31/54/65/584315465.db2.gz ZSODOZBNOZIEDG-UHFFFAOYSA-N 1 2 235.331 2.037 20 0 BEADLO CCN(C(=O)Cc1c[nH+]c[nH]1)[C@@H]1CCCC[C@H]1C ZINC000900531010 584322736 /nfs/dbraw/zinc/32/27/36/584322736.db2.gz VFYCQCDTNMBACC-DGCLKSJQSA-N 1 2 249.358 2.379 20 0 BEADLO CC(C)[C@@H]1CCC[C@H](NC(=O)Cc2c[nH]c[nH+]2)C1 ZINC000900572870 584326876 /nfs/dbraw/zinc/32/68/76/584326876.db2.gz JGQSWGVWPGEUQU-NEPJUHHUSA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)[C@@H]1CCC[C@H](NC(=O)Cc2c[nH+]c[nH]2)C1 ZINC000900572870 584326877 /nfs/dbraw/zinc/32/68/77/584326877.db2.gz JGQSWGVWPGEUQU-NEPJUHHUSA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)[C@H]1CCC[C@@H](NC(=O)Cc2c[nH]c[nH+]2)C1 ZINC000900572872 584326914 /nfs/dbraw/zinc/32/69/14/584326914.db2.gz JGQSWGVWPGEUQU-NWDGAFQWSA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)[C@H]1CCC[C@@H](NC(=O)Cc2c[nH+]c[nH]2)C1 ZINC000900572872 584326915 /nfs/dbraw/zinc/32/69/15/584326915.db2.gz JGQSWGVWPGEUQU-NWDGAFQWSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@H](C)[C@H](C)N(C(=O)Cc1c[nH+]c[nH]1)C1CC1 ZINC000900588190 584328844 /nfs/dbraw/zinc/32/88/44/584328844.db2.gz MXEFYEAAPYPUBM-QWRGUYRKSA-N 1 2 249.358 2.378 20 0 BEADLO C[C@H]1CCC[C@@H](CCNC(=O)Cc2c[nH]c[nH+]2)C1 ZINC000900733160 584346959 /nfs/dbraw/zinc/34/69/59/584346959.db2.gz ZCRWBOPIZFXDFF-RYUDHWBXSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H]1CCC[C@@H](CCNC(=O)Cc2c[nH+]c[nH]2)C1 ZINC000900733160 584346960 /nfs/dbraw/zinc/34/69/60/584346960.db2.gz ZCRWBOPIZFXDFF-RYUDHWBXSA-N 1 2 249.358 2.285 20 0 BEADLO CC[C@@H](C)[C@H]1CCCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC000900771788 584349365 /nfs/dbraw/zinc/34/93/65/584349365.db2.gz DFSCOIFZNFUKDV-DGCLKSJQSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@@H]1CC(C)(C)CC[C@@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000900953712 584366441 /nfs/dbraw/zinc/36/64/41/584366441.db2.gz FOGGHJCQVVIHGU-PWSUYJOCSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CC(C)(C)CC[C@@H]1NC(=O)Cc1c[nH+]c[nH]1 ZINC000900953712 584366444 /nfs/dbraw/zinc/36/64/44/584366444.db2.gz FOGGHJCQVVIHGU-PWSUYJOCSA-N 1 2 249.358 2.283 20 0 BEADLO CC1(C)CCC[C@@H]1NC(=O)CNc1cccc[nH+]1 ZINC000900972124 584369919 /nfs/dbraw/zinc/36/99/19/584369919.db2.gz IJXXAHNWELQKFK-NSHDSACASA-N 1 2 247.342 2.188 20 0 BEADLO CC(C)CC(C)(C)CNC(=O)Cc1c[nH]c[nH+]1 ZINC000900982473 584372724 /nfs/dbraw/zinc/37/27/24/584372724.db2.gz DHYUPCUHDJCGJF-UHFFFAOYSA-N 1 2 237.347 2.141 20 0 BEADLO CC(C)CC(C)(C)CNC(=O)Cc1c[nH+]c[nH]1 ZINC000900982473 584372725 /nfs/dbraw/zinc/37/27/25/584372725.db2.gz DHYUPCUHDJCGJF-UHFFFAOYSA-N 1 2 237.347 2.141 20 0 BEADLO CC(C)CC1(CNC(=O)Cc2c[nH]c[nH+]2)CCC1 ZINC000901016202 584374136 /nfs/dbraw/zinc/37/41/36/584374136.db2.gz LAPKETQUXXTRCB-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO CC(C)CC1(CNC(=O)Cc2c[nH+]c[nH]2)CCC1 ZINC000901016202 584374138 /nfs/dbraw/zinc/37/41/38/584374138.db2.gz LAPKETQUXXTRCB-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO CC(C)C[C@H]1CCCN(C(=O)Cc2c[nH+]c[nH]2)C1 ZINC000901038761 584376393 /nfs/dbraw/zinc/37/63/93/584376393.db2.gz KUCHNJVYCXPDCA-GFCCVEGCSA-N 1 2 249.358 2.237 20 0 BEADLO CC(C)CC[C@H]1CCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC000901117414 584386559 /nfs/dbraw/zinc/38/65/59/584386559.db2.gz IICKUVUWRANMTO-CYBMUJFWSA-N 1 2 249.358 2.379 20 0 BEADLO CC1(CNC(=O)Cc2c[nH]c[nH+]2)CCCCCC1 ZINC000901333556 584425628 /nfs/dbraw/zinc/42/56/28/584425628.db2.gz BTBPWZJWMWNPDP-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO CC1(CNC(=O)Cc2c[nH+]c[nH]2)CCCCCC1 ZINC000901333556 584425629 /nfs/dbraw/zinc/42/56/29/584425629.db2.gz BTBPWZJWMWNPDP-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO CCc1cc(NC(=O)Cc2c[nH+]c[nH]2)ccc1C ZINC000901353827 584431367 /nfs/dbraw/zinc/43/13/67/584431367.db2.gz HLAOOZPUCKMAJJ-UHFFFAOYSA-N 1 2 243.310 2.462 20 0 BEADLO CCc1cc(NC(=O)Cc2c[nH]c[nH+]2)ccc1C ZINC000901353827 584431371 /nfs/dbraw/zinc/43/13/71/584431371.db2.gz HLAOOZPUCKMAJJ-UHFFFAOYSA-N 1 2 243.310 2.462 20 0 BEADLO c1csc(-c2cc([C@H]3COCC[NH2+]3)on2)c1 ZINC000901387970 584437048 /nfs/dbraw/zinc/43/70/48/584437048.db2.gz OTBHEEPQQKFGRH-SECBINFHSA-N 1 2 236.296 2.064 20 0 BEADLO Cc1ccc(-c2cc([C@@H]3COCC[NH2+]3)on2)cc1 ZINC000901398994 584438949 /nfs/dbraw/zinc/43/89/49/584438949.db2.gz AGHUAUHBEYSARL-ZDUSSCGKSA-N 1 2 244.294 2.311 20 0 BEADLO CO[C@H](C)Sc1[nH+]cc2ccccn21 ZINC000901411806 584440807 /nfs/dbraw/zinc/44/08/07/584440807.db2.gz WIZPAEGOUAXGTJ-QMMMGPOBSA-N 1 2 208.286 2.419 20 0 BEADLO COc1cc(C)[nH+]c(CSC2COC2)c1 ZINC000901634017 584472734 /nfs/dbraw/zinc/47/27/34/584472734.db2.gz GKZNVXFXCPQCQI-UHFFFAOYSA-N 1 2 225.313 2.031 20 0 BEADLO Cc1cc(NCc2[nH+]ccn2C2CC2)no1 ZINC000902038278 584514878 /nfs/dbraw/zinc/51/48/78/584514878.db2.gz RJYIGDUJNIDMGL-UHFFFAOYSA-N 1 2 218.260 2.127 20 0 BEADLO Cc1[nH]c(CNc2nnc(C3CC3)s2)[nH+]c1C ZINC000902037818 584515094 /nfs/dbraw/zinc/51/50/94/584515094.db2.gz QTOLYHLLQGLWDV-UHFFFAOYSA-N 1 2 249.343 2.368 20 0 BEADLO Cc1[nH]c(CNc2nnc(C(C)C)o2)[nH+]c1C ZINC000902040306 584515753 /nfs/dbraw/zinc/51/57/53/584515753.db2.gz AWDYSFSHZJHIEH-UHFFFAOYSA-N 1 2 235.291 2.145 20 0 BEADLO CC[C@@H]1C[C@H]1CO[NH+]=C(N)Cc1cccnc1 ZINC000902299231 584553215 /nfs/dbraw/zinc/55/32/15/584553215.db2.gz YUWWECYOADZGGH-NEPJUHHUSA-N 1 2 233.315 2.169 20 0 BEADLO CCn1c[nH+]c(CNc2ccc(CCO)cc2)c1 ZINC000902302778 584553640 /nfs/dbraw/zinc/55/36/40/584553640.db2.gz SJGDEHICLVZUHM-UHFFFAOYSA-N 1 2 245.326 2.050 20 0 BEADLO CCCOC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000859057187 588994778 /nfs/dbraw/zinc/99/47/78/588994778.db2.gz BUQZTWXBPCUAFW-JTQLQIEISA-N 1 2 237.303 2.483 20 0 BEADLO NC(=[NH+]OCC[C@@H]1C[C@H]1C1CC1)[C@@H]1CCCO1 ZINC000902381195 584576609 /nfs/dbraw/zinc/57/66/09/584576609.db2.gz LQRCMFLDURMTQU-WOPDTQHZSA-N 1 2 238.331 2.100 20 0 BEADLO CCn1cnc(CNc2c[nH+]ccc2C)c1 ZINC000902394857 584584411 /nfs/dbraw/zinc/58/44/11/584584411.db2.gz FFMRDJFITCBQPV-UHFFFAOYSA-N 1 2 216.288 2.219 20 0 BEADLO COc1cccc(COCc2[nH]cc[nH+]2)c1C ZINC000902395933 584585625 /nfs/dbraw/zinc/58/56/25/584585625.db2.gz GJWPUHMDFCYTTF-UHFFFAOYSA-N 1 2 232.283 2.444 20 0 BEADLO CCn1c[nH+]c(CNc2cccnc2C)c1 ZINC000902400082 584586442 /nfs/dbraw/zinc/58/64/42/584586442.db2.gz XTTHTTAOFLQTLI-UHFFFAOYSA-N 1 2 216.288 2.219 20 0 BEADLO Cc1cc[nH+]cc1Cn1cc2c(n1)C(=O)CCC2 ZINC000902544118 584629367 /nfs/dbraw/zinc/62/93/67/584629367.db2.gz AHWJGHFOOJIMRL-UHFFFAOYSA-N 1 2 241.294 2.154 20 0 BEADLO CCc1onc(C)c1NCc1cn(CC)c[nH+]1 ZINC000902561879 584634313 /nfs/dbraw/zinc/63/43/13/584634313.db2.gz HMHYWKRXXLKJND-UHFFFAOYSA-N 1 2 234.303 2.374 20 0 BEADLO CCCOC(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000859100786 589002087 /nfs/dbraw/zinc/00/20/87/589002087.db2.gz IVIJCNLGNDMUGR-VIFPVBQESA-N 1 2 223.276 2.093 20 0 BEADLO CCN(C)C(=O)COc1ccc2c[nH+]ccc2c1 ZINC000902639389 584649058 /nfs/dbraw/zinc/64/90/58/584649058.db2.gz WIKLIQUDCAEZAR-UHFFFAOYSA-N 1 2 244.294 2.092 20 0 BEADLO CCn1c[nH+]c(CNc2cnn(CC)c2C)c1 ZINC000902640483 584649929 /nfs/dbraw/zinc/64/99/29/584649929.db2.gz AUGYJQAKPCTZIE-UHFFFAOYSA-N 1 2 233.319 2.040 20 0 BEADLO CCc1onc(C)c1C[NH2+]Cc1cn(CC)cn1 ZINC000902658715 584650422 /nfs/dbraw/zinc/65/04/22/584650422.db2.gz ANCXOVUVEFZXTI-UHFFFAOYSA-N 1 2 248.330 2.052 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+]2CCC[C@@H](F)C2)o1 ZINC000902996739 584714162 /nfs/dbraw/zinc/71/41/62/584714162.db2.gz WIZXTMFOBGIDHQ-VHSXEESVSA-N 1 2 212.268 2.478 20 0 BEADLO Cc1cnc([C@H](C)[N@H+]2CCC[C@@H](F)C2)o1 ZINC000902996739 584714164 /nfs/dbraw/zinc/71/41/64/584714164.db2.gz WIZXTMFOBGIDHQ-VHSXEESVSA-N 1 2 212.268 2.478 20 0 BEADLO CCCCCNC(=O)[C@@H](C)[N@@H+]1CCC[C@H](F)C1 ZINC000902999557 584715138 /nfs/dbraw/zinc/71/51/38/584715138.db2.gz ABWUOWIYVYUHJF-NEPJUHHUSA-N 1 2 244.354 2.115 20 0 BEADLO CCCCCNC(=O)[C@@H](C)[N@H+]1CCC[C@H](F)C1 ZINC000902999557 584715139 /nfs/dbraw/zinc/71/51/39/584715139.db2.gz ABWUOWIYVYUHJF-NEPJUHHUSA-N 1 2 244.354 2.115 20 0 BEADLO CCC(CC)NC(=O)[C@H](C)[N@@H+]1CCC[C@@H](F)C1 ZINC000903001363 584715728 /nfs/dbraw/zinc/71/57/28/584715728.db2.gz NMKYFCYUALRJAJ-WDEREUQCSA-N 1 2 244.354 2.114 20 0 BEADLO CCC(CC)NC(=O)[C@H](C)[N@H+]1CCC[C@@H](F)C1 ZINC000903001363 584715729 /nfs/dbraw/zinc/71/57/29/584715729.db2.gz NMKYFCYUALRJAJ-WDEREUQCSA-N 1 2 244.354 2.114 20 0 BEADLO CCCCCCNC(=O)C[N@@H+]1CCC[C@@H](F)C1 ZINC000903002790 584716277 /nfs/dbraw/zinc/71/62/77/584716277.db2.gz HNLVSJWWAZROIL-GFCCVEGCSA-N 1 2 244.354 2.117 20 0 BEADLO CCCCCCNC(=O)C[N@H+]1CCC[C@@H](F)C1 ZINC000903002790 584716278 /nfs/dbraw/zinc/71/62/78/584716278.db2.gz HNLVSJWWAZROIL-GFCCVEGCSA-N 1 2 244.354 2.117 20 0 BEADLO CC(C)[C@H]([NH2+][C@@H](C)c1ccco1)c1nncn1C ZINC000903061235 584723022 /nfs/dbraw/zinc/72/30/22/584723022.db2.gz LQCFGAVSMVAPRO-JQWIXIFHSA-N 1 2 248.330 2.456 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@H]1CC[C@H](C2CC2)O1 ZINC000903250870 584738837 /nfs/dbraw/zinc/73/88/37/584738837.db2.gz DSURMINIFCMXOR-MRCXROJRSA-N 1 2 249.358 2.326 20 0 BEADLO C[C@H]([NH2+]Cc1cn(C)cn1)c1cc(O)ccc1F ZINC000903350515 584754829 /nfs/dbraw/zinc/75/48/29/584754829.db2.gz CIMUDTCFSCTIER-VIFPVBQESA-N 1 2 249.289 2.116 20 0 BEADLO C[C@H](NCc1cn(C)c[nH+]1)c1cc(O)ccc1F ZINC000903350515 584754830 /nfs/dbraw/zinc/75/48/30/584754830.db2.gz CIMUDTCFSCTIER-VIFPVBQESA-N 1 2 249.289 2.116 20 0 BEADLO C[C@H]([NH2+]Cc1ccc(CCO)cc1)c1ncco1 ZINC000903403945 584761028 /nfs/dbraw/zinc/76/10/28/584761028.db2.gz WGTMELAVTONHML-NSHDSACASA-N 1 2 246.310 2.060 20 0 BEADLO C[C@@H]([NH2+]Cc1ccc(CCO)cc1)c1ncco1 ZINC000903403944 584761233 /nfs/dbraw/zinc/76/12/33/584761233.db2.gz WGTMELAVTONHML-LLVKDONJSA-N 1 2 246.310 2.060 20 0 BEADLO Cl/C=C\C[NH2+][C@@H]1CCCc2[nH]ncc21 ZINC000903444134 584768880 /nfs/dbraw/zinc/76/88/80/584768880.db2.gz NFEJTKYEGBQVGL-JHYPKJRRSA-N 1 2 211.696 2.129 20 0 BEADLO CC(C)n1cc([C@H](C)[NH2+]C/C=C\Cl)nn1 ZINC000903446567 584770204 /nfs/dbraw/zinc/77/02/04/584770204.db2.gz YLVVESSIVVHFGK-WBSSQXGSSA-N 1 2 228.727 2.262 20 0 BEADLO Cn1c[nH+]cc1Cc1noc(CCC2(C)CC2)n1 ZINC000904033564 584838237 /nfs/dbraw/zinc/83/82/37/584838237.db2.gz KRZGIWHSGHPANM-UHFFFAOYSA-N 1 2 246.314 2.127 20 0 BEADLO CCO[C@H](c1noc([C@H](C)[NH+](C)C)n1)C(C)C ZINC000904120870 584842459 /nfs/dbraw/zinc/84/24/59/584842459.db2.gz GTOLSRXULFENHZ-UWVGGRQHSA-N 1 2 241.335 2.426 20 0 BEADLO CC[C@H](OC)c1nc(-c2c[nH+]c(N)cc2C)no1 ZINC000904272031 584858553 /nfs/dbraw/zinc/85/85/53/584858553.db2.gz IFNZSSJYEIOWLN-VIFPVBQESA-N 1 2 248.286 2.120 20 0 BEADLO CC[C@@H](OC)c1nc(-c2c[nH+]c(N)cc2C)no1 ZINC000904272030 584858710 /nfs/dbraw/zinc/85/87/10/584858710.db2.gz IFNZSSJYEIOWLN-SECBINFHSA-N 1 2 248.286 2.120 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1noc(C2CCC2)n1 ZINC000904272862 584858825 /nfs/dbraw/zinc/85/88/25/584858825.db2.gz KEEFOPAJWUYVFC-UHFFFAOYSA-N 1 2 230.271 2.290 20 0 BEADLO CCCCc1nc(-c2ccc(N)[nH+]c2C)no1 ZINC000904257089 584859313 /nfs/dbraw/zinc/85/93/13/584859313.db2.gz OYASGSFDEWRGLI-UHFFFAOYSA-N 1 2 232.287 2.365 20 0 BEADLO Cc1[nH+]c(N)ccc1-c1noc(C(C)(C)F)n1 ZINC000904260628 584859383 /nfs/dbraw/zinc/85/93/83/584859383.db2.gz RCFHUPSULJDFLH-UHFFFAOYSA-N 1 2 236.250 2.227 20 0 BEADLO Cc1[nH+]c(N)ccc1-c1noc(CC(C)C)n1 ZINC000904257452 584859420 /nfs/dbraw/zinc/85/94/20/584859420.db2.gz YBBWAOUXLKOPLN-UHFFFAOYSA-N 1 2 232.287 2.221 20 0 BEADLO C[C@@H](OC(=O)[C@@H]1CCCC[N@@H+]1C)c1ccncc1 ZINC000757711745 584903640 /nfs/dbraw/zinc/90/36/40/584903640.db2.gz RQKWWLAAAKDBDL-YPMHNXCESA-N 1 2 248.326 2.170 20 0 BEADLO C[C@@H](OC(=O)[C@@H]1CCCC[N@H+]1C)c1ccncc1 ZINC000757711745 584903641 /nfs/dbraw/zinc/90/36/41/584903641.db2.gz RQKWWLAAAKDBDL-YPMHNXCESA-N 1 2 248.326 2.170 20 0 BEADLO CCC[C@@H]1C[N@H+](C/C=C/Cl)CCO1 ZINC000131723710 584909416 /nfs/dbraw/zinc/90/94/16/584909416.db2.gz RHHHWYIFSBWWBN-RXNUUUNCSA-N 1 2 203.713 2.240 20 0 BEADLO CCC[C@@H]1C[N@@H+](C/C=C/Cl)CCO1 ZINC000131723710 584909417 /nfs/dbraw/zinc/90/94/17/584909417.db2.gz RHHHWYIFSBWWBN-RXNUUUNCSA-N 1 2 203.713 2.240 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C=C1CCCC1 ZINC000730565315 584912710 /nfs/dbraw/zinc/91/27/10/584912710.db2.gz AOZCNAKQXVPNJB-UHFFFAOYSA-N 1 2 216.284 2.251 20 0 BEADLO C/C=C\COC(=O)c1ccc2[nH+]ccn2c1 ZINC000731907673 584931102 /nfs/dbraw/zinc/93/11/02/584931102.db2.gz KIUKZRQZHQBMBC-IHWYPQMZSA-N 1 2 216.240 2.067 20 0 BEADLO CC(C)c1nc(N[C@H]2CCC[C@@H](O)C2)cc[nH+]1 ZINC000731974910 584932621 /nfs/dbraw/zinc/93/26/21/584932621.db2.gz JNALRHDUOCIFQM-WDEREUQCSA-N 1 2 235.331 2.315 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)C=C(C1CC1)C1CC1 ZINC000732094621 584933736 /nfs/dbraw/zinc/93/37/36/584933736.db2.gz RLYORNXWGPSTMV-UHFFFAOYSA-N 1 2 245.326 2.115 20 0 BEADLO Cc1cc(NCc2ccc([C@H](C)O)cc2)nc[nH+]1 ZINC000732567128 584938751 /nfs/dbraw/zinc/93/87/51/584938751.db2.gz ABUSTMJYRUABFL-NSHDSACASA-N 1 2 243.310 2.450 20 0 BEADLO O[C@@H](COc1ccccc1-n1cc[nH+]c1)C1CC1 ZINC000840759277 584945459 /nfs/dbraw/zinc/94/54/59/584945459.db2.gz HNIQEGRVPRMTQB-ZDUSSCGKSA-N 1 2 244.294 2.022 20 0 BEADLO CC(C)c1cnc(C[N@H+](C)[C@@H]2CCOC2)o1 ZINC000733310120 584946724 /nfs/dbraw/zinc/94/67/24/584946724.db2.gz KWSCFXTTZBRLIO-SNVBAGLBSA-N 1 2 224.304 2.019 20 0 BEADLO CC(C)c1cnc(C[N@@H+](C)[C@@H]2CCOC2)o1 ZINC000733310120 584946725 /nfs/dbraw/zinc/94/67/25/584946725.db2.gz KWSCFXTTZBRLIO-SNVBAGLBSA-N 1 2 224.304 2.019 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2nc(C)no2)c(C)o1 ZINC000734004976 584956003 /nfs/dbraw/zinc/95/60/03/584956003.db2.gz YNPLKOXLXNIXKL-MRVPVSSYSA-N 1 2 235.287 2.439 20 0 BEADLO Cc1nonc1C[N@H+](C)Cc1cccs1 ZINC000734147420 584957438 /nfs/dbraw/zinc/95/74/38/584957438.db2.gz KXEKMKUVTLMOAT-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO Cc1nonc1C[N@@H+](C)Cc1cccs1 ZINC000734147420 584957439 /nfs/dbraw/zinc/95/74/39/584957439.db2.gz KXEKMKUVTLMOAT-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO CC[N@H+](CCC(F)(F)F)Cc1nonc1C ZINC000734147940 584957692 /nfs/dbraw/zinc/95/76/92/584957692.db2.gz WDKXLDUODJVULA-UHFFFAOYSA-N 1 2 237.225 2.152 20 0 BEADLO CC[N@@H+](CCC(F)(F)F)Cc1nonc1C ZINC000734147940 584957693 /nfs/dbraw/zinc/95/76/93/584957693.db2.gz WDKXLDUODJVULA-UHFFFAOYSA-N 1 2 237.225 2.152 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@@H](C)C(C)(C)C)c[nH+]1 ZINC000734549870 584963988 /nfs/dbraw/zinc/96/39/88/584963988.db2.gz YSQUSTPRSBERMU-MRVPVSSYSA-N 1 2 223.320 2.130 20 0 BEADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1cnn[nH]1 ZINC000734558604 584964544 /nfs/dbraw/zinc/96/45/44/584964544.db2.gz NEHNDWMDUCFBEY-CQSZACIVSA-N 1 2 242.326 2.314 20 0 BEADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1cnn[nH]1 ZINC000734558604 584964545 /nfs/dbraw/zinc/96/45/45/584964545.db2.gz NEHNDWMDUCFBEY-CQSZACIVSA-N 1 2 242.326 2.314 20 0 BEADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1c[nH]nn1 ZINC000734558604 584964546 /nfs/dbraw/zinc/96/45/46/584964546.db2.gz NEHNDWMDUCFBEY-CQSZACIVSA-N 1 2 242.326 2.314 20 0 BEADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1c[nH]nn1 ZINC000734558604 584964547 /nfs/dbraw/zinc/96/45/47/584964547.db2.gz NEHNDWMDUCFBEY-CQSZACIVSA-N 1 2 242.326 2.314 20 0 BEADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1cn[nH]n1 ZINC000734558604 584964548 /nfs/dbraw/zinc/96/45/48/584964548.db2.gz NEHNDWMDUCFBEY-CQSZACIVSA-N 1 2 242.326 2.314 20 0 BEADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1cn[nH]n1 ZINC000734558604 584964549 /nfs/dbraw/zinc/96/45/49/584964549.db2.gz NEHNDWMDUCFBEY-CQSZACIVSA-N 1 2 242.326 2.314 20 0 BEADLO Cc1cc(NC[C@@H](O)CC(C)C)nc(C2CC2)[nH+]1 ZINC000734835537 584969285 /nfs/dbraw/zinc/96/92/85/584969285.db2.gz XWJNQQHLYJKNIJ-LBPRGKRZSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)[C@@H]2CCCC[C@H]2C)S1 ZINC000819784514 585007049 /nfs/dbraw/zinc/00/70/49/585007049.db2.gz ROTMWBHNTHVJAL-OPRDCNLKSA-N 1 2 240.372 2.420 20 0 BEADLO C[N@H+](C[C@@H]1CCCOC1)CC(F)(F)C(F)F ZINC000736618706 585007395 /nfs/dbraw/zinc/00/73/95/585007395.db2.gz HJKFXPXTNNMGDL-QMMMGPOBSA-N 1 2 243.244 2.245 20 0 BEADLO C[N@@H+](C[C@@H]1CCCOC1)CC(F)(F)C(F)F ZINC000736618706 585007396 /nfs/dbraw/zinc/00/73/96/585007396.db2.gz HJKFXPXTNNMGDL-QMMMGPOBSA-N 1 2 243.244 2.245 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)C[C@@H]2C=CCCC2)S1 ZINC000819781539 585007956 /nfs/dbraw/zinc/00/79/56/585007956.db2.gz KGJUGMHTRDVRBC-VHSXEESVSA-N 1 2 238.356 2.340 20 0 BEADLO COc1c(C)c[nH+]c(COC(=O)[C@@H]2C[C@@H]2C)c1C ZINC000736742471 585011386 /nfs/dbraw/zinc/01/13/86/585011386.db2.gz GJBKQZKQRKPZQU-GZMMTYOYSA-N 1 2 249.310 2.406 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)NCc1cn(C)c[nH+]1 ZINC000890107658 585023670 /nfs/dbraw/zinc/02/36/70/585023670.db2.gz OSKWHWSWFVCFHQ-UXBLZVDNSA-N 1 2 235.331 2.029 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1C(=O)OCc1c[nH+]cn1C ZINC000774140786 585027151 /nfs/dbraw/zinc/02/71/51/585027151.db2.gz UZUXWKWHXKXPQZ-DGCLKSJQSA-N 1 2 236.315 2.146 20 0 BEADLO CC1(CCCC[N@@H+]2CCC(F)(F)C2)OCCO1 ZINC000838922339 585078429 /nfs/dbraw/zinc/07/84/29/585078429.db2.gz QSWYWMMSZKQEOJ-UHFFFAOYSA-N 1 2 249.301 2.261 20 0 BEADLO CC1(CCCC[N@H+]2CCC(F)(F)C2)OCCO1 ZINC000838922339 585078430 /nfs/dbraw/zinc/07/84/30/585078430.db2.gz QSWYWMMSZKQEOJ-UHFFFAOYSA-N 1 2 249.301 2.261 20 0 BEADLO CCn1ncc(C[NH2+][C@@H](C)c2ccccc2F)n1 ZINC000838893208 585078870 /nfs/dbraw/zinc/07/88/70/585078870.db2.gz GSMUDUHEJSHINH-JTQLQIEISA-N 1 2 248.305 2.288 20 0 BEADLO CCn1ncc(C[N@@H+]2CC(C)(C)[C@H]2C(C)C)n1 ZINC000839115044 585091887 /nfs/dbraw/zinc/09/18/87/585091887.db2.gz YCDDHNGBRHCMJB-GFCCVEGCSA-N 1 2 236.363 2.164 20 0 BEADLO CCn1ncc(C[N@H+]2CC(C)(C)[C@H]2C(C)C)n1 ZINC000839115044 585091888 /nfs/dbraw/zinc/09/18/88/585091888.db2.gz YCDDHNGBRHCMJB-GFCCVEGCSA-N 1 2 236.363 2.164 20 0 BEADLO C[C@H]([NH2+]C/C(Cl)=C/Cl)c1ccn(C)n1 ZINC000839195751 585098524 /nfs/dbraw/zinc/09/85/24/585098524.db2.gz GSSJAFADFYRIBG-BJMRUTCWSA-N 1 2 234.130 2.390 20 0 BEADLO Cl/C=C(\Cl)C[N@@H+]1C[C@@H]2C[C@H]1CS2 ZINC000839201720 585099427 /nfs/dbraw/zinc/09/94/27/585099427.db2.gz QRMVRNJUXCRZFV-LZEKQGCWSA-N 1 2 224.156 2.495 20 0 BEADLO Cl/C=C(\Cl)C[N@H+]1C[C@@H]2C[C@H]1CS2 ZINC000839201720 585099428 /nfs/dbraw/zinc/09/94/28/585099428.db2.gz QRMVRNJUXCRZFV-LZEKQGCWSA-N 1 2 224.156 2.495 20 0 BEADLO Clc1cccc(C[N@@H+]2C[C@@H]3C[C@H]2CS3)n1 ZINC000839201384 585099620 /nfs/dbraw/zinc/09/96/20/585099620.db2.gz JKTYLHPWDHSLTG-UWVGGRQHSA-N 1 2 240.759 2.425 20 0 BEADLO Clc1cccc(C[N@H+]2C[C@@H]3C[C@H]2CS3)n1 ZINC000839201384 585099621 /nfs/dbraw/zinc/09/96/21/585099621.db2.gz JKTYLHPWDHSLTG-UWVGGRQHSA-N 1 2 240.759 2.425 20 0 BEADLO CN(C(=O)Cn1cc[nH+]c1)C1CCCCCCC1 ZINC000742248462 585124178 /nfs/dbraw/zinc/12/41/78/585124178.db2.gz YZWREGMQJQXXNX-UHFFFAOYSA-N 1 2 249.358 2.454 20 0 BEADLO CCOCCCO[NH+]=C(N)Cc1ccccc1 ZINC000742354922 585124725 /nfs/dbraw/zinc/12/47/25/585124725.db2.gz YDVZWCFNANYZTA-UHFFFAOYSA-N 1 2 236.315 2.154 20 0 BEADLO C/C(=C/C(=O)NCc1[nH+]ccn1C)C(C)(C)C ZINC000742633294 585129065 /nfs/dbraw/zinc/12/90/65/585129065.db2.gz DSZXREVRKTXUAD-NTMALXAHSA-N 1 2 235.331 2.029 20 0 BEADLO C/C=C/C(=O)Nc1ccc2c(c1)[nH+]c(C)n2C ZINC000742945995 585132537 /nfs/dbraw/zinc/13/25/37/585132537.db2.gz OWUXLTPHWZZXRA-SNAWJCMRSA-N 1 2 229.283 2.396 20 0 BEADLO C/C=C\C(=O)Nc1ccc2c(c1)[nH+]c(C)n2C ZINC000742945994 585132719 /nfs/dbraw/zinc/13/27/19/585132719.db2.gz OWUXLTPHWZZXRA-PLNGDYQASA-N 1 2 229.283 2.396 20 0 BEADLO CC1(C)CC[N@H+](Cn2ncsc2=S)C1 ZINC000743389955 585136357 /nfs/dbraw/zinc/13/63/57/585136357.db2.gz FJGVBCVHNWAXTC-UHFFFAOYSA-N 1 2 229.374 2.363 20 0 BEADLO CC1(C)CC[N@@H+](Cn2ncsc2=S)C1 ZINC000743389955 585136358 /nfs/dbraw/zinc/13/63/58/585136358.db2.gz FJGVBCVHNWAXTC-UHFFFAOYSA-N 1 2 229.374 2.363 20 0 BEADLO CCn1cnn(C[N@@H+]2CCC(C)(C)C2)c1=S ZINC000743391775 585136389 /nfs/dbraw/zinc/13/63/89/585136389.db2.gz YNPHUHNMNCNDIS-UHFFFAOYSA-N 1 2 240.376 2.123 20 0 BEADLO CCn1cnn(C[N@H+]2CCC(C)(C)C2)c1=S ZINC000743391775 585136390 /nfs/dbraw/zinc/13/63/90/585136390.db2.gz YNPHUHNMNCNDIS-UHFFFAOYSA-N 1 2 240.376 2.123 20 0 BEADLO CC1(C)CC[N@H+](Cn2cc(Cl)cn2)C1 ZINC000743390419 585136481 /nfs/dbraw/zinc/13/64/81/585136481.db2.gz KDONLQSTMMYQRE-UHFFFAOYSA-N 1 2 213.712 2.226 20 0 BEADLO CC1(C)CC[N@@H+](Cn2cc(Cl)cn2)C1 ZINC000743390419 585136482 /nfs/dbraw/zinc/13/64/82/585136482.db2.gz KDONLQSTMMYQRE-UHFFFAOYSA-N 1 2 213.712 2.226 20 0 BEADLO C[C@@H]1C[N@@H+](Cn2cc(Cl)cn2)C[C@H](C)S1 ZINC000743376998 585136573 /nfs/dbraw/zinc/13/65/73/585136573.db2.gz WSVWSTUVSXQBFM-DTORHVGOSA-N 1 2 245.779 2.320 20 0 BEADLO C[C@@H]1C[N@H+](Cn2cc(Cl)cn2)C[C@H](C)S1 ZINC000743376998 585136574 /nfs/dbraw/zinc/13/65/74/585136574.db2.gz WSVWSTUVSXQBFM-DTORHVGOSA-N 1 2 245.779 2.320 20 0 BEADLO FC(F)(F)c1ccn(C[NH+]2CCCCC2)n1 ZINC000744122161 585144236 /nfs/dbraw/zinc/14/42/36/585144236.db2.gz YGKSSSKZNWNGTR-UHFFFAOYSA-N 1 2 233.237 2.345 20 0 BEADLO O=C(Cc1cn2ccccc2[nH+]1)OCC1CCC1 ZINC000744197581 585145819 /nfs/dbraw/zinc/14/58/19/585145819.db2.gz GFVQVXFXIOJEEB-UHFFFAOYSA-N 1 2 244.294 2.220 20 0 BEADLO CC1=CC[N@H+](Cc2cc(Cl)n(C)n2)CC1 ZINC000859206198 589019303 /nfs/dbraw/zinc/01/93/03/589019303.db2.gz IYURNHGZQYXJFN-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO CC1=CC[N@@H+](Cc2cc(Cl)n(C)n2)CC1 ZINC000859206198 589019305 /nfs/dbraw/zinc/01/93/05/589019305.db2.gz IYURNHGZQYXJFN-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO Cc1ccc([C@H](C)NC(=O)Cn2cc[nH+]c2)s1 ZINC000746157475 585164147 /nfs/dbraw/zinc/16/41/47/585164147.db2.gz ODMPSYSYPAKWDU-JTQLQIEISA-N 1 2 249.339 2.130 20 0 BEADLO CC(C)C1CC[NH+](Cn2ccsc2=O)CC1 ZINC000746615903 585170793 /nfs/dbraw/zinc/17/07/93/585170793.db2.gz QLIKHCWTSBKAOR-UHFFFAOYSA-N 1 2 240.372 2.235 20 0 BEADLO Cc1cccc(C[N@H+](C)Cn2ccsc2=O)c1 ZINC000746602849 585170966 /nfs/dbraw/zinc/17/09/66/585170966.db2.gz HAABTKRSPRULFO-UHFFFAOYSA-N 1 2 248.351 2.308 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cn2ccsc2=O)c1 ZINC000746602849 585170967 /nfs/dbraw/zinc/17/09/67/585170967.db2.gz HAABTKRSPRULFO-UHFFFAOYSA-N 1 2 248.351 2.308 20 0 BEADLO C/C=C/C(=O)N(C)Cc1[nH+]cc(C)c(OC)c1C ZINC000746889310 585173174 /nfs/dbraw/zinc/17/31/74/585173174.db2.gz BQISEVDBYKWZPU-VOTSOKGWSA-N 1 2 248.326 2.242 20 0 BEADLO CCC=C(C)C(=O)Nc1cc(C)[nH+]cc1C ZINC000747107776 585175180 /nfs/dbraw/zinc/17/51/80/585175180.db2.gz PWRBZVHAFUZIBE-RMKNXTFCSA-N 1 2 218.300 2.415 20 0 BEADLO CCC/C(C)=C\C(=O)NC[C@H](C)Cn1cc[nH+]c1 ZINC000747400739 585178780 /nfs/dbraw/zinc/17/87/80/585178780.db2.gz MFZIIDNRGPSZLG-FSBNRTBOSA-N 1 2 249.358 2.382 20 0 BEADLO C[C@H]1c2ccccc2C[N@H+]1CN1CCCC1=O ZINC000747464799 585179143 /nfs/dbraw/zinc/17/91/43/585179143.db2.gz XRGOMDVQZHHSIF-NSHDSACASA-N 1 2 230.311 2.143 20 0 BEADLO C[C@H]1c2ccccc2C[N@@H+]1CN1CCCC1=O ZINC000747464799 585179144 /nfs/dbraw/zinc/17/91/44/585179144.db2.gz XRGOMDVQZHHSIF-NSHDSACASA-N 1 2 230.311 2.143 20 0 BEADLO Cn1c[nH+]cc1COC(=O)CCc1ccccc1 ZINC000747782718 585184207 /nfs/dbraw/zinc/18/42/07/585184207.db2.gz RHNJLZMMWUHVMD-UHFFFAOYSA-N 1 2 244.294 2.096 20 0 BEADLO C[C@H]1CCC[C@H](C(=O)OCc2c[nH+]cn2C)C1 ZINC000747779911 585184235 /nfs/dbraw/zinc/18/42/35/585184235.db2.gz HGWZOWFTRGCHGS-QWRGUYRKSA-N 1 2 236.315 2.290 20 0 BEADLO Cn1c[nH+]cc1COC(=O)C=C(C1CC1)C1CC1 ZINC000747784447 585184412 /nfs/dbraw/zinc/18/44/12/585184412.db2.gz WVZZKMDXRLGKFU-UHFFFAOYSA-N 1 2 246.310 2.210 20 0 BEADLO Cc1ccc(C(=O)OCc2c[nH+]cn2C)cc1 ZINC000747780202 585184433 /nfs/dbraw/zinc/18/44/33/585184433.db2.gz DNQNTWFILBUVMA-UHFFFAOYSA-N 1 2 230.267 2.086 20 0 BEADLO CCCCNC(=S)Nc1c[nH+]ccc1OC ZINC000748157867 585188291 /nfs/dbraw/zinc/18/82/91/585188291.db2.gz QWXRDCSFDMHMHU-UHFFFAOYSA-N 1 2 239.344 2.177 20 0 BEADLO COc1cc[nH+]cc1NC(=O)/C=C/c1ccco1 ZINC000748204563 585189205 /nfs/dbraw/zinc/18/92/05/585189205.db2.gz OXDAWQKAYJEOPI-SNAWJCMRSA-N 1 2 244.250 2.335 20 0 BEADLO Cc1cc(CO[NH+]=C(N)c2ccccc2C)on1 ZINC000748984076 585197925 /nfs/dbraw/zinc/19/79/25/585197925.db2.gz UNMBDCYCLNNNRI-UHFFFAOYSA-N 1 2 245.282 2.338 20 0 BEADLO CCCC(=O)OCc1ccc(-n2cc[nH+]c2)nc1 ZINC000749323924 585201290 /nfs/dbraw/zinc/20/12/90/585201290.db2.gz AOJVOVQSWKPSGS-UHFFFAOYSA-N 1 2 245.282 2.111 20 0 BEADLO Cc1ccc(NC(=O)/C=C/C2CC2)c(N(C)C)[nH+]1 ZINC000749992777 585209377 /nfs/dbraw/zinc/20/93/77/585209377.db2.gz OJYSHMDGPMRSFY-VQHVLOKHSA-N 1 2 245.326 2.361 20 0 BEADLO CCC[N@H+](CC)Cn1ncn(C2CC2)c1=S ZINC000750603147 585217820 /nfs/dbraw/zinc/21/78/20/585217820.db2.gz MYTZYBNUFGXPSL-UHFFFAOYSA-N 1 2 240.376 2.438 20 0 BEADLO CCC[N@@H+](CC)Cn1ncn(C2CC2)c1=S ZINC000750603147 585217821 /nfs/dbraw/zinc/21/78/21/585217821.db2.gz MYTZYBNUFGXPSL-UHFFFAOYSA-N 1 2 240.376 2.438 20 0 BEADLO Cc1nc2[nH]ccc2c(NCCOC2CCC2)[nH+]1 ZINC000751229754 585226057 /nfs/dbraw/zinc/22/60/57/585226057.db2.gz CKOWWENUVYXSTC-UHFFFAOYSA-N 1 2 246.314 2.247 20 0 BEADLO C/C=C(/C)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000751377453 585228153 /nfs/dbraw/zinc/22/81/53/585228153.db2.gz UULFLGRXXQKTSS-CTPBAPBTSA-N 1 2 233.315 2.013 20 0 BEADLO CC(C)=C(C)C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000751425792 585230151 /nfs/dbraw/zinc/23/01/51/585230151.db2.gz RWBORNWUJDCAER-UHFFFAOYSA-N 1 2 247.342 2.472 20 0 BEADLO CC(C)=C(C)C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000751425792 585230152 /nfs/dbraw/zinc/23/01/52/585230152.db2.gz RWBORNWUJDCAER-UHFFFAOYSA-N 1 2 247.342 2.472 20 0 BEADLO CC/C=C(/C)C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000751431451 585230181 /nfs/dbraw/zinc/23/01/81/585230181.db2.gz WARLPFCHLNTJSL-WCIBSUBMSA-N 1 2 247.342 2.472 20 0 BEADLO CC/C=C(/C)C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000751431451 585230182 /nfs/dbraw/zinc/23/01/82/585230182.db2.gz WARLPFCHLNTJSL-WCIBSUBMSA-N 1 2 247.342 2.472 20 0 BEADLO C/C=C(/C)C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000751424674 585230252 /nfs/dbraw/zinc/23/02/52/585230252.db2.gz FUZWUSVROBRSHM-KMKOMSMNSA-N 1 2 233.315 2.082 20 0 BEADLO C/C=C(/C)C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000751424674 585230253 /nfs/dbraw/zinc/23/02/53/585230253.db2.gz FUZWUSVROBRSHM-KMKOMSMNSA-N 1 2 233.315 2.082 20 0 BEADLO Nc1ccc(CCC(=O)OCC2CCCC2)c[nH+]1 ZINC000751439603 585230360 /nfs/dbraw/zinc/23/03/60/585230360.db2.gz OHCCZBBEUGKJBL-UHFFFAOYSA-N 1 2 248.326 2.330 20 0 BEADLO Nc1ccc(CCC(=O)O[C@H]2C=CCCC2)c[nH+]1 ZINC000751441901 585230525 /nfs/dbraw/zinc/23/05/25/585230525.db2.gz IASYOPCLDOGBEN-LBPRGKRZSA-N 1 2 246.310 2.248 20 0 BEADLO CS/C=C/C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000751572228 585233133 /nfs/dbraw/zinc/23/31/33/585233133.db2.gz QOLCUSHAWNTOSP-AATRIKPKSA-N 1 2 247.323 2.458 20 0 BEADLO CCn1cnn(C[N@@H+]2CC[C@H](C)[C@@H]2C)c1=S ZINC000751940300 585239595 /nfs/dbraw/zinc/23/95/95/585239595.db2.gz HIQRNMGLIMEPOL-UWVGGRQHSA-N 1 2 240.376 2.122 20 0 BEADLO CCn1cnn(C[N@H+]2CC[C@H](C)[C@@H]2C)c1=S ZINC000751940300 585239596 /nfs/dbraw/zinc/23/95/96/585239596.db2.gz HIQRNMGLIMEPOL-UWVGGRQHSA-N 1 2 240.376 2.122 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)/C=C1\CC[C@@H](C)C1 ZINC000753585344 585262831 /nfs/dbraw/zinc/26/28/31/585262831.db2.gz VECDPQKXXLATSI-DQSXNGOJSA-N 1 2 247.342 2.134 20 0 BEADLO C[C@@H]1CC/C(=C\C(=O)N2CC(n3cc[nH+]c3)C2)C1 ZINC000753616142 585264168 /nfs/dbraw/zinc/26/41/68/585264168.db2.gz FOVQRTMPXLKBQU-LAPSENCUSA-N 1 2 245.326 2.013 20 0 BEADLO C/C(=C\C(=O)NCc1c[nH+]c[nH]1)C(C)(C)C ZINC000754296125 585282332 /nfs/dbraw/zinc/28/23/32/585282332.db2.gz MQVHEKQJGXNTHD-WEVVVXLNSA-N 1 2 221.304 2.018 20 0 BEADLO CC(=CC(=O)NCc1c[nH]c[nH+]1)C(C)(C)C ZINC000754296125 585282333 /nfs/dbraw/zinc/28/23/33/585282333.db2.gz MQVHEKQJGXNTHD-WEVVVXLNSA-N 1 2 221.304 2.018 20 0 BEADLO C/C(=C\C(=O)NCc1[nH]c[nH+]c1C)C(C)(C)C ZINC000754345519 585282878 /nfs/dbraw/zinc/28/28/78/585282878.db2.gz GUEHKWMXZXJYKD-RMKNXTFCSA-N 1 2 235.331 2.327 20 0 BEADLO O=C(C[NH2+]C1(C2CC2)CC1)OCc1ccccc1 ZINC000754358840 585282975 /nfs/dbraw/zinc/28/29/75/585282975.db2.gz PHLZJFIJIAUQLQ-UHFFFAOYSA-N 1 2 245.322 2.262 20 0 BEADLO C[C@H]1CC/C(=C\C(=O)OCc2c[nH+]cn2C)C1 ZINC000754682769 585289186 /nfs/dbraw/zinc/28/91/86/585289186.db2.gz BZKHDHVWOPAKFS-OTXQMUPVSA-N 1 2 234.299 2.210 20 0 BEADLO C/C(=C/C(=O)OCc1c[nH+]cn1C)C(C)(C)C ZINC000754685370 585289305 /nfs/dbraw/zinc/28/93/05/585289305.db2.gz UKRFPWJNWGRZKQ-POHAHGRESA-N 1 2 236.315 2.456 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@@H]1CC12CCCC2 ZINC000754688153 585289462 /nfs/dbraw/zinc/28/94/62/585289462.db2.gz VRGAHKSXLAGYDD-NSHDSACASA-N 1 2 234.299 2.044 20 0 BEADLO CC1(NC(=O)c2cccc3[nH+]ccn32)CCC1 ZINC000755202392 585296239 /nfs/dbraw/zinc/29/62/39/585296239.db2.gz LAZFQDQUDWNJKJ-UHFFFAOYSA-N 1 2 229.283 2.007 20 0 BEADLO CN(C)c1cc(COC(=O)/C=C\C2CC2)cc[nH+]1 ZINC000755887031 585309238 /nfs/dbraw/zinc/30/92/38/585309238.db2.gz MRRYCEBJJNWVIE-WAYWQWQTSA-N 1 2 246.310 2.157 20 0 BEADLO CC[C@H]1CC[N@H+](Cn2ncn(CC)c2=S)C1 ZINC000755924343 585310828 /nfs/dbraw/zinc/31/08/28/585310828.db2.gz KYNLVKLTHWVQKH-JTQLQIEISA-N 1 2 240.376 2.123 20 0 BEADLO CC[C@H]1CC[N@@H+](Cn2ncn(CC)c2=S)C1 ZINC000755924343 585310829 /nfs/dbraw/zinc/31/08/29/585310829.db2.gz KYNLVKLTHWVQKH-JTQLQIEISA-N 1 2 240.376 2.123 20 0 BEADLO C[C@H](NC(=O)c1cccc2[nH+]ccn21)C1CCC1 ZINC000756098870 585314377 /nfs/dbraw/zinc/31/43/77/585314377.db2.gz PERPPJRSLZDEHP-JTQLQIEISA-N 1 2 243.310 2.253 20 0 BEADLO Cc1ccnc(C[N@H+](C)CCOC(C)(C)C)n1 ZINC000756567247 585321350 /nfs/dbraw/zinc/32/13/50/585321350.db2.gz IPZBRFLRYZPHME-UHFFFAOYSA-N 1 2 237.347 2.032 20 0 BEADLO Cc1ccnc(C[N@@H+](C)CCOC(C)(C)C)n1 ZINC000756567247 585321351 /nfs/dbraw/zinc/32/13/51/585321351.db2.gz IPZBRFLRYZPHME-UHFFFAOYSA-N 1 2 237.347 2.032 20 0 BEADLO CC[C@@H]([NH2+]Cc1cccc(F)n1)c1ccn(C)n1 ZINC000756769156 585322932 /nfs/dbraw/zinc/32/29/32/585322932.db2.gz OLGVSGNCACQKIN-LLVKDONJSA-N 1 2 248.305 2.195 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)c2cc[nH]c2)c1 ZINC000757711060 585344673 /nfs/dbraw/zinc/34/46/73/585344673.db2.gz AQUGGARXRYOUEW-UHFFFAOYSA-N 1 2 246.266 2.084 20 0 BEADLO CCCC1(C(=O)NC2=[NH+]CCS2)CCC1 ZINC000759111548 585364264 /nfs/dbraw/zinc/36/42/64/585364264.db2.gz AEJVCMWLMFPJPL-UHFFFAOYSA-N 1 2 226.345 2.176 20 0 BEADLO CCC(=CC(=O)N1CC(n2cc[nH+]c2)C1)CC ZINC000759217718 585365765 /nfs/dbraw/zinc/36/57/65/585365765.db2.gz GOYVXNXXLMTEFO-UHFFFAOYSA-N 1 2 233.315 2.013 20 0 BEADLO COCC[N@H+](CCF)Cc1ccccc1F ZINC000759330336 585367810 /nfs/dbraw/zinc/36/78/10/585367810.db2.gz JWUMGUQSDCZRAP-UHFFFAOYSA-N 1 2 229.270 2.244 20 0 BEADLO COCC[N@@H+](CCF)Cc1ccccc1F ZINC000759330336 585367811 /nfs/dbraw/zinc/36/78/11/585367811.db2.gz JWUMGUQSDCZRAP-UHFFFAOYSA-N 1 2 229.270 2.244 20 0 BEADLO Cc1ccccc1N1CC[NH+](CCF)CC1 ZINC000759331923 585368161 /nfs/dbraw/zinc/36/81/61/585368161.db2.gz INBITDDIQOCTPI-UHFFFAOYSA-N 1 2 222.307 2.087 20 0 BEADLO Cc1nc(C[NH+]2CC(C(F)F)C2)sc1C ZINC000759844805 585381324 /nfs/dbraw/zinc/38/13/24/585381324.db2.gz XFSYLFRAQRVASN-UHFFFAOYSA-N 1 2 232.299 2.457 20 0 BEADLO Cc1ccnc(C[N@@H+]2CC[C@H](C(F)(F)F)C2)n1 ZINC000761046586 585404130 /nfs/dbraw/zinc/40/41/30/585404130.db2.gz JOFSNDWESAQFLD-VIFPVBQESA-N 1 2 245.248 2.169 20 0 BEADLO Cc1ccnc(C[N@H+]2CC[C@H](C(F)(F)F)C2)n1 ZINC000761046586 585404131 /nfs/dbraw/zinc/40/41/31/585404131.db2.gz JOFSNDWESAQFLD-VIFPVBQESA-N 1 2 245.248 2.169 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@H](C(F)(F)F)C2)nn1C ZINC000761054844 585404699 /nfs/dbraw/zinc/40/46/99/585404699.db2.gz JXRFBOCSHRGNGS-VIFPVBQESA-N 1 2 247.264 2.113 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@H](C(F)(F)F)C2)nn1C ZINC000761054844 585404700 /nfs/dbraw/zinc/40/47/00/585404700.db2.gz JXRFBOCSHRGNGS-VIFPVBQESA-N 1 2 247.264 2.113 20 0 BEADLO CCCCc1noc(C[N@@H+]2CC[C@@H]3C[C@@H]32)n1 ZINC000761084450 585407157 /nfs/dbraw/zinc/40/71/57/585407157.db2.gz ANCJHVCCHPALCK-ZJUUUORDSA-N 1 2 221.304 2.006 20 0 BEADLO CCCCc1noc(C[N@H+]2CC[C@@H]3C[C@@H]32)n1 ZINC000761084450 585407158 /nfs/dbraw/zinc/40/71/58/585407158.db2.gz ANCJHVCCHPALCK-ZJUUUORDSA-N 1 2 221.304 2.006 20 0 BEADLO CC(C)CCc1noc(C[N@@H+]2CC[C@H]3C[C@H]32)n1 ZINC000761086068 585407545 /nfs/dbraw/zinc/40/75/45/585407545.db2.gz BWOFTJQLYQDUHZ-WDEREUQCSA-N 1 2 235.331 2.252 20 0 BEADLO CC(C)CCc1noc(C[N@H+]2CC[C@H]3C[C@H]32)n1 ZINC000761086068 585407546 /nfs/dbraw/zinc/40/75/46/585407546.db2.gz BWOFTJQLYQDUHZ-WDEREUQCSA-N 1 2 235.331 2.252 20 0 BEADLO CCCCOC(=O)CC[N@@H+]1CCC[C@H]1C(F)F ZINC000761118750 585410528 /nfs/dbraw/zinc/41/05/28/585410528.db2.gz NVGKDWNXJCHSFK-JTQLQIEISA-N 1 2 249.301 2.449 20 0 BEADLO CCCCOC(=O)CC[N@H+]1CCC[C@H]1C(F)F ZINC000761118750 585410529 /nfs/dbraw/zinc/41/05/29/585410529.db2.gz NVGKDWNXJCHSFK-JTQLQIEISA-N 1 2 249.301 2.449 20 0 BEADLO O[C@@H](C[N@@H+]1CCC[C@H]1C(F)F)c1ccccc1 ZINC000761121960 585410970 /nfs/dbraw/zinc/41/09/70/585410970.db2.gz ZOJLGYHOMPRMAT-RYUDHWBXSA-N 1 2 241.281 2.450 20 0 BEADLO O[C@@H](C[N@H+]1CCC[C@H]1C(F)F)c1ccccc1 ZINC000761121960 585410971 /nfs/dbraw/zinc/41/09/71/585410971.db2.gz ZOJLGYHOMPRMAT-RYUDHWBXSA-N 1 2 241.281 2.450 20 0 BEADLO CCC(CC)[C@H](C)C(=O)NC1=[NH+]CCS1 ZINC000761222553 585412586 /nfs/dbraw/zinc/41/25/86/585412586.db2.gz HYTSBZLMTWTKRH-QMMMGPOBSA-N 1 2 228.361 2.278 20 0 BEADLO CCC[C@@H](C)c1noc(CCn2cc[nH+]c2)n1 ZINC000761842898 585420020 /nfs/dbraw/zinc/42/00/20/585420020.db2.gz LJVKFBWTWZVGMI-SNVBAGLBSA-N 1 2 234.303 2.412 20 0 BEADLO Cc1cccc(C(=O)OCCn2cc[nH+]c2)c1 ZINC000763117087 585443282 /nfs/dbraw/zinc/44/32/82/585443282.db2.gz UVQDVBGZTROQIS-UHFFFAOYSA-N 1 2 230.267 2.049 20 0 BEADLO Cc1ccc([N@@H+](C)C[C@@H](C)CO)cc1C ZINC000766895083 585509166 /nfs/dbraw/zinc/50/91/66/585509166.db2.gz JDJCDKIHYBHCAY-SNVBAGLBSA-N 1 2 207.317 2.368 20 0 BEADLO Cc1ccc([N@H+](C)C[C@@H](C)CO)cc1C ZINC000766895083 585509167 /nfs/dbraw/zinc/50/91/67/585509167.db2.gz JDJCDKIHYBHCAY-SNVBAGLBSA-N 1 2 207.317 2.368 20 0 BEADLO COc1cc[nH+]cc1COC(=O)c1ccccc1 ZINC000805341778 585514626 /nfs/dbraw/zinc/51/46/26/585514626.db2.gz RGTYGRBEJWWLDR-UHFFFAOYSA-N 1 2 243.262 2.447 20 0 BEADLO NC(=[NH+]OCc1ccccn1)c1cccc(F)c1 ZINC000767546737 585522487 /nfs/dbraw/zinc/52/24/87/585522487.db2.gz IAQQNVDJOVCSSM-UHFFFAOYSA-N 1 2 245.257 2.267 20 0 BEADLO CCOC(=O)C[N@H+](C/C=C\Cl)C1CCC1 ZINC000767873231 585527338 /nfs/dbraw/zinc/52/73/38/585527338.db2.gz AFPYXHGDKKOAGT-DAXSKMNVSA-N 1 2 231.723 2.157 20 0 BEADLO CCOC(=O)C[N@@H+](C/C=C\Cl)C1CCC1 ZINC000767873231 585527339 /nfs/dbraw/zinc/52/73/39/585527339.db2.gz AFPYXHGDKKOAGT-DAXSKMNVSA-N 1 2 231.723 2.157 20 0 BEADLO CCC/C(C)=C\C(=O)N(C)CCCn1cc[nH+]c1 ZINC000768323520 585535823 /nfs/dbraw/zinc/53/58/23/585535823.db2.gz JEFXKVKAZUNPTM-QBFSEMIESA-N 1 2 249.358 2.478 20 0 BEADLO CC(C)C[C@H](C)OC(=O)NCc1c[nH+]c[nH]1 ZINC000859235990 589023142 /nfs/dbraw/zinc/02/31/42/589023142.db2.gz QPTQEUYZDKUOTL-VIFPVBQESA-N 1 2 225.292 2.071 20 0 BEADLO CC(C)C[C@H](C)OC(=O)NCc1c[nH]c[nH+]1 ZINC000859235990 589023144 /nfs/dbraw/zinc/02/31/44/589023144.db2.gz QPTQEUYZDKUOTL-VIFPVBQESA-N 1 2 225.292 2.071 20 0 BEADLO CC(C)CCO[NH+]=C(N)COC(C)(C)C ZINC000768939594 585546597 /nfs/dbraw/zinc/54/65/97/585546597.db2.gz BCPPERKRCQTRLI-UHFFFAOYSA-N 1 2 216.325 2.346 20 0 BEADLO C[C@H]1CCC[C@@H]1CC(=O)OCCn1cc[nH+]c1 ZINC000769184115 585550709 /nfs/dbraw/zinc/55/07/09/585550709.db2.gz QCGXXLPPJPFKFC-NWDGAFQWSA-N 1 2 236.315 2.253 20 0 BEADLO Cc1cc(NC(=O)[C@H](F)c2ccccc2)cc[nH+]1 ZINC000769470825 585557874 /nfs/dbraw/zinc/55/78/74/585557874.db2.gz BGUXANJNIKKXIL-CYBMUJFWSA-N 1 2 244.269 2.461 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OC[C@@H]1CCCOC1 ZINC000769879842 585565808 /nfs/dbraw/zinc/56/58/08/585565808.db2.gz YGJSAQZFOGOUNY-GFCCVEGCSA-N 1 2 248.326 2.268 20 0 BEADLO CCC[C@]1(C(=O)OCC)CCC[N@@H+]1CCF ZINC000769998878 585568767 /nfs/dbraw/zinc/56/87/67/585568767.db2.gz DGZGMOVJURKXCJ-GFCCVEGCSA-N 1 2 231.311 2.154 20 0 BEADLO CCC[C@]1(C(=O)OCC)CCC[N@H+]1CCF ZINC000769998878 585568768 /nfs/dbraw/zinc/56/87/68/585568768.db2.gz DGZGMOVJURKXCJ-GFCCVEGCSA-N 1 2 231.311 2.154 20 0 BEADLO CCCCCNC(=O)c1cccc2[nH+]ccn21 ZINC000770039358 585570042 /nfs/dbraw/zinc/57/00/42/585570042.db2.gz RCYOYGBSRRCUAB-UHFFFAOYSA-N 1 2 231.299 2.254 20 0 BEADLO CC(C)[C@@H](C)NC(=O)c1cccc2[nH+]ccn21 ZINC000770054883 585570237 /nfs/dbraw/zinc/57/02/37/585570237.db2.gz KZWIOEBPZWPTNE-SNVBAGLBSA-N 1 2 231.299 2.109 20 0 BEADLO C[C@@H]1CCC[C@@H]1NC(=O)c1cccc2[nH+]ccn21 ZINC000770417791 585574084 /nfs/dbraw/zinc/57/40/84/585574084.db2.gz NZEPYSUYWSZSHM-MNOVXSKESA-N 1 2 243.310 2.253 20 0 BEADLO CC(C)[C@@H]1C[N@H+](Cc2ccnc(F)c2)CCO1 ZINC000859239426 589023678 /nfs/dbraw/zinc/02/36/78/589023678.db2.gz OKBYDEKFWKOEGU-LBPRGKRZSA-N 1 2 238.306 2.078 20 0 BEADLO CC(C)[C@@H]1C[N@@H+](Cc2ccnc(F)c2)CCO1 ZINC000859239426 589023680 /nfs/dbraw/zinc/02/36/80/589023680.db2.gz OKBYDEKFWKOEGU-LBPRGKRZSA-N 1 2 238.306 2.078 20 0 BEADLO CC(C)C[C@H](C)CC(=O)OCCn1cc[nH+]c1 ZINC000771953635 585605534 /nfs/dbraw/zinc/60/55/34/585605534.db2.gz RFBPREYTOUVVLN-LBPRGKRZSA-N 1 2 238.331 2.499 20 0 BEADLO C/C(=C/C(=O)OCCn1cc[nH+]c1)C(C)(C)C ZINC000771986423 585605962 /nfs/dbraw/zinc/60/59/62/585605962.db2.gz QLCUFWSWTWXDSJ-LUAWRHEFSA-N 1 2 236.315 2.419 20 0 BEADLO C/C(=C\C(=O)OCCn1cc[nH+]c1)C(C)(C)C ZINC000771986428 585606026 /nfs/dbraw/zinc/60/60/26/585606026.db2.gz QLCUFWSWTWXDSJ-PKNBQFBNSA-N 1 2 236.315 2.419 20 0 BEADLO CC(C)(C)CCC(=O)OCCn1cc[nH+]c1 ZINC000771981290 585606050 /nfs/dbraw/zinc/60/60/50/585606050.db2.gz YYQYTGRYEBYMIH-UHFFFAOYSA-N 1 2 224.304 2.253 20 0 BEADLO Cc1cscc1C(=O)OCCn1cc[nH+]c1 ZINC000771996036 585606303 /nfs/dbraw/zinc/60/63/03/585606303.db2.gz WACVZZASURTTFD-UHFFFAOYSA-N 1 2 236.296 2.110 20 0 BEADLO O=C(CCC1CCC1)OCCn1cc[nH+]c1 ZINC000771993963 585606343 /nfs/dbraw/zinc/60/63/43/585606343.db2.gz MXRMFAUFTDTOTK-UHFFFAOYSA-N 1 2 222.288 2.007 20 0 BEADLO CCCC1(C(=O)OCCn2cc[nH+]c2)CC1 ZINC000772001289 585606759 /nfs/dbraw/zinc/60/67/59/585606759.db2.gz DFABVNRIXPYRBK-UHFFFAOYSA-N 1 2 222.288 2.007 20 0 BEADLO CCO[C@H]1C[C@H]1C(=O)OCc1ccc(C)[nH+]c1C ZINC000772027376 585607098 /nfs/dbraw/zinc/60/70/98/585607098.db2.gz YXISTXOLQOMQTK-OLZOCXBDSA-N 1 2 249.310 2.167 20 0 BEADLO Cc1ccc(COC(=O)COC(C)C)c(C)[nH+]1 ZINC000772052535 585607879 /nfs/dbraw/zinc/60/78/79/585607879.db2.gz OAKUTNMCHNJGMC-UHFFFAOYSA-N 1 2 237.299 2.167 20 0 BEADLO C/C(=C/C(C)(C)C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000772900403 585627025 /nfs/dbraw/zinc/62/70/25/585627025.db2.gz YHAJUIFZFDZOLO-NTMALXAHSA-N 1 2 235.331 2.361 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)NCCc1c[nH+]cn1C ZINC000773821813 585644538 /nfs/dbraw/zinc/64/45/38/585644538.db2.gz BOFPXKWHLLRHQT-DHZHZOJOSA-N 1 2 249.358 2.071 20 0 BEADLO Cc1ccc(CONC(=O)C2CCCC2)c(C)[nH+]1 ZINC000774759877 585665312 /nfs/dbraw/zinc/66/53/12/585665312.db2.gz DDHYPALYAKPTIL-UHFFFAOYSA-N 1 2 248.326 2.436 20 0 BEADLO NC(Cc1cccs1)=[NH+]OCc1cccnc1 ZINC000774820124 585666799 /nfs/dbraw/zinc/66/67/99/585666799.db2.gz WDQLAIZTTWKPKZ-UHFFFAOYSA-N 1 2 247.323 2.384 20 0 BEADLO Cc1cc(NC(=O)NOC2CCCC2)c(C)c[nH+]1 ZINC000775355689 585676443 /nfs/dbraw/zinc/67/64/43/585676443.db2.gz PJFOJBLOVSJSDD-UHFFFAOYSA-N 1 2 249.314 2.116 20 0 BEADLO CC(C)[C@@H]1CCN1C(=O)c1cccc2[nH+]ccn21 ZINC000775978015 585688621 /nfs/dbraw/zinc/68/86/21/585688621.db2.gz QFSCPMMBHLZSDG-NSHDSACASA-N 1 2 243.310 2.205 20 0 BEADLO COc1cccc2c1N(Cc1c[nH+]c[nH]1)CCC2 ZINC000776101558 585690190 /nfs/dbraw/zinc/69/01/90/585690190.db2.gz JOQLYJNQFSRTML-UHFFFAOYSA-N 1 2 243.310 2.371 20 0 BEADLO COc1cccc2c1N(Cc1c[nH]c[nH+]1)CCC2 ZINC000776101558 585690191 /nfs/dbraw/zinc/69/01/91/585690191.db2.gz JOQLYJNQFSRTML-UHFFFAOYSA-N 1 2 243.310 2.371 20 0 BEADLO OCCCCCCC[N@@H+]1CCC(F)(F)C1 ZINC000776608412 585702650 /nfs/dbraw/zinc/70/26/50/585702650.db2.gz CBFGSSSKJVEMLA-UHFFFAOYSA-N 1 2 221.291 2.270 20 0 BEADLO OCCCCCCC[N@H+]1CCC(F)(F)C1 ZINC000776608412 585702651 /nfs/dbraw/zinc/70/26/51/585702651.db2.gz CBFGSSSKJVEMLA-UHFFFAOYSA-N 1 2 221.291 2.270 20 0 BEADLO Cl/C=C\C[N@@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000778229259 585728254 /nfs/dbraw/zinc/72/82/54/585728254.db2.gz RBFJYLUQPMCBGX-MDHMXLOGSA-N 1 2 211.696 2.299 20 0 BEADLO Cl/C=C\C[N@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000778229259 585728255 /nfs/dbraw/zinc/72/82/55/585728255.db2.gz RBFJYLUQPMCBGX-MDHMXLOGSA-N 1 2 211.696 2.299 20 0 BEADLO Cl/C=C\CN1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000778229259 585728256 /nfs/dbraw/zinc/72/82/56/585728256.db2.gz RBFJYLUQPMCBGX-MDHMXLOGSA-N 1 2 211.696 2.299 20 0 BEADLO CCCOC(=O)[C@H](C)[N@@H+]1CC[C@H](C)[C@H](F)C1 ZINC000778232520 585729059 /nfs/dbraw/zinc/72/90/59/585729059.db2.gz FXJIAZGMKSKNHQ-GARJFASQSA-N 1 2 231.311 2.008 20 0 BEADLO CCCOC(=O)[C@H](C)[N@H+]1CC[C@H](C)[C@H](F)C1 ZINC000778232520 585729060 /nfs/dbraw/zinc/72/90/60/585729060.db2.gz FXJIAZGMKSKNHQ-GARJFASQSA-N 1 2 231.311 2.008 20 0 BEADLO Cc1ccc2oc(=O)n(C[N@H+]3CC=CCC3)c2c1 ZINC000778577566 585737668 /nfs/dbraw/zinc/73/76/68/585737668.db2.gz RTQAHBJELIKMIB-UHFFFAOYSA-N 1 2 244.294 2.122 20 0 BEADLO Cc1ccc2oc(=O)n(C[N@@H+]3CC=CCC3)c2c1 ZINC000778577566 585737669 /nfs/dbraw/zinc/73/76/69/585737669.db2.gz RTQAHBJELIKMIB-UHFFFAOYSA-N 1 2 244.294 2.122 20 0 BEADLO CCC/C(C)=C\C(=O)N[C@H]1CCn2cc[nH+]c2C1 ZINC000779097775 585745220 /nfs/dbraw/zinc/74/52/20/585745220.db2.gz XDLAYXUOYNAMFF-MMRAYRKESA-N 1 2 247.342 2.061 20 0 BEADLO CCC/C(C)=C/C(=O)N[C@H]1CCn2cc[nH+]c2C1 ZINC000779097777 585745266 /nfs/dbraw/zinc/74/52/66/585745266.db2.gz XDLAYXUOYNAMFF-ZKQHCESOSA-N 1 2 247.342 2.061 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2ccc(F)nc2)C[C@@H]1F ZINC000779166734 585746618 /nfs/dbraw/zinc/74/66/18/585746618.db2.gz UYUPTLQGWBVXGU-KOLCDFICSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2ccc(F)nc2)C[C@@H]1F ZINC000779166734 585746619 /nfs/dbraw/zinc/74/66/19/585746619.db2.gz UYUPTLQGWBVXGU-KOLCDFICSA-N 1 2 226.270 2.401 20 0 BEADLO CCOc1ccc([NH2+][C@H](C)CCO)cc1 ZINC000779416835 585754239 /nfs/dbraw/zinc/75/42/39/585754239.db2.gz NQXAETLZKFVQMJ-SNVBAGLBSA-N 1 2 209.289 2.268 20 0 BEADLO C[C@H](CCO)Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000779422286 585754613 /nfs/dbraw/zinc/75/46/13/585754613.db2.gz NAMGNKMLDUBLDQ-GFCCVEGCSA-N 1 2 249.358 2.255 20 0 BEADLO Cc1cc(NC(=O)NOC2CCCCC2)cc[nH+]1 ZINC000779444153 585755126 /nfs/dbraw/zinc/75/51/26/585755126.db2.gz DAWVDAWOUIRNDR-UHFFFAOYSA-N 1 2 249.314 2.198 20 0 BEADLO C[C@@H]1CC[C@@H](NC(=O)c2cccc3[nH+]ccn32)C1 ZINC000781606298 585800354 /nfs/dbraw/zinc/80/03/54/585800354.db2.gz LKVSRIKWWGHPCU-GHMZBOCLSA-N 1 2 243.310 2.253 20 0 BEADLO CC1(C)CC[C@H](C(=O)OCCn2cc[nH+]c2)C1 ZINC000781696389 585801989 /nfs/dbraw/zinc/80/19/89/585801989.db2.gz CUSXNJALPFRHDY-NSHDSACASA-N 1 2 236.315 2.253 20 0 BEADLO C[C@H]([NH2+]Cc1ccc(CF)cc1)c1ncn(C)n1 ZINC000781956077 585806030 /nfs/dbraw/zinc/80/60/30/585806030.db2.gz SNXUJMRAGDHWTM-JTQLQIEISA-N 1 2 248.305 2.135 20 0 BEADLO CC[C@@H](NC(=O)C[C@H](C)C1CC1)c1[nH]cc[nH+]1 ZINC000781994121 585806472 /nfs/dbraw/zinc/80/64/72/585806472.db2.gz YAKZNQDKBXPCNR-GXSJLCMTSA-N 1 2 235.331 2.413 20 0 BEADLO Cl/C=C(\Cl)C[N@@H+]1CCOCC2(CC2)C1 ZINC000782539144 585819836 /nfs/dbraw/zinc/81/98/36/585819836.db2.gz QZDBCGRWICREDS-UITAMQMPSA-N 1 2 236.142 2.418 20 0 BEADLO Cl/C=C(\Cl)C[N@H+]1CCOCC2(CC2)C1 ZINC000782539144 585819837 /nfs/dbraw/zinc/81/98/37/585819837.db2.gz QZDBCGRWICREDS-UITAMQMPSA-N 1 2 236.142 2.418 20 0 BEADLO Cc1cn2c(n1)C[N@@H+](C/C(Cl)=C\Cl)CC2 ZINC000782521163 585819649 /nfs/dbraw/zinc/81/96/49/585819649.db2.gz ZVZPUSGCYKADMI-RUDMXATFSA-N 1 2 246.141 2.326 20 0 BEADLO Cc1cn2c(n1)C[N@H+](C/C(Cl)=C\Cl)CC2 ZINC000782521163 585819650 /nfs/dbraw/zinc/81/96/50/585819650.db2.gz ZVZPUSGCYKADMI-RUDMXATFSA-N 1 2 246.141 2.326 20 0 BEADLO COc1cccc2c1CC[N@H+](CCF)C2 ZINC000782529913 585819697 /nfs/dbraw/zinc/81/96/97/585819697.db2.gz SIAXJEQTUZCHEJ-UHFFFAOYSA-N 1 2 209.264 2.023 20 0 BEADLO COc1cccc2c1CC[N@@H+](CCF)C2 ZINC000782529913 585819698 /nfs/dbraw/zinc/81/96/98/585819698.db2.gz SIAXJEQTUZCHEJ-UHFFFAOYSA-N 1 2 209.264 2.023 20 0 BEADLO c1oc(C2CC2)nc1C[N@@H+]1CCOCC2(CC2)C1 ZINC000783595081 585837656 /nfs/dbraw/zinc/83/76/56/585837656.db2.gz MPDFHPTUSPMPFQ-UHFFFAOYSA-N 1 2 248.326 2.164 20 0 BEADLO c1oc(C2CC2)nc1C[N@H+]1CCOCC2(CC2)C1 ZINC000783595081 585837657 /nfs/dbraw/zinc/83/76/57/585837657.db2.gz MPDFHPTUSPMPFQ-UHFFFAOYSA-N 1 2 248.326 2.164 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc(F)nc2)[C@H](C)[C@@H](C)O1 ZINC000783737983 585841660 /nfs/dbraw/zinc/84/16/60/585841660.db2.gz RNABITIHBITZLR-GMTAPVOTSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc(F)nc2)[C@H](C)[C@@H](C)O1 ZINC000783737983 585841661 /nfs/dbraw/zinc/84/16/61/585841661.db2.gz RNABITIHBITZLR-GMTAPVOTSA-N 1 2 238.306 2.218 20 0 BEADLO O=C(CCC1CCC1)OCCCn1cc[nH+]c1 ZINC000783998362 585846607 /nfs/dbraw/zinc/84/66/07/585846607.db2.gz ORPYCXRDJPNPJW-UHFFFAOYSA-N 1 2 236.315 2.397 20 0 BEADLO CC(C)[C@@H]1C[C@@H]1C(=O)OCCCn1cc[nH+]c1 ZINC000784785926 585866209 /nfs/dbraw/zinc/86/62/09/585866209.db2.gz HGSZKSFORHLSEM-RYUDHWBXSA-N 1 2 236.315 2.109 20 0 BEADLO CC(C)/C=C/C(=O)OCCCn1cc[nH+]c1 ZINC000785044837 585869913 /nfs/dbraw/zinc/86/99/13/585869913.db2.gz ZZORYIVQLLLQIF-SNAWJCMRSA-N 1 2 222.288 2.029 20 0 BEADLO CNC(=O)COc1ccc([NH2+]CC2(C)CC2)cc1 ZINC000785494584 585874651 /nfs/dbraw/zinc/87/46/51/585874651.db2.gz YGCBTCPXIWPJQR-UHFFFAOYSA-N 1 2 248.326 2.023 20 0 BEADLO Cc1[nH]ncc1C(=O)OCc1ccc(C)[nH+]c1C ZINC000785575961 585875864 /nfs/dbraw/zinc/87/58/64/585875864.db2.gz XHRTWDIHCOVQAY-UHFFFAOYSA-N 1 2 245.282 2.087 20 0 BEADLO C=Cc1ccc(C(=O)OCCn2cc[nH+]c2)cc1 ZINC000785631249 585876833 /nfs/dbraw/zinc/87/68/33/585876833.db2.gz XUZRSFIROBOOJE-UHFFFAOYSA-N 1 2 242.278 2.383 20 0 BEADLO FCC[N@@H+]1CCC[C@H](Oc2ncccc2F)C1 ZINC000785839255 585881858 /nfs/dbraw/zinc/88/18/58/585881858.db2.gz TVTOWSUBBVDOOE-JTQLQIEISA-N 1 2 242.269 2.033 20 0 BEADLO FCC[N@H+]1CCC[C@H](Oc2ncccc2F)C1 ZINC000785839255 585881859 /nfs/dbraw/zinc/88/18/59/585881859.db2.gz TVTOWSUBBVDOOE-JTQLQIEISA-N 1 2 242.269 2.033 20 0 BEADLO CCCCCCNC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000788271601 585920614 /nfs/dbraw/zinc/92/06/14/585920614.db2.gz PBZNKGUEUMOFAJ-UHFFFAOYSA-N 1 2 237.347 2.384 20 0 BEADLO C/C=C(\CC)C(=O)NCCCCn1cc[nH+]c1 ZINC000788799130 585930777 /nfs/dbraw/zinc/93/07/77/585930777.db2.gz SFBGMOLWPNDLGZ-KGVSQERTSA-N 1 2 235.331 2.136 20 0 BEADLO C[C@@H]1CCC[C@H](CO[NH+]=C(N)[C@@H]2CCCO2)C1 ZINC000789608545 585946299 /nfs/dbraw/zinc/94/62/99/585946299.db2.gz KMIHTKOCLACRKJ-WOPDTQHZSA-N 1 2 240.347 2.490 20 0 BEADLO CC(C)(C)CCO[NH+]=C(N)[C@H]1CCCO1 ZINC000789612055 585946701 /nfs/dbraw/zinc/94/67/01/585946701.db2.gz RZQQTEITXVGNEM-SECBINFHSA-N 1 2 214.309 2.100 20 0 BEADLO Cc1occc1C(=O)OCCCc1[nH+]ccn1C ZINC000789792752 585950231 /nfs/dbraw/zinc/95/02/31/585950231.db2.gz YZTRZWLSEBEULK-UHFFFAOYSA-N 1 2 248.282 2.111 20 0 BEADLO C/C=C(/CC)C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000789849695 585951591 /nfs/dbraw/zinc/95/15/91/585951591.db2.gz UPRBLIPZQBRZQE-FWAPLPHYSA-N 1 2 221.304 2.333 20 0 BEADLO CC=C(CC)C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000789849695 585951592 /nfs/dbraw/zinc/95/15/92/585951592.db2.gz UPRBLIPZQBRZQE-FWAPLPHYSA-N 1 2 221.304 2.333 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1nnc(C(C)(C)C)o1 ZINC000791572369 585984242 /nfs/dbraw/zinc/98/42/42/585984242.db2.gz DZHCFROEBVOGGO-DTORHVGOSA-N 1 2 223.320 2.350 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1nnc(C(C)(C)C)o1 ZINC000791572369 585984243 /nfs/dbraw/zinc/98/42/43/585984243.db2.gz DZHCFROEBVOGGO-DTORHVGOSA-N 1 2 223.320 2.350 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1ncc(Cl)n1C ZINC000791567739 585984542 /nfs/dbraw/zinc/98/45/42/585984542.db2.gz KPVWWEUNXYBAGH-OCAPTIKFSA-N 1 2 213.712 2.056 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1ncc(Cl)n1C ZINC000791567739 585984543 /nfs/dbraw/zinc/98/45/43/585984543.db2.gz KPVWWEUNXYBAGH-OCAPTIKFSA-N 1 2 213.712 2.056 20 0 BEADLO CC(F)(F)CCC(=O)OCc1cc[nH+]c(N)c1 ZINC000791731641 585986899 /nfs/dbraw/zinc/98/68/99/585986899.db2.gz GVQNFPAUNANSQN-UHFFFAOYSA-N 1 2 244.241 2.142 20 0 BEADLO C[C@H](CC(=O)OCc1cc[nH+]c(N)c1)C1CC1 ZINC000791780223 585987665 /nfs/dbraw/zinc/98/76/65/585987665.db2.gz YVCAPQOSZFGHFI-SECBINFHSA-N 1 2 234.299 2.143 20 0 BEADLO CC(C)(C)/C=C/C(=O)OCc1cc[nH+]c(N)c1 ZINC000791900321 585990958 /nfs/dbraw/zinc/99/09/58/585990958.db2.gz YNHGOBRZHACWHV-GQCTYLIASA-N 1 2 234.299 2.309 20 0 BEADLO Nc1cc(COC(=O)[C@@H]2CC23CCCC3)cc[nH+]1 ZINC000791976231 585992707 /nfs/dbraw/zinc/99/27/07/585992707.db2.gz BUQPDFHQOJSLIC-NSHDSACASA-N 1 2 246.310 2.287 20 0 BEADLO Cc1cscc1C(=O)OCc1cc[nH+]c(N)c1 ZINC000791990336 585992755 /nfs/dbraw/zinc/99/27/55/585992755.db2.gz HHLGZLLDKQIMCG-UHFFFAOYSA-N 1 2 248.307 2.391 20 0 BEADLO C[C@H]1CC[C@@H](C(=O)OCc2cc[nH+]c(N)c2)C1 ZINC000792101428 585995829 /nfs/dbraw/zinc/99/58/29/585995829.db2.gz CTNVWLYXRAEKTD-GXSJLCMTSA-N 1 2 234.299 2.143 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)OCc2cc[nH+]c(N)c2)C1 ZINC000792101431 585995901 /nfs/dbraw/zinc/99/59/01/585995901.db2.gz CTNVWLYXRAEKTD-KOLCDFICSA-N 1 2 234.299 2.143 20 0 BEADLO Cc1coc(C)c1C(=O)OCCc1c[nH+]cn1C ZINC000793250225 586014955 /nfs/dbraw/zinc/01/49/55/586014955.db2.gz GFEYJYSMQHTULK-UHFFFAOYSA-N 1 2 248.282 2.029 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)CC1=CCCCC1 ZINC000793251409 586015217 /nfs/dbraw/zinc/01/52/17/586015217.db2.gz XOVKMXKLUMEMMF-UHFFFAOYSA-N 1 2 248.326 2.396 20 0 BEADLO CCCC1(C(=O)OCCc2c[nH+]cn2C)CC1 ZINC000793258548 586015449 /nfs/dbraw/zinc/01/54/49/586015449.db2.gz MOHGWNUHBYEIDP-UHFFFAOYSA-N 1 2 236.315 2.086 20 0 BEADLO CCCCCCC(=O)OCCc1c[nH+]cn1C ZINC000793256174 586015465 /nfs/dbraw/zinc/01/54/65/586015465.db2.gz PMIPHTBPNGGETJ-UHFFFAOYSA-N 1 2 238.331 2.476 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)C12CCC(CC1)C2 ZINC000793258152 586015470 /nfs/dbraw/zinc/01/54/70/586015470.db2.gz JEIZYSZXRWCKEU-UHFFFAOYSA-N 1 2 248.326 2.086 20 0 BEADLO Cc1noc(C)c1C[NH2+]Cc1cccnc1F ZINC000793284790 586016006 /nfs/dbraw/zinc/01/60/06/586016006.db2.gz RMIJSADONFMBGS-UHFFFAOYSA-N 1 2 235.262 2.115 20 0 BEADLO Cc1cnc(C[NH+]2CCC(F)(F)CC2)cn1 ZINC000793361104 586017598 /nfs/dbraw/zinc/01/75/98/586017598.db2.gz DQPVMQZQEXDIBZ-UHFFFAOYSA-N 1 2 227.258 2.016 20 0 BEADLO C[C@H](CNC(=O)CCc1c[nH+]c[nH]1)C(C)(C)C ZINC000793518000 586021292 /nfs/dbraw/zinc/02/12/92/586021292.db2.gz JLISAOHJRYGAPB-SNVBAGLBSA-N 1 2 237.347 2.141 20 0 BEADLO C[C@H](CNC(=O)CCc1c[nH]c[nH+]1)C(C)(C)C ZINC000793518000 586021293 /nfs/dbraw/zinc/02/12/93/586021293.db2.gz JLISAOHJRYGAPB-SNVBAGLBSA-N 1 2 237.347 2.141 20 0 BEADLO C[C@@H](CNC(=O)CCc1c[nH+]c[nH]1)C(C)(C)C ZINC000793517999 586021379 /nfs/dbraw/zinc/02/13/79/586021379.db2.gz JLISAOHJRYGAPB-JTQLQIEISA-N 1 2 237.347 2.141 20 0 BEADLO C[C@@H](CNC(=O)CCc1c[nH]c[nH+]1)C(C)(C)C ZINC000793517999 586021380 /nfs/dbraw/zinc/02/13/80/586021380.db2.gz JLISAOHJRYGAPB-JTQLQIEISA-N 1 2 237.347 2.141 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OC[C@H]1CCCO1 ZINC000794517794 586041272 /nfs/dbraw/zinc/04/12/72/586041272.db2.gz GWEHGKPMWOMENO-LLVKDONJSA-N 1 2 234.299 2.021 20 0 BEADLO Cc1ccccc1CC(N)=[NH+]OC[C@H]1CCCO1 ZINC000794522017 586041731 /nfs/dbraw/zinc/04/17/31/586041731.db2.gz MOKBAGJFASERBH-CYBMUJFWSA-N 1 2 248.326 2.215 20 0 BEADLO Cc1nccnc1[C@H](C)[NH2+]Cc1cccnc1F ZINC000794834331 586049683 /nfs/dbraw/zinc/04/96/83/586049683.db2.gz IRYXFHRYZWFECM-JTQLQIEISA-N 1 2 246.289 2.170 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1cc(Cl)n(C)n1 ZINC000859283850 589027993 /nfs/dbraw/zinc/02/79/93/589027993.db2.gz HTPWMJFKVLLRRB-YUMQZZPRSA-N 1 2 213.712 2.056 20 0 BEADLO FC1(CNc2ccc(-n3cc[nH+]c3)nc2)CC1 ZINC000794947591 586057529 /nfs/dbraw/zinc/05/75/29/586057529.db2.gz YSLCGRJFZKMMSV-UHFFFAOYSA-N 1 2 232.262 2.181 20 0 BEADLO CC(C)CO[C@H](C)C(N)=[NH+]OCCCCF ZINC000795215535 586072326 /nfs/dbraw/zinc/07/23/26/586072326.db2.gz RUAONWIXLGMQCT-SNVBAGLBSA-N 1 2 234.315 2.296 20 0 BEADLO Cn1c[nH+]cc1COc1ccc2cc[nH]c2c1 ZINC000795234378 586073360 /nfs/dbraw/zinc/07/33/60/586073360.db2.gz BCDYIFKYDQMDIN-UHFFFAOYSA-N 1 2 227.267 2.480 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)Cc1ccnc(C)n1 ZINC000796444447 586103579 /nfs/dbraw/zinc/10/35/79/586103579.db2.gz DSLAMNBMWATHDY-UHFFFAOYSA-N 1 2 246.314 2.022 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)Cc1ccnc(C)n1 ZINC000796444447 586103580 /nfs/dbraw/zinc/10/35/80/586103580.db2.gz DSLAMNBMWATHDY-UHFFFAOYSA-N 1 2 246.314 2.022 20 0 BEADLO CC(C)c1nnc(C[NH+]2CCC(F)(F)CC2)o1 ZINC000796542143 586105759 /nfs/dbraw/zinc/10/57/59/586105759.db2.gz BBNPPGLYEFNBCN-UHFFFAOYSA-N 1 2 245.273 2.424 20 0 BEADLO CCCCOC(=O)[C@H](C)[NH+]1CCC(F)(F)CC1 ZINC000796541615 586106308 /nfs/dbraw/zinc/10/63/08/586106308.db2.gz VOTBZDKOAWRONQ-JTQLQIEISA-N 1 2 249.301 2.449 20 0 BEADLO Cc1cnc(C[NH+]2CCC(F)(F)CC2)nc1 ZINC000796542639 586106387 /nfs/dbraw/zinc/10/63/87/586106387.db2.gz INVRGNJOKWQBSM-UHFFFAOYSA-N 1 2 227.258 2.016 20 0 BEADLO Cc1ccc(C[N@@H+](C/C=C/Cl)CCO)o1 ZINC000796558086 586106750 /nfs/dbraw/zinc/10/67/50/586106750.db2.gz CFBUEWKNJPSSMG-GORDUTHDSA-N 1 2 229.707 2.135 20 0 BEADLO Cc1ccc(C[N@H+](C/C=C/Cl)CCO)o1 ZINC000796558086 586106751 /nfs/dbraw/zinc/10/67/51/586106751.db2.gz CFBUEWKNJPSSMG-GORDUTHDSA-N 1 2 229.707 2.135 20 0 BEADLO Cc1c(Cl)cnn1C[N@@H+]1CCC=C(C)C1 ZINC000797823313 586132574 /nfs/dbraw/zinc/13/25/74/586132574.db2.gz RRRLFLQLUUOBMF-UHFFFAOYSA-N 1 2 225.723 2.454 20 0 BEADLO Cc1c(Cl)cnn1C[N@H+]1CCC=C(C)C1 ZINC000797823313 586132575 /nfs/dbraw/zinc/13/25/75/586132575.db2.gz RRRLFLQLUUOBMF-UHFFFAOYSA-N 1 2 225.723 2.454 20 0 BEADLO CC1=CCCN(C(=O)c2cccc3[nH+]ccn32)C1 ZINC000798087744 586136653 /nfs/dbraw/zinc/13/66/53/586136653.db2.gz RIRZFRAWXLIQGB-UHFFFAOYSA-N 1 2 241.294 2.127 20 0 BEADLO O=C(OCCn1cc[nH+]c1)c1ccoc1C1CC1 ZINC000798706209 586148633 /nfs/dbraw/zinc/14/86/33/586148633.db2.gz DMCIOCQSLJDBJS-UHFFFAOYSA-N 1 2 246.266 2.211 20 0 BEADLO C[C@H]([NH2+]Cc1cnc(Cl)cn1)c1ccccn1 ZINC000799162808 586162597 /nfs/dbraw/zinc/16/25/97/586162597.db2.gz BEXXGIQQPAXPJV-VIFPVBQESA-N 1 2 248.717 2.376 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OC[C@@H](C)CC(C)C ZINC000799175876 586165066 /nfs/dbraw/zinc/16/50/66/586165066.db2.gz UNXSWKBUDLTVSH-VHSXEESVSA-N 1 2 216.325 2.202 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2cccc(F)n2)nn1C ZINC000800481815 586222057 /nfs/dbraw/zinc/22/20/57/586222057.db2.gz GNJDUWKIRKDYNF-SNVBAGLBSA-N 1 2 248.305 2.113 20 0 BEADLO Cc1nc(C(=O)OCc2ccc(C)[nH+]c2C)co1 ZINC000801398069 586255399 /nfs/dbraw/zinc/25/53/99/586255399.db2.gz NHTVQJXPRZQRMI-UHFFFAOYSA-N 1 2 246.266 2.352 20 0 BEADLO C[C@H](c1cccnc1)[N@@H+]1CCO[C@H](C(F)F)C1 ZINC000801566625 586264589 /nfs/dbraw/zinc/26/45/89/586264589.db2.gz DHZSSZQZROALAI-KOLCDFICSA-N 1 2 242.269 2.109 20 0 BEADLO C[C@H](c1cccnc1)[N@H+]1CCO[C@H](C(F)F)C1 ZINC000801566625 586264590 /nfs/dbraw/zinc/26/45/90/586264590.db2.gz DHZSSZQZROALAI-KOLCDFICSA-N 1 2 242.269 2.109 20 0 BEADLO C[C@@H](C(=O)O[C@@H]1CC[N@H+](CCF)C1)C(C)(C)C ZINC000802235053 586295343 /nfs/dbraw/zinc/29/53/43/586295343.db2.gz VPHNSSDNRFQWHG-WDEREUQCSA-N 1 2 245.338 2.256 20 0 BEADLO C[C@@H](C(=O)O[C@@H]1CC[N@@H+](CCF)C1)C(C)(C)C ZINC000802235053 586295344 /nfs/dbraw/zinc/29/53/44/586295344.db2.gz VPHNSSDNRFQWHG-WDEREUQCSA-N 1 2 245.338 2.256 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)O[C@H]2CC[N@H+](CCF)C2)C1 ZINC000802234227 586297515 /nfs/dbraw/zinc/29/75/15/586297515.db2.gz BGDDNKMUCZSKNW-UTUOFQBUSA-N 1 2 243.322 2.010 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)O[C@H]2CC[N@@H+](CCF)C2)C1 ZINC000802234227 586297517 /nfs/dbraw/zinc/29/75/17/586297517.db2.gz BGDDNKMUCZSKNW-UTUOFQBUSA-N 1 2 243.322 2.010 20 0 BEADLO CC(C)C[C@H](C)C(=O)O[C@@H]1CC[N@H+](CCF)C1 ZINC000802237392 586297658 /nfs/dbraw/zinc/29/76/58/586297658.db2.gz FIWDOUAGTBPCOR-NWDGAFQWSA-N 1 2 245.338 2.256 20 0 BEADLO CC(C)C[C@H](C)C(=O)O[C@@H]1CC[N@@H+](CCF)C1 ZINC000802237392 586297659 /nfs/dbraw/zinc/29/76/59/586297659.db2.gz FIWDOUAGTBPCOR-NWDGAFQWSA-N 1 2 245.338 2.256 20 0 BEADLO CC(C)C[C@@H](C)C(=O)O[C@H]1CC[N@H+](CCF)C1 ZINC000802237391 586297931 /nfs/dbraw/zinc/29/79/31/586297931.db2.gz FIWDOUAGTBPCOR-NEPJUHHUSA-N 1 2 245.338 2.256 20 0 BEADLO CC(C)C[C@@H](C)C(=O)O[C@H]1CC[N@@H+](CCF)C1 ZINC000802237391 586297933 /nfs/dbraw/zinc/29/79/33/586297933.db2.gz FIWDOUAGTBPCOR-NEPJUHHUSA-N 1 2 245.338 2.256 20 0 BEADLO Cc1ccoc1C[N@@H+]1CCO[C@@H](C(F)F)C1 ZINC000802653786 586308178 /nfs/dbraw/zinc/30/81/78/586308178.db2.gz SPAWPLDWZQWAIH-SNVBAGLBSA-N 1 2 231.242 2.054 20 0 BEADLO Cc1ccoc1C[N@H+]1CCO[C@@H](C(F)F)C1 ZINC000802653786 586308179 /nfs/dbraw/zinc/30/81/79/586308179.db2.gz SPAWPLDWZQWAIH-SNVBAGLBSA-N 1 2 231.242 2.054 20 0 BEADLO Cn1c(Cl)cnc1C[NH+](C1CC1)C1CC1 ZINC000859620796 589049304 /nfs/dbraw/zinc/04/93/04/589049304.db2.gz DFBDCJCGCUOXEX-UHFFFAOYSA-N 1 2 225.723 2.200 20 0 BEADLO CC[C@H](Nc1ncc(SC)cn1)c1[nH]cc[nH+]1 ZINC000804629443 586404130 /nfs/dbraw/zinc/40/41/30/586404130.db2.gz UAUOATRFYVFSGU-VIFPVBQESA-N 1 2 249.343 2.485 20 0 BEADLO C[C@H](CNC(=O)CCc1[nH]cc[nH+]1)C(C)(C)C ZINC000806865804 586420140 /nfs/dbraw/zinc/42/01/40/586420140.db2.gz DQQZPLHLMDFYBM-SNVBAGLBSA-N 1 2 237.347 2.141 20 0 BEADLO CC1(C)CCC(=O)N1C[N@@H+]1CCC[C@@](C)(F)C1 ZINC000840100699 586445658 /nfs/dbraw/zinc/44/56/58/586445658.db2.gz WJFOFVDHOYAHIK-CYBMUJFWSA-N 1 2 242.338 2.169 20 0 BEADLO CC1(C)CCC(=O)N1C[N@H+]1CCC[C@@](C)(F)C1 ZINC000840100699 586445659 /nfs/dbraw/zinc/44/56/59/586445659.db2.gz WJFOFVDHOYAHIK-CYBMUJFWSA-N 1 2 242.338 2.169 20 0 BEADLO CC[C@H]1CC(=O)N(C[N@@H+]2CCC[C@@](C)(F)C2)C1 ZINC000840097951 586446032 /nfs/dbraw/zinc/44/60/32/586446032.db2.gz BFTKMINAKUXOKR-WCQYABFASA-N 1 2 242.338 2.026 20 0 BEADLO CC[C@H]1CC(=O)N(C[N@H+]2CCC[C@@](C)(F)C2)C1 ZINC000840097951 586446033 /nfs/dbraw/zinc/44/60/33/586446033.db2.gz BFTKMINAKUXOKR-WCQYABFASA-N 1 2 242.338 2.026 20 0 BEADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2cn(C)cn2)o1 ZINC000808381243 586470003 /nfs/dbraw/zinc/47/00/03/586470003.db2.gz NFJHCVOCADDTIZ-ZWNOBZJWSA-N 1 2 245.326 2.426 20 0 BEADLO CCOc1ccccc1C[NH2+]Cc1cn(C)cn1 ZINC000808380197 586470290 /nfs/dbraw/zinc/47/02/90/586470290.db2.gz ASRQYIRLGNXZHW-UHFFFAOYSA-N 1 2 245.326 2.109 20 0 BEADLO Cn1cnc(C[NH2+]C2(c3cccc(F)c3)CC2)c1 ZINC000808392129 586470692 /nfs/dbraw/zinc/47/06/92/586470692.db2.gz VTKZJALJWWLMBG-UHFFFAOYSA-N 1 2 245.301 2.338 20 0 BEADLO Cc1c(NCc2cn(C)c[nH+]2)cnn1CC(C)C ZINC000808403445 586471186 /nfs/dbraw/zinc/47/11/86/586471186.db2.gz MRSYBOHAXQOMHF-UHFFFAOYSA-N 1 2 247.346 2.193 20 0 BEADLO CCN1CC[N@H+](Cc2cc(C)oc2C)[C@@H](C)C1 ZINC000809698140 586513129 /nfs/dbraw/zinc/51/31/29/586513129.db2.gz WPVDCGGWDXUSGK-NSHDSACASA-N 1 2 236.359 2.422 20 0 BEADLO CCN1CC[N@@H+](Cc2cc(C)oc2C)[C@@H](C)C1 ZINC000809698140 586513130 /nfs/dbraw/zinc/51/31/30/586513130.db2.gz WPVDCGGWDXUSGK-NSHDSACASA-N 1 2 236.359 2.422 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccoc2)C[C@H](C)[S@]1=O ZINC000809699421 586513470 /nfs/dbraw/zinc/51/34/70/586513470.db2.gz OCOHFLLARUMPIQ-KANYHAFZSA-N 1 2 241.356 2.011 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccoc2)C[C@H](C)[S@]1=O ZINC000809699421 586513471 /nfs/dbraw/zinc/51/34/71/586513471.db2.gz OCOHFLLARUMPIQ-KANYHAFZSA-N 1 2 241.356 2.011 20 0 BEADLO Cc1nonc1C[NH2+]Cc1cc2ccccc2[nH]1 ZINC000809745643 586516350 /nfs/dbraw/zinc/51/63/50/586516350.db2.gz XRIPWMALIMPCAA-UHFFFAOYSA-N 1 2 242.282 2.149 20 0 BEADLO Cc1nonc1C[NH2+]Cc1cccc(C)c1C ZINC000809744250 586516486 /nfs/dbraw/zinc/51/64/86/586516486.db2.gz CQCOBIWANHRBNH-UHFFFAOYSA-N 1 2 231.299 2.285 20 0 BEADLO Cc1nonc1C[NH2+]Cc1ccc(C)c(F)c1 ZINC000809744881 586516583 /nfs/dbraw/zinc/51/65/83/586516583.db2.gz HEXGWKBWPOBXDK-UHFFFAOYSA-N 1 2 235.262 2.115 20 0 BEADLO Cc1nonc1C[NH2+]Cc1cc(C)ccc1C ZINC000809744092 586516851 /nfs/dbraw/zinc/51/68/51/586516851.db2.gz VAPXFRBRXHASKN-UHFFFAOYSA-N 1 2 231.299 2.285 20 0 BEADLO Cc1nonc1C[NH2+]Cc1coc2ccccc12 ZINC000809743790 586516859 /nfs/dbraw/zinc/51/68/59/586516859.db2.gz FLNYFJSWJQQJMP-UHFFFAOYSA-N 1 2 243.266 2.414 20 0 BEADLO CC(C)COC(=O)C[N@@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000810045122 586532351 /nfs/dbraw/zinc/53/23/51/586532351.db2.gz DJRJMLFWXMPMBQ-JTQLQIEISA-N 1 2 249.301 2.163 20 0 BEADLO CC(C)COC(=O)C[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000810045122 586532354 /nfs/dbraw/zinc/53/23/54/586532354.db2.gz DJRJMLFWXMPMBQ-JTQLQIEISA-N 1 2 249.301 2.163 20 0 BEADLO Cc1cn[nH]c1CNc1ccc(C)[nH+]c1N(C)C ZINC000810150395 586535386 /nfs/dbraw/zinc/53/53/86/586535386.db2.gz DCFPVUGFUVGPRC-UHFFFAOYSA-N 1 2 245.330 2.100 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C1(F)CCCCC1 ZINC000810363344 586538557 /nfs/dbraw/zinc/53/85/57/586538557.db2.gz OJJGPFMJBCOMLC-UHFFFAOYSA-N 1 2 236.290 2.423 20 0 BEADLO CCCC(=O)OCC1CC[NH+](CC(F)F)CC1 ZINC000810960978 586551887 /nfs/dbraw/zinc/55/18/87/586551887.db2.gz KEGDPIMJYKNXRD-UHFFFAOYSA-N 1 2 249.301 2.307 20 0 BEADLO C[C@H]1C[N@H+](Cn2cc(Cl)cn2)CCC1(F)F ZINC000811779158 586566340 /nfs/dbraw/zinc/56/63/40/586566340.db2.gz GNPFGBGACYUNER-QMMMGPOBSA-N 1 2 249.692 2.471 20 0 BEADLO C[C@H]1C[N@@H+](Cn2cc(Cl)cn2)CCC1(F)F ZINC000811779158 586566341 /nfs/dbraw/zinc/56/63/41/586566341.db2.gz GNPFGBGACYUNER-QMMMGPOBSA-N 1 2 249.692 2.471 20 0 BEADLO FC(F)(F)c1cc(C[NH+]2CC(C3CC3)C2)[nH]n1 ZINC000812775341 586584091 /nfs/dbraw/zinc/58/40/91/586584091.db2.gz KAAUDXOFIYGTBR-UHFFFAOYSA-N 1 2 245.248 2.270 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1cnn(-c2ccccc2)n1 ZINC000815162683 586671308 /nfs/dbraw/zinc/67/13/08/586671308.db2.gz GPHSNFVTLYTKBT-NWDGAFQWSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1cnn(-c2ccccc2)n1 ZINC000815162683 586671310 /nfs/dbraw/zinc/67/13/10/586671310.db2.gz GPHSNFVTLYTKBT-NWDGAFQWSA-N 1 2 242.326 2.108 20 0 BEADLO Cc1cc(F)ccc1[C@@H](C)[NH2+]CC(F)(F)CO ZINC000815617266 586689069 /nfs/dbraw/zinc/68/90/69/586689069.db2.gz JOCCXBYYHVQUCI-SECBINFHSA-N 1 2 247.260 2.412 20 0 BEADLO Cc1cc(F)ccc1[C@H](C)[NH2+]CC(F)(F)CO ZINC000815617267 586689421 /nfs/dbraw/zinc/68/94/21/586689421.db2.gz JOCCXBYYHVQUCI-VIFPVBQESA-N 1 2 247.260 2.412 20 0 BEADLO Cn1ncc(C[NH+]2CCC(F)(F)CC2)c1Cl ZINC000816596601 586744141 /nfs/dbraw/zinc/74/41/41/586744141.db2.gz IPVVTGIXMUZMND-UHFFFAOYSA-N 1 2 249.692 2.305 20 0 BEADLO COc1cccc(C[N@H+](C)CCF)c1F ZINC000816639658 586747514 /nfs/dbraw/zinc/74/75/14/586747514.db2.gz AGYYZHPMGHLJCC-UHFFFAOYSA-N 1 2 215.243 2.236 20 0 BEADLO COc1cccc(C[N@@H+](C)CCF)c1F ZINC000816639658 586747516 /nfs/dbraw/zinc/74/75/16/586747516.db2.gz AGYYZHPMGHLJCC-UHFFFAOYSA-N 1 2 215.243 2.236 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1cn2cccc(F)c2n1 ZINC000816647614 586750444 /nfs/dbraw/zinc/75/04/44/586750444.db2.gz VQLWGSPZCOENTD-VHSXEESVSA-N 1 2 233.290 2.314 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1cn2cccc(F)c2n1 ZINC000816647614 586750447 /nfs/dbraw/zinc/75/04/47/586750447.db2.gz VQLWGSPZCOENTD-VHSXEESVSA-N 1 2 233.290 2.314 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cn3cccc(F)c3n2)[C@H]1C ZINC000816647615 586750743 /nfs/dbraw/zinc/75/07/43/586750743.db2.gz VQLWGSPZCOENTD-ZJUUUORDSA-N 1 2 233.290 2.314 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cn3cccc(F)c3n2)[C@H]1C ZINC000816647615 586750746 /nfs/dbraw/zinc/75/07/46/586750746.db2.gz VQLWGSPZCOENTD-ZJUUUORDSA-N 1 2 233.290 2.314 20 0 BEADLO C[C@@H](NC(=O)/C=C1\CC[C@H](C)C1)c1[nH]cc[nH+]1 ZINC000816719175 586759844 /nfs/dbraw/zinc/75/98/44/586759844.db2.gz RNCUQQQGLZHNIJ-BMNILSKHSA-N 1 2 233.315 2.333 20 0 BEADLO C[C@@H](NC(=O)C=C1CC[C@H](C)C1)c1[nH]cc[nH+]1 ZINC000816719175 586759845 /nfs/dbraw/zinc/75/98/45/586759845.db2.gz RNCUQQQGLZHNIJ-BMNILSKHSA-N 1 2 233.315 2.333 20 0 BEADLO CCCC[C@@H](CC)CNC(=O)Cc1[nH]cc[nH+]1 ZINC000816843415 586767735 /nfs/dbraw/zinc/76/77/35/586767735.db2.gz BAIXPSUTJDATSP-LLVKDONJSA-N 1 2 237.347 2.285 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)NCCCC1CCCCC1 ZINC000816868224 586769017 /nfs/dbraw/zinc/76/90/17/586769017.db2.gz KTCODPBVHSOQAF-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)N[C@@H]1C[C@@H]1C1CCCCC1 ZINC000816936057 586772132 /nfs/dbraw/zinc/77/21/32/586772132.db2.gz COWYKKHMCMPXTA-VXGBXAGGSA-N 1 2 247.342 2.037 20 0 BEADLO CCCC1(CNC(=O)Cc2[nH]cc[nH+]2)CCC1 ZINC000816947444 586772977 /nfs/dbraw/zinc/77/29/77/586772977.db2.gz RAZNYPQMIGHGPX-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO CCC/C=C\C(=O)NCc1c[nH+]ccc1OC ZINC000817086269 586781149 /nfs/dbraw/zinc/78/11/49/586781149.db2.gz MXBFUOQRZKTWNC-WAYWQWQTSA-N 1 2 234.299 2.063 20 0 BEADLO CC/C(C)=C(/C)C(=O)NCc1c[nH+]ccc1OC ZINC000817085787 586781462 /nfs/dbraw/zinc/78/14/62/586781462.db2.gz DUPREWZBLMFYDX-KHPPLWFESA-N 1 2 248.326 2.453 20 0 BEADLO CCC/C(C)=C\C(=O)NCc1c[nH+]ccc1OC ZINC000817086754 586781477 /nfs/dbraw/zinc/78/14/77/586781477.db2.gz JUXRJJOAXYJNPG-FLIBITNWSA-N 1 2 248.326 2.453 20 0 BEADLO Cc1cc(CNC(=O)[C@@H]2CCC=CO2)cc(C)[nH+]1 ZINC000817621381 586814406 /nfs/dbraw/zinc/81/44/06/586814406.db2.gz SQYGWNZVGKTJQQ-ZDUSSCGKSA-N 1 2 246.310 2.007 20 0 BEADLO C[C@@H](CSC(C)(C)C)[NH2+]CC(F)(F)CN ZINC000817966943 586856521 /nfs/dbraw/zinc/85/65/21/586856521.db2.gz ZXQCIKUIZLIQSY-QMMMGPOBSA-N 1 2 240.363 2.090 20 0 BEADLO Cc1cnc(NCc2c[nH+]cn2C(C)C)nc1 ZINC000819147893 586933038 /nfs/dbraw/zinc/93/30/38/586933038.db2.gz XDSPLXVVLHPGHE-UHFFFAOYSA-N 1 2 231.303 2.175 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)C(F)=C1CCC1 ZINC000819147316 586933236 /nfs/dbraw/zinc/93/32/36/586933236.db2.gz OQMXBTHJSHEYLA-UHFFFAOYSA-N 1 2 249.289 2.494 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C(F)=C1CCC1 ZINC000819202826 586938236 /nfs/dbraw/zinc/93/82/36/586938236.db2.gz PBQVULQQZAZCPB-UHFFFAOYSA-N 1 2 236.246 2.436 20 0 BEADLO Cc1ccc([C@H](O)C[NH2+]CC(C)(F)F)cc1 ZINC000819331748 586953151 /nfs/dbraw/zinc/95/31/51/586953151.db2.gz BHDYIZMBCOAORH-LLVKDONJSA-N 1 2 229.270 2.273 20 0 BEADLO Cc1cc(NC(=O)C(F)=C2CCC2)c(C)c[nH+]1 ZINC000819413428 586962443 /nfs/dbraw/zinc/96/24/43/586962443.db2.gz DTBMRCNTXIDEBW-UHFFFAOYSA-N 1 2 234.274 2.466 20 0 BEADLO CCn1ccc(C[NH2+][C@@H](C)c2ccns2)n1 ZINC000860059468 589077575 /nfs/dbraw/zinc/07/75/75/589077575.db2.gz MEBYOPQNRMAIFP-VIFPVBQESA-N 1 2 236.344 2.210 20 0 BEADLO CC[C@@H](NC(=O)C(F)=C1CCC1)c1[nH]cc[nH+]1 ZINC000819499335 586970352 /nfs/dbraw/zinc/97/03/52/586970352.db2.gz VITFXVRRVCALBJ-SECBINFHSA-N 1 2 237.278 2.385 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)CC2CCCC2)S1 ZINC000819758844 586990180 /nfs/dbraw/zinc/99/01/80/586990180.db2.gz BCVJAHXGQARDNI-MRVPVSSYSA-N 1 2 226.345 2.174 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)[C@H]2CCC(C)(C)C2)S1 ZINC000819775638 586992408 /nfs/dbraw/zinc/99/24/08/586992408.db2.gz IRZNCFVRDXCONO-IUCAKERBSA-N 1 2 240.372 2.420 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)NC2=[NH+]C[C@H](C)S2)C1 ZINC000819775394 586992711 /nfs/dbraw/zinc/99/27/11/586992711.db2.gz FTVHIESABJHTJJ-HRDYMLBCSA-N 1 2 226.345 2.030 20 0 BEADLO CC/C(C)=C(/C)C(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819777909 586993355 /nfs/dbraw/zinc/99/33/55/586993355.db2.gz WHINDJJIBANVMH-FZGDARCMSA-N 1 2 226.345 2.340 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)C2CC(C)(C)C2)S1 ZINC000819778123 586993477 /nfs/dbraw/zinc/99/34/77/586993477.db2.gz NMNWVOKYVAHKHH-SSDOTTSWSA-N 1 2 226.345 2.030 20 0 BEADLO CC[C@H](C)CC(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819779929 586994303 /nfs/dbraw/zinc/99/43/03/586994303.db2.gz BJTPZAVSZLKBFO-YUMQZZPRSA-N 1 2 214.334 2.030 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)CCCC2CC2)S1 ZINC000819780703 586994319 /nfs/dbraw/zinc/99/43/19/586994319.db2.gz IOIFYDMQSNUAGP-QMMMGPOBSA-N 1 2 226.345 2.174 20 0 BEADLO Cc1ccc(CCNc2ccc(Cl)nn2)c[nH+]1 ZINC000819918377 587002338 /nfs/dbraw/zinc/00/23/38/587002338.db2.gz ZLMCABFGIQTUCH-UHFFFAOYSA-N 1 2 248.717 2.488 20 0 BEADLO C[C@@H](CNC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C(C)(C)C ZINC000820023562 587013896 /nfs/dbraw/zinc/01/38/96/587013896.db2.gz RJCGALLOSDIKOE-HBNTYKKESA-N 1 2 249.358 2.312 20 0 BEADLO C[C@@H](CNC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C(C)(C)C ZINC000820023562 587013899 /nfs/dbraw/zinc/01/38/99/587013899.db2.gz RJCGALLOSDIKOE-HBNTYKKESA-N 1 2 249.358 2.312 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1C[C@H]2C[C@H]2C[C@H]1C)c1[nH]cc[nH+]1 ZINC000820191740 587033749 /nfs/dbraw/zinc/03/37/49/587033749.db2.gz NZJHDNFSKUNFRL-LZQZFOIKSA-N 1 2 247.342 2.269 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)[C@]1(C)C=CCC1 ZINC000820415483 587047190 /nfs/dbraw/zinc/04/71/90/587047190.db2.gz UIROOWUZMDOMCM-CQSZACIVSA-N 1 2 246.310 2.063 20 0 BEADLO CCCCCCNC(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000820526380 587052623 /nfs/dbraw/zinc/05/26/23/587052623.db2.gz FUEXDEUXENPESU-LLVKDONJSA-N 1 2 249.358 2.211 20 0 BEADLO CCCCCCNC(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000820526380 587052624 /nfs/dbraw/zinc/05/26/24/587052624.db2.gz FUEXDEUXENPESU-LLVKDONJSA-N 1 2 249.358 2.211 20 0 BEADLO C=C=CCNc1cc(C)[nH+]c(C2CC2)n1 ZINC000820586684 587056782 /nfs/dbraw/zinc/05/67/82/587056782.db2.gz NZMOYVRSWOYALX-UHFFFAOYSA-N 1 2 201.273 2.415 20 0 BEADLO C[C@@H]1CN(C(=O)c2cc3c[nH+]ccc3[nH]2)[C@H]1C ZINC000820657771 587063493 /nfs/dbraw/zinc/06/34/93/587063493.db2.gz YAVBKGXRNDSKGD-BDAKNGLRSA-N 1 2 229.283 2.043 20 0 BEADLO CC1(CCC(=O)N[C@H]2CCn3cc[nH+]c32)CC1 ZINC000820948341 587083889 /nfs/dbraw/zinc/08/38/89/587083889.db2.gz SVWAMCSTEPQAMQ-JTQLQIEISA-N 1 2 233.315 2.024 20 0 BEADLO CC(C)=CC(=O)OCc1ccc[nH+]c1N(C)C ZINC000821608163 587132513 /nfs/dbraw/zinc/13/25/13/587132513.db2.gz VVOQFVKMXKFLAC-UHFFFAOYSA-N 1 2 234.299 2.157 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)[C@]23C[C@H]2CCC3)c2[nH+]ccn21 ZINC000821787545 587138092 /nfs/dbraw/zinc/13/80/92/587138092.db2.gz VJDUMCKKPJUSPI-NJBDSQKTSA-N 1 2 245.326 2.195 20 0 BEADLO CCC[C@H](CC)C(=O)N[C@@H]1CCn2cc[nH+]c2C1 ZINC000822131798 587155529 /nfs/dbraw/zinc/15/55/29/587155529.db2.gz FBUPQFODRMCYPR-NWDGAFQWSA-N 1 2 249.358 2.140 20 0 BEADLO CC[C@H]1CCC[C@@H]1C(=O)NC1=[NH+]CCS1 ZINC000822234392 587159076 /nfs/dbraw/zinc/15/90/76/587159076.db2.gz RNZOIPGZCGQFJB-IUCAKERBSA-N 1 2 226.345 2.032 20 0 BEADLO C[C@@H](CC(C)(C)C)NC(=O)/C=C/c1cn(C)c[nH+]1 ZINC000822276436 587160270 /nfs/dbraw/zinc/16/02/70/587160270.db2.gz FEYXCRMQOMQQJG-MLRMMBSGSA-N 1 2 249.358 2.374 20 0 BEADLO C[C@H]1COCC[N@@H+]1CC[C@@H]1CC1(Cl)Cl ZINC000822579797 587175935 /nfs/dbraw/zinc/17/59/35/587175935.db2.gz JALBLMNBHWLNCC-DTWKUNHWSA-N 1 2 238.158 2.291 20 0 BEADLO C[C@H]1COCC[N@H+]1CC[C@@H]1CC1(Cl)Cl ZINC000822579797 587175936 /nfs/dbraw/zinc/17/59/36/587175936.db2.gz JALBLMNBHWLNCC-DTWKUNHWSA-N 1 2 238.158 2.291 20 0 BEADLO C[C@@H]1COCC[N@@H+]1CC[C@@H]1CC1(Cl)Cl ZINC000822579799 587176149 /nfs/dbraw/zinc/17/61/49/587176149.db2.gz JALBLMNBHWLNCC-RKDXNWHRSA-N 1 2 238.158 2.291 20 0 BEADLO C[C@@H]1COCC[N@H+]1CC[C@@H]1CC1(Cl)Cl ZINC000822579799 587176151 /nfs/dbraw/zinc/17/61/51/587176151.db2.gz JALBLMNBHWLNCC-RKDXNWHRSA-N 1 2 238.158 2.291 20 0 BEADLO CC/C(C)=C\C(=O)N1CC(Oc2cc[nH+]cc2)C1 ZINC000823050519 587199527 /nfs/dbraw/zinc/19/95/27/587199527.db2.gz BPQIMPYCXBGRIX-FLIBITNWSA-N 1 2 246.310 2.028 20 0 BEADLO CC/C(C)=C\C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000823088251 587201794 /nfs/dbraw/zinc/20/17/94/587201794.db2.gz KQHZYSWPXHQHLY-SUIFULHWSA-N 1 2 247.342 2.403 20 0 BEADLO O=C(N[C@H]1CCn2cc[nH+]c21)C1CCC=CCC1 ZINC000823236992 587210481 /nfs/dbraw/zinc/21/04/81/587210481.db2.gz JRFQNSHEJSMPOQ-LBPRGKRZSA-N 1 2 245.326 2.191 20 0 BEADLO CCC[C@H](CC)C(=O)NC1=[NH+]C[C@H](C)S1 ZINC000823806766 587240851 /nfs/dbraw/zinc/24/08/51/587240851.db2.gz IIDPQYSQDMHHLH-IUCAKERBSA-N 1 2 228.361 2.420 20 0 BEADLO CCC[C@H](CC)C(=O)N[C@H]1CCn2c[nH+]cc2C1 ZINC000824046122 587251534 /nfs/dbraw/zinc/25/15/34/587251534.db2.gz JDAANBUPZXNNAH-RYUDHWBXSA-N 1 2 249.358 2.140 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)[C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000824629849 587280284 /nfs/dbraw/zinc/28/02/84/587280284.db2.gz ZTUZHMDJFKNXOY-WCFLWFBJSA-N 1 2 247.342 2.194 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)[C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000824629849 587280285 /nfs/dbraw/zinc/28/02/85/587280285.db2.gz ZTUZHMDJFKNXOY-WCFLWFBJSA-N 1 2 247.342 2.194 20 0 BEADLO CC(C)CC[NH2+]c1ccc(O[C@@H]2CC(=O)N2)cc1 ZINC000824999843 587298052 /nfs/dbraw/zinc/29/80/52/587298052.db2.gz RRKDHOJZNWKBKQ-CQSZACIVSA-N 1 2 248.326 2.369 20 0 BEADLO CC(C)CC[NH2+]c1ccc(O[C@H]2CC(=O)N2)cc1 ZINC000824999842 587298279 /nfs/dbraw/zinc/29/82/79/587298279.db2.gz RRKDHOJZNWKBKQ-AWEZNQCLSA-N 1 2 248.326 2.369 20 0 BEADLO CC[C@H](C)C[NH2+]c1ccc(O[C@@H]2CC(=O)N2)cc1 ZINC000824998813 587298377 /nfs/dbraw/zinc/29/83/77/587298377.db2.gz CWVADDHGWPAAED-IINYFYTJSA-N 1 2 248.326 2.369 20 0 BEADLO CC1(C)CC[N@H+](Cc2ccoc2)CC[S@]1=O ZINC000825024358 587298713 /nfs/dbraw/zinc/29/87/13/587298713.db2.gz OCERYVTZXSYGIR-MRXNPFEDSA-N 1 2 241.356 2.013 20 0 BEADLO CC1(C)CC[N@@H+](Cc2ccoc2)CC[S@]1=O ZINC000825024358 587298715 /nfs/dbraw/zinc/29/87/15/587298715.db2.gz OCERYVTZXSYGIR-MRXNPFEDSA-N 1 2 241.356 2.013 20 0 BEADLO CC[C@](C)(NC(=O)/C=C\c1cn(C)c[nH+]1)C1CC1 ZINC000825398352 587318236 /nfs/dbraw/zinc/31/82/36/587318236.db2.gz QFAMBDKEOFBBSX-DANTVBBOSA-N 1 2 247.342 2.128 20 0 BEADLO Cc1cccn2c(NC(=O)NOC(C)C)c[nH+]c12 ZINC000825469298 587320334 /nfs/dbraw/zinc/32/03/34/587320334.db2.gz WBFILKBGBICLQO-UHFFFAOYSA-N 1 2 248.286 2.104 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NCCCCC1CC1 ZINC000825662236 587329826 /nfs/dbraw/zinc/32/98/26/587329826.db2.gz SYRYACWQXCYOBT-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NCCCCC1CC1 ZINC000825662236 587329827 /nfs/dbraw/zinc/32/98/27/587329827.db2.gz SYRYACWQXCYOBT-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO Cc1cc[nH+]c(NCCC(C)C)c1-c1nn[nH]n1 ZINC000826313728 587351941 /nfs/dbraw/zinc/35/19/41/587351941.db2.gz RGMZPYQUOBSJJE-UHFFFAOYSA-N 1 2 246.318 2.028 20 0 BEADLO CC1(C)CC(NC(=O)c2cc3c[nH+]ccc3[nH]2)C1 ZINC000826624036 587356944 /nfs/dbraw/zinc/35/69/44/587356944.db2.gz YJWPIQSKXOLORC-UHFFFAOYSA-N 1 2 243.310 2.481 20 0 BEADLO c1cnc(CNc2c[nH+]cc3c2CCCC3)cn1 ZINC000826816085 587363293 /nfs/dbraw/zinc/36/32/93/587363293.db2.gz RFULLTJILGVMAI-UHFFFAOYSA-N 1 2 240.310 2.363 20 0 BEADLO CC/C(C)=C\C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000826937812 587366215 /nfs/dbraw/zinc/36/62/15/587366215.db2.gz NJEDQZWOCUFTIB-FLIBITNWSA-N 1 2 247.342 2.472 20 0 BEADLO CC/C(C)=C\C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000826937812 587366216 /nfs/dbraw/zinc/36/62/16/587366216.db2.gz NJEDQZWOCUFTIB-FLIBITNWSA-N 1 2 247.342 2.472 20 0 BEADLO COCC[N@H+](CCF)Cc1occc1C ZINC000827054119 587369308 /nfs/dbraw/zinc/36/93/08/587369308.db2.gz MEQNPMBMVFNTAL-UHFFFAOYSA-N 1 2 215.268 2.006 20 0 BEADLO CC/C(C)=C\C(=O)N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000827722062 587399369 /nfs/dbraw/zinc/39/93/69/587399369.db2.gz XWIVTVYCHQKWJI-UCQJPZFISA-N 1 2 247.342 2.092 20 0 BEADLO c1cn2c([nH+]1)[C@@H](Nc1nc(C3CC3)ns1)CC2 ZINC000828357230 587438128 /nfs/dbraw/zinc/43/81/28/587438128.db2.gz AZBQMLHKRCAUNE-QMMMGPOBSA-N 1 2 247.327 2.169 20 0 BEADLO CC(C)c1nc(N[C@@H]2CCn3ccnc32)cc[nH+]1 ZINC000828359012 587438507 /nfs/dbraw/zinc/43/85/07/587438507.db2.gz XSYUHACURSGXSP-SNVBAGLBSA-N 1 2 243.314 2.353 20 0 BEADLO CC(C)c1nsc(N[C@H]2CCn3cc[nH+]c32)n1 ZINC000828359248 587438514 /nfs/dbraw/zinc/43/85/14/587438514.db2.gz ZAHNLNHZEXAVOH-QMMMGPOBSA-N 1 2 249.343 2.415 20 0 BEADLO CCc1cc(C)nc(N[C@H]2CCn3cc[nH+]c32)n1 ZINC000828359188 587438606 /nfs/dbraw/zinc/43/86/06/587438606.db2.gz YPDPCLGMAKMMGH-NSHDSACASA-N 1 2 243.314 2.101 20 0 BEADLO Cc1nn(C)c(C)c1C[NH+]1CC(C(F)(F)F)C1 ZINC000828405826 587440441 /nfs/dbraw/zinc/44/04/41/587440441.db2.gz QEUBRAVTEANAJW-UHFFFAOYSA-N 1 2 247.264 2.031 20 0 BEADLO Cc1nc(C)c(C[NH+]2CC(C(F)(F)F)C2)o1 ZINC000828415700 587441165 /nfs/dbraw/zinc/44/11/65/587441165.db2.gz UTLNJAVZYKYTJM-UHFFFAOYSA-N 1 2 234.221 2.286 20 0 BEADLO CC[C@@H]1CCC[C@H](NC(=O)Cc2[nH]cc[nH+]2)C1 ZINC000828507482 587446076 /nfs/dbraw/zinc/44/60/76/587446076.db2.gz ZBRKRXSFVAIAQB-MNOVXSKESA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@]1(O)CC[N@H+](Cc2csc(Cl)n2)C1 ZINC000828992290 587478094 /nfs/dbraw/zinc/47/80/94/587478094.db2.gz SLYNZSXLIQSSDL-JTQLQIEISA-N 1 2 246.763 2.143 20 0 BEADLO CC[C@]1(O)CC[N@@H+](Cc2csc(Cl)n2)C1 ZINC000828992290 587478096 /nfs/dbraw/zinc/47/80/96/587478096.db2.gz SLYNZSXLIQSSDL-JTQLQIEISA-N 1 2 246.763 2.143 20 0 BEADLO CC[C@H](C)C(=O)N1CCc2[nH]c[nH+]c2C12CCC2 ZINC000829099202 587482782 /nfs/dbraw/zinc/48/27/82/587482782.db2.gz BDPXDZGESVUGSB-JTQLQIEISA-N 1 2 247.342 2.220 20 0 BEADLO CC/C(C)=C/C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000829542040 587503054 /nfs/dbraw/zinc/50/30/54/587503054.db2.gz FJKDGXAJDDHDNC-AAXQSMANSA-N 1 2 221.304 2.333 20 0 BEADLO CCC(C)=CC(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000829542040 587503056 /nfs/dbraw/zinc/50/30/56/587503056.db2.gz FJKDGXAJDDHDNC-AAXQSMANSA-N 1 2 221.304 2.333 20 0 BEADLO CCCC[C@@H](CCC)NC(=O)Cc1[nH]cc[nH+]1 ZINC000829678453 587508909 /nfs/dbraw/zinc/50/89/09/587508909.db2.gz IZUVQZGJVFUZNM-LLVKDONJSA-N 1 2 237.347 2.427 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@@H+]1CCC[C@@](C)(F)C1 ZINC000830212702 587542002 /nfs/dbraw/zinc/54/20/02/587542002.db2.gz TZWQDSSHLONTIA-ZYHUDNBSSA-N 1 2 231.311 2.152 20 0 BEADLO CCCOC(=O)[C@@H](C)[N@H+]1CCC[C@@](C)(F)C1 ZINC000830212702 587542003 /nfs/dbraw/zinc/54/20/03/587542003.db2.gz TZWQDSSHLONTIA-ZYHUDNBSSA-N 1 2 231.311 2.152 20 0 BEADLO CC(C)(O)c1ccc(C[NH2+]C(CF)CF)cc1 ZINC000830446129 587551802 /nfs/dbraw/zinc/55/18/02/587551802.db2.gz UOUNISPZHGPRBD-UHFFFAOYSA-N 1 2 243.297 2.311 20 0 BEADLO COC[C@@]1(C)CC[N@H+](CC(F)(F)C(F)F)C1 ZINC000830519509 587555366 /nfs/dbraw/zinc/55/53/66/587555366.db2.gz HLXUTMVNTKYHGV-VIFPVBQESA-N 1 2 243.244 2.245 20 0 BEADLO COC[C@@]1(C)CC[N@@H+](CC(F)(F)C(F)F)C1 ZINC000830519509 587555367 /nfs/dbraw/zinc/55/53/67/587555367.db2.gz HLXUTMVNTKYHGV-VIFPVBQESA-N 1 2 243.244 2.245 20 0 BEADLO COC[C@]1(C)CC[N@H+](CC(F)(F)C(F)F)C1 ZINC000830519507 587555573 /nfs/dbraw/zinc/55/55/73/587555573.db2.gz HLXUTMVNTKYHGV-SECBINFHSA-N 1 2 243.244 2.245 20 0 BEADLO COC[C@]1(C)CC[N@@H+](CC(F)(F)C(F)F)C1 ZINC000830519507 587555575 /nfs/dbraw/zinc/55/55/75/587555575.db2.gz HLXUTMVNTKYHGV-SECBINFHSA-N 1 2 243.244 2.245 20 0 BEADLO C[N@H+](C/C(Cl)=C\Cl)CC(C)(C)CO ZINC000830703575 587564193 /nfs/dbraw/zinc/56/41/93/587564193.db2.gz FDSUBFJHBIFHQD-XBXARRHUSA-N 1 2 226.147 2.256 20 0 BEADLO C[N@@H+](C/C(Cl)=C\Cl)CC(C)(C)CO ZINC000830703575 587564194 /nfs/dbraw/zinc/56/41/94/587564194.db2.gz FDSUBFJHBIFHQD-XBXARRHUSA-N 1 2 226.147 2.256 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)/C=C\C1CCCC1 ZINC000830789116 587570569 /nfs/dbraw/zinc/57/05/69/587570569.db2.gz WPWMUMOQZIBQEY-SREVYHEPSA-N 1 2 248.326 2.252 20 0 BEADLO CC1(C(=O)N[C@H]2CCn3cc[nH+]c32)CCCCC1 ZINC000833277791 587704293 /nfs/dbraw/zinc/70/42/93/587704293.db2.gz HFKQFBGJSJSITG-NSHDSACASA-N 1 2 247.342 2.415 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833272544 587704308 /nfs/dbraw/zinc/70/43/08/587704308.db2.gz PIUKWPCXEGEVHC-IJLUTSLNSA-N 1 2 247.342 2.270 20 0 BEADLO C[C@H](C(=O)N[C@H]1CCn2cc[nH+]c21)C(C)(C)C ZINC000833292886 587704334 /nfs/dbraw/zinc/70/43/34/587704334.db2.gz OGWYYHMPLMDKSK-ZJUUUORDSA-N 1 2 235.331 2.126 20 0 BEADLO C[C@@H]1CC/C(=C/C(=O)N[C@H]2CCn3cc[nH+]c32)C1 ZINC000833283315 587704576 /nfs/dbraw/zinc/70/45/76/587704576.db2.gz BGOFWBCFCXZKEZ-JFTBMZSVSA-N 1 2 245.326 2.191 20 0 BEADLO C[C@@H]1CCC[C@H](C(=O)N[C@H]2CCn3cc[nH+]c32)C1 ZINC000833292643 587704674 /nfs/dbraw/zinc/70/46/74/587704674.db2.gz JNGASRSSHGJICE-WOPDTQHZSA-N 1 2 247.342 2.270 20 0 BEADLO C[C@@H]1CC/C(=C\C(=O)N[C@H]2CCn3cc[nH+]c32)C1 ZINC000833283323 587704690 /nfs/dbraw/zinc/70/46/90/587704690.db2.gz BGOFWBCFCXZKEZ-ZYHQFBDJSA-N 1 2 245.326 2.191 20 0 BEADLO O=C(N[C@H]1CCn2cc[nH+]c21)[C@H]1CC12CCCC2 ZINC000833284490 587704710 /nfs/dbraw/zinc/70/47/10/587704710.db2.gz JKMRQYRIZIKBFE-MNOVXSKESA-N 1 2 245.326 2.024 20 0 BEADLO O=C(C=C1CCCCC1)N[C@H]1CCn2cc[nH+]c21 ZINC000833284331 587704870 /nfs/dbraw/zinc/70/48/70/587704870.db2.gz IBKOSUINBUJDST-LBPRGKRZSA-N 1 2 245.326 2.335 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)OCc1c[nH+]cn1C ZINC000835193774 587788249 /nfs/dbraw/zinc/78/82/49/587788249.db2.gz NWARAAUACHEFHF-ZYHUDNBSSA-N 1 2 236.315 2.290 20 0 BEADLO C[C@H]1CC=C(C(=O)OCc2c[nH+]cn2C)CC1 ZINC000835195952 587788592 /nfs/dbraw/zinc/78/85/92/587788592.db2.gz VCQRODCRDLNTEO-JTQLQIEISA-N 1 2 234.299 2.210 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)[C@@]1(C)CC=CCC1 ZINC000835323521 587796302 /nfs/dbraw/zinc/79/63/02/587796302.db2.gz NESCSEVVPDQMJD-AWEZNQCLSA-N 1 2 248.326 2.252 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)OCCn1cc[nH+]c1 ZINC000835348885 587797799 /nfs/dbraw/zinc/79/77/99/587797799.db2.gz DHWDGMVIFAEKJX-VXGBXAGGSA-N 1 2 236.315 2.253 20 0 BEADLO C[C@@H]1CCC[C@]1(C)C(=O)OCCn1cc[nH+]c1 ZINC000835349767 587797908 /nfs/dbraw/zinc/79/79/08/587797908.db2.gz KATXXTSQMNFGBC-YPMHNXCESA-N 1 2 236.315 2.253 20 0 BEADLO C[C@@]1(C(=O)OCCn2cc[nH+]c2)CC=CCC1 ZINC000835350076 587798066 /nfs/dbraw/zinc/79/80/66/587798066.db2.gz MKBFVFXJEKXDKY-CYBMUJFWSA-N 1 2 234.299 2.173 20 0 BEADLO C[C@H]1C[C@H](NC(=O)N2CCCCC2)c2[nH+]ccn21 ZINC000836240933 587829401 /nfs/dbraw/zinc/82/94/01/587829401.db2.gz RWYVLSXIDWGJPI-QWRGUYRKSA-N 1 2 248.330 2.084 20 0 BEADLO CC/C(C)=C(/C)C(=O)NCc1[nH+]ccn1CC ZINC000836806569 587838383 /nfs/dbraw/zinc/83/83/83/587838383.db2.gz FAOGJRHMIVXCBF-KHPPLWFESA-N 1 2 235.331 2.266 20 0 BEADLO CC/C=C(/C)C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000836953675 587843482 /nfs/dbraw/zinc/84/34/82/587843482.db2.gz GWXGOBMAVZWVIE-DESOLJLISA-N 1 2 233.315 2.361 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)C(C)=C(C)C ZINC000836951777 587843836 /nfs/dbraw/zinc/84/38/36/587843836.db2.gz ZSEAGLHFZAIUSI-LLVKDONJSA-N 1 2 235.331 2.437 20 0 BEADLO CC/C(C)=C\C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000836961767 587843977 /nfs/dbraw/zinc/84/39/77/587843977.db2.gz WZQVYPQJKRSWGQ-ZNWQGHSCSA-N 1 2 233.315 2.361 20 0 BEADLO Cc1cc(C)c(CNC(=O)[C@@H](F)C(C)C)c[nH+]1 ZINC000837106160 587854350 /nfs/dbraw/zinc/85/43/50/587854350.db2.gz WTSZQRKCGXSWOB-LBPRGKRZSA-N 1 2 238.306 2.309 20 0 BEADLO Cc1occc1C[N@@H+]1CCO[C@H](C(F)F)C1 ZINC000840942830 587931175 /nfs/dbraw/zinc/93/11/75/587931175.db2.gz HAIMAQHMOFLHOZ-JTQLQIEISA-N 1 2 231.242 2.054 20 0 BEADLO Cc1occc1C[N@H+]1CCO[C@H](C(F)F)C1 ZINC000840942830 587931176 /nfs/dbraw/zinc/93/11/76/587931176.db2.gz HAIMAQHMOFLHOZ-JTQLQIEISA-N 1 2 231.242 2.054 20 0 BEADLO COC1(CO[NH+]=C(N)c2ccccc2C)CCC1 ZINC000842013743 587989110 /nfs/dbraw/zinc/98/91/10/587989110.db2.gz UAGMWQRXKSGAJY-UHFFFAOYSA-N 1 2 248.326 2.411 20 0 BEADLO CC[N@H+](CCSC)Cn1ncsc1=S ZINC000842643587 588048380 /nfs/dbraw/zinc/04/83/80/588048380.db2.gz FLIARBCKSVXCMQ-UHFFFAOYSA-N 1 2 249.430 2.316 20 0 BEADLO CC[N@@H+](CCSC)Cn1ncsc1=S ZINC000842643587 588048382 /nfs/dbraw/zinc/04/83/82/588048382.db2.gz FLIARBCKSVXCMQ-UHFFFAOYSA-N 1 2 249.430 2.316 20 0 BEADLO CC(C)(C)OCC(N)=[NH+]OCC1=CCCC1 ZINC000842649292 588048708 /nfs/dbraw/zinc/04/87/08/588048708.db2.gz FZRPDGAPSWUFRX-UHFFFAOYSA-N 1 2 226.320 2.410 20 0 BEADLO Cn1c[nH+]cc1COC(=O)/C=C/C1CCCC1 ZINC000842725892 588056171 /nfs/dbraw/zinc/05/61/71/588056171.db2.gz OCFXAHXIKSNEKO-VOTSOKGWSA-N 1 2 234.299 2.210 20 0 BEADLO C/C=C(/C)COC(=O)Cc1cn2ccccc2[nH+]1 ZINC000842847928 588069780 /nfs/dbraw/zinc/06/97/80/588069780.db2.gz DVEUZHZWUSPQTR-JYOAFUTRSA-N 1 2 244.294 2.386 20 0 BEADLO CC[NH2+]Cc1noc([C@H](C)C2CCCC2)n1 ZINC000843145221 588086771 /nfs/dbraw/zinc/08/67/71/588086771.db2.gz XUIDNHYHJWMPJQ-SECBINFHSA-N 1 2 223.320 2.473 20 0 BEADLO CC[NH2+]Cc1noc(CCc2ccsc2)n1 ZINC000843145283 588086880 /nfs/dbraw/zinc/08/68/80/588086880.db2.gz ATIOVVFEOXPYSJ-UHFFFAOYSA-N 1 2 237.328 2.026 20 0 BEADLO Cn1c[nH+]cc1-c1cccc2c1OCC2 ZINC000844234067 588175805 /nfs/dbraw/zinc/17/58/05/588175805.db2.gz WFJIIMVTHNRCEE-UHFFFAOYSA-N 1 2 200.241 2.022 20 0 BEADLO CC(C)(C)OC(=O)N1CCC=C(c2[nH]cc[nH+]2)C1 ZINC000844235177 588176213 /nfs/dbraw/zinc/17/62/13/588176213.db2.gz YVIOIIJWMVGWIL-UHFFFAOYSA-N 1 2 249.314 2.434 20 0 BEADLO O=C(NC1=[NH+]CCS1)[C@@H]1C[C@@H]1C1CCCC1 ZINC000844317332 588184346 /nfs/dbraw/zinc/18/43/46/588184346.db2.gz QPZYBXLBUNGFTF-NXEZZACHSA-N 1 2 238.356 2.032 20 0 BEADLO C[C@H](CC(=O)Nc1cccc(F)n1)n1cc[nH+]c1 ZINC000844484251 588199037 /nfs/dbraw/zinc/19/90/37/588199037.db2.gz YSEABAYYQVEHMA-SECBINFHSA-N 1 2 248.261 2.007 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)[C@@H]1C[C@H]1C1CCC1 ZINC000845221144 588224235 /nfs/dbraw/zinc/22/42/35/588224235.db2.gz QTSBNGQWYJKWHA-QWHCGFSZSA-N 1 2 248.326 2.253 20 0 BEADLO CCN(C(=O)Cc1cn2c([nH+]1)CCCC2)C(C)C ZINC000845256361 588224896 /nfs/dbraw/zinc/22/48/96/588224896.db2.gz UPTOTLJUZVKLGW-UHFFFAOYSA-N 1 2 249.358 2.019 20 0 BEADLO C[C@@H](CC(=O)OC/C=C\Cl)n1cc[nH+]c1 ZINC000845279451 588225215 /nfs/dbraw/zinc/22/52/15/588225215.db2.gz WOAUGRKVWXRPCI-XADBCAIWSA-N 1 2 228.679 2.130 20 0 BEADLO CSCCCOC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000845282342 588225362 /nfs/dbraw/zinc/22/53/62/588225362.db2.gz OAUDKBOXKLZPOO-SNVBAGLBSA-N 1 2 242.344 2.131 20 0 BEADLO CC(C)CCOC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000845279650 588225412 /nfs/dbraw/zinc/22/54/12/588225412.db2.gz XGOHRRUBNLCJQU-NSHDSACASA-N 1 2 224.304 2.424 20 0 BEADLO C[C@@H](CC(=O)OCCC(C)(F)F)n1cc[nH+]c1 ZINC000845284754 588225804 /nfs/dbraw/zinc/22/58/04/588225804.db2.gz DXTRHLZTOVCBKN-VIFPVBQESA-N 1 2 246.257 2.423 20 0 BEADLO C[C@H](CC(=O)OCCC(C)(F)F)n1cc[nH+]c1 ZINC000845284753 588225810 /nfs/dbraw/zinc/22/58/10/588225810.db2.gz DXTRHLZTOVCBKN-SECBINFHSA-N 1 2 246.257 2.423 20 0 BEADLO Cc1occc1COC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000845470232 588229785 /nfs/dbraw/zinc/22/97/85/588229785.db2.gz RXJMZICAYJNIIQ-SNVBAGLBSA-N 1 2 248.282 2.479 20 0 BEADLO C[C@H](CC(=O)OC1(C)CCC1)n1cc[nH+]c1 ZINC000845482646 588230115 /nfs/dbraw/zinc/23/01/15/588230115.db2.gz GZWDVHCWVOALHZ-SNVBAGLBSA-N 1 2 222.288 2.320 20 0 BEADLO C[C@@H](CC(=O)O[C@@H](C)C(F)F)n1cc[nH+]c1 ZINC000845526810 588232155 /nfs/dbraw/zinc/23/21/55/588232155.db2.gz MAYUOCOOTABYSK-YUMQZZPRSA-N 1 2 232.230 2.031 20 0 BEADLO C[C@@H](CC(=O)OC1CC2(CC2)C1)n1cc[nH+]c1 ZINC000845586582 588234121 /nfs/dbraw/zinc/23/41/21/588234121.db2.gz WJJKEAGCHCULJP-JTQLQIEISA-N 1 2 234.299 2.320 20 0 BEADLO C[C@H](CC(=O)OC[C@@]1(C)C[C@H]1F)n1cc[nH+]c1 ZINC000845611849 588236035 /nfs/dbraw/zinc/23/60/35/588236035.db2.gz QOCKYPURTHQPPO-CKYFFXLPSA-N 1 2 240.278 2.126 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccc(C)nn2)[C@@H](CC)CO1 ZINC000846027733 588253965 /nfs/dbraw/zinc/25/39/65/588253965.db2.gz ORGLYDLQRLXXEK-KBPBESRZSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccc(C)nn2)[C@@H](CC)CO1 ZINC000846027733 588253966 /nfs/dbraw/zinc/25/39/66/588253966.db2.gz ORGLYDLQRLXXEK-KBPBESRZSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccc(F)nc2)[C@@H](C)CO1 ZINC000846043585 588254744 /nfs/dbraw/zinc/25/47/44/588254744.db2.gz LQZSBUKPTCYTTQ-JQWIXIFHSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccc(F)nc2)[C@@H](C)CO1 ZINC000846043585 588254745 /nfs/dbraw/zinc/25/47/45/588254745.db2.gz LQZSBUKPTCYTTQ-JQWIXIFHSA-N 1 2 238.306 2.220 20 0 BEADLO CCc1cnc(C[N@@H+]2C[C@H]3[C@@H](C2)C3(F)F)s1 ZINC000846113174 588257421 /nfs/dbraw/zinc/25/74/21/588257421.db2.gz VUDHWIBALHCJCH-DTORHVGOSA-N 1 2 244.310 2.402 20 0 BEADLO CCc1cnc(C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)s1 ZINC000846113174 588257422 /nfs/dbraw/zinc/25/74/22/588257422.db2.gz VUDHWIBALHCJCH-DTORHVGOSA-N 1 2 244.310 2.402 20 0 BEADLO COCc1cc[nH+]c(N[C@H]2CC[C@H]2C)c1 ZINC000846117246 588257972 /nfs/dbraw/zinc/25/79/72/588257972.db2.gz LGJUZGATJSGCGG-KOLCDFICSA-N 1 2 206.289 2.438 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCC[C@@H](F)C2)nc1 ZINC000846120332 588258103 /nfs/dbraw/zinc/25/81/03/588258103.db2.gz OINJJGFCSFUKNY-LLVKDONJSA-N 1 2 238.306 2.414 20 0 BEADLO CCOc1ccc(C[N@H+]2CCC[C@@H](F)C2)nc1 ZINC000846120332 588258104 /nfs/dbraw/zinc/25/81/04/588258104.db2.gz OINJJGFCSFUKNY-LLVKDONJSA-N 1 2 238.306 2.414 20 0 BEADLO CC[C@H](C)N(OC)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000846637642 588280423 /nfs/dbraw/zinc/28/04/23/588280423.db2.gz CYZAIVAHZKYRRQ-WDEREUQCSA-N 1 2 239.319 2.023 20 0 BEADLO c1csc(N2CC[C@@H](Oc3cc[nH+]cc3)C2)n1 ZINC000846749807 588285064 /nfs/dbraw/zinc/28/50/64/588285064.db2.gz JNLYNLJNMHVJBX-LLVKDONJSA-N 1 2 247.323 2.196 20 0 BEADLO CC[C@@H]1CCCC[N@@H+]1Cc1cnsn1 ZINC000846768512 588286995 /nfs/dbraw/zinc/28/69/95/588286995.db2.gz MLROLDLSXPMIMY-SNVBAGLBSA-N 1 2 211.334 2.303 20 0 BEADLO CC[C@@H]1CCCC[N@H+]1Cc1cnsn1 ZINC000846768512 588286996 /nfs/dbraw/zinc/28/69/96/588286996.db2.gz MLROLDLSXPMIMY-SNVBAGLBSA-N 1 2 211.334 2.303 20 0 BEADLO C[N@@H+](Cc1cnsn1)CC1CCCC1 ZINC000846787820 588288272 /nfs/dbraw/zinc/28/82/72/588288272.db2.gz CDOHGRDNGBEZNW-UHFFFAOYSA-N 1 2 211.334 2.160 20 0 BEADLO C[N@H+](Cc1cnsn1)CC1CCCC1 ZINC000846787820 588288273 /nfs/dbraw/zinc/28/82/73/588288273.db2.gz CDOHGRDNGBEZNW-UHFFFAOYSA-N 1 2 211.334 2.160 20 0 BEADLO CC[C@H](C)C[N@H+](CC)Cc1cnsn1 ZINC000846811959 588290299 /nfs/dbraw/zinc/29/02/99/588290299.db2.gz PZSWIGDLCNGOMO-VIFPVBQESA-N 1 2 213.350 2.406 20 0 BEADLO CC[C@H](C)C[N@@H+](CC)Cc1cnsn1 ZINC000846811959 588290300 /nfs/dbraw/zinc/29/03/00/588290300.db2.gz PZSWIGDLCNGOMO-VIFPVBQESA-N 1 2 213.350 2.406 20 0 BEADLO FC1(F)C[C@]12CCC[N@H+](Cc1cnsn1)C2 ZINC000847015331 588301579 /nfs/dbraw/zinc/30/15/79/588301579.db2.gz VRESLAMJOHLEQW-VIFPVBQESA-N 1 2 245.298 2.159 20 0 BEADLO FC1(F)C[C@]12CCC[N@@H+](Cc1cnsn1)C2 ZINC000847015331 588301580 /nfs/dbraw/zinc/30/15/80/588301580.db2.gz VRESLAMJOHLEQW-VIFPVBQESA-N 1 2 245.298 2.159 20 0 BEADLO CCCCOC(=O)C(C)(C)[NH2+]C[C@@H](CC)OC ZINC000847062645 588305405 /nfs/dbraw/zinc/30/54/05/588305405.db2.gz NJNVLDUHUJJKLY-LLVKDONJSA-N 1 2 245.363 2.123 20 0 BEADLO CCC/C(C)=C\C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000848387176 588376051 /nfs/dbraw/zinc/37/60/51/588376051.db2.gz MARYZWNJEFPXKU-HSTULFTRSA-N 1 2 221.304 2.333 20 0 BEADLO CCCC(C)=CC(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000848387176 588376053 /nfs/dbraw/zinc/37/60/53/588376053.db2.gz MARYZWNJEFPXKU-HSTULFTRSA-N 1 2 221.304 2.333 20 0 BEADLO CCC1=C(C(=O)N[C@H](C)c2[nH]cc[nH+]2)CCCO1 ZINC000848387155 588376082 /nfs/dbraw/zinc/37/60/82/588376082.db2.gz LAHBCNMOFMKJAK-SECBINFHSA-N 1 2 249.314 2.061 20 0 BEADLO Fc1cccc(C[NH2+][C@H]2CCCn3ccnc32)n1 ZINC000848534975 588394041 /nfs/dbraw/zinc/39/40/41/588394041.db2.gz BZERZINUKVIYCG-NSHDSACASA-N 1 2 246.289 2.042 20 0 BEADLO CC[NH2+]Cc1noc(/C(C)=C/c2ccco2)n1 ZINC000848618625 588402191 /nfs/dbraw/zinc/40/21/91/588402191.db2.gz UUGXNXDTBDOZEE-VQHVLOKHSA-N 1 2 233.271 2.333 20 0 BEADLO CC[NH2+]Cc1noc(/C(C)=C/c2cccnc2)n1 ZINC000848618365 588402381 /nfs/dbraw/zinc/40/23/81/588402381.db2.gz SORQSBVNHGOLDM-JXMROGBWSA-N 1 2 244.298 2.135 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@H]1CC[C@@H](C)C1 ZINC000848686312 588405473 /nfs/dbraw/zinc/40/54/73/588405473.db2.gz BJJQEYQUQDHTFB-SCZZXKLOSA-N 1 2 221.304 2.394 20 0 BEADLO c1cc2c(cn1)CN(c1cc[nH+]c(C3CC3)n1)C2 ZINC000848727207 588408823 /nfs/dbraw/zinc/40/88/23/588408823.db2.gz UCHJAUAPVIWQEQ-UHFFFAOYSA-N 1 2 238.294 2.269 20 0 BEADLO COC(=O)C[N@H+](C)Cc1ccccc1C(C)C ZINC000848882024 588415873 /nfs/dbraw/zinc/41/58/73/588415873.db2.gz VWJBDNVIUYAFSH-UHFFFAOYSA-N 1 2 235.327 2.415 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1ccccc1C(C)C ZINC000848882024 588415875 /nfs/dbraw/zinc/41/58/75/588415875.db2.gz VWJBDNVIUYAFSH-UHFFFAOYSA-N 1 2 235.327 2.415 20 0 BEADLO Cn1c(C[N@@H+]2CCC[C@@](C)(F)C2)cnc1Cl ZINC000848914024 588420116 /nfs/dbraw/zinc/42/01/16/588420116.db2.gz GRSSMSFLVSDZBC-LLVKDONJSA-N 1 2 245.729 2.398 20 0 BEADLO Cn1c(C[N@H+]2CCC[C@@](C)(F)C2)cnc1Cl ZINC000848914024 588420118 /nfs/dbraw/zinc/42/01/18/588420118.db2.gz GRSSMSFLVSDZBC-LLVKDONJSA-N 1 2 245.729 2.398 20 0 BEADLO CCC1(C)C[NH+](Cc2cnc(Cl)n2C)C1 ZINC000848916222 588420281 /nfs/dbraw/zinc/42/02/81/588420281.db2.gz FUQFUJJNGGGNLQ-UHFFFAOYSA-N 1 2 227.739 2.305 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[NH2+][C@H]1C=CCC1 ZINC000849322044 588472548 /nfs/dbraw/zinc/47/25/48/588472548.db2.gz GJYJFZMKQQAEKZ-NWDGAFQWSA-N 1 2 225.332 2.272 20 0 BEADLO c1ncc(CNc2c[nH+]cc3c2CCCC3)cn1 ZINC000849347233 588474527 /nfs/dbraw/zinc/47/45/27/588474527.db2.gz XZKKDDGYRLSSPX-UHFFFAOYSA-N 1 2 240.310 2.363 20 0 BEADLO CC(C)[C@@H](C)OC(=O)CCc1ccc(N)[nH+]c1 ZINC000849747398 588493172 /nfs/dbraw/zinc/49/31/72/588493172.db2.gz OJGSNJAXGOJTBF-SNVBAGLBSA-N 1 2 236.315 2.184 20 0 BEADLO CCCC[C@](C)(F)C(=O)OCCn1cc[nH+]c1 ZINC000849845615 588504285 /nfs/dbraw/zinc/50/42/85/588504285.db2.gz CZGSVXBUQAWXBM-LBPRGKRZSA-N 1 2 242.294 2.345 20 0 BEADLO Cc1cc(C[NH2+][C@H]2C[C@H](C)n3ncnc32)c(C)o1 ZINC000850352421 588537912 /nfs/dbraw/zinc/53/79/12/588537912.db2.gz VMPRYBSKDVDDEN-UFBFGSQYSA-N 1 2 246.314 2.284 20 0 BEADLO C[C@H](CCO)[NH2+]CC(F)(F)c1cccc(F)c1 ZINC000850504207 588552808 /nfs/dbraw/zinc/55/28/08/588552808.db2.gz XDIDVEGRIXZMOO-SECBINFHSA-N 1 2 247.260 2.278 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@@H]1CCCC2(CC2)C1 ZINC000850869537 588572267 /nfs/dbraw/zinc/57/22/67/588572267.db2.gz XHBPJQCSNCBNHR-LLVKDONJSA-N 1 2 248.326 2.434 20 0 BEADLO O=C(Nc1cc[nH+]cc1O)c1ccnc(Cl)c1 ZINC000109889524 588600534 /nfs/dbraw/zinc/60/05/34/588600534.db2.gz IJMPKBBNTIQZKT-UHFFFAOYSA-N 1 2 249.657 2.088 20 0 BEADLO O=C(Nc1cc[nH+]cc1O)c1ccc(Cl)nc1 ZINC000109889917 588600603 /nfs/dbraw/zinc/60/06/03/588600603.db2.gz SAJWCVMQTRCEOS-UHFFFAOYSA-N 1 2 249.657 2.088 20 0 BEADLO CC[N@@H+]1CCCC[C@@H]1C(=O)OCC(F)(F)CC ZINC000851492150 588608048 /nfs/dbraw/zinc/60/80/48/588608048.db2.gz VGYKGRYWSGGPJB-SNVBAGLBSA-N 1 2 249.301 2.449 20 0 BEADLO CC[N@H+]1CCCC[C@@H]1C(=O)OCC(F)(F)CC ZINC000851492150 588608049 /nfs/dbraw/zinc/60/80/49/588608049.db2.gz VGYKGRYWSGGPJB-SNVBAGLBSA-N 1 2 249.301 2.449 20 0 BEADLO C[N@H+](Cc1ccco1)Cc1cccc(F)n1 ZINC000851713055 588615794 /nfs/dbraw/zinc/61/57/94/588615794.db2.gz XYRVPEZHMUPLKZ-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO C[N@@H+](Cc1ccco1)Cc1cccc(F)n1 ZINC000851713055 588615795 /nfs/dbraw/zinc/61/57/95/588615795.db2.gz XYRVPEZHMUPLKZ-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO C[C@@H]1c2ccsc2CC[N@H+]1Cc1cnon1 ZINC000851717773 588616411 /nfs/dbraw/zinc/61/64/11/588616411.db2.gz OYFYNJNPJPPHRF-MRVPVSSYSA-N 1 2 235.312 2.250 20 0 BEADLO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1cnon1 ZINC000851717773 588616412 /nfs/dbraw/zinc/61/64/12/588616412.db2.gz OYFYNJNPJPPHRF-MRVPVSSYSA-N 1 2 235.312 2.250 20 0 BEADLO C[N@H+](Cc1cnon1)Cc1ccc(Cl)cc1 ZINC000851722788 588617796 /nfs/dbraw/zinc/61/77/96/588617796.db2.gz QFOMZCGVDCYDMX-UHFFFAOYSA-N 1 2 237.690 2.355 20 0 BEADLO C[N@@H+](Cc1cnon1)Cc1ccc(Cl)cc1 ZINC000851722788 588617797 /nfs/dbraw/zinc/61/77/97/588617797.db2.gz QFOMZCGVDCYDMX-UHFFFAOYSA-N 1 2 237.690 2.355 20 0 BEADLO CCC[N@H+](CC(F)F)C[C@H]1COC(C)(C)O1 ZINC000851744909 588621923 /nfs/dbraw/zinc/62/19/23/588621923.db2.gz ROPJMYVVMJSSOH-VIFPVBQESA-N 1 2 237.290 2.115 20 0 BEADLO CCC[N@@H+](CC(F)F)C[C@H]1COC(C)(C)O1 ZINC000851744909 588621924 /nfs/dbraw/zinc/62/19/24/588621924.db2.gz ROPJMYVVMJSSOH-VIFPVBQESA-N 1 2 237.290 2.115 20 0 BEADLO CC(C)c1nc(NC[C@@H](O)c2ccco2)cc[nH+]1 ZINC000110199390 588624070 /nfs/dbraw/zinc/62/40/70/588624070.db2.gz NPPLJTWKERTKLU-SNVBAGLBSA-N 1 2 247.298 2.339 20 0 BEADLO CC[N@H+](Cc1cnon1)[C@@H](C)c1cccc(O)c1 ZINC000851801320 588630564 /nfs/dbraw/zinc/63/05/64/588630564.db2.gz GTTPCHUDEZMTGK-JTQLQIEISA-N 1 2 247.298 2.358 20 0 BEADLO CC[N@@H+](Cc1cnon1)[C@@H](C)c1cccc(O)c1 ZINC000851801320 588630565 /nfs/dbraw/zinc/63/05/65/588630565.db2.gz GTTPCHUDEZMTGK-JTQLQIEISA-N 1 2 247.298 2.358 20 0 BEADLO CC(C)[N@H+](CCOC(F)F)CC(F)F ZINC000851817575 588633209 /nfs/dbraw/zinc/63/32/09/588633209.db2.gz GQIGLSPUVONRKT-UHFFFAOYSA-N 1 2 217.206 2.201 20 0 BEADLO CC(C)[N@@H+](CCOC(F)F)CC(F)F ZINC000851817575 588633210 /nfs/dbraw/zinc/63/32/10/588633210.db2.gz GQIGLSPUVONRKT-UHFFFAOYSA-N 1 2 217.206 2.201 20 0 BEADLO Cc1cccnc1[C@@H]([NH2+]Cc1cnon1)C(C)C ZINC000851844289 588634521 /nfs/dbraw/zinc/63/45/21/588634521.db2.gz UHQATEHTVPPEGN-LBPRGKRZSA-N 1 2 246.314 2.260 20 0 BEADLO CCc1nocc1C[NH+]1CC(C(F)(F)F)C1 ZINC000851857727 588635824 /nfs/dbraw/zinc/63/58/24/588635824.db2.gz XJBGSCBPTDLXOW-UHFFFAOYSA-N 1 2 234.221 2.231 20 0 BEADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1cnon1 ZINC000851893505 588641402 /nfs/dbraw/zinc/64/14/02/588641402.db2.gz LBJWCRGTVOJHEX-SNVBAGLBSA-N 1 2 247.298 2.237 20 0 BEADLO Cc1c(C[N@H+](C)CC=C(Cl)Cl)cnn1C ZINC000851996903 588651708 /nfs/dbraw/zinc/65/17/08/588651708.db2.gz FDRACWSRNCREDD-UHFFFAOYSA-N 1 2 248.157 2.479 20 0 BEADLO Cc1c(C[N@@H+](C)CC=C(Cl)Cl)cnn1C ZINC000851996903 588651709 /nfs/dbraw/zinc/65/17/09/588651709.db2.gz FDRACWSRNCREDD-UHFFFAOYSA-N 1 2 248.157 2.479 20 0 BEADLO Cl/C=C(/Cl)C[N@@H+]1CCn2cncc2C1 ZINC000852067216 588658777 /nfs/dbraw/zinc/65/87/77/588658777.db2.gz WSUQGXOQQNUCEO-FPYGCLRLSA-N 1 2 232.114 2.018 20 0 BEADLO Cl/C=C(/Cl)C[N@H+]1CCn2cncc2C1 ZINC000852067216 588658778 /nfs/dbraw/zinc/65/87/78/588658778.db2.gz WSUQGXOQQNUCEO-FPYGCLRLSA-N 1 2 232.114 2.018 20 0 BEADLO O[C@@]1(C(F)F)CC[N@H+](CC=C(Cl)Cl)C1 ZINC000852121407 588665170 /nfs/dbraw/zinc/66/51/70/588665170.db2.gz QJRFJNHNZUSMQW-QMMMGPOBSA-N 1 2 246.084 2.007 20 0 BEADLO O[C@@]1(C(F)F)CC[N@@H+](CC=C(Cl)Cl)C1 ZINC000852121407 588665171 /nfs/dbraw/zinc/66/51/71/588665171.db2.gz QJRFJNHNZUSMQW-QMMMGPOBSA-N 1 2 246.084 2.007 20 0 BEADLO CC[N@H+](CCC(C)=O)[C@H](C)C(=O)OC(C)(C)C ZINC000852307037 588677316 /nfs/dbraw/zinc/67/73/16/588677316.db2.gz UCZRYTZZBGWQPY-LLVKDONJSA-N 1 2 243.347 2.018 20 0 BEADLO CC[N@@H+](CCC(C)=O)[C@H](C)C(=O)OC(C)(C)C ZINC000852307037 588677317 /nfs/dbraw/zinc/67/73/17/588677317.db2.gz UCZRYTZZBGWQPY-LLVKDONJSA-N 1 2 243.347 2.018 20 0 BEADLO CCCCCC[N@@H+]1CC[C@H](O)C(F)(F)C1 ZINC000852411761 588681445 /nfs/dbraw/zinc/68/14/45/588681445.db2.gz HSRNNIRUEUBVIC-JTQLQIEISA-N 1 2 221.291 2.269 20 0 BEADLO CCCCCC[N@H+]1CC[C@H](O)C(F)(F)C1 ZINC000852411761 588681446 /nfs/dbraw/zinc/68/14/46/588681446.db2.gz HSRNNIRUEUBVIC-JTQLQIEISA-N 1 2 221.291 2.269 20 0 BEADLO Oc1ccc2c(c1)C[N@@H+](C/C=C/Cl)CCO2 ZINC000852689892 588696163 /nfs/dbraw/zinc/69/61/63/588696163.db2.gz LPBMOEMQKVAUQL-DAFODLJHSA-N 1 2 239.702 2.339 20 0 BEADLO Oc1ccc2c(c1)C[N@H+](C/C=C/Cl)CCO2 ZINC000852689892 588696164 /nfs/dbraw/zinc/69/61/64/588696164.db2.gz LPBMOEMQKVAUQL-DAFODLJHSA-N 1 2 239.702 2.339 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@@H]1CCCC12CC2 ZINC000860576431 589107216 /nfs/dbraw/zinc/10/72/16/589107216.db2.gz TUWWCZTZGBIOQS-NSHDSACASA-N 1 2 234.299 2.044 20 0 BEADLO C[C@H]1SCC[N@H+](Cn2cc(Cl)cn2)[C@H]1C ZINC000118382478 589169387 /nfs/dbraw/zinc/16/93/87/589169387.db2.gz WQKZQIYAPQGZGQ-DTWKUNHWSA-N 1 2 245.779 2.320 20 0 BEADLO C[C@H]1SCC[N@@H+](Cn2cc(Cl)cn2)[C@H]1C ZINC000118382478 589169389 /nfs/dbraw/zinc/16/93/89/589169389.db2.gz WQKZQIYAPQGZGQ-DTWKUNHWSA-N 1 2 245.779 2.320 20 0 BEADLO O=C(C(F)=C1CCCC1)N1CCc2[nH]c[nH+]c2C1 ZINC000861760694 589177288 /nfs/dbraw/zinc/17/72/88/589177288.db2.gz MFVVTRUKWXWYBQ-UHFFFAOYSA-N 1 2 249.289 2.092 20 0 BEADLO O=C(C(F)=C1CCCC1)N1CCc2[nH+]c[nH]c2C1 ZINC000861760694 589177289 /nfs/dbraw/zinc/17/72/89/589177289.db2.gz MFVVTRUKWXWYBQ-UHFFFAOYSA-N 1 2 249.289 2.092 20 0 BEADLO O=C(N[C@@H]1CCn2cc[nH+]c21)[C@@H]1CCCC12CC2 ZINC000861854159 589180885 /nfs/dbraw/zinc/18/08/85/589180885.db2.gz KRDLUUJARYJPPK-WDEREUQCSA-N 1 2 245.326 2.024 20 0 BEADLO Cc1ncc(CN2CCC[C@H]2c2[nH]cc[nH+]2)o1 ZINC000862326975 589201032 /nfs/dbraw/zinc/20/10/32/589201032.db2.gz WFYFFAKUXWPIPD-NSHDSACASA-N 1 2 232.287 2.043 20 0 BEADLO C[C@H]1C[C@H]1CO[NH+]=C(N)c1ccc(F)c(F)c1 ZINC000863456566 589289503 /nfs/dbraw/zinc/28/95/03/589289503.db2.gz VOZXLVXVOMKDMU-CBAPKCEASA-N 1 2 240.253 2.467 20 0 BEADLO COC1CC(O[NH+]=C(N)Cc2ccccc2C)C1 ZINC000863459693 589290047 /nfs/dbraw/zinc/29/00/47/589290047.db2.gz XYBGMSFUYVIGBO-UHFFFAOYSA-N 1 2 248.326 2.213 20 0 BEADLO COC1(C(N)=[NH+]OC[C@H]2C[C@H]2C)CCCC1 ZINC000863477519 589291966 /nfs/dbraw/zinc/29/19/66/589291966.db2.gz NSHLVYVJWTUQFY-NXEZZACHSA-N 1 2 226.320 2.100 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)Nc1nnc(C(C)(C)C)o1 ZINC000863980181 589332383 /nfs/dbraw/zinc/33/23/83/589332383.db2.gz DDNHLZXKNMFQQS-VIFPVBQESA-N 1 2 249.318 2.064 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)Nc1nnc(C(C)(C)C)o1 ZINC000863980180 589332582 /nfs/dbraw/zinc/33/25/82/589332582.db2.gz DDNHLZXKNMFQQS-SECBINFHSA-N 1 2 249.318 2.064 20 0 BEADLO CC(C)(C)c1nnc(NCCCn2cc[nH+]c2)o1 ZINC000863981231 589332862 /nfs/dbraw/zinc/33/28/62/589332862.db2.gz XDXJGFZGRQSOJM-UHFFFAOYSA-N 1 2 249.318 2.066 20 0 BEADLO Cc1cn(C(C)(C)C(=O)NCC2CC(C)C2)c[nH+]1 ZINC000864071426 589339039 /nfs/dbraw/zinc/33/90/39/589339039.db2.gz BMLVTIIAEILGBR-UHFFFAOYSA-N 1 2 249.358 2.089 20 0 BEADLO C[C@H](NC(=O)Cc1c[nH]c[nH+]1)[C@@]12C[C@@H]1CCCC2 ZINC000864081108 589341694 /nfs/dbraw/zinc/34/16/94/589341694.db2.gz RONOLNZSUCAQHF-COPLHBTASA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H](NC(=O)Cc1c[nH+]c[nH]1)[C@@]12C[C@@H]1CCCC2 ZINC000864081108 589341696 /nfs/dbraw/zinc/34/16/96/589341696.db2.gz RONOLNZSUCAQHF-COPLHBTASA-N 1 2 247.342 2.037 20 0 BEADLO C[C@@H](O)c1ccc(N2CCC(C)(F)CC2)[nH+]c1 ZINC000864089108 589343107 /nfs/dbraw/zinc/34/31/07/589343107.db2.gz LSAWLDUMDWQLRG-SNVBAGLBSA-N 1 2 238.306 2.463 20 0 BEADLO C[C@H](O)c1cccc(N[C@@H]2COC(C)(C)C2)[nH+]1 ZINC000864090192 589343262 /nfs/dbraw/zinc/34/32/62/589343262.db2.gz BQYOLRMKNPSPAD-UWVGGRQHSA-N 1 2 236.315 2.114 20 0 BEADLO Cc1ccc([N@H+](C)CC[C@@H]2CCOC2=O)cc1 ZINC000120376801 589408457 /nfs/dbraw/zinc/40/84/57/589408457.db2.gz UDDYXUUKJDUERA-GFCCVEGCSA-N 1 2 233.311 2.384 20 0 BEADLO Cc1ccc([N@@H+](C)CC[C@@H]2CCOC2=O)cc1 ZINC000120376801 589408458 /nfs/dbraw/zinc/40/84/58/589408458.db2.gz UDDYXUUKJDUERA-GFCCVEGCSA-N 1 2 233.311 2.384 20 0 BEADLO Cc1cc(=O)[nH]c(C=Cc2cn(C3CC3)c[nH+]2)n1 ZINC000865225147 589414686 /nfs/dbraw/zinc/41/46/86/589414686.db2.gz ZAAGULIZBBSYPL-DJWKRKHSSA-N 1 2 242.282 2.192 20 0 BEADLO C(=C/c1ccncn1)\c1cn(C2CC2)c[nH+]1 ZINC000865222112 589414838 /nfs/dbraw/zinc/41/48/38/589414838.db2.gz OPMOVOGOHXSJJE-OWOJBTEDSA-N 1 2 212.256 2.178 20 0 BEADLO COc1cncc(NCc2[nH+]ccn2C(C)C)c1 ZINC000865294309 589420420 /nfs/dbraw/zinc/42/04/20/589420420.db2.gz HFBDGLBVSPGMFH-UHFFFAOYSA-N 1 2 246.314 2.480 20 0 BEADLO CC(C)(C)c1cn(CCn2cccn2)c[nH+]1 ZINC000865375950 589428058 /nfs/dbraw/zinc/42/80/58/589428058.db2.gz RSMOFFAZUMTVEB-UHFFFAOYSA-N 1 2 218.304 2.077 20 0 BEADLO Cc1cc(Cn2c[nH+]c(C(C)(C)C)c2)nn1C ZINC000865376239 589428175 /nfs/dbraw/zinc/42/81/75/589428175.db2.gz FVXRESPRWWTHNK-UHFFFAOYSA-N 1 2 232.331 2.271 20 0 BEADLO COC(=O)CCCn1c[nH+]c(C(C)(C)C)c1 ZINC000865375929 589428445 /nfs/dbraw/zinc/42/84/45/589428445.db2.gz REHOLVMAXRKXBE-UHFFFAOYSA-N 1 2 224.304 2.134 20 0 BEADLO CCn1nc(C)c(Cn2c[nH+]c(C(C)(C)C)c2)n1 ZINC000865376236 589428452 /nfs/dbraw/zinc/42/84/52/589428452.db2.gz FSTGKJNWIODGCB-UHFFFAOYSA-N 1 2 247.346 2.149 20 0 BEADLO COc1ccc(Cn2c[nH+]c(C(C)(C)C)c2)nn1 ZINC000865376557 589428720 /nfs/dbraw/zinc/42/87/20/589428720.db2.gz SZMSSVFBDDGZSK-UHFFFAOYSA-N 1 2 246.314 2.028 20 0 BEADLO Cc1nccnc1Cn1c[nH+]c(C(C)(C)C)c1 ZINC000865376697 589428760 /nfs/dbraw/zinc/42/87/60/589428760.db2.gz ZJGBBKQDUZOONX-UHFFFAOYSA-N 1 2 230.315 2.327 20 0 BEADLO C[C@H]([NH2+]Cc1cn(C2CC2)cn1)c1ccccn1 ZINC000865400849 589432294 /nfs/dbraw/zinc/43/22/94/589432294.db2.gz AGGSDOGHCBISFO-NSHDSACASA-N 1 2 242.326 2.464 20 0 BEADLO C[C@@H](Nc1[nH+]cnc2[nH]c(Cl)cc21)C1CC1 ZINC000865415424 589434291 /nfs/dbraw/zinc/43/42/91/589434291.db2.gz MUGJAFSLCVTJIS-ZCFIWIBFSA-N 1 2 236.706 2.244 20 0 BEADLO c1cc(C[NH2+]Cc2cn(C3CC3)cn2)co1 ZINC000865428404 589435577 /nfs/dbraw/zinc/43/55/77/589435577.db2.gz UBSNDONALCLFHF-UHFFFAOYSA-N 1 2 217.272 2.101 20 0 BEADLO CN(C)c1ccc(F)cc1C[NH2+]Cc1cocn1 ZINC000865455489 589437085 /nfs/dbraw/zinc/43/70/85/589437085.db2.gz AICNECAYEWQTMT-UHFFFAOYSA-N 1 2 249.289 2.170 20 0 BEADLO COC[C@@H](C)CNc1cc(CC(C)C)[nH+]cn1 ZINC000865469652 589438639 /nfs/dbraw/zinc/43/86/39/589438639.db2.gz RHUTVIOKLMKOIQ-NSHDSACASA-N 1 2 237.347 2.370 20 0 BEADLO CCCN(C)c1[nH+]cnc2[nH]c(Cl)cc21 ZINC000865480035 589439977 /nfs/dbraw/zinc/43/99/77/589439977.db2.gz UPBBQFNLQMDCHW-UHFFFAOYSA-N 1 2 224.695 2.409 20 0 BEADLO COc1cc[nH+]cc1NCc1cn(C2CC2)cn1 ZINC000865506120 589441561 /nfs/dbraw/zinc/44/15/61/589441561.db2.gz OYYRSIJBGIIUTO-UHFFFAOYSA-N 1 2 244.298 2.234 20 0 BEADLO Fc1ccc(NCc2cn(C3CC3)c[nH+]2)cn1 ZINC000865505176 589441792 /nfs/dbraw/zinc/44/17/92/589441792.db2.gz AVBLNROSGIRXLE-UHFFFAOYSA-N 1 2 232.262 2.364 20 0 BEADLO CCCCc1cc(N[C@@H](CO)C2CC2)nc[nH+]1 ZINC000865540696 589444868 /nfs/dbraw/zinc/44/48/68/589444868.db2.gz WPUZMBCZCXBAQD-LBPRGKRZSA-N 1 2 235.331 2.002 20 0 BEADLO CC(C)Cc1cc(NC[C@@H](O)C(C)C)nc[nH+]1 ZINC000865552303 589446019 /nfs/dbraw/zinc/44/60/19/589446019.db2.gz FQJORDJPCWAHHH-GFCCVEGCSA-N 1 2 237.347 2.104 20 0 BEADLO C[C@@H](NCc1cn(C2CC2)c[nH+]1)C(F)(F)F ZINC000865569141 589447354 /nfs/dbraw/zinc/44/73/54/589447354.db2.gz GTHZYBWJUNHQEF-SSDOTTSWSA-N 1 2 233.237 2.258 20 0 BEADLO C[C@H]1CCCN1c1nc(N)[nH+]c(C2CCCC2)n1 ZINC000865570763 589447821 /nfs/dbraw/zinc/44/78/21/589447821.db2.gz CCOLNUMCYQKDEP-VIFPVBQESA-N 1 2 247.346 2.100 20 0 BEADLO C[C@H]1CCCN1c1nc(N)nc(C2CCCC2)[nH+]1 ZINC000865570763 589447822 /nfs/dbraw/zinc/44/78/22/589447822.db2.gz CCOLNUMCYQKDEP-VIFPVBQESA-N 1 2 247.346 2.100 20 0 BEADLO Cc1nc(N2CCC(CC(C)C)CC2)nc(N)[nH+]1 ZINC000865613923 589451739 /nfs/dbraw/zinc/45/17/39/589451739.db2.gz XGPKMOPHPZQINJ-UHFFFAOYSA-N 1 2 249.362 2.025 20 0 BEADLO Cc1nc(N)nc(N2CCC(CC(C)C)CC2)[nH+]1 ZINC000865613923 589451741 /nfs/dbraw/zinc/45/17/41/589451741.db2.gz XGPKMOPHPZQINJ-UHFFFAOYSA-N 1 2 249.362 2.025 20 0 BEADLO CCn1ccc(NCc2cn(C3CC3)c[nH+]2)n1 ZINC000865624828 589451932 /nfs/dbraw/zinc/45/19/32/589451932.db2.gz QWLTYMUWJTZBHP-UHFFFAOYSA-N 1 2 231.303 2.047 20 0 BEADLO COc1ccc(NCc2[nH]cc(C)[nH+]2)c(F)c1 ZINC000865661930 589455051 /nfs/dbraw/zinc/45/50/51/589455051.db2.gz HFSCHOFTSHXWHQ-UHFFFAOYSA-N 1 2 235.262 2.478 20 0 BEADLO CCCNc1cc(NC[C@@H]2CCC=CO2)nc[nH+]1 ZINC000865708843 589457711 /nfs/dbraw/zinc/45/77/11/589457711.db2.gz BZZUIJYLQZUYFT-NSHDSACASA-N 1 2 248.330 2.403 20 0 BEADLO CCCNc1cc(NC[C@@H]2CCC=CO2)[nH+]cn1 ZINC000865708843 589457712 /nfs/dbraw/zinc/45/77/12/589457712.db2.gz BZZUIJYLQZUYFT-NSHDSACASA-N 1 2 248.330 2.403 20 0 BEADLO COCc1cc(NCc2[nH]cc[nH+]2)ccc1OC ZINC000865751275 589460730 /nfs/dbraw/zinc/46/07/30/589460730.db2.gz JRVVBKZUSOJTOX-UHFFFAOYSA-N 1 2 247.298 2.177 20 0 BEADLO CCCNc1cc(N2CCC[C@@H]3C[C@@H]32)nc[nH+]1 ZINC000865793325 589462073 /nfs/dbraw/zinc/46/20/73/589462073.db2.gz FFXGNHNTUAPTJU-MNOVXSKESA-N 1 2 232.331 2.287 20 0 BEADLO CCCNc1cc(N2CCC[C@@H]3C[C@@H]32)[nH+]cn1 ZINC000865793325 589462074 /nfs/dbraw/zinc/46/20/74/589462074.db2.gz FFXGNHNTUAPTJU-MNOVXSKESA-N 1 2 232.331 2.287 20 0 BEADLO CCCNc1cc(N[C@H](C)[C@H](C)OC)nc[nH+]1 ZINC000865819873 589463194 /nfs/dbraw/zinc/46/31/94/589463194.db2.gz YEQNLVQJGZULQY-ZJUUUORDSA-N 1 2 238.335 2.134 20 0 BEADLO CCCNc1cc(N[C@H](C)[C@H](C)OC)[nH+]cn1 ZINC000865819873 589463195 /nfs/dbraw/zinc/46/31/95/589463195.db2.gz YEQNLVQJGZULQY-ZJUUUORDSA-N 1 2 238.335 2.134 20 0 BEADLO CCc1ncc(CNc2ccc([C@@H](C)O)c[nH+]2)o1 ZINC000865860912 589465497 /nfs/dbraw/zinc/46/54/97/589465497.db2.gz ZEYCGDOFOBXHQR-SECBINFHSA-N 1 2 247.298 2.297 20 0 BEADLO CCO[C@H]1C[C@@H](Nc2ccc([C@@H](C)O)c[nH+]2)C1 ZINC000865869477 589466007 /nfs/dbraw/zinc/46/60/07/589466007.db2.gz HKEJPCOOJOJLNP-JLLWLGSASA-N 1 2 236.315 2.114 20 0 BEADLO CC[C@H](C)COC(=O)[C@H](C)[NH+]1CCSCC1 ZINC000120794673 589466308 /nfs/dbraw/zinc/46/63/08/589466308.db2.gz YFFONYYRGBQAIV-QWRGUYRKSA-N 1 2 245.388 2.013 20 0 BEADLO COCC[C@@H](C)CNc1ccc([C@@H](C)O)c[nH+]1 ZINC000865874326 589466624 /nfs/dbraw/zinc/46/66/24/589466624.db2.gz BPOJYQXYBIPDRD-GHMZBOCLSA-N 1 2 238.331 2.219 20 0 BEADLO Nc1[nH+]cnc(N[C@@H]2CCCC[C@@H]2F)c1Cl ZINC000866045545 589473823 /nfs/dbraw/zinc/47/38/23/589473823.db2.gz JXNKJJOOGVGOCT-NKWVEPMBSA-N 1 2 244.701 2.405 20 0 BEADLO Nc1nc[nH+]c(N[C@@H]2CCCC[C@@H]2F)c1Cl ZINC000866045545 589473824 /nfs/dbraw/zinc/47/38/24/589473824.db2.gz JXNKJJOOGVGOCT-NKWVEPMBSA-N 1 2 244.701 2.405 20 0 BEADLO CO[C@H]1CC[C@H](C)N(c2cc[nH+]c(C3CC3)n2)C1 ZINC000866069663 589474534 /nfs/dbraw/zinc/47/45/34/589474534.db2.gz FRJWSABXKHZELM-JQWIXIFHSA-N 1 2 247.342 2.358 20 0 BEADLO CC[C@]1(O)CCCN(c2cc[nH+]c(C(C)C)n2)C1 ZINC000866067950 589474542 /nfs/dbraw/zinc/47/45/42/589474542.db2.gz ZSBSPFFXGRGPFM-AWEZNQCLSA-N 1 2 249.358 2.341 20 0 BEADLO CO[C@H]1CC[C@H](C)N(c2cccc[nH+]2)C1 ZINC000866070646 589474823 /nfs/dbraw/zinc/47/48/23/589474823.db2.gz ZZWBOAYONXMERK-QWRGUYRKSA-N 1 2 206.289 2.085 20 0 BEADLO COc1c(C)[nH+]cnc1N1C[C@@H]2CC=CC[C@@H]2C1 ZINC000866162241 589478379 /nfs/dbraw/zinc/47/83/79/589478379.db2.gz QJEGZEMRIGQYBK-TXEJJXNPSA-N 1 2 245.326 2.196 20 0 BEADLO C[C@@H](O)c1ccc(N[C@@H](C)c2ccnn2C)[nH+]c1 ZINC000866253408 589483222 /nfs/dbraw/zinc/48/32/22/589483222.db2.gz YIJQLHBECNTHQL-VHSXEESVSA-N 1 2 246.314 2.042 20 0 BEADLO CCc1cc(N[C@@H]2C[C@H]2C2CCOCC2)nc[nH+]1 ZINC000866272923 589483834 /nfs/dbraw/zinc/48/38/34/589483834.db2.gz YEANAZNULIXPLK-QWHCGFSZSA-N 1 2 247.342 2.266 20 0 BEADLO CC[C@H](C[C@H](C)O)Nc1cc[nH+]c2ccncc12 ZINC000866300856 589484818 /nfs/dbraw/zinc/48/48/18/589484818.db2.gz YGCBHMQWMFFGJU-WDEREUQCSA-N 1 2 245.326 2.013 20 0 BEADLO CC[C@H](C[C@H](C)O)Nc1cc[nH+]c(C2CC2)n1 ZINC000866299379 589484861 /nfs/dbraw/zinc/48/48/61/589484861.db2.gz JRBSIXNSUWSGCM-GXSJLCMTSA-N 1 2 235.331 2.315 20 0 BEADLO O[C@@H](CCNc1cccc[nH+]1)C1CCCC1 ZINC000866303937 589485309 /nfs/dbraw/zinc/48/53/09/589485309.db2.gz RNUCURILOGXDIC-LBPRGKRZSA-N 1 2 220.316 2.435 20 0 BEADLO CC(C)(F)C[NH2+][C@@H]1CCCc2[nH]ncc21 ZINC000866409405 589490877 /nfs/dbraw/zinc/49/08/77/589490877.db2.gz LIMMQAYAQVTOHX-SECBINFHSA-N 1 2 211.284 2.125 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2ccnc(F)c2)nn1C ZINC000866475382 589495464 /nfs/dbraw/zinc/49/54/64/589495464.db2.gz XQCUVSCFLBCUOB-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO COCc1cc([NH2+][C@@H](C)CCO)ccc1OC ZINC000866499665 589497655 /nfs/dbraw/zinc/49/76/55/589497655.db2.gz OQRCWHLURVGJJC-JTQLQIEISA-N 1 2 239.315 2.024 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@]12C[C@H]1CCCC2 ZINC000868662512 589571504 /nfs/dbraw/zinc/57/15/04/589571504.db2.gz PHLQFQILYBRLSZ-BXUZGUMPSA-N 1 2 247.342 2.100 20 0 BEADLO CC/C=C(\F)C(=O)N[C@H](C)c1[nH+]ccn1CC ZINC000868679872 589572748 /nfs/dbraw/zinc/57/27/48/589572748.db2.gz YIGHLMGLJBHKKB-WPVMNKCKSA-N 1 2 239.294 2.344 20 0 BEADLO CC/C=C(/F)C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000868730873 589574871 /nfs/dbraw/zinc/57/48/71/589574871.db2.gz BBAHUKZOZYSLPX-VMPITWQZSA-N 1 2 225.267 2.024 20 0 BEADLO Cn1cc[nH+]c1CNc1ccnc(Cl)c1 ZINC000122668029 589614583 /nfs/dbraw/zinc/61/45/83/589614583.db2.gz AOHQRVGQTOPCOC-UHFFFAOYSA-N 1 2 222.679 2.081 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)[C@@]12C[C@@H]1CCCC2 ZINC000869704217 589623786 /nfs/dbraw/zinc/62/37/86/589623786.db2.gz PDDLYNIESFVIIX-FZMZJTMJSA-N 1 2 248.326 2.086 20 0 BEADLO CC(C)CCOC(=O)[C@H](C)[NH+]1CCSCC1 ZINC000122903103 589643351 /nfs/dbraw/zinc/64/33/51/589643351.db2.gz DAMGJIRSEPBPJS-NSHDSACASA-N 1 2 245.388 2.013 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@@H]1C[C@H]1C(C)(C)C ZINC000870219620 589650225 /nfs/dbraw/zinc/65/02/25/589650225.db2.gz CCXLKLXHLUTPPV-GHMZBOCLSA-N 1 2 236.315 2.146 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)NCC1CCC2(CC2)CC1 ZINC000871019097 589712871 /nfs/dbraw/zinc/71/28/71/589712871.db2.gz OZMSZAVPNQQYMS-UHFFFAOYSA-N 1 2 247.342 2.039 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OC[C@@H]1CCO[C@H]1C ZINC000871719479 589798155 /nfs/dbraw/zinc/79/81/55/589798155.db2.gz WXNUZRAPMPRWJA-RYUDHWBXSA-N 1 2 248.326 2.267 20 0 BEADLO CC(C)OCC(N)=[NH+]OCCCC1CC1 ZINC000871727581 589799897 /nfs/dbraw/zinc/79/98/97/589799897.db2.gz JZZSGOLUWYMDNE-UHFFFAOYSA-N 1 2 214.309 2.100 20 0 BEADLO C[C@@H](CO[NH+]=C(N)[C@@H]1CCCO1)C(C)(C)C ZINC000871748648 589804439 /nfs/dbraw/zinc/80/44/39/589804439.db2.gz MJXATRXVUCNAPO-UWVGGRQHSA-N 1 2 228.336 2.346 20 0 BEADLO NC(COC1CCC1)=[NH+]OCC1CCCC1 ZINC000871774365 589812801 /nfs/dbraw/zinc/81/28/01/589812801.db2.gz BZGWQSHPVKMGOS-UHFFFAOYSA-N 1 2 226.320 2.244 20 0 BEADLO NC(COC1CCC1)=[NH+]OCCCC1CC1 ZINC000871778336 589814240 /nfs/dbraw/zinc/81/42/40/589814240.db2.gz DFSQHCOYIVXRRB-UHFFFAOYSA-N 1 2 226.320 2.244 20 0 BEADLO C[C@@H]([NH2+]Cc1nccn1C)c1cccc(O)c1F ZINC000872031227 589857381 /nfs/dbraw/zinc/85/73/81/589857381.db2.gz IBPDESNSGKLVDL-SECBINFHSA-N 1 2 249.289 2.116 20 0 BEADLO C[C@@H](NCc1[nH+]ccn1C)c1cccc(O)c1F ZINC000872031227 589857384 /nfs/dbraw/zinc/85/73/84/589857384.db2.gz IBPDESNSGKLVDL-SECBINFHSA-N 1 2 249.289 2.116 20 0 BEADLO C[C@@H]([NH2+]Cc1cc[nH]n1)c1cccc(O)c1F ZINC000872035763 589858224 /nfs/dbraw/zinc/85/82/24/589858224.db2.gz YQNVXCASCWSTPX-MRVPVSSYSA-N 1 2 235.262 2.105 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@@H]1CC(C)(C)CO1 ZINC000872107683 589873474 /nfs/dbraw/zinc/87/34/74/589873474.db2.gz QSPDOJVSQOYCMX-ONGXEEELSA-N 1 2 237.347 2.184 20 0 BEADLO CC(=O)C1CCN(c2nc(C)[nH+]c(C)c2C)CC1 ZINC000872668552 589960275 /nfs/dbraw/zinc/96/02/75/589960275.db2.gz ORKAASSPINELQC-UHFFFAOYSA-N 1 2 247.342 2.207 20 0 BEADLO CC1(F)CC[NH+](Cn2cc(Cl)cn2)CC1 ZINC000872691055 589961917 /nfs/dbraw/zinc/96/19/17/589961917.db2.gz VRCCNTVKWZXUOO-UHFFFAOYSA-N 1 2 231.702 2.318 20 0 BEADLO CCc1cc(NC[C@@H]2C[C@H]3CCC[C@H]3O2)nc[nH+]1 ZINC000872696308 589962541 /nfs/dbraw/zinc/96/25/41/589962541.db2.gz PXCKMARFVHLHIF-KGYLQXTDSA-N 1 2 247.342 2.409 20 0 BEADLO Cc1nc(NC[C@@H]2C[C@@H]3CCC[C@H]3O2)cc[nH+]1 ZINC000872699771 589963102 /nfs/dbraw/zinc/96/31/02/589963102.db2.gz UAKZJNHUJQWKQJ-SDDRHHMPSA-N 1 2 233.315 2.155 20 0 BEADLO Cc1cc[nH+]c(NC[C@H]2C[C@H](O)C2)c1Cl ZINC000872719536 589964837 /nfs/dbraw/zinc/96/48/37/589964837.db2.gz ZSIYYRUDKHNRTF-KYZUINATSA-N 1 2 226.707 2.226 20 0 BEADLO Cc1cc(N[C@@H](C)c2nccnc2C)nc[nH+]1 ZINC000872767684 589966851 /nfs/dbraw/zinc/96/68/51/589966851.db2.gz CBHYWCBZIYGGDN-JTQLQIEISA-N 1 2 229.287 2.057 20 0 BEADLO CCn1c[nH+]cc1CNc1cnn(CC)c1C ZINC000873197007 589992338 /nfs/dbraw/zinc/99/23/38/589992338.db2.gz WDOFYORPKGVFDG-UHFFFAOYSA-N 1 2 233.319 2.040 20 0 BEADLO CCC[C@@H](CC)C(=O)NC1=[NH+]CCS1 ZINC000873837873 590073616 /nfs/dbraw/zinc/07/36/16/590073616.db2.gz JTGIVGMXMJYFHP-MRVPVSSYSA-N 1 2 214.334 2.032 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C1(OC(C)C)CCC1 ZINC000874442716 590111160 /nfs/dbraw/zinc/11/11/60/590111160.db2.gz RSUJJMZEXMQQMS-UHFFFAOYSA-N 1 2 248.326 2.098 20 0 BEADLO CSCC[C@H](C)[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000125239104 590157661 /nfs/dbraw/zinc/15/76/61/590157661.db2.gz XLXOBZWHRJQLED-UWVGGRQHSA-N 1 2 247.404 2.448 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@H]1CCCC2(CC2)C1 ZINC000888695939 590186147 /nfs/dbraw/zinc/18/61/47/590186147.db2.gz KILYEEOGQILFRU-NSHDSACASA-N 1 2 247.342 2.100 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@H]1CCCC2(CC2)C1 ZINC000888695939 590186149 /nfs/dbraw/zinc/18/61/49/590186149.db2.gz KILYEEOGQILFRU-NSHDSACASA-N 1 2 247.342 2.100 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N[C@@H]1CCCC2(CC2)C1 ZINC000888696843 590186168 /nfs/dbraw/zinc/18/61/68/590186168.db2.gz WZKITXFJFLANLJ-LLVKDONJSA-N 1 2 247.342 2.181 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N[C@@H]1CCCC2(CC2)C1 ZINC000888696843 590186170 /nfs/dbraw/zinc/18/61/70/590186170.db2.gz WZKITXFJFLANLJ-LLVKDONJSA-N 1 2 247.342 2.181 20 0 BEADLO CCOc1cccc(F)c1C[N@H+](C)CCOC ZINC000876565267 590216806 /nfs/dbraw/zinc/21/68/06/590216806.db2.gz SYDLEWNHTFMFNJ-UHFFFAOYSA-N 1 2 241.306 2.303 20 0 BEADLO CCOc1cccc(F)c1C[N@@H+](C)CCOC ZINC000876565267 590216808 /nfs/dbraw/zinc/21/68/08/590216808.db2.gz SYDLEWNHTFMFNJ-UHFFFAOYSA-N 1 2 241.306 2.303 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nc(Cl)cs2)CCCO1 ZINC000876685014 590230793 /nfs/dbraw/zinc/23/07/93/590230793.db2.gz WEDVEAHMMTWLAC-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nc(Cl)cs2)CCCO1 ZINC000876685014 590230794 /nfs/dbraw/zinc/23/07/94/590230794.db2.gz WEDVEAHMMTWLAC-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO COc1cnc(F)c(C[NH2+]Cc2ccco2)c1 ZINC000876887904 590254228 /nfs/dbraw/zinc/25/42/28/590254228.db2.gz JKOWHARJASPOBW-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO C[C@@H](O)C[N@@H+](C)Cc1c(Cl)cncc1Cl ZINC000877320769 590315138 /nfs/dbraw/zinc/31/51/38/590315138.db2.gz UZIOFMXOCKNXNK-SSDOTTSWSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@@H](O)C[N@H+](C)Cc1c(Cl)cncc1Cl ZINC000877320769 590315135 /nfs/dbraw/zinc/31/51/35/590315135.db2.gz UZIOFMXOCKNXNK-SSDOTTSWSA-N 1 2 249.141 2.201 20 0 BEADLO c1ncc(C[NH2+]Cc2cc(C3CC3)no2)s1 ZINC000877340827 590317562 /nfs/dbraw/zinc/31/75/62/590317562.db2.gz RAHRWRVWRSGOJC-UHFFFAOYSA-N 1 2 235.312 2.298 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@@H](C)Cc1cccc(C)c1 ZINC000877471221 590335227 /nfs/dbraw/zinc/33/52/27/590335227.db2.gz QGMIZONDVBMZLU-STQMWFEESA-N 1 2 249.354 2.467 20 0 BEADLO COc1cnc(F)c(C[N@H+]2[C@H](C)C[C@@H]2C)c1 ZINC000877488204 590339065 /nfs/dbraw/zinc/33/90/65/590339065.db2.gz ZNPMHRKWEFYHFM-DTORHVGOSA-N 1 2 224.279 2.212 20 0 BEADLO COc1cnc(F)c(C[N@@H+]2[C@H](C)C[C@@H]2C)c1 ZINC000877488204 590339068 /nfs/dbraw/zinc/33/90/68/590339068.db2.gz ZNPMHRKWEFYHFM-DTORHVGOSA-N 1 2 224.279 2.212 20 0 BEADLO Fc1ncccc1C[NH2+]Cc1cc(C2CC2)no1 ZINC000877492041 590339870 /nfs/dbraw/zinc/33/98/70/590339870.db2.gz ZYBNNYNDVNDHDM-UHFFFAOYSA-N 1 2 247.273 2.376 20 0 BEADLO C[N@H+](CCCO)Cc1c(Cl)cncc1Cl ZINC000877499836 590342010 /nfs/dbraw/zinc/34/20/10/590342010.db2.gz VDLCORQMVWUPAZ-UHFFFAOYSA-N 1 2 249.141 2.203 20 0 BEADLO C[N@@H+](CCCO)Cc1c(Cl)cncc1Cl ZINC000877499836 590342013 /nfs/dbraw/zinc/34/20/13/590342013.db2.gz VDLCORQMVWUPAZ-UHFFFAOYSA-N 1 2 249.141 2.203 20 0 BEADLO C[N@@H+](Cc1nc(Cl)cs1)[C@H]1CCCOC1 ZINC000877515699 590345544 /nfs/dbraw/zinc/34/55/44/590345544.db2.gz MJSODLOLBGAICD-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO C[N@H+](Cc1nc(Cl)cs1)[C@H]1CCCOC1 ZINC000877515699 590345541 /nfs/dbraw/zinc/34/55/41/590345541.db2.gz MJSODLOLBGAICD-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO c1cc(C[NH+]2CC3(CC3)C2)n(CC2CCC2)n1 ZINC000877556520 590357282 /nfs/dbraw/zinc/35/72/82/590357282.db2.gz UNIJPMOOQRQJND-UHFFFAOYSA-N 1 2 231.343 2.279 20 0 BEADLO ClC1(Cl)C[C@H]1C[NH+]1CC2(C1)CCCO2 ZINC000877653555 590385018 /nfs/dbraw/zinc/38/50/18/590385018.db2.gz NDMRBYFYMOHDBP-QMMMGPOBSA-N 1 2 236.142 2.045 20 0 BEADLO Cc1cc(CNc2c[nH+]cc(N(C)C)c2)no1 ZINC000877668730 590389279 /nfs/dbraw/zinc/38/92/79/590389279.db2.gz UANWOIAMKOSDCL-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO CC(C)c1ncc(C[NH2+]Cc2ncc[nH]2)s1 ZINC000877672603 590389488 /nfs/dbraw/zinc/38/94/88/590389488.db2.gz IKPKZQYSTSRRSQ-UHFFFAOYSA-N 1 2 236.344 2.279 20 0 BEADLO COCc1cc(C[NH2+][C@@H]2CCCC[C@@H]2F)no1 ZINC000877682111 590390879 /nfs/dbraw/zinc/39/08/79/590390879.db2.gz GTPOUPCRSXVZMZ-NWDGAFQWSA-N 1 2 242.294 2.191 20 0 BEADLO C[C@@H]([NH2+]Cc1cc(C2CC2)no1)c1ccnn1C ZINC000877761957 590419556 /nfs/dbraw/zinc/41/95/56/590419556.db2.gz VIEIFFXEDGRNTG-SECBINFHSA-N 1 2 246.314 2.136 20 0 BEADLO C[C@H]1CCC[C@H](C2C[NH+](Cc3cnn(C)n3)C2)C1 ZINC000877763952 590420230 /nfs/dbraw/zinc/42/02/30/590420230.db2.gz OOXWWXIYLZSKDA-RYUDHWBXSA-N 1 2 248.374 2.073 20 0 BEADLO CC[C@H]1CCC[C@@]1(C)C(=O)NC1=[NH+]CCS1 ZINC000877963034 590459254 /nfs/dbraw/zinc/45/92/54/590459254.db2.gz FCUYUDCXGNALMQ-JOYOIKCWSA-N 1 2 240.372 2.422 20 0 BEADLO Cc1cc(NC(=O)c2c[nH]cc2C2CC2)cc[nH+]1 ZINC000878008770 590472127 /nfs/dbraw/zinc/47/21/27/590472127.db2.gz NTHMSCKIEPOMBX-UHFFFAOYSA-N 1 2 241.294 2.270 20 0 BEADLO FC(F)(F)[C@H]1C[N@H+](CCCC2CC2)CCO1 ZINC000878123301 590500010 /nfs/dbraw/zinc/50/00/10/590500010.db2.gz WKGPMQDDTKODRP-SNVBAGLBSA-N 1 2 237.265 2.440 20 0 BEADLO FC(F)(F)[C@H]1C[N@@H+](CCCC2CC2)CCO1 ZINC000878123301 590500011 /nfs/dbraw/zinc/50/00/11/590500011.db2.gz WKGPMQDDTKODRP-SNVBAGLBSA-N 1 2 237.265 2.440 20 0 BEADLO C[N@@H+](Cc1ccon1)C[C@H]1CC2(CCC2)CO1 ZINC000878123758 590500207 /nfs/dbraw/zinc/50/02/07/590500207.db2.gz FERYGLDCZOOHGD-GFCCVEGCSA-N 1 2 236.315 2.066 20 0 BEADLO C[N@H+](Cc1ccon1)C[C@H]1CC2(CCC2)CO1 ZINC000878123758 590500209 /nfs/dbraw/zinc/50/02/09/590500209.db2.gz FERYGLDCZOOHGD-GFCCVEGCSA-N 1 2 236.315 2.066 20 0 BEADLO CC(C)[C@@H](O)CC[N@H+](CC(F)F)C(C)C ZINC000878200360 590522626 /nfs/dbraw/zinc/52/26/26/590522626.db2.gz OFORMFJTAMJGNU-JTQLQIEISA-N 1 2 223.307 2.369 20 0 BEADLO CC(C)[C@@H](O)CC[N@@H+](CC(F)F)C(C)C ZINC000878200360 590522630 /nfs/dbraw/zinc/52/26/30/590522630.db2.gz OFORMFJTAMJGNU-JTQLQIEISA-N 1 2 223.307 2.369 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)Cc1scnc1Cl ZINC000878315198 590542334 /nfs/dbraw/zinc/54/23/34/590542334.db2.gz ISYQTFKMDGESSI-UHFFFAOYSA-N 1 2 242.735 2.152 20 0 BEADLO Cc1conc1CN1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000878338514 590550662 /nfs/dbraw/zinc/55/06/62/590550662.db2.gz WQRDKIRXRQFBKU-NSHDSACASA-N 1 2 232.287 2.043 20 0 BEADLO FC1(F)CC[N@H+](C[C@@H]2C[C@H]3CCC[C@H]3O2)C1 ZINC000878380302 590555941 /nfs/dbraw/zinc/55/59/41/590555941.db2.gz WGUGAIJFMFTHTC-OUAUKWLOSA-N 1 2 231.286 2.285 20 0 BEADLO FC1(F)CC[N@@H+](C[C@@H]2C[C@H]3CCC[C@H]3O2)C1 ZINC000878380302 590555943 /nfs/dbraw/zinc/55/59/43/590555943.db2.gz WGUGAIJFMFTHTC-OUAUKWLOSA-N 1 2 231.286 2.285 20 0 BEADLO OC[C@@H]1CC(F)(F)C[N@@H+]1CC1CC2(CCC2)C1 ZINC000878476350 590575381 /nfs/dbraw/zinc/57/53/81/590575381.db2.gz IBPJVQSGSOIJPC-NSHDSACASA-N 1 2 245.313 2.269 20 0 BEADLO OC[C@@H]1CC(F)(F)C[N@H+]1CC1CC2(CCC2)C1 ZINC000878476350 590575382 /nfs/dbraw/zinc/57/53/82/590575382.db2.gz IBPJVQSGSOIJPC-NSHDSACASA-N 1 2 245.313 2.269 20 0 BEADLO FC1(F)COCC[N@H+](CCCC2CC2)C1 ZINC000878623139 590597458 /nfs/dbraw/zinc/59/74/58/590597458.db2.gz FTWPLFZIJMHZAM-UHFFFAOYSA-N 1 2 219.275 2.144 20 0 BEADLO FC1(F)COCC[N@@H+](CCCC2CC2)C1 ZINC000878623139 590597460 /nfs/dbraw/zinc/59/74/60/590597460.db2.gz FTWPLFZIJMHZAM-UHFFFAOYSA-N 1 2 219.275 2.144 20 0 BEADLO CC[C@H]1CCC[C@]1(C)C(=O)NCc1[nH+]ccn1C ZINC000878722412 590617123 /nfs/dbraw/zinc/61/71/23/590617123.db2.gz UICOZOGBHJLEFK-FZMZJTMJSA-N 1 2 249.358 2.253 20 0 BEADLO Clc1cnn(CC[N@@H+]2CCC=C(Cl)C2)c1 ZINC000878790049 590622190 /nfs/dbraw/zinc/62/21/90/590622190.db2.gz BXOYAVFJDHMEOW-UHFFFAOYSA-N 1 2 246.141 2.365 20 0 BEADLO Clc1cnn(CC[N@H+]2CCC=C(Cl)C2)c1 ZINC000878790049 590622192 /nfs/dbraw/zinc/62/21/92/590622192.db2.gz BXOYAVFJDHMEOW-UHFFFAOYSA-N 1 2 246.141 2.365 20 0 BEADLO COc1ccc(C[N@@H+]2CCC=C(Cl)C2)cn1 ZINC000878791598 590622925 /nfs/dbraw/zinc/62/29/25/590622925.db2.gz AOAAVMYTMFZVBC-UHFFFAOYSA-N 1 2 238.718 2.419 20 0 BEADLO COc1ccc(C[N@H+]2CCC=C(Cl)C2)cn1 ZINC000878791598 590622927 /nfs/dbraw/zinc/62/29/27/590622927.db2.gz AOAAVMYTMFZVBC-UHFFFAOYSA-N 1 2 238.718 2.419 20 0 BEADLO CCC(C)(C)NC(=O)C[N@@H+]1CCC=C(Cl)C1 ZINC000878793032 590624115 /nfs/dbraw/zinc/62/41/15/590624115.db2.gz AUIUFBDGMKPBQD-UHFFFAOYSA-N 1 2 244.766 2.120 20 0 BEADLO CCC(C)(C)NC(=O)C[N@H+]1CCC=C(Cl)C1 ZINC000878793032 590624116 /nfs/dbraw/zinc/62/41/16/590624116.db2.gz AUIUFBDGMKPBQD-UHFFFAOYSA-N 1 2 244.766 2.120 20 0 BEADLO FC(F)Cn1ccnc1C[NH+](C1CC1)C1CC1 ZINC000879037976 590683637 /nfs/dbraw/zinc/68/36/37/590683637.db2.gz OMNGQPRKEVBBPP-UHFFFAOYSA-N 1 2 241.285 2.275 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)C[C@@H]1CCC2(CCC2)O1 ZINC000879188638 590710341 /nfs/dbraw/zinc/71/03/41/590710341.db2.gz OPROQWCGQKUPOD-ZDUSSCGKSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)C[C@@H]1CCC2(CCC2)O1 ZINC000879188638 590710344 /nfs/dbraw/zinc/71/03/44/590710344.db2.gz OPROQWCGQKUPOD-ZDUSSCGKSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1coc(C(=O)N2CCC[C@@H]2c2[nH]cc[nH+]2)c1 ZINC000879372759 590755668 /nfs/dbraw/zinc/75/56/68/590755668.db2.gz VVRVYFQNHNQRME-SNVBAGLBSA-N 1 2 245.282 2.288 20 0 BEADLO CC(C)c1cnc(C[NH2+][C@H](C)c2ccnn2C)o1 ZINC000879683573 590847603 /nfs/dbraw/zinc/84/76/03/590847603.db2.gz AWYKUMBRQMPZKX-SNVBAGLBSA-N 1 2 248.330 2.382 20 0 BEADLO CC1(C)OC[C@H](CC[N@@H+]2OC3CCC2CC3)O1 ZINC000879800351 590878255 /nfs/dbraw/zinc/87/82/55/590878255.db2.gz POJWNXPJCVFGQV-MCIGGMRASA-N 1 2 241.331 2.086 20 0 BEADLO CC1(C)OC[C@H](CC[N@H+]2OC3CCC2CC3)O1 ZINC000879800351 590878258 /nfs/dbraw/zinc/87/82/58/590878258.db2.gz POJWNXPJCVFGQV-MCIGGMRASA-N 1 2 241.331 2.086 20 0 BEADLO CC(C)(NC(=O)C[C@@H]1C[C@H]1C1CC1)c1[nH]cc[nH+]1 ZINC000880219148 590960226 /nfs/dbraw/zinc/96/02/26/590960226.db2.gz XXQMLSFRRLDEIH-QWRGUYRKSA-N 1 2 247.342 2.197 20 0 BEADLO FC[C@@H]1CCC[N@H+](Cc2nccn2C(F)F)C1 ZINC000880234622 590964088 /nfs/dbraw/zinc/96/40/88/590964088.db2.gz JXLNEDPVQHMVLL-VIFPVBQESA-N 1 2 247.264 2.460 20 0 BEADLO FC[C@@H]1CCC[N@@H+](Cc2nccn2C(F)F)C1 ZINC000880234622 590964091 /nfs/dbraw/zinc/96/40/91/590964091.db2.gz JXLNEDPVQHMVLL-VIFPVBQESA-N 1 2 247.264 2.460 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2CCC[C@H](CF)C2)no1 ZINC000880236960 590968075 /nfs/dbraw/zinc/96/80/75/590968075.db2.gz MXTFHZZRRHFVTO-PSASIEDQSA-N 1 2 227.283 2.121 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2CCC[C@H](CF)C2)no1 ZINC000880236960 590968079 /nfs/dbraw/zinc/96/80/79/590968079.db2.gz MXTFHZZRRHFVTO-PSASIEDQSA-N 1 2 227.283 2.121 20 0 BEADLO CC(C)c1nnc(C[NH+]2CCC(F)CC2)o1 ZINC000880241346 590975767 /nfs/dbraw/zinc/97/57/67/590975767.db2.gz AAPMTWGTAFCLHC-UHFFFAOYSA-N 1 2 227.283 2.127 20 0 BEADLO CCCCc1noc(C[NH+]2CCC(F)CC2)n1 ZINC000880243637 590976563 /nfs/dbraw/zinc/97/65/63/590976563.db2.gz OVNYVRILWVWOPX-UHFFFAOYSA-N 1 2 241.310 2.346 20 0 BEADLO CCCCc1nc(C[N@@H+]2CC[C@@H](CF)C2)no1 ZINC000880295009 590989299 /nfs/dbraw/zinc/98/92/99/590989299.db2.gz HDLRAIFCTNQYCE-JTQLQIEISA-N 1 2 241.310 2.204 20 0 BEADLO CCCCc1nc(C[N@H+]2CC[C@@H](CF)C2)no1 ZINC000880295009 590989300 /nfs/dbraw/zinc/98/93/00/590989300.db2.gz HDLRAIFCTNQYCE-JTQLQIEISA-N 1 2 241.310 2.204 20 0 BEADLO Cl/C=C\C[NH2+]C1(c2ncccn2)CCC1 ZINC000880364930 591010628 /nfs/dbraw/zinc/01/06/28/591010628.db2.gz XNHLVABTEWNUTF-KXFIGUGUSA-N 1 2 223.707 2.198 20 0 BEADLO c1ncc(C[NH2+]C2(c3ncccn3)CCC2)s1 ZINC000880367545 591012606 /nfs/dbraw/zinc/01/26/06/591012606.db2.gz HFBWMMRBVRJTLD-UHFFFAOYSA-N 1 2 246.339 2.102 20 0 BEADLO OC[C@@H]1C=CC[N@@H+]1Cc1cc(C(F)(F)F)co1 ZINC000880493308 591071594 /nfs/dbraw/zinc/07/15/94/591071594.db2.gz ANSUPWURJQHXNB-VIFPVBQESA-N 1 2 247.216 2.031 20 0 BEADLO OC[C@@H]1C=CC[N@H+]1Cc1cc(C(F)(F)F)co1 ZINC000880493308 591071599 /nfs/dbraw/zinc/07/15/99/591071599.db2.gz ANSUPWURJQHXNB-VIFPVBQESA-N 1 2 247.216 2.031 20 0 BEADLO COC(=O)C[N@@H+]1C[C@@H]2CC[C@H]1c1ccccc12 ZINC000880536180 591086302 /nfs/dbraw/zinc/08/63/02/591086302.db2.gz KDAGNKMRHGBMBW-GWCFXTLKSA-N 1 2 231.295 2.094 20 0 BEADLO COC(=O)C[N@H+]1C[C@@H]2CC[C@H]1c1ccccc12 ZINC000880536180 591086307 /nfs/dbraw/zinc/08/63/07/591086307.db2.gz KDAGNKMRHGBMBW-GWCFXTLKSA-N 1 2 231.295 2.094 20 0 BEADLO C=C/C=C/CCNC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000881570938 591244976 /nfs/dbraw/zinc/24/49/76/591244976.db2.gz WVABXIVXHZXKJO-ITKZLYELSA-N 1 2 233.315 2.083 20 0 BEADLO Cc1[nH+]cnc(NC[C@H](O)c2ccccc2)c1C ZINC000881744117 591268378 /nfs/dbraw/zinc/26/83/78/591268378.db2.gz MYNXSOHKQFUMJV-ZDUSSCGKSA-N 1 2 243.310 2.239 20 0 BEADLO Cc1[nH+]cnc(NCCCOC(C)C)c1C ZINC000881746194 591268709 /nfs/dbraw/zinc/26/87/09/591268709.db2.gz WVXKMAWVHNZIFZ-UHFFFAOYSA-N 1 2 223.320 2.320 20 0 BEADLO Cc1[nH+]cnc(N(C)C[C@@H]2CCCCO2)c1C ZINC000881835870 591273734 /nfs/dbraw/zinc/27/37/34/591273734.db2.gz KPZWXDWCTSQUOU-LBPRGKRZSA-N 1 2 235.331 2.099 20 0 BEADLO CCOC1CCN(c2nc[nH+]c(C)c2C)CC1 ZINC000881835990 591274148 /nfs/dbraw/zinc/27/41/48/591274148.db2.gz NEIIFAWJGUUSTK-UHFFFAOYSA-N 1 2 235.331 2.099 20 0 BEADLO Cc1[nH+]cnc(NCc2cscn2)c1C ZINC000881869662 591275894 /nfs/dbraw/zinc/27/58/94/591275894.db2.gz CWCNLIFLISZLEK-UHFFFAOYSA-N 1 2 220.301 2.162 20 0 BEADLO Cc1ncsc1CNc1nc[nH+]c(C)c1C ZINC000881921540 591278857 /nfs/dbraw/zinc/27/88/57/591278857.db2.gz WXJAGUHRKMISER-UHFFFAOYSA-N 1 2 234.328 2.470 20 0 BEADLO Cc1[nH+]cnc(NCC(C)(C)C[C@@H](C)O)c1C ZINC000882016427 591288301 /nfs/dbraw/zinc/28/83/01/591288301.db2.gz NRWNEMAFWGQDSS-SECBINFHSA-N 1 2 237.347 2.302 20 0 BEADLO Cc1[nH+]cnc(N2CCC(C)(C)C2)c1C ZINC000882032959 591289678 /nfs/dbraw/zinc/28/96/78/591289678.db2.gz YDJKASMXXVYWCL-UHFFFAOYSA-N 1 2 205.305 2.330 20 0 BEADLO Cc1noc(C)c1CCCNc1cc[nH+]cc1F ZINC000882073233 591293777 /nfs/dbraw/zinc/29/37/77/591293777.db2.gz NQEMWGUKIARUEY-UHFFFAOYSA-N 1 2 249.289 2.292 20 0 BEADLO Cc1[nH+]cnc(N2CCC3(CCC3)C2)c1C ZINC000882086874 591295053 /nfs/dbraw/zinc/29/50/53/591295053.db2.gz ZWCQKDMJOFRDON-UHFFFAOYSA-N 1 2 217.316 2.474 20 0 BEADLO COCCC1(CNc2nc[nH+]c(C)c2C)CC1 ZINC000882111015 591299834 /nfs/dbraw/zinc/29/98/34/591299834.db2.gz OJAKWVZUYRXDPL-UHFFFAOYSA-N 1 2 235.331 2.322 20 0 BEADLO CCC(CC)(CO)CNc1nc[nH+]c(C)c1C ZINC000882129655 591302673 /nfs/dbraw/zinc/30/26/73/591302673.db2.gz XXCIVWWKJVLKCQ-UHFFFAOYSA-N 1 2 237.347 2.304 20 0 BEADLO Cc1[nH+]cnc(N(C)CCc2nccs2)c1C ZINC000882129867 591302902 /nfs/dbraw/zinc/30/29/02/591302902.db2.gz GRYLCUWHDQRCSR-UHFFFAOYSA-N 1 2 248.355 2.229 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2CCOC(C)(C)C2)c1C ZINC000882131452 591303510 /nfs/dbraw/zinc/30/35/10/591303510.db2.gz GNOXTUHLRBZOPV-NSHDSACASA-N 1 2 235.331 2.463 20 0 BEADLO Cc1[nH+]cnc(NCC2([C@H](O)C(C)C)CC2)c1C ZINC000882161576 591309299 /nfs/dbraw/zinc/30/92/99/591309299.db2.gz KLIYSMDUIQQSCB-GFCCVEGCSA-N 1 2 249.358 2.302 20 0 BEADLO COC[C@H]1CCCCN(c2nc[nH+]c(C)c2C)C1 ZINC000882196385 591315550 /nfs/dbraw/zinc/31/55/50/591315550.db2.gz IOVSJGPVEXPSGH-ZDUSSCGKSA-N 1 2 249.358 2.346 20 0 BEADLO COCC1(CNc2nc[nH+]c(C)c2C)CCC1 ZINC000882313404 591328729 /nfs/dbraw/zinc/32/87/29/591328729.db2.gz LXQAVYCTLPEZAT-UHFFFAOYSA-N 1 2 235.331 2.322 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2C[C@H]2C(F)(F)F)c1C ZINC000882313180 591328777 /nfs/dbraw/zinc/32/87/77/591328777.db2.gz AKPDRGITCRIWOJ-HTQZYQBOSA-N 1 2 231.221 2.456 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2CCOC[C@@H]2C)c1C ZINC000882353878 591337090 /nfs/dbraw/zinc/33/70/90/591337090.db2.gz VGCBWQMFKBWXOK-CABZTGNLSA-N 1 2 235.331 2.178 20 0 BEADLO Cc1[nH+]cnc(NCC(C)(F)F)c1C ZINC000882399927 591342213 /nfs/dbraw/zinc/34/22/13/591342213.db2.gz CXEJDOXJJUKWLA-UHFFFAOYSA-N 1 2 201.220 2.161 20 0 BEADLO COC1(CCNc2nc[nH+]c(C)c2C)CCC1 ZINC000882401479 591343575 /nfs/dbraw/zinc/34/35/75/591343575.db2.gz YPNHKVSEVBQDDD-UHFFFAOYSA-N 1 2 235.331 2.465 20 0 BEADLO CO[C@H]1CCN(c2nc[nH+]c(C)c2C)CC1(C)C ZINC000882419376 591345570 /nfs/dbraw/zinc/34/55/70/591345570.db2.gz HVMSFBBHBDKBMR-LBPRGKRZSA-N 1 2 249.358 2.345 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2C[C@@H](OC(C)C)C2)c1C ZINC000882440100 591349846 /nfs/dbraw/zinc/34/98/46/591349846.db2.gz WIFHJMBBYNSHJJ-TXEJJXNPSA-N 1 2 235.331 2.461 20 0 BEADLO Cc1[nH+]cnc(NCc2cnc(Cl)cn2)c1C ZINC000882447463 591351316 /nfs/dbraw/zinc/35/13/16/591351316.db2.gz AAJKCMNNROZWLN-UHFFFAOYSA-N 1 2 249.705 2.149 20 0 BEADLO CC[C@@H]1C[C@@H](Nc2nc[nH+]c(C)c2C)CCO1 ZINC000882472520 591354420 /nfs/dbraw/zinc/35/44/20/591354420.db2.gz RIVDPAPZCREKQQ-NWDGAFQWSA-N 1 2 235.331 2.463 20 0 BEADLO CC(C)(Nc1cncc(Cl)n1)c1[nH]cc[nH+]1 ZINC000882626882 591402436 /nfs/dbraw/zinc/40/24/36/591402436.db2.gz XVZJADBBGGISHJ-UHFFFAOYSA-N 1 2 237.694 2.200 20 0 BEADLO CCCCc1cc(NC2CSC2)nc[nH+]1 ZINC000882626017 591402407 /nfs/dbraw/zinc/40/24/07/591402407.db2.gz QMKOGPDVKPJJST-UHFFFAOYSA-N 1 2 223.345 2.347 20 0 BEADLO COc1cncc(CNc2nc[nH+]c(C)c2C)c1 ZINC000882625491 591402765 /nfs/dbraw/zinc/40/27/65/591402765.db2.gz BAOUVCJIBMXVNZ-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2[C@@H](C)[C@@H](C)O[C@H]2C)c1C ZINC000882660411 591408014 /nfs/dbraw/zinc/40/80/14/591408014.db2.gz SCKGOMMCSZHCGE-IELRGYKMSA-N 1 2 235.331 2.317 20 0 BEADLO C[C@H](Nc1cc(CO)cc[nH+]1)c1ccns1 ZINC000882669260 591409367 /nfs/dbraw/zinc/40/93/67/591409367.db2.gz YOJJZFNIARBTQN-QMMMGPOBSA-N 1 2 235.312 2.204 20 0 BEADLO Cc1[nH+]cnc(N2CCC(C)(F)CC2)c1C ZINC000882687159 591411888 /nfs/dbraw/zinc/41/18/88/591411888.db2.gz ANZBTBVPIRRXMO-UHFFFAOYSA-N 1 2 223.295 2.422 20 0 BEADLO CC(C)OC1(CNc2cc[nH+]cc2F)CCC1 ZINC000882715403 591419196 /nfs/dbraw/zinc/41/91/96/591419196.db2.gz ANYYJVLKJXLHMG-UHFFFAOYSA-N 1 2 238.306 2.402 20 0 BEADLO CCOC1CC2(C[C@H]2Nc2nc[nH+]c(C)c2C)C1 ZINC000882720052 591420951 /nfs/dbraw/zinc/42/09/51/591420951.db2.gz IUYQXOAIJXOUTJ-MBHSVXNSSA-N 1 2 247.342 2.463 20 0 BEADLO C1=C[C@H](CNc2cc(N3CCCC3)nc[nH+]2)CC1 ZINC000882757781 591431128 /nfs/dbraw/zinc/43/11/28/591431128.db2.gz PAEWUIZSHKXDRC-LBPRGKRZSA-N 1 2 244.342 2.455 20 0 BEADLO C1=C[C@H](CNc2cc(N3CCCC3)[nH+]cn2)CC1 ZINC000882757781 591431132 /nfs/dbraw/zinc/43/11/32/591431132.db2.gz PAEWUIZSHKXDRC-LBPRGKRZSA-N 1 2 244.342 2.455 20 0 BEADLO CC1(CNc2cc(CO)cc[nH+]2)CC(F)(F)C1 ZINC000882774865 591435743 /nfs/dbraw/zinc/43/57/43/591435743.db2.gz BPFNUDQWRFLMEE-UHFFFAOYSA-N 1 2 242.269 2.421 20 0 BEADLO C=C/C=C/CCNc1cc(CC(=O)OC)cc[nH+]1 ZINC000882795663 591440570 /nfs/dbraw/zinc/44/05/70/591440570.db2.gz QWLMUISRBDFQTQ-SNAWJCMRSA-N 1 2 246.310 2.341 20 0 BEADLO Cn1c2ccccc2[nH+]c1N1CC[C@@H](CF)C1 ZINC000882840856 591451588 /nfs/dbraw/zinc/45/15/88/591451588.db2.gz GQRWEAUQOIPJQD-JTQLQIEISA-N 1 2 233.290 2.369 20 0 BEADLO Cc1cc(N2CC[C@H](c3nccs3)C2)nc[nH+]1 ZINC000882855236 591454454 /nfs/dbraw/zinc/45/44/54/591454454.db2.gz DWRGRBBUISLGBV-JTQLQIEISA-N 1 2 246.339 2.235 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1CCC[C@]12CCCO2 ZINC000882982689 591492678 /nfs/dbraw/zinc/49/26/78/591492678.db2.gz QVLFJUVWJCLLOO-OLZOCXBDSA-N 1 2 236.290 2.156 20 0 BEADLO Cc1nc(N[C@@H]2CCC[C@]23CCCO3)cc[nH+]1 ZINC000882983787 591494165 /nfs/dbraw/zinc/49/41/65/591494165.db2.gz OTWGYXPQQFOEAZ-YPMHNXCESA-N 1 2 233.315 2.299 20 0 BEADLO C=C/C=C\CCO[NH+]=C(N)COC(C)(C)C ZINC000882988130 591496432 /nfs/dbraw/zinc/49/64/32/591496432.db2.gz BTAPYTCRPDSSFW-SREVYHEPSA-N 1 2 226.320 2.432 20 0 BEADLO COCC[C@@H](C)O[NH+]=C(N)c1ccccc1C ZINC000883059045 591531654 /nfs/dbraw/zinc/53/16/54/591531654.db2.gz KNBXITPGSASAHC-LLVKDONJSA-N 1 2 236.315 2.267 20 0 BEADLO C[C@@H]([NH2+]C1CC=CC1)C(=O)OC(C)(C)C ZINC000131049649 591545330 /nfs/dbraw/zinc/54/53/30/591545330.db2.gz QORSMTRUQOSKJV-SECBINFHSA-N 1 2 211.305 2.025 20 0 BEADLO CCc1noc(C)c1C[NH2+]Cc1cc(C)on1 ZINC000883130416 591545705 /nfs/dbraw/zinc/54/57/05/591545705.db2.gz DFFOVUZJYUOCIF-UHFFFAOYSA-N 1 2 235.287 2.132 20 0 BEADLO CCc1ncc(C[NH2+]Cc2nc(C(C)C)c[nH]2)o1 ZINC000883136904 591548646 /nfs/dbraw/zinc/54/86/46/591548646.db2.gz RKBQLGSRAAIGNR-UHFFFAOYSA-N 1 2 248.330 2.373 20 0 BEADLO COc1cc[nH+]cc1NC(=O)/C=C(/C)C1CC1 ZINC000131477407 591610185 /nfs/dbraw/zinc/61/01/85/591610185.db2.gz ZXBQFIKLTDRIQG-CLFYSBASSA-N 1 2 232.283 2.385 20 0 BEADLO Cc1cc(N[C@@H]2CO[C@@H](C)C2)c[nH+]c1C ZINC000883341140 591620293 /nfs/dbraw/zinc/62/02/93/591620293.db2.gz JGLGUARVEAVUQX-CABZTGNLSA-N 1 2 206.289 2.288 20 0 BEADLO Cc1cc(NCC2(C)COC2)c[nH+]c1C ZINC000883340844 591620300 /nfs/dbraw/zinc/62/03/00/591620300.db2.gz AEFUIBWWDZBTDE-UHFFFAOYSA-N 1 2 206.289 2.147 20 0 BEADLO COc1nccnc1CNc1c[nH+]c(C)c(C)c1 ZINC000883341650 591620495 /nfs/dbraw/zinc/62/04/95/591620495.db2.gz WNHRJYHCROMKHZ-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO Cc1cc(CNc2c[nH+]c(C)c(C)c2)nn1C ZINC000883341360 591620813 /nfs/dbraw/zinc/62/08/13/591620813.db2.gz OFNWJPKCDSLFNI-UHFFFAOYSA-N 1 2 230.315 2.352 20 0 BEADLO CCCNc1cc(NCc2cc(C)no2)nc[nH+]1 ZINC000132113280 591687986 /nfs/dbraw/zinc/68/79/86/591687986.db2.gz VGFYIQJUFHUYCC-UHFFFAOYSA-N 1 2 247.302 2.207 20 0 BEADLO CCCNc1cc(NCc2cc(C)no2)[nH+]cn1 ZINC000132113280 591687989 /nfs/dbraw/zinc/68/79/89/591687989.db2.gz VGFYIQJUFHUYCC-UHFFFAOYSA-N 1 2 247.302 2.207 20 0 BEADLO Cc1nc(N[C@@H](C)C[C@H](O)c2ccco2)cc[nH+]1 ZINC000133669159 591845163 /nfs/dbraw/zinc/84/51/63/591845163.db2.gz BUHQDFBAXHFZGU-ONGXEEELSA-N 1 2 247.298 2.302 20 0 BEADLO Fc1ccc2c(c1)CC[C@H]2[NH2+]Cc1ccn[nH]1 ZINC000134287547 591911952 /nfs/dbraw/zinc/91/19/52/591911952.db2.gz LZGIHCPUOZSHQC-CYBMUJFWSA-N 1 2 231.274 2.326 20 0 BEADLO CCc1nc(N(CC2CCC2)[C@@H](C)CO)cc[nH+]1 ZINC000884493880 591956358 /nfs/dbraw/zinc/95/63/58/591956358.db2.gz FMVLFIYBYMHQIT-NSHDSACASA-N 1 2 249.358 2.026 20 0 BEADLO CCc1nc(N2CCC3(CCOC3)CC2)cc[nH+]1 ZINC000884496631 591956605 /nfs/dbraw/zinc/95/66/05/591956605.db2.gz BWULUWUMQZCPQH-UHFFFAOYSA-N 1 2 247.342 2.046 20 0 BEADLO CCc1nc(NC[C@@]2(O)CCCC2(C)C)cc[nH+]1 ZINC000884516638 591962908 /nfs/dbraw/zinc/96/29/08/591962908.db2.gz PLXXQJQTMZWHBB-AWEZNQCLSA-N 1 2 249.358 2.392 20 0 BEADLO CCc1nc(NCCC2(OC)CCC2)cc[nH+]1 ZINC000884516641 591963267 /nfs/dbraw/zinc/96/32/67/591963267.db2.gz PQOYGWCPOBIBBT-UHFFFAOYSA-N 1 2 235.331 2.410 20 0 BEADLO CCC[C@@H](CNc1cc[nH+]c(CC)n1)OC ZINC000884518071 591964229 /nfs/dbraw/zinc/96/42/29/591964229.db2.gz DQUNJGVXVALQKL-JTQLQIEISA-N 1 2 223.320 2.266 20 0 BEADLO CCc1nc(N[C@H]2CC23CCOCC3)cc[nH+]1 ZINC000884521714 591964653 /nfs/dbraw/zinc/96/46/53/591964653.db2.gz FEJLBUBDISFMTR-JTQLQIEISA-N 1 2 233.315 2.020 20 0 BEADLO CCc1nc(N2CC[C@@H]2C(C)C)cc[nH+]1 ZINC000884521843 591965118 /nfs/dbraw/zinc/96/51/18/591965118.db2.gz IECXRQHGHJWNSM-SNVBAGLBSA-N 1 2 205.305 2.274 20 0 BEADLO CCc1nc(NC[C@H]2CCCC[C@@H]2O)cc[nH+]1 ZINC000884523281 591965672 /nfs/dbraw/zinc/96/56/72/591965672.db2.gz TYLUKPCLNQFSEG-MNOVXSKESA-N 1 2 235.331 2.002 20 0 BEADLO CCc1nc(N[C@@H]2C[C@@H](C)n3ccnc32)cc[nH+]1 ZINC000884522633 591965768 /nfs/dbraw/zinc/96/57/68/591965768.db2.gz DEOLGYVIXIWVLG-NXEZZACHSA-N 1 2 243.314 2.353 20 0 BEADLO CCc1nc(N[C@@H](C)[C@@H](OC)C2CC2)cc[nH+]1 ZINC000884524474 591965861 /nfs/dbraw/zinc/96/58/61/591965861.db2.gz YPJOLFQFUIVUHM-TVQRCGJNSA-N 1 2 235.331 2.264 20 0 BEADLO CCc1nc(N2CCO[C@H](C3CCC3)C2)cc[nH+]1 ZINC000884529875 591967480 /nfs/dbraw/zinc/96/74/80/591967480.db2.gz YIWCNMFVZONPJZ-LBPRGKRZSA-N 1 2 247.342 2.044 20 0 BEADLO CCc1nc(NC[C@H](C)CCOC)cc[nH+]1 ZINC000884529718 591967492 /nfs/dbraw/zinc/96/74/92/591967492.db2.gz UVCKLFSUOKHSLZ-SNVBAGLBSA-N 1 2 223.320 2.124 20 0 BEADLO CCc1nc(N[C@@H](CO)C[C@H](C)CC)cc[nH+]1 ZINC000884542664 591972031 /nfs/dbraw/zinc/97/20/31/591972031.db2.gz KJPWBAVAGZBIMK-GHMZBOCLSA-N 1 2 237.347 2.248 20 0 BEADLO CCc1nc(N[C@H]2CCS[C@H]2C)cc[nH+]1 ZINC000884544000 591973075 /nfs/dbraw/zinc/97/30/75/591973075.db2.gz SYSJTQRLBHWLCD-IUCAKERBSA-N 1 2 223.345 2.345 20 0 BEADLO CCc1nc(N2C[C@@H](C)OC3(CCC3)C2)cc[nH+]1 ZINC000884543618 591973112 /nfs/dbraw/zinc/97/31/12/591973112.db2.gz JQMFBIZLRDELNY-LLVKDONJSA-N 1 2 247.342 2.187 20 0 BEADLO CCc1nc(N2C[C@H](CC)OC[C@H]2CC)cc[nH+]1 ZINC000884545157 591974006 /nfs/dbraw/zinc/97/40/06/591974006.db2.gz ZTKMWMKQKQGLEQ-NEPJUHHUSA-N 1 2 249.358 2.433 20 0 BEADLO CCc1nc(N[C@@H](C)COCC2CC2)cc[nH+]1 ZINC000884545462 591974699 /nfs/dbraw/zinc/97/46/99/591974699.db2.gz IKAKDVSBUKIKQC-JTQLQIEISA-N 1 2 235.331 2.266 20 0 BEADLO CCc1nc(NCCC2CC(OC)C2)cc[nH+]1 ZINC000884551438 591976392 /nfs/dbraw/zinc/97/63/92/591976392.db2.gz ANYDRJRRJHJEHJ-UHFFFAOYSA-N 1 2 235.331 2.266 20 0 BEADLO CCc1nc(N[C@H](C)Cc2ccccn2)cc[nH+]1 ZINC000884548393 591976449 /nfs/dbraw/zinc/97/64/49/591976449.db2.gz JVHFRSBHJZIMNE-LLVKDONJSA-N 1 2 242.326 2.477 20 0 BEADLO CCc1nc(N2CCC[C@H](C)[C@@H]2CCO)cc[nH+]1 ZINC000884554869 591977039 /nfs/dbraw/zinc/97/70/39/591977039.db2.gz DXWSNWIKXFKGFU-RYUDHWBXSA-N 1 2 249.358 2.026 20 0 BEADLO CCc1nc(N[C@]23C[C@H]2COC3(C)C)cc[nH+]1 ZINC000884564048 591982631 /nfs/dbraw/zinc/98/26/31/591982631.db2.gz WJOUBEKSGGVGQP-TVQRCGJNSA-N 1 2 233.315 2.018 20 0 BEADLO CCc1nc(NC[C@@H]2CC(C)(C)CO2)cc[nH+]1 ZINC000884578646 591985773 /nfs/dbraw/zinc/98/57/73/591985773.db2.gz FYFOTCZVJJBRRD-JTQLQIEISA-N 1 2 235.331 2.266 20 0 BEADLO COc1c(C)[nH+]c(C2CC2)nc1N1C[C@@H]2C[C@@H]2C1 ZINC000884590797 591990030 /nfs/dbraw/zinc/99/00/30/591990030.db2.gz FFLXLACFEUTFFG-PHIMTYICSA-N 1 2 245.326 2.127 20 0 BEADLO CC(C)OC(=O)[C@@H]1CCC[N@@H+]1C/C=C/Cl ZINC000135239790 591997953 /nfs/dbraw/zinc/99/79/53/591997953.db2.gz LVFZUZKNSQAEOB-RWCYGVJQSA-N 1 2 231.723 2.155 20 0 BEADLO CC(C)OC(=O)[C@@H]1CCC[N@H+]1C/C=C/Cl ZINC000135239790 591997956 /nfs/dbraw/zinc/99/79/56/591997956.db2.gz LVFZUZKNSQAEOB-RWCYGVJQSA-N 1 2 231.723 2.155 20 0 BEADLO CCc1nc(NC[C@H]2CC3(CCC3)CO2)cc[nH+]1 ZINC000884660102 592006242 /nfs/dbraw/zinc/00/62/42/592006242.db2.gz LKHAQKLKTJLBEP-LLVKDONJSA-N 1 2 247.342 2.410 20 0 BEADLO CCc1cc(NC[C@@H]2CC3(CCC3)CO2)nc[nH+]1 ZINC000884660249 592006285 /nfs/dbraw/zinc/00/62/85/592006285.db2.gz ODMLOCXPEUTSRX-LBPRGKRZSA-N 1 2 247.342 2.410 20 0 BEADLO c1ccc(NC[C@H]2CC3(CCC3)CO2)[nH+]c1 ZINC000884663834 592007716 /nfs/dbraw/zinc/00/77/16/592007716.db2.gz WMSNFSRQMUHIGN-LLVKDONJSA-N 1 2 218.300 2.453 20 0 BEADLO CC/C=C(/C)C(=O)Nc1cc[nH+]cc1O ZINC000135403464 592012894 /nfs/dbraw/zinc/01/28/94/592012894.db2.gz FJRXPNJLDCRPNT-YWEYNIOJSA-N 1 2 206.245 2.082 20 0 BEADLO c1cnc([C@H]2CCCN(c3cccc[nH+]3)C2)nc1 ZINC000884708822 592013129 /nfs/dbraw/zinc/01/31/29/592013129.db2.gz MECLMZSTIIUXKL-LBPRGKRZSA-N 1 2 240.310 2.256 20 0 BEADLO Cc1[nH+]cnc(N2CC[C@@H]([C@@H]3CCCO3)C2)c1C ZINC000884752252 592017319 /nfs/dbraw/zinc/01/73/19/592017319.db2.gz SRVAZJBSPBAMOT-OLZOCXBDSA-N 1 2 247.342 2.099 20 0 BEADLO CC[C@@]1(C)C[N@H+](C/C=C/Cl)CCO1 ZINC000135600513 592024575 /nfs/dbraw/zinc/02/45/75/592024575.db2.gz STKLBFSYGTXXFN-YEZKRMTDSA-N 1 2 203.713 2.240 20 0 BEADLO CC[C@@]1(C)C[N@@H+](C/C=C/Cl)CCO1 ZINC000135600513 592024576 /nfs/dbraw/zinc/02/45/76/592024576.db2.gz STKLBFSYGTXXFN-YEZKRMTDSA-N 1 2 203.713 2.240 20 0 BEADLO C[C@@H]1C[N@H+](CCSC(F)(F)F)[C@@H](C)CO1 ZINC000885940459 592111142 /nfs/dbraw/zinc/11/11/42/592111142.db2.gz KBCKFXDZXLCGBJ-JGVFFNPUSA-N 1 2 243.294 2.349 20 0 BEADLO C[C@@H]1C[N@@H+](CCSC(F)(F)F)[C@@H](C)CO1 ZINC000885940459 592111143 /nfs/dbraw/zinc/11/11/43/592111143.db2.gz KBCKFXDZXLCGBJ-JGVFFNPUSA-N 1 2 243.294 2.349 20 0 BEADLO C[N@@H+](CCSC(F)(F)F)Cc1ccon1 ZINC000886018603 592132401 /nfs/dbraw/zinc/13/24/01/592132401.db2.gz DROOCQZMEGZBRQ-UHFFFAOYSA-N 1 2 240.250 2.359 20 0 BEADLO Cc1n[nH]c(C[NH2+]Cc2ccn(C(C)C)n2)c1C ZINC000885994272 592124471 /nfs/dbraw/zinc/12/44/71/592124471.db2.gz HBROHLCPFFIPFY-UHFFFAOYSA-N 1 2 247.346 2.094 20 0 BEADLO FC(F)C[N@H+](C[C@H]1C[C@@]12CCOC2)C1CC1 ZINC000886002074 592127590 /nfs/dbraw/zinc/12/75/90/592127590.db2.gz QCEIRGJSXDAMKA-BXKDBHETSA-N 1 2 231.286 2.143 20 0 BEADLO FC(F)C[N@@H+](C[C@H]1C[C@@]12CCOC2)C1CC1 ZINC000886002074 592127593 /nfs/dbraw/zinc/12/75/93/592127593.db2.gz QCEIRGJSXDAMKA-BXKDBHETSA-N 1 2 231.286 2.143 20 0 BEADLO COC[C@H]([NH2+]Cc1[nH]nc(C)c1C)c1ccco1 ZINC000886007942 592129030 /nfs/dbraw/zinc/12/90/30/592129030.db2.gz CDXLDKDREWKJDZ-LBPRGKRZSA-N 1 2 249.314 2.097 20 0 BEADLO C[N@H+](CCSC(F)(F)F)Cc1ccon1 ZINC000886018603 592132399 /nfs/dbraw/zinc/13/23/99/592132399.db2.gz DROOCQZMEGZBRQ-UHFFFAOYSA-N 1 2 240.250 2.359 20 0 BEADLO C[N@H+](Cc1ccon1)C[C@@H]1CC[C@H](C2CC2)O1 ZINC000886019517 592133418 /nfs/dbraw/zinc/13/34/18/592133418.db2.gz WFVNTZXFJWEZBF-QWHCGFSZSA-N 1 2 236.315 2.064 20 0 BEADLO C[N@@H+](Cc1ccon1)C[C@@H]1CC[C@H](C2CC2)O1 ZINC000886019517 592133416 /nfs/dbraw/zinc/13/34/16/592133416.db2.gz WFVNTZXFJWEZBF-QWHCGFSZSA-N 1 2 236.315 2.064 20 0 BEADLO Cc1n[nH]c(CNc2c[nH+]cc(C)c2)c1C ZINC000886041498 592139415 /nfs/dbraw/zinc/13/94/15/592139415.db2.gz NEAHBENGQGTWFZ-UHFFFAOYSA-N 1 2 216.288 2.342 20 0 BEADLO C[C@@H](O)C[N@H+](CC[C@@H]1C[C@H]1C1CC1)CC(F)F ZINC000886236777 592182119 /nfs/dbraw/zinc/18/21/19/592182119.db2.gz OQCBWLFHGGMPAC-JLLWLGSASA-N 1 2 247.329 2.371 20 0 BEADLO C[C@@H](O)C[N@@H+](CC[C@@H]1C[C@H]1C1CC1)CC(F)F ZINC000886236777 592182121 /nfs/dbraw/zinc/18/21/21/592182121.db2.gz OQCBWLFHGGMPAC-JLLWLGSASA-N 1 2 247.329 2.371 20 0 BEADLO CCn1cncc1C[NH2+]Cc1cc(C2CC2)no1 ZINC000886268844 592190867 /nfs/dbraw/zinc/19/08/67/592190867.db2.gz CPQRHLNYOXKVPH-UHFFFAOYSA-N 1 2 246.314 2.058 20 0 BEADLO C[C@@H]([NH2+]Cc1c(C2CC2)cnn1C)c1ncco1 ZINC000886272530 592192951 /nfs/dbraw/zinc/19/29/51/592192951.db2.gz RYJVHENZBVVORG-SECBINFHSA-N 1 2 246.314 2.136 20 0 BEADLO Cc1ncccc1C[NH2+][C@@H](C)c1ncco1 ZINC000886273534 592194027 /nfs/dbraw/zinc/19/40/27/592194027.db2.gz BBITZRJDZVLOQS-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO C[N@@H+](Cc1cnc[nH]1)C[C@@H]1CCC2(CCC2)CO1 ZINC000886274469 592195080 /nfs/dbraw/zinc/19/50/80/592195080.db2.gz UFGUHNLKNXTCLT-ZDUSSCGKSA-N 1 2 249.358 2.191 20 0 BEADLO C[N@H+](Cc1cnc[nH]1)C[C@@H]1CCC2(CCC2)CO1 ZINC000886274469 592195082 /nfs/dbraw/zinc/19/50/82/592195082.db2.gz UFGUHNLKNXTCLT-ZDUSSCGKSA-N 1 2 249.358 2.191 20 0 BEADLO C[N@@H+](Cc1c[nH]cn1)C[C@@H]1CCC2(CCC2)CO1 ZINC000886274469 592195084 /nfs/dbraw/zinc/19/50/84/592195084.db2.gz UFGUHNLKNXTCLT-ZDUSSCGKSA-N 1 2 249.358 2.191 20 0 BEADLO C[N@H+](Cc1c[nH]cn1)C[C@@H]1CCC2(CCC2)CO1 ZINC000886274469 592195086 /nfs/dbraw/zinc/19/50/86/592195086.db2.gz UFGUHNLKNXTCLT-ZDUSSCGKSA-N 1 2 249.358 2.191 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2C[C@@H]3C[C@@H]3C2)s1 ZINC000886347985 592213963 /nfs/dbraw/zinc/21/39/63/592213963.db2.gz CYHQXVMKVWKMHY-DTORHVGOSA-N 1 2 223.345 2.113 20 0 BEADLO CC(C)c1nnc(C[N@H+]2C[C@@H]3C[C@@H]3C2)s1 ZINC000886347985 592213965 /nfs/dbraw/zinc/21/39/65/592213965.db2.gz CYHQXVMKVWKMHY-DTORHVGOSA-N 1 2 223.345 2.113 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1cccnc1)c1ncco1 ZINC000886530011 592247596 /nfs/dbraw/zinc/24/75/96/592247596.db2.gz BJIWYNQLUIFOPL-NXEZZACHSA-N 1 2 217.272 2.481 20 0 BEADLO COC(=O)[C@@H]1CC[C@H](Nc2c[nH+]cc(C)c2)C1 ZINC000886577903 592266824 /nfs/dbraw/zinc/26/68/24/592266824.db2.gz BIYUMNINFNDECX-MNOVXSKESA-N 1 2 234.299 2.144 20 0 BEADLO COC(=O)[C@H]1CC[C@H](Nc2c[nH+]cc(C)c2)C1 ZINC000886577904 592267182 /nfs/dbraw/zinc/26/71/82/592267182.db2.gz BIYUMNINFNDECX-QWRGUYRKSA-N 1 2 234.299 2.144 20 0 BEADLO CCC[C@H](C)C(=O)N1CCc2c([nH+]cn2CC)C1 ZINC000886621492 592277453 /nfs/dbraw/zinc/27/74/53/592277453.db2.gz QXUYEITUVPNDAS-NSHDSACASA-N 1 2 249.358 2.224 20 0 BEADLO CCn1ccc(C[NH2+][C@@H]2CCc3cccnc32)n1 ZINC000886625743 592281671 /nfs/dbraw/zinc/28/16/71/592281671.db2.gz ZAIIUJHTGJSNPL-CYBMUJFWSA-N 1 2 242.326 2.075 20 0 BEADLO COC(=O)[C@@H]1CC[C@H](Nc2c[nH+]c(C)c(C)c2)C1 ZINC000886651768 592290895 /nfs/dbraw/zinc/29/08/95/592290895.db2.gz QOSNVBOFRAPQEO-NEPJUHHUSA-N 1 2 248.326 2.452 20 0 BEADLO CC(C)CC(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000075556692 592313842 /nfs/dbraw/zinc/31/38/42/592313842.db2.gz HBMVBEVRVFJGFW-LLVKDONJSA-N 1 2 235.331 2.162 20 0 BEADLO Cn1cc[nH+]c1CN(CC(F)F)C1CCC1 ZINC000887099208 592441119 /nfs/dbraw/zinc/44/11/19/592441119.db2.gz VOIJFRQOCPEZME-UHFFFAOYSA-N 1 2 229.274 2.040 20 0 BEADLO CC1(C[N@H+](CC(F)F)C2CCC2)COC1 ZINC000887099115 592442015 /nfs/dbraw/zinc/44/20/15/592442015.db2.gz RMDHIHIHPASOIE-UHFFFAOYSA-N 1 2 219.275 2.143 20 0 BEADLO CC1(C[N@@H+](CC(F)F)C2CCC2)COC1 ZINC000887099115 592442018 /nfs/dbraw/zinc/44/20/18/592442018.db2.gz RMDHIHIHPASOIE-UHFFFAOYSA-N 1 2 219.275 2.143 20 0 BEADLO C[C@@H](c1nc(C2CC2)no1)[N@H+](C)CCCF ZINC000887137856 592452908 /nfs/dbraw/zinc/45/29/08/592452908.db2.gz VWVLSZJMLJWYKX-QMMMGPOBSA-N 1 2 227.283 2.299 20 0 BEADLO C[C@@H](c1nc(C2CC2)no1)[N@@H+](C)CCCF ZINC000887137856 592452910 /nfs/dbraw/zinc/45/29/10/592452910.db2.gz VWVLSZJMLJWYKX-QMMMGPOBSA-N 1 2 227.283 2.299 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@H+](C)CCCF ZINC000887142738 592459427 /nfs/dbraw/zinc/45/94/27/592459427.db2.gz YBNFOAHVIXQITI-JTQLQIEISA-N 1 2 245.319 2.254 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@@H+](C)CCCF ZINC000887142738 592459432 /nfs/dbraw/zinc/45/94/32/592459432.db2.gz YBNFOAHVIXQITI-JTQLQIEISA-N 1 2 245.319 2.254 20 0 BEADLO CCCC[N@@H+]1CC(=O)N[C@]12C[C@@H]1CC[C@@H](C1)C2 ZINC000887326501 592481538 /nfs/dbraw/zinc/48/15/38/592481538.db2.gz DSVFQRZWKXCULD-DABQJJPHSA-N 1 2 236.359 2.125 20 0 BEADLO CCCC[N@H+]1CC(=O)N[C@]12C[C@@H]1CC[C@@H](C1)C2 ZINC000887326501 592481542 /nfs/dbraw/zinc/48/15/42/592481542.db2.gz DSVFQRZWKXCULD-DABQJJPHSA-N 1 2 236.359 2.125 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N1CC[C@@H]1C1CCCC1 ZINC000889407155 592609082 /nfs/dbraw/zinc/60/90/82/592609082.db2.gz KFQURCQLEFUXHF-CYBMUJFWSA-N 1 2 247.342 2.133 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N1CC[C@@H]1C1CCCC1 ZINC000889407155 592609083 /nfs/dbraw/zinc/60/90/83/592609083.db2.gz KFQURCQLEFUXHF-CYBMUJFWSA-N 1 2 247.342 2.133 20 0 BEADLO C[C@H](CC(=O)N[C@@H]1C[C@@H]2CCC[C@H]12)n1cc[nH+]c1 ZINC000889613349 592629748 /nfs/dbraw/zinc/62/97/48/592629748.db2.gz YSXCZWGAVKISDX-MROQNXINSA-N 1 2 247.342 2.139 20 0 BEADLO O=C(Cn1cc[nH+]c1)NC[C@H]1CCC=CCCC1 ZINC000890045733 592671102 /nfs/dbraw/zinc/67/11/02/592671102.db2.gz QLVSQLAEBZIJHY-ZDUSSCGKSA-N 1 2 247.342 2.136 20 0 BEADLO Cn1c[nH+]c(CNC(=O)C2CCC3(CC3)CC2)c1 ZINC000890104320 592679784 /nfs/dbraw/zinc/67/97/84/592679784.db2.gz XDQSEMIHQXZFSG-UHFFFAOYSA-N 1 2 247.342 2.007 20 0 BEADLO CC1=CC[C@@](C)(C(=O)NCc2cn(C)c[nH+]2)CC1 ZINC000890103652 592680305 /nfs/dbraw/zinc/68/03/05/592680305.db2.gz OELRKKGTTRKLSF-CQSZACIVSA-N 1 2 247.342 2.173 20 0 BEADLO CCC[C@@](C)(CC)C(=O)NCc1cn(C)c[nH+]1 ZINC000890108301 592682769 /nfs/dbraw/zinc/68/27/69/592682769.db2.gz WZJJIFZRFFPHIT-CYBMUJFWSA-N 1 2 237.347 2.253 20 0 BEADLO Cn1c[nH+]c(CNC(=O)C2(C)CCCCCC2)c1 ZINC000890109732 592683747 /nfs/dbraw/zinc/68/37/47/592683747.db2.gz ROQLJRCZFJYVMA-UHFFFAOYSA-N 1 2 249.358 2.397 20 0 BEADLO Cn1c[nH+]c(CNC(=O)CCCC(C)(C)C)c1 ZINC000890113362 592684669 /nfs/dbraw/zinc/68/46/69/592684669.db2.gz AKHQFJJGVYVGGG-UHFFFAOYSA-N 1 2 237.347 2.253 20 0 BEADLO CC(F)(F)C[NH2+][C@H]1CCc2cccnc21 ZINC000829299907 592707847 /nfs/dbraw/zinc/70/78/47/592707847.db2.gz LWIURTZUCSDUOZ-VIFPVBQESA-N 1 2 212.243 2.314 20 0 BEADLO Cc1csc([C@@H](C)[NH2+]Cc2cncn2C)n1 ZINC000082403792 634385366 /nfs/dbraw/zinc/38/53/66/634385366.db2.gz NJPLRQDXDQRKIU-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO C#C[C@@H](C)OC(=O)[C@@H](c1ccccc1)[N@@H+](C)CC ZINC000245878276 634614002 /nfs/dbraw/zinc/61/40/02/634614002.db2.gz MXSLMBDURDGBNC-TZMCWYRMSA-N 1 2 245.322 2.244 20 0 BEADLO C#C[C@@H](C)OC(=O)[C@@H](c1ccccc1)[N@H+](C)CC ZINC000245878276 634614007 /nfs/dbraw/zinc/61/40/07/634614007.db2.gz MXSLMBDURDGBNC-TZMCWYRMSA-N 1 2 245.322 2.244 20 0 BEADLO CC[NH2+]Cc1noc([C@H](C)c2ccccc2)n1 ZINC000233548951 635534017 /nfs/dbraw/zinc/53/40/17/635534017.db2.gz ZHZHTRVRNXBSKM-SNVBAGLBSA-N 1 2 231.299 2.331 20 0 BEADLO C[C@H]1C[N@H+](C/C(Cl)=C\Cl)CCCO1 ZINC000255321804 631221765 /nfs/dbraw/zinc/22/17/65/631221765.db2.gz IIRFJPPOIZVYOW-MOIHINDBSA-N 1 2 224.131 2.416 20 0 BEADLO C[C@H]1C[N@@H+](C/C(Cl)=C\Cl)CCCO1 ZINC000255321804 631221775 /nfs/dbraw/zinc/22/17/75/631221775.db2.gz IIRFJPPOIZVYOW-MOIHINDBSA-N 1 2 224.131 2.416 20 0 BEADLO CCN(C(=O)Cc1c[nH]c[nH+]1)c1cccc(C)c1 ZINC000074673747 631236477 /nfs/dbraw/zinc/23/64/77/631236477.db2.gz SLYYXLXQHKMWBF-UHFFFAOYSA-N 1 2 243.310 2.314 20 0 BEADLO COc1ccc2ccc(NC[C@@H](C)O)[nH+]c2c1 ZINC000891437661 631255539 /nfs/dbraw/zinc/25/55/39/631255539.db2.gz WCCBDMHETKNIIY-SECBINFHSA-N 1 2 232.283 2.036 20 0 BEADLO COC[C@@H]1COCC[N@@H+]1C/C=C\c1ccccc1 ZINC000933334145 631270849 /nfs/dbraw/zinc/27/08/49/631270849.db2.gz DYYUJSXECBZVER-GTBONMDNSA-N 1 2 247.338 2.047 20 0 BEADLO COC[C@@H]1COCC[N@H+]1C/C=C\c1ccccc1 ZINC000933334145 631270851 /nfs/dbraw/zinc/27/08/51/631270851.db2.gz DYYUJSXECBZVER-GTBONMDNSA-N 1 2 247.338 2.047 20 0 BEADLO CC1(C)C[N@H+](C/C(Cl)=C\Cl)C[C@H]1O ZINC000308299851 631274326 /nfs/dbraw/zinc/27/43/26/631274326.db2.gz LJHHJBLUTWGCAJ-HOOMWESVSA-N 1 2 224.131 2.008 20 0 BEADLO CC1(C)C[N@@H+](C/C(Cl)=C\Cl)C[C@H]1O ZINC000308299851 631274332 /nfs/dbraw/zinc/27/43/32/631274332.db2.gz LJHHJBLUTWGCAJ-HOOMWESVSA-N 1 2 224.131 2.008 20 0 BEADLO Nc1ccc(CNC(=O)CCC2CCCC2)c[nH+]1 ZINC000308372055 631312799 /nfs/dbraw/zinc/31/27/99/631312799.db2.gz FKZNIEKRXUVHLH-UHFFFAOYSA-N 1 2 247.342 2.250 20 0 BEADLO C[Si](C)(C)c1ccc(C[NH+]2CCOCC2)cc1 ZINC000235732089 631322267 /nfs/dbraw/zinc/32/22/67/631322267.db2.gz HIPRURGYZQLSLE-UHFFFAOYSA-N 1 2 249.430 2.064 20 0 BEADLO C[C@@H]1C[C@H](C)CN1C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000933368938 631328352 /nfs/dbraw/zinc/32/83/52/631328352.db2.gz NFUZXQZTCBVIEC-VHSXEESVSA-N 1 2 243.310 2.433 20 0 BEADLO Cc1cc(C[NH+]2CCSCC2)cnc1F ZINC000891572612 631396618 /nfs/dbraw/zinc/39/66/18/631396618.db2.gz XPGOKFBMUVJNIT-UHFFFAOYSA-N 1 2 226.320 2.078 20 0 BEADLO O=C(NC1CCCC1)c1cccc2[nH+]ccn21 ZINC000082301004 631403582 /nfs/dbraw/zinc/40/35/82/631403582.db2.gz OZVSITIKGWXANN-UHFFFAOYSA-N 1 2 229.283 2.007 20 0 BEADLO C[C@H]1COCC[N@@H+]1Cc1nccc2c1CCCC2 ZINC000891696691 631453963 /nfs/dbraw/zinc/45/39/63/631453963.db2.gz WCPKPANCZMUFAW-LBPRGKRZSA-N 1 2 246.354 2.181 20 0 BEADLO C[C@H]1COCC[N@H+]1Cc1nccc2c1CCCC2 ZINC000891696691 631453971 /nfs/dbraw/zinc/45/39/71/631453971.db2.gz WCPKPANCZMUFAW-LBPRGKRZSA-N 1 2 246.354 2.181 20 0 BEADLO CCn1c[nH+]cc1CNc1ccc2c(c1)OCO2 ZINC000090169853 631525865 /nfs/dbraw/zinc/52/58/65/631525865.db2.gz HOYLRJIIMGHKSN-UHFFFAOYSA-N 1 2 245.282 2.244 20 0 BEADLO C[C@@H](c1cc(F)ccc1F)[N@@H+]1CC[C@H]1CO ZINC000934027500 631617981 /nfs/dbraw/zinc/61/79/81/631617981.db2.gz VAFCWTUJPRKLRT-WPRPVWTQSA-N 1 2 227.254 2.092 20 0 BEADLO C[C@@H](c1cc(F)ccc1F)[N@H+]1CC[C@H]1CO ZINC000934027500 631617984 /nfs/dbraw/zinc/61/79/84/631617984.db2.gz VAFCWTUJPRKLRT-WPRPVWTQSA-N 1 2 227.254 2.092 20 0 BEADLO C[C@H](c1ccc(F)cc1F)[N@@H+]1CC[C@H]1CO ZINC000934028759 631628111 /nfs/dbraw/zinc/62/81/11/631628111.db2.gz ZMFGMWCPTCWCQT-SCZZXKLOSA-N 1 2 227.254 2.092 20 0 BEADLO C[C@H](c1ccc(F)cc1F)[N@H+]1CC[C@H]1CO ZINC000934028759 631628116 /nfs/dbraw/zinc/62/81/16/631628116.db2.gz ZMFGMWCPTCWCQT-SCZZXKLOSA-N 1 2 227.254 2.092 20 0 BEADLO C[C@@]1(C(=O)OCc2cc[nH+]c(N)c2)C=CCC1 ZINC000924407814 631739490 /nfs/dbraw/zinc/73/94/90/631739490.db2.gz LJLCPMFZQYGUJR-CYBMUJFWSA-N 1 2 232.283 2.063 20 0 BEADLO O[C@H]1CC[N@H+](CCCCC(F)(F)F)C[C@H]1F ZINC000934564524 631928016 /nfs/dbraw/zinc/92/80/16/631928016.db2.gz DBYRRNPOZYWECJ-BDAKNGLRSA-N 1 2 243.244 2.124 20 0 BEADLO O[C@H]1CC[N@@H+](CCCCC(F)(F)F)C[C@H]1F ZINC000934564524 631928018 /nfs/dbraw/zinc/92/80/18/631928018.db2.gz DBYRRNPOZYWECJ-BDAKNGLRSA-N 1 2 243.244 2.124 20 0 BEADLO C[C@H](c1ccccc1F)[N@@H+]1CC[C@@H](O)[C@H](F)C1 ZINC000934584893 631956584 /nfs/dbraw/zinc/95/65/84/631956584.db2.gz ZUTGULGWGFLYFA-OASPWFOLSA-N 1 2 241.281 2.291 20 0 BEADLO C[C@H](c1ccccc1F)[N@H+]1CC[C@@H](O)[C@H](F)C1 ZINC000934584893 631956593 /nfs/dbraw/zinc/95/65/93/631956593.db2.gz ZUTGULGWGFLYFA-OASPWFOLSA-N 1 2 241.281 2.291 20 0 BEADLO CCc1cc(N2CC(CC)C2)nc(CC)[nH+]1 ZINC000894144678 635716165 /nfs/dbraw/zinc/71/61/65/635716165.db2.gz DVJQKFINGICVIE-UHFFFAOYSA-N 1 2 219.332 2.448 20 0 BEADLO C[N@@H+](C/C(Cl)=C/Cl)C[C@H](O)C1CC1 ZINC000156629398 632397319 /nfs/dbraw/zinc/39/73/19/632397319.db2.gz WHBGRCGZNXTSPX-OTOXVQDCSA-N 1 2 224.131 2.008 20 0 BEADLO C[N@H+](C/C(Cl)=C/Cl)C[C@H](O)C1CC1 ZINC000156629398 632397326 /nfs/dbraw/zinc/39/73/26/632397326.db2.gz WHBGRCGZNXTSPX-OTOXVQDCSA-N 1 2 224.131 2.008 20 0 BEADLO CC(C)C1CN(C(=O)c2cc3c[nH+]ccc3[nH]2)C1 ZINC000935064372 632435651 /nfs/dbraw/zinc/43/56/51/632435651.db2.gz MIECTJRGWDASDJ-UHFFFAOYSA-N 1 2 243.310 2.291 20 0 BEADLO Cc1ncc(CCNc2cc[nH+]c(C)n2)s1 ZINC000309692460 632651586 /nfs/dbraw/zinc/65/15/86/632651586.db2.gz JZWIBNQLDYRQDY-UHFFFAOYSA-N 1 2 234.328 2.205 20 0 BEADLO COCc1cc[nH+]c(N[C@H](C)c2nonc2C)c1 ZINC000926658802 632783033 /nfs/dbraw/zinc/78/30/33/632783033.db2.gz GBVDJUOSVSSKSU-MRVPVSSYSA-N 1 2 248.286 2.093 20 0 BEADLO CC[C@@H]1COC[C@H]1Nc1cc(COC)cc[nH+]1 ZINC000926660525 632787427 /nfs/dbraw/zinc/78/74/27/632787427.db2.gz JOTHTHYQBJCXJU-VXGBXAGGSA-N 1 2 236.315 2.065 20 0 BEADLO CC(C)=CC(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC000152592072 632803616 /nfs/dbraw/zinc/80/36/16/632803616.db2.gz OTSHOUOHWIALQD-UHFFFAOYSA-N 1 2 233.315 2.361 20 0 BEADLO CN(C(=O)CCCn1cc[nH+]c1)c1ccsc1 ZINC000892549372 632956434 /nfs/dbraw/zinc/95/64/34/632956434.db2.gz RUBMTKJCKRWNOT-UHFFFAOYSA-N 1 2 249.339 2.388 20 0 BEADLO CCC[C@@H](OC)c1noc([C@@H](C)[NH+](C)C)n1 ZINC000924082034 633001219 /nfs/dbraw/zinc/00/12/19/633001219.db2.gz TVSSZYVCHDQVNR-RKDXNWHRSA-N 1 2 227.308 2.180 20 0 BEADLO COC1(c2noc([C@@H](C)[NH+](C)C)n2)CCCC1 ZINC000923976197 635883735 /nfs/dbraw/zinc/88/37/35/635883735.db2.gz QQISQGKNQAKBLK-SECBINFHSA-N 1 2 239.319 2.108 20 0 BEADLO CCc1cc(N2CCC[C@@H]2COC)nc(CC)[nH+]1 ZINC000894758204 635922982 /nfs/dbraw/zinc/92/29/82/635922982.db2.gz DHQMLCWPNJEJMZ-GFCCVEGCSA-N 1 2 249.358 2.217 20 0 BEADLO C[N@H+](CCF)Cc1ccc(Cl)nc1 ZINC000308249200 633220237 /nfs/dbraw/zinc/22/02/37/633220237.db2.gz AVKMMZTURUBKNU-UHFFFAOYSA-N 1 2 202.660 2.136 20 0 BEADLO C[N@@H+](CCF)Cc1ccc(Cl)nc1 ZINC000308249200 633220244 /nfs/dbraw/zinc/22/02/44/633220244.db2.gz AVKMMZTURUBKNU-UHFFFAOYSA-N 1 2 202.660 2.136 20 0 BEADLO CC1(C)C[N@H+](C/C(Cl)=C/Cl)C[C@@H]1O ZINC000306755707 635974358 /nfs/dbraw/zinc/97/43/58/635974358.db2.gz LJHHJBLUTWGCAJ-PFPYCLJUSA-N 1 2 224.131 2.008 20 0 BEADLO CC1(C)C[N@@H+](C/C(Cl)=C/Cl)C[C@@H]1O ZINC000306755707 635974363 /nfs/dbraw/zinc/97/43/63/635974363.db2.gz LJHHJBLUTWGCAJ-PFPYCLJUSA-N 1 2 224.131 2.008 20 0 BEADLO COCC[C@H]([NH2+]Cc1cnc[nH]1)c1ccc(C)o1 ZINC000280300949 633752686 /nfs/dbraw/zinc/75/26/86/633752686.db2.gz VTEMXMDQGABNKE-LBPRGKRZSA-N 1 2 249.314 2.179 20 0 BEADLO COCC[C@@H]([NH2+]Cc1cnc[nH]1)c1ccc(C)o1 ZINC000280300948 633753740 /nfs/dbraw/zinc/75/37/40/633753740.db2.gz VTEMXMDQGABNKE-GFCCVEGCSA-N 1 2 249.314 2.179 20 0 BEADLO c1cc(C[NH2+][C@@H]2CCCc3c[nH]nc32)co1 ZINC000309537222 633948356 /nfs/dbraw/zinc/94/83/56/633948356.db2.gz CZTTZFFTUWXPRB-LLVKDONJSA-N 1 2 217.272 2.170 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@H]1CS[C@@H](C(C)C)C1 ZINC000309960295 633986027 /nfs/dbraw/zinc/98/60/27/633986027.db2.gz KRYJDAHGKVUAOA-HBNTYKKESA-N 1 2 245.388 2.058 20 0 BEADLO CSC1(c2noc([C@@H](C)[NH+](C)C)n2)CC1 ZINC000924116415 634007334 /nfs/dbraw/zinc/00/73/34/634007334.db2.gz HNEAWSIRQCAWEQ-SSDOTTSWSA-N 1 2 227.333 2.044 20 0 BEADLO CC[C@](C)([NH2+]CCSC(C)(C)C)C(=O)OC ZINC000310008775 634063121 /nfs/dbraw/zinc/06/31/21/634063121.db2.gz HWKUWBYYSUXMBW-LBPRGKRZSA-N 1 2 247.404 2.449 20 0 BEADLO C=Cn1cc(C[N@@H+](C)Cc2c(C)noc2C)cn1 ZINC000193737991 634289130 /nfs/dbraw/zinc/28/91/30/634289130.db2.gz JMJPWLQUQRJDBN-UHFFFAOYSA-N 1 2 246.314 2.220 20 0 BEADLO C=Cn1cc(C[N@H+](C)Cc2c(C)noc2C)cn1 ZINC000193737991 634289135 /nfs/dbraw/zinc/28/91/35/634289135.db2.gz JMJPWLQUQRJDBN-UHFFFAOYSA-N 1 2 246.314 2.220 20 0 BEADLO Cc1nc2c(c(=O)[nH]1)C[N@H+](Cc1ccsc1)C2 ZINC000931311612 634327571 /nfs/dbraw/zinc/32/75/71/634327571.db2.gz LPJOACCEHRTOQH-UHFFFAOYSA-N 1 2 247.323 2.068 20 0 BEADLO CC(C)=C(C)CC(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000896907869 636250806 /nfs/dbraw/zinc/25/08/06/636250806.db2.gz SUUVJXCRERHVLL-UHFFFAOYSA-N 1 2 235.331 2.389 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@]2(C)C[C@H]3C[C@H]3C2)[nH+]c1C ZINC000896908166 636250966 /nfs/dbraw/zinc/25/09/66/636250966.db2.gz XJQRPQIYXCJKKT-GNXNZQSNSA-N 1 2 247.342 2.079 20 0 BEADLO Cc1[nH]c(CNC(=O)CCCC2CC2)[nH+]c1C ZINC000896910743 636253210 /nfs/dbraw/zinc/25/32/10/636253210.db2.gz VUALZCKMPYITCN-UHFFFAOYSA-N 1 2 235.331 2.223 20 0 BEADLO C[C@H](NCc1ccon1)c1cn2c([nH+]1)CCCC2 ZINC000925211262 636390342 /nfs/dbraw/zinc/39/03/42/636390342.db2.gz IRMJBXYZKKNESZ-JTQLQIEISA-N 1 2 246.314 2.058 20 0 BEADLO Cc1nonc1[C@H](C)[NH2+][C@H](C)c1cnccc1C ZINC000925295506 636782543 /nfs/dbraw/zinc/78/25/43/636782543.db2.gz XSVJWPHQGPJYSQ-ZJUUUORDSA-N 1 2 246.314 2.493 20 0 BEADLO C[C@H](c1nc(COc2ccccc2)no1)[NH+](C)C ZINC000923808691 637033386 /nfs/dbraw/zinc/03/33/86/637033386.db2.gz GQRIRHADJGHOSP-SNVBAGLBSA-N 1 2 247.298 2.271 20 0 BEADLO C[C@@H]1CC[C@H](C)N(C(=O)CNc2cccc[nH+]2)C1 ZINC000900903421 637197238 /nfs/dbraw/zinc/19/72/38/637197238.db2.gz HWASMPOUHXZRRR-NEPJUHHUSA-N 1 2 247.342 2.141 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@]2(C)CCC[C@H]2C)[nH+]c1C ZINC000901000041 637226144 /nfs/dbraw/zinc/22/61/44/637226144.db2.gz IRYKDCOSZCIDOY-OTYXRUKQSA-N 1 2 249.358 2.469 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1noc(CCC2CC2)n1 ZINC000904269378 637394734 /nfs/dbraw/zinc/39/47/34/637394734.db2.gz DIPIHXVNSYNWGB-UHFFFAOYSA-N 1 2 244.298 2.365 20 0 BEADLO C[C@H](c1nc(CCc2ccco2)no1)[NH+](C)C ZINC000923954601 637396806 /nfs/dbraw/zinc/39/68/06/637396806.db2.gz XYTIVKHGBMTPBK-SECBINFHSA-N 1 2 235.287 2.070 20 0 BEADLO Cc1[nH]cc(-c2ccc3c(c2)CCCNC3=O)[nH+]1 ZINC000904775091 637478973 /nfs/dbraw/zinc/47/89/73/637478973.db2.gz HBQCGHKWHLNKEF-UHFFFAOYSA-N 1 2 241.294 2.061 20 0 BEADLO Cc1cccc([C@@H](O)C[NH2+]CC(C)(F)F)c1 ZINC000905267005 637718689 /nfs/dbraw/zinc/71/86/89/637718689.db2.gz GYDBNIAGSBGQSW-NSHDSACASA-N 1 2 229.270 2.273 20 0 BEADLO CC/C=C\C[NH2+][C@H](C(=O)OC)[C@@H](C)CC ZINC000905769769 637924603 /nfs/dbraw/zinc/92/46/03/637924603.db2.gz JAMCCFRPALOMLD-ZXXKLBARSA-N 1 2 213.321 2.130 20 0 BEADLO CC/C=C/C[NH2+][C@H](C(=O)OC)[C@H](C)CC ZINC000905769767 637924709 /nfs/dbraw/zinc/92/47/09/637924709.db2.gz JAMCCFRPALOMLD-SFEFJYQLSA-N 1 2 213.321 2.130 20 0 BEADLO COc1ncccc1-c1c[nH+]c2n1CCCC2 ZINC000906539600 638207813 /nfs/dbraw/zinc/20/78/13/638207813.db2.gz VTYGVPMULUCRJX-UHFFFAOYSA-N 1 2 229.283 2.290 20 0 BEADLO Fc1cccc([C@H]2C[C@@H]2[NH+]2CCOCC2)c1 ZINC000906585218 638210642 /nfs/dbraw/zinc/21/06/42/638210642.db2.gz XNMSFJZPEHVFOI-OLZOCXBDSA-N 1 2 221.275 2.014 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)N1CCCC2(CCCC2)C1 ZINC000907612249 638431286 /nfs/dbraw/zinc/43/12/86/638431286.db2.gz BSFCGKOSXRGART-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO C[C@@H](CC1CCCCC1)NC(=O)Cc1c[nH]c[nH+]1 ZINC000907796126 638474172 /nfs/dbraw/zinc/47/41/72/638474172.db2.gz AVNIKYQCLBZLOV-NSHDSACASA-N 1 2 249.358 2.427 20 0 BEADLO C[C@@H]1CCC[C@H](CNC(=O)Cc2c[nH]c[nH+]2)[C@@H]1C ZINC000907924207 638514390 /nfs/dbraw/zinc/51/43/90/638514390.db2.gz IFQZJLKBUGDAFS-IJLUTSLNSA-N 1 2 249.358 2.141 20 0 BEADLO CCN(CC(C)=O)C(=O)c1c(C)cc(C)[nH+]c1C ZINC000908393585 638692878 /nfs/dbraw/zinc/69/28/78/638692878.db2.gz GSQIHRZSONEDMX-UHFFFAOYSA-N 1 2 248.326 2.058 20 0 BEADLO Cc1cc(C)c(C(=O)N2CC3(CC3)C2)c(C)[nH+]1 ZINC000908519945 638754939 /nfs/dbraw/zinc/75/49/39/638754939.db2.gz WZUWWERXVDYARJ-UHFFFAOYSA-N 1 2 230.311 2.243 20 0 BEADLO CC(C)[C@@H]1CN(C(=O)Cc2c[nH+]c[nH]2)[C@H]1C(C)C ZINC000909052758 639132202 /nfs/dbraw/zinc/13/22/02/639132202.db2.gz SMKCWSGDAHODBE-JSGCOSHPSA-N 1 2 249.358 2.091 20 0 BEADLO CC[C@@H](NC(=O)Cc1c[nH]c[nH+]1)C1CCCC1 ZINC000909279832 639194393 /nfs/dbraw/zinc/19/43/93/639194393.db2.gz MGARFJKCPCSTDM-GFCCVEGCSA-N 1 2 235.331 2.037 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1NC(=O)CNc1cccc[nH+]1 ZINC000909903659 639265807 /nfs/dbraw/zinc/26/58/07/639265807.db2.gz RHVKBUNTAOZKHF-RISCZKNCSA-N 1 2 247.342 2.044 20 0 BEADLO CCC[C@H](NC(=O)Cc1c[nH]c[nH+]1)C1CCCC1 ZINC000909928837 639277646 /nfs/dbraw/zinc/27/76/46/639277646.db2.gz IZTPGFHDSILGDV-ZDUSSCGKSA-N 1 2 249.358 2.427 20 0 BEADLO CC(F)(F)CCC[N@@H+]1CCO[C@@H](C(F)F)C1 ZINC000930341853 639716918 /nfs/dbraw/zinc/71/69/18/639716918.db2.gz FVFMZWAKZPEMPP-MRVPVSSYSA-N 1 2 243.244 2.388 20 0 BEADLO CC(F)(F)CCC[N@H+]1CCO[C@@H](C(F)F)C1 ZINC000930341853 639716920 /nfs/dbraw/zinc/71/69/20/639716920.db2.gz FVFMZWAKZPEMPP-MRVPVSSYSA-N 1 2 243.244 2.388 20 0 BEADLO Cc1cc(NC(=O)N2CCCCC2)c(C)c[nH+]1 ZINC000930626052 639828274 /nfs/dbraw/zinc/82/82/74/639828274.db2.gz QQYVZIRPVCXWOC-UHFFFAOYSA-N 1 2 233.315 2.138 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N(C)c1ccsc1 ZINC000912003727 639919880 /nfs/dbraw/zinc/91/98/80/639919880.db2.gz NQAHYZXUAYCBFW-VIFPVBQESA-N 1 2 249.339 2.313 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N(C)c1ccsc1 ZINC000912003727 639919883 /nfs/dbraw/zinc/91/98/83/639919883.db2.gz NQAHYZXUAYCBFW-VIFPVBQESA-N 1 2 249.339 2.313 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@@H](CC)OC[C@H]2C)o1 ZINC000930851755 639947007 /nfs/dbraw/zinc/94/70/07/639947007.db2.gz JQWJKZLBCXXEGP-GHMZBOCLSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@@H](CC)OC[C@H]2C)o1 ZINC000930851755 639947011 /nfs/dbraw/zinc/94/70/11/639947011.db2.gz JQWJKZLBCXXEGP-GHMZBOCLSA-N 1 2 238.331 2.236 20 0 BEADLO Cc1noc(CN(C)Cc2cc(C)cc(C)[nH+]2)n1 ZINC000930890832 639973021 /nfs/dbraw/zinc/97/30/21/639973021.db2.gz CELVKPHBJXJJKM-UHFFFAOYSA-N 1 2 246.314 2.022 20 0 BEADLO CC[C@H](C)[N@H+](CC)Cc1nnc(OC)s1 ZINC000930922151 639990721 /nfs/dbraw/zinc/99/07/21/639990721.db2.gz KPJZITMSNWJAIC-QMMMGPOBSA-N 1 2 229.349 2.167 20 0 BEADLO CC[C@H](C)[N@@H+](CC)Cc1nnc(OC)s1 ZINC000930922151 639990727 /nfs/dbraw/zinc/99/07/27/639990727.db2.gz KPJZITMSNWJAIC-QMMMGPOBSA-N 1 2 229.349 2.167 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2cscn2)c(C)nn1 ZINC000930963598 640001075 /nfs/dbraw/zinc/00/10/75/640001075.db2.gz KJAQQZAEYRSGCC-SNVBAGLBSA-N 1 2 248.355 2.401 20 0 BEADLO O=C(CNc1cccc[nH+]1)NCCCC1CCC1 ZINC000912502385 640099715 /nfs/dbraw/zinc/09/97/15/640099715.db2.gz ADKFRFDIGJNLNR-UHFFFAOYSA-N 1 2 247.342 2.190 20 0 BEADLO CCC1(CC)CCCN(C(=O)Cc2c[nH+]c[nH]2)C1 ZINC000912506383 640101374 /nfs/dbraw/zinc/10/13/74/640101374.db2.gz KTCYOMGNFXTBOI-UHFFFAOYSA-N 1 2 249.358 2.381 20 0 BEADLO CCC/C=C\C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000912615080 640138703 /nfs/dbraw/zinc/13/87/03/640138703.db2.gz VGZGCDICGYMDSF-SREVYHEPSA-N 1 2 235.331 2.091 20 0 BEADLO CC(C)=C(C)C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000912615626 640139870 /nfs/dbraw/zinc/13/98/70/640139870.db2.gz NKTADHPHLQVVHX-UHFFFAOYSA-N 1 2 235.331 2.091 20 0 BEADLO CC(C)[C@@H](NC(=O)CNc1cccc[nH+]1)C1CC1 ZINC000912692394 640167406 /nfs/dbraw/zinc/16/74/06/640167406.db2.gz FCDBDEAKVIMSEF-CQSZACIVSA-N 1 2 247.342 2.044 20 0 BEADLO COC[C@H](C[N@@H+]1CC[C@@H]1C(F)F)C(C)C ZINC000931426575 640194454 /nfs/dbraw/zinc/19/44/54/640194454.db2.gz NCCICTWLPYMHJW-VHSXEESVSA-N 1 2 221.291 2.244 20 0 BEADLO COC[C@H](C[N@H+]1CC[C@@H]1C(F)F)C(C)C ZINC000931426575 640194459 /nfs/dbraw/zinc/19/44/59/640194459.db2.gz NCCICTWLPYMHJW-VHSXEESVSA-N 1 2 221.291 2.244 20 0 BEADLO Cc1ccc(F)c(C[N@@H+]2CC=C[C@H]2CO)c1F ZINC000931702375 640328017 /nfs/dbraw/zinc/32/80/17/640328017.db2.gz CLFUKDCPLNRJOV-JTQLQIEISA-N 1 2 239.265 2.006 20 0 BEADLO Cc1ccc(F)c(C[N@H+]2CC=C[C@H]2CO)c1F ZINC000931702375 640328020 /nfs/dbraw/zinc/32/80/20/640328020.db2.gz CLFUKDCPLNRJOV-JTQLQIEISA-N 1 2 239.265 2.006 20 0 BEADLO COc1c(C)c[nH+]c(CNC(=O)C2(C)CC2)c1C ZINC000151473442 640391509 /nfs/dbraw/zinc/39/15/09/640391509.db2.gz PAMUHPRNLNVZDS-UHFFFAOYSA-N 1 2 248.326 2.123 20 0 BEADLO CCOc1cccc(C[NH2+]Cc2c[nH]cn2)c1 ZINC000054764998 640408752 /nfs/dbraw/zinc/40/87/52/640408752.db2.gz YEQBJLUNYOLXTL-UHFFFAOYSA-N 1 2 231.299 2.098 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2nc3ccccc3[nH]2)CCO1 ZINC000932335182 640477438 /nfs/dbraw/zinc/47/74/38/640477438.db2.gz GRVNZNWVMVAYHB-LLVKDONJSA-N 1 2 245.326 2.174 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2nc3ccccc3[nH]2)CCO1 ZINC000932335182 640477443 /nfs/dbraw/zinc/47/74/43/640477443.db2.gz GRVNZNWVMVAYHB-LLVKDONJSA-N 1 2 245.326 2.174 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CCO[C@@H](C)CC2)s1 ZINC000932346481 640487905 /nfs/dbraw/zinc/48/79/05/640487905.db2.gz IPIPNVBRLXKLLA-DTWKUNHWSA-N 1 2 241.360 2.018 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CCO[C@@H](C)CC2)s1 ZINC000932346481 640487909 /nfs/dbraw/zinc/48/79/09/640487909.db2.gz IPIPNVBRLXKLLA-DTWKUNHWSA-N 1 2 241.360 2.018 20 0 BEADLO Cc1nc(C[N@@H+]2CCO[C@H](C)CC2)cs1 ZINC000932347199 640491297 /nfs/dbraw/zinc/49/12/97/640491297.db2.gz MQFNYHUYFKSXOY-SECBINFHSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1nc(C[N@H+]2CCO[C@H](C)CC2)cs1 ZINC000932347199 640491302 /nfs/dbraw/zinc/49/13/02/640491302.db2.gz MQFNYHUYFKSXOY-SECBINFHSA-N 1 2 226.345 2.062 20 0 BEADLO CCc1nc(C[N@@H+]2CCO[C@H](C)CC2)cs1 ZINC000932349179 640494513 /nfs/dbraw/zinc/49/45/13/640494513.db2.gz JSJPIZYVSAKDGQ-SNVBAGLBSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nc(C[N@H+]2CCO[C@H](C)CC2)cs1 ZINC000932349179 640494519 /nfs/dbraw/zinc/49/45/19/640494519.db2.gz JSJPIZYVSAKDGQ-SNVBAGLBSA-N 1 2 240.372 2.316 20 0 BEADLO C[C@H]1C(=O)CCC[N@H+]1CCCc1ccncc1 ZINC000932849076 640623389 /nfs/dbraw/zinc/62/33/89/640623389.db2.gz YWMLQBYVTXURMU-LBPRGKRZSA-N 1 2 232.327 2.068 20 0 BEADLO C[C@H]1C(=O)CCC[N@@H+]1CCCc1ccncc1 ZINC000932849076 640623393 /nfs/dbraw/zinc/62/33/93/640623393.db2.gz YWMLQBYVTXURMU-LBPRGKRZSA-N 1 2 232.327 2.068 20 0 BEADLO CCO[C@H]1CC[N@H+](C/C(Cl)=C\Cl)C1 ZINC000932973866 640659255 /nfs/dbraw/zinc/65/92/55/640659255.db2.gz MEAQLLZOORIHBX-QRJSTWQJSA-N 1 2 224.131 2.416 20 0 BEADLO CCO[C@H]1CC[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000932973866 640659260 /nfs/dbraw/zinc/65/92/60/640659260.db2.gz MEAQLLZOORIHBX-QRJSTWQJSA-N 1 2 224.131 2.416 20 0 BEADLO CCn1c[nH+]c2c1CCN(CC(F)(F)CC)C2 ZINC000933253600 640690574 /nfs/dbraw/zinc/69/05/74/640690574.db2.gz RWGDABYZBXEOCS-UHFFFAOYSA-N 1 2 243.301 2.306 20 0 BEADLO O=C1SCCN1C[N@@H+]1CCc2ccccc2C1 ZINC000078470338 640715569 /nfs/dbraw/zinc/71/55/69/640715569.db2.gz DQICLABWZUYKMT-UHFFFAOYSA-N 1 2 248.351 2.171 20 0 BEADLO O=C1SCCN1C[N@H+]1CCc2ccccc2C1 ZINC000078470338 640715572 /nfs/dbraw/zinc/71/55/72/640715572.db2.gz DQICLABWZUYKMT-UHFFFAOYSA-N 1 2 248.351 2.171 20 0 BEADLO COc1ccc([C@@H](C)[NH2+]Cc2cnon2)cc1C ZINC000933484047 640720909 /nfs/dbraw/zinc/72/09/09/640720909.db2.gz WBSPUPVPLIFBRW-SNVBAGLBSA-N 1 2 247.298 2.237 20 0 BEADLO C[C@@H]([NH2+][C@@H]1COCc2ccccc21)c1ncc[nH]1 ZINC000226011270 640721491 /nfs/dbraw/zinc/72/14/91/640721491.db2.gz IVVPZYUGWZHOKB-ZWNOBZJWSA-N 1 2 243.310 2.332 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H]1CC[C@@H]2C[C@@H]2CC1 ZINC000933994546 640802383 /nfs/dbraw/zinc/80/23/83/640802383.db2.gz ZGNDNURQKTWHJD-ZSBIGDGJSA-N 1 2 247.342 2.161 20 0 BEADLO CC[C@@H]1CCCN(c2cc(NC)[nH+]cn2)C1 ZINC000087819200 641056492 /nfs/dbraw/zinc/05/64/92/641056492.db2.gz JQDGQNCDWFNGCF-SNVBAGLBSA-N 1 2 220.320 2.145 20 0 BEADLO CC[C@@H]1CCCN(c2cc(NC)nc[nH+]2)C1 ZINC000087819200 641056495 /nfs/dbraw/zinc/05/64/95/641056495.db2.gz JQDGQNCDWFNGCF-SNVBAGLBSA-N 1 2 220.320 2.145 20 0 BEADLO CNc1cc(N[C@@H]2CCC[C@H]2C)[nH+]cn1 ZINC000087829555 641062854 /nfs/dbraw/zinc/06/28/54/641062854.db2.gz MCXGOLVIJLLZMX-RKDXNWHRSA-N 1 2 206.293 2.119 20 0 BEADLO C[C@@H]1[C@@H](C)CCN1C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000934096825 641064400 /nfs/dbraw/zinc/06/44/00/641064400.db2.gz AIBAAVYBAPRCPK-VHSXEESVSA-N 1 2 243.310 2.433 20 0 BEADLO CNc1cc(N2CCC[C@@H]2C(C)C)nc[nH+]1 ZINC000087837241 641065424 /nfs/dbraw/zinc/06/54/24/641065424.db2.gz XIJHSHUOFJZTIO-SNVBAGLBSA-N 1 2 220.320 2.143 20 0 BEADLO CNc1cc(N2CCC[C@@H]2C(C)C)[nH+]cn1 ZINC000087837241 641065430 /nfs/dbraw/zinc/06/54/30/641065430.db2.gz XIJHSHUOFJZTIO-SNVBAGLBSA-N 1 2 220.320 2.143 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@H+](C)C/C(Cl)=C\Cl ZINC000934113541 641076224 /nfs/dbraw/zinc/07/62/24/641076224.db2.gz BITAXJPEPUAQEA-KSOOHAFHSA-N 1 2 224.131 2.415 20 0 BEADLO CO[C@@H]1CC[C@@H]1[N@@H+](C)C/C(Cl)=C\Cl ZINC000934113541 641076227 /nfs/dbraw/zinc/07/62/27/641076227.db2.gz BITAXJPEPUAQEA-KSOOHAFHSA-N 1 2 224.131 2.415 20 0 BEADLO CCc1nc(C[N@H+](C)[C@H]2CC[C@H]2OC)cs1 ZINC000934128183 641086822 /nfs/dbraw/zinc/08/68/22/641086822.db2.gz QKXWKMIIGLEBRB-WDEREUQCSA-N 1 2 240.372 2.315 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@H]2CC[C@H]2OC)cs1 ZINC000934128183 641086829 /nfs/dbraw/zinc/08/68/29/641086829.db2.gz QKXWKMIIGLEBRB-WDEREUQCSA-N 1 2 240.372 2.315 20 0 BEADLO O=C(NC1(C2CC2)CC1)c1cc2c[nH+]ccc2[nH]1 ZINC000934739840 641256985 /nfs/dbraw/zinc/25/69/85/641256985.db2.gz JHZGGLLDWMVMBB-UHFFFAOYSA-N 1 2 241.294 2.235 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc(O)c(F)c2)C[C@H](C)O1 ZINC000232449583 641273618 /nfs/dbraw/zinc/27/36/18/641273618.db2.gz VYNNIALZARUOMR-AOOOYVTPSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc(O)c(F)c2)C[C@H](C)O1 ZINC000232449583 641273624 /nfs/dbraw/zinc/27/36/24/641273624.db2.gz VYNNIALZARUOMR-AOOOYVTPSA-N 1 2 239.290 2.141 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)[C@]1(C)C=CCC1 ZINC000934913114 641301233 /nfs/dbraw/zinc/30/12/33/641301233.db2.gz UXFQOCAOLSKIMT-CQSZACIVSA-N 1 2 247.342 2.088 20 0 BEADLO C[C@@H](CC1CCC1)NC(=O)CNc1cccc[nH+]1 ZINC000913718644 641462474 /nfs/dbraw/zinc/46/24/74/641462474.db2.gz AFCZUAGKMZBDPN-NSHDSACASA-N 1 2 247.342 2.188 20 0 BEADLO C[C@@H]1C[C@H](C)N1C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000935737223 641472665 /nfs/dbraw/zinc/47/26/65/641472665.db2.gz JAZRCGXCYIUNQO-DTORHVGOSA-N 1 2 229.283 2.186 20 0 BEADLO OCc1cc[nH+]c(N2CCCCCCC2)c1 ZINC000040865013 641536341 /nfs/dbraw/zinc/53/63/41/641536341.db2.gz LMJSDWZCUHFAJA-UHFFFAOYSA-N 1 2 220.316 2.344 20 0 BEADLO CCCCN(C)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000929793229 641571707 /nfs/dbraw/zinc/57/17/07/641571707.db2.gz NEYIAYXPPAVOHV-UHFFFAOYSA-N 1 2 231.299 2.435 20 0 BEADLO Cc1cc(C)c(C(=O)N2CC[C@@H]2C)c(C)[nH+]1 ZINC000914164491 641600733 /nfs/dbraw/zinc/60/07/33/641600733.db2.gz HJKZJEYFCUOTGZ-JTQLQIEISA-N 1 2 218.300 2.241 20 0 BEADLO CCN(CC)C(=S)SCCn1cc[nH+]c1 ZINC000159354092 641679874 /nfs/dbraw/zinc/67/98/74/641679874.db2.gz TVVKTAMXFDNEKP-UHFFFAOYSA-N 1 2 243.401 2.243 20 0 BEADLO COc1cc[nH+]cc1NCc1ccc(F)nc1 ZINC000188543808 641760866 /nfs/dbraw/zinc/76/08/66/641760866.db2.gz IEWQPKWCAGSIDI-UHFFFAOYSA-N 1 2 233.246 2.236 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)Cc1ccc(F)nc1 ZINC000189301466 641801747 /nfs/dbraw/zinc/80/17/47/641801747.db2.gz BCAZYWWFOAQWHU-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)Cc1ccc(F)nc1 ZINC000189301466 641801748 /nfs/dbraw/zinc/80/17/48/641801748.db2.gz BCAZYWWFOAQWHU-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2CC2(C)C)c(N(C)C)[nH+]1 ZINC000153486348 641804378 /nfs/dbraw/zinc/80/43/78/641804378.db2.gz BOSWGDBWGCLQSK-JTQLQIEISA-N 1 2 247.342 2.441 20 0 BEADLO CCO[C@@H]1CCC[N@H+](Cc2nc(C)c(C)[nH]2)C1 ZINC000628117640 641857263 /nfs/dbraw/zinc/85/72/63/641857263.db2.gz PXLFWPCFABEZAE-GFCCVEGCSA-N 1 2 237.347 2.027 20 0 BEADLO CCO[C@@H]1CCC[N@@H+](Cc2nc(C)c(C)[nH]2)C1 ZINC000628117640 641857268 /nfs/dbraw/zinc/85/72/68/641857268.db2.gz PXLFWPCFABEZAE-GFCCVEGCSA-N 1 2 237.347 2.027 20 0 BEADLO CC(=O)CC[N@H+](CC(=O)OC(C)(C)C)C(C)C ZINC000153926748 641923587 /nfs/dbraw/zinc/92/35/87/641923587.db2.gz BDFZCAUNWRCECX-UHFFFAOYSA-N 1 2 243.347 2.018 20 0 BEADLO CC(=O)CC[N@@H+](CC(=O)OC(C)(C)C)C(C)C ZINC000153926748 641923593 /nfs/dbraw/zinc/92/35/93/641923593.db2.gz BDFZCAUNWRCECX-UHFFFAOYSA-N 1 2 243.347 2.018 20 0 BEADLO Cc1noc([C@H](CC(C)C)n2cc[nH+]c2)n1 ZINC000923760441 642302558 /nfs/dbraw/zinc/30/25/58/642302558.db2.gz LGINVNHEVLJWCQ-JTQLQIEISA-N 1 2 220.276 2.210 20 0 BEADLO C[NH+](C)c1ccc(N[C@@H]2CCCOC2)cc1 ZINC000070012935 642417557 /nfs/dbraw/zinc/41/75/57/642417557.db2.gz ZWELCILCBDHBNY-GFCCVEGCSA-N 1 2 220.316 2.344 20 0 BEADLO COCC[N@H+](C/C=C/Cl)C/C=C\Cl ZINC000255355523 642445231 /nfs/dbraw/zinc/44/52/31/642445231.db2.gz WBAMPXLGOZCMHI-VOERYJCWSA-N 1 2 224.131 2.440 20 0 BEADLO COCC[N@@H+](C/C=C/Cl)C/C=C\Cl ZINC000255355523 642445237 /nfs/dbraw/zinc/44/52/37/642445237.db2.gz WBAMPXLGOZCMHI-VOERYJCWSA-N 1 2 224.131 2.440 20 0 BEADLO Cn1c[nH+]cc1CNc1nc(Cl)cs1 ZINC000307637875 642445409 /nfs/dbraw/zinc/44/54/09/642445409.db2.gz XFRRPKIVUKSMRY-UHFFFAOYSA-N 1 2 228.708 2.142 20 0 BEADLO C[N@@H+](Cc1ncc[nH]1)C[C@H]1CCCC2(CCC2)O1 ZINC000930121973 642448403 /nfs/dbraw/zinc/44/84/03/642448403.db2.gz RUBUIIVREYPFDM-GFCCVEGCSA-N 1 2 249.358 2.333 20 0 BEADLO C[N@H+](Cc1ncc[nH]1)C[C@H]1CCCC2(CCC2)O1 ZINC000930121973 642448405 /nfs/dbraw/zinc/44/84/05/642448405.db2.gz RUBUIIVREYPFDM-GFCCVEGCSA-N 1 2 249.358 2.333 20 0 BEADLO COc1nnc(C[N@H+](C)C2CCCCC2)s1 ZINC000920257307 642461182 /nfs/dbraw/zinc/46/11/82/642461182.db2.gz MLTOSMMROUBESN-UHFFFAOYSA-N 1 2 241.360 2.311 20 0 BEADLO COc1nnc(C[N@@H+](C)C2CCCCC2)s1 ZINC000920257307 642461184 /nfs/dbraw/zinc/46/11/84/642461184.db2.gz MLTOSMMROUBESN-UHFFFAOYSA-N 1 2 241.360 2.311 20 0 BEADLO CCC/C(C)=C/C(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000920290721 642469549 /nfs/dbraw/zinc/46/95/49/642469549.db2.gz OTANFBAUTDBBEL-OBIHZWKSSA-N 1 2 235.331 2.134 20 0 BEADLO CC1(C)CCN1C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000933298015 642511516 /nfs/dbraw/zinc/51/15/16/642511516.db2.gz AGKZMPYRVXKKKE-UHFFFAOYSA-N 1 2 229.283 2.187 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N[C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000921379147 642606387 /nfs/dbraw/zinc/60/63/87/642606387.db2.gz RAVORUCDIQIHMV-WCFLWFBJSA-N 1 2 247.342 2.037 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N[C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000921379147 642606389 /nfs/dbraw/zinc/60/63/89/642606389.db2.gz RAVORUCDIQIHMV-WCFLWFBJSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@@H]1CC[N@H+](Cn2ncsc2=S)[C@@H]1C ZINC000174949592 642639419 /nfs/dbraw/zinc/63/94/19/642639419.db2.gz VXEFICNLXFNHIZ-HTQZYQBOSA-N 1 2 229.374 2.362 20 0 BEADLO C[C@@H]1CC[N@@H+](Cn2ncsc2=S)[C@@H]1C ZINC000174949592 642639425 /nfs/dbraw/zinc/63/94/25/642639425.db2.gz VXEFICNLXFNHIZ-HTQZYQBOSA-N 1 2 229.374 2.362 20 0 BEADLO C#C[C@H](C)OC(=O)[C@@H](c1ccccc1)[N@@H+](C)CC ZINC000181165690 642846391 /nfs/dbraw/zinc/84/63/91/642846391.db2.gz MXSLMBDURDGBNC-GXTWGEPZSA-N 1 2 245.322 2.244 20 0 BEADLO C#C[C@H](C)OC(=O)[C@@H](c1ccccc1)[N@H+](C)CC ZINC000181165690 642846394 /nfs/dbraw/zinc/84/63/94/642846394.db2.gz MXSLMBDURDGBNC-GXTWGEPZSA-N 1 2 245.322 2.244 20 0 BEADLO Cc1nonc1C[NH2+]Cc1cccc(Cl)c1 ZINC000069795203 642908149 /nfs/dbraw/zinc/90/81/49/642908149.db2.gz PQUSUZXSZNGEPJ-UHFFFAOYSA-N 1 2 237.690 2.321 20 0 BEADLO C=CCOC(=O)[C@H](c1ccccc1)[NH+](C)C ZINC000181977741 642935711 /nfs/dbraw/zinc/93/57/11/642935711.db2.gz MLIWNJORSSDGMJ-LBPRGKRZSA-N 1 2 219.284 2.019 20 0 BEADLO O=C(CC[N@@H+]1CCO[C@@H](c2ccco2)C1)C1CC1 ZINC000767413307 642940990 /nfs/dbraw/zinc/94/09/90/642940990.db2.gz ABCDXKOYIQQCBE-CQSZACIVSA-N 1 2 249.310 2.022 20 0 BEADLO O=C(CC[N@H+]1CCO[C@@H](c2ccco2)C1)C1CC1 ZINC000767413307 642941012 /nfs/dbraw/zinc/94/10/12/642941012.db2.gz ABCDXKOYIQQCBE-CQSZACIVSA-N 1 2 249.310 2.022 20 0 BEADLO O=C(CC[N@@H+]1CCO[C@H](c2ccco2)C1)C1CC1 ZINC000767413306 642942234 /nfs/dbraw/zinc/94/22/34/642942234.db2.gz ABCDXKOYIQQCBE-AWEZNQCLSA-N 1 2 249.310 2.022 20 0 BEADLO O=C(CC[N@H+]1CCO[C@H](c2ccco2)C1)C1CC1 ZINC000767413306 642942239 /nfs/dbraw/zinc/94/22/39/642942239.db2.gz ABCDXKOYIQQCBE-AWEZNQCLSA-N 1 2 249.310 2.022 20 0 BEADLO Cc1csc([C@@H](C)[NH2+]Cc2cncnc2)n1 ZINC000070650050 643054432 /nfs/dbraw/zinc/05/44/32/643054432.db2.gz VHIJFOSPRQCSDJ-SECBINFHSA-N 1 2 234.328 2.092 20 0 BEADLO CC1C[NH+](Cc2occc2Br)C1 ZINC000306711514 643217291 /nfs/dbraw/zinc/21/72/91/643217291.db2.gz NKFINWJPANPPGE-UHFFFAOYSA-N 1 2 230.105 2.494 20 0 BEADLO CC[N@H+](CCC#N)C[C@@H](O)c1ccccc1C ZINC000081513855 643292404 /nfs/dbraw/zinc/29/24/04/643292404.db2.gz ZHJJPPMVHOSIDN-CQSZACIVSA-N 1 2 232.327 2.264 20 0 BEADLO CC[N@@H+](CCC#N)C[C@@H](O)c1ccccc1C ZINC000081513855 643292409 /nfs/dbraw/zinc/29/24/09/643292409.db2.gz ZHJJPPMVHOSIDN-CQSZACIVSA-N 1 2 232.327 2.264 20 0 BEADLO C[C@@H]1C(=O)CCC[N@H+]1C[C@@H]1CCC(F)(F)C1 ZINC000932847127 643527514 /nfs/dbraw/zinc/52/75/14/643527514.db2.gz VVDZXVBMEKCIHU-NXEZZACHSA-N 1 2 231.286 2.475 20 0 BEADLO C[C@@H]1C(=O)CCC[N@@H+]1C[C@@H]1CCC(F)(F)C1 ZINC000932847127 643527522 /nfs/dbraw/zinc/52/75/22/643527522.db2.gz VVDZXVBMEKCIHU-NXEZZACHSA-N 1 2 231.286 2.475 20 0 BEADLO C=C(C)C[C@H](C)C(=O)NNc1cc(C)[nH+]c(C)n1 ZINC000186427402 643733453 /nfs/dbraw/zinc/73/34/53/643733453.db2.gz WQFRWZOXLFHWNP-VIFPVBQESA-N 1 2 248.330 2.139 20 0 BEADLO CC[NH2+]Cc1noc(C2C(C)(C)C2(C)C)n1 ZINC000085710759 643789544 /nfs/dbraw/zinc/78/95/44/643789544.db2.gz BVDMKGSSQSKDAJ-UHFFFAOYSA-N 1 2 223.320 2.329 20 0 BEADLO Cn1c[nH+]cc1COC(=O)C1(C)CCCC1 ZINC000085989039 643882446 /nfs/dbraw/zinc/88/24/46/643882446.db2.gz HLKODFCYUDSDPQ-UHFFFAOYSA-N 1 2 222.288 2.044 20 0 BEADLO CCC/C=C\C(=O)OCc1ccc[nH+]c1N ZINC000922352963 643979552 /nfs/dbraw/zinc/97/95/52/643979552.db2.gz WOCNXOTYVSQLAV-DAXSKMNVSA-N 1 2 220.272 2.063 20 0 BEADLO CCC(C)(C)C(=O)OCc1ccc(N)[nH+]c1 ZINC000922408171 643990804 /nfs/dbraw/zinc/99/08/04/643990804.db2.gz GUWVNBPNNVEYEL-UHFFFAOYSA-N 1 2 222.288 2.143 20 0 BEADLO Nc1ccc(COC(=O)[C@@H]2CC23CCCC3)c[nH+]1 ZINC000922507576 644005307 /nfs/dbraw/zinc/00/53/07/644005307.db2.gz HGWOJAWWPGIURQ-NSHDSACASA-N 1 2 246.310 2.287 20 0 BEADLO C[C@H](c1nc(Cc2cccs2)no1)[NH+](C)C ZINC000923755495 644006082 /nfs/dbraw/zinc/00/60/82/644006082.db2.gz YHOLBRZMVUOFLA-MRVPVSSYSA-N 1 2 237.328 2.345 20 0 BEADLO C[C@@H]1CC/C(=C\C(=O)OCc2ccc(N)[nH+]c2)C1 ZINC000922516447 644008267 /nfs/dbraw/zinc/00/82/67/644008267.db2.gz HQFMYNFDJLTWBO-UEUZTHOGSA-N 1 2 246.310 2.453 20 0 BEADLO c1ncc(C[NH2+][C@H](c2ncccn2)C2CC2)s1 ZINC000922579910 644032892 /nfs/dbraw/zinc/03/28/92/644032892.db2.gz MEEQDJSNUFQMBD-NSHDSACASA-N 1 2 246.339 2.174 20 0 BEADLO C[C@H]1CC[C@@H](C(=O)OCc2ccc(N)[nH+]c2)C1 ZINC000922585348 644035415 /nfs/dbraw/zinc/03/54/15/644035415.db2.gz FHELHQAZGIGKCZ-GXSJLCMTSA-N 1 2 234.299 2.143 20 0 BEADLO CC/C(C)=C(/C)C(=O)OCc1ccc(N)[nH+]c1 ZINC000922594318 644038116 /nfs/dbraw/zinc/03/81/16/644038116.db2.gz XBQRUICRJCSBDX-KTKRTIGZSA-N 1 2 234.299 2.453 20 0 BEADLO CC(C)C[C@H](C)C(=O)OCc1ccc[nH+]c1N ZINC000922614866 644042028 /nfs/dbraw/zinc/04/20/28/644042028.db2.gz OSEJTEBUVWJHHY-JTQLQIEISA-N 1 2 236.315 2.389 20 0 BEADLO Nc1[nH+]cccc1COC(=O)C1=CCCCC1 ZINC000922632507 644045496 /nfs/dbraw/zinc/04/54/96/644045496.db2.gz SCFCIGPCHIQVBP-UHFFFAOYSA-N 1 2 232.283 2.207 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1C(=O)OCc1ccc[nH+]c1N ZINC000922625392 644045534 /nfs/dbraw/zinc/04/55/34/644045534.db2.gz ZQWYTNBNKDBGDB-RISCZKNCSA-N 1 2 248.326 2.389 20 0 BEADLO C/C=C(/CC)C(=O)OCc1ccc[nH+]c1N ZINC000922640679 644054370 /nfs/dbraw/zinc/05/43/70/644054370.db2.gz VFFPNOYLEVKJGD-OQFOIZHKSA-N 1 2 220.272 2.063 20 0 BEADLO CC(C)n1c[nH+]cc1CNc1nncn1C1CC1 ZINC000922658346 644061997 /nfs/dbraw/zinc/06/19/97/644061997.db2.gz CJZFXVZOHYEFEH-UHFFFAOYSA-N 1 2 246.318 2.003 20 0 BEADLO CC1(C)CC(C(=O)OCc2ccc(N)[nH+]c2)C1 ZINC000922722606 644077698 /nfs/dbraw/zinc/07/76/98/644077698.db2.gz HHXWLYDAWLRREO-UHFFFAOYSA-N 1 2 234.299 2.143 20 0 BEADLO CC/C(C)=C/C(=O)OCc1ccc[nH+]c1N ZINC000922777728 644092400 /nfs/dbraw/zinc/09/24/00/644092400.db2.gz ZQWFRHJXOIXHLI-VQHVLOKHSA-N 1 2 220.272 2.063 20 0 BEADLO Nc1ccc(COC(=O)[C@@H]2CC[C@@H]3C[C@@H]3C2)c[nH+]1 ZINC000922808724 644101463 /nfs/dbraw/zinc/10/14/63/644101463.db2.gz IFOHZOQPARECBE-IJLUTSLNSA-N 1 2 246.310 2.143 20 0 BEADLO CC1(C)CC[C@H]1C(=O)OCc1ccc(N)[nH+]c1 ZINC000922866184 644121565 /nfs/dbraw/zinc/12/15/65/644121565.db2.gz LYLOIZIURVURBY-JTQLQIEISA-N 1 2 234.299 2.143 20 0 BEADLO C[C@H]1CCC[N@H+](Cn2ncsc2=S)C1 ZINC000073878954 644144079 /nfs/dbraw/zinc/14/40/79/644144079.db2.gz VODUGHZGURCHLC-QMMMGPOBSA-N 1 2 229.374 2.363 20 0 BEADLO C[C@H]1CCC[N@@H+](Cn2ncsc2=S)C1 ZINC000073878954 644144081 /nfs/dbraw/zinc/14/40/81/644144081.db2.gz VODUGHZGURCHLC-QMMMGPOBSA-N 1 2 229.374 2.363 20 0 BEADLO CC[C@H](C)[C@@H](C(=O)OC)[N@H+](C)Cc1ccoc1 ZINC000929328125 644146687 /nfs/dbraw/zinc/14/66/87/644146687.db2.gz OIEHJHAUAFRCAX-JQWIXIFHSA-N 1 2 239.315 2.299 20 0 BEADLO CC[C@H](C)[C@@H](C(=O)OC)[N@@H+](C)Cc1ccoc1 ZINC000929328125 644146690 /nfs/dbraw/zinc/14/66/90/644146690.db2.gz OIEHJHAUAFRCAX-JQWIXIFHSA-N 1 2 239.315 2.299 20 0 BEADLO CCc1onc(C)c1C[NH2+]Cc1cc(C)no1 ZINC000922983074 644209720 /nfs/dbraw/zinc/20/97/20/644209720.db2.gz XCUDAFLPJGPIMZ-UHFFFAOYSA-N 1 2 235.287 2.132 20 0 BEADLO CCc1onc(C)c1C[NH2+]Cc1ccncc1F ZINC000922984381 644210978 /nfs/dbraw/zinc/21/09/78/644210978.db2.gz QDDXTHBQKLJYAJ-UHFFFAOYSA-N 1 2 249.289 2.369 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)C1(C2CC2)CCC1 ZINC000923337670 644359025 /nfs/dbraw/zinc/35/90/25/644359025.db2.gz OJWHLGGXDSCVKM-UHFFFAOYSA-N 1 2 248.326 2.086 20 0 BEADLO CC(C)CCNC(=O)c1cccc2[nH+]ccn21 ZINC000082317811 644368246 /nfs/dbraw/zinc/36/82/46/644368246.db2.gz BCMIAALAAJWJIJ-UHFFFAOYSA-N 1 2 231.299 2.110 20 0 BEADLO c1ncc(C[NH2+][C@H]2CSc3ccccc32)[nH]1 ZINC000083748717 644408716 /nfs/dbraw/zinc/40/87/16/644408716.db2.gz CKRLMKFTGLWLQP-NSHDSACASA-N 1 2 231.324 2.346 20 0 BEADLO c1ncc(C[NH2+][C@@H]2CSc3ccccc32)[nH]1 ZINC000083748715 644409780 /nfs/dbraw/zinc/40/97/80/644409780.db2.gz CKRLMKFTGLWLQP-LLVKDONJSA-N 1 2 231.324 2.346 20 0 BEADLO CCC[C@@H](C)N(C)c1cc(NC)[nH+]cn1 ZINC000087813463 644503013 /nfs/dbraw/zinc/50/30/13/644503013.db2.gz IJRRAIBOWCZEOZ-SECBINFHSA-N 1 2 208.309 2.143 20 0 BEADLO CCC[C@@H](C)N(C)c1cc(NC)nc[nH+]1 ZINC000087813463 644503018 /nfs/dbraw/zinc/50/30/18/644503018.db2.gz IJRRAIBOWCZEOZ-SECBINFHSA-N 1 2 208.309 2.143 20 0 BEADLO O=C(/C=C/c1ccsc1)OCCn1cc[nH+]c1 ZINC000771870689 644690532 /nfs/dbraw/zinc/69/05/32/644690532.db2.gz UQADPDYSRPMDRB-OWOJBTEDSA-N 1 2 248.307 2.201 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2ccoc2)CCO1 ZINC000093508880 644691534 /nfs/dbraw/zinc/69/15/34/644691534.db2.gz IAXHFVMNVQIFMX-GFCCVEGCSA-N 1 2 209.289 2.281 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2ccoc2)CCO1 ZINC000093508880 644691537 /nfs/dbraw/zinc/69/15/37/644691537.db2.gz IAXHFVMNVQIFMX-GFCCVEGCSA-N 1 2 209.289 2.281 20 0 BEADLO CN(C)c1cc(CSc2nccn2C)cc[nH+]1 ZINC000782109915 644739474 /nfs/dbraw/zinc/73/94/74/644739474.db2.gz FJVDBUCLUVPLML-UHFFFAOYSA-N 1 2 248.355 2.173 20 0 BEADLO CCC/C=C\C(=O)OCCCn1cc[nH+]c1 ZINC000782991318 644749011 /nfs/dbraw/zinc/74/90/11/644749011.db2.gz OMBSVQJFZACCNJ-XQRVVYSFSA-N 1 2 222.288 2.173 20 0 BEADLO CCn1nc(C)c(C[NH2+][C@@H](C)c2ccoc2)n1 ZINC000823990030 645052510 /nfs/dbraw/zinc/05/25/10/645052510.db2.gz GGIYUOPRFCDKEU-VIFPVBQESA-N 1 2 234.303 2.050 20 0 BEADLO CC(C)C[C@H](C(=O)N[C@H]1C=CCC1)n1cc[nH+]c1 ZINC000824438702 645054290 /nfs/dbraw/zinc/05/42/90/645054290.db2.gz XOJAFUZQMSAUOS-QWHCGFSZSA-N 1 2 247.342 2.305 20 0 BEADLO CCCC[C@@](C)(F)C(=O)NCc1[nH]c[nH+]c1C ZINC000829493922 645108663 /nfs/dbraw/zinc/10/86/63/645108663.db2.gz UNEGKVYBLIBHOG-GFCCVEGCSA-N 1 2 241.310 2.253 20 0 BEADLO O=C(OC1CCC1)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000830382910 645123502 /nfs/dbraw/zinc/12/35/02/645123502.db2.gz BZFDIZNDABDMIG-NSHDSACASA-N 1 2 249.314 2.209 20 0 BEADLO CCCc1ncc(C[NH2+][C@H](C)c2ccnnc2)o1 ZINC000926536701 645263858 /nfs/dbraw/zinc/26/38/58/645263858.db2.gz HDKQAKFGCULKOS-SNVBAGLBSA-N 1 2 246.314 2.268 20 0 BEADLO CCC[C@@H](C)[C@H](CO)[NH2+]CC(F)(F)C(F)F ZINC000844378798 645320928 /nfs/dbraw/zinc/32/09/28/645320928.db2.gz MLLOGDPUIYTKDT-SFYZADRCSA-N 1 2 245.260 2.274 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@@H+]1Cc1cnc(C)cn1 ZINC000844386918 645328038 /nfs/dbraw/zinc/32/80/38/645328038.db2.gz PWAMPUCZGRCULH-CYBMUJFWSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1COC(C)(C)C[N@H+]1Cc1cnc(C)cn1 ZINC000844386918 645328046 /nfs/dbraw/zinc/32/80/46/645328046.db2.gz PWAMPUCZGRCULH-CYBMUJFWSA-N 1 2 249.358 2.174 20 0 BEADLO C[C@H](CC(=O)OCc1ccoc1)n1cc[nH+]c1 ZINC000845448647 645361814 /nfs/dbraw/zinc/36/18/14/645361814.db2.gz KVGOQGAPBVJKOU-SNVBAGLBSA-N 1 2 234.255 2.171 20 0 BEADLO C[C@H](CC(=O)OC[C@H]1C[C@H]1C)n1cc[nH+]c1 ZINC000845453824 645363748 /nfs/dbraw/zinc/36/37/48/645363748.db2.gz VZDKLQHGKOZFIN-GMTAPVOTSA-N 1 2 222.288 2.033 20 0 BEADLO C[C@H](CC(=O)OC[C@@H]1C[C@H]1C)n1cc[nH+]c1 ZINC000845453825 645364260 /nfs/dbraw/zinc/36/42/60/645364260.db2.gz VZDKLQHGKOZFIN-MXWKQRLJSA-N 1 2 222.288 2.033 20 0 BEADLO Cc1cc(N[C@@H](C)c2cnnn2C)c[nH+]c1C ZINC000926855591 645457602 /nfs/dbraw/zinc/45/76/02/645457602.db2.gz MDVQEZCZQXPDTB-JTQLQIEISA-N 1 2 231.303 2.000 20 0 BEADLO CON1CCC(Nc2c[nH+]c(C)c(C)c2)CC1 ZINC000926855152 645457997 /nfs/dbraw/zinc/45/79/97/645457997.db2.gz IJXJHOHQRLBMLK-UHFFFAOYSA-N 1 2 235.331 2.136 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)C(F)F)c1cc[nH]c(=O)c1 ZINC000926864051 645462737 /nfs/dbraw/zinc/46/27/37/645462737.db2.gz FUSBKMXILXHFMA-RQJHMYQMSA-N 1 2 216.231 2.091 20 0 BEADLO C[C@@H]([NH2+][C@H](C)C(F)F)c1cc[nH]c(=O)c1 ZINC000926864050 645464498 /nfs/dbraw/zinc/46/44/98/645464498.db2.gz FUSBKMXILXHFMA-RNFRBKRXSA-N 1 2 216.231 2.091 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)NC[C@]12C[C@H]1CCCC2 ZINC000927438584 645613828 /nfs/dbraw/zinc/61/38/28/645613828.db2.gz WSPATZGTQSXAIE-RISCZKNCSA-N 1 2 247.342 2.039 20 0 BEADLO Nc1ccc(CNC(=O)/C=C/C2CCCC2)c[nH+]1 ZINC000927776467 645656620 /nfs/dbraw/zinc/65/66/20/645656620.db2.gz CRDIFNNOGIQHSJ-SOFGYWHQSA-N 1 2 245.326 2.026 20 0 BEADLO COc1cnc(F)c(C[N@@H+]2CCC=C(C)C2)c1 ZINC000877496539 645798824 /nfs/dbraw/zinc/79/88/24/645798824.db2.gz UQTCGNRYGRGFAS-UHFFFAOYSA-N 1 2 236.290 2.381 20 0 BEADLO COc1cnc(F)c(C[N@H+]2CCC=C(C)C2)c1 ZINC000877496539 645798829 /nfs/dbraw/zinc/79/88/29/645798829.db2.gz UQTCGNRYGRGFAS-UHFFFAOYSA-N 1 2 236.290 2.381 20 0 BEADLO C[C@H](c1nc([C@@H]2CCCS2)no1)[NH+](C)C ZINC000923921851 645962305 /nfs/dbraw/zinc/96/23/05/645962305.db2.gz YTJVGYMQSOHOMB-SFYZADRCSA-N 1 2 227.333 2.260 20 0 BEADLO C[C@H]1C[C@H]1c1noc([C@@H]2C[C@H]2c2c[nH]c[nH+]2)n1 ZINC000923924318 645962714 /nfs/dbraw/zinc/96/27/14/645962714.db2.gz ZSIUPWXEBMBADY-JQCXWYLXSA-N 1 2 230.271 2.187 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccco2)c(C)nn1 ZINC000929139683 645966704 /nfs/dbraw/zinc/96/67/04/645966704.db2.gz VCVVRUWXWUYZGQ-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccco2)c(C)nn1 ZINC000929139683 645966710 /nfs/dbraw/zinc/96/67/10/645966710.db2.gz VCVVRUWXWUYZGQ-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO C[C@H](c1nc([C@H](C)c2ccco2)no1)[NH+](C)C ZINC000924124649 645988779 /nfs/dbraw/zinc/98/87/79/645988779.db2.gz FSAMLUNOFQOPHX-RKDXNWHRSA-N 1 2 235.287 2.437 20 0 BEADLO C[C@@]1(C(=O)OCc2ccc[nH+]c2N)C=CCC1 ZINC000924411401 646031942 /nfs/dbraw/zinc/03/19/42/646031942.db2.gz FRAOXLRMNDURST-CYBMUJFWSA-N 1 2 232.283 2.063 20 0 BEADLO C[C@@]1(C(=O)OCc2ccc(N)[nH+]c2)C=CCC1 ZINC000924414072 646033939 /nfs/dbraw/zinc/03/39/39/646033939.db2.gz YCNYVPJPGJABFY-CYBMUJFWSA-N 1 2 232.283 2.063 20 0 BEADLO COC/C(C)=C/C[N@H+](C)Cc1cc(C)on1 ZINC000929259442 646042982 /nfs/dbraw/zinc/04/29/82/646042982.db2.gz YOMOHGIHHRGTMF-BJMVGYQFSA-N 1 2 224.304 2.008 20 0 BEADLO COC/C(C)=C/C[N@@H+](C)Cc1cc(C)on1 ZINC000929259442 646042988 /nfs/dbraw/zinc/04/29/88/646042988.db2.gz YOMOHGIHHRGTMF-BJMVGYQFSA-N 1 2 224.304 2.008 20 0 BEADLO Cc1nonc1[C@@H](C)[NH2+]Cc1cccs1 ZINC000924559257 646069085 /nfs/dbraw/zinc/06/90/85/646069085.db2.gz JGAVYNKGCQCQTE-SSDOTTSWSA-N 1 2 223.301 2.290 20 0 BEADLO CC[N@H+](CCOC)Cc1coc(C(C)(C)C)n1 ZINC000929340942 646088559 /nfs/dbraw/zinc/08/85/59/646088559.db2.gz IRZWJVQLCRMYPX-UHFFFAOYSA-N 1 2 240.347 2.440 20 0 BEADLO CC[N@@H+](CCOC)Cc1coc(C(C)(C)C)n1 ZINC000929340942 646088562 /nfs/dbraw/zinc/08/85/62/646088562.db2.gz IRZWJVQLCRMYPX-UHFFFAOYSA-N 1 2 240.347 2.440 20 0 BEADLO Cc1nonc1[C@H](C)[NH2+]Cc1ccsc1 ZINC000924666185 646088961 /nfs/dbraw/zinc/08/89/61/646088961.db2.gz TYYKZRQSVDTABX-ZETCQYMHSA-N 1 2 223.301 2.290 20 0 BEADLO C[C@H]([NH2+]Cc1cc[nH]n1)c1cnn(C2CCC2)c1 ZINC000924987768 646150644 /nfs/dbraw/zinc/15/06/44/646150644.db2.gz AFXDRSOCIDNIDR-JTQLQIEISA-N 1 2 245.330 2.182 20 0 BEADLO C[C@@H]1C[C@H](C[N@H+](C)CC(F)F)C[C@H](C)O1 ZINC000929516455 646164525 /nfs/dbraw/zinc/16/45/25/646164525.db2.gz SIVIOWXCYSLYSX-MYJAWHEDSA-N 1 2 221.291 2.387 20 0 BEADLO C[C@@H]1C[C@H](C[N@@H+](C)CC(F)F)C[C@H](C)O1 ZINC000929516455 646164539 /nfs/dbraw/zinc/16/45/39/646164539.db2.gz SIVIOWXCYSLYSX-MYJAWHEDSA-N 1 2 221.291 2.387 20 0 BEADLO CC(C)n1ccc(C[NH2+][C@@H](C)c2ccnnc2)n1 ZINC000925109281 646186202 /nfs/dbraw/zinc/18/62/02/646186202.db2.gz ZGGYGJCFVWUMIV-NSHDSACASA-N 1 2 245.330 2.105 20 0 BEADLO C[C@H](O)CC[N@H+](C)Cc1coc(C(C)(C)C)n1 ZINC000929714524 646264239 /nfs/dbraw/zinc/26/42/39/646264239.db2.gz CYIZXLTZGKJLEJ-JTQLQIEISA-N 1 2 240.347 2.175 20 0 BEADLO C[C@H](O)CC[N@@H+](C)Cc1coc(C(C)(C)C)n1 ZINC000929714524 646264250 /nfs/dbraw/zinc/26/42/50/646264250.db2.gz CYIZXLTZGKJLEJ-JTQLQIEISA-N 1 2 240.347 2.175 20 0 BEADLO C[C@@H](O)CC[N@H+](C)Cc1coc(C(C)(C)C)n1 ZINC000929714526 646264362 /nfs/dbraw/zinc/26/43/62/646264362.db2.gz CYIZXLTZGKJLEJ-SNVBAGLBSA-N 1 2 240.347 2.175 20 0 BEADLO C[C@@H](O)CC[N@@H+](C)Cc1coc(C(C)(C)C)n1 ZINC000929714526 646264369 /nfs/dbraw/zinc/26/43/69/646264369.db2.gz CYIZXLTZGKJLEJ-SNVBAGLBSA-N 1 2 240.347 2.175 20 0 BEADLO CCC(C)(C)NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000929781593 646309479 /nfs/dbraw/zinc/30/94/79/646309479.db2.gz YWDBODMRJDFXHP-UHFFFAOYSA-N 1 2 231.299 2.481 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)C[C@@H]1CC2CCC1CC2 ZINC000929811017 646330017 /nfs/dbraw/zinc/33/00/17/646330017.db2.gz FRFQMYBMNHOZGY-MCIGGMRASA-N 1 2 234.347 2.063 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)C[C@@H]1CC2CCC1CC2 ZINC000929811017 646330025 /nfs/dbraw/zinc/33/00/25/646330025.db2.gz FRFQMYBMNHOZGY-MCIGGMRASA-N 1 2 234.347 2.063 20 0 BEADLO Cc1cc(C)nc(C[N@H+]2CCO[C@H](C)[C@H]2C)c1 ZINC000929848085 646358680 /nfs/dbraw/zinc/35/86/80/646358680.db2.gz QBUAOPXMWZGAQN-CHWSQXEVSA-N 1 2 234.343 2.308 20 0 BEADLO Cc1cc(C)nc(C[N@@H+]2CCO[C@H](C)[C@H]2C)c1 ZINC000929848085 646358685 /nfs/dbraw/zinc/35/86/85/646358685.db2.gz QBUAOPXMWZGAQN-CHWSQXEVSA-N 1 2 234.343 2.308 20 0 BEADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@H](C)c1cn[nH]c1 ZINC000925633238 646378033 /nfs/dbraw/zinc/37/80/33/646378033.db2.gz COJTVKCGNCIJLP-KCJUWKMLSA-N 1 2 246.314 2.434 20 0 BEADLO C[C@@H]1CC2(CC(Nc3cccc[nH+]3)C2)CO1 ZINC000925716694 646441033 /nfs/dbraw/zinc/44/10/33/646441033.db2.gz BRRBMTFIVOSAPW-XSRFYTQQSA-N 1 2 218.300 2.451 20 0 BEADLO Cc1cn(C)nc1C[N@@H+]1CC[C@H](C(F)(F)F)C1 ZINC000930121594 646444960 /nfs/dbraw/zinc/44/49/60/646444960.db2.gz PNUCZQXMZGQJJQ-VIFPVBQESA-N 1 2 247.264 2.113 20 0 BEADLO Cc1cn(C)nc1C[N@H+]1CC[C@H](C(F)(F)F)C1 ZINC000930121594 646444964 /nfs/dbraw/zinc/44/49/64/646444964.db2.gz PNUCZQXMZGQJJQ-VIFPVBQESA-N 1 2 247.264 2.113 20 0 BEADLO O=C(NCC1CCC1)c1cc2c[nH+]ccc2[nH]1 ZINC000930155590 646461987 /nfs/dbraw/zinc/46/19/87/646461987.db2.gz KYFPWKUZDAHTDN-UHFFFAOYSA-N 1 2 229.283 2.093 20 0 BEADLO C[C@@H]([NH2+]Cc1cocn1)c1cnn(C2CCC2)c1 ZINC000925869493 646519376 /nfs/dbraw/zinc/51/93/76/646519376.db2.gz MCILSEAODKNYQO-SNVBAGLBSA-N 1 2 246.314 2.447 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cnn(C)n1)c1ccsc1 ZINC000926368923 646628690 /nfs/dbraw/zinc/62/86/90/646628690.db2.gz GRBBGOASFCBIAG-BDAKNGLRSA-N 1 2 236.344 2.288 20 0 BEADLO C[C@H](CNc1nccs1)Cn1cc[nH+]c1 ZINC000382391871 711583835 /nfs/dbraw/zinc/58/38/35/711583835.db2.gz VFAGGXMOUMKARM-SECBINFHSA-N 1 2 222.317 2.088 20 0 BEADLO Cc1[nH]c(CN(C)C[C@@H]2CCCCO2)c(C)[nH+]1 ZINC000724782503 711612692 /nfs/dbraw/zinc/61/26/92/711612692.db2.gz CHTXLUCTLHQQAS-LBPRGKRZSA-N 1 2 237.347 2.027 20 0 BEADLO C[C@@H]1CC[C@H](O)C[N@@H+]1C/C(Cl)=C\Cl ZINC000399473527 711782048 /nfs/dbraw/zinc/78/20/48/711782048.db2.gz NGPGVKMMEDBHPR-HFBYHIIMSA-N 1 2 224.131 2.151 20 0 BEADLO C[C@@H]1CC[C@H](O)C[N@H+]1C/C(Cl)=C\Cl ZINC000399473527 711782049 /nfs/dbraw/zinc/78/20/49/711782049.db2.gz NGPGVKMMEDBHPR-HFBYHIIMSA-N 1 2 224.131 2.151 20 0 BEADLO CC[C@@]1(C)CC[N@H+](Cn2ncn(C)c2=S)C1 ZINC000758399846 712408648 /nfs/dbraw/zinc/40/86/48/712408648.db2.gz ZVZQHEVWCKWJRX-NSHDSACASA-N 1 2 240.376 2.031 20 0 BEADLO CC[C@@]1(C)CC[N@@H+](Cn2ncn(C)c2=S)C1 ZINC000758399846 712408650 /nfs/dbraw/zinc/40/86/50/712408650.db2.gz ZVZQHEVWCKWJRX-NSHDSACASA-N 1 2 240.376 2.031 20 0 BEADLO Cc1ccc(NC[C@H]2COC(C)(C)O2)c(C)[nH+]1 ZINC000715090936 712508117 /nfs/dbraw/zinc/50/81/17/712508117.db2.gz DXKDDRGDYMNCDB-NSHDSACASA-N 1 2 236.315 2.262 20 0 BEADLO Cc1cc(C[NH2+]Cc2cnc(Cl)s2)on1 ZINC000718176224 712751490 /nfs/dbraw/zinc/75/14/90/712751490.db2.gz OPTGANOKBGSGOJ-UHFFFAOYSA-N 1 2 243.719 2.383 20 0 BEADLO CO[C@]1(CNc2cccc[nH+]2)CCSC1 ZINC000719276847 712803251 /nfs/dbraw/zinc/80/32/51/712803251.db2.gz SYUGFQGUNVJZKC-NSHDSACASA-N 1 2 224.329 2.016 20 0 BEADLO CNc1cc(N[C@H]2CCC(F)(F)C2)[nH+]cn1 ZINC000381129481 710603128 /nfs/dbraw/zinc/60/31/28/710603128.db2.gz KGMSVHXOYNSKJS-ZETCQYMHSA-N 1 2 228.246 2.118 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccon2)cc(Cl)n1 ZINC000381356669 710626741 /nfs/dbraw/zinc/62/67/41/710626741.db2.gz DIMBUXNOELPVCL-UHFFFAOYSA-N 1 2 237.690 2.321 20 0 BEADLO CCCC[C@@H]([NH2+][C@@H]1CC12CCC2)C(=O)OC ZINC000721223260 712899564 /nfs/dbraw/zinc/89/95/64/712899564.db2.gz UNYOMQUTYQPOHT-GHMZBOCLSA-N 1 2 225.332 2.250 20 0 BEADLO CCN(C(=O)C[C@H]([NH3+])C(F)F)C1CCCCC1 ZINC000724757894 710746756 /nfs/dbraw/zinc/74/67/56/710746756.db2.gz HDJVKXHYBUNCRR-JTQLQIEISA-N 1 2 248.317 2.150 20 0 BEADLO C[C@@H]1CCC[C@@H](N(C)C(=O)C[C@@H]([NH3+])C(F)F)C1 ZINC000724757046 710746912 /nfs/dbraw/zinc/74/69/12/710746912.db2.gz AMMKAMDIYFDTPR-OPRDCNLKSA-N 1 2 248.317 2.006 20 0 BEADLO OCc1cc[nH+]c(N2CCC3(CCCC3)C2)c1 ZINC000383983384 710987648 /nfs/dbraw/zinc/98/76/48/710987648.db2.gz KMINOUFEXLNEAZ-UHFFFAOYSA-N 1 2 232.327 2.344 20 0 BEADLO Cn1cc(Br)cc1C[N@H+](C)CCF ZINC000388732943 711066541 /nfs/dbraw/zinc/06/65/41/711066541.db2.gz VSQBNFPTQHDNKA-UHFFFAOYSA-N 1 2 249.127 2.189 20 0 BEADLO Cn1cc(Br)cc1C[N@@H+](C)CCF ZINC000388732943 711066546 /nfs/dbraw/zinc/06/65/46/711066546.db2.gz VSQBNFPTQHDNKA-UHFFFAOYSA-N 1 2 249.127 2.189 20 0 BEADLO CC[C@H]([NH2+]CC(F)(F)C(F)F)[C@H]1CCCO1 ZINC000390768690 711133783 /nfs/dbraw/zinc/13/37/83/711133783.db2.gz TXSSNRJZWIWNQJ-JGVFFNPUSA-N 1 2 243.244 2.434 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2CC[C@@H](C)C2)n1 ZINC000390781471 711135081 /nfs/dbraw/zinc/13/50/81/711135081.db2.gz KFZJVTIPXIAWMO-RKDXNWHRSA-N 1 2 209.293 2.083 20 0 BEADLO CC1(C)C[N@H+](C/C(Cl)=C\Cl)CC[C@@H]1O ZINC000393688898 711169614 /nfs/dbraw/zinc/16/96/14/711169614.db2.gz GWYLTTDOXNDZGW-QRJSTWQJSA-N 1 2 238.158 2.398 20 0 BEADLO CC1(C)C[N@@H+](C/C(Cl)=C\Cl)CC[C@@H]1O ZINC000393688898 711169616 /nfs/dbraw/zinc/16/96/16/711169616.db2.gz GWYLTTDOXNDZGW-QRJSTWQJSA-N 1 2 238.158 2.398 20 0 BEADLO FC(F)(F)[C@H]1CCC[C@@H]([NH2+]Cc2c[nH]nn2)C1 ZINC000398352365 711408502 /nfs/dbraw/zinc/40/85/02/711408502.db2.gz GDJDYFURTRJVMM-JGVFFNPUSA-N 1 2 248.252 2.015 20 0 BEADLO FC(F)(F)[C@H]1CCC[C@@H]([NH2+]Cc2cn[nH]n2)C1 ZINC000398352365 711408504 /nfs/dbraw/zinc/40/85/04/711408504.db2.gz GDJDYFURTRJVMM-JGVFFNPUSA-N 1 2 248.252 2.015 20 0 BEADLO CCn1c(C)nn(C[N@@H+]2CC[C@@H](C)C2)c1=S ZINC000726590860 711439168 /nfs/dbraw/zinc/43/91/68/711439168.db2.gz WCWXNHLKFMQFOR-SECBINFHSA-N 1 2 240.376 2.042 20 0 BEADLO CCn1c(C)nn(C[N@H+]2CC[C@@H](C)C2)c1=S ZINC000726590860 711439169 /nfs/dbraw/zinc/43/91/69/711439169.db2.gz WCWXNHLKFMQFOR-SECBINFHSA-N 1 2 240.376 2.042 20 0 BEADLO CNc1cc(N2CCC3(CCCC3)C2)nc[nH+]1 ZINC000383201669 711465599 /nfs/dbraw/zinc/46/55/99/711465599.db2.gz VHAYLNPSFCTOJF-UHFFFAOYSA-N 1 2 232.331 2.289 20 0 BEADLO CNc1cc(N2CCC3(CCCC3)C2)[nH+]cn1 ZINC000383201669 711465601 /nfs/dbraw/zinc/46/56/01/711465601.db2.gz VHAYLNPSFCTOJF-UHFFFAOYSA-N 1 2 232.331 2.289 20 0 BEADLO COCC(C)(C)C[NH2+]c1ccc(N)c(OC)c1 ZINC000383235879 711485337 /nfs/dbraw/zinc/48/53/37/711485337.db2.gz CRWRUEFMPCXWFN-UHFFFAOYSA-N 1 2 238.331 2.362 20 0 BEADLO CC1CCC(N(C)C(=O)C[C@@H]([NH3+])C(F)F)CC1 ZINC000724758458 711610608 /nfs/dbraw/zinc/61/06/08/711610608.db2.gz LOUIORMGJKNELU-UDNWOFFPSA-N 1 2 248.317 2.006 20 0 BEADLO Cc1[nH]c(CN2CCC(F)(F)CC2)c(C)[nH+]1 ZINC000724792314 711614625 /nfs/dbraw/zinc/61/46/25/711614625.db2.gz SOWJNTIDXVYDBQ-UHFFFAOYSA-N 1 2 229.274 2.258 20 0 BEADLO CC[C@H]([NH2+]Cc1cc[nH]n1)c1cccc(OC)n1 ZINC000924989611 711767826 /nfs/dbraw/zinc/76/78/26/711767826.db2.gz GGIPXRSCMHNROG-NSHDSACASA-N 1 2 246.314 2.054 20 0 BEADLO CCCSC[C@H](C)[NH2+][C@@H](C)C(=O)OC(C)C ZINC000894759364 711772150 /nfs/dbraw/zinc/77/21/50/711772150.db2.gz XMWGXFZQOIXVPO-QWRGUYRKSA-N 1 2 247.404 2.448 20 0 BEADLO CC(C)(C)C[C@H]1CCN(C(=O)Cc2c[nH+]c[nH]2)C1 ZINC000909421207 711774784 /nfs/dbraw/zinc/77/47/84/711774784.db2.gz AVNSABHZEHWSPI-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO C/C=C/C[C@@H]1CCCN(C(=O)Cc2c[nH+]c[nH]2)C1 ZINC000913354051 711821646 /nfs/dbraw/zinc/82/16/46/711821646.db2.gz YVKQFQOYLRIMEJ-QAVQXKDTSA-N 1 2 247.342 2.157 20 0 BEADLO C[C@@H](c1nc(Cc2cccc(F)c2)no1)[NH+](C)C ZINC000350505416 711842593 /nfs/dbraw/zinc/84/25/93/711842593.db2.gz OETMTWQDSWZBCJ-VIFPVBQESA-N 1 2 249.289 2.422 20 0 BEADLO CNc1cc(N2CC[C@H](C)[C@@H](C)C2)nc[nH+]1 ZINC000132215189 711955969 /nfs/dbraw/zinc/95/59/69/711955969.db2.gz MHVJKHFUNYOTBE-UWVGGRQHSA-N 1 2 220.320 2.001 20 0 BEADLO CNc1cc(N2CC[C@H](C)[C@@H](C)C2)[nH+]cn1 ZINC000132215189 711955971 /nfs/dbraw/zinc/95/59/71/711955971.db2.gz MHVJKHFUNYOTBE-UWVGGRQHSA-N 1 2 220.320 2.001 20 0 BEADLO C[C@H]1CC=C(C(=O)OCc2ccc[nH+]c2N)CC1 ZINC000922794936 711976696 /nfs/dbraw/zinc/97/66/96/711976696.db2.gz QIQNSCXUHYFJRD-JTQLQIEISA-N 1 2 246.310 2.453 20 0 BEADLO C[C@H]1O[C@@H](C)[C@H](C)[C@@H]1[NH2+]CC(F)(F)C(F)F ZINC000701034487 712013243 /nfs/dbraw/zinc/01/32/43/712013243.db2.gz JIVGNZURDULPEI-HSNKUXOKSA-N 1 2 243.244 2.288 20 0 BEADLO CCO[C@H]1CC[N@H+](Cc2cnc(Cl)s2)C1 ZINC000701693990 712028093 /nfs/dbraw/zinc/02/80/93/712028093.db2.gz ZGQVHGXLLVMMLI-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO CCO[C@H]1CC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC000701693990 712028095 /nfs/dbraw/zinc/02/80/95/712028095.db2.gz ZGQVHGXLLVMMLI-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO CCC[C@H](CNc1cc(NC)nc[nH+]1)OCC ZINC000705336898 712129395 /nfs/dbraw/zinc/12/93/95/712129395.db2.gz HXOXTRALOFRHBU-SNVBAGLBSA-N 1 2 238.335 2.135 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2cn(C)cn2)o1 ZINC000710006564 712239304 /nfs/dbraw/zinc/23/93/04/712239304.db2.gz MWURBXPIZAPDPQ-JTQLQIEISA-N 1 2 219.288 2.172 20 0 BEADLO COc1ccc[nH+]c1NCCc1ccns1 ZINC000710011985 712240521 /nfs/dbraw/zinc/24/05/21/712240521.db2.gz VOKNHZBIZUTBEB-UHFFFAOYSA-N 1 2 235.312 2.201 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1cncs1)c1cn(C)cn1 ZINC000710184237 712247359 /nfs/dbraw/zinc/24/73/59/712247359.db2.gz NIRNQPGZVICMHB-RKDXNWHRSA-N 1 2 236.344 2.288 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1cncs1)c1cn(C)cn1 ZINC000710184233 712247674 /nfs/dbraw/zinc/24/76/74/712247674.db2.gz NIRNQPGZVICMHB-IUCAKERBSA-N 1 2 236.344 2.288 20 0 BEADLO C[C@H]1COC[C@H]1Nc1ccc([NH+](C)C)cc1 ZINC000710887604 712261514 /nfs/dbraw/zinc/26/15/14/712261514.db2.gz DFHOWDSTJUENCU-GXFFZTMASA-N 1 2 220.316 2.199 20 0 BEADLO CCCNc1cc(NCCC(C)(F)F)nc[nH+]1 ZINC000379307342 712373324 /nfs/dbraw/zinc/37/33/24/712373324.db2.gz VZPRDJKUQJYVMX-UHFFFAOYSA-N 1 2 244.289 2.178 20 0 BEADLO CCCNc1cc(NCCC(C)(F)F)[nH+]cn1 ZINC000379307342 712373325 /nfs/dbraw/zinc/37/33/25/712373325.db2.gz VZPRDJKUQJYVMX-UHFFFAOYSA-N 1 2 244.289 2.178 20 0 BEADLO C[C@H]1COCC[N@H+](C/C(Cl)=C\Cl)C1 ZINC000379358273 712376120 /nfs/dbraw/zinc/37/61/20/712376120.db2.gz UWOKPAQACLUFTO-SXPLAPADSA-N 1 2 224.131 2.274 20 0 BEADLO C[C@H]1COCC[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000379358273 712376122 /nfs/dbraw/zinc/37/61/22/712376122.db2.gz UWOKPAQACLUFTO-SXPLAPADSA-N 1 2 224.131 2.274 20 0 BEADLO Cc1[nH]c(CN[C@H](C)c2ccns2)[nH+]c1C ZINC000716032691 712547120 /nfs/dbraw/zinc/54/71/20/712547120.db2.gz GOVBJMOIOTXPGV-SECBINFHSA-N 1 2 236.344 2.334 20 0 BEADLO Cc1nc(C[NH2+][C@H](C)c2ccns2)[nH]c1C ZINC000716032691 712547121 /nfs/dbraw/zinc/54/71/21/712547121.db2.gz GOVBJMOIOTXPGV-SECBINFHSA-N 1 2 236.344 2.334 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1nccn1C)c1ccns1 ZINC000716036239 712547630 /nfs/dbraw/zinc/54/76/30/712547630.db2.gz ZYJHLMIXFGYSRZ-BDAKNGLRSA-N 1 2 236.344 2.288 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCn2ccnc21)c1ccns1 ZINC000716000001 712551721 /nfs/dbraw/zinc/55/17/21/712551721.db2.gz RURRSFINIQKOLT-RKDXNWHRSA-N 1 2 234.328 2.135 20 0 BEADLO Cc1[nH]nc(CNc2cccc(C)[nH+]2)c1C ZINC000716449316 712561576 /nfs/dbraw/zinc/56/15/76/712561576.db2.gz ZVEAUZFYGZEIDE-UHFFFAOYSA-N 1 2 216.288 2.342 20 0 BEADLO Cc1n[nH]c(C[NH2+][C@@H]2C[C@@H](C)n3ccnc32)c1C ZINC000716465325 712563106 /nfs/dbraw/zinc/56/31/06/712563106.db2.gz LDNKAABLYZGDQV-LDYMZIIASA-N 1 2 245.330 2.019 20 0 BEADLO CC[C@H](C[C@H](C)O)Nc1[nH+]cccc1OC ZINC000716879625 712580273 /nfs/dbraw/zinc/58/02/73/712580273.db2.gz KXYWRDBISBWXBC-VHSXEESVSA-N 1 2 224.304 2.052 20 0 BEADLO Cc1coc(C[NH2+]Cc2snnc2C)c1 ZINC000718035541 712737468 /nfs/dbraw/zinc/73/74/68/712737468.db2.gz LDKRZJISNWCAMC-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO CCOC1CC2(C[C@@H]2Nc2[nH+]cccc2OC)C1 ZINC000721168828 712894112 /nfs/dbraw/zinc/89/41/12/712894112.db2.gz KOYRHUYYHKUXFP-KHJSKFAYSA-N 1 2 248.326 2.460 20 0 BEADLO C1=CCC[C@@H](OCC[NH+]2CCOCC2)CCC1 ZINC001210206829 957669725 /nfs/dbraw/zinc/66/97/25/957669725.db2.gz JRHVTCLTMQOHFJ-CQSZACIVSA-N 1 2 239.359 2.224 20 0 BEADLO Fc1ccc(F)c(O[C@H]2CC[NH2+]CC2(F)F)c1 ZINC001218007479 959829374 /nfs/dbraw/zinc/82/93/74/959829374.db2.gz QQAYWKRAUIUBOS-JTQLQIEISA-N 1 2 249.207 2.341 20 0 BEADLO C[C@H]([NH2+]Cc1nn(C)cc1Cl)C1(Cl)CC1 ZINC000695654618 960326843 /nfs/dbraw/zinc/32/68/43/960326843.db2.gz IJKZOTBYBLBYTI-ZETCQYMHSA-N 1 2 248.157 2.323 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2ccc(CO)o2)C[C@@H]1F ZINC001140679026 960490009 /nfs/dbraw/zinc/49/00/09/960490009.db2.gz NXAMDKSEFOJERI-RYUDHWBXSA-N 1 2 245.269 2.044 20 0 BEADLO CO[C@H]1CC[N@H+](Cc2cc(Cl)ncc2F)C1 ZINC001140606082 960455313 /nfs/dbraw/zinc/45/53/13/960455313.db2.gz WAYZVLLLOFLABL-VIFPVBQESA-N 1 2 244.697 2.095 20 0 BEADLO CO[C@H]1CC[N@@H+](Cc2cc(Cl)ncc2F)C1 ZINC001140606082 960455319 /nfs/dbraw/zinc/45/53/19/960455319.db2.gz WAYZVLLLOFLABL-VIFPVBQESA-N 1 2 244.697 2.095 20 0 BEADLO C[N@H+](Cc1cnco1)Cc1cccc(F)c1 ZINC001140927289 960695170 /nfs/dbraw/zinc/69/51/70/960695170.db2.gz MAVZYYIZSMADGX-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO C[N@@H+](Cc1cnco1)Cc1cccc(F)c1 ZINC001140927289 960695186 /nfs/dbraw/zinc/69/51/86/960695186.db2.gz MAVZYYIZSMADGX-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO COC(=O)[C@H](C)c1ccc(NCC(C)C)[nH+]c1 ZINC001161647147 962996893 /nfs/dbraw/zinc/99/68/93/962996893.db2.gz LOEVNHXGSMYMNK-SNVBAGLBSA-N 1 2 236.315 2.426 20 0 BEADLO Cc1cc[nH+]c(C)c1NCc1nccn1C ZINC000304616294 963095928 /nfs/dbraw/zinc/09/59/28/963095928.db2.gz XIWFGEFHRCNPPW-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO CCc1coc(CNc2cccc[nH+]2)n1 ZINC001162133920 964851614 /nfs/dbraw/zinc/85/16/14/964851614.db2.gz HFMXXBOGVYNOBD-UHFFFAOYSA-N 1 2 203.245 2.244 20 0 BEADLO C[C@H]1CC[N@@H+]1Cc1cnccc1Br ZINC001237383956 966652456 /nfs/dbraw/zinc/65/24/56/966652456.db2.gz HDEAVKWAKSBXGG-QMMMGPOBSA-N 1 2 241.132 2.438 20 0 BEADLO C[C@H]1CC[N@H+]1Cc1cnccc1Br ZINC001237383956 966652476 /nfs/dbraw/zinc/65/24/76/966652476.db2.gz HDEAVKWAKSBXGG-QMMMGPOBSA-N 1 2 241.132 2.438 20 0 BEADLO COc1ccc(C[N@H+](C)CCF)c(OC)c1C ZINC001204267981 966953297 /nfs/dbraw/zinc/95/32/97/966953297.db2.gz XSYUXZZJWJWAOB-UHFFFAOYSA-N 1 2 241.306 2.414 20 0 BEADLO COc1ccc(C[N@@H+](C)CCF)c(OC)c1C ZINC001204267981 966953303 /nfs/dbraw/zinc/95/33/03/966953303.db2.gz XSYUXZZJWJWAOB-UHFFFAOYSA-N 1 2 241.306 2.414 20 0 BEADLO CNC(=O)Nc1ccc2c(cc[nH+]c2N(C)C)c1 ZINC001670366441 1165817786 /nfs/dbraw/zinc/81/77/86/1165817786.db2.gz LUTZWLPSQMEYSZ-UHFFFAOYSA-N 1 2 244.298 2.052 20 0 BEADLO CO[C@H]1C[N@@H+](Cc2ccc(F)c(C)c2)C[C@@H]1F ZINC001205161282 967404135 /nfs/dbraw/zinc/40/41/35/967404135.db2.gz FMMPRWOJYHUKEJ-STQMWFEESA-N 1 2 241.281 2.303 20 0 BEADLO CC1(C)CCC[C@@H](OCC[NH+]2CCOCC2)C1 ZINC001210224926 1165854163 /nfs/dbraw/zinc/85/41/63/1165854163.db2.gz KORBUCZNRBYSEA-CYBMUJFWSA-N 1 2 241.375 2.304 20 0 BEADLO COc1nccc(C)c1Nc1c[nH+]c(C)c(N)c1 ZINC001210287345 1165864695 /nfs/dbraw/zinc/86/46/95/1165864695.db2.gz QQMBSEVXJSXQKJ-UHFFFAOYSA-N 1 2 244.298 2.428 20 0 BEADLO COCCCc1ccc(N2CCCC2)[nH+]c1 ZINC001250300716 967647174 /nfs/dbraw/zinc/64/71/74/967647174.db2.gz VMMAAOWDEMXTFF-UHFFFAOYSA-N 1 2 220.316 2.261 20 0 BEADLO OCCCCC[N@@H+]1CC[C@H](CF)C(F)(F)C1 ZINC001205895231 967877515 /nfs/dbraw/zinc/87/75/15/967877515.db2.gz BYBPBWCRDLPGBB-SNVBAGLBSA-N 1 2 239.281 2.076 20 0 BEADLO OCCCCC[N@H+]1CC[C@H](CF)C(F)(F)C1 ZINC001205895231 967877516 /nfs/dbraw/zinc/87/75/16/967877516.db2.gz BYBPBWCRDLPGBB-SNVBAGLBSA-N 1 2 239.281 2.076 20 0 BEADLO CCc1[nH+]ccc(C)c1NC[C@H](O)CC ZINC001251763758 968317305 /nfs/dbraw/zinc/31/73/05/968317305.db2.gz ICBVOIIGFMTNQP-SNVBAGLBSA-N 1 2 208.305 2.135 20 0 BEADLO CC(C)N(C)Cc1[nH+]cc2ccccn21 ZINC001207048291 968575326 /nfs/dbraw/zinc/57/53/26/968575326.db2.gz JBDPJXOLUNWVRQ-UHFFFAOYSA-N 1 2 203.289 2.175 20 0 BEADLO CC(C)n1nccc1C[NH+]1CC2(CSC2)C1 ZINC001207174918 1166054072 /nfs/dbraw/zinc/05/40/72/1166054072.db2.gz IEZKGKPNNUCOME-UHFFFAOYSA-N 1 2 237.372 2.013 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1c(C)noc1C ZINC000111691864 1166055930 /nfs/dbraw/zinc/05/59/30/1166055930.db2.gz CTOGPIITMMOHBT-ZDUSSCGKSA-N 1 2 236.315 2.235 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@H+]1Cc1c(C)noc1C ZINC000111691864 1166055935 /nfs/dbraw/zinc/05/59/35/1166055935.db2.gz CTOGPIITMMOHBT-ZDUSSCGKSA-N 1 2 236.315 2.235 20 0 BEADLO C[C@H](C(=O)N1CC[C@H](C2CCC2)C1)n1cc[nH+]c1 ZINC001348465877 1166090273 /nfs/dbraw/zinc/09/02/73/1166090273.db2.gz QZVHEEQQQQRAQZ-YPMHNXCESA-N 1 2 247.342 2.093 20 0 BEADLO CCC[C@H](O)C[N@@H+]1CCC[C@@H](F)C(F)(F)C1 ZINC001252779419 968952441 /nfs/dbraw/zinc/95/24/41/968952441.db2.gz QEOJHMGECKHNSO-VHSXEESVSA-N 1 2 239.281 2.217 20 0 BEADLO CCC[C@H](O)C[N@H+]1CCC[C@@H](F)C(F)(F)C1 ZINC001252779419 968952447 /nfs/dbraw/zinc/95/24/47/968952447.db2.gz QEOJHMGECKHNSO-VHSXEESVSA-N 1 2 239.281 2.217 20 0 BEADLO c1cn2cc(-c3cscn3)ccc2[nH+]1 ZINC001241890856 969134754 /nfs/dbraw/zinc/13/47/54/969134754.db2.gz WRQQFKMJOBFSIN-UHFFFAOYSA-N 1 2 201.254 2.458 20 0 BEADLO Nc1cc(-c2ccc3c(c2)COC3)cc[nH+]1 ZINC000227663901 1166248227 /nfs/dbraw/zinc/24/82/27/1166248227.db2.gz VXMSRNJICJUKBX-UHFFFAOYSA-N 1 2 212.252 2.361 20 0 BEADLO CC/C=C\CC[N@@H+]1Cc2cnn(C)c2C1 ZINC001208729173 969217703 /nfs/dbraw/zinc/21/77/03/969217703.db2.gz NLWIUOKOQDURFQ-PLNGDYQASA-N 1 2 205.305 2.092 20 0 BEADLO CC/C=C\CC[N@H+]1Cc2cnn(C)c2C1 ZINC001208729173 969217710 /nfs/dbraw/zinc/21/77/10/969217710.db2.gz NLWIUOKOQDURFQ-PLNGDYQASA-N 1 2 205.305 2.092 20 0 BEADLO CCOc1cc[nH+]cc1NC[C@@H](O)C(C)(C)C ZINC001253716656 969342593 /nfs/dbraw/zinc/34/25/93/969342593.db2.gz FOXCGUXXPLVFAS-GFCCVEGCSA-N 1 2 238.331 2.299 20 0 BEADLO Cc1ccc(NC(=O)C[C@@H]([NH3+])C(F)F)c(C)c1 ZINC000724762563 1166363159 /nfs/dbraw/zinc/36/31/59/1166363159.db2.gz QAXRXIYNPRKBEF-SECBINFHSA-N 1 2 242.269 2.224 20 0 BEADLO CCOC(=O)[C@H]1CSCC[N@@H+]1CC(C)(C)C ZINC000259678072 1166373122 /nfs/dbraw/zinc/37/31/22/1166373122.db2.gz JKTPGQLMLFRPEH-SNVBAGLBSA-N 1 2 245.388 2.013 20 0 BEADLO CCOC(=O)[C@H]1CSCC[N@H+]1CC(C)(C)C ZINC000259678072 1166373129 /nfs/dbraw/zinc/37/31/29/1166373129.db2.gz JKTPGQLMLFRPEH-SNVBAGLBSA-N 1 2 245.388 2.013 20 0 BEADLO CC[C@@H]1CCC[C@@H](C[NH2+]Cc2ncn[nH]2)C1 ZINC000394534714 1166596067 /nfs/dbraw/zinc/59/60/67/1166596067.db2.gz CCSLWPJIGXRAAB-GHMZBOCLSA-N 1 2 222.336 2.111 20 0 BEADLO CC1(C)COCC[N@@H+]1Cc1c(N)cccc1F ZINC000109427383 1166602792 /nfs/dbraw/zinc/60/27/92/1166602792.db2.gz MWSNAHLIINXLQB-UHFFFAOYSA-N 1 2 238.306 2.019 20 0 BEADLO CC1(C)COCC[N@H+]1Cc1c(N)cccc1F ZINC000109427383 1166602798 /nfs/dbraw/zinc/60/27/98/1166602798.db2.gz MWSNAHLIINXLQB-UHFFFAOYSA-N 1 2 238.306 2.019 20 0 BEADLO CCC[C@](C)(CC)C(=O)NC1C[NH+](CC)C1 ZINC001267663240 1166605251 /nfs/dbraw/zinc/60/52/51/1166605251.db2.gz LCWBDQHCOBWEDJ-ZDUSSCGKSA-N 1 2 226.364 2.023 20 0 BEADLO CCCCOc1ccc(C[NH+]2CC(O)C2)cc1 ZINC000291433260 970171789 /nfs/dbraw/zinc/17/17/89/970171789.db2.gz JLFHSOURKBTEGG-UHFFFAOYSA-N 1 2 235.327 2.042 20 0 BEADLO C[C@@H](CC(F)(F)F)[N@H+]1CCC(=O)[C@@H](F)CC1 ZINC001255646584 970428499 /nfs/dbraw/zinc/42/84/99/970428499.db2.gz PFFPHXYCMZAOIZ-YUMQZZPRSA-N 1 2 241.228 2.330 20 0 BEADLO C[C@@H](CC(F)(F)F)[N@@H+]1CCC(=O)[C@@H](F)CC1 ZINC001255646584 970428504 /nfs/dbraw/zinc/42/85/04/970428504.db2.gz PFFPHXYCMZAOIZ-YUMQZZPRSA-N 1 2 241.228 2.330 20 0 BEADLO C[C@@H](CC(F)(F)F)[N@@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001255662167 970444122 /nfs/dbraw/zinc/44/41/22/970444122.db2.gz HXJLEQFPRMQMCA-DJLDLDEBSA-N 1 2 223.238 2.191 20 0 BEADLO C[C@@H](CC(F)(F)F)[N@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001255662167 970444125 /nfs/dbraw/zinc/44/41/25/970444125.db2.gz HXJLEQFPRMQMCA-DJLDLDEBSA-N 1 2 223.238 2.191 20 0 BEADLO Cc1noc([C@@H]([NH2+]C/C=C\Cl)C(C)C)n1 ZINC000380078141 1166826028 /nfs/dbraw/zinc/82/60/28/1166826028.db2.gz FWKCJQBDVIIJEF-WBSSQXGSSA-N 1 2 229.711 2.417 20 0 BEADLO Cc1cc(CO[C@@H]2CCOC[C@H]2F)cc(C)[nH+]1 ZINC001223425979 1166863870 /nfs/dbraw/zinc/86/38/70/1166863870.db2.gz WIVJHRFTKQAWIP-CHWSQXEVSA-N 1 2 239.290 2.342 20 0 BEADLO Cc1nc2c(NC=[NH2+])cc(C(F)(F)F)cn2n1 ZINC001167871366 1166878030 /nfs/dbraw/zinc/87/80/30/1166878030.db2.gz MVHKVQZPLTYZCH-UHFFFAOYSA-N 1 2 243.192 2.075 20 0 BEADLO COC(=O)[C@H](CC(C)C)[NH2+]CCSC(C)C ZINC000304231297 1166904542 /nfs/dbraw/zinc/90/45/42/1166904542.db2.gz ATTVRGRLGNTACO-NSHDSACASA-N 1 2 247.404 2.305 20 0 BEADLO COc1ccc(C)cc1OC1C[NH+](C(C)C)C1 ZINC001225322381 1166967253 /nfs/dbraw/zinc/96/72/53/1166967253.db2.gz DJMUZQWEXCDFIZ-UHFFFAOYSA-N 1 2 235.327 2.475 20 0 BEADLO Cn1cccc1C[N@H+]1CC[C@](C)(F)[C@H](F)C1 ZINC001203254256 975055911 /nfs/dbraw/zinc/05/59/11/975055911.db2.gz OKNSRZWYZIYXFQ-NEPJUHHUSA-N 1 2 228.286 2.297 20 0 BEADLO CCSC[C@H](C)[N@@H+]1CCC[C@H](F)C(=O)C1 ZINC001173299379 975192230 /nfs/dbraw/zinc/19/22/30/975192230.db2.gz GHCLYYIESRIWTD-UWVGGRQHSA-N 1 2 233.352 2.131 20 0 BEADLO CCSC[C@H](C)[N@H+]1CCC[C@H](F)C(=O)C1 ZINC001173299379 975192233 /nfs/dbraw/zinc/19/22/33/975192233.db2.gz GHCLYYIESRIWTD-UWVGGRQHSA-N 1 2 233.352 2.131 20 0 BEADLO CC(C)c1nc(CNC[C@H]2CC[N@@H+]2C)cs1 ZINC000712585293 1167052227 /nfs/dbraw/zinc/05/22/27/1167052227.db2.gz FGOFVCNXBSHYOJ-LLVKDONJSA-N 1 2 239.388 2.060 20 0 BEADLO CC(C)c1nc(CNC[C@H]2CC[N@H+]2C)cs1 ZINC000712585293 1167052232 /nfs/dbraw/zinc/05/22/32/1167052232.db2.gz FGOFVCNXBSHYOJ-LLVKDONJSA-N 1 2 239.388 2.060 20 0 BEADLO CCSC[C@@H](C)[NH2+][C@H](C(=O)OC)[C@@H](C)CC ZINC001173292627 975262451 /nfs/dbraw/zinc/26/24/51/975262451.db2.gz NHGBAQVLLBIBKZ-AXFHLTTASA-N 1 2 247.404 2.305 20 0 BEADLO CC[C@H](C)Nc1ccc(CC(=O)OC)c[nH+]1 ZINC001168001200 1167139236 /nfs/dbraw/zinc/13/92/36/1167139236.db2.gz WUXZKMQMPICQCF-VIFPVBQESA-N 1 2 222.288 2.008 20 0 BEADLO Cc1cc(F)cc(CN2CCn3c[nH+]cc3C2)c1 ZINC001143590494 1167187742 /nfs/dbraw/zinc/18/77/42/1167187742.db2.gz WMXFQKIYXHFXFZ-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO CCOC(=O)C[C@@H]1CC[C@H]([NH+]2CC(C)(F)C2)C1 ZINC001173643669 975509936 /nfs/dbraw/zinc/50/99/36/975509936.db2.gz XGMQWKMQBFNVLC-MNOVXSKESA-N 1 2 243.322 2.152 20 0 BEADLO Fc1c[nH+]ccc1NCc1ccncc1 ZINC000308882853 1167213200 /nfs/dbraw/zinc/21/32/00/1167213200.db2.gz RAIHAYVOCPEKOO-UHFFFAOYSA-N 1 2 203.220 2.228 20 0 BEADLO COC[C@@H](CNc1[nH+]cccc1OC)C(C)C ZINC000896501119 1167285759 /nfs/dbraw/zinc/28/57/59/1167285759.db2.gz CNIIWLBQUXRVBZ-LLVKDONJSA-N 1 2 238.331 2.421 20 0 BEADLO CCC(C)(CC)C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000896914173 1167335227 /nfs/dbraw/zinc/33/52/27/1167335227.db2.gz SZUPQLUKCDSUIL-UHFFFAOYSA-N 1 2 237.347 2.469 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H]2C[C@]2(C)C(C)C)[nH+]c1C ZINC000896914167 1167335408 /nfs/dbraw/zinc/33/54/08/1167335408.db2.gz SQALAYDFLMOUTA-SMDDNHRTSA-N 1 2 249.358 2.325 20 0 BEADLO Cc1cc(O)cc(-c2ccc(N)[nH+]c2)c1 ZINC001206233805 977068526 /nfs/dbraw/zinc/06/85/26/977068526.db2.gz ASJLHYSXPRWWAN-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO CC1(C)COCC[N@@H+]1Cc1cc(F)ccc1N ZINC000042461207 1167437089 /nfs/dbraw/zinc/43/70/89/1167437089.db2.gz KCYNAGDVUGPADZ-UHFFFAOYSA-N 1 2 238.306 2.019 20 0 BEADLO CC1(C)COCC[N@H+]1Cc1cc(F)ccc1N ZINC000042461207 1167437095 /nfs/dbraw/zinc/43/70/95/1167437095.db2.gz KCYNAGDVUGPADZ-UHFFFAOYSA-N 1 2 238.306 2.019 20 0 BEADLO CCC(F)(F)C[NH2+]C[C@H](O)c1ccc(F)cc1 ZINC000697554818 1167506536 /nfs/dbraw/zinc/50/65/36/1167506536.db2.gz XXDKDYFLUSGLKZ-NSHDSACASA-N 1 2 247.260 2.494 20 0 BEADLO Cc1cc(F)ncc1C[NH+]1CC2(CSC2)C1 ZINC001231985703 977823137 /nfs/dbraw/zinc/82/31/37/977823137.db2.gz RJFIMWJGVNTJQS-UHFFFAOYSA-N 1 2 238.331 2.078 20 0 BEADLO C[N@H+](Cc1cnsc1)Cc1ccncc1 ZINC001232224994 977950321 /nfs/dbraw/zinc/95/03/21/977950321.db2.gz UCVKWNVWDDZOBI-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO C[N@@H+](Cc1cnsc1)Cc1ccncc1 ZINC001232224994 977950331 /nfs/dbraw/zinc/95/03/31/977950331.db2.gz UCVKWNVWDDZOBI-UHFFFAOYSA-N 1 2 219.313 2.170 20 0 BEADLO CCOc1ccc(OC)cc1C[N@H+](C)CCF ZINC001232387417 978047305 /nfs/dbraw/zinc/04/73/05/978047305.db2.gz JKAQCNMWFNFACE-UHFFFAOYSA-N 1 2 241.306 2.495 20 0 BEADLO CCOc1ccc(OC)cc1C[N@@H+](C)CCF ZINC001232387417 978047318 /nfs/dbraw/zinc/04/73/18/978047318.db2.gz JKAQCNMWFNFACE-UHFFFAOYSA-N 1 2 241.306 2.495 20 0 BEADLO CSCC[N@@H+](C)Cc1ccc(F)c(O)c1F ZINC001232939242 978350589 /nfs/dbraw/zinc/35/05/89/978350589.db2.gz IAWYVMIVGHAOGM-UHFFFAOYSA-N 1 2 247.310 2.465 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)c1ccsc1 ZINC001597677511 978351021 /nfs/dbraw/zinc/35/10/21/978351021.db2.gz YVVUDQLNEXITKT-UHFFFAOYSA-N 1 2 232.308 2.434 20 0 BEADLO CCC[C@H](C)C(=O)Nc1c(C)c[nH+]cc1C ZINC001337509332 978381112 /nfs/dbraw/zinc/38/11/12/978381112.db2.gz LPAFWOGUCOOTFP-VIFPVBQESA-N 1 2 220.316 2.495 20 0 BEADLO CCc1ccc(N(C)C[C@H]2CCCO2)[nH+]c1 ZINC001337832863 978518496 /nfs/dbraw/zinc/51/84/96/978518496.db2.gz UWXBCXXJJNPURK-GFCCVEGCSA-N 1 2 220.316 2.259 20 0 BEADLO Cc1cnsc1C[N@@H+]1CCO[C@H](C(C)C)C1 ZINC001233321740 978563831 /nfs/dbraw/zinc/56/38/31/978563831.db2.gz AZDKYUAXTSKETD-NSHDSACASA-N 1 2 240.372 2.308 20 0 BEADLO Cc1cnsc1C[N@H+]1CCO[C@H](C(C)C)C1 ZINC001233321740 978563835 /nfs/dbraw/zinc/56/38/35/978563835.db2.gz AZDKYUAXTSKETD-NSHDSACASA-N 1 2 240.372 2.308 20 0 BEADLO F[C@H]1C[C@@H]2C[C@H]1C[N@@H+]2Cc1cncc(Cl)n1 ZINC001233450175 978605503 /nfs/dbraw/zinc/60/55/03/978605503.db2.gz JKSSCGWDTVDCPU-HGNGGELXSA-N 1 2 241.697 2.062 20 0 BEADLO F[C@H]1C[C@@H]2C[C@H]1C[N@H+]2Cc1cncc(Cl)n1 ZINC001233450175 978605511 /nfs/dbraw/zinc/60/55/11/978605511.db2.gz JKSSCGWDTVDCPU-HGNGGELXSA-N 1 2 241.697 2.062 20 0 BEADLO CCOc1ccc(OC2C[NH+](C)C2)cc1Cl ZINC001233644670 978659635 /nfs/dbraw/zinc/65/96/35/978659635.db2.gz ZIZAWQOZFCZECZ-UHFFFAOYSA-N 1 2 241.718 2.432 20 0 BEADLO CCOCCc1ccc2[nH]c(C)[nH+]c2c1 ZINC001249942949 978740508 /nfs/dbraw/zinc/74/05/08/978740508.db2.gz GXWLWDDITOLTML-UHFFFAOYSA-N 1 2 204.273 2.450 20 0 BEADLO COc1cc(Nc2ccc(C)[nH+]c2C)no1 ZINC001203367637 979237719 /nfs/dbraw/zinc/23/77/19/979237719.db2.gz NLMLSKVHDKHVMU-UHFFFAOYSA-N 1 2 219.244 2.439 20 0 BEADLO Clc1nccnc1C[N@@H+]1CCC[C@@H]2C[C@@H]21 ZINC001236623704 979684783 /nfs/dbraw/zinc/68/47/83/979684783.db2.gz HFTLHFNZXCOIES-SCZZXKLOSA-N 1 2 223.707 2.114 20 0 BEADLO Clc1nccnc1C[N@H+]1CCC[C@@H]2C[C@@H]21 ZINC001236623704 979684786 /nfs/dbraw/zinc/68/47/86/979684786.db2.gz HFTLHFNZXCOIES-SCZZXKLOSA-N 1 2 223.707 2.114 20 0 BEADLO C[C@@H]1CC(=O)CC[N@@H+]1CC1OC=CC1=S ZINC001237181009 979833658 /nfs/dbraw/zinc/83/36/58/979833658.db2.gz LGFZUDMVLOVFEP-MRVPVSSYSA-N 1 2 225.313 2.122 20 0 BEADLO C[C@@H]1CC(=O)CC[N@H+]1CC1OC=CC1=S ZINC001237181009 979833661 /nfs/dbraw/zinc/83/36/61/979833661.db2.gz LGFZUDMVLOVFEP-MRVPVSSYSA-N 1 2 225.313 2.122 20 0 BEADLO CCCN(CCC)c1cc(N(C)C)[nH+]cn1 ZINC000140166074 1168366133 /nfs/dbraw/zinc/36/61/33/1168366133.db2.gz WRPVHVBOCBSKJN-UHFFFAOYSA-N 1 2 222.336 2.169 20 0 BEADLO CCCN(CCC)c1cc(N(C)C)nc[nH+]1 ZINC000140166074 1168366141 /nfs/dbraw/zinc/36/61/41/1168366141.db2.gz WRPVHVBOCBSKJN-UHFFFAOYSA-N 1 2 222.336 2.169 20 0 BEADLO COc1ccc(OC)c(C[N@H+]2CC[C@@H]2C)c1F ZINC001237573875 979942996 /nfs/dbraw/zinc/94/29/96/979942996.db2.gz XYXHDVQTMMVPSF-VIFPVBQESA-N 1 2 239.290 2.437 20 0 BEADLO CCc1[nH]ncc1C[N@@H+]1CCC[C@@H](C(F)F)C1 ZINC001237651845 980014323 /nfs/dbraw/zinc/01/43/23/980014323.db2.gz ZQTUHJYBUYHYBT-SECBINFHSA-N 1 2 243.301 2.449 20 0 BEADLO CCc1[nH]ncc1C[N@H+]1CCC[C@@H](C(F)F)C1 ZINC001237651845 980014330 /nfs/dbraw/zinc/01/43/30/980014330.db2.gz ZQTUHJYBUYHYBT-SECBINFHSA-N 1 2 243.301 2.449 20 0 BEADLO CCCc1ncc(C[NH2+]Cc2ocnc2C)o1 ZINC000823018902 1168444511 /nfs/dbraw/zinc/44/45/11/1168444511.db2.gz LPYCIGFUVITSSR-UHFFFAOYSA-N 1 2 235.287 2.213 20 0 BEADLO COc1cnc(C[N@@H+]2CC[C@@H]2C)c(Cl)c1 ZINC001238485299 980275569 /nfs/dbraw/zinc/27/55/69/980275569.db2.gz SGPCDQUHVKRHCM-QMMMGPOBSA-N 1 2 226.707 2.338 20 0 BEADLO COc1cnc(C[N@H+]2CC[C@@H]2C)c(Cl)c1 ZINC001238485299 980275577 /nfs/dbraw/zinc/27/55/77/980275577.db2.gz SGPCDQUHVKRHCM-QMMMGPOBSA-N 1 2 226.707 2.338 20 0 BEADLO OCc1cc(Cl)cc(CCn2cc[nH+]c2)c1 ZINC001250319433 980764609 /nfs/dbraw/zinc/76/46/09/980764609.db2.gz DKYGGFKDSSUIBF-UHFFFAOYSA-N 1 2 236.702 2.272 20 0 BEADLO Cn1c[nH+]cc1CCCOC(=O)CC1(C)CC1 ZINC001346235660 980794894 /nfs/dbraw/zinc/79/48/94/980794894.db2.gz PILAZEPKIZRGQK-UHFFFAOYSA-N 1 2 236.315 2.086 20 0 BEADLO CN(C)c1cc(-c2cnc(N)c(Cl)c2)cc[nH+]1 ZINC001245567305 1168602586 /nfs/dbraw/zinc/60/25/86/1168602586.db2.gz SONBTPOJEFAICN-UHFFFAOYSA-N 1 2 248.717 2.445 20 0 BEADLO CC(C)(C)[C@H]1CCC[N@H+](Cc2nnc[nH]2)C1 ZINC001347113939 980974256 /nfs/dbraw/zinc/97/42/56/980974256.db2.gz MNWQYLVSJAXSDR-JTQLQIEISA-N 1 2 222.336 2.063 20 0 BEADLO CC(C)(C)[C@H]1CCC[N@@H+](Cc2nnc[nH]2)C1 ZINC001347113939 980974260 /nfs/dbraw/zinc/97/42/60/980974260.db2.gz MNWQYLVSJAXSDR-JTQLQIEISA-N 1 2 222.336 2.063 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1CCC[C@@H](F)C1 ZINC001349775589 981722909 /nfs/dbraw/zinc/72/29/09/981722909.db2.gz HCVUAUCXZUBBOO-RKDXNWHRSA-N 1 2 212.243 2.335 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@@H](C)C(C)C ZINC001350335203 981930755 /nfs/dbraw/zinc/93/07/55/981930755.db2.gz SZZRCDOODABTJB-JTQLQIEISA-N 1 2 224.304 2.238 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)[C@H](C)n1cc[nH+]c1 ZINC001351044320 982182909 /nfs/dbraw/zinc/18/29/09/982182909.db2.gz LBCFPIOCQQDOTM-MNOVXSKESA-N 1 2 223.320 2.091 20 0 BEADLO CCCCCNC(=S)Nc1cc[nH+]c(C)c1 ZINC001200040529 982530081 /nfs/dbraw/zinc/53/00/81/982530081.db2.gz BAXJICVYKPYZTL-UHFFFAOYSA-N 1 2 237.372 2.289 20 0 BEADLO OCc1cc[nH+]c(N[C@@H]2CCC[C@H](F)C2)c1 ZINC001353017756 982668389 /nfs/dbraw/zinc/66/83/89/982668389.db2.gz PSAIPGLELKQDGI-WDEREUQCSA-N 1 2 224.279 2.267 20 0 BEADLO COc1cccc(C[N@@H+]2C[C@@H](F)C[C@H]2C)n1 ZINC001137528677 983053254 /nfs/dbraw/zinc/05/32/54/983053254.db2.gz PCVUTEKQHZEBBI-ZJUUUORDSA-N 1 2 224.279 2.023 20 0 BEADLO COc1cccc(C[N@H+]2C[C@@H](F)C[C@H]2C)n1 ZINC001137528677 983053263 /nfs/dbraw/zinc/05/32/63/983053263.db2.gz PCVUTEKQHZEBBI-ZJUUUORDSA-N 1 2 224.279 2.023 20 0 BEADLO Cn1c[nH+]c(CCNc2cc(Cl)ccn2)c1 ZINC001354213851 983198620 /nfs/dbraw/zinc/19/86/20/983198620.db2.gz PERQHSMUFQGSNE-UHFFFAOYSA-N 1 2 236.706 2.123 20 0 BEADLO CC(C)=CCC[C@@H](C)C[N@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001201496919 983262569 /nfs/dbraw/zinc/26/25/69/983262569.db2.gz SDLLXYKNXJWJES-AGIUHOORSA-N 1 2 237.343 2.369 20 0 BEADLO CCC[C@H](O)CNc1cc[nH+]c(OCC)c1 ZINC001252774194 983876656 /nfs/dbraw/zinc/87/66/56/983876656.db2.gz IZANUEMVEQDAJX-NSHDSACASA-N 1 2 224.304 2.053 20 0 BEADLO Cc1csc(C[NH+]2CC3(CCO3)C2)c1 ZINC001137158565 984004950 /nfs/dbraw/zinc/00/49/50/984004950.db2.gz YUWIPJOTBPXBOG-UHFFFAOYSA-N 1 2 209.314 2.031 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@@H+]1[C@@H](C)CCC(C)C ZINC001256363118 970765471 /nfs/dbraw/zinc/76/54/71/970765471.db2.gz GWQPJXMUHQVYQU-SRVKXCTJSA-N 1 2 245.338 2.397 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@H+]1[C@@H](C)CCC(C)C ZINC001256363118 970765481 /nfs/dbraw/zinc/76/54/81/970765481.db2.gz GWQPJXMUHQVYQU-SRVKXCTJSA-N 1 2 245.338 2.397 20 0 BEADLO C[C@@H](COC(C)(C)C)OCc1c[nH+]cn1C ZINC001222588017 972586791 /nfs/dbraw/zinc/58/67/91/972586791.db2.gz VOMGUYBCUWSJAS-JTQLQIEISA-N 1 2 226.320 2.140 20 0 BEADLO Cc1ccc(C[N@@H+]2CCCOCC2)c(F)c1F ZINC001137964779 1169349843 /nfs/dbraw/zinc/34/98/43/1169349843.db2.gz NYYVUMNASIWZJR-UHFFFAOYSA-N 1 2 241.281 2.496 20 0 BEADLO Cc1ccc(C[N@H+]2CCCOCC2)c(F)c1F ZINC001137964779 1169349845 /nfs/dbraw/zinc/34/98/45/1169349845.db2.gz NYYVUMNASIWZJR-UHFFFAOYSA-N 1 2 241.281 2.496 20 0 BEADLO CCCC[C@H]([NH2+]Cc1ncn[nH]1)C1CCC1 ZINC001328392982 973017702 /nfs/dbraw/zinc/01/77/02/973017702.db2.gz CPVSUSPQDVPXMR-NSHDSACASA-N 1 2 222.336 2.253 20 0 BEADLO O=C(NC[C@H]1C[C@H](F)C1)c1cc2c[nH+]ccc2[nH]1 ZINC001151976699 1169412820 /nfs/dbraw/zinc/41/28/20/1169412820.db2.gz QHTBMJMLIQKJRK-CZMCAQCFSA-N 1 2 247.273 2.041 20 0 BEADLO CC(C)Cc1nnc(C[NH+]2CCCCC2)o1 ZINC001256400151 970806965 /nfs/dbraw/zinc/80/69/65/970806965.db2.gz GXRMEIPHCFWCQZ-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO COC(C)(CNc1cc2cc(C)[nH]c2c[nH+]1)OC ZINC001170433466 970808735 /nfs/dbraw/zinc/80/87/35/970808735.db2.gz DUXRHGNXSVUURY-UHFFFAOYSA-N 1 2 249.314 2.292 20 0 BEADLO CC(C)Cc1nnc([C@H]2CCCc3[nH]c[nH+]c32)o1 ZINC001256432680 970838078 /nfs/dbraw/zinc/83/80/78/970838078.db2.gz YQWJRQPXJQEKEP-VIFPVBQESA-N 1 2 246.314 2.459 20 0 BEADLO O=C1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC001203914054 1169468997 /nfs/dbraw/zinc/46/89/97/1169468997.db2.gz CJUIONXWEVSVGB-UHFFFAOYSA-N 1 2 221.275 2.381 20 0 BEADLO O=C1CCC[N@H+](Cc2ccc(F)cc2)CC1 ZINC001203914054 1169469001 /nfs/dbraw/zinc/46/90/01/1169469001.db2.gz CJUIONXWEVSVGB-UHFFFAOYSA-N 1 2 221.275 2.381 20 0 BEADLO Cc1nc(N(C)C)nc(N[C@@H](C)C(C)(C)C)[nH+]1 ZINC001157875570 970852729 /nfs/dbraw/zinc/85/27/29/970852729.db2.gz IKIROPZXTFXTOX-QMMMGPOBSA-N 1 2 237.351 2.093 20 0 BEADLO COC(=O)C[N@@H+]1Cc2ccccc2C2(CCC2)C1 ZINC000352352887 1169473912 /nfs/dbraw/zinc/47/39/12/1169473912.db2.gz PCDHGCIZVSACGK-UHFFFAOYSA-N 1 2 245.322 2.097 20 0 BEADLO COC(=O)C[N@H+]1Cc2ccccc2C2(CCC2)C1 ZINC000352352887 1169473915 /nfs/dbraw/zinc/47/39/15/1169473915.db2.gz PCDHGCIZVSACGK-UHFFFAOYSA-N 1 2 245.322 2.097 20 0 BEADLO C[C@H]1C[C@@H]1c1nnc([C@H]2CCCC[N@@H+]2C)o1 ZINC001256683177 970922046 /nfs/dbraw/zinc/92/20/46/970922046.db2.gz NIMNEKRHECVWNP-LPEHRKFASA-N 1 2 221.304 2.350 20 0 BEADLO C[C@H]1C[C@@H]1c1nnc([C@H]2CCCC[N@H+]2C)o1 ZINC001256683177 970922055 /nfs/dbraw/zinc/92/20/55/970922055.db2.gz NIMNEKRHECVWNP-LPEHRKFASA-N 1 2 221.304 2.350 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2CC[C@H]3C[C@H]3C2)n1 ZINC000403408745 970933860 /nfs/dbraw/zinc/93/38/60/970933860.db2.gz UVUGWQUCTNXZII-AEJSXWLSSA-N 1 2 221.304 2.083 20 0 BEADLO CCc1cc(Nc2[nH+]cccc2N)ccc1CO ZINC001216103507 970942395 /nfs/dbraw/zinc/94/23/95/970942395.db2.gz WXTMDFFBSUFOPI-UHFFFAOYSA-N 1 2 243.310 2.462 20 0 BEADLO C[C@@H](Cc1ccncc1)[N@@H+]1C[C@@H](F)C[C@H]1CF ZINC001256737228 970970288 /nfs/dbraw/zinc/97/02/88/970970288.db2.gz YQAMTZYBHLZMHS-DRZSPHRISA-N 1 2 240.297 2.395 20 0 BEADLO C[C@@H](Cc1ccncc1)[N@H+]1C[C@@H](F)C[C@H]1CF ZINC001256737228 970970296 /nfs/dbraw/zinc/97/02/96/970970296.db2.gz YQAMTZYBHLZMHS-DRZSPHRISA-N 1 2 240.297 2.395 20 0 BEADLO Cc1cccc(CC[N@@H+]2Cc3cnn(C)c3C2)c1 ZINC001207538918 1169495343 /nfs/dbraw/zinc/49/53/43/1169495343.db2.gz WSGVNZVNVUCDMS-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO Cc1cccc(CC[N@H+]2Cc3cnn(C)c3C2)c1 ZINC001207538918 1169495346 /nfs/dbraw/zinc/49/53/46/1169495346.db2.gz WSGVNZVNVUCDMS-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1cncs1 ZINC001209546181 1169514987 /nfs/dbraw/zinc/51/49/87/1169514987.db2.gz QNHLIUQMGILEPY-SFYZADRCSA-N 1 2 200.282 2.075 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1cncs1 ZINC001209546181 1169514994 /nfs/dbraw/zinc/51/49/94/1169514994.db2.gz QNHLIUQMGILEPY-SFYZADRCSA-N 1 2 200.282 2.075 20 0 BEADLO Cc1cc(C)c(NC2=CCCOC2)c[nH+]1 ZINC001216505450 971105790 /nfs/dbraw/zinc/10/57/90/971105790.db2.gz VRYYTSJSEWLBOW-UHFFFAOYSA-N 1 2 204.273 2.415 20 0 BEADLO Cc1oncc1Nc1ccn2cc[nH+]c2c1 ZINC001210578404 1169529024 /nfs/dbraw/zinc/52/90/24/1169529024.db2.gz KHPVANDPWUAORL-UHFFFAOYSA-N 1 2 214.228 2.374 20 0 BEADLO Nc1cc[nH+]c(-c2c(F)cc(CO)cc2F)c1 ZINC001244359201 971216735 /nfs/dbraw/zinc/21/67/35/971216735.db2.gz AADJHYGNAFQMRW-UHFFFAOYSA-N 1 2 236.221 2.101 20 0 BEADLO C[NH+]1CC(OCCSc2ccccc2)C1 ZINC001224906358 974069820 /nfs/dbraw/zinc/06/98/20/974069820.db2.gz MLHKMSKNLMDSAV-UHFFFAOYSA-N 1 2 223.341 2.109 20 0 BEADLO CCCCC[C@@H](C)N1CC[NH2+]CC(F)(F)C1 ZINC001257511333 971435112 /nfs/dbraw/zinc/43/51/12/971435112.db2.gz IGFHQBROEXVFNM-LLVKDONJSA-N 1 2 234.334 2.496 20 0 BEADLO CCCCC[C@@H](C)[N@@H+]1CCNCC(F)(F)C1 ZINC001257511333 971435114 /nfs/dbraw/zinc/43/51/14/971435114.db2.gz IGFHQBROEXVFNM-LLVKDONJSA-N 1 2 234.334 2.496 20 0 BEADLO CCCCC[C@@H](C)[N@H+]1CCNCC(F)(F)C1 ZINC001257511333 971435120 /nfs/dbraw/zinc/43/51/20/971435120.db2.gz IGFHQBROEXVFNM-LLVKDONJSA-N 1 2 234.334 2.496 20 0 BEADLO CC1(C)CC(CO[C@H]2C[NH2+]CC(F)(F)C2)C1 ZINC001217854315 971444500 /nfs/dbraw/zinc/44/45/00/971444500.db2.gz FQJSVBNLQDSBGD-SNVBAGLBSA-N 1 2 233.302 2.436 20 0 BEADLO Cn1c[nH+]c(Cc2nnc(C3CCCC3)o2)c1 ZINC001257525330 971447092 /nfs/dbraw/zinc/44/70/92/971447092.db2.gz UDUFWPBKYUSFEX-UHFFFAOYSA-N 1 2 232.287 2.052 20 0 BEADLO CCC(CC)CO[C@@H]1C[NH2+]CC(F)(F)C1 ZINC001217856301 971447994 /nfs/dbraw/zinc/44/79/94/971447994.db2.gz JTXQTWUDPIYFNR-JTQLQIEISA-N 1 2 221.291 2.436 20 0 BEADLO CCOC(=O)[C@@H]([NH2+][C@@H]1CCCSC1)C(C)C ZINC001257659994 971459526 /nfs/dbraw/zinc/45/95/26/971459526.db2.gz QUGQNIHVXCGBMU-MNOVXSKESA-N 1 2 245.388 2.059 20 0 BEADLO Cc1cc(S)ccc1O[C@H]1C[NH2+]C[C@H]1C ZINC001217969182 971552615 /nfs/dbraw/zinc/55/26/15/971552615.db2.gz XSTRQSXCAQENPF-SKDRFNHKSA-N 1 2 223.341 2.270 20 0 BEADLO Cc1c(O)cccc1-c1ccc(N)[nH+]c1 ZINC001244958608 971564169 /nfs/dbraw/zinc/56/41/69/971564169.db2.gz GFJKPZIAAWGRRR-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO COc1cc(C)c[nH+]c1N(C)CC(F)F ZINC001158927232 971585205 /nfs/dbraw/zinc/58/52/05/971585205.db2.gz XMLQVQHGCMWVBW-UHFFFAOYSA-N 1 2 216.231 2.100 20 0 BEADLO Cc1cc(S)ccc1O[C@H]1C[NH2+][C@@H]1C ZINC001218384466 971762514 /nfs/dbraw/zinc/76/25/14/971762514.db2.gz DOQDQBLVYMFPMY-KCJUWKMLSA-N 1 2 209.314 2.023 20 0 BEADLO C[C@@H]1CC[NH2+]C[C@@H]1Oc1cccc(S)c1 ZINC001218480587 971828420 /nfs/dbraw/zinc/82/84/20/971828420.db2.gz DOKTYIAGSBWPEJ-SKDRFNHKSA-N 1 2 223.341 2.352 20 0 BEADLO Cc1cc(-c2ccc3c(c2)COC3=O)c[nH+]c1N ZINC001245538228 971851376 /nfs/dbraw/zinc/85/13/76/971851376.db2.gz YQOQZGSYPRRZDV-UHFFFAOYSA-N 1 2 240.262 2.310 20 0 BEADLO C[C@H]1COCC[C@H]1Nc1ccn2cc[nH+]c2c1 ZINC001170818638 971899791 /nfs/dbraw/zinc/89/97/91/971899791.db2.gz MGRRYEBFQLSYNU-CMPLNLGQSA-N 1 2 231.299 2.171 20 0 BEADLO Cn1cc[nH+]c1CCC(=O)Nc1cccc(F)c1 ZINC001135507834 971900300 /nfs/dbraw/zinc/90/03/00/971900300.db2.gz NHPMCAJGHACGOW-UHFFFAOYSA-N 1 2 247.273 2.131 20 0 BEADLO C[C@H]1COCC[C@H]1Nc1ccc2[nH+]cn(C)c2c1 ZINC001170819567 971909065 /nfs/dbraw/zinc/90/90/65/971909065.db2.gz OLXUECJHNSCPBS-CMPLNLGQSA-N 1 2 245.326 2.410 20 0 BEADLO [NH3+][C@@H]1CCC[C@H]1C(=O)Nc1ccccc1S ZINC001218831418 971951053 /nfs/dbraw/zinc/95/10/53/971951053.db2.gz UMNZVYDJBLKICP-RKDXNWHRSA-N 1 2 236.340 2.041 20 0 BEADLO C[C@H]1c2cccn2CC[N@H+]1Cc1ccc[nH]1 ZINC000190581030 972034757 /nfs/dbraw/zinc/03/47/57/972034757.db2.gz BIUZGUCFWUHIPK-NSHDSACASA-N 1 2 215.300 2.393 20 0 BEADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1ccc[nH]1 ZINC000190581030 972034762 /nfs/dbraw/zinc/03/47/62/972034762.db2.gz BIUZGUCFWUHIPK-NSHDSACASA-N 1 2 215.300 2.393 20 0 BEADLO Nc1cc(-c2cc(O)cc(F)c2)cc[nH+]1 ZINC001241272029 1169714239 /nfs/dbraw/zinc/71/42/39/1169714239.db2.gz LYKMRGHVNFEGRH-UHFFFAOYSA-N 1 2 204.204 2.176 20 0 BEADLO CN1CCOc2c(/C=C/C(C)(C)C)[nH+]ncc21 ZINC001241562374 1169729154 /nfs/dbraw/zinc/72/91/54/1169729154.db2.gz CXLZYICFNBCZMV-AATRIKPKSA-N 1 2 233.315 2.365 20 0 BEADLO O=C1CC[NH+]([C@H]2CCc3cccc(F)c3C2)CC1 ZINC001170986662 972207980 /nfs/dbraw/zinc/20/79/80/972207980.db2.gz WLWGXSCBIQCPLI-LBPRGKRZSA-N 1 2 247.313 2.348 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1ccc(OC)cc1C ZINC001136600713 972211845 /nfs/dbraw/zinc/21/18/45/972211845.db2.gz CHVGLQIIHLOMDK-CYBMUJFWSA-N 1 2 248.326 2.036 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1ccc(OC)cc1C ZINC001136600713 972211850 /nfs/dbraw/zinc/21/18/50/972211850.db2.gz CHVGLQIIHLOMDK-CYBMUJFWSA-N 1 2 248.326 2.036 20 0 BEADLO Cc1cc(NC(=O)Cc2c[nH]c[nH+]2)ccc1F ZINC001136609328 972215952 /nfs/dbraw/zinc/21/59/52/972215952.db2.gz GIGRVVWEVPKBIQ-UHFFFAOYSA-N 1 2 233.246 2.038 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc3c(c2)OCO3)[C@H](C)CO1 ZINC001204055260 972219101 /nfs/dbraw/zinc/21/91/01/972219101.db2.gz IYSQNFVHQAJKNV-GHMZBOCLSA-N 1 2 249.310 2.025 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc3c(c2)OCO3)[C@H](C)CO1 ZINC001204055260 972219106 /nfs/dbraw/zinc/21/91/06/972219106.db2.gz IYSQNFVHQAJKNV-GHMZBOCLSA-N 1 2 249.310 2.025 20 0 BEADLO Cc1cc(C)c(Nc2noc3nccnc23)c[nH+]1 ZINC001213505250 956981028 /nfs/dbraw/zinc/98/10/28/956981028.db2.gz ADGVASSJVGNMLA-UHFFFAOYSA-N 1 2 241.254 2.373 20 0 BEADLO Cc1cc2c(cn1)C[N@H+](C[C@H]1CCC=CO1)C2 ZINC001208878973 957189783 /nfs/dbraw/zinc/18/97/83/957189783.db2.gz AVXLIIYWJASPNV-CQSZACIVSA-N 1 2 230.311 2.398 20 0 BEADLO Cc1cc2c(cn1)C[N@@H+](C[C@H]1CCC=CO1)C2 ZINC001208878973 957189791 /nfs/dbraw/zinc/18/97/91/957189791.db2.gz AVXLIIYWJASPNV-CQSZACIVSA-N 1 2 230.311 2.398 20 0 BEADLO CCCOC1C[NH+](C[C@@H](C)C(F)(F)F)C1 ZINC001208894054 957213813 /nfs/dbraw/zinc/21/38/13/957213813.db2.gz NRELVBPWNPYYJN-MRVPVSSYSA-N 1 2 225.254 2.296 20 0 BEADLO CN(C)c1cc(N(C)C[C@H]2CC2(C)C)nc[nH+]1 ZINC001167093370 957278860 /nfs/dbraw/zinc/27/88/60/957278860.db2.gz ZINYFSPQRJFPTC-SNVBAGLBSA-N 1 2 234.347 2.025 20 0 BEADLO CN(C)c1cc(N(C)C[C@H]2CC2(C)C)[nH+]cn1 ZINC001167093370 957278874 /nfs/dbraw/zinc/27/88/74/957278874.db2.gz ZINYFSPQRJFPTC-SNVBAGLBSA-N 1 2 234.347 2.025 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2ccccn2)C[C@H]1F ZINC001204056153 972257753 /nfs/dbraw/zinc/25/77/53/972257753.db2.gz UYRSDBWYAHEJBH-NEPJUHHUSA-N 1 2 226.270 2.354 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2ccccn2)C[C@H]1F ZINC001204056153 972257758 /nfs/dbraw/zinc/25/77/58/972257758.db2.gz UYRSDBWYAHEJBH-NEPJUHHUSA-N 1 2 226.270 2.354 20 0 BEADLO CCc1nc(NC(C)(C)CC(C)=O)cc[nH+]1 ZINC001160299333 972258924 /nfs/dbraw/zinc/25/89/24/972258924.db2.gz AEDVOCJZGGRXQO-UHFFFAOYSA-N 1 2 221.304 2.209 20 0 BEADLO C[C@H]1COCC[N@@H+]1Cc1cc2ccccc2cn1 ZINC001139995376 957330013 /nfs/dbraw/zinc/33/00/13/957330013.db2.gz IQMLMBKPHPGDLD-LBPRGKRZSA-N 1 2 242.322 2.456 20 0 BEADLO C[C@H]1COCC[N@H+]1Cc1cc2ccccc2cn1 ZINC001139995376 957330027 /nfs/dbraw/zinc/33/00/27/957330027.db2.gz IQMLMBKPHPGDLD-LBPRGKRZSA-N 1 2 242.322 2.456 20 0 BEADLO CCCc1cc[nH+]c(NC2=CCOC2)c1 ZINC001203386913 957402599 /nfs/dbraw/zinc/40/25/99/957402599.db2.gz RGSHEEMORPSELY-UHFFFAOYSA-N 1 2 204.273 2.360 20 0 BEADLO Cc1n[nH]cc1C[N@@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001209554069 957498294 /nfs/dbraw/zinc/49/82/94/957498294.db2.gz GLKITHOUELMHDI-JTQLQIEISA-N 1 2 247.264 2.287 20 0 BEADLO Cc1n[nH]cc1C[N@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001209554069 957498299 /nfs/dbraw/zinc/49/82/99/957498299.db2.gz GLKITHOUELMHDI-JTQLQIEISA-N 1 2 247.264 2.287 20 0 BEADLO c1cn(-c2ccccc2NC2=CCOC2)c[nH+]1 ZINC001203388896 957512433 /nfs/dbraw/zinc/51/24/33/957512433.db2.gz JXXXUUYGBCNQOR-UHFFFAOYSA-N 1 2 227.267 2.198 20 0 BEADLO c1cn(Cc2cccc(NC3=CCOC3)c2)c[nH+]1 ZINC001203390294 957531519 /nfs/dbraw/zinc/53/15/19/957531519.db2.gz RXRMDLOUFJXPJK-UHFFFAOYSA-N 1 2 241.294 2.257 20 0 BEADLO Cc1nc(N2CC[C@H]3OCC[C@@H]3C2)c(C)c(C)[nH+]1 ZINC001167219513 957551939 /nfs/dbraw/zinc/55/19/39/957551939.db2.gz YOSDFYQRGRKJHO-CHWSQXEVSA-N 1 2 247.342 2.017 20 0 BEADLO CCc1[nH+]ccc(C)c1Nc1ccnnc1 ZINC001209959306 957580955 /nfs/dbraw/zinc/58/09/55/957580955.db2.gz PCVIEUMBYIEYGH-UHFFFAOYSA-N 1 2 214.272 2.486 20 0 BEADLO CC(C)Oc1ccc[nH+]c1NCc1cncnc1 ZINC001167268370 957609539 /nfs/dbraw/zinc/60/95/39/957609539.db2.gz FJLSBJVRUYSLSC-UHFFFAOYSA-N 1 2 244.298 2.271 20 0 BEADLO C[C@]1(F)CCCC[N@H+](Cc2cnc[nH]2)C1 ZINC001136865971 972282698 /nfs/dbraw/zinc/28/26/98/972282698.db2.gz FALVVBIHZYIYRC-NSHDSACASA-N 1 2 211.284 2.124 20 0 BEADLO C[C@]1(F)CCCC[N@@H+](Cc2cnc[nH]2)C1 ZINC001136865971 972282704 /nfs/dbraw/zinc/28/27/04/972282704.db2.gz FALVVBIHZYIYRC-NSHDSACASA-N 1 2 211.284 2.124 20 0 BEADLO C[C@]1(F)CCCC[N@H+](Cc2c[nH]cn2)C1 ZINC001136865971 972282711 /nfs/dbraw/zinc/28/27/11/972282711.db2.gz FALVVBIHZYIYRC-NSHDSACASA-N 1 2 211.284 2.124 20 0 BEADLO C[C@]1(F)CCCC[N@@H+](Cc2c[nH]cn2)C1 ZINC001136865971 972282717 /nfs/dbraw/zinc/28/27/17/972282717.db2.gz FALVVBIHZYIYRC-NSHDSACASA-N 1 2 211.284 2.124 20 0 BEADLO c1nc(C[NH2+]Cc2cccc3c2OCC3)cs1 ZINC000693123335 957685251 /nfs/dbraw/zinc/68/52/51/957685251.db2.gz MWZOCZNZLQJPDA-UHFFFAOYSA-N 1 2 246.335 2.368 20 0 BEADLO Cc1nc(Cl)ncc1Nc1c[nH+]c(C)c(N)c1 ZINC001210286734 957714967 /nfs/dbraw/zinc/71/49/67/957714967.db2.gz FRYJWHDENNLYLU-UHFFFAOYSA-N 1 2 249.705 2.468 20 0 BEADLO Cc1[nH+]cc(Nc2cccn3nccc23)cc1N ZINC001210288347 957716775 /nfs/dbraw/zinc/71/67/75/957716775.db2.gz NIKNLTRWVVHASP-UHFFFAOYSA-N 1 2 239.282 2.364 20 0 BEADLO Cc1[nH+]cc(Nc2cc(F)ncc2F)cc1N ZINC001210288697 957716845 /nfs/dbraw/zinc/71/68/45/957716845.db2.gz SKRMEGLSBDMCSZ-UHFFFAOYSA-N 1 2 236.225 2.389 20 0 BEADLO Cn1ccc(Nc2ccc3c(c2)[nH+]cn3C)n1 ZINC001210352787 957728633 /nfs/dbraw/zinc/72/86/33/957728633.db2.gz IUGGEJDQQHYPGN-UHFFFAOYSA-N 1 2 227.271 2.050 20 0 BEADLO Cc1cc(NCc2cccnn2)ccc1[NH+](C)C ZINC001167330462 957779434 /nfs/dbraw/zinc/77/94/34/957779434.db2.gz KTTKKXRVKXHVTP-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO COc1ccc2cc(NC3CC(=O)C3)[nH+]cc2c1 ZINC001167336163 957790745 /nfs/dbraw/zinc/79/07/45/957790745.db2.gz QSVDAENMFSHMKX-UHFFFAOYSA-N 1 2 242.278 2.387 20 0 BEADLO O=C1CC(Nc2[nH+]cccc2-n2cccc2)C1 ZINC001167336174 957792107 /nfs/dbraw/zinc/79/21/07/957792107.db2.gz QZUBHERMDMHYFD-UHFFFAOYSA-N 1 2 227.267 2.016 20 0 BEADLO O=c1cccc(C[NH+]2Cc3ccccc3C2)[nH]1 ZINC001207065842 957906055 /nfs/dbraw/zinc/90/60/55/957906055.db2.gz WUCYKPPJXSAVGB-UHFFFAOYSA-N 1 2 226.279 2.303 20 0 BEADLO CCc1nccc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)n1 ZINC001207083936 957952698 /nfs/dbraw/zinc/95/26/98/957952698.db2.gz JBDNZYWVMLORQL-ZYHUDNBSSA-N 1 2 237.322 2.219 20 0 BEADLO CCc1nccc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)n1 ZINC001207083936 957952705 /nfs/dbraw/zinc/95/27/05/957952705.db2.gz JBDNZYWVMLORQL-ZYHUDNBSSA-N 1 2 237.322 2.219 20 0 BEADLO CCc1nccc(C[N@H+](C)Cc2ccncc2)n1 ZINC001207084935 957957976 /nfs/dbraw/zinc/95/79/76/957957976.db2.gz VKBNBLRASJMLCI-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO CCc1nccc(C[N@@H+](C)Cc2ccncc2)n1 ZINC001207084935 957957983 /nfs/dbraw/zinc/95/79/83/957957983.db2.gz VKBNBLRASJMLCI-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO Fc1cnc(C[NH+]2CCCCC2)c(F)c1 ZINC001207089779 957983648 /nfs/dbraw/zinc/98/36/48/957983648.db2.gz BVHOMUCQZJNBRW-UHFFFAOYSA-N 1 2 212.243 2.346 20 0 BEADLO Cc1cc(C)c(Nc2ccncn2)c[nH+]1 ZINC001211024352 957993385 /nfs/dbraw/zinc/99/33/85/957993385.db2.gz LOYHTYHLACHXGG-UHFFFAOYSA-N 1 2 200.245 2.232 20 0 BEADLO Cc1cc(C)c(Nc2cncc(CO)c2)c[nH+]1 ZINC001211103414 958030089 /nfs/dbraw/zinc/03/00/89/958030089.db2.gz SZJORDIQVQCTRX-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO COc1ncc(C[N@@H+]2CCC[C@@H](F)C2)cc1C ZINC001137004992 972318752 /nfs/dbraw/zinc/31/87/52/972318752.db2.gz VIBHALWGOXNTFU-GFCCVEGCSA-N 1 2 238.306 2.333 20 0 BEADLO COc1ncc(C[N@H+]2CCC[C@@H](F)C2)cc1C ZINC001137004992 972318754 /nfs/dbraw/zinc/31/87/54/972318754.db2.gz VIBHALWGOXNTFU-GFCCVEGCSA-N 1 2 238.306 2.333 20 0 BEADLO COc1cc(F)c(F)cc1C[NH+]1CC=CC1 ZINC001143387494 958210092 /nfs/dbraw/zinc/21/00/92/958210092.db2.gz JZCRBFCCHYOYJA-UHFFFAOYSA-N 1 2 225.238 2.345 20 0 BEADLO Cc1nccc(C[NH+]2CC3(C2)CC(F)(F)C3)n1 ZINC001207163083 958273356 /nfs/dbraw/zinc/27/33/56/958273356.db2.gz JDTXMIFMDLQNST-UHFFFAOYSA-N 1 2 239.269 2.016 20 0 BEADLO CC1(C)CCC[C@H](N[C@H]2C[NH2+]CC2(F)F)C1 ZINC001246461258 972335584 /nfs/dbraw/zinc/33/55/84/972335584.db2.gz OHFWEWUVBSONMV-UWVGGRQHSA-N 1 2 232.318 2.152 20 0 BEADLO C[C@@H]1CC[C@H](N[C@@H]2C[NH2+]CC2(F)F)C[C@@H]1C ZINC001246464571 972340196 /nfs/dbraw/zinc/34/01/96/972340196.db2.gz RXBYGJUWDLVYRA-VPOLOUISSA-N 1 2 232.318 2.008 20 0 BEADLO C[C@@H]1CC[C@H]([NH2+][C@@H]2CNCC2(F)F)C[C@@H]1C ZINC001246464571 972340202 /nfs/dbraw/zinc/34/02/02/972340202.db2.gz RXBYGJUWDLVYRA-VPOLOUISSA-N 1 2 232.318 2.008 20 0 BEADLO FC1(F)C[NH2+]C[C@@H]1NC1CCCCCCC1 ZINC001246467791 972344597 /nfs/dbraw/zinc/34/45/97/972344597.db2.gz ZSOYHJANXBOMQE-NSHDSACASA-N 1 2 232.318 2.296 20 0 BEADLO COc1ccc(F)c(F)c1C[NH+]1CC(C)C1 ZINC001143403285 958510358 /nfs/dbraw/zinc/51/03/58/958510358.db2.gz ATWJHVNRTWXVLR-UHFFFAOYSA-N 1 2 227.254 2.425 20 0 BEADLO Cc1nn(C)cc1C[N@@H+]1CC[C@](C)(F)[C@H](F)C1 ZINC001204576123 958535897 /nfs/dbraw/zinc/53/58/97/958535897.db2.gz FIBFABKYPYNAMM-NEPJUHHUSA-N 1 2 243.301 2.001 20 0 BEADLO Cc1nn(C)cc1C[N@H+]1CC[C@](C)(F)[C@H](F)C1 ZINC001204576123 958535906 /nfs/dbraw/zinc/53/59/06/958535906.db2.gz FIBFABKYPYNAMM-NEPJUHHUSA-N 1 2 243.301 2.001 20 0 BEADLO C[C@H]1CCC[C@@H](OCCn2cc[nH+]c2)C1 ZINC001222135063 972381172 /nfs/dbraw/zinc/38/11/72/972381172.db2.gz VDOLRWLUOWKOAQ-NWDGAFQWSA-N 1 2 208.305 2.478 20 0 BEADLO CC(C)[C@H](OCCn1cc[nH+]c1)C(F)(F)F ZINC001222134673 972382365 /nfs/dbraw/zinc/38/23/65/972382365.db2.gz JVDPMONQBQZLEE-VIFPVBQESA-N 1 2 236.237 2.487 20 0 BEADLO C[C@H](OCCn1cc[nH+]c1)c1ccccn1 ZINC001222134196 972382616 /nfs/dbraw/zinc/38/26/16/972382616.db2.gz BPLFVGFDUBHONU-NSHDSACASA-N 1 2 217.272 2.056 20 0 BEADLO COc1ccc([C@H](C)OCCn2cc[nH+]c2)cn1 ZINC001222134976 972382866 /nfs/dbraw/zinc/38/28/66/972382866.db2.gz UOHHNJZMJRMLTB-NSHDSACASA-N 1 2 247.298 2.065 20 0 BEADLO C[C@H](COCCn1cc[nH+]c1)Oc1ccccc1 ZINC001222139800 972386256 /nfs/dbraw/zinc/38/62/56/972386256.db2.gz XIUHJGVFWQHNOV-CYBMUJFWSA-N 1 2 246.310 2.367 20 0 BEADLO F[C@H]1CCCC[C@@H]1OCCn1cc[nH+]c1 ZINC001222138523 972388115 /nfs/dbraw/zinc/38/81/15/972388115.db2.gz GCAIQIGLQMMTAD-QWRGUYRKSA-N 1 2 212.268 2.180 20 0 BEADLO COc1ccc(C[NH+]2CCC2)c(F)c1F ZINC001143903400 972389235 /nfs/dbraw/zinc/38/92/35/972389235.db2.gz XCBDCABEVQRDPM-UHFFFAOYSA-N 1 2 213.227 2.179 20 0 BEADLO Cc1cc(NCc2cc[nH+]c(N)c2)cc(F)n1 ZINC001167617383 959080560 /nfs/dbraw/zinc/08/05/60/959080560.db2.gz LLULWDMDYMELQG-UHFFFAOYSA-N 1 2 232.262 2.118 20 0 BEADLO CCN(C(=O)C[C@H]([NH3+])C(F)F)c1ccccc1 ZINC000724762839 959301873 /nfs/dbraw/zinc/30/18/73/959301873.db2.gz SQCDOVQEOMJZBI-JTQLQIEISA-N 1 2 242.269 2.022 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N(C(=O)C[C@H]([NH3+])C(F)F)C1 ZINC000724728122 959311975 /nfs/dbraw/zinc/31/19/75/959311975.db2.gz SQZWCEITHFXMSR-BBBLOLIVSA-N 1 2 248.317 2.006 20 0 BEADLO C/C=C(\C)C(=O)NCc1c[nH+]cn1C1CCC1 ZINC001143951797 972441644 /nfs/dbraw/zinc/44/16/44/972441644.db2.gz VJCIABHYKKJOMD-XCVCLJGOSA-N 1 2 233.315 2.191 20 0 BEADLO CNc1cc(N[C@@H]2CCC[C@@H]3C[C@@H]32)[nH+]cn1 ZINC000694255516 959813433 /nfs/dbraw/zinc/81/34/33/959813433.db2.gz PMQCLYXXXDMEMB-KXUCPTDWSA-N 1 2 218.304 2.119 20 0 BEADLO C[C@H]1CC[N@@H+]1Cc1cc(Br)ccn1 ZINC001140762255 959815704 /nfs/dbraw/zinc/81/57/04/959815704.db2.gz SHYTYAJPYOJTDT-QMMMGPOBSA-N 1 2 241.132 2.438 20 0 BEADLO C[C@H]1CC[N@H+]1Cc1cc(Br)ccn1 ZINC001140762255 959815706 /nfs/dbraw/zinc/81/57/06/959815706.db2.gz SHYTYAJPYOJTDT-QMMMGPOBSA-N 1 2 241.132 2.438 20 0 BEADLO Cc1ccc(F)c(O[C@H]2C[NH2+]CC2(F)F)c1F ZINC001218233001 959907608 /nfs/dbraw/zinc/90/76/08/959907608.db2.gz WREXJPDMZMLQGZ-QMMMGPOBSA-N 1 2 249.207 2.259 20 0 BEADLO COc1cccc2c1C[N@H+](Cc1cnco1)CC2 ZINC001140927395 960089920 /nfs/dbraw/zinc/08/99/20/960089920.db2.gz QCAXGMXBKVORSZ-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1cccc2c1C[N@@H+](Cc1cnco1)CC2 ZINC001140927395 960089938 /nfs/dbraw/zinc/08/99/38/960089938.db2.gz QCAXGMXBKVORSZ-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO CC1C[NH+](Cc2cc(F)c(O)c(F)c2)C1 ZINC001140988106 960154090 /nfs/dbraw/zinc/15/40/90/960154090.db2.gz NOKOOMDTSWMPGX-UHFFFAOYSA-N 1 2 213.227 2.122 20 0 BEADLO Cc1cc(C(=O)C[NH+]2CCC(F)CC2)c(C)[nH]1 ZINC000689867456 960297056 /nfs/dbraw/zinc/29/70/56/960297056.db2.gz JBPFIIGPXMNAJI-UHFFFAOYSA-N 1 2 238.306 2.248 20 0 BEADLO C[C@H]1CCC[N@@H+]1Cn1ncsc1=S ZINC000173520766 960354839 /nfs/dbraw/zinc/35/48/39/960354839.db2.gz AEYFJESYADAMKL-ZETCQYMHSA-N 1 2 215.347 2.116 20 0 BEADLO C[C@H]1CCC[N@H+]1Cn1ncsc1=S ZINC000173520766 960354847 /nfs/dbraw/zinc/35/48/47/960354847.db2.gz AEYFJESYADAMKL-ZETCQYMHSA-N 1 2 215.347 2.116 20 0 BEADLO Fc1cnc(Cl)cc1C[NH+]1CCCC1 ZINC001140603683 960456392 /nfs/dbraw/zinc/45/63/92/960456392.db2.gz YLESVBVEIJWOMP-UHFFFAOYSA-N 1 2 214.671 2.470 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2ccc(CO)o2)C[C@@H]1F ZINC001140679026 960490001 /nfs/dbraw/zinc/49/00/01/960490001.db2.gz NXAMDKSEFOJERI-RYUDHWBXSA-N 1 2 245.269 2.044 20 0 BEADLO Cc1cc2c(cn1)C[N@H+](Cc1cc[nH]c1)C2 ZINC001140708548 960519009 /nfs/dbraw/zinc/51/90/09/960519009.db2.gz FMJMRDAOFRNBGA-UHFFFAOYSA-N 1 2 213.284 2.234 20 0 BEADLO Cc1cc2c(cn1)C[N@@H+](Cc1cc[nH]c1)C2 ZINC001140708548 960519014 /nfs/dbraw/zinc/51/90/14/960519014.db2.gz FMJMRDAOFRNBGA-UHFFFAOYSA-N 1 2 213.284 2.234 20 0 BEADLO COC(C)(C)COC1C[NH+](Cc2ccccc2)C1 ZINC001222358125 960557532 /nfs/dbraw/zinc/55/75/32/960557532.db2.gz BGISESSRWZVUSP-UHFFFAOYSA-N 1 2 249.354 2.312 20 0 BEADLO c1nocc1COC1C[NH+](Cc2ccccc2)C1 ZINC001222370904 960568229 /nfs/dbraw/zinc/56/82/29/960568229.db2.gz RGPZNYXCZVVDNO-UHFFFAOYSA-N 1 2 244.294 2.076 20 0 BEADLO C[C@@H]1C[N@H+](Cc2c[nH]c3ccncc23)[C@H](C)CO1 ZINC001140804751 960593471 /nfs/dbraw/zinc/59/34/71/960593471.db2.gz CQUFZHMAQGTTSR-GHMZBOCLSA-N 1 2 245.326 2.172 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2c[nH]c3ccncc23)[C@H](C)CO1 ZINC001140804751 960593483 /nfs/dbraw/zinc/59/34/83/960593483.db2.gz CQUFZHMAQGTTSR-GHMZBOCLSA-N 1 2 245.326 2.172 20 0 BEADLO Nc1[nH+]cccc1-c1cnn(C2CCC2)c1 ZINC000724345472 960594908 /nfs/dbraw/zinc/59/49/08/960594908.db2.gz QEHTXQQUACIHLN-UHFFFAOYSA-N 1 2 214.272 2.252 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccc(F)c2)[nH]n1 ZINC001203070118 960620100 /nfs/dbraw/zinc/62/01/00/960620100.db2.gz HXLBEBMFFHZTQM-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccc(F)c2)[nH]n1 ZINC001203070118 960620105 /nfs/dbraw/zinc/62/01/05/960620105.db2.gz HXLBEBMFFHZTQM-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO c1cc2c(cccc2C[NH2+]Cc2csnn2)[nH]1 ZINC000398249078 960623380 /nfs/dbraw/zinc/62/33/80/960623380.db2.gz LNIICSVJXZXMOQ-UHFFFAOYSA-N 1 2 244.323 2.309 20 0 BEADLO CSCC[N@H+](C)Cc1ccc(O)c(F)c1F ZINC001140892620 960670034 /nfs/dbraw/zinc/67/00/34/960670034.db2.gz UMRHAUGDSOZNLK-UHFFFAOYSA-N 1 2 247.310 2.465 20 0 BEADLO CSCC[N@@H+](C)Cc1ccc(O)c(F)c1F ZINC001140892620 960670056 /nfs/dbraw/zinc/67/00/56/960670056.db2.gz UMRHAUGDSOZNLK-UHFFFAOYSA-N 1 2 247.310 2.465 20 0 BEADLO CSC1CC[NH+](Cc2cc(C)[nH]n2)CC1 ZINC001203076989 960684819 /nfs/dbraw/zinc/68/48/19/960684819.db2.gz MXRIHHFZBPFWRU-UHFFFAOYSA-N 1 2 225.361 2.046 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccsc2)[nH]n1 ZINC001203076862 960689794 /nfs/dbraw/zinc/68/97/94/960689794.db2.gz KNFURQWUCAXHQN-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccsc2)[nH]n1 ZINC001203076862 960689800 /nfs/dbraw/zinc/68/98/00/960689800.db2.gz KNFURQWUCAXHQN-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@@H](c3ccccn3)C2)n[nH]1 ZINC001203077088 960689999 /nfs/dbraw/zinc/68/99/99/960689999.db2.gz RLKKUMZWMFHGNE-GFCCVEGCSA-N 1 2 242.326 2.103 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@@H](c3ccccn3)C2)n[nH]1 ZINC001203077088 960690009 /nfs/dbraw/zinc/69/00/09/960690009.db2.gz RLKKUMZWMFHGNE-GFCCVEGCSA-N 1 2 242.326 2.103 20 0 BEADLO C[C@H]1C(=O)CC[N@H+](Cc2cnco2)C12CCCC2 ZINC001140935661 960724771 /nfs/dbraw/zinc/72/47/71/960724771.db2.gz WKMWMTRWQIHEHT-NSHDSACASA-N 1 2 248.326 2.398 20 0 BEADLO C[C@H]1C(=O)CC[N@@H+](Cc2cnco2)C12CCCC2 ZINC001140935661 960724785 /nfs/dbraw/zinc/72/47/85/960724785.db2.gz WKMWMTRWQIHEHT-NSHDSACASA-N 1 2 248.326 2.398 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2cn[nH]c2)c(F)c1 ZINC000651640297 960772726 /nfs/dbraw/zinc/77/27/26/960772726.db2.gz IEXLDYSHDKVUMQ-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2cn[nH]c2)c(F)c1 ZINC000651640297 960772743 /nfs/dbraw/zinc/77/27/43/960772743.db2.gz IEXLDYSHDKVUMQ-UHFFFAOYSA-N 1 2 249.289 2.189 20 0 BEADLO Cc1ncoc1C[N@@H+]1CCC(=O)[C@@H]2CCCC[C@H]21 ZINC001141050605 960841514 /nfs/dbraw/zinc/84/15/14/960841514.db2.gz DXAICJQCSUHMFT-VXGBXAGGSA-N 1 2 248.326 2.317 20 0 BEADLO Cc1ncoc1C[N@H+]1CCC(=O)[C@@H]2CCCC[C@H]21 ZINC001141050605 960841518 /nfs/dbraw/zinc/84/15/18/960841518.db2.gz DXAICJQCSUHMFT-VXGBXAGGSA-N 1 2 248.326 2.317 20 0 BEADLO Cc1ncoc1C[N@@H+](C)Cc1cccnc1C ZINC001141055227 960851773 /nfs/dbraw/zinc/85/17/73/960851773.db2.gz VBKRKGYODRWUGT-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ncoc1C[N@H+](C)Cc1cccnc1C ZINC001141055227 960851778 /nfs/dbraw/zinc/85/17/78/960851778.db2.gz VBKRKGYODRWUGT-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CCCCc1[nH]c(CN2C[C@@H](F)[C@H](F)C2)c[nH+]1 ZINC001141067748 960857398 /nfs/dbraw/zinc/85/73/98/960857398.db2.gz MMVSXICCLLXNKG-GHMZBOCLSA-N 1 2 243.301 2.244 20 0 BEADLO CCCCc1[nH]cc(CN2C[C@@H](F)[C@H](F)C2)[nH+]1 ZINC001141067748 960857399 /nfs/dbraw/zinc/85/73/99/960857399.db2.gz MMVSXICCLLXNKG-GHMZBOCLSA-N 1 2 243.301 2.244 20 0 BEADLO CCCCc1[nH]c(CN2CCC(=O)C[C@H]2C)c[nH+]1 ZINC001141068114 960858455 /nfs/dbraw/zinc/85/84/55/960858455.db2.gz YULLDXBGXIWNAU-LLVKDONJSA-N 1 2 249.358 2.306 20 0 BEADLO CCCCc1[nH]cc(CN2CCC(=O)C[C@H]2C)[nH+]1 ZINC001141068114 960858460 /nfs/dbraw/zinc/85/84/60/960858460.db2.gz YULLDXBGXIWNAU-LLVKDONJSA-N 1 2 249.358 2.306 20 0 BEADLO CCCCc1[nH]c(CN(C2CC2)C2COC2)c[nH+]1 ZINC001141072606 960862182 /nfs/dbraw/zinc/86/21/82/960862182.db2.gz WHCWMMCNWKBIIF-UHFFFAOYSA-N 1 2 249.358 2.116 20 0 BEADLO CCCCc1[nH]cc(CN(C2CC2)C2COC2)[nH+]1 ZINC001141072606 960862183 /nfs/dbraw/zinc/86/21/83/960862183.db2.gz WHCWMMCNWKBIIF-UHFFFAOYSA-N 1 2 249.358 2.116 20 0 BEADLO CCCCc1ncc(C[N@@H+]2CC[C@H]3OCC[C@H]32)[nH]1 ZINC001141067461 960862568 /nfs/dbraw/zinc/86/25/68/960862568.db2.gz CXCRXDWQJRSZQP-CHWSQXEVSA-N 1 2 249.358 2.116 20 0 BEADLO CCCCc1ncc(C[N@H+]2CC[C@H]3OCC[C@H]32)[nH]1 ZINC001141067461 960862571 /nfs/dbraw/zinc/86/25/71/960862571.db2.gz CXCRXDWQJRSZQP-CHWSQXEVSA-N 1 2 249.358 2.116 20 0 BEADLO CCCCc1nc(C[N@@H+]2CC[C@H]3OCC[C@H]32)c[nH]1 ZINC001141067461 960862573 /nfs/dbraw/zinc/86/25/73/960862573.db2.gz CXCRXDWQJRSZQP-CHWSQXEVSA-N 1 2 249.358 2.116 20 0 BEADLO CCCCc1nc(C[N@H+]2CC[C@H]3OCC[C@H]32)c[nH]1 ZINC001141067461 960862582 /nfs/dbraw/zinc/86/25/82/960862582.db2.gz CXCRXDWQJRSZQP-CHWSQXEVSA-N 1 2 249.358 2.116 20 0 BEADLO COc1c(F)cccc1C[N@@H+]1CC[C@@H](F)C1 ZINC001143521792 960895262 /nfs/dbraw/zinc/89/52/62/960895262.db2.gz HXBUDKWNIFLJQD-SNVBAGLBSA-N 1 2 227.254 2.378 20 0 BEADLO COc1c(F)cccc1C[N@H+]1CC[C@@H](F)C1 ZINC001143521792 960895263 /nfs/dbraw/zinc/89/52/63/960895263.db2.gz HXBUDKWNIFLJQD-SNVBAGLBSA-N 1 2 227.254 2.378 20 0 BEADLO C[C@@H]1CC(=O)CC[N@@H+]1Cc1cccc(N(C)C)c1 ZINC001141257401 961023800 /nfs/dbraw/zinc/02/38/00/961023800.db2.gz FIMYJTSNLSUPBF-GFCCVEGCSA-N 1 2 246.354 2.306 20 0 BEADLO C[C@@H]1CC(=O)CC[N@H+]1Cc1cccc(N(C)C)c1 ZINC001141257401 961023820 /nfs/dbraw/zinc/02/38/20/961023820.db2.gz FIMYJTSNLSUPBF-GFCCVEGCSA-N 1 2 246.354 2.306 20 0 BEADLO COc1cc(F)c(C[NH+]2CC=CC2)cc1OC ZINC001141272577 961032511 /nfs/dbraw/zinc/03/25/11/961032511.db2.gz WIAYCHFAGXXSIP-UHFFFAOYSA-N 1 2 237.274 2.215 20 0 BEADLO Cc1ccc(Nc2ccncc2C#N)c(C)[nH+]1 ZINC000399415334 961119555 /nfs/dbraw/zinc/11/95/55/961119555.db2.gz CHXQGRWGUCOLKP-UHFFFAOYSA-N 1 2 224.267 2.131 20 0 BEADLO CCCC[C@H](CC)C(=O)NC1C[NH+](CC)C1 ZINC001481546353 961165062 /nfs/dbraw/zinc/16/50/62/961165062.db2.gz VUJHHEDESMOKJG-NSHDSACASA-N 1 2 226.364 2.023 20 0 BEADLO Cc1nc(NC=[NH2+])ccc1Br ZINC001167864784 961332633 /nfs/dbraw/zinc/33/26/33/961332633.db2.gz JRUPKIWRCQOCRT-UHFFFAOYSA-N 1 2 214.066 2.171 20 0 BEADLO C[C@H]1CC(=O)CC[N@@H+]1Cc1cccc2nc[nH]c21 ZINC001142673043 961587362 /nfs/dbraw/zinc/58/73/62/961587362.db2.gz WOSRRNFEGCMCKG-JTQLQIEISA-N 1 2 243.310 2.116 20 0 BEADLO C[C@H]1CC(=O)CC[N@H+]1Cc1cccc2nc[nH]c21 ZINC001142673043 961587386 /nfs/dbraw/zinc/58/73/86/961587386.db2.gz WOSRRNFEGCMCKG-JTQLQIEISA-N 1 2 243.310 2.116 20 0 BEADLO C[C@H](C(=O)N(CC1CC1)C1CCC1)n1cc[nH+]c1 ZINC001344404746 961644470 /nfs/dbraw/zinc/64/44/70/961644470.db2.gz DZAPHDWKHVMFNS-LLVKDONJSA-N 1 2 247.342 2.235 20 0 BEADLO CC(C)(C)OC(=O)n1cc(C[NH+]2CC=CC2)cn1 ZINC001142783707 961744955 /nfs/dbraw/zinc/74/49/55/961744955.db2.gz AWYZEOFRCJGURC-UHFFFAOYSA-N 1 2 249.314 2.038 20 0 BEADLO C[C@H](CCCC(C)(C)O)CC[N@@H+]1CCC(=O)C1 ZINC001207671223 961745941 /nfs/dbraw/zinc/74/59/41/961745941.db2.gz ULOKFGLLGLQPBT-GFCCVEGCSA-N 1 2 241.375 2.229 20 0 BEADLO C[C@H](CCCC(C)(C)O)CC[N@H+]1CCC(=O)C1 ZINC001207671223 961745962 /nfs/dbraw/zinc/74/59/62/961745962.db2.gz ULOKFGLLGLQPBT-GFCCVEGCSA-N 1 2 241.375 2.229 20 0 BEADLO COc1c(F)cccc1C[N@H+](C)CCF ZINC001143534433 961794354 /nfs/dbraw/zinc/79/43/54/961794354.db2.gz QTASNUITQGFLIH-UHFFFAOYSA-N 1 2 215.243 2.236 20 0 BEADLO COc1c(F)cccc1C[N@@H+](C)CCF ZINC001143534433 961794364 /nfs/dbraw/zinc/79/43/64/961794364.db2.gz QTASNUITQGFLIH-UHFFFAOYSA-N 1 2 215.243 2.236 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc(F)nc2)C[C@@H]1F ZINC001137735091 961826478 /nfs/dbraw/zinc/82/64/78/961826478.db2.gz BRWNGQWMEGDVGC-SCZZXKLOSA-N 1 2 212.243 2.011 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc(F)nc2)C[C@@H]1F ZINC001137735091 961826484 /nfs/dbraw/zinc/82/64/84/961826484.db2.gz BRWNGQWMEGDVGC-SCZZXKLOSA-N 1 2 212.243 2.011 20 0 BEADLO COc1cc(C)c(C[N@@H+]2CCO[C@H]3C[C@H]32)c(C)c1 ZINC001142951151 961853068 /nfs/dbraw/zinc/85/30/68/961853068.db2.gz YDAJMKOMXLLUDK-CABCVRRESA-N 1 2 247.338 2.285 20 0 BEADLO COc1cc(C)c(C[N@H+]2CCO[C@H]3C[C@H]32)c(C)c1 ZINC001142951151 961853076 /nfs/dbraw/zinc/85/30/76/961853076.db2.gz YDAJMKOMXLLUDK-CABCVRRESA-N 1 2 247.338 2.285 20 0 BEADLO Cc1ccc(C[N@@H+]2CCc3occc3C2)c(N)n1 ZINC001143207784 961944290 /nfs/dbraw/zinc/94/42/90/961944290.db2.gz GATZCXKHPBXJCE-UHFFFAOYSA-N 1 2 243.310 2.124 20 0 BEADLO Cc1ccc(C[N@H+]2CCc3occc3C2)c(N)n1 ZINC001143207784 961944316 /nfs/dbraw/zinc/94/43/16/961944316.db2.gz GATZCXKHPBXJCE-UHFFFAOYSA-N 1 2 243.310 2.124 20 0 BEADLO C[C@H](C[NH+](C)C)Oc1ccc(S)cc1 ZINC001225556244 962251403 /nfs/dbraw/zinc/25/14/03/962251403.db2.gz ZSJMOCYZCHXQLL-SECBINFHSA-N 1 2 211.330 2.304 20 0 BEADLO C[C@@H](C[NH+](C)C)Oc1ccc(S)cc1 ZINC001225556246 962256135 /nfs/dbraw/zinc/25/61/35/962256135.db2.gz ZSJMOCYZCHXQLL-VIFPVBQESA-N 1 2 211.330 2.304 20 0 BEADLO Cc1ccc(CNC(=O)[C@@H](C)n2cc[nH+]c2)cc1 ZINC000048481988 962410202 /nfs/dbraw/zinc/41/02/02/962410202.db2.gz MQHAAGUCSJSHNR-GFCCVEGCSA-N 1 2 243.310 2.069 20 0 BEADLO Cc1ccc(CNC(=O)[C@H](C)n2cc[nH+]c2)cc1 ZINC000048481990 962413704 /nfs/dbraw/zinc/41/37/04/962413704.db2.gz MQHAAGUCSJSHNR-LBPRGKRZSA-N 1 2 243.310 2.069 20 0 BEADLO COC1(OC)CC[C@@H]1Nc1ccc(C)[nH+]c1C ZINC000710999816 962581453 /nfs/dbraw/zinc/58/14/53/962581453.db2.gz YAOOPXBNAZSOJI-LBPRGKRZSA-N 1 2 236.315 2.262 20 0 BEADLO C[C@H](C(=O)N[C@@H]1C[C@@H]2CCCC[C@H]12)n1cc[nH+]c1 ZINC001153597755 962604791 /nfs/dbraw/zinc/60/47/91/962604791.db2.gz QILUCHDTOBWKHO-MROQNXINSA-N 1 2 247.342 2.139 20 0 BEADLO Cc1ccc(C)c(OC2C[NH+](C)C2)c1C ZINC001225797763 962832528 /nfs/dbraw/zinc/83/25/28/962832528.db2.gz HWIKKUFBERTMDR-UHFFFAOYSA-N 1 2 205.301 2.305 20 0 BEADLO C=Cc1ccc(NCCc2ncc(C)cn2)[nH+]c1 ZINC001154867623 962877106 /nfs/dbraw/zinc/87/71/06/962877106.db2.gz PKJOYALKINELNL-UHFFFAOYSA-N 1 2 240.310 2.478 20 0 BEADLO CC(=O)NCc1ccc(NCC(C)(C)C)[nH+]c1 ZINC001161634885 962894733 /nfs/dbraw/zinc/89/47/33/962894733.db2.gz RBNSRCJYBNOACV-UHFFFAOYSA-N 1 2 235.331 2.176 20 0 BEADLO Cn1c[nH+]cc1CN1CCCCC(F)(F)C1 ZINC001204383319 962899094 /nfs/dbraw/zinc/89/90/94/962899094.db2.gz FUNRVQTYTVZYOF-UHFFFAOYSA-N 1 2 229.274 2.041 20 0 BEADLO COCc1cc[nH+]c(N2CCC[C@@H](C)C2)c1 ZINC001155201318 963023725 /nfs/dbraw/zinc/02/37/25/963023725.db2.gz ZBASXUUWRDNODX-LLVKDONJSA-N 1 2 220.316 2.464 20 0 BEADLO COc1ccc(C)[nH+]c1N1C[C@@H](C)OC[C@H]1C ZINC001155417536 963073310 /nfs/dbraw/zinc/07/33/10/963073310.db2.gz HWNBYPIYZWUOKH-GHMZBOCLSA-N 1 2 236.315 2.012 20 0 BEADLO Cc1c(F)cc[nH+]c1N1C[C@@H](C)OC[C@H]1C ZINC001155428970 963076392 /nfs/dbraw/zinc/07/63/92/963076392.db2.gz OIHNSCKIUQEIOZ-RKDXNWHRSA-N 1 2 224.279 2.143 20 0 BEADLO CSc1cc[nH+]c(N2C[C@@H](C)OC[C@H]2C)c1 ZINC001155428735 963078259 /nfs/dbraw/zinc/07/82/59/963078259.db2.gz BHHDJJYNZMLPSZ-NXEZZACHSA-N 1 2 238.356 2.417 20 0 BEADLO Cc1ccsc1CN1CCC(F)(F)[C@@H]([NH3+])C1 ZINC001206658409 963160022 /nfs/dbraw/zinc/16/00/22/963160022.db2.gz XPZJPGBPPWERED-JTQLQIEISA-N 1 2 246.326 2.225 20 0 BEADLO CSCCCNc1ccc(Cl)c(N)[nH+]1 ZINC001155981877 963222590 /nfs/dbraw/zinc/22/25/90/963222590.db2.gz YOOJYJRROFBLFW-UHFFFAOYSA-N 1 2 231.752 2.482 20 0 BEADLO COc1c[nH+]c(NC[C@H]2CCCCO2)c(C)c1 ZINC001156372973 963326117 /nfs/dbraw/zinc/32/61/17/963326117.db2.gz VNVWCVNYNLSZFG-LLVKDONJSA-N 1 2 236.315 2.380 20 0 BEADLO COC(C)(C)CNc1cc(C)[nH+]c(SC)n1 ZINC001156433650 963343629 /nfs/dbraw/zinc/34/36/29/963343629.db2.gz UKVDWEANTIOEMF-UHFFFAOYSA-N 1 2 241.360 2.344 20 0 BEADLO COC(C)(C)CNc1nc(C)[nH+]c2c1CCC2 ZINC001156438700 963345352 /nfs/dbraw/zinc/34/53/52/963345352.db2.gz FVIFZTHTILAHAR-UHFFFAOYSA-N 1 2 235.331 2.111 20 0 BEADLO Cc1cc(F)cnc1NCc1cc[nH+]c(N)c1 ZINC001156756483 963453596 /nfs/dbraw/zinc/45/35/96/963453596.db2.gz ZMJLUDSQMRAMFK-UHFFFAOYSA-N 1 2 232.262 2.118 20 0 BEADLO CC(C)c1ccnc(NCc2cc[nH+]c(N)c2)n1 ZINC001156757550 963455391 /nfs/dbraw/zinc/45/53/91/963455391.db2.gz VIXIQTJXALVXNQ-UHFFFAOYSA-N 1 2 243.314 2.189 20 0 BEADLO Cc1cccc(O)c1OC1C[NH+](C(C)C)C1 ZINC001227140403 963465458 /nfs/dbraw/zinc/46/54/58/963465458.db2.gz ZETNAAGMLOXVIF-UHFFFAOYSA-N 1 2 221.300 2.172 20 0 BEADLO Cc1nc(N2Cc3ncsc3C2)c(C)c(C)[nH+]1 ZINC001156840068 963472375 /nfs/dbraw/zinc/47/23/75/963472375.db2.gz LUHXKYLBYIQKPS-UHFFFAOYSA-N 1 2 246.339 2.379 20 0 BEADLO CCCCCC(=O)NCc1[nH]c2c([nH+]1)CCCC2 ZINC001156891285 963481116 /nfs/dbraw/zinc/48/11/16/963481116.db2.gz DVVUTIAAYWJKPS-UHFFFAOYSA-N 1 2 249.358 2.485 20 0 BEADLO COc1cc(C)c[nH+]c1N(C)Cc1cncs1 ZINC001157082508 963524415 /nfs/dbraw/zinc/52/44/15/963524415.db2.gz JZOPTWWJJXFYRS-UHFFFAOYSA-N 1 2 249.339 2.492 20 0 BEADLO COc1ccc2cnc(NC=[NH2+])cc2c1 ZINC001157078290 963525556 /nfs/dbraw/zinc/52/55/56/963525556.db2.gz KLQPMGMVLFXSAK-UHFFFAOYSA-N 1 2 201.229 2.262 20 0 BEADLO CCOC(=O)c1c(C)nc(Cl)cc1NC=[NH2+] ZINC001157078529 963525681 /nfs/dbraw/zinc/52/56/81/963525681.db2.gz OLQTUEJDDOEBCC-UHFFFAOYSA-N 1 2 241.678 2.239 20 0 BEADLO Cc1cc[nH]c1C(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001157125682 963536957 /nfs/dbraw/zinc/53/69/57/963536957.db2.gz YOIHZHIMLQXMQP-UHFFFAOYSA-N 1 2 246.314 2.100 20 0 BEADLO Cc1cc[nH]c1C(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001157125682 963536953 /nfs/dbraw/zinc/53/69/53/963536953.db2.gz YOIHZHIMLQXMQP-UHFFFAOYSA-N 1 2 246.314 2.100 20 0 BEADLO CSCc1cc[nH+]c(N[C@H]2C[C@@H](CO)C2)c1 ZINC001157464044 963620874 /nfs/dbraw/zinc/62/08/74/963620874.db2.gz LRUNWFVOYIWVSF-PHIMTYICSA-N 1 2 238.356 2.127 20 0 BEADLO COc1cc(C)c[nH+]c1NCc1ccc(=O)[nH]c1 ZINC001157516916 963639523 /nfs/dbraw/zinc/63/95/23/963639523.db2.gz SCHOLYMPDBRRCE-UHFFFAOYSA-N 1 2 245.282 2.111 20 0 BEADLO CCc1cc(C[NH+]2CC3(C2)CC(F)(F)C3)on1 ZINC001203212467 963649511 /nfs/dbraw/zinc/64/95/11/963649511.db2.gz NWAKDIWKMBPDPJ-UHFFFAOYSA-N 1 2 242.269 2.468 20 0 BEADLO CCC1(CNc2nc(C)[nH+]c3c2CCC3)COC1 ZINC001157546180 963655431 /nfs/dbraw/zinc/65/54/31/963655431.db2.gz DJGCKQPKPCWGHH-UHFFFAOYSA-N 1 2 247.342 2.112 20 0 BEADLO CCOc1ccc[nH+]c1NC[C@H]1C[C@@](C)(O)C1 ZINC001157560970 963663246 /nfs/dbraw/zinc/66/32/46/963663246.db2.gz UZMDPCJCEKHPLL-GSJFWJNXSA-N 1 2 236.315 2.053 20 0 BEADLO COc1cc(C)c[nH+]c1NC[C@H]1CC(C)(C)O1 ZINC001157659388 963692053 /nfs/dbraw/zinc/69/20/53/963692053.db2.gz CRFRRAFALVJEPK-SNVBAGLBSA-N 1 2 236.315 2.378 20 0 BEADLO C[C@H](Nc1cc(N(C)C)nc[nH+]1)C(C)(C)C ZINC001157872218 963752803 /nfs/dbraw/zinc/75/28/03/963752803.db2.gz RPHDPKJLYYDQFB-VIFPVBQESA-N 1 2 222.336 2.389 20 0 BEADLO C[C@H](Nc1cc(N(C)C)[nH+]cn1)C(C)(C)C ZINC001157872218 963752808 /nfs/dbraw/zinc/75/28/08/963752808.db2.gz RPHDPKJLYYDQFB-VIFPVBQESA-N 1 2 222.336 2.389 20 0 BEADLO COc1cc(C)c[nH+]c1N[C@@H](C)c1cnccn1 ZINC001158596746 963893805 /nfs/dbraw/zinc/89/38/05/963893805.db2.gz KBGYFXHYCVPKAS-JTQLQIEISA-N 1 2 244.298 2.362 20 0 BEADLO CSc1cc[nH+]c(N[C@H]2CCCOC2)c1 ZINC001158714036 963909498 /nfs/dbraw/zinc/90/94/98/963909498.db2.gz KDZPAJGKWINKBP-VIFPVBQESA-N 1 2 224.329 2.394 20 0 BEADLO Cc1c(F)cc[nH+]c1NCc1ncccc1O ZINC001158774539 963925823 /nfs/dbraw/zinc/92/58/23/963925823.db2.gz MUBWEQJQFFJQLR-UHFFFAOYSA-N 1 2 233.246 2.242 20 0 BEADLO Fc1c[nH]c2nc[nH+]c(NC[C@H]3C[C@H](F)C3)c12 ZINC001168232813 964018510 /nfs/dbraw/zinc/01/85/10/964018510.db2.gz DEESNQJXUJIPDZ-LJGSYFOKSA-N 1 2 238.241 2.209 20 0 BEADLO COc1cc[nH+]cc1NC[C@H]1C[C@H](F)C1 ZINC001168237707 964038989 /nfs/dbraw/zinc/03/89/89/964038989.db2.gz LVRZXLMLQSOHOC-KYZUINATSA-N 1 2 210.252 2.250 20 0 BEADLO Cc1nc(N[C@H]2CCOC[C@H]2C)c2c([nH+]1)CCC2 ZINC001159712801 964163574 /nfs/dbraw/zinc/16/35/74/964163574.db2.gz ANPZBPBKYPRULA-SKDRFNHKSA-N 1 2 247.342 2.111 20 0 BEADLO Cc1cc(F)cc(-c2noc(C[NH+]3CCC3)n2)c1 ZINC001212093097 964253612 /nfs/dbraw/zinc/25/36/12/964253612.db2.gz FUNOOYXUUIBTTB-UHFFFAOYSA-N 1 2 247.273 2.390 20 0 BEADLO Cc1c[nH]c(CCNC(=O)[C@]2(C)CC=CCC2)[nH+]1 ZINC001142545990 964376949 /nfs/dbraw/zinc/37/69/49/964376949.db2.gz KJAMBAGLSBJZRC-CQSZACIVSA-N 1 2 247.342 2.123 20 0 BEADLO Cn1cc(Nc2cccc3[nH+]c[nH]c32)cn1 ZINC001213026297 964408558 /nfs/dbraw/zinc/40/85/58/964408558.db2.gz RTWLMEWQJPNTOD-UHFFFAOYSA-N 1 2 213.244 2.040 20 0 BEADLO C[C@H](Cc1ccncc1)[NH2+][C@H]1CC1(F)F ZINC001256715847 1169838556 /nfs/dbraw/zinc/83/85/56/1169838556.db2.gz IKNJLJPDGWGXIV-SCZZXKLOSA-N 1 2 212.243 2.010 20 0 BEADLO O=c1ccc(Nc2cccc3[nH+]c[nH]c32)c[nH]1 ZINC001213027424 964441053 /nfs/dbraw/zinc/44/10/53/964441053.db2.gz YZIKRDXBRRODPY-UHFFFAOYSA-N 1 2 226.239 2.407 20 0 BEADLO Cc1ncncc1Nc1cccc2[nH+]c[nH]c21 ZINC001213027309 964441647 /nfs/dbraw/zinc/44/16/47/964441647.db2.gz SVQJFWKESPYSCD-UHFFFAOYSA-N 1 2 225.255 2.405 20 0 BEADLO CNc1cc(NC2CC3(CCC3)C2)[nH+]cn1 ZINC000697694761 964497917 /nfs/dbraw/zinc/49/79/17/964497917.db2.gz GILPDRRMSSOWAZ-UHFFFAOYSA-N 1 2 218.304 2.263 20 0 BEADLO COCn1cc(Nc2cccc3[nH+]c[nH]c32)cn1 ZINC001213029469 964520728 /nfs/dbraw/zinc/52/07/28/964520728.db2.gz MNWXNLBITWEHSP-UHFFFAOYSA-N 1 2 243.270 2.107 20 0 BEADLO Nc1cccc2[nH+]cn(-c3cccc4nc[nH]c43)c21 ZINC001213032159 964582738 /nfs/dbraw/zinc/58/27/38/964582738.db2.gz WCHPIMZGGKSXIG-UHFFFAOYSA-N 1 2 249.277 2.484 20 0 BEADLO Cc1cnnc(NCc2c[nH+]cn2C(C)C)c1 ZINC001161563093 964642260 /nfs/dbraw/zinc/64/22/60/964642260.db2.gz MXLVNEDBJXXAKG-UHFFFAOYSA-N 1 2 231.303 2.175 20 0 BEADLO c1cc2ncc(NCCCn3cc[nH+]c3)cc2[nH]1 ZINC001161684438 964681801 /nfs/dbraw/zinc/68/18/01/964681801.db2.gz AIDQKJGNJZYRJI-UHFFFAOYSA-N 1 2 241.298 2.262 20 0 BEADLO COc1ncc(C)cc1NCCCn1cc[nH+]c1 ZINC001161688642 964687023 /nfs/dbraw/zinc/68/70/23/964687023.db2.gz XUGIUCVLWOTWJE-UHFFFAOYSA-N 1 2 246.314 2.097 20 0 BEADLO CC(C)OCCNc1ccc2[nH+]cn(C)c2c1 ZINC001161788621 964756754 /nfs/dbraw/zinc/75/67/54/964756754.db2.gz IONLFHYMUYWPDI-UHFFFAOYSA-N 1 2 233.315 2.410 20 0 BEADLO Cn1c[nH+]c2ccc(NC3CCOCC3)cc21 ZINC001161862683 964795835 /nfs/dbraw/zinc/79/58/35/964795835.db2.gz KOMUAQVWTSTQMV-UHFFFAOYSA-N 1 2 231.299 2.164 20 0 BEADLO CC(C)Oc1cc(NCc2ccnn2C)cc[nH+]1 ZINC001161873956 964802940 /nfs/dbraw/zinc/80/29/40/964802940.db2.gz JUFXAHWUJPLQEV-UHFFFAOYSA-N 1 2 246.314 2.214 20 0 BEADLO COc1cc[nH+]cc1NCc1ncccc1C ZINC001161883234 964808169 /nfs/dbraw/zinc/80/81/69/964808169.db2.gz CHHJFHHELWTGLV-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO COC(=[NH2+])c1cccc(NCc2nccn2C)c1 ZINC001161919761 964818872 /nfs/dbraw/zinc/81/88/72/964818872.db2.gz BNIHINBPRALBLX-UHFFFAOYSA-N 1 2 244.298 2.004 20 0 BEADLO Cc1cc(NCc2nccn2C)ccc1[NH+](C)C ZINC001161919785 964818887 /nfs/dbraw/zinc/81/88/87/964818887.db2.gz CSIUSTILDAJQOP-UHFFFAOYSA-N 1 2 244.342 2.407 20 0 BEADLO Fc1ccc2c[nH+]c(NCC3COC3)cc2c1 ZINC001161946224 964830711 /nfs/dbraw/zinc/83/07/11/964830711.db2.gz OFMYHHQYIPFCRC-UHFFFAOYSA-N 1 2 232.258 2.432 20 0 BEADLO Cc1ccnc(CNc2c(C)cc[nH+]c2C)n1 ZINC001162196169 964864360 /nfs/dbraw/zinc/86/43/60/964864360.db2.gz DUSDSIXBLFPXFR-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO FC1CC(Nc2ccn3cc[nH+]c3c2)C1 ZINC001162210607 964873209 /nfs/dbraw/zinc/87/32/09/964873209.db2.gz UOMZULKUESJNGN-UHFFFAOYSA-N 1 2 205.236 2.247 20 0 BEADLO Cc1cc(NC[C@@H](O)c2ccco2)c[nH+]c1C ZINC001162257236 964891913 /nfs/dbraw/zinc/89/19/13/964891913.db2.gz DNVNEQGUIKRDKU-GFCCVEGCSA-N 1 2 232.283 2.437 20 0 BEADLO CN(C)c1ncc(CNc2cccc[nH+]2)s1 ZINC000163653727 964896089 /nfs/dbraw/zinc/89/60/89/964896089.db2.gz LAWWVIFLIOLBEP-UHFFFAOYSA-N 1 2 234.328 2.216 20 0 BEADLO CCOc1ccc[nH+]c1N[C@H]1C[C@]12CCCOC2 ZINC001162381036 964949478 /nfs/dbraw/zinc/94/94/78/964949478.db2.gz PECQUNAFUVIJCN-JSGCOSHPSA-N 1 2 248.326 2.461 20 0 BEADLO CCOc1ccc[nH+]c1N[C@H]1C[C@@]12CCCOC2 ZINC001162381035 964950021 /nfs/dbraw/zinc/95/00/21/964950021.db2.gz PECQUNAFUVIJCN-GXTWGEPZSA-N 1 2 248.326 2.461 20 0 BEADLO COc1cc(C)c[nH+]c1N[C@@H]1C[C@@]12CCCOC2 ZINC001162379614 964950333 /nfs/dbraw/zinc/95/03/33/964950333.db2.gz ZAQHVJVDGAPWBB-TZMCWYRMSA-N 1 2 248.326 2.380 20 0 BEADLO Cc1c(F)cc[nH+]c1NC[C@@H](F)C(C)(C)O ZINC001162412322 964968613 /nfs/dbraw/zinc/96/86/13/964968613.db2.gz RSFQUUKYEQHLOR-SECBINFHSA-N 1 2 230.258 2.050 20 0 BEADLO COC(=O)c1[nH+]ccc(NC(C)(C)C2CC2)c1C ZINC001162522500 965019278 /nfs/dbraw/zinc/01/92/78/965019278.db2.gz WJGLEHJWIDDVMF-UHFFFAOYSA-N 1 2 248.326 2.199 20 0 BEADLO Cc1c(F)cc[nH+]c1NC[C@@H](O)c1ccncc1 ZINC001162547014 965034715 /nfs/dbraw/zinc/03/47/15/965034715.db2.gz HHTDBNZZSYYCLY-GFCCVEGCSA-N 1 2 247.273 2.070 20 0 BEADLO Cn1cccc1CNc1ccc2c([nH+]1)CCOC2 ZINC001162706591 965129696 /nfs/dbraw/zinc/12/96/96/965129696.db2.gz SUVVEFIYEZYUFJ-UHFFFAOYSA-N 1 2 243.310 2.105 20 0 BEADLO COC1CC(CNc2nc(C)[nH+]c3c2CCC3)C1 ZINC001162991966 965222921 /nfs/dbraw/zinc/22/29/21/965222921.db2.gz ZYAMZHYBBBBGJO-UHFFFAOYSA-N 1 2 247.342 2.111 20 0 BEADLO CCC1(C[NH2+][C@@H](C)C(=O)OC(C)(C)C)CC1 ZINC000226774047 965243728 /nfs/dbraw/zinc/24/37/28/965243728.db2.gz VYMUUVQXNJMQLR-JTQLQIEISA-N 1 2 227.348 2.496 20 0 BEADLO Fc1cccnc1NCc1ccc2[nH+]ccn2c1 ZINC001163136556 965260425 /nfs/dbraw/zinc/26/04/25/965260425.db2.gz KPZBRCGNBMGUIV-UHFFFAOYSA-N 1 2 242.257 2.481 20 0 BEADLO COc1cc(C)c[nH+]c1N[C@@H](C)[C@@H]1CCCO1 ZINC001163480715 965419121 /nfs/dbraw/zinc/41/91/21/965419121.db2.gz XWNKXPAQBLRHMA-QWRGUYRKSA-N 1 2 236.315 2.378 20 0 BEADLO CCc1ccc(N2C[C@@H]3CC[C@H](O)C[C@@H]3C2)[nH+]c1 ZINC001120944928 965459416 /nfs/dbraw/zinc/45/94/16/965459416.db2.gz CYQDZMGLKZZSJO-MJBXVCDLSA-N 1 2 246.354 2.241 20 0 BEADLO CCCN(CCOC)c1[nH+]cc(C)cc1OC ZINC001163647485 965493297 /nfs/dbraw/zinc/49/32/97/965493297.db2.gz DEMXRDVKMCPWPJ-UHFFFAOYSA-N 1 2 238.331 2.261 20 0 BEADLO Oc1cccc(CCNc2cc[nH+]cc2F)c1 ZINC001163698439 965516200 /nfs/dbraw/zinc/51/62/00/965516200.db2.gz NWPBIBMNNGAYSI-UHFFFAOYSA-N 1 2 232.258 2.003 20 0 BEADLO COCC1CN(c2ccc(C(C)C)c[nH+]2)C1 ZINC001163729869 965543458 /nfs/dbraw/zinc/54/34/58/965543458.db2.gz CHNHDDIEWNKXHH-UHFFFAOYSA-N 1 2 220.316 2.288 20 0 BEADLO OC1CC2(C1)CN(c1cc3ccccc3c[nH+]1)C2 ZINC001163735238 965551991 /nfs/dbraw/zinc/55/19/91/965551991.db2.gz NEQFMZHPHWFQFV-UHFFFAOYSA-N 1 2 240.306 2.196 20 0 BEADLO Nc1ccc(N2CCC(=O)[C@@H]3CCCC[C@@H]32)[nH+]c1 ZINC001163789109 965590053 /nfs/dbraw/zinc/59/00/53/965590053.db2.gz AIZKOWOZKBZENV-NEPJUHHUSA-N 1 2 245.326 2.002 20 0 BEADLO CSCCCNc1ccc2c([nH+]1)CCOC2 ZINC001163871472 965613357 /nfs/dbraw/zinc/61/33/57/965613357.db2.gz OHQSDCPFJLUGBA-UHFFFAOYSA-N 1 2 238.356 2.319 20 0 BEADLO Cc1c(F)cc[nH+]c1N1CCCO[C@H](C)C1 ZINC001163962589 965661910 /nfs/dbraw/zinc/66/19/10/965661910.db2.gz SASHHTQSOIZXTA-SECBINFHSA-N 1 2 224.279 2.144 20 0 BEADLO Cc1nc(N2CC(F)(C3CC3)C2)c(C)c(C)[nH+]1 ZINC001163972299 965671260 /nfs/dbraw/zinc/67/12/60/965671260.db2.gz LAUYXODMOHNBJN-UHFFFAOYSA-N 1 2 235.306 2.340 20 0 BEADLO COc1c[nH+]c(NC2(C)CCC2)nc1NC1CC1 ZINC001164023317 965699309 /nfs/dbraw/zinc/69/93/09/965699309.db2.gz PFXXXGKOXJXTHQ-UHFFFAOYSA-N 1 2 248.330 2.414 20 0 BEADLO CN(C)c1ccc(NC[C@@H]2CC(C)(C)O2)[nH+]c1 ZINC001168455481 965759739 /nfs/dbraw/zinc/75/97/39/965759739.db2.gz GPWSDEBLUMGGBW-NSHDSACASA-N 1 2 235.331 2.127 20 0 BEADLO CNc1ccc(CNc2cc[nH+]cc2F)cc1 ZINC001164151984 965763780 /nfs/dbraw/zinc/76/37/80/965763780.db2.gz CPNPJWURKICEKU-UHFFFAOYSA-N 1 2 231.274 2.296 20 0 BEADLO CC(C)c1[nH]cc(CNc2nccnc2F)[nH+]1 ZINC001164220321 965802494 /nfs/dbraw/zinc/80/24/94/965802494.db2.gz FVRGGWPFMBYRKR-UHFFFAOYSA-N 1 2 235.266 2.074 20 0 BEADLO CC(C)c1[nH]c(CNc2nccnc2F)c[nH+]1 ZINC001164220321 965802500 /nfs/dbraw/zinc/80/25/00/965802500.db2.gz FVRGGWPFMBYRKR-UHFFFAOYSA-N 1 2 235.266 2.074 20 0 BEADLO COc1ncc(Nc2[nH+]cc(C)cc2C)cc1N ZINC001203502547 965852198 /nfs/dbraw/zinc/85/21/98/965852198.db2.gz XXNDSGOIHUHQDX-UHFFFAOYSA-N 1 2 244.298 2.428 20 0 BEADLO c1ccn(CCNc2cc3cc[nH]c3c[nH+]2)c1 ZINC001164438821 965883606 /nfs/dbraw/zinc/88/36/06/965883606.db2.gz JFRMIEJKKGQIOC-UHFFFAOYSA-N 1 2 226.283 2.477 20 0 BEADLO CCN(CC)C(=O)[C@H](C)Nc1c(C)cc[nH+]c1C ZINC001164643847 965939100 /nfs/dbraw/zinc/93/91/00/965939100.db2.gz ZEMHXFAQBYBSNZ-LBPRGKRZSA-N 1 2 249.358 2.367 20 0 BEADLO CNc1ccc(Nc2cc(SC)nn2C)c[nH+]1 ZINC001203451849 966000202 /nfs/dbraw/zinc/00/02/02/966000202.db2.gz DZKQPBNRZGJQBG-UHFFFAOYSA-N 1 2 249.343 2.322 20 0 BEADLO Cc1c(F)cc[nH+]c1N1CCCC(=O)CC1 ZINC001165466071 966100917 /nfs/dbraw/zinc/10/09/17/966100917.db2.gz LCJAGSKRZVJLAE-UHFFFAOYSA-N 1 2 222.263 2.089 20 0 BEADLO Cc1cc2cc(N[C@@H](C)CCO)[nH+]cc2[nH]1 ZINC001165867190 966180485 /nfs/dbraw/zinc/18/04/85/966180485.db2.gz NZEGKVHUDUBFGK-QMMMGPOBSA-N 1 2 219.288 2.054 20 0 BEADLO CCC(=O)Cn1c[nH+]c(Cc2ccccc2)c1 ZINC000919144703 966295225 /nfs/dbraw/zinc/29/52/25/966295225.db2.gz SRNQZOMZPMPZTF-UHFFFAOYSA-N 1 2 228.295 2.453 20 0 BEADLO CC(C)(O)Cn1c[nH+]c(Cc2ccccc2)c1 ZINC000919149684 966297103 /nfs/dbraw/zinc/29/71/03/966297103.db2.gz CUFHSIBAVJTAHD-UHFFFAOYSA-N 1 2 230.311 2.245 20 0 BEADLO Cc1cc(CN(C)c2[nH+]ccc(F)c2C)n(C)n1 ZINC001166597777 966318035 /nfs/dbraw/zinc/31/80/35/966318035.db2.gz YLZJYMYXNAOZGL-UHFFFAOYSA-N 1 2 248.305 2.207 20 0 BEADLO COc1ccc(C)[nH+]c1N1CCn2cccc2C1 ZINC001166602116 966319486 /nfs/dbraw/zinc/31/94/86/966319486.db2.gz VMPAFRSDPPVXAP-UHFFFAOYSA-N 1 2 243.310 2.220 20 0 BEADLO C[C@@H]1CCCN(c2cc(N(C)C)[nH+]cn2)[C@H]1C ZINC001166612624 966331988 /nfs/dbraw/zinc/33/19/88/966331988.db2.gz XOSSSKZYTDKEFS-MNOVXSKESA-N 1 2 234.347 2.167 20 0 BEADLO C[C@@H]1CCCN(c2cc(N(C)C)nc[nH+]2)[C@H]1C ZINC001166612624 966332000 /nfs/dbraw/zinc/33/20/00/966332000.db2.gz XOSSSKZYTDKEFS-MNOVXSKESA-N 1 2 234.347 2.167 20 0 BEADLO Nc1ccc(-c2ccc(-c3nc[nH]n3)cc2)c[nH+]1 ZINC001236313124 966360853 /nfs/dbraw/zinc/36/08/53/966360853.db2.gz JONKYPPUTFYHKF-UHFFFAOYSA-N 1 2 237.266 2.116 20 0 BEADLO Cc1cc(Cl)c(C)c(N2C[C@@H]3C[C@H]2CO3)[nH+]1 ZINC001166757045 966399856 /nfs/dbraw/zinc/39/98/56/966399856.db2.gz ZIGQFCSDJSUXBE-UWVGGRQHSA-N 1 2 238.718 2.329 20 0 BEADLO CCc1cn(CC(=O)Nc2cccc(F)c2)c[nH+]1 ZINC001166823037 966426053 /nfs/dbraw/zinc/42/60/53/966426053.db2.gz RIUCCNWRRAINEK-UHFFFAOYSA-N 1 2 247.273 2.223 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1cncc(O)c1 ZINC001236580840 966460370 /nfs/dbraw/zinc/46/03/70/966460370.db2.gz PZPJTZSMJNBEIB-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO C[C@]1(CF)CC[N@H+](Cc2nccnc2Cl)C1 ZINC001236614003 966481913 /nfs/dbraw/zinc/48/19/13/966481913.db2.gz NETDHTXVCCLHNB-LLVKDONJSA-N 1 2 243.713 2.312 20 0 BEADLO C[C@]1(CF)CC[N@@H+](Cc2nccnc2Cl)C1 ZINC001236614003 966481919 /nfs/dbraw/zinc/48/19/19/966481919.db2.gz NETDHTXVCCLHNB-LLVKDONJSA-N 1 2 243.713 2.312 20 0 BEADLO Cc1ccc(O)cc1Nc1[nH+]cccc1N ZINC001214338853 966483604 /nfs/dbraw/zinc/48/36/04/966483604.db2.gz CQPVDHKQUZSVCT-UHFFFAOYSA-N 1 2 215.256 2.421 20 0 BEADLO Cc1nc(N2CCOC[C@@H]2C(C)C)c(C)c(C)[nH+]1 ZINC001166998867 966512533 /nfs/dbraw/zinc/51/25/33/966512533.db2.gz BHKZVUFTWSVMSN-CYBMUJFWSA-N 1 2 249.358 2.263 20 0 BEADLO Cc1cncc(C[N@H+](C)Cc2cccc(O)c2)n1 ZINC001203162098 966534579 /nfs/dbraw/zinc/53/45/79/966534579.db2.gz QVXYPDIUUGMPOH-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO Cc1cncc(C[N@@H+](C)Cc2cccc(O)c2)n1 ZINC001203162098 966534584 /nfs/dbraw/zinc/53/45/84/966534584.db2.gz QVXYPDIUUGMPOH-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cnn[nH]2)cc1 ZINC001203206425 966552057 /nfs/dbraw/zinc/55/20/57/966552057.db2.gz ZYPODYCKDZUXQR-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cnn[nH]2)cc1 ZINC001203206425 966552066 /nfs/dbraw/zinc/55/20/66/966552066.db2.gz ZYPODYCKDZUXQR-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2c[nH]nn2)cc1 ZINC001203206425 966552073 /nfs/dbraw/zinc/55/20/73/966552073.db2.gz ZYPODYCKDZUXQR-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2c[nH]nn2)cc1 ZINC001203206425 966552083 /nfs/dbraw/zinc/55/20/83/966552083.db2.gz ZYPODYCKDZUXQR-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO CCc1cccc(NC=CC(C)(C)O)[nH+]1 ZINC001203215100 966559119 /nfs/dbraw/zinc/55/91/19/966559119.db2.gz REIYKXIGIKASJE-CMDGGOBGSA-N 1 2 206.289 2.341 20 0 BEADLO Cc1cn2cccc(Nc3cnoc3)c2[nH+]1 ZINC001203233258 966570854 /nfs/dbraw/zinc/57/08/54/966570854.db2.gz VWTYTDHBBSWJDG-UHFFFAOYSA-N 1 2 214.228 2.374 20 0 BEADLO c1coc(C[N@@H+]2CCc3occc3C2)c1 ZINC001203284297 966599653 /nfs/dbraw/zinc/59/96/53/966599653.db2.gz WJHMLTIVXQUEFT-UHFFFAOYSA-N 1 2 203.241 2.431 20 0 BEADLO c1coc(C[N@H+]2CCc3occc3C2)c1 ZINC001203284297 966599659 /nfs/dbraw/zinc/59/96/59/966599659.db2.gz WJHMLTIVXQUEFT-UHFFFAOYSA-N 1 2 203.241 2.431 20 0 BEADLO Fc1ccccc1C[N@@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001203359855 966612342 /nfs/dbraw/zinc/61/23/42/966612342.db2.gz LQDNRFVRVKJTOM-VXGBXAGGSA-N 1 2 221.275 2.189 20 0 BEADLO Fc1ccccc1C[N@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001203359855 966612346 /nfs/dbraw/zinc/61/23/46/966612346.db2.gz LQDNRFVRVKJTOM-VXGBXAGGSA-N 1 2 221.275 2.189 20 0 BEADLO Cc1ccc(Nc2ccc(CO)nc2)c(C)[nH+]1 ZINC001203369239 966617798 /nfs/dbraw/zinc/61/77/98/966617798.db2.gz MDFSYLQVPDKIAE-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO CNc1ccc(Nc2ncc(F)cc2O)c[nH+]1 ZINC001203451881 966651661 /nfs/dbraw/zinc/65/16/61/966651661.db2.gz FMOBZPDAMORHLM-UHFFFAOYSA-N 1 2 234.234 2.107 20 0 BEADLO CNc1ccc(N(C)c2ccccc2N)c[nH+]1 ZINC001203456495 966658549 /nfs/dbraw/zinc/65/85/49/966658549.db2.gz GLUXCQPPDSHVGB-UHFFFAOYSA-N 1 2 228.299 2.473 20 0 BEADLO COc1cncc(Nc2cc(C)c[nH+]c2C)n1 ZINC001203656611 966722104 /nfs/dbraw/zinc/72/21/04/966722104.db2.gz XEPMDCFLECKOMM-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO CC(=O)[C@@H]1C[N@H+](Cc2cc(C)ccc2C)CCO1 ZINC001203751609 966772743 /nfs/dbraw/zinc/77/27/43/966772743.db2.gz DQRBAOHTMYPFTG-HNNXBMFYSA-N 1 2 247.338 2.093 20 0 BEADLO CC(=O)[C@@H]1C[N@@H+](Cc2cc(C)ccc2C)CCO1 ZINC001203751609 966772750 /nfs/dbraw/zinc/77/27/50/966772750.db2.gz DQRBAOHTMYPFTG-HNNXBMFYSA-N 1 2 247.338 2.093 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC3(CC3)C2)ccc1F ZINC001205198860 966815620 /nfs/dbraw/zinc/81/56/20/966815620.db2.gz VITJSVXOPNETPH-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1cc(C[N@H+]2CCOC3(CC3)C2)ccc1F ZINC001205198860 966815622 /nfs/dbraw/zinc/81/56/22/966815622.db2.gz VITJSVXOPNETPH-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO CC[N@H+](Cc1ncc[nH]1)Cc1cccc(OC)c1 ZINC001203983570 966841627 /nfs/dbraw/zinc/84/16/27/966841627.db2.gz JTTXIWVVERWXNB-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO CC[N@@H+](Cc1ncc[nH]1)Cc1cccc(OC)c1 ZINC001203983570 966841630 /nfs/dbraw/zinc/84/16/30/966841630.db2.gz JTTXIWVVERWXNB-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO c1c[nH]c(C[NH+]2CC(c3ccccc3)C2)n1 ZINC001203984083 966842197 /nfs/dbraw/zinc/84/21/97/966842197.db2.gz XLPVFTTWWYSQFN-UHFFFAOYSA-N 1 2 213.284 2.009 20 0 BEADLO c1[nH]c2ccccc2c1C[NH+]1CC2(CCO2)C1 ZINC001204047020 966870464 /nfs/dbraw/zinc/87/04/64/966870464.db2.gz DIGOTXNNIWUFAN-UHFFFAOYSA-N 1 2 228.295 2.143 20 0 BEADLO c1cncc(C[N@@H+]2CCc3cccnc3C2)c1 ZINC001204076248 966883870 /nfs/dbraw/zinc/88/38/70/966883870.db2.gz QTVIDOPGJKSWSB-UHFFFAOYSA-N 1 2 225.295 2.035 20 0 BEADLO c1cncc(C[N@H+]2CCc3cccnc3C2)c1 ZINC001204076248 966883878 /nfs/dbraw/zinc/88/38/78/966883878.db2.gz QTVIDOPGJKSWSB-UHFFFAOYSA-N 1 2 225.295 2.035 20 0 BEADLO Cc1c(F)cccc1C[N@H+]1CCOC[C@H]1C ZINC001204506258 967011232 /nfs/dbraw/zinc/01/12/32/967011232.db2.gz GUQLDXJPHLYICF-SNVBAGLBSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1c(F)cccc1C[N@@H+]1CCOC[C@H]1C ZINC001204506258 967011236 /nfs/dbraw/zinc/01/12/36/967011236.db2.gz GUQLDXJPHLYICF-SNVBAGLBSA-N 1 2 223.291 2.355 20 0 BEADLO Nc1[nH+]cccc1Nc1ccnc(Cl)c1O ZINC001212395647 967025218 /nfs/dbraw/zinc/02/52/18/967025218.db2.gz WZKJWWWKDGZIJY-UHFFFAOYSA-N 1 2 236.662 2.161 20 0 BEADLO COc1cc(Nc2[nH+]c(C)ccc2O)ccc1N ZINC001249715001 967036780 /nfs/dbraw/zinc/03/67/80/967036780.db2.gz LAHQNZDHQSXZOI-UHFFFAOYSA-N 1 2 245.282 2.430 20 0 BEADLO Cc1cc(C[N@H+]2CCC(=O)[C@H](F)CC2)oc1C ZINC001204537980 967037004 /nfs/dbraw/zinc/03/70/04/967037004.db2.gz WFRSWLLXLLFHGY-GFCCVEGCSA-N 1 2 239.290 2.399 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(=O)[C@H](F)CC2)oc1C ZINC001204537980 967037009 /nfs/dbraw/zinc/03/70/09/967037009.db2.gz WFRSWLLXLLFHGY-GFCCVEGCSA-N 1 2 239.290 2.399 20 0 BEADLO c1csc(C[N@@H+]2CC[C@@H]3CCCO[C@H]3C2)n1 ZINC001204545616 967045321 /nfs/dbraw/zinc/04/53/21/967045321.db2.gz ZITLENPZDSVWMD-QWRGUYRKSA-N 1 2 238.356 2.144 20 0 BEADLO c1csc(C[N@H+]2CC[C@@H]3CCCO[C@H]3C2)n1 ZINC001204545616 967045333 /nfs/dbraw/zinc/04/53/33/967045333.db2.gz ZITLENPZDSVWMD-QWRGUYRKSA-N 1 2 238.356 2.144 20 0 BEADLO Cc1[nH+]c[nH]c1CN1CC[C@H](CF)C(F)(F)C1 ZINC001204587689 967076031 /nfs/dbraw/zinc/07/60/31/967076031.db2.gz IKSXUMUQNTUBRD-SECBINFHSA-N 1 2 247.264 2.145 20 0 BEADLO CC[N@H+](Cc1[nH]cnc1C)Cc1ccccn1 ZINC001204591108 967090800 /nfs/dbraw/zinc/09/08/00/967090800.db2.gz WQSBQNLHQXBHNV-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CC[N@@H+](Cc1[nH]cnc1C)Cc1ccccn1 ZINC001204591108 967090812 /nfs/dbraw/zinc/09/08/12/967090812.db2.gz WQSBQNLHQXBHNV-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CCCn1c[nH+]cc1CN1CCOC2(CCC2)C1 ZINC001204608272 967102804 /nfs/dbraw/zinc/10/28/04/967102804.db2.gz GJJNJJNZFRVQIV-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CN(C)c1cc(F)cc(C[N@@H+]2CC[C@@H](F)C2)c1 ZINC001249941321 967181387 /nfs/dbraw/zinc/18/13/87/967181387.db2.gz FGFRFXFJTSMTLV-LLVKDONJSA-N 1 2 240.297 2.436 20 0 BEADLO CN(C)c1cc(F)cc(C[N@H+]2CC[C@@H](F)C2)c1 ZINC001249941321 967181389 /nfs/dbraw/zinc/18/13/89/967181389.db2.gz FGFRFXFJTSMTLV-LLVKDONJSA-N 1 2 240.297 2.436 20 0 BEADLO CCOC(=O)CCCc1ccc2[nH+]ccn2c1 ZINC001249972911 967212688 /nfs/dbraw/zinc/21/26/88/967212688.db2.gz HOYACWILYABZIC-UHFFFAOYSA-N 1 2 232.283 2.220 20 0 BEADLO Cc1nccc(Nc2ccn3cc[nH+]c3c2)n1 ZINC001204951277 967249897 /nfs/dbraw/zinc/24/98/97/967249897.db2.gz QGPOUCWQEYODJG-UHFFFAOYSA-N 1 2 225.255 2.176 20 0 BEADLO CNc1ccc(Nc2ccccn2)c[nH+]1 ZINC001203446646 967252545 /nfs/dbraw/zinc/25/25/45/967252545.db2.gz GHVZLYFHPLFJSP-UHFFFAOYSA-N 1 2 200.245 2.262 20 0 BEADLO Cc1cc(C)c(Nc2ccc3nncn3c2)c[nH+]1 ZINC001249999625 967254690 /nfs/dbraw/zinc/25/46/90/967254690.db2.gz JZGYUGSPBSRELP-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Nc1ccc(O)c(Nc2ccn3cc[nH+]c3c2)c1 ZINC001204982801 967275609 /nfs/dbraw/zinc/27/56/09/967275609.db2.gz JELJQQRZNXFSAK-UHFFFAOYSA-N 1 2 240.266 2.366 20 0 BEADLO CCOc1cc(C[N@@H+]2CCC[C@H]2C(C)=O)ccn1 ZINC001250018866 967277218 /nfs/dbraw/zinc/27/72/18/967277218.db2.gz JHGZPGIINMETLE-ZDUSSCGKSA-N 1 2 248.326 2.034 20 0 BEADLO CCOc1cc(C[N@H+]2CCC[C@H]2C(C)=O)ccn1 ZINC001250018866 967277221 /nfs/dbraw/zinc/27/72/21/967277221.db2.gz JHGZPGIINMETLE-ZDUSSCGKSA-N 1 2 248.326 2.034 20 0 BEADLO FC(F)(F)Cc1ccc2[nH+]ccn2c1 ZINC001250028949 967280988 /nfs/dbraw/zinc/28/09/88/967280988.db2.gz SGZKYVOSUJENLL-UHFFFAOYSA-N 1 2 200.163 2.439 20 0 BEADLO Nc1cccc(Nc2ccn3cc[nH+]c3c2)c1O ZINC001205005092 967285533 /nfs/dbraw/zinc/28/55/33/967285533.db2.gz CUVMDXQPWQMHLY-UHFFFAOYSA-N 1 2 240.266 2.366 20 0 BEADLO CC(C)OCCCNc1ccc(N(C)C)c[nH+]1 ZINC001168681280 967299890 /nfs/dbraw/zinc/29/98/90/967299890.db2.gz TWQKTHRFSZCUBV-UHFFFAOYSA-N 1 2 237.347 2.375 20 0 BEADLO CNc1cc(Cc2c(C)noc2C)cc[nH+]1 ZINC001250072685 967341100 /nfs/dbraw/zinc/34/11/00/967341100.db2.gz ZHNMZEMMHFBTOY-UHFFFAOYSA-N 1 2 217.272 2.319 20 0 BEADLO Cc1cccc(C[NH+]2CC(C)(N(C)C)C2)c1C ZINC001205089649 967342301 /nfs/dbraw/zinc/34/23/01/967342301.db2.gz VWRLOLBWNRKFDA-UHFFFAOYSA-N 1 2 232.371 2.439 20 0 BEADLO CO[C@H]1C[N@H+](Cc2ccc(F)c(C)c2)C[C@@H]1F ZINC001205161282 967404124 /nfs/dbraw/zinc/40/41/24/967404124.db2.gz FMMPRWOJYHUKEJ-STQMWFEESA-N 1 2 241.281 2.303 20 0 BEADLO Cc1ccc(C[N@@H+]2C[C@@H]3C[C@H]2CO3)cc1F ZINC001205236846 967432727 /nfs/dbraw/zinc/43/27/27/967432727.db2.gz WBUUYUGMMJEJLJ-RYUDHWBXSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1ccc(C[N@H+]2C[C@@H]3C[C@H]2CO3)cc1F ZINC001205236846 967432737 /nfs/dbraw/zinc/43/27/37/967432737.db2.gz WBUUYUGMMJEJLJ-RYUDHWBXSA-N 1 2 221.275 2.107 20 0 BEADLO CCOc1cc(C)ccc1C[N@H+](C)CC(C)=O ZINC001250171245 967473907 /nfs/dbraw/zinc/47/39/07/967473907.db2.gz KDOFFOZDIPRCAP-UHFFFAOYSA-N 1 2 235.327 2.415 20 0 BEADLO CCOc1cc(C)ccc1C[N@@H+](C)CC(C)=O ZINC001250171245 967473919 /nfs/dbraw/zinc/47/39/19/967473919.db2.gz KDOFFOZDIPRCAP-UHFFFAOYSA-N 1 2 235.327 2.415 20 0 BEADLO CN(C)c1ccc(Cc2ccncc2)c[nH+]1 ZINC001250312582 967666832 /nfs/dbraw/zinc/66/68/32/967666832.db2.gz JRXZEBZGWNZDGX-UHFFFAOYSA-N 1 2 213.284 2.133 20 0 BEADLO COc1cccc(OC)c1CCn1cc[nH+]c1 ZINC001250315457 967678185 /nfs/dbraw/zinc/67/81/85/967678185.db2.gz MMNPORNNTJFDPP-UHFFFAOYSA-N 1 2 232.283 2.143 20 0 BEADLO COc1cccc(CCn2cc[nH+]c2)c1OC ZINC001250315186 967681013 /nfs/dbraw/zinc/68/10/13/967681013.db2.gz GNJWVTMUBZQJFW-UHFFFAOYSA-N 1 2 232.283 2.143 20 0 BEADLO c1cn(CCc2c[nH]c3ncccc23)c[nH+]1 ZINC001250318332 967685526 /nfs/dbraw/zinc/68/55/26/967685526.db2.gz CLCVFBSBXDRDHV-UHFFFAOYSA-N 1 2 212.256 2.002 20 0 BEADLO CSc1ccc(CCn2cc[nH+]c2)cn1 ZINC001250316676 967691145 /nfs/dbraw/zinc/69/11/45/967691145.db2.gz SDIPKPXTCFWJIJ-UHFFFAOYSA-N 1 2 219.313 2.243 20 0 BEADLO COc1cc(C)ccc1CCn1cc[nH+]c1 ZINC001250319546 967693344 /nfs/dbraw/zinc/69/33/44/967693344.db2.gz UUYBHEYJKFSUFZ-UHFFFAOYSA-N 1 2 216.284 2.443 20 0 BEADLO C[C@H](O)c1cccc(CCn2cc[nH+]c2)c1 ZINC001250318919 967694202 /nfs/dbraw/zinc/69/42/02/967694202.db2.gz MGGQASHTJAVBBM-NSHDSACASA-N 1 2 216.284 2.179 20 0 BEADLO Nc1ccc(CCn2cc[nH+]c2)cc1Cl ZINC001250319508 967695438 /nfs/dbraw/zinc/69/54/38/967695438.db2.gz SOFUDLWBKJLWRY-UHFFFAOYSA-N 1 2 221.691 2.361 20 0 BEADLO c1cn(CCc2ccc3ncncc3c2)c[nH+]1 ZINC001250319405 967695465 /nfs/dbraw/zinc/69/54/65/967695465.db2.gz QTGZGFKXXNOUMI-UHFFFAOYSA-N 1 2 224.267 2.069 20 0 BEADLO Cc1ccc(O)c(CCn2cc[nH+]c2)c1 ZINC001250320036 967696652 /nfs/dbraw/zinc/69/66/52/967696652.db2.gz HMAYPSQPTIAQST-UHFFFAOYSA-N 1 2 202.257 2.140 20 0 BEADLO Cc1nn(C)c2cc(CCn3cc[nH+]c3)ccc12 ZINC001250320076 967697141 /nfs/dbraw/zinc/69/71/41/967697141.db2.gz XWNQNCFPYDSZEB-UHFFFAOYSA-N 1 2 240.310 2.321 20 0 BEADLO CC(=O)Oc1ccc(CCn2cc[nH+]c2)cc1 ZINC001250320066 967697929 /nfs/dbraw/zinc/69/79/29/967697929.db2.gz XHOTZLLQHJHVQL-UHFFFAOYSA-N 1 2 230.267 2.051 20 0 BEADLO Cc1cc(F)cc(C[N@@H+]2CCOCC23CC3)c1 ZINC001143618627 967699774 /nfs/dbraw/zinc/69/97/74/967699774.db2.gz BFDQWCMEIDZRHK-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1cc(F)cc(C[N@H+]2CCOCC23CC3)c1 ZINC001143618627 967699784 /nfs/dbraw/zinc/69/97/84/967699784.db2.gz BFDQWCMEIDZRHK-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO CN(C)c1cc(F)cc(CCn2cc[nH+]c2)c1 ZINC001250320980 967699964 /nfs/dbraw/zinc/69/99/64/967699964.db2.gz USPXCOUEQWPVBG-UHFFFAOYSA-N 1 2 233.290 2.331 20 0 BEADLO Clc1cccc2c1C[C@H]([N@@H+]1CCO[C@H]3C[C@H]31)C2 ZINC001168744441 967718013 /nfs/dbraw/zinc/71/80/13/967718013.db2.gz PTOXMWJMRGUEBV-HONMWMINSA-N 1 2 249.741 2.280 20 0 BEADLO Clc1cccc2c1C[C@H]([N@H+]1CCO[C@H]3C[C@H]31)C2 ZINC001168744441 967718019 /nfs/dbraw/zinc/71/80/19/967718019.db2.gz PTOXMWJMRGUEBV-HONMWMINSA-N 1 2 249.741 2.280 20 0 BEADLO CNc1ccc(Nc2c(N)ccnc2Cl)c[nH+]1 ZINC001203448770 967772840 /nfs/dbraw/zinc/77/28/40/967772840.db2.gz JJGUNABGFOZSAB-UHFFFAOYSA-N 1 2 249.705 2.498 20 0 BEADLO CNc1cc(Cc2cc(C)no2)cc[nH+]1 ZINC001250366706 967777431 /nfs/dbraw/zinc/77/74/31/967777431.db2.gz LBKSXTYVWFBEJQ-UHFFFAOYSA-N 1 2 203.245 2.011 20 0 BEADLO CNc1ccc(Nc2cncc(F)c2)c[nH+]1 ZINC001203448934 967782625 /nfs/dbraw/zinc/78/26/25/967782625.db2.gz RMRLNQHJFHRNKD-UHFFFAOYSA-N 1 2 218.235 2.401 20 0 BEADLO CSCCc1[nH]c2cc3c(cc2[nH+]1)OCC3 ZINC001250426514 967842170 /nfs/dbraw/zinc/84/21/70/967842170.db2.gz HTEWPGCSJZAXPB-UHFFFAOYSA-N 1 2 234.324 2.403 20 0 BEADLO Cc1cnccc1C[NH+]1CC2(C1)CCCCO2 ZINC001205835054 967845476 /nfs/dbraw/zinc/84/54/76/967845476.db2.gz HLPYCFKJHNXIPB-UHFFFAOYSA-N 1 2 232.327 2.145 20 0 BEADLO c1c2c(cc3[nH+]c(C4CCOCC4)[nH]c13)OCC2 ZINC001250433576 967851083 /nfs/dbraw/zinc/85/10/83/967851083.db2.gz QVEOZAKVCNRLOY-UHFFFAOYSA-N 1 2 244.294 2.392 20 0 BEADLO Cn1nccc1Cc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001250436080 967856142 /nfs/dbraw/zinc/85/61/42/967856142.db2.gz HUHLFBSPEQHTKK-UHFFFAOYSA-N 1 2 238.294 2.401 20 0 BEADLO Cc1ccnc(-c2ccn3cc[nH+]c3c2)n1 ZINC001250452459 967876144 /nfs/dbraw/zinc/87/61/44/967876144.db2.gz AFQIBWBZFDHOLQ-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO OCCCCC[N@@H+]1CC[C@@H](CF)C(F)(F)C1 ZINC001205895229 967876494 /nfs/dbraw/zinc/87/64/94/967876494.db2.gz BYBPBWCRDLPGBB-JTQLQIEISA-N 1 2 239.281 2.076 20 0 BEADLO OCCCCC[N@H+]1CC[C@@H](CF)C(F)(F)C1 ZINC001205895229 967876495 /nfs/dbraw/zinc/87/64/95/967876495.db2.gz BYBPBWCRDLPGBB-JTQLQIEISA-N 1 2 239.281 2.076 20 0 BEADLO Cc1cc[nH+]c(C)c1Nc1ccn(C)c(=O)c1 ZINC001206076518 968044413 /nfs/dbraw/zinc/04/44/13/968044413.db2.gz CIUNWIUQHZOXEA-UHFFFAOYSA-N 1 2 229.283 2.141 20 0 BEADLO Oc1ccc(-c2cc[nH+]c3c2CCN3)c(F)c1 ZINC001206087545 968055382 /nfs/dbraw/zinc/05/53/82/968055382.db2.gz DHBHNGKWWXJBQO-UHFFFAOYSA-N 1 2 230.242 2.204 20 0 BEADLO Cc1c2[nH+]c(CCn3cccn3)[nH]c2ccc1F ZINC001250563188 968074233 /nfs/dbraw/zinc/07/42/33/968074233.db2.gz WOLYXMBVLRXFBX-UHFFFAOYSA-N 1 2 244.273 2.450 20 0 BEADLO CSc1ccc2nc(C[NH+](C)C)[nH]c2c1 ZINC001250565459 968079667 /nfs/dbraw/zinc/07/96/67/968079667.db2.gz HQTSZOUBUQBFEL-UHFFFAOYSA-N 1 2 221.329 2.346 20 0 BEADLO CC(C)CC(=O)NCc1c[nH+]cn1C1CCC1 ZINC001142711717 968117729 /nfs/dbraw/zinc/11/77/29/968117729.db2.gz LWNGPKQFAIKNHA-UHFFFAOYSA-N 1 2 235.331 2.270 20 0 BEADLO Cc1ccc(-c2ccc3c(c2)CC(=O)N3)[nH+]c1N ZINC001206189340 968120890 /nfs/dbraw/zinc/12/08/90/968120890.db2.gz IKKFPINXIPKIPT-UHFFFAOYSA-N 1 2 239.278 2.134 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc2c(c1)CC(=O)N2 ZINC001206208788 968143798 /nfs/dbraw/zinc/14/37/98/968143798.db2.gz ODUJKGPQZKZSBB-YGQDEOHPSA-N 1 2 214.268 2.057 20 0 BEADLO Cc1cccc2[nH+]c(CCC3OCCO3)[nH]c21 ZINC001250607769 968156259 /nfs/dbraw/zinc/15/62/59/968156259.db2.gz AWPJXGQVFSQLAR-UHFFFAOYSA-N 1 2 232.283 2.177 20 0 BEADLO Cc1cccc2[nH]c(CCC3OCCO3)[nH+]c21 ZINC001250607769 968156265 /nfs/dbraw/zinc/15/62/65/968156265.db2.gz AWPJXGQVFSQLAR-UHFFFAOYSA-N 1 2 232.283 2.177 20 0 BEADLO COC(C)(C)Cc1[nH]c2cc3c(cc2[nH+]1)OCC3 ZINC001250613115 968161052 /nfs/dbraw/zinc/16/10/52/968161052.db2.gz ARJULGQBKIWCBF-UHFFFAOYSA-N 1 2 246.310 2.465 20 0 BEADLO C[C@@H]1C[C@H]1c1[nH]c2cc3c(cc2[nH+]1)OCO3 ZINC001250614140 968161078 /nfs/dbraw/zinc/16/10/78/968161078.db2.gz GMFJFORSBSOPSG-RNFRBKRXSA-N 1 2 216.240 2.415 20 0 BEADLO COc1cc[nH+]cc1Nc1ccccc1N ZINC001206315976 968221423 /nfs/dbraw/zinc/22/14/23/968221423.db2.gz YWPQFZXDBTVWAA-UHFFFAOYSA-N 1 2 215.256 2.416 20 0 BEADLO Cc1cn2c(cccc2Nc2ccc[nH]c2=O)[nH+]1 ZINC001206417112 968289969 /nfs/dbraw/zinc/28/99/69/968289969.db2.gz KEDYGIBQHQLLFI-UHFFFAOYSA-N 1 2 240.266 2.487 20 0 BEADLO O=c1[nH]cccc1Nc1cccn2cc[nH+]c12 ZINC001206431644 968297729 /nfs/dbraw/zinc/29/77/29/968297729.db2.gz RZRLOVHVJBIJNX-UHFFFAOYSA-N 1 2 226.239 2.179 20 0 BEADLO CCc1ccc(CN(C)c2cc(N)nc[nH+]2)cc1 ZINC001251645912 968300380 /nfs/dbraw/zinc/30/03/80/968300380.db2.gz RCSUSJNPJLXBJZ-UHFFFAOYSA-N 1 2 242.326 2.258 20 0 BEADLO COc1cnccc1C[N@@H+]1CCC[C@@](C)(F)C1 ZINC001206438195 968301916 /nfs/dbraw/zinc/30/19/16/968301916.db2.gz MBCJZAXZKDVMBB-CYBMUJFWSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cnccc1C[N@H+]1CCC[C@@](C)(F)C1 ZINC001206438195 968301925 /nfs/dbraw/zinc/30/19/25/968301925.db2.gz MBCJZAXZKDVMBB-CYBMUJFWSA-N 1 2 238.306 2.414 20 0 BEADLO Cn1c[nH+]cc1-c1cc2n[nH]cc2c(F)c1 ZINC001206571222 968395031 /nfs/dbraw/zinc/39/50/31/968395031.db2.gz AQBPNXWOZISLDX-UHFFFAOYSA-N 1 2 216.219 2.103 20 0 BEADLO COc1cc(C)c[nH+]c1N1CCC(=O)C(C)(C)C1 ZINC001166976682 968409925 /nfs/dbraw/zinc/40/99/25/968409925.db2.gz AVFVBPJPMQMVNV-UHFFFAOYSA-N 1 2 248.326 2.204 20 0 BEADLO COC1(C)C[NH+](CCCC(F)(F)F)C1 ZINC001119969610 968488478 /nfs/dbraw/zinc/48/84/78/968488478.db2.gz HAAGOHLYZKWBOH-UHFFFAOYSA-N 1 2 211.227 2.050 20 0 BEADLO CCCC[C@H](O)C[N@H+](C)CC(=O)c1ccccc1 ZINC001252092407 968511002 /nfs/dbraw/zinc/51/10/02/968511002.db2.gz ANLBIEOASXWDSV-AWEZNQCLSA-N 1 2 249.354 2.352 20 0 BEADLO CCCC[C@H](O)C[N@@H+](C)CC(=O)c1ccccc1 ZINC001252092407 968511010 /nfs/dbraw/zinc/51/10/10/968511010.db2.gz ANLBIEOASXWDSV-AWEZNQCLSA-N 1 2 249.354 2.352 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1ccc(F)cn1 ZINC001207037110 968568005 /nfs/dbraw/zinc/56/80/05/968568005.db2.gz OUEYTOUKQWFOPX-PSASIEDQSA-N 1 2 212.243 2.153 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1ccc(F)cn1 ZINC001207037110 968568010 /nfs/dbraw/zinc/56/80/10/968568010.db2.gz OUEYTOUKQWFOPX-PSASIEDQSA-N 1 2 212.243 2.153 20 0 BEADLO CCCC[C@H](O)C[N@H+](C)Cc1cscn1 ZINC001252094524 968570981 /nfs/dbraw/zinc/57/09/81/968570981.db2.gz PHSSZZCTVPDISS-NSHDSACASA-N 1 2 228.361 2.126 20 0 BEADLO CCCC[C@H](O)C[N@@H+](C)Cc1cscn1 ZINC001252094524 968570991 /nfs/dbraw/zinc/57/09/91/968570991.db2.gz PHSSZZCTVPDISS-NSHDSACASA-N 1 2 228.361 2.126 20 0 BEADLO CC(=O)[C@@H]1CCC[N@@H+]1Cc1cnc(C)s1 ZINC001207063722 968590812 /nfs/dbraw/zinc/59/08/12/968590812.db2.gz ACRBVACSUCWTQT-NSHDSACASA-N 1 2 224.329 2.005 20 0 BEADLO CC(=O)[C@@H]1CCC[N@H+]1Cc1cnc(C)s1 ZINC001207063722 968590820 /nfs/dbraw/zinc/59/08/20/968590820.db2.gz ACRBVACSUCWTQT-NSHDSACASA-N 1 2 224.329 2.005 20 0 BEADLO Fc1ccc(-c2nnc(Cn3cc[nH+]c3)o2)cc1 ZINC001252163486 968611951 /nfs/dbraw/zinc/61/19/51/968611951.db2.gz NXRYRKQKMPKYSH-UHFFFAOYSA-N 1 2 244.229 2.121 20 0 BEADLO CC(C)(O)CNc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001252360615 968640247 /nfs/dbraw/zinc/64/02/47/968640247.db2.gz PFOLEXLCBFUWNO-UHFFFAOYSA-N 1 2 231.299 2.260 20 0 BEADLO O=c1cc(C[N@@H+]2Cc3cccc(F)c3C2)cc[nH]1 ZINC001207124051 968644256 /nfs/dbraw/zinc/64/42/56/968644256.db2.gz JFIMEQXWQBKOFP-UHFFFAOYSA-N 1 2 244.269 2.442 20 0 BEADLO O=c1cc(C[N@H+]2Cc3cccc(F)c3C2)cc[nH]1 ZINC001207124051 968644264 /nfs/dbraw/zinc/64/42/64/968644264.db2.gz JFIMEQXWQBKOFP-UHFFFAOYSA-N 1 2 244.269 2.442 20 0 BEADLO CC[C@@]12C[C@@H](CO1)[N@H+](Cc1c(C)noc1C)C2 ZINC001207139444 968651168 /nfs/dbraw/zinc/65/11/68/968651168.db2.gz GNBTUVUFNHNKCI-AAEUAGOBSA-N 1 2 236.315 2.045 20 0 BEADLO CC[C@@]12C[C@@H](CO1)[N@@H+](Cc1c(C)noc1C)C2 ZINC001207139444 968651171 /nfs/dbraw/zinc/65/11/71/968651171.db2.gz GNBTUVUFNHNKCI-AAEUAGOBSA-N 1 2 236.315 2.045 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCc2occc2C1 ZINC001207139503 968653857 /nfs/dbraw/zinc/65/38/57/968653857.db2.gz HWTSUUKMBNDRCV-UHFFFAOYSA-N 1 2 232.283 2.443 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCc2occc2C1 ZINC001207139503 968653860 /nfs/dbraw/zinc/65/38/60/968653860.db2.gz HWTSUUKMBNDRCV-UHFFFAOYSA-N 1 2 232.283 2.443 20 0 BEADLO CCn1ccnc1C[N@H+]1CCC[C@@H](C(F)F)C1 ZINC001207145737 968656060 /nfs/dbraw/zinc/65/60/60/968656060.db2.gz RYMLSQFBWCQIHZ-SNVBAGLBSA-N 1 2 243.301 2.380 20 0 BEADLO CCn1ccnc1C[N@@H+]1CCC[C@@H](C(F)F)C1 ZINC001207145737 968656058 /nfs/dbraw/zinc/65/60/58/968656058.db2.gz RYMLSQFBWCQIHZ-SNVBAGLBSA-N 1 2 243.301 2.380 20 0 BEADLO Cc1cncc(C[N@@H+]2CCC(=O)C(C)(C)C2)c1 ZINC001207160704 968671608 /nfs/dbraw/zinc/67/16/08/968671608.db2.gz INEBMURRMZJVOG-UHFFFAOYSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1cncc(C[N@H+]2CCC(=O)C(C)(C)C2)c1 ZINC001207160704 968671612 /nfs/dbraw/zinc/67/16/12/968671612.db2.gz INEBMURRMZJVOG-UHFFFAOYSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1nc(Cl)c(CC[NH+]2CCC2)c(Cl)n1 ZINC001207333571 968727511 /nfs/dbraw/zinc/72/75/11/968727511.db2.gz IAPIXTJIPFZTGO-UHFFFAOYSA-N 1 2 246.141 2.340 20 0 BEADLO C=Cc1ccc(OC)cc1C[NH+]1CCOCC1 ZINC001240833504 968734311 /nfs/dbraw/zinc/73/43/11/968734311.db2.gz IMTMVNNKSJTQHR-UHFFFAOYSA-N 1 2 233.311 2.170 20 0 BEADLO CCOC1C[NH+](CCc2ccccc2F)C1 ZINC001207497827 968806603 /nfs/dbraw/zinc/80/66/03/968806603.db2.gz VFUKSWGKJYKZAM-UHFFFAOYSA-N 1 2 223.291 2.089 20 0 BEADLO Cn1cnc2cc(-c3cc[nH+]c(N)c3)ccc21 ZINC001241161977 968941675 /nfs/dbraw/zinc/94/16/75/968941675.db2.gz DCOKDDWGTAVKQU-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO Nc1cc(-c2ccc3oncc3c2)cc[nH+]1 ZINC001241161980 968942009 /nfs/dbraw/zinc/94/20/09/968942009.db2.gz DGIAHYSMICXZLS-UHFFFAOYSA-N 1 2 211.224 2.472 20 0 BEADLO COC(=O)c1ccc(-c2cc[nH+]c(N)c2)cc1F ZINC001241164182 968944856 /nfs/dbraw/zinc/94/48/56/968944856.db2.gz XKPTVLLQYGOVHI-UHFFFAOYSA-N 1 2 246.241 2.257 20 0 BEADLO CCCC[C@@H](C(=O)OC)[NH+]1CCC(F)(F)CC1 ZINC000405063431 968949121 /nfs/dbraw/zinc/94/91/21/968949121.db2.gz QIELGRJCBMROSR-JTQLQIEISA-N 1 2 249.301 2.449 20 0 BEADLO CCC[C@H](O)C[N@@H+]1CCC[C@H](F)C(F)(F)C1 ZINC001252779418 968950891 /nfs/dbraw/zinc/95/08/91/968950891.db2.gz QEOJHMGECKHNSO-UWVGGRQHSA-N 1 2 239.281 2.217 20 0 BEADLO CCC[C@H](O)C[N@H+]1CCC[C@H](F)C(F)(F)C1 ZINC001252779418 968950899 /nfs/dbraw/zinc/95/08/99/968950899.db2.gz QEOJHMGECKHNSO-UWVGGRQHSA-N 1 2 239.281 2.217 20 0 BEADLO Cn1ccc2c[nH+]c(-c3cccc(CO)c3)nc21 ZINC001241505993 969020140 /nfs/dbraw/zinc/02/01/40/969020140.db2.gz FBBANJGGXMTDRR-UHFFFAOYSA-N 1 2 239.278 2.128 20 0 BEADLO CC(C)OC1C[NH+](CCc2cccc(F)c2)C1 ZINC001208202704 969126483 /nfs/dbraw/zinc/12/64/83/969126483.db2.gz YMJCLGGQLSYWJW-UHFFFAOYSA-N 1 2 237.318 2.477 20 0 BEADLO COc1cc(C)[nH+]c(CSCC(C)(C)O)c1 ZINC001323441458 1169931883 /nfs/dbraw/zinc/93/18/83/1169931883.db2.gz QPUGTFZFLJBTSM-UHFFFAOYSA-N 1 2 241.356 2.403 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1ccc(=O)[nH]c1 ZINC001242062997 969193072 /nfs/dbraw/zinc/19/30/72/969193072.db2.gz FFNAMWVXDIIROX-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO Cc1ccnc(-c2c[nH+]c(N)cc2C)c1F ZINC001242072778 969197243 /nfs/dbraw/zinc/19/72/43/969197243.db2.gz PUMLEKUTNGXDMS-UHFFFAOYSA-N 1 2 217.247 2.482 20 0 BEADLO CCCCC[C@H](O)CNc1[nH+]c[nH]c1C ZINC001253531903 969203844 /nfs/dbraw/zinc/20/38/44/969203844.db2.gz TUZOLSBFQZIAMY-JTQLQIEISA-N 1 2 211.309 2.071 20 0 BEADLO CC(=O)N1CCC[C@@H](CNc2ccc[nH+]c2C)C1 ZINC001168781606 969205160 /nfs/dbraw/zinc/20/51/60/969205160.db2.gz NHKPAWBIYKOGPX-ZDUSSCGKSA-N 1 2 247.342 2.060 20 0 BEADLO CC(C)CCC[N@@H+]1C[C@H](CO)CC(F)(F)C1 ZINC001208735044 969221503 /nfs/dbraw/zinc/22/15/03/969221503.db2.gz RIPWXQBJJZKBOS-LLVKDONJSA-N 1 2 235.318 2.372 20 0 BEADLO CC(C)CCC[N@H+]1C[C@H](CO)CC(F)(F)C1 ZINC001208735044 969221513 /nfs/dbraw/zinc/22/15/13/969221513.db2.gz RIPWXQBJJZKBOS-LLVKDONJSA-N 1 2 235.318 2.372 20 0 BEADLO CC(C)c1cc(CNc2cc[nH+]cc2F)on1 ZINC001168827974 969229217 /nfs/dbraw/zinc/22/92/17/969229217.db2.gz UVLKSMWYUCTAQJ-UHFFFAOYSA-N 1 2 235.262 2.366 20 0 BEADLO COCCC[N@@H+]1CCC[C@H](F)C(F)(F)C1 ZINC001209048733 969336325 /nfs/dbraw/zinc/33/63/25/969336325.db2.gz PRYUPOCVKFLSGL-VIFPVBQESA-N 1 2 225.254 2.092 20 0 BEADLO COCCC[N@H+]1CCC[C@H](F)C(F)(F)C1 ZINC001209048733 969336332 /nfs/dbraw/zinc/33/63/32/969336332.db2.gz PRYUPOCVKFLSGL-VIFPVBQESA-N 1 2 225.254 2.092 20 0 BEADLO CC(C)[C@H](O)CNc1ccccc1-n1cc[nH+]c1 ZINC001253752147 969370300 /nfs/dbraw/zinc/37/03/00/969370300.db2.gz IBSRZFMCSJMYJI-CQSZACIVSA-N 1 2 245.326 2.301 20 0 BEADLO C[N@@H+]1CCCC[C@H]1c1nnc(C2CC2)o1 ZINC001254073085 969476270 /nfs/dbraw/zinc/47/62/70/969476270.db2.gz RWLIHHBVFVVMCD-VIFPVBQESA-N 1 2 207.277 2.104 20 0 BEADLO C[N@H+]1CCCC[C@H]1c1nnc(C2CC2)o1 ZINC001254073085 969476280 /nfs/dbraw/zinc/47/62/80/969476280.db2.gz RWLIHHBVFVVMCD-VIFPVBQESA-N 1 2 207.277 2.104 20 0 BEADLO CO[C@H](C)C1C[NH+](Cc2cnc(Cl)s2)C1 ZINC001209471617 969522113 /nfs/dbraw/zinc/52/21/13/969522113.db2.gz CTAALHOHKHNLSA-SSDOTTSWSA-N 1 2 246.763 2.263 20 0 BEADLO CO[C@@H](C)C1C[NH+](Cc2cnc(Cl)s2)C1 ZINC001209471618 969522480 /nfs/dbraw/zinc/52/24/80/969522480.db2.gz CTAALHOHKHNLSA-ZETCQYMHSA-N 1 2 246.763 2.263 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC[C@@H]2CCC[C@H]2C1 ZINC001209551849 969536536 /nfs/dbraw/zinc/53/65/36/969536536.db2.gz CETSMPNPCFCORN-RYUDHWBXSA-N 1 2 219.332 2.340 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC[C@@H]2CCC[C@H]2C1 ZINC001209551849 969536539 /nfs/dbraw/zinc/53/65/39/969536539.db2.gz CETSMPNPCFCORN-RYUDHWBXSA-N 1 2 219.332 2.340 20 0 BEADLO c1ncc(C[N@@H+]2CCc3ccncc3C2)s1 ZINC001209550187 969539918 /nfs/dbraw/zinc/53/99/18/969539918.db2.gz QIKNVRKHQCSPFS-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1ncc(C[N@H+]2CCc3ccncc3C2)s1 ZINC001209550187 969539927 /nfs/dbraw/zinc/53/99/27/969539927.db2.gz QIKNVRKHQCSPFS-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO Cc1cc(Cl)ncc1C[N@@H+](C)C1(C)COC1 ZINC001209636700 969568307 /nfs/dbraw/zinc/56/83/07/969568307.db2.gz ZQZOOVVXMHSDTB-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO Cc1cc(Cl)ncc1C[N@H+](C)C1(C)COC1 ZINC001209636700 969568312 /nfs/dbraw/zinc/56/83/12/969568312.db2.gz ZQZOOVVXMHSDTB-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO COC1C[NH+](Cc2c[nH]c3cc(F)ccc23)C1 ZINC001209690722 969575077 /nfs/dbraw/zinc/57/50/77/969575077.db2.gz YDEJEDZQGGEDPM-UHFFFAOYSA-N 1 2 234.274 2.138 20 0 BEADLO FC1(F)CCCC[N@@H+]([C@H]2CCCOC2)C1 ZINC001254376654 969592762 /nfs/dbraw/zinc/59/27/62/969592762.db2.gz WVIFCDRWCUDNJO-JTQLQIEISA-N 1 2 219.275 2.287 20 0 BEADLO FC1(F)CCCC[N@H+]([C@H]2CCCOC2)C1 ZINC001254376654 969592768 /nfs/dbraw/zinc/59/27/68/969592768.db2.gz WVIFCDRWCUDNJO-JTQLQIEISA-N 1 2 219.275 2.287 20 0 BEADLO Nc1cc(Cl)[nH+]c(NCCn2cccc2)c1 ZINC001156299724 969615861 /nfs/dbraw/zinc/61/58/61/969615861.db2.gz IHLLTDSNBYPZJC-UHFFFAOYSA-N 1 2 236.706 2.231 20 0 BEADLO Cc1cnc(Nc2ccc3[nH]c[nH+]c3c2)cn1 ZINC001209841015 969650269 /nfs/dbraw/zinc/65/02/69/969650269.db2.gz AVHBJNSYUGGMFX-UHFFFAOYSA-N 1 2 225.255 2.405 20 0 BEADLO C[NH+](C)Cc1nnc([C@H]2C[C@@H]2c2ccccc2)o1 ZINC001254501732 969665076 /nfs/dbraw/zinc/66/50/76/969665076.db2.gz FKXWFAJPZUIMPS-NEPJUHHUSA-N 1 2 243.310 2.402 20 0 BEADLO C[C@@H](Nc1ccn2cc[nH+]c2c1)c1cnccn1 ZINC001169529769 969711335 /nfs/dbraw/zinc/71/13/35/969711335.db2.gz PLVXDYWIVFWYON-SNVBAGLBSA-N 1 2 239.282 2.297 20 0 BEADLO COCc1cc[nH+]c(NC[C@@H]2CCCCO2)c1 ZINC001156370872 969837836 /nfs/dbraw/zinc/83/78/36/969837836.db2.gz AQIYXFZAHPEWDJ-LBPRGKRZSA-N 1 2 236.315 2.209 20 0 BEADLO Cn1ncc(Nc2cccc3cc[nH+]cc32)n1 ZINC001210224040 969839356 /nfs/dbraw/zinc/83/93/56/969839356.db2.gz BNMCSPDIBXNDSS-UHFFFAOYSA-N 1 2 225.255 2.107 20 0 BEADLO FC1(F)C[C@H]1[NH2+]C1Cc2ccccc2C1 ZINC001255010963 969844550 /nfs/dbraw/zinc/84/45/50/969844550.db2.gz VGVSIAMTSULAEW-LLVKDONJSA-N 1 2 209.239 2.151 20 0 BEADLO CO[C@@H](C)CNc1[nH+]cccc1[Si](C)(C)C ZINC001169772079 969844613 /nfs/dbraw/zinc/84/46/13/969844613.db2.gz FGGBKZQIRDBGJT-JTQLQIEISA-N 1 2 238.407 2.074 20 0 BEADLO Cc1[nH+]cc(Nc2ccnc(F)c2)cc1N ZINC001210286703 969845481 /nfs/dbraw/zinc/84/54/81/969845481.db2.gz DUVCODZLCISXMV-UHFFFAOYSA-N 1 2 218.235 2.250 20 0 BEADLO Cc1[nH+]cc(Nc2nnc(C(C)C)o2)cc1N ZINC001210285283 969852324 /nfs/dbraw/zinc/85/23/24/969852324.db2.gz NAPUVLZYPPSQOC-UHFFFAOYSA-N 1 2 233.275 2.222 20 0 BEADLO Cc1[nH+]cc(Nc2ncc(F)cc2F)cc1N ZINC001210287638 969853118 /nfs/dbraw/zinc/85/31/18/969853118.db2.gz YOVAEPPNIRKHIR-UHFFFAOYSA-N 1 2 236.225 2.389 20 0 BEADLO Cc1ccc(O)c(Nc2c[nH+]c(C)c(N)c2)n1 ZINC001210287220 969854125 /nfs/dbraw/zinc/85/41/25/969854125.db2.gz OUSQHAJTOYDSIN-UHFFFAOYSA-N 1 2 230.271 2.125 20 0 BEADLO CC(=O)c1ccncc1Nc1c[nH+]c(C)c(N)c1 ZINC001210287245 969855215 /nfs/dbraw/zinc/85/52/15/969855215.db2.gz PJWSCVSKKLKHGZ-UHFFFAOYSA-N 1 2 242.282 2.313 20 0 BEADLO Cc1[nH+]cc(-n2ccc3c2cccc3N)cc1N ZINC001210290372 969859901 /nfs/dbraw/zinc/85/99/01/969859901.db2.gz KRISIXSRWVFLGQ-UHFFFAOYSA-N 1 2 238.294 2.498 20 0 BEADLO CN(C)c1ccc(NCCc2cncs2)[nH+]c1 ZINC001169867521 969878002 /nfs/dbraw/zinc/87/80/02/969878002.db2.gz SSEOGIBLKFVOOE-UHFFFAOYSA-N 1 2 248.355 2.259 20 0 BEADLO Nc1cncc(Nc2cccc3[nH+]ccn32)c1 ZINC001210435337 969885547 /nfs/dbraw/zinc/88/55/47/969885547.db2.gz DZPQAHUOPFEJTF-UHFFFAOYSA-N 1 2 225.255 2.055 20 0 BEADLO Nc1ccc[nH+]c1Nc1ccc2ncncc2c1 ZINC001210454289 969892317 /nfs/dbraw/zinc/89/23/17/969892317.db2.gz QTSBBBYXFLKRCZ-UHFFFAOYSA-N 1 2 237.266 2.351 20 0 BEADLO Cc1cc(Cl)c(C)c(NC2CC(=O)C2)[nH+]1 ZINC001156616418 969946930 /nfs/dbraw/zinc/94/69/30/969946930.db2.gz HWQJKHCWHUGCNH-UHFFFAOYSA-N 1 2 224.691 2.495 20 0 BEADLO O=c1[nH]cc(Nc2cccn3cc[nH+]c23)cc1F ZINC001210598848 969974704 /nfs/dbraw/zinc/97/47/04/969974704.db2.gz KXTOFOSNQSNVOL-UHFFFAOYSA-N 1 2 244.229 2.318 20 0 BEADLO Nc1cc(CNc2ccc(Cl)cn2)cc[nH+]1 ZINC001156756219 969993945 /nfs/dbraw/zinc/99/39/45/969993945.db2.gz SXWNPUTXLCDJAK-UHFFFAOYSA-N 1 2 234.690 2.324 20 0 BEADLO CC(=O)c1cc(C(C)=CC=C[NH3+])ccn1 ZINC001242610503 970016166 /nfs/dbraw/zinc/01/61/66/970016166.db2.gz QCQUECZVGYFFAG-PLPQCDBPSA-N 1 2 202.257 2.160 20 0 BEADLO Cc1nc(NCCC(=O)c2ccccc2)cc[nH+]1 ZINC001170018984 970022215 /nfs/dbraw/zinc/02/22/15/970022215.db2.gz CSGILPLDBSLNEL-UHFFFAOYSA-N 1 2 241.294 2.470 20 0 BEADLO COc1cc(Nc2ncccc2CO)cc(C)[nH+]1 ZINC001210773969 970023223 /nfs/dbraw/zinc/02/32/23/970023223.db2.gz GZFYZMABWPEMJO-UHFFFAOYSA-N 1 2 245.282 2.030 20 0 BEADLO Cc1ccsc1CN1CC[NH2+]CC(F)(F)C1 ZINC001210815663 970048115 /nfs/dbraw/zinc/04/81/15/970048115.db2.gz YFCAARAYLWVMSS-UHFFFAOYSA-N 1 2 246.326 2.097 20 0 BEADLO CNc1ncccc1C[N@H+](C)Cc1ccccn1 ZINC000052720980 970057296 /nfs/dbraw/zinc/05/72/96/970057296.db2.gz JYUMGSGAOGMXDW-UHFFFAOYSA-N 1 2 242.326 2.150 20 0 BEADLO CNc1ncccc1C[N@@H+](C)Cc1ccccn1 ZINC000052720980 970057305 /nfs/dbraw/zinc/05/73/05/970057305.db2.gz JYUMGSGAOGMXDW-UHFFFAOYSA-N 1 2 242.326 2.150 20 0 BEADLO CC1(C)CCC(N2CC[NH2+]CC(F)(F)C2)CC1 ZINC001255302866 970066793 /nfs/dbraw/zinc/06/67/93/970066793.db2.gz LOHRPPACGMMTPT-UHFFFAOYSA-N 1 2 246.345 2.496 20 0 BEADLO CCCC[C@H](C)[NH2+]C1(C(=O)OCC)CC1 ZINC001255312278 970081346 /nfs/dbraw/zinc/08/13/46/970081346.db2.gz OCZMECLCWIOSNO-JTQLQIEISA-N 1 2 213.321 2.250 20 0 BEADLO CCCC[C@H](C)[NH2+]CC(=O)OCCC ZINC001255320905 970092851 /nfs/dbraw/zinc/09/28/51/970092851.db2.gz UYEKXAMRVYDEDK-JTQLQIEISA-N 1 2 201.310 2.108 20 0 BEADLO CC(=O)Nc1cc(Nc2ccc(C)cn2)cc[nH+]1 ZINC001211009406 970109902 /nfs/dbraw/zinc/10/99/02/970109902.db2.gz AWYZOGWGGLSTGZ-UHFFFAOYSA-N 1 2 242.282 2.487 20 0 BEADLO c1cn(-c2cccc(Nc3ccncn3)c2)c[nH+]1 ZINC001211029028 970122789 /nfs/dbraw/zinc/12/27/89/970122789.db2.gz PCYGJXMGFVCQGL-UHFFFAOYSA-N 1 2 237.266 2.406 20 0 BEADLO c1cn(-c2ccc(Nc3ccncn3)cc2)c[nH+]1 ZINC001211028865 970124315 /nfs/dbraw/zinc/12/43/15/970124315.db2.gz IAQJWXXXDZAXTR-UHFFFAOYSA-N 1 2 237.266 2.406 20 0 BEADLO CCOC(=O)Cc1cc[nH+]c(N[C@@H](C)CC)c1 ZINC001157236993 970163794 /nfs/dbraw/zinc/16/37/94/970163794.db2.gz CDVVCTKQRXHOPP-JTQLQIEISA-N 1 2 236.315 2.398 20 0 BEADLO N=C1C=CC(F)=C(N)[N@H+]1c1cc2ccccc2[nH]1 ZINC001211306015 970231475 /nfs/dbraw/zinc/23/14/75/970231475.db2.gz SGBMDPOWKYARRT-UHFFFAOYSA-N 1 2 242.257 2.159 20 0 BEADLO N=C1C=CC(F)=C(N)[N@@H+]1c1cc2ccccc2[nH]1 ZINC001211306015 970231484 /nfs/dbraw/zinc/23/14/84/970231484.db2.gz SGBMDPOWKYARRT-UHFFFAOYSA-N 1 2 242.257 2.159 20 0 BEADLO COC(=O)Nc1cccc(-c2c[nH+]cn2C)c1 ZINC001243068021 970255988 /nfs/dbraw/zinc/25/59/88/970255988.db2.gz SADUOKBIOXZBAY-UHFFFAOYSA-N 1 2 231.255 2.265 20 0 BEADLO Cn1c[nH+]cc1-c1cccc2c1NC(=O)C21CC1 ZINC001243066790 970257391 /nfs/dbraw/zinc/25/73/91/970257391.db2.gz AUVIJGDODRMXRV-UHFFFAOYSA-N 1 2 239.278 2.071 20 0 BEADLO Cc1nc(-c2ccc(-c3c[nH+]cn3C)cc2)no1 ZINC001243068863 970262169 /nfs/dbraw/zinc/26/21/69/970262169.db2.gz JLKHMQILSZRCTL-UHFFFAOYSA-N 1 2 240.266 2.446 20 0 BEADLO Cc1cc(N(C)C)ccc1-c1c[nH+]cn1C ZINC001243071149 970277778 /nfs/dbraw/zinc/27/77/78/970277778.db2.gz NYOLXDPQMAEUFZ-UHFFFAOYSA-N 1 2 215.300 2.462 20 0 BEADLO COc1nccc(Nc2c[nH+]c(C)cc2C)n1 ZINC001213503353 970333192 /nfs/dbraw/zinc/33/31/92/970333192.db2.gz AUAMTIGCHKIGEL-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO Cc1cc(C)c(Nc2ccn3cnnc3c2)c[nH+]1 ZINC001213508210 970335403 /nfs/dbraw/zinc/33/54/03/970335403.db2.gz NKKXOVGQVRCPOT-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO COc1nccc(Nc2c[nH+]cc(C)c2C)n1 ZINC001213522506 970337611 /nfs/dbraw/zinc/33/76/11/970337611.db2.gz AWXBFWNXTFHWCE-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO Cc1c[nH+]cc(Nc2cncnc2)c1C ZINC001213523272 970349194 /nfs/dbraw/zinc/34/91/94/970349194.db2.gz OVEYDPICEZVUJS-UHFFFAOYSA-N 1 2 200.245 2.232 20 0 BEADLO CC(=O)c1nn(C)cc1Nc1c[nH+]cc(C)c1C ZINC001213527257 970349524 /nfs/dbraw/zinc/34/95/24/970349524.db2.gz FEXZSEYZNARIEW-UHFFFAOYSA-N 1 2 244.298 2.378 20 0 BEADLO Cc1ccc(Nc2[nH+]cccc2CCO)c(N)c1 ZINC001214184409 970456250 /nfs/dbraw/zinc/45/62/50/970456250.db2.gz CUHVYONZAGUKGJ-UHFFFAOYSA-N 1 2 243.310 2.251 20 0 BEADLO COC(=O)C(C)(C)[NH2+][C@H](C)Cc1ccc(C)cc1 ZINC001255772445 970475516 /nfs/dbraw/zinc/47/55/16/970475516.db2.gz HNKBOSLIJQRNIT-GFCCVEGCSA-N 1 2 249.354 2.467 20 0 BEADLO C[C@H](Cc1ccccc1Cl)[NH+]1CC(C)(O)C1 ZINC001170266446 970646922 /nfs/dbraw/zinc/64/69/22/970646922.db2.gz OSBWGXYEADTGBO-SNVBAGLBSA-N 1 2 239.746 2.338 20 0 BEADLO CC1(CO)CC[NH+](C/C(Cl)=C\Cl)CC1 ZINC000401811633 970734096 /nfs/dbraw/zinc/73/40/96/970734096.db2.gz UOBARYUBJQJMJB-RMKNXTFCSA-N 1 2 238.158 2.400 20 0 BEADLO C[NH+](C)Cc1nnc(CC2(C(F)(F)F)CC2)o1 ZINC001327351790 972557351 /nfs/dbraw/zinc/55/73/51/972557351.db2.gz CEOMBUGVDBPROW-UHFFFAOYSA-N 1 2 249.236 2.016 20 0 BEADLO Cc1ccc([C@@H](C)OCc2c[nH+]cn2C)cn1 ZINC001222595034 972593138 /nfs/dbraw/zinc/59/31/38/972593138.db2.gz MERPRHGTYLOICH-LLVKDONJSA-N 1 2 231.299 2.401 20 0 BEADLO C[C@H](COCc1c[nH+]cn1C)Oc1ccccc1 ZINC001222601122 972597257 /nfs/dbraw/zinc/59/72/57/972597257.db2.gz YEVWWPWDEKSDIX-GFCCVEGCSA-N 1 2 246.310 2.404 20 0 BEADLO Cn1c[nH+]cc1CO[C@@H]1CCCC[C@@H]1F ZINC001222600180 972598586 /nfs/dbraw/zinc/59/85/86/972598586.db2.gz MTVZCPHQBSIWAB-WDEREUQCSA-N 1 2 212.268 2.217 20 0 BEADLO C[C@@H]1c2cnccc2C[C@@H]1OCc1c[nH+]cn1C ZINC001222600965 972600496 /nfs/dbraw/zinc/60/04/96/972600496.db2.gz WVBNJVQUEALZHO-YGRLFVJLSA-N 1 2 243.310 2.060 20 0 BEADLO CC(C)(C)CC(C)(C)[NH2+]Cc1ncn[nH]1 ZINC001327512417 972606771 /nfs/dbraw/zinc/60/67/71/972606771.db2.gz OLFPPKRJKBRQFK-UHFFFAOYSA-N 1 2 210.325 2.109 20 0 BEADLO COc1ccc(O)cc1-c1ccc[nH+]c1N ZINC001222625196 972608673 /nfs/dbraw/zinc/60/86/73/972608673.db2.gz SYPDQCFVPGLGHV-UHFFFAOYSA-N 1 2 216.240 2.045 20 0 BEADLO COc1ccc(O)cc1-c1cc[nH+]c2c1CCN2 ZINC001222653941 972621132 /nfs/dbraw/zinc/62/11/32/972621132.db2.gz BJJYYPVFWRTJPL-UHFFFAOYSA-N 1 2 242.278 2.431 20 0 BEADLO C[C@H]1CC(=O)CC[N@@H+]1Cc1ccc2cc[nH]c2n1 ZINC001144169098 972667695 /nfs/dbraw/zinc/66/76/95/972667695.db2.gz WOAOESCDVDKKRU-JTQLQIEISA-N 1 2 243.310 2.116 20 0 BEADLO C[C@H]1CC(=O)CC[N@H+]1Cc1ccc2cc[nH]c2n1 ZINC001144169098 972667698 /nfs/dbraw/zinc/66/76/98/972667698.db2.gz WOAOESCDVDKKRU-JTQLQIEISA-N 1 2 243.310 2.116 20 0 BEADLO CC(C)[N@H+](CCc1ccccc1)Cc1nnc[nH]1 ZINC001327866548 972768084 /nfs/dbraw/zinc/76/80/84/972768084.db2.gz ZSBJVDDOUKDOLK-UHFFFAOYSA-N 1 2 244.342 2.258 20 0 BEADLO CC(C)[N@@H+](CCc1ccccc1)Cc1nnc[nH]1 ZINC001327866548 972768092 /nfs/dbraw/zinc/76/80/92/972768092.db2.gz ZSBJVDDOUKDOLK-UHFFFAOYSA-N 1 2 244.342 2.258 20 0 BEADLO C[C@@H]1CCC[C@@H]1Cc1nnc(C[NH+](C)C)o1 ZINC001327865208 972768809 /nfs/dbraw/zinc/76/88/09/972768809.db2.gz MHBJXHZGCPKSFU-NXEZZACHSA-N 1 2 223.320 2.110 20 0 BEADLO CC1C[NH+](Cc2cc(F)c(O)cc2F)C1 ZINC001144646582 972903635 /nfs/dbraw/zinc/90/36/35/972903635.db2.gz CEZYFBXLEQRFMX-UHFFFAOYSA-N 1 2 213.227 2.122 20 0 BEADLO CCc1cccc(N(C)C(=O)Cc2[nH]cc[nH+]2)c1 ZINC001328408011 973030280 /nfs/dbraw/zinc/03/02/80/973030280.db2.gz UVBBXWAMIBKVNC-UHFFFAOYSA-N 1 2 243.310 2.178 20 0 BEADLO C[NH+]1CC(O[C@H]2CCc3ccccc32)C1 ZINC001223415581 973047265 /nfs/dbraw/zinc/04/72/65/973047265.db2.gz HWQSVRCIGNRXCB-ZDUSSCGKSA-N 1 2 203.285 2.005 20 0 BEADLO C[C@@H]1CC[C@@H](Cc2nnc(C[NH+](C)C)o2)C1 ZINC001328433436 973056215 /nfs/dbraw/zinc/05/62/15/973056215.db2.gz MNXDNSICQWMKDJ-NXEZZACHSA-N 1 2 223.320 2.110 20 0 BEADLO c1ccc(C[N@@H+]2CCc3cccnc3C2)nc1 ZINC001204062085 973125274 /nfs/dbraw/zinc/12/52/74/973125274.db2.gz FHMNFQQVAAWNAM-UHFFFAOYSA-N 1 2 225.295 2.035 20 0 BEADLO c1ccc(C[N@H+]2CCc3cccnc3C2)nc1 ZINC001204062085 973125296 /nfs/dbraw/zinc/12/52/96/973125296.db2.gz FHMNFQQVAAWNAM-UHFFFAOYSA-N 1 2 225.295 2.035 20 0 BEADLO O=C(NCCOc1cc[nH+]cc1)C1=CCCCC1 ZINC001146727470 973237702 /nfs/dbraw/zinc/23/77/02/973237702.db2.gz VPDUDMZXIXAGLJ-UHFFFAOYSA-N 1 2 246.310 2.077 20 0 BEADLO O[C@@H]1CN(c2[nH+]ccc3ccccc32)CC12CC2 ZINC001329174532 973542780 /nfs/dbraw/zinc/54/27/80/973542780.db2.gz GBPHJCBWZUOPIL-CYBMUJFWSA-N 1 2 240.306 2.196 20 0 BEADLO C[C@H](C(=O)N(C)CCC(C)(C)C)n1cc[nH+]c1 ZINC001329547829 973823093 /nfs/dbraw/zinc/82/30/93/973823093.db2.gz OFPZZLHQWMBBHE-LLVKDONJSA-N 1 2 237.347 2.339 20 0 BEADLO CC(C)(C)c1cn(CCn2ccccc2=O)c[nH+]1 ZINC001329724445 973899307 /nfs/dbraw/zinc/89/93/07/973899307.db2.gz UCGCYZNMVATUMT-UHFFFAOYSA-N 1 2 245.326 2.043 20 0 BEADLO CC[C@H]1CCCCN1c1cc(N(C)C)[nH+]cn1 ZINC000585415577 973913919 /nfs/dbraw/zinc/91/39/19/973913919.db2.gz XMSDFJBHUXFGQR-NSHDSACASA-N 1 2 234.347 2.312 20 0 BEADLO CC[C@H]1CCCCN1c1cc(N(C)C)nc[nH+]1 ZINC000585415577 973913931 /nfs/dbraw/zinc/91/39/31/973913931.db2.gz XMSDFJBHUXFGQR-NSHDSACASA-N 1 2 234.347 2.312 20 0 BEADLO Fc1c[nH+]ccc1NCc1cccc2ncoc21 ZINC001171459482 974077816 /nfs/dbraw/zinc/07/78/16/974077816.db2.gz CSMHRMXQGAAELJ-UHFFFAOYSA-N 1 2 243.241 2.396 20 0 BEADLO C[C@@H](c1nc(C2CCC2)no1)n1cc[nH+]c1 ZINC001330050945 974083333 /nfs/dbraw/zinc/08/33/33/974083333.db2.gz PTEJFJDZELZSTM-QMMMGPOBSA-N 1 2 218.260 2.143 20 0 BEADLO CCOC(=[NH2+])CCCCOC1CC2(COC2)C1 ZINC001224963270 974103277 /nfs/dbraw/zinc/10/32/77/974103277.db2.gz LOAMIYPWHIBAIN-UHFFFAOYSA-N 1 2 241.331 2.366 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1c1nnc(C[NH+](C)C)o1 ZINC001330100959 974105602 /nfs/dbraw/zinc/10/56/02/974105602.db2.gz QETGGKOVDQVKOX-CABZTGNLSA-N 1 2 223.320 2.281 20 0 BEADLO CCCOC1C[NH+]([C@@H]2Cc3cccc(F)c3C2)C1 ZINC001171804272 974196951 /nfs/dbraw/zinc/19/69/51/974196951.db2.gz BTHGQICCIIAUJL-GFCCVEGCSA-N 1 2 249.329 2.404 20 0 BEADLO C[C@H](C(=O)N1CCC(C2CC2)CC1)n1cc[nH+]c1 ZINC001330437642 974265761 /nfs/dbraw/zinc/26/57/61/974265761.db2.gz XRQGBWHUEPVLIV-LLVKDONJSA-N 1 2 247.342 2.093 20 0 BEADLO CC[NH+]1CC(Oc2cc(F)cc(F)c2)C1 ZINC001225229480 974271179 /nfs/dbraw/zinc/27/11/79/974271179.db2.gz YYEWNOHXTGHXAP-UHFFFAOYSA-N 1 2 213.227 2.048 20 0 BEADLO CC(C)(CCc1ccccc1)[NH2+]Cc1ncn[nH]1 ZINC001330546091 974304496 /nfs/dbraw/zinc/30/44/96/974304496.db2.gz BFGBSVQFGUMAPD-UHFFFAOYSA-N 1 2 244.342 2.306 20 0 BEADLO COC(=O)C1CCC(Oc2cc[nH+]cc2)CC1 ZINC001225290930 974362132 /nfs/dbraw/zinc/36/21/32/974362132.db2.gz LFXQZDVDPNUYEO-UHFFFAOYSA-N 1 2 235.283 2.192 20 0 BEADLO Cc1nc([C@H](C)[NH2+][C@H](C)[C@H]2CC2(F)F)no1 ZINC001330621597 974367484 /nfs/dbraw/zinc/36/74/84/974367484.db2.gz LMRQLQDHSVOUEC-GKROBHDKSA-N 1 2 231.246 2.072 20 0 BEADLO CC[NH+]1CC(Oc2ccc(F)cc2C)C1 ZINC001225347959 974428982 /nfs/dbraw/zinc/42/89/82/974428982.db2.gz NREWJUISEBNDFW-UHFFFAOYSA-N 1 2 209.264 2.217 20 0 BEADLO c1ccc2c(c1)C[C@@H]([NH+]1CC3(CCO3)C1)CS2 ZINC001172207030 974438048 /nfs/dbraw/zinc/43/80/48/974438048.db2.gz VPZSGLGMZICEMA-GFCCVEGCSA-N 1 2 247.363 2.178 20 0 BEADLO CC[NH+]1CC(Oc2cccnc2C(C)C)C1 ZINC001225527031 974538432 /nfs/dbraw/zinc/53/84/32/974538432.db2.gz ZVTQNPWERMJLRR-UHFFFAOYSA-N 1 2 220.316 2.288 20 0 BEADLO CCc1nn(C[N@@H+]2C[C@@H](C)C[C@@H]2C)c(=S)o1 ZINC001331008390 974557083 /nfs/dbraw/zinc/55/70/83/974557083.db2.gz PJPMIUJXKQFCFS-IUCAKERBSA-N 1 2 241.360 2.456 20 0 BEADLO CCc1nn(C[N@H+]2C[C@@H](C)C[C@@H]2C)c(=S)o1 ZINC001331008390 974557089 /nfs/dbraw/zinc/55/70/89/974557089.db2.gz PJPMIUJXKQFCFS-IUCAKERBSA-N 1 2 241.360 2.456 20 0 BEADLO Cc1nc2c(s1)C[N@@H+]([C@H]1COC(C)(C)C1)C2 ZINC001172295902 974566922 /nfs/dbraw/zinc/56/69/22/974566922.db2.gz UCLBXCJLSCYEMD-SECBINFHSA-N 1 2 238.356 2.335 20 0 BEADLO Cc1nc2c(s1)C[N@H+]([C@H]1COC(C)(C)C1)C2 ZINC001172295902 974566936 /nfs/dbraw/zinc/56/69/36/974566936.db2.gz UCLBXCJLSCYEMD-SECBINFHSA-N 1 2 238.356 2.335 20 0 BEADLO Fc1cc(C[N@H+]2CC[C@H](OC(F)F)C2)ccn1 ZINC001331364594 974695391 /nfs/dbraw/zinc/69/53/91/974695391.db2.gz PGFGHXYPDOPLOS-VIFPVBQESA-N 1 2 246.232 2.034 20 0 BEADLO Fc1cc(C[N@@H+]2CC[C@H](OC(F)F)C2)ccn1 ZINC001331364594 974695395 /nfs/dbraw/zinc/69/53/95/974695395.db2.gz PGFGHXYPDOPLOS-VIFPVBQESA-N 1 2 246.232 2.034 20 0 BEADLO CC(C)OCC[C@@H](C)[N@@H+]1CCC[C@@H](F)C(=O)C1 ZINC001172444685 974805875 /nfs/dbraw/zinc/80/58/75/974805875.db2.gz VFDYNEHAKUWRRS-VXGBXAGGSA-N 1 2 245.338 2.193 20 0 BEADLO CC(C)OCC[C@@H](C)[N@H+]1CCC[C@@H](F)C(=O)C1 ZINC001172444685 974805878 /nfs/dbraw/zinc/80/58/78/974805878.db2.gz VFDYNEHAKUWRRS-VXGBXAGGSA-N 1 2 245.338 2.193 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N[C@@H]2CC[C@H](C)C2)c[nH+]1 ZINC001331727965 974806358 /nfs/dbraw/zinc/80/63/58/974806358.db2.gz CYKRWWKLYLBEIQ-CMPLNLGQSA-N 1 2 249.358 2.231 20 0 BEADLO OC1C[NH+](Cc2ccc(Nc3ccco3)cc2)C1 ZINC001212667489 974830687 /nfs/dbraw/zinc/83/06/87/974830687.db2.gz VNPCLDCVFFRWNC-UHFFFAOYSA-N 1 2 244.294 2.200 20 0 BEADLO Oc1ccc(C[NH+]2CC3(C2)CCCCO3)cc1 ZINC001204090141 974873607 /nfs/dbraw/zinc/87/36/07/974873607.db2.gz COKBRIBUKXTTLV-UHFFFAOYSA-N 1 2 233.311 2.147 20 0 BEADLO COC(=O)C[NH2+][C@H]1CC[C@@H](c2ccccc2)C1 ZINC001172546235 974878415 /nfs/dbraw/zinc/87/84/15/974878415.db2.gz LBIJUQTZTJWPTJ-OLZOCXBDSA-N 1 2 233.311 2.085 20 0 BEADLO Clc1ccc2c(c1)C[C@H]([N@H+]1C[C@H]3C[C@@H](C1)O3)C2 ZINC001172722032 974904254 /nfs/dbraw/zinc/90/42/54/974904254.db2.gz NBOKROSMKRLVNZ-MCIONIFRSA-N 1 2 249.741 2.280 20 0 BEADLO Clc1ccc2c(c1)C[C@H]([N@@H+]1C[C@H]3C[C@@H](C1)O3)C2 ZINC001172722032 974904257 /nfs/dbraw/zinc/90/42/57/974904257.db2.gz NBOKROSMKRLVNZ-MCIONIFRSA-N 1 2 249.741 2.280 20 0 BEADLO Clc1ccc2c(c1)C[C@@H]([N@@H+]1CCC13COC3)C2 ZINC001172717004 974906371 /nfs/dbraw/zinc/90/63/71/974906371.db2.gz CUNGIIAADZUXQB-ZDUSSCGKSA-N 1 2 249.741 2.282 20 0 BEADLO Clc1ccc2c(c1)C[C@@H]([N@H+]1CCC13COC3)C2 ZINC001172717004 974906379 /nfs/dbraw/zinc/90/63/79/974906379.db2.gz CUNGIIAADZUXQB-ZDUSSCGKSA-N 1 2 249.741 2.282 20 0 BEADLO Cc1nc2cc(OC3C[NH+](C)C3)ccc2s1 ZINC001226472084 974919467 /nfs/dbraw/zinc/91/94/67/974919467.db2.gz WJRUQJLUKPNQQK-UHFFFAOYSA-N 1 2 234.324 2.298 20 0 BEADLO CC(C)[NH+]1CC(Oc2ncnc3ccsc32)C1 ZINC001226622549 974981387 /nfs/dbraw/zinc/98/13/87/974981387.db2.gz CSIDYZZFPISZLZ-UHFFFAOYSA-N 1 2 249.339 2.163 20 0 BEADLO c1cn(Cc2ccc(Nc3nnco3)cc2)c[nH+]1 ZINC001212692144 975001029 /nfs/dbraw/zinc/00/10/29/975001029.db2.gz CVIQSKQPOKOPCU-UHFFFAOYSA-N 1 2 241.254 2.058 20 0 BEADLO Cn1cccc1C[N@@H+]1CC[C@](C)(F)[C@H](F)C1 ZINC001203254256 975055906 /nfs/dbraw/zinc/05/59/06/975055906.db2.gz OKNSRZWYZIYXFQ-NEPJUHHUSA-N 1 2 228.286 2.297 20 0 BEADLO CCc1ccc(C[C@@H](C)[NH2+][C@@H](C)C(=O)OC)cc1 ZINC001173235100 975076284 /nfs/dbraw/zinc/07/62/84/975076284.db2.gz IRQOLZHWXWBNMS-NEPJUHHUSA-N 1 2 249.354 2.331 20 0 BEADLO C[NH+]1CC(Oc2cc(-c3ccccc3)ccn2)C1 ZINC001226950966 975180427 /nfs/dbraw/zinc/18/04/27/975180427.db2.gz YXQIJWYYFIWOMA-UHFFFAOYSA-N 1 2 240.306 2.441 20 0 BEADLO CC[C@H]1CC[C@H]([N@@H+]2C[C@H](F)C[C@H]2C(=O)OC)C1 ZINC001173280307 975233373 /nfs/dbraw/zinc/23/33/73/975233373.db2.gz LMPNYZJSFHQFPH-USZNOCQGSA-N 1 2 243.322 2.151 20 0 BEADLO CC[C@H]1CC[C@H]([N@H+]2C[C@H](F)C[C@H]2C(=O)OC)C1 ZINC001173280307 975233381 /nfs/dbraw/zinc/23/33/81/975233381.db2.gz LMPNYZJSFHQFPH-USZNOCQGSA-N 1 2 243.322 2.151 20 0 BEADLO CC[C@@H]1CC[C@H]([N@@H+]2C[C@@H](F)C[C@H]2C(=O)OC)C1 ZINC001173280305 975237102 /nfs/dbraw/zinc/23/71/02/975237102.db2.gz LMPNYZJSFHQFPH-RHYQMDGZSA-N 1 2 243.322 2.151 20 0 BEADLO CC[C@@H]1CC[C@H]([N@H+]2C[C@@H](F)C[C@H]2C(=O)OC)C1 ZINC001173280305 975237111 /nfs/dbraw/zinc/23/71/11/975237111.db2.gz LMPNYZJSFHQFPH-RHYQMDGZSA-N 1 2 243.322 2.151 20 0 BEADLO CC1(C)CN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1(C)C ZINC001332672989 975246661 /nfs/dbraw/zinc/24/66/61/975246661.db2.gz DHCBNZKYNAUKBU-NXEZZACHSA-N 1 2 247.342 2.160 20 0 BEADLO CC1(C)CN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1(C)C ZINC001332672989 975246666 /nfs/dbraw/zinc/24/66/66/975246666.db2.gz DHCBNZKYNAUKBU-NXEZZACHSA-N 1 2 247.342 2.160 20 0 BEADLO CCOC(=O)C1([NH2+][C@H](C)CSCC)CCC1 ZINC001173292372 975266158 /nfs/dbraw/zinc/26/61/58/975266158.db2.gz WTPCGKJPGTUMFU-SNVBAGLBSA-N 1 2 245.388 2.203 20 0 BEADLO c1nnc(C[N@@H+](CCc2ccccc2)C2CC2)[nH]1 ZINC001332761192 975280002 /nfs/dbraw/zinc/28/00/02/975280002.db2.gz NPYKBUNBMZPPIU-UHFFFAOYSA-N 1 2 242.326 2.012 20 0 BEADLO c1nnc(C[N@H+](CCc2ccccc2)C2CC2)[nH]1 ZINC001332761192 975280008 /nfs/dbraw/zinc/28/00/08/975280008.db2.gz NPYKBUNBMZPPIU-UHFFFAOYSA-N 1 2 242.326 2.012 20 0 BEADLO CCCc1ccc(OC2C[NH+](C)C2)cc1 ZINC001227181810 975305159 /nfs/dbraw/zinc/30/51/59/975305159.db2.gz IEBLEIUZURTOQU-UHFFFAOYSA-N 1 2 205.301 2.332 20 0 BEADLO COC(=O)C1CC(Oc2c(C)cc[nH+]c2C)C1 ZINC001227261076 975334231 /nfs/dbraw/zinc/33/42/31/975334231.db2.gz XRHUVYXGKDDRPS-UHFFFAOYSA-N 1 2 235.283 2.029 20 0 BEADLO Cc1cc[nH+]c(C)c1OCC(=O)OC(C)C ZINC001227263074 975338999 /nfs/dbraw/zinc/33/89/99/975338999.db2.gz BUXFDLYNGFZZEO-UHFFFAOYSA-N 1 2 223.272 2.029 20 0 BEADLO CCOC(=O)[C@@H](Oc1c(C)cc[nH+]c1C)C1CC1 ZINC001227262726 975340099 /nfs/dbraw/zinc/34/00/99/975340099.db2.gz VFLIPIZMIMFERC-ZDUSSCGKSA-N 1 2 249.310 2.419 20 0 BEADLO C=CC(=O)OC[C@H](C)Oc1c(C)cc[nH+]c1C ZINC001227265132 975343430 /nfs/dbraw/zinc/34/34/30/975343430.db2.gz SHKAJRMDSNCMAX-JTQLQIEISA-N 1 2 235.283 2.195 20 0 BEADLO C=CC(=O)OC[C@@H](C)Oc1c(C)cc[nH+]c1C ZINC001227265133 975345231 /nfs/dbraw/zinc/34/52/31/975345231.db2.gz SHKAJRMDSNCMAX-SNVBAGLBSA-N 1 2 235.283 2.195 20 0 BEADLO CC(C)(C)[NH+]1CC(OC(=O)c2ccccc2O)C1 ZINC001227484292 975470083 /nfs/dbraw/zinc/47/00/83/975470083.db2.gz LQOGHBGRXFQARD-UHFFFAOYSA-N 1 2 249.310 2.032 20 0 BEADLO Cc1cc(O)c[nH+]c1Nc1cc(F)cc(CO)c1 ZINC001212742601 975480466 /nfs/dbraw/zinc/48/04/66/975480466.db2.gz KOCGROQKZWFXCY-UHFFFAOYSA-N 1 2 248.257 2.471 20 0 BEADLO Nc1ccc[nH+]c1Nc1cc(F)cc(CO)c1 ZINC001212742814 975481705 /nfs/dbraw/zinc/48/17/05/975481705.db2.gz VKRDZRQSLQSSBH-UHFFFAOYSA-N 1 2 233.246 2.039 20 0 BEADLO CCc1ncc(C[N@@H+]2CC(C)(C)OC[C@@H]2C)o1 ZINC001333470986 975800440 /nfs/dbraw/zinc/80/04/40/975800440.db2.gz JQBSTHYYHAFKBL-JTQLQIEISA-N 1 2 238.331 2.236 20 0 BEADLO CCc1ncc(C[N@H+]2CC(C)(C)OC[C@@H]2C)o1 ZINC001333470986 975800447 /nfs/dbraw/zinc/80/04/47/975800447.db2.gz JQBSTHYYHAFKBL-JTQLQIEISA-N 1 2 238.331 2.236 20 0 BEADLO CC(C)[NH+]1CC(Oc2cnc(F)c(Cl)c2)C1 ZINC001227965188 975815232 /nfs/dbraw/zinc/81/52/32/975815232.db2.gz NKXQTXXUBXFRIB-UHFFFAOYSA-N 1 2 244.697 2.346 20 0 BEADLO Cc1ccccc1[C@H]1CC[N@H+](Cc2nnc[nH]2)C1 ZINC001333581340 975864493 /nfs/dbraw/zinc/86/44/93/975864493.db2.gz DSDJZAKKCGWOLW-LBPRGKRZSA-N 1 2 242.326 2.103 20 0 BEADLO Cc1ccccc1[C@H]1CC[N@@H+](Cc2nnc[nH]2)C1 ZINC001333581340 975864495 /nfs/dbraw/zinc/86/44/95/975864495.db2.gz DSDJZAKKCGWOLW-LBPRGKRZSA-N 1 2 242.326 2.103 20 0 BEADLO CC[C@@H](C)[C@H](C)[N@H+](Cc1nnc[nH]1)C1CC1 ZINC001333583193 975867163 /nfs/dbraw/zinc/86/71/63/975867163.db2.gz QCYKTEYFRJCAIN-ZJUUUORDSA-N 1 2 222.336 2.204 20 0 BEADLO CC[C@@H](C)[C@H](C)[N@@H+](Cc1nnc[nH]1)C1CC1 ZINC001333583193 975867171 /nfs/dbraw/zinc/86/71/71/975867171.db2.gz QCYKTEYFRJCAIN-ZJUUUORDSA-N 1 2 222.336 2.204 20 0 BEADLO CCCCC[C@H]1CCC[N@@H+]1Cc1nnc[nH]1 ZINC001333586484 975870513 /nfs/dbraw/zinc/87/05/13/975870513.db2.gz JOJZPVWPFJGPSS-NSHDSACASA-N 1 2 222.336 2.349 20 0 BEADLO CCCCC[C@H]1CCC[N@H+]1Cc1nnc[nH]1 ZINC001333586484 975870520 /nfs/dbraw/zinc/87/05/20/975870520.db2.gz JOJZPVWPFJGPSS-NSHDSACASA-N 1 2 222.336 2.349 20 0 BEADLO C[NH+]1CC(Oc2cccc3c(O)cccc23)C1 ZINC001228099577 975906794 /nfs/dbraw/zinc/90/67/94/975906794.db2.gz DSGAKCRAUTXKRZ-UHFFFAOYSA-N 1 2 229.279 2.238 20 0 BEADLO Cc1cc(NCC(C)(C)CO)nc(C2CCC2)[nH+]1 ZINC001333722644 976030494 /nfs/dbraw/zinc/03/04/94/976030494.db2.gz DYKDTERBXHDGFO-UHFFFAOYSA-N 1 2 249.358 2.483 20 0 BEADLO CCc1nn(C[N@H+](CC)CC2CC2)c(=S)o1 ZINC001333792126 976086988 /nfs/dbraw/zinc/08/69/88/976086988.db2.gz RZSCHFDCTQFMLL-UHFFFAOYSA-N 1 2 241.360 2.457 20 0 BEADLO CCc1nn(C[N@@H+](CC)CC2CC2)c(=S)o1 ZINC001333792126 976087002 /nfs/dbraw/zinc/08/70/02/976087002.db2.gz RZSCHFDCTQFMLL-UHFFFAOYSA-N 1 2 241.360 2.457 20 0 BEADLO CC[C@@H](Oc1ccc2[nH]c(C)[nH+]c2c1)C(=O)OC ZINC001228328443 976122732 /nfs/dbraw/zinc/12/27/32/976122732.db2.gz FDVRYHCONSKZJP-GFCCVEGCSA-N 1 2 248.282 2.202 20 0 BEADLO CCOc1ccc(OC2C[NH+](CC)C2)cc1F ZINC001228354592 976149615 /nfs/dbraw/zinc/14/96/15/976149615.db2.gz NUZVFKAOGAQPLF-UHFFFAOYSA-N 1 2 239.290 2.307 20 0 BEADLO Cc1cc(C)c(OC2C[NH+](C)C2)c(C)c1 ZINC001228405533 976189092 /nfs/dbraw/zinc/18/90/92/976189092.db2.gz JCAZHCXBZHXDFA-UHFFFAOYSA-N 1 2 205.301 2.305 20 0 BEADLO C[C@@H]1CC[C@H]1NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001333969969 976191374 /nfs/dbraw/zinc/19/13/74/976191374.db2.gz SNTUYKWHKWTQQF-PSASIEDQSA-N 1 2 229.283 2.091 20 0 BEADLO COc1cc[nH+]cc1Nc1cccnc1OC ZINC001174041540 976251061 /nfs/dbraw/zinc/25/10/61/976251061.db2.gz SVGMEKLAJLFUGI-UHFFFAOYSA-N 1 2 231.255 2.237 20 0 BEADLO COc1cccc(OC2C[NH+](C(C)C)C2)c1F ZINC001228569637 976331792 /nfs/dbraw/zinc/33/17/92/976331792.db2.gz RMJLMLCLRJXBBC-UHFFFAOYSA-N 1 2 239.290 2.306 20 0 BEADLO COc1cncc(Nc2[nH+]cc(C)cc2N)c1 ZINC001174087863 976354158 /nfs/dbraw/zinc/35/41/58/976354158.db2.gz FBEYQKNNPWYJIE-UHFFFAOYSA-N 1 2 230.271 2.119 20 0 BEADLO CC[C@@H](C[NH2+]Cc1ncn[nH]1)c1ccccc1 ZINC001204137642 976377348 /nfs/dbraw/zinc/37/73/48/976377348.db2.gz ZGPFWZRVPSRUDY-NSHDSACASA-N 1 2 230.315 2.088 20 0 BEADLO C[C@@H](C(=O)N(C)c1ccsc1)n1cc[nH+]c1 ZINC001334229840 976393302 /nfs/dbraw/zinc/39/33/02/976393302.db2.gz KCBNBENALFJAJB-VIFPVBQESA-N 1 2 235.312 2.169 20 0 BEADLO Cc1n[nH]c(C)c1Nc1cccn2cc[nH+]c12 ZINC001174216377 976405307 /nfs/dbraw/zinc/40/53/07/976405307.db2.gz SHGWGVFFXSXCDM-UHFFFAOYSA-N 1 2 227.271 2.418 20 0 BEADLO Cc1ccnc2cc(OC3C[NH+](C)C3)ccc12 ZINC001228738256 976473359 /nfs/dbraw/zinc/47/33/59/976473359.db2.gz ARTPNOMKKHADDP-UHFFFAOYSA-N 1 2 228.295 2.236 20 0 BEADLO CCN(C)c1ccc(Nc2cn[nH]c2)c[nH+]1 ZINC001174295340 976475824 /nfs/dbraw/zinc/47/58/24/976475824.db2.gz WTFKIKZXMHQLAD-UHFFFAOYSA-N 1 2 217.276 2.004 20 0 BEADLO Cn1cc(Nc2ccccc2-n2cc[nH+]c2)cn1 ZINC001174330330 976534368 /nfs/dbraw/zinc/53/43/68/976534368.db2.gz XIRWEQZNACMMHY-UHFFFAOYSA-N 1 2 239.282 2.349 20 0 BEADLO CS[C@@H]1CC[C@@H]([N@H+](C)Cc2nncs2)C1 ZINC001334603002 976563103 /nfs/dbraw/zinc/56/31/03/976563103.db2.gz JYNBQXOYEZXATO-RKDXNWHRSA-N 1 2 243.401 2.254 20 0 BEADLO CS[C@@H]1CC[C@@H]([N@@H+](C)Cc2nncs2)C1 ZINC001334603002 976563114 /nfs/dbraw/zinc/56/31/14/976563114.db2.gz JYNBQXOYEZXATO-RKDXNWHRSA-N 1 2 243.401 2.254 20 0 BEADLO COc1ccc(C[NH2+]Cc2ncc(C)s2)o1 ZINC001334694911 976590519 /nfs/dbraw/zinc/59/05/19/976590519.db2.gz SYVPFLHYYWCWMN-UHFFFAOYSA-N 1 2 238.312 2.343 20 0 BEADLO CCc1[nH+]ccc(C)c1Nc1ccc(=O)n(C)c1 ZINC001174356156 976598775 /nfs/dbraw/zinc/59/87/75/976598775.db2.gz IYMFVKSUPPLTGE-UHFFFAOYSA-N 1 2 243.310 2.395 20 0 BEADLO CCCc1cc[nH+]c(Nc2ccc(=O)n(C)c2)c1 ZINC001174357081 976602535 /nfs/dbraw/zinc/60/25/35/976602535.db2.gz YLRBXHCCKGPQCG-UHFFFAOYSA-N 1 2 243.310 2.476 20 0 BEADLO C[C@H](C(=O)NC1CCC=CCC1)n1cc[nH+]c1 ZINC001334735733 976608719 /nfs/dbraw/zinc/60/87/19/976608719.db2.gz YJCMXXJYFMPDAP-LLVKDONJSA-N 1 2 233.315 2.059 20 0 BEADLO Cc1ccncc1[C@H](C)[NH2+]Cc1nncs1 ZINC001334747825 976619144 /nfs/dbraw/zinc/61/91/44/976619144.db2.gz TVPIDMYWQRGBHE-VIFPVBQESA-N 1 2 234.328 2.092 20 0 BEADLO CCc1cc(NC[C@@H]2CCOC2)nc(CC)[nH+]1 ZINC001334901178 976781363 /nfs/dbraw/zinc/78/13/63/976781363.db2.gz HDWLPPKXNGXLFT-JTQLQIEISA-N 1 2 235.331 2.050 20 0 BEADLO COc1ccc2[nH+]ccc(NC=C(C)C)c2n1 ZINC001174553389 976855654 /nfs/dbraw/zinc/85/56/54/976855654.db2.gz HCURPULIZDBOPI-UHFFFAOYSA-N 1 2 229.283 2.396 20 0 BEADLO Cc1cc(O)ccc1[N@H+]1C(=N)C=CC(Cl)=C1N ZINC001174560410 976876381 /nfs/dbraw/zinc/87/63/81/976876381.db2.gz NBWNUEBCXIYKHO-UHFFFAOYSA-N 1 2 249.701 2.206 20 0 BEADLO Cc1cc(O)ccc1[N@@H+]1C(=N)C=CC(Cl)=C1N ZINC001174560410 976876389 /nfs/dbraw/zinc/87/63/89/976876389.db2.gz NBWNUEBCXIYKHO-UHFFFAOYSA-N 1 2 249.701 2.206 20 0 BEADLO CCc1cc(N2CC[C@H]2C)nc(CC)[nH+]1 ZINC001335518435 977114098 /nfs/dbraw/zinc/11/40/98/977114098.db2.gz CWZGEVPHQSMQLL-SECBINFHSA-N 1 2 205.305 2.200 20 0 BEADLO CN(C)c1cccc(N(C)c2[nH+]cccc2N)c1 ZINC001174961288 977186986 /nfs/dbraw/zinc/18/69/86/977186986.db2.gz WORXFOLGQDNECR-UHFFFAOYSA-N 1 2 242.326 2.498 20 0 BEADLO CCCC(=O)N(C)C[C@H]1CC[N@@H+]1C/C=C\Cl ZINC001230633905 977281400 /nfs/dbraw/zinc/28/14/00/977281400.db2.gz MJHLCQHLIGEXQX-MEQVVJDKSA-N 1 2 244.766 2.072 20 0 BEADLO CCCC(=O)N(C)C[C@H]1CC[N@H+]1C/C=C\Cl ZINC001230633905 977281409 /nfs/dbraw/zinc/28/14/09/977281409.db2.gz MJHLCQHLIGEXQX-MEQVVJDKSA-N 1 2 244.766 2.072 20 0 BEADLO Cc1csc2nccc(OC3C[NH+](C)C3)c12 ZINC001230653653 977289515 /nfs/dbraw/zinc/28/95/15/977289515.db2.gz CQBWDLXTGXCTJW-UHFFFAOYSA-N 1 2 234.324 2.298 20 0 BEADLO Fc1cnccc1Nc1cccc2[nH+]ccn21 ZINC001175196418 977294967 /nfs/dbraw/zinc/29/49/67/977294967.db2.gz CEUWTGBIVWVONQ-UHFFFAOYSA-N 1 2 228.230 2.034 20 0 BEADLO CN(C)c1ccc(Nc2ccccc2CO)c[nH+]1 ZINC001175342435 977364875 /nfs/dbraw/zinc/36/48/75/977364875.db2.gz PMNDRHFZVIXSHF-UHFFFAOYSA-N 1 2 243.310 2.384 20 0 BEADLO CN(C)c1ccc(Nc2c(N)cccc2O)c[nH+]1 ZINC001175346093 977366472 /nfs/dbraw/zinc/36/64/72/977366472.db2.gz MJAKRMTWYBMMEL-UHFFFAOYSA-N 1 2 244.298 2.179 20 0 BEADLO Cc1cc(C[NH+]2CCC(F)(C3CC3)CC2)n[nH]1 ZINC001355357684 1170019006 /nfs/dbraw/zinc/01/90/06/1170019006.db2.gz FKNCAGSMVGIDFN-UHFFFAOYSA-N 1 2 237.322 2.432 20 0 BEADLO CN(C)c1ccc(Nc2cnccc2F)c[nH+]1 ZINC001175340702 977388483 /nfs/dbraw/zinc/38/84/83/977388483.db2.gz CJYCHWVPQUWOQT-UHFFFAOYSA-N 1 2 232.262 2.425 20 0 BEADLO c1c[nH+]c(-c2ccc(OC[C@@H]3CCO3)cc2)[nH]1 ZINC001231080589 977474611 /nfs/dbraw/zinc/47/46/11/977474611.db2.gz FSPQYFRYGDIAIE-LBPRGKRZSA-N 1 2 230.267 2.244 20 0 BEADLO Cc1ccc(O)c(Nc2ccc(CO)cc2)[nH+]1 ZINC001175562926 977544199 /nfs/dbraw/zinc/54/41/99/977544199.db2.gz IBUCTNJMPLCKSO-UHFFFAOYSA-N 1 2 230.267 2.332 20 0 BEADLO CCC[C@H]1CCCN1C(=O)[C@H](C)n1cc[nH+]c1 ZINC001336161620 977545502 /nfs/dbraw/zinc/54/55/02/977545502.db2.gz BJMSQLMHOKOXBB-RYUDHWBXSA-N 1 2 235.331 2.235 20 0 BEADLO C[N@@H+]1CCC=C(Nc2c(O)cc(F)cc2F)C1 ZINC001175576611 977583745 /nfs/dbraw/zinc/58/37/45/977583745.db2.gz MXYIAWFULNIXLL-UHFFFAOYSA-N 1 2 240.253 2.302 20 0 BEADLO C[N@H+]1CCC=C(Nc2c(O)cc(F)cc2F)C1 ZINC001175576611 977583753 /nfs/dbraw/zinc/58/37/53/977583753.db2.gz MXYIAWFULNIXLL-UHFFFAOYSA-N 1 2 240.253 2.302 20 0 BEADLO CCc1ccc(C[NH+]2CC3(CCO3)C2)s1 ZINC001231502751 977619756 /nfs/dbraw/zinc/61/97/56/977619756.db2.gz YANNYKCRDUUZIN-UHFFFAOYSA-N 1 2 223.341 2.285 20 0 BEADLO CCCOC1C[NH+](Cc2c[nH]c3cnccc23)C1 ZINC001231518436 977624574 /nfs/dbraw/zinc/62/45/74/977624574.db2.gz HRAKEGRYEQXDCG-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO COc1cc(F)ccc1C[N@@H+]1CC[C@@H](F)C1 ZINC001231600852 977647209 /nfs/dbraw/zinc/64/72/09/977647209.db2.gz YCBLJLMERTWADD-LLVKDONJSA-N 1 2 227.254 2.378 20 0 BEADLO COc1cc(F)ccc1C[N@H+]1CC[C@@H](F)C1 ZINC001231600852 977647214 /nfs/dbraw/zinc/64/72/14/977647214.db2.gz YCBLJLMERTWADD-LLVKDONJSA-N 1 2 227.254 2.378 20 0 BEADLO CCc1[nH+]ccc(C)c1Nc1cnc(N)nc1C ZINC001175669591 977649141 /nfs/dbraw/zinc/64/91/41/977649141.db2.gz MFQDPPREHSLKCO-UHFFFAOYSA-N 1 2 243.314 2.377 20 0 BEADLO COc1cc(C)c(C[NH+]2CC(O)C2)cc1C(C)C ZINC001231625527 977656285 /nfs/dbraw/zinc/65/62/85/977656285.db2.gz ZTNQKIMGIUZSKF-UHFFFAOYSA-N 1 2 249.354 2.304 20 0 BEADLO CCc1ccc(C[NH+]2CC(C(F)F)C2)nc1 ZINC001231646417 977660488 /nfs/dbraw/zinc/66/04/88/977660488.db2.gz ICHGAIUHHBALKN-UHFFFAOYSA-N 1 2 226.270 2.341 20 0 BEADLO CSc1ccccc1C[NH+]1CCN(C#N)CC1 ZINC001231786525 977748175 /nfs/dbraw/zinc/74/81/75/977748175.db2.gz GCTJXOJLLQCGDI-UHFFFAOYSA-N 1 2 247.367 2.007 20 0 BEADLO CCc1ccc(N(C)Cc2cnn(CC)c2)[nH+]c1 ZINC001336527265 977748339 /nfs/dbraw/zinc/74/83/39/977748339.db2.gz FLUOVLSAPWJJQT-UHFFFAOYSA-N 1 2 244.342 2.497 20 0 BEADLO CCC[C@@]1(C)CCCN(c2cc(N)nc[nH+]2)C1 ZINC001336545694 977768803 /nfs/dbraw/zinc/76/88/03/977768803.db2.gz YBFWSLYYTZELRV-ZDUSSCGKSA-N 1 2 234.347 2.465 20 0 BEADLO c1[nH]cc(C2CCN(c3ccccn3)CC2)[nH+]1 ZINC001336546763 977768956 /nfs/dbraw/zinc/76/89/56/977768956.db2.gz YAWBALPQZMCBRR-UHFFFAOYSA-N 1 2 228.299 2.189 20 0 BEADLO C[C@@H](C(=O)NCC1(C)CCCC1)n1cc[nH+]c1 ZINC000066430875 977772057 /nfs/dbraw/zinc/77/20/57/977772057.db2.gz VXVUXVPXGGDYCH-NSHDSACASA-N 1 2 235.331 2.141 20 0 BEADLO Cc1[nH+]c2ccc(N)cc2n1-c1ccc(F)cn1 ZINC001175851340 977779109 /nfs/dbraw/zinc/77/91/09/977779109.db2.gz UPCYJNWCTLMGBM-UHFFFAOYSA-N 1 2 242.257 2.450 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@H](F)C2)[nH+]1 ZINC001336617453 977813483 /nfs/dbraw/zinc/81/34/83/977813483.db2.gz SYLCRNVROWXZJF-VIFPVBQESA-N 1 2 212.243 2.467 20 0 BEADLO COc1cc[nH+]c(CN2CC(F)(C3CC3)C2)c1 ZINC001231967209 977815282 /nfs/dbraw/zinc/81/52/82/977815282.db2.gz VZTQVPFXKRVCBA-UHFFFAOYSA-N 1 2 236.290 2.024 20 0 BEADLO Cc1cc(C[N@@H+]2CCOCC23CC3)cc(C)n1 ZINC001232000848 977836170 /nfs/dbraw/zinc/83/61/70/977836170.db2.gz APNYSUGKBHZFJO-UHFFFAOYSA-N 1 2 232.327 2.063 20 0 BEADLO Cc1cc(C[N@H+]2CCOCC23CC3)cc(C)n1 ZINC001232000848 977836179 /nfs/dbraw/zinc/83/61/79/977836179.db2.gz APNYSUGKBHZFJO-UHFFFAOYSA-N 1 2 232.327 2.063 20 0 BEADLO CCc1cc(NC[C@@](C)(O)CC)nc(CC)[nH+]1 ZINC001336698306 977864298 /nfs/dbraw/zinc/86/42/98/977864298.db2.gz RADGKPIPUGSRQF-ZDUSSCGKSA-N 1 2 237.347 2.174 20 0 BEADLO CC[C@@]1(O)CCCN(c2cc(F)cc(C)[nH+]2)C1 ZINC001336705327 977869504 /nfs/dbraw/zinc/86/95/04/977869504.db2.gz GZNXICHSXXGQAY-CYBMUJFWSA-N 1 2 238.306 2.270 20 0 BEADLO C/C=C/C[C@H]1CCCN(c2cc(N)nc[nH+]2)C1 ZINC001336702995 977870367 /nfs/dbraw/zinc/87/03/67/977870367.db2.gz IYVYYYCHZFMSRM-VUDBWIFFSA-N 1 2 232.331 2.241 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1cc2ncccc2[nH]1 ZINC001232065284 977877013 /nfs/dbraw/zinc/87/70/13/977877013.db2.gz QYFTWVNVCKWVLO-LBPRGKRZSA-N 1 2 245.326 2.174 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1cc2ncccc2[nH]1 ZINC001232065284 977877015 /nfs/dbraw/zinc/87/70/15/977877015.db2.gz QYFTWVNVCKWVLO-LBPRGKRZSA-N 1 2 245.326 2.174 20 0 BEADLO O=C1CCC[N@H+](Cc2cc3ccncc3[nH]2)CC1 ZINC001232089326 977889148 /nfs/dbraw/zinc/88/91/48/977889148.db2.gz HVEHIQRQOOYJDU-UHFFFAOYSA-N 1 2 243.310 2.118 20 0 BEADLO O=C1CCC[N@@H+](Cc2cc3ccncc3[nH]2)CC1 ZINC001232089326 977889155 /nfs/dbraw/zinc/88/91/55/977889155.db2.gz HVEHIQRQOOYJDU-UHFFFAOYSA-N 1 2 243.310 2.118 20 0 BEADLO C[N@H+](Cc1cc2ccncc2[nH]1)Cc1ccno1 ZINC001232096617 977892427 /nfs/dbraw/zinc/89/24/27/977892427.db2.gz GCWHMRPGQAPMIW-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO C[N@@H+](Cc1cc2ccncc2[nH]1)Cc1ccno1 ZINC001232096617 977892430 /nfs/dbraw/zinc/89/24/30/977892430.db2.gz GCWHMRPGQAPMIW-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO CNc1ccc(Nc2c[nH+]ccc2OC)c(F)n1 ZINC001203351337 977906634 /nfs/dbraw/zinc/90/66/34/977906634.db2.gz XABZMVOUQAAOFV-UHFFFAOYSA-N 1 2 248.261 2.410 20 0 BEADLO C[C@@]1(F)CCC[N@H+](Cc2cnsc2)C1 ZINC001232223009 977941961 /nfs/dbraw/zinc/94/19/61/977941961.db2.gz BLNVRZKEFZIQOO-SNVBAGLBSA-N 1 2 214.309 2.467 20 0 BEADLO C[C@@]1(F)CCC[N@@H+](Cc2cnsc2)C1 ZINC001232223009 977941973 /nfs/dbraw/zinc/94/19/73/977941973.db2.gz BLNVRZKEFZIQOO-SNVBAGLBSA-N 1 2 214.309 2.467 20 0 BEADLO COc1cc[nH+]cc1Nc1ncc(C)c(C)n1 ZINC001176118268 977943409 /nfs/dbraw/zinc/94/34/09/977943409.db2.gz DIQOVQJPNZUERM-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1ccnc(C(C)(C)C)c1 ZINC001232214808 977943935 /nfs/dbraw/zinc/94/39/35/977943935.db2.gz ZLWMPGLKPNTBJK-UHFFFAOYSA-N 1 2 234.343 2.400 20 0 BEADLO CC(=O)C[N@H+](C)Cc1ccnc(C(C)(C)C)c1 ZINC001232214808 977943945 /nfs/dbraw/zinc/94/39/45/977943945.db2.gz ZLWMPGLKPNTBJK-UHFFFAOYSA-N 1 2 234.343 2.400 20 0 BEADLO COc1cc[nH+]cc1Nc1cncnc1Cl ZINC001176117111 977945974 /nfs/dbraw/zinc/94/59/74/977945974.db2.gz RLEFXNGRXVYEKB-UHFFFAOYSA-N 1 2 236.662 2.277 20 0 BEADLO C[C@H]1C[C@@H](CF)[N@H+](Cc2cnsc2)C1 ZINC001232223322 977949406 /nfs/dbraw/zinc/94/94/06/977949406.db2.gz GWAPOQJOWFTBST-WPRPVWTQSA-N 1 2 214.309 2.323 20 0 BEADLO C[C@H]1C[C@@H](CF)[N@@H+](Cc2cnsc2)C1 ZINC001232223322 977949417 /nfs/dbraw/zinc/94/94/17/977949417.db2.gz GWAPOQJOWFTBST-WPRPVWTQSA-N 1 2 214.309 2.323 20 0 BEADLO COc1cc[nH+]cc1Nc1cc(C)no1 ZINC001176118789 977950523 /nfs/dbraw/zinc/95/05/23/977950523.db2.gz HWJYOSFNBNRUNW-UHFFFAOYSA-N 1 2 205.217 2.130 20 0 BEADLO COc1cc[nH+]cc1Nc1ccc(O)cc1O ZINC001176121797 977956660 /nfs/dbraw/zinc/95/66/60/977956660.db2.gz QEYKFXPYWCPQGN-UHFFFAOYSA-N 1 2 232.239 2.245 20 0 BEADLO COc1cc[nH+]cc1Nc1ccc(N)cc1OC ZINC001176123146 977958853 /nfs/dbraw/zinc/95/88/53/977958853.db2.gz NTZLNCMYCKKSNZ-UHFFFAOYSA-N 1 2 245.282 2.425 20 0 BEADLO COc1cc[nH+]cc1Nc1cccc(CO)c1F ZINC001176122549 977959460 /nfs/dbraw/zinc/95/94/60/977959460.db2.gz ABPSPYFJQRTGAY-UHFFFAOYSA-N 1 2 248.257 2.465 20 0 BEADLO c1ccc2c(c1)ccnc2C[N@@H+]1CCC12COC2 ZINC001232248684 977973470 /nfs/dbraw/zinc/97/34/70/977973470.db2.gz UNAYMCXEZBPLOI-UHFFFAOYSA-N 1 2 240.306 2.210 20 0 BEADLO c1ccc2c(c1)ccnc2C[N@H+]1CCC12COC2 ZINC001232248684 977973483 /nfs/dbraw/zinc/97/34/83/977973483.db2.gz UNAYMCXEZBPLOI-UHFFFAOYSA-N 1 2 240.306 2.210 20 0 BEADLO COCc1ccc(C[N@@H+]2CCC(=O)C[C@H]2C)cc1 ZINC001232298290 977996230 /nfs/dbraw/zinc/99/62/30/977996230.db2.gz HBMXHIIIIHRTMK-GFCCVEGCSA-N 1 2 247.338 2.386 20 0 BEADLO COCc1ccc(C[N@H+]2CCC(=O)C[C@H]2C)cc1 ZINC001232298290 977996234 /nfs/dbraw/zinc/99/62/34/977996234.db2.gz HBMXHIIIIHRTMK-GFCCVEGCSA-N 1 2 247.338 2.386 20 0 BEADLO Cc1cn2cccc(Nc3cnc(C)nc3)c2[nH+]1 ZINC001176393215 978044549 /nfs/dbraw/zinc/04/45/49/978044549.db2.gz OIZPIZLJBZQXBF-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO CN(C)c1ccc(Nc2csc(CO)c2)c[nH+]1 ZINC001176365664 978048714 /nfs/dbraw/zinc/04/87/14/978048714.db2.gz FUFLTHJHUOAFOZ-UHFFFAOYSA-N 1 2 249.339 2.445 20 0 BEADLO Fc1ccc2nc(C[NH+]3CC4(CCC4)C3)cn2c1 ZINC001232410529 978052971 /nfs/dbraw/zinc/05/29/71/978052971.db2.gz HTJLHJWXGASVFO-UHFFFAOYSA-N 1 2 245.301 2.459 20 0 BEADLO Cc1c[nH+]c(Nc2csc(CO)c2)c(N)c1 ZINC001176366542 978054211 /nfs/dbraw/zinc/05/42/11/978054211.db2.gz UQUYQCROQKITNO-UHFFFAOYSA-N 1 2 235.312 2.270 20 0 BEADLO Cc1[nH]c(CN(C)Cc2ccc(C)nc2)c[nH+]1 ZINC001232465801 978107143 /nfs/dbraw/zinc/10/71/43/978107143.db2.gz PZIFWZJCDYNJKJ-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO COC1(C)C[NH+](Cc2c(C)cccc2F)C1 ZINC001232481620 978134600 /nfs/dbraw/zinc/13/46/00/978134600.db2.gz GJJCBTCZQPXRLY-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cccc(F)c1C[N@H+]1CCOC[C@@H]1C ZINC001232482634 978134760 /nfs/dbraw/zinc/13/47/60/978134760.db2.gz SPLONCJILDHDGR-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cccc(F)c1C[N@@H+]1CCOC[C@@H]1C ZINC001232482634 978134767 /nfs/dbraw/zinc/13/47/67/978134767.db2.gz SPLONCJILDHDGR-NSHDSACASA-N 1 2 223.291 2.355 20 0 BEADLO CC[N@H+](Cc1c(C)cccc1F)C1COC1 ZINC001232485579 978137888 /nfs/dbraw/zinc/13/78/88/978137888.db2.gz ZZBCNASSILWHJT-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO CC[N@@H+](Cc1c(C)cccc1F)C1COC1 ZINC001232485579 978137895 /nfs/dbraw/zinc/13/78/95/978137895.db2.gz ZZBCNASSILWHJT-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1ccc(C)c(Nc2cnc3nonc3c2)[nH+]1 ZINC001176689887 978151989 /nfs/dbraw/zinc/15/19/89/978151989.db2.gz PSYBIZINANUBRG-UHFFFAOYSA-N 1 2 241.254 2.373 20 0 BEADLO CCc1nn(C[N@@H+]2CCC(C)(C)C2)c(=S)o1 ZINC001337122366 978173699 /nfs/dbraw/zinc/17/36/99/978173699.db2.gz JXXZUGHXERRYOM-UHFFFAOYSA-N 1 2 241.360 2.457 20 0 BEADLO CCc1nn(C[N@H+]2CCC(C)(C)C2)c(=S)o1 ZINC001337122366 978173703 /nfs/dbraw/zinc/17/37/03/978173703.db2.gz JXXZUGHXERRYOM-UHFFFAOYSA-N 1 2 241.360 2.457 20 0 BEADLO c1cc2cc(C[N@@H+]3CCCC34COC4)ncc2o1 ZINC001232552272 978177606 /nfs/dbraw/zinc/17/76/06/978177606.db2.gz BQNIJVIPOKDGHW-UHFFFAOYSA-N 1 2 244.294 2.193 20 0 BEADLO c1cc2cc(C[N@H+]3CCCC34COC4)ncc2o1 ZINC001232552272 978177617 /nfs/dbraw/zinc/17/76/17/978177617.db2.gz BQNIJVIPOKDGHW-UHFFFAOYSA-N 1 2 244.294 2.193 20 0 BEADLO c1ccc2oc(C[NH+]3CC4(CSC4)C3)nc2c1 ZINC001232559632 978181975 /nfs/dbraw/zinc/18/19/75/978181975.db2.gz YBGBDMPRSMETLL-UHFFFAOYSA-N 1 2 246.335 2.377 20 0 BEADLO Cc1ccc(F)cc1NC(=O)Cc1c[nH]c[nH+]1 ZINC001176825813 978190657 /nfs/dbraw/zinc/19/06/57/978190657.db2.gz AJHBMCQMVPRCBB-UHFFFAOYSA-N 1 2 233.246 2.038 20 0 BEADLO C=Cc1ccc(NC(=O)Cc2c[nH]c[nH+]2)cc1 ZINC001176832611 978196918 /nfs/dbraw/zinc/19/69/18/978196918.db2.gz WSIRVSLYCZUVJO-UHFFFAOYSA-N 1 2 227.267 2.234 20 0 BEADLO COc1cccc(C)c1C[N@H+](C1CC1)C1COC1 ZINC001232625607 978198547 /nfs/dbraw/zinc/19/85/47/978198547.db2.gz QPHVMGBHMOWUOL-UHFFFAOYSA-N 1 2 247.338 2.367 20 0 BEADLO COc1cccc(C)c1C[N@@H+](C1CC1)C1COC1 ZINC001232625607 978198553 /nfs/dbraw/zinc/19/85/53/978198553.db2.gz QPHVMGBHMOWUOL-UHFFFAOYSA-N 1 2 247.338 2.367 20 0 BEADLO CC[N@H+](Cc1c(C)cccc1OC)C1COC1 ZINC001232625622 978200077 /nfs/dbraw/zinc/20/00/77/978200077.db2.gz QVZLKLJFNGESBZ-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO CC[N@@H+](Cc1c(C)cccc1OC)C1COC1 ZINC001232625622 978200083 /nfs/dbraw/zinc/20/00/83/978200083.db2.gz QVZLKLJFNGESBZ-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO COc1cccc(C)c1C[N@@H+]1CCOCC12CC2 ZINC001232623132 978201702 /nfs/dbraw/zinc/20/17/02/978201702.db2.gz JOILEOPOZIICJA-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO COc1cccc(C)c1C[N@H+]1CCOCC12CC2 ZINC001232623132 978201714 /nfs/dbraw/zinc/20/17/14/978201714.db2.gz JOILEOPOZIICJA-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO CC[C@@H](F)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC001337204187 978214163 /nfs/dbraw/zinc/21/41/63/978214163.db2.gz DDWDYVPAXPJEEL-SECBINFHSA-N 1 2 221.235 2.021 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@@H](C(C)=O)C2)cc1 ZINC001204179111 978235283 /nfs/dbraw/zinc/23/52/83/978235283.db2.gz IZKUILPHJHGLNA-OAHLLOKOSA-N 1 2 247.338 2.039 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@@H](C(C)=O)C2)cc1 ZINC001204179111 978235289 /nfs/dbraw/zinc/23/52/89/978235289.db2.gz IZKUILPHJHGLNA-OAHLLOKOSA-N 1 2 247.338 2.039 20 0 BEADLO Cc1cc(F)cc(N2C[C@H](O)CC(C)(C)C2)[nH+]1 ZINC001337239640 978243345 /nfs/dbraw/zinc/24/33/45/978243345.db2.gz NRGXMNJWSRMUOK-LLVKDONJSA-N 1 2 238.306 2.126 20 0 BEADLO Cc1cccnc1[C@@H](C)[NH2+]Cc1cnns1 ZINC001176896535 978253299 /nfs/dbraw/zinc/25/32/99/978253299.db2.gz HUKTWWZBBOBUMZ-SECBINFHSA-N 1 2 234.328 2.092 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1ccnc(Cl)c1C ZINC001232751720 978262749 /nfs/dbraw/zinc/26/27/49/978262749.db2.gz ODDUONXAUHGGPS-UHFFFAOYSA-N 1 2 226.707 2.064 20 0 BEADLO CC(=O)C[N@H+](C)Cc1ccnc(Cl)c1C ZINC001232751720 978262760 /nfs/dbraw/zinc/26/27/60/978262760.db2.gz ODDUONXAUHGGPS-UHFFFAOYSA-N 1 2 226.707 2.064 20 0 BEADLO CCCn1cnc(C[NH+]2CC(C)(C)C2)c1 ZINC001232796442 978282770 /nfs/dbraw/zinc/28/27/70/978282770.db2.gz YPMVWSKFSSELLG-UHFFFAOYSA-N 1 2 207.321 2.135 20 0 BEADLO COc1cc(O)cc(C[N@@H+]2C[C@H](F)C[C@H]2C)c1 ZINC001232801250 978290778 /nfs/dbraw/zinc/29/07/78/978290778.db2.gz FZLMUOWCCVEOQK-MWLCHTKSSA-N 1 2 239.290 2.333 20 0 BEADLO COc1cc(O)cc(C[N@H+]2C[C@H](F)C[C@H]2C)c1 ZINC001232801250 978290791 /nfs/dbraw/zinc/29/07/91/978290791.db2.gz FZLMUOWCCVEOQK-MWLCHTKSSA-N 1 2 239.290 2.333 20 0 BEADLO CCc1[nH]c(CNC(=O)c2cccc(F)c2)c[nH+]1 ZINC001597250761 978304427 /nfs/dbraw/zinc/30/44/27/978304427.db2.gz JISZKGCZEMUPTD-UHFFFAOYSA-N 1 2 247.273 2.041 20 0 BEADLO CCc1[nH]cc(CNC(=O)c2cccc(F)c2)[nH+]1 ZINC001597250761 978304440 /nfs/dbraw/zinc/30/44/40/978304440.db2.gz JISZKGCZEMUPTD-UHFFFAOYSA-N 1 2 247.273 2.041 20 0 BEADLO c1nc2ccc(C[N@H+]3C[C@H]4CC[C@@H](C3)O4)cc2o1 ZINC001232937479 978349677 /nfs/dbraw/zinc/34/96/77/978349677.db2.gz BNVBQORGOFUJBK-TXEJJXNPSA-N 1 2 244.294 2.191 20 0 BEADLO c1nc2ccc(C[N@@H+]3C[C@H]4CC[C@@H](C3)O4)cc2o1 ZINC001232937479 978349691 /nfs/dbraw/zinc/34/96/91/978349691.db2.gz BNVBQORGOFUJBK-TXEJJXNPSA-N 1 2 244.294 2.191 20 0 BEADLO Cc1cccc(C(=O)Nc2c(C)c[nH+]cc2C)n1 ZINC001597676983 978350321 /nfs/dbraw/zinc/35/03/21/978350321.db2.gz NQMAJPVDNPIUOI-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO CSCC[N@H+](C)Cc1ccc(F)c(O)c1F ZINC001232939242 978350581 /nfs/dbraw/zinc/35/05/81/978350581.db2.gz IAWYVMIVGHAOGM-UHFFFAOYSA-N 1 2 247.310 2.465 20 0 BEADLO c1nc2ccc(C[N@@H+]3CCOCC34CC4)cc2o1 ZINC001232945611 978356564 /nfs/dbraw/zinc/35/65/64/978356564.db2.gz ZLDQXXWVVJVVNZ-UHFFFAOYSA-N 1 2 244.294 2.193 20 0 BEADLO c1nc2ccc(C[N@H+]3CCOCC34CC4)cc2o1 ZINC001232945611 978356582 /nfs/dbraw/zinc/35/65/82/978356582.db2.gz ZLDQXXWVVJVVNZ-UHFFFAOYSA-N 1 2 244.294 2.193 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)CC[C@@H]1CCCO1 ZINC001337509830 978382308 /nfs/dbraw/zinc/38/23/08/978382308.db2.gz MRJRADCQKJZUCU-LBPRGKRZSA-N 1 2 248.326 2.018 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H]1C[C@H]1C1CCC1 ZINC001337638773 978438143 /nfs/dbraw/zinc/43/81/43/978438143.db2.gz GHOONNBXIPIWFD-QWHCGFSZSA-N 1 2 244.338 2.495 20 0 BEADLO CC1(C)C[NH+](Cc2cccc(O)c2F)C1 ZINC001233049919 978442245 /nfs/dbraw/zinc/44/22/45/978442245.db2.gz IXZIZYJIZIFPFI-UHFFFAOYSA-N 1 2 209.264 2.373 20 0 BEADLO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1nc2ccccn2n1 ZINC001233069784 978458520 /nfs/dbraw/zinc/45/85/20/978458520.db2.gz GCPPWGFQUUMFBA-NWDGAFQWSA-N 1 2 244.342 2.350 20 0 BEADLO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1nc2ccccn2n1 ZINC001233069784 978458530 /nfs/dbraw/zinc/45/85/30/978458530.db2.gz GCPPWGFQUUMFBA-NWDGAFQWSA-N 1 2 244.342 2.350 20 0 BEADLO CCC1CC[NH+](Cc2nc3ccccn3n2)CC1 ZINC001233069389 978459694 /nfs/dbraw/zinc/45/96/94/978459694.db2.gz UIPDJGCLEKZKJG-UHFFFAOYSA-N 1 2 244.342 2.351 20 0 BEADLO Cc1cc(C)c(NC(=O)[C@@H](C)n2cc[nH+]c2)cn1 ZINC001177922563 978471799 /nfs/dbraw/zinc/47/17/99/978471799.db2.gz WCNUQAMOSPYTMM-LLVKDONJSA-N 1 2 244.298 2.095 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(=O)[C@@H](C)CC2)cnc1C ZINC001233156075 978476784 /nfs/dbraw/zinc/47/67/84/978476784.db2.gz HWUOUFVMAGHJDF-NSHDSACASA-N 1 2 246.354 2.499 20 0 BEADLO Cc1cc(C[N@H+]2CCC(=O)[C@@H](C)CC2)cnc1C ZINC001233156075 978476789 /nfs/dbraw/zinc/47/67/89/978476789.db2.gz HWUOUFVMAGHJDF-NSHDSACASA-N 1 2 246.354 2.499 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cnccn2)cnc1C ZINC001233162181 978482273 /nfs/dbraw/zinc/48/22/73/978482273.db2.gz VSXARIRFTTUILN-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cnccn2)cnc1C ZINC001233162181 978482279 /nfs/dbraw/zinc/48/22/79/978482279.db2.gz VSXARIRFTTUILN-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO CO[C@H]1CN(c2cc(F)cc(C)[nH+]2)CC[C@@H]1C ZINC001337844720 978523543 /nfs/dbraw/zinc/52/35/43/978523543.db2.gz DQQKZVZAFDIVPY-CABZTGNLSA-N 1 2 238.306 2.390 20 0 BEADLO Cc1cc(C[N@H+]2CCOC[C@@H]2C(C)C)sn1 ZINC001233312251 978537972 /nfs/dbraw/zinc/53/79/72/978537972.db2.gz HJRSOZNOSSHAQL-GFCCVEGCSA-N 1 2 240.372 2.308 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC[C@@H]2C(C)C)sn1 ZINC001233312251 978537977 /nfs/dbraw/zinc/53/79/77/978537977.db2.gz HJRSOZNOSSHAQL-GFCCVEGCSA-N 1 2 240.372 2.308 20 0 BEADLO Cc1cc(F)cc(N2CCO[C@@H](CCF)C2)[nH+]1 ZINC001337936114 978570780 /nfs/dbraw/zinc/57/07/80/978570780.db2.gz UUKXYCXVCYDGBK-NSHDSACASA-N 1 2 242.269 2.094 20 0 BEADLO Clc1cccc2ncc(C[NH+]3CC=CC3)n21 ZINC001233355603 978571822 /nfs/dbraw/zinc/57/18/22/978571822.db2.gz DSOLJBNRCJXBRV-UHFFFAOYSA-N 1 2 233.702 2.360 20 0 BEADLO Cc1ncc(C[N@@H+]2CCC(=O)[C@H]3CCCC[C@@H]32)o1 ZINC001233364812 978572672 /nfs/dbraw/zinc/57/26/72/978572672.db2.gz DVTZIOOGYYZOCB-STQMWFEESA-N 1 2 248.326 2.317 20 0 BEADLO Cc1ncc(C[N@H+]2CCC(=O)[C@H]3CCCC[C@@H]32)o1 ZINC001233364812 978572676 /nfs/dbraw/zinc/57/26/76/978572676.db2.gz DVTZIOOGYYZOCB-STQMWFEESA-N 1 2 248.326 2.317 20 0 BEADLO CC[N@H+](Cc1cnc(C)o1)Cc1cccnc1 ZINC001233367303 978580256 /nfs/dbraw/zinc/58/02/56/978580256.db2.gz YRAUVNXRTIOOFK-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1cnc(C)o1)Cc1cccnc1 ZINC001233367303 978580260 /nfs/dbraw/zinc/58/02/60/978580260.db2.gz YRAUVNXRTIOOFK-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO C[C@@H]1c2cccn2CCN1Cc1cccc(N)[nH+]1 ZINC001233371854 978586872 /nfs/dbraw/zinc/58/68/72/978586872.db2.gz LDZBXWMPWIZFFU-LLVKDONJSA-N 1 2 242.326 2.042 20 0 BEADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1cccc(N)n1 ZINC001233371854 978586879 /nfs/dbraw/zinc/58/68/79/978586879.db2.gz LDZBXWMPWIZFFU-LLVKDONJSA-N 1 2 242.326 2.042 20 0 BEADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1cccc(N)n1 ZINC001233371854 978586884 /nfs/dbraw/zinc/58/68/84/978586884.db2.gz LDZBXWMPWIZFFU-LLVKDONJSA-N 1 2 242.326 2.042 20 0 BEADLO CCc1ccc(N2CCO[C@@H](C)CC2)[nH+]c1 ZINC001338096190 978612143 /nfs/dbraw/zinc/61/21/43/978612143.db2.gz IYJWDUKEGYPBMP-NSHDSACASA-N 1 2 220.316 2.259 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H]1CC[C@H](C)C1 ZINC001338243445 978642397 /nfs/dbraw/zinc/64/23/97/978642397.db2.gz OMSUDWAKPRIHJN-CABZTGNLSA-N 1 2 232.327 2.495 20 0 BEADLO C=C/C=C\CC(=O)NCc1[nH]c2c([nH+]1)CCCC2 ZINC001178922737 978647442 /nfs/dbraw/zinc/64/74/42/978647442.db2.gz WAWZCWZQWICLGG-ARJAWSKDSA-N 1 2 245.326 2.037 20 0 BEADLO C[NH+]1CC(Oc2cccc3ncc(F)cc32)C1 ZINC001233632222 978652589 /nfs/dbraw/zinc/65/25/89/978652589.db2.gz GLYFNCQHAPYILY-UHFFFAOYSA-N 1 2 232.258 2.067 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)C[C@@H]1C[C@H]1C1CC1 ZINC001338988442 978767017 /nfs/dbraw/zinc/76/70/17/978767017.db2.gz SOTNRZBOCWKCPE-STQMWFEESA-N 1 2 244.338 2.495 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H]1CC1(C)C ZINC001339102994 978795537 /nfs/dbraw/zinc/79/55/37/978795537.db2.gz MEDQPORBTUOSPG-JTQLQIEISA-N 1 2 218.300 2.105 20 0 BEADLO CCOC(=[NH2+])c1ccc(O[C@@H](C)C(C)=O)cc1 ZINC001234587799 978865014 /nfs/dbraw/zinc/86/50/14/978865014.db2.gz DBRXISOYEFPSLD-JTQLQIEISA-N 1 2 235.283 2.405 20 0 BEADLO Cc1cc2cccnc2c(OC2C[NH+](C)C2)c1 ZINC001234609725 978873140 /nfs/dbraw/zinc/87/31/40/978873140.db2.gz RUNJSBWVQDJYLT-UHFFFAOYSA-N 1 2 228.295 2.236 20 0 BEADLO Cc1cc(F)cc(N2CC[C@@]3(CCOC3)C2)[nH+]1 ZINC001339611303 978881227 /nfs/dbraw/zinc/88/12/27/978881227.db2.gz YHDSDKIJFGCXMS-CYBMUJFWSA-N 1 2 236.290 2.146 20 0 BEADLO CC(C)(C)CC[N@@H+]1CCCCC12CNC2 ZINC001235101686 978975301 /nfs/dbraw/zinc/97/53/01/978975301.db2.gz DEODNYLHYVHJGG-UHFFFAOYSA-N 1 2 210.365 2.251 20 0 BEADLO CC(C)(C)CC[N@H+]1CCCCC12CNC2 ZINC001235101686 978975308 /nfs/dbraw/zinc/97/53/08/978975308.db2.gz DEODNYLHYVHJGG-UHFFFAOYSA-N 1 2 210.365 2.251 20 0 BEADLO Fc1cccc2cc(C[NH+]3CC4(COC4)C3)[nH]c21 ZINC001235233454 979003379 /nfs/dbraw/zinc/00/33/79/979003379.db2.gz FLUVQLFDIIMAQI-UHFFFAOYSA-N 1 2 246.285 2.139 20 0 BEADLO Cc1ncn(C)c1C[N@@H+]1CCn2cccc2[C@@H]1C ZINC001235550797 979094433 /nfs/dbraw/zinc/09/44/33/979094433.db2.gz YGYHKRMBZSCWBX-LBPRGKRZSA-N 1 2 244.342 2.107 20 0 BEADLO Cc1ncn(C)c1C[N@H+]1CCn2cccc2[C@@H]1C ZINC001235550797 979094437 /nfs/dbraw/zinc/09/44/37/979094437.db2.gz YGYHKRMBZSCWBX-LBPRGKRZSA-N 1 2 244.342 2.107 20 0 BEADLO Cc1ncn(C)c1C[N@H+](C)Cc1cccnc1C ZINC001235555567 979099731 /nfs/dbraw/zinc/09/97/31/979099731.db2.gz JEXBLVFIIXSWQN-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1ncn(C)c1C[N@@H+](C)Cc1cccnc1C ZINC001235555567 979099737 /nfs/dbraw/zinc/09/97/37/979099737.db2.gz JEXBLVFIIXSWQN-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1ncn(C)c1C[N@H+](C)Cc1ccc(C)nc1 ZINC001235554939 979100343 /nfs/dbraw/zinc/10/03/43/979100343.db2.gz GDAXKPPSUAFDFY-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1ncn(C)c1C[N@@H+](C)Cc1ccc(C)nc1 ZINC001235554939 979100353 /nfs/dbraw/zinc/10/03/53/979100353.db2.gz GDAXKPPSUAFDFY-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)COC1CCCC1 ZINC001340811469 979116496 /nfs/dbraw/zinc/11/64/96/979116496.db2.gz YLFACOVIYUJHCW-UHFFFAOYSA-N 1 2 248.326 2.018 20 0 BEADLO CC(=O)[C@@H]1CCC[N@@H+]1Cc1ccc(F)nc1C ZINC001235819864 979160165 /nfs/dbraw/zinc/16/01/65/979160165.db2.gz RGNBESQYSUHCPK-LBPRGKRZSA-N 1 2 236.290 2.083 20 0 BEADLO CC(=O)[C@@H]1CCC[N@H+]1Cc1ccc(F)nc1C ZINC001235819864 979160169 /nfs/dbraw/zinc/16/01/69/979160169.db2.gz RGNBESQYSUHCPK-LBPRGKRZSA-N 1 2 236.290 2.083 20 0 BEADLO COc1nccc(C[N@@H+]2CC[C@@H]2C)c1Cl ZINC001235829463 979163220 /nfs/dbraw/zinc/16/32/20/979163220.db2.gz FCWPNAFMEBGOKU-QMMMGPOBSA-N 1 2 226.707 2.338 20 0 BEADLO COc1nccc(C[N@H+]2CC[C@@H]2C)c1Cl ZINC001235829463 979163222 /nfs/dbraw/zinc/16/32/22/979163222.db2.gz FCWPNAFMEBGOKU-QMMMGPOBSA-N 1 2 226.707 2.338 20 0 BEADLO COc1nccnc1Nc1ccc(C)[nH+]c1C ZINC001203368102 979328977 /nfs/dbraw/zinc/32/89/77/979328977.db2.gz UQQFVSQOFBLKDK-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO CCC1(CC)C[C@@H]1C(=O)NCCc1[nH]cc(C)[nH+]1 ZINC001181886012 979356937 /nfs/dbraw/zinc/35/69/37/979356937.db2.gz GCAIAUYTPRDALM-LLVKDONJSA-N 1 2 249.358 2.203 20 0 BEADLO Nc1cc(-c2cccnc2N2CCCC2)cc[nH+]1 ZINC001236125791 979403197 /nfs/dbraw/zinc/40/31/97/979403197.db2.gz QPLPYHCJGGSKNJ-UHFFFAOYSA-N 1 2 240.310 2.326 20 0 BEADLO Cc1ccc(F)c(C[N@H+](C)CCO)c1Cl ZINC001236254284 979471546 /nfs/dbraw/zinc/47/15/46/979471546.db2.gz WIEQQNFGDNMMAJ-UHFFFAOYSA-N 1 2 231.698 2.212 20 0 BEADLO Cc1ccc(F)c(C[N@@H+](C)CCO)c1Cl ZINC001236254284 979471550 /nfs/dbraw/zinc/47/15/50/979471550.db2.gz WIEQQNFGDNMMAJ-UHFFFAOYSA-N 1 2 231.698 2.212 20 0 BEADLO C[C@H]1c2ccc(-c3ccc(N)[nH+]c3)cc2NC1=O ZINC001236312129 979517811 /nfs/dbraw/zinc/51/78/11/979517811.db2.gz JMLAMFVEZODMLM-QMMMGPOBSA-N 1 2 239.278 2.386 20 0 BEADLO Cc1cc(-c2ccc(N)nc2)cn2cc[nH+]c12 ZINC001236312997 979519917 /nfs/dbraw/zinc/51/99/17/979519917.db2.gz FVDVQFNSTCFUII-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO Nc1ccc(-c2ccc3ncncc3c2)c[nH+]1 ZINC001236313738 979523973 /nfs/dbraw/zinc/52/39/73/979523973.db2.gz ZNMMZYBJTJQUCX-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO Nc1ccc(-c2ccc3c(c2)[C@H](O)CCO3)c[nH+]1 ZINC001236313802 979524543 /nfs/dbraw/zinc/52/45/43/979524543.db2.gz YUIXYBVYBHWGOT-GFCCVEGCSA-N 1 2 242.278 2.147 20 0 BEADLO C=CC(=O)Oc1ccc(-c2ccc(N)[nH+]c2)cc1 ZINC001236315881 979529253 /nfs/dbraw/zinc/52/92/53/979529253.db2.gz DDWCZMNYXLSRNK-UHFFFAOYSA-N 1 2 240.262 2.422 20 0 BEADLO CCC(=O)Nc1cc(-c2ccc(N)[nH+]c2)ccn1 ZINC001236317410 979533778 /nfs/dbraw/zinc/53/37/78/979533778.db2.gz LOTHHMPMZDGKAC-UHFFFAOYSA-N 1 2 242.282 2.074 20 0 BEADLO C[S@@](=N)(=O)c1ccc(-c2ccc(N)[nH+]c2)cc1 ZINC001236317760 979533936 /nfs/dbraw/zinc/53/39/36/979533936.db2.gz VNAPBFYEFNEQKT-QGZVFWFLSA-N 1 2 247.323 2.366 20 0 BEADLO Cc1cc(NC[C@@H](C)O)[nH+]c2ccccc12 ZINC000072112205 979593681 /nfs/dbraw/zinc/59/36/81/979593681.db2.gz AXXXVHCHAXOOME-SNVBAGLBSA-N 1 2 216.284 2.336 20 0 BEADLO CCOc1cncc(C[N@@H+]2CCC[C@H]2C(C)=O)c1 ZINC001236844182 979752177 /nfs/dbraw/zinc/75/21/77/979752177.db2.gz WHYLJYORKVHSLO-AWEZNQCLSA-N 1 2 248.326 2.034 20 0 BEADLO CCOc1cncc(C[N@H+]2CCC[C@H]2C(C)=O)c1 ZINC001236844182 979752189 /nfs/dbraw/zinc/75/21/89/979752189.db2.gz WHYLJYORKVHSLO-AWEZNQCLSA-N 1 2 248.326 2.034 20 0 BEADLO CCOc1cncc(C[N@@H+]2C[C@@H](F)C[C@H]2C)c1 ZINC001236838901 979755713 /nfs/dbraw/zinc/75/57/13/979755713.db2.gz WDSCNKMZNZIRMX-PWSUYJOCSA-N 1 2 238.306 2.413 20 0 BEADLO CCOc1cncc(C[N@H+]2C[C@@H](F)C[C@H]2C)c1 ZINC001236838901 979755721 /nfs/dbraw/zinc/75/57/21/979755721.db2.gz WDSCNKMZNZIRMX-PWSUYJOCSA-N 1 2 238.306 2.413 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@H](C)c2ccccn2)[nH]n1 ZINC001342420489 979798218 /nfs/dbraw/zinc/79/82/18/979798218.db2.gz IVTKZUGQFZTKHP-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO Cc1cc(C[N@H+](C)[C@H](C)c2ccccn2)[nH]n1 ZINC001342420489 979798227 /nfs/dbraw/zinc/79/82/27/979798227.db2.gz IVTKZUGQFZTKHP-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO C[C@@H]1CN(CC2OC=CC2=S)C[C@H](C)[N@H+]1C ZINC001237191612 979840212 /nfs/dbraw/zinc/84/02/12/979840212.db2.gz MSXRVCBZIBDARE-AOOOYVTPSA-N 1 2 240.372 2.093 20 0 BEADLO C[C@@H]1CN(CC2OC=CC2=S)C[C@H](C)[N@@H+]1C ZINC001237191612 979840216 /nfs/dbraw/zinc/84/02/16/979840216.db2.gz MSXRVCBZIBDARE-AOOOYVTPSA-N 1 2 240.372 2.093 20 0 BEADLO Nc1cccc(C[N@@H+]2CCC(F)(F)[C@H](F)C2)c1 ZINC001237216612 979849196 /nfs/dbraw/zinc/84/91/96/979849196.db2.gz FXRAEXBPLZZXCJ-LLVKDONJSA-N 1 2 244.260 2.448 20 0 BEADLO Nc1cccc(C[N@H+]2CCC(F)(F)[C@H](F)C2)c1 ZINC001237216612 979849200 /nfs/dbraw/zinc/84/92/00/979849200.db2.gz FXRAEXBPLZZXCJ-LLVKDONJSA-N 1 2 244.260 2.448 20 0 BEADLO Cc1cc(F)cc(C)c1C[N@@H+]1CCO[C@@H]2C[C@@H]21 ZINC001237327083 979870435 /nfs/dbraw/zinc/87/04/35/979870435.db2.gz YMXCPZOVLBHZMK-UONOGXRCSA-N 1 2 235.302 2.416 20 0 BEADLO Cc1cc(F)cc(C)c1C[N@H+]1CCO[C@@H]2C[C@@H]21 ZINC001237327083 979870439 /nfs/dbraw/zinc/87/04/39/979870439.db2.gz YMXCPZOVLBHZMK-UONOGXRCSA-N 1 2 235.302 2.416 20 0 BEADLO CCc1cccc(C)c1C[NH+]1CC(OC(C)=O)C1 ZINC001237327869 979870655 /nfs/dbraw/zinc/87/06/55/979870655.db2.gz ULCGQUBUEQLWEN-UHFFFAOYSA-N 1 2 247.338 2.305 20 0 BEADLO c1c2ccccn2nc1C[NH+]1CC2(CCC2)C1 ZINC001237439678 979891301 /nfs/dbraw/zinc/89/13/01/979891301.db2.gz VAVNHBXOFKALBT-UHFFFAOYSA-N 1 2 227.311 2.320 20 0 BEADLO COc1c(C)cccc1C[N@H+](C)CC(C)=O ZINC001237500696 979921209 /nfs/dbraw/zinc/92/12/09/979921209.db2.gz LIBWWEKJGSAKSD-UHFFFAOYSA-N 1 2 221.300 2.024 20 0 BEADLO COc1c(C)cccc1C[N@@H+](C)CC(C)=O ZINC001237500696 979921217 /nfs/dbraw/zinc/92/12/17/979921217.db2.gz LIBWWEKJGSAKSD-UHFFFAOYSA-N 1 2 221.300 2.024 20 0 BEADLO COc1c(C)cccc1C[N@@H+]1CCO[C@@H](C)C1 ZINC001237498994 979922771 /nfs/dbraw/zinc/92/27/71/979922771.db2.gz AQURAZRSPRYMNS-LBPRGKRZSA-N 1 2 235.327 2.224 20 0 BEADLO COc1c(C)cccc1C[N@H+]1CCO[C@@H](C)C1 ZINC001237498994 979922776 /nfs/dbraw/zinc/92/27/76/979922776.db2.gz AQURAZRSPRYMNS-LBPRGKRZSA-N 1 2 235.327 2.224 20 0 BEADLO COc1ccc(OC)c(C[NH+]2CCC2)c1F ZINC001237567716 979941109 /nfs/dbraw/zinc/94/11/09/979941109.db2.gz GHAVDWMIOHKUDK-UHFFFAOYSA-N 1 2 225.263 2.049 20 0 BEADLO COc1ccc(OC)c(C[NH+]2CC=CC2)c1F ZINC001237568911 979941486 /nfs/dbraw/zinc/94/14/86/979941486.db2.gz JHQWSXZBMLHNHZ-UHFFFAOYSA-N 1 2 237.274 2.215 20 0 BEADLO COc1ccc(OC)c(C[N@@H+]2CC[C@@H]2C)c1F ZINC001237573875 979942992 /nfs/dbraw/zinc/94/29/92/979942992.db2.gz XYXHDVQTMMVPSF-VIFPVBQESA-N 1 2 239.290 2.437 20 0 BEADLO Cc1coc(C[N@@H+]2CCC[C@H](C(F)F)C2)n1 ZINC001237645347 979977240 /nfs/dbraw/zinc/97/72/40/979977240.db2.gz KRJATZOCCKHKGI-VIFPVBQESA-N 1 2 230.258 2.460 20 0 BEADLO Cc1coc(C[N@H+]2CCC[C@H](C(F)F)C2)n1 ZINC001237645347 979977243 /nfs/dbraw/zinc/97/72/43/979977243.db2.gz KRJATZOCCKHKGI-VIFPVBQESA-N 1 2 230.258 2.460 20 0 BEADLO C[N@H+](CCF)Cc1ccnc(OC(F)F)c1 ZINC001237618858 979978782 /nfs/dbraw/zinc/97/87/82/979978782.db2.gz KIFHQBMRQWNCIK-UHFFFAOYSA-N 1 2 234.221 2.084 20 0 BEADLO C[N@@H+](CCF)Cc1ccnc(OC(F)F)c1 ZINC001237618858 979978784 /nfs/dbraw/zinc/97/87/84/979978784.db2.gz KIFHQBMRQWNCIK-UHFFFAOYSA-N 1 2 234.221 2.084 20 0 BEADLO Cc1cccnc1[C@@H](C)[NH2+][C@@H]1CCn2ccnc21 ZINC001184292459 980016935 /nfs/dbraw/zinc/01/69/35/980016935.db2.gz ZSDYRGYXWXWYCC-VXGBXAGGSA-N 1 2 242.326 2.382 20 0 BEADLO COc1ccc(C)c(C[N@@H+]2CCC(=O)[C@@H](C)C2)c1 ZINC001237706577 980029520 /nfs/dbraw/zinc/02/95/20/980029520.db2.gz BNWJOKPWTDQSMW-LBPRGKRZSA-N 1 2 247.338 2.415 20 0 BEADLO COc1ccc(C)c(C[N@H+]2CCC(=O)[C@@H](C)C2)c1 ZINC001237706577 980029524 /nfs/dbraw/zinc/02/95/24/980029524.db2.gz BNWJOKPWTDQSMW-LBPRGKRZSA-N 1 2 247.338 2.415 20 0 BEADLO O=C1CCC[N@H+](Cc2cccc3c2OCC3)CC1 ZINC001237742079 980040551 /nfs/dbraw/zinc/04/05/51/980040551.db2.gz IYWXBSSNOPYNTM-UHFFFAOYSA-N 1 2 245.322 2.177 20 0 BEADLO O=C1CCC[N@@H+](Cc2cccc3c2OCC3)CC1 ZINC001237742079 980040557 /nfs/dbraw/zinc/04/05/57/980040557.db2.gz IYWXBSSNOPYNTM-UHFFFAOYSA-N 1 2 245.322 2.177 20 0 BEADLO Cc1nc(C[NH+]2CCSCC2)ccc1F ZINC001237819221 980063824 /nfs/dbraw/zinc/06/38/24/980063824.db2.gz LGWGAOXBRIDXIT-UHFFFAOYSA-N 1 2 226.320 2.078 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)s1 ZINC001237822678 980069457 /nfs/dbraw/zinc/06/94/57/980069457.db2.gz FLKDMOBBHJYQGX-LSJOCFKGSA-N 1 2 240.347 2.495 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)s1 ZINC001237822678 980069466 /nfs/dbraw/zinc/06/94/66/980069466.db2.gz FLKDMOBBHJYQGX-LSJOCFKGSA-N 1 2 240.347 2.495 20 0 BEADLO Cc1sccc1C[N@@H+]1CCC(=O)[C@@H](C)C1 ZINC001237964342 980117358 /nfs/dbraw/zinc/11/73/58/980117358.db2.gz JWGBOKDDEFLEOF-VIFPVBQESA-N 1 2 223.341 2.467 20 0 BEADLO Cc1sccc1C[N@H+]1CCC(=O)[C@@H](C)C1 ZINC001237964342 980117361 /nfs/dbraw/zinc/11/73/61/980117361.db2.gz JWGBOKDDEFLEOF-VIFPVBQESA-N 1 2 223.341 2.467 20 0 BEADLO C[NH+](C)Cc1cncc(Cl)c1Cl ZINC001238007643 980126227 /nfs/dbraw/zinc/12/62/27/980126227.db2.gz MBGQHSZBKUKAAI-UHFFFAOYSA-N 1 2 205.088 2.450 20 0 BEADLO Cc1c[nH]c(CCNC(=O)[C@H]2CCC(C)(C)C2)[nH+]1 ZINC001185172380 980188061 /nfs/dbraw/zinc/18/80/61/980188061.db2.gz HQXQZRLEOYJKDJ-NSHDSACASA-N 1 2 249.358 2.203 20 0 BEADLO CC[N@H+](Cc1ccccn1)Cc1cncnc1C ZINC001238171735 980202597 /nfs/dbraw/zinc/20/25/97/980202597.db2.gz BCZHMLRYSFDVRG-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO CC[N@@H+](Cc1ccccn1)Cc1cncnc1C ZINC001238171735 980202603 /nfs/dbraw/zinc/20/26/03/980202603.db2.gz BCZHMLRYSFDVRG-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO C[C@H]1C[N@H+](Cc2cncc(C3CC3)c2)CCO1 ZINC001238181142 980214839 /nfs/dbraw/zinc/21/48/39/980214839.db2.gz DIXMDERZLPXWPE-NSHDSACASA-N 1 2 232.327 2.180 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cncc(C3CC3)c2)CCO1 ZINC001238181142 980214846 /nfs/dbraw/zinc/21/48/46/980214846.db2.gz DIXMDERZLPXWPE-NSHDSACASA-N 1 2 232.327 2.180 20 0 BEADLO CC/C=C(/C)C(=O)OCCCc1c[nH+]cn1C ZINC001343725094 980221447 /nfs/dbraw/zinc/22/14/47/980221447.db2.gz MXFIMDLXYGCLOO-WDZFZDKYSA-N 1 2 236.315 2.252 20 0 BEADLO Fc1ccnc(Cl)c1C[N@@H+]1C[C@@H]2C[C@@H]2C1 ZINC001238225861 980230371 /nfs/dbraw/zinc/23/03/71/980230371.db2.gz XNTOQICZQRPFDF-OCAPTIKFSA-N 1 2 226.682 2.326 20 0 BEADLO Fc1ccnc(Cl)c1C[N@H+]1C[C@@H]2C[C@@H]2C1 ZINC001238225861 980230380 /nfs/dbraw/zinc/23/03/80/980230380.db2.gz XNTOQICZQRPFDF-OCAPTIKFSA-N 1 2 226.682 2.326 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@H]2C)c(F)c1O ZINC001238357399 980242040 /nfs/dbraw/zinc/24/20/40/980242040.db2.gz JWQLBLDMNGWBCX-MRVPVSSYSA-N 1 2 225.263 2.134 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@H]2C)c(F)c1O ZINC001238357399 980242050 /nfs/dbraw/zinc/24/20/50/980242050.db2.gz JWQLBLDMNGWBCX-MRVPVSSYSA-N 1 2 225.263 2.134 20 0 BEADLO Cc1cnc(C[N@@H+]2CCOC3(CC3)C2)c(C)c1 ZINC001238434810 980263799 /nfs/dbraw/zinc/26/37/99/980263799.db2.gz IMUWKSLJTGVRED-UHFFFAOYSA-N 1 2 232.327 2.063 20 0 BEADLO Cc1cnc(C[N@H+]2CCOC3(CC3)C2)c(C)c1 ZINC001238434810 980263804 /nfs/dbraw/zinc/26/38/04/980263804.db2.gz IMUWKSLJTGVRED-UHFFFAOYSA-N 1 2 232.327 2.063 20 0 BEADLO COc1cnc(C[N@H+](C)C2CC2)c(Cl)c1 ZINC001238482061 980277184 /nfs/dbraw/zinc/27/71/84/980277184.db2.gz BJIHCHDRCRMBQY-UHFFFAOYSA-N 1 2 226.707 2.338 20 0 BEADLO COc1cnc(C[N@@H+](C)C2CC2)c(Cl)c1 ZINC001238482061 980277192 /nfs/dbraw/zinc/27/71/92/980277192.db2.gz BJIHCHDRCRMBQY-UHFFFAOYSA-N 1 2 226.707 2.338 20 0 BEADLO Cc1cc(C[N@H+]2CCOC[C@@H]2C)cnc1C1CC1 ZINC001238620843 980303288 /nfs/dbraw/zinc/30/32/88/980303288.db2.gz PROOHHAJDBLVIW-LBPRGKRZSA-N 1 2 246.354 2.488 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC[C@@H]2C)cnc1C1CC1 ZINC001238620843 980303295 /nfs/dbraw/zinc/30/32/95/980303295.db2.gz PROOHHAJDBLVIW-LBPRGKRZSA-N 1 2 246.354 2.488 20 0 BEADLO COc1cc(C)c(C)cc1C[NH+]1CCOCC1 ZINC001238757764 980316960 /nfs/dbraw/zinc/31/69/60/980316960.db2.gz GTGLWEWJXUNLBW-UHFFFAOYSA-N 1 2 235.327 2.144 20 0 BEADLO CC(C)Oc1cc(C[NH+]2CC(C)C2)c(F)cn1 ZINC001238793244 980324986 /nfs/dbraw/zinc/32/49/86/980324986.db2.gz GVAOYXPXGGHNES-UHFFFAOYSA-N 1 2 238.306 2.460 20 0 BEADLO Nc1cc(-c2ccc(F)c3n[nH]cc32)cc[nH+]1 ZINC001205342646 980330782 /nfs/dbraw/zinc/33/07/82/980330782.db2.gz SMBDJOYGBVXWFA-UHFFFAOYSA-N 1 2 228.230 2.346 20 0 BEADLO CC[C@@H]1CCC[C@H](C)N1C(=O)C[C@H]([NH3+])C(F)F ZINC001344067808 980335963 /nfs/dbraw/zinc/33/59/63/980335963.db2.gz IUVMREBKAOEEQE-AEJSXWLSSA-N 1 2 248.317 2.149 20 0 BEADLO CC(C)[C@@H](F)C(=O)OCC(C)(C)n1cc[nH+]c1 ZINC001344105987 980350082 /nfs/dbraw/zinc/35/00/82/980350082.db2.gz CGPWTPQKTPBQQJ-SNVBAGLBSA-N 1 2 242.294 2.156 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)Nc1ccccc1Cl ZINC000074673503 980382819 /nfs/dbraw/zinc/38/28/19/980382819.db2.gz KCMGXOWWJRUTCA-UHFFFAOYSA-N 1 2 235.674 2.244 20 0 BEADLO COc1cnc(F)cc1-c1cc[nH+]c2c1CCN2 ZINC001239041032 980420845 /nfs/dbraw/zinc/42/08/45/980420845.db2.gz SWSAUFKPYCDAPL-UHFFFAOYSA-N 1 2 245.257 2.259 20 0 BEADLO COc1cnc(F)cc1-c1c[nH+]c(N)c(C)c1 ZINC001239036231 980420966 /nfs/dbraw/zinc/42/09/66/980420966.db2.gz KNMYGUNGEQCMPW-UHFFFAOYSA-N 1 2 233.246 2.182 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2ccnn2C)c1 ZINC001203654072 980477620 /nfs/dbraw/zinc/47/76/20/980477620.db2.gz CCJWDGVKGMXNDG-UHFFFAOYSA-N 1 2 202.261 2.176 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2cc(=O)[nH]c(=S)[nH]2)c1 ZINC001203656053 980495342 /nfs/dbraw/zinc/49/53/42/980495342.db2.gz JEWTUKQTKBWBSD-UHFFFAOYSA-N 1 2 248.311 2.226 20 0 BEADLO c1cn(-c2ccc(C3=CCOC3)cc2)c[nH+]1 ZINC001239480107 980622263 /nfs/dbraw/zinc/62/22/63/980622263.db2.gz BHBCWDYRKVBVSG-UHFFFAOYSA-N 1 2 212.252 2.286 20 0 BEADLO C[C@H](c1nnc(C[NH+](C)C)o1)C(C)(C)C ZINC001345940930 980714790 /nfs/dbraw/zinc/71/47/90/980714790.db2.gz HLTWIMIZPFQAIM-MRVPVSSYSA-N 1 2 211.309 2.281 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@@H]1CCC1(C)C ZINC001345995908 980726745 /nfs/dbraw/zinc/72/67/45/980726745.db2.gz KHHIKGYZAIRHKV-NSHDSACASA-N 1 2 236.315 2.382 20 0 BEADLO Fc1ccc(F)c(CCn2cc[nH+]c2)c1 ZINC001250315048 980752758 /nfs/dbraw/zinc/75/27/58/980752758.db2.gz BWUHQDPFTMZJON-UHFFFAOYSA-N 1 2 208.211 2.404 20 0 BEADLO c1cn2cc(Cc3ccccn3)ccc2[nH+]1 ZINC001250318713 980757002 /nfs/dbraw/zinc/75/70/02/980757002.db2.gz GSBUSPHOSYQYSU-UHFFFAOYSA-N 1 2 209.252 2.320 20 0 BEADLO Cc1[nH]c2ccc(Cn3cnc(Cl)n3)cc2[nH+]1 ZINC001189450043 980792790 /nfs/dbraw/zinc/79/27/90/980792790.db2.gz MUFCHINQALOOGM-UHFFFAOYSA-N 1 2 247.689 2.165 20 0 BEADLO C[NH+](C)Cc1nnc([C@H]2CCC(F)(F)C2)o1 ZINC001346661411 980877126 /nfs/dbraw/zinc/87/71/26/980877126.db2.gz BHHFVLYSFNBXHW-ZETCQYMHSA-N 1 2 231.246 2.034 20 0 BEADLO COC(=O)c1cccc(/C(C)=C/C=C/[NH3+])c1 ZINC001239732793 980882167 /nfs/dbraw/zinc/88/21/67/980882167.db2.gz XMEUTQLPZLBLBO-DXNUHORPSA-N 1 2 217.268 2.349 20 0 BEADLO CC(C)CC[C@H]1CCC[C@H]1[NH2+]Cc1ncn[nH]1 ZINC001347114020 980974179 /nfs/dbraw/zinc/97/41/79/980974179.db2.gz NXYUFYLFLJPHBB-VXGBXAGGSA-N 1 2 236.363 2.499 20 0 BEADLO COc1ncccc1-c1ccc2[nH+]ccn2c1 ZINC001239855426 980995083 /nfs/dbraw/zinc/99/50/83/980995083.db2.gz DYMFZQZAAGUKOJ-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO CC(=O)OC1C[NH+](Cc2ccc(C)cc2C)C1 ZINC001203735972 980998686 /nfs/dbraw/zinc/99/86/86/980998686.db2.gz KZRKFPZKOCVPKG-UHFFFAOYSA-N 1 2 233.311 2.051 20 0 BEADLO COCc1cccc(-c2c[nH+]cn2C)c1 ZINC001239935498 981046285 /nfs/dbraw/zinc/04/62/85/981046285.db2.gz NDADCPNMHQCHSO-UHFFFAOYSA-N 1 2 202.257 2.234 20 0 BEADLO C[C@@H](C[N@H+]1CCOCC12CC2)C(F)(F)F ZINC000335926568 981152556 /nfs/dbraw/zinc/15/25/56/981152556.db2.gz LWBQMOQDHGJCSN-QMMMGPOBSA-N 1 2 223.238 2.050 20 0 BEADLO C[C@@H](C(=O)N1CC(C)(C)[C@H]1C1CC1)n1cc[nH+]c1 ZINC001347526343 981107768 /nfs/dbraw/zinc/10/77/68/981107768.db2.gz HVJIXYRYRWSLTI-CMPLNLGQSA-N 1 2 247.342 2.091 20 0 BEADLO C[C@H](C(=O)N1CC(C)(C)[C@@H]1C1CC1)n1cc[nH+]c1 ZINC001347526346 981109074 /nfs/dbraw/zinc/10/90/74/981109074.db2.gz HVJIXYRYRWSLTI-PWSUYJOCSA-N 1 2 247.342 2.091 20 0 BEADLO CC(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001347537527 981109905 /nfs/dbraw/zinc/10/99/05/981109905.db2.gz XYVICZWOCVCLPT-GFCCVEGCSA-N 1 2 249.358 2.364 20 0 BEADLO Cc1nn(C)c(C)c1-c1cc[nH+]c2c1CCN2 ZINC001240146458 981146142 /nfs/dbraw/zinc/14/61/42/981146142.db2.gz FHDYOGBCKNHAGV-UHFFFAOYSA-N 1 2 228.299 2.067 20 0 BEADLO C[C@@H](C[N@@H+]1CCOCC12CC2)C(F)(F)F ZINC000335926568 981152550 /nfs/dbraw/zinc/15/25/50/981152550.db2.gz LWBQMOQDHGJCSN-QMMMGPOBSA-N 1 2 223.238 2.050 20 0 BEADLO Cc1nccc(-c2ccc3[nH+]ccn3c2)n1 ZINC001240214208 981161231 /nfs/dbraw/zinc/16/12/31/981161231.db2.gz LGWSBGCSQKVBPF-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO c1cn2cc(-c3cnc4ncccc4n3)ccc2[nH+]1 ZINC001240214384 981162091 /nfs/dbraw/zinc/16/20/91/981162091.db2.gz PBKBICVBNAWPHP-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO c1cn2cc(-c3nccc4nccnc43)ccc2[nH+]1 ZINC001240215426 981163652 /nfs/dbraw/zinc/16/36/52/981163652.db2.gz ZBSSEIOZYHXSGE-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO c1cc2c(ncnc2-c2ccc3[nH+]ccn3c2)[nH]1 ZINC001240215421 981163667 /nfs/dbraw/zinc/16/36/67/981163667.db2.gz RGHOGFPJMWSYJB-UHFFFAOYSA-N 1 2 235.250 2.224 20 0 BEADLO c1cn2cc(-c3nncc4cnccc43)ccc2[nH+]1 ZINC001240215413 981163761 /nfs/dbraw/zinc/16/37/61/981163761.db2.gz VYPVDGVRTRRWAK-UHFFFAOYSA-N 1 2 247.261 2.340 20 0 BEADLO CCc1cc(-c2ccc3[nH+]ccn3c2)ncn1 ZINC001240216442 981163768 /nfs/dbraw/zinc/16/37/68/981163768.db2.gz GXHXOINLOUTYAZ-UHFFFAOYSA-N 1 2 224.267 2.354 20 0 BEADLO c1cn2cc(-c3ccn4cnnc4c3)ccc2[nH+]1 ZINC001240217207 981165643 /nfs/dbraw/zinc/16/56/43/981165643.db2.gz HEHRWHJQMIROJG-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO Cc1nc2c(-c3ccc4[nH+]ccn4c3)cccn2n1 ZINC001240218050 981166668 /nfs/dbraw/zinc/16/66/68/981166668.db2.gz XVSWVIPJQODJRZ-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO O=C1NCc2cccc(-c3ccc4[nH+]ccn4c3)c21 ZINC001240217920 981167451 /nfs/dbraw/zinc/16/74/51/981167451.db2.gz QQIHEHGEBITVNF-UHFFFAOYSA-N 1 2 249.273 2.245 20 0 BEADLO COc1ccncc1-c1ccc2[nH+]ccn2c1 ZINC001240217632 981167531 /nfs/dbraw/zinc/16/75/31/981167531.db2.gz KUZWEJBPYGNFTG-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO COc1ncc(-c2ccc3[nH+]ccn3c2)c(C)n1 ZINC001240218282 981169234 /nfs/dbraw/zinc/16/92/34/981169234.db2.gz JJPUNTBXHQGLPJ-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO Cn1nnc2ccc(-c3ccc4[nH+]ccn4c3)cc21 ZINC001240219161 981169910 /nfs/dbraw/zinc/16/99/10/981169910.db2.gz CRQOYBBNHOHHMJ-UHFFFAOYSA-N 1 2 249.277 2.283 20 0 BEADLO Cc1cc(-c2ccc3nccn3c2)c[nH+]c1N ZINC001240218767 981170062 /nfs/dbraw/zinc/17/00/62/981170062.db2.gz YDWVEHRYXIXXGN-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO c1cn2cc(-c3ccnc4[nH]cnc43)ccc2[nH+]1 ZINC001240219343 981170187 /nfs/dbraw/zinc/17/01/87/981170187.db2.gz HHDHCSMELIVXHG-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO Fc1ncc(-c2ccc3[nH+]ccn3c2)c(F)n1 ZINC001240218591 981170619 /nfs/dbraw/zinc/17/06/19/981170619.db2.gz SUZFFINJKCTNIB-UHFFFAOYSA-N 1 2 232.193 2.070 20 0 BEADLO c1cn2cc(-c3ccc4nncn4c3)ccc2[nH+]1 ZINC001240219540 981171063 /nfs/dbraw/zinc/17/10/63/981171063.db2.gz MLFXMGXEHSYPGY-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO Cc1ccccc1CC[N@@H+](C)CC(=O)OC(C)C ZINC001347837712 981191579 /nfs/dbraw/zinc/19/15/79/981191579.db2.gz CKOXZDHQHFFWOR-UHFFFAOYSA-N 1 2 249.354 2.421 20 0 BEADLO Cc1ccccc1CC[N@H+](C)CC(=O)OC(C)C ZINC001347837712 981191582 /nfs/dbraw/zinc/19/15/82/981191582.db2.gz CKOXZDHQHFFWOR-UHFFFAOYSA-N 1 2 249.354 2.421 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N(C)[C@@H](C)C2CC2)c1 ZINC001347895271 981209184 /nfs/dbraw/zinc/20/91/84/981209184.db2.gz ZNSIUDOLUJMPBY-JTQLQIEISA-N 1 2 248.326 2.032 20 0 BEADLO Cn1c[nH+]cc1-c1cccc(-n2cccn2)c1 ZINC001240247606 981225848 /nfs/dbraw/zinc/22/58/48/981225848.db2.gz FJAHDMYQYXXOMF-UHFFFAOYSA-N 1 2 224.267 2.273 20 0 BEADLO Cc1cc(NC(=O)NC/C=C\C2CC2)c(C)c[nH+]1 ZINC001347973097 981232710 /nfs/dbraw/zinc/23/27/10/981232710.db2.gz QNNAOONEUUBGIX-ARJAWSKDSA-N 1 2 245.326 2.208 20 0 BEADLO Cc1cnc(-c2ccn3cc[nH+]c3c2)nc1 ZINC001250498008 981242217 /nfs/dbraw/zinc/24/22/17/981242217.db2.gz NWLAMBKCEFXQJD-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO Cc1cc(-c2cnn(C)c2)c2[nH+]ccn2c1 ZINC001240294798 981242688 /nfs/dbraw/zinc/24/26/88/981242688.db2.gz AIGBGCKVMFEDSF-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO Cc1nn(C)cc1-c1ccn2cc[nH+]c2c1 ZINC001240300844 981260481 /nfs/dbraw/zinc/26/04/81/981260481.db2.gz ASSKVMBUSJYKLE-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO CCCCCNC(=O)Nc1cc[nH+]c2c1CCC2 ZINC001193295649 981284623 /nfs/dbraw/zinc/28/46/23/981284623.db2.gz QTCMGTWPBGICRH-UHFFFAOYSA-N 1 2 247.342 2.304 20 0 BEADLO COC(=[NH2+])c1cccc(-c2ccc(=O)n(C)c2)c1 ZINC001240332556 981301065 /nfs/dbraw/zinc/30/10/65/981301065.db2.gz LBCRCNYGSOEDMA-UHFFFAOYSA-N 1 2 242.278 2.024 20 0 BEADLO CCc1ccc(N2C[C@H]3COC[C@]3(C)C2)[nH+]c1 ZINC001348247586 981317393 /nfs/dbraw/zinc/31/73/93/981317393.db2.gz RTYXHJWWIHANQR-JSGCOSHPSA-N 1 2 232.327 2.117 20 0 BEADLO CC(C)OC(=O)Nc1ccc2[nH+]ccn2c1 ZINC001193449687 981323884 /nfs/dbraw/zinc/32/38/84/981323884.db2.gz YVNGCIIAFCLGDY-UHFFFAOYSA-N 1 2 219.244 2.291 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1cncnc1 ZINC001240375410 981327336 /nfs/dbraw/zinc/32/73/36/981327336.db2.gz JHBDUEDXBSFVFW-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO Cc1[nH]c(CNc2ncnc(C)c2C)[nH+]c1C ZINC001348311179 981332492 /nfs/dbraw/zinc/33/24/92/981332492.db2.gz GLFAEJBEBBXSTL-UHFFFAOYSA-N 1 2 231.303 2.045 20 0 BEADLO Cc1c(-c2ccc3[nH+]ccn3c2C)cnn1C ZINC001240382745 981342339 /nfs/dbraw/zinc/34/23/39/981342339.db2.gz OWFUPSKRDLPDAK-UHFFFAOYSA-N 1 2 226.283 2.352 20 0 BEADLO Nc1cn2ccc(-c3cnc4[nH]ccc4c3)cc2[nH+]1 ZINC001240391588 981349669 /nfs/dbraw/zinc/34/96/69/981349669.db2.gz LTBPJIIKGMXPAK-UHFFFAOYSA-N 1 2 249.277 2.411 20 0 BEADLO Cc1ccc(-c2cnc3[nH]ccc3c2)[nH+]c1N ZINC001240390754 981350033 /nfs/dbraw/zinc/35/00/33/981350033.db2.gz DEOGWJHXXIGSJN-UHFFFAOYSA-N 1 2 224.267 2.467 20 0 BEADLO C[C@H]1CCCC[C@H]1NC(=O)CCc1[nH+]ccn1C ZINC001348423400 981359278 /nfs/dbraw/zinc/35/92/78/981359278.db2.gz CFVJINIKVAYPBF-NWDGAFQWSA-N 1 2 249.358 2.048 20 0 BEADLO c1cc2c(nccc2-c2cc[nH+]c3c2CCN3)[nH]1 ZINC001240416084 981365405 /nfs/dbraw/zinc/36/54/05/981365405.db2.gz BDWRCWBDQJIJLT-UHFFFAOYSA-N 1 2 236.278 2.187 20 0 BEADLO COc1cccnc1-c1ccn2cc[nH+]c2c1 ZINC001240496150 981415069 /nfs/dbraw/zinc/41/50/69/981415069.db2.gz HMKPKCUUYXFUJO-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO CCOc1cnc(-c2ccn3cc[nH+]c3c2)nc1 ZINC001240496013 981415876 /nfs/dbraw/zinc/41/58/76/981415876.db2.gz COCVYNFLKOGIRZ-UHFFFAOYSA-N 1 2 240.266 2.190 20 0 BEADLO Cc1ncnc(-c2ccn3cc[nH+]c3c2)c1C ZINC001240495945 981416112 /nfs/dbraw/zinc/41/61/12/981416112.db2.gz AYOFOCDEWRWXNH-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO Cc1cnc(-c2ccn3cc[nH+]c3c2)c(N)c1 ZINC001240496731 981417743 /nfs/dbraw/zinc/41/77/43/981417743.db2.gz HINQNVFAUDZMKE-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO CCCCOC(=O)NCc1ccc2[nH+]ccn2c1 ZINC001193732075 981418509 /nfs/dbraw/zinc/41/85/09/981418509.db2.gz WOGKPKWVUABAJV-UHFFFAOYSA-N 1 2 247.298 2.361 20 0 BEADLO CCc1nccnc1-c1ccn2cc[nH+]c2c1 ZINC001240496287 981419019 /nfs/dbraw/zinc/41/90/19/981419019.db2.gz KQPDEMIZBZSFOJ-UHFFFAOYSA-N 1 2 224.267 2.354 20 0 BEADLO c1cn2cc(-c3ccn4cc[nH+]c4c3)ncc2n1 ZINC001240508548 981431230 /nfs/dbraw/zinc/43/12/30/981431230.db2.gz BVXQNYCFVMZMAG-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO O=C1NCc2cc(-c3ccn4cc[nH+]c4c3)ccc21 ZINC001240503164 981431357 /nfs/dbraw/zinc/43/13/57/981431357.db2.gz IKFQQDOPEKFFPV-UHFFFAOYSA-N 1 2 249.273 2.245 20 0 BEADLO Cc1cn2cc(-c3ccn4cc[nH+]c4c3)ncc2n1 ZINC001240508675 981433631 /nfs/dbraw/zinc/43/36/31/981433631.db2.gz IJSWEABHZNLHSO-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO COc1cnccc1-c1ccn2cc[nH+]c2c1 ZINC001240509191 981434530 /nfs/dbraw/zinc/43/45/30/981434530.db2.gz UUOWMPXLDGWCLW-UHFFFAOYSA-N 1 2 225.251 2.405 20 0 BEADLO Cn1nnc2ccc(-c3ccn4cc[nH+]c4c3)cc21 ZINC001240510989 981437148 /nfs/dbraw/zinc/43/71/48/981437148.db2.gz XEYIROYISAPGDP-UHFFFAOYSA-N 1 2 249.277 2.283 20 0 BEADLO CCc1ccccc1Cc1nnc(C[NH+](C)C)o1 ZINC001348918513 981476209 /nfs/dbraw/zinc/47/62/09/981476209.db2.gz ASXVHTBYALOXLL-UHFFFAOYSA-N 1 2 245.326 2.284 20 0 BEADLO Nc1cc(-c2ccc3c[nH]nc3c2)cc[nH+]1 ZINC001240556933 981477548 /nfs/dbraw/zinc/47/75/48/981477548.db2.gz GDTXLDBSVWOESD-UHFFFAOYSA-N 1 2 210.240 2.207 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2c(c1)OC(F)(F)O2 ZINC001240563616 981482355 /nfs/dbraw/zinc/48/23/55/981482355.db2.gz JMSLNASVKGMSCI-UHFFFAOYSA-N 1 2 238.193 2.409 20 0 BEADLO COC(=O)c1c[nH]c2nc(C=C(C)C)[nH+]cc12 ZINC001240632508 981524061 /nfs/dbraw/zinc/52/40/61/981524061.db2.gz FKHOMMGINRDIIR-UHFFFAOYSA-N 1 2 231.255 2.119 20 0 BEADLO CCn1cc(-c2ccn3cc[nH+]c3c2)cn1 ZINC001240648683 981548726 /nfs/dbraw/zinc/54/87/26/981548726.db2.gz BMMHKFPZDFEZKS-UHFFFAOYSA-N 1 2 212.256 2.218 20 0 BEADLO COc1cc(-c2c[nH+]cn2C)cc(F)c1F ZINC001240661221 981570032 /nfs/dbraw/zinc/57/00/32/981570032.db2.gz NDWKIAYRXBZSJR-UHFFFAOYSA-N 1 2 224.210 2.374 20 0 BEADLO Nc1[nH+]cccc1-c1cnn([C@@H]2CCCCO2)c1 ZINC001240674666 981582755 /nfs/dbraw/zinc/58/27/55/981582755.db2.gz GZUCZBLRPDQHCD-LBPRGKRZSA-N 1 2 244.298 2.226 20 0 BEADLO Nc1cn2ccc(-c3cc(F)ccc3O)cc2[nH+]1 ZINC001240696743 981607777 /nfs/dbraw/zinc/60/77/77/981607777.db2.gz NPBBCEAIWGALAA-UHFFFAOYSA-N 1 2 243.241 2.428 20 0 BEADLO Cc1ccc(-c2ccc(O)c(F)c2)[nH+]c1N ZINC001240783741 981823339 /nfs/dbraw/zinc/82/33/39/981823339.db2.gz YOMYNJPBFSJAMO-UHFFFAOYSA-N 1 2 218.231 2.484 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC001350091319 981868559 /nfs/dbraw/zinc/86/85/59/981868559.db2.gz XIYVFKHCAXILES-UPJWGTAASA-N 1 2 248.326 2.253 20 0 BEADLO Cc1cc(-c2cccc3[nH+]c(C)cn32)n(C)n1 ZINC001240858528 981896964 /nfs/dbraw/zinc/89/69/64/981896964.db2.gz OVXYROGNMXDPRX-UHFFFAOYSA-N 1 2 226.283 2.352 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@H](C)C(C)C ZINC001350335206 981929614 /nfs/dbraw/zinc/92/96/14/981929614.db2.gz SZZRCDOODABTJB-SNVBAGLBSA-N 1 2 224.304 2.238 20 0 BEADLO CCn1c[nH+]cc1COC(=O)C[C@@H](C)SC ZINC001350344121 981934363 /nfs/dbraw/zinc/93/43/63/981934363.db2.gz KDKYSXWFBAQZKZ-SECBINFHSA-N 1 2 242.344 2.088 20 0 BEADLO c1cc2c(s1)CC[N@@H+](Cc1cnoc1)C2 ZINC001205678270 981937004 /nfs/dbraw/zinc/93/70/04/981937004.db2.gz XDGKXJMTSNXCOW-UHFFFAOYSA-N 1 2 220.297 2.294 20 0 BEADLO c1cc2c(s1)CC[N@H+](Cc1cnoc1)C2 ZINC001205678270 981937016 /nfs/dbraw/zinc/93/70/16/981937016.db2.gz XDGKXJMTSNXCOW-UHFFFAOYSA-N 1 2 220.297 2.294 20 0 BEADLO c1nnc(C[NH2+][C@H](CC2CC2)c2ccccc2)[nH]1 ZINC001350371473 981949467 /nfs/dbraw/zinc/94/94/67/981949467.db2.gz NHACTTZAWDWDMB-CYBMUJFWSA-N 1 2 242.326 2.436 20 0 BEADLO Nc1cn2ccc(-c3cccc(O)c3)cc2[nH+]1 ZINC001240925057 981992720 /nfs/dbraw/zinc/99/27/20/981992720.db2.gz ZUOSHNVGVMMXIY-UHFFFAOYSA-N 1 2 225.251 2.289 20 0 BEADLO Cc1c[nH]c2ncc(-c3c[nH+]cn3C)cc12 ZINC001240957031 982025632 /nfs/dbraw/zinc/02/56/32/982025632.db2.gz OPQPQKORCZTVMF-UHFFFAOYSA-N 1 2 212.256 2.272 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1cc(C)cc(C)c1O ZINC001586941496 982033891 /nfs/dbraw/zinc/03/38/91/982033891.db2.gz PYXYPBAPNUVEPI-GFCCVEGCSA-N 1 2 248.326 2.042 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1cc(C)cc(C)c1O ZINC001586941496 982033899 /nfs/dbraw/zinc/03/38/99/982033899.db2.gz PYXYPBAPNUVEPI-GFCCVEGCSA-N 1 2 248.326 2.042 20 0 BEADLO CCCCC(=O)NCCCN(C)c1cccc[nH+]1 ZINC001588306315 982127225 /nfs/dbraw/zinc/12/72/25/982127225.db2.gz SJEHETHCVVILTQ-UHFFFAOYSA-N 1 2 249.358 2.214 20 0 BEADLO Cc1cc[nH]c1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001195489175 982293028 /nfs/dbraw/zinc/29/30/28/982293028.db2.gz LJHRXBONBULMHJ-UHFFFAOYSA-N 1 2 240.266 2.223 20 0 BEADLO C[C@@H]1c2ccc(-c3cc[nH+]c(N)c3)cc2NC1=O ZINC001241164198 982308670 /nfs/dbraw/zinc/30/86/70/982308670.db2.gz YDOFPLLAOSLWEQ-MRVPVSSYSA-N 1 2 239.278 2.386 20 0 BEADLO Nc1cc(-c2cc3c(c(F)c2)C(=O)OC3)cc[nH+]1 ZINC001241175612 982323996 /nfs/dbraw/zinc/32/39/96/982323996.db2.gz GWPGMIHMNFSTMN-UHFFFAOYSA-N 1 2 244.225 2.140 20 0 BEADLO CCc1c(F)cncc1-c1cc[nH+]c(N)c1 ZINC001241171217 982325125 /nfs/dbraw/zinc/32/51/25/982325125.db2.gz YYVMDFNEWPKTMA-UHFFFAOYSA-N 1 2 217.247 2.427 20 0 BEADLO COc1cc(SC)c(-c2cc[nH+]c(N)c2)cn1 ZINC001241176088 982326050 /nfs/dbraw/zinc/32/60/50/982326050.db2.gz UOQLZJNUEIENGG-UHFFFAOYSA-N 1 2 247.323 2.456 20 0 BEADLO CCOc1cc(-c2cc[nH+]c(N)c2)cnc1F ZINC001241176289 982328496 /nfs/dbraw/zinc/32/84/96/982328496.db2.gz YPHSKNAQJOHKLA-UHFFFAOYSA-N 1 2 233.246 2.264 20 0 BEADLO C[NH+](C)Cc1nnc([C@H]2CCC2(C)C)o1 ZINC001351672437 982357121 /nfs/dbraw/zinc/35/71/21/982357121.db2.gz VQOVQNWAMIXNFG-MRVPVSSYSA-N 1 2 209.293 2.035 20 0 BEADLO Cc1nnc(C[NH2+][C@@H](c2ccncc2)C2CC2)o1 ZINC001351757430 982379447 /nfs/dbraw/zinc/37/94/47/982379447.db2.gz XMCSDUPXHLLYEI-CYBMUJFWSA-N 1 2 244.298 2.014 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1c(N)cncc1F ZINC001241244261 982388848 /nfs/dbraw/zinc/38/88/48/982388848.db2.gz ZUVOHAQOXGLORN-UHFFFAOYSA-N 1 2 246.289 2.239 20 0 BEADLO CC(=O)c1ccc(-c2c[nH+]cn2C)cc1F ZINC001241257756 982396322 /nfs/dbraw/zinc/39/63/22/982396322.db2.gz KZSMGYCWMCIMPN-UHFFFAOYSA-N 1 2 218.231 2.429 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)o1 ZINC001352010896 982433633 /nfs/dbraw/zinc/43/36/33/982433633.db2.gz CZNQRNJWWLHJRN-MWLCHTKSSA-N 1 2 227.279 2.468 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)o1 ZINC001352010896 982433641 /nfs/dbraw/zinc/43/36/41/982433641.db2.gz CZNQRNJWWLHJRN-MWLCHTKSSA-N 1 2 227.279 2.468 20 0 BEADLO Cc1nnc(C[NH2+][C@@H](C)c2ccc[nH]2)s1 ZINC001352012741 982440319 /nfs/dbraw/zinc/44/03/19/982440319.db2.gz YNZWRXDYLWBXLR-ZETCQYMHSA-N 1 2 222.317 2.025 20 0 BEADLO Cn1nccc1[C@@H]1CCCN1c1cccc[nH+]1 ZINC001352080938 982458567 /nfs/dbraw/zinc/45/85/67/982458567.db2.gz ZQYRSWJNMCSVEK-LBPRGKRZSA-N 1 2 228.299 2.157 20 0 BEADLO O=C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1cccc(O)c1 ZINC001203862218 982500995 /nfs/dbraw/zinc/50/09/95/982500995.db2.gz BODSJAMSIDCDLG-BETUJISGSA-N 1 2 245.322 2.478 20 0 BEADLO O=C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1cccc(O)c1 ZINC001203862218 982501003 /nfs/dbraw/zinc/50/10/03/982501003.db2.gz BODSJAMSIDCDLG-BETUJISGSA-N 1 2 245.322 2.478 20 0 BEADLO C[S@](=O)c1ccccc1-c1ccc[nH+]c1N ZINC001241337692 982502846 /nfs/dbraw/zinc/50/28/46/982502846.db2.gz MXJNSUTWBZBKHA-INIZCTEOSA-N 1 2 232.308 2.068 20 0 BEADLO COc1ncc(C)cc1-c1c[nH+]c(N)c(C)c1 ZINC001241364959 982524493 /nfs/dbraw/zinc/52/44/93/982524493.db2.gz SKHZJDWSBMMDHH-UHFFFAOYSA-N 1 2 229.283 2.351 20 0 BEADLO c1cn2ccc(-c3cnc4n[nH]cc4c3)cc2[nH+]1 ZINC001241423522 982573462 /nfs/dbraw/zinc/57/34/62/982573462.db2.gz HYEWHCCXJGZIFT-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO Cn1ncc2c1cccc2-c1ccc[nH+]c1N ZINC001241448547 982598545 /nfs/dbraw/zinc/59/85/45/982598545.db2.gz NGTFWDNAQUOYNE-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO Cn1ncc2c1cccc2-c1cc[nH+]c(N)c1 ZINC001241450991 982602509 /nfs/dbraw/zinc/60/25/09/982602509.db2.gz XHQJORJDEXJOQU-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO Cn1cc2cccc(-c3ccc[nH+]c3N)c2n1 ZINC001241469656 982624515 /nfs/dbraw/zinc/62/45/15/982624515.db2.gz RZASYJLXJVKXTN-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO Cc1ccc(-c2ccc([S@](C)=O)cc2)[nH+]c1N ZINC001241481216 982636443 /nfs/dbraw/zinc/63/64/43/982636443.db2.gz UNHPGONIDDSSRK-KRWDZBQOSA-N 1 2 246.335 2.377 20 0 BEADLO c1cn(Cc2ccc(-c3cncs3)nc2)c[nH+]1 ZINC001241496639 982653542 /nfs/dbraw/zinc/65/35/42/982653542.db2.gz OQSUOILUOIQNCL-UHFFFAOYSA-N 1 2 242.307 2.450 20 0 BEADLO OCc1cc[nH+]c(N[C@H]2CCC[C@@H](F)C2)c1 ZINC001353017752 982669017 /nfs/dbraw/zinc/66/90/17/982669017.db2.gz PSAIPGLELKQDGI-MNOVXSKESA-N 1 2 224.279 2.267 20 0 BEADLO Nc1ccc(-c2nc3[nH]ccc3c[nH+]2)cc1 ZINC001241537664 982706581 /nfs/dbraw/zinc/70/65/81/982706581.db2.gz DPPNUDRSPLBIDJ-UHFFFAOYSA-N 1 2 210.240 2.159 20 0 BEADLO CO[C@H](C)C[N@@H+]1CC(F)(F)CC[C@@H]1C ZINC001198640280 982811016 /nfs/dbraw/zinc/81/10/16/982811016.db2.gz AYGRFMISCINFCT-DTWKUNHWSA-N 1 2 207.264 2.141 20 0 BEADLO CO[C@H](C)C[N@H+]1CC(F)(F)CC[C@@H]1C ZINC001198640280 982811018 /nfs/dbraw/zinc/81/10/18/982811018.db2.gz AYGRFMISCINFCT-DTWKUNHWSA-N 1 2 207.264 2.141 20 0 BEADLO CO[C@H](C)C[N@@H+]1CC(F)(F)CC[C@H]1C ZINC001198640284 982812438 /nfs/dbraw/zinc/81/24/38/982812438.db2.gz AYGRFMISCINFCT-RKDXNWHRSA-N 1 2 207.264 2.141 20 0 BEADLO CO[C@H](C)C[N@H+]1CC(F)(F)CC[C@H]1C ZINC001198640284 982812441 /nfs/dbraw/zinc/81/24/41/982812441.db2.gz AYGRFMISCINFCT-RKDXNWHRSA-N 1 2 207.264 2.141 20 0 BEADLO C[N@@H+]1CCC=C(c2cncnc2C(F)(F)F)C1 ZINC001241569964 982819918 /nfs/dbraw/zinc/81/99/18/982819918.db2.gz BSJSMXIWLRAEKL-UHFFFAOYSA-N 1 2 243.232 2.214 20 0 BEADLO C[N@H+]1CCC=C(c2cncnc2C(F)(F)F)C1 ZINC001241569964 982819919 /nfs/dbraw/zinc/81/99/19/982819919.db2.gz BSJSMXIWLRAEKL-UHFFFAOYSA-N 1 2 243.232 2.214 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc2cn(C)nc2c1 ZINC001241600993 982840983 /nfs/dbraw/zinc/84/09/83/982840983.db2.gz OALOTBCRYDKEST-DROBUMMNSA-N 1 2 213.284 2.449 20 0 BEADLO Cn1cc2ccc(-c3cc[nH+]c(N)c3)cc2n1 ZINC001241601514 982842360 /nfs/dbraw/zinc/84/23/60/982842360.db2.gz QVYPDSUXCHMLOU-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO CC1CCC(C)(C(=O)NCCn2cc[nH+]c2)CC1 ZINC001353526939 982882216 /nfs/dbraw/zinc/88/22/16/982882216.db2.gz IFKYJTFGWPPTFT-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)C1=CC=CC1 ZINC001199692082 982977595 /nfs/dbraw/zinc/97/75/95/982977595.db2.gz UVFIXVXSRFQVPK-UHFFFAOYSA-N 1 2 225.251 2.159 20 0 BEADLO CCCCNC(=S)Nc1cc[nH+]c(CC)c1 ZINC001200448385 983006008 /nfs/dbraw/zinc/00/60/08/983006008.db2.gz ZXDYLIJBYMHMMT-UHFFFAOYSA-N 1 2 237.372 2.152 20 0 BEADLO Cc1ccc(-c2ccc(F)c(CO)c2)[nH+]c1N ZINC001241780695 983044490 /nfs/dbraw/zinc/04/44/90/983044490.db2.gz DJYTVJWVHKEEBN-UHFFFAOYSA-N 1 2 232.258 2.271 20 0 BEADLO c1cn2ccc(-c3cscn3)cc2[nH+]1 ZINC001241889997 983106412 /nfs/dbraw/zinc/10/64/12/983106412.db2.gz XTUDRMMMLFTQNG-UHFFFAOYSA-N 1 2 201.254 2.458 20 0 BEADLO CNc1cc(-c2ccc(OC)c(CO)c2)cc[nH+]1 ZINC001241931735 983146723 /nfs/dbraw/zinc/14/67/23/983146723.db2.gz SGSZHNGELBRTFA-UHFFFAOYSA-N 1 2 244.294 2.291 20 0 BEADLO COc1cccc(Nc2ccc(N)[nH+]c2)c1OC ZINC001201284202 983156475 /nfs/dbraw/zinc/15/64/75/983156475.db2.gz NGFKWYIUNCJNAA-UHFFFAOYSA-N 1 2 245.282 2.425 20 0 BEADLO Nc1ccc(Nc2ccc(O)c(F)c2F)c[nH+]1 ZINC001201284735 983156495 /nfs/dbraw/zinc/15/64/95/983156495.db2.gz ZCPNWJXSGCYGDS-UHFFFAOYSA-N 1 2 237.209 2.391 20 0 BEADLO Nc1ccc(F)c(Nc2ccc(N)[nH+]c2)c1 ZINC001201285546 983160924 /nfs/dbraw/zinc/16/09/24/983160924.db2.gz KQJXWAAUHMIYNC-UHFFFAOYSA-N 1 2 218.235 2.129 20 0 BEADLO Nc1ccc(Nc2c(N)ccc(F)c2F)c[nH+]1 ZINC001201286805 983164005 /nfs/dbraw/zinc/16/40/05/983164005.db2.gz BBVUTDDWEAYCFD-UHFFFAOYSA-N 1 2 236.225 2.268 20 0 BEADLO CC(=O)Nc1ccccc1Nc1ccc(N)[nH+]c1 ZINC001201287176 983165585 /nfs/dbraw/zinc/16/55/85/983165585.db2.gz XSBQZBPJDPGBKJ-UHFFFAOYSA-N 1 2 242.282 2.366 20 0 BEADLO Cc1cc(Nc2ccc(N)[nH+]c2)ccc1CO ZINC001201291126 983168494 /nfs/dbraw/zinc/16/84/94/983168494.db2.gz BLHIRASZQPPCCN-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO Cc1c(O)cccc1Nc1ccc(N)[nH+]c1 ZINC001201291853 983169491 /nfs/dbraw/zinc/16/94/91/983169491.db2.gz FULUFKCPOBZYQO-UHFFFAOYSA-N 1 2 215.256 2.421 20 0 BEADLO Nc1ccc(N2CCCc3c(N)cccc32)c[nH+]1 ZINC001201291645 983169695 /nfs/dbraw/zinc/16/96/95/983169695.db2.gz KWHJOFKGARWXCQ-UHFFFAOYSA-N 1 2 240.310 2.330 20 0 BEADLO Cc1ccc(Nc2ccc(N)[nH+]c2)c(C)n1 ZINC001201272396 983171275 /nfs/dbraw/zinc/17/12/75/983171275.db2.gz MXDLFQJPJGOYRS-UHFFFAOYSA-N 1 2 214.272 2.419 20 0 BEADLO Nc1ccc(Nc2cc(C(F)(F)F)no2)c[nH+]1 ZINC001201272584 983171809 /nfs/dbraw/zinc/17/18/09/983171809.db2.gz QZFUDJFJLYADJK-UHFFFAOYSA-N 1 2 244.176 2.414 20 0 BEADLO CCc1ccc(N2CCC[C@H]2C(C)(C)O)[nH+]c1 ZINC001354139874 983171929 /nfs/dbraw/zinc/17/19/29/983171929.db2.gz JYCNRYQHHAFHFW-LBPRGKRZSA-N 1 2 234.343 2.384 20 0 BEADLO Nc1ccc(Nc2ncc(O)cc2Cl)c[nH+]1 ZINC001201278776 983178263 /nfs/dbraw/zinc/17/82/63/983178263.db2.gz GAFHRSBAKKEIDS-UHFFFAOYSA-N 1 2 236.662 2.161 20 0 BEADLO Nc1ccc(Nc2cc(F)cc(F)c2O)c[nH+]1 ZINC001201295180 983182739 /nfs/dbraw/zinc/18/27/39/983182739.db2.gz LQMPYZKYUMBBAE-UHFFFAOYSA-N 1 2 237.209 2.391 20 0 BEADLO CCc1ccc(N2C[C@@H](F)[C@@H](F)C2)[nH+]c1 ZINC001354204130 983192509 /nfs/dbraw/zinc/19/25/09/983192509.db2.gz MHDYYWFGPCAFLM-AOOOYVTPSA-N 1 2 212.243 2.140 20 0 BEADLO Cc1ccc(N[C@H]2C[C@@H](C)n3ncnc32)c(C)[nH+]1 ZINC001354234748 983215012 /nfs/dbraw/zinc/21/50/12/983215012.db2.gz JCMUDJLMFRVCED-SKDRFNHKSA-N 1 2 243.314 2.408 20 0 BEADLO Cc1ccc(N[C@@H]2C[C@H](C)n3ncnc32)c(C)[nH+]1 ZINC001354234746 983215890 /nfs/dbraw/zinc/21/58/90/983215890.db2.gz JCMUDJLMFRVCED-JOYOIKCWSA-N 1 2 243.314 2.408 20 0 BEADLO O=C1CSCN1c1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001242018037 983219132 /nfs/dbraw/zinc/21/91/32/983219132.db2.gz BXTQEDICMMUUGZ-UHFFFAOYSA-N 1 2 245.307 2.114 20 0 BEADLO CC(C)=CCC[C@@H](C)C[N@@H+]1C[C@@H]2C[C@H]1C(=O)O2 ZINC001201496919 983262563 /nfs/dbraw/zinc/26/25/63/983262563.db2.gz SDLLXYKNXJWJES-AGIUHOORSA-N 1 2 237.343 2.369 20 0 BEADLO c1cn(Cc2ccccc2-c2ccnnc2)c[nH+]1 ZINC001242058750 983268530 /nfs/dbraw/zinc/26/85/30/983268530.db2.gz JVEQUNCROCHWGL-UHFFFAOYSA-N 1 2 236.278 2.388 20 0 BEADLO CNc1ccc(-c2cc[nH+]c(NC)c2)cn1 ZINC001242071030 983303999 /nfs/dbraw/zinc/30/39/99/983303999.db2.gz JJTKTHIHKYVPAC-UHFFFAOYSA-N 1 2 214.272 2.227 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1cnc(C)c(C)n1 ZINC001242070902 983304655 /nfs/dbraw/zinc/30/46/55/983304655.db2.gz OZUFWNDWZTUFRQ-UHFFFAOYSA-N 1 2 214.272 2.046 20 0 BEADLO Cc1cc2cnc(-c3c[nH+]c(N)cc3C)nc2[nH]1 ZINC001242070595 983305123 /nfs/dbraw/zinc/30/51/23/983305123.db2.gz DRYLDQLLMNCNDN-UHFFFAOYSA-N 1 2 239.282 2.171 20 0 BEADLO Cc1cc2[nH+]ccn2cc1C1=CCOCC1 ZINC001242076112 983320878 /nfs/dbraw/zinc/32/08/78/983320878.db2.gz XMEKQYXMJMFZAZ-UHFFFAOYSA-N 1 2 214.268 2.446 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1ncc2c(n1)CCCC2 ZINC001242078131 983324553 /nfs/dbraw/zinc/32/45/53/983324553.db2.gz SAECFNQEYSDYMY-UHFFFAOYSA-N 1 2 240.310 2.308 20 0 BEADLO CCCOc1nccnc1-c1c[nH+]c(N)cc1C ZINC001242077552 983324737 /nfs/dbraw/zinc/32/47/37/983324737.db2.gz FHVDOACXMBBWGD-UHFFFAOYSA-N 1 2 244.298 2.218 20 0 BEADLO CCCC[C@@H](O)CNc1cccc2[nH+]ccn21 ZINC001252078760 983329441 /nfs/dbraw/zinc/32/94/41/983329441.db2.gz YWKHUHDZOPPFPV-LLVKDONJSA-N 1 2 233.315 2.297 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1nc(F)ccc1F ZINC001242089752 983333354 /nfs/dbraw/zinc/33/33/54/983333354.db2.gz IAUXDXXBZWNPBP-UHFFFAOYSA-N 1 2 221.210 2.312 20 0 BEADLO Cc1nc2cncc(-c3c[nH+]c(N)cc3C)c2[nH]1 ZINC001242095668 983338264 /nfs/dbraw/zinc/33/82/64/983338264.db2.gz LHSKUBDZXUUOKK-UHFFFAOYSA-N 1 2 239.282 2.219 20 0 BEADLO Cc1nc2c[nH]cc(-c3c[nH+]c(N)cc3C)c-2n1 ZINC001242095668 983338269 /nfs/dbraw/zinc/33/82/69/983338269.db2.gz LHSKUBDZXUUOKK-UHFFFAOYSA-N 1 2 239.282 2.219 20 0 BEADLO Cc1cc(-c2ccc[nH+]c2N)ccc1O ZINC001242111816 983360141 /nfs/dbraw/zinc/36/01/41/983360141.db2.gz RQHBFZJEMYJAIX-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO COc1ccc(-c2ccc(C)c(N)[nH+]2)cc1O ZINC001242172213 983386653 /nfs/dbraw/zinc/38/66/53/983386653.db2.gz UCALTVBYPNYFLL-UHFFFAOYSA-N 1 2 230.267 2.353 20 0 BEADLO Cn1c[nH+]c2cc(Nc3cncc(O)c3)ccc21 ZINC001201641441 983395439 /nfs/dbraw/zinc/39/54/39/983395439.db2.gz NTFWFWHWKICUIV-UHFFFAOYSA-N 1 2 240.266 2.418 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H]1CC12CCC2 ZINC001355036449 983400406 /nfs/dbraw/zinc/40/04/06/983400406.db2.gz SAAOZIFPGOFJFL-NSHDSACASA-N 1 2 230.311 2.249 20 0 BEADLO Nc1cc[nH+]c(-c2cccc(F)c2O)c1 ZINC001242348503 983612623 /nfs/dbraw/zinc/61/26/23/983612623.db2.gz ULLRKIBSKYYKRG-UHFFFAOYSA-N 1 2 204.204 2.176 20 0 BEADLO CC(C)(C)NC(=O)Nc1cccc2[nH+]ccn21 ZINC001202469323 983678823 /nfs/dbraw/zinc/67/88/23/983678823.db2.gz ZHJZMASPDNDIEC-UHFFFAOYSA-N 1 2 232.287 2.254 20 0 BEADLO Cc1ccc(-c2ccc(CO)c(F)c2)[nH+]c1N ZINC001242530680 983852327 /nfs/dbraw/zinc/85/23/27/983852327.db2.gz VXMDZGMSAVYYCS-UHFFFAOYSA-N 1 2 232.258 2.271 20 0 BEADLO Nc1[nH+]cccc1-c1cccc2c1OCO2 ZINC001242587288 983900999 /nfs/dbraw/zinc/90/09/99/983900999.db2.gz CRFYOPUOKYYLAL-UHFFFAOYSA-N 1 2 214.224 2.060 20 0 BEADLO Clc1cc2c(cn1)C[N@H+](C[C@H]1CCOC1)C2 ZINC001202539808 983916053 /nfs/dbraw/zinc/91/60/53/983916053.db2.gz BYKKUGXYEHUALN-SECBINFHSA-N 1 2 238.718 2.087 20 0 BEADLO Clc1cc2c(cn1)C[N@@H+](C[C@H]1CCOC1)C2 ZINC001202539808 983916068 /nfs/dbraw/zinc/91/60/68/983916068.db2.gz BYKKUGXYEHUALN-SECBINFHSA-N 1 2 238.718 2.087 20 0 BEADLO Cc1cccc2c(C[N@H+]3CCOC[C@H]3C)[nH]nc21 ZINC001137141627 983968065 /nfs/dbraw/zinc/96/80/65/983968065.db2.gz CVUNCZRYZXXQMF-LLVKDONJSA-N 1 2 245.326 2.092 20 0 BEADLO Cc1cccc2c(C[N@@H+]3CCOC[C@H]3C)[nH]nc21 ZINC001137141627 983968082 /nfs/dbraw/zinc/96/80/82/983968082.db2.gz CVUNCZRYZXXQMF-LLVKDONJSA-N 1 2 245.326 2.092 20 0 BEADLO CCNC(=O)Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001202547626 983973322 /nfs/dbraw/zinc/97/33/22/983973322.db2.gz HNEHUXJPRJVDAC-UHFFFAOYSA-N 1 2 244.298 2.073 20 0 BEADLO O=c1[nH]cc(-c2cccc3[nH+]ccn32)cc1F ZINC001242615688 983999376 /nfs/dbraw/zinc/99/93/76/983999376.db2.gz PJEKDTVIWMTHDV-UHFFFAOYSA-N 1 2 229.214 2.241 20 0 BEADLO Nc1[nH+]cccc1-c1ccnc(OC2CC2)c1 ZINC001242722986 984073932 /nfs/dbraw/zinc/07/39/32/984073932.db2.gz JWJZUDDHOBXMRB-UHFFFAOYSA-N 1 2 227.267 2.267 20 0 BEADLO CC=C(C)c1nc2[nH]cc(C(=O)OC)c2c[nH+]1 ZINC001242757156 984115468 /nfs/dbraw/zinc/11/54/68/984115468.db2.gz YTKAKOPKWZCFMY-QPJJXVBHSA-N 1 2 231.255 2.119 20 0 BEADLO CCc1[nH]nc2ncc(-c3cc[nH+]c(N)c3)cc12 ZINC001242823199 984183086 /nfs/dbraw/zinc/18/30/86/984183086.db2.gz DULIPTOZBJBQQT-UHFFFAOYSA-N 1 2 239.282 2.165 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cc(F)c(N)c(F)c1 ZINC001242838802 984187502 /nfs/dbraw/zinc/18/75/02/984187502.db2.gz JCSXTADHCQJQKX-JKEDICHKSA-N 1 2 210.227 2.423 20 0 BEADLO CCCCC[C@@H](O)CNc1cc[nH+]c(OC)c1 ZINC001253519528 984189588 /nfs/dbraw/zinc/18/95/88/984189588.db2.gz FJZTZFGGGWHSHL-GFCCVEGCSA-N 1 2 238.331 2.443 20 0 BEADLO CCCCC[C@@H](O)CNc1cccc[nH+]1 ZINC001253522402 984192978 /nfs/dbraw/zinc/19/29/78/984192978.db2.gz LORSVGWUPQROAH-LLVKDONJSA-N 1 2 208.305 2.435 20 0 BEADLO COc1ccc(/C(C)=C/C=C/[NH3+])c(C)n1 ZINC001242926179 984300321 /nfs/dbraw/zinc/30/03/21/984300321.db2.gz NYSMOEWSWWFRRV-KBXRYBNXSA-N 1 2 204.273 2.274 20 0 BEADLO Nc1ccc(-c2c[nH+]c3c(c2)CCCN3)c(F)c1 ZINC001240530542 984317869 /nfs/dbraw/zinc/31/78/69/984317869.db2.gz XQWICROQSRNNBH-UHFFFAOYSA-N 1 2 243.285 2.471 20 0 BEADLO Cc1cc(-c2cncn2C)c2[nH+]ccn2c1 ZINC001243066846 984477855 /nfs/dbraw/zinc/47/78/55/984477855.db2.gz BPPRLBNPYPEDCV-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO Cn1c[nH+]cc1-c1ccnc(N2CCCC2)c1 ZINC001243066881 984480581 /nfs/dbraw/zinc/48/05/81/984480581.db2.gz NVFVJFRIGKHDDH-UHFFFAOYSA-N 1 2 228.299 2.082 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1cncn1C ZINC001243067909 984481707 /nfs/dbraw/zinc/48/17/07/984481707.db2.gz QQEYGQWQIYIYBE-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2cc(N)cnc2c1 ZINC001243069861 984492747 /nfs/dbraw/zinc/49/27/47/984492747.db2.gz BLKSORAWUINWSF-UHFFFAOYSA-N 1 2 224.267 2.218 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(F)c(-n2ccnc2)c1 ZINC001243072658 984502313 /nfs/dbraw/zinc/50/23/13/984502313.db2.gz UCYGBAMGVQHICP-UHFFFAOYSA-N 1 2 242.257 2.412 20 0 BEADLO Cn1c[nH+]cc1-c1cccc2c1NC(=O)N(C)C2 ZINC001243071914 984504687 /nfs/dbraw/zinc/50/46/87/984504687.db2.gz JGDFOMLUCFODGU-UHFFFAOYSA-N 1 2 242.282 2.064 20 0 BEADLO CCOc1cc(OC)cc(-c2c[nH+]cn2C)c1 ZINC001243072443 984505251 /nfs/dbraw/zinc/50/52/51/984505251.db2.gz OUBSVVPKQXZXJS-UHFFFAOYSA-N 1 2 232.283 2.494 20 0 BEADLO CSc1cnccc1-c1c[nH+]cn1C ZINC001243073095 984509028 /nfs/dbraw/zinc/50/90/28/984509028.db2.gz YNXHDEZHLPJMHJ-UHFFFAOYSA-N 1 2 205.286 2.204 20 0 BEADLO CC(C)(C)[C@H]1CCCN1C(=O)CCc1[nH]cc[nH+]1 ZINC001445040188 984587535 /nfs/dbraw/zinc/58/75/35/984587535.db2.gz VHCNWZARPMICRF-LLVKDONJSA-N 1 2 249.358 2.379 20 0 BEADLO C=C/C=C\CC(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC001445356348 984590100 /nfs/dbraw/zinc/59/01/00/984590100.db2.gz XZJWCPPIOOXTPZ-ARJAWSKDSA-N 1 2 245.326 2.248 20 0 BEADLO C=C/C=C\CC(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC001445356348 984590115 /nfs/dbraw/zinc/59/01/15/984590115.db2.gz XZJWCPPIOOXTPZ-ARJAWSKDSA-N 1 2 245.326 2.248 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc(CO)c(C)c1 ZINC001243191901 984662704 /nfs/dbraw/zinc/66/27/04/984662704.db2.gz LQNQIMBBMVMEGA-DROBUMMNSA-N 1 2 203.285 2.363 20 0 BEADLO C[C@@H](NC(=O)Cn1cc[nH+]c1)C1CCCCCC1 ZINC001447502767 984748508 /nfs/dbraw/zinc/74/85/08/984748508.db2.gz LXXCQCQRVUNACA-GFCCVEGCSA-N 1 2 249.358 2.358 20 0 BEADLO CC[NH2+][C@H](C)C(=O)OC[C@@H]1CC=CC[C@H]1C ZINC001577814307 984803686 /nfs/dbraw/zinc/80/36/86/984803686.db2.gz VSLVBBAJLSOGOB-UTUOFQBUSA-N 1 2 225.332 2.130 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(CC1CCC1)C(C)C ZINC001448628608 984816586 /nfs/dbraw/zinc/81/65/86/984816586.db2.gz JVDDWIJVLIYUKX-UHFFFAOYSA-N 1 2 249.358 2.298 20 0 BEADLO CCC[C@H](CC)[N@@H+]1CC[C@@H](O)C(F)(F)C1 ZINC001257262657 984861422 /nfs/dbraw/zinc/86/14/22/984861422.db2.gz DNSGDMYSOPHJNF-VHSXEESVSA-N 1 2 221.291 2.267 20 0 BEADLO CCC[C@H](CC)[N@H+]1CC[C@@H](O)C(F)(F)C1 ZINC001257262657 984861424 /nfs/dbraw/zinc/86/14/24/984861424.db2.gz DNSGDMYSOPHJNF-VHSXEESVSA-N 1 2 221.291 2.267 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1ccc(CO)nc1 ZINC001243467884 984998021 /nfs/dbraw/zinc/99/80/21/984998021.db2.gz CXMRXYPITDMNHS-UHFFFAOYSA-N 1 2 239.278 2.197 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2c(c1)COCC2 ZINC001243473709 985020927 /nfs/dbraw/zinc/02/09/27/985020927.db2.gz ONIBROBFBNCJQV-UHFFFAOYSA-N 1 2 226.279 2.404 20 0 BEADLO Cc1c(F)cncc1-c1ccc[nH+]c1N ZINC001243473503 985022208 /nfs/dbraw/zinc/02/22/08/985022208.db2.gz MBWNOROLCAMEOR-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO Nc1[nH+]cccc1-c1cnc2ccncc2c1 ZINC001243474066 985022559 /nfs/dbraw/zinc/02/25/59/985022559.db2.gz SNKDKPXCMPJJAM-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO Nc1[nH+]cccc1-c1cccc2c1COC2 ZINC001243473994 985024860 /nfs/dbraw/zinc/02/48/60/985024860.db2.gz QUDVEVFSJKCBGO-UHFFFAOYSA-N 1 2 212.252 2.361 20 0 BEADLO Nc1[nH+]cccc1-c1cc(F)cc2nccnc21 ZINC001243473322 985025072 /nfs/dbraw/zinc/02/50/72/985025072.db2.gz KOVXXIZDYHEIPP-UHFFFAOYSA-N 1 2 240.241 2.413 20 0 BEADLO CN1CCOc2cc(-c3ccc[nH+]c3N)ccc21 ZINC001243473989 985025757 /nfs/dbraw/zinc/02/57/57/985025757.db2.gz GVXILDBXJADAHV-UHFFFAOYSA-N 1 2 241.294 2.159 20 0 BEADLO CC(=O)Nc1ccc(F)c(-c2ccc[nH+]c2N)c1 ZINC001243473379 985025971 /nfs/dbraw/zinc/02/59/71/985025971.db2.gz KPRRYNVEADKDEK-UHFFFAOYSA-N 1 2 245.257 2.428 20 0 BEADLO CCNC(=O)c1ccccc1-c1ccc[nH+]c1N ZINC001243473925 985026189 /nfs/dbraw/zinc/02/61/89/985026189.db2.gz FQYKTOKGKBIPBL-UHFFFAOYSA-N 1 2 241.294 2.081 20 0 BEADLO C[S@](=N)(=O)c1ccc(-c2ccc[nH+]c2N)cc1 ZINC001243473979 985026304 /nfs/dbraw/zinc/02/63/04/985026304.db2.gz QMJWAQASOODGKN-KRWDZBQOSA-N 1 2 247.323 2.366 20 0 BEADLO Nc1[nH+]cccc1-c1cnc2cc[nH]c2c1 ZINC001243475462 985026984 /nfs/dbraw/zinc/02/69/84/985026984.db2.gz ZYGYQTXQIXCVDI-UHFFFAOYSA-N 1 2 210.240 2.207 20 0 BEADLO Cc1ccc(O)cc1-c1ccc[nH+]c1N ZINC001243475467 985032196 /nfs/dbraw/zinc/03/21/96/985032196.db2.gz IQXVJBDLECKVIM-UHFFFAOYSA-N 1 2 200.241 2.345 20 0 BEADLO COCOc1cc(-c2ccc[nH+]c2N)ccc1F ZINC001243477416 985038430 /nfs/dbraw/zinc/03/84/30/985038430.db2.gz NCXZYCIPVCTKBN-UHFFFAOYSA-N 1 2 248.257 2.453 20 0 BEADLO CC(C)COc1ncc(-c2ccc[nH+]c2N)cn1 ZINC001243478000 985044267 /nfs/dbraw/zinc/04/42/67/985044267.db2.gz WGPYSPSAQMRBSN-UHFFFAOYSA-N 1 2 244.298 2.156 20 0 BEADLO CC(=O)n1ncc2ccc(-c3c[nH+]cn3C)cc21 ZINC001243479848 985045374 /nfs/dbraw/zinc/04/53/74/985045374.db2.gz XTDVNHADNAZAEG-UHFFFAOYSA-N 1 2 240.266 2.097 20 0 BEADLO Cc1[nH]c([C@@H]2CCCN2C(=O)C(C)C)[nH+]c1C ZINC001455762081 985093512 /nfs/dbraw/zinc/09/35/12/985093512.db2.gz KUZOOXWAJUQQNO-NSHDSACASA-N 1 2 235.331 2.346 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@H]2CCC(C)(C)C2)c[nH+]1 ZINC001456143960 985118798 /nfs/dbraw/zinc/11/87/98/985118798.db2.gz MMSJXRWFEWLUGJ-JTQLQIEISA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@H]2CCC(C)(C)C2)[nH+]1 ZINC001456143960 985118810 /nfs/dbraw/zinc/11/88/10/985118810.db2.gz MMSJXRWFEWLUGJ-JTQLQIEISA-N 1 2 249.358 2.415 20 0 BEADLO CSC=CC(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001456344546 985135991 /nfs/dbraw/zinc/13/59/91/985135991.db2.gz LPNZORUWOGEPJS-PLNGDYQASA-N 1 2 239.344 2.026 20 0 BEADLO CS/C=C\C(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001456344546 985136009 /nfs/dbraw/zinc/13/60/09/985136009.db2.gz LPNZORUWOGEPJS-PLNGDYQASA-N 1 2 239.344 2.026 20 0 BEADLO O=c1cccc(-c2ccc3[nH+]ccn3c2)[nH]1 ZINC001243737564 985275671 /nfs/dbraw/zinc/27/56/71/985275671.db2.gz NHXCPASVGIIRHP-UHFFFAOYSA-N 1 2 211.224 2.102 20 0 BEADLO c1csc(NCc2[nH]c3c([nH+]2)CCCC3)n1 ZINC001458637992 985337401 /nfs/dbraw/zinc/33/74/01/985337401.db2.gz HAOZZVVEUICSGU-UHFFFAOYSA-N 1 2 234.328 2.357 20 0 BEADLO CC(C)c1cnc(C[N@@H+]2C[C@@H](O)C(C)(C)C2)o1 ZINC000687766451 985380357 /nfs/dbraw/zinc/38/03/57/985380357.db2.gz RPYXSKCZNDSOPB-LLVKDONJSA-N 1 2 238.331 2.001 20 0 BEADLO CC(C)c1cnc(C[N@H+]2C[C@@H](O)C(C)(C)C2)o1 ZINC000687766451 985380369 /nfs/dbraw/zinc/38/03/69/985380369.db2.gz RPYXSKCZNDSOPB-LLVKDONJSA-N 1 2 238.331 2.001 20 0 BEADLO CCN(CC)c1ccc(N[C@H]2COC[C@@H]2C)c[nH+]1 ZINC000688046242 985524236 /nfs/dbraw/zinc/52/42/36/985524236.db2.gz IEWNURNFZJJOAR-AAEUAGOBSA-N 1 2 249.358 2.375 20 0 BEADLO CC(C)c1cc(C2=C[NH2+]CCC2)ncn1 ZINC001243947805 985621310 /nfs/dbraw/zinc/62/13/10/985621310.db2.gz OTQMLOLZZXSQKF-UHFFFAOYSA-N 1 2 203.289 2.324 20 0 BEADLO CC(C)(C)Oc1ccc(C2=C[NH2+]CCC2)nn1 ZINC001243947072 985622041 /nfs/dbraw/zinc/62/20/41/985622041.db2.gz CZWQFCPSBIILGC-UHFFFAOYSA-N 1 2 233.315 2.378 20 0 BEADLO CCOC(=O)c1cnc(C2=C[NH2+]CCC2)c(C)c1 ZINC001243947563 985622679 /nfs/dbraw/zinc/62/26/79/985622679.db2.gz LHJCWXIAJZOIJK-UHFFFAOYSA-N 1 2 246.310 2.291 20 0 BEADLO COc1cccc2ncnc(C3=C[NH2+]CCC3)c21 ZINC001243949100 985634015 /nfs/dbraw/zinc/63/40/15/985634015.db2.gz QKRZVYVMNHUZRX-UHFFFAOYSA-N 1 2 241.294 2.363 20 0 BEADLO FC(F)(F)Oc1cnc(C2=C[NH2+]CCC2)cn1 ZINC001243949054 985638329 /nfs/dbraw/zinc/63/83/29/985638329.db2.gz HYUNEXKEMCZKMF-UHFFFAOYSA-N 1 2 245.204 2.100 20 0 BEADLO Fc1ccc2cnnc(C3=C[NH2+]CCC3)c2c1 ZINC001243949696 985641476 /nfs/dbraw/zinc/64/14/76/985641476.db2.gz PXOMYMOWOWANGW-UHFFFAOYSA-N 1 2 229.258 2.493 20 0 BEADLO Cc1cnc2c(ccnc2C2=C[NH2+]CCC2)n1 ZINC001243949965 985643264 /nfs/dbraw/zinc/64/32/64/985643264.db2.gz QCKOIMJCRKLVFK-UHFFFAOYSA-N 1 2 226.283 2.058 20 0 BEADLO Cc1ccc(C[N@@H+](C)[C@@H]2CCOC2)c(Cl)n1 ZINC000688550299 985679823 /nfs/dbraw/zinc/67/98/23/985679823.db2.gz HBBYUZKYMITHFX-LLVKDONJSA-N 1 2 240.734 2.264 20 0 BEADLO Cc1ccc(C[N@H+](C)[C@@H]2CCOC2)c(Cl)n1 ZINC000688550299 985679838 /nfs/dbraw/zinc/67/98/38/985679838.db2.gz HBBYUZKYMITHFX-LLVKDONJSA-N 1 2 240.734 2.264 20 0 BEADLO COc1cc(O)ccc1/C(C)=C/C=C/[NH3+] ZINC001243983211 985714635 /nfs/dbraw/zinc/71/46/35/985714635.db2.gz LTORESQBUHOWGN-DDEWIXKASA-N 1 2 205.257 2.277 20 0 BEADLO Cc1cn(C)nc1C[NH2+][C@@H](C)c1ncccc1C ZINC001460930024 985952969 /nfs/dbraw/zinc/95/29/69/985952969.db2.gz DOZNGJRLMDXBEV-LBPRGKRZSA-N 1 2 244.342 2.283 20 0 BEADLO CC[NH+](CC)c1ccc(Nc2cn(C)nn2)cc1 ZINC001212969319 986087102 /nfs/dbraw/zinc/08/71/02/986087102.db2.gz ZNVJWXFQMZEVKU-UHFFFAOYSA-N 1 2 245.330 2.405 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cccc(F)c1CO ZINC001244561362 986246011 /nfs/dbraw/zinc/24/60/11/986246011.db2.gz INTVZUJSTIKFGS-DDEWIXKASA-N 1 2 207.248 2.194 20 0 BEADLO Cc1cc(-c2cccc(F)c2CO)c[nH+]c1N ZINC001244562679 986250854 /nfs/dbraw/zinc/25/08/54/986250854.db2.gz HMDXZMIDFPPONW-UHFFFAOYSA-N 1 2 232.258 2.271 20 0 BEADLO CCn1cnc(Cl)c1C[N@H+]1CC=CCC1 ZINC001461993457 986256440 /nfs/dbraw/zinc/25/64/40/986256440.db2.gz HGGNRAYTYYJWHT-UHFFFAOYSA-N 1 2 225.723 2.318 20 0 BEADLO CCn1cnc(Cl)c1C[N@@H+]1CC=CCC1 ZINC001461993457 986256449 /nfs/dbraw/zinc/25/64/49/986256449.db2.gz HGGNRAYTYYJWHT-UHFFFAOYSA-N 1 2 225.723 2.318 20 0 BEADLO Cc1n[nH]c(C)c1C[N@@H+]1CC[C@@](C)(F)[C@@H](F)C1 ZINC001139094699 986370692 /nfs/dbraw/zinc/37/06/92/986370692.db2.gz SLLOHSNECYXPMT-NWDGAFQWSA-N 1 2 243.301 2.299 20 0 BEADLO Cc1n[nH]c(C)c1C[N@H+]1CC[C@@](C)(F)[C@@H](F)C1 ZINC001139094699 986370701 /nfs/dbraw/zinc/37/07/01/986370701.db2.gz SLLOHSNECYXPMT-NWDGAFQWSA-N 1 2 243.301 2.299 20 0 BEADLO Cc1ccnc(C[NH2+]Cc2ccc(Cl)nn2)c1 ZINC001462543475 986418695 /nfs/dbraw/zinc/41/86/95/986418695.db2.gz CCPFCYXELYVCDT-UHFFFAOYSA-N 1 2 248.717 2.123 20 0 BEADLO Cc1cc(-c2ccc(CO)cc2F)c[nH+]c1N ZINC001244911276 986449187 /nfs/dbraw/zinc/44/91/87/986449187.db2.gz RHAJBQBYYOPFPK-UHFFFAOYSA-N 1 2 232.258 2.271 20 0 BEADLO Cc1cocc1C(=O)Nc1c(C)c[nH+]cc1C ZINC001462730498 986514940 /nfs/dbraw/zinc/51/49/40/986514940.db2.gz JLBKMGYMXAQZNU-UHFFFAOYSA-N 1 2 230.267 2.274 20 0 BEADLO CNc1cc(-c2ccc(C(N)=O)c(F)c2)cc[nH+]1 ZINC001244972235 986546760 /nfs/dbraw/zinc/54/67/60/986546760.db2.gz LDNILCSMYWQCNM-UHFFFAOYSA-N 1 2 245.257 2.028 20 0 BEADLO CNc1cc(-c2ccc3c(c2)CNC3=O)cc[nH+]1 ZINC001244972172 986549472 /nfs/dbraw/zinc/54/94/72/986549472.db2.gz DRGZKVUBFSXTEM-UHFFFAOYSA-N 1 2 239.278 2.034 20 0 BEADLO CNc1cc(-c2ccn3cc(N)[nH+]c3c2)ccn1 ZINC001244973941 986552371 /nfs/dbraw/zinc/55/23/71/986552371.db2.gz SWENECQLWLJFJG-UHFFFAOYSA-N 1 2 239.282 2.020 20 0 BEADLO CNc1cc(-c2ccc3c(c2)COC3=O)cc[nH+]1 ZINC001244973679 986557326 /nfs/dbraw/zinc/55/73/26/986557326.db2.gz PZHQFWLUQQSGMH-UHFFFAOYSA-N 1 2 240.262 2.461 20 0 BEADLO COC(=O)[C@@H](CC(C)C)[N@@H+]1CCC[C@@H](F)C1 ZINC000689423632 986581344 /nfs/dbraw/zinc/58/13/44/986581344.db2.gz CUOFZGSRUGYFIZ-GHMZBOCLSA-N 1 2 231.311 2.008 20 0 BEADLO COC(=O)[C@@H](CC(C)C)[N@H+]1CCC[C@@H](F)C1 ZINC000689423632 986581347 /nfs/dbraw/zinc/58/13/47/986581347.db2.gz CUOFZGSRUGYFIZ-GHMZBOCLSA-N 1 2 231.311 2.008 20 0 BEADLO COc1cnc(F)c(-c2c[nH+]c(N)c(C)c2)c1 ZINC001245063428 986626189 /nfs/dbraw/zinc/62/61/89/986626189.db2.gz WEVALSQZJYDOSH-UHFFFAOYSA-N 1 2 233.246 2.182 20 0 BEADLO COc1cc(-c2cc[nH+]c3c2CCN3)cnc1F ZINC001245080999 986644178 /nfs/dbraw/zinc/64/41/78/986644178.db2.gz URIGJWYIVPDABV-UHFFFAOYSA-N 1 2 245.257 2.259 20 0 BEADLO c1cn2cccc(C3=CCCOC3)c2[nH+]1 ZINC001245157344 986687031 /nfs/dbraw/zinc/68/70/31/986687031.db2.gz GBDHTVOVHFLPQP-UHFFFAOYSA-N 1 2 200.241 2.138 20 0 BEADLO c1cn(Cc2ccc(C3=CCCOC3)nc2)c[nH+]1 ZINC001245157738 986689957 /nfs/dbraw/zinc/68/99/57/986689957.db2.gz CBHFNNFNFXBJJC-UHFFFAOYSA-N 1 2 241.294 2.130 20 0 BEADLO CCc1cc(NC(=S)NCC(C)C)cc[nH+]1 ZINC001245212584 986734402 /nfs/dbraw/zinc/73/44/02/986734402.db2.gz STOXNFPGJCBNMU-UHFFFAOYSA-N 1 2 237.372 2.008 20 0 BEADLO O=c1ccc(C[N@@H+]2Cc3cccc(F)c3C2)c[nH]1 ZINC001139468711 986750736 /nfs/dbraw/zinc/75/07/36/986750736.db2.gz PEKQOOBEPFKHRR-UHFFFAOYSA-N 1 2 244.269 2.442 20 0 BEADLO O=c1ccc(C[N@H+]2Cc3cccc(F)c3C2)c[nH]1 ZINC001139468711 986750744 /nfs/dbraw/zinc/75/07/44/986750744.db2.gz PEKQOOBEPFKHRR-UHFFFAOYSA-N 1 2 244.269 2.442 20 0 BEADLO CCOC(=O)c1ccc(/C(C)=C/C=C/[NH3+])cn1 ZINC001245254729 986760107 /nfs/dbraw/zinc/76/01/07/986760107.db2.gz PDNPYJMRLYNHIL-DXNUHORPSA-N 1 2 232.283 2.134 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cnc(OC(C)C)nc1 ZINC001245261743 986763667 /nfs/dbraw/zinc/76/36/67/986763667.db2.gz PAGYIJLHRRGUCA-GQYICFGZSA-N 1 2 219.288 2.140 20 0 BEADLO Cc1cc(-c2cnc(OC(C)C)nc2)c[nH+]c1N ZINC001245262027 986765507 /nfs/dbraw/zinc/76/55/07/986765507.db2.gz KUXUTEXAJZYGTF-UHFFFAOYSA-N 1 2 244.298 2.216 20 0 BEADLO Cc1cc(C)c(C[N@H+]2CCC(=O)C[C@H]2C)[nH]1 ZINC001137322445 986771568 /nfs/dbraw/zinc/77/15/68/986771568.db2.gz FGURGUPOTWCNSA-LLVKDONJSA-N 1 2 220.316 2.185 20 0 BEADLO Cc1cc(C)c(C[N@@H+]2CCC(=O)C[C@H]2C)[nH]1 ZINC001137322445 986771576 /nfs/dbraw/zinc/77/15/76/986771576.db2.gz FGURGUPOTWCNSA-LLVKDONJSA-N 1 2 220.316 2.185 20 0 BEADLO O=C1C[N@H+](C2Cc3ccccc3C2)CCC[C@@H]1F ZINC001255020707 986779851 /nfs/dbraw/zinc/77/98/51/986779851.db2.gz ZRXSGCICMQPFNS-AWEZNQCLSA-N 1 2 247.313 2.157 20 0 BEADLO O=C1C[N@@H+](C2Cc3ccccc3C2)CCC[C@@H]1F ZINC001255020707 986779861 /nfs/dbraw/zinc/77/98/61/986779861.db2.gz ZRXSGCICMQPFNS-AWEZNQCLSA-N 1 2 247.313 2.157 20 0 BEADLO COC1C[NH+](Cc2c[nH]c3ccc(F)cc23)C1 ZINC001137333847 986797953 /nfs/dbraw/zinc/79/79/53/986797953.db2.gz WCMWGTLBSFFEDH-UHFFFAOYSA-N 1 2 234.274 2.138 20 0 BEADLO Nc1[nH+]cccc1-c1c[nH]c2cnccc21 ZINC001245394736 986831635 /nfs/dbraw/zinc/83/16/35/986831635.db2.gz MIBJHMVFHCNQCV-UHFFFAOYSA-N 1 2 210.240 2.207 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)N[C@@H]1C=CCC1 ZINC001467068902 986835779 /nfs/dbraw/zinc/83/57/79/986835779.db2.gz XJUKOEGUXPKAEN-SNVBAGLBSA-N 1 2 242.282 2.174 20 0 BEADLO COc1cc(-c2ccc(C)c(N)[nH+]2)ccc1N ZINC001245501346 986879344 /nfs/dbraw/zinc/87/93/44/986879344.db2.gz HJSRDBWWYFPOBK-UHFFFAOYSA-N 1 2 229.283 2.230 20 0 BEADLO Nc1ncc(-c2cc3[nH]ccc3c[nH+]2)cc1F ZINC001245513077 986891043 /nfs/dbraw/zinc/89/10/43/986891043.db2.gz PPXBRSZEBYUDAL-UHFFFAOYSA-N 1 2 228.230 2.346 20 0 BEADLO Cc1cc(-c2cnc(OC(C)C)cn2)c[nH+]c1N ZINC001245535613 986908660 /nfs/dbraw/zinc/90/86/60/986908660.db2.gz LLUGCCCWJXBKPH-UHFFFAOYSA-N 1 2 244.298 2.216 20 0 BEADLO Cc1cc(-c2ccnc(F)c2)c[nH+]c1N ZINC001245536844 986912136 /nfs/dbraw/zinc/91/21/36/986912136.db2.gz NAMRFTBSUYIFKT-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO Cc1cc(-c2cnc3ncoc3c2)c[nH+]c1N ZINC001245535959 986914187 /nfs/dbraw/zinc/91/41/87/986914187.db2.gz GGBRBMWNAVCVCG-UHFFFAOYSA-N 1 2 226.239 2.175 20 0 BEADLO Cc1cc(-c2ccc3c(n2)CCOC3)c[nH+]c1N ZINC001245536860 986915796 /nfs/dbraw/zinc/91/57/96/986915796.db2.gz APTOAMQQSNXGAC-UHFFFAOYSA-N 1 2 241.294 2.107 20 0 BEADLO COc1c(F)nccc1-c1c[nH+]c(N)c(C)c1 ZINC001245537589 986918647 /nfs/dbraw/zinc/91/86/47/986918647.db2.gz RTXDHKMOZBMRTG-UHFFFAOYSA-N 1 2 233.246 2.182 20 0 BEADLO Cc1cc(-c2ccc(F)nc2)c[nH+]c1N ZINC001245537544 986920795 /nfs/dbraw/zinc/92/07/95/986920795.db2.gz QZPOGVAKORUPRB-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO Cc1cc(-c2cccc(C(N)=O)c2C)c[nH+]c1N ZINC001245537561 986921723 /nfs/dbraw/zinc/92/17/23/986921723.db2.gz FYOHMBYRVVURSU-UHFFFAOYSA-N 1 2 241.294 2.047 20 0 BEADLO Cc1cc(-c2cc(C3CC3)ncn2)c[nH+]c1N ZINC001245539322 986926711 /nfs/dbraw/zinc/92/67/11/986926711.db2.gz XNGVIXZCGXALGP-UHFFFAOYSA-N 1 2 226.283 2.307 20 0 BEADLO COC(=O)c1ccc(/C(C)=C/C=C/[NH3+])c(OC)c1 ZINC001245631679 987009436 /nfs/dbraw/zinc/00/94/36/987009436.db2.gz RQQUELWIFJDZEF-DXNUHORPSA-N 1 2 247.294 2.358 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@H](C)Cc1ccc(C)cc1 ZINC001255775598 987070251 /nfs/dbraw/zinc/07/02/51/987070251.db2.gz ZTHUPMBTONSMIK-NEPJUHHUSA-N 1 2 235.327 2.077 20 0 BEADLO O=C1CC(C2CC[NH2+]CC2)=NN1CC1CCCC1 ZINC001245918545 987160088 /nfs/dbraw/zinc/16/00/88/987160088.db2.gz WLPMMGHMUFGDPO-UHFFFAOYSA-N 1 2 249.358 2.246 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H]2CCCC23CC3)c[nH+]1 ZINC001472020090 987164079 /nfs/dbraw/zinc/16/40/79/987164079.db2.gz CBBJSWWZGOHGEQ-NSHDSACASA-N 1 2 247.342 2.169 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H]2CCCC23CC3)[nH+]1 ZINC001472020090 987164093 /nfs/dbraw/zinc/16/40/93/987164093.db2.gz CBBJSWWZGOHGEQ-NSHDSACASA-N 1 2 247.342 2.169 20 0 BEADLO CC(C)CC[C@H](C)[NH+]1CC(O)(C(F)(F)F)C1 ZINC001256366974 987181649 /nfs/dbraw/zinc/18/16/49/987181649.db2.gz UQKKWJLKGSCARW-VIFPVBQESA-N 1 2 239.281 2.420 20 0 BEADLO C[C@H]1C[C@H]1c1nnc(CN(C)c2cccc[nH+]2)o1 ZINC001256659976 987266616 /nfs/dbraw/zinc/26/66/16/987266616.db2.gz UQIDCRTXBCUJDT-VHSXEESVSA-N 1 2 244.298 2.224 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)C/C=C\Cl ZINC000207771805 987395304 /nfs/dbraw/zinc/39/53/04/987395304.db2.gz DPSVSLYRBDZMCA-PLNGDYQASA-N 1 2 214.696 2.476 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)C/C=C\Cl ZINC000207771805 987395308 /nfs/dbraw/zinc/39/53/08/987395308.db2.gz DPSVSLYRBDZMCA-PLNGDYQASA-N 1 2 214.696 2.476 20 0 BEADLO CC(C)N(CC1CC1)C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001115897697 987409140 /nfs/dbraw/zinc/40/91/40/987409140.db2.gz LUCWHFBTRFDOFF-LLVKDONJSA-N 1 2 235.331 2.091 20 0 BEADLO Cc1ccc(O)c(NC(=O)[C@H](C)n2cc[nH+]c2)c1 ZINC001115901335 987410798 /nfs/dbraw/zinc/41/07/98/987410798.db2.gz RQZMXNYNSIXNDF-JTQLQIEISA-N 1 2 245.282 2.097 20 0 BEADLO C[C@H](C(=O)NC1C[C@H](C)C[C@@H](C)C1)n1cc[nH+]c1 ZINC001116115606 987446870 /nfs/dbraw/zinc/44/68/70/987446870.db2.gz OHCGCSFWRJJZRG-IJLUTSLNSA-N 1 2 249.358 2.385 20 0 BEADLO COC[C@@H]([NH2+]Cc1cc(C)n[nH]1)c1ccc(C)o1 ZINC001116190716 987466418 /nfs/dbraw/zinc/46/64/18/987466418.db2.gz LXWKZUQSWDIZSH-GFCCVEGCSA-N 1 2 249.314 2.097 20 0 BEADLO C[C@H](C(=O)N[C@@H]1CCCC1(C)C)n1cc[nH+]c1 ZINC001116210032 987480430 /nfs/dbraw/zinc/48/04/30/987480430.db2.gz GWOZOVGPDSEPKR-GHMZBOCLSA-N 1 2 235.331 2.139 20 0 BEADLO Cc1cc(CNc2ccc3c(c2)[nH+]cn3C)n[nH]1 ZINC001116317707 987518232 /nfs/dbraw/zinc/51/82/32/987518232.db2.gz BCFJWXLQGOEFIM-UHFFFAOYSA-N 1 2 241.298 2.217 20 0 BEADLO C[N@H+](Cc1ncccn1)[C@H]1C=CCCC1 ZINC001473753202 987544353 /nfs/dbraw/zinc/54/43/53/987544353.db2.gz SMRSZMKYHVSQCP-NSHDSACASA-N 1 2 203.289 2.017 20 0 BEADLO C[N@@H+](Cc1ncccn1)[C@H]1C=CCCC1 ZINC001473753202 987544367 /nfs/dbraw/zinc/54/43/67/987544367.db2.gz SMRSZMKYHVSQCP-NSHDSACASA-N 1 2 203.289 2.017 20 0 BEADLO Cc1cc(CNc2ccn(C)n2)cc(C)[nH+]1 ZINC001474067107 987636649 /nfs/dbraw/zinc/63/66/49/987636649.db2.gz CPSCBCNYZHOMQQ-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO Cc1cc(C[N@@H+]2CCS[C@@H](C)CC2)n[nH]1 ZINC001116762317 987701295 /nfs/dbraw/zinc/70/12/95/987701295.db2.gz KDESQNMPTKJEMG-JTQLQIEISA-N 1 2 225.361 2.046 20 0 BEADLO Cc1cc(C[N@H+]2CCS[C@@H](C)CC2)n[nH]1 ZINC001116762317 987701302 /nfs/dbraw/zinc/70/13/02/987701302.db2.gz KDESQNMPTKJEMG-JTQLQIEISA-N 1 2 225.361 2.046 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@H](C)Cc1ccc(C)cc1 ZINC001116866500 987740398 /nfs/dbraw/zinc/74/03/98/987740398.db2.gz ZTHUPMBTONSMIK-VXGBXAGGSA-N 1 2 235.327 2.077 20 0 BEADLO Nc1[nH+]cccc1CNc1cnc2[nH]ccc2c1 ZINC001474706705 987805673 /nfs/dbraw/zinc/80/56/73/987805673.db2.gz JJBASEZGDRIKMT-UHFFFAOYSA-N 1 2 239.282 2.104 20 0 BEADLO C[NH+](C)Cc1nnc(CCC2CCCC2)o1 ZINC001117260582 987812497 /nfs/dbraw/zinc/81/24/97/987812497.db2.gz NPCTWNIFFFYOHM-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO C[C@H]1CC(N[C@H]2C[NH2+]CC2(F)F)C[C@H](C)C1 ZINC001246456445 987812817 /nfs/dbraw/zinc/81/28/17/987812817.db2.gz AOESSGJAFBPISP-KKZNHRDASA-N 1 2 232.318 2.008 20 0 BEADLO CC1(NC(=O)c2ccc(-n3cc[nH+]c3)cc2)CC1 ZINC001117451439 987838512 /nfs/dbraw/zinc/83/85/12/987838512.db2.gz ZPKQFNSUKMCYBW-UHFFFAOYSA-N 1 2 241.294 2.155 20 0 BEADLO Cc1cc(C[N@@H+]2CC(C)(C)[C@@H]2C2CC2)n[nH]1 ZINC001117641930 987849067 /nfs/dbraw/zinc/84/90/67/987849067.db2.gz OZFVSMPPDCOHQL-LBPRGKRZSA-N 1 2 219.332 2.339 20 0 BEADLO Cc1cc(C[N@H+]2CC(C)(C)[C@@H]2C2CC2)n[nH]1 ZINC001117641930 987849072 /nfs/dbraw/zinc/84/90/72/987849072.db2.gz OZFVSMPPDCOHQL-LBPRGKRZSA-N 1 2 219.332 2.339 20 0 BEADLO C[C@@H](C(=O)N(C1CCC1)C1CCC1)n1cc[nH+]c1 ZINC001117726510 987876793 /nfs/dbraw/zinc/87/67/93/987876793.db2.gz DWZSDNQVQNNHTF-NSHDSACASA-N 1 2 247.342 2.378 20 0 BEADLO CC(C)=CCC[C@@H](C)[N@H+]1C[C@@H](F)[C@@H](N)C1 ZINC001246526119 987879858 /nfs/dbraw/zinc/87/98/58/987879858.db2.gz MBGNCVHCPDYAND-UTUOFQBUSA-N 1 2 214.328 2.102 20 0 BEADLO CC(C)=CCC[C@@H](C)[N@@H+]1C[C@@H](F)[C@@H](N)C1 ZINC001246526119 987879862 /nfs/dbraw/zinc/87/98/62/987879862.db2.gz MBGNCVHCPDYAND-UTUOFQBUSA-N 1 2 214.328 2.102 20 0 BEADLO CC[C@@H](C)CC(=O)NC1C[NH+](CC=C(C)C)C1 ZINC001494377052 988134081 /nfs/dbraw/zinc/13/40/81/988134081.db2.gz HCUUAFNTCFBGOL-GFCCVEGCSA-N 1 2 238.375 2.189 20 0 BEADLO CCC1(C)CCN(C(=O)[C@H](C)n2cc[nH+]c2)CC1 ZINC001322278734 988187713 /nfs/dbraw/zinc/18/77/13/988187713.db2.gz GEUBRABGPRAAJV-LBPRGKRZSA-N 1 2 249.358 2.483 20 0 BEADLO C[C@H]1CC[C@H](c2nnc(C[NH+](C)C)o2)C1 ZINC001118419374 988335292 /nfs/dbraw/zinc/33/52/92/988335292.db2.gz VRSRDGZFFSHUDF-IUCAKERBSA-N 1 2 209.293 2.035 20 0 BEADLO C[C@@H]1CCC[C@@H](c2nnc(C[NH+](C)C)o2)C1 ZINC001322984488 988422766 /nfs/dbraw/zinc/42/27/66/988422766.db2.gz VLELNKARCDMCDA-NXEZZACHSA-N 1 2 223.320 2.425 20 0 BEADLO C[C@@H]1CCC[C@H](c2nnc(C[NH+](C)C)o2)C1 ZINC001322984493 988423925 /nfs/dbraw/zinc/42/39/25/988423925.db2.gz VLELNKARCDMCDA-ZJUUUORDSA-N 1 2 223.320 2.425 20 0 BEADLO CC(C)(NC(=O)Cc1[nH]cc[nH+]1)C1CCCCC1 ZINC001118575452 988457990 /nfs/dbraw/zinc/45/79/90/988457990.db2.gz BOLJYTPGGLWLRB-UHFFFAOYSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@H](C(=O)N1CCC[C@@H](C)[C@H]1C)n1cc[nH+]c1 ZINC001323146509 988460095 /nfs/dbraw/zinc/46/00/95/988460095.db2.gz QDDPVDAGJGGBAZ-IJLUTSLNSA-N 1 2 235.331 2.091 20 0 BEADLO CCC(C)(C)[C@@H](C)NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001118727368 988524171 /nfs/dbraw/zinc/52/41/71/988524171.db2.gz YOEVFLSCOYUVMQ-WDEREUQCSA-N 1 2 237.347 2.385 20 0 BEADLO C[C@H]1CC([N@@H+]2CC[C@@H](N)C(F)(F)C2)C[C@H](C)C1 ZINC001246837628 988540712 /nfs/dbraw/zinc/54/07/12/988540712.db2.gz RHMDZYPXUBKKNV-CKYFFXLPSA-N 1 2 246.345 2.479 20 0 BEADLO C[C@H]1CC([N@H+]2CC[C@@H](N)C(F)(F)C2)C[C@H](C)C1 ZINC001246837628 988540731 /nfs/dbraw/zinc/54/07/31/988540731.db2.gz RHMDZYPXUBKKNV-CKYFFXLPSA-N 1 2 246.345 2.479 20 0 BEADLO Cc1cc(-n2cc[nH+]c2)ccc1CSCCO ZINC001323664910 988579872 /nfs/dbraw/zinc/57/98/72/988579872.db2.gz QUNBCCJWESHRFW-UHFFFAOYSA-N 1 2 248.351 2.406 20 0 BEADLO C[C@@H]1CC[C@@]2(CCN(c3cc(N)nc[nH+]3)C2)C1 ZINC001548515178 988678383 /nfs/dbraw/zinc/67/83/83/988678383.db2.gz SUABKUWXGXZTRK-ZWNOBZJWSA-N 1 2 232.331 2.075 20 0 BEADLO C[C@H](O)CCCn1c[nH+]c(C(C)(C)C)c1 ZINC001118928149 988711783 /nfs/dbraw/zinc/71/17/83/988711783.db2.gz XAGFHYFBWCENRO-JTQLQIEISA-N 1 2 210.321 2.342 20 0 BEADLO CCc1nc(Cn2c[nH+]c(C(C)(C)C)c2)no1 ZINC001118986656 988775789 /nfs/dbraw/zinc/77/57/89/988775789.db2.gz LIGWGBWIRXFJJP-UHFFFAOYSA-N 1 2 234.303 2.174 20 0 BEADLO C[C@@H](C(=O)NC[C@H]1CCCC1(C)C)n1cc[nH+]c1 ZINC001324454994 988845921 /nfs/dbraw/zinc/84/59/21/988845921.db2.gz VAZKDELTKILEET-NWDGAFQWSA-N 1 2 249.358 2.387 20 0 BEADLO CCC[C@@H]1CCCN1C(=O)CCn1cc[nH+]c1 ZINC001514711713 988926304 /nfs/dbraw/zinc/92/63/04/988926304.db2.gz UATWNULZVUJIGC-GFCCVEGCSA-N 1 2 235.331 2.064 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N[C@@H](C)C2(C)CC2)c[nH+]1 ZINC001514813384 988941685 /nfs/dbraw/zinc/94/16/85/988941685.db2.gz CWTFVQAHGIFJNH-NSHDSACASA-N 1 2 249.358 2.231 20 0 BEADLO C/C=C(/C)C(=O)OCCc1cn2c([nH+]1)CCCC2 ZINC001515195654 988999207 /nfs/dbraw/zinc/99/92/07/988999207.db2.gz CQDQSTFXRHVOFR-JYOAFUTRSA-N 1 2 248.326 2.271 20 0 BEADLO COC(C)(C)CN(C)c1cc(F)cc(C)[nH+]1 ZINC001515566465 989065901 /nfs/dbraw/zinc/06/59/01/989065901.db2.gz YEGOZMXKUJCBKN-UHFFFAOYSA-N 1 2 226.295 2.390 20 0 BEADLO CC(C)[C@@H](C)C(=O)OCC(C)(C)n1cc[nH+]c1 ZINC001515911844 989129413 /nfs/dbraw/zinc/12/94/13/989129413.db2.gz DFSMMDVHQXKQNU-LLVKDONJSA-N 1 2 238.331 2.454 20 0 BEADLO CCN(C(=O)[C@@H](C)n1cc[nH+]c1)C1CC(C)(C)C1 ZINC001325260888 989134387 /nfs/dbraw/zinc/13/43/87/989134387.db2.gz IUMBGPWNEWYLIK-LLVKDONJSA-N 1 2 249.358 2.481 20 0 BEADLO Fc1ccc(C[N@@H+]2CCO[C@H]3C[C@H]32)c2[nH]ccc21 ZINC001248818392 989170274 /nfs/dbraw/zinc/17/02/74/989170274.db2.gz KQTPGMVJEDJFJD-OLZOCXBDSA-N 1 2 246.285 2.280 20 0 BEADLO Fc1ccc(C[N@H+]2CCO[C@H]3C[C@H]32)c2[nH]ccc21 ZINC001248818392 989170277 /nfs/dbraw/zinc/17/02/77/989170277.db2.gz KQTPGMVJEDJFJD-OLZOCXBDSA-N 1 2 246.285 2.280 20 0 BEADLO CCc1cc(N[C@@H](CO)C(C)C)nc(CC)[nH+]1 ZINC001516926745 989183076 /nfs/dbraw/zinc/18/30/76/989183076.db2.gz BQBIUPNUZPVXKY-NSHDSACASA-N 1 2 237.347 2.030 20 0 BEADLO CC(C)Sc1nccc(C[NH+]2CC=CC2)n1 ZINC001248829967 989188783 /nfs/dbraw/zinc/18/87/83/989188783.db2.gz YGCCXQMSWBMZLO-UHFFFAOYSA-N 1 2 235.356 2.349 20 0 BEADLO C[C@H]1CN(CC2CCC(F)(F)CC2)CC[N@@H+]1C ZINC001325502261 989202031 /nfs/dbraw/zinc/20/20/31/989202031.db2.gz PCIALXCULXPKEY-NSHDSACASA-N 1 2 246.345 2.448 20 0 BEADLO C[C@H]1CN(CC2CCC(F)(F)CC2)CC[N@H+]1C ZINC001325502261 989202039 /nfs/dbraw/zinc/20/20/39/989202039.db2.gz PCIALXCULXPKEY-NSHDSACASA-N 1 2 246.345 2.448 20 0 BEADLO C(=C/C1CC1)\CNc1cc(NC2CC2)[nH+]cn1 ZINC001325562839 989208082 /nfs/dbraw/zinc/20/80/82/989208082.db2.gz CIROTBKTUOFECN-OWOJBTEDSA-N 1 2 230.315 2.429 20 0 BEADLO C(=C/C1CC1)\CNc1cc(NC2CC2)nc[nH+]1 ZINC001325562839 989208096 /nfs/dbraw/zinc/20/80/96/989208096.db2.gz CIROTBKTUOFECN-OWOJBTEDSA-N 1 2 230.315 2.429 20 0 BEADLO C[C@@H](C(=O)N[C@H]1[C@H](C)CCC[C@@H]1C)n1cc[nH+]c1 ZINC001325556113 989209920 /nfs/dbraw/zinc/20/99/20/989209920.db2.gz UBXKNKBWYHPTGY-QNWHQSFQSA-N 1 2 249.358 2.385 20 0 BEADLO CCCO[C@H]1CC[N@H+](Cc2nc(C)cc(C)n2)C1 ZINC001248965980 989232478 /nfs/dbraw/zinc/23/24/78/989232478.db2.gz QMACYOHIPOJMLE-ZDUSSCGKSA-N 1 2 249.358 2.094 20 0 BEADLO CCCO[C@H]1CC[N@@H+](Cc2nc(C)cc(C)n2)C1 ZINC001248965980 989232488 /nfs/dbraw/zinc/23/24/88/989232488.db2.gz QMACYOHIPOJMLE-ZDUSSCGKSA-N 1 2 249.358 2.094 20 0 BEADLO CCn1c[nH+]cc1COC(=O)C1(C)CC=CC1 ZINC001518047031 989270976 /nfs/dbraw/zinc/27/09/76/989270976.db2.gz BTGUVOQFNDRZFD-UHFFFAOYSA-N 1 2 234.299 2.303 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@H]1CC12CCC2 ZINC001518047102 989277657 /nfs/dbraw/zinc/27/76/57/989277657.db2.gz CIVAEIJHICTMOX-LLVKDONJSA-N 1 2 234.299 2.136 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)C(F)=C1CCC1 ZINC001518364445 989299488 /nfs/dbraw/zinc/29/94/88/989299488.db2.gz FZGMFJLHNCRMMQ-UHFFFAOYSA-N 1 2 234.274 2.466 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)C1CC2(CC2)C1 ZINC001518366609 989299682 /nfs/dbraw/zinc/29/96/82/989299682.db2.gz RZRQCAPNTMVTPL-UHFFFAOYSA-N 1 2 230.311 2.249 20 0 BEADLO CC(C)=CC(=O)Nc1c(C)c[nH+]cc1C ZINC001518383837 989302030 /nfs/dbraw/zinc/30/20/30/989302030.db2.gz LJQWCZQUFUSDMF-UHFFFAOYSA-N 1 2 204.273 2.025 20 0 BEADLO CC[C@@H]1CC[C@H](C(=O)Nc2c(C)c[nH+]cc2C)O1 ZINC001518385935 989303467 /nfs/dbraw/zinc/30/34/67/989303467.db2.gz YERPCFKCGVXDDJ-VXGBXAGGSA-N 1 2 248.326 2.016 20 0 BEADLO CO[C@H]1CCC[N@H+](Cc2cc(C)sn2)C1 ZINC001249570489 989303971 /nfs/dbraw/zinc/30/39/71/989303971.db2.gz DRBRHZWPIYEGKU-NSHDSACASA-N 1 2 226.345 2.062 20 0 BEADLO CO[C@H]1CCC[N@@H+](Cc2cc(C)sn2)C1 ZINC001249570489 989303979 /nfs/dbraw/zinc/30/39/79/989303979.db2.gz DRBRHZWPIYEGKU-NSHDSACASA-N 1 2 226.345 2.062 20 0 BEADLO Cc1cc(N)n(-c2cc[nH+]cc2C(F)(F)F)n1 ZINC001249583335 989317576 /nfs/dbraw/zinc/31/75/76/989317576.db2.gz GVLRCVPADMIPPG-UHFFFAOYSA-N 1 2 242.204 2.177 20 0 BEADLO CCCCCCNC(=O)CCc1[nH+]ccn1C ZINC001518833271 989342784 /nfs/dbraw/zinc/34/27/84/989342784.db2.gz GDDOZEKXVBTETO-UHFFFAOYSA-N 1 2 237.347 2.049 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2CCC[C@@H](F)C2)n1 ZINC001326236889 989438884 /nfs/dbraw/zinc/43/88/84/989438884.db2.gz RMWBSACZNMPLDX-RKDXNWHRSA-N 1 2 227.283 2.175 20 0 BEADLO CCCN(c1nccn2c[nH+]cc12)C1CC1 ZINC001120031241 989571357 /nfs/dbraw/zinc/57/13/57/989571357.db2.gz PFFHWIQRSCJAOP-UHFFFAOYSA-N 1 2 216.288 2.108 20 0 BEADLO COC1(C)C[NH+](CCc2ccc(F)cc2F)C1 ZINC001326787624 989711090 /nfs/dbraw/zinc/71/10/90/989711090.db2.gz SCOBUXNZLSSSDU-UHFFFAOYSA-N 1 2 241.281 2.228 20 0 BEADLO C[C@@H](c1ccccc1)[C@@H](O)C[NH2+]CC(F)F ZINC001120583882 989755911 /nfs/dbraw/zinc/75/59/11/989755911.db2.gz ZSKTURGXNCXXNY-ONGXEEELSA-N 1 2 229.270 2.006 20 0 BEADLO C/C(=C\c1nnc(C[NH+](C)C)o1)c1ccco1 ZINC001326987710 989799189 /nfs/dbraw/zinc/79/91/89/989799189.db2.gz NJKWICUQXQIGFA-VQHVLOKHSA-N 1 2 233.271 2.285 20 0 BEADLO CCC[C@@H]1CCCN1C(=O)CCc1[nH]cc[nH+]1 ZINC001120790426 989882265 /nfs/dbraw/zinc/88/22/65/989882265.db2.gz DDVWPBZHNVIGAC-LLVKDONJSA-N 1 2 235.331 2.133 20 0 BEADLO CCc1ccc(N2CCOC[C@H](C)C2)[nH+]c1 ZINC001120829013 989907095 /nfs/dbraw/zinc/90/70/95/989907095.db2.gz XSCGXKWLYXMBBZ-LLVKDONJSA-N 1 2 220.316 2.117 20 0 BEADLO CCc1ccc(N(C)[C@H]2CC[C@H]2OC)[nH+]c1 ZINC001120880966 989942092 /nfs/dbraw/zinc/94/20/92/989942092.db2.gz DVABYOFNVMZZOE-NWDGAFQWSA-N 1 2 220.316 2.258 20 0 BEADLO CC(C)CC[C@H]1CCCN1c1cc(N)nc[nH+]1 ZINC001120910371 989962641 /nfs/dbraw/zinc/96/26/41/989962641.db2.gz NSLJEFSVBDMHHU-LLVKDONJSA-N 1 2 234.347 2.464 20 0 BEADLO C[C@H](CC(=O)N1C[C@H]2CCCC[C@H]21)n1cc[nH+]c1 ZINC001121147244 990026695 /nfs/dbraw/zinc/02/66/95/990026695.db2.gz PMVGBSRFOWTWKL-JHJVBQTASA-N 1 2 247.342 2.235 20 0 BEADLO Cc1ccc(C(=O)OCCCc2c[nH+]cn2C)o1 ZINC001525847981 990079145 /nfs/dbraw/zinc/07/91/45/990079145.db2.gz RXJGVZLVGOYRAD-UHFFFAOYSA-N 1 2 248.282 2.111 20 0 BEADLO CC(C)[N@@H+]1CCC[C@H]1C(=O)OCC(C)(F)F ZINC001526353897 990130199 /nfs/dbraw/zinc/13/01/99/990130199.db2.gz XWQBZWLECHDGHO-VIFPVBQESA-N 1 2 235.274 2.058 20 0 BEADLO CC(C)[N@H+]1CCC[C@H]1C(=O)OCC(C)(F)F ZINC001526353897 990130208 /nfs/dbraw/zinc/13/02/08/990130208.db2.gz XWQBZWLECHDGHO-VIFPVBQESA-N 1 2 235.274 2.058 20 0 BEADLO Cc1coc(C(=O)Nc2ccn3cc[nH+]c3c2)c1 ZINC001527606101 990229360 /nfs/dbraw/zinc/22/93/60/990229360.db2.gz AGCYFDMUNCRCEV-UHFFFAOYSA-N 1 2 241.250 2.488 20 0 BEADLO C[C@H]1CCC(C)(C)N1C(=O)CCc1[nH+]ccn1C ZINC001528483106 990293206 /nfs/dbraw/zinc/29/32/06/990293206.db2.gz GUZOAGGBPJDSCM-NSHDSACASA-N 1 2 249.358 2.142 20 0 BEADLO CC(C)CC1(NC(=O)CCc2[nH+]ccn2C)CC1 ZINC001528611307 990301993 /nfs/dbraw/zinc/30/19/93/990301993.db2.gz UKFYCRCBVVVTLB-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO Cc1cocc1C(=O)Nc1cc(C)[nH+]cc1C ZINC001535599278 990474493 /nfs/dbraw/zinc/47/44/93/990474493.db2.gz CSNIIEYAWLBCEQ-UHFFFAOYSA-N 1 2 230.267 2.274 20 0 BEADLO CC[C@@H](C)C(=O)OCC(C)(C)n1cc[nH+]c1 ZINC001123160221 990520406 /nfs/dbraw/zinc/52/04/06/990520406.db2.gz FJKDRTSSQFNYSR-SNVBAGLBSA-N 1 2 224.304 2.208 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1ccc(C)c(F)c1 ZINC001538612096 990537340 /nfs/dbraw/zinc/53/73/40/990537340.db2.gz AONXIAHNODOTDI-LBPRGKRZSA-N 1 2 236.290 2.167 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1ccc(C)c(F)c1 ZINC001538612096 990537344 /nfs/dbraw/zinc/53/73/44/990537344.db2.gz AONXIAHNODOTDI-LBPRGKRZSA-N 1 2 236.290 2.167 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1cccc(Cl)c1 ZINC001538812900 990546046 /nfs/dbraw/zinc/54/60/46/990546046.db2.gz MWRHVEDGABONNO-LLVKDONJSA-N 1 2 238.718 2.373 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1cccc(Cl)c1 ZINC001538812900 990546050 /nfs/dbraw/zinc/54/60/50/990546050.db2.gz MWRHVEDGABONNO-LLVKDONJSA-N 1 2 238.718 2.373 20 0 BEADLO CCn1c[nH+]cc1COC(=O)[C@@H]1CC[C@H]2C[C@H]2C1 ZINC001123377402 990568440 /nfs/dbraw/zinc/56/84/40/990568440.db2.gz HVLOFUWECDCZAU-TUAOUCFPSA-N 1 2 248.326 2.382 20 0 BEADLO Cn1cc[nH+]c1CCC(=O)NCC1CCCCC1 ZINC001123572949 990616222 /nfs/dbraw/zinc/61/62/22/990616222.db2.gz JHRVXYCLTGWTPR-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO O=C(Nc1ccccc1-n1cc[nH+]c1)[C@@H]1C[C@H]1F ZINC001540721367 990643525 /nfs/dbraw/zinc/64/35/25/990643525.db2.gz ZRADVOFQUAZQLQ-NXEZZACHSA-N 1 2 245.257 2.169 20 0 BEADLO Cc1[nH]c2ccc(NC(=O)[C@@H]3C[C@H]3F)cc2[nH+]1 ZINC001123748976 990659047 /nfs/dbraw/zinc/65/90/47/990659047.db2.gz RRYXZLGGEYHAJP-RKDXNWHRSA-N 1 2 233.246 2.168 20 0 BEADLO C/C=C(/C)C(=O)N1CCC(c2c[nH+]cn2C)CC1 ZINC001124093080 990751215 /nfs/dbraw/zinc/75/12/15/990751215.db2.gz ZZWUAPHCBLTYBD-WCIBSUBMSA-N 1 2 247.342 2.092 20 0 BEADLO CC(C)(C)C[C@H]1CCCN1c1cc(N)nc[nH+]1 ZINC001548508708 990764191 /nfs/dbraw/zinc/76/41/91/990764191.db2.gz LTRFXTITMGMYQX-SNVBAGLBSA-N 1 2 234.347 2.464 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CC[C@H](C)C(C)(C)C1 ZINC001556134452 990806477 /nfs/dbraw/zinc/80/64/77/990806477.db2.gz OERBPHFTDVFWPD-JTQLQIEISA-N 1 2 249.358 2.155 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1ccc(F)nc1 ZINC001137735143 990844373 /nfs/dbraw/zinc/84/43/73/990844373.db2.gz FRDNMHLBMCGQDK-SCZZXKLOSA-N 1 2 212.243 2.153 20 0 BEADLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1ccc(F)nc1 ZINC001137735143 990844377 /nfs/dbraw/zinc/84/43/77/990844377.db2.gz FRDNMHLBMCGQDK-SCZZXKLOSA-N 1 2 212.243 2.153 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CC[C@H](C(C)(C)C)C1 ZINC001137779528 990850447 /nfs/dbraw/zinc/85/04/47/990850447.db2.gz JNWVHGJTUXJTLX-NSHDSACASA-N 1 2 249.358 2.155 20 0 BEADLO OC[C@@H]1CCC[N@@H+]1Cc1cc(F)cc(F)c1F ZINC001137868670 990862588 /nfs/dbraw/zinc/86/25/88/990862588.db2.gz NMOVMINOYQRRTP-JTQLQIEISA-N 1 2 245.244 2.061 20 0 BEADLO OC[C@@H]1CCC[N@H+]1Cc1cc(F)cc(F)c1F ZINC001137868670 990862590 /nfs/dbraw/zinc/86/25/90/990862590.db2.gz NMOVMINOYQRRTP-JTQLQIEISA-N 1 2 245.244 2.061 20 0 BEADLO Cc1ccc(Cl)c(C[NH+]2CC(CO)C2)c1F ZINC001138034765 990877838 /nfs/dbraw/zinc/87/78/38/990877838.db2.gz SDBFJYGQSJDWSN-UHFFFAOYSA-N 1 2 243.709 2.212 20 0 BEADLO COCC1C[NH+](Cc2c(F)ccc(C)c2F)C1 ZINC001138114869 990883747 /nfs/dbraw/zinc/88/37/47/990883747.db2.gz OBFNVKWIMFNRLB-UHFFFAOYSA-N 1 2 241.281 2.351 20 0 BEADLO C[C@]1(F)CCC[N@H+](Cc2cc(O)cc(O)c2)C1 ZINC001138324048 990914419 /nfs/dbraw/zinc/91/44/19/990914419.db2.gz HQFZDQIAGIBCGL-ZDUSSCGKSA-N 1 2 239.290 2.422 20 0 BEADLO C[C@]1(F)CCC[N@@H+](Cc2cc(O)cc(O)c2)C1 ZINC001138324048 990914428 /nfs/dbraw/zinc/91/44/28/990914428.db2.gz HQFZDQIAGIBCGL-ZDUSSCGKSA-N 1 2 239.290 2.422 20 0 BEADLO Oc1cc(O)cc(C[N@@H+]2CCCC[C@H](F)C2)c1 ZINC001138324629 990918713 /nfs/dbraw/zinc/91/87/13/990918713.db2.gz TUAGPXFHZOITHI-NSHDSACASA-N 1 2 239.290 2.422 20 0 BEADLO Oc1cc(O)cc(C[N@H+]2CCCC[C@H](F)C2)c1 ZINC001138324629 990918718 /nfs/dbraw/zinc/91/87/18/990918718.db2.gz TUAGPXFHZOITHI-NSHDSACASA-N 1 2 239.290 2.422 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@]2(C)CC=CCC2)c[nH+]1 ZINC001558497202 990950705 /nfs/dbraw/zinc/95/07/05/990950705.db2.gz FGTIAHFGWCBNHK-CQSZACIVSA-N 1 2 247.342 2.335 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@]2(C)CC=CCC2)[nH+]1 ZINC001558497202 990950716 /nfs/dbraw/zinc/95/07/16/990950716.db2.gz FGTIAHFGWCBNHK-CQSZACIVSA-N 1 2 247.342 2.335 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)c2ccoc2)[nH+]1 ZINC001558561431 990965607 /nfs/dbraw/zinc/96/56/07/990965607.db2.gz RIZXVVJSJDXPRS-UHFFFAOYSA-N 1 2 233.271 2.056 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)c2ccoc2)c[nH+]1 ZINC001558561431 990965621 /nfs/dbraw/zinc/96/56/21/990965621.db2.gz RIZXVVJSJDXPRS-UHFFFAOYSA-N 1 2 233.271 2.056 20 0 BEADLO COC(=O)C1([NH2+][C@@H](C)CCC=C(C)C)CC1 ZINC001258077893 990980951 /nfs/dbraw/zinc/98/09/51/990980951.db2.gz FRSKDKVSHDRLGB-NSHDSACASA-N 1 2 225.332 2.417 20 0 BEADLO CCCc1ncc(C[NH2+]Cc2ccnn2CC)o1 ZINC001308403127 990982883 /nfs/dbraw/zinc/98/28/83/990982883.db2.gz LYWVCAZQWHRFSY-UHFFFAOYSA-N 1 2 248.330 2.133 20 0 BEADLO Cc1nonc1C[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001308508826 991013764 /nfs/dbraw/zinc/01/37/64/991013764.db2.gz OQLUMQQZGXQKCH-UHFFFAOYSA-N 1 2 242.282 2.149 20 0 BEADLO Cc1cccc(Cl)c1C[N@@H+]1C[C@@H](O)[C@@H](F)C1 ZINC001138718318 991019017 /nfs/dbraw/zinc/01/90/17/991019017.db2.gz NLVWTPODPWPGKC-NWDGAFQWSA-N 1 2 243.709 2.163 20 0 BEADLO Cc1cccc(Cl)c1C[N@H+]1C[C@@H](O)[C@@H](F)C1 ZINC001138718318 991019026 /nfs/dbraw/zinc/01/90/26/991019026.db2.gz NLVWTPODPWPGKC-NWDGAFQWSA-N 1 2 243.709 2.163 20 0 BEADLO CCOC(=O)CCC[C@H](C)[N@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001258118036 991021084 /nfs/dbraw/zinc/02/10/84/991021084.db2.gz UTEOKLZKEACOKK-GARJFASQSA-N 1 2 249.301 2.100 20 0 BEADLO CCOC(=O)CCC[C@H](C)[N@@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001258118036 991021092 /nfs/dbraw/zinc/02/10/92/991021092.db2.gz UTEOKLZKEACOKK-GARJFASQSA-N 1 2 249.301 2.100 20 0 BEADLO CC1(C)C[NH+](Cc2ccnn2[C@@H]2CCCCO2)C1 ZINC001138773630 991041651 /nfs/dbraw/zinc/04/16/51/991041651.db2.gz JBVMKPAUDOUWNM-ZDUSSCGKSA-N 1 2 249.358 2.424 20 0 BEADLO CN(CCCNc1nccs1)c1cccc[nH+]1 ZINC001559266769 991060965 /nfs/dbraw/zinc/06/09/65/991060965.db2.gz OFDDEIIJHAWTPI-UHFFFAOYSA-N 1 2 248.355 2.477 20 0 BEADLO C[C@H]1CSCC[N@@H+]1Cc1cn(C2CC2)cn1 ZINC001308623649 991067539 /nfs/dbraw/zinc/06/75/39/991067539.db2.gz JAWFXTIJWKXPEF-JTQLQIEISA-N 1 2 237.372 2.155 20 0 BEADLO C[C@H]1CSCC[N@H+]1Cc1cn(C2CC2)cn1 ZINC001308623649 991067544 /nfs/dbraw/zinc/06/75/44/991067544.db2.gz JAWFXTIJWKXPEF-JTQLQIEISA-N 1 2 237.372 2.155 20 0 BEADLO CCNc1ccccc1C[N@H+](C)Cc1cc[nH]n1 ZINC001308633299 991068863 /nfs/dbraw/zinc/06/88/63/991068863.db2.gz IXIBATNMLYZWBE-UHFFFAOYSA-N 1 2 244.342 2.474 20 0 BEADLO CCNc1ccccc1C[N@@H+](C)Cc1cc[nH]n1 ZINC001308633299 991068871 /nfs/dbraw/zinc/06/88/71/991068871.db2.gz IXIBATNMLYZWBE-UHFFFAOYSA-N 1 2 244.342 2.474 20 0 BEADLO CC[NH+](CC)[C@@H](C)c1ncc(C(=O)OC)s1 ZINC001308646960 991078510 /nfs/dbraw/zinc/07/85/10/991078510.db2.gz ACWYRJDKYNNUAZ-QMMMGPOBSA-N 1 2 242.344 2.333 20 0 BEADLO CCOC(=O)C(C)(C)[NH2+][C@@H](C)CCSC ZINC001258202895 991095465 /nfs/dbraw/zinc/09/54/65/991095465.db2.gz ZFQRBVHJFBZSCX-VIFPVBQESA-N 1 2 233.377 2.059 20 0 BEADLO Cc1c[nH]c(C[NH+]2CC3(C2)CCCC3)n1 ZINC001138936950 991102660 /nfs/dbraw/zinc/10/26/60/991102660.db2.gz PMLPFESUOQDNCJ-UHFFFAOYSA-N 1 2 205.305 2.094 20 0 BEADLO CCCCOc1cccc(C[NH+]2CC(C)(O)C2)c1 ZINC001138952695 991113059 /nfs/dbraw/zinc/11/30/59/991113059.db2.gz VUUUWHWWRVTPMQ-UHFFFAOYSA-N 1 2 249.354 2.432 20 0 BEADLO CCCn1cc(C[N@H+]2CCC(=O)[C@@H](C)CC2)cn1 ZINC001139036991 991128255 /nfs/dbraw/zinc/12/82/55/991128255.db2.gz FEJXJKBBMVQYKN-LBPRGKRZSA-N 1 2 249.358 2.094 20 0 BEADLO CCCn1cc(C[N@@H+]2CCC(=O)[C@@H](C)CC2)cn1 ZINC001139036991 991128261 /nfs/dbraw/zinc/12/82/61/991128261.db2.gz FEJXJKBBMVQYKN-LBPRGKRZSA-N 1 2 249.358 2.094 20 0 BEADLO CCCCc1nc(Cl)c(C[NH+](C)C)[nH]1 ZINC001139174696 991182375 /nfs/dbraw/zinc/18/23/75/991182375.db2.gz WFKWEKHRJGONOB-UHFFFAOYSA-N 1 2 215.728 2.467 20 0 BEADLO Cn1ccc2cc(C[N@@H+]3CCO[C@@H]4C[C@@H]43)ccc21 ZINC001139192445 991184281 /nfs/dbraw/zinc/18/42/81/991184281.db2.gz LJJNPMVAQXWFKU-LSDHHAIUSA-N 1 2 242.322 2.151 20 0 BEADLO Cn1ccc2cc(C[N@H+]3CCO[C@@H]4C[C@@H]43)ccc21 ZINC001139192445 991184289 /nfs/dbraw/zinc/18/42/89/991184289.db2.gz LJJNPMVAQXWFKU-LSDHHAIUSA-N 1 2 242.322 2.151 20 0 BEADLO CC[C@@H]([NH2+]C/C=C(/C)COC)c1noc(C)n1 ZINC001559737957 991233872 /nfs/dbraw/zinc/23/38/72/991233872.db2.gz RPUYLBMHUJQFEP-DHHDDZJSSA-N 1 2 239.319 2.011 20 0 BEADLO COC(=O)C1([NH2+][C@H](C)CC(C)(C)SC)CC1 ZINC001258314597 991241075 /nfs/dbraw/zinc/24/10/75/991241075.db2.gz GUWCJNFXWCFLJT-SECBINFHSA-N 1 2 245.388 2.202 20 0 BEADLO Cc1cc(C[N@@H+](C)C2(C)COC2)cnc1Cl ZINC001139546717 991269027 /nfs/dbraw/zinc/26/90/27/991269027.db2.gz OBIRVAWHRFILJZ-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO Cc1cc(C[N@H+](C)C2(C)COC2)cnc1Cl ZINC001139546717 991269033 /nfs/dbraw/zinc/26/90/33/991269033.db2.gz OBIRVAWHRFILJZ-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO C[C@@H]1CC[N@@H+]1Cc1cn2c(cccc2F)n1 ZINC001139571415 991277166 /nfs/dbraw/zinc/27/71/66/991277166.db2.gz XLEZJBVTIAGYQR-SECBINFHSA-N 1 2 219.263 2.068 20 0 BEADLO C[C@@H]1CC[N@H+]1Cc1cn2c(cccc2F)n1 ZINC001139571415 991277178 /nfs/dbraw/zinc/27/71/78/991277178.db2.gz XLEZJBVTIAGYQR-SECBINFHSA-N 1 2 219.263 2.068 20 0 BEADLO CCOc1ccc(C)cc1C[N@H+](C)CC(C)=O ZINC001139600334 991277750 /nfs/dbraw/zinc/27/77/50/991277750.db2.gz PHFFHWHBVJAGIN-UHFFFAOYSA-N 1 2 235.327 2.415 20 0 BEADLO CCOc1ccc(C)cc1C[N@@H+](C)CC(C)=O ZINC001139600334 991277761 /nfs/dbraw/zinc/27/77/61/991277761.db2.gz PHFFHWHBVJAGIN-UHFFFAOYSA-N 1 2 235.327 2.415 20 0 BEADLO COc1ccncc1C[N@H+](C)C1CC(F)(F)C1 ZINC001139605898 991282582 /nfs/dbraw/zinc/28/25/82/991282582.db2.gz KNPWCUSBANLSKH-UHFFFAOYSA-N 1 2 242.269 2.320 20 0 BEADLO COc1ccncc1C[N@@H+](C)C1CC(F)(F)C1 ZINC001139605898 991282593 /nfs/dbraw/zinc/28/25/93/991282593.db2.gz KNPWCUSBANLSKH-UHFFFAOYSA-N 1 2 242.269 2.320 20 0 BEADLO CCOc1ccc(C[NH+]2CC(C)(O)C2)cc1CC ZINC001139618957 991293898 /nfs/dbraw/zinc/29/38/98/991293898.db2.gz RRGJFCPCKPJBKS-UHFFFAOYSA-N 1 2 249.354 2.214 20 0 BEADLO Cc1cc(O)cc(C)c1C[NH+]1CCC(=O)CC1 ZINC001139711813 991337760 /nfs/dbraw/zinc/33/77/60/991337760.db2.gz KWYPJDUWMWSHOQ-UHFFFAOYSA-N 1 2 233.311 2.174 20 0 BEADLO COc1ncc(Cl)cc1C[N@@H+]1CC[C@H]1C ZINC001139746686 991351186 /nfs/dbraw/zinc/35/11/86/991351186.db2.gz YOBVWSOFJJBWFA-MRVPVSSYSA-N 1 2 226.707 2.338 20 0 BEADLO COc1ncc(Cl)cc1C[N@H+]1CC[C@H]1C ZINC001139746686 991351190 /nfs/dbraw/zinc/35/11/90/991351190.db2.gz YOBVWSOFJJBWFA-MRVPVSSYSA-N 1 2 226.707 2.338 20 0 BEADLO COc1ccc(CNc2cccc[nH+]2)o1 ZINC001560278619 991450055 /nfs/dbraw/zinc/45/00/55/991450055.db2.gz NLLBUUMVXMEHGH-UHFFFAOYSA-N 1 2 204.229 2.295 20 0 BEADLO Cc1cc(CNc2cnn(C)c2)cc(C)[nH+]1 ZINC001560310413 991454233 /nfs/dbraw/zinc/45/42/33/991454233.db2.gz HTSDGLUFZZIANR-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO C[N@H+](Cc1ccnnc1)Cc1ccccc1F ZINC001139983531 991461089 /nfs/dbraw/zinc/46/10/89/991461089.db2.gz VKEWZZXYLZZERD-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[N@@H+](Cc1ccnnc1)Cc1ccccc1F ZINC001139983531 991461093 /nfs/dbraw/zinc/46/10/93/991461093.db2.gz VKEWZZXYLZZERD-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO Cc1ccc(NCc2ccc(=O)[nH]c2)c(C)[nH+]1 ZINC001560407944 991469021 /nfs/dbraw/zinc/46/90/21/991469021.db2.gz OLGSYEKYMJPBLH-UHFFFAOYSA-N 1 2 229.283 2.411 20 0 BEADLO c1ccc2cc(C[NH+]3CCOCC3)ncc2c1 ZINC001139995130 991474929 /nfs/dbraw/zinc/47/49/29/991474929.db2.gz VLNRUIUKGBXOJL-UHFFFAOYSA-N 1 2 228.295 2.067 20 0 BEADLO CCc1noc(C)c1C[NH2+]Cc1ccn(CC)n1 ZINC001560481556 991483621 /nfs/dbraw/zinc/48/36/21/991483621.db2.gz MSPJWQZCATYZNU-UHFFFAOYSA-N 1 2 248.330 2.052 20 0 BEADLO CC1(C)C[NH+](Cc2cc(O)ccc2F)C1 ZINC001140050463 991500372 /nfs/dbraw/zinc/50/03/72/991500372.db2.gz LNEOJQSDTZRPGR-UHFFFAOYSA-N 1 2 209.264 2.373 20 0 BEADLO CC[N@@H+](C)Cc1n[nH]c2ccc(OC)cc21 ZINC001140065318 991512525 /nfs/dbraw/zinc/51/25/25/991512525.db2.gz DIDQITPEGUKSJP-UHFFFAOYSA-N 1 2 219.288 2.023 20 0 BEADLO CC[N@H+](C)Cc1n[nH]c2ccc(OC)cc21 ZINC001140065318 991512509 /nfs/dbraw/zinc/51/25/09/991512509.db2.gz DIDQITPEGUKSJP-UHFFFAOYSA-N 1 2 219.288 2.023 20 0 BEADLO Oc1ccc(C[NH+]2CC3(CSC3)C2)c(F)c1 ZINC001140129512 991520313 /nfs/dbraw/zinc/52/03/13/991520313.db2.gz FSALAZIFCHRYKV-UHFFFAOYSA-N 1 2 239.315 2.080 20 0 BEADLO C[C@H](Cc1cccnc1)[NH2+][C@@H]1CC1(F)F ZINC001258608863 991524046 /nfs/dbraw/zinc/52/40/46/991524046.db2.gz GMFWSEFAHHMDHL-PSASIEDQSA-N 1 2 212.243 2.010 20 0 BEADLO Cc1[nH]ncc1C[NH2+]C[C@@H]1OCc2ccccc21 ZINC001560620506 991525500 /nfs/dbraw/zinc/52/55/00/991525500.db2.gz ZYOYNDWDBZPQEY-AWEZNQCLSA-N 1 2 243.310 2.079 20 0 BEADLO c1cn(CCc2nnc(CC3CCCC3)o2)c[nH+]1 ZINC001258627022 991561815 /nfs/dbraw/zinc/56/18/15/991561815.db2.gz BHGNGFZGESYKQB-UHFFFAOYSA-N 1 2 246.314 2.242 20 0 BEADLO C[C@H]1COCC[N@@H+]1Cc1c[nH]c2cccc(O)c12 ZINC001140229882 991570610 /nfs/dbraw/zinc/57/06/10/991570610.db2.gz JBIJHTPEOMPZKJ-JTQLQIEISA-N 1 2 246.310 2.094 20 0 BEADLO C[C@H]1COCC[N@H+]1Cc1c[nH]c2cccc(O)c12 ZINC001140229882 991570620 /nfs/dbraw/zinc/57/06/20/991570620.db2.gz JBIJHTPEOMPZKJ-JTQLQIEISA-N 1 2 246.310 2.094 20 0 BEADLO Nc1[nH+]cccc1CN1CCc2c1cccc2F ZINC001560734640 991578094 /nfs/dbraw/zinc/57/80/94/991578094.db2.gz OMIVUXIXYOHVPW-UHFFFAOYSA-N 1 2 243.285 2.366 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2ccncc2O)C[C@@H]1F ZINC001140273686 991583116 /nfs/dbraw/zinc/58/31/16/991583116.db2.gz PKJVXAYCIWHCOE-NWDGAFQWSA-N 1 2 242.269 2.059 20 0 BEADLO CCc1cc(NC(=O)Cc2[nH]cc[nH+]2)ccc1F ZINC001140317758 991606877 /nfs/dbraw/zinc/60/68/77/991606877.db2.gz KRTPDHYGKOSLAI-UHFFFAOYSA-N 1 2 247.273 2.292 20 0 BEADLO C[C@H](Cc1ccno1)[NH2+]C(C)(C)C(F)F ZINC001560800536 991607300 /nfs/dbraw/zinc/60/73/00/991607300.db2.gz MVVQXHAJDSANNB-SSDOTTSWSA-N 1 2 218.247 2.239 20 0 BEADLO Cc1occc1CN(C)C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001318035390 991612793 /nfs/dbraw/zinc/61/27/93/991612793.db2.gz WHBUNMAEMIIZHY-SNVBAGLBSA-N 1 2 247.298 2.004 20 0 BEADLO CC(C)C[C@H]1CCCN1C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001318080651 991620220 /nfs/dbraw/zinc/62/02/20/991620220.db2.gz RUSFCLHNLVONKM-CHWSQXEVSA-N 1 2 249.358 2.481 20 0 BEADLO CCCCOc1ccccc1C[NH+]1CC(C)(O)C1 ZINC001560876381 991636251 /nfs/dbraw/zinc/63/62/51/991636251.db2.gz IRZSTGXQPGHBMU-UHFFFAOYSA-N 1 2 249.354 2.432 20 0 BEADLO CC[N@H+](Cc1nc(Cl)ccc1C)C1COC1 ZINC001140444040 991641422 /nfs/dbraw/zinc/64/14/22/991641422.db2.gz JVIHQHSVWYLLRL-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO CC[N@@H+](Cc1nc(Cl)ccc1C)C1COC1 ZINC001140444040 991641427 /nfs/dbraw/zinc/64/14/27/991641427.db2.gz JVIHQHSVWYLLRL-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO C[C@@H]1C[C@@H](O)C[N@@H+]1Cc1c(F)cc(F)cc1F ZINC001140529990 991661375 /nfs/dbraw/zinc/66/13/75/991661375.db2.gz LLELNCSVWCQROF-VXNVDRBHSA-N 1 2 245.244 2.059 20 0 BEADLO C[C@@H]1C[C@@H](O)C[N@H+]1Cc1c(F)cc(F)cc1F ZINC001140529990 991661380 /nfs/dbraw/zinc/66/13/80/991661380.db2.gz LLELNCSVWCQROF-VXNVDRBHSA-N 1 2 245.244 2.059 20 0 BEADLO CC(C)SCC[N@@H+]1CCCc2[nH]ncc2C1 ZINC001560952006 991667054 /nfs/dbraw/zinc/66/70/54/991667054.db2.gz XLZKOUZIRZRWDR-UHFFFAOYSA-N 1 2 239.388 2.300 20 0 BEADLO CC(C)SCC[N@H+]1CCCc2[nH]ncc2C1 ZINC001560952006 991667064 /nfs/dbraw/zinc/66/70/64/991667064.db2.gz XLZKOUZIRZRWDR-UHFFFAOYSA-N 1 2 239.388 2.300 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ncccn2)ccc1O ZINC001140574580 991674584 /nfs/dbraw/zinc/67/45/84/991674584.db2.gz JTOMDDWPNUDOCK-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ncccn2)ccc1O ZINC001140574580 991674587 /nfs/dbraw/zinc/67/45/87/991674587.db2.gz JTOMDDWPNUDOCK-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO CCCC[C@H](CCC)[NH+]1CC(F)(CO)C1 ZINC001258760146 991712861 /nfs/dbraw/zinc/71/28/61/991712861.db2.gz JYMMUVNGHBWOSS-NSHDSACASA-N 1 2 217.328 2.362 20 0 BEADLO C[C@@H](C(=O)Nc1ccsc1)n1cc[nH+]c1 ZINC001318958877 991747910 /nfs/dbraw/zinc/74/79/10/991747910.db2.gz NJQCMHILPHHHGS-QMMMGPOBSA-N 1 2 221.285 2.144 20 0 BEADLO CCOC(=O)C1([NH2+][C@H]2CCC[C@@H](C)C2)CC1 ZINC001258806970 991808647 /nfs/dbraw/zinc/80/86/47/991808647.db2.gz KHSWESQVEQOEDM-MNOVXSKESA-N 1 2 225.332 2.250 20 0 BEADLO CC[C@]1(C)CCCN(C(=O)Cc2[nH]c[nH+]c2C)C1 ZINC001566003063 991819572 /nfs/dbraw/zinc/81/95/72/991819572.db2.gz PKMJZDWWIIGBNO-CQSZACIVSA-N 1 2 249.358 2.299 20 0 BEADLO CC[C@@]1(C)CCN(C(=O)[C@@H](C)n2cc[nH+]c2)C1 ZINC001319610028 991903946 /nfs/dbraw/zinc/90/39/46/991903946.db2.gz PEYMFJSTBQCUBR-YPMHNXCESA-N 1 2 235.331 2.093 20 0 BEADLO CC[C@]1(C)CCN(C(=O)[C@@H](C)n2cc[nH+]c2)C1 ZINC001319610026 991908645 /nfs/dbraw/zinc/90/86/45/991908645.db2.gz PEYMFJSTBQCUBR-DGCLKSJQSA-N 1 2 235.331 2.093 20 0 BEADLO Cc1cc(C[NH2+]Cc2nc(C3CC3)cs2)[nH]n1 ZINC001319836587 991996837 /nfs/dbraw/zinc/99/68/37/991996837.db2.gz AJXVFMPEOWNSBD-UHFFFAOYSA-N 1 2 248.355 2.342 20 0 BEADLO COc1ccc(C)[nH+]c1NCc1cc(C)[nH]n1 ZINC001319983283 992060295 /nfs/dbraw/zinc/06/02/95/992060295.db2.gz BOTVDSIJPOYUCA-UHFFFAOYSA-N 1 2 232.287 2.042 20 0 BEADLO CCC[C@@H](CC)NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001320385495 992188615 /nfs/dbraw/zinc/18/86/15/992188615.db2.gz HEDZTCMYHZWWOK-GHMZBOCLSA-N 1 2 223.320 2.139 20 0 BEADLO C[C@H](c1nc([C@@H](C)C2CC2)no1)n1cc[nH+]c1 ZINC001320500286 992222277 /nfs/dbraw/zinc/22/22/77/992222277.db2.gz QKOGVGDOJYBFEQ-DTWKUNHWSA-N 1 2 232.287 2.389 20 0 BEADLO CC[C@@H]1[C@H](C)CCN1C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001320521694 992232518 /nfs/dbraw/zinc/23/25/18/992232518.db2.gz RFCAQDCXJIVXQA-IJLUTSLNSA-N 1 2 235.331 2.091 20 0 BEADLO CCc1ccncc1NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001261526678 992366298 /nfs/dbraw/zinc/36/62/98/992366298.db2.gz REQWVZLYYUKPSR-JTQLQIEISA-N 1 2 244.298 2.040 20 0 BEADLO CCCN(C(=O)[C@H](C)n1cc[nH+]c1)C(C)C ZINC001261551455 992382980 /nfs/dbraw/zinc/38/29/80/992382980.db2.gz KVLITRYDRPFUQJ-NSHDSACASA-N 1 2 223.320 2.091 20 0 BEADLO C[NH2+]CC(=O)O[C@@H](C)c1ccc(Cl)s1 ZINC001573896182 992752857 /nfs/dbraw/zinc/75/28/57/992752857.db2.gz XNGZRIHLSOQDKM-LURJTMIESA-N 1 2 233.720 2.225 20 0 BEADLO C[NH2+]CC(=O)O[C@@H]1CCc2c1cccc2Cl ZINC001573896209 992756986 /nfs/dbraw/zinc/75/69/86/992756986.db2.gz YDBXAPFCCNMIBR-LLVKDONJSA-N 1 2 239.702 2.090 20 0 BEADLO Cc1ncccc1[C@H](C)OC(=O)[C@@H]1CCCC[NH2+]1 ZINC001574192089 992822134 /nfs/dbraw/zinc/82/21/34/992822134.db2.gz OPYSRPNJLDHYKG-AAEUAGOBSA-N 1 2 248.326 2.136 20 0 BEADLO CC[N@H+](CCC1CC1)Cc1nnc(OC)s1 ZINC001262259923 992822503 /nfs/dbraw/zinc/82/25/03/992822503.db2.gz ZAAJTXHXVNDZEN-UHFFFAOYSA-N 1 2 241.360 2.169 20 0 BEADLO CC[N@@H+](CCC1CC1)Cc1nnc(OC)s1 ZINC001262259923 992822508 /nfs/dbraw/zinc/82/25/08/992822508.db2.gz ZAAJTXHXVNDZEN-UHFFFAOYSA-N 1 2 241.360 2.169 20 0 BEADLO CCc1ccc(N(C)Cc2nccn2C)[nH+]c1 ZINC001262676612 993019230 /nfs/dbraw/zinc/01/92/30/993019230.db2.gz JMMILBZAPVWSCP-UHFFFAOYSA-N 1 2 230.315 2.014 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@@H]([C@H](C)O)C2)[nH+]1 ZINC001262688402 993029473 /nfs/dbraw/zinc/02/94/73/993029473.db2.gz PNKIEYFRYHZEGD-WDEREUQCSA-N 1 2 238.306 2.126 20 0 BEADLO CO[C@H]1C[C@@H](N(C)c2cc(F)cc(C)[nH+]2)C1 ZINC001262695369 993034549 /nfs/dbraw/zinc/03/45/49/993034549.db2.gz AIUHOQNIFQCSGV-PHIMTYICSA-N 1 2 224.279 2.143 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N(C(=O)C[C@@H]([NH3+])C(F)F)C1 ZINC001263085652 993105197 /nfs/dbraw/zinc/10/51/97/993105197.db2.gz HZXXCRCNQYXWJZ-OPRDCNLKSA-N 1 2 248.317 2.006 20 0 BEADLO CC[C@H]([NH2+][C@H]1C[C@@H]2CCCC[C@@H]21)c1c[nH]nn1 ZINC001576290047 993257697 /nfs/dbraw/zinc/25/76/97/993257697.db2.gz KUJFFHNSEOJNEI-BJDJZHNGSA-N 1 2 234.347 2.424 20 0 BEADLO CC[C@H]([NH2+][C@H]1C[C@@H]2CCCC[C@@H]21)c1cn[nH]n1 ZINC001576290047 993257703 /nfs/dbraw/zinc/25/77/03/993257703.db2.gz KUJFFHNSEOJNEI-BJDJZHNGSA-N 1 2 234.347 2.424 20 0 BEADLO Cn1c[nH+]cc1CCCOC(=O)[C@@H]1CC12CCC2 ZINC001263509846 993350849 /nfs/dbraw/zinc/35/08/49/993350849.db2.gz JLNVOONICBPUOE-LBPRGKRZSA-N 1 2 248.326 2.086 20 0 BEADLO CN(C)c1ccc(Nc2cccnc2C#N)c[nH+]1 ZINC000387164220 993703024 /nfs/dbraw/zinc/70/30/24/993703024.db2.gz FMFKAQOOQKZTRI-UHFFFAOYSA-N 1 2 239.282 2.158 20 0 BEADLO CN(C)c1ccc(Nc2ccccc2N)c[nH+]1 ZINC000387245865 993703780 /nfs/dbraw/zinc/70/37/80/993703780.db2.gz XZSORNWCDJMEJM-UHFFFAOYSA-N 1 2 228.299 2.473 20 0 BEADLO C[C@@H]1CC(=O)CC[N@H+]1CCOCc1ccccc1 ZINC000390071475 993774307 /nfs/dbraw/zinc/77/43/07/993774307.db2.gz LJSRDBLFTIWASM-CYBMUJFWSA-N 1 2 247.338 2.257 20 0 BEADLO C[C@@H]1CC(=O)CC[N@@H+]1CCOCc1ccccc1 ZINC000390071475 993774298 /nfs/dbraw/zinc/77/42/98/993774298.db2.gz LJSRDBLFTIWASM-CYBMUJFWSA-N 1 2 247.338 2.257 20 0 BEADLO Cc1cccnc1C(=O)Nc1c(C)c[nH+]cc1C ZINC001288772675 994478830 /nfs/dbraw/zinc/47/88/30/994478830.db2.gz YZPOCICRKUVTCM-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1cccc(C)c1C ZINC001290430275 994539990 /nfs/dbraw/zinc/53/99/90/994539990.db2.gz ZHDYATZVWGNKRA-CYBMUJFWSA-N 1 2 232.327 2.336 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1cccc(C)c1C ZINC001290430275 994540003 /nfs/dbraw/zinc/54/00/03/994540003.db2.gz ZHDYATZVWGNKRA-CYBMUJFWSA-N 1 2 232.327 2.336 20 0 BEADLO Cc1ccnc(NCc2c[nH]c(C(C)C)[nH+]2)n1 ZINC001307219472 994840249 /nfs/dbraw/zinc/84/02/49/994840249.db2.gz NRIHOGHCXJYCKB-UHFFFAOYSA-N 1 2 231.303 2.244 20 0 BEADLO Cc1ccnc(NCc2c[nH+]c(C(C)C)[nH]2)n1 ZINC001307219472 994840258 /nfs/dbraw/zinc/84/02/58/994840258.db2.gz NRIHOGHCXJYCKB-UHFFFAOYSA-N 1 2 231.303 2.244 20 0 BEADLO CCc1cc(NC[C@H]2CCCOC2)nc(CC)[nH+]1 ZINC001336687431 995078616 /nfs/dbraw/zinc/07/86/16/995078616.db2.gz WJHZGZHTJWZEBW-LLVKDONJSA-N 1 2 249.358 2.440 20 0 BEADLO CCC[C@@H](O)C[N@@H+]1CC(F)(F)CC[C@@H]1C ZINC001308155093 995573137 /nfs/dbraw/zinc/57/31/37/995573137.db2.gz XJSOGNIUPKGMGV-VHSXEESVSA-N 1 2 221.291 2.267 20 0 BEADLO CCC[C@@H](O)C[N@H+]1CC(F)(F)CC[C@@H]1C ZINC001308155093 995573141 /nfs/dbraw/zinc/57/31/41/995573141.db2.gz XJSOGNIUPKGMGV-VHSXEESVSA-N 1 2 221.291 2.267 20 0 BEADLO c1cn2c(cccc2CNc2cccc[nH+]2)n1 ZINC001308211711 995597023 /nfs/dbraw/zinc/59/70/23/995597023.db2.gz DWMMVAFRYBRJKF-UHFFFAOYSA-N 1 2 224.267 2.341 20 0 BEADLO CC[NH+]1CC(NC(=O)C2(CC(C)C)CCC2)C1 ZINC001567799828 1170093958 /nfs/dbraw/zinc/09/39/58/1170093958.db2.gz CZPKXFMGYRFUAX-UHFFFAOYSA-N 1 2 238.375 2.023 20 0 BEADLO CCc1nnc([C@@H](C)[NH2+]Cc2ccccc2F)[nH]1 ZINC001620887587 1170164631 /nfs/dbraw/zinc/16/46/31/1170164631.db2.gz JJGYHFSYQFASTB-SECBINFHSA-N 1 2 248.305 2.357 20 0 BEADLO CCc1nnc([C@H](C)[NH2+]Cc2ccccc2F)[nH]1 ZINC001620887588 1170165711 /nfs/dbraw/zinc/16/57/11/1170165711.db2.gz JJGYHFSYQFASTB-VIFPVBQESA-N 1 2 248.305 2.357 20 0 BEADLO COc1cc(NCc2cc(C)[nH+]c(C)c2)[nH]n1 ZINC001621006997 1170181351 /nfs/dbraw/zinc/18/13/51/1170181351.db2.gz CDDUUQKBRRTGOR-UHFFFAOYSA-N 1 2 232.287 2.042 20 0 BEADLO CCc1cn(CC2CCC(=O)CC2)c[nH+]1 ZINC001614959475 1170500571 /nfs/dbraw/zinc/50/05/71/1170500571.db2.gz BNLMHJUEEOUVSV-UHFFFAOYSA-N 1 2 206.289 2.205 20 0 BEADLO Cc1ccoc1C(=O)Nc1c(C)c[nH+]cc1C ZINC001616246159 1170546838 /nfs/dbraw/zinc/54/68/38/1170546838.db2.gz HFQKHYKRIAQNAH-UHFFFAOYSA-N 1 2 230.267 2.274 20 0 BEADLO C[C@@H]([NH2+]CC(=O)c1ccccc1F)c1cn[nH]c1 ZINC001617056005 1170577227 /nfs/dbraw/zinc/57/72/27/1170577227.db2.gz VRTCACSKRZITRE-SECBINFHSA-N 1 2 247.273 2.082 20 0 BEADLO CC[C@H]1CCCN(C(=O)Cc2[nH]c[nH+]c2C)CC1 ZINC001617165220 1170580718 /nfs/dbraw/zinc/58/07/18/1170580718.db2.gz QOWJYOHJBMAHST-LBPRGKRZSA-N 1 2 249.358 2.299 20 0 BEADLO Fc1ccc([C@H]2CC[N@@H+]2CC2=NOCC2)cc1 ZINC001620284453 1170662126 /nfs/dbraw/zinc/66/21/26/1170662126.db2.gz HVUYPNRIVACMBR-CYBMUJFWSA-N 1 2 234.274 2.349 20 0 BEADLO Fc1ccc([C@H]2CC[N@H+]2CC2=NOCC2)cc1 ZINC001620284453 1170662133 /nfs/dbraw/zinc/66/21/33/1170662133.db2.gz HVUYPNRIVACMBR-CYBMUJFWSA-N 1 2 234.274 2.349 20 0 BEADLO Cc1cc(C)[nH+]c(CN(C)Cc2ncccn2)c1 ZINC001620536503 1170679227 /nfs/dbraw/zinc/67/92/27/1170679227.db2.gz WYMLMNGSVCEGMA-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO CON(CCCn1cc[nH+]c1)Cc1ccc(C)o1 ZINC001620597360 1170685886 /nfs/dbraw/zinc/68/58/86/1170685886.db2.gz SSXIWNIYCFFQOC-UHFFFAOYSA-N 1 2 249.314 2.238 20 0 BEADLO CN(C)c1ccc(Nc2ccc(N)[nH+]c2)cc1 ZINC000019952030 1170689480 /nfs/dbraw/zinc/68/94/80/1170689480.db2.gz AMVOOYLBQGGRBX-UHFFFAOYSA-N 1 2 228.299 2.473 20 0 BEADLO COC(=O)c1ccc(Nc2ccc(N)[nH+]c2)cc1 ZINC000019952007 1170690715 /nfs/dbraw/zinc/69/07/15/1170690715.db2.gz NBPROTLSGWVWJL-UHFFFAOYSA-N 1 2 243.266 2.194 20 0 BEADLO CCNc1ccccc1C[NH+]1CC(OCC)C1 ZINC001621379803 1170785246 /nfs/dbraw/zinc/78/52/46/1170785246.db2.gz ICGBQNHRXHBRRK-UHFFFAOYSA-N 1 2 234.343 2.339 20 0 BEADLO Nc1ccc(-c2ccc3[nH]c(=O)ccc3c2)c[nH+]1 ZINC000026167915 1170858857 /nfs/dbraw/zinc/85/88/57/1170858857.db2.gz NRWMDOLUDGKMQF-UHFFFAOYSA-N 1 2 237.262 2.172 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC001621995572 1170874907 /nfs/dbraw/zinc/87/49/07/1170874907.db2.gz VWWICDPUYVCIOY-GHMZBOCLSA-N 1 2 235.331 2.079 20 0 BEADLO Cc1cc(C)cc(C[NH+]2CCC(=O)CC2)c1 ZINC000037978649 1171000134 /nfs/dbraw/zinc/00/01/34/1171000134.db2.gz FFRATGXATXAQQI-UHFFFAOYSA-N 1 2 217.312 2.468 20 0 BEADLO Cc1ccc(NC(=O)Cc2c[nH]c[nH+]2)cc1F ZINC001628371996 1171229244 /nfs/dbraw/zinc/22/92/44/1171229244.db2.gz PMDDZNXARRDSDL-UHFFFAOYSA-N 1 2 233.246 2.038 20 0 BEADLO C[N@@H+](CC(=O)c1ccccc1)C[C@@H]1CCCCO1 ZINC000042464983 1171232757 /nfs/dbraw/zinc/23/27/57/1171232757.db2.gz BSZNANGHZDQDKC-AWEZNQCLSA-N 1 2 247.338 2.370 20 0 BEADLO C[N@H+](CC(=O)c1ccccc1)C[C@@H]1CCCCO1 ZINC000042464983 1171232763 /nfs/dbraw/zinc/23/27/63/1171232763.db2.gz BSZNANGHZDQDKC-AWEZNQCLSA-N 1 2 247.338 2.370 20 0 BEADLO CC(C)CCCCNC(=O)CCc1c[nH]c[nH+]1 ZINC001629670238 1171338412 /nfs/dbraw/zinc/33/84/12/1171338412.db2.gz UAEJMPKEMGIQLV-UHFFFAOYSA-N 1 2 237.347 2.285 20 0 BEADLO CC(C)CCCCNC(=O)CCc1c[nH+]c[nH]1 ZINC001629670238 1171338419 /nfs/dbraw/zinc/33/84/19/1171338419.db2.gz UAEJMPKEMGIQLV-UHFFFAOYSA-N 1 2 237.347 2.285 20 0 BEADLO C[C@H](C(=O)N1CCCCCCC1)n1cc[nH+]c1 ZINC000044874236 1171420254 /nfs/dbraw/zinc/42/02/54/1171420254.db2.gz PMCPTHXNPKWCPC-GFCCVEGCSA-N 1 2 235.331 2.237 20 0 BEADLO CCc1[nH]c(CNC(=O)CCC(C)C)c[nH+]1 ZINC001635607169 1171742240 /nfs/dbraw/zinc/74/22/40/1171742240.db2.gz UWNGVWSOAIZTAS-UHFFFAOYSA-N 1 2 223.320 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)CCC(C)C)[nH+]1 ZINC001635607169 1171742248 /nfs/dbraw/zinc/74/22/48/1171742248.db2.gz UWNGVWSOAIZTAS-UHFFFAOYSA-N 1 2 223.320 2.025 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H](C)CC(C)C)c[nH+]1 ZINC001635610167 1171743935 /nfs/dbraw/zinc/74/39/35/1171743935.db2.gz DKVXKQQCCKSRRL-JTQLQIEISA-N 1 2 237.347 2.271 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H](C)CC(C)C)[nH+]1 ZINC001635610167 1171743946 /nfs/dbraw/zinc/74/39/46/1171743946.db2.gz DKVXKQQCCKSRRL-JTQLQIEISA-N 1 2 237.347 2.271 20 0 BEADLO O=C(NCc1[nH]c2c([nH+]1)CCCC2)C1CCCC1 ZINC001635850275 1171767139 /nfs/dbraw/zinc/76/71/39/1171767139.db2.gz JWURZYVQRXUMDX-UHFFFAOYSA-N 1 2 247.342 2.095 20 0 BEADLO C[C@H](C(=O)N[C@H]1CCC[C@@H](C)C1)n1cc[nH+]c1 ZINC000052493371 1171967361 /nfs/dbraw/zinc/96/73/61/1171967361.db2.gz CJIDSBXIVWVBEB-UTUOFQBUSA-N 1 2 235.331 2.139 20 0 BEADLO Cc1nnc(SCc2ccc[nH+]c2N)s1 ZINC000052756461 1171985874 /nfs/dbraw/zinc/98/58/74/1171985874.db2.gz MCXJOKWDWPDLGV-UHFFFAOYSA-N 1 2 238.341 2.116 20 0 BEADLO CC[C@H]([NH2+]Cc1cn(C)nn1)c1ccccc1F ZINC000389831466 398140520 /nfs/dbraw/zinc/14/05/20/398140520.db2.gz HITNLTKRKMDRPR-ZDUSSCGKSA-N 1 2 248.305 2.195 20 0 BEADLO CC(C)n1c[nH+]cc1CN[C@@H](C)C(F)F ZINC000389915274 398148681 /nfs/dbraw/zinc/14/86/81/398148681.db2.gz MMFASUGKTYEVBA-QMMMGPOBSA-N 1 2 217.263 2.207 20 0 BEADLO CC(C)n1cc(C[NH2+][C@@H](C)C(F)F)cn1 ZINC000389924699 398149320 /nfs/dbraw/zinc/14/93/20/398149320.db2.gz UZKKFUIMTRVLNI-QMMMGPOBSA-N 1 2 217.263 2.207 20 0 BEADLO C[C@H]([NH2+]Cc1cnn(C(C)(C)C)c1)C(F)F ZINC000389933242 398150825 /nfs/dbraw/zinc/15/08/25/398150825.db2.gz KGIOMMWWNDRZKI-QMMMGPOBSA-N 1 2 231.290 2.381 20 0 BEADLO Cc1cc(C[N@@H+]2CC[S@](=O)[C@H](C)C2)cs1 ZINC000336224003 178003563 /nfs/dbraw/zinc/00/35/63/178003563.db2.gz AXVKVEWSEVJNMX-BMIGLBTASA-N 1 2 243.397 2.009 20 0 BEADLO Cc1cc(C[N@H+]2CC[S@](=O)[C@H](C)C2)cs1 ZINC000336224003 178003565 /nfs/dbraw/zinc/00/35/65/178003565.db2.gz AXVKVEWSEVJNMX-BMIGLBTASA-N 1 2 243.397 2.009 20 0 BEADLO COC(=O)[C@H]([NH2+][C@H]1C=CCCCCC1)C1CC1 ZINC000339107907 398151685 /nfs/dbraw/zinc/15/16/85/398151685.db2.gz KPQLJPBOUWSMLW-QWHCGFSZSA-N 1 2 237.343 2.417 20 0 BEADLO Cc1cc(C[N@@H+]2CCn3cccc3[C@@H]2C)ncn1 ZINC000292229840 178005997 /nfs/dbraw/zinc/00/59/97/178005997.db2.gz ROHGHBGREXRDCF-LBPRGKRZSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1cc(C[N@H+]2CCn3cccc3[C@@H]2C)ncn1 ZINC000292229840 178005998 /nfs/dbraw/zinc/00/59/98/178005998.db2.gz ROHGHBGREXRDCF-LBPRGKRZSA-N 1 2 242.326 2.163 20 0 BEADLO CCN(C(=O)CCn1cc[nH+]c1)C1CCCC1 ZINC000299694977 398152095 /nfs/dbraw/zinc/15/20/95/398152095.db2.gz XRNCRCQKEDPIQF-UHFFFAOYSA-N 1 2 235.331 2.064 20 0 BEADLO CCC(CC)C(=O)N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000371044343 168335674 /nfs/dbraw/zinc/33/56/74/168335674.db2.gz OJPVBEVMKFZGEG-LBPRGKRZSA-N 1 2 249.358 2.172 20 0 BEADLO Cc1cc(C[NH2+]Cc2cnn(C(C)C)c2)on1 ZINC000226244021 178026100 /nfs/dbraw/zinc/02/61/00/178026100.db2.gz KWOYMLWHDMUJRT-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO Cc1cc(C[NH2+]Cc2occc2C)on1 ZINC000126776299 178029947 /nfs/dbraw/zinc/02/99/47/178029947.db2.gz AKCXLTGARDFUNJ-UHFFFAOYSA-N 1 2 206.245 2.174 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ncnn2C)ccc1F ZINC000276615240 178032109 /nfs/dbraw/zinc/03/21/09/178032109.db2.gz DLKKSOPODVNQJK-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO Cc1cnc(C[NH2+][C@H](C)c2cccc(O)c2)n1C ZINC000341031415 398183223 /nfs/dbraw/zinc/18/32/23/398183223.db2.gz VVSUUCOGXWFURH-LLVKDONJSA-N 1 2 245.326 2.285 20 0 BEADLO Cc1c[nH+]c(CN[C@H](C)c2cccc(O)c2)n1C ZINC000341031415 398183226 /nfs/dbraw/zinc/18/32/26/398183226.db2.gz VVSUUCOGXWFURH-LLVKDONJSA-N 1 2 245.326 2.285 20 0 BEADLO Cc1cc(C[NH2+][C@@H]2CCc3c2cccc3O)no1 ZINC000044692774 178035826 /nfs/dbraw/zinc/03/58/26/178035826.db2.gz BBVJZWDPSRKPKE-CYBMUJFWSA-N 1 2 244.294 2.466 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2ccncc2F)no1 ZINC000338354252 178038018 /nfs/dbraw/zinc/03/80/18/178038018.db2.gz IYEXQIDVWNCHFY-SECBINFHSA-N 1 2 235.262 2.368 20 0 BEADLO Cc1nc(C[N@H+]2CCS[C@@H](C)[C@H]2C)co1 ZINC000647964529 398178404 /nfs/dbraw/zinc/17/84/04/398178404.db2.gz NKEFLABERFUGDM-BDAKNGLRSA-N 1 2 226.345 2.309 20 0 BEADLO Cc1nc(C[N@@H+]2CCS[C@@H](C)[C@H]2C)co1 ZINC000647964529 398178407 /nfs/dbraw/zinc/17/84/07/398178407.db2.gz NKEFLABERFUGDM-BDAKNGLRSA-N 1 2 226.345 2.309 20 0 BEADLO Cc1nc(C[N@H+]2CCS[C@@H](C)[C@@H]2C)co1 ZINC000647964531 398178456 /nfs/dbraw/zinc/17/84/56/398178456.db2.gz NKEFLABERFUGDM-IUCAKERBSA-N 1 2 226.345 2.309 20 0 BEADLO Cc1nc(C[N@@H+]2CCS[C@@H](C)[C@@H]2C)co1 ZINC000647964531 398178461 /nfs/dbraw/zinc/17/84/61/398178461.db2.gz NKEFLABERFUGDM-IUCAKERBSA-N 1 2 226.345 2.309 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2C[C@H]2C2CCC2)c(C)c[nH+]1 ZINC000649882950 398164302 /nfs/dbraw/zinc/16/43/02/398164302.db2.gz GWANRJZDEFELEF-QWHCGFSZSA-N 1 2 244.338 2.495 20 0 BEADLO CC[C@@H]1CC[C@H](C)C[C@@H]1NCC(F)(F)C[NH3+] ZINC000423343910 398166463 /nfs/dbraw/zinc/16/64/63/398166463.db2.gz MHAOZFQTEUGWFI-AXFHLTTASA-N 1 2 234.334 2.385 20 0 BEADLO Cc1cc([NH+](C)C)ccc1NCc1ccnn1C ZINC000057668009 178095454 /nfs/dbraw/zinc/09/54/54/178095454.db2.gz YVLHWRRYFWRYII-UHFFFAOYSA-N 1 2 244.342 2.407 20 0 BEADLO Cc1cc(N(C)CCCCO)nc(C(C)C)[nH+]1 ZINC000302792622 178099166 /nfs/dbraw/zinc/09/91/66/178099166.db2.gz ZFOAGKLKFREWAP-UHFFFAOYSA-N 1 2 237.347 2.117 20 0 BEADLO Cc1cc(N)nc(SCCc2ccncc2)[nH+]1 ZINC000023106345 178108795 /nfs/dbraw/zinc/10/87/95/178108795.db2.gz WXZGOJADSARZHT-UHFFFAOYSA-N 1 2 246.339 2.097 20 0 BEADLO Cc1cc(N)nc(SCOC2CCCC2)[nH+]1 ZINC000288035589 178109303 /nfs/dbraw/zinc/10/93/03/178109303.db2.gz AUILHRSHHUEQMO-UHFFFAOYSA-N 1 2 239.344 2.376 20 0 BEADLO Cc1cc(N)nc(SCC2CCC2)[nH+]1 ZINC000097637406 178109651 /nfs/dbraw/zinc/10/96/51/178109651.db2.gz FQCSRGCBGNGZKC-UHFFFAOYSA-N 1 2 209.318 2.259 20 0 BEADLO Cc1cc(N2CCCO[C@@H](C(C)C)C2)nc[nH+]1 ZINC000338846003 178114270 /nfs/dbraw/zinc/11/42/70/178114270.db2.gz JBDMWSBVTQEKTJ-GFCCVEGCSA-N 1 2 235.331 2.036 20 0 BEADLO Cc1cc(N2CC[C@H](O)C2)c2cccc(F)c2[nH+]1 ZINC000124494003 178120032 /nfs/dbraw/zinc/12/00/32/178120032.db2.gz BZLFPNZGKCISAI-JTQLQIEISA-N 1 2 246.285 2.253 20 0 BEADLO Cc1cc(N2C[C@H]3CCCC[C@@H]3C2)nc[nH+]1 ZINC000301547642 178121808 /nfs/dbraw/zinc/12/18/08/178121808.db2.gz LNLHODSUOWZCJD-VXGBXAGGSA-N 1 2 217.316 2.411 20 0 BEADLO Cc1cc(NC(=O)C2=COCCC2)cc[nH+]1 ZINC000107760259 178125292 /nfs/dbraw/zinc/12/52/92/178125292.db2.gz VURRYRSCXSOYLU-UHFFFAOYSA-N 1 2 218.256 2.023 20 0 BEADLO Cc1cc(NC(=O)Cc2ccccc2O)cc[nH+]1 ZINC000101630886 178134985 /nfs/dbraw/zinc/13/49/85/178134985.db2.gz ZIOAGAJQDBOSQU-UHFFFAOYSA-N 1 2 242.278 2.277 20 0 BEADLO Cc1cc(NC(=O)NC(C)(C)C)cc[nH+]1 ZINC000074921616 178137499 /nfs/dbraw/zinc/13/74/99/178137499.db2.gz RWAOQRBZKITKJB-UHFFFAOYSA-N 1 2 207.277 2.310 20 0 BEADLO Cc1cc(NC(=O)NCCn2cccc2)cc[nH+]1 ZINC000119602949 178139385 /nfs/dbraw/zinc/13/93/85/178139385.db2.gz YMXYHKOTCBIQMV-UHFFFAOYSA-N 1 2 244.298 2.013 20 0 BEADLO CCCC[N@H+](CCO)Cc1csc(Cl)n1 ZINC000297171925 398200444 /nfs/dbraw/zinc/20/04/44/398200444.db2.gz PMKOZCUKJCAKAO-UHFFFAOYSA-N 1 2 248.779 2.391 20 0 BEADLO CCCC[N@@H+](CCO)Cc1csc(Cl)n1 ZINC000297171925 398200451 /nfs/dbraw/zinc/20/04/51/398200451.db2.gz PMKOZCUKJCAKAO-UHFFFAOYSA-N 1 2 248.779 2.391 20 0 BEADLO Cc1cc(NC(=O)N[C@@H](C)C2CC2)cc[nH+]1 ZINC000119286010 178141308 /nfs/dbraw/zinc/14/13/08/178141308.db2.gz SPEMNUAPIJUEFB-VIFPVBQESA-N 1 2 219.288 2.310 20 0 BEADLO Cc1cc(NC(=O)Nc2ccc(C)[nH+]c2C)n[nH]1 ZINC000192278677 178142159 /nfs/dbraw/zinc/14/21/59/178142159.db2.gz BNIWQQFKEBCIOM-UHFFFAOYSA-N 1 2 245.286 2.374 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CCCO[C@H]2C)cc[nH+]1 ZINC000191633095 178148298 /nfs/dbraw/zinc/14/82/98/178148298.db2.gz FVJQVWUCAKIBCA-JQWIXIFHSA-N 1 2 234.299 2.144 20 0 BEADLO Cc1cc(NC(C2CC2)C2CC2)nc[nH+]1 ZINC000049235820 178152427 /nfs/dbraw/zinc/15/24/27/178152427.db2.gz AUFNVURODHJIPJ-UHFFFAOYSA-N 1 2 203.289 2.386 20 0 BEADLO Cc1cc(NC2C[C@@H](C)O[C@H](C)C2)nc[nH+]1 ZINC000301971778 178155382 /nfs/dbraw/zinc/15/53/82/178155382.db2.gz SRICIJWMYXIJNY-NXEZZACHSA-N 1 2 221.304 2.153 20 0 BEADLO Cc1cc(NCC(C)(C)[C@H](O)C(C)C)nc[nH+]1 ZINC000301831299 178156079 /nfs/dbraw/zinc/15/60/79/178156079.db2.gz SOYBPAGDYAIJRO-GFCCVEGCSA-N 1 2 237.347 2.240 20 0 BEADLO Cc1cc(NCC2(O)CCCC2)nc(C2CC2)[nH+]1 ZINC000265393288 178157294 /nfs/dbraw/zinc/15/72/94/178157294.db2.gz VGOKRIJSXWPYON-UHFFFAOYSA-N 1 2 247.342 2.379 20 0 BEADLO Cc1nc(CCNc2cc(C)[nH+]cn2)cs1 ZINC000225695364 178163423 /nfs/dbraw/zinc/16/34/23/178163423.db2.gz KJCYKEQXDBKJOD-UHFFFAOYSA-N 1 2 234.328 2.205 20 0 BEADLO Cc1cc(NC[C@@H]2CSCCS2)nc[nH+]1 ZINC000130290385 178167114 /nfs/dbraw/zinc/16/71/14/178167114.db2.gz PYXGTWLJJHJIMU-SECBINFHSA-N 1 2 241.385 2.046 20 0 BEADLO Cc1cc(NC[C@H]2CCOC2)nc(C(C)C)[nH+]1 ZINC000037988141 178170516 /nfs/dbraw/zinc/17/05/16/178170516.db2.gz DRRUOBMOFAHFCL-LLVKDONJSA-N 1 2 235.331 2.357 20 0 BEADLO Cc1cc(NCc2cccc(O)c2)nc[nH+]1 ZINC000309710403 178173841 /nfs/dbraw/zinc/17/38/41/178173841.db2.gz QJRPCKLBMXEWAH-UHFFFAOYSA-N 1 2 215.256 2.103 20 0 BEADLO Cc1cc(N[C@@H](C)C[C@H](C)O)nc(C(C)C)[nH+]1 ZINC000126931857 178178963 /nfs/dbraw/zinc/17/89/63/178178963.db2.gz GGKBLEOPLYBESA-ONGXEEELSA-N 1 2 237.347 2.480 20 0 BEADLO Cc1cc(N[C@@H](CO)CCC(C)(C)C)nc[nH+]1 ZINC000360239420 178180430 /nfs/dbraw/zinc/18/04/30/178180430.db2.gz BJLYSHWRAONETE-LLVKDONJSA-N 1 2 237.347 2.384 20 0 BEADLO Cc1[nH]c(CN2CCOC[C@@H]2C2CCC2)[nH+]c1C ZINC000628322265 398223351 /nfs/dbraw/zinc/22/33/51/398223351.db2.gz LIEUINCPVGKNBZ-CYBMUJFWSA-N 1 2 249.358 2.027 20 0 BEADLO Cc1cc(N[C@@]2(C)CCOC2)nc(C2CC2)[nH+]1 ZINC000339354907 178183654 /nfs/dbraw/zinc/18/36/54/178183654.db2.gz CHZNOOQVOKLDBU-ZDUSSCGKSA-N 1 2 233.315 2.253 20 0 BEADLO Cc1cc(N[C@H](C)CF)nc(C2CC2)[nH+]1 ZINC000288365433 178185292 /nfs/dbraw/zinc/18/52/92/178185292.db2.gz XZUFQVLLMMBBII-MRVPVSSYSA-N 1 2 209.268 2.432 20 0 BEADLO Cc1cc(N[C@H](CO)CCC(C)(C)C)nc[nH+]1 ZINC000360239422 178187652 /nfs/dbraw/zinc/18/76/52/178187652.db2.gz BJLYSHWRAONETE-NSHDSACASA-N 1 2 237.347 2.384 20 0 BEADLO c1[nH]cc(-c2ccc(O[C@@H]3CCOC3)cc2)[nH+]1 ZINC000649427872 398229285 /nfs/dbraw/zinc/22/92/85/398229285.db2.gz ANBUPSJHPHJPLA-GFCCVEGCSA-N 1 2 230.267 2.244 20 0 BEADLO Cc1cc(N[C@@H]2C[C@@H](C)O[C@@H](C)C2)nc[nH+]1 ZINC000301971777 178191659 /nfs/dbraw/zinc/19/16/59/178191659.db2.gz SRICIJWMYXIJNY-JGPRNRPPSA-N 1 2 221.304 2.153 20 0 BEADLO Cc1cc(C[NH2+]Cc2cscn2)cc(C)n1 ZINC000421391104 192328160 /nfs/dbraw/zinc/32/81/60/192328160.db2.gz WCXBIAARZXTSSB-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO C[C@@H](c1ccco1)N(C)C(=O)CCc1c[nH+]c[nH]1 ZINC000276386337 538932672 /nfs/dbraw/zinc/93/26/72/538932672.db2.gz FIMAPDOOAYLMTP-JTQLQIEISA-N 1 2 247.298 2.155 20 0 BEADLO C[C@@H](c1ccco1)N(C)C(=O)CCc1c[nH]c[nH+]1 ZINC000276386337 538932673 /nfs/dbraw/zinc/93/26/73/538932673.db2.gz FIMAPDOOAYLMTP-JTQLQIEISA-N 1 2 247.298 2.155 20 0 BEADLO C/C=C/C[C@@H]1CCCN(C(=O)Cn2cc[nH+]c2)C1 ZINC000629871537 361745614 /nfs/dbraw/zinc/74/56/14/361745614.db2.gz QYSZMHHGQJFUKY-YWVDXFKGSA-N 1 2 247.342 2.088 20 0 BEADLO CC[C@H](C)[C@@H](CNc1cc(CO)cc[nH+]1)OC ZINC000381155490 398228094 /nfs/dbraw/zinc/22/80/94/398228094.db2.gz MKUBOGBZFVDYJD-CMPLNLGQSA-N 1 2 238.331 2.047 20 0 BEADLO CC[C@@H]1C[NH+](Cc2cocn2)C[C@@H](CC)O1 ZINC000421392240 192328262 /nfs/dbraw/zinc/32/82/62/192328262.db2.gz QQRXVKJIXCPGFN-VXGBXAGGSA-N 1 2 224.304 2.064 20 0 BEADLO Clc1ccc(C[N@@H+]2CC[C@]23CCOC3)o1 ZINC000421394744 192328923 /nfs/dbraw/zinc/32/89/23/192328923.db2.gz HCFWYXPYUSUEBS-LLVKDONJSA-N 1 2 227.691 2.298 20 0 BEADLO Clc1ccc(C[N@H+]2CC[C@]23CCOC3)o1 ZINC000421394744 192328926 /nfs/dbraw/zinc/32/89/26/192328926.db2.gz HCFWYXPYUSUEBS-LLVKDONJSA-N 1 2 227.691 2.298 20 0 BEADLO COCCc1cccc(-c2c[nH]c[nH+]2)c1 ZINC000649431980 398232312 /nfs/dbraw/zinc/23/23/12/398232312.db2.gz VENGJPWWRIYMOK-UHFFFAOYSA-N 1 2 202.257 2.266 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2cnn[nH]2)c(C)s1 ZINC000284019557 178228951 /nfs/dbraw/zinc/22/89/51/178228951.db2.gz OFEDXLGOGPTMHU-MRVPVSSYSA-N 1 2 236.344 2.334 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2c[nH]nn2)c(C)s1 ZINC000284019557 178228953 /nfs/dbraw/zinc/22/89/53/178228953.db2.gz OFEDXLGOGPTMHU-MRVPVSSYSA-N 1 2 236.344 2.334 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2cn[nH]n2)c(C)s1 ZINC000284019557 178228955 /nfs/dbraw/zinc/22/89/55/178228955.db2.gz OFEDXLGOGPTMHU-MRVPVSSYSA-N 1 2 236.344 2.334 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@@H](CO)c2ccccc2)no1 ZINC000290587209 178231240 /nfs/dbraw/zinc/23/12/40/178231240.db2.gz GHJWENRRYBWTNT-RISCZKNCSA-N 1 2 246.310 2.367 20 0 BEADLO COCCc1cccc(-c2c[nH+]cn2C)c1 ZINC000649431613 398231644 /nfs/dbraw/zinc/23/16/44/398231644.db2.gz BVFBXGTXUSUEPJ-UHFFFAOYSA-N 1 2 216.284 2.276 20 0 BEADLO c1[nH]cc(-c2ccccc2OC[C@@H]2CCOC2)[nH+]1 ZINC000649434519 398235985 /nfs/dbraw/zinc/23/59/85/398235985.db2.gz PCPLGNKSYOCMCJ-LLVKDONJSA-N 1 2 244.294 2.492 20 0 BEADLO C[C@H]1CCC[N@@H+]1Cc1ccc(-c2nnc[nH]2)cc1 ZINC000649432689 398236642 /nfs/dbraw/zinc/23/66/42/398236642.db2.gz QJUGQCZHTWMSFZ-NSHDSACASA-N 1 2 242.326 2.456 20 0 BEADLO C[C@H]1CCC[N@H+]1Cc1ccc(-c2nnc[nH]2)cc1 ZINC000649432689 398236646 /nfs/dbraw/zinc/23/66/46/398236646.db2.gz QJUGQCZHTWMSFZ-NSHDSACASA-N 1 2 242.326 2.456 20 0 BEADLO CCCC[C@H]1CCC[C@@H]1[NH2+]Cc1c[nH]nn1 ZINC000649430969 398233374 /nfs/dbraw/zinc/23/33/74/398233374.db2.gz HTFVPPZFYCKSLY-JQWIXIFHSA-N 1 2 222.336 2.253 20 0 BEADLO CCCC[C@H]1CCC[C@@H]1[NH2+]Cc1cn[nH]n1 ZINC000649430969 398233376 /nfs/dbraw/zinc/23/33/76/398233376.db2.gz HTFVPPZFYCKSLY-JQWIXIFHSA-N 1 2 222.336 2.253 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2c(C)noc2C)no1 ZINC000279593682 178250641 /nfs/dbraw/zinc/25/06/41/178250641.db2.gz OMWHVIKIAZINIM-VIFPVBQESA-N 1 2 235.287 2.439 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2cccn2C)no1 ZINC000282779225 178251337 /nfs/dbraw/zinc/25/13/37/178251337.db2.gz VOWIEJCKGIPOOL-JTQLQIEISA-N 1 2 219.288 2.172 20 0 BEADLO Cc1ccc(CNC(=O)CCc2c[nH+]c[nH]2)s1 ZINC000279549457 538935883 /nfs/dbraw/zinc/93/58/83/538935883.db2.gz ALKPHZSXBNQEFM-UHFFFAOYSA-N 1 2 249.339 2.029 20 0 BEADLO Cc1ccc(CNC(=O)CCc2c[nH]c[nH+]2)s1 ZINC000279549457 538935884 /nfs/dbraw/zinc/93/58/84/538935884.db2.gz ALKPHZSXBNQEFM-UHFFFAOYSA-N 1 2 249.339 2.029 20 0 BEADLO COCCc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000649431507 398234268 /nfs/dbraw/zinc/23/42/68/398234268.db2.gz ZQFASKFQKXLJRZ-UHFFFAOYSA-N 1 2 202.257 2.266 20 0 BEADLO C[C@@H]1N(c2cccc[nH+]2)CCC12CCOCC2 ZINC000334444861 136225745 /nfs/dbraw/zinc/22/57/45/136225745.db2.gz HVURGKGONBLRFV-LBPRGKRZSA-N 1 2 232.327 2.477 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@H](C)c2ncnn2C)c(C)o1 ZINC000278150363 178258474 /nfs/dbraw/zinc/25/84/74/178258474.db2.gz ACEDXLUIIVJUCD-VHSXEESVSA-N 1 2 248.330 2.437 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@H]2C[C@H](C)N(C3CC3)C2)no1 ZINC000337552959 178259521 /nfs/dbraw/zinc/25/95/21/178259521.db2.gz POSPELQJWMVTAH-DLOVCJGASA-N 1 2 249.358 2.259 20 0 BEADLO CCCN(CC(C)C)C(=O)CCc1c[nH+]c[nH]1 ZINC000280840064 538938113 /nfs/dbraw/zinc/93/81/13/538938113.db2.gz KPCHCNKKKQMHKH-UHFFFAOYSA-N 1 2 237.347 2.237 20 0 BEADLO CCCN(CC(C)C)C(=O)CCc1c[nH]c[nH+]1 ZINC000280840064 538938115 /nfs/dbraw/zinc/93/81/15/538938115.db2.gz KPCHCNKKKQMHKH-UHFFFAOYSA-N 1 2 237.347 2.237 20 0 BEADLO Cc1cc([C@H]2CCCN2Cc2c[nH+]cn2C)no1 ZINC000364374980 178265885 /nfs/dbraw/zinc/26/58/85/178265885.db2.gz IYKKJLNNVFFFKM-CYBMUJFWSA-N 1 2 246.314 2.054 20 0 BEADLO COc1ccc(NC[C@](C)(OC)C2CC2)[nH+]c1 ZINC000379858086 398238822 /nfs/dbraw/zinc/23/88/22/398238822.db2.gz NECIDTYHOLHRGB-ZDUSSCGKSA-N 1 2 236.315 2.317 20 0 BEADLO FC(F)(F)[C@@H]1CCC[N@H+](Cc2ccon2)C1 ZINC000172647311 398240660 /nfs/dbraw/zinc/24/06/60/398240660.db2.gz RXVWPRKGJWSIBB-MRVPVSSYSA-N 1 2 234.221 2.449 20 0 BEADLO FC(F)(F)[C@@H]1CCC[N@@H+](Cc2ccon2)C1 ZINC000172647311 398240664 /nfs/dbraw/zinc/24/06/64/398240664.db2.gz RXVWPRKGJWSIBB-MRVPVSSYSA-N 1 2 234.221 2.449 20 0 BEADLO C[C@@H](Nc1ccc(CCO)cc1)c1[nH]cc[nH+]1 ZINC000286160923 538943296 /nfs/dbraw/zinc/94/32/96/538943296.db2.gz PIDFPALNJMNHRU-SNVBAGLBSA-N 1 2 231.299 2.118 20 0 BEADLO Cc1cc2ccccc2[nH+]c1N[C@@H](C)CO ZINC000063105708 178298639 /nfs/dbraw/zinc/29/86/39/178298639.db2.gz BWZTUBVULQUKDD-JTQLQIEISA-N 1 2 216.284 2.336 20 0 BEADLO Cc1cc2ccccc2[nH+]c1N(C)C[C@H](C)O ZINC000063106503 178299219 /nfs/dbraw/zinc/29/92/19/178299219.db2.gz WBRYUOWSYBLZOD-NSHDSACASA-N 1 2 230.311 2.360 20 0 BEADLO Cc1cc2cc(C[NH2+]Cc3ccn[nH]3)ccc2[nH]1 ZINC000353133130 178293903 /nfs/dbraw/zinc/29/39/03/178293903.db2.gz DRNJJEJZLWEMQB-UHFFFAOYSA-N 1 2 240.310 2.489 20 0 BEADLO Cc1cc2[nH+]cn(CC(=O)C(F)F)c2cc1C ZINC000282158081 178305949 /nfs/dbraw/zinc/30/59/49/178305949.db2.gz MWOHPTCAYDYPGL-UHFFFAOYSA-N 1 2 238.237 2.487 20 0 BEADLO COc1ccsc1[C@@H](C)[NH2+]Cc1ncccn1 ZINC000580902785 398250677 /nfs/dbraw/zinc/25/06/77/398250677.db2.gz LSHJRIAVFYABEP-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO COc1ccsc1[C@H](C)[NH2+]Cc1ncccn1 ZINC000580902786 398250762 /nfs/dbraw/zinc/25/07/62/398250762.db2.gz LSHJRIAVFYABEP-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO Cc1cc(Nc2cc3n(n2)CCCC3)nc(C)[nH+]1 ZINC000286613380 538944340 /nfs/dbraw/zinc/94/43/40/538944340.db2.gz UBYAQPGRBFHQCY-UHFFFAOYSA-N 1 2 243.314 2.370 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)CCC1CCCC1 ZINC000291411986 538947644 /nfs/dbraw/zinc/94/76/44/538947644.db2.gz JRRQKIIXXNLFNV-UHFFFAOYSA-N 1 2 235.331 2.007 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)CCCC1CCCC1 ZINC000291096638 538946823 /nfs/dbraw/zinc/94/68/23/538946823.db2.gz BATZMEGRLWFGFO-UHFFFAOYSA-N 1 2 249.358 2.397 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)CCCC(C)(C)C ZINC000291212572 538947210 /nfs/dbraw/zinc/94/72/10/538947210.db2.gz FZZLMRWFSKJMSY-UHFFFAOYSA-N 1 2 237.347 2.253 20 0 BEADLO CC(C)c1occc1C(=O)NCc1c[nH+]cn1C ZINC000291289116 538947240 /nfs/dbraw/zinc/94/72/40/538947240.db2.gz RIMSNPIBRLOPQN-UHFFFAOYSA-N 1 2 247.298 2.067 20 0 BEADLO Cc1ccc(C(=O)N(C)Cc2[nH+]ccn2C)s1 ZINC000049087032 178379933 /nfs/dbraw/zinc/37/99/33/178379933.db2.gz XTUJLEYQGIERHQ-UHFFFAOYSA-N 1 2 249.339 2.062 20 0 BEADLO CC/C=C/CNc1nc[nH+]c(N)c1Cl ZINC000294975884 398264887 /nfs/dbraw/zinc/26/48/87/398264887.db2.gz LNFCPRPRYSISFU-ONEGZZNKSA-N 1 2 212.684 2.090 20 0 BEADLO CC/C=C/CNc1[nH+]cnc(N)c1Cl ZINC000294975884 398264890 /nfs/dbraw/zinc/26/48/90/398264890.db2.gz LNFCPRPRYSISFU-ONEGZZNKSA-N 1 2 212.684 2.090 20 0 BEADLO Cc1csc(C[NH+]2C[C@@H](C)O[C@H](C)C2)n1 ZINC000081643014 398270499 /nfs/dbraw/zinc/27/04/99/398270499.db2.gz BWGYEDWDCLGQFB-NXEZZACHSA-N 1 2 226.345 2.061 20 0 BEADLO C[C@H]([NH2+][C@H]1CS[C@@H](C)C1)C(=O)OC(C)(C)C ZINC000602503731 349581315 /nfs/dbraw/zinc/58/13/15/349581315.db2.gz FWRZAQJZFFYGPB-LPEHRKFASA-N 1 2 245.388 2.200 20 0 BEADLO CCC[C@@](C)([NH2+]C[C@](C)(CC)OC)C(=O)OC ZINC000602508035 349583715 /nfs/dbraw/zinc/58/37/15/349583715.db2.gz YWJLRHMLCAAKRH-QWHCGFSZSA-N 1 2 245.363 2.123 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1ccc(C)c(F)c1 ZINC000334508667 178415204 /nfs/dbraw/zinc/41/52/04/178415204.db2.gz LIBIICZOPFCXLO-UHFFFAOYSA-N 1 2 247.273 2.096 20 0 BEADLO CCN(CC)C(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000082262864 398272254 /nfs/dbraw/zinc/27/22/54/398272254.db2.gz LTGXWASXRCIRPG-UHFFFAOYSA-N 1 2 243.310 2.354 20 0 BEADLO C[N@@H+](Cc1cc2n(n1)CCCC2)Cc1ccco1 ZINC000649476092 398273138 /nfs/dbraw/zinc/27/31/38/398273138.db2.gz WJBIINKXRPGEHH-UHFFFAOYSA-N 1 2 245.326 2.444 20 0 BEADLO C[N@H+](Cc1cc2n(n1)CCCC2)Cc1ccco1 ZINC000649476092 398273140 /nfs/dbraw/zinc/27/31/40/398273140.db2.gz WJBIINKXRPGEHH-UHFFFAOYSA-N 1 2 245.326 2.444 20 0 BEADLO Cc1csc(C[N@@H+]2CC[C@](C)(F)C2)n1 ZINC000334925169 398274490 /nfs/dbraw/zinc/27/44/90/398274490.db2.gz FUEAUSBLWHMCHP-JTQLQIEISA-N 1 2 214.309 2.385 20 0 BEADLO Cc1csc(C[N@H+]2CC[C@](C)(F)C2)n1 ZINC000334925169 398274493 /nfs/dbraw/zinc/27/44/93/398274493.db2.gz FUEAUSBLWHMCHP-JTQLQIEISA-N 1 2 214.309 2.385 20 0 BEADLO Fc1ccc(NCc2c[nH+]c3ccccn23)nc1 ZINC000181573473 538960870 /nfs/dbraw/zinc/96/08/70/538960870.db2.gz LIMAJUDVSXYYJQ-UHFFFAOYSA-N 1 2 242.257 2.481 20 0 BEADLO CO[C@H](C[NH2+][C@@H](C)c1cn[nH]c1C)C(C)(C)C ZINC000180691049 538958759 /nfs/dbraw/zinc/95/87/59/538958759.db2.gz VJWZVGHZZFJNNK-JOYOIKCWSA-N 1 2 239.363 2.430 20 0 BEADLO Cc1[nH]c([C@@H]2CCCN2C(=O)[C@H]2C[C@H]2C)[nH+]c1C ZINC001638207148 1172004474 /nfs/dbraw/zinc/00/44/74/1172004474.db2.gz GAWDUSTZOCPLJQ-ZHAHWJHGSA-N 1 2 247.342 2.346 20 0 BEADLO Cc1ccc(NC(=O)c2ccccn2)c(C)[nH+]1 ZINC000176197405 365687387 /nfs/dbraw/zinc/68/73/87/365687387.db2.gz XLNQHCTXBZDBFF-UHFFFAOYSA-N 1 2 227.267 2.346 20 0 BEADLO C[C@@H]1CC[C@H](C)[N@H+]1Cc1nc(C(F)F)no1 ZINC000335603314 136235719 /nfs/dbraw/zinc/23/57/19/136235719.db2.gz GTIDKSUFWFXXTC-KNVOCYPGSA-N 1 2 231.246 2.380 20 0 BEADLO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1nc(C(F)F)no1 ZINC000335603314 136235720 /nfs/dbraw/zinc/23/57/20/136235720.db2.gz GTIDKSUFWFXXTC-KNVOCYPGSA-N 1 2 231.246 2.380 20 0 BEADLO COc1ccc(C[NH2+][C@H](C)c2nnc(C)o2)cc1 ZINC000583340291 342742880 /nfs/dbraw/zinc/74/28/80/342742880.db2.gz OLHIWDGYNCOTMA-SECBINFHSA-N 1 2 247.298 2.237 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)C1CC=CC1 ZINC000607064307 342728629 /nfs/dbraw/zinc/72/86/29/342728629.db2.gz BIIQJWLLGTURNZ-UHFFFAOYSA-N 1 2 227.267 2.239 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccoc2C)no1 ZINC000321521518 342761194 /nfs/dbraw/zinc/76/11/94/342761194.db2.gz OFUPMYFLGIRQRY-UHFFFAOYSA-N 1 2 206.245 2.174 20 0 BEADLO C[C@@]1(C(=O)Nc2ccn3cc[nH+]c3c2)C[C@H]1F ZINC000335614408 136237434 /nfs/dbraw/zinc/23/74/34/136237434.db2.gz YSISMSBRJNWMRE-BXKDBHETSA-N 1 2 233.246 2.021 20 0 BEADLO Cc1cc(CNC(=O)N(C)C2CCC2)cc(C)[nH+]1 ZINC000335614374 136237478 /nfs/dbraw/zinc/23/74/78/136237478.db2.gz XJJFXBQEUVMMIZ-UHFFFAOYSA-N 1 2 247.342 2.392 20 0 BEADLO COC(=O)[C@@H](CC(C)(C)C)[NH2+][C@@H]1CCSC1 ZINC000309657312 342776657 /nfs/dbraw/zinc/77/66/57/342776657.db2.gz QIRRZGMREZTRDL-NXEZZACHSA-N 1 2 245.388 2.059 20 0 BEADLO COC(=O)[C@H](CC(C)(C)C)[NH2+][C@@H]1CCSC1 ZINC000309657315 342776759 /nfs/dbraw/zinc/77/67/59/342776759.db2.gz QIRRZGMREZTRDL-ZJUUUORDSA-N 1 2 245.388 2.059 20 0 BEADLO COC(=O)[C@@H](CC(C)(C)C)[NH2+][C@H]1CCSC1 ZINC000309657314 342776767 /nfs/dbraw/zinc/77/67/67/342776767.db2.gz QIRRZGMREZTRDL-VHSXEESVSA-N 1 2 245.388 2.059 20 0 BEADLO CC1=C[C@@H](C)C[N@H+](Cc2nc(C3CC3)nn2C)C1 ZINC000335365044 398287131 /nfs/dbraw/zinc/28/71/31/398287131.db2.gz GAIJFDWWGVSWML-SNVBAGLBSA-N 1 2 246.358 2.091 20 0 BEADLO CC1=C[C@@H](C)C[N@@H+](Cc2nc(C3CC3)nn2C)C1 ZINC000335365044 398287133 /nfs/dbraw/zinc/28/71/33/398287133.db2.gz GAIJFDWWGVSWML-SNVBAGLBSA-N 1 2 246.358 2.091 20 0 BEADLO C[C@]1(C(=O)Nc2ccn3cc[nH+]c3c2)C[C@H]1F ZINC000335614411 136237613 /nfs/dbraw/zinc/23/76/13/136237613.db2.gz YSISMSBRJNWMRE-SKDRFNHKSA-N 1 2 233.246 2.021 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]C[C@@H]1CCC(C)(C)O1 ZINC000187862114 538977200 /nfs/dbraw/zinc/97/72/00/538977200.db2.gz PJCNLSCTHJQXIV-KOLCDFICSA-N 1 2 237.347 2.326 20 0 BEADLO CCC(F)(F)CNCc1cccc2[nH+]ccn21 ZINC000623679790 398290238 /nfs/dbraw/zinc/29/02/38/398290238.db2.gz JSVBUVVRIOUSLM-UHFFFAOYSA-N 1 2 239.269 2.469 20 0 BEADLO CCC(F)(F)C[NH2+]Cc1cccn1C ZINC000623679625 398290408 /nfs/dbraw/zinc/29/04/08/398290408.db2.gz BUDATMSIRKWWCJ-UHFFFAOYSA-N 1 2 202.248 2.160 20 0 BEADLO CCn1nccc1-c1c[nH+]c(C(C)C)n1C ZINC000630052304 361919382 /nfs/dbraw/zinc/91/93/82/361919382.db2.gz UQJNWOGZRGFVFJ-UHFFFAOYSA-N 1 2 218.304 2.427 20 0 BEADLO CC(C)c1[nH+]cc(-c2cnn3ncccc23)n1C ZINC000630052738 361920705 /nfs/dbraw/zinc/92/07/05/361920705.db2.gz KLCADCTVPPUYHF-UHFFFAOYSA-N 1 2 241.298 2.253 20 0 BEADLO Cc1[nH+]cc(-c2cc(C(F)(F)F)nn2C)n1C ZINC000630052398 361920869 /nfs/dbraw/zinc/92/08/69/361920869.db2.gz UQVCAGHAGVLWCD-UHFFFAOYSA-N 1 2 244.220 2.148 20 0 BEADLO C[C@@H]1C[C@H](CO)CCN1c1[nH]c2ccccc2[nH+]1 ZINC000624726180 342822653 /nfs/dbraw/zinc/82/26/53/342822653.db2.gz KTBRNDWWKMAXQP-GHMZBOCLSA-N 1 2 245.326 2.160 20 0 BEADLO COC(=O)[C@H]([NH2+]C/C=C\c1ccccc1)C(C)C ZINC000210601390 342823237 /nfs/dbraw/zinc/82/32/37/342823237.db2.gz WZVAHTHYFHJSIE-JKEYDSJLSA-N 1 2 247.338 2.487 20 0 BEADLO CC(C)Oc1cc(N)ccc1-c1[nH+]ccn1C ZINC000630053710 361923560 /nfs/dbraw/zinc/92/35/60/361923560.db2.gz YDQVOLJKVOHZJF-UHFFFAOYSA-N 1 2 231.299 2.457 20 0 BEADLO C[C@H]1CCCC[C@@H]1N(C)C(=O)CCc1c[nH+]c[nH]1 ZINC000188566354 538979391 /nfs/dbraw/zinc/97/93/91/538979391.db2.gz DMUAXHUOXBAGJV-AAEUAGOBSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H]1CCCC[C@@H]1N(C)C(=O)CCc1c[nH]c[nH+]1 ZINC000188566354 538979392 /nfs/dbraw/zinc/97/93/92/538979392.db2.gz DMUAXHUOXBAGJV-AAEUAGOBSA-N 1 2 249.358 2.379 20 0 BEADLO CCc1cc(N[C@@H]2C[C@H]2C2CC2)nc[nH+]1 ZINC000378808210 538974474 /nfs/dbraw/zinc/97/44/74/538974474.db2.gz YEHBEWRRZQTFBU-WDEREUQCSA-N 1 2 203.289 2.249 20 0 BEADLO C[C@H]1CC[S@](=O)CC[N@@H+]1Cc1cccs1 ZINC000335464479 398289802 /nfs/dbraw/zinc/28/98/02/398289802.db2.gz LFZJMARYXLBYBF-BONVTDFDSA-N 1 2 243.397 2.091 20 0 BEADLO C[C@H]1CC[S@](=O)CC[N@H+]1Cc1cccs1 ZINC000335464479 398289803 /nfs/dbraw/zinc/28/98/03/398289803.db2.gz LFZJMARYXLBYBF-BONVTDFDSA-N 1 2 243.397 2.091 20 0 BEADLO CC1(C)CCN(C(=O)[C@H]2CCCc3[nH+]c[nH]c32)C1 ZINC000336450335 342806513 /nfs/dbraw/zinc/80/65/13/342806513.db2.gz CHMZGAHNTINADE-JTQLQIEISA-N 1 2 247.342 2.088 20 0 BEADLO CCc1cc(NC[C@@H]2CCCC23CC3)nc[nH+]1 ZINC000624756384 342825129 /nfs/dbraw/zinc/82/51/29/342825129.db2.gz ACNDMALMCAHUIC-NSHDSACASA-N 1 2 231.343 2.453 20 0 BEADLO C[C@H]1C[C@H]1CNc1cc2cc[nH]c2c[nH+]1 ZINC000380246716 538987913 /nfs/dbraw/zinc/98/79/13/538987913.db2.gz OJBPAJOYVFYDJO-WPRPVWTQSA-N 1 2 201.273 2.053 20 0 BEADLO C[N@H+](Cc1ccoc1)Cc1cc2n(n1)CCC2 ZINC000649494810 398292906 /nfs/dbraw/zinc/29/29/06/398292906.db2.gz ZLUFIJHDATZCRZ-UHFFFAOYSA-N 1 2 231.299 2.054 20 0 BEADLO C[N@@H+](Cc1ccoc1)Cc1cc2n(n1)CCC2 ZINC000649494810 398292908 /nfs/dbraw/zinc/29/29/08/398292908.db2.gz ZLUFIJHDATZCRZ-UHFFFAOYSA-N 1 2 231.299 2.054 20 0 BEADLO Cc1cc(F)ccc1NC(=O)CCc1c[nH+]c[nH]1 ZINC000188982212 538980180 /nfs/dbraw/zinc/98/01/80/538980180.db2.gz IKGYDJCMQUXQDS-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO Cc1cc(F)ccc1NC(=O)CCc1c[nH]c[nH+]1 ZINC000188982212 538980182 /nfs/dbraw/zinc/98/01/82/538980182.db2.gz IKGYDJCMQUXQDS-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO CO[C@@H](C[NH2+][C@H](C)c1cn[nH]c1C)C(C)C ZINC000381480445 539001650 /nfs/dbraw/zinc/00/16/50/539001650.db2.gz SMTSFVXBOVVPFU-SKDRFNHKSA-N 1 2 225.336 2.040 20 0 BEADLO CO[C@@H](C[NH2+][C@@H](C)c1cn[nH]c1C)C(C)C ZINC000381480441 539001681 /nfs/dbraw/zinc/00/16/81/539001681.db2.gz SMTSFVXBOVVPFU-CABZTGNLSA-N 1 2 225.336 2.040 20 0 BEADLO CCC(CC)[C@@H](C)C(=O)NCc1[nH+]ccn1C ZINC000341557802 168398254 /nfs/dbraw/zinc/39/82/54/168398254.db2.gz AHYHHTZUFDOHSH-SNVBAGLBSA-N 1 2 237.347 2.109 20 0 BEADLO Cc1n[nH]c(C)c1C[NH2+][C@H]1CCCC1(F)F ZINC000381534584 539003151 /nfs/dbraw/zinc/00/31/51/539003151.db2.gz DTSUCAWEHFTJJM-JTQLQIEISA-N 1 2 229.274 2.304 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccccn2)s1 ZINC000381520791 539003340 /nfs/dbraw/zinc/00/33/40/539003340.db2.gz UPFDUGHAGAAKLD-MRVPVSSYSA-N 1 2 234.328 2.092 20 0 BEADLO CC[C@H]1CCCN(C(=O)CCc2c[nH+]c[nH]2)CC1 ZINC000193290870 539004139 /nfs/dbraw/zinc/00/41/39/539004139.db2.gz QDRMSNKSQVDNRK-LBPRGKRZSA-N 1 2 249.358 2.381 20 0 BEADLO CC[C@H]1CCCN(C(=O)CCc2c[nH]c[nH+]2)CC1 ZINC000193290870 539004141 /nfs/dbraw/zinc/00/41/41/539004141.db2.gz QDRMSNKSQVDNRK-LBPRGKRZSA-N 1 2 249.358 2.381 20 0 BEADLO C[C@H](NC(=O)CCc1c[nH+]c[nH]1)C1CCCCC1 ZINC000193338719 539004918 /nfs/dbraw/zinc/00/49/18/539004918.db2.gz UXVKTAHAMVGVFH-NSHDSACASA-N 1 2 249.358 2.427 20 0 BEADLO C[C@H](NC(=O)CCc1c[nH]c[nH+]1)C1CCCCC1 ZINC000193338719 539004919 /nfs/dbraw/zinc/00/49/19/539004919.db2.gz UXVKTAHAMVGVFH-NSHDSACASA-N 1 2 249.358 2.427 20 0 BEADLO CC(C)[C@H](NC(=O)[C@H]1CC12CCC2)c1[nH]cc[nH+]1 ZINC000640723846 361962219 /nfs/dbraw/zinc/96/22/19/361962219.db2.gz JIYDOMZSYFUYNH-MNOVXSKESA-N 1 2 247.342 2.413 20 0 BEADLO C[C@H](NC(=O)CCc1c[nH+]c[nH]1)c1cccs1 ZINC000195033784 539009477 /nfs/dbraw/zinc/00/94/77/539009477.db2.gz FFXSWCGYTNTFFP-VIFPVBQESA-N 1 2 249.339 2.281 20 0 BEADLO C[C@H](NC(=O)CCc1c[nH]c[nH+]1)c1cccs1 ZINC000195033784 539009479 /nfs/dbraw/zinc/00/94/79/539009479.db2.gz FFXSWCGYTNTFFP-VIFPVBQESA-N 1 2 249.339 2.281 20 0 BEADLO COc1ccc[nH+]c1N[C@@H](C)CCCCO ZINC000381417689 539000159 /nfs/dbraw/zinc/00/01/59/539000159.db2.gz WNZJTAHYAUVPIJ-JTQLQIEISA-N 1 2 224.304 2.053 20 0 BEADLO COc1ccc(NCc2ccsc2C)[nH+]c1 ZINC000382015032 398296967 /nfs/dbraw/zinc/29/69/67/398296967.db2.gz OALNTKJZDXPPAZ-UHFFFAOYSA-N 1 2 234.324 2.494 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2cccnc2C)s1 ZINC000391909446 539027682 /nfs/dbraw/zinc/02/76/82/539027682.db2.gz ONFRCDBBXFPKNA-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1CCO[C@H](C)C1 ZINC000388717919 539014921 /nfs/dbraw/zinc/01/49/21/539014921.db2.gz NBPKPLNLYZEOKA-GHMZBOCLSA-N 1 2 236.315 2.317 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1CCO[C@@H](C)C1 ZINC000388717921 539014941 /nfs/dbraw/zinc/01/49/41/539014941.db2.gz NBPKPLNLYZEOKA-QWRGUYRKSA-N 1 2 236.315 2.317 20 0 BEADLO CC[C@H](C)N(C)C(=O)[C@@H]1CCn2cc(C)[nH+]c2C1 ZINC000624983749 342840622 /nfs/dbraw/zinc/84/06/22/342840622.db2.gz UKHBGQLNVOVDSW-NWDGAFQWSA-N 1 2 249.358 2.011 20 0 BEADLO CCc1cc(N[C@@H]2CSC[C@@H]2C)nc[nH+]1 ZINC000389979733 539019433 /nfs/dbraw/zinc/01/94/33/539019433.db2.gz HUQLYHNBZKNIOB-WCBMZHEXSA-N 1 2 223.345 2.202 20 0 BEADLO Cc1cc(NC(=O)NC2C(C)(C)C2(C)C)cc[nH+]1 ZINC000348844166 136242306 /nfs/dbraw/zinc/24/23/06/136242306.db2.gz MJWFAWDISWJRQC-UHFFFAOYSA-N 1 2 247.342 2.368 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@H]1COCc2ccccc21 ZINC000335637552 136243051 /nfs/dbraw/zinc/24/30/51/136243051.db2.gz PQLLPYUBVMRYLE-AWEZNQCLSA-N 1 2 243.310 2.079 20 0 BEADLO OC[C@@]1(F)CC[N@H+](Cc2ccc(Cl)s2)C1 ZINC000335645986 136243890 /nfs/dbraw/zinc/24/38/90/136243890.db2.gz QYCZGXOQUNHTFC-SNVBAGLBSA-N 1 2 249.738 2.308 20 0 BEADLO OC[C@@]1(F)CC[N@@H+](Cc2ccc(Cl)s2)C1 ZINC000335645986 136243891 /nfs/dbraw/zinc/24/38/91/136243891.db2.gz QYCZGXOQUNHTFC-SNVBAGLBSA-N 1 2 249.738 2.308 20 0 BEADLO C[C@@H]1C[C@H]([NH2+]CC(F)(F)CO)c2ccccc21 ZINC000290380476 398302566 /nfs/dbraw/zinc/30/25/66/398302566.db2.gz RSLWTELGVQBSCE-SKDRFNHKSA-N 1 2 241.281 2.452 20 0 BEADLO OCc1cccc(NCc2ccc(F)cc2)[nH+]1 ZINC000351335350 136244183 /nfs/dbraw/zinc/24/41/83/136244183.db2.gz XWGZGKDCWKIKFX-UHFFFAOYSA-N 1 2 232.258 2.325 20 0 BEADLO Cc1c(C[N@H+](C)Cc2ccccc2F)cnn1C ZINC000014192129 342878213 /nfs/dbraw/zinc/87/82/13/342878213.db2.gz SFZMVZLWPLRBGU-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1c(C[N@@H+](C)Cc2ccccc2F)cnn1C ZINC000014192129 342878215 /nfs/dbraw/zinc/87/82/15/342878215.db2.gz SFZMVZLWPLRBGU-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO FC(F)c1ccc(C[NH2+]Cc2cocn2)cn1 ZINC000631068721 398316358 /nfs/dbraw/zinc/31/63/58/398316358.db2.gz LQSJQGQEPSZCKQ-UHFFFAOYSA-N 1 2 239.225 2.297 20 0 BEADLO CCc1nc(C[N@@H+]2CCOC[C@H](C)C2)cs1 ZINC000335905039 398311787 /nfs/dbraw/zinc/31/17/87/398311787.db2.gz WMHQBQMKUJUQHB-SNVBAGLBSA-N 1 2 240.372 2.174 20 0 BEADLO CCc1nc(C[N@H+]2CCOC[C@H](C)C2)cs1 ZINC000335905039 398311789 /nfs/dbraw/zinc/31/17/89/398311789.db2.gz WMHQBQMKUJUQHB-SNVBAGLBSA-N 1 2 240.372 2.174 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1cncc(OC)n1 ZINC000625132928 342886109 /nfs/dbraw/zinc/88/61/09/342886109.db2.gz GEKVFXRAHARZJY-UHFFFAOYSA-N 1 2 247.298 2.100 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1cncc(OC)n1 ZINC000625132928 342886110 /nfs/dbraw/zinc/88/61/10/342886110.db2.gz GEKVFXRAHARZJY-UHFFFAOYSA-N 1 2 247.298 2.100 20 0 BEADLO CC1(C)C[C@H]1CNc1nc[nH+]c(N)c1Cl ZINC000232943744 342892316 /nfs/dbraw/zinc/89/23/16/342892316.db2.gz MFXZJDKWEZANDY-LURJTMIESA-N 1 2 226.711 2.170 20 0 BEADLO CC1(C)C[C@H]1CNc1[nH+]cnc(N)c1Cl ZINC000232943744 342892317 /nfs/dbraw/zinc/89/23/17/342892317.db2.gz MFXZJDKWEZANDY-LURJTMIESA-N 1 2 226.711 2.170 20 0 BEADLO CC1(C)[C@@H]2C[N@@H+](Cc3noc(C4CCC4)n3)C[C@@H]21 ZINC000625185257 342904657 /nfs/dbraw/zinc/90/46/57/342904657.db2.gz WGQRIHSUTHIHBM-PHIMTYICSA-N 1 2 247.342 2.425 20 0 BEADLO CC1(C)[C@@H]2C[N@H+](Cc3noc(C4CCC4)n3)C[C@@H]21 ZINC000625185257 342904660 /nfs/dbraw/zinc/90/46/60/342904660.db2.gz WGQRIHSUTHIHBM-PHIMTYICSA-N 1 2 247.342 2.425 20 0 BEADLO Cc1cc(C(=O)Nc2ccc(C)[nH+]c2C)on1 ZINC000176201726 365688526 /nfs/dbraw/zinc/68/85/26/365688526.db2.gz BNRCZFTYOYPXDS-UHFFFAOYSA-N 1 2 231.255 2.247 20 0 BEADLO C[C@@H]1C[NH+](Cc2noc(C3CCC3)n2)C[C@H]1C ZINC000625197510 342908268 /nfs/dbraw/zinc/90/82/68/342908268.db2.gz KXLVVQPNCFNZOM-NXEZZACHSA-N 1 2 235.331 2.425 20 0 BEADLO Cc1noc(C[N@@H+](C)Cc2ccc(C)cc2)n1 ZINC000042326569 398323643 /nfs/dbraw/zinc/32/36/43/398323643.db2.gz GWXYGAODMSTYQP-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1noc(C[N@H+](C)Cc2ccc(C)cc2)n1 ZINC000042326569 398323644 /nfs/dbraw/zinc/32/36/44/398323644.db2.gz GWXYGAODMSTYQP-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO COc1c(O)cccc1C[NH2+][C@H](C)c1ccon1 ZINC000351572837 136247042 /nfs/dbraw/zinc/24/70/42/136247042.db2.gz GKEQPUMTSRONTL-SECBINFHSA-N 1 2 248.282 2.240 20 0 BEADLO C[C@H]1CCCN1c1cc(N2CCCCC2)[nH+]cn1 ZINC000105784942 398324980 /nfs/dbraw/zinc/32/49/80/398324980.db2.gz OIHRLZBTSWLRNG-LBPRGKRZSA-N 1 2 246.358 2.456 20 0 BEADLO C[C@H]1CCCN1c1cc(N2CCCCC2)nc[nH+]1 ZINC000105784942 398324982 /nfs/dbraw/zinc/32/49/82/398324982.db2.gz OIHRLZBTSWLRNG-LBPRGKRZSA-N 1 2 246.358 2.456 20 0 BEADLO CC[C@@H]1C[C@H](C)CN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492856857 529437203 /nfs/dbraw/zinc/43/72/03/529437203.db2.gz CKPOSDQDLMWWGW-KOBKQOIESA-N 1 2 233.315 2.070 20 0 BEADLO CC[C@@H](CC(C)C)c1nc(C[NH2+]C)no1 ZINC000308058006 529454748 /nfs/dbraw/zinc/45/47/48/529454748.db2.gz PZDZKYXYSRXURI-VIFPVBQESA-N 1 2 211.309 2.329 20 0 BEADLO O=C(C=C1CCC1)NCCCNc1cccc[nH+]1 ZINC000119294224 398336099 /nfs/dbraw/zinc/33/60/99/398336099.db2.gz AAKFSZMVQUZISJ-UHFFFAOYSA-N 1 2 245.326 2.110 20 0 BEADLO CC[C@H]1CN(Cc2[nH]c(C)c(C)[nH+]2)C[C@H](C)O1 ZINC000628155043 398336192 /nfs/dbraw/zinc/33/61/92/398336192.db2.gz OQZMNEZFJKDXCL-CABZTGNLSA-N 1 2 237.347 2.026 20 0 BEADLO CC(C)c1nc(C[N@H+](C)[C@H]2CCSC2)no1 ZINC000119903499 398333050 /nfs/dbraw/zinc/33/30/50/398333050.db2.gz BFNXEGSXQAEFHI-VIFPVBQESA-N 1 2 241.360 2.130 20 0 BEADLO CC(C)c1nc(C[N@@H+](C)[C@H]2CCSC2)no1 ZINC000119903499 398333051 /nfs/dbraw/zinc/33/30/51/398333051.db2.gz BFNXEGSXQAEFHI-VIFPVBQESA-N 1 2 241.360 2.130 20 0 BEADLO COC(C)(C)C(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC000224034743 398333767 /nfs/dbraw/zinc/33/37/67/398333767.db2.gz UVDCXVRFDUBKNY-UHFFFAOYSA-N 1 2 247.298 2.235 20 0 BEADLO COC(C)(C)C(=O)Nc1ccc2[nH+]c(C)[nH]c2c1 ZINC000224034743 398333768 /nfs/dbraw/zinc/33/37/68/398333768.db2.gz UVDCXVRFDUBKNY-UHFFFAOYSA-N 1 2 247.298 2.235 20 0 BEADLO COC(=O)c1csc(C[NH2+]CC(C)(F)F)c1 ZINC000602673951 349667492 /nfs/dbraw/zinc/66/74/92/349667492.db2.gz FSCHZVVXVSHBJT-UHFFFAOYSA-N 1 2 249.282 2.280 20 0 BEADLO COC[C@H](C)CNc1cc[nH+]c(C2CC2)n1 ZINC000171865409 398343724 /nfs/dbraw/zinc/34/37/24/398343724.db2.gz UEHMKJUNOUSQPQ-SECBINFHSA-N 1 2 221.304 2.048 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1C[C@@H]1C ZINC000643903114 398344382 /nfs/dbraw/zinc/34/43/82/398344382.db2.gz QMEQNVAGJDKSQO-WCBMZHEXSA-N 1 2 204.273 2.293 20 0 BEADLO CC[C@@]1(C)CCCN(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493346074 529521738 /nfs/dbraw/zinc/52/17/38/529521738.db2.gz AXAABXAUFHHXHQ-GJBLVYBDSA-N 1 2 247.342 2.462 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)NCC(C)(C)CC ZINC000493248268 529552802 /nfs/dbraw/zinc/55/28/02/529552802.db2.gz AZHGVGHUEVIGJL-BQYQJAHWSA-N 1 2 249.358 2.469 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N[C@H]1C=CCCC1 ZINC000492490615 529561521 /nfs/dbraw/zinc/56/15/21/529561521.db2.gz IFPYIQXCOQJXPW-LAUAKBEESA-N 1 2 245.326 2.141 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N1CC(C)(CC)C1 ZINC000493433916 529556855 /nfs/dbraw/zinc/55/68/55/529556855.db2.gz NMIXKHGAXJGIEQ-SREVYHEPSA-N 1 2 247.342 2.175 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N(C)[C@H]1CC1(C)C ZINC000492998052 529557182 /nfs/dbraw/zinc/55/71/82/529557182.db2.gz OOZNSPZTNWGDQO-ZADCQDASSA-N 1 2 247.342 2.173 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N(C)CCC1CC1 ZINC000492491825 529557204 /nfs/dbraw/zinc/55/72/04/529557204.db2.gz KQLXRGZHRMWJRH-SREVYHEPSA-N 1 2 247.342 2.175 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N(C)[C@H](C)C1CC1 ZINC000492450517 529549650 /nfs/dbraw/zinc/54/96/50/529549650.db2.gz RCWBGHITCXBCMM-WSKFYRRCSA-N 1 2 247.342 2.173 20 0 BEADLO CC[C@@H](NC(=O)/C=C\c1[nH]cc[nH+]1)C(C)(C)C ZINC000493813305 529573357 /nfs/dbraw/zinc/57/33/57/529573357.db2.gz CRFZBGJBXIPYNT-JYESYGNLSA-N 1 2 235.331 2.364 20 0 BEADLO COC(=O)[C@H]([NH2+]CCc1cccc(C)c1)C1CC1 ZINC000227769685 536735854 /nfs/dbraw/zinc/73/58/54/536735854.db2.gz HUNAOUCUHWWIHB-CQSZACIVSA-N 1 2 247.338 2.079 20 0 BEADLO CO[C@@H]1CN(c2nc(C)[nH+]c(C)c2C)CC[C@@H]1C ZINC000302570371 536738479 /nfs/dbraw/zinc/73/84/79/536738479.db2.gz QIWLAEPBUDKNPO-TVQRCGJNSA-N 1 2 249.358 2.263 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2cnc(C)nc2)n1 ZINC000351877013 136261454 /nfs/dbraw/zinc/26/14/54/136261454.db2.gz AFZLYFPVSDQYBH-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2cnc(C)nc2)n1 ZINC000351877013 136261455 /nfs/dbraw/zinc/26/14/55/136261455.db2.gz AFZLYFPVSDQYBH-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ncc(C[N@@H+]2CCO[C@H](C3CC3)C2)s1 ZINC000335908506 136261750 /nfs/dbraw/zinc/26/17/50/136261750.db2.gz IGJUATJVRGWVPE-LBPRGKRZSA-N 1 2 238.356 2.062 20 0 BEADLO Cc1ncc(C[N@H+]2CCO[C@H](C3CC3)C2)s1 ZINC000335908506 136261751 /nfs/dbraw/zinc/26/17/51/136261751.db2.gz IGJUATJVRGWVPE-LBPRGKRZSA-N 1 2 238.356 2.062 20 0 BEADLO C[C@@H]1C[N@@H+](CC(F)F)C[C@H](C)C1(F)F ZINC000625647433 344024911 /nfs/dbraw/zinc/02/49/11/344024911.db2.gz DXZZEZRBWVSLRS-KNVOCYPGSA-N 1 2 213.218 2.475 20 0 BEADLO C[C@@H]1C[N@H+](CC(F)F)C[C@H](C)C1(F)F ZINC000625647433 344024912 /nfs/dbraw/zinc/02/49/12/344024912.db2.gz DXZZEZRBWVSLRS-KNVOCYPGSA-N 1 2 213.218 2.475 20 0 BEADLO CC(C)CN(Cc1c[nH+]cn1C)CC(F)(F)F ZINC000177051234 346921595 /nfs/dbraw/zinc/92/15/95/346921595.db2.gz NNGSNFRSVRZOPY-UHFFFAOYSA-N 1 2 249.280 2.440 20 0 BEADLO C[C@H]1C[NH+](CC(F)F)C[C@H](C)C1(F)F ZINC000625647418 344025293 /nfs/dbraw/zinc/02/52/93/344025293.db2.gz DXZZEZRBWVSLRS-BQBZGAKWSA-N 1 2 213.218 2.475 20 0 BEADLO CCCCOCC[N@@H+]1CCC=C(F)C1 ZINC000352784064 136264634 /nfs/dbraw/zinc/26/46/34/136264634.db2.gz MNTYKLHKLVQTHU-UHFFFAOYSA-N 1 2 201.285 2.362 20 0 BEADLO CCCCOCC[N@H+]1CCC=C(F)C1 ZINC000352784064 136264635 /nfs/dbraw/zinc/26/46/35/136264635.db2.gz MNTYKLHKLVQTHU-UHFFFAOYSA-N 1 2 201.285 2.362 20 0 BEADLO CCCCc1cc(NCC2(CC)COC2)nc[nH+]1 ZINC000631294400 343147848 /nfs/dbraw/zinc/14/78/48/343147848.db2.gz IVXLDYJQUVIAKT-UHFFFAOYSA-N 1 2 249.358 2.080 20 0 BEADLO CC[C@@H](C)[C@@H](O)CNc1cc[nH+]c(C(C)C)n1 ZINC000112334462 343128823 /nfs/dbraw/zinc/12/88/23/343128823.db2.gz OZSRTNHWTYSYRU-MNOVXSKESA-N 1 2 237.347 2.419 20 0 BEADLO CC[C@H](NC(=O)c1ccccc1F)c1[nH]cc[nH+]1 ZINC000139425680 136271866 /nfs/dbraw/zinc/27/18/66/136271866.db2.gz HWZUXIKCAKCSTF-NSHDSACASA-N 1 2 247.273 2.430 20 0 BEADLO CC[C@@H]([NH2+][C@H]1CCSC1)C(=O)OC(C)(C)C ZINC000310015498 343179133 /nfs/dbraw/zinc/17/91/33/343179133.db2.gz KSDNUDOKHYRRDY-VHSXEESVSA-N 1 2 245.388 2.202 20 0 BEADLO CC[C@H](Cc1cccs1)[NH2+][C@H](C)C(=O)OC ZINC000310019406 343180023 /nfs/dbraw/zinc/18/00/23/343180023.db2.gz MKFSHYJAFAMAON-NXEZZACHSA-N 1 2 241.356 2.220 20 0 BEADLO Cc1ccc(NC(=O)NCC(C)(F)F)c(C)[nH+]1 ZINC000576942720 365728508 /nfs/dbraw/zinc/72/85/08/365728508.db2.gz UBZXMDHBAIUZBH-UHFFFAOYSA-N 1 2 243.257 2.475 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NC1(C)CCCCC1 ZINC000576955012 365731700 /nfs/dbraw/zinc/73/17/00/365731700.db2.gz VCZGXJBHTYFSGK-NSHDSACASA-N 1 2 249.358 2.427 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NC1(C)CCCCC1 ZINC000576955012 365731708 /nfs/dbraw/zinc/73/17/08/365731708.db2.gz VCZGXJBHTYFSGK-NSHDSACASA-N 1 2 249.358 2.427 20 0 BEADLO Cc1cnc(C[NH2+]Cc2cncs2)s1 ZINC000124335516 343167264 /nfs/dbraw/zinc/16/72/64/343167264.db2.gz SHSOGXYYSSOELK-UHFFFAOYSA-N 1 2 225.342 2.198 20 0 BEADLO CC(C)[C@H]1C[C@H](Nc2c[nH]c[nH+]2)CCO1 ZINC000308886360 346929732 /nfs/dbraw/zinc/92/97/32/346929732.db2.gz VXXHGOWDGZKVHR-NXEZZACHSA-N 1 2 209.293 2.025 20 0 BEADLO C[C@@H](NC(=O)CC1CCCC1)c1[nH]cc[nH+]1 ZINC000125371229 343173162 /nfs/dbraw/zinc/17/31/62/343173162.db2.gz XEPUICORRZEMDD-SECBINFHSA-N 1 2 221.304 2.167 20 0 BEADLO Cc1ccsc1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000125411031 343173631 /nfs/dbraw/zinc/17/36/31/343173631.db2.gz HLUHECHNQVBZNB-MRVPVSSYSA-N 1 2 235.312 2.271 20 0 BEADLO Cc1[nH]c(CN(C(C)C)[C@@H]2CCOC2)[nH+]c1C ZINC000628288901 346930832 /nfs/dbraw/zinc/93/08/32/346930832.db2.gz WIXTUZLMKSQWAU-GFCCVEGCSA-N 1 2 237.347 2.026 20 0 BEADLO CCC[C@@H](CC)Nc1nc[nH+]c(N)c1OC ZINC000134873589 343191686 /nfs/dbraw/zinc/19/16/86/343191686.db2.gz KEKPKFDLUZAQKL-MRVPVSSYSA-N 1 2 224.308 2.058 20 0 BEADLO CCC[C@@H](CC)Nc1[nH+]cnc(N)c1OC ZINC000134873589 343191687 /nfs/dbraw/zinc/19/16/87/343191687.db2.gz KEKPKFDLUZAQKL-MRVPVSSYSA-N 1 2 224.308 2.058 20 0 BEADLO COc1c(N)[nH+]cnc1N[C@@H]1CCCC[C@H]1C ZINC000134816483 343195487 /nfs/dbraw/zinc/19/54/87/343195487.db2.gz FSOXOVWWILWUAF-RKDXNWHRSA-N 1 2 236.319 2.058 20 0 BEADLO COc1c(N)nc[nH+]c1N[C@@H]1CCCC[C@H]1C ZINC000134816483 343195488 /nfs/dbraw/zinc/19/54/88/343195488.db2.gz FSOXOVWWILWUAF-RKDXNWHRSA-N 1 2 236.319 2.058 20 0 BEADLO COc1ccc(C[N@@H+]2CCOC[C@@H]2C)cc1F ZINC000046774373 343259941 /nfs/dbraw/zinc/25/99/41/343259941.db2.gz OBSZKYUVLBPGBJ-JTQLQIEISA-N 1 2 239.290 2.055 20 0 BEADLO COc1ccc(C[N@H+]2CCOC[C@@H]2C)cc1F ZINC000046774373 343259943 /nfs/dbraw/zinc/25/99/43/343259943.db2.gz OBSZKYUVLBPGBJ-JTQLQIEISA-N 1 2 239.290 2.055 20 0 BEADLO COC(=O)C(C)(C)[NH2+]CCCc1ccccc1 ZINC000037085136 343333572 /nfs/dbraw/zinc/33/35/72/343333572.db2.gz ZITZIWMLQSBYES-UHFFFAOYSA-N 1 2 235.327 2.160 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)CCC(C)(C)C ZINC000348712081 136293962 /nfs/dbraw/zinc/29/39/62/136293962.db2.gz HJZMYYKEEYFNIH-LLVKDONJSA-N 1 2 237.347 2.214 20 0 BEADLO CC[C@@H]([NH2+][C@@H](C)C(=O)OC)c1ccccc1 ZINC000037074063 343332764 /nfs/dbraw/zinc/33/27/64/343332764.db2.gz SFJGDLZNFIQLDR-CMPLNLGQSA-N 1 2 221.300 2.289 20 0 BEADLO Cn1c[nH+]cc1CCC(=O)NCCCC1CCC1 ZINC000618614205 343313115 /nfs/dbraw/zinc/31/31/15/343313115.db2.gz GSYBFFUCEUMLHF-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO COC(=O)C(C)(C)[NH2+]Cc1ccc(C)cc1 ZINC000037085255 343333400 /nfs/dbraw/zinc/33/34/00/343333400.db2.gz DPNWAVZNGFHCLR-UHFFFAOYSA-N 1 2 221.300 2.036 20 0 BEADLO Cn1c[nH+]cc1CNc1ncccc1Cl ZINC000335620324 136298837 /nfs/dbraw/zinc/29/88/37/136298837.db2.gz ZKSAYGIQFLBOKO-UHFFFAOYSA-N 1 2 222.679 2.081 20 0 BEADLO Cc1csc(CNc2cccc[nH+]2)n1 ZINC000037979597 343363867 /nfs/dbraw/zinc/36/38/67/343363867.db2.gz HSIQUYAJPOJQIU-UHFFFAOYSA-N 1 2 205.286 2.459 20 0 BEADLO C/C=C/c1cn(Cc2c[nH+]ccc2C)nn1 ZINC000641070420 362179378 /nfs/dbraw/zinc/17/93/78/362179378.db2.gz DVPLJNXIRHLQNB-ONEGZZNKSA-N 1 2 214.272 2.063 20 0 BEADLO C/C=C\c1cn(Cc2c[nH+]ccc2C)nn1 ZINC000641070419 362179742 /nfs/dbraw/zinc/17/97/42/362179742.db2.gz DVPLJNXIRHLQNB-ARJAWSKDSA-N 1 2 214.272 2.063 20 0 BEADLO CCCC[C@@H](C)C(=O)N1CCn2cc(C)[nH+]c2C1 ZINC000367073435 136322782 /nfs/dbraw/zinc/32/27/82/136322782.db2.gz SKSVVBFJMYUQPP-LLVKDONJSA-N 1 2 249.358 2.360 20 0 BEADLO c1nc(C[NH2+]Cc2ccc3c(c2)OCO3)cs1 ZINC000040419993 343402553 /nfs/dbraw/zinc/40/25/53/343402553.db2.gz VMLSHKVJKMWRLK-UHFFFAOYSA-N 1 2 248.307 2.162 20 0 BEADLO Cc1c([C@@H](C)[NH2+]Cc2cscn2)cnn1C ZINC000040436111 343403051 /nfs/dbraw/zinc/40/30/51/343403051.db2.gz MZNLXEIDUTYJNI-MRVPVSSYSA-N 1 2 236.344 2.036 20 0 BEADLO CC(C)(C)C[NH2+]c1ccc(-n2cnnn2)cc1 ZINC000041120179 343415650 /nfs/dbraw/zinc/41/56/50/343415650.db2.gz PGRJOLOVPMUDET-UHFFFAOYSA-N 1 2 231.303 2.120 20 0 BEADLO CC(C)C[C@H](C)n1cc(Cn2cc[nH+]c2)nn1 ZINC000641092822 362219388 /nfs/dbraw/zinc/21/93/88/362219388.db2.gz LQHJGRZBJLOZDO-NSHDSACASA-N 1 2 233.319 2.130 20 0 BEADLO C[C@H](NCc1cn2ccccc2[nH+]1)c1ccon1 ZINC000349197416 136331500 /nfs/dbraw/zinc/33/15/00/136331500.db2.gz JDTUZDZSHOXQAF-JTQLQIEISA-N 1 2 242.282 2.173 20 0 BEADLO C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)S1=O ZINC000335709023 136336942 /nfs/dbraw/zinc/33/69/42/136336942.db2.gz ZQOISCGHBOBKNC-VXGBXAGGSA-N 1 2 237.368 2.028 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CCC(C)(C)CC1 ZINC000335710843 136337608 /nfs/dbraw/zinc/33/76/08/136337608.db2.gz JFGSJVGWFKINCZ-UHFFFAOYSA-N 1 2 247.342 2.466 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@H](C)CCc1ccccc1 ZINC000042304317 343434513 /nfs/dbraw/zinc/43/45/13/343434513.db2.gz CVDPSKOARRFWKX-VXGBXAGGSA-N 1 2 235.327 2.159 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@H](C)c1ccc(C)cc1 ZINC000042304320 343434624 /nfs/dbraw/zinc/43/46/24/343434624.db2.gz IGWZMYYHGGWSQY-GHMZBOCLSA-N 1 2 221.300 2.207 20 0 BEADLO c1cc(C[N@@H+]2CCC[C@H]2c2cccnc2)n[nH]1 ZINC000335716676 136339417 /nfs/dbraw/zinc/33/94/17/136339417.db2.gz HODDKTORWQIDFC-ZDUSSCGKSA-N 1 2 228.299 2.142 20 0 BEADLO c1cc(C[N@H+]2CCC[C@H]2c2cccnc2)n[nH]1 ZINC000335716676 136339418 /nfs/dbraw/zinc/33/94/18/136339418.db2.gz HODDKTORWQIDFC-ZDUSSCGKSA-N 1 2 228.299 2.142 20 0 BEADLO CC[C@H]1CC[N@@H+]1Cc1c(C(F)(F)F)cnn1C ZINC000668189658 488218865 /nfs/dbraw/zinc/21/88/65/488218865.db2.gz KVAYIQMEYIEDRG-QMMMGPOBSA-N 1 2 247.264 2.423 20 0 BEADLO CC[C@H]1CC[N@H+]1Cc1c(C(F)(F)F)cnn1C ZINC000668189658 488218866 /nfs/dbraw/zinc/21/88/66/488218866.db2.gz KVAYIQMEYIEDRG-QMMMGPOBSA-N 1 2 247.264 2.423 20 0 BEADLO C[C@@H]1C[C@H]1CC(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000335842936 136354758 /nfs/dbraw/zinc/35/47/58/136354758.db2.gz FRSVHNFYJGOAIT-PWSUYJOCSA-N 1 2 247.342 2.162 20 0 BEADLO C[C@@H]1C[C@H]1CC(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000335842936 136354759 /nfs/dbraw/zinc/35/47/59/136354759.db2.gz FRSVHNFYJGOAIT-PWSUYJOCSA-N 1 2 247.342 2.162 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2CCC[C@H](C)C2)no1 ZINC000335857317 136356116 /nfs/dbraw/zinc/35/61/16/136356116.db2.gz SMOUKDNMFKPWJA-DTWKUNHWSA-N 1 2 209.293 2.171 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2CCC[C@H](C)C2)no1 ZINC000335857317 136356117 /nfs/dbraw/zinc/35/61/17/136356117.db2.gz SMOUKDNMFKPWJA-DTWKUNHWSA-N 1 2 209.293 2.171 20 0 BEADLO Cc1nc([C@H](C)[N@@H+]2CCC[C@@H](C)C2)no1 ZINC000335857315 136356294 /nfs/dbraw/zinc/35/62/94/136356294.db2.gz SMOUKDNMFKPWJA-BDAKNGLRSA-N 1 2 209.293 2.171 20 0 BEADLO Cc1nc([C@H](C)[N@H+]2CCC[C@@H](C)C2)no1 ZINC000335857315 136356295 /nfs/dbraw/zinc/35/62/95/136356295.db2.gz SMOUKDNMFKPWJA-BDAKNGLRSA-N 1 2 209.293 2.171 20 0 BEADLO C[C@H](CC(=O)N1CCC(C)(C)C1)n1cc[nH+]c1 ZINC000570049550 323048168 /nfs/dbraw/zinc/04/81/68/323048168.db2.gz PAOOJPGLVKYNKS-LLVKDONJSA-N 1 2 235.331 2.093 20 0 BEADLO COCCCCC[N@@H+]1CCO[C@@H](C(C)C)C1 ZINC000351102779 136367857 /nfs/dbraw/zinc/36/78/57/136367857.db2.gz QMSOAURDVKWQMV-CYBMUJFWSA-N 1 2 229.364 2.160 20 0 BEADLO COCCCCC[N@H+]1CCO[C@@H](C(C)C)C1 ZINC000351102779 136367858 /nfs/dbraw/zinc/36/78/58/136367858.db2.gz QMSOAURDVKWQMV-CYBMUJFWSA-N 1 2 229.364 2.160 20 0 BEADLO CO[C@H](C)C[NH2+][C@H]1CCc2ccccc21 ZINC000167012765 136367903 /nfs/dbraw/zinc/36/79/03/136367903.db2.gz XTGIODNVNKFUTJ-MFKMUULPSA-N 1 2 205.301 2.298 20 0 BEADLO CC(C)CC(C)(C)C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627369624 346942611 /nfs/dbraw/zinc/94/26/11/346942611.db2.gz YQXAYNPULHHYIS-UHFFFAOYSA-N 1 2 249.358 2.367 20 0 BEADLO CC(C)CC(C)(C)C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627369624 346942614 /nfs/dbraw/zinc/94/26/14/346942614.db2.gz YQXAYNPULHHYIS-UHFFFAOYSA-N 1 2 249.358 2.367 20 0 BEADLO Cc1cc(NCC2CC(C)(C)C2)nc[nH+]1 ZINC000379924763 365751504 /nfs/dbraw/zinc/75/15/04/365751504.db2.gz KLCURUSQXLZMMF-UHFFFAOYSA-N 1 2 205.305 2.055 20 0 BEADLO CC[NH2+][C@H](c1ncn[nH]1)C1CCCCC1 ZINC000083746805 343497575 /nfs/dbraw/zinc/49/75/75/343497575.db2.gz HLBAVMWWNCBJEG-JTQLQIEISA-N 1 2 208.309 2.036 20 0 BEADLO CC1(C)C[S@](=O)CC[N@@H+]1Cc1ccccc1 ZINC000336061773 534942015 /nfs/dbraw/zinc/94/20/15/534942015.db2.gz DYCOAVIIBOWHOM-MRXNPFEDSA-N 1 2 237.368 2.030 20 0 BEADLO CC1(C)C[S@](=O)CC[N@H+]1Cc1ccccc1 ZINC000336061773 534942019 /nfs/dbraw/zinc/94/20/19/534942019.db2.gz DYCOAVIIBOWHOM-MRXNPFEDSA-N 1 2 237.368 2.030 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CCc2[nH+]c[nH]c2C1)C(C)(C)C ZINC000616562073 343505170 /nfs/dbraw/zinc/50/51/70/343505170.db2.gz RNIIHPAWTLRXLD-NXEZZACHSA-N 1 2 249.358 2.065 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CCc2[nH]c[nH+]c2C1)C(C)(C)C ZINC000616562073 343505172 /nfs/dbraw/zinc/50/51/72/343505172.db2.gz RNIIHPAWTLRXLD-NXEZZACHSA-N 1 2 249.358 2.065 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)[C@@H]1CC=CCC1 ZINC000047975870 343569087 /nfs/dbraw/zinc/56/90/87/343569087.db2.gz VESCQGBZDDBCEX-LLVKDONJSA-N 1 2 245.326 2.442 20 0 BEADLO COC(=O)C[N@H+](C)Cc1cccc2ccccc21 ZINC000048583759 343584256 /nfs/dbraw/zinc/58/42/56/343584256.db2.gz QJYHLEUJHRSTKQ-UHFFFAOYSA-N 1 2 243.306 2.445 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1cccc2ccccc21 ZINC000048583759 343584258 /nfs/dbraw/zinc/58/42/58/343584258.db2.gz QJYHLEUJHRSTKQ-UHFFFAOYSA-N 1 2 243.306 2.445 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)Nc1ncccc1Cl ZINC000049236009 343594439 /nfs/dbraw/zinc/59/44/39/343594439.db2.gz AYJSOCZQKXRVKP-SECBINFHSA-N 1 2 236.706 2.432 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)c1ccccc1Cl ZINC000622745672 343605610 /nfs/dbraw/zinc/60/56/10/343605610.db2.gz SELOOUJLNNRQFL-UHFFFAOYSA-N 1 2 249.701 2.335 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)c1ccccc1Cl ZINC000622745672 343605611 /nfs/dbraw/zinc/60/56/11/343605611.db2.gz SELOOUJLNNRQFL-UHFFFAOYSA-N 1 2 249.701 2.335 20 0 BEADLO Cc1nnc(C[N@H+](Cc2ccccn2)C(C)C)o1 ZINC000052218033 343632527 /nfs/dbraw/zinc/63/25/27/343632527.db2.gz FZAOQUGKTNAZIE-UHFFFAOYSA-N 1 2 246.314 2.184 20 0 BEADLO Cc1nnc(C[N@@H+](Cc2ccccn2)C(C)C)o1 ZINC000052218033 343632530 /nfs/dbraw/zinc/63/25/30/343632530.db2.gz FZAOQUGKTNAZIE-UHFFFAOYSA-N 1 2 246.314 2.184 20 0 BEADLO CCCCN(CC)c1cc(-n2cc[nH+]c2)ncn1 ZINC000077165208 343669846 /nfs/dbraw/zinc/66/98/46/343669846.db2.gz IHMFGOPESFJYMJ-UHFFFAOYSA-N 1 2 245.330 2.289 20 0 BEADLO Cc1nnsc1C[N@@H+](C)[C@@H](C)c1cccnc1 ZINC000576063867 343702570 /nfs/dbraw/zinc/70/25/70/343702570.db2.gz VANLLLORQATBIQ-JTQLQIEISA-N 1 2 248.355 2.435 20 0 BEADLO Cc1nnsc1C[N@H+](C)[C@@H](C)c1cccnc1 ZINC000576063867 343702572 /nfs/dbraw/zinc/70/25/72/343702572.db2.gz VANLLLORQATBIQ-JTQLQIEISA-N 1 2 248.355 2.435 20 0 BEADLO CC[C@@H]1C[C@H]1Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000390747128 537806081 /nfs/dbraw/zinc/80/60/81/537806081.db2.gz ASTJNPBGOOGMKM-NXEZZACHSA-N 1 2 219.332 2.406 20 0 BEADLO Cc1cc[nH+]c([C@H]2CCN(c3ncccn3)C2)c1 ZINC000624371621 343739471 /nfs/dbraw/zinc/73/94/71/343739471.db2.gz SRXKYJONDAIDFU-LBPRGKRZSA-N 1 2 240.310 2.174 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2nccs2)[nH]n1 ZINC000380265199 343711899 /nfs/dbraw/zinc/71/18/99/343711899.db2.gz TUDCUWNJFKSGNU-MRVPVSSYSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1cc(CNC(=O)CC2CC2)cc(C)[nH+]1 ZINC000421573565 192364504 /nfs/dbraw/zinc/36/45/04/192364504.db2.gz BJTPOHYQKCWWDG-UHFFFAOYSA-N 1 2 218.300 2.115 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2c(C)nsc2C)CCO1 ZINC000584151176 343765749 /nfs/dbraw/zinc/76/57/49/343765749.db2.gz GVITTZNZUHGHAA-LLVKDONJSA-N 1 2 240.372 2.371 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2c(C)nsc2C)CCO1 ZINC000584151176 343765751 /nfs/dbraw/zinc/76/57/51/343765751.db2.gz GVITTZNZUHGHAA-LLVKDONJSA-N 1 2 240.372 2.371 20 0 BEADLO C[C@@H]1CC2(CCC2)CN1C(=O)CCc1c[nH+]c[nH]1 ZINC000336441269 537812054 /nfs/dbraw/zinc/81/20/54/537812054.db2.gz OZAOCIDTUBIWJM-LLVKDONJSA-N 1 2 247.342 2.133 20 0 BEADLO C[C@@H]1CC2(CCC2)CN1C(=O)CCc1c[nH]c[nH+]1 ZINC000336441269 537812060 /nfs/dbraw/zinc/81/20/60/537812060.db2.gz OZAOCIDTUBIWJM-LLVKDONJSA-N 1 2 247.342 2.133 20 0 BEADLO CC1(C)CCC[C@H](C(=O)NCCn2cc[nH+]c2)C1 ZINC000179295520 346980602 /nfs/dbraw/zinc/98/06/02/346980602.db2.gz QPJTVWCIAWLBBG-LBPRGKRZSA-N 1 2 249.358 2.216 20 0 BEADLO C[N@H+](CC(=O)OC(C)(C)C)[C@@H]1C=CCCC1 ZINC000066497504 349877198 /nfs/dbraw/zinc/87/71/98/349877198.db2.gz ZVQNJXYABGDBAM-LLVKDONJSA-N 1 2 225.332 2.369 20 0 BEADLO C[N@@H+](CC(=O)OC(C)(C)C)[C@@H]1C=CCCC1 ZINC000066497504 349877199 /nfs/dbraw/zinc/87/71/99/349877199.db2.gz ZVQNJXYABGDBAM-LLVKDONJSA-N 1 2 225.332 2.369 20 0 BEADLO CC(C)Oc1cccc(C[NH+]2CC(C)(O)C2)c1 ZINC000683895945 488238961 /nfs/dbraw/zinc/23/89/61/488238961.db2.gz RZPSMLBEMLZMCJ-UHFFFAOYSA-N 1 2 235.327 2.040 20 0 BEADLO C[C@@H]1C[C@@H]1C[N@H+](C)Cc1noc(C2CC2)n1 ZINC000625470403 343874660 /nfs/dbraw/zinc/87/46/60/343874660.db2.gz FSFZFGBJPIALAZ-PSASIEDQSA-N 1 2 221.304 2.035 20 0 BEADLO C[C@@H]1C[C@@H]1C[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000625470403 343874662 /nfs/dbraw/zinc/87/46/62/343874662.db2.gz FSFZFGBJPIALAZ-PSASIEDQSA-N 1 2 221.304 2.035 20 0 BEADLO CC(C)CC1(NC(=O)[C@H](C)Cc2c[nH+]c[nH]2)CC1 ZINC000620286963 343889636 /nfs/dbraw/zinc/88/96/36/343889636.db2.gz VZSDAFIQVFFRCN-LLVKDONJSA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)CC1(NC(=O)[C@H](C)Cc2c[nH]c[nH+]2)CC1 ZINC000620286963 343889637 /nfs/dbraw/zinc/88/96/37/343889637.db2.gz VZSDAFIQVFFRCN-LLVKDONJSA-N 1 2 249.358 2.283 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CSC1(C)C ZINC000393749010 343923713 /nfs/dbraw/zinc/92/37/13/343923713.db2.gz PPZKNYXZLPPSAE-VIFPVBQESA-N 1 2 224.329 2.396 20 0 BEADLO Cc1cc(N2CCCC(F)(F)CC2)nc[nH+]1 ZINC000624520876 343932886 /nfs/dbraw/zinc/93/28/86/343932886.db2.gz DDFLZOZZIKNTPT-UHFFFAOYSA-N 1 2 227.258 2.411 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2nc(C)c[nH]2)cc1 ZINC000628119385 343970759 /nfs/dbraw/zinc/97/07/59/343970759.db2.gz PIDBJNBMXIBREZ-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2nc(C)c[nH]2)cc1 ZINC000628119385 343970760 /nfs/dbraw/zinc/97/07/60/343970760.db2.gz PIDBJNBMXIBREZ-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)n1 ZINC000628119903 343968533 /nfs/dbraw/zinc/96/85/33/343968533.db2.gz PMBXGOCRMOGRMT-SECBINFHSA-N 1 2 247.264 2.492 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)n1 ZINC000628119903 343968534 /nfs/dbraw/zinc/96/85/34/343968534.db2.gz PMBXGOCRMOGRMT-SECBINFHSA-N 1 2 247.264 2.492 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CCCC(F)(F)CC2)[nH]1 ZINC000625771147 344067038 /nfs/dbraw/zinc/06/70/38/344067038.db2.gz BMKLVXURJLHKFI-MRVPVSSYSA-N 1 2 244.289 2.295 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CCCC(F)(F)CC2)[nH]1 ZINC000625771147 344067039 /nfs/dbraw/zinc/06/70/39/344067039.db2.gz BMKLVXURJLHKFI-MRVPVSSYSA-N 1 2 244.289 2.295 20 0 BEADLO CC[C@H](C)Cc1noc(CCn2cc[nH+]c2)n1 ZINC000632246056 344078139 /nfs/dbraw/zinc/07/81/39/344078139.db2.gz KWJQCTNPLLOFGB-JTQLQIEISA-N 1 2 234.303 2.097 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1C[C@H](C)C[C@@H]1C ZINC000335912316 344084949 /nfs/dbraw/zinc/08/49/49/344084949.db2.gz RUMKWBDRGKSUDW-KOLCDFICSA-N 1 2 233.315 2.074 20 0 BEADLO O=C(CCCn1cc[nH+]c1)Nc1cccc(F)c1 ZINC000620409494 344085657 /nfs/dbraw/zinc/08/56/57/344085657.db2.gz PRTGNCRXYOMGPY-UHFFFAOYSA-N 1 2 247.273 2.441 20 0 BEADLO CCCc1noc(C[NH+](C2CC2)C2CC2)n1 ZINC000625834812 344088683 /nfs/dbraw/zinc/08/86/83/344088683.db2.gz PBNZXEFIAVOJTC-UHFFFAOYSA-N 1 2 221.304 2.149 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)CC1CCCCC1 ZINC000082260191 344152938 /nfs/dbraw/zinc/15/29/38/344152938.db2.gz BVLZJYMVFDXJED-UHFFFAOYSA-N 1 2 235.331 2.007 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC[C@@H]2c2ccccn2)n1 ZINC000628136686 344212348 /nfs/dbraw/zinc/21/23/48/344212348.db2.gz KAXNNIHMUNLXLL-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC[C@@H]2c2ccccn2)n1 ZINC000628136686 344212349 /nfs/dbraw/zinc/21/23/49/344212349.db2.gz KAXNNIHMUNLXLL-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO CC(C)n1ccc(C[NH2+]Cc2cccnc2)n1 ZINC000084225378 344190060 /nfs/dbraw/zinc/19/00/60/344190060.db2.gz XQUYJRQZGCPLPU-UHFFFAOYSA-N 1 2 230.315 2.149 20 0 BEADLO CCCCOCCNc1cc(C)[nH+]cn1 ZINC000040727434 344247446 /nfs/dbraw/zinc/24/74/46/344247446.db2.gz SOWDNIOPCPULLF-UHFFFAOYSA-N 1 2 209.293 2.014 20 0 BEADLO CCc1cc(N[C@@H]2C[C@@H](C)O[C@@H]2C)nc[nH+]1 ZINC000385090276 344322940 /nfs/dbraw/zinc/32/29/40/344322940.db2.gz GDLUUQPHXVXKLS-FXPVBKGRSA-N 1 2 221.304 2.017 20 0 BEADLO CC[C@@H]([NH2+][C@@H]1C[C@H]1c1ccsc1)C(=O)OC ZINC000600612737 344336265 /nfs/dbraw/zinc/33/62/65/344336265.db2.gz BZTWQCBIGNJTDH-HBNTYKKESA-N 1 2 239.340 2.145 20 0 BEADLO C/C=C/C[NH2+][C@@H](CC(C)C)C(=O)OCC ZINC000600615440 344337108 /nfs/dbraw/zinc/33/71/08/344337108.db2.gz VXEUKQGXOYBFAA-ZRQQLDRUSA-N 1 2 213.321 2.130 20 0 BEADLO CC1=C(C(=O)N[C@H](C)c2[nH+]ccn2C)CCC1 ZINC000620604036 344354757 /nfs/dbraw/zinc/35/47/57/344354757.db2.gz PREUBRYEFSHTCC-SNVBAGLBSA-N 1 2 233.315 2.098 20 0 BEADLO CC(C)CC[C@@](C)(O)CNc1cc[nH+]cc1F ZINC000641391047 362389099 /nfs/dbraw/zinc/38/90/99/362389099.db2.gz YGZONMYCOXGNEJ-CYBMUJFWSA-N 1 2 240.322 2.242 20 0 BEADLO CO[C@H](C(=O)Nc1c(C)cc[nH+]c1C)C1CCC1 ZINC000622866654 344435176 /nfs/dbraw/zinc/43/51/76/344435176.db2.gz NHIJDFVLTJNKHR-ZDUSSCGKSA-N 1 2 248.326 2.452 20 0 BEADLO CC1(C)CCC[C@@H](CNCC(F)(F)C[NH3+])C1 ZINC000584279335 344405374 /nfs/dbraw/zinc/40/53/74/344405374.db2.gz SUBPYVLZDHKSAB-SNVBAGLBSA-N 1 2 234.334 2.386 20 0 BEADLO COC(C)(C)C[C@@H](C)Nc1cc[nH+]cc1F ZINC000641399663 362393809 /nfs/dbraw/zinc/39/38/09/362393809.db2.gz RLCYMNZSHJUNNC-SECBINFHSA-N 1 2 226.295 2.258 20 0 BEADLO COc1ccc[nH+]c1NCC1(SC)CC1 ZINC000234948186 344494165 /nfs/dbraw/zinc/49/41/65/344494165.db2.gz HUEIKGXNIKQYNQ-UHFFFAOYSA-N 1 2 224.329 2.398 20 0 BEADLO CC[N@@H+](Cc1cccs1)Cc1ncc[nH]1 ZINC000109828687 344535073 /nfs/dbraw/zinc/53/50/73/344535073.db2.gz ASQJYQZSXZXNFV-UHFFFAOYSA-N 1 2 221.329 2.493 20 0 BEADLO CC[N@H+](Cc1cccs1)Cc1ncc[nH]1 ZINC000109828687 344535076 /nfs/dbraw/zinc/53/50/76/344535076.db2.gz ASQJYQZSXZXNFV-UHFFFAOYSA-N 1 2 221.329 2.493 20 0 BEADLO C[C@@H](CNc1cc(CO)cc[nH+]1)c1ccncc1 ZINC000641418765 362405339 /nfs/dbraw/zinc/40/53/39/362405339.db2.gz PKSJEBVCHJOYAG-NSHDSACASA-N 1 2 243.310 2.185 20 0 BEADLO CN(CCOC(C)(C)C)c1cc[nH+]cc1F ZINC000641446431 362423630 /nfs/dbraw/zinc/42/36/30/362423630.db2.gz IBQDEOXYYVAQMA-UHFFFAOYSA-N 1 2 226.295 2.472 20 0 BEADLO Cc1noc(C)c1[C@H](C)CNc1cc[nH+]cc1F ZINC000641457517 362428021 /nfs/dbraw/zinc/42/80/21/362428021.db2.gz XWYCEHSIQNBUSI-MRVPVSSYSA-N 1 2 249.289 2.463 20 0 BEADLO CCOCCC1(CNc2cc[nH+]cc2F)CC1 ZINC000641457679 362429131 /nfs/dbraw/zinc/42/91/31/362429131.db2.gz RJHAPYDYPJYVOT-UHFFFAOYSA-N 1 2 238.306 2.261 20 0 BEADLO CCC1(CO)CCN(c2cc[nH+]cc2F)CC1 ZINC000641469243 362437833 /nfs/dbraw/zinc/43/78/33/362437833.db2.gz VNJNVLQBQBCODI-UHFFFAOYSA-N 1 2 238.306 2.210 20 0 BEADLO C[C@@H](Nc1cc[nH+]cc1F)[C@@H]1CCCCO1 ZINC000641481865 362450004 /nfs/dbraw/zinc/45/00/04/362450004.db2.gz ALHKTWIZYPAJNV-SKDRFNHKSA-N 1 2 224.279 2.012 20 0 BEADLO C[C@@H](Nc1cc[nH+]cc1F)[C@H]1CCCCO1 ZINC000641481862 362450234 /nfs/dbraw/zinc/45/02/34/362450234.db2.gz ALHKTWIZYPAJNV-BXKDBHETSA-N 1 2 224.279 2.012 20 0 BEADLO CN(C[C@@H]1CCCC[C@@H]1O)c1cc[nH+]cc1F ZINC000641483521 362450993 /nfs/dbraw/zinc/45/09/93/362450993.db2.gz RHNSAIFKSJRRIE-GWCFXTLKSA-N 1 2 238.306 2.208 20 0 BEADLO C[C@@H]1CCN(c2cc[nH+]cc2F)C[C@H]1F ZINC000641483927 362452622 /nfs/dbraw/zinc/45/26/22/362452622.db2.gz XSMYOWXPLLKMGH-PSASIEDQSA-N 1 2 212.243 2.405 20 0 BEADLO C[C@@H](CNc1cc(CO)cc[nH+]1)c1nccs1 ZINC000641487676 362454631 /nfs/dbraw/zinc/45/46/31/362454631.db2.gz BFXVFMZMRLTUPA-VIFPVBQESA-N 1 2 249.339 2.246 20 0 BEADLO Fc1c[nH+]ccc1NC[C@H]1CCCCS1 ZINC000641487716 362454736 /nfs/dbraw/zinc/45/47/36/362454736.db2.gz NKJSZKADWTZUHD-SECBINFHSA-N 1 2 226.320 2.340 20 0 BEADLO C[C@@H]1C[C@@H](CCNc2cc[nH+]cc2F)CCO1 ZINC000641487909 362454994 /nfs/dbraw/zinc/45/49/94/362454994.db2.gz XBAJWZDATBBDAX-MNOVXSKESA-N 1 2 238.306 2.260 20 0 BEADLO Fc1c[nH+]ccc1NCCC[C@H]1CCCCO1 ZINC000641489823 362457771 /nfs/dbraw/zinc/45/77/71/362457771.db2.gz TUSLSFMXLMCGCJ-LLVKDONJSA-N 1 2 238.306 2.404 20 0 BEADLO CO[C@@H]1CN(c2cc[nH+]cc2F)CC[C@H]1C ZINC000641523005 362479760 /nfs/dbraw/zinc/47/97/60/362479760.db2.gz XLGJVZTVRDAYEC-BXKDBHETSA-N 1 2 224.279 2.082 20 0 BEADLO C[C@@H]1CSCCN(c2cc[nH+]cc2F)C1 ZINC000641533033 362484876 /nfs/dbraw/zinc/48/48/76/362484876.db2.gz SOTHVTQGHQHHJN-VIFPVBQESA-N 1 2 226.320 2.410 20 0 BEADLO C[C@@H](c1ccncc1)[N@@H+]1CCO[C@@H](CCF)C1 ZINC000626002011 344662365 /nfs/dbraw/zinc/66/23/65/344662365.db2.gz DMSOVQXQSGNTCK-AAEUAGOBSA-N 1 2 238.306 2.203 20 0 BEADLO C[C@@H](c1ccncc1)[N@H+]1CCO[C@@H](CCF)C1 ZINC000626002011 344662366 /nfs/dbraw/zinc/66/23/66/344662366.db2.gz DMSOVQXQSGNTCK-AAEUAGOBSA-N 1 2 238.306 2.203 20 0 BEADLO CC[N@H+](Cc1ncn(-c2ccccc2)n1)C(C)C ZINC000181545800 347063324 /nfs/dbraw/zinc/06/33/24/347063324.db2.gz GDCYSCBBOHUURS-UHFFFAOYSA-N 1 2 244.342 2.498 20 0 BEADLO CC[N@@H+](Cc1ncn(-c2ccccc2)n1)C(C)C ZINC000181545800 347063326 /nfs/dbraw/zinc/06/33/26/347063326.db2.gz GDCYSCBBOHUURS-UHFFFAOYSA-N 1 2 244.342 2.498 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1ccc(CC)s1 ZINC000050066536 344630212 /nfs/dbraw/zinc/63/02/12/344630212.db2.gz LNPYNZQPRQTXPL-UHFFFAOYSA-N 1 2 241.356 2.305 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1ccc(CC)s1 ZINC000050066536 344630214 /nfs/dbraw/zinc/63/02/14/344630214.db2.gz LNPYNZQPRQTXPL-UHFFFAOYSA-N 1 2 241.356 2.305 20 0 BEADLO C[C@]12CCCC[C@H]1C[N@@H+]2Cc1csnn1 ZINC000626103856 344745216 /nfs/dbraw/zinc/74/52/16/344745216.db2.gz TUSIOGGVDWVXAQ-ONGXEEELSA-N 1 2 223.345 2.303 20 0 BEADLO C[C@]12CCCC[C@H]1C[N@H+]2Cc1csnn1 ZINC000626103856 344745218 /nfs/dbraw/zinc/74/52/18/344745218.db2.gz TUSIOGGVDWVXAQ-ONGXEEELSA-N 1 2 223.345 2.303 20 0 BEADLO CCOC(=O)C[C@@H](C)Nc1cc[nH+]c(C2CC2)n1 ZINC000152829813 344697031 /nfs/dbraw/zinc/69/70/31/344697031.db2.gz SHSWRJDYDLOURO-SECBINFHSA-N 1 2 249.314 2.108 20 0 BEADLO Cc1ccccc1C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000082285380 344714689 /nfs/dbraw/zinc/71/46/89/344714689.db2.gz DEQDMLTVVSSZIZ-NSHDSACASA-N 1 2 243.310 2.220 20 0 BEADLO C[C@@H](NC(=O)C1CCCCC1)c1[nH+]ccn1C ZINC000082279909 344715188 /nfs/dbraw/zinc/71/51/88/344715188.db2.gz WJXQEEGSUYZJTJ-SNVBAGLBSA-N 1 2 235.331 2.178 20 0 BEADLO C[C@H](NC(=O)C1CCCCC1)c1[nH+]ccn1C ZINC000082279908 344715511 /nfs/dbraw/zinc/71/55/11/344715511.db2.gz WJXQEEGSUYZJTJ-JTQLQIEISA-N 1 2 235.331 2.178 20 0 BEADLO CC[C@@H](C)C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000075552082 344779214 /nfs/dbraw/zinc/77/92/14/344779214.db2.gz PHFPYZSOJXHNMY-MNOVXSKESA-N 1 2 235.331 2.162 20 0 BEADLO C[N@@H+](Cc1ccon1)Cc1cccs1 ZINC000077247203 344813911 /nfs/dbraw/zinc/81/39/11/344813911.db2.gz FAKZKWXPTZNVCK-UHFFFAOYSA-N 1 2 208.286 2.368 20 0 BEADLO C[N@H+](Cc1ccon1)Cc1cccs1 ZINC000077247203 344813912 /nfs/dbraw/zinc/81/39/12/344813912.db2.gz FAKZKWXPTZNVCK-UHFFFAOYSA-N 1 2 208.286 2.368 20 0 BEADLO Cc1ncc(C[N@@H+]2CCOc3ccccc3C2)o1 ZINC000628150310 344837847 /nfs/dbraw/zinc/83/78/47/344837847.db2.gz NERVNLQSIWFJNL-UHFFFAOYSA-N 1 2 244.294 2.378 20 0 BEADLO Cc1ncc(C[N@H+]2CCOc3ccccc3C2)o1 ZINC000628150310 344837849 /nfs/dbraw/zinc/83/78/49/344837849.db2.gz NERVNLQSIWFJNL-UHFFFAOYSA-N 1 2 244.294 2.378 20 0 BEADLO Cc1cc([C@@H]2CCCN2Cc2[nH]cc(C)[nH+]2)on1 ZINC000628146451 344825568 /nfs/dbraw/zinc/82/55/68/344825568.db2.gz OBJVZKILEIQDON-NSHDSACASA-N 1 2 246.314 2.352 20 0 BEADLO Cc1nc(NC[C@@](C)(O)c2cccs2)cc[nH+]1 ZINC000078297547 344842285 /nfs/dbraw/zinc/84/22/85/344842285.db2.gz IMFKJIPWEMTVQL-GFCCVEGCSA-N 1 2 249.339 2.166 20 0 BEADLO Fc1c[nH+]ccc1N1CCC2(CCOC2)CC1 ZINC000641552333 362496010 /nfs/dbraw/zinc/49/60/10/362496010.db2.gz IEQMSWSITGWANA-UHFFFAOYSA-N 1 2 236.290 2.228 20 0 BEADLO COC[C@H]([NH2+][C@@H](C)c1ncc[nH]1)c1ccccc1 ZINC000234724263 537872827 /nfs/dbraw/zinc/87/28/27/537872827.db2.gz FEAMJYPOGMIAFI-AAEUAGOBSA-N 1 2 245.326 2.448 20 0 BEADLO COC[C@@H]([NH2+][C@@H](C)c1ncc[nH]1)c1ccccc1 ZINC000234736174 537870742 /nfs/dbraw/zinc/87/07/42/537870742.db2.gz FEAMJYPOGMIAFI-WCQYABFASA-N 1 2 245.326 2.448 20 0 BEADLO Cc1c[nH]c(CN(C)Cc2cccc(C)n2)[nH+]1 ZINC000628182708 344926996 /nfs/dbraw/zinc/92/69/96/344926996.db2.gz FQEZKMOLTKLIBK-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nc(C)c(C)[nH]2)CCS1 ZINC000628178991 344913465 /nfs/dbraw/zinc/91/34/65/344913465.db2.gz KHRCVCFQYYGANR-LLVKDONJSA-N 1 2 239.388 2.354 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nc(C)c(C)[nH]2)CCS1 ZINC000628178991 344913466 /nfs/dbraw/zinc/91/34/66/344913466.db2.gz KHRCVCFQYYGANR-LLVKDONJSA-N 1 2 239.388 2.354 20 0 BEADLO CC[C@@H]1CN(Cc2[nH]c(C)c(C)[nH+]2)CCS1 ZINC000628178991 344913467 /nfs/dbraw/zinc/91/34/67/344913467.db2.gz KHRCVCFQYYGANR-LLVKDONJSA-N 1 2 239.388 2.354 20 0 BEADLO CC(=O)[C@H]1CCCC[N@@H+]1Cc1cncs1 ZINC000166612845 344943191 /nfs/dbraw/zinc/94/31/91/344943191.db2.gz BYFQAWVWWDMMCA-LLVKDONJSA-N 1 2 224.329 2.087 20 0 BEADLO CC(=O)[C@H]1CCCC[N@H+]1Cc1cncs1 ZINC000166612845 344943193 /nfs/dbraw/zinc/94/31/93/344943193.db2.gz BYFQAWVWWDMMCA-LLVKDONJSA-N 1 2 224.329 2.087 20 0 BEADLO Cc1c[nH]c(CN(CC(F)F)C(C)C)[nH+]1 ZINC000628190941 344944468 /nfs/dbraw/zinc/94/44/68/344944468.db2.gz VECXZWFOXVBJCR-UHFFFAOYSA-N 1 2 217.263 2.194 20 0 BEADLO C[C@H](CC(=O)N[C@@H]1CCC[C@@H]2C[C@@H]21)n1cc[nH+]c1 ZINC000583443890 344979343 /nfs/dbraw/zinc/97/93/43/344979343.db2.gz GJRBMNKRUWZSFL-FVCCEPFGSA-N 1 2 247.342 2.139 20 0 BEADLO C[C@@H](CC(=O)N[C@H]1CCC[C@@H]2C[C@@H]21)n1cc[nH+]c1 ZINC000583443893 344979625 /nfs/dbraw/zinc/97/96/25/344979625.db2.gz GJRBMNKRUWZSFL-RNJOBUHISA-N 1 2 247.342 2.139 20 0 BEADLO C[C@H](CC(=O)N[C@H]1CCC[C@@H]2C[C@@H]21)n1cc[nH+]c1 ZINC000583443891 344979935 /nfs/dbraw/zinc/97/99/35/344979935.db2.gz GJRBMNKRUWZSFL-NDBYEHHHSA-N 1 2 247.342 2.139 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CC[C@@H](C2CC2)C1 ZINC000583451248 344998644 /nfs/dbraw/zinc/99/86/44/344998644.db2.gz PISBPARHVPFAOP-GFCCVEGCSA-N 1 2 217.316 2.330 20 0 BEADLO CC[C@H]1CN(c2cc[nH+]cc2F)CCCO1 ZINC000641553244 362497855 /nfs/dbraw/zinc/49/78/55/362497855.db2.gz UZPOYORQICWLPS-JTQLQIEISA-N 1 2 224.279 2.226 20 0 BEADLO CC[C@@H](C)[C@H](CNc1cc[nH+]cc1F)OC ZINC000641615222 362547462 /nfs/dbraw/zinc/54/74/62/362547462.db2.gz IKHFWQGYCYQIDZ-SKDRFNHKSA-N 1 2 226.295 2.116 20 0 BEADLO CO[C@H]1CCN(c2cc[nH+]cc2F)CC1(C)C ZINC000641619718 362550720 /nfs/dbraw/zinc/55/07/20/362550720.db2.gz WXAMBDDHTPLXNE-LBPRGKRZSA-N 1 2 238.306 2.472 20 0 BEADLO Cc1cncnc1N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000641622375 362554058 /nfs/dbraw/zinc/55/40/58/362554058.db2.gz SYRZQIYKWWOLRJ-ZJUUUORDSA-N 1 2 229.287 2.099 20 0 BEADLO CCC[C@]1(CO)CCN(c2cc[nH+]cc2F)C1 ZINC000641601525 362539219 /nfs/dbraw/zinc/53/92/19/362539219.db2.gz FCIQXYMZVZTCBP-ZDUSSCGKSA-N 1 2 238.306 2.210 20 0 BEADLO CCC(CC)(CNc1cc[nH+]cc1F)OC ZINC000641608652 362543087 /nfs/dbraw/zinc/54/30/87/362543087.db2.gz XCMLLQJMPVJJPJ-UHFFFAOYSA-N 1 2 226.295 2.260 20 0 BEADLO CC(F)(F)CCCNc1cc[nH+]cc1F ZINC000641613536 362545276 /nfs/dbraw/zinc/54/52/76/362545276.db2.gz SMZOEEQWRSDDHO-UHFFFAOYSA-N 1 2 218.222 2.490 20 0 BEADLO OCc1cc[nH+]c(NC2CC3(CCC3)C2)c1 ZINC000641652462 362578650 /nfs/dbraw/zinc/57/86/50/362578650.db2.gz LJVIFONESHHLMA-UHFFFAOYSA-N 1 2 218.300 2.319 20 0 BEADLO CC[C@@H](Nc1cc[nH+]cc1F)[C@H]1CCCCO1 ZINC000641655096 362578806 /nfs/dbraw/zinc/57/88/06/362578806.db2.gz CLPMGQCSCWRRLV-DGCLKSJQSA-N 1 2 238.306 2.402 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@]2(CC2(F)F)C1 ZINC000641652054 362578892 /nfs/dbraw/zinc/57/88/92/362578892.db2.gz MQGKSAUJRARGMS-JTQLQIEISA-N 1 2 228.217 2.456 20 0 BEADLO C[C@@H](Cc1ccccn1)Nc1cc(CO)cc[nH+]1 ZINC000641655689 362580172 /nfs/dbraw/zinc/58/01/72/362580172.db2.gz VMXJEOIHQBFSHK-NSHDSACASA-N 1 2 243.310 2.012 20 0 BEADLO COC[C@H]1CCCN(c2cc[nH+]cc2F)CC1 ZINC000641625457 362557708 /nfs/dbraw/zinc/55/77/08/362557708.db2.gz RTKJDRWHIDHUEJ-NSHDSACASA-N 1 2 238.306 2.474 20 0 BEADLO Fc1c[nH+]ccc1N1CCC[C@]2(CCOC2)C1 ZINC000641628229 362557774 /nfs/dbraw/zinc/55/77/74/362557774.db2.gz BQXSUYPFLLTTFG-ZDUSSCGKSA-N 1 2 236.290 2.228 20 0 BEADLO CC1(C)C[C@@H](O)CCN(c2cc[nH+]cc2F)C1 ZINC000641629488 362558968 /nfs/dbraw/zinc/55/89/68/362558968.db2.gz LQBLQAWVAZAHNC-JTQLQIEISA-N 1 2 238.306 2.208 20 0 BEADLO F[C@]1(c2ccccc2)C[C@@H]1[NH2+]Cc1ccon1 ZINC000634983969 345167105 /nfs/dbraw/zinc/16/71/05/345167105.db2.gz DBIZXFLQCMZFGY-STQMWFEESA-N 1 2 232.258 2.402 20 0 BEADLO CC[C@@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635058370 345232292 /nfs/dbraw/zinc/23/22/92/345232292.db2.gz LAFMLUZIJRCLQR-IJLUTSLNSA-N 1 2 247.342 2.304 20 0 BEADLO CC[C@@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635058370 345232294 /nfs/dbraw/zinc/23/22/94/345232294.db2.gz LAFMLUZIJRCLQR-IJLUTSLNSA-N 1 2 247.342 2.304 20 0 BEADLO CCN(CC)C(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC000635064107 345235051 /nfs/dbraw/zinc/23/50/51/345235051.db2.gz QHMHSQDKZIAXMA-GFCCVEGCSA-N 1 2 237.347 2.339 20 0 BEADLO CCCN(CC1CC1)C(=O)Cc1[nH]cc(CC)[nH+]1 ZINC000635081673 345242273 /nfs/dbraw/zinc/24/22/73/345242273.db2.gz CNXJSVHIKUSZIR-UHFFFAOYSA-N 1 2 249.358 2.163 20 0 BEADLO CC(C)CC[C@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635187988 345267100 /nfs/dbraw/zinc/26/71/00/345267100.db2.gz GDNXSWQVUWLZHY-QJPTWQEYSA-N 1 2 249.358 2.454 20 0 BEADLO CC(C)CC[C@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635187988 345267103 /nfs/dbraw/zinc/26/71/03/345267103.db2.gz GDNXSWQVUWLZHY-QJPTWQEYSA-N 1 2 249.358 2.454 20 0 BEADLO CCc1c[nH]c(CC(=O)N(CC)CC(C)C)[nH+]1 ZINC000635248278 345284750 /nfs/dbraw/zinc/28/47/50/345284750.db2.gz GBUFIYZYIJMUAR-UHFFFAOYSA-N 1 2 237.347 2.019 20 0 BEADLO CCC[C@H](C)N(C)C(=O)Cc1[nH]cc(CC)[nH+]1 ZINC000635277344 345293820 /nfs/dbraw/zinc/29/38/20/345293820.db2.gz GCDTXJIDMDKYJC-JTQLQIEISA-N 1 2 237.347 2.162 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccc(C)s1)C(=O)OC ZINC000168341159 345307163 /nfs/dbraw/zinc/30/71/63/345307163.db2.gz LLGBGXVAUZIKLU-SNVBAGLBSA-N 1 2 227.329 2.098 20 0 BEADLO COc1cccc2c1cc[nH+]c2N[C@@H]1CC[C@H]1O ZINC000425276420 192087843 /nfs/dbraw/zinc/08/78/43/192087843.db2.gz BXVNNCQCOMWZCE-VXGBXAGGSA-N 1 2 244.294 2.179 20 0 BEADLO CC(C)C[C@H](C(=O)Nc1cnoc1)n1cc[nH+]c1 ZINC000635463484 345380710 /nfs/dbraw/zinc/38/07/10/345380710.db2.gz PCCROOZKIKDWLA-LLVKDONJSA-N 1 2 248.286 2.097 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2CCCC3(CC3)CC2)n[nH]1 ZINC000626115129 345328228 /nfs/dbraw/zinc/32/82/28/345328228.db2.gz GTZXFVGDODRBFK-SNVBAGLBSA-N 1 2 234.347 2.440 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2CCCC3(CC3)CC2)n[nH]1 ZINC000626115129 345328232 /nfs/dbraw/zinc/32/82/32/345328232.db2.gz GTZXFVGDODRBFK-SNVBAGLBSA-N 1 2 234.347 2.440 20 0 BEADLO C[C@H]1CCN(C(=O)C2(C)CC2)C[C@H]1n1cc[nH+]c1 ZINC000159092191 345409037 /nfs/dbraw/zinc/40/90/37/345409037.db2.gz YSFIALZLBPAHHM-NWDGAFQWSA-N 1 2 247.342 2.093 20 0 BEADLO C[C@H]1CCN(C(=O)C2(C)CC2)C[C@@H]1n1cc[nH+]c1 ZINC000159091931 345409287 /nfs/dbraw/zinc/40/92/87/345409287.db2.gz YSFIALZLBPAHHM-RYUDHWBXSA-N 1 2 247.342 2.093 20 0 BEADLO COCCCNc1cc[nH+]c(C(C)(C)C)n1 ZINC000080762080 345449371 /nfs/dbraw/zinc/44/93/71/345449371.db2.gz RJYBFFPKNJUPKW-UHFFFAOYSA-N 1 2 223.320 2.223 20 0 BEADLO Cc1noc([C@@H](C)[N@H+](C)Cc2cccc(O)c2)n1 ZINC000080924956 345451507 /nfs/dbraw/zinc/45/15/07/345451507.db2.gz WXLGZECLKWUUGO-SECBINFHSA-N 1 2 247.298 2.277 20 0 BEADLO Cc1noc([C@@H](C)[N@@H+](C)Cc2cccc(O)c2)n1 ZINC000080924956 345451509 /nfs/dbraw/zinc/45/15/09/345451509.db2.gz WXLGZECLKWUUGO-SECBINFHSA-N 1 2 247.298 2.277 20 0 BEADLO C[C@]1(CCNc2cc[nH+]cc2F)CC1(F)F ZINC000641658476 362583531 /nfs/dbraw/zinc/58/35/31/362583531.db2.gz GZOGTTQHRVQMEF-JTQLQIEISA-N 1 2 230.233 2.490 20 0 BEADLO C[C@]1(CNc2cc[nH+]cc2F)CC1(F)F ZINC000641659660 362585501 /nfs/dbraw/zinc/58/55/01/362585501.db2.gz QJGVPUDVAZQPRZ-SECBINFHSA-N 1 2 216.206 2.100 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)C1CCC=CCC1 ZINC000635537742 345501174 /nfs/dbraw/zinc/50/11/74/345501174.db2.gz IERCBMDJJYKCPS-UHFFFAOYSA-N 1 2 233.315 2.115 20 0 BEADLO O=C(N1CCCC[C@H]1c1[nH]cc[nH+]1)C(F)(F)F ZINC000082277986 345501333 /nfs/dbraw/zinc/50/13/33/345501333.db2.gz DTCTZHOGACVLDV-ZETCQYMHSA-N 1 2 247.220 2.026 20 0 BEADLO CC1(C)[C@H](CNc2cc[nH+]cc2F)C1(F)F ZINC000641665898 362587277 /nfs/dbraw/zinc/58/72/77/362587277.db2.gz PTTSRPFTVLXFAY-VIFPVBQESA-N 1 2 230.233 2.346 20 0 BEADLO CC[C@H]1CCCCN1C(=O)[C@H](C)n1cc[nH+]c1 ZINC000053898616 1172061212 /nfs/dbraw/zinc/06/12/12/1172061212.db2.gz AOPTUFZYZGYKKC-RYUDHWBXSA-N 1 2 235.331 2.235 20 0 BEADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1cnccn1 ZINC000080965985 345456265 /nfs/dbraw/zinc/45/62/65/345456265.db2.gz VVCFXSIVPOHTAB-NSHDSACASA-N 1 2 228.299 2.065 20 0 BEADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1cnccn1 ZINC000080965985 345456271 /nfs/dbraw/zinc/45/62/71/345456271.db2.gz VVCFXSIVPOHTAB-NSHDSACASA-N 1 2 228.299 2.065 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CCS[C@H](C)C2)[nH+]1 ZINC000080985993 345458341 /nfs/dbraw/zinc/45/83/41/345458341.db2.gz QEFIOMVTALHWPI-MRVPVSSYSA-N 1 2 248.355 2.208 20 0 BEADLO Cc1nc2[nH]ccc2c(NCC[C@@H](O)C(C)C)[nH+]1 ZINC000081004911 345460998 /nfs/dbraw/zinc/46/09/98/345460998.db2.gz HKARQKPDZISDJU-LLVKDONJSA-N 1 2 248.330 2.085 20 0 BEADLO CC(C)c1noc(C[N@@H+]2CCC23CCC3)n1 ZINC000081545306 345477565 /nfs/dbraw/zinc/47/75/65/345477565.db2.gz WDWZYCMWYUFZHE-UHFFFAOYSA-N 1 2 221.304 2.321 20 0 BEADLO CC(C)c1noc(C[N@H+]2CCC23CCC3)n1 ZINC000081545306 345477567 /nfs/dbraw/zinc/47/75/67/345477567.db2.gz WDWZYCMWYUFZHE-UHFFFAOYSA-N 1 2 221.304 2.321 20 0 BEADLO CN(C[C@@H]1CCOC1)c1cc[nH+]c2ccncc21 ZINC000085689466 345528580 /nfs/dbraw/zinc/52/85/80/345528580.db2.gz HMUQRSDKCBMRBT-NSHDSACASA-N 1 2 243.310 2.103 20 0 BEADLO CO[C@@H]1CCCN(c2cc[nH+]c3ccncc32)C1 ZINC000085681961 345529097 /nfs/dbraw/zinc/52/90/97/345529097.db2.gz VOPIQTPSTABIKP-LLVKDONJSA-N 1 2 243.310 2.245 20 0 BEADLO CC[C@H](CSC)N(C)c1cc(C)[nH+]cn1 ZINC000091022953 345580657 /nfs/dbraw/zinc/58/06/57/345580657.db2.gz OEEHYHPXECQUNJ-SNVBAGLBSA-N 1 2 225.361 2.363 20 0 BEADLO CCN(C(=O)[C@H](C)n1cc[nH+]c1)c1ccccc1 ZINC000053898746 1172062026 /nfs/dbraw/zinc/06/20/26/1172062026.db2.gz YNWSHDCDTKSFFZ-LBPRGKRZSA-N 1 2 243.310 2.497 20 0 BEADLO CC[C@@H](CSC)N(C)c1cc(C)[nH+]cn1 ZINC000091022951 345580950 /nfs/dbraw/zinc/58/09/50/345580950.db2.gz OEEHYHPXECQUNJ-JTQLQIEISA-N 1 2 225.361 2.363 20 0 BEADLO CC[C@H]1CCCCN1C(=O)[C@@H](C)n1cc[nH+]c1 ZINC000053898614 1172062227 /nfs/dbraw/zinc/06/22/27/1172062227.db2.gz AOPTUFZYZGYKKC-NEPJUHHUSA-N 1 2 235.331 2.235 20 0 BEADLO O[C@H]1Cc2ccccc2[C@@H]1Nc1cccc[nH+]1 ZINC000091431378 345593007 /nfs/dbraw/zinc/59/30/07/345593007.db2.gz KCPGJYPLGNYKTA-JSGCOSHPSA-N 1 2 226.279 2.152 20 0 BEADLO Cn1c[nH+]c(CS[C@@H]2COC(C)(C)C2)c1 ZINC000603358629 349932512 /nfs/dbraw/zinc/93/25/12/349932512.db2.gz JQNQDKOQHYYUTF-JTQLQIEISA-N 1 2 226.345 2.221 20 0 BEADLO C[C@]1(C(F)F)CN(c2cc[nH+]cc2F)CCO1 ZINC000641673305 362597914 /nfs/dbraw/zinc/59/79/14/362597914.db2.gz YCLZIFXGAYLTOU-LLVKDONJSA-N 1 2 246.232 2.081 20 0 BEADLO CCc1ncc(C[N@@H+]2CCOC(C)(C)C2)s1 ZINC000091917259 345612300 /nfs/dbraw/zinc/61/23/00/345612300.db2.gz QFUOKGOTTPXVLN-UHFFFAOYSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1ncc(C[N@H+]2CCOC(C)(C)C2)s1 ZINC000091917259 345612302 /nfs/dbraw/zinc/61/23/02/345612302.db2.gz QFUOKGOTTPXVLN-UHFFFAOYSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1ncc(C[N@H+]2CCOC[C@@H]2CC)s1 ZINC000091980163 345613848 /nfs/dbraw/zinc/61/38/48/345613848.db2.gz FQSLATUELYDZAO-JTQLQIEISA-N 1 2 240.372 2.316 20 0 BEADLO CCc1ncc(C[N@@H+]2CCOC[C@@H]2CC)s1 ZINC000091980163 345613852 /nfs/dbraw/zinc/61/38/52/345613852.db2.gz FQSLATUELYDZAO-JTQLQIEISA-N 1 2 240.372 2.316 20 0 BEADLO CCc1ncc(C[N@H+]2CCOC[C@H]2CC)s1 ZINC000091980164 345614024 /nfs/dbraw/zinc/61/40/24/345614024.db2.gz FQSLATUELYDZAO-SNVBAGLBSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1ncc(C[N@@H+]2CCOC[C@H]2CC)s1 ZINC000091980164 345614025 /nfs/dbraw/zinc/61/40/25/345614025.db2.gz FQSLATUELYDZAO-SNVBAGLBSA-N 1 2 240.372 2.316 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1sccc1OC ZINC000091980461 345614028 /nfs/dbraw/zinc/61/40/28/345614028.db2.gz SLYMEUKMHYEIEJ-JTQLQIEISA-N 1 2 241.356 2.368 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1sccc1OC ZINC000091980461 345614030 /nfs/dbraw/zinc/61/40/30/345614030.db2.gz SLYMEUKMHYEIEJ-JTQLQIEISA-N 1 2 241.356 2.368 20 0 BEADLO OC[C@@H]1CCC[N@@H+]1Cc1cc(F)c(F)cc1F ZINC000092456024 345620979 /nfs/dbraw/zinc/62/09/79/345620979.db2.gz XBJGCCJGRYIPCL-VIFPVBQESA-N 1 2 245.244 2.061 20 0 BEADLO OC[C@@H]1CCC[N@H+]1Cc1cc(F)c(F)cc1F ZINC000092456024 345620982 /nfs/dbraw/zinc/62/09/82/345620982.db2.gz XBJGCCJGRYIPCL-VIFPVBQESA-N 1 2 245.244 2.061 20 0 BEADLO CCOC(=O)Cc1ccc(-c2[nH+]ccn2C)cc1 ZINC000260952116 345625910 /nfs/dbraw/zinc/62/59/10/345625910.db2.gz MHHGKODPJGQMNL-UHFFFAOYSA-N 1 2 244.294 2.193 20 0 BEADLO Cc1cc(C)c(NC(=O)[C@H]2CCO[C@H]2C)c(C)[nH+]1 ZINC000092303429 345628685 /nfs/dbraw/zinc/62/86/85/345628685.db2.gz SQDBBTRMFFBRPB-RYUDHWBXSA-N 1 2 248.326 2.370 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2scnc2C)CCO1 ZINC000093508919 345662631 /nfs/dbraw/zinc/66/26/31/345662631.db2.gz LEQNVLZABZJBDR-NSHDSACASA-N 1 2 240.372 2.452 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2scnc2C)CCO1 ZINC000093508919 345662633 /nfs/dbraw/zinc/66/26/33/345662633.db2.gz LEQNVLZABZJBDR-NSHDSACASA-N 1 2 240.372 2.452 20 0 BEADLO CCC[C@H](C[NH2+][C@H](C)C(=O)OC(C)(C)C)OC ZINC000378829353 345640094 /nfs/dbraw/zinc/64/00/94/345640094.db2.gz QZSMCXIDLPMIAY-GHMZBOCLSA-N 1 2 245.363 2.121 20 0 BEADLO CCc1cc(Nc2ccc(N(C)C)[nH+]c2)ncn1 ZINC000603370592 349934952 /nfs/dbraw/zinc/93/49/52/349934952.db2.gz YLMBTUMYQYVCRB-UHFFFAOYSA-N 1 2 243.314 2.244 20 0 BEADLO CCOCCN(C)c1cc(C)[nH+]c(C(C)C)n1 ZINC000092963203 345650041 /nfs/dbraw/zinc/65/00/41/345650041.db2.gz JIEPFKWPJUQEEK-UHFFFAOYSA-N 1 2 237.347 2.381 20 0 BEADLO OCc1cc[nH+]c(NCC[C@H]2CC=CCC2)c1 ZINC000641678407 362600135 /nfs/dbraw/zinc/60/01/35/362600135.db2.gz OWBOQKGROLXXAS-LBPRGKRZSA-N 1 2 232.327 2.154 20 0 BEADLO CCC[C@H](CNc1cc[nH+]cc1F)OCC ZINC000641676433 362602466 /nfs/dbraw/zinc/60/24/66/362602466.db2.gz OZVOBSDZZFDLHH-SNVBAGLBSA-N 1 2 226.295 2.260 20 0 BEADLO Cc1nc(N[C@H](C)C(F)F)c2c([nH+]1)CCCC2 ZINC000641729548 362644430 /nfs/dbraw/zinc/64/44/30/362644430.db2.gz GOTPUPBYTQCMQM-SSDOTTSWSA-N 1 2 241.285 2.151 20 0 BEADLO CC(C)=CCCn1cc[nH+]c1CN1CCOCC1 ZINC000641728633 362648783 /nfs/dbraw/zinc/64/87/83/362648783.db2.gz WWWHMZSYOJARDL-UHFFFAOYSA-N 1 2 249.358 2.072 20 0 BEADLO Cc1cc(N2CCCC2)nc(-c2ccncc2)[nH+]1 ZINC000068873538 349937250 /nfs/dbraw/zinc/93/72/50/349937250.db2.gz UFKMCPSQVJMADA-UHFFFAOYSA-N 1 2 240.310 2.447 20 0 BEADLO Cc1cnc([C@H](C)[NH2+]Cc2ccncc2N)s1 ZINC000641733456 362654904 /nfs/dbraw/zinc/65/49/04/362654904.db2.gz PZAZFRBJXJYISO-VIFPVBQESA-N 1 2 248.355 2.280 20 0 BEADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CC[C@H](O)C1 ZINC000095435348 345686340 /nfs/dbraw/zinc/68/63/40/345686340.db2.gz LIPPDCODHRWWAT-UWVGGRQHSA-N 1 2 238.331 2.100 20 0 BEADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC[C@H](O)C1 ZINC000095435348 345686342 /nfs/dbraw/zinc/68/63/42/345686342.db2.gz LIPPDCODHRWWAT-UWVGGRQHSA-N 1 2 238.331 2.100 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CCCCC[C@H]2C)[nH+]1 ZINC000635568735 345823830 /nfs/dbraw/zinc/82/38/30/345823830.db2.gz JWTUXDPZPNFUAU-LLVKDONJSA-N 1 2 249.358 2.306 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CCCCC[C@@H]2C)[nH+]1 ZINC000635568736 345823853 /nfs/dbraw/zinc/82/38/53/345823853.db2.gz JWTUXDPZPNFUAU-NSHDSACASA-N 1 2 249.358 2.306 20 0 BEADLO CCC(C)(CC)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635560277 345762636 /nfs/dbraw/zinc/76/26/36/345762636.db2.gz YHWAZWBLTZZOSE-NXEZZACHSA-N 1 2 235.331 2.208 20 0 BEADLO CCC(C)(CC)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635560277 345762637 /nfs/dbraw/zinc/76/26/37/345762637.db2.gz YHWAZWBLTZZOSE-NXEZZACHSA-N 1 2 235.331 2.208 20 0 BEADLO Cn1c2cc(F)ccc2[nH]c1=[NH+]C[C@H]1CC12CC2 ZINC000418983248 192090991 /nfs/dbraw/zinc/09/09/91/192090991.db2.gz SXNYHIIXLMAJMC-SECBINFHSA-N 1 2 245.301 2.346 20 0 BEADLO O=C(C1CCC=CCC1)N1CC(n2cc[nH+]c2)C1 ZINC000635564945 345787701 /nfs/dbraw/zinc/78/77/01/345787701.db2.gz JUZCOLYUVPOTHN-UHFFFAOYSA-N 1 2 245.326 2.013 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C1CCCC1 ZINC000635565182 345789889 /nfs/dbraw/zinc/78/98/89/345789889.db2.gz BAJOGWAFEWMJHJ-YUSALJHKSA-N 1 2 247.342 2.208 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C1CCCC1 ZINC000635565182 345789894 /nfs/dbraw/zinc/78/98/94/345789894.db2.gz BAJOGWAFEWMJHJ-YUSALJHKSA-N 1 2 247.342 2.208 20 0 BEADLO Cc1noc(C)c1C[NH2+]Cc1cnc(C2CC2)o1 ZINC000628209061 345801876 /nfs/dbraw/zinc/80/18/76/345801876.db2.gz NITVEEAHFKPZKR-UHFFFAOYSA-N 1 2 247.298 2.447 20 0 BEADLO COc1ccsc1[C@H](C)[NH2+]Cc1cc[nH]n1 ZINC000381427344 345855340 /nfs/dbraw/zinc/85/53/40/345855340.db2.gz ZIJBCPKMUIDXSU-QMMMGPOBSA-N 1 2 237.328 2.331 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CCC[C@H](C)[C@H]2C)[nH+]1 ZINC000635602619 345888266 /nfs/dbraw/zinc/88/82/66/345888266.db2.gz JGFSCIKWUGAZTR-WDEREUQCSA-N 1 2 249.358 2.162 20 0 BEADLO C[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)[C@H]1C ZINC000635604722 345888798 /nfs/dbraw/zinc/88/87/98/345888798.db2.gz WJBSBLZKGIKJGR-WRWGMCAJSA-N 1 2 247.342 2.160 20 0 BEADLO C[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)[C@H]1C ZINC000635604722 345888799 /nfs/dbraw/zinc/88/87/99/345888799.db2.gz WJBSBLZKGIKJGR-WRWGMCAJSA-N 1 2 247.342 2.160 20 0 BEADLO CC[C@H](C)C[C@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635614743 345893736 /nfs/dbraw/zinc/89/37/36/345893736.db2.gz FHJKIRMOGMZQRQ-NNYUYHANSA-N 1 2 249.358 2.454 20 0 BEADLO CC[C@H](C)C[C@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635614743 345893740 /nfs/dbraw/zinc/89/37/40/345893740.db2.gz FHJKIRMOGMZQRQ-NNYUYHANSA-N 1 2 249.358 2.454 20 0 BEADLO C[C@@H]1C[C@H](Nc2cc[nH+]c3ccncc23)[C@H](C)O1 ZINC000631466425 345874340 /nfs/dbraw/zinc/87/43/40/345874340.db2.gz VXISTKQIGCSPLO-BFVZDQMLSA-N 1 2 243.310 2.030 20 0 BEADLO CCc1c[nH]c(CC(=O)N2C[C@@H](C)CC[C@H]2C)[nH+]1 ZINC000635633296 345911842 /nfs/dbraw/zinc/91/18/42/345911842.db2.gz YZTZDUZINKOWNX-WDEREUQCSA-N 1 2 249.358 2.162 20 0 BEADLO CCc1c[nH]c(CC(=O)N[C@@H]2CCCC2(C)C)[nH+]1 ZINC000635654854 345933993 /nfs/dbraw/zinc/93/39/93/345933993.db2.gz KSLBGRVGGJVTIX-LLVKDONJSA-N 1 2 249.358 2.210 20 0 BEADLO CCC1(CNC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)CCC1 ZINC000635659997 345938863 /nfs/dbraw/zinc/93/88/63/345938863.db2.gz CLVHRXHBNCDGJD-GHMZBOCLSA-N 1 2 247.342 2.210 20 0 BEADLO CCC1(CNC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)CCC1 ZINC000635659997 345938866 /nfs/dbraw/zinc/93/88/66/345938866.db2.gz CLVHRXHBNCDGJD-GHMZBOCLSA-N 1 2 247.342 2.210 20 0 BEADLO CC[C@H]1CCC[C@@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635677445 345974706 /nfs/dbraw/zinc/97/47/06/345974706.db2.gz SDPLFVRZRFBFOA-QCNOEVLYSA-N 1 2 247.342 2.208 20 0 BEADLO CC[C@H]1CCC[C@@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635677445 345974708 /nfs/dbraw/zinc/97/47/08/345974708.db2.gz SDPLFVRZRFBFOA-QCNOEVLYSA-N 1 2 247.342 2.208 20 0 BEADLO CC[C@H]1CCC[C@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635677441 345974871 /nfs/dbraw/zinc/97/48/71/345974871.db2.gz SDPLFVRZRFBFOA-IRCOFANPSA-N 1 2 247.342 2.208 20 0 BEADLO CC[C@H]1CCC[C@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635677441 345974874 /nfs/dbraw/zinc/97/48/74/345974874.db2.gz SDPLFVRZRFBFOA-IRCOFANPSA-N 1 2 247.342 2.208 20 0 BEADLO COCCN(c1cc(C)[nH+]cn1)C1CCCC1 ZINC000603385443 349941396 /nfs/dbraw/zinc/94/13/96/349941396.db2.gz HTLBRVXMRLRVMG-UHFFFAOYSA-N 1 2 235.331 2.180 20 0 BEADLO CC(C)(C)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000074859409 345981842 /nfs/dbraw/zinc/98/18/42/345981842.db2.gz UYORRXQYEUIOHU-UHFFFAOYSA-N 1 2 217.272 2.319 20 0 BEADLO CCc1[nH]c(CNC(=O)C2=CCCCC2)c[nH+]1 ZINC001639093239 1172070671 /nfs/dbraw/zinc/07/06/71/1172070671.db2.gz HQWSZOHGWYXFFF-UHFFFAOYSA-N 1 2 233.315 2.089 20 0 BEADLO CCc1[nH]cc(CNC(=O)C2=CCCCC2)[nH+]1 ZINC001639093239 1172070681 /nfs/dbraw/zinc/07/06/81/1172070681.db2.gz HQWSZOHGWYXFFF-UHFFFAOYSA-N 1 2 233.315 2.089 20 0 BEADLO CCN(C#N)CCSc1[nH+]cc2ccccn21 ZINC000601072076 346013250 /nfs/dbraw/zinc/01/32/50/346013250.db2.gz FDSMUCPLIJXZGX-UHFFFAOYSA-N 1 2 246.339 2.229 20 0 BEADLO CCC(=O)c1cccc(NC(=O)[C@@H](C)[NH+](C)C)c1 ZINC000635715080 346026322 /nfs/dbraw/zinc/02/63/22/346026322.db2.gz SJJDWXATRUFLOK-SNVBAGLBSA-N 1 2 248.326 2.168 20 0 BEADLO Cc1cn2ccc(C(=O)NC3(C)CCC3)cc2[nH+]1 ZINC000635733339 346043677 /nfs/dbraw/zinc/04/36/77/346043677.db2.gz LKRUKAVWVPHUSS-UHFFFAOYSA-N 1 2 243.310 2.315 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CC[C@@H](C)[C@@H](C)C2)[nH+]1 ZINC000635752706 346049581 /nfs/dbraw/zinc/04/95/81/346049581.db2.gz MEEHJBSOKNFGIF-MNOVXSKESA-N 1 2 249.358 2.019 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CC[C@H](C)[C@@H]2CC)[nH+]1 ZINC000635816176 346071922 /nfs/dbraw/zinc/07/19/22/346071922.db2.gz LHUFTGRMKMGUAK-JQWIXIFHSA-N 1 2 249.358 2.162 20 0 BEADLO CCc1c[nH]c(CC(=O)NCC(C)(C)CC)[nH+]1 ZINC000635854461 346091239 /nfs/dbraw/zinc/09/12/39/346091239.db2.gz UHTNUKVJKVADGF-UHFFFAOYSA-N 1 2 237.347 2.067 20 0 BEADLO CCc1c[nH]c(CC(=O)NC[C@H]2CC[C@H](C)C2)[nH+]1 ZINC000635882152 346101102 /nfs/dbraw/zinc/10/11/02/346101102.db2.gz SYAGQEQXKXTJNV-QWRGUYRKSA-N 1 2 249.358 2.067 20 0 BEADLO Cc1cn2ccc(C(=O)N[C@H]3CC[C@H]3C)cc2[nH+]1 ZINC000635924917 346116267 /nfs/dbraw/zinc/11/62/67/346116267.db2.gz FNEGRSDGRNDTBT-SKDRFNHKSA-N 1 2 243.310 2.171 20 0 BEADLO C[C@@H](NC(=O)C1CCC=CCC1)c1[nH]cc[nH+]1 ZINC000635952257 346121742 /nfs/dbraw/zinc/12/17/42/346121742.db2.gz PLFUWLZOYHCWJS-SNVBAGLBSA-N 1 2 233.315 2.333 20 0 BEADLO CC(C)=C(C)CC(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000635951514 346121823 /nfs/dbraw/zinc/12/18/23/346121823.db2.gz HLDSKGHJIWICNO-SNVBAGLBSA-N 1 2 221.304 2.333 20 0 BEADLO Cc1cn2ccc(C(=O)N3C[C@@H](C)[C@H]3C)cc2[nH+]1 ZINC000635966536 346125572 /nfs/dbraw/zinc/12/55/72/346125572.db2.gz RBUCDNOEHIHTCG-MWLCHTKSSA-N 1 2 243.310 2.123 20 0 BEADLO CCC1(NC(=O)c2ccn3cc(C)[nH+]c3c2)CC1 ZINC000635978553 346133636 /nfs/dbraw/zinc/13/36/36/346133636.db2.gz QUXGGOWZUZNZOZ-UHFFFAOYSA-N 1 2 243.310 2.315 20 0 BEADLO Cc1cn2ccc(C(=O)NCCCCF)cc2[nH+]1 ZINC000635965595 346135564 /nfs/dbraw/zinc/13/55/64/346135564.db2.gz QUEWQLFNXRBALF-UHFFFAOYSA-N 1 2 249.289 2.122 20 0 BEADLO CC/C=C\CNC(=O)c1ccn2cc(C)[nH+]c2c1 ZINC000635983399 346137073 /nfs/dbraw/zinc/13/70/73/346137073.db2.gz LJVXSTHGLCMUEE-PLNGDYQASA-N 1 2 243.310 2.339 20 0 BEADLO C[C@@H]1CCC(C)(C)N1C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636011569 346152999 /nfs/dbraw/zinc/15/29/99/346152999.db2.gz HLWBHYIVSBOUSX-GMTAPVOTSA-N 1 2 247.342 2.303 20 0 BEADLO C[C@@H]1CCC(C)(C)N1C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636011569 346153000 /nfs/dbraw/zinc/15/30/00/346153000.db2.gz HLWBHYIVSBOUSX-GMTAPVOTSA-N 1 2 247.342 2.303 20 0 BEADLO CC(C)(C)C1CN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000636014407 346155610 /nfs/dbraw/zinc/15/56/10/346155610.db2.gz MYSGHXGJHMOAES-GHMZBOCLSA-N 1 2 247.342 2.018 20 0 BEADLO CC(C)(C)C1CN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000636014407 346155612 /nfs/dbraw/zinc/15/56/12/346155612.db2.gz MYSGHXGJHMOAES-GHMZBOCLSA-N 1 2 247.342 2.018 20 0 BEADLO CC[C@@]1(C)COCCN1Cc1[nH]c(C)c(C)[nH+]1 ZINC000628240660 346203276 /nfs/dbraw/zinc/20/32/76/346203276.db2.gz NXZZMHPODOZMTH-ZDUSSCGKSA-N 1 2 237.347 2.027 20 0 BEADLO c1nc(C2CC2)oc1C[N@@H+]1CCO[C@H](C2CC2)C1 ZINC000628241182 346204140 /nfs/dbraw/zinc/20/41/40/346204140.db2.gz LNYRHTMXEXVOSL-ZDUSSCGKSA-N 1 2 248.326 2.163 20 0 BEADLO c1nc(C2CC2)oc1C[N@H+]1CCO[C@H](C2CC2)C1 ZINC000628241182 346204143 /nfs/dbraw/zinc/20/41/43/346204143.db2.gz LNYRHTMXEXVOSL-ZDUSSCGKSA-N 1 2 248.326 2.163 20 0 BEADLO Cc1ncc(C[NH2+][C@H](C)c2nnc(C(C)C)[nH]2)o1 ZINC000628231549 346184156 /nfs/dbraw/zinc/18/41/56/346184156.db2.gz SJYJXVWSDQHSIL-MRVPVSSYSA-N 1 2 249.318 2.075 20 0 BEADLO Cc1ncc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)o1 ZINC000628235098 346188650 /nfs/dbraw/zinc/18/86/50/346188650.db2.gz YOJCQNBGHOAEFG-LDYMZIIASA-N 1 2 212.268 2.163 20 0 BEADLO Cc1ncc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)o1 ZINC000628235098 346188651 /nfs/dbraw/zinc/18/86/51/346188651.db2.gz YOJCQNBGHOAEFG-LDYMZIIASA-N 1 2 212.268 2.163 20 0 BEADLO Cc1ncc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)o1 ZINC000628235096 346188663 /nfs/dbraw/zinc/18/86/63/346188663.db2.gz YOJCQNBGHOAEFG-KCJUWKMLSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1ncc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)o1 ZINC000628235096 346188664 /nfs/dbraw/zinc/18/86/64/346188664.db2.gz YOJCQNBGHOAEFG-KCJUWKMLSA-N 1 2 212.268 2.163 20 0 BEADLO Fc1cc(Br)cnc1-n1cc[nH+]c1 ZINC000236146213 346197384 /nfs/dbraw/zinc/19/73/84/346197384.db2.gz ABUXOXLMVGRIKH-UHFFFAOYSA-N 1 2 242.051 2.169 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CC[C@@H](CC(F)(F)F)C2)n1 ZINC000628252726 346228689 /nfs/dbraw/zinc/22/86/89/346228689.db2.gz FAKBVTBZMISEQV-VIFPVBQESA-N 1 2 247.264 2.492 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)n1 ZINC000628252726 346228690 /nfs/dbraw/zinc/22/86/90/346228690.db2.gz FAKBVTBZMISEQV-VIFPVBQESA-N 1 2 247.264 2.492 20 0 BEADLO COC(C)(C)C[N@H+](C)Cc1noc(C(C)C)n1 ZINC000531575832 323110320 /nfs/dbraw/zinc/11/03/20/323110320.db2.gz GGNKIAONGMZAJY-UHFFFAOYSA-N 1 2 241.335 2.050 20 0 BEADLO COC(C)(C)C[N@@H+](C)Cc1noc(C(C)C)n1 ZINC000531575832 323110321 /nfs/dbraw/zinc/11/03/21/323110321.db2.gz GGNKIAONGMZAJY-UHFFFAOYSA-N 1 2 241.335 2.050 20 0 BEADLO Cc1cc(CNc2ccc(N(C)C)c[nH+]2)on1 ZINC000631092406 346222134 /nfs/dbraw/zinc/22/21/34/346222134.db2.gz YJQHRKQJRKTTEQ-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO CC[C@H]1CN(Cc2[nH]c(C)c(C)[nH+]2)CCCO1 ZINC000628260734 346260216 /nfs/dbraw/zinc/26/02/16/346260216.db2.gz SKYDPBQYODATQC-LBPRGKRZSA-N 1 2 237.347 2.027 20 0 BEADLO Cc1ncc(C[N@@H+]2CCCC[C@H]2c2cc[nH]n2)o1 ZINC000628271754 346282621 /nfs/dbraw/zinc/28/26/21/346282621.db2.gz ORDXZYYDRMZSSW-ZDUSSCGKSA-N 1 2 246.314 2.433 20 0 BEADLO Cc1ncc(C[N@H+]2CCCC[C@H]2c2cc[nH]n2)o1 ZINC000628271754 346282623 /nfs/dbraw/zinc/28/26/23/346282623.db2.gz ORDXZYYDRMZSSW-ZDUSSCGKSA-N 1 2 246.314 2.433 20 0 BEADLO Cc1c[nH]c(CN(Cc2cccnc2)C2CC2)[nH+]1 ZINC000628280826 346292961 /nfs/dbraw/zinc/29/29/61/346292961.db2.gz KENUVISYXFJQEU-UHFFFAOYSA-N 1 2 242.326 2.278 20 0 BEADLO COCc1ccccc1OCc1c[nH+]cn1C ZINC000419091916 192099897 /nfs/dbraw/zinc/09/98/97/192099897.db2.gz FMPDKBRDVIRSTJ-UHFFFAOYSA-N 1 2 232.283 2.146 20 0 BEADLO Cc1c[nH]c(CN(Cc2ccccn2)C2CC2)[nH+]1 ZINC000628280663 346291255 /nfs/dbraw/zinc/29/12/55/346291255.db2.gz BASIQEBBMLDFMC-UHFFFAOYSA-N 1 2 242.326 2.278 20 0 BEADLO CC(C)=C(C)CC(=O)N[C@@H]1CCn2c[nH+]cc2C1 ZINC000636070449 346310915 /nfs/dbraw/zinc/31/09/15/346310915.db2.gz BGJSRTFABKQSAY-GFCCVEGCSA-N 1 2 247.342 2.061 20 0 BEADLO CCCN(C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C(C)C ZINC000636147977 346334648 /nfs/dbraw/zinc/33/46/48/346334648.db2.gz XFUDZMHBDIWPOW-GHMZBOCLSA-N 1 2 235.331 2.160 20 0 BEADLO CCCN(C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C(C)C ZINC000636147977 346334649 /nfs/dbraw/zinc/33/46/49/346334649.db2.gz XFUDZMHBDIWPOW-GHMZBOCLSA-N 1 2 235.331 2.160 20 0 BEADLO O=C([C@@H]1C[C@H]1c1c[nH+]c[nH]1)N1CCC12CCCC2 ZINC000636121994 346325293 /nfs/dbraw/zinc/32/52/93/346325293.db2.gz ZXXRCLMHHYSIRP-GHMZBOCLSA-N 1 2 245.326 2.058 20 0 BEADLO O=C([C@@H]1C[C@H]1c1c[nH]c[nH+]1)N1CCC12CCCC2 ZINC000636121994 346325295 /nfs/dbraw/zinc/32/52/95/346325295.db2.gz ZXXRCLMHHYSIRP-GHMZBOCLSA-N 1 2 245.326 2.058 20 0 BEADLO CCOC(=O)C[N@H+](CC1=CCCC1)C1CC1 ZINC000401167613 346367177 /nfs/dbraw/zinc/36/71/77/346367177.db2.gz MFZKMYRAQZIPHM-UHFFFAOYSA-N 1 2 223.316 2.124 20 0 BEADLO CCOC(=O)C[N@@H+](CC1=CCCC1)C1CC1 ZINC000401167613 346367180 /nfs/dbraw/zinc/36/71/80/346367180.db2.gz MFZKMYRAQZIPHM-UHFFFAOYSA-N 1 2 223.316 2.124 20 0 BEADLO CC(C)[C@H](NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1)C1CC1 ZINC000636227212 346361090 /nfs/dbraw/zinc/36/10/90/346361090.db2.gz QVUZGACEVFSRRJ-WZRBSPASSA-N 1 2 247.342 2.064 20 0 BEADLO CC(C)[C@H](NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1)C1CC1 ZINC000636227212 346361092 /nfs/dbraw/zinc/36/10/92/346361092.db2.gz QVUZGACEVFSRRJ-WZRBSPASSA-N 1 2 247.342 2.064 20 0 BEADLO Cc1cccc(CCCNc2ncc(F)cn2)[nH+]1 ZINC000286675704 179056077 /nfs/dbraw/zinc/05/60/77/179056077.db2.gz WLKMSPUACLCURZ-UHFFFAOYSA-N 1 2 246.289 2.364 20 0 BEADLO CN(C[C@H]1CC1(C)C)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000636237031 346364679 /nfs/dbraw/zinc/36/46/79/346364679.db2.gz CZFOACVSJYIKQW-GMTAPVOTSA-N 1 2 247.342 2.018 20 0 BEADLO CN(C[C@H]1CC1(C)C)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000636237031 346364680 /nfs/dbraw/zinc/36/46/80/346364680.db2.gz CZFOACVSJYIKQW-GMTAPVOTSA-N 1 2 247.342 2.018 20 0 BEADLO C/C=C/CNC(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC000636284500 346378076 /nfs/dbraw/zinc/37/80/76/346378076.db2.gz BXNHRXRUHAAOED-ITKZLYELSA-N 1 2 235.331 2.163 20 0 BEADLO C/C=C\CNC(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC000636284502 346378163 /nfs/dbraw/zinc/37/81/63/346378163.db2.gz BXNHRXRUHAAOED-RXNFCKPNSA-N 1 2 235.331 2.163 20 0 BEADLO C/C=C\CNC(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC000636284501 346378243 /nfs/dbraw/zinc/37/82/43/346378243.db2.gz BXNHRXRUHAAOED-QMAVJUDZSA-N 1 2 235.331 2.163 20 0 BEADLO CCC[C@H]([NH2+]CC[C@H](C)F)C(=O)OCC ZINC000419166030 192101843 /nfs/dbraw/zinc/10/18/43/192101843.db2.gz BBPCJWMIKACWME-UWVGGRQHSA-N 1 2 219.300 2.056 20 0 BEADLO Cc1nonc1C[N@@H+](C)Cc1cccc(C)c1 ZINC000265157797 179068541 /nfs/dbraw/zinc/06/85/41/179068541.db2.gz VEIRDSBRWWVEAH-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1nonc1C[N@H+](C)Cc1cccc(C)c1 ZINC000265157797 179068544 /nfs/dbraw/zinc/06/85/44/179068544.db2.gz VEIRDSBRWWVEAH-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCCc2nn(C)cc21)C(F)F ZINC000641791285 362730730 /nfs/dbraw/zinc/73/07/30/362730730.db2.gz GGOFRBDPZAWIJA-IONNQARKSA-N 1 2 229.274 2.041 20 0 BEADLO C[C@@H]([NH2+][C@H](C)C(F)F)c1cccc(CO)c1 ZINC000641791600 362731419 /nfs/dbraw/zinc/73/14/19/362731419.db2.gz KXEBQJMKXSDEEX-RKDXNWHRSA-N 1 2 229.270 2.483 20 0 BEADLO C[C@H]([NH2+][C@@H](C)C(F)F)c1cccc(CO)c1 ZINC000641791599 362731714 /nfs/dbraw/zinc/73/17/14/362731714.db2.gz KXEBQJMKXSDEEX-IUCAKERBSA-N 1 2 229.270 2.483 20 0 BEADLO c1cc(NCCOCC2CCC2)nc(C2CC2)[nH+]1 ZINC000580609303 365810845 /nfs/dbraw/zinc/81/08/45/365810845.db2.gz YYWRYNVPEYSXCR-UHFFFAOYSA-N 1 2 247.342 2.005 20 0 BEADLO Cc1ccc2[nH+]c(CN[C@H](C)C(F)F)cn2c1 ZINC000641794219 362733988 /nfs/dbraw/zinc/73/39/88/362733988.db2.gz SHZTVCYZABLAKG-SECBINFHSA-N 1 2 239.269 2.386 20 0 BEADLO C[C@@H](NCc1cccc2[nH+]ccn21)C(F)F ZINC000641794225 362734781 /nfs/dbraw/zinc/73/47/81/362734781.db2.gz SPVBNEADXRZSEV-MRVPVSSYSA-N 1 2 225.242 2.078 20 0 BEADLO Cc1cccc(Cl)c1C[NH+]1CCOCC1 ZINC000296656474 179108299 /nfs/dbraw/zinc/10/82/99/179108299.db2.gz XYRIJBNDISKLRC-UHFFFAOYSA-N 1 2 225.719 2.481 20 0 BEADLO CC[C@H](C[N@H+](CC(F)F)C1CC1)OC ZINC000419207538 192104022 /nfs/dbraw/zinc/10/40/22/192104022.db2.gz PCPUJDRTWAVASU-SECBINFHSA-N 1 2 207.264 2.141 20 0 BEADLO CC[C@H](C[N@@H+](CC(F)F)C1CC1)OC ZINC000419207538 192104024 /nfs/dbraw/zinc/10/40/24/192104024.db2.gz PCPUJDRTWAVASU-SECBINFHSA-N 1 2 207.264 2.141 20 0 BEADLO C[C@@H](CN(C)C(=O)Cn1cc[nH+]c1)C(C)(C)C ZINC000636429778 346529398 /nfs/dbraw/zinc/52/93/98/346529398.db2.gz OGHOTPGANSWVLD-NSHDSACASA-N 1 2 237.347 2.024 20 0 BEADLO COc1cccc(C[N@H+](C)CCN(C)C2CC2)c1 ZINC000186732877 346532880 /nfs/dbraw/zinc/53/28/80/346532880.db2.gz OAPLMORDMDZHTK-UHFFFAOYSA-N 1 2 248.370 2.221 20 0 BEADLO COc1cccc(C[N@@H+](C)CCN(C)C2CC2)c1 ZINC000186732877 346532881 /nfs/dbraw/zinc/53/28/81/346532881.db2.gz OAPLMORDMDZHTK-UHFFFAOYSA-N 1 2 248.370 2.221 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)on1 ZINC000679227231 488322238 /nfs/dbraw/zinc/32/22/38/488322238.db2.gz YENOPGCNZFXNHH-KWQFWETISA-N 1 2 212.268 2.163 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)on1 ZINC000679227231 488322241 /nfs/dbraw/zinc/32/22/41/488322241.db2.gz YENOPGCNZFXNHH-KWQFWETISA-N 1 2 212.268 2.163 20 0 BEADLO Cc1cccc(N(C)Cc2[nH+]ccn2C)c1 ZINC000264143909 179117866 /nfs/dbraw/zinc/11/78/66/179117866.db2.gz UZDYZJWDNDVPKU-UHFFFAOYSA-N 1 2 215.300 2.365 20 0 BEADLO CCCC[C@@H](COC)Nc1cc(C)[nH+]cn1 ZINC000301273673 346579212 /nfs/dbraw/zinc/57/92/12/346579212.db2.gz KZLOKLUKGSAODY-NSHDSACASA-N 1 2 223.320 2.402 20 0 BEADLO Cc1cccc(NC(=O)COc2cc[nH+]cc2)c1 ZINC000356085312 179130009 /nfs/dbraw/zinc/13/00/09/179130009.db2.gz AJRDRIGMWFXXAD-UHFFFAOYSA-N 1 2 242.278 2.408 20 0 BEADLO CO[C@@H](Cn1cc[nH+]c1)c1ccccc1 ZINC000203458112 346633614 /nfs/dbraw/zinc/63/36/14/346633614.db2.gz DLZHOBRHZICOPF-LBPRGKRZSA-N 1 2 202.257 2.271 20 0 BEADLO CC(C)[C@H](O)CNc1cc[nH+]c(C(C)(C)C)n1 ZINC000301577503 187371114 /nfs/dbraw/zinc/37/11/14/187371114.db2.gz MTGAKTJOSOPCHD-SNVBAGLBSA-N 1 2 237.347 2.203 20 0 BEADLO C[C@H]1CCC[C@@H]1CNC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000621993639 370650627 /nfs/dbraw/zinc/65/06/27/370650627.db2.gz PGIWOFKTHSYZES-WDEREUQCSA-N 1 2 249.358 2.240 20 0 BEADLO Cc1cccc(NCc2c[nH+]cn2C)c1 ZINC000085167642 179152181 /nfs/dbraw/zinc/15/21/81/179152181.db2.gz PCCPGKKVSPESDN-UHFFFAOYSA-N 1 2 201.273 2.341 20 0 BEADLO Cc1ccc(NC(=O)Cc2c[nH+]cn2C)c(F)c1 ZINC000188086123 346745631 /nfs/dbraw/zinc/74/56/31/346745631.db2.gz SHUIFUYIPOQWBP-UHFFFAOYSA-N 1 2 247.273 2.049 20 0 BEADLO COc1cc(C)[nH+]c(CS[C@H](C)CCO)c1 ZINC000168878311 346747307 /nfs/dbraw/zinc/74/73/07/346747307.db2.gz IHPGBBGKNYMGDY-SNVBAGLBSA-N 1 2 241.356 2.403 20 0 BEADLO Cc1c[nH+]c(C)nc1NCC1(C(F)(F)F)CC1 ZINC000577191172 365870743 /nfs/dbraw/zinc/87/07/43/365870743.db2.gz CRCLGINYMRMUKS-UHFFFAOYSA-N 1 2 245.248 2.270 20 0 BEADLO CC1(C)CN(c2[nH+]ccc3ccccc32)C[C@H]1O ZINC000387871994 347112791 /nfs/dbraw/zinc/11/27/91/347112791.db2.gz BLVFHYLYYRHYOT-CYBMUJFWSA-N 1 2 242.322 2.442 20 0 BEADLO CCc1nc(C[N@@H+]2CCCO[C@@H](C)C2)cs1 ZINC000170767049 346795692 /nfs/dbraw/zinc/79/56/92/346795692.db2.gz DXKZWQFLRPUZOK-JTQLQIEISA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nc(C[N@H+]2CCCO[C@@H](C)C2)cs1 ZINC000170767049 346795695 /nfs/dbraw/zinc/79/56/95/346795695.db2.gz DXKZWQFLRPUZOK-JTQLQIEISA-N 1 2 240.372 2.316 20 0 BEADLO CC[C@@H](Nc1ccc(OC)nc1)c1[nH+]ccn1C ZINC000183195484 347121054 /nfs/dbraw/zinc/12/10/54/347121054.db2.gz CBADYSLAFBAICA-LLVKDONJSA-N 1 2 246.314 2.387 20 0 BEADLO Cc1nc(C[NH2+]Cc2ccccn2)cs1 ZINC000020253067 347151258 /nfs/dbraw/zinc/15/12/58/347151258.db2.gz NSYZCUVTVLMBAG-UHFFFAOYSA-N 1 2 219.313 2.136 20 0 BEADLO CCC(F)(F)CN[C@H](C)c1[nH+]ccn1C ZINC000624148249 347265334 /nfs/dbraw/zinc/26/53/34/347265334.db2.gz ZDMQICIHZXFLPH-MRVPVSSYSA-N 1 2 217.263 2.116 20 0 BEADLO Cc1cccc([C@H](O)CNc2cc[nH+]c(C)n2)c1 ZINC000132569070 179201878 /nfs/dbraw/zinc/20/18/78/179201878.db2.gz KRUUGGNJGCCJOW-CYBMUJFWSA-N 1 2 243.310 2.239 20 0 BEADLO CO[C@H]([C@@H](C)Nc1cccc[nH+]1)C1CC1 ZINC000388268648 347279509 /nfs/dbraw/zinc/27/95/09/347279509.db2.gz GIFLFTNCMGKECM-BXKDBHETSA-N 1 2 206.289 2.307 20 0 BEADLO Cc1nnsc1C[N@H+](C)Cc1ccoc1 ZINC000581253699 347348651 /nfs/dbraw/zinc/34/86/51/347348651.db2.gz AZCMWBSYDJDGKC-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO Cc1nnsc1C[N@@H+](C)Cc1ccoc1 ZINC000581253699 347348657 /nfs/dbraw/zinc/34/86/57/347348657.db2.gz AZCMWBSYDJDGKC-UHFFFAOYSA-N 1 2 223.301 2.072 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@H](C)[C@H](C)c1ccccc1 ZINC000193097324 347390796 /nfs/dbraw/zinc/39/07/96/347390796.db2.gz GLWJGVMAWUBBFY-QJPTWQEYSA-N 1 2 235.327 2.330 20 0 BEADLO C[C@@H]1CCC[C@@H](C(=O)N(C)Cc2c[nH+]c[nH]2)C1 ZINC000616925596 347457470 /nfs/dbraw/zinc/45/74/70/347457470.db2.gz LABNVZPSQLGYGG-GHMZBOCLSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@@H]1CCC[C@@H](C(=O)N(C)Cc2c[nH]c[nH+]2)C1 ZINC000616925596 347457472 /nfs/dbraw/zinc/45/74/72/347457472.db2.gz LABNVZPSQLGYGG-GHMZBOCLSA-N 1 2 235.331 2.194 20 0 BEADLO Cc1cccc2[nH+]c(CS[C@H](C)CO)cn21 ZINC000079087309 179230124 /nfs/dbraw/zinc/23/01/24/179230124.db2.gz XOVYEHOMGDHIOJ-SNVBAGLBSA-N 1 2 236.340 2.257 20 0 BEADLO CC[C@H](CC(C)C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616921762 347451500 /nfs/dbraw/zinc/45/15/00/347451500.db2.gz BLSVDQNTDHRLOJ-LLVKDONJSA-N 1 2 237.347 2.440 20 0 BEADLO CC[C@H](CC(C)C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616921762 347451501 /nfs/dbraw/zinc/45/15/01/347451501.db2.gz BLSVDQNTDHRLOJ-LLVKDONJSA-N 1 2 237.347 2.440 20 0 BEADLO Cc1cccc2[nH+]c(CS[C@@H](C)CO)cn21 ZINC000079087305 179230599 /nfs/dbraw/zinc/23/05/99/179230599.db2.gz XOVYEHOMGDHIOJ-JTQLQIEISA-N 1 2 236.340 2.257 20 0 BEADLO Cc1ccc(C)c(C(=O)N(C)Cc2c[nH+]c[nH]2)c1 ZINC000616922031 347452414 /nfs/dbraw/zinc/45/24/14/347452414.db2.gz MZQREYVIQPIOFL-UHFFFAOYSA-N 1 2 243.310 2.299 20 0 BEADLO Cc1ccc(C)c(C(=O)N(C)Cc2c[nH]c[nH+]2)c1 ZINC000616922031 347452417 /nfs/dbraw/zinc/45/24/17/347452417.db2.gz MZQREYVIQPIOFL-UHFFFAOYSA-N 1 2 243.310 2.299 20 0 BEADLO Cc1ccc(C(=O)N(C)Cc2c[nH+]c[nH]2)cc1C ZINC000616922084 347452592 /nfs/dbraw/zinc/45/25/92/347452592.db2.gz OTNPLZQBLLYVSY-UHFFFAOYSA-N 1 2 243.310 2.299 20 0 BEADLO Cc1ccc(C(=O)N(C)Cc2c[nH]c[nH+]2)cc1C ZINC000616922084 347452594 /nfs/dbraw/zinc/45/25/94/347452594.db2.gz OTNPLZQBLLYVSY-UHFFFAOYSA-N 1 2 243.310 2.299 20 0 BEADLO Cc1cccc2[nH+]cc(CN(C)CC(F)F)n21 ZINC000352758026 179231211 /nfs/dbraw/zinc/23/12/11/179231211.db2.gz XMADEGSPHJIMJM-UHFFFAOYSA-N 1 2 239.269 2.340 20 0 BEADLO CC(C)C[C@@H](C)CC(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616924381 347454764 /nfs/dbraw/zinc/45/47/64/347454764.db2.gz HINLRUFZINLONZ-LLVKDONJSA-N 1 2 237.347 2.440 20 0 BEADLO CC(C)C[C@@H](C)CC(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616924381 347454770 /nfs/dbraw/zinc/45/47/70/347454770.db2.gz HINLRUFZINLONZ-LLVKDONJSA-N 1 2 237.347 2.440 20 0 BEADLO Cc1nc(C[NH2+]Cc2ccco2)cs1 ZINC000020252768 347435537 /nfs/dbraw/zinc/43/55/37/347435537.db2.gz RXLGGZPFKHOLQD-UHFFFAOYSA-N 1 2 208.286 2.334 20 0 BEADLO O=C(CSC1CC1)Nc1ccc2[nH+]ccn2c1 ZINC000590635493 347483644 /nfs/dbraw/zinc/48/36/44/347483644.db2.gz RWGSKWKDLNFVFT-UHFFFAOYSA-N 1 2 247.323 2.168 20 0 BEADLO Cc1ccccc1-n1cc(C[NH2+][C@H](C)CF)nn1 ZINC000288421270 179240896 /nfs/dbraw/zinc/24/08/96/179240896.db2.gz JURYDXRLWAMPDD-LLVKDONJSA-N 1 2 248.305 2.023 20 0 BEADLO C[C@@H](CNC(=O)c1ccc2[nH+]ccn2c1)C1CC1 ZINC000590669651 347488307 /nfs/dbraw/zinc/48/83/07/347488307.db2.gz AINCUXWNCLPCOA-JTQLQIEISA-N 1 2 243.310 2.110 20 0 BEADLO C[C@@H]1CCC[C@@]1(C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616928695 347495203 /nfs/dbraw/zinc/49/52/03/347495203.db2.gz JEQXZEAIIFMCNJ-ZWNOBZJWSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@@H]1CCC[C@@]1(C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616928695 347495206 /nfs/dbraw/zinc/49/52/06/347495206.db2.gz JEQXZEAIIFMCNJ-ZWNOBZJWSA-N 1 2 235.331 2.194 20 0 BEADLO CC[C@H](C)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000590728995 347497523 /nfs/dbraw/zinc/49/75/23/347497523.db2.gz NXORRQRGTLMKQN-NWDGAFQWSA-N 1 2 235.331 2.093 20 0 BEADLO CC(C)C[C@@H](C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616927350 347458315 /nfs/dbraw/zinc/45/83/15/347458315.db2.gz FZHIXJBQYGIMMA-SNVBAGLBSA-N 1 2 223.320 2.050 20 0 BEADLO CC(C)C[C@@H](C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616927350 347458318 /nfs/dbraw/zinc/45/83/18/347458318.db2.gz FZHIXJBQYGIMMA-SNVBAGLBSA-N 1 2 223.320 2.050 20 0 BEADLO CCc1ccccc1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616926651 347458882 /nfs/dbraw/zinc/45/88/82/347458882.db2.gz KKKJFBHMQIUQFC-UHFFFAOYSA-N 1 2 243.310 2.244 20 0 BEADLO CCc1ccccc1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616926651 347458883 /nfs/dbraw/zinc/45/88/83/347458883.db2.gz KKKJFBHMQIUQFC-UHFFFAOYSA-N 1 2 243.310 2.244 20 0 BEADLO C[C@@H]1CCC[C@@H]1CC(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616927401 347459688 /nfs/dbraw/zinc/45/96/88/347459688.db2.gz IFFCTFKUGGATRA-GHMZBOCLSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@@H]1CCC[C@@H]1CC(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616927401 347459691 /nfs/dbraw/zinc/45/96/91/347459691.db2.gz IFFCTFKUGGATRA-GHMZBOCLSA-N 1 2 235.331 2.194 20 0 BEADLO C[C@H]1CCCC[C@@H]1CC(=O)NCc1[nH+]ccn1C ZINC000590736972 347501645 /nfs/dbraw/zinc/50/16/45/347501645.db2.gz UJESCPBTZKSPBM-NWDGAFQWSA-N 1 2 249.358 2.253 20 0 BEADLO CC[C@H](C)N(CC)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000616975022 347546942 /nfs/dbraw/zinc/54/69/42/347546942.db2.gz XMRVGNNDECIUHB-NWDGAFQWSA-N 1 2 237.347 2.481 20 0 BEADLO CC[C@H]1CCCN1C(=O)CCCn1cc[nH+]c1 ZINC000591201095 347629869 /nfs/dbraw/zinc/62/98/69/347629869.db2.gz AYXMNMSRQZURRV-LBPRGKRZSA-N 1 2 235.331 2.064 20 0 BEADLO CCCC[C@H]([NH2+][C@H](C)[C@H]1CC1(F)F)C(=O)OC ZINC000591377446 347650972 /nfs/dbraw/zinc/65/09/72/347650972.db2.gz ZXADOXVWHZPTQV-BBBLOLIVSA-N 1 2 249.301 2.352 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)C(=O)OC(C)(C)C)[C@H]1CC1(F)F ZINC000591377424 347651227 /nfs/dbraw/zinc/65/12/27/347651227.db2.gz STFMTYROAOFJJK-HRDYMLBCSA-N 1 2 249.301 2.350 20 0 BEADLO C[C@H]([NH2+][C@@H](C)[C@H]1CC1(F)F)C(=O)OC(C)(C)C ZINC000591377426 347651356 /nfs/dbraw/zinc/65/13/56/347651356.db2.gz STFMTYROAOFJJK-XHNCKOQMSA-N 1 2 249.301 2.350 20 0 BEADLO C[C@@H]1C[C@@H]1C(=O)NCCCCNc1cccc[nH+]1 ZINC000591063052 347612715 /nfs/dbraw/zinc/61/27/15/347612715.db2.gz HNKHFMUTWRTGIX-NEPJUHHUSA-N 1 2 247.342 2.046 20 0 BEADLO C[C@H]1C[C@H]1C(=O)NCCCCNc1cccc[nH+]1 ZINC000591063057 347612721 /nfs/dbraw/zinc/61/27/21/347612721.db2.gz HNKHFMUTWRTGIX-NWDGAFQWSA-N 1 2 247.342 2.046 20 0 BEADLO Cc1nc(F)ccc1C[N@@H+]1CCC[C@@H]1CF ZINC000294036680 323152193 /nfs/dbraw/zinc/15/21/93/323152193.db2.gz OOIBIXNMHMODFM-LLVKDONJSA-N 1 2 226.270 2.463 20 0 BEADLO Cc1nc(F)ccc1C[N@H+]1CCC[C@@H]1CF ZINC000294036680 323152194 /nfs/dbraw/zinc/15/21/94/323152194.db2.gz OOIBIXNMHMODFM-LLVKDONJSA-N 1 2 226.270 2.463 20 0 BEADLO Cc1ccccc1C[N@@H+]1CCn2cnnc2[C@H]1C ZINC000276737030 179276543 /nfs/dbraw/zinc/27/65/43/179276543.db2.gz CLFHIRHPHHCMGW-GFCCVEGCSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1ccccc1C[N@H+]1CCn2cnnc2[C@H]1C ZINC000276737030 179276545 /nfs/dbraw/zinc/27/65/45/179276545.db2.gz CLFHIRHPHHCMGW-GFCCVEGCSA-N 1 2 242.326 2.163 20 0 BEADLO CCO[C@@H]1C[C@@H](Nc2cccc[nH+]2)[C@@H]1SC ZINC000591990601 347720957 /nfs/dbraw/zinc/72/09/57/347720957.db2.gz KBNQHLOAQCFRFL-FOGDFJRCSA-N 1 2 238.356 2.403 20 0 BEADLO CC[N@H+](CCSC)CC(=O)OC(C)(C)C ZINC000592198416 347750912 /nfs/dbraw/zinc/75/09/12/347750912.db2.gz IVOCLTZTBOKOFF-UHFFFAOYSA-N 1 2 233.377 2.013 20 0 BEADLO CC[N@@H+](CCSC)CC(=O)OC(C)(C)C ZINC000592198416 347750915 /nfs/dbraw/zinc/75/09/15/347750915.db2.gz IVOCLTZTBOKOFF-UHFFFAOYSA-N 1 2 233.377 2.013 20 0 BEADLO CSCCC[N@@H+]1CCCC(F)(F)C1 ZINC000593049717 347846038 /nfs/dbraw/zinc/84/60/38/347846038.db2.gz QUZFSZDBGUGBSM-UHFFFAOYSA-N 1 2 209.305 2.471 20 0 BEADLO CSCCC[N@H+]1CCCC(F)(F)C1 ZINC000593049717 347846041 /nfs/dbraw/zinc/84/60/41/347846041.db2.gz QUZFSZDBGUGBSM-UHFFFAOYSA-N 1 2 209.305 2.471 20 0 BEADLO Cc1ccccc1NC(=O)CCc1c[nH+]cn1C ZINC000188388477 179298292 /nfs/dbraw/zinc/29/82/92/179298292.db2.gz GQHVCKKXAZUUSR-UHFFFAOYSA-N 1 2 243.310 2.300 20 0 BEADLO CC(C)(O)CCOc1cccc(-n2cc[nH+]c2)c1 ZINC000361417849 187381918 /nfs/dbraw/zinc/38/19/18/187381918.db2.gz YWDIKKLSLRZDIN-UHFFFAOYSA-N 1 2 246.310 2.412 20 0 BEADLO Cc1nc(N(CCO)CC2CCCCC2)cc[nH+]1 ZINC000362694456 187383129 /nfs/dbraw/zinc/38/31/29/187383129.db2.gz OSJYAXKUPHUMJJ-UHFFFAOYSA-N 1 2 249.358 2.164 20 0 BEADLO Cc1nc(NC[C@@H]2C[C@H]2C2CCC2)cc[nH+]1 ZINC000425282831 192372021 /nfs/dbraw/zinc/37/20/21/192372021.db2.gz ODYJUUFFMVAPIX-RYUDHWBXSA-N 1 2 217.316 2.055 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+]1CCc2cc(C)ccc2C1 ZINC000361850590 187383402 /nfs/dbraw/zinc/38/34/02/187383402.db2.gz RNTHOZJZEMJHMR-GFCCVEGCSA-N 1 2 247.338 2.305 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+]1CCc2cc(C)ccc2C1 ZINC000361850590 187383404 /nfs/dbraw/zinc/38/34/04/187383404.db2.gz RNTHOZJZEMJHMR-GFCCVEGCSA-N 1 2 247.338 2.305 20 0 BEADLO Cc1ccccc1[C@H](C)[N@H+](C)Cc1ncnn1C ZINC000267445312 179334944 /nfs/dbraw/zinc/33/49/44/179334944.db2.gz ZPEORBMKTPCYCZ-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1ccccc1[C@H](C)[N@@H+](C)Cc1ncnn1C ZINC000267445312 179334946 /nfs/dbraw/zinc/33/49/46/179334946.db2.gz ZPEORBMKTPCYCZ-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO c1nc(C[NH2+]CC2=Cc3ccccc3OC2)co1 ZINC000594060983 347996540 /nfs/dbraw/zinc/99/65/40/347996540.db2.gz GODBUNUEMSBAFH-UHFFFAOYSA-N 1 2 242.278 2.240 20 0 BEADLO Cc1cccn2cc(CS[C@@H](C)CO)[nH+]c12 ZINC000079092713 179355910 /nfs/dbraw/zinc/35/59/10/179355910.db2.gz OIXGCGJQEHUXEY-JTQLQIEISA-N 1 2 236.340 2.257 20 0 BEADLO CCSCCNc1cc2cc[nH]c2c[nH+]1 ZINC000594609422 348081635 /nfs/dbraw/zinc/08/16/35/348081635.db2.gz XEDUDPGDJYTILQ-UHFFFAOYSA-N 1 2 221.329 2.150 20 0 BEADLO C[C@@H](CSCCF)[NH2+]C1(C(F)F)CC1 ZINC000595037578 348176477 /nfs/dbraw/zinc/17/64/77/348176477.db2.gz BOSSQEWENPARNG-ZETCQYMHSA-N 1 2 227.295 2.465 20 0 BEADLO COC(=O)[C@@H]1C[C@@H]1[C@H](C)Nc1ccc(C)[nH+]c1C ZINC000594949460 348147339 /nfs/dbraw/zinc/14/73/39/348147339.db2.gz DUKSRQQTZMRXSD-MVWJERBFSA-N 1 2 248.326 2.308 20 0 BEADLO CC(C)c1nc(N2CCC[C@@](C)(O)CC2)cc[nH+]1 ZINC000376114794 187388914 /nfs/dbraw/zinc/38/89/14/187388914.db2.gz NXEPADZQWXABTN-CQSZACIVSA-N 1 2 249.358 2.341 20 0 BEADLO CC(C)(C)OC(=O)C[NH+]1CCC(C(F)F)CC1 ZINC000312982348 187392283 /nfs/dbraw/zinc/39/22/83/187392283.db2.gz TVLDYCYIMYJDRR-UHFFFAOYSA-N 1 2 249.301 2.305 20 0 BEADLO CCc1nnc([C@H](C)[N@H+](CC)CCSC)[nH]1 ZINC000595570908 348284644 /nfs/dbraw/zinc/28/46/44/348284644.db2.gz ZWTGZSPLFCHRQS-VIFPVBQESA-N 1 2 242.392 2.113 20 0 BEADLO CCc1nnc([C@H](C)[N@@H+](CC)CCSC)[nH]1 ZINC000595570908 348284645 /nfs/dbraw/zinc/28/46/45/348284645.db2.gz ZWTGZSPLFCHRQS-VIFPVBQESA-N 1 2 242.392 2.113 20 0 BEADLO Cc1cccnc1C[NH2+]Cc1cscn1 ZINC000082425376 179383178 /nfs/dbraw/zinc/38/31/78/179383178.db2.gz JGHOJNSSJIZYDS-UHFFFAOYSA-N 1 2 219.313 2.136 20 0 BEADLO CCCCC[NH2+][C@@](C)(CCF)C(=O)OC ZINC000595768853 348335567 /nfs/dbraw/zinc/33/55/67/348335567.db2.gz HQLWPFPMZSIDNO-NSHDSACASA-N 1 2 219.300 2.058 20 0 BEADLO COC(=O)[C@](C)(CCF)[NH2+]CCCC(C)C ZINC000595773888 348337425 /nfs/dbraw/zinc/33/74/25/348337425.db2.gz FURNTUAHXOZARY-LBPRGKRZSA-N 1 2 233.327 2.304 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)C2(C)CCC2)[nH+]1 ZINC001639428285 1172104057 /nfs/dbraw/zinc/10/40/57/1172104057.db2.gz ZZWDGYLAGKIYDM-UHFFFAOYSA-N 1 2 235.331 2.340 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)C2(C)CCC2)c[nH+]1 ZINC001639428285 1172104061 /nfs/dbraw/zinc/10/40/61/1172104061.db2.gz ZZWDGYLAGKIYDM-UHFFFAOYSA-N 1 2 235.331 2.340 20 0 BEADLO COC(=O)Cc1cc[nH+]c(NCC2CCCC2)c1 ZINC000596076407 348438660 /nfs/dbraw/zinc/43/86/60/348438660.db2.gz QKBOFRUFRWSOIV-UHFFFAOYSA-N 1 2 248.326 2.399 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N2C[C@@H](C)C[C@@H]2C)c1 ZINC000596135721 348447692 /nfs/dbraw/zinc/44/76/92/348447692.db2.gz KONAETDSASDBJX-QWRGUYRKSA-N 1 2 248.326 2.032 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N(C)CCC2CC2)c1 ZINC000596169355 348460692 /nfs/dbraw/zinc/46/06/92/348460692.db2.gz HVEWIXQQWFJBRI-UHFFFAOYSA-N 1 2 248.326 2.033 20 0 BEADLO Cc1nn(C)cc1CNc1c[nH+]ccc1C ZINC000119235005 179495900 /nfs/dbraw/zinc/49/59/00/179495900.db2.gz APTDPYBYNHTIIL-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO Cc1nc(C[N@@H+]([C@@H](C)C2CC2)C2CC2)no1 ZINC000051881574 323191786 /nfs/dbraw/zinc/19/17/86/323191786.db2.gz YPOGCEOSORSZMV-QMMMGPOBSA-N 1 2 221.304 2.141 20 0 BEADLO Cc1nc(C[N@H+]([C@@H](C)C2CC2)C2CC2)no1 ZINC000051881574 323191787 /nfs/dbraw/zinc/19/17/87/323191787.db2.gz YPOGCEOSORSZMV-QMMMGPOBSA-N 1 2 221.304 2.141 20 0 BEADLO CC1=CC[N@H+](Cc2nnc(C3CC3)o2)CC1 ZINC000535970466 323194767 /nfs/dbraw/zinc/19/47/67/323194767.db2.gz WXFUJTXPAHGYOK-UHFFFAOYSA-N 1 2 219.288 2.099 20 0 BEADLO CC1=CC[N@@H+](Cc2nnc(C3CC3)o2)CC1 ZINC000535970466 323194768 /nfs/dbraw/zinc/19/47/68/323194768.db2.gz WXFUJTXPAHGYOK-UHFFFAOYSA-N 1 2 219.288 2.099 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+][C@H](CO)c2ccccc2)o1 ZINC000359614120 179648854 /nfs/dbraw/zinc/64/88/54/179648854.db2.gz YAPUFSWYYGJWIG-DGCLKSJQSA-N 1 2 246.310 2.367 20 0 BEADLO Cc1cnccc1SCCn1cc[nH+]c1 ZINC000292646443 179713623 /nfs/dbraw/zinc/71/36/23/179713623.db2.gz CAPIAJVGFNYKIL-UHFFFAOYSA-N 1 2 219.313 2.379 20 0 BEADLO CCCc1ccc(C[N@H+](C)CC(=O)OC)s1 ZINC000598679190 349021297 /nfs/dbraw/zinc/02/12/97/349021297.db2.gz QLVJNENJWJZXSV-UHFFFAOYSA-N 1 2 241.356 2.305 20 0 BEADLO CCCc1ccc(C[N@@H+](C)CC(=O)OC)s1 ZINC000598679190 349021298 /nfs/dbraw/zinc/02/12/98/349021298.db2.gz QLVJNENJWJZXSV-UHFFFAOYSA-N 1 2 241.356 2.305 20 0 BEADLO CC(C)OC(=O)CC[N@H+](CC(F)F)C(C)C ZINC000135406610 349068715 /nfs/dbraw/zinc/06/87/15/349068715.db2.gz KJDGVZFMCJQSPH-UHFFFAOYSA-N 1 2 237.290 2.304 20 0 BEADLO CC(C)OC(=O)CC[N@@H+](CC(F)F)C(C)C ZINC000135406610 349068718 /nfs/dbraw/zinc/06/87/18/349068718.db2.gz KJDGVZFMCJQSPH-UHFFFAOYSA-N 1 2 237.290 2.304 20 0 BEADLO Nc1ccc(NC(=O)[C@H]2[C@@H]3CCCC[C@@H]32)c[nH+]1 ZINC000250082446 349166278 /nfs/dbraw/zinc/16/62/78/349166278.db2.gz JLXRNFAVDSHOBD-IAZYJMLFSA-N 1 2 231.299 2.039 20 0 BEADLO CCC[N@@H+]1CCc2occc2[C@@H]1C(=O)OCC ZINC000599549697 349215168 /nfs/dbraw/zinc/21/51/68/349215168.db2.gz YVGZCHMUZYNHQW-GFCCVEGCSA-N 1 2 237.299 2.152 20 0 BEADLO CCC[N@H+]1CCc2occc2[C@@H]1C(=O)OCC ZINC000599549697 349215173 /nfs/dbraw/zinc/21/51/73/349215173.db2.gz YVGZCHMUZYNHQW-GFCCVEGCSA-N 1 2 237.299 2.152 20 0 BEADLO COC(=O)c1ccoc1C[N@H+](C)Cc1ccco1 ZINC000055255646 349275615 /nfs/dbraw/zinc/27/56/15/349275615.db2.gz GQBPQQWFUGTMTE-UHFFFAOYSA-N 1 2 249.266 2.291 20 0 BEADLO COC(=O)c1ccoc1C[N@@H+](C)Cc1ccco1 ZINC000055255646 349275620 /nfs/dbraw/zinc/27/56/20/349275620.db2.gz GQBPQQWFUGTMTE-UHFFFAOYSA-N 1 2 249.266 2.291 20 0 BEADLO Cc1ccc(NC(=O)CCC(C)(C)O)c(C)[nH+]1 ZINC000583476599 349283096 /nfs/dbraw/zinc/28/30/96/349283096.db2.gz KRUSXTKXTJVHCP-UHFFFAOYSA-N 1 2 236.315 2.188 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)c1ccoc1 ZINC000603786098 350025475 /nfs/dbraw/zinc/02/54/75/350025475.db2.gz OYTUEXWLCXLKCV-UHFFFAOYSA-N 1 2 227.223 2.180 20 0 BEADLO CCC1(CC)C[NH+](Cc2nc(C)c[nH]2)C1 ZINC000628306093 350113658 /nfs/dbraw/zinc/11/36/58/350113658.db2.gz LZYPNVVDAPDUFP-UHFFFAOYSA-N 1 2 207.321 2.340 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@H]2CC2(C)C)[nH+]1 ZINC000309686943 180025668 /nfs/dbraw/zinc/02/56/68/180025668.db2.gz HRCBEJCOFDDKGP-VIFPVBQESA-N 1 2 216.288 2.477 20 0 BEADLO Cc1nc(SCCn2cc[nH+]c2)[nH]c1C ZINC000292649574 180031601 /nfs/dbraw/zinc/03/16/01/180031601.db2.gz MLPHGJADUFKNHY-UHFFFAOYSA-N 1 2 222.317 2.015 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2CCS[C@H](C)CC2)no1 ZINC000336394946 180034838 /nfs/dbraw/zinc/03/48/38/180034838.db2.gz JQSCORQYDYVSAH-RKDXNWHRSA-N 1 2 241.360 2.266 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2CCS[C@H](C)CC2)no1 ZINC000336394946 180034840 /nfs/dbraw/zinc/03/48/40/180034840.db2.gz JQSCORQYDYVSAH-RKDXNWHRSA-N 1 2 241.360 2.266 20 0 BEADLO Cc1nc(NCC2(C)COC2)c2c([nH+]1)CCCC2 ZINC000272865860 180067264 /nfs/dbraw/zinc/06/72/64/180067264.db2.gz MYPPJZXOVLRARB-UHFFFAOYSA-N 1 2 247.342 2.112 20 0 BEADLO Cc1nc(N[C@@H](C)[C@H](C)CO)c2c([nH+]1)CCCC2 ZINC000272822246 180069783 /nfs/dbraw/zinc/06/97/83/180069783.db2.gz FJPQYYJRNXWPEQ-ZJUUUORDSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1nc(NC[C@@H](O)C(C)C)c2c([nH+]1)CCCC2 ZINC000272849728 180069928 /nfs/dbraw/zinc/06/99/28/180069928.db2.gz KDNOCWQIIHUSRM-CYBMUJFWSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1[nH]c(C(=O)NCC=Cc2ccccc2)c[nH+]1 ZINC000339237418 180128843 /nfs/dbraw/zinc/12/88/43/180128843.db2.gz XFHUWTPHXUDPMD-VMPITWQZSA-N 1 2 241.294 2.161 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)C[C@@H]1C=CCCC1 ZINC000427011320 191050525 /nfs/dbraw/zinc/05/05/25/191050525.db2.gz FAONAUHLDCIYCZ-LLVKDONJSA-N 1 2 233.315 2.115 20 0 BEADLO Cc1[nH]c(C(=O)NCc2cccc(Cl)c2)c[nH+]1 ZINC000336508218 180131447 /nfs/dbraw/zinc/13/14/47/180131447.db2.gz FWEBAPZRTVBFPC-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2cccnc2N)s1 ZINC000290051913 180140418 /nfs/dbraw/zinc/14/04/18/180140418.db2.gz OSTLLHSEBNFTSI-UHFFFAOYSA-N 1 2 248.355 2.061 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2cccnc2N)s1 ZINC000290051913 180140422 /nfs/dbraw/zinc/14/04/22/180140422.db2.gz OSTLLHSEBNFTSI-UHFFFAOYSA-N 1 2 248.355 2.061 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C1=CC[C@@H](C)CC1 ZINC000336287237 180119143 /nfs/dbraw/zinc/11/91/43/180119143.db2.gz RAGBPZXJMQNJSQ-SECBINFHSA-N 1 2 233.315 2.081 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@H](C)CC(C)(C)C ZINC000356741318 180119361 /nfs/dbraw/zinc/11/93/61/180119361.db2.gz RCWJFRJFTIGDDW-SECBINFHSA-N 1 2 237.347 2.407 20 0 BEADLO Cc1ncc(C[NH2+][C@@H]2C[C@H](C)n3ccnc32)s1 ZINC000294133884 180156497 /nfs/dbraw/zinc/15/64/97/180156497.db2.gz OSHQIOAGMVNYGG-GZMMTYOYSA-N 1 2 248.355 2.444 20 0 BEADLO CCC(O)(CC)CNc1cc(C)[nH+]c(C2CC2)n1 ZINC000604756886 350187879 /nfs/dbraw/zinc/18/78/79/350187879.db2.gz PPOHARWLDSHBSU-UHFFFAOYSA-N 1 2 249.358 2.047 20 0 BEADLO Cc1nc(N2C[C@@H]3CCC[C@@H]3C2)cc[nH+]1 ZINC000129088089 180195210 /nfs/dbraw/zinc/19/52/10/180195210.db2.gz KEKABRWHWKVDMK-PHIMTYICSA-N 1 2 203.289 2.021 20 0 BEADLO Cc1nc(N2CCS[C@H](C)CC2)cc[nH+]1 ZINC000191846782 180195242 /nfs/dbraw/zinc/19/52/42/180195242.db2.gz GXLNECRNASSAOT-SECBINFHSA-N 1 2 223.345 2.117 20 0 BEADLO Cc1nc(NCCC(C)(F)F)cc[nH+]1 ZINC000307654355 180199287 /nfs/dbraw/zinc/19/92/87/180199287.db2.gz VMVAPNJNAAAXAT-UHFFFAOYSA-N 1 2 201.220 2.242 20 0 BEADLO Cc1nc(NCC2CC(F)(F)C2)cc[nH+]1 ZINC000291970651 180199348 /nfs/dbraw/zinc/19/93/48/180199348.db2.gz WAVWVJJZEQWAQB-UHFFFAOYSA-N 1 2 213.231 2.242 20 0 BEADLO Cc1nc(NC[C@H]2COc3ccccc32)cc[nH+]1 ZINC000289084276 180200171 /nfs/dbraw/zinc/20/01/71/180200171.db2.gz OHTYIHFEGIQAIK-NSHDSACASA-N 1 2 241.294 2.373 20 0 BEADLO Cc1nc(NC[C@@H]2CCO[C@H](C)C2)cc[nH+]1 ZINC000271289125 180200875 /nfs/dbraw/zinc/20/08/75/180200875.db2.gz DQVIAQAFVXWGHI-MWLCHTKSSA-N 1 2 221.304 2.012 20 0 BEADLO Cc1nc(NC[C@H](CO)C2CCCCC2)cc[nH+]1 ZINC000292751699 180201013 /nfs/dbraw/zinc/20/10/13/180201013.db2.gz JPRVCLWEKJCPTA-CYBMUJFWSA-N 1 2 249.358 2.386 20 0 BEADLO Cc1nc(N[C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)cc[nH+]1 ZINC000361118372 180205381 /nfs/dbraw/zinc/20/53/81/180205381.db2.gz UWPITSMUEXIING-RTXFEEFZSA-N 1 2 247.342 2.401 20 0 BEADLO Cc1nc(NCCC2C[C@@H](C)O[C@H](C)C2)cc[nH+]1 ZINC000338485178 180180582 /nfs/dbraw/zinc/18/05/82/180180582.db2.gz QTDRDWCXHKAWBO-GHMZBOCLSA-N 1 2 249.358 2.213 20 0 BEADLO Cc1nc(NCc2cccc3cc[nH]c32)cc[nH+]1 ZINC000341433538 180181913 /nfs/dbraw/zinc/18/19/13/180181913.db2.gz JKAFTRNJHDCYMQ-UHFFFAOYSA-N 1 2 238.294 2.300 20 0 BEADLO Cc1[nH+]cccc1N[C@H](C)[C@H]1CCOC1 ZINC000162943023 180227295 /nfs/dbraw/zinc/22/72/95/180227295.db2.gz ZELGWWHZOVPTLK-KOLCDFICSA-N 1 2 206.289 2.227 20 0 BEADLO CC1(O)C[NH+](Cc2ccc(C(F)F)cc2)C1 ZINC000639254156 490394032 /nfs/dbraw/zinc/39/40/32/490394032.db2.gz ZTKHXYVMTGVGHJ-UHFFFAOYSA-N 1 2 227.254 2.191 20 0 BEADLO CCC1(CNc2c[nH]c[nH+]2)CCOCC1 ZINC000309249902 350234832 /nfs/dbraw/zinc/23/48/32/350234832.db2.gz ZWXOMNBOZUTBIA-UHFFFAOYSA-N 1 2 209.293 2.028 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@@H](C)c2cccnc2)ncn1 ZINC000428311306 191082413 /nfs/dbraw/zinc/08/24/13/191082413.db2.gz QLCVGUKOYLNYLM-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cc(C[N@H+](C)[C@@H](C)c2cccnc2)ncn1 ZINC000428311306 191082414 /nfs/dbraw/zinc/08/24/14/191082414.db2.gz QLCVGUKOYLNYLM-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO CCOC[C@H](C)[NH2+][C@H](CC)C(=O)OC(C)(C)C ZINC000571676643 323323983 /nfs/dbraw/zinc/32/39/83/323323983.db2.gz GJZOCKZYDZXSFF-WDEREUQCSA-N 1 2 245.363 2.121 20 0 BEADLO CC(C)C1CCC([NH2+]Cc2ncn[nH]2)CC1 ZINC000054556192 1172125027 /nfs/dbraw/zinc/12/50/27/1172125027.db2.gz VQWNRIWDRSWWHN-UHFFFAOYSA-N 1 2 222.336 2.109 20 0 BEADLO O=C(N[C@@]12C[C@@H]1CCC2)c1ccc2[nH+]ccn2c1 ZINC000617206289 350352145 /nfs/dbraw/zinc/35/21/45/350352145.db2.gz GGWWLNYIZJJPND-FZMZJTMJSA-N 1 2 241.294 2.007 20 0 BEADLO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2ccon2)cn1 ZINC000427857142 191096339 /nfs/dbraw/zinc/09/63/39/191096339.db2.gz PQLRGAVDYATPDM-UWVGGRQHSA-N 1 2 232.287 2.185 20 0 BEADLO CC(C)CNC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606582969 350373231 /nfs/dbraw/zinc/37/32/31/350373231.db2.gz KICXGXKEFFJUQE-UHFFFAOYSA-N 1 2 232.287 2.112 20 0 BEADLO C[C@@H](NC(=O)Nc1ccc2[nH+]ccn2c1)C1CC1 ZINC000606581624 350373416 /nfs/dbraw/zinc/37/34/16/350373416.db2.gz KRYZCWGVSYJGEE-SECBINFHSA-N 1 2 244.298 2.254 20 0 BEADLO C[C@H]1C[C@@H]1CNC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606581124 350374324 /nfs/dbraw/zinc/37/43/24/350374324.db2.gz RCLJKWHTEDMKEO-VHSXEESVSA-N 1 2 244.298 2.112 20 0 BEADLO Cc1ncsc1C[N@H+]1C[C@@H](C)OC[C@@H]1C ZINC000092018260 180318413 /nfs/dbraw/zinc/31/84/13/180318413.db2.gz VVFSMJUMUCLYKZ-DTWKUNHWSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ncsc1C[N@@H+]1C[C@@H](C)OC[C@@H]1C ZINC000092018260 180318415 /nfs/dbraw/zinc/31/84/15/180318415.db2.gz VVFSMJUMUCLYKZ-DTWKUNHWSA-N 1 2 226.345 2.061 20 0 BEADLO CCCCOCCNc1cc(CC)[nH+]cn1 ZINC000040765236 350395482 /nfs/dbraw/zinc/39/54/82/350395482.db2.gz HCIHLEXWCMYGON-UHFFFAOYSA-N 1 2 223.320 2.268 20 0 BEADLO CCc1cc(NCc2nccs2)nc[nH+]1 ZINC000041013142 350403526 /nfs/dbraw/zinc/40/35/26/350403526.db2.gz ROWWVPCPSPNXLU-UHFFFAOYSA-N 1 2 220.301 2.108 20 0 BEADLO CCc1cc(NCc2csc(C)n2)nc[nH+]1 ZINC000041011097 350403552 /nfs/dbraw/zinc/40/35/52/350403552.db2.gz LYNLIHKLEXSHTQ-UHFFFAOYSA-N 1 2 234.328 2.416 20 0 BEADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2cc[nH]n2)o1 ZINC000041014033 350403558 /nfs/dbraw/zinc/40/35/58/350403558.db2.gz UKPUPEWLYHCFKX-JOYOIKCWSA-N 1 2 231.299 2.416 20 0 BEADLO c1cc(C[NH2+]Cc2cc3ccccc3o2)n[nH]1 ZINC000041014640 350404166 /nfs/dbraw/zinc/40/41/66/350404166.db2.gz SOCRKSAYVCWKKG-UHFFFAOYSA-N 1 2 227.267 2.446 20 0 BEADLO O=C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1cccnc1 ZINC000054600940 1172127715 /nfs/dbraw/zinc/12/77/15/1172127715.db2.gz VKUSYBCHUUTDPD-BETUJISGSA-N 1 2 230.311 2.168 20 0 BEADLO O=C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1cccnc1 ZINC000054600940 1172127721 /nfs/dbraw/zinc/12/77/21/1172127721.db2.gz VKUSYBCHUUTDPD-BETUJISGSA-N 1 2 230.311 2.168 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C1=C(C)OCCC1 ZINC000132360780 191101796 /nfs/dbraw/zinc/10/17/96/191101796.db2.gz RBVMJAMIHPPJFB-UHFFFAOYSA-N 1 2 232.283 2.413 20 0 BEADLO CCc1nc(C[N@H+](C)[C@@H]2CCCOC2)cs1 ZINC000336665095 350425665 /nfs/dbraw/zinc/42/56/65/350425665.db2.gz FIGFVKXHFKRIRK-LLVKDONJSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@@H]2CCCOC2)cs1 ZINC000336665095 350425669 /nfs/dbraw/zinc/42/56/69/350425669.db2.gz FIGFVKXHFKRIRK-LLVKDONJSA-N 1 2 240.372 2.316 20 0 BEADLO CCC[C@H](C)CC(=O)N[C@H]1CCn2cc[nH+]c2C1 ZINC000427989993 191104275 /nfs/dbraw/zinc/10/42/75/191104275.db2.gz CBESJTIGBAXDAJ-RYUDHWBXSA-N 1 2 249.358 2.140 20 0 BEADLO CC[N@H+](Cc1ccccn1)Cc1ncc(C)cn1 ZINC000336707328 350460579 /nfs/dbraw/zinc/46/05/79/350460579.db2.gz KLCLSEMLRKYDSY-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO CC[N@@H+](Cc1ccccn1)Cc1ncc(C)cn1 ZINC000336707328 350460581 /nfs/dbraw/zinc/46/05/81/350460581.db2.gz KLCLSEMLRKYDSY-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO Cc1cccc(C(=O)NCc2c[nH+]c[nH]2)c1Cl ZINC000162942100 350474312 /nfs/dbraw/zinc/47/43/12/350474312.db2.gz ASTJTOGXAISRFW-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO Cc1cccc(C(=O)NCc2c[nH]c[nH+]2)c1Cl ZINC000162942100 350474317 /nfs/dbraw/zinc/47/43/17/350474317.db2.gz ASTJTOGXAISRFW-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO c1cc(C[NH2+]Cc2cscn2)cs1 ZINC000058395713 350484926 /nfs/dbraw/zinc/48/49/26/350484926.db2.gz ZKRIWSDDXUMIMX-UHFFFAOYSA-N 1 2 210.327 2.494 20 0 BEADLO COC[C@@H](C)Nc1[nH+]c2ccccc2n1C ZINC000070609097 350547962 /nfs/dbraw/zinc/54/79/62/350547962.db2.gz MXUITHRAIXXGGW-SECBINFHSA-N 1 2 219.288 2.020 20 0 BEADLO CC(C)[C@H]([NH2+]Cc1ncn(C)n1)c1ccccc1 ZINC000091409992 187454004 /nfs/dbraw/zinc/45/40/04/187454004.db2.gz BDHVAPRGOLBVIC-AWEZNQCLSA-N 1 2 244.342 2.302 20 0 BEADLO CCCC[C@H](C)C(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000337540985 350593928 /nfs/dbraw/zinc/59/39/28/350593928.db2.gz YZXYETZVGUJTOG-WDEREUQCSA-N 1 2 249.358 2.210 20 0 BEADLO CCCC[C@H](C)C(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000337540985 350593930 /nfs/dbraw/zinc/59/39/30/350593930.db2.gz YZXYETZVGUJTOG-WDEREUQCSA-N 1 2 249.358 2.210 20 0 BEADLO CC(C)[C@H](C)CNC(=O)CCCn1cc[nH+]c1 ZINC000606808289 350613595 /nfs/dbraw/zinc/61/35/95/350613595.db2.gz VXJIYIUXPIGDNR-GFCCVEGCSA-N 1 2 237.347 2.072 20 0 BEADLO CCn1cc([C@@H](C)[NH2+]Cc2ncc(C)o2)cn1 ZINC000231640518 350632724 /nfs/dbraw/zinc/63/27/24/350632724.db2.gz KGSPBAKYMFBMAO-SNVBAGLBSA-N 1 2 234.303 2.050 20 0 BEADLO CCc1cc(N[C@@H]2C[C@H](C)O[C@H]2C)nc[nH+]1 ZINC000385090274 350763818 /nfs/dbraw/zinc/76/38/18/350763818.db2.gz GDLUUQPHXVXKLS-ATZCPNFKSA-N 1 2 221.304 2.017 20 0 BEADLO CC(C)CCc1noc(C[N@@H+]2C[C@@H](C)[C@H]2C)n1 ZINC000339575364 350765417 /nfs/dbraw/zinc/76/54/17/350765417.db2.gz ZCNSVEFVEZWGHU-GHMZBOCLSA-N 1 2 237.347 2.498 20 0 BEADLO CC(C)CCc1noc(C[N@H+]2C[C@@H](C)[C@H]2C)n1 ZINC000339575364 350765420 /nfs/dbraw/zinc/76/54/20/350765420.db2.gz ZCNSVEFVEZWGHU-GHMZBOCLSA-N 1 2 237.347 2.498 20 0 BEADLO COC[C@H]([NH2+]Cc1cccnc1)c1ccco1 ZINC000177574149 366009905 /nfs/dbraw/zinc/00/99/05/366009905.db2.gz YFSJLFSXNGYENN-LBPRGKRZSA-N 1 2 232.283 2.152 20 0 BEADLO C[C@@H]([NH2+][C@H]1CS[C@H](C)C1)C(=O)OC(C)(C)C ZINC000397918458 350990539 /nfs/dbraw/zinc/99/05/39/350990539.db2.gz FWRZAQJZFFYGPB-OPRDCNLKSA-N 1 2 245.388 2.200 20 0 BEADLO CC[C@@H]1CCCN1c1cc(-n2cc[nH+]c2)ncn1 ZINC000607144838 350946080 /nfs/dbraw/zinc/94/60/80/350946080.db2.gz VBLNMVWFRANSNI-LLVKDONJSA-N 1 2 243.314 2.041 20 0 BEADLO CC(C)(C)c1ccc(C[NH2+]Cc2cnn[nH]2)cc1 ZINC000398350257 351048633 /nfs/dbraw/zinc/04/86/33/351048633.db2.gz RWABYHGUDBPKDG-UHFFFAOYSA-N 1 2 244.342 2.392 20 0 BEADLO CC(C)(C)c1ccc(C[NH2+]Cc2c[nH]nn2)cc1 ZINC000398350257 351048637 /nfs/dbraw/zinc/04/86/37/351048637.db2.gz RWABYHGUDBPKDG-UHFFFAOYSA-N 1 2 244.342 2.392 20 0 BEADLO CC(C)(C)c1ccc(C[NH2+]Cc2cn[nH]n2)cc1 ZINC000398350257 351048642 /nfs/dbraw/zinc/04/86/42/351048642.db2.gz RWABYHGUDBPKDG-UHFFFAOYSA-N 1 2 244.342 2.392 20 0 BEADLO C/C=C(\CC)C(=O)N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000365094426 191131105 /nfs/dbraw/zinc/13/11/05/191131105.db2.gz SSJSGIKIRHSMOZ-KBVBDRTLSA-N 1 2 247.342 2.092 20 0 BEADLO CC(C)c1ccc(C[NH2+]Cc2cnn[nH]2)cc1 ZINC000398362007 351123364 /nfs/dbraw/zinc/12/33/64/351123364.db2.gz NRFXXKSUCKPEAQ-UHFFFAOYSA-N 1 2 230.315 2.218 20 0 BEADLO CC(C)c1ccc(C[NH2+]Cc2c[nH]nn2)cc1 ZINC000398362007 351123365 /nfs/dbraw/zinc/12/33/65/351123365.db2.gz NRFXXKSUCKPEAQ-UHFFFAOYSA-N 1 2 230.315 2.218 20 0 BEADLO CC(C)c1ccc(C[NH2+]Cc2cn[nH]n2)cc1 ZINC000398362007 351123367 /nfs/dbraw/zinc/12/33/67/351123367.db2.gz NRFXXKSUCKPEAQ-UHFFFAOYSA-N 1 2 230.315 2.218 20 0 BEADLO CC[C@H]1CCC[C@H](C[NH2+]Cc2c[nH]nn2)C1 ZINC000398388077 351127969 /nfs/dbraw/zinc/12/79/69/351127969.db2.gz JMAXQJFXERURNL-QWRGUYRKSA-N 1 2 222.336 2.111 20 0 BEADLO CC[C@H]1CCC[C@H](C[NH2+]Cc2cn[nH]n2)C1 ZINC000398388077 351127972 /nfs/dbraw/zinc/12/79/72/351127972.db2.gz JMAXQJFXERURNL-QWRGUYRKSA-N 1 2 222.336 2.111 20 0 BEADLO Cc1[nH]c(CN2CCCC(F)(F)C2)[nH+]c1C ZINC000628323706 351234140 /nfs/dbraw/zinc/23/41/40/351234140.db2.gz INBGFTRFKSFHBC-UHFFFAOYSA-N 1 2 229.274 2.258 20 0 BEADLO Cc1[nH]c(CN2C[C@H](C)OCC23CCC3)[nH+]c1C ZINC000628325257 351251157 /nfs/dbraw/zinc/25/11/57/351251157.db2.gz FAWNOWODUBKHPE-JTQLQIEISA-N 1 2 249.358 2.170 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1NC(=O)c1c[nH+]c(C)[nH]1 ZINC000264855532 351257699 /nfs/dbraw/zinc/25/76/99/351257699.db2.gz NZPMJQOICSLNBE-MNOVXSKESA-N 1 2 235.331 2.417 20 0 BEADLO Cc1c[nH]c(C[N@H+]2C[C@H](C)OC3(CCCC3)C2)n1 ZINC000628322920 351212327 /nfs/dbraw/zinc/21/23/27/351212327.db2.gz RNCCDSOSQPYEDF-LBPRGKRZSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2C[C@H](C)OC3(CCCC3)C2)n1 ZINC000628322920 351212330 /nfs/dbraw/zinc/21/23/30/351212330.db2.gz RNCCDSOSQPYEDF-LBPRGKRZSA-N 1 2 249.358 2.252 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H](C)SC ZINC000265034022 351262084 /nfs/dbraw/zinc/26/20/84/351262084.db2.gz UOOGERHNDITUDQ-QMMMGPOBSA-N 1 2 224.329 2.334 20 0 BEADLO Cc1cc(C)c(C(=O)NCc2[nH]cc[nH+]2)s1 ZINC000631240093 351291916 /nfs/dbraw/zinc/29/19/16/351291916.db2.gz ZZLPLSQUTBTJKX-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)CC[C@@H]1CCOC1 ZINC000267586712 351316703 /nfs/dbraw/zinc/31/67/03/351316703.db2.gz MMPQMGCWPVDOBM-LLVKDONJSA-N 1 2 248.326 2.399 20 0 BEADLO COc1cc(C[NH2+][C@H](C)C(F)F)ccc1C#N ZINC000389947976 351278211 /nfs/dbraw/zinc/27/82/11/351278211.db2.gz VIFGJMBCQILNGV-MRVPVSSYSA-N 1 2 240.253 2.310 20 0 BEADLO CCCCc1cc(N[C@@H](CC)CCO)nc[nH+]1 ZINC000631126317 351365782 /nfs/dbraw/zinc/36/57/82/351365782.db2.gz IRUDBJRQQCFFOD-NSHDSACASA-N 1 2 237.347 2.392 20 0 BEADLO Cn1c[nH+]cc1CN1CC2(CC2)c2ccccc21 ZINC000177123312 187478910 /nfs/dbraw/zinc/47/89/10/187478910.db2.gz FGEGUDYATIOIHC-UHFFFAOYSA-N 1 2 239.322 2.472 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)CC[C@H](C)OC ZINC000272872550 351498693 /nfs/dbraw/zinc/49/86/93/351498693.db2.gz DLLFUOPZGPLSLT-JTQLQIEISA-N 1 2 236.315 2.398 20 0 BEADLO CCc1nnc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)[nH]1 ZINC000273174543 351512108 /nfs/dbraw/zinc/51/21/08/351512108.db2.gz GTIBXXFISULTJY-NSHDSACASA-N 1 2 245.330 2.032 20 0 BEADLO CCc1nnc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)[nH]1 ZINC000273174543 351512113 /nfs/dbraw/zinc/51/21/13/351512113.db2.gz GTIBXXFISULTJY-NSHDSACASA-N 1 2 245.330 2.032 20 0 BEADLO Clc1ccccc1C[NH2+]Cc1cc[nH]n1 ZINC000036900012 180595221 /nfs/dbraw/zinc/59/52/21/180595221.db2.gz PSAQJABOBXBANR-UHFFFAOYSA-N 1 2 221.691 2.353 20 0 BEADLO CN(C)c1ccc(NCc2ccccn2)c[nH+]1 ZINC000036988925 358465218 /nfs/dbraw/zinc/46/52/18/358465218.db2.gz OONBXHXNZKFXKW-UHFFFAOYSA-N 1 2 228.299 2.155 20 0 BEADLO Cc1nn(C(C)C)cc1C[N@@H+]1CC[C@@H](F)C1 ZINC000335406101 133857562 /nfs/dbraw/zinc/85/75/62/133857562.db2.gz GONZDTALOIBDHZ-GFCCVEGCSA-N 1 2 225.311 2.316 20 0 BEADLO Cc1nn(C(C)C)cc1C[N@H+]1CC[C@@H](F)C1 ZINC000335406101 133857563 /nfs/dbraw/zinc/85/75/63/133857563.db2.gz GONZDTALOIBDHZ-GFCCVEGCSA-N 1 2 225.311 2.316 20 0 BEADLO C[N@H+](Cc1ccns1)Cc1cccc(O)c1 ZINC000637813014 351649240 /nfs/dbraw/zinc/64/92/40/351649240.db2.gz HRSIGAOWHWZGCH-UHFFFAOYSA-N 1 2 234.324 2.481 20 0 BEADLO C[N@@H+](Cc1ccns1)Cc1cccc(O)c1 ZINC000637813014 351649241 /nfs/dbraw/zinc/64/92/41/351649241.db2.gz HRSIGAOWHWZGCH-UHFFFAOYSA-N 1 2 234.324 2.481 20 0 BEADLO C[C@H](CC(=O)Nc1ccc(N)[nH+]c1)C(F)(F)F ZINC000637829476 351677726 /nfs/dbraw/zinc/67/77/26/351677726.db2.gz LNEFMSUJNVPXCX-ZCFIWIBFSA-N 1 2 247.220 2.021 20 0 BEADLO C[C@H](CC(=O)N1CCC[C@H](C)CC1)n1cc[nH+]c1 ZINC000577734536 366047299 /nfs/dbraw/zinc/04/72/99/366047299.db2.gz ABFOYMQZEUUWOF-QWHCGFSZSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1csc(C(=O)NC(C)(C)c2[nH]cc[nH+]2)c1 ZINC000577737886 366047843 /nfs/dbraw/zinc/04/78/43/366047843.db2.gz FUGRZGWLCBPQFC-UHFFFAOYSA-N 1 2 249.339 2.445 20 0 BEADLO CC(C)[C@H](NC(=O)C[C@H]1C[C@@H]1C)c1[nH]cc[nH+]1 ZINC000355973435 191140920 /nfs/dbraw/zinc/14/09/20/191140920.db2.gz PWLHJONPCCVBSG-UMNHJUIQSA-N 1 2 235.331 2.269 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H](OC)C1CC1 ZINC000280256211 351838053 /nfs/dbraw/zinc/83/80/53/351838053.db2.gz CDUHVGGSUSPPTB-GFCCVEGCSA-N 1 2 234.299 2.008 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)C1C(C)(C)C1(C)C ZINC000072960902 351816206 /nfs/dbraw/zinc/81/62/06/351816206.db2.gz OGEYQHXXPVMOMY-SNVBAGLBSA-N 1 2 249.358 2.070 20 0 BEADLO CC1(C)C[C@@H]1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000280804875 351861567 /nfs/dbraw/zinc/86/15/67/351861567.db2.gz QPISYHPAPZCEAJ-SNVBAGLBSA-N 1 2 229.283 2.319 20 0 BEADLO CCc1nc(C[N@@H+]2CCC(C)=C(C)C2)no1 ZINC000280678858 351856494 /nfs/dbraw/zinc/85/64/94/351856494.db2.gz GNRAACRTHPTJOY-UHFFFAOYSA-N 1 2 221.304 2.174 20 0 BEADLO CCc1nc(C[N@H+]2CCC(C)=C(C)C2)no1 ZINC000280678858 351856499 /nfs/dbraw/zinc/85/64/99/351856499.db2.gz GNRAACRTHPTJOY-UHFFFAOYSA-N 1 2 221.304 2.174 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1CCSC1 ZINC000335527833 133875965 /nfs/dbraw/zinc/87/59/65/133875965.db2.gz KUYUJSSENOWKOS-SNVBAGLBSA-N 1 2 236.340 2.390 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H](C)OC(C)(C)C2)sn1 ZINC000637968635 351843564 /nfs/dbraw/zinc/84/35/64/351843564.db2.gz AALUMVWYXKLBQX-JTQLQIEISA-N 1 2 240.372 2.451 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H](C)OC(C)(C)C2)sn1 ZINC000637968635 351843567 /nfs/dbraw/zinc/84/35/67/351843567.db2.gz AALUMVWYXKLBQX-JTQLQIEISA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccns2)C[C@H](C)O1 ZINC000637973595 351848709 /nfs/dbraw/zinc/84/87/09/351848709.db2.gz XLPXLTGEFOTDLE-UWVGGRQHSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccns2)C[C@H](C)O1 ZINC000637973595 351848710 /nfs/dbraw/zinc/84/87/10/351848710.db2.gz XLPXLTGEFOTDLE-UWVGGRQHSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@H](SC)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000280836314 351862597 /nfs/dbraw/zinc/86/25/97/351862597.db2.gz UWSVZQVQPMEYRF-SNVBAGLBSA-N 1 2 249.339 2.414 20 0 BEADLO CC(C)C[C@H]1COCC[N@@H+]1Cc1ccns1 ZINC000638070320 351940565 /nfs/dbraw/zinc/94/05/65/351940565.db2.gz YJUGMRADTWRKLS-NSHDSACASA-N 1 2 240.372 2.390 20 0 BEADLO CC(C)C[C@H]1COCC[N@H+]1Cc1ccns1 ZINC000638070320 351940568 /nfs/dbraw/zinc/94/05/68/351940568.db2.gz YJUGMRADTWRKLS-NSHDSACASA-N 1 2 240.372 2.390 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2ccns2)n1 ZINC000638112590 351988729 /nfs/dbraw/zinc/98/87/29/351988729.db2.gz VRBVHAAZGOEFAR-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2ccns2)n1 ZINC000638112590 351988731 /nfs/dbraw/zinc/98/87/31/351988731.db2.gz VRBVHAAZGOEFAR-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CC1(C)CCC[C@H]1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000284545673 351999506 /nfs/dbraw/zinc/99/95/06/351999506.db2.gz XNGXURAJEXHTOU-MVIFTORASA-N 1 2 233.315 2.118 20 0 BEADLO Cc1cc(CSCCn2cc[nH+]c2)no1 ZINC000090199879 352006659 /nfs/dbraw/zinc/00/66/59/352006659.db2.gz HTOMKBZJNQPRCE-UHFFFAOYSA-N 1 2 223.301 2.113 20 0 BEADLO Cn1cc(C[NH2+][C@H]2CCCc3scnc32)cn1 ZINC000623871970 352058725 /nfs/dbraw/zinc/05/87/25/352058725.db2.gz QTGGFYOIAIEHOB-JTQLQIEISA-N 1 2 248.355 2.044 20 0 BEADLO Cc1nnc([C@H](C)[N@H+](C)Cc2ccccc2)[nH]1 ZINC000411146422 191163328 /nfs/dbraw/zinc/16/33/28/191163328.db2.gz FRWMSIZNBQMRSV-JTQLQIEISA-N 1 2 230.315 2.306 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+](C)Cc2ccccc2)[nH]1 ZINC000411146422 191163330 /nfs/dbraw/zinc/16/33/30/191163330.db2.gz FRWMSIZNBQMRSV-JTQLQIEISA-N 1 2 230.315 2.306 20 0 BEADLO c1cc(C[NH2+]Cc2cc(C3CC3)no2)co1 ZINC000638408976 352218516 /nfs/dbraw/zinc/21/85/16/352218516.db2.gz MEDHVAUEBNBHPZ-UHFFFAOYSA-N 1 2 218.256 2.435 20 0 BEADLO CC[N@H+](Cc1cc[nH]n1)[C@H](C)c1cccnc1 ZINC000290328778 352220719 /nfs/dbraw/zinc/22/07/19/352220719.db2.gz DNRPETYRCLLWIW-LLVKDONJSA-N 1 2 230.315 2.388 20 0 BEADLO CC[N@@H+](Cc1cc[nH]n1)[C@H](C)c1cccnc1 ZINC000290328778 352220722 /nfs/dbraw/zinc/22/07/22/352220722.db2.gz DNRPETYRCLLWIW-LLVKDONJSA-N 1 2 230.315 2.388 20 0 BEADLO Cc1cc(C[NH+]2CC(C)(CC(F)F)C2)on1 ZINC000630074023 363157609 /nfs/dbraw/zinc/15/76/09/363157609.db2.gz DQKGLMWLWNCTCA-UHFFFAOYSA-N 1 2 230.258 2.460 20 0 BEADLO Cc1cc(NC(=O)C(C)(C)CC(F)F)cc[nH+]1 ZINC000411199426 191168541 /nfs/dbraw/zinc/16/85/41/191168541.db2.gz KOSRKGSNQHEKJG-UHFFFAOYSA-N 1 2 242.269 2.432 20 0 BEADLO CC1(C)CN(C(=O)C=Cc2c[nH]c[nH+]2)[C@@H]1C1CC1 ZINC000291988398 352297581 /nfs/dbraw/zinc/29/75/81/352297581.db2.gz WAMCCPIOCQMXRJ-URWSZGRFSA-N 1 2 245.326 2.070 20 0 BEADLO Cc1cc(NC(=O)[C@@H](C)CC(F)F)cc[nH+]1 ZINC000411199290 191170066 /nfs/dbraw/zinc/17/00/66/191170066.db2.gz KJZROTNBKXNQSM-ZETCQYMHSA-N 1 2 228.242 2.042 20 0 BEADLO CCC[N@H+](C[C@@H](F)CC)[C@@H](C)C(=O)OCC ZINC000411653214 191200577 /nfs/dbraw/zinc/20/05/77/191200577.db2.gz WHWYHYDBVUVMDQ-QWRGUYRKSA-N 1 2 233.327 2.398 20 0 BEADLO CCC[N@@H+](C[C@@H](F)CC)[C@@H](C)C(=O)OCC ZINC000411653214 191200580 /nfs/dbraw/zinc/20/05/80/191200580.db2.gz WHWYHYDBVUVMDQ-QWRGUYRKSA-N 1 2 233.327 2.398 20 0 BEADLO C[C@H](C[NH2+]Cc1cc(C2CC2)no1)N(C)C1CC1 ZINC000638574375 352404663 /nfs/dbraw/zinc/40/46/63/352404663.db2.gz DCKFOEDINWAQHP-SNVBAGLBSA-N 1 2 249.358 2.124 20 0 BEADLO CC(C)=C[C@@H]1[C@@H](C(=O)NCc2c[nH+]c[nH]2)C1(C)C ZINC000607948771 352454726 /nfs/dbraw/zinc/45/47/26/352454726.db2.gz SFEPOBZCACEQSG-NEPJUHHUSA-N 1 2 247.342 2.264 20 0 BEADLO CC(C)=C[C@@H]1[C@@H](C(=O)NCc2c[nH]c[nH+]2)C1(C)C ZINC000607948771 352454730 /nfs/dbraw/zinc/45/47/30/352454730.db2.gz SFEPOBZCACEQSG-NEPJUHHUSA-N 1 2 247.342 2.264 20 0 BEADLO [NH3+][C@H]1CC[N@H+](Cc2cccc3ccccc32)C1 ZINC000039170309 352586269 /nfs/dbraw/zinc/58/62/69/352586269.db2.gz AYSAWSQFBJHOIJ-AWEZNQCLSA-N 1 2 226.323 2.373 20 0 BEADLO C[C@H]1CCC[N@@H+]1Cn1ccc(Br)n1 ZINC000307574451 352658519 /nfs/dbraw/zinc/65/85/19/352658519.db2.gz HEGRDTFZIKZMQE-QMMMGPOBSA-N 1 2 244.136 2.087 20 0 BEADLO C[C@H]1CCC[N@H+]1Cn1ccc(Br)n1 ZINC000307574451 352658523 /nfs/dbraw/zinc/65/85/23/352658523.db2.gz HEGRDTFZIKZMQE-QMMMGPOBSA-N 1 2 244.136 2.087 20 0 BEADLO Cc1cnc([C@H]([NH2+]Cc2cc[nH]n2)C2CC2)s1 ZINC000608062337 352660631 /nfs/dbraw/zinc/66/06/31/352660631.db2.gz DXIIHVSHXKTGDZ-LLVKDONJSA-N 1 2 248.355 2.416 20 0 BEADLO FC[C@@H]1C[N@H+](C/C=C/c2ccccc2)CCO1 ZINC000411852460 191220463 /nfs/dbraw/zinc/22/04/63/191220463.db2.gz KHOGMYPXRUFWIB-BTKRWWFXSA-N 1 2 235.302 2.370 20 0 BEADLO FC[C@@H]1C[N@@H+](C/C=C/c2ccccc2)CCO1 ZINC000411852460 191220464 /nfs/dbraw/zinc/22/04/64/191220464.db2.gz KHOGMYPXRUFWIB-BTKRWWFXSA-N 1 2 235.302 2.370 20 0 BEADLO COC[C@H](C)[N@@H+]1Cc2ccc(C(C)=O)cc2C1 ZINC000411953738 191232681 /nfs/dbraw/zinc/23/26/81/191232681.db2.gz WFJIYFAUKNJEOF-JTQLQIEISA-N 1 2 233.311 2.240 20 0 BEADLO COC[C@H](C)[N@H+]1Cc2ccc(C(C)=O)cc2C1 ZINC000411953738 191232682 /nfs/dbraw/zinc/23/26/82/191232682.db2.gz WFJIYFAUKNJEOF-JTQLQIEISA-N 1 2 233.311 2.240 20 0 BEADLO COCC1(CNc2ccc(N(C)C)c[nH+]2)CCC1 ZINC000638759506 352696659 /nfs/dbraw/zinc/69/66/59/352696659.db2.gz KDKQOGDUEKYPMP-UHFFFAOYSA-N 1 2 249.358 2.376 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H](C)CC(F)F ZINC000412058678 191245762 /nfs/dbraw/zinc/24/57/62/191245762.db2.gz VKVYPBGYKLSAPS-SSDOTTSWSA-N 1 2 228.242 2.042 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C(C)(C)CC(F)F ZINC000412058704 191246074 /nfs/dbraw/zinc/24/60/74/191246074.db2.gz VOGULCGOIRRLIB-UHFFFAOYSA-N 1 2 242.269 2.432 20 0 BEADLO COC(=O)[C@H](CC(C)C)[NH2+][C@@H]1CS[C@H](C)C1 ZINC000086934978 352747589 /nfs/dbraw/zinc/74/75/89/352747589.db2.gz MFXWTKWVJLXWFF-VWYCJHECSA-N 1 2 245.388 2.058 20 0 BEADLO COC(=O)[C@H](CC(C)C)[NH2+][C@H]1CS[C@H](C)C1 ZINC000086934980 352747692 /nfs/dbraw/zinc/74/76/92/352747692.db2.gz MFXWTKWVJLXWFF-MXWKQRLJSA-N 1 2 245.388 2.058 20 0 BEADLO c1cnn([C@@H]2CCC[N@@H+](Cc3cscn3)C2)c1 ZINC000334188441 352777852 /nfs/dbraw/zinc/77/78/52/352777852.db2.gz HHXFLDKEQHYYEM-GFCCVEGCSA-N 1 2 248.355 2.177 20 0 BEADLO c1cnn([C@@H]2CCC[N@H+](Cc3cscn3)C2)c1 ZINC000334188441 352777855 /nfs/dbraw/zinc/77/78/55/352777855.db2.gz HHXFLDKEQHYYEM-GFCCVEGCSA-N 1 2 248.355 2.177 20 0 BEADLO Cc1nocc1C[N@@H+]1CCO[C@H](c2ccco2)C1 ZINC000334188497 352778225 /nfs/dbraw/zinc/77/82/25/352778225.db2.gz HMHFKWPHVUNGNO-ZDUSSCGKSA-N 1 2 248.282 2.150 20 0 BEADLO Cc1nocc1C[N@H+]1CCO[C@H](c2ccco2)C1 ZINC000334188497 352778227 /nfs/dbraw/zinc/77/82/27/352778227.db2.gz HMHFKWPHVUNGNO-ZDUSSCGKSA-N 1 2 248.282 2.150 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H]2CCCC(F)(F)C2)c[nH+]1 ZINC000334193767 352785502 /nfs/dbraw/zinc/78/55/02/352785502.db2.gz JJONGWWZTKPVEL-QMMMGPOBSA-N 1 2 243.257 2.026 20 0 BEADLO CC1(C)CC(CC(=O)N2CCn3c[nH+]cc3C2)C1 ZINC000334202563 352796233 /nfs/dbraw/zinc/79/62/33/352796233.db2.gz PULNLLKPESCRRR-UHFFFAOYSA-N 1 2 247.342 2.052 20 0 BEADLO C[C@@H](F)CC[N@H+](C)Cc1noc(C2CC2)n1 ZINC000412083362 191255372 /nfs/dbraw/zinc/25/53/72/191255372.db2.gz ZRPAKSJFNFVMQX-MRVPVSSYSA-N 1 2 227.283 2.127 20 0 BEADLO C[C@@H](F)CC[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000412083362 191255373 /nfs/dbraw/zinc/25/53/73/191255373.db2.gz ZRPAKSJFNFVMQX-MRVPVSSYSA-N 1 2 227.283 2.127 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ncc(C)n2C)CCS1 ZINC000342806533 352860109 /nfs/dbraw/zinc/86/01/09/352860109.db2.gz JVNRSGCREKLNMR-LLVKDONJSA-N 1 2 239.388 2.056 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ncc(C)n2C)CCS1 ZINC000342806533 352860112 /nfs/dbraw/zinc/86/01/12/352860112.db2.gz JVNRSGCREKLNMR-LLVKDONJSA-N 1 2 239.388 2.056 20 0 BEADLO CC[C@@H]1CN(Cc2[nH+]cc(C)n2C)CCS1 ZINC000342806533 352860113 /nfs/dbraw/zinc/86/01/13/352860113.db2.gz JVNRSGCREKLNMR-LLVKDONJSA-N 1 2 239.388 2.056 20 0 BEADLO Fc1ccc(F)c(CN2CCn3cc[nH+]c3C2)c1 ZINC000334259679 352871161 /nfs/dbraw/zinc/87/11/61/352871161.db2.gz UUYJOUNZMYEGJO-UHFFFAOYSA-N 1 2 249.264 2.177 20 0 BEADLO C[C@@H]1C[N@H+](CCc2cccc(F)c2F)CCO1 ZINC000334228870 352845997 /nfs/dbraw/zinc/84/59/97/352845997.db2.gz PCCVCLIABNLVEI-SNVBAGLBSA-N 1 2 241.281 2.228 20 0 BEADLO C[C@@H]1C[N@@H+](CCc2cccc(F)c2F)CCO1 ZINC000334228870 352845999 /nfs/dbraw/zinc/84/59/99/352845999.db2.gz PCCVCLIABNLVEI-SNVBAGLBSA-N 1 2 241.281 2.228 20 0 BEADLO C(c1noc(C2CC2)n1)[N@@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000334272237 352909064 /nfs/dbraw/zinc/90/90/64/352909064.db2.gz WUXGWZKHOGPJQG-ONGXEEELSA-N 1 2 233.315 2.321 20 0 BEADLO C(c1noc(C2CC2)n1)[N@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000334272237 352909066 /nfs/dbraw/zinc/90/90/66/352909066.db2.gz WUXGWZKHOGPJQG-ONGXEEELSA-N 1 2 233.315 2.321 20 0 BEADLO CO[C@@H](CNc1cc2cc[nH]c2c[nH+]1)CC(C)C ZINC000642278460 363199561 /nfs/dbraw/zinc/19/95/61/363199561.db2.gz SENAQSWLTLRUFI-GFCCVEGCSA-N 1 2 247.342 2.458 20 0 BEADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cc[nH]n2)on1 ZINC000334352131 352986829 /nfs/dbraw/zinc/98/68/29/352986829.db2.gz GVKJCSOBIZWEDL-LLVKDONJSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cc[nH]n2)on1 ZINC000334352131 352986832 /nfs/dbraw/zinc/98/68/32/352986832.db2.gz GVKJCSOBIZWEDL-LLVKDONJSA-N 1 2 232.287 2.043 20 0 BEADLO Cn1c2ccccc2[nH+]c1N1CCC(F)(F)C1 ZINC000334311861 352943752 /nfs/dbraw/zinc/94/37/52/352943752.db2.gz SIMJIBKHPIXDNQ-UHFFFAOYSA-N 1 2 237.253 2.419 20 0 BEADLO c1c(C[NH2+]Cc2ccccn2)onc1C1CC1 ZINC000638841430 353018052 /nfs/dbraw/zinc/01/80/52/353018052.db2.gz SOJIGFPBBBOLCQ-UHFFFAOYSA-N 1 2 229.283 2.237 20 0 BEADLO CCN(C(=O)C[C@H](C)n1cc[nH+]c1)C(C)C ZINC000577854560 366085153 /nfs/dbraw/zinc/08/51/53/366085153.db2.gz QRMXKTAMMDLIBI-NSHDSACASA-N 1 2 223.320 2.091 20 0 BEADLO CCc1nn(C)cc1CNc1c[nH+]cc(C)c1 ZINC000092414522 538106962 /nfs/dbraw/zinc/10/69/62/538106962.db2.gz LOVUNXOYCQOOEC-UHFFFAOYSA-N 1 2 230.315 2.298 20 0 BEADLO CC[C@H](O)CCCNc1[nH+]cccc1OC ZINC000398566921 353070706 /nfs/dbraw/zinc/07/07/06/353070706.db2.gz NEESRBZKGDSZSP-JTQLQIEISA-N 1 2 224.304 2.053 20 0 BEADLO CC[C@H]1CCCN(C(=O)C[C@H](C)n2cc[nH+]c2)C1 ZINC000577854276 366085531 /nfs/dbraw/zinc/08/55/31/366085531.db2.gz HZNIPQUBZMJFRO-STQMWFEESA-N 1 2 249.358 2.483 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1cc[nH]n1 ZINC000092935993 538108248 /nfs/dbraw/zinc/10/82/48/538108248.db2.gz LSBAWUPWYXOFFK-UHFFFAOYSA-N 1 2 205.261 2.025 20 0 BEADLO CC(C)CCn1ccc(N[C@H](C)c2[nH]cc[nH+]2)n1 ZINC000428439653 538107983 /nfs/dbraw/zinc/10/79/83/538107983.db2.gz CJAVKCFXHUOYOX-LLVKDONJSA-N 1 2 247.346 2.247 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1cc[nH]n1 ZINC000092935993 538108249 /nfs/dbraw/zinc/10/82/49/538108249.db2.gz LSBAWUPWYXOFFK-UHFFFAOYSA-N 1 2 205.261 2.025 20 0 BEADLO CN(C)c1ccc(Nc2ncncc2Cl)c[nH+]1 ZINC000302595900 188059992 /nfs/dbraw/zinc/05/99/92/188059992.db2.gz XJFXPHDIXDHNDQ-UHFFFAOYSA-N 1 2 249.705 2.335 20 0 BEADLO CC[C@H]1CCCC[C@@H]1C(=O)NCCc1[nH]cc[nH+]1 ZINC000355985356 188064746 /nfs/dbraw/zinc/06/47/46/188064746.db2.gz KPBCSAYBCCKGMS-RYUDHWBXSA-N 1 2 249.358 2.285 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+]C1CC(c2ccccc2)C1 ZINC000049371729 188125072 /nfs/dbraw/zinc/12/50/72/188125072.db2.gz MOWGZSKZJCJZGY-LMWSTFAQSA-N 1 2 247.338 2.474 20 0 BEADLO CC[C@@H](OC)C(=O)Nc1c(C)cc[nH+]c1C ZINC000331121444 353220897 /nfs/dbraw/zinc/22/08/97/353220897.db2.gz MJTMTMTVUMJUOT-SNVBAGLBSA-N 1 2 222.288 2.062 20 0 BEADLO Cc1nc(N2CCCC[C@H](C)C2)cc[nH+]1 ZINC000185858323 188170452 /nfs/dbraw/zinc/17/04/52/188170452.db2.gz QNRQWUONYOORNB-JTQLQIEISA-N 1 2 205.305 2.411 20 0 BEADLO Cc1nc(N(Cc2cccnc2)C2CC2)cc[nH+]1 ZINC000266315355 188194863 /nfs/dbraw/zinc/19/48/63/188194863.db2.gz DYRPTHSOICYMLN-UHFFFAOYSA-N 1 2 240.310 2.349 20 0 BEADLO Cc1cc(N(C)C[C@H]2CCOC2)nc(C2CC2)[nH+]1 ZINC000267315618 188196264 /nfs/dbraw/zinc/19/62/64/188196264.db2.gz YCRGDEAAWBBXKD-LLVKDONJSA-N 1 2 247.342 2.135 20 0 BEADLO CC(C)c1nc(N(C)C[C@H]2CCCOC2)cc[nH+]1 ZINC000110587167 188176337 /nfs/dbraw/zinc/17/63/37/188176337.db2.gz YCEYIVNHRQHJCA-GFCCVEGCSA-N 1 2 249.358 2.463 20 0 BEADLO CC(=O)CCCCSc1nc(N)cc(C)[nH+]1 ZINC000122075522 188216760 /nfs/dbraw/zinc/21/67/60/188216760.db2.gz ZHVQRXNPSOJTLQ-UHFFFAOYSA-N 1 2 239.344 2.219 20 0 BEADLO OCC[C@H]1CCC[C@@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000275016982 188201496 /nfs/dbraw/zinc/20/14/96/188201496.db2.gz LCBJHMZSHRZOHI-PWSUYJOCSA-N 1 2 247.342 2.317 20 0 BEADLO Cn1c[nH+]cc1CCC(=O)N1CCCCCCC1 ZINC000276490898 188201761 /nfs/dbraw/zinc/20/17/61/188201761.db2.gz GJLRIMXRRWZCEK-UHFFFAOYSA-N 1 2 249.358 2.145 20 0 BEADLO COc1ccc(NCc2nccs2)[nH+]c1 ZINC000225893742 538114541 /nfs/dbraw/zinc/11/45/41/538114541.db2.gz JRLQFXUZTIIPMD-UHFFFAOYSA-N 1 2 221.285 2.159 20 0 BEADLO Cc1ccc(NC(=O)C[C@@](C)(O)C2CC2)c(C)[nH+]1 ZINC000331774866 188226596 /nfs/dbraw/zinc/22/65/96/188226596.db2.gz BWLSKVFYIVXDRK-CQSZACIVSA-N 1 2 248.326 2.188 20 0 BEADLO CCc1cc(NCC2(CO)CCCC2)nc[nH+]1 ZINC000135111024 538114715 /nfs/dbraw/zinc/11/47/15/538114715.db2.gz FDLMWTUHZYWKPS-UHFFFAOYSA-N 1 2 235.331 2.004 20 0 BEADLO c1[nH]nnc1C[NH2+][C@H]1CCCCC12CCCC2 ZINC000398301000 363214630 /nfs/dbraw/zinc/21/46/30/363214630.db2.gz RDHMEEHJVYGXMT-LBPRGKRZSA-N 1 2 234.347 2.397 20 0 BEADLO c1n[nH]nc1C[NH2+][C@H]1CCCCC12CCCC2 ZINC000398301000 363214636 /nfs/dbraw/zinc/21/46/36/363214636.db2.gz RDHMEEHJVYGXMT-LBPRGKRZSA-N 1 2 234.347 2.397 20 0 BEADLO CO[C@H](C[NH+]1CC(F)C1)C1CCCCC1 ZINC000639036779 353314720 /nfs/dbraw/zinc/31/47/20/353314720.db2.gz CTRFBNDTVUGBRA-GFCCVEGCSA-N 1 2 215.312 2.235 20 0 BEADLO CCO[C@@H]1C[C@H]1[NH2+]Cc1ncc(Cl)s1 ZINC000308496342 353357559 /nfs/dbraw/zinc/35/75/59/353357559.db2.gz DIKXYUYAJBHIDR-RNFRBKRXSA-N 1 2 232.736 2.064 20 0 BEADLO CC[N@H+](CCC[C@H]1CCO1)CC(F)F ZINC000639062870 353376787 /nfs/dbraw/zinc/37/67/87/353376787.db2.gz VPDAQZWKUISOKB-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CC[N@@H+](CCC[C@H]1CCO1)CC(F)F ZINC000639062870 353376790 /nfs/dbraw/zinc/37/67/90/353376790.db2.gz VPDAQZWKUISOKB-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)sn1 ZINC000639085529 353425499 /nfs/dbraw/zinc/42/54/99/353425499.db2.gz HJNAYYLPNXTAMD-DCAQKATOSA-N 1 2 240.372 2.449 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)sn1 ZINC000639085529 353425501 /nfs/dbraw/zinc/42/55/01/353425501.db2.gz HJNAYYLPNXTAMD-DCAQKATOSA-N 1 2 240.372 2.449 20 0 BEADLO CC(C)[C@H](NC(=O)[C@H]1C[C@H]1C1CC1)c1[nH]cc[nH+]1 ZINC000332942555 353482459 /nfs/dbraw/zinc/48/24/59/353482459.db2.gz LLDIPYCVQIDSPJ-SRVKXCTJSA-N 1 2 247.342 2.269 20 0 BEADLO CC(C)[C@H](NC(=O)[C@H]1C[C@@H]1C1CC1)c1[nH]cc[nH+]1 ZINC000332942556 353483035 /nfs/dbraw/zinc/48/30/35/353483035.db2.gz LLDIPYCVQIDSPJ-WOPDTQHZSA-N 1 2 247.342 2.269 20 0 BEADLO C[C@@H]([NH2+]CC(F)F)c1ccc2c(c1)OCO2 ZINC000147345510 538117582 /nfs/dbraw/zinc/11/75/82/538117582.db2.gz VXEXJTOYPMHFAZ-SSDOTTSWSA-N 1 2 229.226 2.331 20 0 BEADLO Cc1cc(N[C@@H](C)C2CCOCC2)nc[nH+]1 ZINC000230217577 353476258 /nfs/dbraw/zinc/47/62/58/353476258.db2.gz VIQIFFJLKLOHGL-JTQLQIEISA-N 1 2 221.304 2.012 20 0 BEADLO CO[C@H]1CC[C@H](NC(=O)Nc2cc[nH+]cc2C)C1 ZINC000189755687 353534864 /nfs/dbraw/zinc/53/48/64/353534864.db2.gz BBWGJTMTRIXERB-QWRGUYRKSA-N 1 2 249.314 2.079 20 0 BEADLO Cc1cn2c([nH+]1)C[C@@H](C(=O)N(C)C(C)(C)C)CC2 ZINC000627964081 353496892 /nfs/dbraw/zinc/49/68/92/353496892.db2.gz CMALGMQLAPBNOF-NSHDSACASA-N 1 2 249.358 2.011 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1ccc(C)cc1C ZINC000053097144 353557178 /nfs/dbraw/zinc/55/71/78/353557178.db2.gz KGOGFUKAGAMOFM-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1ccc(C)cc1C ZINC000053097144 353557180 /nfs/dbraw/zinc/55/71/80/353557180.db2.gz KGOGFUKAGAMOFM-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO CCCC(C)(C)NC(=O)CCc1c[nH+]c[nH]1 ZINC000193017035 353572033 /nfs/dbraw/zinc/57/20/33/353572033.db2.gz FIDKXDHOGIDGJX-UHFFFAOYSA-N 1 2 223.320 2.037 20 0 BEADLO CCCC(C)(C)NC(=O)CCc1c[nH]c[nH+]1 ZINC000193017035 353572035 /nfs/dbraw/zinc/57/20/35/353572035.db2.gz FIDKXDHOGIDGJX-UHFFFAOYSA-N 1 2 223.320 2.037 20 0 BEADLO CS[C@@H](C)C(=O)Nc1c(C)cc[nH+]c1C ZINC000334515811 353611913 /nfs/dbraw/zinc/61/19/13/353611913.db2.gz HQNWANPVBRQHMF-VIFPVBQESA-N 1 2 224.329 2.388 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+]Cc2c(C)n[nH]c2C)o1 ZINC000231525708 353618960 /nfs/dbraw/zinc/61/89/60/353618960.db2.gz LCUPZEGUSBRFNF-SNVBAGLBSA-N 1 2 234.303 2.174 20 0 BEADLO CCC(CC)(CC)C[NH2+]Cc1c[nH]nn1 ZINC000398463387 363246852 /nfs/dbraw/zinc/24/68/52/363246852.db2.gz SSARSHYMKREDQO-UHFFFAOYSA-N 1 2 210.325 2.111 20 0 BEADLO CCC(CC)(CC)C[NH2+]Cc1cn[nH]n1 ZINC000398463387 363246855 /nfs/dbraw/zinc/24/68/55/363246855.db2.gz SSARSHYMKREDQO-UHFFFAOYSA-N 1 2 210.325 2.111 20 0 BEADLO Fc1cccc2c1C[N@H+](Cc1ccno1)CC2 ZINC000271258978 181006697 /nfs/dbraw/zinc/00/66/97/181006697.db2.gz UGDQFBAUXNXBSX-UHFFFAOYSA-N 1 2 232.258 2.372 20 0 BEADLO Fc1cccc2c1C[N@@H+](Cc1ccno1)CC2 ZINC000271258978 181006698 /nfs/dbraw/zinc/00/66/98/181006698.db2.gz UGDQFBAUXNXBSX-UHFFFAOYSA-N 1 2 232.258 2.372 20 0 BEADLO CCc1ccc(C[N@H+](C)Cc2nnc(C)[nH]2)cc1 ZINC000353814488 353767299 /nfs/dbraw/zinc/76/72/99/353767299.db2.gz IUXHSCOIZOBQOB-UHFFFAOYSA-N 1 2 244.342 2.308 20 0 BEADLO CCc1ccc(C[N@@H+](C)Cc2nnc(C)[nH]2)cc1 ZINC000353814488 353767300 /nfs/dbraw/zinc/76/73/00/353767300.db2.gz IUXHSCOIZOBQOB-UHFFFAOYSA-N 1 2 244.342 2.308 20 0 BEADLO Fc1ccccc1C1(NCc2[nH]cc[nH+]2)CC1 ZINC000076766517 181010698 /nfs/dbraw/zinc/01/06/98/181010698.db2.gz ICQBLPPYLKONRR-UHFFFAOYSA-N 1 2 231.274 2.328 20 0 BEADLO Fc1ccccc1C1([NH2+]Cc2ncc[nH]2)CC1 ZINC000076766517 181010700 /nfs/dbraw/zinc/01/07/00/181010700.db2.gz ICQBLPPYLKONRR-UHFFFAOYSA-N 1 2 231.274 2.328 20 0 BEADLO Cc1ccc(C[N@@H+]2CC[C@@](F)(CO)C2)c(F)c1 ZINC000639145669 353851681 /nfs/dbraw/zinc/85/16/81/353851681.db2.gz VLKFCWPBDPJOMM-ZDUSSCGKSA-N 1 2 241.281 2.040 20 0 BEADLO Cc1ccc(C[N@H+]2CC[C@@](F)(CO)C2)c(F)c1 ZINC000639145669 353851683 /nfs/dbraw/zinc/85/16/83/353851683.db2.gz VLKFCWPBDPJOMM-ZDUSSCGKSA-N 1 2 241.281 2.040 20 0 BEADLO CC[C@@H]1C[C@@H](Nc2cccc[nH+]2)CCO1 ZINC000334534126 353914129 /nfs/dbraw/zinc/91/41/29/353914129.db2.gz LCKSCNQNWBJBTJ-WDEREUQCSA-N 1 2 206.289 2.451 20 0 BEADLO Cc1ccc2c(c1)CN(Cc1[nH]cc[nH+]1)C2 ZINC000334539161 353927006 /nfs/dbraw/zinc/92/70/06/353927006.db2.gz QNBBZLMYFNDUMF-UHFFFAOYSA-N 1 2 213.284 2.234 20 0 BEADLO CO[C@H](C[NH2+]CC(F)F)Cc1ccccc1 ZINC000639162142 353950293 /nfs/dbraw/zinc/95/02/93/353950293.db2.gz LRPUALDULVWAIO-NSHDSACASA-N 1 2 229.270 2.099 20 0 BEADLO CO[C@@H](C[NH2+]CC(F)F)Cc1ccccc1 ZINC000639162141 353950441 /nfs/dbraw/zinc/95/04/41/353950441.db2.gz LRPUALDULVWAIO-LLVKDONJSA-N 1 2 229.270 2.099 20 0 BEADLO CC[N@H+](CCOC)[C@@H](C)c1nc(C(C)C)no1 ZINC000343657552 353955743 /nfs/dbraw/zinc/95/57/43/353955743.db2.gz YUSGOLBDTDPGGR-JTQLQIEISA-N 1 2 241.335 2.222 20 0 BEADLO CC[N@@H+](CCOC)[C@@H](C)c1nc(C(C)C)no1 ZINC000343657552 353955744 /nfs/dbraw/zinc/95/57/44/353955744.db2.gz YUSGOLBDTDPGGR-JTQLQIEISA-N 1 2 241.335 2.222 20 0 BEADLO CC(C)n1nccc1C[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000334554410 353998780 /nfs/dbraw/zinc/99/87/80/353998780.db2.gz PEPNPHZFYVWVHX-VXGBXAGGSA-N 1 2 237.347 2.073 20 0 BEADLO CC[C@H]1C[N@H+](Cc2ccc3c(n2)CCC3)CCO1 ZINC000334557537 354003803 /nfs/dbraw/zinc/00/38/03/354003803.db2.gz DBDLQPDMRMBIKO-AWEZNQCLSA-N 1 2 246.354 2.181 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2ccc3c(n2)CCC3)CCO1 ZINC000334557537 354003805 /nfs/dbraw/zinc/00/38/05/354003805.db2.gz DBDLQPDMRMBIKO-AWEZNQCLSA-N 1 2 246.354 2.181 20 0 BEADLO CO[C@@H](C)CN(C)c1cc(C)[nH+]c(C(C)C)n1 ZINC000343807584 354010111 /nfs/dbraw/zinc/01/01/11/354010111.db2.gz LSIZENUMGQIOJI-NSHDSACASA-N 1 2 237.347 2.380 20 0 BEADLO Cc1cc(N[C@@H]2C[C@H]2C(F)F)nc(C(C)C)[nH+]1 ZINC000343782310 354017567 /nfs/dbraw/zinc/01/75/67/354017567.db2.gz NSWWJZJEYKQKAA-RKDXNWHRSA-N 1 2 241.285 2.396 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2ccc3c(n2)CCC3)[C@H]1C ZINC000334565834 354086737 /nfs/dbraw/zinc/08/67/37/354086737.db2.gz YNLMYLAFXQOMMD-NWDGAFQWSA-N 1 2 246.354 2.180 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2ccc3c(n2)CCC3)[C@H]1C ZINC000334565834 354086740 /nfs/dbraw/zinc/08/67/40/354086740.db2.gz YNLMYLAFXQOMMD-NWDGAFQWSA-N 1 2 246.354 2.180 20 0 BEADLO Cc1cc(NCC2(C(F)(F)F)CCC2)nc[nH+]1 ZINC000343976893 354056164 /nfs/dbraw/zinc/05/61/64/354056164.db2.gz SCUQAKKQLLDWFM-UHFFFAOYSA-N 1 2 245.248 2.351 20 0 BEADLO CCC[C@H](C)[N@@H+]1CCOCC(F)(F)C1 ZINC000344078014 354134720 /nfs/dbraw/zinc/13/47/20/354134720.db2.gz XDSUKUPEDQVTPW-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CCC[C@H](C)[N@H+]1CCOCC(F)(F)C1 ZINC000344078014 354134721 /nfs/dbraw/zinc/13/47/21/354134721.db2.gz XDSUKUPEDQVTPW-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@H](C)c2nnc(C)[nH]2)CCS1 ZINC000334561743 354116502 /nfs/dbraw/zinc/11/65/02/354116502.db2.gz FAKRYPYEWZUXOZ-PSASIEDQSA-N 1 2 240.376 2.002 20 0 BEADLO CC[C@@H]1C[N@H+]([C@H](C)c2nnc(C)[nH]2)CCS1 ZINC000334561743 354116505 /nfs/dbraw/zinc/11/65/05/354116505.db2.gz FAKRYPYEWZUXOZ-PSASIEDQSA-N 1 2 240.376 2.002 20 0 BEADLO Fc1cnccc1C[N@@H+]1CCC[C@H]1c1cc[nH]n1 ZINC000334562553 354119047 /nfs/dbraw/zinc/11/90/47/354119047.db2.gz MXHOJJCMKYQOPB-ZDUSSCGKSA-N 1 2 246.289 2.281 20 0 BEADLO Fc1cnccc1C[N@H+]1CCC[C@H]1c1cc[nH]n1 ZINC000334562553 354119049 /nfs/dbraw/zinc/11/90/49/354119049.db2.gz MXHOJJCMKYQOPB-ZDUSSCGKSA-N 1 2 246.289 2.281 20 0 BEADLO CC(C)[C@H](NC(=O)N(C)C(C)C)c1[nH]cc[nH+]1 ZINC000296260996 188572728 /nfs/dbraw/zinc/57/27/28/188572728.db2.gz YHWMJZHZXPNLKS-JTQLQIEISA-N 1 2 238.335 2.157 20 0 BEADLO CC[C@@H]1CC[C@@H]1[NH2+][C@@H](C)C(=O)OC(C)C ZINC000449658386 201998731 /nfs/dbraw/zinc/99/87/31/201998731.db2.gz AUAUHBKNBQAZPC-AXFHLTTASA-N 1 2 213.321 2.105 20 0 BEADLO COc1cccnc1C[NH2+]Cc1ccc(C)o1 ZINC000449746405 202017728 /nfs/dbraw/zinc/01/77/28/202017728.db2.gz FVXRUZGJOBQPDK-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO C[C@H](C(=O)NC[C@@H]1CCC[C@@H](C)C1)n1cc[nH+]c1 ZINC000055487867 1172171867 /nfs/dbraw/zinc/17/18/67/1172171867.db2.gz ZVZLYEORKCBIGO-JHJVBQTASA-N 1 2 249.358 2.387 20 0 BEADLO C[C@H](CF)[NH2+][C@@H](c1nnc[nH]1)C1CCCCC1 ZINC000639182945 354340104 /nfs/dbraw/zinc/34/01/04/354340104.db2.gz NEHSKYUDDPOYJI-MWLCHTKSSA-N 1 2 240.326 2.374 20 0 BEADLO Cc1ccc(-c2n[nH]cc2CNc2c[nH]c[nH+]2)o1 ZINC000577965138 366148596 /nfs/dbraw/zinc/14/85/96/366148596.db2.gz VHJOINIGPWHACB-UHFFFAOYSA-N 1 2 243.270 2.313 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2CCC3(CCC3)C2)no1 ZINC000334685272 354431523 /nfs/dbraw/zinc/43/15/23/354431523.db2.gz JKIGVHKYPBVIGN-SECBINFHSA-N 1 2 221.304 2.315 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2CCC3(CCC3)C2)no1 ZINC000334685272 354431526 /nfs/dbraw/zinc/43/15/26/354431526.db2.gz JKIGVHKYPBVIGN-SECBINFHSA-N 1 2 221.304 2.315 20 0 BEADLO Cn1ncc(Cl)c1C[NH+]1CC2(C1)CCCC2 ZINC000334645853 354435843 /nfs/dbraw/zinc/43/58/43/354435843.db2.gz OHJYFFWNCQBGOD-UHFFFAOYSA-N 1 2 239.750 2.450 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cccnc2)on1 ZINC000178945542 366188007 /nfs/dbraw/zinc/18/80/07/366188007.db2.gz HBINVTYWARFGRI-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cccnc2)on1 ZINC000178945542 366188013 /nfs/dbraw/zinc/18/80/13/366188013.db2.gz HBINVTYWARFGRI-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](Cc1cnccn1)C2 ZINC000334648271 354439353 /nfs/dbraw/zinc/43/93/53/354439353.db2.gz SPLWZIKUZZMHSB-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](Cc1cnccn1)C2 ZINC000334648271 354439355 /nfs/dbraw/zinc/43/93/55/354439355.db2.gz SPLWZIKUZZMHSB-UHFFFAOYSA-N 1 2 225.295 2.301 20 0 BEADLO CC1(CC(=O)Nc2c[nH+]c3n2CCCC3)CC1 ZINC000334669292 354410169 /nfs/dbraw/zinc/41/01/69/354410169.db2.gz WWLHUUHPLHMIMA-UHFFFAOYSA-N 1 2 233.315 2.348 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CCC(F)(F)[C@@H](C)C2)o1 ZINC000334669790 354410829 /nfs/dbraw/zinc/41/08/29/354410829.db2.gz WWAWCLKMGAQFPK-YUMQZZPRSA-N 1 2 245.273 2.416 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CCC(F)(F)[C@@H](C)C2)o1 ZINC000334669790 354410831 /nfs/dbraw/zinc/41/08/31/354410831.db2.gz WWAWCLKMGAQFPK-YUMQZZPRSA-N 1 2 245.273 2.416 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CC[C@](C)(F)C1 ZINC000334675222 354418093 /nfs/dbraw/zinc/41/80/93/354418093.db2.gz KEYFFHPNTZNGSB-LBPRGKRZSA-N 1 2 225.311 2.398 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CC[C@](C)(F)C1 ZINC000334675222 354418099 /nfs/dbraw/zinc/41/80/99/354418099.db2.gz KEYFFHPNTZNGSB-LBPRGKRZSA-N 1 2 225.311 2.398 20 0 BEADLO C1CC([NH+]2CCN(C3CCCC3)CC2)C1 ZINC000178979966 366197296 /nfs/dbraw/zinc/19/72/96/366197296.db2.gz XQSKNCMGVCAEOO-UHFFFAOYSA-N 1 2 208.349 2.099 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@@H](C(C)(C)C)C2)on1 ZINC000334683650 354429802 /nfs/dbraw/zinc/42/98/02/354429802.db2.gz CZKVVHPDZAXVCG-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@@H](C(C)(C)C)C2)on1 ZINC000334683650 354429805 /nfs/dbraw/zinc/42/98/05/354429805.db2.gz CZKVVHPDZAXVCG-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO O=C(Nc1c[nH+]c2n1CCCC2)[C@H]1C[C@@H]1C1CC1 ZINC000334655611 354449484 /nfs/dbraw/zinc/44/94/84/354449484.db2.gz VASOAIYTXHTTKL-MNOVXSKESA-N 1 2 245.326 2.204 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1nnc(C(C)(C)C)[nH]1 ZINC000334659321 354455973 /nfs/dbraw/zinc/45/59/73/354455973.db2.gz ITTQXKSVXKWUQS-IUCAKERBSA-N 1 2 222.336 2.085 20 0 BEADLO CC(=O)c1ccc(C[N@H+]2CCN(C)C[C@@H]2C)cc1 ZINC000334661309 354460950 /nfs/dbraw/zinc/46/09/50/354460950.db2.gz DCPYEBSNBGATIY-LBPRGKRZSA-N 1 2 246.354 2.025 20 0 BEADLO CC(=O)c1ccc(C[N@@H+]2CCN(C)C[C@@H]2C)cc1 ZINC000334661309 354460952 /nfs/dbraw/zinc/46/09/52/354460952.db2.gz DCPYEBSNBGATIY-LBPRGKRZSA-N 1 2 246.354 2.025 20 0 BEADLO Cc1cccc(CN2CCn3cc[nH+]c3C2)c1F ZINC000334663298 354463406 /nfs/dbraw/zinc/46/34/06/354463406.db2.gz PSQUUTOCINMTJR-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO C[C@@H]1CCCC[C@@H]1CCNC(=O)Cn1cc[nH+]c1 ZINC000578061026 366206981 /nfs/dbraw/zinc/20/69/81/366206981.db2.gz DTAXSSPIGKVQMJ-CHWSQXEVSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1cc(N2CC(C)(C)C[C@H]2C)nc[nH+]1 ZINC000334715606 354513900 /nfs/dbraw/zinc/51/39/00/354513900.db2.gz OQXXUDUDXXXTAY-SNVBAGLBSA-N 1 2 205.305 2.410 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CCO[C@H]2CCC[C@H]21 ZINC000334798489 354553371 /nfs/dbraw/zinc/55/33/71/354553371.db2.gz PSJHXWMLUHXULA-OLZOCXBDSA-N 1 2 249.358 2.217 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@H](C3CCC3)C2)nc1 ZINC000334814840 354573142 /nfs/dbraw/zinc/57/31/42/354573142.db2.gz GSESBGARMXPHKF-HNNXBMFYSA-N 1 2 246.354 2.391 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@H](C3CCC3)C2)nc1 ZINC000334814840 354573143 /nfs/dbraw/zinc/57/31/43/354573143.db2.gz GSESBGARMXPHKF-HNNXBMFYSA-N 1 2 246.354 2.391 20 0 BEADLO Cc1cnc(C[NH+]2C[C@@H](C)S[C@H](C)C2)nc1 ZINC000334754337 354575538 /nfs/dbraw/zinc/57/55/38/354575538.db2.gz DBOQNAIEHRAKPU-GHMZBOCLSA-N 1 2 237.372 2.111 20 0 BEADLO O=C([C@@H]1CCCc2[nH+]c[nH]c21)N1CCCCCC1 ZINC000334762273 354582198 /nfs/dbraw/zinc/58/21/98/354582198.db2.gz QIHOCJNMSIQLCO-LLVKDONJSA-N 1 2 247.342 2.232 20 0 BEADLO C[C@H]1CCCN(C(=O)[C@H]2CCCc3[nH+]c[nH]c32)C1 ZINC000334761994 354582299 /nfs/dbraw/zinc/58/22/99/354582299.db2.gz DAHLBGUJISTYFA-QWRGUYRKSA-N 1 2 247.342 2.088 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H](C)C1CCC1 ZINC000334769474 354591042 /nfs/dbraw/zinc/59/10/42/354591042.db2.gz GVARQOIOQHAXTD-SNVBAGLBSA-N 1 2 218.300 2.187 20 0 BEADLO Cc1ccc(C(=O)N[C@@H]2C[C@H](C)n3cc[nH+]c32)o1 ZINC000334743780 354547428 /nfs/dbraw/zinc/54/74/28/354547428.db2.gz MUNSHDIDFZMJSO-WCBMZHEXSA-N 1 2 245.282 2.220 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)C2CCCC2)c2[nH+]ccn21 ZINC000334744482 354548139 /nfs/dbraw/zinc/54/81/39/354548139.db2.gz SGNUOYPAARLOSM-MWLCHTKSSA-N 1 2 233.315 2.195 20 0 BEADLO Cc1cc(C)c(CNC(=O)[C@]2(C)C[C@H]2F)c[nH+]1 ZINC000335091223 354627668 /nfs/dbraw/zinc/62/76/68/354627668.db2.gz LOCGZJHRIAOVIF-DGCLKSJQSA-N 1 2 236.290 2.063 20 0 BEADLO Cc1cc(C)c(CNC(=O)[C@]2(C)C[C@@H]2F)c[nH+]1 ZINC000335091224 354627827 /nfs/dbraw/zinc/62/78/27/354627827.db2.gz LOCGZJHRIAOVIF-WCQYABFASA-N 1 2 236.290 2.063 20 0 BEADLO C[C@H]1CCCC[N@@H+]1Cc1nc(C(F)F)no1 ZINC000335097495 354637552 /nfs/dbraw/zinc/63/75/52/354637552.db2.gz DPNKAQBGIBRWNK-ZETCQYMHSA-N 1 2 231.246 2.382 20 0 BEADLO C[C@H]1CCCC[N@H+]1Cc1nc(C(F)F)no1 ZINC000335097495 354637555 /nfs/dbraw/zinc/63/75/55/354637555.db2.gz DPNKAQBGIBRWNK-ZETCQYMHSA-N 1 2 231.246 2.382 20 0 BEADLO C[NH2+]Cc1noc([C@H]2CCCC[C@@H]2C)n1 ZINC000335080478 354643219 /nfs/dbraw/zinc/64/32/19/354643219.db2.gz WWVGJFQLSLDOQI-IUCAKERBSA-N 1 2 209.293 2.083 20 0 BEADLO C[C@@H]1CCC[C@H](CC(=O)Nc2cc[nH+]cc2O)C1 ZINC000345382935 354646404 /nfs/dbraw/zinc/64/64/04/354646404.db2.gz UEAHWIZLCJZMEN-MNOVXSKESA-N 1 2 248.326 2.364 20 0 BEADLO CCn1ncnc1C[N@@H+]1CC(C)(C)[C@@H]1C(C)C ZINC000639204466 354655356 /nfs/dbraw/zinc/65/53/56/354655356.db2.gz QBTNNHPLHGJAFF-LBPRGKRZSA-N 1 2 236.363 2.164 20 0 BEADLO CCn1ncnc1C[N@H+]1CC(C)(C)[C@@H]1C(C)C ZINC000639204466 354655359 /nfs/dbraw/zinc/65/53/59/354655359.db2.gz QBTNNHPLHGJAFF-LBPRGKRZSA-N 1 2 236.363 2.164 20 0 BEADLO CC(C)CCN(C)c1nc[nH+]c(N)c1Cl ZINC000232548854 363375687 /nfs/dbraw/zinc/37/56/87/363375687.db2.gz RBCQMYMAAVVBKB-UHFFFAOYSA-N 1 2 228.727 2.195 20 0 BEADLO CC(C)CCN(C)c1[nH+]cnc(N)c1Cl ZINC000232548854 363375693 /nfs/dbraw/zinc/37/56/93/363375693.db2.gz RBCQMYMAAVVBKB-UHFFFAOYSA-N 1 2 228.727 2.195 20 0 BEADLO C[C@H]1C[C@H](NC(=O)CC2CCC2)c2[nH+]ccn21 ZINC000335141167 354845453 /nfs/dbraw/zinc/84/54/53/354845453.db2.gz OZLUBJGRRRDKJF-ONGXEEELSA-N 1 2 233.315 2.195 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)CCc1ccsc1 ZINC000346396377 354909596 /nfs/dbraw/zinc/90/95/96/354909596.db2.gz JWYOGCXTCMHPHK-UHFFFAOYSA-N 1 2 249.339 2.062 20 0 BEADLO C[C@@H]1c2ccccc2C[N@H+]1Cc1cc[nH]n1 ZINC000335167456 354926877 /nfs/dbraw/zinc/92/68/77/354926877.db2.gz VOZCGMDHSSVYJI-SNVBAGLBSA-N 1 2 213.284 2.487 20 0 BEADLO C[C@@H]1c2ccccc2C[N@@H+]1Cc1cc[nH]n1 ZINC000335167456 354926880 /nfs/dbraw/zinc/92/68/80/354926880.db2.gz VOZCGMDHSSVYJI-SNVBAGLBSA-N 1 2 213.284 2.487 20 0 BEADLO C[N@@H+](Cc1ncc(Cl)s1)C[C@@H]1CCCO1 ZINC000351983509 134025745 /nfs/dbraw/zinc/02/57/45/134025745.db2.gz TUHBBSKNMJSMTL-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO C[N@H+](Cc1ncc(Cl)s1)C[C@@H]1CCCO1 ZINC000351983509 134025746 /nfs/dbraw/zinc/02/57/46/134025746.db2.gz TUHBBSKNMJSMTL-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO CC(C)c1nc(N2C[C@@H](C)OC[C@@H]2C)cc[nH+]1 ZINC000346591541 354987010 /nfs/dbraw/zinc/98/70/10/354987010.db2.gz JDRJNMJOFQAHLW-WDEREUQCSA-N 1 2 235.331 2.214 20 0 BEADLO CC(C)c1nc(NCc2ccc(O)cc2)cc[nH+]1 ZINC000346610521 354992666 /nfs/dbraw/zinc/99/26/66/354992666.db2.gz WEJMVBQENHVGFE-UHFFFAOYSA-N 1 2 243.310 2.340 20 0 BEADLO CC[C@](C)(O)C[N@@H+]1CC[C@H](C)C(F)(F)C1 ZINC000335201185 355034534 /nfs/dbraw/zinc/03/45/34/355034534.db2.gz HFOBLBDZOFKGNP-UWVGGRQHSA-N 1 2 221.291 2.125 20 0 BEADLO CC[C@](C)(O)C[N@H+]1CC[C@H](C)C(F)(F)C1 ZINC000335201185 355034536 /nfs/dbraw/zinc/03/45/36/355034536.db2.gz HFOBLBDZOFKGNP-UWVGGRQHSA-N 1 2 221.291 2.125 20 0 BEADLO Fc1cccc2c1OCC[C@H]2[NH2+]Cc1cc[nH]n1 ZINC000335209470 355046014 /nfs/dbraw/zinc/04/60/14/355046014.db2.gz HXJYJLCYDMBWFF-GFCCVEGCSA-N 1 2 247.273 2.162 20 0 BEADLO Cc1nc(C(C)C)oc1C[N@@H+]1CCOC[C@H]1C ZINC000335228441 355070106 /nfs/dbraw/zinc/07/01/06/355070106.db2.gz ICGGXZBSSIGMLF-SNVBAGLBSA-N 1 2 238.331 2.327 20 0 BEADLO Cc1nc(C(C)C)oc1C[N@H+]1CCOC[C@H]1C ZINC000335228441 355070110 /nfs/dbraw/zinc/07/01/10/355070110.db2.gz ICGGXZBSSIGMLF-SNVBAGLBSA-N 1 2 238.331 2.327 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CCC[C@@H](F)C2)cc[nH+]1 ZINC000335228058 355070251 /nfs/dbraw/zinc/07/02/51/355070251.db2.gz ANXFTZKDCWDYLF-GHMZBOCLSA-N 1 2 236.290 2.279 20 0 BEADLO CC(C)c1nc(NCC2(C)CCOCC2)cc[nH+]1 ZINC000346697208 355063431 /nfs/dbraw/zinc/06/34/31/355063431.db2.gz BBFWWLRXRRVGAF-UHFFFAOYSA-N 1 2 249.358 2.251 20 0 BEADLO c1n[nH]nc1C[N@@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000335225235 355066566 /nfs/dbraw/zinc/06/65/66/355066566.db2.gz VJHDHUWYQHGUFU-ZDUSSCGKSA-N 1 2 232.331 2.127 20 0 BEADLO c1n[nH]nc1C[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000335225235 355066567 /nfs/dbraw/zinc/06/65/67/355066567.db2.gz VJHDHUWYQHGUFU-ZDUSSCGKSA-N 1 2 232.331 2.127 20 0 BEADLO Cc1ncc([C@H](C)[N@@H+]2CC[C@@H](F)C2)c(C)n1 ZINC000639228407 355104612 /nfs/dbraw/zinc/10/46/12/355104612.db2.gz OJVJRECQCDUFFT-GXSJLCMTSA-N 1 2 223.295 2.198 20 0 BEADLO Cc1ncc([C@H](C)[N@H+]2CC[C@@H](F)C2)c(C)n1 ZINC000639228407 355104616 /nfs/dbraw/zinc/10/46/16/355104616.db2.gz OJVJRECQCDUFFT-GXSJLCMTSA-N 1 2 223.295 2.198 20 0 BEADLO Cc1cc(NC(=O)N(C)[C@H]2CC[C@@H](C)C2)cc[nH+]1 ZINC000335231526 355091856 /nfs/dbraw/zinc/09/18/56/355091856.db2.gz RFFDCPYESXFGCK-MFKMUULPSA-N 1 2 247.342 2.464 20 0 BEADLO C[C@@H](C1CC1)N(C)C(=O)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000335234831 355095334 /nfs/dbraw/zinc/09/53/34/355095334.db2.gz LSCHUVRZKAMZSI-ONGXEEELSA-N 1 2 247.342 2.087 20 0 BEADLO COc1ccncc1C[N@H+](C)Cc1ccoc1 ZINC000346834977 355130644 /nfs/dbraw/zinc/13/06/44/355130644.db2.gz ZFXDAVGPSWCQIE-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO COc1ccncc1C[N@@H+](C)Cc1ccoc1 ZINC000346834977 355130649 /nfs/dbraw/zinc/13/06/49/355130649.db2.gz ZFXDAVGPSWCQIE-UHFFFAOYSA-N 1 2 232.283 2.315 20 0 BEADLO CCCC1(C(=O)Nc2cc[nH+]c(C)c2)CC1 ZINC000346839899 355132219 /nfs/dbraw/zinc/13/22/19/355132219.db2.gz HQZOLOMTPSLXBL-UHFFFAOYSA-N 1 2 218.300 2.331 20 0 BEADLO c1cnc(C[N@@H+]2CCC[C@H]2c2cccnc2)nc1 ZINC000346991411 355190230 /nfs/dbraw/zinc/19/02/30/355190230.db2.gz UOXXAZZWDFUNCL-ZDUSSCGKSA-N 1 2 240.310 2.209 20 0 BEADLO c1cnc(C[N@H+]2CCC[C@H]2c2cccnc2)nc1 ZINC000346991411 355190232 /nfs/dbraw/zinc/19/02/32/355190232.db2.gz UOXXAZZWDFUNCL-ZDUSSCGKSA-N 1 2 240.310 2.209 20 0 BEADLO CCCC[C@H]([NH2+][C@H]1CCCSC1)C(=O)OC ZINC000154597332 191327312 /nfs/dbraw/zinc/32/73/12/191327312.db2.gz ANSLKICNYMEQBS-QWRGUYRKSA-N 1 2 245.388 2.203 20 0 BEADLO C[C@@H]1C[C@H](C)CN1c1cc(NC2CC2)[nH+]cn1 ZINC000413157546 191356613 /nfs/dbraw/zinc/35/66/13/191356613.db2.gz UNHPRXMFLKZTNM-VHSXEESVSA-N 1 2 232.331 2.286 20 0 BEADLO C[C@@H]1C[C@H](C)CN1c1cc(NC2CC2)nc[nH+]1 ZINC000413157546 191356614 /nfs/dbraw/zinc/35/66/14/191356614.db2.gz UNHPRXMFLKZTNM-VHSXEESVSA-N 1 2 232.331 2.286 20 0 BEADLO Cc1[nH]c2ccc(CSCCCO)cc2[nH+]1 ZINC000413016039 191340436 /nfs/dbraw/zinc/34/04/36/191340436.db2.gz LFFFXFYZTNGYDJ-UHFFFAOYSA-N 1 2 236.340 2.487 20 0 BEADLO Cc1[nH]c2cc(CSCCCO)ccc2[nH+]1 ZINC000413016039 191340439 /nfs/dbraw/zinc/34/04/39/191340439.db2.gz LFFFXFYZTNGYDJ-UHFFFAOYSA-N 1 2 236.340 2.487 20 0 BEADLO C[C@H](Nc1cc(NC2CC2)[nH+]cn1)C1CC1 ZINC000413052250 191351103 /nfs/dbraw/zinc/35/11/03/191351103.db2.gz XXUGRDFAWYOBJQ-QMMMGPOBSA-N 1 2 218.304 2.261 20 0 BEADLO C[C@H](Nc1cc(NC2CC2)nc[nH+]1)C1CC1 ZINC000413052250 191351104 /nfs/dbraw/zinc/35/11/04/191351104.db2.gz XXUGRDFAWYOBJQ-QMMMGPOBSA-N 1 2 218.304 2.261 20 0 BEADLO CC[C@@H]1OCC[C@H]1Nc1cc[nH+]c2ccncc12 ZINC000413448965 191384534 /nfs/dbraw/zinc/38/45/34/191384534.db2.gz JUUIKIGHQUSNJW-KGLIPLIRSA-N 1 2 243.310 2.031 20 0 BEADLO CO[C@H]1C[C@@H](Nc2cc(C)[nH+]cn2)C12CCC2 ZINC000413446156 191384732 /nfs/dbraw/zinc/38/47/32/191384732.db2.gz PHORKNYGMOMJPU-MNOVXSKESA-N 1 2 233.315 2.155 20 0 BEADLO FC(F)n1ccc(C[N@@H+]2CCC23CCC3)n1 ZINC000347673087 355261599 /nfs/dbraw/zinc/26/15/99/355261599.db2.gz BPVUBEOLSHESGL-UHFFFAOYSA-N 1 2 227.258 2.407 20 0 BEADLO FC(F)n1ccc(C[N@H+]2CCC23CCC3)n1 ZINC000347673087 355261603 /nfs/dbraw/zinc/26/16/03/355261603.db2.gz BPVUBEOLSHESGL-UHFFFAOYSA-N 1 2 227.258 2.407 20 0 BEADLO C[C@@H]1CSCC[N@@H+]1Cc1ccn(C(F)F)n1 ZINC000347677592 355264478 /nfs/dbraw/zinc/26/44/78/355264478.db2.gz ICBUQCXLFUVXDZ-MRVPVSSYSA-N 1 2 247.314 2.216 20 0 BEADLO C[C@@H]1CSCC[N@H+]1Cc1ccn(C(F)F)n1 ZINC000347677592 355264481 /nfs/dbraw/zinc/26/44/81/355264481.db2.gz ICBUQCXLFUVXDZ-MRVPVSSYSA-N 1 2 247.314 2.216 20 0 BEADLO COCC1CCC(Nc2cc(C)[nH+]cn2)CC1 ZINC000413530065 191392583 /nfs/dbraw/zinc/39/25/83/191392583.db2.gz IMUYKTSQUNAJFP-UHFFFAOYSA-N 1 2 235.331 2.402 20 0 BEADLO CO[C@](C)([C@@H](C)Nc1cc(C)[nH+]cn1)C1CC1 ZINC000413524983 191392767 /nfs/dbraw/zinc/39/27/67/191392767.db2.gz XKLTWNPHMJDCIA-ZWNOBZJWSA-N 1 2 235.331 2.401 20 0 BEADLO C[C@@H]1C[C@@H](CNc2cc[nH+]c(C3CC3)n2)[C@H](C)O1 ZINC000413534548 191394333 /nfs/dbraw/zinc/39/43/33/191394333.db2.gz OXQVJHLOPZDBEF-SCVCMEIPSA-N 1 2 247.342 2.001 20 0 BEADLO CN(c1cc(NC2CC2)[nH+]cn1)C1CCC1 ZINC000413158206 191361821 /nfs/dbraw/zinc/36/18/21/191361821.db2.gz ASSVEIPKECSRKD-UHFFFAOYSA-N 1 2 218.304 2.040 20 0 BEADLO CN(c1cc(NC2CC2)nc[nH+]1)C1CCC1 ZINC000413158206 191361824 /nfs/dbraw/zinc/36/18/24/191361824.db2.gz ASSVEIPKECSRKD-UHFFFAOYSA-N 1 2 218.304 2.040 20 0 BEADLO F[C@H]1CC[C@H](Nc2cc(NC3CC3)[nH+]cn2)C1 ZINC000413290464 191369028 /nfs/dbraw/zinc/36/90/28/191369028.db2.gz AMJLSLORYFFLLM-WPRPVWTQSA-N 1 2 236.294 2.353 20 0 BEADLO F[C@H]1CC[C@H](Nc2cc(NC3CC3)nc[nH+]2)C1 ZINC000413290464 191369031 /nfs/dbraw/zinc/36/90/31/191369031.db2.gz AMJLSLORYFFLLM-WPRPVWTQSA-N 1 2 236.294 2.353 20 0 BEADLO F[C@@H]1CCC[C@@H]1Nc1cc(NC2CC2)[nH+]cn1 ZINC000413296780 191369548 /nfs/dbraw/zinc/36/95/48/191369548.db2.gz KOGAIVTUUPYNMV-ZJUUUORDSA-N 1 2 236.294 2.353 20 0 BEADLO F[C@@H]1CCC[C@@H]1Nc1cc(NC2CC2)nc[nH+]1 ZINC000413296780 191369550 /nfs/dbraw/zinc/36/95/50/191369550.db2.gz KOGAIVTUUPYNMV-ZJUUUORDSA-N 1 2 236.294 2.353 20 0 BEADLO FCCCCNc1cc(NC2CC2)nc[nH+]1 ZINC000413308788 191370980 /nfs/dbraw/zinc/37/09/80/191370980.db2.gz KMLTXYKMZMAFIT-UHFFFAOYSA-N 1 2 224.283 2.213 20 0 BEADLO FCCCCNc1cc(NC2CC2)[nH+]cn1 ZINC000413308788 191370981 /nfs/dbraw/zinc/37/09/81/191370981.db2.gz KMLTXYKMZMAFIT-UHFFFAOYSA-N 1 2 224.283 2.213 20 0 BEADLO Cc1ccc(CCNc2nccnc2C)[nH+]c1 ZINC000413343586 191373620 /nfs/dbraw/zinc/37/36/20/191373620.db2.gz AVLRGKSPXWZVBB-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO CCO[C@H]1C[C@@H](Nc2[nH+]c(C)nc3[nH]ccc32)C1 ZINC000413384404 191378186 /nfs/dbraw/zinc/37/81/86/191378186.db2.gz DYLHHIBNMPBATR-AOOOYVTPSA-N 1 2 246.314 2.246 20 0 BEADLO CCCOc1ccc(C[NH+]2CC(C)(O)C2)cc1 ZINC000639253567 355291245 /nfs/dbraw/zinc/29/12/45/355291245.db2.gz BESAFQYYOLHYJG-UHFFFAOYSA-N 1 2 235.327 2.042 20 0 BEADLO CCC1(C)C[NH+](Cc2ncnn2C(C)C)C1 ZINC000639255535 355298957 /nfs/dbraw/zinc/29/89/57/355298957.db2.gz UOGGHVHLWNJMHQ-UHFFFAOYSA-N 1 2 222.336 2.091 20 0 BEADLO COc1ccc[nH+]c1N[C@@H](C)[C@@H]1CCCOC1 ZINC000388856714 355301905 /nfs/dbraw/zinc/30/19/05/355301905.db2.gz GRVXFGGBPBVBDB-WDEREUQCSA-N 1 2 236.315 2.317 20 0 BEADLO CCCC[C@H]([NH2+]CC=C(C)C)C(=O)OC ZINC000191119063 355317607 /nfs/dbraw/zinc/31/76/07/355317607.db2.gz DJOCQRTYDRQULX-NSHDSACASA-N 1 2 213.321 2.274 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H]1[C@H](C2CC2)[C@@H]1C ZINC000528464807 355334060 /nfs/dbraw/zinc/33/40/60/355334060.db2.gz GGPWGESEZIKUKE-TVYUQYBPSA-N 1 2 230.311 2.043 20 0 BEADLO COc1cncc(C[NH+]2CC(C(F)F)C2)c1C ZINC000639252971 355287766 /nfs/dbraw/zinc/28/77/66/355287766.db2.gz XTCFCUWTFBJQHU-UHFFFAOYSA-N 1 2 242.269 2.096 20 0 BEADLO C[C@H]([NH2+]Cc1cnc2ccccn12)c1ccon1 ZINC000349232438 355372412 /nfs/dbraw/zinc/37/24/12/355372412.db2.gz CCACKBVOCKVQTF-JTQLQIEISA-N 1 2 242.282 2.173 20 0 BEADLO CCc1cc(N[C@@H](CC)C[C@H](C)CO)nc[nH+]1 ZINC000608369417 355380792 /nfs/dbraw/zinc/38/07/92/355380792.db2.gz WSCYNLQFZSBPHD-JQWIXIFHSA-N 1 2 237.347 2.248 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC[C@@H](C(F)(F)F)[C@@H]1C ZINC000335740263 355389998 /nfs/dbraw/zinc/38/99/98/355389998.db2.gz ZUMFRCZMTLLBNK-WCBMZHEXSA-N 1 2 247.264 2.491 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC[C@@H](C(F)(F)F)[C@@H]1C ZINC000335740263 355390002 /nfs/dbraw/zinc/39/00/02/355390002.db2.gz ZUMFRCZMTLLBNK-WCBMZHEXSA-N 1 2 247.264 2.491 20 0 BEADLO CC(C)(C(=O)N1CCC2(CCC2)C1)c1c[nH+]c[nH]1 ZINC000335777188 355403046 /nfs/dbraw/zinc/40/30/46/355403046.db2.gz VDPLMEOCRVYYQI-UHFFFAOYSA-N 1 2 247.342 2.090 20 0 BEADLO CSC1(C(=O)Nc2cc[nH+]cc2C)CCC1 ZINC000335783058 355430608 /nfs/dbraw/zinc/43/06/08/355430608.db2.gz SIHSIIVFKDPACJ-UHFFFAOYSA-N 1 2 236.340 2.036 20 0 BEADLO CC(C)c1nc(C[N@@H+]2C[C@@H](C)C[C@H]2C)no1 ZINC000335805980 355476872 /nfs/dbraw/zinc/47/68/72/355476872.db2.gz JJUMMLOLOQDHHP-VHSXEESVSA-N 1 2 223.320 2.423 20 0 BEADLO CC(C)c1nc(C[N@H+]2C[C@@H](C)C[C@H]2C)no1 ZINC000335805980 355476874 /nfs/dbraw/zinc/47/68/74/355476874.db2.gz JJUMMLOLOQDHHP-VHSXEESVSA-N 1 2 223.320 2.423 20 0 BEADLO Cc1cc(CN2CCn3cc[nH+]c3C2)ccc1F ZINC000335824240 355546016 /nfs/dbraw/zinc/54/60/16/355546016.db2.gz JSIPVQITKJCZCU-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1nc(C(C)(C)C)no1 ZINC000335817475 355507635 /nfs/dbraw/zinc/50/76/35/355507635.db2.gz NBENIWMZVJNFAI-IUCAKERBSA-N 1 2 223.320 2.350 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2C[C@H]2c2sccc2C)n1 ZINC000349873124 355513541 /nfs/dbraw/zinc/51/35/41/355513541.db2.gz DDYALNFOEJLPOJ-RKDXNWHRSA-N 1 2 249.339 2.430 20 0 BEADLO C[NH2+]Cc1noc([C@H](C)Cc2cccc(F)c2)n1 ZINC000349876077 355514554 /nfs/dbraw/zinc/51/45/54/355514554.db2.gz CQQMVSOFEWLYDM-SECBINFHSA-N 1 2 249.289 2.274 20 0 BEADLO Cc1nc(N2CCO[C@@H](C(C)C)C2)c(C)c(C)[nH+]1 ZINC000349914960 355525454 /nfs/dbraw/zinc/52/54/54/355525454.db2.gz LFFKWMWHHZHRDX-CYBMUJFWSA-N 1 2 249.358 2.263 20 0 BEADLO CN(C(=O)c1ccc2[nH+]ccn2c1)[C@@H]1CC1(C)C ZINC000335840722 355583755 /nfs/dbraw/zinc/58/37/55/355583755.db2.gz VKRNRJSFBCUFKL-LLVKDONJSA-N 1 2 243.310 2.205 20 0 BEADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2[nH]ncc2C)on1 ZINC000335835712 355562940 /nfs/dbraw/zinc/56/29/40/355562940.db2.gz IKRWSGJOMFDHNZ-GFCCVEGCSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1cc([C@H]2CCC[N@H+]2Cc2[nH]ncc2C)on1 ZINC000335835712 355562944 /nfs/dbraw/zinc/56/29/44/355562944.db2.gz IKRWSGJOMFDHNZ-GFCCVEGCSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2n[nH]cc2C)on1 ZINC000335835712 355562947 /nfs/dbraw/zinc/56/29/47/355562947.db2.gz IKRWSGJOMFDHNZ-GFCCVEGCSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1cc([C@H]2CCC[N@H+]2Cc2n[nH]cc2C)on1 ZINC000335835712 355562951 /nfs/dbraw/zinc/56/29/51/355562951.db2.gz IKRWSGJOMFDHNZ-GFCCVEGCSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1cccc(C[N@@H+]2CCc3n[nH]cc3C2)c1F ZINC000623242578 355579667 /nfs/dbraw/zinc/57/96/67/355579667.db2.gz BMMDPQUAWFFRHU-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1cccc(C[N@H+]2CCc3n[nH]cc3C2)c1F ZINC000623242578 355579671 /nfs/dbraw/zinc/57/96/71/355579671.db2.gz BMMDPQUAWFFRHU-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO CC(C)C1(C[N@@H+]2CC[C@@H](O)C(F)(F)C2)CC1 ZINC000639311693 355671100 /nfs/dbraw/zinc/67/11/00/355671100.db2.gz VLGFMHUSTIQIQY-SNVBAGLBSA-N 1 2 233.302 2.125 20 0 BEADLO CC(C)C1(C[N@H+]2CC[C@@H](O)C(F)(F)C2)CC1 ZINC000639311693 355671103 /nfs/dbraw/zinc/67/11/03/355671103.db2.gz VLGFMHUSTIQIQY-SNVBAGLBSA-N 1 2 233.302 2.125 20 0 BEADLO Cn1c2cccc(F)c2[nH]c1=[NH+]CC1CCC1 ZINC000350311623 355667702 /nfs/dbraw/zinc/66/77/02/355667702.db2.gz JIWQVBVEBYHSOV-UHFFFAOYSA-N 1 2 233.290 2.346 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)c1cncs1 ZINC000350175767 355619576 /nfs/dbraw/zinc/61/95/76/355619576.db2.gz JENYFCQIIGQZRK-UHFFFAOYSA-N 1 2 244.279 2.043 20 0 BEADLO COCc1ccc(C[N@H+](C)Cc2ccccn2)o1 ZINC000350361806 355692664 /nfs/dbraw/zinc/69/26/64/355692664.db2.gz WOWVRYDPFONZCX-UHFFFAOYSA-N 1 2 246.310 2.453 20 0 BEADLO COCc1ccc(C[N@@H+](C)Cc2ccccn2)o1 ZINC000350361806 355692667 /nfs/dbraw/zinc/69/26/67/355692667.db2.gz WOWVRYDPFONZCX-UHFFFAOYSA-N 1 2 246.310 2.453 20 0 BEADLO Cc1nnc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)o1 ZINC000336006770 134049279 /nfs/dbraw/zinc/04/92/79/134049279.db2.gz ZUMWTXWNWOOPQV-POYBYMJQSA-N 1 2 249.236 2.151 20 0 BEADLO Cc1nnc(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)o1 ZINC000336006770 134049280 /nfs/dbraw/zinc/04/92/80/134049280.db2.gz ZUMWTXWNWOOPQV-POYBYMJQSA-N 1 2 249.236 2.151 20 0 BEADLO CC(C)c1cc(NCCCn2cc[nH+]c2)ncn1 ZINC000040766208 358498377 /nfs/dbraw/zinc/49/83/77/358498377.db2.gz WWHSPPIKIUPUCO-UHFFFAOYSA-N 1 2 245.330 2.299 20 0 BEADLO Cc1cnc(C[NH2+][C@@H]2CCc3ccc(O)cc32)o1 ZINC000639319585 355719989 /nfs/dbraw/zinc/71/99/89/355719989.db2.gz ZAOIKPBKJKYBOS-CYBMUJFWSA-N 1 2 244.294 2.466 20 0 BEADLO COc1ccc(C[N@@H+]2CCC=C(F)C2)cc1O ZINC000335892863 355686345 /nfs/dbraw/zinc/68/63/45/355686345.db2.gz QOQMUVQLKDHXRR-UHFFFAOYSA-N 1 2 237.274 2.460 20 0 BEADLO COc1ccc(C[N@H+]2CCC=C(F)C2)cc1O ZINC000335892863 355686347 /nfs/dbraw/zinc/68/63/47/355686347.db2.gz QOQMUVQLKDHXRR-UHFFFAOYSA-N 1 2 237.274 2.460 20 0 BEADLO CO[C@H]1CC[C@@H](Nc2cc[nH+]c3ccncc23)C1 ZINC000350700577 355743622 /nfs/dbraw/zinc/74/36/22/355743622.db2.gz KBKTUXZPIUNCHN-MNOVXSKESA-N 1 2 243.310 2.031 20 0 BEADLO CCC[C@@H](C[N@H+](C)Cc1nnc(C)s1)OC ZINC000639332238 355757657 /nfs/dbraw/zinc/75/76/57/355757657.db2.gz HBPYBMSBBKBNJS-JTQLQIEISA-N 1 2 243.376 2.093 20 0 BEADLO CCC[C@@H](C[N@@H+](C)Cc1nnc(C)s1)OC ZINC000639332238 355757659 /nfs/dbraw/zinc/75/76/59/355757659.db2.gz HBPYBMSBBKBNJS-JTQLQIEISA-N 1 2 243.376 2.093 20 0 BEADLO Cc1cnc(C[NH2+][C@H](c2ccccc2)[C@@H](C)O)o1 ZINC000639333645 355763186 /nfs/dbraw/zinc/76/31/86/355763186.db2.gz YQONGVGGXXENAV-RISCZKNCSA-N 1 2 246.310 2.195 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)NC(C)(C)C(C)(C)C ZINC000350812889 355769321 /nfs/dbraw/zinc/76/93/21/355769321.db2.gz OVDNNSBOXGHUSI-UHFFFAOYSA-N 1 2 237.347 2.202 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)NC(C)(C)C(C)(C)C ZINC000350812889 355769323 /nfs/dbraw/zinc/76/93/23/355769323.db2.gz OVDNNSBOXGHUSI-UHFFFAOYSA-N 1 2 237.347 2.202 20 0 BEADLO c1cc(C[NH+]2CC(Cc3ccsc3)C2)no1 ZINC000639341188 355782809 /nfs/dbraw/zinc/78/28/09/355782809.db2.gz PTJHUNHKXDBYSW-UHFFFAOYSA-N 1 2 234.324 2.411 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)[C@H]1/C=C/CCCCC1 ZINC000336039880 134061126 /nfs/dbraw/zinc/06/11/26/134061126.db2.gz JYCWYVNPGHJUGO-ZRQQLDRUSA-N 1 2 220.320 2.125 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)[C@H]1/C=C/CCCCC1 ZINC000336039880 134061127 /nfs/dbraw/zinc/06/11/27/134061127.db2.gz JYCWYVNPGHJUGO-ZRQQLDRUSA-N 1 2 220.320 2.125 20 0 BEADLO C[C@H]1[C@H](c2ccccc2)C[C@@H]1[NH2+]Cc1cn[nH]n1 ZINC000628363757 355850452 /nfs/dbraw/zinc/85/04/52/355850452.db2.gz XACAIWAJHNWYLU-GDLCADMTSA-N 1 2 242.326 2.087 20 0 BEADLO C[C@H]1CC[C@@H](CC(=O)N2CC(n3cc[nH+]c3)C2)C1 ZINC000532092071 355852460 /nfs/dbraw/zinc/85/24/60/355852460.db2.gz DKQYNMQJIGCWEK-NWDGAFQWSA-N 1 2 247.342 2.093 20 0 BEADLO CCc1cccc(F)c1C[NH2+]Cc1ncc[nH]1 ZINC000639369832 355857414 /nfs/dbraw/zinc/85/74/14/355857414.db2.gz CHYHRZLVZUSTIE-UHFFFAOYSA-N 1 2 233.290 2.401 20 0 BEADLO C[C@H]1C[C@H](Nc2c[nH+]cc(N(C)C)c2)CS1 ZINC000639363697 355829269 /nfs/dbraw/zinc/82/92/69/355829269.db2.gz FAJZNFJSUPVAFD-ONGXEEELSA-N 1 2 237.372 2.454 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@H](C)c2nc(C)no2)CCS1 ZINC000608510563 355832569 /nfs/dbraw/zinc/83/25/69/355832569.db2.gz PQWIJHQKDFSMLV-PSASIEDQSA-N 1 2 241.360 2.266 20 0 BEADLO CC[C@@H]1C[N@H+]([C@H](C)c2nc(C)no2)CCS1 ZINC000608510563 355832574 /nfs/dbraw/zinc/83/25/74/355832574.db2.gz PQWIJHQKDFSMLV-PSASIEDQSA-N 1 2 241.360 2.266 20 0 BEADLO CC[C@H]1C[N@@H+]([C@H](C)c2nc(C)no2)CCS1 ZINC000608510564 355832770 /nfs/dbraw/zinc/83/27/70/355832770.db2.gz PQWIJHQKDFSMLV-SCZZXKLOSA-N 1 2 241.360 2.266 20 0 BEADLO CC[C@H]1C[N@H+]([C@H](C)c2nc(C)no2)CCS1 ZINC000608510564 355832771 /nfs/dbraw/zinc/83/27/71/355832771.db2.gz PQWIJHQKDFSMLV-SCZZXKLOSA-N 1 2 241.360 2.266 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)Nc1ccccc1F ZINC000336044385 134063192 /nfs/dbraw/zinc/06/31/92/134063192.db2.gz VVGDYMDXSPFHPJ-UHFFFAOYSA-N 1 2 233.246 2.038 20 0 BEADLO COc1ccccc1CNc1cccc(CO)[nH+]1 ZINC000351323072 355978968 /nfs/dbraw/zinc/97/89/68/355978968.db2.gz DVYGILWLHCQSIA-UHFFFAOYSA-N 1 2 244.294 2.195 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2conc2CC)CCO1 ZINC000351623972 356033171 /nfs/dbraw/zinc/03/31/71/356033171.db2.gz LHKHROHXEJTIRR-LBPRGKRZSA-N 1 2 238.331 2.238 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2conc2CC)CCO1 ZINC000351623972 356033175 /nfs/dbraw/zinc/03/31/75/356033175.db2.gz LHKHROHXEJTIRR-LBPRGKRZSA-N 1 2 238.331 2.238 20 0 BEADLO C[C@H](c1cccc(F)c1)[N@@H+]1CCc2nn[nH]c2C1 ZINC000351638303 356039738 /nfs/dbraw/zinc/03/97/38/356039738.db2.gz BPJYYCNFZGPBFF-SECBINFHSA-N 1 2 246.289 2.063 20 0 BEADLO C[C@H](c1cccc(F)c1)[N@H+]1CCc2nn[nH]c2C1 ZINC000351638303 356039741 /nfs/dbraw/zinc/03/97/41/356039741.db2.gz BPJYYCNFZGPBFF-SECBINFHSA-N 1 2 246.289 2.063 20 0 BEADLO NC(=O)CCOc1ccc([NH2+]C2CCCC2)cc1 ZINC000036934184 181226672 /nfs/dbraw/zinc/22/66/72/181226672.db2.gz CCBYISLVAMUVMI-UHFFFAOYSA-N 1 2 248.326 2.295 20 0 BEADLO COCc1cc(C[NH+]2CCC(C)(F)CC2)no1 ZINC000639389456 356015196 /nfs/dbraw/zinc/01/51/96/356015196.db2.gz XAWVJQVBIWYHED-UHFFFAOYSA-N 1 2 242.294 2.145 20 0 BEADLO C/C=C/C[C@@H](CO)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC000351585073 356021996 /nfs/dbraw/zinc/02/19/96/356021996.db2.gz KPWLHWNJUNDWGU-FSIBCCDJSA-N 1 2 246.314 2.005 20 0 BEADLO CCC(C)(C)[C@@H](C)NC(=O)C[NH+]1CC(C)(C)C1 ZINC000617567585 356122188 /nfs/dbraw/zinc/12/21/88/356122188.db2.gz LPYVMRCPQBETFC-LLVKDONJSA-N 1 2 240.391 2.269 20 0 BEADLO COCc1cnc(C[NH+]2CC(C)(C)C2)s1 ZINC000639393908 356076547 /nfs/dbraw/zinc/07/65/47/356076547.db2.gz XFUMGVNQSURMFH-UHFFFAOYSA-N 1 2 226.345 2.131 20 0 BEADLO C[C@H](F)CC[N@H+](C)Cc1nccn1C(F)F ZINC000351863607 356100145 /nfs/dbraw/zinc/10/01/45/356100145.db2.gz QRONWRXOAONGPG-QMMMGPOBSA-N 1 2 235.253 2.458 20 0 BEADLO C[C@H](F)CC[N@@H+](C)Cc1nccn1C(F)F ZINC000351863607 356100149 /nfs/dbraw/zinc/10/01/49/356100149.db2.gz QRONWRXOAONGPG-QMMMGPOBSA-N 1 2 235.253 2.458 20 0 BEADLO CCc1ccc(C[NH+]2C[C@H](C)O[C@@H](C)C2)cn1 ZINC000335916427 356157465 /nfs/dbraw/zinc/15/74/65/356157465.db2.gz YJCSYCAPWPSVEP-RYUDHWBXSA-N 1 2 234.343 2.253 20 0 BEADLO CCC(C)(C)[C@@H](C)NC(=O)CCn1cc[nH+]c1 ZINC000617571408 356134771 /nfs/dbraw/zinc/13/47/71/356134771.db2.gz MGTTUAHSARHZGE-LLVKDONJSA-N 1 2 237.347 2.214 20 0 BEADLO C[N@H+](CCOc1cccc(F)c1)Cc1cc[nH]n1 ZINC000351888575 356149609 /nfs/dbraw/zinc/14/96/09/356149609.db2.gz JCIRDTJJAWDZEK-UHFFFAOYSA-N 1 2 249.289 2.060 20 0 BEADLO C[N@@H+](CCOc1cccc(F)c1)Cc1cc[nH]n1 ZINC000351888575 356149613 /nfs/dbraw/zinc/14/96/13/356149613.db2.gz JCIRDTJJAWDZEK-UHFFFAOYSA-N 1 2 249.289 2.060 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+]C12C[C@H](C)C[C@@H](C)C2 ZINC000639427704 356208850 /nfs/dbraw/zinc/20/88/50/356208850.db2.gz OCLAFZRHUAXJCD-GHMZBOCLSA-N 1 2 238.375 2.369 20 0 BEADLO Cc1nnc(C[N@H+]2Cc3ccccc3C[C@H]2C)[nH]1 ZINC000336111043 134086474 /nfs/dbraw/zinc/08/64/74/134086474.db2.gz NDUILHVIBBFRMG-SNVBAGLBSA-N 1 2 242.326 2.060 20 0 BEADLO Cc1nnc(C[N@@H+]2Cc3ccccc3C[C@H]2C)[nH]1 ZINC000336111043 134086475 /nfs/dbraw/zinc/08/64/75/134086475.db2.gz NDUILHVIBBFRMG-SNVBAGLBSA-N 1 2 242.326 2.060 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCCO[C@@H](C)C1 ZINC000639473288 356266122 /nfs/dbraw/zinc/26/61/22/356266122.db2.gz XWUIYJLZEIEJJL-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CCC(F)(F)C[N@H+]1CCCO[C@@H](C)C1 ZINC000639473288 356266123 /nfs/dbraw/zinc/26/61/23/356266123.db2.gz XWUIYJLZEIEJJL-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO COC[C@@H](Nc1c[nH+]ccc1C)C1CC1 ZINC000087480447 491089024 /nfs/dbraw/zinc/08/90/24/491089024.db2.gz PQGZZZUAEXIBCL-GFCCVEGCSA-N 1 2 206.289 2.227 20 0 BEADLO CC(=O)C[N@H+](Cc1ccc(C)o1)C1CC1 ZINC000639453737 356237836 /nfs/dbraw/zinc/23/78/36/356237836.db2.gz QVNOITBEMBUVPM-UHFFFAOYSA-N 1 2 207.273 2.141 20 0 BEADLO CC(=O)C[N@@H+](Cc1ccc(C)o1)C1CC1 ZINC000639453737 356237837 /nfs/dbraw/zinc/23/78/37/356237837.db2.gz QVNOITBEMBUVPM-UHFFFAOYSA-N 1 2 207.273 2.141 20 0 BEADLO CC(=O)C[N@H+](Cc1cccc(F)c1)C1CC1 ZINC000639454572 356239522 /nfs/dbraw/zinc/23/95/22/356239522.db2.gz FKMQDSAGZYPLGF-UHFFFAOYSA-N 1 2 221.275 2.379 20 0 BEADLO CC(=O)C[N@@H+](Cc1cccc(F)c1)C1CC1 ZINC000639454572 356239525 /nfs/dbraw/zinc/23/95/25/356239525.db2.gz FKMQDSAGZYPLGF-UHFFFAOYSA-N 1 2 221.275 2.379 20 0 BEADLO Cc1cc(NC(=O)N2CC[C@H]3CCC[C@@H]32)cc[nH+]1 ZINC000336119291 134089701 /nfs/dbraw/zinc/08/97/01/134089701.db2.gz VWFQZSCDBSHFSM-YPMHNXCESA-N 1 2 245.326 2.218 20 0 BEADLO CC(=O)C[N@@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000639492618 356318542 /nfs/dbraw/zinc/31/85/42/356318542.db2.gz DPXIGHKNHCNEMK-CYBMUJFWSA-N 1 2 235.352 2.366 20 0 BEADLO CC(=O)C[N@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000639492618 356318543 /nfs/dbraw/zinc/31/85/43/356318543.db2.gz DPXIGHKNHCNEMK-CYBMUJFWSA-N 1 2 235.352 2.366 20 0 BEADLO CC1(C)CCC[C@@H]1C(=O)N1CCn2cc[nH+]c2C1 ZINC000335707574 535301971 /nfs/dbraw/zinc/30/19/71/535301971.db2.gz OLLGDUPBZCKHLB-LLVKDONJSA-N 1 2 247.342 2.052 20 0 BEADLO CC[C@@H]1CCCN1C(=O)Nc1cc[nH+]cc1C ZINC000336445385 356371418 /nfs/dbraw/zinc/37/14/18/356371418.db2.gz UZGUEKBMSNRSBT-LLVKDONJSA-N 1 2 233.315 2.218 20 0 BEADLO CCC(F)(F)C[N@H+](C)[C@@H]1CCSC1 ZINC000639546449 356408577 /nfs/dbraw/zinc/40/85/77/356408577.db2.gz AHEPPAWUKVBEAQ-MRVPVSSYSA-N 1 2 209.305 2.469 20 0 BEADLO CCC(F)(F)C[N@@H+](C)[C@@H]1CCSC1 ZINC000639546449 356408579 /nfs/dbraw/zinc/40/85/79/356408579.db2.gz AHEPPAWUKVBEAQ-MRVPVSSYSA-N 1 2 209.305 2.469 20 0 BEADLO CC[C@H]1C[C@H](Nc2cc[nH+]c(C3CC3)n2)CCO1 ZINC000420623528 192250638 /nfs/dbraw/zinc/25/06/38/192250638.db2.gz VGBWUKMAWWPCCN-NEPJUHHUSA-N 1 2 247.342 2.145 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@@H](C(F)F)C2)[nH]c1C ZINC000639554925 356460275 /nfs/dbraw/zinc/46/02/75/356460275.db2.gz LZHJGPLDMMOZMM-SECBINFHSA-N 1 2 229.274 2.114 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@@H](C(F)F)C2)[nH]c1C ZINC000639554925 356460277 /nfs/dbraw/zinc/46/02/77/356460277.db2.gz LZHJGPLDMMOZMM-SECBINFHSA-N 1 2 229.274 2.114 20 0 BEADLO Cc1[nH]c(CN2CC[C@@H](C(F)F)C2)[nH+]c1C ZINC000639554925 356460279 /nfs/dbraw/zinc/46/02/79/356460279.db2.gz LZHJGPLDMMOZMM-SECBINFHSA-N 1 2 229.274 2.114 20 0 BEADLO C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)Cn1cc[nH+]c1 ZINC000580378123 356438013 /nfs/dbraw/zinc/43/80/13/356438013.db2.gz GMQQWBWKJWZSRH-JHJVBQTASA-N 1 2 247.342 2.063 20 0 BEADLO COc1cccc(F)c1[C@H](C)[NH2+]CC(C)=O ZINC000639566536 356485387 /nfs/dbraw/zinc/48/53/87/356485387.db2.gz SYOLONCPJFHLBV-VIFPVBQESA-N 1 2 225.263 2.074 20 0 BEADLO Cc1cc(CNC(=O)NCCC2CC2)cc(C)[nH+]1 ZINC000420795307 192261341 /nfs/dbraw/zinc/26/13/41/192261341.db2.gz LOJPOYAQYSQSDV-UHFFFAOYSA-N 1 2 247.342 2.298 20 0 BEADLO CC(C)c1nc(N2C[C@H](CO)C[C@H](C)C2)cc[nH+]1 ZINC000420640573 192253638 /nfs/dbraw/zinc/25/36/38/192253638.db2.gz YVKUOISKPZGSNE-NWDGAFQWSA-N 1 2 249.358 2.055 20 0 BEADLO CC(C)c1nc(N2C[C@@H](C)C[C@H](CO)C2)cc[nH+]1 ZINC000420640574 192253675 /nfs/dbraw/zinc/25/36/75/192253675.db2.gz YVKUOISKPZGSNE-RYUDHWBXSA-N 1 2 249.358 2.055 20 0 BEADLO Cc1cc(CNc2ncncc2Cl)cc(C)[nH+]1 ZINC000420656515 192256432 /nfs/dbraw/zinc/25/64/32/192256432.db2.gz UQDAWTGAWMLBEH-UHFFFAOYSA-N 1 2 248.717 2.176 20 0 BEADLO CC1=CC[N@H+](Cc2nc(CC3CC3)no2)CC1 ZINC000639571107 356495046 /nfs/dbraw/zinc/49/50/46/356495046.db2.gz VYPWQIDVOPZJMU-UHFFFAOYSA-N 1 2 233.315 2.174 20 0 BEADLO CC1=CC[N@@H+](Cc2nc(CC3CC3)no2)CC1 ZINC000639571107 356495048 /nfs/dbraw/zinc/49/50/48/356495048.db2.gz VYPWQIDVOPZJMU-UHFFFAOYSA-N 1 2 233.315 2.174 20 0 BEADLO C[C@H]1Cc2ccccc2[N@@H+](C[C@H]2C[C@@H](O)C2)C1 ZINC000420906203 192270458 /nfs/dbraw/zinc/27/04/58/192270458.db2.gz RZEZNZIJCPSYSU-SGMGOOAPSA-N 1 2 231.339 2.456 20 0 BEADLO C[C@H]1Cc2ccccc2[N@H+](C[C@H]2C[C@@H](O)C2)C1 ZINC000420906203 192270459 /nfs/dbraw/zinc/27/04/59/192270459.db2.gz RZEZNZIJCPSYSU-SGMGOOAPSA-N 1 2 231.339 2.456 20 0 BEADLO CC[C@@H]1C[NH+](Cc2ccon2)C[C@@H](CC)O1 ZINC000420952063 192277672 /nfs/dbraw/zinc/27/76/72/192277672.db2.gz HWRGXGQHLDMCCP-VXGBXAGGSA-N 1 2 224.304 2.064 20 0 BEADLO COC[C@@H](C)[N@H+](C)Cc1csc(C2CC2)n1 ZINC000179480927 366263016 /nfs/dbraw/zinc/26/30/16/366263016.db2.gz CGDCDBHMJPUMFG-SECBINFHSA-N 1 2 240.372 2.487 20 0 BEADLO COC[C@@H](C)[N@@H+](C)Cc1csc(C2CC2)n1 ZINC000179480927 366263023 /nfs/dbraw/zinc/26/30/23/366263023.db2.gz CGDCDBHMJPUMFG-SECBINFHSA-N 1 2 240.372 2.487 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C)ncn2)C[C@H](CC)O1 ZINC000420959664 192281658 /nfs/dbraw/zinc/28/16/58/192281658.db2.gz QLPSUXVDLLYDEP-OKILXGFUSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C)ncn2)C[C@H](CC)O1 ZINC000420959664 192281660 /nfs/dbraw/zinc/28/16/60/192281660.db2.gz QLPSUXVDLLYDEP-OKILXGFUSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@H]1C[NH+](Cc2cnc(C)nc2)C[C@H](CC)O1 ZINC000420961406 192282213 /nfs/dbraw/zinc/28/22/13/192282213.db2.gz SHFIFLYELOZTID-KBPBESRZSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ncc(C)o2)C[C@H](CC)O1 ZINC000420962443 192283918 /nfs/dbraw/zinc/28/39/18/192283918.db2.gz UHNBNYWGFJRLHM-TXEJJXNPSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ncc(C)o2)C[C@H](CC)O1 ZINC000420962443 192283920 /nfs/dbraw/zinc/28/39/20/192283920.db2.gz UHNBNYWGFJRLHM-TXEJJXNPSA-N 1 2 238.331 2.372 20 0 BEADLO CCC(F)(F)C[NH2+][C@@H](CO)c1cccc(F)c1 ZINC000639597553 356516222 /nfs/dbraw/zinc/51/62/22/356516222.db2.gz LQBPLGRQSCNMAR-NSHDSACASA-N 1 2 247.260 2.494 20 0 BEADLO CCn1cc[nH+]c1[C@H]1CCCCN1CC(C)=O ZINC000639623803 356543647 /nfs/dbraw/zinc/54/36/47/356543647.db2.gz MSPXYGAVEPMJFH-GFCCVEGCSA-N 1 2 235.331 2.019 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1nc(C2CCC2)no1 ZINC000639618380 356535708 /nfs/dbraw/zinc/53/57/08/356535708.db2.gz JZMGYQDSCYPBTO-RKDXNWHRSA-N 1 2 221.304 2.320 20 0 BEADLO CC[N@H+](C[C@H]1C[C@@H](O)C1)c1ccccc1 ZINC000420941205 192288481 /nfs/dbraw/zinc/28/84/81/192288481.db2.gz SLRKUEPINNLUBJ-BJHJDKERSA-N 1 2 205.301 2.284 20 0 BEADLO CC[N@@H+](C[C@H]1C[C@@H](O)C1)c1ccccc1 ZINC000420941205 192288483 /nfs/dbraw/zinc/28/84/83/192288483.db2.gz SLRKUEPINNLUBJ-BJHJDKERSA-N 1 2 205.301 2.284 20 0 BEADLO CC1=C[C@H](C)C[N@H+](Cc2nc(CC3CC3)no2)C1 ZINC000639624839 356538573 /nfs/dbraw/zinc/53/85/73/356538573.db2.gz WZHAIYPSFWWXMU-JTQLQIEISA-N 1 2 247.342 2.420 20 0 BEADLO CC1=C[C@H](C)C[N@@H+](Cc2nc(CC3CC3)no2)C1 ZINC000639624839 356538579 /nfs/dbraw/zinc/53/85/79/356538579.db2.gz WZHAIYPSFWWXMU-JTQLQIEISA-N 1 2 247.342 2.420 20 0 BEADLO CCc1cnc(CCNc2cc(C)[nH+]cn2)s1 ZINC000301465707 356540308 /nfs/dbraw/zinc/54/03/08/356540308.db2.gz LJURMYCCNGFOTO-UHFFFAOYSA-N 1 2 248.355 2.459 20 0 BEADLO CC(=O)C[NH+]1CCC(CC(F)(F)F)CC1 ZINC000639633138 356547315 /nfs/dbraw/zinc/54/73/15/356547315.db2.gz QKKFTMPNFXZEHI-UHFFFAOYSA-N 1 2 223.238 2.240 20 0 BEADLO CCC(F)(F)C[N@H+](C)[C@@H]1CCCOC1 ZINC000639637870 356551923 /nfs/dbraw/zinc/55/19/23/356551923.db2.gz KFDZAQUBCZVTJQ-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CCC(F)(F)C[N@@H+](C)[C@@H]1CCCOC1 ZINC000639637870 356551925 /nfs/dbraw/zinc/55/19/25/356551925.db2.gz KFDZAQUBCZVTJQ-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CCC(F)(F)C[N@@H+]1CC[C@H](n2cc(C)cn2)C1 ZINC000639648427 356555533 /nfs/dbraw/zinc/55/55/33/356555533.db2.gz IKZHMVSTFSJXME-NSHDSACASA-N 1 2 243.301 2.484 20 0 BEADLO CCC(F)(F)C[N@H+]1CC[C@H](n2cc(C)cn2)C1 ZINC000639648427 356555534 /nfs/dbraw/zinc/55/55/34/356555534.db2.gz IKZHMVSTFSJXME-NSHDSACASA-N 1 2 243.301 2.484 20 0 BEADLO CC[C@@H](O)CCNc1cc[nH+]c(C(C)(C)C)n1 ZINC000301639029 356556691 /nfs/dbraw/zinc/55/66/91/356556691.db2.gz AUDNSPBHSYFQRZ-SNVBAGLBSA-N 1 2 237.347 2.347 20 0 BEADLO CC[C@H](CC(C)C)C(=O)NCc1[nH+]ccn1C ZINC000449839419 202044303 /nfs/dbraw/zinc/04/43/03/202044303.db2.gz MEMBLDXOLJOUMS-LLVKDONJSA-N 1 2 237.347 2.109 20 0 BEADLO Cc1cc(N[C@H](C)c2ccon2)nc(C(C)C)[nH+]1 ZINC000353269465 134129536 /nfs/dbraw/zinc/12/95/36/134129536.db2.gz UEGUBJZGJMHSAC-SNVBAGLBSA-N 1 2 246.314 2.491 20 0 BEADLO C[C@@H]1C[N@H+](CC(=O)c2ccccc2F)[C@@H]1C ZINC000639654698 356559434 /nfs/dbraw/zinc/55/94/34/356559434.db2.gz GDNCHPJRTRZFOZ-NXEZZACHSA-N 1 2 221.275 2.349 20 0 BEADLO C[C@@H]1C[N@@H+](CC(=O)c2ccccc2F)[C@@H]1C ZINC000639654698 356559435 /nfs/dbraw/zinc/55/94/35/356559435.db2.gz GDNCHPJRTRZFOZ-NXEZZACHSA-N 1 2 221.275 2.349 20 0 BEADLO CC[C@H](C)CCC(=O)N[C@H]1CCn2c[nH+]cc2C1 ZINC000623299830 356559658 /nfs/dbraw/zinc/55/96/58/356559658.db2.gz DISBQNLPTOQKLB-RYUDHWBXSA-N 1 2 249.358 2.140 20 0 BEADLO Fc1cccc(C[N@@H+]2CC[C@]23CCOC3)c1F ZINC000421032619 192309903 /nfs/dbraw/zinc/30/99/03/192309903.db2.gz MAKVNKBZMMHFHF-CYBMUJFWSA-N 1 2 239.265 2.330 20 0 BEADLO Fc1cccc(C[N@H+]2CC[C@]23CCOC3)c1F ZINC000421032619 192309906 /nfs/dbraw/zinc/30/99/06/192309906.db2.gz MAKVNKBZMMHFHF-CYBMUJFWSA-N 1 2 239.265 2.330 20 0 BEADLO CCC(F)(F)C[N@@H+]1CC[C@@H](n2cccn2)C1 ZINC000639650817 356561654 /nfs/dbraw/zinc/56/16/54/356561654.db2.gz JWHOFSBWRVFFMQ-SNVBAGLBSA-N 1 2 229.274 2.175 20 0 BEADLO CCC(F)(F)C[N@H+]1CC[C@@H](n2cccn2)C1 ZINC000639650817 356561657 /nfs/dbraw/zinc/56/16/57/356561657.db2.gz JWHOFSBWRVFFMQ-SNVBAGLBSA-N 1 2 229.274 2.175 20 0 BEADLO CC(C)n1cc[nH+]c1CN1C[C@H](C)OC[C@H]1C ZINC000336208975 134133832 /nfs/dbraw/zinc/13/38/32/134133832.db2.gz VGSITOOHKNKRIO-NEPJUHHUSA-N 1 2 237.347 2.073 20 0 BEADLO CCC(F)(F)C[N@H+](C[C@@H]1CCC(=O)N1)C(C)C ZINC000639677356 356593217 /nfs/dbraw/zinc/59/32/17/356593217.db2.gz MQUIRLTYQMCYKS-JTQLQIEISA-N 1 2 248.317 2.021 20 0 BEADLO CCC(F)(F)C[N@@H+](C[C@@H]1CCC(=O)N1)C(C)C ZINC000639677356 356593222 /nfs/dbraw/zinc/59/32/22/356593222.db2.gz MQUIRLTYQMCYKS-JTQLQIEISA-N 1 2 248.317 2.021 20 0 BEADLO CCCC[C@@H](C)C(=O)N[C@H]1CCn2c[nH+]cc2C1 ZINC000623301918 356577949 /nfs/dbraw/zinc/57/79/49/356577949.db2.gz WHNHSDYMYBYHGV-NEPJUHHUSA-N 1 2 249.358 2.140 20 0 BEADLO CC(=O)C[N@@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000639665003 356579598 /nfs/dbraw/zinc/57/95/98/356579598.db2.gz JZPPFYNGZNLNIP-LBPRGKRZSA-N 1 2 219.284 2.396 20 0 BEADLO CC(=O)C[N@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000639665003 356579599 /nfs/dbraw/zinc/57/95/99/356579599.db2.gz JZPPFYNGZNLNIP-LBPRGKRZSA-N 1 2 219.284 2.396 20 0 BEADLO C[C@]1(CCNc2cc(CO)cc[nH+]2)CC1(F)F ZINC000630092341 363514606 /nfs/dbraw/zinc/51/46/06/363514606.db2.gz DVSPQNYBFAXCAP-NSHDSACASA-N 1 2 242.269 2.421 20 0 BEADLO C[C@@]1(CNc2cc(CO)cc[nH+]2)CC1(F)F ZINC000630092374 363514733 /nfs/dbraw/zinc/51/47/33/363514733.db2.gz DWMZREZOIQIHJA-JTQLQIEISA-N 1 2 228.242 2.031 20 0 BEADLO CCC(F)(F)C[NH+]1CCC([C@H](C)CO)CC1 ZINC000639732500 356625863 /nfs/dbraw/zinc/62/58/63/356625863.db2.gz RRBCDNIWXZNFCO-SNVBAGLBSA-N 1 2 235.318 2.372 20 0 BEADLO CC[NH+](CC)Cc1noc(-c2cncc(C)c2)n1 ZINC000450240336 202104271 /nfs/dbraw/zinc/10/42/71/202104271.db2.gz GAGMZBQFXJFEBO-UHFFFAOYSA-N 1 2 246.314 2.282 20 0 BEADLO CC[C@@](C)(CNc1ccc(OC)c[nH+]1)OC ZINC000323040073 491099507 /nfs/dbraw/zinc/09/95/07/491099507.db2.gz ATHFNQCIUKMIBK-LBPRGKRZSA-N 1 2 224.304 2.317 20 0 BEADLO CC1(C)[C@H](CNc2cc(CO)cc[nH+]2)C1(F)F ZINC000630094349 363536726 /nfs/dbraw/zinc/53/67/26/363536726.db2.gz GJRQRFWIFBEJMN-VIFPVBQESA-N 1 2 242.269 2.277 20 0 BEADLO C[C@H](Oc1ccccc1)c1noc(C[NH+](C)C)n1 ZINC000350643749 366314389 /nfs/dbraw/zinc/31/43/89/366314389.db2.gz DCKIAENETDNEQA-JTQLQIEISA-N 1 2 247.298 2.271 20 0 BEADLO COCC[N@H+](CC(F)F)CC1CC(F)(F)C1 ZINC000450353700 202141261 /nfs/dbraw/zinc/14/12/61/202141261.db2.gz GINDIWAIYFEQRI-UHFFFAOYSA-N 1 2 243.244 2.245 20 0 BEADLO COCC[N@@H+](CC(F)F)CC1CC(F)(F)C1 ZINC000450353700 202141265 /nfs/dbraw/zinc/14/12/65/202141265.db2.gz GINDIWAIYFEQRI-UHFFFAOYSA-N 1 2 243.244 2.245 20 0 BEADLO CNc1nc(N2CCC[C@H]2C)[nH+]c2ccccc21 ZINC000450359715 202142433 /nfs/dbraw/zinc/14/24/33/202142433.db2.gz HVPWOCJGSSAIOL-SNVBAGLBSA-N 1 2 242.326 2.082 20 0 BEADLO C[C@H]([NH2+]Cc1ccn(C)c1)C(C)(F)F ZINC000389462795 356681346 /nfs/dbraw/zinc/68/13/46/356681346.db2.gz HIFUZOWVQZJHOF-QMMMGPOBSA-N 1 2 202.248 2.158 20 0 BEADLO COc1ccc(C[NH2+][C@@H](C)C(C)(F)F)cn1 ZINC000389463277 356681494 /nfs/dbraw/zinc/68/14/94/356681494.db2.gz HYJQQTKAAJWGTF-QMMMGPOBSA-N 1 2 230.258 2.224 20 0 BEADLO O=S1CC[NH+](CC/C=C\c2ccccc2)CC1 ZINC000450394316 202151153 /nfs/dbraw/zinc/15/11/53/202151153.db2.gz SGPKSZZCWVOSCL-YWEYNIOJSA-N 1 2 249.379 2.154 20 0 BEADLO C[C@@H]([NH2+][C@H](C)C(C)(F)F)c1ccnn1C ZINC000389475663 356685012 /nfs/dbraw/zinc/68/50/12/356685012.db2.gz ZCDLKSFFEAGBRZ-HTQZYQBOSA-N 1 2 217.263 2.114 20 0 BEADLO Cc1cc(N[C@@H]2CCCC2(F)F)c(C#N)c[nH+]1 ZINC000399460296 356703006 /nfs/dbraw/zinc/70/30/06/356703006.db2.gz VBTDAUKAUJTFBA-LLVKDONJSA-N 1 2 237.253 2.283 20 0 BEADLO CC[NH+](CC)Cc1nc([C@@H]2CCCS2)no1 ZINC000346992717 538562172 /nfs/dbraw/zinc/56/21/72/538562172.db2.gz QESFRZBFJVHASK-VIFPVBQESA-N 1 2 241.360 2.480 20 0 BEADLO CCC(C)(CC)c1nc(Cc2c[nH+]cn2C)no1 ZINC000350189185 538631487 /nfs/dbraw/zinc/63/14/87/538631487.db2.gz HLIVMZUPHSIOGM-UHFFFAOYSA-N 1 2 248.330 2.472 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ccns2)cn1 ZINC000639810407 356787952 /nfs/dbraw/zinc/78/79/52/356787952.db2.gz XSABPRBLISIWBE-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ccns2)cn1 ZINC000639810407 356787957 /nfs/dbraw/zinc/78/79/57/356787957.db2.gz XSABPRBLISIWBE-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO COC(=O)C[N@H+](CC1=CCCCC1)C1CC1 ZINC000450476056 202178314 /nfs/dbraw/zinc/17/83/14/202178314.db2.gz MRARCMPXDPTBFJ-UHFFFAOYSA-N 1 2 223.316 2.124 20 0 BEADLO COC(=O)C[N@@H+](CC1=CCCCC1)C1CC1 ZINC000450476056 202178315 /nfs/dbraw/zinc/17/83/15/202178315.db2.gz MRARCMPXDPTBFJ-UHFFFAOYSA-N 1 2 223.316 2.124 20 0 BEADLO CC[N@H+](Cc1cnn(C)c1)[C@@H](C)c1ncc(C)o1 ZINC000357004777 356812146 /nfs/dbraw/zinc/81/21/46/356812146.db2.gz KWTNAIXBNKEYQJ-NSHDSACASA-N 1 2 248.330 2.300 20 0 BEADLO CC[N@@H+](Cc1cnn(C)c1)[C@@H](C)c1ncc(C)o1 ZINC000357004777 356812148 /nfs/dbraw/zinc/81/21/48/356812148.db2.gz KWTNAIXBNKEYQJ-NSHDSACASA-N 1 2 248.330 2.300 20 0 BEADLO CCc1nc(C[N@H+](C)[C@@H](C)C2CCC2)no1 ZINC000357028044 356812501 /nfs/dbraw/zinc/81/25/01/356812501.db2.gz AKGIWSRXIRYOFG-VIFPVBQESA-N 1 2 223.320 2.252 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@@H](C)C2CCC2)no1 ZINC000357028044 356812506 /nfs/dbraw/zinc/81/25/06/356812506.db2.gz AKGIWSRXIRYOFG-VIFPVBQESA-N 1 2 223.320 2.252 20 0 BEADLO CO[C@@H]1C[N@H+](C/C=C/c2ccccc2)CCO1 ZINC000639836563 356822500 /nfs/dbraw/zinc/82/25/00/356822500.db2.gz UTGYAKGTYJMRIV-GPAKFWEMSA-N 1 2 233.311 2.005 20 0 BEADLO CO[C@@H]1C[N@@H+](C/C=C/c2ccccc2)CCO1 ZINC000639836563 356822504 /nfs/dbraw/zinc/82/25/04/356822504.db2.gz UTGYAKGTYJMRIV-GPAKFWEMSA-N 1 2 233.311 2.005 20 0 BEADLO CCc1cccc(C[N@@H+]2CCO[C@@H](OC)C2)c1 ZINC000639835142 356824520 /nfs/dbraw/zinc/82/45/20/356824520.db2.gz BCVOELQKASKJSQ-CQSZACIVSA-N 1 2 235.327 2.054 20 0 BEADLO CCc1cccc(C[N@H+]2CCO[C@@H](OC)C2)c1 ZINC000639835142 356824523 /nfs/dbraw/zinc/82/45/23/356824523.db2.gz BCVOELQKASKJSQ-CQSZACIVSA-N 1 2 235.327 2.054 20 0 BEADLO c1ccc(C[N@@H+]2CCC[C@@H]2c2ncccn2)nc1 ZINC000639843612 356840133 /nfs/dbraw/zinc/84/01/33/356840133.db2.gz STVBYYDLJFOWNJ-CYBMUJFWSA-N 1 2 240.310 2.209 20 0 BEADLO c1ccc(C[N@H+]2CCC[C@@H]2c2ncccn2)nc1 ZINC000639843612 356840137 /nfs/dbraw/zinc/84/01/37/356840137.db2.gz STVBYYDLJFOWNJ-CYBMUJFWSA-N 1 2 240.310 2.209 20 0 BEADLO CC(C)C[C@H]1CCCN1C(=O)CCc1c[nH+]c[nH]1 ZINC000352739454 538725597 /nfs/dbraw/zinc/72/55/97/538725597.db2.gz NCCBNZAPKXWCIG-CYBMUJFWSA-N 1 2 249.358 2.379 20 0 BEADLO CC(C)C[C@H]1CCCN1C(=O)CCc1c[nH]c[nH+]1 ZINC000352739454 538725603 /nfs/dbraw/zinc/72/56/03/538725603.db2.gz NCCBNZAPKXWCIG-CYBMUJFWSA-N 1 2 249.358 2.379 20 0 BEADLO CCc1cnccc1[C@H](C)[NH2+]Cc1ccon1 ZINC000361134600 356917885 /nfs/dbraw/zinc/91/78/85/356917885.db2.gz HHLGUMMIRUSCGL-JTQLQIEISA-N 1 2 231.299 2.483 20 0 BEADLO Cc1cc(NC(=O)C2(C(F)F)CCC2)cc[nH+]1 ZINC000631255495 356930705 /nfs/dbraw/zinc/93/07/05/356930705.db2.gz XAEMLQFCOIYBKK-UHFFFAOYSA-N 1 2 240.253 2.186 20 0 BEADLO c1ncc(C[N@@H+]2CCC[C@H]2c2ncccn2)s1 ZINC000639865292 356962799 /nfs/dbraw/zinc/96/27/99/356962799.db2.gz GTOWWGRWZYYPOT-NSHDSACASA-N 1 2 246.339 2.270 20 0 BEADLO c1ncc(C[N@H+]2CCC[C@H]2c2ncccn2)s1 ZINC000639865292 356962802 /nfs/dbraw/zinc/96/28/02/356962802.db2.gz GTOWWGRWZYYPOT-NSHDSACASA-N 1 2 246.339 2.270 20 0 BEADLO CC(C)c1nc(NC2CC(C)(F)C2)cc[nH+]1 ZINC000450581036 202202556 /nfs/dbraw/zinc/20/25/56/202202556.db2.gz OZUSERUHIJUSHE-UHFFFAOYSA-N 1 2 223.295 2.324 20 0 BEADLO COC[C@@]1(C)CCN(c2nc(C)[nH+]c(C)c2C)C1 ZINC000450605586 202208301 /nfs/dbraw/zinc/20/83/01/202208301.db2.gz QANZVBBUHAHRCL-AWEZNQCLSA-N 1 2 249.358 2.265 20 0 BEADLO C[C@H]1CCC[C@H](CC(=O)NCc2c[nH+]cn2C)C1 ZINC000355258160 538791605 /nfs/dbraw/zinc/79/16/05/538791605.db2.gz RXMGCEMHUYIUMY-RYUDHWBXSA-N 1 2 249.358 2.253 20 0 BEADLO COc1ccc[nH+]c1NCc1cc[nH]c1 ZINC000389915141 357066596 /nfs/dbraw/zinc/06/65/96/357066596.db2.gz KUODBHFESCXGFJ-UHFFFAOYSA-N 1 2 203.245 2.030 20 0 BEADLO c1[nH]cc(N[C@@H]2CCc3ccccc3C2)[nH+]1 ZINC000390340991 357089947 /nfs/dbraw/zinc/08/99/47/357089947.db2.gz MWERBKWKLDLNAY-GFCCVEGCSA-N 1 2 213.284 2.379 20 0 BEADLO CC[N@H+](Cc1nc([C@@H]2CC23CC3)no1)C1CC1 ZINC000351291464 357139997 /nfs/dbraw/zinc/13/99/97/357139997.db2.gz SAIYGAUCSBEXGE-JTQLQIEISA-N 1 2 233.315 2.321 20 0 BEADLO CC[N@@H+](Cc1nc([C@@H]2CC23CC3)no1)C1CC1 ZINC000351291464 357140002 /nfs/dbraw/zinc/14/00/02/357140002.db2.gz SAIYGAUCSBEXGE-JTQLQIEISA-N 1 2 233.315 2.321 20 0 BEADLO CC(C)C[N@H+](Cc1csnn1)C1CC1 ZINC000122171305 357166641 /nfs/dbraw/zinc/16/66/41/357166641.db2.gz VAVHUENIVRYQRZ-UHFFFAOYSA-N 1 2 211.334 2.159 20 0 BEADLO CC(C)C[N@@H+](Cc1csnn1)C1CC1 ZINC000122171305 357166644 /nfs/dbraw/zinc/16/66/44/357166644.db2.gz VAVHUENIVRYQRZ-UHFFFAOYSA-N 1 2 211.334 2.159 20 0 BEADLO CC(C)(C)[C@H]1CCN(C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000356031203 538806078 /nfs/dbraw/zinc/80/60/78/538806078.db2.gz DUDZMQUGSGTJRW-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO CC(C)(C)[C@H]1CCN(C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000356031203 538806080 /nfs/dbraw/zinc/80/60/80/538806080.db2.gz DUDZMQUGSGTJRW-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCC[C@H]1COC ZINC000639892653 357221593 /nfs/dbraw/zinc/22/15/93/357221593.db2.gz XEWKTKUNJOIQHD-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CCC(F)(F)C[N@H+]1CCC[C@H]1COC ZINC000639892653 357221596 /nfs/dbraw/zinc/22/15/96/357221596.db2.gz XEWKTKUNJOIQHD-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO Cc1[nH]c(CN2Cc3ccc(O)cc3C2)[nH+]c1C ZINC000628419007 357238887 /nfs/dbraw/zinc/23/88/87/357238887.db2.gz ITDMOXYIWYBNNU-UHFFFAOYSA-N 1 2 243.310 2.248 20 0 BEADLO CC(F)(F)C[NH2+]Cc1ccc2c[nH]nc2c1 ZINC000393531101 357286371 /nfs/dbraw/zinc/28/63/71/357286371.db2.gz XBRLGMWJWBDTQZ-UHFFFAOYSA-N 1 2 225.242 2.308 20 0 BEADLO COc1ccc(C[NH+]2CC3(C2)CCCO3)cc1C ZINC000628426932 357257956 /nfs/dbraw/zinc/25/79/56/357257956.db2.gz VTQGPEFWOXNHJX-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO c1c2cccnc2oc1C[NH+]1CC2(C1)CCCO2 ZINC000628427752 357258765 /nfs/dbraw/zinc/25/87/65/357258765.db2.gz XJHHOSKNKAFTFH-UHFFFAOYSA-N 1 2 244.294 2.193 20 0 BEADLO CCSCC[N@@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000610215191 357277653 /nfs/dbraw/zinc/27/76/53/357277653.db2.gz OGVIPDVKNHBTMN-MRVPVSSYSA-N 1 2 243.294 2.003 20 0 BEADLO CCSCC[N@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000610215191 357277656 /nfs/dbraw/zinc/27/76/56/357277656.db2.gz OGVIPDVKNHBTMN-MRVPVSSYSA-N 1 2 243.294 2.003 20 0 BEADLO CCCc1nc(C[N@@H+]2CCC[C@H](C)C2)no1 ZINC000054982758 363581877 /nfs/dbraw/zinc/58/18/77/363581877.db2.gz BOAWGRMITBYWGL-JTQLQIEISA-N 1 2 223.320 2.254 20 0 BEADLO CCCc1nc(C[N@H+]2CCC[C@H](C)C2)no1 ZINC000054982758 363581885 /nfs/dbraw/zinc/58/18/85/363581885.db2.gz BOAWGRMITBYWGL-JTQLQIEISA-N 1 2 223.320 2.254 20 0 BEADLO COc1ccc[nH+]c1N[C@@H](C)CC(C)(C)O ZINC000395063093 357409367 /nfs/dbraw/zinc/40/93/67/357409367.db2.gz ZYEHZBUMMTWMLX-VIFPVBQESA-N 1 2 224.304 2.052 20 0 BEADLO CC(C)N(C(=O)C[C@H](C)n1cc[nH+]c1)C1CC1 ZINC000583087001 357469011 /nfs/dbraw/zinc/46/90/11/357469011.db2.gz DEJOYHRYGGYTSS-NSHDSACASA-N 1 2 235.331 2.234 20 0 BEADLO Cc1[nH]c(CNCc2cnc(C)cc2C)[nH+]c1C ZINC000583095220 357479313 /nfs/dbraw/zinc/47/93/13/357479313.db2.gz BFPGLFWEYRMOIW-UHFFFAOYSA-N 1 2 244.342 2.328 20 0 BEADLO COc1cc(C)[nH+]c(CS[C@@H](C)CCO)c1 ZINC000168878223 357516847 /nfs/dbraw/zinc/51/68/47/357516847.db2.gz IHPGBBGKNYMGDY-JTQLQIEISA-N 1 2 241.356 2.403 20 0 BEADLO Cc1[nH+]cccc1NCc1cscn1 ZINC000085712050 357560939 /nfs/dbraw/zinc/56/09/39/357560939.db2.gz IQRTXHJLRYKLFY-UHFFFAOYSA-N 1 2 205.286 2.459 20 0 BEADLO CCOc1nnc(C[N@H+](C(C)C)C2CC2)s1 ZINC000063493037 357659905 /nfs/dbraw/zinc/65/99/05/357659905.db2.gz DLYSEYOJUZVKNZ-UHFFFAOYSA-N 1 2 241.360 2.310 20 0 BEADLO CCOc1nnc(C[N@@H+](C(C)C)C2CC2)s1 ZINC000063493037 357659907 /nfs/dbraw/zinc/65/99/07/357659907.db2.gz DLYSEYOJUZVKNZ-UHFFFAOYSA-N 1 2 241.360 2.310 20 0 BEADLO CCS[C@@H]1CCC[C@@H]1[NH2+]Cc1noc(C)n1 ZINC000233994169 357765499 /nfs/dbraw/zinc/76/54/99/357765499.db2.gz CRZIVBQCEUVDCM-VHSXEESVSA-N 1 2 241.360 2.142 20 0 BEADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1ncccn1 ZINC000192135320 357824473 /nfs/dbraw/zinc/82/44/73/357824473.db2.gz DAUGOPNFOXINHE-NSHDSACASA-N 1 2 228.299 2.065 20 0 BEADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1ncccn1 ZINC000192135320 357824474 /nfs/dbraw/zinc/82/44/74/357824474.db2.gz DAUGOPNFOXINHE-NSHDSACASA-N 1 2 228.299 2.065 20 0 BEADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1ncccn1 ZINC000192103758 357823349 /nfs/dbraw/zinc/82/33/49/357823349.db2.gz GEBJUWZDJBNBQZ-LLVKDONJSA-N 1 2 243.310 2.375 20 0 BEADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1ncccn1 ZINC000192103758 357823352 /nfs/dbraw/zinc/82/33/52/357823352.db2.gz GEBJUWZDJBNBQZ-LLVKDONJSA-N 1 2 243.310 2.375 20 0 BEADLO C=Cn1cc(CNc2ccc(N(C)C)[nH+]c2)cn1 ZINC000234242721 357787447 /nfs/dbraw/zinc/78/74/47/357787447.db2.gz PCAVMBFXGSPZHO-UHFFFAOYSA-N 1 2 243.314 2.057 20 0 BEADLO O=C(OCC1CC1)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000192898608 357857522 /nfs/dbraw/zinc/85/75/22/357857522.db2.gz IEGOKHIQYYAKJD-NSHDSACASA-N 1 2 249.314 2.483 20 0 BEADLO COc1cccc2c1cc[nH+]c2N[C@@H](C)CCO ZINC000234916225 357836738 /nfs/dbraw/zinc/83/67/38/357836738.db2.gz CVOZEZVSDAEEAN-JTQLQIEISA-N 1 2 246.310 2.426 20 0 BEADLO Cc1nnsc1C[N@@H+](C)Cc1ccoc1C ZINC000583325658 357905288 /nfs/dbraw/zinc/90/52/88/357905288.db2.gz UYSCORRCHPJSKK-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1nnsc1C[N@H+](C)Cc1ccoc1C ZINC000583325658 357905293 /nfs/dbraw/zinc/90/52/93/357905293.db2.gz UYSCORRCHPJSKK-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1nc(C[NH2+][C@H](C)c2cnccn2)cs1 ZINC000070025504 491117410 /nfs/dbraw/zinc/11/74/10/491117410.db2.gz PZERYCGLYNLOCT-MRVPVSSYSA-N 1 2 234.328 2.092 20 0 BEADLO CC[C@@H]1CCC[C@H]1CNC(=O)CCc1c[nH+]c[nH]1 ZINC000584451712 357971408 /nfs/dbraw/zinc/97/14/08/357971408.db2.gz GGDGGIWJCCFXHC-NEPJUHHUSA-N 1 2 249.358 2.285 20 0 BEADLO CC[C@@H]1CCC[C@H]1CNC(=O)CCc1c[nH]c[nH+]1 ZINC000584451712 357971410 /nfs/dbraw/zinc/97/14/10/357971410.db2.gz GGDGGIWJCCFXHC-NEPJUHHUSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H](CC(=O)N(C)[C@@H]1CC[C@@H](C)C1)n1cc[nH+]c1 ZINC000584473010 357990301 /nfs/dbraw/zinc/99/03/01/357990301.db2.gz MPWSJBODHFIFFL-FRRDWIJNSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1ncc([C@@H](C)[NH2+]Cc2ncc(C)cn2)s1 ZINC000639995229 358034149 /nfs/dbraw/zinc/03/41/49/358034149.db2.gz JMMCWMDKOSOOIS-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@H](CCF)C2)o1 ZINC000628458087 358040382 /nfs/dbraw/zinc/04/03/82/358040382.db2.gz CAXVMKAZHRSASW-GFCCVEGCSA-N 1 2 241.306 2.402 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@H](CCF)C2)o1 ZINC000628458087 358040384 /nfs/dbraw/zinc/04/03/84/358040384.db2.gz CAXVMKAZHRSASW-GFCCVEGCSA-N 1 2 241.306 2.402 20 0 BEADLO Cc1cc([NH2+]CC(C)C)ccc1-n1cnnn1 ZINC000037104021 358064953 /nfs/dbraw/zinc/06/49/53/358064953.db2.gz NCUPLIXXIFIRFA-UHFFFAOYSA-N 1 2 231.303 2.039 20 0 BEADLO CO[C@@H](C)c1nc(CCc2[nH+]cccc2C)no1 ZINC000351133871 358157877 /nfs/dbraw/zinc/15/78/77/358157877.db2.gz UKUIWOQBJHPIGL-JTQLQIEISA-N 1 2 247.298 2.266 20 0 BEADLO Cn1cnc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000640069534 358155477 /nfs/dbraw/zinc/15/54/77/358155477.db2.gz XFZCVRPUPAISTB-SECBINFHSA-N 1 2 247.264 2.194 20 0 BEADLO Cn1cnc(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000640069534 358155479 /nfs/dbraw/zinc/15/54/79/358155479.db2.gz XFZCVRPUPAISTB-SECBINFHSA-N 1 2 247.264 2.194 20 0 BEADLO CCOC1(CNc2nc(C)[nH+]cc2C)CCCC1 ZINC000584730829 358167814 /nfs/dbraw/zinc/16/78/14/358167814.db2.gz RDGZQPKHWXMTGZ-UHFFFAOYSA-N 1 2 249.358 2.277 20 0 BEADLO CC[C@H]1[C@H](CO)CCN1c1cc[nH+]c(C(C)C)n1 ZINC000450658637 202229158 /nfs/dbraw/zinc/22/91/58/202229158.db2.gz NUKASNVQZMFYMF-RYUDHWBXSA-N 1 2 249.358 2.197 20 0 BEADLO CC[C@@H]([NH2+]Cc1ncccn1)c1ccc(F)cn1 ZINC000584851561 358209387 /nfs/dbraw/zinc/20/93/87/358209387.db2.gz XEODZZCRYWLKBW-LLVKDONJSA-N 1 2 246.289 2.252 20 0 BEADLO COc1ccc([C@H](C)[NH2+]Cc2cc[nH]n2)c(F)c1 ZINC000041015405 358241553 /nfs/dbraw/zinc/24/15/53/358241553.db2.gz STRUQILZGKQAPX-VIFPVBQESA-N 1 2 249.289 2.408 20 0 BEADLO C[C@@H]([NH2+]Cc1c[nH]nn1)[C@H](C)C1CCCCC1 ZINC000450728011 202250005 /nfs/dbraw/zinc/25/00/05/202250005.db2.gz NUCQAPXNRVNDLU-WDEREUQCSA-N 1 2 236.363 2.499 20 0 BEADLO C[C@@H]([NH2+]Cc1cn[nH]n1)[C@H](C)C1CCCCC1 ZINC000450728011 202250009 /nfs/dbraw/zinc/25/00/09/202250009.db2.gz NUCQAPXNRVNDLU-WDEREUQCSA-N 1 2 236.363 2.499 20 0 BEADLO CC[C@@](C)(CNc1cc[nH+]c2ccncc12)OC ZINC000450720685 202244037 /nfs/dbraw/zinc/24/40/37/202244037.db2.gz ZHFRBJRESKACME-AWEZNQCLSA-N 1 2 245.326 2.279 20 0 BEADLO CC[C@@H]1C[C@H]1CNc1cc[nH+]c(C(C)C)n1 ZINC000450725767 202247513 /nfs/dbraw/zinc/24/75/13/202247513.db2.gz SHPWOXXMAVBMTO-MNOVXSKESA-N 1 2 219.332 2.480 20 0 BEADLO CCO[C@@H]1CCN(c2cc[nH+]c(C)n2)C[C@@H]1C ZINC000450744158 202252666 /nfs/dbraw/zinc/25/26/66/202252666.db2.gz LALAUXLPWHPPGW-CMPLNLGQSA-N 1 2 235.331 2.036 20 0 BEADLO Cc1cc(NC[C@H]2CCO[C@H](C(C)C)C2)nc[nH+]1 ZINC000450741391 202250708 /nfs/dbraw/zinc/25/07/08/202250708.db2.gz WYNLTPBRGVLFRN-STQMWFEESA-N 1 2 249.358 2.070 20 0 BEADLO CCC[C@@H](OC)c1noc(C[NH+](CC)CC)n1 ZINC000351127767 366417592 /nfs/dbraw/zinc/41/75/92/366417592.db2.gz BWRMKTUBDDWKTR-SNVBAGLBSA-N 1 2 241.335 2.399 20 0 BEADLO CCC[C@@H](OC)c1noc(C[N@H+](C)CCC)n1 ZINC000351132682 366422701 /nfs/dbraw/zinc/42/27/01/366422701.db2.gz KRMHFTHTTOMZPB-SNVBAGLBSA-N 1 2 241.335 2.399 20 0 BEADLO CCC[C@@H](OC)c1noc(C[N@@H+](C)CCC)n1 ZINC000351132682 366422705 /nfs/dbraw/zinc/42/27/05/366422705.db2.gz KRMHFTHTTOMZPB-SNVBAGLBSA-N 1 2 241.335 2.399 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnc(C3CC3)s2)CCO1 ZINC000578213172 366423792 /nfs/dbraw/zinc/42/37/92/366423792.db2.gz CKKKMEPWJBKKQU-SECBINFHSA-N 1 2 238.356 2.241 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnc(C3CC3)s2)CCO1 ZINC000578213172 366423800 /nfs/dbraw/zinc/42/38/00/366423800.db2.gz CKKKMEPWJBKKQU-SECBINFHSA-N 1 2 238.356 2.241 20 0 BEADLO CCOC(=O)CCC1CC[NH+](CC(F)F)CC1 ZINC000610997185 358424539 /nfs/dbraw/zinc/42/45/39/358424539.db2.gz SQOWJAHEDFZNEO-UHFFFAOYSA-N 1 2 249.301 2.307 20 0 BEADLO Cc1[nH+]cccc1Cc1noc(CC2CC2)n1 ZINC000351235650 366457487 /nfs/dbraw/zinc/45/74/87/366457487.db2.gz OXLCYYWHJJYKLB-UHFFFAOYSA-N 1 2 229.283 2.316 20 0 BEADLO Cc1cnc([C@@H]([NH2+]Cc2cnc[nH]2)C2CC2)s1 ZINC000174545756 134282437 /nfs/dbraw/zinc/28/24/37/134282437.db2.gz YRQKLDIEHMWWJI-NSHDSACASA-N 1 2 248.355 2.416 20 0 BEADLO CCOC(=O)C[N@H+](C)C/C=C\c1ccccc1 ZINC000219654233 134288713 /nfs/dbraw/zinc/28/87/13/134288713.db2.gz ZXBVJLYHGKJOPV-YFHOEESVSA-N 1 2 233.311 2.195 20 0 BEADLO CCOC(=O)C[N@@H+](C)C/C=C\c1ccccc1 ZINC000219654233 134288714 /nfs/dbraw/zinc/28/87/14/134288714.db2.gz ZXBVJLYHGKJOPV-YFHOEESVSA-N 1 2 233.311 2.195 20 0 BEADLO Fc1cc2[nH+]cn(C[C@H]3CCCO3)c2cc1F ZINC000131292811 358667824 /nfs/dbraw/zinc/66/78/24/358667824.db2.gz JPEORXXRYAPUHJ-MRVPVSSYSA-N 1 2 238.237 2.494 20 0 BEADLO CC(C)OC(=O)C[N@H+](C)Cc1ccccc1 ZINC000049633280 358695724 /nfs/dbraw/zinc/69/57/24/358695724.db2.gz KBEHANNTFAPOQL-UHFFFAOYSA-N 1 2 221.300 2.070 20 0 BEADLO CC(C)OC(=O)C[N@@H+](C)Cc1ccccc1 ZINC000049633280 358695726 /nfs/dbraw/zinc/69/57/26/358695726.db2.gz KBEHANNTFAPOQL-UHFFFAOYSA-N 1 2 221.300 2.070 20 0 BEADLO CCOC(=O)CCCC[N@H+](CC(F)F)C1CC1 ZINC000133002032 358743560 /nfs/dbraw/zinc/74/35/60/358743560.db2.gz PJNHSNGOANGGNH-UHFFFAOYSA-N 1 2 249.301 2.449 20 0 BEADLO CCOC(=O)CCCC[N@@H+](CC(F)F)C1CC1 ZINC000133002032 358743564 /nfs/dbraw/zinc/74/35/64/358743564.db2.gz PJNHSNGOANGGNH-UHFFFAOYSA-N 1 2 249.301 2.449 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1cc(C)cc(C)c1 ZINC000050066677 358711910 /nfs/dbraw/zinc/71/19/10/358711910.db2.gz PPVDRXMCYVYSHN-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1cc(C)cc(C)c1 ZINC000050066677 358711913 /nfs/dbraw/zinc/71/19/13/358711913.db2.gz PPVDRXMCYVYSHN-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO CC(C)c1nc(N2CCO[C@@H](C)[C@@H]2C)cc[nH+]1 ZINC000132250778 358714011 /nfs/dbraw/zinc/71/40/11/358714011.db2.gz VXMFFCPLJBKRKH-QWRGUYRKSA-N 1 2 235.331 2.214 20 0 BEADLO CCOC(=O)C[NH2+][C@H](c1cccs1)C1CC1 ZINC000051100080 358743291 /nfs/dbraw/zinc/74/32/91/358743291.db2.gz YXWWLMGWFYICBW-LBPRGKRZSA-N 1 2 239.340 2.352 20 0 BEADLO CCCC[C@@H](CC)C(=O)NCCc1[nH]cc[nH+]1 ZINC000135073536 358818572 /nfs/dbraw/zinc/81/85/72/358818572.db2.gz JVCCZYUZCANZGB-LLVKDONJSA-N 1 2 237.347 2.285 20 0 BEADLO CC(C)c1cnc(C[N@@H+]2CCC[C@H](O)C2)s1 ZINC000134871721 358809012 /nfs/dbraw/zinc/80/90/12/358809012.db2.gz XYZCYUKEONNTSK-JTQLQIEISA-N 1 2 240.372 2.223 20 0 BEADLO CC(C)c1cnc(C[N@H+]2CCC[C@H](O)C2)s1 ZINC000134871721 358809014 /nfs/dbraw/zinc/80/90/14/358809014.db2.gz XYZCYUKEONNTSK-JTQLQIEISA-N 1 2 240.372 2.223 20 0 BEADLO CCc1nc(C[NH+]2C[C@@H](C)C[C@H](C)C2)no1 ZINC000054316308 358858230 /nfs/dbraw/zinc/85/82/30/358858230.db2.gz FFRUWRKAGFBYHQ-UWVGGRQHSA-N 1 2 223.320 2.110 20 0 BEADLO Cc1nc(C[NH2+][C@H]2CCCn3nccc32)oc1C ZINC000640217070 358856240 /nfs/dbraw/zinc/85/62/40/358856240.db2.gz IMGMTCYPRCJUJG-NSHDSACASA-N 1 2 246.314 2.113 20 0 BEADLO CS[C@H](C)CC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000611134763 358856294 /nfs/dbraw/zinc/85/62/94/358856294.db2.gz MKAVAJXRRZFLAP-SECBINFHSA-N 1 2 249.339 2.414 20 0 BEADLO COc1ccccc1CNc1cc[nH+]c(C)n1 ZINC000054935653 358878859 /nfs/dbraw/zinc/87/88/59/358878859.db2.gz OSUQBLGZLMIIEQ-UHFFFAOYSA-N 1 2 229.283 2.406 20 0 BEADLO CCOc1ccc(C[NH2+]CC(F)F)cc1OC ZINC000136570629 358881765 /nfs/dbraw/zinc/88/17/65/358881765.db2.gz ZESBYSVMUJLDSB-UHFFFAOYSA-N 1 2 245.269 2.449 20 0 BEADLO CCn1cc[nH+]c1CNc1cc(C)n(C(C)C)n1 ZINC000578346780 366531324 /nfs/dbraw/zinc/53/13/24/366531324.db2.gz WWECRLKRQSJQBR-UHFFFAOYSA-N 1 2 247.346 2.023 20 0 BEADLO CC(C)c1noc(C[C@H](C)n2cc[nH+]c2)n1 ZINC000351405955 366522761 /nfs/dbraw/zinc/52/27/61/366522761.db2.gz NUGZKOWFNOYQDW-VIFPVBQESA-N 1 2 220.276 2.193 20 0 BEADLO Cc1nc(N2CCCO[C@@H](C)C2)c(C)c(C)[nH+]1 ZINC000177824496 134300543 /nfs/dbraw/zinc/30/05/43/134300543.db2.gz JAXOECALNCYNDU-VIFPVBQESA-N 1 2 235.331 2.017 20 0 BEADLO CSc1ccccc1C(=O)NCc1[nH]cc[nH+]1 ZINC000070991811 359069639 /nfs/dbraw/zinc/06/96/39/359069639.db2.gz XRWXANMEAPBWSX-UHFFFAOYSA-N 1 2 247.323 2.062 20 0 BEADLO CC1(C)C[N@H+](Cc2ccccc2F)CCO1 ZINC000073871154 359106906 /nfs/dbraw/zinc/10/69/06/359106906.db2.gz VDSYAXYZNGIZPQ-UHFFFAOYSA-N 1 2 223.291 2.437 20 0 BEADLO CC1(C)C[N@@H+](Cc2ccccc2F)CCO1 ZINC000073871154 359106912 /nfs/dbraw/zinc/10/69/12/359106912.db2.gz VDSYAXYZNGIZPQ-UHFFFAOYSA-N 1 2 223.291 2.437 20 0 BEADLO C[C@H]([NH2+]Cc1ccccc1F)c1cnccn1 ZINC000070477349 359056479 /nfs/dbraw/zinc/05/64/79/359056479.db2.gz RUSOKQKILDWSDF-JTQLQIEISA-N 1 2 231.274 2.467 20 0 BEADLO CCCCC(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000074828210 359130431 /nfs/dbraw/zinc/13/04/31/359130431.db2.gz BNWRJFQVRTZTKV-UHFFFAOYSA-N 1 2 235.331 2.306 20 0 BEADLO CO[C@@H]1CCN(c2cc[nH+]c(C3CC3)n2)C[C@@H]1C ZINC000450780785 202262963 /nfs/dbraw/zinc/26/29/63/202262963.db2.gz YPORXNZATSOASP-CMPLNLGQSA-N 1 2 247.342 2.215 20 0 BEADLO Cn1ccnc1C[NH+]1CC(Cc2cccs2)C1 ZINC000628478434 359313694 /nfs/dbraw/zinc/31/36/94/359313694.db2.gz CDZFYPISRQJNOT-UHFFFAOYSA-N 1 2 247.367 2.156 20 0 BEADLO CCCc1nc(C[N@@H+]2CC[C@H](C)[C@H]2C)no1 ZINC000248330589 359264769 /nfs/dbraw/zinc/26/47/69/359264769.db2.gz DPFCDRJOFYYQGA-VHSXEESVSA-N 1 2 223.320 2.252 20 0 BEADLO CCCc1nc(C[N@H+]2CC[C@H](C)[C@H]2C)no1 ZINC000248330589 359264772 /nfs/dbraw/zinc/26/47/72/359264772.db2.gz DPFCDRJOFYYQGA-VHSXEESVSA-N 1 2 223.320 2.252 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCCC(C)(F)F ZINC000521462557 259486136 /nfs/dbraw/zinc/48/61/36/259486136.db2.gz KUMQFJPSRVNGFX-UHFFFAOYSA-N 1 2 229.274 2.363 20 0 BEADLO C[C@@H](CCO)SCc1c[nH+]c2ccccn12 ZINC000611468625 359375588 /nfs/dbraw/zinc/37/55/88/359375588.db2.gz HSKBPNHTKHWDGT-JTQLQIEISA-N 1 2 236.340 2.338 20 0 BEADLO Cc1ccnc(NCc2[nH+]ccn2CC(C)C)n1 ZINC000078336757 359322698 /nfs/dbraw/zinc/32/26/98/359322698.db2.gz JLWNAHDTHZIVQO-UHFFFAOYSA-N 1 2 245.330 2.250 20 0 BEADLO C[C@H](C(=O)OC(C)(C)C)[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000611502491 359384551 /nfs/dbraw/zinc/38/45/51/359384551.db2.gz UEDYBLHZQYPSGU-MXWKQRLJSA-N 1 2 245.338 2.397 20 0 BEADLO C[C@H](C(=O)OC(C)(C)C)[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000611502491 359384553 /nfs/dbraw/zinc/38/45/53/359384553.db2.gz UEDYBLHZQYPSGU-MXWKQRLJSA-N 1 2 245.338 2.397 20 0 BEADLO COC(=O)[C@@H](c1ccccc1)[N@H+]1CC=CCC1 ZINC000611517380 359387462 /nfs/dbraw/zinc/38/74/62/359387462.db2.gz WHCOOEUHVWVSBJ-CYBMUJFWSA-N 1 2 231.295 2.163 20 0 BEADLO COC(=O)[C@@H](c1ccccc1)[N@@H+]1CC=CCC1 ZINC000611517380 359387470 /nfs/dbraw/zinc/38/74/70/359387470.db2.gz WHCOOEUHVWVSBJ-CYBMUJFWSA-N 1 2 231.295 2.163 20 0 BEADLO COC(=O)c1cc(F)ccc1C[N@H+]1CC=CCC1 ZINC000611517408 359387567 /nfs/dbraw/zinc/38/75/67/359387567.db2.gz ZMSUXWODXAJFLJ-UHFFFAOYSA-N 1 2 249.285 2.374 20 0 BEADLO COC(=O)c1cc(F)ccc1C[N@@H+]1CC=CCC1 ZINC000611517408 359387570 /nfs/dbraw/zinc/38/75/70/359387570.db2.gz ZMSUXWODXAJFLJ-UHFFFAOYSA-N 1 2 249.285 2.374 20 0 BEADLO C[C@H](CC(=O)N1CC[C@@H](C)C[C@H]1C)n1cc[nH+]c1 ZINC000580437205 359555501 /nfs/dbraw/zinc/55/55/01/359555501.db2.gz MEMJJMHRXWZGLL-JHJVBQTASA-N 1 2 249.358 2.481 20 0 BEADLO Cc1ccoc1CNC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000580453362 359559404 /nfs/dbraw/zinc/55/94/04/359559404.db2.gz WTFGFMKOSBUUQZ-LLVKDONJSA-N 1 2 247.298 2.052 20 0 BEADLO Cc1ncncc1[C@H](C)[NH2+]Cc1nccs1 ZINC000580465499 359569952 /nfs/dbraw/zinc/56/99/52/359569952.db2.gz LBNHURGMERWUDR-QMMMGPOBSA-N 1 2 234.328 2.092 20 0 BEADLO Nc1ccc(CNc2ncc(Cl)s2)c[nH+]1 ZINC000308988778 491141889 /nfs/dbraw/zinc/14/18/89/491141889.db2.gz KMUYOPCNKAEKMY-UHFFFAOYSA-N 1 2 240.719 2.386 20 0 BEADLO C[C@@H]([NH2+]Cc1ccco1)c1nnc2ccccn21 ZINC000035044253 359649135 /nfs/dbraw/zinc/64/91/35/359649135.db2.gz OMLWXCQZPFNWMI-SNVBAGLBSA-N 1 2 242.282 2.173 20 0 BEADLO CCc1cc(NCC2(CC)CCOCC2)nc[nH+]1 ZINC000385762544 359663657 /nfs/dbraw/zinc/66/36/57/359663657.db2.gz UOBVHHITUMJHEA-UHFFFAOYSA-N 1 2 249.358 2.080 20 0 BEADLO CCc1cc(N[C@@H]2[C@@H]3CCC[C@@H]32)nc[nH+]1 ZINC000309050069 491143452 /nfs/dbraw/zinc/14/34/52/491143452.db2.gz QMXUCIDPPMWXSU-PEGIJTEDSA-N 1 2 203.289 2.249 20 0 BEADLO CC(C)CC[C@H]1CCC[C@@H]1[NH2+]Cc1c[nH]nn1 ZINC000450820176 202274801 /nfs/dbraw/zinc/27/48/01/202274801.db2.gz NLQGZRARUJWODW-YPMHNXCESA-N 1 2 236.363 2.499 20 0 BEADLO CC(C)CC[C@H]1CCC[C@@H]1[NH2+]Cc1cn[nH]n1 ZINC000450820176 202274805 /nfs/dbraw/zinc/27/48/05/202274805.db2.gz NLQGZRARUJWODW-YPMHNXCESA-N 1 2 236.363 2.499 20 0 BEADLO C[C@@H]1c2nncn2CC[N@H+]1CC12CCC(CC1)C2 ZINC000450842575 202284724 /nfs/dbraw/zinc/28/47/24/202284724.db2.gz MRUQMKMXYPPGEI-LKSINWNRSA-N 1 2 246.358 2.235 20 0 BEADLO C[C@@H]1c2nncn2CC[N@@H+]1CC12CCC(CC1)C2 ZINC000450842575 202284727 /nfs/dbraw/zinc/28/47/27/202284727.db2.gz MRUQMKMXYPPGEI-LKSINWNRSA-N 1 2 246.358 2.235 20 0 BEADLO Cc1ccc(NC(=O)CCc2ccon2)c(C)[nH+]1 ZINC000612227499 359740670 /nfs/dbraw/zinc/74/06/70/359740670.db2.gz UIOOGHKVNXNGOE-UHFFFAOYSA-N 1 2 245.282 2.258 20 0 BEADLO CC[C@@H](Nc1[nH+]c(C)nc2[nH]ccc21)[C@@H](O)CC ZINC000450866588 202293216 /nfs/dbraw/zinc/29/32/16/202293216.db2.gz XIZRLYRSVUULFE-MNOVXSKESA-N 1 2 248.330 2.228 20 0 BEADLO CC[C@@H](Nc1cc[nH+]c2ccncc12)[C@@H](O)CC ZINC000450866672 202293359 /nfs/dbraw/zinc/29/33/59/202293359.db2.gz XODJKPGPQBVKDZ-RISCZKNCSA-N 1 2 245.326 2.013 20 0 BEADLO CC(C)[C@@H]([NH2+]Cc1c[nH]nn1)c1ccc(F)cc1 ZINC000450924192 202310132 /nfs/dbraw/zinc/31/01/32/202310132.db2.gz SZWMWJYTHGZEJV-CYBMUJFWSA-N 1 2 248.305 2.431 20 0 BEADLO CC(C)[C@@H]([NH2+]Cc1cn[nH]n1)c1ccc(F)cc1 ZINC000450924192 202310135 /nfs/dbraw/zinc/31/01/35/202310135.db2.gz SZWMWJYTHGZEJV-CYBMUJFWSA-N 1 2 248.305 2.431 20 0 BEADLO CCO[C@@H](CC)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000578441632 366569584 /nfs/dbraw/zinc/56/95/84/366569584.db2.gz UOLRXXFIRXSXIS-NSHDSACASA-N 1 2 247.298 2.088 20 0 BEADLO CO[C@@H](C)C[N@H+](C)Cc1nnc(C(C)C)s1 ZINC000450992125 202328635 /nfs/dbraw/zinc/32/86/35/202328635.db2.gz OLORZPBVNOBHIR-VIFPVBQESA-N 1 2 243.376 2.128 20 0 BEADLO CO[C@@H](C)C[N@@H+](C)Cc1nnc(C(C)C)s1 ZINC000450992125 202328639 /nfs/dbraw/zinc/32/86/39/202328639.db2.gz OLORZPBVNOBHIR-VIFPVBQESA-N 1 2 243.376 2.128 20 0 BEADLO CCC(=O)CCC[N@@H+]1CCOC[C@@H]1CC(F)F ZINC000450991500 202330621 /nfs/dbraw/zinc/33/06/21/202330621.db2.gz KJSGBZJAGIRRCH-JTQLQIEISA-N 1 2 249.301 2.102 20 0 BEADLO CCC(=O)CCC[N@H+]1CCOC[C@@H]1CC(F)F ZINC000450991500 202330625 /nfs/dbraw/zinc/33/06/25/202330625.db2.gz KJSGBZJAGIRRCH-JTQLQIEISA-N 1 2 249.301 2.102 20 0 BEADLO Cn1cc[nH+]c1CSCc1cccnc1 ZINC000451048879 202339215 /nfs/dbraw/zinc/33/92/15/202339215.db2.gz KYWADJQGQZWYIK-UHFFFAOYSA-N 1 2 219.313 2.249 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000578515568 366586287 /nfs/dbraw/zinc/58/62/87/366586287.db2.gz ZBFWCSIPYUWIMD-IINYFYTJSA-N 1 2 249.358 2.443 20 0 BEADLO c1ccc2oc(C[N@H+](C3CC3)C3COC3)nc2c1 ZINC000451132366 202362257 /nfs/dbraw/zinc/36/22/57/202362257.db2.gz WLHGWLPYOMVMLI-UHFFFAOYSA-N 1 2 244.294 2.191 20 0 BEADLO c1ccc2oc(C[N@@H+](C3CC3)C3COC3)nc2c1 ZINC000451132366 202362260 /nfs/dbraw/zinc/36/22/60/202362260.db2.gz WLHGWLPYOMVMLI-UHFFFAOYSA-N 1 2 244.294 2.191 20 0 BEADLO Brc1coc(C[NH+]2CCC2)c1 ZINC000306430585 359884595 /nfs/dbraw/zinc/88/45/95/359884595.db2.gz ZADKACHQCYTBON-UHFFFAOYSA-N 1 2 216.078 2.248 20 0 BEADLO c1ccc2[nH+]c(N[C@@H]3CCOC3)ccc2c1 ZINC000087787981 359929771 /nfs/dbraw/zinc/92/97/71/359929771.db2.gz YYHFQLXVVIHOQL-LLVKDONJSA-N 1 2 214.268 2.436 20 0 BEADLO CC[N@H+](Cc1ccccc1OC1CC1)C1COC1 ZINC000451294798 202397120 /nfs/dbraw/zinc/39/71/20/202397120.db2.gz YDLIRNYLSXWKAB-UHFFFAOYSA-N 1 2 247.338 2.449 20 0 BEADLO CC[N@@H+](Cc1ccccc1OC1CC1)C1COC1 ZINC000451294798 202397124 /nfs/dbraw/zinc/39/71/24/202397124.db2.gz YDLIRNYLSXWKAB-UHFFFAOYSA-N 1 2 247.338 2.449 20 0 BEADLO CCCc1nc(C)c(C[N@H+](CC)C2COC2)o1 ZINC000451293902 202398251 /nfs/dbraw/zinc/39/82/51/202398251.db2.gz WNNORHWGGPYGJE-UHFFFAOYSA-N 1 2 238.331 2.156 20 0 BEADLO CCCc1nc(C)c(C[N@@H+](CC)C2COC2)o1 ZINC000451293902 202398255 /nfs/dbraw/zinc/39/82/55/202398255.db2.gz WNNORHWGGPYGJE-UHFFFAOYSA-N 1 2 238.331 2.156 20 0 BEADLO CC[C@@H](F)C[N@H+](C)[C@H](CC(C)C)C(=O)OC ZINC000451273455 202392297 /nfs/dbraw/zinc/39/22/97/202392297.db2.gz WNGXRCRQBYZTBU-GHMZBOCLSA-N 1 2 233.327 2.254 20 0 BEADLO CC[C@@H](F)C[N@@H+](C)[C@H](CC(C)C)C(=O)OC ZINC000451273455 202392299 /nfs/dbraw/zinc/39/22/99/202392299.db2.gz WNGXRCRQBYZTBU-GHMZBOCLSA-N 1 2 233.327 2.254 20 0 BEADLO FCCC[NH2+][C@H](c1ncn[nH]1)C1CCCCC1 ZINC000578712750 366629737 /nfs/dbraw/zinc/62/97/37/366629737.db2.gz VTZBHPIHDYEWDW-NSHDSACASA-N 1 2 240.326 2.375 20 0 BEADLO c1csc([C@H]([NH2+][C@H]2CC23CC3)c2nnc[nH]2)c1 ZINC000578878853 366664432 /nfs/dbraw/zinc/66/44/32/366664432.db2.gz JCJWWEIMRMDQAH-UWVGGRQHSA-N 1 2 246.339 2.098 20 0 BEADLO CC(C)n1ncnc1C[NH2+][C@@H](C)c1cccnc1 ZINC000088589273 359968052 /nfs/dbraw/zinc/96/80/52/359968052.db2.gz QQGXQNJVJVBWTK-NSHDSACASA-N 1 2 245.330 2.105 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CCC[C@H]3C[C@H]32)c(C)c[nH+]1 ZINC000612746491 360040591 /nfs/dbraw/zinc/04/05/91/360040591.db2.gz BKEDYORMOISTOW-YNEHKIRRSA-N 1 2 244.338 2.495 20 0 BEADLO Cc1cc(NC[C@H]2CCC[C@@H]2O)nc(C(C)C)[nH+]1 ZINC000089166508 359996844 /nfs/dbraw/zinc/99/68/44/359996844.db2.gz MVSXXVDTURAOBN-NEPJUHHUSA-N 1 2 249.358 2.481 20 0 BEADLO CC(C)C[C@@H](C)NC(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000612841027 360104172 /nfs/dbraw/zinc/10/41/72/360104172.db2.gz WJBVUHXSXBCJJE-MNOVXSKESA-N 1 2 249.358 2.065 20 0 BEADLO CC(C)C[C@@H](C)NC(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000612841027 360104175 /nfs/dbraw/zinc/10/41/75/360104175.db2.gz WJBVUHXSXBCJJE-MNOVXSKESA-N 1 2 249.358 2.065 20 0 BEADLO CCc1ccc(C[N@H+]2CCOC[C@@H]2CC)o1 ZINC000091980957 360140289 /nfs/dbraw/zinc/14/02/89/360140289.db2.gz HUBUHBZJOFMMMK-NSHDSACASA-N 1 2 223.316 2.453 20 0 BEADLO CCc1ccc(C[N@@H+]2CCOC[C@@H]2CC)o1 ZINC000091980957 360140291 /nfs/dbraw/zinc/14/02/91/360140291.db2.gz HUBUHBZJOFMMMK-NSHDSACASA-N 1 2 223.316 2.453 20 0 BEADLO CC[C@H]([NH2+]Cc1cn(C)cn1)c1nccs1 ZINC000309385149 491147797 /nfs/dbraw/zinc/14/77/97/491147797.db2.gz BCMMWBNYLOWRHM-JTQLQIEISA-N 1 2 236.344 2.118 20 0 BEADLO CC[C@H](NCc1cn(C)c[nH+]1)c1nccs1 ZINC000309385149 491147798 /nfs/dbraw/zinc/14/77/98/491147798.db2.gz BCMMWBNYLOWRHM-JTQLQIEISA-N 1 2 236.344 2.118 20 0 BEADLO CNc1ccc(C(=O)Nc2cc[nH+]c(C)c2)cn1 ZINC000092366236 360165183 /nfs/dbraw/zinc/16/51/83/360165183.db2.gz IPRKVLWXLKMSCS-UHFFFAOYSA-N 1 2 242.282 2.079 20 0 BEADLO Cc1[nH]ncc1C[NH+]1C[C@@H](C)S[C@H](C)C1 ZINC000092541418 360179124 /nfs/dbraw/zinc/17/91/24/360179124.db2.gz CCOJYJCGXUCQEU-RKDXNWHRSA-N 1 2 225.361 2.044 20 0 BEADLO CCC[C@H]([NH2+]CCC(F)(F)F)C(=O)OCC ZINC000097988548 360385093 /nfs/dbraw/zinc/38/50/93/360385093.db2.gz ZTOICEBVPLTEMI-QMMMGPOBSA-N 1 2 241.253 2.260 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccn(C)n1)c1nccs1 ZINC000096811845 360355796 /nfs/dbraw/zinc/35/57/96/360355796.db2.gz KKKCMKFHURBJLG-SNVBAGLBSA-N 1 2 236.344 2.118 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N[C@H]1CCCC12CC2 ZINC000633780757 360496302 /nfs/dbraw/zinc/49/63/02/360496302.db2.gz VAYPRJCSUNPBOI-JQWIXIFHSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N[C@H]1CCCC12CC2 ZINC000633780757 360496305 /nfs/dbraw/zinc/49/63/05/360496305.db2.gz VAYPRJCSUNPBOI-JQWIXIFHSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H](CC(=O)N[C@@H]1CCCC12CC2)n1cc[nH+]c1 ZINC000633781574 360496370 /nfs/dbraw/zinc/49/63/70/360496370.db2.gz XXLNGENCSGWCIY-VXGBXAGGSA-N 1 2 247.342 2.283 20 0 BEADLO CC(C)(F)C[NH2+]Cc1n[nH]c2ccccc21 ZINC000631190081 360535945 /nfs/dbraw/zinc/53/59/45/360535945.db2.gz WNIGDBCTORNFKY-UHFFFAOYSA-N 1 2 221.279 2.401 20 0 BEADLO Cn1c[nH+]cc1CNc1ncc(Cl)cc1F ZINC000309501350 491150437 /nfs/dbraw/zinc/15/04/37/491150437.db2.gz LRBZXJGHNXDYER-UHFFFAOYSA-N 1 2 240.669 2.220 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)NCC[C@@H]1CC=CCC1 ZINC000628889397 360730333 /nfs/dbraw/zinc/73/03/33/360730333.db2.gz NQIYOLRBFZLMNS-GFCCVEGCSA-N 1 2 247.342 2.205 20 0 BEADLO c1cc(N2CCCC2)[nH+]cc1NC1CSC1 ZINC000309541535 491150881 /nfs/dbraw/zinc/15/08/81/491150881.db2.gz GMWHHCIGIJXYPO-UHFFFAOYSA-N 1 2 235.356 2.209 20 0 BEADLO O=C(CCn1cc[nH+]c1)NCC[C@@H]1CC=CCC1 ZINC000628892294 360732496 /nfs/dbraw/zinc/73/24/96/360732496.db2.gz VLGJZBSFKMTNPY-CYBMUJFWSA-N 1 2 247.342 2.136 20 0 BEADLO Cc1cc(NC(=O)CCC(C)(F)F)cc[nH+]1 ZINC000613197445 360734971 /nfs/dbraw/zinc/73/49/71/360734971.db2.gz VSBVJQAKHDSEOC-UHFFFAOYSA-N 1 2 228.242 2.186 20 0 BEADLO C[C@H](O)[C@H]1CCN(c2cc3ccccc3c[nH+]2)C1 ZINC000631200442 360789183 /nfs/dbraw/zinc/78/91/83/360789183.db2.gz HERNHJIYGPAXGJ-FZMZJTMJSA-N 1 2 242.322 2.442 20 0 BEADLO C[C@@H]1C[C@H]1CSc1[nH+]cnc2c1cnn2C ZINC000629113834 360882688 /nfs/dbraw/zinc/88/26/88/360882688.db2.gz ZQCPUPDREFYHPU-SFYZADRCSA-N 1 2 234.328 2.111 20 0 BEADLO C[C@H]1C[C@H]1CSc1[nH+]cnc2c1cnn2C ZINC000629113835 360882843 /nfs/dbraw/zinc/88/28/43/360882843.db2.gz ZQCPUPDREFYHPU-YUMQZZPRSA-N 1 2 234.328 2.111 20 0 BEADLO C[C@@H]1C[C@@H](Nc2c[nH+]cc(N(C)C)c2)[C@H](C)O1 ZINC000631203590 360900060 /nfs/dbraw/zinc/90/00/60/360900060.db2.gz QQJZTAWVRUHPCC-GBIKHYSHSA-N 1 2 235.331 2.125 20 0 BEADLO CCc1cc(N)nc(SC[C@@H]2C[C@H]2C)[nH+]1 ZINC000629178769 360926596 /nfs/dbraw/zinc/92/65/96/360926596.db2.gz JHFBUXFYZRKASS-SFYZADRCSA-N 1 2 223.345 2.200 20 0 BEADLO CC(C)(C)c1nc(N[C@H](CCO)C2CC2)cc[nH+]1 ZINC000301589587 200825122 /nfs/dbraw/zinc/82/51/22/200825122.db2.gz QCDZFALVFYYHLM-LLVKDONJSA-N 1 2 249.358 2.347 20 0 BEADLO C[NH2+]c1ccc(NCc2ccnn2C)cc1 ZINC000629388950 361035266 /nfs/dbraw/zinc/03/52/66/361035266.db2.gz FXWVUYDGZQSIFB-UHFFFAOYSA-N 1 2 216.288 2.074 20 0 BEADLO C[NH2+]c1ccc(NCc2cn(C)nc2C)cc1 ZINC000629389775 361036214 /nfs/dbraw/zinc/03/62/14/361036214.db2.gz VQZWMBGSFOEEEF-UHFFFAOYSA-N 1 2 230.315 2.382 20 0 BEADLO Cc1coc(SCc2cc[nH+]c(N)c2)n1 ZINC000194338728 361217932 /nfs/dbraw/zinc/21/79/32/361217932.db2.gz KYYLIJZMNJUUDN-UHFFFAOYSA-N 1 2 221.285 2.253 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@H]2CCOC2(C)C)[nH+]1 ZINC000579075895 366705077 /nfs/dbraw/zinc/70/50/77/366705077.db2.gz OSTDWHIFCOULPK-JTQLQIEISA-N 1 2 246.314 2.246 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2CC[C@@H]2C)c(C)c[nH+]1 ZINC000579095793 366708982 /nfs/dbraw/zinc/70/89/82/366708982.db2.gz PSVNWLSDEJQYNE-GZMMTYOYSA-N 1 2 233.315 2.040 20 0 BEADLO Cc1[nH]c(CNc2cccc(CO)c2)[nH+]c1C ZINC000579130740 366722003 /nfs/dbraw/zinc/72/20/03/366722003.db2.gz SKSXOAAEBQHKER-UHFFFAOYSA-N 1 2 231.299 2.131 20 0 BEADLO Fc1ccc(CC[NH+]2CCOCC2)c(Cl)c1 ZINC000428445979 201017360 /nfs/dbraw/zinc/01/73/60/201017360.db2.gz IBYGWQCDQOPLFT-UHFFFAOYSA-N 1 2 243.709 2.354 20 0 BEADLO CC[C@]1(C)C[N@@H+]([C@@H](C)c2cnc(C)cn2)CCO1 ZINC000428486422 201024704 /nfs/dbraw/zinc/02/47/04/201024704.db2.gz VXPSDHNQPCYCEZ-GXTWGEPZSA-N 1 2 249.358 2.347 20 0 BEADLO CC[C@]1(C)C[N@H+]([C@@H](C)c2cnc(C)cn2)CCO1 ZINC000428486422 201024707 /nfs/dbraw/zinc/02/47/07/201024707.db2.gz VXPSDHNQPCYCEZ-GXTWGEPZSA-N 1 2 249.358 2.347 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cnccc2C)ncn1 ZINC000428936710 201048998 /nfs/dbraw/zinc/04/89/98/201048998.db2.gz BNMJEDZRGVCJJE-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cnccc2C)ncn1 ZINC000428936710 201049000 /nfs/dbraw/zinc/04/90/00/201049000.db2.gz BNMJEDZRGVCJJE-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1nc(N[C@H]2Cc3cccc(O)c3C2)cc[nH+]1 ZINC000428675629 201033711 /nfs/dbraw/zinc/03/37/11/201033711.db2.gz MKGBTPTZQWFQHS-NSHDSACASA-N 1 2 241.294 2.070 20 0 BEADLO COCC(C)(C)[N@H+](C)Cc1nc(C(C)C)no1 ZINC000429264632 201087266 /nfs/dbraw/zinc/08/72/66/201087266.db2.gz NFLFRQOVJVAUSJ-UHFFFAOYSA-N 1 2 241.335 2.050 20 0 BEADLO COCC(C)(C)[N@@H+](C)Cc1nc(C(C)C)no1 ZINC000429264632 201087270 /nfs/dbraw/zinc/08/72/70/201087270.db2.gz NFLFRQOVJVAUSJ-UHFFFAOYSA-N 1 2 241.335 2.050 20 0 BEADLO CC(C)[N@H+](Cc1cocn1)Cc1ccccn1 ZINC000579308594 366756306 /nfs/dbraw/zinc/75/63/06/366756306.db2.gz WGOYBILXOCBATR-UHFFFAOYSA-N 1 2 231.299 2.480 20 0 BEADLO CC(C)[N@@H+](Cc1cocn1)Cc1ccccn1 ZINC000579308594 366756312 /nfs/dbraw/zinc/75/63/12/366756312.db2.gz WGOYBILXOCBATR-UHFFFAOYSA-N 1 2 231.299 2.480 20 0 BEADLO COC1C[NH+](Cc2ccc(C(F)F)cc2)C1 ZINC000579444811 366801335 /nfs/dbraw/zinc/80/13/35/366801335.db2.gz PEIANZCURRIYCH-UHFFFAOYSA-N 1 2 227.254 2.455 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[NH2+][C@@H]1C[C@H]1C1CC1 ZINC000429794498 201133792 /nfs/dbraw/zinc/13/37/92/201133792.db2.gz VNDGVYJXXWHURB-XQQFMLRXSA-N 1 2 239.359 2.352 20 0 BEADLO c1snnc1C[NH+](C1CCC1)C1CCC1 ZINC000430138694 201148015 /nfs/dbraw/zinc/14/80/15/201148015.db2.gz ZIVMELKOULJGDL-UHFFFAOYSA-N 1 2 223.345 2.445 20 0 BEADLO CCC(F)(F)C[NH2+]C[C@H](O)Cc1ccccc1 ZINC000629595704 361483738 /nfs/dbraw/zinc/48/37/38/361483738.db2.gz VHCUZEIDUNSFGM-GFCCVEGCSA-N 1 2 243.297 2.225 20 0 BEADLO CC[C@H]1CC[N@@H+]1Cc1ccn(C(F)F)n1 ZINC000430198451 201152222 /nfs/dbraw/zinc/15/22/22/201152222.db2.gz YMOWUZDCAVZOFO-VIFPVBQESA-N 1 2 215.247 2.263 20 0 BEADLO CC[C@H]1CC[N@H+]1Cc1ccn(C(F)F)n1 ZINC000430198451 201152224 /nfs/dbraw/zinc/15/22/24/201152224.db2.gz YMOWUZDCAVZOFO-VIFPVBQESA-N 1 2 215.247 2.263 20 0 BEADLO CC[C@H](F)C[NH2+][C@](C)(c1noc(C)n1)C1CC1 ZINC000433308384 201179173 /nfs/dbraw/zinc/17/91/73/201179173.db2.gz YAYNTILYFKIGNM-JQWIXIFHSA-N 1 2 241.310 2.341 20 0 BEADLO Cc1cc(N)nc(SCc2cnccc2C)[nH+]1 ZINC000433380785 201183372 /nfs/dbraw/zinc/18/33/72/201183372.db2.gz FNHUKPOLSVUTAS-UHFFFAOYSA-N 1 2 246.339 2.193 20 0 BEADLO C[C@]12CCCC[C@H]1CN2C(=O)CCc1[nH]cc[nH+]1 ZINC000629616663 361510717 /nfs/dbraw/zinc/51/07/17/361510717.db2.gz DSAHWSBNTLMEPO-FZMZJTMJSA-N 1 2 247.342 2.133 20 0 BEADLO CC1(CNc2cc(N3CCCC3)nc[nH+]2)CC1 ZINC000433788451 201194730 /nfs/dbraw/zinc/19/47/30/201194730.db2.gz GGXXUKWRIUFHFR-UHFFFAOYSA-N 1 2 232.331 2.289 20 0 BEADLO CC1(CNc2cc(N3CCCC3)[nH+]cn2)CC1 ZINC000433788451 201194732 /nfs/dbraw/zinc/19/47/32/201194732.db2.gz GGXXUKWRIUFHFR-UHFFFAOYSA-N 1 2 232.331 2.289 20 0 BEADLO CCn1cc(C[NH2+]Cc2ccc(C)cc2F)nn1 ZINC000631172174 361574679 /nfs/dbraw/zinc/57/46/79/361574679.db2.gz PGUTWYVPIAAVEV-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO COc1cccc(-c2c[nH]c(C)[nH+]2)c1OC ZINC000629696013 361626277 /nfs/dbraw/zinc/62/62/77/361626277.db2.gz SEIBERZKNNNGOG-UHFFFAOYSA-N 1 2 218.256 2.402 20 0 BEADLO Cc1cnccc1-c1ccc(N[C@@H](C)CO)[nH+]c1 ZINC000629698378 361634568 /nfs/dbraw/zinc/63/45/68/361634568.db2.gz VUZGJRMOWSBHOM-NSHDSACASA-N 1 2 243.310 2.245 20 0 BEADLO CNc1ccc(-c2ccc(F)cc2)c[nH+]1 ZINC000629691869 361619094 /nfs/dbraw/zinc/61/90/94/361619094.db2.gz CGSAHNBIHHJMJG-UHFFFAOYSA-N 1 2 202.232 2.351 20 0 BEADLO Cc1ccn(C2CC[NH+](Cc3cocn3)CC2)n1 ZINC000435050691 201250091 /nfs/dbraw/zinc/25/00/91/201250091.db2.gz ULDJDFLKTMFBRL-UHFFFAOYSA-N 1 2 246.314 2.017 20 0 BEADLO COCCCNc1ccc(-c2ccncc2)c[nH+]1 ZINC000629689775 361624170 /nfs/dbraw/zinc/62/41/70/361624170.db2.gz AILRLCLIUYCDRE-UHFFFAOYSA-N 1 2 243.310 2.014 20 0 BEADLO CC/C=C\CCn1ncc2c1nc[nH+]c2NC ZINC000435785290 201287905 /nfs/dbraw/zinc/28/79/05/201287905.db2.gz NZLYOLUZIZGPTF-PLNGDYQASA-N 1 2 231.303 2.224 20 0 BEADLO CCCOc1cncc(-c2ccc(NC)[nH+]c2)c1 ZINC000629734378 361673575 /nfs/dbraw/zinc/67/35/75/361673575.db2.gz ODYSVIODUTWURU-UHFFFAOYSA-N 1 2 243.310 2.396 20 0 BEADLO Cc1[nH]cc(-c2ccc3c(c2)CCOC3)[nH+]1 ZINC000629754827 361685203 /nfs/dbraw/zinc/68/52/03/361685203.db2.gz JXGXWESEZJZNGB-UHFFFAOYSA-N 1 2 214.268 2.458 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)NC[C@@H]1CCCC12CC2 ZINC000629831164 361727907 /nfs/dbraw/zinc/72/79/07/361727907.db2.gz QDNBFCRVRLRRLE-NSHDSACASA-N 1 2 247.342 2.039 20 0 BEADLO CC[N@H+](CC[C@@H]1CCOC1)CC(F)F ZINC000437995914 201383612 /nfs/dbraw/zinc/38/36/12/201383612.db2.gz JYUQBAGGNZKDSA-SECBINFHSA-N 1 2 207.264 2.000 20 0 BEADLO CC[N@@H+](CC[C@@H]1CCOC1)CC(F)F ZINC000437995914 201383615 /nfs/dbraw/zinc/38/36/15/201383615.db2.gz JYUQBAGGNZKDSA-SECBINFHSA-N 1 2 207.264 2.000 20 0 BEADLO COC(=O)[C@H](Cc1ccccc1)[NH2+]CC1CCC1 ZINC000614794272 363972564 /nfs/dbraw/zinc/97/25/64/363972564.db2.gz IKNHPNXTGNXHRR-AWEZNQCLSA-N 1 2 247.338 2.160 20 0 BEADLO COC(=O)[C@@H](Cc1ccccc1)[NH2+]CC1CCC1 ZINC000614794273 363972635 /nfs/dbraw/zinc/97/26/35/363972635.db2.gz IKNHPNXTGNXHRR-CQSZACIVSA-N 1 2 247.338 2.160 20 0 BEADLO Cc1ncc([C@H](C)[NH2+][C@@H]2CCn3ccnc32)s1 ZINC000631708752 364023962 /nfs/dbraw/zinc/02/39/62/364023962.db2.gz PUAMZCZPWBZACJ-WCBMZHEXSA-N 1 2 248.355 2.444 20 0 BEADLO Cc1ncc([C@@H](C)[NH2+][C@H]2CCn3ccnc32)s1 ZINC000631708750 364024026 /nfs/dbraw/zinc/02/40/26/364024026.db2.gz PUAMZCZPWBZACJ-SCZZXKLOSA-N 1 2 248.355 2.444 20 0 BEADLO CCc1nn(C)cc1Nc1cc(C)[nH+]c(C)n1 ZINC000232179328 541346759 /nfs/dbraw/zinc/34/67/59/541346759.db2.gz IDNDMARQOCKGAD-UHFFFAOYSA-N 1 2 231.303 2.133 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@H](CC(C)C)C2)no1 ZINC000074994821 364302527 /nfs/dbraw/zinc/30/25/27/364302527.db2.gz AWSYWEKGWIFUBE-LLVKDONJSA-N 1 2 223.320 2.246 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@H](CC(C)C)C2)no1 ZINC000074994821 364302532 /nfs/dbraw/zinc/30/25/32/364302532.db2.gz AWSYWEKGWIFUBE-LLVKDONJSA-N 1 2 223.320 2.246 20 0 BEADLO CC[C@@](C)(NC(=O)CCc1c[nH+]cn1C)C1CC1 ZINC000618962052 364400118 /nfs/dbraw/zinc/40/01/18/364400118.db2.gz UDCMPTNCWUIXEG-CQSZACIVSA-N 1 2 249.358 2.048 20 0 BEADLO COC[C@H](Nc1c[nH+]cc(C)c1)C1CC1 ZINC000134343807 541357471 /nfs/dbraw/zinc/35/74/71/541357471.db2.gz SMRPTLADRZTFQC-LBPRGKRZSA-N 1 2 206.289 2.227 20 0 BEADLO Cc1ccncc1C[NH2+]Cc1cscn1 ZINC000135461024 364441037 /nfs/dbraw/zinc/44/10/37/364441037.db2.gz UUHBYVKXUOPDBD-UHFFFAOYSA-N 1 2 219.313 2.136 20 0 BEADLO COc1ccccc1C[C@H](C)Nc1c[nH]c[nH+]1 ZINC000516560695 541358671 /nfs/dbraw/zinc/35/86/71/541358671.db2.gz OKCAEAZUGKWNBR-JTQLQIEISA-N 1 2 231.299 2.461 20 0 BEADLO COc1cncc(/C=C\CCn2cc[nH+]c2)c1 ZINC001642068150 1172319615 /nfs/dbraw/zinc/31/96/15/1172319615.db2.gz MPTDKZAIKAWEKI-RQOWECAXSA-N 1 2 229.283 2.390 20 0 BEADLO CN(C(=O)c1ccc(-c2c[nH]c[nH+]2)cc1)C1CC1 ZINC000630719609 364502962 /nfs/dbraw/zinc/50/29/62/364502962.db2.gz QNEIERVWAUPQAO-UHFFFAOYSA-N 1 2 241.294 2.311 20 0 BEADLO CC1=C(C(=O)N[C@H](C)c2[nH]cc[nH+]2)CCC1 ZINC000615159857 364551526 /nfs/dbraw/zinc/55/15/26/364551526.db2.gz DNQXDLDPIURNTQ-SECBINFHSA-N 1 2 219.288 2.087 20 0 BEADLO Cc1ccc(CCC[N@@H+](C)Cc2nnc[nH]2)cc1 ZINC000181974682 366857960 /nfs/dbraw/zinc/85/79/60/366857960.db2.gz YGBSUIXOVOIUDJ-UHFFFAOYSA-N 1 2 244.342 2.178 20 0 BEADLO Cc1ccc(CCC[N@H+](C)Cc2nnc[nH]2)cc1 ZINC000181974682 366857966 /nfs/dbraw/zinc/85/79/66/366857966.db2.gz YGBSUIXOVOIUDJ-UHFFFAOYSA-N 1 2 244.342 2.178 20 0 BEADLO CCc1ccc([C@@H](C)[NH2+]Cc2cc[nH]n2)o1 ZINC000167437614 364793056 /nfs/dbraw/zinc/79/30/56/364793056.db2.gz GCKUAYSNLLZQCV-SECBINFHSA-N 1 2 219.288 2.416 20 0 BEADLO COc1ccc[nH+]c1NCc1ccnn1C(C)C ZINC000573505140 364850301 /nfs/dbraw/zinc/85/03/01/364850301.db2.gz RMKXWVWYGYNAOE-UHFFFAOYSA-N 1 2 246.314 2.480 20 0 BEADLO C[C@@H](NC(=O)C1CC(C)(C)C1)c1[nH]cc[nH+]1 ZINC000573505712 364851242 /nfs/dbraw/zinc/85/12/42/364851242.db2.gz LQCMYRJJAUGVLY-MRVPVSSYSA-N 1 2 221.304 2.023 20 0 BEADLO C[C@@H](O)CCOc1ccccc1-n1cc[nH+]c1 ZINC000573668721 364888155 /nfs/dbraw/zinc/88/81/55/364888155.db2.gz INXUZSBMVGATPC-LLVKDONJSA-N 1 2 232.283 2.022 20 0 BEADLO CC(C)N(C(=O)CCCn1cc[nH+]c1)C1CC1 ZINC000623252292 541422995 /nfs/dbraw/zinc/42/29/95/541422995.db2.gz GMYAFLZSFSKCHU-UHFFFAOYSA-N 1 2 235.331 2.063 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)c1cccc(Cl)c1 ZINC000336014741 541424759 /nfs/dbraw/zinc/42/47/59/541424759.db2.gz FSUNVLOVDISNOL-UHFFFAOYSA-N 1 2 249.701 2.004 20 0 BEADLO CC(C)[C@@H]1CCN1C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000574092437 364986367 /nfs/dbraw/zinc/98/63/67/364986367.db2.gz TZBQTKCOGWMZSG-RYUDHWBXSA-N 1 2 235.331 2.091 20 0 BEADLO CCOc1ccccc1C[NH2+]Cc1ncccn1 ZINC000574412426 365057812 /nfs/dbraw/zinc/05/78/12/365057812.db2.gz AQCOBOSBTFSFDZ-UHFFFAOYSA-N 1 2 243.310 2.165 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCC(CCCO)CC1 ZINC000574464760 365069337 /nfs/dbraw/zinc/06/93/37/365069337.db2.gz RWRHUMYQVHQHJV-UHFFFAOYSA-N 1 2 249.358 2.082 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)C[C@H]2C=CCC2)[nH+]1 ZINC000574524910 365083894 /nfs/dbraw/zinc/08/38/94/365083894.db2.gz KYTRJFLEHFXWMA-NSHDSACASA-N 1 2 247.342 2.426 20 0 BEADLO CCn1c[nH+]cc1CN=c1cc(C(C)C)o[nH]1 ZINC000574545834 365087574 /nfs/dbraw/zinc/08/75/74/365087574.db2.gz YFROKJYKRVYYEI-UHFFFAOYSA-N 1 2 234.303 2.048 20 0 BEADLO CC(C)CCCC(=O)N1CC(n2cc[nH+]c2)C1 ZINC000574837896 365156866 /nfs/dbraw/zinc/15/68/66/365156866.db2.gz PYHIPRYSUMBJEZ-UHFFFAOYSA-N 1 2 235.331 2.093 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CCS[C@H](C)C2)o1 ZINC000171686096 365225119 /nfs/dbraw/zinc/22/51/19/365225119.db2.gz MNSMKFDREQEGBS-SECBINFHSA-N 1 2 241.360 2.130 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CCS[C@H](C)C2)o1 ZINC000171686096 365225124 /nfs/dbraw/zinc/22/51/24/365225124.db2.gz MNSMKFDREQEGBS-SECBINFHSA-N 1 2 241.360 2.130 20 0 BEADLO CC[C@H](c1ccccc1)[NH+]1CCS(=O)CC1 ZINC000171700482 365227543 /nfs/dbraw/zinc/22/75/43/365227543.db2.gz XBJWRYYWYGBHKX-CYBMUJFWSA-N 1 2 237.368 2.202 20 0 BEADLO Cn1c2c(cccc2F)[nH]c1=[NH+]C1CCCC1 ZINC000443411267 193020407 /nfs/dbraw/zinc/02/04/07/193020407.db2.gz VEQPOCVEDBMKNK-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO CCc1cc(C[NH2+]Cc2cncn2C(C)C)on1 ZINC000575115609 365205607 /nfs/dbraw/zinc/20/56/07/365205607.db2.gz NGGSAFVVXTVLJD-UHFFFAOYSA-N 1 2 248.330 2.304 20 0 BEADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1ncccn1 ZINC000192041155 365270788 /nfs/dbraw/zinc/27/07/88/365270788.db2.gz HZJARRRESVYHSO-GFCCVEGCSA-N 1 2 239.322 2.423 20 0 BEADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1ncccn1 ZINC000192041155 365270792 /nfs/dbraw/zinc/27/07/92/365270792.db2.gz HZJARRRESVYHSO-GFCCVEGCSA-N 1 2 239.322 2.423 20 0 BEADLO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1ncccn1 ZINC000192080269 365273149 /nfs/dbraw/zinc/27/31/49/365273149.db2.gz NQAAVWNSJDILQR-ZDUSSCGKSA-N 1 2 242.326 2.152 20 0 BEADLO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1ncccn1 ZINC000192080269 365273156 /nfs/dbraw/zinc/27/31/56/365273156.db2.gz NQAAVWNSJDILQR-ZDUSSCGKSA-N 1 2 242.326 2.152 20 0 BEADLO CC[C@@H]([NH2+]C/C=C\c1ccccc1)C(=O)OC ZINC000336720375 365362528 /nfs/dbraw/zinc/36/25/28/365362528.db2.gz WNODKHWMYPYSNS-PGJNLMOESA-N 1 2 233.311 2.241 20 0 BEADLO CCC[C@@H](C)C[N@@H+]1CCOCC(F)(F)C1 ZINC000575929862 365418737 /nfs/dbraw/zinc/41/87/37/365418737.db2.gz SBRUKBHCPWTPRC-SNVBAGLBSA-N 1 2 221.291 2.390 20 0 BEADLO CCC[C@@H](C)C[N@H+]1CCOCC(F)(F)C1 ZINC000575929862 365418745 /nfs/dbraw/zinc/41/87/45/365418745.db2.gz SBRUKBHCPWTPRC-SNVBAGLBSA-N 1 2 221.291 2.390 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCSC(C)(C)C1 ZINC000575882378 365405270 /nfs/dbraw/zinc/40/52/70/365405270.db2.gz QRSKRBYEVJZCBB-UHFFFAOYSA-N 1 2 237.372 2.425 20 0 BEADLO CC[C@@H]([NH2+][C@H](C)[C@@H](C)OC)C(=O)OC(C)(C)C ZINC000575969096 365427902 /nfs/dbraw/zinc/42/79/02/365427902.db2.gz WQPHOYBWVAQVDH-GMTAPVOTSA-N 1 2 245.363 2.120 20 0 BEADLO CC1=CCN(C(=O)C[C@H](C)n2cc[nH+]c2)CC1 ZINC000576113236 365490969 /nfs/dbraw/zinc/49/09/69/365490969.db2.gz BVUJVLFHAIYTIA-LBPRGKRZSA-N 1 2 233.315 2.013 20 0 BEADLO CC[C@@H]([NH2+]Cc1cccc(C)n1)c1nccn1C ZINC000182524498 366913963 /nfs/dbraw/zinc/91/39/63/366913963.db2.gz OZSNINWXVADWNW-CYBMUJFWSA-N 1 2 244.342 2.364 20 0 BEADLO CN(CCCn1cc[nH+]c1)c1ccccc1 ZINC000182621650 366923697 /nfs/dbraw/zinc/92/36/97/366923697.db2.gz PDGXKKGPFQLRNN-UHFFFAOYSA-N 1 2 215.300 2.410 20 0 BEADLO COc1ccc(C[NH2+][C@@H](C)c2ncc[nH]2)c(F)c1 ZINC000353647736 541484799 /nfs/dbraw/zinc/48/47/99/541484799.db2.gz SMQTUKXSSRUZDN-VIFPVBQESA-N 1 2 249.289 2.408 20 0 BEADLO CCOCC[N@H+](C)Cc1noc2c1CCCC2 ZINC000093311851 541491013 /nfs/dbraw/zinc/49/10/13/541491013.db2.gz HNCNMPLJANUXLF-UHFFFAOYSA-N 1 2 238.331 2.022 20 0 BEADLO CCOCC[N@@H+](C)Cc1noc2c1CCCC2 ZINC000093311851 541491017 /nfs/dbraw/zinc/49/10/17/541491017.db2.gz HNCNMPLJANUXLF-UHFFFAOYSA-N 1 2 238.331 2.022 20 0 BEADLO CC[C@H]1CCC[C@H](C[N@H+](C)Cc2nnc[nH]2)C1 ZINC000183085088 366975554 /nfs/dbraw/zinc/97/55/54/366975554.db2.gz XRRYRWZWILODSO-RYUDHWBXSA-N 1 2 236.363 2.453 20 0 BEADLO CC[C@H]1CCC[C@H](C[N@@H+](C)Cc2nnc[nH]2)C1 ZINC000183085088 366975559 /nfs/dbraw/zinc/97/55/59/366975559.db2.gz XRRYRWZWILODSO-RYUDHWBXSA-N 1 2 236.363 2.453 20 0 BEADLO CC[C@H](C)CN(C)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000579718407 366990901 /nfs/dbraw/zinc/99/09/01/366990901.db2.gz HSFUDNODANJIRV-RYUDHWBXSA-N 1 2 237.347 2.339 20 0 BEADLO C[C@H](CC(=O)N1CCCC12CCC2)n1cc[nH+]c1 ZINC000579723036 366991789 /nfs/dbraw/zinc/99/17/89/366991789.db2.gz VDSZEPVAQJHGOQ-GFCCVEGCSA-N 1 2 247.342 2.379 20 0 BEADLO Cc1nc(C[N@H+](C)CCC(C)(C)C)no1 ZINC000183703692 367041420 /nfs/dbraw/zinc/04/14/20/367041420.db2.gz DVZHNELJVFZOOB-UHFFFAOYSA-N 1 2 211.309 2.246 20 0 BEADLO Cc1nc(C[N@@H+](C)CCC(C)(C)C)no1 ZINC000183703692 367041424 /nfs/dbraw/zinc/04/14/24/367041424.db2.gz DVZHNELJVFZOOB-UHFFFAOYSA-N 1 2 211.309 2.246 20 0 BEADLO Cc1c[nH+]c(C)nc1NC[C@@H](C)C(F)(F)F ZINC000579972960 367109549 /nfs/dbraw/zinc/10/95/49/367109549.db2.gz QWCITBFLXWBFEY-SSDOTTSWSA-N 1 2 233.237 2.126 20 0 BEADLO COC1CCC(CNc2nc(C)[nH+]cc2C)CC1 ZINC000580963806 367221236 /nfs/dbraw/zinc/22/12/36/367221236.db2.gz ZQUINABTTRSONE-UHFFFAOYSA-N 1 2 249.358 2.132 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)[C@@H](C)C(C)C)[nH+]1 ZINC000581137135 367274575 /nfs/dbraw/zinc/27/45/75/367274575.db2.gz MKFZTVQOQVGKCL-JTQLQIEISA-N 1 2 237.347 2.362 20 0 BEADLO CCc1cnn(Cc2[nH+]ccn2C(F)F)c1 ZINC000565220059 325879339 /nfs/dbraw/zinc/87/93/39/325879339.db2.gz BNWUVFZJVLRWAU-UHFFFAOYSA-N 1 2 226.230 2.085 20 0 BEADLO CO[C@@]1(C)CCCN(c2nc(C)[nH+]cc2C)CC1 ZINC000581321644 367348270 /nfs/dbraw/zinc/34/82/70/367348270.db2.gz SPACNIGRXDCUSU-AWEZNQCLSA-N 1 2 249.358 2.489 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2CCOC[C@H]2C)c(C)[nH+]1 ZINC000194658513 367315831 /nfs/dbraw/zinc/31/58/31/367315831.db2.gz WMTGBJBAAFUUCY-SKDRFNHKSA-N 1 2 248.326 2.310 20 0 BEADLO CC(C)(C)[C@H](NCc1c[nH+]c[nH]1)C(F)(F)F ZINC000381358390 367387658 /nfs/dbraw/zinc/38/76/58/367387658.db2.gz CRHUUBWYRFWBMC-QMMMGPOBSA-N 1 2 235.253 2.476 20 0 BEADLO CC(C)(C)[C@H](NCc1c[nH]c[nH+]1)C(F)(F)F ZINC000381358390 367387664 /nfs/dbraw/zinc/38/76/64/367387664.db2.gz CRHUUBWYRFWBMC-QMMMGPOBSA-N 1 2 235.253 2.476 20 0 BEADLO COCc1ccc(C[NH2+]Cc2cc(C)on2)o1 ZINC000382475396 367529504 /nfs/dbraw/zinc/52/95/04/367529504.db2.gz HRWCKJGFIXCNCS-UHFFFAOYSA-N 1 2 236.271 2.012 20 0 BEADLO CC(C)C(C)(C)NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000581491737 367521198 /nfs/dbraw/zinc/52/11/98/367521198.db2.gz GGDICDXXVYCIDH-LLVKDONJSA-N 1 2 237.347 2.385 20 0 BEADLO Cn1c[nH+]cc1CC(=O)N1CCCC(C)(C)CC1 ZINC000581599839 367624720 /nfs/dbraw/zinc/62/47/20/367624720.db2.gz FFSUWEFJHHZVIQ-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO Cc1cccc(C[NH2+]Cc2ccn(C)n2)c1F ZINC000384478795 367692742 /nfs/dbraw/zinc/69/27/42/367692742.db2.gz WQEWQLDZYNJUCO-UHFFFAOYSA-N 1 2 233.290 2.157 20 0 BEADLO CC/C=C\C[NH2+][C@@H](CCC)C(=O)OCC ZINC000384710563 367719110 /nfs/dbraw/zinc/71/91/10/367719110.db2.gz DIMZYQVIWFONSP-TVRMLOFPSA-N 1 2 213.321 2.274 20 0 BEADLO CC/C=C/C[NH+]=c1[nH]c2ccccc2[nH]1 ZINC000385030984 367775746 /nfs/dbraw/zinc/77/57/46/367775746.db2.gz PTUGGHXHEUKHJX-ZZXKWVIFSA-N 1 2 201.273 2.363 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCC(=O)CC12CCC2 ZINC000581832977 367837010 /nfs/dbraw/zinc/83/70/10/367837010.db2.gz YLNNNNHFGNXVCU-UHFFFAOYSA-N 1 2 248.326 2.379 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCC(=O)CC12CCC2 ZINC000581832977 367837016 /nfs/dbraw/zinc/83/70/16/367837016.db2.gz YLNNNNHFGNXVCU-UHFFFAOYSA-N 1 2 248.326 2.379 20 0 BEADLO Cc1cc(N[C@@H](CO)C2CCCCC2)nc[nH+]1 ZINC000386112747 367914484 /nfs/dbraw/zinc/91/44/84/367914484.db2.gz KQZXDTHWVZFCAS-LBPRGKRZSA-N 1 2 235.331 2.138 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N[C@H](C1CC1)C1CCC1 ZINC000581987371 368051696 /nfs/dbraw/zinc/05/16/96/368051696.db2.gz MKDGLPYJZCBCJV-AWEZNQCLSA-N 1 2 247.342 2.037 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N[C@H](C1CC1)C1CCC1 ZINC000581987371 368051699 /nfs/dbraw/zinc/05/16/99/368051699.db2.gz MKDGLPYJZCBCJV-AWEZNQCLSA-N 1 2 247.342 2.037 20 0 BEADLO CC[C@@H](C)N(C)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000566307564 326032013 /nfs/dbraw/zinc/03/20/13/326032013.db2.gz KYOBALMWWKROGP-GHMZBOCLSA-N 1 2 223.320 2.091 20 0 BEADLO COCCc1ncc(CNc2cccc[nH+]2)s1 ZINC000630951724 368147293 /nfs/dbraw/zinc/14/72/93/368147293.db2.gz UHOHYRQJLUMJDN-UHFFFAOYSA-N 1 2 249.339 2.339 20 0 BEADLO CN(C)c1c[nH+]cc(NCc2ccn(C)c2)c1 ZINC000630955877 368149825 /nfs/dbraw/zinc/14/98/25/368149825.db2.gz GMVGCLKYOBOMTR-UHFFFAOYSA-N 1 2 230.315 2.098 20 0 BEADLO CCC[C@@H](C)C(=O)NCc1ccc(N(C)C)[nH+]c1 ZINC000042497957 368310506 /nfs/dbraw/zinc/31/05/06/368310506.db2.gz LMYGMMLYMIRGCT-LLVKDONJSA-N 1 2 249.358 2.200 20 0 BEADLO c1c(C[NH+]2CCOCC2)onc1-c1ccccc1 ZINC000054115170 368332145 /nfs/dbraw/zinc/33/21/45/368332145.db2.gz VENMITPILVZPQO-UHFFFAOYSA-N 1 2 244.294 2.174 20 0 BEADLO C[C@@H]1CCN(c2cc(CO)cc[nH+]2)C[C@H]1C ZINC000253069013 368444759 /nfs/dbraw/zinc/44/47/59/368444759.db2.gz LGNFOJCWVYRSMF-GHMZBOCLSA-N 1 2 220.316 2.056 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@H](C)CC(C)C)no1 ZINC000045943808 368434179 /nfs/dbraw/zinc/43/41/79/368434179.db2.gz DGTNZKLBWWIDAY-SECBINFHSA-N 1 2 211.309 2.244 20 0 BEADLO Cc1nc(C[N@H+](C)[C@H](C)CC(C)C)no1 ZINC000045943808 368434183 /nfs/dbraw/zinc/43/41/83/368434183.db2.gz DGTNZKLBWWIDAY-SECBINFHSA-N 1 2 211.309 2.244 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)CCC1CCCC1 ZINC000061512265 368564531 /nfs/dbraw/zinc/56/45/31/368564531.db2.gz CDSULEUDXSNOLK-UHFFFAOYSA-N 1 2 249.358 2.349 20 0 BEADLO CCCCc1nc(C[NH+]2CCCCC2)no1 ZINC000064931340 368615761 /nfs/dbraw/zinc/61/57/61/368615761.db2.gz TWXTWPBWFUYSJO-UHFFFAOYSA-N 1 2 223.320 2.398 20 0 BEADLO C[C@H]1CCCC[C@]1(C)NC(=O)CCn1cc[nH+]c1 ZINC000457249427 203028139 /nfs/dbraw/zinc/02/81/39/203028139.db2.gz IWDKWWVNAZIUMT-JSGCOSHPSA-N 1 2 249.358 2.358 20 0 BEADLO Cc1nc(C[N@H+](C)CCc2ccccc2F)no1 ZINC000068866808 368740354 /nfs/dbraw/zinc/74/03/54/368740354.db2.gz YIKRQHOSJALUPQ-UHFFFAOYSA-N 1 2 249.289 2.192 20 0 BEADLO Cc1nc(C[N@@H+](C)CCc2ccccc2F)no1 ZINC000068866808 368740359 /nfs/dbraw/zinc/74/03/59/368740359.db2.gz YIKRQHOSJALUPQ-UHFFFAOYSA-N 1 2 249.289 2.192 20 0 BEADLO O=C(CCn1cc[nH+]c1)NC1CCCCCC1 ZINC000072619892 368775524 /nfs/dbraw/zinc/77/55/24/368775524.db2.gz HTARVVQCWPLASZ-UHFFFAOYSA-N 1 2 235.331 2.112 20 0 BEADLO CC(C)(NC(=O)[C@@H]1CCC[C@H]2C[C@H]21)c1[nH]cc[nH+]1 ZINC000615952763 368760953 /nfs/dbraw/zinc/76/09/53/368760953.db2.gz HZUABJDEAYWRHA-HBNTYKKESA-N 1 2 247.342 2.197 20 0 BEADLO CCOC(=O)C[N@H+](C)[C@@H](C)c1cccc(F)c1 ZINC000069521536 370945800 /nfs/dbraw/zinc/94/58/00/370945800.db2.gz WQJHFCJJMDNQPA-JTQLQIEISA-N 1 2 239.290 2.382 20 0 BEADLO CCOC(=O)C[N@@H+](C)[C@@H](C)c1cccc(F)c1 ZINC000069521536 370945804 /nfs/dbraw/zinc/94/58/04/370945804.db2.gz WQJHFCJJMDNQPA-JTQLQIEISA-N 1 2 239.290 2.382 20 0 BEADLO CC(C)(O)CSc1[nH+]cc2ccccn21 ZINC000069251560 368750603 /nfs/dbraw/zinc/75/06/03/368750603.db2.gz KRHJHLFYNDRXHE-UHFFFAOYSA-N 1 2 222.313 2.197 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)[C@H]2CCC2(C)C)c2[nH+]ccn21 ZINC000615963972 368800908 /nfs/dbraw/zinc/80/09/08/368800908.db2.gz UTWMJRCDCSKNRB-GMTAPVOTSA-N 1 2 247.342 2.441 20 0 BEADLO CC[C@H]1CCCCCN1C(=O)Cn1cc[nH+]c1 ZINC000073904022 368820351 /nfs/dbraw/zinc/82/03/51/368820351.db2.gz ZYBIBYOAYINMIZ-LBPRGKRZSA-N 1 2 235.331 2.064 20 0 BEADLO Cc1ccc(C(C)(C)C[NH2+]Cc2ccn[nH]2)nc1 ZINC000623648242 368973005 /nfs/dbraw/zinc/97/30/05/368973005.db2.gz BGPLYKYSLAXEKA-UHFFFAOYSA-N 1 2 244.342 2.181 20 0 BEADLO CC(C)(C)C1CC(C(=O)NCc2c[nH+]c[nH]2)C1 ZINC000457566074 203076215 /nfs/dbraw/zinc/07/62/15/203076215.db2.gz DBNCUQTVKHUBFX-UHFFFAOYSA-N 1 2 235.331 2.098 20 0 BEADLO CC(C)(C)C1CC(C(=O)NCc2c[nH]c[nH+]2)C1 ZINC000457566074 203076217 /nfs/dbraw/zinc/07/62/17/203076217.db2.gz DBNCUQTVKHUBFX-UHFFFAOYSA-N 1 2 235.331 2.098 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H](C)C1CCC1 ZINC000457494592 203068395 /nfs/dbraw/zinc/06/83/95/203068395.db2.gz BGSYBVLGKNFJMK-VIFPVBQESA-N 1 2 234.299 2.465 20 0 BEADLO Cc1cccn2c(NC(=O)COC(C)C)c[nH+]c12 ZINC000619012914 369257648 /nfs/dbraw/zinc/25/76/48/369257648.db2.gz IVSLTFOUWRSIDY-UHFFFAOYSA-N 1 2 247.298 2.006 20 0 BEADLO CC(C)OC1CC([N@H+](C)CC(F)F)C1 ZINC000459337787 203261795 /nfs/dbraw/zinc/26/17/95/203261795.db2.gz LAMSMSLOZYMKJB-UHFFFAOYSA-N 1 2 207.264 2.139 20 0 BEADLO CC(C)OC1CC([N@@H+](C)CC(F)F)C1 ZINC000459337787 203261798 /nfs/dbraw/zinc/26/17/98/203261798.db2.gz LAMSMSLOZYMKJB-UHFFFAOYSA-N 1 2 207.264 2.139 20 0 BEADLO CCC(F)(F)C[NH2+][C@@H]1C[C@@H](C)N(C2CC2)C1 ZINC000623680126 369381557 /nfs/dbraw/zinc/38/15/57/369381557.db2.gz YSEZFOLMYHDXES-NXEZZACHSA-N 1 2 232.318 2.247 20 0 BEADLO CCn1cc(C[NH2+]CC(F)(F)CC)cn1 ZINC000623680093 369381815 /nfs/dbraw/zinc/38/18/15/369381815.db2.gz XJDJKZWQBNSSQF-UHFFFAOYSA-N 1 2 217.263 2.038 20 0 BEADLO CCc1cccc(F)c1C[NH+]1CC(OC)C1 ZINC000459588159 203307961 /nfs/dbraw/zinc/30/79/61/203307961.db2.gz VZCBWGJZWDUTKY-UHFFFAOYSA-N 1 2 223.291 2.219 20 0 BEADLO CCOC1(C)C[NH+](Cc2cccc(O)c2)C1 ZINC000459614358 203316220 /nfs/dbraw/zinc/31/62/20/203316220.db2.gz ODMQJOCRHZTHEO-UHFFFAOYSA-N 1 2 221.300 2.003 20 0 BEADLO Cc1c[nH+]c(CN2CC(C3CCCC3)C2)n1C ZINC000459612706 203316746 /nfs/dbraw/zinc/31/67/46/203316746.db2.gz MLPHWECWKRZSBQ-UHFFFAOYSA-N 1 2 233.359 2.351 20 0 BEADLO CCOC1(C)C[NH+](Cc2ccc(F)cc2)C1 ZINC000459611597 203316946 /nfs/dbraw/zinc/31/69/46/203316946.db2.gz AIRQVRATHXFZKQ-UHFFFAOYSA-N 1 2 223.291 2.437 20 0 BEADLO CCOC1(C)C[NH+](Cc2ccsc2)C1 ZINC000459623639 203320470 /nfs/dbraw/zinc/32/04/70/203320470.db2.gz PWWTVUJHDZBWQB-UHFFFAOYSA-N 1 2 211.330 2.359 20 0 BEADLO Cc1cccc(CC[NH+]2CC(OC(F)F)C2)c1 ZINC000459630594 203324978 /nfs/dbraw/zinc/32/49/78/203324978.db2.gz PGGLENZGEMHBMN-UHFFFAOYSA-N 1 2 241.281 2.461 20 0 BEADLO Cn1cc[nH+]c1CN1CC(C)(CC(F)(F)F)C1 ZINC000459637062 203325883 /nfs/dbraw/zinc/32/58/83/203325883.db2.gz KSENGSVEDZYSGT-UHFFFAOYSA-N 1 2 247.264 2.194 20 0 BEADLO CCCCc1cc(N[C@H](C)COC)nc[nH+]1 ZINC000631033907 370984772 /nfs/dbraw/zinc/98/47/72/370984772.db2.gz CKVIZGVRNFWGNO-SNVBAGLBSA-N 1 2 223.320 2.266 20 0 BEADLO CC(C)CC(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000082277324 370978688 /nfs/dbraw/zinc/97/86/88/370978688.db2.gz KVNYYZYBZKFUCT-GFCCVEGCSA-N 1 2 235.331 2.093 20 0 BEADLO O=C(C1CCCC1)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000082278172 370978988 /nfs/dbraw/zinc/97/89/88/370978988.db2.gz CVBNHAZPLDINIR-ZDUSSCGKSA-N 1 2 247.342 2.237 20 0 BEADLO CC(C)[C@@H](NC(=O)C[C@H](C)n1cc[nH+]c1)C1CC1 ZINC000620032804 369677681 /nfs/dbraw/zinc/67/76/81/369677681.db2.gz FPPQXOGUAKMLIR-SMDDNHRTSA-N 1 2 249.358 2.385 20 0 BEADLO C[C@H](CC(=O)N[C@@]1(C)CC1(C)C)n1cc[nH+]c1 ZINC000620084532 369723649 /nfs/dbraw/zinc/72/36/49/369723649.db2.gz BZKBVWXIUQXKAA-MFKMUULPSA-N 1 2 235.331 2.139 20 0 BEADLO Cc1[nH]c(C(=O)NC2(CC(C)C)CC2)c[nH+]1 ZINC000620283532 369799069 /nfs/dbraw/zinc/79/90/69/369799069.db2.gz BLOUXYFLPODUOE-UHFFFAOYSA-N 1 2 221.304 2.027 20 0 BEADLO C[C@@H](NC(=O)[C@H](C)C(C)(C)C)c1[nH+]ccn1C ZINC000620600483 369950220 /nfs/dbraw/zinc/95/02/20/369950220.db2.gz OCBJFMJTUPTUGU-VHSXEESVSA-N 1 2 237.347 2.280 20 0 BEADLO C[C@@H](C(=O)N[C@@H](C)c1[nH+]ccn1C)C(C)(C)C ZINC000620600482 369950715 /nfs/dbraw/zinc/95/07/15/369950715.db2.gz OCBJFMJTUPTUGU-UWVGGRQHSA-N 1 2 237.347 2.280 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CC12CCCC2)c1[nH+]ccn1C ZINC000620603905 369951289 /nfs/dbraw/zinc/95/12/89/369951289.db2.gz OLLLUOGYFIXHCO-MNOVXSKESA-N 1 2 247.342 2.178 20 0 BEADLO C[C@@H](NC(=O)C[C@H]1CC[C@@H](C)C1)c1[nH+]ccn1C ZINC000620603648 369951754 /nfs/dbraw/zinc/95/17/54/369951754.db2.gz MHDLTLZTUMVMBB-UTUOFQBUSA-N 1 2 249.358 2.424 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620604924 369953034 /nfs/dbraw/zinc/95/30/34/369953034.db2.gz XEUOHTZMVMMOBT-GARJFASQSA-N 1 2 237.347 2.280 20 0 BEADLO C[C@@H](NC(=O)C1C(C)(C)C1(C)C)c1[nH+]ccn1C ZINC000620604377 369953199 /nfs/dbraw/zinc/95/31/99/369953199.db2.gz SVHDSMDREXYZAK-SECBINFHSA-N 1 2 249.358 2.280 20 0 BEADLO CC[C@H](C)CC(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620605748 369954337 /nfs/dbraw/zinc/95/43/37/369954337.db2.gz JSVLAOMJQMQBAQ-UWVGGRQHSA-N 1 2 223.320 2.034 20 0 BEADLO C=C/C(C)=C/CC(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620605891 369954866 /nfs/dbraw/zinc/95/48/66/369954866.db2.gz MFWSZRJCAIHSRO-RUYJGKKWSA-N 1 2 233.315 2.120 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620607023 369955420 /nfs/dbraw/zinc/95/54/20/369955420.db2.gz DKOQLXLRKOYGNC-QJPTWQEYSA-N 1 2 249.358 2.424 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620607025 369956026 /nfs/dbraw/zinc/95/60/26/369956026.db2.gz DKOQLXLRKOYGNC-UTUOFQBUSA-N 1 2 249.358 2.424 20 0 BEADLO Cc1cc(C(=O)N[C@@H](C)c2[nH+]ccn2C)cs1 ZINC000620608266 369957328 /nfs/dbraw/zinc/95/73/28/369957328.db2.gz NGFSEKYQWMMURB-VIFPVBQESA-N 1 2 249.339 2.281 20 0 BEADLO C[C@H](NC(=O)[C@@H]1CCCC[C@@H]1C)c1[nH+]ccn1C ZINC000620612562 369958047 /nfs/dbraw/zinc/95/80/47/369958047.db2.gz YKWMDGDOUJTVCW-SDDRHHMPSA-N 1 2 249.358 2.424 20 0 BEADLO C[C@H](NC(=O)[C@H]1CCCC[C@H]1C)c1[nH+]ccn1C ZINC000620612564 369958063 /nfs/dbraw/zinc/95/80/63/369958063.db2.gz YKWMDGDOUJTVCW-WOPDTQHZSA-N 1 2 249.358 2.424 20 0 BEADLO C[C@@H](NC(=O)CC1CCCC1)c1[nH+]ccn1C ZINC000620592769 369945603 /nfs/dbraw/zinc/94/56/03/369945603.db2.gz XKUSXOVZQVPFPK-SNVBAGLBSA-N 1 2 235.331 2.178 20 0 BEADLO CN(C[C@H]1CC1(C)C)C(=O)C(C)(C)c1c[nH+]c[nH]1 ZINC000621045182 370080085 /nfs/dbraw/zinc/08/00/85/370080085.db2.gz VVMBFGHKNHWOLO-SNVBAGLBSA-N 1 2 249.358 2.192 20 0 BEADLO C[C@@H]1C[NH+](Cc2ccncc2Cl)C[C@@H](C)O1 ZINC000075589658 370146899 /nfs/dbraw/zinc/14/68/99/370146899.db2.gz LLKPVPQTCNVNCD-NXEZZACHSA-N 1 2 240.734 2.344 20 0 BEADLO CC[C@H]1C[N@@H+]([C@@H](C)c2nnc(C)o2)CCS1 ZINC000076072686 370210433 /nfs/dbraw/zinc/21/04/33/370210433.db2.gz DIKCICNFKQMFDC-WPRPVWTQSA-N 1 2 241.360 2.266 20 0 BEADLO CC[C@H]1C[N@H+]([C@@H](C)c2nnc(C)o2)CCS1 ZINC000076072686 370210436 /nfs/dbraw/zinc/21/04/36/370210436.db2.gz DIKCICNFKQMFDC-WPRPVWTQSA-N 1 2 241.360 2.266 20 0 BEADLO Clc1cncc(C[N@@H+]2C[C@@H]3C[C@H]2CS3)c1 ZINC000621301031 370230575 /nfs/dbraw/zinc/23/05/75/370230575.db2.gz GWEJHGVXSDCSGL-QWRGUYRKSA-N 1 2 240.759 2.425 20 0 BEADLO Clc1cncc(C[N@H+]2C[C@@H]3C[C@H]2CS3)c1 ZINC000621301031 370230578 /nfs/dbraw/zinc/23/05/78/370230578.db2.gz GWEJHGVXSDCSGL-QWRGUYRKSA-N 1 2 240.759 2.425 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(=O)CC23CCC3)ccn1 ZINC000621302472 370233167 /nfs/dbraw/zinc/23/31/67/370233167.db2.gz DVENKRNMJHPQKM-UHFFFAOYSA-N 1 2 244.338 2.478 20 0 BEADLO Cc1cc(C[N@H+]2CCC(=O)CC23CCC3)ccn1 ZINC000621302472 370233171 /nfs/dbraw/zinc/23/31/71/370233171.db2.gz DVENKRNMJHPQKM-UHFFFAOYSA-N 1 2 244.338 2.478 20 0 BEADLO Cc1csc([C@@H](C)[NH2+]Cc2cc(C)n[nH]2)n1 ZINC000309798216 370261792 /nfs/dbraw/zinc/26/17/92/370261792.db2.gz QQTLMCLVCNIBKL-SECBINFHSA-N 1 2 236.344 2.334 20 0 BEADLO CCc1cc(NC[C@@H]2CC2(C)C)nc[nH+]1 ZINC000226531265 370368007 /nfs/dbraw/zinc/36/80/07/370368007.db2.gz GSBFVKHVHSNNGC-VIFPVBQESA-N 1 2 205.305 2.497 20 0 BEADLO CCC1CCN(C(=O)C(C)(C)c2c[nH+]c[nH]2)CC1 ZINC000621696834 370442969 /nfs/dbraw/zinc/44/29/69/370442969.db2.gz UWAFZGWKUPLILA-UHFFFAOYSA-N 1 2 249.358 2.336 20 0 BEADLO Cc1nccnc1C[N@H+](C)Cc1cccc(O)c1 ZINC000621709201 370454116 /nfs/dbraw/zinc/45/41/16/370454116.db2.gz OCRYQDFFRHWGQM-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO Cc1nccnc1C[N@@H+](C)Cc1cccc(O)c1 ZINC000621709201 370454122 /nfs/dbraw/zinc/45/41/22/370454122.db2.gz OCRYQDFFRHWGQM-UHFFFAOYSA-N 1 2 243.310 2.123 20 0 BEADLO Cc1ncsc1C[N@@H+](C)Cc1nccnc1C ZINC000621715206 370463511 /nfs/dbraw/zinc/46/35/11/370463511.db2.gz NWMUMJQDXPQKPU-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO Cc1ncsc1C[N@H+](C)Cc1nccnc1C ZINC000621715206 370463514 /nfs/dbraw/zinc/46/35/14/370463514.db2.gz NWMUMJQDXPQKPU-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO CCCC[C@H](C(=O)NCc1[nH]cc[nH+]1)C(C)C ZINC000621865852 370572105 /nfs/dbraw/zinc/57/21/05/370572105.db2.gz ZJEDLBBBHMLELG-NSHDSACASA-N 1 2 237.347 2.488 20 0 BEADLO Cc1noc(C)c1CNc1cc(C)[nH+]cn1 ZINC000082686893 371024071 /nfs/dbraw/zinc/02/40/71/371024071.db2.gz OCRFBFAWPZYGOY-UHFFFAOYSA-N 1 2 218.260 2.002 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H](C)Cn1cccn1 ZINC000623865668 371133006 /nfs/dbraw/zinc/13/30/06/371133006.db2.gz ZARVLICRAKZSKS-LLVKDONJSA-N 1 2 246.314 2.035 20 0 BEADLO Cc1nc(NCC(F)(F)F)c2c([nH+]1)CCCC2 ZINC000623892792 371142749 /nfs/dbraw/zinc/14/27/49/371142749.db2.gz ZAHBASIFJBSKJR-UHFFFAOYSA-N 1 2 245.248 2.060 20 0 BEADLO COc1ccc[nH+]c1N1CCCOC(C)(C)C1 ZINC000623980066 371213067 /nfs/dbraw/zinc/21/30/67/371213067.db2.gz URZQASPLHOOLOU-UHFFFAOYSA-N 1 2 236.315 2.096 20 0 BEADLO CC[C@@H]1CCCN(C(=O)CCCn2cc[nH+]c2)C1 ZINC000125315024 371318310 /nfs/dbraw/zinc/31/83/10/371318310.db2.gz BAIWELUMKHNKHF-CYBMUJFWSA-N 1 2 249.358 2.312 20 0 BEADLO CCC(F)(F)C[NH2+][C@H](C)c1c[nH]nc1C ZINC000624147697 371343212 /nfs/dbraw/zinc/34/32/12/371343212.db2.gz IOGDWNNTOUYTPC-SSDOTTSWSA-N 1 2 217.263 2.414 20 0 BEADLO Cc1nc([C@@H](C)[NH2+]Cc2ccc[nH]c2=O)cs1 ZINC000624258718 371444774 /nfs/dbraw/zinc/44/47/74/371444774.db2.gz RHUBPQUXKPAQRZ-MRVPVSSYSA-N 1 2 249.339 2.403 20 0 BEADLO CC[C@@H](CCO)Nc1cc[nH+]c(C(C)C)n1 ZINC000156809074 371502745 /nfs/dbraw/zinc/50/27/45/371502745.db2.gz SDHSKTIWZBZDHQ-JTQLQIEISA-N 1 2 223.320 2.173 20 0 BEADLO COc1ccc[nH+]c1NCCCC(C)(C)CO ZINC000393367612 371508667 /nfs/dbraw/zinc/50/86/67/371508667.db2.gz AGJQOZMOFGOLDL-UHFFFAOYSA-N 1 2 238.331 2.301 20 0 BEADLO COc1ccc[nH+]c1NCC1CC=CC1 ZINC000624491094 371520775 /nfs/dbraw/zinc/52/07/75/371520775.db2.gz NVMZLOYRTVYZDW-UHFFFAOYSA-N 1 2 204.273 2.468 20 0 BEADLO COc1ccc[nH+]c1N1CCO[C@](C)(C2CC2)C1 ZINC000624385384 371496584 /nfs/dbraw/zinc/49/65/84/371496584.db2.gz BCEFTROWCAWLBF-AWEZNQCLSA-N 1 2 248.326 2.096 20 0 BEADLO O=C(C1=CCCCCC1)N1CCc2[nH]c[nH+]c2C1 ZINC000627370355 371587953 /nfs/dbraw/zinc/58/79/53/371587953.db2.gz WNCBTZGIBSZCJW-UHFFFAOYSA-N 1 2 245.326 2.185 20 0 BEADLO O=C(C1=CCCCCC1)N1CCc2[nH+]c[nH]c2C1 ZINC000627370355 371587954 /nfs/dbraw/zinc/58/79/54/371587954.db2.gz WNCBTZGIBSZCJW-UHFFFAOYSA-N 1 2 245.326 2.185 20 0 BEADLO Cc1cc(CNC(=O)C23CC(C2)C3)cc(C)[nH+]1 ZINC000627787192 371977528 /nfs/dbraw/zinc/97/75/28/371977528.db2.gz JVJLBKPYGWBLEX-UHFFFAOYSA-N 1 2 230.311 2.115 20 0 BEADLO Brc1ccn(C[NH+]2CCCCC2)n1 ZINC000307324618 372111566 /nfs/dbraw/zinc/11/15/66/372111566.db2.gz DYLLKXPVYXXMBO-UHFFFAOYSA-N 1 2 244.136 2.089 20 0 BEADLO CC(=O)Nc1cccc(C[NH2+]CC(C)(F)F)c1 ZINC000631143245 372208093 /nfs/dbraw/zinc/20/80/93/372208093.db2.gz PNEGZTNNMTVUQI-UHFFFAOYSA-N 1 2 242.269 2.390 20 0 BEADLO CCCCC[C@@H]1CCCN1c1nc(C)[nH+]c(N)n1 ZINC000631170110 372216154 /nfs/dbraw/zinc/21/61/54/372216154.db2.gz LUIQZUPQUZDAKE-LLVKDONJSA-N 1 2 249.362 2.142 20 0 BEADLO CCCCC[C@@H]1CCCN1c1nc(N)nc(C)[nH+]1 ZINC000631170110 372216158 /nfs/dbraw/zinc/21/61/58/372216158.db2.gz LUIQZUPQUZDAKE-LLVKDONJSA-N 1 2 249.362 2.142 20 0 BEADLO CCCCc1cc(NCC[C@@H]2CCOC2)nc[nH+]1 ZINC000631203773 372233168 /nfs/dbraw/zinc/23/31/68/372233168.db2.gz FBAOOTSHUPWFQG-GFCCVEGCSA-N 1 2 249.358 2.080 20 0 BEADLO CCCCc1cc(NCC[C@H]2CCOC2)nc[nH+]1 ZINC000631203774 372234046 /nfs/dbraw/zinc/23/40/46/372234046.db2.gz FBAOOTSHUPWFQG-LBPRGKRZSA-N 1 2 249.358 2.080 20 0 BEADLO OCCN(CC1CC1)c1cc2ccccc2c[nH+]1 ZINC000631132687 372204563 /nfs/dbraw/zinc/20/45/63/372204563.db2.gz MZRVPCPNCPGGKY-UHFFFAOYSA-N 1 2 242.322 2.444 20 0 BEADLO Cc1n[nH]cc1CN(C)c1cc[nH+]c(C2CC2)n1 ZINC000631322743 372294285 /nfs/dbraw/zinc/29/42/85/372294285.db2.gz KRSHHMQOMMWDAV-UHFFFAOYSA-N 1 2 243.314 2.022 20 0 BEADLO CCCc1ccc(C(=O)NCc2[nH]cc[nH+]2)s1 ZINC000631239224 372254742 /nfs/dbraw/zinc/25/47/42/372254742.db2.gz QSUUYGBHZUZLLD-UHFFFAOYSA-N 1 2 249.339 2.354 20 0 BEADLO CCOC(C)(C)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000631254273 372262795 /nfs/dbraw/zinc/26/27/95/372262795.db2.gz DSWGSWXWKKAVBO-UHFFFAOYSA-N 1 2 247.298 2.088 20 0 BEADLO CCCCc1cc(NC[C@@H](OC)C2CC2)nc[nH+]1 ZINC000631283246 372276814 /nfs/dbraw/zinc/27/68/14/372276814.db2.gz ANISNSDMKIBKEE-CYBMUJFWSA-N 1 2 249.358 2.078 20 0 BEADLO CC1(CO)CN(c2cc3ccccc3c[nH+]2)C1 ZINC000631300113 372283257 /nfs/dbraw/zinc/28/32/57/372283257.db2.gz FRHRVFXQBLGUDO-UHFFFAOYSA-N 1 2 228.295 2.053 20 0 BEADLO Cc1cc(C)c(C(=O)NCc2c[nH+]c[nH]2)s1 ZINC000631414167 372347028 /nfs/dbraw/zinc/34/70/28/372347028.db2.gz PNNWSSAFKVLBMG-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO Cc1cc(C)c(C(=O)NCc2c[nH]c[nH+]2)s1 ZINC000631414167 372347032 /nfs/dbraw/zinc/34/70/32/372347032.db2.gz PNNWSSAFKVLBMG-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO CCC[C@@H](CCO)Nc1cc[nH+]c2ccncc12 ZINC000631428261 372358760 /nfs/dbraw/zinc/35/87/60/372358760.db2.gz VACFCKRJJZRBDR-NSHDSACASA-N 1 2 245.326 2.015 20 0 BEADLO Cc1cc(N2CCC(CCF)CC2)nc[nH+]1 ZINC000631448255 372368865 /nfs/dbraw/zinc/36/88/65/372368865.db2.gz IEMBFRMVBTWLKJ-UHFFFAOYSA-N 1 2 223.295 2.361 20 0 BEADLO CC[C@]1(O)CCCN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000631486791 372390178 /nfs/dbraw/zinc/39/01/78/372390178.db2.gz XMJLAEQFCCZGPT-AWEZNQCLSA-N 1 2 247.342 2.095 20 0 BEADLO c1nc(C[NH2+][C@H]2CCCc3ncccc32)co1 ZINC000631605986 372456490 /nfs/dbraw/zinc/45/64/90/372456490.db2.gz CRPFGBVKYPLZJM-ZDUSSCGKSA-N 1 2 229.283 2.237 20 0 BEADLO Cc1ccc(C[NH2+][C@H]2CCCn3ccnc32)o1 ZINC000631729369 372533951 /nfs/dbraw/zinc/53/39/51/372533951.db2.gz DEBHCMIBWZYQNW-LBPRGKRZSA-N 1 2 231.299 2.409 20 0 BEADLO COCCC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000171405446 372570980 /nfs/dbraw/zinc/57/09/80/372570980.db2.gz QMQMRNXHUROJAQ-UHFFFAOYSA-N 1 2 245.282 2.052 20 0 BEADLO CC(C)c1nc(NC[C@](C)(O)C(C)C)cc[nH+]1 ZINC000171945537 372838031 /nfs/dbraw/zinc/83/80/31/372838031.db2.gz PSSZZKRLKINIMN-ZDUSSCGKSA-N 1 2 237.347 2.419 20 0 BEADLO O=C(COc1cc[nH+]cc1)NC1CCCCCC1 ZINC000292579601 182004449 /nfs/dbraw/zinc/00/44/49/182004449.db2.gz ZTZLUBSYDATEKE-UHFFFAOYSA-N 1 2 248.326 2.299 20 0 BEADLO O=C(C[C@@H]1C=CCCC1)NCCCn1cc[nH+]c1 ZINC000187293287 182015209 /nfs/dbraw/zinc/01/52/09/182015209.db2.gz LKQNBRQBJKAFOZ-CYBMUJFWSA-N 1 2 247.342 2.136 20 0 BEADLO CCO[C@H]1C[C@H]([N@H+](C)CC(F)F)C1(C)C ZINC000172665898 373037569 /nfs/dbraw/zinc/03/75/69/373037569.db2.gz RBFHVDOWPQPAAK-IUCAKERBSA-N 1 2 221.291 2.387 20 0 BEADLO CCO[C@H]1C[C@H]([N@@H+](C)CC(F)F)C1(C)C ZINC000172665898 373037577 /nfs/dbraw/zinc/03/75/77/373037577.db2.gz RBFHVDOWPQPAAK-IUCAKERBSA-N 1 2 221.291 2.387 20 0 BEADLO Cc1ccc(C[NH2+]Cc2nccs2)o1 ZINC000040444007 373267426 /nfs/dbraw/zinc/26/74/26/373267426.db2.gz NARPBYSBZJPMJL-UHFFFAOYSA-N 1 2 208.286 2.334 20 0 BEADLO O=C(NCCCNc1cccc[nH+]1)C1CCCC1 ZINC000115161148 182169687 /nfs/dbraw/zinc/16/96/87/182169687.db2.gz ZBSQZYJQVSZWQT-UHFFFAOYSA-N 1 2 247.342 2.190 20 0 BEADLO CCOC(=O)C[NH2+][C@@H]1CCCC[C@@H]1SCC ZINC000189494811 205867570 /nfs/dbraw/zinc/86/75/70/205867570.db2.gz PCPCTRVVVGDUME-MNOVXSKESA-N 1 2 245.388 2.203 20 0 BEADLO Cc1ccc(CNC(=O)C[C@@H](C)n2cc[nH+]c2)o1 ZINC000634313152 374163992 /nfs/dbraw/zinc/16/39/92/374163992.db2.gz QMHZPZBTGJXWJD-SNVBAGLBSA-N 1 2 247.298 2.052 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H](C)CC2CCC2)c[nH+]1 ZINC000634367749 374211956 /nfs/dbraw/zinc/21/19/56/374211956.db2.gz PPEMBDCNKHDMNL-MRVPVSSYSA-N 1 2 221.304 2.027 20 0 BEADLO C[C@H](CC1CCC1)NC(=O)CCCn1cc[nH+]c1 ZINC000634367803 374214018 /nfs/dbraw/zinc/21/40/18/374214018.db2.gz RCIDVARTLIORRH-GFCCVEGCSA-N 1 2 249.358 2.358 20 0 BEADLO O=C(N[C@@H]1CC=CCC1)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000370491140 182291674 /nfs/dbraw/zinc/29/16/74/182291674.db2.gz KNIZKYXNVQJEGU-MNOVXSKESA-N 1 2 245.326 2.055 20 0 BEADLO O=C(N[C@@H]1CC=CCC1)[C@H]1CCCc2[nH]c[nH+]c21 ZINC000370491140 182291675 /nfs/dbraw/zinc/29/16/75/182291675.db2.gz KNIZKYXNVQJEGU-MNOVXSKESA-N 1 2 245.326 2.055 20 0 BEADLO C=Cn1cc(CNc2ccc(N(C)C)c[nH+]2)cn1 ZINC000194375711 206087311 /nfs/dbraw/zinc/08/73/11/206087311.db2.gz ZXSPYAHUIAXNFX-UHFFFAOYSA-N 1 2 243.314 2.057 20 0 BEADLO COc1ccc(OC)c(C[N@@H+]2CC[C@@H](F)C2)c1 ZINC000449392047 206096353 /nfs/dbraw/zinc/09/63/53/206096353.db2.gz ZZZZFDOOLCTVKL-LLVKDONJSA-N 1 2 239.290 2.248 20 0 BEADLO COc1ccc(OC)c(C[N@H+]2CC[C@@H](F)C2)c1 ZINC000449392047 206096355 /nfs/dbraw/zinc/09/63/55/206096355.db2.gz ZZZZFDOOLCTVKL-LLVKDONJSA-N 1 2 239.290 2.248 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+](C)Cc1csc(C)c1 ZINC000449025807 206095282 /nfs/dbraw/zinc/09/52/82/206095282.db2.gz HWALXHVEJPVFFK-JTQLQIEISA-N 1 2 241.356 2.440 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+](C)Cc1csc(C)c1 ZINC000449025807 206095289 /nfs/dbraw/zinc/09/52/89/206095289.db2.gz HWALXHVEJPVFFK-JTQLQIEISA-N 1 2 241.356 2.440 20 0 BEADLO COC1C[NH+](C[C@H](C)c2cc(F)cc(F)c2)C1 ZINC000459580184 206136245 /nfs/dbraw/zinc/13/62/45/206136245.db2.gz KUYOGCYCQRNDPZ-VIFPVBQESA-N 1 2 241.281 2.399 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)c1ccco1 ZINC000357456530 182374597 /nfs/dbraw/zinc/37/45/97/182374597.db2.gz SASHZQYHAWDACA-UHFFFAOYSA-N 1 2 227.223 2.180 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+]1Cc2ccc(C)cc2C1 ZINC000361599911 170267618 /nfs/dbraw/zinc/26/76/18/170267618.db2.gz FGWWKHOWIYNKHJ-NSHDSACASA-N 1 2 233.311 2.262 20 0 BEADLO OC1CC[NH+](Cc2cc(F)c(F)c(F)c2)CC1 ZINC000305728433 183028197 /nfs/dbraw/zinc/02/81/97/183028197.db2.gz JKLLYLODONPLDK-UHFFFAOYSA-N 1 2 245.244 2.061 20 0 BEADLO OCCC1(Nc2cc[nH+]c(C3CC3)n2)CCCC1 ZINC000288878686 183044331 /nfs/dbraw/zinc/04/43/31/183044331.db2.gz GMCGPGZAZNIDDO-UHFFFAOYSA-N 1 2 247.342 2.461 20 0 BEADLO OCCCCC[N@@H+]1CCCC[C@H]1C(F)F ZINC000337430207 183045567 /nfs/dbraw/zinc/04/55/67/183045567.db2.gz YPYKNIBURKJNLN-JTQLQIEISA-N 1 2 221.291 2.269 20 0 BEADLO OCCCCC[N@H+]1CCCC[C@H]1C(F)F ZINC000337430207 183045570 /nfs/dbraw/zinc/04/55/70/183045570.db2.gz YPYKNIBURKJNLN-JTQLQIEISA-N 1 2 221.291 2.269 20 0 BEADLO OCC(F)(F)C[NH2+]C/C=C/c1ccc(F)cc1 ZINC000183867936 183033360 /nfs/dbraw/zinc/03/33/60/183033360.db2.gz BWPDXELSAUDJAN-OWOJBTEDSA-N 1 2 245.244 2.056 20 0 BEADLO OCC[N@H+](Cc1ccsc1Cl)C1CC1 ZINC000361508989 183071000 /nfs/dbraw/zinc/07/10/00/183071000.db2.gz RYCALZASMVDIHN-UHFFFAOYSA-N 1 2 231.748 2.358 20 0 BEADLO OCC[N@@H+](Cc1ccsc1Cl)C1CC1 ZINC000361508989 183071002 /nfs/dbraw/zinc/07/10/02/183071002.db2.gz RYCALZASMVDIHN-UHFFFAOYSA-N 1 2 231.748 2.358 20 0 BEADLO OCC[C@H]1CCC[C@H]1Nc1cccc[nH+]1 ZINC000275024814 183098313 /nfs/dbraw/zinc/09/83/13/183098313.db2.gz MZKBWYOIKVJQDR-GHMZBOCLSA-N 1 2 206.289 2.045 20 0 BEADLO CCCC[C@H]([NH2+][C@H]1CC[C@H](F)C1)C(=O)OC ZINC000336747537 169012518 /nfs/dbraw/zinc/01/25/18/169012518.db2.gz XGSVOLIKOSHDHH-DCAQKATOSA-N 1 2 231.311 2.198 20 0 BEADLO CCCC[C@H]([NH2+][C@@H]1CSC1(C)C)C(=O)OC ZINC000310038178 169012947 /nfs/dbraw/zinc/01/29/47/169012947.db2.gz VVSGGUDIACYOGI-VHSXEESVSA-N 1 2 245.388 2.202 20 0 BEADLO OC[C@@H](CC1CCC1)Nc1cc[nH+]c(C2CC2)n1 ZINC000280281956 183104944 /nfs/dbraw/zinc/10/49/44/183104944.db2.gz PVGVRFVOVQQJHQ-GFCCVEGCSA-N 1 2 247.342 2.317 20 0 BEADLO OC[C@H]([NH2+]C/C=C/Cl)c1c(F)cccc1F ZINC000273130547 183138826 /nfs/dbraw/zinc/13/88/26/183138826.db2.gz RMPXECVIAPZQDX-FWYAXHSGSA-N 1 2 247.672 2.340 20 0 BEADLO OC[C@H](Nc1cc[nH+]c(C2CC2)n1)C1CCCC1 ZINC000290896650 183142739 /nfs/dbraw/zinc/14/27/39/183142739.db2.gz URBOLOZLLDXPQV-LBPRGKRZSA-N 1 2 247.342 2.317 20 0 BEADLO OC[C@@H]1CC[C@H](Nc2cc[nH+]c3ccncc23)C1 ZINC000296341411 183125999 /nfs/dbraw/zinc/12/59/99/183125999.db2.gz QHUBEILIZUHDIH-MNOVXSKESA-N 1 2 243.310 2.203 20 0 BEADLO CCCCc1noc(C[N@@H+]2C[C@H](C)[C@@H]2C)n1 ZINC000339575909 169031368 /nfs/dbraw/zinc/03/13/68/169031368.db2.gz UPQFBEKAWQFDSU-UWVGGRQHSA-N 1 2 223.320 2.252 20 0 BEADLO CCCCc1noc(C[N@H+]2C[C@H](C)[C@@H]2C)n1 ZINC000339575909 169031370 /nfs/dbraw/zinc/03/13/70/169031370.db2.gz UPQFBEKAWQFDSU-UWVGGRQHSA-N 1 2 223.320 2.252 20 0 BEADLO OC[C@H]1CCC[N@H+](Cc2csc(Cl)n2)C1 ZINC000290165399 183151090 /nfs/dbraw/zinc/15/10/90/183151090.db2.gz XWXRTLFYYKNHNO-QMMMGPOBSA-N 1 2 246.763 2.001 20 0 BEADLO OC[C@H]1CCC[N@@H+](Cc2csc(Cl)n2)C1 ZINC000290165399 183151092 /nfs/dbraw/zinc/15/10/92/183151092.db2.gz XWXRTLFYYKNHNO-QMMMGPOBSA-N 1 2 246.763 2.001 20 0 BEADLO OCc1ccc(NC/C=C/c2ccccc2)[nH+]c1 ZINC000356289310 183162871 /nfs/dbraw/zinc/16/28/71/183162871.db2.gz ALWRWOFDXAEWPU-QPJJXVBHSA-N 1 2 240.306 2.121 20 0 BEADLO OCc1cccc(NCc2cccs2)[nH+]1 ZINC000336728051 183168145 /nfs/dbraw/zinc/16/81/45/183168145.db2.gz HXPVNMSEIQBAJR-UHFFFAOYSA-N 1 2 220.297 2.248 20 0 BEADLO O[C@@H](CCc1ccccc1)CNc1cccc[nH+]1 ZINC000273208005 183174766 /nfs/dbraw/zinc/17/47/66/183174766.db2.gz TXANYQVAPGDLJR-AWEZNQCLSA-N 1 2 242.322 2.487 20 0 BEADLO O[C@@H]1CCC[C@H](CNc2cc[nH+]c(C3CC3)n2)C1 ZINC000301394143 183196540 /nfs/dbraw/zinc/19/65/40/183196540.db2.gz KEOZVBRYQXRQAR-CMPLNLGQSA-N 1 2 247.342 2.317 20 0 BEADLO CCC[N@H+](CC(=O)OC)Cc1cccc(F)c1 ZINC000048667943 169100802 /nfs/dbraw/zinc/10/08/02/169100802.db2.gz PKIGTJAALSTKBC-UHFFFAOYSA-N 1 2 239.290 2.211 20 0 BEADLO CCC[N@@H+](CC(=O)OC)Cc1cccc(F)c1 ZINC000048667943 169100805 /nfs/dbraw/zinc/10/08/05/169100805.db2.gz PKIGTJAALSTKBC-UHFFFAOYSA-N 1 2 239.290 2.211 20 0 BEADLO O[C@H](CNc1cc[nH+]c(C2CC2)n1)c1ccco1 ZINC000110199360 183226614 /nfs/dbraw/zinc/22/66/14/183226614.db2.gz JGMCLCSGVICKRU-SNVBAGLBSA-N 1 2 245.282 2.093 20 0 BEADLO CCC[N@H+](C/C=C\Cl)CC(=O)OCC ZINC000219074413 169090704 /nfs/dbraw/zinc/09/07/04/169090704.db2.gz WWHDSIKAMMTDCS-WAYWQWQTSA-N 1 2 219.712 2.014 20 0 BEADLO CCC[N@@H+](C/C=C\Cl)CC(=O)OCC ZINC000219074413 169090706 /nfs/dbraw/zinc/09/07/06/169090706.db2.gz WWHDSIKAMMTDCS-WAYWQWQTSA-N 1 2 219.712 2.014 20 0 BEADLO O[C@H](CC1CCCC1)C[N@@H+]1CCC(F)(F)C1 ZINC000313268369 183217439 /nfs/dbraw/zinc/21/74/39/183217439.db2.gz IPWUSCZWECHEPD-LLVKDONJSA-N 1 2 233.302 2.269 20 0 BEADLO O[C@H](CC1CCCC1)C[N@H+]1CCC(F)(F)C1 ZINC000313268369 183217441 /nfs/dbraw/zinc/21/74/41/183217441.db2.gz IPWUSCZWECHEPD-LLVKDONJSA-N 1 2 233.302 2.269 20 0 BEADLO O[C@H]1C[C@@H](CSc2[nH+]cc3ccccn32)C1 ZINC000335005781 183246791 /nfs/dbraw/zinc/24/67/91/183246791.db2.gz INUXUVVUXKOOKN-JGZJWPJOSA-N 1 2 234.324 2.197 20 0 BEADLO CCCN(CC(C)(C)O)c1cc[nH+]c(C2CC2)n1 ZINC000269616460 169103557 /nfs/dbraw/zinc/10/35/57/169103557.db2.gz LQGSXLKWBFZJNA-UHFFFAOYSA-N 1 2 249.358 2.341 20 0 BEADLO CCC[N@H+](CC)Cc1noc(C2CC2)n1 ZINC000336648202 169131989 /nfs/dbraw/zinc/13/19/89/169131989.db2.gz NYMSRFRWIULPRA-UHFFFAOYSA-N 1 2 209.293 2.179 20 0 BEADLO CCC[N@@H+](CC)Cc1noc(C2CC2)n1 ZINC000336648202 169131990 /nfs/dbraw/zinc/13/19/90/169131990.db2.gz NYMSRFRWIULPRA-UHFFFAOYSA-N 1 2 209.293 2.179 20 0 BEADLO CCC[N@H+](CC)Cc1nnc(OCC)s1 ZINC000336650882 169132451 /nfs/dbraw/zinc/13/24/51/169132451.db2.gz UCMIXUBZMTWIIC-UHFFFAOYSA-N 1 2 229.349 2.169 20 0 BEADLO CCC[N@@H+](CC)Cc1nnc(OCC)s1 ZINC000336650882 169132452 /nfs/dbraw/zinc/13/24/52/169132452.db2.gz UCMIXUBZMTWIIC-UHFFFAOYSA-N 1 2 229.349 2.169 20 0 BEADLO CCCN(CCC)C(=O)COc1cc[nH+]cc1 ZINC000292417752 169140763 /nfs/dbraw/zinc/14/07/63/169140763.db2.gz KFKDIQSWJCQHDE-UHFFFAOYSA-N 1 2 236.315 2.109 20 0 BEADLO Oc1ccc2c(c1)C[N@@H+](Cc1cncs1)CC2 ZINC000336604382 183280754 /nfs/dbraw/zinc/28/07/54/183280754.db2.gz QHPYRGDPMSNGSX-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO Oc1ccc2c(c1)C[N@H+](Cc1cncs1)CC2 ZINC000336604382 183280756 /nfs/dbraw/zinc/28/07/56/183280756.db2.gz QHPYRGDPMSNGSX-UHFFFAOYSA-N 1 2 246.335 2.407 20 0 BEADLO Oc1ccc2c(c1)OCCN(c1cccc[nH+]1)C2 ZINC000376189004 183281952 /nfs/dbraw/zinc/28/19/52/183281952.db2.gz TZEZKEFKPVBMPE-UHFFFAOYSA-N 1 2 242.278 2.186 20 0 BEADLO CCC[N@H+](Cc1nnc(C)s1)C1CC1 ZINC000358500844 169180458 /nfs/dbraw/zinc/18/04/58/169180458.db2.gz QOVDYYAPKJCPML-UHFFFAOYSA-N 1 2 211.334 2.221 20 0 BEADLO CCC[N@@H+](Cc1nnc(C)s1)C1CC1 ZINC000358500844 169180460 /nfs/dbraw/zinc/18/04/60/169180460.db2.gz QOVDYYAPKJCPML-UHFFFAOYSA-N 1 2 211.334 2.221 20 0 BEADLO CCC[N@H+](Cc1ncnn1C(C)(C)C)C1CC1 ZINC000338307084 169181663 /nfs/dbraw/zinc/18/16/63/169181663.db2.gz XBSABYBNIGZQGB-UHFFFAOYSA-N 1 2 236.363 2.408 20 0 BEADLO CCC[N@@H+](Cc1ncnn1C(C)(C)C)C1CC1 ZINC000338307084 169181665 /nfs/dbraw/zinc/18/16/65/169181665.db2.gz XBSABYBNIGZQGB-UHFFFAOYSA-N 1 2 236.363 2.408 20 0 BEADLO c1c[nH+]c(CNc2ccc3c(c2)OCCCO3)[nH]1 ZINC000049714499 183325917 /nfs/dbraw/zinc/32/59/17/183325917.db2.gz PZUICSDGBAQTAJ-UHFFFAOYSA-N 1 2 245.282 2.183 20 0 BEADLO c1c[nH+]c(COCc2ccn(C3CCCC3)n2)[nH]1 ZINC000271995919 183327222 /nfs/dbraw/zinc/32/72/22/183327222.db2.gz CDJGJHVZJZCJOL-UHFFFAOYSA-N 1 2 246.314 2.438 20 0 BEADLO c1c[nH]c([C@H]2CCC[N@H+]2Cc2cnns2)c1 ZINC000295631269 183329326 /nfs/dbraw/zinc/32/93/26/183329326.db2.gz BZWCIMGYCCXECZ-LLVKDONJSA-N 1 2 234.328 2.203 20 0 BEADLO c1c[nH]c([C@H]2CCC[N@@H+]2Cc2cnns2)c1 ZINC000295631269 183329327 /nfs/dbraw/zinc/32/93/27/183329327.db2.gz BZWCIMGYCCXECZ-LLVKDONJSA-N 1 2 234.328 2.203 20 0 BEADLO CCCNC(=O)C[N@@H+]1Cc2ccccc2[C@H]1C ZINC000361053957 169223918 /nfs/dbraw/zinc/22/39/18/169223918.db2.gz ARLADXXFQKLVEL-LLVKDONJSA-N 1 2 232.327 2.089 20 0 BEADLO CCCNC(=O)C[N@H+]1Cc2ccccc2[C@H]1C ZINC000361053957 169223919 /nfs/dbraw/zinc/22/39/19/169223919.db2.gz ARLADXXFQKLVEL-LLVKDONJSA-N 1 2 232.327 2.089 20 0 BEADLO c1cc(OCC2CC2)ccc1C[NH+]1CCOCC1 ZINC000191146563 183359187 /nfs/dbraw/zinc/35/91/87/183359187.db2.gz CHRGXMXUGQNZIW-UHFFFAOYSA-N 1 2 247.338 2.308 20 0 BEADLO c1cc(N[C@H]2CCSC2)nc(C2CC2)[nH+]1 ZINC000266197820 183358884 /nfs/dbraw/zinc/35/88/84/183358884.db2.gz CXGKPEPHNFTQJF-VIFPVBQESA-N 1 2 221.329 2.271 20 0 BEADLO c1nnsc1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC000290159743 183364572 /nfs/dbraw/zinc/36/45/72/183364572.db2.gz XHZNFPQDYOEVOA-GFCCVEGCSA-N 1 2 246.339 2.270 20 0 BEADLO c1nnsc1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000290159743 183364575 /nfs/dbraw/zinc/36/45/75/183364575.db2.gz XHZNFPQDYOEVOA-GFCCVEGCSA-N 1 2 246.339 2.270 20 0 BEADLO CCC[C@@H](C(=O)NCc1c[nH+]c[nH]1)C(C)C ZINC000330519421 169344899 /nfs/dbraw/zinc/34/48/99/169344899.db2.gz GWKVWGGCSMTKOK-LLVKDONJSA-N 1 2 223.320 2.098 20 0 BEADLO CCC[C@@H](C(=O)NCc1c[nH]c[nH+]1)C(C)C ZINC000330519421 169344901 /nfs/dbraw/zinc/34/49/01/169344901.db2.gz GWKVWGGCSMTKOK-LLVKDONJSA-N 1 2 223.320 2.098 20 0 BEADLO CCC[C@@H](C)N(C)c1nc[nH+]c(N)c1Cl ZINC000233274919 169366265 /nfs/dbraw/zinc/36/62/65/169366265.db2.gz RDOPWFZLGKSZFY-SSDOTTSWSA-N 1 2 228.727 2.337 20 0 BEADLO CCC[C@@H](C)N(C)c1[nH+]cnc(N)c1Cl ZINC000233274919 169366267 /nfs/dbraw/zinc/36/62/67/169366267.db2.gz RDOPWFZLGKSZFY-SSDOTTSWSA-N 1 2 228.727 2.337 20 0 BEADLO CCC[C@@H](C)CC(=O)N(C)Cc1[nH+]ccn1C ZINC000299535227 169354150 /nfs/dbraw/zinc/35/41/50/169354150.db2.gz SKCGMROYIYAUOF-LLVKDONJSA-N 1 2 237.347 2.205 20 0 BEADLO CCC[C@@H](C)C[NH2+][C@@H](CC(F)F)C(=O)OC ZINC000336670201 169360303 /nfs/dbraw/zinc/36/03/03/169360303.db2.gz ABNUUWBJQXHXAU-BDAKNGLRSA-N 1 2 237.290 2.209 20 0 BEADLO CCC[C@@H](CC)NC(=O)c1c[nH+]c(C)[nH]1 ZINC000264852277 169378347 /nfs/dbraw/zinc/37/83/47/169378347.db2.gz NFVBPZLJPAWXBI-SECBINFHSA-N 1 2 209.293 2.027 20 0 BEADLO CCC[C@@H](CC)[S@](=O)Cc1[nH+]ccn1C ZINC000279913519 169381836 /nfs/dbraw/zinc/38/18/36/169381836.db2.gz DOHVPSGTBAXRNY-MEBBXXQBSA-N 1 2 228.361 2.248 20 0 BEADLO CCc1cn(Cc2cccc3nsnc32)c[nH+]1 ZINC001644227096 1172535643 /nfs/dbraw/zinc/53/56/43/1172535643.db2.gz DZBJCGZOKRJMLO-UHFFFAOYSA-N 1 2 244.323 2.499 20 0 BEADLO CCC[C@H](C)C(=O)NCc1ccn2cc[nH+]c2c1 ZINC000178379249 169472696 /nfs/dbraw/zinc/47/26/96/169472696.db2.gz QQDKHNPLMOMVME-NSHDSACASA-N 1 2 245.326 2.387 20 0 BEADLO C[C@@H]1CC(C(=O)NCCn2cc[nH+]c2)C[C@@H](C)C1 ZINC000182532698 134346113 /nfs/dbraw/zinc/34/61/13/134346113.db2.gz XDRARPFMHQIBQN-RYUDHWBXSA-N 1 2 249.358 2.072 20 0 BEADLO CCC[C@H]([NH2+][C@@H]1C[C@@H]1C1CC1)C(=O)OCC ZINC000310039315 169512229 /nfs/dbraw/zinc/51/22/29/169512229.db2.gz WXKAQBLLINZEQI-GRYCIOLGSA-N 1 2 225.332 2.106 20 0 BEADLO C[C@@H](c1ccccc1)[N@H+](CCO)Cc1ccon1 ZINC001644986820 1172624982 /nfs/dbraw/zinc/62/49/82/1172624982.db2.gz VMGQDQGAZDJPHM-LBPRGKRZSA-N 1 2 246.310 2.230 20 0 BEADLO C[C@@H](c1ccccc1)[N@@H+](CCO)Cc1ccon1 ZINC001644986820 1172624985 /nfs/dbraw/zinc/62/49/85/1172624985.db2.gz VMGQDQGAZDJPHM-LBPRGKRZSA-N 1 2 246.310 2.230 20 0 BEADLO Cc1nc(N2C[C@@H](C)CC[C@H]2C)cc[nH+]1 ZINC000247448135 383840863 /nfs/dbraw/zinc/84/08/63/383840863.db2.gz OOARHCISJMQYCZ-VHSXEESVSA-N 1 2 205.305 2.410 20 0 BEADLO Cc1csc(C[N@@H+]2CCOCC2(C)C)n1 ZINC000088579925 383910892 /nfs/dbraw/zinc/91/08/92/383910892.db2.gz GEZGCVPNCQJRAM-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1csc(C[N@H+]2CCOCC2(C)C)n1 ZINC000088579925 383910899 /nfs/dbraw/zinc/91/08/99/383910899.db2.gz GEZGCVPNCQJRAM-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO c1cc(C[NH2+][C@@H]2CCc3ccccc32)[nH]n1 ZINC000036900171 383916532 /nfs/dbraw/zinc/91/65/32/383916532.db2.gz FVQZAAVIXQDJNW-CYBMUJFWSA-N 1 2 213.284 2.187 20 0 BEADLO C[C@H]([NH2+]Cc1csnn1)c1ccccc1 ZINC000036901796 383921431 /nfs/dbraw/zinc/92/14/31/383921431.db2.gz VNVWRZDABGHSCA-VIFPVBQESA-N 1 2 219.313 2.389 20 0 BEADLO Cc1n[nH]c(C)c1CNc1ccc(N(C)C)[nH+]c1 ZINC000036989116 383923512 /nfs/dbraw/zinc/92/35/12/383923512.db2.gz FDZRLOJVFILFFA-UHFFFAOYSA-N 1 2 245.330 2.100 20 0 BEADLO CC[S@](=O)Cc1[nH+]ccn1Cc1ccccc1 ZINC000089104835 383932530 /nfs/dbraw/zinc/93/25/30/383932530.db2.gz DOFRAJOQNMJJCK-QGZVFWFLSA-N 1 2 248.351 2.200 20 0 BEADLO C[C@H](CO)CNc1ccc2ccccc2[nH+]1 ZINC000088389807 383899110 /nfs/dbraw/zinc/89/91/10/383899110.db2.gz BZEGEDBFVWNPMB-JTQLQIEISA-N 1 2 216.284 2.275 20 0 BEADLO C=Cn1cc(C[NH2+][C@H](CC)C(F)F)cn1 ZINC000449361952 383980065 /nfs/dbraw/zinc/98/00/65/383980065.db2.gz LVAGHKUHDYYBHU-SECBINFHSA-N 1 2 215.247 2.117 20 0 BEADLO CCCC(=O)NCc1cn2c(cccc2C)[nH+]1 ZINC000068570424 384000067 /nfs/dbraw/zinc/00/00/67/384000067.db2.gz PKZFSNJWWRNNSJ-UHFFFAOYSA-N 1 2 231.299 2.059 20 0 BEADLO Cc1c[nH+]c2c(Br)cccn12 ZINC000089202201 383943164 /nfs/dbraw/zinc/94/31/64/383943164.db2.gz NIXDDCLNGVQVBF-UHFFFAOYSA-N 1 2 211.062 2.405 20 0 BEADLO C[C@H]([NH2+]Cc1cccnc1)c1nccs1 ZINC000070621420 383944561 /nfs/dbraw/zinc/94/45/61/383944561.db2.gz YNYAWUULYVAZSY-VIFPVBQESA-N 1 2 219.313 2.389 20 0 BEADLO CC(C)C[C@H](C)CC(=O)NCCn1cc[nH+]c1 ZINC000067793271 383946178 /nfs/dbraw/zinc/94/61/78/383946178.db2.gz WFSYKWRBBDSQGR-LBPRGKRZSA-N 1 2 237.347 2.072 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000569412182 384000780 /nfs/dbraw/zinc/00/07/80/384000780.db2.gz OYRDPUPBZVFEMB-LPEHRKFASA-N 1 2 223.320 2.269 20 0 BEADLO OCC1(SCCn2cc[nH+]c2)CCCCC1 ZINC000313155518 383959775 /nfs/dbraw/zinc/95/97/75/383959775.db2.gz XFVUGWYXFPMQDL-UHFFFAOYSA-N 1 2 240.372 2.312 20 0 BEADLO Cc1nnc(C[N@@H+]2CCSC(C)(C)C2)s1 ZINC000336503095 384020274 /nfs/dbraw/zinc/02/02/74/384020274.db2.gz MSDHXGGWGDVIQL-UHFFFAOYSA-N 1 2 243.401 2.174 20 0 BEADLO Cc1nnc(C[N@H+]2CCSC(C)(C)C2)s1 ZINC000336503095 384020276 /nfs/dbraw/zinc/02/02/76/384020276.db2.gz MSDHXGGWGDVIQL-UHFFFAOYSA-N 1 2 243.401 2.174 20 0 BEADLO CN(C)c1ccc(NC[C@@H]2CCSC2)[nH+]c1 ZINC000278535918 384005934 /nfs/dbraw/zinc/00/59/34/384005934.db2.gz SKYZZXPVUYAIMS-JTQLQIEISA-N 1 2 237.372 2.313 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)c1cscn1 ZINC000309130027 384006202 /nfs/dbraw/zinc/00/62/02/384006202.db2.gz ORXKRSLZGJYBJW-UHFFFAOYSA-N 1 2 233.296 2.407 20 0 BEADLO CC(C)C[C@@H](C)CC(=O)NCc1[nH]cc[nH+]1 ZINC000114337335 384032501 /nfs/dbraw/zinc/03/25/01/384032501.db2.gz BJTGKOKABNYELM-SNVBAGLBSA-N 1 2 223.320 2.098 20 0 BEADLO c1csc(CSCCn2cc[nH+]c2)n1 ZINC000090202655 384034300 /nfs/dbraw/zinc/03/43/00/384034300.db2.gz ZLMJUWYACUPHRL-UHFFFAOYSA-N 1 2 225.342 2.273 20 0 BEADLO Cn1cnc(C[NH2+][C@@H]2CCCc3sccc32)n1 ZINC000090969347 384085928 /nfs/dbraw/zinc/08/59/28/384085928.db2.gz QJTNFXTWOMKRPG-SNVBAGLBSA-N 1 2 248.355 2.044 20 0 BEADLO c1cc(OCCC[C@@H]2CCOC2)cc[nH+]1 ZINC000647158655 384086195 /nfs/dbraw/zinc/08/61/95/384086195.db2.gz YPRMCFBTAMTAAE-LLVKDONJSA-N 1 2 207.273 2.277 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2ccccc2)o1 ZINC000306487265 384060854 /nfs/dbraw/zinc/06/08/54/384060854.db2.gz ITGGNOILRGMMAR-VIFPVBQESA-N 1 2 217.272 2.229 20 0 BEADLO Cc1nc(C[NH2+]Cc2c(C)noc2C)cs1 ZINC000069785084 384063525 /nfs/dbraw/zinc/06/35/25/384063525.db2.gz JFBYGECRWVRTOP-UHFFFAOYSA-N 1 2 237.328 2.346 20 0 BEADLO FCC(CF)[NH2+]Cc1ccnn1C1CCCC1 ZINC000449377487 384073565 /nfs/dbraw/zinc/07/35/65/384073565.db2.gz ALANBUILKFEUHB-UHFFFAOYSA-N 1 2 243.301 2.395 20 0 BEADLO C[C@H](Nc1[nH+]cnc2c1cnn2C)C1CCCC1 ZINC000070307341 384098696 /nfs/dbraw/zinc/09/86/96/384098696.db2.gz KGCPGBCLSRRWTK-VIFPVBQESA-N 1 2 245.330 2.354 20 0 BEADLO Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1Cc1ccon1 ZINC000091081168 384099318 /nfs/dbraw/zinc/09/93/18/384099318.db2.gz XNDUSSRXJQRVMW-LBPRGKRZSA-N 1 2 246.314 2.352 20 0 BEADLO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1Cc1ccon1 ZINC000091081168 384099319 /nfs/dbraw/zinc/09/93/19/384099319.db2.gz XNDUSSRXJQRVMW-LBPRGKRZSA-N 1 2 246.314 2.352 20 0 BEADLO c1csc(C2([NH2+]Cc3cc[nH]n3)CCCC2)n1 ZINC000116373997 384131232 /nfs/dbraw/zinc/13/12/32/384131232.db2.gz TTWSVARPFMSMMB-UHFFFAOYSA-N 1 2 248.355 2.425 20 0 BEADLO O=C(CCC1CCCCC1)NCc1[nH]cc[nH+]1 ZINC000070990172 384146103 /nfs/dbraw/zinc/14/61/03/384146103.db2.gz ZKILWRIEBZJIJW-UHFFFAOYSA-N 1 2 235.331 2.386 20 0 BEADLO CCc1ccc(C[N@@H+]2CCOC[C@H]2C)o1 ZINC000091810358 384147565 /nfs/dbraw/zinc/14/75/65/384147565.db2.gz JGDRIDWRANFWAT-SNVBAGLBSA-N 1 2 209.289 2.063 20 0 BEADLO CCc1ccc(C[N@H+]2CCOC[C@H]2C)o1 ZINC000091810358 384147567 /nfs/dbraw/zinc/14/75/67/384147567.db2.gz JGDRIDWRANFWAT-SNVBAGLBSA-N 1 2 209.289 2.063 20 0 BEADLO C[C@@H]1C[C@H]1CC(=O)N[C@@H](c1[nH+]ccn1C)C1CC1 ZINC000356498450 384157594 /nfs/dbraw/zinc/15/75/94/384157594.db2.gz RMDSGBPGWQSCHS-SUZMYJTESA-N 1 2 247.342 2.034 20 0 BEADLO Cc1cc[nH+]cc1NCc1cncs1 ZINC000070958556 384142727 /nfs/dbraw/zinc/14/27/27/384142727.db2.gz VWJKIFFKPJFKMK-UHFFFAOYSA-N 1 2 205.286 2.459 20 0 BEADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2n[nH]c(=O)[nH]2)cc1 ZINC000092617475 384185268 /nfs/dbraw/zinc/18/52/68/384185268.db2.gz XESWEHBGKXYUTH-SNVBAGLBSA-N 1 2 246.314 2.012 20 0 BEADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2n[nH]c(=O)[nH]2)cc1 ZINC000092617475 384185271 /nfs/dbraw/zinc/18/52/71/384185271.db2.gz XESWEHBGKXYUTH-SNVBAGLBSA-N 1 2 246.314 2.012 20 0 BEADLO c1ccc2[nH+]c(N3CCOCC4(CC4)C3)[nH]c2c1 ZINC000335982664 384183590 /nfs/dbraw/zinc/18/35/90/384183590.db2.gz QPMPLFFXOUDVJY-UHFFFAOYSA-N 1 2 243.310 2.180 20 0 BEADLO CC1(C)CC[N@@H+]1Cc1cc(C(F)(F)F)n[nH]1 ZINC000569541376 384193694 /nfs/dbraw/zinc/19/36/94/384193694.db2.gz MKTLIURRRRIXBU-UHFFFAOYSA-N 1 2 233.237 2.413 20 0 BEADLO CC1(C)CC[N@H+]1Cc1cc(C(F)(F)F)n[nH]1 ZINC000569541376 384193701 /nfs/dbraw/zinc/19/37/01/384193701.db2.gz MKTLIURRRRIXBU-UHFFFAOYSA-N 1 2 233.237 2.413 20 0 BEADLO Cc1csc(C[N@@H+](C)Cc2ccccn2)n1 ZINC000118402616 384199802 /nfs/dbraw/zinc/19/98/02/384199802.db2.gz USPMUJBMIFMHPD-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1csc(C[N@H+](C)Cc2ccccn2)n1 ZINC000118402616 384199808 /nfs/dbraw/zinc/19/98/08/384199808.db2.gz USPMUJBMIFMHPD-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CC(C)C[C@H]1COCC[N@@H+]1Cc1cncs1 ZINC000093340053 384229999 /nfs/dbraw/zinc/22/99/99/384229999.db2.gz NPQNGUPWRXVSNT-NSHDSACASA-N 1 2 240.372 2.390 20 0 BEADLO CC(C)C[C@H]1COCC[N@H+]1Cc1cncs1 ZINC000093340053 384230001 /nfs/dbraw/zinc/23/00/01/384230001.db2.gz NPQNGUPWRXVSNT-NSHDSACASA-N 1 2 240.372 2.390 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)COC(C)(C)C ZINC000158499766 384237465 /nfs/dbraw/zinc/23/74/65/384237465.db2.gz WHDSARUABUHMFH-UHFFFAOYSA-N 1 2 222.288 2.144 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+]1CCc2ccsc2C1 ZINC000132576453 384239627 /nfs/dbraw/zinc/23/96/27/384239627.db2.gz STRGXBOUFQPTSG-SECBINFHSA-N 1 2 239.340 2.058 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+]1CCc2ccsc2C1 ZINC000132576453 384239634 /nfs/dbraw/zinc/23/96/34/384239634.db2.gz STRGXBOUFQPTSG-SECBINFHSA-N 1 2 239.340 2.058 20 0 BEADLO CCc1ccc([C@@H](C)[NH2+][C@H](C)C(=O)OC)cc1 ZINC000042304175 384214989 /nfs/dbraw/zinc/21/49/89/384214989.db2.gz PNSZGMKLSPPBTQ-GHMZBOCLSA-N 1 2 235.327 2.461 20 0 BEADLO C/C(Cl)=C/C[NH2+][C@@H](C)c1nc(C)no1 ZINC000528446543 384240740 /nfs/dbraw/zinc/24/07/40/384240740.db2.gz ATRISZOCLKTIBQ-NGAMADIESA-N 1 2 215.684 2.171 20 0 BEADLO CC[NH+](CC)[C@@H](C(=O)OC)c1ccccc1F ZINC000072557602 384225591 /nfs/dbraw/zinc/22/55/91/384225591.db2.gz CURFDWUNYDHOAY-GFCCVEGCSA-N 1 2 239.290 2.382 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2cncs2)CCO1 ZINC000093508537 384244667 /nfs/dbraw/zinc/24/46/67/384244667.db2.gz ZPFMKWMQROKKPB-SNVBAGLBSA-N 1 2 226.345 2.144 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2cncs2)CCO1 ZINC000093508537 384244673 /nfs/dbraw/zinc/24/46/73/384244673.db2.gz ZPFMKWMQROKKPB-SNVBAGLBSA-N 1 2 226.345 2.144 20 0 BEADLO Cc1ccc(O)c(C[N@@H+](C)Cc2nccs2)n1 ZINC000093582208 384251413 /nfs/dbraw/zinc/25/14/13/384251413.db2.gz CXAAPDQGLKGAMN-UHFFFAOYSA-N 1 2 249.339 2.184 20 0 BEADLO C[C@@H](CO)[N@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000159129778 384304659 /nfs/dbraw/zinc/30/46/59/384304659.db2.gz HFODGIHNSZQQLH-VIFPVBQESA-N 1 2 242.388 2.253 20 0 BEADLO C[C@@H](CO)[N@@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000159129778 384304663 /nfs/dbraw/zinc/30/46/63/384304663.db2.gz HFODGIHNSZQQLH-VIFPVBQESA-N 1 2 242.388 2.253 20 0 BEADLO O=C1OCC[C@H]1[NH2+][C@H]1CCC[C@H]1c1ccccc1 ZINC000133840593 384315191 /nfs/dbraw/zinc/31/51/91/384315191.db2.gz RXOBDHXPNJRYJJ-MELADBBJSA-N 1 2 245.322 2.228 20 0 BEADLO CCc1ccc(C[N@H+](C)Cc2cnn(C)c2)o1 ZINC000119692940 384294852 /nfs/dbraw/zinc/29/48/52/384294852.db2.gz VYOGRJVQLNCTNS-UHFFFAOYSA-N 1 2 233.315 2.208 20 0 BEADLO CCc1ccc(C[N@@H+](C)Cc2cnn(C)c2)o1 ZINC000119692940 384294860 /nfs/dbraw/zinc/29/48/60/384294860.db2.gz VYOGRJVQLNCTNS-UHFFFAOYSA-N 1 2 233.315 2.208 20 0 BEADLO C[C@@H]1CCN(c2ccccn2)C[C@@H]1n1cc[nH+]c1 ZINC000134160871 384336857 /nfs/dbraw/zinc/33/68/57/384336857.db2.gz FNCKMIASIUHESB-OLZOCXBDSA-N 1 2 242.326 2.366 20 0 BEADLO C[N@@H+](Cc1nccs1)C[C@@H](O)c1ccccc1 ZINC000175071357 384392190 /nfs/dbraw/zinc/39/21/90/384392190.db2.gz MPBDFXRLSCGYNP-GFCCVEGCSA-N 1 2 248.351 2.309 20 0 BEADLO C[N@H+](Cc1nccs1)C[C@@H](O)c1ccccc1 ZINC000175071357 384392198 /nfs/dbraw/zinc/39/21/98/384392198.db2.gz MPBDFXRLSCGYNP-GFCCVEGCSA-N 1 2 248.351 2.309 20 0 BEADLO CC[C@@H](C)NC(=O)Nc1cc[nH+]cc1C ZINC000121180001 384400436 /nfs/dbraw/zinc/40/04/36/384400436.db2.gz IPFLAHZUQLPXIH-SECBINFHSA-N 1 2 207.277 2.310 20 0 BEADLO CSC[C@H](C)NC(=O)Nc1cc[nH+]cc1C ZINC000121252405 384407506 /nfs/dbraw/zinc/40/75/06/384407506.db2.gz RTARLNWAULAZAJ-VIFPVBQESA-N 1 2 239.344 2.263 20 0 BEADLO Cn1cccc1C[N@H+](C)Cc1nccs1 ZINC000135152235 384417765 /nfs/dbraw/zinc/41/77/65/384417765.db2.gz FTHXYLZAPINPHD-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO Cn1cccc1C[N@@H+](C)Cc1nccs1 ZINC000135152235 384417771 /nfs/dbraw/zinc/41/77/71/384417771.db2.gz FTHXYLZAPINPHD-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO CC(C)CO[C@H]1CC[N@H+](Cc2nccs2)C1 ZINC000135149070 384418639 /nfs/dbraw/zinc/41/86/39/384418639.db2.gz DLQCESMGGYUDEI-NSHDSACASA-N 1 2 240.372 2.390 20 0 BEADLO CC(C)CO[C@H]1CC[N@@H+](Cc2nccs2)C1 ZINC000135149070 384418648 /nfs/dbraw/zinc/41/86/48/384418648.db2.gz DLQCESMGGYUDEI-NSHDSACASA-N 1 2 240.372 2.390 20 0 BEADLO C[C@@H]([NH2+]Cc1c[nH]cn1)c1ccccc1 ZINC000035776104 384421963 /nfs/dbraw/zinc/42/19/63/384421963.db2.gz RJSGQTHTVWZCDQ-SNVBAGLBSA-N 1 2 201.273 2.261 20 0 BEADLO CC(F)(F)CNc1cc(NC2CC2)nc[nH+]1 ZINC000560833646 384376251 /nfs/dbraw/zinc/37/62/51/384376251.db2.gz WLFCTNDOMSOHTD-UHFFFAOYSA-N 1 2 228.246 2.118 20 0 BEADLO CC(F)(F)CNc1cc(NC2CC2)[nH+]cn1 ZINC000560833646 384376253 /nfs/dbraw/zinc/37/62/53/384376253.db2.gz WLFCTNDOMSOHTD-UHFFFAOYSA-N 1 2 228.246 2.118 20 0 BEADLO c1cn(Cc2csc(C3CC3)n2)c[nH+]1 ZINC000120781393 384380866 /nfs/dbraw/zinc/38/08/66/384380866.db2.gz OVZDCASHCQAMGI-UHFFFAOYSA-N 1 2 205.286 2.265 20 0 BEADLO Cc1cnc(C[NH2+][C@H]2C[C@H](C)n3ccnc32)s1 ZINC000334200576 384384648 /nfs/dbraw/zinc/38/46/48/384384648.db2.gz NIEUWSDQKXURJH-WPRPVWTQSA-N 1 2 248.355 2.444 20 0 BEADLO CC(C)c1nc(N[C@@H]2CC[C@@H](F)C2)cc[nH+]1 ZINC000335607881 384386580 /nfs/dbraw/zinc/38/65/80/384386580.db2.gz KKHTUJSWKMPSRG-NXEZZACHSA-N 1 2 223.295 2.324 20 0 BEADLO CCCc1nnc(SCc2[nH+]ccn2C)o1 ZINC000121897108 384445655 /nfs/dbraw/zinc/44/56/55/384445655.db2.gz HXOLJRSUCPBVJR-UHFFFAOYSA-N 1 2 238.316 2.048 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2ccc[nH]2)s1 ZINC000175427711 384434911 /nfs/dbraw/zinc/43/49/11/384434911.db2.gz KTKQFTTZVBXRJC-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2ccc[nH]2)s1 ZINC000175427711 384434915 /nfs/dbraw/zinc/43/49/15/384434915.db2.gz KTKQFTTZVBXRJC-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NOCC(C)C ZINC000122142291 384460973 /nfs/dbraw/zinc/46/09/73/384460973.db2.gz ISRTZWWAVOOVEP-UHFFFAOYSA-N 1 2 223.276 2.099 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCCc2c1cnn2C)C(C)(F)F ZINC000335658698 384461092 /nfs/dbraw/zinc/46/10/92/384461092.db2.gz WJXDNRNDFRCIBK-WCBMZHEXSA-N 1 2 243.301 2.431 20 0 BEADLO CC[C@]1(C)C[N@H+](Cc2cnc(C)s2)CCO1 ZINC000135710236 384461170 /nfs/dbraw/zinc/46/11/70/384461170.db2.gz ICFZLGDNHFILDI-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO CC[C@]1(C)C[N@@H+](Cc2cnc(C)s2)CCO1 ZINC000135710236 384461174 /nfs/dbraw/zinc/46/11/74/384461174.db2.gz ICFZLGDNHFILDI-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO C[C@H]([NH2+]Cc1ccn[nH]1)c1cccs1 ZINC000036900230 384462024 /nfs/dbraw/zinc/46/20/24/384462024.db2.gz PKYZCTXLUYVMQV-QMMMGPOBSA-N 1 2 207.302 2.322 20 0 BEADLO CC[C@H]([NH2+]Cc1ncccc1F)c1nccn1C ZINC000530529421 384478973 /nfs/dbraw/zinc/47/89/73/384478973.db2.gz KEUNKCDJJQKRNB-NSHDSACASA-N 1 2 248.305 2.195 20 0 BEADLO CC[C@H](NCc1ncccc1F)c1[nH+]ccn1C ZINC000530529421 384478978 /nfs/dbraw/zinc/47/89/78/384478978.db2.gz KEUNKCDJJQKRNB-NSHDSACASA-N 1 2 248.305 2.195 20 0 BEADLO CCC[NH2+][C@H](C(=O)OCC)c1ccccc1 ZINC000037382468 384496252 /nfs/dbraw/zinc/49/62/52/384496252.db2.gz HMFRHTJCEIILSA-LBPRGKRZSA-N 1 2 221.300 2.290 20 0 BEADLO CC(C)n1ccc(CN[C@@H](C)c2[nH]cc[nH+]2)n1 ZINC000569600027 384499475 /nfs/dbraw/zinc/49/94/75/384499475.db2.gz WPHASULFPJRLBI-JTQLQIEISA-N 1 2 233.319 2.038 20 0 BEADLO C[C@H]1CC(C)(C)CC[C@H]1NC(=O)Cn1cc[nH+]c1 ZINC000517793643 384509612 /nfs/dbraw/zinc/50/96/12/384509612.db2.gz JFNXMCPIFQMPMK-NWDGAFQWSA-N 1 2 249.358 2.214 20 0 BEADLO CC[C@@H](NC(=O)CC1CCC1)c1[nH]cc[nH+]1 ZINC000221512788 384486389 /nfs/dbraw/zinc/48/63/89/384486389.db2.gz TWAMEISCIMODDD-SNVBAGLBSA-N 1 2 221.304 2.167 20 0 BEADLO COC(=O)C1([NH2+]CCSC(C)C)CCCC1 ZINC000309549522 384493793 /nfs/dbraw/zinc/49/37/93/384493793.db2.gz HRMLXJKDAKLGTB-UHFFFAOYSA-N 1 2 245.388 2.203 20 0 BEADLO COc1cc[nH+]cc1CSCCC(C)(C)O ZINC000568234691 384534426 /nfs/dbraw/zinc/53/44/26/384534426.db2.gz YGAGKLCSBADYLG-UHFFFAOYSA-N 1 2 241.356 2.484 20 0 BEADLO C[C@@H]1C[C@@H]1c1ccc(C[NH+]2CCN(C)CC2)o1 ZINC000137072015 384516709 /nfs/dbraw/zinc/51/67/09/384516709.db2.gz GQNGWWJECPJDLP-YPMHNXCESA-N 1 2 234.343 2.150 20 0 BEADLO C[N@H+](Cc1csc(C2CC2)n1)[C@H]1CCOC1 ZINC000161714030 384520309 /nfs/dbraw/zinc/52/03/09/384520309.db2.gz NFWAPGHIIWRRHM-NSHDSACASA-N 1 2 238.356 2.241 20 0 BEADLO C[N@@H+](Cc1csc(C2CC2)n1)[C@H]1CCOC1 ZINC000161714030 384520319 /nfs/dbraw/zinc/52/03/19/384520319.db2.gz NFWAPGHIIWRRHM-NSHDSACASA-N 1 2 238.356 2.241 20 0 BEADLO CN(C)c1ccc(NCc2ccccn2)[nH+]c1 ZINC000150909317 384522877 /nfs/dbraw/zinc/52/28/77/384522877.db2.gz NLCXGGCYXNRKOO-UHFFFAOYSA-N 1 2 228.299 2.155 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2CC23CC3)c(C)[nH+]1 ZINC000335066810 384523396 /nfs/dbraw/zinc/52/33/96/384523396.db2.gz GVDFTOXJCXEUJI-SNVBAGLBSA-N 1 2 216.284 2.437 20 0 BEADLO Cn1ncc2c1nc[nH+]c2NC[C@@H]1CC=CCC1 ZINC000049281750 384528453 /nfs/dbraw/zinc/52/84/53/384528453.db2.gz FIHZJHXKROWOID-SNVBAGLBSA-N 1 2 243.314 2.132 20 0 BEADLO COC(=O)C(C)(C)[NH2+]Cc1cccc2[nH]ccc21 ZINC000080342934 384547852 /nfs/dbraw/zinc/54/78/52/384547852.db2.gz DBFXSDFVCJBDGQ-UHFFFAOYSA-N 1 2 246.310 2.209 20 0 BEADLO Cn1c[nH+]cc1CN1CCc2c1cccc2F ZINC000184040663 384556933 /nfs/dbraw/zinc/55/69/33/384556933.db2.gz JDTGFKRTYQRZJG-UHFFFAOYSA-N 1 2 231.274 2.122 20 0 BEADLO CCOc1cccc(NCc2[nH]cc[nH+]2)c1 ZINC000049715560 384561274 /nfs/dbraw/zinc/56/12/74/384561274.db2.gz AGXLPTFEDAJHLF-UHFFFAOYSA-N 1 2 217.272 2.421 20 0 BEADLO C[N@H+](Cc1ccco1)Cc1cncs1 ZINC000162141359 384578572 /nfs/dbraw/zinc/57/85/72/384578572.db2.gz TYDKMWYJFCGYFO-UHFFFAOYSA-N 1 2 208.286 2.368 20 0 BEADLO C[N@@H+](Cc1ccco1)Cc1cncs1 ZINC000162141359 384578579 /nfs/dbraw/zinc/57/85/79/384578579.db2.gz TYDKMWYJFCGYFO-UHFFFAOYSA-N 1 2 208.286 2.368 20 0 BEADLO Cc1nc(C[N@@H+]2CCCO[C@@H](C)C2)cs1 ZINC000172321318 384565715 /nfs/dbraw/zinc/56/57/15/384565715.db2.gz GBVXPPLIIANBIZ-VIFPVBQESA-N 1 2 226.345 2.062 20 0 BEADLO Cc1nc(C[N@H+]2CCCO[C@@H](C)C2)cs1 ZINC000172321318 384565721 /nfs/dbraw/zinc/56/57/21/384565721.db2.gz GBVXPPLIIANBIZ-VIFPVBQESA-N 1 2 226.345 2.062 20 0 BEADLO CSc1ccc(C[NH+]2CCN(C)CC2)s1 ZINC000334606616 384604232 /nfs/dbraw/zinc/60/42/32/384604232.db2.gz UXHIEWVVBJGUEJ-UHFFFAOYSA-N 1 2 242.413 2.217 20 0 BEADLO Cc1cncc(C[NH2+][C@H](C)c2ccon2)c1 ZINC000309805553 384632622 /nfs/dbraw/zinc/63/26/22/384632622.db2.gz SCCIZRSTCSSIEG-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO Cc1nnc(C[N@@H+](C)[C@@H](C)c2ccc(F)cc2)[nH]1 ZINC000362480698 384608797 /nfs/dbraw/zinc/60/87/97/384608797.db2.gz UQONZEGRGYFJTH-VIFPVBQESA-N 1 2 248.305 2.445 20 0 BEADLO Cc1nnc(C[N@H+](C)[C@@H](C)c2ccc(F)cc2)[nH]1 ZINC000362480698 384608805 /nfs/dbraw/zinc/60/88/05/384608805.db2.gz UQONZEGRGYFJTH-VIFPVBQESA-N 1 2 248.305 2.445 20 0 BEADLO CCC[C@H]1C[C@@H]1C(=O)Nc1cc[nH+]c(C)c1 ZINC000359914848 384610693 /nfs/dbraw/zinc/61/06/93/384610693.db2.gz BWICBUUJAHMGHC-JQWIXIFHSA-N 1 2 218.300 2.187 20 0 BEADLO Cc1cncc(C[NH2+][C@@H](C)c2ccon2)c1 ZINC000309805551 384633228 /nfs/dbraw/zinc/63/32/28/384633228.db2.gz SCCIZRSTCSSIEG-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO COC[C@H]1C[N@H+](C/C=C/c2ccccc2)CCO1 ZINC000172879078 384633256 /nfs/dbraw/zinc/63/32/56/384633256.db2.gz VXFKXTZAKWDARV-SBJJXXPASA-N 1 2 247.338 2.047 20 0 BEADLO COC[C@H]1C[N@@H+](C/C=C/c2ccccc2)CCO1 ZINC000172879078 384633264 /nfs/dbraw/zinc/63/32/64/384633264.db2.gz VXFKXTZAKWDARV-SBJJXXPASA-N 1 2 247.338 2.047 20 0 BEADLO C[N@H+](C/C(Cl)=C/Cl)CC(C)(C)O ZINC000086274393 384631935 /nfs/dbraw/zinc/63/19/35/384631935.db2.gz FTENCADXGYCBBB-DAXSKMNVSA-N 1 2 212.120 2.008 20 0 BEADLO C[N@@H+](C/C(Cl)=C/Cl)CC(C)(C)O ZINC000086274393 384631941 /nfs/dbraw/zinc/63/19/41/384631941.db2.gz FTENCADXGYCBBB-DAXSKMNVSA-N 1 2 212.120 2.008 20 0 BEADLO CC(C)[C@H](CC(F)(F)F)[NH2+]Cc1ccn[nH]1 ZINC000336657429 384667429 /nfs/dbraw/zinc/66/74/29/384667429.db2.gz IJUKKWMTVZXZRP-VIFPVBQESA-N 1 2 235.253 2.476 20 0 BEADLO CC[C@H]([NH2+]CC(F)(F)CO)c1ccccc1 ZINC000184702933 384641314 /nfs/dbraw/zinc/64/13/14/384641314.db2.gz FMBWSGSUGKPSIK-NSHDSACASA-N 1 2 229.270 2.355 20 0 BEADLO Cc1cc(C)cc(C[NH2+]Cc2ccn[nH]2)c1 ZINC000043393747 384645978 /nfs/dbraw/zinc/64/59/78/384645978.db2.gz SEHDAICCRNSENJ-UHFFFAOYSA-N 1 2 215.300 2.316 20 0 BEADLO C/C=C/C[C@H](CO)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000184806095 384651166 /nfs/dbraw/zinc/65/11/66/384651166.db2.gz OZPHBRKBNZDTBJ-AAOUONPWSA-N 1 2 247.342 2.401 20 0 BEADLO CC(C)(C)OC1CC[NH+](Cc2ccon2)CC1 ZINC000162601300 384652208 /nfs/dbraw/zinc/65/22/08/384652208.db2.gz FKEYGGPZOLBTCA-UHFFFAOYSA-N 1 2 238.331 2.454 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cccc3c2OCO3)CCO1 ZINC000125534953 384724993 /nfs/dbraw/zinc/72/49/93/384724993.db2.gz QMCOHWHTZYPGIU-GFCCVEGCSA-N 1 2 249.310 2.026 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cccc3c2OCO3)CCO1 ZINC000125534953 384724996 /nfs/dbraw/zinc/72/49/96/384724996.db2.gz QMCOHWHTZYPGIU-GFCCVEGCSA-N 1 2 249.310 2.026 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1C(=O)NCCCn1cc[nH+]c1 ZINC000185168754 384688182 /nfs/dbraw/zinc/68/81/82/384688182.db2.gz SQZJNYBUXJDMEX-GXTWGEPZSA-N 1 2 249.358 2.072 20 0 BEADLO FCCC[NH2+]C1(c2noc(C(F)F)n2)CCC1 ZINC000368334719 384691017 /nfs/dbraw/zinc/69/10/17/384691017.db2.gz XDGALEMBQIWNDK-UHFFFAOYSA-N 1 2 249.236 2.336 20 0 BEADLO CCC[C@@H]([NH2+]Cc1cccs1)C(=O)OC ZINC000037966926 384691841 /nfs/dbraw/zinc/69/18/41/384691841.db2.gz DJFCBAYMUOSMRK-SNVBAGLBSA-N 1 2 227.329 2.179 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)NCCNc1cccc[nH+]1 ZINC000360000616 384703374 /nfs/dbraw/zinc/70/33/74/384703374.db2.gz LOLSHGMLJYAVBS-VXGBXAGGSA-N 1 2 247.342 2.046 20 0 BEADLO COCc1ccc(C[NH2+]Cc2nccs2)o1 ZINC000125901032 384720106 /nfs/dbraw/zinc/72/01/06/384720106.db2.gz QDGNCNZWGRWBGL-UHFFFAOYSA-N 1 2 238.312 2.172 20 0 BEADLO CCc1cc(N)nc(SCC(C)C)[nH+]1 ZINC000279071551 384779432 /nfs/dbraw/zinc/77/94/32/384779432.db2.gz KDSQGTMZCUZTKK-UHFFFAOYSA-N 1 2 211.334 2.369 20 0 BEADLO CCc1[nH]c(CNC(=O)C[C@@H](C)C2CC2)c[nH+]1 ZINC001645212789 1172642780 /nfs/dbraw/zinc/64/27/80/1172642780.db2.gz LDIDYESZIIXIGY-SECBINFHSA-N 1 2 235.331 2.025 20 0 BEADLO c1cn(CCCSC2CCOCC2)c[nH+]1 ZINC000185637062 384750562 /nfs/dbraw/zinc/75/05/62/384750562.db2.gz PNKKMDCCUPOVBG-UHFFFAOYSA-N 1 2 226.345 2.185 20 0 BEADLO CCc1[nH]cc(CNC(=O)C[C@@H](C)C2CC2)[nH+]1 ZINC001645212789 1172642784 /nfs/dbraw/zinc/64/27/84/1172642784.db2.gz LDIDYESZIIXIGY-SECBINFHSA-N 1 2 235.331 2.025 20 0 BEADLO CCN(CC)c1ccc(N[C@@H](C)COC)c[nH+]1 ZINC000053173615 384770381 /nfs/dbraw/zinc/77/03/81/384770381.db2.gz AGOJZSXGHQGSOB-NSHDSACASA-N 1 2 237.347 2.375 20 0 BEADLO CC(C)[N@H+](CCC[C@@H](C)O)CC(F)F ZINC000308578488 384820005 /nfs/dbraw/zinc/82/00/05/384820005.db2.gz NZQHAYKKKHMTRN-SECBINFHSA-N 1 2 209.280 2.123 20 0 BEADLO CC(C)[N@@H+](CCC[C@@H](C)O)CC(F)F ZINC000308578488 384820011 /nfs/dbraw/zinc/82/00/11/384820011.db2.gz NZQHAYKKKHMTRN-SECBINFHSA-N 1 2 209.280 2.123 20 0 BEADLO CC(C)n1cc(C[NH2+]Cc2cccc(F)c2)nn1 ZINC000289599645 384789117 /nfs/dbraw/zinc/78/91/17/384789117.db2.gz DIPPCBGSWXWMFU-UHFFFAOYSA-N 1 2 248.305 2.288 20 0 BEADLO CCc1ccc([C@H](COC)[NH2+]Cc2cc[nH]n2)o1 ZINC000174477912 384796918 /nfs/dbraw/zinc/79/69/18/384796918.db2.gz NWFNIBGXUUKLCC-LBPRGKRZSA-N 1 2 249.314 2.042 20 0 BEADLO CC[C@H]([NH2+]Cc1ncn(C)n1)c1ccsc1 ZINC000294396702 384802464 /nfs/dbraw/zinc/80/24/64/384802464.db2.gz KRAFXFUNHOEZQG-JTQLQIEISA-N 1 2 236.344 2.118 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)CCc1ccccc1 ZINC000126470099 384803900 /nfs/dbraw/zinc/80/39/00/384803900.db2.gz WJXHLUDGPKLVGZ-UHFFFAOYSA-N 1 2 229.327 2.393 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)CCc1ccccc1 ZINC000126470099 384803906 /nfs/dbraw/zinc/80/39/06/384803906.db2.gz WJXHLUDGPKLVGZ-UHFFFAOYSA-N 1 2 229.327 2.393 20 0 BEADLO CCC[C@H]([NH2+][C@@H]1C[C@H]1C1CC1)C(=O)OCC ZINC000310039316 384806542 /nfs/dbraw/zinc/80/65/42/384806542.db2.gz WXKAQBLLINZEQI-SDDRHHMPSA-N 1 2 225.332 2.106 20 0 BEADLO C[C@@H]1COCC[N@@H+]1CCc1ccc(F)c(F)c1 ZINC000151924709 384875174 /nfs/dbraw/zinc/87/51/74/384875174.db2.gz WARYUZJLVHQRAS-SNVBAGLBSA-N 1 2 241.281 2.228 20 0 BEADLO C[C@@H]1COCC[N@H+]1CCc1ccc(F)c(F)c1 ZINC000151924709 384875181 /nfs/dbraw/zinc/87/51/81/384875181.db2.gz WARYUZJLVHQRAS-SNVBAGLBSA-N 1 2 241.281 2.228 20 0 BEADLO C[C@@]1(CNc2cccc[nH+]2)CCCC[C@H]1O ZINC000301485598 384875264 /nfs/dbraw/zinc/87/52/64/384875264.db2.gz HIJLVUGUKJOVRF-YPMHNXCESA-N 1 2 220.316 2.435 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1cc2ccccc2o1 ZINC000175174256 384876219 /nfs/dbraw/zinc/87/62/19/384876219.db2.gz RHFTUXXENCCYIT-SNVBAGLBSA-N 1 2 247.294 2.426 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1cc2ccccc2o1 ZINC000175174256 384876227 /nfs/dbraw/zinc/87/62/27/384876227.db2.gz RHFTUXXENCCYIT-SNVBAGLBSA-N 1 2 247.294 2.426 20 0 BEADLO C/C(Cl)=C\C[NH2+]C(C)(C)c1noc(C)n1 ZINC000528414581 384887379 /nfs/dbraw/zinc/88/73/79/384887379.db2.gz QXDKFHBWRIKQCU-FNORWQNLSA-N 1 2 229.711 2.345 20 0 BEADLO c1cn(-c2nc3ccccc3s2)c[nH+]1 ZINC000025369461 384848436 /nfs/dbraw/zinc/84/84/36/384848436.db2.gz GNMJEWXJNHOOBA-UHFFFAOYSA-N 1 2 201.254 2.482 20 0 BEADLO C[C@H]([NH2+]Cc1ccsc1)c1csnn1 ZINC000398227258 384856651 /nfs/dbraw/zinc/85/66/51/384856651.db2.gz HITUFOYMAGXMML-ZETCQYMHSA-N 1 2 225.342 2.450 20 0 BEADLO CC(C)c1nc(N[C@H]2CCCOC2)cc[nH+]1 ZINC000301247890 384862960 /nfs/dbraw/zinc/86/29/60/384862960.db2.gz LUMIEFSVZKECET-JTQLQIEISA-N 1 2 221.304 2.191 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1cc(C)ccc1F ZINC000336063287 384864491 /nfs/dbraw/zinc/86/44/91/384864491.db2.gz FBCQRLCCTDSGGV-UHFFFAOYSA-N 1 2 247.273 2.096 20 0 BEADLO CCCCOCCCNc1cc[nH+]c(C)n1 ZINC000127159782 384868533 /nfs/dbraw/zinc/86/85/33/384868533.db2.gz FUEBZQDEWQWMJF-UHFFFAOYSA-N 1 2 223.320 2.404 20 0 BEADLO CO[C@@H](C)CNc1[nH+]ccc(C)c1Cl ZINC000306438445 384949070 /nfs/dbraw/zinc/94/90/70/384949070.db2.gz IIRLRALQSDQKHN-QMMMGPOBSA-N 1 2 214.696 2.490 20 0 BEADLO FCCNc1cc(C(F)(F)F)cc[nH+]1 ZINC000306379256 384899831 /nfs/dbraw/zinc/89/98/31/384899831.db2.gz IBJWGLVXEUPLDA-UHFFFAOYSA-N 1 2 208.158 2.482 20 0 BEADLO COc1ccc(CNc2cccc[nH+]2)nc1 ZINC000309920268 384910614 /nfs/dbraw/zinc/91/06/14/384910614.db2.gz RPGXRFTXTIVKJK-UHFFFAOYSA-N 1 2 215.256 2.097 20 0 BEADLO C[NH+](C)c1ccc(NCc2cc[nH]n2)cc1 ZINC000057651426 384959093 /nfs/dbraw/zinc/95/90/93/384959093.db2.gz YVLQNIODKHXERL-UHFFFAOYSA-N 1 2 216.288 2.088 20 0 BEADLO Cn1nccc1CNc1ccc([NH+](C)C)cc1 ZINC000057651430 384959213 /nfs/dbraw/zinc/95/92/13/384959213.db2.gz DZZPJBYNYQKPPD-UHFFFAOYSA-N 1 2 230.315 2.098 20 0 BEADLO Cc1cnccc1CCNc1cccc[nH+]1 ZINC000301874713 384934436 /nfs/dbraw/zinc/93/44/36/384934436.db2.gz XWYFIDPXENPXPN-UHFFFAOYSA-N 1 2 213.284 2.440 20 0 BEADLO CC(C)(C)C[C@@H]1C[C@H]1C(=O)NCCn1cc[nH+]c1 ZINC000648221267 384947488 /nfs/dbraw/zinc/94/74/88/384947488.db2.gz KDJYXNWPXHSNFS-NWDGAFQWSA-N 1 2 249.358 2.072 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2nccn2C)sn1 ZINC000404389491 384972638 /nfs/dbraw/zinc/97/26/38/384972638.db2.gz XNHVSPYJJWSWIM-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO CC(C)c1nsc(NCc2ccc(N)[nH+]c2)n1 ZINC000302755419 385018437 /nfs/dbraw/zinc/01/84/37/385018437.db2.gz INZIYMPJXCDXRZ-UHFFFAOYSA-N 1 2 249.343 2.251 20 0 BEADLO Cc1ccc(NC(=O)NC(C)C)c(C)[nH+]1 ZINC000130114532 385023424 /nfs/dbraw/zinc/02/34/24/385023424.db2.gz ZLYQNSAUJPNOPF-UHFFFAOYSA-N 1 2 207.277 2.228 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2csnn2)sn1 ZINC000404508834 385024026 /nfs/dbraw/zinc/02/40/26/385024026.db2.gz OKKVUHOLNYPLFC-SSDOTTSWSA-N 1 2 240.357 2.154 20 0 BEADLO CCO[C@@H]1C[C@H]1C(=O)Nc1ccc(C)[nH+]c1C ZINC000176208795 385040157 /nfs/dbraw/zinc/04/01/57/385040157.db2.gz ZIBLHXDRCBREDI-ZYHUDNBSSA-N 1 2 234.299 2.062 20 0 BEADLO Cc1cnc(C[NH2+]Cc2cccc(O)c2)s1 ZINC000164841603 385043836 /nfs/dbraw/zinc/04/38/36/385043836.db2.gz XFWWMIQUTLLFQR-UHFFFAOYSA-N 1 2 234.324 2.447 20 0 BEADLO C[C@@H](C1CC1)[N@H+](C)Cc1noc(C2CC2)n1 ZINC000064931740 385128493 /nfs/dbraw/zinc/12/84/93/385128493.db2.gz GALWVMCOHIXQDG-QMMMGPOBSA-N 1 2 221.304 2.177 20 0 BEADLO C[C@@H](C1CC1)[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000064931740 385128498 /nfs/dbraw/zinc/12/84/98/385128498.db2.gz GALWVMCOHIXQDG-QMMMGPOBSA-N 1 2 221.304 2.177 20 0 BEADLO CCCC[C@@H](CC)C(=O)NCc1c[nH+]cn1C ZINC000292037169 385142337 /nfs/dbraw/zinc/14/23/37/385142337.db2.gz QQICGJWLAITVEB-LLVKDONJSA-N 1 2 237.347 2.253 20 0 BEADLO CC1=C(C)CN(C(=O)C(C)(C)c2c[nH+]c[nH]2)CC1 ZINC000646966767 385091610 /nfs/dbraw/zinc/09/16/10/385091610.db2.gz JNAJHVVLDQXCPS-UHFFFAOYSA-N 1 2 247.342 2.256 20 0 BEADLO C[C@H]([NH2+]c1ccc2c(c1)CCO2)[C@H]1CCOC1 ZINC000165287837 385097185 /nfs/dbraw/zinc/09/71/85/385097185.db2.gz IGONCHIZHCKQQQ-JQWIXIFHSA-N 1 2 233.311 2.458 20 0 BEADLO Cc1noc(C)c1[C@H](C)[NH2+]Cc1cc(C)ncn1 ZINC000644681873 385097314 /nfs/dbraw/zinc/09/73/14/385097314.db2.gz WHJKMRIIAZUXQO-VIFPVBQESA-N 1 2 246.314 2.241 20 0 BEADLO Cc1ccc2c(c1)OCCN2Cc1c[nH+]cn1C ZINC000177129062 385183433 /nfs/dbraw/zinc/18/34/33/385183433.db2.gz RCFSYJNPXUZZIR-UHFFFAOYSA-N 1 2 243.310 2.128 20 0 BEADLO CC[C@]1(C)CN(c2nc(C)[nH+]c(C)c2C)CCO1 ZINC000189825625 385187509 /nfs/dbraw/zinc/18/75/09/385187509.db2.gz MJSHMXYSPPIGDL-CQSZACIVSA-N 1 2 249.358 2.407 20 0 BEADLO CCC[C@H]([NH2+][C@@H](C)COC)C(=O)OC(C)(C)C ZINC000157486635 385195391 /nfs/dbraw/zinc/19/53/91/385195391.db2.gz HDMQWZMVZAZTSR-QWRGUYRKSA-N 1 2 245.363 2.121 20 0 BEADLO CCC1(CNc2[nH+]cnc3c2cnn3C)CCC1 ZINC000176856374 385151954 /nfs/dbraw/zinc/15/19/54/385151954.db2.gz RVPSHLSMFMMSAK-UHFFFAOYSA-N 1 2 245.330 2.356 20 0 BEADLO CC(C)Cn1nccc1CNc1cc[nH+]cc1F ZINC000647643821 385158561 /nfs/dbraw/zinc/15/85/61/385158561.db2.gz VFXAABSFSFOPJP-UHFFFAOYSA-N 1 2 248.305 2.107 20 0 BEADLO C[N@H+](Cc1ncc(Cl)s1)C1CC1 ZINC000306716657 385167034 /nfs/dbraw/zinc/16/70/34/385167034.db2.gz BPWUJXFZKYFKGC-UHFFFAOYSA-N 1 2 202.710 2.391 20 0 BEADLO C[N@@H+](Cc1ncc(Cl)s1)C1CC1 ZINC000306716657 385167038 /nfs/dbraw/zinc/16/70/38/385167038.db2.gz BPWUJXFZKYFKGC-UHFFFAOYSA-N 1 2 202.710 2.391 20 0 BEADLO Cn1ncc(Cl)c1C[N@H+](C)[C@H]1CCSC1 ZINC000189649463 385173831 /nfs/dbraw/zinc/17/38/31/385173831.db2.gz ZFLQNGFCYNIUAT-QMMMGPOBSA-N 1 2 245.779 2.011 20 0 BEADLO Cn1ncc(Cl)c1C[N@@H+](C)[C@H]1CCSC1 ZINC000189649463 385173840 /nfs/dbraw/zinc/17/38/40/385173840.db2.gz ZFLQNGFCYNIUAT-QMMMGPOBSA-N 1 2 245.779 2.011 20 0 BEADLO CN(C[C@@H]1CC=CCC1)c1cc(CO)cc[nH+]1 ZINC000402719939 385177169 /nfs/dbraw/zinc/17/71/69/385177169.db2.gz XNYLDNDNORBITM-GFCCVEGCSA-N 1 2 232.327 2.366 20 0 BEADLO Cc1nnc(C[NH2+][C@H](C)c2ccccc2)o1 ZINC000062639332 385179230 /nfs/dbraw/zinc/17/92/30/385179230.db2.gz FCTVCQWIHRDGTB-SECBINFHSA-N 1 2 217.272 2.229 20 0 BEADLO COC[C@@H](Cc1ccccc1)[NH2+]CC(C)(F)F ZINC000559875949 385208461 /nfs/dbraw/zinc/20/84/61/385208461.db2.gz CTICZSQIFZIPBT-GFCCVEGCSA-N 1 2 243.297 2.489 20 0 BEADLO CC[C@]1(C)C[N@H+](Cc2ncc(C)s2)CCO1 ZINC000190105790 385209406 /nfs/dbraw/zinc/20/94/06/385209406.db2.gz QSWSYERKHKRJHX-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO CC[C@]1(C)C[N@@H+](Cc2ncc(C)s2)CCO1 ZINC000190105790 385209412 /nfs/dbraw/zinc/20/94/12/385209412.db2.gz QSWSYERKHKRJHX-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO CCCN(C)c1cc(N2CCCCC2)nc[nH+]1 ZINC000110370106 385232296 /nfs/dbraw/zinc/23/22/96/385232296.db2.gz JRDIBDBEOCDDOQ-UHFFFAOYSA-N 1 2 234.347 2.313 20 0 BEADLO CCCN(C)c1cc(N2CCCCC2)[nH+]cn1 ZINC000110370106 385232302 /nfs/dbraw/zinc/23/23/02/385232302.db2.gz JRDIBDBEOCDDOQ-UHFFFAOYSA-N 1 2 234.347 2.313 20 0 BEADLO CC(C)(O)COc1ccc(-n2cc[nH+]c2)cc1 ZINC000153300140 385246657 /nfs/dbraw/zinc/24/66/57/385246657.db2.gz PXVCQEVZPMEXFO-UHFFFAOYSA-N 1 2 232.283 2.022 20 0 BEADLO C[C@]1(O)CCCN(c2[nH]c3ccccc3[nH+]2)CC1 ZINC000230372576 385246572 /nfs/dbraw/zinc/24/65/72/385246572.db2.gz JMZINNHXLAXYPM-AWEZNQCLSA-N 1 2 245.326 2.304 20 0 BEADLO CC(=O)CSCc1c[nH+]c2ccccn12 ZINC000179901070 385206044 /nfs/dbraw/zinc/20/60/44/385206044.db2.gz XVCDXQBPYCXFAJ-UHFFFAOYSA-N 1 2 220.297 2.157 20 0 BEADLO CSC1(CNc2cc(C)[nH+]cn2)CC1 ZINC000227992416 385305819 /nfs/dbraw/zinc/30/58/19/385305819.db2.gz ANRYYWAYVCREFG-UHFFFAOYSA-N 1 2 209.318 2.093 20 0 BEADLO Fc1ccc2c(c1)[C@H]([NH+]1CCOCC1)CC2 ZINC000177666456 385271666 /nfs/dbraw/zinc/27/16/66/385271666.db2.gz FCSCQYSQHAGTTH-CYBMUJFWSA-N 1 2 221.275 2.145 20 0 BEADLO C[N@H+](Cc1cscn1)Cc1cccc(O)c1 ZINC000177737153 385278709 /nfs/dbraw/zinc/27/87/09/385278709.db2.gz HRXUQOGWWYEKGO-UHFFFAOYSA-N 1 2 234.324 2.481 20 0 BEADLO C[N@@H+](Cc1cscn1)Cc1cccc(O)c1 ZINC000177737153 385278716 /nfs/dbraw/zinc/27/87/16/385278716.db2.gz HRXUQOGWWYEKGO-UHFFFAOYSA-N 1 2 234.324 2.481 20 0 BEADLO CC[C@H]([NH2+]Cc1cc(C)cs1)C(=O)OC ZINC000344620623 385287371 /nfs/dbraw/zinc/28/73/71/385287371.db2.gz KEHDKXDPNVVDKJ-JTQLQIEISA-N 1 2 227.329 2.098 20 0 BEADLO COC(=O)C[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1 ZINC000191354278 385299227 /nfs/dbraw/zinc/29/92/27/385299227.db2.gz IUZKEDLDHDIWRM-ZIAGYGMSSA-N 1 2 247.338 2.160 20 0 BEADLO C[N@H+](Cc1cocn1)Cc1ccc2c(c1)OCO2 ZINC000191922713 385334255 /nfs/dbraw/zinc/33/42/55/385334255.db2.gz PYUCTJCRRZHRFJ-UHFFFAOYSA-N 1 2 246.266 2.035 20 0 BEADLO C[N@@H+](Cc1cocn1)Cc1ccc2c(c1)OCO2 ZINC000191922713 385334261 /nfs/dbraw/zinc/33/42/61/385334261.db2.gz PYUCTJCRRZHRFJ-UHFFFAOYSA-N 1 2 246.266 2.035 20 0 BEADLO Cc1c([C@@H](C)Nc2cccc[nH+]2)cnn1C ZINC000180398818 385388942 /nfs/dbraw/zinc/38/89/42/385388942.db2.gz ZYWWHYOIMPLSGL-SECBINFHSA-N 1 2 216.288 2.297 20 0 BEADLO Cc1c[nH+]cc(N[C@@H]2COC(C)(C)C2)c1 ZINC000335358390 385346604 /nfs/dbraw/zinc/34/66/04/385346604.db2.gz OTPCWWPUQRLPTA-NSHDSACASA-N 1 2 206.289 2.369 20 0 BEADLO C[N@H+](CCOCc1ccccc1)Cc1ccon1 ZINC000154711084 385349297 /nfs/dbraw/zinc/34/92/97/385349297.db2.gz KUEXLUARTJUQLS-UHFFFAOYSA-N 1 2 246.310 2.323 20 0 BEADLO C[N@@H+](CCOCc1ccccc1)Cc1ccon1 ZINC000154711084 385349302 /nfs/dbraw/zinc/34/93/02/385349302.db2.gz KUEXLUARTJUQLS-UHFFFAOYSA-N 1 2 246.310 2.323 20 0 BEADLO C[C@@H](O)c1ccc(C[NH2+]Cc2cocn2)cc1 ZINC000192294754 385351649 /nfs/dbraw/zinc/35/16/49/385351649.db2.gz PBTBPWYOWFMWOG-SNVBAGLBSA-N 1 2 232.283 2.018 20 0 BEADLO CCOCCNc1cc[nH+]c(C(C)C)n1 ZINC000110226072 385389683 /nfs/dbraw/zinc/38/96/83/385389683.db2.gz WSYWPYGKBZSQMU-UHFFFAOYSA-N 1 2 209.293 2.048 20 0 BEADLO CC(C)[C@H](C)C(=O)NCc1ccn2cc[nH+]c2c1 ZINC000178360488 385360574 /nfs/dbraw/zinc/36/05/74/385360574.db2.gz ALVKLKDSJXLJDQ-NSHDSACASA-N 1 2 245.326 2.243 20 0 BEADLO FCC[NH2+][C@H](c1ncc[nH]1)c1ccccc1 ZINC000280916055 385382028 /nfs/dbraw/zinc/38/20/28/385382028.db2.gz DJYMUHINQDJXOC-NSHDSACASA-N 1 2 219.263 2.058 20 0 BEADLO FCCN[C@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000280916055 385382032 /nfs/dbraw/zinc/38/20/32/385382032.db2.gz DJYMUHINQDJXOC-NSHDSACASA-N 1 2 219.263 2.058 20 0 BEADLO Cc1cn[nH]c1C[NH2+]Cc1nc(C)c(C)s1 ZINC000336709172 385392693 /nfs/dbraw/zinc/39/26/93/385392693.db2.gz RBCCXCXWKTXKDB-UHFFFAOYSA-N 1 2 236.344 2.081 20 0 BEADLO Cc1c[nH]nc1C[NH2+]Cc1nc(C)c(C)s1 ZINC000336709172 385392696 /nfs/dbraw/zinc/39/26/96/385392696.db2.gz RBCCXCXWKTXKDB-UHFFFAOYSA-N 1 2 236.344 2.081 20 0 BEADLO C[C@H]([N@H+](C)Cc1csnn1)C1(C)CC1 ZINC000180534914 385393250 /nfs/dbraw/zinc/39/32/50/385393250.db2.gz ZVHZCNMEUCUBRU-QMMMGPOBSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@H]([N@@H+](C)Cc1csnn1)C1(C)CC1 ZINC000180534914 385393254 /nfs/dbraw/zinc/39/32/54/385393254.db2.gz ZVHZCNMEUCUBRU-QMMMGPOBSA-N 1 2 211.334 2.159 20 0 BEADLO CC=CC=CC(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000364392573 385406632 /nfs/dbraw/zinc/40/66/32/385406632.db2.gz WCBOHTOTCNIJKB-MQQKCMAXSA-N 1 2 245.326 2.248 20 0 BEADLO CC=CC=CC(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000364392573 385406636 /nfs/dbraw/zinc/40/66/36/385406636.db2.gz WCBOHTOTCNIJKB-MQQKCMAXSA-N 1 2 245.326 2.248 20 0 BEADLO CC[C@@H](CC(F)(F)F)[NH2+]Cc1ccn[nH]1 ZINC000309096435 385407534 /nfs/dbraw/zinc/40/75/34/385407534.db2.gz FATHZGZCNBNTFT-ZETCQYMHSA-N 1 2 221.226 2.230 20 0 BEADLO CC[C@H](CC(F)(F)F)[NH2+]Cc1ccn[nH]1 ZINC000309096431 385407655 /nfs/dbraw/zinc/40/76/55/385407655.db2.gz FATHZGZCNBNTFT-SSDOTTSWSA-N 1 2 221.226 2.230 20 0 BEADLO CCOC(=O)[C@H]([NH2+]CCSCC)[C@H](C)CC ZINC000181637596 385411603 /nfs/dbraw/zinc/41/16/03/385411603.db2.gz MPOCJRZFUJYYFE-GHMZBOCLSA-N 1 2 247.404 2.307 20 0 BEADLO Cc1cc(N[C@@H]2CCCC[C@H]2F)nc[nH+]1 ZINC000334723578 385414817 /nfs/dbraw/zinc/41/48/17/385414817.db2.gz ZUHTWPJTOLQHJS-NXEZZACHSA-N 1 2 209.268 2.478 20 0 BEADLO Cc1cc[nH+]c(NC[C@@H](O)C(F)F)c1Cl ZINC000309164481 385445136 /nfs/dbraw/zinc/44/51/36/385445136.db2.gz IKKFYTWURKRJCC-ZCFIWIBFSA-N 1 2 236.649 2.081 20 0 BEADLO Cc1ccc(O)c(NC(=O)C=Cc2c[nH]c[nH+]2)c1 ZINC000492861056 385452727 /nfs/dbraw/zinc/45/27/27/385452727.db2.gz IZGNZIYZNONSJZ-HYXAFXHYSA-N 1 2 243.266 2.076 20 0 BEADLO Cn1cc(C[N@@H+]2CCc3ccc(F)cc3C2)cn1 ZINC000179072552 385437958 /nfs/dbraw/zinc/43/79/58/385437958.db2.gz KMFICOMJRIIPEO-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1cc(C[N@H+]2CCc3ccc(F)cc3C2)cn1 ZINC000179072552 385437960 /nfs/dbraw/zinc/43/79/60/385437960.db2.gz KMFICOMJRIIPEO-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO C[C@@H](O)C[C@@H](C)CNc1cc[nH+]c(C2CC2)n1 ZINC000156699335 385465735 /nfs/dbraw/zinc/46/57/35/385465735.db2.gz CISZPGIRWQGADB-NXEZZACHSA-N 1 2 235.331 2.173 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CCO[C@@H](C3CC3)C2)cn1 ZINC000364496431 385472921 /nfs/dbraw/zinc/47/29/21/385472921.db2.gz SPGYNWMWGRCNHN-CQSZACIVSA-N 1 2 249.358 2.075 20 0 BEADLO CC(C)n1cc(C[N@H+]2CCO[C@@H](C3CC3)C2)cn1 ZINC000364496431 385472925 /nfs/dbraw/zinc/47/29/25/385472925.db2.gz SPGYNWMWGRCNHN-CQSZACIVSA-N 1 2 249.358 2.075 20 0 BEADLO Cc1nc(N2CC[C@@H](CC(C)(C)C)C2)nc(N)[nH+]1 ZINC000307836334 385474870 /nfs/dbraw/zinc/47/48/70/385474870.db2.gz PMUOIZWSFJWCFN-JTQLQIEISA-N 1 2 249.362 2.025 20 0 BEADLO Cc1nc(N)nc(N2CC[C@@H](CC(C)(C)C)C2)[nH+]1 ZINC000307836334 385474873 /nfs/dbraw/zinc/47/48/73/385474873.db2.gz PMUOIZWSFJWCFN-JTQLQIEISA-N 1 2 249.362 2.025 20 0 BEADLO CC(=O)NCc1c(Cl)cccc1-n1cc[nH+]c1 ZINC000336393471 385484679 /nfs/dbraw/zinc/48/46/79/385484679.db2.gz VHVDXGIOXIJRFW-UHFFFAOYSA-N 1 2 249.701 2.162 20 0 BEADLO CC(C)=CC[NH2+][C@@H](c1ncc[nH]1)c1cccnc1 ZINC000195129720 385460495 /nfs/dbraw/zinc/46/04/95/385460495.db2.gz VXPGRILPBRLWFQ-CYBMUJFWSA-N 1 2 242.326 2.450 20 0 BEADLO CC(C)=CC[NH2+][C@H](c1ncc[nH]1)c1cccnc1 ZINC000195129711 385460611 /nfs/dbraw/zinc/46/06/11/385460611.db2.gz VXPGRILPBRLWFQ-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO COC[C@@H]([NH2+][C@@H](C)c1cnccn1)c1ccco1 ZINC000156621060 385462782 /nfs/dbraw/zinc/46/27/82/385462782.db2.gz TVSSMJSLDPWZRX-CMPLNLGQSA-N 1 2 247.298 2.108 20 0 BEADLO COC[C@H](C)[N@H+](C)Cc1c(F)cccc1F ZINC000179373350 385463174 /nfs/dbraw/zinc/46/31/74/385463174.db2.gz XIJNWIHUPUKVMT-VIFPVBQESA-N 1 2 229.270 2.432 20 0 BEADLO COC[C@H](C)[N@@H+](C)Cc1c(F)cccc1F ZINC000179373350 385463177 /nfs/dbraw/zinc/46/31/77/385463177.db2.gz XIJNWIHUPUKVMT-VIFPVBQESA-N 1 2 229.270 2.432 20 0 BEADLO O=C(CCc1ccsc1)Nc1cc[nH+]cc1O ZINC000109889649 385491427 /nfs/dbraw/zinc/49/14/27/385491427.db2.gz LLJKPNKMIUMYIP-UHFFFAOYSA-N 1 2 248.307 2.420 20 0 BEADLO CCc1ccc(C(C)(C)[NH2+]CC(=O)OC)cc1 ZINC000180103651 385507689 /nfs/dbraw/zinc/50/76/89/385507689.db2.gz UHUAYCUFIUSGPX-UHFFFAOYSA-N 1 2 235.327 2.247 20 0 BEADLO CC(C)c1nc(NC[C@H]2CCCO2)cc[nH+]1 ZINC000106461818 385509105 /nfs/dbraw/zinc/50/91/05/385509105.db2.gz WYYIEXMYDVQBCW-SNVBAGLBSA-N 1 2 221.304 2.191 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)[C@@H]1CCCC1(C)C ZINC000616928122 385490438 /nfs/dbraw/zinc/49/04/38/385490438.db2.gz XJVAUZOJTHSTFH-NSHDSACASA-N 1 2 235.331 2.194 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)[C@@H]1CCCC1(C)C ZINC000616928122 385490443 /nfs/dbraw/zinc/49/04/43/385490443.db2.gz XJVAUZOJTHSTFH-NSHDSACASA-N 1 2 235.331 2.194 20 0 BEADLO CCN(CC1CC1)C(=O)c1ccc2[nH+]ccn2c1 ZINC000171944195 385535464 /nfs/dbraw/zinc/53/54/64/385535464.db2.gz UQMBYOVVOVOEHA-UHFFFAOYSA-N 1 2 243.310 2.206 20 0 BEADLO CC[N@H+](CC1CC1)[C@@H](C(=O)OC)c1cccnc1 ZINC000157926387 385536882 /nfs/dbraw/zinc/53/68/82/385536882.db2.gz WUEFSWCDSGAJBQ-CYBMUJFWSA-N 1 2 248.326 2.028 20 0 BEADLO CC[N@@H+](CC1CC1)[C@@H](C(=O)OC)c1cccnc1 ZINC000157926387 385536886 /nfs/dbraw/zinc/53/68/86/385536886.db2.gz WUEFSWCDSGAJBQ-CYBMUJFWSA-N 1 2 248.326 2.028 20 0 BEADLO Cc1ccc(NC(=O)c2cc(F)c[nH]2)c(C)[nH+]1 ZINC000334417182 385547968 /nfs/dbraw/zinc/54/79/68/385547968.db2.gz QTIXNUNEUWHHHG-UHFFFAOYSA-N 1 2 233.246 2.418 20 0 BEADLO COC[C@H](C)CNc1nc(C)[nH+]c2c1CCCC2 ZINC000180430518 385523223 /nfs/dbraw/zinc/52/32/23/385523223.db2.gz LDCWHUYHJPCCDM-SNVBAGLBSA-N 1 2 249.358 2.358 20 0 BEADLO COC[C@@H](C)CNc1nc(C)[nH+]c2c1CCCC2 ZINC000180430536 385523276 /nfs/dbraw/zinc/52/32/76/385523276.db2.gz LDCWHUYHJPCCDM-JTQLQIEISA-N 1 2 249.358 2.358 20 0 BEADLO Cc1cnc(C[N@H+](C)C[C@H]2CCCO2)s1 ZINC000180439804 385523946 /nfs/dbraw/zinc/52/39/46/385523946.db2.gz RHFULQKCJJXFAP-SNVBAGLBSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1cnc(C[N@@H+](C)C[C@H]2CCCO2)s1 ZINC000180439804 385523948 /nfs/dbraw/zinc/52/39/48/385523948.db2.gz RHFULQKCJJXFAP-SNVBAGLBSA-N 1 2 226.345 2.062 20 0 BEADLO Cc1cnc(C[N@@H+]2CCc3ccsc3C2)cn1 ZINC000334438203 385551000 /nfs/dbraw/zinc/55/10/00/385551000.db2.gz JKCXBSSBPAORFB-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cnc(C[N@H+]2CCc3ccsc3C2)cn1 ZINC000334438203 385551006 /nfs/dbraw/zinc/55/10/06/385551006.db2.gz JKCXBSSBPAORFB-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)Cc1cccc(O)c1 ZINC000107038870 385552511 /nfs/dbraw/zinc/55/25/11/385552511.db2.gz HJDVHYSAVSFMJG-UHFFFAOYSA-N 1 2 242.278 2.277 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[NH2+]C[C@@H](C)SC ZINC000181021772 385560189 /nfs/dbraw/zinc/56/01/89/385560189.db2.gz BEMKCFWEFQKLTG-GHMZBOCLSA-N 1 2 247.404 2.305 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)CCc1ccncc1 ZINC000107289427 385560998 /nfs/dbraw/zinc/56/09/98/385560998.db2.gz FBPKWKABFHZBEI-UHFFFAOYSA-N 1 2 241.294 2.356 20 0 BEADLO CC[C@@H](C)[C@@H]([NH2+]CCC(F)(F)F)C(=O)OC ZINC000336732215 385563849 /nfs/dbraw/zinc/56/38/49/385563849.db2.gz JHBKWAXCDJIZGX-HTQZYQBOSA-N 1 2 241.253 2.116 20 0 BEADLO Cc1csc(C[NH+]2CC3(C2)CCCOC3)n1 ZINC000334510324 385563982 /nfs/dbraw/zinc/56/39/82/385563982.db2.gz APAIVGOOMZVOTG-UHFFFAOYSA-N 1 2 238.356 2.064 20 0 BEADLO C[C@H](C(=O)Nc1c[nH+]c2n1CCCC2)C1CC1 ZINC000334650944 385594885 /nfs/dbraw/zinc/59/48/85/385594885.db2.gz CHLSWVHVMRIAFI-VIFPVBQESA-N 1 2 233.315 2.204 20 0 BEADLO COC(=O)[C@H]([NH2+][C@H]1C[C@H]1c1ccccc1)C1CC1 ZINC000300064805 385585983 /nfs/dbraw/zinc/58/59/83/385585983.db2.gz RSRPHSOCWFUFIN-MELADBBJSA-N 1 2 245.322 2.084 20 0 BEADLO CC[C@H](F)C[NH2+][C@@H](C)c1nnc(C)s1 ZINC000336649069 385587782 /nfs/dbraw/zinc/58/77/82/385587782.db2.gz HIQVOWZAMVZQDI-XPUUQOCRSA-N 1 2 217.313 2.245 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1oc(C)nc1C ZINC000311711378 385606052 /nfs/dbraw/zinc/60/60/52/385606052.db2.gz VNVDTHGHXFSXQY-UHFFFAOYSA-N 1 2 220.272 2.483 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)N[C@H](C1CC1)C1CCC1 ZINC000493743747 385613867 /nfs/dbraw/zinc/61/38/67/385613867.db2.gz DRHMYXDAHNGAPS-UZYOAWRESA-N 1 2 245.326 2.118 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)C/C=C/c1ccccc1 ZINC000280948742 385620940 /nfs/dbraw/zinc/62/09/40/385620940.db2.gz TWBGSDMWOHBARQ-PMDBQALLSA-N 1 2 233.311 2.193 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)C/C=C/c1ccccc1 ZINC000280948742 385620947 /nfs/dbraw/zinc/62/09/47/385620947.db2.gz TWBGSDMWOHBARQ-PMDBQALLSA-N 1 2 233.311 2.193 20 0 BEADLO C[C@@H]1[C@H](C)SCC[N@@H+]1Cc1nccs1 ZINC000269672243 385624611 /nfs/dbraw/zinc/62/46/11/385624611.db2.gz AUFCBDMUTSTTKP-BDAKNGLRSA-N 1 2 228.386 2.469 20 0 BEADLO C[C@@H]1[C@H](C)SCC[N@H+]1Cc1nccs1 ZINC000269672243 385624616 /nfs/dbraw/zinc/62/46/16/385624616.db2.gz AUFCBDMUTSTTKP-BDAKNGLRSA-N 1 2 228.386 2.469 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(F)(F)[C@H](C)C2)no1 ZINC000334574442 385626184 /nfs/dbraw/zinc/62/61/84/385626184.db2.gz FSCIJAPCOXYCHX-MRVPVSSYSA-N 1 2 230.258 2.460 20 0 BEADLO Cc1cc(C[N@H+]2CCC(F)(F)[C@H](C)C2)no1 ZINC000334574442 385626189 /nfs/dbraw/zinc/62/61/89/385626189.db2.gz FSCIJAPCOXYCHX-MRVPVSSYSA-N 1 2 230.258 2.460 20 0 BEADLO CO[C@H](C)CCC(=O)Nc1cc[nH+]c(C)c1 ZINC000181822393 385607738 /nfs/dbraw/zinc/60/77/38/385607738.db2.gz PGWCNVHRPWWKKA-SNVBAGLBSA-N 1 2 222.288 2.144 20 0 BEADLO COCc1cc(C[NH2+][C@@H]2CCCC[C@H]2F)no1 ZINC000414510048 385610029 /nfs/dbraw/zinc/61/00/29/385610029.db2.gz GTPOUPCRSXVZMZ-VXGBXAGGSA-N 1 2 242.294 2.191 20 0 BEADLO COC(=O)C[NH2+][C@@H](c1ccc(F)cc1)C(C)C ZINC000337385028 385638064 /nfs/dbraw/zinc/63/80/64/385638064.db2.gz FJGYMTFOUFASFY-CYBMUJFWSA-N 1 2 239.290 2.285 20 0 BEADLO CC(C)c1nc(N[C@H]2CCO[C@@H](C)C2)cc[nH+]1 ZINC000354709657 385641041 /nfs/dbraw/zinc/64/10/41/385641041.db2.gz FUJBGCXTWUMLTG-QWRGUYRKSA-N 1 2 235.331 2.001 20 0 BEADLO CC[C@H]([NH2+][C@@H]1CCCC(F)(F)C1)C(=O)OC ZINC000309505293 385642166 /nfs/dbraw/zinc/64/21/66/385642166.db2.gz BTVHDPNBJUHDKU-BDAKNGLRSA-N 1 2 235.274 2.106 20 0 BEADLO C[C@@H](O)CCC[N@@H+]1CCCC[C@H]1C(F)F ZINC000337411804 385643038 /nfs/dbraw/zinc/64/30/38/385643038.db2.gz PGNOYKXGQCVWEE-ZJUUUORDSA-N 1 2 221.291 2.267 20 0 BEADLO C[C@@H](O)CCC[N@H+]1CCCC[C@H]1C(F)F ZINC000337411804 385643045 /nfs/dbraw/zinc/64/30/45/385643045.db2.gz PGNOYKXGQCVWEE-ZJUUUORDSA-N 1 2 221.291 2.267 20 0 BEADLO FC(F)[C@@H]1CCCCN1CCCn1cc[nH+]c1 ZINC000337407923 385650911 /nfs/dbraw/zinc/65/09/11/385650911.db2.gz NOVZBQDSPGBKLU-NSHDSACASA-N 1 2 243.301 2.393 20 0 BEADLO Cc1c[nH+]ccc1CCNc1ncc(Cl)cn1 ZINC000269975706 385654187 /nfs/dbraw/zinc/65/41/87/385654187.db2.gz MCMOVHZPKSVPAI-UHFFFAOYSA-N 1 2 248.717 2.488 20 0 BEADLO CC1(C)C[C@H]1C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000372723567 385656225 /nfs/dbraw/zinc/65/62/25/385656225.db2.gz CHYFHUIKWGQVFM-NSHDSACASA-N 1 2 247.342 2.162 20 0 BEADLO CC1(C)C[C@H]1C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000372723567 385656232 /nfs/dbraw/zinc/65/62/32/385656232.db2.gz CHYFHUIKWGQVFM-NSHDSACASA-N 1 2 247.342 2.162 20 0 BEADLO Cc1nc(N(C)C[C@@H](C)c2nccs2)cc[nH+]1 ZINC000182355160 385661855 /nfs/dbraw/zinc/66/18/55/385661855.db2.gz NJMKMKIDLWHDJN-SECBINFHSA-N 1 2 248.355 2.481 20 0 BEADLO COCc1cnc(C[NH2+]C(C)(C)CF)s1 ZINC000336734481 385662994 /nfs/dbraw/zinc/66/29/94/385662994.db2.gz NDZRBCLCSZUYEQ-UHFFFAOYSA-N 1 2 232.324 2.127 20 0 BEADLO CCOC[C@H]1CCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000270551436 385717379 /nfs/dbraw/zinc/71/73/79/385717379.db2.gz GHTOLFRHEKPQHF-NSHDSACASA-N 1 2 245.326 2.426 20 0 BEADLO Cn1cc(C[N@H+]2CC=C(C(F)(F)F)CC2)cn1 ZINC000270207623 385684912 /nfs/dbraw/zinc/68/49/12/385684912.db2.gz DDLPLKZIVRVNIC-UHFFFAOYSA-N 1 2 245.248 2.115 20 0 BEADLO Cn1cc(C[N@@H+]2CC=C(C(F)(F)F)CC2)cn1 ZINC000270207623 385684917 /nfs/dbraw/zinc/68/49/17/385684917.db2.gz DDLPLKZIVRVNIC-UHFFFAOYSA-N 1 2 245.248 2.115 20 0 BEADLO CCN(CC)C(=O)C[C@H](C)[NH2+]C1(C(F)F)CC1 ZINC000337528562 385697575 /nfs/dbraw/zinc/69/75/75/385697575.db2.gz BVYDHBGFXPAASG-VIFPVBQESA-N 1 2 248.317 2.021 20 0 BEADLO CC[C@H]1CN(c2[nH+]c3ccccc3n2C)CCO1 ZINC000270557789 385717988 /nfs/dbraw/zinc/71/79/88/385717988.db2.gz IJYYVMBVGCRDPH-NSHDSACASA-N 1 2 245.326 2.189 20 0 BEADLO CC(C)c1nc(NCCC[C@H](C)O)cc[nH+]1 ZINC000309562762 385699577 /nfs/dbraw/zinc/69/95/77/385699577.db2.gz LNJDFFJXDJARAT-JTQLQIEISA-N 1 2 223.320 2.173 20 0 BEADLO C[N@H+](CCCc1cccc(F)c1)Cc1nnc[nH]1 ZINC000182835042 385711353 /nfs/dbraw/zinc/71/13/53/385711353.db2.gz UQYXGGTVHSPRBH-UHFFFAOYSA-N 1 2 248.305 2.008 20 0 BEADLO C[N@@H+](CCCc1cccc(F)c1)Cc1nnc[nH]1 ZINC000182835042 385711356 /nfs/dbraw/zinc/71/13/56/385711356.db2.gz UQYXGGTVHSPRBH-UHFFFAOYSA-N 1 2 248.305 2.008 20 0 BEADLO CC[C@@H](C)N(C)C(=O)Cc1cn2ccccc2[nH+]1 ZINC000340118322 385712516 /nfs/dbraw/zinc/71/25/16/385712516.db2.gz LHKYWWFTOWNBTQ-LLVKDONJSA-N 1 2 245.326 2.134 20 0 BEADLO C[C@@H]([NH2+]Cc1ncccn1)c1ccsc1 ZINC000061362733 385737923 /nfs/dbraw/zinc/73/79/23/385737923.db2.gz FJJJNFWAGOEVMV-SECBINFHSA-N 1 2 219.313 2.389 20 0 BEADLO C[NH2+]Cc1ccccc1NCc1cn[nH]c1C ZINC000414860651 385742521 /nfs/dbraw/zinc/74/25/21/385742521.db2.gz QAJFXHABWIWPNI-UHFFFAOYSA-N 1 2 230.315 2.050 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1O[C@H](C)C[C@H]1C ZINC000408462692 385747486 /nfs/dbraw/zinc/74/74/86/385747486.db2.gz AFQTYAIWDMVFNK-GIPNMCIBSA-N 1 2 248.326 2.450 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1O[C@@H](C)C[C@H]1C ZINC000408462669 385748067 /nfs/dbraw/zinc/74/80/67/385748067.db2.gz AFQTYAIWDMVFNK-GBIKHYSHSA-N 1 2 248.326 2.450 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1O[C@@H](C)C[C@@H]1C ZINC000408462697 385748150 /nfs/dbraw/zinc/74/81/50/385748150.db2.gz AFQTYAIWDMVFNK-OUJBWJOFSA-N 1 2 248.326 2.450 20 0 BEADLO COc1ncccc1C[NH2+][C@@H](C)c1cc(C)on1 ZINC000282726595 385783478 /nfs/dbraw/zinc/78/34/78/385783478.db2.gz MILCIVLQSXYJHW-JTQLQIEISA-N 1 2 247.298 2.237 20 0 BEADLO COC(=O)C[N@H+](C)C/C(C)=C/c1ccccc1 ZINC000271094247 385783901 /nfs/dbraw/zinc/78/39/01/385783901.db2.gz XYVFPMFKYVGGTL-FMIVXFBMSA-N 1 2 233.311 2.195 20 0 BEADLO COC(=O)C[N@@H+](C)C/C(C)=C/c1ccccc1 ZINC000271094247 385783903 /nfs/dbraw/zinc/78/39/03/385783903.db2.gz XYVFPMFKYVGGTL-FMIVXFBMSA-N 1 2 233.311 2.195 20 0 BEADLO CSCc1[nH+]ccn1CC(F)(F)F ZINC000336654036 385719091 /nfs/dbraw/zinc/71/90/91/385719091.db2.gz MYYXQCBCFUAULB-UHFFFAOYSA-N 1 2 210.224 2.308 20 0 BEADLO C[C@H]([NH2+]Cc1c[nH]cn1)c1ccc2n[nH]cc2c1 ZINC000353103863 385722651 /nfs/dbraw/zinc/72/26/51/385722651.db2.gz UDKRENHAKCRWFU-VIFPVBQESA-N 1 2 241.298 2.137 20 0 BEADLO CN(C[C@H]1CCC[C@@H]1O)c1[nH]c2ccccc2[nH+]1 ZINC000270595160 385723012 /nfs/dbraw/zinc/72/30/12/385723012.db2.gz UKNZJQRDLHSSRJ-MFKMUULPSA-N 1 2 245.326 2.160 20 0 BEADLO C[C@@H](O)C[C@H]1CCCN1c1[nH]c2ccccc2[nH+]1 ZINC000270589909 385723156 /nfs/dbraw/zinc/72/31/56/385723156.db2.gz SKYJPDIXDXGPDL-GHMZBOCLSA-N 1 2 245.326 2.303 20 0 BEADLO C[C@@H]([NH2+]Cc1ncnn1C(C)(C)C)c1ccco1 ZINC000282917856 385797853 /nfs/dbraw/zinc/79/78/53/385797853.db2.gz XSKAXJHOOFJKHD-SNVBAGLBSA-N 1 2 248.330 2.477 20 0 BEADLO CC(C)[C@H]1N(C(=O)CCn2cc[nH+]c2)CC1(C)C ZINC000294089565 385803868 /nfs/dbraw/zinc/80/38/68/385803868.db2.gz XQDTYKDOZCOBFM-CYBMUJFWSA-N 1 2 249.358 2.166 20 0 BEADLO Cc1ccoc1CNc1cccc(CO)[nH+]1 ZINC000336715828 385813981 /nfs/dbraw/zinc/81/39/81/385813981.db2.gz VSALLZGCNRTOCN-UHFFFAOYSA-N 1 2 218.256 2.087 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CC2(C1)CCCCC2 ZINC000283345830 385817592 /nfs/dbraw/zinc/81/75/92/385817592.db2.gz ZZTVOLWLHSLBSB-SNAWJCMRSA-N 1 2 245.326 2.216 20 0 BEADLO CC[C@H](C[N@H+](C)Cc1nccn1C(F)F)OC ZINC000412980623 385817824 /nfs/dbraw/zinc/81/78/24/385817824.db2.gz YDLGLAPQERPHTG-SECBINFHSA-N 1 2 247.289 2.135 20 0 BEADLO CC[C@H](C[N@@H+](C)Cc1nccn1C(F)F)OC ZINC000412980623 385817828 /nfs/dbraw/zinc/81/78/28/385817828.db2.gz YDLGLAPQERPHTG-SECBINFHSA-N 1 2 247.289 2.135 20 0 BEADLO CC/C(C)=C/C(=O)NCc1ccc(N(C)C)[nH+]c1 ZINC000294236925 385826114 /nfs/dbraw/zinc/82/61/14/385826114.db2.gz FDLARXVCLYBELV-DHZHZOJOSA-N 1 2 247.342 2.120 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CCc2ccc(F)cc2C1 ZINC000283727281 385829816 /nfs/dbraw/zinc/82/98/16/385829816.db2.gz BVCFLSHTQSRWGL-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CCc2ccc(F)cc2C1 ZINC000283727281 385829818 /nfs/dbraw/zinc/82/98/18/385829818.db2.gz BVCFLSHTQSRWGL-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO CC[C@@H](C)CN(CC)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000284221403 385857977 /nfs/dbraw/zinc/85/79/77/385857977.db2.gz AYNUPDUVHHWVQV-XUIVZRPNSA-N 1 2 235.331 2.318 20 0 BEADLO Cc1cn[nH]c1C[N@H+](C)CCOc1ccccc1 ZINC000284251958 385858023 /nfs/dbraw/zinc/85/80/23/385858023.db2.gz RHSVIKIMUFGBSV-UHFFFAOYSA-N 1 2 245.326 2.229 20 0 BEADLO Cc1cn[nH]c1C[N@@H+](C)CCOc1ccccc1 ZINC000284251958 385858024 /nfs/dbraw/zinc/85/80/24/385858024.db2.gz RHSVIKIMUFGBSV-UHFFFAOYSA-N 1 2 245.326 2.229 20 0 BEADLO CC(C)C[C@H](C)OC(=O)NCCn1cc[nH+]c1 ZINC000294291338 385833066 /nfs/dbraw/zinc/83/30/66/385833066.db2.gz HBAJUPAMIRNQCE-NSHDSACASA-N 1 2 239.319 2.044 20 0 BEADLO C[C@H](NC(=O)C=Cc1c[nH]c[nH+]1)C1CCCC1 ZINC000283838496 385835182 /nfs/dbraw/zinc/83/51/82/385835182.db2.gz GPGSSSBZTUDKAB-FGEFZZPRSA-N 1 2 233.315 2.118 20 0 BEADLO c1[nH]nnc1C[NH2+][C@@H]1CCC[C@@H]1c1ccccc1 ZINC000283969385 385842507 /nfs/dbraw/zinc/84/25/07/385842507.db2.gz LYJHSWNKRDNKMC-ZIAGYGMSSA-N 1 2 242.326 2.231 20 0 BEADLO c1n[nH]nc1C[NH2+][C@@H]1CCC[C@@H]1c1ccccc1 ZINC000283969385 385842509 /nfs/dbraw/zinc/84/25/09/385842509.db2.gz LYJHSWNKRDNKMC-ZIAGYGMSSA-N 1 2 242.326 2.231 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)s1 ZINC000644836587 385844496 /nfs/dbraw/zinc/84/44/96/385844496.db2.gz AKIVYUQFCODIEV-NWDGAFQWSA-N 1 2 223.341 2.284 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@@H]3C[C@@H]32)s1 ZINC000644836587 385844500 /nfs/dbraw/zinc/84/45/00/385844500.db2.gz AKIVYUQFCODIEV-NWDGAFQWSA-N 1 2 223.341 2.284 20 0 BEADLO COC(=O)C[N@H+](Cc1ccsc1C)C1CC1 ZINC000294407178 385846261 /nfs/dbraw/zinc/84/62/61/385846261.db2.gz WEYBLIRIMVCEOK-UHFFFAOYSA-N 1 2 239.340 2.194 20 0 BEADLO COC(=O)C[N@@H+](Cc1ccsc1C)C1CC1 ZINC000294407178 385846265 /nfs/dbraw/zinc/84/62/65/385846265.db2.gz WEYBLIRIMVCEOK-UHFFFAOYSA-N 1 2 239.340 2.194 20 0 BEADLO FC1=CCC[N@H+](Cc2c[nH]c3nccnc23)C1 ZINC000284112715 385852770 /nfs/dbraw/zinc/85/27/70/385852770.db2.gz OYOQBLTYRLSFOJ-UHFFFAOYSA-N 1 2 232.262 2.017 20 0 BEADLO FC1=CCC[N@@H+](Cc2c[nH]c3nccnc23)C1 ZINC000284112715 385852772 /nfs/dbraw/zinc/85/27/72/385852772.db2.gz OYOQBLTYRLSFOJ-UHFFFAOYSA-N 1 2 232.262 2.017 20 0 BEADLO Cc1nonc1C[NH2+]C1(c2cccc(F)c2)CC1 ZINC000271823474 385852970 /nfs/dbraw/zinc/85/29/70/385852970.db2.gz SJQIUPZQDCHXCW-UHFFFAOYSA-N 1 2 247.273 2.296 20 0 BEADLO CC(C)[C@@H]1CCCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000284142360 385853440 /nfs/dbraw/zinc/85/34/40/385853440.db2.gz WANXOHOECJZVMK-YBJDMEARSA-N 1 2 247.342 2.460 20 0 BEADLO Cc1cscc1CNCc1[nH+]cc(C)n1C ZINC000309690484 385793146 /nfs/dbraw/zinc/79/31/46/385793146.db2.gz JDDCRMFDXVNBOA-UHFFFAOYSA-N 1 2 235.356 2.388 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1ccc(C)c(F)c1 ZINC000271143036 385793450 /nfs/dbraw/zinc/79/34/50/385793450.db2.gz FOORXRAIDSOHNP-UHFFFAOYSA-N 1 2 239.290 2.129 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1ccc(C)c(F)c1 ZINC000271143036 385793455 /nfs/dbraw/zinc/79/34/55/385793455.db2.gz FOORXRAIDSOHNP-UHFFFAOYSA-N 1 2 239.290 2.129 20 0 BEADLO CCC[N@H+](CC(N)=O)Cc1cscc1Cl ZINC000644843120 385884470 /nfs/dbraw/zinc/88/44/70/385884470.db2.gz KUWVHSCXCQFXRO-UHFFFAOYSA-N 1 2 246.763 2.099 20 0 BEADLO CCC[N@@H+](CC(N)=O)Cc1cscc1Cl ZINC000644843120 385884473 /nfs/dbraw/zinc/88/44/73/385884473.db2.gz KUWVHSCXCQFXRO-UHFFFAOYSA-N 1 2 246.763 2.099 20 0 BEADLO COCC[C@H]([NH2+]Cc1cc[nH]n1)c1ccc(C)o1 ZINC000272300749 385891956 /nfs/dbraw/zinc/89/19/56/385891956.db2.gz NNSOQGXIOMSGEE-LBPRGKRZSA-N 1 2 249.314 2.179 20 0 BEADLO Cc1ccc(C[NH2+]Cc2snnc2C)o1 ZINC000291715185 385892565 /nfs/dbraw/zinc/89/25/65/385892565.db2.gz LUVFFCPXTZIXCJ-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO C[C@@H](O)c1cc(NCc2[nH+]ccn2C)ccc1F ZINC000285445971 385928936 /nfs/dbraw/zinc/92/89/36/385928936.db2.gz INHBRVGGLCJHMA-SECBINFHSA-N 1 2 249.289 2.225 20 0 BEADLO CCc1cccc(C[NH2+][C@H](C(=O)OC)C2CC2)c1 ZINC000285051186 385895940 /nfs/dbraw/zinc/89/59/40/385895940.db2.gz ODAHJWJDPUAYDJ-AWEZNQCLSA-N 1 2 247.338 2.290 20 0 BEADLO CC(C)c1nnc(C[NH2+]Cc2cccc(F)c2)[nH]1 ZINC000294792313 385896321 /nfs/dbraw/zinc/89/63/21/385896321.db2.gz MBPLUTLAZKXLFV-UHFFFAOYSA-N 1 2 248.305 2.357 20 0 BEADLO C[C@@H](CCCO)CNc1cc[nH+]c(C2CC2)n1 ZINC000294855729 385905044 /nfs/dbraw/zinc/90/50/44/385905044.db2.gz BPMCHFHLRWUWSN-JTQLQIEISA-N 1 2 235.331 2.175 20 0 BEADLO CCc1ccc(C[NH2+]Cc2nnc(C(C)C)[nH]2)o1 ZINC000294934236 385918813 /nfs/dbraw/zinc/91/88/13/385918813.db2.gz ZQDCRARSDBBWQB-UHFFFAOYSA-N 1 2 248.330 2.373 20 0 BEADLO Cc1cc(C)c(CNC(=O)NC2CCC2)c[nH+]1 ZINC000334498875 385925568 /nfs/dbraw/zinc/92/55/68/385925568.db2.gz NIRUDYFOQOYBAQ-UHFFFAOYSA-N 1 2 233.315 2.050 20 0 BEADLO Cc1cn[nH]c1C[N@@H+](C)[C@@H](C)c1cccnc1 ZINC000284268967 385859750 /nfs/dbraw/zinc/85/97/50/385859750.db2.gz SIMASUQTGIEVSV-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO Cc1cn[nH]c1C[N@H+](C)[C@@H](C)c1cccnc1 ZINC000284268967 385859755 /nfs/dbraw/zinc/85/97/55/385859755.db2.gz SIMASUQTGIEVSV-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO Cc1c[nH]nc1C[N@@H+](C)[C@@H](C)c1cccnc1 ZINC000284268967 385859757 /nfs/dbraw/zinc/85/97/57/385859757.db2.gz SIMASUQTGIEVSV-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO Cc1c[nH]nc1C[N@H+](C)[C@@H](C)c1cccnc1 ZINC000284268967 385859763 /nfs/dbraw/zinc/85/97/63/385859763.db2.gz SIMASUQTGIEVSV-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO CCC1(CC)CCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000284273154 385859932 /nfs/dbraw/zinc/85/99/32/385859932.db2.gz DZONACKCCKLDQZ-AATRIKPKSA-N 1 2 247.342 2.462 20 0 BEADLO Cc1c[nH]nc1C[N@@H+](C)[C@H](C)c1ccccn1 ZINC000284304924 385862359 /nfs/dbraw/zinc/86/23/59/385862359.db2.gz VJONOUOCQAXRCB-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO Cc1c[nH]nc1C[N@H+](C)[C@H](C)c1ccccn1 ZINC000284304924 385862361 /nfs/dbraw/zinc/86/23/61/385862361.db2.gz VJONOUOCQAXRCB-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO Cc1cn[nH]c1C[N@@H+](C)[C@H](C)c1ccccn1 ZINC000284304924 385862364 /nfs/dbraw/zinc/86/23/64/385862364.db2.gz VJONOUOCQAXRCB-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO Cc1cn[nH]c1C[N@H+](C)[C@H](C)c1ccccn1 ZINC000284304924 385862368 /nfs/dbraw/zinc/86/23/68/385862368.db2.gz VJONOUOCQAXRCB-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO Cc1c(C(=O)NCc2[nH]cc[nH+]2)ccn1C(C)C ZINC000340190976 385865911 /nfs/dbraw/zinc/86/59/11/385865911.db2.gz DMPSYHUAEQEPMQ-UHFFFAOYSA-N 1 2 246.314 2.031 20 0 BEADLO CC(C)CCC[S@@](=O)Cc1c[nH+]cn1C ZINC000271990947 385866292 /nfs/dbraw/zinc/86/62/92/385866292.db2.gz ZGOJCCIEVKLRNR-OAHLLOKOSA-N 1 2 228.361 2.105 20 0 BEADLO FC(F)[C@H]1CCC[N@@H+]1CCOCC1CC1 ZINC000353173240 385871804 /nfs/dbraw/zinc/87/18/04/385871804.db2.gz OQXUUZGXYWNVHT-SNVBAGLBSA-N 1 2 219.275 2.143 20 0 BEADLO FC(F)[C@H]1CCC[N@H+]1CCOCC1CC1 ZINC000353173240 385871808 /nfs/dbraw/zinc/87/18/08/385871808.db2.gz OQXUUZGXYWNVHT-SNVBAGLBSA-N 1 2 219.275 2.143 20 0 BEADLO CCC1(C(=O)N2CCc3[nH]c[nH+]c3C2)CCCC1 ZINC000647734766 385875118 /nfs/dbraw/zinc/87/51/18/385875118.db2.gz AZAOUWJSTAGIIR-UHFFFAOYSA-N 1 2 247.342 2.265 20 0 BEADLO CCC1(C(=O)N2CCc3[nH+]c[nH]c3C2)CCCC1 ZINC000647734766 385875120 /nfs/dbraw/zinc/87/51/20/385875120.db2.gz AZAOUWJSTAGIIR-UHFFFAOYSA-N 1 2 247.342 2.265 20 0 BEADLO CCC[C@@H]1CCC[C@@H]1C(=O)NCc1[nH]cc[nH+]1 ZINC000294617531 385875704 /nfs/dbraw/zinc/87/57/04/385875704.db2.gz NJPRFAXWDOXQEF-MNOVXSKESA-N 1 2 235.331 2.242 20 0 BEADLO Cc1ccc(C[NH2+]Cc2nnc(C(C)C)[nH]2)o1 ZINC000294688102 385881938 /nfs/dbraw/zinc/88/19/38/385881938.db2.gz CDRFJKVBELZCCM-UHFFFAOYSA-N 1 2 234.303 2.119 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+]1CCC=C(c2ccccc2)C1 ZINC000284733801 385882585 /nfs/dbraw/zinc/88/25/85/385882585.db2.gz KHKVQMFVYLJJKY-GFCCVEGCSA-N 1 2 245.322 2.337 20 0 BEADLO COC(=O)[C@@H](C)[N@H+]1CCC=C(c2ccccc2)C1 ZINC000284733801 385882592 /nfs/dbraw/zinc/88/25/92/385882592.db2.gz KHKVQMFVYLJJKY-GFCCVEGCSA-N 1 2 245.322 2.337 20 0 BEADLO CC[C@@H](C)[NH+]=c1[nH]c2cccc(F)c2n1C ZINC000336747580 385979252 /nfs/dbraw/zinc/97/92/52/385979252.db2.gz XHMPKLADKCKVDS-MRVPVSSYSA-N 1 2 221.279 2.345 20 0 BEADLO CO[C@H](C[N@H+](CC(F)F)C(C)C)C1CC1 ZINC000425413230 385981911 /nfs/dbraw/zinc/98/19/11/385981911.db2.gz GILOQDNRFXNNJO-SNVBAGLBSA-N 1 2 221.291 2.387 20 0 BEADLO CO[C@H](C[N@@H+](CC(F)F)C(C)C)C1CC1 ZINC000425413230 385981918 /nfs/dbraw/zinc/98/19/18/385981918.db2.gz GILOQDNRFXNNJO-SNVBAGLBSA-N 1 2 221.291 2.387 20 0 BEADLO C[N@H+](Cc1ncnn1C(C)(C)C)[C@@H]1CC1(C)C ZINC000338363845 385987703 /nfs/dbraw/zinc/98/77/03/385987703.db2.gz JKVRTVUMXXTPHQ-SNVBAGLBSA-N 1 2 236.363 2.263 20 0 BEADLO C[N@@H+](Cc1ncnn1C(C)(C)C)[C@@H]1CC1(C)C ZINC000338363845 385987710 /nfs/dbraw/zinc/98/77/10/385987710.db2.gz JKVRTVUMXXTPHQ-SNVBAGLBSA-N 1 2 236.363 2.263 20 0 BEADLO Cc1occc1C[NH2+][C@H](C)c1ccn(C)n1 ZINC000414060795 385937122 /nfs/dbraw/zinc/93/71/22/385937122.db2.gz AEUOWEMAUNBQHD-SECBINFHSA-N 1 2 219.288 2.172 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ccco1)c1ccn(C)n1 ZINC000414063776 385939983 /nfs/dbraw/zinc/93/99/83/385939983.db2.gz MUQVEJAHXPIZDM-UWVGGRQHSA-N 1 2 219.288 2.425 20 0 BEADLO Cc1ccc(NCC[C@H]2CCOC2)c[nH+]1 ZINC000336742376 385947339 /nfs/dbraw/zinc/94/73/39/385947339.db2.gz WXZLRJGDYNTTHO-NSHDSACASA-N 1 2 206.289 2.229 20 0 BEADLO C[C@H]1COCC[C@@H]1[NH2+]c1ccc2c(c1)CCN2 ZINC000335051663 385948342 /nfs/dbraw/zinc/94/83/42/385948342.db2.gz CDOXZVLVWJLHSI-GWCFXTLKSA-N 1 2 232.327 2.492 20 0 BEADLO C[C@H]1COCC[C@@H]1Nc1ccc2c(c1)CC[NH2+]2 ZINC000335051663 385948345 /nfs/dbraw/zinc/94/83/45/385948345.db2.gz CDOXZVLVWJLHSI-GWCFXTLKSA-N 1 2 232.327 2.492 20 0 BEADLO CO[C@@H]1CCC[N@@H+]([C@@H](C)c2nnc(C)s2)C1 ZINC000338284544 385949008 /nfs/dbraw/zinc/94/90/08/385949008.db2.gz QXSGUBLOYGBFGF-WCBMZHEXSA-N 1 2 241.360 2.018 20 0 BEADLO CO[C@@H]1CCC[N@H+]([C@@H](C)c2nnc(C)s2)C1 ZINC000338284544 385949014 /nfs/dbraw/zinc/94/90/14/385949014.db2.gz QXSGUBLOYGBFGF-WCBMZHEXSA-N 1 2 241.360 2.018 20 0 BEADLO C[C@@H]1OCC[C@@H]1Nc1ccc2c(c1)CC[NH2+]2 ZINC000335054921 385953624 /nfs/dbraw/zinc/95/36/24/385953624.db2.gz ORPLUMIGZXMUIG-CABZTGNLSA-N 1 2 218.300 2.244 20 0 BEADLO CCO[C@H](C)c1noc(C[NH+](CC)CC)n1 ZINC000115939232 385957106 /nfs/dbraw/zinc/95/71/06/385957106.db2.gz RCSLQTVZQQCIDM-SECBINFHSA-N 1 2 227.308 2.009 20 0 BEADLO C[C@H](CF)[NH2+]Cc1nccn1-c1ccccc1 ZINC000342208917 385959713 /nfs/dbraw/zinc/95/97/13/385959713.db2.gz VSMNIURNUREVBV-LLVKDONJSA-N 1 2 233.290 2.320 20 0 BEADLO Cc1ccc(NCC[C@@H]2CCOC2)c[nH+]1 ZINC000336742373 385962425 /nfs/dbraw/zinc/96/24/25/385962425.db2.gz WXZLRJGDYNTTHO-LLVKDONJSA-N 1 2 206.289 2.229 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)C[C@H]1CCCC(F)(F)C1 ZINC000338318621 385966532 /nfs/dbraw/zinc/96/65/32/385966532.db2.gz SBLACHVTBBEJNU-VIFPVBQESA-N 1 2 244.289 2.062 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)C[C@H]1CCCC(F)(F)C1 ZINC000338318621 385966540 /nfs/dbraw/zinc/96/65/40/385966540.db2.gz SBLACHVTBBEJNU-VIFPVBQESA-N 1 2 244.289 2.062 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1cccs1 ZINC000335016655 385973438 /nfs/dbraw/zinc/97/34/38/385973438.db2.gz RPWPVFWLNUQTEK-UHFFFAOYSA-N 1 2 234.280 2.404 20 0 BEADLO CCOC[C@H](Nc1cc[nH+]c(C)n1)C(C)C ZINC000233799669 386000233 /nfs/dbraw/zinc/00/02/33/386000233.db2.gz GYNRWBQDXPPQMO-NSHDSACASA-N 1 2 223.320 2.258 20 0 BEADLO CC[C@H]([NH2+][C@@H]1CCO[C@@H](C)C1)C(F)(F)F ZINC000336750212 386000784 /nfs/dbraw/zinc/00/07/84/386000784.db2.gz DSRLRBVTOFGTCE-YIZRAAEISA-N 1 2 225.254 2.484 20 0 BEADLO Fc1ccc(C[N@@H+]2CCC[C@H]2c2cc[nH]n2)nc1 ZINC000286175573 386006388 /nfs/dbraw/zinc/00/63/88/386006388.db2.gz OXDHPHDMNNMVPZ-ZDUSSCGKSA-N 1 2 246.289 2.281 20 0 BEADLO Fc1ccc(C[N@H+]2CCC[C@H]2c2cc[nH]n2)nc1 ZINC000286175573 386006393 /nfs/dbraw/zinc/00/63/93/386006393.db2.gz OXDHPHDMNNMVPZ-ZDUSSCGKSA-N 1 2 246.289 2.281 20 0 BEADLO c1cn(CCCS[C@@H]2CCCOC2)c[nH+]1 ZINC000273513570 386008575 /nfs/dbraw/zinc/00/85/75/386008575.db2.gz XHAPFWZTSFPHHC-LLVKDONJSA-N 1 2 226.345 2.185 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@@](C)(F)C2)o1 ZINC000295336862 386015399 /nfs/dbraw/zinc/01/53/99/386015399.db2.gz HUPYDQJAGIWCIS-LLVKDONJSA-N 1 2 212.268 2.307 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@@](C)(F)C2)o1 ZINC000295336862 386015405 /nfs/dbraw/zinc/01/54/05/386015405.db2.gz HUPYDQJAGIWCIS-LLVKDONJSA-N 1 2 212.268 2.307 20 0 BEADLO FC(F)Oc1ccc(NCc2[nH]cc[nH+]2)cn1 ZINC000338481424 386016657 /nfs/dbraw/zinc/01/66/57/386016657.db2.gz WUTRETDMWWVVCL-UHFFFAOYSA-N 1 2 240.213 2.018 20 0 BEADLO Cc1cc(NCC[C@@H]2C[C@@H](C)O[C@@H](C)C2)nc[nH+]1 ZINC000338489439 386018543 /nfs/dbraw/zinc/01/85/43/386018543.db2.gz OMDUVXKGPPBBFV-CLLJXQQHSA-N 1 2 249.358 2.213 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1 ZINC000295364268 386020060 /nfs/dbraw/zinc/02/00/60/386020060.db2.gz REEILFGECZOKPC-JFGNBEQYSA-N 1 2 249.358 2.407 20 0 BEADLO Clc1cc(C[N@H+](C2CC2)C2COC2)ccn1 ZINC000295360269 386020858 /nfs/dbraw/zinc/02/08/58/386020858.db2.gz JFJSORWJELRSOW-UHFFFAOYSA-N 1 2 238.718 2.098 20 0 BEADLO Clc1cc(C[N@@H+](C2CC2)C2COC2)ccn1 ZINC000295360269 386020861 /nfs/dbraw/zinc/02/08/61/386020861.db2.gz JFJSORWJELRSOW-UHFFFAOYSA-N 1 2 238.718 2.098 20 0 BEADLO CCC[N@@H+]1CC(=O)N[C@]12CCCC(C)(C)C2 ZINC000414179715 386023324 /nfs/dbraw/zinc/02/33/24/386023324.db2.gz IYCHODJOLKXDQA-CYBMUJFWSA-N 1 2 224.348 2.125 20 0 BEADLO CCC[N@H+]1CC(=O)N[C@]12CCCC(C)(C)C2 ZINC000414179715 386023332 /nfs/dbraw/zinc/02/33/32/386023332.db2.gz IYCHODJOLKXDQA-CYBMUJFWSA-N 1 2 224.348 2.125 20 0 BEADLO CC[C@H]1CCC[C@H]1C(=O)NCc1[nH]c[nH+]c1C ZINC000295411126 386025984 /nfs/dbraw/zinc/02/59/84/386025984.db2.gz VFWZDAUIMNDDNH-WDEREUQCSA-N 1 2 235.331 2.161 20 0 BEADLO CCC[N@@H+]1CC(=O)N[C@]12CCC[C@H](CC)C2 ZINC000414187102 386027179 /nfs/dbraw/zinc/02/71/79/386027179.db2.gz QAMWESMZELLKIN-WCQYABFASA-N 1 2 224.348 2.125 20 0 BEADLO CCC[N@H+]1CC(=O)N[C@]12CCC[C@H](CC)C2 ZINC000414187102 386027186 /nfs/dbraw/zinc/02/71/86/386027186.db2.gz QAMWESMZELLKIN-WCQYABFASA-N 1 2 224.348 2.125 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2cn3ccccc3n2)C1 ZINC000334422513 386028076 /nfs/dbraw/zinc/02/80/76/386028076.db2.gz UOSFHNBNOGQHQZ-CYBMUJFWSA-N 1 2 233.290 2.268 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2cn3ccccc3n2)C1 ZINC000334422513 386028081 /nfs/dbraw/zinc/02/80/81/386028081.db2.gz UOSFHNBNOGQHQZ-CYBMUJFWSA-N 1 2 233.290 2.268 20 0 BEADLO COc1cnccc1[C@@H](C)[NH2+]Cc1cscn1 ZINC000189570139 386028907 /nfs/dbraw/zinc/02/89/07/386028907.db2.gz PBVASMNUWHKRRS-SECBINFHSA-N 1 2 249.339 2.398 20 0 BEADLO Cc1c[nH+]c(C)nc1NCC1(O)CCCCCC1 ZINC000647868766 386032373 /nfs/dbraw/zinc/03/23/73/386032373.db2.gz JKNJEQQRDMIOAT-UHFFFAOYSA-N 1 2 249.358 2.013 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@H]1C1CCCCC1 ZINC000414200926 386038411 /nfs/dbraw/zinc/03/84/11/386038411.db2.gz SAKIHKJXTUBWBL-LLVKDONJSA-N 1 2 224.348 2.123 20 0 BEADLO CCC[C@@](C)(CC)c1nc(C[NH2+]C)no1 ZINC000414643258 386045609 /nfs/dbraw/zinc/04/56/09/386045609.db2.gz MLLUDLYPMGJYEZ-LLVKDONJSA-N 1 2 211.309 2.257 20 0 BEADLO CCO[C@@H](C)c1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000273885182 386047468 /nfs/dbraw/zinc/04/74/68/386047468.db2.gz HISYFNJCRUPBRB-JTQLQIEISA-N 1 2 247.298 2.461 20 0 BEADLO CC[C@@H](C)[C@H](C)C(=O)NCc1[nH+]ccn1CC ZINC000295544884 386050578 /nfs/dbraw/zinc/05/05/78/386050578.db2.gz DAMSRFGHVNUIFK-MNOVXSKESA-N 1 2 237.347 2.201 20 0 BEADLO CC[C@H]1CC[N@@H+]1Cc1cc(F)ncc1F ZINC000295582783 386054794 /nfs/dbraw/zinc/05/47/94/386054794.db2.gz BOLYOSWPSKDELL-VIFPVBQESA-N 1 2 212.243 2.344 20 0 BEADLO CC[C@H]1CC[N@H+]1Cc1cc(F)ncc1F ZINC000295582783 386054799 /nfs/dbraw/zinc/05/47/99/386054799.db2.gz BOLYOSWPSKDELL-VIFPVBQESA-N 1 2 212.243 2.344 20 0 BEADLO C[C@@H]1C[N@H+](CC(=O)Nc2ccccc2F)[C@@H]1C ZINC000334454000 386102430 /nfs/dbraw/zinc/10/24/30/386102430.db2.gz DWKVUPLQGPFYPP-NXEZZACHSA-N 1 2 236.290 2.104 20 0 BEADLO C[C@@H]1C[N@@H+](CC(=O)Nc2ccccc2F)[C@@H]1C ZINC000334454000 386102434 /nfs/dbraw/zinc/10/24/34/386102434.db2.gz DWKVUPLQGPFYPP-NXEZZACHSA-N 1 2 236.290 2.104 20 0 BEADLO CC(C)=CCSc1[nH+]cnc2c1cnn2C ZINC000295897247 386103137 /nfs/dbraw/zinc/10/31/37/386103137.db2.gz DVMYJTOKTIFIFM-UHFFFAOYSA-N 1 2 234.328 2.422 20 0 BEADLO CC(C)[N@H+](Cc1ccc(Cl)nc1)C1COC1 ZINC000295950416 386110531 /nfs/dbraw/zinc/11/05/31/386110531.db2.gz HANJRMCUWOGEDB-UHFFFAOYSA-N 1 2 240.734 2.344 20 0 BEADLO CC(C)[N@@H+](Cc1ccc(Cl)nc1)C1COC1 ZINC000295950416 386110536 /nfs/dbraw/zinc/11/05/36/386110536.db2.gz HANJRMCUWOGEDB-UHFFFAOYSA-N 1 2 240.734 2.344 20 0 BEADLO C/C=C/C[C@H](CO)Nc1cc[nH+]c(C2CC2)n1 ZINC000274518117 386113595 /nfs/dbraw/zinc/11/35/95/386113595.db2.gz WALMVFCUEYDCKC-KXMPLOMGSA-N 1 2 233.315 2.093 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)NCC(C)C ZINC000287413991 386118650 /nfs/dbraw/zinc/11/86/50/386118650.db2.gz FIZWSGYHSBMHHR-UHFFFAOYSA-N 1 2 221.304 2.476 20 0 BEADLO CCc1cnccc1[C@@H](C)[NH2+]Cc1csnn1 ZINC000345208894 386060108 /nfs/dbraw/zinc/06/01/08/386060108.db2.gz FOEGETFSPYHGFZ-SECBINFHSA-N 1 2 248.355 2.346 20 0 BEADLO c1nnc(NCCCCNc2cccc[nH+]2)s1 ZINC000295609448 386060946 /nfs/dbraw/zinc/06/09/46/386060946.db2.gz VEUQTWOJAYWCFE-UHFFFAOYSA-N 1 2 249.343 2.237 20 0 BEADLO Cc1nocc1C[N@H+]1CC[C@H](C)C[C@H]1C(N)=O ZINC000334444050 386064709 /nfs/dbraw/zinc/06/47/09/386064709.db2.gz MTOIEHMYEXCDMA-KWQFWETISA-N 1 2 237.303 2.119 20 0 BEADLO Cc1nocc1C[N@@H+]1CC[C@H](C)C[C@H]1C(N)=O ZINC000334444050 386064715 /nfs/dbraw/zinc/06/47/15/386064715.db2.gz MTOIEHMYEXCDMA-KWQFWETISA-N 1 2 237.303 2.119 20 0 BEADLO Cc1[nH]c(C(=O)NC(C2CCC2)C2CCC2)c[nH+]1 ZINC000286713080 386069678 /nfs/dbraw/zinc/06/96/78/386069678.db2.gz LCIDZPBMJXMNCK-UHFFFAOYSA-N 1 2 247.342 2.417 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000274583748 386122337 /nfs/dbraw/zinc/12/23/37/386122337.db2.gz FYVQLBQVMRNHRY-OBIHZWKSSA-N 1 2 249.358 2.380 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c(C)s1 ZINC000334445545 386078132 /nfs/dbraw/zinc/07/81/32/386078132.db2.gz JLPZIKBPQMGZDO-DTORHVGOSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c(C)s1 ZINC000334445545 386078137 /nfs/dbraw/zinc/07/81/37/386078137.db2.gz JLPZIKBPQMGZDO-DTORHVGOSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1ccc(NC(=O)c2cncs2)c(C)[nH+]1 ZINC000334446009 386079148 /nfs/dbraw/zinc/07/91/48/386079148.db2.gz PBHHIIULVWAVIK-UHFFFAOYSA-N 1 2 233.296 2.407 20 0 BEADLO Cn1nccc1CC[N@@H+]1CCCC[C@H]1C(F)F ZINC000338635656 386081205 /nfs/dbraw/zinc/08/12/05/386081205.db2.gz FOOLMSPLIIJBDS-NSHDSACASA-N 1 2 243.301 2.082 20 0 BEADLO Cn1nccc1CC[N@H+]1CCCC[C@H]1C(F)F ZINC000338635656 386081208 /nfs/dbraw/zinc/08/12/08/386081208.db2.gz FOOLMSPLIIJBDS-NSHDSACASA-N 1 2 243.301 2.082 20 0 BEADLO CCOC(=O)CCCC[N@@H+]1CCC(F)(F)C1 ZINC000345840694 386122742 /nfs/dbraw/zinc/12/27/42/386122742.db2.gz RHZLZKACAUTESR-UHFFFAOYSA-N 1 2 235.274 2.061 20 0 BEADLO CCOC(=O)CCCC[N@H+]1CCC(F)(F)C1 ZINC000345840694 386122744 /nfs/dbraw/zinc/12/27/44/386122744.db2.gz RHZLZKACAUTESR-UHFFFAOYSA-N 1 2 235.274 2.061 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@H](n3cccn3)C2)o1 ZINC000334450454 386089626 /nfs/dbraw/zinc/08/96/26/386089626.db2.gz TVJULFVENHJDJD-LBPRGKRZSA-N 1 2 246.314 2.017 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@H](n3cccn3)C2)o1 ZINC000334450454 386089632 /nfs/dbraw/zinc/08/96/32/386089632.db2.gz TVJULFVENHJDJD-LBPRGKRZSA-N 1 2 246.314 2.017 20 0 BEADLO CC(C)n1cc(CNc2cc[nH+]cc2F)nn1 ZINC000287030640 386092879 /nfs/dbraw/zinc/09/28/79/386092879.db2.gz VZAAEXHDELVBDW-UHFFFAOYSA-N 1 2 235.266 2.005 20 0 BEADLO CCC1(NC(=O)CCc2c[nH+]cn2C)CCCC1 ZINC000295844987 386095017 /nfs/dbraw/zinc/09/50/17/386095017.db2.gz DFSPRVOXLFXIAU-UHFFFAOYSA-N 1 2 249.358 2.192 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000274761745 386146685 /nfs/dbraw/zinc/14/66/85/386146685.db2.gz NOIUYGWLFIENJL-MBNYWOFBSA-N 1 2 249.358 2.070 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C[C@H]1C=CCCC1 ZINC000275206413 386189984 /nfs/dbraw/zinc/18/99/84/386189984.db2.gz ZGAUKJWJEKUKQT-NSHDSACASA-N 1 2 233.315 2.081 20 0 BEADLO CC1(C)CCC[C@H](C(=O)NCc2c[nH+]c[nH]2)C1 ZINC000334476692 386159837 /nfs/dbraw/zinc/15/98/37/386159837.db2.gz PAAVLYZWTUMUEH-JTQLQIEISA-N 1 2 235.331 2.242 20 0 BEADLO CC1(C)CCC[C@H](C(=O)NCc2c[nH]c[nH+]2)C1 ZINC000334476692 386159845 /nfs/dbraw/zinc/15/98/45/386159845.db2.gz PAAVLYZWTUMUEH-JTQLQIEISA-N 1 2 235.331 2.242 20 0 BEADLO CCOc1cccc([C@@H](C)[NH2+]Cc2cnn[nH]2)c1 ZINC000296341204 386163891 /nfs/dbraw/zinc/16/38/91/386163891.db2.gz QFBWJTXVEQIDJG-SNVBAGLBSA-N 1 2 246.314 2.054 20 0 BEADLO CCOc1cccc([C@@H](C)[NH2+]Cc2c[nH]nn2)c1 ZINC000296341204 386163897 /nfs/dbraw/zinc/16/38/97/386163897.db2.gz QFBWJTXVEQIDJG-SNVBAGLBSA-N 1 2 246.314 2.054 20 0 BEADLO CC(C)(CNC(=O)CCc1[nH]cc[nH+]1)C1CCC1 ZINC000296494966 386179897 /nfs/dbraw/zinc/17/98/97/386179897.db2.gz SNFIESLIYMEDKJ-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO CC1(C(=O)Nc2ccn3cc[nH+]c3c2)CCC1 ZINC000288296321 386182666 /nfs/dbraw/zinc/18/26/66/386182666.db2.gz BYPPDAGCXIUTAK-UHFFFAOYSA-N 1 2 229.283 2.463 20 0 BEADLO CC(C)=CC(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000263852874 386183527 /nfs/dbraw/zinc/18/35/27/386183527.db2.gz YKUMZDHKCGXVNV-UHFFFAOYSA-N 1 2 233.315 2.013 20 0 BEADLO COC(=O)CCCNc1cc(C)[nH+]c(C2CC2)n1 ZINC000296564013 386183941 /nfs/dbraw/zinc/18/39/41/386183941.db2.gz PUXASRXJAYLDRB-UHFFFAOYSA-N 1 2 249.314 2.028 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)[C@H]1CCCC1(C)C ZINC000274584968 386124440 /nfs/dbraw/zinc/12/44/40/386124440.db2.gz GDWBLYUAIOUZSH-NWDGAFQWSA-N 1 2 249.358 2.214 20 0 BEADLO Cc1n[nH]cc1NC(=O)Nc1c(C)cc[nH+]c1C ZINC000287484128 386125077 /nfs/dbraw/zinc/12/50/77/386125077.db2.gz KJJDTEVHDJKWCK-UHFFFAOYSA-N 1 2 245.286 2.374 20 0 BEADLO Cc1ccc(F)c(C[N@@H+]2CCOCC23CC3)c1 ZINC000334460581 386125223 /nfs/dbraw/zinc/12/52/23/386125223.db2.gz NJDKYIVAFLCNPK-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1ccc(F)c(C[N@H+]2CCOCC23CC3)c1 ZINC000334460581 386125227 /nfs/dbraw/zinc/12/52/27/386125227.db2.gz NJDKYIVAFLCNPK-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H]2CCC(C)(C)C2)c[nH+]1 ZINC000334463218 386130216 /nfs/dbraw/zinc/13/02/16/386130216.db2.gz RFZDZRQIHCTLQV-VIFPVBQESA-N 1 2 221.304 2.027 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H](C)CF ZINC000287508403 386130541 /nfs/dbraw/zinc/13/05/41/386130541.db2.gz LZQPDVZXGIRMAN-MRVPVSSYSA-N 1 2 225.267 2.178 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@@H](CO)c2ccccc2)no1 ZINC000264011139 386202418 /nfs/dbraw/zinc/20/24/18/386202418.db2.gz IUIZALIDYATHII-AWEZNQCLSA-N 1 2 246.310 2.148 20 0 BEADLO Cc1cc(C[N@H+](C)[C@@H](CO)c2ccccc2)no1 ZINC000264011139 386202422 /nfs/dbraw/zinc/20/24/22/386202422.db2.gz IUIZALIDYATHII-AWEZNQCLSA-N 1 2 246.310 2.148 20 0 BEADLO Cn1cccc1C[NH2+]Cc1noc2c1CCCC2 ZINC000288459120 386203726 /nfs/dbraw/zinc/20/37/26/386203726.db2.gz NSXZOKXRHZLBPS-UHFFFAOYSA-N 1 2 245.326 2.182 20 0 BEADLO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1ncc[nH]1 ZINC000288470327 386204975 /nfs/dbraw/zinc/20/49/75/386204975.db2.gz FRYXJBYILFTCNU-NOZJJQNGSA-N 1 2 229.283 2.022 20 0 BEADLO CC(C)C(C)(C)CNC(=O)CCn1cc[nH+]c1 ZINC000275562429 386222777 /nfs/dbraw/zinc/22/27/77/386222777.db2.gz BHDXTOYOWHLENE-UHFFFAOYSA-N 1 2 237.347 2.072 20 0 BEADLO Cc1ccnc(CNc2cc[nH+]c(C)n2)c1 ZINC000292667260 386225792 /nfs/dbraw/zinc/22/57/92/386225792.db2.gz CUTSNWCGEXXGSG-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@H](C)OC(C)(C)C2)cn1 ZINC000414382362 386226826 /nfs/dbraw/zinc/22/68/26/386226826.db2.gz OTHQDVJPJWBFTF-NSHDSACASA-N 1 2 249.358 2.038 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@H](C)OC(C)(C)C2)cn1 ZINC000414382362 386226830 /nfs/dbraw/zinc/22/68/30/386226830.db2.gz OTHQDVJPJWBFTF-NSHDSACASA-N 1 2 249.358 2.038 20 0 BEADLO FC(F)(F)[C@H](N[C@H]1CCn2cc[nH+]c21)C1CC1 ZINC000297239835 386234512 /nfs/dbraw/zinc/23/45/12/386234512.db2.gz ILVWAKZIRCCXTL-DTWKUNHWSA-N 1 2 245.248 2.258 20 0 BEADLO CCC1(C)C[NH+](Cc2c(Cl)cnn2C)C1 ZINC000297448187 386256809 /nfs/dbraw/zinc/25/68/09/386256809.db2.gz QGGKDQGKMBJSMZ-UHFFFAOYSA-N 1 2 227.739 2.305 20 0 BEADLO CCc1ccc(C[N@H+]2CCOC[C@H]2CC)nc1 ZINC000338997295 386196945 /nfs/dbraw/zinc/19/69/45/386196945.db2.gz NATKRKOUCHFBGO-CQSZACIVSA-N 1 2 234.343 2.255 20 0 BEADLO CCc1ccc(C[N@@H+]2CCOC[C@H]2CC)nc1 ZINC000338997295 386196953 /nfs/dbraw/zinc/19/69/53/386196953.db2.gz NATKRKOUCHFBGO-CQSZACIVSA-N 1 2 234.343 2.255 20 0 BEADLO CCc1ccc(C[N@H+]2CCOC[C@@H]2CC)nc1 ZINC000338997294 386198869 /nfs/dbraw/zinc/19/88/69/386198869.db2.gz NATKRKOUCHFBGO-AWEZNQCLSA-N 1 2 234.343 2.255 20 0 BEADLO CCc1ccc(C[N@@H+]2CCOC[C@@H]2CC)nc1 ZINC000338997294 386198872 /nfs/dbraw/zinc/19/88/72/386198872.db2.gz NATKRKOUCHFBGO-AWEZNQCLSA-N 1 2 234.343 2.255 20 0 BEADLO CC(C)[C@H](C)N(C)C(=O)c1ccc2[nH+]ccn2c1 ZINC000263995798 386199483 /nfs/dbraw/zinc/19/94/83/386199483.db2.gz IVRGAOMKDNWOKM-NSHDSACASA-N 1 2 245.326 2.451 20 0 BEADLO CC(C)c1cc(N2CC(C)(O)C2)nc(C(C)C)[nH+]1 ZINC000276166182 386280488 /nfs/dbraw/zinc/28/04/88/386280488.db2.gz GQGZIKJEBUGKGY-UHFFFAOYSA-N 1 2 249.358 2.294 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H](C)CCC(C)C)c[nH+]1 ZINC000264889167 386281247 /nfs/dbraw/zinc/28/12/47/386281247.db2.gz VAVJFICSZSQDDM-SECBINFHSA-N 1 2 223.320 2.273 20 0 BEADLO CSCCC[N@H+](C)Cc1nnc(C(C)C)o1 ZINC000336663229 386282458 /nfs/dbraw/zinc/28/24/58/386282458.db2.gz AVWHYNRKRXBYQA-UHFFFAOYSA-N 1 2 243.376 2.378 20 0 BEADLO CSCCC[N@@H+](C)Cc1nnc(C(C)C)o1 ZINC000336663229 386282462 /nfs/dbraw/zinc/28/24/62/386282462.db2.gz AVWHYNRKRXBYQA-UHFFFAOYSA-N 1 2 243.376 2.378 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc(F)cn1 ZINC000276198798 386283400 /nfs/dbraw/zinc/28/34/00/386283400.db2.gz DYVSPBPIMLUREQ-GWCFXTLKSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(F)cn1 ZINC000276198798 386283402 /nfs/dbraw/zinc/28/34/02/386283402.db2.gz DYVSPBPIMLUREQ-GWCFXTLKSA-N 1 2 238.306 2.220 20 0 BEADLO COCc1nc(C[N@@H+]2CCC=C(C)C2)cs1 ZINC000336663313 386285282 /nfs/dbraw/zinc/28/52/82/386285282.db2.gz BMBNGPXPUPVRLT-UHFFFAOYSA-N 1 2 238.356 2.442 20 0 BEADLO COCc1nc(C[N@H+]2CCC=C(C)C2)cs1 ZINC000336663313 386285288 /nfs/dbraw/zinc/28/52/88/386285288.db2.gz BMBNGPXPUPVRLT-UHFFFAOYSA-N 1 2 238.356 2.442 20 0 BEADLO CC/C=C/CNC(=O)Nc1cc[nH+]cc1C ZINC000297915049 386286876 /nfs/dbraw/zinc/28/68/76/386286876.db2.gz YTEKKVNLZHPWTE-SNAWJCMRSA-N 1 2 219.288 2.478 20 0 BEADLO F[C@@H]1CCC[N@H+](Cc2cnc(C3CC3)o2)C1 ZINC000628326466 386290441 /nfs/dbraw/zinc/29/04/41/386290441.db2.gz HZQNAGGQSKMGRE-SNVBAGLBSA-N 1 2 224.279 2.486 20 0 BEADLO F[C@@H]1CCC[N@@H+](Cc2cnc(C3CC3)o2)C1 ZINC000628326466 386290448 /nfs/dbraw/zinc/29/04/48/386290448.db2.gz HZQNAGGQSKMGRE-SNVBAGLBSA-N 1 2 224.279 2.486 20 0 BEADLO CC(C)(C)CCC(=O)Nc1ccc(N)[nH+]c1 ZINC000236597358 386290654 /nfs/dbraw/zinc/29/06/54/386290654.db2.gz JUENDQIHGAXUCY-UHFFFAOYSA-N 1 2 221.304 2.429 20 0 BEADLO CCO[C@H](C)C(=O)Nc1cc[nH+]cc1CC ZINC000265010820 386293817 /nfs/dbraw/zinc/29/38/17/386293817.db2.gz OLRQOKOHVNPOBV-SECBINFHSA-N 1 2 222.288 2.008 20 0 BEADLO CCO[C@@H](C)C(=O)Nc1cc[nH+]cc1CC ZINC000265010822 386295225 /nfs/dbraw/zinc/29/52/25/386295225.db2.gz OLRQOKOHVNPOBV-VIFPVBQESA-N 1 2 222.288 2.008 20 0 BEADLO C[C@H]([NH2+][C@H]1/C=C/CCCCC1)c1ncn(C)n1 ZINC000334480530 386295998 /nfs/dbraw/zinc/29/59/98/386295998.db2.gz VDKZOMHBZJFHBX-BIVWETNQSA-N 1 2 234.347 2.355 20 0 BEADLO COc1cnccc1[C@H](C)[NH2+]Cc1cc(C)on1 ZINC000187068117 386297177 /nfs/dbraw/zinc/29/71/77/386297177.db2.gz WNKIVVUKCLIMSF-JTQLQIEISA-N 1 2 247.298 2.237 20 0 BEADLO Cc1nonc1C[NH2+]C(C)(C)c1ccccc1 ZINC000265025989 386298016 /nfs/dbraw/zinc/29/80/16/386298016.db2.gz DUWRWNDBTPOFTP-UHFFFAOYSA-N 1 2 231.299 2.403 20 0 BEADLO Clc1ccc2c(c1)[C@H](NCc1[nH]cc[nH+]1)CO2 ZINC000334481354 386301684 /nfs/dbraw/zinc/30/16/84/386301684.db2.gz WGULFEHHPVHWOY-SNVBAGLBSA-N 1 2 249.701 2.286 20 0 BEADLO Clc1ccc2c(c1)[C@H]([NH2+]Cc1ncc[nH]1)CO2 ZINC000334481354 386301688 /nfs/dbraw/zinc/30/16/88/386301688.db2.gz WGULFEHHPVHWOY-SNVBAGLBSA-N 1 2 249.701 2.286 20 0 BEADLO CCn1c[nH+]cc1CN=c1cc(C(C)(C)C)o[nH]1 ZINC000416426973 386302960 /nfs/dbraw/zinc/30/29/60/386302960.db2.gz ODZIWGDDDLOADV-UHFFFAOYSA-N 1 2 248.330 2.223 20 0 BEADLO Cc1cc(C[N@H+](C)CCC(F)(F)F)nn1C ZINC000336672312 386303604 /nfs/dbraw/zinc/30/36/04/386303604.db2.gz JZOBKQYJEGNKHG-UHFFFAOYSA-N 1 2 235.253 2.113 20 0 BEADLO Cc1cc(C[N@@H+](C)CCC(F)(F)F)nn1C ZINC000336672312 386303605 /nfs/dbraw/zinc/30/36/05/386303605.db2.gz JZOBKQYJEGNKHG-UHFFFAOYSA-N 1 2 235.253 2.113 20 0 BEADLO Cc1ccc(OCc2c[nH+]cn2C)cc1F ZINC000226439144 386305132 /nfs/dbraw/zinc/30/51/32/386305132.db2.gz IRQOIYYIOHLQQA-UHFFFAOYSA-N 1 2 220.247 2.447 20 0 BEADLO Cc1occc1SCC[N@@H+]1CCO[C@@H](C)C1 ZINC000298177912 386306201 /nfs/dbraw/zinc/30/62/01/386306201.db2.gz GJNADJFZHOLFDU-JTQLQIEISA-N 1 2 241.356 2.401 20 0 BEADLO Cc1occc1SCC[N@H+]1CCO[C@@H](C)C1 ZINC000298177912 386306207 /nfs/dbraw/zinc/30/62/07/386306207.db2.gz GJNADJFZHOLFDU-JTQLQIEISA-N 1 2 241.356 2.401 20 0 BEADLO COC[C@H]([NH2+]Cc1[nH]ncc1C)c1ccccc1 ZINC000289441602 386307545 /nfs/dbraw/zinc/30/75/45/386307545.db2.gz FZULVQCPIBOCOW-AWEZNQCLSA-N 1 2 245.326 2.195 20 0 BEADLO COC[C@H]([NH2+]Cc1n[nH]cc1C)c1ccccc1 ZINC000289441602 386307551 /nfs/dbraw/zinc/30/75/51/386307551.db2.gz FZULVQCPIBOCOW-AWEZNQCLSA-N 1 2 245.326 2.195 20 0 BEADLO CC[C@H](NC(=O)c1c[nH+]c(C)[nH]1)C(C)(C)C ZINC000339224739 386308471 /nfs/dbraw/zinc/30/84/71/386308471.db2.gz CMGXRLLEFRMALF-JTQLQIEISA-N 1 2 223.320 2.273 20 0 BEADLO CSC[C@H]1CCCN1c1cc(C)[nH+]cn1 ZINC000133340922 386309056 /nfs/dbraw/zinc/30/90/56/386309056.db2.gz BQWRUGLBJJCPGE-SNVBAGLBSA-N 1 2 223.345 2.117 20 0 BEADLO Cc1nonc1C[N@@H+](Cc1ccco1)C(C)C ZINC000265143597 386310276 /nfs/dbraw/zinc/31/02/76/386310276.db2.gz QVSQIBHGNRZRTI-UHFFFAOYSA-N 1 2 235.287 2.382 20 0 BEADLO Cc1nonc1C[N@H+](Cc1ccco1)C(C)C ZINC000265143597 386310283 /nfs/dbraw/zinc/31/02/83/386310283.db2.gz QVSQIBHGNRZRTI-UHFFFAOYSA-N 1 2 235.287 2.382 20 0 BEADLO Cc1[nH+]cccc1Cc1noc(C(C)C)n1 ZINC000335260799 386317333 /nfs/dbraw/zinc/31/73/33/386317333.db2.gz YKPXMJHCQJQWEK-UHFFFAOYSA-N 1 2 217.272 2.487 20 0 BEADLO Cc1noc([C@@H]2CCC[N@@H+]2Cc2ccco2)n1 ZINC000289140257 386265497 /nfs/dbraw/zinc/26/54/97/386265497.db2.gz AGJMXADHKKPKMO-NSHDSACASA-N 1 2 233.271 2.308 20 0 BEADLO Cc1noc([C@@H]2CCC[N@H+]2Cc2ccco2)n1 ZINC000289140257 386265503 /nfs/dbraw/zinc/26/55/03/386265503.db2.gz AGJMXADHKKPKMO-NSHDSACASA-N 1 2 233.271 2.308 20 0 BEADLO Cc1nnc(C[N@@H+](C)[C@H](C)c2cccc(O)c2)o1 ZINC000264732088 386267784 /nfs/dbraw/zinc/26/77/84/386267784.db2.gz RFOOBTUBHUOKEG-SECBINFHSA-N 1 2 247.298 2.277 20 0 BEADLO Cc1nnc(C[N@H+](C)[C@H](C)c2cccc(O)c2)o1 ZINC000264732088 386267788 /nfs/dbraw/zinc/26/77/88/386267788.db2.gz RFOOBTUBHUOKEG-SECBINFHSA-N 1 2 247.298 2.277 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H](C)Cc2cccs2)c[nH+]1 ZINC000264856598 386274925 /nfs/dbraw/zinc/27/49/25/386274925.db2.gz OEVYJGMFGPMBLD-QMMMGPOBSA-N 1 2 249.339 2.141 20 0 BEADLO CCOCCOC1C[NH+](Cc2cccc(C)c2)C1 ZINC000297780555 386277504 /nfs/dbraw/zinc/27/75/04/386277504.db2.gz WEGGQDZYQMLDLU-UHFFFAOYSA-N 1 2 249.354 2.232 20 0 BEADLO CCOc1ncccc1C[NH2+]Cc1conc1C ZINC000339180550 386277486 /nfs/dbraw/zinc/27/74/86/386277486.db2.gz CZERSWQDAZOXMV-UHFFFAOYSA-N 1 2 247.298 2.067 20 0 BEADLO Cn1c[nH+]cc1CCC(=O)N[C@H]1CCC(C)(C)C1 ZINC000339175858 386278875 /nfs/dbraw/zinc/27/88/75/386278875.db2.gz IPPABVMDLKTZPE-NSHDSACASA-N 1 2 249.358 2.048 20 0 BEADLO COC1CC[NH+]([C@@H](C)c2nnc(C)s2)CC1 ZINC000347350954 386345837 /nfs/dbraw/zinc/34/58/37/386345837.db2.gz QVMHTWZYGLCQRV-QMMMGPOBSA-N 1 2 241.360 2.018 20 0 BEADLO CCCCCCC(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000298497762 386351305 /nfs/dbraw/zinc/35/13/05/386351305.db2.gz YEGCCUXXRBPMSF-LBPRGKRZSA-N 1 2 237.347 2.358 20 0 BEADLO CC[C@@H](COC)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000265603919 386351849 /nfs/dbraw/zinc/35/18/49/386351849.db2.gz SOMGFPLSRKFTJK-NSHDSACASA-N 1 2 235.331 2.499 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)[C@H]1C[C@@H]1C1CC1 ZINC000334492569 386353847 /nfs/dbraw/zinc/35/38/47/386353847.db2.gz ONUKLYDXLCMYDA-MNOVXSKESA-N 1 2 241.294 2.319 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ncnn1C)c1cccc(F)c1 ZINC000276624739 386354354 /nfs/dbraw/zinc/35/43/54/386354354.db2.gz NFWCENJVCWHOHH-ZJUUUORDSA-N 1 2 248.305 2.366 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1csc(C(C)C)n1 ZINC000339286924 386356415 /nfs/dbraw/zinc/35/64/15/386356415.db2.gz WBZAAINPQQKLML-LLVKDONJSA-N 1 2 240.372 2.487 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1csc(C(C)C)n1 ZINC000339286924 386356418 /nfs/dbraw/zinc/35/64/18/386356418.db2.gz WBZAAINPQQKLML-LLVKDONJSA-N 1 2 240.372 2.487 20 0 BEADLO Cc1ccnc(C[N@H+]2CC[C@H](OCC(C)C)C2)n1 ZINC000336690483 386357553 /nfs/dbraw/zinc/35/75/53/386357553.db2.gz BSIVRGWTMWZWEU-ZDUSSCGKSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1ccnc(C[N@@H+]2CC[C@H](OCC(C)C)C2)n1 ZINC000336690483 386357558 /nfs/dbraw/zinc/35/75/58/386357558.db2.gz BSIVRGWTMWZWEU-ZDUSSCGKSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2cnn(C)n2)cc1 ZINC000290054313 386386834 /nfs/dbraw/zinc/38/68/34/386386834.db2.gz SAMYCHPQLDPHRM-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2cnn(C)n2)cc1 ZINC000290054313 386386840 /nfs/dbraw/zinc/38/68/40/386386840.db2.gz SAMYCHPQLDPHRM-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO C[C@@H]([NH2+][C@@H](c1nnc[nH]1)c1ccccc1)C1CC1 ZINC000276702621 386364701 /nfs/dbraw/zinc/36/47/01/386364701.db2.gz BPJTYKBPZILBKZ-ZWNOBZJWSA-N 1 2 242.326 2.282 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC(F)(F)[C@H](C)C2)o1 ZINC000289934151 386373610 /nfs/dbraw/zinc/37/36/10/386373610.db2.gz UZHXJKOZLNBRJN-MRVPVSSYSA-N 1 2 230.258 2.460 20 0 BEADLO Cc1cnc(C[N@H+]2CCC(F)(F)[C@H](C)C2)o1 ZINC000289934151 386373616 /nfs/dbraw/zinc/37/36/16/386373616.db2.gz UZHXJKOZLNBRJN-MRVPVSSYSA-N 1 2 230.258 2.460 20 0 BEADLO CC[C@H]1CCC[C@H](NC(=O)CCn2cc[nH+]c2)C1 ZINC000265826985 386375282 /nfs/dbraw/zinc/37/52/82/386375282.db2.gz VKNDRQYSPRRVDK-STQMWFEESA-N 1 2 249.358 2.358 20 0 BEADLO C[N@H+](Cc1ccsc1)Cc1ccon1 ZINC000265829633 386375356 /nfs/dbraw/zinc/37/53/56/386375356.db2.gz KKWYNWLTYGBRBM-UHFFFAOYSA-N 1 2 208.286 2.368 20 0 BEADLO C[N@@H+](Cc1ccsc1)Cc1ccon1 ZINC000265829633 386375363 /nfs/dbraw/zinc/37/53/63/386375363.db2.gz KKWYNWLTYGBRBM-UHFFFAOYSA-N 1 2 208.286 2.368 20 0 BEADLO CCCc1nc(C[N@@H+]2CCC[C@@H]2CC)no1 ZINC000336696969 386378719 /nfs/dbraw/zinc/37/87/19/386378719.db2.gz HRNNRYPFXSMESS-JTQLQIEISA-N 1 2 223.320 2.397 20 0 BEADLO CCCc1nc(C[N@H+]2CCC[C@@H]2CC)no1 ZINC000336696969 386378722 /nfs/dbraw/zinc/37/87/22/386378722.db2.gz HRNNRYPFXSMESS-JTQLQIEISA-N 1 2 223.320 2.397 20 0 BEADLO CC[C@H]1CCC[N@@H+]1Cc1noc(C2CC2)n1 ZINC000336696806 386379091 /nfs/dbraw/zinc/37/90/91/386379091.db2.gz GZLLQEMKKACEBI-JTQLQIEISA-N 1 2 221.304 2.321 20 0 BEADLO CC[C@H]1CCC[N@H+]1Cc1noc(C2CC2)n1 ZINC000336696806 386379095 /nfs/dbraw/zinc/37/90/95/386379095.db2.gz GZLLQEMKKACEBI-JTQLQIEISA-N 1 2 221.304 2.321 20 0 BEADLO C[C@@H](C(=O)OC(C)(C)C)[N@@H+]1CC[C@@](C)(F)C1 ZINC000347395711 386382694 /nfs/dbraw/zinc/38/26/94/386382694.db2.gz SXPNREUBPYDCQF-JOYOIKCWSA-N 1 2 231.311 2.151 20 0 BEADLO C[C@@H](C(=O)OC(C)(C)C)[N@H+]1CC[C@@](C)(F)C1 ZINC000347395711 386382696 /nfs/dbraw/zinc/38/26/96/386382696.db2.gz SXPNREUBPYDCQF-JOYOIKCWSA-N 1 2 231.311 2.151 20 0 BEADLO CC1(C)CCC(NC(=O)CCn2cc[nH+]c2)CC1 ZINC000265937486 386384606 /nfs/dbraw/zinc/38/46/06/386384606.db2.gz SCUDMPLNWBIOTI-UHFFFAOYSA-N 1 2 249.358 2.358 20 0 BEADLO C/C=C(\CC)C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000276490448 386332313 /nfs/dbraw/zinc/33/23/13/386332313.db2.gz URMLVBDGJAZXLJ-NDZKXSSTSA-N 1 2 247.342 2.472 20 0 BEADLO COC(=O)[C@@H]([NH2+]CCc1ccc(C)cc1)C1CC1 ZINC000276491832 386333628 /nfs/dbraw/zinc/33/36/28/386333628.db2.gz VNWAILKZVFSPEJ-AWEZNQCLSA-N 1 2 247.338 2.079 20 0 BEADLO C[C@H]1SCC[C@@H]1Nc1cc[nH+]c2ccncc12 ZINC000645402922 386439176 /nfs/dbraw/zinc/43/91/76/386439176.db2.gz VFRGOICKBPOHFN-KOLCDFICSA-N 1 2 245.351 2.358 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H](C)c1cc[nH]c(=O)c1 ZINC000645485614 386440330 /nfs/dbraw/zinc/44/03/30/386440330.db2.gz JHPYSICEEGGEBC-IUCAKERBSA-N 1 2 246.314 2.231 20 0 BEADLO CC(C)[N@H+](Cc1cnns1)Cc1cccnc1 ZINC000336718265 386440365 /nfs/dbraw/zinc/44/03/65/386440365.db2.gz QYYQAWMKVPCIDN-UHFFFAOYSA-N 1 2 248.355 2.344 20 0 BEADLO CC(C)[N@@H+](Cc1cnns1)Cc1cccnc1 ZINC000336718265 386440372 /nfs/dbraw/zinc/44/03/72/386440372.db2.gz QYYQAWMKVPCIDN-UHFFFAOYSA-N 1 2 248.355 2.344 20 0 BEADLO Cc1ccc([C@@H](O)C[N@@H+](C)Cc2ccon2)cc1 ZINC000266525316 386446138 /nfs/dbraw/zinc/44/61/38/386446138.db2.gz JZMVGIHVFLEXMX-AWEZNQCLSA-N 1 2 246.310 2.148 20 0 BEADLO Cc1ccc([C@@H](O)C[N@H+](C)Cc2ccon2)cc1 ZINC000266525316 386446144 /nfs/dbraw/zinc/44/61/44/386446144.db2.gz JZMVGIHVFLEXMX-AWEZNQCLSA-N 1 2 246.310 2.148 20 0 BEADLO CCc1ncc(C[N@@H+]2CCO[C@](C)(CC)C2)cn1 ZINC000414434842 386447195 /nfs/dbraw/zinc/44/71/95/386447195.db2.gz MOGIDGBBMADIDZ-CQSZACIVSA-N 1 2 249.358 2.040 20 0 BEADLO CCc1ncc(C[N@H+]2CCO[C@](C)(CC)C2)cn1 ZINC000414434842 386447205 /nfs/dbraw/zinc/44/72/05/386447205.db2.gz MOGIDGBBMADIDZ-CQSZACIVSA-N 1 2 249.358 2.040 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000290543213 386449361 /nfs/dbraw/zinc/44/93/61/386449361.db2.gz WGMYFEPDWMDBTA-VIFPVBQESA-N 1 2 247.264 2.492 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000290543213 386449369 /nfs/dbraw/zinc/44/93/69/386449369.db2.gz WGMYFEPDWMDBTA-VIFPVBQESA-N 1 2 247.264 2.492 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000290543213 386449376 /nfs/dbraw/zinc/44/93/76/386449376.db2.gz WGMYFEPDWMDBTA-VIFPVBQESA-N 1 2 247.264 2.492 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000290543213 386449379 /nfs/dbraw/zinc/44/93/79/386449379.db2.gz WGMYFEPDWMDBTA-VIFPVBQESA-N 1 2 247.264 2.492 20 0 BEADLO COC(=O)C[N@H+]([C@H](C)c1ccccc1)C1CC1 ZINC000265981514 386388870 /nfs/dbraw/zinc/38/88/70/386388870.db2.gz FKCNTAFHRICVJA-LLVKDONJSA-N 1 2 233.311 2.385 20 0 BEADLO COC(=O)C[N@@H+]([C@H](C)c1ccccc1)C1CC1 ZINC000265981514 386388874 /nfs/dbraw/zinc/38/88/74/386388874.db2.gz FKCNTAFHRICVJA-LLVKDONJSA-N 1 2 233.311 2.385 20 0 BEADLO O=C(CCn1cc[nH+]c1)N1CCC[C@H]2CCC[C@@H]21 ZINC000266121151 386400669 /nfs/dbraw/zinc/40/06/69/386400669.db2.gz UJZZJSZOPVECJQ-OLZOCXBDSA-N 1 2 247.342 2.064 20 0 BEADLO CC(C)N(CC1CCC1)C(=O)CCc1[nH]cc[nH+]1 ZINC000299045462 386406504 /nfs/dbraw/zinc/40/65/04/386406504.db2.gz SKXBWBIZPGYSEE-UHFFFAOYSA-N 1 2 249.358 2.379 20 0 BEADLO CCCC(=O)NCc1cn2ccc(C)cc2[nH+]1 ZINC000048750323 386411393 /nfs/dbraw/zinc/41/13/93/386411393.db2.gz PJLCSXPGTMYGHB-UHFFFAOYSA-N 1 2 231.299 2.059 20 0 BEADLO Cc1occc1C[N@H+](C)Cc1ccno1 ZINC000299105947 386413919 /nfs/dbraw/zinc/41/39/19/386413919.db2.gz WLGTWHUYYUDUIN-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO Cc1occc1C[N@@H+](C)Cc1ccno1 ZINC000299105947 386413928 /nfs/dbraw/zinc/41/39/28/386413928.db2.gz WLGTWHUYYUDUIN-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO Cc1cnc(C[N@@H+](C)[C@@H](C)c2ccccn2)nc1 ZINC000336709580 386421403 /nfs/dbraw/zinc/42/14/03/386421403.db2.gz MCTZIACMIRSUAS-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cnc(C[N@H+](C)[C@@H](C)c2ccccn2)nc1 ZINC000336709580 386421405 /nfs/dbraw/zinc/42/14/05/386421405.db2.gz MCTZIACMIRSUAS-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cc(N[C@@H]2CCS[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000645402079 386427263 /nfs/dbraw/zinc/42/72/63/386427263.db2.gz NPDOOGXEOWCPRS-MWLCHTKSSA-N 1 2 249.383 2.390 20 0 BEADLO CC[S@](=O)Cc1[nH+]ccn1-c1ccccc1 ZINC000277426746 386432704 /nfs/dbraw/zinc/43/27/04/386432704.db2.gz FWFQUQCZXGYZIF-INIZCTEOSA-N 1 2 234.324 2.141 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1CCCS1 ZINC000266435451 386436619 /nfs/dbraw/zinc/43/66/19/386436619.db2.gz JWSMGIVNCSUPRX-JTQLQIEISA-N 1 2 222.313 2.224 20 0 BEADLO CC(C)Cc1noc(C[N@@H+]2C[C@H](C)[C@H]2C)n1 ZINC000339575504 386473271 /nfs/dbraw/zinc/47/32/71/386473271.db2.gz SJQWYFLOTQQTSK-VHSXEESVSA-N 1 2 223.320 2.108 20 0 BEADLO CC(C)Cc1noc(C[N@H+]2C[C@H](C)[C@H]2C)n1 ZINC000339575504 386473281 /nfs/dbraw/zinc/47/32/81/386473281.db2.gz SJQWYFLOTQQTSK-VHSXEESVSA-N 1 2 223.320 2.108 20 0 BEADLO CCN(C(=O)CCn1cc[nH+]c1)C1CCCCC1 ZINC000299656433 386478122 /nfs/dbraw/zinc/47/81/22/386478122.db2.gz OLEXQJIIXMVFIB-UHFFFAOYSA-N 1 2 249.358 2.454 20 0 BEADLO COc1ncncc1C[NH+]1CC2(C1)CCCCC2 ZINC000648042713 386485348 /nfs/dbraw/zinc/48/53/48/386485348.db2.gz PFKWOTKUMLDCSG-UHFFFAOYSA-N 1 2 247.342 2.251 20 0 BEADLO CC(C)(C)CCCC(=O)N1CCn2c[nH+]cc2C1 ZINC000290931926 386489875 /nfs/dbraw/zinc/48/98/75/386489875.db2.gz MRXWOKFSVBBPFN-UHFFFAOYSA-N 1 2 249.358 2.442 20 0 BEADLO CCCCCCC(=O)N1CCn2c[nH+]cc2C1 ZINC000290923475 386490264 /nfs/dbraw/zinc/49/02/64/386490264.db2.gz KZSXOSSGDKTJHT-UHFFFAOYSA-N 1 2 235.331 2.196 20 0 BEADLO CC[C@@H](C)CN(CC)C(=O)CCn1cc[nH+]c1 ZINC000267082846 386491597 /nfs/dbraw/zinc/49/15/97/386491597.db2.gz GUBLXLCWYBIZKC-GFCCVEGCSA-N 1 2 237.347 2.168 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C[C@@H](C)CC(C)C ZINC000267067934 386491634 /nfs/dbraw/zinc/49/16/34/386491634.db2.gz AVQYORAICHRBPZ-JTQLQIEISA-N 1 2 237.347 2.407 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C[C@H](C)C(C)C ZINC000267057842 386493075 /nfs/dbraw/zinc/49/30/75/386493075.db2.gz GENLHCWFGIWCRL-VIFPVBQESA-N 1 2 223.320 2.017 20 0 BEADLO Cc1c[nH+]ccc1CCNc1nccnc1C ZINC000290982219 386494814 /nfs/dbraw/zinc/49/48/14/386494814.db2.gz RRPPQNULWMYVEJ-UHFFFAOYSA-N 1 2 228.299 2.143 20 0 BEADLO Cc1ccnc(C[NH+]2CC(C)(C)OC(C)(C)C2)n1 ZINC000336783419 386507996 /nfs/dbraw/zinc/50/79/96/386507996.db2.gz NSVOXQMPGFPTSH-UHFFFAOYSA-N 1 2 249.358 2.174 20 0 BEADLO Cc1csc(SCc2c[nH+]cn2C)n1 ZINC000267202677 386508435 /nfs/dbraw/zinc/50/84/35/386508435.db2.gz QTMLQIWPXVMOBY-UHFFFAOYSA-N 1 2 225.342 2.477 20 0 BEADLO CC(C)(C)[C@H](O)CNc1cc[nH+]c2ccncc12 ZINC000267206177 386509973 /nfs/dbraw/zinc/50/99/73/386509973.db2.gz KPFGDZAXSCVICB-CYBMUJFWSA-N 1 2 245.326 2.449 20 0 BEADLO COC(=O)[C@@H]([NH2+]Cc1ccc(C)cc1)C1CC1 ZINC000227767165 386510951 /nfs/dbraw/zinc/51/09/51/386510951.db2.gz UMWWVOKVJFTLEP-ZDUSSCGKSA-N 1 2 233.311 2.036 20 0 BEADLO COC(=O)[C@H]([NH2+]Cc1ccccc1C)C1CC1 ZINC000227767736 386511198 /nfs/dbraw/zinc/51/11/98/386511198.db2.gz JWVIITRTKOTRTJ-CYBMUJFWSA-N 1 2 233.311 2.036 20 0 BEADLO Cc1nc(N2CCCCC[C@@H]2C[C@H](C)O)cc[nH+]1 ZINC000286516997 386517817 /nfs/dbraw/zinc/51/78/17/386517817.db2.gz ZIBRBAVRXWZBQC-WCQYABFASA-N 1 2 249.358 2.305 20 0 BEADLO CCC1(C(=O)N2CCC(c3[nH]cc[nH+]3)CC2)CC1 ZINC000267280561 386522477 /nfs/dbraw/zinc/52/24/77/386522477.db2.gz WBPCETDORHSSHE-UHFFFAOYSA-N 1 2 247.342 2.306 20 0 BEADLO CC[N@H+](CCO)Cc1nc(Cl)ccc1Cl ZINC000061630472 386523011 /nfs/dbraw/zinc/52/30/11/386523011.db2.gz WQFZATZPVDXGFA-UHFFFAOYSA-N 1 2 249.141 2.203 20 0 BEADLO CC[N@@H+](CCO)Cc1nc(Cl)ccc1Cl ZINC000061630472 386523016 /nfs/dbraw/zinc/52/30/16/386523016.db2.gz WQFZATZPVDXGFA-UHFFFAOYSA-N 1 2 249.141 2.203 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@H](C)c2ccncc2)nn1C ZINC000336724355 386457339 /nfs/dbraw/zinc/45/73/39/386457339.db2.gz ZXHDVEQLTILFQZ-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cc(C[N@H+](C)[C@H](C)c2ccncc2)nn1C ZINC000336724355 386457345 /nfs/dbraw/zinc/45/73/45/386457345.db2.gz ZXHDVEQLTILFQZ-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1nc(N2CC(C)(C)[C@H]2C2CC2)cc[nH+]1 ZINC000290629391 386462892 /nfs/dbraw/zinc/46/28/92/386462892.db2.gz GYWMZUKTICUPDI-GFCCVEGCSA-N 1 2 217.316 2.410 20 0 BEADLO Cc1cc(CC(=O)Nc2c(C)cc[nH+]c2C)no1 ZINC000335414865 386582843 /nfs/dbraw/zinc/58/28/43/386582843.db2.gz MGAWOOGVIGBOTR-UHFFFAOYSA-N 1 2 245.282 2.176 20 0 BEADLO Cn1c[nH+]cc1CSCC(=O)C(C)(C)C ZINC000267786620 386584074 /nfs/dbraw/zinc/58/40/74/386584074.db2.gz OWEMIIKHPTVEKU-UHFFFAOYSA-N 1 2 226.345 2.269 20 0 BEADLO CCCCC[C@H](C)NC(=O)Cc1[nH+]c[nH]c1C ZINC000278790578 386585221 /nfs/dbraw/zinc/58/52/21/386585221.db2.gz YLXHRVLXLIXQPY-JTQLQIEISA-N 1 2 237.347 2.346 20 0 BEADLO CC1(C(N)=O)C[NH+](Cc2ccc(Cl)o2)C1 ZINC000335423346 386596849 /nfs/dbraw/zinc/59/68/49/386596849.db2.gz LAQLQILZICAWQR-UHFFFAOYSA-N 1 2 228.679 2.290 20 0 BEADLO CCn1cc[nH+]c1CN1C[C@@H](C)OC2(CCC2)C1 ZINC000335461364 386542328 /nfs/dbraw/zinc/54/23/28/386542328.db2.gz HVMBQNBJHKHASW-GFCCVEGCSA-N 1 2 249.358 2.046 20 0 BEADLO CCn1ccnc1C[N@@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC000335461364 386542332 /nfs/dbraw/zinc/54/23/32/386542332.db2.gz HVMBQNBJHKHASW-GFCCVEGCSA-N 1 2 249.358 2.046 20 0 BEADLO CCn1ccnc1C[N@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC000335461364 386542334 /nfs/dbraw/zinc/54/23/34/386542334.db2.gz HVMBQNBJHKHASW-GFCCVEGCSA-N 1 2 249.358 2.046 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CCCC2(C)C)c[nH+]1 ZINC000267509298 386548071 /nfs/dbraw/zinc/54/80/71/386548071.db2.gz IFPZUVMPVBPPFI-SNVBAGLBSA-N 1 2 221.304 2.027 20 0 BEADLO Fc1ccc(F)c(CN2CCn3c[nH+]cc3C2)c1 ZINC000291481149 386551686 /nfs/dbraw/zinc/55/16/86/386551686.db2.gz FTMVBLHCLNXBCP-UHFFFAOYSA-N 1 2 249.264 2.177 20 0 BEADLO CCCc1occc1C(=O)Nc1cc[nH+]cc1O ZINC000336934173 386555120 /nfs/dbraw/zinc/55/51/20/386555120.db2.gz RZGBJOPNOJJMLF-UHFFFAOYSA-N 1 2 246.266 2.007 20 0 BEADLO Cc1ccc(F)c(CN2CCn3c[nH+]cc3C2)c1 ZINC000291539651 386556957 /nfs/dbraw/zinc/55/69/57/386556957.db2.gz LCZCCHFQWNUFOR-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO CN(Cc1c[nH+]cn1C)c1ccccc1F ZINC000267616918 386563671 /nfs/dbraw/zinc/56/36/71/386563671.db2.gz PIGNRZRJCLOARY-UHFFFAOYSA-N 1 2 219.263 2.196 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CC[C@@H](F)C1 ZINC000335407729 386569760 /nfs/dbraw/zinc/56/97/60/386569760.db2.gz QWPCNLSTHKCILE-SNVBAGLBSA-N 1 2 211.284 2.008 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CC[C@@H](F)C1 ZINC000335407729 386569763 /nfs/dbraw/zinc/56/97/63/386569763.db2.gz QWPCNLSTHKCILE-SNVBAGLBSA-N 1 2 211.284 2.008 20 0 BEADLO Cc1cccn2c(C[N@@H+]3CC[C@H](F)C3)cnc12 ZINC000335410099 386573977 /nfs/dbraw/zinc/57/39/77/386573977.db2.gz OEOVROCPODIXSP-NSHDSACASA-N 1 2 233.290 2.187 20 0 BEADLO Cc1cccn2c(C[N@H+]3CC[C@H](F)C3)cnc12 ZINC000335410099 386573983 /nfs/dbraw/zinc/57/39/83/386573983.db2.gz OEOVROCPODIXSP-NSHDSACASA-N 1 2 233.290 2.187 20 0 BEADLO Cc1cccn2c(CN3CC[C@H](F)C3)c[nH+]c12 ZINC000335410099 386573991 /nfs/dbraw/zinc/57/39/91/386573991.db2.gz OEOVROCPODIXSP-NSHDSACASA-N 1 2 233.290 2.187 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)CCCC1CC1 ZINC000644920176 386620579 /nfs/dbraw/zinc/62/05/79/386620579.db2.gz IOJKQJXJIIQXAV-UHFFFAOYSA-N 1 2 248.326 2.287 20 0 BEADLO CCC[C@H]1CCCN(C(=O)CCn2cc[nH+]c2)C1 ZINC000268147428 386625064 /nfs/dbraw/zinc/62/50/64/386625064.db2.gz VMBGXIOFLMWHDH-ZDUSSCGKSA-N 1 2 249.358 2.312 20 0 BEADLO Cc1ccc([S@](=O)Cc2c[nH+]cn2C)c(C)c1 ZINC000268141996 386626450 /nfs/dbraw/zinc/62/64/50/386626450.db2.gz CMVVLYUDKUSIDF-QGZVFWFLSA-N 1 2 248.351 2.345 20 0 BEADLO CCC[C@@H](C(=O)NCCc1[nH]cc[nH+]1)C(C)C ZINC000179267400 386630233 /nfs/dbraw/zinc/63/02/33/386630233.db2.gz IYYFMTSCNKARJJ-LLVKDONJSA-N 1 2 237.347 2.141 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1nn(C)cc1Cl ZINC000335503527 386631594 /nfs/dbraw/zinc/63/15/94/386631594.db2.gz NKRNIVAKQFRBFG-YUMQZZPRSA-N 1 2 213.712 2.056 20 0 BEADLO CCCCC[C@H](C)NC(=O)CCc1[nH]cc[nH+]1 ZINC000279110162 386632823 /nfs/dbraw/zinc/63/28/23/386632823.db2.gz BWVNDQGOHTZVGU-NSHDSACASA-N 1 2 237.347 2.427 20 0 BEADLO CC(C)n1nccc1C[N@H+](C)Cc1ccc[nH]1 ZINC000337179441 386636620 /nfs/dbraw/zinc/63/66/20/386636620.db2.gz LMEITDMKZCYEFB-UHFFFAOYSA-N 1 2 232.331 2.424 20 0 BEADLO CC(C)n1nccc1C[N@@H+](C)Cc1ccc[nH]1 ZINC000337179441 386636626 /nfs/dbraw/zinc/63/66/26/386636626.db2.gz LMEITDMKZCYEFB-UHFFFAOYSA-N 1 2 232.331 2.424 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@H](CF)C2)o1 ZINC000414470455 386640685 /nfs/dbraw/zinc/64/06/85/386640685.db2.gz LXEZRQAOIHYIRD-GFCCVEGCSA-N 1 2 227.279 2.012 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@H](CF)C2)o1 ZINC000414470455 386640689 /nfs/dbraw/zinc/64/06/89/386640689.db2.gz LXEZRQAOIHYIRD-GFCCVEGCSA-N 1 2 227.279 2.012 20 0 BEADLO C[C@@H](C1CC1)N(C(=O)CCc1[nH]cc[nH+]1)C1CC1 ZINC000279175512 386642565 /nfs/dbraw/zinc/64/25/65/386642565.db2.gz HOFKFYZNYAHMHD-JTQLQIEISA-N 1 2 247.342 2.132 20 0 BEADLO CC[C@H]1CCN1Cc1[nH+]ccn1CC(F)(F)F ZINC000292275202 386643945 /nfs/dbraw/zinc/64/39/45/386643945.db2.gz BJQJOJJECZLNGA-VIFPVBQESA-N 1 2 247.264 2.430 20 0 BEADLO CCCc1csc(C[N@H+](C)CCOC)n1 ZINC000426061051 386644331 /nfs/dbraw/zinc/64/43/31/386644331.db2.gz JNUHYXFXERRQNK-UHFFFAOYSA-N 1 2 228.361 2.174 20 0 BEADLO CCCc1csc(C[N@@H+](C)CCOC)n1 ZINC000426061051 386644335 /nfs/dbraw/zinc/64/43/35/386644335.db2.gz JNUHYXFXERRQNK-UHFFFAOYSA-N 1 2 228.361 2.174 20 0 BEADLO CCn1nccc1C(=O)Nc1c(C)cc[nH+]c1C ZINC000644972033 386646545 /nfs/dbraw/zinc/64/65/45/386646545.db2.gz LJJAXUVVVVHXRA-UHFFFAOYSA-N 1 2 244.298 2.167 20 0 BEADLO CC(C)([NH2+]CCF)c1cc(C(F)(F)F)on1 ZINC000336647200 386649825 /nfs/dbraw/zinc/64/98/25/386649825.db2.gz BPSLFBNZKZYURL-UHFFFAOYSA-N 1 2 240.200 2.488 20 0 BEADLO CCCCN(C(=O)CCc1[nH]cc[nH+]1)C1CC1 ZINC000279261245 386656291 /nfs/dbraw/zinc/65/62/91/386656291.db2.gz TYVTWYGHDQQNMB-UHFFFAOYSA-N 1 2 235.331 2.133 20 0 BEADLO CO[C@@H](C)CCNc1cc[nH+]c2ccncc12 ZINC000267991384 386607612 /nfs/dbraw/zinc/60/76/12/386607612.db2.gz RNPBVYZKKPAWOJ-JTQLQIEISA-N 1 2 231.299 2.467 20 0 BEADLO Cc1ccc(NC(=O)NC[C@H]2C[C@@H]2C)c(C)[nH+]1 ZINC000268038433 386614328 /nfs/dbraw/zinc/61/43/28/386614328.db2.gz RKQHWQZMGQNJHT-GZMMTYOYSA-N 1 2 233.315 2.476 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@](C)(OC)C1CC1 ZINC000292060935 386617480 /nfs/dbraw/zinc/61/74/80/386617480.db2.gz NWLVIABZKQTPML-AWEZNQCLSA-N 1 2 248.326 2.398 20 0 BEADLO CC[C@H]1CC[N@@H+]1Cc1cnn(-c2ccccc2)n1 ZINC000292413282 386664595 /nfs/dbraw/zinc/66/45/95/386664595.db2.gz MFLQZJDKSQOUKN-ZDUSSCGKSA-N 1 2 242.326 2.252 20 0 BEADLO CC[C@H]1CC[N@H+]1Cc1cnn(-c2ccccc2)n1 ZINC000292413282 386664606 /nfs/dbraw/zinc/66/46/06/386664606.db2.gz MFLQZJDKSQOUKN-ZDUSSCGKSA-N 1 2 242.326 2.252 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1CO[C@@H](C)C1 ZINC000335527329 386673313 /nfs/dbraw/zinc/67/33/13/386673313.db2.gz IBTNEKXJPGWHIW-GXSJLCMTSA-N 1 2 234.299 2.062 20 0 BEADLO CC(C)n1cnnc1C[N@H+](C)[C@@H]1C=CCCC1 ZINC000292449215 386673679 /nfs/dbraw/zinc/67/36/79/386673679.db2.gz PFNTURPLHOJWNI-GFCCVEGCSA-N 1 2 234.347 2.400 20 0 BEADLO CC(C)n1cnnc1C[N@@H+](C)[C@@H]1C=CCCC1 ZINC000292449215 386673684 /nfs/dbraw/zinc/67/36/84/386673684.db2.gz PFNTURPLHOJWNI-GFCCVEGCSA-N 1 2 234.347 2.400 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1CCCCO1 ZINC000335529884 386677447 /nfs/dbraw/zinc/67/74/47/386677447.db2.gz TWDPMEKJBCSSCZ-LLVKDONJSA-N 1 2 234.299 2.206 20 0 BEADLO Cc1cc(NC(=O)N(C)[C@H](C)C2CCC2)cc[nH+]1 ZINC000357005397 386682877 /nfs/dbraw/zinc/68/28/77/386682877.db2.gz BGQKXIMLSDIAEK-LLVKDONJSA-N 1 2 247.342 2.464 20 0 BEADLO CC[C@@H](C)Cn1c2ccccc2[nH+]c1NCCO ZINC000268718411 386687633 /nfs/dbraw/zinc/68/76/33/386687633.db2.gz NMQRJZCURXYHBK-LLVKDONJSA-N 1 2 247.342 2.487 20 0 BEADLO C[C@@H](C[NH2+]CC(F)(F)CN)c1ccc(F)cc1 ZINC000414927576 386692893 /nfs/dbraw/zinc/69/28/93/386692893.db2.gz LPCKNRKQCKTJQO-VIFPVBQESA-N 1 2 246.276 2.113 20 0 BEADLO CC(C)(C)CCC[N@@H+]1CCOC[C@H]1C(N)=O ZINC000330381698 386693746 /nfs/dbraw/zinc/69/37/46/386693746.db2.gz INCMHBLPKDGHJJ-JTQLQIEISA-N 1 2 228.336 2.049 20 0 BEADLO CC(C)(C)CCC[N@H+]1CCOC[C@H]1C(N)=O ZINC000330381698 386693753 /nfs/dbraw/zinc/69/37/53/386693753.db2.gz INCMHBLPKDGHJJ-JTQLQIEISA-N 1 2 228.336 2.049 20 0 BEADLO C/C=C(\C=C\C(=O)N(C)Cc1[nH+]ccn1C)CC ZINC000268821268 386702515 /nfs/dbraw/zinc/70/25/15/386702515.db2.gz LZAPKVAALHHYAP-ZECXQIHBSA-N 1 2 247.342 2.291 20 0 BEADLO CC(C)(C)c1cnc(C[N@@H+]2CC[C@@H](O)C2)s1 ZINC000279756249 386732155 /nfs/dbraw/zinc/73/21/55/386732155.db2.gz DFTAANBWWFKKSJ-SECBINFHSA-N 1 2 240.372 2.007 20 0 BEADLO CC(C)(C)c1cnc(C[N@H+]2CC[C@@H](O)C2)s1 ZINC000279756249 386732160 /nfs/dbraw/zinc/73/21/60/386732160.db2.gz DFTAANBWWFKKSJ-SECBINFHSA-N 1 2 240.372 2.007 20 0 BEADLO Cc1cnc([C@@H]([NH2+]Cc2cc[nH]n2)C2CC2)s1 ZINC000608062341 386733761 /nfs/dbraw/zinc/73/37/61/386733761.db2.gz DXIIHVSHXKTGDZ-NSHDSACASA-N 1 2 248.355 2.416 20 0 BEADLO CCn1cncc1C[N@H+](C)[C@H](C)c1ccccn1 ZINC000417975358 386738204 /nfs/dbraw/zinc/73/82/04/386738204.db2.gz DUKGEOBLSCIYMB-GFCCVEGCSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1cncc1C[N@@H+](C)[C@H](C)c1ccccn1 ZINC000417975358 386738210 /nfs/dbraw/zinc/73/82/10/386738210.db2.gz DUKGEOBLSCIYMB-GFCCVEGCSA-N 1 2 244.342 2.491 20 0 BEADLO CC[N@@H+](Cc1cccs1)Cc1nc(C)no1 ZINC000248007763 386739830 /nfs/dbraw/zinc/73/98/30/386739830.db2.gz HRVPVAXCMKSHLJ-UHFFFAOYSA-N 1 2 237.328 2.462 20 0 BEADLO CC[N@H+](Cc1cccs1)Cc1nc(C)no1 ZINC000248007763 386739836 /nfs/dbraw/zinc/73/98/36/386739836.db2.gz HRVPVAXCMKSHLJ-UHFFFAOYSA-N 1 2 237.328 2.462 20 0 BEADLO Cc1ccoc1C[NH2+][C@H]1CCCc2cn[nH]c21 ZINC000268883776 386714903 /nfs/dbraw/zinc/71/49/03/386714903.db2.gz YKSHMJMKPAMDIH-NSHDSACASA-N 1 2 231.299 2.478 20 0 BEADLO Cc1ccoc1C[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000268883776 386714911 /nfs/dbraw/zinc/71/49/11/386714911.db2.gz YKSHMJMKPAMDIH-NSHDSACASA-N 1 2 231.299 2.478 20 0 BEADLO FC1(C[N@@H+]2CCCC[C@H]2c2ncc[nH]2)CC1 ZINC000526971429 386714929 /nfs/dbraw/zinc/71/49/29/386714929.db2.gz FYCGROJVGLJQRT-JTQLQIEISA-N 1 2 223.295 2.439 20 0 BEADLO FC1(C[N@H+]2CCCC[C@H]2c2ncc[nH]2)CC1 ZINC000526971429 386714937 /nfs/dbraw/zinc/71/49/37/386714937.db2.gz FYCGROJVGLJQRT-JTQLQIEISA-N 1 2 223.295 2.439 20 0 BEADLO COCC[N@H+](Cc1cncs1)CC1(F)CC1 ZINC000526988102 386723479 /nfs/dbraw/zinc/72/34/79/386723479.db2.gz ZGPWSFSRRBFZBJ-UHFFFAOYSA-N 1 2 244.335 2.094 20 0 BEADLO COCC[N@@H+](Cc1cncs1)CC1(F)CC1 ZINC000526988102 386723486 /nfs/dbraw/zinc/72/34/86/386723486.db2.gz ZGPWSFSRRBFZBJ-UHFFFAOYSA-N 1 2 244.335 2.094 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)[C@H]1C=CCCCCC1 ZINC000292774391 386725101 /nfs/dbraw/zinc/72/51/01/386725101.db2.gz JYCWYVNPGHJUGO-NSHDSACASA-N 1 2 220.320 2.125 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)[C@H]1C=CCCCCC1 ZINC000292774391 386725106 /nfs/dbraw/zinc/72/51/06/386725106.db2.gz JYCWYVNPGHJUGO-NSHDSACASA-N 1 2 220.320 2.125 20 0 BEADLO C[C@@H]1CCCC[N@@H+]1Cc1nn(C)cc1Cl ZINC000335542467 386725593 /nfs/dbraw/zinc/72/55/93/386725593.db2.gz DSHHDMZWIVHLBG-SECBINFHSA-N 1 2 227.739 2.448 20 0 BEADLO C[C@@H]1CCCC[N@H+]1Cc1nn(C)cc1Cl ZINC000335542467 386725598 /nfs/dbraw/zinc/72/55/98/386725598.db2.gz DSHHDMZWIVHLBG-SECBINFHSA-N 1 2 227.739 2.448 20 0 BEADLO CCc1[nH+]c(C(C)C)ccc1Cn1nnnc1C ZINC000292795417 386727466 /nfs/dbraw/zinc/72/74/66/386727466.db2.gz ZSWSNBJCMMRHFN-UHFFFAOYSA-N 1 2 245.330 2.111 20 0 BEADLO CC(C)(C)n1ncnc1COc1cc[nH+]cc1 ZINC000292795597 386727529 /nfs/dbraw/zinc/72/75/29/386727529.db2.gz QSOUBMJNXOXCLD-UHFFFAOYSA-N 1 2 232.287 2.007 20 0 BEADLO CCn1cc(CNc2cc[nH+]cc2F)cn1 ZINC000192150709 386745658 /nfs/dbraw/zinc/74/56/58/386745658.db2.gz QWMAWNOOOCTQKO-UHFFFAOYSA-N 1 2 220.251 2.049 20 0 BEADLO C[C@@H]([NH2+]Cc1cocn1)c1cccc(O)c1 ZINC000192308072 386755470 /nfs/dbraw/zinc/75/54/70/386755470.db2.gz ZVEATDDRXAWJHA-SECBINFHSA-N 1 2 218.256 2.231 20 0 BEADLO C[N@H+](Cc1ccn(C2CCCC2)n1)[C@H]1CCOC1 ZINC000357304052 386756639 /nfs/dbraw/zinc/75/66/39/386756639.db2.gz KQOHIADTTJFSFD-AWEZNQCLSA-N 1 2 249.358 2.219 20 0 BEADLO C[N@@H+](Cc1ccn(C2CCCC2)n1)[C@H]1CCOC1 ZINC000357304052 386756644 /nfs/dbraw/zinc/75/66/44/386756644.db2.gz KQOHIADTTJFSFD-AWEZNQCLSA-N 1 2 249.358 2.219 20 0 BEADLO CC(C)(C)[C@@H](O)C[N@H+](CC(F)F)C1CC1 ZINC000336663726 386758204 /nfs/dbraw/zinc/75/82/04/386758204.db2.gz CVHNVEBEMVEVSI-VIFPVBQESA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)(C)[C@@H](O)C[N@@H+](CC(F)F)C1CC1 ZINC000336663726 386758207 /nfs/dbraw/zinc/75/82/07/386758207.db2.gz CVHNVEBEMVEVSI-VIFPVBQESA-N 1 2 221.291 2.123 20 0 BEADLO C[C@@H]1C[N@H+](CC(=O)OCc2ccccc2)[C@H]1C ZINC000293025234 386768622 /nfs/dbraw/zinc/76/86/22/386768622.db2.gz PHMBYMGYMMUENQ-NEPJUHHUSA-N 1 2 233.311 2.070 20 0 BEADLO C[C@@H]1C[N@@H+](CC(=O)OCc2ccccc2)[C@H]1C ZINC000293025234 386768631 /nfs/dbraw/zinc/76/86/31/386768631.db2.gz PHMBYMGYMMUENQ-NEPJUHHUSA-N 1 2 233.311 2.070 20 0 BEADLO CO[C@@H](CNc1cc[nH+]c(C2CC2)n1)C1CC1 ZINC000292875671 386742003 /nfs/dbraw/zinc/74/20/03/386742003.db2.gz UHWFXSIKCMEZTC-NSHDSACASA-N 1 2 233.315 2.191 20 0 BEADLO CC[C@H]1CCC[C@@H]1NC(=O)CCc1c[nH+]cn1C ZINC000279819844 386742905 /nfs/dbraw/zinc/74/29/05/386742905.db2.gz IFFBFQFFOHDDBT-AAEUAGOBSA-N 1 2 249.358 2.048 20 0 BEADLO COC(=O)[C@H](c1ccccc1)[N@@H+]1C[C@H](C)[C@H]1C ZINC000292886115 386742984 /nfs/dbraw/zinc/74/29/84/386742984.db2.gz CMSLCXFQSPAARE-LOWVWBTDSA-N 1 2 233.311 2.241 20 0 BEADLO COC(=O)[C@H](c1ccccc1)[N@H+]1C[C@H](C)[C@H]1C ZINC000292886115 386742992 /nfs/dbraw/zinc/74/29/92/386742992.db2.gz CMSLCXFQSPAARE-LOWVWBTDSA-N 1 2 233.311 2.241 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCO[C@@H]2CCC[C@H]21 ZINC000334143176 386743709 /nfs/dbraw/zinc/74/37/09/386743709.db2.gz QDBBMLGYDIKLAI-CHWSQXEVSA-N 1 2 236.315 2.045 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCO[C@@H]2CCC[C@H]21 ZINC000334143176 386743711 /nfs/dbraw/zinc/74/37/11/386743711.db2.gz QDBBMLGYDIKLAI-CHWSQXEVSA-N 1 2 236.315 2.045 20 0 BEADLO CC(C)(C)CCCC(=O)Nc1cc[nH+]cc1O ZINC000330572749 386793637 /nfs/dbraw/zinc/79/36/37/386793637.db2.gz YXLLCQVTYVWALT-UHFFFAOYSA-N 1 2 236.315 2.364 20 0 BEADLO CCC(CC)[C@H](C)C(=O)NCc1[nH]cc[nH+]1 ZINC000330526976 386774228 /nfs/dbraw/zinc/77/42/28/386774228.db2.gz KKOIZEOIJKDHNB-VIFPVBQESA-N 1 2 223.320 2.098 20 0 BEADLO CCn1cncc1C[N@H+](C)[C@@H](C)c1cccnc1 ZINC000417978795 386780885 /nfs/dbraw/zinc/78/08/85/386780885.db2.gz DISNAVSOONZCAT-LBPRGKRZSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1cncc1C[N@@H+](C)[C@@H](C)c1cccnc1 ZINC000417978795 386780891 /nfs/dbraw/zinc/78/08/91/386780891.db2.gz DISNAVSOONZCAT-LBPRGKRZSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1c[nH+]cc1CN(C)[C@@H](C)c1cccnc1 ZINC000417978795 386780896 /nfs/dbraw/zinc/78/08/96/386780896.db2.gz DISNAVSOONZCAT-LBPRGKRZSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1cncc1C[N@H+](C)[C@H](C)c1cccnc1 ZINC000417978794 386782706 /nfs/dbraw/zinc/78/27/06/386782706.db2.gz DISNAVSOONZCAT-GFCCVEGCSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1cncc1C[N@@H+](C)[C@H](C)c1cccnc1 ZINC000417978794 386782710 /nfs/dbraw/zinc/78/27/10/386782710.db2.gz DISNAVSOONZCAT-GFCCVEGCSA-N 1 2 244.342 2.491 20 0 BEADLO CCn1c[nH+]cc1CN(C)[C@H](C)c1cccnc1 ZINC000417978794 386782715 /nfs/dbraw/zinc/78/27/15/386782715.db2.gz DISNAVSOONZCAT-GFCCVEGCSA-N 1 2 244.342 2.491 20 0 BEADLO COC(=O)c1occc1C[N@@H+]1CCC[C@@H]1CF ZINC000293157535 386783965 /nfs/dbraw/zinc/78/39/65/386783965.db2.gz UOPZKRKNJFMWKL-SNVBAGLBSA-N 1 2 241.262 2.000 20 0 BEADLO COC(=O)c1occc1C[N@H+]1CCC[C@@H]1CF ZINC000293157535 386783973 /nfs/dbraw/zinc/78/39/73/386783973.db2.gz UOPZKRKNJFMWKL-SNVBAGLBSA-N 1 2 241.262 2.000 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@@H+]1C[C@@H](C)[C@@H]1C ZINC000293284218 386797964 /nfs/dbraw/zinc/79/79/64/386797964.db2.gz CRZZNQMPHDUCEK-YWVKMMECSA-N 1 2 239.340 2.302 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@H+]1C[C@@H](C)[C@@H]1C ZINC000293284218 386797970 /nfs/dbraw/zinc/79/79/70/386797970.db2.gz CRZZNQMPHDUCEK-YWVKMMECSA-N 1 2 239.340 2.302 20 0 BEADLO COc1c(C)cc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)cc1C ZINC000366543554 386798928 /nfs/dbraw/zinc/79/89/28/386798928.db2.gz IMQZXCLADFPYQV-UONOGXRCSA-N 1 2 247.338 2.285 20 0 BEADLO COc1c(C)cc(C[N@H+]2CCO[C@@H]3C[C@@H]32)cc1C ZINC000366543554 386798930 /nfs/dbraw/zinc/79/89/30/386798930.db2.gz IMQZXCLADFPYQV-UONOGXRCSA-N 1 2 247.338 2.285 20 0 BEADLO Cc1nnc(N[C@H](c2[nH]cc[nH+]2)C(C)C)nc1C ZINC000357557724 386805477 /nfs/dbraw/zinc/80/54/77/386805477.db2.gz JEVRXCUHLHAVJU-JTQLQIEISA-N 1 2 246.318 2.021 20 0 BEADLO CC[C@](C)(OC)C(=O)Nc1ccc(C)[nH+]c1C ZINC000280333765 386805911 /nfs/dbraw/zinc/80/59/11/386805911.db2.gz LOSIFFLIGJGBEU-ZDUSSCGKSA-N 1 2 236.315 2.452 20 0 BEADLO C[C@H]1C[N@H+](CCOCC2CCCC2)CCC1=O ZINC000314622413 386809887 /nfs/dbraw/zinc/80/98/87/386809887.db2.gz ZSRKPKNCYJNCIY-LBPRGKRZSA-N 1 2 239.359 2.104 20 0 BEADLO C[C@H]1C[N@@H+](CCOCC2CCCC2)CCC1=O ZINC000314622413 386809894 /nfs/dbraw/zinc/80/98/94/386809894.db2.gz ZSRKPKNCYJNCIY-LBPRGKRZSA-N 1 2 239.359 2.104 20 0 BEADLO CCOc1ncccc1CNc1cc(C)[nH+]cn1 ZINC000301222858 386825071 /nfs/dbraw/zinc/82/50/71/386825071.db2.gz BPOFOMIKVXBLBV-UHFFFAOYSA-N 1 2 244.298 2.191 20 0 BEADLO CC(C)C[C@H](O)CNc1cc[nH+]c(C2CC2)n1 ZINC000301224666 386825598 /nfs/dbraw/zinc/82/55/98/386825598.db2.gz CTVNEJPSNSWHBY-NSHDSACASA-N 1 2 235.331 2.173 20 0 BEADLO CC(=O)Nc1ccccc1C[N@H+](C)CCF ZINC000293518671 386830505 /nfs/dbraw/zinc/83/05/05/386830505.db2.gz AURYVDVOEYGUGZ-UHFFFAOYSA-N 1 2 224.279 2.046 20 0 BEADLO CC(=O)Nc1ccccc1C[N@@H+](C)CCF ZINC000293518671 386830510 /nfs/dbraw/zinc/83/05/10/386830510.db2.gz AURYVDVOEYGUGZ-UHFFFAOYSA-N 1 2 224.279 2.046 20 0 BEADLO COc1ccc(CN(C)c2cc(C)[nH+]cn2)cc1 ZINC000301276010 386830650 /nfs/dbraw/zinc/83/06/50/386830650.db2.gz WPEWRRXJUXJHJO-UHFFFAOYSA-N 1 2 243.310 2.430 20 0 BEADLO C[C@H](NC(=O)Nc1ccn2cc[nH+]c2c1)C1CC1 ZINC000280724813 386839575 /nfs/dbraw/zinc/83/95/75/386839575.db2.gz CLOYOGITXSUVLR-VIFPVBQESA-N 1 2 244.298 2.254 20 0 BEADLO CCc1cccc(C[N@H+](C)[C@@H](C)C(=O)OC)c1 ZINC000280730370 386840439 /nfs/dbraw/zinc/84/04/39/386840439.db2.gz LFFJIHDXFAYCPV-NSHDSACASA-N 1 2 235.327 2.242 20 0 BEADLO CCc1cccc(C[N@@H+](C)[C@@H](C)C(=O)OC)c1 ZINC000280730370 386840451 /nfs/dbraw/zinc/84/04/51/386840451.db2.gz LFFJIHDXFAYCPV-NSHDSACASA-N 1 2 235.327 2.242 20 0 BEADLO Cc1cc(CNc2c[nH+]cc(C)c2)no1 ZINC000334790445 386853443 /nfs/dbraw/zinc/85/34/43/386853443.db2.gz UOJZMMMVEPQAIW-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO CSC[C@@H](C)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000280725558 386841577 /nfs/dbraw/zinc/84/15/77/386841577.db2.gz HYXRARYJMLUMIK-SECBINFHSA-N 1 2 249.339 2.272 20 0 BEADLO Cc1nc(N(C)Cc2ccncc2)c(C)c(C)[nH+]1 ZINC000301428167 386842355 /nfs/dbraw/zinc/84/23/55/386842355.db2.gz DVCFAQMOBWZQOS-UHFFFAOYSA-N 1 2 242.326 2.433 20 0 BEADLO c1coc(C[N@@H+]2C[C@@]3(CCCO3)[C@H]2C2CC2)c1 ZINC000293862124 386891592 /nfs/dbraw/zinc/89/15/92/386891592.db2.gz CBKKWDULSWSILZ-KGLIPLIRSA-N 1 2 233.311 2.423 20 0 BEADLO c1coc(C[N@H+]2C[C@@]3(CCCO3)[C@H]2C2CC2)c1 ZINC000293862124 386891596 /nfs/dbraw/zinc/89/15/96/386891596.db2.gz CBKKWDULSWSILZ-KGLIPLIRSA-N 1 2 233.311 2.423 20 0 BEADLO CC(C)c1nc(N(C)C)nc(NC2CCCC2)[nH+]1 ZINC000301914363 386892090 /nfs/dbraw/zinc/89/20/90/386892090.db2.gz IECZWQAREQLFLE-UHFFFAOYSA-N 1 2 249.362 2.416 20 0 BEADLO CC(C)c1nc(NC2CCCC2)nc(N(C)C)[nH+]1 ZINC000301914363 386892096 /nfs/dbraw/zinc/89/20/96/386892096.db2.gz IECZWQAREQLFLE-UHFFFAOYSA-N 1 2 249.362 2.416 20 0 BEADLO CO[C@@]1(C)C[C@@H](N(C)c2cc(C)[nH+]cn2)C1(C)C ZINC000301550165 386854387 /nfs/dbraw/zinc/85/43/87/386854387.db2.gz GMGKETULRRRCEF-RISCZKNCSA-N 1 2 249.358 2.425 20 0 BEADLO Fc1cccc2c1C[N@H+](C[C@@H]1CCCO1)C2 ZINC000334791182 386856744 /nfs/dbraw/zinc/85/67/44/386856744.db2.gz XCYVYLYLXBYVPK-NSHDSACASA-N 1 2 221.275 2.320 20 0 BEADLO Fc1cccc2c1C[N@@H+](C[C@@H]1CCCO1)C2 ZINC000334791182 386856748 /nfs/dbraw/zinc/85/67/48/386856748.db2.gz XCYVYLYLXBYVPK-NSHDSACASA-N 1 2 221.275 2.320 20 0 BEADLO Cn1cc[nH+]c1CN1Cc2cccc(F)c2C1 ZINC000334792437 386857817 /nfs/dbraw/zinc/85/78/17/386857817.db2.gz OZFTZNLXUBBBPT-UHFFFAOYSA-N 1 2 231.274 2.075 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1ccc(F)cc1F ZINC000293687607 386861771 /nfs/dbraw/zinc/86/17/71/386861771.db2.gz WCQHPKIBLCHIEX-LLVKDONJSA-N 1 2 227.254 2.186 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1ccc(F)cc1F ZINC000293687607 386861776 /nfs/dbraw/zinc/86/17/76/386861776.db2.gz WCQHPKIBLCHIEX-LLVKDONJSA-N 1 2 227.254 2.186 20 0 BEADLO Cc1cccc(C)c1C[NH+]1CC(O)(C(F)F)C1 ZINC000425347499 386862027 /nfs/dbraw/zinc/86/20/27/386862027.db2.gz LRDPSDAQQUQBIX-UHFFFAOYSA-N 1 2 241.281 2.115 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+]1CCO[C@@H](CF)C1 ZINC000334831065 386866823 /nfs/dbraw/zinc/86/68/23/386866823.db2.gz XMDVGTSXUCFEOJ-ZDUSSCGKSA-N 1 2 241.281 2.304 20 0 BEADLO Cc1ccc(F)cc1C[N@H+]1CCO[C@@H](CF)C1 ZINC000334831065 386866825 /nfs/dbraw/zinc/86/68/25/386866825.db2.gz XMDVGTSXUCFEOJ-ZDUSSCGKSA-N 1 2 241.281 2.304 20 0 BEADLO Cc1nc(N2C[C@H](C)[C@H](C)C2)c(C)c(C)[nH+]1 ZINC000301682181 386867627 /nfs/dbraw/zinc/86/76/27/386867627.db2.gz KBIWGLGQBDGPOZ-DTORHVGOSA-N 1 2 219.332 2.494 20 0 BEADLO Cc1nc(N2C[C@H](C)[C@@H](C)C2)c(C)c(C)[nH+]1 ZINC000301682182 386868689 /nfs/dbraw/zinc/86/86/89/386868689.db2.gz KBIWGLGQBDGPOZ-IUCAKERBSA-N 1 2 219.332 2.494 20 0 BEADLO CCC(=O)N1CC[N@H+](Cc2ccc(C)c(C)c2)C1 ZINC000425350923 386869676 /nfs/dbraw/zinc/86/96/76/386869676.db2.gz UICZQUCAXMLBOT-UHFFFAOYSA-N 1 2 246.354 2.315 20 0 BEADLO CCC(=O)N1CC[N@@H+](Cc2ccc(C)c(C)c2)C1 ZINC000425350923 386869679 /nfs/dbraw/zinc/86/96/79/386869679.db2.gz UICZQUCAXMLBOT-UHFFFAOYSA-N 1 2 246.354 2.315 20 0 BEADLO CCC1(c2nc(Cc3c[nH+]cn3C)no2)CCC1 ZINC000357948175 386871136 /nfs/dbraw/zinc/87/11/36/386871136.db2.gz LVGUQMJROGSLTK-UHFFFAOYSA-N 1 2 246.314 2.226 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000293741993 386871216 /nfs/dbraw/zinc/87/12/16/386871216.db2.gz VWOYQMFXCOCLFJ-SECBINFHSA-N 1 2 245.244 2.325 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000293741993 386871225 /nfs/dbraw/zinc/87/12/25/386871225.db2.gz VWOYQMFXCOCLFJ-SECBINFHSA-N 1 2 245.244 2.325 20 0 BEADLO C[N@H+](CCF)Cc1cccc(F)c1F ZINC000293746520 386872862 /nfs/dbraw/zinc/87/28/62/386872862.db2.gz WHVKZZXWOOPFDH-UHFFFAOYSA-N 1 2 203.207 2.366 20 0 BEADLO C[N@@H+](CCF)Cc1cccc(F)c1F ZINC000293746520 386872864 /nfs/dbraw/zinc/87/28/64/386872864.db2.gz WHVKZZXWOOPFDH-UHFFFAOYSA-N 1 2 203.207 2.366 20 0 BEADLO Cc1noc(C(C)(C)[NH2+]Cc2cccc(O)c2)n1 ZINC000341282603 386876132 /nfs/dbraw/zinc/87/61/32/386876132.db2.gz XDERTVVBEWKJFR-UHFFFAOYSA-N 1 2 247.298 2.109 20 0 BEADLO Cc1nc(C[N@H+]2CC(C)(C)OC[C@@H]2C)cs1 ZINC000335752991 386878633 /nfs/dbraw/zinc/87/86/33/386878633.db2.gz HXGMCQQPTRPSRK-VIFPVBQESA-N 1 2 240.372 2.451 20 0 BEADLO Cc1nc(C[N@@H+]2CC(C)(C)OC[C@@H]2C)cs1 ZINC000335752991 386878635 /nfs/dbraw/zinc/87/86/35/386878635.db2.gz HXGMCQQPTRPSRK-VIFPVBQESA-N 1 2 240.372 2.451 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)c1coc(C)c1 ZINC000456364960 386878892 /nfs/dbraw/zinc/87/88/92/386878892.db2.gz VNKIUQIUZIDMQS-JTQLQIEISA-N 1 2 247.298 2.295 20 0 BEADLO CN(C(=O)CCn1cc[nH+]c1)[C@@H]1CCC(C)(C)C1 ZINC000358044106 386883308 /nfs/dbraw/zinc/88/33/08/386883308.db2.gz FQRPGEHASPCAPC-GFCCVEGCSA-N 1 2 249.358 2.310 20 0 BEADLO Cc1c[nH+]c(CN[C@@H](C(C)C)C(F)(F)F)n1C ZINC000341335729 386883694 /nfs/dbraw/zinc/88/36/94/386883694.db2.gz AXEJLZGBELVGII-JTQLQIEISA-N 1 2 249.280 2.405 20 0 BEADLO COC(C)(C)CNc1nc(N)c2ccccc2[nH+]1 ZINC000301877503 386887050 /nfs/dbraw/zinc/88/70/50/386887050.db2.gz HEKHQZJTSPRWAU-UHFFFAOYSA-N 1 2 246.314 2.049 20 0 BEADLO CC(C)c1nc(N2CCC[C@H]2C(C)(C)O)cc[nH+]1 ZINC000301983413 386895961 /nfs/dbraw/zinc/89/59/61/386895961.db2.gz RPOSHAVHCDQHIT-NSHDSACASA-N 1 2 249.358 2.340 20 0 BEADLO CCc1ccc([C@H](C)[NH2+]Cc2ccn(C)n2)o1 ZINC000358248629 386919446 /nfs/dbraw/zinc/91/94/46/386919446.db2.gz MGHVVMOYFIHFGI-JTQLQIEISA-N 1 2 233.315 2.426 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)Nc1ccc(C)cc1F ZINC000335761056 386897971 /nfs/dbraw/zinc/89/79/71/386897971.db2.gz AKOIWQSXWJGYJG-UHFFFAOYSA-N 1 2 247.273 2.347 20 0 BEADLO COCc1ccccc1NCc1[nH+]cc(C)n1C ZINC000341401193 386903946 /nfs/dbraw/zinc/90/39/46/386903946.db2.gz YODVEDBJFVXFSN-UHFFFAOYSA-N 1 2 245.326 2.487 20 0 BEADLO CCCC(C)(C)CC(=O)N1CCn2c[nH+]cc2C1 ZINC000358166567 386905357 /nfs/dbraw/zinc/90/53/57/386905357.db2.gz MEINVOJWVHUJIF-UHFFFAOYSA-N 1 2 249.358 2.442 20 0 BEADLO CC[C@@H](CC(=O)N1CCn2cc[nH+]c2C1)C(C)C ZINC000358167269 386905456 /nfs/dbraw/zinc/90/54/56/386905456.db2.gz DKMQKZWMDWHIPF-LBPRGKRZSA-N 1 2 249.358 2.298 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)C1=CCCC1 ZINC000334860918 386913210 /nfs/dbraw/zinc/91/32/10/386913210.db2.gz OSDQVVSCOLOULU-UHFFFAOYSA-N 1 2 227.267 2.383 20 0 BEADLO Cn1nccc1CNc1ccc2c(c1)CCC[NH2+]2 ZINC000334865485 386922641 /nfs/dbraw/zinc/92/26/41/386922641.db2.gz UPNDCKVZCWHOKI-UHFFFAOYSA-N 1 2 242.326 2.390 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CC(C)(C)[C@H]2C2CC2)nn1 ZINC000367975693 386923011 /nfs/dbraw/zinc/92/30/11/386923011.db2.gz ZXYDBFKYCAQRPE-CYBMUJFWSA-N 1 2 248.374 2.479 20 0 BEADLO CC(C)n1cc(C[N@H+]2CC(C)(C)[C@H]2C2CC2)nn1 ZINC000367975693 386923013 /nfs/dbraw/zinc/92/30/13/386923013.db2.gz ZXYDBFKYCAQRPE-CYBMUJFWSA-N 1 2 248.374 2.479 20 0 BEADLO CCCCNC(=O)CC[N@H+](CC(F)F)C1CC1 ZINC000116279037 386930213 /nfs/dbraw/zinc/93/02/13/386930213.db2.gz UMPYFWOJUDCXJB-UHFFFAOYSA-N 1 2 248.317 2.022 20 0 BEADLO CCCCNC(=O)CC[N@@H+](CC(F)F)C1CC1 ZINC000116279037 386930217 /nfs/dbraw/zinc/93/02/17/386930217.db2.gz UMPYFWOJUDCXJB-UHFFFAOYSA-N 1 2 248.317 2.022 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC[C@@H]2c2ccco2)n1C ZINC000116293614 386932988 /nfs/dbraw/zinc/93/29/88/386932988.db2.gz DXVYCXKCCBYMRE-LLVKDONJSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1nnc(C[N@H+]2CCC[C@@H]2c2ccco2)n1C ZINC000116293614 386932992 /nfs/dbraw/zinc/93/29/92/386932992.db2.gz DXVYCXKCCBYMRE-LLVKDONJSA-N 1 2 246.314 2.054 20 0 BEADLO c1snnc1C[NH+]1CCC2(CCC2)CC1 ZINC000368041407 386933539 /nfs/dbraw/zinc/93/35/39/386933539.db2.gz UIMHAMBFJHMRKV-UHFFFAOYSA-N 1 2 223.345 2.304 20 0 BEADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2cn(C)nn2)cc1 ZINC000341616676 386935145 /nfs/dbraw/zinc/93/51/45/386935145.db2.gz NNDOOIVJOWCMPR-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2cn(C)nn2)cc1 ZINC000341616676 386935151 /nfs/dbraw/zinc/93/51/51/386935151.db2.gz NNDOOIVJOWCMPR-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO CC(C)c1nc(NCCO)cc(C(C)(C)C)[nH+]1 ZINC000302797293 386935924 /nfs/dbraw/zinc/93/59/24/386935924.db2.gz QVNQELRWFFRJQW-UHFFFAOYSA-N 1 2 237.347 2.302 20 0 BEADLO Cc1cc(C[N@H+](C)CCOCC2CCC2)no1 ZINC000341682012 386941459 /nfs/dbraw/zinc/94/14/59/386941459.db2.gz HVPWPOAPJPAVHV-UHFFFAOYSA-N 1 2 238.331 2.232 20 0 BEADLO Cc1cc(C[N@@H+](C)CCOCC2CCC2)no1 ZINC000341682012 386941466 /nfs/dbraw/zinc/94/14/66/386941466.db2.gz HVPWPOAPJPAVHV-UHFFFAOYSA-N 1 2 238.331 2.232 20 0 BEADLO CC(C)CC1(C(=O)NCc2c[nH+]c[nH]2)CCC1 ZINC000332021281 386942482 /nfs/dbraw/zinc/94/24/82/386942482.db2.gz MCSSVCVTKZAWLB-UHFFFAOYSA-N 1 2 235.331 2.242 20 0 BEADLO CC(C)CC1(C(=O)NCc2c[nH]c[nH+]2)CCC1 ZINC000332021281 386942486 /nfs/dbraw/zinc/94/24/86/386942486.db2.gz MCSSVCVTKZAWLB-UHFFFAOYSA-N 1 2 235.331 2.242 20 0 BEADLO Cn1cc[nH+]c1[C@H](NC(=O)CC(C)(C)C)C1CC1 ZINC000341720572 386955506 /nfs/dbraw/zinc/95/55/06/386955506.db2.gz QAJXNVPNNCJEHG-GFCCVEGCSA-N 1 2 249.358 2.424 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CC[C@H](C)C2)cc[nH+]1 ZINC000334886224 386957736 /nfs/dbraw/zinc/95/77/36/386957736.db2.gz OJPMPJLIEZFDES-ONGXEEELSA-N 1 2 218.300 2.187 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](C)c2cccc(O)c2)nc1 ZINC000341812031 386974400 /nfs/dbraw/zinc/97/44/00/386974400.db2.gz ZETIFACLJODFDI-NSHDSACASA-N 1 2 243.310 2.341 20 0 BEADLO COC(=O)C[NH2+][C@H](C)c1c(C)cccc1C ZINC000336745301 386982128 /nfs/dbraw/zinc/98/21/28/386982128.db2.gz VQFVMHXSBXLPRC-LLVKDONJSA-N 1 2 221.300 2.127 20 0 BEADLO Fc1ccc2c(c1F)CN(Cc1c[nH+]c[nH]1)CC2 ZINC000334915997 386992619 /nfs/dbraw/zinc/99/26/19/386992619.db2.gz BGYWBVWHYUNIFH-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO Fc1ccc2c(c1F)CN(Cc1c[nH]c[nH+]1)CC2 ZINC000334915997 386992628 /nfs/dbraw/zinc/99/26/28/386992628.db2.gz BGYWBVWHYUNIFH-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO CC[C@H]1COCC[N@@H+]1C/C=C(/C)Cl ZINC000528378860 387037288 /nfs/dbraw/zinc/03/72/88/387037288.db2.gz BNEQCGNPCJSPQW-FWAPLPHYSA-N 1 2 203.713 2.240 20 0 BEADLO CC[C@H]1COCC[N@H+]1C/C=C(/C)Cl ZINC000528378860 387037290 /nfs/dbraw/zinc/03/72/90/387037290.db2.gz BNEQCGNPCJSPQW-FWAPLPHYSA-N 1 2 203.713 2.240 20 0 BEADLO c1snnc1C[N@@H+]1CCC12CCCCC2 ZINC000369326904 387038374 /nfs/dbraw/zinc/03/83/74/387038374.db2.gz MFTKYEXFKAMJNP-UHFFFAOYSA-N 1 2 223.345 2.447 20 0 BEADLO c1snnc1C[N@H+]1CCC12CCCCC2 ZINC000369326904 387038378 /nfs/dbraw/zinc/03/83/78/387038378.db2.gz MFTKYEXFKAMJNP-UHFFFAOYSA-N 1 2 223.345 2.447 20 0 BEADLO Cc1cc(CNC(=O)N2CC[C@H](C)C2)cc(C)[nH+]1 ZINC000334966723 387048952 /nfs/dbraw/zinc/04/89/52/387048952.db2.gz CECUFUBPZFJCJR-JTQLQIEISA-N 1 2 247.342 2.250 20 0 BEADLO CC(C)n1cc(C[N@@H+]2CC[C@@H](F)C2)cn1 ZINC000336223385 387064071 /nfs/dbraw/zinc/06/40/71/387064071.db2.gz ZCJKVJADTSLQGK-LLVKDONJSA-N 1 2 211.284 2.008 20 0 BEADLO CC(C)n1cc(C[N@H+]2CC[C@@H](F)C2)cn1 ZINC000336223385 387064075 /nfs/dbraw/zinc/06/40/75/387064075.db2.gz ZCJKVJADTSLQGK-LLVKDONJSA-N 1 2 211.284 2.008 20 0 BEADLO FC(F)n1cc[nH+]c1Cn1nnc2ccccc21 ZINC000358818437 387017570 /nfs/dbraw/zinc/01/75/70/387017570.db2.gz WCVGURXTQDXQCR-UHFFFAOYSA-N 1 2 249.224 2.071 20 0 BEADLO CC[C@H]1CCN1C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000334985823 387073705 /nfs/dbraw/zinc/07/37/05/387073705.db2.gz FMMOZDIMFCMGRX-ZDUSSCGKSA-N 1 2 247.342 2.392 20 0 BEADLO C([NH2+]C1CC2(CCC2)C1)c1noc(C2CC2)n1 ZINC000333900895 387075789 /nfs/dbraw/zinc/07/57/89/387075789.db2.gz SSMROXFAZCERDN-UHFFFAOYSA-N 1 2 233.315 2.369 20 0 BEADLO C[NH2+]Cc1noc(C2CCC(F)(F)CC2)n1 ZINC000127120622 387079177 /nfs/dbraw/zinc/07/91/77/387079177.db2.gz TWSUVAJDMGIMJC-UHFFFAOYSA-N 1 2 231.246 2.082 20 0 BEADLO Cc1nc(C[NH+]2[C@H](C)CCC[C@H]2C)no1 ZINC000066531624 387086241 /nfs/dbraw/zinc/08/62/41/387086241.db2.gz HLXZHWQVMSUDBO-RKDXNWHRSA-N 1 2 209.293 2.141 20 0 BEADLO C[NH2+]Cc1noc(C2=CCCCCC2)n1 ZINC000333933991 387090928 /nfs/dbraw/zinc/09/09/28/387090928.db2.gz IDVDLSJIYBHLHQ-UHFFFAOYSA-N 1 2 207.277 2.137 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@@H]1CCCC[C@@H]1C ZINC000424860781 387092465 /nfs/dbraw/zinc/09/24/65/387092465.db2.gz FLNPRJANFLZOIR-NWDGAFQWSA-N 1 2 249.358 2.346 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](C)c2cncc(F)c2)o1 ZINC000228578910 387094912 /nfs/dbraw/zinc/09/49/12/387094912.db2.gz JWBRLZZRSPAXEU-VIFPVBQESA-N 1 2 235.262 2.368 20 0 BEADLO F[C@H]1CC[N@H+](Cc2nc3cccnc3s2)C1 ZINC000336262920 387097116 /nfs/dbraw/zinc/09/71/16/387097116.db2.gz ZPIURCHVTZYZKB-QMMMGPOBSA-N 1 2 237.303 2.235 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2nc3cccnc3s2)C1 ZINC000336262920 387097119 /nfs/dbraw/zinc/09/71/19/387097119.db2.gz ZPIURCHVTZYZKB-QMMMGPOBSA-N 1 2 237.303 2.235 20 0 BEADLO CO[C@H]1CCN(c2[nH]c3ccccc3[nH+]2)C[C@H]1C ZINC000336271250 387103473 /nfs/dbraw/zinc/10/34/73/387103473.db2.gz MBXHKDCPVMYIBK-MFKMUULPSA-N 1 2 245.326 2.424 20 0 BEADLO C[C@@H]1CC2(CN1c1cccc[nH+]1)CCOCC2 ZINC000645381679 387107987 /nfs/dbraw/zinc/10/79/87/387107987.db2.gz GCACZMQKWVZWNH-GFCCVEGCSA-N 1 2 232.327 2.477 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@H](C)CC2)no1 ZINC000068855681 387108241 /nfs/dbraw/zinc/10/82/41/387108241.db2.gz NRLNVUAFVCKXSO-JTQLQIEISA-N 1 2 223.320 2.254 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@H](C)CC2)no1 ZINC000068855681 387108250 /nfs/dbraw/zinc/10/82/50/387108250.db2.gz NRLNVUAFVCKXSO-JTQLQIEISA-N 1 2 223.320 2.254 20 0 BEADLO O=C(C=C1CCC1)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000370355342 387111059 /nfs/dbraw/zinc/11/10/59/387111059.db2.gz NFJHNRGMKKUQEP-UHFFFAOYSA-N 1 2 245.326 2.226 20 0 BEADLO O=C(C=C1CCC1)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000370355342 387111067 /nfs/dbraw/zinc/11/10/67/387111067.db2.gz NFJHNRGMKKUQEP-UHFFFAOYSA-N 1 2 245.326 2.226 20 0 BEADLO Cc1[nH]ncc1C[NH2+]Cc1ccc(C)c(F)c1 ZINC000070160746 387118797 /nfs/dbraw/zinc/11/87/97/387118797.db2.gz KAQJBXBFTJMMDK-UHFFFAOYSA-N 1 2 233.290 2.455 20 0 BEADLO c1cc([C@H]2CCC[N@@H+](Cc3cccnc3)C2)[nH]n1 ZINC000072344678 387125404 /nfs/dbraw/zinc/12/54/04/387125404.db2.gz VEVKNXLZEXVDCT-ZDUSSCGKSA-N 1 2 242.326 2.184 20 0 BEADLO c1cc([C@H]2CCC[N@H+](Cc3cccnc3)C2)[nH]n1 ZINC000072344678 387125408 /nfs/dbraw/zinc/12/54/08/387125408.db2.gz VEVKNXLZEXVDCT-ZDUSSCGKSA-N 1 2 242.326 2.184 20 0 BEADLO CCCn1cc(C[N@@H+]2CCO[C@H]3CCC[C@@H]32)cn1 ZINC000352382720 387129033 /nfs/dbraw/zinc/12/90/33/387129033.db2.gz GBVJZYYHPYUUGF-KBPBESRZSA-N 1 2 249.358 2.046 20 0 BEADLO CCCn1cc(C[N@H+]2CCO[C@H]3CCC[C@@H]32)cn1 ZINC000352382720 387129037 /nfs/dbraw/zinc/12/90/37/387129037.db2.gz GBVJZYYHPYUUGF-KBPBESRZSA-N 1 2 249.358 2.046 20 0 BEADLO CCOCCC(=O)Nc1ccc(C)[nH+]c1C ZINC000119360978 387129957 /nfs/dbraw/zinc/12/99/57/387129957.db2.gz KMRJKSVTTCIBME-UHFFFAOYSA-N 1 2 222.288 2.064 20 0 BEADLO Cc1oncc1CN1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000336315746 387141369 /nfs/dbraw/zinc/14/13/69/387141369.db2.gz HCKIIQJHUZTPST-NSHDSACASA-N 1 2 232.287 2.043 20 0 BEADLO Cc1oncc1C[N@@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000336315746 387141376 /nfs/dbraw/zinc/14/13/76/387141376.db2.gz HCKIIQJHUZTPST-NSHDSACASA-N 1 2 232.287 2.043 20 0 BEADLO Cc1oncc1C[N@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000336315746 387141379 /nfs/dbraw/zinc/14/13/79/387141379.db2.gz HCKIIQJHUZTPST-NSHDSACASA-N 1 2 232.287 2.043 20 0 BEADLO Cc1c[nH+]cc(NCc2cncs2)c1 ZINC000119558668 387141704 /nfs/dbraw/zinc/14/17/04/387141704.db2.gz LWOUPAIPSBMMFW-UHFFFAOYSA-N 1 2 205.286 2.459 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)NC(C)(C)c1[nH]cc(C)[nH+]1 ZINC000571692028 387145293 /nfs/dbraw/zinc/14/52/93/387145293.db2.gz YCNSVCKSLWPGBI-NXEZZACHSA-N 1 2 235.331 2.116 20 0 BEADLO Cc1cc(C)n(CC[N@@H+]2CCC[C@@H]2C(F)F)n1 ZINC000353172272 387147054 /nfs/dbraw/zinc/14/70/54/387147054.db2.gz NHYZLPUNWLGCMJ-LLVKDONJSA-N 1 2 243.301 2.229 20 0 BEADLO Cc1cc(C)n(CC[N@H+]2CCC[C@@H]2C(F)F)n1 ZINC000353172272 387147058 /nfs/dbraw/zinc/14/70/58/387147058.db2.gz NHYZLPUNWLGCMJ-LLVKDONJSA-N 1 2 243.301 2.229 20 0 BEADLO Cc1noc([C@H](C)[NH2+]Cc2cnn(C(C)C)c2)n1 ZINC000352400270 387148720 /nfs/dbraw/zinc/14/87/20/387148720.db2.gz QWJDPMLTSQIJJE-VIFPVBQESA-N 1 2 249.318 2.006 20 0 BEADLO CC[C@@H]1CCC[C@@H]1NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000571699830 387149135 /nfs/dbraw/zinc/14/91/35/387149135.db2.gz LEHJFKGPAAKXAC-LOWVWBTDSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@@H]1CCC[C@@H]1NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000571699830 387149137 /nfs/dbraw/zinc/14/91/37/387149137.db2.gz LEHJFKGPAAKXAC-LOWVWBTDSA-N 1 2 249.358 2.283 20 0 BEADLO FC(F)[C@H]1CCC[N@@H+]1CCc1cccnc1 ZINC000353181331 387150614 /nfs/dbraw/zinc/15/06/14/387150614.db2.gz LUGICZDWFJRKPP-LLVKDONJSA-N 1 2 226.270 2.354 20 0 BEADLO FC(F)[C@H]1CCC[N@H+]1CCc1cccnc1 ZINC000353181331 387150618 /nfs/dbraw/zinc/15/06/18/387150618.db2.gz LUGICZDWFJRKPP-LLVKDONJSA-N 1 2 226.270 2.354 20 0 BEADLO CC1=CCCN(c2nc(N)c3ccccc3[nH+]2)C1 ZINC000571723239 387151235 /nfs/dbraw/zinc/15/12/35/387151235.db2.gz ZTLOEGLMNUHXAT-UHFFFAOYSA-N 1 2 240.310 2.199 20 0 BEADLO C[C@@]1(F)CCN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000336326433 387153669 /nfs/dbraw/zinc/15/36/69/387153669.db2.gz ZYQASVYXCDUJQH-GFCCVEGCSA-N 1 2 221.279 2.292 20 0 BEADLO C[C@]1(F)CCN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000336326434 387154176 /nfs/dbraw/zinc/15/41/76/387154176.db2.gz ZYQASVYXCDUJQH-LBPRGKRZSA-N 1 2 221.279 2.292 20 0 BEADLO CCCc1nc(C[N@@H+]2CCCC3(CC3)C2)no1 ZINC000186973703 387156388 /nfs/dbraw/zinc/15/63/88/387156388.db2.gz CCOIKYXWDSOKQG-UHFFFAOYSA-N 1 2 235.331 2.398 20 0 BEADLO CCCc1nc(C[N@H+]2CCCC3(CC3)C2)no1 ZINC000186973703 387156395 /nfs/dbraw/zinc/15/63/95/387156395.db2.gz CCOIKYXWDSOKQG-UHFFFAOYSA-N 1 2 235.331 2.398 20 0 BEADLO Cc1ccc(C[N@@H+]2CC[C@](F)(CO)C2)cc1F ZINC000336332108 387158286 /nfs/dbraw/zinc/15/82/86/387158286.db2.gz PIEIGRUDBYGHTN-CYBMUJFWSA-N 1 2 241.281 2.040 20 0 BEADLO Cc1ccc(C[N@H+]2CC[C@](F)(CO)C2)cc1F ZINC000336332108 387158289 /nfs/dbraw/zinc/15/82/89/387158289.db2.gz PIEIGRUDBYGHTN-CYBMUJFWSA-N 1 2 241.281 2.040 20 0 BEADLO C(c1noc(C2CC2)n1)[N@@H+]1CCCC2(CC2)C1 ZINC000186992164 387158959 /nfs/dbraw/zinc/15/89/59/387158959.db2.gz DBZNDECPYRYNEX-UHFFFAOYSA-N 1 2 233.315 2.323 20 0 BEADLO C(c1noc(C2CC2)n1)[N@H+]1CCCC2(CC2)C1 ZINC000186992164 387158963 /nfs/dbraw/zinc/15/89/63/387158963.db2.gz DBZNDECPYRYNEX-UHFFFAOYSA-N 1 2 233.315 2.323 20 0 BEADLO CO[C@H](C)C[N@H+](C)[C@H](C)c1nc(C(C)C)no1 ZINC000353318710 387180977 /nfs/dbraw/zinc/18/09/77/387180977.db2.gz UDJWISYURDWPRJ-NXEZZACHSA-N 1 2 241.335 2.221 20 0 BEADLO CO[C@H](C)C[N@@H+](C)[C@H](C)c1nc(C(C)C)no1 ZINC000353318710 387180982 /nfs/dbraw/zinc/18/09/82/387180982.db2.gz UDJWISYURDWPRJ-NXEZZACHSA-N 1 2 241.335 2.221 20 0 BEADLO Cc1nnc(C[N@@H+]2CC[C@@H]2c2ccccc2)n1C ZINC000336356729 387186607 /nfs/dbraw/zinc/18/66/07/387186607.db2.gz LEHHHQDCMBBJJF-CYBMUJFWSA-N 1 2 242.326 2.071 20 0 BEADLO Cc1nnc(C[N@H+]2CC[C@@H]2c2ccccc2)n1C ZINC000336356729 387186613 /nfs/dbraw/zinc/18/66/13/387186613.db2.gz LEHHHQDCMBBJJF-CYBMUJFWSA-N 1 2 242.326 2.071 20 0 BEADLO Cc1nnc(C[N@@H+]2CC[C@H]2c2ccccc2)n1C ZINC000336356730 387186959 /nfs/dbraw/zinc/18/69/59/387186959.db2.gz LEHHHQDCMBBJJF-ZDUSSCGKSA-N 1 2 242.326 2.071 20 0 BEADLO Cc1nnc(C[N@H+]2CC[C@H]2c2ccccc2)n1C ZINC000336356730 387186962 /nfs/dbraw/zinc/18/69/62/387186962.db2.gz LEHHHQDCMBBJJF-ZDUSSCGKSA-N 1 2 242.326 2.071 20 0 BEADLO CCc1nc(C[N@H+](C)CC2CCCC2)no1 ZINC000058411030 387187043 /nfs/dbraw/zinc/18/70/43/387187043.db2.gz NXOOWEPQJLCRIT-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO CCc1nc(C[N@@H+](C)CC2CCCC2)no1 ZINC000058411030 387187048 /nfs/dbraw/zinc/18/70/48/387187048.db2.gz NXOOWEPQJLCRIT-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO FCCCCNc1cc(N2CCCC2)nc[nH+]1 ZINC000359966570 387202961 /nfs/dbraw/zinc/20/29/61/387202961.db2.gz QEHIWDVAQPTZQD-UHFFFAOYSA-N 1 2 238.310 2.238 20 0 BEADLO FCCCCNc1cc(N2CCCC2)[nH+]cn1 ZINC000359966570 387202968 /nfs/dbraw/zinc/20/29/68/387202968.db2.gz QEHIWDVAQPTZQD-UHFFFAOYSA-N 1 2 238.310 2.238 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCO[C@@H]2CCC[C@H]21 ZINC000336378398 387208979 /nfs/dbraw/zinc/20/89/79/387208979.db2.gz CNLIFWGEEYGLRL-ZIAGYGMSSA-N 1 2 249.358 2.217 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCO[C@@H]2CCC[C@H]21 ZINC000336378398 387208981 /nfs/dbraw/zinc/20/89/81/387208981.db2.gz CNLIFWGEEYGLRL-ZIAGYGMSSA-N 1 2 249.358 2.217 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CCO[C@H]2CCC[C@H]21 ZINC000336378396 387210336 /nfs/dbraw/zinc/21/03/36/387210336.db2.gz CNLIFWGEEYGLRL-KGLIPLIRSA-N 1 2 249.358 2.217 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CCO[C@H]2CCC[C@H]21 ZINC000336378396 387210339 /nfs/dbraw/zinc/21/03/39/387210339.db2.gz CNLIFWGEEYGLRL-KGLIPLIRSA-N 1 2 249.358 2.217 20 0 BEADLO Cc1nc(C[N@@H+](C)C2CCC(F)(F)CC2)no1 ZINC000336380231 387211800 /nfs/dbraw/zinc/21/18/00/387211800.db2.gz UYPUPTUQRHYQMT-UHFFFAOYSA-N 1 2 245.273 2.388 20 0 BEADLO Cc1nc(C[N@H+](C)C2CCC(F)(F)CC2)no1 ZINC000336380231 387211806 /nfs/dbraw/zinc/21/18/06/387211806.db2.gz UYPUPTUQRHYQMT-UHFFFAOYSA-N 1 2 245.273 2.388 20 0 BEADLO Cc1cnn(C)c1CNc1c[nH+]ccc1C ZINC000285250479 387252921 /nfs/dbraw/zinc/25/29/21/387252921.db2.gz WWEIQCYFTHVAHH-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO CC(C)CC1(C(=O)N2CCn3c[nH+]cc3C2)CC1 ZINC000336396900 387225093 /nfs/dbraw/zinc/22/50/93/387225093.db2.gz NXSCDANQNQULBK-UHFFFAOYSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1oncc1C[N@@H+]1CCC[C@H]1c1cc[nH]n1 ZINC000336395589 387225133 /nfs/dbraw/zinc/22/51/33/387225133.db2.gz MQXFNNUSIADESI-LBPRGKRZSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1oncc1C[N@H+]1CCC[C@H]1c1cc[nH]n1 ZINC000336395589 387225135 /nfs/dbraw/zinc/22/51/35/387225135.db2.gz MQXFNNUSIADESI-LBPRGKRZSA-N 1 2 232.287 2.043 20 0 BEADLO CN(c1[nH]c2ccccc2[nH+]1)[C@H]1CCCOC1 ZINC000336398351 387226225 /nfs/dbraw/zinc/22/62/25/387226225.db2.gz UAKIKEBOBYXAKP-JTQLQIEISA-N 1 2 231.299 2.178 20 0 BEADLO Cc1cn2c([nH+]1)CN(Cc1cccs1)CC2 ZINC000371677088 387239565 /nfs/dbraw/zinc/23/95/65/387239565.db2.gz QWSIILDMAFSTDS-UHFFFAOYSA-N 1 2 233.340 2.269 20 0 BEADLO Cn1nccc1C[N@H+](C)Cc1ccsc1 ZINC000120480737 387250573 /nfs/dbraw/zinc/25/05/73/387250573.db2.gz SKCWMOWSAYCZHV-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO Cn1nccc1C[N@@H+](C)Cc1ccsc1 ZINC000120480737 387250579 /nfs/dbraw/zinc/25/05/79/387250579.db2.gz SKCWMOWSAYCZHV-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO C[C@@H]1C[C@H](O)CN1c1[nH+]ccc2ccc(F)cc21 ZINC000336367904 387198730 /nfs/dbraw/zinc/19/87/30/387198730.db2.gz QXPSIJYABSGWJJ-SKDRFNHKSA-N 1 2 246.285 2.333 20 0 BEADLO CCC[C@H]([NH2+]CC1(SC)CC1)C(=O)OCC ZINC000193331127 387198958 /nfs/dbraw/zinc/19/89/58/387198958.db2.gz TYQPIJDLVYZHHK-JTQLQIEISA-N 1 2 245.388 2.203 20 0 BEADLO CCCCCCC(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000371360101 387199249 /nfs/dbraw/zinc/19/92/49/387199249.db2.gz NPIDCXMXQMZGRQ-NSHDSACASA-N 1 2 249.358 2.354 20 0 BEADLO CCCCCCC(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000371360101 387199253 /nfs/dbraw/zinc/19/92/53/387199253.db2.gz NPIDCXMXQMZGRQ-NSHDSACASA-N 1 2 249.358 2.354 20 0 BEADLO CCCC[C@H](C)[C@H](C)NCC(F)(F)C[NH3+] ZINC000423349641 387201527 /nfs/dbraw/zinc/20/15/27/387201527.db2.gz XGTGIQKQGSGSDK-UWVGGRQHSA-N 1 2 222.323 2.385 20 0 BEADLO COc1ccc(C[N@@H+]2CCC[C@H](F)C2)cc1O ZINC000514944350 387312114 /nfs/dbraw/zinc/31/21/14/387312114.db2.gz PQDNMZFQCPGTBX-NSHDSACASA-N 1 2 239.290 2.335 20 0 BEADLO COc1ccc(C[N@H+]2CCC[C@H](F)C2)cc1O ZINC000514944350 387312120 /nfs/dbraw/zinc/31/21/20/387312120.db2.gz PQDNMZFQCPGTBX-NSHDSACASA-N 1 2 239.290 2.335 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)C[C@H]1C[C@H]1c1ccccc1 ZINC000353744308 387267482 /nfs/dbraw/zinc/26/74/82/387267482.db2.gz ZVLKHNKEOCHDED-OLZOCXBDSA-N 1 2 242.326 2.040 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)C[C@H]1C[C@H]1c1ccccc1 ZINC000353744308 387267487 /nfs/dbraw/zinc/26/74/87/387267487.db2.gz ZVLKHNKEOCHDED-OLZOCXBDSA-N 1 2 242.326 2.040 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2CCC[C@H](O)C2)c(C)[nH+]1 ZINC000336452700 387280304 /nfs/dbraw/zinc/28/03/04/387280304.db2.gz NLGOEVFADLSMMU-RYUDHWBXSA-N 1 2 248.326 2.188 20 0 BEADLO Cc1ccsc1C[N@H+](C)Cc1nnc(C)[nH]1 ZINC000353865011 387287294 /nfs/dbraw/zinc/28/72/94/387287294.db2.gz HXZRBRFDZWQOKY-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1ccsc1C[N@@H+](C)Cc1nnc(C)[nH]1 ZINC000353865011 387287297 /nfs/dbraw/zinc/28/72/97/387287297.db2.gz HXZRBRFDZWQOKY-UHFFFAOYSA-N 1 2 236.344 2.115 20 0 BEADLO Cc1ccc(NCc2cn(C(C)(C)C)nn2)c[nH+]1 ZINC000189957577 387293439 /nfs/dbraw/zinc/29/34/39/387293439.db2.gz JNOTXORWEQPYTG-UHFFFAOYSA-N 1 2 245.330 2.349 20 0 BEADLO c1csc([C@@H]2CCCN2Cc2c[nH+]c[nH]2)n1 ZINC000372433366 387301077 /nfs/dbraw/zinc/30/10/77/387301077.db2.gz GTSHRQCEAITDSE-JTQLQIEISA-N 1 2 234.328 2.203 20 0 BEADLO c1csc([C@@H]2CCCN2Cc2c[nH]c[nH+]2)n1 ZINC000372433366 387301082 /nfs/dbraw/zinc/30/10/82/387301082.db2.gz GTSHRQCEAITDSE-JTQLQIEISA-N 1 2 234.328 2.203 20 0 BEADLO C[C@H]([NH2+]Cc1[nH]ncc1Br)C1CC1 ZINC000379403970 387306829 /nfs/dbraw/zinc/30/68/29/387306829.db2.gz QLXXMNWBOZUKHH-LURJTMIESA-N 1 2 244.136 2.060 20 0 BEADLO CC1C[NH+](Cc2cnc(Cl)s2)C1 ZINC000575600167 387358275 /nfs/dbraw/zinc/35/82/75/387358275.db2.gz SGQCZFPZGPVYOF-UHFFFAOYSA-N 1 2 202.710 2.248 20 0 BEADLO C[C@H]1c2ccccc2CN1Cc1[nH+]ccn1C ZINC000336552725 387372474 /nfs/dbraw/zinc/37/24/74/387372474.db2.gz MHUYHMYZFZPSDQ-NSHDSACASA-N 1 2 227.311 2.497 20 0 BEADLO C[C@H]1c2ccccc2C[N@H+]1Cc1nccn1C ZINC000336552725 387372476 /nfs/dbraw/zinc/37/24/76/387372476.db2.gz MHUYHMYZFZPSDQ-NSHDSACASA-N 1 2 227.311 2.497 20 0 BEADLO C[C@H]1c2ccccc2C[N@@H+]1Cc1nccn1C ZINC000336552725 387372483 /nfs/dbraw/zinc/37/24/83/387372483.db2.gz MHUYHMYZFZPSDQ-NSHDSACASA-N 1 2 227.311 2.497 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N(C)C1CC1 ZINC000121267947 387320209 /nfs/dbraw/zinc/32/02/09/387320209.db2.gz VXIQOSJOIDXARN-UHFFFAOYSA-N 1 2 205.261 2.016 20 0 BEADLO Cn1c2cc(F)ccc2[nH]c1=[NH+]CCC1CC1 ZINC000431419010 387324271 /nfs/dbraw/zinc/32/42/71/387324271.db2.gz NZAOOXWDTAQYKS-UHFFFAOYSA-N 1 2 233.290 2.346 20 0 BEADLO CCC[C@@H]1C[C@@H]1C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000360651220 387328230 /nfs/dbraw/zinc/32/82/30/387328230.db2.gz GGABPVLCXRTWCZ-VWYCJHECSA-N 1 2 235.331 2.413 20 0 BEADLO CCc1ccccc1CN1CCn2cc[nH+]c2C1 ZINC000336510096 387333356 /nfs/dbraw/zinc/33/33/56/387333356.db2.gz LTPVUTSATFJVRL-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO CCc1ccccc1C[N@@H+]1CCn2ccnc2C1 ZINC000336510096 387333362 /nfs/dbraw/zinc/33/33/62/387333362.db2.gz LTPVUTSATFJVRL-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO CCc1ccccc1C[N@H+]1CCn2ccnc2C1 ZINC000336510096 387333366 /nfs/dbraw/zinc/33/33/66/387333366.db2.gz LTPVUTSATFJVRL-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO CCN(C(=O)Nc1cc[nH+]c(C)c1)C1CCC1 ZINC000336527401 387351010 /nfs/dbraw/zinc/35/10/10/387351010.db2.gz GLUDNIJCFFRAGT-UHFFFAOYSA-N 1 2 233.315 2.218 20 0 BEADLO C[C@@H]1CC[N@@H+]1Cc1cccc(Br)n1 ZINC000575599222 387351593 /nfs/dbraw/zinc/35/15/93/387351593.db2.gz BXKRCQWYTYSASB-MRVPVSSYSA-N 1 2 241.132 2.438 20 0 BEADLO C[C@@H]1CC[N@H+]1Cc1cccc(Br)n1 ZINC000575599222 387351600 /nfs/dbraw/zinc/35/16/00/387351600.db2.gz BXKRCQWYTYSASB-MRVPVSSYSA-N 1 2 241.132 2.438 20 0 BEADLO c1cn(CCSc2ncc3ccccn32)c[nH+]1 ZINC000121864413 387423661 /nfs/dbraw/zinc/42/36/61/387423661.db2.gz NMVNLMZFTLOXMM-UHFFFAOYSA-N 1 2 244.323 2.323 20 0 BEADLO CCC[C@H]1C[C@H]1c1nc(Cc2c[nH+]cn2C)no1 ZINC000361260656 387427016 /nfs/dbraw/zinc/42/70/16/387427016.db2.gz HTEJIKGBASUNOL-GXSJLCMTSA-N 1 2 246.314 2.298 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H]1CCCO[C@H]1C ZINC000191457406 387432698 /nfs/dbraw/zinc/43/26/98/387432698.db2.gz WXSSCWZXRVJWNW-QWRGUYRKSA-N 1 2 234.299 2.144 20 0 BEADLO CC(C)CCC(=O)N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000374354738 387445905 /nfs/dbraw/zinc/44/59/05/387445905.db2.gz VTMMJBLMUNDJEG-LBPRGKRZSA-N 1 2 249.358 2.172 20 0 BEADLO Cc1ccc(C[N@H+]2CCc3c(ncn3C)C2)s1 ZINC000374421486 387453693 /nfs/dbraw/zinc/45/36/93/387453693.db2.gz OIJDHGXXJCXWEG-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1ccc(C[N@@H+]2CCc3c(ncn3C)C2)s1 ZINC000374421486 387453696 /nfs/dbraw/zinc/45/36/96/387453696.db2.gz OIJDHGXXJCXWEG-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1ccc(CN2CCc3c([nH+]cn3C)C2)s1 ZINC000374421486 387453701 /nfs/dbraw/zinc/45/37/01/387453701.db2.gz OIJDHGXXJCXWEG-UHFFFAOYSA-N 1 2 247.367 2.348 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NCC1CCCC1 ZINC000336614127 387455235 /nfs/dbraw/zinc/45/52/35/387455235.db2.gz QETAIGDVORNWDQ-UHFFFAOYSA-N 1 2 233.315 2.124 20 0 BEADLO Cc1cc(NC(=O)N2CC[C@@H](C3CC3)C2)cc[nH+]1 ZINC000336614317 387455588 /nfs/dbraw/zinc/45/55/88/387455588.db2.gz UOJSZRQQNPCTON-GFCCVEGCSA-N 1 2 245.326 2.076 20 0 BEADLO C[C@]1(CNc2cc(NC3CC3)nc[nH+]2)CCCO1 ZINC000515513563 387385650 /nfs/dbraw/zinc/38/56/50/387385650.db2.gz FZURCLONEVBHRZ-CYBMUJFWSA-N 1 2 248.330 2.032 20 0 BEADLO C[C@]1(CNc2cc(NC3CC3)[nH+]cn2)CCCO1 ZINC000515513563 387385653 /nfs/dbraw/zinc/38/56/53/387385653.db2.gz FZURCLONEVBHRZ-CYBMUJFWSA-N 1 2 248.330 2.032 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H]1Cc2ccccc21 ZINC000336562657 387388630 /nfs/dbraw/zinc/38/86/30/387388630.db2.gz HJHNDHRXIXGLJQ-ZDUSSCGKSA-N 1 2 238.290 2.090 20 0 BEADLO CC[C@@H](C)NC(=O)C[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000361072924 387398711 /nfs/dbraw/zinc/39/87/11/387398711.db2.gz HWTBRJPINPYEKX-NEPJUHHUSA-N 1 2 246.354 2.478 20 0 BEADLO CC[C@@H](C)NC(=O)C[N@H+]1Cc2ccccc2[C@@H]1C ZINC000361072924 387398714 /nfs/dbraw/zinc/39/87/14/387398714.db2.gz HWTBRJPINPYEKX-NEPJUHHUSA-N 1 2 246.354 2.478 20 0 BEADLO CCCc1nc(C[N@@H+]2CCCOCC2)cs1 ZINC000374026366 387412717 /nfs/dbraw/zinc/41/27/17/387412717.db2.gz FFYSKGXIJFTTBZ-UHFFFAOYSA-N 1 2 240.372 2.318 20 0 BEADLO CCCc1nc(C[N@H+]2CCCOCC2)cs1 ZINC000374026366 387412722 /nfs/dbraw/zinc/41/27/22/387412722.db2.gz FFYSKGXIJFTTBZ-UHFFFAOYSA-N 1 2 240.372 2.318 20 0 BEADLO CC(C)c1nc(C[N@@H+]2CCCOCC2)cs1 ZINC000374027805 387413302 /nfs/dbraw/zinc/41/33/02/387413302.db2.gz UHMRZJZORUJKCA-UHFFFAOYSA-N 1 2 240.372 2.489 20 0 BEADLO CC(C)c1nc(C[N@H+]2CCCOCC2)cs1 ZINC000374027805 387413306 /nfs/dbraw/zinc/41/33/06/387413306.db2.gz UHMRZJZORUJKCA-UHFFFAOYSA-N 1 2 240.372 2.489 20 0 BEADLO C[C@@H](O)[C@@H]1CCN(c2[nH+]ccc3ccccc32)C1 ZINC000162697926 387494773 /nfs/dbraw/zinc/49/47/73/387494773.db2.gz PCPBOTXIAIVPJB-DGCLKSJQSA-N 1 2 242.322 2.442 20 0 BEADLO CCc1ccc(C[N@H+](C)Cc2ccnn2C)o1 ZINC000355279021 387511011 /nfs/dbraw/zinc/51/10/11/387511011.db2.gz LGKVGPHPQMFPFP-UHFFFAOYSA-N 1 2 233.315 2.208 20 0 BEADLO CCc1ccc(C[N@@H+](C)Cc2ccnn2C)o1 ZINC000355279021 387511015 /nfs/dbraw/zinc/51/10/15/387511015.db2.gz LGKVGPHPQMFPFP-UHFFFAOYSA-N 1 2 233.315 2.208 20 0 BEADLO CC(C)(C)CC[N@@H+]1CC(F)(F)C[C@H]1CO ZINC000375252483 387520036 /nfs/dbraw/zinc/52/00/36/387520036.db2.gz IQLKWSHPRJBLSA-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)(C)CC[N@H+]1CC(F)(F)C[C@H]1CO ZINC000375252483 387520040 /nfs/dbraw/zinc/52/00/40/387520040.db2.gz IQLKWSHPRJBLSA-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO C[C@H]([NH2+]Cc1ccon1)c1cncc(F)c1 ZINC000122434013 387529084 /nfs/dbraw/zinc/52/90/84/387529084.db2.gz SWXZANDEWZXNKN-QMMMGPOBSA-N 1 2 221.235 2.060 20 0 BEADLO O=C(NCC1CC1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000030607284 387536122 /nfs/dbraw/zinc/53/61/22/387536122.db2.gz MVSMLRCQGUTAHG-UHFFFAOYSA-N 1 2 241.294 2.012 20 0 BEADLO COC(=O)[C@@H](CC(F)F)[NH2+]C[C@@H]1CC=CCC1 ZINC000355048833 387470713 /nfs/dbraw/zinc/47/07/13/387470713.db2.gz KHMKWUWLOCKTHK-NXEZZACHSA-N 1 2 247.285 2.129 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N3C[C@@H](C)[C@H]3C)ccn12 ZINC000516193668 387473374 /nfs/dbraw/zinc/47/33/74/387473374.db2.gz WFOGKAQFMUUCMT-MWLCHTKSSA-N 1 2 243.310 2.123 20 0 BEADLO C(c1noc(C2CC2)n1)[NH+]1C2CCC1CC2 ZINC000516197449 387478191 /nfs/dbraw/zinc/47/81/91/387478191.db2.gz UBASBSHAAVWCKP-UHFFFAOYSA-N 1 2 219.288 2.074 20 0 BEADLO Cc1cn2c([nH+]1)CN(C(=O)[C@@H](C)C(C)(C)C)CC2 ZINC000374691194 387481480 /nfs/dbraw/zinc/48/14/80/387481480.db2.gz CODJQNZXUUJZIH-LLVKDONJSA-N 1 2 249.358 2.216 20 0 BEADLO COC(=O)C[N@H+](C/C=C\c1ccccc1)C1CC1 ZINC000355139865 387486036 /nfs/dbraw/zinc/48/60/36/387486036.db2.gz VHBGHSCGHHVUTK-YVMONPNESA-N 1 2 245.322 2.337 20 0 BEADLO COC(=O)C[N@@H+](C/C=C\c1ccccc1)C1CC1 ZINC000355139865 387486038 /nfs/dbraw/zinc/48/60/38/387486038.db2.gz VHBGHSCGHHVUTK-YVMONPNESA-N 1 2 245.322 2.337 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1c(O)cccc1F ZINC000123637573 387588701 /nfs/dbraw/zinc/58/87/01/387588701.db2.gz BTCIBUUSYUKFBM-UHFFFAOYSA-N 1 2 246.241 2.487 20 0 BEADLO Cc1cc(NC(=O)N2CCC[C@H]2C2CC2)cc[nH+]1 ZINC000367216224 387593041 /nfs/dbraw/zinc/59/30/41/387593041.db2.gz SWPOEICRBKTVPD-ZDUSSCGKSA-N 1 2 245.326 2.218 20 0 BEADLO CN(C[C@H]1CC=CCC1)C(=O)CCc1[nH]cc[nH+]1 ZINC000355917635 387595098 /nfs/dbraw/zinc/59/50/98/387595098.db2.gz YQTZRKUXDULQNR-LBPRGKRZSA-N 1 2 247.342 2.157 20 0 BEADLO Fc1ccc(OCCOCc2[nH]cc[nH+]2)cc1 ZINC000123860420 387595717 /nfs/dbraw/zinc/59/57/17/387595717.db2.gz OFAABRNYYQLDSQ-UHFFFAOYSA-N 1 2 236.246 2.144 20 0 BEADLO COC1(C)C[NH+](Cc2ccc(F)c(C)c2)C1 ZINC000362319259 387597175 /nfs/dbraw/zinc/59/71/75/387597175.db2.gz GADFJWVDOWVZGD-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO CC1=C[C@H](C)C[N@@H+](Cc2ncnn2CC(C)C)C1 ZINC000430258782 387601116 /nfs/dbraw/zinc/60/11/16/387601116.db2.gz DCWDRSXJUSIORS-LBPRGKRZSA-N 1 2 248.374 2.332 20 0 BEADLO CC1=C[C@H](C)C[N@H+](Cc2ncnn2CC(C)C)C1 ZINC000430258782 387601119 /nfs/dbraw/zinc/60/11/19/387601119.db2.gz DCWDRSXJUSIORS-LBPRGKRZSA-N 1 2 248.374 2.332 20 0 BEADLO c1[nH]cc(-c2ccc3c(c2)CCOC3)[nH+]1 ZINC000527531534 387603529 /nfs/dbraw/zinc/60/35/29/387603529.db2.gz CIRHBSBCZZFRSE-UHFFFAOYSA-N 1 2 200.241 2.149 20 0 BEADLO Cc1cc(N[C@@H]2C[C@H]2C2CC2)nc(C2CC2)[nH+]1 ZINC000362375615 387604017 /nfs/dbraw/zinc/60/40/17/387604017.db2.gz KGPFVSCHQRMFOD-NWDGAFQWSA-N 1 2 229.327 2.295 20 0 BEADLO C[C@@H]1C[C@H](CSCCn2cc[nH+]c2)CCO1 ZINC000362457245 387614194 /nfs/dbraw/zinc/61/41/94/387614194.db2.gz PJCXYEJSAVDMQP-VXGBXAGGSA-N 1 2 240.372 2.431 20 0 BEADLO Cc1cc(NC(=O)NC23CCC(CC2)C3)cc[nH+]1 ZINC000376358035 387624562 /nfs/dbraw/zinc/62/45/62/387624562.db2.gz ZGLJRQSPLRVBMH-UHFFFAOYSA-N 1 2 245.326 2.266 20 0 BEADLO CCC[C@@](C)(CC)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000527246441 387549612 /nfs/dbraw/zinc/54/96/12/387549612.db2.gz QAECWGYAQDLRAL-CQSZACIVSA-N 1 2 249.358 2.483 20 0 BEADLO CCCC(C)(C)CC(=O)NCCc1[nH]cc[nH+]1 ZINC000426300903 387555090 /nfs/dbraw/zinc/55/50/90/387555090.db2.gz KJOCCWSRLFELOS-UHFFFAOYSA-N 1 2 237.347 2.285 20 0 BEADLO FCCCC[N@@H+]1CCOC[C@@H]1c1ccco1 ZINC000375687731 387566447 /nfs/dbraw/zinc/56/64/47/387566447.db2.gz GZAYVQSZFUMTLF-LLVKDONJSA-N 1 2 227.279 2.403 20 0 BEADLO FCCCC[N@H+]1CCOC[C@@H]1c1ccco1 ZINC000375687731 387566448 /nfs/dbraw/zinc/56/64/48/387566448.db2.gz GZAYVQSZFUMTLF-LLVKDONJSA-N 1 2 227.279 2.403 20 0 BEADLO CC[C@@H]([NH2+]C1CC(c2ccccc2)C1)C(=O)OC ZINC000279716839 387568495 /nfs/dbraw/zinc/56/84/95/387568495.db2.gz INUQBADNRDJUJN-JXQTWKCFSA-N 1 2 247.338 2.474 20 0 BEADLO CC[C@H](F)C[N@H+](C)[C@@H](C)C(=O)OC(C)(C)C ZINC000440776228 387694527 /nfs/dbraw/zinc/69/45/27/387694527.db2.gz BRUJBFGKMFAZHO-UWVGGRQHSA-N 1 2 233.327 2.397 20 0 BEADLO CC[C@H](F)C[N@@H+](C)[C@@H](C)C(=O)OC(C)(C)C ZINC000440776228 387694536 /nfs/dbraw/zinc/69/45/36/387694536.db2.gz BRUJBFGKMFAZHO-UWVGGRQHSA-N 1 2 233.327 2.397 20 0 BEADLO Cc1cc(NC[C@H]2CCCS2)nc(C2CC2)[nH+]1 ZINC000362560026 387630856 /nfs/dbraw/zinc/63/08/56/387630856.db2.gz JKCWSLFPOQYLSN-LLVKDONJSA-N 1 2 249.383 2.392 20 0 BEADLO CC[C@H](F)C[N@H+](C)[C@H](C)C(=O)OC(C)C ZINC000440778420 387694756 /nfs/dbraw/zinc/69/47/56/387694756.db2.gz KLCXSIPRCAFWHP-ZJUUUORDSA-N 1 2 219.300 2.006 20 0 BEADLO CC[C@H](F)C[N@@H+](C)[C@H](C)C(=O)OC(C)C ZINC000440778420 387694761 /nfs/dbraw/zinc/69/47/61/387694761.db2.gz KLCXSIPRCAFWHP-ZJUUUORDSA-N 1 2 219.300 2.006 20 0 BEADLO CC(C)c1ncc2c(n1)CC[N@@H+](CC(F)F)C2 ZINC000527621267 387639713 /nfs/dbraw/zinc/63/97/13/387639713.db2.gz DJTQYCHLQUHTTQ-UHFFFAOYSA-N 1 2 241.285 2.223 20 0 BEADLO CC(C)c1ncc2c(n1)CC[N@H+](CC(F)F)C2 ZINC000527621267 387639716 /nfs/dbraw/zinc/63/97/16/387639716.db2.gz DJTQYCHLQUHTTQ-UHFFFAOYSA-N 1 2 241.285 2.223 20 0 BEADLO Cc1cc(C(=O)Nc2cc[nH+]cc2O)oc1C ZINC000125122007 387643185 /nfs/dbraw/zinc/64/31/85/387643185.db2.gz TULHPUSKEWNVAU-UHFFFAOYSA-N 1 2 232.239 2.249 20 0 BEADLO C[C@@H](CC(=O)Nc1ccccc1)[NH2+]CC(F)F ZINC000306063506 387675066 /nfs/dbraw/zinc/67/50/66/387675066.db2.gz XSFYRJSLWHILGK-VIFPVBQESA-N 1 2 242.269 2.258 20 0 BEADLO CCOC(=O)C[N@H+](CC(C)C)C[C@H](F)CC ZINC000440705165 387675149 /nfs/dbraw/zinc/67/51/49/387675149.db2.gz OYCOJDLTBLIXJJ-LLVKDONJSA-N 1 2 233.327 2.256 20 0 BEADLO CCOC(=O)C[N@@H+](CC(C)C)C[C@H](F)CC ZINC000440705165 387675158 /nfs/dbraw/zinc/67/51/58/387675158.db2.gz OYCOJDLTBLIXJJ-LLVKDONJSA-N 1 2 233.327 2.256 20 0 BEADLO CCN(CC)C(=O)N[C@H](C)c1[nH+]ccn1CC ZINC000451932948 387680028 /nfs/dbraw/zinc/68/00/28/387680028.db2.gz OFBKTMPRKOZMPF-SNVBAGLBSA-N 1 2 238.335 2.015 20 0 BEADLO CC[C@@H](F)C[N@H+](CCOC)Cc1ccco1 ZINC000440714179 387681024 /nfs/dbraw/zinc/68/10/24/387681024.db2.gz OHXXHTCHSAOQSR-LLVKDONJSA-N 1 2 229.295 2.476 20 0 BEADLO CC[C@@H](F)C[N@@H+](CCOC)Cc1ccco1 ZINC000440714179 387681030 /nfs/dbraw/zinc/68/10/30/387681030.db2.gz OHXXHTCHSAOQSR-LLVKDONJSA-N 1 2 229.295 2.476 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCCSC1)C(=O)OC(C)(C)C ZINC000126455920 387681992 /nfs/dbraw/zinc/68/19/92/387681992.db2.gz NOHWSLQSQZDZAU-VHSXEESVSA-N 1 2 245.388 2.202 20 0 BEADLO CCOC(=O)C[N@H+](C[C@H](F)CC)C(C)(C)C ZINC000440767646 387690744 /nfs/dbraw/zinc/69/07/44/387690744.db2.gz UENNXCPMUSMGCQ-SNVBAGLBSA-N 1 2 233.327 2.398 20 0 BEADLO CCOC(=O)C[N@@H+](C[C@H](F)CC)C(C)(C)C ZINC000440767646 387690747 /nfs/dbraw/zinc/69/07/47/387690747.db2.gz UENNXCPMUSMGCQ-SNVBAGLBSA-N 1 2 233.327 2.398 20 0 BEADLO CCC[C@@H]1C[N@H+](C[C@@H](F)CC)CCO1 ZINC000440771604 387691002 /nfs/dbraw/zinc/69/10/02/387691002.db2.gz RLCONZCVPIFULB-WDEREUQCSA-N 1 2 203.301 2.235 20 0 BEADLO CCC[C@@H]1C[N@@H+](C[C@@H](F)CC)CCO1 ZINC000440771604 387691006 /nfs/dbraw/zinc/69/10/06/387691006.db2.gz RLCONZCVPIFULB-WDEREUQCSA-N 1 2 203.301 2.235 20 0 BEADLO CC(C)c1nc(N[C@@H]2CCO[C@@H]2C2CC2)cc[nH+]1 ZINC000363163205 387693820 /nfs/dbraw/zinc/69/38/20/387693820.db2.gz UJXCVMWNNPICLM-DGCLKSJQSA-N 1 2 247.342 2.001 20 0 BEADLO CC[C@@H](C)[C@@H](C)C(=O)Nc1ccc(N)[nH+]c1 ZINC000422794320 387696847 /nfs/dbraw/zinc/69/68/47/387696847.db2.gz UCZBSDOVSFPFPV-RKDXNWHRSA-N 1 2 221.304 2.115 20 0 BEADLO CNC(=O)c1ccc(COc2cc[nH+]cc2)cc1 ZINC000431501264 387712637 /nfs/dbraw/zinc/71/26/37/387712637.db2.gz DOXVSORSLUXNSW-UHFFFAOYSA-N 1 2 242.278 2.020 20 0 BEADLO COc1cc(C)nc(COc2cc[nH+]cc2)c1 ZINC000431514004 387717250 /nfs/dbraw/zinc/71/72/50/387717250.db2.gz OGYQATUNKZOFRZ-UHFFFAOYSA-N 1 2 230.267 2.373 20 0 BEADLO FC1(F)CC[N@@H+](C2CCSCC2)C1 ZINC000306353040 387727618 /nfs/dbraw/zinc/72/76/18/387727618.db2.gz ARYFPHWFPNYRPC-UHFFFAOYSA-N 1 2 207.289 2.223 20 0 BEADLO FC1(F)CC[N@H+](C2CCSCC2)C1 ZINC000306353040 387727625 /nfs/dbraw/zinc/72/76/25/387727625.db2.gz ARYFPHWFPNYRPC-UHFFFAOYSA-N 1 2 207.289 2.223 20 0 BEADLO COc1ccc[nH+]c1NC[C@](C)(O)c1ccco1 ZINC000527905035 387762705 /nfs/dbraw/zinc/76/27/05/387762705.db2.gz GAIVQKLDFJKLRB-ZDUSSCGKSA-N 1 2 248.282 2.003 20 0 BEADLO CC(C)c1nc(N2CC[C@@]3(CCOC3)C2)cc[nH+]1 ZINC000129201008 387765037 /nfs/dbraw/zinc/76/50/37/387765037.db2.gz OOLQSFMSBCVOPG-CQSZACIVSA-N 1 2 247.342 2.217 20 0 BEADLO COc1ccc[nH+]c1N1C[C@H](C)[C@H](C)C1 ZINC000527911542 387765116 /nfs/dbraw/zinc/76/51/16/387765116.db2.gz PVJYHHOFCZVFEV-AOOOYVTPSA-N 1 2 206.289 2.182 20 0 BEADLO CCc1ccc(CC[NH2+][C@H](CC)C(=O)OC)cc1 ZINC000192850479 387771730 /nfs/dbraw/zinc/77/17/30/387771730.db2.gz SUSPXJZBFWAZPO-CQSZACIVSA-N 1 2 249.354 2.333 20 0 BEADLO Cc1cc(F)cc(NC(=O)CCn2cc[nH+]c2)c1 ZINC000432206156 387774975 /nfs/dbraw/zinc/77/49/75/387774975.db2.gz FHLRBZFQFBXSBB-UHFFFAOYSA-N 1 2 247.273 2.359 20 0 BEADLO Cc1cc(NC(=O)NC[C@H]2CC[C@H](C)C2)cc[nH+]1 ZINC000432269450 387778912 /nfs/dbraw/zinc/77/89/12/387778912.db2.gz JLRJMOIRBMUZNA-JQWIXIFHSA-N 1 2 247.342 2.370 20 0 BEADLO c1coc([C@H]2CC[N@@H+](Cc3csnn3)C2)c1 ZINC000378345238 387779353 /nfs/dbraw/zinc/77/93/53/387779353.db2.gz IHPAUCKJMSORLE-VIFPVBQESA-N 1 2 235.312 2.121 20 0 BEADLO c1coc([C@H]2CC[N@H+](Cc3csnn3)C2)c1 ZINC000378345238 387779357 /nfs/dbraw/zinc/77/93/57/387779357.db2.gz IHPAUCKJMSORLE-VIFPVBQESA-N 1 2 235.312 2.121 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC[C@H]1CC[C@H](C)C1 ZINC000432269222 387779673 /nfs/dbraw/zinc/77/96/73/387779673.db2.gz JEBLKUYUDSXJGD-JQWIXIFHSA-N 1 2 247.342 2.370 20 0 BEADLO CC[C@@H](COC)Nc1cc[nH+]c(C(C)C)n1 ZINC000150916352 387780584 /nfs/dbraw/zinc/78/05/84/387780584.db2.gz FMJHAKLLZNRZJV-JTQLQIEISA-N 1 2 223.320 2.437 20 0 BEADLO COC1(C)CN(c2[nH+]ccc3ccccc32)C1 ZINC000527944653 387780871 /nfs/dbraw/zinc/78/08/71/387780871.db2.gz OOKBSTOLHYQKTK-UHFFFAOYSA-N 1 2 228.295 2.460 20 0 BEADLO Cc1n[nH]c(C)c1CNc1ccc(N(C)C)c[nH+]1 ZINC000150904183 387781307 /nfs/dbraw/zinc/78/13/07/387781307.db2.gz PLJDWUASNAEMFZ-UHFFFAOYSA-N 1 2 245.330 2.100 20 0 BEADLO COc1ccc[nH+]c1N1CCC(C)(OC)CC1 ZINC000527943519 387781839 /nfs/dbraw/zinc/78/18/39/387781839.db2.gz AEBTUCJGDGLSEZ-UHFFFAOYSA-N 1 2 236.315 2.096 20 0 BEADLO FC(F)OCCCNc1cccc[nH+]1 ZINC000193616719 387797550 /nfs/dbraw/zinc/79/75/50/387797550.db2.gz FRLQLRJKXYVQEQ-UHFFFAOYSA-N 1 2 202.204 2.123 20 0 BEADLO CCCc1nc(C[N@H+](CC)C(C)C)no1 ZINC000194004977 387813352 /nfs/dbraw/zinc/81/33/52/387813352.db2.gz LMTCAOWBARBOBF-UHFFFAOYSA-N 1 2 211.309 2.252 20 0 BEADLO CCCc1nc(C[N@@H+](CC)C(C)C)no1 ZINC000194004977 387813356 /nfs/dbraw/zinc/81/33/56/387813356.db2.gz LMTCAOWBARBOBF-UHFFFAOYSA-N 1 2 211.309 2.252 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CCO[C@@H](C2CC2)C1 ZINC000527961069 387809934 /nfs/dbraw/zinc/80/99/34/387809934.db2.gz AUTIIUXXSLKLKA-DGCLKSJQSA-N 1 2 248.326 2.460 20 0 BEADLO CSc1ccc(C[N@@H+]2CCO[C@H]3C[C@H]32)cc1 ZINC000367831860 387757465 /nfs/dbraw/zinc/75/74/65/387757465.db2.gz KPIPLAIBUVTUOI-OLZOCXBDSA-N 1 2 235.352 2.382 20 0 BEADLO CSc1ccc(C[N@H+]2CCO[C@H]3C[C@H]32)cc1 ZINC000367831860 387757474 /nfs/dbraw/zinc/75/74/74/387757474.db2.gz KPIPLAIBUVTUOI-OLZOCXBDSA-N 1 2 235.352 2.382 20 0 BEADLO c1nc(C[N@H+]2CCC[C@H](OCC3CC3)C2)co1 ZINC000432923012 387840359 /nfs/dbraw/zinc/84/03/59/387840359.db2.gz CPRRXOVSFWRPTH-ZDUSSCGKSA-N 1 2 236.315 2.066 20 0 BEADLO c1nc(C[N@@H+]2CCC[C@H](OCC3CC3)C2)co1 ZINC000432923012 387840363 /nfs/dbraw/zinc/84/03/63/387840363.db2.gz CPRRXOVSFWRPTH-ZDUSSCGKSA-N 1 2 236.315 2.066 20 0 BEADLO C[N@H+](CCc1ccccc1O)Cc1cocn1 ZINC000432913766 387840840 /nfs/dbraw/zinc/84/08/40/387840840.db2.gz BHCXBOUBNOZSCD-UHFFFAOYSA-N 1 2 232.283 2.055 20 0 BEADLO C[N@@H+](CCc1ccccc1O)Cc1cocn1 ZINC000432913766 387840844 /nfs/dbraw/zinc/84/08/44/387840844.db2.gz BHCXBOUBNOZSCD-UHFFFAOYSA-N 1 2 232.283 2.055 20 0 BEADLO CCCSCC(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000442802424 387844622 /nfs/dbraw/zinc/84/46/22/387844622.db2.gz RAUPVFHNOPKPEN-SECBINFHSA-N 1 2 241.360 2.120 20 0 BEADLO CC[C@@H]1CCC[C@H]1CNC(=O)CCc1[nH]cc[nH+]1 ZINC000452513075 387845321 /nfs/dbraw/zinc/84/53/21/387845321.db2.gz AAMOCHCYNYIBAP-NEPJUHHUSA-N 1 2 249.358 2.285 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1CCC[C@@H]2OCC[C@@H]21 ZINC000582576400 387852411 /nfs/dbraw/zinc/85/24/11/387852411.db2.gz LZGIGRZQNDTOLH-UPJWGTAASA-N 1 2 247.342 2.463 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)CC1CC(C)(C)C1 ZINC000452571070 387861711 /nfs/dbraw/zinc/86/17/11/387861711.db2.gz NLQACOQWRRBLGE-UHFFFAOYSA-N 1 2 249.358 2.346 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)CC(C)(C)CC ZINC000452571016 387861990 /nfs/dbraw/zinc/86/19/90/387861990.db2.gz NEQMLFUQQPDGPK-UHFFFAOYSA-N 1 2 237.347 2.346 20 0 BEADLO Cc1nc(N[C@@H]2[C@H](C)O[C@@H](C)[C@H]2C)cc[nH+]1 ZINC000528207195 387871304 /nfs/dbraw/zinc/87/13/04/387871304.db2.gz OZPWAMKHBGNINW-ARHDFHRDSA-N 1 2 221.304 2.009 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H]1C[C@@H](C)O[C@H]1C ZINC000528034137 387818031 /nfs/dbraw/zinc/81/80/31/387818031.db2.gz GNZSPLCSUCCVMO-VWYCJHECSA-N 1 2 236.315 2.316 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)[C@]1(C)CCC[C@H]1C ZINC000448708880 387893614 /nfs/dbraw/zinc/89/36/14/387893614.db2.gz NDWODINSWLSBIO-YRGRVCCFSA-N 1 2 249.358 2.214 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000448709505 387896306 /nfs/dbraw/zinc/89/63/06/387896306.db2.gz PZLPVEQZDFRFNJ-JHJVBQTASA-N 1 2 249.358 2.070 20 0 BEADLO COc1cccc2c1cc[nH+]c2NCC1COC1 ZINC000528227255 387882304 /nfs/dbraw/zinc/88/23/04/387882304.db2.gz MPCULLVMUSJXTH-UHFFFAOYSA-N 1 2 244.294 2.302 20 0 BEADLO C[C@@H]1CC[C@H](Nc2ncnc3c2C[N@H+](C)CC3)C1 ZINC000443989613 387882517 /nfs/dbraw/zinc/88/25/17/387882517.db2.gz PCVBFBUXUSFGRO-MNOVXSKESA-N 1 2 246.358 2.065 20 0 BEADLO C[C@@H]1CC[C@H](Nc2ncnc3c2C[N@@H+](C)CC3)C1 ZINC000443989613 387882520 /nfs/dbraw/zinc/88/25/20/387882520.db2.gz PCVBFBUXUSFGRO-MNOVXSKESA-N 1 2 246.358 2.065 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2C[C@H]2C2CCCCC2)c[nH+]1 ZINC000266597350 387883642 /nfs/dbraw/zinc/88/36/42/387883642.db2.gz RNISHEYURSOWMY-NWDGAFQWSA-N 1 2 247.342 2.417 20 0 BEADLO CC[C@H]1C[N@H+](C/C=C(\C)Cl)CCO1 ZINC000528354219 387908583 /nfs/dbraw/zinc/90/85/83/387908583.db2.gz WKCCHFAAEPRQLY-LLGDCAAFSA-N 1 2 203.713 2.240 20 0 BEADLO CC[C@H]1C[N@@H+](C/C=C(\C)Cl)CCO1 ZINC000528354219 387908585 /nfs/dbraw/zinc/90/85/85/387908585.db2.gz WKCCHFAAEPRQLY-LLGDCAAFSA-N 1 2 203.713 2.240 20 0 BEADLO CC[C@@H]1C[N@H+](C/C=C(\C)Cl)CCO1 ZINC000528354221 387908672 /nfs/dbraw/zinc/90/86/72/387908672.db2.gz WKCCHFAAEPRQLY-WXLQGSQKSA-N 1 2 203.713 2.240 20 0 BEADLO CC[C@@H]1C[N@@H+](C/C=C(\C)Cl)CCO1 ZINC000528354221 387908674 /nfs/dbraw/zinc/90/86/74/387908674.db2.gz WKCCHFAAEPRQLY-WXLQGSQKSA-N 1 2 203.713 2.240 20 0 BEADLO Cc1n[nH]c(C)c1C[N@@H+]1CCc2ncsc2C1 ZINC000438366029 387929208 /nfs/dbraw/zinc/92/92/08/387929208.db2.gz UAYJZEWLUANKCE-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO Cc1n[nH]c(C)c1C[N@H+]1CCc2ncsc2C1 ZINC000438366029 387929210 /nfs/dbraw/zinc/92/92/10/387929210.db2.gz UAYJZEWLUANKCE-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO Cc1cccnc1C[N@@H+]1CCc2ncsc2C1 ZINC000438363201 387929479 /nfs/dbraw/zinc/92/94/79/387929479.db2.gz ZREZNYVQRADMCN-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1cccnc1C[N@H+]1CCc2ncsc2C1 ZINC000438363201 387929482 /nfs/dbraw/zinc/92/94/82/387929482.db2.gz ZREZNYVQRADMCN-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cncs2)[C@H](C)[C@H](C)O1 ZINC000438363936 387928925 /nfs/dbraw/zinc/92/89/25/387928925.db2.gz MOLVBLHXTZXZJW-BBBLOLIVSA-N 1 2 226.345 2.141 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cncs2)[C@H](C)[C@H](C)O1 ZINC000438363936 387928929 /nfs/dbraw/zinc/92/89/29/387928929.db2.gz MOLVBLHXTZXZJW-BBBLOLIVSA-N 1 2 226.345 2.141 20 0 BEADLO CC(C)C(=O)c1ccc(NC(=O)C[NH+](C)C)cc1 ZINC000452927982 387939378 /nfs/dbraw/zinc/93/93/78/387939378.db2.gz FJJJFWPTAUQUDY-UHFFFAOYSA-N 1 2 248.326 2.025 20 0 BEADLO C[C@@H]1CCCN(c2cc(NC3CC3)[nH+]cn2)C1 ZINC000244202196 387940899 /nfs/dbraw/zinc/94/08/99/387940899.db2.gz VPIXDRQHEIOFOB-SNVBAGLBSA-N 1 2 232.331 2.287 20 0 BEADLO C[C@@H]1CCCN(c2cc(NC3CC3)nc[nH+]2)C1 ZINC000244202196 387940902 /nfs/dbraw/zinc/94/09/02/387940902.db2.gz VPIXDRQHEIOFOB-SNVBAGLBSA-N 1 2 232.331 2.287 20 0 BEADLO C[C@@H](c1ccccc1)[C@H](O)C[N@H+](C)CC(F)F ZINC000450352229 387957269 /nfs/dbraw/zinc/95/72/69/387957269.db2.gz BNZWXUAVUZKOFP-CMPLNLGQSA-N 1 2 243.297 2.348 20 0 BEADLO C[C@@H](c1ccccc1)[C@H](O)C[N@@H+](C)CC(F)F ZINC000450352229 387957270 /nfs/dbraw/zinc/95/72/70/387957270.db2.gz BNZWXUAVUZKOFP-CMPLNLGQSA-N 1 2 243.297 2.348 20 0 BEADLO CC[C@@H](C)[NH2+][C@H](c1cn[nH]n1)c1ccc(F)cc1 ZINC000453056854 387975339 /nfs/dbraw/zinc/97/53/39/387975339.db2.gz LVRXTHCLZXFWMW-RNCFNFMXSA-N 1 2 248.305 2.421 20 0 BEADLO CC[C@@H](C)[NH2+][C@H](c1c[nH]nn1)c1ccc(F)cc1 ZINC000453056854 387975344 /nfs/dbraw/zinc/97/53/44/387975344.db2.gz LVRXTHCLZXFWMW-RNCFNFMXSA-N 1 2 248.305 2.421 20 0 BEADLO Cc1nc(N2CCC[C@@H]([C@H]3CCOC3)C2)cc[nH+]1 ZINC000439073512 387977949 /nfs/dbraw/zinc/97/79/49/387977949.db2.gz CPUKMSPBMIBMRC-OLZOCXBDSA-N 1 2 247.342 2.038 20 0 BEADLO OCC[N@H+](Cc1ncc(Cl)s1)C1CCC1 ZINC000439299436 387994305 /nfs/dbraw/zinc/99/43/05/387994305.db2.gz QJABYRARZZDKAB-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO OCC[N@@H+](Cc1ncc(Cl)s1)C1CCC1 ZINC000439299436 387994308 /nfs/dbraw/zinc/99/43/08/387994308.db2.gz QJABYRARZZDKAB-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC[C@H]1CCC[C@@H]1C ZINC000439431108 387998504 /nfs/dbraw/zinc/99/85/04/387998504.db2.gz LPJKKGXOQFWIER-CMPLNLGQSA-N 1 2 247.342 2.370 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC[C@H]1CCC[C@H]1C ZINC000439431111 387998656 /nfs/dbraw/zinc/99/86/56/387998656.db2.gz LPJKKGXOQFWIER-ZYHUDNBSSA-N 1 2 247.342 2.370 20 0 BEADLO Cc1cc(NC(=O)NC[C@@H]2CCC[C@@H]2C)cc[nH+]1 ZINC000439453913 387998910 /nfs/dbraw/zinc/99/89/10/387998910.db2.gz PELVVBQLAPICBM-JQWIXIFHSA-N 1 2 247.342 2.370 20 0 BEADLO CC[C@@H](COC)Nc1ccc2c(c1)CC[NH2+]2 ZINC000423220818 388002263 /nfs/dbraw/zinc/00/22/63/388002263.db2.gz VVSLZYXIONNMQF-NSHDSACASA-N 1 2 220.316 2.492 20 0 BEADLO Cc1cnc(C[N@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)s1 ZINC000446083996 387996382 /nfs/dbraw/zinc/99/63/82/387996382.db2.gz STTVPYPEMJUVGI-INTQDDNPSA-N 1 2 240.372 2.449 20 0 BEADLO Cc1cnc(C[N@@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)s1 ZINC000446083996 387996386 /nfs/dbraw/zinc/99/63/86/387996386.db2.gz STTVPYPEMJUVGI-INTQDDNPSA-N 1 2 240.372 2.449 20 0 BEADLO Cc1csc(C[N@H+]2C[C@H](C)OC[C@H]2C)n1 ZINC000246171552 388016262 /nfs/dbraw/zinc/01/62/62/388016262.db2.gz FPCJABFDCLMOBO-ZJUUUORDSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1csc(C[N@@H+]2C[C@H](C)OC[C@H]2C)n1 ZINC000246171552 388016265 /nfs/dbraw/zinc/01/62/65/388016265.db2.gz FPCJABFDCLMOBO-ZJUUUORDSA-N 1 2 226.345 2.061 20 0 BEADLO CC[C@@H]([NH2+][C@H]1CCCc2c1cnn2C)C(F)F ZINC000453233025 388017730 /nfs/dbraw/zinc/01/77/30/388017730.db2.gz GTVNPUNZZMNPBH-ZJUUUORDSA-N 1 2 243.301 2.431 20 0 BEADLO Cc1cc(NC(=O)c2cscn2)cc[nH+]1 ZINC000082259120 388019298 /nfs/dbraw/zinc/01/92/98/388019298.db2.gz LVOHSVILVGAPAT-UHFFFAOYSA-N 1 2 219.269 2.099 20 0 BEADLO CC[C@@H]([NH2+][C@@H]1CCCc2nn(C)cc21)C(F)F ZINC000453246139 388023332 /nfs/dbraw/zinc/02/33/32/388023332.db2.gz MJHRAUIZPLTEIQ-NXEZZACHSA-N 1 2 243.301 2.431 20 0 BEADLO CC[C@H](N[C@H](C)c1[nH+]ccn1C)C(F)F ZINC000453252164 388027177 /nfs/dbraw/zinc/02/71/77/388027177.db2.gz UUUWTQOAIWGRHZ-SFYZADRCSA-N 1 2 217.263 2.114 20 0 BEADLO Cc1cc(N2CCC(C)(F)CC2)nc[nH+]1 ZINC000631514089 388031838 /nfs/dbraw/zinc/03/18/38/388031838.db2.gz AQRWQZMTUNDIFL-UHFFFAOYSA-N 1 2 209.268 2.113 20 0 BEADLO CC[C@](C)(O)CNc1cc(C)[nH+]c(C(C)C)n1 ZINC000083421408 388051230 /nfs/dbraw/zinc/05/12/30/388051230.db2.gz HSOFRVQCTSLLQD-ZDUSSCGKSA-N 1 2 237.347 2.481 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCC[C@@H](c2n[nH]c(C)n2)C1 ZINC000440518092 388051731 /nfs/dbraw/zinc/05/17/31/388051731.db2.gz JHJJCJYEMDMSAI-GHMZBOCLSA-N 1 2 240.326 2.041 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCC[C@@H](c2n[nH]c(C)n2)C1 ZINC000440518092 388051734 /nfs/dbraw/zinc/05/17/34/388051734.db2.gz JHJJCJYEMDMSAI-GHMZBOCLSA-N 1 2 240.326 2.041 20 0 BEADLO Cc1nnc(C[NH2+]C2(c3ccccc3C)CC2)[nH]1 ZINC000645980741 388114686 /nfs/dbraw/zinc/11/46/86/388114686.db2.gz GSBHNQVALAUYPB-UHFFFAOYSA-N 1 2 242.326 2.200 20 0 BEADLO CC(C)(C)C(C)(C)C(=O)NCCc1[nH]cc[nH+]1 ZINC000336658641 388078737 /nfs/dbraw/zinc/07/87/37/388078737.db2.gz OKPAAAVZGBKDKZ-UHFFFAOYSA-N 1 2 237.347 2.141 20 0 BEADLO CCO[C@H]1C[C@H]([NH2+]Cc2ccn[nH]2)C12CCCC2 ZINC000085680479 388094273 /nfs/dbraw/zinc/09/42/73/388094273.db2.gz KKCKLJCBISAYFG-STQMWFEESA-N 1 2 249.358 2.237 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N[C@@H]1C=CCCC1 ZINC000119182073 388106964 /nfs/dbraw/zinc/10/69/64/388106964.db2.gz IFPYIQXCOQJXPW-IDVQTMNDSA-N 1 2 245.326 2.141 20 0 BEADLO Cc1cc(C)c(CNC(=O)NC[C@@H]2C[C@@H]2C)c[nH+]1 ZINC000454263818 388110859 /nfs/dbraw/zinc/11/08/59/388110859.db2.gz GBSYWSTZXRREIH-JQWIXIFHSA-N 1 2 247.342 2.154 20 0 BEADLO Cc1cc(C)c(CNC(=O)NC[C@@H]2C[C@H]2C)c[nH+]1 ZINC000454263821 388110914 /nfs/dbraw/zinc/11/09/14/388110914.db2.gz GBSYWSTZXRREIH-PWSUYJOCSA-N 1 2 247.342 2.154 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+](C[C@@H](F)CC)C1CC1 ZINC000440512672 388046352 /nfs/dbraw/zinc/04/63/52/388046352.db2.gz NIATVKDLZLPVPD-ZJUUUORDSA-N 1 2 231.311 2.151 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+](C[C@@H](F)CC)C1CC1 ZINC000440512672 388046355 /nfs/dbraw/zinc/04/63/55/388046355.db2.gz NIATVKDLZLPVPD-ZJUUUORDSA-N 1 2 231.311 2.151 20 0 BEADLO CC[C@H](F)C[N@H+]([C@H](C)C(=O)OC)C1CCC1 ZINC000440522110 388048747 /nfs/dbraw/zinc/04/87/47/388048747.db2.gz YORQYIAAIXMEEZ-ZJUUUORDSA-N 1 2 231.311 2.151 20 0 BEADLO CC[C@H](F)C[N@@H+]([C@H](C)C(=O)OC)C1CCC1 ZINC000440522110 388048748 /nfs/dbraw/zinc/04/87/48/388048748.db2.gz YORQYIAAIXMEEZ-ZJUUUORDSA-N 1 2 231.311 2.151 20 0 BEADLO CCc1nocc1C[N@@H+]1CC[C@H](C)[C@H](F)C1 ZINC000646153344 388157260 /nfs/dbraw/zinc/15/72/60/388157260.db2.gz IRMSVPCHYQJJIP-GXSJLCMTSA-N 1 2 226.295 2.417 20 0 BEADLO CCc1nocc1C[N@H+]1CC[C@H](C)[C@H](F)C1 ZINC000646153344 388157262 /nfs/dbraw/zinc/15/72/62/388157262.db2.gz IRMSVPCHYQJJIP-GXSJLCMTSA-N 1 2 226.295 2.417 20 0 BEADLO CCC[C@H]([NH2+][C@H](C)Cc1ccoc1)C(=O)OC ZINC000449258796 388163356 /nfs/dbraw/zinc/16/33/56/388163356.db2.gz RBXBZHKECNSXOF-PWSUYJOCSA-N 1 2 239.315 2.142 20 0 BEADLO CC1(C)C[N@H+](Cc2cn[nH]c2)[C@H]1c1ccncc1 ZINC000646216906 388167226 /nfs/dbraw/zinc/16/72/26/388167226.db2.gz JAUNUVRTKYKGGU-ZDUSSCGKSA-N 1 2 242.326 2.388 20 0 BEADLO CC1(C)C[N@@H+](Cc2cn[nH]c2)[C@H]1c1ccncc1 ZINC000646216906 388167228 /nfs/dbraw/zinc/16/72/28/388167228.db2.gz JAUNUVRTKYKGGU-ZDUSSCGKSA-N 1 2 242.326 2.388 20 0 BEADLO Cc1nn(C(C)C)cc1C[NH2+]C(CF)CF ZINC000449378447 388187975 /nfs/dbraw/zinc/18/79/75/388187975.db2.gz DTJXFAMFRCYESV-UHFFFAOYSA-N 1 2 231.290 2.170 20 0 BEADLO FCC(CF)[NH2+]CC1=Cc2ccccc2OC1 ZINC000449378435 388188012 /nfs/dbraw/zinc/18/80/12/388188012.db2.gz DSXQYIYNYDPCOY-UHFFFAOYSA-N 1 2 239.265 2.360 20 0 BEADLO CC[C@@H]([NH2+]Cc1cnc(N(C)C)s1)C(F)F ZINC000449360014 388181582 /nfs/dbraw/zinc/18/15/82/388181582.db2.gz INWBXIKZBZKOTE-MRVPVSSYSA-N 1 2 249.330 2.342 20 0 BEADLO CC[C@@H]([NH2+]Cc1cncs1)C(F)F ZINC000449363987 388182445 /nfs/dbraw/zinc/18/24/45/388182445.db2.gz QTOAHKFYNZLWML-SSDOTTSWSA-N 1 2 206.261 2.276 20 0 BEADLO CC[C@H]([NH2+]Cc1nc(C)ccc1O)C(F)F ZINC000449364576 388183149 /nfs/dbraw/zinc/18/31/49/388183149.db2.gz SLNCMUSRZGPIOT-QMMMGPOBSA-N 1 2 230.258 2.229 20 0 BEADLO COC(=O)[C@H](Cc1ccccc1)[NH2+]C[C@@H]1C[C@H]1C ZINC000488526161 388183883 /nfs/dbraw/zinc/18/38/83/388183883.db2.gz FGPJWIBQVHUJAW-XBFCOCLRSA-N 1 2 247.338 2.016 20 0 BEADLO Cc1ccc(C[NH2+]C(CF)CF)s1 ZINC000449371954 388184867 /nfs/dbraw/zinc/18/48/67/388184867.db2.gz AIQIGQKIXGEAGO-UHFFFAOYSA-N 1 2 205.273 2.454 20 0 BEADLO FCC(CF)[NH2+]Cc1ccc(F)cc1 ZINC000449373185 388185411 /nfs/dbraw/zinc/18/54/11/388185411.db2.gz PBJGKZIRDSICMH-UHFFFAOYSA-N 1 2 203.207 2.223 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)N(C)Cc2[nH]cc[nH+]2)C[C@@H]1C ZINC000448935978 388121314 /nfs/dbraw/zinc/12/13/14/388121314.db2.gz KRLFURVULMAVPX-GRYCIOLGSA-N 1 2 249.358 2.440 20 0 BEADLO Cc1cc(NC(=O)[C@@]2(C)CC=CCC2)cc[nH+]1 ZINC000448960769 388123408 /nfs/dbraw/zinc/12/34/08/388123408.db2.gz HFEMWYVGZGRJFQ-AWEZNQCLSA-N 1 2 230.311 2.497 20 0 BEADLO CC[C@@H]1C[C@H]1NC(=O)NCc1c[nH+]c(C)cc1C ZINC000454912732 388139766 /nfs/dbraw/zinc/13/97/66/388139766.db2.gz NNSOZZCFPRPQNL-DGCLKSJQSA-N 1 2 247.342 2.296 20 0 BEADLO CCn1ccc(CN(C)c2cc(CO)cc[nH+]2)c1 ZINC000641529117 388151251 /nfs/dbraw/zinc/15/12/51/388151251.db2.gz XQXIRZBMLGFSJY-UHFFFAOYSA-N 1 2 245.326 2.032 20 0 BEADLO CCc1nnc(SCc2cn(C)c[nH+]2)s1 ZINC000641530247 388151318 /nfs/dbraw/zinc/15/13/18/388151318.db2.gz LPTJQQLYAZQFJG-UHFFFAOYSA-N 1 2 240.357 2.126 20 0 BEADLO Cc1ccc(N[C@@H]2CCCOCC2)c[nH+]1 ZINC000164844926 388249467 /nfs/dbraw/zinc/24/94/67/388249467.db2.gz BDUWZPKBTKDYMX-LLVKDONJSA-N 1 2 206.289 2.371 20 0 BEADLO CC[C@H]1CC[C@H]1[NH2+][C@@H](C)C(=O)OC(C)C ZINC000449658389 388249916 /nfs/dbraw/zinc/24/99/16/388249916.db2.gz AUAUHBKNBQAZPC-GARJFASQSA-N 1 2 213.321 2.105 20 0 BEADLO Cc1cccc(CC[NH2+][C@@H](C)C(=O)OC(C)C)c1 ZINC000449665502 388250772 /nfs/dbraw/zinc/25/07/72/388250772.db2.gz NDIQMSLRBLTSCQ-ZDUSSCGKSA-N 1 2 249.354 2.467 20 0 BEADLO CC1=CC[N@H+](CC2CC3CCC2O3)CC1 ZINC000450614150 388257313 /nfs/dbraw/zinc/25/73/13/388257313.db2.gz APQLUMZJMBLJNJ-JHJVBQTASA-N 1 2 207.317 2.206 20 0 BEADLO CC1=CC[N@@H+](CC2CC3CCC2O3)CC1 ZINC000450614150 388257315 /nfs/dbraw/zinc/25/73/15/388257315.db2.gz APQLUMZJMBLJNJ-JHJVBQTASA-N 1 2 207.317 2.206 20 0 BEADLO Cc1ccn2c(CNC(CF)CF)c[nH+]c2c1 ZINC000449380855 388189057 /nfs/dbraw/zinc/18/90/57/388189057.db2.gz PAQORBDNPMCDSD-UHFFFAOYSA-N 1 2 239.269 2.040 20 0 BEADLO Cc1ccn2c(C[NH2+]C(CF)CF)cnc2c1 ZINC000449380855 388189059 /nfs/dbraw/zinc/18/90/59/388189059.db2.gz PAQORBDNPMCDSD-UHFFFAOYSA-N 1 2 239.269 2.040 20 0 BEADLO FCC(CF)[NH2+]Cc1cc(F)cc(F)c1 ZINC000449382895 388189787 /nfs/dbraw/zinc/18/97/87/388189787.db2.gz ZDOSWSQZNAJALZ-UHFFFAOYSA-N 1 2 221.197 2.362 20 0 BEADLO COc1cc(C[N@@H+]2CC[C@@H](F)C2)cc(OC)c1 ZINC000449389516 388191446 /nfs/dbraw/zinc/19/14/46/388191446.db2.gz SMSVUMUHWHKVMH-LLVKDONJSA-N 1 2 239.290 2.248 20 0 BEADLO COc1cc(C[N@H+]2CC[C@@H](F)C2)cc(OC)c1 ZINC000449389516 388191449 /nfs/dbraw/zinc/19/14/49/388191449.db2.gz SMSVUMUHWHKVMH-LLVKDONJSA-N 1 2 239.290 2.248 20 0 BEADLO CC(C)[C@@H]1C[C@H]1CNC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000456325109 388194428 /nfs/dbraw/zinc/19/44/28/388194428.db2.gz VMCYWQOOJYXRIQ-QWRGUYRKSA-N 1 2 249.358 2.096 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)C1(C)CCC1 ZINC000456361207 388196401 /nfs/dbraw/zinc/19/64/01/388196401.db2.gz RUKKHJSGHKJWHO-SNVBAGLBSA-N 1 2 235.331 2.270 20 0 BEADLO C[C@@H]([NH2+]Cc1c[nH]c2nccnc12)C(C)(F)F ZINC000449416080 388198747 /nfs/dbraw/zinc/19/87/47/388198747.db2.gz RSOUXADJZHVAGS-SSDOTTSWSA-N 1 2 240.257 2.043 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456403299 388199453 /nfs/dbraw/zinc/19/94/53/388199453.db2.gz FNLBLUVQZNCQKK-DDHJBXDOSA-N 1 2 247.342 2.441 20 0 BEADLO CCCCC(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456407910 388199631 /nfs/dbraw/zinc/19/96/31/388199631.db2.gz YWEWUJRULVZUCW-NXEZZACHSA-N 1 2 221.304 2.195 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)[C@H]2[C@@H]3CCC[C@@H]32)c2[nH+]ccn21 ZINC000456410153 388200038 /nfs/dbraw/zinc/20/00/38/388200038.db2.gz GAYGHIANPWUXMM-ZIQFBCGOSA-N 1 2 245.326 2.051 20 0 BEADLO C[C@H]1C[C@H](NC(=O)[C@H]2C[C@@H]2C2CC2)c2[nH+]ccn21 ZINC000456420416 388200082 /nfs/dbraw/zinc/20/00/82/388200082.db2.gz MNFSIMAFIOJZRY-IELRGYKMSA-N 1 2 245.326 2.051 20 0 BEADLO CC[N@H+](Cc1ccc(F)cc1F)C1COC1 ZINC000449423541 388202021 /nfs/dbraw/zinc/20/20/21/388202021.db2.gz HJQYZKFJCYKQNZ-UHFFFAOYSA-N 1 2 227.254 2.186 20 0 BEADLO CC[N@@H+](Cc1ccc(F)cc1F)C1COC1 ZINC000449423541 388202022 /nfs/dbraw/zinc/20/20/22/388202022.db2.gz HJQYZKFJCYKQNZ-UHFFFAOYSA-N 1 2 227.254 2.186 20 0 BEADLO CC[C@@H]1CCN1c1nc(C(C)C)[nH+]c(N(C)C)n1 ZINC000489037353 388203016 /nfs/dbraw/zinc/20/30/16/388203016.db2.gz JGJMOSWBMXPUAG-SNVBAGLBSA-N 1 2 249.362 2.050 20 0 BEADLO CC(C)(C)n1cc(C[N@@H+]2CC[C@H]2C2CC2)nn1 ZINC000449427760 388203241 /nfs/dbraw/zinc/20/32/41/388203241.db2.gz OTGKVKQIHYZJKR-LBPRGKRZSA-N 1 2 234.347 2.017 20 0 BEADLO CC(C)(C)n1cc(C[N@H+]2CC[C@H]2C2CC2)nn1 ZINC000449427760 388203242 /nfs/dbraw/zinc/20/32/42/388203242.db2.gz OTGKVKQIHYZJKR-LBPRGKRZSA-N 1 2 234.347 2.017 20 0 BEADLO CCCn1c(C)nnc1C[N@H+](C)[C@@H]1CC1(C)C ZINC000489407181 388211967 /nfs/dbraw/zinc/21/19/67/388211967.db2.gz QRHGIIUXKVHLPQ-LLVKDONJSA-N 1 2 236.363 2.227 20 0 BEADLO CCCn1c(C)nnc1C[N@@H+](C)[C@@H]1CC1(C)C ZINC000489407181 388211969 /nfs/dbraw/zinc/21/19/69/388211969.db2.gz QRHGIIUXKVHLPQ-LLVKDONJSA-N 1 2 236.363 2.227 20 0 BEADLO CCCc1noc(C[N@H+](C)[C@@H]2CC2(C)C)n1 ZINC000489451704 388215309 /nfs/dbraw/zinc/21/53/09/388215309.db2.gz RXLCTZHOMFULEV-SECBINFHSA-N 1 2 223.320 2.252 20 0 BEADLO CCCc1noc(C[N@@H+](C)[C@@H]2CC2(C)C)n1 ZINC000489451704 388215310 /nfs/dbraw/zinc/21/53/10/388215310.db2.gz RXLCTZHOMFULEV-SECBINFHSA-N 1 2 223.320 2.252 20 0 BEADLO Cc1cc(C)c(CNC(=O)C[C@@H]2C[C@@H]2C)c[nH+]1 ZINC000456833967 388226051 /nfs/dbraw/zinc/22/60/51/388226051.db2.gz HEOPBURFOVVHAA-JQWIXIFHSA-N 1 2 232.327 2.361 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)NCc1c[nH+]c(C)cc1C ZINC000456845619 388227175 /nfs/dbraw/zinc/22/71/75/388227175.db2.gz SDHBDTCXSHNKOE-DGCLKSJQSA-N 1 2 232.327 2.361 20 0 BEADLO Cc1cc(N2CCC[C@@H](OCC3CC3)C2)nc[nH+]1 ZINC000489934728 388228812 /nfs/dbraw/zinc/22/88/12/388228812.db2.gz VCVGDVNAJACEDE-CYBMUJFWSA-N 1 2 247.342 2.180 20 0 BEADLO Cc1cc(C)c(CNC(=O)CC2CC2)c[nH+]1 ZINC000456867426 388228870 /nfs/dbraw/zinc/22/88/70/388228870.db2.gz VWQKEDGBLUVMNJ-UHFFFAOYSA-N 1 2 218.300 2.115 20 0 BEADLO COCCN(Cc1c[nH+]cn1C)c1ccccc1 ZINC000449579031 388237606 /nfs/dbraw/zinc/23/76/06/388237606.db2.gz VZMFBRFVIAAHLA-UHFFFAOYSA-N 1 2 245.326 2.073 20 0 BEADLO C[C@H](O)C[N@H+](CC(F)F)CC1(C)CCC1 ZINC000449627864 388245113 /nfs/dbraw/zinc/24/51/13/388245113.db2.gz HOWOYNOFTCTKLH-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO C[C@H](O)C[N@@H+](CC(F)F)CC1(C)CCC1 ZINC000449627864 388245115 /nfs/dbraw/zinc/24/51/15/388245115.db2.gz HOWOYNOFTCTKLH-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO C[C@@H](O)C[N@H+](CCC(C)(C)C)CC(F)F ZINC000449633896 388247066 /nfs/dbraw/zinc/24/70/66/388247066.db2.gz VGKRRLUUARHKLX-SECBINFHSA-N 1 2 223.307 2.371 20 0 BEADLO C[C@@H](O)C[N@@H+](CCC(C)(C)C)CC(F)F ZINC000449633896 388247067 /nfs/dbraw/zinc/24/70/67/388247067.db2.gz VGKRRLUUARHKLX-SECBINFHSA-N 1 2 223.307 2.371 20 0 BEADLO C/C=C/C=C\C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000491369447 388289342 /nfs/dbraw/zinc/28/93/42/388289342.db2.gz VUZWNOWMYBJMOC-IAROGAJJSA-N 1 2 245.326 2.248 20 0 BEADLO C[C@@H](O)C[N@@H+](CC1=CCCCC1)CC(F)F ZINC000451826555 388298218 /nfs/dbraw/zinc/29/82/18/388298218.db2.gz FMLQYQVQDVXLJW-SNVBAGLBSA-N 1 2 233.302 2.435 20 0 BEADLO C[C@@H](O)C[N@H+](CC1=CCCCC1)CC(F)F ZINC000451826555 388298220 /nfs/dbraw/zinc/29/82/20/388298220.db2.gz FMLQYQVQDVXLJW-SNVBAGLBSA-N 1 2 233.302 2.435 20 0 BEADLO CC/C=C\CC[N@@H+](CC(F)F)C[C@@H](C)O ZINC000451839305 388299695 /nfs/dbraw/zinc/29/96/95/388299695.db2.gz RLMNPGJGYQUPEN-UMCURTJPSA-N 1 2 221.291 2.291 20 0 BEADLO CC/C=C\CC[N@H+](CC(F)F)C[C@@H](C)O ZINC000451839305 388299696 /nfs/dbraw/zinc/29/96/96/388299696.db2.gz RLMNPGJGYQUPEN-UMCURTJPSA-N 1 2 221.291 2.291 20 0 BEADLO CC/C=C/CC[N@@H+](CC(F)F)C[C@@H](C)O ZINC000451839304 388299899 /nfs/dbraw/zinc/29/98/99/388299899.db2.gz RLMNPGJGYQUPEN-ORAHPGNNSA-N 1 2 221.291 2.291 20 0 BEADLO CC/C=C/CC[N@H+](CC(F)F)C[C@@H](C)O ZINC000451839304 388299901 /nfs/dbraw/zinc/29/99/01/388299901.db2.gz RLMNPGJGYQUPEN-ORAHPGNNSA-N 1 2 221.291 2.291 20 0 BEADLO CC[C@@H](CC(C)C)C(=O)N1CCn2c[nH+]cc2C1 ZINC000451873030 388302295 /nfs/dbraw/zinc/30/22/95/388302295.db2.gz ZCNSXYYJEMJKKG-LBPRGKRZSA-N 1 2 249.358 2.298 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)NCCCC(C)C ZINC000492294414 388340540 /nfs/dbraw/zinc/34/05/40/388340540.db2.gz BFFKIWYGSZMMIN-FPLPWBNLSA-N 1 2 249.358 2.469 20 0 BEADLO CC=CC=CC(=O)Nc1cc(C)[nH+]cc1C ZINC000492298653 388340569 /nfs/dbraw/zinc/34/05/69/388340569.db2.gz XADIAKSFSRNRRI-DEQVHDEQSA-N 1 2 216.284 2.191 20 0 BEADLO Cc1cc(NC(=O)C=CC2CC2)c(C)c[nH+]1 ZINC000492295216 388340587 /nfs/dbraw/zinc/34/05/87/388340587.db2.gz LKSFWWRERPCIDF-WAYWQWQTSA-N 1 2 216.284 2.025 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)NCCC(C)C ZINC000492323682 388341760 /nfs/dbraw/zinc/34/17/60/388341760.db2.gz VOJOKLSNVKQQAJ-WAYWQWQTSA-N 1 2 235.331 2.079 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N1CC[C@@H]1C(C)C ZINC000492387205 388343279 /nfs/dbraw/zinc/34/32/79/388343279.db2.gz PAIDGZVRXFDJEE-BTDICHCPSA-N 1 2 247.342 2.173 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N1CC[C@H]1C(C)C ZINC000492387206 388343352 /nfs/dbraw/zinc/34/33/52/388343352.db2.gz PAIDGZVRXFDJEE-FJOGCWAESA-N 1 2 247.342 2.173 20 0 BEADLO CCC[C@H](C)N(C)c1nc[nH+]c(N)c1Cl ZINC000233333102 388345666 /nfs/dbraw/zinc/34/56/66/388345666.db2.gz RDOPWFZLGKSZFY-ZETCQYMHSA-N 1 2 228.727 2.337 20 0 BEADLO CCC[C@H](C)N(C)c1[nH+]cnc(N)c1Cl ZINC000233333102 388345667 /nfs/dbraw/zinc/34/56/67/388345667.db2.gz RDOPWFZLGKSZFY-ZETCQYMHSA-N 1 2 228.727 2.337 20 0 BEADLO C[C@H]([NH2+]C/C=C/c1ccccc1)c1ncn(C)n1 ZINC000275817779 388345718 /nfs/dbraw/zinc/34/57/18/388345718.db2.gz MINDPUYBRGVTNO-LZGFCCKTSA-N 1 2 242.326 2.179 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2ncn(C)n2)s1 ZINC000275837769 388346330 /nfs/dbraw/zinc/34/63/30/388346330.db2.gz PHMZXSRYZKGNPQ-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO CCC(O)(CC)CCNc1cc[nH+]c(C)n1 ZINC000276254349 388348915 /nfs/dbraw/zinc/34/89/15/388348915.db2.gz RIGVTJGBLHNDEP-UHFFFAOYSA-N 1 2 223.320 2.138 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ncnn1C)c1ccsc1 ZINC000276620281 388350142 /nfs/dbraw/zinc/35/01/42/388350142.db2.gz MGQRGAKIVRRZMG-IUCAKERBSA-N 1 2 236.344 2.288 20 0 BEADLO C[C@H]1CCCC[C@H]1CC(=O)NCc1[nH]cc[nH+]1 ZINC000524406770 388358338 /nfs/dbraw/zinc/35/83/38/388358338.db2.gz NXQMXLPBSFYEAS-QWRGUYRKSA-N 1 2 235.331 2.242 20 0 BEADLO CC1(C)COC[C@H]1[NH2+]Cc1n[nH]c2ccccc21 ZINC000648795281 388365142 /nfs/dbraw/zinc/36/51/42/388365142.db2.gz MFCINSXCZIYMGO-CYBMUJFWSA-N 1 2 245.326 2.078 20 0 BEADLO Nc1[nH+]cnc(NC2CCCC2)c1Cl ZINC000227840899 388371309 /nfs/dbraw/zinc/37/13/09/388371309.db2.gz HDLXPHCWWRAKJW-UHFFFAOYSA-N 1 2 212.684 2.067 20 0 BEADLO Nc1nc[nH+]c(NC2CCCC2)c1Cl ZINC000227840899 388371311 /nfs/dbraw/zinc/37/13/11/388371311.db2.gz HDLXPHCWWRAKJW-UHFFFAOYSA-N 1 2 212.684 2.067 20 0 BEADLO CC[C@@H]1CCCN(c2nc[nH+]c(N)c2Cl)C1 ZINC000227848062 388372256 /nfs/dbraw/zinc/37/22/56/388372256.db2.gz XWRVVAQILPFATN-MRVPVSSYSA-N 1 2 240.738 2.339 20 0 BEADLO CC[C@@H]1CCCN(c2[nH+]cnc(N)c2Cl)C1 ZINC000227848062 388372259 /nfs/dbraw/zinc/37/22/59/388372259.db2.gz XWRVVAQILPFATN-MRVPVSSYSA-N 1 2 240.738 2.339 20 0 BEADLO C[C@H](CC(=O)NCC1CCCC1)n1cc[nH+]c1 ZINC000572885604 388384479 /nfs/dbraw/zinc/38/44/79/388384479.db2.gz GYZLYEAABJWHKP-LLVKDONJSA-N 1 2 235.331 2.141 20 0 BEADLO CCOc1ccccc1C[NH2+]Cc1cncn1C ZINC000236942071 388386471 /nfs/dbraw/zinc/38/64/71/388386471.db2.gz OSVWFUBFPLZOSW-UHFFFAOYSA-N 1 2 245.326 2.109 20 0 BEADLO C[C@@H]1CCCC[C@H]1NC(=O)C[NH+]1CC(C)(C)C1 ZINC000646574862 388386777 /nfs/dbraw/zinc/38/67/77/388386777.db2.gz GJQLXPLXXVJBDQ-VXGBXAGGSA-N 1 2 238.375 2.023 20 0 BEADLO CCC[C@@H]1[C@H](C)CCCN1C(=O)[C@@H]([NH3+])CC ZINC000236938462 388386953 /nfs/dbraw/zinc/38/69/53/388386953.db2.gz JIENRCFZJIGWQY-GRYCIOLGSA-N 1 2 226.364 2.151 20 0 BEADLO CC(F)(F)CCNc1nc[nH+]c(N)c1Cl ZINC000294228192 388396280 /nfs/dbraw/zinc/39/62/80/388396280.db2.gz OBZOIEXTQAJBTI-UHFFFAOYSA-N 1 2 236.653 2.169 20 0 BEADLO CC(F)(F)CCNc1[nH+]cnc(N)c1Cl ZINC000294228192 388396281 /nfs/dbraw/zinc/39/62/81/388396281.db2.gz OBZOIEXTQAJBTI-UHFFFAOYSA-N 1 2 236.653 2.169 20 0 BEADLO CC(C)c1nn(C)cc1N[C@@H]1CCn2cc[nH+]c21 ZINC000294193039 388397015 /nfs/dbraw/zinc/39/70/15/388397015.db2.gz SOBAQJUAYQSRRC-SNVBAGLBSA-N 1 2 245.330 2.297 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cocn2)cc1 ZINC000237750773 388398161 /nfs/dbraw/zinc/39/81/61/388398161.db2.gz MBPXUXHEKCQJDY-UHFFFAOYSA-N 1 2 202.257 2.273 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cocn2)cc1F ZINC000237750816 388398300 /nfs/dbraw/zinc/39/83/00/388398300.db2.gz YBHJUUSVWHURCO-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO CC[C@@H]([NH2+]CC(F)(F)CO)c1ccsc1 ZINC000294455245 388400469 /nfs/dbraw/zinc/40/04/69/388400469.db2.gz SOGGGUWTUIIJTQ-SECBINFHSA-N 1 2 235.299 2.416 20 0 BEADLO c1ccc2c(c1)cc[nH+]c2N1CCCOCC1 ZINC000527866622 388400848 /nfs/dbraw/zinc/40/08/48/388400848.db2.gz PWSZNFIJZOFYSV-UHFFFAOYSA-N 1 2 228.295 2.462 20 0 BEADLO CCc1cccc(C[NH2+]Cc2ncccn2)c1 ZINC000572976231 388401003 /nfs/dbraw/zinc/40/10/03/388401003.db2.gz MWKFETNTYZGXKT-UHFFFAOYSA-N 1 2 227.311 2.329 20 0 BEADLO COC[C@H]1CCCN(c2nc(C)[nH+]cc2C)CC1 ZINC000572975299 388401656 /nfs/dbraw/zinc/40/16/56/388401656.db2.gz SFRAAANDXZMLKC-ZDUSSCGKSA-N 1 2 249.358 2.346 20 0 BEADLO C[C@@H]([NH2+][C@@H]1C=CCCCCC1)c1ncn(C)n1 ZINC000294711310 388403191 /nfs/dbraw/zinc/40/31/91/388403191.db2.gz VDKZOMHBZJFHBX-VXGBXAGGSA-N 1 2 234.347 2.355 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C=CC1CCC1 ZINC000492065653 388333435 /nfs/dbraw/zinc/33/34/35/388333435.db2.gz IAMKAHMBGREXPK-AATRIKPKSA-N 1 2 216.284 2.107 20 0 BEADLO C/C=C(/C=C\C(=O)NC1=[NH+]CCS1)CC ZINC000492171473 388337256 /nfs/dbraw/zinc/33/72/56/388337256.db2.gz SBPZBTQTZUXDKS-JZDKOIQPSA-N 1 2 224.329 2.118 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N1CCC(C)CC1 ZINC000492257102 388339340 /nfs/dbraw/zinc/33/93/40/388339340.db2.gz CZAHOZTVNPGRSJ-PLNGDYQASA-N 1 2 247.342 2.175 20 0 BEADLO C[C@@H](COCC(F)(F)F)Nc1cccc[nH+]1 ZINC000299330409 388440274 /nfs/dbraw/zinc/44/02/74/388440274.db2.gz LASOFJIGYZCHGA-QMMMGPOBSA-N 1 2 234.221 2.461 20 0 BEADLO Cc1nc(C[N@H+]2C[C@@H](C)OC[C@H]2C)sc1C ZINC000246243345 388441276 /nfs/dbraw/zinc/44/12/76/388441276.db2.gz OHYUFNGGJCFGOY-RKDXNWHRSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@@H](C)OC[C@H]2C)sc1C ZINC000246243345 388441278 /nfs/dbraw/zinc/44/12/78/388441278.db2.gz OHYUFNGGJCFGOY-RKDXNWHRSA-N 1 2 240.372 2.369 20 0 BEADLO C[C@H](CC(=O)N(C)C1CCCC1)n1cc[nH+]c1 ZINC000515062241 256731844 /nfs/dbraw/zinc/73/18/44/256731844.db2.gz DJDSABCEHFEOFT-LLVKDONJSA-N 1 2 235.331 2.235 20 0 BEADLO Cc1cnn(C)c1C[NH2+][C@H](C)c1cscn1 ZINC000394059099 388450198 /nfs/dbraw/zinc/45/01/98/388450198.db2.gz JANDDZJZBWETRC-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO Cc1cc(C)c(CNC(=O)NC2CCCC2)c[nH+]1 ZINC000335467263 388450947 /nfs/dbraw/zinc/45/09/47/388450947.db2.gz GIGKAPWHMZHVPV-UHFFFAOYSA-N 1 2 247.342 2.440 20 0 BEADLO CC/C=C/CNC(=O)c1ccn2c(C)c[nH+]c2c1 ZINC000515497711 256747879 /nfs/dbraw/zinc/74/78/79/256747879.db2.gz ATNXIDPSRCQCHM-SNAWJCMRSA-N 1 2 243.310 2.339 20 0 BEADLO C[C@H](F)CC[NH+]=c1[nH]c2ccccc2[nH]1 ZINC000338747404 388476934 /nfs/dbraw/zinc/47/69/34/388476934.db2.gz CGULKVMHSYPCIQ-QMMMGPOBSA-N 1 2 207.252 2.145 20 0 BEADLO Cc1noc([C@H](C)[N@H+](C)CCC(F)(F)F)n1 ZINC000573031696 388408929 /nfs/dbraw/zinc/40/89/29/388408929.db2.gz ROBVIYVOQKUOLY-LURJTMIESA-N 1 2 237.225 2.323 20 0 BEADLO Cc1noc([C@H](C)[N@@H+](C)CCC(F)(F)F)n1 ZINC000573031696 388408931 /nfs/dbraw/zinc/40/89/31/388408931.db2.gz ROBVIYVOQKUOLY-LURJTMIESA-N 1 2 237.225 2.323 20 0 BEADLO Cc1cnc(C[NH2+]Cc2ncccc2C)s1 ZINC000134762233 388479519 /nfs/dbraw/zinc/47/95/19/388479519.db2.gz UZXOMAYQGUKCPD-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO CC[C@@H]1C[N@H+](C/C=C(/C)Cl)C[C@H](C)[S@@]1=O ZINC000528506880 388537233 /nfs/dbraw/zinc/53/72/33/388537233.db2.gz MSRGTVWXETZQIH-BZLOGFCISA-N 1 2 249.807 2.360 20 0 BEADLO CC[C@@H]1C[N@@H+](C/C=C(/C)Cl)C[C@H](C)[S@@]1=O ZINC000528506880 388537234 /nfs/dbraw/zinc/53/72/34/388537234.db2.gz MSRGTVWXETZQIH-BZLOGFCISA-N 1 2 249.807 2.360 20 0 BEADLO C[C@@]1(CO)CCC[N@@H+]1Cc1ncc(Cl)s1 ZINC000548487379 388543068 /nfs/dbraw/zinc/54/30/68/388543068.db2.gz KGJGDOCLWHFPJI-JTQLQIEISA-N 1 2 246.763 2.143 20 0 BEADLO C[C@@]1(CO)CCC[N@H+]1Cc1ncc(Cl)s1 ZINC000548487379 388543070 /nfs/dbraw/zinc/54/30/70/388543070.db2.gz KGJGDOCLWHFPJI-JTQLQIEISA-N 1 2 246.763 2.143 20 0 BEADLO C/C(Cl)=C\C[NH2+][C@H](C)c1csnn1 ZINC000528529350 388543846 /nfs/dbraw/zinc/54/38/46/388543846.db2.gz ZYGGHKSKEVSLOP-XUTFHDRNSA-N 1 2 217.725 2.331 20 0 BEADLO CC[C@@H](C)Nc1cc(N2CCCC2)nc[nH+]1 ZINC000244420925 388493131 /nfs/dbraw/zinc/49/31/31/388493131.db2.gz YTMWNUASVUHHFG-SNVBAGLBSA-N 1 2 220.320 2.287 20 0 BEADLO CC[C@@H](C)Nc1cc(N2CCCC2)[nH+]cn1 ZINC000244420925 388493134 /nfs/dbraw/zinc/49/31/34/388493134.db2.gz YTMWNUASVUHHFG-SNVBAGLBSA-N 1 2 220.320 2.287 20 0 BEADLO CC[C@H]1CCC[C@@H]1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000516582837 256794369 /nfs/dbraw/zinc/79/43/69/256794369.db2.gz MEOYULIEOGHXCH-VWYCJHECSA-N 1 2 235.331 2.413 20 0 BEADLO C/C=C/C=C/C(=O)NCc1ccn2cc[nH+]c2c1 ZINC000178359329 388498591 /nfs/dbraw/zinc/49/85/91/388498591.db2.gz NGRFCNQJCPHNGH-MQQKCMAXSA-N 1 2 241.294 2.083 20 0 BEADLO c1[nH+]c(Sc2cccnn2)n2ccccc12 ZINC000548090061 388509653 /nfs/dbraw/zinc/50/96/53/388509653.db2.gz OOHOSQCVBQNUKK-UHFFFAOYSA-N 1 2 228.280 2.276 20 0 BEADLO COCc1nc(C[N@H+]2[C@H](C)C[C@@H]2C)cs1 ZINC000548097463 388510687 /nfs/dbraw/zinc/51/06/87/388510687.db2.gz URLCOSNZWWCHQJ-DTORHVGOSA-N 1 2 226.345 2.272 20 0 BEADLO COCc1nc(C[N@@H+]2[C@H](C)C[C@@H]2C)cs1 ZINC000548097463 388510689 /nfs/dbraw/zinc/51/06/89/388510689.db2.gz URLCOSNZWWCHQJ-DTORHVGOSA-N 1 2 226.345 2.272 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1nc(CC(F)(F)F)no1 ZINC000548096215 388510877 /nfs/dbraw/zinc/51/08/77/388510877.db2.gz IIBMYORIDUXICE-KNVOCYPGSA-N 1 2 249.236 2.157 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1nc(CC(F)(F)F)no1 ZINC000548096215 388510880 /nfs/dbraw/zinc/51/08/80/388510880.db2.gz IIBMYORIDUXICE-KNVOCYPGSA-N 1 2 249.236 2.157 20 0 BEADLO CCCc1noc(C[NH+]2[C@H](C)C[C@H]2C)n1 ZINC000548096663 388511111 /nfs/dbraw/zinc/51/11/11/388511111.db2.gz FSOMZXCODRXPTB-RKDXNWHRSA-N 1 2 209.293 2.005 20 0 BEADLO C[C@H]1CCCC[C@@H]1CC(=O)NCCn1cc[nH+]c1 ZINC000516840751 388520240 /nfs/dbraw/zinc/52/02/40/388520240.db2.gz DHBNOSSSVGWOSK-QWHCGFSZSA-N 1 2 249.358 2.216 20 0 BEADLO C/C(Cl)=C/C[N@H+]1CCO[C@H](C)[C@@H]1C ZINC000528404854 388521278 /nfs/dbraw/zinc/52/12/78/388521278.db2.gz OCWQMYIRGNMTGE-YXCTTXFESA-N 1 2 203.713 2.238 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1CCO[C@H](C)[C@@H]1C ZINC000528404854 388521285 /nfs/dbraw/zinc/52/12/85/388521285.db2.gz OCWQMYIRGNMTGE-YXCTTXFESA-N 1 2 203.713 2.238 20 0 BEADLO CC(=O)N1CC[N@@H+](C/C=C(/C)Cl)C(C)(C)C1 ZINC000528440896 388526302 /nfs/dbraw/zinc/52/63/02/388526302.db2.gz UZCDMBPSIOFZNK-YHYXMXQVSA-N 1 2 244.766 2.072 20 0 BEADLO CC(=O)N1CC[N@H+](C/C=C(/C)Cl)C(C)(C)C1 ZINC000528440896 388526303 /nfs/dbraw/zinc/52/63/03/388526303.db2.gz UZCDMBPSIOFZNK-YHYXMXQVSA-N 1 2 244.766 2.072 20 0 BEADLO COc1ccc[nH+]c1NC1CC(OC(C)C)C1 ZINC000548309899 388528248 /nfs/dbraw/zinc/52/82/48/388528248.db2.gz ZIJMMMAHSFOYTA-UHFFFAOYSA-N 1 2 236.315 2.458 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)NC(C)(C)CC ZINC000136277441 388529714 /nfs/dbraw/zinc/52/97/14/388529714.db2.gz DQHQQJFPPUUDNT-BQYQJAHWSA-N 1 2 235.331 2.221 20 0 BEADLO CC(F)(F)C[NH2+]Cc1[nH]nc2ccccc21 ZINC000378874550 388530572 /nfs/dbraw/zinc/53/05/72/388530572.db2.gz WXGSPQZQQUALPT-UHFFFAOYSA-N 1 2 225.242 2.308 20 0 BEADLO C/C(=C\c1ccccc1)C[NH2+]CC(F)(F)CO ZINC000183884726 256841745 /nfs/dbraw/zinc/84/17/45/256841745.db2.gz JBRKTYFFYKTSQM-YRNVUSSQSA-N 1 2 241.281 2.307 20 0 BEADLO CCCCCN(C(=O)Cn1cc[nH+]c1)C(C)C ZINC000549903460 388594512 /nfs/dbraw/zinc/59/45/12/388594512.db2.gz OIGRAIKNZXUHHD-UHFFFAOYSA-N 1 2 237.347 2.310 20 0 BEADLO CC(C)c1nc(N[C@H]2CCCC[C@H]2O)cc[nH+]1 ZINC000106465308 388595262 /nfs/dbraw/zinc/59/52/62/388595262.db2.gz AQJCAIPIJUCESS-WDEREUQCSA-N 1 2 235.331 2.315 20 0 BEADLO Cc1cc(NC(=O)c2c(O)cccc2F)cc[nH+]1 ZINC000186025749 388596970 /nfs/dbraw/zinc/59/69/70/388596970.db2.gz MIFNKGLDHGNXEB-UHFFFAOYSA-N 1 2 246.241 2.487 20 0 BEADLO C[C@H]1CC[N@H+](Cc2csnn2)C[C@H]1C ZINC000245762885 388603527 /nfs/dbraw/zinc/60/35/27/388603527.db2.gz QAIBKEVFFVNJFW-DTWKUNHWSA-N 1 2 211.334 2.016 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2csnn2)C[C@H]1C ZINC000245762885 388603529 /nfs/dbraw/zinc/60/35/29/388603529.db2.gz QAIBKEVFFVNJFW-DTWKUNHWSA-N 1 2 211.334 2.016 20 0 BEADLO CC[C@@H]1CC[N@@H+]([C@@H](C(=O)OC)c2cccnc2)C1 ZINC000245941558 388611768 /nfs/dbraw/zinc/61/17/68/388611768.db2.gz MLVYJQSPTYQPRT-DGCLKSJQSA-N 1 2 248.326 2.028 20 0 BEADLO CC[C@@H]1CC[N@H+]([C@@H](C(=O)OC)c2cccnc2)C1 ZINC000245941558 388611770 /nfs/dbraw/zinc/61/17/70/388611770.db2.gz MLVYJQSPTYQPRT-DGCLKSJQSA-N 1 2 248.326 2.028 20 0 BEADLO CNc1[nH+]cnc2c1cnn2C/C=C(\C)Cl ZINC000530162046 388618375 /nfs/dbraw/zinc/61/83/75/388618375.db2.gz DZIPCGKCWYRJNV-XVNBXDOJSA-N 1 2 237.694 2.011 20 0 BEADLO COC(=O)c1ccoc1C[NH+]1[C@@H](C)C[C@@H]1C ZINC000548754219 388557869 /nfs/dbraw/zinc/55/78/69/388557869.db2.gz IYFAEJFRSMCNCC-IUCAKERBSA-N 1 2 223.272 2.049 20 0 BEADLO c1cc(C[NH2+]Cc2cccc3[nH]ccc32)[nH]n1 ZINC000080354482 388558591 /nfs/dbraw/zinc/55/85/91/388558591.db2.gz BDZAKIVDDYUATP-UHFFFAOYSA-N 1 2 226.283 2.181 20 0 BEADLO Cc1cc(NC(=O)[C@H](C)CC(F)F)c(C)c[nH+]1 ZINC000521208006 388564444 /nfs/dbraw/zinc/56/44/44/388564444.db2.gz FNFWDQSNOOAFHW-SSDOTTSWSA-N 1 2 242.269 2.350 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2[C@H](C)C[C@@H]2C)s1 ZINC000549172694 388574526 /nfs/dbraw/zinc/57/45/26/388574526.db2.gz IATHUUFXUYHFIK-GJMOJQLCSA-N 1 2 211.334 2.390 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2[C@H](C)C[C@@H]2C)s1 ZINC000549172694 388574529 /nfs/dbraw/zinc/57/45/29/388574529.db2.gz IATHUUFXUYHFIK-GJMOJQLCSA-N 1 2 211.334 2.390 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ncccc2F)on1 ZINC000528823816 388576931 /nfs/dbraw/zinc/57/69/31/388576931.db2.gz IBMZEWFDJXFFFU-VIFPVBQESA-N 1 2 235.262 2.368 20 0 BEADLO Cc1nc(N2CC[C@@H](C)C2)c(C)c(C)[nH+]1 ZINC000301681160 388667897 /nfs/dbraw/zinc/66/78/97/388667897.db2.gz JRXVSQJSYAXESE-MRVPVSSYSA-N 1 2 205.305 2.248 20 0 BEADLO CC(C)c1ncc(C[NH+]2CCN(C)CC2)s1 ZINC000141760897 388686376 /nfs/dbraw/zinc/68/63/76/388686376.db2.gz DJUJJOYNKYIGJD-UHFFFAOYSA-N 1 2 239.388 2.014 20 0 BEADLO CCc1nocc1CSCCn1cc[nH+]c1 ZINC000522013130 388675194 /nfs/dbraw/zinc/67/51/94/388675194.db2.gz CZVABGRIWLVHIJ-UHFFFAOYSA-N 1 2 237.328 2.367 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1ncccc1F ZINC000125772057 388676863 /nfs/dbraw/zinc/67/68/63/388676863.db2.gz OQAKVWKYSGBDOG-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO CC[C@H]1CC[N@H+](Cc2nnsc2Cl)C1 ZINC000125854424 388679666 /nfs/dbraw/zinc/67/96/66/388679666.db2.gz WKJRDBKWPRVTAL-ZETCQYMHSA-N 1 2 231.752 2.423 20 0 BEADLO CC[C@H]1CC[N@@H+](Cc2nnsc2Cl)C1 ZINC000125854424 388679668 /nfs/dbraw/zinc/67/96/68/388679668.db2.gz WKJRDBKWPRVTAL-ZETCQYMHSA-N 1 2 231.752 2.423 20 0 BEADLO CC[C@@H](C)CCC(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000521643820 388621049 /nfs/dbraw/zinc/62/10/49/388621049.db2.gz QDTDSJWWIQDJRG-NXEZZACHSA-N 1 2 223.320 2.413 20 0 BEADLO CCc1nn(C)c(CC)c1C[NH2+]CC(C)(F)F ZINC000521837069 388633044 /nfs/dbraw/zinc/63/30/44/388633044.db2.gz YPTQMIYNWXPCPJ-UHFFFAOYSA-N 1 2 245.317 2.290 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1nccs1)c1cn[nH]c1 ZINC000222481466 388637315 /nfs/dbraw/zinc/63/73/15/388637315.db2.gz GHKSYTWQPGTCOP-YUMQZZPRSA-N 1 2 222.317 2.278 20 0 BEADLO CC(C)[N@H+](CC(F)F)C[C@H](O)CC(F)(F)F ZINC000189573581 388638730 /nfs/dbraw/zinc/63/87/30/388638730.db2.gz OGJAJZGHFNMAEJ-SSDOTTSWSA-N 1 2 249.223 2.275 20 0 BEADLO CC(C)[N@@H+](CC(F)F)C[C@H](O)CC(F)(F)F ZINC000189573581 388638732 /nfs/dbraw/zinc/63/87/32/388638732.db2.gz OGJAJZGHFNMAEJ-SSDOTTSWSA-N 1 2 249.223 2.275 20 0 BEADLO c1n[nH]c([C@H]([NH2+]C2CC2)C2CCCCC2)n1 ZINC000328612324 388645734 /nfs/dbraw/zinc/64/57/34/388645734.db2.gz PGSPTIQONQSIGW-LLVKDONJSA-N 1 2 220.320 2.178 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2CCc3ccccc3C2)n1 ZINC000223634085 388655819 /nfs/dbraw/zinc/65/58/19/388655819.db2.gz NFWOOFQXBIUYAJ-GFCCVEGCSA-N 1 2 243.310 2.062 20 0 BEADLO C[C@H](N(C)C(=O)CCn1cc[nH+]c1)C(C)(C)C ZINC000522252599 388734544 /nfs/dbraw/zinc/73/45/44/388734544.db2.gz FGHMUESIAUSBDO-NSHDSACASA-N 1 2 237.347 2.166 20 0 BEADLO COc1ccc[nH+]c1NCCOC1CCCC1 ZINC000128064966 388738160 /nfs/dbraw/zinc/73/81/60/388738160.db2.gz DNRPNZYJZHWGJF-UHFFFAOYSA-N 1 2 236.315 2.461 20 0 BEADLO CCn1cc(C[N@H+](C)[C@@H](C)c2ncc(C)o2)cn1 ZINC000538954859 388741961 /nfs/dbraw/zinc/74/19/61/388741961.db2.gz UZALPNYBSXFCRT-NSHDSACASA-N 1 2 248.330 2.392 20 0 BEADLO CCn1cc(C[N@@H+](C)[C@@H](C)c2ncc(C)o2)cn1 ZINC000538954859 388741963 /nfs/dbraw/zinc/74/19/63/388741963.db2.gz UZALPNYBSXFCRT-NSHDSACASA-N 1 2 248.330 2.392 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CCOC[C@H]2C)cc[nH+]1 ZINC000194802796 388743674 /nfs/dbraw/zinc/74/36/74/388743674.db2.gz REWGEUBOFANNHA-BXKDBHETSA-N 1 2 234.299 2.001 20 0 BEADLO CCCCN(CC)C(=O)[C@@H]1CCc2c[nH+]cn2C1 ZINC000553227060 388754776 /nfs/dbraw/zinc/75/47/76/388754776.db2.gz QCRDESNJVAGEKH-GFCCVEGCSA-N 1 2 249.358 2.094 20 0 BEADLO CCC(CC)[C@H](O)CNc1cccc[nH+]1 ZINC000225745847 388689091 /nfs/dbraw/zinc/68/90/91/388689091.db2.gz QLUDUQFFAZXNHP-LLVKDONJSA-N 1 2 208.305 2.291 20 0 BEADLO CC[C@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)C(=O)OC ZINC000248754155 388693151 /nfs/dbraw/zinc/69/31/51/388693151.db2.gz PDUFFQNDGXFHSZ-IHRRRGAJSA-N 1 2 247.338 2.331 20 0 BEADLO COC(=O)C[N@H+](C)[C@@H](C)c1ccccc1C ZINC000193426465 388704393 /nfs/dbraw/zinc/70/43/93/388704393.db2.gz HPZONSFJWDKEKT-NSHDSACASA-N 1 2 221.300 2.161 20 0 BEADLO COC(=O)C[N@@H+](C)[C@@H](C)c1ccccc1C ZINC000193426465 388704395 /nfs/dbraw/zinc/70/43/95/388704395.db2.gz HPZONSFJWDKEKT-NSHDSACASA-N 1 2 221.300 2.161 20 0 BEADLO COc1ncccc1C[N@H+](C)Cc1cccnc1 ZINC000193448861 388705420 /nfs/dbraw/zinc/70/54/20/388705420.db2.gz MTAFTVRKRHGVQQ-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1ncccc1C[N@@H+](C)Cc1cccnc1 ZINC000193448861 388705424 /nfs/dbraw/zinc/70/54/24/388705424.db2.gz MTAFTVRKRHGVQQ-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cnc(C)s2)CCO1 ZINC000066420624 388717779 /nfs/dbraw/zinc/71/77/79/388717779.db2.gz JWAQCZAPHVJOHE-JTQLQIEISA-N 1 2 226.345 2.062 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cnc(C)s2)CCO1 ZINC000066420624 388717780 /nfs/dbraw/zinc/71/77/80/388717780.db2.gz JWAQCZAPHVJOHE-JTQLQIEISA-N 1 2 226.345 2.062 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@@H]2CCC[C@@H](C)C2)no1 ZINC000249705091 388731651 /nfs/dbraw/zinc/73/16/51/388731651.db2.gz AFBHZJKCEYYVRU-MWLCHTKSSA-N 1 2 223.320 2.389 20 0 BEADLO Cc1nc(C[N@H+](C)[C@@H]2CCC[C@@H](C)C2)no1 ZINC000249705091 388731652 /nfs/dbraw/zinc/73/16/52/388731652.db2.gz AFBHZJKCEYYVRU-MWLCHTKSSA-N 1 2 223.320 2.389 20 0 BEADLO COc1cc[nH+]cc1CN(C)c1cccc(O)c1 ZINC000554243818 388805204 /nfs/dbraw/zinc/80/52/04/388805204.db2.gz MEADVWVCTWQQSI-UHFFFAOYSA-N 1 2 244.294 2.432 20 0 BEADLO C[S@@](=O)CCNc1[nH+]ccc2ccccc21 ZINC000229239680 388840476 /nfs/dbraw/zinc/84/04/76/388840476.db2.gz VPZDBTTWWLATAG-MRXNPFEDSA-N 1 2 234.324 2.025 20 0 BEADLO COC(=O)[C@@](C)([NH2+]CC1=CCCCC1)C1CC1 ZINC000556249295 388873348 /nfs/dbraw/zinc/87/33/48/388873348.db2.gz ZKPICQNBEDLKPT-AWEZNQCLSA-N 1 2 237.343 2.418 20 0 BEADLO COC[C@H](Nc1cc[nH+]c(C(C)C)n1)C1CC1 ZINC000129537429 388851035 /nfs/dbraw/zinc/85/10/35/388851035.db2.gz UBYIPJVOCXFGHY-NSHDSACASA-N 1 2 235.331 2.437 20 0 BEADLO CCC[C@@]1(CO)CCN(c2nc(C)[nH+]cc2C)C1 ZINC000564668609 388882975 /nfs/dbraw/zinc/88/29/75/388882975.db2.gz VEJNUJRIEYDDBQ-CQSZACIVSA-N 1 2 249.358 2.082 20 0 BEADLO C[C@@H]([NH2+]Cc1nnc2ccccn21)c1ccoc1 ZINC000094867713 388874759 /nfs/dbraw/zinc/87/47/59/388874759.db2.gz QGCKDRFYGZYORV-SNVBAGLBSA-N 1 2 242.282 2.173 20 0 BEADLO C[C@H](CC(=O)N1CC(C2CCC2)C1)n1cc[nH+]c1 ZINC000565086641 388913880 /nfs/dbraw/zinc/91/38/80/388913880.db2.gz QYJLSWQOIMBTPV-LLVKDONJSA-N 1 2 247.342 2.093 20 0 BEADLO CCCN(CC1CC1)C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000565168997 388919963 /nfs/dbraw/zinc/91/99/63/388919963.db2.gz CLCQRWWAMKNXHD-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO CCCN(CC1CC1)C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000565168997 388919960 /nfs/dbraw/zinc/91/99/60/388919960.db2.gz CLCQRWWAMKNXHD-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO F[C@@H]1C[N@@H+](C[C@H]2CCC3(CCCC3)O2)C[C@@H]1F ZINC000565286260 388934938 /nfs/dbraw/zinc/93/49/38/388934938.db2.gz MBPSKTFVKPFQNV-UTUOFQBUSA-N 1 2 245.313 2.470 20 0 BEADLO F[C@@H]1C[N@H+](C[C@H]2CCC3(CCCC3)O2)C[C@@H]1F ZINC000565286260 388934940 /nfs/dbraw/zinc/93/49/40/388934940.db2.gz MBPSKTFVKPFQNV-UTUOFQBUSA-N 1 2 245.313 2.470 20 0 BEADLO CCCn1ncnc1C[N@H+](C(C)C)C1CC1 ZINC000565755549 388967261 /nfs/dbraw/zinc/96/72/61/388967261.db2.gz JCBOVPCQXKMXSF-UHFFFAOYSA-N 1 2 222.336 2.061 20 0 BEADLO CCCn1ncnc1C[N@@H+](C(C)C)C1CC1 ZINC000565755549 388967263 /nfs/dbraw/zinc/96/72/63/388967263.db2.gz JCBOVPCQXKMXSF-UHFFFAOYSA-N 1 2 222.336 2.061 20 0 BEADLO CC(C)C1(NC(=O)C[C@@H](C)n2cc[nH+]c2)CC1 ZINC000565778092 388968414 /nfs/dbraw/zinc/96/84/14/388968414.db2.gz NVDKEXUUBGTJSQ-LLVKDONJSA-N 1 2 235.331 2.139 20 0 BEADLO F[C@@]1(c2ccccc2)C[C@@H]1[NH2+]Cc1cnccn1 ZINC000565418273 388943785 /nfs/dbraw/zinc/94/37/85/388943785.db2.gz ODZMRCZQSYEZQO-UONOGXRCSA-N 1 2 243.285 2.204 20 0 BEADLO CC[C@@H]1CN(c2nc(C)[nH+]cc2C)C[C@H](CC)O1 ZINC000565435135 388944779 /nfs/dbraw/zinc/94/47/79/388944779.db2.gz YMOMBEWYTBTFOX-BETUJISGSA-N 1 2 249.358 2.487 20 0 BEADLO C[C@](O)(CNc1cccc[nH+]1)c1ccsc1 ZINC000265833563 388994317 /nfs/dbraw/zinc/99/43/17/388994317.db2.gz LLVOYZCMRVCDJM-LBPRGKRZSA-N 1 2 234.324 2.463 20 0 BEADLO C[N@@H+](CCF)Cc1ccc(Br)o1 ZINC000266890013 388998147 /nfs/dbraw/zinc/99/81/47/388998147.db2.gz SCFRPXBZKNWCCU-UHFFFAOYSA-N 1 2 236.084 2.443 20 0 BEADLO C[N@H+](CCF)Cc1ccc(Br)o1 ZINC000266890013 388998145 /nfs/dbraw/zinc/99/81/45/388998145.db2.gz SCFRPXBZKNWCCU-UHFFFAOYSA-N 1 2 236.084 2.443 20 0 BEADLO Cc1c([C@H](C)Nc2cccc[nH+]2)cnn1C ZINC000180398834 177633128 /nfs/dbraw/zinc/63/31/28/177633128.db2.gz ZYWWHYOIMPLSGL-VIFPVBQESA-N 1 2 216.288 2.297 20 0 BEADLO C[C@H]([NH2+]C/C(Cl)=C/Cl)c1cnn(C)c1 ZINC000273442716 389040809 /nfs/dbraw/zinc/04/08/09/389040809.db2.gz ZVDIBUWUEAJMAD-MEVQIBDESA-N 1 2 234.130 2.390 20 0 BEADLO C[C@@H]([NH2+]C/C(Cl)=C/Cl)c1cnn(C)c1 ZINC000273442715 389041410 /nfs/dbraw/zinc/04/14/10/389041410.db2.gz ZVDIBUWUEAJMAD-LVWLXAFTSA-N 1 2 234.130 2.390 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2cnccc2C)s1 ZINC000273611982 389042260 /nfs/dbraw/zinc/04/22/60/389042260.db2.gz OBTWIASEPJQEKK-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO C[C@@H]1CN(Cc2[nH+]ccn2C)c2ccccc2O1 ZINC000264767696 132180764 /nfs/dbraw/zinc/18/07/64/132180764.db2.gz ZYHVEZLRPZUIEK-LLVKDONJSA-N 1 2 243.310 2.208 20 0 BEADLO C[C@H]1CN(Cc2c[nH+]cn2C)c2ccccc2O1 ZINC000267638936 132190715 /nfs/dbraw/zinc/19/07/15/132190715.db2.gz VIAZFVZGPPNCAB-NSHDSACASA-N 1 2 243.310 2.208 20 0 BEADLO FC1=CCCN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000272601809 132200761 /nfs/dbraw/zinc/20/07/61/132200761.db2.gz XVBHGULJVYYDNT-UHFFFAOYSA-N 1 2 219.263 2.418 20 0 BEADLO CC(C)(C)[C@@H]1CCN(c2cccc[nH+]2)C[C@@H]1O ZINC000273310865 132201794 /nfs/dbraw/zinc/20/17/94/132201794.db2.gz NKNLEPKECNSXLY-NEPJUHHUSA-N 1 2 234.343 2.315 20 0 BEADLO Cc1nc(N2CC[C@H](C(C)(C)C)[C@H](O)C2)cc[nH+]1 ZINC000273353981 132201800 /nfs/dbraw/zinc/20/18/00/132201800.db2.gz VQSZIJMNOAPXDW-NWDGAFQWSA-N 1 2 249.358 2.018 20 0 BEADLO CC1(C)CN(c2cccc[nH+]2)CC(C)(C)O1 ZINC000275995708 132205553 /nfs/dbraw/zinc/20/55/53/132205553.db2.gz GCOBPPCLFPEGDA-UHFFFAOYSA-N 1 2 220.316 2.475 20 0 BEADLO Cc1nc(N2CCO[C@H](C(C)(C)C)C2)cc[nH+]1 ZINC000279329988 132208853 /nfs/dbraw/zinc/20/88/53/132208853.db2.gz DEMUZYKSBLIJPM-NSHDSACASA-N 1 2 235.331 2.036 20 0 BEADLO Cc1nc(N2CCC[C@](C)(F)C2)cc[nH+]1 ZINC000294915002 132219596 /nfs/dbraw/zinc/21/95/96/132219596.db2.gz JHUXBAWDITUBIK-NSHDSACASA-N 1 2 209.268 2.113 20 0 BEADLO Cc1cc(N2CCC[C@@H](O)[C@H]2C)nc(C2CC2)[nH+]1 ZINC000295068555 132220293 /nfs/dbraw/zinc/22/02/93/132220293.db2.gz WCDCRAWTFPYYKJ-ZYHUDNBSSA-N 1 2 247.342 2.012 20 0 BEADLO Cc1nc(N2CCCCC2)c(C)c(C)[nH+]1 ZINC000128947077 132232773 /nfs/dbraw/zinc/23/27/73/132232773.db2.gz PHSFZLKHXWUYPR-UHFFFAOYSA-N 1 2 205.305 2.392 20 0 BEADLO Cc1cc(N2CCO[C@@H](C)C2)nc(C(C)C)[nH+]1 ZINC000301080261 132251227 /nfs/dbraw/zinc/25/12/27/132251227.db2.gz IWLJBQQUWDMGID-NSHDSACASA-N 1 2 235.331 2.134 20 0 BEADLO Cc1cc(N2CCS[C@@H](C)[C@@H]2C)nc[nH+]1 ZINC000301307302 132252571 /nfs/dbraw/zinc/25/25/71/132252571.db2.gz ZSCGFKSOMRLGLT-UWVGGRQHSA-N 1 2 223.345 2.115 20 0 BEADLO CCO[C@@H]1CCCN(c2nc(C)[nH+]c(C)c2C)C1 ZINC000301432826 132253564 /nfs/dbraw/zinc/25/35/64/132253564.db2.gz HSJZFCZZNGQFPS-CYBMUJFWSA-N 1 2 249.358 2.407 20 0 BEADLO Cc1cc(N2CC[C@H](C)[C@@H](C)C2)nc[nH+]1 ZINC000301918324 132258627 /nfs/dbraw/zinc/25/86/27/132258627.db2.gz JSHCIWLSZCRLJC-UWVGGRQHSA-N 1 2 205.305 2.267 20 0 BEADLO Cc1cc(N2CC(C)(C)OC(C)(C)C2)nc[nH+]1 ZINC000302707008 132265781 /nfs/dbraw/zinc/26/57/81/132265781.db2.gz YPOKAQYZNZGXHF-UHFFFAOYSA-N 1 2 235.331 2.179 20 0 BEADLO C[C@@H]1N(c2cc[nH+]c(C3CC3)n2)CCOC1(C)C ZINC000357164113 132272763 /nfs/dbraw/zinc/27/27/63/132272763.db2.gz AUJVHIPBCWWVCT-JTQLQIEISA-N 1 2 247.342 2.358 20 0 BEADLO Cc1cc(N2CC[C@H](C)[C@@H](O)C2)nc(C(C)C)[nH+]1 ZINC000221208019 132291635 /nfs/dbraw/zinc/29/16/35/132291635.db2.gz OXCNAXFSWMGPOB-JQWIXIFHSA-N 1 2 249.358 2.116 20 0 BEADLO c1cc(N2CCOCC2)[nH+]cc1NC1CCCC1 ZINC000037076012 132295479 /nfs/dbraw/zinc/29/54/79/132295479.db2.gz PUAPLKFFNKBUBC-UHFFFAOYSA-N 1 2 247.342 2.273 20 0 BEADLO CC1CCN(c2nc(N)c3ccccc3[nH+]2)CC1 ZINC000041146391 132349620 /nfs/dbraw/zinc/34/96/20/132349620.db2.gz OKJGVKSWWZIFGM-UHFFFAOYSA-N 1 2 242.326 2.448 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CCC[C@H]2CF)[nH+]1 ZINC000335927935 134009671 /nfs/dbraw/zinc/00/96/71/134009671.db2.gz IHCUUDUAHNXJCQ-VIFPVBQESA-N 1 2 234.278 2.205 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C1CC(C)(C)C1 ZINC000335941443 134017545 /nfs/dbraw/zinc/01/75/45/134017545.db2.gz SOFBXDFFSKUVCJ-UHFFFAOYSA-N 1 2 234.299 2.465 20 0 BEADLO Fc1ccc(CN2CCn3cc[nH+]c3C2)cc1 ZINC000335945463 134019695 /nfs/dbraw/zinc/01/96/95/134019695.db2.gz UUBBKANFOMTCNS-UHFFFAOYSA-N 1 2 231.274 2.038 20 0 BEADLO Cc1nc(N2CCC(F)(F)C2)c(C)c(C)[nH+]1 ZINC000335954766 134022740 /nfs/dbraw/zinc/02/27/40/134022740.db2.gz FDFRCPJJDPILSX-UHFFFAOYSA-N 1 2 227.258 2.247 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)Nc1cn[nH]c1 ZINC000335963653 134027639 /nfs/dbraw/zinc/02/76/39/134027639.db2.gz RIKBWROCXDOTGG-UHFFFAOYSA-N 1 2 231.259 2.066 20 0 BEADLO c1c[nH+]c([C@@H]2CCCN2Cc2cscn2)[nH]1 ZINC000335965782 134027977 /nfs/dbraw/zinc/02/79/77/134027977.db2.gz FMKCPSHHFBPTOR-JTQLQIEISA-N 1 2 234.328 2.203 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)[C@@H]1CCC(C)(C)C1 ZINC000335979806 134032752 /nfs/dbraw/zinc/03/27/52/134032752.db2.gz DVYJUKRZCCOERD-LLVKDONJSA-N 1 2 249.358 2.205 20 0 BEADLO Cc1ncc(C[N@H+]2CCOC[C@@H]2CC(C)C)cn1 ZINC000352001577 134033928 /nfs/dbraw/zinc/03/39/28/134033928.db2.gz CGXZLDKPKLTANH-AWEZNQCLSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1ncc(C[N@@H+]2CCOC[C@@H]2CC(C)C)cn1 ZINC000352001577 134033929 /nfs/dbraw/zinc/03/39/29/134033929.db2.gz CGXZLDKPKLTANH-AWEZNQCLSA-N 1 2 249.358 2.032 20 0 BEADLO C[C@@H]1C[N@H+](Cc2csnn2)CC(C)(C)C1 ZINC000335996178 134042370 /nfs/dbraw/zinc/04/23/70/134042370.db2.gz YHURYADZQCIOFG-VIFPVBQESA-N 1 2 225.361 2.406 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2csnn2)CC(C)(C)C1 ZINC000335996178 134042371 /nfs/dbraw/zinc/04/23/71/134042371.db2.gz YHURYADZQCIOFG-VIFPVBQESA-N 1 2 225.361 2.406 20 0 BEADLO Cc1nc(N2CC3(CCC3(F)F)C2)cc[nH+]1 ZINC000336025206 134056848 /nfs/dbraw/zinc/05/68/48/134056848.db2.gz YCOMKBPZYXHHBC-UHFFFAOYSA-N 1 2 225.242 2.021 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)[C@@H]1/C=C/CCCCC1 ZINC000336039879 134060972 /nfs/dbraw/zinc/06/09/72/134060972.db2.gz JYCWYVNPGHJUGO-OKPNEXGHSA-N 1 2 220.320 2.125 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)[C@@H]1/C=C/CCCCC1 ZINC000336039879 134060973 /nfs/dbraw/zinc/06/09/73/134060973.db2.gz JYCWYVNPGHJUGO-OKPNEXGHSA-N 1 2 220.320 2.125 20 0 BEADLO Cc1[nH+]c2ccc(C(=O)N3CCCC3)cc2n1C ZINC000336063675 134069568 /nfs/dbraw/zinc/06/95/68/134069568.db2.gz KADFQHUBHNCQDW-UHFFFAOYSA-N 1 2 243.310 2.118 20 0 BEADLO Cc1cnn(Cc2ccc(C)[nH+]c2C)c1 ZINC000336082962 134075684 /nfs/dbraw/zinc/07/56/84/134075684.db2.gz ZTAIRIDJJATCNU-UHFFFAOYSA-N 1 2 201.273 2.252 20 0 BEADLO Cc1ccc2c(c1)CC[N@@H+](Cc1ccn(C)n1)C2 ZINC000336089230 134078017 /nfs/dbraw/zinc/07/80/17/134078017.db2.gz PEJMEVGEMPVHDH-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO Cc1ccc2c(c1)CC[N@H+](Cc1ccn(C)n1)C2 ZINC000336089230 134078018 /nfs/dbraw/zinc/07/80/18/134078018.db2.gz PEJMEVGEMPVHDH-UHFFFAOYSA-N 1 2 241.338 2.287 20 0 BEADLO Cc1cc[nH]c1C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000336153529 134105107 /nfs/dbraw/zinc/10/51/07/134105107.db2.gz HUJOYAHAKYHQTI-JTQLQIEISA-N 1 2 244.298 2.024 20 0 BEADLO OCC[N@@H+]1CCc2c(Cl)c(Cl)ccc2C1 ZINC000336209741 134133945 /nfs/dbraw/zinc/13/39/45/134133945.db2.gz VDKBNSPYZJBXRV-UHFFFAOYSA-N 1 2 246.137 2.344 20 0 BEADLO OCC[N@H+]1CCc2c(Cl)c(Cl)ccc2C1 ZINC000336209741 134133946 /nfs/dbraw/zinc/13/39/46/134133946.db2.gz VDKBNSPYZJBXRV-UHFFFAOYSA-N 1 2 246.137 2.344 20 0 BEADLO C[C@H]([NH2+]Cc1ccn[nH]1)[C@@H]1COc2ccccc21 ZINC000169170615 134249602 /nfs/dbraw/zinc/24/96/02/134249602.db2.gz PWSWMOVKRFJDGN-GWCFXTLKSA-N 1 2 243.310 2.064 20 0 BEADLO CC(C)n1ccc(C[N@@H+]2CCCO[C@@H](C)C2)n1 ZINC000172013714 134264190 /nfs/dbraw/zinc/26/41/90/134264190.db2.gz VFPBWGGTNWHBFM-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccc(C[N@H+]2CCCO[C@@H](C)C2)n1 ZINC000172013714 134264191 /nfs/dbraw/zinc/26/41/91/134264191.db2.gz VFPBWGGTNWHBFM-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccc(C[N@H+](C)C[C@@H]2CCCO2)n1 ZINC000172013532 134264375 /nfs/dbraw/zinc/26/43/75/134264375.db2.gz GYHUAZQPBXSGEI-ZDUSSCGKSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccc(C[N@@H+](C)C[C@@H]2CCCO2)n1 ZINC000172013532 134264376 /nfs/dbraw/zinc/26/43/76/134264376.db2.gz GYHUAZQPBXSGEI-ZDUSSCGKSA-N 1 2 237.347 2.075 20 0 BEADLO CCOC[C@@H]1CCN(c2cc[nH+]c(C(C)C)n2)C1 ZINC000175050534 134284415 /nfs/dbraw/zinc/28/44/15/134284415.db2.gz APMDBNANDKYUGM-GFCCVEGCSA-N 1 2 249.358 2.463 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@H]1C[C@@H]1C1CC1 ZINC000176025425 134290118 /nfs/dbraw/zinc/29/01/18/134290118.db2.gz IAROYNOLAUFMEL-MNOVXSKESA-N 1 2 216.284 2.375 20 0 BEADLO C[C@@H]1CCC[C@@H](CC[N@H+](C)Cc2nnc[nH]2)C1 ZINC000177103009 134295200 /nfs/dbraw/zinc/29/52/00/134295200.db2.gz LJCBYCWYQBWUJE-NEPJUHHUSA-N 1 2 236.363 2.453 20 0 BEADLO C[C@@H]1CCC[C@@H](CC[N@@H+](C)Cc2nnc[nH]2)C1 ZINC000177103009 134295201 /nfs/dbraw/zinc/29/52/01/134295201.db2.gz LJCBYCWYQBWUJE-NEPJUHHUSA-N 1 2 236.363 2.453 20 0 BEADLO C[C@H](c1ccncc1)N(C)Cc1[nH+]ccn1C ZINC000179259986 134319893 /nfs/dbraw/zinc/31/98/93/134319893.db2.gz GIFQVWZUHJDPBL-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1ccncc1)[N@H+](C)Cc1nccn1C ZINC000179259986 134319894 /nfs/dbraw/zinc/31/98/94/134319894.db2.gz GIFQVWZUHJDPBL-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1nccn1C ZINC000179259986 134319895 /nfs/dbraw/zinc/31/98/95/134319895.db2.gz GIFQVWZUHJDPBL-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO COC1CC(Nc2ccc(N3CCCC3)[nH+]c2)C1 ZINC000221243787 134322518 /nfs/dbraw/zinc/32/25/18/134322518.db2.gz MNBYTPHFFMTZOB-UHFFFAOYSA-N 1 2 247.342 2.271 20 0 BEADLO CC[C@@H](C)[C@H](C)C(=O)NCCCn1cc[nH+]c1 ZINC000182891742 134349509 /nfs/dbraw/zinc/34/95/09/134349509.db2.gz FUTFOADMVSPDER-NEPJUHHUSA-N 1 2 237.347 2.072 20 0 BEADLO C[C@@H]1CC(C(=O)NCCc2[nH]cc[nH+]2)C[C@@H](C)C1 ZINC000183750270 134354021 /nfs/dbraw/zinc/35/40/21/134354021.db2.gz SFYIOIIVAWFAKV-QWRGUYRKSA-N 1 2 249.358 2.141 20 0 BEADLO C/C=C/CS(=O)(=O)Cc1ccc(C)[nH+]c1C ZINC000185174297 134372362 /nfs/dbraw/zinc/37/23/62/134372362.db2.gz CRZDHSNWXQVHJD-SNAWJCMRSA-N 1 2 239.340 2.189 20 0 BEADLO CO[C@H]1C[C@@H](Nc2cc(C)[nH+]cn2)C1(C)C ZINC000227822020 134389484 /nfs/dbraw/zinc/38/94/84/134389484.db2.gz GAIPUMOONUHYPJ-ZJUUUORDSA-N 1 2 221.304 2.010 20 0 BEADLO C[C@@H]1CCC[C@@H]1CNc1[nH+]cnc2c1cnn2C ZINC000230695528 134531550 /nfs/dbraw/zinc/53/15/50/134531550.db2.gz YVJWIVFYIPFDFD-NXEZZACHSA-N 1 2 245.330 2.211 20 0 BEADLO Cc1cccc2c1OCC[C@H]2[NH2+]Cc1ncc[nH]1 ZINC000188877949 134538429 /nfs/dbraw/zinc/53/84/29/134538429.db2.gz BJFYUYKVKVNDPT-GFCCVEGCSA-N 1 2 243.310 2.332 20 0 BEADLO C1=C[C@H]2C[C@@H]1C[C@@H]2CN1CC[NH+](CC2CC2)CC1 ZINC000130643082 134621457 /nfs/dbraw/zinc/62/14/57/134621457.db2.gz TUJXTIZBDIUIRD-OWCLPIDISA-N 1 2 246.398 2.226 20 0 BEADLO CO[C@@H](C)CN1CC[N@H+](C)C[C@H]1c1ccccc1 ZINC000248417693 135008385 /nfs/dbraw/zinc/00/83/85/135008385.db2.gz JSWHLMCOWQJHQG-ZFWWWQNUSA-N 1 2 248.370 2.010 20 0 BEADLO CO[C@@H](C)CN1CC[N@@H+](C)C[C@H]1c1ccccc1 ZINC000248417693 135008387 /nfs/dbraw/zinc/00/83/87/135008387.db2.gz JSWHLMCOWQJHQG-ZFWWWQNUSA-N 1 2 248.370 2.010 20 0 BEADLO C[C@H](c1cnccn1)[N@@H+]1C[C@H](C)OC(C)(C)C1 ZINC000248639410 135017239 /nfs/dbraw/zinc/01/72/39/135017239.db2.gz XQKBGVJBRZUECV-WDEREUQCSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H](c1cnccn1)[N@H+]1C[C@H](C)OC(C)(C)C1 ZINC000248639410 135017241 /nfs/dbraw/zinc/01/72/41/135017241.db2.gz XQKBGVJBRZUECV-WDEREUQCSA-N 1 2 235.331 2.037 20 0 BEADLO Cc1cc(NC[C@]2(C)CCCS2)nc[nH+]1 ZINC000087620147 135159510 /nfs/dbraw/zinc/15/95/10/135159510.db2.gz OKWFYVWXQMFYEO-NSHDSACASA-N 1 2 223.345 2.483 20 0 BEADLO C[NH2+]Cc1noc([C@H]2CC3CCC2CC3)n1 ZINC000261542887 135182935 /nfs/dbraw/zinc/18/29/35/135182935.db2.gz HEEVOVMLSVTITC-RTBKNWGFSA-N 1 2 221.304 2.083 20 0 BEADLO C[NH2+]Cc1noc(/C=C(/C)C(C)(C)C)n1 ZINC000261548661 135187494 /nfs/dbraw/zinc/18/74/94/135187494.db2.gz NUBBMCBNQPNGOO-VURMDHGXSA-N 1 2 209.293 2.238 20 0 BEADLO CCC(C)(C)c1csc([C@@H]2COCC[NH2+]2)n1 ZINC000261571743 135213883 /nfs/dbraw/zinc/21/38/83/135213883.db2.gz HURXEXLCCPNRGN-VIFPVBQESA-N 1 2 240.372 2.492 20 0 BEADLO Cc1cc(NC(=O)CCc2ccncc2)cc[nH+]1 ZINC000078892444 135250880 /nfs/dbraw/zinc/25/08/80/135250880.db2.gz PBNYNJFZHVDAON-UHFFFAOYSA-N 1 2 241.294 2.356 20 0 BEADLO CCCC[N@@H+]1CC(=O)N[C@]12CC[C@@H](C)[C@@H](C)C2 ZINC000342453578 135276010 /nfs/dbraw/zinc/27/60/10/135276010.db2.gz NAXJAILDDZCEGY-MBNYWOFBSA-N 1 2 238.375 2.371 20 0 BEADLO CCCC[N@H+]1CC(=O)N[C@]12CC[C@@H](C)[C@@H](C)C2 ZINC000342453578 135276012 /nfs/dbraw/zinc/27/60/12/135276012.db2.gz NAXJAILDDZCEGY-MBNYWOFBSA-N 1 2 238.375 2.371 20 0 BEADLO Cc1[nH]c2ccc(CSc3nc[nH]n3)cc2[nH+]1 ZINC000342689139 135305776 /nfs/dbraw/zinc/30/57/76/135305776.db2.gz RYLSSBWUGJVHRQ-UHFFFAOYSA-N 1 2 245.311 2.282 20 0 BEADLO Cc1[nH]c2cc(CSc3nc[nH]n3)ccc2[nH+]1 ZINC000342689139 135305778 /nfs/dbraw/zinc/30/57/78/135305778.db2.gz RYLSSBWUGJVHRQ-UHFFFAOYSA-N 1 2 245.311 2.282 20 0 BEADLO Cc1c[nH+]c(CN(C)[C@H](C)c2ccncc2)n1C ZINC000342797522 135321460 /nfs/dbraw/zinc/32/14/60/135321460.db2.gz PCYSSUICXWVELM-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1c[nH+]c(CN(CC(F)F)C(C)C)n1C ZINC000342801569 135322316 /nfs/dbraw/zinc/32/23/16/135322316.db2.gz XYYVUPSTSGRYBP-UHFFFAOYSA-N 1 2 231.290 2.204 20 0 BEADLO Cc1c[nH+]c(CN(C)c2ccccc2)n1C ZINC000342773508 135327230 /nfs/dbraw/zinc/32/72/30/135327230.db2.gz DFDWGOOKPRTZCX-UHFFFAOYSA-N 1 2 215.300 2.365 20 0 BEADLO CC1(C)CC[C@@H](C(=O)N2CCn3cc[nH+]c3C2)C1 ZINC000334338584 135356978 /nfs/dbraw/zinc/35/69/78/135356978.db2.gz YTWMPDVCRRJXND-LLVKDONJSA-N 1 2 247.342 2.052 20 0 BEADLO CCC1CC([NH2+][C@@H]2CCO[C@]3(CCOC3)C2)C1 ZINC000334354038 135370427 /nfs/dbraw/zinc/37/04/27/135370427.db2.gz YWCRPMRNSSIYHM-FKZOYECMSA-N 1 2 239.359 2.103 20 0 BEADLO C[C@@H]1CC[N@@H+](CCC(C)(C)C)CC[S@]1=O ZINC000334357761 135370560 /nfs/dbraw/zinc/37/05/60/135370560.db2.gz QTSLBQWKGDXDOS-IAQYHMDHSA-N 1 2 231.405 2.266 20 0 BEADLO c1snnc1C[N@@H+]1CC2(CCC2)[C@H]1C1CC1 ZINC000334385311 135381719 /nfs/dbraw/zinc/38/17/19/135381719.db2.gz MMDQVXLTNURJBI-LLVKDONJSA-N 1 2 235.356 2.303 20 0 BEADLO c1snnc1C[N@H+]1CC2(CCC2)[C@H]1C1CC1 ZINC000334385311 135381721 /nfs/dbraw/zinc/38/17/21/135381721.db2.gz MMDQVXLTNURJBI-LLVKDONJSA-N 1 2 235.356 2.303 20 0 BEADLO CCC1(C(=O)Nc2cc[nH+]c(C)c2)CCC1 ZINC000334385467 135382440 /nfs/dbraw/zinc/38/24/40/135382440.db2.gz NANJVIRKQNNPJM-UHFFFAOYSA-N 1 2 218.300 2.331 20 0 BEADLO CC(C)[C@H](C)CNc1[nH+]cnc2c1cnn2C ZINC000081070419 135386764 /nfs/dbraw/zinc/38/67/64/135386764.db2.gz IYZXVVIUUVPACH-SECBINFHSA-N 1 2 233.319 2.067 20 0 BEADLO CC1(C)C[N@H+](Cc2ccon2)[C@H]1[C@H]1CCCO1 ZINC000334406758 135393683 /nfs/dbraw/zinc/39/36/83/135393683.db2.gz HYYHAVPIBRDMNG-NEPJUHHUSA-N 1 2 236.315 2.064 20 0 BEADLO CC1(C)C[N@@H+](Cc2ccon2)[C@H]1[C@H]1CCCO1 ZINC000334406758 135393684 /nfs/dbraw/zinc/39/36/84/135393684.db2.gz HYYHAVPIBRDMNG-NEPJUHHUSA-N 1 2 236.315 2.064 20 0 BEADLO CC1(C)C[N@H+](Cc2ccon2)[C@@H]1[C@@H]1CCCO1 ZINC000334406761 135394326 /nfs/dbraw/zinc/39/43/26/135394326.db2.gz HYYHAVPIBRDMNG-NWDGAFQWSA-N 1 2 236.315 2.064 20 0 BEADLO CC1(C)C[N@@H+](Cc2ccon2)[C@@H]1[C@@H]1CCCO1 ZINC000334406761 135394327 /nfs/dbraw/zinc/39/43/27/135394327.db2.gz HYYHAVPIBRDMNG-NWDGAFQWSA-N 1 2 236.315 2.064 20 0 BEADLO CC[C@H](C)[N@H+](C)Cc1ncn(-c2ccccc2)n1 ZINC000092803605 135582672 /nfs/dbraw/zinc/58/26/72/135582672.db2.gz XEOUHCSXNJDMEQ-LBPRGKRZSA-N 1 2 244.342 2.498 20 0 BEADLO CC[C@H](C)[N@@H+](C)Cc1ncn(-c2ccccc2)n1 ZINC000092803605 135582674 /nfs/dbraw/zinc/58/26/74/135582674.db2.gz XEOUHCSXNJDMEQ-LBPRGKRZSA-N 1 2 244.342 2.498 20 0 BEADLO C[C@@H]1CC[C@H]1[NH+]=c1[nH]c2cccc(F)c2n1C ZINC000343807573 135699158 /nfs/dbraw/zinc/69/91/58/135699158.db2.gz LPAIPLOVKKVILF-PSASIEDQSA-N 1 2 233.290 2.345 20 0 BEADLO CC(C)c1nc(NC[C@H]2CCCCO2)cc[nH+]1 ZINC000346939354 135981011 /nfs/dbraw/zinc/98/10/11/135981011.db2.gz IDOGISVNBVFIOA-LLVKDONJSA-N 1 2 235.331 2.003 20 0 BEADLO O=C1CCC(C[N@@H+](CC(F)F)C2CC2)CC1 ZINC000347729021 136003931 /nfs/dbraw/zinc/00/39/31/136003931.db2.gz DQQOABRJLLBTCS-UHFFFAOYSA-N 1 2 231.286 2.475 20 0 BEADLO O=C1CCC(C[N@H+](CC(F)F)C2CC2)CC1 ZINC000347729021 136003932 /nfs/dbraw/zinc/00/39/32/136003932.db2.gz DQQOABRJLLBTCS-UHFFFAOYSA-N 1 2 231.286 2.475 20 0 BEADLO FC(F)n1ccc(C[N@@H+]2C[C@H]3CCC[C@@H]32)n1 ZINC000347701427 136007193 /nfs/dbraw/zinc/00/71/93/136007193.db2.gz LERNRVOACPRJDB-SCZZXKLOSA-N 1 2 227.258 2.263 20 0 BEADLO FC(F)n1ccc(C[N@H+]2C[C@H]3CCC[C@@H]32)n1 ZINC000347701427 136007194 /nfs/dbraw/zinc/00/71/94/136007194.db2.gz LERNRVOACPRJDB-SCZZXKLOSA-N 1 2 227.258 2.263 20 0 BEADLO COC1CCC(CCNc2cc[nH+]c(C)n2)CC1 ZINC000347870357 136016534 /nfs/dbraw/zinc/01/65/34/136016534.db2.gz BSLIMGJCUZDIMW-UHFFFAOYSA-N 1 2 249.358 2.214 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@H](C(C)C)C2)nc1 ZINC000335316442 136025060 /nfs/dbraw/zinc/02/50/60/136025060.db2.gz QGEKHGZWUSHRPG-AWEZNQCLSA-N 1 2 234.343 2.247 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@H](C(C)C)C2)nc1 ZINC000335316442 136025061 /nfs/dbraw/zinc/02/50/61/136025061.db2.gz QGEKHGZWUSHRPG-AWEZNQCLSA-N 1 2 234.343 2.247 20 0 BEADLO Fc1ccccc1CC[N@@H+]1CCOCC12CC2 ZINC000335316814 136025195 /nfs/dbraw/zinc/02/51/95/136025195.db2.gz GRTZCYFKIURXIU-UHFFFAOYSA-N 1 2 235.302 2.233 20 0 BEADLO Fc1ccccc1CC[N@H+]1CCOCC12CC2 ZINC000335316814 136025196 /nfs/dbraw/zinc/02/51/96/136025196.db2.gz GRTZCYFKIURXIU-UHFFFAOYSA-N 1 2 235.302 2.233 20 0 BEADLO Cc1cc(C(=O)C[N@H+]2CC=C(C)CC2)c(C)[nH]1 ZINC000335308526 136027657 /nfs/dbraw/zinc/02/76/57/136027657.db2.gz IXSVPBGOFAKHBI-UHFFFAOYSA-N 1 2 232.327 2.466 20 0 BEADLO Cc1cc(C(=O)C[N@@H+]2CC=C(C)CC2)c(C)[nH]1 ZINC000335308526 136027658 /nfs/dbraw/zinc/02/76/58/136027658.db2.gz IXSVPBGOFAKHBI-UHFFFAOYSA-N 1 2 232.327 2.466 20 0 BEADLO CC(C)c1nc(N[C@@H]2C[C@H]2C(F)F)cc[nH+]1 ZINC000348113306 136037450 /nfs/dbraw/zinc/03/74/50/136037450.db2.gz FWBXTBMFSPPLHZ-HTQZYQBOSA-N 1 2 227.258 2.087 20 0 BEADLO CCc1ccc(CN(C)Cc2[nH+]ccn2C)cn1 ZINC000348130309 136038277 /nfs/dbraw/zinc/03/82/77/136038277.db2.gz CEAWGGLNXVBUNZ-UHFFFAOYSA-N 1 2 244.342 2.010 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[NH2+][C@H]1C[C@H]1CC ZINC000348155953 136040581 /nfs/dbraw/zinc/04/05/81/136040581.db2.gz ZWIHJYOUZVVMLW-WOPDTQHZSA-N 1 2 227.348 2.352 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CC[C@@H](C)[C@H](C)C2)c[nH+]1 ZINC000348197205 136051204 /nfs/dbraw/zinc/05/12/04/136051204.db2.gz CZBVENQGJDGERN-FXPVBKGRSA-N 1 2 235.331 2.273 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CC[C@H](C)[C@@H](C)C2)c[nH+]1 ZINC000348197203 136051234 /nfs/dbraw/zinc/05/12/34/136051234.db2.gz CZBVENQGJDGERN-ATZCPNFKSA-N 1 2 235.331 2.273 20 0 BEADLO Cn1c[nH+]cc1CNc1cccc2c1OCCC2 ZINC000335329196 136053136 /nfs/dbraw/zinc/05/31/36/136053136.db2.gz YCCRQVVXFKUEBH-UHFFFAOYSA-N 1 2 243.310 2.357 20 0 BEADLO C[C@@H](c1cnccn1)[N@@H+]1C[C@@H](C)O[C@@H](C2CC2)C1 ZINC000348206469 136054089 /nfs/dbraw/zinc/05/40/89/136054089.db2.gz PGJUOJNNQQJIEG-UHIISALHSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@@H](c1cnccn1)[N@H+]1C[C@@H](C)O[C@@H](C2CC2)C1 ZINC000348206469 136054090 /nfs/dbraw/zinc/05/40/90/136054090.db2.gz PGJUOJNNQQJIEG-UHIISALHSA-N 1 2 247.342 2.037 20 0 BEADLO CCc1nnc([C@H](C)[N@@H+]2CC[C@](C)(F)C2)o1 ZINC000335354772 136070994 /nfs/dbraw/zinc/07/09/94/136070994.db2.gz HFADDQWWQDUXCT-KWQFWETISA-N 1 2 227.283 2.127 20 0 BEADLO CCc1nnc([C@H](C)[N@H+]2CC[C@](C)(F)C2)o1 ZINC000335354772 136070995 /nfs/dbraw/zinc/07/09/95/136070995.db2.gz HFADDQWWQDUXCT-KWQFWETISA-N 1 2 227.283 2.127 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)c1ccccc1 ZINC000348430933 136078441 /nfs/dbraw/zinc/07/84/41/136078441.db2.gz ZXRVYVODWOKPSJ-UHFFFAOYSA-N 1 2 242.278 2.020 20 0 BEADLO Cc1noc(C[N@H+]2Cc3ccccc3C[C@H]2C)n1 ZINC000335370075 136082724 /nfs/dbraw/zinc/08/27/24/136082724.db2.gz AONHLGBLLZEDAY-SNVBAGLBSA-N 1 2 243.310 2.325 20 0 BEADLO Cc1noc(C[N@@H+]2Cc3ccccc3C[C@H]2C)n1 ZINC000335370075 136082725 /nfs/dbraw/zinc/08/27/25/136082725.db2.gz AONHLGBLLZEDAY-SNVBAGLBSA-N 1 2 243.310 2.325 20 0 BEADLO Cn1c2cc(F)ccc2[nH+]c1N1CC[C@@H](F)C1 ZINC000335398622 136093341 /nfs/dbraw/zinc/09/33/41/136093341.db2.gz BSIPBNQECLMLQM-SECBINFHSA-N 1 2 237.253 2.261 20 0 BEADLO Cc1ncc(C[N@@H+]2CCC[C@@](C)(F)C2)cn1 ZINC000335364111 136094807 /nfs/dbraw/zinc/09/48/07/136094807.db2.gz VPBULYMPSGLDSH-GFCCVEGCSA-N 1 2 223.295 2.109 20 0 BEADLO Cc1ncc(C[N@H+]2CCC[C@@](C)(F)C2)cn1 ZINC000335364111 136094808 /nfs/dbraw/zinc/09/48/08/136094808.db2.gz VPBULYMPSGLDSH-GFCCVEGCSA-N 1 2 223.295 2.109 20 0 BEADLO C[C@H]1[C@@H](O)CCC[N@@H+]1Cc1ncc(Cl)s1 ZINC000335364061 136094853 /nfs/dbraw/zinc/09/48/53/136094853.db2.gz STBPIEMAUHGZFI-YUMQZZPRSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@H]1[C@@H](O)CCC[N@H+]1Cc1ncc(Cl)s1 ZINC000335364061 136094854 /nfs/dbraw/zinc/09/48/54/136094854.db2.gz STBPIEMAUHGZFI-YUMQZZPRSA-N 1 2 246.763 2.142 20 0 BEADLO O=C(Nc1ccsc1)[C@H]1CCc2c[nH+]cn2C1 ZINC000335547947 136096821 /nfs/dbraw/zinc/09/68/21/136096821.db2.gz LVECJWIBKUXSGV-VIFPVBQESA-N 1 2 247.323 2.146 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1CCC(C)=C(C)C1 ZINC000335549585 136097629 /nfs/dbraw/zinc/09/76/29/136097629.db2.gz WSJFKMGQWRZKIO-GFCCVEGCSA-N 1 2 247.342 2.471 20 0 BEADLO Cc1c(Cl)c(C[NH+]2CCCCC2)nn1C ZINC000335551711 136098509 /nfs/dbraw/zinc/09/85/09/136098509.db2.gz UOYUYRJIGCKNOJ-UHFFFAOYSA-N 1 2 227.739 2.368 20 0 BEADLO Cc1cc(C)c(NC(=O)Nc2cn[nH]c2)c(C)[nH+]1 ZINC000335585910 136102021 /nfs/dbraw/zinc/10/20/21/136102021.db2.gz GMQQFJYMOJKABI-UHFFFAOYSA-N 1 2 245.286 2.374 20 0 BEADLO CC1(C)C[NH+](Cc2c[nH]nn2)CC(C)(C)C1 ZINC000335591889 136103379 /nfs/dbraw/zinc/10/33/79/136103379.db2.gz YKJBHGZJMDNGJK-UHFFFAOYSA-N 1 2 222.336 2.063 20 0 BEADLO CC1(C)C[NH+](Cc2cnn[nH]2)CC(C)(C)C1 ZINC000335591889 136103380 /nfs/dbraw/zinc/10/33/80/136103380.db2.gz YKJBHGZJMDNGJK-UHFFFAOYSA-N 1 2 222.336 2.063 20 0 BEADLO CC1(C)C[NH+](Cc2cn[nH]n2)CC(C)(C)C1 ZINC000335591889 136103381 /nfs/dbraw/zinc/10/33/81/136103381.db2.gz YKJBHGZJMDNGJK-UHFFFAOYSA-N 1 2 222.336 2.063 20 0 BEADLO CCc1[nH]c(CNC(=O)CCCC2CC2)c[nH+]1 ZINC001646324720 1172731425 /nfs/dbraw/zinc/73/14/25/1172731425.db2.gz DTAYVTLUXKEPNI-UHFFFAOYSA-N 1 2 235.331 2.169 20 0 BEADLO CCc1[nH]cc(CNC(=O)CCCC2CC2)[nH+]1 ZINC001646324720 1172731432 /nfs/dbraw/zinc/73/14/32/1172731432.db2.gz DTAYVTLUXKEPNI-UHFFFAOYSA-N 1 2 235.331 2.169 20 0 BEADLO CC(C)[C@H](C)C(=O)NCc1[nH]c2c([nH+]1)CCCC2 ZINC001647345037 1172757887 /nfs/dbraw/zinc/75/78/87/1172757887.db2.gz XVQJTQGHJRUYCO-JTQLQIEISA-N 1 2 249.358 2.197 20 0 BEADLO Fc1cc(C[NH2+]Cc2cc[nH]n2)cc(F)c1F ZINC000062708368 322859869 /nfs/dbraw/zinc/85/98/69/322859869.db2.gz RLDVPZRIHGQTEQ-UHFFFAOYSA-N 1 2 241.216 2.117 20 0 BEADLO Cc1cnc(C[N@@H+]2CCS[C@H](C)C2)s1 ZINC000180473385 397857650 /nfs/dbraw/zinc/85/76/50/397857650.db2.gz KGNQTCARKUBZRE-SECBINFHSA-N 1 2 228.386 2.389 20 0 BEADLO Cc1cnc(C[N@H+]2CCS[C@H](C)C2)s1 ZINC000180473385 397857652 /nfs/dbraw/zinc/85/76/52/397857652.db2.gz KGNQTCARKUBZRE-SECBINFHSA-N 1 2 228.386 2.389 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@H]1CCCC(F)(F)C1 ZINC000309851806 397870636 /nfs/dbraw/zinc/87/06/36/397870636.db2.gz JCTWSJVMLCAKOJ-JTQLQIEISA-N 1 2 229.274 2.386 20 0 BEADLO COc1cccc2c1C[N@H+](CC(F)F)CC2 ZINC000650107805 397927944 /nfs/dbraw/zinc/92/79/44/397927944.db2.gz IUCYMLJNIDJZGR-UHFFFAOYSA-N 1 2 227.254 2.318 20 0 BEADLO COc1cccc2c1C[N@@H+](CC(F)F)CC2 ZINC000650107805 397927948 /nfs/dbraw/zinc/92/79/48/397927948.db2.gz IUCYMLJNIDJZGR-UHFFFAOYSA-N 1 2 227.254 2.318 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)CCc1ccsc1 ZINC000266967671 397941760 /nfs/dbraw/zinc/94/17/60/397941760.db2.gz KCACDPMUCKKMNS-UHFFFAOYSA-N 1 2 249.339 2.029 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccncc2F)[C@@H](C)[C@@H](C)O1 ZINC000449264562 397954113 /nfs/dbraw/zinc/95/41/13/397954113.db2.gz MQZGPEOUPCNDBB-OUAUKWLOSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccncc2F)[C@@H](C)[C@@H](C)O1 ZINC000449264562 397954117 /nfs/dbraw/zinc/95/41/17/397954117.db2.gz MQZGPEOUPCNDBB-OUAUKWLOSA-N 1 2 238.306 2.218 20 0 BEADLO CC(C)c1occc1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000359495563 397954723 /nfs/dbraw/zinc/95/47/23/397954723.db2.gz URMHGMSHCNHMMJ-UHFFFAOYSA-N 1 2 247.298 2.398 20 0 BEADLO CCc1cc(N[C@H](C)[C@@H](OC)C2CC2)nc[nH+]1 ZINC000388245880 397954921 /nfs/dbraw/zinc/95/49/21/397954921.db2.gz SUJRXCUTCQENMX-NOZJJQNGSA-N 1 2 235.331 2.264 20 0 BEADLO CC(C)CN(C(=O)C[C@H](C)n1cc[nH+]c1)C1CC1 ZINC000649580239 397968358 /nfs/dbraw/zinc/96/83/58/397968358.db2.gz ZFOYTAGWRPLJCT-LBPRGKRZSA-N 1 2 249.358 2.481 20 0 BEADLO COc1cccc(CNc2c[nH+]ccc2OC)n1 ZINC000191532938 397890183 /nfs/dbraw/zinc/89/01/83/397890183.db2.gz IRUMRIGQVFFOOI-UHFFFAOYSA-N 1 2 245.282 2.106 20 0 BEADLO CCC[C@H](C(=O)NCc1[nH+]ccn1C)C(C)C ZINC000270685311 397962698 /nfs/dbraw/zinc/96/26/98/397962698.db2.gz UMKQYVMMNAVWHW-NSHDSACASA-N 1 2 237.347 2.109 20 0 BEADLO CC(C)C[C@@H](C)CC(=O)NCc1[nH+]ccn1C ZINC000264305896 397919609 /nfs/dbraw/zinc/91/96/09/397919609.db2.gz MSBYCXZDWYZOJS-LLVKDONJSA-N 1 2 237.347 2.109 20 0 BEADLO C[C@H](CC(=O)N1CC(C)(C)C[C@@H]1C)n1cc[nH+]c1 ZINC000650098566 397920990 /nfs/dbraw/zinc/92/09/90/397920990.db2.gz JIKDYAGSMGJHTA-NEPJUHHUSA-N 1 2 249.358 2.481 20 0 BEADLO O[C@@H]1CCCC[C@H]1C[N@H+](CC(F)F)C1CC1 ZINC000382218983 397924015 /nfs/dbraw/zinc/92/40/15/397924015.db2.gz MNYOFRTYIUDJAU-GXSJLCMTSA-N 1 2 233.302 2.267 20 0 BEADLO O[C@@H]1CCCC[C@H]1C[N@@H+](CC(F)F)C1CC1 ZINC000382218983 397924019 /nfs/dbraw/zinc/92/40/19/397924019.db2.gz MNYOFRTYIUDJAU-GXSJLCMTSA-N 1 2 233.302 2.267 20 0 BEADLO C[C@@H](CC(=O)N(C)c1ccccc1)n1cc[nH+]c1 ZINC000649537103 397926219 /nfs/dbraw/zinc/92/62/19/397926219.db2.gz TUOMEUQYFKCNLU-LBPRGKRZSA-N 1 2 243.310 2.497 20 0 BEADLO CC(C)CCN(C)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000649598954 397990011 /nfs/dbraw/zinc/99/00/11/397990011.db2.gz HACXPPSDXOBAPN-LBPRGKRZSA-N 1 2 237.347 2.339 20 0 BEADLO FC1(F)CCC[N@H+](CC[C@@H]2CCOC2)C1 ZINC000649695956 398044982 /nfs/dbraw/zinc/04/49/82/398044982.db2.gz OVRIWODMJSPEBG-SNVBAGLBSA-N 1 2 219.275 2.144 20 0 BEADLO FC1(F)CCC[N@@H+](CC[C@@H]2CCOC2)C1 ZINC000649695956 398044985 /nfs/dbraw/zinc/04/49/85/398044985.db2.gz OVRIWODMJSPEBG-SNVBAGLBSA-N 1 2 219.275 2.144 20 0 BEADLO CCc1cc[nH+]cc1NCc1c(C)nnn1CC ZINC000650242903 398005290 /nfs/dbraw/zinc/00/52/90/398005290.db2.gz BJOYDJBAFDWSCD-UHFFFAOYSA-N 1 2 245.330 2.176 20 0 BEADLO CCc1cc[nH+]cc1NCc1ccnc(OC)n1 ZINC000650243240 398005546 /nfs/dbraw/zinc/00/55/46/398005546.db2.gz PZYHGJWRXGARJF-UHFFFAOYSA-N 1 2 244.298 2.055 20 0 BEADLO FC(F)C[N@@H+]1CCC[C@]2(CCSC2)C1 ZINC000650261939 398012971 /nfs/dbraw/zinc/01/29/71/398012971.db2.gz UGMMKZDVKXWEEI-JTQLQIEISA-N 1 2 221.316 2.471 20 0 BEADLO FC(F)C[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000650261939 398012976 /nfs/dbraw/zinc/01/29/76/398012976.db2.gz UGMMKZDVKXWEEI-JTQLQIEISA-N 1 2 221.316 2.471 20 0 BEADLO CCc1nc(C[N@@H+]2CCC23CCCC3)no1 ZINC000649656352 398026897 /nfs/dbraw/zinc/02/68/97/398026897.db2.gz JSUAYIRIKLXNKN-UHFFFAOYSA-N 1 2 221.304 2.151 20 0 BEADLO CCc1nc(C[N@H+]2CCC23CCCC3)no1 ZINC000649656352 398026898 /nfs/dbraw/zinc/02/68/98/398026898.db2.gz JSUAYIRIKLXNKN-UHFFFAOYSA-N 1 2 221.304 2.151 20 0 BEADLO O=C(CCn1cc[nH+]c1)NC1CCC2(CC2)CC1 ZINC000277542403 398030997 /nfs/dbraw/zinc/03/09/97/398030997.db2.gz WVWQHGMVZUGEQF-UHFFFAOYSA-N 1 2 247.342 2.112 20 0 BEADLO FC1(F)CCC[N@H+](C[C@H]2CCCCO2)C1 ZINC000649691758 398038722 /nfs/dbraw/zinc/03/87/22/398038722.db2.gz RCTUEXZARGLMBD-SNVBAGLBSA-N 1 2 219.275 2.287 20 0 BEADLO FC1(F)CCC[N@@H+](C[C@H]2CCCCO2)C1 ZINC000649691758 398038728 /nfs/dbraw/zinc/03/87/28/398038728.db2.gz RCTUEXZARGLMBD-SNVBAGLBSA-N 1 2 219.275 2.287 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1cccc(F)c1)c1ncn(C)n1 ZINC000275598714 398041064 /nfs/dbraw/zinc/04/10/64/398041064.db2.gz IYESIOPREACWSR-NXEZZACHSA-N 1 2 248.305 2.366 20 0 BEADLO COCCCC[N@@H+]1CCCC(F)(F)C1 ZINC000649693701 398041417 /nfs/dbraw/zinc/04/14/17/398041417.db2.gz MVSTZUVVSPYWSO-UHFFFAOYSA-N 1 2 207.264 2.144 20 0 BEADLO COCCCC[N@H+]1CCCC(F)(F)C1 ZINC000649693701 398041420 /nfs/dbraw/zinc/04/14/20/398041420.db2.gz MVSTZUVVSPYWSO-UHFFFAOYSA-N 1 2 207.264 2.144 20 0 BEADLO O=C(CCn1cc[nH+]c1)N[C@H]1CC12CCCCC2 ZINC000271725420 397971511 /nfs/dbraw/zinc/97/15/11/397971511.db2.gz YIGPVQASAQOULZ-LBPRGKRZSA-N 1 2 247.342 2.112 20 0 BEADLO CCO[C@@H]1C[C@@H](N(C)c2cc[nH+]c(C)n2)C1(C)C ZINC000361042720 397971751 /nfs/dbraw/zinc/97/17/51/397971751.db2.gz CEWUYSRFQCMRMY-VXGBXAGGSA-N 1 2 249.358 2.425 20 0 BEADLO CO[C@@H]1[C@@H](C)[C@H](Nc2cc[nH+]c(C)n2)C1(C)C ZINC000271754775 397972862 /nfs/dbraw/zinc/97/28/62/397972862.db2.gz CPSGNYTURIVRSM-KPXOXKRLSA-N 1 2 235.331 2.256 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1CCO[C@H](C)C1 ZINC000271979888 397976506 /nfs/dbraw/zinc/97/65/06/397976506.db2.gz OKNHGVWTPMKADM-GHMZBOCLSA-N 1 2 234.299 2.144 20 0 BEADLO Cc1cc(NCCOC2CCCC2)nc[nH+]1 ZINC000082627698 397980957 /nfs/dbraw/zinc/98/09/57/397980957.db2.gz CSUJWGIMDVZCLC-UHFFFAOYSA-N 1 2 221.304 2.156 20 0 BEADLO FC1(F)CCC[N@H+](CCc2cccnc2)C1 ZINC000649695243 398043153 /nfs/dbraw/zinc/04/31/53/398043153.db2.gz NWZCLJZKFZCSGH-UHFFFAOYSA-N 1 2 226.270 2.355 20 0 BEADLO FC1(F)CCC[N@@H+](CCc2cccnc2)C1 ZINC000649695243 398043156 /nfs/dbraw/zinc/04/31/56/398043156.db2.gz NWZCLJZKFZCSGH-UHFFFAOYSA-N 1 2 226.270 2.355 20 0 BEADLO CC1(C)CC=C(C(=O)NCCc2[nH]cc[nH+]2)CC1 ZINC000455589245 397989644 /nfs/dbraw/zinc/98/96/44/397989644.db2.gz LOFZASUZLLSXKG-UHFFFAOYSA-N 1 2 247.342 2.205 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cnc(C)nc2)[C@H](CC)CO1 ZINC000649718653 398060263 /nfs/dbraw/zinc/06/02/63/398060263.db2.gz DFJFNTWXUFBKRD-ZIAGYGMSSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cnc(C)nc2)[C@H](CC)CO1 ZINC000649718653 398060265 /nfs/dbraw/zinc/06/02/65/398060265.db2.gz DFJFNTWXUFBKRD-ZIAGYGMSSA-N 1 2 249.358 2.174 20 0 BEADLO C[C@H]([NH2+][C@@H](C1CC1)C(F)(F)F)[C@H]1CCOC1 ZINC000336735617 398064832 /nfs/dbraw/zinc/06/48/32/398064832.db2.gz IFHRILGCVYPFAD-HGNGGELXSA-N 1 2 237.265 2.342 20 0 BEADLO C[C@H]([NH2+][C@H](C1CC1)C(F)(F)F)[C@@H]1CCOC1 ZINC000336735616 398064896 /nfs/dbraw/zinc/06/48/96/398064896.db2.gz IFHRILGCVYPFAD-FXBDTBDDSA-N 1 2 237.265 2.342 20 0 BEADLO CC[C@H]1C[N@H+](Cc2nc(C)c(C)o2)[C@@H](C)CO1 ZINC000649731627 398070862 /nfs/dbraw/zinc/07/08/62/398070862.db2.gz KHUIUKDKFKBWOV-CABZTGNLSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2nc(C)c(C)o2)[C@@H](C)CO1 ZINC000649731627 398070865 /nfs/dbraw/zinc/07/08/65/398070865.db2.gz KHUIUKDKFKBWOV-CABZTGNLSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nc(C)c(C)o2)[C@H](C)CO1 ZINC000649731626 398071363 /nfs/dbraw/zinc/07/13/63/398071363.db2.gz KHUIUKDKFKBWOV-BXKDBHETSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nc(C)c(C)o2)[C@H](C)CO1 ZINC000649731626 398071366 /nfs/dbraw/zinc/07/13/66/398071366.db2.gz KHUIUKDKFKBWOV-BXKDBHETSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2c(C)noc2C)[C@H](C)CO1 ZINC000649731510 398071673 /nfs/dbraw/zinc/07/16/73/398071673.db2.gz INGGTLSKVQLRQB-BXKDBHETSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2c(C)noc2C)[C@H](C)CO1 ZINC000649731510 398071676 /nfs/dbraw/zinc/07/16/76/398071676.db2.gz INGGTLSKVQLRQB-BXKDBHETSA-N 1 2 238.331 2.291 20 0 BEADLO CCC1(C)CCN(C(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000283509092 398074990 /nfs/dbraw/zinc/07/49/90/398074990.db2.gz PQAMYXQMCIJTOT-SNAWJCMRSA-N 1 2 247.342 2.462 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC[C@H]2C2CC2)sn1 ZINC000638116589 398077328 /nfs/dbraw/zinc/07/73/28/398077328.db2.gz JSZXSTIMJRUFJL-LBPRGKRZSA-N 1 2 238.356 2.062 20 0 BEADLO Cc1cc(C[N@H+]2CCOC[C@H]2C2CC2)sn1 ZINC000638116589 398077330 /nfs/dbraw/zinc/07/73/30/398077330.db2.gz JSZXSTIMJRUFJL-LBPRGKRZSA-N 1 2 238.356 2.062 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cc(C)no2)[C@@H](CC)CO1 ZINC000649717769 398058823 /nfs/dbraw/zinc/05/88/23/398058823.db2.gz MEONBTUOTZSPLV-RYUDHWBXSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cc(C)no2)[C@@H](CC)CO1 ZINC000649717769 398058825 /nfs/dbraw/zinc/05/88/25/398058825.db2.gz MEONBTUOTZSPLV-RYUDHWBXSA-N 1 2 238.331 2.372 20 0 BEADLO CCC[N@H+](CC(F)F)C[C@@H](O)CC(F)(F)F ZINC000189028501 398096768 /nfs/dbraw/zinc/09/67/68/398096768.db2.gz AWRVFBOHEIUASI-ZETCQYMHSA-N 1 2 249.223 2.277 20 0 BEADLO CCC[N@@H+](CC(F)F)C[C@@H](O)CC(F)(F)F ZINC000189028501 398096769 /nfs/dbraw/zinc/09/67/69/398096769.db2.gz AWRVFBOHEIUASI-ZETCQYMHSA-N 1 2 249.223 2.277 20 0 BEADLO CC1(C)CCC[C@@H]1CNC(=O)CCn1cc[nH+]c1 ZINC000294035572 398120472 /nfs/dbraw/zinc/12/04/72/398120472.db2.gz DNAFAJIWNMTSDW-GFCCVEGCSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1nccn1C ZINC000528768095 398126445 /nfs/dbraw/zinc/12/64/45/398126445.db2.gz NJFYWILUEBNJLH-VIFPVBQESA-N 1 2 229.274 2.040 20 0 BEADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1nccn1C ZINC000528768095 398126449 /nfs/dbraw/zinc/12/64/49/398126449.db2.gz NJFYWILUEBNJLH-VIFPVBQESA-N 1 2 229.274 2.040 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1C[C@H](C)O[C@H]1C ZINC000385058104 398128616 /nfs/dbraw/zinc/12/86/16/398128616.db2.gz CMROLIVKRQHWBC-LPEHRKFASA-N 1 2 222.288 2.068 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1C[C@@H](C)O[C@H]1C ZINC000385058102 398128775 /nfs/dbraw/zinc/12/87/75/398128775.db2.gz CMROLIVKRQHWBC-KXUCPTDWSA-N 1 2 222.288 2.068 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1cc(C)sc1C ZINC000195001556 398129620 /nfs/dbraw/zinc/12/96/20/398129620.db2.gz OPMPOTMWQWPKDW-UHFFFAOYSA-N 1 2 241.356 2.360 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1cc(C)sc1C ZINC000195001556 398129621 /nfs/dbraw/zinc/12/96/21/398129621.db2.gz OPMPOTMWQWPKDW-UHFFFAOYSA-N 1 2 241.356 2.360 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2ccoc2)on1 ZINC000087290102 322876215 /nfs/dbraw/zinc/87/62/15/322876215.db2.gz MINPQZVMWRQNDX-VIFPVBQESA-N 1 2 206.245 2.427 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@H](C)C(C)(C)C)no1 ZINC000668798423 487557246 /nfs/dbraw/zinc/55/72/46/487557246.db2.gz LBTRGLVOTPCSLK-VIFPVBQESA-N 1 2 225.336 2.492 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@H](C)C(C)(C)C)no1 ZINC000668798423 487557251 /nfs/dbraw/zinc/55/72/51/487557251.db2.gz LBTRGLVOTPCSLK-VIFPVBQESA-N 1 2 225.336 2.492 20 0 BEADLO Cc1nn(C)cc1CNc1cc[nH+]c(C(C)C)n1 ZINC000680326048 487561910 /nfs/dbraw/zinc/56/19/10/487561910.db2.gz AGCZXJPKRDELLM-UHFFFAOYSA-N 1 2 245.330 2.254 20 0 BEADLO Cc1ccc(C[N@@H+](Cc2cncn2C)C2CC2)o1 ZINC000674370134 487567035 /nfs/dbraw/zinc/56/70/35/487567035.db2.gz ORPIFSIQOLSISY-UHFFFAOYSA-N 1 2 245.326 2.486 20 0 BEADLO Cc1ccc(C[N@H+](Cc2cncn2C)C2CC2)o1 ZINC000674370134 487567039 /nfs/dbraw/zinc/56/70/39/487567039.db2.gz ORPIFSIQOLSISY-UHFFFAOYSA-N 1 2 245.326 2.486 20 0 BEADLO C[C@@H]1CCCC[C@@H]1CC(=O)Nc1cc[nH+]cc1O ZINC000530883350 322897224 /nfs/dbraw/zinc/89/72/24/322897224.db2.gz ZRMQFCNXZZXNIV-GHMZBOCLSA-N 1 2 248.326 2.364 20 0 BEADLO CCn1cnc(Cl)c1C[NH2+][C@@H](C)CF ZINC001651138276 1172925520 /nfs/dbraw/zinc/92/55/20/1172925520.db2.gz BTEHICGWGSXOOK-ZETCQYMHSA-N 1 2 219.691 2.004 20 0 BEADLO CC(C)OC[C@@H](C)[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000337245511 167258531 /nfs/dbraw/zinc/25/85/31/167258531.db2.gz HGFQLYOCWOFFBG-GHMZBOCLSA-N 1 2 245.363 2.120 20 0 BEADLO C[C@H](N(C)C(=O)CCCn1cc[nH+]c1)C1(C)CC1 ZINC000674537524 487596099 /nfs/dbraw/zinc/59/60/99/487596099.db2.gz HOXQRJRHGNUSOW-LBPRGKRZSA-N 1 2 249.358 2.310 20 0 BEADLO C[C@H]1CCCN1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000674568739 487596964 /nfs/dbraw/zinc/59/69/64/487596964.db2.gz MAIPPPHZGOBXDI-JTQLQIEISA-N 1 2 244.298 2.351 20 0 BEADLO CC1(CNC(=O)Nc2ccc3[nH+]ccn3c2)CC1 ZINC000674569209 487597179 /nfs/dbraw/zinc/59/71/79/487597179.db2.gz TYVLLSPBLWUXBP-UHFFFAOYSA-N 1 2 244.298 2.256 20 0 BEADLO CC[C@@H](Nc1ccc(OC)c[nH+]1)c1ccn(C)n1 ZINC000680469018 487602275 /nfs/dbraw/zinc/60/22/75/487602275.db2.gz WYSVZDYVDLCZQI-LLVKDONJSA-N 1 2 246.314 2.387 20 0 BEADLO c1csc(C[NH2+]Cc2ccc3c(n2)CCC3)n1 ZINC000556776963 322923243 /nfs/dbraw/zinc/92/32/43/322923243.db2.gz HJDAKYVRRYPKBX-UHFFFAOYSA-N 1 2 245.351 2.317 20 0 BEADLO C[C@H](c1csnn1)[N@H+](C)CC1=CCSC1 ZINC000662267614 409570173 /nfs/dbraw/zinc/57/01/73/409570173.db2.gz WFTVJCRSVSANEX-MRVPVSSYSA-N 1 2 241.385 2.204 20 0 BEADLO C[C@H](c1csnn1)[N@@H+](C)CC1=CCSC1 ZINC000662267614 409570181 /nfs/dbraw/zinc/57/01/81/409570181.db2.gz WFTVJCRSVSANEX-MRVPVSSYSA-N 1 2 241.385 2.204 20 0 BEADLO C[C@@H](C[N@H+](C)Cc1n[nH]c(=O)o1)c1ccccc1 ZINC000660850790 409866946 /nfs/dbraw/zinc/86/69/46/409866946.db2.gz YFFLPWHZDUTSDX-JTQLQIEISA-N 1 2 247.298 2.011 20 0 BEADLO C[C@@H](C[N@@H+](C)Cc1n[nH]c(=O)o1)c1ccccc1 ZINC000660850790 409866954 /nfs/dbraw/zinc/86/69/54/409866954.db2.gz YFFLPWHZDUTSDX-JTQLQIEISA-N 1 2 247.298 2.011 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1Cc1coc(C)n1 ZINC000660911628 409960372 /nfs/dbraw/zinc/96/03/72/409960372.db2.gz FHWFECSQLKMTQT-OLZOCXBDSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@H+]1Cc1coc(C)n1 ZINC000660911628 409960378 /nfs/dbraw/zinc/96/03/78/409960378.db2.gz FHWFECSQLKMTQT-OLZOCXBDSA-N 1 2 238.331 2.372 20 0 BEADLO CCOCn1c[nH+]c2c1C[C@@H](C)[C@H](C)C2 ZINC000308951978 410073245 /nfs/dbraw/zinc/07/32/45/410073245.db2.gz VLZYVGVZEWBRQF-NXEZZACHSA-N 1 2 208.305 2.248 20 0 BEADLO CCc1cc[nH+]cc1N[C@@H]1CCCOC1 ZINC000651979373 410112789 /nfs/dbraw/zinc/11/27/89/410112789.db2.gz MIIGXCOEYXSVRX-LLVKDONJSA-N 1 2 206.289 2.235 20 0 BEADLO CCc1cc[nH+]cc1N[C@H](C)Cn1cccn1 ZINC000651979355 410113160 /nfs/dbraw/zinc/11/31/60/410113160.db2.gz LMPCYYIMKMILGG-LLVKDONJSA-N 1 2 230.315 2.341 20 0 BEADLO CCc1cc[nH+]cc1N[C@H](C)[C@H]1CCOC1 ZINC000651979791 410114554 /nfs/dbraw/zinc/11/45/54/410114554.db2.gz JQGDJQFCUHXALQ-PWSUYJOCSA-N 1 2 220.316 2.481 20 0 BEADLO C[C@@H](NC(=O)[C@H](C)C1CCCC1)c1[nH]cc[nH+]1 ZINC000655401807 410205417 /nfs/dbraw/zinc/20/54/17/410205417.db2.gz HEGICWLFXPZXAJ-NXEZZACHSA-N 1 2 235.331 2.413 20 0 BEADLO C[C@@H](NC(=O)CCCC1CC1)c1[nH]cc[nH+]1 ZINC000655401943 410205824 /nfs/dbraw/zinc/20/58/24/410205824.db2.gz FJIXHRRGBVSKHS-SECBINFHSA-N 1 2 221.304 2.167 20 0 BEADLO CC[C@H](C)NC(=O)c1ccn2cc(C)[nH+]c2c1 ZINC000071540714 410416014 /nfs/dbraw/zinc/41/60/14/410416014.db2.gz VMDFEFVZVONKSD-VIFPVBQESA-N 1 2 231.299 2.171 20 0 BEADLO C[C@@H](CCO)N(C)c1[nH+]ccc2c(N)cccc21 ZINC000664071058 410452776 /nfs/dbraw/zinc/45/27/76/410452776.db2.gz RWJPGVPXUOXFSU-JTQLQIEISA-N 1 2 245.326 2.024 20 0 BEADLO O[C@@H]1C[C@@H](Nc2cc[nH+]c(C3CC3)n2)C12CCC2 ZINC000664465146 410586531 /nfs/dbraw/zinc/58/65/31/410586531.db2.gz GKEJQRHRQDILDQ-GHMZBOCLSA-N 1 2 245.326 2.069 20 0 BEADLO O[C@H]1C[C@@H](Nc2cc[nH+]c(C3CC3)n2)C12CCC2 ZINC000664465147 410586542 /nfs/dbraw/zinc/58/65/42/410586542.db2.gz GKEJQRHRQDILDQ-MNOVXSKESA-N 1 2 245.326 2.069 20 0 BEADLO CCCCCNC(=O)Cc1cn2c([nH+]1)CCCC2 ZINC000650982706 410671532 /nfs/dbraw/zinc/67/15/32/410671532.db2.gz DVKKDCGQNYUALS-UHFFFAOYSA-N 1 2 249.358 2.068 20 0 BEADLO O[C@@H]1CC[N@H+](CCCC2CCC2)CC1(F)F ZINC000661414764 410625940 /nfs/dbraw/zinc/62/59/40/410625940.db2.gz VSJXTUKJNOWLFC-LLVKDONJSA-N 1 2 233.302 2.269 20 0 BEADLO O[C@@H]1CC[N@@H+](CCCC2CCC2)CC1(F)F ZINC000661414764 410625943 /nfs/dbraw/zinc/62/59/43/410625943.db2.gz VSJXTUKJNOWLFC-LLVKDONJSA-N 1 2 233.302 2.269 20 0 BEADLO CC(C)(C)OC(=O)NCc1ccn2cc[nH+]c2c1 ZINC000178402742 166664538 /nfs/dbraw/zinc/66/45/38/166664538.db2.gz SIKVHZUTOBCXED-UHFFFAOYSA-N 1 2 247.298 2.359 20 0 BEADLO COc1cc(OC)cc(-c2c[nH+]cn2C)c1 ZINC000665219487 410722108 /nfs/dbraw/zinc/72/21/08/410722108.db2.gz YJGMHTZOJSVZJP-UHFFFAOYSA-N 1 2 218.256 2.104 20 0 BEADLO CCC[C@@H](CNc1[nH+]cccc1OC)OC ZINC000393473594 410688573 /nfs/dbraw/zinc/68/85/73/410688573.db2.gz GPZDHOIFDGVHHP-JTQLQIEISA-N 1 2 224.304 2.317 20 0 BEADLO CC(C)CCC(=O)NCCNc1cccc[nH+]1 ZINC000063705633 166793245 /nfs/dbraw/zinc/79/32/45/166793245.db2.gz FJJKXXWVAUUGPZ-UHFFFAOYSA-N 1 2 235.331 2.046 20 0 BEADLO CC[C@H](C)CN(C)c1cc(CO)cc[nH+]1 ZINC000040877672 410895475 /nfs/dbraw/zinc/89/54/75/410895475.db2.gz WMHAPLVXTPLHOB-JTQLQIEISA-N 1 2 208.305 2.056 20 0 BEADLO CC[C@@H](C)CN(C)c1cc(CO)cc[nH+]1 ZINC000040877670 410895883 /nfs/dbraw/zinc/89/58/83/410895883.db2.gz WMHAPLVXTPLHOB-SNVBAGLBSA-N 1 2 208.305 2.056 20 0 BEADLO CC(C)OC(=O)[C@H](C)[N@@H+]1CCc2ccccc2C1 ZINC000340726890 167169646 /nfs/dbraw/zinc/16/96/46/167169646.db2.gz OSEDZTKAJQDCPG-LBPRGKRZSA-N 1 2 247.338 2.385 20 0 BEADLO CC(C)OC(=O)[C@H](C)[N@H+]1CCc2ccccc2C1 ZINC000340726890 167169651 /nfs/dbraw/zinc/16/96/51/167169651.db2.gz OSEDZTKAJQDCPG-LBPRGKRZSA-N 1 2 247.338 2.385 20 0 BEADLO CC(C)OC(=O)[C@H]1CN(c2cccc[nH+]2)C[C@@H]1C ZINC000353637060 167169929 /nfs/dbraw/zinc/16/99/29/167169929.db2.gz JNMXBZOVQKEKRX-RYUDHWBXSA-N 1 2 248.326 2.106 20 0 BEADLO CC(C)OC[C@H](C)[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000337245513 167266259 /nfs/dbraw/zinc/26/62/59/167266259.db2.gz HGFQLYOCWOFFBG-QWRGUYRKSA-N 1 2 245.363 2.120 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1C[C@H](OC)C12CCC2 ZINC000651302508 410912041 /nfs/dbraw/zinc/91/20/41/410912041.db2.gz XGHADMAKMDUJHX-NEPJUHHUSA-N 1 2 248.326 2.460 20 0 BEADLO CC(C)Oc1ccccc1C[NH+]1CCOCC1 ZINC000055897370 167310091 /nfs/dbraw/zinc/31/00/91/167310091.db2.gz GTSZZILGCGZZKS-UHFFFAOYSA-N 1 2 235.327 2.306 20 0 BEADLO CC(C)[C@@H](NC(=O)Cc1ccoc1)c1[nH]cc[nH+]1 ZINC000338882175 167424376 /nfs/dbraw/zinc/42/43/76/167424376.db2.gz YEQNKBDSPYWLKR-GFCCVEGCSA-N 1 2 247.298 2.059 20 0 BEADLO CCC[C@H](C)[C@H](CO)Nc1cc(CC)[nH+]cn1 ZINC000651384260 410967671 /nfs/dbraw/zinc/96/76/71/410967671.db2.gz IIPRAEXDZPUKLU-JQWIXIFHSA-N 1 2 237.347 2.248 20 0 BEADLO CC(C)O[C@@H]1CCCN(c2cccc[nH+]2)C1 ZINC000651385679 410969486 /nfs/dbraw/zinc/96/94/86/410969486.db2.gz OHVNICAIFHKJOI-GFCCVEGCSA-N 1 2 220.316 2.475 20 0 BEADLO C[C@H](N(C)c1cc(CO)cc[nH+]1)C(C)(C)C ZINC000042779006 411042465 /nfs/dbraw/zinc/04/24/65/411042465.db2.gz YIENPXLIHRWBMP-JTQLQIEISA-N 1 2 222.332 2.445 20 0 BEADLO Cn1cnc(C[NH+]2CCC(C(F)(F)F)CC2)c1 ZINC000659974700 411151646 /nfs/dbraw/zinc/15/16/46/411151646.db2.gz IZCCYRXIQKFIHH-UHFFFAOYSA-N 1 2 247.264 2.194 20 0 BEADLO CC(C)(C)C[C@@H]1C[C@H]1NC(=O)CCc1[nH]cc[nH+]1 ZINC000652758358 411151659 /nfs/dbraw/zinc/15/16/59/411151659.db2.gz SMGAKOYGVWDBTG-WDEREUQCSA-N 1 2 249.358 2.283 20 0 BEADLO COCc1cc[nH+]c(N[C@H](C)[C@@H]2CCOC2)c1 ZINC000652067660 411103553 /nfs/dbraw/zinc/10/35/53/411103553.db2.gz BZSRCFQOWDIFLY-ZYHUDNBSSA-N 1 2 236.315 2.065 20 0 BEADLO COCc1cc[nH+]c(NC[C@H]2C[C@H]2C)c1 ZINC000652067800 411104674 /nfs/dbraw/zinc/10/46/74/411104674.db2.gz HYAGSHADZYNDEP-MWLCHTKSSA-N 1 2 206.289 2.296 20 0 BEADLO COCc1cc[nH+]c(N[C@H]2CSC[C@H]2C)c1 ZINC000652068286 411105110 /nfs/dbraw/zinc/10/51/10/411105110.db2.gz XYBOBYDLDRDUIB-KOLCDFICSA-N 1 2 238.356 2.391 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2CCOC[C@H]2C)c1 ZINC000652068180 411105688 /nfs/dbraw/zinc/10/56/88/411105688.db2.gz VJSPKHOVBUZUAG-ZYHUDNBSSA-N 1 2 236.315 2.065 20 0 BEADLO F[C@H]1CCC[N@H+](Cc2cccc3c2OCO3)C1 ZINC000652079424 411111843 /nfs/dbraw/zinc/11/18/43/411111843.db2.gz FRZBGXUKASQLRL-NSHDSACASA-N 1 2 237.274 2.349 20 0 BEADLO F[C@H]1CCC[N@@H+](Cc2cccc3c2OCO3)C1 ZINC000652079424 411111846 /nfs/dbraw/zinc/11/18/46/411111846.db2.gz FRZBGXUKASQLRL-NSHDSACASA-N 1 2 237.274 2.349 20 0 BEADLO CCC(CC)Nc1nc[nH+]c(C)c1OC ZINC000656103772 411178848 /nfs/dbraw/zinc/17/88/48/411178848.db2.gz HMINXFBCJGYLJR-UHFFFAOYSA-N 1 2 209.293 2.394 20 0 BEADLO COc1c(C)[nH+]cnc1NCc1cccc(C)n1 ZINC000656110307 411180418 /nfs/dbraw/zinc/18/04/18/411180418.db2.gz CRCFWHHCTSLLKN-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO CC[C@@H](C)CN(C)c1nc[nH+]c(C)c1OC ZINC000656125126 411183466 /nfs/dbraw/zinc/18/34/66/411183466.db2.gz WTYJJSJAOKLOEV-SECBINFHSA-N 1 2 223.320 2.276 20 0 BEADLO COc1c(C)[nH+]cnc1N1CC[C@@H](C)[C@H]1C ZINC000656138179 411185462 /nfs/dbraw/zinc/18/54/62/411185462.db2.gz PFEXXPLUUIFOJW-PSASIEDQSA-N 1 2 221.304 2.028 20 0 BEADLO COc1c(C)[nH+]cnc1NC[C@H]1CCCS1 ZINC000656145155 411186069 /nfs/dbraw/zinc/18/60/69/411186069.db2.gz MPFRNZTXYJTIMW-SECBINFHSA-N 1 2 239.344 2.101 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1[C@@H]2CCC[C@@H]21 ZINC000656182201 411194215 /nfs/dbraw/zinc/19/42/15/411194215.db2.gz UPRRVYQDGAGYRH-JGPRNRPPSA-N 1 2 203.289 2.304 20 0 BEADLO CC(C)[C@@H](O)C[NH+]1Cc2cc(F)c(F)cc2C1 ZINC000653830514 411195508 /nfs/dbraw/zinc/19/55/08/411195508.db2.gz BYEGRVPKOJEFMN-ZDUSSCGKSA-N 1 2 241.281 2.297 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@@H]2CCCn3nccc32)no1 ZINC000658005380 411195815 /nfs/dbraw/zinc/19/58/15/411195815.db2.gz ZGMRZKMJCNTTBL-WDEREUQCSA-N 1 2 246.314 2.365 20 0 BEADLO Cn1c[nH+]cc1CN1Cc2cc(F)c(F)cc2C1 ZINC000653833948 411196722 /nfs/dbraw/zinc/19/67/22/411196722.db2.gz YHMCVICRCCMAHG-UHFFFAOYSA-N 1 2 249.264 2.214 20 0 BEADLO CCc1nnc(CNc2nc(C)[nH+]cc2C)s1 ZINC000656189083 411197167 /nfs/dbraw/zinc/19/71/67/411197167.db2.gz RXRJTNOOKSKJLK-UHFFFAOYSA-N 1 2 249.343 2.119 20 0 BEADLO COc1c(C)[nH+]cnc1NCc1cc(C)ccn1 ZINC000656192384 411198274 /nfs/dbraw/zinc/19/82/74/411198274.db2.gz QNFAAFXUSRHRRC-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO COc1c(C)[nH+]cnc1NC[C@@H]1C[C@H]1C(C)C ZINC000656196783 411201473 /nfs/dbraw/zinc/20/14/73/411201473.db2.gz GJZGQXHTLQSOMI-QWRGUYRKSA-N 1 2 235.331 2.498 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](C)c2ccnn2C)c1 ZINC000652330365 411202259 /nfs/dbraw/zinc/20/22/59/411202259.db2.gz DLMNZIRPLQPTAH-JTQLQIEISA-N 1 2 246.314 2.135 20 0 BEADLO COc1c(C)[nH+]cnc1N1C[C@H](C)[C@H](C)[C@@H]1C ZINC000656204951 411207804 /nfs/dbraw/zinc/20/78/04/411207804.db2.gz QGVKPIOEQFQFEE-QXEWZRGKSA-N 1 2 235.331 2.274 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1C[C@H]2C[C@H]2C1 ZINC000656203181 411207875 /nfs/dbraw/zinc/20/78/75/411207875.db2.gz GGTPTTQBQGDSGR-ILWJIGKKSA-N 1 2 219.288 2.004 20 0 BEADLO Cc1nc(N[C@H](C)Cc2ccccn2)cc[nH+]1 ZINC000656221913 411211910 /nfs/dbraw/zinc/21/19/10/411211910.db2.gz XAPXUBKEODLIDL-SNVBAGLBSA-N 1 2 228.299 2.223 20 0 BEADLO Cc1nc(N2CCC[C@@H](OC3CCC3)C2)cc[nH+]1 ZINC000656216107 411212031 /nfs/dbraw/zinc/21/20/31/411212031.db2.gz DRVZMZHWLGLPNR-CYBMUJFWSA-N 1 2 247.342 2.323 20 0 BEADLO CC[C@H]1C[C@@H](Nc2cc(COC)cc[nH+]2)CO1 ZINC000658043395 411216815 /nfs/dbraw/zinc/21/68/15/411216815.db2.gz HEUSCOCZLSKIHD-NEPJUHHUSA-N 1 2 236.315 2.207 20 0 BEADLO COCc1cc[nH+]c(N[C@H]2COC3(CCC3)C2)c1 ZINC000658045378 411217473 /nfs/dbraw/zinc/21/74/73/411217473.db2.gz TWVUABAPEPYUML-GFCCVEGCSA-N 1 2 248.326 2.352 20 0 BEADLO FC1(F)CC12C[NH+](Cc1cnc3ccccn13)C2 ZINC000656265805 411220982 /nfs/dbraw/zinc/22/09/82/411220982.db2.gz JHXCJZSIZIZRKM-UHFFFAOYSA-N 1 2 249.264 2.175 20 0 BEADLO Cn1cc[nH+]c1-c1ccc2c(c1)CCC(=O)C2 ZINC000656371350 411236256 /nfs/dbraw/zinc/23/62/56/411236256.db2.gz FGSVTPWXLNZZBM-UHFFFAOYSA-N 1 2 226.279 2.145 20 0 BEADLO CC(C)Oc1cncc(-c2[nH+]ccn2C)c1 ZINC000656371572 411236940 /nfs/dbraw/zinc/23/69/40/411236940.db2.gz ITFGGZKXXAPUFR-UHFFFAOYSA-N 1 2 217.272 2.269 20 0 BEADLO Cn1cc[nH+]c1-c1ccc2c(c1)CCO2 ZINC000656371776 411237727 /nfs/dbraw/zinc/23/77/27/411237727.db2.gz TYRHMQJXFJGLPT-UHFFFAOYSA-N 1 2 200.241 2.022 20 0 BEADLO Cn1cc[nH+]c1-c1ccc2c(c1)COC2 ZINC000656371726 411238277 /nfs/dbraw/zinc/23/82/77/411238277.db2.gz QSPZTDRJQMJGEE-UHFFFAOYSA-N 1 2 200.241 2.117 20 0 BEADLO Cn1cc[nH+]c1-c1ccc2c(c1)C(=O)C(C)(C)O2 ZINC000656371819 411238448 /nfs/dbraw/zinc/23/84/48/411238448.db2.gz WUQOHNUSEWSMPO-UHFFFAOYSA-N 1 2 242.278 2.441 20 0 BEADLO Cn1cc[nH+]c1-c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000656371664 411238539 /nfs/dbraw/zinc/23/85/39/411238539.db2.gz NDKYWLXTKQPNLG-UHFFFAOYSA-N 1 2 241.294 2.317 20 0 BEADLO CC1(C)CCCN(c2cc(CO)cc[nH+]2)C1 ZINC000069793662 411266500 /nfs/dbraw/zinc/26/65/00/411266500.db2.gz NCBGVUSGXJUKTL-UHFFFAOYSA-N 1 2 220.316 2.200 20 0 BEADLO CCc1cc(C[NH2+][C@H]2CCCn3ccnc32)on1 ZINC000655715795 411269773 /nfs/dbraw/zinc/26/97/73/411269773.db2.gz NSCZHCCQEJKEHC-LBPRGKRZSA-N 1 2 246.314 2.058 20 0 BEADLO CC[N@H+](Cc1coc(C)n1)Cc1ccncc1 ZINC000660161744 411272337 /nfs/dbraw/zinc/27/23/37/411272337.db2.gz OLXMCUZODUDTGI-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1coc(C)n1)Cc1ccncc1 ZINC000660161744 411272338 /nfs/dbraw/zinc/27/23/38/411272338.db2.gz OLXMCUZODUDTGI-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cnccn2)o1 ZINC000656490072 411285860 /nfs/dbraw/zinc/28/58/60/411285860.db2.gz IFNMNRBXCUFDDL-GWCFXTLKSA-N 1 2 243.310 2.483 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1cc(C)nc(C)n1 ZINC000659840909 411329383 /nfs/dbraw/zinc/32/93/83/411329383.db2.gz LPJCCLVTAVSDGQ-RISCZKNCSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1cc(C)nc(C)n1 ZINC000659840909 411329384 /nfs/dbraw/zinc/32/93/84/411329384.db2.gz LPJCCLVTAVSDGQ-RISCZKNCSA-N 1 2 249.358 2.093 20 0 BEADLO CC(C)n1nccc1C[NH+]1CC(C(F)F)C1 ZINC000656691568 411330384 /nfs/dbraw/zinc/33/03/84/411330384.db2.gz MRBSLPTUDNFMNH-UHFFFAOYSA-N 1 2 229.274 2.161 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@@H]1CC12CCC2 ZINC000654002464 411310043 /nfs/dbraw/zinc/31/00/43/411310043.db2.gz AWILWDCGZBNFIN-QWRGUYRKSA-N 1 2 247.342 2.270 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)[C@@H]2CC23CCC3)c2[nH+]ccn21 ZINC000654012562 411315007 /nfs/dbraw/zinc/31/50/07/411315007.db2.gz FWVNPXILRQTDQN-VWYCJHECSA-N 1 2 245.326 2.195 20 0 BEADLO COc1cc(C)c(C)cc1[NH2+]C[C@H](C)CO ZINC000656660332 411318941 /nfs/dbraw/zinc/31/89/41/411318941.db2.gz WLTTZWBDSOZPTQ-VIFPVBQESA-N 1 2 223.316 2.352 20 0 BEADLO CC(C)[N@@H+](Cc1cn(C)cn1)Cc1ccco1 ZINC000659858072 411349246 /nfs/dbraw/zinc/34/92/46/411349246.db2.gz SGTDWTSPYNKGRA-UHFFFAOYSA-N 1 2 233.315 2.424 20 0 BEADLO CC(C)[N@H+](Cc1cn(C)cn1)Cc1ccco1 ZINC000659858072 411349248 /nfs/dbraw/zinc/34/92/48/411349248.db2.gz SGTDWTSPYNKGRA-UHFFFAOYSA-N 1 2 233.315 2.424 20 0 BEADLO C[C@@H](c1nccc(N)n1)[N@H+](C)Cc1ccsc1 ZINC000653483928 411372973 /nfs/dbraw/zinc/37/29/73/411372973.db2.gz HLSNDDCAQHINHA-VIFPVBQESA-N 1 2 248.355 2.144 20 0 BEADLO C[C@@H](c1nccc(N)n1)[N@@H+](C)Cc1ccsc1 ZINC000653483928 411372974 /nfs/dbraw/zinc/37/29/74/411372974.db2.gz HLSNDDCAQHINHA-VIFPVBQESA-N 1 2 248.355 2.144 20 0 BEADLO CC(C)n1cc[nH+]c1CNc1nnc(C2CC2)o1 ZINC000656768155 411362823 /nfs/dbraw/zinc/36/28/23/411362823.db2.gz JTJHJRVKWLOISE-UHFFFAOYSA-N 1 2 247.302 2.337 20 0 BEADLO Cc1ccc(NCc2cn(C3CCC3)nn2)c[nH+]1 ZINC000656769922 411362943 /nfs/dbraw/zinc/36/29/43/411362943.db2.gz JKLGGNPGTOMJQI-UHFFFAOYSA-N 1 2 243.314 2.319 20 0 BEADLO CCOC1(C)C[NH+](Cc2ccc(O)cc2)C1 ZINC000656736120 411341330 /nfs/dbraw/zinc/34/13/30/411341330.db2.gz NMJMHRZPMBSKDW-UHFFFAOYSA-N 1 2 221.300 2.003 20 0 BEADLO CCCCC(=O)N1CCC[C@@H](c2[nH+]ccn2C)C1 ZINC000373062208 411341601 /nfs/dbraw/zinc/34/16/01/411341601.db2.gz BDEMZBGZRPXFOO-GFCCVEGCSA-N 1 2 249.358 2.316 20 0 BEADLO CC1(CNc2cccc(-n3cc[nH+]c3)c2)COC1 ZINC000227520853 168048101 /nfs/dbraw/zinc/04/81/01/168048101.db2.gz ZRRZFURZVPRDOW-UHFFFAOYSA-N 1 2 243.310 2.321 20 0 BEADLO C[C@@H]1CCC(C)(C)N1C(=O)CCCn1cc[nH+]c1 ZINC000662019896 411347261 /nfs/dbraw/zinc/34/72/61/411347261.db2.gz ACHDWCJVZNMSFF-GFCCVEGCSA-N 1 2 249.358 2.453 20 0 BEADLO CC1=CCC[N@@H+](Cc2nc(CC(C)C)no2)C1 ZINC000280781569 168100070 /nfs/dbraw/zinc/10/00/70/168100070.db2.gz IHIIXRCVIVEKGS-UHFFFAOYSA-N 1 2 235.331 2.420 20 0 BEADLO CC1=CCC[N@H+](Cc2nc(CC(C)C)no2)C1 ZINC000280781569 168100072 /nfs/dbraw/zinc/10/00/72/168100072.db2.gz IHIIXRCVIVEKGS-UHFFFAOYSA-N 1 2 235.331 2.420 20 0 BEADLO CC1=CC[N@H+](CC(=O)OCc2ccccc2)CC1 ZINC000270340847 168110270 /nfs/dbraw/zinc/11/02/70/168110270.db2.gz NOGMATCVTRELGT-UHFFFAOYSA-N 1 2 245.322 2.382 20 0 BEADLO CC1=CC[N@@H+](CC(=O)OCc2ccccc2)CC1 ZINC000270340847 168110272 /nfs/dbraw/zinc/11/02/72/168110272.db2.gz NOGMATCVTRELGT-UHFFFAOYSA-N 1 2 245.322 2.382 20 0 BEADLO CC1=CC[N@H+](Cc2ncnn2CC(C)C)CC1 ZINC000272498464 168114215 /nfs/dbraw/zinc/11/42/15/168114215.db2.gz NPQHAQZUKUYRAQ-UHFFFAOYSA-N 1 2 234.347 2.086 20 0 BEADLO CC1=CC[N@@H+](Cc2ncnn2CC(C)C)CC1 ZINC000272498464 168114218 /nfs/dbraw/zinc/11/42/18/168114218.db2.gz NPQHAQZUKUYRAQ-UHFFFAOYSA-N 1 2 234.347 2.086 20 0 BEADLO CC1=C[C@@H](C)C[C@@H](C[N@H+]2CC(=O)N(C3CC3)C2)C1 ZINC000356415011 168124106 /nfs/dbraw/zinc/12/41/06/168124106.db2.gz CPRZZWHIWFPOCU-DGCLKSJQSA-N 1 2 248.370 2.243 20 0 BEADLO CC1=C[C@@H](C)C[C@@H](C[N@@H+]2CC(=O)N(C3CC3)C2)C1 ZINC000356415011 168124108 /nfs/dbraw/zinc/12/41/08/168124108.db2.gz CPRZZWHIWFPOCU-DGCLKSJQSA-N 1 2 248.370 2.243 20 0 BEADLO CC1=C[C@@H](C)C[C@H](C[N@H+](C)Cc2nnc[nH]2)C1 ZINC000290312039 168124998 /nfs/dbraw/zinc/12/49/98/168124998.db2.gz AQRQFTQLOINFNP-PWSUYJOCSA-N 1 2 234.347 2.229 20 0 BEADLO CC1=C[C@@H](C)C[C@H](C[N@@H+](C)Cc2nnc[nH]2)C1 ZINC000290312039 168124999 /nfs/dbraw/zinc/12/49/99/168124999.db2.gz AQRQFTQLOINFNP-PWSUYJOCSA-N 1 2 234.347 2.229 20 0 BEADLO CC1CCC(C)(CNC(=O)Cn2cc[nH+]c2)CC1 ZINC000360455404 168149231 /nfs/dbraw/zinc/14/92/31/168149231.db2.gz NPAOHIBSEPCUKF-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO CCC(=CC(=O)NC[C@@H](C)Cn1cc[nH+]c1)CC ZINC000268271293 168194257 /nfs/dbraw/zinc/19/42/57/168194257.db2.gz NVRKEXTZTXKYRE-GFCCVEGCSA-N 1 2 249.358 2.382 20 0 BEADLO CCC(C)(C)C(=O)NC[C@H](C)Cn1cc[nH+]c1 ZINC000265846156 168264280 /nfs/dbraw/zinc/26/42/80/168264280.db2.gz TUHJJCIFHLLSFJ-NSHDSACASA-N 1 2 237.347 2.072 20 0 BEADLO CCC(C)(C)CC(=O)NCc1[nH]c[nH+]c1C ZINC000331100470 168273509 /nfs/dbraw/zinc/27/35/09/168273509.db2.gz OHJHNLYXFXNVOE-UHFFFAOYSA-N 1 2 223.320 2.161 20 0 BEADLO CCC(C)(C)N(C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000284085156 168282722 /nfs/dbraw/zinc/28/27/22/168282722.db2.gz SHWWRJHRYAGLME-VOTSOKGWSA-N 1 2 221.304 2.070 20 0 BEADLO CC(C)n1ccnc1C[N@@H+]1CCC[C@@H]2COC[C@@H]21 ZINC000657294435 411455921 /nfs/dbraw/zinc/45/59/21/411455921.db2.gz BYIYQBOSHATQRM-OLZOCXBDSA-N 1 2 249.358 2.075 20 0 BEADLO CC(C)n1ccnc1C[N@H+]1CCC[C@@H]2COC[C@@H]21 ZINC000657294435 411455924 /nfs/dbraw/zinc/45/59/24/411455924.db2.gz BYIYQBOSHATQRM-OLZOCXBDSA-N 1 2 249.358 2.075 20 0 BEADLO CCC1(CNC(=O)[C@@H](C)Cc2c[nH+]c[nH]2)CCC1 ZINC000654877613 411459255 /nfs/dbraw/zinc/45/92/55/411459255.db2.gz YOXNVJMTGWEACS-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO CCC1(CNC(=O)[C@@H](C)Cc2c[nH]c[nH+]2)CCC1 ZINC000654877613 411459258 /nfs/dbraw/zinc/45/92/58/411459258.db2.gz YOXNVJMTGWEACS-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccco2)nc(C)n1 ZINC000659815721 411460248 /nfs/dbraw/zinc/46/02/48/411460248.db2.gz JFFBNUIFMCWWCM-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccco2)nc(C)n1 ZINC000659815721 411460251 /nfs/dbraw/zinc/46/02/51/411460251.db2.gz JFFBNUIFMCWWCM-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1c[nH+]c(C)c(NCc2ccn(C)n2)c1 ZINC000404617260 411401522 /nfs/dbraw/zinc/40/15/22/411401522.db2.gz XFOBOEVQAKJXSQ-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO COCc1cccc(NCc2[nH]cc(C)[nH+]2)c1 ZINC000657321469 411461487 /nfs/dbraw/zinc/46/14/87/411461487.db2.gz CKEMXTAKXMWWOZ-UHFFFAOYSA-N 1 2 231.299 2.477 20 0 BEADLO c1c(C[N@@H+]2CCO[C@@H](C3CC3)C2)onc1C1CC1 ZINC000660323413 411412219 /nfs/dbraw/zinc/41/22/19/411412219.db2.gz URWZPKUQMQKWMW-CQSZACIVSA-N 1 2 248.326 2.163 20 0 BEADLO c1c(C[N@H+]2CCO[C@@H](C3CC3)C2)onc1C1CC1 ZINC000660323413 411412221 /nfs/dbraw/zinc/41/22/21/411412221.db2.gz URWZPKUQMQKWMW-CQSZACIVSA-N 1 2 248.326 2.163 20 0 BEADLO CC(C)(C)[C@H](O)C[N@@H+]1CCCC(F)(F)C1 ZINC000405074224 411415612 /nfs/dbraw/zinc/41/56/12/411415612.db2.gz KSBSLWUANOVUDF-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)(C)[C@H](O)C[N@H+]1CCCC(F)(F)C1 ZINC000405074224 411415614 /nfs/dbraw/zinc/41/56/14/411415614.db2.gz KSBSLWUANOVUDF-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO Cc1cc(N[C@H]2CCS[C@@H]2C)nc[nH+]1 ZINC000306925665 411462220 /nfs/dbraw/zinc/46/22/20/411462220.db2.gz NEAJNFCAYWGZRU-BDAKNGLRSA-N 1 2 209.318 2.091 20 0 BEADLO CCCN(C)C(=O)c1ccn2c(C)c[nH+]c2c1 ZINC000654645477 411422474 /nfs/dbraw/zinc/42/24/74/411422474.db2.gz RQEXWBRVCARPNV-UHFFFAOYSA-N 1 2 231.299 2.125 20 0 BEADLO Cn1ncc2c1nc[nH+]c2SCC1CC=CC1 ZINC000657243510 411424441 /nfs/dbraw/zinc/42/44/41/411424441.db2.gz WEYPUHUGBFYUQJ-UHFFFAOYSA-N 1 2 246.339 2.422 20 0 BEADLO Cc1nc(CNCc2[nH]c(C)c(C)[nH+]2)cs1 ZINC000657317960 411463166 /nfs/dbraw/zinc/46/31/66/411463166.db2.gz JIYBRPJFBSOCRJ-UHFFFAOYSA-N 1 2 236.344 2.081 20 0 BEADLO Cn1cnc(C[N@H+](C)Cc2ccsc2)c1 ZINC000659820326 411463347 /nfs/dbraw/zinc/46/33/47/411463347.db2.gz FMKVLLIXGYXZFG-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO Cn1cnc(C[N@@H+](C)Cc2ccsc2)c1 ZINC000659820326 411463349 /nfs/dbraw/zinc/46/33/49/411463349.db2.gz FMKVLLIXGYXZFG-UHFFFAOYSA-N 1 2 221.329 2.114 20 0 BEADLO CC[C@@H]1CCCCN1C(=O)CCc1[nH]cc[nH+]1 ZINC000279250681 411446347 /nfs/dbraw/zinc/44/63/47/411446347.db2.gz RRIIVYACMYAGAK-LLVKDONJSA-N 1 2 235.331 2.133 20 0 BEADLO CC[C@H]1CCCCN1C(=O)CCc1[nH]cc[nH+]1 ZINC000279250685 411446538 /nfs/dbraw/zinc/44/65/38/411446538.db2.gz RRIIVYACMYAGAK-NSHDSACASA-N 1 2 235.331 2.133 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N3CCC3(C)C)ccn12 ZINC000654820956 411451005 /nfs/dbraw/zinc/45/10/05/411451005.db2.gz YVQRSMTUPZBYIP-UHFFFAOYSA-N 1 2 243.310 2.267 20 0 BEADLO Cc1[nH]c(CN[C@H](C)c2cccnc2)[nH+]c1C ZINC000657291790 411453488 /nfs/dbraw/zinc/45/34/88/411453488.db2.gz CPIVRTGGAZLZCT-LLVKDONJSA-N 1 2 230.315 2.272 20 0 BEADLO Cc1csc([C@@H](C)NCc2[nH]cc(C)[nH+]2)n1 ZINC000657345746 411470877 /nfs/dbraw/zinc/47/08/77/411470877.db2.gz XVGLOXFWDCUZOR-SECBINFHSA-N 1 2 236.344 2.334 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@H]2CF)cs1 ZINC000293056272 411471519 /nfs/dbraw/zinc/47/15/19/411471519.db2.gz NGORPUIIVXKIHF-JTQLQIEISA-N 1 2 214.309 2.385 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@H]2CF)cs1 ZINC000293056272 411471522 /nfs/dbraw/zinc/47/15/22/411471522.db2.gz NGORPUIIVXKIHF-JTQLQIEISA-N 1 2 214.309 2.385 20 0 BEADLO Cc1[nH]c(CNCc2cc(C(C)C)no2)[nH+]c1C ZINC000657361228 411478519 /nfs/dbraw/zinc/47/85/19/411478519.db2.gz ITHRFKHWONAYAC-UHFFFAOYSA-N 1 2 248.330 2.428 20 0 BEADLO Cc1c[nH]c(CNC(C)(C)c2nccs2)[nH+]1 ZINC000657363854 411481669 /nfs/dbraw/zinc/48/16/69/411481669.db2.gz PZTXNAJCOGMMDD-UHFFFAOYSA-N 1 2 236.344 2.200 20 0 BEADLO COCc1csc(C[NH2+]Cc2ccon2)c1 ZINC000657382194 411487732 /nfs/dbraw/zinc/48/77/32/411487732.db2.gz BPQLKQXCMAPNDV-UHFFFAOYSA-N 1 2 238.312 2.172 20 0 BEADLO COc1cc(C)ccc1C[NH2+]Cc1nc(C)c[nH]1 ZINC000657395785 411494219 /nfs/dbraw/zinc/49/42/19/411494219.db2.gz WYZWGJIKWCERHC-UHFFFAOYSA-N 1 2 245.326 2.325 20 0 BEADLO CCc1noc(CC)c1C[NH2+]Cc1nc(C)c[nH]1 ZINC000657397862 411495169 /nfs/dbraw/zinc/49/51/69/411495169.db2.gz XQYYPTZXZZOPHO-UHFFFAOYSA-N 1 2 248.330 2.121 20 0 BEADLO CC[C@@H]1C[C@@H](Nc2ccc(OC)c[nH+]2)CO1 ZINC000657402062 411496448 /nfs/dbraw/zinc/49/64/48/411496448.db2.gz LARKIUZJCDZAFC-NXEZZACHSA-N 1 2 222.288 2.070 20 0 BEADLO CC[C@H]1C[C@H](Nc2ccc(OC)c[nH+]2)CO1 ZINC000657402063 411496456 /nfs/dbraw/zinc/49/64/56/411496456.db2.gz LARKIUZJCDZAFC-UWVGGRQHSA-N 1 2 222.288 2.070 20 0 BEADLO CCCn1nccc1CNc1ccc(OC)c[nH+]1 ZINC000657402240 411496526 /nfs/dbraw/zinc/49/65/26/411496526.db2.gz OMVJILLBXHKVQL-UHFFFAOYSA-N 1 2 246.314 2.309 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)NCC[C@@H](C)F)ccn12 ZINC000655112765 411497141 /nfs/dbraw/zinc/49/71/41/411497141.db2.gz ICHZOZVRTISHFG-SECBINFHSA-N 1 2 249.289 2.121 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NC(C)(C)C1CCC1 ZINC000655129017 411501158 /nfs/dbraw/zinc/50/11/58/411501158.db2.gz KLCHUCJPAASXFY-JTQLQIEISA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NC(C)(C)C1CCC1 ZINC000655129017 411501160 /nfs/dbraw/zinc/50/11/60/411501160.db2.gz KLCHUCJPAASXFY-JTQLQIEISA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@@H]([NH2+]Cc1cc(C)cc(C)c1)C(=O)OC ZINC000383386473 411506472 /nfs/dbraw/zinc/50/64/72/411506472.db2.gz IIWKEIHVFGMVHF-CYBMUJFWSA-N 1 2 235.327 2.345 20 0 BEADLO CC(C)CC[C@H]1CCC[N@@H+]1CCc1cnn[nH]1 ZINC000660011938 411527932 /nfs/dbraw/zinc/52/79/32/411527932.db2.gz IVNFVIQOUHDBHM-CYBMUJFWSA-N 1 2 236.363 2.248 20 0 BEADLO CC(C)CC[C@H]1CCC[N@H+]1CCc1cnn[nH]1 ZINC000660011938 411527934 /nfs/dbraw/zinc/52/79/34/411527934.db2.gz IVNFVIQOUHDBHM-CYBMUJFWSA-N 1 2 236.363 2.248 20 0 BEADLO COc1c(C)cccc1C[NH2+]Cc1nccn1C ZINC000655832573 411528805 /nfs/dbraw/zinc/52/88/05/411528805.db2.gz WZRWAHXCZOSSKO-UHFFFAOYSA-N 1 2 245.326 2.027 20 0 BEADLO COc1c(C)cccc1C[NH2+]Cc1cc[nH]n1 ZINC000655831926 411529206 /nfs/dbraw/zinc/52/92/06/411529206.db2.gz OGTHECCWHBJINN-UHFFFAOYSA-N 1 2 231.299 2.017 20 0 BEADLO CC[NH+](CC)Cc1nnc(C(F)(F)F)s1 ZINC000659827309 411465003 /nfs/dbraw/zinc/46/50/03/411465003.db2.gz SJOUVZINHKKUSS-UHFFFAOYSA-N 1 2 239.266 2.399 20 0 BEADLO CC[N@@H+]1C[C@H]([NH2+]CCc2cccc(C)c2)[C@@H](C)C1 ZINC000358104903 170034605 /nfs/dbraw/zinc/03/46/05/170034605.db2.gz ZVJZNZSCMOFSCT-HOCLYGCPSA-N 1 2 246.398 2.467 20 0 BEADLO CCc1nnc([C@H](C)[N@H+]2CC=C(C)CC2)[nH]1 ZINC000660128320 411542246 /nfs/dbraw/zinc/54/22/46/411542246.db2.gz UOOSUYPKMCWIOQ-JTQLQIEISA-N 1 2 220.320 2.080 20 0 BEADLO CCc1nnc([C@H](C)[N@@H+]2CC=C(C)CC2)[nH]1 ZINC000660128320 411542248 /nfs/dbraw/zinc/54/22/48/411542248.db2.gz UOOSUYPKMCWIOQ-JTQLQIEISA-N 1 2 220.320 2.080 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@H]2C[C@]2(F)c2ccccc2)n1 ZINC000657496353 411535520 /nfs/dbraw/zinc/53/55/20/411535520.db2.gz RVOAZZLXMBNMBN-JSGCOSHPSA-N 1 2 245.301 2.445 20 0 BEADLO Cc1cc(C[NH2+][C@@H]2C[C@H](C)n3ncnc32)cs1 ZINC000657568413 411552899 /nfs/dbraw/zinc/55/28/99/411552899.db2.gz GFNIJYQKJBGIGX-GZMMTYOYSA-N 1 2 248.355 2.444 20 0 BEADLO C[C@H]1C[C@H]([NH2+]Cc2cccc(F)c2)c2ncnn21 ZINC000657567094 411553005 /nfs/dbraw/zinc/55/30/05/411553005.db2.gz JEGJOYNMQFLPMQ-CABZTGNLSA-N 1 2 246.289 2.213 20 0 BEADLO Cc1cc(C[NH2+][C@H]2C[C@@H](C)n3ncnc32)cs1 ZINC000657568414 411553317 /nfs/dbraw/zinc/55/33/17/411553317.db2.gz GFNIJYQKJBGIGX-KCJUWKMLSA-N 1 2 248.355 2.444 20 0 BEADLO Cc1nc(C[N@H+](C)CCCC2CCC2)no1 ZINC000660213741 411554771 /nfs/dbraw/zinc/55/47/71/411554771.db2.gz ARFZCTFVYCRWJB-UHFFFAOYSA-N 1 2 223.320 2.390 20 0 BEADLO Cc1nc(C[N@@H+](C)CCCC2CCC2)no1 ZINC000660213741 411554772 /nfs/dbraw/zinc/55/47/72/411554772.db2.gz ARFZCTFVYCRWJB-UHFFFAOYSA-N 1 2 223.320 2.390 20 0 BEADLO Cc1ccc(CN(C)Cc2[nH]cc[nH+]2)c(C)n1 ZINC000660143536 411544632 /nfs/dbraw/zinc/54/46/32/411544632.db2.gz WTWHVHOXWBAICF-UHFFFAOYSA-N 1 2 230.315 2.054 20 0 BEADLO CCc1nc([C@H](C)[NH+]2CCC3(CC3)CC2)n[nH]1 ZINC000660144555 411544754 /nfs/dbraw/zinc/54/47/54/411544754.db2.gz GQHMJMAPVJNDDI-JTQLQIEISA-N 1 2 234.347 2.304 20 0 BEADLO CCc1nnc([C@@H](C)[N@@H+]2CC[C@H](C(F)F)C2)[nH]1 ZINC000660146275 411545753 /nfs/dbraw/zinc/54/57/53/411545753.db2.gz FPXHEKQVMPSPDT-SFYZADRCSA-N 1 2 244.289 2.015 20 0 BEADLO CCc1nnc([C@@H](C)[N@H+]2CC[C@H](C(F)F)C2)[nH]1 ZINC000660146275 411545754 /nfs/dbraw/zinc/54/57/54/411545754.db2.gz FPXHEKQVMPSPDT-SFYZADRCSA-N 1 2 244.289 2.015 20 0 BEADLO CCc1nocc1C[N@@H+]1CCOC[C@]1(C)CC ZINC000660148650 411546175 /nfs/dbraw/zinc/54/61/75/411546175.db2.gz LYVHCTZLRQQAGE-ZDUSSCGKSA-N 1 2 238.331 2.238 20 0 BEADLO CCc1nocc1C[N@H+]1CCOC[C@]1(C)CC ZINC000660148650 411546177 /nfs/dbraw/zinc/54/61/77/411546177.db2.gz LYVHCTZLRQQAGE-ZDUSSCGKSA-N 1 2 238.331 2.238 20 0 BEADLO CCNc1nc(C2CC2)[nH+]c2c1CCC2 ZINC000050847813 170176153 /nfs/dbraw/zinc/17/61/53/170176153.db2.gz MPDJBRWJMPVYHX-UHFFFAOYSA-N 1 2 203.289 2.275 20 0 BEADLO CCOC(=O)CCC[N@H+](CC(F)F)C1CC1 ZINC000106871890 170200605 /nfs/dbraw/zinc/20/06/05/170200605.db2.gz BBMSDVKFGTYZIP-UHFFFAOYSA-N 1 2 235.274 2.059 20 0 BEADLO CCOC(=O)CCC[N@@H+](CC(F)F)C1CC1 ZINC000106871890 170200607 /nfs/dbraw/zinc/20/06/07/170200607.db2.gz BBMSDVKFGTYZIP-UHFFFAOYSA-N 1 2 235.274 2.059 20 0 BEADLO CCOC(=O)CC[N@H+](CC(F)F)CC1CCC1 ZINC000341756018 170205224 /nfs/dbraw/zinc/20/52/24/170205224.db2.gz RPTIRGNBTFOVJY-UHFFFAOYSA-N 1 2 249.301 2.307 20 0 BEADLO CCOC(=O)CC[N@@H+](CC(F)F)CC1CCC1 ZINC000341756018 170205225 /nfs/dbraw/zinc/20/52/25/170205225.db2.gz RPTIRGNBTFOVJY-UHFFFAOYSA-N 1 2 249.301 2.307 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1ccc(Cl)cc1 ZINC000042223907 170214866 /nfs/dbraw/zinc/21/48/66/170214866.db2.gz HEPHXYRFIKTZDV-UHFFFAOYSA-N 1 2 241.718 2.335 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000042223907 170214867 /nfs/dbraw/zinc/21/48/67/170214867.db2.gz HEPHXYRFIKTZDV-UHFFFAOYSA-N 1 2 241.718 2.335 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1ccc(C)c(F)c1 ZINC000128602455 170214989 /nfs/dbraw/zinc/21/49/89/170214989.db2.gz FJHGHAMBHZDVBU-UHFFFAOYSA-N 1 2 239.290 2.129 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1ccc(C)c(F)c1 ZINC000128602455 170214990 /nfs/dbraw/zinc/21/49/90/170214990.db2.gz FJHGHAMBHZDVBU-UHFFFAOYSA-N 1 2 239.290 2.129 20 0 BEADLO CCOC(=O)C[N@H+](CCSC(C)C)C1CC1 ZINC000336668109 170218292 /nfs/dbraw/zinc/21/82/92/170218292.db2.gz QJCHKKGMKWQULI-UHFFFAOYSA-N 1 2 245.388 2.156 20 0 BEADLO CCOC(=O)C[N@@H+](CCSC(C)C)C1CC1 ZINC000336668109 170218294 /nfs/dbraw/zinc/21/82/94/170218294.db2.gz QJCHKKGMKWQULI-UHFFFAOYSA-N 1 2 245.388 2.156 20 0 BEADLO CCOC(=O)C[NH2+][C@H]1CCC[C@@H]1c1ccccc1 ZINC000133497224 170227045 /nfs/dbraw/zinc/22/70/45/170227045.db2.gz LJMKGKDCPHFXQJ-KGLIPLIRSA-N 1 2 247.338 2.475 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+](C)Cc1cccc(F)c1 ZINC000043638511 170247146 /nfs/dbraw/zinc/24/71/46/170247146.db2.gz WLKIILCGKHJHES-SNVBAGLBSA-N 1 2 239.290 2.209 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+](C)Cc1cccc(F)c1 ZINC000043638511 170247147 /nfs/dbraw/zinc/24/71/47/170247147.db2.gz WLKIILCGKHJHES-SNVBAGLBSA-N 1 2 239.290 2.209 20 0 BEADLO CCOC(=O)[C@@H](CC)[N@H+](C)Cc1ccc(C)o1 ZINC000077901423 170250460 /nfs/dbraw/zinc/25/04/60/170250460.db2.gz HCOIHRVXZZDRMO-GFCCVEGCSA-N 1 2 239.315 2.362 20 0 BEADLO CCOC(=O)[C@@H](CC)[N@@H+](C)Cc1ccc(C)o1 ZINC000077901423 170250461 /nfs/dbraw/zinc/25/04/61/170250461.db2.gz HCOIHRVXZZDRMO-GFCCVEGCSA-N 1 2 239.315 2.362 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+](C)Cc1ccsc1 ZINC000043638579 170265868 /nfs/dbraw/zinc/26/58/68/170265868.db2.gz IMJQBKDRSNVRSX-VIFPVBQESA-N 1 2 227.329 2.132 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+](C)Cc1ccsc1 ZINC000043638579 170265869 /nfs/dbraw/zinc/26/58/69/170265869.db2.gz IMJQBKDRSNVRSX-VIFPVBQESA-N 1 2 227.329 2.132 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000362186412 170266248 /nfs/dbraw/zinc/26/62/48/170266248.db2.gz YRMNBKFBHICABT-WCQYABFASA-N 1 2 233.311 2.385 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+]1CC[C@@H]1c1ccccc1 ZINC000362186412 170266250 /nfs/dbraw/zinc/26/62/50/170266250.db2.gz YRMNBKFBHICABT-WCQYABFASA-N 1 2 233.311 2.385 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+]C1CC(c2ccccc2)C1 ZINC000049371731 170267437 /nfs/dbraw/zinc/26/74/37/170267437.db2.gz MOWGZSKZJCJZGY-XGNXJENSSA-N 1 2 247.338 2.474 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+]1Cc2ccc(C)cc2C1 ZINC000361599911 170267620 /nfs/dbraw/zinc/26/76/20/170267620.db2.gz FGWWKHOWIYNKHJ-NSHDSACASA-N 1 2 233.311 2.262 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@@H]1CCC[C@H]1SCC ZINC000300389067 170268614 /nfs/dbraw/zinc/26/86/14/170268614.db2.gz PMIZLZJHJCDLEV-HBNTYKKESA-N 1 2 245.388 2.202 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[NH2+][C@@H]1C[C@H]1CC ZINC000348155952 170270308 /nfs/dbraw/zinc/27/03/08/170270308.db2.gz ZWIHJYOUZVVMLW-UTUOFQBUSA-N 1 2 227.348 2.352 20 0 BEADLO CCOC(=O)[C@H]1CCC[N@@H+]1[C@@H](C)c1ccccn1 ZINC000191176235 170281792 /nfs/dbraw/zinc/28/17/92/170281792.db2.gz YDUPXZDSBGZBEI-WCQYABFASA-N 1 2 248.326 2.170 20 0 BEADLO CCOC(=O)[C@H]1CCC[N@H+]1[C@@H](C)c1ccccn1 ZINC000191176235 170281794 /nfs/dbraw/zinc/28/17/94/170281794.db2.gz YDUPXZDSBGZBEI-WCQYABFASA-N 1 2 248.326 2.170 20 0 BEADLO CCOC1CC(CCNc2cc[nH+]c(C)n2)C1 ZINC000302710666 170323706 /nfs/dbraw/zinc/32/37/06/170323706.db2.gz WXZLPXSGKVTBTK-UHFFFAOYSA-N 1 2 235.331 2.402 20 0 BEADLO CCOC1CC(N(C)c2cc[nH+]c(C3CC3)n2)C1 ZINC000288481334 170327963 /nfs/dbraw/zinc/32/79/63/170327963.db2.gz LGGFVASGTCUSGN-UHFFFAOYSA-N 1 2 247.342 2.358 20 0 BEADLO CCOC1CC([N@H+](C)Cc2cscn2)C1 ZINC000278535600 170328309 /nfs/dbraw/zinc/32/83/09/170328309.db2.gz FQESFLILEGQGEU-UHFFFAOYSA-N 1 2 226.345 2.142 20 0 BEADLO CCOC1CC([N@@H+](C)Cc2cscn2)C1 ZINC000278535600 170328311 /nfs/dbraw/zinc/32/83/11/170328311.db2.gz FQESFLILEGQGEU-UHFFFAOYSA-N 1 2 226.345 2.142 20 0 BEADLO CCOC1C[NH+](Cc2cccc(COC)c2)C1 ZINC000297468107 170336729 /nfs/dbraw/zinc/33/67/29/170336729.db2.gz QVFKFKJRMNXASI-UHFFFAOYSA-N 1 2 235.327 2.054 20 0 BEADLO CCOCC[N@H+](C)Cc1csc(C2CC2)n1 ZINC000093311778 170389844 /nfs/dbraw/zinc/38/98/44/170389844.db2.gz WSUPHUOETIPXRT-UHFFFAOYSA-N 1 2 240.372 2.489 20 0 BEADLO CCOCC[N@@H+](C)Cc1csc(C2CC2)n1 ZINC000093311778 170389846 /nfs/dbraw/zinc/38/98/46/170389846.db2.gz WSUPHUOETIPXRT-UHFFFAOYSA-N 1 2 240.372 2.489 20 0 BEADLO CCC[N@H+](C)[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000660762923 411623259 /nfs/dbraw/zinc/62/32/59/411623259.db2.gz YYCJCSLUWCSVJX-GFCCVEGCSA-N 1 2 230.315 2.236 20 0 BEADLO CCC[N@@H+](C)[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000660762923 411623261 /nfs/dbraw/zinc/62/32/61/411623261.db2.gz YYCJCSLUWCSVJX-GFCCVEGCSA-N 1 2 230.315 2.236 20 0 BEADLO CCOCCN(CC)c1cc[nH+]c2ccncc21 ZINC000267998568 170396036 /nfs/dbraw/zinc/39/60/36/170396036.db2.gz TXHAZPQEJQXWEO-UHFFFAOYSA-N 1 2 245.326 2.493 20 0 BEADLO CCOCCN(CC)c1cc[nH+]c(C(C)C)n1 ZINC000110587066 170396524 /nfs/dbraw/zinc/39/65/24/170396524.db2.gz HKAKZISFEBOLFC-UHFFFAOYSA-N 1 2 237.347 2.463 20 0 BEADLO CCc1cccc(F)c1C[NH2+]Cc1ncccn1 ZINC000657735072 411587618 /nfs/dbraw/zinc/58/76/18/411587618.db2.gz ULDUXYFLTWLYNI-UHFFFAOYSA-N 1 2 245.301 2.468 20 0 BEADLO COCc1ccc(C[NH2+][C@@H](C)c2nccn2C)o1 ZINC000657793222 411598527 /nfs/dbraw/zinc/59/85/27/411598527.db2.gz GYTDHFVSOMUZFI-JTQLQIEISA-N 1 2 249.314 2.010 20 0 BEADLO CC(C)n1cncc1C[NH2+][C@@H](C)c1nccn1C ZINC000657792766 411598531 /nfs/dbraw/zinc/59/85/31/411598531.db2.gz FVYMRKHDMRMEKS-NSHDSACASA-N 1 2 247.346 2.048 20 0 BEADLO Cn1cc(C[NH2+]CC(F)(F)C(C)(C)C)cn1 ZINC000657794419 411599899 /nfs/dbraw/zinc/59/98/99/411599899.db2.gz VUELFTLGHXGLDE-UHFFFAOYSA-N 1 2 231.290 2.191 20 0 BEADLO Cc1nc(C[NH2+][C@H]2CCc3c2cccc3O)co1 ZINC000660649990 411613658 /nfs/dbraw/zinc/61/36/58/411613658.db2.gz OTWMPUMTLPNYLU-ZDUSSCGKSA-N 1 2 244.294 2.466 20 0 BEADLO CCn1cc([C@H](C)[NH2+]Cc2coc(C)n2)cn1 ZINC000660738380 411620402 /nfs/dbraw/zinc/62/04/02/411620402.db2.gz BMVCLGRNNJJTOF-VIFPVBQESA-N 1 2 234.303 2.050 20 0 BEADLO CN(c1[nH+]ccc2c(N)cccc21)[C@@H]1CCOC1 ZINC000663572029 411703651 /nfs/dbraw/zinc/70/36/51/411703651.db2.gz SNNWOPSPPVWDOM-SNVBAGLBSA-N 1 2 243.310 2.042 20 0 BEADLO C[C@H]1CCC[C@H](C[N@H+](C)Cc2n[nH]c(=O)o2)C1 ZINC000660843633 411653872 /nfs/dbraw/zinc/65/38/72/411653872.db2.gz BKKPLWCESVVJKC-UWVGGRQHSA-N 1 2 239.319 2.033 20 0 BEADLO C[C@H]1CCC[C@H](C[N@@H+](C)Cc2n[nH]c(=O)o2)C1 ZINC000660843633 411653877 /nfs/dbraw/zinc/65/38/77/411653877.db2.gz BKKPLWCESVVJKC-UWVGGRQHSA-N 1 2 239.319 2.033 20 0 BEADLO C[C@H]1CCCC[C@H]1C[N@H+](C)Cc1n[nH]c(=O)o1 ZINC000660844602 411655789 /nfs/dbraw/zinc/65/57/89/411655789.db2.gz QNSKJTCRSMFRKA-UWVGGRQHSA-N 1 2 239.319 2.033 20 0 BEADLO C[C@H]1CCCC[C@H]1C[N@@H+](C)Cc1n[nH]c(=O)o1 ZINC000660844602 411655794 /nfs/dbraw/zinc/65/57/94/411655794.db2.gz QNSKJTCRSMFRKA-UWVGGRQHSA-N 1 2 239.319 2.033 20 0 BEADLO CCCC[C@@H](CC)C[N@H+](C)Cc1n[nH]c(=O)o1 ZINC000660845199 411657746 /nfs/dbraw/zinc/65/77/46/411657746.db2.gz KTTSYBMCBKHPHA-SNVBAGLBSA-N 1 2 241.335 2.423 20 0 BEADLO CCCC[C@@H](CC)C[N@@H+](C)Cc1n[nH]c(=O)o1 ZINC000660845199 411657753 /nfs/dbraw/zinc/65/77/53/411657753.db2.gz KTTSYBMCBKHPHA-SNVBAGLBSA-N 1 2 241.335 2.423 20 0 BEADLO Cc1cccc(C)c1C[N@H+](C)Cc1n[nH]c(=O)o1 ZINC000660847917 411658334 /nfs/dbraw/zinc/65/83/34/411658334.db2.gz FGSYJGNHNCTHOU-UHFFFAOYSA-N 1 2 247.298 2.024 20 0 BEADLO Cc1cccc(C)c1C[N@@H+](C)Cc1n[nH]c(=O)o1 ZINC000660847917 411658341 /nfs/dbraw/zinc/65/83/41/411658341.db2.gz FGSYJGNHNCTHOU-UHFFFAOYSA-N 1 2 247.298 2.024 20 0 BEADLO FC(F)[C@@H]1CCC[N@@H+]1CCc1cncs1 ZINC000663471471 411667919 /nfs/dbraw/zinc/66/79/19/411667919.db2.gz NRURHBMOKLCEND-VIFPVBQESA-N 1 2 232.299 2.415 20 0 BEADLO FC(F)[C@@H]1CCC[N@H+]1CCc1cncs1 ZINC000663471471 411667921 /nfs/dbraw/zinc/66/79/21/411667921.db2.gz NRURHBMOKLCEND-VIFPVBQESA-N 1 2 232.299 2.415 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)[nH]1 ZINC000660934330 411684979 /nfs/dbraw/zinc/68/49/79/411684979.db2.gz PTFRDKYYOGRYBW-QWRGUYRKSA-N 1 2 234.347 2.303 20 0 BEADLO CC(C)c1nnc(C[N@H+]2C[C@@H]3CCCC[C@@H]32)[nH]1 ZINC000660934330 411684983 /nfs/dbraw/zinc/68/49/83/411684983.db2.gz PTFRDKYYOGRYBW-QWRGUYRKSA-N 1 2 234.347 2.303 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](Cc1cnns1)CC2 ZINC000661371965 411756162 /nfs/dbraw/zinc/75/61/62/411756162.db2.gz UUXNZCPISOQMJP-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](Cc1cnns1)CC2 ZINC000661371965 411756164 /nfs/dbraw/zinc/75/61/64/411756164.db2.gz UUXNZCPISOQMJP-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO CCc1nnc(C[NH+]2CCC(C3CCC3)CC2)[nH]1 ZINC000661375390 411758166 /nfs/dbraw/zinc/75/81/66/411758166.db2.gz ZEDFOJNMKXPIMO-UHFFFAOYSA-N 1 2 248.374 2.379 20 0 BEADLO Nc1cccc2c1cc[nH+]c2N1CC[C@H](F)C1 ZINC000663964105 411792780 /nfs/dbraw/zinc/79/27/80/411792780.db2.gz OZADNUKMYHUSFJ-VIFPVBQESA-N 1 2 231.274 2.365 20 0 BEADLO CC(C)(C)CC[N@@H+]1CC[C@H](O)C(F)(F)C1 ZINC000661396358 411767940 /nfs/dbraw/zinc/76/79/40/411767940.db2.gz ADHXKLLEYZWNJX-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)(C)CC[N@H+]1CC[C@H](O)C(F)(F)C1 ZINC000661396358 411767945 /nfs/dbraw/zinc/76/79/45/411767945.db2.gz ADHXKLLEYZWNJX-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO CC(C)C[C@@H](C)[N@@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000661411772 411770959 /nfs/dbraw/zinc/77/09/59/411770959.db2.gz AQEYFLDBTRYJGF-NXEZZACHSA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)C[C@@H](C)[N@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000661411772 411770962 /nfs/dbraw/zinc/77/09/62/411770962.db2.gz AQEYFLDBTRYJGF-NXEZZACHSA-N 1 2 221.291 2.123 20 0 BEADLO FC(F)[C@@H]1CCN1c1cc[nH+]c(C2CC2)n1 ZINC000663946959 411785866 /nfs/dbraw/zinc/78/58/66/411785866.db2.gz XZOXIPFVJJFNTR-QMMMGPOBSA-N 1 2 225.242 2.198 20 0 BEADLO C[C@@H]1[C@@H](C)CN1c1cc[nH+]c(C2CC2)n1 ZINC000663946694 411786040 /nfs/dbraw/zinc/78/60/40/411786040.db2.gz LNKQVORRGQQBQR-DTWKUNHWSA-N 1 2 203.289 2.199 20 0 BEADLO Cc1cnc(N[C@H]2C[C@H](C)n3cc[nH+]c32)nc1 ZINC000663973015 411796683 /nfs/dbraw/zinc/79/66/83/411796683.db2.gz DGUPEMNKGZZGQB-UWVGGRQHSA-N 1 2 229.287 2.099 20 0 BEADLO COc1cccc(C[NH+]2C[C@@H](C)C(=O)[C@H](C)C2)c1 ZINC000661545849 411799639 /nfs/dbraw/zinc/79/96/39/411799639.db2.gz HFVCXAMGIHUBEK-VXGBXAGGSA-N 1 2 247.338 2.352 20 0 BEADLO C[C@@H]1C[NH+](Cc2ccccc2F)C[C@@H](C)C1=O ZINC000661551946 411801093 /nfs/dbraw/zinc/80/10/93/411801093.db2.gz WHBKRQBIDCRUBG-GHMZBOCLSA-N 1 2 235.302 2.483 20 0 BEADLO CCC(CC)Cn1ncc2c1nc[nH+]c2NC ZINC000664000113 411808470 /nfs/dbraw/zinc/80/84/70/411808470.db2.gz QDTKBQVMEBOZHG-UHFFFAOYSA-N 1 2 233.319 2.304 20 0 BEADLO Cc1[nH+]c2cc(OCCC(C)(C)O)ccc2n1C ZINC000664046721 411827423 /nfs/dbraw/zinc/82/74/23/411827423.db2.gz NNDSHPGOEPARPL-UHFFFAOYSA-N 1 2 248.326 2.422 20 0 BEADLO CCOCCOc1ccc2c(c1)[nH+]c(C)n2C ZINC000664046719 411827568 /nfs/dbraw/zinc/82/75/68/411827568.db2.gz NLQBXQNCIJARLR-UHFFFAOYSA-N 1 2 234.299 2.297 20 0 BEADLO Cc1cc[nH+]c(NC/C=C/CO)c1Cl ZINC000664235026 411891913 /nfs/dbraw/zinc/89/19/13/411891913.db2.gz FRQQKGFPVNSNGA-NSCUHMNNSA-N 1 2 212.680 2.004 20 0 BEADLO Cc1nc(N[C@@H](C)c2cscn2)cc[nH+]1 ZINC000664264847 411904462 /nfs/dbraw/zinc/90/44/62/411904462.db2.gz PJGUDJMKGZODFC-ZETCQYMHSA-N 1 2 220.301 2.415 20 0 BEADLO C[C@@H]1CN(c2[nH]c3ccccc3[nH+]2)C[C@H](C)[C@H]1O ZINC000664350215 411927205 /nfs/dbraw/zinc/92/72/05/411927205.db2.gz HGBUHCFRWOLBCA-IWIIMEHWSA-N 1 2 245.326 2.016 20 0 BEADLO C[C@H]1CN(c2[nH]c3ccccc3[nH+]2)C[C@H](C)C1O ZINC000664350219 411927924 /nfs/dbraw/zinc/92/79/24/411927924.db2.gz HGBUHCFRWOLBCA-UWVGGRQHSA-N 1 2 245.326 2.016 20 0 BEADLO C[C@@H]1CCC[C@@H](CNc2cccc[nH+]2)O1 ZINC000664392841 411939191 /nfs/dbraw/zinc/93/91/91/411939191.db2.gz LDSANZMAKLZKNE-MNOVXSKESA-N 1 2 206.289 2.451 20 0 BEADLO Cc1cc(NCc2c(C3CC3)cnn2C)nc[nH+]1 ZINC000664389756 411939623 /nfs/dbraw/zinc/93/96/23/411939623.db2.gz SVXSHEPTELMJDK-UHFFFAOYSA-N 1 2 243.314 2.008 20 0 BEADLO Cc1cnc(C[NH+]2CCC(c3ccon3)CC2)o1 ZINC000662047512 411965141 /nfs/dbraw/zinc/96/51/41/411965141.db2.gz LABYBBGSDIEUCP-UHFFFAOYSA-N 1 2 247.298 2.351 20 0 BEADLO CCc1nc(C[NH2+]C2(CC(C)C)CC2)no1 ZINC000662071079 411971375 /nfs/dbraw/zinc/97/13/75/411971375.db2.gz QIYGQVOSHCEPRS-UHFFFAOYSA-N 1 2 223.320 2.300 20 0 BEADLO CC(C)[C@@H](Nc1nc[nH+]c2c1OCCN2)C1CC1 ZINC000664545299 411981529 /nfs/dbraw/zinc/98/15/29/411981529.db2.gz GDZZJCCIOVPXJW-SNVBAGLBSA-N 1 2 248.330 2.127 20 0 BEADLO CC(C)[C@@H](Nc1[nH+]cnc2c1OCCN2)C1CC1 ZINC000664545299 411981535 /nfs/dbraw/zinc/98/15/35/411981535.db2.gz GDZZJCCIOVPXJW-SNVBAGLBSA-N 1 2 248.330 2.127 20 0 BEADLO CC[C@@H](NC(=O)c1cccs1)c1[nH]cc[nH+]1 ZINC000125327820 170885957 /nfs/dbraw/zinc/88/59/57/170885957.db2.gz OAPKKZSNECOPES-MRVPVSSYSA-N 1 2 235.312 2.352 20 0 BEADLO c1ccc2[nH+]c(N3CC[C@H]4COC[C@H]4C3)[nH]c2c1 ZINC000664557151 411986293 /nfs/dbraw/zinc/98/62/93/411986293.db2.gz PSSFLDSHCHSRIU-WDEREUQCSA-N 1 2 243.310 2.036 20 0 BEADLO CC[C@@H]([NH2+]Cc1cc(C)cs1)C(=O)OC ZINC000344620625 170901518 /nfs/dbraw/zinc/90/15/18/170901518.db2.gz KEHDKXDPNVVDKJ-SNVBAGLBSA-N 1 2 227.329 2.098 20 0 BEADLO FC(F)(F)C[C@@H]1CN(c2cccc[nH+]2)CCO1 ZINC000664638855 412001883 /nfs/dbraw/zinc/00/18/83/412001883.db2.gz KSHXWOGHPXFXMC-SECBINFHSA-N 1 2 246.232 2.239 20 0 BEADLO CN(C[C@@H]1CC1(C)C)c1nc[nH+]c(N)c1Cl ZINC000664669429 412006573 /nfs/dbraw/zinc/00/65/73/412006573.db2.gz ADYHNNHJDIZNPI-ZETCQYMHSA-N 1 2 240.738 2.195 20 0 BEADLO CN(C[C@@H]1CC1(C)C)c1[nH+]cnc(N)c1Cl ZINC000664669429 412006576 /nfs/dbraw/zinc/00/65/76/412006576.db2.gz ADYHNNHJDIZNPI-ZETCQYMHSA-N 1 2 240.738 2.195 20 0 BEADLO Cc1cc(N[C@H](c2ccccc2)[C@@H](C)O)nc[nH+]1 ZINC000664653742 412007074 /nfs/dbraw/zinc/00/70/74/412007074.db2.gz CAGHESHDQKFRLE-RISCZKNCSA-N 1 2 243.310 2.319 20 0 BEADLO Cc1nc(N(C)C[C@H]2CC2(C)C)cc[nH+]1 ZINC000664670722 412008004 /nfs/dbraw/zinc/00/80/04/412008004.db2.gz XGDFRIXSRJWMGI-SNVBAGLBSA-N 1 2 205.305 2.267 20 0 BEADLO CCn1nccc1CNc1cc[nH+]c(C2CC2)n1 ZINC000664680717 412009432 /nfs/dbraw/zinc/00/94/32/412009432.db2.gz NKNHELZXBFZYDT-UHFFFAOYSA-N 1 2 243.314 2.183 20 0 BEADLO CCc1nc(N2CC3CC2(C)C3)cc(C)[nH+]1 ZINC000664694624 412012286 /nfs/dbraw/zinc/01/22/86/412012286.db2.gz GZDLXWWYSFWHSY-UHFFFAOYSA-N 1 2 217.316 2.336 20 0 BEADLO C[C@@H]1CCC(C)(C)N1C(=O)CCn1cc[nH+]c1 ZINC000662032742 411950569 /nfs/dbraw/zinc/95/05/69/411950569.db2.gz KNLNAOADEVVWHX-LLVKDONJSA-N 1 2 235.331 2.063 20 0 BEADLO C[C@]12COC[C@@H]1CN(c1[nH]c3ccccc3[nH+]1)C2 ZINC000664421414 411951256 /nfs/dbraw/zinc/95/12/56/411951256.db2.gz JZSFKMUBFVYWGO-HZMBPMFUSA-N 1 2 243.310 2.036 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@@H](C3CCC3)C2)no1 ZINC000662039154 411955712 /nfs/dbraw/zinc/95/57/12/411955712.db2.gz OYEXWEQCOMRXLN-GFCCVEGCSA-N 1 2 235.331 2.390 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@@H](C3CCC3)C2)no1 ZINC000662039154 411955725 /nfs/dbraw/zinc/95/57/25/411955725.db2.gz OYEXWEQCOMRXLN-GFCCVEGCSA-N 1 2 235.331 2.390 20 0 BEADLO Cn1c[nH+]cc1Cc1noc([C@@H]2CCC2(C)C)n1 ZINC000664824944 412027820 /nfs/dbraw/zinc/02/78/20/412027820.db2.gz QBSUUNCJIUMGCH-JTQLQIEISA-N 1 2 246.314 2.298 20 0 BEADLO Cc1cc[nH+]cc1Cc1nc(C2(C)CC2)no1 ZINC000664899948 412041641 /nfs/dbraw/zinc/04/16/41/412041641.db2.gz RJMZZARUIGTXMI-UHFFFAOYSA-N 1 2 229.283 2.415 20 0 BEADLO CC[C@@H](OC)c1nc(Cc2c[nH+]ccc2C)no1 ZINC000664982335 412055114 /nfs/dbraw/zinc/05/51/14/412055114.db2.gz SQSJCZPPXXFLQZ-LLVKDONJSA-N 1 2 247.298 2.461 20 0 BEADLO Cc1cc[nH+]cc1Cc1noc([C@@H]2C[C@H]2C)n1 ZINC000664981581 412055284 /nfs/dbraw/zinc/05/52/84/412055284.db2.gz XJARBDXFRTZYAH-MWLCHTKSSA-N 1 2 229.283 2.487 20 0 BEADLO CC[C@@H]1CC[N@@H+]1Cc1c(Cl)cnn1C ZINC000292720243 171024237 /nfs/dbraw/zinc/02/42/37/171024237.db2.gz FEMDIHMPTJKHDS-MRVPVSSYSA-N 1 2 213.712 2.058 20 0 BEADLO CC[C@@H]1CC[N@H+]1Cc1c(Cl)cnn1C ZINC000292720243 171024238 /nfs/dbraw/zinc/02/42/38/171024238.db2.gz FEMDIHMPTJKHDS-MRVPVSSYSA-N 1 2 213.712 2.058 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1C(=O)CCc1c[nH+]cn1C ZINC000281283323 171035040 /nfs/dbraw/zinc/03/50/40/171035040.db2.gz SEAURSCXSRDNSU-VXGBXAGGSA-N 1 2 249.358 2.142 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1C(=O)CCc1[nH]cc[nH+]1 ZINC000288608801 171035255 /nfs/dbraw/zinc/03/52/55/171035255.db2.gz UUWFSOFVRJXZJM-GHMZBOCLSA-N 1 2 235.331 2.132 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000284525043 171049649 /nfs/dbraw/zinc/04/96/49/171049649.db2.gz WKPQUNGEZAIZJE-LCMYJQKYSA-N 1 2 233.315 2.212 20 0 BEADLO CC[C@@H]1C[C@H](C)CN1C(=O)Nc1cc[nH+]c(C)c1 ZINC000336528571 171126997 /nfs/dbraw/zinc/12/69/97/171126997.db2.gz VWUHWJMDMSLJIX-GXFFZTMASA-N 1 2 247.342 2.464 20 0 BEADLO CC[C@@](C)(CO)Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000301539648 171170599 /nfs/dbraw/zinc/17/05/99/171170599.db2.gz MYRDFZFOVMBMEE-ZDUSSCGKSA-N 1 2 237.347 2.347 20 0 BEADLO CC[C@@](C)(O)CNc1cc[nH+]c2ccncc12 ZINC000267980419 171185544 /nfs/dbraw/zinc/18/55/44/171185544.db2.gz OYDCGKTVTBEMNM-CYBMUJFWSA-N 1 2 231.299 2.203 20 0 BEADLO CC[C@@]1(C)COCC[N@@H+]1Cc1nccs1 ZINC000335183438 171205955 /nfs/dbraw/zinc/20/59/55/171205955.db2.gz UCQXTZPPENIVAJ-NSHDSACASA-N 1 2 226.345 2.144 20 0 BEADLO CC[C@@]1(C)COCC[N@H+]1Cc1nccs1 ZINC000335183438 171205957 /nfs/dbraw/zinc/20/59/57/171205957.db2.gz UCQXTZPPENIVAJ-NSHDSACASA-N 1 2 226.345 2.144 20 0 BEADLO CC[C@@]1(C)COCC[N@@H+]1Cc1ncc(C)s1 ZINC000336519123 171206791 /nfs/dbraw/zinc/20/67/91/171206791.db2.gz SDNFWNLLZYQCID-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO CC[C@@]1(C)COCC[N@H+]1Cc1ncc(C)s1 ZINC000336519123 171206794 /nfs/dbraw/zinc/20/67/94/171206794.db2.gz SDNFWNLLZYQCID-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO CC[C@@]1(C)C[C@H]1c1nc(Cc2c[nH+]cn2C)no1 ZINC000357930293 171207932 /nfs/dbraw/zinc/20/79/32/171207932.db2.gz FOQMCQDCGDSXPA-GWCFXTLKSA-N 1 2 246.314 2.298 20 0 BEADLO CCc1cc(N[C@H]2C[C@@H](OC)C23CCC3)nc[nH+]1 ZINC000665738162 487621884 /nfs/dbraw/zinc/62/18/84/487621884.db2.gz KWEUSBDETMAPND-NWDGAFQWSA-N 1 2 247.342 2.409 20 0 BEADLO CC[C@H](C)CN(C)C(=O)c1ccc2[nH+]ccn2c1 ZINC000171875313 171271487 /nfs/dbraw/zinc/27/14/87/171271487.db2.gz HKPMIBOUEDFMJJ-NSHDSACASA-N 1 2 245.326 2.452 20 0 BEADLO CC[C@H](C)C[NH2+][C@H](CC(F)(F)F)C(=O)OC ZINC000336749307 171286908 /nfs/dbraw/zinc/28/69/08/171286908.db2.gz YSBDUXWMGFYGAX-JGVFFNPUSA-N 1 2 241.253 2.116 20 0 BEADLO CC[C@H](C)C[NH2+][C@@H](CC(F)(F)F)C(=O)OC ZINC000336749309 171287344 /nfs/dbraw/zinc/28/73/44/171287344.db2.gz YSBDUXWMGFYGAX-YUMQZZPRSA-N 1 2 241.253 2.116 20 0 BEADLO CC[C@H](C)C[C@H](C)NC(=O)CCc1[nH]cc[nH+]1 ZINC000288621608 171296522 /nfs/dbraw/zinc/29/65/22/171296522.db2.gz DKUXMVVDRRJYMJ-QWRGUYRKSA-N 1 2 237.347 2.283 20 0 BEADLO CC[C@H](C)NC(=O)C[N@@H+]1Cc2ccccc2[C@H]1C ZINC000361072925 171326675 /nfs/dbraw/zinc/32/66/75/171326675.db2.gz HWTBRJPINPYEKX-NWDGAFQWSA-N 1 2 246.354 2.478 20 0 BEADLO CC[C@H](C)NC(=O)C[N@H+]1Cc2ccccc2[C@H]1C ZINC000361072925 171326676 /nfs/dbraw/zinc/32/66/76/171326676.db2.gz HWTBRJPINPYEKX-NWDGAFQWSA-N 1 2 246.354 2.478 20 0 BEADLO CC[C@H](C)[NH2+][C@@H](Cc1ccccc1)C(=O)OC ZINC000038066893 171345764 /nfs/dbraw/zinc/34/57/64/171345764.db2.gz YRSMFCKMTZFEFW-AAEUAGOBSA-N 1 2 235.327 2.159 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)c1ccc2[nH+]ccn2c1 ZINC000171160223 171364078 /nfs/dbraw/zinc/36/40/78/171364078.db2.gz XHKLBVIGGNFQGR-WDEREUQCSA-N 1 2 245.326 2.499 20 0 BEADLO CCc1cc(N[C@H]2C[C@H](OC)C23CCC3)nc[nH+]1 ZINC000665738163 487622033 /nfs/dbraw/zinc/62/20/33/487622033.db2.gz KWEUSBDETMAPND-RYUDHWBXSA-N 1 2 247.342 2.409 20 0 BEADLO CC[C@H](C)[C@@H]([NH2+]Cc1cccs1)C(=O)OC ZINC000035036744 171374460 /nfs/dbraw/zinc/37/44/60/171374460.db2.gz CDJAKAAQQBSCCG-GXSJLCMTSA-N 1 2 241.356 2.425 20 0 BEADLO C[C@@]1(C(F)F)C[N@H+](CCC(F)(F)F)CCO1 ZINC000662369824 412128037 /nfs/dbraw/zinc/12/80/37/412128037.db2.gz XDOBZNYKRMZSHG-QMMMGPOBSA-N 1 2 247.207 2.295 20 0 BEADLO C[C@@]1(C(F)F)C[N@@H+](CCC(F)(F)F)CCO1 ZINC000662369824 412128041 /nfs/dbraw/zinc/12/80/41/412128041.db2.gz XDOBZNYKRMZSHG-QMMMGPOBSA-N 1 2 247.207 2.295 20 0 BEADLO CCC(=O)CCC[N@@H+]1CCO[C@@](C)(C(F)F)C1 ZINC000662369285 412128074 /nfs/dbraw/zinc/12/80/74/412128074.db2.gz OOVKKAPRBHNIOP-GFCCVEGCSA-N 1 2 249.301 2.102 20 0 BEADLO CCC(=O)CCC[N@H+]1CCO[C@@](C)(C(F)F)C1 ZINC000662369285 412128076 /nfs/dbraw/zinc/12/80/76/412128076.db2.gz OOVKKAPRBHNIOP-GFCCVEGCSA-N 1 2 249.301 2.102 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]Cc1cccc(N)c1 ZINC000665234110 412171430 /nfs/dbraw/zinc/17/14/30/412171430.db2.gz XKVIAXNURFDHPU-SECBINFHSA-N 1 2 230.315 2.151 20 0 BEADLO C1=CCC(C[NH2+]c2ccc(-n3cnnn3)cc2)C1 ZINC000663274822 412405304 /nfs/dbraw/zinc/40/53/04/412405304.db2.gz PROIBFPIDXYJPZ-UHFFFAOYSA-N 1 2 241.298 2.040 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)cc1 ZINC000368636557 171799165 /nfs/dbraw/zinc/79/91/65/171799165.db2.gz VONLUEDCQSUWDI-UONOGXRCSA-N 1 2 217.312 2.222 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@@H]3C[C@@H]32)cc1 ZINC000368636557 171799166 /nfs/dbraw/zinc/79/91/66/171799166.db2.gz VONLUEDCQSUWDI-UONOGXRCSA-N 1 2 217.312 2.222 20 0 BEADLO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2ccccn2)[nH]1 ZINC000271569080 172003169 /nfs/dbraw/zinc/00/31/69/172003169.db2.gz VKJMHXXUZNENTF-NXEZZACHSA-N 1 2 245.330 2.174 20 0 BEADLO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2cccnc2)[nH]1 ZINC000271492992 172007242 /nfs/dbraw/zinc/00/72/42/172007242.db2.gz LFBGOTWKUZQWRV-UWVGGRQHSA-N 1 2 245.330 2.174 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@H](C)OC[C@H]2C)s1 ZINC000271068183 172016972 /nfs/dbraw/zinc/01/69/72/172016972.db2.gz KRGNJZNZHBRNAR-ZJUUUORDSA-N 1 2 240.372 2.315 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@H](C)OC[C@H]2C)s1 ZINC000271068183 172016974 /nfs/dbraw/zinc/01/69/74/172016974.db2.gz KRGNJZNZHBRNAR-ZJUUUORDSA-N 1 2 240.372 2.315 20 0 BEADLO CCc1ncc(CNc2ccc(CO)c[nH+]2)s1 ZINC000291700820 172020313 /nfs/dbraw/zinc/02/03/13/172020313.db2.gz YYJCNRRYHDSUDC-UHFFFAOYSA-N 1 2 249.339 2.205 20 0 BEADLO CCc1nn(C)c(Cl)c1C[N@H+](C)C1CC1 ZINC000153754116 172038085 /nfs/dbraw/zinc/03/80/85/172038085.db2.gz OZXXJAFCAFXTER-UHFFFAOYSA-N 1 2 227.739 2.230 20 0 BEADLO CCc1nn(C)c(Cl)c1C[N@@H+](C)C1CC1 ZINC000153754116 172038086 /nfs/dbraw/zinc/03/80/86/172038086.db2.gz OZXXJAFCAFXTER-UHFFFAOYSA-N 1 2 227.739 2.230 20 0 BEADLO CCc1nn(C)cc1N[C@H](CC)c1[nH+]ccn1C ZINC000272083650 172044581 /nfs/dbraw/zinc/04/45/81/172044581.db2.gz WPYAYGWIADBFQK-LLVKDONJSA-N 1 2 247.346 2.279 20 0 BEADLO CCc1nocc1C[N@@H+](C)C/C=C/Cl ZINC000293546393 172093132 /nfs/dbraw/zinc/09/31/32/172093132.db2.gz YNXJZYUQKAYGHS-SNAWJCMRSA-N 1 2 214.696 2.421 20 0 BEADLO CCc1noc(C)c1C[N@@H+]1CC[C@@H](F)C1 ZINC000334811522 172076791 /nfs/dbraw/zinc/07/67/91/172076791.db2.gz NBDAHAYTPQLXPT-SECBINFHSA-N 1 2 212.268 2.089 20 0 BEADLO CCc1noc(C)c1C[N@H+]1CC[C@@H](F)C1 ZINC000334811522 172076794 /nfs/dbraw/zinc/07/67/94/172076794.db2.gz NBDAHAYTPQLXPT-SECBINFHSA-N 1 2 212.268 2.089 20 0 BEADLO CCc1nocc1C[N@H+](C)C/C=C/Cl ZINC000293546393 172093130 /nfs/dbraw/zinc/09/31/30/172093130.db2.gz YNXJZYUQKAYGHS-SNAWJCMRSA-N 1 2 214.696 2.421 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1c(C)noc1C ZINC000293302180 172095051 /nfs/dbraw/zinc/09/50/51/172095051.db2.gz DWBCUTQYDBROHZ-UHFFFAOYSA-N 1 2 249.314 2.474 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1c(C)noc1C ZINC000293302180 172095055 /nfs/dbraw/zinc/09/50/55/172095055.db2.gz DWBCUTQYDBROHZ-UHFFFAOYSA-N 1 2 249.314 2.474 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1cncs1 ZINC000293732929 172095531 /nfs/dbraw/zinc/09/55/31/172095531.db2.gz UZYNWZHQDWKRTQ-UHFFFAOYSA-N 1 2 237.328 2.326 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1cncs1 ZINC000293732929 172095533 /nfs/dbraw/zinc/09/55/33/172095533.db2.gz UZYNWZHQDWKRTQ-UHFFFAOYSA-N 1 2 237.328 2.326 20 0 BEADLO CCc1nocc1C[N@@H+]1CCO[C@H](C(C)C)C1 ZINC000352816376 172097420 /nfs/dbraw/zinc/09/74/20/172097420.db2.gz OZCPAZOGKLJZEF-ZDUSSCGKSA-N 1 2 238.331 2.094 20 0 BEADLO CCc1nocc1C[N@H+]1CCO[C@H](C(C)C)C1 ZINC000352816376 172097423 /nfs/dbraw/zinc/09/74/23/172097423.db2.gz OZCPAZOGKLJZEF-ZDUSSCGKSA-N 1 2 238.331 2.094 20 0 BEADLO CCc1nsc(NCCc2cc[nH+]cc2C)n1 ZINC000270010992 172105950 /nfs/dbraw/zinc/10/59/50/172105950.db2.gz UNTWKTOJSUTZAA-UHFFFAOYSA-N 1 2 248.355 2.459 20 0 BEADLO CCn1cc(CC[N@H+](CC(F)F)C(C)C)cn1 ZINC000285035446 172158762 /nfs/dbraw/zinc/15/87/62/172158762.db2.gz NGXWBTJOTLJNML-UHFFFAOYSA-N 1 2 245.317 2.421 20 0 BEADLO CCn1cc(CC[N@@H+](CC(F)F)C(C)C)cn1 ZINC000285035446 172158763 /nfs/dbraw/zinc/15/87/63/172158763.db2.gz NGXWBTJOTLJNML-UHFFFAOYSA-N 1 2 245.317 2.421 20 0 BEADLO CCn1cc(CC[N@@H+]2CCC[C@@H]2C(F)F)cn1 ZINC000353167208 172159261 /nfs/dbraw/zinc/15/92/61/172159261.db2.gz ABHNRJZVNCMWQC-LLVKDONJSA-N 1 2 243.301 2.175 20 0 BEADLO CCn1cc(CC[N@H+]2CCC[C@@H]2C(F)F)cn1 ZINC000353167208 172159263 /nfs/dbraw/zinc/15/92/63/172159263.db2.gz ABHNRJZVNCMWQC-LLVKDONJSA-N 1 2 243.301 2.175 20 0 BEADLO CCn1cc(C[NH2+][C@@H](C)c2nccs2)cn1 ZINC000070650900 172173280 /nfs/dbraw/zinc/17/32/80/172173280.db2.gz DDRNTAJRHCBFKT-VIFPVBQESA-N 1 2 236.344 2.210 20 0 BEADLO CCn1cc(C[NH2+][C@H](C)c2cscn2)cn1 ZINC000129689396 172173960 /nfs/dbraw/zinc/17/39/60/172173960.db2.gz IKUKEILQCOPZPS-SECBINFHSA-N 1 2 236.344 2.210 20 0 BEADLO CCn1cc(Nc2cc(C)[nH+]c(C)n2)cn1 ZINC000037756819 172188330 /nfs/dbraw/zinc/18/83/30/172188330.db2.gz PSYDXYFHHQRIBQ-UHFFFAOYSA-N 1 2 217.276 2.053 20 0 BEADLO CCn1cc[nH+]c1CN(C)Cc1cnccc1C ZINC000355577876 172217601 /nfs/dbraw/zinc/21/76/01/172217601.db2.gz CBPAVRIMCYWDEL-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)c1oc(C)cc1C ZINC000295831022 172222440 /nfs/dbraw/zinc/22/24/40/172222440.db2.gz UZTDIRTWZJBZMO-UHFFFAOYSA-N 1 2 247.298 2.043 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@@H]1C[C@]1(C)C(C)C ZINC000295597773 172222877 /nfs/dbraw/zinc/22/28/77/172222877.db2.gz IFWQNUWJRXIQIY-SMDDNHRTSA-N 1 2 249.358 2.201 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)CC1=CCCCC1 ZINC000295903761 172223219 /nfs/dbraw/zinc/22/32/19/172223219.db2.gz ZXDNFHQXUCCGTN-UHFFFAOYSA-N 1 2 247.342 2.410 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)Nc1c(C)nn(C)c1C ZINC000297018788 172229182 /nfs/dbraw/zinc/22/91/82/172229182.db2.gz UFUVOBBLIFNDHA-JTQLQIEISA-N 1 2 247.346 2.426 20 0 BEADLO CCCCC[C@H]([NH2+][C@@H](CC)COC)C(=O)OC ZINC001652223459 1173048491 /nfs/dbraw/zinc/04/84/91/1173048491.db2.gz JPCDABDRAFKNCE-RYUDHWBXSA-N 1 2 245.363 2.123 20 0 BEADLO CCn1ncc2ccc(NCc3[nH]cc[nH+]3)cc21 ZINC000123401765 172257071 /nfs/dbraw/zinc/25/70/71/172257071.db2.gz LOEGOLYWLHGSNY-UHFFFAOYSA-N 1 2 241.298 2.391 20 0 BEADLO CCn1nccc1C[N@H+](C)Cc1ncccc1C ZINC000352339866 172263564 /nfs/dbraw/zinc/26/35/64/172263564.db2.gz BGIIVKUXWSOSCN-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1nccc1C[N@@H+](C)Cc1ncccc1C ZINC000352339866 172263567 /nfs/dbraw/zinc/26/35/67/172263567.db2.gz BGIIVKUXWSOSCN-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1nccc1C[N@H+](C)Cc1ccoc1C ZINC000179589721 172264156 /nfs/dbraw/zinc/26/41/56/172264156.db2.gz GVZGRLSNWOVZTO-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CCn1nccc1C[N@@H+](C)Cc1ccoc1C ZINC000179589721 172264159 /nfs/dbraw/zinc/26/41/59/172264159.db2.gz GVZGRLSNWOVZTO-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CN(C(=O)CCc1c[nH+]cn1C)C1CCCCC1 ZINC000276443482 172306448 /nfs/dbraw/zinc/30/64/48/172306448.db2.gz ABZTVFNMSUPQEB-UHFFFAOYSA-N 1 2 249.358 2.144 20 0 BEADLO CN(C(=O)COc1cc[nH+]cc1)c1ccccc1 ZINC000356090102 172312634 /nfs/dbraw/zinc/31/26/34/172312634.db2.gz GZXIQOKIJGWPPC-UHFFFAOYSA-N 1 2 242.278 2.123 20 0 BEADLO CNc1cc(CNc2ncc(Cl)cn2)cc[nH+]1 ZINC001652255591 1173050356 /nfs/dbraw/zinc/05/03/56/1173050356.db2.gz VZXWOIFWVBIHMP-UHFFFAOYSA-N 1 2 249.705 2.179 20 0 BEADLO C[NH+]1CCN(CCSC2CCCCC2)CC1 ZINC000337322507 173083489 /nfs/dbraw/zinc/08/34/89/173083489.db2.gz DHHIJHSYGNRYCY-UHFFFAOYSA-N 1 2 242.432 2.300 20 0 BEADLO C[NH2+]Cc1noc(Cc2ccccc2Cl)n1 ZINC000051848714 173399612 /nfs/dbraw/zinc/39/96/12/173399612.db2.gz GVNHZALUPPQHHK-UHFFFAOYSA-N 1 2 237.690 2.033 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2CCCCC2(C)C)n1 ZINC000226694309 173399637 /nfs/dbraw/zinc/39/96/37/173399637.db2.gz CGGGZIWOOSETAP-VIFPVBQESA-N 1 2 223.320 2.473 20 0 BEADLO COC(=O)C[NH2+][C@@H](c1ccccc1)C1CCC1 ZINC000119037505 173606750 /nfs/dbraw/zinc/60/67/50/173606750.db2.gz CJVJLOSDLHAOJR-AWEZNQCLSA-N 1 2 233.311 2.290 20 0 BEADLO COC1CCN(C(=O)Nc2cc[nH+]c(C)c2)CC1 ZINC000271069095 174026782 /nfs/dbraw/zinc/02/67/82/174026782.db2.gz NAZYVMNUINGOOB-UHFFFAOYSA-N 1 2 249.314 2.033 20 0 BEADLO COC1CCN(c2[nH+]c3ccccc3n2C)CC1 ZINC000270547539 174032389 /nfs/dbraw/zinc/03/23/89/174032389.db2.gz FDMOAHXNHUKBFE-UHFFFAOYSA-N 1 2 245.326 2.189 20 0 BEADLO COC1C[NH+](Cc2ccc(Cl)cc2)C1 ZINC000357888566 174035667 /nfs/dbraw/zinc/03/56/67/174035667.db2.gz FMDMVKOEJVEXIX-UHFFFAOYSA-N 1 2 211.692 2.171 20 0 BEADLO COCC1(C(=O)Nc2ccc(C)[nH+]c2C)CCC1 ZINC000285614681 174090418 /nfs/dbraw/zinc/09/04/18/174090418.db2.gz YHKXITBSYXGCCC-UHFFFAOYSA-N 1 2 248.326 2.454 20 0 BEADLO COCC1(C(=O)Nc2cc[nH+]cc2C)CCC1 ZINC000283304782 174090423 /nfs/dbraw/zinc/09/04/23/174090423.db2.gz DKQPZYRCKCLZQD-UHFFFAOYSA-N 1 2 234.299 2.145 20 0 BEADLO COCCCC[N@@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000352403788 174192568 /nfs/dbraw/zinc/19/25/68/174192568.db2.gz YCJDGWMCZMPFQS-SNVBAGLBSA-N 1 2 221.291 2.390 20 0 BEADLO COCCCC[N@H+]1CC[C@@H](C)C(F)(F)C1 ZINC000352403788 174192570 /nfs/dbraw/zinc/19/25/70/174192570.db2.gz YCJDGWMCZMPFQS-SNVBAGLBSA-N 1 2 221.291 2.390 20 0 BEADLO COCCCN(C)c1cc[nH+]c2ccncc21 ZINC000267919499 174220770 /nfs/dbraw/zinc/22/07/70/174220770.db2.gz CNXPKIDMNBNZCW-UHFFFAOYSA-N 1 2 231.299 2.103 20 0 BEADLO COCCCN(C)c1cc(C)[nH+]c(C(C)C)n1 ZINC000301091915 174220823 /nfs/dbraw/zinc/22/08/23/174220823.db2.gz FQYQGKHOYSSUCN-UHFFFAOYSA-N 1 2 237.347 2.381 20 0 BEADLO COCCC[C@@H](C)C(=O)Nc1cc[nH+]c(C)c1 ZINC000179861627 174260221 /nfs/dbraw/zinc/26/02/21/174260221.db2.gz RFVARDRSAPLGLO-SNVBAGLBSA-N 1 2 236.315 2.391 20 0 BEADLO COCC[N@H+](C)Cc1cccc(O)c1Cl ZINC000294883151 174281276 /nfs/dbraw/zinc/28/12/76/174281276.db2.gz LBAXLROLGFVHPF-UHFFFAOYSA-N 1 2 229.707 2.124 20 0 BEADLO COCC[N@@H+](C)Cc1cccc(O)c1Cl ZINC000294883151 174281278 /nfs/dbraw/zinc/28/12/78/174281278.db2.gz LBAXLROLGFVHPF-UHFFFAOYSA-N 1 2 229.707 2.124 20 0 BEADLO COCC[N@H+](C/C=C\Cl)Cc1ccccn1 ZINC000287204857 174284722 /nfs/dbraw/zinc/28/47/22/174284722.db2.gz DSTIGBBLAULBGT-XQRVVYSFSA-N 1 2 240.734 2.283 20 0 BEADLO COCC[N@@H+](C/C=C\Cl)Cc1ccccn1 ZINC000287204857 174284726 /nfs/dbraw/zinc/28/47/26/174284726.db2.gz DSTIGBBLAULBGT-XQRVVYSFSA-N 1 2 240.734 2.283 20 0 BEADLO COCCN(c1cc[nH+]c(C)n1)[C@H]1CC[C@@H](C)C1 ZINC000357647196 174301850 /nfs/dbraw/zinc/30/18/50/174301850.db2.gz QGXMEGDASZVHLD-YPMHNXCESA-N 1 2 249.358 2.426 20 0 BEADLO COCC[N@H+](Cc1ncc(C2CC2)o1)C1CC1 ZINC000340657030 174302607 /nfs/dbraw/zinc/30/26/07/174302607.db2.gz HBPCUUTXQLSYGJ-UHFFFAOYSA-N 1 2 236.315 2.163 20 0 BEADLO COCC[N@@H+](Cc1ncc(C2CC2)o1)C1CC1 ZINC000340657030 174302609 /nfs/dbraw/zinc/30/26/09/174302609.db2.gz HBPCUUTXQLSYGJ-UHFFFAOYSA-N 1 2 236.315 2.163 20 0 BEADLO COCC[N@@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000246346352 174317427 /nfs/dbraw/zinc/31/74/27/174317427.db2.gz FIRSGEGUMGLERD-PWSUYJOCSA-N 1 2 241.356 2.156 20 0 BEADLO COCC[N@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000246346352 174317428 /nfs/dbraw/zinc/31/74/28/174317428.db2.gz FIRSGEGUMGLERD-PWSUYJOCSA-N 1 2 241.356 2.156 20 0 BEADLO COCC[N@@H+]1Cc2ccc(Cl)cc2C1 ZINC000335159476 174317903 /nfs/dbraw/zinc/31/79/03/174317903.db2.gz LRVNMIXLBNEEJJ-UHFFFAOYSA-N 1 2 211.692 2.302 20 0 BEADLO COCC[N@H+]1Cc2ccc(Cl)cc2C1 ZINC000335159476 174317905 /nfs/dbraw/zinc/31/79/05/174317905.db2.gz LRVNMIXLBNEEJJ-UHFFFAOYSA-N 1 2 211.692 2.302 20 0 BEADLO COCC[C@@H]1CCCCN(c2cc(C)[nH+]cn2)C1 ZINC000341955522 174395849 /nfs/dbraw/zinc/39/58/49/174395849.db2.gz HFGSYQGMMDKGIX-ZDUSSCGKSA-N 1 2 249.358 2.428 20 0 BEADLO CO[C@H](C(=O)Nc1c(C)cc(C)[nH+]c1C)C1CC1 ZINC000332210768 174801789 /nfs/dbraw/zinc/80/17/89/174801789.db2.gz VPRQYHMNOTWKIY-ZDUSSCGKSA-N 1 2 248.326 2.370 20 0 BEADLO CO[C@H]1CCC[C@H]1CNc1cccc[nH+]1 ZINC000308966973 174884010 /nfs/dbraw/zinc/88/40/10/174884010.db2.gz WJVKWNJGVFLOHR-QWRGUYRKSA-N 1 2 206.289 2.309 20 0 BEADLO COc1cc(NCc2[nH]cc[nH+]2)cc(OC)c1C ZINC000292652200 175003552 /nfs/dbraw/zinc/00/35/52/175003552.db2.gz LAURWXVCSCQDFS-UHFFFAOYSA-N 1 2 247.298 2.347 20 0 BEADLO COc1cc(NCc2c[nH+]cn2C)cc(OC)c1 ZINC000078779891 175003788 /nfs/dbraw/zinc/00/37/88/175003788.db2.gz QDVJBDQJCQKAAH-UHFFFAOYSA-N 1 2 247.298 2.049 20 0 BEADLO COc1ccc(-c2ccc(N)[nH+]c2)c(F)c1 ZINC000052886430 175033718 /nfs/dbraw/zinc/03/37/18/175033718.db2.gz ADNMPFTXFORWGL-UHFFFAOYSA-N 1 2 218.231 2.479 20 0 BEADLO COc1ccc(C[NH2+][C@@H](C)c2cc(C)on2)cn1 ZINC000337308910 175109072 /nfs/dbraw/zinc/10/90/72/175109072.db2.gz TWKBROBBDVYLBP-JTQLQIEISA-N 1 2 247.298 2.237 20 0 BEADLO COc1ccc([NH2+]C(C)C)cc1NC(C)=O ZINC000133005743 175149630 /nfs/dbraw/zinc/14/96/30/175149630.db2.gz VSEUHGNFKVNYPF-UHFFFAOYSA-N 1 2 222.288 2.474 20 0 BEADLO COc1ccc(NCc2c[nH+]cn2C)cc1F ZINC000090165302 175152631 /nfs/dbraw/zinc/15/26/31/175152631.db2.gz QVXKCZXTJJSZRB-UHFFFAOYSA-N 1 2 235.262 2.180 20 0 BEADLO COc1ccc(NCc2c[nH+]cn2C)c(OC)c1 ZINC000078779795 175152682 /nfs/dbraw/zinc/15/26/82/175152682.db2.gz KIYRVVQDZVJVII-UHFFFAOYSA-N 1 2 247.298 2.049 20 0 BEADLO COc1ccc(NCc2[nH]cc[nH+]2)c(C)c1 ZINC000061566821 175152876 /nfs/dbraw/zinc/15/28/76/175152876.db2.gz DSVGKNJPCLQAST-UHFFFAOYSA-N 1 2 217.272 2.339 20 0 BEADLO COc1ccc([C@@H](C)[NH2+]Cc2nonc2C)cc1 ZINC000090340179 175177486 /nfs/dbraw/zinc/17/74/86/175177486.db2.gz KZIJVBYWDFJUIP-SECBINFHSA-N 1 2 247.298 2.237 20 0 BEADLO Cc1noc(C[N@@H+]2CCC[C@H]2c2ccncc2)n1 ZINC000162754126 487630041 /nfs/dbraw/zinc/63/00/41/487630041.db2.gz GPTJJELMIIIYRS-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1noc(C[N@H+]2CCC[C@H]2c2ccncc2)n1 ZINC000162754126 487630047 /nfs/dbraw/zinc/63/00/47/487630047.db2.gz GPTJJELMIIIYRS-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2ncccn2)c1 ZINC000361689653 175254703 /nfs/dbraw/zinc/25/47/03/175254703.db2.gz PADJHTSYNVFGHL-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2ncccn2)c1 ZINC000361689653 175254705 /nfs/dbraw/zinc/25/47/05/175254705.db2.gz PADJHTSYNVFGHL-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1cccc(C[N@@H+]2CCC(=O)[C@@H](C)C2)c1 ZINC000049693791 175256654 /nfs/dbraw/zinc/25/66/54/175256654.db2.gz FMJUNDZCXWIIMO-NSHDSACASA-N 1 2 233.311 2.106 20 0 BEADLO COc1cccc(C[N@H+]2CCC(=O)[C@@H](C)C2)c1 ZINC000049693791 175256656 /nfs/dbraw/zinc/25/66/56/175256656.db2.gz FMJUNDZCXWIIMO-NSHDSACASA-N 1 2 233.311 2.106 20 0 BEADLO COc1cccc(C[N@@H+]2CCC[C@@](C)(F)C2)n1 ZINC000296133987 175258456 /nfs/dbraw/zinc/25/84/56/175258456.db2.gz URGWYFFHAGNVJN-CYBMUJFWSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cccc(C[N@H+]2CCC[C@@](C)(F)C2)n1 ZINC000296133987 175258457 /nfs/dbraw/zinc/25/84/57/175258457.db2.gz URGWYFFHAGNVJN-CYBMUJFWSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cccc(COCc2[nH]cc[nH+]2)c1 ZINC000123838703 175270082 /nfs/dbraw/zinc/27/00/82/175270082.db2.gz RZEPKEJRUNFYMH-UHFFFAOYSA-N 1 2 218.256 2.135 20 0 BEADLO COc1cccc(OCCOCc2[nH]cc[nH+]2)c1 ZINC000180046813 175283680 /nfs/dbraw/zinc/28/36/80/175283680.db2.gz LNQIBPVPIFSHPE-UHFFFAOYSA-N 1 2 248.282 2.014 20 0 BEADLO COc1cccc([C@@H](C)[NH2+]Cc2ccn[nH]2)c1 ZINC000037771544 175286517 /nfs/dbraw/zinc/28/65/17/175286517.db2.gz FGBVLUDZBZFMGK-SNVBAGLBSA-N 1 2 231.299 2.269 20 0 BEADLO COc1ccccc1C[N@@H+]1CCC(=O)C[C@@H]1C ZINC000049708122 175326259 /nfs/dbraw/zinc/32/62/59/175326259.db2.gz KSOUDCHMNMMDLE-NSHDSACASA-N 1 2 233.311 2.249 20 0 BEADLO COc1ccccc1C[N@H+]1CCC(=O)C[C@@H]1C ZINC000049708122 175326261 /nfs/dbraw/zinc/32/62/61/175326261.db2.gz KSOUDCHMNMMDLE-NSHDSACASA-N 1 2 233.311 2.249 20 0 BEADLO COc1ccnc(N[C@@H](c2[nH]cc[nH+]2)C(C)C)n1 ZINC000285521242 175366775 /nfs/dbraw/zinc/36/67/75/175366775.db2.gz GPEZATMRWGYUCQ-SNVBAGLBSA-N 1 2 247.302 2.018 20 0 BEADLO COc1ccnc(N[C@H](c2[nH]cc[nH+]2)C(C)C)n1 ZINC000285521236 175368386 /nfs/dbraw/zinc/36/83/86/175368386.db2.gz GPEZATMRWGYUCQ-JTQLQIEISA-N 1 2 247.302 2.018 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)C[C@@H]1C=CCC1 ZINC000294619090 175370508 /nfs/dbraw/zinc/37/05/08/175370508.db2.gz OMPIUVNFNNEVPP-LLVKDONJSA-N 1 2 246.310 2.063 20 0 BEADLO COc1cc[nH+]cc1CS[C@@H](C)C(C)=O ZINC000286579069 175373853 /nfs/dbraw/zinc/37/38/53/175373853.db2.gz RGUHPRMNZDDKOS-VIFPVBQESA-N 1 2 225.313 2.301 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@H]1C[C@H]1C(C)C ZINC000185210428 175374335 /nfs/dbraw/zinc/37/43/35/175374335.db2.gz SJTTYPDNEXKVRZ-UWVGGRQHSA-N 1 2 234.299 2.321 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H](C)CSC ZINC000066768945 175374503 /nfs/dbraw/zinc/37/45/03/175374503.db2.gz IVDNLJBOEIJVGT-QMMMGPOBSA-N 1 2 240.328 2.028 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C1=C(C)OCCC1 ZINC000125457473 175375337 /nfs/dbraw/zinc/37/53/37/175375337.db2.gz ACIHUPKWNSLQRV-UHFFFAOYSA-N 1 2 248.282 2.113 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1cnccc1C ZINC000358246304 175376234 /nfs/dbraw/zinc/37/62/34/175376234.db2.gz YRDIVXHPFYNWBE-UHFFFAOYSA-N 1 2 243.266 2.046 20 0 BEADLO COc1ccsc1C[NH2+]CC(F)F ZINC000147709457 175377835 /nfs/dbraw/zinc/37/78/35/175377835.db2.gz GJYGDYKNMHLARQ-UHFFFAOYSA-N 1 2 207.245 2.111 20 0 BEADLO COc1ncccc1CNc1cccc[nH+]1 ZINC000037655427 175408441 /nfs/dbraw/zinc/40/84/41/175408441.db2.gz JCJSKLUNYGJDFH-UHFFFAOYSA-N 1 2 215.256 2.097 20 0 BEADLO CCCn1nccc1C[NH+]1CC2(CC2(F)F)C1 ZINC000668294153 487631146 /nfs/dbraw/zinc/63/11/46/487631146.db2.gz RJPKMVSGBXZWSQ-UHFFFAOYSA-N 1 2 241.285 2.134 20 0 BEADLO C[C@@H](CC(N)=O)Nc1[nH+]ccc2ccc(F)cc21 ZINC000354327774 175654036 /nfs/dbraw/zinc/65/40/36/175654036.db2.gz KEIDINFUNFWZJT-QMMMGPOBSA-N 1 2 247.273 2.050 20 0 BEADLO C[C@@H](c1ccccc1)[N@H+](C)Cc1cnn(C)n1 ZINC000289553116 176021180 /nfs/dbraw/zinc/02/11/80/176021180.db2.gz DNWJXZUASWQCCJ-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1ccccc1)[N@@H+](C)Cc1cnn(C)n1 ZINC000289553116 176021181 /nfs/dbraw/zinc/02/11/81/176021181.db2.gz DNWJXZUASWQCCJ-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1ccco1)[N@H+](C)Cc1ccno1 ZINC000264716751 176031877 /nfs/dbraw/zinc/03/18/77/176031877.db2.gz NXAJCESBLSOEAI-VIFPVBQESA-N 1 2 206.245 2.461 20 0 BEADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1ccno1 ZINC000264716751 176031878 /nfs/dbraw/zinc/03/18/78/176031878.db2.gz NXAJCESBLSOEAI-VIFPVBQESA-N 1 2 206.245 2.461 20 0 BEADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1ccon1 ZINC000172653873 176036340 /nfs/dbraw/zinc/03/63/40/176036340.db2.gz AWEOJTUBSLIIPS-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1ccon1 ZINC000172653873 176036341 /nfs/dbraw/zinc/03/63/41/176036341.db2.gz AWEOJTUBSLIIPS-JTQLQIEISA-N 1 2 217.272 2.263 20 0 BEADLO C[C@@H]1CC(NC(=O)CCc2[nH]cc[nH+]2)C[C@@H](C)C1 ZINC000287674975 176053512 /nfs/dbraw/zinc/05/35/12/176053512.db2.gz PHCLMQAIQDXPPA-QWRGUYRKSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CCCCN(C(=O)CCc2c[nH+]cn2C)C1 ZINC000281578722 176063206 /nfs/dbraw/zinc/06/32/06/176063206.db2.gz MIHMBUDDLARIPB-GFCCVEGCSA-N 1 2 249.358 2.001 20 0 BEADLO C[C@@H]1CCCCN(c2nc[nH+]c(N)c2Cl)C1 ZINC000277798505 176066545 /nfs/dbraw/zinc/06/65/45/176066545.db2.gz NHEPYARGNZVEQH-MRVPVSSYSA-N 1 2 240.738 2.339 20 0 BEADLO C[C@@H]1CCCCN(c2[nH+]cnc(N)c2Cl)C1 ZINC000277798505 176066548 /nfs/dbraw/zinc/06/65/48/176066548.db2.gz NHEPYARGNZVEQH-MRVPVSSYSA-N 1 2 240.738 2.339 20 0 BEADLO C[C@@H]1CCC[N@@H+]1Cc1ncn(-c2ccccc2)n1 ZINC000179356335 176110909 /nfs/dbraw/zinc/11/09/09/176110909.db2.gz WTBVOWYOAYIWHX-GFCCVEGCSA-N 1 2 242.326 2.252 20 0 BEADLO C[C@@H]1CCC[N@H+]1Cc1ncn(-c2ccccc2)n1 ZINC000179356335 176110910 /nfs/dbraw/zinc/11/09/10/176110910.db2.gz WTBVOWYOAYIWHX-GFCCVEGCSA-N 1 2 242.326 2.252 20 0 BEADLO C[C@@H]1CCC[C@@H](C)C1NC(=O)CCc1[nH]cc[nH+]1 ZINC000289338458 176113392 /nfs/dbraw/zinc/11/33/92/176113392.db2.gz ZFMFNFHFQAWQAU-GHMZBOCLSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N1C(=O)CCc1c[nH+]c[nH]1 ZINC000074726955 176114636 /nfs/dbraw/zinc/11/46/36/176114636.db2.gz NKOPRJQQPIPSGB-GHMZBOCLSA-N 1 2 235.331 2.132 20 0 BEADLO C[C@@H]1CCC[C@@H](C)N1C(=O)CCc1c[nH]c[nH+]1 ZINC000074726955 176114637 /nfs/dbraw/zinc/11/46/37/176114637.db2.gz NKOPRJQQPIPSGB-GHMZBOCLSA-N 1 2 235.331 2.132 20 0 BEADLO C[C@@H]1CCC[C@@H](CNC(=O)Cn2cc[nH+]c2)[C@@H]1C ZINC000360470330 176118566 /nfs/dbraw/zinc/11/85/66/176118566.db2.gz SQEZKVKLWDUHED-UPJWGTAASA-N 1 2 249.358 2.072 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)CCc2c[nH+]cn2C)C1 ZINC000188572919 176121692 /nfs/dbraw/zinc/12/16/92/176121692.db2.gz HESBZOMPCFTBLW-VXGBXAGGSA-N 1 2 249.358 2.048 20 0 BEADLO C[C@@H]1CCC[C@H](C(=O)N(C)Cc2[nH]cc[nH+]2)C1 ZINC000335835789 176135124 /nfs/dbraw/zinc/13/51/24/176135124.db2.gz WXPFQDDIGSINPR-MNOVXSKESA-N 1 2 235.331 2.194 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)CCc2c[nH+]c[nH]2)[C@@H]1C ZINC000188420679 176141597 /nfs/dbraw/zinc/14/15/97/176141597.db2.gz CZRNERWZZRERPQ-WZRBSPASSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)CCc2c[nH]c[nH+]2)[C@@H]1C ZINC000188420679 176141598 /nfs/dbraw/zinc/14/15/98/176141598.db2.gz CZRNERWZZRERPQ-WZRBSPASSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)CCc2c[nH+]cn2C)C1 ZINC000188572877 176141619 /nfs/dbraw/zinc/14/16/19/176141619.db2.gz HESBZOMPCFTBLW-NEPJUHHUSA-N 1 2 249.358 2.048 20 0 BEADLO C[C@@H]1CCOCC[N@@H+]1Cc1ncc(C2CC2)o1 ZINC000367655468 176190031 /nfs/dbraw/zinc/19/00/31/176190031.db2.gz DAQFOGUSEBEUGP-SNVBAGLBSA-N 1 2 236.315 2.163 20 0 BEADLO C[C@@H]1CCOCC[N@H+]1Cc1ncc(C2CC2)o1 ZINC000367655468 176190034 /nfs/dbraw/zinc/19/00/34/176190034.db2.gz DAQFOGUSEBEUGP-SNVBAGLBSA-N 1 2 236.315 2.163 20 0 BEADLO C[C@@H]1CC[C@@H](C)N(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000284156152 176196313 /nfs/dbraw/zinc/19/63/13/176196313.db2.gz WVJGQZXQIQYKLD-XIJCSBCJSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@@H]1CC[C@@H](C[N@@H+]2CCC[C@H]2C(F)F)O1 ZINC000353167303 176204475 /nfs/dbraw/zinc/20/44/75/176204475.db2.gz AXQVIPFQLMUBLQ-UTLUCORTSA-N 1 2 219.275 2.283 20 0 BEADLO C[C@@H]1CC[C@@H](C[N@H+]2CCC[C@H]2C(F)F)O1 ZINC000353167303 176204476 /nfs/dbraw/zinc/20/44/76/176204476.db2.gz AXQVIPFQLMUBLQ-UTLUCORTSA-N 1 2 219.275 2.283 20 0 BEADLO C[C@H]1CC[C@H](NC(=O)CCc2c[nH+]cn2C)CC1 ZINC000193196835 176210170 /nfs/dbraw/zinc/21/01/70/176210170.db2.gz BFEQZNLPJQKBCF-TXEJJXNPSA-N 1 2 249.358 2.048 20 0 BEADLO C[C@@H]1CC[C@H](CC(=O)NCCCn2cc[nH+]c2)C1 ZINC000164141083 176222414 /nfs/dbraw/zinc/22/24/14/176222414.db2.gz IQPPYDSHCCTFMU-OLZOCXBDSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@@H]1CC[C@H](C[N@@H+]2CCC[C@H]2C(F)F)O1 ZINC000353167300 176223928 /nfs/dbraw/zinc/22/39/28/176223928.db2.gz AXQVIPFQLMUBLQ-BBBLOLIVSA-N 1 2 219.275 2.283 20 0 BEADLO C[C@@H]1CC[C@H](C[N@H+]2CCC[C@H]2C(F)F)O1 ZINC000353167300 176223929 /nfs/dbraw/zinc/22/39/29/176223929.db2.gz AXQVIPFQLMUBLQ-BBBLOLIVSA-N 1 2 219.275 2.283 20 0 BEADLO C[C@@H]1CC[C@H](C[N@@H+]2CCC[C@@H]2C(F)F)O1 ZINC000353167302 176224245 /nfs/dbraw/zinc/22/42/45/176224245.db2.gz AXQVIPFQLMUBLQ-OPRDCNLKSA-N 1 2 219.275 2.283 20 0 BEADLO C[C@@H]1CC[C@H](C[N@H+]2CCC[C@@H]2C(F)F)O1 ZINC000353167302 176224247 /nfs/dbraw/zinc/22/42/47/176224247.db2.gz AXQVIPFQLMUBLQ-OPRDCNLKSA-N 1 2 219.275 2.283 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)CCc2[nH]cc[nH+]2)[C@H](C)C1 ZINC000287401915 176231250 /nfs/dbraw/zinc/23/12/50/176231250.db2.gz JFERTSZGIIFASP-UTUOFQBUSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)CCn2cc[nH+]c2)[C@H](C)C1 ZINC000264967661 176231631 /nfs/dbraw/zinc/23/16/31/176231631.db2.gz FQBBKGYFUHTUHY-UPJWGTAASA-N 1 2 249.358 2.214 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc(F)cn2)CC(C)(C)O1 ZINC000276194418 176305007 /nfs/dbraw/zinc/30/50/07/176305007.db2.gz CZKQYSPMLMQHOV-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc(F)cn2)CC(C)(C)O1 ZINC000276194418 176305009 /nfs/dbraw/zinc/30/50/09/176305009.db2.gz CZKQYSPMLMQHOV-SNVBAGLBSA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccccc2OC2CC2)CCO1 ZINC000289272153 176307907 /nfs/dbraw/zinc/30/79/07/176307907.db2.gz FFLVPELCFYGIOF-GFCCVEGCSA-N 1 2 247.338 2.449 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccccc2OC2CC2)CCO1 ZINC000289272153 176307909 /nfs/dbraw/zinc/30/79/09/176307909.db2.gz FFLVPELCFYGIOF-GFCCVEGCSA-N 1 2 247.338 2.449 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccccc2F)CCC1=O ZINC000049693560 176308241 /nfs/dbraw/zinc/30/82/41/176308241.db2.gz ITOUFCQKTAFBNY-SNVBAGLBSA-N 1 2 221.275 2.237 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccccc2F)CCC1=O ZINC000049693560 176308242 /nfs/dbraw/zinc/30/82/42/176308242.db2.gz ITOUFCQKTAFBNY-SNVBAGLBSA-N 1 2 221.275 2.237 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnns2)CCC1(F)F ZINC000336254017 176310252 /nfs/dbraw/zinc/31/02/52/176310252.db2.gz HZPZSBGSVKUYRA-SSDOTTSWSA-N 1 2 233.287 2.015 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnns2)CCC1(F)F ZINC000336254017 176310254 /nfs/dbraw/zinc/31/02/54/176310254.db2.gz HZPZSBGSVKUYRA-SSDOTTSWSA-N 1 2 233.287 2.015 20 0 BEADLO C[C@H]1CN(c2cc(NCC3CC3)[nH+]cn2)C[C@H]1C ZINC000301835871 176318853 /nfs/dbraw/zinc/31/88/53/176318853.db2.gz UTDSRJZVRUCAQS-PHIMTYICSA-N 1 2 246.358 2.391 20 0 BEADLO C[C@H]1CN(c2cc(NCC3CC3)nc[nH+]2)C[C@H]1C ZINC000301835871 176318855 /nfs/dbraw/zinc/31/88/55/176318855.db2.gz UTDSRJZVRUCAQS-PHIMTYICSA-N 1 2 246.358 2.391 20 0 BEADLO C[C@H](c1csnn1)[N@@H+]1CCSC[C@@H](C)C1 ZINC000336259156 176350760 /nfs/dbraw/zinc/35/07/60/176350760.db2.gz PORDQFHJOKBCHC-DTWKUNHWSA-N 1 2 243.401 2.284 20 0 BEADLO C[C@H](c1csnn1)[N@H+]1CCSC[C@@H](C)C1 ZINC000336259156 176350762 /nfs/dbraw/zinc/35/07/62/176350762.db2.gz PORDQFHJOKBCHC-DTWKUNHWSA-N 1 2 243.401 2.284 20 0 BEADLO C[C@@H]1C[C@@H]([NH2+][C@H](C2CC2)C(F)(F)F)CCO1 ZINC000309805280 176379166 /nfs/dbraw/zinc/37/91/66/176379166.db2.gz SAUQQNCHNUGGTE-FKTZTGRPSA-N 1 2 237.265 2.484 20 0 BEADLO C[C@@H]1C[C@@H]1CC(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000355499153 176387875 /nfs/dbraw/zinc/38/78/75/176387875.db2.gz AYOSRZJPNGSJOI-MXWKQRLJSA-N 1 2 233.315 2.119 20 0 BEADLO CC(F)(F)C[NH2+]Cc1ccc2c(c1)OCCO2 ZINC000515437508 487635565 /nfs/dbraw/zinc/63/55/65/487635565.db2.gz FCPLNQBYNJEZRK-UHFFFAOYSA-N 1 2 243.253 2.203 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ncc[nH]1)c1ccccn1 ZINC000124672344 176914330 /nfs/dbraw/zinc/91/43/30/176914330.db2.gz DWYOTHJMNINHTP-ZJUUUORDSA-N 1 2 216.288 2.217 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cn[nH]c1)c1cscn1 ZINC000222510311 176916207 /nfs/dbraw/zinc/91/62/07/176916207.db2.gz RQYJSBKPMSZDPJ-JGVFFNPUSA-N 1 2 222.317 2.278 20 0 BEADLO C[C@H](O)c1ncc(C[N@@H+]2CCC[C@@H]2CF)s1 ZINC000294197825 177019578 /nfs/dbraw/zinc/01/95/78/177019578.db2.gz XQMLQZSCDRHRAG-DTWKUNHWSA-N 1 2 244.335 2.130 20 0 BEADLO C[C@H](O)c1ncc(C[N@H+]2CCC[C@@H]2CF)s1 ZINC000294197825 177019580 /nfs/dbraw/zinc/01/95/80/177019580.db2.gz XQMLQZSCDRHRAG-DTWKUNHWSA-N 1 2 244.335 2.130 20 0 BEADLO C[C@H](c1ccccn1)[N@H+](C)Cc1cocn1 ZINC000191973674 177042970 /nfs/dbraw/zinc/04/29/70/177042970.db2.gz LDPWIQKRBOFRHC-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1cocn1 ZINC000191973674 177042971 /nfs/dbraw/zinc/04/29/71/177042971.db2.gz LDPWIQKRBOFRHC-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H](c1ccco1)[N@H+](C)Cc1ccn(C)n1 ZINC000270763805 177047234 /nfs/dbraw/zinc/04/72/34/177047234.db2.gz GBRBWRTVFOXVCR-SNVBAGLBSA-N 1 2 219.288 2.206 20 0 BEADLO C[C@H](c1ccco1)[N@@H+](C)Cc1ccn(C)n1 ZINC000270763805 177047235 /nfs/dbraw/zinc/04/72/35/177047235.db2.gz GBRBWRTVFOXVCR-SNVBAGLBSA-N 1 2 219.288 2.206 20 0 BEADLO C[C@H](c1ccco1)[N@H+](C)Cc1ccno1 ZINC000264716748 177048173 /nfs/dbraw/zinc/04/81/73/177048173.db2.gz NXAJCESBLSOEAI-SECBINFHSA-N 1 2 206.245 2.461 20 0 BEADLO C[C@H](c1ccco1)[N@@H+](C)Cc1ccno1 ZINC000264716748 177048175 /nfs/dbraw/zinc/04/81/75/177048175.db2.gz NXAJCESBLSOEAI-SECBINFHSA-N 1 2 206.245 2.461 20 0 BEADLO C[C@H](c1ccncc1)N(C)Cc1c[nH+]cn1C ZINC000179259504 177050183 /nfs/dbraw/zinc/05/01/83/177050183.db2.gz SDGQPMUAWZYHCB-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1cnccn1)[N@@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000279821158 177051434 /nfs/dbraw/zinc/05/14/34/177051434.db2.gz QMXBZTDYRPMWNJ-YPMHNXCESA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H](c1cnccn1)[N@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000279821158 177051435 /nfs/dbraw/zinc/05/14/35/177051435.db2.gz QMXBZTDYRPMWNJ-YPMHNXCESA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H](c1cnn(C)c1)N(C)c1cccc[nH+]1 ZINC000302698405 177052549 /nfs/dbraw/zinc/05/25/49/177052549.db2.gz WWKPEYXEORGIBR-SNVBAGLBSA-N 1 2 216.288 2.013 20 0 BEADLO C[C@H]1CC(NC(=O)CCn2cc[nH+]c2)C[C@H](C)C1 ZINC000265722598 177064635 /nfs/dbraw/zinc/06/46/35/177064635.db2.gz NGVROCMMFUFNFG-VXGBXAGGSA-N 1 2 249.358 2.214 20 0 BEADLO C[C@H]1CCCCN(c2nc[nH+]c(N)c2Cl)C1 ZINC000277798508 177071794 /nfs/dbraw/zinc/07/17/94/177071794.db2.gz NHEPYARGNZVEQH-QMMMGPOBSA-N 1 2 240.738 2.339 20 0 BEADLO C[C@H]1CCCCN(c2[nH+]cnc(N)c2Cl)C1 ZINC000277798508 177071797 /nfs/dbraw/zinc/07/17/97/177071797.db2.gz NHEPYARGNZVEQH-QMMMGPOBSA-N 1 2 240.738 2.339 20 0 BEADLO C[C@H]1CCCC[C@@H]1CNC(=O)CCn1cc[nH+]c1 ZINC000299657328 177079874 /nfs/dbraw/zinc/07/98/74/177079874.db2.gz MLFALFBDXYWDIH-QWHCGFSZSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@H]1CCCC[C@@H]1N(C)C(=O)CCc1[nH]cc[nH+]1 ZINC000279259319 177081301 /nfs/dbraw/zinc/08/13/01/177081301.db2.gz SZNCSSDGWJCADP-RYUDHWBXSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)[C@H]1C ZINC000284073891 177091155 /nfs/dbraw/zinc/09/11/55/177091155.db2.gz RTNMJGXRWLKOOO-PZIAFJOJSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@H]1CCC[N@@H+]1Cc1nccn1CC(F)(F)F ZINC000173984664 177110759 /nfs/dbraw/zinc/11/07/59/177110759.db2.gz VNAQPAJBGMENHJ-VIFPVBQESA-N 1 2 247.264 2.430 20 0 BEADLO C[C@H]1CCC[N@H+]1Cc1nccn1CC(F)(F)F ZINC000173984664 177110761 /nfs/dbraw/zinc/11/07/61/177110761.db2.gz VNAQPAJBGMENHJ-VIFPVBQESA-N 1 2 247.264 2.430 20 0 BEADLO C[C@H]1CCC[C@@H](NC(=O)CCc2c[nH+]c[nH]2)CC1 ZINC000281936434 177121351 /nfs/dbraw/zinc/12/13/51/177121351.db2.gz RVWMRHCRUQYFNE-NWDGAFQWSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@H]1CCC[C@@H](NC(=O)CCc2c[nH]c[nH+]2)CC1 ZINC000281936434 177121354 /nfs/dbraw/zinc/12/13/54/177121354.db2.gz RVWMRHCRUQYFNE-NWDGAFQWSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@H]1CCC[C@H](C)N1C(=O)CCc1c[nH+]cn1C ZINC000280467357 177130145 /nfs/dbraw/zinc/13/01/45/177130145.db2.gz HWFDOFUZKJUYRA-RYUDHWBXSA-N 1 2 249.358 2.142 20 0 BEADLO C[C@H]1CCC[C@]1(O)CNc1cc[nH+]c(C2CC2)n1 ZINC000294278741 177144736 /nfs/dbraw/zinc/14/47/36/177144736.db2.gz XOOMYPRWDICUJZ-HZMBPMFUSA-N 1 2 247.342 2.317 20 0 BEADLO C[C@H]1CCN(C(=O)C(C)(C)C)C[C@H]1n1cc[nH+]c1 ZINC000123965857 177145169 /nfs/dbraw/zinc/14/51/69/177145169.db2.gz JREFQANGOCUPAV-NWDGAFQWSA-N 1 2 249.358 2.339 20 0 BEADLO C[C@H]1CCN(C(=O)C2CCC2)C[C@H]1n1cc[nH+]c1 ZINC000123054418 177146548 /nfs/dbraw/zinc/14/65/48/177146548.db2.gz XPXIVKFKUHBXJE-WCQYABFASA-N 1 2 247.342 2.093 20 0 BEADLO C[C@@H]1[C@@H](C)CCN1C(=O)c1ccc2[nH+]ccn2c1 ZINC000177060805 177153818 /nfs/dbraw/zinc/15/38/18/177153818.db2.gz HDDCZHLKQLBOIU-WDEREUQCSA-N 1 2 243.310 2.205 20 0 BEADLO C[C@H]1CCN(CC(F)(F)F)C[C@@H]1n1cc[nH+]c1 ZINC000156527830 177159537 /nfs/dbraw/zinc/15/95/37/177159537.db2.gz GFGRWOPROYIROI-UWVGGRQHSA-N 1 2 247.264 2.328 20 0 BEADLO C[C@H]1CCN(c2cc(NCC3CC3)[nH+]cn2)C1 ZINC000270229907 177171471 /nfs/dbraw/zinc/17/14/71/177171471.db2.gz FBPNFEGYHNHTJU-JTQLQIEISA-N 1 2 232.331 2.145 20 0 BEADLO C[C@H]1CCN(c2cc(NCC3CC3)nc[nH+]2)C1 ZINC000270229907 177171473 /nfs/dbraw/zinc/17/14/73/177171473.db2.gz FBPNFEGYHNHTJU-JTQLQIEISA-N 1 2 232.331 2.145 20 0 BEADLO C[C@H]1CC[C@@H](C[N@H+](C)Cc2cscn2)O1 ZINC000188541684 177189496 /nfs/dbraw/zinc/18/94/96/177189496.db2.gz IJNHERDFHXTFQN-ONGXEEELSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@H]1CC[C@@H](C[N@@H+](C)Cc2cscn2)O1 ZINC000188541684 177189498 /nfs/dbraw/zinc/18/94/98/177189498.db2.gz IJNHERDFHXTFQN-ONGXEEELSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@H]1CC[C@H](CC(=O)NCCCn2cc[nH+]c2)C1 ZINC000164141195 177200232 /nfs/dbraw/zinc/20/02/32/177200232.db2.gz IQPPYDSHCCTFMU-STQMWFEESA-N 1 2 249.358 2.216 20 0 BEADLO C[C@H]1CC[C@H](C[N@H+](C)Cc2cscn2)O1 ZINC000188541641 177200998 /nfs/dbraw/zinc/20/09/98/177200998.db2.gz IJNHERDFHXTFQN-GXSJLCMTSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@H]1CC[C@H](C[N@@H+](C)Cc2cscn2)O1 ZINC000188541641 177200999 /nfs/dbraw/zinc/20/09/99/177200999.db2.gz IJNHERDFHXTFQN-GXSJLCMTSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@H]1CC[C@H]([NH2+]c2ccc(-n3cnnn3)cc2)C1 ZINC000080427164 177205573 /nfs/dbraw/zinc/20/55/73/177205573.db2.gz VJQAHMLQZAINEC-JQWIXIFHSA-N 1 2 243.314 2.263 20 0 BEADLO C[C@H]1C[N@H+](CCc2ccccc2F)CCC1=O ZINC000049693541 177254690 /nfs/dbraw/zinc/25/46/90/177254690.db2.gz CDDCWOVXOYTYHW-NSHDSACASA-N 1 2 235.302 2.279 20 0 BEADLO C[C@H]1C[N@@H+](CCc2ccccc2F)CCC1=O ZINC000049693541 177254691 /nfs/dbraw/zinc/25/46/91/177254691.db2.gz CDDCWOVXOYTYHW-NSHDSACASA-N 1 2 235.302 2.279 20 0 BEADLO C[C@H]1C[N@H+](Cc2cc[nH]n2)Cc2ccccc2O1 ZINC000292848482 177261594 /nfs/dbraw/zinc/26/15/94/177261594.db2.gz SYNQOCVSWVFZAS-NSHDSACASA-N 1 2 243.310 2.193 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2O1 ZINC000292848482 177261597 /nfs/dbraw/zinc/26/15/97/177261597.db2.gz SYNQOCVSWVFZAS-NSHDSACASA-N 1 2 243.310 2.193 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccc(F)cn2)CC(C)(C)O1 ZINC000276194414 177263007 /nfs/dbraw/zinc/26/30/07/177263007.db2.gz CZKQYSPMLMQHOV-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccc(F)cn2)CC(C)(C)O1 ZINC000276194414 177263008 /nfs/dbraw/zinc/26/30/08/177263008.db2.gz CZKQYSPMLMQHOV-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cccc(Cl)n2)C[C@H](C)O1 ZINC000085696680 177264630 /nfs/dbraw/zinc/26/46/30/177264630.db2.gz JCKOISLJLUDFIC-AOOOYVTPSA-N 1 2 240.734 2.344 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cccc(Cl)n2)C[C@H](C)O1 ZINC000085696680 177264632 /nfs/dbraw/zinc/26/46/32/177264632.db2.gz JCKOISLJLUDFIC-AOOOYVTPSA-N 1 2 240.734 2.344 20 0 BEADLO C[C@H]1C[N@H+](Cc2cncs2)CC(C)(C)O1 ZINC000119504137 177269037 /nfs/dbraw/zinc/26/90/37/177269037.db2.gz KTIPOJKRONKVHB-VIFPVBQESA-N 1 2 226.345 2.142 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cncs2)CC(C)(C)O1 ZINC000119504137 177269039 /nfs/dbraw/zinc/26/90/39/177269039.db2.gz KTIPOJKRONKVHB-VIFPVBQESA-N 1 2 226.345 2.142 20 0 BEADLO C[C@H]1C[N@H+](Cc2ncc(C3CC3)o2)[C@H]1C ZINC000293522034 177270119 /nfs/dbraw/zinc/27/01/19/177270119.db2.gz WDFWBOSOUOHJJB-IUCAKERBSA-N 1 2 206.289 2.392 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ncc(C3CC3)o2)[C@H]1C ZINC000293522034 177270120 /nfs/dbraw/zinc/27/01/20/177270120.db2.gz WDFWBOSOUOHJJB-IUCAKERBSA-N 1 2 206.289 2.392 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1nc(-c2ccco2)no1 ZINC000292926736 177270419 /nfs/dbraw/zinc/27/04/19/177270419.db2.gz GRABDIMWKJIZPN-DTWKUNHWSA-N 1 2 233.271 2.170 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1nc(-c2ccco2)no1 ZINC000292926736 177270420 /nfs/dbraw/zinc/27/04/20/177270420.db2.gz GRABDIMWKJIZPN-DTWKUNHWSA-N 1 2 233.271 2.170 20 0 BEADLO C[C@H]1C[N@H+](Cc2ncnn2-c2ccccc2)[C@H]1C ZINC000293401604 177271715 /nfs/dbraw/zinc/27/17/15/177271715.db2.gz LODXULCKYHAZNN-RYUDHWBXSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ncnn2-c2ccccc2)[C@H]1C ZINC000293401604 177271717 /nfs/dbraw/zinc/27/17/17/177271717.db2.gz LODXULCKYHAZNN-RYUDHWBXSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1nnc(C2CC2)s1 ZINC000336266936 177272244 /nfs/dbraw/zinc/27/22/44/177272244.db2.gz OAGIXCRHOHDBLS-JGVFFNPUSA-N 1 2 223.345 2.256 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1nnc(C2CC2)s1 ZINC000336266936 177272245 /nfs/dbraw/zinc/27/22/45/177272245.db2.gz OAGIXCRHOHDBLS-JGVFFNPUSA-N 1 2 223.345 2.256 20 0 BEADLO C[C@H]1COCC[C@H]1Nc1cc[nH+]c2ccncc12 ZINC000277390925 177297265 /nfs/dbraw/zinc/29/72/65/177297265.db2.gz GISMNONSXQPIIE-CMPLNLGQSA-N 1 2 243.310 2.467 20 0 BEADLO C[C@H]1CSC(SCc2c[nH+]cn2C)=N1 ZINC000270881746 177302673 /nfs/dbraw/zinc/30/26/73/177302673.db2.gz PCDJHOLUQPMGQL-ZETCQYMHSA-N 1 2 227.358 2.145 20 0 BEADLO C[C@H]1CCN(C(=O)CCn2cc[nH+]c2)C[C@@H](C)C1 ZINC000269792379 177309761 /nfs/dbraw/zinc/30/97/61/177309761.db2.gz HHWURTJPIPRCNH-STQMWFEESA-N 1 2 249.358 2.168 20 0 BEADLO C[C@H]1C[C@@H](O)CN1c1[nH+]ccc2ccc(F)cc21 ZINC000336367896 177338391 /nfs/dbraw/zinc/33/83/91/177338391.db2.gz QXPSIJYABSGWJJ-JOYOIKCWSA-N 1 2 246.285 2.333 20 0 BEADLO C[C@H]1C[C@@H]1CC(=O)NCCCNc1cccc[nH+]1 ZINC000354379475 177341902 /nfs/dbraw/zinc/34/19/02/177341902.db2.gz CLJIMKHYKOTIFZ-NWDGAFQWSA-N 1 2 247.342 2.046 20 0 BEADLO C[C@H]1C[C@@H]1CC(=O)Nc1ccc[nH+]c1N(C)C ZINC000361551856 177342492 /nfs/dbraw/zinc/34/24/92/177342492.db2.gz QVKCFADRUUFQDW-VHSXEESVSA-N 1 2 233.315 2.132 20 0 BEADLO C[C@H]1C[C@@H]1NC(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000117785152 177349130 /nfs/dbraw/zinc/34/91/30/177349130.db2.gz MJEHCYJLTPRQTJ-GWCFXTLKSA-N 1 2 241.294 2.011 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)CCc2[nH]cc[nH+]2)[C@@H](C)C1 ZINC000287401919 177355908 /nfs/dbraw/zinc/35/59/08/177355908.db2.gz JFERTSZGIIFASP-WOPDTQHZSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H]1C[C@H](C)CN(C(=O)CCCn2cc[nH+]c2)C1 ZINC000125288304 177357511 /nfs/dbraw/zinc/35/75/11/177357511.db2.gz FSWRHKLCFYSWFT-STQMWFEESA-N 1 2 249.358 2.168 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1cn(-c2ccccc2)nn1 ZINC000336565524 177360191 /nfs/dbraw/zinc/36/01/91/177360191.db2.gz PZLBMYAMPNAOHG-RYUDHWBXSA-N 1 2 242.326 2.250 20 0 BEADLO C[C@H]1C[C@H](C)N1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000336233076 177360195 /nfs/dbraw/zinc/36/01/95/177360195.db2.gz ORYJPOMQCREFMK-UWVGGRQHSA-N 1 2 244.298 2.349 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1nncn1-c1ccccc1 ZINC000336460984 177360639 /nfs/dbraw/zinc/36/06/39/177360639.db2.gz VEGNHOUQGHDZIN-RYUDHWBXSA-N 1 2 242.326 2.250 20 0 BEADLO C[C@@H]1CC[C@@H](NC(=O)CCc2[nH]cc[nH+]2)C[C@@H]1C ZINC000356005496 177367239 /nfs/dbraw/zinc/36/72/39/177367239.db2.gz FVWCNHJEYUUMOZ-GRYCIOLGSA-N 1 2 249.358 2.283 20 0 BEADLO CCc1cc(N[C@H]2CCOC2(C)C)nc[nH+]1 ZINC000328280206 487641994 /nfs/dbraw/zinc/64/19/94/487641994.db2.gz ZBYSYDOUQNOFRA-JTQLQIEISA-N 1 2 221.304 2.018 20 0 BEADLO C[C@@H]1CCCN(c2cc(CO)cc[nH+]2)CC1 ZINC000082489750 487641672 /nfs/dbraw/zinc/64/16/72/487641672.db2.gz CAJZSHVGJMOLIT-LLVKDONJSA-N 1 2 220.316 2.200 20 0 BEADLO CCc1[nH]c(CNC(=O)C[C@H]2CC[C@@H](C)C2)c[nH+]1 ZINC001652464149 1173087726 /nfs/dbraw/zinc/08/77/26/1173087726.db2.gz VOZSITWNEPMGTC-MNOVXSKESA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)C[C@H]2CC[C@@H](C)C2)[nH+]1 ZINC001652464149 1173087733 /nfs/dbraw/zinc/08/77/33/1173087733.db2.gz VOZSITWNEPMGTC-MNOVXSKESA-N 1 2 249.358 2.415 20 0 BEADLO Cc1ccccc1CNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492776528 226052142 /nfs/dbraw/zinc/05/21/42/226052142.db2.gz ZVZUULCDIOZRHH-SREVYHEPSA-N 1 2 241.294 2.048 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)C=Cc2c[nH]c[nH+]2)C[C@@H]1C ZINC000492809064 226057414 /nfs/dbraw/zinc/05/74/14/226057414.db2.gz FLIARZJWXUCGPF-JXSGWAFGSA-N 1 2 247.342 2.364 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)C=Cc2c[nH]c[nH+]2)[C@@H](C)C1 ZINC000492815709 226060135 /nfs/dbraw/zinc/06/01/35/226060135.db2.gz XPISVJSKZSMGKA-ADCNQFKTSA-N 1 2 247.342 2.364 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)NCC1=CCCCC1 ZINC000492952434 226091266 /nfs/dbraw/zinc/09/12/66/226091266.db2.gz GYCIQCVDVHPRTN-SREVYHEPSA-N 1 2 231.299 2.040 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)/C=C\C2CCCC2)S1 ZINC000493049080 226112937 /nfs/dbraw/zinc/11/29/37/226112937.db2.gz MZEDEKLKZYDMPM-ATJFRQLMSA-N 1 2 238.356 2.340 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CC(C2CCCC2)C1 ZINC000493196457 226152799 /nfs/dbraw/zinc/15/27/99/226152799.db2.gz JWOJQFMILGCSTM-AATRIKPKSA-N 1 2 245.326 2.072 20 0 BEADLO C[C@@H]1CCCC[C@@H]1NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493254947 226167341 /nfs/dbraw/zinc/16/73/41/226167341.db2.gz DBTAAAGLVCSKRH-JNQBIPAQSA-N 1 2 233.315 2.118 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N[C@@H](C1CC1)C1CCC1 ZINC000493427876 226212986 /nfs/dbraw/zinc/21/29/86/226212986.db2.gz RIWCHEJIMFRKSK-PSKZRQQASA-N 1 2 245.326 2.118 20 0 BEADLO C[C@@H](c1ccco1)N(C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493448196 226217834 /nfs/dbraw/zinc/21/78/34/226217834.db2.gz HZPQICBNVCTHJB-OMMCCPJFSA-N 1 2 245.282 2.236 20 0 BEADLO C[C@]1(NC(=O)/C=C/c2[nH]cc[nH+]2)CC=CCC1 ZINC000493592980 226245027 /nfs/dbraw/zinc/24/50/27/226245027.db2.gz XXZVNYVTFDEKFH-GFUIURDCSA-N 1 2 231.299 2.038 20 0 BEADLO CN(C(=O)C=Cc1c[nH]c[nH+]1)C1CC(C)(C)C1 ZINC000493648251 226247680 /nfs/dbraw/zinc/24/76/80/226247680.db2.gz RVGXZCKSRRKLTL-SNAWJCMRSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@H]1CCCCN(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493785214 226253929 /nfs/dbraw/zinc/25/39/29/226253929.db2.gz IKQWOMPZMAWENJ-QRGHLMKCSA-N 1 2 233.315 2.072 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N(CC1CC1)CC1CC1 ZINC000493820216 226255616 /nfs/dbraw/zinc/25/56/16/226255616.db2.gz KVRSTLYWJYVEDR-AATRIKPKSA-N 1 2 245.326 2.072 20 0 BEADLO C[C@H]1CCCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493829520 226256376 /nfs/dbraw/zinc/25/63/76/226256376.db2.gz WZHOLOZKCARPOQ-GZTOBOFZSA-N 1 2 233.315 2.072 20 0 BEADLO FC(F)C[N@H+](C[C@@H]1CCSC1)C1CC1 ZINC000494946495 226272057 /nfs/dbraw/zinc/27/20/57/226272057.db2.gz IIBAWBPMLZGNFR-QMMMGPOBSA-N 1 2 221.316 2.469 20 0 BEADLO FC(F)C[N@@H+](C[C@@H]1CCSC1)C1CC1 ZINC000494946495 226272058 /nfs/dbraw/zinc/27/20/58/226272058.db2.gz IIBAWBPMLZGNFR-QMMMGPOBSA-N 1 2 221.316 2.469 20 0 BEADLO Cc1cc(CNC(=O)OCC2CC2)cc(C)[nH+]1 ZINC000496330320 226302128 /nfs/dbraw/zinc/30/21/28/226302128.db2.gz WLXBWVKLXMPYOL-UHFFFAOYSA-N 1 2 234.299 2.335 20 0 BEADLO CC[C@@]1(Nc2[nH+]c(C)nc3[nH]ccc32)CCOC1 ZINC000672275876 487655650 /nfs/dbraw/zinc/65/56/50/487655650.db2.gz CVAPOEDBWQJIHF-CYBMUJFWSA-N 1 2 246.314 2.247 20 0 BEADLO COc1ccc(C[NH2+][C@H](C)C(F)F)cc1OC ZINC000228482713 487656789 /nfs/dbraw/zinc/65/67/89/487656789.db2.gz XNFAWNHIDLGNHZ-MRVPVSSYSA-N 1 2 245.269 2.447 20 0 BEADLO COc1ccc(C[NH2+][C@@H](C)C(F)F)cc1OC ZINC000228482707 487656862 /nfs/dbraw/zinc/65/68/62/487656862.db2.gz XNFAWNHIDLGNHZ-QMMMGPOBSA-N 1 2 245.269 2.447 20 0 BEADLO CO[C@@H]([C@@H](C)Nc1cc[nH+]c(C(C)C)n1)C1CC1 ZINC000450867734 229166379 /nfs/dbraw/zinc/16/63/79/229166379.db2.gz ZTWKYUHJKHYBRB-MFKMUULPSA-N 1 2 249.358 2.247 20 0 BEADLO CC[C@@]1(C)COCC[N@@H+]1Cc1cc(C)nc(C)n1 ZINC000660149216 487697101 /nfs/dbraw/zinc/69/71/01/487697101.db2.gz PHPCZQYWOGNTQA-AWEZNQCLSA-N 1 2 249.358 2.094 20 0 BEADLO CC[C@@]1(C)COCC[N@H+]1Cc1cc(C)nc(C)n1 ZINC000660149216 487697104 /nfs/dbraw/zinc/69/71/04/487697104.db2.gz PHPCZQYWOGNTQA-AWEZNQCLSA-N 1 2 249.358 2.094 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)[C@@H]1CC12CCC2 ZINC000675304340 487698253 /nfs/dbraw/zinc/69/82/53/487698253.db2.gz SXSMKPVSHNZGSX-JTQLQIEISA-N 1 2 245.326 2.276 20 0 BEADLO CCN(CC)C(=O)Cc1cn2cccc(C)c2[nH+]1 ZINC000041291951 262921182 /nfs/dbraw/zinc/92/11/82/262921182.db2.gz QEPJUUASBNOOPH-UHFFFAOYSA-N 1 2 245.326 2.054 20 0 BEADLO C/C(Cl)=C/C[N@@H+](C(C)C)C1COC1 ZINC000528514616 262937613 /nfs/dbraw/zinc/93/76/13/262937613.db2.gz UOLMBWHDNJTYHO-WTKPLQERSA-N 1 2 203.713 2.238 20 0 BEADLO C/C(Cl)=C/C[N@H+](C(C)C)C1COC1 ZINC000528514616 262937614 /nfs/dbraw/zinc/93/76/14/262937614.db2.gz UOLMBWHDNJTYHO-WTKPLQERSA-N 1 2 203.713 2.238 20 0 BEADLO Cc1oncc1C[NH2+][C@@H](C)c1ncccc1F ZINC000528822990 262976274 /nfs/dbraw/zinc/97/62/74/262976274.db2.gz KGNLWZKPIPDPBH-QMMMGPOBSA-N 1 2 235.262 2.368 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)C1CC(C(C)(C)C)C1 ZINC000457806841 487707797 /nfs/dbraw/zinc/70/77/97/487707797.db2.gz LQUDWMWEGCYZKB-UHFFFAOYSA-N 1 2 249.358 2.109 20 0 BEADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1cn(C)cn1 ZINC000683899178 487710962 /nfs/dbraw/zinc/71/09/62/487710962.db2.gz WCAWZJNBQUPBHP-LLVKDONJSA-N 1 2 245.326 2.319 20 0 BEADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1cn(C)cn1 ZINC000683899178 487710964 /nfs/dbraw/zinc/71/09/64/487710964.db2.gz WCAWZJNBQUPBHP-LLVKDONJSA-N 1 2 245.326 2.319 20 0 BEADLO C[C@@H](CCC1CC1)NC(=O)CCCn1cc[nH+]c1 ZINC000681108010 487727187 /nfs/dbraw/zinc/72/71/87/487727187.db2.gz ZCSUFUHCWJYCLJ-LBPRGKRZSA-N 1 2 249.358 2.358 20 0 BEADLO CCOc1cccc(C[N@H+](C)Cc2cnc[nH]2)c1 ZINC000668422625 487728875 /nfs/dbraw/zinc/72/88/75/487728875.db2.gz FLKYDBQQKMUEOE-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO CCOc1cccc(C[N@@H+](C)Cc2cnc[nH]2)c1 ZINC000668422625 487728877 /nfs/dbraw/zinc/72/88/77/487728877.db2.gz FLKYDBQQKMUEOE-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO CCOc1cccc(C[N@H+](C)Cc2c[nH]cn2)c1 ZINC000668422625 487728880 /nfs/dbraw/zinc/72/88/80/487728880.db2.gz FLKYDBQQKMUEOE-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO CCOc1cccc(C[N@@H+](C)Cc2c[nH]cn2)c1 ZINC000668422625 487728882 /nfs/dbraw/zinc/72/88/82/487728882.db2.gz FLKYDBQQKMUEOE-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO Cc1ccc(C)c(NC(=O)Cn2cc[nH+]c2)c1 ZINC000010809319 487731496 /nfs/dbraw/zinc/73/14/96/487731496.db2.gz TUUFQUFPNXUKQS-UHFFFAOYSA-N 1 2 229.283 2.139 20 0 BEADLO CCCc1noc(Cc2ccc[nH+]c2C)n1 ZINC000284946085 487733672 /nfs/dbraw/zinc/73/36/72/487733672.db2.gz CTDXOOZJQZPKGZ-UHFFFAOYSA-N 1 2 217.272 2.316 20 0 BEADLO C1=CCC(Nc2cc(NC3CC3)[nH+]cn2)C1 ZINC000665706473 487736775 /nfs/dbraw/zinc/73/67/75/487736775.db2.gz PPHLGPJKQYWKIC-UHFFFAOYSA-N 1 2 216.288 2.181 20 0 BEADLO C1=CCC(Nc2cc(NC3CC3)nc[nH+]2)C1 ZINC000665706473 487736784 /nfs/dbraw/zinc/73/67/84/487736784.db2.gz PPHLGPJKQYWKIC-UHFFFAOYSA-N 1 2 216.288 2.181 20 0 BEADLO c1nc(N2CCC3(CC3)C2)cc(NC2CC2)[nH+]1 ZINC000665716812 487738982 /nfs/dbraw/zinc/73/89/82/487738982.db2.gz FUIFFSXTZXCMMN-UHFFFAOYSA-N 1 2 230.315 2.041 20 0 BEADLO c1nc(NC2CC2)cc(N2CCC3(CC3)C2)[nH+]1 ZINC000665716812 487738990 /nfs/dbraw/zinc/73/89/90/487738990.db2.gz FUIFFSXTZXCMMN-UHFFFAOYSA-N 1 2 230.315 2.041 20 0 BEADLO C[C@H]1CCCC[C@]1(C)NC(=O)CCc1c[nH+]c[nH]1 ZINC000457293240 487739912 /nfs/dbraw/zinc/73/99/12/487739912.db2.gz PVNMDLRMNYAHJL-FZMZJTMJSA-N 1 2 249.358 2.427 20 0 BEADLO C[C@H]1CCCC[C@]1(C)NC(=O)CCc1c[nH]c[nH+]1 ZINC000457293240 487739919 /nfs/dbraw/zinc/73/99/19/487739919.db2.gz PVNMDLRMNYAHJL-FZMZJTMJSA-N 1 2 249.358 2.427 20 0 BEADLO Cc1nc(N2CCC(CCO)CC2)c(C)c(C)[nH+]1 ZINC000675548426 487746574 /nfs/dbraw/zinc/74/65/74/487746574.db2.gz OGFPXWCCOYYHFT-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cccc(F)c2N)[C@@H](C)CO1 ZINC000226470105 487752803 /nfs/dbraw/zinc/75/28/03/487752803.db2.gz MXMONYHUSKVQCX-VHSXEESVSA-N 1 2 238.306 2.017 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cccc(F)c2N)[C@@H](C)CO1 ZINC000226470105 487752807 /nfs/dbraw/zinc/75/28/07/487752807.db2.gz MXMONYHUSKVQCX-VHSXEESVSA-N 1 2 238.306 2.017 20 0 BEADLO c1snnc1CNc1c[nH+]cc2c1CCCC2 ZINC000668439802 487757986 /nfs/dbraw/zinc/75/79/86/487757986.db2.gz FIUZGDGXMPGJGU-UHFFFAOYSA-N 1 2 246.339 2.424 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)[C@@H]1CCCC2(CC2)C1 ZINC000668448265 487770554 /nfs/dbraw/zinc/77/05/54/487770554.db2.gz MUFUFELHCXWVMO-LLVKDONJSA-N 1 2 247.342 2.339 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)[C@H]1CCCC2(CC2)C1 ZINC000668448266 487770565 /nfs/dbraw/zinc/77/05/65/487770565.db2.gz MUFUFELHCXWVMO-NSHDSACASA-N 1 2 247.342 2.339 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CC[C@@H](C)[C@H](F)C2)[nH+]1 ZINC000679193934 487776554 /nfs/dbraw/zinc/77/65/54/487776554.db2.gz ZEFRGSXYCYFWNU-LDYMZIIASA-N 1 2 248.305 2.451 20 0 BEADLO COc1ccc[nH+]c1NCc1nc(C)cs1 ZINC000095978140 487776302 /nfs/dbraw/zinc/77/63/02/487776302.db2.gz NJZORIJHYFTTFE-UHFFFAOYSA-N 1 2 235.312 2.467 20 0 BEADLO Cc1cnc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)o1 ZINC000679225726 487788758 /nfs/dbraw/zinc/78/87/58/487788758.db2.gz RCAWAHRDOSGHHS-WPRPVWTQSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1cnc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)o1 ZINC000679225726 487788761 /nfs/dbraw/zinc/78/87/61/487788761.db2.gz RCAWAHRDOSGHHS-WPRPVWTQSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1noc([C@@H](C)[NH+]2CCC(C(F)F)CC2)n1 ZINC000675904177 487789773 /nfs/dbraw/zinc/78/97/73/487789773.db2.gz SBANGGOXHDUGFH-SSDOTTSWSA-N 1 2 245.273 2.416 20 0 BEADLO CCn1cc[nH+]c1CN1CC[C@H](C)[C@H](F)C1 ZINC000679228454 487790094 /nfs/dbraw/zinc/79/00/94/487790094.db2.gz XOGCEBRZHICYRJ-WDEREUQCSA-N 1 2 225.311 2.083 20 0 BEADLO CCC[C@H](CC)NC(=O)[C@@H]1CCc2[nH+]ccn2C1 ZINC000364982965 487794590 /nfs/dbraw/zinc/79/45/90/487794590.db2.gz BCMISIVXWZTELW-NEPJUHHUSA-N 1 2 249.358 2.140 20 0 BEADLO COCCC1C[NH+](Cc2c(F)cccc2F)C1 ZINC000668473758 487799513 /nfs/dbraw/zinc/79/95/13/487799513.db2.gz AQLLJZQROBVABH-UHFFFAOYSA-N 1 2 241.281 2.433 20 0 BEADLO Cc1nnc(C[N@@H+](C)[C@H]2C[C@H]2c2ccccc2)o1 ZINC000676043723 487804358 /nfs/dbraw/zinc/80/43/58/487804358.db2.gz LWKDRBPDCOXGQX-STQMWFEESA-N 1 2 243.310 2.366 20 0 BEADLO Cc1nnc(C[N@H+](C)[C@H]2C[C@H]2c2ccccc2)o1 ZINC000676043723 487804361 /nfs/dbraw/zinc/80/43/61/487804361.db2.gz LWKDRBPDCOXGQX-STQMWFEESA-N 1 2 243.310 2.366 20 0 BEADLO COc1ccc(-c2[nH+]ccn2C)cc1OC ZINC000041231021 487812653 /nfs/dbraw/zinc/81/26/53/487812653.db2.gz ZDUSOOMVTJFBMO-UHFFFAOYSA-N 1 2 218.256 2.104 20 0 BEADLO Cc1cc(NC(=O)N2C[C@@H]3CCCC[C@@H]32)cc[nH+]1 ZINC000666492262 487820554 /nfs/dbraw/zinc/82/05/54/487820554.db2.gz NUDZDRFLBCEVOQ-AAEUAGOBSA-N 1 2 245.326 2.218 20 0 BEADLO CC[C@H](NC(=O)Nc1cc(C)[nH+]cc1C)C1CC1 ZINC000666496167 487821677 /nfs/dbraw/zinc/82/16/77/487821677.db2.gz KKOSPQKVPDCTLO-LBPRGKRZSA-N 1 2 247.342 2.430 20 0 BEADLO O=C(C1CCCC1)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000074828227 487822504 /nfs/dbraw/zinc/82/25/04/487822504.db2.gz RUZIPEIJUCTGCA-UHFFFAOYSA-N 1 2 247.342 2.306 20 0 BEADLO CCc1cc(NC[C@H]2CCC(C)(C)O2)nc[nH+]1 ZINC000681675185 487838905 /nfs/dbraw/zinc/83/89/05/487838905.db2.gz YKSOLHXFKXLQIY-LLVKDONJSA-N 1 2 235.331 2.409 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@H+]1CC1(Br)CC1 ZINC000846766475 588286672 /nfs/dbraw/zinc/28/66/72/588286672.db2.gz SPWSDWSSLSOATQ-BDAKNGLRSA-N 1 2 248.164 2.023 20 0 BEADLO C[C@]1(C(F)F)C[N@H+](C/C=C/Cl)CCO1 ZINC000852784552 588702225 /nfs/dbraw/zinc/70/22/25/588702225.db2.gz OFCHCDQXQPUSBL-GKQMSVHHSA-N 1 2 225.666 2.095 20 0 BEADLO C[C@]1(C(F)F)C[N@@H+](C/C=C/Cl)CCO1 ZINC000852784552 588702226 /nfs/dbraw/zinc/70/22/26/588702226.db2.gz OFCHCDQXQPUSBL-GKQMSVHHSA-N 1 2 225.666 2.095 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)[C@H]1CC12CCC2 ZINC000654002462 487846762 /nfs/dbraw/zinc/84/67/62/487846762.db2.gz AWILWDCGZBNFIN-GHMZBOCLSA-N 1 2 247.342 2.270 20 0 BEADLO CCC[C@H]1CCCCN1C(=O)Cn1cc[nH+]c1 ZINC000558437012 322950226 /nfs/dbraw/zinc/95/02/26/322950226.db2.gz PWSQSEXTIQTHRJ-LBPRGKRZSA-N 1 2 235.331 2.064 20 0 BEADLO ClC1=CCC[N@@H+](Cc2ccns2)C1 ZINC000878790005 590622454 /nfs/dbraw/zinc/62/24/54/590622454.db2.gz AGQFLMHYIMOESU-UHFFFAOYSA-N 1 2 214.721 2.472 20 0 BEADLO COc1cncc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)c1 ZINC000676437030 487850953 /nfs/dbraw/zinc/85/09/53/487850953.db2.gz YCQMUQZVYAFQCL-MFKMUULPSA-N 1 2 238.306 2.270 20 0 BEADLO COc1cncc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)c1 ZINC000676437030 487850960 /nfs/dbraw/zinc/85/09/60/487850960.db2.gz YCQMUQZVYAFQCL-MFKMUULPSA-N 1 2 238.306 2.270 20 0 BEADLO COc1cncc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)c1 ZINC000676437028 487851163 /nfs/dbraw/zinc/85/11/63/487851163.db2.gz YCQMUQZVYAFQCL-GWCFXTLKSA-N 1 2 238.306 2.270 20 0 BEADLO COc1cncc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)c1 ZINC000676437028 487851170 /nfs/dbraw/zinc/85/11/70/487851170.db2.gz YCQMUQZVYAFQCL-GWCFXTLKSA-N 1 2 238.306 2.270 20 0 BEADLO CCC(C)(CC)C(=O)N[C@H]1CCn2cc[nH+]c2C1 ZINC000681746481 487851561 /nfs/dbraw/zinc/85/15/61/487851561.db2.gz QDTVWUCLVIPMPD-NSHDSACASA-N 1 2 249.358 2.140 20 0 BEADLO CC1(C)CC(Nc2nc[nH+]c(N)c2Cl)C1 ZINC000395401944 487857462 /nfs/dbraw/zinc/85/74/62/487857462.db2.gz HBIWMTPYFWSPSO-UHFFFAOYSA-N 1 2 226.711 2.313 20 0 BEADLO CC1(C)CC(Nc2[nH+]cnc(N)c2Cl)C1 ZINC000395401944 487857467 /nfs/dbraw/zinc/85/74/67/487857467.db2.gz HBIWMTPYFWSPSO-UHFFFAOYSA-N 1 2 226.711 2.313 20 0 BEADLO CC(=O)NC1C[NH+](Cc2cccc(C(C)C)c2)C1 ZINC000668172103 487861930 /nfs/dbraw/zinc/86/19/30/487861930.db2.gz DMTZELKYERZHEV-UHFFFAOYSA-N 1 2 246.354 2.130 20 0 BEADLO C[C@H]1CN(c2cc[nH+]c(C(C)(C)C)n2)CCC1=O ZINC000681803270 487864316 /nfs/dbraw/zinc/86/43/16/487864316.db2.gz KPBMXLMEYPPDDP-JTQLQIEISA-N 1 2 247.342 2.189 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cncs2)[C@@H](C)CO1 ZINC000651930990 487869695 /nfs/dbraw/zinc/86/96/95/487869695.db2.gz IRMCUMMVBZWEFG-VHSXEESVSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cncs2)[C@@H](C)CO1 ZINC000651930990 487869703 /nfs/dbraw/zinc/86/97/03/487869703.db2.gz IRMCUMMVBZWEFG-VHSXEESVSA-N 1 2 226.345 2.142 20 0 BEADLO Cc1cc(NC(=O)C2CC(F)(F)C2)c(C)c[nH+]1 ZINC000676587718 487877253 /nfs/dbraw/zinc/87/72/53/487877253.db2.gz BCRRSELOSHXSIS-UHFFFAOYSA-N 1 2 240.253 2.104 20 0 BEADLO Cc1cc(C(=O)Nc2cc(C)[nH+]cc2C)c(C)[nH]1 ZINC000676623423 487879638 /nfs/dbraw/zinc/87/96/38/487879638.db2.gz XILRLFVNEQUMKJ-UHFFFAOYSA-N 1 2 243.310 2.318 20 0 BEADLO C[C@@H](CNC(=O)[C@H]1CCC1(C)C)Cn1cc[nH+]c1 ZINC000669018888 487879802 /nfs/dbraw/zinc/87/98/02/487879802.db2.gz QVMLCYURILVESS-NWDGAFQWSA-N 1 2 249.358 2.072 20 0 BEADLO CC(C)C(C)(C)NC(=O)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000652764816 487907246 /nfs/dbraw/zinc/90/72/46/487907246.db2.gz QBFSQMQUHXONEV-JTQLQIEISA-N 1 2 249.358 2.380 20 0 BEADLO CC(C)C(C)(C)NC(=O)[C@H]1CCCc2[nH]c[nH+]c21 ZINC000652764816 487907250 /nfs/dbraw/zinc/90/72/50/487907250.db2.gz QBFSQMQUHXONEV-JTQLQIEISA-N 1 2 249.358 2.380 20 0 BEADLO COCc1cc[nH+]c(N[C@H](C)[C@@H]2CCCO2)c1 ZINC000652331184 487920743 /nfs/dbraw/zinc/92/07/43/487920743.db2.gz ZXUCJOKVWVUKSE-PWSUYJOCSA-N 1 2 236.315 2.207 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2ccsc2)nn1 ZINC000669927369 487928553 /nfs/dbraw/zinc/92/85/53/487928553.db2.gz IGOJZTNDAXMVLI-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2ccsc2)nn1 ZINC000669927369 487928559 /nfs/dbraw/zinc/92/85/59/487928559.db2.gz IGOJZTNDAXMVLI-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO Fc1ccc(C[N@@H+]2CCc3c[nH]nc3C2)cc1 ZINC000676791865 487929365 /nfs/dbraw/zinc/92/93/65/487929365.db2.gz ATFOBLKNAKMFTC-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO Fc1ccc(C[N@H+]2CCc3c[nH]nc3C2)cc1 ZINC000676791865 487929367 /nfs/dbraw/zinc/92/93/67/487929367.db2.gz ATFOBLKNAKMFTC-UHFFFAOYSA-N 1 2 231.274 2.107 20 0 BEADLO CCc1cc(NCCc2cccc(C)[nH+]2)ncn1 ZINC000684590063 487943651 /nfs/dbraw/zinc/94/36/51/487943651.db2.gz IHKBENBCBZMANN-UHFFFAOYSA-N 1 2 242.326 2.397 20 0 BEADLO CC[C@@H](C)[C@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000667142231 487946153 /nfs/dbraw/zinc/94/61/53/487946153.db2.gz OWGPJLORJPOPIA-WRWGMCAJSA-N 1 2 249.358 2.074 20 0 BEADLO Cc1cc(N[C@@H](C)C[C@@H](C)O)nc(C2CC2)[nH+]1 ZINC000679934101 487945612 /nfs/dbraw/zinc/94/56/12/487945612.db2.gz YDMPIJPPMBPTHU-WCBMZHEXSA-N 1 2 235.331 2.234 20 0 BEADLO CO[C@@H](C)C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000049276080 487945795 /nfs/dbraw/zinc/94/57/95/487945795.db2.gz IQHNXVLKGWMLKW-VIFPVBQESA-N 1 2 245.282 2.050 20 0 BEADLO CC[C@H]1CCN(C(=O)C[C@@H](C)n2cc[nH+]c2)C1 ZINC000564662389 322976666 /nfs/dbraw/zinc/97/66/66/322976666.db2.gz YTBMSQZYDKWLKF-NEPJUHHUSA-N 1 2 235.331 2.093 20 0 BEADLO CC[C@@H](C)CCC(=O)N1CC(n2cc[nH+]c2)C1 ZINC000560501170 322988701 /nfs/dbraw/zinc/98/87/01/322988701.db2.gz MFBMJTNILFQJKM-LLVKDONJSA-N 1 2 235.331 2.093 20 0 BEADLO CCn1c(CNc2c[nH]c[nH+]2)nc2ccccc21 ZINC000561411826 323001266 /nfs/dbraw/zinc/00/12/66/323001266.db2.gz QSWDZYJNFUUARK-UHFFFAOYSA-N 1 2 241.298 2.391 20 0 BEADLO CC(C)n1cc([C@@H](C)[NH2+]Cc2cocn2)cn1 ZINC000561851120 323007759 /nfs/dbraw/zinc/00/77/59/323007759.db2.gz WFDFMMFLCTXYMS-SNVBAGLBSA-N 1 2 234.303 2.303 20 0 BEADLO CCC1(CC)CCN(C(=O)Cn2cc[nH+]c2)CC1 ZINC000562280010 323014671 /nfs/dbraw/zinc/01/46/71/323014671.db2.gz ZBRWUQNHDUNOKG-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO Cn1ncc2c1nc[nH+]c2NCCC1(F)CCC1 ZINC000562292704 323015179 /nfs/dbraw/zinc/01/51/79/323015179.db2.gz NFFDXVZBIOKPLY-UHFFFAOYSA-N 1 2 249.293 2.058 20 0 BEADLO C[C@H](c1csnn1)[NH+]1C[C@@H](C)S[C@H](C)C1 ZINC000562533383 323023146 /nfs/dbraw/zinc/02/31/46/323023146.db2.gz PSNKLLICJBYGDS-IWSPIJDZSA-N 1 2 243.401 2.425 20 0 BEADLO CC(C)[C@H](C)C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000565107867 323023293 /nfs/dbraw/zinc/02/32/93/323023293.db2.gz XMUHUXBAHJRPSP-VIFPVBQESA-N 1 2 223.320 2.053 20 0 BEADLO CC(C)[N@H+](CCOCC1CC1)CC(F)F ZINC000135404289 323028909 /nfs/dbraw/zinc/02/89/09/323028909.db2.gz HLPFPUDNZVQDSN-UHFFFAOYSA-N 1 2 221.291 2.389 20 0 BEADLO CC(C)[N@@H+](CCOCC1CC1)CC(F)F ZINC000135404289 323028910 /nfs/dbraw/zinc/02/89/10/323028910.db2.gz HLPFPUDNZVQDSN-UHFFFAOYSA-N 1 2 221.291 2.389 20 0 BEADLO C[C@@H]1C[C@H](NCC(C)(F)F)c2[nH+]ccn21 ZINC000562794102 323030903 /nfs/dbraw/zinc/03/09/03/323030903.db2.gz BMYNCUAVSGWGJN-SFYZADRCSA-N 1 2 215.247 2.134 20 0 BEADLO COc1cccc2c1CC[C@@H](Nc1c[nH]c[nH+]1)C2 ZINC000562913252 323033294 /nfs/dbraw/zinc/03/32/94/323033294.db2.gz HHNJTHGBXGCNTA-LLVKDONJSA-N 1 2 243.310 2.388 20 0 BEADLO CC1(C)CCC[C@H](CNC(=O)Cn2cc[nH+]c2)C1 ZINC000572957840 323036014 /nfs/dbraw/zinc/03/60/14/323036014.db2.gz CRQWKCPWDPBEPB-LBPRGKRZSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NC[C@@H]1CC=CCC1 ZINC000572973377 323037755 /nfs/dbraw/zinc/03/77/55/323037755.db2.gz VVMZNYUQQUKTEE-NWDGAFQWSA-N 1 2 247.342 2.061 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NC[C@@H]1CC=CCC1 ZINC000572973377 323037756 /nfs/dbraw/zinc/03/77/56/323037756.db2.gz VVMZNYUQQUKTEE-NWDGAFQWSA-N 1 2 247.342 2.061 20 0 BEADLO CCOC[C@H]1CCCN(c2nc(C)[nH+]cc2C)C1 ZINC000570107393 323050310 /nfs/dbraw/zinc/05/03/10/323050310.db2.gz VAUULENYZIICBQ-ZDUSSCGKSA-N 1 2 249.358 2.346 20 0 BEADLO C[C@@H](CC(=O)N1C[C@@H](C)[C@@H](C)[C@H]1C)n1cc[nH+]c1 ZINC000573005367 323052589 /nfs/dbraw/zinc/05/25/89/323052589.db2.gz NABPLNVNGHMWIZ-YVECIDJPSA-N 1 2 249.358 2.337 20 0 BEADLO CCC[N@@H+]1CC(=O)N[C@H]1[C@@H]1CCCC(C)(C)C1 ZINC000570301090 323055716 /nfs/dbraw/zinc/05/57/16/323055716.db2.gz ZKBGQDKLKSBXIA-DGCLKSJQSA-N 1 2 238.375 2.371 20 0 BEADLO CCC[N@H+]1CC(=O)N[C@H]1[C@@H]1CCCC(C)(C)C1 ZINC000570301090 323055717 /nfs/dbraw/zinc/05/57/17/323055717.db2.gz ZKBGQDKLKSBXIA-DGCLKSJQSA-N 1 2 238.375 2.371 20 0 BEADLO CCc1occc1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000570338245 323056877 /nfs/dbraw/zinc/05/68/77/323056877.db2.gz PGGLXGYTIRAUCZ-UHFFFAOYSA-N 1 2 247.298 2.230 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CC[C@@H](C)C1)c1[nH]cc[nH+]1 ZINC000570409662 323058705 /nfs/dbraw/zinc/05/87/05/323058705.db2.gz CJHMATYIJNCDHX-BBBLOLIVSA-N 1 2 221.304 2.023 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@]1(C)CC=CCC1 ZINC000570460351 323060510 /nfs/dbraw/zinc/06/05/10/323060510.db2.gz SEHBLGVHILZSQL-FZMZJTMJSA-N 1 2 247.342 2.203 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@]1(C)CC=CCC1 ZINC000570460351 323060511 /nfs/dbraw/zinc/06/05/11/323060511.db2.gz SEHBLGVHILZSQL-FZMZJTMJSA-N 1 2 247.342 2.203 20 0 BEADLO CC(C)[C@@H]1CN(C(=O)Cn2cc[nH+]c2)[C@H]1C(C)C ZINC000570533426 323062377 /nfs/dbraw/zinc/06/23/77/323062377.db2.gz OWGOPCBJHDJZSX-JSGCOSHPSA-N 1 2 249.358 2.022 20 0 BEADLO c1cc(C[NH2+][C@@H](c2cccnc2)C2CCC2)[nH]n1 ZINC000570566001 323062986 /nfs/dbraw/zinc/06/29/86/323062986.db2.gz XODCOISSSMXWOV-CQSZACIVSA-N 1 2 242.326 2.436 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000570693281 323067418 /nfs/dbraw/zinc/06/74/18/323067418.db2.gz BKRNPYGVRXIFSU-AXFHLTTASA-N 1 2 237.347 2.139 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000570693281 323067419 /nfs/dbraw/zinc/06/74/19/323067419.db2.gz BKRNPYGVRXIFSU-AXFHLTTASA-N 1 2 237.347 2.139 20 0 BEADLO CCCCc1nc(C[N@H+](C)CC2CC2)no1 ZINC000053611023 323077301 /nfs/dbraw/zinc/07/73/01/323077301.db2.gz SASYWQSYFUGUIM-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO CCCCc1nc(C[N@@H+](C)CC2CC2)no1 ZINC000053611023 323077302 /nfs/dbraw/zinc/07/73/02/323077302.db2.gz SASYWQSYFUGUIM-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H]2CC23CC3)[nH+]1 ZINC000563019763 323080086 /nfs/dbraw/zinc/08/00/86/323080086.db2.gz QJRVEPHVHZIJBZ-SECBINFHSA-N 1 2 214.272 2.231 20 0 BEADLO Cc1nc(N[C@@H]2CO[C@@H](C)C2)c2c([nH+]1)CCCC2 ZINC000563053029 323082947 /nfs/dbraw/zinc/08/29/47/323082947.db2.gz UGKAYNGMYSXSCK-ONGXEEELSA-N 1 2 247.342 2.253 20 0 BEADLO CCOC(=O)C[N@H+](C)C[C@@H]1CCCCC1(F)F ZINC000394677833 323090545 /nfs/dbraw/zinc/09/05/45/323090545.db2.gz WVPHUJVOECYLKL-JTQLQIEISA-N 1 2 249.301 2.307 20 0 BEADLO CCOC(=O)C[N@@H+](C)C[C@@H]1CCCCC1(F)F ZINC000394677833 323090546 /nfs/dbraw/zinc/09/05/46/323090546.db2.gz WVPHUJVOECYLKL-JTQLQIEISA-N 1 2 249.301 2.307 20 0 BEADLO CCC[C@H]([NH2+][C@H]1CS[C@H](C)C1)C(=O)OCC ZINC000397941783 323103457 /nfs/dbraw/zinc/10/34/57/323103457.db2.gz QMRKQSIRMDUPQF-MXWKQRLJSA-N 1 2 245.388 2.202 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)c2ccccc2)[nH+]1 ZINC000563286219 323108629 /nfs/dbraw/zinc/10/86/29/323108629.db2.gz NLBDYULWOGOMLD-UHFFFAOYSA-N 1 2 243.310 2.383 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2C=CCCC2)c(C)c[nH+]1 ZINC000534323993 323116436 /nfs/dbraw/zinc/11/64/36/323116436.db2.gz DBZCQZMXAGJHRR-GFCCVEGCSA-N 1 2 245.326 2.351 20 0 BEADLO Cc1cc(NC(=O)NC(C)(C)C2CC2)c(C)c[nH+]1 ZINC000534323695 323116531 /nfs/dbraw/zinc/11/65/31/323116531.db2.gz AMSUBZWAMXVXGT-UHFFFAOYSA-N 1 2 247.342 2.430 20 0 BEADLO Cc1cc(NC(=O)N2C[C@H](C)C[C@H]2C)c(C)c[nH+]1 ZINC000534324422 323116575 /nfs/dbraw/zinc/11/65/75/323116575.db2.gz VDKQCWXBEVNEIP-BXKDBHETSA-N 1 2 247.342 2.383 20 0 BEADLO Cc1cc(NC(=O)N2C[C@@H](C)C[C@H]2C)c(C)c[nH+]1 ZINC000534324425 323116674 /nfs/dbraw/zinc/11/66/74/323116674.db2.gz VDKQCWXBEVNEIP-JOYOIKCWSA-N 1 2 247.342 2.383 20 0 BEADLO CCCN(CC)C(=O)Nc1cc(C)[nH+]cc1C ZINC000534324392 323116689 /nfs/dbraw/zinc/11/66/89/323116689.db2.gz UYTLMDABWVJDCW-UHFFFAOYSA-N 1 2 235.331 2.384 20 0 BEADLO Cc1nsc(C)c1C[N@H+]1CCO[C@H](C)[C@@H]1C ZINC000563350752 323120101 /nfs/dbraw/zinc/12/01/01/323120101.db2.gz QHGCUBJGCVOMIR-VHSXEESVSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nsc(C)c1C[N@@H+]1CCO[C@H](C)[C@@H]1C ZINC000563350752 323120102 /nfs/dbraw/zinc/12/01/02/323120102.db2.gz QHGCUBJGCVOMIR-VHSXEESVSA-N 1 2 240.372 2.369 20 0 BEADLO CCC[C@H](C(=O)N1CC(n2cc[nH+]c2)C1)C(C)C ZINC000535005658 323162727 /nfs/dbraw/zinc/16/27/27/323162727.db2.gz QRPRNSPIHVNBIK-ZDUSSCGKSA-N 1 2 249.358 2.339 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CC=CCC2)c(C)c[nH+]1 ZINC000535035953 323164156 /nfs/dbraw/zinc/16/41/56/323164156.db2.gz JWKJAKDEEUPIRS-GFCCVEGCSA-N 1 2 230.311 2.415 20 0 BEADLO CCCSCC(=O)Nc1cc(C)[nH+]cc1C ZINC000535036412 323164289 /nfs/dbraw/zinc/16/42/89/323164289.db2.gz SNKWDUOLCWFDEV-UHFFFAOYSA-N 1 2 238.356 2.202 20 0 BEADLO Cc1[nH]c(C(=O)NCC23CCC(CC2)C3)c[nH+]1 ZINC000535307856 323170415 /nfs/dbraw/zinc/17/04/15/323170415.db2.gz QMLLSLIYMHVBOQ-UHFFFAOYSA-N 1 2 233.315 2.028 20 0 BEADLO c1cn(Cc2ccn(-c3ccccc3)n2)c[nH+]1 ZINC000070165725 323170519 /nfs/dbraw/zinc/17/05/19/323170519.db2.gz ZZGIQECODFEGCH-UHFFFAOYSA-N 1 2 224.267 2.117 20 0 BEADLO Clc1cnc(CNc2c[nH]c[nH+]2)s1 ZINC000307371920 323178705 /nfs/dbraw/zinc/17/87/05/323178705.db2.gz QMJDDSQLQJVIJO-UHFFFAOYSA-N 1 2 214.681 2.132 20 0 BEADLO Cc1cc(NC(=O)CSC(C)C)c(C)c[nH+]1 ZINC000535748581 323190227 /nfs/dbraw/zinc/19/02/27/323190227.db2.gz LYRQXCOJTZBQPU-UHFFFAOYSA-N 1 2 238.356 2.200 20 0 BEADLO Cc1cc(NC(=O)C(C)(C)C)c(C)c[nH+]1 ZINC000535749193 323190377 /nfs/dbraw/zinc/19/03/77/323190377.db2.gz REABZQNWBCSDEG-UHFFFAOYSA-N 1 2 206.289 2.105 20 0 BEADLO Cc1cc(NC(=O)N(C)CC2CCC2)c(C)c[nH+]1 ZINC000535773673 323190909 /nfs/dbraw/zinc/19/09/09/323190909.db2.gz NXETYFBGHRNUQT-UHFFFAOYSA-N 1 2 247.342 2.384 20 0 BEADLO c1cc(C[NH2+][C@H](c2cccnc2)C2CC2)[nH]n1 ZINC000536163922 323196234 /nfs/dbraw/zinc/19/62/34/323196234.db2.gz SJWJXHUJCMZLOT-ZDUSSCGKSA-N 1 2 228.299 2.046 20 0 BEADLO C[C@@H]1CC[C@@H](CC(=O)N2CC(n3cc[nH+]c3)C2)C1 ZINC000532092073 323201183 /nfs/dbraw/zinc/20/11/83/323201183.db2.gz DKQYNMQJIGCWEK-VXGBXAGGSA-N 1 2 247.342 2.093 20 0 BEADLO CCc1cnc(C[N@H+](C)CCOCC2CC2)o1 ZINC000532293311 323214144 /nfs/dbraw/zinc/21/41/44/323214144.db2.gz HKYWSJTXPOCXBW-UHFFFAOYSA-N 1 2 238.331 2.095 20 0 BEADLO CCc1cnc(C[N@@H+](C)CCOCC2CC2)o1 ZINC000532293311 323214146 /nfs/dbraw/zinc/21/41/46/323214146.db2.gz HKYWSJTXPOCXBW-UHFFFAOYSA-N 1 2 238.331 2.095 20 0 BEADLO Cc1cnc(CN[C@@H](C)c2[nH]cc[nH+]2)s1 ZINC000309124118 323318256 /nfs/dbraw/zinc/31/82/56/323318256.db2.gz OVQNQMMBWGNKGF-QMMMGPOBSA-N 1 2 222.317 2.025 20 0 BEADLO CCc1nc(C[N@H+](C)[C@H](C)C(C)(C)C)no1 ZINC000532928573 323396975 /nfs/dbraw/zinc/39/69/75/323396975.db2.gz QWWLKDHQBZCBRZ-SECBINFHSA-N 1 2 225.336 2.498 20 0 BEADLO CCc1nc(C[N@@H+](C)[C@H](C)C(C)(C)C)no1 ZINC000532928573 323396978 /nfs/dbraw/zinc/39/69/78/323396978.db2.gz QWWLKDHQBZCBRZ-SECBINFHSA-N 1 2 225.336 2.498 20 0 BEADLO CC[C@H]([NH2+]CC(C)(C)C(F)(F)F)C(=O)OC ZINC000309622982 323436791 /nfs/dbraw/zinc/43/67/91/323436791.db2.gz DZLAJHOHSLATII-ZETCQYMHSA-N 1 2 241.253 2.116 20 0 BEADLO Cn1cc(Cl)c(C[NH+]2C3CCC2CC3)n1 ZINC000571786459 323480489 /nfs/dbraw/zinc/48/04/89/323480489.db2.gz GCXMLHSTVDDMIL-UHFFFAOYSA-N 1 2 225.723 2.200 20 0 BEADLO OC[C@@]1(F)CCN(c2[nH+]ccc3ccccc32)C1 ZINC000528010732 323749341 /nfs/dbraw/zinc/74/93/41/323749341.db2.gz RFCKKPRAYZBLGK-CQSZACIVSA-N 1 2 246.285 2.146 20 0 BEADLO O[C@@H]1C[C@@H]2CN(c3[nH+]ccc4ccccc43)C[C@H]12 ZINC000528057381 323754232 /nfs/dbraw/zinc/75/42/32/323754232.db2.gz HFZDWJZDFPUIPP-KWCYVHTRSA-N 1 2 240.306 2.052 20 0 BEADLO Cc1cc(N[C@@H]2[C@H](C)O[C@H](C)[C@H]2C)nc[nH+]1 ZINC000528203646 323779456 /nfs/dbraw/zinc/77/94/56/323779456.db2.gz DMLUEEGUTSUEKP-SVDPJWKOSA-N 1 2 221.304 2.009 20 0 BEADLO CC(C)(CNc1cccc[nH+]1)C(=O)N1CCCC1 ZINC000528220227 323782792 /nfs/dbraw/zinc/78/27/92/323782792.db2.gz TXPTUHTWUHJNSL-UHFFFAOYSA-N 1 2 247.342 2.142 20 0 BEADLO O=C(/C=C/C1CCCCC1)NCCn1cc[nH+]c1 ZINC000117577231 323897257 /nfs/dbraw/zinc/89/72/57/323897257.db2.gz BYHQQPGXJLGXJY-VOTSOKGWSA-N 1 2 247.342 2.136 20 0 BEADLO CCNC(=O)/C=C/c1ccc(-n2cc[nH+]c2)cc1 ZINC000060520542 324041995 /nfs/dbraw/zinc/04/19/95/324041995.db2.gz ZPZRSCOXMLCEIT-VMPITWQZSA-N 1 2 241.294 2.022 20 0 BEADLO CCCCn1nnnc1C[N@@H+]1CCC(C)=C(C)C1 ZINC000514767943 324111806 /nfs/dbraw/zinc/11/18/06/324111806.db2.gz SRDNDHHUTCNGLW-UHFFFAOYSA-N 1 2 249.362 2.015 20 0 BEADLO CCCCn1nnnc1C[N@H+]1CCC(C)=C(C)C1 ZINC000514767943 324111811 /nfs/dbraw/zinc/11/18/11/324111811.db2.gz SRDNDHHUTCNGLW-UHFFFAOYSA-N 1 2 249.362 2.015 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)/C=C\c1[nH+]ccn1CC ZINC000492452896 324163603 /nfs/dbraw/zinc/16/36/03/324163603.db2.gz FIEZGRJPKZRZBY-XPOJSHTGSA-N 1 2 249.358 2.467 20 0 BEADLO CC[C@H](C)[C@@H](C)NC(=O)/C=C/c1[nH+]ccn1CC ZINC000492452893 324163799 /nfs/dbraw/zinc/16/37/99/324163799.db2.gz FIEZGRJPKZRZBY-ADYIUWEDSA-N 1 2 249.358 2.467 20 0 BEADLO Cc1cocc1C(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000529457832 324304765 /nfs/dbraw/zinc/30/47/65/324304765.db2.gz MDAXUQMJPODNEP-ONGXEEELSA-N 1 2 245.282 2.220 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)c1cocc1C ZINC000529457991 324305081 /nfs/dbraw/zinc/30/50/81/324305081.db2.gz MYYIKORVYNEUDO-JTQLQIEISA-N 1 2 247.298 2.295 20 0 BEADLO O[C@@H]1CC[N@H+](Cc2c(F)ccc(F)c2Cl)C1 ZINC000529519767 324322260 /nfs/dbraw/zinc/32/22/60/324322260.db2.gz GSMWYNQPJRXSDR-SSDOTTSWSA-N 1 2 247.672 2.185 20 0 BEADLO O[C@@H]1CC[N@@H+](Cc2c(F)ccc(F)c2Cl)C1 ZINC000529519767 324322267 /nfs/dbraw/zinc/32/22/67/324322267.db2.gz GSMWYNQPJRXSDR-SSDOTTSWSA-N 1 2 247.672 2.185 20 0 BEADLO C[C@@H](CC(=O)N(C)Cc1c[nH+]c[nH]1)c1ccco1 ZINC000529523040 324323128 /nfs/dbraw/zinc/32/31/28/324323128.db2.gz WLDPQPVLIVVRFL-JTQLQIEISA-N 1 2 247.298 2.155 20 0 BEADLO C[C@@H](CC(=O)N(C)Cc1c[nH]c[nH+]1)c1ccco1 ZINC000529523040 324323129 /nfs/dbraw/zinc/32/31/29/324323129.db2.gz WLDPQPVLIVVRFL-JTQLQIEISA-N 1 2 247.298 2.155 20 0 BEADLO Cc1cnc(C[NH2+]Cc2ccc(F)cn2)s1 ZINC000529550754 324338119 /nfs/dbraw/zinc/33/81/19/324338119.db2.gz PZTSHLFKLSOVDQ-UHFFFAOYSA-N 1 2 237.303 2.275 20 0 BEADLO c1coc(CC2C[NH+](Cc3cscn3)C2)c1 ZINC000529648387 324371647 /nfs/dbraw/zinc/37/16/47/324371647.db2.gz BBKNQGXCKXEHHP-UHFFFAOYSA-N 1 2 234.324 2.411 20 0 BEADLO CNc1[nH+]cnc2c1cnn2C/C=C(/C)Cl ZINC000530162043 324498618 /nfs/dbraw/zinc/49/86/18/324498618.db2.gz DZIPCGKCWYRJNV-CLTKARDFSA-N 1 2 237.694 2.011 20 0 BEADLO Cc1ccc(C[NH2+]Cc2ncccc2F)o1 ZINC000125778543 324653630 /nfs/dbraw/zinc/65/36/30/324653630.db2.gz PASBYVBGPONKMK-UHFFFAOYSA-N 1 2 220.247 2.412 20 0 BEADLO Fc1c(Cl)cccc1C[NH2+]Cc1cc[nH]n1 ZINC000127151397 324749634 /nfs/dbraw/zinc/74/96/34/324749634.db2.gz XTCZIZAERVJZKT-UHFFFAOYSA-N 1 2 239.681 2.492 20 0 BEADLO CC1(C)CC[C@@H](C(=O)N2CC(n3cc[nH+]c3)C2)C1 ZINC000541043542 324944081 /nfs/dbraw/zinc/94/40/81/324944081.db2.gz UENIVLAUTNWRHN-LLVKDONJSA-N 1 2 247.342 2.093 20 0 BEADLO CC(C)n1cc([C@@H](C)[NH2+]Cc2ccon2)cn1 ZINC000541646070 324970283 /nfs/dbraw/zinc/97/02/83/324970283.db2.gz VLONKNAPAIDDKT-SNVBAGLBSA-N 1 2 234.303 2.303 20 0 BEADLO Cc1noc(C[NH2+][C@@H](C)c2cnn(C(C)C)c2)n1 ZINC000542574812 325035491 /nfs/dbraw/zinc/03/54/91/325035491.db2.gz WLZTVSGZXWPOBT-VIFPVBQESA-N 1 2 249.318 2.006 20 0 BEADLO Cc1ccc(/C=C/C(=O)NCc2[nH]cc[nH+]2)cc1 ZINC000070990556 325048915 /nfs/dbraw/zinc/04/89/15/325048915.db2.gz ZXYBWPPIACMQTN-VOTSOKGWSA-N 1 2 241.294 2.048 20 0 BEADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2nccn2C)o1 ZINC000071138766 325057105 /nfs/dbraw/zinc/05/71/05/325057105.db2.gz IYVGEPYNFOYWFG-PWSUYJOCSA-N 1 2 245.326 2.426 20 0 BEADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2nccn2C)o1 ZINC000071138768 325057378 /nfs/dbraw/zinc/05/73/78/325057378.db2.gz IYVGEPYNFOYWFG-ZYHUDNBSSA-N 1 2 245.326 2.426 20 0 BEADLO Cc1cc(Cl)cc(C(=O)NCc2[nH]cc[nH+]2)c1 ZINC000130504834 325058813 /nfs/dbraw/zinc/05/88/13/325058813.db2.gz ZHPCNRPGHMEOPA-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO Cc1ccccc1[C@H](C)[NH+]1CCS(=O)CC1 ZINC000131033308 325109778 /nfs/dbraw/zinc/10/97/78/325109778.db2.gz KDYOBWHAPFYYRI-LBPRGKRZSA-N 1 2 237.368 2.120 20 0 BEADLO c1cc(C[N@@H+]2CCc3ccsc3C2)no1 ZINC000132635794 325231536 /nfs/dbraw/zinc/23/15/36/325231536.db2.gz WIEFAGMPTAVIFU-UHFFFAOYSA-N 1 2 220.297 2.294 20 0 BEADLO c1cc(C[N@H+]2CCc3ccsc3C2)no1 ZINC000132635794 325231539 /nfs/dbraw/zinc/23/15/39/325231539.db2.gz WIEFAGMPTAVIFU-UHFFFAOYSA-N 1 2 220.297 2.294 20 0 BEADLO Cc1cc(C[NH2+]Cc2cn(C(C)C)nc2C)no1 ZINC000546626505 325295193 /nfs/dbraw/zinc/29/51/93/325295193.db2.gz YJDWFEAJECTLDL-UHFFFAOYSA-N 1 2 248.330 2.359 20 0 BEADLO COc1ccc[nH+]c1N[C@@H](C)CCn1cccn1 ZINC000546716128 325304449 /nfs/dbraw/zinc/30/44/49/325304449.db2.gz IWHSHXQGXPVQQT-NSHDSACASA-N 1 2 246.314 2.177 20 0 BEADLO Cn1ncc2c1nc[nH+]c2NCC1CC(C)(C)C1 ZINC000547700446 325384482 /nfs/dbraw/zinc/38/44/82/325384482.db2.gz DSDZDWANVBQIPW-UHFFFAOYSA-N 1 2 245.330 2.211 20 0 BEADLO CCCC[C@@H]([NH2+]C[C@@H]1CCCS1)C(=O)OC ZINC000135245212 325402558 /nfs/dbraw/zinc/40/25/58/325402558.db2.gz QLGKNYREAKVHRI-WDEREUQCSA-N 1 2 245.388 2.203 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)N(C)C(C)C ZINC000548008172 325420776 /nfs/dbraw/zinc/42/07/76/325420776.db2.gz UZSFFNSLHNQFNE-SNVBAGLBSA-N 1 2 238.335 2.014 20 0 BEADLO C[C@@H]([NH2+]Cc1ncnn1C(C)(C)C)c1ccoc1 ZINC000548805901 325485604 /nfs/dbraw/zinc/48/56/04/325485604.db2.gz UDXCEUJAOOVPRY-SNVBAGLBSA-N 1 2 248.330 2.477 20 0 BEADLO C[C@H]([NH2+]Cc1ncnn1C(C)(C)C)c1ccoc1 ZINC000548805900 325485721 /nfs/dbraw/zinc/48/57/21/325485721.db2.gz UDXCEUJAOOVPRY-JTQLQIEISA-N 1 2 248.330 2.477 20 0 BEADLO Nc1nc(N[C@@H]2CCC[C@@H]2F)[nH+]c2ccccc12 ZINC000549297835 325499616 /nfs/dbraw/zinc/49/96/16/325499616.db2.gz YOSMAJFHNCOANO-GXSJLCMTSA-N 1 2 246.289 2.345 20 0 BEADLO Cc1ccc(NC(=O)C[C@@H](C)n2cc[nH+]c2)nc1 ZINC000551771488 325568382 /nfs/dbraw/zinc/56/83/82/325568382.db2.gz VSTDVRYRVZVLRK-LLVKDONJSA-N 1 2 244.298 2.176 20 0 BEADLO C[C@@H]([NH2+]Cc1cc[nH]n1)c1nc2c(s1)CCC2 ZINC000551933445 325575089 /nfs/dbraw/zinc/57/50/89/325575089.db2.gz URNJSCKASOAORG-MRVPVSSYSA-N 1 2 248.355 2.206 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2CCC2(C)C)c(C)c[nH+]1 ZINC000554298243 325712707 /nfs/dbraw/zinc/71/27/07/325712707.db2.gz UVGGHNMMOWHKJO-LBPRGKRZSA-N 1 2 247.342 2.430 20 0 BEADLO CC[C@H]1CCCC[C@@H]1NC(=O)Cc1c[nH+]cn1C ZINC000554501151 325722572 /nfs/dbraw/zinc/72/25/72/325722572.db2.gz IPOVUQVFRKQMQL-AAEUAGOBSA-N 1 2 249.358 2.048 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2ncccc2F)nn1C ZINC000564784420 325809028 /nfs/dbraw/zinc/80/90/28/325809028.db2.gz FIELUAGEVLTGHB-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO CCOc1cc(C)ccc1C[NH2+]Cc1ncc[nH]1 ZINC000153390162 325953618 /nfs/dbraw/zinc/95/36/18/325953618.db2.gz QZBZIGZVVFBZNW-UHFFFAOYSA-N 1 2 245.326 2.407 20 0 BEADLO C[C@H](CC(=O)N1C[C@H](C)C[C@H]1C)n1cc[nH+]c1 ZINC000566328553 326033984 /nfs/dbraw/zinc/03/39/84/326033984.db2.gz PQLGFVSZUQMQIT-IJLUTSLNSA-N 1 2 235.331 2.091 20 0 BEADLO Cc1[nH]nc2ncc(C[N@@H+]3CCC[C@@H](F)C3)cc12 ZINC000566352899 326036258 /nfs/dbraw/zinc/03/62/58/326036258.db2.gz AWVFJJYQPYHMFH-LLVKDONJSA-N 1 2 248.305 2.200 20 0 BEADLO Cc1[nH]nc2ncc(C[N@H+]3CCC[C@@H](F)C3)cc12 ZINC000566352899 326036259 /nfs/dbraw/zinc/03/62/59/326036259.db2.gz AWVFJJYQPYHMFH-LLVKDONJSA-N 1 2 248.305 2.200 20 0 BEADLO COc1cc(C[N@@H+]2CCC(=O)[C@H](C)C2)ccc1C ZINC000566415710 326042149 /nfs/dbraw/zinc/04/21/49/326042149.db2.gz INEKAWNUXCSLTF-GFCCVEGCSA-N 1 2 247.338 2.415 20 0 BEADLO COc1cc(C[N@H+]2CCC(=O)[C@H](C)C2)ccc1C ZINC000566415710 326042150 /nfs/dbraw/zinc/04/21/50/326042150.db2.gz INEKAWNUXCSLTF-GFCCVEGCSA-N 1 2 247.338 2.415 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1CCOC(C)(C)C1 ZINC000566485628 326057059 /nfs/dbraw/zinc/05/70/59/326057059.db2.gz PEVXYPLPCAUGDP-NSHDSACASA-N 1 2 235.331 2.463 20 0 BEADLO C=Cn1cc(C[NH2+][C@H](C)c2cscn2)cn1 ZINC000566500668 326059625 /nfs/dbraw/zinc/05/96/25/326059625.db2.gz LAPRVBRAVRQYBR-SECBINFHSA-N 1 2 234.328 2.291 20 0 BEADLO CC(C)[C@H]1CCCN1C(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000567059673 326108941 /nfs/dbraw/zinc/10/89/41/326108941.db2.gz DKQGJBYKBVECKR-DGCLKSJQSA-N 1 2 249.358 2.235 20 0 BEADLO CC(C)[C@H]1CCCN1C(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000567059673 326108944 /nfs/dbraw/zinc/10/89/44/326108944.db2.gz DKQGJBYKBVECKR-DGCLKSJQSA-N 1 2 249.358 2.235 20 0 BEADLO CC[C@H](NCc1[nH+]ccn1CC)C(F)F ZINC000567120253 326119570 /nfs/dbraw/zinc/11/95/70/326119570.db2.gz SBKDKUJDVDKCGG-QMMMGPOBSA-N 1 2 217.263 2.036 20 0 BEADLO CC(C)c1nc(N(C)CCOCC2CC2)cc[nH+]1 ZINC000154078280 326129625 /nfs/dbraw/zinc/12/96/25/326129625.db2.gz ZPMVUHCAWJNMEF-UHFFFAOYSA-N 1 2 249.358 2.463 20 0 BEADLO CC[C@@H]1CCCN(C(=O)Cc2c[nH+]cn2C)CC1 ZINC000567368760 326176316 /nfs/dbraw/zinc/17/63/16/326176316.db2.gz FTTGZDWAOUXJDN-GFCCVEGCSA-N 1 2 249.358 2.001 20 0 BEADLO CC(C)Cc1ncc(C[NH+]2CCOCC2)s1 ZINC000156386821 326230478 /nfs/dbraw/zinc/23/04/78/326230478.db2.gz GDJHOWPNLKVEJM-UHFFFAOYSA-N 1 2 240.372 2.174 20 0 BEADLO CC(F)(F)C[NH2+]Cc1cccc2c1OCCO2 ZINC000567760939 326255755 /nfs/dbraw/zinc/25/57/55/326255755.db2.gz OOSDOVQQFCXZDQ-UHFFFAOYSA-N 1 2 243.253 2.203 20 0 BEADLO CC1(C)CC[C@H]1NC(=O)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000567772359 326256910 /nfs/dbraw/zinc/25/69/10/326256910.db2.gz AHGHFVGQTGHJES-GXSJLCMTSA-N 1 2 247.342 2.134 20 0 BEADLO CC1(C)CC[C@H]1NC(=O)[C@H]1CCCc2[nH]c[nH+]c21 ZINC000567772359 326256912 /nfs/dbraw/zinc/25/69/12/326256912.db2.gz AHGHFVGQTGHJES-GXSJLCMTSA-N 1 2 247.342 2.134 20 0 BEADLO COC1C[NH+](Cc2ccc(C)cc2Cl)C1 ZINC000568033568 326298236 /nfs/dbraw/zinc/29/82/36/326298236.db2.gz RBANVUNIJLEINL-UHFFFAOYSA-N 1 2 225.719 2.479 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)NC1CCCCC1 ZINC000158611954 326333303 /nfs/dbraw/zinc/33/33/03/326333303.db2.gz ODINFJOTYQMNKH-CMDGGOBGSA-N 1 2 247.342 2.365 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1C[C@H]2C[C@H]2C1 ZINC000568247878 326334408 /nfs/dbraw/zinc/33/44/08/326334408.db2.gz ZPXNSWOROGOJTC-JGPRNRPPSA-N 1 2 203.289 2.304 20 0 BEADLO Cc1nc2ccc(NCc3c[nH+]cn3C)cc2o1 ZINC000159009388 326347921 /nfs/dbraw/zinc/34/79/21/326347921.db2.gz BNRWLKHURQJWJV-UHFFFAOYSA-N 1 2 242.282 2.482 20 0 BEADLO Cc1[nH]c(C(=O)NC2(C3CCC3)CCC2)c[nH+]1 ZINC000568362056 326349370 /nfs/dbraw/zinc/34/93/70/326349370.db2.gz MLYRMIUAHMHBQC-UHFFFAOYSA-N 1 2 233.315 2.171 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1CC[C@@H](C)C[C@H]1C ZINC000568880910 326381024 /nfs/dbraw/zinc/38/10/24/326381024.db2.gz LTWWKLSTXSFGIY-GRYCIOLGSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1CC[C@@H](C)C[C@H]1C ZINC000568880910 326381025 /nfs/dbraw/zinc/38/10/25/326381025.db2.gz LTWWKLSTXSFGIY-GRYCIOLGSA-N 1 2 249.358 2.235 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NC12CCC(CC1)CC2 ZINC000569194334 326394339 /nfs/dbraw/zinc/39/43/39/326394339.db2.gz WVPIUECSMPBEEZ-UHFFFAOYSA-N 1 2 247.342 2.181 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NC12CCC(CC1)CC2 ZINC000569194334 326394340 /nfs/dbraw/zinc/39/43/40/326394340.db2.gz WVPIUECSMPBEEZ-UHFFFAOYSA-N 1 2 247.342 2.181 20 0 BEADLO C[C@@H](CC(=O)NC[C@@H]1CCC[C@H]1C)n1cc[nH+]c1 ZINC000573123161 326431036 /nfs/dbraw/zinc/43/10/36/326431036.db2.gz BROHGNZUFAXQQM-AGIUHOORSA-N 1 2 249.358 2.387 20 0 BEADLO CC[C@@H](C)[C@@H]1CCCCN1C(=O)Cn1cc[nH+]c1 ZINC000573148813 326432128 /nfs/dbraw/zinc/43/21/28/326432128.db2.gz BEYMZNAKAFVLEY-OLZOCXBDSA-N 1 2 249.358 2.310 20 0 BEADLO O[C@H]1C[N@H+](CC2CCCCC2)CC(F)(F)C1 ZINC000682544539 487983556 /nfs/dbraw/zinc/98/35/56/487983556.db2.gz RXRMUGZLYQJNSA-LLVKDONJSA-N 1 2 233.302 2.269 20 0 BEADLO O[C@H]1C[N@@H+](CC2CCCCC2)CC(F)(F)C1 ZINC000682544539 487983558 /nfs/dbraw/zinc/98/35/58/487983558.db2.gz RXRMUGZLYQJNSA-LLVKDONJSA-N 1 2 233.302 2.269 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2ccns2)nc1 ZINC000639098921 487986703 /nfs/dbraw/zinc/98/67/03/487986703.db2.gz ZYISGTOIHWYNPX-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2ccns2)nc1 ZINC000639098921 487986710 /nfs/dbraw/zinc/98/67/10/487986710.db2.gz ZYISGTOIHWYNPX-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO c1nc(NC2CCCCC2)c2c([nH+]1)NCCO2 ZINC000665688611 487987692 /nfs/dbraw/zinc/98/76/92/487987692.db2.gz JAUQDXUNISYKCT-UHFFFAOYSA-N 1 2 234.303 2.026 20 0 BEADLO c1nc2c(c(NC3CCCCC3)[nH+]1)OCCN2 ZINC000665688611 487987698 /nfs/dbraw/zinc/98/76/98/487987698.db2.gz JAUQDXUNISYKCT-UHFFFAOYSA-N 1 2 234.303 2.026 20 0 BEADLO O[C@@H]1C[N@H+](C[C@@H]2CC=CCC2)CC(F)(F)C1 ZINC000682559383 487989389 /nfs/dbraw/zinc/98/93/89/487989389.db2.gz UYIJULDDOXHYMN-MNOVXSKESA-N 1 2 231.286 2.045 20 0 BEADLO O[C@@H]1C[N@@H+](C[C@@H]2CC=CCC2)CC(F)(F)C1 ZINC000682559383 487989394 /nfs/dbraw/zinc/98/93/94/487989394.db2.gz UYIJULDDOXHYMN-MNOVXSKESA-N 1 2 231.286 2.045 20 0 BEADLO CCC(CC)C[N@@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000682558117 487988837 /nfs/dbraw/zinc/98/88/37/487988837.db2.gz HKXWEYLYVOIDJE-JTQLQIEISA-N 1 2 221.291 2.125 20 0 BEADLO CCC(CC)C[N@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000682558117 487988842 /nfs/dbraw/zinc/98/88/42/487988842.db2.gz HKXWEYLYVOIDJE-JTQLQIEISA-N 1 2 221.291 2.125 20 0 BEADLO Oc1cccc2c1CC[C@H]2[NH2+]CC(F)F ZINC000147288653 487995397 /nfs/dbraw/zinc/99/53/97/487995397.db2.gz XTRJVQATVGLSLU-SECBINFHSA-N 1 2 213.227 2.234 20 0 BEADLO c1nc(N2CCC[C@H]3C[C@H]32)cc(NC2CC2)[nH+]1 ZINC000665719022 487999257 /nfs/dbraw/zinc/99/92/57/487999257.db2.gz WTDGTTNKEODNMJ-GXSJLCMTSA-N 1 2 230.315 2.040 20 0 BEADLO c1nc(NC2CC2)cc(N2CCC[C@H]3C[C@H]32)[nH+]1 ZINC000665719022 487999265 /nfs/dbraw/zinc/99/92/65/487999265.db2.gz WTDGTTNKEODNMJ-GXSJLCMTSA-N 1 2 230.315 2.040 20 0 BEADLO O[C@@H]1CCC[N@H+](Cc2ccc(F)c(F)c2F)C1 ZINC000667472256 488017389 /nfs/dbraw/zinc/01/73/89/488017389.db2.gz AEIRVCIZGDKLNP-SECBINFHSA-N 1 2 245.244 2.061 20 0 BEADLO O[C@@H]1CCC[N@@H+](Cc2ccc(F)c(F)c2F)C1 ZINC000667472256 488017391 /nfs/dbraw/zinc/01/73/91/488017391.db2.gz AEIRVCIZGDKLNP-SECBINFHSA-N 1 2 245.244 2.061 20 0 BEADLO OC1CC[NH+](Cc2ccc(F)c(F)c2F)CC1 ZINC000667479527 488022406 /nfs/dbraw/zinc/02/24/06/488022406.db2.gz IDROTLYZTFWQGC-UHFFFAOYSA-N 1 2 245.244 2.061 20 0 BEADLO CCn1nccc1C[N@H+](C)Cc1ccc(C)cn1 ZINC000682788647 488041869 /nfs/dbraw/zinc/04/18/69/488041869.db2.gz SSVFXIKJJKJMFZ-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1nccc1C[N@@H+](C)Cc1ccc(C)cn1 ZINC000682788647 488041873 /nfs/dbraw/zinc/04/18/73/488041873.db2.gz SSVFXIKJJKJMFZ-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCN(Cc1ccoc1)Cc1c[nH+]c2n1CCC2 ZINC000667584247 488053776 /nfs/dbraw/zinc/05/37/76/488053776.db2.gz WOLCWQQNPVZJFL-UHFFFAOYSA-N 1 2 245.326 2.444 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@H]1CSC1(C)C ZINC000656185475 488062784 /nfs/dbraw/zinc/06/27/84/488062784.db2.gz CYESATOGTOKQJO-QMMMGPOBSA-N 1 2 239.344 2.100 20 0 BEADLO CO[C@H](C)CN(C)c1cc[nH+]c(C(C)(C)C)n1 ZINC000672337903 488064270 /nfs/dbraw/zinc/06/42/70/488064270.db2.gz JPTSKHRXWCJXMG-SNVBAGLBSA-N 1 2 237.347 2.245 20 0 BEADLO CN(C)c1cc[nH+]c(NC(=O)c2ccccc2)c1 ZINC000680255930 488065604 /nfs/dbraw/zinc/06/56/04/488065604.db2.gz AEKQHPJGFLSLCW-UHFFFAOYSA-N 1 2 241.294 2.400 20 0 BEADLO OCc1cc[nH+]c(N2C[C@@H]3CCCC[C@@H]3C2)c1 ZINC000310202191 488074807 /nfs/dbraw/zinc/07/48/07/488074807.db2.gz BAIPEIASEFENTE-BETUJISGSA-N 1 2 232.327 2.200 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCOCC2(C)C)c1 ZINC000683004589 488087003 /nfs/dbraw/zinc/08/70/03/488087003.db2.gz OPRQILDGTCYIQT-UHFFFAOYSA-N 1 2 220.316 2.001 20 0 BEADLO Cc1ccnc(C[N@H+]2CCOCC2(C)C)c1 ZINC000683004589 488087005 /nfs/dbraw/zinc/08/70/05/488087005.db2.gz OPRQILDGTCYIQT-UHFFFAOYSA-N 1 2 220.316 2.001 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1ncc(C)cn1 ZINC000677682205 488089881 /nfs/dbraw/zinc/08/98/81/488089881.db2.gz RWLZEADLGAWSHH-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1ncc(C)cn1 ZINC000677682205 488089882 /nfs/dbraw/zinc/08/98/82/488089882.db2.gz RWLZEADLGAWSHH-UHFFFAOYSA-N 1 2 231.299 2.400 20 0 BEADLO Cc1ccc2cc(C[NH+]3CCN(C)CC3)[nH]c2c1 ZINC000257894119 488091105 /nfs/dbraw/zinc/09/11/05/488091105.db2.gz MYBJGRRTNRGVCE-UHFFFAOYSA-N 1 2 243.354 2.224 20 0 BEADLO Cc1noc([C@H](C)[N@@H+]2CC[C@H](C(F)(F)F)C2)n1 ZINC000677714022 488097333 /nfs/dbraw/zinc/09/73/33/488097333.db2.gz NZTIEHLVIGBEOQ-XPUUQOCRSA-N 1 2 249.236 2.323 20 0 BEADLO Cc1noc([C@H](C)[N@H+]2CC[C@H](C(F)(F)F)C2)n1 ZINC000677714022 488097336 /nfs/dbraw/zinc/09/73/36/488097336.db2.gz NZTIEHLVIGBEOQ-XPUUQOCRSA-N 1 2 249.236 2.323 20 0 BEADLO C[C@@H](CO)c1ccc(-c2[nH+]ccn2C)cc1 ZINC000258147470 488103249 /nfs/dbraw/zinc/10/32/49/488103249.db2.gz KJHUYODWMSZOLU-JTQLQIEISA-N 1 2 216.284 2.183 20 0 BEADLO Cc1cc(C[NH+]2CC3(C2)CC(F)(F)C3)no1 ZINC000677736517 488114025 /nfs/dbraw/zinc/11/40/25/488114025.db2.gz RUORTTLJBHTOBA-UHFFFAOYSA-N 1 2 228.242 2.214 20 0 BEADLO CC[C@@H](C(N)=O)[N@@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000451833117 488114324 /nfs/dbraw/zinc/11/43/24/488114324.db2.gz HOLODVWGYFBJTP-CMPLNLGQSA-N 1 2 248.326 2.071 20 0 BEADLO CC[C@@H](C(N)=O)[N@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000451833117 488114329 /nfs/dbraw/zinc/11/43/29/488114329.db2.gz HOLODVWGYFBJTP-CMPLNLGQSA-N 1 2 248.326 2.071 20 0 BEADLO CC[C@@H](C(N)=O)[N@@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000451833118 488114483 /nfs/dbraw/zinc/11/44/83/488114483.db2.gz HOLODVWGYFBJTP-JQWIXIFHSA-N 1 2 248.326 2.071 20 0 BEADLO CC[C@@H](C(N)=O)[N@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000451833118 488114486 /nfs/dbraw/zinc/11/44/86/488114486.db2.gz HOLODVWGYFBJTP-JQWIXIFHSA-N 1 2 248.326 2.071 20 0 BEADLO CC[C@H]([NH2+]Cc1ncnn1C)c1ccccc1F ZINC000180683062 488120245 /nfs/dbraw/zinc/12/02/45/488120245.db2.gz HQUQBAONBVMWSV-LBPRGKRZSA-N 1 2 248.305 2.195 20 0 BEADLO CC(F)(F)CC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000683200720 488129710 /nfs/dbraw/zinc/12/97/10/488129710.db2.gz GNAKSQHWOBKZIS-UHFFFAOYSA-N 1 2 239.225 2.318 20 0 BEADLO CCC[C@H](C)C[N@H+](C)Cc1noc(C)n1 ZINC000668796471 487550891 /nfs/dbraw/zinc/55/08/91/487550891.db2.gz VIMGHGZSFZBCJW-VIFPVBQESA-N 1 2 211.309 2.246 20 0 BEADLO CCC[C@H](C)C[N@@H+](C)Cc1noc(C)n1 ZINC000668796471 487550893 /nfs/dbraw/zinc/55/08/93/487550893.db2.gz VIMGHGZSFZBCJW-VIFPVBQESA-N 1 2 211.309 2.246 20 0 BEADLO CCCC1(C(=O)N2CCn3cc(C)[nH+]c3C2)CC1 ZINC000679894031 487482506 /nfs/dbraw/zinc/48/25/06/487482506.db2.gz QMEWRLLDBWZZMW-UHFFFAOYSA-N 1 2 247.342 2.114 20 0 BEADLO Cc1nn(C(C)C)cc1C[N@H+](C)Cc1cn[nH]c1 ZINC000684964596 487476600 /nfs/dbraw/zinc/47/66/00/487476600.db2.gz LTBKLPUMDOUGIO-UHFFFAOYSA-N 1 2 247.346 2.128 20 0 BEADLO Cc1nn(C(C)C)cc1C[N@@H+](C)Cc1cn[nH]c1 ZINC000684964596 487476602 /nfs/dbraw/zinc/47/66/02/487476602.db2.gz LTBKLPUMDOUGIO-UHFFFAOYSA-N 1 2 247.346 2.128 20 0 BEADLO COc1ccc(N[C@@H]2COC3(CCC3)C2)[nH+]c1 ZINC000657951206 487480077 /nfs/dbraw/zinc/48/00/77/487480077.db2.gz YNTXNUSPSGIPCO-JTQLQIEISA-N 1 2 234.299 2.214 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2cncs2)s1 ZINC000391822923 487498410 /nfs/dbraw/zinc/49/84/10/487498410.db2.gz UTNGAWUCULTEQU-LURJTMIESA-N 1 2 240.357 2.154 20 0 BEADLO Cc1nc(N[C@H](C)C[C@@H](C)O)c2c([nH+]1)CCCC2 ZINC000679932672 487495945 /nfs/dbraw/zinc/49/59/45/487495945.db2.gz MMXOJPVPPGHGRX-NXEZZACHSA-N 1 2 249.358 2.235 20 0 BEADLO CC(C)(C)c1nc(NCc2cc[nH]n2)cc[nH+]1 ZINC000674064724 487506515 /nfs/dbraw/zinc/50/65/15/487506515.db2.gz QXXDVHGXEDDIOB-UHFFFAOYSA-N 1 2 231.303 2.109 20 0 BEADLO COc1ccc(N[C@@H](C)COC(C)C)[nH+]c1 ZINC000381313980 487503962 /nfs/dbraw/zinc/50/39/62/487503962.db2.gz QUJQQDDWYZEYJU-JTQLQIEISA-N 1 2 224.304 2.316 20 0 BEADLO C[C@@H](C(=O)N[C@@H](C)Cn1cc[nH+]c1)C1CCCC1 ZINC000674082099 487513501 /nfs/dbraw/zinc/51/35/01/487513501.db2.gz ATZDCMSUGOQEFP-NWDGAFQWSA-N 1 2 249.358 2.214 20 0 BEADLO C[C@H](C(=O)N(C)Cc1[nH+]ccn1C)C1CCCC1 ZINC000674089153 487515547 /nfs/dbraw/zinc/51/55/47/487515547.db2.gz KQNANFPZKOSLPH-NSHDSACASA-N 1 2 249.358 2.205 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)NCc2c[nH+]cn2C)C[C@@H]1C ZINC000295935854 487515666 /nfs/dbraw/zinc/51/56/66/487515666.db2.gz GHUFXKBZPXGKNS-WOPDTQHZSA-N 1 2 249.358 2.109 20 0 BEADLO Cc1nnc(C[N@@H+](C)CC2(C)CC2)s1 ZINC000668773902 487517006 /nfs/dbraw/zinc/51/70/06/487517006.db2.gz HSZNGSMSBRVLRZ-UHFFFAOYSA-N 1 2 211.334 2.078 20 0 BEADLO Cc1nnc(C[N@H+](C)CC2(C)CC2)s1 ZINC000668773902 487517012 /nfs/dbraw/zinc/51/70/12/487517012.db2.gz HSZNGSMSBRVLRZ-UHFFFAOYSA-N 1 2 211.334 2.078 20 0 BEADLO CCc1nnc(C[NH+]2C3CCC2CC3)s1 ZINC000680045060 487526147 /nfs/dbraw/zinc/52/61/47/487526147.db2.gz AQZGLWCMDWCBNF-UHFFFAOYSA-N 1 2 223.345 2.227 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000668299708 487635449 /nfs/dbraw/zinc/63/54/49/487635449.db2.gz PXMJOVNXBWQWGX-JQWIXIFHSA-N 1 2 205.305 2.093 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000668299708 487635453 /nfs/dbraw/zinc/63/54/53/487635453.db2.gz PXMJOVNXBWQWGX-JQWIXIFHSA-N 1 2 205.305 2.093 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)NC1CC=CC1 ZINC000675369594 487721240 /nfs/dbraw/zinc/72/12/40/487721240.db2.gz CNBGJWXHHDUBQM-UHFFFAOYSA-N 1 2 242.282 2.174 20 0 BEADLO Cc1nc(N2CC[C@H](C3CCC3)C2)cc[nH+]1 ZINC000665755897 487766443 /nfs/dbraw/zinc/76/64/43/487766443.db2.gz WWWYXXQCZCNRQL-LBPRGKRZSA-N 1 2 217.316 2.411 20 0 BEADLO Cc1noc(C[N@@H+](C)[C@H]2C[C@@H]2c2ccccc2)n1 ZINC000676043927 487804719 /nfs/dbraw/zinc/80/47/19/487804719.db2.gz RVQCKAKXXRTOHW-OLZOCXBDSA-N 1 2 243.310 2.366 20 0 BEADLO Cc1noc(C[N@H+](C)[C@H]2C[C@@H]2c2ccccc2)n1 ZINC000676043927 487804722 /nfs/dbraw/zinc/80/47/22/487804722.db2.gz RVQCKAKXXRTOHW-OLZOCXBDSA-N 1 2 243.310 2.366 20 0 BEADLO Cc1cc(C(=O)Nc2ccc3[nH+]ccn3c2)co1 ZINC000681993765 487876974 /nfs/dbraw/zinc/87/69/74/487876974.db2.gz XCRGMQWWLQUVKA-UHFFFAOYSA-N 1 2 241.250 2.488 20 0 BEADLO C(=C/c1ccccc1)\C[N@@H+]1CCc2cn[nH]c2C1 ZINC000676795141 487930859 /nfs/dbraw/zinc/93/08/59/487930859.db2.gz YNQSLNMMFVOOAL-QPJJXVBHSA-N 1 2 239.322 2.481 20 0 BEADLO C(=C/c1ccccc1)\C[N@H+]1CCc2cn[nH]c2C1 ZINC000676795141 487930864 /nfs/dbraw/zinc/93/08/64/487930864.db2.gz YNQSLNMMFVOOAL-QPJJXVBHSA-N 1 2 239.322 2.481 20 0 BEADLO Oc1ccc(C[N@@H+]2CCC=C(F)C2)cc1 ZINC000682407120 487950061 /nfs/dbraw/zinc/95/00/61/487950061.db2.gz OMJUDIXHWWRLLR-UHFFFAOYSA-N 1 2 207.248 2.451 20 0 BEADLO Oc1ccc(C[N@H+]2CCC=C(F)C2)cc1 ZINC000682407120 487950065 /nfs/dbraw/zinc/95/00/65/487950065.db2.gz OMJUDIXHWWRLLR-UHFFFAOYSA-N 1 2 207.248 2.451 20 0 BEADLO FC1CC2(C1)CN(c1cc[nH+]c(C3CC3)n1)C2 ZINC000677124482 487976274 /nfs/dbraw/zinc/97/62/74/487976274.db2.gz JWQYVNFFQNQJJJ-UHFFFAOYSA-N 1 2 233.290 2.292 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)[C@H]1[C@@H]2CCC[C@@H]21 ZINC000674015138 487997191 /nfs/dbraw/zinc/99/71/91/487997191.db2.gz RGESCMALLHRPFC-PJXYFTJBSA-N 1 2 241.294 2.319 20 0 BEADLO c1cc2c(s1)CCC[N@@H+](Cc1ncccn1)C2 ZINC000683007819 488088217 /nfs/dbraw/zinc/08/82/17/488088217.db2.gz KUNXARCXZXAXQQ-UHFFFAOYSA-N 1 2 245.351 2.487 20 0 BEADLO c1cc2c(s1)CCC[N@H+](Cc1ncccn1)C2 ZINC000683007819 488088221 /nfs/dbraw/zinc/08/82/21/488088221.db2.gz KUNXARCXZXAXQQ-UHFFFAOYSA-N 1 2 245.351 2.487 20 0 BEADLO CC[C@@H](COCC1CC1)[NH2+]Cc1cn[nH]c1C ZINC000657561267 488137147 /nfs/dbraw/zinc/13/71/47/488137147.db2.gz NVZUNWHAVJOYIU-ZDUSSCGKSA-N 1 2 237.347 2.013 20 0 BEADLO Cc1nc(N2CC[C@@H](OCCC(C)C)C2)cc[nH+]1 ZINC000176735886 488156364 /nfs/dbraw/zinc/15/63/64/488156364.db2.gz IAKSMKLFWRNBRC-CYBMUJFWSA-N 1 2 249.358 2.426 20 0 BEADLO CCCc1nc(C)c(C[N@@H+]2CCO[C@H](C)C2)o1 ZINC000339590299 488159899 /nfs/dbraw/zinc/15/98/99/488159899.db2.gz IGXPCYDXUYZMFY-SNVBAGLBSA-N 1 2 238.331 2.156 20 0 BEADLO CCCc1nc(C)c(C[N@H+]2CCO[C@H](C)C2)o1 ZINC000339590299 488159904 /nfs/dbraw/zinc/15/99/04/488159904.db2.gz IGXPCYDXUYZMFY-SNVBAGLBSA-N 1 2 238.331 2.156 20 0 BEADLO CCn1cc(C[NH2+][C@@H](C)c2ccc(C)o2)nn1 ZINC000404469231 488164863 /nfs/dbraw/zinc/16/48/63/488164863.db2.gz ZPOFSVVGEDCHFW-JTQLQIEISA-N 1 2 234.303 2.050 20 0 BEADLO Cn1ncc(C(F)(F)F)c1C[N@H+]1CC=CCC1 ZINC000667946488 488164985 /nfs/dbraw/zinc/16/49/85/488164985.db2.gz LXQYDCVSBSZIEY-UHFFFAOYSA-N 1 2 245.248 2.201 20 0 BEADLO Cn1ncc(C(F)(F)F)c1C[N@@H+]1CC=CCC1 ZINC000667946488 488164988 /nfs/dbraw/zinc/16/49/88/488164988.db2.gz LXQYDCVSBSZIEY-UHFFFAOYSA-N 1 2 245.248 2.201 20 0 BEADLO Cc1cccn2c(NC(=O)NCC(C)C)c[nH+]c12 ZINC000667948188 488165846 /nfs/dbraw/zinc/16/58/46/488165846.db2.gz RWRPNLWAYWJMJQ-UHFFFAOYSA-N 1 2 246.314 2.420 20 0 BEADLO CCn1cc(C[NH2+]Cc2cc(F)ccc2C)nn1 ZINC000404509387 488165818 /nfs/dbraw/zinc/16/58/18/488165818.db2.gz PDUQIZMCPKPXOK-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO C[C@H](C(=O)NCCCn1cc[nH+]c1)C1CCCC1 ZINC000674076647 488179409 /nfs/dbraw/zinc/17/94/09/488179409.db2.gz MWEUTNLAHSUOGF-LBPRGKRZSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@@H](N[C@@H](C)c1[nH]cc[nH+]1)C(C)(F)F ZINC000453274866 488187678 /nfs/dbraw/zinc/18/76/78/488187678.db2.gz BCSKTMHYAVAQMG-NKWVEPMBSA-N 1 2 203.236 2.104 20 0 BEADLO C[C@@H](N[C@@H](C)C(C)(F)F)c1[nH]cc[nH+]1 ZINC000453274868 488187710 /nfs/dbraw/zinc/18/77/10/488187710.db2.gz BCSKTMHYAVAQMG-RQJHMYQMSA-N 1 2 203.236 2.104 20 0 BEADLO C[C@H](N[C@@H](C)C(C)(F)F)c1[nH]cc[nH+]1 ZINC000453274865 488187758 /nfs/dbraw/zinc/18/77/58/488187758.db2.gz BCSKTMHYAVAQMG-BQBZGAKWSA-N 1 2 203.236 2.104 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)Cc1cc(F)ccc1F ZINC000678053683 488188435 /nfs/dbraw/zinc/18/84/35/488188435.db2.gz QSYJXABGMBGZLQ-UHFFFAOYSA-N 1 2 237.253 2.320 20 0 BEADLO C[C@@H]1CCN(C(=O)CCCn2cc[nH+]c2)[C@H](C)C1 ZINC000078000224 488196462 /nfs/dbraw/zinc/19/64/62/488196462.db2.gz KAPGAWMITNVJHJ-CHWSQXEVSA-N 1 2 249.358 2.310 20 0 BEADLO CCCCCNC(=O)Nc1cc(C)[nH+]cc1C ZINC000678098268 488197556 /nfs/dbraw/zinc/19/75/56/488197556.db2.gz JGRSGINUPVJJFH-UHFFFAOYSA-N 1 2 235.331 2.432 20 0 BEADLO Cc1cc(NC(=O)N2CCC[C@H](C)C2)c(C)c[nH+]1 ZINC000678096928 488197703 /nfs/dbraw/zinc/19/77/03/488197703.db2.gz FHCPQTZGMDBTBY-JTQLQIEISA-N 1 2 247.342 2.384 20 0 BEADLO C[C@H]1CCC[C@H](C)[NH+]1Cc1csnn1 ZINC000678120205 488200049 /nfs/dbraw/zinc/20/00/49/488200049.db2.gz BLRUEMZPIIAARI-IUCAKERBSA-N 1 2 211.334 2.301 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2[nH]nc3ccccc32)CCO1 ZINC000678131441 488201906 /nfs/dbraw/zinc/20/19/06/488201906.db2.gz BNZZCQOGJONJSE-LLVKDONJSA-N 1 2 245.326 2.174 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2[nH]nc3ccccc32)CCO1 ZINC000678131441 488201909 /nfs/dbraw/zinc/20/19/09/488201909.db2.gz BNZZCQOGJONJSE-LLVKDONJSA-N 1 2 245.326 2.174 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2n[nH]c3ccccc32)CCO1 ZINC000678131441 488201915 /nfs/dbraw/zinc/20/19/15/488201915.db2.gz BNZZCQOGJONJSE-LLVKDONJSA-N 1 2 245.326 2.174 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2n[nH]c3ccccc32)CCO1 ZINC000678131441 488201918 /nfs/dbraw/zinc/20/19/18/488201918.db2.gz BNZZCQOGJONJSE-LLVKDONJSA-N 1 2 245.326 2.174 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H]1CCC1(C)C ZINC000668745321 488204399 /nfs/dbraw/zinc/20/43/99/488204399.db2.gz DHWJUCKWYQDJHS-LLVKDONJSA-N 1 2 232.327 2.441 20 0 BEADLO Cc1noc(C[N@@H+](C)Cc2cc(F)ccc2C)n1 ZINC000683672263 488206557 /nfs/dbraw/zinc/20/65/57/488206557.db2.gz KNXLWCFVNPULGO-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO Cc1noc(C[N@H+](C)Cc2cc(F)ccc2C)n1 ZINC000683672263 488206560 /nfs/dbraw/zinc/20/65/60/488206560.db2.gz KNXLWCFVNPULGO-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO Cc1cn2ccc(NC(=O)NCC3CC3)cc2[nH+]1 ZINC000668151056 488209862 /nfs/dbraw/zinc/20/98/62/488209862.db2.gz PZAOJOUIEZBHGZ-UHFFFAOYSA-N 1 2 244.298 2.174 20 0 BEADLO Cc1[nH+]cc(CN2CCC(F)(F)[C@H](C)C2)n1C ZINC000668178333 488214937 /nfs/dbraw/zinc/21/49/37/488214937.db2.gz TYDRJBALIZAGPC-SECBINFHSA-N 1 2 243.301 2.206 20 0 BEADLO c1[nH]nnc1C[NH2+][C@H]1CCCC12CCCCC2 ZINC000398387058 488216466 /nfs/dbraw/zinc/21/64/66/488216466.db2.gz JGDCPTGXFXGBAV-LBPRGKRZSA-N 1 2 234.347 2.397 20 0 BEADLO c1n[nH]nc1C[NH2+][C@H]1CCCC12CCCCC2 ZINC000398387058 488216467 /nfs/dbraw/zinc/21/64/67/488216467.db2.gz JGDCPTGXFXGBAV-LBPRGKRZSA-N 1 2 234.347 2.397 20 0 BEADLO c1[nH]nnc1C[NH2+][C@@H]1CCCC12CCCCC2 ZINC000398387054 488216510 /nfs/dbraw/zinc/21/65/10/488216510.db2.gz JGDCPTGXFXGBAV-GFCCVEGCSA-N 1 2 234.347 2.397 20 0 BEADLO c1n[nH]nc1C[NH2+][C@@H]1CCCC12CCCCC2 ZINC000398387054 488216513 /nfs/dbraw/zinc/21/65/13/488216513.db2.gz JGDCPTGXFXGBAV-GFCCVEGCSA-N 1 2 234.347 2.397 20 0 BEADLO c1c2ccncc2sc1C[N@@H+]1CCO[C@H]2C[C@H]21 ZINC000668186794 488216944 /nfs/dbraw/zinc/21/69/44/488216944.db2.gz QIYHHEGKHAJGMV-NEPJUHHUSA-N 1 2 246.335 2.269 20 0 BEADLO c1c2ccncc2sc1C[N@H+]1CCO[C@H]2C[C@H]21 ZINC000668186794 488216947 /nfs/dbraw/zinc/21/69/47/488216947.db2.gz QIYHHEGKHAJGMV-NEPJUHHUSA-N 1 2 246.335 2.269 20 0 BEADLO C[C@@H]1c2ccccc2OCC[N@H+]1Cc1cc[nH]n1 ZINC000678196951 488216972 /nfs/dbraw/zinc/21/69/72/488216972.db2.gz OHRKZFIQJAMNLU-LLVKDONJSA-N 1 2 243.310 2.365 20 0 BEADLO C[C@@H]1c2ccccc2OCC[N@@H+]1Cc1cc[nH]n1 ZINC000678196951 488216975 /nfs/dbraw/zinc/21/69/75/488216975.db2.gz OHRKZFIQJAMNLU-LLVKDONJSA-N 1 2 243.310 2.365 20 0 BEADLO Cc1cccc2[nH]c(C[N@@H+]3CCO[C@H]4C[C@H]43)cc21 ZINC000668187141 488217776 /nfs/dbraw/zinc/21/77/76/488217776.db2.gz YKWILNQHKUOIIL-CABCVRRESA-N 1 2 242.322 2.449 20 0 BEADLO Cc1cccc2[nH]c(C[N@H+]3CCO[C@H]4C[C@H]43)cc21 ZINC000668187141 488217777 /nfs/dbraw/zinc/21/77/77/488217777.db2.gz YKWILNQHKUOIIL-CABCVRRESA-N 1 2 242.322 2.449 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H]1C[C@H]2C[C@H]2C1 ZINC000668746670 488220170 /nfs/dbraw/zinc/22/01/70/488220170.db2.gz SIMKMSVSASZZRO-GDNZZTSVSA-N 1 2 230.311 2.051 20 0 BEADLO Cn1ccc(C[N@@H+]2CCOC[C@@H]2c2ccco2)c1 ZINC000678264502 488229652 /nfs/dbraw/zinc/22/96/52/488229652.db2.gz NLMVTUJRPABEKZ-CYBMUJFWSA-N 1 2 246.310 2.192 20 0 BEADLO Cn1ccc(C[N@H+]2CCOC[C@@H]2c2ccco2)c1 ZINC000678264502 488229654 /nfs/dbraw/zinc/22/96/54/488229654.db2.gz NLMVTUJRPABEKZ-CYBMUJFWSA-N 1 2 246.310 2.192 20 0 BEADLO Fc1cc(F)c2c(c1)C[N@@H+](Cc1cn[nH]c1)CC2 ZINC000678295102 488238180 /nfs/dbraw/zinc/23/81/80/488238180.db2.gz YVBBMQSCQFAATI-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO Fc1cc(F)c2c(c1)C[N@H+](Cc1cn[nH]c1)CC2 ZINC000678295102 488238183 /nfs/dbraw/zinc/23/81/83/488238183.db2.gz YVBBMQSCQFAATI-UHFFFAOYSA-N 1 2 249.264 2.246 20 0 BEADLO CCC[C@@H](C)CC(=O)N[C@@H]1CCc2c[nH+]cn2C1 ZINC000672145238 488240915 /nfs/dbraw/zinc/24/09/15/488240915.db2.gz BAUBUMRZOHQVJP-VXGBXAGGSA-N 1 2 249.358 2.140 20 0 BEADLO CCC(CC)CC(=O)N[C@@H]1CCc2c[nH+]cn2C1 ZINC000672157961 488243217 /nfs/dbraw/zinc/24/32/17/488243217.db2.gz LNRYIOWDFHSOKL-GFCCVEGCSA-N 1 2 249.358 2.140 20 0 BEADLO CCCCNc1cc(NC2CCC2)nc(N)[nH+]1 ZINC000672211308 488245186 /nfs/dbraw/zinc/24/51/86/488245186.db2.gz KCIQMMBMEGKTAH-UHFFFAOYSA-N 1 2 235.335 2.235 20 0 BEADLO CCCCNc1cc(NC2CCC2)[nH+]c(N)n1 ZINC000672211308 488245190 /nfs/dbraw/zinc/24/51/90/488245190.db2.gz KCIQMMBMEGKTAH-UHFFFAOYSA-N 1 2 235.335 2.235 20 0 BEADLO Cc1nc(N2CC[C@H](C(F)F)C2)c(C)c(C)[nH+]1 ZINC000672275274 488249584 /nfs/dbraw/zinc/24/95/84/488249584.db2.gz OHFIPNKZDIZWHH-JTQLQIEISA-N 1 2 241.285 2.493 20 0 BEADLO CC(C)(C)c1nc(NCCC2(O)CCC2)cc[nH+]1 ZINC000672298435 488250280 /nfs/dbraw/zinc/25/02/80/488250280.db2.gz ZSTKYXFZJQRWBF-UHFFFAOYSA-N 1 2 249.358 2.491 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2ccc(F)cn2)ncn1 ZINC000678604417 488271104 /nfs/dbraw/zinc/27/11/04/488271104.db2.gz DMAQPNAGNLKAFK-SNVBAGLBSA-N 1 2 246.289 2.170 20 0 BEADLO Cc1ccc(NC(=O)C(C)(C)c2c[nH+]c[nH]2)cn1 ZINC000684191674 488273182 /nfs/dbraw/zinc/27/31/82/488273182.db2.gz LKSFVINOFRILDM-UHFFFAOYSA-N 1 2 244.298 2.029 20 0 BEADLO Cc1ccc(NC(=O)C(C)(C)c2c[nH]c[nH+]2)cn1 ZINC000684191674 488273184 /nfs/dbraw/zinc/27/31/84/488273184.db2.gz LKSFVINOFRILDM-UHFFFAOYSA-N 1 2 244.298 2.029 20 0 BEADLO FC(F)C[N@@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000678637153 488275158 /nfs/dbraw/zinc/27/51/58/488275158.db2.gz BOISTYOXHJAIOD-MNOVXSKESA-N 1 2 233.302 2.390 20 0 BEADLO FC(F)C[N@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000678637153 488275161 /nfs/dbraw/zinc/27/51/61/488275161.db2.gz BOISTYOXHJAIOD-MNOVXSKESA-N 1 2 233.302 2.390 20 0 BEADLO CCc1noc(C[NH2+][C@H](C)c2cccc(O)c2)n1 ZINC000678761662 488280599 /nfs/dbraw/zinc/28/05/99/488280599.db2.gz OUXZKZGMHFQZSA-SECBINFHSA-N 1 2 247.298 2.188 20 0 BEADLO CO[C@H](CNc1cc[nH+]cc1F)c1ccccc1 ZINC000678787963 488283574 /nfs/dbraw/zinc/28/35/74/488283574.db2.gz BCDWUHQFYXXPRQ-CQSZACIVSA-N 1 2 246.285 2.442 20 0 BEADLO COc1ccccc1N(C)CCCn1cc[nH+]c1 ZINC000678804801 488285226 /nfs/dbraw/zinc/28/52/26/488285226.db2.gz HBLYNXNHECPBII-UHFFFAOYSA-N 1 2 245.326 2.418 20 0 BEADLO c1c(C[N@H+]2CC=CCC2)nnn1-c1ccccc1 ZINC000679321923 488336134 /nfs/dbraw/zinc/33/61/34/488336134.db2.gz ODHZLEMUXRBDSQ-UHFFFAOYSA-N 1 2 240.310 2.029 20 0 BEADLO c1c(C[N@@H+]2CC=CCC2)nnn1-c1ccccc1 ZINC000679321923 488336135 /nfs/dbraw/zinc/33/61/35/488336135.db2.gz ODHZLEMUXRBDSQ-UHFFFAOYSA-N 1 2 240.310 2.029 20 0 BEADLO COc1ccc(N[C@@H]2CCC[C@H](OC)C2)[nH+]c1 ZINC000684385301 488303694 /nfs/dbraw/zinc/30/36/94/488303694.db2.gz JKXSBXNBGWBMOE-MNOVXSKESA-N 1 2 236.315 2.460 20 0 BEADLO COc1cc(C)[nH+]c(CN2CC=CCC2)c1 ZINC000679323499 488336985 /nfs/dbraw/zinc/33/69/85/488336985.db2.gz YPJDSHTXNFZUON-UHFFFAOYSA-N 1 2 218.300 2.161 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1cn2cccc(F)c2n1 ZINC000684411076 488309049 /nfs/dbraw/zinc/30/90/49/488309049.db2.gz FPLPUYGKFBMIDT-AOOOYVTPSA-N 1 2 233.290 2.456 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1cn2cccc(F)c2n1 ZINC000684411076 488309053 /nfs/dbraw/zinc/30/90/53/488309053.db2.gz FPLPUYGKFBMIDT-AOOOYVTPSA-N 1 2 233.290 2.456 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)nc1 ZINC000679219433 488317322 /nfs/dbraw/zinc/31/73/22/488317322.db2.gz FUTMRZXIZQBTEB-MFKMUULPSA-N 1 2 238.306 2.270 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)nc1 ZINC000679219433 488317323 /nfs/dbraw/zinc/31/73/23/488317323.db2.gz FUTMRZXIZQBTEB-MFKMUULPSA-N 1 2 238.306 2.270 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)no1 ZINC000679220627 488319335 /nfs/dbraw/zinc/31/93/35/488319335.db2.gz IDXBDTCGFUIWRF-KWQFWETISA-N 1 2 212.268 2.163 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)no1 ZINC000679220627 488319333 /nfs/dbraw/zinc/31/93/33/488319333.db2.gz IDXBDTCGFUIWRF-KWQFWETISA-N 1 2 212.268 2.163 20 0 BEADLO CC[C@H](NC(=O)CCC(F)F)c1[nH]cc[nH+]1 ZINC000684478061 488320089 /nfs/dbraw/zinc/32/00/89/488320089.db2.gz ORMUWVKIPQAIPQ-ZETCQYMHSA-N 1 2 231.246 2.022 20 0 BEADLO Cc1cc(N2CC=CCC2)nc(C2CC2)[nH+]1 ZINC000679279971 488328776 /nfs/dbraw/zinc/32/87/76/488328776.db2.gz NIBYYBJZCHMADZ-UHFFFAOYSA-N 1 2 215.300 2.429 20 0 BEADLO Cc1cc(N2CC(Cc3ccccc3)C2)nc[nH+]1 ZINC000679284253 488329079 /nfs/dbraw/zinc/32/90/79/488329079.db2.gz YWKUTOYIQQLWOF-UHFFFAOYSA-N 1 2 239.322 2.464 20 0 BEADLO Clc1ccc(C[N@H+]2CC=CCC2)nc1 ZINC000679323387 488336921 /nfs/dbraw/zinc/33/69/21/488336921.db2.gz OLHWBXCVGGWJNH-UHFFFAOYSA-N 1 2 208.692 2.497 20 0 BEADLO Clc1ccc(C[N@@H+]2CC=CCC2)nc1 ZINC000679323387 488336922 /nfs/dbraw/zinc/33/69/22/488336922.db2.gz OLHWBXCVGGWJNH-UHFFFAOYSA-N 1 2 208.692 2.497 20 0 BEADLO CC[C@@H]1C[C@H]1NC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000684776106 488341464 /nfs/dbraw/zinc/34/14/64/488341464.db2.gz DYWOFPBNRZLAFU-MWLCHTKSSA-N 1 2 244.298 2.254 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)N1CC=CCC1 ZINC000679340607 488341560 /nfs/dbraw/zinc/34/15/60/488341560.db2.gz FXTUMVUTPCBQLI-UHFFFAOYSA-N 1 2 242.282 2.128 20 0 BEADLO Cc1n[nH]cc1[C@H](C)[NH2+]Cc1ccn(C(C)C)n1 ZINC000679340736 488341855 /nfs/dbraw/zinc/34/18/55/488341855.db2.gz NYJVKOLENUVPRS-JTQLQIEISA-N 1 2 247.346 2.346 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@H](C)[C@@H]1CCCCO1 ZINC000679365010 488347075 /nfs/dbraw/zinc/34/70/75/488347075.db2.gz WOKZUDSHFRFLMO-NDMJEZRESA-N 1 2 237.347 2.326 20 0 BEADLO CN(C)c1ccc(NCc2ccc(O)cc2)[nH+]c1 ZINC000679394338 488350093 /nfs/dbraw/zinc/35/00/93/488350093.db2.gz MGAAHYPKUQTCHX-UHFFFAOYSA-N 1 2 243.310 2.465 20 0 BEADLO Cc1nn(C(C)C)cc1C[NH2+]Cc1cocn1 ZINC000684926624 488353351 /nfs/dbraw/zinc/35/33/51/488353351.db2.gz ALTBQPISMAIOAO-UHFFFAOYSA-N 1 2 234.303 2.050 20 0 BEADLO COCc1nc(C[N@H+](C)[C@H](C)C(C)(C)C)no1 ZINC000679533349 488356789 /nfs/dbraw/zinc/35/67/89/488356789.db2.gz MRHDLVCJEAKFRU-SECBINFHSA-N 1 2 241.335 2.082 20 0 BEADLO COCc1nc(C[N@@H+](C)[C@H](C)C(C)(C)C)no1 ZINC000679533349 488356791 /nfs/dbraw/zinc/35/67/91/488356791.db2.gz MRHDLVCJEAKFRU-SECBINFHSA-N 1 2 241.335 2.082 20 0 BEADLO c1n[nH]cc1CNc1c[nH+]c2c(c1)CCCC2 ZINC000679843121 488368280 /nfs/dbraw/zinc/36/82/80/488368280.db2.gz PWOAONBKWKKARL-UHFFFAOYSA-N 1 2 228.299 2.296 20 0 BEADLO FC1(F)C[C@@]12CCN(c1cccc[nH+]1)C2 ZINC000651486595 490099158 /nfs/dbraw/zinc/09/91/58/490099158.db2.gz FAIOFNKOBWUTPN-SNVBAGLBSA-N 1 2 210.227 2.317 20 0 BEADLO O=C(C[N@H+]1CC=CCC1)Nc1ccccc1F ZINC000679322449 490113496 /nfs/dbraw/zinc/11/34/96/490113496.db2.gz JTMCMEZUBIBIKX-UHFFFAOYSA-N 1 2 234.274 2.026 20 0 BEADLO O=C(C[N@@H+]1CC=CCC1)Nc1ccccc1F ZINC000679322449 490113500 /nfs/dbraw/zinc/11/35/00/490113500.db2.gz JTMCMEZUBIBIKX-UHFFFAOYSA-N 1 2 234.274 2.026 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2[nH]ncc2C)[C@@H](CC)CO1 ZINC000651913300 490154724 /nfs/dbraw/zinc/15/47/24/490154724.db2.gz RYILNOSMWUTUEO-NWDGAFQWSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2[nH]ncc2C)[C@@H](CC)CO1 ZINC000651913300 490154728 /nfs/dbraw/zinc/15/47/28/490154728.db2.gz RYILNOSMWUTUEO-NWDGAFQWSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2n[nH]cc2C)[C@@H](CC)CO1 ZINC000651913300 490154732 /nfs/dbraw/zinc/15/47/32/490154732.db2.gz RYILNOSMWUTUEO-NWDGAFQWSA-N 1 2 237.347 2.108 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2n[nH]cc2C)[C@@H](CC)CO1 ZINC000651913300 490154735 /nfs/dbraw/zinc/15/47/35/490154735.db2.gz RYILNOSMWUTUEO-NWDGAFQWSA-N 1 2 237.347 2.108 20 0 BEADLO C[C@@H]1C[C@@H]([NH2+]Cc2ccsc2)c2ncnn21 ZINC000657571109 490286012 /nfs/dbraw/zinc/28/60/12/490286012.db2.gz WATUXQXACFSRGZ-PSASIEDQSA-N 1 2 234.328 2.135 20 0 BEADLO CCc1cc(NC[C@H](C)CC(F)(F)F)nc[nH+]1 ZINC000396931848 490483073 /nfs/dbraw/zinc/48/30/73/490483073.db2.gz ARPIHQAMXLAZIY-MRVPVSSYSA-N 1 2 247.264 2.461 20 0 BEADLO CCc1cc(NCC2(CO)CCCCC2)nc[nH+]1 ZINC000122852886 490484941 /nfs/dbraw/zinc/48/49/41/490484941.db2.gz SPQMYWZCHIKFIS-UHFFFAOYSA-N 1 2 249.358 2.394 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NCCC1=CCCCC1 ZINC000074726787 490500991 /nfs/dbraw/zinc/50/09/91/490500991.db2.gz LCFHPQDDHORNAY-UHFFFAOYSA-N 1 2 247.342 2.349 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NCCC1=CCCCC1 ZINC000074726787 490500997 /nfs/dbraw/zinc/50/09/97/490500997.db2.gz LCFHPQDDHORNAY-UHFFFAOYSA-N 1 2 247.342 2.349 20 0 BEADLO CCc1cc(N[C@H](CO)C2CCCCC2)nc[nH+]1 ZINC000075066309 490514377 /nfs/dbraw/zinc/51/43/77/490514377.db2.gz MSDSNLUQSBROKL-CYBMUJFWSA-N 1 2 249.358 2.392 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)Nc1ccccc1 ZINC000080526842 490642263 /nfs/dbraw/zinc/64/22/63/490642263.db2.gz HITVIYGNWTXISM-UHFFFAOYSA-N 1 2 230.271 2.074 20 0 BEADLO CCc1noc([C@H](C)[N@@H+]2CC[C@H](C(F)F)C2)n1 ZINC000677735476 490655198 /nfs/dbraw/zinc/65/51/98/490655198.db2.gz QVNKNWUSELZNCX-YUMQZZPRSA-N 1 2 245.273 2.280 20 0 BEADLO CCc1noc([C@H](C)[N@H+]2CC[C@H](C(F)F)C2)n1 ZINC000677735476 490655201 /nfs/dbraw/zinc/65/52/01/490655201.db2.gz QVNKNWUSELZNCX-YUMQZZPRSA-N 1 2 245.273 2.280 20 0 BEADLO Cc1nc(N2CC[C@H]3C[C@H]3C2)c(C)c(C)[nH+]1 ZINC000664521626 490669403 /nfs/dbraw/zinc/66/94/03/490669403.db2.gz BVCSRLFGMAZYBS-RYUDHWBXSA-N 1 2 217.316 2.248 20 0 BEADLO Cc1cnc(C[NH2+]Cc2cccs2)o1 ZINC000227083789 491054997 /nfs/dbraw/zinc/05/49/97/491054997.db2.gz SBULDMPYXPTLHT-UHFFFAOYSA-N 1 2 208.286 2.334 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]CCOC(C)(C)C ZINC000309516973 491056356 /nfs/dbraw/zinc/05/63/56/491056356.db2.gz YXXYYVNFTOHFLL-SECBINFHSA-N 1 2 225.336 2.184 20 0 BEADLO COc1ccc(NCc2cc[nH]c2)[nH+]c1 ZINC000308954318 491141122 /nfs/dbraw/zinc/14/11/22/491141122.db2.gz QBXDKNWJQOHRPJ-UHFFFAOYSA-N 1 2 203.245 2.030 20 0 BEADLO CC[C@H]([NH2+][C@@H](C)CCCCO)C(F)(F)F ZINC000309032057 491142915 /nfs/dbraw/zinc/14/29/15/491142915.db2.gz FJZCSCIPYQQVSN-IUCAKERBSA-N 1 2 227.270 2.468 20 0 BEADLO c1cc2cc(NCc3cocn3)[nH+]cc2[nH]1 ZINC000309314020 491146784 /nfs/dbraw/zinc/14/67/84/491146784.db2.gz CPIDBGSUVRLXDL-UHFFFAOYSA-N 1 2 214.228 2.163 20 0 BEADLO Cc1cc[nH+]cc1NCc1nccs1 ZINC000082493729 491146907 /nfs/dbraw/zinc/14/69/07/491146907.db2.gz LCAVOIGWRQEBCJ-UHFFFAOYSA-N 1 2 205.286 2.459 20 0 BEADLO Cc1noc(C)c1[C@H](C)[NH2+]Cc1ccno1 ZINC000309659517 491153850 /nfs/dbraw/zinc/15/38/50/491153850.db2.gz APDUTHKSHXGBTO-ZETCQYMHSA-N 1 2 221.260 2.130 20 0 BEADLO COc1ccc(NCc2ccn(C)c2)[nH+]c1 ZINC000309690234 491154488 /nfs/dbraw/zinc/15/44/88/491154488.db2.gz IYOMSVUARUAKTR-UHFFFAOYSA-N 1 2 217.272 2.041 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@H](C)[C@H](F)C2)no1 ZINC000225249928 491162958 /nfs/dbraw/zinc/16/29/58/491162958.db2.gz IDXBDTCGFUIWRF-GZMMTYOYSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)no1 ZINC000225249928 491162959 /nfs/dbraw/zinc/16/29/59/491162959.db2.gz IDXBDTCGFUIWRF-GZMMTYOYSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1cc(F)ccc1C[N@H+](C)Cc1ncc[nH]1 ZINC000487963830 533877713 /nfs/dbraw/zinc/87/77/13/533877713.db2.gz NKFQSCOAGARDHG-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1ncc[nH]1 ZINC000487963830 533877719 /nfs/dbraw/zinc/87/77/19/533877719.db2.gz NKFQSCOAGARDHG-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO Cc1cc(F)ccc1CN(C)Cc1[nH]cc[nH+]1 ZINC000487963830 533877724 /nfs/dbraw/zinc/87/77/24/533877724.db2.gz NKFQSCOAGARDHG-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO C[C@@H]1CCN(C(=O)C=Cc2c[nH]c[nH+]2)[C@H](C)C1 ZINC000493090987 533912988 /nfs/dbraw/zinc/91/29/88/533912988.db2.gz GLZDROKQMCAFTG-ANDSXOESSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@@H]1CCN(C(=O)C=Cc2c[nH]c[nH+]2)C[C@@H](C)C1 ZINC000492856568 533913765 /nfs/dbraw/zinc/91/37/65/533913765.db2.gz BYMVNYWLHHYFRJ-BKGLOODYSA-N 1 2 247.342 2.318 20 0 BEADLO C[C@@H]1CCN(C(=O)/C=C/c2[nH]cc[nH+]2)CC1(C)C ZINC000493223428 533911958 /nfs/dbraw/zinc/91/19/58/533911958.db2.gz CFBJVQAMAUMIEG-SGUJLRQBSA-N 1 2 247.342 2.318 20 0 BEADLO C[C@@H]1CCN(C(=O)C=Cc2c[nH]c[nH+]2)C[C@@H](C)C1 ZINC000492856570 533912137 /nfs/dbraw/zinc/91/21/37/533912137.db2.gz BYMVNYWLHHYFRJ-LXYZTQFVSA-N 1 2 247.342 2.318 20 0 BEADLO COc1ccccc1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493114972 534164071 /nfs/dbraw/zinc/16/40/71/534164071.db2.gz HRFWHQSBOHNBSI-VOTSOKGWSA-N 1 2 243.266 2.070 20 0 BEADLO C[C@@H]1CN(C(=O)C=Cc2c[nH]c[nH+]2)CC(C)(C)C1 ZINC000492776533 534274994 /nfs/dbraw/zinc/27/49/94/534274994.db2.gz ZWBJANUFIRYUMS-ZWNMCFTASA-N 1 2 247.342 2.318 20 0 BEADLO C[C@@H](N(C)C(=O)/C=C/c1[nH]cc[nH+]1)C1(C)CC1 ZINC000493582460 534280551 /nfs/dbraw/zinc/28/05/51/534280551.db2.gz JMMUEQZXZPDLEB-ORAHPGNNSA-N 1 2 233.315 2.070 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)CC1CC1 ZINC000265176984 517860416 /nfs/dbraw/zinc/86/04/16/517860416.db2.gz FWIFPVIYLDSWAX-UHFFFAOYSA-N 1 2 204.273 2.383 20 0 BEADLO COC[C@@H]1CCCCN(c2cc(C)[nH+]cn2)C1 ZINC000342016121 518084350 /nfs/dbraw/zinc/08/43/50/518084350.db2.gz HXTKGGDVCCQDRU-GFCCVEGCSA-N 1 2 235.331 2.038 20 0 BEADLO CC(C)(C)CNc1ccc(N2CCOCC2)[nH+]c1 ZINC000041120540 534613408 /nfs/dbraw/zinc/61/34/08/534613408.db2.gz KSZVGSDEABCUBF-UHFFFAOYSA-N 1 2 249.358 2.376 20 0 BEADLO CC(=O)CSCc1ccc(-n2cc[nH+]c2)nc1 ZINC000175942253 534732478 /nfs/dbraw/zinc/73/24/78/534732478.db2.gz RVGRQMVAZLVVIK-UHFFFAOYSA-N 1 2 247.323 2.090 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CC(C2CCCC2)C1 ZINC000493196458 534801880 /nfs/dbraw/zinc/80/18/80/534801880.db2.gz JWOJQFMILGCSTM-WAYWQWQTSA-N 1 2 245.326 2.072 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)Nc1ccccc1F ZINC000493167782 534805434 /nfs/dbraw/zinc/80/54/34/534805434.db2.gz QHEVQYWYWRSYJG-WAYWQWQTSA-N 1 2 231.230 2.201 20 0 BEADLO CC(=O)c1ccc(OCc2c[nH+]cn2C)cc1F ZINC000227780118 534871242 /nfs/dbraw/zinc/87/12/42/534871242.db2.gz ONOONCVQGJHPOS-UHFFFAOYSA-N 1 2 248.257 2.341 20 0 BEADLO CC(=O)c1cccc(C[N@H+]2CCO[C@H](C)[C@H]2C)c1 ZINC000336196001 534888944 /nfs/dbraw/zinc/88/89/44/534888944.db2.gz KDTAWRPBMQYZIM-DGCLKSJQSA-N 1 2 247.338 2.498 20 0 BEADLO CC(=O)c1cccc(C[N@@H+]2CCO[C@H](C)[C@H]2C)c1 ZINC000336196001 534888946 /nfs/dbraw/zinc/88/89/46/534888946.db2.gz KDTAWRPBMQYZIM-DGCLKSJQSA-N 1 2 247.338 2.498 20 0 BEADLO CC(C)(C)[C@H]1CCCN1C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493340977 526722331 /nfs/dbraw/zinc/72/23/31/526722331.db2.gz WACFISMTSNXVMI-XUIVZRPNSA-N 1 2 247.342 2.460 20 0 BEADLO CC(C)(C)[C@H]1CCN(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493630885 526729918 /nfs/dbraw/zinc/72/99/18/526729918.db2.gz ZYVYVAFMLOOXQC-ZWNMCFTASA-N 1 2 247.342 2.318 20 0 BEADLO CC(C)(CNC(=O)C=Cc1c[nH]c[nH+]1)C1CCC1 ZINC000492996356 527092235 /nfs/dbraw/zinc/09/22/35/527092235.db2.gz WESAXJWYPVXICT-SREVYHEPSA-N 1 2 247.342 2.365 20 0 BEADLO CC(C)CCN(C(=O)C=Cc1c[nH]c[nH+]1)C1CC1 ZINC000493376862 527706479 /nfs/dbraw/zinc/70/64/79/527706479.db2.gz AKQPHRXVHMQTTR-UTCJRWHESA-N 1 2 247.342 2.460 20 0 BEADLO CCC[C@@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493613342 527743704 /nfs/dbraw/zinc/74/37/04/527743704.db2.gz OTVLDZVOARSDRI-NNNHXZLVSA-N 1 2 247.342 2.462 20 0 BEADLO CCC1CCN(C(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000492807014 527863225 /nfs/dbraw/zinc/86/32/25/527863225.db2.gz ASKAABVEFOZZBS-ARJAWSKDSA-N 1 2 233.315 2.072 20 0 BEADLO CC(C)CN(C(=O)C=Cc1c[nH]c[nH+]1)C(C)C ZINC000492810686 527889314 /nfs/dbraw/zinc/88/93/14/527889314.db2.gz IZFPXGDAGBXQAJ-WAYWQWQTSA-N 1 2 235.331 2.316 20 0 BEADLO CCCN(CC(C)C)C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493678293 527919170 /nfs/dbraw/zinc/91/91/70/527919170.db2.gz VRXROIKICOESLI-AATRIKPKSA-N 1 2 235.331 2.318 20 0 BEADLO CCCC(C)(C)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493548145 527984861 /nfs/dbraw/zinc/98/48/61/527984861.db2.gz GXVDTOLNIMEONA-WAYWQWQTSA-N 1 2 221.304 2.118 20 0 BEADLO CCCN(CC1CC1)C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493110008 528014537 /nfs/dbraw/zinc/01/45/37/528014537.db2.gz YJDFKUFVHSFJOL-AATRIKPKSA-N 1 2 233.315 2.072 20 0 BEADLO CCCCN(CC)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492863316 528381909 /nfs/dbraw/zinc/38/19/09/528381909.db2.gz MFMYUCPVVJSNGM-SREVYHEPSA-N 1 2 221.304 2.072 20 0 BEADLO CC(C)[C@@H]1CCCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492815001 528647281 /nfs/dbraw/zinc/64/72/81/528647281.db2.gz WANXOHOECJZVMK-FWWRYZNZSA-N 1 2 247.342 2.460 20 0 BEADLO CC(C)[C@@H]1CCCCN1C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493716540 528647305 /nfs/dbraw/zinc/64/73/05/528647305.db2.gz CMIWLMGSTPEGLH-SYTKJHMZSA-N 1 2 247.342 2.460 20 0 BEADLO CC1(C)C(CNC(=O)/C=C/c2[nH]cc[nH+]2)C1(C)C ZINC000493322174 528872212 /nfs/dbraw/zinc/87/22/12/528872212.db2.gz OIEMFPCDUUJWTJ-AATRIKPKSA-N 1 2 247.342 2.221 20 0 BEADLO CCN(C(=O)/C=C/c1[nH+]ccn1CC)C1CCC1 ZINC000492538490 528907598 /nfs/dbraw/zinc/90/75/98/528907598.db2.gz SDVLOMMWGCFHKO-CMDGGOBGSA-N 1 2 247.342 2.317 20 0 BEADLO CCN(C(=O)C=Cc1c[nH]c[nH+]1)C1CCCC1 ZINC000493329951 528911511 /nfs/dbraw/zinc/91/15/11/528911511.db2.gz XLLOVTYZSWPPEA-FPLPWBNLSA-N 1 2 233.315 2.214 20 0 BEADLO CCN(C(=O)C=Cc1c[nH]c[nH+]1)[C@H](C)C(C)C ZINC000493416298 528911657 /nfs/dbraw/zinc/91/16/57/528911657.db2.gz HMXGLHKMQAODCW-JMEBYUIHSA-N 1 2 235.331 2.316 20 0 BEADLO CC[C@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492896423 529211848 /nfs/dbraw/zinc/21/18/48/529211848.db2.gz JCXKRIUKNNIWRQ-GZTOBOFZSA-N 1 2 233.315 2.072 20 0 BEADLO CC[C@H]1CC[C@H](NC(=O)Cc2[nH]c[nH+]c2C)CC1 ZINC000479611808 529254424 /nfs/dbraw/zinc/25/44/24/529254424.db2.gz CUMLOTUFEPETLQ-HAQNSBGRSA-N 1 2 249.358 2.346 20 0 BEADLO CC[C@H]1CC[C@H](NC(=O)Cc2[nH+]c[nH]c2C)CC1 ZINC000479611808 529254425 /nfs/dbraw/zinc/25/44/25/529254425.db2.gz CUMLOTUFEPETLQ-HAQNSBGRSA-N 1 2 249.358 2.346 20 0 BEADLO CC[C@@H]1CCC[C@H]1CNC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493066201 529318788 /nfs/dbraw/zinc/31/87/88/529318788.db2.gz RXTURYDQOLSWIF-JIVBQCDMSA-N 1 2 247.342 2.365 20 0 BEADLO CC[C@@H]1CCC[C@H]1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492763245 529319981 /nfs/dbraw/zinc/31/99/81/529319981.db2.gz IYNDCNVKCCJPRC-PCQKXGFJSA-N 1 2 233.315 2.118 20 0 BEADLO CC1(C)[C@@H]2C[N@@H+](Cc3nc(C(F)F)no3)C[C@@H]21 ZINC000335609889 535042386 /nfs/dbraw/zinc/04/23/86/535042386.db2.gz JPLCPXINDYTAIM-KNVOCYPGSA-N 1 2 243.257 2.095 20 0 BEADLO CC1(C)[C@@H]2C[N@H+](Cc3nc(C(F)F)no3)C[C@@H]21 ZINC000335609889 535042393 /nfs/dbraw/zinc/04/23/93/535042393.db2.gz JPLCPXINDYTAIM-KNVOCYPGSA-N 1 2 243.257 2.095 20 0 BEADLO CC[C@@H](C)C[N@H+](CC)Cc1noc(COC)n1 ZINC000182533725 535511466 /nfs/dbraw/zinc/51/14/66/535511466.db2.gz NXLLCJAOEUBKGM-SNVBAGLBSA-N 1 2 241.335 2.084 20 0 BEADLO CC[C@@H](C)C[N@@H+](CC)Cc1noc(COC)n1 ZINC000182533725 535511468 /nfs/dbraw/zinc/51/14/68/535511468.db2.gz NXLLCJAOEUBKGM-SNVBAGLBSA-N 1 2 241.335 2.084 20 0 BEADLO CC[NH2+][C@H](C)c1noc(Cc2ccccc2)n1 ZINC000348283647 535516734 /nfs/dbraw/zinc/51/67/34/535516734.db2.gz DHMSLNSPIKNWLQ-SNVBAGLBSA-N 1 2 231.299 2.331 20 0 BEADLO CCCc1nc(C[N@@H+](CCC)C2CC2)no1 ZINC000171678738 535520719 /nfs/dbraw/zinc/52/07/19/535520719.db2.gz ABVOLUUSDLSXNG-UHFFFAOYSA-N 1 2 223.320 2.397 20 0 BEADLO CCCc1nc(C[N@H+](CCC)C2CC2)no1 ZINC000171678738 535520724 /nfs/dbraw/zinc/52/07/24/535520724.db2.gz ABVOLUUSDLSXNG-UHFFFAOYSA-N 1 2 223.320 2.397 20 0 BEADLO CCCn1cc(C[NH2+][C@@H](C)c2ccon2)cn1 ZINC000351598645 535613841 /nfs/dbraw/zinc/61/38/41/535613841.db2.gz WONCFLRZXFSJAO-JTQLQIEISA-N 1 2 234.303 2.132 20 0 BEADLO CC[C@@H](C)[C@@H](C)C(=O)NCCCn1cc[nH+]c1 ZINC000182891701 535637041 /nfs/dbraw/zinc/63/70/41/535637041.db2.gz FUTFOADMVSPDER-VXGBXAGGSA-N 1 2 237.347 2.072 20 0 BEADLO CSCCCNc1cccc([C@H](C)O)[nH+]1 ZINC000892600992 582925019 /nfs/dbraw/zinc/92/50/19/582925019.db2.gz QUOKMFXVWSBSHQ-VIFPVBQESA-N 1 2 226.345 2.300 20 0 BEADLO CC[C@@]1(C)C[C@H]1C(=O)NCc1c[nH+]ccc1OC ZINC000348266911 536068655 /nfs/dbraw/zinc/06/86/55/536068655.db2.gz CJOUBCUUCVWKND-FZMZJTMJSA-N 1 2 248.326 2.143 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1ccncc1F ZINC000336217618 536171829 /nfs/dbraw/zinc/17/18/29/536171829.db2.gz RQVSHFWQXMXTPS-PWSUYJOCSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1ccncc1F ZINC000336217618 536171832 /nfs/dbraw/zinc/17/18/32/536171832.db2.gz RQVSHFWQXMXTPS-PWSUYJOCSA-N 1 2 238.306 2.220 20 0 BEADLO COc1cc(C)[nH+]c(CN[C@H](C)c2ccon2)c1 ZINC000351577847 536694205 /nfs/dbraw/zinc/69/42/05/536694205.db2.gz GSNWCSWHYIZYPA-SNVBAGLBSA-N 1 2 247.298 2.237 20 0 BEADLO COC(=O)c1sccc1C[N@@H+]1C[C@H](C)[C@H]1C ZINC000339582864 566373607 /nfs/dbraw/zinc/37/36/07/566373607.db2.gz RZDSGDIQQOUORC-DTWKUNHWSA-N 1 2 239.340 2.375 20 0 BEADLO COC(=O)c1sccc1C[N@H+]1C[C@H](C)[C@H]1C ZINC000339582864 566373611 /nfs/dbraw/zinc/37/36/11/566373611.db2.gz RZDSGDIQQOUORC-DTWKUNHWSA-N 1 2 239.340 2.375 20 0 BEADLO FC1(F)CCN(Cc2[nH+]ccn2C2CC2)C1 ZINC000893310016 583096292 /nfs/dbraw/zinc/09/62/92/583096292.db2.gz SRYQKTUAEKTXTD-UHFFFAOYSA-N 1 2 227.258 2.059 20 0 BEADLO CC(C)c1c[nH]c(CN2C[C@H](C)OC[C@H]2C)[nH+]1 ZINC000893952810 583261558 /nfs/dbraw/zinc/26/15/58/583261558.db2.gz MAPCGOWJUHAIIG-MNOVXSKESA-N 1 2 237.347 2.142 20 0 BEADLO CC[C@H]1COCCN1Cc1[nH]cc(C(C)C)[nH+]1 ZINC000893995799 583267964 /nfs/dbraw/zinc/26/79/64/583267964.db2.gz SOANNWVATHZIQT-NSHDSACASA-N 1 2 237.347 2.144 20 0 BEADLO CSc1ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)o1 ZINC000894031231 583276998 /nfs/dbraw/zinc/27/69/98/583276998.db2.gz RTSNIYQXCBKKMI-AOOOYVTPSA-N 1 2 239.340 2.365 20 0 BEADLO CC(C)c1c[nH]c(CN2CCO[C@H](C)[C@H]2C)[nH+]1 ZINC000894026543 583280594 /nfs/dbraw/zinc/28/05/94/583280594.db2.gz MMKRSCDIVNHIKR-GHMZBOCLSA-N 1 2 237.347 2.142 20 0 BEADLO CC[C@@H]1CC[N@@H+](Cc2n[nH]c(C)c2C)C1 ZINC000894087272 583299024 /nfs/dbraw/zinc/29/90/24/583299024.db2.gz AZOJRMQTGDGCBR-LLVKDONJSA-N 1 2 207.321 2.258 20 0 BEADLO Cc1cc(NC(=O)c2ccnc(F)c2)cc[nH+]1 ZINC000111159676 588723506 /nfs/dbraw/zinc/72/35/06/588723506.db2.gz XWQWBPQHYIWQDV-UHFFFAOYSA-N 1 2 231.230 2.176 20 0 BEADLO CCc1nn(C[NH+]2CCCC2)c(=S)s1 ZINC000853488255 588745433 /nfs/dbraw/zinc/74/54/33/588745433.db2.gz YTAPBIKIUMZHAD-UHFFFAOYSA-N 1 2 229.374 2.290 20 0 BEADLO CC(C)[C@H](C)O[NH+]=C(N)Cc1cccnc1 ZINC000853678871 588755222 /nfs/dbraw/zinc/75/52/22/588755222.db2.gz OPWIIPQSJZBTOV-JTQLQIEISA-N 1 2 221.304 2.167 20 0 BEADLO Cc1cc(CNc2cnc(F)cn2)cc(C)[nH+]1 ZINC000853695546 588757249 /nfs/dbraw/zinc/75/72/49/588757249.db2.gz DVNPKEXXJQNJKR-UHFFFAOYSA-N 1 2 232.262 2.240 20 0 BEADLO c1cc(N[C@@H]2COC3(CCC3)C2)nc(C2CC2)[nH+]1 ZINC000853827387 588765321 /nfs/dbraw/zinc/76/53/21/588765321.db2.gz VAYLLYOXBNKNLJ-NSHDSACASA-N 1 2 245.326 2.478 20 0 BEADLO Cc1nc(N[C@H]2C[C@H](O)c3ccccc32)cc[nH+]1 ZINC000853837477 588765495 /nfs/dbraw/zinc/76/54/95/588765495.db2.gz GJCPMYOZYDLRQX-STQMWFEESA-N 1 2 241.294 2.375 20 0 BEADLO Cc1nc(N[C@@H]2C[C@@H](O)c3ccccc32)cc[nH+]1 ZINC000853837469 588765599 /nfs/dbraw/zinc/76/55/99/588765599.db2.gz GJCPMYOZYDLRQX-CHWSQXEVSA-N 1 2 241.294 2.375 20 0 BEADLO CC(C)c1nc(N2C[C@@H]3COC[C@@]3(C)C2)cc[nH+]1 ZINC000853858485 588766414 /nfs/dbraw/zinc/76/64/14/588766414.db2.gz MYFJOGWHVCZDSN-BXUZGUMPSA-N 1 2 247.342 2.073 20 0 BEADLO CC(C)c1nc(N2CC[C@@H]3C[C@@H]3C2)cc[nH+]1 ZINC000853903261 588768078 /nfs/dbraw/zinc/76/80/78/588768078.db2.gz ZLRVJHJLJNFQKW-GHMZBOCLSA-N 1 2 217.316 2.446 20 0 BEADLO O=C(NC1=[NH+]CCS1)[C@@H]1CCCC2(CC2)C1 ZINC000854293328 588782709 /nfs/dbraw/zinc/78/27/09/588782709.db2.gz QXDBNANROQUITG-SECBINFHSA-N 1 2 238.356 2.176 20 0 BEADLO C[C@@H](c1ccccc1)N(C)C(=O)Cc1[nH]cc[nH+]1 ZINC000854324172 588783459 /nfs/dbraw/zinc/78/34/59/588783459.db2.gz RVVFXRROFUWSPJ-NSHDSACASA-N 1 2 243.310 2.172 20 0 BEADLO C[C@@H](NC(=O)/C=C\C1CCCC1)c1[nH]cc[nH+]1 ZINC000854594630 588796264 /nfs/dbraw/zinc/79/62/64/588796264.db2.gz OWZDHYHHCKBDPW-JYESYGNLSA-N 1 2 233.315 2.333 20 0 BEADLO C[C@@H](NC(=O)C=CC1CCCC1)c1[nH]cc[nH+]1 ZINC000854594630 588796265 /nfs/dbraw/zinc/79/62/65/588796265.db2.gz OWZDHYHHCKBDPW-JYESYGNLSA-N 1 2 233.315 2.333 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)C1CCC2(CC2)CC1 ZINC000854498716 588789580 /nfs/dbraw/zinc/78/95/80/588789580.db2.gz KRYYOMNSRAXUID-UHFFFAOYSA-N 1 2 247.342 2.007 20 0 BEADLO C[C@H](NC(=O)Cc1[nH]cc[nH+]1)[C@H]1CCC[C@@H](C)C1 ZINC000854895539 588815665 /nfs/dbraw/zinc/81/56/65/588815665.db2.gz WQNUPGZMPUDOAV-WOPDTQHZSA-N 1 2 249.358 2.283 20 0 BEADLO CC=C(C=CC(=O)N(C)Cc1c[nH+]c[nH]1)CC ZINC000855136137 588823168 /nfs/dbraw/zinc/82/31/68/588823168.db2.gz LXYYVRUBJCURDN-BJNIYONUSA-N 1 2 233.315 2.281 20 0 BEADLO CC=C(C=CC(=O)N(C)Cc1c[nH]c[nH+]1)CC ZINC000855136137 588823169 /nfs/dbraw/zinc/82/31/69/588823169.db2.gz LXYYVRUBJCURDN-BJNIYONUSA-N 1 2 233.315 2.281 20 0 BEADLO CC(C)c1nc(N2CC[C@H]3C[C@H]32)cc[nH+]1 ZINC000804688310 582526682 /nfs/dbraw/zinc/52/66/82/582526682.db2.gz IOIIRSGDFYKSOB-VHSXEESVSA-N 1 2 203.289 2.199 20 0 BEADLO Cc1cc(N2CC[C@@H]3C[C@@H]32)nc(C2CC2)[nH+]1 ZINC000804689347 582526964 /nfs/dbraw/zinc/52/69/64/582526964.db2.gz NOHRLBFEQZLWLJ-MNOVXSKESA-N 1 2 215.300 2.261 20 0 BEADLO C[C@H](CC(=O)N[C@@H]1CC=CC[C@H]1C)n1cc[nH+]c1 ZINC000890765596 582542721 /nfs/dbraw/zinc/54/27/21/582542721.db2.gz LUOWZAIKASAHSB-JHJVBQTASA-N 1 2 247.342 2.305 20 0 BEADLO CCc1cc(N[C@H](CO)CC(C)(C)C)nc[nH+]1 ZINC000393487129 582665261 /nfs/dbraw/zinc/66/52/61/582665261.db2.gz SXMFBIAMZHHQLX-NSHDSACASA-N 1 2 237.347 2.248 20 0 BEADLO CC(C)OCCCNc1cccc([C@H](C)O)[nH+]1 ZINC000891449177 582688172 /nfs/dbraw/zinc/68/81/72/582688172.db2.gz NHWAAQVYESOABH-NSHDSACASA-N 1 2 238.331 2.362 20 0 BEADLO CN(Cc1ccco1)Cc1[nH+]ccn1C1CC1 ZINC000891487661 582692348 /nfs/dbraw/zinc/69/23/48/582692348.db2.gz MREVVOSVORSQKM-UHFFFAOYSA-N 1 2 231.299 2.443 20 0 BEADLO Cc1cc(-n2cc[nH+]c2)nc(C2CCC2)n1 ZINC000891550512 582696539 /nfs/dbraw/zinc/69/65/39/582696539.db2.gz NULRUNJDCKAYLD-UHFFFAOYSA-N 1 2 214.272 2.238 20 0 BEADLO COCC[N@H+](C)Cc1cc(C)cnc1Cl ZINC000891574975 582698766 /nfs/dbraw/zinc/69/87/66/582698766.db2.gz WATLINBGKUXRGT-UHFFFAOYSA-N 1 2 228.723 2.122 20 0 BEADLO COCC[N@@H+](C)Cc1cc(C)cnc1Cl ZINC000891574975 582698767 /nfs/dbraw/zinc/69/87/67/582698767.db2.gz WATLINBGKUXRGT-UHFFFAOYSA-N 1 2 228.723 2.122 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1cnn(C2CCC2)c1 ZINC000891672931 582708310 /nfs/dbraw/zinc/70/83/10/582708310.db2.gz ZIFZNLFCIKJHJQ-NEPJUHHUSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1cnn(C2CCC2)c1 ZINC000891672931 582708312 /nfs/dbraw/zinc/70/83/12/582708312.db2.gz ZIFZNLFCIKJHJQ-NEPJUHHUSA-N 1 2 249.358 2.217 20 0 BEADLO CC1(C)C[N@H+](Cc2cnn(C3CCC3)c2)CCO1 ZINC000891704840 582711398 /nfs/dbraw/zinc/71/13/98/582711398.db2.gz AFSFDPTYANYYEX-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO CC1(C)C[N@@H+](Cc2cnn(C3CCC3)c2)CCO1 ZINC000891704840 582711401 /nfs/dbraw/zinc/71/14/01/582711401.db2.gz AFSFDPTYANYYEX-UHFFFAOYSA-N 1 2 249.358 2.219 20 0 BEADLO Cc1cc(CN(C)c2cccc([C@@H](C)O)[nH+]2)no1 ZINC000891755756 582717404 /nfs/dbraw/zinc/71/74/04/582717404.db2.gz ZGOJTPCJWNCZAP-SNVBAGLBSA-N 1 2 247.298 2.068 20 0 BEADLO CCc1cc(N(CC)CCOC)nc(CC)[nH+]1 ZINC000891982383 582751999 /nfs/dbraw/zinc/75/19/99/582751999.db2.gz VPAMPNCATQBMBB-UHFFFAOYSA-N 1 2 237.347 2.074 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCO[C@H](C)[C@@H]2C)o1 ZINC000892047790 582773089 /nfs/dbraw/zinc/77/30/89/582773089.db2.gz BYTHELFGMVMSEX-WDEREUQCSA-N 1 2 239.315 2.288 20 0 BEADLO CCOc1ccc(C[N@H+]2CCO[C@H](C)[C@@H]2C)o1 ZINC000892047790 582773090 /nfs/dbraw/zinc/77/30/90/582773090.db2.gz BYTHELFGMVMSEX-WDEREUQCSA-N 1 2 239.315 2.288 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@@H+]1Cc1cnn(C2CCC2)c1 ZINC000892049174 582774418 /nfs/dbraw/zinc/77/44/18/582774418.db2.gz PGBJRCCIKAQHQV-NEPJUHHUSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1cnn(C2CCC2)c1 ZINC000892049174 582774419 /nfs/dbraw/zinc/77/44/19/582774419.db2.gz PGBJRCCIKAQHQV-NEPJUHHUSA-N 1 2 249.358 2.217 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2ccc(OC)o2)CCO1 ZINC000892068186 582785208 /nfs/dbraw/zinc/78/52/08/582785208.db2.gz GPLHAQWSGJMANO-NSHDSACASA-N 1 2 239.315 2.289 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2ccc(OC)o2)CCO1 ZINC000892068186 582785210 /nfs/dbraw/zinc/78/52/10/582785210.db2.gz GPLHAQWSGJMANO-NSHDSACASA-N 1 2 239.315 2.289 20 0 BEADLO CC[C@H](NC(=O)c1cccc2[nH+]ccn21)C1CC1 ZINC000855857818 588851526 /nfs/dbraw/zinc/85/15/26/588851526.db2.gz LNSXSBBRIOZSNP-NSHDSACASA-N 1 2 243.310 2.253 20 0 BEADLO COC(=O)/C(C)=C\C[NH+]1Cc2ccccc2C1 ZINC000214548968 582806540 /nfs/dbraw/zinc/80/65/40/582806540.db2.gz ZTPLZWLITXZKLE-XFFZJAGNSA-N 1 2 231.295 2.122 20 0 BEADLO CC1(C)CCN(c2nccn3c[nH+]cc23)CC1 ZINC000892282548 582826330 /nfs/dbraw/zinc/82/63/30/582826330.db2.gz XXUPGRPWJOEBSI-UHFFFAOYSA-N 1 2 230.315 2.356 20 0 BEADLO CC(C)(O)CNc1cc(C2CC2)[nH+]c(C2CC2)n1 ZINC000892308495 582835004 /nfs/dbraw/zinc/83/50/04/582835004.db2.gz ZQFJTAXHZYRFHA-UHFFFAOYSA-N 1 2 247.342 2.414 20 0 BEADLO COc1ccc2ccc(NCC(C)(C)O)[nH+]c2c1 ZINC000892308477 582835076 /nfs/dbraw/zinc/83/50/76/582835076.db2.gz MQCJDWZHHLTUAD-UHFFFAOYSA-N 1 2 246.310 2.426 20 0 BEADLO CC(=O)OC[C@H](C)Nc1ccc([NH+](C)C)cc1 ZINC000892312120 582836420 /nfs/dbraw/zinc/83/64/20/582836420.db2.gz APXQHVQHBRYNOY-JTQLQIEISA-N 1 2 236.315 2.116 20 0 BEADLO Cc1noc(C)c1[C@@H](C)[NH2+][C@@H](C)c1cnccn1 ZINC000092326996 582855039 /nfs/dbraw/zinc/85/50/39/582855039.db2.gz GTYOFTDVPOUYLG-DTWKUNHWSA-N 1 2 246.314 2.493 20 0 BEADLO CNc1cc(N2CC[C@H](c3ccco3)C2)nc[nH+]1 ZINC000892454636 582891163 /nfs/dbraw/zinc/89/11/63/582891163.db2.gz OWLQHXHYJVYWPR-JTQLQIEISA-N 1 2 244.298 2.105 20 0 BEADLO CNc1cc(N2CC[C@H](c3ccco3)C2)[nH+]cn1 ZINC000892454636 582891165 /nfs/dbraw/zinc/89/11/65/582891165.db2.gz OWLQHXHYJVYWPR-JTQLQIEISA-N 1 2 244.298 2.105 20 0 BEADLO CCc1cc(NC[C@](C)(O)C2CC2)nc(CC)[nH+]1 ZINC000892481772 582896330 /nfs/dbraw/zinc/89/63/30/582896330.db2.gz QAFRLVYQMOYMAV-AWEZNQCLSA-N 1 2 249.358 2.174 20 0 BEADLO CCc1cc(NC[C@@]2(C)CCOC2)nc(CC)[nH+]1 ZINC000892509676 582902282 /nfs/dbraw/zinc/90/22/82/582902282.db2.gz AMIQCJTYRWMOBS-CQSZACIVSA-N 1 2 249.358 2.440 20 0 BEADLO Cc1cc(N[C@@H](CO)C2CC2)nc(C2CCC2)[nH+]1 ZINC000892545719 582909410 /nfs/dbraw/zinc/90/94/10/582909410.db2.gz QWBQDTFRIOYNNO-LBPRGKRZSA-N 1 2 247.342 2.235 20 0 BEADLO Cc1cc(NC2CC=CC2)nc(C2CC2)[nH+]1 ZINC000393789686 582925124 /nfs/dbraw/zinc/92/51/24/582925124.db2.gz CXPKQARRNKMGRQ-UHFFFAOYSA-N 1 2 215.300 2.215 20 0 BEADLO CCOc1ccc(C[NH2+]Cc2nccs2)o1 ZINC000892640909 582935883 /nfs/dbraw/zinc/93/58/83/582935883.db2.gz MXXCNHJEHQZLCO-UHFFFAOYSA-N 1 2 238.312 2.425 20 0 BEADLO CC[C@H]1CN(c2nccn3c[nH+]cc23)CCS1 ZINC000892734335 582971527 /nfs/dbraw/zinc/97/15/27/582971527.db2.gz WVNQMMTVCKUVEF-JTQLQIEISA-N 1 2 248.355 2.061 20 0 BEADLO CCC/C(C)=C/C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000856277637 588866724 /nfs/dbraw/zinc/86/67/24/588866724.db2.gz NHWMUFTWZCBYAX-USKTWTLRSA-N 1 2 235.331 2.344 20 0 BEADLO C[C@H](NC(=O)C(F)=C1CCC1)c1[nH+]ccn1C ZINC000856279482 588866974 /nfs/dbraw/zinc/86/69/74/588866974.db2.gz GMRAWCMBWKBWEW-QMMMGPOBSA-N 1 2 237.278 2.005 20 0 BEADLO CCc1cc(N(C)C[C@H]2CCOC2)nc(CC)[nH+]1 ZINC000892821332 582988303 /nfs/dbraw/zinc/98/83/03/582988303.db2.gz HNGNRWUJRQKHRB-LLVKDONJSA-N 1 2 249.358 2.074 20 0 BEADLO Cc1cc(N(CCO)C2CC2)nc(C2CCC2)[nH+]1 ZINC000892878110 583002028 /nfs/dbraw/zinc/00/20/28/583002028.db2.gz QAELMPHZXWVZEO-UHFFFAOYSA-N 1 2 247.342 2.014 20 0 BEADLO CN(C)c1cc(NCCC2CCC2)[nH+]cn1 ZINC000892881063 583002598 /nfs/dbraw/zinc/00/25/98/583002598.db2.gz PNRDRZOKVZKGSH-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO CN(C)c1cc(NCCC2CCC2)nc[nH+]1 ZINC000892881063 583002599 /nfs/dbraw/zinc/00/25/99/583002599.db2.gz PNRDRZOKVZKGSH-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO C[C@@H](O)c1cccc(NC[C@H]2CCCS2)[nH+]1 ZINC000892885582 583003195 /nfs/dbraw/zinc/00/31/95/583003195.db2.gz ZUFXPHSWGRQQTC-NXEZZACHSA-N 1 2 238.356 2.442 20 0 BEADLO C[C@@H]1CC[C@@H](C)N1c1nccn2c[nH+]cc12 ZINC000892899452 583007047 /nfs/dbraw/zinc/00/70/47/583007047.db2.gz LYYJWBMYJIGXKJ-NXEZZACHSA-N 1 2 216.288 2.107 20 0 BEADLO CCc1cc(N[C@@](C)(CO)C2CC2)nc(CC)[nH+]1 ZINC000892923269 583010435 /nfs/dbraw/zinc/01/04/35/583010435.db2.gz WHZFQPSZIYDHCU-AWEZNQCLSA-N 1 2 249.358 2.174 20 0 BEADLO CCc1cc(N[C@@H](CO)CC2CC2)nc(CC)[nH+]1 ZINC000892976209 583024155 /nfs/dbraw/zinc/02/41/55/583024155.db2.gz BPJFABJBDRADOO-GFCCVEGCSA-N 1 2 249.358 2.174 20 0 BEADLO COc1ccc(C[NH2+]Cc2ccn(C(C)C)n2)o1 ZINC000893007813 583029646 /nfs/dbraw/zinc/02/96/46/583029646.db2.gz DRWSKLIJKAZABH-UHFFFAOYSA-N 1 2 249.314 2.355 20 0 BEADLO Cc1ocnc1CNc1cccc([C@@H](C)O)[nH+]1 ZINC000893029448 583032465 /nfs/dbraw/zinc/03/24/65/583032465.db2.gz VLBDVDZIINYUCW-MRVPVSSYSA-N 1 2 233.271 2.043 20 0 BEADLO Cc1ocnc1CNc1cccc([C@H](C)O)[nH+]1 ZINC000893029449 583032692 /nfs/dbraw/zinc/03/26/92/583032692.db2.gz VLBDVDZIINYUCW-QMMMGPOBSA-N 1 2 233.271 2.043 20 0 BEADLO C[C@@H]1CCN(c2cc(N(C)C)[nH+]cn2)C[C@@H]1C ZINC000893055485 583038412 /nfs/dbraw/zinc/03/84/12/583038412.db2.gz FCTAZIREGCACLP-MNOVXSKESA-N 1 2 234.347 2.025 20 0 BEADLO C[C@@H]1CCN(c2cc(N(C)C)nc[nH+]2)C[C@@H]1C ZINC000893055485 583038413 /nfs/dbraw/zinc/03/84/13/583038413.db2.gz FCTAZIREGCACLP-MNOVXSKESA-N 1 2 234.347 2.025 20 0 BEADLO C[C@@H](O)c1cccc(N[C@H]2CCO[C@H](C)C2)[nH+]1 ZINC000893087588 583047264 /nfs/dbraw/zinc/04/72/64/583047264.db2.gz CXJIRMFIWIFKGU-MXWKQRLJSA-N 1 2 236.315 2.114 20 0 BEADLO CCc1cc(N[C@@H](C)C[C@@H](C)O)nc(CC)[nH+]1 ZINC000893127879 583053910 /nfs/dbraw/zinc/05/39/10/583053910.db2.gz QXAVHDNYGNBFOE-VHSXEESVSA-N 1 2 237.347 2.173 20 0 BEADLO Fc1cccc(C[NH2+]Cc2nccn2C2CC2)n1 ZINC000893202511 583070457 /nfs/dbraw/zinc/07/04/57/583070457.db2.gz JKKRVZPYMFSWQM-UHFFFAOYSA-N 1 2 246.289 2.042 20 0 BEADLO C[C@H](CC(F)(F)F)Nc1cc(N(C)C)nc[nH+]1 ZINC000893207165 583070959 /nfs/dbraw/zinc/07/09/59/583070959.db2.gz ZXHJEDOYGSGEFP-SSDOTTSWSA-N 1 2 248.252 2.295 20 0 BEADLO C[C@H](CC(F)(F)F)Nc1cc(N(C)C)[nH+]cn1 ZINC000893207165 583070962 /nfs/dbraw/zinc/07/09/62/583070962.db2.gz ZXHJEDOYGSGEFP-SSDOTTSWSA-N 1 2 248.252 2.295 20 0 BEADLO C/C=C\C[C@@H](CO)Nc1cc(CC)[nH+]c(CC)n1 ZINC000893239592 583076472 /nfs/dbraw/zinc/07/64/72/583076472.db2.gz SGJWAYMVYVIWOH-KMSCOEIWSA-N 1 2 249.358 2.340 20 0 BEADLO C/C=C/C[C@H](CO)Nc1cc(CC)[nH+]c(CC)n1 ZINC000893239596 583076549 /nfs/dbraw/zinc/07/65/49/583076549.db2.gz SGJWAYMVYVIWOH-RPTYSRGTSA-N 1 2 249.358 2.340 20 0 BEADLO Cc1cc[nH+]cc1NCc1cn(C)nc1Cl ZINC000856775388 588877144 /nfs/dbraw/zinc/87/71/44/588877144.db2.gz NGPPGHYNUOFEKY-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO CCOc1cc(C[NH2+]Cc2cocn2)ccc1O ZINC000397939693 583114086 /nfs/dbraw/zinc/11/40/86/583114086.db2.gz UBIVIIOXJUIEIQ-UHFFFAOYSA-N 1 2 248.282 2.069 20 0 BEADLO CC(C)c1nc(N2CC[C@H](C)[C@H](CO)C2)cc[nH+]1 ZINC000856780661 588877654 /nfs/dbraw/zinc/87/76/54/588877654.db2.gz NWNJPJGDYGMNCW-RYUDHWBXSA-N 1 2 249.358 2.055 20 0 BEADLO C[C@@H](O)c1cccc(NC[C@H]2CCC=CO2)[nH+]1 ZINC000893367743 583127124 /nfs/dbraw/zinc/12/71/24/583127124.db2.gz LUEWWYNZJNYFKW-GHMZBOCLSA-N 1 2 234.299 2.240 20 0 BEADLO CCOC(C)(C)CNc1cccc([C@@H](C)O)[nH+]1 ZINC000893370546 583129179 /nfs/dbraw/zinc/12/91/79/583129179.db2.gz OJTFOIIREIKBRW-SNVBAGLBSA-N 1 2 238.331 2.362 20 0 BEADLO C[N@@H+](Cc1cc2ccccc2o1)CN1CCC1=O ZINC000857233731 583135449 /nfs/dbraw/zinc/13/54/49/583135449.db2.gz ASSIXLWCVFCQGX-UHFFFAOYSA-N 1 2 244.294 2.054 20 0 BEADLO C[N@H+](Cc1cc2ccccc2o1)CN1CCC1=O ZINC000857233731 583135451 /nfs/dbraw/zinc/13/54/51/583135451.db2.gz ASSIXLWCVFCQGX-UHFFFAOYSA-N 1 2 244.294 2.054 20 0 BEADLO Cc1c[nH+]c2n1CC[C@H]2OC(=O)c1ccoc1 ZINC000893517086 583155416 /nfs/dbraw/zinc/15/54/16/583155416.db2.gz CQWRVLIUNFUITC-SNVBAGLBSA-N 1 2 232.239 2.086 20 0 BEADLO Cc1c[nH+]c2n1CC[C@H]2OC(=O)[C@@H]1CC12CCC2 ZINC000893523611 583156540 /nfs/dbraw/zinc/15/65/40/583156540.db2.gz DYNCMSAJLFFOHA-WDEREUQCSA-N 1 2 246.310 2.370 20 0 BEADLO CCc1cc(NCc2cccnn2)nc(CC)[nH+]1 ZINC000893521653 583156907 /nfs/dbraw/zinc/15/69/07/583156907.db2.gz GLBWUOJAGWQVRU-UHFFFAOYSA-N 1 2 243.314 2.004 20 0 BEADLO Cc1c[nH+]c2n1CC[C@@H]2OC(=O)C1=CCCC1 ZINC000893524718 583157305 /nfs/dbraw/zinc/15/73/05/583157305.db2.gz KQETZHNMWXGXRS-NSHDSACASA-N 1 2 232.283 2.290 20 0 BEADLO C[C@H]1CC[N@H+](Cc2cn(C)nc2Cl)C[C@H]1F ZINC000857035767 588882981 /nfs/dbraw/zinc/88/29/81/588882981.db2.gz BIKAZCPMCJYEIR-WCBMZHEXSA-N 1 2 245.729 2.253 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2cn(C)nc2Cl)C[C@H]1F ZINC000857035767 588882982 /nfs/dbraw/zinc/88/29/82/588882982.db2.gz BIKAZCPMCJYEIR-WCBMZHEXSA-N 1 2 245.729 2.253 20 0 BEADLO C[C@H](O)c1cccc(NCCCOC(F)F)[nH+]1 ZINC000893718557 583212671 /nfs/dbraw/zinc/21/26/71/583212671.db2.gz SRIGIMSBWWMXQJ-QMMMGPOBSA-N 1 2 246.257 2.176 20 0 BEADLO CCc1cc(N(C)C[C@H](C)OC)nc(CC)[nH+]1 ZINC000893847861 583233077 /nfs/dbraw/zinc/23/30/77/583233077.db2.gz KSJVHSUIIRVRNU-JTQLQIEISA-N 1 2 237.347 2.073 20 0 BEADLO CCc1cc(N[C@H]2CCCOC2)nc(CC)[nH+]1 ZINC000893875630 583238654 /nfs/dbraw/zinc/23/86/54/583238654.db2.gz CPIZITRCOYDPBQ-NSHDSACASA-N 1 2 235.331 2.192 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2CCn3cccc3[C@@H]2C)c1C ZINC000893879135 583239664 /nfs/dbraw/zinc/23/96/64/583239664.db2.gz CPJRSFDDTLPGPO-LBPRGKRZSA-N 1 2 244.342 2.405 20 0 BEADLO Cc1n[nH]c(C[N@H+]2CCn3cccc3[C@@H]2C)c1C ZINC000893879135 583239666 /nfs/dbraw/zinc/23/96/66/583239666.db2.gz CPJRSFDDTLPGPO-LBPRGKRZSA-N 1 2 244.342 2.405 20 0 BEADLO CC[C@]1(C)C[N@H+](Cc2ccc(OC)o2)CCO1 ZINC000893907163 583244368 /nfs/dbraw/zinc/24/43/68/583244368.db2.gz HKQLIOFSJQZYHC-CYBMUJFWSA-N 1 2 239.315 2.289 20 0 BEADLO CC[C@]1(C)C[N@@H+](Cc2ccc(OC)o2)CCO1 ZINC000893907163 583244371 /nfs/dbraw/zinc/24/43/71/583244371.db2.gz HKQLIOFSJQZYHC-CYBMUJFWSA-N 1 2 239.315 2.289 20 0 BEADLO CCc1cc(NC[C@@H](CC)OC)nc(CC)[nH+]1 ZINC000893917523 583246771 /nfs/dbraw/zinc/24/67/71/583246771.db2.gz IQXSETJRPRNVGA-LLVKDONJSA-N 1 2 237.347 2.438 20 0 BEADLO CCN(Cc1c(C)cc[nH+]c1N)CC(F)(F)F ZINC000893961918 583256294 /nfs/dbraw/zinc/25/62/94/583256294.db2.gz GTXCLHFLHFPDFZ-UHFFFAOYSA-N 1 2 247.264 2.356 20 0 BEADLO CCCSC[C@H](C)[NH2+][C@@H](C)C(=O)OCC ZINC000893951622 583260231 /nfs/dbraw/zinc/26/02/31/583260231.db2.gz XJRLKPZSIGZJJB-UWVGGRQHSA-N 1 2 233.377 2.059 20 0 BEADLO Cc1cc(CN(C)Cc2[nH]cc(C(C)C)[nH+]2)no1 ZINC000893952326 583261263 /nfs/dbraw/zinc/26/12/63/583261263.db2.gz FTRBOVLTQVGZPK-UHFFFAOYSA-N 1 2 248.330 2.462 20 0 BEADLO CO[C@@H]1CCC[N@H+](Cc2nc(C(C)C)c[nH]2)C1 ZINC000893960088 583263030 /nfs/dbraw/zinc/26/30/30/583263030.db2.gz RPZRPPOSECZERA-LLVKDONJSA-N 1 2 237.347 2.144 20 0 BEADLO CO[C@@H]1CCC[N@@H+](Cc2nc(C(C)C)c[nH]2)C1 ZINC000893960088 583263031 /nfs/dbraw/zinc/26/30/31/583263031.db2.gz RPZRPPOSECZERA-LLVKDONJSA-N 1 2 237.347 2.144 20 0 BEADLO Cc1ncoc1C[N@@H+]1CCOc2ccccc2C1 ZINC000893969216 583264157 /nfs/dbraw/zinc/26/41/57/583264157.db2.gz RVJOQFRLFJEIAV-UHFFFAOYSA-N 1 2 244.294 2.378 20 0 BEADLO Cc1ncoc1C[N@H+]1CCOc2ccccc2C1 ZINC000893969216 583264160 /nfs/dbraw/zinc/26/41/60/583264160.db2.gz RVJOQFRLFJEIAV-UHFFFAOYSA-N 1 2 244.294 2.378 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2[nH]nc(C)c2C)C[C@@H](C)O1 ZINC000893976050 583264524 /nfs/dbraw/zinc/26/45/24/583264524.db2.gz LYJGHEBDMDGVSL-BXKDBHETSA-N 1 2 237.347 2.026 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2[nH]nc(C)c2C)C[C@@H](C)O1 ZINC000893976050 583264527 /nfs/dbraw/zinc/26/45/27/583264527.db2.gz LYJGHEBDMDGVSL-BXKDBHETSA-N 1 2 237.347 2.026 20 0 BEADLO CC[C@H]1CCC[N@@H+]1Cc1n[nH]c(C)c1C ZINC000893974678 583264850 /nfs/dbraw/zinc/26/48/50/583264850.db2.gz VYFRYYVIFYYLBG-NSHDSACASA-N 1 2 207.321 2.401 20 0 BEADLO CC[C@H]1CCC[N@H+]1Cc1n[nH]c(C)c1C ZINC000893974678 583264851 /nfs/dbraw/zinc/26/48/51/583264851.db2.gz VYFRYYVIFYYLBG-NSHDSACASA-N 1 2 207.321 2.401 20 0 BEADLO COc1ccc(C[N@@H+]2CC(C)(C)OC[C@@H]2C)o1 ZINC000894010366 583271060 /nfs/dbraw/zinc/27/10/60/583271060.db2.gz SWGDTIZUQGFTHQ-JTQLQIEISA-N 1 2 239.315 2.288 20 0 BEADLO COc1ccc(C[N@H+]2CC(C)(C)OC[C@@H]2C)o1 ZINC000894010366 583271063 /nfs/dbraw/zinc/27/10/63/583271063.db2.gz SWGDTIZUQGFTHQ-JTQLQIEISA-N 1 2 239.315 2.288 20 0 BEADLO CCc1cc(N2CC[C@@H]2C(F)F)nc(CC)[nH+]1 ZINC000894000879 583271704 /nfs/dbraw/zinc/27/17/04/583271704.db2.gz SCAVMZDGNZQIPO-SECBINFHSA-N 1 2 241.285 2.445 20 0 BEADLO CCc1cc(N2C[C@H](C)[C@H]2C)nc(CC)[nH+]1 ZINC000894001418 583272284 /nfs/dbraw/zinc/27/22/84/583272284.db2.gz WLEMAYSHPUGCKS-VHSXEESVSA-N 1 2 219.332 2.446 20 0 BEADLO CCC[C@@H](CNc1cccc([C@H](C)O)[nH+]1)OC ZINC000894017128 583273882 /nfs/dbraw/zinc/27/38/82/583273882.db2.gz XUDAGIHUSIZNEZ-QWRGUYRKSA-N 1 2 238.331 2.362 20 0 BEADLO CSc1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)o1 ZINC000894031231 583276995 /nfs/dbraw/zinc/27/69/95/583276995.db2.gz RTSNIYQXCBKKMI-AOOOYVTPSA-N 1 2 239.340 2.365 20 0 BEADLO Cn1cc[nH+]c1[C@@H]1N(c2nccs2)CC1(C)C ZINC000894033635 583277434 /nfs/dbraw/zinc/27/74/34/583277434.db2.gz HBWQVACUCLSYAS-VIFPVBQESA-N 1 2 248.355 2.464 20 0 BEADLO Cc1n[nH]c(C[N@@H+](C)Cc2cccc(C)n2)c1C ZINC000894049772 583288317 /nfs/dbraw/zinc/28/83/17/583288317.db2.gz LESIJTFWMVBTRJ-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO Cc1n[nH]c(C[N@H+](C)Cc2cccc(C)n2)c1C ZINC000894049772 583288319 /nfs/dbraw/zinc/28/83/19/583288319.db2.gz LESIJTFWMVBTRJ-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO CCc1cc(NC[C@@H]2CC(C)=NO2)nc(CC)[nH+]1 ZINC000894051515 583288999 /nfs/dbraw/zinc/28/89/99/583288999.db2.gz MTCODBUOPJIOOS-NSHDSACASA-N 1 2 248.330 2.178 20 0 BEADLO C[C@@H](O)c1cccc(N[C@H]2CC23CCOCC3)[nH+]1 ZINC000894081506 583294036 /nfs/dbraw/zinc/29/40/36/583294036.db2.gz ZKBVZYDXIODYME-PWSUYJOCSA-N 1 2 248.326 2.116 20 0 BEADLO Cc1coc(C[N@H+]2CCC[C@@H]2c2nncn2C)c1 ZINC000894077330 583297254 /nfs/dbraw/zinc/29/72/54/583297254.db2.gz ZSJYXTJFMBOSKM-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1coc(C[N@@H+]2CCC[C@@H]2c2nncn2C)c1 ZINC000894077330 583297255 /nfs/dbraw/zinc/29/72/55/583297255.db2.gz ZSJYXTJFMBOSKM-GFCCVEGCSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1ccc2c(c1C)OC[C@H]2[NH2+]Cc1cnc[nH]1 ZINC000894138158 583314204 /nfs/dbraw/zinc/31/42/04/583314204.db2.gz YKSPSPQRLMSQGN-CYBMUJFWSA-N 1 2 243.310 2.250 20 0 BEADLO CC[C@@H]1OCC[C@H]1Nc1cccc([C@H](C)O)[nH+]1 ZINC000894169302 583325000 /nfs/dbraw/zinc/32/50/00/583325000.db2.gz GGAANFCEPMHJRP-WCQGTBRESA-N 1 2 236.315 2.114 20 0 BEADLO C[C@@H]1CC(C)(C)CN1c1cc(N(C)C)[nH+]cn1 ZINC000894206146 583346908 /nfs/dbraw/zinc/34/69/08/583346908.db2.gz TWJYTJZDAVMYRT-SNVBAGLBSA-N 1 2 234.347 2.167 20 0 BEADLO C[C@@H]1CC(C)(C)CN1c1cc(N(C)C)nc[nH+]1 ZINC000894206146 583346909 /nfs/dbraw/zinc/34/69/09/583346909.db2.gz TWJYTJZDAVMYRT-SNVBAGLBSA-N 1 2 234.347 2.167 20 0 BEADLO c1[nH+]cn2ccnc(N3CC[C@H](C4CCC4)C3)c12 ZINC000894226657 583383454 /nfs/dbraw/zinc/38/34/54/583383454.db2.gz MDIWTICUHIKRBE-LBPRGKRZSA-N 1 2 242.326 2.356 20 0 BEADLO C[C@@H]1CN(c2nccn3c[nH+]cc23)[C@@H](C)[C@H]1C ZINC000894234413 583385107 /nfs/dbraw/zinc/38/51/07/583385107.db2.gz IMBRPNPNRUDBTB-VWYCJHECSA-N 1 2 230.315 2.210 20 0 BEADLO Cn1c[nH+]cc1COC(=O)/C=C\c1ccccc1 ZINC000747784953 583388773 /nfs/dbraw/zinc/38/87/73/583388773.db2.gz WVUTYDMVKGNIPA-FPLPWBNLSA-N 1 2 242.278 2.177 20 0 BEADLO Cc1ccc(CNc2cccc([C@H](C)O)[nH+]2)nc1 ZINC000894349669 583432239 /nfs/dbraw/zinc/43/22/39/583432239.db2.gz JWJHMMJQADEAES-NSHDSACASA-N 1 2 243.310 2.450 20 0 BEADLO Cc1cc[nH+]c(N)c1CN1CCC=C(F)C1 ZINC000894427153 583456574 /nfs/dbraw/zinc/45/65/74/583456574.db2.gz LQTQHRYYYAIXHN-UHFFFAOYSA-N 1 2 221.279 2.031 20 0 BEADLO Cc1nc2c(s1)[C@@H]([NH2+]Cc1c[nH]cn1)CCC2 ZINC000894430996 583457405 /nfs/dbraw/zinc/45/74/05/583457405.db2.gz INQRTYLQGFUDFR-JTQLQIEISA-N 1 2 248.355 2.342 20 0 BEADLO CCSc1cc(C[NH2+]Cc2c[nH]cn2)ccn1 ZINC000894500713 583474559 /nfs/dbraw/zinc/47/45/59/583474559.db2.gz PSPCSXCQRWGGKE-UHFFFAOYSA-N 1 2 248.355 2.207 20 0 BEADLO Cc1noc([C@H](C)[NH2+][C@@H]2CCc3cccnc32)n1 ZINC000894542146 583480695 /nfs/dbraw/zinc/48/06/95/583480695.db2.gz GNGWHRZGSXOUPI-GZMMTYOYSA-N 1 2 244.298 2.111 20 0 BEADLO C[C@@H](O)c1cccc(NCCc2ccoc2)[nH+]1 ZINC000894554764 583483571 /nfs/dbraw/zinc/48/35/71/583483571.db2.gz LQPDWNSMMYWPBQ-SNVBAGLBSA-N 1 2 232.283 2.383 20 0 BEADLO CN(C)c1cc(NCCCc2ccco2)[nH+]cn1 ZINC000894613217 583494105 /nfs/dbraw/zinc/49/41/05/583494105.db2.gz IGPJVNJJJDNLIZ-UHFFFAOYSA-N 1 2 246.314 2.180 20 0 BEADLO CN(C)c1cc(NCCCc2ccco2)nc[nH+]1 ZINC000894613217 583494108 /nfs/dbraw/zinc/49/41/08/583494108.db2.gz IGPJVNJJJDNLIZ-UHFFFAOYSA-N 1 2 246.314 2.180 20 0 BEADLO CC[C@H]1C[N@H+](Cc2n[nH]c(C)c2C)CCCO1 ZINC000894652409 583501458 /nfs/dbraw/zinc/50/14/58/583501458.db2.gz IAKYCTHFFSWEOD-LBPRGKRZSA-N 1 2 237.347 2.027 20 0 BEADLO F[C@H]1CC[N@H+](Cc2ccnn2C2CCC2)C1 ZINC000894671254 583503466 /nfs/dbraw/zinc/50/34/66/583503466.db2.gz NWJLUZPPBLZGLK-JTQLQIEISA-N 1 2 223.295 2.152 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2ccnn2C2CCC2)C1 ZINC000894671254 583503467 /nfs/dbraw/zinc/50/34/67/583503467.db2.gz NWJLUZPPBLZGLK-JTQLQIEISA-N 1 2 223.295 2.152 20 0 BEADLO F[C@H]1CC[N@H+](Cc2c(Cl)n[nH]c2C2CC2)C1 ZINC000894673445 583504160 /nfs/dbraw/zinc/50/41/60/583504160.db2.gz ZWJBLCWLLQPQEI-QMMMGPOBSA-N 1 2 243.713 2.484 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2c(Cl)n[nH]c2C2CC2)C1 ZINC000894673445 583504161 /nfs/dbraw/zinc/50/41/61/583504161.db2.gz ZWJBLCWLLQPQEI-QMMMGPOBSA-N 1 2 243.713 2.484 20 0 BEADLO FC(F)(F)C1CN(Cc2[nH+]ccn2C2CC2)C1 ZINC000894713433 583511249 /nfs/dbraw/zinc/51/12/49/583511249.db2.gz ZCUGSNYDWBMAFI-UHFFFAOYSA-N 1 2 245.248 2.212 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2nnc(C)[nH]2)c(C)o1 ZINC000894772157 583516810 /nfs/dbraw/zinc/51/68/10/583516810.db2.gz GKFUHOMIFMBXTR-MRVPVSSYSA-N 1 2 234.303 2.174 20 0 BEADLO Fc1cccc2c1N(Cc1c[nH+]c[nH]1)CC2 ZINC000894782599 583521553 /nfs/dbraw/zinc/52/15/53/583521553.db2.gz MGRXWMWBIJGYSX-UHFFFAOYSA-N 1 2 217.247 2.112 20 0 BEADLO Fc1cccc2c1N(Cc1c[nH]c[nH+]1)CC2 ZINC000894782599 583521554 /nfs/dbraw/zinc/52/15/54/583521554.db2.gz MGRXWMWBIJGYSX-UHFFFAOYSA-N 1 2 217.247 2.112 20 0 BEADLO CCC1(C)C[NH+](Cc2nnc(C)s2)C1 ZINC000894841709 583529940 /nfs/dbraw/zinc/52/99/40/583529940.db2.gz YLUQFKAFROAQNN-UHFFFAOYSA-N 1 2 211.334 2.078 20 0 BEADLO Cc1c(Cl)c(C[N@H+]2C[C@@H](C)[C@@H]2C)nn1C ZINC000894861243 583534126 /nfs/dbraw/zinc/53/41/26/583534126.db2.gz CJSASKNTBCCNFC-SFYZADRCSA-N 1 2 227.739 2.222 20 0 BEADLO Cc1c(Cl)c(C[N@@H+]2C[C@@H](C)[C@@H]2C)nn1C ZINC000894861243 583534128 /nfs/dbraw/zinc/53/41/28/583534128.db2.gz CJSASKNTBCCNFC-SFYZADRCSA-N 1 2 227.739 2.222 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1[nH]nc(C)c1C ZINC000894863546 583536379 /nfs/dbraw/zinc/53/63/79/583536379.db2.gz HUDVNHHWKYBQNP-UHFFFAOYSA-N 1 2 248.330 2.209 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1[nH]nc(C)c1C ZINC000894863546 583536381 /nfs/dbraw/zinc/53/63/81/583536381.db2.gz HUDVNHHWKYBQNP-UHFFFAOYSA-N 1 2 248.330 2.209 20 0 BEADLO COc1cnc(F)c(C[N@@H+]2C[C@H](C)[C@H]2C)c1 ZINC000894862602 583537034 /nfs/dbraw/zinc/53/70/34/583537034.db2.gz ZVISETQRJAJAEJ-DTWKUNHWSA-N 1 2 224.279 2.070 20 0 BEADLO COc1cnc(F)c(C[N@H+]2C[C@H](C)[C@H]2C)c1 ZINC000894862602 583537035 /nfs/dbraw/zinc/53/70/35/583537035.db2.gz ZVISETQRJAJAEJ-DTWKUNHWSA-N 1 2 224.279 2.070 20 0 BEADLO Cc1ncoc1C[N@@H+]1C[C@@]2(CCCO2)[C@H]1C1CC1 ZINC000894866679 583537691 /nfs/dbraw/zinc/53/76/91/583537691.db2.gz XGOINPGDOLGUHE-KGLIPLIRSA-N 1 2 248.326 2.126 20 0 BEADLO Cc1ncoc1C[N@H+]1C[C@@]2(CCCO2)[C@H]1C1CC1 ZINC000894866679 583537692 /nfs/dbraw/zinc/53/76/92/583537692.db2.gz XGOINPGDOLGUHE-KGLIPLIRSA-N 1 2 248.326 2.126 20 0 BEADLO CCC[C@H](CCO)Nc1cccc([C@@H](C)O)[nH+]1 ZINC000894867829 583538515 /nfs/dbraw/zinc/53/85/15/583538515.db2.gz SHVUBDJYVOETKG-GHMZBOCLSA-N 1 2 238.331 2.098 20 0 BEADLO CC(C)c1c[nH]c(CN(C(C)C)C2COC2)[nH+]1 ZINC000894869480 583539667 /nfs/dbraw/zinc/53/96/67/583539667.db2.gz YHJHFBPOCUNCOS-UHFFFAOYSA-N 1 2 237.347 2.142 20 0 BEADLO COCc1ccc(C[NH+]2CC(C(F)(F)F)C2)o1 ZINC000894892035 583548453 /nfs/dbraw/zinc/54/84/53/583548453.db2.gz JKBIZVOIQAXEBF-UHFFFAOYSA-N 1 2 249.232 2.420 20 0 BEADLO CNc1cc(N2CCC(CCF)CC2)nc[nH+]1 ZINC000894905121 583552942 /nfs/dbraw/zinc/55/29/42/583552942.db2.gz AARIBVPAGXVSSJ-UHFFFAOYSA-N 1 2 238.310 2.094 20 0 BEADLO CNc1cc(N2CCC(CCF)CC2)[nH+]cn1 ZINC000894905121 583552944 /nfs/dbraw/zinc/55/29/44/583552944.db2.gz AARIBVPAGXVSSJ-UHFFFAOYSA-N 1 2 238.310 2.094 20 0 BEADLO Cc1cccc(C[NH2+][C@@H]2CCCc3cn[nH]c32)n1 ZINC000857847890 588912338 /nfs/dbraw/zinc/91/23/38/588912338.db2.gz BHMJGIZKSXXTEX-CYBMUJFWSA-N 1 2 242.326 2.280 20 0 BEADLO Cc1cccc(C[NH2+][C@@H]2CCCc3c[nH]nc32)n1 ZINC000857847890 588912339 /nfs/dbraw/zinc/91/23/39/588912339.db2.gz BHMJGIZKSXXTEX-CYBMUJFWSA-N 1 2 242.326 2.280 20 0 BEADLO C/C=C/C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000727056342 583597059 /nfs/dbraw/zinc/59/70/59/583597059.db2.gz OFFJVRJNUHNDNK-ONEGZZNKSA-N 1 2 215.256 2.157 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2CCC[C@@H]2CCO)c1C ZINC000882214757 583598541 /nfs/dbraw/zinc/59/85/41/583598541.db2.gz ZAWNANSUNUUIMZ-VXGBXAGGSA-N 1 2 235.331 2.056 20 0 BEADLO C[C@@H](O)c1cccc(NCCc2ccns2)[nH+]1 ZINC000895131729 583601210 /nfs/dbraw/zinc/60/12/10/583601210.db2.gz ZSYGFFYUEOOPNZ-SECBINFHSA-N 1 2 249.339 2.246 20 0 BEADLO CCc1cc[nH+]cc1N[C@H]1COCC1(C)C ZINC000895141455 583603321 /nfs/dbraw/zinc/60/33/21/583603321.db2.gz APNLXLHLYOIOLZ-LBPRGKRZSA-N 1 2 220.316 2.481 20 0 BEADLO Cc1n[nH]c(C[N@H+]2C[C@@H](C)OCC23CCC3)c1C ZINC000895141443 583603334 /nfs/dbraw/zinc/60/33/34/583603334.db2.gz AJFPUMAIWYKFKS-SNVBAGLBSA-N 1 2 249.358 2.170 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2C[C@@H](C)OCC23CCC3)c1C ZINC000895141443 583603335 /nfs/dbraw/zinc/60/33/35/583603335.db2.gz AJFPUMAIWYKFKS-SNVBAGLBSA-N 1 2 249.358 2.170 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)c1C ZINC000895149432 583605632 /nfs/dbraw/zinc/60/56/32/583605632.db2.gz GYUXOTRGVZNKNS-LLVKDONJSA-N 1 2 241.285 2.258 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CC[C@@]3(CC3(F)F)C2)c1C ZINC000895149432 583605634 /nfs/dbraw/zinc/60/56/34/583605634.db2.gz GYUXOTRGVZNKNS-LLVKDONJSA-N 1 2 241.285 2.258 20 0 BEADLO Cc1noc2ncc(C[N@@H+]3CCC[C@H](F)C3)cc12 ZINC000895150671 583606358 /nfs/dbraw/zinc/60/63/58/583606358.db2.gz NRBQYHZBJUSJJQ-NSHDSACASA-N 1 2 249.289 2.465 20 0 BEADLO Cc1noc2ncc(C[N@H+]3CCC[C@H](F)C3)cc12 ZINC000895150671 583606359 /nfs/dbraw/zinc/60/63/59/583606359.db2.gz NRBQYHZBJUSJJQ-NSHDSACASA-N 1 2 249.289 2.465 20 0 BEADLO COc1ccc(C[N@@H+]2CCC[C@@H](F)C2)o1 ZINC000895192308 583621675 /nfs/dbraw/zinc/62/16/75/583621675.db2.gz YVTNEZFQDNPYOK-SECBINFHSA-N 1 2 213.252 2.222 20 0 BEADLO COc1ccc(C[N@H+]2CCC[C@@H](F)C2)o1 ZINC000895192308 583621676 /nfs/dbraw/zinc/62/16/76/583621676.db2.gz YVTNEZFQDNPYOK-SECBINFHSA-N 1 2 213.252 2.222 20 0 BEADLO COc1ccc(C[N@@H+]2CCC[C@H](F)C2)nc1 ZINC000895191903 583621854 /nfs/dbraw/zinc/62/18/54/583621854.db2.gz UOSDOGMJHOBYCP-JTQLQIEISA-N 1 2 224.279 2.024 20 0 BEADLO COc1ccc(C[N@H+]2CCC[C@H](F)C2)nc1 ZINC000895191903 583621856 /nfs/dbraw/zinc/62/18/56/583621856.db2.gz UOSDOGMJHOBYCP-JTQLQIEISA-N 1 2 224.279 2.024 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2[C@@H](C)[C@H](C)O[C@H]2C)c1C ZINC000882660418 583628689 /nfs/dbraw/zinc/62/86/89/583628689.db2.gz SCKGOMMCSZHCGE-VGDYDELISA-N 1 2 235.331 2.317 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2cnc[nH]2)c(C)c1 ZINC000895302617 583644927 /nfs/dbraw/zinc/64/49/27/583644927.db2.gz NFGYLIPNKKIAKP-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2cnc[nH]2)c(C)c1 ZINC000895302617 583644929 /nfs/dbraw/zinc/64/49/29/583644929.db2.gz NFGYLIPNKKIAKP-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2c[nH]cn2)c(C)c1 ZINC000895302617 583644931 /nfs/dbraw/zinc/64/49/31/583644931.db2.gz NFGYLIPNKKIAKP-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2c[nH]cn2)c(C)c1 ZINC000895302617 583644932 /nfs/dbraw/zinc/64/49/32/583644932.db2.gz NFGYLIPNKKIAKP-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO CC(=O)OC[C@H](C)Nc1c[nH+]cc2c1CCCC2 ZINC000895308432 583646689 /nfs/dbraw/zinc/64/66/89/583646689.db2.gz IJLMTLMKZUBCKZ-JTQLQIEISA-N 1 2 248.326 2.324 20 0 BEADLO C[C@H](CCO)Nc1c[nH+]cc2c1CCCC2 ZINC000895310171 583647161 /nfs/dbraw/zinc/64/71/61/583647161.db2.gz RQCRFXSOFHUFBS-SNVBAGLBSA-N 1 2 220.316 2.143 20 0 BEADLO Cc1ncoc1C[NH2+][C@H](C)c1ccns1 ZINC000895411369 583666593 /nfs/dbraw/zinc/66/65/93/583666593.db2.gz OIXLTHUSEQVWAX-MRVPVSSYSA-N 1 2 223.301 2.290 20 0 BEADLO Cc1coc(C[N@@H+]2CCO[C@H](CCF)C2)c1 ZINC000895404365 583667272 /nfs/dbraw/zinc/66/72/72/583667272.db2.gz FDQWXXLXVWALOH-LLVKDONJSA-N 1 2 227.279 2.148 20 0 BEADLO Cc1coc(C[N@H+]2CCO[C@H](CCF)C2)c1 ZINC000895404365 583667275 /nfs/dbraw/zinc/66/72/75/583667275.db2.gz FDQWXXLXVWALOH-LLVKDONJSA-N 1 2 227.279 2.148 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CC[C@H]1C(F)F ZINC000895430874 583670386 /nfs/dbraw/zinc/67/03/86/583670386.db2.gz JBRAKDSFBIOPRM-VIFPVBQESA-N 1 2 229.274 2.303 20 0 BEADLO CC[C@@](C)(C[N@@H+]1CC[C@H]1C(F)F)OC ZINC000895431994 583670802 /nfs/dbraw/zinc/67/08/02/583670802.db2.gz SEOPWMIPDJSXIK-WPRPVWTQSA-N 1 2 207.264 2.141 20 0 BEADLO CC[C@@](C)(C[N@H+]1CC[C@H]1C(F)F)OC ZINC000895431994 583670803 /nfs/dbraw/zinc/67/08/03/583670803.db2.gz SEOPWMIPDJSXIK-WPRPVWTQSA-N 1 2 207.264 2.141 20 0 BEADLO FC(F)[C@@H]1CC[N@@H+]1C[C@@H]1CCSC1 ZINC000895432859 583671415 /nfs/dbraw/zinc/67/14/15/583671415.db2.gz QUFMLFSFXXXIBP-YUMQZZPRSA-N 1 2 207.289 2.079 20 0 BEADLO FC(F)[C@@H]1CC[N@H+]1C[C@@H]1CCSC1 ZINC000895432859 583671416 /nfs/dbraw/zinc/67/14/16/583671416.db2.gz QUFMLFSFXXXIBP-YUMQZZPRSA-N 1 2 207.289 2.079 20 0 BEADLO CC(=O)OC[C@H](C)[NH2+]CC(F)(F)C(C)(C)C ZINC000895461576 583678130 /nfs/dbraw/zinc/67/81/30/583678130.db2.gz RLUATNKTOSOBKM-QMMMGPOBSA-N 1 2 237.290 2.209 20 0 BEADLO C[C@@H]1C[C@H]1[C@@H]1C[C@H]1Nc1nc[nH+]c(N)c1Cl ZINC000895541152 583687756 /nfs/dbraw/zinc/68/77/56/583687756.db2.gz PMCCQVHEGPNTEC-OOJXKGFFSA-N 1 2 238.722 2.169 20 0 BEADLO C[C@@H]1C[C@H]1[C@@H]1C[C@H]1Nc1[nH+]cnc(N)c1Cl ZINC000895541152 583687757 /nfs/dbraw/zinc/68/77/57/583687757.db2.gz PMCCQVHEGPNTEC-OOJXKGFFSA-N 1 2 238.722 2.169 20 0 BEADLO CCC(F)(F)C[NH2+]Cc1cnn(C)c1C1CC1 ZINC000895597504 583695627 /nfs/dbraw/zinc/69/56/27/583695627.db2.gz MJYSIGPPTUCHMR-UHFFFAOYSA-N 1 2 243.301 2.432 20 0 BEADLO CC(C)c1nnc(C[NH2+]CC(C)(C)F)s1 ZINC000895690345 583707337 /nfs/dbraw/zinc/70/73/37/583707337.db2.gz ATZWYNAPGMDPSR-UHFFFAOYSA-N 1 2 231.340 2.499 20 0 BEADLO C[C@@H]1CCN(c2[nH]c3ccccc3[nH+]2)CCO1 ZINC000895759016 583721380 /nfs/dbraw/zinc/72/13/80/583721380.db2.gz SMXDWHVAEVBNMD-SNVBAGLBSA-N 1 2 231.299 2.178 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2ccns2)o1 ZINC000895810413 583730241 /nfs/dbraw/zinc/73/02/41/583730241.db2.gz CKJJHVIUACYMEC-UHFFFAOYSA-N 1 2 238.312 2.377 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2ccns2)o1 ZINC000895810413 583730243 /nfs/dbraw/zinc/73/02/43/583730243.db2.gz CKJJHVIUACYMEC-UHFFFAOYSA-N 1 2 238.312 2.377 20 0 BEADLO CC/C(C)=C(/C)C(=O)N[C@@H]1CCn2c[nH+]cc2C1 ZINC000857946643 588924985 /nfs/dbraw/zinc/92/49/85/588924985.db2.gz XJBDJLFCTHIJNI-NLYDNYMLSA-N 1 2 247.342 2.061 20 0 BEADLO Cc1ccc(CC[C@H](C)[NH2+][C@H]2CCOC2=O)cc1 ZINC000895804928 583732281 /nfs/dbraw/zinc/73/22/81/583732281.db2.gz ONXQGVGMLKALCW-JSGCOSHPSA-N 1 2 247.338 2.221 20 0 BEADLO C[C@@H]1COC[C@H]1Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000895904299 583742995 /nfs/dbraw/zinc/74/29/95/583742995.db2.gz BHWOVDYCEKXZEN-NXEZZACHSA-N 1 2 235.331 2.221 20 0 BEADLO C[C@H]1CC=C(C(=O)N[C@H]2CCn3c[nH+]cc32)CC1 ZINC000857976312 588926076 /nfs/dbraw/zinc/92/60/76/588926076.db2.gz AZIOTDHPHOQBLU-JQWIXIFHSA-N 1 2 245.326 2.191 20 0 BEADLO C[C@@H](C(=O)N[C@H]1CCn2c[nH+]cc21)C(C)(C)C ZINC000857987646 588926398 /nfs/dbraw/zinc/92/63/98/588926398.db2.gz XMUJXGBCECTMPC-UWVGGRQHSA-N 1 2 235.331 2.126 20 0 BEADLO CCc1onc(C)c1C[NH+]1CC(OC(C)C)C1 ZINC000895956630 583752664 /nfs/dbraw/zinc/75/26/64/583752664.db2.gz PWCZADNZKMOEKZ-UHFFFAOYSA-N 1 2 238.331 2.155 20 0 BEADLO C[C@@]1(C(=O)N[C@H]2CCn3c[nH+]cc32)CC=CCC1 ZINC000857977779 588926799 /nfs/dbraw/zinc/92/67/99/588926799.db2.gz ZINFXCQWBOMTSD-SMDDNHRTSA-N 1 2 245.326 2.191 20 0 BEADLO COCC1C[NH+](Cc2ccc(Cl)o2)C1 ZINC000895970709 583756106 /nfs/dbraw/zinc/75/61/06/583756106.db2.gz FDAMGPBMMWZDOG-UHFFFAOYSA-N 1 2 215.680 2.011 20 0 BEADLO COCC1C[NH+](Cc2ncc(C(C)C)s2)C1 ZINC000895971914 583756126 /nfs/dbraw/zinc/75/61/26/583756126.db2.gz WZHYRXCSKMMXDE-UHFFFAOYSA-N 1 2 240.372 2.345 20 0 BEADLO FC1CC[NH+](Cc2nccn2C2CC2)CC1 ZINC000895999525 583760353 /nfs/dbraw/zinc/76/03/53/583760353.db2.gz ITHUQLUTKGNMQD-UHFFFAOYSA-N 1 2 223.295 2.152 20 0 BEADLO CC/C(C)=C(\C)C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857979234 588927171 /nfs/dbraw/zinc/92/71/71/588927171.db2.gz ACDIPHAHQSFOGG-PBQZMEPESA-N 1 2 233.315 2.191 20 0 BEADLO C[C@@H]1CCC[C@]1(C)C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857979602 588927487 /nfs/dbraw/zinc/92/74/87/588927487.db2.gz WUJOAFJXPGMBMB-SUNKGSAMSA-N 1 2 247.342 2.270 20 0 BEADLO Cc1cc(F)ncc1C[NH2+][C@H](C)C(F)F ZINC000896038571 583766372 /nfs/dbraw/zinc/76/63/72/583766372.db2.gz SNJANRJKAIZJMK-SSDOTTSWSA-N 1 2 218.222 2.272 20 0 BEADLO C[C@H]([NH2+]Cc1cnn(C)c1C1CC1)C(F)F ZINC000896038229 583766403 /nfs/dbraw/zinc/76/64/03/583766403.db2.gz MOJHYDNNGRFBMA-ZETCQYMHSA-N 1 2 229.274 2.041 20 0 BEADLO CC1(C)CC[C@H](C(=O)N[C@H]2CCn3c[nH+]cc32)C1 ZINC000857981958 588928078 /nfs/dbraw/zinc/92/80/78/588928078.db2.gz KIGNJDFOHFPPRB-QWRGUYRKSA-N 1 2 247.342 2.270 20 0 BEADLO CCC1(C(=O)N[C@@H]2CCn3c[nH+]cc32)CCC1 ZINC000857982131 588928192 /nfs/dbraw/zinc/92/81/92/588928192.db2.gz FZFLTNSZYCIQGH-SNVBAGLBSA-N 1 2 233.315 2.024 20 0 BEADLO CC1(C)CC[C@H](C(=O)N[C@@H]2CCn3c[nH+]cc32)C1 ZINC000857981959 588928292 /nfs/dbraw/zinc/92/82/92/588928292.db2.gz KIGNJDFOHFPPRB-WDEREUQCSA-N 1 2 247.342 2.270 20 0 BEADLO CCC1(C(=O)N[C@H]2CCn3c[nH+]cc32)CCCC1 ZINC000857984504 588928406 /nfs/dbraw/zinc/92/84/06/588928406.db2.gz BPSWJQSATURMKD-NSHDSACASA-N 1 2 247.342 2.415 20 0 BEADLO c1ccc(NC[C@@H]2CCC3(CCOCC3)O2)[nH+]c1 ZINC000896170028 583777329 /nfs/dbraw/zinc/77/73/29/583777329.db2.gz JNEZODNDJOQORR-LBPRGKRZSA-N 1 2 248.326 2.222 20 0 BEADLO CCC[C@@H](O)CCNc1cc[nH+]c(CC)n1 ZINC000896183531 583779197 /nfs/dbraw/zinc/77/91/97/583779197.db2.gz NGPGDCSTKQRFGL-SNVBAGLBSA-N 1 2 223.320 2.002 20 0 BEADLO CCCC1(C(=O)N[C@H]2CCn3c[nH+]cc32)CCC1 ZINC000857983388 588928794 /nfs/dbraw/zinc/92/87/94/588928794.db2.gz QSFMOGVKPUUEKA-NSHDSACASA-N 1 2 247.342 2.415 20 0 BEADLO CCC[C@@H](O)CCNc1cc(CC)[nH+]cn1 ZINC000896185410 583780433 /nfs/dbraw/zinc/78/04/33/583780433.db2.gz BVMOCUZROHQPID-LLVKDONJSA-N 1 2 223.320 2.002 20 0 BEADLO CCC[C@@H](O)CCNc1cc[nH+]c(C2CC2)n1 ZINC000896185791 583781187 /nfs/dbraw/zinc/78/11/87/583781187.db2.gz AOGBGLTVGCLBQB-LLVKDONJSA-N 1 2 235.331 2.317 20 0 BEADLO Cc1cc(N[C@@H]2CCS[C@H](C)C2)nc[nH+]1 ZINC000896245257 583784853 /nfs/dbraw/zinc/78/48/53/583784853.db2.gz LHHUMARNQHLJKO-NXEZZACHSA-N 1 2 223.345 2.481 20 0 BEADLO O=C(CC1=CCCCC1)N[C@H]1CCn2c[nH+]cc21 ZINC000857986652 588929479 /nfs/dbraw/zinc/92/94/79/588929479.db2.gz OCLLYIGAJROCOW-LBPRGKRZSA-N 1 2 245.326 2.335 20 0 BEADLO Cn1c2ccccc2[nH+]c1NCC(F)F ZINC000147892263 583788684 /nfs/dbraw/zinc/78/86/84/583788684.db2.gz VJGXMIVEUIQXKP-UHFFFAOYSA-N 1 2 211.215 2.250 20 0 BEADLO CC(C)(C)/C=C/C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857985965 588929497 /nfs/dbraw/zinc/92/94/97/588929497.db2.gz MTNHCXTVHRXTMY-RWCYGVJQSA-N 1 2 233.315 2.046 20 0 BEADLO C/C=C/C=C\C(=O)N1CCNc2[nH+]cc(C)cc21 ZINC000857995081 588929855 /nfs/dbraw/zinc/92/98/55/588929855.db2.gz ZKSNDVFYOMRGEL-ICWBMWKASA-N 1 2 243.310 2.281 20 0 BEADLO CCO[C@H]1CCN(c2[nH+]c3ccccc3n2C)C1 ZINC000896406960 583800647 /nfs/dbraw/zinc/80/06/47/583800647.db2.gz NWMNOCVKCSEVOE-NSHDSACASA-N 1 2 245.326 2.189 20 0 BEADLO CC(C)[C@H](Nc1cc[nH+]cc1F)c1cnn(C)c1 ZINC000896422587 583801845 /nfs/dbraw/zinc/80/18/45/583801845.db2.gz LTPSRHDQAVSCLM-ZDUSSCGKSA-N 1 2 248.305 2.185 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N2C[C@H](C)[C@H](C)C2)c[nH+]1 ZINC000896755823 583830764 /nfs/dbraw/zinc/83/07/64/583830764.db2.gz CISHFSOBIALDRG-PHIMTYICSA-N 1 2 249.358 2.041 20 0 BEADLO CCc1nc(NC[C@@H]2CC[C@H](C3CC3)O2)cc[nH+]1 ZINC000896800216 583834770 /nfs/dbraw/zinc/83/47/70/583834770.db2.gz ZHIIBODALMMFKC-NWDGAFQWSA-N 1 2 247.342 2.409 20 0 BEADLO CCc1nc(NCC2(C3(O)CCC3)CC2)cc[nH+]1 ZINC000896812700 583835990 /nfs/dbraw/zinc/83/59/90/583835990.db2.gz XVUIPGYFDXHBLI-UHFFFAOYSA-N 1 2 247.342 2.146 20 0 BEADLO C[C@@H]1C[C@H]([NH2+]Cc2ccnc(F)c2)c2nccn21 ZINC000858171740 588936521 /nfs/dbraw/zinc/93/65/21/588936521.db2.gz BTSSCYVJONLTCB-KOLCDFICSA-N 1 2 246.289 2.213 20 0 BEADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1ccnc(F)c1 ZINC000858172036 588936758 /nfs/dbraw/zinc/93/67/58/588936758.db2.gz HKNUFRKLNVCGCX-SNVBAGLBSA-N 1 2 248.305 2.288 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H]2CC[C@@H]3C[C@@H]3C2)[nH+]c1C ZINC000896909981 583852635 /nfs/dbraw/zinc/85/26/35/583852635.db2.gz JTYVQQMPAYZGAY-IJLUTSLNSA-N 1 2 247.342 2.079 20 0 BEADLO Cc1[nH]c(CNC(=O)C[C@H]2C=CCCC2)[nH+]c1C ZINC000896913431 583853874 /nfs/dbraw/zinc/85/38/74/583853874.db2.gz FFUNSNPFVNRVKO-LBPRGKRZSA-N 1 2 247.342 2.389 20 0 BEADLO Cc1[nH]c(CNC(=O)C[C@H]2CCC[C@H]2C)[nH+]c1C ZINC000896913103 583853938 /nfs/dbraw/zinc/85/39/38/583853938.db2.gz ADKVYNYPZWZEDW-BXKDBHETSA-N 1 2 249.358 2.469 20 0 BEADLO Cc1[nH]c(CNC(=O)C[C@@H]2CCC[C@H]2C)[nH+]c1C ZINC000896913120 583854050 /nfs/dbraw/zinc/85/40/50/583854050.db2.gz ADKVYNYPZWZEDW-SKDRFNHKSA-N 1 2 249.358 2.469 20 0 BEADLO Cc1[nH]c(CNC(=O)c2ccsc2)[nH+]c1C ZINC000896928444 583859509 /nfs/dbraw/zinc/85/95/09/583859509.db2.gz VDISSGOGVQPXKG-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO CCc1nc(NC2CC3(C2)CO[C@@H](C)C3)cc[nH+]1 ZINC000897045942 583872828 /nfs/dbraw/zinc/87/28/28/583872828.db2.gz WOFPQENQOXKXPB-IFQILLTASA-N 1 2 247.342 2.409 20 0 BEADLO CCCCc1cc(N[C@@H]2CC23CC(O)C3)nc[nH+]1 ZINC000897087001 583878508 /nfs/dbraw/zinc/87/85/08/583878508.db2.gz JKKKVVQLIUCCKQ-MBHSVXNSSA-N 1 2 247.342 2.145 20 0 BEADLO CC(C)c1nc(N[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@H]23)cc[nH+]1 ZINC000897078694 583878949 /nfs/dbraw/zinc/87/89/49/583878949.db2.gz UZCLZKKVAHKWRO-OQEOFVATSA-N 1 2 245.326 2.188 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N(C)CCC2CC2)c[nH+]1 ZINC000897144387 583885439 /nfs/dbraw/zinc/88/54/39/583885439.db2.gz PCAFMHACEYKYML-UHFFFAOYSA-N 1 2 249.358 2.185 20 0 BEADLO CO[C@H]1CC[C@@H]1N(C)c1nc(C)[nH+]c(C)c1C ZINC000897146849 583885508 /nfs/dbraw/zinc/88/55/08/583885508.db2.gz CCRNIPDHUDEWDL-RYUDHWBXSA-N 1 2 235.331 2.015 20 0 BEADLO Cc1cc(N[C@@H]2C[C@H]3CCC[C@H]32)nc[nH+]1 ZINC000897176233 583889217 /nfs/dbraw/zinc/88/92/17/583889217.db2.gz QHPQTIJIMRSNCU-GMTAPVOTSA-N 1 2 203.289 2.386 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1C[C@@H]2CCC[C@@H]12 ZINC000897177232 583889930 /nfs/dbraw/zinc/88/99/30/583889930.db2.gz LVUSDWRDDRPCKG-HBNTYKKESA-N 1 2 233.315 2.394 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1C[C@@H]2CCC[C@H]12 ZINC000897177010 583889966 /nfs/dbraw/zinc/88/99/66/583889966.db2.gz IMQROFMZRAFLGU-HOTUBEGUSA-N 1 2 206.264 2.243 20 0 BEADLO C/C=C/C=C/C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000728542126 583896745 /nfs/dbraw/zinc/89/67/45/583896745.db2.gz MGLNFJFGSOBAGS-ADOIESLVSA-N 1 2 245.326 2.179 20 0 BEADLO CC/C=C(/C)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000728539253 583897144 /nfs/dbraw/zinc/89/71/44/583897144.db2.gz VVEXQUFPHWNDJA-QWGHSUKYSA-N 1 2 247.342 2.403 20 0 BEADLO O=C(OCCn1cc[nH+]c1)[C@]12C[C@H]1CCCC2 ZINC000869704151 583899395 /nfs/dbraw/zinc/89/93/95/583899395.db2.gz NZVACQYUDWMTPX-DGCLKSJQSA-N 1 2 234.299 2.007 20 0 BEADLO CCn1c[nH+]c2c1CCN(Cc1occc1C)C2 ZINC000897334168 583924483 /nfs/dbraw/zinc/92/44/83/583924483.db2.gz MMBBFXXAXKSUDQ-UHFFFAOYSA-N 1 2 245.326 2.363 20 0 BEADLO CCc1ccc([N@H+](CC)CCCO)cc1 ZINC000728918021 583936461 /nfs/dbraw/zinc/93/64/61/583936461.db2.gz RWTREIUXXVWUGP-UHFFFAOYSA-N 1 2 207.317 2.458 20 0 BEADLO CCc1ccc([N@@H+](CC)CCCO)cc1 ZINC000728918021 583936463 /nfs/dbraw/zinc/93/64/63/583936463.db2.gz RWTREIUXXVWUGP-UHFFFAOYSA-N 1 2 207.317 2.458 20 0 BEADLO O[C@@H]1CCN(c2[nH+]ccc3ccccc32)C[C@@H]1F ZINC000897380312 583946779 /nfs/dbraw/zinc/94/67/79/583946779.db2.gz OOMBKEJGHXIASC-QWHCGFSZSA-N 1 2 246.285 2.144 20 0 BEADLO c1[nH]cc(-c2cccc(CO[C@H]3CCOC3)c2)[nH+]1 ZINC000653510785 583959998 /nfs/dbraw/zinc/95/99/98/583959998.db2.gz MHMFYDYZJMCQLE-ZDUSSCGKSA-N 1 2 244.294 2.382 20 0 BEADLO CC(C)Cc1cc(NC[C@@H]2CCCO2)nc[nH+]1 ZINC000865398563 584018151 /nfs/dbraw/zinc/01/81/51/584018151.db2.gz YRHWMZZXZXXCQJ-LBPRGKRZSA-N 1 2 235.331 2.266 20 0 BEADLO c1nc(CNc2ccc(C3CC3)c[nH+]2)c[nH]1 ZINC000897715058 584043677 /nfs/dbraw/zinc/04/36/77/584043677.db2.gz DWICSBZONLMHQT-UHFFFAOYSA-N 1 2 214.272 2.294 20 0 BEADLO Cn1cncc1C[NH2+][C@H]1CCCc2scnc21 ZINC000858418314 588952910 /nfs/dbraw/zinc/95/29/10/588952910.db2.gz PXNWDTOCAZONDY-JTQLQIEISA-N 1 2 248.355 2.044 20 0 BEADLO CC/C=C/CNC(=O)C(C)(C)n1c[nH+]c(C)c1 ZINC000897893306 584057623 /nfs/dbraw/zinc/05/76/23/584057623.db2.gz XOZBBNCRIWMMHB-VOTSOKGWSA-N 1 2 235.331 2.009 20 0 BEADLO Fc1nccnc1N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000858437292 588954640 /nfs/dbraw/zinc/95/46/40/588954640.db2.gz XLXMWABXKZJWOW-SECBINFHSA-N 1 2 247.277 2.070 20 0 BEADLO Cc1nnsc1C[NH+]1CC(Cc2ccoc2)C1 ZINC000898159713 584087558 /nfs/dbraw/zinc/08/75/58/584087558.db2.gz DFBDHWATXJZZBI-UHFFFAOYSA-N 1 2 249.339 2.114 20 0 BEADLO Cc1cccc(C[N@@H+]2CC[C@@H](O)[C@@H](F)C2)c1F ZINC000898187521 584094285 /nfs/dbraw/zinc/09/42/85/584094285.db2.gz GIYZAMVAPXVIPW-NWDGAFQWSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cccc(C[N@H+]2CC[C@@H](O)[C@@H](F)C2)c1F ZINC000898187521 584094286 /nfs/dbraw/zinc/09/42/86/584094286.db2.gz GIYZAMVAPXVIPW-NWDGAFQWSA-N 1 2 241.281 2.039 20 0 BEADLO COC(=O)[C@@H]([NH2+][C@@H]1CC[C@H]1C)c1ccccc1 ZINC000898336590 584111811 /nfs/dbraw/zinc/11/18/11/584111811.db2.gz UJHICBNIEKQRAU-RTXFEEFZSA-N 1 2 233.311 2.289 20 0 BEADLO Fc1cccc(OCCC[NH2+]Cc2ccn[nH]2)c1 ZINC000898445791 584136681 /nfs/dbraw/zinc/13/66/81/584136681.db2.gz NQIYGZKPNWSZLQ-UHFFFAOYSA-N 1 2 249.289 2.108 20 0 BEADLO CCC[C@H](CC)C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000898809547 584160007 /nfs/dbraw/zinc/16/00/07/584160007.db2.gz ATOGLDYMLJYQQM-WDEREUQCSA-N 1 2 235.331 2.270 20 0 BEADLO CC(C)(CNC(=O)CCC1CCC1)n1cc[nH+]c1 ZINC000898903666 584165064 /nfs/dbraw/zinc/16/50/64/584165064.db2.gz HTTDGDAXPVUFDL-UHFFFAOYSA-N 1 2 249.358 2.315 20 0 BEADLO COc1ccc[nH+]c1N1CCC[C@@](C)(F)C1 ZINC000858557307 588965447 /nfs/dbraw/zinc/96/54/47/588965447.db2.gz YBASZGQNQWIDSJ-GFCCVEGCSA-N 1 2 224.279 2.419 20 0 BEADLO Cc1ccc([C@@H](O)C[NH+]2CC(OC(C)C)C2)cc1 ZINC000899901239 584250390 /nfs/dbraw/zinc/25/03/90/584250390.db2.gz GLQSQHBXDYFARZ-HNNXBMFYSA-N 1 2 249.354 2.138 20 0 BEADLO CCN(C(=O)Cc1c[nH+]c[nH]1)C1CCCCC1 ZINC000900118246 584274660 /nfs/dbraw/zinc/27/46/60/584274660.db2.gz MVGVIJMGOOBISB-UHFFFAOYSA-N 1 2 235.331 2.133 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)c1nc(Cl)cs1 ZINC000858621134 588971549 /nfs/dbraw/zinc/97/15/49/588971549.db2.gz STWDKKDIMDNAOA-UHFFFAOYSA-N 1 2 228.708 2.156 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)c1nc(Cl)cs1 ZINC000858621134 588971550 /nfs/dbraw/zinc/97/15/50/588971550.db2.gz STWDKKDIMDNAOA-UHFFFAOYSA-N 1 2 228.708 2.156 20 0 BEADLO CCN(C(=O)[C@H]1CCn2cc(C)[nH+]c2C1)C(C)C ZINC000858666319 588973579 /nfs/dbraw/zinc/97/35/79/588973579.db2.gz FNTHRSYIOBZSMO-LBPRGKRZSA-N 1 2 249.358 2.011 20 0 BEADLO CCN(C(=O)[C@@H]1CCn2cc(C)[nH+]c2C1)C(C)C ZINC000858666318 588973696 /nfs/dbraw/zinc/97/36/96/588973696.db2.gz FNTHRSYIOBZSMO-GFCCVEGCSA-N 1 2 249.358 2.011 20 0 BEADLO CC(C)(C)CCCCNC(=O)Cc1c[nH]c[nH+]1 ZINC000900575779 584327421 /nfs/dbraw/zinc/32/74/21/584327421.db2.gz HWYHNTJFGXKNEA-UHFFFAOYSA-N 1 2 237.347 2.285 20 0 BEADLO CC(C)(C)CCCCNC(=O)Cc1c[nH+]c[nH]1 ZINC000900575779 584327423 /nfs/dbraw/zinc/32/74/23/584327423.db2.gz HWYHNTJFGXKNEA-UHFFFAOYSA-N 1 2 237.347 2.285 20 0 BEADLO CC[C@H](C)[C@@H](C)N(C(=O)Cc1c[nH+]c[nH]1)C1CC1 ZINC000900588191 584328931 /nfs/dbraw/zinc/32/89/31/584328931.db2.gz MXEFYEAAPYPUBM-WDEREUQCSA-N 1 2 249.358 2.378 20 0 BEADLO CC(C)[C@@H]1CCCN(C(=O)Cc2c[nH+]c[nH]2)CC1 ZINC000900721819 584345049 /nfs/dbraw/zinc/34/50/49/584345049.db2.gz OMBNMEDLTAGNAF-GFCCVEGCSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H]1CCC[C@H](CCNC(=O)Cc2c[nH]c[nH+]2)C1 ZINC000900733161 584346903 /nfs/dbraw/zinc/34/69/03/584346903.db2.gz ZCRWBOPIZFXDFF-VXGBXAGGSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1CCC[C@H](CCNC(=O)Cc2c[nH+]c[nH]2)C1 ZINC000900733161 584346905 /nfs/dbraw/zinc/34/69/05/584346905.db2.gz ZCRWBOPIZFXDFF-VXGBXAGGSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)Cc1c[nH+]c[nH]1 ZINC000900737190 584347512 /nfs/dbraw/zinc/34/75/12/584347512.db2.gz RUTFHTAIFMPNRC-MDZLAQPJSA-N 1 2 247.342 2.132 20 0 BEADLO C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)Cc1c[nH+]c[nH]1 ZINC000900737191 584347518 /nfs/dbraw/zinc/34/75/18/584347518.db2.gz RUTFHTAIFMPNRC-NQBHXWOUSA-N 1 2 247.342 2.132 20 0 BEADLO CC[C@@H](C)[C@@H]1CCCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC000900771790 584349397 /nfs/dbraw/zinc/34/93/97/584349397.db2.gz DFSCOIFZNFUKDV-YPMHNXCESA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H](CCC(C)(C)C)NC(=O)Cc1c[nH]c[nH+]1 ZINC000900765340 584353736 /nfs/dbraw/zinc/35/37/36/584353736.db2.gz VYCYOOWAQGSQBK-SNVBAGLBSA-N 1 2 237.347 2.283 20 0 BEADLO C[C@H](CCC(C)(C)C)NC(=O)Cc1c[nH+]c[nH]1 ZINC000900765340 584353737 /nfs/dbraw/zinc/35/37/37/584353737.db2.gz VYCYOOWAQGSQBK-SNVBAGLBSA-N 1 2 237.347 2.283 20 0 BEADLO CCC[C@H]1[C@@H](C)CCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC000900870519 584363849 /nfs/dbraw/zinc/36/38/49/584363849.db2.gz UEONNFVSYXSHFM-AAEUAGOBSA-N 1 2 249.358 2.379 20 0 BEADLO CC/C(C)=C(/C)C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000900997139 584375049 /nfs/dbraw/zinc/37/50/49/584375049.db2.gz JVOPHSCKCLFOFI-HJWRWDBZSA-N 1 2 235.331 2.389 20 0 BEADLO CCC(C)=C(C)C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000900997139 584375050 /nfs/dbraw/zinc/37/50/50/584375050.db2.gz JVOPHSCKCLFOFI-HJWRWDBZSA-N 1 2 235.331 2.389 20 0 BEADLO Cc1[nH]c(CNC(=O)C2=C(C)CCC2)[nH+]c1C ZINC000900996163 584375151 /nfs/dbraw/zinc/37/51/51/584375151.db2.gz DMPPVYXMUDTRSS-UHFFFAOYSA-N 1 2 233.315 2.143 20 0 BEADLO CCC[C@@H](C)[C@H]1CCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC000901116301 584385920 /nfs/dbraw/zinc/38/59/20/584385920.db2.gz CNWCWENLMMTZSY-DGCLKSJQSA-N 1 2 249.358 2.379 20 0 BEADLO CCC[C@@H](C)[C@@H]1CCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC000901116305 584386447 /nfs/dbraw/zinc/38/64/47/584386447.db2.gz CNWCWENLMMTZSY-YPMHNXCESA-N 1 2 249.358 2.379 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)Nc1ccc(C2CC2)cc1 ZINC000901302416 584419446 /nfs/dbraw/zinc/41/94/46/584419446.db2.gz JQMRDQSXBXVMBT-UHFFFAOYSA-N 1 2 241.294 2.468 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)Nc1ccc(C2CC2)cc1 ZINC000901302416 584419447 /nfs/dbraw/zinc/41/94/47/584419447.db2.gz JQMRDQSXBXVMBT-UHFFFAOYSA-N 1 2 241.294 2.468 20 0 BEADLO COC/C(C)=C\CSc1nc(N)cc(C)[nH+]1 ZINC000901415450 584441400 /nfs/dbraw/zinc/44/14/00/584441400.db2.gz IDUJPQCHUQAOAI-YWEYNIOJSA-N 1 2 239.344 2.052 20 0 BEADLO CC(C)CCOC(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000858903656 588983945 /nfs/dbraw/zinc/98/39/45/588983945.db2.gz XZVRQBPWTCOJLJ-NSHDSACASA-N 1 2 239.319 2.044 20 0 BEADLO C[C@H](O)CC[NH2+]c1ccc2c(c1)C[C@H](C)O2 ZINC000901445411 584446863 /nfs/dbraw/zinc/44/68/63/584446863.db2.gz BBWBXLCTVYVSKX-UWVGGRQHSA-N 1 2 221.300 2.193 20 0 BEADLO CC(C)n1c[nH+]cc1/C=C/c1cnccn1 ZINC000901462437 584450887 /nfs/dbraw/zinc/45/08/87/584450887.db2.gz UQFRRMDTXOIOBE-ONEGZZNKSA-N 1 2 214.272 2.424 20 0 BEADLO CC(C)n1c[nH+]cc1/C=C\c1ccncn1 ZINC000901490143 584452445 /nfs/dbraw/zinc/45/24/45/584452445.db2.gz RXJILGLOARQJIF-ARJAWSKDSA-N 1 2 214.272 2.424 20 0 BEADLO Cc1cc(C)nc(COCc2[nH]cc[nH+]2)c1 ZINC000901530875 584459324 /nfs/dbraw/zinc/45/93/24/584459324.db2.gz VXFUXSFFBNCSSC-UHFFFAOYSA-N 1 2 217.272 2.138 20 0 BEADLO CC(C)n1c[nH+]cc1C=Cc1c[nH]c(C=O)n1 ZINC000901555267 584462570 /nfs/dbraw/zinc/46/25/70/584462570.db2.gz RKMZZCUAMCOHBR-ARJAWSKDSA-N 1 2 230.271 2.170 20 0 BEADLO CCO[C@H](C)Sc1nc(N)cc(CC)[nH+]1 ZINC000901547785 584464406 /nfs/dbraw/zinc/46/44/06/584464406.db2.gz LOAIZFWLDYWFRO-ZETCQYMHSA-N 1 2 227.333 2.096 20 0 BEADLO Cn1cc[nH+]c1CSCc1ccncc1 ZINC000901629361 584470619 /nfs/dbraw/zinc/47/06/19/584470619.db2.gz CLHRIYCMODILJX-UHFFFAOYSA-N 1 2 219.313 2.249 20 0 BEADLO Cn1c[nH+]cc1CSCc1ccncc1 ZINC000901630916 584471131 /nfs/dbraw/zinc/47/11/31/584471131.db2.gz QIYCEICZVFNPEX-UHFFFAOYSA-N 1 2 219.313 2.249 20 0 BEADLO Cc1cccn2cc(CSC3COC3)[nH+]c12 ZINC000901641576 584473561 /nfs/dbraw/zinc/47/35/61/584473561.db2.gz GDGGUAUGRLLUFR-UHFFFAOYSA-N 1 2 234.324 2.275 20 0 BEADLO CCCOC(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000858943186 588986681 /nfs/dbraw/zinc/98/66/81/588986681.db2.gz GISXCIRMPBOEID-LLVKDONJSA-N 1 2 237.303 2.067 20 0 BEADLO CCn1cnc(C[NH2+]Cc2ccccc2F)c1 ZINC000902034902 584514401 /nfs/dbraw/zinc/51/44/01/584514401.db2.gz NVGQJXBFZHYKEW-UHFFFAOYSA-N 1 2 233.290 2.332 20 0 BEADLO Cc1[nH]c(CNc2ccc(F)cn2)[nH+]c1C ZINC000902042714 584515728 /nfs/dbraw/zinc/51/57/28/584515728.db2.gz NKLJTZYARTVZLW-UHFFFAOYSA-N 1 2 220.251 2.173 20 0 BEADLO Fc1cccnc1NCc1[nH+]ccn1C1CC1 ZINC000902064841 584522215 /nfs/dbraw/zinc/52/22/15/584522215.db2.gz AVMDPCOPJSDSBQ-UHFFFAOYSA-N 1 2 232.262 2.364 20 0 BEADLO Cc1nc(NCc2cnn(C(C)(C)C)c2)cc[nH+]1 ZINC000902124753 584529075 /nfs/dbraw/zinc/52/90/75/584529075.db2.gz JQYUXUOMFMUMEI-UHFFFAOYSA-N 1 2 245.330 2.349 20 0 BEADLO CCOc1cccc(CNc2cc[nH+]c(C)n2)n1 ZINC000902125642 584529106 /nfs/dbraw/zinc/52/91/06/584529106.db2.gz UMGUXOHRCGRAFV-UHFFFAOYSA-N 1 2 244.298 2.191 20 0 BEADLO Cc1nc(NCc2ccnn2C2CCC2)cc[nH+]1 ZINC000902127134 584529344 /nfs/dbraw/zinc/52/93/44/584529344.db2.gz MTGSAMNDZMTZGH-UHFFFAOYSA-N 1 2 243.314 2.319 20 0 BEADLO CCOc1cccc(CNc2cc(C)[nH+]cn2)n1 ZINC000902194526 584536530 /nfs/dbraw/zinc/53/65/30/584536530.db2.gz GMIMWSDMVOMBJT-UHFFFAOYSA-N 1 2 244.298 2.191 20 0 BEADLO CCCn1nccc1CNc1cc(C)[nH+]cn1 ZINC000902196544 584536639 /nfs/dbraw/zinc/53/66/39/584536639.db2.gz SPVVYIAEBZJSJN-UHFFFAOYSA-N 1 2 231.303 2.004 20 0 BEADLO CCc1ncc(NCc2c[nH+]cn2C(C)C)cn1 ZINC000902202889 584538014 /nfs/dbraw/zinc/53/80/14/584538014.db2.gz YHDWHWVMBZUBAK-UHFFFAOYSA-N 1 2 245.330 2.429 20 0 BEADLO CCn1cnc(C[NH2+][C@@H](C)c2c(C)noc2C)c1 ZINC000902243211 584545487 /nfs/dbraw/zinc/54/54/87/584545487.db2.gz KQQBZUYEEVGSJT-VIFPVBQESA-N 1 2 248.330 2.359 20 0 BEADLO CC[C@@H]1C[C@H]1CO[NH+]=C(N)COC(C)(C)C ZINC000902342908 584557875 /nfs/dbraw/zinc/55/78/75/584557875.db2.gz XVCNYMSNIWDTEW-ZJUUUORDSA-N 1 2 228.336 2.346 20 0 BEADLO O=C1c2ccccc2CN1C[NH+]1CCC(F)CC1 ZINC000902361903 584572127 /nfs/dbraw/zinc/57/21/27/584572127.db2.gz NYYRPKBBBSZATI-UHFFFAOYSA-N 1 2 248.301 2.034 20 0 BEADLO O=C(OCCF)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000859057562 588994902 /nfs/dbraw/zinc/99/49/02/588994902.db2.gz HBBVUMXKVAZPTK-SECBINFHSA-N 1 2 241.266 2.043 20 0 BEADLO C[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)n(C)n1 ZINC000859063951 588996239 /nfs/dbraw/zinc/99/62/39/588996239.db2.gz PIFDFVXLPNBPDG-SECBINFHSA-N 1 2 227.739 2.448 20 0 BEADLO C[C@@H]1CCCC[N@H+]1Cc1cc(Cl)n(C)n1 ZINC000859063951 588996241 /nfs/dbraw/zinc/99/62/41/588996241.db2.gz PIFDFVXLPNBPDG-SECBINFHSA-N 1 2 227.739 2.448 20 0 BEADLO C[C@@H]1CCC[N@H+](Cc2cc(Cl)n(C)n2)C1 ZINC000859064401 588996384 /nfs/dbraw/zinc/99/63/84/588996384.db2.gz ZVDVQSXINNTXTN-SECBINFHSA-N 1 2 227.739 2.305 20 0 BEADLO C[C@@H]1CCC[N@@H+](Cc2cc(Cl)n(C)n2)C1 ZINC000859064401 588996386 /nfs/dbraw/zinc/99/63/86/588996386.db2.gz ZVDVQSXINNTXTN-SECBINFHSA-N 1 2 227.739 2.305 20 0 BEADLO Cc1cncc([C@H](C)[NH2+]Cc2csc(N)n2)c1 ZINC000902500492 584619927 /nfs/dbraw/zinc/61/99/27/584619927.db2.gz WSDIGQVALTXKGG-VIFPVBQESA-N 1 2 248.355 2.280 20 0 BEADLO C[C@H]([NH2+]Cc1csc(N)n1)c1cncs1 ZINC000902488575 584627692 /nfs/dbraw/zinc/62/76/92/584627692.db2.gz HMKYEQQKENODOQ-LURJTMIESA-N 1 2 240.357 2.033 20 0 BEADLO CCn1c[nH+]c(CNc2cn(C)nc2C(C)C)c1 ZINC000902541695 584628776 /nfs/dbraw/zinc/62/87/76/584628776.db2.gz SIMQKRLLDKRZRE-UHFFFAOYSA-N 1 2 247.346 2.372 20 0 BEADLO c1cn(CCSC[C@H]2C[C@@]23CCOC3)c[nH+]1 ZINC000902547318 584635366 /nfs/dbraw/zinc/63/53/66/584635366.db2.gz OOHJVTJPCZPPJU-VXGBXAGGSA-N 1 2 238.356 2.043 20 0 BEADLO CCc1noc(C)c1C[NH2+]Cc1cn(CC)cn1 ZINC000902574788 584637434 /nfs/dbraw/zinc/63/74/34/584637434.db2.gz KKRSXDGUZYCBLJ-UHFFFAOYSA-N 1 2 248.330 2.052 20 0 BEADLO CCn1c[nH+]c(CNc2cccc3c2OCC3)c1 ZINC000902624045 584640091 /nfs/dbraw/zinc/64/00/91/584640091.db2.gz CGHYWAOHHYCHOW-UHFFFAOYSA-N 1 2 243.310 2.450 20 0 BEADLO CNc1ccccc1C[NH2+][C@@H](C)c1csnn1 ZINC000902609382 584642974 /nfs/dbraw/zinc/64/29/74/584642974.db2.gz QLICPDCKKGEVPS-VIFPVBQESA-N 1 2 248.355 2.431 20 0 BEADLO NC(COC1CCC1)=[NH+]OCc1ccsc1 ZINC000902612022 584643602 /nfs/dbraw/zinc/64/36/02/584643602.db2.gz FIBWKZGGGHSDCI-UHFFFAOYSA-N 1 2 240.328 2.316 20 0 BEADLO NC(Cc1ccccc1F)=[NH+]OC1CCC1 ZINC000902623212 584645069 /nfs/dbraw/zinc/64/50/69/584645069.db2.gz NXCSNMOZUMSXAB-UHFFFAOYSA-N 1 2 222.263 2.419 20 0 BEADLO CCn1c[nH+]c(CNc2cnn3c2CCCC3)c1 ZINC000902629638 584646622 /nfs/dbraw/zinc/64/66/22/584646622.db2.gz GPSRRKVAHSABDT-UHFFFAOYSA-N 1 2 245.330 2.048 20 0 BEADLO CNc1ccc(C)cc1C[NH2+]Cc1nonc1C ZINC000902640923 584649850 /nfs/dbraw/zinc/64/98/50/584649850.db2.gz POCQBFPUAPQUKV-UHFFFAOYSA-N 1 2 246.314 2.018 20 0 BEADLO COC/C(C)=C/CO[NH+]=C(N)c1ccccc1 ZINC000902685517 584656014 /nfs/dbraw/zinc/65/60/14/584656014.db2.gz QBCPGDZGMLVBLB-DHZHZOJOSA-N 1 2 234.299 2.126 20 0 BEADLO CC1CC(CO[NH+]=C(N)COC(C)(C)C)C1 ZINC000902731391 584662400 /nfs/dbraw/zinc/66/24/00/584662400.db2.gz XRLBGPDBQJZHSO-UHFFFAOYSA-N 1 2 228.336 2.346 20 0 BEADLO Cn1c[nH+]c2cc(OC[C@H]3CCCOC3)ccc21 ZINC000902781295 584670017 /nfs/dbraw/zinc/67/00/17/584670017.db2.gz MWZRCFXLRRHDDQ-NSHDSACASA-N 1 2 246.310 2.379 20 0 BEADLO Cn1c[nH+]c2cc(OCCC3(O)CCC3)ccc21 ZINC000902781225 584670156 /nfs/dbraw/zinc/67/01/56/584670156.db2.gz KJOVHLKOVZLAJY-UHFFFAOYSA-N 1 2 246.310 2.257 20 0 BEADLO CO[C@H]1C[C@@H](COc2ccc3c(c2)[nH+]cn3C)C1 ZINC000902781062 584670430 /nfs/dbraw/zinc/67/04/30/584670430.db2.gz DBEPPXXLJPDDJW-KLPPZKSPSA-N 1 2 246.310 2.377 20 0 BEADLO Cn1c[nH+]c2cc(OCC3CC3)ccc21 ZINC000902781024 584670454 /nfs/dbraw/zinc/67/04/54/584670454.db2.gz BZVGUSTVWWMHIO-UHFFFAOYSA-N 1 2 202.257 2.362 20 0 BEADLO COc1cccc(OCc2c[nH+]cn2C)c1C ZINC000902798330 584674690 /nfs/dbraw/zinc/67/46/90/584674690.db2.gz RJBAORFNBPDYBM-UHFFFAOYSA-N 1 2 232.283 2.316 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1ccnc(F)c1 ZINC000859078229 588998072 /nfs/dbraw/zinc/99/80/72/588998072.db2.gz ZKUXZMYISQIKDX-ZYHUDNBSSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1ccnc(F)c1 ZINC000859078229 588998073 /nfs/dbraw/zinc/99/80/73/588998073.db2.gz ZKUXZMYISQIKDX-ZYHUDNBSSA-N 1 2 238.306 2.220 20 0 BEADLO CCc1noc(C)c1C[N@@H+]1CCC[C@H](F)C1 ZINC000902998029 584714421 /nfs/dbraw/zinc/71/44/21/584714421.db2.gz DZXMQESBOTUGIQ-JTQLQIEISA-N 1 2 226.295 2.479 20 0 BEADLO CCc1noc(C)c1C[N@H+]1CCC[C@H](F)C1 ZINC000902998029 584714422 /nfs/dbraw/zinc/71/44/22/584714422.db2.gz DZXMQESBOTUGIQ-JTQLQIEISA-N 1 2 226.295 2.479 20 0 BEADLO CCC(C)(C)NC(=O)[C@@H](C)[N@@H+]1CCC[C@@H](F)C1 ZINC000903001705 584716149 /nfs/dbraw/zinc/71/61/49/584716149.db2.gz PUJLJNVUKTZNTL-GHMZBOCLSA-N 1 2 244.354 2.114 20 0 BEADLO CCC(C)(C)NC(=O)[C@@H](C)[N@H+]1CCC[C@@H](F)C1 ZINC000903001705 584716150 /nfs/dbraw/zinc/71/61/50/584716150.db2.gz PUJLJNVUKTZNTL-GHMZBOCLSA-N 1 2 244.354 2.114 20 0 BEADLO CCCCCCNC(=O)C[N@@H+]1CCC[C@H](F)C1 ZINC000903002791 584716219 /nfs/dbraw/zinc/71/62/19/584716219.db2.gz HNLVSJWWAZROIL-LBPRGKRZSA-N 1 2 244.354 2.117 20 0 BEADLO CCCCCCNC(=O)C[N@H+]1CCC[C@H](F)C1 ZINC000903002791 584716220 /nfs/dbraw/zinc/71/62/20/584716220.db2.gz HNLVSJWWAZROIL-LBPRGKRZSA-N 1 2 244.354 2.117 20 0 BEADLO CCC[C@H](C)NC(=O)[C@H](C)[N@@H+]1CCC[C@@H](F)C1 ZINC000903002185 584716274 /nfs/dbraw/zinc/71/62/74/584716274.db2.gz XLQVWWRJZVADSR-SDDRHHMPSA-N 1 2 244.354 2.114 20 0 BEADLO CCC[C@H](C)NC(=O)[C@H](C)[N@H+]1CCC[C@@H](F)C1 ZINC000903002185 584716275 /nfs/dbraw/zinc/71/62/75/584716275.db2.gz XLQVWWRJZVADSR-SDDRHHMPSA-N 1 2 244.354 2.114 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@@H]1CC[C@@H](C2CC2)O1 ZINC000903250871 584738847 /nfs/dbraw/zinc/73/88/47/584738847.db2.gz DSURMINIFCMXOR-WFBYXXMGSA-N 1 2 249.358 2.326 20 0 BEADLO C[C@@H](N[C@@H](c1ncccn1)C1CC1)c1[nH]cc[nH+]1 ZINC000903323091 584747061 /nfs/dbraw/zinc/74/70/61/584747061.db2.gz AKYBZPKUHVRTBP-MWLCHTKSSA-N 1 2 243.314 2.002 20 0 BEADLO Cc1nonc1[C@H](C)[NH2+][C@H](C)c1cncs1 ZINC000903309711 584747963 /nfs/dbraw/zinc/74/79/63/584747963.db2.gz HBRAPAPTHFHNDX-RQJHMYQMSA-N 1 2 238.316 2.246 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1cncs1)c1ccn(C)n1 ZINC000903312637 584748094 /nfs/dbraw/zinc/74/80/94/584748094.db2.gz XMIPDLJHXBIPLJ-IUCAKERBSA-N 1 2 236.344 2.288 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cncs1)c1ccn(C)n1 ZINC000903312635 584748323 /nfs/dbraw/zinc/74/83/23/584748323.db2.gz XMIPDLJHXBIPLJ-BDAKNGLRSA-N 1 2 236.344 2.288 20 0 BEADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1cn(C)cn1 ZINC000903351123 584755462 /nfs/dbraw/zinc/75/54/62/584755462.db2.gz HYPHWQIJWHUEIG-LLVKDONJSA-N 1 2 244.342 2.228 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2cn(C)cn2)oc1C ZINC000903352944 584755695 /nfs/dbraw/zinc/75/56/95/584755695.db2.gz XIHPACWDLHQCPY-SNVBAGLBSA-N 1 2 233.315 2.481 20 0 BEADLO Cc1ccccc1OCCCN1CC=CC[NH2+]1 ZINC000903488487 584780544 /nfs/dbraw/zinc/78/05/44/584780544.db2.gz GHUDQXBSKRJCQG-UHFFFAOYSA-N 1 2 232.327 2.140 20 0 BEADLO COc1cccc(CCCN2CC=CC[NH2+]2)c1 ZINC000903488820 584780623 /nfs/dbraw/zinc/78/06/23/584780623.db2.gz ZDGDWSIBGZGBDS-UHFFFAOYSA-N 1 2 232.327 2.004 20 0 BEADLO c1ccc([C@@H]2CC[C@@H](CN3CC=CC[NH2+]3)O2)cc1 ZINC000903490796 584781130 /nfs/dbraw/zinc/78/11/30/584781130.db2.gz IMILHPSYGFEWAQ-GJZGRUSLSA-N 1 2 244.338 2.283 20 0 BEADLO CSCCCCc1noc([C@H](C)[NH+](C)C)n1 ZINC000903785765 584800298 /nfs/dbraw/zinc/80/02/98/584800298.db2.gz PDKLUDLGAUKDOX-VIFPVBQESA-N 1 2 243.376 2.378 20 0 BEADLO CC[C@]1(C)CCC[N@H+](C[C@@H]([NH3+])CC(F)F)C1 ZINC000903894985 584819955 /nfs/dbraw/zinc/81/99/55/584819955.db2.gz JBSAZXWBRUXVHG-CMPLNLGQSA-N 1 2 234.334 2.481 20 0 BEADLO CC[C@]1(C)CCC[N@@H+](C[C@@H]([NH3+])CC(F)F)C1 ZINC000903894985 584819956 /nfs/dbraw/zinc/81/99/56/584819956.db2.gz JBSAZXWBRUXVHG-CMPLNLGQSA-N 1 2 234.334 2.481 20 0 BEADLO FC(F)(F)Cn1cc[nH+]c1CN1CC[C@H]2C[C@H]21 ZINC000761091736 584909747 /nfs/dbraw/zinc/90/97/47/584909747.db2.gz JKDGSZCHFDZWHL-DTWKUNHWSA-N 1 2 245.248 2.040 20 0 BEADLO FC(F)(F)Cn1ccnc1C[N@@H+]1CC[C@H]2C[C@H]21 ZINC000761091736 584909748 /nfs/dbraw/zinc/90/97/48/584909748.db2.gz JKDGSZCHFDZWHL-DTWKUNHWSA-N 1 2 245.248 2.040 20 0 BEADLO FC(F)(F)Cn1ccnc1C[N@H+]1CC[C@H]2C[C@H]21 ZINC000761091736 584909749 /nfs/dbraw/zinc/90/97/49/584909749.db2.gz JKDGSZCHFDZWHL-DTWKUNHWSA-N 1 2 245.248 2.040 20 0 BEADLO Cc1cc([C@@H]2CCCN2c2cc(C)[nH+]cn2)no1 ZINC000731921043 584931572 /nfs/dbraw/zinc/93/15/72/584931572.db2.gz ZIARMICGLIKIBV-LBPRGKRZSA-N 1 2 244.298 2.423 20 0 BEADLO Cc1cccn2cc(CC(=O)OCC(C)C)[nH+]c12 ZINC000732358784 584936061 /nfs/dbraw/zinc/93/60/61/584936061.db2.gz UJFWKDKJDQHORD-UHFFFAOYSA-N 1 2 246.310 2.384 20 0 BEADLO Cc1cc(NCc2ccc([C@@H](C)O)cc2)nc[nH+]1 ZINC000732567127 584938685 /nfs/dbraw/zinc/93/86/85/584938685.db2.gz ABUSTMJYRUABFL-LLVKDONJSA-N 1 2 243.310 2.450 20 0 BEADLO CC(C)c1cnc(C[N@@H+]2CCCOCC2)o1 ZINC000733307586 584946737 /nfs/dbraw/zinc/94/67/37/584946737.db2.gz CGCXULZLASGYOJ-UHFFFAOYSA-N 1 2 224.304 2.020 20 0 BEADLO CC(C)c1cnc(C[N@H+]2CCCOCC2)o1 ZINC000733307586 584946738 /nfs/dbraw/zinc/94/67/38/584946738.db2.gz CGCXULZLASGYOJ-UHFFFAOYSA-N 1 2 224.304 2.020 20 0 BEADLO Cc1nonc1C[N@@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000734146516 584957407 /nfs/dbraw/zinc/95/74/07/584957407.db2.gz FVRLRPSLDYRVJN-QMMMGPOBSA-N 1 2 249.236 2.152 20 0 BEADLO Cc1nonc1C[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000734146516 584957408 /nfs/dbraw/zinc/95/74/08/584957408.db2.gz FVRLRPSLDYRVJN-QMMMGPOBSA-N 1 2 249.236 2.152 20 0 BEADLO CCC/C=C\C(=O)NCCCNc1cccc[nH+]1 ZINC000736196324 584991235 /nfs/dbraw/zinc/99/12/35/584991235.db2.gz VNPMIZZCLRCQLD-WTKPLQERSA-N 1 2 247.342 2.356 20 0 BEADLO CN(C)c1cc(COC(=O)C2(C)CCC2)cc[nH+]1 ZINC000755915811 585001306 /nfs/dbraw/zinc/00/13/06/585001306.db2.gz YYAHXEHGQLIURM-UHFFFAOYSA-N 1 2 248.326 2.381 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)[C@@]2(C)CCC[C@@H]2C)S1 ZINC000819781058 585007561 /nfs/dbraw/zinc/00/75/61/585007561.db2.gz KZWCXQHEQXVYOS-SBMIAAHKSA-N 1 2 240.372 2.420 20 0 BEADLO COc1c(C)c[nH+]c(COC(=O)[C@@H]2C[C@H]2C)c1C ZINC000736742475 585011318 /nfs/dbraw/zinc/01/13/18/585011318.db2.gz GJBKQZKQRKPZQU-LDYMZIIASA-N 1 2 249.310 2.406 20 0 BEADLO COc1c(C)c[nH+]c(COC(=O)C(C)C)c1C ZINC000736740599 585011361 /nfs/dbraw/zinc/01/13/61/585011361.db2.gz WZGSTKKOPRCSRV-UHFFFAOYSA-N 1 2 237.299 2.406 20 0 BEADLO CCC(CC)[C@@H](C)C(=O)NCc1cn(C)c[nH+]1 ZINC000890109105 585023805 /nfs/dbraw/zinc/02/38/05/585023805.db2.gz BUBUDNMHYIWBSV-SNVBAGLBSA-N 1 2 237.347 2.109 20 0 BEADLO CCC(=O)Oc1cccc(-n2cc[nH+]c2)c1 ZINC000737567767 585036457 /nfs/dbraw/zinc/03/64/57/585036457.db2.gz FBYHIXRSZXEZQR-UHFFFAOYSA-N 1 2 216.240 2.188 20 0 BEADLO CCn1cnn(C[N@H+](C)CC(C)(C)C)c1=S ZINC000738098335 585040927 /nfs/dbraw/zinc/04/09/27/585040927.db2.gz IDDUGPDLLRCYAP-UHFFFAOYSA-N 1 2 242.392 2.369 20 0 BEADLO CCn1cnn(C[N@@H+](C)CC(C)(C)C)c1=S ZINC000738098335 585040928 /nfs/dbraw/zinc/04/09/28/585040928.db2.gz IDDUGPDLLRCYAP-UHFFFAOYSA-N 1 2 242.392 2.369 20 0 BEADLO O=C(C[C@@H]1CC[C@@H]2C[C@@H]21)OCCCn1cc[nH+]c1 ZINC000838123051 585046459 /nfs/dbraw/zinc/04/64/59/585046459.db2.gz MIZFJYPCMNFMGK-AGIUHOORSA-N 1 2 248.326 2.253 20 0 BEADLO CCn1ncc(C[NH2+][C@@H](C)c2cc(C)oc2C)n1 ZINC000838919595 585078237 /nfs/dbraw/zinc/07/82/37/585078237.db2.gz MZCYLRRTJUWQGJ-JTQLQIEISA-N 1 2 248.330 2.359 20 0 BEADLO O=C(CC1CC1)OCCc1cn2ccccc2[nH+]1 ZINC000838925465 585081202 /nfs/dbraw/zinc/08/12/02/585081202.db2.gz YYUGXKZXLHHXFH-UHFFFAOYSA-N 1 2 244.294 2.220 20 0 BEADLO Cc1ccc(C[N@@H+](C)C2(CO)CC2)c(Cl)n1 ZINC000839008223 585086686 /nfs/dbraw/zinc/08/66/86/585086686.db2.gz LMHMIUDHXHPUFT-UHFFFAOYSA-N 1 2 240.734 2.000 20 0 BEADLO Cc1ccc(C[N@H+](C)C2(CO)CC2)c(Cl)n1 ZINC000839008223 585086687 /nfs/dbraw/zinc/08/66/87/585086687.db2.gz LMHMIUDHXHPUFT-UHFFFAOYSA-N 1 2 240.734 2.000 20 0 BEADLO CCOC1C[NH+](Cc2cnc3ccccc3c2)C1 ZINC000839132379 585094037 /nfs/dbraw/zinc/09/40/37/585094037.db2.gz OHWMMGFHWSLDRX-UHFFFAOYSA-N 1 2 242.322 2.456 20 0 BEADLO Cl/C=C(/Cl)C[N@@H+]1CCC[C@@H]2COC[C@@H]21 ZINC000839193453 585097734 /nfs/dbraw/zinc/09/77/34/585097734.db2.gz UYYISTNATNDOPO-OCSORSNKSA-N 1 2 236.142 2.416 20 0 BEADLO Cl/C=C(/Cl)C[N@H+]1CCC[C@@H]2COC[C@@H]21 ZINC000839193453 585097735 /nfs/dbraw/zinc/09/77/35/585097735.db2.gz UYYISTNATNDOPO-OCSORSNKSA-N 1 2 236.142 2.416 20 0 BEADLO COC(C[N@@H+]1Cc2ccc(Cl)cc2C1)OC ZINC000839194863 585098098 /nfs/dbraw/zinc/09/80/98/585098098.db2.gz VQMAZXZGTWUVPU-UHFFFAOYSA-N 1 2 241.718 2.275 20 0 BEADLO COC(C[N@H+]1Cc2ccc(Cl)cc2C1)OC ZINC000839194863 585098099 /nfs/dbraw/zinc/09/80/99/585098099.db2.gz VQMAZXZGTWUVPU-UHFFFAOYSA-N 1 2 241.718 2.275 20 0 BEADLO C[C@@H]1C[C@@H](C)[N@H+](Cn2ncsc2=S)C1 ZINC000740861309 585107751 /nfs/dbraw/zinc/10/77/51/585107751.db2.gz MWDCRJQHMLCLSC-HTQZYQBOSA-N 1 2 229.374 2.362 20 0 BEADLO C[C@@H]1C[C@@H](C)[N@@H+](Cn2ncsc2=S)C1 ZINC000740861309 585107752 /nfs/dbraw/zinc/10/77/52/585107752.db2.gz MWDCRJQHMLCLSC-HTQZYQBOSA-N 1 2 229.374 2.362 20 0 BEADLO Cc1noc(-c2[nH+]c(C)n3ccccc23)n1 ZINC000741448066 585114198 /nfs/dbraw/zinc/11/41/98/585114198.db2.gz XEOYSCYOLBKEPG-UHFFFAOYSA-N 1 2 214.228 2.001 20 0 BEADLO CCCOC(=O)[C@H](C)[N@@H+]1CCS[C@@H](C)[C@@H]1C ZINC000741796479 585119650 /nfs/dbraw/zinc/11/96/50/585119650.db2.gz GARYZDVFRSQOKG-DCAQKATOSA-N 1 2 245.388 2.154 20 0 BEADLO CCCOC(=O)[C@H](C)[N@H+]1CCS[C@@H](C)[C@@H]1C ZINC000741796479 585119651 /nfs/dbraw/zinc/11/96/51/585119651.db2.gz GARYZDVFRSQOKG-DCAQKATOSA-N 1 2 245.388 2.154 20 0 BEADLO CCOCCCO[NH+]=C(N)c1cccc(F)c1 ZINC000742356660 585124766 /nfs/dbraw/zinc/12/47/66/585124766.db2.gz UHBGMHDKTCOPBJ-UHFFFAOYSA-N 1 2 240.278 2.099 20 0 BEADLO CC(C)c1nc(NC[C@@H]2CCC[C@@H]2O)cc[nH+]1 ZINC000742421216 585126077 /nfs/dbraw/zinc/12/60/77/585126077.db2.gz KLIJGANQMCQHOH-QWRGUYRKSA-N 1 2 235.331 2.173 20 0 BEADLO Cc1cc(NCC[C@H](O)c2ccccc2)nc[nH+]1 ZINC000742427335 585126147 /nfs/dbraw/zinc/12/61/47/585126147.db2.gz HXSIZTXTHGFPCK-ZDUSSCGKSA-N 1 2 243.310 2.321 20 0 BEADLO O=C1CC2(CCC2)N1C[NH+]1Cc2ccccc2C1 ZINC000743362406 585135841 /nfs/dbraw/zinc/13/58/41/585135841.db2.gz OCWRHMLBUSVIPR-UHFFFAOYSA-N 1 2 242.322 2.115 20 0 BEADLO CCC=C(C)C(=O)Nc1cc(C)[nH+]cc1C ZINC000747107777 585175024 /nfs/dbraw/zinc/17/50/24/585175024.db2.gz PWRBZVHAFUZIBE-TWGQIWQCSA-N 1 2 218.300 2.415 20 0 BEADLO C[C@@H]1c2ccccc2C[N@H+]1CN1C[C@@H](C)CC1=O ZINC000747463931 585179085 /nfs/dbraw/zinc/17/90/85/585179085.db2.gz SAGFTGCRGSDTIZ-NWDGAFQWSA-N 1 2 244.338 2.389 20 0 BEADLO C[C@@H]1c2ccccc2C[N@@H+]1CN1C[C@@H](C)CC1=O ZINC000747463931 585179086 /nfs/dbraw/zinc/17/90/86/585179086.db2.gz SAGFTGCRGSDTIZ-NWDGAFQWSA-N 1 2 244.338 2.389 20 0 BEADLO COCCO[NH+]=C(N)c1cccc2ccccc21 ZINC000747834208 585184951 /nfs/dbraw/zinc/18/49/51/585184951.db2.gz PINFSKLKCYBCAK-UHFFFAOYSA-N 1 2 244.294 2.333 20 0 BEADLO COc1cc[nH+]cc1NC(=S)NCC(C)C ZINC000748156146 585188336 /nfs/dbraw/zinc/18/83/36/585188336.db2.gz GMPDERKLUGQUQH-UHFFFAOYSA-N 1 2 239.344 2.033 20 0 BEADLO CCc1ccc(C(=O)Nc2cc[nH+]cc2O)s1 ZINC000748313187 585190396 /nfs/dbraw/zinc/19/03/96/585190396.db2.gz ZFSYZYGTSJZMJY-UHFFFAOYSA-N 1 2 248.307 2.085 20 0 BEADLO c1csc(CC[N@@H+]2CCn3ccnc3C2)c1 ZINC000750536944 585217094 /nfs/dbraw/zinc/21/70/94/585217094.db2.gz XXGXPCZRRVHQLB-UHFFFAOYSA-N 1 2 233.340 2.003 20 0 BEADLO c1csc(CC[N@H+]2CCn3ccnc3C2)c1 ZINC000750536944 585217095 /nfs/dbraw/zinc/21/70/95/585217095.db2.gz XXGXPCZRRVHQLB-UHFFFAOYSA-N 1 2 233.340 2.003 20 0 BEADLO CC(C)=C(C)C(=O)NCc1ccc(N(C)C)[nH+]c1 ZINC000751190327 585225189 /nfs/dbraw/zinc/22/51/89/585225189.db2.gz GLZWOXPPVYDKIO-UHFFFAOYSA-N 1 2 247.342 2.120 20 0 BEADLO Cc1nc2[nH]ccc2c(NC[C@@H](O)CC(C)C)[nH+]1 ZINC000751218735 585226032 /nfs/dbraw/zinc/22/60/32/585226032.db2.gz HJCGCHVHTHDVMA-JTQLQIEISA-N 1 2 248.330 2.085 20 0 BEADLO C/C=C(/C)C(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000751360583 585227277 /nfs/dbraw/zinc/22/72/77/585227277.db2.gz MGYLYXRXIVIBPR-HUMZTAOYSA-N 1 2 249.358 2.380 20 0 BEADLO CC(C)=C(C)C(=O)N1CC(Oc2cc[nH+]cc2)C1 ZINC000751376592 585228277 /nfs/dbraw/zinc/22/82/77/585228277.db2.gz NOZHGPBILOSZSE-UHFFFAOYSA-N 1 2 246.310 2.028 20 0 BEADLO C/C=C(\C)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000751377456 585228305 /nfs/dbraw/zinc/22/83/05/585228305.db2.gz UULFLGRXXQKTSS-NDZKXSSTSA-N 1 2 233.315 2.013 20 0 BEADLO Nc1ccc(CCC(=O)O[C@@H]2C=CCCC2)c[nH+]1 ZINC000751441900 585230474 /nfs/dbraw/zinc/23/04/74/585230474.db2.gz IASYOPCLDOGBEN-GFCCVEGCSA-N 1 2 246.310 2.248 20 0 BEADLO C[C@H]1C[N@H+](Cn2ncsc2=S)C[C@H]1C ZINC000751925481 585239137 /nfs/dbraw/zinc/23/91/37/585239137.db2.gz FRBVMKUGVTZZAJ-OCAPTIKFSA-N 1 2 229.374 2.219 20 0 BEADLO C[C@H]1C[N@@H+](Cn2ncsc2=S)C[C@H]1C ZINC000751925481 585239138 /nfs/dbraw/zinc/23/91/38/585239138.db2.gz FRBVMKUGVTZZAJ-OCAPTIKFSA-N 1 2 229.374 2.219 20 0 BEADLO Cn1c[nH+]cc1COC(=O)/C=C/c1cccs1 ZINC000753146080 585254445 /nfs/dbraw/zinc/25/44/45/585254445.db2.gz HGHMVSVSQQCNRL-SNAWJCMRSA-N 1 2 248.307 2.238 20 0 BEADLO C[C@@H]1CC/C(=C\C(=O)N(C)Cc2[nH]cc[nH+]2)C1 ZINC000753607995 585263795 /nfs/dbraw/zinc/26/37/95/585263795.db2.gz PBJOLDZSJQRUQH-MXBGMFSPSA-N 1 2 233.315 2.115 20 0 BEADLO Cc1nonc1C[N@@H+](C)Cc1ccc(F)cc1C ZINC000753785430 585269204 /nfs/dbraw/zinc/26/92/04/585269204.db2.gz LOXOYWHBUHJSJB-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO Cc1nonc1C[N@H+](C)Cc1ccc(F)cc1C ZINC000753785430 585269205 /nfs/dbraw/zinc/26/92/05/585269205.db2.gz LOXOYWHBUHJSJB-UHFFFAOYSA-N 1 2 249.289 2.458 20 0 BEADLO NC(=[NH+]OCC1CCC1)c1ccccc1 ZINC000753822353 585270390 /nfs/dbraw/zinc/27/03/90/585270390.db2.gz VJZHTSMWINGJJD-UHFFFAOYSA-N 1 2 204.273 2.333 20 0 BEADLO Cc1ccccc1C(N)=[NH+]OCCC(C)(C)O ZINC000754279769 585281813 /nfs/dbraw/zinc/28/18/13/585281813.db2.gz OTRSRZJLENFJPU-UHFFFAOYSA-N 1 2 236.315 2.003 20 0 BEADLO C/C(=C/C(=O)NCc1[nH]c[nH+]c1C)C(C)(C)C ZINC000754345520 585282829 /nfs/dbraw/zinc/28/28/29/585282829.db2.gz GUEHKWMXZXJYKD-TWGQIWQCSA-N 1 2 235.331 2.327 20 0 BEADLO C[C@@H]1CCN(c2[nH+]cnc3[nH]c(Cl)cc32)C1 ZINC000754677368 585289173 /nfs/dbraw/zinc/28/91/73/585289173.db2.gz YGWQUXNDBQEXJY-SSDOTTSWSA-N 1 2 236.706 2.409 20 0 BEADLO CC(C)c1cnc(C[NH2+][C@@H](C)c2cnn(C)c2)o1 ZINC000754776264 585290570 /nfs/dbraw/zinc/29/05/70/585290570.db2.gz ZTWLZHBNSZUYIH-JTQLQIEISA-N 1 2 248.330 2.382 20 0 BEADLO CC1=CC[N@H+](Cn2cc(Cl)cn2)CC1 ZINC000755756942 585305869 /nfs/dbraw/zinc/30/58/69/585305869.db2.gz BIZWUXBTAJVCHZ-UHFFFAOYSA-N 1 2 211.696 2.146 20 0 BEADLO CC1=CC[N@@H+](Cn2cc(Cl)cn2)CC1 ZINC000755756942 585305870 /nfs/dbraw/zinc/30/58/70/585305870.db2.gz BIZWUXBTAJVCHZ-UHFFFAOYSA-N 1 2 211.696 2.146 20 0 BEADLO CC1=CC[N@H+](Cn2c3ccccc3oc2=O)CC1 ZINC000755769791 585306463 /nfs/dbraw/zinc/30/64/63/585306463.db2.gz WRWSGGSQLWZVJN-UHFFFAOYSA-N 1 2 244.294 2.204 20 0 BEADLO CC1=CC[N@@H+](Cn2c3ccccc3oc2=O)CC1 ZINC000755769791 585306464 /nfs/dbraw/zinc/30/64/64/585306464.db2.gz WRWSGGSQLWZVJN-UHFFFAOYSA-N 1 2 244.294 2.204 20 0 BEADLO Cc1ccc(NC(=O)NCc2ccon2)c(C)[nH+]1 ZINC000755850005 585308669 /nfs/dbraw/zinc/30/86/69/585308669.db2.gz AVIYXRQMJVHUOP-UHFFFAOYSA-N 1 2 246.270 2.008 20 0 BEADLO C/C=C/C=C/C(=O)OCc1cc[nH+]c(N(C)C)c1 ZINC000755904240 585309842 /nfs/dbraw/zinc/30/98/42/585309842.db2.gz QWBVAGOLSRUCCR-YTXTXJHMSA-N 1 2 246.310 2.323 20 0 BEADLO CCC/C=C/C(=O)N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000756130423 585314957 /nfs/dbraw/zinc/31/49/57/585314957.db2.gz LWJADGLRBBOMCD-FYJFLYSWSA-N 1 2 247.342 2.092 20 0 BEADLO C[C@H]1C[N@H+](C/C=C/c2ccccc2)CCN1C ZINC000839533954 585329097 /nfs/dbraw/zinc/32/90/97/585329097.db2.gz PTYKIVWMIVPZQA-MRZGDXHCSA-N 1 2 230.355 2.336 20 0 BEADLO C[C@H]1C[N@@H+](C/C=C/c2ccccc2)CCN1C ZINC000839533954 585329098 /nfs/dbraw/zinc/32/90/98/585329098.db2.gz PTYKIVWMIVPZQA-MRZGDXHCSA-N 1 2 230.355 2.336 20 0 BEADLO Cl/C=C/C[N@@H+]1CCO[C@@H](C2CCC2)C1 ZINC000839623822 585332687 /nfs/dbraw/zinc/33/26/87/585332687.db2.gz UUXNRLALELMNBG-XGQHYKRYSA-N 1 2 215.724 2.240 20 0 BEADLO Cl/C=C/C[N@H+]1CCO[C@@H](C2CCC2)C1 ZINC000839623822 585332688 /nfs/dbraw/zinc/33/26/88/585332688.db2.gz UUXNRLALELMNBG-XGQHYKRYSA-N 1 2 215.724 2.240 20 0 BEADLO C[C@H](OC(=O)[C@@H]1CCCC[N@@H+]1C)c1ccncc1 ZINC000757711708 585344605 /nfs/dbraw/zinc/34/46/05/585344605.db2.gz RQKWWLAAAKDBDL-AAEUAGOBSA-N 1 2 248.326 2.170 20 0 BEADLO C[C@H](OC(=O)[C@@H]1CCCC[N@H+]1C)c1ccncc1 ZINC000757711708 585344606 /nfs/dbraw/zinc/34/46/06/585344606.db2.gz RQKWWLAAAKDBDL-AAEUAGOBSA-N 1 2 248.326 2.170 20 0 BEADLO C/C=C(\C)C(=O)OCc1cc(OC)cc(C)[nH+]1 ZINC000757717218 585344945 /nfs/dbraw/zinc/34/49/45/585344945.db2.gz WPSPDHXMMDODFS-WEVVVXLNSA-N 1 2 235.283 2.408 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)c1ccnc(Cl)c1 ZINC000757920161 585346939 /nfs/dbraw/zinc/34/69/39/585346939.db2.gz JISWBQDXIVPSRR-UHFFFAOYSA-N 1 2 222.679 2.095 20 0 BEADLO CCOCSc1[nH+]cc2ccccn21 ZINC000758370043 585355008 /nfs/dbraw/zinc/35/50/08/585355008.db2.gz GBXVOUDODPNYTC-UHFFFAOYSA-N 1 2 208.286 2.420 20 0 BEADLO FCC[N@@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000759340540 585368889 /nfs/dbraw/zinc/36/88/89/585368889.db2.gz VMDZEGZPFYJAKK-UHFFFAOYSA-N 1 2 218.275 2.496 20 0 BEADLO FCC[N@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000759340540 585368890 /nfs/dbraw/zinc/36/88/90/585368890.db2.gz VMDZEGZPFYJAKK-UHFFFAOYSA-N 1 2 218.275 2.496 20 0 BEADLO FCC[N@@H+]1CCOC[C@@H]1c1ccccc1 ZINC000759348598 585370579 /nfs/dbraw/zinc/37/05/79/585370579.db2.gz YBABMJPDGNCUSM-GFCCVEGCSA-N 1 2 209.264 2.029 20 0 BEADLO FCC[N@H+]1CCOC[C@@H]1c1ccccc1 ZINC000759348598 585370580 /nfs/dbraw/zinc/37/05/80/585370580.db2.gz YBABMJPDGNCUSM-GFCCVEGCSA-N 1 2 209.264 2.029 20 0 BEADLO C[C@H]1C[N@H+](CCF)[C@@H](c2ccccc2)CO1 ZINC000759347597 585370664 /nfs/dbraw/zinc/37/06/64/585370664.db2.gz REKRESIGWJJLKV-WCQYABFASA-N 1 2 223.291 2.418 20 0 BEADLO C[C@H]1C[N@@H+](CCF)[C@@H](c2ccccc2)CO1 ZINC000759347597 585370665 /nfs/dbraw/zinc/37/06/65/585370665.db2.gz REKRESIGWJJLKV-WCQYABFASA-N 1 2 223.291 2.418 20 0 BEADLO C[C@H]1CC[C@@H](CC(=O)OCc2c[nH+]cn2C)C1 ZINC000759564101 585376417 /nfs/dbraw/zinc/37/64/17/585376417.db2.gz IRHUZQNUJRBSSZ-WDEREUQCSA-N 1 2 236.315 2.290 20 0 BEADLO Cc1ccc(C)c(C[N@@H+](C)[C@H]2CCOC2=O)c1 ZINC000759630938 585377505 /nfs/dbraw/zinc/37/75/05/585377505.db2.gz LZPJPYVSJCINFJ-ZDUSSCGKSA-N 1 2 233.311 2.051 20 0 BEADLO Cc1ccc(C)c(C[N@H+](C)[C@H]2CCOC2=O)c1 ZINC000759630938 585377506 /nfs/dbraw/zinc/37/75/06/585377506.db2.gz LZPJPYVSJCINFJ-ZDUSSCGKSA-N 1 2 233.311 2.051 20 0 BEADLO Cc1ccc(C)c(C[N@@H+](C)[C@@H]2CCOC2=O)c1 ZINC000759630937 585377586 /nfs/dbraw/zinc/37/75/86/585377586.db2.gz LZPJPYVSJCINFJ-CYBMUJFWSA-N 1 2 233.311 2.051 20 0 BEADLO Cc1ccc(C)c(C[N@H+](C)[C@@H]2CCOC2=O)c1 ZINC000759630937 585377587 /nfs/dbraw/zinc/37/75/87/585377587.db2.gz LZPJPYVSJCINFJ-CYBMUJFWSA-N 1 2 233.311 2.051 20 0 BEADLO C[C@@]1(c2ccccc2)C[N@H+](CCF)CCO1 ZINC000759755157 585379906 /nfs/dbraw/zinc/37/99/06/585379906.db2.gz PTYXFUNNICGKEV-ZDUSSCGKSA-N 1 2 223.291 2.204 20 0 BEADLO C[C@@]1(c2ccccc2)C[N@@H+](CCF)CCO1 ZINC000759755157 585379907 /nfs/dbraw/zinc/37/99/07/585379907.db2.gz PTYXFUNNICGKEV-ZDUSSCGKSA-N 1 2 223.291 2.204 20 0 BEADLO CC[N@H+](CCC1CC1)Cn1ncn(C)c1=S ZINC000760538250 585393932 /nfs/dbraw/zinc/39/39/32/585393932.db2.gz XZYOYJUDTRROAS-UHFFFAOYSA-N 1 2 240.376 2.031 20 0 BEADLO CC[N@@H+](CCC1CC1)Cn1ncn(C)c1=S ZINC000760538250 585393933 /nfs/dbraw/zinc/39/39/33/585393933.db2.gz XZYOYJUDTRROAS-UHFFFAOYSA-N 1 2 240.376 2.031 20 0 BEADLO COC(=O)[C@H](c1ccc(F)cc1)[N@@H+]1CC[C@H]2C[C@H]21 ZINC000761086550 585407564 /nfs/dbraw/zinc/40/75/64/585407564.db2.gz DUJHGQIRBYVYLM-UHTWSYAYSA-N 1 2 249.285 2.134 20 0 BEADLO COC(=O)[C@H](c1ccc(F)cc1)[N@H+]1CC[C@H]2C[C@H]21 ZINC000761086550 585407565 /nfs/dbraw/zinc/40/75/65/585407565.db2.gz DUJHGQIRBYVYLM-UHTWSYAYSA-N 1 2 249.285 2.134 20 0 BEADLO C[N@@H+](Cc1coc(C2CC2)n1)C[C@H]1CCCO1 ZINC000761227789 585412784 /nfs/dbraw/zinc/41/27/84/585412784.db2.gz BTABUFNJUIHZPI-GFCCVEGCSA-N 1 2 236.315 2.163 20 0 BEADLO C[N@H+](Cc1coc(C2CC2)n1)C[C@H]1CCCO1 ZINC000761227789 585412785 /nfs/dbraw/zinc/41/27/85/585412785.db2.gz BTABUFNJUIHZPI-GFCCVEGCSA-N 1 2 236.315 2.163 20 0 BEADLO C[C@H](O)[C@H](C)SCc1cc[nH+]c(N(C)C)c1 ZINC000762478332 585432811 /nfs/dbraw/zinc/43/28/11/585432811.db2.gz FWTABWMTLYNEGE-UWVGGRQHSA-N 1 2 240.372 2.150 20 0 BEADLO CC(=CC(=O)Nc1cc[nH+]cc1O)C(C)(C)C ZINC000762803649 585437561 /nfs/dbraw/zinc/43/75/61/585437561.db2.gz CRBLFRGNCJCAKP-VQHVLOKHSA-N 1 2 234.299 2.140 20 0 BEADLO COC(=O)C1(C[N@H+](CC(F)F)C2CCC2)CC1 ZINC000887102529 585440262 /nfs/dbraw/zinc/44/02/62/585440262.db2.gz SRCLQFNIJDEIPG-UHFFFAOYSA-N 1 2 247.285 2.059 20 0 BEADLO COC(=O)C1(C[N@@H+](CC(F)F)C2CCC2)CC1 ZINC000887102529 585440263 /nfs/dbraw/zinc/44/02/63/585440263.db2.gz SRCLQFNIJDEIPG-UHFFFAOYSA-N 1 2 247.285 2.059 20 0 BEADLO Cc1cccc(C(=O)OCCn2cc[nH+]c2)c1C ZINC000763114269 585443161 /nfs/dbraw/zinc/44/31/61/585443161.db2.gz GRXJMIPFJGKHES-UHFFFAOYSA-N 1 2 244.294 2.357 20 0 BEADLO CC(C)OCC(N)=[NH+]OC/C(Cl)=C/Cl ZINC000763178439 585444196 /nfs/dbraw/zinc/44/41/96/585444196.db2.gz DFFAXYDSHJSREL-CLTKARDFSA-N 1 2 241.118 2.229 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)[C@@H]1CC=CCC1 ZINC000763288708 585445796 /nfs/dbraw/zinc/44/57/96/585445796.db2.gz XVFOGQUHBARBGX-GFCCVEGCSA-N 1 2 234.299 2.173 20 0 BEADLO Cc1ccc(C(=O)OCCCn2cc[nH+]c2)cc1 ZINC000763288691 585445844 /nfs/dbraw/zinc/44/58/44/585445844.db2.gz QOHZKZWQYCWXRT-UHFFFAOYSA-N 1 2 244.294 2.439 20 0 BEADLO CCC[N@H+](CC(F)F)C[C@H]1CC2(CC2)C(=O)O1 ZINC000763677326 585452446 /nfs/dbraw/zinc/45/24/46/585452446.db2.gz YEGABAPOJKBZMW-SECBINFHSA-N 1 2 247.285 2.059 20 0 BEADLO CCC[N@@H+](CC(F)F)C[C@H]1CC2(CC2)C(=O)O1 ZINC000763677326 585452447 /nfs/dbraw/zinc/45/24/47/585452447.db2.gz YEGABAPOJKBZMW-SECBINFHSA-N 1 2 247.285 2.059 20 0 BEADLO C[C@@H](OC(=O)c1ccc2[nH+]ccn2c1)C1CC1 ZINC000764381186 585464237 /nfs/dbraw/zinc/46/42/37/585464237.db2.gz WKIANWUPOLDSEA-SECBINFHSA-N 1 2 230.267 2.290 20 0 BEADLO CC(C)C[C@@H](C)C(=O)OCCn1cc[nH+]c1 ZINC000765551498 585489636 /nfs/dbraw/zinc/48/96/36/585489636.db2.gz SQIVQRNNDDVTNS-LLVKDONJSA-N 1 2 224.304 2.109 20 0 BEADLO CC(C)[N@H+](CCC(=O)C1CC1)CC(F)F ZINC000767413936 585519209 /nfs/dbraw/zinc/51/92/09/585519209.db2.gz AVIKFMIBSIWANO-UHFFFAOYSA-N 1 2 219.275 2.331 20 0 BEADLO CC(C)[N@@H+](CCC(=O)C1CC1)CC(F)F ZINC000767413936 585519210 /nfs/dbraw/zinc/51/92/10/585519210.db2.gz AVIKFMIBSIWANO-UHFFFAOYSA-N 1 2 219.275 2.331 20 0 BEADLO C[C@@H]1CC[C@@H](OC(=O)CCCn2cc[nH+]c2)C1 ZINC000767519380 585521800 /nfs/dbraw/zinc/52/18/00/585521800.db2.gz UXAJUTIASWWPCH-VXGBXAGGSA-N 1 2 236.315 2.395 20 0 BEADLO CN(Cc1[nH+]ccn1C)C[C@H]1CC1(Cl)Cl ZINC000767550074 585522315 /nfs/dbraw/zinc/52/23/15/585522315.db2.gz OVXIRCXGNXKZBA-MRVPVSSYSA-N 1 2 248.157 2.046 20 0 BEADLO Cn1ccnc1C[N@H+](C)C[C@H]1CC1(Cl)Cl ZINC000767550074 585522316 /nfs/dbraw/zinc/52/23/16/585522316.db2.gz OVXIRCXGNXKZBA-MRVPVSSYSA-N 1 2 248.157 2.046 20 0 BEADLO Cn1ccnc1C[N@@H+](C)C[C@H]1CC1(Cl)Cl ZINC000767550074 585522317 /nfs/dbraw/zinc/52/23/17/585522317.db2.gz OVXIRCXGNXKZBA-MRVPVSSYSA-N 1 2 248.157 2.046 20 0 BEADLO CCOC(=O)C[N@H+](Cc1ccoc1)C1CCC1 ZINC000768530003 585539484 /nfs/dbraw/zinc/53/94/84/585539484.db2.gz BUJVUPMJALWPNY-UHFFFAOYSA-N 1 2 237.299 2.197 20 0 BEADLO CCOC(=O)C[N@@H+](Cc1ccoc1)C1CCC1 ZINC000768530003 585539485 /nfs/dbraw/zinc/53/94/85/585539485.db2.gz BUJVUPMJALWPNY-UHFFFAOYSA-N 1 2 237.299 2.197 20 0 BEADLO COC(=O)C(C)(C)[N@H+](C)Cc1cc(C)oc1C ZINC000769304715 585552984 /nfs/dbraw/zinc/55/29/84/585552984.db2.gz CBGMEDDIKWHAJF-UHFFFAOYSA-N 1 2 239.315 2.280 20 0 BEADLO COC(=O)C(C)(C)[N@@H+](C)Cc1cc(C)oc1C ZINC000769304715 585552985 /nfs/dbraw/zinc/55/29/85/585552985.db2.gz CBGMEDDIKWHAJF-UHFFFAOYSA-N 1 2 239.315 2.280 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@H](F)c1ccccc1 ZINC000769303050 585553154 /nfs/dbraw/zinc/55/31/54/585553154.db2.gz DVYATLYCIVXAOY-GFCCVEGCSA-N 1 2 248.257 2.174 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2cc[nH]n2)c(C)o1 ZINC000769382824 585555011 /nfs/dbraw/zinc/55/50/11/585555011.db2.gz BXKFCNCXLXTQMK-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2cc[nH]n2)c(C)o1 ZINC000769382824 585555012 /nfs/dbraw/zinc/55/50/12/585555012.db2.gz BXKFCNCXLXTQMK-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO NC(Cc1ccccc1)=[NH+]OC[C@H]1CCCOC1 ZINC000769877881 585565743 /nfs/dbraw/zinc/56/57/43/585565743.db2.gz MNHRJINRKFQELT-ZDUSSCGKSA-N 1 2 248.326 2.154 20 0 BEADLO C[C@@H]1CCCCN1C(=O)c1cccc2[nH+]ccn21 ZINC000770053009 585570228 /nfs/dbraw/zinc/57/02/28/585570228.db2.gz MQIARQZGKUWSDY-LLVKDONJSA-N 1 2 243.310 2.349 20 0 BEADLO CCC(C)(C)NC(=O)c1cccc2[nH+]ccn21 ZINC000770399156 585573596 /nfs/dbraw/zinc/57/35/96/585573596.db2.gz DVHJLFSWIIGNCN-UHFFFAOYSA-N 1 2 231.299 2.253 20 0 BEADLO CC[C@H](C)CN(C)C(=O)c1cccc2[nH+]ccn21 ZINC000770416077 585573679 /nfs/dbraw/zinc/57/36/79/585573679.db2.gz JUWGHQYGQMXFSS-NSHDSACASA-N 1 2 245.326 2.452 20 0 BEADLO O=C(NCC1CCCC1)c1cccc2[nH+]ccn21 ZINC000770400539 585573773 /nfs/dbraw/zinc/57/37/73/585573773.db2.gz QIFJKBLKGBTCQE-UHFFFAOYSA-N 1 2 243.310 2.254 20 0 BEADLO CC[C@H](C)C(=O)OCc1cccc2[nH+]ccn21 ZINC000770732102 585580711 /nfs/dbraw/zinc/58/07/11/585580711.db2.gz CMPLQFRJUJWVAN-JTQLQIEISA-N 1 2 232.283 2.424 20 0 BEADLO C[C@H](C(=O)OCc1cccc2[nH+]ccn21)C1CC1 ZINC000770925919 585584236 /nfs/dbraw/zinc/58/42/36/585584236.db2.gz PMFBIQREAHIDFV-JTQLQIEISA-N 1 2 244.294 2.424 20 0 BEADLO CC1(C(=O)OCc2cccc3[nH+]ccn32)CC1 ZINC000770928639 585584253 /nfs/dbraw/zinc/58/42/53/585584253.db2.gz ZRVPLGPGGKFAPN-UHFFFAOYSA-N 1 2 230.267 2.178 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)NCCCn1cc[nH+]c1 ZINC000771841631 585602197 /nfs/dbraw/zinc/60/21/97/585602197.db2.gz WPEWLNOHMDNGKO-ZRDIBKRKSA-N 1 2 249.358 2.382 20 0 BEADLO CC(C)C[C@@H](C)CC(=O)OCCn1cc[nH+]c1 ZINC000771953634 585605369 /nfs/dbraw/zinc/60/53/69/585605369.db2.gz RFBPREYTOUVVLN-GFCCVEGCSA-N 1 2 238.331 2.499 20 0 BEADLO C[C@H]1CCC[C@H](C(=O)OCCn2cc[nH+]c2)C1 ZINC000771977729 585606113 /nfs/dbraw/zinc/60/61/13/585606113.db2.gz QAQMYLHZAAQXOP-RYUDHWBXSA-N 1 2 236.315 2.253 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C1(F)CCCC1 ZINC000772040159 585607350 /nfs/dbraw/zinc/60/73/50/585607350.db2.gz ZAQGCGGSZWLBEQ-UHFFFAOYSA-N 1 2 222.263 2.033 20 0 BEADLO COc1cc[nH+]cc1COC(=O)[C@H]1C[C@H]1C1CC1 ZINC000805486753 585640519 /nfs/dbraw/zinc/64/05/19/585640519.db2.gz JRFDGTHZKZIXFL-RYUDHWBXSA-N 1 2 247.294 2.180 20 0 BEADLO C/C(=C/C(=O)NCCc1c[nH+]cn1C)C(C)(C)C ZINC000773853347 585645091 /nfs/dbraw/zinc/64/50/91/585645091.db2.gz PLEVMISTIKUNBB-FLIBITNWSA-N 1 2 249.358 2.071 20 0 BEADLO FC1(F)CC[N@H+](C[C@@H]2CCC=CO2)C1 ZINC000775053482 585671117 /nfs/dbraw/zinc/67/11/17/585671117.db2.gz ZAXNOFWHNXCFJS-VIFPVBQESA-N 1 2 203.232 2.020 20 0 BEADLO FC1(F)CC[N@@H+](C[C@@H]2CCC=CO2)C1 ZINC000775053482 585671118 /nfs/dbraw/zinc/67/11/18/585671118.db2.gz ZAXNOFWHNXCFJS-VIFPVBQESA-N 1 2 203.232 2.020 20 0 BEADLO COCC1=CC[N@H+](Cc2coc(C3CC3)n2)CC1 ZINC000775993877 585688827 /nfs/dbraw/zinc/68/88/27/585688827.db2.gz DCBANBRGCDMEFJ-UHFFFAOYSA-N 1 2 248.326 2.331 20 0 BEADLO COCC1=CC[N@@H+](Cc2coc(C3CC3)n2)CC1 ZINC000775993877 585688828 /nfs/dbraw/zinc/68/88/28/585688828.db2.gz DCBANBRGCDMEFJ-UHFFFAOYSA-N 1 2 248.326 2.331 20 0 BEADLO CCC1(NC(=O)c2cccc3[nH+]ccn32)CCC1 ZINC000776980576 585707122 /nfs/dbraw/zinc/70/71/22/585707122.db2.gz SQKXPXMNXAGHHE-UHFFFAOYSA-N 1 2 243.310 2.397 20 0 BEADLO C[C@@H]1CC[C@H](C)N1C(=O)c1cccc2[nH+]ccn21 ZINC000777013604 585707252 /nfs/dbraw/zinc/70/72/52/585707252.db2.gz ZOEOYPSHJRQKPW-PHIMTYICSA-N 1 2 243.310 2.347 20 0 BEADLO O=C(/C=C\C1CC1)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000777454589 585712571 /nfs/dbraw/zinc/71/25/71/585712571.db2.gz ZWBKORUHHCTCSE-ISALQUGTSA-N 1 2 231.299 2.039 20 0 BEADLO CCC/C=C\C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000777457966 585712876 /nfs/dbraw/zinc/71/28/76/585712876.db2.gz XIXJEOKUDWZXJO-MEQVVJDKSA-N 1 2 233.315 2.430 20 0 BEADLO COc1cc2c(cc1F)C[N@H+](CCF)CC2 ZINC000777745692 585719350 /nfs/dbraw/zinc/71/93/50/585719350.db2.gz TZGMXLGBUZADPG-UHFFFAOYSA-N 1 2 227.254 2.162 20 0 BEADLO COc1cc2c(cc1F)C[N@@H+](CCF)CC2 ZINC000777745692 585719351 /nfs/dbraw/zinc/71/93/51/585719351.db2.gz TZGMXLGBUZADPG-UHFFFAOYSA-N 1 2 227.254 2.162 20 0 BEADLO COc1cc2cc[nH+]cc2cc1OC(C)=O ZINC000778381873 585732915 /nfs/dbraw/zinc/73/29/15/585732915.db2.gz ATKXJAFFIRAJSC-UHFFFAOYSA-N 1 2 217.224 2.169 20 0 BEADLO Cc1ccc([C@H](O)C[NH2+][C@@H](C)c2cn[nH]c2C)o1 ZINC000779071253 585744535 /nfs/dbraw/zinc/74/45/35/585744535.db2.gz DBDWNGOWLXQPIP-JOYOIKCWSA-N 1 2 249.314 2.004 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]CCNc1ccccc1 ZINC000779079156 585745030 /nfs/dbraw/zinc/74/50/30/585745030.db2.gz RMSJQBAFINTENU-NSHDSACASA-N 1 2 244.342 2.481 20 0 BEADLO CC[C@]1(C)COCC[N@@H+]1Cc1ccc(F)nc1 ZINC000779170529 585746871 /nfs/dbraw/zinc/74/68/71/585746871.db2.gz AZAGIRYWWLRIKD-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO CC[C@]1(C)COCC[N@H+]1Cc1ccc(F)nc1 ZINC000779170529 585746872 /nfs/dbraw/zinc/74/68/72/585746872.db2.gz AZAGIRYWWLRIKD-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO Cc1cc([NH+](C)C)ccc1N[C@H](C)CCO ZINC000779415175 585754114 /nfs/dbraw/zinc/75/41/14/585754114.db2.gz CQJFJNUTXAKFNR-LLVKDONJSA-N 1 2 222.332 2.244 20 0 BEADLO Cc1cc(N(C)C)ccc1[NH2+][C@H](C)CCO ZINC000779415175 585754115 /nfs/dbraw/zinc/75/41/15/585754115.db2.gz CQJFJNUTXAKFNR-LLVKDONJSA-N 1 2 222.332 2.244 20 0 BEADLO CCOc1ccc([NH2+][C@@H](C)CCO)cc1 ZINC000779416834 585754180 /nfs/dbraw/zinc/75/41/80/585754180.db2.gz NQXAETLZKFVQMJ-JTQLQIEISA-N 1 2 209.289 2.268 20 0 BEADLO CC/C(C)=C(\C)C(=O)N(C)Cc1[nH+]ccn1C ZINC000779754584 585761117 /nfs/dbraw/zinc/76/11/17/585761117.db2.gz PPLBJMIVCVFLGB-ZHACJKMWSA-N 1 2 235.331 2.125 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OCCCC(C)(C)C ZINC000780126102 585772869 /nfs/dbraw/zinc/77/28/69/585772869.db2.gz SZMCTNZRLRHLLC-SECBINFHSA-N 1 2 216.325 2.346 20 0 BEADLO CC[NH+]1CCN(C[C@H]2CCc3ccccc32)CC1 ZINC000780286736 585776997 /nfs/dbraw/zinc/77/69/97/585776997.db2.gz KHEIACCOLRYRGX-OAHLLOKOSA-N 1 2 244.382 2.354 20 0 BEADLO COCCCSCc1cc[nH+]c(N(C)C)c1 ZINC000780339090 585778074 /nfs/dbraw/zinc/77/80/74/585778074.db2.gz OUHXNTIEIXALAR-UHFFFAOYSA-N 1 2 240.372 2.417 20 0 BEADLO C1=CO[C@@H](CNc2cc[nH+]c(C3CC3)n2)CC1 ZINC000780621610 585782530 /nfs/dbraw/zinc/78/25/30/585782530.db2.gz HBZDZAPILKVGHT-LLVKDONJSA-N 1 2 231.299 2.459 20 0 BEADLO CC[C@H](NC(=O)C[C@H](C)C1CC1)c1[nH]cc[nH+]1 ZINC000781994144 585806331 /nfs/dbraw/zinc/80/63/31/585806331.db2.gz YAKZNQDKBXPCNR-ONGXEEELSA-N 1 2 235.331 2.413 20 0 BEADLO CN(C)c1cc(COC(=O)c2ccoc2)cc[nH+]1 ZINC000782147275 585808511 /nfs/dbraw/zinc/80/85/11/585808511.db2.gz PYMACTRMXGGPFO-UHFFFAOYSA-N 1 2 246.266 2.098 20 0 BEADLO CN(C)c1cc(COC(=O)c2ccco2)cc[nH+]1 ZINC000782147713 585808564 /nfs/dbraw/zinc/80/85/64/585808564.db2.gz WBHYRQZYPAHLFP-UHFFFAOYSA-N 1 2 246.266 2.098 20 0 BEADLO CC(C)OCCO[NH+]=C(N)Cc1cccs1 ZINC000782328865 585814969 /nfs/dbraw/zinc/81/49/69/585814969.db2.gz OSAXULGCSLSBSJ-UHFFFAOYSA-N 1 2 242.344 2.214 20 0 BEADLO Cc1oncc1C[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000782532192 585819585 /nfs/dbraw/zinc/81/95/85/585819585.db2.gz YZTJILAGOVSHGD-LDYMZIIASA-N 1 2 212.268 2.163 20 0 BEADLO Cc1oncc1C[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000782532192 585819586 /nfs/dbraw/zinc/81/95/86/585819586.db2.gz YZTJILAGOVSHGD-LDYMZIIASA-N 1 2 212.268 2.163 20 0 BEADLO Cc1ccnc(C[NH2+][C@@H](C)c2cnccc2C)n1 ZINC000782999250 585826867 /nfs/dbraw/zinc/82/68/67/585826867.db2.gz NTAUVHIRYGHTPS-LBPRGKRZSA-N 1 2 242.326 2.339 20 0 BEADLO CC[N@H+](C)[C@@H](C(=O)OC1CC1)c1ccccc1 ZINC000783190289 585829599 /nfs/dbraw/zinc/82/95/99/585829599.db2.gz XYFQPKXJIUYUFA-CYBMUJFWSA-N 1 2 233.311 2.385 20 0 BEADLO CC[N@@H+](C)[C@@H](C(=O)OC1CC1)c1ccccc1 ZINC000783190289 585829600 /nfs/dbraw/zinc/82/96/00/585829600.db2.gz XYFQPKXJIUYUFA-CYBMUJFWSA-N 1 2 233.311 2.385 20 0 BEADLO Cc1nc(CC(N)=[NH+]OCCC2CC2)cs1 ZINC000783553286 585836598 /nfs/dbraw/zinc/83/65/98/585836598.db2.gz LFDNINDMTQPOGK-UHFFFAOYSA-N 1 2 239.344 2.293 20 0 BEADLO C[C@H]1CC[C@H]1[NH2+]c1ccc(-n2ccnn2)cc1 ZINC000783585016 585837531 /nfs/dbraw/zinc/83/75/31/585837531.db2.gz IHSSGBWBBLEDCI-GXFFZTMASA-N 1 2 228.299 2.478 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccc(F)nc2)[C@@H](C)[C@H](C)O1 ZINC000783737987 585841551 /nfs/dbraw/zinc/84/15/51/585841551.db2.gz RNABITIHBITZLR-VWYCJHECSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccc(F)nc2)[C@@H](C)[C@H](C)O1 ZINC000783737987 585841552 /nfs/dbraw/zinc/84/15/52/585841552.db2.gz RNABITIHBITZLR-VWYCJHECSA-N 1 2 238.306 2.218 20 0 BEADLO CC(C)[C@H](F)C(=O)Nc1ccc[nH+]c1N(C)C ZINC000784051830 585847999 /nfs/dbraw/zinc/84/79/99/585847999.db2.gz QBNWGNONXGAKIP-JTQLQIEISA-N 1 2 239.294 2.080 20 0 BEADLO O=C(CCCn1cc[nH+]c1)NC12CCC(CC1)C2 ZINC000784353624 585856653 /nfs/dbraw/zinc/85/66/53/585856653.db2.gz OULXHGNXGUALCO-UHFFFAOYSA-N 1 2 247.342 2.112 20 0 BEADLO CC[C@@H](C)[C@@H](C)C(=O)OCCCn1cc[nH+]c1 ZINC000784614458 585864772 /nfs/dbraw/zinc/86/47/72/585864772.db2.gz RMYMFRRPRWTSGG-VXGBXAGGSA-N 1 2 238.331 2.499 20 0 BEADLO CC(C)/C=C/C(=O)OCc1cc[nH+]c(N(C)C)c1 ZINC000785048716 585869953 /nfs/dbraw/zinc/86/99/53/585869953.db2.gz BCCRKQCWGUHECP-AATRIKPKSA-N 1 2 248.326 2.403 20 0 BEADLO CC[N@@H+]1CCCC[C@@H]1C(=O)O[C@H](C)C(F)F ZINC000786517866 585893824 /nfs/dbraw/zinc/89/38/24/585893824.db2.gz YNULSEYHNNCUEY-RKDXNWHRSA-N 1 2 235.274 2.058 20 0 BEADLO CC[N@H+]1CCCC[C@@H]1C(=O)O[C@H](C)C(F)F ZINC000786517866 585893825 /nfs/dbraw/zinc/89/38/25/585893825.db2.gz YNULSEYHNNCUEY-RKDXNWHRSA-N 1 2 235.274 2.058 20 0 BEADLO Cc1ccc(COC(=O)[C@@H]2CCC=CO2)c(C)[nH+]1 ZINC000787042669 585900343 /nfs/dbraw/zinc/90/03/43/585900343.db2.gz RMTYKOFZKCZMPO-ZDUSSCGKSA-N 1 2 247.294 2.434 20 0 BEADLO Cc1ccc(COC(=O)[C@H]2CCC=CO2)c(C)[nH+]1 ZINC000787042667 585900364 /nfs/dbraw/zinc/90/03/64/585900364.db2.gz RMTYKOFZKCZMPO-CYBMUJFWSA-N 1 2 247.294 2.434 20 0 BEADLO Cc1nc(F)ccc1C[N@H+]1CCO[C@@H](C)[C@H]1C ZINC000787174298 585902654 /nfs/dbraw/zinc/90/26/54/585902654.db2.gz BCJBULQGRWUZJS-MNOVXSKESA-N 1 2 238.306 2.138 20 0 BEADLO Cc1nc(F)ccc1C[N@@H+]1CCO[C@@H](C)[C@H]1C ZINC000787174298 585902655 /nfs/dbraw/zinc/90/26/55/585902655.db2.gz BCJBULQGRWUZJS-MNOVXSKESA-N 1 2 238.306 2.138 20 0 BEADLO C[C@H]1CC[N@H+](Cc2ccc(F)cn2)C[C@@H]1F ZINC000787279163 585904598 /nfs/dbraw/zinc/90/45/98/585904598.db2.gz HVEJQSSOJXMLNB-CABZTGNLSA-N 1 2 226.270 2.401 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2ccc(F)cn2)C[C@@H]1F ZINC000787279163 585904599 /nfs/dbraw/zinc/90/45/99/585904599.db2.gz HVEJQSSOJXMLNB-CABZTGNLSA-N 1 2 226.270 2.401 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1ccc2[nH]ccc2c1 ZINC000787372650 585908237 /nfs/dbraw/zinc/90/82/37/585908237.db2.gz NBGWKOCIAROEBN-UHFFFAOYSA-N 1 2 246.310 2.163 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1ccc2[nH]ccc2c1 ZINC000787372650 585908238 /nfs/dbraw/zinc/90/82/38/585908238.db2.gz NBGWKOCIAROEBN-UHFFFAOYSA-N 1 2 246.310 2.163 20 0 BEADLO Cc1cc(C(=O)OCc2cc[nH+]c(N)c2)c(C)o1 ZINC000787572796 585911914 /nfs/dbraw/zinc/91/19/14/585911914.db2.gz OQXIKQVLBZDRAB-UHFFFAOYSA-N 1 2 246.266 2.231 20 0 BEADLO Cc1nc(CC(N)=[NH+]OC2CCC2)cs1 ZINC000787910770 585917361 /nfs/dbraw/zinc/91/73/61/585917361.db2.gz RJNFVTBSPJUEKX-UHFFFAOYSA-N 1 2 225.317 2.045 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccnc(F)c2)[C@@H](C)[C@@H](C)O1 ZINC000859270279 589026713 /nfs/dbraw/zinc/02/67/13/589026713.db2.gz NYSDYSNANDFHFN-OUAUKWLOSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccnc(F)c2)[C@@H](C)[C@@H](C)O1 ZINC000859270279 589026715 /nfs/dbraw/zinc/02/67/15/589026715.db2.gz NYSDYSNANDFHFN-OUAUKWLOSA-N 1 2 238.306 2.218 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@@H+]1CC[C@H]2C[C@H]21 ZINC000789300968 585939186 /nfs/dbraw/zinc/93/91/86/585939186.db2.gz QSUZKWGXNQXFSE-GDPRMGEGSA-N 1 2 237.324 2.056 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@H+]1CC[C@H]2C[C@H]21 ZINC000789300968 585939187 /nfs/dbraw/zinc/93/91/87/585939187.db2.gz QSUZKWGXNQXFSE-GDPRMGEGSA-N 1 2 237.324 2.056 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+]C[C@@H](C)Cc1ccccc1 ZINC000789744621 585949166 /nfs/dbraw/zinc/94/91/66/585949166.db2.gz WYDFUINJJVAMCR-QWHCGFSZSA-N 1 2 249.354 2.406 20 0 BEADLO Cn1cc[nH+]c1CCCOC(=O)[C@H]1CC=CCC1 ZINC000789786994 585950069 /nfs/dbraw/zinc/95/00/69/585950069.db2.gz FCCHNZJHTLKXLR-LBPRGKRZSA-N 1 2 248.326 2.252 20 0 BEADLO C/C=C(/CC)C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000789849700 585951682 /nfs/dbraw/zinc/95/16/82/585951682.db2.gz UPRBLIPZQBRZQE-ZUYFITGHSA-N 1 2 221.304 2.333 20 0 BEADLO CC=C(CC)C(=O)N[C@H](CC)c1[nH]cc[nH+]1 ZINC000789849700 585951683 /nfs/dbraw/zinc/95/16/83/585951683.db2.gz UPRBLIPZQBRZQE-ZUYFITGHSA-N 1 2 221.304 2.333 20 0 BEADLO COC(=O)Oc1ccc(-n2cc[nH+]c2)cc1 ZINC000790324211 585963969 /nfs/dbraw/zinc/96/39/69/585963969.db2.gz IOHUTMVTKFQVEI-UHFFFAOYSA-N 1 2 218.212 2.018 20 0 BEADLO CC[C@@H]1CC[C@@H]1[NH2+]c1ccc(OCC(N)=O)cc1 ZINC000806151982 585984167 /nfs/dbraw/zinc/98/41/67/585984167.db2.gz NGVUDWJMXIKHCZ-MFKMUULPSA-N 1 2 248.326 2.151 20 0 BEADLO C[C@@H]1C[C@@H](C)N1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000791821596 585988864 /nfs/dbraw/zinc/98/88/64/585988864.db2.gz HEWPDFHJXOJZBV-NXEZZACHSA-N 1 2 244.298 2.349 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)OCc2cc[nH+]c(N)c2)C1 ZINC000792101434 585995769 /nfs/dbraw/zinc/99/57/69/585995769.db2.gz CTNVWLYXRAEKTD-MWLCHTKSSA-N 1 2 234.299 2.143 20 0 BEADLO C[C@H]1CC[C@H](C(=O)OCc2cc[nH+]c(N)c2)C1 ZINC000792101437 585995924 /nfs/dbraw/zinc/99/59/24/585995924.db2.gz CTNVWLYXRAEKTD-ONGXEEELSA-N 1 2 234.299 2.143 20 0 BEADLO O=C1O[C@H](C[N@H+]2CCC=C(F)C2)CC12CCC2 ZINC000792269944 585998561 /nfs/dbraw/zinc/99/85/61/585998561.db2.gz WUDDLOPGSODVRS-NSHDSACASA-N 1 2 239.290 2.031 20 0 BEADLO O=C1O[C@H](C[N@@H+]2CCC=C(F)C2)CC12CCC2 ZINC000792269944 585998562 /nfs/dbraw/zinc/99/85/62/585998562.db2.gz WUDDLOPGSODVRS-NSHDSACASA-N 1 2 239.290 2.031 20 0 BEADLO CC(C)[C@@H]([NH2+]Cc1ncccn1)c1ccccn1 ZINC000792273762 585998697 /nfs/dbraw/zinc/99/86/97/585998697.db2.gz XLXXUYRXGLOGKU-CQSZACIVSA-N 1 2 242.326 2.359 20 0 BEADLO CC[C@@H]1CCCC[C@H]1C(=O)NC1=[NH+]CCS1 ZINC000792857343 586005801 /nfs/dbraw/zinc/00/58/01/586005801.db2.gz YOKPZOOELATYDZ-NXEZZACHSA-N 1 2 240.372 2.422 20 0 BEADLO CC[C@H]1CCCC[C@H]1C(=O)NC1=[NH+]CCS1 ZINC000792857351 586005924 /nfs/dbraw/zinc/00/59/24/586005924.db2.gz YOKPZOOELATYDZ-VHSXEESVSA-N 1 2 240.372 2.422 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cccnc2F)nc1 ZINC000793290682 586016350 /nfs/dbraw/zinc/01/63/50/586016350.db2.gz VHYPQZAXDJXCPU-UHFFFAOYSA-N 1 2 231.274 2.214 20 0 BEADLO CC[C@H]1CC[N@@H+]1CN1Cc2ccc(F)cc2C1=O ZINC000793822755 586027503 /nfs/dbraw/zinc/02/75/03/586027503.db2.gz FHNVKCDJPIUNBD-LBPRGKRZSA-N 1 2 248.301 2.223 20 0 BEADLO CC[C@H]1CC[N@H+]1CN1Cc2ccc(F)cc2C1=O ZINC000793822755 586027504 /nfs/dbraw/zinc/02/75/04/586027504.db2.gz FHNVKCDJPIUNBD-LBPRGKRZSA-N 1 2 248.301 2.223 20 0 BEADLO CC(C)(C(=O)OCCCn1cc[nH+]c1)C(F)F ZINC000795863729 586093684 /nfs/dbraw/zinc/09/36/84/586093684.db2.gz RPTWWEZJOIBREO-UHFFFAOYSA-N 1 2 246.257 2.108 20 0 BEADLO Cc1ccc(N2CC[N@@H+](C(C)C)CC2=O)cc1 ZINC000796088592 586097295 /nfs/dbraw/zinc/09/72/95/586097295.db2.gz HXTCUXWAOOEDFC-UHFFFAOYSA-N 1 2 232.327 2.052 20 0 BEADLO Cc1ccc(N2CC[N@H+](C(C)C)CC2=O)cc1 ZINC000796088592 586097296 /nfs/dbraw/zinc/09/72/96/586097296.db2.gz HXTCUXWAOOEDFC-UHFFFAOYSA-N 1 2 232.327 2.052 20 0 BEADLO CCCC[N@@H+]1CCN(c2ccc(C)cc2)C(=O)C1 ZINC000796082746 586097385 /nfs/dbraw/zinc/09/73/85/586097385.db2.gz ZLTXEDGAMMOTCY-UHFFFAOYSA-N 1 2 246.354 2.444 20 0 BEADLO CCCC[N@H+]1CCN(c2ccc(C)cc2)C(=O)C1 ZINC000796082746 586097386 /nfs/dbraw/zinc/09/73/86/586097386.db2.gz ZLTXEDGAMMOTCY-UHFFFAOYSA-N 1 2 246.354 2.444 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1ccc(CF)cc1 ZINC000796490995 586105055 /nfs/dbraw/zinc/10/50/55/586105055.db2.gz HGFXGFPFYMEHAX-SNVBAGLBSA-N 1 2 239.290 2.149 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(CF)cc1 ZINC000796490995 586105056 /nfs/dbraw/zinc/10/50/56/586105056.db2.gz HGFXGFPFYMEHAX-SNVBAGLBSA-N 1 2 239.290 2.149 20 0 BEADLO Cc1occc1C[NH2+][C@@H]1CCCc2[nH]ncc21 ZINC000796719637 586110620 /nfs/dbraw/zinc/11/06/20/586110620.db2.gz HVZJCWHOLZIRTO-GFCCVEGCSA-N 1 2 231.299 2.478 20 0 BEADLO CC(C)Oc1cc[nH+]cc1COC(=O)C(F)F ZINC000806104792 586124969 /nfs/dbraw/zinc/12/49/69/586124969.db2.gz ANKWQXDCJXMJLA-UHFFFAOYSA-N 1 2 245.225 2.177 20 0 BEADLO CC[NH2+]c1ccc(O[C@@H]2CCN(C)C2=O)cc1C ZINC000798392729 586143537 /nfs/dbraw/zinc/14/35/37/586143537.db2.gz UMEJMZGGJAAJKB-CYBMUJFWSA-N 1 2 248.326 2.036 20 0 BEADLO CC[C@@H](C)[N@H+](CC(=O)OC)Cc1ccoc1 ZINC000798955191 586154112 /nfs/dbraw/zinc/15/41/12/586154112.db2.gz MATSFQQEMTWJLY-SNVBAGLBSA-N 1 2 225.288 2.053 20 0 BEADLO CC[C@@H](C)[N@@H+](CC(=O)OC)Cc1ccoc1 ZINC000798955191 586154113 /nfs/dbraw/zinc/15/41/13/586154113.db2.gz MATSFQQEMTWJLY-SNVBAGLBSA-N 1 2 225.288 2.053 20 0 BEADLO O=C(CSc1[nH+]cc2ccccn21)C(F)F ZINC000799875331 586198863 /nfs/dbraw/zinc/19/88/63/586198863.db2.gz XFNARPUHKKBBCB-UHFFFAOYSA-N 1 2 242.250 2.261 20 0 BEADLO CCCC[C@H](C)C(=O)OCc1c[nH+]cn1C ZINC000800394526 586215659 /nfs/dbraw/zinc/21/56/59/586215659.db2.gz HNPVAHWXBKPQLZ-JTQLQIEISA-N 1 2 224.304 2.290 20 0 BEADLO CC(C)C(=O)CC[N@@H+]1Cc2ccc(O)cc2C1 ZINC000859478108 589040243 /nfs/dbraw/zinc/04/02/43/589040243.db2.gz QZZIPJUWJFPAEF-UHFFFAOYSA-N 1 2 233.311 2.323 20 0 BEADLO CC(C)C(=O)CC[N@H+]1Cc2ccc(O)cc2C1 ZINC000859478108 589040245 /nfs/dbraw/zinc/04/02/45/589040245.db2.gz QZZIPJUWJFPAEF-UHFFFAOYSA-N 1 2 233.311 2.323 20 0 BEADLO C[C@@H]1C[N@H+](C[C@H]2CC2(Cl)Cl)CCC1=O ZINC000801944657 586282016 /nfs/dbraw/zinc/28/20/16/586282016.db2.gz HBCDLKUVVLYKSA-HTQZYQBOSA-N 1 2 236.142 2.091 20 0 BEADLO C[C@@H]1C[N@@H+](C[C@H]2CC2(Cl)Cl)CCC1=O ZINC000801944657 586282017 /nfs/dbraw/zinc/28/20/17/586282017.db2.gz HBCDLKUVVLYKSA-HTQZYQBOSA-N 1 2 236.142 2.091 20 0 BEADLO ClC1(Cl)C[C@@H]1C[N@@H+]1CCOCC12CC2 ZINC000801981207 586285342 /nfs/dbraw/zinc/28/53/42/586285342.db2.gz KUBCFUJLRGYDSN-MRVPVSSYSA-N 1 2 236.142 2.045 20 0 BEADLO ClC1(Cl)C[C@@H]1C[N@H+]1CCOCC12CC2 ZINC000801981207 586285345 /nfs/dbraw/zinc/28/53/45/586285345.db2.gz KUBCFUJLRGYDSN-MRVPVSSYSA-N 1 2 236.142 2.045 20 0 BEADLO C[C@H](C(=O)O[C@H]1CC[N@H+](CCF)C1)C(C)(C)C ZINC000802235051 586297151 /nfs/dbraw/zinc/29/71/51/586297151.db2.gz VPHNSSDNRFQWHG-MNOVXSKESA-N 1 2 245.338 2.256 20 0 BEADLO C[C@H](C(=O)O[C@H]1CC[N@@H+](CCF)C1)C(C)(C)C ZINC000802235051 586297152 /nfs/dbraw/zinc/29/71/52/586297152.db2.gz VPHNSSDNRFQWHG-MNOVXSKESA-N 1 2 245.338 2.256 20 0 BEADLO CCCC[C@@H](C)C(=O)O[C@@H]1CC[N@H+](CCF)C1 ZINC000802232882 586297634 /nfs/dbraw/zinc/29/76/34/586297634.db2.gz LMWDUXVGGYEPEI-VXGBXAGGSA-N 1 2 245.338 2.400 20 0 BEADLO CCCC[C@@H](C)C(=O)O[C@@H]1CC[N@@H+](CCF)C1 ZINC000802232882 586297637 /nfs/dbraw/zinc/29/76/37/586297637.db2.gz LMWDUXVGGYEPEI-VXGBXAGGSA-N 1 2 245.338 2.400 20 0 BEADLO C[C@H](C(=O)O[C@@H]1CC[N@H+](CCF)C1)C(C)(C)C ZINC000802235050 586298305 /nfs/dbraw/zinc/29/83/05/586298305.db2.gz VPHNSSDNRFQWHG-GHMZBOCLSA-N 1 2 245.338 2.256 20 0 BEADLO C[C@H](C(=O)O[C@@H]1CC[N@@H+](CCF)C1)C(C)(C)C ZINC000802235050 586298307 /nfs/dbraw/zinc/29/83/07/586298307.db2.gz VPHNSSDNRFQWHG-GHMZBOCLSA-N 1 2 245.338 2.256 20 0 BEADLO CCC(C)(C)C(=O)O[C@@H]1CC[N@H+](CCF)C1 ZINC000802239701 586299192 /nfs/dbraw/zinc/29/91/92/586299192.db2.gz XQDXFXKSMZIQEI-SNVBAGLBSA-N 1 2 231.311 2.010 20 0 BEADLO CCC(C)(C)C(=O)O[C@@H]1CC[N@@H+](CCF)C1 ZINC000802239701 586299193 /nfs/dbraw/zinc/29/91/93/586299193.db2.gz XQDXFXKSMZIQEI-SNVBAGLBSA-N 1 2 231.311 2.010 20 0 BEADLO Cn1cc[nH+]c1CCCOC(=O)CCC1CC1 ZINC000802787022 586313973 /nfs/dbraw/zinc/31/39/73/586313973.db2.gz YTDXVYHBZZBBJV-UHFFFAOYSA-N 1 2 236.315 2.086 20 0 BEADLO Cn1cc[nH+]c1CCCOC(=O)CC1CCC1 ZINC000802784857 586314156 /nfs/dbraw/zinc/31/41/56/586314156.db2.gz WFZJEEOUNYVQCV-UHFFFAOYSA-N 1 2 236.315 2.086 20 0 BEADLO Cc1cc(C(=O)OCCCc2[nH+]ccn2C)co1 ZINC000802788019 586314376 /nfs/dbraw/zinc/31/43/76/586314376.db2.gz OQDLGMFJWIJMBJ-UHFFFAOYSA-N 1 2 248.282 2.111 20 0 BEADLO CC(C)COC(=O)C[N@@H+]1CCCC(F)(F)CC1 ZINC000859537443 589043217 /nfs/dbraw/zinc/04/32/17/589043217.db2.gz CKZRXIQFPOAACU-UHFFFAOYSA-N 1 2 249.301 2.307 20 0 BEADLO CC(C)COC(=O)C[N@H+]1CCCC(F)(F)CC1 ZINC000859537443 589043219 /nfs/dbraw/zinc/04/32/19/589043219.db2.gz CKZRXIQFPOAACU-UHFFFAOYSA-N 1 2 249.301 2.307 20 0 BEADLO CC1(C)CC(C(=O)O[C@@H]2CC[N@H+](CCF)C2)C1 ZINC000802821753 586316854 /nfs/dbraw/zinc/31/68/54/586316854.db2.gz RATWCIRLPNQDPS-LLVKDONJSA-N 1 2 243.322 2.010 20 0 BEADLO CC1(C)CC(C(=O)O[C@@H]2CC[N@@H+](CCF)C2)C1 ZINC000802821753 586316856 /nfs/dbraw/zinc/31/68/56/586316856.db2.gz RATWCIRLPNQDPS-LLVKDONJSA-N 1 2 243.322 2.010 20 0 BEADLO CC(C)c1[nH]ccc1C(=O)OCCn1cc[nH+]c1 ZINC000803777239 586373778 /nfs/dbraw/zinc/37/37/78/586373778.db2.gz CCZZVKCWMDBICB-UHFFFAOYSA-N 1 2 247.298 2.192 20 0 BEADLO C[C@@H]1CCN(C[N@@H+]2Cc3ccccc3[C@H]2C)C1=O ZINC000840020367 586382389 /nfs/dbraw/zinc/38/23/89/586382389.db2.gz ZSUILELLHMFBTE-VXGBXAGGSA-N 1 2 244.338 2.389 20 0 BEADLO C[C@@H]1CCN(C[N@H+]2Cc3ccccc3[C@H]2C)C1=O ZINC000840020367 586382391 /nfs/dbraw/zinc/38/23/91/586382391.db2.gz ZSUILELLHMFBTE-VXGBXAGGSA-N 1 2 244.338 2.389 20 0 BEADLO CCCCCCC(=O)N[C@@H]1CCc2c[nH+]cn2C1 ZINC000804332707 586391359 /nfs/dbraw/zinc/39/13/59/586391359.db2.gz PRLHTEKPCIDXHD-GFCCVEGCSA-N 1 2 249.358 2.285 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N1CCC2(CCCC2)C1 ZINC000806961164 586421222 /nfs/dbraw/zinc/42/12/22/586421222.db2.gz LIMIBUUYCCEGEJ-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO Cn1cnn(C[N@H+](C)C2CC(C)(C)C2)c1=S ZINC000840163020 586500803 /nfs/dbraw/zinc/50/08/03/586500803.db2.gz DCNNBWMNWDMOCU-UHFFFAOYSA-N 1 2 240.376 2.029 20 0 BEADLO Cn1cnn(C[N@@H+](C)C2CC(C)(C)C2)c1=S ZINC000840163020 586500804 /nfs/dbraw/zinc/50/08/04/586500804.db2.gz DCNNBWMNWDMOCU-UHFFFAOYSA-N 1 2 240.376 2.029 20 0 BEADLO c1ccc(OCC[N@@H+]2Cc3ccncc3C2)cc1 ZINC000809565449 586507268 /nfs/dbraw/zinc/50/72/68/586507268.db2.gz GZWMJDVJEAUBEU-UHFFFAOYSA-N 1 2 240.306 2.476 20 0 BEADLO c1ccc(OCC[N@H+]2Cc3ccncc3C2)cc1 ZINC000809565449 586507270 /nfs/dbraw/zinc/50/72/70/586507270.db2.gz GZWMJDVJEAUBEU-UHFFFAOYSA-N 1 2 240.306 2.476 20 0 BEADLO Cc1nonc1C[NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000809744253 586516587 /nfs/dbraw/zinc/51/65/87/586516587.db2.gz CSRVVAHQKADBLN-GZMMTYOYSA-N 1 2 247.298 2.384 20 0 BEADLO CC[N@H+](Cc1cnn(C)n1)Cc1ccc(C)cc1 ZINC000809937430 586524427 /nfs/dbraw/zinc/52/44/27/586524427.db2.gz QTNCVDXUBDCSLX-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CC[N@@H+](Cc1cnn(C)n1)Cc1ccc(C)cc1 ZINC000809937430 586524428 /nfs/dbraw/zinc/52/44/28/586524428.db2.gz QTNCVDXUBDCSLX-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO Cc1ccc(C)c(C[NH2+][C@@]2(C)CCOC2=O)c1 ZINC000810096234 586533636 /nfs/dbraw/zinc/53/36/36/586533636.db2.gz IJTQDMHIZFAJAB-AWEZNQCLSA-N 1 2 233.311 2.099 20 0 BEADLO OCc1ccc(NCc2ccc(Cl)nc2)[nH+]c1 ZINC000811500892 586560070 /nfs/dbraw/zinc/56/00/70/586560070.db2.gz AWVYXEGLHJZXDA-UHFFFAOYSA-N 1 2 249.701 2.234 20 0 BEADLO Cc1ccc2c(c1)/C(=C/c1[nH]cc[nH+]1)C(=O)N2C ZINC000811701112 586565871 /nfs/dbraw/zinc/56/58/71/586565871.db2.gz UOCKTGOVXWYXQL-FLIBITNWSA-N 1 2 239.278 2.235 20 0 BEADLO CC(C)c1nc(N2CC(C3CC3)C2)cc[nH+]1 ZINC000812481073 586578104 /nfs/dbraw/zinc/57/81/04/586578104.db2.gz IPDCEOGVVJROQA-UHFFFAOYSA-N 1 2 217.316 2.446 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)OCc1cc[nH+]c(N)c1 ZINC000812638493 586581194 /nfs/dbraw/zinc/58/11/94/586581194.db2.gz SSAOQWRWPOQRMS-GHMZBOCLSA-N 1 2 234.299 2.143 20 0 BEADLO c1cc(OCC2CCC3(CC2)OCCO3)cc[nH+]1 ZINC000814265681 586621090 /nfs/dbraw/zinc/62/10/90/586621090.db2.gz PMGUDMIMZKLSRE-UHFFFAOYSA-N 1 2 249.310 2.394 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)C[C@@H](C)C1CC1 ZINC000814327902 586621476 /nfs/dbraw/zinc/62/14/76/586621476.db2.gz UTOVYJDANBTBSB-SNVBAGLBSA-N 1 2 248.326 2.143 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1cnc(Cl)c(C)c1 ZINC000816637207 586745917 /nfs/dbraw/zinc/74/59/17/586745917.db2.gz WPGJWHAVZYFEDO-LLVKDONJSA-N 1 2 240.734 2.264 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1cnc(Cl)c(C)c1 ZINC000816637207 586745919 /nfs/dbraw/zinc/74/59/19/586745919.db2.gz WPGJWHAVZYFEDO-LLVKDONJSA-N 1 2 240.734 2.264 20 0 BEADLO Cc1cccc2ncc(C[N@H+](C)CCF)n21 ZINC000816639980 586746604 /nfs/dbraw/zinc/74/66/04/586746604.db2.gz NUYKJDGXIDGBJA-UHFFFAOYSA-N 1 2 221.279 2.044 20 0 BEADLO Cc1cccc2ncc(C[N@@H+](C)CCF)n21 ZINC000816639980 586746605 /nfs/dbraw/zinc/74/66/05/586746605.db2.gz NUYKJDGXIDGBJA-UHFFFAOYSA-N 1 2 221.279 2.044 20 0 BEADLO C[C@H]1C[N@H+](Cc2cn3cccc(F)c3n2)[C@H]1C ZINC000816647613 586750530 /nfs/dbraw/zinc/75/05/30/586750530.db2.gz VQLWGSPZCOENTD-UWVGGRQHSA-N 1 2 233.290 2.314 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cn3cccc(F)c3n2)[C@H]1C ZINC000816647613 586750531 /nfs/dbraw/zinc/75/05/31/586750531.db2.gz VQLWGSPZCOENTD-UWVGGRQHSA-N 1 2 233.290 2.314 20 0 BEADLO C[C@H]1CC/C(=C\C(=O)N2CCc3[nH]c[nH+]c3C2)C1 ZINC000816651351 586752431 /nfs/dbraw/zinc/75/24/31/586752431.db2.gz DFAHASBXLQJSPO-VUBLIPMDSA-N 1 2 245.326 2.041 20 0 BEADLO C[C@H]1CC/C(=C\C(=O)N2CCc3[nH+]c[nH]c3C2)C1 ZINC000816651351 586752432 /nfs/dbraw/zinc/75/24/32/586752432.db2.gz DFAHASBXLQJSPO-VUBLIPMDSA-N 1 2 245.326 2.041 20 0 BEADLO COC(=O)N(C)[C@@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000817497658 586807991 /nfs/dbraw/zinc/80/79/91/586807991.db2.gz XDWQFKCJJNNESN-LLVKDONJSA-N 1 2 245.282 2.197 20 0 BEADLO O=C(OCc1cccc2[nH+]ccn21)[C@@H]1CC12CC2 ZINC000817721693 586820383 /nfs/dbraw/zinc/82/03/83/586820383.db2.gz MFEURGCBWJSXOW-NSHDSACASA-N 1 2 242.278 2.178 20 0 BEADLO c1ccc2[nH+]c(N3C[C@@H]4C[C@H]3CS4)[nH]c2c1 ZINC000840351347 586841996 /nfs/dbraw/zinc/84/19/96/586841996.db2.gz QENCQWWGXQTPEB-IUCAKERBSA-N 1 2 231.324 2.257 20 0 BEADLO Cc1oncc1C[N@@H+]1CCc2c(O)cccc2C1 ZINC000859947289 589073096 /nfs/dbraw/zinc/07/30/96/589073096.db2.gz YYOGSUSSQSGHJG-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO Cc1oncc1C[N@H+]1CCc2c(O)cccc2C1 ZINC000859947289 589073097 /nfs/dbraw/zinc/07/30/97/589073097.db2.gz YYOGSUSSQSGHJG-UHFFFAOYSA-N 1 2 244.294 2.247 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1csnn1)c1ccns1 ZINC000860061547 589076724 /nfs/dbraw/zinc/07/67/24/589076724.db2.gz LCGNBFITVIWDDI-NKWVEPMBSA-N 1 2 240.357 2.406 20 0 BEADLO Cc1ccc(NC(=O)/C=C/[C@H]2CCCO2)c(C)[nH+]1 ZINC000819376188 586958339 /nfs/dbraw/zinc/95/83/39/586958339.db2.gz UWAABEPQNXDXRF-WAFBPQNNSA-N 1 2 246.310 2.372 20 0 BEADLO C[C@]12CCCC[C@H]1C[N@@H+]2Cc1cnsn1 ZINC000860048579 589077482 /nfs/dbraw/zinc/07/74/82/589077482.db2.gz ZJZNQKRTWDFVDY-ONGXEEELSA-N 1 2 223.345 2.303 20 0 BEADLO C[C@]12CCCC[C@H]1C[N@H+]2Cc1cnsn1 ZINC000860048579 589077484 /nfs/dbraw/zinc/07/74/84/589077484.db2.gz ZJZNQKRTWDFVDY-ONGXEEELSA-N 1 2 223.345 2.303 20 0 BEADLO C[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000819544687 586975935 /nfs/dbraw/zinc/97/59/35/586975935.db2.gz TYUAEHLDQDHDHJ-IJLUTSLNSA-N 1 2 247.342 2.270 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)C(F)=C2CCC2)c2[nH+]ccn21 ZINC000819558294 586977495 /nfs/dbraw/zinc/97/74/95/586977495.db2.gz SLDNUKHNASXAHO-PSASIEDQSA-N 1 2 249.289 2.413 20 0 BEADLO CSCCCCC(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819773718 586991415 /nfs/dbraw/zinc/99/14/15/586991415.db2.gz MOJWEOYBQOELST-MRVPVSSYSA-N 1 2 246.401 2.127 20 0 BEADLO CCCCSCC(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819768590 586991757 /nfs/dbraw/zinc/99/17/57/586991757.db2.gz NMMUPFWNSMXUSF-QMMMGPOBSA-N 1 2 246.401 2.127 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)[C@H]2CCC(C)(C)C2)S1 ZINC000819775636 586992597 /nfs/dbraw/zinc/99/25/97/586992597.db2.gz IRZNCFVRDXCONO-BDAKNGLRSA-N 1 2 240.372 2.420 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)C2CC(C)(C)C2)S1 ZINC000819778124 586993369 /nfs/dbraw/zinc/99/33/69/586993369.db2.gz NMNWVOKYVAHKHH-ZETCQYMHSA-N 1 2 226.345 2.030 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)C(C)(C)C2CC2)S1 ZINC000819777153 586993541 /nfs/dbraw/zinc/99/35/41/586993541.db2.gz HTJAUPYRJJWPTK-ZETCQYMHSA-N 1 2 226.345 2.030 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)[C@@H]2CCCC2(C)C)S1 ZINC000819781193 586993867 /nfs/dbraw/zinc/99/38/67/586993867.db2.gz JIWWIGSCVFVMGE-IUCAKERBSA-N 1 2 240.372 2.420 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819780656 586993886 /nfs/dbraw/zinc/99/38/86/586993886.db2.gz IGPYUPARJDVHLH-LNLATYFQSA-N 1 2 240.372 2.276 20 0 BEADLO C[C@H]1CCCC[C@@H]1C(=O)OCc1c[nH+]cn1C ZINC000820161104 587030368 /nfs/dbraw/zinc/03/03/68/587030368.db2.gz DMIJYDARUFKNDZ-JQWIXIFHSA-N 1 2 236.315 2.290 20 0 BEADLO CCC(=CC(=O)N[C@H](C)c1[nH]cc[nH+]1)CC ZINC000820267588 587039585 /nfs/dbraw/zinc/03/95/85/587039585.db2.gz DQHDVUORXUPSPV-SECBINFHSA-N 1 2 221.304 2.333 20 0 BEADLO C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C(C)(C)C1 ZINC000820527721 587052850 /nfs/dbraw/zinc/05/28/50/587052850.db2.gz RDSXRVQPSHJKIM-HBNTYKKESA-N 1 2 247.342 2.160 20 0 BEADLO C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C(C)(C)C1 ZINC000820527721 587052851 /nfs/dbraw/zinc/05/28/51/587052851.db2.gz RDSXRVQPSHJKIM-HBNTYKKESA-N 1 2 247.342 2.160 20 0 BEADLO C[C@@H]1C[C@H]1C(=O)OCCc1cn2ccccc2[nH+]1 ZINC000821596090 587131492 /nfs/dbraw/zinc/13/14/92/587131492.db2.gz ZAAAZBKQKXDXKV-ZYHUDNBSSA-N 1 2 244.294 2.076 20 0 BEADLO C[C@H]1C[C@H](NC(=O)[C@]23C[C@H]2CCC3)c2[nH+]ccn21 ZINC000821787542 587137795 /nfs/dbraw/zinc/13/77/95/587137795.db2.gz VJDUMCKKPJUSPI-BBGACYKPSA-N 1 2 245.326 2.195 20 0 BEADLO C[C@@H](NC(=O)/C=C\c1cn(C)c[nH+]1)C1CCCC1 ZINC000821980254 587148808 /nfs/dbraw/zinc/14/88/08/587148808.db2.gz MAZDKCAPZKXQIK-SKVAFPRGSA-N 1 2 247.342 2.128 20 0 BEADLO CC(C)C(=O)OCc1[nH]c[nH+]c1C(C)(C)C ZINC000822323781 587162193 /nfs/dbraw/zinc/16/21/93/587162193.db2.gz OKMWZHMCFDZLHR-UHFFFAOYSA-N 1 2 224.304 2.406 20 0 BEADLO C[C@H]1C[C@H]1C(=O)OCc1[nH]c[nH+]c1C(C)(C)C ZINC000822323462 587162421 /nfs/dbraw/zinc/16/24/21/587162421.db2.gz JAXBFWXXJSJSIA-DTWKUNHWSA-N 1 2 236.315 2.406 20 0 BEADLO C[C@H]1CCC[N@H+](CCF)[C@@H]1C(=O)OC(C)(C)C ZINC000823509653 587228587 /nfs/dbraw/zinc/22/85/87/587228587.db2.gz PTDOZFWQFSTHBB-QWRGUYRKSA-N 1 2 245.338 2.398 20 0 BEADLO C[C@H]1CCC[N@@H+](CCF)[C@@H]1C(=O)OC(C)(C)C ZINC000823509653 587228589 /nfs/dbraw/zinc/22/85/89/587228589.db2.gz PTDOZFWQFSTHBB-QWRGUYRKSA-N 1 2 245.338 2.398 20 0 BEADLO Cc1nonc1C[NH2+]Cc1cccc(C)c1F ZINC000824389589 587268445 /nfs/dbraw/zinc/26/84/45/587268445.db2.gz NUXFHGVGIYBJAU-UHFFFAOYSA-N 1 2 235.262 2.115 20 0 BEADLO Fc1cccc(F)c1CN[C@@H]1CCn2cc[nH+]c21 ZINC000824522139 587273282 /nfs/dbraw/zinc/27/32/82/587273282.db2.gz QXNXPTRGLZKUEF-GFCCVEGCSA-N 1 2 249.264 2.396 20 0 BEADLO Clc1ncccc1C[NH+]1CC2(CC2)C1 ZINC000824533552 587273840 /nfs/dbraw/zinc/27/38/40/587273840.db2.gz HQBMLXNPACKAES-UHFFFAOYSA-N 1 2 208.692 2.331 20 0 BEADLO CCc1ccc(C[NH2+][C@@H]2CCn3ccnc32)o1 ZINC000824527557 587273887 /nfs/dbraw/zinc/27/38/87/587273887.db2.gz WGKVFWRVBCIMKV-GFCCVEGCSA-N 1 2 231.299 2.273 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)[C@H]1CC[C@@H]2C[C@@H]2CC1 ZINC000824629515 587280159 /nfs/dbraw/zinc/28/01/59/587280159.db2.gz UZTAWCDQGUXVQQ-ZSBIGDGJSA-N 1 2 247.342 2.194 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)[C@H]1CC[C@@H]2C[C@@H]2CC1 ZINC000824629515 587280161 /nfs/dbraw/zinc/28/01/61/587280161.db2.gz UZTAWCDQGUXVQQ-ZSBIGDGJSA-N 1 2 247.342 2.194 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)C[C@@H]1CC=CCC1 ZINC000824628533 587280357 /nfs/dbraw/zinc/28/03/57/587280357.db2.gz HDQJLQNYPMUFAJ-LLVKDONJSA-N 1 2 233.315 2.115 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)C[C@@H]1CC=CCC1 ZINC000824628533 587280358 /nfs/dbraw/zinc/28/03/58/587280358.db2.gz HDQJLQNYPMUFAJ-LLVKDONJSA-N 1 2 233.315 2.115 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2ccc(F)c(F)c2F)C1 ZINC000824829300 587289558 /nfs/dbraw/zinc/28/95/58/587289558.db2.gz JDOQGTZUUBYWJE-SECBINFHSA-N 1 2 245.244 2.325 20 0 BEADLO CC[C@@H](C)C[NH2+]c1ccc(O[C@@H]2CC(=O)N2)cc1 ZINC000824998814 587297565 /nfs/dbraw/zinc/29/75/65/587297565.db2.gz CWVADDHGWPAAED-QMTHXVAHSA-N 1 2 248.326 2.369 20 0 BEADLO CC(C)(C)C[NH2+]c1ccc(O[C@@H]2CC(=O)N2)cc1 ZINC000824999021 587298314 /nfs/dbraw/zinc/29/83/14/587298314.db2.gz GHFOCGJXFOKLNT-CYBMUJFWSA-N 1 2 248.326 2.369 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cnn(C)n2)cc1C ZINC000825299075 587313306 /nfs/dbraw/zinc/31/33/06/587313306.db2.gz AVRGRGKXIKFBJH-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cnn(C)n2)cc1C ZINC000825299075 587313308 /nfs/dbraw/zinc/31/33/08/587313308.db2.gz AVRGRGKXIKFBJH-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO CC(C)(CNC(=O)C1(C)CC=CC1)n1cc[nH+]c1 ZINC000825531188 587323839 /nfs/dbraw/zinc/32/38/39/587323839.db2.gz IMWIJFUZMGKSSO-UHFFFAOYSA-N 1 2 247.342 2.091 20 0 BEADLO CCN(C(=O)Cc1[nH]cc[nH+]1)[C@@H]1CCCC[C@H]1C ZINC000825607798 587327300 /nfs/dbraw/zinc/32/73/00/587327300.db2.gz PMFNVBSDLHNHSP-VXGBXAGGSA-N 1 2 249.358 2.379 20 0 BEADLO CCc1c[nH]c(CC(=O)NCCCCC2CC2)[nH+]1 ZINC000825661207 587329397 /nfs/dbraw/zinc/32/93/97/587329397.db2.gz BJQHTCIRBCLURR-UHFFFAOYSA-N 1 2 249.358 2.211 20 0 BEADLO Cn1c[nH+]cc1CCC(=O)NCCCCC1CC1 ZINC000825669692 587330534 /nfs/dbraw/zinc/33/05/34/587330534.db2.gz FRIBWFWBINTZLH-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO CC(C)[C@@H]1CCCC[C@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000826043941 587349312 /nfs/dbraw/zinc/34/93/12/587349312.db2.gz WMOJLSPLCPFXTK-NWDGAFQWSA-N 1 2 249.358 2.283 20 0 BEADLO CC12CC(C1)CN2C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000826783741 587362367 /nfs/dbraw/zinc/36/23/67/587362367.db2.gz NZDBXROFWOCWHP-UHFFFAOYSA-N 1 2 241.294 2.187 20 0 BEADLO Cc1cc(C[NH2+][C@@H]2C[C@H](O)c3ccccc32)no1 ZINC000827170354 587371791 /nfs/dbraw/zinc/37/17/91/587371791.db2.gz IDFSGBFELRIGSA-KGLIPLIRSA-N 1 2 244.294 2.251 20 0 BEADLO Cc1c[nH]c(CNC(=O)[C@H]2CC[C@@H]3C[C@@H]3CC2)[nH+]1 ZINC000827582656 587390194 /nfs/dbraw/zinc/39/01/94/587390194.db2.gz STNBYRHUCZFCTC-ZSBIGDGJSA-N 1 2 247.342 2.161 20 0 BEADLO CC/C(C)=C/C(=O)N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000827722060 587399526 /nfs/dbraw/zinc/39/95/26/587399526.db2.gz XWIVTVYCHQKWJI-LMMOQWNQSA-N 1 2 247.342 2.092 20 0 BEADLO C[C@@H]1CCCC[C@H]1CCNC(=O)Cc1[nH]cc[nH+]1 ZINC000827787843 587402632 /nfs/dbraw/zinc/40/26/32/587402632.db2.gz PXPJUELKPWAOBX-NEPJUHHUSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H]1CCCC[C@@H]1CCNC(=O)Cc1[nH]cc[nH+]1 ZINC000827787844 587402777 /nfs/dbraw/zinc/40/27/77/587402777.db2.gz PXPJUELKPWAOBX-NWDGAFQWSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1CCC[C@@H](CCNC(=O)Cc2[nH]cc[nH+]2)C1 ZINC000827955181 587413138 /nfs/dbraw/zinc/41/31/38/587413138.db2.gz AQIYLESMAIMBKN-NEPJUHHUSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H](CC1CCC1)NC(=O)/C=C\c1cn(C)c[nH+]1 ZINC000828271488 587429772 /nfs/dbraw/zinc/42/97/72/587429772.db2.gz ZODULWHRXUOGRL-ZADCQDASSA-N 1 2 247.342 2.128 20 0 BEADLO CC(C)=CC[N@@H+]1CCc2cc(Cl)nnc2C1 ZINC000829125940 587483796 /nfs/dbraw/zinc/48/37/96/587483796.db2.gz UHBHLJUBGJSPED-UHFFFAOYSA-N 1 2 237.734 2.454 20 0 BEADLO CC(C)=CC[N@H+]1CCc2cc(Cl)nnc2C1 ZINC000829125940 587483798 /nfs/dbraw/zinc/48/37/98/587483798.db2.gz UHBHLJUBGJSPED-UHFFFAOYSA-N 1 2 237.734 2.454 20 0 BEADLO C[C@H]1CC(C)(C)CC[C@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000829663330 587508416 /nfs/dbraw/zinc/50/84/16/587508416.db2.gz FEMNWRARRDFAKH-WDEREUQCSA-N 1 2 249.358 2.283 20 0 BEADLO CN(C(=O)Cc1[nH]cc[nH+]1)C1CCC(C)(C)CC1 ZINC000829934225 587528668 /nfs/dbraw/zinc/52/86/68/587528668.db2.gz HUZGULARIRZMNT-UHFFFAOYSA-N 1 2 249.358 2.379 20 0 BEADLO CCCC[C@@H](NC(=O)Cc1[nH]cc[nH+]1)C1CCC1 ZINC000829982644 587530810 /nfs/dbraw/zinc/53/08/10/587530810.db2.gz SYEUQFLZLXWYCS-GFCCVEGCSA-N 1 2 249.358 2.427 20 0 BEADLO CCCCC[C@@H](C)NC(=O)C[N@@H+]1CC[C@@H](F)C1 ZINC000830461610 587551702 /nfs/dbraw/zinc/55/17/02/587551702.db2.gz BKISOUOKWAMZMT-VXGBXAGGSA-N 1 2 244.354 2.115 20 0 BEADLO CCCCC[C@@H](C)NC(=O)C[N@H+]1CC[C@@H](F)C1 ZINC000830461610 587551704 /nfs/dbraw/zinc/55/17/04/587551704.db2.gz BKISOUOKWAMZMT-VXGBXAGGSA-N 1 2 244.354 2.115 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2cccc3nsnc32)C1 ZINC000830474726 587553369 /nfs/dbraw/zinc/55/33/69/587553369.db2.gz PXEXUKPNGBCBJS-SECBINFHSA-N 1 2 237.303 2.235 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2cccc3nsnc32)C1 ZINC000830474726 587553371 /nfs/dbraw/zinc/55/33/71/587553371.db2.gz PXEXUKPNGBCBJS-SECBINFHSA-N 1 2 237.303 2.235 20 0 BEADLO CCC[C@@H](C)[C@H]1CCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC000830498832 587554500 /nfs/dbraw/zinc/55/45/00/587554500.db2.gz RBCOJDQICCRSLV-VXGBXAGGSA-N 1 2 249.358 2.379 20 0 BEADLO Nc1cc(COC(=O)C2CC3(CCC3)C2)cc[nH+]1 ZINC000830626312 587561317 /nfs/dbraw/zinc/56/13/17/587561317.db2.gz STJUEHGYZJHJFF-UHFFFAOYSA-N 1 2 246.310 2.287 20 0 BEADLO C[C@H]1C[N@H+](CCF)C2(CCCC2)CN1CCF ZINC000830924200 587577560 /nfs/dbraw/zinc/57/75/60/587577560.db2.gz URAMZSRRDFSCAV-LBPRGKRZSA-N 1 2 246.345 2.244 20 0 BEADLO C[C@H]1C[N@@H+](CCF)C2(CCCC2)CN1CCF ZINC000830924200 587577561 /nfs/dbraw/zinc/57/75/61/587577561.db2.gz URAMZSRRDFSCAV-LBPRGKRZSA-N 1 2 246.345 2.244 20 0 BEADLO O=C(OC1CCC1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000831068646 587584695 /nfs/dbraw/zinc/58/46/95/587584695.db2.gz BDGMMTBFULIJBR-JTQLQIEISA-N 1 2 235.287 2.236 20 0 BEADLO O=C(OC1CCC1)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000831068647 587584833 /nfs/dbraw/zinc/58/48/33/587584833.db2.gz BDGMMTBFULIJBR-SNVBAGLBSA-N 1 2 235.287 2.236 20 0 BEADLO O[C@]1(C(F)F)CC[N@H+](C/C(Cl)=C\Cl)C1 ZINC000831176033 587589673 /nfs/dbraw/zinc/58/96/73/587589673.db2.gz RKVJWBCLTUQYID-GWSCVKMXSA-N 1 2 246.084 2.007 20 0 BEADLO O[C@]1(C(F)F)CC[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000831176033 587589675 /nfs/dbraw/zinc/58/96/75/587589675.db2.gz RKVJWBCLTUQYID-GWSCVKMXSA-N 1 2 246.084 2.007 20 0 BEADLO O[C@H](C[N@@H+]1CC[C@H](F)C1)c1cc(F)ccc1F ZINC000831187471 587590429 /nfs/dbraw/zinc/59/04/29/587590429.db2.gz GHGSVTYGTZUMBA-JOYOIKCWSA-N 1 2 245.244 2.042 20 0 BEADLO O[C@H](C[N@H+]1CC[C@H](F)C1)c1cc(F)ccc1F ZINC000831187471 587590431 /nfs/dbraw/zinc/59/04/31/587590431.db2.gz GHGSVTYGTZUMBA-JOYOIKCWSA-N 1 2 245.244 2.042 20 0 BEADLO O[C@H](C[N@@H+]1CC[C@@H](F)C1)c1cc(F)ccc1F ZINC000831215928 587592269 /nfs/dbraw/zinc/59/22/69/587592269.db2.gz GHGSVTYGTZUMBA-BXKDBHETSA-N 1 2 245.244 2.042 20 0 BEADLO O[C@H](C[N@H+]1CC[C@@H](F)C1)c1cc(F)ccc1F ZINC000831215928 587592270 /nfs/dbraw/zinc/59/22/70/587592270.db2.gz GHGSVTYGTZUMBA-BXKDBHETSA-N 1 2 245.244 2.042 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NCCC1CC=CC1 ZINC000831422909 587605427 /nfs/dbraw/zinc/60/54/27/587605427.db2.gz KIMCQYDVSJBTBI-NSHDSACASA-N 1 2 247.342 2.061 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NCCC1CC=CC1 ZINC000831422909 587605429 /nfs/dbraw/zinc/60/54/29/587605429.db2.gz KIMCQYDVSJBTBI-NSHDSACASA-N 1 2 247.342 2.061 20 0 BEADLO CO[C@@H]1CC[N@H+](CC(F)(F)C(F)F)C[C@H]1C ZINC000831528337 587616666 /nfs/dbraw/zinc/61/66/66/587616666.db2.gz NTLYEALVAGHAIA-HTQZYQBOSA-N 1 2 243.244 2.244 20 0 BEADLO CO[C@@H]1CC[N@@H+](CC(F)(F)C(F)F)C[C@H]1C ZINC000831528337 587616667 /nfs/dbraw/zinc/61/66/67/587616667.db2.gz NTLYEALVAGHAIA-HTQZYQBOSA-N 1 2 243.244 2.244 20 0 BEADLO CCC[C@H]1CCCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC000832147550 587646668 /nfs/dbraw/zinc/64/66/68/587646668.db2.gz JKBKYBULVKVHDT-NSHDSACASA-N 1 2 235.331 2.133 20 0 BEADLO Cc1csc(C(=O)N[C@@H]2CCn3cc[nH+]c32)c1 ZINC000833271336 587704100 /nfs/dbraw/zinc/70/41/00/587704100.db2.gz GTVRWABKQQZRNP-SECBINFHSA-N 1 2 247.323 2.128 20 0 BEADLO CC1(C)CCC[C@@H]1C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833279312 587704132 /nfs/dbraw/zinc/70/41/32/587704132.db2.gz YRXNIHVOAGZHCW-MNOVXSKESA-N 1 2 247.342 2.270 20 0 BEADLO CC(C)CCCC(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833272531 587704219 /nfs/dbraw/zinc/70/42/19/587704219.db2.gz OVEORIMFBKIZDP-LLVKDONJSA-N 1 2 235.331 2.270 20 0 BEADLO C[C@@H]1CC/C(=C\C(=O)N[C@@H]2CCn3cc[nH+]c32)C1 ZINC000833283318 587704535 /nfs/dbraw/zinc/70/45/35/587704535.db2.gz BGOFWBCFCXZKEZ-LNOKQREWSA-N 1 2 245.326 2.191 20 0 BEADLO C/C(=C\C(=O)N[C@@H]1CCn2cc[nH+]c21)C(C)(C)C ZINC000833286666 587704566 /nfs/dbraw/zinc/70/45/66/587704566.db2.gz ZGBJODURZRSTSG-PBQZMEPESA-N 1 2 247.342 2.437 20 0 BEADLO C[C@@H]1CCC[C@H](C(=O)N[C@@H]2CCn3cc[nH+]c32)C1 ZINC000833292640 587704696 /nfs/dbraw/zinc/70/46/96/587704696.db2.gz JNGASRSSHGJICE-GRYCIOLGSA-N 1 2 247.342 2.270 20 0 BEADLO C[C@@H]1CC[C@@H](CC(=O)N[C@@H]2CCn3cc[nH+]c32)C1 ZINC000833283220 587704883 /nfs/dbraw/zinc/70/48/83/587704883.db2.gz ASOXLRSIBUSKEP-IJLUTSLNSA-N 1 2 247.342 2.270 20 0 BEADLO C[C@@H]1CCC[C@@H](C(=O)N[C@H]2CCn3cc[nH+]c32)C1 ZINC000833292642 587704887 /nfs/dbraw/zinc/70/48/87/587704887.db2.gz JNGASRSSHGJICE-UTUOFQBUSA-N 1 2 247.342 2.270 20 0 BEADLO Cc1cscc1C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833284322 587704891 /nfs/dbraw/zinc/70/48/91/587704891.db2.gz HVSBPCMXOIZXKD-JTQLQIEISA-N 1 2 247.323 2.128 20 0 BEADLO O=C(N[C@H]1CCn2cc[nH+]c21)C1CCCCC1 ZINC000833305800 587705305 /nfs/dbraw/zinc/70/53/05/587705305.db2.gz XQPKKRMJLFOWTG-NSHDSACASA-N 1 2 233.315 2.024 20 0 BEADLO CCC[C@H](C)CC(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833293370 587705336 /nfs/dbraw/zinc/70/53/36/587705336.db2.gz XIJZAFQQPBMWEC-WDEREUQCSA-N 1 2 235.331 2.270 20 0 BEADLO O=C(N[C@@H]1CCn2cc[nH+]c21)C1CCCCC1 ZINC000833305799 587705533 /nfs/dbraw/zinc/70/55/33/587705533.db2.gz XQPKKRMJLFOWTG-LLVKDONJSA-N 1 2 233.315 2.024 20 0 BEADLO O=C(CCn1cc[nH+]c1)NCCC[C@@H]1C=CCC1 ZINC000834334208 587752340 /nfs/dbraw/zinc/75/23/40/587752340.db2.gz JIPAZSKCBVLJJP-CYBMUJFWSA-N 1 2 247.342 2.136 20 0 BEADLO Cn1ncc2c1nc[nH+]c2SCc1ccco1 ZINC000834878032 587769050 /nfs/dbraw/zinc/76/90/50/587769050.db2.gz PKZQSKLNFVGBGT-UHFFFAOYSA-N 1 2 246.295 2.249 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@]1(C)CC=CCC1 ZINC000835196342 587788432 /nfs/dbraw/zinc/78/84/32/587788432.db2.gz XMVNLHKMJRUGKG-CYBMUJFWSA-N 1 2 234.299 2.210 20 0 BEADLO C[C@@H]1CC=C(C(=O)OCc2c[nH+]cn2C)CC1 ZINC000835195953 587788602 /nfs/dbraw/zinc/78/86/02/587788602.db2.gz VCQRODCRDLNTEO-SNVBAGLBSA-N 1 2 234.299 2.210 20 0 BEADLO CC[C@H](CC(C)C)C(=O)OCCn1cc[nH+]c1 ZINC000835348847 587797838 /nfs/dbraw/zinc/79/78/38/587797838.db2.gz CZKLMSUSCRKCKE-GFCCVEGCSA-N 1 2 238.331 2.499 20 0 BEADLO CC[C@@H](CC(C)C)C(=O)OCCn1cc[nH+]c1 ZINC000835348848 587797863 /nfs/dbraw/zinc/79/78/63/587797863.db2.gz CZKLMSUSCRKCKE-LBPRGKRZSA-N 1 2 238.331 2.499 20 0 BEADLO CC/C(C)=C\C(=O)OCc1c[nH+]ccc1OC ZINC000835442498 587802239 /nfs/dbraw/zinc/80/22/39/587802239.db2.gz UJKYUKPLCJTENN-YFHOEESVSA-N 1 2 235.283 2.490 20 0 BEADLO CC/C(C)=C/C(=O)OCc1c[nH+]ccc1OC ZINC000835442494 587802285 /nfs/dbraw/zinc/80/22/85/587802285.db2.gz UJKYUKPLCJTENN-JXMROGBWSA-N 1 2 235.283 2.490 20 0 BEADLO CCC(C)(C)c1noc(Cn2cc[nH+]c2)n1 ZINC000867172306 587829994 /nfs/dbraw/zinc/82/99/94/587829994.db2.gz XJVCWEMKLDXQFS-UHFFFAOYSA-N 1 2 220.276 2.002 20 0 BEADLO CCC(C)(C)c1noc(Cc2c[nH+]cn2C)n1 ZINC000867172109 587829999 /nfs/dbraw/zinc/82/99/99/587829999.db2.gz VHMODDSRCIKORM-UHFFFAOYSA-N 1 2 234.303 2.082 20 0 BEADLO C/C=C(\C)C(=O)Nc1nc(C[NH+](C)C)cs1 ZINC000837264349 587862433 /nfs/dbraw/zinc/86/24/33/587862433.db2.gz XDFJLNXEHDVQLF-VMPITWQZSA-N 1 2 239.344 2.109 20 0 BEADLO COc1ccc([NH2+]C[C@H]2CCCOC2)cc1N ZINC000841039869 587938562 /nfs/dbraw/zinc/93/85/62/587938562.db2.gz DPDFPHFVFDQBKS-SNVBAGLBSA-N 1 2 236.315 2.116 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1cc(C)nn1C ZINC000841837681 587976790 /nfs/dbraw/zinc/97/67/90/587976790.db2.gz ICQUQXVCDYIZBW-UHFFFAOYSA-N 1 2 233.315 2.344 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1cc(C)nn1C ZINC000841837681 587976791 /nfs/dbraw/zinc/97/67/91/587976791.db2.gz ICQUQXVCDYIZBW-UHFFFAOYSA-N 1 2 233.315 2.344 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OCCC1=CCCCC1 ZINC000842037393 587991853 /nfs/dbraw/zinc/99/18/53/587991853.db2.gz YUZDZFXVBGATBK-JTQLQIEISA-N 1 2 226.320 2.410 20 0 BEADLO NC(=[NH+]OC[C@H]1CCC(F)(F)C1)[C@@H]1CCCO1 ZINC000842046279 587992611 /nfs/dbraw/zinc/99/26/11/587992611.db2.gz BBCQNNCBMNNPGY-IUCAKERBSA-N 1 2 248.273 2.099 20 0 BEADLO C[N@H+](CCC(C)(C)C)Cn1ccsc1=O ZINC000842630349 588046860 /nfs/dbraw/zinc/04/68/60/588046860.db2.gz BOTNKDWMUHFYSZ-UHFFFAOYSA-N 1 2 228.361 2.235 20 0 BEADLO C[N@@H+](CCC(C)(C)C)Cn1ccsc1=O ZINC000842630349 588046862 /nfs/dbraw/zinc/04/68/62/588046862.db2.gz BOTNKDWMUHFYSZ-UHFFFAOYSA-N 1 2 228.361 2.235 20 0 BEADLO Cn1c[nH+]cc1COC(=O)/C=C\C1CCCC1 ZINC000842725891 588056099 /nfs/dbraw/zinc/05/60/99/588056099.db2.gz OCFXAHXIKSNEKO-SREVYHEPSA-N 1 2 234.299 2.210 20 0 BEADLO CC[NH2+]Cc1noc(C[C@H](CC)C(C)C)n1 ZINC000843144901 588083937 /nfs/dbraw/zinc/08/39/37/588083937.db2.gz NPVPOKYYLKVOSP-JTQLQIEISA-N 1 2 225.336 2.404 20 0 BEADLO CC[NH2+]Cc1noc(COc2ccccc2C)n1 ZINC000843145917 588087082 /nfs/dbraw/zinc/08/70/82/588087082.db2.gz VMIONZUUBLUHBQ-UHFFFAOYSA-N 1 2 247.298 2.067 20 0 BEADLO Cc1[nH+]c2cc(NC(=O)C3(F)CC3)ccc2n1C ZINC000843558420 588123273 /nfs/dbraw/zinc/12/32/73/588123273.db2.gz LFWSHSKGJGLUBJ-UHFFFAOYSA-N 1 2 247.273 2.322 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)C1(F)CC1 ZINC000843592218 588127572 /nfs/dbraw/zinc/12/75/72/588127572.db2.gz KQUKBCLLPPBGIS-UHFFFAOYSA-N 1 2 208.236 2.139 20 0 BEADLO CC(C)c1ocnc1C(=O)Nc1ccc(N)[nH+]c1 ZINC000844163928 588171702 /nfs/dbraw/zinc/17/17/02/588171702.db2.gz PKIUVCZTMOCBOA-UHFFFAOYSA-N 1 2 246.270 2.028 20 0 BEADLO CC[C@@H]1C[N@H+](C/C=C\Cl)[C@@H](C)CO1 ZINC000844390472 588189070 /nfs/dbraw/zinc/18/90/70/588189070.db2.gz XOZPSIWHBRHXFT-YVDHIRPGSA-N 1 2 203.713 2.238 20 0 BEADLO CC[C@@H]1C[N@@H+](C/C=C\Cl)[C@@H](C)CO1 ZINC000844390472 588189072 /nfs/dbraw/zinc/18/90/72/588189072.db2.gz XOZPSIWHBRHXFT-YVDHIRPGSA-N 1 2 203.713 2.238 20 0 BEADLO COC/C(C)=C\C(=O)Nc1ccc(C)[nH+]c1C ZINC000844421615 588191954 /nfs/dbraw/zinc/19/19/54/588191954.db2.gz GPFSMIZOCWUZFV-CLFYSBASSA-N 1 2 234.299 2.230 20 0 BEADLO C[C@@H](CCO)[N@H+](C)C/C(Cl)=C/Cl ZINC000844453050 588196054 /nfs/dbraw/zinc/19/60/54/588196054.db2.gz YTNBNUPZEVOSMY-BJMRUTCWSA-N 1 2 212.120 2.008 20 0 BEADLO C[C@@H](CCO)[N@@H+](C)C/C(Cl)=C/Cl ZINC000844453050 588196056 /nfs/dbraw/zinc/19/60/56/588196056.db2.gz YTNBNUPZEVOSMY-BJMRUTCWSA-N 1 2 212.120 2.008 20 0 BEADLO COCc1cc[nH+]c(NCc2ccoc2)c1 ZINC000844709420 588214891 /nfs/dbraw/zinc/21/48/91/588214891.db2.gz YKNUPZWOPNEMQA-UHFFFAOYSA-N 1 2 218.256 2.433 20 0 BEADLO CC[C@@H](C)OC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000845283412 588225906 /nfs/dbraw/zinc/22/59/06/588225906.db2.gz WPUTVJHHTIAWQK-VHSXEESVSA-N 1 2 210.277 2.176 20 0 BEADLO O=C(OCCn1cc[nH+]c1)[C@@H]1C[C@H]1C1CCCC1 ZINC000845337784 588227080 /nfs/dbraw/zinc/22/70/80/588227080.db2.gz AFBLNWSOUNSFKR-QWHCGFSZSA-N 1 2 248.326 2.253 20 0 BEADLO Cc1occc1COC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000845470231 588229770 /nfs/dbraw/zinc/22/97/70/588229770.db2.gz RXJMZICAYJNIIQ-JTQLQIEISA-N 1 2 248.282 2.479 20 0 BEADLO CC(C)=CCOC(=O)Cc1cn2c([nH+]1)CCCC2 ZINC000845505845 588231137 /nfs/dbraw/zinc/23/11/37/588231137.db2.gz NKNMBCVOASRSSQ-UHFFFAOYSA-N 1 2 248.326 2.271 20 0 BEADLO C[C@@H](CC(=O)OCC(C)(C)F)n1cc[nH+]c1 ZINC000845524749 588231223 /nfs/dbraw/zinc/23/12/23/588231223.db2.gz BEJKCBHZSNMYKL-VIFPVBQESA-N 1 2 228.267 2.126 20 0 BEADLO C[C@H](CC(=O)O[C@H](C)C(F)F)n1cc[nH+]c1 ZINC000845526806 588232133 /nfs/dbraw/zinc/23/21/33/588232133.db2.gz MAYUOCOOTABYSK-HTQZYQBOSA-N 1 2 232.230 2.031 20 0 BEADLO CC1CC(OC(=O)Cc2cn3c([nH+]2)CCCC3)C1 ZINC000845575400 588233693 /nfs/dbraw/zinc/23/36/93/588233693.db2.gz VGAZTRMYYKQYEQ-UHFFFAOYSA-N 1 2 248.326 2.104 20 0 BEADLO C[C@H](CC(=O)OC1CC2(CC2)C1)n1cc[nH+]c1 ZINC000845586585 588234181 /nfs/dbraw/zinc/23/41/81/588234181.db2.gz WJJKEAGCHCULJP-SNVBAGLBSA-N 1 2 234.299 2.320 20 0 BEADLO C[C@H](CC(=O)OC[C@]1(C)C[C@H]1F)n1cc[nH+]c1 ZINC000845611850 588236182 /nfs/dbraw/zinc/23/61/82/588236182.db2.gz QOCKYPURTHQPPO-FOGDFJRCSA-N 1 2 240.278 2.126 20 0 BEADLO CCc1cccc(C[NH2+]Cc2nonc2C)c1 ZINC000845970182 588251994 /nfs/dbraw/zinc/25/19/94/588251994.db2.gz LGBUITUSBJOEAP-UHFFFAOYSA-N 1 2 231.299 2.230 20 0 BEADLO CCONC(=O)C[NH2+][C@H](C)CCC1CCCC1 ZINC000846090510 588256369 /nfs/dbraw/zinc/25/63/69/588256369.db2.gz BPGWBGBRZUOGSA-LLVKDONJSA-N 1 2 242.363 2.003 20 0 BEADLO COCc1cc[nH+]c(NC[C@H]2CCCOC2)c1 ZINC000846117535 588257728 /nfs/dbraw/zinc/25/77/28/588257728.db2.gz OUJRKCJSHGXAOO-GFCCVEGCSA-N 1 2 236.315 2.067 20 0 BEADLO C[C@@H](O)c1ncc(C[N@@H+]2CCC[C@@H](F)C2)s1 ZINC000846120530 588258057 /nfs/dbraw/zinc/25/80/57/588258057.db2.gz RHDGWAYFIWAHTA-RKDXNWHRSA-N 1 2 244.335 2.130 20 0 BEADLO C[C@@H](O)c1ncc(C[N@H+]2CCC[C@@H](F)C2)s1 ZINC000846120530 588258058 /nfs/dbraw/zinc/25/80/58/588258058.db2.gz RHDGWAYFIWAHTA-RKDXNWHRSA-N 1 2 244.335 2.130 20 0 BEADLO C[C@H](O)c1ncc(C[N@@H+]2CCC[C@@H](F)C2)s1 ZINC000846120528 588258068 /nfs/dbraw/zinc/25/80/68/588258068.db2.gz RHDGWAYFIWAHTA-DTWKUNHWSA-N 1 2 244.335 2.130 20 0 BEADLO C[C@H](O)c1ncc(C[N@H+]2CCC[C@@H](F)C2)s1 ZINC000846120528 588258069 /nfs/dbraw/zinc/25/80/69/588258069.db2.gz RHDGWAYFIWAHTA-DTWKUNHWSA-N 1 2 244.335 2.130 20 0 BEADLO C[C@H](COCC1CC1)[NH2+][C@@H]1CCCc2[nH]ncc21 ZINC000846204125 588260211 /nfs/dbraw/zinc/26/02/11/588260211.db2.gz DQEAKWBAIGAXEO-ZWNOBZJWSA-N 1 2 249.358 2.192 20 0 BEADLO COCc1cc[nH+]c(N[C@H](C)c2ncc[nH]2)c1 ZINC000846211374 588260284 /nfs/dbraw/zinc/26/02/84/588260284.db2.gz DSXPIWCHHXIDGV-SECBINFHSA-N 1 2 232.287 2.124 20 0 BEADLO CC[C@H](C)N(OC)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000846637639 588280400 /nfs/dbraw/zinc/28/04/00/588280400.db2.gz CYZAIVAHZKYRRQ-QWRGUYRKSA-N 1 2 239.319 2.023 20 0 BEADLO C[C@@H]1Cc2cc(NCc3c[nH+]cn3C)ccc2O1 ZINC000846749498 588284765 /nfs/dbraw/zinc/28/47/65/588284765.db2.gz BTSQKSJFBWWFTP-SNVBAGLBSA-N 1 2 243.310 2.356 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@@H+]1CC1(Br)CC1 ZINC000846766475 588286671 /nfs/dbraw/zinc/28/66/71/588286671.db2.gz SPWSDWSSLSOATQ-BDAKNGLRSA-N 1 2 248.164 2.023 20 0 BEADLO C[C@H]1C[N@H+](CC2(Br)CC2)[C@@H](C)CO1 ZINC000846766477 588286770 /nfs/dbraw/zinc/28/67/70/588286770.db2.gz SPWSDWSSLSOATQ-IUCAKERBSA-N 1 2 248.164 2.023 20 0 BEADLO C[C@H]1C[N@@H+](CC2(Br)CC2)[C@@H](C)CO1 ZINC000846766477 588286771 /nfs/dbraw/zinc/28/67/71/588286771.db2.gz SPWSDWSSLSOATQ-IUCAKERBSA-N 1 2 248.164 2.023 20 0 BEADLO C[C@@H](C1CC1)[N@H+](Cc1cnsn1)C1CC1 ZINC000846773790 588287295 /nfs/dbraw/zinc/28/72/95/588287295.db2.gz KSNWSMCNFDQJDN-QMMMGPOBSA-N 1 2 223.345 2.301 20 0 BEADLO C[C@@H](C1CC1)[N@@H+](Cc1cnsn1)C1CC1 ZINC000846773790 588287296 /nfs/dbraw/zinc/28/72/96/588287296.db2.gz KSNWSMCNFDQJDN-QMMMGPOBSA-N 1 2 223.345 2.301 20 0 BEADLO CC(C)C[C@H]1CC[N@H+](Cc2cnsn2)C1 ZINC000846807997 588290166 /nfs/dbraw/zinc/29/01/66/588290166.db2.gz OIQYLYYMUVDYEN-SNVBAGLBSA-N 1 2 225.361 2.406 20 0 BEADLO CC(C)C[C@H]1CC[N@@H+](Cc2cnsn2)C1 ZINC000846807997 588290167 /nfs/dbraw/zinc/29/01/67/588290167.db2.gz OIQYLYYMUVDYEN-SNVBAGLBSA-N 1 2 225.361 2.406 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1CC1(Br)CC1 ZINC000846808687 588290187 /nfs/dbraw/zinc/29/01/87/588290187.db2.gz LMFGOPPGVPLCNE-SECBINFHSA-N 1 2 248.164 2.025 20 0 BEADLO CC[C@@H]1COCC[N@H+]1CC1(Br)CC1 ZINC000846808687 588290188 /nfs/dbraw/zinc/29/01/88/588290188.db2.gz LMFGOPPGVPLCNE-SECBINFHSA-N 1 2 248.164 2.025 20 0 BEADLO c1nsnc1C[NH2+][C@@H](c1cccnc1)C1CC1 ZINC000846848325 588292911 /nfs/dbraw/zinc/29/29/11/588292911.db2.gz BJUQLILDDUDFBX-GFCCVEGCSA-N 1 2 246.339 2.174 20 0 BEADLO C[N@@H+](Cc1cnsn1)C[C@H]1CC=CCC1 ZINC000846852075 588293464 /nfs/dbraw/zinc/29/34/64/588293464.db2.gz VZKNLPQBPRPRJP-JTQLQIEISA-N 1 2 223.345 2.326 20 0 BEADLO C[N@H+](Cc1cnsn1)C[C@H]1CC=CCC1 ZINC000846852075 588293465 /nfs/dbraw/zinc/29/34/65/588293465.db2.gz VZKNLPQBPRPRJP-JTQLQIEISA-N 1 2 223.345 2.326 20 0 BEADLO CSC[C@@H]1CCC[N@H+](Cc2cnsn2)C1 ZINC000846918899 588296721 /nfs/dbraw/zinc/29/67/21/588296721.db2.gz NGIBUGHWGPHPOI-SECBINFHSA-N 1 2 243.401 2.113 20 0 BEADLO CSC[C@@H]1CCC[N@@H+](Cc2cnsn2)C1 ZINC000846918899 588296722 /nfs/dbraw/zinc/29/67/22/588296722.db2.gz NGIBUGHWGPHPOI-SECBINFHSA-N 1 2 243.401 2.113 20 0 BEADLO CC(=O)C1CC[NH+](Cc2ncc(C3CC3)o2)CC1 ZINC000846947085 588298053 /nfs/dbraw/zinc/29/80/53/588298053.db2.gz QQVJMLRFSNMAFM-UHFFFAOYSA-N 1 2 248.326 2.353 20 0 BEADLO CON1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000846973724 588299431 /nfs/dbraw/zinc/29/94/31/588299431.db2.gz CXGXEOKRKPAIAV-UHFFFAOYSA-N 1 2 240.734 2.019 20 0 BEADLO C[C@@H]1CCC[C@H](CNC(=O)Cc2[nH]cc[nH+]2)[C@@H]1C ZINC000846986353 588300166 /nfs/dbraw/zinc/30/01/66/588300166.db2.gz JXBUYNDYDGNGPX-IJLUTSLNSA-N 1 2 249.358 2.141 20 0 BEADLO CC(C)(CCO[NH+]=C(N)[C@@H]1CCCO1)C1CC1 ZINC000848511657 588388299 /nfs/dbraw/zinc/38/82/99/588388299.db2.gz AMQIBGKDJCLLGE-NSHDSACASA-N 1 2 240.347 2.490 20 0 BEADLO Fc1cccc(C[NH2+][C@@H]2CCCn3ccnc32)n1 ZINC000848534974 588394102 /nfs/dbraw/zinc/39/41/02/588394102.db2.gz BZERZINUKVIYCG-LLVKDONJSA-N 1 2 246.289 2.042 20 0 BEADLO COc1c(C)cccc1C[NH2+]Cc1cn(C)cn1 ZINC000848564373 588397704 /nfs/dbraw/zinc/39/77/04/588397704.db2.gz MAGZGLCXUORIBB-UHFFFAOYSA-N 1 2 245.326 2.027 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@@H]1CC[C@H](C)C1 ZINC000848686313 588405511 /nfs/dbraw/zinc/40/55/11/588405511.db2.gz BJJQEYQUQDHTFB-WCBMZHEXSA-N 1 2 221.304 2.394 20 0 BEADLO COc1c(C)[nH+]cnc1N1CCC(F)(F)CC1 ZINC000848694545 588406195 /nfs/dbraw/zinc/40/61/95/588406195.db2.gz VDVQHTJCDQFULW-UHFFFAOYSA-N 1 2 243.257 2.029 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)OCCCF)ccn12 ZINC000848781611 588413652 /nfs/dbraw/zinc/41/36/52/588413652.db2.gz MQTWJIQCIGYQME-UHFFFAOYSA-N 1 2 236.246 2.159 20 0 BEADLO CCCCCCn1cc(Cn2cc[nH+]c2)nn1 ZINC000849140830 588454534 /nfs/dbraw/zinc/45/45/34/588454534.db2.gz SVWMKRYVVYKZJG-UHFFFAOYSA-N 1 2 233.319 2.103 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+]CCc1ccc(C)c(C)c1 ZINC000849323369 588472431 /nfs/dbraw/zinc/47/24/31/588472431.db2.gz OZGSQFQQYQJADC-ZDUSSCGKSA-N 1 2 249.354 2.387 20 0 BEADLO COc1cncc(C[NH2+]C(C)(C)C(F)F)c1 ZINC000850281042 588534689 /nfs/dbraw/zinc/53/46/89/588534689.db2.gz CCUKUPNZIQTLSO-UHFFFAOYSA-N 1 2 230.258 2.224 20 0 BEADLO CC(C)(C)C(F)(F)C[NH2+]Cc1cncnc1 ZINC000850409558 588544147 /nfs/dbraw/zinc/54/41/47/588544147.db2.gz AXNNITCVRVBAPP-UHFFFAOYSA-N 1 2 229.274 2.248 20 0 BEADLO c1c[nH]c([C@H]([NH2+][C@H]2C=CCC2)c2cccnc2)n1 ZINC000850510898 588555214 /nfs/dbraw/zinc/55/52/14/588555214.db2.gz XEZOMNMLGSRNMU-QWHCGFSZSA-N 1 2 240.310 2.202 20 0 BEADLO C1=C[C@@H]([NH2+][C@@H](c2nnc[nH]2)c2ccccc2)CC1 ZINC000850510874 588555413 /nfs/dbraw/zinc/55/54/13/588555413.db2.gz XBZREBHILUJUPI-CHWSQXEVSA-N 1 2 240.310 2.202 20 0 BEADLO C1=C[C@H]([NH2+][C@H](c2nnc[nH]2)c2ccccc2)CC1 ZINC000850510878 588555563 /nfs/dbraw/zinc/55/55/63/588555563.db2.gz XBZREBHILUJUPI-STQMWFEESA-N 1 2 240.310 2.202 20 0 BEADLO CCCCC[C@@H](C)[NH2+]Cc1nnc(COC)[nH]1 ZINC000850513314 588556007 /nfs/dbraw/zinc/55/60/07/588556007.db2.gz FUDBCYNFAGQZJD-SNVBAGLBSA-N 1 2 240.351 2.010 20 0 BEADLO C[C@@H](CCO)[NH2+]CC(F)(F)c1ccc(F)cc1 ZINC000850562194 588560878 /nfs/dbraw/zinc/56/08/78/588560878.db2.gz UCLNVQPLMASCME-VIFPVBQESA-N 1 2 247.260 2.278 20 0 BEADLO c1csc([C@@H]2CCC[N@H+]2Cc2cnon2)c1 ZINC000851714353 588615984 /nfs/dbraw/zinc/61/59/84/588615984.db2.gz QBKVTNUSDJIVMM-JTQLQIEISA-N 1 2 235.312 2.468 20 0 BEADLO c1csc([C@@H]2CCC[N@@H+]2Cc2cnon2)c1 ZINC000851714353 588615985 /nfs/dbraw/zinc/61/59/85/588615985.db2.gz QBKVTNUSDJIVMM-JTQLQIEISA-N 1 2 235.312 2.468 20 0 BEADLO c1cc([C@@H]2CCC[N@H+]2Cc2cnon2)cs1 ZINC000851726750 588617975 /nfs/dbraw/zinc/61/79/75/588617975.db2.gz VOSPIKMQKWAQJZ-NSHDSACASA-N 1 2 235.312 2.468 20 0 BEADLO c1cc([C@@H]2CCC[N@@H+]2Cc2cnon2)cs1 ZINC000851726750 588617976 /nfs/dbraw/zinc/61/79/76/588617976.db2.gz VOSPIKMQKWAQJZ-NSHDSACASA-N 1 2 235.312 2.468 20 0 BEADLO C[C@@H](c1cccs1)[N@H+](C)Cc1cnon1 ZINC000851727978 588618673 /nfs/dbraw/zinc/61/86/73/588618673.db2.gz CLVQPDGZNPOFPW-QMMMGPOBSA-N 1 2 223.301 2.324 20 0 BEADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1cnon1 ZINC000851727978 588618674 /nfs/dbraw/zinc/61/86/74/588618674.db2.gz CLVQPDGZNPOFPW-QMMMGPOBSA-N 1 2 223.301 2.324 20 0 BEADLO ClC(Cl)=CC[N@@H+]1CCCOCC1 ZINC000851739527 588620870 /nfs/dbraw/zinc/62/08/70/588620870.db2.gz LFKHWRBZTYDJFD-UHFFFAOYSA-N 1 2 210.104 2.028 20 0 BEADLO ClC(Cl)=CC[N@H+]1CCCOCC1 ZINC000851739527 588620871 /nfs/dbraw/zinc/62/08/71/588620871.db2.gz LFKHWRBZTYDJFD-UHFFFAOYSA-N 1 2 210.104 2.028 20 0 BEADLO c1nonc1C[N@@H+]1CCCc2ccccc2C1 ZINC000851762205 588624460 /nfs/dbraw/zinc/62/44/60/588624460.db2.gz LPUSYPSXSARLPT-UHFFFAOYSA-N 1 2 229.283 2.018 20 0 BEADLO c1nonc1C[N@H+]1CCCc2ccccc2C1 ZINC000851762205 588624461 /nfs/dbraw/zinc/62/44/61/588624461.db2.gz LPUSYPSXSARLPT-UHFFFAOYSA-N 1 2 229.283 2.018 20 0 BEADLO C[N@H+](Cc1ncc[nH]1)C[C@]1(C)CC1(Cl)Cl ZINC000851873741 588638320 /nfs/dbraw/zinc/63/83/20/588638320.db2.gz LTFSYUJQSFTSCN-VIFPVBQESA-N 1 2 248.157 2.425 20 0 BEADLO C[N@@H+](Cc1ncc[nH]1)C[C@]1(C)CC1(Cl)Cl ZINC000851873741 588638321 /nfs/dbraw/zinc/63/83/21/588638321.db2.gz LTFSYUJQSFTSCN-VIFPVBQESA-N 1 2 248.157 2.425 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C[C@]1(C)CC1(Cl)Cl ZINC000851873741 588638322 /nfs/dbraw/zinc/63/83/22/588638322.db2.gz LTFSYUJQSFTSCN-VIFPVBQESA-N 1 2 248.157 2.425 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C[C@@H]1CC1(Cl)Cl ZINC000851875989 588638413 /nfs/dbraw/zinc/63/84/13/588638413.db2.gz SFNSUGDXFMMPEV-ZETCQYMHSA-N 1 2 234.130 2.035 20 0 BEADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1cnon1 ZINC000851878590 588638830 /nfs/dbraw/zinc/63/88/30/588638830.db2.gz OPLJGFVJVGHMMK-LBPRGKRZSA-N 1 2 232.287 2.048 20 0 BEADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1cnon1 ZINC000851878590 588638831 /nfs/dbraw/zinc/63/88/31/588638831.db2.gz OPLJGFVJVGHMMK-LBPRGKRZSA-N 1 2 232.287 2.048 20 0 BEADLO CC[C@@H]([NH2+]Cc1cnon1)c1ccccc1OC ZINC000851896508 588641712 /nfs/dbraw/zinc/64/17/12/588641712.db2.gz JMVHKWOBOQKQQE-GFCCVEGCSA-N 1 2 247.298 2.319 20 0 BEADLO Cc1noc([C@@H](C)[NH2+]CC=C(Cl)Cl)n1 ZINC000851927517 588644720 /nfs/dbraw/zinc/64/47/20/588644720.db2.gz AYOCFNFJQFEAJB-RXMQYKEDSA-N 1 2 236.102 2.348 20 0 BEADLO Cc1ccc(C)c(C[N@H+](C)Cc2cnon2)c1 ZINC000851985887 588651860 /nfs/dbraw/zinc/65/18/60/588651860.db2.gz VDCXGNHNJBKDPP-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ccc(C)c(C[N@@H+](C)Cc2cnon2)c1 ZINC000851985887 588651861 /nfs/dbraw/zinc/65/18/61/588651861.db2.gz VDCXGNHNJBKDPP-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO COc1cc(C[NH+]2CCC(F)(F)CC2)sn1 ZINC000852001278 588653989 /nfs/dbraw/zinc/65/39/89/588653989.db2.gz HJUYUQWJKHNUJO-UHFFFAOYSA-N 1 2 248.298 2.383 20 0 BEADLO CC(C)([NH2+]Cc1cnon1)c1ccccc1F ZINC000852077934 588660455 /nfs/dbraw/zinc/66/04/55/588660455.db2.gz HFZIVUWHSCSBAH-UHFFFAOYSA-N 1 2 235.262 2.234 20 0 BEADLO Cc1cccc([C@H](C)[NH2+]Cc2cnon2)c1 ZINC000852149171 588667585 /nfs/dbraw/zinc/66/75/85/588667585.db2.gz DONWEQQSHNZGLE-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cccc(F)n2)[C@@H](C)CO1 ZINC000852211418 588672690 /nfs/dbraw/zinc/67/26/90/588672690.db2.gz JZZSCWFKSMBECR-CMPLNLGQSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cccc(F)n2)[C@@H](C)CO1 ZINC000852211418 588672691 /nfs/dbraw/zinc/67/26/91/588672691.db2.gz JZZSCWFKSMBECR-CMPLNLGQSA-N 1 2 238.306 2.220 20 0 BEADLO CC1(C)OC[C@H](CC[N@@H+]2CCCC(F)(F)C2)O1 ZINC000852211146 588672793 /nfs/dbraw/zinc/67/27/93/588672793.db2.gz PYWGKRUTEQGRRK-JTQLQIEISA-N 1 2 249.301 2.259 20 0 BEADLO CC1(C)OC[C@H](CC[N@H+]2CCCC(F)(F)C2)O1 ZINC000852211146 588672794 /nfs/dbraw/zinc/67/27/94/588672794.db2.gz PYWGKRUTEQGRRK-JTQLQIEISA-N 1 2 249.301 2.259 20 0 BEADLO Cn1c(Cl)cnc1C[N@@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000852218952 588673607 /nfs/dbraw/zinc/67/36/07/588673607.db2.gz NZGRELWALVUTJR-UWVGGRQHSA-N 1 2 239.750 2.448 20 0 BEADLO Cn1c(Cl)cnc1C[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000852218952 588673608 /nfs/dbraw/zinc/67/36/08/588673608.db2.gz NZGRELWALVUTJR-UWVGGRQHSA-N 1 2 239.750 2.448 20 0 BEADLO Cc1cc(C)c(CNC(=O)N[C@H]2C=CCC2)c[nH+]1 ZINC000852374172 588680465 /nfs/dbraw/zinc/68/04/65/588680465.db2.gz KQTMNRBGPQXGKN-ZDUSSCGKSA-N 1 2 245.326 2.216 20 0 BEADLO COCC[N@H+](CCF)[C@H](C)c1cccnc1 ZINC000852484065 588685185 /nfs/dbraw/zinc/68/51/85/588685185.db2.gz VHZHYZSTLKIFHX-LLVKDONJSA-N 1 2 226.295 2.061 20 0 BEADLO COCC[N@@H+](CCF)[C@H](C)c1cccnc1 ZINC000852484065 588685186 /nfs/dbraw/zinc/68/51/86/588685186.db2.gz VHZHYZSTLKIFHX-LLVKDONJSA-N 1 2 226.295 2.061 20 0 BEADLO C[C@@H]1C[N@H+](C/C=C\Cl)C[C@](C)(C(F)F)O1 ZINC000852780999 588702433 /nfs/dbraw/zinc/70/24/33/588702433.db2.gz QLIZFYUTNJBSMQ-CCIFHCDCSA-N 1 2 239.693 2.483 20 0 BEADLO C[C@@H]1C[N@@H+](C/C=C\Cl)C[C@](C)(C(F)F)O1 ZINC000852780999 588702434 /nfs/dbraw/zinc/70/24/34/588702434.db2.gz QLIZFYUTNJBSMQ-CCIFHCDCSA-N 1 2 239.693 2.483 20 0 BEADLO Cn1c[nH+]cc1COC(=O)[C@H]1CCCC12CC2 ZINC000860576429 589107327 /nfs/dbraw/zinc/10/73/27/589107327.db2.gz TUWWCZTZGBIOQS-LLVKDONJSA-N 1 2 234.299 2.044 20 0 BEADLO CCC/C(C)=C/C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000861760090 589177205 /nfs/dbraw/zinc/17/72/05/589177205.db2.gz TYBLYCQHZYASQF-JXMROGBWSA-N 1 2 233.315 2.041 20 0 BEADLO CCC/C(C)=C/C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000861760090 589177207 /nfs/dbraw/zinc/17/72/07/589177207.db2.gz TYBLYCQHZYASQF-JXMROGBWSA-N 1 2 233.315 2.041 20 0 BEADLO Cc1noc(C)c1CN(C)Cc1[nH]c(C)c(C)[nH+]1 ZINC000862227012 589195605 /nfs/dbraw/zinc/19/56/05/589195605.db2.gz TUUFCWIMAMWWHM-UHFFFAOYSA-N 1 2 248.330 2.263 20 0 BEADLO Cc1c(C[N@H+]2C[C@H](C)OC[C@H]2C)ccnc1F ZINC000862223541 589195621 /nfs/dbraw/zinc/19/56/21/589195621.db2.gz QPSJPFAOIMGEAC-ZJUUUORDSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1c(C[N@@H+]2C[C@H](C)OC[C@H]2C)ccnc1F ZINC000862223541 589195622 /nfs/dbraw/zinc/19/56/22/589195622.db2.gz QPSJPFAOIMGEAC-ZJUUUORDSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1c(C[N@@H+]2CC[C@H](F)C2)ccnc1F ZINC000862383648 589206019 /nfs/dbraw/zinc/20/60/19/589206019.db2.gz WPJDIXAMMKFRBV-JTQLQIEISA-N 1 2 212.243 2.073 20 0 BEADLO Cc1c(C[N@H+]2CC[C@H](F)C2)ccnc1F ZINC000862383648 589206020 /nfs/dbraw/zinc/20/60/20/589206020.db2.gz WPJDIXAMMKFRBV-JTQLQIEISA-N 1 2 212.243 2.073 20 0 BEADLO c1nc(C2CC2)oc1C[NH+]1CC2(CC2)C1 ZINC000862381665 589206513 /nfs/dbraw/zinc/20/65/13/589206513.db2.gz HEJVMBWWQBHSEK-UHFFFAOYSA-N 1 2 204.273 2.148 20 0 BEADLO Fc1cc(C[N@H+]2CCC[C@@H](F)C2)ccn1 ZINC000862402242 589209257 /nfs/dbraw/zinc/20/92/57/589209257.db2.gz KHVLQIMFRLKJBT-SNVBAGLBSA-N 1 2 212.243 2.155 20 0 BEADLO Fc1cc(C[N@@H+]2CCC[C@@H](F)C2)ccn1 ZINC000862402242 589209258 /nfs/dbraw/zinc/20/92/58/589209258.db2.gz KHVLQIMFRLKJBT-SNVBAGLBSA-N 1 2 212.243 2.155 20 0 BEADLO C[C@@H]1C[C@@H]1CO[NH+]=C(N)Cc1ccccc1 ZINC000863453671 589288955 /nfs/dbraw/zinc/28/89/55/589288955.db2.gz LUHNGJHKHJFDEI-ZYHUDNBSSA-N 1 2 218.300 2.384 20 0 BEADLO CC(C)CO[C@H](C)C(N)=[NH+]OC[C@@H]1C[C@@H]1C ZINC000863456944 589289606 /nfs/dbraw/zinc/28/96/06/589289606.db2.gz ABDFPKQWRYVFSP-AXFHLTTASA-N 1 2 228.336 2.202 20 0 BEADLO COc1cccc(C(N)=[NH+]OC[C@H]2C[C@@H]2C)c1 ZINC000863458265 589289887 /nfs/dbraw/zinc/28/98/87/589289887.db2.gz XUGPJQSWBCWRTP-GXSJLCMTSA-N 1 2 234.299 2.198 20 0 BEADLO CC1(C)CC(CO[NH+]=C(N)[C@@H]2CCCO2)C1 ZINC000863472386 589291068 /nfs/dbraw/zinc/29/10/68/589291068.db2.gz DLRRKLPKLDUEEF-JTQLQIEISA-N 1 2 226.320 2.100 20 0 BEADLO COC1(C(N)=[NH+]OCc2ccccn2)CCCC1 ZINC000863478455 589292022 /nfs/dbraw/zinc/29/20/22/589292022.db2.gz PUIIWWQTHUAHLE-UHFFFAOYSA-N 1 2 249.314 2.039 20 0 BEADLO CC[NH2+]Cc1noc(C[C@H](C)c2ccco2)n1 ZINC000863656257 589308196 /nfs/dbraw/zinc/30/81/96/589308196.db2.gz LQYCLCDNYDIRCA-VIFPVBQESA-N 1 2 235.287 2.118 20 0 BEADLO COc1cccc([C@@H]([NH3+])c2nc(C3CC3)no2)c1 ZINC000863658938 589308638 /nfs/dbraw/zinc/30/86/38/589308638.db2.gz XXTCRFBZOODUNZ-LLVKDONJSA-N 1 2 245.282 2.004 20 0 BEADLO c1[nH+]c2n(c1-c1cccc3nonc31)CCCC2 ZINC000863975708 589331525 /nfs/dbraw/zinc/33/15/25/589331525.db2.gz XQLMSPLHSWQNPW-UHFFFAOYSA-N 1 2 240.266 2.423 20 0 BEADLO CC(C)(C)C(F)(F)CNCc1c[nH+]c[nH]1 ZINC000864050074 589334766 /nfs/dbraw/zinc/33/47/66/589334766.db2.gz SUYTVTPZXCWYIQ-UHFFFAOYSA-N 1 2 217.263 2.181 20 0 BEADLO CC(C)(C)C(F)(F)CNCc1c[nH]c[nH+]1 ZINC000864050074 589334768 /nfs/dbraw/zinc/33/47/68/589334768.db2.gz SUYTVTPZXCWYIQ-UHFFFAOYSA-N 1 2 217.263 2.181 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)NCC1CCC2(CC2)CC1 ZINC000864076124 589340653 /nfs/dbraw/zinc/34/06/53/589340653.db2.gz ICKVKLSOEYWCEA-UHFFFAOYSA-N 1 2 247.342 2.039 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)NCC1CCC2(CC2)CC1 ZINC000864076124 589340655 /nfs/dbraw/zinc/34/06/55/589340655.db2.gz ICKVKLSOEYWCEA-UHFFFAOYSA-N 1 2 247.342 2.039 20 0 BEADLO C[C@@H](O)c1cccc(N[C@H]2C[C@@H](C)O[C@@H]2C)[nH+]1 ZINC000864088905 589342736 /nfs/dbraw/zinc/34/27/36/589342736.db2.gz IMDKZBLCDPPWPH-BFLSOPEQSA-N 1 2 236.315 2.113 20 0 BEADLO C[C@@H](O)c1cccc(N[C@H]2C[C@@H](C)O[C@H]2C)[nH+]1 ZINC000864088907 589343121 /nfs/dbraw/zinc/34/31/21/589343121.db2.gz IMDKZBLCDPPWPH-SVDPJWKOSA-N 1 2 236.315 2.113 20 0 BEADLO C[C@@H](O)c1cccc(N[C@H]2COC(C)(C)C2)[nH+]1 ZINC000864090191 589343389 /nfs/dbraw/zinc/34/33/89/589343389.db2.gz BQYOLRMKNPSPAD-NXEZZACHSA-N 1 2 236.315 2.114 20 0 BEADLO CO[C@H]1C[C@H](Nc2cc(CC(C)C)[nH+]cn2)C1 ZINC000864091642 589343909 /nfs/dbraw/zinc/34/39/09/589343909.db2.gz QWVGUFLCUJWRJV-HAQNSBGRSA-N 1 2 235.331 2.264 20 0 BEADLO CS[C@H]1C[C@H](Nc2ccc([C@H](C)O)c[nH+]2)C1 ZINC000864092272 589344040 /nfs/dbraw/zinc/34/40/40/589344040.db2.gz YKDBNNZSDIGUIM-LSJOCFKGSA-N 1 2 238.356 2.441 20 0 BEADLO CS[C@H]1C[C@H](Nc2ccc([C@@H](C)O)c[nH+]2)C1 ZINC000864092270 589344102 /nfs/dbraw/zinc/34/41/02/589344102.db2.gz YKDBNNZSDIGUIM-FBIMIBRVSA-N 1 2 238.356 2.441 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H]1C[C@@H]1[C@H]1C[C@H]1C ZINC000865069445 589407509 /nfs/dbraw/zinc/40/75/09/589407509.db2.gz GVEWBXCYXMAQKE-LMLFDSFASA-N 1 2 246.310 2.321 20 0 BEADLO C(=C/c1cnccn1)\c1cn(C2CC2)c[nH+]1 ZINC000865217972 589414639 /nfs/dbraw/zinc/41/46/39/589414639.db2.gz LGLYDKVYSZKPDR-OWOJBTEDSA-N 1 2 212.256 2.178 20 0 BEADLO CN(C)c1c[nH+]cc(NCc2ccoc2)c1 ZINC000865294347 589420213 /nfs/dbraw/zinc/42/02/13/589420213.db2.gz IYRNPWHDEJGEKT-UHFFFAOYSA-N 1 2 217.272 2.353 20 0 BEADLO Cc1cnc(Cn2c[nH+]c(C(C)(C)C)c2)cn1 ZINC000865375203 589428304 /nfs/dbraw/zinc/42/83/04/589428304.db2.gz GEZRFYWBYGMQND-UHFFFAOYSA-N 1 2 230.315 2.327 20 0 BEADLO Cn1ccc(C(=O)Cn2c[nH+]c(C(C)(C)C)c2)c1 ZINC000865376041 589428483 /nfs/dbraw/zinc/42/84/83/589428483.db2.gz WSMUHJGWDYOQBF-UHFFFAOYSA-N 1 2 245.326 2.402 20 0 BEADLO CC(C)Cc1cc(NCC2(O)CCCC2)nc[nH+]1 ZINC000865460162 589438178 /nfs/dbraw/zinc/43/81/78/589438178.db2.gz HCMXYMZIHNOTQG-UHFFFAOYSA-N 1 2 249.358 2.392 20 0 BEADLO Nc1nc(NCCC2CC2)nc(C2CCCC2)[nH+]1 ZINC000865565812 589447145 /nfs/dbraw/zinc/44/71/45/589447145.db2.gz RATWSXLCDNUKIU-UHFFFAOYSA-N 1 2 247.346 2.323 20 0 BEADLO Nc1nc(NCCC2CC2)[nH+]c(C2CCCC2)n1 ZINC000865565812 589447146 /nfs/dbraw/zinc/44/71/46/589447146.db2.gz RATWSXLCDNUKIU-UHFFFAOYSA-N 1 2 247.346 2.323 20 0 BEADLO CC(C)Cc1cc(NC[C@@H]2CCC[C@H]2O)nc[nH+]1 ZINC000865565922 589447637 /nfs/dbraw/zinc/44/76/37/589447637.db2.gz SQYBTHUOXLLBAG-WCQYABFASA-N 1 2 249.358 2.248 20 0 BEADLO FCC(CF)[NH2+]Cc1ccnn1CC1CCC1 ZINC000865582652 589448748 /nfs/dbraw/zinc/44/87/48/589448748.db2.gz FQILORZSACCLDZ-UHFFFAOYSA-N 1 2 243.301 2.080 20 0 BEADLO CCCNc1cc(NC2CC=CC2)nc[nH+]1 ZINC000865613279 589451054 /nfs/dbraw/zinc/45/10/54/589451054.db2.gz QMKWUKLRKOAGKI-UHFFFAOYSA-N 1 2 218.304 2.429 20 0 BEADLO CCCNc1cc(NC2CC=CC2)[nH+]cn1 ZINC000865613279 589451056 /nfs/dbraw/zinc/45/10/56/589451056.db2.gz QMKWUKLRKOAGKI-UHFFFAOYSA-N 1 2 218.304 2.429 20 0 BEADLO CC[C@H](O)CCNc1cc(CC(C)C)[nH+]cn1 ZINC000865617289 589451460 /nfs/dbraw/zinc/45/14/60/589451460.db2.gz QOLSDJQPPFPYAQ-LBPRGKRZSA-N 1 2 237.347 2.248 20 0 BEADLO COc1cncc(NCc2cn(C3CC3)c[nH+]2)c1 ZINC000865655451 589454559 /nfs/dbraw/zinc/45/45/59/589454559.db2.gz BDAXNDNCIILZRX-UHFFFAOYSA-N 1 2 244.298 2.234 20 0 BEADLO C[C@H](O)c1ccc(N2CC[C@@H](C)[C@@H](F)C2)[nH+]c1 ZINC000865662528 589454772 /nfs/dbraw/zinc/45/47/72/589454772.db2.gz APLNGWVYGWGHOX-SCVCMEIPSA-N 1 2 238.306 2.319 20 0 BEADLO COc1ccc(NCc2cn(C)c[nH+]2)c(F)c1 ZINC000865661943 589454774 /nfs/dbraw/zinc/45/47/74/589454774.db2.gz HPNLTHATBUDHST-UHFFFAOYSA-N 1 2 235.262 2.180 20 0 BEADLO C[C@@H]1CC[C@H]1Nc1[nH+]cnc2[nH]c(Cl)cc21 ZINC000865803727 589462234 /nfs/dbraw/zinc/46/22/34/589462234.db2.gz HYOILXZRTGEXOL-HTRCEHHLSA-N 1 2 236.706 2.244 20 0 BEADLO C[C@@H]1CC[C@@H]1Nc1[nH+]cnc2[nH]c(Cl)cc21 ZINC000865803729 589462461 /nfs/dbraw/zinc/46/24/61/589462461.db2.gz HYOILXZRTGEXOL-SVRRBLITSA-N 1 2 236.706 2.244 20 0 BEADLO CC(C)Cc1cc(NCC2=CCOCC2)nc[nH+]1 ZINC000865843322 589464774 /nfs/dbraw/zinc/46/47/74/589464774.db2.gz QLSMJMIQRDQOQW-UHFFFAOYSA-N 1 2 247.342 2.434 20 0 BEADLO c1c[nH+]c(CNc2cccc3c2OCCCO3)[nH]1 ZINC000865851348 589464851 /nfs/dbraw/zinc/46/48/51/589464851.db2.gz AUGFOQAYDFPXJA-UHFFFAOYSA-N 1 2 245.282 2.183 20 0 BEADLO CCc1ncc(CNc2ccc([C@H](C)O)c[nH+]2)o1 ZINC000865860914 589465573 /nfs/dbraw/zinc/46/55/73/589465573.db2.gz ZEYCGDOFOBXHQR-VIFPVBQESA-N 1 2 247.298 2.297 20 0 BEADLO CC[C@H](C)COC(=O)[C@@H](C)[NH+]1CCSCC1 ZINC000120794376 589466351 /nfs/dbraw/zinc/46/63/51/589466351.db2.gz YFFONYYRGBQAIV-WDEREUQCSA-N 1 2 245.388 2.013 20 0 BEADLO CC[C@@H](C)COC(=O)[C@@H](C)[NH+]1CCSCC1 ZINC000120794221 589466504 /nfs/dbraw/zinc/46/65/04/589466504.db2.gz YFFONYYRGBQAIV-GHMZBOCLSA-N 1 2 245.388 2.013 20 0 BEADLO Clc1cc2c(nc[nH+]c2N[C@@H]2C[C@H]3C[C@H]3C2)[nH]1 ZINC000865889392 589467472 /nfs/dbraw/zinc/46/74/72/589467472.db2.gz CSFWHXMPAIXNPN-RNLVFQAGSA-N 1 2 248.717 2.244 20 0 BEADLO Clc1cc2c(nc[nH+]c2N[C@H]2C=CCC2)[nH]1 ZINC000865939037 589469508 /nfs/dbraw/zinc/46/95/08/589469508.db2.gz NSOFNIITLWQHKD-ZETCQYMHSA-N 1 2 234.690 2.164 20 0 BEADLO CC(C)c1nc(NCC[C@@H](O)C(F)F)cc[nH+]1 ZINC000866038336 589473524 /nfs/dbraw/zinc/47/35/24/589473524.db2.gz LARRLJJVMDLQKF-MRVPVSSYSA-N 1 2 245.273 2.028 20 0 BEADLO CO[C@H]1CC[C@@H](C)N(c2cc[nH+]c(C3CC3)n2)C1 ZINC000866069665 589474644 /nfs/dbraw/zinc/47/46/44/589474644.db2.gz FRJWSABXKHZELM-PWSUYJOCSA-N 1 2 247.342 2.358 20 0 BEADLO CCc1cc(N2C[C@H](OC)CC[C@@H]2C)nc(C)[nH+]1 ZINC000866073306 589474773 /nfs/dbraw/zinc/47/47/73/589474773.db2.gz YSPFNAPTFMULGT-GXFFZTMASA-N 1 2 249.358 2.351 20 0 BEADLO CCc1nc(N2C[C@H](OC)CC[C@@H]2C)cc(C)[nH+]1 ZINC000866072663 589474955 /nfs/dbraw/zinc/47/49/55/589474955.db2.gz LXRLPEXWMUVXIB-NWDGAFQWSA-N 1 2 249.358 2.351 20 0 BEADLO CCc1cc(NCc2ccnc(F)c2)nc[nH+]1 ZINC000866090297 589475314 /nfs/dbraw/zinc/47/53/14/589475314.db2.gz RLNCJBJJHOSFEB-UHFFFAOYSA-N 1 2 232.262 2.185 20 0 BEADLO CS[C@H]1C[C@H](Nc2cc[nH+]c3ccncc23)C1 ZINC000866101476 589476111 /nfs/dbraw/zinc/47/61/11/589476111.db2.gz NLLDQXRPELWYRO-MGCOHNPYSA-N 1 2 245.351 2.358 20 0 BEADLO CC(C)c1nc(N2C[C@H](O)CC(C)(C)C2)cc[nH+]1 ZINC000866226458 589481390 /nfs/dbraw/zinc/48/13/90/589481390.db2.gz KXAFIBLGVCMAHX-LLVKDONJSA-N 1 2 249.358 2.197 20 0 BEADLO CC[C@@H](C[C@H](C)O)Nc1cc[nH+]c(C2CC2)n1 ZINC000866299382 589484732 /nfs/dbraw/zinc/48/47/32/589484732.db2.gz JRBSIXNSUWSGCM-ONGXEEELSA-N 1 2 235.331 2.315 20 0 BEADLO CC/C=C(\F)C(=O)N[C@@H](C)c1[nH+]ccn1CC ZINC000868679871 589572445 /nfs/dbraw/zinc/57/24/45/589572445.db2.gz YIGHLMGLJBHKKB-LKJZUNMESA-N 1 2 239.294 2.344 20 0 BEADLO CC/C=C(\F)C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000868738070 589574772 /nfs/dbraw/zinc/57/47/72/589574772.db2.gz HDLDNLFKEBHANV-DLGWSKDZSA-N 1 2 237.278 2.269 20 0 BEADLO C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000868731668 589574858 /nfs/dbraw/zinc/57/48/58/589574858.db2.gz KHOVILGMSMVXBQ-VPOLOUISSA-N 1 2 247.342 2.053 20 0 BEADLO C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000868731667 589575028 /nfs/dbraw/zinc/57/50/28/589575028.db2.gz KHOVILGMSMVXBQ-RCWTZXSCSA-N 1 2 247.342 2.053 20 0 BEADLO COc1cc(C)[nH+]c(COC(=O)[C@H]2C[C@H]2C)c1 ZINC000122286009 589576552 /nfs/dbraw/zinc/57/65/52/589576552.db2.gz LVCSUHXHBJQPRM-PELKAZGASA-N 1 2 235.283 2.098 20 0 BEADLO Nc1ccc(CCC(=O)OCCCC2CC2)c[nH+]1 ZINC000869448121 589606626 /nfs/dbraw/zinc/60/66/26/589606626.db2.gz UFOAIRWFTNYGFA-UHFFFAOYSA-N 1 2 248.326 2.330 20 0 BEADLO CC(C)(C)[C@@H]1C[C@H]1C(=O)OCCn1cc[nH+]c1 ZINC000869647522 589618683 /nfs/dbraw/zinc/61/86/83/589618683.db2.gz CTUJRIPOBVEGQC-GHMZBOCLSA-N 1 2 236.315 2.109 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)[C@]12C[C@H]1CCCC2 ZINC000869704216 589623710 /nfs/dbraw/zinc/62/37/10/589623710.db2.gz PDDLYNIESFVIIX-BXUZGUMPSA-N 1 2 248.326 2.086 20 0 BEADLO C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)OCCCn1cc[nH+]c1 ZINC000869886299 589635346 /nfs/dbraw/zinc/63/53/46/589635346.db2.gz DVDXZPATXZOKAS-MROQNXINSA-N 1 2 248.326 2.109 20 0 BEADLO CC(C)CCOC(=O)[C@@H](C)[NH+]1CCSCC1 ZINC000122902885 589643295 /nfs/dbraw/zinc/64/32/95/589643295.db2.gz DAMGJIRSEPBPJS-LLVKDONJSA-N 1 2 245.388 2.013 20 0 BEADLO C[C@H]1OCC[C@H]1CO[NH+]=C(N)Cc1ccccc1 ZINC000871727675 589799339 /nfs/dbraw/zinc/79/93/39/589799339.db2.gz JOKCVAIHYNEYQW-YPMHNXCESA-N 1 2 248.326 2.153 20 0 BEADLO CC(C)(C)c1cn(C[C@H](O)C(F)(F)F)c[nH+]1 ZINC000871988480 589853441 /nfs/dbraw/zinc/85/34/41/589853441.db2.gz DEMSGBVGEKLETD-QMMMGPOBSA-N 1 2 236.237 2.104 20 0 BEADLO C[C@@H]([NH2+]Cc1cc[nH]n1)c1cc(O)ccc1F ZINC000872033908 589858483 /nfs/dbraw/zinc/85/84/83/589858483.db2.gz KBJVQOIVAHMJFA-MRVPVSSYSA-N 1 2 235.262 2.105 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2cccc(O)c2F)[nH]n1 ZINC000872038743 589859299 /nfs/dbraw/zinc/85/92/99/589859299.db2.gz PPZBZYLGXBRUMI-SECBINFHSA-N 1 2 249.289 2.414 20 0 BEADLO C[C@@H]([NH2+]Cc1ccn(C)n1)c1cc(O)ccc1F ZINC000872053958 589861118 /nfs/dbraw/zinc/86/11/18/589861118.db2.gz NXUHVDILPZULII-SECBINFHSA-N 1 2 249.289 2.116 20 0 BEADLO CC[C@@H]([NH2+]Cc1nonc1C)c1ccncc1 ZINC000872135510 589878758 /nfs/dbraw/zinc/87/87/58/589878758.db2.gz HYTXUVBHKDASNL-LLVKDONJSA-N 1 2 232.287 2.014 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C[C@@H]1C[C@H]1C1CC1 ZINC000888598081 589898470 /nfs/dbraw/zinc/89/84/70/589898470.db2.gz TZMZFQXZCONSPY-QWRGUYRKSA-N 1 2 246.310 2.465 20 0 BEADLO CCc1cc(N[C@H](C)c2nccnc2C)nc[nH+]1 ZINC000872767996 589967155 /nfs/dbraw/zinc/96/71/55/589967155.db2.gz GHYZWSMNFKRNRN-SNVBAGLBSA-N 1 2 243.314 2.311 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@H]1CC12CCC2 ZINC000872775307 589968421 /nfs/dbraw/zinc/96/84/21/589968421.db2.gz RKJIUAXRUGRMSJ-VIFPVBQESA-N 1 2 219.288 2.148 20 0 BEADLO CC[C@H]([NH2+][C@H]1CCOC1=O)c1ccc(C)cc1 ZINC000019876563 590025588 /nfs/dbraw/zinc/02/55/88/590025588.db2.gz PHFLDFAJBWASOR-STQMWFEESA-N 1 2 233.311 2.351 20 0 BEADLO Cn1c[nH+]cc1COC(=O)C1CCC=CCC1 ZINC000873507612 590051710 /nfs/dbraw/zinc/05/17/10/590051710.db2.gz BOORHVKIKGKDRW-UHFFFAOYSA-N 1 2 234.299 2.210 20 0 BEADLO COc1ccccc1OC(=O)[C@@H]1CCCC[N@@H+]1C ZINC000873850022 590074822 /nfs/dbraw/zinc/07/48/22/590074822.db2.gz ATSDFNDEYYWFBV-NSHDSACASA-N 1 2 249.310 2.085 20 0 BEADLO COc1ccccc1OC(=O)[C@@H]1CCCC[N@H+]1C ZINC000873850022 590074825 /nfs/dbraw/zinc/07/48/25/590074825.db2.gz ATSDFNDEYYWFBV-NSHDSACASA-N 1 2 249.310 2.085 20 0 BEADLO CCC[C@H](CC)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000874445058 590111446 /nfs/dbraw/zinc/11/14/46/590111446.db2.gz UHNQHUMAUKRKRO-JTQLQIEISA-N 1 2 223.320 2.194 20 0 BEADLO C[C@H](CN(C)C(=O)Cc1[nH]cc[nH+]1)C(C)(C)C ZINC000874591255 590118075 /nfs/dbraw/zinc/11/80/75/590118075.db2.gz HCHUXQAZESBNQC-SNVBAGLBSA-N 1 2 237.347 2.093 20 0 BEADLO CSCC[C@@H](C)[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000125239286 590157590 /nfs/dbraw/zinc/15/75/90/590157590.db2.gz XLXOBZWHRJQLED-ZJUUUORDSA-N 1 2 247.404 2.448 20 0 BEADLO CSCC[C@H](C)[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000125239476 590157809 /nfs/dbraw/zinc/15/78/09/590157809.db2.gz XLXOBZWHRJQLED-VHSXEESVSA-N 1 2 247.404 2.448 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N[C@@H]1CCCC2(CC2)C1 ZINC000888696279 590185941 /nfs/dbraw/zinc/18/59/41/590185941.db2.gz PVCBDBVTTMPALG-LLVKDONJSA-N 1 2 247.342 2.181 20 0 BEADLO Clc1csc(C[NH+]2CCCC2)n1 ZINC000876523980 590207734 /nfs/dbraw/zinc/20/77/34/590207734.db2.gz HWKUQIWZPJYTNQ-UHFFFAOYSA-N 1 2 202.710 2.392 20 0 BEADLO CC[N@H+](CCOC)Cc1nc(Cl)cs1 ZINC000876567949 590216880 /nfs/dbraw/zinc/21/68/80/590216880.db2.gz CAPUZRLHZXNMAG-UHFFFAOYSA-N 1 2 234.752 2.265 20 0 BEADLO CC[N@@H+](CCOC)Cc1nc(Cl)cs1 ZINC000876567949 590216881 /nfs/dbraw/zinc/21/68/81/590216881.db2.gz CAPUZRLHZXNMAG-UHFFFAOYSA-N 1 2 234.752 2.265 20 0 BEADLO COC(=O)C[N@H+](C)Cc1cccc(Cl)c1C ZINC000876586960 590218517 /nfs/dbraw/zinc/21/85/17/590218517.db2.gz KFLZXEMDDJLKJN-UHFFFAOYSA-N 1 2 241.718 2.253 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1cccc(Cl)c1C ZINC000876586960 590218519 /nfs/dbraw/zinc/21/85/19/590218519.db2.gz KFLZXEMDDJLKJN-UHFFFAOYSA-N 1 2 241.718 2.253 20 0 BEADLO C[N@H+](Cc1nc(Cl)cs1)[C@H]1CCOC1 ZINC000876690851 590231305 /nfs/dbraw/zinc/23/13/05/590231305.db2.gz STLNHAQNJKHSSK-ZETCQYMHSA-N 1 2 232.736 2.017 20 0 BEADLO C[N@@H+](Cc1nc(Cl)cs1)[C@H]1CCOC1 ZINC000876690851 590231307 /nfs/dbraw/zinc/23/13/07/590231307.db2.gz STLNHAQNJKHSSK-ZETCQYMHSA-N 1 2 232.736 2.017 20 0 BEADLO c1cc(CN2CCC[C@@H]2c2[nH]cc[nH+]2)sn1 ZINC000877344648 590319065 /nfs/dbraw/zinc/31/90/65/590319065.db2.gz LISVGLOQWLBZFK-SNVBAGLBSA-N 1 2 234.328 2.203 20 0 BEADLO OCC[C@@H]1CCC[N@@H+]1Cc1nc(Cl)cs1 ZINC000877435022 590326898 /nfs/dbraw/zinc/32/68/98/590326898.db2.gz MOVZMXSOTXCCGR-QMMMGPOBSA-N 1 2 246.763 2.143 20 0 BEADLO OCC[C@@H]1CCC[N@H+]1Cc1nc(Cl)cs1 ZINC000877435022 590326901 /nfs/dbraw/zinc/32/69/01/590326901.db2.gz MOVZMXSOTXCCGR-QMMMGPOBSA-N 1 2 246.763 2.143 20 0 BEADLO COc1cnc(F)c(C[NH+]2[C@@H](C)C[C@@H]2C)c1 ZINC000877488205 590338707 /nfs/dbraw/zinc/33/87/07/590338707.db2.gz ZNPMHRKWEFYHFM-IUCAKERBSA-N 1 2 224.279 2.212 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1ccc(Cl)nn1 ZINC000877486032 590338939 /nfs/dbraw/zinc/33/89/39/590338939.db2.gz CLHXBZPKBHISSB-YUMQZZPRSA-N 1 2 211.696 2.113 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1ccc(Cl)nn1 ZINC000877486031 590339216 /nfs/dbraw/zinc/33/92/16/590339216.db2.gz CLHXBZPKBHISSB-OCAPTIKFSA-N 1 2 211.696 2.113 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1ccc(Cl)nn1 ZINC000877486031 590339217 /nfs/dbraw/zinc/33/92/17/590339217.db2.gz CLHXBZPKBHISSB-OCAPTIKFSA-N 1 2 211.696 2.113 20 0 BEADLO COc1c(C)c[nH+]c(CNC(CF)CF)c1C ZINC000877559187 590358400 /nfs/dbraw/zinc/35/84/00/590358400.db2.gz JMRKVUMYIDHMAN-UHFFFAOYSA-N 1 2 244.285 2.104 20 0 BEADLO Cc1ncc([C@@H](C)[NH2+]C(CF)CF)c(C)n1 ZINC000877559705 590358894 /nfs/dbraw/zinc/35/88/94/590358894.db2.gz SMGQRTVAEYVRGK-MRVPVSSYSA-N 1 2 229.274 2.052 20 0 BEADLO CCc1nc(C[NH2+]Cc2cccc(F)c2N)co1 ZINC000877571379 590362140 /nfs/dbraw/zinc/36/21/40/590362140.db2.gz XEFFCZMMPYJWKX-UHFFFAOYSA-N 1 2 249.289 2.248 20 0 BEADLO CCC1C[NH+](Cc2cc(OC)cnc2F)C1 ZINC000877579223 590365022 /nfs/dbraw/zinc/36/50/22/590365022.db2.gz OVRSQRDVBGIMFI-UHFFFAOYSA-N 1 2 224.279 2.071 20 0 BEADLO C[C@@H](O)C[N@H+](Cc1nc(Cl)cs1)C1CC1 ZINC000877621471 590375746 /nfs/dbraw/zinc/37/57/46/590375746.db2.gz RTZLKAXCFYILHB-SSDOTTSWSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H](O)C[N@@H+](Cc1nc(Cl)cs1)C1CC1 ZINC000877621471 590375749 /nfs/dbraw/zinc/37/57/49/590375749.db2.gz RTZLKAXCFYILHB-SSDOTTSWSA-N 1 2 246.763 2.142 20 0 BEADLO Clc1csc(C[N@@H+]2CCC3(COC3)C2)n1 ZINC000877638976 590381636 /nfs/dbraw/zinc/38/16/36/590381636.db2.gz UKUQOBNNYGZSBX-UHFFFAOYSA-N 1 2 244.747 2.019 20 0 BEADLO Clc1csc(C[N@H+]2CCC3(COC3)C2)n1 ZINC000877638976 590381637 /nfs/dbraw/zinc/38/16/37/590381637.db2.gz UKUQOBNNYGZSBX-UHFFFAOYSA-N 1 2 244.747 2.019 20 0 BEADLO C[C@@H](C[C@H]1CCOC1)Nc1c[nH+]cc(N(C)C)c1 ZINC000877668867 590389411 /nfs/dbraw/zinc/38/94/11/590389411.db2.gz VKXMCWLRPINXSV-NWDGAFQWSA-N 1 2 249.358 2.375 20 0 BEADLO CC(C)(C)OC1C[NH+](Cc2ccoc2)C1 ZINC000877772288 590422496 /nfs/dbraw/zinc/42/24/96/590422496.db2.gz XLSBXTFUZHLAHS-UHFFFAOYSA-N 1 2 209.289 2.279 20 0 BEADLO FC(F)(F)[C@@H]1CC[N@H+](CC2(F)CC2)CCO1 ZINC000877820204 590428414 /nfs/dbraw/zinc/42/84/14/590428414.db2.gz NJZAWXCPFRADIE-QMMMGPOBSA-N 1 2 241.228 2.142 20 0 BEADLO FC(F)(F)[C@@H]1CC[N@@H+](CC2(F)CC2)CCO1 ZINC000877820204 590428415 /nfs/dbraw/zinc/42/84/15/590428415.db2.gz NJZAWXCPFRADIE-QMMMGPOBSA-N 1 2 241.228 2.142 20 0 BEADLO Cc1conc1C[N@H+](C)CCOc1ccccc1 ZINC000877932028 590449712 /nfs/dbraw/zinc/44/97/12/590449712.db2.gz ZHVMIFCYXOHCHN-UHFFFAOYSA-N 1 2 246.310 2.494 20 0 BEADLO Cc1conc1C[N@@H+](C)CCOc1ccccc1 ZINC000877932028 590449714 /nfs/dbraw/zinc/44/97/14/590449714.db2.gz ZHVMIFCYXOHCHN-UHFFFAOYSA-N 1 2 246.310 2.494 20 0 BEADLO CO[C@@H]1CCC[N@H+](Cc2scnc2Cl)C1 ZINC000878046921 590480450 /nfs/dbraw/zinc/48/04/50/590480450.db2.gz MDZONVWBADFHPB-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO CO[C@@H]1CCC[N@@H+](Cc2scnc2Cl)C1 ZINC000878046921 590480452 /nfs/dbraw/zinc/48/04/52/590480452.db2.gz MDZONVWBADFHPB-MRVPVSSYSA-N 1 2 246.763 2.407 20 0 BEADLO C[N@H+](Cc1scnc1Cl)[C@@H]1CCOC1 ZINC000878084649 590490256 /nfs/dbraw/zinc/49/02/56/590490256.db2.gz WZWATZYLSANNSU-SSDOTTSWSA-N 1 2 232.736 2.017 20 0 BEADLO C[N@@H+](Cc1scnc1Cl)[C@@H]1CCOC1 ZINC000878084649 590490257 /nfs/dbraw/zinc/49/02/57/590490257.db2.gz WZWATZYLSANNSU-SSDOTTSWSA-N 1 2 232.736 2.017 20 0 BEADLO C[N@@H+](Cc1ccon1)C[C@H]1CCC2(CCC2)O1 ZINC000878124089 590499988 /nfs/dbraw/zinc/49/99/88/590499988.db2.gz GDOKXUBFFCHHQM-GFCCVEGCSA-N 1 2 236.315 2.208 20 0 BEADLO C[N@H+](Cc1ccon1)C[C@H]1CCC2(CCC2)O1 ZINC000878124089 590499990 /nfs/dbraw/zinc/49/99/90/590499990.db2.gz GDOKXUBFFCHHQM-GFCCVEGCSA-N 1 2 236.315 2.208 20 0 BEADLO C=C/C=C/CC[N@@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000878123316 590500236 /nfs/dbraw/zinc/50/02/36/590500236.db2.gz WRBDUXPOLIDHMD-HMDXOVGESA-N 1 2 235.249 2.382 20 0 BEADLO C=C/C=C/CC[N@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000878123316 590500237 /nfs/dbraw/zinc/50/02/37/590500237.db2.gz WRBDUXPOLIDHMD-HMDXOVGESA-N 1 2 235.249 2.382 20 0 BEADLO C[N@@H+](Cc1ccon1)C[C@@H]1C[C@H]2CCC[C@@H]2O1 ZINC000878126310 590501992 /nfs/dbraw/zinc/50/19/92/590501992.db2.gz WZKLKXZIDNLKEI-WXHSDQCUSA-N 1 2 236.315 2.064 20 0 BEADLO C[N@H+](Cc1ccon1)C[C@@H]1C[C@H]2CCC[C@@H]2O1 ZINC000878126310 590501995 /nfs/dbraw/zinc/50/19/95/590501995.db2.gz WZKLKXZIDNLKEI-WXHSDQCUSA-N 1 2 236.315 2.064 20 0 BEADLO C[N@@H+](Cc1ccon1)C[C@H]1CCCC(C)(C)O1 ZINC000878125908 590502072 /nfs/dbraw/zinc/50/20/72/590502072.db2.gz QQKLHFMUKWWIFD-GFCCVEGCSA-N 1 2 238.331 2.454 20 0 BEADLO C[N@H+](Cc1ccon1)C[C@H]1CCCC(C)(C)O1 ZINC000878125908 590502074 /nfs/dbraw/zinc/50/20/74/590502074.db2.gz QQKLHFMUKWWIFD-GFCCVEGCSA-N 1 2 238.331 2.454 20 0 BEADLO CC1(C)CCC[C@@H](C[N@@H+]2CCc3c[nH]nc3C2)O1 ZINC000878290583 590535765 /nfs/dbraw/zinc/53/57/65/590535765.db2.gz BAHXZTULKFDHLP-LBPRGKRZSA-N 1 2 249.358 2.116 20 0 BEADLO CC1(C)CCC[C@@H](C[N@H+]2CCc3c[nH]nc3C2)O1 ZINC000878290583 590535767 /nfs/dbraw/zinc/53/57/67/590535767.db2.gz BAHXZTULKFDHLP-LBPRGKRZSA-N 1 2 249.358 2.116 20 0 BEADLO CC1(C)CCC[C@@H](C[N@@H+]2CCc3cn[nH]c3C2)O1 ZINC000878290583 590535769 /nfs/dbraw/zinc/53/57/69/590535769.db2.gz BAHXZTULKFDHLP-LBPRGKRZSA-N 1 2 249.358 2.116 20 0 BEADLO CC1(C)CCC[C@@H](C[N@H+]2CCc3cn[nH]c3C2)O1 ZINC000878290583 590535770 /nfs/dbraw/zinc/53/57/70/590535770.db2.gz BAHXZTULKFDHLP-LBPRGKRZSA-N 1 2 249.358 2.116 20 0 BEADLO Cc1conc1C[N@@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000878315111 590542046 /nfs/dbraw/zinc/54/20/46/590542046.db2.gz GHPIJDQPRSTKMZ-MRVPVSSYSA-N 1 2 234.221 2.367 20 0 BEADLO Cc1conc1C[N@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000878315111 590542049 /nfs/dbraw/zinc/54/20/49/590542049.db2.gz GHPIJDQPRSTKMZ-MRVPVSSYSA-N 1 2 234.221 2.367 20 0 BEADLO CC(C)[C@H](O)CC[N@@H+]1CCC[C@H]1C(F)F ZINC000878321699 590545089 /nfs/dbraw/zinc/54/50/89/590545089.db2.gz SZQVWBDZOCCIDH-VHSXEESVSA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)[C@H](O)CC[N@H+]1CCC[C@H]1C(F)F ZINC000878321699 590545092 /nfs/dbraw/zinc/54/50/92/590545092.db2.gz SZQVWBDZOCCIDH-VHSXEESVSA-N 1 2 221.291 2.123 20 0 BEADLO FC1=CCC[N@H+](CCCOC(F)(F)F)C1 ZINC000878338703 590550667 /nfs/dbraw/zinc/55/06/67/590550667.db2.gz APUGPNZXJLYHRZ-UHFFFAOYSA-N 1 2 227.201 2.472 20 0 BEADLO FC1=CCC[N@@H+](CCCOC(F)(F)F)C1 ZINC000878338703 590550668 /nfs/dbraw/zinc/55/06/68/590550668.db2.gz APUGPNZXJLYHRZ-UHFFFAOYSA-N 1 2 227.201 2.472 20 0 BEADLO FC1(F)CC[N@H+](C[C@@H]2C[C@@H]3CCC[C@H]3O2)C1 ZINC000878380301 590555948 /nfs/dbraw/zinc/55/59/48/590555948.db2.gz WGUGAIJFMFTHTC-GARJFASQSA-N 1 2 231.286 2.285 20 0 BEADLO FC1(F)CC[N@@H+](C[C@@H]2C[C@@H]3CCC[C@H]3O2)C1 ZINC000878380301 590555950 /nfs/dbraw/zinc/55/59/50/590555950.db2.gz WGUGAIJFMFTHTC-GARJFASQSA-N 1 2 231.286 2.285 20 0 BEADLO FC1(F)CC[N@H+](C[C@@H]2CC3(CCC3)CO2)C1 ZINC000878379110 590556730 /nfs/dbraw/zinc/55/67/30/590556730.db2.gz HBLMCXKOBILEIO-JTQLQIEISA-N 1 2 231.286 2.287 20 0 BEADLO FC1(F)CC[N@@H+](C[C@@H]2CC3(CCC3)CO2)C1 ZINC000878379110 590556733 /nfs/dbraw/zinc/55/67/33/590556733.db2.gz HBLMCXKOBILEIO-JTQLQIEISA-N 1 2 231.286 2.287 20 0 BEADLO Cc1nc(C[N@H+](C)CC2CC3(CCC3)C2)no1 ZINC000878381324 590556845 /nfs/dbraw/zinc/55/68/45/590556845.db2.gz MNMVWXUWXWSYLS-UHFFFAOYSA-N 1 2 235.331 2.390 20 0 BEADLO Cc1nc(C[N@@H+](C)CC2CC3(CCC3)C2)no1 ZINC000878381324 590556847 /nfs/dbraw/zinc/55/68/47/590556847.db2.gz MNMVWXUWXWSYLS-UHFFFAOYSA-N 1 2 235.331 2.390 20 0 BEADLO Cc1conc1C[N@@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000878530902 590587204 /nfs/dbraw/zinc/58/72/04/590587204.db2.gz ANGGBQBJAYYAGJ-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1conc1C[N@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000878530902 590587205 /nfs/dbraw/zinc/58/72/05/590587205.db2.gz ANGGBQBJAYYAGJ-GFCCVEGCSA-N 1 2 238.331 2.230 20 0 BEADLO CC1(C)CO[C@@H](C[N@@H+]2Cc3ccncc3C2)C1 ZINC000878608930 590595355 /nfs/dbraw/zinc/59/53/55/590595355.db2.gz IHBRYICLBXAOFL-CYBMUJFWSA-N 1 2 232.327 2.212 20 0 BEADLO CC1(C)CO[C@@H](C[N@H+]2Cc3ccncc3C2)C1 ZINC000878608930 590595356 /nfs/dbraw/zinc/59/53/56/590595356.db2.gz IHBRYICLBXAOFL-CYBMUJFWSA-N 1 2 232.327 2.212 20 0 BEADLO CC(=O)C1CC[NH+](Cc2coc(C3CC3)n2)CC1 ZINC000878673088 590607389 /nfs/dbraw/zinc/60/73/89/590607389.db2.gz VWBVXHGIQCETDL-UHFFFAOYSA-N 1 2 248.326 2.353 20 0 BEADLO Cc1[nH]c(CN2CCC=C(Cl)C2)[nH+]c1C ZINC000878789889 590622111 /nfs/dbraw/zinc/62/21/11/590622111.db2.gz HTYKVSALRKJMGV-UHFFFAOYSA-N 1 2 225.723 2.355 20 0 BEADLO ClC1=CCC[N@H+](Cc2ccns2)C1 ZINC000878790005 590622453 /nfs/dbraw/zinc/62/24/53/590622453.db2.gz AGQFLMHYIMOESU-UHFFFAOYSA-N 1 2 214.721 2.472 20 0 BEADLO C[C@H](c1cnccn1)[N@@H+]1CCC=C(Cl)C1 ZINC000878791068 590623866 /nfs/dbraw/zinc/62/38/66/590623866.db2.gz CIVQUTUKDDLREM-SECBINFHSA-N 1 2 223.707 2.366 20 0 BEADLO C[C@H](c1cnccn1)[N@H+]1CCC=C(Cl)C1 ZINC000878791068 590623867 /nfs/dbraw/zinc/62/38/67/590623867.db2.gz CIVQUTUKDDLREM-SECBINFHSA-N 1 2 223.707 2.366 20 0 BEADLO ClC1=CCC[N@H+](Cc2ccncc2)C1 ZINC000878794205 590624461 /nfs/dbraw/zinc/62/44/61/590624461.db2.gz VJSDYCGQIDOTFR-UHFFFAOYSA-N 1 2 208.692 2.410 20 0 BEADLO ClC1=CCC[N@@H+](Cc2ccncc2)C1 ZINC000878794205 590624463 /nfs/dbraw/zinc/62/44/63/590624463.db2.gz VJSDYCGQIDOTFR-UHFFFAOYSA-N 1 2 208.692 2.410 20 0 BEADLO FC(F)(F)COCC[N@@H+]1CCC=C(Cl)C1 ZINC000878793748 590624488 /nfs/dbraw/zinc/62/44/88/590624488.db2.gz KRGGMAKIESMIGK-UHFFFAOYSA-N 1 2 243.656 2.394 20 0 BEADLO FC(F)(F)COCC[N@H+]1CCC=C(Cl)C1 ZINC000878793748 590624489 /nfs/dbraw/zinc/62/44/89/590624489.db2.gz KRGGMAKIESMIGK-UHFFFAOYSA-N 1 2 243.656 2.394 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1Cc1nocc1C ZINC000878803890 590625225 /nfs/dbraw/zinc/62/52/25/590625225.db2.gz NBINSCLRVGMSKJ-NEPJUHHUSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@H+]1Cc1nocc1C ZINC000878803890 590625226 /nfs/dbraw/zinc/62/52/26/590625226.db2.gz NBINSCLRVGMSKJ-NEPJUHHUSA-N 1 2 238.331 2.372 20 0 BEADLO C[N@@H+](Cc1cnc[nH]1)C[C@H]1CCC(C)(C)CO1 ZINC000878884888 590640161 /nfs/dbraw/zinc/64/01/61/590640161.db2.gz OGURRWJKQFMVRK-GFCCVEGCSA-N 1 2 237.347 2.047 20 0 BEADLO C[N@H+](Cc1cnc[nH]1)C[C@H]1CCC(C)(C)CO1 ZINC000878884888 590640166 /nfs/dbraw/zinc/64/01/66/590640166.db2.gz OGURRWJKQFMVRK-GFCCVEGCSA-N 1 2 237.347 2.047 20 0 BEADLO C[N@@H+](Cc1c[nH]cn1)C[C@H]1CCC(C)(C)CO1 ZINC000878884888 590640168 /nfs/dbraw/zinc/64/01/68/590640168.db2.gz OGURRWJKQFMVRK-GFCCVEGCSA-N 1 2 237.347 2.047 20 0 BEADLO C[N@H+](Cc1c[nH]cn1)C[C@H]1CCC(C)(C)CO1 ZINC000878884888 590640173 /nfs/dbraw/zinc/64/01/73/590640173.db2.gz OGURRWJKQFMVRK-GFCCVEGCSA-N 1 2 237.347 2.047 20 0 BEADLO Cl/C=C\C[N@@H+]1CCC[C@H]1c1ncccn1 ZINC000878976423 590665831 /nfs/dbraw/zinc/66/58/31/590665831.db2.gz DFIQKCNKVCAGFP-ODTOEKCJSA-N 1 2 223.707 2.366 20 0 BEADLO Cl/C=C\C[N@H+]1CCC[C@H]1c1ncccn1 ZINC000878976423 590665834 /nfs/dbraw/zinc/66/58/34/590665834.db2.gz DFIQKCNKVCAGFP-ODTOEKCJSA-N 1 2 223.707 2.366 20 0 BEADLO Cc1conc1C[N@H+](C)CC1=CCSC1 ZINC000878998293 590674376 /nfs/dbraw/zinc/67/43/76/590674376.db2.gz NHBNGVXOLJROQE-UHFFFAOYSA-N 1 2 224.329 2.088 20 0 BEADLO Cc1conc1C[N@@H+](C)CC1=CCSC1 ZINC000878998293 590674381 /nfs/dbraw/zinc/67/43/81/590674381.db2.gz NHBNGVXOLJROQE-UHFFFAOYSA-N 1 2 224.329 2.088 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)C[C@@H]1C[C@@H]2CCC[C@H]2O1 ZINC000879188242 590709472 /nfs/dbraw/zinc/70/94/72/590709472.db2.gz IQWITVIXKCRGLG-FPMFFAJLSA-N 1 2 249.358 2.108 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)C[C@@H]1C[C@@H]2CCC[C@H]2O1 ZINC000879188242 590709476 /nfs/dbraw/zinc/70/94/76/590709476.db2.gz IQWITVIXKCRGLG-FPMFFAJLSA-N 1 2 249.358 2.108 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)CC1(C)CCC1 ZINC000879188438 590710717 /nfs/dbraw/zinc/71/07/17/590710717.db2.gz LKBRSXPVVGUFBO-UHFFFAOYSA-N 1 2 207.321 2.340 20 0 BEADLO Cc1ncc([C@@H](C)[NH2+]Cc2nccc(C)n2)s1 ZINC000879251672 590721798 /nfs/dbraw/zinc/72/17/98/590721798.db2.gz AFPBOGLFICUFQG-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO CC1(C)C[C@@H](O)C[N@H+](C/C(Cl)=C/Cl)C1 ZINC000879622864 590836801 /nfs/dbraw/zinc/83/68/01/590836801.db2.gz SRLRXOSRKACSMZ-USYJTPIQSA-N 1 2 238.158 2.398 20 0 BEADLO CC1(C)C[C@@H](O)C[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000879622864 590836807 /nfs/dbraw/zinc/83/68/07/590836807.db2.gz SRLRXOSRKACSMZ-USYJTPIQSA-N 1 2 238.158 2.398 20 0 BEADLO CC(C)c1cnc(C[NH2+][C@@H](C)c2ccnn2C)o1 ZINC000879683572 590847618 /nfs/dbraw/zinc/84/76/18/590847618.db2.gz AWYKUMBRQMPZKX-JTQLQIEISA-N 1 2 248.330 2.382 20 0 BEADLO FC(F)(F)OCCC[N@@H+]1OC2CCC1CC2 ZINC000879799685 590869918 /nfs/dbraw/zinc/86/99/18/590869918.db2.gz LLKCWXGJVSYDEL-UHFFFAOYSA-N 1 2 239.237 2.471 20 0 BEADLO FC(F)(F)OCCC[N@H+]1OC2CCC1CC2 ZINC000879799685 590869924 /nfs/dbraw/zinc/86/99/24/590869924.db2.gz LLKCWXGJVSYDEL-UHFFFAOYSA-N 1 2 239.237 2.471 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)c1cc(C)co1 ZINC000880191674 590955813 /nfs/dbraw/zinc/95/58/13/590955813.db2.gz MZZOGHFBEZOKKD-SNVBAGLBSA-N 1 2 247.298 2.295 20 0 BEADLO CCc1nnc(C[NH+]2CCC(F)CC2)s1 ZINC000880238640 590971192 /nfs/dbraw/zinc/97/11/92/590971192.db2.gz JXWLGCXIJRGQKD-UHFFFAOYSA-N 1 2 229.324 2.034 20 0 BEADLO C[C@H](c1csnn1)[NH+]1CCC(F)CC1 ZINC000880240015 590973625 /nfs/dbraw/zinc/97/36/25/590973625.db2.gz WMZJSAAAYMGHBR-SSDOTTSWSA-N 1 2 215.297 2.033 20 0 BEADLO CCc1cnc(C[NH+]2CCC(F)CC2)o1 ZINC000880241868 590975128 /nfs/dbraw/zinc/97/51/28/590975128.db2.gz KLTRSFAEHFJEBT-UHFFFAOYSA-N 1 2 212.268 2.171 20 0 BEADLO COC(=O)c1occc1C[NH+]1CCC(F)CC1 ZINC000880242566 590975835 /nfs/dbraw/zinc/97/58/35/590975835.db2.gz DGAMBQNTZIWZFE-UHFFFAOYSA-N 1 2 241.262 2.000 20 0 BEADLO CCc1noc([C@@H](C)[NH+]2CCC(F)CC2)n1 ZINC000880242804 590977007 /nfs/dbraw/zinc/97/70/07/590977007.db2.gz LQLNTQAIURBZCI-MRVPVSSYSA-N 1 2 227.283 2.127 20 0 BEADLO CC(C)(C)c1noc(C[NH+]2CCC(F)CC2)n1 ZINC000880243619 590977062 /nfs/dbraw/zinc/97/70/62/590977062.db2.gz OKFQZEZKDFJDRO-UHFFFAOYSA-N 1 2 241.310 2.301 20 0 BEADLO CC(C)(C)c1nnc(C[N@@H+]2CC[C@@H](CF)C2)o1 ZINC000880292103 590983185 /nfs/dbraw/zinc/98/31/85/590983185.db2.gz VBXBYRNJBVDXMB-VIFPVBQESA-N 1 2 241.310 2.159 20 0 BEADLO CC(C)(C)c1nnc(C[N@H+]2CC[C@@H](CF)C2)o1 ZINC000880292103 590983188 /nfs/dbraw/zinc/98/31/88/590983188.db2.gz VBXBYRNJBVDXMB-VIFPVBQESA-N 1 2 241.310 2.159 20 0 BEADLO CCCCc1nc(C[N@@H+]2CC[C@H](CF)C2)no1 ZINC000880295010 590989724 /nfs/dbraw/zinc/98/97/24/590989724.db2.gz HDLRAIFCTNQYCE-SNVBAGLBSA-N 1 2 241.310 2.204 20 0 BEADLO CCCCc1nc(C[N@H+]2CC[C@H](CF)C2)no1 ZINC000880295010 590989729 /nfs/dbraw/zinc/98/97/29/590989729.db2.gz HDLRAIFCTNQYCE-SNVBAGLBSA-N 1 2 241.310 2.204 20 0 BEADLO CC[N@H+](Cc1ccon1)[C@@H](CO)c1ccccc1 ZINC000880461434 591050109 /nfs/dbraw/zinc/05/01/09/591050109.db2.gz JETPPLHKCIJLHH-AWEZNQCLSA-N 1 2 246.310 2.230 20 0 BEADLO CC[N@@H+](Cc1ccon1)[C@@H](CO)c1ccccc1 ZINC000880461434 591050114 /nfs/dbraw/zinc/05/01/14/591050114.db2.gz JETPPLHKCIJLHH-AWEZNQCLSA-N 1 2 246.310 2.230 20 0 BEADLO OC[C@@H]1C=CC[N@@H+]1Cc1cc(Cl)ccc1F ZINC000880488255 591064327 /nfs/dbraw/zinc/06/43/27/591064327.db2.gz ARLHOVKXMUOYAD-NSHDSACASA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@@H]1C=CC[N@H+]1Cc1cc(Cl)ccc1F ZINC000880488255 591064335 /nfs/dbraw/zinc/06/43/35/591064335.db2.gz ARLHOVKXMUOYAD-NSHDSACASA-N 1 2 241.693 2.212 20 0 BEADLO Cc1ccc(C(=O)Nc2cc[nH+]c(C)c2)nc1 ZINC000128694335 591151920 /nfs/dbraw/zinc/15/19/20/591151920.db2.gz LUFHONJERYFLRO-UHFFFAOYSA-N 1 2 227.267 2.346 20 0 BEADLO OC[C@H]1CCC[N@H+](C/C(Cl)=C\Cl)C1 ZINC000211362967 591162578 /nfs/dbraw/zinc/16/25/78/591162578.db2.gz LJJCDSSTSBJTKP-DHFUWRPHSA-N 1 2 224.131 2.010 20 0 BEADLO OC[C@H]1CCC[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000211362967 591162581 /nfs/dbraw/zinc/16/25/81/591162581.db2.gz LJJCDSSTSBJTKP-DHFUWRPHSA-N 1 2 224.131 2.010 20 0 BEADLO C[C@@H](Cn1cc(Cn2cc[nH+]c2)nn1)C(C)(C)C ZINC000881327218 591192527 /nfs/dbraw/zinc/19/25/27/591192527.db2.gz YLZQUQKYYASCTF-NSHDSACASA-N 1 2 247.346 2.205 20 0 BEADLO CC1(C)C[C@@]1(C)CNC(=O)CCCn1cc[nH+]c1 ZINC000881542996 591235852 /nfs/dbraw/zinc/23/58/52/591235852.db2.gz TXMDIBGXQXWPQT-AWEZNQCLSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@@H](CC(=O)NC[C@@]1(C)CC1(C)C)n1cc[nH+]c1 ZINC000881544653 591237005 /nfs/dbraw/zinc/23/70/05/591237005.db2.gz CUPVZHPJWDHKBS-SMDDNHRTSA-N 1 2 249.358 2.387 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NC[C@@]1(C)CC1(C)C ZINC000881545784 591237509 /nfs/dbraw/zinc/23/75/09/591237509.db2.gz OGIBFWQWTZEVPD-IINYFYTJSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NC[C@@]1(C)CC1(C)C ZINC000881545784 591237506 /nfs/dbraw/zinc/23/75/06/591237506.db2.gz OGIBFWQWTZEVPD-IINYFYTJSA-N 1 2 249.358 2.141 20 0 BEADLO Fc1c[nH+]ccc1NC[C@@H]1CC1(Cl)Cl ZINC000881769036 591269291 /nfs/dbraw/zinc/26/92/91/591269291.db2.gz HBJFAZSJFIDTOQ-LURJTMIESA-N 1 2 235.089 2.248 20 0 BEADLO Cc1[nH+]cnc(N(C)C[C@H]2CCCCO2)c1C ZINC000881835861 591274105 /nfs/dbraw/zinc/27/41/05/591274105.db2.gz KPZWXDWCTSQUOU-GFCCVEGCSA-N 1 2 235.331 2.099 20 0 BEADLO Cc1[nH+]cnc(NC[C@H]2CCCCO2)c1C ZINC000881846770 591274482 /nfs/dbraw/zinc/27/44/82/591274482.db2.gz WOGDODYQEXPWAY-LLVKDONJSA-N 1 2 221.304 2.074 20 0 BEADLO CSCCCNc1nc[nH+]c(C)c1C ZINC000881995712 591285917 /nfs/dbraw/zinc/28/59/17/591285917.db2.gz ULWBEWBXLQNHCA-UHFFFAOYSA-N 1 2 211.334 2.258 20 0 BEADLO Cc1[nH+]cnc(N2CCC(OC(C)C)CC2)c1C ZINC000881956535 591284135 /nfs/dbraw/zinc/28/41/35/591284135.db2.gz RTCLMAWAUINSPY-UHFFFAOYSA-N 1 2 249.358 2.487 20 0 BEADLO CCC[C@](C)(O)CNc1nc[nH+]c(C)c1C ZINC000881977819 591284838 /nfs/dbraw/zinc/28/48/38/591284838.db2.gz SNFYYTMBRDCFPO-LBPRGKRZSA-N 1 2 223.320 2.056 20 0 BEADLO Cc1[nH+]cnc(N(C)CCCOC(C)C)c1C ZINC000882005505 591287825 /nfs/dbraw/zinc/28/78/25/591287825.db2.gz BVWBNRSUFIXPEH-UHFFFAOYSA-N 1 2 237.347 2.345 20 0 BEADLO Cc1cnc(CNc2nc[nH+]c(C)c2C)s1 ZINC000882026174 591288877 /nfs/dbraw/zinc/28/88/77/591288877.db2.gz YCVOTOVFGDJVJM-UHFFFAOYSA-N 1 2 234.328 2.470 20 0 BEADLO CSC(C)(C)CNc1cc(CO)cc[nH+]1 ZINC000882039142 591291035 /nfs/dbraw/zinc/29/10/35/591291035.db2.gz KSUGWTKVRSKYMW-UHFFFAOYSA-N 1 2 226.345 2.127 20 0 BEADLO Cc1[nH+]cnc(NC[C@]2(C)CCCO2)c1C ZINC000882077154 591294513 /nfs/dbraw/zinc/29/45/13/591294513.db2.gz ARPOYYMDMWONED-LBPRGKRZSA-N 1 2 221.304 2.074 20 0 BEADLO Cn1c[nH+]c(CSc2nccn2C2CC2)c1 ZINC000882091014 591295874 /nfs/dbraw/zinc/29/58/74/591295874.db2.gz LJORTVKNRRQRMB-UHFFFAOYSA-N 1 2 234.328 2.244 20 0 BEADLO Cc1[nH+]cnc(NCc2cccc(F)n2)c1C ZINC000882123691 591301505 /nfs/dbraw/zinc/30/15/05/591301505.db2.gz IFTLWVFONPNLQF-UHFFFAOYSA-N 1 2 232.262 2.240 20 0 BEADLO Cc1c[nH+]ccc1CCNc1ncnc(C)c1C ZINC000882132805 591303240 /nfs/dbraw/zinc/30/32/40/591303240.db2.gz QUQPSKQPZYHDNS-UHFFFAOYSA-N 1 2 242.326 2.451 20 0 BEADLO Cc1[nH+]cnc(NCCOCC2CCC2)c1C ZINC000882193358 591313964 /nfs/dbraw/zinc/31/39/64/591313964.db2.gz PHZUUJGJNGJWDY-UHFFFAOYSA-N 1 2 235.331 2.322 20 0 BEADLO Cc1[nH+]cnc(NC[C@H]2CCC=CO2)c1C ZINC000882229488 591317735 /nfs/dbraw/zinc/31/77/35/591317735.db2.gz MQQRQAULRWUGMG-LLVKDONJSA-N 1 2 219.288 2.198 20 0 BEADLO C[C@@H]1CC[C@@H](Nc2cc(CO)cc[nH+]2)C1 ZINC000882228927 591317793 /nfs/dbraw/zinc/31/77/93/591317793.db2.gz GIFYAVGETHNDRA-MWLCHTKSSA-N 1 2 206.289 2.174 20 0 BEADLO CO[C@@]1(C)CCCN(c2nc[nH+]c(C)c2C)CC1 ZINC000882289375 591326661 /nfs/dbraw/zinc/32/66/61/591326661.db2.gz ZCYSKTODRJQAQP-AWEZNQCLSA-N 1 2 249.358 2.489 20 0 BEADLO CS[C@H]1CCN(c2nc[nH+]c(C)c2C)C1 ZINC000882412019 591344483 /nfs/dbraw/zinc/34/44/83/591344483.db2.gz UTOODRQTVMWHFO-JTQLQIEISA-N 1 2 223.345 2.035 20 0 BEADLO CCc1nc(CNc2nc[nH+]c(C)c2C)co1 ZINC000882427223 591346955 /nfs/dbraw/zinc/34/69/55/591346955.db2.gz GGCKXMJUGVDRNW-UHFFFAOYSA-N 1 2 232.287 2.256 20 0 BEADLO Cc1[nH+]cnc(NCCC[C@H]2CCOC2)c1C ZINC000882430948 591347768 /nfs/dbraw/zinc/34/77/68/591347768.db2.gz SLHUEMDURGWOSU-LBPRGKRZSA-N 1 2 235.331 2.322 20 0 BEADLO Cc1ncnc(N[C@H](C)c2[nH+]ccn2C)c1C ZINC000882625822 591402707 /nfs/dbraw/zinc/40/27/07/591402707.db2.gz OPFLMYMHHGDLJS-SNVBAGLBSA-N 1 2 231.303 2.000 20 0 BEADLO Cc1[nH+]cnc(NCC(C)(C)n2cccn2)c1C ZINC000882625109 591402738 /nfs/dbraw/zinc/40/27/38/591402738.db2.gz ADOBVCJWNXUCEO-UHFFFAOYSA-N 1 2 245.330 2.137 20 0 BEADLO Cc1[nH+]cnc(N2CCC(=O)CC(C)(C)C2)c1C ZINC000882652297 591406838 /nfs/dbraw/zinc/40/68/38/591406838.db2.gz QUBGUHPIOSFMBI-UHFFFAOYSA-N 1 2 247.342 2.289 20 0 BEADLO COCCC1CCN(c2nc[nH+]c(C)c2C)CC1 ZINC000882649277 591406873 /nfs/dbraw/zinc/40/68/73/591406873.db2.gz ZDFCOJJLDLXEKP-UHFFFAOYSA-N 1 2 249.358 2.346 20 0 BEADLO Cc1[nH+]cnc(N2CC(Cc3ccco3)C2)c1C ZINC000882652817 591407288 /nfs/dbraw/zinc/40/72/88/591407288.db2.gz KMLCVKMTLQEVIY-UHFFFAOYSA-N 1 2 243.310 2.365 20 0 BEADLO Cc1nocc1CNc1nc[nH+]c(C)c1C ZINC000882678763 591410625 /nfs/dbraw/zinc/41/06/25/591410625.db2.gz ZYKYINPREPBHAH-UHFFFAOYSA-N 1 2 218.260 2.002 20 0 BEADLO Cc1[nH+]cnc(NC[C@@H]2C[C@H]3CCC[C@@H]3O2)c1C ZINC000882714999 591418303 /nfs/dbraw/zinc/41/83/03/591418303.db2.gz GODIJULETMSRAO-AGIUHOORSA-N 1 2 247.342 2.463 20 0 BEADLO CCC[C@@H](C)CCNc1nc(C)[nH+]c(N)n1 ZINC000882777849 591436265 /nfs/dbraw/zinc/43/62/65/591436265.db2.gz UIADMJGVOLRCDK-MRVPVSSYSA-N 1 2 223.324 2.000 20 0 BEADLO CCC[C@@H](C)CCNc1nc(N)nc(C)[nH+]1 ZINC000882777849 591436266 /nfs/dbraw/zinc/43/62/66/591436266.db2.gz UIADMJGVOLRCDK-MRVPVSSYSA-N 1 2 223.324 2.000 20 0 BEADLO COc1ccc[nH+]c1N1CCC(F)CC1 ZINC000882804326 591445008 /nfs/dbraw/zinc/44/50/08/591445008.db2.gz BFQFOYBZEDSHED-UHFFFAOYSA-N 1 2 210.252 2.029 20 0 BEADLO CC(C)c1nc(N2CC[C@@H](CF)C2)cc[nH+]1 ZINC000882842169 591452063 /nfs/dbraw/zinc/45/20/63/591452063.db2.gz OYJOBCQXZWRBFC-JTQLQIEISA-N 1 2 223.295 2.396 20 0 BEADLO Cc1cc(N2CC[C@@H](c3nccs3)C2)nc[nH+]1 ZINC000882855237 591454275 /nfs/dbraw/zinc/45/42/75/591454275.db2.gz DWRGRBBUISLGBV-SNVBAGLBSA-N 1 2 246.339 2.235 20 0 BEADLO Cc1cc(N2CCC3(CCCCO3)CC2)nc[nH+]1 ZINC000882949319 591482789 /nfs/dbraw/zinc/48/27/89/591482789.db2.gz LCISMYGTUKOIQE-UHFFFAOYSA-N 1 2 247.342 2.325 20 0 BEADLO Cc1cc(NC2CCC3(COC3)CC2)nc[nH+]1 ZINC000882994441 591499084 /nfs/dbraw/zinc/49/90/84/591499084.db2.gz GLFXHHYXSMBFRG-UHFFFAOYSA-N 1 2 233.315 2.156 20 0 BEADLO CCn1cc(C[NH2+]Cc2nc(C(C)C)c[nH]2)cn1 ZINC000883011087 591511495 /nfs/dbraw/zinc/51/14/95/591511495.db2.gz JQXIHRRUGVAKHW-UHFFFAOYSA-N 1 2 247.346 2.039 20 0 BEADLO CC(C)c1c[nH]c(C[NH2+][C@@H](C)c2cnn(C)c2)n1 ZINC000883017069 591515871 /nfs/dbraw/zinc/51/58/71/591515871.db2.gz VUWKYQFIAQGEDP-JTQLQIEISA-N 1 2 247.346 2.117 20 0 BEADLO CCc1noc(CC)c1C[NH2+]Cc1cc(C)on1 ZINC000883035725 591522747 /nfs/dbraw/zinc/52/27/47/591522747.db2.gz MZDFQQSSAYJVSF-UHFFFAOYSA-N 1 2 249.314 2.386 20 0 BEADLO Cc1cc(NCc2[nH]cc(C(C)C)[nH+]2)nn1C ZINC000883073456 591535298 /nfs/dbraw/zinc/53/52/98/591535298.db2.gz QLXUIAMURSUJNX-UHFFFAOYSA-N 1 2 233.319 2.187 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)c2ccc[nH]2)no1 ZINC000883077473 591535739 /nfs/dbraw/zinc/53/57/39/591535739.db2.gz LHESOQWUCZOHKV-SECBINFHSA-N 1 2 205.261 2.162 20 0 BEADLO CSc1ccc(C[NH2+][C@@H]2CCn3ccnc32)o1 ZINC000883131509 591546482 /nfs/dbraw/zinc/54/64/82/591546482.db2.gz FTDBGBAYHDGCTJ-SNVBAGLBSA-N 1 2 249.339 2.433 20 0 BEADLO CCC[C@@H](C)CNc1cc(CO)cc[nH+]1 ZINC000883147573 591552464 /nfs/dbraw/zinc/55/24/64/591552464.db2.gz ADGVVNLCHZFFEE-SNVBAGLBSA-N 1 2 208.305 2.422 20 0 BEADLO CCn1ccc(NCc2[nH]cc(C(C)C)[nH+]2)n1 ZINC000883166480 591558128 /nfs/dbraw/zinc/55/81/28/591558128.db2.gz AMIOHCLLUJXUKN-UHFFFAOYSA-N 1 2 233.319 2.362 20 0 BEADLO Cc1cc(NC(=O)c2cccc(F)n2)cc[nH+]1 ZINC000131317014 591590190 /nfs/dbraw/zinc/59/01/90/591590190.db2.gz GGFIBSVQTJNIJQ-UHFFFAOYSA-N 1 2 231.230 2.176 20 0 BEADLO Cc1cnn(C)c1CNc1c[nH+]c(C)c(C)c1 ZINC000883340884 591619690 /nfs/dbraw/zinc/61/96/90/591619690.db2.gz BQPRIDYYKSCTNI-UHFFFAOYSA-N 1 2 230.315 2.352 20 0 BEADLO Cc1cc(N[C@H]2CO[C@H](C)C2)c[nH+]c1C ZINC000883341139 591620025 /nfs/dbraw/zinc/62/00/25/591620025.db2.gz JGLGUARVEAVUQX-BXKDBHETSA-N 1 2 206.289 2.288 20 0 BEADLO Cc1cc(NCc2cc3n(n2)CCC3)c[nH+]c1C ZINC000883341343 591620285 /nfs/dbraw/zinc/62/02/85/591620285.db2.gz NWDPSDRGFHCZAN-UHFFFAOYSA-N 1 2 242.326 2.453 20 0 BEADLO Cc1cc(N[C@@H]2CCCOC2)c[nH+]c1C ZINC000883342451 591621835 /nfs/dbraw/zinc/62/18/35/591621835.db2.gz YPDJHXOEEFMDGW-LLVKDONJSA-N 1 2 206.289 2.289 20 0 BEADLO Cc1cc(N[C@H]2CCCOC2)c[nH+]c1C ZINC000883342452 591622013 /nfs/dbraw/zinc/62/20/13/591622013.db2.gz YPDJHXOEEFMDGW-NSHDSACASA-N 1 2 206.289 2.289 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]C[C@@H]1CCC2(CCC2)O1 ZINC000883356116 591627673 /nfs/dbraw/zinc/62/76/73/591627673.db2.gz GAYWIELZOKGCAL-PWSUYJOCSA-N 1 2 249.358 2.470 20 0 BEADLO Cc1cc2ccccc2[nH+]c1NCC[S@@](C)=O ZINC000133202948 591778967 /nfs/dbraw/zinc/77/89/67/591778967.db2.gz RQJBJBCQJCLXFE-KRWDZBQOSA-N 1 2 248.351 2.334 20 0 BEADLO Cc1nc(N[C@@H](C)C[C@@H](O)c2ccco2)cc[nH+]1 ZINC000133669527 591845756 /nfs/dbraw/zinc/84/57/56/591845756.db2.gz BUHQDFBAXHFZGU-GXSJLCMTSA-N 1 2 247.298 2.302 20 0 BEADLO CCSCCC[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000133691661 591848191 /nfs/dbraw/zinc/84/81/91/591848191.db2.gz BVOZIOJTEDDAEP-JTQLQIEISA-N 1 2 247.404 2.449 20 0 BEADLO CCc1nc(N2C[C@@H](C3CC3)O[C@@H](C)C2)cc[nH+]1 ZINC000884492176 591956201 /nfs/dbraw/zinc/95/62/01/591956201.db2.gz OMBMYJBZRTWLHW-JQWIXIFHSA-N 1 2 247.342 2.043 20 0 BEADLO CCc1nc(N2CCCCC[C@H]2CCO)cc[nH+]1 ZINC000884500146 591957664 /nfs/dbraw/zinc/95/76/64/591957664.db2.gz YAOKCEVMBCODNZ-LBPRGKRZSA-N 1 2 249.358 2.170 20 0 BEADLO CCc1nc(NCC(C)(F)F)cc[nH+]1 ZINC000884516170 591962729 /nfs/dbraw/zinc/96/27/29/591962729.db2.gz DELYRCJUZUBJIU-UHFFFAOYSA-N 1 2 201.220 2.106 20 0 BEADLO CCc1nc(NC[C@@]2(O)CCC[C@H]2C)cc[nH+]1 ZINC000884516181 591963013 /nfs/dbraw/zinc/96/30/13/591963013.db2.gz DPRSKHMAOMKWNC-MFKMUULPSA-N 1 2 235.331 2.002 20 0 BEADLO CCc1nc(N[C@H](C)CC(C)(C)O)cc[nH+]1 ZINC000884520565 591964667 /nfs/dbraw/zinc/96/46/67/591964667.db2.gz YXMUJCAVWKXHAZ-SECBINFHSA-N 1 2 223.320 2.000 20 0 BEADLO CCc1nc(NC[C@@](C)(CC)OC)cc[nH+]1 ZINC000884521468 591964851 /nfs/dbraw/zinc/96/48/51/591964851.db2.gz XWEUCVZMFWMRSF-GFCCVEGCSA-N 1 2 223.320 2.266 20 0 BEADLO CCc1nc(N[C@@H]2C[C@H](C)n3ccnc32)cc[nH+]1 ZINC000884522635 591965395 /nfs/dbraw/zinc/96/53/95/591965395.db2.gz DEOLGYVIXIWVLG-VHSXEESVSA-N 1 2 243.314 2.353 20 0 BEADLO CCc1nc(N[C@H]2C[C@@H](C)n3ccnc32)cc[nH+]1 ZINC000884522636 591965610 /nfs/dbraw/zinc/96/56/10/591965610.db2.gz DEOLGYVIXIWVLG-ZJUUUORDSA-N 1 2 243.314 2.353 20 0 BEADLO CCc1nc(N[C@H](C)c2nccn2CC)cc[nH+]1 ZINC000884523152 591965631 /nfs/dbraw/zinc/96/56/31/591965631.db2.gz QXGIODZQWWETRC-SNVBAGLBSA-N 1 2 245.330 2.429 20 0 BEADLO CCO[C@@H]1CCC[C@H]1Nc1cc[nH+]c(CC)n1 ZINC000884525152 591965693 /nfs/dbraw/zinc/96/56/93/591965693.db2.gz ODTLMIKYUYOASZ-GHMZBOCLSA-N 1 2 235.331 2.409 20 0 BEADLO CCc1nc(N[C@@H](C)[C@H](OC)C2CC2)cc[nH+]1 ZINC000884524475 591965966 /nfs/dbraw/zinc/96/59/66/591965966.db2.gz YPJOLFQFUIVUHM-ZANVPECISA-N 1 2 235.331 2.264 20 0 BEADLO CCc1nc(N[C@@H](C)c2cnn(CC)c2)cc[nH+]1 ZINC000884524196 591966028 /nfs/dbraw/zinc/96/60/28/591966028.db2.gz RDUJPXWVMDCMEH-JTQLQIEISA-N 1 2 245.330 2.429 20 0 BEADLO CCc1nc(N[C@@H](C)C2(OC)CCC2)cc[nH+]1 ZINC000884531313 591968489 /nfs/dbraw/zinc/96/84/89/591968489.db2.gz JEQJPLDHDSZKNU-JTQLQIEISA-N 1 2 235.331 2.409 20 0 BEADLO CCc1nc(NC[C@@H]2C[C@@H](C)O[C@H]2C)cc[nH+]1 ZINC000884530230 591969097 /nfs/dbraw/zinc/96/90/97/591969097.db2.gz HVRAIKJZYWATCR-VWYCJHECSA-N 1 2 235.331 2.264 20 0 BEADLO CCc1nc(N[C@@H]2CCC[C@H](CO)C2)cc[nH+]1 ZINC000884532249 591969881 /nfs/dbraw/zinc/96/98/81/591969881.db2.gz FVHJEYBNQLTVAQ-WDEREUQCSA-N 1 2 235.331 2.002 20 0 BEADLO CCc1nc(N2CC[C@@H]2C(F)(F)F)cc[nH+]1 ZINC000884551349 591976595 /nfs/dbraw/zinc/97/65/95/591976595.db2.gz YAWOLJREUYNOQT-SSDOTTSWSA-N 1 2 231.221 2.180 20 0 BEADLO CCc1nc(N2CCC[C@H](C)[C@H]2CCO)cc[nH+]1 ZINC000884554868 591977664 /nfs/dbraw/zinc/97/76/64/591977664.db2.gz DXWSNWIKXFKGFU-NWDGAFQWSA-N 1 2 249.358 2.026 20 0 BEADLO CCc1nc(NCCc2ccoc2)cc[nH+]1 ZINC000884557691 591978241 /nfs/dbraw/zinc/97/82/41/591978241.db2.gz WQOBZINUWUITRH-UHFFFAOYSA-N 1 2 217.272 2.287 20 0 BEADLO CCc1nc(N(C)CC2=CCSC2)cc[nH+]1 ZINC000884561028 591980096 /nfs/dbraw/zinc/98/00/96/591980096.db2.gz NOARJVJZACFGNM-UHFFFAOYSA-N 1 2 235.356 2.148 20 0 BEADLO CCc1nc(NCC(F)(F)CC)cc[nH+]1 ZINC000884564859 591982706 /nfs/dbraw/zinc/98/27/06/591982706.db2.gz SDIUFYZMFMUGRH-UHFFFAOYSA-N 1 2 215.247 2.496 20 0 BEADLO CCc1nc(N2CC(OC(C)(C)C)C2)cc[nH+]1 ZINC000884575086 591984495 /nfs/dbraw/zinc/98/44/95/591984495.db2.gz BIARMEMAXQUUIZ-UHFFFAOYSA-N 1 2 235.331 2.043 20 0 BEADLO CCc1nc(N2CC[C@H]3CSC[C@@H]3C2)cc[nH+]1 ZINC000884573904 591984610 /nfs/dbraw/zinc/98/46/10/591984610.db2.gz XFDLALCOGFMQCZ-QWRGUYRKSA-N 1 2 249.383 2.228 20 0 BEADLO CCc1nc(N2CCC(C(C)(C)O)CC2)cc[nH+]1 ZINC000884574780 591984930 /nfs/dbraw/zinc/98/49/30/591984930.db2.gz SUBHHASWEPXSSU-UHFFFAOYSA-N 1 2 249.358 2.026 20 0 BEADLO CCc1nc(N[C@H](C)C(F)F)cc[nH+]1 ZINC000884583376 591987791 /nfs/dbraw/zinc/98/77/91/591987791.db2.gz BIHTYDWVDHUVLP-ZCFIWIBFSA-N 1 2 201.220 2.105 20 0 BEADLO Cn1c2ccccc2[nH+]c1N1C[C@@H]2C[C@@H]2C1 ZINC000884590414 591989479 /nfs/dbraw/zinc/98/94/79/591989479.db2.gz VLNCUGHHDJOQDS-AOOOYVTPSA-N 1 2 213.284 2.029 20 0 BEADLO O=C(C[C@@H]1C[C@H]1C1CC1)OCCCn1cc[nH+]c1 ZINC000884640504 592001084 /nfs/dbraw/zinc/00/10/84/592001084.db2.gz HKNIJYBNYWYKGT-STQMWFEESA-N 1 2 248.326 2.253 20 0 BEADLO COc1ccc[nH+]c1N1CC[C@@H]([C@H]2CCCO2)C1 ZINC000884742671 592016227 /nfs/dbraw/zinc/01/62/27/592016227.db2.gz UMSQYHNGJXZAAO-VXGBXAGGSA-N 1 2 248.326 2.096 20 0 BEADLO Fc1c[nH+]ccc1N1CC[C@@H]([C@@H]2CCCO2)C1 ZINC000884743423 592016554 /nfs/dbraw/zinc/01/65/54/592016554.db2.gz YJMAHUZLBIJASC-MFKMUULPSA-N 1 2 236.290 2.226 20 0 BEADLO Cc1nc(NCC2(C3(O)CCC3)CCC2)cc[nH+]1 ZINC000884807715 592017894 /nfs/dbraw/zinc/01/78/94/592017894.db2.gz GPQVFSBJDSPAFX-UHFFFAOYSA-N 1 2 247.342 2.282 20 0 BEADLO CC(C)c1nc(N(C)CCCF)cc[nH+]1 ZINC000884857472 592026056 /nfs/dbraw/zinc/02/60/56/592026056.db2.gz YPYHSSQUARXZEE-UHFFFAOYSA-N 1 2 211.284 2.396 20 0 BEADLO CC[NH2+]Cc1noc(C2CCC(F)(F)CC2)n1 ZINC000216536225 592050957 /nfs/dbraw/zinc/05/09/57/592050957.db2.gz YISZFXMJVFRZKM-UHFFFAOYSA-N 1 2 245.273 2.472 20 0 BEADLO C[C@@H]1C[N@@H+](CCSC(F)(F)F)C[C@H](C)O1 ZINC000885931353 592109888 /nfs/dbraw/zinc/10/98/88/592109888.db2.gz RUVZZHWZCZUUKQ-OCAPTIKFSA-N 1 2 243.294 2.349 20 0 BEADLO C[C@@H]1C[N@H+](CCSC(F)(F)F)C[C@H](C)O1 ZINC000885931353 592109891 /nfs/dbraw/zinc/10/98/91/592109891.db2.gz RUVZZHWZCZUUKQ-OCAPTIKFSA-N 1 2 243.294 2.349 20 0 BEADLO C(CN1CC[NH+](C2CC2)CC1)[C@@H]1C[C@H]1C1CC1 ZINC000885967598 592118015 /nfs/dbraw/zinc/11/80/15/592118015.db2.gz TXYTZUGYNSINEV-HIFRSBDPSA-N 1 2 234.387 2.203 20 0 BEADLO C[C@H](CC(=O)NC[C@]12C[C@H]1CCC2)n1cc[nH+]c1 ZINC000885991721 592123315 /nfs/dbraw/zinc/12/33/15/592123315.db2.gz QYBDUFDAQDEZSS-BZPMIXESSA-N 1 2 247.342 2.141 20 0 BEADLO FC(F)C[N@H+](C[C@H]1C[C@]12CCOC2)C1CC1 ZINC000886002077 592127474 /nfs/dbraw/zinc/12/74/74/592127474.db2.gz QCEIRGJSXDAMKA-SKDRFNHKSA-N 1 2 231.286 2.143 20 0 BEADLO FC(F)C[N@@H+](C[C@H]1C[C@]12CCOC2)C1CC1 ZINC000886002077 592127477 /nfs/dbraw/zinc/12/74/77/592127477.db2.gz QCEIRGJSXDAMKA-SKDRFNHKSA-N 1 2 231.286 2.143 20 0 BEADLO O=C(CCn1cc[nH+]c1)NCC1CCC=CCC1 ZINC000886021806 592134134 /nfs/dbraw/zinc/13/41/34/592134134.db2.gz IZDBCAAEZJWELF-UHFFFAOYSA-N 1 2 247.342 2.136 20 0 BEADLO CCc1nnc([C@H](C)[NH2+]Cc2cc(C)co2)[nH]1 ZINC000886052326 592141325 /nfs/dbraw/zinc/14/13/25/592141325.db2.gz OOOOWFWNZCPVBH-VIFPVBQESA-N 1 2 234.303 2.119 20 0 BEADLO Cc1coc(C[NH2+]Cc2nnc(C(C)(C)C)[nH]2)c1 ZINC000886142763 592162545 /nfs/dbraw/zinc/16/25/45/592162545.db2.gz KKWMRGQLSIZTKI-UHFFFAOYSA-N 1 2 248.330 2.293 20 0 BEADLO c1cnc2c(c1)C[N@@H+](C[C@@H]1CC[C@H](C3CC3)O1)C2 ZINC000886186213 592172633 /nfs/dbraw/zinc/17/26/33/592172633.db2.gz SCYRIOGXHXLMQY-DZGCQCFKSA-N 1 2 244.338 2.355 20 0 BEADLO c1cnc2c(c1)C[N@H+](C[C@@H]1CC[C@H](C3CC3)O1)C2 ZINC000886186213 592172635 /nfs/dbraw/zinc/17/26/35/592172635.db2.gz SCYRIOGXHXLMQY-DZGCQCFKSA-N 1 2 244.338 2.355 20 0 BEADLO Cc1[nH]nc(NCc2c[nH+]cn2C(C)C)c1C ZINC000886197753 592174292 /nfs/dbraw/zinc/17/42/92/592174292.db2.gz LCTLCVSTXXNSPS-UHFFFAOYSA-N 1 2 233.319 2.416 20 0 BEADLO Cc1ncccc1C[NH2+][C@H](C)c1ncco1 ZINC000886273535 592193776 /nfs/dbraw/zinc/19/37/76/592193776.db2.gz BBITZRJDZVLOQS-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO Cc1noc(C)c1C[NH2+][C@H](C)c1ncco1 ZINC000886275875 592195861 /nfs/dbraw/zinc/19/58/61/592195861.db2.gz PEDWQSKCFFHHDR-MRVPVSSYSA-N 1 2 221.260 2.130 20 0 BEADLO c1cc(-c2nc(C[N@@H+]3C[C@@H]4C[C@@H]4C3)no2)cs1 ZINC000886329031 592210188 /nfs/dbraw/zinc/21/01/88/592210188.db2.gz WXOXBXMDXJQWNO-AOOOYVTPSA-N 1 2 247.323 2.250 20 0 BEADLO c1cc(-c2nc(C[N@H+]3C[C@@H]4C[C@@H]4C3)no2)cs1 ZINC000886329031 592210190 /nfs/dbraw/zinc/21/01/90/592210190.db2.gz WXOXBXMDXJQWNO-AOOOYVTPSA-N 1 2 247.323 2.250 20 0 BEADLO COC(=O)C[NH2+][C@H](Cc1ccccc1)C(C)C ZINC000886422242 592224284 /nfs/dbraw/zinc/22/42/84/592224284.db2.gz IXMQWUADBXZHCJ-CYBMUJFWSA-N 1 2 235.327 2.016 20 0 BEADLO Cc1ccccc1[C@@H](CO)[N@H+](C)Cc1ccon1 ZINC000886434007 592225630 /nfs/dbraw/zinc/22/56/30/592225630.db2.gz ZOEQKFMNPYZOKZ-CQSZACIVSA-N 1 2 246.310 2.148 20 0 BEADLO Cc1ccccc1[C@@H](CO)[N@@H+](C)Cc1ccon1 ZINC000886434007 592225632 /nfs/dbraw/zinc/22/56/32/592225632.db2.gz ZOEQKFMNPYZOKZ-CQSZACIVSA-N 1 2 246.310 2.148 20 0 BEADLO CCc1cc(C[NH2+][C@H]2CCc3cccnc32)on1 ZINC000886529961 592246984 /nfs/dbraw/zinc/24/69/84/592246984.db2.gz AUBCVDFNVSLURI-ZDUSSCGKSA-N 1 2 243.310 2.409 20 0 BEADLO C[C@@H]([NH2+]CCC(F)(F)F)c1ncco1 ZINC000886532044 592249246 /nfs/dbraw/zinc/24/92/46/592249246.db2.gz CEEKIZRSJDKUDS-ZCFIWIBFSA-N 1 2 208.183 2.278 20 0 BEADLO COC(=O)[C@H]1CC[C@@H]([NH2+]c2ccc(OC)cc2)C1 ZINC000886564227 592261604 /nfs/dbraw/zinc/26/16/04/592261604.db2.gz QLWKKMFWOKQQMT-CMPLNLGQSA-N 1 2 249.310 2.449 20 0 BEADLO COC(=O)[C@H]1CC[C@@H](Nc2c[nH+]cc(C)c2)C1 ZINC000886577905 592267527 /nfs/dbraw/zinc/26/75/27/592267527.db2.gz BIYUMNINFNDECX-WDEREUQCSA-N 1 2 234.299 2.144 20 0 BEADLO COC(=O)[C@H]1CC[C@@H](Nc2ccc(C)[nH+]c2)C1 ZINC000886577108 592267719 /nfs/dbraw/zinc/26/77/19/592267719.db2.gz XDOCANKBYOFSSE-WDEREUQCSA-N 1 2 234.299 2.144 20 0 BEADLO CCn1c[nH+]c2c1CCN(C(=O)CCC(C)C)C2 ZINC000886628856 592280600 /nfs/dbraw/zinc/28/06/00/592280600.db2.gz GYQYPGNUKDAIIE-UHFFFAOYSA-N 1 2 249.358 2.224 20 0 BEADLO Cc1ccc(N2CC[NH+](CCF)CC2)cc1 ZINC000221019551 592390379 /nfs/dbraw/zinc/39/03/79/592390379.db2.gz QNFAZABFZFAPCU-UHFFFAOYSA-N 1 2 222.307 2.087 20 0 BEADLO O=C(CC[N@@H+](CC(F)F)C1CCC1)C1CC1 ZINC000887100678 592441011 /nfs/dbraw/zinc/44/10/11/592441011.db2.gz LMUGNPNDGXVGAK-UHFFFAOYSA-N 1 2 231.286 2.475 20 0 BEADLO O=C(CC[N@H+](CC(F)F)C1CCC1)C1CC1 ZINC000887100678 592441015 /nfs/dbraw/zinc/44/10/15/592441015.db2.gz LMUGNPNDGXVGAK-UHFFFAOYSA-N 1 2 231.286 2.475 20 0 BEADLO CC(C)NC(=O)CC[N@H+](CC(F)F)C1CCC1 ZINC000887099055 592441596 /nfs/dbraw/zinc/44/15/96/592441596.db2.gz OZUKESUGIMPRKQ-UHFFFAOYSA-N 1 2 248.317 2.021 20 0 BEADLO CC(C)NC(=O)CC[N@@H+](CC(F)F)C1CCC1 ZINC000887099055 592441598 /nfs/dbraw/zinc/44/15/98/592441598.db2.gz OZUKESUGIMPRKQ-UHFFFAOYSA-N 1 2 248.317 2.021 20 0 BEADLO COC(CC[N@H+](CC(F)F)C1CCC1)OC ZINC000887102103 592443521 /nfs/dbraw/zinc/44/35/21/592443521.db2.gz CDEGXGSURQSCKT-UHFFFAOYSA-N 1 2 237.290 2.115 20 0 BEADLO COC(CC[N@@H+](CC(F)F)C1CCC1)OC ZINC000887102103 592443522 /nfs/dbraw/zinc/44/35/22/592443522.db2.gz CDEGXGSURQSCKT-UHFFFAOYSA-N 1 2 237.290 2.115 20 0 BEADLO C[N@H+](CCCF)Cc1nc(C2CCC2)no1 ZINC000887142235 592457784 /nfs/dbraw/zinc/45/77/84/592457784.db2.gz BIIGDVOGJHJPAO-UHFFFAOYSA-N 1 2 227.283 2.129 20 0 BEADLO C[N@@H+](CCCF)Cc1nc(C2CCC2)no1 ZINC000887142235 592457787 /nfs/dbraw/zinc/45/77/87/592457787.db2.gz BIIGDVOGJHJPAO-UHFFFAOYSA-N 1 2 227.283 2.129 20 0 BEADLO COC(=O)[C@@H](c1ccsc1)[N@H+](C)CCCF ZINC000887142739 592459350 /nfs/dbraw/zinc/45/93/50/592459350.db2.gz YBNFOAHVIXQITI-SNVBAGLBSA-N 1 2 245.319 2.254 20 0 BEADLO COC(=O)[C@@H](c1ccsc1)[N@@H+](C)CCCF ZINC000887142739 592459354 /nfs/dbraw/zinc/45/93/54/592459354.db2.gz YBNFOAHVIXQITI-SNVBAGLBSA-N 1 2 245.319 2.254 20 0 BEADLO CC(C)(CNC(=O)CNc1cccc[nH+]1)C1CC1 ZINC000887370400 592494552 /nfs/dbraw/zinc/49/45/52/592494552.db2.gz QVQGAGGBIWDHDO-UHFFFAOYSA-N 1 2 247.342 2.046 20 0 BEADLO CC(C)(CNC(=O)CCCn1cc[nH+]c1)C1CC1 ZINC000887377934 592498008 /nfs/dbraw/zinc/49/80/08/592498008.db2.gz JZSZOLMDZGACPG-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1ccc(NC(=O)N2C[C@@H]3C[C@@H]3C2)c(C)[nH+]1 ZINC000887878514 592555809 /nfs/dbraw/zinc/55/58/09/592555809.db2.gz HCGCWDOHXXBMLY-PHIMTYICSA-N 1 2 231.299 2.182 20 0 BEADLO CCc1cnc(NC(=O)C[C@H](C)n2cc[nH+]c2)o1 ZINC000889385529 592604148 /nfs/dbraw/zinc/60/41/48/592604148.db2.gz WLFQEPKZZZDMRW-VIFPVBQESA-N 1 2 248.286 2.023 20 0 BEADLO CCCCC1(NC(=O)CCn2cc[nH+]c2)CC1 ZINC000889531130 592618538 /nfs/dbraw/zinc/61/85/38/592618538.db2.gz JEOUNNPSKJYJLR-UHFFFAOYSA-N 1 2 235.331 2.112 20 0 BEADLO Cn1c[nH+]c(CNC(=O)C2(C)C(C)(C)C2(C)C)c1 ZINC000890100229 592678844 /nfs/dbraw/zinc/67/88/44/592678844.db2.gz SGJJKVUZMOJNOP-UHFFFAOYSA-N 1 2 249.358 2.109 20 0 BEADLO Cn1c[nH+]c(CNC(=O)[C@H]2CCC=CCCC2)c1 ZINC000890099828 592678863 /nfs/dbraw/zinc/67/88/63/592678863.db2.gz LBHLUCMTKUHKAE-LBPRGKRZSA-N 1 2 247.342 2.173 20 0 BEADLO Cn1c[nH+]c(CNC(=O)CC2(C)CCCC2)c1 ZINC000890107226 592681188 /nfs/dbraw/zinc/68/11/88/592681188.db2.gz KFGZRKGLQPJFMY-UHFFFAOYSA-N 1 2 235.331 2.007 20 0 BEADLO CC(C)C[C@H](C)CC(=O)NCc1cn(C)c[nH+]1 ZINC000890114126 592684108 /nfs/dbraw/zinc/68/41/08/592684108.db2.gz VCJRZPSIDMPSAE-NSHDSACASA-N 1 2 237.347 2.109 20 0 BEADLO Cn1c[nH+]c(CNC(=O)/C=C/C2CCCCC2)c1 ZINC000890113502 592684253 /nfs/dbraw/zinc/68/42/53/592684253.db2.gz GNASIDQCNKJAKU-BQYQJAHWSA-N 1 2 247.342 2.173 20 0 BEADLO C[C@H](CC1CCCC1)C(=O)NCc1cn(C)c[nH+]1 ZINC000890113377 592684318 /nfs/dbraw/zinc/68/43/18/592684318.db2.gz BBAMBOWJPJBWQP-LLVKDONJSA-N 1 2 249.358 2.253 20 0 BEADLO CCc1c[nH]c2nc[nH+]c(S[C@@H]3CCOC3)c12 ZINC000893471546 634517032 /nfs/dbraw/zinc/51/70/32/634517032.db2.gz GZDDBKXSCCKYGJ-SECBINFHSA-N 1 2 249.339 2.401 20 0 BEADLO C/C(Cl)=C/C(=O)NCc1c[nH+]c(C)cc1C ZINC000909391049 634598524 /nfs/dbraw/zinc/59/85/24/634598524.db2.gz OPJANLVGWUZFOG-UITAMQMPSA-N 1 2 238.718 2.457 20 0 BEADLO Nc1cc(COC(=O)C[C@@H]2CC=CCC2)cc[nH+]1 ZINC000924243861 635531641 /nfs/dbraw/zinc/53/16/41/635531641.db2.gz ACDGMFKJVUGUQY-LLVKDONJSA-N 1 2 246.310 2.453 20 0 BEADLO O=C(C[C@@H]1CC=CCC1)OCCn1cc[nH+]c1 ZINC000924244760 635539131 /nfs/dbraw/zinc/53/91/31/635539131.db2.gz HPDMQZMTCDCJMZ-GFCCVEGCSA-N 1 2 234.299 2.173 20 0 BEADLO CCCC(CCC)C(=O)NCc1ccc(N)[nH+]c1 ZINC000308382957 631243983 /nfs/dbraw/zinc/24/39/83/631243983.db2.gz YNDLFEBRVMCPFM-UHFFFAOYSA-N 1 2 249.358 2.496 20 0 BEADLO COC[C@@H]1COCC[N@@H+]1C/C=C/c1ccccc1 ZINC000933334151 631270994 /nfs/dbraw/zinc/27/09/94/631270994.db2.gz DYYUJSXECBZVER-SBJJXXPASA-N 1 2 247.338 2.047 20 0 BEADLO COC[C@@H]1COCC[N@H+]1C/C=C/c1ccccc1 ZINC000933334151 631270999 /nfs/dbraw/zinc/27/09/99/631270999.db2.gz DYYUJSXECBZVER-SBJJXXPASA-N 1 2 247.338 2.047 20 0 BEADLO Cc1ncc(C[N@@H+](C)Cc2cccc(=O)[nH]2)s1 ZINC000933396373 631359407 /nfs/dbraw/zinc/35/94/07/631359407.db2.gz WIPKUPVVEDBGKH-UHFFFAOYSA-N 1 2 249.339 2.184 20 0 BEADLO Cc1ncc(C[N@H+](C)Cc2cccc(=O)[nH]2)s1 ZINC000933396373 631359412 /nfs/dbraw/zinc/35/94/12/631359412.db2.gz WIPKUPVVEDBGKH-UHFFFAOYSA-N 1 2 249.339 2.184 20 0 BEADLO CCC[C@H](C)N(C)c1nccn2c[nH+]cc12 ZINC000891809507 631498506 /nfs/dbraw/zinc/49/85/06/631498506.db2.gz NRWBKXUYQKIBRB-JTQLQIEISA-N 1 2 218.304 2.354 20 0 BEADLO C[C@H]1CN(C(=O)c2cc3c[nH+]ccc3[nH]2)C[C@@H]1C ZINC000933818667 631515680 /nfs/dbraw/zinc/51/56/80/631515680.db2.gz XHVRKXNSPALPJD-UWVGGRQHSA-N 1 2 243.310 2.291 20 0 BEADLO C[C@@H](O)c1ccc(OCc2c[nH+]cn2C)cc1 ZINC000091278649 631538180 /nfs/dbraw/zinc/53/81/80/631538180.db2.gz BUUMMIKFDXOCOF-SNVBAGLBSA-N 1 2 232.283 2.052 20 0 BEADLO C[C@H](O)c1ccc(OCc2c[nH+]cn2C)cc1 ZINC000091278648 631539246 /nfs/dbraw/zinc/53/92/46/631539246.db2.gz BUUMMIKFDXOCOF-JTQLQIEISA-N 1 2 232.283 2.052 20 0 BEADLO OC[C@@H]1CC[N@@H+]1Cc1c(F)cccc1Cl ZINC000934014093 631593898 /nfs/dbraw/zinc/59/38/98/631593898.db2.gz KSYUGGVAPCXUFL-QMMMGPOBSA-N 1 2 229.682 2.046 20 0 BEADLO OC[C@@H]1CC[N@H+]1Cc1c(F)cccc1Cl ZINC000934014093 631593903 /nfs/dbraw/zinc/59/39/03/631593903.db2.gz KSYUGGVAPCXUFL-QMMMGPOBSA-N 1 2 229.682 2.046 20 0 BEADLO Fc1ncccc1CNc1cccc[nH+]1 ZINC000308852248 631695455 /nfs/dbraw/zinc/69/54/55/631695455.db2.gz DOYFQDNHYLCNBA-UHFFFAOYSA-N 1 2 203.220 2.228 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H](C)CSC(C)(C)C ZINC000308924738 631745821 /nfs/dbraw/zinc/74/58/21/631745821.db2.gz HXBZAHZGOBZVSO-IUCAKERBSA-N 1 2 233.377 2.058 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CC[C@@H]1C)C(=O)OC(C)(C)C ZINC000309087010 631875068 /nfs/dbraw/zinc/87/50/68/631875068.db2.gz YZDVNJGAMRPDCC-IVZWLZJFSA-N 1 2 213.321 2.105 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+]1CC[C@@H](O)[C@@H](F)C1 ZINC000934570624 631943963 /nfs/dbraw/zinc/94/39/63/631943963.db2.gz GAXDPVRTGGUGCE-QWHCGFSZSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cc(F)ccc1C[N@H+]1CC[C@@H](O)[C@@H](F)C1 ZINC000934570624 631943967 /nfs/dbraw/zinc/94/39/67/631943967.db2.gz GAXDPVRTGGUGCE-QWHCGFSZSA-N 1 2 241.281 2.039 20 0 BEADLO O[C@H]1CC[N@H+](Cc2cc3ccccc3o2)C[C@@H]1F ZINC000934575562 631946765 /nfs/dbraw/zinc/94/67/65/631946765.db2.gz KEBFSZIDGDBAKB-STQMWFEESA-N 1 2 249.285 2.338 20 0 BEADLO O[C@H]1CC[N@@H+](Cc2cc3ccccc3o2)C[C@@H]1F ZINC000934575562 631946770 /nfs/dbraw/zinc/94/67/70/631946770.db2.gz KEBFSZIDGDBAKB-STQMWFEESA-N 1 2 249.285 2.338 20 0 BEADLO O[C@@H]1CC[N@H+](C/C=C\c2ccccc2)C[C@H]1F ZINC000934581444 631950506 /nfs/dbraw/zinc/95/05/06/631950506.db2.gz IWOGTCPVCWCMOX-ALCJFRFOSA-N 1 2 235.302 2.105 20 0 BEADLO O[C@@H]1CC[N@@H+](C/C=C\c2ccccc2)C[C@H]1F ZINC000934581444 631950511 /nfs/dbraw/zinc/95/05/11/631950511.db2.gz IWOGTCPVCWCMOX-ALCJFRFOSA-N 1 2 235.302 2.105 20 0 BEADLO CC[NH2+]Cc1noc(CC2CCCCC2)n1 ZINC000051860797 631971990 /nfs/dbraw/zinc/97/19/90/631971990.db2.gz PMQRGHGZQOEBLM-UHFFFAOYSA-N 1 2 223.320 2.302 20 0 BEADLO CC(C)(O)C(C)(C)[NH2+]CC(F)(F)C(F)F ZINC000308894814 632103252 /nfs/dbraw/zinc/10/32/52/632103252.db2.gz SCFCLBYZRWWMCC-UHFFFAOYSA-N 1 2 231.233 2.026 20 0 BEADLO CC[C@@H]1CCC[N@H+](Cn2ncn(C)c2=S)C1 ZINC000126252381 635723400 /nfs/dbraw/zinc/72/34/00/635723400.db2.gz IOGUVMNWVVWDOZ-SNVBAGLBSA-N 1 2 240.376 2.031 20 0 BEADLO CC[C@@H]1CCC[N@@H+](Cn2ncn(C)c2=S)C1 ZINC000126252381 635723405 /nfs/dbraw/zinc/72/34/05/635723405.db2.gz IOGUVMNWVVWDOZ-SNVBAGLBSA-N 1 2 240.376 2.031 20 0 BEADLO CC(C)[C@H]1CCN1C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000935252079 632569926 /nfs/dbraw/zinc/56/99/26/632569926.db2.gz PGLARHSOEWMFOG-CYBMUJFWSA-N 1 2 243.310 2.433 20 0 BEADLO C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@H]2F)c2ncnn21 ZINC000926586550 632595702 /nfs/dbraw/zinc/59/57/02/632595702.db2.gz CHSAKCCRMSAKNH-GWOFURMSSA-N 1 2 238.310 2.154 20 0 BEADLO C(=C\c1ccccc1)\C[NH2+]Cc1csnn1 ZINC000309077749 632635492 /nfs/dbraw/zinc/63/54/92/632635492.db2.gz BXALFMRPDCTRHK-DAXSKMNVSA-N 1 2 231.324 2.341 20 0 BEADLO CNc1cc(N2C[C@@H]3CCCC[C@@H]3C2)nc[nH+]1 ZINC000310528706 632755908 /nfs/dbraw/zinc/75/59/08/632755908.db2.gz YQQYXWIDMXBCAC-PHIMTYICSA-N 1 2 232.331 2.145 20 0 BEADLO CNc1cc(N2C[C@@H]3CCCC[C@@H]3C2)[nH+]cn1 ZINC000310528706 632755912 /nfs/dbraw/zinc/75/59/12/632755912.db2.gz YQQYXWIDMXBCAC-PHIMTYICSA-N 1 2 232.331 2.145 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2CO[C@@H](C)[C@@H]2C)c1 ZINC000926664226 632790935 /nfs/dbraw/zinc/79/09/35/632790935.db2.gz XIEIDXZFRIARMO-JBLDHEPKSA-N 1 2 236.315 2.063 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2CC2(C)C)c(N(C)C)[nH+]1 ZINC000153486426 632820093 /nfs/dbraw/zinc/82/00/93/632820093.db2.gz BOSWGDBWGCLQSK-SNVBAGLBSA-N 1 2 247.342 2.441 20 0 BEADLO CC/C=C(\C)C(=O)NCc1ccn2cc[nH+]c2c1 ZINC000177670290 632858310 /nfs/dbraw/zinc/85/83/10/632858310.db2.gz TVSXJRQILKDYFZ-NYYWCZLTSA-N 1 2 243.310 2.307 20 0 BEADLO CCCSC[C@H](C)[NH2+]Cc1ccn[nH]1 ZINC000892515345 632868933 /nfs/dbraw/zinc/86/89/33/632868933.db2.gz NOORBAXCCQLGIT-VIFPVBQESA-N 1 2 213.350 2.031 20 0 BEADLO CC[C@H](C)CC(=O)OCc1cc[nH+]c(N)c1 ZINC000309296469 632899660 /nfs/dbraw/zinc/89/96/60/632899660.db2.gz RQHXALWRCBBARS-VIFPVBQESA-N 1 2 222.288 2.143 20 0 BEADLO O=C(N[C@@H]1C[C@H]1C1CC1)c1cc2c[nH+]ccc2[nH]1 ZINC000935782608 633009132 /nfs/dbraw/zinc/00/91/32/633009132.db2.gz SAHAUHSRUBUZDE-CMPLNLGQSA-N 1 2 241.294 2.091 20 0 BEADLO CC[NH2+]Cc1noc(CSc2ccccc2)n1 ZINC000092234116 633235114 /nfs/dbraw/zinc/23/51/14/633235114.db2.gz RPUILBKGCOFDEJ-UHFFFAOYSA-N 1 2 249.339 2.471 20 0 BEADLO CCCCC[C@@H](C)Nc1nc(C)[nH+]c(N)n1 ZINC000304407078 635941763 /nfs/dbraw/zinc/94/17/63/635941763.db2.gz BQYJRFXEOXBLEU-MRVPVSSYSA-N 1 2 223.324 2.143 20 0 BEADLO CCCCC[C@@H](C)Nc1nc(N)nc(C)[nH+]1 ZINC000304407078 635941766 /nfs/dbraw/zinc/94/17/66/635941766.db2.gz BQYJRFXEOXBLEU-MRVPVSSYSA-N 1 2 223.324 2.143 20 0 BEADLO CC(C)[C@@H]1C[N@H+](C/C=C/Cl)CCO1 ZINC000307713419 635994206 /nfs/dbraw/zinc/99/42/06/635994206.db2.gz BSGQPIYZBWOUQI-FSIBCCDJSA-N 1 2 203.713 2.096 20 0 BEADLO CC(C)[C@@H]1C[N@@H+](C/C=C/Cl)CCO1 ZINC000307713419 635994207 /nfs/dbraw/zinc/99/42/07/635994207.db2.gz BSGQPIYZBWOUQI-FSIBCCDJSA-N 1 2 203.713 2.096 20 0 BEADLO CC1(C)OCC[C@@H]1[NH2+]CC(F)(F)C(F)F ZINC000328411939 633763960 /nfs/dbraw/zinc/76/39/60/633763960.db2.gz HHFGEZQWPLCXMQ-LURJTMIESA-N 1 2 229.217 2.044 20 0 BEADLO CCc1onc(C)c1C[N@@H+]1CC[C@H](F)C1 ZINC000930603694 633929109 /nfs/dbraw/zinc/92/91/09/633929109.db2.gz QBGYGPGZHJWLIW-VIFPVBQESA-N 1 2 212.268 2.089 20 0 BEADLO CCc1onc(C)c1C[N@H+]1CC[C@H](F)C1 ZINC000930603694 633929111 /nfs/dbraw/zinc/92/91/11/633929111.db2.gz QBGYGPGZHJWLIW-VIFPVBQESA-N 1 2 212.268 2.089 20 0 BEADLO Cc1cn(C(C)(C)C(=O)NCCC(C)C)c[nH+]1 ZINC000895470084 636148406 /nfs/dbraw/zinc/14/84/06/636148406.db2.gz RVSQWJNINIEYHH-UHFFFAOYSA-N 1 2 237.347 2.089 20 0 BEADLO COc1ccc(CNc2[nH+]cccc2OC)o1 ZINC000893267679 634014108 /nfs/dbraw/zinc/01/41/08/634014108.db2.gz VXIJLVWQYOXGBT-UHFFFAOYSA-N 1 2 234.255 2.304 20 0 BEADLO C[C@H]([NH2+]CC1(C)CC1)C(=O)OC1CCCC1 ZINC000309920245 634041168 /nfs/dbraw/zinc/04/11/68/634041168.db2.gz ROOIOHFLYIFPCY-JTQLQIEISA-N 1 2 225.332 2.250 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N2C3CCC2CC3)c[nH+]1 ZINC000895569435 636160182 /nfs/dbraw/zinc/16/01/82/636160182.db2.gz WEIHLNKTBMKTDJ-UHFFFAOYSA-N 1 2 247.342 2.080 20 0 BEADLO CC(C)SCC[NH2+][C@@]1(C)CC(C)(C)OC1=O ZINC000930872015 634146196 /nfs/dbraw/zinc/14/61/96/634146196.db2.gz IMPHBHDHJTYMOO-LBPRGKRZSA-N 1 2 245.388 2.202 20 0 BEADLO c1cc(C[NH2+]Cc2nccc3c2CCCC3)on1 ZINC000893549467 635142006 /nfs/dbraw/zinc/14/20/06/635142006.db2.gz UYYHBDZSAMJXTD-UHFFFAOYSA-N 1 2 243.310 2.238 20 0 BEADLO COc1ccc(-c2c[nH]c(C)[nH+]2)c(OC)c1 ZINC000259169051 635249838 /nfs/dbraw/zinc/24/98/38/635249838.db2.gz VBWPSXGDPWPIIP-UHFFFAOYSA-N 1 2 218.256 2.402 20 0 BEADLO C[C@@H]([NH2+]C[C@@H]1CC1(Cl)Cl)C(F)F ZINC000895726086 636175105 /nfs/dbraw/zinc/17/51/05/636175105.db2.gz ZRYNXHVOJMZYRK-UHNVWZDZSA-N 1 2 218.074 2.423 20 0 BEADLO c1ccc(NCc2nc3c(s2)COCC3)[nH+]c1 ZINC000896546070 636202333 /nfs/dbraw/zinc/20/23/33/636202333.db2.gz UPKZXNDAUJKGCX-UHFFFAOYSA-N 1 2 247.323 2.223 20 0 BEADLO Cc1noc(C(C)C)c1NC(=O)Cc1[nH]cc[nH+]1 ZINC000928784587 636359607 /nfs/dbraw/zinc/35/96/07/636359607.db2.gz KKMCGKMKQXJLPT-UHFFFAOYSA-N 1 2 248.286 2.011 20 0 BEADLO CCc1onc(C)c1C[N@@H+]1C[C@@H](C)OC[C@@H]1C ZINC000929183360 636920232 /nfs/dbraw/zinc/92/02/32/636920232.db2.gz UOVAJKVFCBTFMH-VHSXEESVSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1onc(C)c1C[N@H+]1C[C@@H](C)OC[C@@H]1C ZINC000929183360 636920235 /nfs/dbraw/zinc/92/02/35/636920235.db2.gz UOVAJKVFCBTFMH-VHSXEESVSA-N 1 2 238.331 2.155 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@]2(C)CCC[C@H]2C)[nH+]c1C ZINC000901000043 637224014 /nfs/dbraw/zinc/22/40/14/637224014.db2.gz IRYKDCOSZCIDOY-YMTOWFKASA-N 1 2 249.358 2.469 20 0 BEADLO C/C=C(\C)c1nc(-c2c[nH+]c(N)cc2C)no1 ZINC000904269206 637394617 /nfs/dbraw/zinc/39/46/17/637394617.db2.gz XRMJHTLWUWULPC-QPJJXVBHSA-N 1 2 230.271 2.445 20 0 BEADLO Cc1nn(C)c(CNc2cccc[nH+]2)c1Cl ZINC000905406348 637797453 /nfs/dbraw/zinc/79/74/53/637797453.db2.gz NGIHJWLAGATGTF-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO CCn1c[nH+]cc1CNc1cc(F)ccn1 ZINC000905419947 637805465 /nfs/dbraw/zinc/80/54/65/637805465.db2.gz BWVFMVRIRSAIHX-UHFFFAOYSA-N 1 2 220.251 2.049 20 0 BEADLO CC[C@H](C)[C@H]([NH2+][C@H]1CC12CCC2)C(=O)OC ZINC000905779785 637909172 /nfs/dbraw/zinc/90/91/72/637909172.db2.gz ZMDJUULDDPXUOH-DCAQKATOSA-N 1 2 225.332 2.106 20 0 BEADLO CC[C@H](C)[C@H]([NH2+]C[C@@]1(C)CC1(F)F)C(=O)OC ZINC000905772388 637927562 /nfs/dbraw/zinc/92/75/62/637927562.db2.gz DSNBQVNZTIWSJF-ATZCPNFKSA-N 1 2 249.301 2.209 20 0 BEADLO Cc1cncc(-c2c[nH+]c3c(c2)CCCN3)c1 ZINC000906176945 638087827 /nfs/dbraw/zinc/08/78/27/638087827.db2.gz JZVZMGHZEJCYNN-UHFFFAOYSA-N 1 2 225.295 2.453 20 0 BEADLO Cc1ccncc1-c1c[nH+]c2c(c1)CCCN2 ZINC000906185800 638092843 /nfs/dbraw/zinc/09/28/43/638092843.db2.gz PXJNLCUKOSPVIA-UHFFFAOYSA-N 1 2 225.295 2.453 20 0 BEADLO Cc1[nH+]cc(-c2cnn(C(C)(C)C)c2)n1C ZINC000906190908 638098806 /nfs/dbraw/zinc/09/88/06/638098806.db2.gz PZGXMTCKNGHNPW-UHFFFAOYSA-N 1 2 218.304 2.347 20 0 BEADLO Cc1cc(-c2c[nH+]c3c(c2)CCCN3)ccn1 ZINC000906162791 638099931 /nfs/dbraw/zinc/09/99/31/638099931.db2.gz HTXYBVPVRVSCSU-UHFFFAOYSA-N 1 2 225.295 2.453 20 0 BEADLO Cc1cc(C)c(C(=O)N2CC[C@H](C)C2)c(C)[nH+]1 ZINC000906495703 638173712 /nfs/dbraw/zinc/17/37/12/638173712.db2.gz WZEBLDFGXFDLRW-VIFPVBQESA-N 1 2 232.327 2.489 20 0 BEADLO CC(=O)CCN(C)C(=O)c1c(C)cc(C)[nH+]c1C ZINC000907160599 638316245 /nfs/dbraw/zinc/31/62/45/638316245.db2.gz DKAXOBBZJVWXGT-UHFFFAOYSA-N 1 2 248.326 2.058 20 0 BEADLO Cc1cc(C)c(C(=O)N2CC=CCC2)c(C)[nH+]1 ZINC000907242618 638330045 /nfs/dbraw/zinc/33/00/45/638330045.db2.gz ACHIADHWKMMOJV-UHFFFAOYSA-N 1 2 230.311 2.409 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1CNC(=O)Cc1c[nH]c[nH+]1 ZINC000908551241 639011522 /nfs/dbraw/zinc/01/15/22/639011522.db2.gz JTXFLORZWBIKDC-VXGBXAGGSA-N 1 2 249.358 2.285 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)NCC1CCCCCC1 ZINC000908947061 639098005 /nfs/dbraw/zinc/09/80/05/639098005.db2.gz ZAOTZVADXBKHRH-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO C[C@]1(NC(=O)CNc2cccc[nH+]2)CC=CCC1 ZINC000909930781 639280738 /nfs/dbraw/zinc/28/07/38/639280738.db2.gz IIFBTYYDQMFOEL-AWEZNQCLSA-N 1 2 245.326 2.109 20 0 BEADLO C/C(Cl)=C/C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000911169143 639594748 /nfs/dbraw/zinc/59/47/48/639594748.db2.gz TXVIVFUMBPWONE-YWEYNIOJSA-N 1 2 238.718 2.457 20 0 BEADLO c1cc(CC[N@@H+]2Cc3cccnc3C2)sn1 ZINC000930305258 639692616 /nfs/dbraw/zinc/69/26/16/639692616.db2.gz AWYVZGNHYKYIGD-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1cc(CC[N@H+]2Cc3cccnc3C2)sn1 ZINC000930305258 639692619 /nfs/dbraw/zinc/69/26/19/639692619.db2.gz AWYVZGNHYKYIGD-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO C[C@H]([NH2+]Cc1nncs1)c1ccsc1 ZINC000930345886 639720070 /nfs/dbraw/zinc/72/00/70/639720070.db2.gz UTJBBUIFJGGXIL-ZETCQYMHSA-N 1 2 225.342 2.450 20 0 BEADLO Cc1cn(C)nc1C[N@@H+]1CCC[C@](C)(F)C1 ZINC000930596155 639815587 /nfs/dbraw/zinc/81/55/87/639815587.db2.gz SEEKWNTZVCGUIA-LBPRGKRZSA-N 1 2 225.311 2.053 20 0 BEADLO Cc1cn(C)nc1C[N@H+]1CCC[C@](C)(F)C1 ZINC000930596155 639815588 /nfs/dbraw/zinc/81/55/88/639815588.db2.gz SEEKWNTZVCGUIA-LBPRGKRZSA-N 1 2 225.311 2.053 20 0 BEADLO C[C@@H](c1ccc(F)nc1)[N@@H+]1CC[C@H](F)C1 ZINC000930603027 639817431 /nfs/dbraw/zinc/81/74/31/639817431.db2.gz HAEXDHYIXUJQLA-WPRPVWTQSA-N 1 2 212.243 2.326 20 0 BEADLO C[C@@H](c1ccc(F)nc1)[N@H+]1CC[C@H](F)C1 ZINC000930603027 639817432 /nfs/dbraw/zinc/81/74/32/639817432.db2.gz HAEXDHYIXUJQLA-WPRPVWTQSA-N 1 2 212.243 2.326 20 0 BEADLO C[C@H](c1ccc(F)nc1)[N@@H+]1CC[C@@H](F)C1 ZINC000930603024 639817594 /nfs/dbraw/zinc/81/75/94/639817594.db2.gz HAEXDHYIXUJQLA-PSASIEDQSA-N 1 2 212.243 2.326 20 0 BEADLO C[C@H](c1ccc(F)nc1)[N@H+]1CC[C@@H](F)C1 ZINC000930603024 639817595 /nfs/dbraw/zinc/81/75/95/639817595.db2.gz HAEXDHYIXUJQLA-PSASIEDQSA-N 1 2 212.243 2.326 20 0 BEADLO F[C@H]1CC[N@H+](C[C@H]2CC[C@@H](C(F)(F)F)O2)C1 ZINC000930623715 639828449 /nfs/dbraw/zinc/82/84/49/639828449.db2.gz XDKHSOAJTYRLHX-YIZRAAEISA-N 1 2 241.228 2.140 20 0 BEADLO F[C@H]1CC[N@@H+](C[C@H]2CC[C@@H](C(F)(F)F)O2)C1 ZINC000930623715 639828451 /nfs/dbraw/zinc/82/84/51/639828451.db2.gz XDKHSOAJTYRLHX-YIZRAAEISA-N 1 2 241.228 2.140 20 0 BEADLO F[C@H]1CC[N@H+](C[C@H]2CC[C@H](C(F)(F)F)O2)C1 ZINC000930623713 639829346 /nfs/dbraw/zinc/82/93/46/639829346.db2.gz XDKHSOAJTYRLHX-DJLDLDEBSA-N 1 2 241.228 2.140 20 0 BEADLO F[C@H]1CC[N@@H+](C[C@H]2CC[C@H](C(F)(F)F)O2)C1 ZINC000930623713 639829350 /nfs/dbraw/zinc/82/93/50/639829350.db2.gz XDKHSOAJTYRLHX-DJLDLDEBSA-N 1 2 241.228 2.140 20 0 BEADLO Cc1cc(C)nc(C[NH2+][C@@H](C)c2ccn(C)n2)c1 ZINC000930704887 639871325 /nfs/dbraw/zinc/87/13/25/639871325.db2.gz OTXXQHXZWXWSPV-LBPRGKRZSA-N 1 2 244.342 2.283 20 0 BEADLO CN(C(=O)CCc1c[nH]c[nH+]1)c1ccsc1 ZINC000912009574 639918849 /nfs/dbraw/zinc/91/88/49/639918849.db2.gz JKEAYNFTJVTGGT-UHFFFAOYSA-N 1 2 235.312 2.067 20 0 BEADLO CN(C(=O)CCc1c[nH+]c[nH]1)c1ccsc1 ZINC000912009574 639918856 /nfs/dbraw/zinc/91/88/56/639918856.db2.gz JKEAYNFTJVTGGT-UHFFFAOYSA-N 1 2 235.312 2.067 20 0 BEADLO c1nnc(C[N@@H+]2CCC23CCCC3)s1 ZINC000930844134 639941232 /nfs/dbraw/zinc/94/12/32/639941232.db2.gz AKKYSLNPYJZFES-UHFFFAOYSA-N 1 2 209.318 2.057 20 0 BEADLO c1nnc(C[N@H+]2CCC23CCCC3)s1 ZINC000930844134 639941237 /nfs/dbraw/zinc/94/12/37/639941237.db2.gz AKKYSLNPYJZFES-UHFFFAOYSA-N 1 2 209.318 2.057 20 0 BEADLO CC[C@@H](CO)[NH+]1Cc2cc(F)c(F)cc2C1 ZINC000930888396 639972384 /nfs/dbraw/zinc/97/23/84/639972384.db2.gz ZAARIDGCWRSREP-JTQLQIEISA-N 1 2 227.254 2.051 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2cnc[nH]2)c1C ZINC000930916870 639982850 /nfs/dbraw/zinc/98/28/50/639982850.db2.gz SVIVPJCRFKPYPJ-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2cnc[nH]2)c1C ZINC000930916870 639982859 /nfs/dbraw/zinc/98/28/59/639982859.db2.gz SVIVPJCRFKPYPJ-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2c[nH]cn2)c1C ZINC000930916870 639982871 /nfs/dbraw/zinc/98/28/71/639982871.db2.gz SVIVPJCRFKPYPJ-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2c[nH]cn2)c1C ZINC000930916870 639982879 /nfs/dbraw/zinc/98/28/79/639982879.db2.gz SVIVPJCRFKPYPJ-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO Cc1ncc(CSCc2c[nH+]cn2C)o1 ZINC000912430009 640057914 /nfs/dbraw/zinc/05/79/14/640057914.db2.gz NFTLOINMGPBDHA-UHFFFAOYSA-N 1 2 223.301 2.150 20 0 BEADLO Cc1ncc(CSCc2ccc[nH+]c2N)o1 ZINC000912433707 640059955 /nfs/dbraw/zinc/05/99/55/640059955.db2.gz OOTIKPHJWCXCON-UHFFFAOYSA-N 1 2 235.312 2.394 20 0 BEADLO Cc1ccccc1C[N@@H+]1CCC[C@H]1c1nnc[nH]1 ZINC000931133060 640073046 /nfs/dbraw/zinc/07/30/46/640073046.db2.gz KCXNRWLDCSNKCK-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccccc1C[N@H+]1CCC[C@H]1c1nnc[nH]1 ZINC000931133060 640073050 /nfs/dbraw/zinc/07/30/50/640073050.db2.gz KCXNRWLDCSNKCK-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO CC(C)CCC[N@@H+]1CCC[C@H]1c1nnc[nH]1 ZINC000931140593 640077035 /nfs/dbraw/zinc/07/70/35/640077035.db2.gz PWKZTQSPJJAQHB-NSHDSACASA-N 1 2 222.336 2.378 20 0 BEADLO CC(C)CCC[N@H+]1CCC[C@H]1c1nnc[nH]1 ZINC000931140593 640077042 /nfs/dbraw/zinc/07/70/42/640077042.db2.gz PWKZTQSPJJAQHB-NSHDSACASA-N 1 2 222.336 2.378 20 0 BEADLO CC[C@@](C)(NC(=O)CNc1cccc[nH+]1)C1CC1 ZINC000912515032 640104199 /nfs/dbraw/zinc/10/41/99/640104199.db2.gz RSJKQCUAPYMVOO-CQSZACIVSA-N 1 2 247.342 2.188 20 0 BEADLO C[C@H](CNC(=O)Cc1c[nH]c[nH+]1)C1CCCCC1 ZINC000912710638 640179480 /nfs/dbraw/zinc/17/94/80/640179480.db2.gz RKBQOOMLZSJOOT-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1Cc2c[nH]nc2[C@H](C)C1 ZINC000931451514 640212347 /nfs/dbraw/zinc/21/23/47/640212347.db2.gz CBNOKJCRMXYWFA-MRVPVSSYSA-N 1 2 246.314 2.134 20 0 BEADLO Cc1noc(C)c1C[N@H+]1Cc2c[nH]nc2[C@H](C)C1 ZINC000931451514 640212354 /nfs/dbraw/zinc/21/23/54/640212354.db2.gz CBNOKJCRMXYWFA-MRVPVSSYSA-N 1 2 246.314 2.134 20 0 BEADLO C[N@H+](CCCF)Cc1c(F)cncc1F ZINC000931762880 640354078 /nfs/dbraw/zinc/35/40/78/640354078.db2.gz BIRRMKWURSAZOJ-UHFFFAOYSA-N 1 2 218.222 2.151 20 0 BEADLO C[N@@H+](CCCF)Cc1c(F)cncc1F ZINC000931762880 640354083 /nfs/dbraw/zinc/35/40/83/640354083.db2.gz BIRRMKWURSAZOJ-UHFFFAOYSA-N 1 2 218.222 2.151 20 0 BEADLO Cc1ccc(C[NH2+]Cc2c[nH]cn2)s1 ZINC000054765303 640408141 /nfs/dbraw/zinc/40/81/41/640408141.db2.gz KNHKXCXNAPMVHJ-UHFFFAOYSA-N 1 2 207.302 2.069 20 0 BEADLO CCCCOC(=O)[C@H](C)[NH2+][C@@H](C)C(C)(C)OC ZINC000932368594 640501664 /nfs/dbraw/zinc/50/16/64/640501664.db2.gz HWLDJASTPAKUCK-QWRGUYRKSA-N 1 2 245.363 2.121 20 0 BEADLO C=CCO[NH+]=C(N)Cc1ccc(Cl)cc1 ZINC000165335476 640562191 /nfs/dbraw/zinc/56/21/91/640562191.db2.gz WZEXBYFHZSCFOQ-UHFFFAOYSA-N 1 2 224.691 2.357 20 0 BEADLO Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1cnn[nH]1 ZINC000932562792 640575339 /nfs/dbraw/zinc/57/53/39/640575339.db2.gz RCBKTWMCTOAUSM-VIFPVBQESA-N 1 2 234.278 2.103 20 0 BEADLO COc1ccc([C@H](C)[NH2+]Cc2cnon2)cc1C ZINC000932570968 640577511 /nfs/dbraw/zinc/57/75/11/640577511.db2.gz WBSPUPVPLIFBRW-JTQLQIEISA-N 1 2 247.298 2.237 20 0 BEADLO C[C@]1(C(=O)NCCCCn2cc[nH+]c2)C=CCC1 ZINC000932717978 640604299 /nfs/dbraw/zinc/60/42/99/640604299.db2.gz KVYCGXJIZJLCAV-AWEZNQCLSA-N 1 2 247.342 2.136 20 0 BEADLO O=C(/C=C\c1ccccc1)OCCn1cc[nH+]c1 ZINC000224294096 640608341 /nfs/dbraw/zinc/60/83/41/640608341.db2.gz NXFKMUGHTXFEOI-SREVYHEPSA-N 1 2 242.278 2.140 20 0 BEADLO CO[C@H](C[N@@H+]1CCCC(=O)[C@H]1C)C1CCCC1 ZINC000932845167 640617424 /nfs/dbraw/zinc/61/74/24/640617424.db2.gz JBMSLWNLSYDDBH-BXUZGUMPSA-N 1 2 239.359 2.245 20 0 BEADLO CO[C@H](C[N@H+]1CCCC(=O)[C@H]1C)C1CCCC1 ZINC000932845167 640617426 /nfs/dbraw/zinc/61/74/26/640617426.db2.gz JBMSLWNLSYDDBH-BXUZGUMPSA-N 1 2 239.359 2.245 20 0 BEADLO CCC(F)(F)C[NH2+][C@]12C[C@H]1COC21CCC1 ZINC000933385390 640712071 /nfs/dbraw/zinc/71/20/71/640712071.db2.gz HAHKNTUMGWVYJF-JOYOIKCWSA-N 1 2 231.286 2.333 20 0 BEADLO c1nc(C[NH2+][C@@H]2CCc3cccnc32)cs1 ZINC000226820873 640793265 /nfs/dbraw/zinc/79/32/65/640793265.db2.gz VXCICQBHVRBLCF-LLVKDONJSA-N 1 2 231.324 2.315 20 0 BEADLO Cc1cscc1C[NH2+]Cc1c[nH]cn1 ZINC000087309225 640870634 /nfs/dbraw/zinc/87/06/34/640870634.db2.gz HTTUNYWPIRXBMH-UHFFFAOYSA-N 1 2 207.302 2.069 20 0 BEADLO COC(=O)[C@H](CC(C)C)[NH2+][C@@H]1CCCSC1 ZINC000061575802 640974998 /nfs/dbraw/zinc/97/49/98/640974998.db2.gz WCLHNDNUJQBDNH-MNOVXSKESA-N 1 2 245.388 2.059 20 0 BEADLO CCC1CCN(c2cc(NC)[nH+]cn2)CC1 ZINC000087821392 641056955 /nfs/dbraw/zinc/05/69/55/641056955.db2.gz VDACDGBFNSWJPB-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO CCC1CCN(c2cc(NC)nc[nH+]2)CC1 ZINC000087821392 641056957 /nfs/dbraw/zinc/05/69/57/641056957.db2.gz VDACDGBFNSWJPB-UHFFFAOYSA-N 1 2 220.320 2.145 20 0 BEADLO CCCc1ccccc1C(=O)NC1C[NH+](CC)C1 ZINC001030654137 641057866 /nfs/dbraw/zinc/05/78/66/641057866.db2.gz WGVRVWKEYIHDHW-UHFFFAOYSA-N 1 2 246.354 2.073 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@H+](C)Cc1ncc(C(C)C)o1 ZINC000934111030 641075205 /nfs/dbraw/zinc/07/52/05/641075205.db2.gz QHPQLZWYUMRAPU-GHMZBOCLSA-N 1 2 238.331 2.407 20 0 BEADLO CO[C@@H]1CC[C@H]1[N@@H+](C)Cc1ncc(C(C)C)o1 ZINC000934111030 641075211 /nfs/dbraw/zinc/07/52/11/641075211.db2.gz QHPQLZWYUMRAPU-GHMZBOCLSA-N 1 2 238.331 2.407 20 0 BEADLO CCCCC1([NH2+][C@@H](C(=O)OC)C2CC2)CC1 ZINC000934205599 641100817 /nfs/dbraw/zinc/10/08/17/641100817.db2.gz PHVNCVGUZSEDDI-LLVKDONJSA-N 1 2 225.332 2.250 20 0 BEADLO CCCNc1cc(N[C@@H]2CCSC2)nc[nH+]1 ZINC000231445453 641171697 /nfs/dbraw/zinc/17/16/97/641171697.db2.gz POMBJUMBRAFKRY-SECBINFHSA-N 1 2 238.360 2.216 20 0 BEADLO CCCNc1cc(N[C@@H]2CCSC2)[nH+]cn1 ZINC000231445453 641171704 /nfs/dbraw/zinc/17/17/04/641171704.db2.gz POMBJUMBRAFKRY-SECBINFHSA-N 1 2 238.360 2.216 20 0 BEADLO Cc1noc(C[NH2+][C@@H](c2ccncc2)C2CC2)n1 ZINC000934685559 641246387 /nfs/dbraw/zinc/24/63/87/641246387.db2.gz GUEYOVGMBISQLB-CYBMUJFWSA-N 1 2 244.298 2.014 20 0 BEADLO c1nc(C[NH2+][C@@H](c2ccncc2)C2CC2)c[nH]1 ZINC000934695641 641249566 /nfs/dbraw/zinc/24/95/66/641249566.db2.gz CJDSPIZTWAJKDO-CYBMUJFWSA-N 1 2 228.299 2.046 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@@H](C)O[C@H](CC)C2)o1 ZINC000929620149 641376675 /nfs/dbraw/zinc/37/66/75/641376675.db2.gz OBVJVJZVZRIMJL-GHMZBOCLSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@@H](C)O[C@H](CC)C2)o1 ZINC000929620149 641376679 /nfs/dbraw/zinc/37/66/79/641376679.db2.gz OBVJVJZVZRIMJL-GHMZBOCLSA-N 1 2 238.331 2.236 20 0 BEADLO C[C@@H]1CC[C@H](NC(=O)c2cc3c[nH+]ccc3[nH]2)C1 ZINC000935540794 641425212 /nfs/dbraw/zinc/42/52/12/641425212.db2.gz MUOAIDCJHVIDDA-KOLCDFICSA-N 1 2 243.310 2.481 20 0 BEADLO OC1(C[N@@H+]2CCC(F)(F)C2)CCCCC1 ZINC000313249335 641544356 /nfs/dbraw/zinc/54/43/56/641544356.db2.gz HRQHDMDSCCJPGH-UHFFFAOYSA-N 1 2 219.275 2.023 20 0 BEADLO OC1(C[N@H+]2CCC(F)(F)C2)CCCCC1 ZINC000313249335 641544361 /nfs/dbraw/zinc/54/43/61/641544361.db2.gz HRQHDMDSCCJPGH-UHFFFAOYSA-N 1 2 219.275 2.023 20 0 BEADLO CCON(CC)C(=O)c1ccn2c(C)c[nH+]c2c1 ZINC000831451005 641595053 /nfs/dbraw/zinc/59/50/53/641595053.db2.gz JNGWZHYHENAJFF-UHFFFAOYSA-N 1 2 247.298 2.056 20 0 BEADLO CCCNc1cc(N[C@H](C)CCOC)nc[nH+]1 ZINC000156237323 641601421 /nfs/dbraw/zinc/60/14/21/641601421.db2.gz XGIPLQZOESZPDL-SNVBAGLBSA-N 1 2 238.335 2.135 20 0 BEADLO CCCNc1cc(N[C@H](C)CCOC)[nH+]cn1 ZINC000156237323 641601423 /nfs/dbraw/zinc/60/14/23/641601423.db2.gz XGIPLQZOESZPDL-SNVBAGLBSA-N 1 2 238.335 2.135 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2C[C@@H]2C)c(N(C)C)[nH+]1 ZINC000152592625 641621756 /nfs/dbraw/zinc/62/17/56/641621756.db2.gz PCVSXBJUOOCOSA-WCBMZHEXSA-N 1 2 233.315 2.051 20 0 BEADLO COc1nnc(C[N@H+](C)[C@H](C)C2(C)CC2)s1 ZINC000929817368 641672117 /nfs/dbraw/zinc/67/21/17/641672117.db2.gz NPXCTBZPOYQRLQ-MRVPVSSYSA-N 1 2 241.360 2.167 20 0 BEADLO COc1nnc(C[N@@H+](C)[C@H](C)C2(C)CC2)s1 ZINC000929817368 641672120 /nfs/dbraw/zinc/67/21/20/641672120.db2.gz NPXCTBZPOYQRLQ-MRVPVSSYSA-N 1 2 241.360 2.167 20 0 BEADLO CCOC(C)(C)C[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000159329810 641677434 /nfs/dbraw/zinc/67/74/34/641677434.db2.gz AORDJIMAXBUKTN-JTQLQIEISA-N 1 2 245.363 2.121 20 0 BEADLO CCCCC[C@@H]([NH2+][C@H]1CCSC1)C(=O)OC ZINC000187886397 641732188 /nfs/dbraw/zinc/73/21/88/641732188.db2.gz RWOAVTKSDDKHOA-WDEREUQCSA-N 1 2 245.388 2.203 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccc(F)nc2)CC(C)(C)O1 ZINC000189307203 641801537 /nfs/dbraw/zinc/80/15/37/641801537.db2.gz SMHWBGSMYCZZGK-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccc(F)nc2)CC(C)(C)O1 ZINC000189307203 641801541 /nfs/dbraw/zinc/80/15/41/641801541.db2.gz SMHWBGSMYCZZGK-JTQLQIEISA-N 1 2 238.306 2.220 20 0 BEADLO CCO[C@H]1CCC[N@H+](Cc2nc(C)c(C)[nH]2)C1 ZINC000628117641 641858064 /nfs/dbraw/zinc/85/80/64/641858064.db2.gz PXLFWPCFABEZAE-LBPRGKRZSA-N 1 2 237.347 2.027 20 0 BEADLO CCO[C@H]1CCC[N@@H+](Cc2nc(C)c(C)[nH]2)C1 ZINC000628117641 641858065 /nfs/dbraw/zinc/85/80/65/641858065.db2.gz PXLFWPCFABEZAE-LBPRGKRZSA-N 1 2 237.347 2.027 20 0 BEADLO CCC(CC)Nc1cc(N(C)C)nc[nH+]1 ZINC000891425509 711514713 /nfs/dbraw/zinc/51/47/13/711514713.db2.gz ARPQAUSZCPBXTI-UHFFFAOYSA-N 1 2 208.309 2.143 20 0 BEADLO CCC(CC)Nc1cc(N(C)C)[nH+]cn1 ZINC000891425509 711514716 /nfs/dbraw/zinc/51/47/16/711514716.db2.gz ARPQAUSZCPBXTI-UHFFFAOYSA-N 1 2 208.309 2.143 20 0 BEADLO C[C@@H]1Cc2c([nH+]cn2COC(=O)C2CC2)C[C@@H]1C ZINC000917788713 642123233 /nfs/dbraw/zinc/12/32/33/642123233.db2.gz FAXPYFPDFZQMGP-VHSXEESVSA-N 1 2 248.326 2.165 20 0 BEADLO O=C(NCC1CCCC1)c1cc2c[nH+]ccc2[nH]1 ZINC000930090145 642373083 /nfs/dbraw/zinc/37/30/83/642373083.db2.gz MZBFGHDKZIXKRY-UHFFFAOYSA-N 1 2 243.310 2.483 20 0 BEADLO Cc1nc(Cl)n(Cc2ccc(C)[nH+]c2C)n1 ZINC000919741511 642383095 /nfs/dbraw/zinc/38/30/95/642383095.db2.gz ZZRCXCHHPIJSEW-UHFFFAOYSA-N 1 2 236.706 2.300 20 0 BEADLO C[N@H+](CC1CC1)Cn1nc2ccccn2c1=S ZINC000919942229 642409070 /nfs/dbraw/zinc/40/90/70/642409070.db2.gz LKKDPZMDZJVDIH-UHFFFAOYSA-N 1 2 248.355 2.165 20 0 BEADLO C[N@@H+](CC1CC1)Cn1nc2ccccn2c1=S ZINC000919942229 642409077 /nfs/dbraw/zinc/40/90/77/642409077.db2.gz LKKDPZMDZJVDIH-UHFFFAOYSA-N 1 2 248.355 2.165 20 0 BEADLO COc1nnc(C[NH+]2C[C@H](C)C[C@@H](C)C2)s1 ZINC000920257341 642460708 /nfs/dbraw/zinc/46/07/08/642460708.db2.gz NYTVZLKIMQTRTJ-RKDXNWHRSA-N 1 2 241.360 2.025 20 0 BEADLO CC[C@H]1CCC[N@H+](Cc2nnc(OC)s2)C1 ZINC000920258027 642464993 /nfs/dbraw/zinc/46/49/93/642464993.db2.gz DTSNQJYWDKXUBY-VIFPVBQESA-N 1 2 241.360 2.169 20 0 BEADLO CC[C@H]1CCC[N@@H+](Cc2nnc(OC)s2)C1 ZINC000920258027 642465003 /nfs/dbraw/zinc/46/50/03/642465003.db2.gz DTSNQJYWDKXUBY-VIFPVBQESA-N 1 2 241.360 2.169 20 0 BEADLO CCc1cc(NC[C@H]2CCCO2)nc(CC)[nH+]1 ZINC000891396910 642469229 /nfs/dbraw/zinc/46/92/29/642469229.db2.gz GYPRZYBWOOGQIA-LLVKDONJSA-N 1 2 235.331 2.192 20 0 BEADLO CCOc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)o1 ZINC000891401718 642471282 /nfs/dbraw/zinc/47/12/82/642471282.db2.gz IKVDNRKTXQTWPJ-PHIMTYICSA-N 1 2 239.315 2.288 20 0 BEADLO CCOc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)o1 ZINC000891401718 642471287 /nfs/dbraw/zinc/47/12/87/642471287.db2.gz IKVDNRKTXQTWPJ-PHIMTYICSA-N 1 2 239.315 2.288 20 0 BEADLO CCCC(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000064441280 642656879 /nfs/dbraw/zinc/65/68/79/642656879.db2.gz PFGMTODRBWWCEE-LLVKDONJSA-N 1 2 237.347 2.214 20 0 BEADLO CO[C@@H]1CCC[N@H+](C/C(Cl)=C/Cl)C1 ZINC000306365125 642741325 /nfs/dbraw/zinc/74/13/25/642741325.db2.gz GQGLYDLGZWWYNH-BZJXQOFCSA-N 1 2 224.131 2.416 20 0 BEADLO CO[C@@H]1CCC[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000306365125 642741328 /nfs/dbraw/zinc/74/13/28/642741328.db2.gz GQGLYDLGZWWYNH-BZJXQOFCSA-N 1 2 224.131 2.416 20 0 BEADLO CCOc1ncccc1C[NH2+]Cc1ccco1 ZINC000069678373 642894575 /nfs/dbraw/zinc/89/45/75/642894575.db2.gz NIXOHIVGZLTPNI-UHFFFAOYSA-N 1 2 232.283 2.363 20 0 BEADLO CCCOC(=O)[C@@H](c1ccccc1)[NH+](C)C ZINC000181984069 642936372 /nfs/dbraw/zinc/93/63/72/642936372.db2.gz FIFLYFSWULRYIL-GFCCVEGCSA-N 1 2 221.300 2.243 20 0 BEADLO C[NH+](C)c1ccc(N[C@H]2CCCOC2)cc1 ZINC000070012939 642951749 /nfs/dbraw/zinc/95/17/49/642951749.db2.gz ZWELCILCBDHBNY-LBPRGKRZSA-N 1 2 220.316 2.344 20 0 BEADLO Cc1nonc1C[NH2+][C@@H](C)c1ccc(F)cc1 ZINC000070261741 643006854 /nfs/dbraw/zinc/00/68/54/643006854.db2.gz YCLRLXXFJVVXET-QMMMGPOBSA-N 1 2 235.262 2.368 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+][C@@H](C)Cc1cccs1 ZINC000070917140 643081090 /nfs/dbraw/zinc/08/10/90/643081090.db2.gz UBLJPZLZMSCWPC-VHSXEESVSA-N 1 2 241.356 2.220 20 0 BEADLO COC(=O)[C@H](C)Nc1ccc([NH+](C)C)cc1C ZINC000090273369 643104912 /nfs/dbraw/zinc/10/49/12/643104912.db2.gz VOCOCTVTKJRWPJ-JTQLQIEISA-N 1 2 236.315 2.034 20 0 BEADLO CC(C)C[N@H+](C)Cn1ncn(C2CC2)c1=S ZINC000065943534 643161010 /nfs/dbraw/zinc/16/10/10/643161010.db2.gz WFJFNEMAUVQNCC-UHFFFAOYSA-N 1 2 240.376 2.294 20 0 BEADLO CC(C)C[N@@H+](C)Cn1ncn(C2CC2)c1=S ZINC000065943534 643161015 /nfs/dbraw/zinc/16/10/15/643161015.db2.gz WFJFNEMAUVQNCC-UHFFFAOYSA-N 1 2 240.376 2.294 20 0 BEADLO C/C(=C/C(=O)N[C@H](C)Cn1cc[nH+]c1)C(C)(C)C ZINC000079577689 643276623 /nfs/dbraw/zinc/27/66/23/643276623.db2.gz ROYFIMNBHYGKTE-NXIHDVOMSA-N 1 2 249.358 2.380 20 0 BEADLO CCc1ccc(C[NH2+]Cc2c[nH]cn2)s1 ZINC000082394251 643308010 /nfs/dbraw/zinc/30/80/10/643308010.db2.gz LVKLVIVRTONTGH-UHFFFAOYSA-N 1 2 221.329 2.323 20 0 BEADLO O=C(Cn1cc[nH+]c1)NCC1CCCCCCC1 ZINC000073006695 643349234 /nfs/dbraw/zinc/34/92/34/643349234.db2.gz UONFGPOCBCYGDG-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO CC(C)=CC[NH2+][C@H]1CCCc2[nH]ncc21 ZINC000335632739 643374907 /nfs/dbraw/zinc/37/49/07/643374907.db2.gz DBDIYHASXUHKNU-NSHDSACASA-N 1 2 205.305 2.343 20 0 BEADLO Cc1cc(NC(=O)[C@H]2[C@H]3[C@@H]2[C@@H]2CC[C@H]3C2)cc[nH+]1 ZINC000932607724 643377659 /nfs/dbraw/zinc/37/76/59/643377659.db2.gz UVWNARYGDRNRGV-SWLJZFRDSA-N 1 2 242.322 2.043 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)C1(C2CC2)CC1 ZINC000891015647 643452049 /nfs/dbraw/zinc/45/20/49/643452049.db2.gz ASIMMBARXUQMEA-UHFFFAOYSA-N 1 2 241.294 2.463 20 0 BEADLO CCC/C(C)=C/C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000733984416 643485910 /nfs/dbraw/zinc/48/59/10/643485910.db2.gz XEMTXXSQXNQRFP-YRNVUSSQSA-N 1 2 233.315 2.013 20 0 BEADLO C[C@H]1CC[C@H](C(=O)OCCn2cc[nH+]c2)CC1 ZINC000845423420 643499523 /nfs/dbraw/zinc/49/95/23/643499523.db2.gz PUCFXWARORISCS-HAQNSBGRSA-N 1 2 236.315 2.253 20 0 BEADLO c1csc(C[NH2+]Cc2ccnn2C2CCC2)n1 ZINC000921561448 643612263 /nfs/dbraw/zinc/61/22/63/643612263.db2.gz FJWZNVCVPFKMOT-UHFFFAOYSA-N 1 2 248.355 2.354 20 0 BEADLO CC(C)C1(O)C[NH+](Cc2ccccc2F)C1 ZINC000084376834 643659885 /nfs/dbraw/zinc/65/98/85/643659885.db2.gz WZCPLMDHTVODRY-UHFFFAOYSA-N 1 2 223.291 2.028 20 0 BEADLO CCCCOC(=O)[C@@H](C)[N@@H+]1CCS[C@H](C)C1 ZINC000160583742 643693124 /nfs/dbraw/zinc/69/31/24/643693124.db2.gz AXYLYBDMFUFTST-GHMZBOCLSA-N 1 2 245.388 2.156 20 0 BEADLO CCCCOC(=O)[C@@H](C)[N@H+]1CCS[C@H](C)C1 ZINC000160583742 643693127 /nfs/dbraw/zinc/69/31/27/643693127.db2.gz AXYLYBDMFUFTST-GHMZBOCLSA-N 1 2 245.388 2.156 20 0 BEADLO Cc1cc(NC(=O)c2ccc(F)nc2)cc[nH+]1 ZINC000073609978 643710294 /nfs/dbraw/zinc/71/02/94/643710294.db2.gz FEIOTNFQNJEZBZ-UHFFFAOYSA-N 1 2 231.230 2.176 20 0 BEADLO Cc1ccc(C)c(C(=O)OCc2c[nH+]cn2C)c1 ZINC000085987533 643880987 /nfs/dbraw/zinc/88/09/87/643880987.db2.gz LYXKFNJEZAFCKN-UHFFFAOYSA-N 1 2 244.294 2.394 20 0 BEADLO CCCCCC(=O)OCc1ccc(N)[nH+]c1 ZINC000922174433 643890936 /nfs/dbraw/zinc/89/09/36/643890936.db2.gz WFGSPQSZGSGTET-UHFFFAOYSA-N 1 2 222.288 2.287 20 0 BEADLO Nc1ccc(COC(=O)[C@H]2CC=CCC2)c[nH+]1 ZINC000922218711 643906434 /nfs/dbraw/zinc/90/64/34/643906434.db2.gz BXRASWXVUBNIDJ-NSHDSACASA-N 1 2 232.283 2.063 20 0 BEADLO Nc1ccc(COC(=O)[C@@H]2CC=CCC2)c[nH+]1 ZINC000922218709 643907353 /nfs/dbraw/zinc/90/73/53/643907353.db2.gz BXRASWXVUBNIDJ-LLVKDONJSA-N 1 2 232.283 2.063 20 0 BEADLO Cc1ncoc1C[NH2+]Cc1nc2c(s1)CCC2 ZINC000922473226 643999044 /nfs/dbraw/zinc/99/90/44/643999044.db2.gz SAKUFPDFCYRYCK-UHFFFAOYSA-N 1 2 249.339 2.218 20 0 BEADLO C[C@@H]1CC/C(=C\C(=O)OCc2ccc[nH+]c2N)C1 ZINC000922516389 644005554 /nfs/dbraw/zinc/00/55/54/644005554.db2.gz GEFCEIZEIPBPHQ-MXBGMFSPSA-N 1 2 246.310 2.453 20 0 BEADLO CC[C@@H]1C[C@H]1COC(=O)CCc1ccc(N)[nH+]c1 ZINC000922556332 644024730 /nfs/dbraw/zinc/02/47/30/644024730.db2.gz FXWSURBMKBROTM-NEPJUHHUSA-N 1 2 248.326 2.186 20 0 BEADLO C[C@H]1CC[C@H](C(=O)OCc2ccc(N)[nH+]c2)C1 ZINC000922585360 644036076 /nfs/dbraw/zinc/03/60/76/644036076.db2.gz FHELHQAZGIGKCZ-ONGXEEELSA-N 1 2 234.299 2.143 20 0 BEADLO Cn1ccnc1C[NH2+][C@@H](c1ccccn1)C1CC1 ZINC000922587137 644036237 /nfs/dbraw/zinc/03/62/37/644036237.db2.gz WUZQDEMBNRFIDB-CQSZACIVSA-N 1 2 242.326 2.056 20 0 BEADLO CC[C@@H](C)[C@@H](C)C(=O)OCc1ccc(N)[nH+]c1 ZINC000922594130 644038026 /nfs/dbraw/zinc/03/80/26/644038026.db2.gz UCAXTJQKZJOWOJ-NXEZZACHSA-N 1 2 236.315 2.389 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)OCc1ccc[nH+]c1N ZINC000922593642 644038122 /nfs/dbraw/zinc/03/81/22/644038122.db2.gz OUQWXKPNSLTROR-UWVGGRQHSA-N 1 2 236.315 2.389 20 0 BEADLO CC(C)C[C@@H](C)C(=O)OCc1ccc(N)[nH+]c1 ZINC000922613400 644042003 /nfs/dbraw/zinc/04/20/03/644042003.db2.gz HXCYONLNYQPIIC-SNVBAGLBSA-N 1 2 236.315 2.389 20 0 BEADLO Nc1ccc(COC(=O)C[C@@H]2C=CCCC2)c[nH+]1 ZINC000922623808 644043237 /nfs/dbraw/zinc/04/32/37/644043237.db2.gz ZHHYHXKAJHNTOR-LLVKDONJSA-N 1 2 246.310 2.453 20 0 BEADLO CC(C)[C@@]1(C)C[C@H]1C(=O)OCc1ccc(N)[nH+]c1 ZINC000922624033 644043463 /nfs/dbraw/zinc/04/34/63/644043463.db2.gz LLAQWQPTOXGZAG-SMDDNHRTSA-N 1 2 248.326 2.389 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ccnn1C)c1nccs1 ZINC000192251739 644141107 /nfs/dbraw/zinc/14/11/07/644141107.db2.gz HCHHDNRXAPFCKW-IUCAKERBSA-N 1 2 236.344 2.288 20 0 BEADLO CC[C@@H](C)[C@H](C(=O)OC)[N@H+](C)Cc1ccoc1 ZINC000929328128 644146723 /nfs/dbraw/zinc/14/67/23/644146723.db2.gz OIEHJHAUAFRCAX-ZYHUDNBSSA-N 1 2 239.315 2.299 20 0 BEADLO CC[C@@H](C)[C@H](C(=O)OC)[N@@H+](C)Cc1ccoc1 ZINC000929328128 644146728 /nfs/dbraw/zinc/14/67/28/644146728.db2.gz OIEHJHAUAFRCAX-ZYHUDNBSSA-N 1 2 239.315 2.299 20 0 BEADLO Nc1ccc(COC(=O)C2CCC=CCC2)c[nH+]1 ZINC000922925297 644188897 /nfs/dbraw/zinc/18/88/97/644188897.db2.gz OFEJHSGWMSWICH-UHFFFAOYSA-N 1 2 246.310 2.453 20 0 BEADLO CCc1onc(C)c1C[NH2+]Cc1nccs1 ZINC000922988108 644215627 /nfs/dbraw/zinc/21/56/27/644215627.db2.gz MKJRJUGYAMLNOJ-UHFFFAOYSA-N 1 2 237.328 2.292 20 0 BEADLO C[C@H](C(=O)O[C@H]1CC[N@H+](CCF)C1)C1CCC1 ZINC000838875542 644546831 /nfs/dbraw/zinc/54/68/31/644546831.db2.gz YJZDMBFLLIZOCH-JQWIXIFHSA-N 1 2 243.322 2.010 20 0 BEADLO C[C@H](C(=O)O[C@H]1CC[N@@H+](CCF)C1)C1CCC1 ZINC000838875542 644546835 /nfs/dbraw/zinc/54/68/35/644546835.db2.gz YJZDMBFLLIZOCH-JQWIXIFHSA-N 1 2 243.322 2.010 20 0 BEADLO CC(C)COC(=O)[C@H](C)[NH2+]C1CC2(CCC2)C1 ZINC000839043925 644554212 /nfs/dbraw/zinc/55/42/12/644554212.db2.gz VKQFHPNITKWQLK-NSHDSACASA-N 1 2 239.359 2.496 20 0 BEADLO CC/C(C)=C(\C)C(=O)N[C@H]1CCn2cc[nH+]c2C1 ZINC000779214999 644710687 /nfs/dbraw/zinc/71/06/87/644710687.db2.gz IVIQBVWMZXMDKA-IIANPFDCSA-N 1 2 247.342 2.061 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2CC[C@@H](C)C2)c(C)c[nH+]1 ZINC000782059440 644739553 /nfs/dbraw/zinc/73/95/53/644739553.db2.gz WYGYNHHYYTWDDO-BXKDBHETSA-N 1 2 247.342 2.430 20 0 BEADLO CC(C)[C@@H](C)C(=O)OCCCn1cc[nH+]c1 ZINC000783666682 644757652 /nfs/dbraw/zinc/75/76/52/644757652.db2.gz BEMMCGLWLWKTFO-LLVKDONJSA-N 1 2 224.304 2.109 20 0 BEADLO CS/C=C/C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000817458023 644983582 /nfs/dbraw/zinc/98/35/82/644983582.db2.gz AMOIGVYTAVJYJK-SNAWJCMRSA-N 1 2 236.340 2.191 20 0 BEADLO CC(C)CN(CC(C)C)C(=O)Cc1[nH]cc[nH+]1 ZINC000827481403 645079928 /nfs/dbraw/zinc/07/99/28/645079928.db2.gz MPZIOPMNUXEBNZ-UHFFFAOYSA-N 1 2 237.347 2.093 20 0 BEADLO Cc1nonc1[C@H](C)[NH2+]Cc1cnc(C)cc1C ZINC000926551068 645272866 /nfs/dbraw/zinc/27/28/66/645272866.db2.gz PWFFXIYRGHXSNP-JTQLQIEISA-N 1 2 246.314 2.241 20 0 BEADLO CCC[C@H](C)[C@@H](CO)[NH2+]CC(F)(F)C(F)F ZINC000844378796 645321286 /nfs/dbraw/zinc/32/12/86/645321286.db2.gz MLLOGDPUIYTKDT-JGVFFNPUSA-N 1 2 245.260 2.274 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cnc(C)cn2)[C@@H](CC)CO1 ZINC000844386224 645327569 /nfs/dbraw/zinc/32/75/69/645327569.db2.gz HXIZJDVGVUETIA-UONOGXRCSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cnc(C)cn2)[C@@H](CC)CO1 ZINC000844386224 645327573 /nfs/dbraw/zinc/32/75/73/645327573.db2.gz HXIZJDVGVUETIA-UONOGXRCSA-N 1 2 249.358 2.174 20 0 BEADLO C[C@@H]([NH2+]C[C@H]1CCN1C(C)(C)C)c1ncco1 ZINC000926670890 645348325 /nfs/dbraw/zinc/34/83/25/645348325.db2.gz GJKIXTAEYRJTQD-GHMZBOCLSA-N 1 2 237.347 2.198 20 0 BEADLO Cc1cccc(NC(=O)Cc2c[nH+]cn2C)c1F ZINC000558848311 645355701 /nfs/dbraw/zinc/35/57/01/645355701.db2.gz AXUUYWBOTQFFFM-UHFFFAOYSA-N 1 2 247.273 2.049 20 0 BEADLO CC/C=C\COC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000845448894 645362127 /nfs/dbraw/zinc/36/21/27/645362127.db2.gz MLRZHJVJILVMRX-WYGGZMRJSA-N 1 2 222.288 2.344 20 0 BEADLO CCN(C(=O)Cc1[nH]cc[nH+]1)c1ccccc1 ZINC000857436809 645556136 /nfs/dbraw/zinc/55/61/36/645556136.db2.gz JAGNWTRQDNQOMK-UHFFFAOYSA-N 1 2 229.283 2.005 20 0 BEADLO CCc1ccc(NC(=O)Cc2[nH]cc[nH+]2)cc1F ZINC000857476392 645572456 /nfs/dbraw/zinc/57/24/56/645572456.db2.gz XIWMFHIUOWHFBZ-UHFFFAOYSA-N 1 2 247.273 2.292 20 0 BEADLO Fc1cc(C[N@@H+]2C[C@@H]3C[C@@H]3C2)cnc1Cl ZINC000877650635 645806729 /nfs/dbraw/zinc/80/67/29/645806729.db2.gz SIDBCENIZBENKV-DTORHVGOSA-N 1 2 226.682 2.326 20 0 BEADLO Fc1cc(C[N@H+]2C[C@@H]3C[C@@H]3C2)cnc1Cl ZINC000877650635 645806732 /nfs/dbraw/zinc/80/67/32/645806732.db2.gz SIDBCENIZBENKV-DTORHVGOSA-N 1 2 226.682 2.326 20 0 BEADLO C[C@H]([NH2+]Cc1ccc2nonc2c1)c1ncco1 ZINC000886538108 645888092 /nfs/dbraw/zinc/88/80/92/645888092.db2.gz BNWQVMVVOLOUIG-QMMMGPOBSA-N 1 2 244.254 2.062 20 0 BEADLO C[C@@H](c1ccc(F)nc1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000929124469 645958027 /nfs/dbraw/zinc/95/80/27/645958027.db2.gz JFHCJCHQESAPCM-AXFHLTTASA-N 1 2 238.306 2.391 20 0 BEADLO C[C@@H](c1ccc(F)nc1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000929124469 645958031 /nfs/dbraw/zinc/95/80/31/645958031.db2.gz JFHCJCHQESAPCM-AXFHLTTASA-N 1 2 238.306 2.391 20 0 BEADLO Cc1cc(C)nc(C[N@@H+](C)Cc2cnn(C)c2)c1 ZINC000929132449 645963959 /nfs/dbraw/zinc/96/39/59/645963959.db2.gz HJYMRGIVQKKIHR-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cc(C)nc(C[N@H+](C)Cc2cnn(C)c2)c1 ZINC000929132449 645963962 /nfs/dbraw/zinc/96/39/62/645963962.db2.gz HJYMRGIVQKKIHR-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cc(C)nc(C[N@H+]2C[C@H](C)OC[C@H]2C)c1 ZINC000929181780 645990278 /nfs/dbraw/zinc/99/02/78/645990278.db2.gz HFTGGYUOAIBEMP-OLZOCXBDSA-N 1 2 234.343 2.308 20 0 BEADLO Cc1cc(C)nc(C[N@@H+]2C[C@H](C)OC[C@H]2C)c1 ZINC000929181780 645990282 /nfs/dbraw/zinc/99/02/82/645990282.db2.gz HFTGGYUOAIBEMP-OLZOCXBDSA-N 1 2 234.343 2.308 20 0 BEADLO CC1(C(=O)OCc2ccc(N)[nH+]c2)CC=CC1 ZINC000924205163 646007845 /nfs/dbraw/zinc/00/78/45/646007845.db2.gz QXJMRZOBJSQAMZ-UHFFFAOYSA-N 1 2 232.283 2.063 20 0 BEADLO CC(C)n1cc([C@@H](C)[NH2+]Cc2cccnc2)nn1 ZINC000924535891 646055257 /nfs/dbraw/zinc/05/52/57/646055257.db2.gz ZGEKYDWHEUIQLH-LLVKDONJSA-N 1 2 245.330 2.105 20 0 BEADLO COc1nnc(C[N@H+](C)CCC(C)C)s1 ZINC000929292357 646064260 /nfs/dbraw/zinc/06/42/60/646064260.db2.gz ATJUHDAXEOSGMF-UHFFFAOYSA-N 1 2 229.349 2.025 20 0 BEADLO COc1nnc(C[N@@H+](C)CCC(C)C)s1 ZINC000929292357 646064266 /nfs/dbraw/zinc/06/42/66/646064266.db2.gz ATJUHDAXEOSGMF-UHFFFAOYSA-N 1 2 229.349 2.025 20 0 BEADLO COc1nnc(C[NH+]2CCC(C)(C)CC2)s1 ZINC000929483603 646140442 /nfs/dbraw/zinc/14/04/42/646140442.db2.gz LOKLLKCWWKZYKC-UHFFFAOYSA-N 1 2 241.360 2.169 20 0 BEADLO C[C@H]([NH2+]Cc1cc[nH]n1)c1cc(O)cc(F)c1 ZINC000924994946 646155291 /nfs/dbraw/zinc/15/52/91/646155291.db2.gz YMTMCHBLQNEVSD-QMMMGPOBSA-N 1 2 235.262 2.105 20 0 BEADLO CC(=O)NCCCCC[N@H+](CC(F)F)C1CC1 ZINC000929598566 646189686 /nfs/dbraw/zinc/18/96/86/646189686.db2.gz PELVDAAEEPYBQD-UHFFFAOYSA-N 1 2 248.317 2.022 20 0 BEADLO CC(=O)NCCCCC[N@@H+](CC(F)F)C1CC1 ZINC000929598566 646189688 /nfs/dbraw/zinc/18/96/88/646189688.db2.gz PELVDAAEEPYBQD-UHFFFAOYSA-N 1 2 248.317 2.022 20 0 BEADLO COc1cccc(C[N@H+](C)Cc2cc[nH]n2)c1C ZINC000929624769 646210722 /nfs/dbraw/zinc/21/07/22/646210722.db2.gz OWFKAAIMSDODGM-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1cccc(C[N@@H+](C)Cc2cc[nH]n2)c1C ZINC000929624769 646210725 /nfs/dbraw/zinc/21/07/25/646210725.db2.gz OWFKAAIMSDODGM-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO CCc1ncc(C[N@@H+]2CCOC(C)(C)[C@@H]2C)o1 ZINC000929843886 646356208 /nfs/dbraw/zinc/35/62/08/646356208.db2.gz YWYHRPREOOWIJG-JTQLQIEISA-N 1 2 238.331 2.236 20 0 BEADLO CCc1ncc(C[N@H+]2CCOC(C)(C)[C@@H]2C)o1 ZINC000929843886 646356214 /nfs/dbraw/zinc/35/62/14/646356214.db2.gz YWYHRPREOOWIJG-JTQLQIEISA-N 1 2 238.331 2.236 20 0 BEADLO c1cn(C[C@H]2CCCC3(CCC3)O2)c[nH+]1 ZINC000929865329 646363582 /nfs/dbraw/zinc/36/35/82/646363582.db2.gz BXLKZCCUNBPBPS-LLVKDONJSA-N 1 2 206.289 2.375 20 0 BEADLO CCCN(CC)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000930027784 646400442 /nfs/dbraw/zinc/40/04/42/646400442.db2.gz YXUWGVYZFVDTFJ-UHFFFAOYSA-N 1 2 231.299 2.435 20 0 BEADLO COc1nnc(C[N@@H+]2CC[C@@H](C)[C@H](C)C2)s1 ZINC000930145006 646457407 /nfs/dbraw/zinc/45/74/07/646457407.db2.gz HFFALROBLKOJCI-RKDXNWHRSA-N 1 2 241.360 2.025 20 0 BEADLO COc1nnc(C[N@H+]2CC[C@@H](C)[C@H](C)C2)s1 ZINC000930145006 646457408 /nfs/dbraw/zinc/45/74/08/646457408.db2.gz HFFALROBLKOJCI-RKDXNWHRSA-N 1 2 241.360 2.025 20 0 BEADLO COc1nnc(C[N@@H+]2CC[C@@H](C)[C@@H](C)C2)s1 ZINC000930144876 646457783 /nfs/dbraw/zinc/45/77/83/646457783.db2.gz HFFALROBLKOJCI-BDAKNGLRSA-N 1 2 241.360 2.025 20 0 BEADLO COc1nnc(C[N@H+]2CC[C@@H](C)[C@@H](C)C2)s1 ZINC000930144876 646457785 /nfs/dbraw/zinc/45/77/85/646457785.db2.gz HFFALROBLKOJCI-BDAKNGLRSA-N 1 2 241.360 2.025 20 0 BEADLO C[C@H]([NH2+]Cc1nncs1)c1ccccc1 ZINC000930183826 646482518 /nfs/dbraw/zinc/48/25/18/646482518.db2.gz XVXDHTJSUAXALM-VIFPVBQESA-N 1 2 219.313 2.389 20 0 BEADLO CSC1CC([NH2+]C2(C(F)F)CC2)C1 ZINC000926365147 646626252 /nfs/dbraw/zinc/62/62/52/646626252.db2.gz TXXKBPBIARQXES-UHFFFAOYSA-N 1 2 207.289 2.268 20 0 BEADLO C[C@@H]([NH2+]C1(C(F)F)CC1)c1cc[nH]c(=O)c1 ZINC000926367697 646626295 /nfs/dbraw/zinc/62/62/95/646626295.db2.gz NIOCUDBSHIZQLY-SSDOTTSWSA-N 1 2 228.242 2.236 20 0 BEADLO O[C@@H](C[N@H+](Cc1ccoc1)C1CC1)C(F)(F)F ZINC000723768411 711536781 /nfs/dbraw/zinc/53/67/81/711536781.db2.gz CTDBHTPJWMUBDK-JTQLQIEISA-N 1 2 249.232 2.167 20 0 BEADLO O[C@@H](C[N@@H+](Cc1ccoc1)C1CC1)C(F)(F)F ZINC000723768411 711536782 /nfs/dbraw/zinc/53/67/82/711536782.db2.gz CTDBHTPJWMUBDK-JTQLQIEISA-N 1 2 249.232 2.167 20 0 BEADLO Cc1ccc(NC(=O)C[C@H]([NH3+])C(F)F)cc1F ZINC000724741159 711609960 /nfs/dbraw/zinc/60/99/60/711609960.db2.gz USWBXDOJRYNXTG-VIFPVBQESA-N 1 2 246.232 2.055 20 0 BEADLO CCc1cc(N2CC(C)(C)C2)nc(CC)[nH+]1 ZINC000893575653 711738998 /nfs/dbraw/zinc/73/89/98/711738998.db2.gz HSBSETAVCDEDBC-UHFFFAOYSA-N 1 2 219.332 2.448 20 0 BEADLO COc1ccc(NCc2c[nH+]cn2C)cc1 ZINC000082416858 711906620 /nfs/dbraw/zinc/90/66/20/711906620.db2.gz IOMVZQYCRKHRNT-UHFFFAOYSA-N 1 2 217.272 2.041 20 0 BEADLO COC(C)(C)[C@H](C)[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000707230261 712166705 /nfs/dbraw/zinc/16/67/05/712166705.db2.gz ORMZQVLWDLBQNH-UWVGGRQHSA-N 1 2 245.363 2.120 20 0 BEADLO COC(C)(C)CC[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000707230675 712167216 /nfs/dbraw/zinc/16/72/16/712167216.db2.gz SMPANBUKCLIXHW-JTQLQIEISA-N 1 2 245.363 2.121 20 0 BEADLO CC[N@H+](C/C(Cl)=C\Cl)[C@@H]1CCOC1 ZINC000379387812 712380361 /nfs/dbraw/zinc/38/03/61/712380361.db2.gz IGBFIXVXVWXNJL-WHXYTISESA-N 1 2 224.131 2.416 20 0 BEADLO CC[N@@H+](C/C(Cl)=C\Cl)[C@@H]1CCOC1 ZINC000379387812 712380364 /nfs/dbraw/zinc/38/03/64/712380364.db2.gz IGBFIXVXVWXNJL-WHXYTISESA-N 1 2 224.131 2.416 20 0 BEADLO CCC[N@H+](C)Cc1cn(C)nc1Br ZINC000713817182 712472728 /nfs/dbraw/zinc/47/27/28/712472728.db2.gz MILAHUMQHBYADB-UHFFFAOYSA-N 1 2 246.152 2.024 20 0 BEADLO CCC[N@@H+](C)Cc1cn(C)nc1Br ZINC000713817182 712472730 /nfs/dbraw/zinc/47/27/30/712472730.db2.gz MILAHUMQHBYADB-UHFFFAOYSA-N 1 2 246.152 2.024 20 0 BEADLO CC1(C)CCC[C@H](C[N@@H+]2CCCC[C@H]2C[NH3+])O1 ZINC000714332676 712482171 /nfs/dbraw/zinc/48/21/71/712482171.db2.gz XOONDTDWMVOKRK-QWHCGFSZSA-N 1 2 240.391 2.147 20 0 BEADLO CC1(C)CCC[C@H](C[N@H+]2CCCC[C@H]2C[NH3+])O1 ZINC000714332676 712482174 /nfs/dbraw/zinc/48/21/74/712482174.db2.gz XOONDTDWMVOKRK-QWHCGFSZSA-N 1 2 240.391 2.147 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@H](C)c2ccns2)n1 ZINC000715968912 712546066 /nfs/dbraw/zinc/54/60/66/712546066.db2.gz WLRRHAFSRVVZPM-MRVPVSSYSA-N 1 2 222.317 2.025 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cn(C)cn1)c1ccns1 ZINC000716034232 712547156 /nfs/dbraw/zinc/54/71/56/712547156.db2.gz QLKXUGVXSWVMGC-DTWKUNHWSA-N 1 2 236.344 2.288 20 0 BEADLO CNc1cc(N[C@H](C)c2ccns2)nc[nH+]1 ZINC000717421694 712657456 /nfs/dbraw/zinc/65/74/56/712657456.db2.gz QPLPRHVDEFMZDR-SSDOTTSWSA-N 1 2 235.316 2.148 20 0 BEADLO CNc1cc(N[C@H](C)c2ccns2)[nH+]cn1 ZINC000717421694 712657457 /nfs/dbraw/zinc/65/74/57/712657457.db2.gz QPLPRHVDEFMZDR-SSDOTTSWSA-N 1 2 235.316 2.148 20 0 BEADLO Cc1nc(NC[C@@H]2CC(C)(C)CO2)cc[nH+]1 ZINC000717568704 712661136 /nfs/dbraw/zinc/66/11/36/712661136.db2.gz PGEGVLVYVCWDQM-JTQLQIEISA-N 1 2 221.304 2.012 20 0 BEADLO CC1(C)CO[C@H](CNc2cccc[nH+]2)C1 ZINC000717568818 712661140 /nfs/dbraw/zinc/66/11/40/712661140.db2.gz PSNTYHKIMAPGFX-JTQLQIEISA-N 1 2 206.289 2.309 20 0 BEADLO CCC(CC)C[N@@H+]1CCC[C@H]1c1nc[nH]n1 ZINC000931142422 712713447 /nfs/dbraw/zinc/71/34/47/712713447.db2.gz MXYLLFGMQNJBFB-NSHDSACASA-N 1 2 222.336 2.378 20 0 BEADLO CCC(CC)C[N@H+]1CCC[C@H]1c1nc[nH]n1 ZINC000931142422 712713448 /nfs/dbraw/zinc/71/34/48/712713448.db2.gz MXYLLFGMQNJBFB-NSHDSACASA-N 1 2 222.336 2.378 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@@H]1CCC=CO1 ZINC000381475119 710642669 /nfs/dbraw/zinc/64/26/69/710642669.db2.gz QGLXDRVRMAOWMO-ONGXEEELSA-N 1 2 221.304 2.061 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]C[C@H]1CCC=CO1 ZINC000381475117 710642719 /nfs/dbraw/zinc/64/27/19/710642719.db2.gz QGLXDRVRMAOWMO-MWLCHTKSSA-N 1 2 221.304 2.061 20 0 BEADLO CC(C)=CC[NH+]1CC(N(C)C(=O)C2CC=CC2)C1 ZINC001042560959 710792052 /nfs/dbraw/zinc/79/20/52/710792052.db2.gz QNSPUTXMABYDSG-UHFFFAOYSA-N 1 2 248.370 2.061 20 0 BEADLO C[C@H]1OCC[N@H+](Cc2ccc(O)c(F)c2)[C@H]1C ZINC000380567428 712901602 /nfs/dbraw/zinc/90/16/02/712901602.db2.gz ZMAORICCVBRYEQ-VHSXEESVSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@H]1OCC[N@@H+](Cc2ccc(O)c(F)c2)[C@H]1C ZINC000380567428 712901603 /nfs/dbraw/zinc/90/16/03/712901603.db2.gz ZMAORICCVBRYEQ-VHSXEESVSA-N 1 2 239.290 2.141 20 0 BEADLO CC[C@H]([NH2+]CC(F)(F)C(F)F)[C@@H]1CCCO1 ZINC000390768693 711133160 /nfs/dbraw/zinc/13/31/60/711133160.db2.gz TXSSNRJZWIWNQJ-YUMQZZPRSA-N 1 2 243.244 2.434 20 0 BEADLO CC[C@@H]([NH2+]CC(F)(F)C(F)F)[C@H]1CCCO1 ZINC000390768688 711133724 /nfs/dbraw/zinc/13/37/24/711133724.db2.gz TXSSNRJZWIWNQJ-HTQZYQBOSA-N 1 2 243.244 2.434 20 0 BEADLO CC[NH2+]Cc1noc([C@H](C)C(C)(C)C)n1 ZINC000399083150 711420860 /nfs/dbraw/zinc/42/08/60/711420860.db2.gz SXZRXMRHHIDNOU-QMMMGPOBSA-N 1 2 211.309 2.329 20 0 BEADLO CCc1cc(C[NH2+][C@@H](C)c2cscn2)[nH]n1 ZINC000381197152 710608490 /nfs/dbraw/zinc/60/84/90/710608490.db2.gz BJFISDBHMLKZNZ-QMMMGPOBSA-N 1 2 236.344 2.279 20 0 BEADLO CCc1ccccc1NC(=O)C[C@@H]([NH3+])C(F)F ZINC000724763281 710745983 /nfs/dbraw/zinc/74/59/83/710745983.db2.gz WSZTWXKXNCJBTN-SECBINFHSA-N 1 2 242.269 2.170 20 0 BEADLO Cc1cnccc1C[NH2+]Cc1nc(C#N)cs1 ZINC000385995522 711020534 /nfs/dbraw/zinc/02/05/34/711020534.db2.gz BPYLTZBCULXCJU-UHFFFAOYSA-N 1 2 244.323 2.008 20 0 BEADLO CCCOC(=O)NCc1c[nH+]c(C)cc1C ZINC000397094430 711377201 /nfs/dbraw/zinc/37/72/01/711377201.db2.gz MKVMRIXQKLDWJW-UHFFFAOYSA-N 1 2 222.288 2.335 20 0 BEADLO COc1ccc([C@H](C)[NH2+]Cc2cnsn2)cc1 ZINC000399898955 711436680 /nfs/dbraw/zinc/43/66/80/711436680.db2.gz SHVCCUJHLKJNMT-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2CCC[C@@H](C)C2)n1 ZINC000383224460 711476855 /nfs/dbraw/zinc/47/68/55/711476855.db2.gz GFKXKNGGWWVWCQ-NXEZZACHSA-N 1 2 223.320 2.473 20 0 BEADLO CC[NH2+]Cc1noc([C@H]2CCC[C@@H](C)C2)n1 ZINC000383224463 711477112 /nfs/dbraw/zinc/47/71/12/711477112.db2.gz GFKXKNGGWWVWCQ-ZJUUUORDSA-N 1 2 223.320 2.473 20 0 BEADLO Cc1cn(C)nc1C[NH2+][C@@H](C)c1cncc(F)c1 ZINC000723494936 711513266 /nfs/dbraw/zinc/51/32/66/711513266.db2.gz QXYODHQCOJXOTF-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO Cc1nc(N[C@@H](C2CC2)[C@H]2CCCOC2)cc[nH+]1 ZINC000723869767 711540917 /nfs/dbraw/zinc/54/09/17/711540917.db2.gz UBDRPWITCNEMTJ-JSGCOSHPSA-N 1 2 247.342 2.402 20 0 BEADLO Cc1nc(N[C@H](C2CC2)[C@H]2CCCOC2)cc[nH+]1 ZINC000723869766 711541051 /nfs/dbraw/zinc/54/10/51/711541051.db2.gz UBDRPWITCNEMTJ-GXTWGEPZSA-N 1 2 247.342 2.402 20 0 BEADLO CC(C)C[C@@H]1CCCN1C(=O)C[C@H]([NH3+])C(F)F ZINC000724695155 711608716 /nfs/dbraw/zinc/60/87/16/711608716.db2.gz AXXFTHXUKJDRPC-UWVGGRQHSA-N 1 2 248.317 2.006 20 0 BEADLO CCCCC[C@@H](C)NC(=O)C[C@@H]([NH3+])C(F)F ZINC000724693123 711609100 /nfs/dbraw/zinc/60/91/00/711609100.db2.gz OLPFAJAQEWKIGP-RKDXNWHRSA-N 1 2 236.306 2.054 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1CC[C@H](C2CC2)O1 ZINC000722326659 711737834 /nfs/dbraw/zinc/73/78/34/711737834.db2.gz WKVOSMMINGEYMS-VXGBXAGGSA-N 1 2 248.326 2.460 20 0 BEADLO CCc1cc(N2CC(C)(COC)C2)nc(CC)[nH+]1 ZINC000893572280 711738292 /nfs/dbraw/zinc/73/82/92/711738292.db2.gz FWBPCMVEUYYRLL-UHFFFAOYSA-N 1 2 249.358 2.074 20 0 BEADLO c1ccc(NC[C@@H]2CC[C@H](C3CC3)O2)[nH+]c1 ZINC000722335464 711739282 /nfs/dbraw/zinc/73/92/82/711739282.db2.gz HXKNACPPBZBNPW-NWDGAFQWSA-N 1 2 218.300 2.451 20 0 BEADLO CC[C@@H](C)[C@@H]([NH2+]CCC(C)(F)F)C(=O)OC ZINC000450725975 711946271 /nfs/dbraw/zinc/94/62/71/711946271.db2.gz SPXXGCVTWCXXCT-RKDXNWHRSA-N 1 2 237.290 2.209 20 0 BEADLO CC[C@@H](C)[C@H]([NH2+]CCC(C)(F)F)C(=O)OC ZINC000450725972 711946063 /nfs/dbraw/zinc/94/60/63/711946063.db2.gz SPXXGCVTWCXXCT-BDAKNGLRSA-N 1 2 237.290 2.209 20 0 BEADLO CNc1cc(N2CC[C@@H](C)[C@@H](C)C2)nc[nH+]1 ZINC000132214964 711955616 /nfs/dbraw/zinc/95/56/16/711955616.db2.gz MHVJKHFUNYOTBE-ZJUUUORDSA-N 1 2 220.320 2.001 20 0 BEADLO CNc1cc(N2CC[C@@H](C)[C@@H](C)C2)[nH+]cn1 ZINC000132214964 711955617 /nfs/dbraw/zinc/95/56/17/711955617.db2.gz MHVJKHFUNYOTBE-ZJUUUORDSA-N 1 2 220.320 2.001 20 0 BEADLO CNc1cc(N2CCCC[C@@H](C)C2)nc[nH+]1 ZINC000703291093 712070483 /nfs/dbraw/zinc/07/04/83/712070483.db2.gz MQCWTCPXPCECSI-SNVBAGLBSA-N 1 2 220.320 2.145 20 0 BEADLO CNc1cc(N2CCCC[C@@H](C)C2)[nH+]cn1 ZINC000703291093 712070484 /nfs/dbraw/zinc/07/04/84/712070484.db2.gz MQCWTCPXPCECSI-SNVBAGLBSA-N 1 2 220.320 2.145 20 0 BEADLO CCOC(=O)C[NH2+][C@H](C)[C@]12C[C@H]1CCCC2 ZINC000709131595 712209761 /nfs/dbraw/zinc/20/97/61/712209761.db2.gz OYPOXCBJRPDUCD-WZRBSPASSA-N 1 2 225.332 2.108 20 0 BEADLO Cc1[nH]ncc1C[NH2+]C[C@@H]1CCC(C)(C)CO1 ZINC000711393096 712297285 /nfs/dbraw/zinc/29/72/85/712297285.db2.gz VRAAFRMMCPGKRW-LBPRGKRZSA-N 1 2 237.347 2.013 20 0 BEADLO CCCNc1cc(N2CC[C@H](CF)C2)nc[nH+]1 ZINC000711435333 712300135 /nfs/dbraw/zinc/30/01/35/712300135.db2.gz OACACPXYHZFADQ-SNVBAGLBSA-N 1 2 238.310 2.094 20 0 BEADLO CCCNc1cc(N2CC[C@H](CF)C2)[nH+]cn1 ZINC000711435333 712300136 /nfs/dbraw/zinc/30/01/36/712300136.db2.gz OACACPXYHZFADQ-SNVBAGLBSA-N 1 2 238.310 2.094 20 0 BEADLO Cc1nc(N[C@H](C2CCC2)[C@H]2CCOC2)cc[nH+]1 ZINC000711869896 712337043 /nfs/dbraw/zinc/33/70/43/712337043.db2.gz MDHWWOHFPVOOMH-GXTWGEPZSA-N 1 2 247.342 2.402 20 0 BEADLO Cc1nc(N[C@H](C2CCC2)[C@@H]2CCOC2)cc[nH+]1 ZINC000711869899 712337646 /nfs/dbraw/zinc/33/76/46/712337646.db2.gz MDHWWOHFPVOOMH-TZMCWYRMSA-N 1 2 247.342 2.402 20 0 BEADLO CCCC1(c2nc(C[NH2+]CC)no2)CC1 ZINC000379787998 712399349 /nfs/dbraw/zinc/39/93/49/712399349.db2.gz GBPAUFVDBOMLKX-UHFFFAOYSA-N 1 2 209.293 2.011 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCCc2occc21)c1cn(C)nn1 ZINC000715849925 712535812 /nfs/dbraw/zinc/53/58/12/712535812.db2.gz HAEANUQELRURBC-GXSJLCMTSA-N 1 2 246.314 2.136 20 0 BEADLO C[C@@H](Nc1ccc([NH+](C)C)cc1)c1cn(C)nn1 ZINC000715852476 712536291 /nfs/dbraw/zinc/53/62/91/712536291.db2.gz OZGHIPUPUUXSOH-SNVBAGLBSA-N 1 2 245.330 2.054 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccccc1F)c1cn(C)nn1 ZINC000715876947 712538570 /nfs/dbraw/zinc/53/85/70/712538570.db2.gz JBDHLPCDLXFNRR-VHSXEESVSA-N 1 2 248.305 2.366 20 0 BEADLO CCn1ccnc1C[NH2+][C@@H](C)c1ccns1 ZINC000716034560 712547762 /nfs/dbraw/zinc/54/77/62/712547762.db2.gz QSQWTGMVKLILIF-VIFPVBQESA-N 1 2 236.344 2.210 20 0 BEADLO Cn1ncc2c1nc[nH+]c2NCCCCC1CC1 ZINC000716401541 712558384 /nfs/dbraw/zinc/55/83/84/712558384.db2.gz PWZZSFHBRRECLU-UHFFFAOYSA-N 1 2 245.330 2.356 20 0 BEADLO Cc1cn[nH]c1C[NH2+][C@@H]1CCCc2cccnc21 ZINC000716438207 712560527 /nfs/dbraw/zinc/56/05/27/712560527.db2.gz BZKLKYMPQDIXFL-GFCCVEGCSA-N 1 2 242.326 2.280 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@@H]1CCCc2cccnc21 ZINC000716438207 712560528 /nfs/dbraw/zinc/56/05/28/712560528.db2.gz BZKLKYMPQDIXFL-GFCCVEGCSA-N 1 2 242.326 2.280 20 0 BEADLO COc1ccc[nH+]c1NCc1[nH]nc(C)c1C ZINC000716450328 712561958 /nfs/dbraw/zinc/56/19/58/712561958.db2.gz HAKWUCVVKKDVLV-UHFFFAOYSA-N 1 2 232.287 2.042 20 0 BEADLO Cc1nc(NC[C@@H]2C[C@@H]2[C@H]2C[C@H]2C)cc[nH+]1 ZINC000716591646 712564544 /nfs/dbraw/zinc/56/45/44/712564544.db2.gz LNUYBWXFEDNNGG-QTKMDUPCSA-N 1 2 217.316 2.489 20 0 BEADLO C[C@@H]1CC[C@H](OC(=O)CCc2ccc(N)[nH+]c2)C1 ZINC000815224291 712588510 /nfs/dbraw/zinc/58/85/10/712588510.db2.gz SMORIZQOIZECFV-PWSUYJOCSA-N 1 2 248.326 2.328 20 0 BEADLO CCN1CC[NH+](CCOc2ccccc2C)CC1 ZINC000041301984 712719544 /nfs/dbraw/zinc/71/95/44/712719544.db2.gz BLWKPZUZNSVYDA-UHFFFAOYSA-N 1 2 248.370 2.011 20 0 BEADLO Cc1cc(NC(=O)[C@H](O)c2ccccc2)cc[nH+]1 ZINC000081386635 712730005 /nfs/dbraw/zinc/73/00/05/712730005.db2.gz HBJXVNZXDPFFGF-CYBMUJFWSA-N 1 2 242.278 2.062 20 0 BEADLO COC(C)(C)[C@@H](C)Nc1cc[nH+]c(C)n1 ZINC000720231407 712829488 /nfs/dbraw/zinc/82/94/88/712829488.db2.gz HBBSFNSFLDSKGV-MRVPVSSYSA-N 1 2 209.293 2.010 20 0 BEADLO CC1(O)CCC(Nc2cccc[nH+]2)CC1 ZINC000380225240 712831012 /nfs/dbraw/zinc/83/10/12/712831012.db2.gz KCIJGGNLSANTFR-UHFFFAOYSA-N 1 2 206.289 2.187 20 0 BEADLO Cc1cc(C[NH+]2CC(C)(O)C2)cc(C)c1F ZINC001143376762 957298921 /nfs/dbraw/zinc/29/89/21/957298921.db2.gz GVDKXCUDWPEWMA-UHFFFAOYSA-N 1 2 223.291 2.009 20 0 BEADLO CC[NH2+]Cc1noc([C@@H]2CCCCS2)n1 ZINC000087682132 958036015 /nfs/dbraw/zinc/03/60/15/958036015.db2.gz DCVHGSAAQSBIMC-QMMMGPOBSA-N 1 2 227.333 2.137 20 0 BEADLO Cc1ccc(O[C@H]2C[NH2+]CC2(F)F)c(F)c1F ZINC001218230741 959909011 /nfs/dbraw/zinc/90/90/11/959909011.db2.gz COIPQZZNQGKQGG-QMMMGPOBSA-N 1 2 249.207 2.259 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2cc(Cl)ncc2F)C1 ZINC001140606081 960456237 /nfs/dbraw/zinc/45/62/37/960456237.db2.gz WAYZVLLLOFLABL-SECBINFHSA-N 1 2 244.697 2.095 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@H](F)CC2)n[nH]1 ZINC001203069774 960612615 /nfs/dbraw/zinc/61/26/15/960612615.db2.gz CXCSSTQPELPYOA-JTQLQIEISA-N 1 2 211.284 2.042 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@H](F)CC2)n[nH]1 ZINC001203069774 960612628 /nfs/dbraw/zinc/61/26/28/960612628.db2.gz CXCSSTQPELPYOA-JTQLQIEISA-N 1 2 211.284 2.042 20 0 BEADLO C[C@H]1CC[N@@H+]1Cc1cc(F)c(O)c(F)c1 ZINC001140988053 960783174 /nfs/dbraw/zinc/78/31/74/960783174.db2.gz LGAMQNWSKVQVNE-ZETCQYMHSA-N 1 2 213.227 2.265 20 0 BEADLO C[C@H]1CC[N@H+]1Cc1cc(F)c(O)c(F)c1 ZINC001140988053 960783183 /nfs/dbraw/zinc/78/31/83/960783183.db2.gz LGAMQNWSKVQVNE-ZETCQYMHSA-N 1 2 213.227 2.265 20 0 BEADLO [NH2+]=CNc1cc(C2CC2)nc(C2CC2)n1 ZINC001167864053 961332724 /nfs/dbraw/zinc/33/27/24/961332724.db2.gz AGEKTWKFFFXHRJ-UHFFFAOYSA-N 1 2 202.261 2.250 20 0 BEADLO CC[C@@H](CO)Nc1cc(C(C)C)[nH+]c(C)n1 ZINC000709786226 961566231 /nfs/dbraw/zinc/56/62/31/961566231.db2.gz UYXHARKYVPIFTG-JTQLQIEISA-N 1 2 223.320 2.091 20 0 BEADLO OCC[N@@H+](Cc1csc(Cl)n1)CC1CC1 ZINC000688337188 963179224 /nfs/dbraw/zinc/17/92/24/963179224.db2.gz JNEMSLQPCQAPRN-UHFFFAOYSA-N 1 2 246.763 2.001 20 0 BEADLO OCC[N@H+](Cc1csc(Cl)n1)CC1CC1 ZINC000688337188 963179229 /nfs/dbraw/zinc/17/92/29/963179229.db2.gz JNEMSLQPCQAPRN-UHFFFAOYSA-N 1 2 246.763 2.001 20 0 BEADLO Nc1[nH+]c(NC[C@H]2CCCCO2)ccc1Cl ZINC001156380932 963329991 /nfs/dbraw/zinc/32/99/91/963329991.db2.gz LPNSZISNOFGRAL-MRVPVSSYSA-N 1 2 241.722 2.298 20 0 BEADLO Cc1c(F)cc[nH+]c1NCCOC(F)(F)F ZINC001157390906 963590205 /nfs/dbraw/zinc/59/02/05/963590205.db2.gz KXIFEEIXTBXROU-UHFFFAOYSA-N 1 2 238.184 2.477 20 0 BEADLO C[C@@H](C[NH+]1CCOCC1)OCC[Si](C)(C)C ZINC001224907804 965066716 /nfs/dbraw/zinc/06/67/16/965066716.db2.gz WUCOHPHLFNVNDK-LBPRGKRZSA-N 1 2 245.439 2.062 20 0 BEADLO CSCCCNc1[nH+]cnc2[nH]cc(F)c21 ZINC001163868865 965610333 /nfs/dbraw/zinc/61/03/33/965610333.db2.gz GEUWJUNFVWYHBM-UHFFFAOYSA-N 1 2 240.307 2.214 20 0 BEADLO COc1cc(C)c(Nc2c[nH+]c(C)c(N)c2)cn1 ZINC001210286731 1165862221 /nfs/dbraw/zinc/86/22/21/1165862221.db2.gz AQHUTMXFIWFGRW-UHFFFAOYSA-N 1 2 244.298 2.428 20 0 BEADLO Cc1ncsc1C[N@@H+]1CCCCC12COC2 ZINC001206989621 1165866504 /nfs/dbraw/zinc/86/65/04/1165866504.db2.gz KDSDHKNKLPSJBD-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO Cc1ncsc1C[N@H+]1CCCCC12COC2 ZINC001206989621 1165866505 /nfs/dbraw/zinc/86/65/05/1165866505.db2.gz KDSDHKNKLPSJBD-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO CCOc1cc(C[NH+]2CCC2)c(Cl)cn1 ZINC001250303666 967646455 /nfs/dbraw/zinc/64/64/55/967646455.db2.gz NXYIFXUVKWVOEH-UHFFFAOYSA-N 1 2 226.707 2.339 20 0 BEADLO C[C@@H]([NH2+]Cc1cccc2c1OCC2)c1ncc[nH]1 ZINC000693156857 1165884697 /nfs/dbraw/zinc/88/46/97/1165884697.db2.gz WJVJFYQNFDTGFF-SNVBAGLBSA-N 1 2 243.310 2.195 20 0 BEADLO Cc1ccc(F)c(C[N@H+](C)C2(C)COC2)c1 ZINC001205654620 967741770 /nfs/dbraw/zinc/74/17/70/967741770.db2.gz BPOTZXUDLXVQQX-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO CNc1ccc(Nc2cnc(Cl)cn2)c[nH+]1 ZINC001203449006 968109132 /nfs/dbraw/zinc/10/91/32/968109132.db2.gz VJLFNKFTYPOBJW-UHFFFAOYSA-N 1 2 235.678 2.310 20 0 BEADLO CC(C)[C@H]1CCCN1C(=O)[C@H](C)n1cc[nH+]c1 ZINC000063833032 1166026695 /nfs/dbraw/zinc/02/66/95/1166026695.db2.gz HLOMIKFVJZGHII-NWDGAFQWSA-N 1 2 235.331 2.091 20 0 BEADLO Nc1cc(-c2ccc(O)c(F)c2)cc[nH+]1 ZINC000082729975 1166077241 /nfs/dbraw/zinc/07/72/41/1166077241.db2.gz INPRLSXXSXBXDX-UHFFFAOYSA-N 1 2 204.204 2.176 20 0 BEADLO Cc1cc(F)ccc1[C@H](O)C[N@H+](C)CCC#N ZINC000083218576 1166097844 /nfs/dbraw/zinc/09/78/44/1166097844.db2.gz BLOPBGFPGBGSHZ-CYBMUJFWSA-N 1 2 236.290 2.013 20 0 BEADLO Cc1cc(F)ccc1[C@H](O)C[N@@H+](C)CCC#N ZINC000083218576 1166097847 /nfs/dbraw/zinc/09/78/47/1166097847.db2.gz BLOPBGFPGBGSHZ-CYBMUJFWSA-N 1 2 236.290 2.013 20 0 BEADLO CN(C)CC[N@@H+]1CCSc2ccccc2C1 ZINC001208129883 969030686 /nfs/dbraw/zinc/03/06/86/969030686.db2.gz LLDJKJGPRMVSRU-UHFFFAOYSA-N 1 2 236.384 2.156 20 0 BEADLO CN(C)CC[N@H+]1CCSc2ccccc2C1 ZINC001208129883 969030696 /nfs/dbraw/zinc/03/06/96/969030696.db2.gz LLDJKJGPRMVSRU-UHFFFAOYSA-N 1 2 236.384 2.156 20 0 BEADLO C[NH+]1CC(Oc2ccc(OC(F)(F)F)cc2)C1 ZINC000224586836 1166289754 /nfs/dbraw/zinc/28/97/54/1166289754.db2.gz RFRWIHUXOAQDSA-UHFFFAOYSA-N 1 2 247.216 2.278 20 0 BEADLO CC(C)OC1C[NH+](C[C@H](C)C(F)(F)F)C1 ZINC001208890798 969282931 /nfs/dbraw/zinc/28/29/31/969282931.db2.gz HXZRRMXHVSNZRH-QMMMGPOBSA-N 1 2 225.254 2.294 20 0 BEADLO Oc1ccc(C[N@@H+]2CC[C@@H](F)C2)cc1F ZINC000689849720 1166365734 /nfs/dbraw/zinc/36/57/34/1166365734.db2.gz PKLDHEXJQOOAPO-SECBINFHSA-N 1 2 213.227 2.075 20 0 BEADLO Oc1ccc(C[N@H+]2CC[C@@H](F)C2)cc1F ZINC000689849720 1166365739 /nfs/dbraw/zinc/36/57/39/1166365739.db2.gz PKLDHEXJQOOAPO-SECBINFHSA-N 1 2 213.227 2.075 20 0 BEADLO Cc1ccc(N[C@@H]2CCO[C@@H]2C)c(C)[nH+]1 ZINC000134397053 1166426416 /nfs/dbraw/zinc/42/64/16/1166426416.db2.gz NEACPAHFYCXAGP-ZYHUDNBSSA-N 1 2 206.289 2.288 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CCC2(CC2)CC1 ZINC001209552037 969536328 /nfs/dbraw/zinc/53/63/28/969536328.db2.gz FDYAPNUBWZAJEE-UHFFFAOYSA-N 1 2 205.305 2.094 20 0 BEADLO CC[N@H+](Cc1cnc(Cl)cc1C)C1COC1 ZINC001209635490 969568999 /nfs/dbraw/zinc/56/89/99/969568999.db2.gz GEPDTSLIAQNZIW-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO CC[N@@H+](Cc1cnc(Cl)cc1C)C1COC1 ZINC001209635490 969569002 /nfs/dbraw/zinc/56/90/02/969569002.db2.gz GEPDTSLIAQNZIW-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO CCOC(=O)[C@@H]([NH2+][C@@H]1CCSC1)[C@@H](C)CC ZINC001255270481 970022756 /nfs/dbraw/zinc/02/27/56/970022756.db2.gz DYFFIENHETUAEX-AXFHLTTASA-N 1 2 245.388 2.059 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1c(N)cccc1F ZINC000109427291 1166603180 /nfs/dbraw/zinc/60/31/80/1166603180.db2.gz LACPXCJQJBQRFO-SNVBAGLBSA-N 1 2 238.306 2.019 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1c(N)cccc1F ZINC000109427291 1166603184 /nfs/dbraw/zinc/60/31/84/1166603184.db2.gz LACPXCJQJBQRFO-SNVBAGLBSA-N 1 2 238.306 2.019 20 0 BEADLO Cc1nc(N[C@@H](C)c2ccc[nH]2)cc[nH+]1 ZINC000309103326 1166624835 /nfs/dbraw/zinc/62/48/35/1166624835.db2.gz GVVQWDJDNLFODI-QMMMGPOBSA-N 1 2 202.261 2.286 20 0 BEADLO Cc1cc(C)c(Nc2ccnn2C)c[nH+]1 ZINC001213503531 970333111 /nfs/dbraw/zinc/33/31/11/970333111.db2.gz KYHBYTKQYTZZNH-UHFFFAOYSA-N 1 2 202.261 2.176 20 0 BEADLO Cc1[nH+]c(N)ccc1CNc1ccc(=S)[nH]c1 ZINC001167786270 1166768722 /nfs/dbraw/zinc/76/87/22/1166768722.db2.gz PDLAXRQHPRIIMO-UHFFFAOYSA-N 1 2 246.339 2.268 20 0 BEADLO COC(=O)C[NH2+][C@@H](C)Cc1ccc(Cl)cc1 ZINC000224352135 1166855223 /nfs/dbraw/zinc/85/52/23/1166855223.db2.gz UWQVXWBBHCPGNT-VIFPVBQESA-N 1 2 241.718 2.034 20 0 BEADLO CC[C@@H]1CC[C@@H]([N@H+](C)Cc2noc(C)n2)C1 ZINC001173273747 975157266 /nfs/dbraw/zinc/15/72/66/975157266.db2.gz OPLRBNXSVLCQEY-GHMZBOCLSA-N 1 2 223.320 2.389 20 0 BEADLO CC[C@@H]1CC[C@@H]([N@@H+](C)Cc2noc(C)n2)C1 ZINC001173273747 975157269 /nfs/dbraw/zinc/15/72/69/975157269.db2.gz OPLRBNXSVLCQEY-GHMZBOCLSA-N 1 2 223.320 2.389 20 0 BEADLO Cc1cc(N2CC(C(F)F)C2)nc(C2CC2)[nH+]1 ZINC000585383214 1167034678 /nfs/dbraw/zinc/03/46/78/1167034678.db2.gz YDZHTMHXKIXBHK-UHFFFAOYSA-N 1 2 239.269 2.364 20 0 BEADLO CCSC[C@H](C)[N@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001173301723 975201946 /nfs/dbraw/zinc/20/19/46/975201946.db2.gz YVPGBVXPLZFZPL-XHNCKOQMSA-N 1 2 209.305 2.120 20 0 BEADLO CCSC[C@H](C)[N@@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001173301723 975201954 /nfs/dbraw/zinc/20/19/54/975201954.db2.gz YVPGBVXPLZFZPL-XHNCKOQMSA-N 1 2 209.305 2.120 20 0 BEADLO CCSC[C@H](C)[NH2+][C@H](C(=O)OC)C(C)(C)C ZINC001173288689 975255264 /nfs/dbraw/zinc/25/52/64/975255264.db2.gz YQQRQASUAWMCJE-VHSXEESVSA-N 1 2 247.404 2.305 20 0 BEADLO COc1nnc(C[NH+](C(C)C)C(C)C)s1 ZINC001332697838 975255851 /nfs/dbraw/zinc/25/58/51/975255851.db2.gz NGJSEQAQEYWLAV-UHFFFAOYSA-N 1 2 229.349 2.166 20 0 BEADLO CC(=C1CCC1)c1nnc(C[NH+](C)C)o1 ZINC001333120291 975448197 /nfs/dbraw/zinc/44/81/97/975448197.db2.gz CFKBMWUTHWYUHY-UHFFFAOYSA-N 1 2 207.277 2.089 20 0 BEADLO CCc1cc(N[C@H](C)[C@H]2CCOC2)nc(CC)[nH+]1 ZINC001355242599 1167329310 /nfs/dbraw/zinc/32/93/10/1167329310.db2.gz DKIRRCOLNMGXSZ-MNOVXSKESA-N 1 2 249.358 2.438 20 0 BEADLO Cc1[nH]c(CNC(=O)C(C)(C)C2CCC2)[nH+]c1C ZINC000896910270 1167333894 /nfs/dbraw/zinc/33/38/94/1167333894.db2.gz ODAUJPSFISIAKC-UHFFFAOYSA-N 1 2 249.358 2.469 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@H]2CCCC2(C)C)[nH+]c1C ZINC000896914202 1167335099 /nfs/dbraw/zinc/33/50/99/1167335099.db2.gz UIXUHGLEPSAOBJ-LLVKDONJSA-N 1 2 249.358 2.469 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@H]2C[C@@]2(C)C(C)C)[nH+]c1C ZINC000896914166 1167335182 /nfs/dbraw/zinc/33/51/82/1167335182.db2.gz SQALAYDFLMOUTA-RISCZKNCSA-N 1 2 249.358 2.325 20 0 BEADLO COCC(C)(C)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000116260820 1167348583 /nfs/dbraw/zinc/34/85/83/1167348583.db2.gz RQSHEWLZGTVDBF-UHFFFAOYSA-N 1 2 235.331 2.499 20 0 BEADLO CCc1[nH]cc(-c2ccc(OC)nc2)[nH+]1 ZINC001335260462 976904235 /nfs/dbraw/zinc/90/42/35/976904235.db2.gz URQGQYZGBOTOJW-UHFFFAOYSA-N 1 2 203.245 2.043 20 0 BEADLO Cc1nn(C)c(C[N@H+]2CC=CCC2)c1Cl ZINC001335480927 977091420 /nfs/dbraw/zinc/09/14/20/977091420.db2.gz CYGONRALNWFNKV-UHFFFAOYSA-N 1 2 225.723 2.144 20 0 BEADLO Cc1nn(C)c(C[N@@H+]2CC=CCC2)c1Cl ZINC001335480927 977091430 /nfs/dbraw/zinc/09/14/30/977091430.db2.gz CYGONRALNWFNKV-UHFFFAOYSA-N 1 2 225.723 2.144 20 0 BEADLO CCOC(=O)CCc1cc(C)[nH+]c(C)c1 ZINC000214096782 1167517159 /nfs/dbraw/zinc/51/71/59/1167517159.db2.gz JDFQWMRWQHZHIR-UHFFFAOYSA-N 1 2 207.273 2.194 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1ccnc(C(F)F)c1 ZINC001231893337 977784441 /nfs/dbraw/zinc/78/44/41/977784441.db2.gz CVTPSIWRBGVBQJ-JTQLQIEISA-N 1 2 242.269 2.240 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1ccnc(C(F)F)c1 ZINC001231893337 977784459 /nfs/dbraw/zinc/78/44/59/977784459.db2.gz CVTPSIWRBGVBQJ-JTQLQIEISA-N 1 2 242.269 2.240 20 0 BEADLO Cc1[nH]c(CN2CC[C@H](CF)C(F)(F)C2)c[nH+]1 ZINC001232459302 978083933 /nfs/dbraw/zinc/08/39/33/978083933.db2.gz BTHSWSQCGMGDCZ-SECBINFHSA-N 1 2 247.264 2.145 20 0 BEADLO Cc1[nH]cc(CN2CC[C@H](CF)C(F)(F)C2)[nH+]1 ZINC001232459302 978083950 /nfs/dbraw/zinc/08/39/50/978083950.db2.gz BTHSWSQCGMGDCZ-SECBINFHSA-N 1 2 247.264 2.145 20 0 BEADLO Cc1c(C[N@@H+](C)C2(C)COC2)ccnc1Cl ZINC001232754234 978260521 /nfs/dbraw/zinc/26/05/21/978260521.db2.gz XVTZMJQNNFCRHM-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO Cc1c(C[N@H+](C)C2(C)COC2)ccnc1Cl ZINC001232754234 978260532 /nfs/dbraw/zinc/26/05/32/978260532.db2.gz XVTZMJQNNFCRHM-UHFFFAOYSA-N 1 2 240.734 2.264 20 0 BEADLO Oc1cnc(Cl)cc1C[N@@H+]1CCC2(CC2)C1 ZINC001233032811 978422999 /nfs/dbraw/zinc/42/29/99/978422999.db2.gz TYUYKYTZRBWHFZ-UHFFFAOYSA-N 1 2 238.718 2.427 20 0 BEADLO Oc1cnc(Cl)cc1C[N@H+]1CCC2(CC2)C1 ZINC001233032811 978423004 /nfs/dbraw/zinc/42/30/04/978423004.db2.gz TYUYKYTZRBWHFZ-UHFFFAOYSA-N 1 2 238.718 2.427 20 0 BEADLO CCc1cccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)n1 ZINC001235251888 1167785058 /nfs/dbraw/zinc/78/50/58/1167785058.db2.gz VHLBPCLUFKZTAG-TXEJJXNPSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1cccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)n1 ZINC001235251888 1167785066 /nfs/dbraw/zinc/78/50/66/1167785066.db2.gz VHLBPCLUFKZTAG-TXEJJXNPSA-N 1 2 234.343 2.253 20 0 BEADLO Cc1cc(C[N@H+]2CCC(=O)[C@@H](C)CC2)sn1 ZINC001233309829 978535530 /nfs/dbraw/zinc/53/55/30/978535530.db2.gz DJDPTZSTYGLHRT-VIFPVBQESA-N 1 2 238.356 2.253 20 0 BEADLO C[NH+]1CC(Oc2ccc(C(C)(C)C)nc2)C1 ZINC001234175953 978785519 /nfs/dbraw/zinc/78/55/19/978785519.db2.gz BWWJQRDYGFYSHN-UHFFFAOYSA-N 1 2 220.316 2.072 20 0 BEADLO Cc1[nH+]cn(C)c1CN1CC[C@H](C)C(F)(F)C1 ZINC001235535817 979072674 /nfs/dbraw/zinc/07/26/74/979072674.db2.gz AMHZTHKBYSUKFX-VIFPVBQESA-N 1 2 243.301 2.206 20 0 BEADLO Cc1noc(C)c1[C@@H](C)[NH2+][C@H]1CCn2ccnc21 ZINC000382312064 1168241851 /nfs/dbraw/zinc/24/18/51/1168241851.db2.gz SIXLYLZCCDHDDY-KCJUWKMLSA-N 1 2 246.314 2.284 20 0 BEADLO COc1ccc(OC)c(C[NH+]2CC(C)C2)c1F ZINC001237573868 1168249146 /nfs/dbraw/zinc/24/91/46/1168249146.db2.gz XQRKGNSVOMWFES-UHFFFAOYSA-N 1 2 239.290 2.295 20 0 BEADLO F[C@@H]1C[C@@H]2C[C@H]1C[N@@H+]2Cc1nccnc1Cl ZINC001236611023 979676322 /nfs/dbraw/zinc/67/63/22/979676322.db2.gz JDBCECDBVJFSSY-XHNCKOQMSA-N 1 2 241.697 2.062 20 0 BEADLO F[C@@H]1C[C@@H]2C[C@H]1C[N@H+]2Cc1nccnc1Cl ZINC001236611023 979676324 /nfs/dbraw/zinc/67/63/24/979676324.db2.gz JDBCECDBVJFSSY-XHNCKOQMSA-N 1 2 241.697 2.062 20 0 BEADLO C[NH+](C)[C@H]1CCCN(CC2OC=CC2=S)C1 ZINC001237177808 979826383 /nfs/dbraw/zinc/82/63/83/979826383.db2.gz GLXVRBHLPOYOHU-JTQLQIEISA-N 1 2 240.372 2.094 20 0 BEADLO CN(C)[C@H]1CCC[N@H+](CC2OC=CC2=S)C1 ZINC001237177808 979826391 /nfs/dbraw/zinc/82/63/91/979826391.db2.gz GLXVRBHLPOYOHU-JTQLQIEISA-N 1 2 240.372 2.094 20 0 BEADLO CN(C)[C@H]1CCC[N@@H+](CC2OC=CC2=S)C1 ZINC001237177808 979826394 /nfs/dbraw/zinc/82/63/94/979826394.db2.gz GLXVRBHLPOYOHU-JTQLQIEISA-N 1 2 240.372 2.094 20 0 BEADLO C[N@H+](Cc1scnc1Cl)[C@H]1CCCOC1 ZINC001137825798 1168373688 /nfs/dbraw/zinc/37/36/88/1168373688.db2.gz AUSKBOVTTKHNHB-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO C[N@@H+](Cc1scnc1Cl)[C@H]1CCCOC1 ZINC001137825798 1168373692 /nfs/dbraw/zinc/37/36/92/1168373692.db2.gz AUSKBOVTTKHNHB-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO Cc1coc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)n1 ZINC001237635516 979982120 /nfs/dbraw/zinc/98/21/20/979982120.db2.gz OQKTYUPALTYTPN-QMMMGPOBSA-N 1 2 230.258 2.460 20 0 BEADLO CC(C)[C@@H](C)N(C(=O)C[C@@H]([NH3+])C(F)F)C1CC1 ZINC001343527773 980142172 /nfs/dbraw/zinc/14/21/72/980142172.db2.gz WHOOMOHFZALHDQ-PSASIEDQSA-N 1 2 248.317 2.004 20 0 BEADLO COc1c(C[NH+]2CC(C)C2)ccc(F)c1F ZINC001238467533 980273667 /nfs/dbraw/zinc/27/36/67/980273667.db2.gz RVBHTTQQYZPWGV-UHFFFAOYSA-N 1 2 227.254 2.425 20 0 BEADLO Nc1ccc[nH+]c1Nc1ccc2c(c1)CCO2 ZINC000257681343 1168460687 /nfs/dbraw/zinc/46/06/87/1168460687.db2.gz HBPNLSWUOFNROA-UHFFFAOYSA-N 1 2 227.267 2.342 20 0 BEADLO CC(C)(COC(=O)CCC1CC1)n1cc[nH+]c1 ZINC001344107899 980349736 /nfs/dbraw/zinc/34/97/36/980349736.db2.gz PRBCBTNGCYZYNP-UHFFFAOYSA-N 1 2 236.315 2.352 20 0 BEADLO COc1ncc(C)cc1/C(C)=C/C=C/[NH3+] ZINC001241363987 1168466829 /nfs/dbraw/zinc/46/68/29/1168466829.db2.gz PKBQUGMHLBNFBK-GQYICFGZSA-N 1 2 204.273 2.274 20 0 BEADLO CCn1c[nH+]cc1COC(=O)C1(CCF)CC1 ZINC001346746899 980899180 /nfs/dbraw/zinc/89/91/80/980899180.db2.gz HUXZPUALHKPPAF-UHFFFAOYSA-N 1 2 240.278 2.086 20 0 BEADLO FC(F)Cc1ccc(N2CCCC2)[nH+]c1 ZINC001250391808 980915043 /nfs/dbraw/zinc/91/50/43/980915043.db2.gz YVYHLLWFIZFLRI-UHFFFAOYSA-N 1 2 212.243 2.489 20 0 BEADLO CC(C)C[N@@H+](Cc1nc[nH]n1)C1CCCC1 ZINC001347096932 980971244 /nfs/dbraw/zinc/97/12/44/980971244.db2.gz FCYDZRFKVZUHRT-UHFFFAOYSA-N 1 2 222.336 2.205 20 0 BEADLO Cc1cc(N[C@H](C)CCO)nc(C(C)(C)C)[nH+]1 ZINC000077988012 981009364 /nfs/dbraw/zinc/00/93/64/981009364.db2.gz IFOPYAOFJHZMKB-SECBINFHSA-N 1 2 237.347 2.265 20 0 BEADLO O=C1CC[N@H+](Cc2ccccn2)[C@H]2CCCC[C@@H]12 ZINC001204056233 1168632502 /nfs/dbraw/zinc/63/25/02/1168632502.db2.gz WVMCUNRWXCGYDR-KGLIPLIRSA-N 1 2 244.338 2.415 20 0 BEADLO O=C1CC[N@@H+](Cc2ccccn2)[C@H]2CCCC[C@@H]12 ZINC001204056233 1168632504 /nfs/dbraw/zinc/63/25/04/1168632504.db2.gz WVMCUNRWXCGYDR-KGLIPLIRSA-N 1 2 244.338 2.415 20 0 BEADLO Cc1cc([NH+](C)C)ccc1N[C@@H](C)[C@H](C)O ZINC001348973495 981492022 /nfs/dbraw/zinc/49/20/22/981492022.db2.gz RXJAAXGANCRWKP-QWRGUYRKSA-N 1 2 222.332 2.242 20 0 BEADLO CC(C)CC(=O)OCC(C)(C)n1cc[nH+]c1 ZINC001349035161 981499857 /nfs/dbraw/zinc/49/98/57/981499857.db2.gz QMYDNVBVRQWDTE-UHFFFAOYSA-N 1 2 224.304 2.208 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cnc(C2CC2)nc1 ZINC001240685824 981590620 /nfs/dbraw/zinc/59/06/20/981590620.db2.gz FCKWFOXEQDXUSE-YGQDEOHPSA-N 1 2 201.273 2.230 20 0 BEADLO C[C@H](C(=O)NC[C@H]1CCCC[C@@H]1C)n1cc[nH+]c1 ZINC001177927553 1168719395 /nfs/dbraw/zinc/71/93/95/1168719395.db2.gz ZWIWWHIBELRKPC-YNEHKIRRSA-N 1 2 249.358 2.387 20 0 BEADLO Cn1cc[nH+]c1CCNC(=O)C1(C)CCCCC1 ZINC000130163191 1168769675 /nfs/dbraw/zinc/76/96/75/1168769675.db2.gz KLFHBTSDVDXKSO-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO Cc1nc(F)ccc1-c1cc[nH+]c(N)c1 ZINC001241163347 982300246 /nfs/dbraw/zinc/30/02/46/982300246.db2.gz MAJLGWRZXAGSNI-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO c1cn2ccc(-c3cncs3)cc2[nH+]1 ZINC001241497229 982652353 /nfs/dbraw/zinc/65/23/53/982652353.db2.gz DPMNPNGVZOCWSA-UHFFFAOYSA-N 1 2 201.254 2.458 20 0 BEADLO Nc1ccc(Nc2cnccc2Cl)c[nH+]1 ZINC001201272650 983172927 /nfs/dbraw/zinc/17/29/27/983172927.db2.gz RWKHRKYGMXVWSL-UHFFFAOYSA-N 1 2 220.663 2.456 20 0 BEADLO Nc1ccc(Nc2ccc(F)nc2F)c[nH+]1 ZINC001201278257 983179386 /nfs/dbraw/zinc/17/93/86/983179386.db2.gz GTKWASKHEZIKGI-UHFFFAOYSA-N 1 2 222.198 2.081 20 0 BEADLO CCC[N@@H+]1CC[C@H]1N(C)C(=O)OC(C)(C)C ZINC001201648342 983401312 /nfs/dbraw/zinc/40/13/12/983401312.db2.gz UTVBMMHPGBGJML-JTQLQIEISA-N 1 2 228.336 2.295 20 0 BEADLO CCC[N@H+]1CC[C@H]1N(C)C(=O)OC(C)(C)C ZINC001201648342 983401318 /nfs/dbraw/zinc/40/13/18/983401318.db2.gz UTVBMMHPGBGJML-JTQLQIEISA-N 1 2 228.336 2.295 20 0 BEADLO CCOC(=O)C[N@H+](CC)Cc1cc(C)cs1 ZINC001137159982 984005621 /nfs/dbraw/zinc/00/56/21/984005621.db2.gz OTVQDNWBJWIFFU-UHFFFAOYSA-N 1 2 241.356 2.442 20 0 BEADLO CCOC(=O)C[N@@H+](CC)Cc1cc(C)cs1 ZINC001137159982 984005633 /nfs/dbraw/zinc/00/56/33/984005633.db2.gz OTVQDNWBJWIFFU-UHFFFAOYSA-N 1 2 241.356 2.442 20 0 BEADLO CC[C@H](CC(C)C)[N@@H+]1CCC(=O)[C@@H](F)C1 ZINC001172399338 974759106 /nfs/dbraw/zinc/75/91/06/974759106.db2.gz CAOBXWFBFJDZLQ-MNOVXSKESA-N 1 2 215.312 2.424 20 0 BEADLO CC[C@H](CC(C)C)[N@H+]1CCC(=O)[C@@H](F)C1 ZINC001172399338 974759109 /nfs/dbraw/zinc/75/91/09/974759109.db2.gz CAOBXWFBFJDZLQ-MNOVXSKESA-N 1 2 215.312 2.424 20 0 BEADLO CC[C@@H](CC(C)C)[NH+]1CC(O)(C(F)(F)F)C1 ZINC001172399010 974759334 /nfs/dbraw/zinc/75/93/34/974759334.db2.gz WKCPTPLXNMVASY-VIFPVBQESA-N 1 2 239.281 2.420 20 0 BEADLO CC(C)COCC[C@@H](C)[NH2+][C@H]1CC1(F)F ZINC001172453709 974817294 /nfs/dbraw/zinc/81/72/94/974817294.db2.gz GJEUXTNWAVAKDG-ZJUUUORDSA-N 1 2 221.291 2.435 20 0 BEADLO C[N@H+](CCF)Cc1cccc(Cl)n1 ZINC001139551163 1169365888 /nfs/dbraw/zinc/36/58/88/1169365888.db2.gz UFNFXHWIZTZEBS-UHFFFAOYSA-N 1 2 202.660 2.136 20 0 BEADLO C[N@@H+](CCF)Cc1cccc(Cl)n1 ZINC001139551163 1169365896 /nfs/dbraw/zinc/36/58/96/1169365896.db2.gz UFNFXHWIZTZEBS-UHFFFAOYSA-N 1 2 202.660 2.136 20 0 BEADLO CC(=O)[C@H](C)OCc1cc(C)[nH+]c(C)c1 ZINC001223418850 973050572 /nfs/dbraw/zinc/05/05/72/973050572.db2.gz BMNCVTNYFIVUHH-NSHDSACASA-N 1 2 207.273 2.193 20 0 BEADLO O=C(N[C@H]1C[C@@H]1C1CC1)c1cc2c[nH+]ccc2[nH]1 ZINC001151979546 1169411835 /nfs/dbraw/zinc/41/18/35/1169411835.db2.gz SAHAUHSRUBUZDE-PWSUYJOCSA-N 1 2 241.294 2.091 20 0 BEADLO Nc1[nH+]cccc1-c1cccc(O)c1F ZINC001243544706 970800244 /nfs/dbraw/zinc/80/02/44/970800244.db2.gz JVYQDGLBNFNHKN-UHFFFAOYSA-N 1 2 204.204 2.176 20 0 BEADLO Fc1ccc(C[N@@H+]2C[C@H]3CC[C@@H]2CO3)cc1 ZINC001203917942 1169468961 /nfs/dbraw/zinc/46/89/61/1169468961.db2.gz IFBCQUGKIAAPTJ-CHWSQXEVSA-N 1 2 221.275 2.189 20 0 BEADLO Fc1ccc(C[N@H+]2C[C@H]3CC[C@@H]2CO3)cc1 ZINC001203917942 1169468966 /nfs/dbraw/zinc/46/89/66/1169468966.db2.gz IFBCQUGKIAAPTJ-CHWSQXEVSA-N 1 2 221.275 2.189 20 0 BEADLO Fc1ccc(C[N@@H+]2CCOC3(CC3)C2)cc1 ZINC001203914830 1169469986 /nfs/dbraw/zinc/46/99/86/1169469986.db2.gz BKBCDVNHXHDSBK-UHFFFAOYSA-N 1 2 221.275 2.191 20 0 BEADLO Fc1ccc(C[N@H+]2CCOC3(CC3)C2)cc1 ZINC001203914830 1169469991 /nfs/dbraw/zinc/46/99/91/1169469991.db2.gz BKBCDVNHXHDSBK-UHFFFAOYSA-N 1 2 221.275 2.191 20 0 BEADLO C[C@@H]1C[C@@H]1C1=NNC(=c2ccnc3c2=CC=[NH+]3)O1 ZINC001256688988 970922822 /nfs/dbraw/zinc/92/28/22/970922822.db2.gz BWFUMCMSVWBRKV-JEZHCXPESA-N 1 2 240.266 2.213 20 0 BEADLO Cc1cc[nH+]c(NC(C2CC2)C2CC2)c1C(N)=O ZINC001157920875 970931079 /nfs/dbraw/zinc/93/10/79/970931079.db2.gz QCUNWURJBVVSLV-UHFFFAOYSA-N 1 2 245.326 2.089 20 0 BEADLO F[C@@H]1C[C@H]1[NH2+][C@@H]1CCCN(C2CCCC2)C1 ZINC001256900388 971013175 /nfs/dbraw/zinc/01/31/75/971013175.db2.gz NCIHLHMBPRVEEY-RAIGVLPGSA-N 1 2 226.339 2.093 20 0 BEADLO F[C@@H]1C[C@H]1[NH2+][C@H]1CCCN(C2CCCC2)C1 ZINC001256900387 971014661 /nfs/dbraw/zinc/01/46/61/971014661.db2.gz NCIHLHMBPRVEEY-CYZMBNFOSA-N 1 2 226.339 2.093 20 0 BEADLO Cc1c(O)cccc1Nc1[nH+]cccc1CCO ZINC001216320168 971037542 /nfs/dbraw/zinc/03/75/42/971037542.db2.gz KRRCDUYBLUTOMZ-UHFFFAOYSA-N 1 2 244.294 2.374 20 0 BEADLO Nc1cn2ccc(-c3cc(F)nc(F)c3)cc2[nH+]1 ZINC001243971197 971064501 /nfs/dbraw/zinc/06/45/01/971064501.db2.gz NPUBYCOXSJKJPH-UHFFFAOYSA-N 1 2 246.220 2.257 20 0 BEADLO CCC[C@H](CC)N1CC[NH2+]CC(F)(F)C1 ZINC001257257771 971156519 /nfs/dbraw/zinc/15/65/19/971156519.db2.gz VPJSDJRTRRMCCW-JTQLQIEISA-N 1 2 220.307 2.106 20 0 BEADLO CCC[C@@H](CC)N1CC[NH2+]CC(F)(F)C1 ZINC001257257781 971156858 /nfs/dbraw/zinc/15/68/58/971156858.db2.gz VPJSDJRTRRMCCW-SNVBAGLBSA-N 1 2 220.307 2.106 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccc(C)nc1 ZINC000405675204 971289860 /nfs/dbraw/zinc/28/98/60/971289860.db2.gz JNGKRLCUCJSWMY-AWEZNQCLSA-N 1 2 232.327 2.334 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@H+]1Cc1ccc(C)nc1 ZINC000405675204 971289873 /nfs/dbraw/zinc/28/98/73/971289873.db2.gz JNGKRLCUCJSWMY-AWEZNQCLSA-N 1 2 232.327 2.334 20 0 BEADLO c1ccc2c(c1)CC[NH2+][C@H]2c1nnc(C2CC2)o1 ZINC001217720914 971361719 /nfs/dbraw/zinc/36/17/19/971361719.db2.gz RAPQLZHFCIQSDL-GFCCVEGCSA-N 1 2 241.294 2.182 20 0 BEADLO Cn1ncc2c1C[N@H+](Cc1ccsc1)CC2 ZINC001204042429 971409049 /nfs/dbraw/zinc/40/90/49/971409049.db2.gz DXPMCGFDPSWJFG-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO Cn1ncc2c1C[N@@H+](Cc1ccsc1)CC2 ZINC001204042429 971409061 /nfs/dbraw/zinc/40/90/61/971409061.db2.gz DXPMCGFDPSWJFG-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO CC[N@H+](C)Cc1nnc(C2CCCC2)o1 ZINC001257532590 971450331 /nfs/dbraw/zinc/45/03/31/971450331.db2.gz ONRJUQYIQKTUNJ-UHFFFAOYSA-N 1 2 209.293 2.179 20 0 BEADLO CC[N@@H+](C)Cc1nnc(C2CCCC2)o1 ZINC001257532590 971450336 /nfs/dbraw/zinc/45/03/36/971450336.db2.gz ONRJUQYIQKTUNJ-UHFFFAOYSA-N 1 2 209.293 2.179 20 0 BEADLO CC(C)c1nc(C[NH2+][C@H]2CCCSC2)no1 ZINC001257657896 971459235 /nfs/dbraw/zinc/45/92/35/971459235.db2.gz MBHRHBODQLCZLQ-VIFPVBQESA-N 1 2 241.360 2.178 20 0 BEADLO CCOC(=O)[C@@H]([NH2+][C@H]1CCCSC1)C(C)C ZINC001257659995 971461267 /nfs/dbraw/zinc/46/12/67/971461267.db2.gz QUGQNIHVXCGBMU-QWRGUYRKSA-N 1 2 245.388 2.059 20 0 BEADLO CO[C@@H](C)CNc1cc(SC)cc[nH+]1 ZINC001158812822 971466745 /nfs/dbraw/zinc/46/67/45/971466745.db2.gz OLIJBSIRGXIZGB-QMMMGPOBSA-N 1 2 212.318 2.250 20 0 BEADLO Cc1ccc(C(=O)Nc2c(C)c[nH+]cc2C)cn1 ZINC001133455643 971543303 /nfs/dbraw/zinc/54/33/03/971543303.db2.gz LGBYADQFQGRPPA-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO Cc1ccc(O[C@H]2CC[NH2+]CC2(F)F)cc1 ZINC001218005913 971567604 /nfs/dbraw/zinc/56/76/04/971567604.db2.gz OFTWVYSUPWMDLW-NSHDSACASA-N 1 2 227.254 2.371 20 0 BEADLO c1cc2cccc(CNc3cccc[nH+]3)n2n1 ZINC001170700817 971588545 /nfs/dbraw/zinc/58/85/45/971588545.db2.gz UGHFGTOOQCUHCC-UHFFFAOYSA-N 1 2 224.267 2.341 20 0 BEADLO Cc1cc(Cl)cnc1O[C@@H]1C[NH2+]CC1(F)F ZINC001218234393 971646873 /nfs/dbraw/zinc/64/68/73/971646873.db2.gz UYXISBIIOKDFBN-MRVPVSSYSA-N 1 2 248.660 2.029 20 0 BEADLO Cc1cc(S)ccc1O[C@@H]1CCC12C[NH2+]C2 ZINC001218242598 971650536 /nfs/dbraw/zinc/65/05/36/971650536.db2.gz SHERNECNDXMGDH-GFCCVEGCSA-N 1 2 235.352 2.415 20 0 BEADLO CCC[C@H](CC(=O)OC)Oc1cc[nH+]cc1 ZINC001225290720 974359194 /nfs/dbraw/zinc/35/91/94/974359194.db2.gz GYYHTFQMRYHISY-LLVKDONJSA-N 1 2 223.272 2.192 20 0 BEADLO CC[NH+]1CC(Oc2cc(Cl)cc(Cl)n2)C1 ZINC001229040467 1169645461 /nfs/dbraw/zinc/64/54/61/1169645461.db2.gz AWSYEVTVFJMRPH-UHFFFAOYSA-N 1 2 247.125 2.471 20 0 BEADLO CCC=CNc1cc(-n2ccnc2)nc(C)[nH+]1 ZINC001170768099 971770489 /nfs/dbraw/zinc/77/04/89/971770489.db2.gz YREGJCLIKZGUGB-SNAWJCMRSA-N 1 2 229.287 2.306 20 0 BEADLO CC[NH+]1CC(Oc2cc(-c3ccccc3)[nH]n2)C1 ZINC001229437753 1169659458 /nfs/dbraw/zinc/65/94/58/1169659458.db2.gz PGFTYQKABCIKLK-UHFFFAOYSA-N 1 2 243.310 2.160 20 0 BEADLO Cc1[nH]c2ccc(OC[C@H]3C[C@@H](O)C3)cc2[nH+]1 ZINC001218433322 971812856 /nfs/dbraw/zinc/81/28/56/971812856.db2.gz ZYXNCRRRTLVYIL-AOOOYVTPSA-N 1 2 232.283 2.021 20 0 BEADLO CC[C@H](C)OCC[C@H](C)[NH2+]C(C)(C)C(=O)OC ZINC001172322479 974533746 /nfs/dbraw/zinc/53/37/46/974533746.db2.gz VAGFXLAKJODQDS-QWRGUYRKSA-N 1 2 245.363 2.121 20 0 BEADLO Cc1cc(-c2cnc3ocnc3c2)c[nH+]c1N ZINC001245539051 971854022 /nfs/dbraw/zinc/85/40/22/971854022.db2.gz QAANYGMWVFESSY-UHFFFAOYSA-N 1 2 226.239 2.175 20 0 BEADLO Cc1cc(-c2cnc3c(n2)CCCC3)c[nH+]c1N ZINC001245537910 971852173 /nfs/dbraw/zinc/85/21/73/971852173.db2.gz LQRAXRVATKKZMB-UHFFFAOYSA-N 1 2 240.310 2.308 20 0 BEADLO CC1(C)C[NH+](Cc2c(F)ccc(N)c2F)C1 ZINC000309925374 971882442 /nfs/dbraw/zinc/88/24/42/971882442.db2.gz SUCIMPATKDBNPP-UHFFFAOYSA-N 1 2 226.270 2.389 20 0 BEADLO C[C@@H]1COCC[C@H]1Nc1cc2cc[nH]c2c[nH+]1 ZINC001170814869 971889360 /nfs/dbraw/zinc/88/93/60/971889360.db2.gz WPCZBPHPZRYHSK-MWLCHTKSSA-N 1 2 231.299 2.400 20 0 BEADLO C[C@H]1COCC[C@@H]1Nc1ccc2[nH+]cn(C)c2c1 ZINC001170819568 971910824 /nfs/dbraw/zinc/91/08/24/971910824.db2.gz OLXUECJHNSCPBS-JQWIXIFHSA-N 1 2 245.326 2.410 20 0 BEADLO C[C@@H]1CC[C@H]([N@@H+]2CCC(=O)[C@H](F)C2)C[C@@H]1C ZINC001172374710 974576002 /nfs/dbraw/zinc/57/60/02/974576002.db2.gz AMBPSZKPZIFONI-NOOOWODRSA-N 1 2 227.323 2.424 20 0 BEADLO C[C@@H]1CC[C@H]([N@H+]2CCC(=O)[C@H](F)C2)C[C@@H]1C ZINC001172374710 974576014 /nfs/dbraw/zinc/57/60/14/974576014.db2.gz AMBPSZKPZIFONI-NOOOWODRSA-N 1 2 227.323 2.424 20 0 BEADLO Fc1cccc2c1C[C@H]([NH+]1CC3(CCO3)C1)CC2 ZINC001171001841 972230340 /nfs/dbraw/zinc/23/03/40/972230340.db2.gz SAJIUPYMRJEEQY-GFCCVEGCSA-N 1 2 247.313 2.158 20 0 BEADLO c1cc2c(s1)CC[N@@H+](Cc1cccnn1)C2 ZINC001139968834 957165513 /nfs/dbraw/zinc/16/55/13/957165513.db2.gz ABKVVEGTZSDDIL-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1cc2c(s1)CC[N@H+](Cc1cccnn1)C2 ZINC001139968834 957165526 /nfs/dbraw/zinc/16/55/26/957165526.db2.gz ABKVVEGTZSDDIL-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO C[C@@H](C[NH+]1CC2(C1)CCCCO2)C(F)(F)F ZINC001208895303 957225148 /nfs/dbraw/zinc/22/51/48/957225148.db2.gz HECNIFWVPWGWOA-VIFPVBQESA-N 1 2 237.265 2.440 20 0 BEADLO C[C@@]1(F)CC[N@H+](Cc2ccccn2)C[C@H]1F ZINC001204056161 972257645 /nfs/dbraw/zinc/25/76/45/972257645.db2.gz UYRSDBWYAHEJBH-VXGBXAGGSA-N 1 2 226.270 2.354 20 0 BEADLO C[C@@]1(F)CC[N@@H+](Cc2ccccn2)C[C@H]1F ZINC001204056161 972257649 /nfs/dbraw/zinc/25/76/49/972257649.db2.gz UYRSDBWYAHEJBH-VXGBXAGGSA-N 1 2 226.270 2.354 20 0 BEADLO C[C@H]1C[C@H]1C[N@@H+]1CCN(C(=O)OC(C)(C)C)C1 ZINC001209429419 957451212 /nfs/dbraw/zinc/45/12/12/957451212.db2.gz WQBMYYMBRSNPFL-QWRGUYRKSA-N 1 2 240.347 2.153 20 0 BEADLO C[C@H]1C[C@H]1C[N@H+]1CCN(C(=O)OC(C)(C)C)C1 ZINC001209429419 957451224 /nfs/dbraw/zinc/45/12/24/957451224.db2.gz WQBMYYMBRSNPFL-QWRGUYRKSA-N 1 2 240.347 2.153 20 0 BEADLO C[C@@H]1C[C@H]1C[N@@H+]1CCN(C(=O)OC(C)(C)C)C1 ZINC001209429418 957454362 /nfs/dbraw/zinc/45/43/62/957454362.db2.gz WQBMYYMBRSNPFL-MNOVXSKESA-N 1 2 240.347 2.153 20 0 BEADLO C[C@@H]1C[C@H]1C[N@H+]1CCN(C(=O)OC(C)(C)C)C1 ZINC001209429418 957454373 /nfs/dbraw/zinc/45/43/73/957454373.db2.gz WQBMYYMBRSNPFL-MNOVXSKESA-N 1 2 240.347 2.153 20 0 BEADLO COc1ccc(C)[nH+]c1N1CC[C@H]2OCC[C@@H]2C1 ZINC001167212785 957546195 /nfs/dbraw/zinc/54/61/95/957546195.db2.gz GPAJLKORMBFWEO-VXGBXAGGSA-N 1 2 248.326 2.014 20 0 BEADLO COc1cc(C)c[nH+]c1N1CC[C@H]2OCC[C@H]2C1 ZINC001167211505 957546616 /nfs/dbraw/zinc/54/66/16/957546616.db2.gz BFZKXORSHQLRJT-NWDGAFQWSA-N 1 2 248.326 2.014 20 0 BEADLO Cc1cn2cccc(Nc3ccnnc3)c2[nH+]1 ZINC001209957954 957579429 /nfs/dbraw/zinc/57/94/29/957579429.db2.gz ZGPBSRVXMIPECA-UHFFFAOYSA-N 1 2 225.255 2.176 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1ccc(O)cc1F ZINC001140124255 957593399 /nfs/dbraw/zinc/59/33/99/957593399.db2.gz HKLUGSDFQGRDGK-PSASIEDQSA-N 1 2 227.254 2.464 20 0 BEADLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1ccc(O)cc1F ZINC001140124255 957593401 /nfs/dbraw/zinc/59/34/01/957593401.db2.gz HKLUGSDFQGRDGK-PSASIEDQSA-N 1 2 227.254 2.464 20 0 BEADLO C[N@H+](Cc1ccccn1)Cc1cccc(F)n1 ZINC001140130165 957601555 /nfs/dbraw/zinc/60/15/55/957601555.db2.gz MQFLLMGRRXJYAA-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[N@@H+](Cc1ccccn1)Cc1cccc(F)n1 ZINC001140130165 957601557 /nfs/dbraw/zinc/60/15/57/957601557.db2.gz MQFLLMGRRXJYAA-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO CC1(C)C[N@@H+](Cc2cnc[nH]2)CCC1(F)F ZINC001136866358 972281634 /nfs/dbraw/zinc/28/16/34/972281634.db2.gz SNMVZWYMJVUKHS-UHFFFAOYSA-N 1 2 229.274 2.277 20 0 BEADLO CC[C@H]1CCCC[C@H]1OCC[NH+]1CCOCC1 ZINC001210207979 957672276 /nfs/dbraw/zinc/67/22/76/957672276.db2.gz QIDBXHFGDYTRBO-UONOGXRCSA-N 1 2 241.375 2.304 20 0 BEADLO Cc1cn2cccc(Nc3cncc(N)c3)c2[nH+]1 ZINC001210437152 957749183 /nfs/dbraw/zinc/74/91/83/957749183.db2.gz DTLJRLHUCHEXLL-UHFFFAOYSA-N 1 2 239.282 2.364 20 0 BEADLO Cc1c[nH+]cc(NCc2cccnn2)c1C ZINC001167327686 957767429 /nfs/dbraw/zinc/76/74/29/957767429.db2.gz LIMYGLMVMZIUNF-UHFFFAOYSA-N 1 2 214.272 2.101 20 0 BEADLO CC/C=C\CCCN1CC[NH2+]CC(F)(F)C1 ZINC001210814791 957910269 /nfs/dbraw/zinc/91/02/69/957910269.db2.gz KANMJCZCJRLVPU-ARJAWSKDSA-N 1 2 232.318 2.273 20 0 BEADLO COc1ncc(C[N@@H+]2CCC[C@H](F)C2)cc1C ZINC001137004993 972318045 /nfs/dbraw/zinc/31/80/45/972318045.db2.gz VIBHALWGOXNTFU-LBPRGKRZSA-N 1 2 238.306 2.333 20 0 BEADLO COc1ncc(C[N@H+]2CCC[C@H](F)C2)cc1C ZINC001137004993 972318047 /nfs/dbraw/zinc/31/80/47/972318047.db2.gz VIBHALWGOXNTFU-LBPRGKRZSA-N 1 2 238.306 2.333 20 0 BEADLO Cc1ncccc1C[NH+]1CC2(C1)CCCCO2 ZINC001207148243 958219449 /nfs/dbraw/zinc/21/94/49/958219449.db2.gz UIODAMCQOFBDRA-UHFFFAOYSA-N 1 2 232.327 2.145 20 0 BEADLO C/C=C\COC(=O)[C@@H](c1ccccc1)[NH+](C)C ZINC000588410980 958310956 /nfs/dbraw/zinc/31/09/56/958310956.db2.gz KDYNSSDEISLNCO-DSYXLKISSA-N 1 2 233.311 2.409 20 0 BEADLO CC[C@H](CC(C)C)N[C@@H]1C[NH2+]CC1(F)F ZINC001246461278 972336880 /nfs/dbraw/zinc/33/68/80/972336880.db2.gz OMBFGBZIYFMXJN-NXEZZACHSA-N 1 2 220.307 2.008 20 0 BEADLO COc1ccc(C[N@@H+]2CCc3occc3C2)cn1 ZINC001137037743 972337794 /nfs/dbraw/zinc/33/77/94/972337794.db2.gz VVFYLQAYJUDJQU-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1ccc(C[N@H+]2CCc3occc3C2)cn1 ZINC001137037743 972337802 /nfs/dbraw/zinc/33/78/02/972337802.db2.gz VVFYLQAYJUDJQU-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO Cc1cc([C@H](C)[NH2+]C/C=C/Cl)no1 ZINC000308328057 958383237 /nfs/dbraw/zinc/38/32/37/958383237.db2.gz IDQLBJGLDCUQCF-RTMURIBGSA-N 1 2 200.669 2.386 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1cnn(C)c1Cl ZINC000382201406 958526370 /nfs/dbraw/zinc/52/63/70/958526370.db2.gz JJZWOBBCWUVROW-UHFFFAOYSA-N 1 2 239.706 2.265 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)Nc1ccc(F)c(C)c1 ZINC001143770682 972358998 /nfs/dbraw/zinc/35/89/98/972358998.db2.gz RLDUZWPRPMKIGO-UHFFFAOYSA-N 1 2 247.273 2.347 20 0 BEADLO CNc1ccc(N[C@H](C)c2ncc(F)cn2)c[nH+]1 ZINC001171115093 972379740 /nfs/dbraw/zinc/37/97/40/972379740.db2.gz PHFRRGLDEIUWNO-MRVPVSSYSA-N 1 2 247.277 2.226 20 0 BEADLO CC1(C)CC(=O)CC[C@@H]1OCCn1cc[nH+]c1 ZINC001222134458 972384597 /nfs/dbraw/zinc/38/45/97/972384597.db2.gz CTACVWIRPIUSFC-LBPRGKRZSA-N 1 2 236.315 2.048 20 0 BEADLO C[C@@H]1c2cnccc2C[C@@H]1OCCn1cc[nH+]c1 ZINC001222138730 972385891 /nfs/dbraw/zinc/38/58/91/972385891.db2.gz JLMJZNGQFCPKOE-RISCZKNCSA-N 1 2 243.310 2.023 20 0 BEADLO Cc1cc([C@H]2CCCN2Cc2[nH]c[nH+]c2C)no1 ZINC001204589086 958925996 /nfs/dbraw/zinc/92/59/96/958925996.db2.gz RMQJAWUYTNCIKJ-CYBMUJFWSA-N 1 2 246.314 2.352 20 0 BEADLO C[C@@H](OCCn1cc[nH+]c1)c1ncccc1F ZINC001222139810 972387947 /nfs/dbraw/zinc/38/79/47/972387947.db2.gz XOTGGZAZPJFREI-SNVBAGLBSA-N 1 2 235.262 2.195 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(=O)[C@@H](C)C2)ccc1O ZINC001140574958 958963143 /nfs/dbraw/zinc/96/31/43/958963143.db2.gz XEWYWWPNRCLJRL-NSHDSACASA-N 1 2 233.311 2.112 20 0 BEADLO Cc1cc(C[N@H+]2CCC(=O)[C@@H](C)C2)ccc1O ZINC001140574958 958963154 /nfs/dbraw/zinc/96/31/54/958963154.db2.gz XEWYWWPNRCLJRL-NSHDSACASA-N 1 2 233.311 2.112 20 0 BEADLO Nc1cc(CNc2ncccc2Cl)cc[nH+]1 ZINC001167611863 959057788 /nfs/dbraw/zinc/05/77/88/959057788.db2.gz CLKHDUFBVHFUNN-UHFFFAOYSA-N 1 2 234.690 2.324 20 0 BEADLO CC(C)n1cc(NCc2cc[nH+]c(N)c2)cn1 ZINC001167616991 959084877 /nfs/dbraw/zinc/08/48/77/959084877.db2.gz DRKOIBZHXNTHBH-UHFFFAOYSA-N 1 2 231.303 2.053 20 0 BEADLO Nc1cc(CNc2ccc3ocnc3c2)cc[nH+]1 ZINC001167617137 959086054 /nfs/dbraw/zinc/08/60/54/959086054.db2.gz HSHYBGWILNZKLK-UHFFFAOYSA-N 1 2 240.266 2.417 20 0 BEADLO CC(C)c1ncc(NCc2cc[nH+]c(N)c2)cn1 ZINC001167619268 959089660 /nfs/dbraw/zinc/08/96/60/959089660.db2.gz XJIDBEQTAZDZRX-UHFFFAOYSA-N 1 2 243.314 2.189 20 0 BEADLO Nc1cc(CNc2cccc3cnoc32)cc[nH+]1 ZINC001167619262 959089719 /nfs/dbraw/zinc/08/97/19/959089719.db2.gz WYSZIIRMPVZUIJ-UHFFFAOYSA-N 1 2 240.266 2.417 20 0 BEADLO Cc1cc(NCc2cc[nH+]c(N)c2)cnc1C ZINC001167617431 959091198 /nfs/dbraw/zinc/09/11/98/959091198.db2.gz MPQPNFRNUDPENH-UHFFFAOYSA-N 1 2 228.299 2.288 20 0 BEADLO CC(=O)CNc1cc2c3c(c1)CCC[NH+]3CCC2 ZINC001167629199 959125312 /nfs/dbraw/zinc/12/53/12/959125312.db2.gz JLSGAXORWMNLOD-UHFFFAOYSA-N 1 2 244.338 2.386 20 0 BEADLO CC(=O)CNc1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001167632151 959153671 /nfs/dbraw/zinc/15/36/71/959153671.db2.gz PDLVEBGGQFQLTD-UHFFFAOYSA-N 1 2 233.246 2.012 20 0 BEADLO CC(C)[C@H]1CCCCN1C(=O)C[C@H]([NH3+])C(F)F ZINC000724710707 959231469 /nfs/dbraw/zinc/23/14/69/959231469.db2.gz HDQNPYQJYNYFLF-VHSXEESVSA-N 1 2 248.317 2.006 20 0 BEADLO Nc1cc(-c2cc(F)c(O)c(F)c2)cc[nH+]1 ZINC001244093535 1169768095 /nfs/dbraw/zinc/76/80/95/1169768095.db2.gz GTFPIPHHNMPRJG-UHFFFAOYSA-N 1 2 222.194 2.315 20 0 BEADLO COc1ccc(F)c(C[NH+]2CC(C)C2)c1F ZINC001143969379 972439078 /nfs/dbraw/zinc/43/90/78/972439078.db2.gz ASMYDENYLQLHOP-UHFFFAOYSA-N 1 2 227.254 2.425 20 0 BEADLO c1cc(C[NH+]2CC(OCc3ccccc3)C2)c[nH]1 ZINC001140707401 959670323 /nfs/dbraw/zinc/67/03/23/959670323.db2.gz IFFFODPTSXQETH-UHFFFAOYSA-N 1 2 242.322 2.416 20 0 BEADLO COCOc1ccc(Nc2[nH+]cccc2N)cc1 ZINC001211628781 959698535 /nfs/dbraw/zinc/69/85/35/959698535.db2.gz ICFJPBMVNGTGIR-UHFFFAOYSA-N 1 2 245.282 2.390 20 0 BEADLO C[C@@H]([NH2+]CCCO)C(F)(F)c1ccccc1 ZINC000924536196 959757503 /nfs/dbraw/zinc/75/75/03/959757503.db2.gz LUBJDEPWEARVKP-SNVBAGLBSA-N 1 2 229.270 2.139 20 0 BEADLO CCCN(CC1CC1)C(=O)[C@@H](C)n1cc[nH+]c1 ZINC000056482579 959963403 /nfs/dbraw/zinc/96/34/03/959963403.db2.gz NPMUNUKGLNVOGT-LLVKDONJSA-N 1 2 235.331 2.093 20 0 BEADLO Cc1c[nH]c(C[NH+]2CC3(C2)CCCCO3)c1C ZINC001140858596 959989034 /nfs/dbraw/zinc/98/90/34/959989034.db2.gz LHGUFORYGVAQGZ-UHFFFAOYSA-N 1 2 234.343 2.386 20 0 BEADLO CCOC(=O)[C@@H]([NH2+]CCSCC)C(C)(C)C ZINC000309908163 960288477 /nfs/dbraw/zinc/28/84/77/960288477.db2.gz LHXCSSCZXQBIBU-SNVBAGLBSA-N 1 2 247.404 2.307 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccon2)ccc1O ZINC001140577478 960440067 /nfs/dbraw/zinc/44/00/67/960440067.db2.gz GZZXEXFMYPKRPM-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccon2)ccc1O ZINC001140577478 960440069 /nfs/dbraw/zinc/44/00/69/960440069.db2.gz GZZXEXFMYPKRPM-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO CO[C@@H]1CC[N@H+](Cc2cc(Cl)ncc2F)C1 ZINC001140606081 960456225 /nfs/dbraw/zinc/45/62/25/960456225.db2.gz WAYZVLLLOFLABL-SECBINFHSA-N 1 2 244.697 2.095 20 0 BEADLO CC[N@H+](CC(=O)OC(C)(C)C)Cc1cc[nH]c1 ZINC001140709318 960530533 /nfs/dbraw/zinc/53/05/33/960530533.db2.gz YEPHQRQUQADGFI-UHFFFAOYSA-N 1 2 238.331 2.178 20 0 BEADLO CC[N@@H+](CC(=O)OC(C)(C)C)Cc1cc[nH]c1 ZINC001140709318 960530541 /nfs/dbraw/zinc/53/05/41/960530541.db2.gz YEPHQRQUQADGFI-UHFFFAOYSA-N 1 2 238.331 2.178 20 0 BEADLO C[N@H+](CCF)Cc1cc(Br)ccn1 ZINC001140769615 960561666 /nfs/dbraw/zinc/56/16/66/960561666.db2.gz OBYROAWNOSRDRH-UHFFFAOYSA-N 1 2 247.111 2.245 20 0 BEADLO C[N@@H+](CCF)Cc1cc(Br)ccn1 ZINC001140769615 960561685 /nfs/dbraw/zinc/56/16/85/960561685.db2.gz OBYROAWNOSRDRH-UHFFFAOYSA-N 1 2 247.111 2.245 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001140781125 960564212 /nfs/dbraw/zinc/56/42/12/960564212.db2.gz PJZPHYOASLVKSU-ZIAGYGMSSA-N 1 2 235.302 2.497 20 0 BEADLO Cc1cc(F)ccc1C[N@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001140781125 960564220 /nfs/dbraw/zinc/56/42/20/960564220.db2.gz PJZPHYOASLVKSU-ZIAGYGMSSA-N 1 2 235.302 2.497 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC(=O)C[C@H]2C)c1C ZINC001140859422 960631939 /nfs/dbraw/zinc/63/19/39/960631939.db2.gz YKNYMMOLFPSXPX-SNVBAGLBSA-N 1 2 220.316 2.185 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC(=O)C[C@H]2C)c1C ZINC001140859422 960631946 /nfs/dbraw/zinc/63/19/46/960631946.db2.gz YKNYMMOLFPSXPX-SNVBAGLBSA-N 1 2 220.316 2.185 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC(=O)C[C@@H]2C)c1C ZINC001140859412 960636990 /nfs/dbraw/zinc/63/69/90/960636990.db2.gz YKNYMMOLFPSXPX-JTQLQIEISA-N 1 2 220.316 2.185 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC(=O)C[C@@H]2C)c1C ZINC001140859412 960637000 /nfs/dbraw/zinc/63/70/00/960637000.db2.gz YKNYMMOLFPSXPX-JTQLQIEISA-N 1 2 220.316 2.185 20 0 BEADLO CCCOC1CC[NH+](Cc2cc(C)[nH]n2)CC1 ZINC001203075574 960671639 /nfs/dbraw/zinc/67/16/39/960671639.db2.gz KRLIJXOLZZCQDJ-UHFFFAOYSA-N 1 2 237.347 2.109 20 0 BEADLO Cc1cccc2c1C[N@H+](Cc1cnco1)C2 ZINC001140927378 960692227 /nfs/dbraw/zinc/69/22/27/960692227.db2.gz POZSDTPBMNAZER-UHFFFAOYSA-N 1 2 214.268 2.499 20 0 BEADLO Cc1cccc2c1C[N@@H+](Cc1cnco1)C2 ZINC001140927378 960692236 /nfs/dbraw/zinc/69/22/36/960692236.db2.gz POZSDTPBMNAZER-UHFFFAOYSA-N 1 2 214.268 2.499 20 0 BEADLO c1cc2c(s1)CC[N@@H+](Cc1cnco1)C2 ZINC001140928680 960703186 /nfs/dbraw/zinc/70/31/86/960703186.db2.gz QWRNBWGOYFVGGE-UHFFFAOYSA-N 1 2 220.297 2.294 20 0 BEADLO c1cc2c(s1)CC[N@H+](Cc1cnco1)C2 ZINC001140928680 960703194 /nfs/dbraw/zinc/70/31/94/960703194.db2.gz QWRNBWGOYFVGGE-UHFFFAOYSA-N 1 2 220.297 2.294 20 0 BEADLO Cc1ccnn1C1CC[NH+](Cc2ncco2)CC1 ZINC001141010104 960811323 /nfs/dbraw/zinc/81/13/23/960811323.db2.gz DNFWKMVAGXCTDR-UHFFFAOYSA-N 1 2 246.314 2.017 20 0 BEADLO Oc1cccc2ccc(C[N@@H+]3CC[C@H](F)C3)nc12 ZINC001141019414 960822141 /nfs/dbraw/zinc/82/21/41/960822141.db2.gz DNBCQUVBKYPOEO-NSHDSACASA-N 1 2 246.285 2.484 20 0 BEADLO Oc1cccc2ccc(C[N@H+]3CC[C@H](F)C3)nc12 ZINC001141019414 960822143 /nfs/dbraw/zinc/82/21/43/960822143.db2.gz DNBCQUVBKYPOEO-NSHDSACASA-N 1 2 246.285 2.484 20 0 BEADLO CCCCc1[nH]c(CN2CCOC3(CC3)C2)c[nH+]1 ZINC001141073875 960857720 /nfs/dbraw/zinc/85/77/20/960857720.db2.gz NKYIBHHJKXTOMI-UHFFFAOYSA-N 1 2 249.358 2.117 20 0 BEADLO CCCCc1[nH]cc(CN2CCOC3(CC3)C2)[nH+]1 ZINC001141073875 960857723 /nfs/dbraw/zinc/85/77/23/960857723.db2.gz NKYIBHHJKXTOMI-UHFFFAOYSA-N 1 2 249.358 2.117 20 0 BEADLO CC(C)(C)c1cccc(C[NH+]2CC(O)C2)c1 ZINC001141102781 960867269 /nfs/dbraw/zinc/86/72/69/960867269.db2.gz NXQIZTKVGIGXMK-UHFFFAOYSA-N 1 2 219.328 2.161 20 0 BEADLO C[N@@H+](Cc1cocn1)C[C@H]1Cc2ccccc2O1 ZINC001141131459 960879860 /nfs/dbraw/zinc/87/98/60/960879860.db2.gz FEZUJTZLXATXET-CYBMUJFWSA-N 1 2 244.294 2.110 20 0 BEADLO C[N@H+](Cc1cocn1)C[C@H]1Cc2ccccc2O1 ZINC001141131459 960879868 /nfs/dbraw/zinc/87/98/68/960879868.db2.gz FEZUJTZLXATXET-CYBMUJFWSA-N 1 2 244.294 2.110 20 0 BEADLO O=C1CCC2(CC1)CC[NH+](Cc1cocn1)CC2 ZINC001141133048 960887323 /nfs/dbraw/zinc/88/73/23/960887323.db2.gz WXYNDKBPQFBOCZ-UHFFFAOYSA-N 1 2 248.326 2.400 20 0 BEADLO Cc1cc(O)c[nH+]c1Nc1cccc(CCO)c1 ZINC001203105719 960967928 /nfs/dbraw/zinc/96/79/28/960967928.db2.gz BZCMNOJIRYDLCR-UHFFFAOYSA-N 1 2 244.294 2.374 20 0 BEADLO COC(=O)[C@H]1CC[C@H](Nc2cccc[nH+]2)CC1 ZINC001167821409 961118648 /nfs/dbraw/zinc/11/86/48/961118648.db2.gz FFTVVRXLLMIUQV-XYPYZODXSA-N 1 2 234.299 2.225 20 0 BEADLO Cc1ccc(Nc2[nH+]cccc2CCO)cc1O ZINC001211698012 961200528 /nfs/dbraw/zinc/20/05/28/961200528.db2.gz RDVGYURHGSPMAA-UHFFFAOYSA-N 1 2 244.294 2.374 20 0 BEADLO Cc1ccc(C[NH+]2CC=CC2)c(Cl)n1 ZINC001142122164 961253404 /nfs/dbraw/zinc/25/34/04/961253404.db2.gz MWZAYRLPNXAXIB-UHFFFAOYSA-N 1 2 208.692 2.415 20 0 BEADLO COCC1C[NH+](Cc2ccc(C)nc2Cl)C1 ZINC001142121995 961258356 /nfs/dbraw/zinc/25/83/56/961258356.db2.gz CXVKOEYRNNQRIQ-UHFFFAOYSA-N 1 2 240.734 2.122 20 0 BEADLO [NH2+]=CNc1nc2ccc(Br)cc2[nH]1 ZINC001167869696 961371658 /nfs/dbraw/zinc/37/16/58/961371658.db2.gz ZMWQKSWEMWWKAJ-UHFFFAOYSA-N 1 2 239.076 2.344 20 0 BEADLO CC(C)(C)OC(=O)c1cccc(NC=[NH2+])n1 ZINC001167865081 961338446 /nfs/dbraw/zinc/33/84/46/961338446.db2.gz RNVNTXOMIUTSSC-UHFFFAOYSA-N 1 2 221.260 2.056 20 0 BEADLO [NH2+]=CNc1ccc2ccc(Cl)nc2n1 ZINC001167864965 961339861 /nfs/dbraw/zinc/33/98/61/961339861.db2.gz QIOAVZQWICKKSL-UHFFFAOYSA-N 1 2 206.636 2.302 20 0 BEADLO CCCOCCNc1[nH+]cc(OC)c2cc[nH]c21 ZINC001167872782 961387562 /nfs/dbraw/zinc/38/75/62/961387562.db2.gz SPPHBDBPTJLFAN-UHFFFAOYSA-N 1 2 249.314 2.410 20 0 BEADLO CCCOCCNc1ccc2[nH+]cn(C)c2c1 ZINC001167873000 961388925 /nfs/dbraw/zinc/38/89/25/961388925.db2.gz BEUBRKQOEXWYBM-UHFFFAOYSA-N 1 2 233.315 2.412 20 0 BEADLO CC(C)C=CC(=O)Nc1cc[nH+]c2c1CCC2 ZINC001142655829 961559773 /nfs/dbraw/zinc/55/97/73/961559773.db2.gz BUJHDUJLIBDCKD-VOTSOKGWSA-N 1 2 230.311 2.143 20 0 BEADLO Cc1nc(N[C@@H](C)CCO)cc(C(C)C)[nH+]1 ZINC000709783826 961576825 /nfs/dbraw/zinc/57/68/25/961576825.db2.gz HXOBRTYEYAOWSA-VIFPVBQESA-N 1 2 223.320 2.091 20 0 BEADLO CC(C)OC1C[NH+](Cc2cccc3nc[nH]c32)C1 ZINC001142692525 961629665 /nfs/dbraw/zinc/62/96/65/961629665.db2.gz IAMKKVCBGDSWRR-UHFFFAOYSA-N 1 2 245.326 2.172 20 0 BEADLO Cc1c[nH+]c(Nc2cc(F)nc(F)c2)c(N)c1 ZINC001213078343 961745167 /nfs/dbraw/zinc/74/51/67/961745167.db2.gz XXKMPDUVOZQUJO-UHFFFAOYSA-N 1 2 236.225 2.389 20 0 BEADLO COc1cc(C)c(C[NH+]2CC3(CCO3)C2)c(C)c1 ZINC001142935087 961839213 /nfs/dbraw/zinc/83/92/13/961839213.db2.gz OAUIIJGWEVFMMH-UHFFFAOYSA-N 1 2 247.338 2.287 20 0 BEADLO COc1cc(C)cc(C[N@@H+]2CCC(=O)[C@@H](C)C2)c1 ZINC001143150474 961892047 /nfs/dbraw/zinc/89/20/47/961892047.db2.gz PWJGFMALYMJQLO-LBPRGKRZSA-N 1 2 247.338 2.415 20 0 BEADLO COc1cc(C)cc(C[N@H+]2CCC(=O)[C@@H](C)C2)c1 ZINC001143150474 961892049 /nfs/dbraw/zinc/89/20/49/961892049.db2.gz PWJGFMALYMJQLO-LBPRGKRZSA-N 1 2 247.338 2.415 20 0 BEADLO CC[C@@H](CO)Nc1cc(CSC)cc[nH+]1 ZINC000092826492 961894110 /nfs/dbraw/zinc/89/41/10/961894110.db2.gz GTZVGVMFXYUOFT-JTQLQIEISA-N 1 2 226.345 2.127 20 0 BEADLO CC(C)N(C)C(=O)c1c[nH]c2cc[nH+]cc21 ZINC001152969298 962501246 /nfs/dbraw/zinc/50/12/46/962501246.db2.gz JSYSEZQJZPCSSL-UHFFFAOYSA-N 1 2 217.272 2.043 20 0 BEADLO CSCc1cc[nH+]c(NCc2nccn2C)c1 ZINC001154616124 962811207 /nfs/dbraw/zinc/81/12/07/962811207.db2.gz ISACTQNAYCBIGJ-UHFFFAOYSA-N 1 2 248.355 2.290 20 0 BEADLO CSc1c[nH+]c(NCC2COC2)c(C)c1 ZINC001154634308 962819591 /nfs/dbraw/zinc/81/95/91/962819591.db2.gz MPWKERAKAJSHAJ-UHFFFAOYSA-N 1 2 224.329 2.170 20 0 BEADLO CC[C@@H]1CCN(C(=O)C(C)(C)c2c[nH+]c[nH]2)[C@H]1C ZINC001154802041 962851680 /nfs/dbraw/zinc/85/16/80/962851680.db2.gz OCTGTJWUSVUGNG-WDEREUQCSA-N 1 2 249.358 2.334 20 0 BEADLO COc1c[nH+]c(NCc2nccc(C)n2)c(C)c1 ZINC001154817813 962855540 /nfs/dbraw/zinc/85/55/40/962855540.db2.gz YLLGJXWPXZFLTB-UHFFFAOYSA-N 1 2 244.298 2.109 20 0 BEADLO CCSc1cc[nH+]c(NCc2ncon2)c1 ZINC001154895415 962888638 /nfs/dbraw/zinc/88/86/38/962888638.db2.gz CVKBEOOSFOOZHO-UHFFFAOYSA-N 1 2 236.300 2.189 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CC[C@](C)(O)CC1 ZINC001154951990 962917076 /nfs/dbraw/zinc/91/70/76/962917076.db2.gz VNYFEBQKFVJYTO-MJHDQNEOSA-N 1 2 236.315 2.196 20 0 BEADLO CCc1ccc(NC(=[NH2+])C(C)(C)C)nn1 ZINC001155179574 963000265 /nfs/dbraw/zinc/00/02/65/963000265.db2.gz APUBTKWUTIEXFX-UHFFFAOYSA-N 1 2 206.293 2.474 20 0 BEADLO Cc1cncnc1Nc1ccn2cc[nH+]c2c1 ZINC001204970951 963134480 /nfs/dbraw/zinc/13/44/80/963134480.db2.gz CQOXYKPVZAKMOM-UHFFFAOYSA-N 1 2 225.255 2.176 20 0 BEADLO Cc1[nH+]c2ccc(N)cc2n1/C=C/C(C)(C)O ZINC001203217068 963145092 /nfs/dbraw/zinc/14/50/92/963145092.db2.gz CUNGSZAATOSHFI-VOTSOKGWSA-N 1 2 231.299 2.169 20 0 BEADLO CCc1[nH]c(CNC(=O)C(C)(C)C2CCC2)c[nH+]1 ZINC001156538639 963379530 /nfs/dbraw/zinc/37/95/30/963379530.db2.gz ZCJFEDLQKKQIBC-UHFFFAOYSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)C(C)(C)C2CCC2)[nH+]1 ZINC001156538639 963379541 /nfs/dbraw/zinc/37/95/41/963379541.db2.gz ZCJFEDLQKKQIBC-UHFFFAOYSA-N 1 2 249.358 2.415 20 0 BEADLO Cc1cc(C[NH+]2CC3(COC3)C2)cc(F)c1F ZINC001143592788 963395725 /nfs/dbraw/zinc/39/57/25/963395725.db2.gz VNMBWGCBBVCWPX-UHFFFAOYSA-N 1 2 239.265 2.105 20 0 BEADLO Cc1cc(NC2CC(=O)C2)nc(C(C)(C)C)[nH+]1 ZINC001156618607 963413569 /nfs/dbraw/zinc/41/35/69/963413569.db2.gz RYKVQQOWPCITPC-UHFFFAOYSA-N 1 2 233.315 2.226 20 0 BEADLO Cc1nc(N2CC3CC(C3)C2)c2c([nH+]1)CCC2 ZINC001156901911 963490302 /nfs/dbraw/zinc/49/03/02/963490302.db2.gz DZTFNFRXQAEVFQ-UHFFFAOYSA-N 1 2 229.327 2.120 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)[C@@H](C)C(C)C)[nH+]1 ZINC001157120281 963534322 /nfs/dbraw/zinc/53/43/22/963534322.db2.gz TZVMCYACDBDFEW-JTQLQIEISA-N 1 2 237.347 2.441 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)[C@@H](C)C(C)C)c[nH+]1 ZINC001157120281 963534325 /nfs/dbraw/zinc/53/43/25/963534325.db2.gz TZVMCYACDBDFEW-JTQLQIEISA-N 1 2 237.347 2.441 20 0 BEADLO CCN(c1nc(Cl)ccc1F)C1C[NH+](C)C1 ZINC001157455265 963615178 /nfs/dbraw/zinc/61/51/78/963615178.db2.gz GMQUIWURWHVUCD-UHFFFAOYSA-N 1 2 243.713 2.014 20 0 BEADLO C=Cc1ccc(N(CC)CCn2cc[nH+]c2)nc1 ZINC001157462477 963620811 /nfs/dbraw/zinc/62/08/11/963620811.db2.gz KAKLHPGLIHTGBF-UHFFFAOYSA-N 1 2 242.326 2.448 20 0 BEADLO CCC1(Nc2cc(C)[nH+]c(C3CC3)n2)COC1 ZINC001157540437 963653334 /nfs/dbraw/zinc/65/33/34/963653334.db2.gz WQBCWHVGYOECKD-UHFFFAOYSA-N 1 2 233.315 2.253 20 0 BEADLO CSc1cc[nH+]c(NC[C@H]2C[C@@](C)(O)C2)c1 ZINC001157560179 963663002 /nfs/dbraw/zinc/66/30/02/963663002.db2.gz NILKHRIGKAYMGE-WVSHTKLVSA-N 1 2 238.356 2.376 20 0 BEADLO CCCNc1cc[nH+]c(OC2CCOCC2)c1 ZINC001168136764 963834277 /nfs/dbraw/zinc/83/42/77/963834277.db2.gz KKOCJHASWXXKFT-UHFFFAOYSA-N 1 2 236.315 2.461 20 0 BEADLO COc1cccnc1C[N@@H+]1CCC[C@@H]1CF ZINC001206666291 963835859 /nfs/dbraw/zinc/83/58/59/963835859.db2.gz MPWHXCONSMTVFZ-SNVBAGLBSA-N 1 2 224.279 2.024 20 0 BEADLO COc1cccnc1C[N@H+]1CCC[C@@H]1CF ZINC001206666291 963835863 /nfs/dbraw/zinc/83/58/63/963835863.db2.gz MPWHXCONSMTVFZ-SNVBAGLBSA-N 1 2 224.279 2.024 20 0 BEADLO COc1cccc(NC(=O)[C@H](C)n2cc[nH+]c2)c1 ZINC000053898625 963845135 /nfs/dbraw/zinc/84/51/35/963845135.db2.gz UUGPPWSUCOUTHV-JTQLQIEISA-N 1 2 245.282 2.091 20 0 BEADLO Nc1ccc(NC2(c3ccccn3)CC2)c[nH+]1 ZINC001168150244 963869490 /nfs/dbraw/zinc/86/94/90/963869490.db2.gz CCBRXZNQGGUBMA-UHFFFAOYSA-N 1 2 226.283 2.160 20 0 BEADLO COc1cc(C)c[nH+]c1NCc1ncccc1O ZINC001158773740 963925366 /nfs/dbraw/zinc/92/53/66/963925366.db2.gz BQOQMDRLJVIQQR-UHFFFAOYSA-N 1 2 245.282 2.111 20 0 BEADLO Cc1nc(N2C3CCC2CC3)c2c([nH+]1)CCC2 ZINC001159082821 963993221 /nfs/dbraw/zinc/99/32/21/963993221.db2.gz PXZRGTAQHDTHPJ-UHFFFAOYSA-N 1 2 229.327 2.405 20 0 BEADLO COc1ccc2c(c1)C[C@H]([NH2+][C@H]1CC1(F)F)C2 ZINC001168228712 964012110 /nfs/dbraw/zinc/01/21/10/964012110.db2.gz ISDRJQAOMPZEKK-PWSUYJOCSA-N 1 2 239.265 2.160 20 0 BEADLO CCC=CNc1[nH+]cnc2c1ccn2C ZINC001159662555 964140030 /nfs/dbraw/zinc/14/00/30/964140030.db2.gz TVRFSXDDUOOKLQ-GQCTYLIASA-N 1 2 202.261 2.304 20 0 BEADLO Cn1c([N@@H+]2C(=N)SC=C2N)cc2ccccc21 ZINC001212040753 964169511 /nfs/dbraw/zinc/16/95/11/964169511.db2.gz HYGVPVSKZOOUKG-UHFFFAOYSA-N 1 2 244.323 2.092 20 0 BEADLO Cn1c([N@H+]2C(=N)SC=C2N)cc2ccccc21 ZINC001212040753 964169515 /nfs/dbraw/zinc/16/95/15/964169515.db2.gz HYGVPVSKZOOUKG-UHFFFAOYSA-N 1 2 244.323 2.092 20 0 BEADLO Cc1cc(-c2noc(C[NH+]3CCC3)n2)ccc1F ZINC001212093232 964253453 /nfs/dbraw/zinc/25/34/53/964253453.db2.gz MUNOTYAXOURJJM-UHFFFAOYSA-N 1 2 247.273 2.390 20 0 BEADLO CC(=O)CC(C)(C)Nc1cc(N)cc(Cl)[nH+]1 ZINC001160294310 964277387 /nfs/dbraw/zinc/27/73/87/964277387.db2.gz DPZHABPYLLLOIQ-UHFFFAOYSA-N 1 2 241.722 2.487 20 0 BEADLO C[C@H](Cc1ccncc1)[NH2+][C@@H]1CC1(F)F ZINC001256715841 1169837644 /nfs/dbraw/zinc/83/76/44/1169837644.db2.gz IKNJLJPDGWGXIV-PSASIEDQSA-N 1 2 212.243 2.010 20 0 BEADLO O=c1ccc(CNc2cc3cc[nH]c3c[nH+]2)c[nH]1 ZINC001168301552 964397968 /nfs/dbraw/zinc/39/79/68/964397968.db2.gz OOWYHTVPOKJZSG-UHFFFAOYSA-N 1 2 240.266 2.276 20 0 BEADLO COc1nn(C)cc1Nc1cccc2[nH+]c[nH]c21 ZINC001213026285 964410722 /nfs/dbraw/zinc/41/07/22/964410722.db2.gz QXLCYNBWUWCASK-UHFFFAOYSA-N 1 2 243.270 2.049 20 0 BEADLO Oc1cncc(Nc2cccc3[nH+]c[nH]c32)c1 ZINC001213027171 964436055 /nfs/dbraw/zinc/43/60/55/964436055.db2.gz MKPZNYRAONDRNP-UHFFFAOYSA-N 1 2 226.239 2.407 20 0 BEADLO CCC1(Nc2[nH+]cccc2-n2cccc2)COC1 ZINC001168321777 964442667 /nfs/dbraw/zinc/44/26/67/964442667.db2.gz PAWCYXREUVHFAK-UHFFFAOYSA-N 1 2 243.310 2.463 20 0 BEADLO CCC1(CNc2cc3cc[nH]c3c[nH+]2)COC1 ZINC001168328064 964458989 /nfs/dbraw/zinc/45/89/89/964458989.db2.gz IVWHKYNTXGDNKF-UHFFFAOYSA-N 1 2 231.299 2.401 20 0 BEADLO c1[nH+]cn(CC2CCC2)c1CNc1ccncn1 ZINC001161530175 964622360 /nfs/dbraw/zinc/62/23/60/964622360.db2.gz WJLBCKTWXPDHFA-UHFFFAOYSA-N 1 2 243.314 2.085 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)C1CC(F)C1 ZINC001142571639 964629279 /nfs/dbraw/zinc/62/92/79/964629279.db2.gz SWNXBAFFOLVYSD-UHFFFAOYSA-N 1 2 233.246 2.021 20 0 BEADLO Cc1cnc(NCc2c[nH+]cn2C(C)C)c(C)n1 ZINC001161562793 964640479 /nfs/dbraw/zinc/64/04/79/964640479.db2.gz GDZCFRSCOHAVFF-UHFFFAOYSA-N 1 2 245.330 2.483 20 0 BEADLO Cc1ncc(F)c(NCc2c[nH+]cn2C(C)C)n1 ZINC001161562787 964640948 /nfs/dbraw/zinc/64/09/48/964640948.db2.gz FVQAQOYAPFKRDN-UHFFFAOYSA-N 1 2 249.293 2.314 20 0 BEADLO Cc1nc(NCc2c[nH+]cn2C(C)C)ncc1F ZINC001161565695 964645427 /nfs/dbraw/zinc/64/54/27/964645427.db2.gz QQVJKDXILWLFFV-UHFFFAOYSA-N 1 2 249.293 2.314 20 0 BEADLO C1=CC=C([NH2+]C2CC[NH+](CC3CC3)CC2)[CH]1 ZINC001168363034 964655396 /nfs/dbraw/zinc/65/53/96/964655396.db2.gz QRWAURUNJLGBOW-UHFFFAOYSA-N 1 2 217.336 2.108 20 0 BEADLO CC(C)(C)CC[NH2+]c1c[nH]c2cc(=O)[nH]c-2c1 ZINC001161677007 964679332 /nfs/dbraw/zinc/67/93/32/964679332.db2.gz DPOGUMWKWLSNAX-UHFFFAOYSA-N 1 2 233.315 2.424 20 0 BEADLO Cc1nnc(NCCCn2cc[nH+]c2)c(C)c1C ZINC001161682539 964684700 /nfs/dbraw/zinc/68/47/00/964684700.db2.gz TYEGQCJZPGODTM-UHFFFAOYSA-N 1 2 245.330 2.101 20 0 BEADLO COc1nccc(C)c1NCCCn1cc[nH+]c1 ZINC001161688604 964686317 /nfs/dbraw/zinc/68/63/17/964686317.db2.gz VEJBPMHKXWLTGQ-UHFFFAOYSA-N 1 2 246.314 2.097 20 0 BEADLO Nc1ccc(F)c(NCCCn2cc[nH+]c2)c1 ZINC001161688083 964688003 /nfs/dbraw/zinc/68/80/03/964688003.db2.gz IVETWVDBXPLHQZ-UHFFFAOYSA-N 1 2 234.278 2.107 20 0 BEADLO C[C@H](O)c1ccc(-c2c[nH+]cn2C)cc1 ZINC000697922457 964691439 /nfs/dbraw/zinc/69/14/39/964691439.db2.gz OTJQCNROTHLZRM-VIFPVBQESA-N 1 2 202.257 2.140 20 0 BEADLO Cn1c[nH+]c2ccc(NC3CSC3)cc21 ZINC001168364931 964692263 /nfs/dbraw/zinc/69/22/63/964692263.db2.gz LIQOZPCLQILMKV-UHFFFAOYSA-N 1 2 219.313 2.101 20 0 BEADLO CC(C)Oc1cc(NC2CSC2)cc[nH+]1 ZINC001168365214 964701238 /nfs/dbraw/zinc/70/12/38/964701238.db2.gz OWXJHKDZFXSIPQ-UHFFFAOYSA-N 1 2 224.329 2.396 20 0 BEADLO COc1c[nH+]c(N[C@@H](CO)C(C)C)c2[nH]ccc21 ZINC001161735526 964722838 /nfs/dbraw/zinc/72/28/38/964722838.db2.gz VUYNPUUGVSLBDG-JTQLQIEISA-N 1 2 249.314 2.000 20 0 BEADLO Cn1c[nH+]c2ccc(NCC(F)F)cc21 ZINC001161813640 964762163 /nfs/dbraw/zinc/76/21/63/964762163.db2.gz QURACKCCDUKCDS-UHFFFAOYSA-N 1 2 211.215 2.250 20 0 BEADLO CSc1cc(NC2CCOCC2)nc(C)[nH+]1 ZINC001161859909 964797155 /nfs/dbraw/zinc/79/71/55/964797155.db2.gz VOUMSSIFSYWMBJ-UHFFFAOYSA-N 1 2 239.344 2.098 20 0 BEADLO Fc1c[nH+]ccc1NCc1nc2ccccc2o1 ZINC001161969347 964839446 /nfs/dbraw/zinc/83/94/46/964839446.db2.gz UACFSJHWZGARRB-UHFFFAOYSA-N 1 2 243.241 2.396 20 0 BEADLO CCc1coc(CNc2ccn3cc[nH+]c3c2)n1 ZINC001162137432 964852201 /nfs/dbraw/zinc/85/22/01/964852201.db2.gz CHSLKFYCXZEXQR-UHFFFAOYSA-N 1 2 242.282 2.497 20 0 BEADLO Cc1cc(C)n(CCNc2cccc[nH+]2)n1 ZINC001162144026 964855595 /nfs/dbraw/zinc/85/55/95/964855595.db2.gz XNLKVJUFGUJZRO-UHFFFAOYSA-N 1 2 216.288 2.007 20 0 BEADLO CCCCNc1ccc(-n2c[nH+]c(C)c2C)nn1 ZINC001162202082 964865799 /nfs/dbraw/zinc/86/57/99/964865799.db2.gz GMTABPLXWLFDOL-UHFFFAOYSA-N 1 2 245.330 2.491 20 0 BEADLO COc1cc[nH+]cc1NCCC1CCOCC1 ZINC001162221182 964880079 /nfs/dbraw/zinc/88/00/79/964880079.db2.gz JPEWJEWESYPETB-UHFFFAOYSA-N 1 2 236.315 2.319 20 0 BEADLO CC(F)(F)CNc1[nH+]cnc2[nH]cc(F)c21 ZINC001162226544 964882420 /nfs/dbraw/zinc/88/24/20/964882420.db2.gz SUPWAHCLKQMUOM-UHFFFAOYSA-N 1 2 230.193 2.164 20 0 BEADLO Cc1cc(NC[C@H](O)c2ccco2)c[nH+]c1C ZINC001162257239 964889899 /nfs/dbraw/zinc/88/98/99/964889899.db2.gz DNVNEQGUIKRDKU-LBPRGKRZSA-N 1 2 232.283 2.437 20 0 BEADLO O[C@@H](CNc1cc2cc[nH]c2c[nH+]1)c1ccco1 ZINC001162247214 964891904 /nfs/dbraw/zinc/89/19/04/964891904.db2.gz KWOVCNHOKVMKIW-NSHDSACASA-N 1 2 243.266 2.301 20 0 BEADLO CC[C@@H]([NH2+]Cc1cnon1)c1ccc(F)cc1 ZINC001168370277 964915880 /nfs/dbraw/zinc/91/58/80/964915880.db2.gz JCWMEDPZJDBQSF-GFCCVEGCSA-N 1 2 235.262 2.450 20 0 BEADLO C[C@@]1(O)CC[C@@H]([NH2+]c2ccc(O)cc2)CC1 ZINC001162360692 964943045 /nfs/dbraw/zinc/94/30/45/964943045.db2.gz LLSULYQNGBUSJN-AULYBMBSSA-N 1 2 221.300 2.498 20 0 BEADLO Cc1c[nH+]cc(NCCN2CCCCO2)c1C ZINC001162422484 964972216 /nfs/dbraw/zinc/97/22/16/964972216.db2.gz KWENULFOXMHLDV-UHFFFAOYSA-N 1 2 235.331 2.138 20 0 BEADLO Cc1c[nH+]c(Nc2cc(C)c(=O)n(C)c2)cc1C ZINC001162511389 965007696 /nfs/dbraw/zinc/00/76/96/965007696.db2.gz VBHNJEHBLGKBGE-UHFFFAOYSA-N 1 2 243.310 2.449 20 0 BEADLO Fc1ccnc(NCc2ccc3[nH+]ccn3c2)c1 ZINC001163136474 965261032 /nfs/dbraw/zinc/26/10/32/965261032.db2.gz IDUOQHNPZQHJLE-UHFFFAOYSA-N 1 2 242.257 2.481 20 0 BEADLO CC(=O)OC1C[NH+](Cc2cc(C)c(C)cc2C)C1 ZINC001231484198 965265962 /nfs/dbraw/zinc/26/59/62/965265962.db2.gz JCFMDBMQOANHGX-UHFFFAOYSA-N 1 2 247.338 2.359 20 0 BEADLO CC1(O)C[NH+](Cc2ccc3ccsc3c2)C1 ZINC001232610256 965385343 /nfs/dbraw/zinc/38/53/43/965385343.db2.gz LVGFPJZVLWNHQM-UHFFFAOYSA-N 1 2 233.336 2.468 20 0 BEADLO COC(=O)c1ccc2cc[nH+]c(N(C)C)c2c1 ZINC001163569114 965455150 /nfs/dbraw/zinc/45/51/50/965455150.db2.gz HNEAVGVROFUKEB-UHFFFAOYSA-N 1 2 230.267 2.087 20 0 BEADLO COC(=O)C[C@H](c1cc[nH+]c(N(C)C)c1)C1CC1 ZINC001163572563 965455433 /nfs/dbraw/zinc/45/54/33/965455433.db2.gz NSEVPHNUGVXQTE-LBPRGKRZSA-N 1 2 248.326 2.204 20 0 BEADLO CCOC(=O)Cc1cc[nH+]c(N(C)C(C)C)c1 ZINC001163622394 965487447 /nfs/dbraw/zinc/48/74/47/965487447.db2.gz JEFXJEAPOYTSAZ-UHFFFAOYSA-N 1 2 236.315 2.032 20 0 BEADLO Cc1cnsc1C[N@H+]1C[C@@H](C)OC[C@H]1C ZINC001233322068 965492047 /nfs/dbraw/zinc/49/20/47/965492047.db2.gz QHFDLYTZEUXHIO-NXEZZACHSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1cnsc1C[N@@H+]1C[C@@H](C)OC[C@H]1C ZINC001233322068 965492054 /nfs/dbraw/zinc/49/20/54/965492054.db2.gz QHFDLYTZEUXHIO-NXEZZACHSA-N 1 2 226.345 2.061 20 0 BEADLO CC1(C)CN(c2ccc(Cl)c(N)[nH+]2)C1 ZINC001163729787 965544287 /nfs/dbraw/zinc/54/42/87/965544287.db2.gz DVUAMZVNSOKAHO-UHFFFAOYSA-N 1 2 211.696 2.163 20 0 BEADLO O=C1CCC[N@@H+]([C@@H]2CCc3cc(F)ccc3C2)C1 ZINC001168440870 965617585 /nfs/dbraw/zinc/61/75/85/965617585.db2.gz NCVBGGZEANMDKI-CQSZACIVSA-N 1 2 247.313 2.348 20 0 BEADLO O=C1CCC[N@H+]([C@@H]2CCc3cc(F)ccc3C2)C1 ZINC001168440870 965617591 /nfs/dbraw/zinc/61/75/91/965617591.db2.gz NCVBGGZEANMDKI-CQSZACIVSA-N 1 2 247.313 2.348 20 0 BEADLO CCc1cc(N2CC(F)(C3CC3)C2)nc(C)[nH+]1 ZINC001163968871 965666241 /nfs/dbraw/zinc/66/62/41/965666241.db2.gz FHPRLRDPVZMKPT-UHFFFAOYSA-N 1 2 235.306 2.286 20 0 BEADLO CC1(C)C[C@H](CNc2ccn3cc[nH+]c3c2)O1 ZINC001168452247 965750301 /nfs/dbraw/zinc/75/03/01/965750301.db2.gz FCNJSDDPHZEZGK-LLVKDONJSA-N 1 2 231.299 2.314 20 0 BEADLO CCCc1cc(N2C[C@@H](F)[C@H](F)C2)nc(C)[nH+]1 ZINC001164211593 965795095 /nfs/dbraw/zinc/79/50/95/965795095.db2.gz ZGBYHHTWUGTNAO-GHMZBOCLSA-N 1 2 241.285 2.234 20 0 BEADLO CCCNc1cc(N2CC[C@@H]3C[C@@H]3C2)nc[nH+]1 ZINC000699171200 965797915 /nfs/dbraw/zinc/79/79/15/965797915.db2.gz CXNKVWBHHDQYPF-GHMZBOCLSA-N 1 2 232.331 2.145 20 0 BEADLO CCCNc1cc(N2CC[C@@H]3C[C@@H]3C2)[nH+]cn1 ZINC000699171200 965797922 /nfs/dbraw/zinc/79/79/22/965797922.db2.gz CXNKVWBHHDQYPF-GHMZBOCLSA-N 1 2 232.331 2.145 20 0 BEADLO CCc1[nH]c(CNc2nccs2)c[nH+]1 ZINC001164243223 965810231 /nfs/dbraw/zinc/81/02/31/965810231.db2.gz GQDUEJPVQQQFHH-UHFFFAOYSA-N 1 2 208.290 2.041 20 0 BEADLO CCc1[nH]cc(CNc2nccs2)[nH+]1 ZINC001164243223 965810233 /nfs/dbraw/zinc/81/02/33/965810233.db2.gz GQDUEJPVQQQFHH-UHFFFAOYSA-N 1 2 208.290 2.041 20 0 BEADLO Cc1nc(N2C[C@@H](C)C[C@H]2CF)c2c([nH+]1)CCC2 ZINC001164259803 965812774 /nfs/dbraw/zinc/81/27/74/965812774.db2.gz HZDCMCNTKMSBMB-ONGXEEELSA-N 1 2 249.333 2.458 20 0 BEADLO C[C@@H]1CCN(c2cccc(C3CC3)[nH+]2)C[C@H]1O ZINC001164277312 965821576 /nfs/dbraw/zinc/82/15/76/965821576.db2.gz LAGCXIBCCGXZLG-ZWNOBZJWSA-N 1 2 232.327 2.166 20 0 BEADLO C/C(=C\C=C\N)[NH2+]C1(c2cccc(C)c2)COC1 ZINC001168473217 965848465 /nfs/dbraw/zinc/84/84/65/965848465.db2.gz FLFFNIMMIULPTP-OUMYDGPMSA-N 1 2 244.338 2.186 20 0 BEADLO c1ccn(CCNc2ccn3cc[nH+]c3c2)c1 ZINC001164446756 965885957 /nfs/dbraw/zinc/88/59/57/965885957.db2.gz JOGRWRGLAPNGNV-UHFFFAOYSA-N 1 2 226.283 2.248 20 0 BEADLO CC[C@H]([NH2+]Cc1nnc[nH]1)c1ccc(C)c(F)c1 ZINC001307641992 965953412 /nfs/dbraw/zinc/95/34/12/965953412.db2.gz CRKYTOWUJKBYQX-LBPRGKRZSA-N 1 2 248.305 2.493 20 0 BEADLO CC(C)c1ccc(N2CC[C@](C)(O)C2)[nH+]c1 ZINC001165230344 965996287 /nfs/dbraw/zinc/99/62/87/965996287.db2.gz YARQMCMKKOTDEC-ZDUSSCGKSA-N 1 2 220.316 2.166 20 0 BEADLO CC(C)(C)COC(=O)NCCCn1cc[nH+]c1 ZINC000653831417 966046017 /nfs/dbraw/zinc/04/60/17/966046017.db2.gz YAEKCOQZOWTRMJ-UHFFFAOYSA-N 1 2 239.319 2.046 20 0 BEADLO C[C@H]1COC[C@H]1Nc1[nH+]c2ccccc2n1C ZINC000699752082 966070059 /nfs/dbraw/zinc/07/00/59/966070059.db2.gz CTFIPHHPVOUWNK-GXSJLCMTSA-N 1 2 231.299 2.020 20 0 BEADLO COc1ccc2cc(N[C@H](C)CCO)[nH+]cc2c1 ZINC001165866161 966177234 /nfs/dbraw/zinc/17/72/34/966177234.db2.gz DTUQYFZXEUDYDW-SNVBAGLBSA-N 1 2 246.310 2.426 20 0 BEADLO CC(C)Oc1cc(N[C@@H](C)CCO)cc[nH+]1 ZINC001165906511 966196512 /nfs/dbraw/zinc/19/65/12/966196512.db2.gz ZGXUDTIJMQZFIA-JTQLQIEISA-N 1 2 224.304 2.052 20 0 BEADLO CC(C)Oc1cc(N[C@H](C)CCO)cc[nH+]1 ZINC001165906512 966197934 /nfs/dbraw/zinc/19/79/34/966197934.db2.gz ZGXUDTIJMQZFIA-SNVBAGLBSA-N 1 2 224.304 2.052 20 0 BEADLO C[C@H](O)CCn1c[nH+]c(Cc2ccccc2)c1 ZINC000919150199 966295537 /nfs/dbraw/zinc/29/55/37/966295537.db2.gz ISNXDOMVFACRGH-LBPRGKRZSA-N 1 2 230.311 2.245 20 0 BEADLO Nc1cc(Cl)[nH+]c(N2CCn3cccc3C2)c1 ZINC001166602125 966317340 /nfs/dbraw/zinc/31/73/40/966317340.db2.gz VUKKWWCKFOYONH-UHFFFAOYSA-N 1 2 248.717 2.139 20 0 BEADLO COc1cc(C)c[nH+]c1N1CCn2cccc2C1 ZINC001166601858 966318790 /nfs/dbraw/zinc/31/87/90/966318790.db2.gz AQVVVFGEDDLCMJ-UHFFFAOYSA-N 1 2 243.310 2.220 20 0 BEADLO C[C@H]1CCCN(c2cc(N(C)C)[nH+]cn2)[C@H]1C ZINC001166612625 966334709 /nfs/dbraw/zinc/33/47/09/966334709.db2.gz XOSSSKZYTDKEFS-QWRGUYRKSA-N 1 2 234.347 2.167 20 0 BEADLO C[C@H]1CCCN(c2cc(N(C)C)nc[nH+]2)[C@H]1C ZINC001166612625 966334722 /nfs/dbraw/zinc/33/47/22/966334722.db2.gz XOSSSKZYTDKEFS-QWRGUYRKSA-N 1 2 234.347 2.167 20 0 BEADLO CCc1cc(N2CCCCC23COC3)nc(C)[nH+]1 ZINC001166691863 966367203 /nfs/dbraw/zinc/36/72/03/966367203.db2.gz MLOXKVCUJJRLKW-UHFFFAOYSA-N 1 2 247.342 2.107 20 0 BEADLO COc1ccc(C)[nH+]c1N1CCCCC12COC2 ZINC001166691455 966369332 /nfs/dbraw/zinc/36/93/32/966369332.db2.gz IRRMQJMFUATRBY-UHFFFAOYSA-N 1 2 248.326 2.158 20 0 BEADLO CSc1cc[nH+]c(N2Cc3cnn(C)c3C2)c1 ZINC001166763435 966405629 /nfs/dbraw/zinc/40/56/29/966405629.db2.gz XLJQFNQMISZWPN-UHFFFAOYSA-N 1 2 246.339 2.057 20 0 BEADLO Cn1cc[nH+]c1Cn1cnc(-c2ccccc2)c1 ZINC001166823907 966428044 /nfs/dbraw/zinc/42/80/44/966428044.db2.gz ZTKJXRJEIUOZKQ-UHFFFAOYSA-N 1 2 238.294 2.332 20 0 BEADLO CCN(c1cc(SC)cc[nH+]1)C1COC1 ZINC001166943771 966469211 /nfs/dbraw/zinc/46/92/11/966469211.db2.gz YEOUXTJVUBKFQY-UHFFFAOYSA-N 1 2 224.329 2.029 20 0 BEADLO Cc1cc(N(C)C2(C)COC2)nc(C(C)(C)C)[nH+]1 ZINC001166984780 966502427 /nfs/dbraw/zinc/50/24/27/966502427.db2.gz CRMIHRMYUXWWLH-UHFFFAOYSA-N 1 2 249.358 2.308 20 0 BEADLO Cc1c(F)cc[nH+]c1N1CCOC[C@@H]1C(C)C ZINC001166999348 966512976 /nfs/dbraw/zinc/51/29/76/966512976.db2.gz VVJGDECKOIFKPO-GFCCVEGCSA-N 1 2 238.306 2.390 20 0 BEADLO CC[NH+](CC)[C@@H](C(=O)N(C)C#N)c1ccccc1 ZINC001523362233 966561147 /nfs/dbraw/zinc/56/11/47/966561147.db2.gz YDLAEQDKDQWINQ-CYBMUJFWSA-N 1 2 245.326 2.009 20 0 BEADLO Cc1nnc(Nc2ccc(C)[nH+]c2C)o1 ZINC001203363009 966613458 /nfs/dbraw/zinc/61/34/58/966613458.db2.gz KDWDKMUJEDZZJA-UHFFFAOYSA-N 1 2 204.233 2.133 20 0 BEADLO Cc1ccc(Nc2ccnn2C2COC2)c(C)[nH+]1 ZINC001203370857 966619267 /nfs/dbraw/zinc/61/92/67/966619267.db2.gz XMRYKGWELFWAFA-UHFFFAOYSA-N 1 2 244.298 2.210 20 0 BEADLO Cc1ccc(Nc2cnns2)c(C)[nH+]1 ZINC001203369913 966620213 /nfs/dbraw/zinc/62/02/13/966620213.db2.gz FCSFNAVXQRHARJ-UHFFFAOYSA-N 1 2 206.274 2.294 20 0 BEADLO Cc1ccc(Nc2noc3nccnc23)c(C)[nH+]1 ZINC001203367198 966620686 /nfs/dbraw/zinc/62/06/86/966620686.db2.gz JIOHRXNBYLIZHU-UHFFFAOYSA-N 1 2 241.254 2.373 20 0 BEADLO CNc1ccc(Nc2ccc(N(C)C)nc2)c[nH+]1 ZINC001203446941 966642065 /nfs/dbraw/zinc/64/20/65/966642065.db2.gz HJNROLONLGABHI-UHFFFAOYSA-N 1 2 243.314 2.328 20 0 BEADLO CNc1ccc(Nc2ccc(C(=O)OC)o2)c[nH+]1 ZINC001203449530 966648223 /nfs/dbraw/zinc/64/82/23/966648223.db2.gz IEAFZZLEAUOKCN-UHFFFAOYSA-N 1 2 247.254 2.247 20 0 BEADLO CNc1ccc(Nc2c(N)cccc2O)c[nH+]1 ZINC001203460303 966653276 /nfs/dbraw/zinc/65/32/76/966653276.db2.gz TXKXMKNRLZEJRT-UHFFFAOYSA-N 1 2 230.271 2.155 20 0 BEADLO CNc1ccc(Nc2cccc(CO)c2F)c[nH+]1 ZINC001203458331 966653353 /nfs/dbraw/zinc/65/33/53/966653353.db2.gz KQNYXUAOVNETGI-UHFFFAOYSA-N 1 2 247.273 2.498 20 0 BEADLO CNc1ccc(Nc2ccc(CO)c(F)c2)c[nH+]1 ZINC001203462467 966656395 /nfs/dbraw/zinc/65/63/95/966656395.db2.gz SUBYKLUBRRETHL-UHFFFAOYSA-N 1 2 247.273 2.498 20 0 BEADLO CNc1ccc(N(C)c2cccc(N)c2)c[nH+]1 ZINC001203462130 966663429 /nfs/dbraw/zinc/66/34/29/966663429.db2.gz KHRKBZDLQMVBHJ-UHFFFAOYSA-N 1 2 228.299 2.473 20 0 BEADLO COc1ncc(Nc2cc(C)cc[nH+]2)cc1N ZINC001203497636 966663512 /nfs/dbraw/zinc/66/35/12/966663512.db2.gz SKHBJGSOODRXCQ-UHFFFAOYSA-N 1 2 230.271 2.119 20 0 BEADLO COc1ccoc1C[N@@H+]1CCOC[C@H]1C(C)C ZINC001237875390 966698751 /nfs/dbraw/zinc/69/87/51/966698751.db2.gz UUQSUIIHJGZMBE-NSHDSACASA-N 1 2 239.315 2.145 20 0 BEADLO COc1ccoc1C[N@H+]1CCOC[C@H]1C(C)C ZINC001237875390 966698755 /nfs/dbraw/zinc/69/87/55/966698755.db2.gz UUQSUIIHJGZMBE-NSHDSACASA-N 1 2 239.315 2.145 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2noc3nccnc23)c1 ZINC001203656235 966721420 /nfs/dbraw/zinc/72/14/20/966721420.db2.gz NJZDTCYCRJLNGS-UHFFFAOYSA-N 1 2 241.254 2.373 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2cncc(CO)c2)c1 ZINC001203658062 966725229 /nfs/dbraw/zinc/72/52/29/966725229.db2.gz VRXAAEGBZGYCGJ-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1c[nH]c2ccccc12 ZINC001204043655 966870519 /nfs/dbraw/zinc/87/05/19/966870519.db2.gz WXBSYRCKXLJYAQ-SNVBAGLBSA-N 1 2 246.310 2.161 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1c[nH]c2ccccc12 ZINC001204043655 966870525 /nfs/dbraw/zinc/87/05/25/966870525.db2.gz WXBSYRCKXLJYAQ-SNVBAGLBSA-N 1 2 246.310 2.161 20 0 BEADLO Cc1cccc(C[N@@H+]2CCC(=O)[C@@H](C)CC2)n1 ZINC001204067252 966877374 /nfs/dbraw/zinc/87/73/74/966877374.db2.gz QELIVDWWAJLDOT-NSHDSACASA-N 1 2 232.327 2.191 20 0 BEADLO Cc1cccc(C[N@H+]2CCC(=O)[C@@H](C)CC2)n1 ZINC001204067252 966877377 /nfs/dbraw/zinc/87/73/77/966877377.db2.gz QELIVDWWAJLDOT-NSHDSACASA-N 1 2 232.327 2.191 20 0 BEADLO C[C@]1(F)CC[N@H+](Cc2ccncc2)C[C@@H]1F ZINC001204080020 966886688 /nfs/dbraw/zinc/88/66/88/966886688.db2.gz DLLVUMOPDBULQT-RYUDHWBXSA-N 1 2 226.270 2.354 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2ccncc2)C[C@@H]1F ZINC001204080020 966886691 /nfs/dbraw/zinc/88/66/91/966886691.db2.gz DLLVUMOPDBULQT-RYUDHWBXSA-N 1 2 226.270 2.354 20 0 BEADLO CC(C)OC1C[NH+](Cc2ccc(O)cc2)C1 ZINC001204097470 966892935 /nfs/dbraw/zinc/89/29/35/966892935.db2.gz ZBRLHADLNCGVIK-UHFFFAOYSA-N 1 2 221.300 2.001 20 0 BEADLO Cc1cc(C)c(Nc2ccc(CO)nc2)c[nH+]1 ZINC001212372753 966934971 /nfs/dbraw/zinc/93/49/71/966934971.db2.gz VNCAFJCSWWFQJX-UHFFFAOYSA-N 1 2 229.283 2.329 20 0 BEADLO C[N@H+](Cc1ccc(F)c(Cl)c1)C1COC1 ZINC001204284312 966958575 /nfs/dbraw/zinc/95/85/75/966958575.db2.gz KAMSWQRQUVHQAY-UHFFFAOYSA-N 1 2 229.682 2.310 20 0 BEADLO C[N@@H+](Cc1ccc(F)c(Cl)c1)C1COC1 ZINC001204284312 966958576 /nfs/dbraw/zinc/95/85/76/966958576.db2.gz KAMSWQRQUVHQAY-UHFFFAOYSA-N 1 2 229.682 2.310 20 0 BEADLO CC(=O)[C@H]1C[N@H+](Cc2cc(C)cc(C)c2)CCO1 ZINC001204527038 967022727 /nfs/dbraw/zinc/02/27/27/967022727.db2.gz NGLSTXBQESWFSH-OAHLLOKOSA-N 1 2 247.338 2.093 20 0 BEADLO CC(=O)[C@H]1C[N@@H+](Cc2cc(C)cc(C)c2)CCO1 ZINC001204527038 967022739 /nfs/dbraw/zinc/02/27/39/967022739.db2.gz NGLSTXBQESWFSH-OAHLLOKOSA-N 1 2 247.338 2.093 20 0 BEADLO CC[N@H+](Cc1cc(C)c(C)o1)C1COC1 ZINC001204533892 967030446 /nfs/dbraw/zinc/03/04/46/967030446.db2.gz SRIVVWNSTLPYCL-UHFFFAOYSA-N 1 2 209.289 2.117 20 0 BEADLO CC[N@@H+](Cc1cc(C)c(C)o1)C1COC1 ZINC001204533892 967030449 /nfs/dbraw/zinc/03/04/49/967030449.db2.gz SRIVVWNSTLPYCL-UHFFFAOYSA-N 1 2 209.289 2.117 20 0 BEADLO Cc1c(C[N@@H+]2CC[C@@](C)(F)[C@H](F)C2)cnn1C ZINC001204570041 967055647 /nfs/dbraw/zinc/05/56/47/967055647.db2.gz ZDIXXOGKNMFQMN-VXGBXAGGSA-N 1 2 243.301 2.001 20 0 BEADLO Cc1c(C[N@H+]2CC[C@@](C)(F)[C@H](F)C2)cnn1C ZINC001204570041 967055659 /nfs/dbraw/zinc/05/56/59/967055659.db2.gz ZDIXXOGKNMFQMN-VXGBXAGGSA-N 1 2 243.301 2.001 20 0 BEADLO Cc1c[nH]c(=O)c(Nc2c[nH+]c(N)c(C)c2)c1 ZINC001249785512 967063615 /nfs/dbraw/zinc/06/36/15/967063615.db2.gz WLNPAFXVCZCYMS-UHFFFAOYSA-N 1 2 230.271 2.125 20 0 BEADLO Cc1[nH+]c[nH]c1CN1CCCC(F)(F)[C@@H](F)C1 ZINC001204587997 967081816 /nfs/dbraw/zinc/08/18/16/967081816.db2.gz RFYQLAUUWDVBGG-JTQLQIEISA-N 1 2 247.264 2.287 20 0 BEADLO COC(=O)[C@H]([NH3+])c1ccc(-c2ccoc2)cc1 ZINC001239690847 967089718 /nfs/dbraw/zinc/08/97/18/967089718.db2.gz RVSCWVMZUUAWQR-GFCCVEGCSA-N 1 2 231.251 2.119 20 0 BEADLO Cc1[nH+]c[nH]c1CN1Cc2cnc(Cl)cc2C1 ZINC001204602931 967100630 /nfs/dbraw/zinc/10/06/30/967100630.db2.gz BNNMTEHYGAUKQJ-UHFFFAOYSA-N 1 2 248.717 2.282 20 0 BEADLO CC[C@@H](C)c1c[nH+]c2c(c1)OCCN2C ZINC001249863730 967101421 /nfs/dbraw/zinc/10/14/21/967101421.db2.gz XDICWZHRPJQGKO-SECBINFHSA-N 1 2 206.289 2.424 20 0 BEADLO COc1ccccc1C(=O)Cc1ccc(N)[nH+]c1 ZINC001249889049 967133634 /nfs/dbraw/zinc/13/36/34/967133634.db2.gz ORDNPVFPBGAVHH-UHFFFAOYSA-N 1 2 242.278 2.098 20 0 BEADLO COc1ccc(C(=O)Cc2ccc(N)[nH+]c2)cc1 ZINC001249904366 967139880 /nfs/dbraw/zinc/13/98/80/967139880.db2.gz VQVVTABPGWZXBS-UHFFFAOYSA-N 1 2 242.278 2.098 20 0 BEADLO COc1cc(CO)ccc1-c1c[nH+]c(N)c(C)c1 ZINC001204803042 967178491 /nfs/dbraw/zinc/17/84/91/967178491.db2.gz QQAOKNQTSPZVCT-UHFFFAOYSA-N 1 2 244.294 2.140 20 0 BEADLO COCCc1ccc(N2CCCCC2)[nH+]c1 ZINC001249939121 967180631 /nfs/dbraw/zinc/18/06/31/967180631.db2.gz ZUNBAQOEZXRZCQ-UHFFFAOYSA-N 1 2 220.316 2.261 20 0 BEADLO Cc1cnc(Nc2ccn3cc[nH+]c3c2)nc1C ZINC001204944148 967244377 /nfs/dbraw/zinc/24/43/77/967244377.db2.gz UKTBAIUIGQQZPR-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cc1cc(Nc2ccn3cc[nH+]c3c2)nc(C)n1 ZINC001204943745 967246247 /nfs/dbraw/zinc/24/62/47/967246247.db2.gz NCTRMULQBWMHFS-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Nc1ccn(-c2ccn3cc[nH+]c3c2)c2nccc1-2 ZINC001204951453 967248862 /nfs/dbraw/zinc/24/88/62/967248862.db2.gz SJYWMGDXUGPMBR-UHFFFAOYSA-N 1 2 249.277 2.207 20 0 BEADLO Cc1ccc(O)c(Nc2ccn3cc[nH+]c3c2)n1 ZINC001204951457 967250842 /nfs/dbraw/zinc/25/08/42/967250842.db2.gz SSNARYREWJDZNN-UHFFFAOYSA-N 1 2 240.266 2.487 20 0 BEADLO Cc1c[nH]c(=O)c(Nc2ccn3cc[nH+]c3c2)c1 ZINC001204959296 967260093 /nfs/dbraw/zinc/26/00/93/967260093.db2.gz LGAHSOMJGXOMPD-UHFFFAOYSA-N 1 2 240.266 2.487 20 0 BEADLO Cc1ncncc1Nc1ccn2cc[nH+]c2c1 ZINC001204959549 967262863 /nfs/dbraw/zinc/26/28/63/967262863.db2.gz PUAKKECGMVSOCM-UHFFFAOYSA-N 1 2 225.255 2.176 20 0 BEADLO CCOc1cc(C[N@H+](C)Cc2ccno2)ccn1 ZINC001250013179 967271844 /nfs/dbraw/zinc/27/18/44/967271844.db2.gz AUBNZENTXAUDDX-UHFFFAOYSA-N 1 2 247.298 2.100 20 0 BEADLO CCOc1cc(C[N@@H+](C)Cc2ccno2)ccn1 ZINC001250013179 967271849 /nfs/dbraw/zinc/27/18/49/967271849.db2.gz AUBNZENTXAUDDX-UHFFFAOYSA-N 1 2 247.298 2.100 20 0 BEADLO FC(F)(F)Cc1ccc(N2CCOCC2)[nH+]c1 ZINC001250030643 967284486 /nfs/dbraw/zinc/28/44/86/967284486.db2.gz MKVHGCBPQSETRR-UHFFFAOYSA-N 1 2 246.232 2.023 20 0 BEADLO COC(=O)[C@@H]1CC[N@@H+]1Cc1cccc(C)c1C ZINC001205066474 967322422 /nfs/dbraw/zinc/32/24/22/967322422.db2.gz CUHUAUATIOEXDF-ZDUSSCGKSA-N 1 2 233.311 2.051 20 0 BEADLO COC(=O)[C@@H]1CC[N@H+]1Cc1cccc(C)c1C ZINC001205066474 967322434 /nfs/dbraw/zinc/32/24/34/967322434.db2.gz CUHUAUATIOEXDF-ZDUSSCGKSA-N 1 2 233.311 2.051 20 0 BEADLO Cc1ccc(C[N@@H+]2CCOC3(CC3)C2)cc1F ZINC001205251546 967441696 /nfs/dbraw/zinc/44/16/96/967441696.db2.gz LSEQGAKXVDDTFB-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1ccc(C[N@H+]2CCOC3(CC3)C2)cc1F ZINC001205251546 967441697 /nfs/dbraw/zinc/44/16/97/967441697.db2.gz LSEQGAKXVDDTFB-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO CNc1ccc(Nc2ccc(F)cn2)c[nH+]1 ZINC001203448344 967450105 /nfs/dbraw/zinc/45/01/05/967450105.db2.gz YDSGOLLZOWWPFP-UHFFFAOYSA-N 1 2 218.235 2.401 20 0 BEADLO CCn1nccc1Nc1cc(C)[nH+]c(OC)c1 ZINC001205289506 967484220 /nfs/dbraw/zinc/48/42/20/967484220.db2.gz YCGGIDOXGREORD-UHFFFAOYSA-N 1 2 232.287 2.359 20 0 BEADLO CC1(C)OC[C@@H](Cc2ccn3cc[nH+]c3c2)O1 ZINC001250184210 967489609 /nfs/dbraw/zinc/48/96/09/967489609.db2.gz DJPIFOSCHRQTLY-LLVKDONJSA-N 1 2 232.283 2.028 20 0 BEADLO FCCCCc1ccc(N2CCOCC2)[nH+]c1 ZINC001250259407 967562385 /nfs/dbraw/zinc/56/23/85/967562385.db2.gz GQGLISYRXZOSHY-UHFFFAOYSA-N 1 2 238.306 2.210 20 0 BEADLO Cc1ccc(CC[NH+]2CCOCC2)cc1F ZINC001250274919 967604946 /nfs/dbraw/zinc/60/49/46/967604946.db2.gz UIRUCZKOCIYMIM-UHFFFAOYSA-N 1 2 223.291 2.009 20 0 BEADLO CSc1cccc(CC[NH+]2CCOCC2)c1 ZINC001250276060 967613856 /nfs/dbraw/zinc/61/38/56/967613856.db2.gz XNIZGCIPMCAGOD-UHFFFAOYSA-N 1 2 237.368 2.283 20 0 BEADLO c1cn2cc(Cc3ccncc3)ccc2[nH+]1 ZINC001250313339 967670456 /nfs/dbraw/zinc/67/04/56/967670456.db2.gz ZQGIUUSIKXONPN-UHFFFAOYSA-N 1 2 209.252 2.320 20 0 BEADLO c1cn(CCc2cccc3c2OCC3)c[nH+]1 ZINC001250316275 967680894 /nfs/dbraw/zinc/68/08/94/967680894.db2.gz GIQFACXPDJXULP-UHFFFAOYSA-N 1 2 214.268 2.061 20 0 BEADLO COc1cc(F)c(CCn2cc[nH+]c2)c(F)c1 ZINC001250316609 967684388 /nfs/dbraw/zinc/68/43/88/967684388.db2.gz ONMUEJNGLUWXPZ-UHFFFAOYSA-N 1 2 238.237 2.413 20 0 BEADLO CC(C)(O)c1ccc(CCn2cc[nH+]c2)cc1 ZINC001250318383 967687042 /nfs/dbraw/zinc/68/70/42/967687042.db2.gz FWSFHMUHMYXBLU-UHFFFAOYSA-N 1 2 230.311 2.353 20 0 BEADLO O=c1[nH]c2ccccc2cc1CCn1cc[nH+]c1 ZINC001250316661 967688069 /nfs/dbraw/zinc/68/80/69/967688069.db2.gz RLTGXCJKHFPSIN-UHFFFAOYSA-N 1 2 239.278 2.380 20 0 BEADLO COCOc1cc(C)ccc1CCn1cc[nH+]c1 ZINC001250316778 967688993 /nfs/dbraw/zinc/68/89/93/967688993.db2.gz XNHOVBPKCKIZNO-UHFFFAOYSA-N 1 2 246.310 2.417 20 0 BEADLO Oc1c(F)cc(CCn2cc[nH+]c2)cc1F ZINC001250319514 967692928 /nfs/dbraw/zinc/69/29/28/967692928.db2.gz SUJQLGMBXJHJKZ-UHFFFAOYSA-N 1 2 224.210 2.110 20 0 BEADLO Cc1c(C)c(CCn2cc[nH+]c2)ccc1CO ZINC001250319346 967694814 /nfs/dbraw/zinc/69/48/14/967694814.db2.gz CJWMVRSPHGMVBN-UHFFFAOYSA-N 1 2 230.311 2.235 20 0 BEADLO Oc1cc(Cl)ccc1CCn1cc[nH+]c1 ZINC001250320444 967697094 /nfs/dbraw/zinc/69/70/94/967697094.db2.gz LSAZTKSEZSXVMP-UHFFFAOYSA-N 1 2 222.675 2.485 20 0 BEADLO COC(=O)c1c(F)cccc1CCn1cc[nH+]c1 ZINC001250320774 967697663 /nfs/dbraw/zinc/69/76/63/967697663.db2.gz POSVQUXBNHEVIJ-UHFFFAOYSA-N 1 2 248.257 2.052 20 0 BEADLO OCc1cccc(CCn2cc[nH+]c2)c1Cl ZINC001250319986 967697964 /nfs/dbraw/zinc/69/79/64/967697964.db2.gz WKXCMVRRLIAQBO-UHFFFAOYSA-N 1 2 236.702 2.272 20 0 BEADLO Clc1cccc2c1C[C@H]([N@H+]1C[C@H]3C[C@@H](C1)O3)C2 ZINC001168741205 967708962 /nfs/dbraw/zinc/70/89/62/967708962.db2.gz WVSRDXFIIATQNL-UTUOFQBUSA-N 1 2 249.741 2.280 20 0 BEADLO Clc1cccc2c1C[C@H]([N@@H+]1C[C@H]3C[C@@H](C1)O3)C2 ZINC001168741205 967708974 /nfs/dbraw/zinc/70/89/74/967708974.db2.gz WVSRDXFIIATQNL-UTUOFQBUSA-N 1 2 249.741 2.280 20 0 BEADLO CNc1ccc(Nc2c(C)nn(C)c2C)c[nH+]1 ZINC001203448543 967713993 /nfs/dbraw/zinc/71/39/93/967713993.db2.gz ACIKGOURSFIMMH-UHFFFAOYSA-N 1 2 231.303 2.217 20 0 BEADLO Cc1ccc(F)c(C[N@@H+](C)C2(C)COC2)c1 ZINC001205654620 967741761 /nfs/dbraw/zinc/74/17/61/967741761.db2.gz BPOTZXUDLXVQQX-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO CN(C)c1ccc(NCC(C)(F)F)[nH+]c1 ZINC001162233253 967769261 /nfs/dbraw/zinc/76/92/61/967769261.db2.gz SXOJDEFEABHJFE-UHFFFAOYSA-N 1 2 215.247 2.215 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ncccc2C)n(C)n1 ZINC001205793685 967823105 /nfs/dbraw/zinc/82/31/05/967823105.db2.gz ZBNADEABMMENKU-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ncccc2C)n(C)n1 ZINC001205793685 967823109 /nfs/dbraw/zinc/82/31/09/967823109.db2.gz ZBNADEABMMENKU-UHFFFAOYSA-N 1 2 244.342 2.064 20 0 BEADLO Cc1ncc(-c2c[nH+]c(N(C)C)cc2C)cn1 ZINC001205854872 967845643 /nfs/dbraw/zinc/84/56/43/967845643.db2.gz XHNTXGQHFJTLDN-UHFFFAOYSA-N 1 2 228.299 2.221 20 0 BEADLO Cn1nccc1Cc1ccc(N2CCCC2)[nH+]c1 ZINC001250437932 967859549 /nfs/dbraw/zinc/85/95/49/967859549.db2.gz XULJKGYTDOYTET-UHFFFAOYSA-N 1 2 242.326 2.006 20 0 BEADLO COCCc1[nH]c2c(cc(F)cc2C)[nH+]1 ZINC001250595078 968126842 /nfs/dbraw/zinc/12/68/42/968126842.db2.gz KCHFYZVBHJYXRZ-UHFFFAOYSA-N 1 2 208.236 2.199 20 0 BEADLO C[C@H]1C[C@H]1c1[nH]c2cc3c(cc2[nH+]1)OCO3 ZINC001250614138 968161558 /nfs/dbraw/zinc/16/15/58/968161558.db2.gz GMFJFORSBSOPSG-NKWVEPMBSA-N 1 2 216.240 2.415 20 0 BEADLO CC(C)c1ccc(N2CC[C@@H](CO)[C@H]2C)[nH+]c1 ZINC001164049790 968162766 /nfs/dbraw/zinc/16/27/66/968162766.db2.gz AEEYMMVTXKYLHU-YPMHNXCESA-N 1 2 234.343 2.412 20 0 BEADLO Cc1cc(N2C[C@@H](O)[C@@H](F)C2)[nH+]c2ccccc12 ZINC001164112889 968176684 /nfs/dbraw/zinc/17/66/84/968176684.db2.gz OUHKRGBLGUOPBY-WCQYABFASA-N 1 2 246.285 2.062 20 0 BEADLO Cc1ccc(NC[C@H](O)C(F)(F)F)c(C)[nH+]1 ZINC001250956258 968219938 /nfs/dbraw/zinc/21/99/38/968219938.db2.gz XDZQTFYODWSMAS-VIFPVBQESA-N 1 2 234.221 2.034 20 0 BEADLO FC(F)n1cccc1C[N@@H+]1CC[C@]12CCOC2 ZINC001206328634 968234178 /nfs/dbraw/zinc/23/41/78/968234178.db2.gz MIDJOKNZWGUNQY-GFCCVEGCSA-N 1 2 242.269 2.248 20 0 BEADLO FC(F)n1cccc1C[N@H+]1CC[C@]12CCOC2 ZINC001206328634 968234185 /nfs/dbraw/zinc/23/41/85/968234185.db2.gz MIDJOKNZWGUNQY-GFCCVEGCSA-N 1 2 242.269 2.248 20 0 BEADLO Cn1nccc1C[N@H+](Cc1ccco1)C1CC1 ZINC001206355635 968253489 /nfs/dbraw/zinc/25/34/89/968253489.db2.gz UVJRNXOYKLKPDP-UHFFFAOYSA-N 1 2 231.299 2.178 20 0 BEADLO Cn1nccc1C[N@@H+](Cc1ccco1)C1CC1 ZINC001206355635 968253503 /nfs/dbraw/zinc/25/35/03/968253503.db2.gz UVJRNXOYKLKPDP-UHFFFAOYSA-N 1 2 231.299 2.178 20 0 BEADLO Cc1c(F)nccc1CNc1cc(CO)cc[nH+]1 ZINC001206366477 968259191 /nfs/dbraw/zinc/25/91/91/968259191.db2.gz UAVWDMIFBZVQES-UHFFFAOYSA-N 1 2 247.273 2.029 20 0 BEADLO CCCN(CC(C)C)C(=O)[C@H](C)n1cc[nH+]c1 ZINC001251283997 968280752 /nfs/dbraw/zinc/28/07/52/968280752.db2.gz ZBHMYGLNGWNRIN-LBPRGKRZSA-N 1 2 237.347 2.339 20 0 BEADLO COc1cnccc1C[N@@H+]1CCCC[C@@H](F)C1 ZINC001206438383 968306802 /nfs/dbraw/zinc/30/68/02/968306802.db2.gz RHNFPYSSEXSWOT-GFCCVEGCSA-N 1 2 238.306 2.414 20 0 BEADLO COc1cnccc1C[N@H+]1CCCC[C@@H](F)C1 ZINC001206438383 968306813 /nfs/dbraw/zinc/30/68/13/968306813.db2.gz RHNFPYSSEXSWOT-GFCCVEGCSA-N 1 2 238.306 2.414 20 0 BEADLO Cc1cc(N2CCC(=O)C[C@@H]2C)nc(C2CC2)[nH+]1 ZINC001166936273 968394762 /nfs/dbraw/zinc/39/47/62/968394762.db2.gz KEEJNJUTANEQCB-JTQLQIEISA-N 1 2 245.326 2.220 20 0 BEADLO COC(CN(C)c1cc2ccccc2c[nH+]1)OC ZINC001167028751 968422355 /nfs/dbraw/zinc/42/23/55/968422355.db2.gz ZHRHWEDXYCITRZ-UHFFFAOYSA-N 1 2 246.310 2.290 20 0 BEADLO CNc1ccc(Nc2cccc(F)n2)c[nH+]1 ZINC001203449056 968439407 /nfs/dbraw/zinc/43/94/07/968439407.db2.gz XYOPCNSSWNWWEJ-UHFFFAOYSA-N 1 2 218.235 2.401 20 0 BEADLO CCOC[C@H](O)CNc1ccc2ccc[nH+]c2c1 ZINC001252031905 968450355 /nfs/dbraw/zinc/45/03/55/968450355.db2.gz HCIADXFTGFYGLM-CYBMUJFWSA-N 1 2 246.310 2.044 20 0 BEADLO COc1cc(C)ccc1C[N@H+](C)CC(C)=O ZINC001206742431 968451143 /nfs/dbraw/zinc/45/11/43/968451143.db2.gz ZLWITSOZKDIHCA-UHFFFAOYSA-N 1 2 221.300 2.024 20 0 BEADLO COc1cc(C)ccc1C[N@@H+](C)CC(C)=O ZINC001206742431 968451146 /nfs/dbraw/zinc/45/11/46/968451146.db2.gz ZLWITSOZKDIHCA-UHFFFAOYSA-N 1 2 221.300 2.024 20 0 BEADLO C[N@H+](Cc1ccncc1F)C1CC(F)(F)C1 ZINC001206782083 968467707 /nfs/dbraw/zinc/46/77/07/968467707.db2.gz PLQDQSJRIWPXPY-UHFFFAOYSA-N 1 2 230.233 2.450 20 0 BEADLO C[N@@H+](Cc1ccncc1F)C1CC(F)(F)C1 ZINC001206782083 968467712 /nfs/dbraw/zinc/46/77/12/968467712.db2.gz PLQDQSJRIWPXPY-UHFFFAOYSA-N 1 2 230.233 2.450 20 0 BEADLO Fc1cncc(F)c1C[N@@H+]1CCC2(CC2)C1 ZINC001206855182 968503385 /nfs/dbraw/zinc/50/33/85/968503385.db2.gz PSFHPRSOZJFZKB-UHFFFAOYSA-N 1 2 224.254 2.346 20 0 BEADLO Fc1cncc(F)c1C[N@H+]1CCC2(CC2)C1 ZINC001206855182 968503387 /nfs/dbraw/zinc/50/33/87/968503387.db2.gz PSFHPRSOZJFZKB-UHFFFAOYSA-N 1 2 224.254 2.346 20 0 BEADLO Cc1ccnc(C[N@@H+]2CCc3ccncc3C2)c1 ZINC001206855203 968503693 /nfs/dbraw/zinc/50/36/93/968503693.db2.gz QLNADIWOHZQZET-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1ccnc(C[N@H+]2CCc3ccncc3C2)c1 ZINC001206855203 968503698 /nfs/dbraw/zinc/50/36/98/968503698.db2.gz QLNADIWOHZQZET-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO COc1cncc(C[N@@H+]2C[C@@H](F)C[C@H]2C)c1 ZINC001206993767 968532317 /nfs/dbraw/zinc/53/23/17/968532317.db2.gz MYVCXKTVLAVPQK-KOLCDFICSA-N 1 2 224.279 2.023 20 0 BEADLO COc1cncc(C[N@H+]2C[C@@H](F)C[C@H]2C)c1 ZINC001206993767 968532320 /nfs/dbraw/zinc/53/23/20/968532320.db2.gz MYVCXKTVLAVPQK-KOLCDFICSA-N 1 2 224.279 2.023 20 0 BEADLO FC1CC[NH+](Cc2ncc3ccccn32)CC1 ZINC001207048798 968582551 /nfs/dbraw/zinc/58/25/51/968582551.db2.gz KJIBZLDCLBQVGU-UHFFFAOYSA-N 1 2 233.290 2.268 20 0 BEADLO Cc1ncc(C[N@@H+]2CCCC(=O)CC2)s1 ZINC001207058147 968585761 /nfs/dbraw/zinc/58/57/61/968585761.db2.gz DWQZADZBAXDWKY-UHFFFAOYSA-N 1 2 224.329 2.007 20 0 BEADLO Cc1ncc(C[N@H+]2CCCC(=O)CC2)s1 ZINC001207058147 968585770 /nfs/dbraw/zinc/58/57/70/968585770.db2.gz DWQZADZBAXDWKY-UHFFFAOYSA-N 1 2 224.329 2.007 20 0 BEADLO CCc1nccc(C[N@H+](C)Cc2cccnc2)n1 ZINC001207082303 968613208 /nfs/dbraw/zinc/61/32/08/968613208.db2.gz JQVKSVHACHPRTC-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO CCc1nccc(C[N@@H+](C)Cc2cccnc2)n1 ZINC001207082303 968613216 /nfs/dbraw/zinc/61/32/16/968613216.db2.gz JQVKSVHACHPRTC-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1C[C@@H](C)[C@@H](F)C1 ZINC001207171003 968678039 /nfs/dbraw/zinc/67/80/39/968678039.db2.gz MNYQTAKNIRTZNL-PWSUYJOCSA-N 1 2 225.311 2.254 20 0 BEADLO CC(C)n1nccc1C[N@H+]1C[C@@H](C)[C@@H](F)C1 ZINC001207171003 968678047 /nfs/dbraw/zinc/67/80/47/968678047.db2.gz MNYQTAKNIRTZNL-PWSUYJOCSA-N 1 2 225.311 2.254 20 0 BEADLO Nc1cc(Cl)[nH+]c(NC2CC(F)C2)c1 ZINC001154833361 968685308 /nfs/dbraw/zinc/68/53/08/968685308.db2.gz WODLRFZEIJUUGT-UHFFFAOYSA-N 1 2 215.659 2.230 20 0 BEADLO Cc1cc(NCc2ccc[nH+]c2N)cnc1C ZINC001207325756 968722636 /nfs/dbraw/zinc/72/26/36/968722636.db2.gz IFWDBFAAZLMHQX-UHFFFAOYSA-N 1 2 228.299 2.288 20 0 BEADLO C[C@@H]1CN(CC2CCC(F)(F)CC2)CC[N@H+]1C ZINC001207348025 968728085 /nfs/dbraw/zinc/72/80/85/968728085.db2.gz PCIALXCULXPKEY-LLVKDONJSA-N 1 2 246.345 2.448 20 0 BEADLO C[C@@H]1CN(CC2CCC(F)(F)CC2)CC[N@@H+]1C ZINC001207348025 968728079 /nfs/dbraw/zinc/72/80/79/968728079.db2.gz PCIALXCULXPKEY-LLVKDONJSA-N 1 2 246.345 2.448 20 0 BEADLO C=Cc1ccc(OC)c(C[NH+]2CCOCC2)c1 ZINC001240833166 968739354 /nfs/dbraw/zinc/73/93/54/968739354.db2.gz GEGXBUKNVNCZGI-UHFFFAOYSA-N 1 2 233.311 2.170 20 0 BEADLO FC1(F)COCC[N@H+](C[C@H]2C[C@H]3C=C[C@@H]2C3)C1 ZINC001207615322 968832972 /nfs/dbraw/zinc/83/29/72/968832972.db2.gz DUGKJODEBKIVEG-QJPTWQEYSA-N 1 2 243.297 2.166 20 0 BEADLO FC1(F)COCC[N@@H+](C[C@H]2C[C@H]3C=C[C@@H]2C3)C1 ZINC001207615322 968832977 /nfs/dbraw/zinc/83/29/77/968832977.db2.gz DUGKJODEBKIVEG-QJPTWQEYSA-N 1 2 243.297 2.166 20 0 BEADLO FC1(F)COCC[N@H+](C[C@@H]2C[C@H]3C=C[C@@H]2C3)C1 ZINC001207615323 968834239 /nfs/dbraw/zinc/83/42/39/968834239.db2.gz DUGKJODEBKIVEG-TUAOUCFPSA-N 1 2 243.297 2.166 20 0 BEADLO FC1(F)COCC[N@@H+](C[C@@H]2C[C@H]3C=C[C@@H]2C3)C1 ZINC001207615323 968834240 /nfs/dbraw/zinc/83/42/40/968834240.db2.gz DUGKJODEBKIVEG-TUAOUCFPSA-N 1 2 243.297 2.166 20 0 BEADLO c1cc(NCCN2CCCCO2)[nH+]c2c1CCC2 ZINC001154997615 968847531 /nfs/dbraw/zinc/84/75/31/968847531.db2.gz MANYZIJHOJMJPS-UHFFFAOYSA-N 1 2 247.342 2.010 20 0 BEADLO CCOc1nccc(NC(=[NH2+])C(C)(C)C)n1 ZINC001155181328 968919434 /nfs/dbraw/zinc/91/94/34/968919434.db2.gz OJPFDUPDWNDEQI-UHFFFAOYSA-N 1 2 222.292 2.311 20 0 BEADLO CCC[C@H](O)CNc1ccc(-n2cc[nH+]c2)cc1 ZINC001252770920 968937870 /nfs/dbraw/zinc/93/78/70/968937870.db2.gz MFJRPLDCQSTOBF-AWEZNQCLSA-N 1 2 245.326 2.445 20 0 BEADLO CCC[C@@H](O)CNc1ccc(N(C)CC)[nH+]c1 ZINC001252778107 968951918 /nfs/dbraw/zinc/95/19/18/968951918.db2.gz LJXOBDINKIKEKF-GFCCVEGCSA-N 1 2 237.347 2.111 20 0 BEADLO OC1(C[N@@H+]2CCCC(F)(F)C2)CCCCC1 ZINC000405122539 968955326 /nfs/dbraw/zinc/95/53/26/968955326.db2.gz WVIHEWDCRJLCMN-UHFFFAOYSA-N 1 2 233.302 2.413 20 0 BEADLO OC1(C[N@H+]2CCCC(F)(F)C2)CCCCC1 ZINC000405122539 968955341 /nfs/dbraw/zinc/95/53/41/968955341.db2.gz WVIHEWDCRJLCMN-UHFFFAOYSA-N 1 2 233.302 2.413 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc([S@](C)=O)cc1 ZINC001241484420 969002934 /nfs/dbraw/zinc/00/29/34/969002934.db2.gz JXLQCKQYGDUJMD-UUODHLEQSA-N 1 2 221.325 2.300 20 0 BEADLO Oc1ccc[nH+]c1NC[C@H](O)c1ccc(F)cc1 ZINC001252833837 969032946 /nfs/dbraw/zinc/03/29/46/969032946.db2.gz CJYMJTVSZFVGCM-LBPRGKRZSA-N 1 2 248.257 2.072 20 0 BEADLO Cc1[nH]c[nH+]c1NC[C@@](C)(O)c1ccccc1 ZINC001253096163 969079527 /nfs/dbraw/zinc/07/95/27/969079527.db2.gz ZJESPODTUBJFAI-CYBMUJFWSA-N 1 2 231.299 2.038 20 0 BEADLO C[C@@](O)(CNc1[nH+]cccc1O)c1ccccc1 ZINC001253091547 969081272 /nfs/dbraw/zinc/08/12/72/969081272.db2.gz UDHYHCCNAKOBAI-CQSZACIVSA-N 1 2 244.294 2.107 20 0 BEADLO CC(=O)N1CCC[C@@H](CNc2c[nH+]ccc2C)C1 ZINC001168778822 969142357 /nfs/dbraw/zinc/14/23/57/969142357.db2.gz CCWLHCWQSIMLKF-ZDUSSCGKSA-N 1 2 247.342 2.060 20 0 BEADLO CC(=O)N1CCC[C@H](CNc2c[nH+]ccc2C)C1 ZINC001168778821 969142941 /nfs/dbraw/zinc/14/29/41/969142941.db2.gz CCWLHCWQSIMLKF-CYBMUJFWSA-N 1 2 247.342 2.060 20 0 BEADLO CCCCC[C@H](O)C[N@@H+]1Cc2cccnc2C1 ZINC001253521109 969197776 /nfs/dbraw/zinc/19/77/76/969197776.db2.gz ZOGHPUHMNMOJPP-ZDUSSCGKSA-N 1 2 234.343 2.338 20 0 BEADLO CCCCC[C@H](O)C[N@H+]1Cc2cccnc2C1 ZINC001253521109 969197777 /nfs/dbraw/zinc/19/77/77/969197777.db2.gz ZOGHPUHMNMOJPP-ZDUSSCGKSA-N 1 2 234.343 2.338 20 0 BEADLO Nc1[nH+]ccc(F)c1NCCC1CCC1 ZINC001168888708 969248871 /nfs/dbraw/zinc/24/88/71/969248871.db2.gz OXZRGZSZZBDZSP-UHFFFAOYSA-N 1 2 209.268 2.405 20 0 BEADLO C[N@@H+]1CCc2ncnc(NCCC3CCC3)c2C1 ZINC001168888605 969248897 /nfs/dbraw/zinc/24/88/97/969248897.db2.gz ITOXENUUQYKCAL-UHFFFAOYSA-N 1 2 246.358 2.067 20 0 BEADLO C[N@H+]1CCc2ncnc(NCCC3CCC3)c2C1 ZINC001168888605 969248904 /nfs/dbraw/zinc/24/89/04/969248904.db2.gz ITOXENUUQYKCAL-UHFFFAOYSA-N 1 2 246.358 2.067 20 0 BEADLO COC(=O)C[NH2+][C@H](Cc1ccccc1)CC(C)C ZINC001169050951 969367750 /nfs/dbraw/zinc/36/77/50/969367750.db2.gz SVYBBESJDYQBOK-AWEZNQCLSA-N 1 2 249.354 2.406 20 0 BEADLO Cc1cc(C)c(NC[C@@H](O)C(C)C)c[nH+]1 ZINC001253752371 969370320 /nfs/dbraw/zinc/37/03/20/969370320.db2.gz FQEOIBUBZGBWMD-GFCCVEGCSA-N 1 2 208.305 2.127 20 0 BEADLO CC(C)[C@H](O)CNc1ccc(N2CCCC2)[nH+]c1 ZINC001253757494 969377925 /nfs/dbraw/zinc/37/79/25/969377925.db2.gz KSCVKQPESGLBPH-CYBMUJFWSA-N 1 2 249.358 2.111 20 0 BEADLO Cn1ncc2c1C[N@H+](CCc1cccs1)C2 ZINC001209224450 969407349 /nfs/dbraw/zinc/40/73/49/969407349.db2.gz BWKYAFPZYHHXDS-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO Cn1ncc2c1C[N@@H+](CCc1cccs1)C2 ZINC001209224450 969407354 /nfs/dbraw/zinc/40/73/54/969407354.db2.gz BWKYAFPZYHHXDS-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO CCCc1nnc(-c2cccc3[nH+]ccn32)o1 ZINC001253952036 969427695 /nfs/dbraw/zinc/42/76/95/969427695.db2.gz RBCLEHBFOQCZNV-UHFFFAOYSA-N 1 2 228.255 2.337 20 0 BEADLO CC1(F)C[NH+](CC2Cc3ccccc3C2)C1 ZINC001209320638 969444206 /nfs/dbraw/zinc/44/42/06/969444206.db2.gz YUEBITDSNGAOHA-UHFFFAOYSA-N 1 2 219.303 2.445 20 0 BEADLO CC(C)(C)[N@@H+]1CC[C@H]1c1nnc(C2CC2)o1 ZINC001254087833 969485890 /nfs/dbraw/zinc/48/58/90/969485890.db2.gz XXXSJJAVGCTJPC-VIFPVBQESA-N 1 2 221.304 2.492 20 0 BEADLO CC(C)(C)[N@H+]1CC[C@H]1c1nnc(C2CC2)o1 ZINC001254087833 969485900 /nfs/dbraw/zinc/48/59/00/969485900.db2.gz XXXSJJAVGCTJPC-VIFPVBQESA-N 1 2 221.304 2.492 20 0 BEADLO C[N@@H+](Cc1ccon1)C[C@H]1Cc2ccccc2O1 ZINC001209566804 969549416 /nfs/dbraw/zinc/54/94/16/969549416.db2.gz UCJPNEYEMSHHDU-CYBMUJFWSA-N 1 2 244.294 2.110 20 0 BEADLO C[N@H+](Cc1ccon1)C[C@H]1Cc2ccccc2O1 ZINC001209566804 969549421 /nfs/dbraw/zinc/54/94/21/969549421.db2.gz UCJPNEYEMSHHDU-CYBMUJFWSA-N 1 2 244.294 2.110 20 0 BEADLO COc1cc(C[N@@H+]2C[C@H](F)C[C@H]2C)ccn1 ZINC001209637808 969569349 /nfs/dbraw/zinc/56/93/49/969569349.db2.gz SAMOYIGEANKNRN-MWLCHTKSSA-N 1 2 224.279 2.023 20 0 BEADLO COc1cc(C[N@H+]2C[C@H](F)C[C@H]2C)ccn1 ZINC001209637808 969569356 /nfs/dbraw/zinc/56/93/56/969569356.db2.gz SAMOYIGEANKNRN-MWLCHTKSSA-N 1 2 224.279 2.023 20 0 BEADLO Cc1cc(NC[C@H](O)C(F)(F)F)c[nH+]c1C ZINC001169456441 969641154 /nfs/dbraw/zinc/64/11/54/969641154.db2.gz QRSBJMCVOHTQDS-VIFPVBQESA-N 1 2 234.221 2.034 20 0 BEADLO Cc1c(Nc2ccc3[nH]c[nH+]c3c2)ncn1C ZINC001209849329 969664881 /nfs/dbraw/zinc/66/48/81/969664881.db2.gz WZXPMLNSDKRBEN-UHFFFAOYSA-N 1 2 227.271 2.348 20 0 BEADLO C[C@@H](C(=O)N1CC[C@@H](C)C(C)(C)C1)n1cc[nH+]c1 ZINC001254785268 969789995 /nfs/dbraw/zinc/78/99/95/969789995.db2.gz QXFALUWCTJQTPF-NEPJUHHUSA-N 1 2 249.358 2.339 20 0 BEADLO Cc1cccc(C)c1NC[C@H]1COCC[N@H+]1C ZINC001169654474 969801724 /nfs/dbraw/zinc/80/17/24/969801724.db2.gz SQCRACVTPJKCCH-ZDUSSCGKSA-N 1 2 234.343 2.046 20 0 BEADLO Cc1cccc(C)c1NC[C@H]1COCC[N@@H+]1C ZINC001169654474 969801732 /nfs/dbraw/zinc/80/17/32/969801732.db2.gz SQCRACVTPJKCCH-ZDUSSCGKSA-N 1 2 234.343 2.046 20 0 BEADLO CCn1cc(Nc2c[nH+]c(C)c(N)c2)c(C)n1 ZINC001210287428 969853391 /nfs/dbraw/zinc/85/33/91/969853391.db2.gz SSIIBTORELFLHG-UHFFFAOYSA-N 1 2 231.303 2.241 20 0 BEADLO Cc1[nH+]cc(Nc2cncnc2Cl)cc1N ZINC001210286679 969854269 /nfs/dbraw/zinc/85/42/69/969854269.db2.gz COUZAZSPVCYUNG-UHFFFAOYSA-N 1 2 235.678 2.159 20 0 BEADLO Cc1cnc(Nc2c[nH+]c(C)c(N)c2)c(C)n1 ZINC001210287402 969854541 /nfs/dbraw/zinc/85/45/41/969854541.db2.gz SGIPWBUAHMDZFH-UHFFFAOYSA-N 1 2 229.287 2.123 20 0 BEADLO Cc1nc(Nc2c[nH+]c(C)c(N)c2)cs1 ZINC001210288669 969856389 /nfs/dbraw/zinc/85/63/89/969856389.db2.gz MVUROSSABSMWFW-UHFFFAOYSA-N 1 2 220.301 2.481 20 0 BEADLO COc1ccc(N)cc1Nc1c[nH+]c(C)c(N)c1 ZINC001210290301 969860517 /nfs/dbraw/zinc/86/05/17/969860517.db2.gz JPCVHLIVRQBJMN-UHFFFAOYSA-N 1 2 244.298 2.307 20 0 BEADLO Cc1cc(C)c(Nc2ccn(C)n2)c[nH+]1 ZINC001210349065 969875808 /nfs/dbraw/zinc/87/58/08/969875808.db2.gz VZSKQLVAZLSVEO-UHFFFAOYSA-N 1 2 202.261 2.176 20 0 BEADLO c1ncc(CCNc2cccc[nH+]2)s1 ZINC001169860845 969876539 /nfs/dbraw/zinc/87/65/39/969876539.db2.gz GEXAYSYILTZLII-UHFFFAOYSA-N 1 2 205.286 2.193 20 0 BEADLO CC1(C)OC[C@@H](CNc2cc3cc[nH]c3c[nH+]2)O1 ZINC001169902552 969880037 /nfs/dbraw/zinc/88/00/37/969880037.db2.gz BIMHPHXPNBESQO-SNVBAGLBSA-N 1 2 247.298 2.126 20 0 BEADLO CCc1nnc(Cc2cn3cc(C)ccc3[nH+]2)o1 ZINC001255091562 969929452 /nfs/dbraw/zinc/92/94/52/969929452.db2.gz RRVDODROPOUKSN-UHFFFAOYSA-N 1 2 242.282 2.179 20 0 BEADLO CNC(=O)[C@H](C)Nc1cc2ccc(C)cc2c[nH+]1 ZINC001169979285 969930556 /nfs/dbraw/zinc/93/05/56/969930556.db2.gz JBASTEHAOSZPLE-JTQLQIEISA-N 1 2 243.310 2.090 20 0 BEADLO CC(C)n1ccc(-c2ccn3cc(N)[nH+]c3c2)n1 ZINC001242453873 969950347 /nfs/dbraw/zinc/95/03/47/969950347.db2.gz WSQCJDGDQUHGIF-UHFFFAOYSA-N 1 2 241.298 2.361 20 0 BEADLO Cn1ccc(-c2cccc(-c3c[nH+]cn3C)c2)n1 ZINC001242460240 969954642 /nfs/dbraw/zinc/95/46/42/969954642.db2.gz SZDBQJANSHBWRM-UHFFFAOYSA-N 1 2 238.294 2.488 20 0 BEADLO CC1(F)C[NH+](C2CC(C)(C)N(O)C(C)(C)C2)C1 ZINC001169992921 969961278 /nfs/dbraw/zinc/96/12/78/969961278.db2.gz NUQILSDACCHZED-UHFFFAOYSA-N 1 2 244.354 2.441 20 0 BEADLO CN(C)c1ccc(Nc2c[nH]c(=O)c(F)c2)c[nH+]1 ZINC001210596491 969968883 /nfs/dbraw/zinc/96/88/83/969968883.db2.gz HSCWEBHUESORKS-UHFFFAOYSA-N 1 2 248.261 2.131 20 0 BEADLO Cc1cc[nH+]c(Nc2c[nH]c(=O)c(F)c2)c1 ZINC001210596528 969970463 /nfs/dbraw/zinc/97/04/63/969970463.db2.gz JSOLYXPFHNIZCJ-UHFFFAOYSA-N 1 2 219.219 2.373 20 0 BEADLO C[C@H](O)c1ccc(N(C)c2[nH+]cccc2N)cc1 ZINC001210640604 969987945 /nfs/dbraw/zinc/98/79/45/969987945.db2.gz OYPGWZPQAWVTQS-JTQLQIEISA-N 1 2 243.310 2.485 20 0 BEADLO Cc1ccc(F)c(NCc2cc[nH+]c(N)c2)n1 ZINC001156756403 969994933 /nfs/dbraw/zinc/99/49/33/969994933.db2.gz XQFYLDCBKQHEJT-UHFFFAOYSA-N 1 2 232.262 2.118 20 0 BEADLO COC(=O)CCN(C)c1cc2ccccc2c[nH+]1 ZINC001156809511 970003610 /nfs/dbraw/zinc/00/36/10/970003610.db2.gz VOMKYCHMNKGBKW-UHFFFAOYSA-N 1 2 244.294 2.234 20 0 BEADLO CC(C)[N@@H+]1CC[C@H]1c1nnc(C2CCC2)o1 ZINC001255214739 970006397 /nfs/dbraw/zinc/00/63/97/970006397.db2.gz WAIVJFLVEPNSJG-JTQLQIEISA-N 1 2 221.304 2.492 20 0 BEADLO CC(C)[N@H+]1CC[C@H]1c1nnc(C2CCC2)o1 ZINC001255214739 970006402 /nfs/dbraw/zinc/00/64/02/970006402.db2.gz WAIVJFLVEPNSJG-JTQLQIEISA-N 1 2 221.304 2.492 20 0 BEADLO Nc1c[nH+]cc(NCCC(=O)c2ccccc2)c1 ZINC001170020952 970023654 /nfs/dbraw/zinc/02/36/54/970023654.db2.gz VVDJLGHFMPEHPD-UHFFFAOYSA-N 1 2 241.294 2.349 20 0 BEADLO COc1cc(Nc2cncc(C)n2)cc(C)[nH+]1 ZINC001210775910 970027030 /nfs/dbraw/zinc/02/70/30/970027030.db2.gz JZIZGZSPCJEILL-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO CCCCCCN1CC[NH2+]CC(F)(F)C1 ZINC001210815298 970048423 /nfs/dbraw/zinc/04/84/23/970048423.db2.gz SUKVFWHMXFWFBU-UHFFFAOYSA-N 1 2 220.307 2.107 20 0 BEADLO COC(=O)C1([NH2+]C2CCC(C)(C)CC2)CC1 ZINC001255295271 970060796 /nfs/dbraw/zinc/06/07/96/970060796.db2.gz CXMZHPXKAQKOGW-UHFFFAOYSA-N 1 2 225.332 2.250 20 0 BEADLO CCOC(=O)[C@@H]1CCC[C@H]([NH2+][C@H]2CC2(F)F)C1 ZINC001255337331 970119665 /nfs/dbraw/zinc/11/96/65/970119665.db2.gz PNYQGVSSBLJMOC-UTLUCORTSA-N 1 2 247.285 2.106 20 0 BEADLO COCc1cncc(Nc2[nH+]cc(C)cc2N)c1 ZINC001211075316 970136161 /nfs/dbraw/zinc/13/61/61/970136161.db2.gz KPZQLPCEQFMDMC-UHFFFAOYSA-N 1 2 244.298 2.257 20 0 BEADLO OCC1C[NH+](Cc2cccc(C(F)(F)F)c2)C1 ZINC000091467649 970234987 /nfs/dbraw/zinc/23/49/87/970234987.db2.gz WYRODBBXLZWXLE-UHFFFAOYSA-N 1 2 245.244 2.130 20 0 BEADLO Cc1cc(C)c(Nc2nccnc2N(C)C)c[nH+]1 ZINC001213505938 970324334 /nfs/dbraw/zinc/32/43/34/970324334.db2.gz UROPSFDBZFFBAV-UHFFFAOYSA-N 1 2 243.314 2.298 20 0 BEADLO Cc1cc(C)c(Nc2cc3n(n2)CCO3)c[nH+]1 ZINC001213510380 970330382 /nfs/dbraw/zinc/33/03/82/970330382.db2.gz AHINJYBQNQNOAJ-UHFFFAOYSA-N 1 2 230.271 2.031 20 0 BEADLO Cc1cc(C)c(Nc2cnc3cccnn32)c[nH+]1 ZINC001213507869 970330707 /nfs/dbraw/zinc/33/07/07/970330707.db2.gz HBEIUEZHSMKUNO-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cc1c[nH+]cc(Nc2cnc3nccn3c2)c1C ZINC001213529100 970357248 /nfs/dbraw/zinc/35/72/48/970357248.db2.gz VZGORFCBGXWONL-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO Cc1c[nH+]cc(Nc2cc(N)c(O)cc2O)c1C ZINC001213534120 970360643 /nfs/dbraw/zinc/36/06/43/970360643.db2.gz NKDQQXCYHIMRNW-UHFFFAOYSA-N 1 2 245.282 2.435 20 0 BEADLO COC[C@H](C)[N@@H+]1CCCCC(F)(F)C1 ZINC001255568704 970365088 /nfs/dbraw/zinc/36/50/88/970365088.db2.gz YIBWTLUOFOMKBK-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO COC[C@H](C)[N@H+]1CCCCC(F)(F)C1 ZINC001255568704 970365100 /nfs/dbraw/zinc/36/51/00/970365100.db2.gz YIBWTLUOFOMKBK-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO C[C@@H](CC(F)(F)F)[N@@H+]1CCOCC12CC2 ZINC001255660839 970441744 /nfs/dbraw/zinc/44/17/44/970441744.db2.gz KVMOEFIWGHVMEP-QMMMGPOBSA-N 1 2 223.238 2.192 20 0 BEADLO C[C@@H](CC(F)(F)F)[N@H+]1CCOCC12CC2 ZINC001255660839 970441754 /nfs/dbraw/zinc/44/17/54/970441754.db2.gz KVMOEFIWGHVMEP-QMMMGPOBSA-N 1 2 223.238 2.192 20 0 BEADLO Cc1ccc(N(C)c2[nH+]cccc2N)c(N)c1 ZINC001214176178 970448235 /nfs/dbraw/zinc/44/82/35/970448235.db2.gz WEPAVRDKEPSDDC-UHFFFAOYSA-N 1 2 228.299 2.322 20 0 BEADLO O=c1cc(-c2cccc3[nH+]ccn32)cc[nH]1 ZINC001243424994 970603032 /nfs/dbraw/zinc/60/30/32/970603032.db2.gz JIHXVZXYUGURGR-UHFFFAOYSA-N 1 2 211.224 2.102 20 0 BEADLO CCCCCc1nnc(C[N@H+](C)CC)o1 ZINC001256092797 970652950 /nfs/dbraw/zinc/65/29/50/970652950.db2.gz ATNXWKREFKQLGA-UHFFFAOYSA-N 1 2 211.309 2.254 20 0 BEADLO CCCCCc1nnc(C[N@@H+](C)CC)o1 ZINC001256092797 970652959 /nfs/dbraw/zinc/65/29/59/970652959.db2.gz ATNXWKREFKQLGA-UHFFFAOYSA-N 1 2 211.309 2.254 20 0 BEADLO COC(=O)C[NH2+][C@@H]1CCC[C@H](c2ccccc2)C1 ZINC001256106445 970657956 /nfs/dbraw/zinc/65/79/56/970657956.db2.gz JTVMJZNXRXUXFZ-UONOGXRCSA-N 1 2 247.338 2.475 20 0 BEADLO Cc1nc(C[NH2+][C@H]2CCCc3n[nH]cc32)cs1 ZINC000401625741 970707730 /nfs/dbraw/zinc/70/77/30/970707730.db2.gz ACDCUPQQIWUFCX-NSHDSACASA-N 1 2 248.355 2.342 20 0 BEADLO C[C@H]1C[C@H](Nc2ccc(N3CCCC3)[nH+]c2)CO1 ZINC000401805907 970735086 /nfs/dbraw/zinc/73/50/86/970735086.db2.gz BTSSTIPHQUYBOV-AAEUAGOBSA-N 1 2 247.342 2.271 20 0 BEADLO C[C@@H]1C[C@H](Nc2ccc([NH+](C)C)cc2)CO1 ZINC000401951727 970747251 /nfs/dbraw/zinc/74/72/51/970747251.db2.gz VEEZVGAKAKXFDG-PWSUYJOCSA-N 1 2 220.316 2.342 20 0 BEADLO Cc1c(O)cccc1C[N@H+]1CCC(=O)C[C@@H]1C ZINC001144108012 972574216 /nfs/dbraw/zinc/57/42/16/972574216.db2.gz RTPPFHVSAGVYTJ-JTQLQIEISA-N 1 2 233.311 2.254 20 0 BEADLO Cc1c(O)cccc1C[N@@H+]1CCC(=O)C[C@@H]1C ZINC001144108012 972574222 /nfs/dbraw/zinc/57/42/22/972574222.db2.gz RTPPFHVSAGVYTJ-JTQLQIEISA-N 1 2 233.311 2.254 20 0 BEADLO Cn1c[nH+]cc1CO[C@H]1CCOc2ccccc21 ZINC001222595256 972592452 /nfs/dbraw/zinc/59/24/52/972592452.db2.gz VCFLVMCFZFEIFB-AWEZNQCLSA-N 1 2 244.294 2.461 20 0 BEADLO Cn1c[nH+]cc1CO[C@H](c1cccnc1)C1CC1 ZINC001222600134 972601820 /nfs/dbraw/zinc/60/18/20/972601820.db2.gz KWAIOXBFIWFTJR-AWEZNQCLSA-N 1 2 243.310 2.483 20 0 BEADLO CCc1cc(C[NH+]2CCOCC2)cc(CC)c1O ZINC001144137997 972606584 /nfs/dbraw/zinc/60/65/84/972606584.db2.gz PBGSLVSPCVASDZ-UHFFFAOYSA-N 1 2 249.354 2.349 20 0 BEADLO CCOc1cccc([C@H](C)[NH2+]Cc2nnc[nH]2)c1 ZINC001327518504 972609015 /nfs/dbraw/zinc/60/90/15/972609015.db2.gz JJKWGSZHUYILOE-JTQLQIEISA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cccc([C@@H](C)[NH2+]Cc2nnc[nH]2)c1C ZINC001327553475 972629454 /nfs/dbraw/zinc/62/94/54/972629454.db2.gz FYVRVXYHTFTXJL-LLVKDONJSA-N 1 2 230.315 2.272 20 0 BEADLO CCOc1ccc(NCc2cc(C)n[nH]2)[nH+]c1C ZINC001327599138 972658691 /nfs/dbraw/zinc/65/86/91/972658691.db2.gz PKQNXFMPKZZYJA-UHFFFAOYSA-N 1 2 246.314 2.432 20 0 BEADLO CCOc1ccc(NCc2cc(C)[nH]n2)[nH+]c1C ZINC001327599138 972658698 /nfs/dbraw/zinc/65/86/98/972658698.db2.gz PKQNXFMPKZZYJA-UHFFFAOYSA-N 1 2 246.314 2.432 20 0 BEADLO CCc1cccc(C[N@@H+]2CCO[C@@H](C(C)=O)C2)c1 ZINC001144328638 972769356 /nfs/dbraw/zinc/76/93/56/972769356.db2.gz BGBRMLCPHOTHQL-OAHLLOKOSA-N 1 2 247.338 2.039 20 0 BEADLO CCc1cccc(C[N@H+]2CCO[C@@H](C(C)=O)C2)c1 ZINC001144328638 972769364 /nfs/dbraw/zinc/76/93/64/972769364.db2.gz BGBRMLCPHOTHQL-OAHLLOKOSA-N 1 2 247.338 2.039 20 0 BEADLO CCc1cccc(C[N@H+]2CCn3nccc3C2)c1 ZINC001144326609 972772991 /nfs/dbraw/zinc/77/29/91/972772991.db2.gz JATSPADVIOPVBE-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO CCc1cccc(C[N@@H+]2CCn3nccc3C2)c1 ZINC001144326609 972772973 /nfs/dbraw/zinc/77/29/73/972772973.db2.gz JATSPADVIOPVBE-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO Cc1nc(C[NH+]2CC3(CSC3)C2)sc1C ZINC001144374941 972793255 /nfs/dbraw/zinc/79/32/55/972793255.db2.gz IIOHIDGNQZJUDS-UHFFFAOYSA-N 1 2 240.397 2.309 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2cncs2)nc1 ZINC001144433359 972816797 /nfs/dbraw/zinc/81/67/97/972816797.db2.gz FHOVZUFOBBEQBP-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2cncs2)nc1 ZINC001144433359 972816803 /nfs/dbraw/zinc/81/68/03/972816803.db2.gz FHOVZUFOBBEQBP-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1cc(Cl)cc(C[N@H+](C)C2COC2)c1 ZINC001144488442 972840741 /nfs/dbraw/zinc/84/07/41/972840741.db2.gz IGDKSOIOHPGAFB-UHFFFAOYSA-N 1 2 241.718 2.179 20 0 BEADLO COc1cc(Cl)cc(C[N@@H+](C)C2COC2)c1 ZINC001144488442 972840744 /nfs/dbraw/zinc/84/07/44/972840744.db2.gz IGDKSOIOHPGAFB-UHFFFAOYSA-N 1 2 241.718 2.179 20 0 BEADLO C=CC(=O)OC[C@H](C)OCc1cc(C)[nH+]c(C)c1 ZINC001223418796 973047996 /nfs/dbraw/zinc/04/79/96/973047996.db2.gz AUHWDMZBMDFGNQ-LBPRGKRZSA-N 1 2 249.310 2.333 20 0 BEADLO C[C@H](c1nnc(C[NH+](C)C)o1)c1ccccc1F ZINC001328433525 973055274 /nfs/dbraw/zinc/05/52/74/973055274.db2.gz NWUHUNCUVWZFLC-VIFPVBQESA-N 1 2 249.289 2.422 20 0 BEADLO CC1=C(OCc2cc(C)[nH+]c(C)c2)C(=O)O[C@H]1C ZINC001223422694 973059202 /nfs/dbraw/zinc/05/92/02/973059202.db2.gz YZEGHUOXEKUGLY-NSHDSACASA-N 1 2 247.294 2.434 20 0 BEADLO COc1cc(C)[nH+]c(CS[C@H]2CCOC2)c1 ZINC001328746541 973328360 /nfs/dbraw/zinc/32/83/60/973328360.db2.gz PMOHVNWKMQDWKM-LBPRGKRZSA-N 1 2 239.340 2.421 20 0 BEADLO Fc1c[nH+]ccc1N[C@H]1COCc2ccccc21 ZINC001171293341 973396771 /nfs/dbraw/zinc/39/67/71/973396771.db2.gz FHNRGHIFCDNZQP-AWEZNQCLSA-N 1 2 244.269 2.326 20 0 BEADLO C[NH+]1CC(OCc2ccc3scnc3c2)C1 ZINC001224133720 973459990 /nfs/dbraw/zinc/45/99/90/973459990.db2.gz CRBMBABZLDXQJF-UHFFFAOYSA-N 1 2 234.324 2.127 20 0 BEADLO C[C@@H](C(=O)NC[C@H]1CCCC12CC2)n1cc[nH+]c1 ZINC001329280706 973635982 /nfs/dbraw/zinc/63/59/82/973635982.db2.gz JIIFIGMWYCHGGK-NWDGAFQWSA-N 1 2 247.342 2.141 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H](C)OC3(CCCC3)C2)[nH]n1 ZINC001329513559 973806613 /nfs/dbraw/zinc/80/66/13/973806613.db2.gz FJTHZYPWTVYGFV-LBPRGKRZSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H](C)OC3(CCCC3)C2)[nH]n1 ZINC001329513559 973806616 /nfs/dbraw/zinc/80/66/16/973806616.db2.gz FJTHZYPWTVYGFV-LBPRGKRZSA-N 1 2 249.358 2.252 20 0 BEADLO C[C@H]1C[C@@H](c2ccccc2)[N@H+](Cc2nnc[nH]2)C1 ZINC001329895277 974010480 /nfs/dbraw/zinc/01/04/80/974010480.db2.gz ORFNCQZWFDFLSI-AAEUAGOBSA-N 1 2 242.326 2.388 20 0 BEADLO C[C@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2nnc[nH]2)C1 ZINC001329895277 974010496 /nfs/dbraw/zinc/01/04/96/974010496.db2.gz ORFNCQZWFDFLSI-AAEUAGOBSA-N 1 2 242.326 2.388 20 0 BEADLO Cc1ccc(O)cc1NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001171477745 974087143 /nfs/dbraw/zinc/08/71/43/974087143.db2.gz ABTYOJSTVWDWJY-SNVBAGLBSA-N 1 2 245.282 2.097 20 0 BEADLO CCOC(=[NH2+])CCCCO[C@H]1CCOC[C@@H]1F ZINC001224964721 974106129 /nfs/dbraw/zinc/10/61/29/974106129.db2.gz CBQOVJSKQUOLFV-QWRGUYRKSA-N 1 2 247.310 2.314 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1c1nnc(C[NH+](C)C)o1 ZINC001330100957 974106558 /nfs/dbraw/zinc/10/65/58/974106558.db2.gz QETGGKOVDQVKOX-BXKDBHETSA-N 1 2 223.320 2.281 20 0 BEADLO Fc1cccc2c1C[C@H]([NH+]1CC3(C1)CCCO3)C2 ZINC001171797207 974195265 /nfs/dbraw/zinc/19/52/65/974195265.db2.gz UOMHVDLRGJMDBZ-GFCCVEGCSA-N 1 2 247.313 2.158 20 0 BEADLO CCC[C@@H](Oc1cc[nH+]cc1)C(=O)OCC ZINC001225290573 974361749 /nfs/dbraw/zinc/36/17/49/974361749.db2.gz BEGGRSRPANEHQQ-LLVKDONJSA-N 1 2 223.272 2.192 20 0 BEADLO CO[C@H]1CCCC[C@@H]1Oc1cc[nH+]cc1 ZINC001225295962 974368280 /nfs/dbraw/zinc/36/82/80/974368280.db2.gz PEZMDETVNBRGPY-RYUDHWBXSA-N 1 2 207.273 2.418 20 0 BEADLO C[C@@H](Oc1cc[nH+]cc1)c1cnccn1 ZINC001225294181 974369031 /nfs/dbraw/zinc/36/90/31/974369031.db2.gz GUJVMTIKCQGVNM-SECBINFHSA-N 1 2 201.229 2.012 20 0 BEADLO CC(C)c1ocnc1C[NH2+][C@H](C)c1ccnn1C ZINC001330693654 974424227 /nfs/dbraw/zinc/42/42/27/974424227.db2.gz APMBCMUNWIWOKZ-SNVBAGLBSA-N 1 2 248.330 2.382 20 0 BEADLO O=C1CC[NH+]([C@@H]2CSc3ccccc3C2)CC1 ZINC001172194936 974480756 /nfs/dbraw/zinc/48/07/56/974480756.db2.gz XSKJZSBYDQDVKC-LBPRGKRZSA-N 1 2 247.363 2.368 20 0 BEADLO C[C@H](C(=O)N[C@@H](C)C1CCCC1)n1cc[nH+]c1 ZINC001330820496 974491560 /nfs/dbraw/zinc/49/15/60/974491560.db2.gz ZOWQKPRQMJHPBK-WDEREUQCSA-N 1 2 235.331 2.139 20 0 BEADLO c1cc(C[NH2+]Cc2ccon2)n(C2CC2)c1 ZINC001330840292 974498002 /nfs/dbraw/zinc/49/80/02/974498002.db2.gz HJBHSPFDOXEMEG-UHFFFAOYSA-N 1 2 217.272 2.101 20 0 BEADLO C[C@@]1(C2CCCCC2)CC[N@@H+]1Cc1nnc[nH]1 ZINC001331160974 974628000 /nfs/dbraw/zinc/62/80/00/974628000.db2.gz BKDQENAPWTWYCV-ZDUSSCGKSA-N 1 2 234.347 2.349 20 0 BEADLO C[C@@]1(C2CCCCC2)CC[N@H+]1Cc1nnc[nH]1 ZINC001331160974 974628002 /nfs/dbraw/zinc/62/80/02/974628002.db2.gz BKDQENAPWTWYCV-ZDUSSCGKSA-N 1 2 234.347 2.349 20 0 BEADLO Cc1cc(CNc2c[nH+]c(C)c(C)c2)[nH]n1 ZINC001331289609 974674039 /nfs/dbraw/zinc/67/40/39/974674039.db2.gz SEOPUFZMFTUNTK-UHFFFAOYSA-N 1 2 216.288 2.342 20 0 BEADLO Cc1c(Cl)cccc1OC1C[NH+](C)C1 ZINC001225921844 974730245 /nfs/dbraw/zinc/73/02/45/974730245.db2.gz YHMDERFYSXRYJE-UHFFFAOYSA-N 1 2 211.692 2.341 20 0 BEADLO Cc1c(Cl)cnn1C[N@@H+]1CCC[C@H](CF)C1 ZINC001331478438 974736712 /nfs/dbraw/zinc/73/67/12/974736712.db2.gz QXWFIJPPLNHLDV-SNVBAGLBSA-N 1 2 245.729 2.484 20 0 BEADLO Cc1c(Cl)cnn1C[N@H+]1CCC[C@H](CF)C1 ZINC001331478438 974736714 /nfs/dbraw/zinc/73/67/14/974736714.db2.gz QXWFIJPPLNHLDV-SNVBAGLBSA-N 1 2 245.729 2.484 20 0 BEADLO CC[C@@H](CC(C)C)[N@@H+]1CCC(=O)[C@@H](F)C1 ZINC001172399339 974757409 /nfs/dbraw/zinc/75/74/09/974757409.db2.gz CAOBXWFBFJDZLQ-QWRGUYRKSA-N 1 2 215.312 2.424 20 0 BEADLO CC[C@@H](CC(C)C)[N@H+]1CCC(=O)[C@@H](F)C1 ZINC001172399339 974757416 /nfs/dbraw/zinc/75/74/16/974757416.db2.gz CAOBXWFBFJDZLQ-QWRGUYRKSA-N 1 2 215.312 2.424 20 0 BEADLO C[NH+](C)C1(c2nc(CCC(F)(F)F)no2)CC1 ZINC001331581155 974768205 /nfs/dbraw/zinc/76/82/05/974768205.db2.gz RTEIPSBQSMGTFM-UHFFFAOYSA-N 1 2 249.236 2.115 20 0 BEADLO COC1C[NH+]([C@H]2Cc3ccc(Cl)cc3C2)C1 ZINC001172719703 974906935 /nfs/dbraw/zinc/90/69/35/974906935.db2.gz SKBFNPDPNLNQEK-LBPRGKRZSA-N 1 2 237.730 2.138 20 0 BEADLO c1nc(C[NH2+]Cc2ccc3c(c2)CCC3)c[nH]1 ZINC001331990114 974912021 /nfs/dbraw/zinc/91/20/21/974912021.db2.gz OEWJSCZHAHWBLB-UHFFFAOYSA-N 1 2 227.311 2.188 20 0 BEADLO C[C@H](C(=O)NCCC[C@H]1C=CCC1)n1cc[nH+]c1 ZINC001332398497 975093146 /nfs/dbraw/zinc/09/31/46/975093146.db2.gz WYAGHXDAGIDYLM-OLZOCXBDSA-N 1 2 247.342 2.307 20 0 BEADLO CCOC(=O)C1([NH2+][C@H]2CC[C@@H](CC)C2)CC1 ZINC001173267369 975132501 /nfs/dbraw/zinc/13/25/01/975132501.db2.gz RHRJAGSBCJSORT-MNOVXSKESA-N 1 2 225.332 2.250 20 0 BEADLO CCOC(=O)C1([NH2+][C@@H]2CC[C@@H](CC)C2)CC1 ZINC001173267366 975133129 /nfs/dbraw/zinc/13/31/29/975133129.db2.gz RHRJAGSBCJSORT-GHMZBOCLSA-N 1 2 225.332 2.250 20 0 BEADLO CC[C@H]1CC[C@H]([NH+]2CC(O)(C(F)(F)F)C2)C1 ZINC001173271929 975146486 /nfs/dbraw/zinc/14/64/86/975146486.db2.gz GQANHZKVKODYNG-IUCAKERBSA-N 1 2 237.265 2.174 20 0 BEADLO CCSC[C@@H](C)[NH2+]C1(C(=O)OC)CCCC1 ZINC001173289358 975253368 /nfs/dbraw/zinc/25/33/68/975253368.db2.gz UTWBVWDTIVOIHW-SNVBAGLBSA-N 1 2 245.388 2.203 20 0 BEADLO CCCc1c(O)cccc1OC1C[NH+](C)C1 ZINC001227144309 975293592 /nfs/dbraw/zinc/29/35/92/975293592.db2.gz MVMDUOKJTPWMTA-UHFFFAOYSA-N 1 2 221.300 2.038 20 0 BEADLO CCOc1cc(C)ccc1OC1C[NH+](CC)C1 ZINC001227202415 975311805 /nfs/dbraw/zinc/31/18/05/975311805.db2.gz KKHQADDDAMCELD-UHFFFAOYSA-N 1 2 235.327 2.477 20 0 BEADLO COC(=O)[C@@H]1CC[C@H](Oc2c(C)cc[nH+]c2C)C1 ZINC001227263014 975337371 /nfs/dbraw/zinc/33/73/71/975337371.db2.gz BGWOZVJIACDLSA-NEPJUHHUSA-N 1 2 249.310 2.419 20 0 BEADLO CCOC(=O)C1CC(Oc2c(C)cc[nH+]c2C)C1 ZINC001227264491 975338725 /nfs/dbraw/zinc/33/87/25/975338725.db2.gz MRVOHWRWPSJNPE-UHFFFAOYSA-N 1 2 249.310 2.419 20 0 BEADLO CC[C@H](C)[C@@H](C[NH2+][C@H](C)c1noc(C)n1)OC ZINC001332998471 975363163 /nfs/dbraw/zinc/36/31/63/975363163.db2.gz FVAPXRISYBPNIN-IQJOONFLSA-N 1 2 241.335 2.090 20 0 BEADLO COc1cc(Cl)cc(OC2C[NH+](C)C2)c1 ZINC001227900651 975780009 /nfs/dbraw/zinc/78/00/09/975780009.db2.gz TVCGJATXMMFMKC-UHFFFAOYSA-N 1 2 227.691 2.041 20 0 BEADLO ClC(Cl)=CC[N@@H+]1CC[C@@]12CCOC2 ZINC001333604443 975886513 /nfs/dbraw/zinc/88/65/13/975886513.db2.gz HDUAHRNKCKKZEF-VIFPVBQESA-N 1 2 222.115 2.170 20 0 BEADLO ClC(Cl)=CC[N@H+]1CC[C@@]12CCOC2 ZINC001333604443 975886515 /nfs/dbraw/zinc/88/65/15/975886515.db2.gz HDUAHRNKCKKZEF-VIFPVBQESA-N 1 2 222.115 2.170 20 0 BEADLO c1cnc2snc([NH+]=c3cc[nH]cc3)c2c1 ZINC001173881409 975927281 /nfs/dbraw/zinc/92/72/81/975927281.db2.gz RCVFNPMQAGTCMV-UHFFFAOYSA-N 1 2 228.280 2.252 20 0 BEADLO C[NH+]1CC(Oc2cc(O)cc3ccccc32)C1 ZINC001228258811 976025549 /nfs/dbraw/zinc/02/55/49/976025549.db2.gz QSSJHBKKWQNABC-UHFFFAOYSA-N 1 2 229.279 2.238 20 0 BEADLO CCc1cc(N[C@@H](C)C2(CO)CC2)nc(CC)[nH+]1 ZINC001333764830 976070049 /nfs/dbraw/zinc/07/00/49/976070049.db2.gz OILFYJKVNXBIDP-JTQLQIEISA-N 1 2 249.358 2.174 20 0 BEADLO C[NH+]1CC(Oc2cccc(N3CCCCC3)c2)C1 ZINC001228430401 976205228 /nfs/dbraw/zinc/20/52/28/976205228.db2.gz GXEBNDTURRCIHH-UHFFFAOYSA-N 1 2 246.354 2.370 20 0 BEADLO Cc1ccc[nH+]c1Nc1cccc(C(N)=O)c1 ZINC001174056964 976206432 /nfs/dbraw/zinc/20/64/32/976206432.db2.gz XCPKGMVNEVFRPH-UHFFFAOYSA-N 1 2 227.267 2.233 20 0 BEADLO Cc1nnc(Nc2cc[nH+]c3ccccc23)o1 ZINC001174036785 976241560 /nfs/dbraw/zinc/24/15/60/976241560.db2.gz FNJKFVQYMQMTNX-UHFFFAOYSA-N 1 2 226.239 2.092 20 0 BEADLO Cc1nc(F)ccc1OC1C[NH+](C(C)C)C1 ZINC001228553104 976314908 /nfs/dbraw/zinc/31/49/08/976314908.db2.gz ZLQXBWPYWWJAHG-UHFFFAOYSA-N 1 2 224.279 2.001 20 0 BEADLO COCn1ncc(C)c1C[N@H+](C)Cc1ccco1 ZINC001334122775 976322487 /nfs/dbraw/zinc/32/24/87/976322487.db2.gz GXNBUFIVDVFKSX-UHFFFAOYSA-N 1 2 249.314 2.020 20 0 BEADLO COCn1ncc(C)c1C[N@@H+](C)Cc1ccco1 ZINC001334122775 976322496 /nfs/dbraw/zinc/32/24/96/976322496.db2.gz GXNBUFIVDVFKSX-UHFFFAOYSA-N 1 2 249.314 2.020 20 0 BEADLO Cc1n[nH]c(C)c1Nc1ccn2cc[nH+]c2c1 ZINC001174213793 976391921 /nfs/dbraw/zinc/39/19/21/976391921.db2.gz NUEXSHDYAZTLHH-UHFFFAOYSA-N 1 2 227.271 2.418 20 0 BEADLO CCCn1cc(Nc2ccc(N(C)C)[nH+]c2)cn1 ZINC001174216843 976403627 /nfs/dbraw/zinc/40/36/27/976403627.db2.gz BEWLUDNYLXNZRW-UHFFFAOYSA-N 1 2 245.330 2.498 20 0 BEADLO CCCn1cc(Nc2cc(OC)cc[nH+]2)cn1 ZINC001174217154 976406621 /nfs/dbraw/zinc/40/66/21/976406621.db2.gz GHCFZRLBCOEADA-UHFFFAOYSA-N 1 2 232.287 2.440 20 0 BEADLO COc1cc[nH+]cc1Nc1c(C)nn(C)c1C ZINC001174226003 976419583 /nfs/dbraw/zinc/41/95/83/976419583.db2.gz PTSIXEZVUODEFH-UHFFFAOYSA-N 1 2 232.287 2.184 20 0 BEADLO CC[NH+]1CC(Oc2ccc(Cl)nc2C)C1 ZINC001228702045 976447294 /nfs/dbraw/zinc/44/72/94/976447294.db2.gz KCYHJORCHRDJRR-UHFFFAOYSA-N 1 2 226.707 2.126 20 0 BEADLO CCc1ccc(C)[nH+]c1Nc1cn[nH]c1 ZINC001174292315 976465311 /nfs/dbraw/zinc/46/53/11/976465311.db2.gz NOPSITCYSKXDMK-UHFFFAOYSA-N 1 2 202.261 2.419 20 0 BEADLO c1cn(Cc2ccc(Nc3cn[nH]c3)cc2)c[nH+]1 ZINC001174293309 976469596 /nfs/dbraw/zinc/46/95/96/976469596.db2.gz KGCSPUXWGYKDPE-UHFFFAOYSA-N 1 2 239.282 2.398 20 0 BEADLO CC[NH+]1CC(Oc2cnc3c(c2)CCCC3)C1 ZINC001228778504 976491526 /nfs/dbraw/zinc/49/15/26/976491526.db2.gz LEABDECZAABFRI-UHFFFAOYSA-N 1 2 232.327 2.043 20 0 BEADLO COc1cc(Nc2cn(C)nc2C)cc(C)[nH+]1 ZINC001174334151 976553496 /nfs/dbraw/zinc/55/34/96/976553496.db2.gz QYSNWLIZFQLPTI-UHFFFAOYSA-N 1 2 232.287 2.184 20 0 BEADLO CCN(C)c1ccc(Nc2cncnc2)c[nH+]1 ZINC001174385530 976625476 /nfs/dbraw/zinc/62/54/76/976625476.db2.gz NEQQSYVRKHXIMM-UHFFFAOYSA-N 1 2 229.287 2.071 20 0 BEADLO Cc1c(Nc2[nH+]c3ccccc3n2C)cnn1C ZINC001174389429 976646615 /nfs/dbraw/zinc/64/66/15/976646615.db2.gz DJJKAIYNYSSWIO-UHFFFAOYSA-N 1 2 241.298 2.359 20 0 BEADLO Cc1c(Nc2ccc(C)[nH+]c2C)cnn1C ZINC001174389692 976647445 /nfs/dbraw/zinc/64/74/45/976647445.db2.gz NEGIXQWCYWYCEO-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO CC[NH+]1CC(Oc2ccc3oc(C)nc3c2)C1 ZINC001229073994 976699308 /nfs/dbraw/zinc/69/93/08/976699308.db2.gz FVLDSIAVRZGVEA-UHFFFAOYSA-N 1 2 232.283 2.219 20 0 BEADLO COc1cc(Nc2[nH+]cccc2N)ccc1O ZINC001174540528 976833297 /nfs/dbraw/zinc/83/32/97/976833297.db2.gz PMZLDUAYAKIUQJ-UHFFFAOYSA-N 1 2 231.255 2.122 20 0 BEADLO CNC(=O)c1ccc(Nc2cccc(C)[nH+]2)cc1 ZINC001174510010 976834917 /nfs/dbraw/zinc/83/49/17/976834917.db2.gz QWQPIWGCIXTLEF-UHFFFAOYSA-N 1 2 241.294 2.493 20 0 BEADLO Cc1cc(NC(=S)c2ccccc2N)cc[nH+]1 ZINC001174656392 976948231 /nfs/dbraw/zinc/94/82/31/976948231.db2.gz KKORPZURRYQEGE-UHFFFAOYSA-N 1 2 243.335 2.182 20 0 BEADLO CN(c1ccc(O)c(F)c1)c1[nH+]cccc1N ZINC001174733168 976977189 /nfs/dbraw/zinc/97/71/89/976977189.db2.gz PFNPMYOVWZHPST-UHFFFAOYSA-N 1 2 233.246 2.276 20 0 BEADLO CC1(C)CN(c2nccn3c[nH+]cc23)C1(C)C ZINC001335442630 977061153 /nfs/dbraw/zinc/06/11/53/977061153.db2.gz BSGQWHCLYRYAAO-UHFFFAOYSA-N 1 2 230.315 2.354 20 0 BEADLO Cc1cc(Nc2ccc3c(c2)[nH+]cn3C)n(C)n1 ZINC001174823892 977081015 /nfs/dbraw/zinc/08/10/15/977081015.db2.gz LEJYOUUSOLDBMJ-UHFFFAOYSA-N 1 2 241.298 2.359 20 0 BEADLO CC[NH+]1CC(Oc2ccc3scnc3c2)C1 ZINC001230231669 977136222 /nfs/dbraw/zinc/13/62/22/977136222.db2.gz OTEQWYWAHOVIPY-UHFFFAOYSA-N 1 2 234.324 2.379 20 0 BEADLO C[NH+]1CC(Oc2ccc(C3CC3)cc2)C1 ZINC001230256570 977149146 /nfs/dbraw/zinc/14/91/46/977149146.db2.gz ZCEBUNSXUMXBGI-UHFFFAOYSA-N 1 2 203.285 2.257 20 0 BEADLO C[NH+]1CC(Oc2ccccc2-c2ccccn2)C1 ZINC001230314500 977173595 /nfs/dbraw/zinc/17/35/95/977173595.db2.gz FPRQPXFYIHJTAD-UHFFFAOYSA-N 1 2 240.306 2.441 20 0 BEADLO CC1(C)C[N@H+](CC2=NOCC2)[C@H]1c1ccncc1 ZINC001174984047 977221124 /nfs/dbraw/zinc/22/11/24/977221124.db2.gz LUUQPYBZIBXKKD-ZDUSSCGKSA-N 1 2 245.326 2.241 20 0 BEADLO CC1(C)C[N@@H+](CC2=NOCC2)[C@H]1c1ccncc1 ZINC001174984047 977221143 /nfs/dbraw/zinc/22/11/43/977221143.db2.gz LUUQPYBZIBXKKD-ZDUSSCGKSA-N 1 2 245.326 2.241 20 0 BEADLO COc1cc[nH+]cc1Nc1cc(CO)ccc1F ZINC001175125830 977277446 /nfs/dbraw/zinc/27/74/46/977277446.db2.gz PQXBBFFQNAZWQQ-UHFFFAOYSA-N 1 2 248.257 2.465 20 0 BEADLO C[C@H](C(=O)NCC12CCC(CC1)C2)n1cc[nH+]c1 ZINC001335804461 977295995 /nfs/dbraw/zinc/29/59/95/977295995.db2.gz WGZDPUFMSLVNNS-LKSINWNRSA-N 1 2 247.342 2.141 20 0 BEADLO Cc1ccc(OC2C[NH+](C(C)(C)C)C2)c(F)n1 ZINC001230712569 977306738 /nfs/dbraw/zinc/30/67/38/977306738.db2.gz KIMMTDNMINMSCN-UHFFFAOYSA-N 1 2 238.306 2.391 20 0 BEADLO C[C@@H](c1ncccn1)[NH+]1CC(C)(C)OC(C)(C)C1 ZINC001335907866 977359615 /nfs/dbraw/zinc/35/96/15/977359615.db2.gz WOUFHCRMMLDKAN-NSHDSACASA-N 1 2 249.358 2.427 20 0 BEADLO CN(C)c1ccc(Nc2cnnc(Cl)c2)c[nH+]1 ZINC001175337273 977382771 /nfs/dbraw/zinc/38/27/71/977382771.db2.gz AFRHPTPCZVKPQU-UHFFFAOYSA-N 1 2 249.705 2.335 20 0 BEADLO CCOC[C@@H](C)Oc1cc2c(cc1O)C=[NH+]CC2 ZINC001230920548 977383292 /nfs/dbraw/zinc/38/32/92/977383292.db2.gz PAQTUOWNVMPKFB-SNVBAGLBSA-N 1 2 249.310 2.171 20 0 BEADLO CN(C)c1ccc(Nc2cscn2)c[nH+]1 ZINC001175340382 977386339 /nfs/dbraw/zinc/38/63/39/977386339.db2.gz FGXNMBBESLLAQX-UHFFFAOYSA-N 1 2 220.301 2.348 20 0 BEADLO CC[C@@H](F)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001335994556 977415267 /nfs/dbraw/zinc/41/52/67/977415267.db2.gz QDAAUWWWRIWCBB-LLVKDONJSA-N 1 2 224.279 2.063 20 0 BEADLO CC[NH+]1CC(Oc2ccc(-c3cnco3)cc2)C1 ZINC001231049064 977444383 /nfs/dbraw/zinc/44/43/83/977444383.db2.gz UZCIHFRCHRGZPZ-UHFFFAOYSA-N 1 2 244.294 2.425 20 0 BEADLO F[C@@H]1COC[C@H]1Oc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001231084048 977468452 /nfs/dbraw/zinc/46/84/52/977468452.db2.gz UYIGFKDOQPEAOV-VXGBXAGGSA-N 1 2 248.257 2.192 20 0 BEADLO C[NH+]1CC(Oc2ccc(O)c3c2[C@@H]2CC[C@H]3C2)C1 ZINC001231215409 977536276 /nfs/dbraw/zinc/53/62/76/977536276.db2.gz MFRGUSAZNTVXQO-VHSXEESVSA-N 1 2 245.322 2.450 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)Nc1cscc1Cl ZINC001594187425 977544916 /nfs/dbraw/zinc/54/49/16/977544916.db2.gz UZVQHPSYJSXHHS-UHFFFAOYSA-N 1 2 241.703 2.306 20 0 BEADLO CCOC(=O)c1c[nH+]c(N)n1/C=C/C(C)(C)C ZINC001175568935 977553765 /nfs/dbraw/zinc/55/37/65/977553765.db2.gz AMYKRQCSVCBZTA-VOTSOKGWSA-N 1 2 237.303 2.159 20 0 BEADLO CCOc1cccnc1NC1=CCC[N@H+](C)C1 ZINC001175574097 977567996 /nfs/dbraw/zinc/56/79/96/977567996.db2.gz MCKVLHFMTZYPTM-UHFFFAOYSA-N 1 2 233.315 2.112 20 0 BEADLO CCOc1cccnc1NC1=CCC[N@@H+](C)C1 ZINC001175574097 977567999 /nfs/dbraw/zinc/56/79/99/977567999.db2.gz MCKVLHFMTZYPTM-UHFFFAOYSA-N 1 2 233.315 2.112 20 0 BEADLO CCOc1cccnc1N=C1CCC[N@H+](C)C1 ZINC001175574097 977568006 /nfs/dbraw/zinc/56/80/06/977568006.db2.gz MCKVLHFMTZYPTM-UHFFFAOYSA-N 1 2 233.315 2.112 20 0 BEADLO CCOc1cccnc1N=C1CCC[N@@H+](C)C1 ZINC001175574097 977568010 /nfs/dbraw/zinc/56/80/10/977568010.db2.gz MCKVLHFMTZYPTM-UHFFFAOYSA-N 1 2 233.315 2.112 20 0 BEADLO C[C@H](CC(=O)N[C@@H](C)C1(C)CC1)n1cc[nH+]c1 ZINC001336207552 977569875 /nfs/dbraw/zinc/56/98/75/977569875.db2.gz SLWDYRBFOWAGIW-MNOVXSKESA-N 1 2 235.331 2.139 20 0 BEADLO Cn1cc2ccc(Nc3[nH+]cccc3N)cc2n1 ZINC001175610158 977617623 /nfs/dbraw/zinc/61/76/23/977617623.db2.gz AYBYFSSAOGYSAJ-UHFFFAOYSA-N 1 2 239.282 2.294 20 0 BEADLO CCc1ccc(C[N@@H+]2CCC23COC3)s1 ZINC001231501344 977620864 /nfs/dbraw/zinc/62/08/64/977620864.db2.gz HBJFEVJLYCQNKD-UHFFFAOYSA-N 1 2 223.341 2.285 20 0 BEADLO CCc1ccc(C[N@H+]2CCC23COC3)s1 ZINC001231501344 977620869 /nfs/dbraw/zinc/62/08/69/977620869.db2.gz HBJFEVJLYCQNKD-UHFFFAOYSA-N 1 2 223.341 2.285 20 0 BEADLO Cn1cc2cc(Nc3[nH+]cccc3N)ccc2n1 ZINC001175618470 977625139 /nfs/dbraw/zinc/62/51/39/977625139.db2.gz YBXXUZGEDZBJFI-UHFFFAOYSA-N 1 2 239.282 2.294 20 0 BEADLO Cc1cc(C)c(C(=O)NC(C)(C)CF)c(C)[nH+]1 ZINC001336318428 977629828 /nfs/dbraw/zinc/62/98/28/977629828.db2.gz HKKMDOSMRPHJJD-UHFFFAOYSA-N 1 2 238.306 2.485 20 0 BEADLO CCc1ccc(C[N@H+](C)Cc2cncnc2)nc1 ZINC001231647406 977659030 /nfs/dbraw/zinc/65/90/30/977659030.db2.gz WCFXPIFUEMLYMZ-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO CCc1ccc(C[N@@H+](C)Cc2cncnc2)nc1 ZINC001231647406 977659038 /nfs/dbraw/zinc/65/90/38/977659038.db2.gz WCFXPIFUEMLYMZ-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO CCc1ccc(C[N@@H+]2CCOC3(CC3)C2)nc1 ZINC001231642484 977661486 /nfs/dbraw/zinc/66/14/86/977661486.db2.gz BXXXHPHZWQMEGF-UHFFFAOYSA-N 1 2 232.327 2.009 20 0 BEADLO CCc1ccc(C[N@H+]2CCOC3(CC3)C2)nc1 ZINC001231642484 977661491 /nfs/dbraw/zinc/66/14/91/977661491.db2.gz BXXXHPHZWQMEGF-UHFFFAOYSA-N 1 2 232.327 2.009 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1ccc(Cl)c(O)c1 ZINC001231735454 977716007 /nfs/dbraw/zinc/71/60/07/977716007.db2.gz QWCCEIPSCHDFBY-SNVBAGLBSA-N 1 2 241.718 2.266 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1ccc(Cl)c(O)c1 ZINC001231735454 977716017 /nfs/dbraw/zinc/71/60/17/977716017.db2.gz QWCCEIPSCHDFBY-SNVBAGLBSA-N 1 2 241.718 2.266 20 0 BEADLO C[N@H+](CCF)Cc1ccc(Cl)c(O)c1 ZINC001231735272 977721061 /nfs/dbraw/zinc/72/10/61/977721061.db2.gz MUHJNIUHGLIIOS-UHFFFAOYSA-N 1 2 217.671 2.447 20 0 BEADLO C[N@@H+](CCF)Cc1ccc(Cl)c(O)c1 ZINC001231735272 977721070 /nfs/dbraw/zinc/72/10/70/977721070.db2.gz MUHJNIUHGLIIOS-UHFFFAOYSA-N 1 2 217.671 2.447 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@@](C)(CO)C2)[nH+]1 ZINC001336555197 977774785 /nfs/dbraw/zinc/77/47/85/977774785.db2.gz GMJMYWZRNQVCJV-CYBMUJFWSA-N 1 2 238.306 2.128 20 0 BEADLO C[N@H+](CCF)Cc1ccnc(C(F)F)c1 ZINC001231896233 977794353 /nfs/dbraw/zinc/79/43/53/977794353.db2.gz SSHHEXGKCRTERD-UHFFFAOYSA-N 1 2 218.222 2.421 20 0 BEADLO C[N@@H+](CCF)Cc1ccnc(C(F)F)c1 ZINC001231896233 977794361 /nfs/dbraw/zinc/79/43/61/977794361.db2.gz SSHHEXGKCRTERD-UHFFFAOYSA-N 1 2 218.222 2.421 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@H]2CF)cnc1F ZINC001231927928 977800023 /nfs/dbraw/zinc/80/00/23/977800023.db2.gz BMYSDRFITJPJSX-LLVKDONJSA-N 1 2 226.270 2.463 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@H]2CF)cnc1F ZINC001231927928 977800025 /nfs/dbraw/zinc/80/00/25/977800025.db2.gz BMYSDRFITJPJSX-LLVKDONJSA-N 1 2 226.270 2.463 20 0 BEADLO COc1cc[nH+]c(CN2Cc3ccncc3C2)c1 ZINC001231968823 977815296 /nfs/dbraw/zinc/81/52/96/977815296.db2.gz DNDLLYUUNGUJKF-UHFFFAOYSA-N 1 2 241.294 2.001 20 0 BEADLO COc1cc[nH+]c(CN2Cc3ncsc3C2)c1 ZINC001231969641 977818452 /nfs/dbraw/zinc/81/84/52/977818452.db2.gz OCAYOXIUJKPTIS-UHFFFAOYSA-N 1 2 247.323 2.063 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(=O)[C@@H](C)C2)cc(C)n1 ZINC001231994394 977825462 /nfs/dbraw/zinc/82/54/62/977825462.db2.gz AHDUMEPNGFODTE-JTQLQIEISA-N 1 2 232.327 2.109 20 0 BEADLO Cc1cc(C[N@H+]2CCC(=O)[C@@H](C)C2)cc(C)n1 ZINC001231994394 977825468 /nfs/dbraw/zinc/82/54/68/977825468.db2.gz AHDUMEPNGFODTE-JTQLQIEISA-N 1 2 232.327 2.109 20 0 BEADLO Cc1cc(C[NH+]2CC(OC(C)C)C2)cc(C)n1 ZINC001232002729 977836283 /nfs/dbraw/zinc/83/62/83/977836283.db2.gz HSNBDDKLJQZIRK-UHFFFAOYSA-N 1 2 234.343 2.308 20 0 BEADLO Cc1cccc2c1C[N@H+](Cc1ccc(=O)[nH]n1)C2 ZINC001232020105 977845608 /nfs/dbraw/zinc/84/56/08/977845608.db2.gz ACNBVGSIYSDPDT-UHFFFAOYSA-N 1 2 241.294 2.006 20 0 BEADLO Cc1cccc2c1C[N@@H+](Cc1ccc(=O)[nH]n1)C2 ZINC001232020105 977845611 /nfs/dbraw/zinc/84/56/11/977845611.db2.gz ACNBVGSIYSDPDT-UHFFFAOYSA-N 1 2 241.294 2.006 20 0 BEADLO Cc1[nH]c([C@@H]2CCCN2CCF)[nH+]c1C ZINC001176076653 977870688 /nfs/dbraw/zinc/87/06/88/977870688.db2.gz GZQMPBJCXHPDLB-JTQLQIEISA-N 1 2 211.284 2.133 20 0 BEADLO F[C@H]1CCC[N@H+](Cc2cc3ncccc3[nH]2)C1 ZINC001232065346 977877138 /nfs/dbraw/zinc/87/71/38/977877138.db2.gz SZPQDXVUCAELDN-JTQLQIEISA-N 1 2 233.290 2.497 20 0 BEADLO F[C@H]1CCC[N@@H+](Cc2cc3ncccc3[nH]2)C1 ZINC001232065346 977877142 /nfs/dbraw/zinc/87/71/42/977877142.db2.gz SZPQDXVUCAELDN-JTQLQIEISA-N 1 2 233.290 2.497 20 0 BEADLO Cc1ccc(C[N@@H+]2C[C@H]3CC[C@@H]2CO3)c(C)n1 ZINC001232083320 977886805 /nfs/dbraw/zinc/88/68/05/977886805.db2.gz YOXZIQBUDGJDIQ-ZIAGYGMSSA-N 1 2 232.327 2.062 20 0 BEADLO Cc1ccc(C[N@H+]2C[C@H]3CC[C@@H]2CO3)c(C)n1 ZINC001232083320 977886808 /nfs/dbraw/zinc/88/68/08/977886808.db2.gz YOXZIQBUDGJDIQ-ZIAGYGMSSA-N 1 2 232.327 2.062 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2cc3ccncc3[nH]2)C1 ZINC001232091567 977888311 /nfs/dbraw/zinc/88/83/11/977888311.db2.gz WYFFFPPOQUOVHN-SNVBAGLBSA-N 1 2 219.263 2.107 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2cc3ccncc3[nH]2)C1 ZINC001232091567 977888314 /nfs/dbraw/zinc/88/83/14/977888314.db2.gz WYFFFPPOQUOVHN-SNVBAGLBSA-N 1 2 219.263 2.107 20 0 BEADLO Nc1ccc(F)c2ccn(-c3[nH]cc[nH+]3)c21 ZINC001176091229 977894436 /nfs/dbraw/zinc/89/44/36/977894436.db2.gz VZCFNOUKSPNLAA-UHFFFAOYSA-N 1 2 216.219 2.075 20 0 BEADLO Cc1cn2cccc(NC3=CCOCC3)c2[nH+]1 ZINC001176139828 977918430 /nfs/dbraw/zinc/91/84/30/977918430.db2.gz JODWRECOXYRCLT-UHFFFAOYSA-N 1 2 229.283 2.359 20 0 BEADLO COc1cc[nH+]cc1-n1cc(N)c2cccnc21 ZINC001176116457 977943210 /nfs/dbraw/zinc/94/32/10/977943210.db2.gz FGAWDQFORPBCCN-UHFFFAOYSA-N 1 2 240.266 2.011 20 0 BEADLO COc1cc[nH+]cc1Nc1ncc(C)cc1N ZINC001176117265 977946031 /nfs/dbraw/zinc/94/60/31/977946031.db2.gz YNCCNLKNUSMJGE-UHFFFAOYSA-N 1 2 230.271 2.119 20 0 BEADLO COc1cc[nH+]cc1Nc1ncccc1OC ZINC001176117195 977947861 /nfs/dbraw/zinc/94/78/61/977947861.db2.gz VIOIRXFJJRZTSN-UHFFFAOYSA-N 1 2 231.255 2.237 20 0 BEADLO FC1(F)CC[NH+](Cc2cnsc2)CC1 ZINC001232223252 977949386 /nfs/dbraw/zinc/94/93/86/977949386.db2.gz DLFVAGDEPYHURJ-UHFFFAOYSA-N 1 2 218.272 2.374 20 0 BEADLO COc1cc[nH+]cc1N[C@@H](C)Cc1cc(C)no1 ZINC001176118817 977951041 /nfs/dbraw/zinc/95/10/41/977951041.db2.gz JIQMIZMLBYXYTN-VIFPVBQESA-N 1 2 247.298 2.430 20 0 BEADLO COc1cc[nH+]cc1Nc1ncc(C)o1 ZINC001176119716 977954449 /nfs/dbraw/zinc/95/44/49/977954449.db2.gz WNGHDPIDSSPFBI-UHFFFAOYSA-N 1 2 205.217 2.130 20 0 BEADLO COc1cc[nH+]cc1-n1ncc2cc(N)ccc21 ZINC001176121782 977958594 /nfs/dbraw/zinc/95/85/94/977958594.db2.gz PODYFGGNJRCGSG-UHFFFAOYSA-N 1 2 240.266 2.011 20 0 BEADLO Cc1ccc(Nc2cnc(N(C)C)nc2)c(C)[nH+]1 ZINC001176326554 978022680 /nfs/dbraw/zinc/02/26/80/978022680.db2.gz BVWSKJOSWVXZGH-UHFFFAOYSA-N 1 2 243.314 2.298 20 0 BEADLO Cc1c(F)cc(C[NH+]2CC3(COC3)C2)cc1F ZINC001232420712 978060190 /nfs/dbraw/zinc/06/01/90/978060190.db2.gz RXQPMBHWRARASQ-UHFFFAOYSA-N 1 2 239.265 2.105 20 0 BEADLO Cc1cn2c(cccc2Nc2cnc(C)nc2)[nH+]1 ZINC001176393698 978061401 /nfs/dbraw/zinc/06/14/01/978061401.db2.gz PMOOYAXROSLITE-UHFFFAOYSA-N 1 2 239.282 2.485 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2[nH]nc3c2CCC3)C[C@H]1F ZINC001232425177 978068006 /nfs/dbraw/zinc/06/80/06/978068006.db2.gz UNLKBTXPVAOSMX-MWLCHTKSSA-N 1 2 237.322 2.078 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2[nH]nc3c2CCC3)C[C@H]1F ZINC001232425177 978068010 /nfs/dbraw/zinc/06/80/10/978068010.db2.gz UNLKBTXPVAOSMX-MWLCHTKSSA-N 1 2 237.322 2.078 20 0 BEADLO Cc1[nH]c(CN2CCc3cc(F)ccc3C2)c[nH+]1 ZINC001232464878 978105988 /nfs/dbraw/zinc/10/59/88/978105988.db2.gz NSPMZONFDXUURY-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1[nH]cc(CN2CCc3cc(F)ccc3C2)[nH+]1 ZINC001232464878 978105994 /nfs/dbraw/zinc/10/59/94/978105994.db2.gz NSPMZONFDXUURY-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1nc2c(s1)CN(Cc1c[nH+]c(C)[nH]1)CC2 ZINC001232464244 978107317 /nfs/dbraw/zinc/10/73/17/978107317.db2.gz WMAUMVGVTCKGNV-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO Cc1nc2c(s1)CN(Cc1c[nH]c(C)[nH+]1)CC2 ZINC001232464244 978107325 /nfs/dbraw/zinc/10/73/25/978107325.db2.gz WMAUMVGVTCKGNV-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO CCc1csc(C[NH+]2CCSCC2)n1 ZINC001232472948 978118474 /nfs/dbraw/zinc/11/84/74/978118474.db2.gz SOWNRKOJSUAZMY-UHFFFAOYSA-N 1 2 228.386 2.254 20 0 BEADLO CC(C)CCN(C(=O)[C@H](C)n1cc[nH+]c1)C1CC1 ZINC000066942591 978143534 /nfs/dbraw/zinc/14/35/34/978143534.db2.gz UUNGVLGAINFTMM-LBPRGKRZSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cccc(CF)n2)C[C@@H]1F ZINC001232535915 978161551 /nfs/dbraw/zinc/16/15/51/978161551.db2.gz PKRXRZBHPCPFTO-SKDRFNHKSA-N 1 2 226.270 2.341 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cccc(CF)n2)C[C@@H]1F ZINC001232535915 978161557 /nfs/dbraw/zinc/16/15/57/978161557.db2.gz PKRXRZBHPCPFTO-SKDRFNHKSA-N 1 2 226.270 2.341 20 0 BEADLO FCc1cccc(C[N@@H+]2CCC[C@@H](F)C2)n1 ZINC001232535252 978162086 /nfs/dbraw/zinc/16/20/86/978162086.db2.gz NYVBTCDJNHQTOY-SNVBAGLBSA-N 1 2 226.270 2.485 20 0 BEADLO FCc1cccc(C[N@H+]2CCC[C@@H](F)C2)n1 ZINC001232535252 978162091 /nfs/dbraw/zinc/16/20/91/978162091.db2.gz NYVBTCDJNHQTOY-SNVBAGLBSA-N 1 2 226.270 2.485 20 0 BEADLO FCc1cccc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)n1 ZINC001232533809 978164135 /nfs/dbraw/zinc/16/41/35/978164135.db2.gz SLEACJMMFKXUAK-TVYUQYBPSA-N 1 2 238.281 2.341 20 0 BEADLO FCc1cccc(C[N@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)n1 ZINC001232533809 978164139 /nfs/dbraw/zinc/16/41/39/978164139.db2.gz SLEACJMMFKXUAK-TVYUQYBPSA-N 1 2 238.281 2.341 20 0 BEADLO c1c[nH+]c(N2CCCC2)c(Nc2ccncn2)c1 ZINC001176742935 978171032 /nfs/dbraw/zinc/17/10/32/978171032.db2.gz DPPYQQJXSUJKGR-UHFFFAOYSA-N 1 2 241.298 2.215 20 0 BEADLO CC(=O)[C@@H]1CCC[N@@H+]1Cc1cc2ccoc2cn1 ZINC001232554897 978182107 /nfs/dbraw/zinc/18/21/07/978182107.db2.gz NNSAMXCSKBJQBM-ZDUSSCGKSA-N 1 2 244.294 2.381 20 0 BEADLO CC(=O)[C@@H]1CCC[N@H+]1Cc1cc2ccoc2cn1 ZINC001232554897 978182115 /nfs/dbraw/zinc/18/21/15/978182115.db2.gz NNSAMXCSKBJQBM-ZDUSSCGKSA-N 1 2 244.294 2.381 20 0 BEADLO COC(=O)C[N@H+](C)Cc1cccc2c1CCCC2 ZINC001232639339 978207208 /nfs/dbraw/zinc/20/72/08/978207208.db2.gz ZYDOBGBDTKRPGA-UHFFFAOYSA-N 1 2 247.338 2.170 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1cccc2c1CCCC2 ZINC001232639339 978207222 /nfs/dbraw/zinc/20/72/22/978207222.db2.gz ZYDOBGBDTKRPGA-UHFFFAOYSA-N 1 2 247.338 2.170 20 0 BEADLO CC[C@@H](F)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001337261619 978253812 /nfs/dbraw/zinc/25/38/12/978253812.db2.gz OAHRSHUTITYRBU-SECBINFHSA-N 1 2 221.235 2.021 20 0 BEADLO CCc1[nH]c(CNC(=O)C(C)(C)C2CC2)c[nH+]1 ZINC001597256924 978301483 /nfs/dbraw/zinc/30/14/83/978301483.db2.gz AHMJGAYHPLMEJM-UHFFFAOYSA-N 1 2 235.331 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)C(C)(C)C2CC2)[nH+]1 ZINC001597256924 978301489 /nfs/dbraw/zinc/30/14/89/978301489.db2.gz AHMJGAYHPLMEJM-UHFFFAOYSA-N 1 2 235.331 2.025 20 0 BEADLO CCc1ncc(C[NH2+]Cc2csc(C)n2)cn1 ZINC001177180922 978302383 /nfs/dbraw/zinc/30/23/83/978302383.db2.gz OWVVCVFPSHTQAM-UHFFFAOYSA-N 1 2 248.355 2.094 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H]2CCC[C@H]3C[C@H]32)c[nH+]1 ZINC001597258143 978306952 /nfs/dbraw/zinc/30/69/52/978306952.db2.gz WJPQQNOIQYNMIS-MVWJERBFSA-N 1 2 247.342 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H]2CCC[C@H]3C[C@H]32)[nH+]1 ZINC001597258143 978306960 /nfs/dbraw/zinc/30/69/60/978306960.db2.gz WJPQQNOIQYNMIS-MVWJERBFSA-N 1 2 247.342 2.025 20 0 BEADLO CCc1[nH]c(CNC(=O)/C=C\C2CCCC2)c[nH+]1 ZINC001597256998 978307711 /nfs/dbraw/zinc/30/77/11/978307711.db2.gz FCWWXJZUHJDFML-FPLPWBNLSA-N 1 2 247.342 2.335 20 0 BEADLO CCc1[nH]cc(CNC(=O)C=CC2CCCC2)[nH+]1 ZINC001597256998 978307717 /nfs/dbraw/zinc/30/77/17/978307717.db2.gz FCWWXJZUHJDFML-FPLPWBNLSA-N 1 2 247.342 2.335 20 0 BEADLO CCc1[nH]c(CNC(=O)C2=CC[C@@H](C)CC2)c[nH+]1 ZINC001597258099 978308387 /nfs/dbraw/zinc/30/83/87/978308387.db2.gz UZCQKCBSSQJMFQ-SNVBAGLBSA-N 1 2 247.342 2.335 20 0 BEADLO CCc1[nH]cc(CNC(=O)C2=CC[C@@H](C)CC2)[nH+]1 ZINC001597258099 978308392 /nfs/dbraw/zinc/30/83/92/978308392.db2.gz UZCQKCBSSQJMFQ-SNVBAGLBSA-N 1 2 247.342 2.335 20 0 BEADLO Cc1cc(O)cc(C[N@H+](C2CC2)C2COC2)c1 ZINC001232885354 978323587 /nfs/dbraw/zinc/32/35/87/978323587.db2.gz GCJANTHTGOYQND-UHFFFAOYSA-N 1 2 233.311 2.064 20 0 BEADLO Cc1cc(O)cc(C[N@@H+](C2CC2)C2COC2)c1 ZINC001232885354 978323596 /nfs/dbraw/zinc/32/35/96/978323596.db2.gz GCJANTHTGOYQND-UHFFFAOYSA-N 1 2 233.311 2.064 20 0 BEADLO Cc1cocc1C(=O)Nc1cc(N(C)C)cc[nH+]1 ZINC001597486708 978333671 /nfs/dbraw/zinc/33/36/71/978333671.db2.gz MQLDWZJYDWFUGN-UHFFFAOYSA-N 1 2 245.282 2.301 20 0 BEADLO Nc1nc(NCCC(F)F)[nH+]c2ccccc12 ZINC001337431977 978334291 /nfs/dbraw/zinc/33/42/91/978334291.db2.gz OPDMQKUXQCCMIY-UHFFFAOYSA-N 1 2 238.241 2.279 20 0 BEADLO FC(F)Oc1ccc(C[N@@H+]2CC[C@H](F)C2)cn1 ZINC001232953915 978355066 /nfs/dbraw/zinc/35/50/66/978355066.db2.gz NPCPBIQRIPSNSX-VIFPVBQESA-N 1 2 246.232 2.227 20 0 BEADLO FC(F)Oc1ccc(C[N@H+]2CC[C@H](F)C2)cn1 ZINC001232953915 978355075 /nfs/dbraw/zinc/35/50/75/978355075.db2.gz NPCPBIQRIPSNSX-VIFPVBQESA-N 1 2 246.232 2.227 20 0 BEADLO C[C@H]1CCCN(C(=O)CCNc2cccc[nH+]2)C1 ZINC001337474616 978357737 /nfs/dbraw/zinc/35/77/37/978357737.db2.gz HKTXKOCIDIWLQG-LBPRGKRZSA-N 1 2 247.342 2.142 20 0 BEADLO Oc1cc(C[NH+]2CCCC2)cc(F)c1F ZINC001232969515 978365832 /nfs/dbraw/zinc/36/58/32/978365832.db2.gz RGKQRFMLUYVYFV-UHFFFAOYSA-N 1 2 213.227 2.266 20 0 BEADLO Cc1ncc(F)cc1C[N@H+]1C[C@@H](C)[C@@H](F)C1 ZINC001232985842 978381736 /nfs/dbraw/zinc/38/17/36/978381736.db2.gz JGOWCLVBCQUJAC-PELKAZGASA-N 1 2 226.270 2.319 20 0 BEADLO Cc1ncc(F)cc1C[N@@H+]1C[C@@H](C)[C@@H](F)C1 ZINC001232985842 978381751 /nfs/dbraw/zinc/38/17/51/978381751.db2.gz JGOWCLVBCQUJAC-PELKAZGASA-N 1 2 226.270 2.319 20 0 BEADLO Cc1ncc(F)cc1C[N@H+]1C[C@@H](F)C[C@H]1C ZINC001232986994 978387891 /nfs/dbraw/zinc/38/78/91/978387891.db2.gz XWFUNUVZYNSJGF-PELKAZGASA-N 1 2 226.270 2.461 20 0 BEADLO Cc1ncc(F)cc1C[N@@H+]1C[C@@H](F)C[C@H]1C ZINC001232986994 978387896 /nfs/dbraw/zinc/38/78/96/978387896.db2.gz XWFUNUVZYNSJGF-PELKAZGASA-N 1 2 226.270 2.461 20 0 BEADLO Cc1cc[nH+]c(Nc2cnc3c(c2)NCCO3)c1 ZINC001249800887 978400235 /nfs/dbraw/zinc/40/02/35/978400235.db2.gz DDXQYJWKTMXCHJ-UHFFFAOYSA-N 1 2 242.282 2.333 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)C[C@@H]1CC[C@H]2C[C@H]21 ZINC001337638840 978437663 /nfs/dbraw/zinc/43/76/63/978437663.db2.gz HFJWFIJSAIZOAS-RWMBFGLXSA-N 1 2 244.338 2.495 20 0 BEADLO C[C@@H](C1CC1)N(C)c1cc(NC2CC2)[nH+]cn1 ZINC001337707377 978467865 /nfs/dbraw/zinc/46/78/65/978467865.db2.gz KRJWLPYHIXYBDX-VIFPVBQESA-N 1 2 232.331 2.286 20 0 BEADLO C[C@@H](C1CC1)N(C)c1cc(NC2CC2)nc[nH+]1 ZINC001337707377 978467873 /nfs/dbraw/zinc/46/78/73/978467873.db2.gz KRJWLPYHIXYBDX-VIFPVBQESA-N 1 2 232.331 2.286 20 0 BEADLO CCOC[C@H]1CCN(c2cc(F)cc(C)[nH+]2)C1 ZINC001337795571 978498947 /nfs/dbraw/zinc/49/89/47/978498947.db2.gz PZRXZSSQGVTNKT-NSHDSACASA-N 1 2 238.306 2.392 20 0 BEADLO C[NH+](C)C1(C)CN(Cc2ccc(S)cc2)C1 ZINC001233261908 978522494 /nfs/dbraw/zinc/52/24/94/978522494.db2.gz IWRGUIVAUPXZHS-UHFFFAOYSA-N 1 2 236.384 2.111 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(=O)[C@@H](C)CC2)sn1 ZINC001233309829 978535519 /nfs/dbraw/zinc/53/55/19/978535519.db2.gz DJDPTZSTYGLHRT-VIFPVBQESA-N 1 2 238.356 2.253 20 0 BEADLO CC[C@@]1(C)CCCN(c2cc(N)nc[nH+]2)C1 ZINC001337874898 978543285 /nfs/dbraw/zinc/54/32/85/978543285.db2.gz CRKMOOLWATWJGO-LBPRGKRZSA-N 1 2 220.320 2.075 20 0 BEADLO Cc1cnsc1C[N@@H+]1C[C@@H]2C[C@@H]2[C@H](F)C1 ZINC001233318754 978549852 /nfs/dbraw/zinc/54/98/52/978549852.db2.gz PDTPEAKIDPLQDA-LPEHRKFASA-N 1 2 226.320 2.241 20 0 BEADLO Cc1cnsc1C[N@H+]1C[C@@H]2C[C@@H]2[C@H](F)C1 ZINC001233318754 978549862 /nfs/dbraw/zinc/54/98/62/978549862.db2.gz PDTPEAKIDPLQDA-LPEHRKFASA-N 1 2 226.320 2.241 20 0 BEADLO Cc1cnsc1C[N@@H+]1CCCC(=O)CC1 ZINC001233318924 978553436 /nfs/dbraw/zinc/55/34/36/978553436.db2.gz VHFVOEYTZADUNO-UHFFFAOYSA-N 1 2 224.329 2.007 20 0 BEADLO Cc1cnsc1C[N@H+]1CCCC(=O)CC1 ZINC001233318924 978553447 /nfs/dbraw/zinc/55/34/47/978553447.db2.gz VHFVOEYTZADUNO-UHFFFAOYSA-N 1 2 224.329 2.007 20 0 BEADLO C[NH+]1CCN(Cc2cc3cccnc3s2)CC1 ZINC001233345035 978565848 /nfs/dbraw/zinc/56/58/48/978565848.db2.gz CMTBFLMJGHQTGT-UHFFFAOYSA-N 1 2 247.367 2.044 20 0 BEADLO C[C@H]1CC[N@H+]1Cc1c[nH]c(Br)c1 ZINC001233434713 978604084 /nfs/dbraw/zinc/60/40/84/978604084.db2.gz YUDVJPHSDUOADC-ZETCQYMHSA-N 1 2 229.121 2.371 20 0 BEADLO CC=C(C)C=CC(=O)Nc1cc[nH+]c2c1CCC2 ZINC001178508189 978578491 /nfs/dbraw/zinc/57/84/91/978578491.db2.gz XEBPYWBELLZKHF-ZMSWCZRLSA-N 1 2 242.322 2.453 20 0 BEADLO Cc1ncc(C[N@@H+]2CCC[C@@H]2c2cnccn2)o1 ZINC001233367061 978579684 /nfs/dbraw/zinc/57/96/84/978579684.db2.gz IFTAYZIFIFDQQU-CYBMUJFWSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1ncc(C[N@H+]2CCC[C@@H]2c2cnccn2)o1 ZINC001233367061 978579688 /nfs/dbraw/zinc/57/96/88/978579688.db2.gz IFTAYZIFIFDQQU-CYBMUJFWSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1ncc(C[NH+]2CC3(C2)C[C@@H](F)CS3)o1 ZINC001233367696 978581092 /nfs/dbraw/zinc/58/10/92/978581092.db2.gz ZACHBMBQAJRIBF-SECBINFHSA-N 1 2 242.319 2.012 20 0 BEADLO CCc1ccc(N(C)Cc2cccc(=O)[nH]2)[nH+]c1 ZINC001337981600 978582318 /nfs/dbraw/zinc/58/23/18/978582318.db2.gz DHZDJFUXXKSFSC-UHFFFAOYSA-N 1 2 243.310 2.381 20 0 BEADLO Nc1cccc(CN2CCC[C@H]2C(F)(F)F)[nH+]1 ZINC001233369314 978582957 /nfs/dbraw/zinc/58/29/57/978582957.db2.gz JHBYIUFWYKOFCX-VIFPVBQESA-N 1 2 245.248 2.191 20 0 BEADLO Brc1cc(C[NH+]2CC=CC2)c[nH]1 ZINC001233434335 978601653 /nfs/dbraw/zinc/60/16/53/978601653.db2.gz KNHLAIHSQIIKFP-UHFFFAOYSA-N 1 2 227.105 2.149 20 0 BEADLO C[C@H]1CC[N@@H+]1Cc1c[nH]c(Br)c1 ZINC001233434713 978604080 /nfs/dbraw/zinc/60/40/80/978604080.db2.gz YUDVJPHSDUOADC-ZETCQYMHSA-N 1 2 229.121 2.371 20 0 BEADLO CCc1[nH]c(CNC(=O)C(C)=C2CCCC2)c[nH+]1 ZINC001178669849 978604114 /nfs/dbraw/zinc/60/41/14/978604114.db2.gz OPJVBYSPQGHTIR-UHFFFAOYSA-N 1 2 247.342 2.479 20 0 BEADLO CCc1[nH]cc(CNC(=O)C(C)=C2CCCC2)[nH+]1 ZINC001178669849 978604118 /nfs/dbraw/zinc/60/41/18/978604118.db2.gz OPJVBYSPQGHTIR-UHFFFAOYSA-N 1 2 247.342 2.479 20 0 BEADLO CCc1[nH]c(CNC(=O)C[C@@H]2C[C@H]2C2CC2)c[nH+]1 ZINC001178669312 978604222 /nfs/dbraw/zinc/60/42/22/978604222.db2.gz FPFCOSSBVNQSIO-JQWIXIFHSA-N 1 2 247.342 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)C[C@@H]2C[C@H]2C2CC2)[nH+]1 ZINC001178669312 978604226 /nfs/dbraw/zinc/60/42/26/978604226.db2.gz FPFCOSSBVNQSIO-JQWIXIFHSA-N 1 2 247.342 2.025 20 0 BEADLO Cn1ncc2c1CC[N@H+](Cc1ccccc1F)C2 ZINC001203357011 978604748 /nfs/dbraw/zinc/60/47/48/978604748.db2.gz DDFHUDITNREEPU-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO Cn1ncc2c1CC[N@@H+](Cc1ccccc1F)C2 ZINC001203357011 978604753 /nfs/dbraw/zinc/60/47/53/978604753.db2.gz DDFHUDITNREEPU-UHFFFAOYSA-N 1 2 245.301 2.118 20 0 BEADLO FCC1CC[NH+](Cc2cncc(Cl)n2)CC1 ZINC001233449596 978606234 /nfs/dbraw/zinc/60/62/34/978606234.db2.gz KCRPJMASAZYGPZ-UHFFFAOYSA-N 1 2 243.713 2.312 20 0 BEADLO CCc1ccc(N2CCO[C@H](C)CC2)[nH+]c1 ZINC001338096187 978611633 /nfs/dbraw/zinc/61/16/33/978611633.db2.gz IYJWDUKEGYPBMP-LLVKDONJSA-N 1 2 220.316 2.259 20 0 BEADLO CNc1cc(N[C@H](C)c2ncccc2C)nc[nH+]1 ZINC001338155527 978622314 /nfs/dbraw/zinc/62/23/14/978622314.db2.gz OYAUPHCDVQZGDW-SNVBAGLBSA-N 1 2 243.314 2.395 20 0 BEADLO CNc1cc(N[C@H](C)c2ncccc2C)[nH+]cn1 ZINC001338155527 978622322 /nfs/dbraw/zinc/62/23/22/978622322.db2.gz OYAUPHCDVQZGDW-SNVBAGLBSA-N 1 2 243.314 2.395 20 0 BEADLO CCc1ccc(O)c(OC2C[NH+](CC)C2)c1 ZINC001233578206 978630742 /nfs/dbraw/zinc/63/07/42/978630742.db2.gz NXJDBTOJZHERAB-UHFFFAOYSA-N 1 2 221.300 2.038 20 0 BEADLO CCNc1ccc(Nc2cc(C)ncn2)c[nH+]1 ZINC001338285387 978653597 /nfs/dbraw/zinc/65/35/97/978653597.db2.gz QBSKBAAUXZOCHR-UHFFFAOYSA-N 1 2 229.287 2.355 20 0 BEADLO C[NH+]1CC(Oc2ccc3cc(F)cnc3c2)C1 ZINC001233636225 978656035 /nfs/dbraw/zinc/65/60/35/978656035.db2.gz LJUQFIKWFNHVCL-UHFFFAOYSA-N 1 2 232.258 2.067 20 0 BEADLO CC(C)(C)c1ccc(N2C[C@@H]3C[C@H]2CO3)[nH+]c1 ZINC000149861993 978667875 /nfs/dbraw/zinc/66/78/75/978667875.db2.gz GDAPFGZMGMYBCB-RYUDHWBXSA-N 1 2 232.327 2.357 20 0 BEADLO CNc1ccc(CC(=O)C(C)(C)C)c[nH+]1 ZINC001249918853 978670036 /nfs/dbraw/zinc/67/00/36/978670036.db2.gz KNBJRRBDPBAHDI-UHFFFAOYSA-N 1 2 206.289 2.281 20 0 BEADLO CCC(=O)Cc1c[nH+]cn1Cc1ccccc1 ZINC001249923465 978679159 /nfs/dbraw/zinc/67/91/59/978679159.db2.gz PZVIVEIOEVDDRF-UHFFFAOYSA-N 1 2 228.295 2.453 20 0 BEADLO CC[NH+]1CC(Oc2nccc3c(F)cccc32)C1 ZINC001233720790 978680328 /nfs/dbraw/zinc/68/03/28/978680328.db2.gz DCNXLNMKQFQDEH-UHFFFAOYSA-N 1 2 246.285 2.457 20 0 BEADLO CC(C)c1nccc(OC2C[NH+](C(C)C)C2)n1 ZINC001233797464 978698528 /nfs/dbraw/zinc/69/85/28/978698528.db2.gz BQPYMENPKGJECS-UHFFFAOYSA-N 1 2 235.331 2.071 20 0 BEADLO COc1cccc2[nH]c(NCc3ccon3)[nH+]c21 ZINC001179497418 978711053 /nfs/dbraw/zinc/71/10/53/978711053.db2.gz FCVCBXMNVQSDMM-UHFFFAOYSA-N 1 2 244.254 2.172 20 0 BEADLO Clc1cscc1C[NH2+]Cc1cnccn1 ZINC001179790039 978756408 /nfs/dbraw/zinc/75/64/08/978756408.db2.gz ZPURLSPOCDOCGO-UHFFFAOYSA-N 1 2 239.731 2.481 20 0 BEADLO CCc1cc(O)ccc1OC1C[NH+](CC)C1 ZINC001234102599 978777206 /nfs/dbraw/zinc/77/72/06/978777206.db2.gz QPRUBFTWOWLQHS-UHFFFAOYSA-N 1 2 221.300 2.038 20 0 BEADLO C[C@H](O)CCCC(=O)Oc1cc2[nH]ccc2c[nH+]1 ZINC001234525492 978855716 /nfs/dbraw/zinc/85/57/16/978855716.db2.gz JFVWRULNISQRQF-VIFPVBQESA-N 1 2 248.282 2.019 20 0 BEADLO Cc1ccc(Nc2ccnn2C)c(C)[nH+]1 ZINC001203363021 978893745 /nfs/dbraw/zinc/89/37/45/978893745.db2.gz KTVDNXNQANTNPM-UHFFFAOYSA-N 1 2 202.261 2.176 20 0 BEADLO COc1ccc(Nc2ccc(C)[nH+]c2C)nn1 ZINC001203363155 978911121 /nfs/dbraw/zinc/91/11/21/978911121.db2.gz MJYXGLDFPOODIM-UHFFFAOYSA-N 1 2 230.271 2.241 20 0 BEADLO C[C@H](C(=O)N(C)[C@@H](C)C1(C)CC1)n1cc[nH+]c1 ZINC001340074923 978965338 /nfs/dbraw/zinc/96/53/38/978965338.db2.gz PRYUWVYELXMRRC-MNOVXSKESA-N 1 2 235.331 2.091 20 0 BEADLO CCc1cc(N2CC(F)(F)C2)nc(CC)[nH+]1 ZINC001340129486 978976180 /nfs/dbraw/zinc/97/61/80/978976180.db2.gz XRRIKYMCRDTOCG-UHFFFAOYSA-N 1 2 227.258 2.057 20 0 BEADLO CC1(CO)C[NH+](Cc2cc3cccc(F)c3[nH]2)C1 ZINC001235234839 979001783 /nfs/dbraw/zinc/00/17/83/979001783.db2.gz NYCXJJMOPHJBAF-UHFFFAOYSA-N 1 2 248.301 2.121 20 0 BEADLO CCc1cccc(C[N@H+](C)Cc2ccno2)n1 ZINC001235268554 979013392 /nfs/dbraw/zinc/01/33/92/979013392.db2.gz XPAGTLUGDMBFAV-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1cccc(C[N@@H+](C)Cc2ccno2)n1 ZINC001235268554 979013399 /nfs/dbraw/zinc/01/33/99/979013399.db2.gz XPAGTLUGDMBFAV-UHFFFAOYSA-N 1 2 231.299 2.264 20 0 BEADLO CCc1cccc(C[N@@H+]2CCOC3(CC3)C2)n1 ZINC001235267212 979014231 /nfs/dbraw/zinc/01/42/31/979014231.db2.gz QSBKKYRXZVOEAU-UHFFFAOYSA-N 1 2 232.327 2.009 20 0 BEADLO CCc1cccc(C[N@H+]2CCOC3(CC3)C2)n1 ZINC001235267212 979014236 /nfs/dbraw/zinc/01/42/36/979014236.db2.gz QSBKKYRXZVOEAU-UHFFFAOYSA-N 1 2 232.327 2.009 20 0 BEADLO Cc1cnc(F)c(C[NH+]2CC3(CSC3)C2)c1 ZINC001235341911 979032045 /nfs/dbraw/zinc/03/20/45/979032045.db2.gz GDLZORDRHJOVPD-UHFFFAOYSA-N 1 2 238.331 2.078 20 0 BEADLO CC[N@H+](Cc1c(C)ncn1C)Cc1ccccn1 ZINC001235552859 979092867 /nfs/dbraw/zinc/09/28/67/979092867.db2.gz LIZGDNPGXLYBIC-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CC[N@@H+](Cc1c(C)ncn1C)Cc1ccccn1 ZINC001235552859 979092885 /nfs/dbraw/zinc/09/28/85/979092885.db2.gz LIZGDNPGXLYBIC-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO Cc1ccc(Nc2nccnc2N(C)C)c(C)[nH+]1 ZINC001203367243 979102811 /nfs/dbraw/zinc/10/28/11/979102811.db2.gz JUCBISYWYXYZBE-UHFFFAOYSA-N 1 2 243.314 2.298 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)C[C@H](C)C1CC1 ZINC001340811423 979117012 /nfs/dbraw/zinc/11/70/12/979117012.db2.gz XYSPFPCKAAUUDG-VIFPVBQESA-N 1 2 232.327 2.495 20 0 BEADLO COc1nccc(C[NH+]2CC=CC2)c1Cl ZINC001235828933 979163668 /nfs/dbraw/zinc/16/36/68/979163668.db2.gz BWRBXRWSBUSLMY-UHFFFAOYSA-N 1 2 224.691 2.115 20 0 BEADLO COCOc1ccc(-c2c[nH+]c(N)c(C)c2)cn1 ZINC001235953980 979230515 /nfs/dbraw/zinc/23/05/15/979230515.db2.gz KWWBBIBMPRSNSF-UHFFFAOYSA-N 1 2 245.282 2.017 20 0 BEADLO Cc1coc(C(=O)OCCCn2cc[nH+]c2)c1C ZINC001341105765 979232608 /nfs/dbraw/zinc/23/26/08/979232608.db2.gz HYZOKJCBJMBXKY-UHFFFAOYSA-N 1 2 248.282 2.340 20 0 BEADLO C[C@@H]1C[C@H]1C[N@@H+]1CCNC[C@H]1c1ccc(F)cc1 ZINC001236126936 979401931 /nfs/dbraw/zinc/40/19/31/979401931.db2.gz FNNQDQDNGWVUCT-ZLDLUXBVSA-N 1 2 248.345 2.428 20 0 BEADLO C[C@@H]1C[C@H]1C[N@H+]1CCNC[C@H]1c1ccc(F)cc1 ZINC001236126936 979401943 /nfs/dbraw/zinc/40/19/43/979401943.db2.gz FNNQDQDNGWVUCT-ZLDLUXBVSA-N 1 2 248.345 2.428 20 0 BEADLO CCC[C@@H]1CNCC[N@@H+]1CC1OC=CC1=S ZINC001236135923 979408968 /nfs/dbraw/zinc/40/89/68/979408968.db2.gz SAUWKADYSLEEKW-SNVBAGLBSA-N 1 2 240.372 2.142 20 0 BEADLO CCC[C@@H]1CNCC[N@H+]1CC1OC=CC1=S ZINC001236135923 979408974 /nfs/dbraw/zinc/40/89/74/979408974.db2.gz SAUWKADYSLEEKW-SNVBAGLBSA-N 1 2 240.372 2.142 20 0 BEADLO Cc1ccc(-n2c(C)cc(=O)c(N)c2C)c(C)[nH+]1 ZINC001203369781 979461978 /nfs/dbraw/zinc/46/19/78/979461978.db2.gz SHGZXRJTHOTUBO-UHFFFAOYSA-N 1 2 243.310 2.048 20 0 BEADLO COC(=O)Cc1ccccc1-c1ccc(N)[nH+]c1 ZINC001236312168 979517943 /nfs/dbraw/zinc/51/79/43/979517943.db2.gz KUNBWVLWIIAAEB-UHFFFAOYSA-N 1 2 242.278 2.046 20 0 BEADLO COC(=O)c1cc(C)cc(-c2ccc(N)[nH+]c2)c1 ZINC001236312866 979518608 /nfs/dbraw/zinc/51/86/08/979518608.db2.gz AJNXHVLKUWNXSX-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1ccc(N)nc1 ZINC001236313540 979519281 /nfs/dbraw/zinc/51/92/81/979519281.db2.gz UOYNNGSXUQPIMQ-UHFFFAOYSA-N 1 2 228.299 2.100 20 0 BEADLO Cc1c(-c2ccc(N)nc2)ccc2[nH+]ccn21 ZINC001236315942 979527002 /nfs/dbraw/zinc/52/70/02/979527002.db2.gz FCRLMJMMJZFTKW-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO C[S@](=N)(=O)c1ccc(-c2ccc(N)[nH+]c2)cc1 ZINC001236317758 979533843 /nfs/dbraw/zinc/53/38/43/979533843.db2.gz VNAPBFYEFNEQKT-KRWDZBQOSA-N 1 2 247.323 2.366 20 0 BEADLO Oc1cncc(-c2ccn3cc[nH+]c3c2)c1 ZINC001236580888 979659212 /nfs/dbraw/zinc/65/92/12/979659212.db2.gz LOWOZNYAPPKQNU-UHFFFAOYSA-N 1 2 211.224 2.102 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCc3ccncc3C2)o1 ZINC001236592299 979673449 /nfs/dbraw/zinc/67/34/49/979673449.db2.gz VZQXFKQVDIYUTH-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCc3ccncc3C2)o1 ZINC001236592299 979673457 /nfs/dbraw/zinc/67/34/57/979673457.db2.gz VZQXFKQVDIYUTH-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCC(=O)[C@H](C)CC2)o1 ZINC001236590314 979674074 /nfs/dbraw/zinc/67/40/74/979674074.db2.gz ZUZWIFAEKDSHNZ-SECBINFHSA-N 1 2 236.315 2.092 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCC(=O)[C@H](C)CC2)o1 ZINC001236590314 979674077 /nfs/dbraw/zinc/67/40/77/979674077.db2.gz ZUZWIFAEKDSHNZ-SECBINFHSA-N 1 2 236.315 2.092 20 0 BEADLO FCC1CC[NH+](Cc2nccnc2Cl)CC1 ZINC001236614563 979681704 /nfs/dbraw/zinc/68/17/04/979681704.db2.gz JCIVYXSKDBQZRA-UHFFFAOYSA-N 1 2 243.713 2.312 20 0 BEADLO COC(=O)[C@@H]1CC[N@@H+]1Cc1cccc2ccoc21 ZINC001236730833 979711264 /nfs/dbraw/zinc/71/12/64/979711264.db2.gz UUJLBIBQUDLSGH-LBPRGKRZSA-N 1 2 245.278 2.180 20 0 BEADLO COC(=O)[C@@H]1CC[N@H+]1Cc1cccc2ccoc21 ZINC001236730833 979711273 /nfs/dbraw/zinc/71/12/73/979711273.db2.gz UUJLBIBQUDLSGH-LBPRGKRZSA-N 1 2 245.278 2.180 20 0 BEADLO CC1(O)C[NH+](Cc2cc(O)cc3ccccc32)C1 ZINC001237065578 979812713 /nfs/dbraw/zinc/81/27/13/979812713.db2.gz NONUYLGCUGMCSN-UHFFFAOYSA-N 1 2 243.306 2.112 20 0 BEADLO CC[N@H+](C)Cc1cnccc1Br ZINC001237385892 979883132 /nfs/dbraw/zinc/88/31/32/979883132.db2.gz VJZZKGOXLOABTK-UHFFFAOYSA-N 1 2 229.121 2.296 20 0 BEADLO CC[N@@H+](C)Cc1cnccc1Br ZINC001237385892 979883137 /nfs/dbraw/zinc/88/31/37/979883137.db2.gz VJZZKGOXLOABTK-UHFFFAOYSA-N 1 2 229.121 2.296 20 0 BEADLO COc1c(C)cccc1C[N@@H+]1CCO[C@H](C)C1 ZINC001237498984 979923885 /nfs/dbraw/zinc/92/38/85/979923885.db2.gz AQURAZRSPRYMNS-GFCCVEGCSA-N 1 2 235.327 2.224 20 0 BEADLO COc1c(C)cccc1C[N@H+]1CCO[C@H](C)C1 ZINC001237498984 979923889 /nfs/dbraw/zinc/92/38/89/979923889.db2.gz AQURAZRSPRYMNS-GFCCVEGCSA-N 1 2 235.327 2.224 20 0 BEADLO CCN(Cc1cccc(C)c1OC)C1C[NH+](C)C1 ZINC001237503648 979924652 /nfs/dbraw/zinc/92/46/52/979924652.db2.gz DSVAGXQLHGOFRF-UHFFFAOYSA-N 1 2 248.370 2.140 20 0 BEADLO Cc1ccccc1[C@@H]1CCC[N@@H+]1Cc1nnc[nH]1 ZINC001237600804 979954492 /nfs/dbraw/zinc/95/44/92/979954492.db2.gz TWJBLIKJYJSLPX-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1nnc[nH]1 ZINC001237600804 979954500 /nfs/dbraw/zinc/95/45/00/979954500.db2.gz TWJBLIKJYJSLPX-ZDUSSCGKSA-N 1 2 242.326 2.450 20 0 BEADLO c1nnc(C[N@@H+]2CCC[C@H](c3ccccc3)C2)[nH]1 ZINC001237602206 979958834 /nfs/dbraw/zinc/95/88/34/979958834.db2.gz PRKOTCRSIKNKOD-ZDUSSCGKSA-N 1 2 242.326 2.184 20 0 BEADLO c1nnc(C[N@H+]2CCC[C@H](c3ccccc3)C2)[nH]1 ZINC001237602206 979958841 /nfs/dbraw/zinc/95/88/41/979958841.db2.gz PRKOTCRSIKNKOD-ZDUSSCGKSA-N 1 2 242.326 2.184 20 0 BEADLO Cc1coc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)n1 ZINC001237635516 979982118 /nfs/dbraw/zinc/98/21/18/979982118.db2.gz OQKTYUPALTYTPN-QMMMGPOBSA-N 1 2 230.258 2.460 20 0 BEADLO CC(C)c1ocnc1C[NH2+][C@H](C)c1cn[nH]c1 ZINC001343046114 979989635 /nfs/dbraw/zinc/98/96/35/979989635.db2.gz AILWFQYEGBXQGG-SECBINFHSA-N 1 2 234.303 2.372 20 0 BEADLO CCc1n[nH]cc1C[N@@H+]1CC[C@@](C)(F)[C@@H](F)C1 ZINC001237651333 980003031 /nfs/dbraw/zinc/00/30/31/980003031.db2.gz JOFPPAIEUJXSQW-NWDGAFQWSA-N 1 2 243.301 2.244 20 0 BEADLO CCc1n[nH]cc1C[N@H+]1CC[C@@](C)(F)[C@@H](F)C1 ZINC001237651333 980003037 /nfs/dbraw/zinc/00/30/37/980003037.db2.gz JOFPPAIEUJXSQW-NWDGAFQWSA-N 1 2 243.301 2.244 20 0 BEADLO CCc1cc(N2CCOCC[C@@H]2C)nc(CC)[nH+]1 ZINC001343142240 980020517 /nfs/dbraw/zinc/02/05/17/980020517.db2.gz YYVJIHCZLNEZFB-NSHDSACASA-N 1 2 249.358 2.217 20 0 BEADLO CN(C)c1cc(N[C@@H]2CCC[C@H](F)C2)[nH+]cn1 ZINC001343153664 980026148 /nfs/dbraw/zinc/02/61/48/980026148.db2.gz JIOJBQRATASHPA-VHSXEESVSA-N 1 2 238.310 2.235 20 0 BEADLO CN(C)c1cc(N[C@@H]2CCC[C@H](F)C2)nc[nH+]1 ZINC001343153664 980026153 /nfs/dbraw/zinc/02/61/53/980026153.db2.gz JIOJBQRATASHPA-VHSXEESVSA-N 1 2 238.310 2.235 20 0 BEADLO COc1ccc(C)c(C[N@@H+]2CCC(=O)[C@H](C)C2)c1 ZINC001237706575 980028075 /nfs/dbraw/zinc/02/80/75/980028075.db2.gz BNWJOKPWTDQSMW-GFCCVEGCSA-N 1 2 247.338 2.415 20 0 BEADLO COc1ccc(C)c(C[N@H+]2CCC(=O)[C@H](C)C2)c1 ZINC001237706575 980028084 /nfs/dbraw/zinc/02/80/84/980028084.db2.gz BNWJOKPWTDQSMW-GFCCVEGCSA-N 1 2 247.338 2.415 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@H](C(F)F)C2)nc1 ZINC001237806171 980055745 /nfs/dbraw/zinc/05/57/45/980055745.db2.gz PXWNHHYADIXUGS-JTQLQIEISA-N 1 2 241.285 2.262 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@H](C(F)F)C2)nc1 ZINC001237806171 980055759 /nfs/dbraw/zinc/05/57/59/980055759.db2.gz PXWNHHYADIXUGS-JTQLQIEISA-N 1 2 241.285 2.262 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@@H]2CF)ccc1F ZINC001237824675 980071566 /nfs/dbraw/zinc/07/15/66/980071566.db2.gz POAVROWUTNAZCX-LLVKDONJSA-N 1 2 226.270 2.463 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@@H]2CF)ccc1F ZINC001237824675 980071575 /nfs/dbraw/zinc/07/15/75/980071575.db2.gz POAVROWUTNAZCX-LLVKDONJSA-N 1 2 226.270 2.463 20 0 BEADLO COc1ccoc1C[N@@H+]1C[C@@H](F)C[C@H]1C ZINC001237863064 980073246 /nfs/dbraw/zinc/07/32/46/980073246.db2.gz JLHBKLLBRQKJFI-BDAKNGLRSA-N 1 2 213.252 2.221 20 0 BEADLO COc1ccoc1C[N@H+]1C[C@@H](F)C[C@H]1C ZINC001237863064 980073248 /nfs/dbraw/zinc/07/32/48/980073248.db2.gz JLHBKLLBRQKJFI-BDAKNGLRSA-N 1 2 213.252 2.221 20 0 BEADLO CNc1cc(-c2csc(CO)c2)cc[nH+]1 ZINC001205310963 980122597 /nfs/dbraw/zinc/12/25/97/980122597.db2.gz JBXFCCRXNPADRD-UHFFFAOYSA-N 1 2 220.297 2.344 20 0 BEADLO Cn1c[nH+]cc1CCCOC(=O)[C@@H]1CC=CCC1 ZINC001343723746 980222762 /nfs/dbraw/zinc/22/27/62/980222762.db2.gz AMTFEJAGUSGZLM-GFCCVEGCSA-N 1 2 248.326 2.252 20 0 BEADLO CC(C)[C@H]1N(C(=O)[C@H](C)n2cc[nH+]c2)CC1(C)C ZINC001343998055 980307726 /nfs/dbraw/zinc/30/77/26/980307726.db2.gz PWXICBKEUQRIPF-NWDGAFQWSA-N 1 2 249.358 2.337 20 0 BEADLO CC(C)Oc1cc(C[NH+]2CC=CC2)c(F)cn1 ZINC001238794704 980326152 /nfs/dbraw/zinc/32/61/52/980326152.db2.gz SAZROEKGRYUOFI-UHFFFAOYSA-N 1 2 236.290 2.380 20 0 BEADLO Fc1ccc(CSCCn2cc[nH+]c2)nc1 ZINC001344050735 980328433 /nfs/dbraw/zinc/32/84/33/980328433.db2.gz ZHJSCWDPBCEQBD-UHFFFAOYSA-N 1 2 237.303 2.351 20 0 BEADLO C[C@H]1COCC[N@@H+]1Cc1cccn1C1CC1 ZINC001344073794 980340251 /nfs/dbraw/zinc/34/02/51/980340251.db2.gz BJGRUFSPMYJVCZ-NSHDSACASA-N 1 2 220.316 2.044 20 0 BEADLO C[C@H]1COCC[N@H+]1Cc1cccn1C1CC1 ZINC001344073794 980340264 /nfs/dbraw/zinc/34/02/64/980340264.db2.gz BJGRUFSPMYJVCZ-NSHDSACASA-N 1 2 220.316 2.044 20 0 BEADLO CCOCc1cncc(/C(C)=C/C=C/[NH3+])c1 ZINC001238928081 980368215 /nfs/dbraw/zinc/36/82/15/980368215.db2.gz KRQUEPUVQYHSNA-KGUOMNFLSA-N 1 2 218.300 2.494 20 0 BEADLO CCOc1cc(C)c(-c2cc[nH+]c(N)c2)cn1 ZINC001238975851 980400930 /nfs/dbraw/zinc/40/09/30/980400930.db2.gz CKROWWWMQSZLPO-UHFFFAOYSA-N 1 2 229.283 2.433 20 0 BEADLO CC(C)(O)/C=C/c1ccc(Cn2cc[nH+]c2)cn1 ZINC001239147344 980464920 /nfs/dbraw/zinc/46/49/20/980464920.db2.gz OYDUTKCXVLCHBY-AATRIKPKSA-N 1 2 243.310 2.111 20 0 BEADLO Cc1c[nH+]c(C)c(Nc2cc3n(n2)CCCO3)c1 ZINC001203658164 980497360 /nfs/dbraw/zinc/49/73/60/980497360.db2.gz YTFAVYMZXZWASM-UHFFFAOYSA-N 1 2 244.298 2.421 20 0 BEADLO CCc1occc1C(=O)OCc1c[nH+]cn1CC ZINC001344971140 980509645 /nfs/dbraw/zinc/50/96/45/980509645.db2.gz HABMCDRKSRXNGW-UHFFFAOYSA-N 1 2 248.282 2.415 20 0 BEADLO CCC[C@@H](C)C(=O)OCc1c[nH+]cn1CC ZINC001344972420 980510754 /nfs/dbraw/zinc/51/07/54/980510754.db2.gz OLABKEWQRDZOAG-SNVBAGLBSA-N 1 2 224.304 2.382 20 0 BEADLO CC(C)(COC(=O)c1ccccc1)n1cc[nH+]c1 ZINC001345252747 980591157 /nfs/dbraw/zinc/59/11/57/980591157.db2.gz NRXGGKXSFBIHFP-UHFFFAOYSA-N 1 2 244.294 2.475 20 0 BEADLO C1=C(c2cc[nH+]c(N3CCCCC3)c2)COC1 ZINC001239481424 980626728 /nfs/dbraw/zinc/62/67/28/980626728.db2.gz ODSQODMOMYXOHH-UHFFFAOYSA-N 1 2 230.311 2.486 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)CCc2[nH+]ccn2C)C1 ZINC001345589035 980638267 /nfs/dbraw/zinc/63/82/67/980638267.db2.gz RQHKFBXPUFTOFY-VXGBXAGGSA-N 1 2 249.358 2.048 20 0 BEADLO Cc1cccc(-c2[nH+]ncc3c2OCCN3C)c1 ZINC001239487778 980641418 /nfs/dbraw/zinc/64/14/18/980641418.db2.gz PUHWIBQOBZGTDY-UHFFFAOYSA-N 1 2 241.294 2.281 20 0 BEADLO Cc1cc(CCn2cc[nH+]c2)cc2c[nH]nc21 ZINC001250316291 980746809 /nfs/dbraw/zinc/74/68/09/980746809.db2.gz GXUUQBRHSRDQJF-UHFFFAOYSA-N 1 2 226.283 2.311 20 0 BEADLO CCCN(CCC)C(=O)CCc1[nH+]ccn1C ZINC001346073098 980747746 /nfs/dbraw/zinc/74/77/46/980747746.db2.gz QTQQXKZFVXIIKI-UHFFFAOYSA-N 1 2 237.347 2.001 20 0 BEADLO Oc1c(F)cc(F)c(CCn2cc[nH+]c2)c1F ZINC001250316335 980748677 /nfs/dbraw/zinc/74/86/77/980748677.db2.gz JKQITHSKAQOHEE-UHFFFAOYSA-N 1 2 242.200 2.249 20 0 BEADLO C=CC(=O)Nc1ccc2c(cc[nH+]c2N(C)C)c1 ZINC001346101036 980755436 /nfs/dbraw/zinc/75/54/36/980755436.db2.gz VFSRNQQTHNNUCH-UHFFFAOYSA-N 1 2 241.294 2.425 20 0 BEADLO CC(C)Oc1cncc(CCn2cc[nH+]c2)c1 ZINC001250316604 980756246 /nfs/dbraw/zinc/75/62/46/980756246.db2.gz OGVWNMXRQLJGPT-UHFFFAOYSA-N 1 2 231.299 2.308 20 0 BEADLO CC(C)Oc1ncccc1CCn1cc[nH+]c1 ZINC001250316646 980756454 /nfs/dbraw/zinc/75/64/54/980756454.db2.gz QQKQOJONPQQFRM-UHFFFAOYSA-N 1 2 231.299 2.308 20 0 BEADLO Cc1cc(CCn2cc[nH+]c2)c(C)cc1CO ZINC001250321129 980760852 /nfs/dbraw/zinc/76/08/52/980760852.db2.gz WZGHEROYYFNNCS-UHFFFAOYSA-N 1 2 230.311 2.235 20 0 BEADLO CCCCN(CC)C(=O)CCc1[nH+]ccn1C ZINC001346230639 980792465 /nfs/dbraw/zinc/79/24/65/980792465.db2.gz KNKNRBOOECTJMU-UHFFFAOYSA-N 1 2 237.347 2.001 20 0 BEADLO Cn1cc[nH+]c1CCC(=O)N1CCCC(C)(C)C1 ZINC001346373390 980822121 /nfs/dbraw/zinc/82/21/21/980822121.db2.gz FZCSDYUXCGYODT-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO NC(=O)c1ccccc1-c1cccc2[nH+]ccn21 ZINC001239760832 980900928 /nfs/dbraw/zinc/90/09/28/980900928.db2.gz CDJWQFZIFBLJKA-UHFFFAOYSA-N 1 2 237.262 2.100 20 0 BEADLO C1=C(c2cc[nH+]c(N3CCOCC3)c2)CCC1 ZINC001239787570 980922189 /nfs/dbraw/zinc/92/21/89/980922189.db2.gz GEECLFBJUBCTRA-UHFFFAOYSA-N 1 2 230.311 2.486 20 0 BEADLO [NH3+]Cc1cncc(-c2ccc(S)cc2)c1 ZINC001239796451 980935400 /nfs/dbraw/zinc/93/54/00/980935400.db2.gz AIKUZNDJJXCCAK-UHFFFAOYSA-N 1 2 216.309 2.496 20 0 BEADLO CN(C)C(=O)c1ccc(-c2ccc[nH+]c2N)cc1 ZINC001239798360 980938501 /nfs/dbraw/zinc/93/85/01/980938501.db2.gz GIJNOXLUXYYNSX-UHFFFAOYSA-N 1 2 241.294 2.033 20 0 BEADLO Cc1cn2c(cccc2-c2ccc(N)nc2F)[nH+]1 ZINC001239821254 980965032 /nfs/dbraw/zinc/96/50/32/980965032.db2.gz WCXXDMOXBUMOBN-UHFFFAOYSA-N 1 2 242.257 2.426 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1ccc(N)nc1F ZINC001239822258 980965757 /nfs/dbraw/zinc/96/57/57/980965757.db2.gz JNIZTZMVQXJWCG-UHFFFAOYSA-N 1 2 242.257 2.426 20 0 BEADLO Cc1cc(-c2ccc(N)nc2F)cn2cc[nH+]c12 ZINC001239822178 980967149 /nfs/dbraw/zinc/96/71/49/980967149.db2.gz IWWTXRREYXUWFG-UHFFFAOYSA-N 1 2 242.257 2.426 20 0 BEADLO COc1cc(C)[nH+]cc1-c1ccc(N)nc1F ZINC001239823235 980968291 /nfs/dbraw/zinc/96/82/91/980968291.db2.gz TVNIQPZEBMBSSK-UHFFFAOYSA-N 1 2 233.246 2.182 20 0 BEADLO Cc1cc(-c2ccc(N)nc2F)c2[nH+]ccn2c1 ZINC001239823163 980968831 /nfs/dbraw/zinc/96/88/31/980968831.db2.gz RIXQAOFGCLYAEI-UHFFFAOYSA-N 1 2 242.257 2.426 20 0 BEADLO CC(C)C[N@H+](Cc1nc[nH]n1)C1CCCC1 ZINC001347096932 980971240 /nfs/dbraw/zinc/97/12/40/980971240.db2.gz FCYDZRFKVZUHRT-UHFFFAOYSA-N 1 2 222.336 2.205 20 0 BEADLO CC(C)CC[C@@H]1CCC[C@@H]1[NH2+]Cc1ncn[nH]1 ZINC001347114019 980975832 /nfs/dbraw/zinc/97/58/32/980975832.db2.gz NXYUFYLFLJPHBB-RYUDHWBXSA-N 1 2 236.363 2.499 20 0 BEADLO Cc1c(-c2ccc(N)nc2F)ccc2[nH+]ccn21 ZINC001239832584 980976046 /nfs/dbraw/zinc/97/60/46/980976046.db2.gz YUNBAZQXBZHCBX-UHFFFAOYSA-N 1 2 242.257 2.426 20 0 BEADLO COc1cc(C)[nH+]cc1-c1cccnc1OC ZINC001239858613 981000770 /nfs/dbraw/zinc/00/07/70/981000770.db2.gz WKSHJTHIWORCHE-UHFFFAOYSA-N 1 2 230.267 2.469 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2n[nH]cc2c1 ZINC001240209241 981155164 /nfs/dbraw/zinc/15/51/64/981155164.db2.gz JMSHZDFJULMCMF-UHFFFAOYSA-N 1 2 210.240 2.207 20 0 BEADLO c1cc2nc(-c3ccc4[nH+]ccn4c3)cnc2[nH]1 ZINC001240214237 981161110 /nfs/dbraw/zinc/16/11/10/981161110.db2.gz MAWMOTYIUOARDJ-UHFFFAOYSA-N 1 2 235.250 2.273 20 0 BEADLO Nc1cnc(-c2ccc3[nH+]ccn3c2)c(F)c1 ZINC001240214007 981162175 /nfs/dbraw/zinc/16/21/75/981162175.db2.gz JLTICDXATYXWKG-UHFFFAOYSA-N 1 2 228.230 2.118 20 0 BEADLO Cn1ccc2ncnc(-c3ccc4[nH+]ccn4c3)c21 ZINC001240213907 981162210 /nfs/dbraw/zinc/16/22/10/981162210.db2.gz HLDIANVREVSJAB-UHFFFAOYSA-N 1 2 249.277 2.283 20 0 BEADLO Cc1ncnc(-c2ccc3[nH+]ccn3c2)c1C ZINC001240215484 981163082 /nfs/dbraw/zinc/16/30/82/981163082.db2.gz ZQYTYFRQWGBXGC-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO Cc1cc(-c2ccc3[nH+]ccn3c2)nnc1C ZINC001240214872 981163326 /nfs/dbraw/zinc/16/33/26/981163326.db2.gz QEHLUMDOCQRWBT-UHFFFAOYSA-N 1 2 224.267 2.408 20 0 BEADLO Cc1cncc(-c2ccc3[nH+]ccn3c2)n1 ZINC001240214850 981163707 /nfs/dbraw/zinc/16/37/07/981163707.db2.gz SWZOEZFZGPNNPE-UHFFFAOYSA-N 1 2 210.240 2.100 20 0 BEADLO c1cn2cc(-c3ccc4[nH+]ccn4c3)cnc2n1 ZINC001240217895 981167340 /nfs/dbraw/zinc/16/73/40/981167340.db2.gz PXOFTEPMCGOYTB-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO Nc1cn2ccc(-c3ccc4nccn4c3)cc2[nH+]1 ZINC001240218074 981167398 /nfs/dbraw/zinc/16/73/98/981167398.db2.gz ZJVCXANABFBBMG-UHFFFAOYSA-N 1 2 249.277 2.231 20 0 BEADLO O=C1Cc2ccc(-c3ccc4[nH+]ccn4c3)cc2N1 ZINC001240217455 981167841 /nfs/dbraw/zinc/16/78/41/981167841.db2.gz DTZRCIKHQLPIPA-UHFFFAOYSA-N 1 2 249.273 2.496 20 0 BEADLO c1cn2c(cncc2-c2ccc3[nH+]ccn3c2)n1 ZINC001240219312 981169934 /nfs/dbraw/zinc/16/99/34/981169934.db2.gz FZSUMUILAQZIIH-UHFFFAOYSA-N 1 2 235.250 2.044 20 0 BEADLO Cc1cc(-c2ccc3[nH+]ccn3c2)c(=O)n(C)c1 ZINC001240221300 981175326 /nfs/dbraw/zinc/17/53/26/981175326.db2.gz KYWHXJABIORAJA-UHFFFAOYSA-N 1 2 239.278 2.008 20 0 BEADLO c1[nH+]cn2ccnc(N3CCC[C@@H]3C3CCC3)c12 ZINC001347980875 981233386 /nfs/dbraw/zinc/23/33/86/981233386.db2.gz HIRDLVHSMGUGKO-GFCCVEGCSA-N 1 2 242.326 2.498 20 0 BEADLO C[C@H](CC(C)(C)C)NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001348024995 981251561 /nfs/dbraw/zinc/25/15/61/981251561.db2.gz XXDQEKSDWWRUOG-GHMZBOCLSA-N 1 2 237.347 2.385 20 0 BEADLO C/C=C(/C)C(=O)N1CCC(Cc2c[nH]c[nH+]2)CC1 ZINC001348022327 981252242 /nfs/dbraw/zinc/25/22/42/981252242.db2.gz FTXBUBVLZXPESL-JYOAFUTRSA-N 1 2 247.342 2.157 20 0 BEADLO CCc1ccc(N2CCO[C@@H](C)[C@H]2C)[nH+]c1 ZINC001348041691 981259909 /nfs/dbraw/zinc/25/99/09/981259909.db2.gz CGGKIOFVJXXAQN-MNOVXSKESA-N 1 2 220.316 2.258 20 0 BEADLO CCc1ccc(N2CCOCC3(CC3)C2)[nH+]c1 ZINC001348085332 981278096 /nfs/dbraw/zinc/27/80/96/981278096.db2.gz WZBKGJANEUJBJU-UHFFFAOYSA-N 1 2 232.327 2.261 20 0 BEADLO CCc1ccc(N2CCC[C@](C)(O)CC2)[nH+]c1 ZINC001348136869 981293867 /nfs/dbraw/zinc/29/38/67/981293867.db2.gz CVQMVQNNPJFTLC-AWEZNQCLSA-N 1 2 234.343 2.385 20 0 BEADLO Cc1cc(F)cc(N2CC[C@@H](CCCO)C2)[nH+]1 ZINC001348206442 981308301 /nfs/dbraw/zinc/30/83/01/981308301.db2.gz NGDSJIRFYJESTL-LLVKDONJSA-N 1 2 238.306 2.128 20 0 BEADLO CCc1ccc(N2CCO[C@@H](CCF)C2)[nH+]c1 ZINC001348271307 981321151 /nfs/dbraw/zinc/32/11/51/981321151.db2.gz QHECRFKJCJGKRH-LBPRGKRZSA-N 1 2 238.306 2.209 20 0 BEADLO CCc1ccc(N2CCO[C@H](CCF)C2)[nH+]c1 ZINC001348271306 981322904 /nfs/dbraw/zinc/32/29/04/981322904.db2.gz QHECRFKJCJGKRH-GFCCVEGCSA-N 1 2 238.306 2.209 20 0 BEADLO CC(C)OC(=O)NCc1c[nH+]cn1C(C)C ZINC001193513914 981368711 /nfs/dbraw/zinc/36/87/11/981368711.db2.gz ITFKYQXSWYMDDC-UHFFFAOYSA-N 1 2 225.292 2.099 20 0 BEADLO CC[C@@H](C)Cc1noc([C@@H](C)n2cc[nH+]c2)n1 ZINC001348573322 981396691 /nfs/dbraw/zinc/39/66/91/981396691.db2.gz GNRPNOXJPRYDCV-NXEZZACHSA-N 1 2 234.303 2.464 20 0 BEADLO CCOc1ccnc(-c2ccn3cc[nH+]c3c2)n1 ZINC001240496050 981415158 /nfs/dbraw/zinc/41/51/58/981415158.db2.gz FIPFSGMKUSBULC-UHFFFAOYSA-N 1 2 240.266 2.190 20 0 BEADLO COc1cc(C)nc(-c2ccn3cc[nH+]c3c2)n1 ZINC001240496025 981416155 /nfs/dbraw/zinc/41/61/55/981416155.db2.gz CXXLHSDANLBZPD-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO CC[C@@H](F)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC001348720538 981427635 /nfs/dbraw/zinc/42/76/35/981427635.db2.gz WGKUTCFCTFOMPG-SNVBAGLBSA-N 1 2 235.262 2.329 20 0 BEADLO O=C1NCc2c1cccc2-c1ccn2cc[nH+]c2c1 ZINC001240509447 981432748 /nfs/dbraw/zinc/43/27/48/981432748.db2.gz ZMFXNLJNXJALIU-UHFFFAOYSA-N 1 2 249.273 2.245 20 0 BEADLO COc1ncnc(C)c1-c1ccn2cc[nH+]c2c1 ZINC001240511026 981437303 /nfs/dbraw/zinc/43/73/03/981437303.db2.gz ZBMLVNDRNVBOCF-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO COc1ncc(-c2ccn3cc[nH+]c3c2)c(C)n1 ZINC001240510437 981437337 /nfs/dbraw/zinc/43/73/37/981437337.db2.gz JXELZTZTRDFUFC-UHFFFAOYSA-N 1 2 240.266 2.108 20 0 BEADLO CCn1ccc(-c2ccn3cc[nH+]c3c2)cc1=O ZINC001240513414 981439977 /nfs/dbraw/zinc/43/99/77/981439977.db2.gz RCRUHIDCGUSJNK-UHFFFAOYSA-N 1 2 239.278 2.183 20 0 BEADLO Cc1cc(NC(=O)[C@@H](C)n2cc[nH+]c2)cs1 ZINC001348789926 981443088 /nfs/dbraw/zinc/44/30/88/981443088.db2.gz YDVMFVBBKNZSDD-SECBINFHSA-N 1 2 235.312 2.453 20 0 BEADLO Nc1ccc(-c2cc[nH+]c(N)c2)c(F)c1 ZINC001240526133 981463098 /nfs/dbraw/zinc/46/30/98/981463098.db2.gz ANSMDDSGDCZJMN-UHFFFAOYSA-N 1 2 203.220 2.052 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2c[nH]nc2c1 ZINC001240557120 981478461 /nfs/dbraw/zinc/47/84/61/981478461.db2.gz OOQNKJTVAAVHKP-UHFFFAOYSA-N 1 2 210.240 2.207 20 0 BEADLO Cc1ccc(C(=O)Nc2cccc3[nH+]ccn32)[nH]1 ZINC001193902033 981503861 /nfs/dbraw/zinc/50/38/61/981503861.db2.gz ZFIIUHZPNQEZQD-UHFFFAOYSA-N 1 2 240.266 2.223 20 0 BEADLO COc1cc(-c2c[nH+]c(N)c(C)c2)ccc1O ZINC001240615955 981512794 /nfs/dbraw/zinc/51/27/94/981512794.db2.gz MCCKEJMGLYWIMA-UHFFFAOYSA-N 1 2 230.267 2.353 20 0 BEADLO CCn1cc(-c2ccc3[nH+]ccn3c2)cn1 ZINC001240649913 981555012 /nfs/dbraw/zinc/55/50/12/981555012.db2.gz MVVMZKDZTDTFAO-UHFFFAOYSA-N 1 2 212.256 2.218 20 0 BEADLO c1snnc1C[NH2+]Cc1cccc2c1CCC2 ZINC001349626259 981599752 /nfs/dbraw/zinc/59/97/52/981599752.db2.gz QVDJIAIRNMKAPF-UHFFFAOYSA-N 1 2 245.351 2.317 20 0 BEADLO Cc1ccc(C2=CCC3(CC2)OCCO3)[nH+]c1N ZINC001240704549 981656413 /nfs/dbraw/zinc/65/64/13/981656413.db2.gz PQXLKCLEZWVYHM-UHFFFAOYSA-N 1 2 246.310 2.283 20 0 BEADLO Fc1c[nH+]ccc1N[C@H]1CCC[C@H](F)C1 ZINC001349775563 981724719 /nfs/dbraw/zinc/72/47/19/981724719.db2.gz HCVUAUCXZUBBOO-IUCAKERBSA-N 1 2 212.243 2.335 20 0 BEADLO CC[C@H](C)CC(=O)Nc1c(C)c[nH+]cc1C ZINC001349793367 981746041 /nfs/dbraw/zinc/74/60/41/981746041.db2.gz YGTWLUMAZDSWHD-VIFPVBQESA-N 1 2 220.316 2.495 20 0 BEADLO Cc1cncc(-c2cc[nH+]c3c2CCN3)c1 ZINC001240806142 981861686 /nfs/dbraw/zinc/86/16/86/981861686.db2.gz OFCUJXRAUNTJGG-UHFFFAOYSA-N 1 2 211.268 2.420 20 0 BEADLO CC(C)Oc1ccc(-c2c[nH+]cn2C)cn1 ZINC001240807069 981861743 /nfs/dbraw/zinc/86/17/43/981861743.db2.gz GNHARRPDVRQTOB-UHFFFAOYSA-N 1 2 217.272 2.269 20 0 BEADLO Cc1cc(-c2cccc3[nH+]ccn32)n(C)n1 ZINC001240857891 981895779 /nfs/dbraw/zinc/89/57/79/981895779.db2.gz AYVLRLGOQCLSGX-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO CC[C@@H](C)CC(=O)OCc1c[nH+]cn1CC ZINC001350345130 981935553 /nfs/dbraw/zinc/93/55/53/981935553.db2.gz RBRKXTBIZMAFPY-SNVBAGLBSA-N 1 2 224.304 2.382 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc2c(c1)OCO2 ZINC001240900546 981952689 /nfs/dbraw/zinc/95/26/89/981952689.db2.gz HENOMTYISSBFGL-YGQDEOHPSA-N 1 2 203.241 2.291 20 0 BEADLO Cc1cc(-c2cnn3cccnc23)cn2cc[nH+]c12 ZINC001240932305 982007862 /nfs/dbraw/zinc/00/78/62/982007862.db2.gz YRIDRXUMNUZVID-UHFFFAOYSA-N 1 2 249.277 2.352 20 0 BEADLO Nc1cn2ccc(-c3ccccc3O)cc2[nH+]1 ZINC001241009413 982101562 /nfs/dbraw/zinc/10/15/62/982101562.db2.gz ZAOWFNAQLAAMNW-UHFFFAOYSA-N 1 2 225.251 2.289 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)N1CCCC[C@@H]1C1CCC1 ZINC001351044469 982183687 /nfs/dbraw/zinc/18/36/87/982183687.db2.gz OKFPSEXXOVAVPQ-GFCCVEGCSA-N 1 2 247.342 2.133 20 0 BEADLO O=c1[nH]cccc1-c1ccc2[nH+]ccn2c1 ZINC001241111978 982220604 /nfs/dbraw/zinc/22/06/04/982220604.db2.gz AMTCIIUGIOZKOZ-UHFFFAOYSA-N 1 2 211.224 2.102 20 0 BEADLO Fc1ccc2c(c1)C[N@@H+](Cc1cnoc1)CC2 ZINC001205703318 982256803 /nfs/dbraw/zinc/25/68/03/982256803.db2.gz ACAMYFGXJLWYDK-UHFFFAOYSA-N 1 2 232.258 2.372 20 0 BEADLO Fc1ccc2c(c1)C[N@H+](Cc1cnoc1)CC2 ZINC001205703318 982256820 /nfs/dbraw/zinc/25/68/20/982256820.db2.gz ACAMYFGXJLWYDK-UHFFFAOYSA-N 1 2 232.258 2.372 20 0 BEADLO Nc1cc(-c2ccc3ncncc3c2)cc[nH+]1 ZINC001241161935 982295964 /nfs/dbraw/zinc/29/59/64/982295964.db2.gz BFDUUWFQGUUSPE-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO COC(=O)c1ccc(C)cc1-c1cc[nH+]c(N)c1 ZINC001241162455 982300287 /nfs/dbraw/zinc/30/02/87/982300287.db2.gz JNOVFMXTXTXLON-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO CC(=O)Nc1ccc(-c2cc[nH+]c(N)c2)cc1F ZINC001241162084 982303690 /nfs/dbraw/zinc/30/36/90/982303690.db2.gz BOZRSXDEQXOUBC-UHFFFAOYSA-N 1 2 245.257 2.428 20 0 BEADLO Nc1cc(-c2ccc3ccnnc3c2)cc[nH+]1 ZINC001241169736 982310067 /nfs/dbraw/zinc/31/00/67/982310067.db2.gz NLPYMYXFSOBNKA-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO Nc1cc(-c2cccc(N3CCC3=O)c2)cc[nH+]1 ZINC001241169641 982310559 /nfs/dbraw/zinc/31/05/59/982310559.db2.gz JGZGAAGJSOXUJE-UHFFFAOYSA-N 1 2 239.278 2.068 20 0 BEADLO Cc1cc(-c2ccnc(N)c2)c2[nH+]ccn2c1 ZINC001241170472 982319105 /nfs/dbraw/zinc/31/91/05/982319105.db2.gz JYVZAPWGZNVQAX-UHFFFAOYSA-N 1 2 224.267 2.287 20 0 BEADLO COc1cc(-c2cc[nH+]c(N)c2)c2cc[nH]c2n1 ZINC001241175790 982326230 /nfs/dbraw/zinc/32/62/30/982326230.db2.gz NEAIQNKBIAKCBS-UHFFFAOYSA-N 1 2 240.266 2.216 20 0 BEADLO CCN(CCC1CC1)C(=O)CCc1[nH+]ccn1C ZINC001351764879 982376946 /nfs/dbraw/zinc/37/69/46/982376946.db2.gz XXTXAKGSBCGFIC-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO Cc1cc(N(C)C)[nH+]cc1-c1cc(N)c(F)cn1 ZINC001241235662 982387058 /nfs/dbraw/zinc/38/70/58/982387058.db2.gz RLIRCEKCGIPYNQ-UHFFFAOYSA-N 1 2 246.289 2.239 20 0 BEADLO C[C@H](C(=O)N1CC[C@H]1C1CCCC1)n1cc[nH+]c1 ZINC001351842125 982398899 /nfs/dbraw/zinc/39/88/99/982398899.db2.gz JLMSCHHZXPHSEE-YPMHNXCESA-N 1 2 247.342 2.235 20 0 BEADLO Cc1ccc(-c2cc(O)cc(F)c2)[nH+]c1N ZINC001241262554 982401166 /nfs/dbraw/zinc/40/11/66/982401166.db2.gz OHCUKZZQTSVWGY-UHFFFAOYSA-N 1 2 218.231 2.484 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)o1 ZINC001352010894 982434667 /nfs/dbraw/zinc/43/46/67/982434667.db2.gz CZNQRNJWWLHJRN-GXSJLCMTSA-N 1 2 227.279 2.468 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@H](C)[C@H](F)C2)o1 ZINC001352010894 982434671 /nfs/dbraw/zinc/43/46/71/982434671.db2.gz CZNQRNJWWLHJRN-GXSJLCMTSA-N 1 2 227.279 2.468 20 0 BEADLO C[C@H](c1ccccc1)[N@@H+]1CCn2nccc2C1 ZINC001196410758 982451889 /nfs/dbraw/zinc/45/18/89/982451889.db2.gz UMQHVYOWZFGNKF-GFCCVEGCSA-N 1 2 227.311 2.460 20 0 BEADLO C[C@H](c1ccccc1)[N@H+]1CCn2nccc2C1 ZINC001196410758 982451896 /nfs/dbraw/zinc/45/18/96/982451896.db2.gz UMQHVYOWZFGNKF-GFCCVEGCSA-N 1 2 227.311 2.460 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccccc1[S@@](C)=O ZINC001241341131 982502978 /nfs/dbraw/zinc/50/29/78/982502978.db2.gz KRTRBSWTFSVFBN-MYRHZDMVSA-N 1 2 221.325 2.300 20 0 BEADLO Cc1cccnc1C[N@@H+]1CCC(=O)C(C)(C)C1 ZINC001205800285 982531943 /nfs/dbraw/zinc/53/19/43/982531943.db2.gz PPCSSDLOMSKWJY-UHFFFAOYSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1cccnc1C[N@H+]1CCC(=O)C(C)(C)C1 ZINC001205800285 982531951 /nfs/dbraw/zinc/53/19/51/982531951.db2.gz PPCSSDLOMSKWJY-UHFFFAOYSA-N 1 2 232.327 2.191 20 0 BEADLO CNC(=O)c1cc(-c2c(C)cc[nH+]c2C)ccn1 ZINC001241432115 982588234 /nfs/dbraw/zinc/58/82/34/982588234.db2.gz DULGDTYPAIRVGF-UHFFFAOYSA-N 1 2 241.294 2.120 20 0 BEADLO Cc1ccc(-c2ccc3c(c2)OCCN3)[nH+]c1N ZINC001241442053 982598396 /nfs/dbraw/zinc/59/83/96/982598396.db2.gz LXLYQFFJSVPFKW-UHFFFAOYSA-N 1 2 241.294 2.444 20 0 BEADLO C[C@H]1CCC[C@@H](C2C[NH+](Cc3cn(C)nn3)C2)C1 ZINC001352878093 982620392 /nfs/dbraw/zinc/62/03/92/982620392.db2.gz PNXKOWDZLZXALV-NWDGAFQWSA-N 1 2 248.374 2.073 20 0 BEADLO Nc1ccc(-c2ccc3nccnc3c2)c[nH+]1 ZINC001241494302 982647312 /nfs/dbraw/zinc/64/73/12/982647312.db2.gz VDOCDFQLLZVPED-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO OCc1cccc(-c2cccn3cc[nH+]c23)c1 ZINC001241508838 982666443 /nfs/dbraw/zinc/66/64/43/982666443.db2.gz OJYIPKQRPSQQJY-UHFFFAOYSA-N 1 2 224.263 2.494 20 0 BEADLO COc1ccc(-c2c[nH+]c(N)c(C)c2)c(OC)n1 ZINC001241576947 982827979 /nfs/dbraw/zinc/82/79/79/982827979.db2.gz DTUCKAKJSIAETK-UHFFFAOYSA-N 1 2 245.282 2.051 20 0 BEADLO Nc1n[nH]c2ccc(-c3cccn4cc[nH+]c34)cc12 ZINC001241722691 983007655 /nfs/dbraw/zinc/00/76/55/983007655.db2.gz MAVVUTFKRFWQTQ-UHFFFAOYSA-N 1 2 249.277 2.460 20 0 BEADLO CC(=O)Nc1ccc(Nc2[nH+]cccc2N)cc1 ZINC000082307399 983010661 /nfs/dbraw/zinc/01/06/61/983010661.db2.gz PFMFQCBKCCGVOO-UHFFFAOYSA-N 1 2 242.282 2.366 20 0 BEADLO COc1cc(C)c(-c2ccc[nH+]c2N)cn1 ZINC001241762150 983035677 /nfs/dbraw/zinc/03/56/77/983035677.db2.gz XXOBWOSHNWBZCM-UHFFFAOYSA-N 1 2 215.256 2.043 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc(F)c(CO)c1 ZINC001241788846 983051574 /nfs/dbraw/zinc/05/15/74/983051574.db2.gz DIEXDBPVYWQPTO-YGQDEOHPSA-N 1 2 207.248 2.194 20 0 BEADLO Cc1cc(F)cc(N2CCC[C@H](CCO)C2)[nH+]1 ZINC001354102460 983154249 /nfs/dbraw/zinc/15/42/49/983154249.db2.gz QZFIPJYSAHBCRM-LLVKDONJSA-N 1 2 238.306 2.128 20 0 BEADLO CC(C)c1nccnc1Nc1ccc(N)[nH+]c1 ZINC001201284198 983156573 /nfs/dbraw/zinc/15/65/73/983156573.db2.gz MZTBGOKDMZISQU-UHFFFAOYSA-N 1 2 229.287 2.321 20 0 BEADLO Nc1ccc(Nc2cnc3ccccc3n2)c[nH+]1 ZINC001201279622 983158216 /nfs/dbraw/zinc/15/82/16/983158216.db2.gz XXQJBIMHNYVRQQ-UHFFFAOYSA-N 1 2 237.266 2.351 20 0 BEADLO Nc1ccc(Nc2cccc3c2COC3=O)c[nH+]1 ZINC001201285866 983160955 /nfs/dbraw/zinc/16/09/55/983160955.db2.gz RCCRRVIAGVDLMV-UHFFFAOYSA-N 1 2 241.250 2.078 20 0 BEADLO Nc1ccc(Nc2cc(O)ccc2F)c[nH+]1 ZINC001201286138 983162804 /nfs/dbraw/zinc/16/28/04/983162804.db2.gz XABIKUSNDFPHQO-UHFFFAOYSA-N 1 2 219.219 2.252 20 0 BEADLO Nc1ccc(Nc2cc(F)ccc2O)c[nH+]1 ZINC001201286931 983163188 /nfs/dbraw/zinc/16/31/88/983163188.db2.gz ILIBGCWAPOMBGY-UHFFFAOYSA-N 1 2 219.219 2.252 20 0 BEADLO Nc1ccc(Nc2cc(O)c(F)cc2F)c[nH+]1 ZINC001201286894 983163639 /nfs/dbraw/zinc/16/36/39/983163639.db2.gz GOZOMMYFXZFGPO-UHFFFAOYSA-N 1 2 237.209 2.391 20 0 BEADLO Cc1c(CO)cccc1Nc1ccc(N)[nH+]c1 ZINC001201286165 983164137 /nfs/dbraw/zinc/16/41/37/983164137.db2.gz XWBGROYAYPHHSI-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO CCN(c1ccc(N)[nH+]c1)c1ccccc1N ZINC001201287191 983166135 /nfs/dbraw/zinc/16/61/35/983166135.db2.gz YKUSCVZBTIKBON-UHFFFAOYSA-N 1 2 228.299 2.404 20 0 BEADLO Nc1ccc(Nc2cc(F)ccc2CO)c[nH+]1 ZINC001201292325 983168430 /nfs/dbraw/zinc/16/84/30/983168430.db2.gz VGNPNFPZEVJDSI-UHFFFAOYSA-N 1 2 233.246 2.039 20 0 BEADLO Fc1cccnc1N1CCC(c2c[nH]c[nH+]2)CC1 ZINC001354132261 983169234 /nfs/dbraw/zinc/16/92/34/983169234.db2.gz WNTGCAGFKUTCTK-UHFFFAOYSA-N 1 2 246.289 2.328 20 0 BEADLO Cc1ccncc1Nc1ccc(N)[nH+]c1 ZINC001201272751 983171067 /nfs/dbraw/zinc/17/10/67/983171067.db2.gz UICOJSKXUXUKCS-UHFFFAOYSA-N 1 2 200.245 2.111 20 0 BEADLO Cc1cn2c(cccc2Nc2ccc(N)[nH+]c2)n1 ZINC001201272512 983174454 /nfs/dbraw/zinc/17/44/54/983174454.db2.gz PMHSLRFSTOYCQO-UHFFFAOYSA-N 1 2 239.282 2.364 20 0 BEADLO Cc1cc(Nc2ccc(N)[nH+]c2)n(CC2CC2)n1 ZINC001201278651 983178881 /nfs/dbraw/zinc/17/88/81/983178881.db2.gz FHCRHKFTEXIEDA-UHFFFAOYSA-N 1 2 243.314 2.322 20 0 BEADLO Nc1ccc(Nc2cc(Cl)ncc2O)c[nH+]1 ZINC001201278920 983179159 /nfs/dbraw/zinc/17/91/59/983179159.db2.gz PIZMMXSTWHTATQ-UHFFFAOYSA-N 1 2 236.662 2.161 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cccc2c1OCC2 ZINC001242010373 983200408 /nfs/dbraw/zinc/20/04/08/983200408.db2.gz LPSVZZSBSJHUPE-KLXHRMLDSA-N 1 2 201.269 2.497 20 0 BEADLO Nc1cc(N2CCC(c3ccco3)CC2)[nH+]cn1 ZINC001354227679 983208315 /nfs/dbraw/zinc/20/83/15/983208315.db2.gz RZTAMSZBTOBNLB-UHFFFAOYSA-N 1 2 244.298 2.036 20 0 BEADLO C[C@@H]1C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc21 ZINC001242015400 983212332 /nfs/dbraw/zinc/21/23/32/983212332.db2.gz GHRWESFUXSZGIX-ZETCQYMHSA-N 1 2 213.240 2.132 20 0 BEADLO Cc1cn2c(cccc2NC(=S)NC2CC2)[nH+]1 ZINC001200618404 983254974 /nfs/dbraw/zinc/25/49/74/983254974.db2.gz JNTZNSKNRPXAIY-UHFFFAOYSA-N 1 2 246.339 2.092 20 0 BEADLO Cc1c[nH+]ccc1NC(=S)NC1CCCCC1 ZINC001200640480 983295410 /nfs/dbraw/zinc/29/54/10/983295410.db2.gz KEJRSUIMFIYUPJ-UHFFFAOYSA-N 1 2 249.383 2.431 20 0 BEADLO CNc1ccc(-c2cc[nH+]c(N(C)C)c2)cn1 ZINC001242069233 983298779 /nfs/dbraw/zinc/29/87/79/983298779.db2.gz DEHVVLDBIXCWCG-UHFFFAOYSA-N 1 2 228.299 2.251 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1ncc(C2CC2)cn1 ZINC001242072175 983308077 /nfs/dbraw/zinc/30/80/77/983308077.db2.gz DSIMZQDZZLMKSY-UHFFFAOYSA-N 1 2 226.283 2.307 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1ncc2ncsc2n1 ZINC001242072108 983308099 /nfs/dbraw/zinc/30/80/99/983308099.db2.gz BMKYMYZZDYNCSG-UHFFFAOYSA-N 1 2 243.295 2.039 20 0 BEADLO Cc1cc(-c2c[nH+]c(N)cc2C)nnc1C ZINC001242072873 983310785 /nfs/dbraw/zinc/31/07/85/983310785.db2.gz SINJZDHVUMWXJX-UHFFFAOYSA-N 1 2 214.272 2.046 20 0 BEADLO Cc1ccccc1O[C@H](C)C[NH2+]Cc1ccn[nH]1 ZINC001200772512 983352965 /nfs/dbraw/zinc/35/29/65/983352965.db2.gz BNTYNSUSVYBVPO-GFCCVEGCSA-N 1 2 245.326 2.275 20 0 BEADLO CCN(C)c1ccc(Nc2cncc(O)c2)c[nH+]1 ZINC001201633147 983363226 /nfs/dbraw/zinc/36/32/26/983363226.db2.gz CDFLECKXAKIIRM-UHFFFAOYSA-N 1 2 244.298 2.382 20 0 BEADLO Cc1[nH+]c2ccc(N)cc2n1-c1cncc(O)c1 ZINC001201639474 983367813 /nfs/dbraw/zinc/36/78/13/983367813.db2.gz DRWLRJZDRAWSCB-UHFFFAOYSA-N 1 2 240.266 2.017 20 0 BEADLO C[N@H+]1CCC[C@H]2C[NH+](CCc3ccccc3)C[C@@H]21 ZINC001201606093 983371953 /nfs/dbraw/zinc/37/19/53/983371953.db2.gz IJZYYHDXBSEGEN-HOTGVXAUSA-N 1 2 244.382 2.255 20 0 BEADLO C[NH+]1CCC[C@H]2C[N@H+](CCc3ccccc3)C[C@@H]21 ZINC001201606093 983371965 /nfs/dbraw/zinc/37/19/65/983371965.db2.gz IJZYYHDXBSEGEN-HOTGVXAUSA-N 1 2 244.382 2.255 20 0 BEADLO COc1ccc(-c2c[nH+]c(N)c(C)c2)cc1O ZINC001242175045 983392872 /nfs/dbraw/zinc/39/28/72/983392872.db2.gz QRDAOLQZWOHTID-UHFFFAOYSA-N 1 2 230.267 2.353 20 0 BEADLO CCCCC[N@@H+]1CC(F)(F)CC[C@H]1CO ZINC001201726021 983434082 /nfs/dbraw/zinc/43/40/82/983434082.db2.gz XHGSXYQYFJXVBE-JTQLQIEISA-N 1 2 221.291 2.269 20 0 BEADLO CCCCC[N@H+]1CC(F)(F)CC[C@H]1CO ZINC001201726021 983434085 /nfs/dbraw/zinc/43/40/85/983434085.db2.gz XHGSXYQYFJXVBE-JTQLQIEISA-N 1 2 221.291 2.269 20 0 BEADLO CCCCC[N@@H+]1CC(F)(F)CC[C@@H]1CO ZINC001201726022 983435336 /nfs/dbraw/zinc/43/53/36/983435336.db2.gz XHGSXYQYFJXVBE-SNVBAGLBSA-N 1 2 221.291 2.269 20 0 BEADLO CCCCC[N@H+]1CC(F)(F)CC[C@@H]1CO ZINC001201726022 983435345 /nfs/dbraw/zinc/43/53/45/983435345.db2.gz XHGSXYQYFJXVBE-SNVBAGLBSA-N 1 2 221.291 2.269 20 0 BEADLO CCOc1ccc(C[NH2+]Cc2cc(C)ncn2)o1 ZINC001355275462 983458251 /nfs/dbraw/zinc/45/82/51/983458251.db2.gz VCMBDLXSKZTTPO-UHFFFAOYSA-N 1 2 247.298 2.067 20 0 BEADLO CCC/C=C/c1[nH+]ncc2c1OCCN2C ZINC001242252687 983468795 /nfs/dbraw/zinc/46/87/95/983468795.db2.gz KDPFJQBCJGJVCO-AATRIKPKSA-N 1 2 219.288 2.119 20 0 BEADLO Cc1cc2n[nH]cc2cc1-c1c[nH+]cn1C ZINC001242282234 983504092 /nfs/dbraw/zinc/50/40/92/983504092.db2.gz TZWSIVGZMJEYCH-UHFFFAOYSA-N 1 2 212.256 2.272 20 0 BEADLO CCCC[C@@H](O)C[N@H+](C)CC(=O)c1ccccc1 ZINC001252092408 983536449 /nfs/dbraw/zinc/53/64/49/983536449.db2.gz ANLBIEOASXWDSV-CQSZACIVSA-N 1 2 249.354 2.352 20 0 BEADLO CCCC[C@@H](O)C[N@@H+](C)CC(=O)c1ccccc1 ZINC001252092408 983536470 /nfs/dbraw/zinc/53/64/70/983536470.db2.gz ANLBIEOASXWDSV-CQSZACIVSA-N 1 2 249.354 2.352 20 0 BEADLO Cc1cc(-c2cc(F)ccc2CO)c[nH+]c1N ZINC001242342065 983589245 /nfs/dbraw/zinc/58/92/45/983589245.db2.gz YGTGXJWMJPBHCV-UHFFFAOYSA-N 1 2 232.258 2.271 20 0 BEADLO CCN(C(=O)Nc1cccc(C)c1)C1C[NH+](C)C1 ZINC001202313880 983629591 /nfs/dbraw/zinc/62/95/91/983629591.db2.gz ZDNIIQQNOMCOLY-UHFFFAOYSA-N 1 2 247.342 2.163 20 0 BEADLO CCCOC1C[NH+](CCCC(F)(F)F)C1 ZINC001202424848 983656119 /nfs/dbraw/zinc/65/61/19/983656119.db2.gz OOAGSSLXDONTPG-UHFFFAOYSA-N 1 2 225.254 2.440 20 0 BEADLO Cc1c(-c2ccn(C)n2)ccc2[nH+]ccn21 ZINC001242461238 983783360 /nfs/dbraw/zinc/78/33/60/983783360.db2.gz ZPPQRWGZNZGCTM-UHFFFAOYSA-N 1 2 212.256 2.043 20 0 BEADLO Cn1nc(C[N@@H+]2CCCSCC2)cc1Cl ZINC000859213133 983806811 /nfs/dbraw/zinc/80/68/11/983806811.db2.gz MFWRQQYTKFINID-UHFFFAOYSA-N 1 2 245.779 2.012 20 0 BEADLO Cn1nc(C[N@H+]2CCCSCC2)cc1Cl ZINC000859213133 983806812 /nfs/dbraw/zinc/80/68/12/983806812.db2.gz MFWRQQYTKFINID-UHFFFAOYSA-N 1 2 245.779 2.012 20 0 BEADLO C/C(=C\C=C\[NH3+])c1cncc(N(C)C)c1 ZINC001242527630 983834232 /nfs/dbraw/zinc/83/42/32/983834232.db2.gz CLVPAQNYXXRNIJ-GQYICFGZSA-N 1 2 203.289 2.023 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2ncncc2c1 ZINC001242511568 983834975 /nfs/dbraw/zinc/83/49/75/983834975.db2.gz GUSBGKKCZULPGK-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO CN(C)c1cc(-c2ccc(CO)c(F)c2)cc[nH+]1 ZINC001242532968 983853699 /nfs/dbraw/zinc/85/36/99/983853699.db2.gz XNUJJELLMSLEOF-UHFFFAOYSA-N 1 2 246.285 2.446 20 0 BEADLO CC(=O)c1cc(-c2c[nH+]c(N)c(C)c2)ccn1 ZINC001242610675 983973882 /nfs/dbraw/zinc/97/38/82/983973882.db2.gz FAMCJVOKASGPBS-UHFFFAOYSA-N 1 2 227.267 2.237 20 0 BEADLO CNc1cc(-c2c[nH]c(=O)c(F)c2)cc[nH+]1 ZINC001242617978 984001768 /nfs/dbraw/zinc/00/17/68/984001768.db2.gz IQZYFPMJVFTPRU-UHFFFAOYSA-N 1 2 219.219 2.030 20 0 BEADLO Cc1cn2cccc(Nc3cccc(=O)[nH]3)c2[nH+]1 ZINC001212787332 984017593 /nfs/dbraw/zinc/01/75/93/984017593.db2.gz VQEWNTLHSNDRQP-UHFFFAOYSA-N 1 2 240.266 2.487 20 0 BEADLO Cn1c[nH+]cc1-c1ccnc(OC2CC2)c1 ZINC001242723049 984074481 /nfs/dbraw/zinc/07/44/81/984074481.db2.gz SGHBCGNOGQCTSY-UHFFFAOYSA-N 1 2 215.256 2.023 20 0 BEADLO Nc1[nH+]cccc1-c1cc(O)ccc1F ZINC001242763764 984132616 /nfs/dbraw/zinc/13/26/16/984132616.db2.gz ZZMFJCIXQTXMPV-UHFFFAOYSA-N 1 2 204.204 2.176 20 0 BEADLO COCc1cncc(-c2c[nH+]c(N)c(C)c2)c1 ZINC001242954559 984319901 /nfs/dbraw/zinc/31/99/01/984319901.db2.gz SRIMKDFYSMVIFT-UHFFFAOYSA-N 1 2 229.283 2.181 20 0 BEADLO Cc1ccc(-c2cccc(CO)c2C)[nH+]c1N ZINC001243013996 984371673 /nfs/dbraw/zinc/37/16/73/984371673.db2.gz PHSKGKNDTBMVSZ-UHFFFAOYSA-N 1 2 228.295 2.440 20 0 BEADLO COC(=O)[C@@H]([NH3+])c1ccc(-c2ccoc2C)cc1 ZINC001243062899 984446271 /nfs/dbraw/zinc/44/62/71/984446271.db2.gz WWBWXKYFWYEFNR-ZDUSSCGKSA-N 1 2 245.278 2.428 20 0 BEADLO Cn1cncc1-c1cc(N)c(C(F)(F)F)c[nH+]1 ZINC001243065233 984469078 /nfs/dbraw/zinc/46/90/78/984469078.db2.gz OWSDRIVCGYHBSV-UHFFFAOYSA-N 1 2 242.204 2.083 20 0 BEADLO COC(=O)c1ccc(C)c(-c2c[nH+]cn2C)c1C ZINC001243069590 984490059 /nfs/dbraw/zinc/49/00/59/984490059.db2.gz IHEBCXXAVBQSLR-UHFFFAOYSA-N 1 2 244.294 2.491 20 0 BEADLO Cn1c[nH+]cc1-c1ccc2ccc(=O)oc2c1 ZINC001243069353 984490209 /nfs/dbraw/zinc/49/02/09/984490209.db2.gz FXPVJNPLGLNTOB-UHFFFAOYSA-N 1 2 226.235 2.194 20 0 BEADLO Cn1c[nH+]cc1-c1ccnc(OC(F)F)c1 ZINC001243068490 984490486 /nfs/dbraw/zinc/49/04/86/984490486.db2.gz ZONWXZISOGQQJU-UHFFFAOYSA-N 1 2 225.198 2.084 20 0 BEADLO COC(=O)c1c(C)cc(-c2c[nH+]cn2C)cc1F ZINC001243070406 984492330 /nfs/dbraw/zinc/49/23/30/984492330.db2.gz VETXZACCSLFTHU-UHFFFAOYSA-N 1 2 248.257 2.321 20 0 BEADLO COCc1cc(OC)ccc1-c1c[nH+]cn1C ZINC001243072260 984505706 /nfs/dbraw/zinc/50/57/06/984505706.db2.gz NPBKSMDXGJWJPE-UHFFFAOYSA-N 1 2 232.283 2.242 20 0 BEADLO Nc1[nH+]cccc1-c1ccnc2ncccc21 ZINC000718920407 984562899 /nfs/dbraw/zinc/56/28/99/984562899.db2.gz HSWQGCWAYOYZBT-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO CON(C)C(=O)c1cccc(/C(C)=C/C=C/[NH3+])c1 ZINC001243130648 984595785 /nfs/dbraw/zinc/59/57/85/984595785.db2.gz HJOPNSVERLCJFE-MPEOSAONSA-N 1 2 246.310 2.196 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1C(=O)Cc1[nH]c[nH+]c1C ZINC001446877978 984707063 /nfs/dbraw/zinc/70/70/63/984707063.db2.gz IGTRZEQNNWGYJP-MWLCHTKSSA-N 1 2 235.331 2.050 20 0 BEADLO Nc1ccc(F)c(-c2c[nH+]c3c(c2)CCCN3)c1 ZINC001243286345 984814054 /nfs/dbraw/zinc/81/40/54/984814054.db2.gz CKECXAACWGVKBI-UHFFFAOYSA-N 1 2 243.285 2.471 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc(F)c(C(=O)N(C)C)c1 ZINC001243289097 984817770 /nfs/dbraw/zinc/81/77/70/984817770.db2.gz CNBJDFQCNOGFRX-DXNUHORPSA-N 1 2 248.301 2.403 20 0 BEADLO CC(=O)Oc1ccc(-c2ccc(N)[nH+]c2)cc1 ZINC001243361335 984843100 /nfs/dbraw/zinc/84/31/00/984843100.db2.gz FRXKZDKWAKHHGX-UHFFFAOYSA-N 1 2 228.251 2.256 20 0 BEADLO Cc1cn2cc(-c3cc[nH]c(=O)c3)ccc2[nH+]1 ZINC001243425991 984901405 /nfs/dbraw/zinc/90/14/05/984901405.db2.gz ZCGXORXXMWEGIU-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO Cc1cc2[nH+]ccn2cc1-c1cc[nH]c(=O)c1 ZINC001243428889 984932322 /nfs/dbraw/zinc/93/23/22/984932322.db2.gz WMJZVHTWAWNKNS-UHFFFAOYSA-N 1 2 225.251 2.410 20 0 BEADLO CC[C@H](C)[NH2+][C@H](C(=O)OC)[C@@H](C)OC(C)(C)C ZINC001257430117 984998950 /nfs/dbraw/zinc/99/89/50/984998950.db2.gz FJCVMXVKDSYUCS-AXFHLTTASA-N 1 2 245.363 2.120 20 0 BEADLO Cc1cnc(F)cc1-c1ccc[nH+]c1N ZINC001243472309 985016673 /nfs/dbraw/zinc/01/66/73/985016673.db2.gz HXWYIBYVVHNUMU-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO Nc1cnc2c(cccc2-c2ccc[nH+]c2N)c1 ZINC001243473018 985019423 /nfs/dbraw/zinc/01/94/23/985019423.db2.gz DVDLRKDZYSPAPN-UHFFFAOYSA-N 1 2 236.278 2.461 20 0 BEADLO C[C@@H]1c2cc(-c3ccc[nH+]c3N)ccc2NC1=O ZINC001243474105 985022891 /nfs/dbraw/zinc/02/28/91/985022891.db2.gz JVXBYKAHTNWMSF-MRVPVSSYSA-N 1 2 239.278 2.386 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2ccnnc2c1 ZINC001243473399 985024217 /nfs/dbraw/zinc/02/42/17/985024217.db2.gz KQNLQILEZKDPOA-UHFFFAOYSA-N 1 2 222.251 2.274 20 0 BEADLO Nc1[nH+]cccc1-c1cccc2oncc21 ZINC001243474427 985026057 /nfs/dbraw/zinc/02/60/57/985026057.db2.gz MHHJETBNMGKBFR-UHFFFAOYSA-N 1 2 211.224 2.472 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2oc(=O)ccc2c1 ZINC001243474991 985032758 /nfs/dbraw/zinc/03/27/58/985032758.db2.gz VAQDVWXRCKEKCV-UHFFFAOYSA-N 1 2 238.246 2.437 20 0 BEADLO Nc1[nH+]cccc1-c1ccc2c(c1)CCC(=O)N2 ZINC001243474525 985032793 /nfs/dbraw/zinc/03/27/93/985032793.db2.gz NDYVAEJPBQPELH-UHFFFAOYSA-N 1 2 239.278 2.216 20 0 BEADLO COC(=O)c1ccc(C)cc1-c1ccc[nH+]c1N ZINC001243475452 985033663 /nfs/dbraw/zinc/03/36/63/985033663.db2.gz ZSQAHRDZAQCYJD-UHFFFAOYSA-N 1 2 242.278 2.426 20 0 BEADLO Nc1[nH+]cccc1-c1ccnc(OC(F)F)c1 ZINC001243476555 985034316 /nfs/dbraw/zinc/03/43/16/985034316.db2.gz UBESSCIUXXIQFS-UHFFFAOYSA-N 1 2 237.209 2.327 20 0 BEADLO Nc1[nH+]cccc1-c1cccc2cnoc21 ZINC001243476461 985039132 /nfs/dbraw/zinc/03/91/32/985039132.db2.gz BEPWAGWWGXZVLD-UHFFFAOYSA-N 1 2 211.224 2.472 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1ccsc1C ZINC001454683788 985046068 /nfs/dbraw/zinc/04/60/68/985046068.db2.gz LCCTUEIGRBPWFO-SNVBAGLBSA-N 1 2 224.329 2.089 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1ccsc1C ZINC001454683788 985046084 /nfs/dbraw/zinc/04/60/84/985046084.db2.gz LCCTUEIGRBPWFO-SNVBAGLBSA-N 1 2 224.329 2.089 20 0 BEADLO Cc1ccnc(F)c1-c1cc(N)cc[nH+]1 ZINC001243549281 985104756 /nfs/dbraw/zinc/10/47/56/985104756.db2.gz VBEPJCISJDDHFO-UHFFFAOYSA-N 1 2 203.220 2.173 20 0 BEADLO CC=CC=CC(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001456345231 985133754 /nfs/dbraw/zinc/13/37/54/985133754.db2.gz KDWAJXOCWPJMBG-DEQVHDEQSA-N 1 2 233.315 2.282 20 0 BEADLO CC=CC=CC(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001456345231 985133759 /nfs/dbraw/zinc/13/37/59/985133759.db2.gz KDWAJXOCWPJMBG-DEQVHDEQSA-N 1 2 233.315 2.282 20 0 BEADLO Cn1c[nH+]cc1-c1cccc(CO)c1Cl ZINC001243707220 985242571 /nfs/dbraw/zinc/24/25/71/985242571.db2.gz LHFKNTKKLYWPHO-UHFFFAOYSA-N 1 2 222.675 2.233 20 0 BEADLO CCOc1ncc(-c2ccc[nH+]c2N)cc1F ZINC001243773480 985310497 /nfs/dbraw/zinc/31/04/97/985310497.db2.gz AWYGRNJKXVZPJX-UHFFFAOYSA-N 1 2 233.246 2.264 20 0 BEADLO CC(C)[N@H+](Cc1cnsn1)C1CCC1 ZINC000687821315 985399165 /nfs/dbraw/zinc/39/91/65/985399165.db2.gz OJXBCVHHROHHHX-UHFFFAOYSA-N 1 2 211.334 2.301 20 0 BEADLO CC(C)[N@@H+](Cc1cnsn1)C1CCC1 ZINC000687821315 985399185 /nfs/dbraw/zinc/39/91/85/985399185.db2.gz OJXBCVHHROHHHX-UHFFFAOYSA-N 1 2 211.334 2.301 20 0 BEADLO C[C@H]1COC[C@H]1Nc1ccc(N2CCCC2)[nH+]c1 ZINC000687997217 985451524 /nfs/dbraw/zinc/45/15/24/985451524.db2.gz PAFRQLYYKZJERW-WCQYABFASA-N 1 2 247.342 2.129 20 0 BEADLO OCCc1ccc(-c2nc3[nH]ccc3c[nH+]2)cc1 ZINC001243847121 985467791 /nfs/dbraw/zinc/46/77/91/985467791.db2.gz KTQGMYYZPMHVHB-UHFFFAOYSA-N 1 2 239.278 2.111 20 0 BEADLO CCOC(=[NH2+])c1cccc(-c2cnc(N)nc2)c1 ZINC001243875865 985544610 /nfs/dbraw/zinc/54/46/10/985544610.db2.gz RUXKLEWTGACBHL-UHFFFAOYSA-N 1 2 242.282 2.088 20 0 BEADLO Cc1cc(CNc2ccc([NH+](C)C)cc2)nn1C ZINC000688101669 985555312 /nfs/dbraw/zinc/55/53/12/985555312.db2.gz LWDXIJXWZGGVSM-UHFFFAOYSA-N 1 2 244.342 2.407 20 0 BEADLO c1cc(C2CC2)nnc1C1=C[NH2+]CCC1 ZINC001243947194 985623895 /nfs/dbraw/zinc/62/38/95/985623895.db2.gz FGBGOSOJSKUBNI-UHFFFAOYSA-N 1 2 201.273 2.078 20 0 BEADLO c1cnc2c(c1)ccnc2C1=C[NH2+]CCC1 ZINC001243947672 985624827 /nfs/dbraw/zinc/62/48/27/985624827.db2.gz OBMSHDYHHMZELV-UHFFFAOYSA-N 1 2 211.268 2.354 20 0 BEADLO CCCc1cncnc1C1=C[NH2+]CCC1 ZINC001243947884 985628685 /nfs/dbraw/zinc/62/86/85/985628685.db2.gz QMYDNZVMXUGXPO-UHFFFAOYSA-N 1 2 203.289 2.153 20 0 BEADLO C[C@@H]1CCc2nnc(C3=C[NH2+]CCC3)cc2C1 ZINC001243949946 985642601 /nfs/dbraw/zinc/64/26/01/985642601.db2.gz PPXHTTKYYPTMLU-SNVBAGLBSA-N 1 2 229.327 2.326 20 0 BEADLO CCSc1cncc(C2=C[NH2+]CCC2)n1 ZINC001243949756 985645001 /nfs/dbraw/zinc/64/50/01/985645001.db2.gz YDWURCLNBUKWIW-UHFFFAOYSA-N 1 2 221.329 2.313 20 0 BEADLO Cc1oncc1C[N@@H+](C)Cc1ccccn1 ZINC001460155702 985783002 /nfs/dbraw/zinc/78/30/02/985783002.db2.gz BAXHTEXYNUXMLV-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1oncc1C[N@H+](C)Cc1ccccn1 ZINC001460155702 985783024 /nfs/dbraw/zinc/78/30/24/985783024.db2.gz BAXHTEXYNUXMLV-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ccccc1C(F)(F)C[NH2+][C@@H](C)[C@@H](C)O ZINC001327641980 985834604 /nfs/dbraw/zinc/83/46/04/985834604.db2.gz VVLUNNFPRQIXCB-WDEREUQCSA-N 1 2 243.297 2.446 20 0 BEADLO Nc1[nH+]cccc1-c1cc(F)c(F)c(F)c1N ZINC001244166491 985871685 /nfs/dbraw/zinc/87/16/85/985871685.db2.gz UDCDWGSCUIYUTP-UHFFFAOYSA-N 1 2 239.200 2.330 20 0 BEADLO Cc1cc(O)c[nH+]c1Nc1ccc(CCO)cc1 ZINC001212925470 985927020 /nfs/dbraw/zinc/92/70/20/985927020.db2.gz ALRNJWJVHXSWFI-UHFFFAOYSA-N 1 2 244.294 2.374 20 0 BEADLO COC(=O)C1([NH2+][C@@H]2C[C@H](C)CC(C)(C)C2)CC1 ZINC001258685432 986007887 /nfs/dbraw/zinc/00/78/87/986007887.db2.gz MKTUPXCYAXRQGR-WDEREUQCSA-N 1 2 239.359 2.496 20 0 BEADLO CCCn1c[nH+]cc1CNc1cccc(OC)n1 ZINC001461624804 986096142 /nfs/dbraw/zinc/09/61/42/986096142.db2.gz CKMIRYPPKGTCEA-UHFFFAOYSA-N 1 2 246.314 2.309 20 0 BEADLO COCOc1ccc(C)c(-c2c[nH+]cn2C)c1 ZINC001244456084 986131229 /nfs/dbraw/zinc/13/12/29/986131229.db2.gz KROQEWSCHNRODC-UHFFFAOYSA-N 1 2 232.283 2.378 20 0 BEADLO COC(=O)c1cccc(/C(C)=C/C=C/[NH3+])c1F ZINC001244545688 986239865 /nfs/dbraw/zinc/23/98/65/986239865.db2.gz FSFVCOATZQPUKN-KBXRYBNXSA-N 1 2 235.258 2.488 20 0 BEADLO CCc1cc(-c2c[nH+]cn2C)ccc1CO ZINC001244634645 986294061 /nfs/dbraw/zinc/29/40/61/986294061.db2.gz WFIOZOZIEJIMBS-UHFFFAOYSA-N 1 2 216.284 2.142 20 0 BEADLO Cc1cc(CO)cc(C)c1-c1ccc(N)[nH+]c1 ZINC001244693043 986309382 /nfs/dbraw/zinc/30/93/82/986309382.db2.gz KXFJUFMVOSOVJD-UHFFFAOYSA-N 1 2 228.295 2.440 20 0 BEADLO C/C(=C\C=C\[NH3+])c1ccc(CO)c(F)c1F ZINC001244719493 986320555 /nfs/dbraw/zinc/32/05/55/986320555.db2.gz LIOFVKJAVLCVAS-YALUOGEHSA-N 1 2 225.238 2.333 20 0 BEADLO CC(C)[C@@H](O)C[N@@H+]1CCC[C@H](F)C(F)(F)C1 ZINC001253757565 986385027 /nfs/dbraw/zinc/38/50/27/986385027.db2.gz PVUVGWXHQWEMQX-UWVGGRQHSA-N 1 2 239.281 2.073 20 0 BEADLO CC(C)[C@@H](O)C[N@H+]1CCC[C@H](F)C(F)(F)C1 ZINC001253757565 986385036 /nfs/dbraw/zinc/38/50/36/986385036.db2.gz PVUVGWXHQWEMQX-UWVGGRQHSA-N 1 2 239.281 2.073 20 0 BEADLO CC(C)[C@@H]1C[C@H]1[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC001462687644 986503950 /nfs/dbraw/zinc/50/39/50/986503950.db2.gz MVCVCIHAWHDFNK-GARJFASQSA-N 1 2 227.348 2.351 20 0 BEADLO FC1CC[NH+](Cc2cnc(Cl)cn2)CC1 ZINC000689394059 986553116 /nfs/dbraw/zinc/55/31/16/986553116.db2.gz BABRYNSOQNNYAD-UHFFFAOYSA-N 1 2 229.686 2.064 20 0 BEADLO CNc1cc(-c2cnc3[nH]cnc3c2)cc[nH+]1 ZINC001244974467 986559207 /nfs/dbraw/zinc/55/92/07/986559207.db2.gz YFYHRKHKHFBESF-UHFFFAOYSA-N 1 2 225.255 2.062 20 0 BEADLO CNc1cc(-c2ccnc(F)c2)cc[nH+]1 ZINC001244976346 986561555 /nfs/dbraw/zinc/56/15/55/986561555.db2.gz SEFOIOGDNPMEKW-UHFFFAOYSA-N 1 2 203.220 2.324 20 0 BEADLO CCCNc1cc(N2CCC[C@H](F)C2)nc[nH+]1 ZINC000689403087 986561446 /nfs/dbraw/zinc/56/14/46/986561446.db2.gz ZIKFPSGOUFVRHL-JTQLQIEISA-N 1 2 238.310 2.237 20 0 BEADLO CCCNc1cc(N2CCC[C@H](F)C2)[nH+]cn1 ZINC000689403087 986561460 /nfs/dbraw/zinc/56/14/60/986561460.db2.gz ZIKFPSGOUFVRHL-JTQLQIEISA-N 1 2 238.310 2.237 20 0 BEADLO Clc1cc2c(cn1)C[N@@H+]([C@@H]1CCCOC1)C2 ZINC001254386670 986613663 /nfs/dbraw/zinc/61/36/63/986613663.db2.gz BSMAWXXDMXOTOU-LLVKDONJSA-N 1 2 238.718 2.230 20 0 BEADLO Clc1cc2c(cn1)C[N@H+]([C@@H]1CCCOC1)C2 ZINC001254386670 986613674 /nfs/dbraw/zinc/61/36/74/986613674.db2.gz BSMAWXXDMXOTOU-LLVKDONJSA-N 1 2 238.718 2.230 20 0 BEADLO c1ccc2ncc(C[N@@H+]3C[C@@H]4C[C@H]3CO4)cc2c1 ZINC001137282437 986718628 /nfs/dbraw/zinc/71/86/28/986718628.db2.gz ZGEZKKDANNAUDU-KBPBESRZSA-N 1 2 240.306 2.208 20 0 BEADLO c1ccc2ncc(C[N@H+]3C[C@@H]4C[C@H]3CO4)cc2c1 ZINC001137282437 986718636 /nfs/dbraw/zinc/71/86/36/986718636.db2.gz ZGEZKKDANNAUDU-KBPBESRZSA-N 1 2 240.306 2.208 20 0 BEADLO Cc1ccc2ncc(C[N@H+]3C[C@@H](C)[C@@H](F)C3)n2c1 ZINC001137304687 986737474 /nfs/dbraw/zinc/73/74/74/986737474.db2.gz GATHEWFTPAMECU-YPMHNXCESA-N 1 2 247.317 2.433 20 0 BEADLO Cc1ccc2ncc(C[N@@H+]3C[C@@H](C)[C@@H](F)C3)n2c1 ZINC001137304687 986737487 /nfs/dbraw/zinc/73/74/87/986737487.db2.gz GATHEWFTPAMECU-YPMHNXCESA-N 1 2 247.317 2.433 20 0 BEADLO CCCOc1ccc(-c2c[nH+]cn2C)cn1 ZINC001245230777 986758276 /nfs/dbraw/zinc/75/82/76/986758276.db2.gz FQUKHWNAUJZXFE-UHFFFAOYSA-N 1 2 217.272 2.271 20 0 BEADLO CC/C=C(\F)C(=O)NCc1ccn2cc[nH+]c2c1 ZINC001465975876 986762170 /nfs/dbraw/zinc/76/21/70/986762170.db2.gz BZXPTMPDSQAJQS-JYOAFUTRSA-N 1 2 247.273 2.214 20 0 BEADLO CCOc1cc(/C(C)=C/C=C/[NH3+])ccn1 ZINC001245267866 986773329 /nfs/dbraw/zinc/77/33/29/986773329.db2.gz YWCGCHBMIXJWQS-HOZCHFDZSA-N 1 2 204.273 2.356 20 0 BEADLO Fc1ccc2[nH]cc(C[N@@H+]3C[C@@H]4C[C@H]3CO4)c2c1 ZINC001137339853 986806620 /nfs/dbraw/zinc/80/66/20/986806620.db2.gz HAGKWEFALIQOBB-RYUDHWBXSA-N 1 2 246.285 2.280 20 0 BEADLO Fc1ccc2[nH]cc(C[N@H+]3C[C@@H]4C[C@H]3CO4)c2c1 ZINC001137339853 986806624 /nfs/dbraw/zinc/80/66/24/986806624.db2.gz HAGKWEFALIQOBB-RYUDHWBXSA-N 1 2 246.285 2.280 20 0 BEADLO Cc1c(N)c(F)ccc1-c1c[nH+]cn1C ZINC001245459906 986855243 /nfs/dbraw/zinc/85/52/43/986855243.db2.gz PHBHQXLDJVXQSC-UHFFFAOYSA-N 1 2 205.236 2.117 20 0 BEADLO Cn1ncc2cc(-c3ccn4cc[nH+]c4c3)cnc21 ZINC001245473424 986862081 /nfs/dbraw/zinc/86/20/81/986862081.db2.gz XYWXHFLWARGGQE-UHFFFAOYSA-N 1 2 249.277 2.283 20 0 BEADLO C/C(Cl)=C\C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001467760725 986865289 /nfs/dbraw/zinc/86/52/89/986865289.db2.gz JMXOKMLIFHWEIA-SOFGYWHQSA-N 1 2 235.674 2.415 20 0 BEADLO Clc1ncccc1C[N@@H+]1CC[C@]12CCOC2 ZINC001137428368 986893113 /nfs/dbraw/zinc/89/31/13/986893113.db2.gz AJBMWDQDJJPVLI-GFCCVEGCSA-N 1 2 238.718 2.100 20 0 BEADLO Clc1ncccc1C[N@H+]1CC[C@]12CCOC2 ZINC001137428368 986893115 /nfs/dbraw/zinc/89/31/15/986893115.db2.gz AJBMWDQDJJPVLI-GFCCVEGCSA-N 1 2 238.718 2.100 20 0 BEADLO Cc1ccc(-c2c[nH+]c(N)c(C)c2)nc1F ZINC001245535540 986910415 /nfs/dbraw/zinc/91/04/15/986910415.db2.gz BWOPOQQJGUWLER-UHFFFAOYSA-N 1 2 217.247 2.482 20 0 BEADLO Cc1cc(-c2cccc3c2CC(=O)N3)c[nH+]c1N ZINC001245536403 986914004 /nfs/dbraw/zinc/91/40/04/986914004.db2.gz KEOVBMBPGQCIKU-UHFFFAOYSA-N 1 2 239.278 2.134 20 0 BEADLO CCc1cc(-c2c[nH+]c(N)c(C)c2)nc(C)n1 ZINC001245536143 986914066 /nfs/dbraw/zinc/91/40/66/986914066.db2.gz QLEKFEYBZSKBPT-UHFFFAOYSA-N 1 2 228.299 2.300 20 0 BEADLO CCCC[C@@H](C)[N@@H+]1C[C@@H](F)C[C@H]1C(=O)OC ZINC001255324066 986915673 /nfs/dbraw/zinc/91/56/73/986915673.db2.gz YZPMTWKXZZURSA-VWYCJHECSA-N 1 2 231.311 2.151 20 0 BEADLO CCCC[C@@H](C)[N@H+]1C[C@@H](F)C[C@H]1C(=O)OC ZINC001255324066 986915684 /nfs/dbraw/zinc/91/56/84/986915684.db2.gz YZPMTWKXZZURSA-VWYCJHECSA-N 1 2 231.311 2.151 20 0 BEADLO Cc1cc(-c2ccc(F)nc2C)c[nH+]c1N ZINC001245536952 986916108 /nfs/dbraw/zinc/91/61/08/986916108.db2.gz OYIPBQBEXXPJIR-UHFFFAOYSA-N 1 2 217.247 2.482 20 0 BEADLO Cc1cc(-c2cc(OC(C)C)ncn2)c[nH+]c1N ZINC001245536588 986916361 /nfs/dbraw/zinc/91/63/61/986916361.db2.gz UACJNNHVVPZUPA-UHFFFAOYSA-N 1 2 244.298 2.216 20 0 BEADLO Cc1cc(F)nc(-c2c[nH+]c(N)c(C)c2)c1 ZINC001245537609 986917517 /nfs/dbraw/zinc/91/75/17/986917517.db2.gz SGYYLODOJWCZPG-UHFFFAOYSA-N 1 2 217.247 2.482 20 0 BEADLO COc1cccc(N)c1-c1c[nH+]c(N)c(C)c1 ZINC001245538379 986919020 /nfs/dbraw/zinc/91/90/20/986919020.db2.gz DCBBFVPUFSCIAF-UHFFFAOYSA-N 1 2 229.283 2.230 20 0 BEADLO Cc1cc(-c2ccn(C(C)C)c(=O)c2)c[nH+]c1N ZINC001245538354 986921467 /nfs/dbraw/zinc/92/14/67/986921467.db2.gz CNQWWWHYAUDOJK-UHFFFAOYSA-N 1 2 243.310 2.382 20 0 BEADLO Fc1nc(Cl)ccc1C[N@@H+]1C[C@@H]2C[C@@H]2C1 ZINC001137472413 986923426 /nfs/dbraw/zinc/92/34/26/986923426.db2.gz ZGHJVPGXQLNUQC-DTORHVGOSA-N 1 2 226.682 2.326 20 0 BEADLO Fc1nc(Cl)ccc1C[N@H+]1C[C@@H]2C[C@@H]2C1 ZINC001137472413 986923433 /nfs/dbraw/zinc/92/34/33/986923433.db2.gz ZGHJVPGXQLNUQC-DTORHVGOSA-N 1 2 226.682 2.326 20 0 BEADLO Cc1cc(-c2cccc3c2COC3=O)c[nH+]c1N ZINC001245539519 986925602 /nfs/dbraw/zinc/92/56/02/986925602.db2.gz VKTROEIQROUKNS-UHFFFAOYSA-N 1 2 240.262 2.310 20 0 BEADLO COc1ccc(-c2c[nH+]c(N)c(C)c2)nc1C ZINC001245539596 986926906 /nfs/dbraw/zinc/92/69/06/986926906.db2.gz HASAPAMLXRHNSU-UHFFFAOYSA-N 1 2 229.283 2.351 20 0 BEADLO CSc1cnc(-c2c[nH+]c(N)c(C)c2)cn1 ZINC001245539791 986928239 /nfs/dbraw/zinc/92/82/39/986928239.db2.gz ZBHJLCUYOIQWSV-UHFFFAOYSA-N 1 2 232.312 2.151 20 0 BEADLO Cc1nc2cc(-c3c[nH+]c(N)c(C)c3)cnc2o1 ZINC001245541693 986929942 /nfs/dbraw/zinc/92/99/42/986929942.db2.gz VVVVRZOWBPZEJO-UHFFFAOYSA-N 1 2 240.266 2.484 20 0 BEADLO [NH3+]Cc1cnccc1-c1ccc(S)cc1 ZINC001245557740 986946260 /nfs/dbraw/zinc/94/62/60/986946260.db2.gz JHNJXOXKFBFENA-UHFFFAOYSA-N 1 2 216.309 2.496 20 0 BEADLO CCOC1C[NH+]([C@@H](C)CC(F)(F)F)C1 ZINC001255645964 987044376 /nfs/dbraw/zinc/04/43/76/987044376.db2.gz KGCIVDUILWBACG-ZETCQYMHSA-N 1 2 211.227 2.048 20 0 BEADLO COC1C[NH+]([C@@H](C)Cc2ccccc2F)C1 ZINC001255841807 987073545 /nfs/dbraw/zinc/07/35/45/987073545.db2.gz KNMWQIMTIOVAHK-JTQLQIEISA-N 1 2 223.291 2.087 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@@H]2CCCC2(C)C)c[nH+]1 ZINC001472021446 987156811 /nfs/dbraw/zinc/15/68/11/987156811.db2.gz WJPVQBAKRKRFKG-NSHDSACASA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@@H]2CCCC2(C)C)[nH+]1 ZINC001472021446 987156830 /nfs/dbraw/zinc/15/68/30/987156830.db2.gz WJPVQBAKRKRFKG-NSHDSACASA-N 1 2 249.358 2.415 20 0 BEADLO C1=CCN(c2nc3ccccc3n3c[nH+]cc23)C1 ZINC001472801727 987283756 /nfs/dbraw/zinc/28/37/56/987283756.db2.gz FYTKJRJRUVWIOV-UHFFFAOYSA-N 1 2 236.278 2.259 20 0 BEADLO Cc1c[nH]c(C[NH2+][C@@H](C)c2cncs2)n1 ZINC000693484874 987310515 /nfs/dbraw/zinc/31/05/15/987310515.db2.gz JVFQXDPMNDGBGU-QMMMGPOBSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1ccc(C[C@H](C)[N@H+](C)Cc2nnc[nH]2)cc1 ZINC001473177312 987356603 /nfs/dbraw/zinc/35/66/03/987356603.db2.gz BTSRHGMZTNOJDW-LBPRGKRZSA-N 1 2 244.342 2.176 20 0 BEADLO Cc1ccc(C[C@H](C)[N@@H+](C)Cc2nnc[nH]2)cc1 ZINC001473177312 987356612 /nfs/dbraw/zinc/35/66/12/987356612.db2.gz BTSRHGMZTNOJDW-LBPRGKRZSA-N 1 2 244.342 2.176 20 0 BEADLO CCC1C[NH+](Cc2ccsc2C(=O)OC)C1 ZINC000697888731 987365395 /nfs/dbraw/zinc/36/53/95/987365395.db2.gz KBXSDNNXERFBDQ-UHFFFAOYSA-N 1 2 239.340 2.377 20 0 BEADLO CS[C@H]1CC[C@@H](Nc2cc[nH+]cc2F)C1 ZINC000699602460 987376811 /nfs/dbraw/zinc/37/68/11/987376811.db2.gz VLHLAHFQDNZGAW-BDAKNGLRSA-N 1 2 226.320 2.339 20 0 BEADLO Oc1ccc(Cl)c(Cn2cc[nH+]c2)c1 ZINC001473232920 987380311 /nfs/dbraw/zinc/38/03/11/987380311.db2.gz VTPPOGRFZBDKGS-UHFFFAOYSA-N 1 2 208.648 2.290 20 0 BEADLO C[C@@H](C(=O)NC1C[C@H](C)C[C@@H](C)C1)n1cc[nH+]c1 ZINC001116115612 987446330 /nfs/dbraw/zinc/44/63/30/987446330.db2.gz OHCGCSFWRJJZRG-UTUOFQBUSA-N 1 2 249.358 2.385 20 0 BEADLO C[C@@H](C(=O)N1C[C@H](C)CCC[C@@H]1C)n1cc[nH+]c1 ZINC001116120526 987447399 /nfs/dbraw/zinc/44/73/99/987447399.db2.gz FOEXMVYFVKNCBS-AGIUHOORSA-N 1 2 249.358 2.481 20 0 BEADLO CO[C@H]1CC[N@H+](Cc2ncc(C(C)C)o2)C1 ZINC001116219032 987487054 /nfs/dbraw/zinc/48/70/54/987487054.db2.gz XKRBKPNLYFGSTG-JTQLQIEISA-N 1 2 224.304 2.019 20 0 BEADLO CO[C@H]1CC[N@@H+](Cc2ncc(C(C)C)o2)C1 ZINC001116219032 987487060 /nfs/dbraw/zinc/48/70/60/987487060.db2.gz XKRBKPNLYFGSTG-JTQLQIEISA-N 1 2 224.304 2.019 20 0 BEADLO CSCC[C@H](C)[N@H+](C)Cc1cc(C)[nH]n1 ZINC001116445227 987581441 /nfs/dbraw/zinc/58/14/41/987581441.db2.gz IQARCOOVQMFDLT-JTQLQIEISA-N 1 2 227.377 2.292 20 0 BEADLO CSCC[C@H](C)[N@@H+](C)Cc1cc(C)[nH]n1 ZINC001116445227 987581452 /nfs/dbraw/zinc/58/14/52/987581452.db2.gz IQARCOOVQMFDLT-JTQLQIEISA-N 1 2 227.377 2.292 20 0 BEADLO CC[N@@H+](Cc1ccccc1F)CC1OCCO1 ZINC001116486904 987601059 /nfs/dbraw/zinc/60/10/59/987601059.db2.gz RUEOYRURWYNKQT-UHFFFAOYSA-N 1 2 239.290 2.021 20 0 BEADLO CC[N@H+](Cc1ccccc1F)CC1OCCO1 ZINC001116486904 987601066 /nfs/dbraw/zinc/60/10/66/987601066.db2.gz RUEOYRURWYNKQT-UHFFFAOYSA-N 1 2 239.290 2.021 20 0 BEADLO CC1(C)CCC(N[C@H]2C[NH2+]CC[C@H]2F)CC1 ZINC001246219093 987617232 /nfs/dbraw/zinc/61/72/32/987617232.db2.gz XESRPQSZCMHTQR-NEPJUHHUSA-N 1 2 228.355 2.245 20 0 BEADLO CC1(C)CCC([NH2+][C@H]2CNCC[C@H]2F)CC1 ZINC001246219093 987617234 /nfs/dbraw/zinc/61/72/34/987617234.db2.gz XESRPQSZCMHTQR-NEPJUHHUSA-N 1 2 228.355 2.245 20 0 BEADLO Cc1nnc(C[NH2+][C@@H](c2cccnc2)C2CC2)o1 ZINC001116555748 987625800 /nfs/dbraw/zinc/62/58/00/987625800.db2.gz VADBTWIUDMQILA-CYBMUJFWSA-N 1 2 244.298 2.014 20 0 BEADLO OCc1cc[nH+]c(NCc2ccncc2Cl)c1 ZINC001474188408 987659576 /nfs/dbraw/zinc/65/95/76/987659576.db2.gz MLLZVMJIMDAODG-UHFFFAOYSA-N 1 2 249.701 2.234 20 0 BEADLO Cc1cc(C[N@@H+]2CCS[C@H](C)CC2)n[nH]1 ZINC001116762318 987699449 /nfs/dbraw/zinc/69/94/49/987699449.db2.gz KDESQNMPTKJEMG-SNVBAGLBSA-N 1 2 225.361 2.046 20 0 BEADLO Cc1cc(C[N@H+]2CCS[C@H](C)CC2)n[nH]1 ZINC001116762318 987699453 /nfs/dbraw/zinc/69/94/53/987699453.db2.gz KDESQNMPTKJEMG-SNVBAGLBSA-N 1 2 225.361 2.046 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@@H](C)Cc1ccc(C)cc1 ZINC001116776164 987703453 /nfs/dbraw/zinc/70/34/53/987703453.db2.gz VJKWGUQYTSBGCD-STQMWFEESA-N 1 2 249.354 2.467 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+][C@H](C)Cc1ccc(C)cc1 ZINC001116776161 987704097 /nfs/dbraw/zinc/70/40/97/987704097.db2.gz VJKWGUQYTSBGCD-CHWSQXEVSA-N 1 2 249.354 2.467 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@H](C)Cc1ccc(C)cc1 ZINC001116776162 987705093 /nfs/dbraw/zinc/70/50/93/987705093.db2.gz VJKWGUQYTSBGCD-OLZOCXBDSA-N 1 2 249.354 2.467 20 0 BEADLO C[C@H](C(=O)NCC1C(C)(C)C1(C)C)n1cc[nH+]c1 ZINC001116886957 987749250 /nfs/dbraw/zinc/74/92/50/987749250.db2.gz MOERTOPCYJTJPC-SNVBAGLBSA-N 1 2 249.358 2.243 20 0 BEADLO COc1cc(C[NH+]2CC3(CCC3)C2)sn1 ZINC001474568696 987756311 /nfs/dbraw/zinc/75/63/11/987756311.db2.gz INENDEKKTGCUBR-UHFFFAOYSA-N 1 2 224.329 2.138 20 0 BEADLO c1[nH+]cc(N[C@@H]2C[C@@H]3COC[C@H]23)c2c1CCCC2 ZINC001474624208 987784395 /nfs/dbraw/zinc/78/43/95/987784395.db2.gz NPWSAJRTOGNPQQ-KWCYVHTRSA-N 1 2 244.338 2.407 20 0 BEADLO CCCC[C@@H](CC)N[C@H]1C[NH2+]CC1(F)F ZINC001246457062 987812030 /nfs/dbraw/zinc/81/20/30/987812030.db2.gz CBZBBHSOSQNLQN-ZJUUUORDSA-N 1 2 220.307 2.152 20 0 BEADLO CCCC[C@@H](CC)[NH2+][C@H]1CNCC1(F)F ZINC001246457062 987812031 /nfs/dbraw/zinc/81/20/31/987812031.db2.gz CBZBBHSOSQNLQN-ZJUUUORDSA-N 1 2 220.307 2.152 20 0 BEADLO Cc1cc(C[N@@H+]2CC(C)(C)[C@H]2C2CC2)n[nH]1 ZINC001117641929 987848915 /nfs/dbraw/zinc/84/89/15/987848915.db2.gz OZFVSMPPDCOHQL-GFCCVEGCSA-N 1 2 219.332 2.339 20 0 BEADLO Cc1cc(C[N@H+]2CC(C)(C)[C@H]2C2CC2)n[nH]1 ZINC001117641929 987848920 /nfs/dbraw/zinc/84/89/20/987848920.db2.gz OZFVSMPPDCOHQL-GFCCVEGCSA-N 1 2 219.332 2.339 20 0 BEADLO CCC(C)(C)N(C)C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001321481858 987919554 /nfs/dbraw/zinc/91/95/54/987919554.db2.gz GCVKNWRTIRCQFP-SNVBAGLBSA-N 1 2 223.320 2.091 20 0 BEADLO C[C@@H](C(=O)N1CC[C@@H](C)C[C@H]1C)n1cc[nH+]c1 ZINC001118154592 988058064 /nfs/dbraw/zinc/05/80/64/988058064.db2.gz ZHUOHGKMDIVRQZ-UTUOFQBUSA-N 1 2 235.331 2.091 20 0 BEADLO CC/C=C\CC[NH+]1CC(NC(=O)c2ccco2)C1 ZINC001494333144 988124338 /nfs/dbraw/zinc/12/43/38/988124338.db2.gz JYJQQPDFQUYLKY-ARJAWSKDSA-N 1 2 248.326 2.050 20 0 BEADLO CC[C@H](C)CC(=O)NC1C[NH+](CC=C(C)C)C1 ZINC001494377053 988137547 /nfs/dbraw/zinc/13/75/47/988137547.db2.gz HCUUAFNTCFBGOL-LBPRGKRZSA-N 1 2 238.375 2.189 20 0 BEADLO C[C@@H](C(=O)N1CCCC(C)(C)CC1)n1cc[nH+]c1 ZINC001322143778 988143725 /nfs/dbraw/zinc/14/37/25/988143725.db2.gz FEIUTVOJBTVKIP-LBPRGKRZSA-N 1 2 249.358 2.483 20 0 BEADLO CCCC1CCN(C(=O)[C@H](C)n2cc[nH+]c2)CC1 ZINC001322254830 988177277 /nfs/dbraw/zinc/17/72/77/988177277.db2.gz JTWWJYOGJKNWKY-LBPRGKRZSA-N 1 2 249.358 2.483 20 0 BEADLO C[C@@H](c1ccsc1)c1nnc(C[NH+](C)C)o1 ZINC001322401665 988250327 /nfs/dbraw/zinc/25/03/27/988250327.db2.gz VQNNJLZCGOYJHF-QMMMGPOBSA-N 1 2 237.328 2.345 20 0 BEADLO C[NH+](C)Cc1nnc(CCc2ccccc2F)o1 ZINC001322401064 988251974 /nfs/dbraw/zinc/25/19/74/988251974.db2.gz LCIGJCGENCQKJX-UHFFFAOYSA-N 1 2 249.289 2.056 20 0 BEADLO CC[C@@H](Cc1ccccc1)[N@H+](C)Cc1nnc[nH]1 ZINC001118557125 988438067 /nfs/dbraw/zinc/43/80/67/988438067.db2.gz NPJKNZBESHHHKM-ZDUSSCGKSA-N 1 2 244.342 2.258 20 0 BEADLO CC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1nnc[nH]1 ZINC001118557125 988438076 /nfs/dbraw/zinc/43/80/76/988438076.db2.gz NPJKNZBESHHHKM-ZDUSSCGKSA-N 1 2 244.342 2.258 20 0 BEADLO Cc1cc(NC(=O)[C@@H](C)C(F)(F)F)cc(C)[nH+]1 ZINC001323080545 988444365 /nfs/dbraw/zinc/44/43/65/988444365.db2.gz VBTGPSJPQNTZKU-MRVPVSSYSA-N 1 2 246.232 2.257 20 0 BEADLO C[C@H](C(=O)N1CCC[C@H]1C(C)(C)C)n1cc[nH+]c1 ZINC001323203623 988472366 /nfs/dbraw/zinc/47/23/66/988472366.db2.gz CXGWJHCUSSRXJF-NEPJUHHUSA-N 1 2 249.358 2.481 20 0 BEADLO CCOC(=O)[C@H]([NH2+]CCc1ccccc1)C1CC1 ZINC001323616992 988571184 /nfs/dbraw/zinc/57/11/84/988571184.db2.gz RTNLEWRNOMIHKN-CQSZACIVSA-N 1 2 247.338 2.160 20 0 BEADLO C[NH+](C)Cc1nnc(C=C2CCCCC2)o1 ZINC001324177736 988743753 /nfs/dbraw/zinc/74/37/53/988743753.db2.gz HEDCJXMVINGRFP-UHFFFAOYSA-N 1 2 221.304 2.479 20 0 BEADLO C[C@H]1COCC[N@@H+]1CCc1ccc(F)cc1F ZINC001324428806 988836499 /nfs/dbraw/zinc/83/64/99/988836499.db2.gz LTPXWUBUAIRLPK-JTQLQIEISA-N 1 2 241.281 2.228 20 0 BEADLO C[C@H]1COCC[N@H+]1CCc1ccc(F)cc1F ZINC001324428806 988836503 /nfs/dbraw/zinc/83/65/03/988836503.db2.gz LTPXWUBUAIRLPK-JTQLQIEISA-N 1 2 241.281 2.228 20 0 BEADLO Fc1ccccc1-c1noc(Cc2c[nH]c[nH+]2)n1 ZINC001247138053 988851381 /nfs/dbraw/zinc/85/13/81/988851381.db2.gz OZQGZMKWIHVXIH-UHFFFAOYSA-N 1 2 244.229 2.190 20 0 BEADLO C[N@H+](Cc1cccn1C1CC1)Cc1cnccn1 ZINC001324645640 988908348 /nfs/dbraw/zinc/90/83/48/988908348.db2.gz INOXGXSDTMMHME-UHFFFAOYSA-N 1 2 242.326 2.245 20 0 BEADLO C[N@@H+](Cc1cccn1C1CC1)Cc1cnccn1 ZINC001324645640 988908359 /nfs/dbraw/zinc/90/83/59/988908359.db2.gz INOXGXSDTMMHME-UHFFFAOYSA-N 1 2 242.326 2.245 20 0 BEADLO CC(C)C[C@H]1CCN(C(=O)[C@H](C)n2cc[nH+]c2)C1 ZINC001324675554 988924096 /nfs/dbraw/zinc/92/40/96/988924096.db2.gz AIEGKEOVTAVYNL-QWHCGFSZSA-N 1 2 249.358 2.339 20 0 BEADLO Cc1cc(C)c(CNC(=O)NC2(C)CC2)c[nH+]1 ZINC001324700383 988939203 /nfs/dbraw/zinc/93/92/03/988939203.db2.gz KSHXHLRSSGUZTM-UHFFFAOYSA-N 1 2 233.315 2.050 20 0 BEADLO CC1(C)C[N@H+](Cc2cnns2)C1(C)C ZINC001324716308 988945129 /nfs/dbraw/zinc/94/51/29/988945129.db2.gz MAVWIFWPZNOOAH-UHFFFAOYSA-N 1 2 211.334 2.159 20 0 BEADLO CC1(C)C[N@@H+](Cc2cnns2)C1(C)C ZINC001324716308 988945140 /nfs/dbraw/zinc/94/51/40/988945140.db2.gz MAVWIFWPZNOOAH-UHFFFAOYSA-N 1 2 211.334 2.159 20 0 BEADLO c1[nH+]cn2ccnc(N3CCC[C@H]3C3CC3)c12 ZINC001515445470 989045979 /nfs/dbraw/zinc/04/59/79/989045979.db2.gz UKZLZSKWFVYOGT-NSHDSACASA-N 1 2 228.299 2.108 20 0 BEADLO C[C@@H]1COCC[N@@H+]1Cc1cccn1C1CC1 ZINC001325126920 989094169 /nfs/dbraw/zinc/09/41/69/989094169.db2.gz BJGRUFSPMYJVCZ-LLVKDONJSA-N 1 2 220.316 2.044 20 0 BEADLO C[C@@H]1COCC[N@H+]1Cc1cccn1C1CC1 ZINC001325126920 989094173 /nfs/dbraw/zinc/09/41/73/989094173.db2.gz BJGRUFSPMYJVCZ-LLVKDONJSA-N 1 2 220.316 2.044 20 0 BEADLO Cc1noc2ccc(C[N@H+]3CCOC[C@H]3C)cc12 ZINC001248689892 989123997 /nfs/dbraw/zinc/12/39/97/989123997.db2.gz GFJICAUVUSWIFG-SNVBAGLBSA-N 1 2 246.310 2.357 20 0 BEADLO Cc1noc2ccc(C[N@@H+]3CCOC[C@H]3C)cc12 ZINC001248689892 989124001 /nfs/dbraw/zinc/12/40/01/989124001.db2.gz GFJICAUVUSWIFG-SNVBAGLBSA-N 1 2 246.310 2.357 20 0 BEADLO COc1ccc(C[NH+]2CC=CC2)c(F)c1OC ZINC001248753381 989143787 /nfs/dbraw/zinc/14/37/87/989143787.db2.gz DFHMBKWWADSRSR-UHFFFAOYSA-N 1 2 237.274 2.215 20 0 BEADLO C[C@H]1CC[N@@H+]1Cc1ccc(Br)n1C ZINC001248773219 989144496 /nfs/dbraw/zinc/14/44/96/989144496.db2.gz CRFRATXEDHAWQX-QMMMGPOBSA-N 1 2 243.148 2.382 20 0 BEADLO C[C@H]1CC[N@H+]1Cc1ccc(Br)n1C ZINC001248773219 989144504 /nfs/dbraw/zinc/14/45/04/989144504.db2.gz CRFRATXEDHAWQX-QMMMGPOBSA-N 1 2 243.148 2.382 20 0 BEADLO Cn1c(Br)ccc1C[N@H+](C)CCF ZINC001248778135 989146502 /nfs/dbraw/zinc/14/65/02/989146502.db2.gz MUIJBEYYDIXZGR-UHFFFAOYSA-N 1 2 249.127 2.189 20 0 BEADLO Cn1c(Br)ccc1C[N@@H+](C)CCF ZINC001248778135 989146519 /nfs/dbraw/zinc/14/65/19/989146519.db2.gz MUIJBEYYDIXZGR-UHFFFAOYSA-N 1 2 249.127 2.189 20 0 BEADLO CN(C)c1cc(CSCC(C)(C)O)cc[nH+]1 ZINC001325299552 989151461 /nfs/dbraw/zinc/15/14/61/989151461.db2.gz ARGCHRSKINTLSW-UHFFFAOYSA-N 1 2 240.372 2.152 20 0 BEADLO CC[C@H](NC(=O)[C@H](C)n1cc[nH+]c1)[C@H]1CC1(C)C ZINC001325341432 989165171 /nfs/dbraw/zinc/16/51/71/989165171.db2.gz GXXXJZAHJIVDGK-TUAOUCFPSA-N 1 2 249.358 2.385 20 0 BEADLO CC[C@H](NC(=O)[C@H](C)n1cc[nH+]c1)[C@@H]1CC1(C)C ZINC001325341430 989167946 /nfs/dbraw/zinc/16/79/46/989167946.db2.gz GXXXJZAHJIVDGK-SRVKXCTJSA-N 1 2 249.358 2.385 20 0 BEADLO CC1(C)C[N@H+](Cc2ccc3n2CCC3)CCC1=O ZINC001248823759 989172715 /nfs/dbraw/zinc/17/27/15/989172715.db2.gz KPKKSOXEEZTRDH-UHFFFAOYSA-N 1 2 246.354 2.235 20 0 BEADLO CC1(C)C[N@@H+](Cc2ccc3n2CCC3)CCC1=O ZINC001248823759 989172719 /nfs/dbraw/zinc/17/27/19/989172719.db2.gz KPKKSOXEEZTRDH-UHFFFAOYSA-N 1 2 246.354 2.235 20 0 BEADLO C(=C\C1CC1)\CNc1cc(NC2CC2)[nH+]cn1 ZINC001325562840 989210269 /nfs/dbraw/zinc/21/02/69/989210269.db2.gz CIROTBKTUOFECN-UPHRSURJSA-N 1 2 230.315 2.429 20 0 BEADLO C(=C\C1CC1)\CNc1cc(NC2CC2)nc[nH+]1 ZINC001325562840 989210279 /nfs/dbraw/zinc/21/02/79/989210279.db2.gz CIROTBKTUOFECN-UPHRSURJSA-N 1 2 230.315 2.429 20 0 BEADLO Cc1cc(C)nc(C[NH+]2CC3(CCC3)C2)n1 ZINC001248939773 989227448 /nfs/dbraw/zinc/22/74/48/989227448.db2.gz LBBUJDQRKPDKJA-UHFFFAOYSA-N 1 2 217.316 2.079 20 0 BEADLO COc1ccc2nc(C[N@@H+]3CC[C@@H](C)C3)[nH]c2c1 ZINC001249412095 989274193 /nfs/dbraw/zinc/27/41/93/989274193.db2.gz UKMVIYDFKAELPA-SNVBAGLBSA-N 1 2 245.326 2.413 20 0 BEADLO COc1ccc2nc(C[N@H+]3CC[C@@H](C)C3)[nH]c2c1 ZINC001249412095 989274204 /nfs/dbraw/zinc/27/42/04/989274204.db2.gz UKMVIYDFKAELPA-SNVBAGLBSA-N 1 2 245.326 2.413 20 0 BEADLO Cc1cc(C[N@H+]2[C@@H]3CC[C@H]2CC(=O)C3)ns1 ZINC001249567675 989307499 /nfs/dbraw/zinc/30/74/99/989307499.db2.gz HMTIHLOJHLDKIM-PHIMTYICSA-N 1 2 236.340 2.147 20 0 BEADLO Cc1cc(C[N@@H+]2[C@@H]3CC[C@H]2CC(=O)C3)ns1 ZINC001249567675 989307510 /nfs/dbraw/zinc/30/75/10/989307510.db2.gz HMTIHLOJHLDKIM-PHIMTYICSA-N 1 2 236.340 2.147 20 0 BEADLO CC(=O)C1CC[NH+](Cc2cc(C)sn2)CC1 ZINC001249581468 989309176 /nfs/dbraw/zinc/30/91/76/989309176.db2.gz ILLSQUDIKPJGPK-UHFFFAOYSA-N 1 2 238.356 2.253 20 0 BEADLO FC(F)(F)c1c[nH+]ccc1Nc1ccno1 ZINC001249582778 989317557 /nfs/dbraw/zinc/31/75/57/989317557.db2.gz FVOQNYZMUIZMQI-UHFFFAOYSA-N 1 2 229.161 2.254 20 0 BEADLO COC(=O)c1cc(F)ccc1C[NH+]1CC(C)C1 ZINC001249601060 989321655 /nfs/dbraw/zinc/32/16/55/989321655.db2.gz XXPGSHSVNOWMFD-UHFFFAOYSA-N 1 2 237.274 2.064 20 0 BEADLO CCn1c[nH+]cc1COC(=O)C=C1CCCC1 ZINC001520439881 989561270 /nfs/dbraw/zinc/56/12/70/989561270.db2.gz AQJGNWACDJCRJU-UHFFFAOYSA-N 1 2 234.299 2.447 20 0 BEADLO C[C@H](c1ccccc1)[C@@H](O)C[NH2+]CC(F)F ZINC001120583879 989757915 /nfs/dbraw/zinc/75/79/15/989757915.db2.gz ZSKTURGXNCXXNY-KOLCDFICSA-N 1 2 229.270 2.006 20 0 BEADLO CC1CCC(C)(C(=O)NCc2c[nH+]cn2C)CC1 ZINC001120678280 989827743 /nfs/dbraw/zinc/82/77/43/989827743.db2.gz BPPFXYMJWTZXNZ-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO CCC[C@H]1CCCN1C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC001120712756 989843212 /nfs/dbraw/zinc/84/32/12/989843212.db2.gz SUESBZDIXOHWNV-AAEUAGOBSA-N 1 2 249.358 2.379 20 0 BEADLO CCC[C@H]1CCCN1C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC001120712756 989843213 /nfs/dbraw/zinc/84/32/13/989843213.db2.gz SUESBZDIXOHWNV-AAEUAGOBSA-N 1 2 249.358 2.379 20 0 BEADLO Fc1cccc(N2CCC(c3c[nH]c[nH+]3)CC2)n1 ZINC001120820673 989903391 /nfs/dbraw/zinc/90/33/91/989903391.db2.gz FAVNBQPPBPJLJL-UHFFFAOYSA-N 1 2 246.289 2.328 20 0 BEADLO Cc1cc(F)cc(N2CCC3(CCO3)CC2)[nH+]1 ZINC001120844464 989918785 /nfs/dbraw/zinc/91/87/85/989918785.db2.gz FJXZHZVDTJESAH-UHFFFAOYSA-N 1 2 236.290 2.288 20 0 BEADLO CCc1ccc(N2CC[C@@H](C)[C@@H](CO)C2)[nH+]c1 ZINC001120867317 989934289 /nfs/dbraw/zinc/93/42/89/989934289.db2.gz GHRBPVUMKQRPOH-DGCLKSJQSA-N 1 2 234.343 2.099 20 0 BEADLO CCc1ccc(N2CCC[C@@H](OC)C2)[nH+]c1 ZINC001120897227 989956086 /nfs/dbraw/zinc/95/60/86/989956086.db2.gz UBWKAVOSQRBSNO-GFCCVEGCSA-N 1 2 220.316 2.259 20 0 BEADLO CCNc1ccc(Nc2ncc(C)cn2)c[nH+]1 ZINC001120950816 989983106 /nfs/dbraw/zinc/98/31/06/989983106.db2.gz QOCVPMDDNWNDFJ-UHFFFAOYSA-N 1 2 229.287 2.355 20 0 BEADLO Cc1cc(N[C@@H](CO)C(C)C)nc(C2CC2)[nH+]1 ZINC001120966427 989988928 /nfs/dbraw/zinc/98/89/28/989988928.db2.gz CBOXQWCOAXMEHA-NSHDSACASA-N 1 2 235.331 2.091 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H]1CCC[C@H]2C[C@H]21 ZINC001121138536 990023743 /nfs/dbraw/zinc/02/37/43/990023743.db2.gz COBJHDQPUJNBQY-YNEHKIRRSA-N 1 2 244.338 2.495 20 0 BEADLO CC(C)=CC(=O)N1CCC(c2c[nH+]cn2C)CC1 ZINC001121218780 990047871 /nfs/dbraw/zinc/04/78/71/990047871.db2.gz RWIDPKKIMKGNPS-UHFFFAOYSA-N 1 2 247.342 2.092 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H]1C[C@@H]1[C@H]1C[C@H]1C ZINC001121231223 990054613 /nfs/dbraw/zinc/05/46/13/990054613.db2.gz JOGLEDQJZREQOA-GHORINQJSA-N 1 2 244.338 2.351 20 0 BEADLO Cn1cc[nH+]c1CCCOC(=O)C1(C)CC=CC1 ZINC001122955715 990470056 /nfs/dbraw/zinc/47/00/56/990470056.db2.gz FQBBXBZNGQJEIQ-UHFFFAOYSA-N 1 2 248.326 2.252 20 0 BEADLO CCC/C=C\C(=O)OCCCc1c[nH+]cn1C ZINC001122973416 990477788 /nfs/dbraw/zinc/47/77/88/990477788.db2.gz FMFSHHJTRRSGDB-YVMONPNESA-N 1 2 236.315 2.252 20 0 BEADLO Cc1cc(NC(=O)c2ccc(F)s2)cc[nH+]1 ZINC001537535803 990505889 /nfs/dbraw/zinc/50/58/89/990505889.db2.gz WNXZOVQUVCRDDJ-UHFFFAOYSA-N 1 2 236.271 2.265 20 0 BEADLO C[C@@H](CC(=O)Nc1cccc(O)c1)n1cc[nH+]c1 ZINC001538627506 990537402 /nfs/dbraw/zinc/53/74/02/990537402.db2.gz OFBDRIKMVYHDNB-JTQLQIEISA-N 1 2 245.282 2.179 20 0 BEADLO Cc1[nH]c2ccc(NC(=O)[C@H]3C[C@@H]3F)cc2[nH+]1 ZINC001123748975 990659460 /nfs/dbraw/zinc/65/94/60/990659460.db2.gz RRYXZLGGEYHAJP-IUCAKERBSA-N 1 2 233.246 2.168 20 0 BEADLO Cc1[nH]c2ccc(NC(=O)[C@H]3C[C@H]3F)cc2[nH+]1 ZINC001123748974 990660437 /nfs/dbraw/zinc/66/04/37/990660437.db2.gz RRYXZLGGEYHAJP-DTWKUNHWSA-N 1 2 233.246 2.168 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CC[C@@H](C)C(C)(C)C1 ZINC001556134453 990806911 /nfs/dbraw/zinc/80/69/11/990806911.db2.gz OERBPHFTDVFWPD-SNVBAGLBSA-N 1 2 249.358 2.155 20 0 BEADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)[C@@H]1C[C@H]1F ZINC001125150853 990817354 /nfs/dbraw/zinc/81/73/54/990817354.db2.gz IDMUDTSBWVPCKJ-VXGBXAGGSA-N 1 2 245.257 2.169 20 0 BEADLO Cc1cccc(C[N@@H+]2CCOC3(CC3)C2)c1F ZINC001137680322 990840080 /nfs/dbraw/zinc/84/00/80/990840080.db2.gz XLOWYMPKLVHSAP-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1cccc(C[N@H+]2CCOC3(CC3)C2)c1F ZINC001137680322 990840081 /nfs/dbraw/zinc/84/00/81/990840081.db2.gz XLOWYMPKLVHSAP-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Brc1cnccc1C[NH+]1CC=CC1 ZINC001137688334 990841444 /nfs/dbraw/zinc/84/14/44/990841444.db2.gz SOADFIFVDMCDRY-UHFFFAOYSA-N 1 2 239.116 2.216 20 0 BEADLO CO[C@H](C)C1C[NH+](Cc2scnc2Cl)C1 ZINC001137824931 990853772 /nfs/dbraw/zinc/85/37/72/990853772.db2.gz PUEBNOQREFBVTF-SSDOTTSWSA-N 1 2 246.763 2.263 20 0 BEADLO CCC(=O)N1CCC[C@@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001558351370 990941988 /nfs/dbraw/zinc/94/19/88/990941988.db2.gz KGTISKNJYBGDCQ-SNVBAGLBSA-N 1 2 221.304 2.100 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@H]2CCCC[C@@H]2C)c[nH+]1 ZINC001558497330 990950187 /nfs/dbraw/zinc/95/01/87/990950187.db2.gz KDSKOXBRNUFTEC-JQWIXIFHSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@H]2CCCC[C@@H]2C)[nH+]1 ZINC001558497330 990950192 /nfs/dbraw/zinc/95/01/92/990950192.db2.gz KDSKOXBRNUFTEC-JQWIXIFHSA-N 1 2 249.358 2.415 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)CC(F)(F)F)[nH+]1 ZINC001558560645 990966345 /nfs/dbraw/zinc/96/63/45/990966345.db2.gz JSUJWOGPNQNCBF-UHFFFAOYSA-N 1 2 249.236 2.102 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)CC(F)(F)F)c[nH+]1 ZINC001558560645 990966355 /nfs/dbraw/zinc/96/63/55/990966355.db2.gz JSUJWOGPNQNCBF-UHFFFAOYSA-N 1 2 249.236 2.102 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)[C@H]2CC2(C)C)[nH+]1 ZINC001558561445 990966813 /nfs/dbraw/zinc/96/68/13/990966813.db2.gz RWAFXDKJXLESHS-SNVBAGLBSA-N 1 2 235.331 2.195 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)[C@H]2CC2(C)C)c[nH+]1 ZINC001558561445 990966822 /nfs/dbraw/zinc/96/68/22/990966822.db2.gz RWAFXDKJXLESHS-SNVBAGLBSA-N 1 2 235.331 2.195 20 0 BEADLO CCn1nc(C)c(C[N@@H+]2CCCC(=O)CC2)c1C ZINC001138643101 990996364 /nfs/dbraw/zinc/99/63/64/990996364.db2.gz SQQBOAUQSWKQJZ-UHFFFAOYSA-N 1 2 249.358 2.075 20 0 BEADLO CCn1nc(C)c(C[N@H+]2CCCC(=O)CC2)c1C ZINC001138643101 990996377 /nfs/dbraw/zinc/99/63/77/990996377.db2.gz SQQBOAUQSWKQJZ-UHFFFAOYSA-N 1 2 249.358 2.075 20 0 BEADLO CCSc1ncc(C[N@@H+]2CC[C@@H]2C)cn1 ZINC001138650419 990996912 /nfs/dbraw/zinc/99/69/12/990996912.db2.gz UZMNIDCEWOZCBD-VIFPVBQESA-N 1 2 223.345 2.183 20 0 BEADLO CCSc1ncc(C[N@H+]2CC[C@@H]2C)cn1 ZINC001138650419 990996917 /nfs/dbraw/zinc/99/69/17/990996917.db2.gz UZMNIDCEWOZCBD-VIFPVBQESA-N 1 2 223.345 2.183 20 0 BEADLO Fc1ccnc(NCc2cccc3[nH+]ccn32)c1 ZINC001308516645 991017858 /nfs/dbraw/zinc/01/78/58/991017858.db2.gz KKNBJSBSVYOXAN-UHFFFAOYSA-N 1 2 242.257 2.481 20 0 BEADLO CCOC(=O)CCC[C@@H](C)[N@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001258118039 991022586 /nfs/dbraw/zinc/02/25/86/991022586.db2.gz UTEOKLZKEACOKK-MXWKQRLJSA-N 1 2 249.301 2.100 20 0 BEADLO CCOC(=O)CCC[C@@H](C)[N@@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001258118039 991022596 /nfs/dbraw/zinc/02/25/96/991022596.db2.gz UTEOKLZKEACOKK-MXWKQRLJSA-N 1 2 249.301 2.100 20 0 BEADLO CCOC(=O)CCC[C@@H](C)[NH+]1C[C@@H](F)[C@H](F)C1 ZINC001258118037 991024063 /nfs/dbraw/zinc/02/40/63/991024063.db2.gz UTEOKLZKEACOKK-GMTAPVOTSA-N 1 2 249.301 2.100 20 0 BEADLO CC[NH+](CC)[C@H](C)c1ncc(C(=O)OC)s1 ZINC001308646927 991074932 /nfs/dbraw/zinc/07/49/32/991074932.db2.gz ACWYRJDKYNNUAZ-MRVPVSSYSA-N 1 2 242.344 2.333 20 0 BEADLO CCn1ccc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)n1 ZINC001308801097 991139373 /nfs/dbraw/zinc/13/93/73/991139373.db2.gz LJLOYXXUXMNZET-JTQLQIEISA-N 1 2 243.301 2.380 20 0 BEADLO CCn1ccc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)n1 ZINC001308801097 991139380 /nfs/dbraw/zinc/13/93/80/991139380.db2.gz LJLOYXXUXMNZET-JTQLQIEISA-N 1 2 243.301 2.380 20 0 BEADLO CCOC1C[NH+](Cc2ccc3cccnc3c2)C1 ZINC001139165411 991181970 /nfs/dbraw/zinc/18/19/70/991181970.db2.gz AQXPIAROJMKLQQ-UHFFFAOYSA-N 1 2 242.322 2.456 20 0 BEADLO CC[C@@H]([NH2+]Cc1cnn[nH]1)c1ccc(C)c(F)c1 ZINC001559680740 991219671 /nfs/dbraw/zinc/21/96/71/991219671.db2.gz JZGUXNSUJXKRHI-CYBMUJFWSA-N 1 2 248.305 2.493 20 0 BEADLO CSC(C)(C)C[C@H](C)[NH2+]CC(=O)OC(C)C ZINC001258314993 991236058 /nfs/dbraw/zinc/23/60/58/991236058.db2.gz JCWAJKWHHHVVDA-JTQLQIEISA-N 1 2 247.404 2.448 20 0 BEADLO CCCCC[N@H+](C)Cc1c(N)ncnc1Cl ZINC001139436346 991239463 /nfs/dbraw/zinc/23/94/63/991239463.db2.gz WPANWCBLQDLMRE-UHFFFAOYSA-N 1 2 242.754 2.334 20 0 BEADLO CCCCC[N@@H+](C)Cc1c(N)ncnc1Cl ZINC001139436346 991239468 /nfs/dbraw/zinc/23/94/68/991239468.db2.gz WPANWCBLQDLMRE-UHFFFAOYSA-N 1 2 242.754 2.334 20 0 BEADLO CSC(C)(C)C[C@H](C)[N@@H+]1CCC(=O)C1 ZINC001258341062 991267870 /nfs/dbraw/zinc/26/78/70/991267870.db2.gz JDAALKQPGYHFBI-VIFPVBQESA-N 1 2 215.362 2.181 20 0 BEADLO CSC(C)(C)C[C@H](C)[N@H+]1CCC(=O)C1 ZINC001258341062 991267877 /nfs/dbraw/zinc/26/78/77/991267877.db2.gz JDAALKQPGYHFBI-VIFPVBQESA-N 1 2 215.362 2.181 20 0 BEADLO COc1ccncc1C[N@@H+]1CCCC[C@H](F)C1 ZINC001139606195 991284417 /nfs/dbraw/zinc/28/44/17/991284417.db2.gz DIRJQDRTGMNLBK-LBPRGKRZSA-N 1 2 238.306 2.414 20 0 BEADLO COc1ccncc1C[N@H+]1CCCC[C@H](F)C1 ZINC001139606195 991284427 /nfs/dbraw/zinc/28/44/27/991284427.db2.gz DIRJQDRTGMNLBK-LBPRGKRZSA-N 1 2 238.306 2.414 20 0 BEADLO CCOc1ccc(C)cc1C[N@@H+]1C[C@@H]2C[C@H]1CO2 ZINC001139605374 991288577 /nfs/dbraw/zinc/28/85/77/991288577.db2.gz XKVSVLZHHLBDIN-KBPBESRZSA-N 1 2 247.338 2.367 20 0 BEADLO CCOc1ccc(C)cc1C[N@H+]1C[C@@H]2C[C@H]1CO2 ZINC001139605374 991288584 /nfs/dbraw/zinc/28/85/84/991288584.db2.gz XKVSVLZHHLBDIN-KBPBESRZSA-N 1 2 247.338 2.367 20 0 BEADLO CCOc1ccc(C[NH+]2CCOCC2)cc1CC ZINC001139618580 991292423 /nfs/dbraw/zinc/29/24/23/991292423.db2.gz CQLSNEUVYDCUDH-UHFFFAOYSA-N 1 2 249.354 2.480 20 0 BEADLO COC(=O)CC[C@H](C)[N@@H+]1CCCCC(F)(F)C1 ZINC001258366720 991314581 /nfs/dbraw/zinc/31/45/81/991314581.db2.gz VQPIOBVTHYYNIY-JTQLQIEISA-N 1 2 249.301 2.449 20 0 BEADLO COC(=O)CC[C@H](C)[N@H+]1CCCCC(F)(F)C1 ZINC001258366720 991314590 /nfs/dbraw/zinc/31/45/90/991314590.db2.gz VQPIOBVTHYYNIY-JTQLQIEISA-N 1 2 249.301 2.449 20 0 BEADLO COc1ncc(Cl)cc1C[NH+]1CC(C)C1 ZINC001139744713 991347450 /nfs/dbraw/zinc/34/74/50/991347450.db2.gz PRHMLQNNPABTJJ-UHFFFAOYSA-N 1 2 226.707 2.195 20 0 BEADLO C[N@H+](Cc1cccnc1)Cc1ccnc(F)c1 ZINC001139831027 991384474 /nfs/dbraw/zinc/38/44/74/991384474.db2.gz PVZQBMVHKODAGD-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO C[N@@H+](Cc1cccnc1)Cc1ccnc(F)c1 ZINC001139831027 991384482 /nfs/dbraw/zinc/38/44/82/991384482.db2.gz PVZQBMVHKODAGD-UHFFFAOYSA-N 1 2 231.274 2.248 20 0 BEADLO CC[N@H+](Cc1ccc(COC)s1)C1COC1 ZINC001139828729 991385931 /nfs/dbraw/zinc/38/59/31/991385931.db2.gz UEUYXOIKTYXPNF-UHFFFAOYSA-N 1 2 241.356 2.115 20 0 BEADLO CC[N@@H+](Cc1ccc(COC)s1)C1COC1 ZINC001139828729 991385941 /nfs/dbraw/zinc/38/59/41/991385941.db2.gz UEUYXOIKTYXPNF-UHFFFAOYSA-N 1 2 241.356 2.115 20 0 BEADLO COCc1ccc(C[N@@H+]2CCOC[C@H]2C)s1 ZINC001139824532 991385985 /nfs/dbraw/zinc/38/59/85/991385985.db2.gz ZBYXPOWWISBQLI-SNVBAGLBSA-N 1 2 241.356 2.115 20 0 BEADLO COCc1ccc(C[N@H+]2CCOC[C@H]2C)s1 ZINC001139824532 991385994 /nfs/dbraw/zinc/38/59/94/991385994.db2.gz ZBYXPOWWISBQLI-SNVBAGLBSA-N 1 2 241.356 2.115 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccnc(F)c2)C[C@@H]1F ZINC001139830457 991387346 /nfs/dbraw/zinc/38/73/46/991387346.db2.gz AOHDIEPCEQFLDX-SCZZXKLOSA-N 1 2 212.243 2.011 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccnc(F)c2)C[C@@H]1F ZINC001139830457 991387355 /nfs/dbraw/zinc/38/73/55/991387355.db2.gz AOHDIEPCEQFLDX-SCZZXKLOSA-N 1 2 212.243 2.011 20 0 BEADLO Cc1ccc(C[N@@H+]2CCc3ncccc3C2)nc1 ZINC001139838931 991396729 /nfs/dbraw/zinc/39/67/29/991396729.db2.gz WYVSIFYCCCBVPX-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1ccc(C[N@H+]2CCc3ncccc3C2)nc1 ZINC001139838931 991396736 /nfs/dbraw/zinc/39/67/36/991396736.db2.gz WYVSIFYCCCBVPX-UHFFFAOYSA-N 1 2 239.322 2.343 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC(=O)[C@H](C)CC2)nc1 ZINC001139839708 991398252 /nfs/dbraw/zinc/39/82/52/991398252.db2.gz POOPBBUBPIGEEW-GFCCVEGCSA-N 1 2 232.327 2.191 20 0 BEADLO Cc1ccc(C[N@H+]2CCC(=O)[C@H](C)CC2)nc1 ZINC001139839708 991398262 /nfs/dbraw/zinc/39/82/62/991398262.db2.gz POOPBBUBPIGEEW-GFCCVEGCSA-N 1 2 232.327 2.191 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccc(C)cn1 ZINC001139842201 991399304 /nfs/dbraw/zinc/39/93/04/991399304.db2.gz AJXHCNZCUZWBRQ-AWEZNQCLSA-N 1 2 232.327 2.334 20 0 BEADLO CC(=O)[C@@H]1CCCC[N@H+]1Cc1ccc(C)cn1 ZINC001139842201 991399311 /nfs/dbraw/zinc/39/93/11/991399311.db2.gz AJXHCNZCUZWBRQ-AWEZNQCLSA-N 1 2 232.327 2.334 20 0 BEADLO c1ccc2c(c1)cncc2C[N@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001139895144 991414758 /nfs/dbraw/zinc/41/47/58/991414758.db2.gz OOXRACCDSYDTIS-OKILXGFUSA-N 1 2 240.306 2.208 20 0 BEADLO c1ccc2c(c1)cncc2C[N@@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001139895144 991414762 /nfs/dbraw/zinc/41/47/62/991414762.db2.gz OOXRACCDSYDTIS-OKILXGFUSA-N 1 2 240.306 2.208 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cnc(C)nc2)cn1 ZINC001139933142 991423261 /nfs/dbraw/zinc/42/32/61/991423261.db2.gz KIKNVAPELPMFLV-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cnc(C)nc2)cn1 ZINC001139933142 991423267 /nfs/dbraw/zinc/42/32/67/991423267.db2.gz KIKNVAPELPMFLV-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO CCn1cnc(Cl)c1C[NH2+]Cc1ccco1 ZINC001560247062 991439092 /nfs/dbraw/zinc/43/90/92/991439092.db2.gz BNGXSBNLIBDBIC-UHFFFAOYSA-N 1 2 239.706 2.439 20 0 BEADLO CCOC(=O)CC[C@H](C)[N@@H+]1Cc2ccncc2C1 ZINC001258494749 991464142 /nfs/dbraw/zinc/46/41/42/991464142.db2.gz ANQGKBVTFSWEBH-NSHDSACASA-N 1 2 248.326 2.129 20 0 BEADLO CCOC(=O)CC[C@H](C)[N@H+]1Cc2ccncc2C1 ZINC001258494749 991464147 /nfs/dbraw/zinc/46/41/47/991464147.db2.gz ANQGKBVTFSWEBH-NSHDSACASA-N 1 2 248.326 2.129 20 0 BEADLO c1ccc2cc(C[N@@H+]3C[C@@H]4C[C@H]3CO4)ncc2c1 ZINC001139998841 991473943 /nfs/dbraw/zinc/47/39/43/991473943.db2.gz HZJZPILUQSYVDP-GJZGRUSLSA-N 1 2 240.306 2.208 20 0 BEADLO c1ccc2cc(C[N@H+]3C[C@@H]4C[C@H]3CO4)ncc2c1 ZINC001139998841 991473949 /nfs/dbraw/zinc/47/39/49/991473949.db2.gz HZJZPILUQSYVDP-GJZGRUSLSA-N 1 2 240.306 2.208 20 0 BEADLO CCOC(=O)C1([NH2+][C@H]2CCC(C)(C)C2)CC1 ZINC001258594534 991490370 /nfs/dbraw/zinc/49/03/70/991490370.db2.gz JKGRYQLDDQSCML-JTQLQIEISA-N 1 2 225.332 2.250 20 0 BEADLO Oc1ccc(F)c(C[N@@H+]2CCC[C@@H]2CF)c1 ZINC001140053184 991510851 /nfs/dbraw/zinc/51/08/51/991510851.db2.gz STDFXJGILUHYMA-SNVBAGLBSA-N 1 2 227.254 2.465 20 0 BEADLO Oc1ccc(F)c(C[N@H+]2CCC[C@@H]2CF)c1 ZINC001140053184 991510861 /nfs/dbraw/zinc/51/08/61/991510861.db2.gz STDFXJGILUHYMA-SNVBAGLBSA-N 1 2 227.254 2.465 20 0 BEADLO CC1(C)CC[C@H]([N@@H+]2CCC(=O)[C@@H](F)C2)C1 ZINC001258604735 991510963 /nfs/dbraw/zinc/51/09/63/991510963.db2.gz JIEZLZVLVOZEMY-UWVGGRQHSA-N 1 2 213.296 2.178 20 0 BEADLO CC1(C)CC[C@H]([N@H+]2CCC(=O)[C@@H](F)C2)C1 ZINC001258604735 991510978 /nfs/dbraw/zinc/51/09/78/991510978.db2.gz JIEZLZVLVOZEMY-UWVGGRQHSA-N 1 2 213.296 2.178 20 0 BEADLO CC(C)[C@@H]1COCC[N@@H+]1Cc1cccc(F)n1 ZINC001140133899 991535062 /nfs/dbraw/zinc/53/50/62/991535062.db2.gz HGLCDMIQTWWECY-LBPRGKRZSA-N 1 2 238.306 2.078 20 0 BEADLO CC(C)[C@@H]1COCC[N@H+]1Cc1cccc(F)n1 ZINC001140133899 991535072 /nfs/dbraw/zinc/53/50/72/991535072.db2.gz HGLCDMIQTWWECY-LBPRGKRZSA-N 1 2 238.306 2.078 20 0 BEADLO C[C@]1(F)CC[N@@H+](Cc2ccncc2O)C[C@@H]1F ZINC001140273687 991576586 /nfs/dbraw/zinc/57/65/86/991576586.db2.gz PKJVXAYCIWHCOE-RYUDHWBXSA-N 1 2 242.269 2.059 20 0 BEADLO COCc1ccc(NCc2ccc[nH+]c2N)cc1 ZINC001560792582 991604250 /nfs/dbraw/zinc/60/42/50/991604250.db2.gz OHEUJDOPQCADOE-UHFFFAOYSA-N 1 2 243.310 2.422 20 0 BEADLO CCCCC(=O)NC1C[NH+](Cc2ccccc2)C1 ZINC001318002554 991609328 /nfs/dbraw/zinc/60/93/28/991609328.db2.gz MYZAPRHBXBEQHI-UHFFFAOYSA-N 1 2 246.354 2.177 20 0 BEADLO CCn1cnc(Cl)c1C[NH+]1CC(C2CC2)C1 ZINC001560856984 991625661 /nfs/dbraw/zinc/62/56/61/991625661.db2.gz VIQQAPCYRADUJY-UHFFFAOYSA-N 1 2 239.750 2.398 20 0 BEADLO CCCOC1C[NH+](Cc2ccc3n[nH]cc3c2)C1 ZINC001140386759 991631946 /nfs/dbraw/zinc/63/19/46/991631946.db2.gz JPNNNHVVJUOEBG-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO Cn1cc(C[NH+]2CC3(CCC3)C2)c(C(F)F)n1 ZINC001560875759 991632202 /nfs/dbraw/zinc/63/22/02/991632202.db2.gz FCAJBVSGMLOPPS-UHFFFAOYSA-N 1 2 241.285 2.344 20 0 BEADLO C[C@@H](C(=O)N1CCC[C@H]1C1CCC1)n1cc[nH+]c1 ZINC001318227879 991637783 /nfs/dbraw/zinc/63/77/83/991637783.db2.gz YYADYUBLEDNNPN-AAEUAGOBSA-N 1 2 247.342 2.235 20 0 BEADLO Clc1ccc2ncc(C[NH+]3CCC3)n2c1 ZINC001140426621 991637784 /nfs/dbraw/zinc/63/77/84/991637784.db2.gz WTDPTBVKLARCOL-UHFFFAOYSA-N 1 2 221.691 2.193 20 0 BEADLO Cc1cc(C[NH+]2CC3(C2)CCCO3)ccc1O ZINC001140573052 991673721 /nfs/dbraw/zinc/67/37/21/991673721.db2.gz CZFPHDTZPKFEGZ-UHFFFAOYSA-N 1 2 233.311 2.065 20 0 BEADLO Cc1cc(C[N@@H+]2CCC(=O)[C@H](C)C2)ccc1O ZINC001140574957 991677037 /nfs/dbraw/zinc/67/70/37/991677037.db2.gz XEWYWWPNRCLJRL-LLVKDONJSA-N 1 2 233.311 2.112 20 0 BEADLO Cc1cc(C[N@H+]2CCC(=O)[C@H](C)C2)ccc1O ZINC001140574957 991677040 /nfs/dbraw/zinc/67/70/40/991677040.db2.gz XEWYWWPNRCLJRL-LLVKDONJSA-N 1 2 233.311 2.112 20 0 BEADLO Cn1cc(Cl)c(C[N@@H+]2CCC[C@H](CF)C2)n1 ZINC001560985260 991678664 /nfs/dbraw/zinc/67/86/64/991678664.db2.gz VHEREULNMKNQMP-SECBINFHSA-N 1 2 245.729 2.255 20 0 BEADLO Cn1cc(Cl)c(C[N@H+]2CCC[C@H](CF)C2)n1 ZINC001560985260 991678671 /nfs/dbraw/zinc/67/86/71/991678671.db2.gz VHEREULNMKNQMP-SECBINFHSA-N 1 2 245.729 2.255 20 0 BEADLO CS[C@@H]1CC[C@@H]([N@H+](C)Cc2noc(C)n2)C1 ZINC001318784526 991715651 /nfs/dbraw/zinc/71/56/51/991715651.db2.gz LXEDGSRCHLCHET-NXEZZACHSA-N 1 2 241.360 2.094 20 0 BEADLO CS[C@@H]1CC[C@@H]([N@@H+](C)Cc2noc(C)n2)C1 ZINC001318784526 991715666 /nfs/dbraw/zinc/71/56/66/991715666.db2.gz LXEDGSRCHLCHET-NXEZZACHSA-N 1 2 241.360 2.094 20 0 BEADLO C[C@H](C(=O)N1C[C@H](C)CC[C@H]1C)n1cc[nH+]c1 ZINC001318913618 991735196 /nfs/dbraw/zinc/73/51/96/991735196.db2.gz UDKSVJJIAMNFKV-IJLUTSLNSA-N 1 2 235.331 2.091 20 0 BEADLO CC[C@H](C[C@@H](C)CC)[N@@H+]1CCOC(=O)C1 ZINC001258798088 991794069 /nfs/dbraw/zinc/79/40/69/991794069.db2.gz QPFPBTIMXJFGJO-WDEREUQCSA-N 1 2 213.321 2.060 20 0 BEADLO CC[C@H](C[C@@H](C)CC)[N@H+]1CCOC(=O)C1 ZINC001258798088 991794083 /nfs/dbraw/zinc/79/40/83/991794083.db2.gz QPFPBTIMXJFGJO-WDEREUQCSA-N 1 2 213.321 2.060 20 0 BEADLO CC[C@@H](C)C[C@@H](CC)[N@@H+]1CCOC(=O)C1 ZINC001258798085 991794951 /nfs/dbraw/zinc/79/49/51/991794951.db2.gz QPFPBTIMXJFGJO-GHMZBOCLSA-N 1 2 213.321 2.060 20 0 BEADLO CC[C@@H](C)C[C@@H](CC)[N@H+]1CCOC(=O)C1 ZINC001258798085 991794965 /nfs/dbraw/zinc/79/49/65/991794965.db2.gz QPFPBTIMXJFGJO-GHMZBOCLSA-N 1 2 213.321 2.060 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1C2CCCC1CCC2 ZINC001565730442 991802288 /nfs/dbraw/zinc/80/22/88/991802288.db2.gz DCIBFBJHHGFEMT-UHFFFAOYSA-N 1 2 247.342 2.194 20 0 BEADLO C[C@@H]1CCC[C@@H]([N@@H+]2CCC(=O)[C@H](F)C2)C1 ZINC001258826542 991850676 /nfs/dbraw/zinc/85/06/76/991850676.db2.gz KGRIBISIFFDBSB-GMTAPVOTSA-N 1 2 213.296 2.178 20 0 BEADLO C[C@@H]1CCC[C@@H]([N@H+]2CCC(=O)[C@H](F)C2)C1 ZINC001258826542 991850679 /nfs/dbraw/zinc/85/06/79/991850679.db2.gz KGRIBISIFFDBSB-GMTAPVOTSA-N 1 2 213.296 2.178 20 0 BEADLO Cc1cnc(C[N@@H+]2CC(C)(C)C2(C)C)nc1 ZINC001319647256 991919294 /nfs/dbraw/zinc/91/92/94/991919294.db2.gz POZKXRMYBVWSJQ-UHFFFAOYSA-N 1 2 219.332 2.405 20 0 BEADLO Cc1cnc(C[N@H+]2CC(C)(C)C2(C)C)nc1 ZINC001319647256 991919309 /nfs/dbraw/zinc/91/93/09/991919309.db2.gz POZKXRMYBVWSJQ-UHFFFAOYSA-N 1 2 219.332 2.405 20 0 BEADLO Cc1cc(C[N@@H+]2CCS[C@H](C(C)C)C2)n[nH]1 ZINC001319829466 991997190 /nfs/dbraw/zinc/99/71/90/991997190.db2.gz WRRSVPFULOULKR-LBPRGKRZSA-N 1 2 239.388 2.292 20 0 BEADLO Cc1cc(C[N@H+]2CCS[C@H](C(C)C)C2)n[nH]1 ZINC001319829466 991997201 /nfs/dbraw/zinc/99/72/01/991997201.db2.gz WRRSVPFULOULKR-LBPRGKRZSA-N 1 2 239.388 2.292 20 0 BEADLO Cc1cc(C[N@@H+]2CCS[C@@H](C(C)C)C2)n[nH]1 ZINC001319829465 991999370 /nfs/dbraw/zinc/99/93/70/991999370.db2.gz WRRSVPFULOULKR-GFCCVEGCSA-N 1 2 239.388 2.292 20 0 BEADLO Cc1cc(C[N@H+]2CCS[C@@H](C(C)C)C2)n[nH]1 ZINC001319829465 991999383 /nfs/dbraw/zinc/99/93/83/991999383.db2.gz WRRSVPFULOULKR-GFCCVEGCSA-N 1 2 239.388 2.292 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1cc(O)c(C)cc1C ZINC001567325843 992013408 /nfs/dbraw/zinc/01/34/08/992013408.db2.gz ONPCMTICXJAYDY-GFCCVEGCSA-N 1 2 248.326 2.042 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1cc(O)c(C)cc1C ZINC001567325843 992013417 /nfs/dbraw/zinc/01/34/17/992013417.db2.gz ONPCMTICXJAYDY-GFCCVEGCSA-N 1 2 248.326 2.042 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@H](C)c2ccncc2)[nH]n1 ZINC001320139899 992115391 /nfs/dbraw/zinc/11/53/91/992115391.db2.gz NWWAYCAWKIAOJM-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO Cc1cc(C[N@H+](C)[C@H](C)c2ccncc2)[nH]n1 ZINC001320139899 992115398 /nfs/dbraw/zinc/11/53/98/992115398.db2.gz NWWAYCAWKIAOJM-LLVKDONJSA-N 1 2 230.315 2.306 20 0 BEADLO C[C@@H](C(=O)N1CCCC[C@@H](C)C1)n1cc[nH+]c1 ZINC001320404263 992196430 /nfs/dbraw/zinc/19/64/30/992196430.db2.gz UDSFGIUSOJFEFY-NEPJUHHUSA-N 1 2 235.331 2.093 20 0 BEADLO CCN(CC(C)(C)C)C(=O)[C@@H](C)n1cc[nH+]c1 ZINC001261224303 992203610 /nfs/dbraw/zinc/20/36/10/992203610.db2.gz ADCAPZPSPJYRSH-LLVKDONJSA-N 1 2 237.347 2.339 20 0 BEADLO C[C@H](C(=O)N[C@@H]1CCC(C)(C)C1)n1cc[nH+]c1 ZINC001320486359 992219052 /nfs/dbraw/zinc/21/90/52/992219052.db2.gz BPOMWJHJZCQYIU-GHMZBOCLSA-N 1 2 235.331 2.139 20 0 BEADLO Cc1coc(C(=O)OCCc2c[nH+]cn2C)c1C ZINC001261292013 992255435 /nfs/dbraw/zinc/25/54/35/992255435.db2.gz QNHGQJZUJYIWOO-UHFFFAOYSA-N 1 2 248.282 2.029 20 0 BEADLO CC1(C)C[N@H+](Cc2ncccn2)C1(C)C ZINC001320709594 992329470 /nfs/dbraw/zinc/32/94/70/992329470.db2.gz WDCKXKGLWXKIGN-UHFFFAOYSA-N 1 2 205.305 2.097 20 0 BEADLO CC1(C)C[N@@H+](Cc2ncccn2)C1(C)C ZINC001320709594 992329484 /nfs/dbraw/zinc/32/94/84/992329484.db2.gz WDCKXKGLWXKIGN-UHFFFAOYSA-N 1 2 205.305 2.097 20 0 BEADLO C[NH+](C)Cc1nnc([C@H]2CCC[C@H](F)C2)o1 ZINC001261575502 992394925 /nfs/dbraw/zinc/39/49/25/992394925.db2.gz KEZZSBIKZKOFIM-IUCAKERBSA-N 1 2 227.283 2.127 20 0 BEADLO C[NH+](C)Cc1nnc([C@@H]2CCC[C@@H](F)C2)o1 ZINC001261575503 992397558 /nfs/dbraw/zinc/39/75/58/992397558.db2.gz KEZZSBIKZKOFIM-RKDXNWHRSA-N 1 2 227.283 2.127 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2cnon2)s1 ZINC001261638441 992425742 /nfs/dbraw/zinc/42/57/42/992425742.db2.gz BKCGTHUYRIWOTH-QMMMGPOBSA-N 1 2 223.301 2.290 20 0 BEADLO CCC[C@@H]1[C@H](C)CCC[N@@H+]1Cc1nc[nH]n1 ZINC001261637795 992428669 /nfs/dbraw/zinc/42/86/69/992428669.db2.gz GRCMRNQNWXVMHL-GHMZBOCLSA-N 1 2 222.336 2.205 20 0 BEADLO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cc1nc[nH]n1 ZINC001261637795 992428677 /nfs/dbraw/zinc/42/86/77/992428677.db2.gz GRCMRNQNWXVMHL-GHMZBOCLSA-N 1 2 222.336 2.205 20 0 BEADLO CC(C)N(CC1CCC1)C(=O)[C@H](C)n1cc[nH+]c1 ZINC001321196558 992484235 /nfs/dbraw/zinc/48/42/35/992484235.db2.gz HTCVVESGHYHWJJ-LBPRGKRZSA-N 1 2 249.358 2.481 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+]2CCCOC[C@@H]2C)n1 ZINC001262109626 992680679 /nfs/dbraw/zinc/68/06/79/992680679.db2.gz ZNCMHXSFJBVAGU-NSHDSACASA-N 1 2 237.347 2.144 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+]2CCCOC[C@@H]2C)n1 ZINC001262109626 992680686 /nfs/dbraw/zinc/68/06/86/992680686.db2.gz ZNCMHXSFJBVAGU-NSHDSACASA-N 1 2 237.347 2.144 20 0 BEADLO Cc1ccc(N[C@H](C)c2cnn(C)n2)c(C)[nH+]1 ZINC001262203183 992798725 /nfs/dbraw/zinc/79/87/25/992798725.db2.gz NSKRBBNIKZYWAS-SNVBAGLBSA-N 1 2 231.303 2.000 20 0 BEADLO CC(C)[C@@H]1CCN(c2cc(N(C)C)[nH+]cn2)C1 ZINC001262359614 992859349 /nfs/dbraw/zinc/85/93/49/992859349.db2.gz DXDQUDNTXOMAOS-LLVKDONJSA-N 1 2 234.347 2.025 20 0 BEADLO CC(C)[C@@H]1CCN(c2cc(N(C)C)nc[nH+]2)C1 ZINC001262359614 992859350 /nfs/dbraw/zinc/85/93/50/992859350.db2.gz DXDQUDNTXOMAOS-LLVKDONJSA-N 1 2 234.347 2.025 20 0 BEADLO OCc1cc[nH+]c(NCCCC(F)F)c1 ZINC001262373132 992867577 /nfs/dbraw/zinc/86/75/77/992867577.db2.gz MYVKRCNMMXZXRS-UHFFFAOYSA-N 1 2 216.231 2.031 20 0 BEADLO CCN(CCc1cccs1)c1cc(N)nc[nH+]1 ZINC001262685586 993026372 /nfs/dbraw/zinc/02/63/72/993026372.db2.gz GOITUHHRSKKRTI-UHFFFAOYSA-N 1 2 248.355 2.189 20 0 BEADLO Cc1c[nH+]cc(C)c1NC(=O)C[C@H]1C=CCC1 ZINC001262805315 993067920 /nfs/dbraw/zinc/06/79/20/993067920.db2.gz MXKXVNUAUPZEQF-LBPRGKRZSA-N 1 2 230.311 2.415 20 0 BEADLO C[C@@H]([NH2+]Cc1ccc2cc[nH]c2c1)c1cnn[nH]1 ZINC001575698899 993099278 /nfs/dbraw/zinc/09/92/78/993099278.db2.gz ZSKCNHWTXFEPNS-SECBINFHSA-N 1 2 241.298 2.137 20 0 BEADLO CC1CC(C[N@H+](Cc2cn[nH]n2)C(C)(C)C)C1 ZINC001576037101 993162574 /nfs/dbraw/zinc/16/25/74/993162574.db2.gz ALTQJMUEMLGZNU-UHFFFAOYSA-N 1 2 236.363 2.451 20 0 BEADLO CC1CC(C[N@@H+](Cc2cn[nH]n2)C(C)(C)C)C1 ZINC001576037101 993162578 /nfs/dbraw/zinc/16/25/78/993162578.db2.gz ALTQJMUEMLGZNU-UHFFFAOYSA-N 1 2 236.363 2.451 20 0 BEADLO CC[C@@H]([NH2+][C@H]1C[C@@H]2CC[C@@H](C2)C1)c1cn[nH]n1 ZINC001576288589 993256634 /nfs/dbraw/zinc/25/66/34/993256634.db2.gz HSMWWHKYDUAWIY-NOOOWODRSA-N 1 2 234.347 2.424 20 0 BEADLO CC[C@@H]([NH2+][C@H]1C[C@@H]2CC[C@@H](C2)C1)c1c[nH]nn1 ZINC001576288589 993256638 /nfs/dbraw/zinc/25/66/38/993256638.db2.gz HSMWWHKYDUAWIY-NOOOWODRSA-N 1 2 234.347 2.424 20 0 BEADLO COC[C@@H](C)Nc1cc(C)c2ccccc2[nH+]1 ZINC000379873710 993289454 /nfs/dbraw/zinc/28/94/54/993289454.db2.gz QQUBOJRWXCIUFN-LLVKDONJSA-N 1 2 230.311 2.412 20 0 BEADLO Cc1cc(C(=O)OCC(C)(C)n2cc[nH+]c2)co1 ZINC001263542588 993377385 /nfs/dbraw/zinc/37/73/85/993377385.db2.gz LAZAPAGWGSNARY-UHFFFAOYSA-N 1 2 248.282 2.377 20 0 BEADLO C[C@@]1(CO)CCN(c2[nH+]ccc3ccccc32)C1 ZINC000381690613 993416072 /nfs/dbraw/zinc/41/60/72/993416072.db2.gz FKWASFUIXFKNJI-OAHLLOKOSA-N 1 2 242.322 2.444 20 0 BEADLO CCn1c[nH+]cc1COC(=O)C=C1CCC1 ZINC001263662766 993454669 /nfs/dbraw/zinc/45/46/69/993454669.db2.gz LDEGCFLVBBMTMU-UHFFFAOYSA-N 1 2 220.272 2.057 20 0 BEADLO CCC(CC)C(=O)OCc1c[nH+]cn1CC ZINC001263663155 993454925 /nfs/dbraw/zinc/45/49/25/993454925.db2.gz VVGUFNYMQWOBPG-UHFFFAOYSA-N 1 2 224.304 2.382 20 0 BEADLO Nc1ccc(Nc2ccc3c(c2)CCO3)c[nH+]1 ZINC000383737360 993513268 /nfs/dbraw/zinc/51/32/68/993513268.db2.gz NCNOUZCDIFTHIZ-UHFFFAOYSA-N 1 2 227.267 2.173 20 0 BEADLO CN(C)c1ccc(Nc2ccnc(F)c2)c[nH+]1 ZINC000387253741 993702973 /nfs/dbraw/zinc/70/29/73/993702973.db2.gz ZJWZGDLJNOZCKM-UHFFFAOYSA-N 1 2 232.262 2.425 20 0 BEADLO CN(C)c1ccc(Nc2cccc(F)n2)c[nH+]1 ZINC000387231181 993704208 /nfs/dbraw/zinc/70/42/08/993704208.db2.gz VIIOIMGFWRNUMQ-UHFFFAOYSA-N 1 2 232.262 2.425 20 0 BEADLO Cc1nc([C@@H](C)[NH2+][C@H]2C=CCCC2)no1 ZINC000393743017 993996350 /nfs/dbraw/zinc/99/63/50/993996350.db2.gz LXHNDHCUAGBJKO-SCZZXKLOSA-N 1 2 207.277 2.137 20 0 BEADLO CCN(Cc1c[nH+]c(C)[nH]1)CC(F)(F)F ZINC000724784468 994078543 /nfs/dbraw/zinc/07/85/43/994078543.db2.gz CPMOPBRZZZZLIV-UHFFFAOYSA-N 1 2 221.226 2.102 20 0 BEADLO CCN(Cc1c[nH]c(C)[nH+]1)CC(F)(F)F ZINC000724784468 994078549 /nfs/dbraw/zinc/07/85/49/994078549.db2.gz CPMOPBRZZZZLIV-UHFFFAOYSA-N 1 2 221.226 2.102 20 0 BEADLO COc1ccccc1Cc1cn(C)c[nH+]1 ZINC001307407751 995345773 /nfs/dbraw/zinc/34/57/73/995345773.db2.gz MBGPCCMQGVJRQA-UHFFFAOYSA-N 1 2 202.257 2.020 20 0 BEADLO Cc1cnc(C[N@@H+]2CC[C@H]3[C@@H](C2)C3(F)F)o1 ZINC001307597197 995411374 /nfs/dbraw/zinc/41/13/74/995411374.db2.gz MHVHKYYVQLWNHB-DTWKUNHWSA-N 1 2 228.242 2.070 20 0 BEADLO Cc1cnc(C[N@H+]2CC[C@H]3[C@@H](C2)C3(F)F)o1 ZINC001307597197 995411379 /nfs/dbraw/zinc/41/13/79/995411379.db2.gz MHVHKYYVQLWNHB-DTWKUNHWSA-N 1 2 228.242 2.070 20 0 BEADLO CCC[C@@H]([NH2+]Cc1cc[nH]n1)c1ccccn1 ZINC001308248687 995602510 /nfs/dbraw/zinc/60/25/10/995602510.db2.gz LGFXYSIHDXMAGX-GFCCVEGCSA-N 1 2 230.315 2.436 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)OCCCF)[nH+]1 ZINC001464646713 1170039730 /nfs/dbraw/zinc/03/97/30/1170039730.db2.gz SMOULSVTTYYVRK-UHFFFAOYSA-N 1 2 243.282 2.119 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)OCCCF)c[nH+]1 ZINC001464646713 1170039738 /nfs/dbraw/zinc/03/97/38/1170039738.db2.gz SMOULSVTTYYVRK-UHFFFAOYSA-N 1 2 243.282 2.119 20 0 BEADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1ccc(F)nc1 ZINC001620936013 1170171087 /nfs/dbraw/zinc/17/10/87/1170171087.db2.gz NZHKZPLENCBXMD-SNVBAGLBSA-N 1 2 248.305 2.288 20 0 BEADLO FCC(CF)[NH2+]Cc1cccc2nsnc21 ZINC001620948972 1170173060 /nfs/dbraw/zinc/17/30/60/1170173060.db2.gz XPTVELREYROCJX-UHFFFAOYSA-N 1 2 243.282 2.089 20 0 BEADLO CCn1cnc(CNc2cc3cc[nH]c3c[nH+]2)c1 ZINC001620988624 1170180382 /nfs/dbraw/zinc/18/03/82/1170180382.db2.gz SDVQYKIWBHAGCF-UHFFFAOYSA-N 1 2 241.298 2.391 20 0 BEADLO Fc1ccc(/C=C\C[NH2+]Cc2csnn2)cc1 ZINC001621023021 1170184430 /nfs/dbraw/zinc/18/44/30/1170184430.db2.gz TWEOECMZQOCWOL-UPHRSURJSA-N 1 2 249.314 2.480 20 0 BEADLO C=C/C=C/CCNC(=O)c1cccc2[nH+]ccn21 ZINC001610969937 1170426219 /nfs/dbraw/zinc/42/62/19/1170426219.db2.gz MAPQQNUNHJJECK-ONEGZZNKSA-N 1 2 241.294 2.196 20 0 BEADLO CCc1cn(Cc2ccccc2C(=O)OC)c[nH+]1 ZINC001614960400 1170501017 /nfs/dbraw/zinc/50/10/17/1170501017.db2.gz MEZKCMJXAOERCI-UHFFFAOYSA-N 1 2 244.294 2.280 20 0 BEADLO Cc1cc([C@H]2CCCC[N@@H+]2CCF)[nH]n1 ZINC001620614779 1170688941 /nfs/dbraw/zinc/68/89/41/1170688941.db2.gz BYCMUNMFMHBJCX-LLVKDONJSA-N 1 2 211.284 2.215 20 0 BEADLO Cc1cc([C@H]2CCCC[N@H+]2CCF)[nH]n1 ZINC001620614779 1170688943 /nfs/dbraw/zinc/68/89/43/1170688943.db2.gz BYCMUNMFMHBJCX-LLVKDONJSA-N 1 2 211.284 2.215 20 0 BEADLO Cn1c(Cl)ncc1CNc1cccc[nH+]1 ZINC001620732503 1170708151 /nfs/dbraw/zinc/70/81/51/1170708151.db2.gz BYNPAKLWABCFSK-UHFFFAOYSA-N 1 2 222.679 2.081 20 0 BEADLO CC(=O)N[C@@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC000023563889 1170745999 /nfs/dbraw/zinc/74/59/99/1170745999.db2.gz HPQLAYZRGRDZHB-JTQLQIEISA-N 1 2 229.283 2.069 20 0 BEADLO Nc1[nH+]cccc1CN1CCc2cc(F)ccc21 ZINC001621284969 1170760789 /nfs/dbraw/zinc/76/07/89/1170760789.db2.gz KPTTWADHXFKEFJ-UHFFFAOYSA-N 1 2 243.285 2.366 20 0 BEADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1cc(C)ccc1OC ZINC001624061107 1171002223 /nfs/dbraw/zinc/00/22/23/1171002223.db2.gz ZXDMYTXMEOJCRF-LBPRGKRZSA-N 1 2 248.326 2.036 20 0 BEADLO CC[N@H+]1CC[C@H]1C(=O)Nc1cc(C)ccc1OC ZINC001624061107 1171002233 /nfs/dbraw/zinc/00/22/33/1171002233.db2.gz ZXDMYTXMEOJCRF-LBPRGKRZSA-N 1 2 248.326 2.036 20 0 BEADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1cc(F)ccc1C ZINC001624054568 1171002256 /nfs/dbraw/zinc/00/22/56/1171002256.db2.gz HNFVXJUKQIDZAS-GFCCVEGCSA-N 1 2 236.290 2.167 20 0 BEADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1cc(F)ccc1C ZINC001624054568 1171002264 /nfs/dbraw/zinc/00/22/64/1171002264.db2.gz HNFVXJUKQIDZAS-GFCCVEGCSA-N 1 2 236.290 2.167 20 0 BEADLO C[C@@H]1CCC[C@@H](OC(=O)[C@@H]2CCCC[NH2+]2)C1 ZINC000040953455 1171161145 /nfs/dbraw/zinc/16/11/45/1171161145.db2.gz YTBDTTBTGHSCIV-UTUOFQBUSA-N 1 2 225.332 2.250 20 0 BEADLO C[C@@H](C(=O)N(C)Cc1cccs1)n1cc[nH+]c1 ZINC000044888032 1171420219 /nfs/dbraw/zinc/42/02/19/1171420219.db2.gz NMNVXNSCBKNOON-JTQLQIEISA-N 1 2 249.339 2.164 20 0 BEADLO Cc1ccsc1CNC(=O)[C@H](C)n1cc[nH+]c1 ZINC000045883695 1171467117 /nfs/dbraw/zinc/46/71/17/1171467117.db2.gz LUESCNRJWXPWRH-JTQLQIEISA-N 1 2 249.339 2.130 20 0 BEADLO Cc1ccccc1CNC(=O)[C@@H](C)n1cc[nH+]c1 ZINC000046762865 1171499209 /nfs/dbraw/zinc/49/92/09/1171499209.db2.gz NGDVPXHIYGMURM-GFCCVEGCSA-N 1 2 243.310 2.069 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@H]1CC12CCCCC2 ZINC001632955352 1171546292 /nfs/dbraw/zinc/54/62/92/1171546292.db2.gz JBMZMWLQZVRQPP-GFCCVEGCSA-N 1 2 247.342 2.100 20 0 BEADLO Cc1[nH]c([C@@H]2CCCN2C(=O)[C@@H]2C[C@H]2C)[nH+]c1C ZINC001634701758 1171673121 /nfs/dbraw/zinc/67/31/21/1171673121.db2.gz GAWDUSTZOCPLJQ-FXAINCCUSA-N 1 2 247.342 2.346 20 0 BEADLO Cc1[nH]c([C@H]2CCCN2C(=O)[C@@H]2C[C@H]2C)[nH+]c1C ZINC001634701759 1171673418 /nfs/dbraw/zinc/67/34/18/1171673418.db2.gz GAWDUSTZOCPLJQ-GGZOMVNGSA-N 1 2 247.342 2.346 20 0 BEADLO C[C@H]1CC(=O)CC[N@@H+]1Cc1cccs1 ZINC000049712688 1171721432 /nfs/dbraw/zinc/72/14/32/1171721432.db2.gz PRQUGWQVJRQWMX-VIFPVBQESA-N 1 2 209.314 2.302 20 0 BEADLO C[C@H]1CC(=O)CC[N@H+]1Cc1cccs1 ZINC000049712688 1171721440 /nfs/dbraw/zinc/72/14/40/1171721440.db2.gz PRQUGWQVJRQWMX-VIFPVBQESA-N 1 2 209.314 2.302 20 0 BEADLO CC[N@H+](CC(=O)OC(C)C)Cc1ccccc1 ZINC000049773177 1171727424 /nfs/dbraw/zinc/72/74/24/1171727424.db2.gz DXAUVJSYMXRGDB-UHFFFAOYSA-N 1 2 235.327 2.460 20 0 BEADLO CC[N@@H+](CC(=O)OC(C)C)Cc1ccccc1 ZINC000049773177 1171727435 /nfs/dbraw/zinc/72/74/35/1171727435.db2.gz DXAUVJSYMXRGDB-UHFFFAOYSA-N 1 2 235.327 2.460 20 0 BEADLO CCc1[nH]c(CNC(=O)C[C@H]2CCC[C@@H]2C)c[nH+]1 ZINC001635610464 1171741431 /nfs/dbraw/zinc/74/14/31/1171741431.db2.gz MQTFXOQLTXGBAH-WDEREUQCSA-N 1 2 249.358 2.415 20 0 BEADLO CCc1[nH]cc(CNC(=O)C[C@H]2CCC[C@@H]2C)[nH+]1 ZINC001635610464 1171741441 /nfs/dbraw/zinc/74/14/41/1171741441.db2.gz MQTFXOQLTXGBAH-WDEREUQCSA-N 1 2 249.358 2.415 20 0 BEADLO CCCC[C@@H](C)C(=O)NCc1c[nH+]c(CC)[nH]1 ZINC001635610650 1171740683 /nfs/dbraw/zinc/74/06/83/1171740683.db2.gz QBCJWTXTNXNXLS-SNVBAGLBSA-N 1 2 237.347 2.415 20 0 BEADLO CCCC[C@@H](C)C(=O)NCc1c[nH]c(CC)[nH+]1 ZINC001635610650 1171740694 /nfs/dbraw/zinc/74/06/94/1171740694.db2.gz QBCJWTXTNXNXLS-SNVBAGLBSA-N 1 2 237.347 2.415 20 0 BEADLO C/C=C/C=C\C(=O)NCc1[nH]c2c([nH+]1)CCCC2 ZINC001635850905 1171768852 /nfs/dbraw/zinc/76/88/52/1171768852.db2.gz VIFKPNSNRCRZGE-OQIXSKIXSA-N 1 2 245.326 2.037 20 0 BEADLO C[C@H](C(=O)N[C@@H]1CCC[C@@H](C)C1)n1cc[nH+]c1 ZINC000052493374 1171967804 /nfs/dbraw/zinc/96/78/04/1171967804.db2.gz CJIDSBXIVWVBEB-IJLUTSLNSA-N 1 2 235.331 2.139 20 0 BEADLO CN(C(=O)Cc1c[nH+]cn1C)C1CCCCCC1 ZINC000548583478 398137848 /nfs/dbraw/zinc/13/78/48/398137848.db2.gz XYCOMVNKRIAAMP-UHFFFAOYSA-N 1 2 249.358 2.144 20 0 BEADLO OCC1(CNc2cccc[nH+]2)CCCCC1 ZINC000161094830 538914137 /nfs/dbraw/zinc/91/41/37/538914137.db2.gz XROQSVGNKPMESK-UHFFFAOYSA-N 1 2 220.316 2.436 20 0 BEADLO Cc1cnc(C[NH2+]Cc2conc2C)s1 ZINC000378714977 346814269 /nfs/dbraw/zinc/81/42/69/346814269.db2.gz XZUCBICXDSSKFA-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO CC(C)n1cc([C@H](C)[NH2+]Cc2cc[nH]n2)cn1 ZINC000602287027 349493883 /nfs/dbraw/zinc/49/38/83/349493883.db2.gz UGCXTTBDAQHQPS-JTQLQIEISA-N 1 2 233.319 2.038 20 0 BEADLO CCC(CC)([NH2+]CCC(F)(F)F)C(=O)OC ZINC000309480712 168331434 /nfs/dbraw/zinc/33/14/34/168331434.db2.gz SYNXPMVPOSODPX-UHFFFAOYSA-N 1 2 241.253 2.260 20 0 BEADLO C[C@H](N[C@H]1C[C@@H](C)n2cc[nH+]c21)C(F)F ZINC000389922561 398149269 /nfs/dbraw/zinc/14/92/69/398149269.db2.gz SMGOEBVAINIDGO-CSMHCCOUSA-N 1 2 215.247 2.132 20 0 BEADLO Cc1ccn2cc(CNC(=O)C3CCC3)[nH+]c2c1 ZINC000071435582 398149541 /nfs/dbraw/zinc/14/95/41/398149541.db2.gz XIPUNPZBPBWKIE-UHFFFAOYSA-N 1 2 243.310 2.059 20 0 BEADLO COc1cc(C[NH2+][C@H](C)C(F)F)cc(OC)c1 ZINC000389928254 398150157 /nfs/dbraw/zinc/15/01/57/398150157.db2.gz YCIUGCGCYTXURE-MRVPVSSYSA-N 1 2 245.269 2.447 20 0 BEADLO C[C@@H]([NH2+]Cc1cnn(C(C)(C)C)c1)C(F)F ZINC000389933241 398151195 /nfs/dbraw/zinc/15/11/95/398151195.db2.gz KGIOMMWWNDRZKI-MRVPVSSYSA-N 1 2 231.290 2.381 20 0 BEADLO Cc1cc(C[NH2+]Cc2occc2C)no1 ZINC000126722222 178029829 /nfs/dbraw/zinc/02/98/29/178029829.db2.gz IZMFQIJLUGUAQF-UHFFFAOYSA-N 1 2 206.245 2.174 20 0 BEADLO CCOC1(C)CCN(c2nc(C)[nH+]cc2C)CC1 ZINC000563426789 398171029 /nfs/dbraw/zinc/17/10/29/398171029.db2.gz VAYLMZKDFFOMAC-UHFFFAOYSA-N 1 2 249.358 2.489 20 0 BEADLO Cc1nc([C@@H](C)[NH2+]Cc2cc(C)ncn2)cs1 ZINC000358346592 178039006 /nfs/dbraw/zinc/03/90/06/178039006.db2.gz ACZDPGSMLXFZIC-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2CC[C@@]3(CC3(F)F)C2)no1 ZINC000649908308 398184000 /nfs/dbraw/zinc/18/40/00/398184000.db2.gz LNIRGMJJHUKDPI-GMSGAONNSA-N 1 2 243.257 2.170 20 0 BEADLO CCC(CC)C(=O)NCCCNc1cccc[nH+]1 ZINC000118724169 168337290 /nfs/dbraw/zinc/33/72/90/168337290.db2.gz GEPCHUXCNCLWRE-UHFFFAOYSA-N 1 2 249.358 2.436 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2CC[C@@]3(CC3(F)F)C2)no1 ZINC000649908308 398184001 /nfs/dbraw/zinc/18/40/01/398184001.db2.gz LNIRGMJJHUKDPI-GMSGAONNSA-N 1 2 243.257 2.170 20 0 BEADLO CCCC(=O)CSc1nc(N)cc(CC)[nH+]1 ZINC000289302436 398187792 /nfs/dbraw/zinc/18/77/92/398187792.db2.gz CVNRFAVJFPZAHQ-UHFFFAOYSA-N 1 2 239.344 2.083 20 0 BEADLO Cc1cc(F)ccc1CN1CCn2c[nH+]cc2C1 ZINC000291592303 178086357 /nfs/dbraw/zinc/08/63/57/178086357.db2.gz PVVGOUNYHOZRJZ-UHFFFAOYSA-N 1 2 245.301 2.346 20 0 BEADLO Cc1cnc(C(=O)Nc2ccc(C)[nH+]c2C)cn1 ZINC000119252508 398192166 /nfs/dbraw/zinc/19/21/66/398192166.db2.gz WQRTTZCZNUPCMT-UHFFFAOYSA-N 1 2 242.282 2.049 20 0 BEADLO Cc1cc(N(C)CC2CCCC2)nc[nH+]1 ZINC000301244050 178096056 /nfs/dbraw/zinc/09/60/56/178096056.db2.gz NJSQBOIBYSRESD-UHFFFAOYSA-N 1 2 205.305 2.411 20 0 BEADLO COC(C)(C)CC(=O)Nc1c(C)cc[nH+]c1C ZINC000425598963 192026985 /nfs/dbraw/zinc/02/69/85/192026985.db2.gz YMBKFIZDJZLVAU-UHFFFAOYSA-N 1 2 236.315 2.452 20 0 BEADLO Cc1cc(N(C)CCC2CCOCC2)nc[nH+]1 ZINC000342213399 178099443 /nfs/dbraw/zinc/09/94/43/178099443.db2.gz XWUDRCGYVKFBAD-UHFFFAOYSA-N 1 2 235.331 2.038 20 0 BEADLO Cc1cc(N(C)[C@H](C)CO)c2cccc(F)c2[nH+]1 ZINC000286296570 178100316 /nfs/dbraw/zinc/10/03/16/178100316.db2.gz DKNUUODXQOPAQE-SNVBAGLBSA-N 1 2 248.301 2.499 20 0 BEADLO Cc1cc(N(CCO)C(C)C)nc(C(C)C)[nH+]1 ZINC000040452631 178102663 /nfs/dbraw/zinc/10/26/63/178102663.db2.gz ZOEWESZDQWVHBO-UHFFFAOYSA-N 1 2 237.347 2.116 20 0 BEADLO Cc1cc(N)nc(SCCOC(C)(C)C)[nH+]1 ZINC000049517147 178109714 /nfs/dbraw/zinc/10/97/14/178109714.db2.gz DUFQOCGFQHOFJF-UHFFFAOYSA-N 1 2 241.360 2.274 20 0 BEADLO Cc1cc(N2CC(CO)C2)c2cccc(F)c2[nH+]1 ZINC000192179971 178112505 /nfs/dbraw/zinc/11/25/05/178112505.db2.gz RTMFPIIVNIQHLK-UHFFFAOYSA-N 1 2 246.285 2.111 20 0 BEADLO Cc1cc(N2CCCCC[C@@H]2C[C@H](C)O)nc[nH+]1 ZINC000336785035 178113456 /nfs/dbraw/zinc/11/34/56/178113456.db2.gz AVVAFFRNNLPQON-QWHCGFSZSA-N 1 2 249.358 2.305 20 0 BEADLO Cc1cc(N2CC[C@@H](O)C2)c2cccc(F)c2[nH+]1 ZINC000268780574 178117162 /nfs/dbraw/zinc/11/71/62/178117162.db2.gz BZLFPNZGKCISAI-SNVBAGLBSA-N 1 2 246.285 2.253 20 0 BEADLO Cc1cc(N2CC[C@H](CO)[C@H]2C)nc(C(C)C)[nH+]1 ZINC000362671600 178119011 /nfs/dbraw/zinc/11/90/11/178119011.db2.gz XUVWIAMKGZGKQK-VXGBXAGGSA-N 1 2 249.358 2.116 20 0 BEADLO C[C@H](c1csnn1)[NH+]1CCC2(CC2)CC1 ZINC000649399976 398202131 /nfs/dbraw/zinc/20/21/31/398202131.db2.gz FAWFKDABGIRZFZ-SECBINFHSA-N 1 2 223.345 2.475 20 0 BEADLO c1snnc1C[NH+]1CC(Cc2ccccc2)C1 ZINC000649400105 398202140 /nfs/dbraw/zinc/20/21/40/398202140.db2.gz SERRCDDWBWQZMF-UHFFFAOYSA-N 1 2 245.351 2.213 20 0 BEADLO Cn1ncc2c1nc[nH+]c2N[C@H]1CCC(C)(C)C1 ZINC000162664072 538924178 /nfs/dbraw/zinc/92/41/78/538924178.db2.gz GAHAJGYZVGTTDE-VIFPVBQESA-N 1 2 245.330 2.354 20 0 BEADLO Cc1cc(NC(=O)N2CCCC2)cc[nH+]1 ZINC000119305103 178136575 /nfs/dbraw/zinc/13/65/75/178136575.db2.gz BKRHCMGBBJBZKX-UHFFFAOYSA-N 1 2 205.261 2.018 20 0 BEADLO Cc1ocnc1CNC(=O)Nc1cc[nH+]c(C)c1 ZINC000271808483 178140135 /nfs/dbraw/zinc/14/01/35/178140135.db2.gz LPQYRNPAMFIHCA-UHFFFAOYSA-N 1 2 246.270 2.008 20 0 BEADLO Cc1cc(NC(=O)N[C@@H]2CC2(C)C)cc[nH+]1 ZINC000270994631 178140792 /nfs/dbraw/zinc/14/07/92/178140792.db2.gz CJJYQFORKLGKQB-SNVBAGLBSA-N 1 2 219.288 2.310 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2CCO[C@@H](C)C2)cc[nH+]1 ZINC000271550921 178142619 /nfs/dbraw/zinc/14/26/19/178142619.db2.gz ZYCDHBLZFBMESN-JQWIXIFHSA-N 1 2 249.314 2.079 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CCC(=O)C[C@@H]2C)cc[nH+]1 ZINC000126055933 178143072 /nfs/dbraw/zinc/14/30/72/178143072.db2.gz UMKJFUOQDRRGKU-TVQRCGJNSA-N 1 2 246.310 2.334 20 0 BEADLO Cc1cc(NC(=O)c2cccc(F)c2N)cc[nH+]1 ZINC000082698013 178150721 /nfs/dbraw/zinc/15/07/21/178150721.db2.gz RWSIRXCARHNUTR-UHFFFAOYSA-N 1 2 245.257 2.364 20 0 BEADLO Cc1cc(NCC2(C3CC3)CC2)nc[nH+]1 ZINC000131218245 178155839 /nfs/dbraw/zinc/15/58/39/178155839.db2.gz XZQUORSLZHQTKA-UHFFFAOYSA-N 1 2 203.289 2.387 20 0 BEADLO Cc1cc(NCC[C@@H](C)CCO)nc(C2CC2)[nH+]1 ZINC000294918698 178162063 /nfs/dbraw/zinc/16/20/63/178162063.db2.gz JRSBAVVXSRPYLZ-SNVBAGLBSA-N 1 2 249.358 2.483 20 0 BEADLO Cc1cc(NCCOc2cccc(F)c2)nc[nH+]1 ZINC000301227284 178162141 /nfs/dbraw/zinc/16/21/41/178162141.db2.gz FOTQBJNWKJPLFZ-UHFFFAOYSA-N 1 2 247.273 2.415 20 0 BEADLO Cc1cc(NC[C@@H]2CCOC2)nc(C(C)C)[nH+]1 ZINC000037988140 178166435 /nfs/dbraw/zinc/16/64/35/178166435.db2.gz DRRUOBMOFAHFCL-NSHDSACASA-N 1 2 235.331 2.357 20 0 BEADLO CCc1nnc(C[NH2+][C@@H](C)c2cccc(F)c2)[nH]1 ZINC000274573171 538929955 /nfs/dbraw/zinc/92/99/55/538929955.db2.gz FXAZFXSHTCPFLV-VIFPVBQESA-N 1 2 248.305 2.357 20 0 BEADLO Cc1ccc(CNc2cc(C)[nH+]cn2)o1 ZINC000053039161 178171347 /nfs/dbraw/zinc/17/13/47/178171347.db2.gz YOVPZCOVWSHQNB-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO Cc1cc(NCc2ccc(Cl)cn2)nc[nH+]1 ZINC000302045023 178171730 /nfs/dbraw/zinc/17/17/30/178171730.db2.gz XPMHNQSAAQGPNU-UHFFFAOYSA-N 1 2 234.690 2.446 20 0 BEADLO Cc1ncc(CNc2cc(C)[nH+]cn2)s1 ZINC000040998293 178174680 /nfs/dbraw/zinc/17/46/80/178174680.db2.gz OLGLKVLEWTXNOO-UHFFFAOYSA-N 1 2 220.301 2.162 20 0 BEADLO Cc1cc(NCc2c[nH+]cn2C)cnc1Cl ZINC000181854471 178174918 /nfs/dbraw/zinc/17/49/18/178174918.db2.gz WSDWWEOHFWIIBV-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO Cc1nc(CNc2cc(C)[nH+]cn2)cs1 ZINC000041011096 178176527 /nfs/dbraw/zinc/17/65/27/178176527.db2.gz CPLXMNDOEJPEOR-UHFFFAOYSA-N 1 2 220.301 2.162 20 0 BEADLO CC[C@H](C)[C@@H](CNc1ccc(CO)c[nH+]1)OC ZINC000381120018 398222210 /nfs/dbraw/zinc/22/22/10/398222210.db2.gz FADDMKDJWLWIMC-CMPLNLGQSA-N 1 2 238.331 2.047 20 0 BEADLO Cc1cc(N[C@@H](C)[C@H](C)CO)nc(C(C)C)[nH+]1 ZINC000134959483 178178302 /nfs/dbraw/zinc/17/83/02/178178302.db2.gz WACDQXXAEXDXDX-KOLCDFICSA-N 1 2 237.347 2.337 20 0 BEADLO Cc1cc(N[C@@H](CO)c2ccc(F)cc2)nc[nH+]1 ZINC000341468458 178180153 /nfs/dbraw/zinc/18/01/53/178180153.db2.gz FPVYIRPXIMQMBT-LBPRGKRZSA-N 1 2 247.273 2.070 20 0 BEADLO Cc1cc(N[C@H](C)C[C@@H](O)c2ccco2)nc[nH+]1 ZINC000301647083 178185176 /nfs/dbraw/zinc/18/51/76/178185176.db2.gz PZAWYYXLNAANGK-GHMZBOCLSA-N 1 2 247.298 2.302 20 0 BEADLO Cc1cc(N[C@H](C)c2cccnc2)nc[nH+]1 ZINC000040727173 178187130 /nfs/dbraw/zinc/18/71/30/178187130.db2.gz MMDGQYUASARXJO-SNVBAGLBSA-N 1 2 214.272 2.353 20 0 BEADLO Cc1cc(N[C@H](C)c2cc[nH]c(=O)c2)nc[nH+]1 ZINC000338735423 178187498 /nfs/dbraw/zinc/18/74/98/178187498.db2.gz XMDVRWXDZYXPEC-SECBINFHSA-N 1 2 230.271 2.059 20 0 BEADLO Cc1cc(N[C@]2(C)CCOC2)nc(C2CC2)[nH+]1 ZINC000339354904 178192145 /nfs/dbraw/zinc/19/21/45/178192145.db2.gz CHZNOOQVOKLDBU-CYBMUJFWSA-N 1 2 233.315 2.253 20 0 BEADLO Cc1cc(N)nc(SCCC2CC2)[nH+]1 ZINC000148615184 398227037 /nfs/dbraw/zinc/22/70/37/398227037.db2.gz RKFIILPVFSVSGO-UHFFFAOYSA-N 1 2 209.318 2.259 20 0 BEADLO C[C@H](c1ccco1)N(C)C(=O)CCc1c[nH+]c[nH]1 ZINC000276386343 538932477 /nfs/dbraw/zinc/93/24/77/538932477.db2.gz FIMAPDOOAYLMTP-SNVBAGLBSA-N 1 2 247.298 2.155 20 0 BEADLO C[C@H](c1ccco1)N(C)C(=O)CCc1c[nH]c[nH+]1 ZINC000276386343 538932479 /nfs/dbraw/zinc/93/24/79/538932479.db2.gz FIMAPDOOAYLMTP-SNVBAGLBSA-N 1 2 247.298 2.155 20 0 BEADLO Cn1c[nH+]cc1CNc1cc(F)c(F)cc1F ZINC000090167197 398228509 /nfs/dbraw/zinc/22/85/09/398228509.db2.gz WHHLUWIVHLHVGZ-UHFFFAOYSA-N 1 2 241.216 2.450 20 0 BEADLO COCCOc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000649429309 398232104 /nfs/dbraw/zinc/23/21/04/398232104.db2.gz WOECZVWHVJGGRI-UHFFFAOYSA-N 1 2 218.256 2.102 20 0 BEADLO Cc1cc([C@@H](C)[NH2+]Cc2nnc(C)n2C)c(C)o1 ZINC000044730373 178228316 /nfs/dbraw/zinc/22/83/16/178228316.db2.gz BHTHCKOFQCFWGR-SECBINFHSA-N 1 2 248.330 2.184 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2nncn2C)c(C)o1 ZINC000037017604 178230605 /nfs/dbraw/zinc/23/06/05/178230605.db2.gz HTIHKOKLNVCDGU-ZJUUUORDSA-N 1 2 248.330 2.437 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2cnn(C)c2C)no1 ZINC000337533632 178231493 /nfs/dbraw/zinc/23/14/93/178231493.db2.gz FCDJXJFRDXKBJW-VHSXEESVSA-N 1 2 248.330 2.437 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ncnn2C)c(C)o1 ZINC000278150367 178231819 /nfs/dbraw/zinc/23/18/19/178231819.db2.gz ACEDXLUIIVJUCD-ZJUUUORDSA-N 1 2 248.330 2.437 20 0 BEADLO Cc1cc([C@@H](C)[NH2+][C@H](CO)c2ccccc2)no1 ZINC000279524015 178232972 /nfs/dbraw/zinc/23/29/72/178232972.db2.gz GHJWENRRYBWTNT-BXUZGUMPSA-N 1 2 246.310 2.367 20 0 BEADLO CC(C)[C@H]1CCCCN1C(=O)CCc1c[nH+]c[nH]1 ZINC000280187370 538936450 /nfs/dbraw/zinc/93/64/50/538936450.db2.gz PWGNAWUTXHRFHW-CYBMUJFWSA-N 1 2 249.358 2.379 20 0 BEADLO CC(C)[C@H]1CCCCN1C(=O)CCc1c[nH]c[nH+]1 ZINC000280187370 538936451 /nfs/dbraw/zinc/93/64/51/538936451.db2.gz PWGNAWUTXHRFHW-CYBMUJFWSA-N 1 2 249.358 2.379 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@@H]2CCCc3cn[nH]c32)no1 ZINC000285316706 178253653 /nfs/dbraw/zinc/25/36/53/178253653.db2.gz SVUKLVXVIZDLGU-GXSJLCMTSA-N 1 2 246.314 2.434 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@@H]2CCCc3c[nH]nc32)no1 ZINC000285316706 178253655 /nfs/dbraw/zinc/25/36/55/178253655.db2.gz SVUKLVXVIZDLGU-GXSJLCMTSA-N 1 2 246.314 2.434 20 0 BEADLO CC[C@@H](C)C[C@@H](C)NC(=O)CCc1c[nH+]c[nH]1 ZINC000280313628 538937312 /nfs/dbraw/zinc/93/73/12/538937312.db2.gz YQSZDIBEIFPXNP-GHMZBOCLSA-N 1 2 237.347 2.283 20 0 BEADLO CC[C@@H](C)C[C@@H](C)NC(=O)CCc1c[nH]c[nH+]1 ZINC000280313628 538937313 /nfs/dbraw/zinc/93/73/13/538937313.db2.gz YQSZDIBEIFPXNP-GHMZBOCLSA-N 1 2 237.347 2.283 20 0 BEADLO COCCc1ccc(-c2c[nH+]cn2C)cc1 ZINC000649431250 398234179 /nfs/dbraw/zinc/23/41/79/398234179.db2.gz MRRTVYWHNJEHLM-UHFFFAOYSA-N 1 2 216.284 2.276 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2cnn(C)n2)ccc1F ZINC000287049684 178251899 /nfs/dbraw/zinc/25/18/99/178251899.db2.gz MUODUSRVBZXESK-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO Cc1cc([C@H](C)[NH2+]Cc2nccs2)nn1C ZINC000282240128 178252517 /nfs/dbraw/zinc/25/25/17/178252517.db2.gz PWTJAHHMVWMHRH-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO OC1CC(CCNc2ccc3ccccc3[nH+]2)C1 ZINC000432865364 398239218 /nfs/dbraw/zinc/23/92/18/398239218.db2.gz OTIAQQDZCZPXAV-UHFFFAOYSA-N 1 2 242.322 2.230 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2C[C@@H]2C2CC2)cc[nH+]1 ZINC000175861693 365610179 /nfs/dbraw/zinc/61/01/79/365610179.db2.gz PDQKLJIHVDHKKV-VXGBXAGGSA-N 1 2 216.284 2.375 20 0 BEADLO Cc1cc(NC(=O)[C@H]2C[C@H]2C2CC2)cc[nH+]1 ZINC000175861742 365610581 /nfs/dbraw/zinc/61/05/81/365610581.db2.gz PDQKLJIHVDHKKV-RYUDHWBXSA-N 1 2 216.284 2.375 20 0 BEADLO CCc1cnc(CN[C@H](C)c2[nH]cc[nH+]2)s1 ZINC000286148355 538943266 /nfs/dbraw/zinc/94/32/66/538943266.db2.gz PGWIKZFCTVXIEF-MRVPVSSYSA-N 1 2 236.344 2.279 20 0 BEADLO C[C@@H](NC(=O)CCC(C)(C)C)c1[nH]cc[nH+]1 ZINC000300810378 323004254 /nfs/dbraw/zinc/00/42/54/323004254.db2.gz FSZPTAJAMKWPBQ-SECBINFHSA-N 1 2 223.320 2.413 20 0 BEADLO Cc1cc2ccccc2[nH+]c1N1CC[C@@H](O)C1 ZINC000063106520 178298256 /nfs/dbraw/zinc/29/82/56/178298256.db2.gz CLUUYLQVJAPCCL-GFCCVEGCSA-N 1 2 228.295 2.114 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CC[C@H]1SC ZINC000576631312 365641824 /nfs/dbraw/zinc/64/18/24/365641824.db2.gz ZPBLIYIVYQTSTA-PSASIEDQSA-N 1 2 224.329 2.396 20 0 BEADLO Cn1c[nH+]cc1CNC(=O)[C@H]1CCCCC1(C)C ZINC000291465805 538948062 /nfs/dbraw/zinc/94/80/62/538948062.db2.gz OQDOQANPAGFAOD-GFCCVEGCSA-N 1 2 249.358 2.253 20 0 BEADLO CCC(CC)N(CC)c1[nH+]cnc2c1cnn2C ZINC000288829294 168371898 /nfs/dbraw/zinc/37/18/98/168371898.db2.gz ICIVCEVMPIULBI-UHFFFAOYSA-N 1 2 247.346 2.378 20 0 BEADLO Cc1cc(C[NH2+][C@H](C)C(F)F)ccn1 ZINC000391128663 398263424 /nfs/dbraw/zinc/26/34/24/398263424.db2.gz FKTYMBZWNJKPJB-MRVPVSSYSA-N 1 2 200.232 2.133 20 0 BEADLO C[C@@H](CC1CCC1)NC(=O)CCc1c[nH+]cn1C ZINC000634369888 361827675 /nfs/dbraw/zinc/82/76/75/361827675.db2.gz LDTBUPBWQOQKRD-NSHDSACASA-N 1 2 249.358 2.048 20 0 BEADLO Cn1cc[nH+]c1CNc1ccccc1OCCF ZINC000295045131 398264641 /nfs/dbraw/zinc/26/46/41/398264641.db2.gz FEPQKFWKUZSYOR-UHFFFAOYSA-N 1 2 249.289 2.381 20 0 BEADLO CC(C)n1cc(C[NH2+]CC(C)(F)F)cn1 ZINC000378751000 346827091 /nfs/dbraw/zinc/82/70/91/346827091.db2.gz OPXBSIXOUUFKDJ-UHFFFAOYSA-N 1 2 217.263 2.209 20 0 BEADLO CC(C)[C@H](C)N(C)C(=O)CCCn1cc[nH+]c1 ZINC000590218555 346832260 /nfs/dbraw/zinc/83/22/60/346832260.db2.gz QQAMZACTFPYQIO-LBPRGKRZSA-N 1 2 237.347 2.166 20 0 BEADLO CCC[C@@H]([NH2+][C@@H]1C[C@H]1C1CC1)C(=O)OCC ZINC000378805812 346838835 /nfs/dbraw/zinc/83/88/35/346838835.db2.gz WXKAQBLLINZEQI-QJPTWQEYSA-N 1 2 225.332 2.106 20 0 BEADLO CCc1cc(N[C@H]2C[C@@H](C)n3cc[nH+]c32)ncn1 ZINC000649471106 398271552 /nfs/dbraw/zinc/27/15/52/398271552.db2.gz NNIPWZLBNIFTEI-KOLCDFICSA-N 1 2 243.314 2.353 20 0 BEADLO CCc1cc(N[C@@H]2C[C@H](C)n3cc[nH+]c32)ncn1 ZINC000649471105 398271598 /nfs/dbraw/zinc/27/15/98/398271598.db2.gz NNIPWZLBNIFTEI-GXSJLCMTSA-N 1 2 243.314 2.353 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]CCOCCC(C)C ZINC000180327193 538957935 /nfs/dbraw/zinc/95/79/35/538957935.db2.gz AEARNTNUGPNYRD-LLVKDONJSA-N 1 2 239.363 2.431 20 0 BEADLO CCCCCNC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000649474091 398272595 /nfs/dbraw/zinc/27/25/95/398272595.db2.gz QTPYVXABACCNSW-LLVKDONJSA-N 1 2 223.320 2.141 20 0 BEADLO Cc1nn(C)cc1[C@H](C)[NH2+]CC(C)(F)F ZINC000378855529 346849466 /nfs/dbraw/zinc/84/94/66/346849466.db2.gz JXTPHMVVUGDFDU-ZETCQYMHSA-N 1 2 217.263 2.034 20 0 BEADLO CCc1cc(Nc2cnn(C)c2C)nc(C)[nH+]1 ZINC000180448750 538958497 /nfs/dbraw/zinc/95/84/97/538958497.db2.gz XXMFSBLZQNJXJK-UHFFFAOYSA-N 1 2 231.303 2.133 20 0 BEADLO OCCC[C@@H]([NH2+]CC(F)F)c1ccccc1 ZINC000179750631 538956221 /nfs/dbraw/zinc/95/62/21/538956221.db2.gz VSWXBKZNTHWOME-LLVKDONJSA-N 1 2 229.270 2.355 20 0 BEADLO C[C@@H]1CC[C@@H](C)[NH+]1Cc1nc(C(F)F)no1 ZINC000335603315 136235418 /nfs/dbraw/zinc/23/54/18/136235418.db2.gz GTIDKSUFWFXXTC-RNFRBKRXSA-N 1 2 231.246 2.380 20 0 BEADLO Cc1cc(NCC2(CO)CCC2)nc(C2CC2)[nH+]1 ZINC000182342493 538962881 /nfs/dbraw/zinc/96/28/81/538962881.db2.gz KBVMCHRKVGXUHP-UHFFFAOYSA-N 1 2 247.342 2.237 20 0 BEADLO CC(C)OC(=O)[C@H](C)[NH2+]C[C@]1(C)CCCS1 ZINC000600169034 342694796 /nfs/dbraw/zinc/69/47/96/342694796.db2.gz OCEAHGZNQGVVKB-JQWIXIFHSA-N 1 2 245.388 2.202 20 0 BEADLO COc1ccc(C[NH2+][C@@H](C)c2nnc(C)o2)cc1 ZINC000583340292 342742775 /nfs/dbraw/zinc/74/27/75/342742775.db2.gz OLHIWDGYNCOTMA-VIFPVBQESA-N 1 2 247.298 2.237 20 0 BEADLO C[C@H](C[N@H+](C)CC(F)F)C(=O)OC(C)(C)C ZINC000320131208 342732420 /nfs/dbraw/zinc/73/24/20/342732420.db2.gz GOCQDIKPRMTAPP-MRVPVSSYSA-N 1 2 237.290 2.161 20 0 BEADLO C[C@H](C[N@@H+](C)CC(F)F)C(=O)OC(C)(C)C ZINC000320131208 342732421 /nfs/dbraw/zinc/73/24/21/342732421.db2.gz GOCQDIKPRMTAPP-MRVPVSSYSA-N 1 2 237.290 2.161 20 0 BEADLO CCOCCC[N@@H+]1CCOC[C@H]1c1ccco1 ZINC000607734919 342785943 /nfs/dbraw/zinc/78/59/43/342785943.db2.gz MBZVBTJLWUMDNK-LBPRGKRZSA-N 1 2 239.315 2.080 20 0 BEADLO CCOCCC[N@H+]1CCOC[C@H]1c1ccco1 ZINC000607734919 342785944 /nfs/dbraw/zinc/78/59/44/342785944.db2.gz MBZVBTJLWUMDNK-LBPRGKRZSA-N 1 2 239.315 2.080 20 0 BEADLO CCC(CC)S(=O)(=O)Cc1[nH+]ccn1CC ZINC000081532805 168394881 /nfs/dbraw/zinc/39/48/81/168394881.db2.gz CBSXMFMAHHHFDX-UHFFFAOYSA-N 1 2 244.360 2.006 20 0 BEADLO Cc1cc(NC[C@H]2CCCC23CC3)nc[nH+]1 ZINC000624756508 342825279 /nfs/dbraw/zinc/82/52/79/342825279.db2.gz CWWVHXLSAULXRT-LLVKDONJSA-N 1 2 217.316 2.199 20 0 BEADLO OCc1ccccc1-c1c[nH+]c2n1CCCC2 ZINC000630051588 361918646 /nfs/dbraw/zinc/91/86/46/361918646.db2.gz AUYUJVIQLXVQBF-UHFFFAOYSA-N 1 2 228.295 2.379 20 0 BEADLO COc1c(C)[nH+]cnc1NC[C@@H]1CCCC12CC2 ZINC000624758214 342825845 /nfs/dbraw/zinc/82/58/45/342825845.db2.gz LNBBEMXSPFLMNV-NSHDSACASA-N 1 2 247.342 2.208 20 0 BEADLO COc1ccc(N[C@@H](C)[C@H]2CCCCO2)[nH+]c1 ZINC000379206733 538976461 /nfs/dbraw/zinc/97/64/61/538976461.db2.gz BRENKFIDGSWBSL-CMPLNLGQSA-N 1 2 236.315 2.460 20 0 BEADLO CC1(C)CC[C@H](C[N@@H+]2CCC(F)(F)C2)O1 ZINC000336477539 342807640 /nfs/dbraw/zinc/80/76/40/342807640.db2.gz MSOANYPMLAAJMV-SECBINFHSA-N 1 2 219.275 2.285 20 0 BEADLO CC1(C)CC[C@H](C[N@H+]2CCC(F)(F)C2)O1 ZINC000336477539 342807642 /nfs/dbraw/zinc/80/76/42/342807642.db2.gz MSOANYPMLAAJMV-SECBINFHSA-N 1 2 219.275 2.285 20 0 BEADLO Cn1ccc(C[NH2+][C@@H]2CCCC2(F)F)c1 ZINC000380168196 538986547 /nfs/dbraw/zinc/98/65/47/538986547.db2.gz FTAGZUVGSVLDKH-SNVBAGLBSA-N 1 2 214.259 2.303 20 0 BEADLO Cc1ccc(NC(=O)CCc2c[nH+]c[nH]2)cc1F ZINC000188869213 538979668 /nfs/dbraw/zinc/97/96/68/538979668.db2.gz BDAAFLKIBDJHNE-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO Cc1ccc(NC(=O)CCc2c[nH]c[nH+]2)cc1F ZINC000188869213 538979670 /nfs/dbraw/zinc/97/96/70/538979670.db2.gz BDAAFLKIBDJHNE-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO Cc1cc(CNC(=O)[C@]2(C)C[C@H]2F)cc(C)[nH+]1 ZINC000335622999 136240224 /nfs/dbraw/zinc/24/02/24/136240224.db2.gz GHBKGHPOTMHGNX-DGCLKSJQSA-N 1 2 236.290 2.063 20 0 BEADLO C[C@H]1CCC[C@H](C)N(C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000189429896 538982594 /nfs/dbraw/zinc/98/25/94/538982594.db2.gz NFEKMZYJNSNQPU-RYUDHWBXSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H]1CCC[C@H](C)N(C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000189429896 538982596 /nfs/dbraw/zinc/98/25/96/538982596.db2.gz NFEKMZYJNSNQPU-RYUDHWBXSA-N 1 2 249.358 2.379 20 0 BEADLO Cc1nc([C@H](C)NCC[NH+]2CCC2)c(C)s1 ZINC000381451323 539000767 /nfs/dbraw/zinc/00/07/67/539000767.db2.gz HJSXUKFGFOPAIE-VIFPVBQESA-N 1 2 239.388 2.116 20 0 BEADLO Cc1ccncc1[C@@H](C)[NH2+]Cc1csnn1 ZINC000381452479 539000885 /nfs/dbraw/zinc/00/08/85/539000885.db2.gz HEEKEGXKWLICHC-SECBINFHSA-N 1 2 234.328 2.092 20 0 BEADLO C[C@H]([NH2+]Cc1cocn1)c1ccc(F)cn1 ZINC000381519574 539002537 /nfs/dbraw/zinc/00/25/37/539002537.db2.gz UAXTVAXAAOJHEQ-QMMMGPOBSA-N 1 2 221.235 2.060 20 0 BEADLO Cc1noc(C)c1[C@H](C)[NH2+]Cc1ccon1 ZINC000381530305 539003263 /nfs/dbraw/zinc/00/32/63/539003263.db2.gz YRZFDTVLNVCODG-ZETCQYMHSA-N 1 2 221.260 2.130 20 0 BEADLO C[C@H]1CCN(C(=O)CCc2c[nH+]c[nH]2)C[C@@H](C)C1 ZINC000193664431 539007515 /nfs/dbraw/zinc/00/75/15/539007515.db2.gz AWCROZICEUCHHA-RYUDHWBXSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@H]1CCN(C(=O)CCc2c[nH]c[nH+]2)C[C@@H](C)C1 ZINC000193664431 539007517 /nfs/dbraw/zinc/00/75/17/539007517.db2.gz AWCROZICEUCHHA-RYUDHWBXSA-N 1 2 249.358 2.237 20 0 BEADLO Fc1cccnc1NCc1c[nH+]c2ccccn12 ZINC000195311380 539010534 /nfs/dbraw/zinc/01/05/34/539010534.db2.gz BIIBKDAEWYSTTP-UHFFFAOYSA-N 1 2 242.257 2.481 20 0 BEADLO c1coc(CNc2cc3cc[nH]c3c[nH+]2)c1 ZINC000390209149 539020398 /nfs/dbraw/zinc/02/03/98/539020398.db2.gz UHTBQLYMCWNSMF-UHFFFAOYSA-N 1 2 213.240 2.190 20 0 BEADLO Cc1nnc([C@H](C)[NH2+]Cc2ccc(C)nc2)s1 ZINC000391863867 539027785 /nfs/dbraw/zinc/02/77/85/539027785.db2.gz RPAIIUHBJKCBJX-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO Cc1cc(C[NH2+][C@@H]2CCCC[C@H]2F)no1 ZINC000335632849 136241709 /nfs/dbraw/zinc/24/17/09/136241709.db2.gz ZGOZBHNUSUVMOR-GHMZBOCLSA-N 1 2 212.268 2.353 20 0 BEADLO CC[C@@H](C)N(C)C(=O)[C@H]1CCn2cc(C)[nH+]c2C1 ZINC000624983747 342840550 /nfs/dbraw/zinc/84/05/50/342840550.db2.gz UKHBGQLNVOVDSW-NEPJUHHUSA-N 1 2 249.358 2.011 20 0 BEADLO CCc1cc(N[C@H](C)[C@@H]2CCCOC2)nc[nH+]1 ZINC000388898156 539015698 /nfs/dbraw/zinc/01/56/98/539015698.db2.gz MDCLDOWRCYBHDO-GHMZBOCLSA-N 1 2 235.331 2.266 20 0 BEADLO CC=CC[NH2+][C@@H](c1cccs1)c1nnc[nH]1 ZINC000624199038 342841384 /nfs/dbraw/zinc/84/13/84/342841384.db2.gz DXPXVKCEWZTYCE-ZMWSMAPVSA-N 1 2 234.328 2.121 20 0 BEADLO CCOC[C@H]1CCC[C@H]1Nc1c[nH]c[nH+]1 ZINC000389996895 539019499 /nfs/dbraw/zinc/01/94/99/539019499.db2.gz QULDALVYEBNYEP-NXEZZACHSA-N 1 2 209.293 2.027 20 0 BEADLO CC[C@@H]1C[C@H](C)CN1C(=O)CCCn1cc[nH+]c1 ZINC000073344119 342845920 /nfs/dbraw/zinc/84/59/20/342845920.db2.gz ZQUJLQWCOCVWOA-QWHCGFSZSA-N 1 2 249.358 2.310 20 0 BEADLO Clc1cccnc1C[NH+]1CCSCC1 ZINC000625084191 342849065 /nfs/dbraw/zinc/84/90/65/342849065.db2.gz XLOBQZLUOKLOLP-UHFFFAOYSA-N 1 2 228.748 2.284 20 0 BEADLO CCCCc1cc(NCC(C)(C)OC)nc[nH+]1 ZINC000631133972 342864127 /nfs/dbraw/zinc/86/41/27/342864127.db2.gz XUNCZPBMTOVEIT-UHFFFAOYSA-N 1 2 237.347 2.078 20 0 BEADLO COc1cncc(C[N@H+](C)[C@@H](C)c2ccco2)n1 ZINC000625111576 342865189 /nfs/dbraw/zinc/86/51/89/342865189.db2.gz PPBNSXWYXJMEBY-JTQLQIEISA-N 1 2 247.298 2.271 20 0 BEADLO COc1cncc(C[N@@H+](C)[C@@H](C)c2ccco2)n1 ZINC000625111576 342865190 /nfs/dbraw/zinc/86/51/90/342865190.db2.gz PPBNSXWYXJMEBY-JTQLQIEISA-N 1 2 247.298 2.271 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)Nc1nc(Cl)cs1 ZINC000165006804 342866204 /nfs/dbraw/zinc/86/62/04/342866204.db2.gz XZLWCQPLPGMTAP-SSDOTTSWSA-N 1 2 242.735 2.494 20 0 BEADLO C[C@H]1C[NH+](Cc2noc(C(C)(C)C)n2)C[C@@H]1C ZINC000076110487 342897969 /nfs/dbraw/zinc/89/79/69/342897969.db2.gz UMUIJWCZQOIKJB-UWVGGRQHSA-N 1 2 237.347 2.455 20 0 BEADLO CC[NH+](CC)CC(=O)c1ccccc1F ZINC000034988987 342881923 /nfs/dbraw/zinc/88/19/23/342881923.db2.gz ZZWYOOXKNKEQFS-UHFFFAOYSA-N 1 2 209.264 2.350 20 0 BEADLO C[N@H+](Cc1noc(C2CCC2)n1)C1CCC1 ZINC000625191788 342906406 /nfs/dbraw/zinc/90/64/06/342906406.db2.gz STUCCXLCXOZVHP-UHFFFAOYSA-N 1 2 221.304 2.321 20 0 BEADLO C[N@@H+](Cc1noc(C2CCC2)n1)C1CCC1 ZINC000625191788 342906408 /nfs/dbraw/zinc/90/64/08/342906408.db2.gz STUCCXLCXOZVHP-UHFFFAOYSA-N 1 2 221.304 2.321 20 0 BEADLO CC[C@@H](N[C@@H](C)c1[nH]cc[nH+]1)C(F)F ZINC000453247064 488186364 /nfs/dbraw/zinc/18/63/64/488186364.db2.gz NTFNYMGXFSINMA-NKWVEPMBSA-N 1 2 203.236 2.104 20 0 BEADLO CCc1cc(NCCCC(C)(C)CO)nc[nH+]1 ZINC000078303669 342911198 /nfs/dbraw/zinc/91/11/98/342911198.db2.gz NMLSRIRWTYZTFF-UHFFFAOYSA-N 1 2 237.347 2.250 20 0 BEADLO CCc1occc1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000234170214 342917190 /nfs/dbraw/zinc/91/71/90/342917190.db2.gz QDEABBSGAWVWDJ-MRVPVSSYSA-N 1 2 233.271 2.056 20 0 BEADLO Cc1noc(C[N@@H+]2CC[C@H](CC(F)(F)F)C2)n1 ZINC000351626544 136248913 /nfs/dbraw/zinc/24/89/13/136248913.db2.gz DDCGWPPDBHTAFB-MRVPVSSYSA-N 1 2 249.236 2.152 20 0 BEADLO Cc1noc(C[N@H+]2CC[C@H](CC(F)(F)F)C2)n1 ZINC000351626544 136248914 /nfs/dbraw/zinc/24/89/14/136248914.db2.gz DDCGWPPDBHTAFB-MRVPVSSYSA-N 1 2 249.236 2.152 20 0 BEADLO C[C@H](CC(=O)NC1(C2CCC2)CC1)n1cc[nH+]c1 ZINC000650658968 398336366 /nfs/dbraw/zinc/33/63/66/398336366.db2.gz WYSBQGHGQCXORO-LLVKDONJSA-N 1 2 247.342 2.283 20 0 BEADLO C[C@@H]1CC[C@@H](CC(=O)N2CCc3[nH]c[nH+]c3C2)C1 ZINC000627368884 346889562 /nfs/dbraw/zinc/88/95/62/346889562.db2.gz FOIDQTKIFWJZFY-GHMZBOCLSA-N 1 2 247.342 2.121 20 0 BEADLO C[C@@H]1CC[C@@H](CC(=O)N2CCc3[nH+]c[nH]c3C2)C1 ZINC000627368884 346889563 /nfs/dbraw/zinc/88/95/63/346889563.db2.gz FOIDQTKIFWJZFY-GHMZBOCLSA-N 1 2 247.342 2.121 20 0 BEADLO CC[C@H](NC(=O)/C=C/c1[nH]cc[nH+]1)[C@H]1CC1(C)C ZINC000493466190 529457012 /nfs/dbraw/zinc/45/70/12/529457012.db2.gz NBUAFJFMCNIYIY-PVTPVBHGSA-N 1 2 247.342 2.364 20 0 BEADLO CC[C@H]([NH2+]Cc1cnc(C)nc1)c1nccs1 ZINC000351728880 136250231 /nfs/dbraw/zinc/25/02/31/136250231.db2.gz IQEHLPNETDSMJS-NSHDSACASA-N 1 2 248.355 2.482 20 0 BEADLO COC(=O)c1csc(C[N@@H+]2CC[C@@H](F)C2)c1 ZINC000602673381 349667516 /nfs/dbraw/zinc/66/75/16/349667516.db2.gz AWFYVSIGODIMBS-SECBINFHSA-N 1 2 243.303 2.079 20 0 BEADLO COC(=O)c1csc(C[N@H+]2CC[C@@H](F)C2)c1 ZINC000602673381 349667519 /nfs/dbraw/zinc/66/75/19/349667519.db2.gz AWFYVSIGODIMBS-SECBINFHSA-N 1 2 243.303 2.079 20 0 BEADLO C[C@@H]1CCC[N@@H+]1CC(=O)c1ccccc1F ZINC000037911536 398335181 /nfs/dbraw/zinc/33/51/81/398335181.db2.gz FDTLZWYPFCCTLZ-SNVBAGLBSA-N 1 2 221.275 2.493 20 0 BEADLO C[C@@H]1CCC[N@H+]1CC(=O)c1ccccc1F ZINC000037911536 398335182 /nfs/dbraw/zinc/33/51/82/398335182.db2.gz FDTLZWYPFCCTLZ-SNVBAGLBSA-N 1 2 221.275 2.493 20 0 BEADLO CCc1cccc(C[N@@H+]2CCO[C@H]3C[C@H]32)c1 ZINC000368336328 398343897 /nfs/dbraw/zinc/34/38/97/398343897.db2.gz MRXVBKLSUVKTSX-KGLIPLIRSA-N 1 2 217.312 2.222 20 0 BEADLO CCc1cccc(C[N@H+]2CCO[C@H]3C[C@H]32)c1 ZINC000368336328 398343898 /nfs/dbraw/zinc/34/38/98/398343898.db2.gz MRXVBKLSUVKTSX-KGLIPLIRSA-N 1 2 217.312 2.222 20 0 BEADLO Cc1nc([C@H]2CCC[N@H+]2CC[C@H](C)F)no1 ZINC000351759873 136252543 /nfs/dbraw/zinc/25/25/43/136252543.db2.gz MSHVZOUPPZMKJF-WCBMZHEXSA-N 1 2 227.283 2.263 20 0 BEADLO Cc1nc([C@H]2CCC[N@@H+]2CC[C@H](C)F)no1 ZINC000351759873 136252544 /nfs/dbraw/zinc/25/25/44/136252544.db2.gz MSHVZOUPPZMKJF-WCBMZHEXSA-N 1 2 227.283 2.263 20 0 BEADLO CC[C@@]1(C)CCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492869658 529524673 /nfs/dbraw/zinc/52/46/73/529524673.db2.gz VBSALCMZYBZSKD-IHVVCDCBSA-N 1 2 233.315 2.072 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N1CC[C@H]1C(C)C ZINC000492387208 529552145 /nfs/dbraw/zinc/55/21/45/529552145.db2.gz PAIDGZVRXFDJEE-FYJFLYSWSA-N 1 2 247.342 2.173 20 0 BEADLO Cn1c2ccccc2nc1[C@@H]([NH3+])c1ccccn1 ZINC000019930118 342963644 /nfs/dbraw/zinc/96/36/44/342963644.db2.gz XFSJJLJQKQFTTN-ZDUSSCGKSA-N 1 2 238.294 2.016 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N(C)[C@H]1CC1(C)C ZINC000492998050 529549827 /nfs/dbraw/zinc/54/98/27/529549827.db2.gz OOZNSPZTNWGDQO-MLRMMBSGSA-N 1 2 247.342 2.173 20 0 BEADLO CSC1CCN(Cc2[nH]c(C)c(C)[nH+]2)CC1 ZINC000602726597 349715621 /nfs/dbraw/zinc/71/56/21/349715621.db2.gz OJSRQPLZANSIGD-UHFFFAOYSA-N 1 2 239.388 2.354 20 0 BEADLO CCn1cc[nH+]c1CN(C)[C@@H](C)c1cccnc1 ZINC000162468211 349715665 /nfs/dbraw/zinc/71/56/65/349715665.db2.gz UIYYTSTWIMHWPJ-LBPRGKRZSA-N 1 2 244.342 2.491 20 0 BEADLO C[C@H]1CC[N@H+](CC2=CCCOC2)CC1(F)F ZINC000335902515 136259752 /nfs/dbraw/zinc/25/97/52/136259752.db2.gz AYXDXANPDPCYHA-JTQLQIEISA-N 1 2 231.286 2.310 20 0 BEADLO C[C@H]1CC[N@@H+](CC2=CCCOC2)CC1(F)F ZINC000335902515 136259753 /nfs/dbraw/zinc/25/97/53/136259753.db2.gz AYXDXANPDPCYHA-JTQLQIEISA-N 1 2 231.286 2.310 20 0 BEADLO CCC(F)(F)C[N@@H+]1CC[C@@H](SC)C1 ZINC000602837071 349776473 /nfs/dbraw/zinc/77/64/73/349776473.db2.gz SZQOMYFIZBLXMU-MRVPVSSYSA-N 1 2 209.305 2.469 20 0 BEADLO CCC(F)(F)C[N@H+]1CC[C@@H](SC)C1 ZINC000602837071 349776475 /nfs/dbraw/zinc/77/64/75/349776475.db2.gz SZQOMYFIZBLXMU-MRVPVSSYSA-N 1 2 209.305 2.469 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccon2)C[C@H](C)C1(F)F ZINC000625646302 344024407 /nfs/dbraw/zinc/02/44/07/344024407.db2.gz AMBACTFKHVNCAQ-DTORHVGOSA-N 1 2 230.258 2.398 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccon2)C[C@H](C)C1(F)F ZINC000625646302 344024410 /nfs/dbraw/zinc/02/44/10/344024410.db2.gz AMBACTFKHVNCAQ-DTORHVGOSA-N 1 2 230.258 2.398 20 0 BEADLO CCCC(=O)NCCn1c(C)[nH+]c2ccccc21 ZINC000021971595 343031448 /nfs/dbraw/zinc/03/14/48/343031448.db2.gz CBDZSXIQHXXXGX-UHFFFAOYSA-N 1 2 245.326 2.261 20 0 BEADLO CC[C@H](C)CN(CC)C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493203900 529651950 /nfs/dbraw/zinc/65/19/50/529651950.db2.gz SSRWSOKRCDYLCI-MLRMMBSGSA-N 1 2 235.331 2.318 20 0 BEADLO CC[C@H](C)CN(CC)C(=O)/C=C\c1[nH]cc[nH+]1 ZINC000493203904 529652107 /nfs/dbraw/zinc/65/21/07/529652107.db2.gz SSRWSOKRCDYLCI-ZADCQDASSA-N 1 2 235.331 2.318 20 0 BEADLO CCc1nc(C)c(C[NH2+]Cc2cc(C)no2)o1 ZINC000383198041 362010944 /nfs/dbraw/zinc/01/09/44/362010944.db2.gz UJWIEBNDXIZRGR-UHFFFAOYSA-N 1 2 235.287 2.132 20 0 BEADLO FC1(F)C[C@@H]1CC[NH+]=c1[nH]c2ccccc2[nH]1 ZINC000621344644 343106198 /nfs/dbraw/zinc/10/61/98/343106198.db2.gz OMURWECFDRRIJM-QMMMGPOBSA-N 1 2 237.253 2.442 20 0 BEADLO CC(C)[C@@H](C)CC(=O)N(C)Cc1[nH+]ccn1C ZINC000067901165 362098001 /nfs/dbraw/zinc/09/80/01/362098001.db2.gz VBRRPFCLPHBPCG-NSHDSACASA-N 1 2 237.347 2.061 20 0 BEADLO Cc1cc(CNC(=O)[C@@H](C)C2CC2)cc(C)[nH+]1 ZINC000421577460 192355527 /nfs/dbraw/zinc/35/55/27/192355527.db2.gz OXLQXDIUXKMRJZ-NSHDSACASA-N 1 2 232.327 2.361 20 0 BEADLO C[C@H](C(=O)NCCCCn1cc[nH+]c1)C1CCC1 ZINC000576920218 365721333 /nfs/dbraw/zinc/72/13/33/365721333.db2.gz PQWAADSEQFYWPS-LBPRGKRZSA-N 1 2 249.358 2.216 20 0 BEADLO COc1c(N)[nH+]cnc1N[C@H]1CCC(C)(C)C1 ZINC000130122556 343180010 /nfs/dbraw/zinc/18/00/10/343180010.db2.gz XHWIAFAZQBEDAN-QMMMGPOBSA-N 1 2 236.319 2.058 20 0 BEADLO COc1c(N)nc[nH+]c1N[C@H]1CCC(C)(C)C1 ZINC000130122556 343180011 /nfs/dbraw/zinc/18/00/11/343180011.db2.gz XHWIAFAZQBEDAN-QMMMGPOBSA-N 1 2 236.319 2.058 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2C[C@H]2C2CCCCC2)n1 ZINC000576959520 365734124 /nfs/dbraw/zinc/73/41/24/365734124.db2.gz ZUDDYXCYKKAOEH-WDEREUQCSA-N 1 2 235.331 2.473 20 0 BEADLO C[C@@H](NC(=O)c1ccc(Cl)o1)c1[nH]cc[nH+]1 ZINC000125366995 343173097 /nfs/dbraw/zinc/17/30/97/343173097.db2.gz SQANDIPTWDVBTG-ZCFIWIBFSA-N 1 2 239.662 2.147 20 0 BEADLO CC[C@H](C(=O)OC)[N@H+](CC)Cc1ccoc1 ZINC000608840317 343220748 /nfs/dbraw/zinc/22/07/48/343220748.db2.gz RCLFZUXPCIBSAU-LLVKDONJSA-N 1 2 225.288 2.053 20 0 BEADLO CC[C@H](C(=O)OC)[N@@H+](CC)Cc1ccoc1 ZINC000608840317 343220750 /nfs/dbraw/zinc/22/07/50/343220750.db2.gz RCLFZUXPCIBSAU-LLVKDONJSA-N 1 2 225.288 2.053 20 0 BEADLO CC1(C)CC(C[N@@H+]2C[C@H](O)CC(F)(F)C2)C1 ZINC000625365160 343259416 /nfs/dbraw/zinc/25/94/16/343259416.db2.gz CSCAQUIIHNYRQT-SNVBAGLBSA-N 1 2 233.302 2.125 20 0 BEADLO CC1(C)CC(C[N@H+]2C[C@H](O)CC(F)(F)C2)C1 ZINC000625365160 343259417 /nfs/dbraw/zinc/25/94/17/343259417.db2.gz CSCAQUIIHNYRQT-SNVBAGLBSA-N 1 2 233.302 2.125 20 0 BEADLO C[C@@H]([NH2+]Cc1ccsc1)c1nnc2n1CCC2 ZINC000035255287 343290958 /nfs/dbraw/zinc/29/09/58/343290958.db2.gz RYARXKSZNYAPKV-SECBINFHSA-N 1 2 248.355 2.137 20 0 BEADLO COC(=O)C(C)(C)[NH2+]Cc1ccccc1C ZINC000037085254 343333564 /nfs/dbraw/zinc/33/35/64/343333564.db2.gz AAJJBUNDXJTTJM-UHFFFAOYSA-N 1 2 221.300 2.036 20 0 BEADLO C[C@@H]([NH2+]Cc1csnn1)c1ccccc1 ZINC000036901797 343327198 /nfs/dbraw/zinc/32/71/98/343327198.db2.gz VNVWRZDABGHSCA-SECBINFHSA-N 1 2 219.313 2.389 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ccccc1F)c1nncn1C ZINC000037017273 343330601 /nfs/dbraw/zinc/33/06/01/343330601.db2.gz LTPWSPLAXJRVGG-NXEZZACHSA-N 1 2 248.305 2.366 20 0 BEADLO Cc1[nH]ncc1C[NH2+]Cc1ccc(C)cc1 ZINC000035273956 343292018 /nfs/dbraw/zinc/29/20/18/343292018.db2.gz VGXTZGWRDNCIAA-UHFFFAOYSA-N 1 2 215.300 2.316 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)NC12CCC(CC1)CC2 ZINC000584037379 343298081 /nfs/dbraw/zinc/29/80/81/343298081.db2.gz YYUTUGPUZYFWRA-UHFFFAOYSA-N 1 2 247.342 2.181 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)CCC(C)(C)C ZINC000348712082 136293854 /nfs/dbraw/zinc/29/38/54/136293854.db2.gz HJZMYYKEEYFNIH-NSHDSACASA-N 1 2 237.347 2.214 20 0 BEADLO Cc1cnc(CNc2cc[nH+]c(C)n2)s1 ZINC000078425422 343368400 /nfs/dbraw/zinc/36/84/00/343368400.db2.gz OFMDSGVJGVSHJM-UHFFFAOYSA-N 1 2 220.301 2.162 20 0 BEADLO CC[C@H]([NH2+]Cc1cc[nH]n1)c1nccs1 ZINC000070633943 343336430 /nfs/dbraw/zinc/33/64/30/343336430.db2.gz OJVPFTJOPFYZIZ-VIFPVBQESA-N 1 2 222.317 2.107 20 0 BEADLO CCc1csc(NCc2[nH+]ccn2C)n1 ZINC000070853764 343338898 /nfs/dbraw/zinc/33/88/98/343338898.db2.gz ZULFOKWFJMFCIV-UHFFFAOYSA-N 1 2 222.317 2.051 20 0 BEADLO COC(=O)C(C)(C)[NH2+][C@H]1CCc2ccccc2C1 ZINC000037304468 343343172 /nfs/dbraw/zinc/34/31/72/343343172.db2.gz IRNYLBDPRFYYBZ-ZDUSSCGKSA-N 1 2 247.338 2.085 20 0 BEADLO CC[C@@H](O)Cn1c[nH+]c2cc(C)c(C)cc21 ZINC000037694325 343351945 /nfs/dbraw/zinc/35/19/45/343351945.db2.gz VHQOROOOFZUTKA-LLVKDONJSA-N 1 2 218.300 2.424 20 0 BEADLO Cc1nc(C[N@@H+]2CCO[C@H]3CCC[C@@H]32)oc1C ZINC000335669413 136312494 /nfs/dbraw/zinc/31/24/94/136312494.db2.gz ZHJBXYHIBJYMRW-RYUDHWBXSA-N 1 2 236.315 2.045 20 0 BEADLO Cc1nc(C[N@H+]2CCO[C@H]3CCC[C@@H]32)oc1C ZINC000335669413 136312495 /nfs/dbraw/zinc/31/24/95/136312495.db2.gz ZHJBXYHIBJYMRW-RYUDHWBXSA-N 1 2 236.315 2.045 20 0 BEADLO Cc1cnc([C@@H](C)[NH+]2CCSCC2)o1 ZINC000335665277 136316245 /nfs/dbraw/zinc/31/62/45/136316245.db2.gz UVYCPYKGRYMMJN-SECBINFHSA-N 1 2 212.318 2.093 20 0 BEADLO Cc1cc(CNC(=O)C2CCC2)cc(C)[nH+]1 ZINC000421557317 192361124 /nfs/dbraw/zinc/36/11/24/192361124.db2.gz LGRMHYDLFGDJAS-UHFFFAOYSA-N 1 2 218.300 2.115 20 0 BEADLO Cc1c([C@H](C)[NH2+]Cc2cscn2)cnn1C ZINC000040436112 343403061 /nfs/dbraw/zinc/40/30/61/343403061.db2.gz MZNLXEIDUTYJNI-QMMMGPOBSA-N 1 2 236.344 2.036 20 0 BEADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1ccccn1)CO2 ZINC000335699659 136328106 /nfs/dbraw/zinc/32/81/06/136328106.db2.gz CIWICCIRMSLYNX-CYBMUJFWSA-N 1 2 244.269 2.444 20 0 BEADLO COC(=O)[C@H](C)[N@@H+]1CCCc2sccc2C1 ZINC000609338412 343419841 /nfs/dbraw/zinc/41/98/41/343419841.db2.gz CFOARJNQWSRWQS-VIFPVBQESA-N 1 2 239.340 2.058 20 0 BEADLO COC(=O)[C@H](C)[N@H+]1CCCc2sccc2C1 ZINC000609338412 343419842 /nfs/dbraw/zinc/41/98/42/343419842.db2.gz CFOARJNQWSRWQS-VIFPVBQESA-N 1 2 239.340 2.058 20 0 BEADLO C[C@H](CC(=O)N1CCn2cc[nH+]c2C1)C(C)(C)C ZINC000335679249 136319794 /nfs/dbraw/zinc/31/97/94/136319794.db2.gz DFMJWNQXLSTBHM-LLVKDONJSA-N 1 2 249.358 2.298 20 0 BEADLO Cc1nc(C(C)C)oc1Cn1cc[nH+]c1 ZINC000335735943 136350412 /nfs/dbraw/zinc/35/04/12/136350412.db2.gz PCUUTRVELHLXMG-UHFFFAOYSA-N 1 2 205.261 2.351 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@H](n3cccn3)C2)no1 ZINC000335737814 136351100 /nfs/dbraw/zinc/35/11/00/136351100.db2.gz ZCIJZVPWAGHAAC-CYBMUJFWSA-N 1 2 246.314 2.017 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@H](n3cccn3)C2)no1 ZINC000335737814 136351101 /nfs/dbraw/zinc/35/11/01/136351101.db2.gz ZCIJZVPWAGHAAC-CYBMUJFWSA-N 1 2 246.314 2.017 20 0 BEADLO C/C=C/c1cn(Cc2cc[nH+]c(C)c2)nn1 ZINC000641088346 362211640 /nfs/dbraw/zinc/21/16/40/362211640.db2.gz HCYAUFSYJCJDMI-ONEGZZNKSA-N 1 2 214.272 2.063 20 0 BEADLO C[C@H]1CC[N@H+](C[C@H]2CCCO2)CC1(F)F ZINC000335681423 136328941 /nfs/dbraw/zinc/32/89/41/136328941.db2.gz AAWMWNROBUVPER-VHSXEESVSA-N 1 2 219.275 2.143 20 0 BEADLO C[C@H]1CC[N@@H+](C[C@H]2CCCO2)CC1(F)F ZINC000335681423 136328942 /nfs/dbraw/zinc/32/89/42/136328942.db2.gz AAWMWNROBUVPER-VHSXEESVSA-N 1 2 219.275 2.143 20 0 BEADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ncc[nH]1 ZINC000335714879 136338817 /nfs/dbraw/zinc/33/88/17/136338817.db2.gz SRKNYTQNAFUZRK-YUMQZZPRSA-N 1 2 233.237 2.182 20 0 BEADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ncc[nH]1 ZINC000335714879 136338818 /nfs/dbraw/zinc/33/88/18/136338818.db2.gz SRKNYTQNAFUZRK-YUMQZZPRSA-N 1 2 233.237 2.182 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+]2CCO[C@H](C3CC3)C2)o1 ZINC000335853998 136355724 /nfs/dbraw/zinc/35/57/24/136355724.db2.gz CSUJNNGRZOVUIN-PWSUYJOCSA-N 1 2 236.315 2.155 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+]2CCO[C@H](C3CC3)C2)o1 ZINC000335853998 136355725 /nfs/dbraw/zinc/35/57/25/136355725.db2.gz CSUJNNGRZOVUIN-PWSUYJOCSA-N 1 2 236.315 2.155 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+]2CCO[C@H](C3CC3)C2)o1 ZINC000335853996 136356006 /nfs/dbraw/zinc/35/60/06/136356006.db2.gz CSUJNNGRZOVUIN-JQWIXIFHSA-N 1 2 236.315 2.155 20 0 BEADLO Cc1cnc([C@H](C)[N@H+]2CCO[C@H](C3CC3)C2)o1 ZINC000335853996 136356007 /nfs/dbraw/zinc/35/60/07/136356007.db2.gz CSUJNNGRZOVUIN-JQWIXIFHSA-N 1 2 236.315 2.155 20 0 BEADLO Cc1nccc(C[N@H+](C)Cc2ccco2)n1 ZINC000350281518 136357432 /nfs/dbraw/zinc/35/74/32/136357432.db2.gz YEXKUXDATDZZNZ-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1nccc(C[N@@H+](C)Cc2ccco2)n1 ZINC000350281518 136357433 /nfs/dbraw/zinc/35/74/33/136357433.db2.gz YEXKUXDATDZZNZ-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cn1c2cccc(F)c2[nH]c1=[NH+][C@H]1CC1(C)C ZINC000350289550 136357792 /nfs/dbraw/zinc/35/77/92/136357792.db2.gz RAPWCEDFASOAKV-JTQLQIEISA-N 1 2 233.290 2.345 20 0 BEADLO CO[C@H](C)C[NH2+]CCc1cccc(C)c1 ZINC000167059975 136367849 /nfs/dbraw/zinc/36/78/49/136367849.db2.gz VPOYQKRAAVXKOA-GFCCVEGCSA-N 1 2 207.317 2.162 20 0 BEADLO CCOC(=O)[C@H](CC)[N@H+](C)CCC(F)(F)F ZINC000083889924 343506532 /nfs/dbraw/zinc/50/65/32/343506532.db2.gz LFJDVBZVYSURSH-QMMMGPOBSA-N 1 2 241.253 2.212 20 0 BEADLO CCOC(=O)[C@H](CC)[N@@H+](C)CCC(F)(F)F ZINC000083889924 343506533 /nfs/dbraw/zinc/50/65/33/343506533.db2.gz LFJDVBZVYSURSH-QMMMGPOBSA-N 1 2 241.253 2.212 20 0 BEADLO CC[N@H+](Cc1nncn1C)Cc1ccc(C)cc1 ZINC000536356477 343509626 /nfs/dbraw/zinc/50/96/26/343509626.db2.gz YAABNQLVXZPDOV-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CC[N@@H+](Cc1nncn1C)Cc1ccc(C)cc1 ZINC000536356477 343509628 /nfs/dbraw/zinc/50/96/28/343509628.db2.gz YAABNQLVXZPDOV-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO C[C@@H](CC(=O)N1C[C@@H]2CCCC[C@@H]21)n1cc[nH+]c1 ZINC000616721918 343549454 /nfs/dbraw/zinc/54/94/54/343549454.db2.gz PMVGBSRFOWTWKL-AVGNSLFASA-N 1 2 247.342 2.235 20 0 BEADLO CC[C@H]([NH2+][C@@H]1C[C@]1(C)c1ccccc1)C(=O)OC ZINC000619183039 343544761 /nfs/dbraw/zinc/54/47/61/343544761.db2.gz MZBFKUJETBXYJH-GZBFAFLISA-N 1 2 247.338 2.258 20 0 BEADLO CC[C@H]([NH2+][C@H]1C[C@@]1(C)c1ccccc1)C(=O)OC ZINC000619183043 343544802 /nfs/dbraw/zinc/54/48/02/343544802.db2.gz MZBFKUJETBXYJH-YDHLFZDLSA-N 1 2 247.338 2.258 20 0 BEADLO Cc1cc(F)cc(NC(=O)Cc2c[nH+]cn2C)c1 ZINC000577015300 365767133 /nfs/dbraw/zinc/76/71/33/365767133.db2.gz PYRLHIVXZFNTIH-UHFFFAOYSA-N 1 2 247.273 2.049 20 0 BEADLO CCc1cc(N[C@H](COC)C(C)C)nc[nH+]1 ZINC000083400320 343595443 /nfs/dbraw/zinc/59/54/43/343595443.db2.gz TWCMYFHTYJSZJW-LLVKDONJSA-N 1 2 223.320 2.122 20 0 BEADLO CC1(C)C[C@]1(C)NC(=O)c1ccc2[nH+]ccn2c1 ZINC000620077387 343637884 /nfs/dbraw/zinc/63/78/84/343637884.db2.gz AAKQEFBIOITFHF-AWEZNQCLSA-N 1 2 243.310 2.253 20 0 BEADLO CCc1nc(C[N@H+](C)C[C@@H]2CCCO2)cs1 ZINC000052102522 343631933 /nfs/dbraw/zinc/63/19/33/343631933.db2.gz ODACXQKMWIHYDI-NSHDSACASA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nc(C[N@@H+](C)C[C@@H]2CCCO2)cs1 ZINC000052102522 343631934 /nfs/dbraw/zinc/63/19/34/343631934.db2.gz ODACXQKMWIHYDI-NSHDSACASA-N 1 2 240.372 2.316 20 0 BEADLO Cc1cc(CNC(=O)C[C@@H]2C[C@H]2C)cc(C)[nH+]1 ZINC000421573777 192364450 /nfs/dbraw/zinc/36/44/50/192364450.db2.gz CABRSOPQOCIIMZ-RNCFNFMXSA-N 1 2 232.327 2.361 20 0 BEADLO Cc1cc(N2CC[C@@H](c3ccncc3)C2)nc[nH+]1 ZINC000624358622 343737225 /nfs/dbraw/zinc/73/72/25/343737225.db2.gz PHTZJBARWKURAW-CYBMUJFWSA-N 1 2 240.310 2.174 20 0 BEADLO Cc1cc[nH+]c([C@H]2CCN(c3cnccn3)C2)c1 ZINC000624371279 343739652 /nfs/dbraw/zinc/73/96/52/343739652.db2.gz IMXNSUKPSWJQHA-LBPRGKRZSA-N 1 2 240.310 2.174 20 0 BEADLO CC1(C)CCN(c2nc[nH+]c(N)c2Cl)CC1 ZINC000232781183 537806679 /nfs/dbraw/zinc/80/66/79/537806679.db2.gz VBARJIQLFDBDFD-UHFFFAOYSA-N 1 2 240.738 2.339 20 0 BEADLO CC1(C)CCN(c2[nH+]cnc(N)c2Cl)CC1 ZINC000232781183 537806684 /nfs/dbraw/zinc/80/66/84/537806684.db2.gz VBARJIQLFDBDFD-UHFFFAOYSA-N 1 2 240.738 2.339 20 0 BEADLO Cc1cc(C(=O)NCc2c[nH+]c[nH]2)c(C)s1 ZINC000084081651 343721755 /nfs/dbraw/zinc/72/17/55/343721755.db2.gz QOELQJCKVATKLS-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO Cc1cc(C(=O)NCc2c[nH]c[nH+]2)c(C)s1 ZINC000084081651 343721758 /nfs/dbraw/zinc/72/17/58/343721758.db2.gz QOELQJCKVATKLS-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO Cc1ccc(N[C@H](C)c2[nH]cc[nH+]2)cn1 ZINC000286149953 537809311 /nfs/dbraw/zinc/80/93/11/537809311.db2.gz OUKDBZGZFLWSQW-SECBINFHSA-N 1 2 202.261 2.286 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1CCOC1(C)C ZINC000624410269 343763702 /nfs/dbraw/zinc/76/37/02/343763702.db2.gz MXQMFKJQCVDKPL-SNVBAGLBSA-N 1 2 236.315 2.317 20 0 BEADLO CNc1cc(N2CCc3sccc3C2)nc[nH+]1 ZINC000128045754 343787345 /nfs/dbraw/zinc/78/73/45/343787345.db2.gz OKZWEPFPQQMQBU-UHFFFAOYSA-N 1 2 246.339 2.143 20 0 BEADLO CNc1cc(N2CCc3sccc3C2)[nH+]cn1 ZINC000128045754 343787348 /nfs/dbraw/zinc/78/73/48/343787348.db2.gz OKZWEPFPQQMQBU-UHFFFAOYSA-N 1 2 246.339 2.143 20 0 BEADLO CC[C@H](NC(=O)[C@@H]1C[C@H]1CC)c1[nH]cc[nH+]1 ZINC000387668050 346996794 /nfs/dbraw/zinc/99/67/94/346996794.db2.gz KHEOBVIMNXILMS-BBBLOLIVSA-N 1 2 221.304 2.023 20 0 BEADLO Cn1ccc(C[NH2+][C@@H]2CSc3ccccc32)n1 ZINC000096693114 343878662 /nfs/dbraw/zinc/87/86/62/343878662.db2.gz GXLBVFRPCMEYEU-GFCCVEGCSA-N 1 2 245.351 2.357 20 0 BEADLO CCC[C@@H](C)CCC[N@H+](C)Cc1n[nH]c(=O)o1 ZINC000625483421 343881893 /nfs/dbraw/zinc/88/18/93/343881893.db2.gz HBPFPWSJXAOSHS-SNVBAGLBSA-N 1 2 241.335 2.423 20 0 BEADLO CCC[C@@H](C)CCC[N@@H+](C)Cc1n[nH]c(=O)o1 ZINC000625483421 343881894 /nfs/dbraw/zinc/88/18/94/343881894.db2.gz HBPFPWSJXAOSHS-SNVBAGLBSA-N 1 2 241.335 2.423 20 0 BEADLO CCC[C@@H](C)Nc1cc[nH+]c(C2CC2)n1 ZINC000393630362 343903362 /nfs/dbraw/zinc/90/33/62/343903362.db2.gz MVNAYXQNNJCFIC-SECBINFHSA-N 1 2 205.305 2.376 20 0 BEADLO Cc1noc(CCn2c(C)[nH+]c3ccccc32)n1 ZINC000128693494 343906704 /nfs/dbraw/zinc/90/67/04/343906704.db2.gz CNLXXJGFRMJSGT-UHFFFAOYSA-N 1 2 242.282 2.279 20 0 BEADLO CN(C[C@@H]1CC=CCC1)C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493396019 529944511 /nfs/dbraw/zinc/94/45/11/529944511.db2.gz DUWWUWAROPNBGA-ABZNLYFFSA-N 1 2 245.326 2.238 20 0 BEADLO CCC[C@@H](C)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000603246567 349898776 /nfs/dbraw/zinc/89/87/76/349898776.db2.gz IPYRVCIRDLRXMM-CHWSQXEVSA-N 1 2 249.358 2.483 20 0 BEADLO CCC[C@H](C)C(=O)N1CC(Oc2cc[nH+]cc2)C1 ZINC000603246506 349898818 /nfs/dbraw/zinc/89/88/18/349898818.db2.gz WKUHWVVLFVEOGL-NSHDSACASA-N 1 2 248.326 2.107 20 0 BEADLO Cc1c[nH]c(C[N@H+](C)CCOc2ccccc2)n1 ZINC000628117048 343966239 /nfs/dbraw/zinc/96/62/39/343966239.db2.gz PVMLJRMLIOXEKW-UHFFFAOYSA-N 1 2 245.326 2.229 20 0 BEADLO Cc1c[nH]c(C[N@@H+](C)CCOc2ccccc2)n1 ZINC000628117048 343966242 /nfs/dbraw/zinc/96/62/42/343966242.db2.gz PVMLJRMLIOXEKW-UHFFFAOYSA-N 1 2 245.326 2.229 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)n1 ZINC000628117296 343966549 /nfs/dbraw/zinc/96/65/49/343966549.db2.gz BAGWFEYTTXPJOG-GFCCVEGCSA-N 1 2 230.315 2.383 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)n1 ZINC000628117296 343966550 /nfs/dbraw/zinc/96/65/50/343966550.db2.gz BAGWFEYTTXPJOG-GFCCVEGCSA-N 1 2 230.315 2.383 20 0 BEADLO Cc1c[nH]c(CN(C)Cc2ccccc2F)[nH+]1 ZINC000628119902 343968782 /nfs/dbraw/zinc/96/87/82/343968782.db2.gz PJFNLGNYIRUMBE-UHFFFAOYSA-N 1 2 233.290 2.489 20 0 BEADLO OCc1cc[nH+]c(NC[C@@H]2Cc3ccccc32)c1 ZINC000641306246 362354451 /nfs/dbraw/zinc/35/44/51/362354451.db2.gz YUISOCLOURHFGL-ZDUSSCGKSA-N 1 2 240.306 2.326 20 0 BEADLO OCc1cc[nH+]c(NC(C2CC2)C2CC2)c1 ZINC000641275589 362342186 /nfs/dbraw/zinc/34/21/86/362342186.db2.gz QRYCBIUCERAYLU-UHFFFAOYSA-N 1 2 218.300 2.174 20 0 BEADLO Cc1ccc(CCNc2cc(CO)cc[nH+]2)o1 ZINC000641289559 362345681 /nfs/dbraw/zinc/34/56/81/362345681.db2.gz KDPAIYSLBQFUHZ-UHFFFAOYSA-N 1 2 232.283 2.130 20 0 BEADLO C[N@H+](Cc1ncc(Cl)s1)CC1(C)COC1 ZINC000625790605 344078245 /nfs/dbraw/zinc/07/82/45/344078245.db2.gz GAVGHWUSMAZMHI-UHFFFAOYSA-N 1 2 246.763 2.265 20 0 BEADLO C[N@@H+](Cc1ncc(Cl)s1)CC1(C)COC1 ZINC000625790605 344078246 /nfs/dbraw/zinc/07/82/46/344078246.db2.gz GAVGHWUSMAZMHI-UHFFFAOYSA-N 1 2 246.763 2.265 20 0 BEADLO CC(C)(C)c1noc(C[NH+](C2CC2)C2CC2)n1 ZINC000625835196 344089387 /nfs/dbraw/zinc/08/93/87/344089387.db2.gz XQNCLGXISUVGGV-UHFFFAOYSA-N 1 2 235.331 2.494 20 0 BEADLO Cc1nnc(C[NH+](C2CC2)C2CC2)n1C1CC1 ZINC000625838320 344090688 /nfs/dbraw/zinc/09/06/88/344090688.db2.gz ZFQRYZWVUPCBPM-UHFFFAOYSA-N 1 2 232.331 2.048 20 0 BEADLO CC(C)(C)n1ncnc1C[NH+](C1CC1)C1CC1 ZINC000625841205 344094986 /nfs/dbraw/zinc/09/49/86/344094986.db2.gz JFGMHOBCMQEXEC-UHFFFAOYSA-N 1 2 234.347 2.160 20 0 BEADLO Cc1nc(N[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)cc[nH+]1 ZINC000078302938 344095636 /nfs/dbraw/zinc/09/56/36/344095636.db2.gz XGIVBHPAOVWNJX-JLLWLGSASA-N 1 2 233.315 2.010 20 0 BEADLO CCOC1CCN(c2cc[nH+]cc2F)CC1 ZINC000641303843 362357452 /nfs/dbraw/zinc/35/74/52/362357452.db2.gz KLSJCZBEAWKXII-UHFFFAOYSA-N 1 2 224.279 2.226 20 0 BEADLO OCc1cc[nH+]c(NC[C@@H]2CC=CCC2)c1 ZINC000641312174 362358343 /nfs/dbraw/zinc/35/83/43/362358343.db2.gz CUOQSACWAMQKGC-LLVKDONJSA-N 1 2 218.300 2.342 20 0 BEADLO CC(C)C[C@@H](CO)Nc1cc[nH+]c2ccncc12 ZINC000085685612 344208166 /nfs/dbraw/zinc/20/81/66/344208166.db2.gz ZQZKDFVQHQVPIT-NSHDSACASA-N 1 2 245.326 2.449 20 0 BEADLO C[N@@H+](Cc1ccsc1)Cc1ccno1 ZINC000588928599 344216792 /nfs/dbraw/zinc/21/67/92/344216792.db2.gz JKOACVGIUAPAQL-UHFFFAOYSA-N 1 2 208.286 2.368 20 0 BEADLO C[N@H+](Cc1ccsc1)Cc1ccno1 ZINC000588928599 344216794 /nfs/dbraw/zinc/21/67/94/344216794.db2.gz JKOACVGIUAPAQL-UHFFFAOYSA-N 1 2 208.286 2.368 20 0 BEADLO C[C@@H](O)[C@@H](C)SCc1ccc(N(C)C)[nH+]c1 ZINC000600524261 344256298 /nfs/dbraw/zinc/25/62/98/344256298.db2.gz GXFCUBJVPBCWDO-NXEZZACHSA-N 1 2 240.372 2.150 20 0 BEADLO Cn1cc[nH+]c1CSCc1ccccn1 ZINC000600577355 344293177 /nfs/dbraw/zinc/29/31/77/344293177.db2.gz JJJDXMLVYWVUKG-UHFFFAOYSA-N 1 2 219.313 2.249 20 0 BEADLO Cc1ccoc1C[N@H+]1CCC[C@@H]1c1nncn1C ZINC000093810258 344322746 /nfs/dbraw/zinc/32/27/46/344322746.db2.gz TVSLPFYTCQLZGZ-LLVKDONJSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1ccoc1C[N@@H+]1CCC[C@@H]1c1nncn1C ZINC000093810258 344322749 /nfs/dbraw/zinc/32/27/49/344322749.db2.gz TVSLPFYTCQLZGZ-LLVKDONJSA-N 1 2 246.314 2.054 20 0 BEADLO CC[C@H](C)[C@@H](C)Nc1cc(CO)cc[nH+]1 ZINC000641383732 362384463 /nfs/dbraw/zinc/38/44/63/362384463.db2.gz DOEBJJZRLMXFRB-VHSXEESVSA-N 1 2 208.305 2.420 20 0 BEADLO CC[C@H]1CN(c2cc[nH+]cc2F)C[C@@H](C)O1 ZINC000641368724 362379834 /nfs/dbraw/zinc/37/98/34/362379834.db2.gz XXJVKUMXIADUAO-ZJUUUORDSA-N 1 2 224.279 2.224 20 0 BEADLO CCC(C)(C)c1nnc(N(C)Cc2[nH]cc[nH+]2)o1 ZINC000641380263 362384868 /nfs/dbraw/zinc/38/48/68/362384868.db2.gz SLRJREFTEQRZNL-UHFFFAOYSA-N 1 2 249.318 2.117 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620603657 344353578 /nfs/dbraw/zinc/35/35/78/344353578.db2.gz JSPUFUBYFPSNRP-WDMOLILDSA-N 1 2 249.358 2.280 20 0 BEADLO Cc1cccc(NCc2[nH]cc[nH+]2)c1F ZINC000132532749 344303451 /nfs/dbraw/zinc/30/34/51/344303451.db2.gz DAZJPGZQQCEBJD-UHFFFAOYSA-N 1 2 205.236 2.469 20 0 BEADLO CC[N@H+](Cc1ncn(-c2ccccc2)n1)C1CC1 ZINC000092793888 344303575 /nfs/dbraw/zinc/30/35/75/344303575.db2.gz VKWYFLWKOHWBJS-UHFFFAOYSA-N 1 2 242.326 2.252 20 0 BEADLO CC[N@@H+](Cc1ncn(-c2ccccc2)n1)C1CC1 ZINC000092793888 344303577 /nfs/dbraw/zinc/30/35/77/344303577.db2.gz VKWYFLWKOHWBJS-UHFFFAOYSA-N 1 2 242.326 2.252 20 0 BEADLO Cc1noc(C)c1C[C@H](C)Nc1cc[nH+]cc1F ZINC000641383123 362385932 /nfs/dbraw/zinc/38/59/32/362385932.db2.gz AWYYZVQSTVBJLF-QMMMGPOBSA-N 1 2 249.289 2.291 20 0 BEADLO CC(C)[C@@H](C)CNc1cc(CO)cc[nH+]1 ZINC000641387600 362387054 /nfs/dbraw/zinc/38/70/54/362387054.db2.gz GEXCKFFASMMHNK-JTQLQIEISA-N 1 2 208.305 2.278 20 0 BEADLO CO[C@@H]1CC[C@@H](C(=O)Nc2c(C)cc[nH+]c2C)C1 ZINC000622866433 344435173 /nfs/dbraw/zinc/43/51/73/344435173.db2.gz FEFDVORGRDWSGB-VXGBXAGGSA-N 1 2 248.326 2.452 20 0 BEADLO COc1ccc[nH+]c1N1CC[C@H](C)[C@H](F)C1 ZINC000624088898 344493952 /nfs/dbraw/zinc/49/39/52/344493952.db2.gz ZOHQNCSQBJJVKH-VHSXEESVSA-N 1 2 224.279 2.275 20 0 BEADLO COc1ccc[nH+]c1NCCCOCC1CC1 ZINC000234948901 344494023 /nfs/dbraw/zinc/49/40/23/344494023.db2.gz NUOXKXDICGAZLU-UHFFFAOYSA-N 1 2 236.315 2.319 20 0 BEADLO COc1ccc[nH+]c1N1CC[C@@H](C)[C@@H](F)C1 ZINC000624088899 344494028 /nfs/dbraw/zinc/49/40/28/344494028.db2.gz ZOHQNCSQBJJVKH-ZJUUUORDSA-N 1 2 224.279 2.275 20 0 BEADLO CCOC[C@H]1CCN(c2cc[nH+]cc2F)C1 ZINC000641415767 362402665 /nfs/dbraw/zinc/40/26/65/362402665.db2.gz YTJTWMGOHMOYFJ-JTQLQIEISA-N 1 2 224.279 2.084 20 0 BEADLO COc1cc[nH+]cc1CSc1ccc(C)nn1 ZINC000641458446 362433187 /nfs/dbraw/zinc/43/31/87/362433187.db2.gz ZDKLBKIRHQAUIW-UHFFFAOYSA-N 1 2 247.323 2.481 20 0 BEADLO CCC[C@H]1CN(c2cc[nH+]cc2F)CCO1 ZINC000641463735 362434722 /nfs/dbraw/zinc/43/47/22/362434722.db2.gz KXFDBIGJGKQDLZ-JTQLQIEISA-N 1 2 224.279 2.226 20 0 BEADLO CN(CC1CCOCC1)c1cc[nH+]cc1F ZINC000641472406 362441381 /nfs/dbraw/zinc/44/13/81/362441381.db2.gz NRTUBBUTIGNGQV-UHFFFAOYSA-N 1 2 224.279 2.084 20 0 BEADLO COc1cc(COCc2[nH]cc[nH+]2)ccc1C ZINC000641472692 362441742 /nfs/dbraw/zinc/44/17/42/362441742.db2.gz QBBBQVFUNXMWSA-UHFFFAOYSA-N 1 2 232.283 2.444 20 0 BEADLO CN(C[C@@H]1CCCC[C@H]1O)c1cc[nH+]cc1F ZINC000641483522 362451650 /nfs/dbraw/zinc/45/16/50/362451650.db2.gz RHNSAIFKSJRRIE-GXFFZTMASA-N 1 2 238.306 2.208 20 0 BEADLO Cc1cnccc1SCc1cn(C)c[nH+]1 ZINC000641486437 362455982 /nfs/dbraw/zinc/45/59/82/362455982.db2.gz UMDOKFABJGHUQP-UHFFFAOYSA-N 1 2 219.313 2.416 20 0 BEADLO C[C@@H](CC(F)(F)F)Nc1cc[nH+]cc1F ZINC000641493630 362459455 /nfs/dbraw/zinc/45/94/55/362459455.db2.gz JLGCPYCSFFPSGF-LURJTMIESA-N 1 2 222.185 2.395 20 0 BEADLO C[C@@H]1CCCCN(c2cc(CO)cc[nH+]2)C1 ZINC000641496690 362461531 /nfs/dbraw/zinc/46/15/31/362461531.db2.gz KKFXAAUUQNTXNC-LLVKDONJSA-N 1 2 220.316 2.200 20 0 BEADLO COC[C@H]1CCCCN(c2cc[nH+]cc2F)C1 ZINC000641497337 362463154 /nfs/dbraw/zinc/46/31/54/362463154.db2.gz SOBRHUJFVBLMPP-NSHDSACASA-N 1 2 238.306 2.474 20 0 BEADLO CC[C@@]1(C)CN(c2cc[nH+]cc2F)CCO1 ZINC000641523257 362479739 /nfs/dbraw/zinc/47/97/39/362479739.db2.gz GVUNUSLLFLTAEQ-LBPRGKRZSA-N 1 2 224.279 2.226 20 0 BEADLO C[C@@H]1CN(c2cc[nH+]cc2F)C[C@@H](C2CC2)O1 ZINC000641546575 362493837 /nfs/dbraw/zinc/49/38/37/362493837.db2.gz XVYAABYAHFELIJ-RNCFNFMXSA-N 1 2 236.290 2.224 20 0 BEADLO C[C@@H](c1cccnc1)[N@@H+]1CCO[C@H](CCF)C1 ZINC000626001971 344662276 /nfs/dbraw/zinc/66/22/76/344662276.db2.gz CIHNBVOGNMGKLT-WCQYABFASA-N 1 2 238.306 2.203 20 0 BEADLO C[C@@H](c1cccnc1)[N@H+]1CCO[C@H](CCF)C1 ZINC000626001971 344662277 /nfs/dbraw/zinc/66/22/77/344662277.db2.gz CIHNBVOGNMGKLT-WCQYABFASA-N 1 2 238.306 2.203 20 0 BEADLO Cc1ncsc1C[N@@H+]1CCO[C@@H](CCF)C1 ZINC000626005512 344668119 /nfs/dbraw/zinc/66/81/19/344668119.db2.gz DTTHABJDDRGOPQ-JTQLQIEISA-N 1 2 244.335 2.012 20 0 BEADLO Cc1ncsc1C[N@H+]1CCO[C@@H](CCF)C1 ZINC000626005512 344668122 /nfs/dbraw/zinc/66/81/22/344668122.db2.gz DTTHABJDDRGOPQ-JTQLQIEISA-N 1 2 244.335 2.012 20 0 BEADLO CC(C)[C@@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000113765098 344674506 /nfs/dbraw/zinc/67/45/06/344674506.db2.gz SUJDRJPYHYZNRL-BTDICHCPSA-N 1 2 247.342 2.318 20 0 BEADLO C[C@@H]1CC[C@H](CNc2cc(CO)cc[nH+]2)C1 ZINC000641547429 362495033 /nfs/dbraw/zinc/49/50/33/362495033.db2.gz QNXBLUPOMTVDTD-MNOVXSKESA-N 1 2 220.316 2.422 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1ccc(Cl)cc1 ZINC000049956415 344704245 /nfs/dbraw/zinc/70/42/45/344704245.db2.gz NKNOKVFLSWLYEM-VIFPVBQESA-N 1 2 241.718 2.333 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000049956415 344704247 /nfs/dbraw/zinc/70/42/47/344704247.db2.gz NKNOKVFLSWLYEM-VIFPVBQESA-N 1 2 241.718 2.333 20 0 BEADLO CCO[C@@H](C(=O)Nc1ccc(C)[nH+]c1C)C1CC1 ZINC000626060846 344707090 /nfs/dbraw/zinc/70/70/90/344707090.db2.gz MZXNSTGIDFZTMS-CYBMUJFWSA-N 1 2 248.326 2.452 20 0 BEADLO Cn1cc[nH+]c1CSc1ccccc1O ZINC000050046859 344717098 /nfs/dbraw/zinc/71/70/98/344717098.db2.gz JLMPCSGXNBJOQK-UHFFFAOYSA-N 1 2 220.297 2.418 20 0 BEADLO CC1(C)C[N@H+](Cc2ccncc2Cl)CCO1 ZINC000075589053 344779582 /nfs/dbraw/zinc/77/95/82/344779582.db2.gz PBZAHGKNXKKQTJ-UHFFFAOYSA-N 1 2 240.734 2.346 20 0 BEADLO CC1(C)C[N@@H+](Cc2ccncc2Cl)CCO1 ZINC000075589053 344779585 /nfs/dbraw/zinc/77/95/85/344779585.db2.gz PBZAHGKNXKKQTJ-UHFFFAOYSA-N 1 2 240.734 2.346 20 0 BEADLO Cc1nc(NC[C@H](CCO)CC(C)C)cc[nH+]1 ZINC000075062256 344764233 /nfs/dbraw/zinc/76/42/33/344764233.db2.gz QEQYBSMULNWELU-GFCCVEGCSA-N 1 2 237.347 2.242 20 0 BEADLO Cc1nc(NCC2(CCO)CCCC2)cc[nH+]1 ZINC000075064133 344764628 /nfs/dbraw/zinc/76/46/28/344764628.db2.gz VPEXCEFWDFYWIQ-UHFFFAOYSA-N 1 2 235.331 2.140 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnc(C3CC3)o2)[C@H](C)CO1 ZINC000628140509 344805670 /nfs/dbraw/zinc/80/56/70/344805670.db2.gz NOQUEDDGNQNDRM-NXEZZACHSA-N 1 2 236.315 2.161 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnc(C3CC3)o2)[C@H](C)CO1 ZINC000628140509 344805671 /nfs/dbraw/zinc/80/56/71/344805671.db2.gz NOQUEDDGNQNDRM-NXEZZACHSA-N 1 2 236.315 2.161 20 0 BEADLO CCC[C@](C)([NH2+]CCC(F)(F)F)C(=O)OC ZINC000077285627 344815261 /nfs/dbraw/zinc/81/52/61/344815261.db2.gz AYCJMZOZVAZCRZ-VIFPVBQESA-N 1 2 241.253 2.260 20 0 BEADLO COCC[N@H+](C)[C@H](C)c1nc(C(C)(C)C)no1 ZINC000077409114 344823536 /nfs/dbraw/zinc/82/35/36/344823536.db2.gz VDXSAEXWMQJDPK-SECBINFHSA-N 1 2 241.335 2.006 20 0 BEADLO COCC[N@@H+](C)[C@H](C)c1nc(C(C)(C)C)no1 ZINC000077409114 344823538 /nfs/dbraw/zinc/82/35/38/344823538.db2.gz VDXSAEXWMQJDPK-SECBINFHSA-N 1 2 241.335 2.006 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2CCCCO2)c(C)[nH+]1 ZINC000178576358 178747457 /nfs/dbraw/zinc/74/74/57/178747457.db2.gz IUTHUTTTZOJDJC-GFCCVEGCSA-N 1 2 234.299 2.206 20 0 BEADLO C[N@H+](CC(F)F)C[C@]1(C)CCCS1 ZINC000628155969 344846344 /nfs/dbraw/zinc/84/63/44/344846344.db2.gz VZDYKLPZZBDILH-VIFPVBQESA-N 1 2 209.305 2.469 20 0 BEADLO C[N@@H+](CC(F)F)C[C@]1(C)CCCS1 ZINC000628155969 344846345 /nfs/dbraw/zinc/84/63/45/344846345.db2.gz VZDYKLPZZBDILH-VIFPVBQESA-N 1 2 209.305 2.469 20 0 BEADLO Cc1[nH]c(CN(C)C[C@@H]2CCCCO2)[nH+]c1C ZINC000628153242 344843287 /nfs/dbraw/zinc/84/32/87/344843287.db2.gz GKTPSFAKECIYOG-LBPRGKRZSA-N 1 2 237.347 2.027 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@@H]2CCCCO2)[nH]c1C ZINC000628153242 344843288 /nfs/dbraw/zinc/84/32/88/344843288.db2.gz GKTPSFAKECIYOG-LBPRGKRZSA-N 1 2 237.347 2.027 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@@H]2CCCCO2)[nH]c1C ZINC000628153242 344843290 /nfs/dbraw/zinc/84/32/90/344843290.db2.gz GKTPSFAKECIYOG-LBPRGKRZSA-N 1 2 237.347 2.027 20 0 BEADLO Cc1nc(N[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)cc[nH+]1 ZINC000078302933 344843312 /nfs/dbraw/zinc/84/33/12/344843312.db2.gz XGIVBHPAOVWNJX-WCQGTBRESA-N 1 2 233.315 2.010 20 0 BEADLO Cc1noc(C)c1C[C@@H](C)Nc1cc[nH+]c(C)n1 ZINC000078294957 344843789 /nfs/dbraw/zinc/84/37/89/344843789.db2.gz JYUQLYBWIJNPDY-MRVPVSSYSA-N 1 2 246.314 2.433 20 0 BEADLO Cc1c[nH]c(CN2Cc3ccccc3C2)[nH+]1 ZINC000628164576 344873198 /nfs/dbraw/zinc/87/31/98/344873198.db2.gz UYTHLTUEYRFMET-UHFFFAOYSA-N 1 2 213.284 2.234 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccnn1C)c1cscn1 ZINC000583392758 344879485 /nfs/dbraw/zinc/87/94/85/344879485.db2.gz PCGGOIABZDHXQX-BDAKNGLRSA-N 1 2 236.344 2.288 20 0 BEADLO C[C@@H](Nc1cccc[nH+]1)c1nnc2ccccn21 ZINC000078596397 344888949 /nfs/dbraw/zinc/88/89/49/344888949.db2.gz MFBUJLXXWKYOPS-SNVBAGLBSA-N 1 2 239.282 2.297 20 0 BEADLO Cc1c[nH]c(CN2CCc3ccc(F)cc3C2)[nH+]1 ZINC000628174751 344896615 /nfs/dbraw/zinc/89/66/15/344896615.db2.gz VRHGPYZKLXLSCR-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1ccc(CNC(=O)[C@H](C)n2cc[nH+]c2)s1 ZINC000053776147 1172053363 /nfs/dbraw/zinc/05/33/63/1172053363.db2.gz DTAQDXPAOXMBSZ-JTQLQIEISA-N 1 2 249.339 2.130 20 0 BEADLO Cc1ccc(N[C@@H](C)[C@@H]2CCCO2)c[nH+]1 ZINC000309042652 178769296 /nfs/dbraw/zinc/76/92/96/178769296.db2.gz KXJIZOVGMYNFKP-JQWIXIFHSA-N 1 2 206.289 2.369 20 0 BEADLO Cc1nc(C[N@H+]2CCS[C@@H](C)[C@@H]2C)[nH]c1C ZINC000628179207 344914144 /nfs/dbraw/zinc/91/41/44/344914144.db2.gz RCYDZRHXEJJFKZ-QWRGUYRKSA-N 1 2 239.388 2.352 20 0 BEADLO Cc1nc(C[N@@H+]2CCS[C@@H](C)[C@@H]2C)[nH]c1C ZINC000628179207 344914147 /nfs/dbraw/zinc/91/41/47/344914147.db2.gz RCYDZRHXEJJFKZ-QWRGUYRKSA-N 1 2 239.388 2.352 20 0 BEADLO Cc1[nH]c(CN2CCS[C@@H](C)[C@@H]2C)[nH+]c1C ZINC000628179207 344914149 /nfs/dbraw/zinc/91/41/49/344914149.db2.gz RCYDZRHXEJJFKZ-QWRGUYRKSA-N 1 2 239.388 2.352 20 0 BEADLO CCc1cc(C[NH2+]Cc2cnc(C3CC3)o2)on1 ZINC000628199053 344965482 /nfs/dbraw/zinc/96/54/82/344965482.db2.gz ZPCXJDDXCJCXCD-UHFFFAOYSA-N 1 2 247.298 2.392 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)N(C)Cc2[nH]cc[nH+]2)C[C@H]1C ZINC000448935980 201775732 /nfs/dbraw/zinc/77/57/32/201775732.db2.gz KRLFURVULMAVPX-UTUOFQBUSA-N 1 2 249.358 2.440 20 0 BEADLO Cc1noc(C[N@@H+](C)[C@@H]2CCc3ccccc32)n1 ZINC000042635304 344941904 /nfs/dbraw/zinc/94/19/04/344941904.db2.gz NVSULKMODPBXQJ-CYBMUJFWSA-N 1 2 243.310 2.497 20 0 BEADLO Cc1noc(C[N@H+](C)[C@@H]2CCc3ccccc32)n1 ZINC000042635304 344941907 /nfs/dbraw/zinc/94/19/07/344941907.db2.gz NVSULKMODPBXQJ-CYBMUJFWSA-N 1 2 243.310 2.497 20 0 BEADLO C[C@@H]1CCC[C@@H]1CNc1cc(CO)cc[nH+]1 ZINC000641553277 362497882 /nfs/dbraw/zinc/49/78/82/362497882.db2.gz VCCZYLLGBWKTGX-ZYHUDNBSSA-N 1 2 220.316 2.422 20 0 BEADLO CC(F)(F)CCNc1cc(CO)cc[nH+]1 ZINC000641612301 362547098 /nfs/dbraw/zinc/54/70/98/362547098.db2.gz FCLAQMYDUZEUKQ-UHFFFAOYSA-N 1 2 216.231 2.031 20 0 BEADLO CC[C@H](C)[C@@H](CNc1cc[nH+]cc1F)OC ZINC000641615221 362547744 /nfs/dbraw/zinc/54/77/44/362547744.db2.gz IKHFWQGYCYQIDZ-JOYOIKCWSA-N 1 2 226.295 2.116 20 0 BEADLO CO[C@@H]1CCN(c2cc[nH+]cc2F)C[C@H]1C ZINC000641618396 362552245 /nfs/dbraw/zinc/55/22/45/362552245.db2.gz FZJAQUVMJXOHJE-BXKDBHETSA-N 1 2 224.279 2.082 20 0 BEADLO Fc1c[nH+]ccc1NC[C@@H]1C[C@H]1C1CC1 ZINC000641622986 362553938 /nfs/dbraw/zinc/55/39/38/362553938.db2.gz AIRHOAXKCVHPRS-UWVGGRQHSA-N 1 2 206.264 2.101 20 0 BEADLO CCO[C@@H]1CCCC[C@H]1Nc1cc[nH+]cc1F ZINC000641623210 362554014 /nfs/dbraw/zinc/55/40/14/362554014.db2.gz FSHVOGOOJROFSB-CHWSQXEVSA-N 1 2 238.306 2.402 20 0 BEADLO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3CN2c1cc[nH+]cc1F ZINC000641593421 362535635 /nfs/dbraw/zinc/53/56/35/362535635.db2.gz QUCBGSHHTKKMGX-UHEDFLHXSA-N 1 2 248.301 2.080 20 0 BEADLO Fc1c[nH+]ccc1NC[C@@H]1CCCSC1 ZINC000641598713 362538239 /nfs/dbraw/zinc/53/82/39/362538239.db2.gz MUTMBXWSRAQRBS-VIFPVBQESA-N 1 2 226.320 2.198 20 0 BEADLO OCc1cc[nH+]c(NCC2CC(F)(F)C2)c1 ZINC000641605069 362541971 /nfs/dbraw/zinc/54/19/71/362541971.db2.gz DGOPXNLPINSHQA-UHFFFAOYSA-N 1 2 228.242 2.031 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1C[C@H]1c1ccco1 ZINC000641639752 362567733 /nfs/dbraw/zinc/56/77/33/362567733.db2.gz XHFQCFGNPHNUOZ-LDYMZIIASA-N 1 2 218.231 2.204 20 0 BEADLO OCc1cc[nH+]c(NC[C@@H]2C[C@H]2C2CCC2)c1 ZINC000641642355 362569048 /nfs/dbraw/zinc/56/90/48/362569048.db2.gz VSMYGYCQOKEVKE-STQMWFEESA-N 1 2 232.327 2.422 20 0 BEADLO C[C@@H](CO)C1CCN(c2cc[nH+]cc2F)CC1 ZINC000641650409 362574886 /nfs/dbraw/zinc/57/48/86/362574886.db2.gz UHRVHGVPGIRBMY-JTQLQIEISA-N 1 2 238.306 2.066 20 0 BEADLO COC(=O)[C@@H](Cc1ccccc1)[NH2+]CCC1CC1 ZINC000125771818 345092858 /nfs/dbraw/zinc/09/28/58/345092858.db2.gz BJUIGFURARMJPW-CQSZACIVSA-N 1 2 247.338 2.160 20 0 BEADLO C[C@H]1CN(c2cc[nH+]cc2F)CC2(CCC2)O1 ZINC000641649103 362576096 /nfs/dbraw/zinc/57/60/96/362576096.db2.gz XSBBREMJAQXZTN-JTQLQIEISA-N 1 2 236.290 2.369 20 0 BEADLO CC1(C)C[C@@H](CNc2cc[nH+]cc2F)CCO1 ZINC000641624007 362555255 /nfs/dbraw/zinc/55/52/55/362555255.db2.gz COAXMDCRSCYBPX-JTQLQIEISA-N 1 2 238.306 2.260 20 0 BEADLO Oc1ccc2c(c1)[C@H]([NH2+]Cc1ccon1)CC2 ZINC000634986544 345166480 /nfs/dbraw/zinc/16/64/80/345166480.db2.gz YAQJFAOJLVYGKY-CYBMUJFWSA-N 1 2 230.267 2.157 20 0 BEADLO CC1(C)CCc2sc([C@H]3COCC[NH2+]3)nc21 ZINC000226468094 345228608 /nfs/dbraw/zinc/22/86/08/345228608.db2.gz WQXYAEPXPOMTMR-MRVPVSSYSA-N 1 2 238.356 2.028 20 0 BEADLO C[C@H]1CCCC[C@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635077881 345242295 /nfs/dbraw/zinc/24/22/95/345242295.db2.gz JTAVVZDDTQJRPI-IRCOFANPSA-N 1 2 247.342 2.208 20 0 BEADLO C[C@H]1CCCC[C@H]1NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635077881 345242297 /nfs/dbraw/zinc/24/22/97/345242297.db2.gz JTAVVZDDTQJRPI-IRCOFANPSA-N 1 2 247.342 2.208 20 0 BEADLO CCCCN(CC)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635077937 345242340 /nfs/dbraw/zinc/24/23/40/345242340.db2.gz KFUDKPULLNRFFY-GHMZBOCLSA-N 1 2 235.331 2.162 20 0 BEADLO CCCCN(CC)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635077937 345242343 /nfs/dbraw/zinc/24/23/43/345242343.db2.gz KFUDKPULLNRFFY-GHMZBOCLSA-N 1 2 235.331 2.162 20 0 BEADLO Cc1cn2ccc(C(=O)N[C@@H](C)C3CC3)cc2[nH+]1 ZINC000635125023 345252878 /nfs/dbraw/zinc/25/28/78/345252878.db2.gz FCZIURFCQYIKGM-JTQLQIEISA-N 1 2 243.310 2.171 20 0 BEADLO Cn1c[nH+]c(CSC2(CO)CCCCC2)c1 ZINC000603335650 349926566 /nfs/dbraw/zinc/92/65/66/349926566.db2.gz LNHZYXXAHOHREK-UHFFFAOYSA-N 1 2 240.372 2.349 20 0 BEADLO CCN(C(=O)c1ccn2cc(C)[nH+]c2c1)C1CC1 ZINC000635214146 345274134 /nfs/dbraw/zinc/27/41/34/345274134.db2.gz CDFLGKRUPTXTAY-UHFFFAOYSA-N 1 2 243.310 2.267 20 0 BEADLO O[C@H]1Cc2ccccc2[C@H]1Nc1cccc[nH+]1 ZINC000080596941 345322509 /nfs/dbraw/zinc/32/25/09/345322509.db2.gz KCPGJYPLGNYKTA-GXTWGEPZSA-N 1 2 226.279 2.152 20 0 BEADLO CC1(C)COCC[N@@H+]1Cc1cccc2c1OCO2 ZINC000130872954 345288070 /nfs/dbraw/zinc/28/80/70/345288070.db2.gz AKWJHOHJGRZPMQ-UHFFFAOYSA-N 1 2 249.310 2.026 20 0 BEADLO CC1(C)COCC[N@H+]1Cc1cccc2c1OCO2 ZINC000130872954 345288073 /nfs/dbraw/zinc/28/80/73/345288073.db2.gz AKWJHOHJGRZPMQ-UHFFFAOYSA-N 1 2 249.310 2.026 20 0 BEADLO CC[C@@H]([NH2+][C@@H](C)c1cccs1)C(=O)OC ZINC000130906251 345289055 /nfs/dbraw/zinc/28/90/55/345289055.db2.gz FHAHAASGVKJEDP-DTWKUNHWSA-N 1 2 227.329 2.350 20 0 BEADLO CC(C)(C)CCNC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635268779 345291341 /nfs/dbraw/zinc/29/13/41/345291341.db2.gz DASDEGZYDCSPDQ-NXEZZACHSA-N 1 2 235.331 2.066 20 0 BEADLO CC(C)(C)CCNC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635268779 345291343 /nfs/dbraw/zinc/29/13/43/345291343.db2.gz DASDEGZYDCSPDQ-NXEZZACHSA-N 1 2 235.331 2.066 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CCC[C@H](CC)C2)[nH+]1 ZINC000635268190 345291362 /nfs/dbraw/zinc/29/13/62/345291362.db2.gz YGQDKIGGYFQAKE-NSHDSACASA-N 1 2 249.358 2.163 20 0 BEADLO CC(C)C[C@H](C(=O)NC[C@H]1C[C@@H]1C)n1cc[nH+]c1 ZINC000635300967 345299234 /nfs/dbraw/zinc/29/92/34/345299234.db2.gz QPHCUMHDNUSUOY-YNEHKIRRSA-N 1 2 249.358 2.243 20 0 BEADLO Cc1cn2ccc(C(=O)NC[C@@H]3C[C@H]3C)cc2[nH+]1 ZINC000635300609 345299429 /nfs/dbraw/zinc/29/94/29/345299429.db2.gz MYJAXLSMQDVNIT-SKDRFNHKSA-N 1 2 243.310 2.029 20 0 BEADLO CCC1CCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)CC1 ZINC000635393596 345340725 /nfs/dbraw/zinc/34/07/25/345340725.db2.gz OMZBIMAMGNLCPC-VXGBXAGGSA-N 1 2 247.342 2.162 20 0 BEADLO CCC1CCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)CC1 ZINC000635393596 345340727 /nfs/dbraw/zinc/34/07/27/345340727.db2.gz OMZBIMAMGNLCPC-VXGBXAGGSA-N 1 2 247.342 2.162 20 0 BEADLO CC1(NC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)CCCCC1 ZINC000635406496 345350754 /nfs/dbraw/zinc/35/07/54/345350754.db2.gz LTAFVIGSRLGCKV-GHMZBOCLSA-N 1 2 247.342 2.352 20 0 BEADLO CC1(NC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)CCCCC1 ZINC000635406496 345350756 /nfs/dbraw/zinc/35/07/56/345350756.db2.gz LTAFVIGSRLGCKV-GHMZBOCLSA-N 1 2 247.342 2.352 20 0 BEADLO Cc1cn2ccc(C(=O)N[C@@H]3CC3(C)C)cc2[nH+]1 ZINC000635407303 345351495 /nfs/dbraw/zinc/35/14/95/345351495.db2.gz SVPHDBIFPPKJOR-LLVKDONJSA-N 1 2 243.310 2.171 20 0 BEADLO Cc1cn2ccc(C(=O)NCC(C)(C)C)cc2[nH+]1 ZINC000635413720 345354867 /nfs/dbraw/zinc/35/48/67/345354867.db2.gz BUAHJQUIPDBDCM-UHFFFAOYSA-N 1 2 245.326 2.419 20 0 BEADLO CCc1c[nH]c(CC(=O)N(C)CC(C)(C)C)[nH+]1 ZINC000635477718 345388618 /nfs/dbraw/zinc/38/86/18/345388618.db2.gz HCURYTNPZNMZTK-UHFFFAOYSA-N 1 2 237.347 2.019 20 0 BEADLO CC[C@@H](C)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635420700 345360372 /nfs/dbraw/zinc/36/03/72/345360372.db2.gz SARFYEHIXRBPOS-GWOFURMSSA-N 1 2 235.331 2.064 20 0 BEADLO CC[C@@H](C)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635420700 345360374 /nfs/dbraw/zinc/36/03/74/345360374.db2.gz SARFYEHIXRBPOS-GWOFURMSSA-N 1 2 235.331 2.064 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CCC(C)(C)CC2)[nH+]1 ZINC000635479615 345389379 /nfs/dbraw/zinc/38/93/79/345389379.db2.gz VJWNZAYKGIBRPF-UHFFFAOYSA-N 1 2 249.358 2.163 20 0 BEADLO C[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)CC1 ZINC000635447068 345372963 /nfs/dbraw/zinc/37/29/63/345372963.db2.gz OXFOKVSRSHEKJI-IJLUTSLNSA-N 1 2 247.342 2.162 20 0 BEADLO C[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)CC1 ZINC000635447068 345372964 /nfs/dbraw/zinc/37/29/64/345372964.db2.gz OXFOKVSRSHEKJI-IJLUTSLNSA-N 1 2 247.342 2.162 20 0 BEADLO CCC[C@H](CC)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635443772 345373697 /nfs/dbraw/zinc/37/36/97/345373697.db2.gz KTKFPYNLYYBZCY-HBNTYKKESA-N 1 2 235.331 2.208 20 0 BEADLO CCC[C@H](CC)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635443772 345373699 /nfs/dbraw/zinc/37/36/99/345373699.db2.gz KTKFPYNLYYBZCY-HBNTYKKESA-N 1 2 235.331 2.208 20 0 BEADLO CCC[NH2+][C@@H](c1c[nH]nn1)c1ccc(F)cc1 ZINC000158938693 345389901 /nfs/dbraw/zinc/38/99/01/345389901.db2.gz BVURMXIZNVXWRK-GFCCVEGCSA-N 1 2 234.278 2.033 20 0 BEADLO COc1ccc(NC(=O)[C@@H](C)n2cc[nH+]c2)cc1 ZINC000053898699 1172060910 /nfs/dbraw/zinc/06/09/10/1172060910.db2.gz FJLMICKPMVIXNJ-SNVBAGLBSA-N 1 2 245.282 2.091 20 0 BEADLO CCC[C@@H]([NH2+]CC(C)(C)OCC)C(=O)OCC ZINC000159386189 345431193 /nfs/dbraw/zinc/43/11/93/345431193.db2.gz OABAIJGRPXTMJY-LLVKDONJSA-N 1 2 245.363 2.123 20 0 BEADLO OCc1cc[nH+]c(NC2Cc3ccccc3C2)c1 ZINC000635528462 345435435 /nfs/dbraw/zinc/43/54/35/345435435.db2.gz TWMICGLCYSSUEZ-UHFFFAOYSA-N 1 2 240.306 2.153 20 0 BEADLO Oc1cc(F)cc(C[NH2+]Cc2nccs2)c1 ZINC000159594826 345445245 /nfs/dbraw/zinc/44/52/45/345445245.db2.gz JSOXFOPGDPJIIF-UHFFFAOYSA-N 1 2 238.287 2.278 20 0 BEADLO Cc1nc2[nH]ccc2c(NCc2cccnc2)[nH+]1 ZINC000080762021 345449342 /nfs/dbraw/zinc/44/93/42/345449342.db2.gz VXXLOBDLWOMTCL-UHFFFAOYSA-N 1 2 239.282 2.273 20 0 BEADLO C[C@@H](CNC(=O)/C=C/C(C)(C)C)Cn1cc[nH+]c1 ZINC000081801573 345492665 /nfs/dbraw/zinc/49/26/65/345492665.db2.gz HGNIXQVJDVBNOW-FYJFLYSWSA-N 1 2 249.358 2.238 20 0 BEADLO C[C@H](Nc1cc(CO)cc[nH+]1)c1cscn1 ZINC000641659762 362585231 /nfs/dbraw/zinc/58/52/31/362585231.db2.gz UROHKTDCHYTFCP-QMMMGPOBSA-N 1 2 235.312 2.204 20 0 BEADLO C[C@H]1COC2(CCC2)CN1c1cc[nH+]cc1F ZINC000641659906 362585668 /nfs/dbraw/zinc/58/56/68/362585668.db2.gz WYTQPMWFGGYDBA-JTQLQIEISA-N 1 2 236.290 2.369 20 0 BEADLO CC(C)CC(C)(C)CNC(=O)Cn1cc[nH+]c1 ZINC000083004387 345503815 /nfs/dbraw/zinc/50/38/15/345503815.db2.gz GNTVTPSXHIFLDF-UHFFFAOYSA-N 1 2 237.347 2.072 20 0 BEADLO CO[C@@H](CNc1cc[nH+]cc1F)C1CCCC1 ZINC000641667597 362588557 /nfs/dbraw/zinc/58/85/57/362588557.db2.gz SFNPSDQFWQMGPA-ZDUSSCGKSA-N 1 2 238.306 2.260 20 0 BEADLO Cc1cc(C)nc(NC(C)(C)c2[nH]cc[nH+]2)n1 ZINC000641664776 362588875 /nfs/dbraw/zinc/58/88/75/362588875.db2.gz MGNYEFLVWXRKBQ-UHFFFAOYSA-N 1 2 231.303 2.164 20 0 BEADLO C[C@H](Nc1cc(C2CC2)ncn1)c1[nH+]ccn1C ZINC000641665316 362589956 /nfs/dbraw/zinc/58/99/56/362589956.db2.gz RSDLUVZQNXGDLD-VIFPVBQESA-N 1 2 243.314 2.261 20 0 BEADLO Cc1nc2[nH]ccc2c(N(C)CC(C)C)[nH+]1 ZINC000080970592 345456239 /nfs/dbraw/zinc/45/62/39/345456239.db2.gz ZKPVQIHVWBZBIC-UHFFFAOYSA-N 1 2 218.304 2.359 20 0 BEADLO Cc1ccc(CCNc2cccc[nH+]2)cn1 ZINC000080981803 345458097 /nfs/dbraw/zinc/45/80/97/345458097.db2.gz BYQAXAHLNCAAFC-UHFFFAOYSA-N 1 2 213.284 2.440 20 0 BEADLO CSCCCNc1[nH+]c(C)nc2[nH]ccc21 ZINC000081000837 345458300 /nfs/dbraw/zinc/45/83/00/345458300.db2.gz MNSXLVAYCAYOTH-UHFFFAOYSA-N 1 2 236.344 2.431 20 0 BEADLO COC(=O)[C@](C)([NH2+]CCc1ccccc1)C1CC1 ZINC000081153652 345463537 /nfs/dbraw/zinc/46/35/37/345463537.db2.gz VSEZFNDJSQGOGL-OAHLLOKOSA-N 1 2 247.338 2.160 20 0 BEADLO COC(=O)[C@@](C)([NH2+]CCc1ccccc1)C1CC1 ZINC000081153655 345463563 /nfs/dbraw/zinc/46/35/63/345463563.db2.gz VSEZFNDJSQGOGL-HNNXBMFYSA-N 1 2 247.338 2.160 20 0 BEADLO COC(=O)[C@@](C)([NH2+]Cc1ccccc1C)C1CC1 ZINC000081154045 345463585 /nfs/dbraw/zinc/46/35/85/345463585.db2.gz TVSGWOOYULJXHI-HNNXBMFYSA-N 1 2 247.338 2.426 20 0 BEADLO FC(F)n1ccnc1C[N@@H+]1CCC12CCC2 ZINC000081531955 345476623 /nfs/dbraw/zinc/47/66/23/345476623.db2.gz ZWRCOCAJTDAJLP-UHFFFAOYSA-N 1 2 227.258 2.407 20 0 BEADLO FC(F)n1ccnc1C[N@H+]1CCC12CCC2 ZINC000081531955 345476626 /nfs/dbraw/zinc/47/66/26/345476626.db2.gz ZWRCOCAJTDAJLP-UHFFFAOYSA-N 1 2 227.258 2.407 20 0 BEADLO CCCc1noc(C[N@@H+]2CCC23CCC3)n1 ZINC000081545804 345477604 /nfs/dbraw/zinc/47/76/04/345477604.db2.gz IRQPTFGKWZLFAF-UHFFFAOYSA-N 1 2 221.304 2.151 20 0 BEADLO CCCc1noc(C[N@H+]2CCC23CCC3)n1 ZINC000081545804 345477605 /nfs/dbraw/zinc/47/76/05/345477605.db2.gz IRQPTFGKWZLFAF-UHFFFAOYSA-N 1 2 221.304 2.151 20 0 BEADLO Cc1cc(N(C)Cc2ccc(O)cc2)nc[nH+]1 ZINC000089635126 345557630 /nfs/dbraw/zinc/55/76/30/345557630.db2.gz SBFBMKIBAOVSMA-UHFFFAOYSA-N 1 2 229.283 2.127 20 0 BEADLO CC(C)CC(C)(C)C(=O)NCc1[nH]cc[nH+]1 ZINC000084601433 345519192 /nfs/dbraw/zinc/51/91/92/345519192.db2.gz XBBDAHNZFTYKMH-UHFFFAOYSA-N 1 2 223.320 2.098 20 0 BEADLO Cn1c[nH+]c(CS[C@H]2COC(C)(C)C2)c1 ZINC000603358630 349932599 /nfs/dbraw/zinc/93/25/99/349932599.db2.gz JQNQDKOQHYYUTF-SNVBAGLBSA-N 1 2 226.345 2.221 20 0 BEADLO CCC[C@@H]1C[N@H+](Cc2scnc2C)CCO1 ZINC000093508918 345662177 /nfs/dbraw/zinc/66/21/77/345662177.db2.gz LEQNVLZABZJBDR-LLVKDONJSA-N 1 2 240.372 2.452 20 0 BEADLO CCC[C@@H]1C[N@@H+](Cc2scnc2C)CCO1 ZINC000093508918 345662181 /nfs/dbraw/zinc/66/21/81/345662181.db2.gz LEQNVLZABZJBDR-LLVKDONJSA-N 1 2 240.372 2.452 20 0 BEADLO COCC[N@H+](CC(F)F)[C@@H]1CC[C@@H](C)C1 ZINC000092965780 345649546 /nfs/dbraw/zinc/64/95/46/345649546.db2.gz SQDRKOYXHJLLAI-NXEZZACHSA-N 1 2 221.291 2.389 20 0 BEADLO COCC[N@@H+](CC(F)F)[C@@H]1CC[C@@H](C)C1 ZINC000092965780 345649547 /nfs/dbraw/zinc/64/95/47/345649547.db2.gz SQDRKOYXHJLLAI-NXEZZACHSA-N 1 2 221.291 2.389 20 0 BEADLO Fc1c[nH+]ccc1N[C@@H]1CCCC12CC2 ZINC000641680165 362602440 /nfs/dbraw/zinc/60/24/40/362602440.db2.gz LLSHNUUIOJHGKS-LLVKDONJSA-N 1 2 206.264 2.387 20 0 BEADLO Fc1c[nH+]ccc1N1CCO[C@H](C(F)F)CC1 ZINC000641681404 362603228 /nfs/dbraw/zinc/60/32/28/362603228.db2.gz GXVXAGGCZNUHST-JTQLQIEISA-N 1 2 246.232 2.081 20 0 BEADLO CCc1nc(CC)n(Cc2c[nH+]ccc2C)n1 ZINC000418910502 192090219 /nfs/dbraw/zinc/09/02/19/192090219.db2.gz UUBATQCKONXWEF-UHFFFAOYSA-N 1 2 230.315 2.155 20 0 BEADLO CC/C=C\CCn1cc[nH+]c1CN1CCOCC1 ZINC000641724741 362640119 /nfs/dbraw/zinc/64/01/19/362640119.db2.gz HZCBHEJDRACRSF-ARJAWSKDSA-N 1 2 249.358 2.072 20 0 BEADLO CC/C=C/CCn1cc[nH+]c1CN1CCOCC1 ZINC000641724752 362640539 /nfs/dbraw/zinc/64/05/39/362640539.db2.gz HZCBHEJDRACRSF-ONEGZZNKSA-N 1 2 249.358 2.072 20 0 BEADLO CCCC[C@@H](C)C(=O)NCCCn1cc[nH+]c1 ZINC000139874500 345802837 /nfs/dbraw/zinc/80/28/37/345802837.db2.gz ZJSHOYQGCGTHNZ-GFCCVEGCSA-N 1 2 237.347 2.216 20 0 BEADLO Cn1c2c(cccc2F)[nH]c1=[NH+]C[C@@H]1CC12CC2 ZINC000418981359 192091321 /nfs/dbraw/zinc/09/13/21/192091321.db2.gz QFUREMRGKPESNF-VIFPVBQESA-N 1 2 245.301 2.346 20 0 BEADLO Cc1ccc(C(=O)N[C@H](C)c2[nH]cc[nH+]2)cc1F ZINC000141100409 345836296 /nfs/dbraw/zinc/83/62/96/345836296.db2.gz OIKWPIFOZQEFAP-SECBINFHSA-N 1 2 247.273 2.348 20 0 BEADLO COc1cc2c(cc1OC(C)C)C=[NH+]CC2 ZINC000143674389 345867059 /nfs/dbraw/zinc/86/70/59/345867059.db2.gz BEDOOZHQUQCJTM-UHFFFAOYSA-N 1 2 219.284 2.457 20 0 BEADLO CCc1c[nH]c(CC(=O)N(C)C(C)(C)CC)[nH+]1 ZINC000635580354 345877174 /nfs/dbraw/zinc/87/71/74/345877174.db2.gz ASCVGFZORKMNRC-UHFFFAOYSA-N 1 2 237.347 2.162 20 0 BEADLO CCC(C)(C)N(C)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635582480 345878761 /nfs/dbraw/zinc/87/87/61/345878761.db2.gz SINVODOFRCCGSE-NXEZZACHSA-N 1 2 235.331 2.160 20 0 BEADLO CCC(C)(C)N(C)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635582480 345878765 /nfs/dbraw/zinc/87/87/65/345878765.db2.gz SINVODOFRCCGSE-NXEZZACHSA-N 1 2 235.331 2.160 20 0 BEADLO CC(C)(C)CCCNC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635593608 345885466 /nfs/dbraw/zinc/88/54/66/345885466.db2.gz BPDNXKITQQPBNH-GHMZBOCLSA-N 1 2 249.358 2.456 20 0 BEADLO CC(C)(C)CCCNC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635593608 345885468 /nfs/dbraw/zinc/88/54/68/345885468.db2.gz BPDNXKITQQPBNH-GHMZBOCLSA-N 1 2 249.358 2.456 20 0 BEADLO C[C@@H]1C[C@@H](Nc2cc(NC3CC3)[nH+]cn2)[C@H](C)O1 ZINC000631466787 345921381 /nfs/dbraw/zinc/92/13/81/345921381.db2.gz XAUXHQWXGBGPDG-WCABBAIRSA-N 1 2 248.330 2.029 20 0 BEADLO C[C@@H]1C[C@@H](Nc2cc(NC3CC3)nc[nH+]2)[C@H](C)O1 ZINC000631466787 345921384 /nfs/dbraw/zinc/92/13/84/345921384.db2.gz XAUXHQWXGBGPDG-WCABBAIRSA-N 1 2 248.330 2.029 20 0 BEADLO CNc1cc(N2C[C@@H](C)C[C@H](C)C2)nc[nH+]1 ZINC000087805636 345940682 /nfs/dbraw/zinc/94/06/82/345940682.db2.gz VPJCYVVGOPRABG-UWVGGRQHSA-N 1 2 220.320 2.001 20 0 BEADLO CNc1cc(N2C[C@@H](C)C[C@H](C)C2)[nH+]cn1 ZINC000087805636 345940685 /nfs/dbraw/zinc/94/06/85/345940685.db2.gz VPJCYVVGOPRABG-UWVGGRQHSA-N 1 2 220.320 2.001 20 0 BEADLO CC[C@@H]1CCCCN1c1cc(NC)[nH+]cn1 ZINC000087808996 345941839 /nfs/dbraw/zinc/94/18/39/345941839.db2.gz VFQBOABEDSHERY-SNVBAGLBSA-N 1 2 220.320 2.287 20 0 BEADLO CC[C@@H]1CCCCN1c1cc(NC)nc[nH+]1 ZINC000087808996 345941841 /nfs/dbraw/zinc/94/18/41/345941841.db2.gz VFQBOABEDSHERY-SNVBAGLBSA-N 1 2 220.320 2.287 20 0 BEADLO CNc1cc(NCc2cccs2)nc[nH+]1 ZINC000087808671 345941938 /nfs/dbraw/zinc/94/19/38/345941938.db2.gz BRHVTRWLRWRQPC-UHFFFAOYSA-N 1 2 220.301 2.192 20 0 BEADLO CNc1cc(NCc2cccs2)[nH+]cn1 ZINC000087808671 345941940 /nfs/dbraw/zinc/94/19/40/345941940.db2.gz BRHVTRWLRWRQPC-UHFFFAOYSA-N 1 2 220.301 2.192 20 0 BEADLO Cc1ncc(C[NH2+][C@@H](C)c2c(C)noc2C)o1 ZINC000628217604 345944122 /nfs/dbraw/zinc/94/41/22/345944122.db2.gz DCGPUSBHIDFWDX-ZETCQYMHSA-N 1 2 235.287 2.439 20 0 BEADLO CC[C@@]1(C)CCN(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635682969 345976928 /nfs/dbraw/zinc/97/69/28/345976928.db2.gz TYFRZIUXRYAUEI-GYSYKLTISA-N 1 2 247.342 2.162 20 0 BEADLO CC[C@@]1(C)CCN(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635682969 345976931 /nfs/dbraw/zinc/97/69/31/345976931.db2.gz TYFRZIUXRYAUEI-GYSYKLTISA-N 1 2 247.342 2.162 20 0 BEADLO CCc1c[nH]c(CC(=O)N2[C@H](CC)CC[C@@H]2C)[nH+]1 ZINC000635764511 346057461 /nfs/dbraw/zinc/05/74/61/346057461.db2.gz NGEMMKLRTANHQQ-CMPLNLGQSA-N 1 2 249.358 2.304 20 0 BEADLO Cc1cc(N2C[C@H](C)[C@@H](C)[C@@H]2C)nc[nH+]1 ZINC000419019695 192094747 /nfs/dbraw/zinc/09/47/47/192094747.db2.gz QXGQGYLUXNMWGE-GDPRMGEGSA-N 1 2 205.305 2.266 20 0 BEADLO COCCCCN(C)c1[nH+]c2ccccc2n1C ZINC000419020276 192094788 /nfs/dbraw/zinc/09/47/88/192094788.db2.gz WQZJMSRHVNIGJL-UHFFFAOYSA-N 1 2 247.342 2.436 20 0 BEADLO Cc1cc(N2C[C@H](C)[C@H](C)[C@@H]2C)nc[nH+]1 ZINC000419019699 192095093 /nfs/dbraw/zinc/09/50/93/192095093.db2.gz QXGQGYLUXNMWGE-LSJOCFKGSA-N 1 2 205.305 2.266 20 0 BEADLO CC(C)C[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635722859 346031653 /nfs/dbraw/zinc/03/16/53/346031653.db2.gz CNTOBQMKWVWSPG-GMTAPVOTSA-N 1 2 235.331 2.064 20 0 BEADLO CC(C)C[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635722859 346031655 /nfs/dbraw/zinc/03/16/55/346031655.db2.gz CNTOBQMKWVWSPG-GMTAPVOTSA-N 1 2 235.331 2.064 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CC[C@H](C)[C@H](C)C2)[nH+]1 ZINC000635752708 346049886 /nfs/dbraw/zinc/04/98/86/346049886.db2.gz MEEHJBSOKNFGIF-WDEREUQCSA-N 1 2 249.358 2.019 20 0 BEADLO CCN(CCC1CC1)C(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635816744 346071267 /nfs/dbraw/zinc/07/12/67/346071267.db2.gz PLRWEDPXDRPMKJ-VXGBXAGGSA-N 1 2 247.342 2.162 20 0 BEADLO CCN(CCC1CC1)C(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635816744 346071268 /nfs/dbraw/zinc/07/12/68/346071268.db2.gz PLRWEDPXDRPMKJ-VXGBXAGGSA-N 1 2 247.342 2.162 20 0 BEADLO CC(C)=C(C)CC(=O)N[C@@H]1CCn2cc[nH+]c2C1 ZINC000635821352 346076933 /nfs/dbraw/zinc/07/69/33/346076933.db2.gz WKQOKCLWMXHANP-GFCCVEGCSA-N 1 2 247.342 2.061 20 0 BEADLO FC1(C[N@@H+]2CCC[C@H](c3ccn[nH]3)C2)CC1 ZINC000684357133 488300008 /nfs/dbraw/zinc/30/00/08/488300008.db2.gz XWLHIKFYLSYPSY-JTQLQIEISA-N 1 2 223.295 2.091 20 0 BEADLO CC1(C)CC(CNC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C1 ZINC000635833561 346086675 /nfs/dbraw/zinc/08/66/75/346086675.db2.gz ANXMUPYRGCRZTL-GHMZBOCLSA-N 1 2 247.342 2.066 20 0 BEADLO CC1(C)CC(CNC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C1 ZINC000635833561 346086678 /nfs/dbraw/zinc/08/66/78/346086678.db2.gz ANXMUPYRGCRZTL-GHMZBOCLSA-N 1 2 247.342 2.066 20 0 BEADLO FC1(C[N@H+]2CCC[C@H](c3ccn[nH]3)C2)CC1 ZINC000684357133 488300010 /nfs/dbraw/zinc/30/00/10/488300010.db2.gz XWLHIKFYLSYPSY-JTQLQIEISA-N 1 2 223.295 2.091 20 0 BEADLO CC(C)=C(C)CC(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000635945071 346118600 /nfs/dbraw/zinc/11/86/00/346118600.db2.gz ZFLBYBBFPKAJMZ-UHFFFAOYSA-N 1 2 233.315 2.041 20 0 BEADLO CC(C)=C(C)CC(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000635945071 346118603 /nfs/dbraw/zinc/11/86/03/346118603.db2.gz ZFLBYBBFPKAJMZ-UHFFFAOYSA-N 1 2 233.315 2.041 20 0 BEADLO CC[C@@H]1CCN1C(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC000635958287 346132308 /nfs/dbraw/zinc/13/23/08/346132308.db2.gz WFAFDFCMZULVOS-CHWSQXEVSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@H]1[C@@H](C)N(C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)C[C@H]1C ZINC000636033468 346169483 /nfs/dbraw/zinc/16/94/83/346169483.db2.gz BQXAAQPCEFRWLO-LZQZFOIKSA-N 1 2 247.342 2.016 20 0 BEADLO C[C@H]1[C@@H](C)N(C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)C[C@H]1C ZINC000636033468 346169486 /nfs/dbraw/zinc/16/94/86/346169486.db2.gz BQXAAQPCEFRWLO-LZQZFOIKSA-N 1 2 247.342 2.016 20 0 BEADLO Cc1[nH]c(CN2C[C@H](C)O[C@H](C)[C@@H]2C)[nH+]c1C ZINC000628244680 346209373 /nfs/dbraw/zinc/20/93/73/346209373.db2.gz RSPLSDAMPUVPHY-KPXOXKRLSA-N 1 2 237.347 2.024 20 0 BEADLO COc1cc[nH+]cc1Cn1cnc(C(C)(C)C)n1 ZINC000419041487 192098341 /nfs/dbraw/zinc/09/83/41/192098341.db2.gz ZDZDYEFNIJSSBJ-UHFFFAOYSA-N 1 2 246.314 2.028 20 0 BEADLO Cc1ncc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)o1 ZINC000628235097 346188355 /nfs/dbraw/zinc/18/83/55/346188355.db2.gz YOJCQNBGHOAEFG-KWQFWETISA-N 1 2 212.268 2.163 20 0 BEADLO Cc1ncc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)o1 ZINC000628235097 346188359 /nfs/dbraw/zinc/18/83/59/346188359.db2.gz YOJCQNBGHOAEFG-KWQFWETISA-N 1 2 212.268 2.163 20 0 BEADLO Cc1[nH]c(CN2CC[C@H](C)[C@H](F)C2)[nH+]c1C ZINC000628234829 346188587 /nfs/dbraw/zinc/18/85/87/346188587.db2.gz OLHFTTZEXFQPAJ-GZMMTYOYSA-N 1 2 225.311 2.206 20 0 BEADLO C[C@@H]1CSCC[N@@H+]1Cc1ccc(Cl)nn1 ZINC000167407523 346243963 /nfs/dbraw/zinc/24/39/63/346243963.db2.gz WBXWQCDXYQEOPC-MRVPVSSYSA-N 1 2 243.763 2.067 20 0 BEADLO C[C@@H]1CSCC[N@H+]1Cc1ccc(Cl)nn1 ZINC000167407523 346243966 /nfs/dbraw/zinc/24/39/66/346243966.db2.gz WBXWQCDXYQEOPC-MRVPVSSYSA-N 1 2 243.763 2.067 20 0 BEADLO CC[C@@H]1CN(Cc2[nH]c(C)c(C)[nH+]2)CCCO1 ZINC000628260733 346260350 /nfs/dbraw/zinc/26/03/50/346260350.db2.gz SKYDPBQYODATQC-GFCCVEGCSA-N 1 2 237.347 2.027 20 0 BEADLO Cc1[nH]c(CN2C[C@@H](C3CC3)O[C@@H](C)C2)[nH+]c1C ZINC000628255466 346249376 /nfs/dbraw/zinc/24/93/76/346249376.db2.gz NPQYSUWMNXGOGA-ZANVPECISA-N 1 2 249.358 2.026 20 0 BEADLO CCCCc1cc(N[C@@H]2CO[C@H](C)C2)nc[nH+]1 ZINC000631331514 346260740 /nfs/dbraw/zinc/26/07/40/346260740.db2.gz WFZQVAQKSBVCOP-PWSUYJOCSA-N 1 2 235.331 2.409 20 0 BEADLO CSc1ccc(C[NH2+]Cc2cc(C)ncn2)o1 ZINC000641745675 362667145 /nfs/dbraw/zinc/66/71/45/362667145.db2.gz ZEPXJNJPTQEDQS-UHFFFAOYSA-N 1 2 249.339 2.390 20 0 BEADLO Cc1c[nH]c(CN2CCCC[C@@H]2C(F)F)[nH+]1 ZINC000628262651 346261839 /nfs/dbraw/zinc/26/18/39/346261839.db2.gz SQLCLWKSKIWHHI-SECBINFHSA-N 1 2 229.274 2.338 20 0 BEADLO Cc1cccc(C(=O)N[C@@H](C)Cn2cc[nH+]c2)c1 ZINC000042512279 179021436 /nfs/dbraw/zinc/02/14/36/179021436.db2.gz HAPQLXQPSJKOPR-LBPRGKRZSA-N 1 2 243.310 2.010 20 0 BEADLO Cc1ncc(C[N@@H+]2CCCC[C@@H]2c2cc[nH]n2)o1 ZINC000628271753 346282342 /nfs/dbraw/zinc/28/23/42/346282342.db2.gz ORDXZYYDRMZSSW-CYBMUJFWSA-N 1 2 246.314 2.433 20 0 BEADLO Cc1ncc(C[N@H+]2CCCC[C@@H]2c2cc[nH]n2)o1 ZINC000628271753 346282344 /nfs/dbraw/zinc/28/23/44/346282344.db2.gz ORDXZYYDRMZSSW-CYBMUJFWSA-N 1 2 246.314 2.433 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2CC(C)(C)[C@H]2[C@@H]2CCCO2)n1 ZINC000628284206 346295818 /nfs/dbraw/zinc/29/58/18/346295818.db2.gz CQSKTCLHSPAGLM-WCQYABFASA-N 1 2 249.358 2.108 20 0 BEADLO Cc1c[nH]c(C[N@H+]2CC(C)(C)[C@H]2[C@@H]2CCCO2)n1 ZINC000628284206 346295822 /nfs/dbraw/zinc/29/58/22/346295822.db2.gz CQSKTCLHSPAGLM-WCQYABFASA-N 1 2 249.358 2.108 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CCC23CCCC3)[nH+]1 ZINC000636120119 346324669 /nfs/dbraw/zinc/32/46/69/346324669.db2.gz LZDQCKWQBYQNOG-UHFFFAOYSA-N 1 2 247.342 2.060 20 0 BEADLO Cc1cccc(CCCNc2cnccn2)[nH+]1 ZINC000286698697 179055694 /nfs/dbraw/zinc/05/56/94/179055694.db2.gz YGNWZWUEHIOUHW-UHFFFAOYSA-N 1 2 228.299 2.225 20 0 BEADLO Oc1cccc2c1CC[C@@H]2[NH2+]Cc1ccon1 ZINC000148664762 346384533 /nfs/dbraw/zinc/38/45/33/346384533.db2.gz CBTYJWQSRHMGJC-LBPRGKRZSA-N 1 2 230.267 2.157 20 0 BEADLO Cc1cccc(CN(C)c2cccc[nH+]2)n1 ZINC000336468885 179072229 /nfs/dbraw/zinc/07/22/29/179072229.db2.gz ABWLRUASYDVENA-UHFFFAOYSA-N 1 2 213.284 2.421 20 0 BEADLO CCCC[C@@H](C)C(=O)NCc1[nH]c[nH+]c1C ZINC000282492442 346406411 /nfs/dbraw/zinc/40/64/11/346406411.db2.gz NBHTYKQLVMGGKZ-SECBINFHSA-N 1 2 223.320 2.161 20 0 BEADLO Cc1cccc(C[N@@H+]2CCC[C@@H]2c2cc[nH]n2)n1 ZINC000072361413 179077581 /nfs/dbraw/zinc/07/75/81/179077581.db2.gz DXMNEXOODAGMCO-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc(C[N@H+]2CCC[C@@H]2c2cc[nH]n2)n1 ZINC000072361413 179077582 /nfs/dbraw/zinc/07/75/82/179077582.db2.gz DXMNEXOODAGMCO-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc(C[N@@H+]2CCC[C@H]2c2cc[nH]n2)n1 ZINC000072361414 179076455 /nfs/dbraw/zinc/07/64/55/179076455.db2.gz DXMNEXOODAGMCO-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cccc(C[N@H+]2CCC[C@H]2c2cc[nH]n2)n1 ZINC000072361414 179076458 /nfs/dbraw/zinc/07/64/58/179076458.db2.gz DXMNEXOODAGMCO-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)N[C@H](C)C(F)F ZINC000641791635 362732020 /nfs/dbraw/zinc/73/20/20/362732020.db2.gz LKERPIWVMJURMS-SFYZADRCSA-N 1 2 217.263 2.207 20 0 BEADLO COc1cncc(C[NH2+][C@H](C)C(F)F)c1C ZINC000641794112 362734452 /nfs/dbraw/zinc/73/44/52/362734452.db2.gz KONLRLHHNVITBO-MRVPVSSYSA-N 1 2 230.258 2.142 20 0 BEADLO CCOc1cncc(C[NH2+][C@H](C)C(F)F)c1 ZINC000641794075 362734536 /nfs/dbraw/zinc/73/45/36/362734536.db2.gz JYSFVSDEAOFCQJ-MRVPVSSYSA-N 1 2 230.258 2.224 20 0 BEADLO C[C@H]([NH2+]Cc1ccc2c(c1)ncn2C)C(F)F ZINC000641793630 362735917 /nfs/dbraw/zinc/73/59/17/362735917.db2.gz MJMREZXAOHNEPF-QMMMGPOBSA-N 1 2 239.269 2.317 20 0 BEADLO Cc1nnc(C[N@@H+]2CCc3ccccc3[C@@H]2C)o1 ZINC000170955916 346489040 /nfs/dbraw/zinc/48/90/40/346489040.db2.gz NFXRSEHJLJHJGU-JTQLQIEISA-N 1 2 243.310 2.497 20 0 BEADLO Cc1nnc(C[N@H+]2CCc3ccccc3[C@@H]2C)o1 ZINC000170955916 346489042 /nfs/dbraw/zinc/48/90/42/346489042.db2.gz NFXRSEHJLJHJGU-JTQLQIEISA-N 1 2 243.310 2.497 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(C)c1cccc(C)c1 ZINC000279524701 179112302 /nfs/dbraw/zinc/11/23/02/179112302.db2.gz VMGFGKUSXLUGJY-UHFFFAOYSA-N 1 2 243.310 2.232 20 0 BEADLO CC(C)C[C@@H]1C[C@H]1NC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000580625236 365830438 /nfs/dbraw/zinc/83/04/38/365830438.db2.gz KLVLGFLSRZDEBQ-GHMZBOCLSA-N 1 2 249.358 2.238 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@H](C)C(C)(C)C ZINC000563547631 323129832 /nfs/dbraw/zinc/12/98/32/323129832.db2.gz MWQDOTBMSAYINA-NXEZZACHSA-N 1 2 237.347 2.139 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@H](C)C(C)(C)C ZINC000563547631 323129833 /nfs/dbraw/zinc/12/98/33/323129833.db2.gz MWQDOTBMSAYINA-NXEZZACHSA-N 1 2 237.347 2.139 20 0 BEADLO Cc1cccc(NC(=O)Cn2cc[nH+]c2)c1C ZINC000010809211 179130817 /nfs/dbraw/zinc/13/08/17/179130817.db2.gz LAANVMBZEVPMRD-UHFFFAOYSA-N 1 2 229.283 2.139 20 0 BEADLO CCc1cnc(C[NH2+]Cc2ccccn2)s1 ZINC000164909689 346633105 /nfs/dbraw/zinc/63/31/05/346633105.db2.gz MEHNBCKQGNWZDM-UHFFFAOYSA-N 1 2 233.340 2.390 20 0 BEADLO Cc1cccc(OCC[N@@H+](C)Cc2ncc[nH]2)c1 ZINC000109831659 179166505 /nfs/dbraw/zinc/16/65/05/179166505.db2.gz OUDGWBUXFXCDGC-UHFFFAOYSA-N 1 2 245.326 2.229 20 0 BEADLO Cc1cccc(OCC[N@H+](C)Cc2ncc[nH]2)c1 ZINC000109831659 179166509 /nfs/dbraw/zinc/16/65/09/179166509.db2.gz OUDGWBUXFXCDGC-UHFFFAOYSA-N 1 2 245.326 2.229 20 0 BEADLO Cc1nn(C)c(C)c1Nc1cccc(C)[nH+]1 ZINC000274553417 179159147 /nfs/dbraw/zinc/15/91/47/179159147.db2.gz AHRWMFYAPOLKFN-UHFFFAOYSA-N 1 2 216.288 2.484 20 0 BEADLO Cc1c[nH]c(CN2CCOC[C@H]2CC2CCC2)[nH+]1 ZINC000628296976 347243394 /nfs/dbraw/zinc/24/33/94/347243394.db2.gz FLKCJILSCSRVRN-CYBMUJFWSA-N 1 2 249.358 2.109 20 0 BEADLO O=C([C@H]1C[C@@H]1C1CC1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000497349527 347267439 /nfs/dbraw/zinc/26/74/39/347267439.db2.gz VRPCSDCFIUMRBD-WOPDTQHZSA-N 1 2 245.326 2.119 20 0 BEADLO O=C([C@H]1C[C@@H]1C1CC1)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000497349526 347267778 /nfs/dbraw/zinc/26/77/78/347267778.db2.gz VRPCSDCFIUMRBD-GRYCIOLGSA-N 1 2 245.326 2.119 20 0 BEADLO CO[C@H]([C@H](C)Nc1cc(C)[nH+]cn1)C1CC1 ZINC000388259929 347274133 /nfs/dbraw/zinc/27/41/33/347274133.db2.gz CPUBNRSNDCLEOZ-JOYOIKCWSA-N 1 2 221.304 2.010 20 0 BEADLO C[C@H]([NH2+]CC(C)(F)F)c1cccc(CO)c1 ZINC000382321596 347277176 /nfs/dbraw/zinc/27/71/76/347277176.db2.gz TZOUKUQAWUNDOQ-VIFPVBQESA-N 1 2 229.270 2.485 20 0 BEADLO Cc1nc(C[NH2+][C@@H](C)c2cncc(F)c2)[nH]c1C ZINC000581259883 347368763 /nfs/dbraw/zinc/36/87/63/347368763.db2.gz ABVVBHOVOXIWHZ-JTQLQIEISA-N 1 2 248.305 2.411 20 0 BEADLO Cc1[nH]c(CN[C@@H](C)c2cncc(F)c2)[nH+]c1C ZINC000581259883 347368766 /nfs/dbraw/zinc/36/87/66/347368766.db2.gz ABVVBHOVOXIWHZ-JTQLQIEISA-N 1 2 248.305 2.411 20 0 BEADLO CCn1nccc1C[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000679359482 488345062 /nfs/dbraw/zinc/34/50/62/488345062.db2.gz QEWXFFPTRJWYIU-PWSUYJOCSA-N 1 2 225.311 2.083 20 0 BEADLO CCn1nccc1C[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000679359482 488345063 /nfs/dbraw/zinc/34/50/63/488345063.db2.gz QEWXFFPTRJWYIU-PWSUYJOCSA-N 1 2 225.311 2.083 20 0 BEADLO CCn1ncnc1C[N@H+](CC)Cc1ccccc1 ZINC000193291850 347394843 /nfs/dbraw/zinc/39/48/43/347394843.db2.gz FVTLNIKCQUOLTR-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CCn1ncnc1C[N@@H+](CC)Cc1ccccc1 ZINC000193291850 347394846 /nfs/dbraw/zinc/39/48/46/347394846.db2.gz FVTLNIKCQUOLTR-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO Cc1ccc(C(=O)N(C)Cc2c[nH+]c[nH]2)c(C)c1 ZINC000616922320 347452777 /nfs/dbraw/zinc/45/27/77/347452777.db2.gz XWSBRWNQGYIPCB-UHFFFAOYSA-N 1 2 243.310 2.299 20 0 BEADLO Cc1ccc(C(=O)N(C)Cc2c[nH]c[nH+]2)c(C)c1 ZINC000616922320 347452780 /nfs/dbraw/zinc/45/27/80/347452780.db2.gz XWSBRWNQGYIPCB-UHFFFAOYSA-N 1 2 243.310 2.299 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)CCc1ccsc1 ZINC000616923004 347454066 /nfs/dbraw/zinc/45/40/66/347454066.db2.gz QIKVJAOGSAWNLX-UHFFFAOYSA-N 1 2 249.339 2.062 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)CCc1ccsc1 ZINC000616923004 347454069 /nfs/dbraw/zinc/45/40/69/347454069.db2.gz QIKVJAOGSAWNLX-UHFFFAOYSA-N 1 2 249.339 2.062 20 0 BEADLO CC[C@H](C)CCC(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616928725 347494758 /nfs/dbraw/zinc/49/47/58/347494758.db2.gz JYDBGNRVZMVLCL-JTQLQIEISA-N 1 2 223.320 2.194 20 0 BEADLO CC[C@H](C)CCC(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616928725 347494759 /nfs/dbraw/zinc/49/47/59/347494759.db2.gz JYDBGNRVZMVLCL-JTQLQIEISA-N 1 2 223.320 2.194 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)CC1(C)CCCC1 ZINC000616928614 347495272 /nfs/dbraw/zinc/49/52/72/347495272.db2.gz GULIJRXSJPPWSR-UHFFFAOYSA-N 1 2 235.331 2.339 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)CC1(C)CCCC1 ZINC000616928614 347495276 /nfs/dbraw/zinc/49/52/76/347495276.db2.gz GULIJRXSJPPWSR-UHFFFAOYSA-N 1 2 235.331 2.339 20 0 BEADLO CC[C@H]1CCC[C@@H]1C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616929024 347495805 /nfs/dbraw/zinc/49/58/05/347495805.db2.gz RGCZGFMGAZNRAM-JQWIXIFHSA-N 1 2 235.331 2.194 20 0 BEADLO CC[C@H]1CCC[C@@H]1C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616929024 347495810 /nfs/dbraw/zinc/49/58/10/347495810.db2.gz RGCZGFMGAZNRAM-JQWIXIFHSA-N 1 2 235.331 2.194 20 0 BEADLO CC(C)(C)CC(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000590729394 347497427 /nfs/dbraw/zinc/49/74/27/347497427.db2.gz JEBPJPLXLWQKBQ-LBPRGKRZSA-N 1 2 249.358 2.483 20 0 BEADLO CC(C)C[C@H](C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616927349 347458680 /nfs/dbraw/zinc/45/86/80/347458680.db2.gz FZHIXJBQYGIMMA-JTQLQIEISA-N 1 2 223.320 2.050 20 0 BEADLO CC(C)C[C@H](C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616927349 347458683 /nfs/dbraw/zinc/45/86/83/347458683.db2.gz FZHIXJBQYGIMMA-JTQLQIEISA-N 1 2 223.320 2.050 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)[C@@H]1CCC(C)(C)C1 ZINC000616927135 347459498 /nfs/dbraw/zinc/45/94/98/347459498.db2.gz AYLGTGFUHYWBSL-SNVBAGLBSA-N 1 2 235.331 2.194 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)[C@@H]1CCC(C)(C)C1 ZINC000616927135 347459500 /nfs/dbraw/zinc/45/95/00/347459500.db2.gz AYLGTGFUHYWBSL-SNVBAGLBSA-N 1 2 235.331 2.194 20 0 BEADLO CCC(CC)CC(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000616927011 347459639 /nfs/dbraw/zinc/45/96/39/347459639.db2.gz YGXVIADDGCQNJV-UHFFFAOYSA-N 1 2 223.320 2.194 20 0 BEADLO CCC(CC)CC(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000616927011 347459641 /nfs/dbraw/zinc/45/96/41/347459641.db2.gz YGXVIADDGCQNJV-UHFFFAOYSA-N 1 2 223.320 2.194 20 0 BEADLO Cc1ccccc1C(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000042511558 179250735 /nfs/dbraw/zinc/25/07/35/179250735.db2.gz LSZHLASKAVYLNR-LBPRGKRZSA-N 1 2 243.310 2.010 20 0 BEADLO CC[C@@H](C)N(CC)C(=O)[C@H]1CCn2cc[nH+]c2C1 ZINC000616974547 347546082 /nfs/dbraw/zinc/54/60/82/347546082.db2.gz NQFMOHGWBIICBS-NEPJUHHUSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1[nH]c2ccc(CSC[C@H](C)O)cc2[nH+]1 ZINC000413016444 323149845 /nfs/dbraw/zinc/14/98/45/323149845.db2.gz LXCKRMRRFCXNOG-QMMMGPOBSA-N 1 2 236.340 2.485 20 0 BEADLO Cc1[nH]c2cc(CSC[C@H](C)O)ccc2[nH+]1 ZINC000413016444 323149846 /nfs/dbraw/zinc/14/98/46/323149846.db2.gz LXCKRMRRFCXNOG-QMMMGPOBSA-N 1 2 236.340 2.485 20 0 BEADLO CC1(NC(=O)CCCn2cc[nH+]c2)CCCC1 ZINC000590835847 347572117 /nfs/dbraw/zinc/57/21/17/347572117.db2.gz RXNKGSFRIBSCMJ-UHFFFAOYSA-N 1 2 235.331 2.112 20 0 BEADLO CCc1cc(N(C)CC2CC2)nc(CC)[nH+]1 ZINC001639306203 1172093653 /nfs/dbraw/zinc/09/36/53/1172093653.db2.gz SJKASTBCYNUENO-UHFFFAOYSA-N 1 2 219.332 2.448 20 0 BEADLO CCC[C@@H]1CN(c2cccc[nH+]2)CCO1 ZINC000197893296 347597612 /nfs/dbraw/zinc/59/76/12/347597612.db2.gz FXZCMEOQXSRCGF-LLVKDONJSA-N 1 2 206.289 2.087 20 0 BEADLO CC[C@H](C)N(CC)C(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000616975914 347548027 /nfs/dbraw/zinc/54/80/27/347548027.db2.gz JZXBICNDXTWSRQ-QJPTWQEYSA-N 1 2 249.358 2.171 20 0 BEADLO Cc1cc(N(C)Cc2cnccc2C)nc[nH+]1 ZINC000360115151 187379794 /nfs/dbraw/zinc/37/97/94/187379794.db2.gz LACDWHYNWBNVAC-UHFFFAOYSA-N 1 2 228.299 2.125 20 0 BEADLO Cc1ccccc1C[NH2+]Cc1csnn1 ZINC000037719022 179283364 /nfs/dbraw/zinc/28/33/64/179283364.db2.gz OYHWCZLEZFBAIN-UHFFFAOYSA-N 1 2 219.313 2.136 20 0 BEADLO CCC[C@@](C)([NH2+]CC1=CCCC1)C(=O)OC ZINC000592068587 347726702 /nfs/dbraw/zinc/72/67/02/347726702.db2.gz DZHZSHCPMQMWBW-CYBMUJFWSA-N 1 2 225.332 2.418 20 0 BEADLO COC(=O)[C@@](C)([NH2+]CC1=CCCC1)C1CC1 ZINC000592089748 347730672 /nfs/dbraw/zinc/73/06/72/347730672.db2.gz KIKNYMCQEZVADN-ZDUSSCGKSA-N 1 2 223.316 2.028 20 0 BEADLO CC[N@H+](CCSC)Cc1nn(C)cc1Cl ZINC000592201907 347753725 /nfs/dbraw/zinc/75/37/25/347753725.db2.gz IXWVUIKDCZBFOA-UHFFFAOYSA-N 1 2 247.795 2.258 20 0 BEADLO CC[N@@H+](CCSC)Cc1nn(C)cc1Cl ZINC000592201907 347753726 /nfs/dbraw/zinc/75/37/26/347753726.db2.gz IXWVUIKDCZBFOA-UHFFFAOYSA-N 1 2 247.795 2.258 20 0 BEADLO CC[N@H+](CCSC)[C@@H](C)c1noc(C)n1 ZINC000592202985 347754756 /nfs/dbraw/zinc/75/47/56/347754756.db2.gz VCXWMEUIRVRVPU-QMMMGPOBSA-N 1 2 229.349 2.124 20 0 BEADLO CC[N@@H+](CCSC)[C@@H](C)c1noc(C)n1 ZINC000592202985 347754758 /nfs/dbraw/zinc/75/47/58/347754758.db2.gz VCXWMEUIRVRVPU-QMMMGPOBSA-N 1 2 229.349 2.124 20 0 BEADLO CC[N@H+](CCSC)Cc1noc(C2CC2)n1 ZINC000592202624 347755045 /nfs/dbraw/zinc/75/50/45/347755045.db2.gz LFWHIJXEJRPXPO-UHFFFAOYSA-N 1 2 241.360 2.132 20 0 BEADLO CC[N@@H+](CCSC)Cc1noc(C2CC2)n1 ZINC000592202624 347755048 /nfs/dbraw/zinc/75/50/48/347755048.db2.gz LFWHIJXEJRPXPO-UHFFFAOYSA-N 1 2 241.360 2.132 20 0 BEADLO CCCc1nc(C[N@H+](CC)CCSC)no1 ZINC000592204901 347756560 /nfs/dbraw/zinc/75/65/60/347756560.db2.gz WQVYMVSDFMZLEV-UHFFFAOYSA-N 1 2 243.376 2.207 20 0 BEADLO CCCc1nc(C[N@@H+](CC)CCSC)no1 ZINC000592204901 347756563 /nfs/dbraw/zinc/75/65/63/347756563.db2.gz WQVYMVSDFMZLEV-UHFFFAOYSA-N 1 2 243.376 2.207 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N1CCC[C@H]1C1CCC1 ZINC000493401768 347787051 /nfs/dbraw/zinc/78/70/51/347787051.db2.gz MFKZQNLDAZTOLQ-FWWRYZNZSA-N 1 2 245.326 2.214 20 0 BEADLO CCCCC[C@H]1CCCN1C(=O)Cn1cc[nH+]c1 ZINC000577333187 365926844 /nfs/dbraw/zinc/92/68/44/365926844.db2.gz ROTMILWPQGCFDE-ZDUSSCGKSA-N 1 2 249.358 2.454 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)Nc1ccccc1C ZINC000336585958 179299844 /nfs/dbraw/zinc/29/98/44/179299844.db2.gz FFCYNJBPBCXVSZ-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)CCC(C)(F)F ZINC000593270934 347876582 /nfs/dbraw/zinc/87/65/82/347876582.db2.gz NDDRIYJOIXYNHB-UHFFFAOYSA-N 1 2 228.242 2.186 20 0 BEADLO Cc1cc(NC2CCC2)nc(-c2ccncc2)[nH+]1 ZINC000593285652 347878465 /nfs/dbraw/zinc/87/84/65/347878465.db2.gz WVWDMSDJZHXCGL-UHFFFAOYSA-N 1 2 240.310 2.233 20 0 BEADLO C[C@H]1CC(C)(C)CN1c1nc[nH+]c(N)c1Cl ZINC000577350724 365931408 /nfs/dbraw/zinc/93/14/08/365931408.db2.gz GPKSQNLQXKIMCB-ZETCQYMHSA-N 1 2 240.738 2.337 20 0 BEADLO C[C@H]1CC(C)(C)CN1c1[nH+]cnc(N)c1Cl ZINC000577350724 365931412 /nfs/dbraw/zinc/93/14/12/365931412.db2.gz GPKSQNLQXKIMCB-ZETCQYMHSA-N 1 2 240.738 2.337 20 0 BEADLO CCOC(=O)C[N@H+](C)Cc1cccc2c1CCC2 ZINC000593565447 347912056 /nfs/dbraw/zinc/91/20/56/347912056.db2.gz GIYIGBKEGKXPBI-UHFFFAOYSA-N 1 2 247.338 2.170 20 0 BEADLO CCOC(=O)C[N@@H+](C)Cc1cccc2c1CCC2 ZINC000593565447 347912057 /nfs/dbraw/zinc/91/20/57/347912057.db2.gz GIYIGBKEGKXPBI-UHFFFAOYSA-N 1 2 247.338 2.170 20 0 BEADLO C[C@H]([NH2+]CCOCC1CCC1)c1csnn1 ZINC000419276325 192110922 /nfs/dbraw/zinc/11/09/22/192110922.db2.gz DYBNXQBWGJHKID-VIFPVBQESA-N 1 2 241.360 2.005 20 0 BEADLO C[C@@H]([NH2+]CCOCC1CCC1)c1csnn1 ZINC000419276324 192111281 /nfs/dbraw/zinc/11/12/81/192111281.db2.gz DYBNXQBWGJHKID-SECBINFHSA-N 1 2 241.360 2.005 20 0 BEADLO CCC(C)(C)C(=O)N1CC(Oc2cc[nH+]cc2)C1 ZINC000594179944 348021010 /nfs/dbraw/zinc/02/10/10/348021010.db2.gz OTCXCJQXHVJWRJ-UHFFFAOYSA-N 1 2 248.326 2.107 20 0 BEADLO CCCC[C@@H]([NH2+]C[C@@]1(C)CC1(F)F)C(=O)OC ZINC000594732706 348109203 /nfs/dbraw/zinc/10/92/03/348109203.db2.gz XDQDDWPJOAIECY-MWLCHTKSSA-N 1 2 249.301 2.353 20 0 BEADLO Cc1cccn2cc(CSCCCO)[nH+]c12 ZINC000085163343 179357378 /nfs/dbraw/zinc/35/73/78/179357378.db2.gz OZIOKNGQPSDEBI-UHFFFAOYSA-N 1 2 236.340 2.258 20 0 BEADLO c1ccc2c(C[NH2+]CCOCC3CC3)n[nH]c2c1 ZINC000594777983 348114301 /nfs/dbraw/zinc/11/43/01/348114301.db2.gz WGKHKEKVRPVLBH-UHFFFAOYSA-N 1 2 245.326 2.079 20 0 BEADLO CC(C)OC(=O)[C@H](C)[NH2+][C@H]1CC[C@H](C)SC1 ZINC000594609965 348081979 /nfs/dbraw/zinc/08/19/79/348081979.db2.gz PFUVDEOONJDVJJ-DCAQKATOSA-N 1 2 245.388 2.200 20 0 BEADLO Clc1snnc1C[NH+]1C[C@@H]2CCC[C@H]2C1 ZINC000132035182 323175338 /nfs/dbraw/zinc/17/53/38/323175338.db2.gz OTHMMOSNAZKVET-YUMQZZPRSA-N 1 2 243.763 2.423 20 0 BEADLO Cc1c[nH]c(CNc2cccc([S@](C)=O)c2)[nH+]1 ZINC000594932918 348140807 /nfs/dbraw/zinc/14/08/07/348140807.db2.gz CWDFXINKFBJAGW-KRWDZBQOSA-N 1 2 249.339 2.068 20 0 BEADLO COC(=O)C[N@H+](C)Cc1cccc(C(C)C)c1 ZINC000595290793 348213503 /nfs/dbraw/zinc/21/35/03/348213503.db2.gz ZJWZMPAEHSWFND-UHFFFAOYSA-N 1 2 235.327 2.415 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1cccc(C(C)C)c1 ZINC000595290793 348213512 /nfs/dbraw/zinc/21/35/12/348213512.db2.gz ZJWZMPAEHSWFND-UHFFFAOYSA-N 1 2 235.327 2.415 20 0 BEADLO CCOC(=O)C[C@@H](C)CNc1cccc[nH+]1 ZINC000192161838 187391290 /nfs/dbraw/zinc/39/12/90/187391290.db2.gz MLTCDMVZXKZRJG-SNVBAGLBSA-N 1 2 222.288 2.083 20 0 BEADLO Cc1cccnc1C[NH2+][C@H](CCO)c1ccco1 ZINC000185074994 179383946 /nfs/dbraw/zinc/38/39/46/179383946.db2.gz PTTOEOMGOLTXKA-GFCCVEGCSA-N 1 2 246.310 2.196 20 0 BEADLO Cc1cc(N[C@@H](CO)c2ccccc2C)nc[nH+]1 ZINC000531334380 348297284 /nfs/dbraw/zinc/29/72/84/348297284.db2.gz WMZJMBWINPJLED-ZDUSSCGKSA-N 1 2 243.310 2.239 20 0 BEADLO c1cc(C[NH+]2CCC(OC3CCC3)CC2)no1 ZINC000419284193 192122926 /nfs/dbraw/zinc/12/29/26/192122926.db2.gz KPSPQASZXKYBRY-UHFFFAOYSA-N 1 2 236.315 2.208 20 0 BEADLO CCOC(=O)[C@@H](CC)[NH2+]C1(CC(C)C)CC1 ZINC000595829945 348364932 /nfs/dbraw/zinc/36/49/32/348364932.db2.gz BEJPFYSHOZOGHT-LLVKDONJSA-N 1 2 227.348 2.496 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+]C1(CC(C)C)CC1 ZINC000595831002 348365716 /nfs/dbraw/zinc/36/57/16/348365716.db2.gz JPTYUKCRMVPDRD-SNVBAGLBSA-N 1 2 213.321 2.106 20 0 BEADLO COC(=O)Cc1cc[nH+]c(NC[C@@H]2CC2(C)C)c1 ZINC000596124638 348445599 /nfs/dbraw/zinc/44/55/99/348445599.db2.gz YHGHTSMHPBEXRX-NSHDSACASA-N 1 2 248.326 2.255 20 0 BEADLO c1cn(CCSCC[C@@H]2CCOC2)c[nH+]1 ZINC000419543114 192141223 /nfs/dbraw/zinc/14/12/23/192141223.db2.gz TXUNNIVKPBMCPY-NSHDSACASA-N 1 2 226.345 2.043 20 0 BEADLO CCc1ncc(C[NH2+]Cc2oc(C)nc2C)o1 ZINC000628300653 348455238 /nfs/dbraw/zinc/45/52/38/348455238.db2.gz QEMLTGGIYAHSHN-UHFFFAOYSA-N 1 2 235.287 2.132 20 0 BEADLO C[C@@H](O)CCSCc1cn2ccccc2[nH+]1 ZINC000596343762 348501079 /nfs/dbraw/zinc/50/10/79/348501079.db2.gz KBRYMNAIBLEEBY-SNVBAGLBSA-N 1 2 236.340 2.338 20 0 BEADLO CCc1ccc(C[NH2+]Cc2cc(C)on2)o1 ZINC000051724991 323190779 /nfs/dbraw/zinc/19/07/79/323190779.db2.gz MGTHCAGXHRYHKW-UHFFFAOYSA-N 1 2 220.272 2.428 20 0 BEADLO Cc1cc[nH+]cc1NCc1c(Cl)cnn1C ZINC000128879339 179493727 /nfs/dbraw/zinc/49/37/27/179493727.db2.gz BXDWRFNGIFIDCF-UHFFFAOYSA-N 1 2 236.706 2.389 20 0 BEADLO COc1cc(C)[nH+]c(CSCC[C@@H](C)O)c1 ZINC000596352364 348519523 /nfs/dbraw/zinc/51/95/23/348519523.db2.gz MOVZMIQIOXSSSZ-SNVBAGLBSA-N 1 2 241.356 2.403 20 0 BEADLO CCSC1(CNc2cc(CC)[nH+]cn2)CC1 ZINC000596510113 348572570 /nfs/dbraw/zinc/57/25/70/348572570.db2.gz DRMVJZBJNOFZDQ-UHFFFAOYSA-N 1 2 237.372 2.159 20 0 BEADLO Cc1c[nH+]c(CN[C@@H](C)c2ccncc2F)n1C ZINC000341337201 179607105 /nfs/dbraw/zinc/60/71/05/179607105.db2.gz FSWJHQFDFOSNGU-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](C)c2ccncc2F)n1C ZINC000341337201 179607106 /nfs/dbraw/zinc/60/71/06/179607106.db2.gz FSWJHQFDFOSNGU-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO Cc1cnc(C(C)(C)NCc2[nH]cc[nH+]2)s1 ZINC000080346094 179579119 /nfs/dbraw/zinc/57/91/19/179579119.db2.gz LXFICKOSWMZUMZ-UHFFFAOYSA-N 1 2 236.344 2.200 20 0 BEADLO COc1ccc(F)cc1C[N@@H+]1CCOC[C@@H]1C ZINC000073617582 352539319 /nfs/dbraw/zinc/53/93/19/352539319.db2.gz WHRDLYITERXMGF-JTQLQIEISA-N 1 2 239.290 2.055 20 0 BEADLO COc1ccc(F)cc1C[N@H+]1CCOC[C@@H]1C ZINC000073617582 352539322 /nfs/dbraw/zinc/53/93/22/352539322.db2.gz WHRDLYITERXMGF-JTQLQIEISA-N 1 2 239.290 2.055 20 0 BEADLO Cc1cnc(C[N@H+](C)C[C@@H]2CCCCO2)s1 ZINC000271434314 179586604 /nfs/dbraw/zinc/58/66/04/179586604.db2.gz BRAFRLUKVGWEEF-NSHDSACASA-N 1 2 240.372 2.452 20 0 BEADLO Cc1cnc(C[N@@H+](C)C[C@@H]2CCCCO2)s1 ZINC000271434314 179586606 /nfs/dbraw/zinc/58/66/06/179586606.db2.gz BRAFRLUKVGWEEF-NSHDSACASA-N 1 2 240.372 2.452 20 0 BEADLO Cc1cnccc1CNc1ccc(N(C)C)c[nH+]1 ZINC000295748654 179704446 /nfs/dbraw/zinc/70/44/46/179704446.db2.gz PJECXKHAKUZIGO-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO CC(C)N(C(=O)C[C@@H](C)n1cc[nH+]c1)C(C)C ZINC000649688612 490199960 /nfs/dbraw/zinc/19/99/60/490199960.db2.gz IOUMCCIKWPRZJD-GFCCVEGCSA-N 1 2 237.347 2.480 20 0 BEADLO Cc1noc([C@H](C)[N@H+](C)Cc2ccoc2C)n1 ZINC000055082789 349084419 /nfs/dbraw/zinc/08/44/19/349084419.db2.gz DHEXBXBXDWKTEG-QMMMGPOBSA-N 1 2 235.287 2.472 20 0 BEADLO Cc1noc([C@H](C)[N@@H+](C)Cc2ccoc2C)n1 ZINC000055082789 349084423 /nfs/dbraw/zinc/08/44/23/349084423.db2.gz DHEXBXBXDWKTEG-QMMMGPOBSA-N 1 2 235.287 2.472 20 0 BEADLO COc1ccc[nH+]c1N1CC[C@H](SC)C1 ZINC000599083203 349096567 /nfs/dbraw/zinc/09/65/67/349096567.db2.gz KMPFVVBNNOPIOC-VIFPVBQESA-N 1 2 224.329 2.032 20 0 BEADLO OC[C@H](CCF)Nc1cc2ccccc2c[nH+]1 ZINC000631340758 349290637 /nfs/dbraw/zinc/29/06/37/349290637.db2.gz LKKBUCCHAITLLP-LBPRGKRZSA-N 1 2 234.274 2.367 20 0 BEADLO CCCCc1cc(NC[C@@]2(C)CCOC2)nc[nH+]1 ZINC000631117470 349262455 /nfs/dbraw/zinc/26/24/55/349262455.db2.gz JPHYANDYGFLTCO-CQSZACIVSA-N 1 2 249.358 2.080 20 0 BEADLO C[C@H](NC(=O)CCCn1cc[nH+]c1)C1CCCC1 ZINC000603671104 350008057 /nfs/dbraw/zinc/00/80/57/350008057.db2.gz GQTQPHFCGBOLPC-LBPRGKRZSA-N 1 2 249.358 2.358 20 0 BEADLO Cc1nc(C)c(C[NH2+]Cc2csc(C)n2)o1 ZINC000311811943 350023348 /nfs/dbraw/zinc/02/33/48/350023348.db2.gz WOLFNDMTTOPNHV-UHFFFAOYSA-N 1 2 237.328 2.346 20 0 BEADLO Cc1occc1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000603785548 350032846 /nfs/dbraw/zinc/03/28/46/350032846.db2.gz AUKFSVDXTVXEGK-UHFFFAOYSA-N 1 2 241.250 2.488 20 0 BEADLO Cc1ccoc1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000603785588 350033031 /nfs/dbraw/zinc/03/30/31/350033031.db2.gz FBJBWZKOWMJEBR-UHFFFAOYSA-N 1 2 241.250 2.488 20 0 BEADLO CCO[C@@H](CC)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000603886029 350048876 /nfs/dbraw/zinc/04/88/76/350048876.db2.gz VSUCARZBPJWXIO-NSHDSACASA-N 1 2 247.298 2.088 20 0 BEADLO Cc1nc2[nH]ccc2c(N2CCC[C@@H]2C)[nH+]1 ZINC000336541675 180001974 /nfs/dbraw/zinc/00/19/74/180001974.db2.gz HJMFIEFUCYTRIT-QMMMGPOBSA-N 1 2 216.288 2.255 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H]2CC2(C)C)[nH+]1 ZINC000309686942 180021690 /nfs/dbraw/zinc/02/16/90/180021690.db2.gz HRCBEJCOFDDKGP-SECBINFHSA-N 1 2 216.288 2.477 20 0 BEADLO Cc1nc2[nH]ccc2c(N[C@@H](C)C2CC2)[nH+]1 ZINC000309812368 180022281 /nfs/dbraw/zinc/02/22/81/180022281.db2.gz UNVHATBHNFCZNB-ZETCQYMHSA-N 1 2 216.288 2.477 20 0 BEADLO Cc1nc([C@@H](C)[NH+]2CCC(CF)CC2)no1 ZINC000336260575 180032927 /nfs/dbraw/zinc/03/29/27/180032927.db2.gz AOKHWZILGMSHTR-MRVPVSSYSA-N 1 2 227.283 2.121 20 0 BEADLO Cc1c[nH]c(C[NH+]2CC(Cc3ccccc3)C2)n1 ZINC000628306374 350116858 /nfs/dbraw/zinc/11/68/58/350116858.db2.gz YPAYLROJWXWSJZ-UHFFFAOYSA-N 1 2 241.338 2.393 20 0 BEADLO Cc1nc([C@H](C)[NH+]2CCC3(CC3)CC2)no1 ZINC000368122391 180046540 /nfs/dbraw/zinc/04/65/40/180046540.db2.gz IXBKXRBISNWEBB-VIFPVBQESA-N 1 2 221.304 2.315 20 0 BEADLO FC1(F)CCC[C@H]1[NH2+]Cc1cncs1 ZINC000306632571 490342479 /nfs/dbraw/zinc/34/24/79/490342479.db2.gz PLKGDSUJAQDWOY-MRVPVSSYSA-N 1 2 218.272 2.421 20 0 BEADLO C[C@H]([NH2+][C@H]1COc2ccc(F)cc21)c1ncc[nH]1 ZINC000334358119 538067192 /nfs/dbraw/zinc/06/71/92/538067192.db2.gz RVRSPDJAPWSDGR-KWQFWETISA-N 1 2 247.273 2.333 20 0 BEADLO C[C@H](N[C@H]1COc2ccc(F)cc21)c1[nH]cc[nH+]1 ZINC000334358119 538067201 /nfs/dbraw/zinc/06/72/01/538067201.db2.gz RVRSPDJAPWSDGR-KWQFWETISA-N 1 2 247.273 2.333 20 0 BEADLO CC(=O)NCCC[N@@H+](C)[C@H](C)c1ccccc1 ZINC000119696066 191068805 /nfs/dbraw/zinc/06/88/05/191068805.db2.gz HTDDSZUSQLOSDR-GFCCVEGCSA-N 1 2 234.343 2.206 20 0 BEADLO CC(=O)NCCC[N@H+](C)[C@H](C)c1ccccc1 ZINC000119696066 191068808 /nfs/dbraw/zinc/06/88/08/191068808.db2.gz HTDDSZUSQLOSDR-GFCCVEGCSA-N 1 2 234.343 2.206 20 0 BEADLO Cc1ncc([C@@H](C)[NH2+]Cc2nccs2)c(C)n1 ZINC000128157011 180172069 /nfs/dbraw/zinc/17/20/69/180172069.db2.gz APYDVOCFDAAYDN-MRVPVSSYSA-N 1 2 248.355 2.401 20 0 BEADLO Cc1nc(N2CC[C@H](OCC(C)C)C2)cc[nH+]1 ZINC000133326675 180195181 /nfs/dbraw/zinc/19/51/81/180195181.db2.gz YKKXGGNIUIZRIP-LBPRGKRZSA-N 1 2 235.331 2.036 20 0 BEADLO Cc1nc(N2Cc3ccccc3C2)cc[nH+]1 ZINC000334143597 180195555 /nfs/dbraw/zinc/19/55/55/180195555.db2.gz DSHOCYRTJSIALV-UHFFFAOYSA-N 1 2 211.268 2.305 20 0 BEADLO Cc1nc(NCC(C)(C)[C@H](O)C(C)C)cc[nH+]1 ZINC000158669854 180198295 /nfs/dbraw/zinc/19/82/95/180198295.db2.gz OZMSQPFSNFMFCQ-GFCCVEGCSA-N 1 2 237.347 2.240 20 0 BEADLO Cc1nc(NCCSC(C)C)cc[nH+]1 ZINC000286522322 180198886 /nfs/dbraw/zinc/19/88/86/180198886.db2.gz ULCGFXUJNDMOTC-UHFFFAOYSA-N 1 2 211.334 2.339 20 0 BEADLO Cc1nc(NC[C@@]2(C)CCCS2)cc[nH+]1 ZINC000087620136 180200291 /nfs/dbraw/zinc/20/02/91/180200291.db2.gz WSVUBPWUXDQCLG-LLVKDONJSA-N 1 2 223.345 2.483 20 0 BEADLO Cc1nc(N[C@@H]2C[C@H](C)n3ccnc32)cc[nH+]1 ZINC000333657887 180205274 /nfs/dbraw/zinc/20/52/74/180205274.db2.gz GIHCMMGEBDECSS-WCBMZHEXSA-N 1 2 229.287 2.099 20 0 BEADLO Cc1nc(N[C@H](C)C2CCOCC2)cc[nH+]1 ZINC000131885029 180205344 /nfs/dbraw/zinc/20/53/44/180205344.db2.gz WBFQULQGYWGDGA-SECBINFHSA-N 1 2 221.304 2.012 20 0 BEADLO Cc1nc(N[C@H]2CCC[C@H]3OCC[C@@H]32)cc[nH+]1 ZINC000153261497 180205500 /nfs/dbraw/zinc/20/55/00/180205500.db2.gz NSSODHIHQWXLHR-GRYCIOLGSA-N 1 2 233.315 2.155 20 0 BEADLO Cc1nc(N[C@H](C)c2nnc(C(C)C)[nH]2)cc[nH+]1 ZINC000270701181 180205915 /nfs/dbraw/zinc/20/59/15/180205915.db2.gz INEYBANNTZGAEN-MRVPVSSYSA-N 1 2 246.318 2.200 20 0 BEADLO Cc1nc(N[C@H](CO)c2ccc(F)cc2)cc[nH+]1 ZINC000361026614 180206059 /nfs/dbraw/zinc/20/60/59/180206059.db2.gz SSPONWSVVYFGGK-GFCCVEGCSA-N 1 2 247.273 2.070 20 0 BEADLO Cc1nc(N[C@@H]2[C@H]3CCCO[C@H]3C2(C)C)cc[nH+]1 ZINC000361118371 180206131 /nfs/dbraw/zinc/20/61/31/180206131.db2.gz UWPITSMUEXIING-RAIGVLPGSA-N 1 2 247.342 2.401 20 0 BEADLO Cc1nc(N[C@H]2CS[C@H](C)C2)cc[nH+]1 ZINC000307171426 180207596 /nfs/dbraw/zinc/20/75/96/180207596.db2.gz OEKPEWUULYQPPD-VXNVDRBHSA-N 1 2 209.318 2.091 20 0 BEADLO Cc1nc(NC[C@H]2CCc3ccccc32)cc[nH+]1 ZINC000361022679 180181235 /nfs/dbraw/zinc/18/12/35/180181235.db2.gz OTTBEVJZXHMOOW-CYBMUJFWSA-N 1 2 239.322 2.349 20 0 BEADLO Cc1nc(NCC[C@@H]2C[C@@H](C)O[C@@H](C)C2)cc[nH+]1 ZINC000338485179 180181497 /nfs/dbraw/zinc/18/14/97/180181497.db2.gz QTDRDWCXHKAWBO-PTEHBNRSSA-N 1 2 249.358 2.213 20 0 BEADLO Cc1nccc(C[N@@H+](C)[C@@H](C)c2ccccn2)n1 ZINC000352822558 180184271 /nfs/dbraw/zinc/18/42/71/180184271.db2.gz HGWNASGALUMSSZ-NSHDSACASA-N 1 2 242.326 2.373 20 0 BEADLO Cc1nccc(C[N@H+](C)[C@@H](C)c2ccccn2)n1 ZINC000352822558 180184275 /nfs/dbraw/zinc/18/42/75/180184275.db2.gz HGWNASGALUMSSZ-NSHDSACASA-N 1 2 242.326 2.373 20 0 BEADLO Cc1[nH+]cccc1Cc1nc([C@H]2CCCO2)no1 ZINC000285158156 180223077 /nfs/dbraw/zinc/22/30/77/180223077.db2.gz SCMRPRIXPFGSFV-LLVKDONJSA-N 1 2 245.282 2.215 20 0 BEADLO Cc1[nH+]cccc1N[C@@H](C)Cn1cccn1 ZINC000123169504 180225699 /nfs/dbraw/zinc/22/56/99/180225699.db2.gz DTRXTSTUFZCMRU-JTQLQIEISA-N 1 2 216.288 2.087 20 0 BEADLO Cc1[nH+]cccc1N[C@@H](C)c1cnccn1 ZINC000085711771 180226731 /nfs/dbraw/zinc/22/67/31/180226731.db2.gz COZXQZJLWLQUMQ-JTQLQIEISA-N 1 2 214.272 2.353 20 0 BEADLO Cc1[nH+]cccc1NCc1cn(C(C)C)nn1 ZINC000286981294 180226927 /nfs/dbraw/zinc/22/69/27/180226927.db2.gz SXNJRXBYESNBCQ-UHFFFAOYSA-N 1 2 231.303 2.175 20 0 BEADLO CC1(C)CN(c2cc[nH+]c(C3CC3)n2)CCCO1 ZINC000604995151 350232642 /nfs/dbraw/zinc/23/26/42/350232642.db2.gz GBWKAJVVCDSSPX-UHFFFAOYSA-N 1 2 247.342 2.359 20 0 BEADLO C[N@H+](Cc1cn[nH]c1)Cc1cncc(Cl)c1 ZINC000621268052 350274350 /nfs/dbraw/zinc/27/43/50/350274350.db2.gz ZTWSDTOJUZJLQT-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO C[N@@H+](Cc1cn[nH]c1)Cc1cncc(Cl)c1 ZINC000621268052 350274352 /nfs/dbraw/zinc/27/43/52/350274352.db2.gz ZTWSDTOJUZJLQT-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO Cc1nccnc1[C@@H](C)[NH2+]Cc1ccco1 ZINC000187680920 180282693 /nfs/dbraw/zinc/28/26/93/180282693.db2.gz XIOFHGHSKZETGO-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO Cc1ncsc1C[N@@H+](C)[C@@H](C)c1cnccn1 ZINC000184541626 180313470 /nfs/dbraw/zinc/31/34/70/180313470.db2.gz IJILGAMOENNVKD-JTQLQIEISA-N 1 2 248.355 2.435 20 0 BEADLO Cc1ncsc1C[N@H+](C)[C@@H](C)c1cnccn1 ZINC000184541626 180313473 /nfs/dbraw/zinc/31/34/73/180313473.db2.gz IJILGAMOENNVKD-JTQLQIEISA-N 1 2 248.355 2.435 20 0 BEADLO CC[C@@H](C)NC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606580359 350370536 /nfs/dbraw/zinc/37/05/36/350370536.db2.gz LHLLVWQHRWPFAI-SECBINFHSA-N 1 2 232.287 2.254 20 0 BEADLO Cc1ncsc1C[N@H+]1C[C@H](C)OC[C@@H]1C ZINC000092018259 180317925 /nfs/dbraw/zinc/31/79/25/180317925.db2.gz VVFSMJUMUCLYKZ-IUCAKERBSA-N 1 2 226.345 2.061 20 0 BEADLO Cc1ncsc1C[N@@H+]1C[C@H](C)OC[C@@H]1C ZINC000092018259 180317926 /nfs/dbraw/zinc/31/79/26/180317926.db2.gz VVFSMJUMUCLYKZ-IUCAKERBSA-N 1 2 226.345 2.061 20 0 BEADLO CC[C@@H]1C[N@@H+]([C@@H](C)c2cnc(C)cn2)C[C@H](C)O1 ZINC000428218439 191101280 /nfs/dbraw/zinc/10/12/80/191101280.db2.gz BMMVDYGKOGQTBJ-RWMBFGLXSA-N 1 2 249.358 2.345 20 0 BEADLO CC[C@@H]1C[N@H+]([C@@H](C)c2cnc(C)cn2)C[C@H](C)O1 ZINC000428218439 191101282 /nfs/dbraw/zinc/10/12/82/191101282.db2.gz BMMVDYGKOGQTBJ-RWMBFGLXSA-N 1 2 249.358 2.345 20 0 BEADLO Cc1ncsc1COc1cc[nH+]cc1 ZINC000334660411 180324064 /nfs/dbraw/zinc/32/40/64/180324064.db2.gz LFTKCNINBKCBBQ-UHFFFAOYSA-N 1 2 206.270 2.426 20 0 BEADLO Cc1nn(C)c(Cl)c1C[N@@H+]1CCC[C@@H]1CF ZINC000293018952 180350063 /nfs/dbraw/zinc/35/00/63/180350063.db2.gz KIIUFEPTYIDJNO-SECBINFHSA-N 1 2 245.729 2.316 20 0 BEADLO Cc1nn(C)c(Cl)c1C[N@H+]1CCC[C@@H]1CF ZINC000293018952 180350064 /nfs/dbraw/zinc/35/00/64/180350064.db2.gz KIIUFEPTYIDJNO-SECBINFHSA-N 1 2 245.729 2.316 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@H]2CC)no1 ZINC000336651477 350419375 /nfs/dbraw/zinc/41/93/75/350419375.db2.gz VGSTTZFIJFNPRL-SECBINFHSA-N 1 2 209.293 2.006 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@H]2CC)no1 ZINC000336651477 350419379 /nfs/dbraw/zinc/41/93/79/350419379.db2.gz VGSTTZFIJFNPRL-SECBINFHSA-N 1 2 209.293 2.006 20 0 BEADLO Cc1nn(C)c2cc(NCc3[nH]cc[nH+]3)ccc12 ZINC000361046647 180363259 /nfs/dbraw/zinc/36/32/59/180363259.db2.gz ZMBSSTJPIMKERT-UHFFFAOYSA-N 1 2 241.298 2.217 20 0 BEADLO CC[C@@H]1CCC[N@@H+]1Cc1noc(C2CC2)n1 ZINC000336696807 350452057 /nfs/dbraw/zinc/45/20/57/350452057.db2.gz GZLLQEMKKACEBI-SNVBAGLBSA-N 1 2 221.304 2.321 20 0 BEADLO CC[C@@H]1CCC[N@H+]1Cc1noc(C2CC2)n1 ZINC000336696807 350452058 /nfs/dbraw/zinc/45/20/58/350452058.db2.gz GZLLQEMKKACEBI-SNVBAGLBSA-N 1 2 221.304 2.321 20 0 BEADLO Cc1ccoc1C[NH2+]Cc1cnc(C)o1 ZINC000397929926 362957249 /nfs/dbraw/zinc/95/72/49/362957249.db2.gz UAKNQWALJMNCJZ-UHFFFAOYSA-N 1 2 206.245 2.174 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@@H](CF)C2)s1 ZINC000577481318 365963700 /nfs/dbraw/zinc/96/37/00/365963700.db2.gz IGPYTCFEZNLQFY-JTQLQIEISA-N 1 2 243.347 2.481 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@@H](CF)C2)s1 ZINC000577481318 365963703 /nfs/dbraw/zinc/96/37/03/365963703.db2.gz IGPYTCFEZNLQFY-JTQLQIEISA-N 1 2 243.347 2.481 20 0 BEADLO CC[C@@H]([NH2+]C[C@H]1CCCOC1)C(F)(F)F ZINC000336763246 350505724 /nfs/dbraw/zinc/50/57/24/350505724.db2.gz OTDWMZQJDWUADZ-RKDXNWHRSA-N 1 2 225.254 2.344 20 0 BEADLO CC(C)(C)[C@H]1C[C@H]([NH2+]Cc2ccn[nH]2)CS1 ZINC000309397263 323372691 /nfs/dbraw/zinc/37/26/91/323372691.db2.gz VQFJPWHTDPOBLO-WDEREUQCSA-N 1 2 239.388 2.420 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1CCC[C@@H]1CCO ZINC000577510572 365973992 /nfs/dbraw/zinc/97/39/92/365973992.db2.gz MVSLXLRHRUCHGV-VXGBXAGGSA-N 1 2 235.331 2.056 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1CCC[C@H]1CCO ZINC000577510571 365974988 /nfs/dbraw/zinc/97/49/88/365974988.db2.gz MVSLXLRHRUCHGV-RYUDHWBXSA-N 1 2 235.331 2.056 20 0 BEADLO FC[C@H](NCc1[nH]cc[nH+]1)c1ccc(F)cc1 ZINC000631283743 350596841 /nfs/dbraw/zinc/59/68/41/350596841.db2.gz MHZBGVSUJIDWDX-NSHDSACASA-N 1 2 237.253 2.349 20 0 BEADLO FC(F)(F)[C@H]1C[N@@H+]([C@H]2C=CCCC2)CCO1 ZINC000606902072 350626921 /nfs/dbraw/zinc/62/69/21/350626921.db2.gz WKMSUSGGXOTWGI-VHSXEESVSA-N 1 2 235.249 2.358 20 0 BEADLO FC(F)(F)[C@H]1C[N@H+]([C@H]2C=CCCC2)CCO1 ZINC000606902072 350626924 /nfs/dbraw/zinc/62/69/24/350626924.db2.gz WKMSUSGGXOTWGI-VHSXEESVSA-N 1 2 235.249 2.358 20 0 BEADLO CCN(c1cc(C)[nH+]c(C(C)C)n1)[C@@H](C)CO ZINC000338792411 350712669 /nfs/dbraw/zinc/71/26/69/350712669.db2.gz HIUPBYOZDJLCGX-NSHDSACASA-N 1 2 237.347 2.116 20 0 BEADLO CC(C)[C@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000216379505 350685495 /nfs/dbraw/zinc/68/54/95/350685495.db2.gz SUJDRJPYHYZNRL-FJOGCWAESA-N 1 2 247.342 2.318 20 0 BEADLO CCc1noc(C)c1C[N@@H+]1CCO[C@H](C)[C@H]1C ZINC000335918936 350693733 /nfs/dbraw/zinc/69/37/33/350693733.db2.gz KEOUOBOXAWGPEU-NXEZZACHSA-N 1 2 238.331 2.155 20 0 BEADLO CCc1noc(C)c1C[N@H+]1CCO[C@H](C)[C@H]1C ZINC000335918936 350693736 /nfs/dbraw/zinc/69/37/36/350693736.db2.gz KEOUOBOXAWGPEU-NXEZZACHSA-N 1 2 238.331 2.155 20 0 BEADLO CC1(C)CC[C@H](CNc2cccc[nH+]2)O1 ZINC000302354600 191120044 /nfs/dbraw/zinc/12/00/44/191120044.db2.gz CBZDOTAEYXUEEU-SNVBAGLBSA-N 1 2 206.289 2.451 20 0 BEADLO CCC1(C)CN(Cc2[nH]c(C)c(C)[nH+]2)C1 ZINC000628308113 350730203 /nfs/dbraw/zinc/73/02/03/350730203.db2.gz WSJGLCAXYZTUJN-UHFFFAOYSA-N 1 2 207.321 2.258 20 0 BEADLO CCC1(C)C[NH+](Cc2nc(C)c(C)[nH]2)C1 ZINC000628308113 350730206 /nfs/dbraw/zinc/73/02/06/350730206.db2.gz WSJGLCAXYZTUJN-UHFFFAOYSA-N 1 2 207.321 2.258 20 0 BEADLO C[C@H]([NH2+]Cc1cnc(C2CC2)o1)c1ccn(C)n1 ZINC000628309274 350785472 /nfs/dbraw/zinc/78/54/72/350785472.db2.gz LOOXGIIYINWQOQ-VIFPVBQESA-N 1 2 246.314 2.136 20 0 BEADLO Cc1[nH]c(CN2CCO[C@@H](C3CCC3)C2)[nH+]c1C ZINC000628309999 350791996 /nfs/dbraw/zinc/79/19/96/350791996.db2.gz HESPEIGTXMHORW-CYBMUJFWSA-N 1 2 249.358 2.027 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1cc(C)[nH]c1C ZINC000623083531 350828272 /nfs/dbraw/zinc/82/82/72/350828272.db2.gz GOLQSWQLRZSRMP-UHFFFAOYSA-N 1 2 245.282 2.287 20 0 BEADLO CCc1nc(C[N@H+](C)C[C@H]2CCCO2)cs1 ZINC000052102523 350937674 /nfs/dbraw/zinc/93/76/74/350937674.db2.gz ODACXQKMWIHYDI-LLVKDONJSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nc(C[N@@H+](C)C[C@H]2CCCO2)cs1 ZINC000052102523 350937676 /nfs/dbraw/zinc/93/76/76/350937676.db2.gz ODACXQKMWIHYDI-LLVKDONJSA-N 1 2 240.372 2.316 20 0 BEADLO COc1ccc[nH+]c1NCCCOC(F)F ZINC000398169500 351008899 /nfs/dbraw/zinc/00/88/99/351008899.db2.gz NGEQLPJYZVZLMW-UHFFFAOYSA-N 1 2 232.230 2.131 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CS[C@H](C)C1 ZINC000397901970 350988413 /nfs/dbraw/zinc/98/84/13/350988413.db2.gz VMMXAJXVWHXDTA-RKDXNWHRSA-N 1 2 224.329 2.396 20 0 BEADLO CCn1cc([C@H](C)[NH2+]Cc2ncc(C)o2)cn1 ZINC000231640521 351013128 /nfs/dbraw/zinc/01/31/28/351013128.db2.gz KGSPBAKYMFBMAO-JTQLQIEISA-N 1 2 234.303 2.050 20 0 BEADLO Cc1scc(C(=O)Nc2cc[nH+]cc2O)c1C ZINC000335086081 180560311 /nfs/dbraw/zinc/56/03/11/180560311.db2.gz GNWOHENQSLQVGP-UHFFFAOYSA-N 1 2 248.307 2.140 20 0 BEADLO CC(C)C[C@@H]1CCC[C@@H]([NH2+]Cc2c[nH]nn2)C1 ZINC000398423246 351150224 /nfs/dbraw/zinc/15/02/24/351150224.db2.gz ZODKSRLTJASWCL-NWDGAFQWSA-N 1 2 236.363 2.499 20 0 BEADLO CC(C)C[C@@H]1CCC[C@@H]([NH2+]Cc2cn[nH]n2)C1 ZINC000398423246 351150226 /nfs/dbraw/zinc/15/02/26/351150226.db2.gz ZODKSRLTJASWCL-NWDGAFQWSA-N 1 2 236.363 2.499 20 0 BEADLO CC[N@@H+]1CCO[C@H](c2ccccc2OC)C1 ZINC000616643096 351155488 /nfs/dbraw/zinc/15/54/88/351155488.db2.gz BBODWACLOCHYGF-ZDUSSCGKSA-N 1 2 221.300 2.088 20 0 BEADLO CC[N@H+]1CCO[C@H](c2ccccc2OC)C1 ZINC000616643096 351155492 /nfs/dbraw/zinc/15/54/92/351155492.db2.gz BBODWACLOCHYGF-ZDUSSCGKSA-N 1 2 221.300 2.088 20 0 BEADLO C[C@H]1C[C@H]([NH2+]Cc2c[nH]nn2)CC(C)(C)C1 ZINC000398405296 351137442 /nfs/dbraw/zinc/13/74/42/351137442.db2.gz OSTIKRSZPIKDPV-UWVGGRQHSA-N 1 2 222.336 2.109 20 0 BEADLO C[C@H]1C[C@H]([NH2+]Cc2cn[nH]n2)CC(C)(C)C1 ZINC000398405296 351137445 /nfs/dbraw/zinc/13/74/45/351137445.db2.gz OSTIKRSZPIKDPV-UWVGGRQHSA-N 1 2 222.336 2.109 20 0 BEADLO CCN(Cc1[nH]c(C)c(C)[nH+]1)[C@@H]1CCCOC1 ZINC000628324699 351244414 /nfs/dbraw/zinc/24/44/14/351244414.db2.gz FKKPIGXQXHDTPT-GFCCVEGCSA-N 1 2 237.347 2.027 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1CCCOC1 ZINC000265180233 351265269 /nfs/dbraw/zinc/26/52/69/351265269.db2.gz GODRCHAIXYCFDJ-LLVKDONJSA-N 1 2 234.299 2.009 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)CCCOC ZINC000264978051 351260374 /nfs/dbraw/zinc/26/03/74/351260374.db2.gz GIHZJRPICGINKU-UHFFFAOYSA-N 1 2 222.288 2.009 20 0 BEADLO Cc1c[nH]c(C[N@H+]2C[C@@H](C)OC3(CCCC3)C2)n1 ZINC000628322919 351212120 /nfs/dbraw/zinc/21/21/20/351212120.db2.gz RNCCDSOSQPYEDF-GFCCVEGCSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1c[nH]c(C[N@@H+]2C[C@@H](C)OC3(CCCC3)C2)n1 ZINC000628322919 351212122 /nfs/dbraw/zinc/21/21/22/351212122.db2.gz RNCCDSOSQPYEDF-GFCCVEGCSA-N 1 2 249.358 2.252 20 0 BEADLO C[C@H](NC(=O)CCn1cc[nH+]c1)c1ccccc1 ZINC000072615543 351299732 /nfs/dbraw/zinc/29/97/32/351299732.db2.gz FYLYTIZGNVFPAB-LBPRGKRZSA-N 1 2 243.310 2.151 20 0 BEADLO Cc1nc(C[N@@H+](C)C[C@@]2(C)CCCS2)no1 ZINC000628352453 351315620 /nfs/dbraw/zinc/31/56/20/351315620.db2.gz JLYRKETYPIJISW-LLVKDONJSA-N 1 2 241.360 2.096 20 0 BEADLO Cc1nc(C[N@H+](C)C[C@@]2(C)CCCS2)no1 ZINC000628352453 351315622 /nfs/dbraw/zinc/31/56/22/351315622.db2.gz JLYRKETYPIJISW-LLVKDONJSA-N 1 2 241.360 2.096 20 0 BEADLO Cc1[nH]c(CN[C@@H](C)C(F)(F)F)[nH+]c1C ZINC000571820513 323486877 /nfs/dbraw/zinc/48/68/77/323486877.db2.gz DNZIJMMVKCYWIY-ZETCQYMHSA-N 1 2 221.226 2.067 20 0 BEADLO CCn1nccc1C[NH2+]Cc1cnc(C2CC2)o1 ZINC000628353262 351318612 /nfs/dbraw/zinc/31/86/12/351318612.db2.gz OKNMMLJXDNAZNU-UHFFFAOYSA-N 1 2 246.314 2.058 20 0 BEADLO C[C@H](O)C[N@H+](Cc1ccon1)Cc1ccccc1 ZINC000607358814 351333098 /nfs/dbraw/zinc/33/30/98/351333098.db2.gz PWPJDSXQXXQFJQ-LBPRGKRZSA-N 1 2 246.310 2.058 20 0 BEADLO C[C@H](O)C[N@@H+](Cc1ccon1)Cc1ccccc1 ZINC000607358814 351333102 /nfs/dbraw/zinc/33/31/02/351333102.db2.gz PWPJDSXQXXQFJQ-LBPRGKRZSA-N 1 2 246.310 2.058 20 0 BEADLO CC[N@H+](Cc1ccncc1)[C@@H](C)c1nnc(C)o1 ZINC000270971092 351392657 /nfs/dbraw/zinc/39/26/57/351392657.db2.gz CRDLEJYLJLUJHC-JTQLQIEISA-N 1 2 246.314 2.356 20 0 BEADLO CC[N@@H+](Cc1ccncc1)[C@@H](C)c1nnc(C)o1 ZINC000270971092 351392662 /nfs/dbraw/zinc/39/26/62/351392662.db2.gz CRDLEJYLJLUJHC-JTQLQIEISA-N 1 2 246.314 2.356 20 0 BEADLO CC[C@H](C(=O)OC)[N@@H+]1CCc2ccsc2C1 ZINC000270957345 351392845 /nfs/dbraw/zinc/39/28/45/351392845.db2.gz ULINDWRVKPRCGZ-SNVBAGLBSA-N 1 2 239.340 2.058 20 0 BEADLO CC[C@H](C(=O)OC)[N@H+]1CCc2ccsc2C1 ZINC000270957345 351392848 /nfs/dbraw/zinc/39/28/48/351392848.db2.gz ULINDWRVKPRCGZ-SNVBAGLBSA-N 1 2 239.340 2.058 20 0 BEADLO CCc1cnc(C[NH2+]Cc2ccns2)s1 ZINC000404441773 351458021 /nfs/dbraw/zinc/45/80/21/351458021.db2.gz HROLEMQZBCJLDN-UHFFFAOYSA-N 1 2 239.369 2.452 20 0 BEADLO CCc1cnc(C[NH2+][C@H](C)c2cn[nH]c2)s1 ZINC000273043645 351508365 /nfs/dbraw/zinc/50/83/65/351508365.db2.gz IYGVNDJXSUAOGX-MRVPVSSYSA-N 1 2 236.344 2.279 20 0 BEADLO C[C@H]1CCC[C@@H](NC(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000276547946 351631766 /nfs/dbraw/zinc/63/17/66/351631766.db2.gz HBMMRBPZGUJHFI-PFDYWKIBSA-N 1 2 233.315 2.118 20 0 BEADLO C[C@@H](CC(=O)Nc1ccc(N)[nH+]c1)C(F)(F)F ZINC000637829475 351678066 /nfs/dbraw/zinc/67/80/66/351678066.db2.gz LNEFMSUJNVPXCX-LURJTMIESA-N 1 2 247.220 2.021 20 0 BEADLO CC(C)[C@H](NC(=O)C[C@@H]1C[C@H]1C)c1[nH]cc[nH+]1 ZINC000355973434 191141101 /nfs/dbraw/zinc/14/11/01/191141101.db2.gz PWLHJONPCCVBSG-SCVCMEIPSA-N 1 2 235.331 2.269 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)[C@H]2[C@@H]3CCC[C@@H]32)[nH+]1 ZINC000577760896 366057082 /nfs/dbraw/zinc/05/70/82/366057082.db2.gz VZUMNPIULLWILW-URLYPYJESA-N 1 2 247.342 2.116 20 0 BEADLO CC1(C)CCN(c2cc(N3CCCC3)[nH+]cn2)C1 ZINC000277725930 351723710 /nfs/dbraw/zinc/72/37/10/351723710.db2.gz IDDQVDWIFXBVMM-UHFFFAOYSA-N 1 2 246.358 2.313 20 0 BEADLO CC1(C)CCN(c2cc(N3CCCC3)nc[nH+]2)C1 ZINC000277725930 351723713 /nfs/dbraw/zinc/72/37/13/351723713.db2.gz IDDQVDWIFXBVMM-UHFFFAOYSA-N 1 2 246.358 2.313 20 0 BEADLO C[C@H]1C[N@H+](Cc2nncn2C)[C@@H]1c1ccccc1 ZINC000177824172 366065479 /nfs/dbraw/zinc/06/54/79/366065479.db2.gz KIFXWGMEUVXOSB-FZMZJTMJSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nncn2C)[C@@H]1c1ccccc1 ZINC000177824172 366065484 /nfs/dbraw/zinc/06/54/84/366065484.db2.gz KIFXWGMEUVXOSB-FZMZJTMJSA-N 1 2 242.326 2.008 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1ccns1 ZINC000637851609 351710562 /nfs/dbraw/zinc/71/05/62/351710562.db2.gz JHYTUQUFSMJJSZ-NXEZZACHSA-N 1 2 226.345 2.142 20 0 BEADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1ccns1 ZINC000637851609 351710563 /nfs/dbraw/zinc/71/05/63/351710563.db2.gz JHYTUQUFSMJJSZ-NXEZZACHSA-N 1 2 226.345 2.142 20 0 BEADLO Cc1nc(NCCF)c(Br)c(C)[nH+]1 ZINC000307273397 351827476 /nfs/dbraw/zinc/82/74/76/351827476.db2.gz IOMRJZJFJGBKHO-UHFFFAOYSA-N 1 2 248.099 2.237 20 0 BEADLO Cc1ncc([C@H](C)[N@@H+]2C[C@H](C)OC[C@H]2C)c(C)n1 ZINC000637930699 351807123 /nfs/dbraw/zinc/80/71/23/351807123.db2.gz SEGHHGQKCWDMQJ-SCVCMEIPSA-N 1 2 249.358 2.264 20 0 BEADLO Cc1ncc([C@H](C)[N@H+]2C[C@H](C)OC[C@H]2C)c(C)n1 ZINC000637930699 351807125 /nfs/dbraw/zinc/80/71/25/351807125.db2.gz SEGHHGQKCWDMQJ-SCVCMEIPSA-N 1 2 249.358 2.264 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccns2)CC(C)(C)O1 ZINC000637971942 351847280 /nfs/dbraw/zinc/84/72/80/351847280.db2.gz VPJKFYPRERRYOQ-SECBINFHSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccns2)CC(C)(C)O1 ZINC000637971942 351847282 /nfs/dbraw/zinc/84/72/82/351847282.db2.gz VPJKFYPRERRYOQ-SECBINFHSA-N 1 2 226.345 2.142 20 0 BEADLO CN(CC(F)F)[C@H](c1[nH+]ccn1C)C1CC1 ZINC000637972651 351848059 /nfs/dbraw/zinc/84/80/59/351848059.db2.gz CFGMNXXGTUUSQW-JTQLQIEISA-N 1 2 229.274 2.068 20 0 BEADLO Cc1ncc([C@H](C)[N@@H+]2CCO[C@H](C)[C@H]2C)c(C)n1 ZINC000638085876 351963222 /nfs/dbraw/zinc/96/32/22/351963222.db2.gz UROIPPRTYMEZJL-GRYCIOLGSA-N 1 2 249.358 2.264 20 0 BEADLO Cc1ncc([C@H](C)[N@H+]2CCO[C@H](C)[C@H]2C)c(C)n1 ZINC000638085876 351963224 /nfs/dbraw/zinc/96/32/24/351963224.db2.gz UROIPPRTYMEZJL-GRYCIOLGSA-N 1 2 249.358 2.264 20 0 BEADLO CC[N@H+](Cc1n[nH]cc1C)Cc1ccccn1 ZINC000283863379 351985896 /nfs/dbraw/zinc/98/58/96/351985896.db2.gz DWRRDAZTSDMJDT-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CC[N@@H+](Cc1n[nH]cc1C)Cc1ccccn1 ZINC000283863379 351985901 /nfs/dbraw/zinc/98/59/01/351985901.db2.gz DWRRDAZTSDMJDT-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CC[N@H+](Cc1[nH]ncc1C)Cc1ccccn1 ZINC000283863379 351985904 /nfs/dbraw/zinc/98/59/04/351985904.db2.gz DWRRDAZTSDMJDT-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CC[N@@H+](Cc1[nH]ncc1C)Cc1ccccn1 ZINC000283863379 351985907 /nfs/dbraw/zinc/98/59/07/351985907.db2.gz DWRRDAZTSDMJDT-UHFFFAOYSA-N 1 2 230.315 2.135 20 0 BEADLO CCC(CC)(CC)CNCC(F)(F)C[NH3+] ZINC000391254966 259421644 /nfs/dbraw/zinc/42/16/44/259421644.db2.gz QZNURACYZBOHLL-UHFFFAOYSA-N 1 2 222.323 2.386 20 0 BEADLO Cc1cnc(CNc2ccc(N(C)C)[nH+]c2)o1 ZINC000638275503 352112991 /nfs/dbraw/zinc/11/29/91/352112991.db2.gz YMCSQYKNQGIUJI-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO CCc1nc(Nc2c(C)nn(C)c2C)cc(C)[nH+]1 ZINC000287123283 352114802 /nfs/dbraw/zinc/11/48/02/352114802.db2.gz WNKWVLGPAWDMCB-UHFFFAOYSA-N 1 2 245.330 2.441 20 0 BEADLO CCn1nccc1C[N@H+](CC)Cc1ccncc1 ZINC000289141826 352173067 /nfs/dbraw/zinc/17/30/67/352173067.db2.gz AIRBJDIAPZIQIM-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CCn1nccc1C[N@@H+](CC)Cc1ccncc1 ZINC000289141826 352173069 /nfs/dbraw/zinc/17/30/69/352173069.db2.gz AIRBJDIAPZIQIM-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO Cc1nnc([C@H](C)[N@H+](C)Cc2cccc(F)c2)[nH]1 ZINC000411148138 191164031 /nfs/dbraw/zinc/16/40/31/191164031.db2.gz KQVRXHOJGJRPJP-VIFPVBQESA-N 1 2 248.305 2.445 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+](C)Cc2cccc(F)c2)[nH]1 ZINC000411148138 191164033 /nfs/dbraw/zinc/16/40/33/191164033.db2.gz KQVRXHOJGJRPJP-VIFPVBQESA-N 1 2 248.305 2.445 20 0 BEADLO Cc1nnc(C[NH+]2CCC(CCF)CC2)s1 ZINC000630072273 363154993 /nfs/dbraw/zinc/15/49/93/363154993.db2.gz BYJGQXOMORRRTA-UHFFFAOYSA-N 1 2 243.351 2.418 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+](C)Cc2cccc(F)c2)[nH]1 ZINC000411148136 191165291 /nfs/dbraw/zinc/16/52/91/191165291.db2.gz KQVRXHOJGJRPJP-SECBINFHSA-N 1 2 248.305 2.445 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+](C)Cc2cccc(F)c2)[nH]1 ZINC000411148136 191165292 /nfs/dbraw/zinc/16/52/92/191165292.db2.gz KQVRXHOJGJRPJP-SECBINFHSA-N 1 2 248.305 2.445 20 0 BEADLO CC[N@@H+](Cc1cccs1)Cc1nnc(C)[nH]1 ZINC000292001989 352297397 /nfs/dbraw/zinc/29/73/97/352297397.db2.gz BWOBZLZECDYGEC-UHFFFAOYSA-N 1 2 236.344 2.197 20 0 BEADLO CC[N@H+](Cc1cccs1)Cc1nnc(C)[nH]1 ZINC000292001989 352297399 /nfs/dbraw/zinc/29/73/99/352297399.db2.gz BWOBZLZECDYGEC-UHFFFAOYSA-N 1 2 236.344 2.197 20 0 BEADLO CCCC[C@H](C)N(C)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000292050421 352299949 /nfs/dbraw/zinc/29/99/49/352299949.db2.gz SNNNHVIEJYIRHW-AEZGRPFRSA-N 1 2 235.331 2.460 20 0 BEADLO C[N@H+](CCc1cncs1)Cc1cscn1 ZINC000411189244 191167488 /nfs/dbraw/zinc/16/74/88/191167488.db2.gz WFRXLJYADCIJGR-UHFFFAOYSA-N 1 2 239.369 2.274 20 0 BEADLO C[N@@H+](CCc1cncs1)Cc1cscn1 ZINC000411189244 191167492 /nfs/dbraw/zinc/16/74/92/191167492.db2.gz WFRXLJYADCIJGR-UHFFFAOYSA-N 1 2 239.369 2.274 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)N(C)Cc1[nH+]ccn1C ZINC000294252197 352373424 /nfs/dbraw/zinc/37/34/24/352373424.db2.gz CVDWKRUNOZNETR-NEPJUHHUSA-N 1 2 249.358 2.205 20 0 BEADLO CC[C@@H]1CCC[C@H]1C(=O)N1CCn2c[nH+]cc2C1 ZINC000295898909 352427077 /nfs/dbraw/zinc/42/70/77/352427077.db2.gz CYHDEQRMIWFKHA-DGCLKSJQSA-N 1 2 247.342 2.052 20 0 BEADLO CC(C)=C[C@@H]1[C@H](C(=O)NCc2c[nH+]c[nH]2)C1(C)C ZINC000607948774 352454497 /nfs/dbraw/zinc/45/44/97/352454497.db2.gz SFEPOBZCACEQSG-VXGBXAGGSA-N 1 2 247.342 2.264 20 0 BEADLO CC(C)=C[C@@H]1[C@H](C(=O)NCc2c[nH]c[nH+]2)C1(C)C ZINC000607948774 352454499 /nfs/dbraw/zinc/45/44/99/352454499.db2.gz SFEPOBZCACEQSG-VXGBXAGGSA-N 1 2 247.342 2.264 20 0 BEADLO CC[C@@H](c1ccccc1)[N@H+](C)Cc1nncn1C ZINC000340683185 352614035 /nfs/dbraw/zinc/61/40/35/352614035.db2.gz JFLOPZMLFJIELR-ZDUSSCGKSA-N 1 2 244.342 2.398 20 0 BEADLO CC[C@@H](c1ccccc1)[N@@H+](C)Cc1nncn1C ZINC000340683185 352614038 /nfs/dbraw/zinc/61/40/38/352614038.db2.gz JFLOPZMLFJIELR-ZDUSSCGKSA-N 1 2 244.342 2.398 20 0 BEADLO CCc1ccc([C@H](COC)[NH2+]Cc2cn[nH]c2)o1 ZINC000608060559 352658455 /nfs/dbraw/zinc/65/84/55/352658455.db2.gz IFMYSAZLLDPFGZ-LBPRGKRZSA-N 1 2 249.314 2.042 20 0 BEADLO Cc1cnc(CNc2ccc(N(C)C)c[nH+]2)o1 ZINC000638760434 352695371 /nfs/dbraw/zinc/69/53/71/352695371.db2.gz RFUNKBVXDRHVOD-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO CCc1noc(CC)c1C[NH2+]Cc1ncc(C)o1 ZINC000638767835 352708217 /nfs/dbraw/zinc/70/82/17/352708217.db2.gz QXUOUMSRCLFDAY-UHFFFAOYSA-N 1 2 249.314 2.386 20 0 BEADLO CC(=O)c1ccc2c(c1)C[N@@H+](CC1(C)COC1)C2 ZINC000411939624 191230227 /nfs/dbraw/zinc/23/02/27/191230227.db2.gz JNKVQXYEQMRAKN-UHFFFAOYSA-N 1 2 245.322 2.241 20 0 BEADLO CC(=O)c1ccc2c(c1)C[N@H+](CC1(C)COC1)C2 ZINC000411939624 191230230 /nfs/dbraw/zinc/23/02/30/191230230.db2.gz JNKVQXYEQMRAKN-UHFFFAOYSA-N 1 2 245.322 2.241 20 0 BEADLO CC(=O)c1ccc2c(c1)C[N@H+](CCC[C@H](C)O)C2 ZINC000411940967 191230407 /nfs/dbraw/zinc/23/04/07/191230407.db2.gz ICUNUGVDQWRJDX-NSHDSACASA-N 1 2 247.338 2.366 20 0 BEADLO CC(=O)c1ccc2c(c1)C[N@@H+](CCC[C@H](C)O)C2 ZINC000411940967 191230410 /nfs/dbraw/zinc/23/04/10/191230410.db2.gz ICUNUGVDQWRJDX-NSHDSACASA-N 1 2 247.338 2.366 20 0 BEADLO Cc1cc(C[NH2+]Cc2ncccc2F)sn1 ZINC000638780048 352730086 /nfs/dbraw/zinc/73/00/86/352730086.db2.gz NSYHDDDIQOWTDB-UHFFFAOYSA-N 1 2 237.303 2.275 20 0 BEADLO CCN(Cc1ccoc1)c1cc[nH+]c(C)n1 ZINC000608082245 352739615 /nfs/dbraw/zinc/73/96/15/352739615.db2.gz VKMFAGAOXVUYER-UHFFFAOYSA-N 1 2 217.272 2.405 20 0 BEADLO CC(C)C[N@@H+]1CC(=O)N[C@@H]1[C@@H]1CCCC[C@H]1C ZINC000342249075 352739931 /nfs/dbraw/zinc/73/99/31/352739931.db2.gz DSYPEERTJMXXRH-BZPMIXESSA-N 1 2 238.375 2.227 20 0 BEADLO CC(C)C[N@H+]1CC(=O)N[C@@H]1[C@@H]1CCCC[C@H]1C ZINC000342249075 352739933 /nfs/dbraw/zinc/73/99/33/352739933.db2.gz DSYPEERTJMXXRH-BZPMIXESSA-N 1 2 238.375 2.227 20 0 BEADLO Cc1[nH+]cccc1N[C@H](C)C[C@H]1CCCC(=O)N1 ZINC000638787438 352742789 /nfs/dbraw/zinc/74/27/89/352742789.db2.gz ZNGPVWNMNKJZSR-ZYHUDNBSSA-N 1 2 247.342 2.249 20 0 BEADLO COc1ncccc1C[NH2+]Cc1csc(C)n1 ZINC000037408120 358472973 /nfs/dbraw/zinc/47/29/73/358472973.db2.gz JVSLEMBFOVGUKG-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO COC(=O)[C@H](CC(C)C)[NH2+][C@@H]1CS[C@@H](C)C1 ZINC000086934979 352747394 /nfs/dbraw/zinc/74/73/94/352747394.db2.gz MFXWTKWVJLXWFF-DCAQKATOSA-N 1 2 245.388 2.058 20 0 BEADLO Cn1c[nH+]cc1CSCc1ccco1 ZINC000267244525 180790265 /nfs/dbraw/zinc/79/02/65/180790265.db2.gz YQFGSMQNYRIHOH-UHFFFAOYSA-N 1 2 208.286 2.447 20 0 BEADLO O=C(C1CC=CC1)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000334216901 352816766 /nfs/dbraw/zinc/81/67/66/352816766.db2.gz GPAKWUXLDLAWDO-UHFFFAOYSA-N 1 2 245.326 2.082 20 0 BEADLO O=C(C1CC=CC1)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000334216901 352816767 /nfs/dbraw/zinc/81/67/67/352816767.db2.gz GPAKWUXLDLAWDO-UHFFFAOYSA-N 1 2 245.326 2.082 20 0 BEADLO CSc1ccccc1C[NH+]1CCOCC1 ZINC000334190435 352781085 /nfs/dbraw/zinc/78/10/85/352781085.db2.gz HHVUQJVWGYLRKB-UHFFFAOYSA-N 1 2 223.341 2.241 20 0 BEADLO C[C@@H]1CN(C)CC[N@@H+]1C/C=C/c1ccccc1 ZINC000334212306 352810004 /nfs/dbraw/zinc/81/00/04/352810004.db2.gz ZXRPSVBXAXSQBX-VIIAAUOXSA-N 1 2 230.355 2.336 20 0 BEADLO Cc1c[nH+]c(CN2CCS[C@@H](C)[C@H]2C)n1C ZINC000342804185 352859405 /nfs/dbraw/zinc/85/94/05/352859405.db2.gz AUAVXKBSLQDUGC-MNOVXSKESA-N 1 2 239.388 2.054 20 0 BEADLO c1c[nH]c([C@@H]2CCC[N@H+]2Cc2ccccn2)n1 ZINC000334243996 352832983 /nfs/dbraw/zinc/83/29/83/352832983.db2.gz ZATHNJDJFKFXDK-LBPRGKRZSA-N 1 2 228.299 2.142 20 0 BEADLO c1c[nH]c([C@@H]2CCC[N@@H+]2Cc2ccccn2)n1 ZINC000334243996 352832984 /nfs/dbraw/zinc/83/29/84/352832984.db2.gz ZATHNJDJFKFXDK-LBPRGKRZSA-N 1 2 228.299 2.142 20 0 BEADLO O=C(c1ccsc1)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000334245350 352835623 /nfs/dbraw/zinc/83/56/23/352835623.db2.gz FEYUVQNAEIZXCX-SNVBAGLBSA-N 1 2 247.323 2.449 20 0 BEADLO O=C(C[C@H]1C=CCC1)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000334248026 352839909 /nfs/dbraw/zinc/83/99/09/352839909.db2.gz OKWALANASWPOHD-NWDGAFQWSA-N 1 2 245.326 2.430 20 0 BEADLO C[C@H]1C[N@H+](Cc2cn(C)nn2)[C@H]1c1ccccc1 ZINC000334249330 352842505 /nfs/dbraw/zinc/84/25/05/352842505.db2.gz VDNBWZRMFXPFRB-SMDDNHRTSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@H]1C[N@@H+](Cc2cn(C)nn2)[C@H]1c1ccccc1 ZINC000334249330 352842507 /nfs/dbraw/zinc/84/25/07/352842507.db2.gz VDNBWZRMFXPFRB-SMDDNHRTSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cn(C)nn2)[C@H]1c1ccccc1 ZINC000334249327 352842828 /nfs/dbraw/zinc/84/28/28/352842828.db2.gz VDNBWZRMFXPFRB-BXUZGUMPSA-N 1 2 242.326 2.008 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cn(C)nn2)[C@H]1c1ccccc1 ZINC000334249327 352842832 /nfs/dbraw/zinc/84/28/32/352842832.db2.gz VDNBWZRMFXPFRB-BXUZGUMPSA-N 1 2 242.326 2.008 20 0 BEADLO COc1cc[nH+]cc1NC(=O)c1occc1C ZINC000334230387 352847494 /nfs/dbraw/zinc/84/74/94/352847494.db2.gz RVOWLTXXZXTKGO-UHFFFAOYSA-N 1 2 232.239 2.244 20 0 BEADLO C(c1noc(C2CC2)n1)[N@@H+]1CC[C@H]2CCC[C@H]21 ZINC000334272236 352909130 /nfs/dbraw/zinc/90/91/30/352909130.db2.gz WUXGWZKHOGPJQG-MWLCHTKSSA-N 1 2 233.315 2.321 20 0 BEADLO C(c1noc(C2CC2)n1)[N@H+]1CC[C@H]2CCC[C@H]21 ZINC000334272236 352909131 /nfs/dbraw/zinc/90/91/31/352909131.db2.gz WUXGWZKHOGPJQG-MWLCHTKSSA-N 1 2 233.315 2.321 20 0 BEADLO c1ccc(C[N@@H+]2C[C@@]3(CCCO3)[C@H]2C2CC2)nc1 ZINC000334279161 352913466 /nfs/dbraw/zinc/91/34/66/352913466.db2.gz FUCHYDGWEOBENG-CABCVRRESA-N 1 2 244.338 2.225 20 0 BEADLO c1ccc(C[N@H+]2C[C@@]3(CCCO3)[C@H]2C2CC2)nc1 ZINC000334279161 352913469 /nfs/dbraw/zinc/91/34/69/352913469.db2.gz FUCHYDGWEOBENG-CABCVRRESA-N 1 2 244.338 2.225 20 0 BEADLO c1ccc(C[N@@H+]2C[C@]3(CCCO3)[C@@H]2C2CC2)nc1 ZINC000334279165 352913727 /nfs/dbraw/zinc/91/37/27/352913727.db2.gz FUCHYDGWEOBENG-LSDHHAIUSA-N 1 2 244.338 2.225 20 0 BEADLO c1ccc(C[N@H+]2C[C@]3(CCCO3)[C@@H]2C2CC2)nc1 ZINC000334279165 352913729 /nfs/dbraw/zinc/91/37/29/352913729.db2.gz FUCHYDGWEOBENG-LSDHHAIUSA-N 1 2 244.338 2.225 20 0 BEADLO COCc1cnc(C[N@H+]2CC=C(C)CC2)s1 ZINC000342919842 352917930 /nfs/dbraw/zinc/91/79/30/352917930.db2.gz WXERWOQJEWICAA-UHFFFAOYSA-N 1 2 238.356 2.442 20 0 BEADLO COCc1cnc(C[N@@H+]2CC=C(C)CC2)s1 ZINC000342919842 352917934 /nfs/dbraw/zinc/91/79/34/352917934.db2.gz WXERWOQJEWICAA-UHFFFAOYSA-N 1 2 238.356 2.442 20 0 BEADLO NC(=O)[C@H]1CCC[N@@H+]1Cc1ccc(Cl)o1 ZINC000334281680 352922787 /nfs/dbraw/zinc/92/27/87/352922787.db2.gz XNCPGJJYUBDALE-MRVPVSSYSA-N 1 2 228.679 2.433 20 0 BEADLO NC(=O)[C@H]1CCC[N@H+]1Cc1ccc(Cl)o1 ZINC000334281680 352922789 /nfs/dbraw/zinc/92/27/89/352922789.db2.gz XNCPGJJYUBDALE-MRVPVSSYSA-N 1 2 228.679 2.433 20 0 BEADLO Clc1ccc(C[NH+]2CCSCC2)o1 ZINC000306420736 353012118 /nfs/dbraw/zinc/01/21/18/353012118.db2.gz XQYSEKUNLYKDKU-UHFFFAOYSA-N 1 2 217.721 2.482 20 0 BEADLO CC[C@@H]1CCCN(C(=O)C[C@@H](C)n2cc[nH+]c2)C1 ZINC000577854273 366085716 /nfs/dbraw/zinc/08/57/16/366085716.db2.gz HZNIPQUBZMJFRO-CHWSQXEVSA-N 1 2 249.358 2.483 20 0 BEADLO COc1ncc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)s1 ZINC000638910558 353074527 /nfs/dbraw/zinc/07/45/27/353074527.db2.gz SGWDSBIETMIWOO-WCBMZHEXSA-N 1 2 244.335 2.332 20 0 BEADLO COc1ncc(C[N@H+]2CC[C@H](C)[C@H](F)C2)s1 ZINC000638910558 353074528 /nfs/dbraw/zinc/07/45/28/353074528.db2.gz SGWDSBIETMIWOO-WCBMZHEXSA-N 1 2 244.335 2.332 20 0 BEADLO COc1ncc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)s1 ZINC000638910559 353074853 /nfs/dbraw/zinc/07/48/53/353074853.db2.gz SGWDSBIETMIWOO-WPRPVWTQSA-N 1 2 244.335 2.332 20 0 BEADLO COc1ncc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)s1 ZINC000638910559 353074857 /nfs/dbraw/zinc/07/48/57/353074857.db2.gz SGWDSBIETMIWOO-WPRPVWTQSA-N 1 2 244.335 2.332 20 0 BEADLO C[C@H]1CC[N@H+](Cc2ccns2)C[C@@H]1F ZINC000638910918 353075313 /nfs/dbraw/zinc/07/53/13/353075313.db2.gz WCECPHQDAVVUAV-WPRPVWTQSA-N 1 2 214.309 2.323 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2ccns2)C[C@@H]1F ZINC000638910918 353075315 /nfs/dbraw/zinc/07/53/15/353075315.db2.gz WCECPHQDAVVUAV-WPRPVWTQSA-N 1 2 214.309 2.323 20 0 BEADLO CCOc1ncccc1C[NH2+][C@H](C)c1ncc[nH]1 ZINC000428242558 538107810 /nfs/dbraw/zinc/10/78/10/538107810.db2.gz VPRQAXIUFGCGDK-SNVBAGLBSA-N 1 2 246.314 2.054 20 0 BEADLO C[C@@H]1Oc2cc(F)ccc2[C@H]1[NH2+]Cc1ncc[nH]1 ZINC000334430114 353104891 /nfs/dbraw/zinc/10/48/91/353104891.db2.gz UXBOAPVGSMHJLS-SDBXPKJASA-N 1 2 247.273 2.161 20 0 BEADLO C[C@H]1Oc2cc(F)ccc2[C@H]1[NH2+]Cc1ncc[nH]1 ZINC000334430113 353105220 /nfs/dbraw/zinc/10/52/20/353105220.db2.gz UXBOAPVGSMHJLS-OQPBUACISA-N 1 2 247.273 2.161 20 0 BEADLO CC(C)[C@H]1CCN1C(=O)c1ccc2[nH+]ccn2c1 ZINC000334297049 535200751 /nfs/dbraw/zinc/20/07/51/535200751.db2.gz AEVBUGANHOJYFR-GFCCVEGCSA-N 1 2 243.310 2.205 20 0 BEADLO Cc1cc(NC(=O)CCCC(F)(F)F)cc[nH+]1 ZINC000355935051 188064760 /nfs/dbraw/zinc/06/47/60/188064760.db2.gz ZQHXHUHOJGIQQI-UHFFFAOYSA-N 1 2 246.232 2.483 20 0 BEADLO CC(C)[N@H+](CC(N)=O)Cc1ccsc1Cl ZINC000361493155 188070702 /nfs/dbraw/zinc/07/07/02/188070702.db2.gz QEIWEOXPVFSCKS-UHFFFAOYSA-N 1 2 246.763 2.097 20 0 BEADLO CC(C)[N@@H+](CC(N)=O)Cc1ccsc1Cl ZINC000361493155 188070704 /nfs/dbraw/zinc/07/07/04/188070704.db2.gz QEIWEOXPVFSCKS-UHFFFAOYSA-N 1 2 246.763 2.097 20 0 BEADLO CC(C)Cn1cc[nH+]c1CNC(=O)[C@H]1CC1(C)C ZINC000125144615 188084305 /nfs/dbraw/zinc/08/43/05/188084305.db2.gz MAHJIKZXHXUKSV-LLVKDONJSA-N 1 2 249.358 2.201 20 0 BEADLO Cc1oncc1N[C@H](c1[nH+]ccn1C)C1CC1 ZINC000638973273 353177746 /nfs/dbraw/zinc/17/77/46/353177746.db2.gz HTHBSDVBCXXJAN-NSHDSACASA-N 1 2 232.287 2.280 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+][C@@H]1CCc2ccccc2C1 ZINC000049371569 188124256 /nfs/dbraw/zinc/12/42/56/188124256.db2.gz JFCMNFRBDVBLKX-BXUZGUMPSA-N 1 2 247.338 2.085 20 0 BEADLO CC(C)=CC(=O)NCc1cn2cccc(C)c2[nH+]1 ZINC000071435501 188131141 /nfs/dbraw/zinc/13/11/41/188131141.db2.gz WVYHDLZPJNFVOO-UHFFFAOYSA-N 1 2 243.310 2.225 20 0 BEADLO Cc1nsc(NCCc2cccc(C)[nH+]2)n1 ZINC000280531618 538110982 /nfs/dbraw/zinc/11/09/82/538110982.db2.gz RQYUSARPIOEMLA-UHFFFAOYSA-N 1 2 234.328 2.205 20 0 BEADLO C/C=C(\C)C(=O)N1CC[C@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000268376192 188196436 /nfs/dbraw/zinc/19/64/36/188196436.db2.gz LRCMNKKPDCZBQR-CLFQDTNISA-N 1 2 247.342 2.259 20 0 BEADLO Cc1ccc(C[S@@](=O)Cc2c[nH+]cn2C)cc1 ZINC000268196988 188196515 /nfs/dbraw/zinc/19/65/15/188196515.db2.gz XYKVZLAPGAOESV-QGZVFWFLSA-N 1 2 248.351 2.177 20 0 BEADLO C=Cn1cc(CN2CCC[C@H]2c2[nH]cc[nH+]2)cn1 ZINC000364762086 188177561 /nfs/dbraw/zinc/17/75/61/188177561.db2.gz XUUSXTJANNHUOI-LBPRGKRZSA-N 1 2 243.314 2.044 20 0 BEADLO C=Cn1cc(C[N@@H+]2CCC[C@H]2c2ncc[nH]2)cn1 ZINC000364762086 188177563 /nfs/dbraw/zinc/17/75/63/188177563.db2.gz XUUSXTJANNHUOI-LBPRGKRZSA-N 1 2 243.314 2.044 20 0 BEADLO C=Cn1cc(C[N@H+]2CCC[C@H]2c2ncc[nH]2)cn1 ZINC000364762086 188177564 /nfs/dbraw/zinc/17/75/64/188177564.db2.gz XUUSXTJANNHUOI-LBPRGKRZSA-N 1 2 243.314 2.044 20 0 BEADLO CC(C)(CC(=O)NCc1c[nH+]c[nH]1)C(F)(F)F ZINC000331098049 188220206 /nfs/dbraw/zinc/22/02/06/188220206.db2.gz NBGCPXHPRBBIKB-UHFFFAOYSA-N 1 2 249.236 2.005 20 0 BEADLO CC(C)(CC(=O)NCc1c[nH]c[nH+]1)C(F)(F)F ZINC000331098049 188220207 /nfs/dbraw/zinc/22/02/07/188220207.db2.gz NBGCPXHPRBBIKB-UHFFFAOYSA-N 1 2 249.236 2.005 20 0 BEADLO CC(C)[C@H](NC(=O)C1CCCC1)c1[nH]cc[nH+]1 ZINC000276616729 188202412 /nfs/dbraw/zinc/20/24/12/188202412.db2.gz NLTBQXABDFHVIR-NSHDSACASA-N 1 2 235.331 2.413 20 0 BEADLO CSC[C@H](C)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000280725560 188206103 /nfs/dbraw/zinc/20/61/03/188206103.db2.gz HYXRARYJMLUMIK-VIFPVBQESA-N 1 2 249.339 2.272 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]CCc1nccs1 ZINC000134555379 538113136 /nfs/dbraw/zinc/11/31/36/538113136.db2.gz DBHITBQNFCQQSU-MRVPVSSYSA-N 1 2 236.344 2.068 20 0 BEADLO O=C(CC1CCC1)Nc1ccc2[nH+]ccn2c1 ZINC000608133591 353287299 /nfs/dbraw/zinc/28/72/99/353287299.db2.gz TZBXHZFNTJPWMV-UHFFFAOYSA-N 1 2 229.283 2.463 20 0 BEADLO Cc1cc(N(C)[C@@H]2CCC[C@H]2O)nc(C(C)C)[nH+]1 ZINC000343272437 353294617 /nfs/dbraw/zinc/29/46/17/353294617.db2.gz UGHJQSIBWHLTEL-VXGBXAGGSA-N 1 2 249.358 2.258 20 0 BEADLO Cc1ccc(NC(=O)C[C@@H]2CCOC2)c(C)[nH+]1 ZINC000333730295 188227807 /nfs/dbraw/zinc/22/78/07/188227807.db2.gz PMZAQDGWDBBJHH-NSHDSACASA-N 1 2 234.299 2.064 20 0 BEADLO CCC1CCC(C(=O)NCc2[nH+]ccn2C)CC1 ZINC000352406473 188228989 /nfs/dbraw/zinc/22/89/89/188228989.db2.gz BLRYKQJAPLVSKZ-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2ccncc2)o1 ZINC000639040153 353322486 /nfs/dbraw/zinc/32/24/86/353322486.db2.gz CIGHXXORTUMZBV-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2ccncc2)o1 ZINC000639040153 353322489 /nfs/dbraw/zinc/32/24/89/353322489.db2.gz CIGHXXORTUMZBV-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO CCO[C@H]1C[C@@H]1[NH2+]Cc1ncc(Cl)s1 ZINC000308496340 353357536 /nfs/dbraw/zinc/35/75/36/353357536.db2.gz DIKXYUYAJBHIDR-BQBZGAKWSA-N 1 2 232.736 2.064 20 0 BEADLO CC[C@@]1(C)COCC[N@@H+]1Cc1ccns1 ZINC000639058969 353365331 /nfs/dbraw/zinc/36/53/31/353365331.db2.gz WIWZKKRLAHQGEL-NSHDSACASA-N 1 2 226.345 2.144 20 0 BEADLO CC[C@@]1(C)COCC[N@H+]1Cc1ccns1 ZINC000639058969 353365333 /nfs/dbraw/zinc/36/53/33/353365333.db2.gz WIWZKKRLAHQGEL-NSHDSACASA-N 1 2 226.345 2.144 20 0 BEADLO F[C@H]1CC[N@H+](Cc2nnc(-c3ccccc3)o2)C1 ZINC000336259589 180945207 /nfs/dbraw/zinc/94/52/07/180945207.db2.gz NAUVOGJRFYTMRS-NSHDSACASA-N 1 2 247.273 2.280 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2nnc(-c3ccccc3)o2)C1 ZINC000336259589 180945208 /nfs/dbraw/zinc/94/52/08/180945208.db2.gz NAUVOGJRFYTMRS-NSHDSACASA-N 1 2 247.273 2.280 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@@H](C3CC3)C2)sn1 ZINC000639060461 353374073 /nfs/dbraw/zinc/37/40/73/353374073.db2.gz HLMFOCIWXWZUQS-GFCCVEGCSA-N 1 2 238.356 2.062 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@@H](C3CC3)C2)sn1 ZINC000639060461 353374075 /nfs/dbraw/zinc/37/40/75/353374075.db2.gz HLMFOCIWXWZUQS-GFCCVEGCSA-N 1 2 238.356 2.062 20 0 BEADLO CCN(CC(F)F)[C@H](c1[nH+]ccn1C)C1CC1 ZINC000639063500 353374583 /nfs/dbraw/zinc/37/45/83/353374583.db2.gz WXWPDFHDROQBFP-NSHDSACASA-N 1 2 243.301 2.458 20 0 BEADLO C[C@H]1CN(c2cc(C(F)(F)F)cc[nH+]2)CCO1 ZINC000080766507 353397609 /nfs/dbraw/zinc/39/76/09/353397609.db2.gz NSLJMVQWTQDQMJ-QMMMGPOBSA-N 1 2 246.232 2.326 20 0 BEADLO c1n[nH]nc1C[NH2+]CCCC1CCCCC1 ZINC000398381749 363229331 /nfs/dbraw/zinc/22/93/31/363229331.db2.gz HILSGXLVOUGVCJ-UHFFFAOYSA-N 1 2 222.336 2.255 20 0 BEADLO CC1(C)CC[C@H]1[NH2+]Cc1nnsc1Cl ZINC000572494386 324131855 /nfs/dbraw/zinc/13/18/55/324131855.db2.gz UIQCKDOEUQPTJK-SSDOTTSWSA-N 1 2 231.752 2.470 20 0 BEADLO Cc1cc(NC[C@H](C)c2nccs2)nc[nH+]1 ZINC000230610832 353514014 /nfs/dbraw/zinc/51/40/14/353514014.db2.gz RNSJPYMREOXHGJ-QMMMGPOBSA-N 1 2 234.328 2.457 20 0 BEADLO CC1(C)CCCC[C@H]1NC(=O)CCc1c[nH+]c[nH]1 ZINC000193512194 353590865 /nfs/dbraw/zinc/59/08/65/353590865.db2.gz BGTMLDOCSRCFTB-GFCCVEGCSA-N 1 2 249.358 2.427 20 0 BEADLO CC1(C)CCCC[C@H]1NC(=O)CCc1c[nH]c[nH+]1 ZINC000193512194 353590867 /nfs/dbraw/zinc/59/08/67/353590867.db2.gz BGTMLDOCSRCFTB-GFCCVEGCSA-N 1 2 249.358 2.427 20 0 BEADLO Cc1nc(CNc2cc(C)[nH+]c(C(C)C)n2)no1 ZINC000230906531 353552258 /nfs/dbraw/zinc/55/22/58/353552258.db2.gz MCGZJTYZYSRGHB-UHFFFAOYSA-N 1 2 247.302 2.212 20 0 BEADLO C[C@@H](CC(=O)Nc1ccc(F)cn1)n1cc[nH+]c1 ZINC000577876338 366094362 /nfs/dbraw/zinc/09/43/62/366094362.db2.gz UVLTVCIMHNUUDN-VIFPVBQESA-N 1 2 248.261 2.007 20 0 BEADLO CC(C)(C)[C@H]1CCCC[C@H]1[NH2+]Cc1ncn[nH]1 ZINC000037919139 188470337 /nfs/dbraw/zinc/47/03/37/188470337.db2.gz XWMIEKQERYGZCO-WDEREUQCSA-N 1 2 236.363 2.499 20 0 BEADLO Fc1cccc2c1OCC[C@@H]2[NH2+]Cc1ncc[nH]1 ZINC000191129452 181006912 /nfs/dbraw/zinc/00/69/12/181006912.db2.gz FCODNATWFOETEM-NSHDSACASA-N 1 2 247.273 2.162 20 0 BEADLO Fc1cccc([C@@H]2C[C@H]2[NH+]2CCOCC2)c1 ZINC000334549882 181004067 /nfs/dbraw/zinc/00/40/67/181004067.db2.gz XNMSFJZPEHVFOI-QWHCGFSZSA-N 1 2 221.275 2.014 20 0 BEADLO Fc1ccccc1C[N@@H+]1CCOC[C@H]1C1CC1 ZINC000090007468 181012226 /nfs/dbraw/zinc/01/22/26/181012226.db2.gz PYRFFROYCGFCHB-AWEZNQCLSA-N 1 2 235.302 2.437 20 0 BEADLO Fc1ccccc1C[N@H+]1CCOC[C@H]1C1CC1 ZINC000090007468 181012228 /nfs/dbraw/zinc/01/22/28/181012228.db2.gz PYRFFROYCGFCHB-AWEZNQCLSA-N 1 2 235.302 2.437 20 0 BEADLO Cc1[nH+]c2cc(NC(=O)[C@@H]3C[C@@H]3C)ccc2n1C ZINC000608248452 353770274 /nfs/dbraw/zinc/77/02/74/353770274.db2.gz NYEHWNNMUYKSBM-GZMMTYOYSA-N 1 2 243.310 2.476 20 0 BEADLO COc1cc(F)cc(OC)c1C[NH+]1CC(C)C1 ZINC000639122608 353773695 /nfs/dbraw/zinc/77/36/95/353773695.db2.gz CUQJVDRFDMKFLC-UHFFFAOYSA-N 1 2 239.290 2.295 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccns2)C[C@H](C2CC2)O1 ZINC000639116922 353742401 /nfs/dbraw/zinc/74/24/01/353742401.db2.gz AXCZWNKFFBVMEH-BXKDBHETSA-N 1 2 238.356 2.142 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccns2)C[C@H](C2CC2)O1 ZINC000639116922 353742404 /nfs/dbraw/zinc/74/24/04/353742404.db2.gz AXCZWNKFFBVMEH-BXKDBHETSA-N 1 2 238.356 2.142 20 0 BEADLO Fc1cccnc1CNc1cccc[nH+]1 ZINC000127658665 181015783 /nfs/dbraw/zinc/01/57/83/181015783.db2.gz ZHUDMKAMSHIQPX-UHFFFAOYSA-N 1 2 203.220 2.228 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2ccc(F)cc2C)[nH]1 ZINC000353822162 353805739 /nfs/dbraw/zinc/80/57/39/353805739.db2.gz LJFNBXPBEJBKBF-UHFFFAOYSA-N 1 2 248.305 2.193 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2ccc(F)cc2C)[nH]1 ZINC000353822162 353805743 /nfs/dbraw/zinc/80/57/43/353805743.db2.gz LJFNBXPBEJBKBF-UHFFFAOYSA-N 1 2 248.305 2.193 20 0 BEADLO CCC[C@@H](C[NH2+]C1(C(F)F)CC1)OC ZINC000639139915 353849094 /nfs/dbraw/zinc/84/90/94/353849094.db2.gz QEKXWTALIMKJBL-QMMMGPOBSA-N 1 2 207.264 2.189 20 0 BEADLO O=c1ccc(C[N@H+]2CCCC[C@@H]2C(F)F)c[nH]1 ZINC000639137737 353854785 /nfs/dbraw/zinc/85/47/85/353854785.db2.gz HORKRXIQGLZVLP-SNVBAGLBSA-N 1 2 242.269 2.407 20 0 BEADLO O=c1ccc(C[N@@H+]2CCCC[C@@H]2C(F)F)c[nH]1 ZINC000639137737 353854787 /nfs/dbraw/zinc/85/47/87/353854787.db2.gz HORKRXIQGLZVLP-SNVBAGLBSA-N 1 2 242.269 2.407 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2CCSC[C@H](C)C2)no1 ZINC000334534803 353914759 /nfs/dbraw/zinc/91/47/59/353914759.db2.gz GISRIPNZNNIXRQ-RKDXNWHRSA-N 1 2 241.360 2.124 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2CCSC[C@H](C)C2)no1 ZINC000334534803 353914760 /nfs/dbraw/zinc/91/47/60/353914760.db2.gz GISRIPNZNNIXRQ-RKDXNWHRSA-N 1 2 241.360 2.124 20 0 BEADLO C[N@H+](Cc1nc(C2CC2)cs1)[C@@H]1CCOC1 ZINC000343522753 353927572 /nfs/dbraw/zinc/92/75/72/353927572.db2.gz HBRISQCBZRYVID-SNVBAGLBSA-N 1 2 238.356 2.241 20 0 BEADLO C[N@@H+](Cc1nc(C2CC2)cs1)[C@@H]1CCOC1 ZINC000343522753 353927575 /nfs/dbraw/zinc/92/75/75/353927575.db2.gz HBRISQCBZRYVID-SNVBAGLBSA-N 1 2 238.356 2.241 20 0 BEADLO CC[C@@]1(C)C[C@H]1C(=O)NCCNc1cccc[nH+]1 ZINC000343599099 353930207 /nfs/dbraw/zinc/93/02/07/353930207.db2.gz HFICLUXVOFOCHW-FZMZJTMJSA-N 1 2 247.342 2.046 20 0 BEADLO CC(C)c1nc(NC[C@@H]2CCOC[C@@H]2C)cc[nH+]1 ZINC000343558254 353934635 /nfs/dbraw/zinc/93/46/35/353934635.db2.gz UVGYXTQAHQBZAU-RYUDHWBXSA-N 1 2 249.358 2.106 20 0 BEADLO CCOC(=O)C[N@H+](C)[C@H](C)c1ccc(F)cc1 ZINC000053422599 363279131 /nfs/dbraw/zinc/27/91/31/363279131.db2.gz DYZPQBATAAIVGQ-SNVBAGLBSA-N 1 2 239.290 2.382 20 0 BEADLO CCOC(=O)C[N@@H+](C)[C@H](C)c1ccc(F)cc1 ZINC000053422599 363279134 /nfs/dbraw/zinc/27/91/34/363279134.db2.gz DYZPQBATAAIVGQ-SNVBAGLBSA-N 1 2 239.290 2.382 20 0 BEADLO CC[N@H+](CCOC)[C@H](C)c1nc(C(C)C)no1 ZINC000343657556 353956002 /nfs/dbraw/zinc/95/60/02/353956002.db2.gz YUSGOLBDTDPGGR-SNVBAGLBSA-N 1 2 241.335 2.222 20 0 BEADLO CC[N@@H+](CCOC)[C@H](C)c1nc(C(C)C)no1 ZINC000343657556 353956006 /nfs/dbraw/zinc/95/60/06/353956006.db2.gz YUSGOLBDTDPGGR-SNVBAGLBSA-N 1 2 241.335 2.222 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2ccc3c(n2)CCC3)CCO1 ZINC000334557538 354004404 /nfs/dbraw/zinc/00/44/04/354004404.db2.gz DBDLQPDMRMBIKO-CQSZACIVSA-N 1 2 246.354 2.181 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2ccc3c(n2)CCC3)CCO1 ZINC000334557538 354004407 /nfs/dbraw/zinc/00/44/07/354004407.db2.gz DBDLQPDMRMBIKO-CQSZACIVSA-N 1 2 246.354 2.181 20 0 BEADLO CCn1nncc1C[N@@H+]1Cc2ccccc2[C@H]1C ZINC000334559351 354009150 /nfs/dbraw/zinc/00/91/50/354009150.db2.gz NLKKKTXRCPCGFS-LLVKDONJSA-N 1 2 242.326 2.375 20 0 BEADLO CCn1nncc1C[N@H+]1Cc2ccccc2[C@H]1C ZINC000334559351 354009152 /nfs/dbraw/zinc/00/91/52/354009152.db2.gz NLKKKTXRCPCGFS-LLVKDONJSA-N 1 2 242.326 2.375 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@@]1(C)CC=CCC1 ZINC000334549870 354017467 /nfs/dbraw/zinc/01/74/67/354017467.db2.gz WXNSOSNZJVRBIV-AWEZNQCLSA-N 1 2 245.326 2.432 20 0 BEADLO Cc1cc(N[C@H]2C[C@H]2C(F)F)nc(C(C)C)[nH+]1 ZINC000343782304 354017695 /nfs/dbraw/zinc/01/76/95/354017695.db2.gz NSWWJZJEYKQKAA-BDAKNGLRSA-N 1 2 241.285 2.396 20 0 BEADLO Cc1nc2[nH]ccc2c(NCC[C@@H]2CCOC2)[nH+]1 ZINC000343859075 354024493 /nfs/dbraw/zinc/02/44/93/354024493.db2.gz FDZDMJGCVWMMEF-SNVBAGLBSA-N 1 2 246.314 2.056 20 0 BEADLO CCN(C)C(=O)c1cc(C)ccc1-n1cc[nH+]c1 ZINC000074198709 354088823 /nfs/dbraw/zinc/08/88/23/354088823.db2.gz DWVYCJLDHGCOSW-UHFFFAOYSA-N 1 2 243.310 2.273 20 0 BEADLO Cc1cnc(C[NH2+]Cc2nccs2)s1 ZINC000230686806 363320190 /nfs/dbraw/zinc/32/01/90/363320190.db2.gz RVKDOPMQGMBKBL-UHFFFAOYSA-N 1 2 225.342 2.198 20 0 BEADLO CCn1cncc1C[NH+]1Cc2ccccc2C1 ZINC000334575114 354105597 /nfs/dbraw/zinc/10/55/97/354105597.db2.gz CSEBYLHKLSEWIL-UHFFFAOYSA-N 1 2 227.311 2.419 20 0 BEADLO CCn1c[nH+]cc1CN1Cc2ccccc2C1 ZINC000334575114 354105601 /nfs/dbraw/zinc/10/56/01/354105601.db2.gz CSEBYLHKLSEWIL-UHFFFAOYSA-N 1 2 227.311 2.419 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)Nc1cccc(F)c1 ZINC000344132606 354148847 /nfs/dbraw/zinc/14/88/47/354148847.db2.gz TUBLZSNUQAAPRG-UHFFFAOYSA-N 1 2 233.246 2.120 20 0 BEADLO OCC[C@H]([NH2+]Cc1cscn1)c1ccccc1 ZINC000344439224 354273440 /nfs/dbraw/zinc/27/34/40/354273440.db2.gz LZAMZXLAIXTLPI-ZDUSSCGKSA-N 1 2 248.351 2.356 20 0 BEADLO COc1cccc(C)c1C[NH+]1CC(C)(OC)C1 ZINC000639179619 354273609 /nfs/dbraw/zinc/27/36/09/354273609.db2.gz FDGSHPQPLMKXDY-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO C[C@@H]1C[C@@H](C)[NH+]1CC(=O)Nc1ccccc1F ZINC000334607274 354314190 /nfs/dbraw/zinc/31/41/90/354314190.db2.gz DTNJIZOLJXPQQA-NXEZZACHSA-N 1 2 236.290 2.247 20 0 BEADLO Fc1ccc(C[NH2+]Cc2ccon2)c(F)c1 ZINC000086452633 491061816 /nfs/dbraw/zinc/06/18/16/491061816.db2.gz AYRJUEQYDSVXEI-UHFFFAOYSA-N 1 2 224.210 2.243 20 0 BEADLO C[C@@H](CF)[NH2+]Cc1nc2ccccc2o1 ZINC000639182269 354344014 /nfs/dbraw/zinc/34/40/14/354344014.db2.gz DUNAJSWCPAVXAV-QMMMGPOBSA-N 1 2 208.236 2.275 20 0 BEADLO CC[C@H]([NH2+]Cc1c[nH]cn1)c1c(C)nn(C)c1C ZINC000344754535 354350990 /nfs/dbraw/zinc/35/09/90/354350990.db2.gz BFMHFKFFUGPZFA-LBPRGKRZSA-N 1 2 247.346 2.001 20 0 BEADLO c1cc(C[NH2+]Cc2noc3c2CCCC3)sn1 ZINC000639187882 354390318 /nfs/dbraw/zinc/39/03/18/354390318.db2.gz PRHLSLYWSDRJPY-UHFFFAOYSA-N 1 2 249.339 2.300 20 0 BEADLO NC(=O)C[N@@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000334628370 354369697 /nfs/dbraw/zinc/36/96/97/354369697.db2.gz YGRFLFRTKWZJBY-LLVKDONJSA-N 1 2 220.272 2.342 20 0 BEADLO NC(=O)C[N@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000334628370 354369701 /nfs/dbraw/zinc/36/97/01/354369701.db2.gz YGRFLFRTKWZJBY-LLVKDONJSA-N 1 2 220.272 2.342 20 0 BEADLO NC(=O)C[N@@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000334628373 354369735 /nfs/dbraw/zinc/36/97/35/354369735.db2.gz YGRFLFRTKWZJBY-NSHDSACASA-N 1 2 220.272 2.342 20 0 BEADLO NC(=O)C[N@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000334628373 354369738 /nfs/dbraw/zinc/36/97/38/354369738.db2.gz YGRFLFRTKWZJBY-NSHDSACASA-N 1 2 220.272 2.342 20 0 BEADLO CC1(CO)CN(c2[nH+]ccc3ccc(F)cc32)C1 ZINC000334687321 354433718 /nfs/dbraw/zinc/43/37/18/354433718.db2.gz VDKTXKOIMQTZIQ-UHFFFAOYSA-N 1 2 246.285 2.193 20 0 BEADLO Cc1csc(C[N@@H+]2CCCO[C@@H](CF)C2)n1 ZINC000334644233 354402084 /nfs/dbraw/zinc/40/20/84/354402084.db2.gz CADVHIRHUIIVNG-JTQLQIEISA-N 1 2 244.335 2.012 20 0 BEADLO Cc1csc(C[N@H+]2CCCO[C@@H](CF)C2)n1 ZINC000334644233 354402087 /nfs/dbraw/zinc/40/20/87/354402087.db2.gz CADVHIRHUIIVNG-JTQLQIEISA-N 1 2 244.335 2.012 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)CC1CC(F)(F)C1 ZINC000334667381 354406793 /nfs/dbraw/zinc/40/67/93/354406793.db2.gz KRQZVOCVFCGPLP-UHFFFAOYSA-N 1 2 240.253 2.186 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCCc2nn(C)cc21)C(C)(F)F ZINC000334668903 354409449 /nfs/dbraw/zinc/40/94/49/354409449.db2.gz CZIGWBQILBWHHZ-PSASIEDQSA-N 1 2 243.301 2.431 20 0 BEADLO O=C(CCn1cc[nH+]c1)N1CC2(C1)CCCCC2 ZINC000334674449 354416844 /nfs/dbraw/zinc/41/68/44/354416844.db2.gz PHGAVMWCXAOJKP-UHFFFAOYSA-N 1 2 247.342 2.066 20 0 BEADLO CC1=C[C@@H](C)C[N@@H+]([C@@H](C)c2csnn2)C1 ZINC000334650771 354442887 /nfs/dbraw/zinc/44/28/87/354442887.db2.gz GKXJYOADKNTDGA-SCZZXKLOSA-N 1 2 223.345 2.497 20 0 BEADLO CC1=C[C@@H](C)C[N@H+]([C@@H](C)c2csnn2)C1 ZINC000334650771 354442890 /nfs/dbraw/zinc/44/28/90/354442890.db2.gz GKXJYOADKNTDGA-SCZZXKLOSA-N 1 2 223.345 2.497 20 0 BEADLO CC1=C[C@H](C)C[N@@H+]([C@@H](C)c2csnn2)C1 ZINC000334650773 354443283 /nfs/dbraw/zinc/44/32/83/354443283.db2.gz GKXJYOADKNTDGA-WPRPVWTQSA-N 1 2 223.345 2.497 20 0 BEADLO CC1=C[C@H](C)C[N@H+]([C@@H](C)c2csnn2)C1 ZINC000334650773 354443284 /nfs/dbraw/zinc/44/32/84/354443284.db2.gz GKXJYOADKNTDGA-WPRPVWTQSA-N 1 2 223.345 2.497 20 0 BEADLO FC[C@@H]1CN(c2[nH]c3ccccc3[nH+]2)CCCO1 ZINC000334652752 354445761 /nfs/dbraw/zinc/44/57/61/354445761.db2.gz STYSXMKZXSKWDU-SNVBAGLBSA-N 1 2 249.289 2.128 20 0 BEADLO O=C(CC1CCC1)Nc1c[nH+]c2n1CCCC2 ZINC000334653274 354446479 /nfs/dbraw/zinc/44/64/79/354446479.db2.gz NSVRORAZBHZLKR-UHFFFAOYSA-N 1 2 233.315 2.348 20 0 BEADLO CC[C@]1(C)COCC[N@@H+]1Cc1csc(C)n1 ZINC000334658856 354454872 /nfs/dbraw/zinc/45/48/72/354454872.db2.gz JJOFJKDFSKCYOJ-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO CC[C@]1(C)COCC[N@H+]1Cc1csc(C)n1 ZINC000334658856 354454875 /nfs/dbraw/zinc/45/48/75/354454875.db2.gz JJOFJKDFSKCYOJ-GFCCVEGCSA-N 1 2 240.372 2.452 20 0 BEADLO C[C@@H]1CCC[C@@]1(C)C(=O)N1CCn2c[nH+]cc2C1 ZINC000334662061 354461767 /nfs/dbraw/zinc/46/17/67/354461767.db2.gz UFTFHBBXSOKHBJ-BXUZGUMPSA-N 1 2 247.342 2.052 20 0 BEADLO Cn1c[nH+]cc1Cc1nc(C2CCCC2)no1 ZINC000349654762 366205842 /nfs/dbraw/zinc/20/58/42/366205842.db2.gz YKPIDDJPYIJZGR-UHFFFAOYSA-N 1 2 232.287 2.052 20 0 BEADLO C[C@H]1c2nncn2CC[N@H+]1CC1=CCCCC1 ZINC000334692056 354481382 /nfs/dbraw/zinc/48/13/82/354481382.db2.gz JVWISOOODZVZQM-NSHDSACASA-N 1 2 232.331 2.155 20 0 BEADLO C[C@H]1c2nncn2CC[N@@H+]1CC1=CCCCC1 ZINC000334692056 354481384 /nfs/dbraw/zinc/48/13/84/354481384.db2.gz JVWISOOODZVZQM-NSHDSACASA-N 1 2 232.331 2.155 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)[C@H]1C[C@@H]1C1CC1 ZINC000334729524 354529659 /nfs/dbraw/zinc/52/96/59/354529659.db2.gz CJNKGFDCVXPLDB-NEPJUHHUSA-N 1 2 241.294 2.319 20 0 BEADLO Cc1cccc(C[N@@H+]2CC[C@@](F)(CO)C2)c1F ZINC000334742504 354545919 /nfs/dbraw/zinc/54/59/19/354545919.db2.gz JKHRDNVJLSRBKP-ZDUSSCGKSA-N 1 2 241.281 2.040 20 0 BEADLO Cc1cccc(C[N@H+]2CC[C@@](F)(CO)C2)c1F ZINC000334742504 354545924 /nfs/dbraw/zinc/54/59/24/354545924.db2.gz JKHRDNVJLSRBKP-ZDUSSCGKSA-N 1 2 241.281 2.040 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CC(C)(C)[C@@H]1[C@@H]1CCCO1 ZINC000334695826 354487207 /nfs/dbraw/zinc/48/72/07/354487207.db2.gz WIWSROCESCWIDH-STQMWFEESA-N 1 2 249.358 2.108 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CC(C)(C)[C@@H]1[C@@H]1CCCO1 ZINC000334695826 354487212 /nfs/dbraw/zinc/48/72/12/354487212.db2.gz WIWSROCESCWIDH-STQMWFEESA-N 1 2 249.358 2.108 20 0 BEADLO C[C@H]1C[C@@H](NC2(C(F)F)CC2)c2[nH+]ccn21 ZINC000334704056 354498051 /nfs/dbraw/zinc/49/80/51/354498051.db2.gz XDDSQMQJDBCKJO-JGVFFNPUSA-N 1 2 227.258 2.276 20 0 BEADLO Cc1cc(C)c(NC(=O)N2CC(C)C2)c(C)[nH+]1 ZINC000334704887 354498323 /nfs/dbraw/zinc/49/83/23/354498323.db2.gz BLUMSPZYQCGFKR-UHFFFAOYSA-N 1 2 233.315 2.490 20 0 BEADLO COC1C[NH+](Cc2cc3ccc(F)cc3[nH]2)C1 ZINC000334742104 354545287 /nfs/dbraw/zinc/54/52/87/354545287.db2.gz XRELIVWAPMLRGX-UHFFFAOYSA-N 1 2 234.274 2.138 20 0 BEADLO COC1C[NH+](Cc2ccc3nc(C)sc3c2)C1 ZINC000334741904 354545314 /nfs/dbraw/zinc/54/53/14/354545314.db2.gz UUEPNWLKAAPHGT-UHFFFAOYSA-N 1 2 248.351 2.435 20 0 BEADLO Cc1ccnc(C[N@@H+]2C[C@@H](C)S[C@@H](C)C2)n1 ZINC000334754370 354575553 /nfs/dbraw/zinc/57/55/53/354575553.db2.gz HGNOQTROQQZACG-PHIMTYICSA-N 1 2 237.372 2.111 20 0 BEADLO Cc1ccnc(C[N@H+]2C[C@@H](C)S[C@@H](C)C2)n1 ZINC000334754370 354575554 /nfs/dbraw/zinc/57/55/54/354575554.db2.gz HGNOQTROQQZACG-PHIMTYICSA-N 1 2 237.372 2.111 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)CC(C)(C)C)c2[nH+]ccn21 ZINC000334756070 354578602 /nfs/dbraw/zinc/57/86/02/354578602.db2.gz SEVFCYVDAPJMOW-ZJUUUORDSA-N 1 2 235.331 2.441 20 0 BEADLO Cc1ccc(C(=O)N[C@@H]2C[C@@H](C)n3cc[nH+]c32)o1 ZINC000334743778 354547623 /nfs/dbraw/zinc/54/76/23/354547623.db2.gz MUNSHDIDFZMJSO-PSASIEDQSA-N 1 2 245.282 2.220 20 0 BEADLO C[C@H]1C[C@H](NC(=O)C2CCCC2)c2[nH+]ccn21 ZINC000334744483 354548205 /nfs/dbraw/zinc/54/82/05/354548205.db2.gz SGNUOYPAARLOSM-ONGXEEELSA-N 1 2 233.315 2.195 20 0 BEADLO Cc1cc(C)c(CNC(=O)[C@@]2(C)C[C@H]2F)c[nH+]1 ZINC000335091225 354627686 /nfs/dbraw/zinc/62/76/86/354627686.db2.gz LOCGZJHRIAOVIF-YPMHNXCESA-N 1 2 236.290 2.063 20 0 BEADLO CC1=C[C@H](C)C[N@H+](Cc2nc(C(F)F)no2)C1 ZINC000335096338 354635892 /nfs/dbraw/zinc/63/58/92/354635892.db2.gz KOTVLEOACKWDCS-ZETCQYMHSA-N 1 2 243.257 2.405 20 0 BEADLO CC1=C[C@H](C)C[N@@H+](Cc2nc(C(F)F)no2)C1 ZINC000335096338 354635896 /nfs/dbraw/zinc/63/58/96/354635896.db2.gz KOTVLEOACKWDCS-ZETCQYMHSA-N 1 2 243.257 2.405 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2CCCC[C@H]2C)n1 ZINC000335080480 354643262 /nfs/dbraw/zinc/64/32/62/354643262.db2.gz WWVGJFQLSLDOQI-RKDXNWHRSA-N 1 2 209.293 2.083 20 0 BEADLO Cc1cc(C(=O)Nc2cc[nH+]cc2O)sc1C ZINC000345385081 354647024 /nfs/dbraw/zinc/64/70/24/354647024.db2.gz YFCPTXUUQRPOLM-UHFFFAOYSA-N 1 2 248.307 2.140 20 0 BEADLO Cn1c(C[N@@H+]2CCO[C@H]3C[C@H]32)cc2ccccc21 ZINC000639202360 354607607 /nfs/dbraw/zinc/60/76/07/354607607.db2.gz XWPIYAWBPXNZOF-CABCVRRESA-N 1 2 242.322 2.151 20 0 BEADLO Cn1c(C[N@H+]2CCO[C@H]3C[C@H]32)cc2ccccc21 ZINC000639202360 354607609 /nfs/dbraw/zinc/60/76/09/354607609.db2.gz XWPIYAWBPXNZOF-CABCVRRESA-N 1 2 242.322 2.151 20 0 BEADLO C[C@@H]1C[C@H](C)C[N@@H+](Cc2nc(C(F)F)no2)C1 ZINC000335100278 354709214 /nfs/dbraw/zinc/70/92/14/354709214.db2.gz NNIXNLIIZBYXQD-OCAPTIKFSA-N 1 2 245.273 2.485 20 0 BEADLO C[C@@H]1C[C@H](C)C[N@H+](Cc2nc(C(F)F)no2)C1 ZINC000335100278 354709219 /nfs/dbraw/zinc/70/92/19/354709219.db2.gz NNIXNLIIZBYXQD-OCAPTIKFSA-N 1 2 245.273 2.485 20 0 BEADLO C[C@H]1C[N@H+](Cc2nc(C(F)F)no2)C[C@H]1C ZINC000335101013 354710266 /nfs/dbraw/zinc/71/02/66/354710266.db2.gz VLIYMUQGPMDXJN-KNVOCYPGSA-N 1 2 231.246 2.095 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nc(C(F)F)no2)C[C@H]1C ZINC000335101013 354710268 /nfs/dbraw/zinc/71/02/68/354710268.db2.gz VLIYMUQGPMDXJN-KNVOCYPGSA-N 1 2 231.246 2.095 20 0 BEADLO Cc1cn2cc(NC(=O)[C@@]3(C)C[C@@H]3F)ccc2[nH+]1 ZINC000335102399 354713639 /nfs/dbraw/zinc/71/36/39/354713639.db2.gz FYUDNFAYEMRBGH-GWCFXTLKSA-N 1 2 247.273 2.329 20 0 BEADLO CCC(CC)CC(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000345639850 354721645 /nfs/dbraw/zinc/72/16/45/354721645.db2.gz FAJVMNVAEUFPBY-UHFFFAOYSA-N 1 2 223.320 2.194 20 0 BEADLO C[C@H]1CC[N@H+](Cc2nc(C(F)F)no2)C[C@H]1C ZINC000335119087 354724743 /nfs/dbraw/zinc/72/47/43/354724743.db2.gz RNPMOSZYBHZMFF-JGVFFNPUSA-N 1 2 245.273 2.485 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2nc(C(F)F)no2)C[C@H]1C ZINC000335119087 354724748 /nfs/dbraw/zinc/72/47/48/354724748.db2.gz RNPMOSZYBHZMFF-JGVFFNPUSA-N 1 2 245.273 2.485 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1ccns1 ZINC000639208901 354729120 /nfs/dbraw/zinc/72/91/20/354729120.db2.gz HEHWDBXPMHFSRI-UHFFFAOYSA-N 1 2 237.328 2.326 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1ccns1 ZINC000639208901 354729123 /nfs/dbraw/zinc/72/91/23/354729123.db2.gz HEHWDBXPMHFSRI-UHFFFAOYSA-N 1 2 237.328 2.326 20 0 BEADLO Cn1cc[nH+]c1CNc1cccc(F)c1F ZINC000040230745 358489366 /nfs/dbraw/zinc/48/93/66/358489366.db2.gz HUVGQOIGKIFKRP-UHFFFAOYSA-N 1 2 223.226 2.310 20 0 BEADLO CCc1noc([C@@H](C)[N@@H+]2CC[C@@](C)(F)C2)n1 ZINC000335940438 134017090 /nfs/dbraw/zinc/01/70/90/134017090.db2.gz HPNULLPGYSWVML-LDYMZIIASA-N 1 2 227.283 2.127 20 0 BEADLO CCc1noc([C@@H](C)[N@H+]2CC[C@@](C)(F)C2)n1 ZINC000335940438 134017091 /nfs/dbraw/zinc/01/70/91/134017091.db2.gz HPNULLPGYSWVML-LDYMZIIASA-N 1 2 227.283 2.127 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1CC[C@@H](C)C1 ZINC000335954352 134022344 /nfs/dbraw/zinc/02/23/44/134022344.db2.gz XWBQBZLODQQEJS-MWLCHTKSSA-N 1 2 218.300 2.187 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)CCc1ccccc1O ZINC000346363829 354918529 /nfs/dbraw/zinc/91/85/29/354918529.db2.gz DGYXFNRDVBIUFB-UHFFFAOYSA-N 1 2 245.326 2.098 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)CCc1ccccc1O ZINC000346363829 354918532 /nfs/dbraw/zinc/91/85/32/354918532.db2.gz DGYXFNRDVBIUFB-UHFFFAOYSA-N 1 2 245.326 2.098 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H](C)CCc1cccc(C)c1 ZINC000040500706 358493285 /nfs/dbraw/zinc/49/32/85/358493285.db2.gz BFNHBUSNALYJFE-STQMWFEESA-N 1 2 249.354 2.467 20 0 BEADLO c1c[nH+]c(COCc2nc3cccnc3s2)[nH]1 ZINC000346616612 354994081 /nfs/dbraw/zinc/99/40/81/354994081.db2.gz AUHJMTJJDZVYDP-UHFFFAOYSA-N 1 2 246.295 2.131 20 0 BEADLO Cc1nc([C@@H](C)[NH2+]Cc2ccn(C)n2)cs1 ZINC000113427615 354996769 /nfs/dbraw/zinc/99/67/69/354996769.db2.gz RITBREIZEYNPKZ-MRVPVSSYSA-N 1 2 236.344 2.036 20 0 BEADLO CCc1nc(C[N@@H+]2CC(C)(C)C[C@H]2C)no1 ZINC000335195003 355028477 /nfs/dbraw/zinc/02/84/77/355028477.db2.gz QSDZEGDMICEGHV-SECBINFHSA-N 1 2 223.320 2.252 20 0 BEADLO CCc1nc(C[N@H+]2CC(C)(C)C[C@H]2C)no1 ZINC000335195003 355028481 /nfs/dbraw/zinc/02/84/81/355028481.db2.gz QSDZEGDMICEGHV-SECBINFHSA-N 1 2 223.320 2.252 20 0 BEADLO Cc1nc(N2CC(C(F)(F)F)C2)c(C)c(C)[nH+]1 ZINC000335230803 355073890 /nfs/dbraw/zinc/07/38/90/355073890.db2.gz BDIJQKSEGJFQII-UHFFFAOYSA-N 1 2 245.248 2.400 20 0 BEADLO Cc1cc(NC(=O)[C@@H](C)C2CCC2)cc[nH+]1 ZINC000335222546 355063353 /nfs/dbraw/zinc/06/33/53/355063353.db2.gz IIMFQIJGXBBZNW-JTQLQIEISA-N 1 2 218.300 2.187 20 0 BEADLO Cc1ccc(NC(=O)CCn2cc[nH+]c2)c(F)c1 ZINC000346801384 355108205 /nfs/dbraw/zinc/10/82/05/355108205.db2.gz SFKPTYQKUDVDQT-UHFFFAOYSA-N 1 2 247.273 2.359 20 0 BEADLO Cc1nnc(C[N@@H+](C)C2CC(C)(C)C2)s1 ZINC000335242057 355177294 /nfs/dbraw/zinc/17/72/94/355177294.db2.gz UOKWISNFACIYEV-UHFFFAOYSA-N 1 2 225.361 2.467 20 0 BEADLO Cc1nnc(C[N@H+](C)C2CC(C)(C)C2)s1 ZINC000335242057 355177298 /nfs/dbraw/zinc/17/72/98/355177298.db2.gz UOKWISNFACIYEV-UHFFFAOYSA-N 1 2 225.361 2.467 20 0 BEADLO c1nc(NC2CC2)cc(NC[C@H]2CCCCO2)[nH+]1 ZINC000413082830 191355869 /nfs/dbraw/zinc/35/58/69/191355869.db2.gz JHVDKNZDUNOEAN-LLVKDONJSA-N 1 2 248.330 2.032 20 0 BEADLO c1nc(NC[C@H]2CCCCO2)cc(NC2CC2)[nH+]1 ZINC000413082830 191355872 /nfs/dbraw/zinc/35/58/72/191355872.db2.gz JHVDKNZDUNOEAN-LLVKDONJSA-N 1 2 248.330 2.032 20 0 BEADLO FC(F)(F)CCNc1cc(NC2CC2)nc[nH+]1 ZINC000413172126 191360953 /nfs/dbraw/zinc/36/09/53/191360953.db2.gz PKKBJJDWSIAQCB-UHFFFAOYSA-N 1 2 246.236 2.415 20 0 BEADLO FC(F)(F)CCNc1cc(NC2CC2)[nH+]cn1 ZINC000413172126 191360955 /nfs/dbraw/zinc/36/09/55/191360955.db2.gz PKKBJJDWSIAQCB-UHFFFAOYSA-N 1 2 246.236 2.415 20 0 BEADLO Cc1ccc(CSCCCO)c(C)[nH+]1 ZINC000413019297 191341873 /nfs/dbraw/zinc/34/18/73/191341873.db2.gz UKLOAYPJHQEARJ-UHFFFAOYSA-N 1 2 211.330 2.314 20 0 BEADLO C[C@H]1CSCC[N@@H+]1Cc1ccn(C(F)F)n1 ZINC000347677598 355264489 /nfs/dbraw/zinc/26/44/89/355264489.db2.gz ICBUQCXLFUVXDZ-QMMMGPOBSA-N 1 2 247.314 2.216 20 0 BEADLO C[C@H]1CSCC[N@H+]1Cc1ccn(C(F)F)n1 ZINC000347677598 355264492 /nfs/dbraw/zinc/26/44/92/355264492.db2.gz ICBUQCXLFUVXDZ-QMMMGPOBSA-N 1 2 247.314 2.216 20 0 BEADLO COCC[C@@H](C)CNc1cc[nH+]c(C(C)C)n1 ZINC000413491939 191388481 /nfs/dbraw/zinc/38/84/81/191388481.db2.gz KZQPKRSVWBVFJC-LLVKDONJSA-N 1 2 237.347 2.106 20 0 BEADLO COCC[C@H](C)CNc1cc[nH+]c2ccncc12 ZINC000413490628 191388826 /nfs/dbraw/zinc/38/88/26/191388826.db2.gz JCFIHMZQYLVBMB-NSHDSACASA-N 1 2 245.326 2.136 20 0 BEADLO COCC1CCC(Nc2cc[nH+]c(C)n2)CC1 ZINC000413536573 191394117 /nfs/dbraw/zinc/39/41/17/191394117.db2.gz VSCZYJNCYGLQHX-UHFFFAOYSA-N 1 2 235.331 2.402 20 0 BEADLO Cc1ccccc1-n1cc(C[N@@H+](C)C2CC2)nn1 ZINC000347597861 355251039 /nfs/dbraw/zinc/25/10/39/355251039.db2.gz WSKWEPBUMXHSDJ-UHFFFAOYSA-N 1 2 242.326 2.170 20 0 BEADLO Cc1ccccc1-n1cc(C[N@H+](C)C2CC2)nn1 ZINC000347597861 355251041 /nfs/dbraw/zinc/25/10/41/355251041.db2.gz WSKWEPBUMXHSDJ-UHFFFAOYSA-N 1 2 242.326 2.170 20 0 BEADLO CN(CCC1CC1)c1cc(NC2CC2)[nH+]cn1 ZINC000413212062 191364259 /nfs/dbraw/zinc/36/42/59/191364259.db2.gz YAEZJQGNZQGLLT-UHFFFAOYSA-N 1 2 232.331 2.287 20 0 BEADLO CN(CCC1CC1)c1cc(NC2CC2)nc[nH+]1 ZINC000413212062 191364261 /nfs/dbraw/zinc/36/42/61/191364261.db2.gz YAEZJQGNZQGLLT-UHFFFAOYSA-N 1 2 232.331 2.287 20 0 BEADLO C[C@@H]1CC[C@@H]1Nc1cc(NC2CC2)[nH+]cn1 ZINC000413300007 191370227 /nfs/dbraw/zinc/37/02/27/191370227.db2.gz VMLAGISTFNMUGA-SCZZXKLOSA-N 1 2 218.304 2.261 20 0 BEADLO C[C@@H]1CC[C@@H]1Nc1cc(NC2CC2)nc[nH+]1 ZINC000413300007 191370229 /nfs/dbraw/zinc/37/02/29/191370229.db2.gz VMLAGISTFNMUGA-SCZZXKLOSA-N 1 2 218.304 2.261 20 0 BEADLO CC/C=C/CNc1cc(NC2CC2)[nH+]cn1 ZINC000413323520 191372973 /nfs/dbraw/zinc/37/29/73/191372973.db2.gz YKBZXMUGSVDMKT-ONEGZZNKSA-N 1 2 218.304 2.429 20 0 BEADLO CC/C=C/CNc1cc(NC2CC2)nc[nH+]1 ZINC000413323520 191372976 /nfs/dbraw/zinc/37/29/76/191372976.db2.gz YKBZXMUGSVDMKT-ONEGZZNKSA-N 1 2 218.304 2.429 20 0 BEADLO Cc1cnc(NCCc2ccc(C)c[nH+]2)s1 ZINC000413350482 191374000 /nfs/dbraw/zinc/37/40/00/191374000.db2.gz JQPVXFKVKYGXBL-UHFFFAOYSA-N 1 2 233.340 2.231 20 0 BEADLO C[C@@H]1CC[C@@H](CNc2cc[nH+]c3ccncc23)O1 ZINC000413370851 191377529 /nfs/dbraw/zinc/37/75/29/191377529.db2.gz DGNHBBLETUFKBB-MNOVXSKESA-N 1 2 243.310 2.031 20 0 BEADLO CCn1ncnc1C[NH+]1CC2(C1)CCCCC2 ZINC000639249851 355281708 /nfs/dbraw/zinc/28/17/08/355281708.db2.gz HZLUZYHZSQMINF-UHFFFAOYSA-N 1 2 234.347 2.064 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccns2)CC2(CCC2)O1 ZINC000639289007 355407737 /nfs/dbraw/zinc/40/77/37/355407737.db2.gz VLPXQVWWWKXTCX-SNVBAGLBSA-N 1 2 238.356 2.287 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccns2)CC2(CCC2)O1 ZINC000639289007 355407740 /nfs/dbraw/zinc/40/77/40/355407740.db2.gz VLPXQVWWWKXTCX-SNVBAGLBSA-N 1 2 238.356 2.287 20 0 BEADLO C[C@@H](C(N)=O)[N@@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000335807542 355480256 /nfs/dbraw/zinc/48/02/56/355480256.db2.gz KDBZZNDBMKANRM-VIFPVBQESA-N 1 2 246.310 2.163 20 0 BEADLO C[C@@H](C(N)=O)[N@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000335807542 355480259 /nfs/dbraw/zinc/48/02/59/355480259.db2.gz KDBZZNDBMKANRM-VIFPVBQESA-N 1 2 246.310 2.163 20 0 BEADLO Cc1ncc([C@@H](C)[NH2+][C@@H](C)c2ccon2)c(C)n1 ZINC000349833924 355488932 /nfs/dbraw/zinc/48/89/32/355488932.db2.gz MIULMHJNJNETOG-SCZZXKLOSA-N 1 2 246.314 2.493 20 0 BEADLO CC[C@H]([NH2+][C@H](C)c1ccon1)c1ccn(C)n1 ZINC000349836347 355490170 /nfs/dbraw/zinc/49/01/70/355490170.db2.gz RXBHYDYWZOAALB-ZJUUUORDSA-N 1 2 234.303 2.210 20 0 BEADLO C[NH2+]Cc1noc([C@@H](C)Cc2ccc(C)cc2)n1 ZINC000349932193 355530957 /nfs/dbraw/zinc/53/09/57/355530957.db2.gz DNYQOUPIGONEPK-NSHDSACASA-N 1 2 245.326 2.444 20 0 BEADLO C[C@H]1[N@H+](Cc2nccs2)CCOC1(C)C ZINC000335835487 355562490 /nfs/dbraw/zinc/56/24/90/355562490.db2.gz ULXHGAXFPZIWFX-SECBINFHSA-N 1 2 226.345 2.142 20 0 BEADLO C[C@H]1[N@@H+](Cc2nccs2)CCOC1(C)C ZINC000335835487 355562493 /nfs/dbraw/zinc/56/24/93/355562493.db2.gz ULXHGAXFPZIWFX-SECBINFHSA-N 1 2 226.345 2.142 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@H]1CC[C@H](C)C1 ZINC000335827748 355553677 /nfs/dbraw/zinc/55/36/77/355553677.db2.gz MTMUMKDWBXMYIF-UWVGGRQHSA-N 1 2 234.299 2.465 20 0 BEADLO CCc1cc[nH+]cc1NC[C@@H](OC)C1CC1 ZINC000639294159 355554614 /nfs/dbraw/zinc/55/46/14/355554614.db2.gz JBXBGBDGCCFBJV-CYBMUJFWSA-N 1 2 220.316 2.481 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@H]3CCCC[C@H]32)n[nH]1 ZINC000335817438 355507828 /nfs/dbraw/zinc/50/78/28/355507828.db2.gz ITUTZXMERMZUDH-VXGBXAGGSA-N 1 2 234.347 2.268 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@@H]3CCCC[C@@H]32)n[nH]1 ZINC000335817437 355507902 /nfs/dbraw/zinc/50/79/02/355507902.db2.gz ITUTZXMERMZUDH-RYUDHWBXSA-N 1 2 234.347 2.268 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1nc(C(C)(C)C)no1 ZINC000335817474 355507924 /nfs/dbraw/zinc/50/79/24/355507924.db2.gz NBENIWMZVJNFAI-DTORHVGOSA-N 1 2 223.320 2.350 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1nc(C(C)(C)C)no1 ZINC000335817474 355507927 /nfs/dbraw/zinc/50/79/27/355507927.db2.gz NBENIWMZVJNFAI-DTORHVGOSA-N 1 2 223.320 2.350 20 0 BEADLO C[NH2+]Cc1noc(C[C@H](C)c2ccccc2)n1 ZINC000349878756 355515564 /nfs/dbraw/zinc/51/55/64/355515564.db2.gz FXRGALLJPWOPOM-JTQLQIEISA-N 1 2 231.299 2.135 20 0 BEADLO CC(C)[C@H]1CN(c2[nH]c3ccccc3[nH+]2)CCO1 ZINC000349895502 355521399 /nfs/dbraw/zinc/52/13/99/355521399.db2.gz RHPSLUALQPIMMF-CYBMUJFWSA-N 1 2 245.326 2.424 20 0 BEADLO C[NH2+]Cc1noc(C[C@H]2CCC[C@@H](C)C2)n1 ZINC000349893677 355521469 /nfs/dbraw/zinc/52/14/69/355521469.db2.gz NXVOJHYZWZSJHS-ZJUUUORDSA-N 1 2 223.320 2.158 20 0 BEADLO C[NH2+]Cc1noc(C2(c3ccccc3)CCC2)n1 ZINC000349896394 355521594 /nfs/dbraw/zinc/52/15/94/355521594.db2.gz QOLKSDYDELVLHJ-UHFFFAOYSA-N 1 2 243.310 2.259 20 0 BEADLO C[NH2+]Cc1noc([C@@H](C)Oc2ccc(C)cc2)n1 ZINC000349905064 355523159 /nfs/dbraw/zinc/52/31/59/355523159.db2.gz DNEKDBWLQZYTJZ-SNVBAGLBSA-N 1 2 247.298 2.237 20 0 BEADLO Cc1nc(N2CCO[C@H](C(C)C)C2)c(C)c(C)[nH+]1 ZINC000349914961 355525626 /nfs/dbraw/zinc/52/56/26/355525626.db2.gz LFFKWMWHHZHRDX-ZDUSSCGKSA-N 1 2 249.358 2.263 20 0 BEADLO CC(C)[C@@H](C)C(=O)N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000335838188 355567319 /nfs/dbraw/zinc/56/73/19/355567319.db2.gz QPKZJSKSVIKDCZ-VXGBXAGGSA-N 1 2 249.358 2.028 20 0 BEADLO CCc1cc[nH+]cc1NCCCc1cnn(C)c1 ZINC000639295189 355577757 /nfs/dbraw/zinc/57/77/57/355577757.db2.gz ORZRCYRKIWAAEJ-UHFFFAOYSA-N 1 2 244.342 2.422 20 0 BEADLO COCc1cc[nH+]c(NC[C@@H](OC)C2CC2)c1 ZINC000639309944 355666126 /nfs/dbraw/zinc/66/61/26/355666126.db2.gz ANTSCZKLYOYJCP-GFCCVEGCSA-N 1 2 236.315 2.065 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)c1ccc(C)nc1 ZINC000335866807 355631130 /nfs/dbraw/zinc/63/11/30/355631130.db2.gz ARPBYEMSXYJOQR-UHFFFAOYSA-N 1 2 241.294 2.022 20 0 BEADLO Cc1cnc([C@H](C)[N@H+]2CCO[C@@H](C(C)C)C2)o1 ZINC000335867671 355632553 /nfs/dbraw/zinc/63/25/53/355632553.db2.gz RJVCJUDYWQMUKC-NWDGAFQWSA-N 1 2 238.331 2.401 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+]2CCO[C@@H](C(C)C)C2)o1 ZINC000335867671 355632555 /nfs/dbraw/zinc/63/25/55/355632555.db2.gz RJVCJUDYWQMUKC-NWDGAFQWSA-N 1 2 238.331 2.401 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+]2CCO[C@H](C(C)C)C2)o1 ZINC000335867670 355632830 /nfs/dbraw/zinc/63/28/30/355632830.db2.gz RJVCJUDYWQMUKC-NEPJUHHUSA-N 1 2 238.331 2.401 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+]2CCO[C@H](C(C)C)C2)o1 ZINC000335867670 355632831 /nfs/dbraw/zinc/63/28/31/355632831.db2.gz RJVCJUDYWQMUKC-NEPJUHHUSA-N 1 2 238.331 2.401 20 0 BEADLO Cc1csc(=O)n1Cc1ccc(C)[nH+]c1C ZINC000335894704 355689031 /nfs/dbraw/zinc/68/90/31/355689031.db2.gz YMEBOLLLUCJWIV-UHFFFAOYSA-N 1 2 234.324 2.278 20 0 BEADLO c1cc(C[N@@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)no1 ZINC000336007682 134049920 /nfs/dbraw/zinc/04/99/20/134049920.db2.gz ULZYUABJSVGFPA-STQMWFEESA-N 1 2 248.326 2.208 20 0 BEADLO c1cc(C[N@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)no1 ZINC000336007682 134049921 /nfs/dbraw/zinc/04/99/21/134049921.db2.gz ULZYUABJSVGFPA-STQMWFEESA-N 1 2 248.326 2.208 20 0 BEADLO Cc1cc(C)c(NC(=O)[C@@H]2CO[C@H](C)C2)c(C)[nH+]1 ZINC000335884510 355675127 /nfs/dbraw/zinc/67/51/27/355675127.db2.gz ROTUBZNTNCVIJK-PWSUYJOCSA-N 1 2 248.326 2.370 20 0 BEADLO Cc1cc(C)c(NC(=O)[C@H]2CO[C@@H](C)C2)c(C)[nH+]1 ZINC000335884508 355675402 /nfs/dbraw/zinc/67/54/02/355675402.db2.gz ROTUBZNTNCVIJK-CMPLNLGQSA-N 1 2 248.326 2.370 20 0 BEADLO CC[C@@H]1CCCN(C(=O)C(C)(C)c2c[nH+]c[nH]2)C1 ZINC000335889710 355681459 /nfs/dbraw/zinc/68/14/59/355681459.db2.gz OTLFTGIEFIVTDA-LLVKDONJSA-N 1 2 249.358 2.336 20 0 BEADLO COCc1cc[nH+]c(NCc2cc(C)no2)c1 ZINC000639313154 355684250 /nfs/dbraw/zinc/68/42/50/355684250.db2.gz OTCAZPUTEJBYPX-UHFFFAOYSA-N 1 2 233.271 2.137 20 0 BEADLO CO[C@@H]1CC[C@@H](Nc2[nH+]c(C)nc3[nH]ccc32)C1 ZINC000350683741 355740700 /nfs/dbraw/zinc/74/07/00/355740700.db2.gz HHKHEITVCMHWFH-NXEZZACHSA-N 1 2 246.314 2.246 20 0 BEADLO OCCOc1ccc(CNc2cccc[nH+]2)cc1 ZINC000350737037 355752597 /nfs/dbraw/zinc/75/25/97/355752597.db2.gz NOKAGJCQMRUSIT-UHFFFAOYSA-N 1 2 244.294 2.065 20 0 BEADLO Cc1nc(C[N@@H+](C)CC2(C(C)C)CC2)no1 ZINC000639332535 355759760 /nfs/dbraw/zinc/75/97/60/355759760.db2.gz MSDQOFNXAMAOSH-UHFFFAOYSA-N 1 2 223.320 2.246 20 0 BEADLO Cc1nc(C[N@H+](C)CC2(C(C)C)CC2)no1 ZINC000639332535 355759764 /nfs/dbraw/zinc/75/97/64/355759764.db2.gz MSDQOFNXAMAOSH-UHFFFAOYSA-N 1 2 223.320 2.246 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](c2ccccc2)[C@@H](C)O)o1 ZINC000639333643 355763200 /nfs/dbraw/zinc/76/32/00/355763200.db2.gz YQONGVGGXXENAV-BXUZGUMPSA-N 1 2 246.310 2.195 20 0 BEADLO COc1cc(C[NH2+]Cc2ccccc2F)on1 ZINC000639326498 355727227 /nfs/dbraw/zinc/72/72/27/355727227.db2.gz YBJSVEDBOWWXBR-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@H]1CCCC[C@H]1C ZINC000424860774 191837214 /nfs/dbraw/zinc/83/72/14/191837214.db2.gz FLNPRJANFLZOIR-NEPJUHHUSA-N 1 2 249.358 2.346 20 0 BEADLO c1nc(C[NH+]2CC(c3ccccc3)C2)co1 ZINC000639361709 355816234 /nfs/dbraw/zinc/81/62/34/355816234.db2.gz OLRZDECHMDCDSJ-UHFFFAOYSA-N 1 2 214.268 2.274 20 0 BEADLO CCCN(CC1CC1)C(=O)CCCn1cc[nH+]c1 ZINC000623250950 355823650 /nfs/dbraw/zinc/82/36/50/355823650.db2.gz KMLBTNDKKORCEX-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO FC(F)c1ccc(C[NH2+]Cc2ncc[nH]2)cn1 ZINC000639365402 355838295 /nfs/dbraw/zinc/83/82/95/355838295.db2.gz CYMBBGSQHUYIKH-UHFFFAOYSA-N 1 2 238.241 2.032 20 0 BEADLO C[C@H]1C[C@@H]1CNc1c[nH+]cc(N(C)C)c1 ZINC000639365635 355838795 /nfs/dbraw/zinc/83/87/95/355838795.db2.gz QBSNJYHSLONUMY-VHSXEESVSA-N 1 2 205.305 2.216 20 0 BEADLO CN(C)c1c[nH+]cc(NCCC[C@H]2CCO2)c1 ZINC000639366496 355843081 /nfs/dbraw/zinc/84/30/81/355843081.db2.gz WSMMTGDNFYPDBW-ZDUSSCGKSA-N 1 2 235.331 2.129 20 0 BEADLO CC(C)c1ccc(CC[NH2+]Cc2cn[nH]n2)cc1 ZINC000628363436 355848364 /nfs/dbraw/zinc/84/83/64/355848364.db2.gz KCSAVHQJCUBMOD-UHFFFAOYSA-N 1 2 244.342 2.260 20 0 BEADLO C[C@@H]1[C@H]([NH2+]Cc2cn[nH]n2)C[C@H]1c1ccccc1 ZINC000628363759 355850227 /nfs/dbraw/zinc/85/02/27/355850227.db2.gz XACAIWAJHNWYLU-ZLKJLUDKSA-N 1 2 242.326 2.087 20 0 BEADLO C[C@@H]1[C@@H]([NH2+]Cc2cn[nH]n2)C[C@@H]1c1ccccc1 ZINC000628363756 355850561 /nfs/dbraw/zinc/85/05/61/355850561.db2.gz XACAIWAJHNWYLU-BPNCWPANSA-N 1 2 242.326 2.087 20 0 BEADLO c1c[nH]c(C[NH2+]Cc2cnc(C3CCC3)s2)n1 ZINC000639372710 355875820 /nfs/dbraw/zinc/87/58/20/355875820.db2.gz TYICDNJTJBPKKT-UHFFFAOYSA-N 1 2 248.355 2.424 20 0 BEADLO CC(C)c1cnc(C[NH2+]C2(C)COC2)s1 ZINC000639380130 355916306 /nfs/dbraw/zinc/91/63/06/355916306.db2.gz AHVYMTYFYBUBBC-UHFFFAOYSA-N 1 2 226.345 2.145 20 0 BEADLO CC1([NH2+]Cc2cccc(Cl)c2F)COC1 ZINC000639380165 355916321 /nfs/dbraw/zinc/91/63/21/355916321.db2.gz BAQFQKXNOZUKJB-UHFFFAOYSA-N 1 2 229.682 2.358 20 0 BEADLO CC1([NH2+]Cc2ccc(Cl)cc2F)COC1 ZINC000639380302 355917535 /nfs/dbraw/zinc/91/75/35/355917535.db2.gz DMACPRWXBGNENI-UHFFFAOYSA-N 1 2 229.682 2.358 20 0 BEADLO Cc1[nH]ncc1C[NH+]1CCC(CCF)CC1 ZINC000639376387 355898610 /nfs/dbraw/zinc/89/86/10/355898610.db2.gz HAEOOFWJSDRFJT-UHFFFAOYSA-N 1 2 225.311 2.290 20 0 BEADLO C[C@H]1CN(c2cccc[nH+]2)C[C@@H](C(F)(F)F)O1 ZINC000608754086 355975063 /nfs/dbraw/zinc/97/50/63/355975063.db2.gz WDAQDGPQHGGPCZ-IUCAKERBSA-N 1 2 246.232 2.238 20 0 BEADLO C[C@H]1CN(c2cccc[nH+]2)C[C@H](C(F)(F)F)O1 ZINC000608754085 355975506 /nfs/dbraw/zinc/97/55/06/355975506.db2.gz WDAQDGPQHGGPCZ-DTWKUNHWSA-N 1 2 246.232 2.238 20 0 BEADLO COC[C@@H](C)CC(=O)Nc1c(C)cc[nH+]c1C ZINC000425591464 191925447 /nfs/dbraw/zinc/92/54/47/191925447.db2.gz ZNTIULNXAWLPDM-VIFPVBQESA-N 1 2 236.315 2.310 20 0 BEADLO C[N@H+](Cc1cc(C(C)(C)C)on1)[C@@H]1CCOC1 ZINC000351495991 356003060 /nfs/dbraw/zinc/00/30/60/356003060.db2.gz QTEFOVDCEACUCB-LLVKDONJSA-N 1 2 238.331 2.193 20 0 BEADLO C[N@@H+](Cc1cc(C(C)(C)C)on1)[C@@H]1CCOC1 ZINC000351495991 356003063 /nfs/dbraw/zinc/00/30/63/356003063.db2.gz QTEFOVDCEACUCB-LLVKDONJSA-N 1 2 238.331 2.193 20 0 BEADLO Cn1ncc(Cl)c1C[NH+]1CCC(C)(F)CC1 ZINC000639388640 356007426 /nfs/dbraw/zinc/00/74/26/356007426.db2.gz JKGNFNINBTZGFG-UHFFFAOYSA-N 1 2 245.729 2.398 20 0 BEADLO CC(C)CCCCC(=O)N[C@@H]1Cc2c[nH+]cn2C1 ZINC000623256714 355973300 /nfs/dbraw/zinc/97/33/00/355973300.db2.gz RLQFAHHIDRHCSX-GFCCVEGCSA-N 1 2 249.358 2.140 20 0 BEADLO Cc1ncccc1C[N@@H+]1CCc2ncsc2C1 ZINC000351646644 356042728 /nfs/dbraw/zinc/04/27/28/356042728.db2.gz HFLSWIIXFWXHCL-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ncccc1C[N@H+]1CCc2ncsc2C1 ZINC000351646644 356042730 /nfs/dbraw/zinc/04/27/30/356042730.db2.gz HFLSWIIXFWXHCL-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ccc2nc(C[NH+]3CC(C)(C)C3)cn2c1 ZINC000639393860 356075708 /nfs/dbraw/zinc/07/57/08/356075708.db2.gz VHEDLYPCKAGLGG-UHFFFAOYSA-N 1 2 229.327 2.485 20 0 BEADLO Cc1cc(C[NH+]2CCC(C(F)F)CC2)no1 ZINC000335916932 356160080 /nfs/dbraw/zinc/16/00/80/356160080.db2.gz WNPRUBOLBNFRRU-UHFFFAOYSA-N 1 2 230.258 2.460 20 0 BEADLO C[C@H]1C[C@H](C)[N@H+](Cc2noc(C3CC3)n2)C1 ZINC000335917220 356160632 /nfs/dbraw/zinc/16/06/32/356160632.db2.gz GYSMNFGNHVSPHG-IUCAKERBSA-N 1 2 221.304 2.177 20 0 BEADLO C[C@H]1C[C@H](C)[N@@H+](Cc2noc(C3CC3)n2)C1 ZINC000335917220 356160635 /nfs/dbraw/zinc/16/06/35/356160635.db2.gz GYSMNFGNHVSPHG-IUCAKERBSA-N 1 2 221.304 2.177 20 0 BEADLO C[C@H](C(N)=O)[N@H+]1CC=C(C(F)(F)F)CC1 ZINC000335913319 356142185 /nfs/dbraw/zinc/14/21/85/356142185.db2.gz GXHQZWREGWQACR-ZCFIWIBFSA-N 1 2 222.210 2.105 20 0 BEADLO C[C@H](C(N)=O)[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000335913319 356142190 /nfs/dbraw/zinc/14/21/90/356142190.db2.gz GXHQZWREGWQACR-ZCFIWIBFSA-N 1 2 222.210 2.105 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1ccc(Br)o1 ZINC000639442856 356220809 /nfs/dbraw/zinc/22/08/09/356220809.db2.gz VSSVFKYGUQTXIO-UHFFFAOYSA-N 1 2 246.104 2.063 20 0 BEADLO CC(=O)C[N@H+](C)Cc1ccc(Br)o1 ZINC000639442856 356220813 /nfs/dbraw/zinc/22/08/13/356220813.db2.gz VSSVFKYGUQTXIO-UHFFFAOYSA-N 1 2 246.104 2.063 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1[C@H]2CCCO[C@H]21 ZINC000425596295 192024395 /nfs/dbraw/zinc/02/43/95/192024395.db2.gz MWNVFVYDLJEMPN-NQBHXWOUSA-N 1 2 246.310 2.062 20 0 BEADLO CCCC(CCC)C(=O)N[C@H]1Cc2c[nH+]cn2C1 ZINC000623263145 356198368 /nfs/dbraw/zinc/19/83/68/356198368.db2.gz DGOKOOLLONXNAM-LBPRGKRZSA-N 1 2 249.358 2.140 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@@]12C[C@H](C)C[C@H](C)C2 ZINC000639427706 356208607 /nfs/dbraw/zinc/20/86/07/356208607.db2.gz OCLAFZRHUAXJCD-YABSGUDNSA-N 1 2 238.375 2.369 20 0 BEADLO CC[C@H](C)CCNC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000617643032 356255043 /nfs/dbraw/zinc/25/50/43/356255043.db2.gz NGZAABZPFWHYNG-RYUDHWBXSA-N 1 2 237.347 2.387 20 0 BEADLO CC[C@@H](C)CCNC(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000617641459 356257983 /nfs/dbraw/zinc/25/79/83/356257983.db2.gz OQSBLOFEFPFZDK-GHMZBOCLSA-N 1 2 249.358 2.067 20 0 BEADLO CC[C@@H](C)CCNC(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000617641459 356257988 /nfs/dbraw/zinc/25/79/88/356257988.db2.gz OQSBLOFEFPFZDK-GHMZBOCLSA-N 1 2 249.358 2.067 20 0 BEADLO Cc1cc(NC(=O)N2CC[C@@H]3CCC[C@@H]32)cc[nH+]1 ZINC000336119288 134089285 /nfs/dbraw/zinc/08/92/85/134089285.db2.gz VWFQZSCDBSHFSM-AAEUAGOBSA-N 1 2 245.326 2.218 20 0 BEADLO Cc1cnc(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)o1 ZINC000336118589 134089327 /nfs/dbraw/zinc/08/93/27/134089327.db2.gz WCGUBKPOADHXRM-KOLCDFICSA-N 1 2 242.269 2.460 20 0 BEADLO Cc1cnc(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)o1 ZINC000336118589 134089328 /nfs/dbraw/zinc/08/93/28/134089328.db2.gz WCGUBKPOADHXRM-KOLCDFICSA-N 1 2 242.269 2.460 20 0 BEADLO CC(C)(C)CCCC(=O)N[C@H]1Cc2c[nH+]cn2C1 ZINC000623267409 356325877 /nfs/dbraw/zinc/32/58/77/356325877.db2.gz QUKSUZOJZQHJEQ-NSHDSACASA-N 1 2 249.358 2.140 20 0 BEADLO CC(=O)C[N@@H+]1CCc2cccc(F)c2[C@@H]1C ZINC000639498099 356326231 /nfs/dbraw/zinc/32/62/31/356326231.db2.gz WSWUSCHXJKTPKN-JTQLQIEISA-N 1 2 221.275 2.334 20 0 BEADLO CC(=O)C[N@H+]1CCc2cccc(F)c2[C@@H]1C ZINC000639498099 356326232 /nfs/dbraw/zinc/32/62/32/356326232.db2.gz WSWUSCHXJKTPKN-JTQLQIEISA-N 1 2 221.275 2.334 20 0 BEADLO CCC(F)(F)C[N@H+](CCO)CC(C)(C)C ZINC000639483938 356299111 /nfs/dbraw/zinc/29/91/11/356299111.db2.gz ZUSGYSHDPCXSAH-UHFFFAOYSA-N 1 2 223.307 2.372 20 0 BEADLO CCC(F)(F)C[N@@H+](CCO)CC(C)(C)C ZINC000639483938 356299112 /nfs/dbraw/zinc/29/91/12/356299112.db2.gz ZUSGYSHDPCXSAH-UHFFFAOYSA-N 1 2 223.307 2.372 20 0 BEADLO Cc1ccncc1C[N@H+](C)Cc1ccnc(C)n1 ZINC000353267810 134097502 /nfs/dbraw/zinc/09/75/02/134097502.db2.gz OXIRCTQSAVHLNB-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO CCc1[nH+]c(C)ccc1OC[C@@H]1CCOC1 ZINC000352537744 356376766 /nfs/dbraw/zinc/37/67/66/356376766.db2.gz ZLVWHARTPFLLMJ-LLVKDONJSA-N 1 2 221.300 2.368 20 0 BEADLO CCC(F)(F)C[N@H+](C)CC1(O)CCCC1 ZINC000639545362 356406720 /nfs/dbraw/zinc/40/67/20/356406720.db2.gz UDUCSUKLBGGXCQ-UHFFFAOYSA-N 1 2 221.291 2.269 20 0 BEADLO CCC(F)(F)C[N@@H+](C)CC1(O)CCCC1 ZINC000639545362 356406722 /nfs/dbraw/zinc/40/67/22/356406722.db2.gz UDUCSUKLBGGXCQ-UHFFFAOYSA-N 1 2 221.291 2.269 20 0 BEADLO CC[C@@H]1CN(c2cc(C)[nH+]cn2)C[C@H](CC)O1 ZINC000420627514 192251331 /nfs/dbraw/zinc/25/13/31/192251331.db2.gz NEAXZKLPSKKFRJ-TXEJJXNPSA-N 1 2 235.331 2.179 20 0 BEADLO CC[C@@H](C)[C@@H](C)NC(=O)CCCn1cc[nH+]c1 ZINC000623280546 356453006 /nfs/dbraw/zinc/45/30/06/356453006.db2.gz AYIRLPZYJQMWFQ-VXGBXAGGSA-N 1 2 237.347 2.214 20 0 BEADLO CC(=O)C[NH+]1CC(c2nc3ccccc3s2)C1 ZINC000639555674 356458218 /nfs/dbraw/zinc/45/82/18/356458218.db2.gz QOSDNXYMJQUVFB-UHFFFAOYSA-N 1 2 246.335 2.285 20 0 BEADLO CC[C@H]1C[C@H](Nc2cc[nH+]c(C(C)C)n2)CCO1 ZINC000420617048 192248853 /nfs/dbraw/zinc/24/88/53/192248853.db2.gz JFUZRTCRBSFXST-NEPJUHHUSA-N 1 2 249.358 2.391 20 0 BEADLO Cc1[nH]ncc1C[NH2+]Cc1ccccc1 ZINC000035273951 356467748 /nfs/dbraw/zinc/46/77/48/356467748.db2.gz BRICWPHNPXCHAK-UHFFFAOYSA-N 1 2 201.273 2.008 20 0 BEADLO CCCCC[N@@H+]1CCSC[C@H]1C(=O)OCC ZINC000609798171 356472840 /nfs/dbraw/zinc/47/28/40/356472840.db2.gz FBRUYAXIIXOIRJ-NSHDSACASA-N 1 2 245.388 2.157 20 0 BEADLO CCCCC[N@H+]1CCSC[C@H]1C(=O)OCC ZINC000609798171 356472841 /nfs/dbraw/zinc/47/28/41/356472841.db2.gz FBRUYAXIIXOIRJ-NSHDSACASA-N 1 2 245.388 2.157 20 0 BEADLO CC1(C)CO[C@@H](C[N@@H+]2CCC(F)(F)C2)C1 ZINC000639570853 356495451 /nfs/dbraw/zinc/49/54/51/356495451.db2.gz REKOGSDHJNIOHH-SECBINFHSA-N 1 2 219.275 2.143 20 0 BEADLO CC1(C)CO[C@@H](C[N@H+]2CCC(F)(F)C2)C1 ZINC000639570853 356495456 /nfs/dbraw/zinc/49/54/56/356495456.db2.gz REKOGSDHJNIOHH-SECBINFHSA-N 1 2 219.275 2.143 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1cc(F)c(F)c(F)c1 ZINC000639571265 356495599 /nfs/dbraw/zinc/49/55/99/356495599.db2.gz HYVCNROLONVWBP-UHFFFAOYSA-N 1 2 231.217 2.125 20 0 BEADLO CC(=O)C[N@H+](C)Cc1cc(F)c(F)c(F)c1 ZINC000639571265 356495602 /nfs/dbraw/zinc/49/56/02/356495602.db2.gz HYVCNROLONVWBP-UHFFFAOYSA-N 1 2 231.217 2.125 20 0 BEADLO CC/C=C/CNC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000420845275 192267160 /nfs/dbraw/zinc/26/71/60/192267160.db2.gz OIIRMWVRFQLKSK-AATRIKPKSA-N 1 2 247.342 2.464 20 0 BEADLO CC(C)C[N@H+](C)Cc1nn(C)cc1Cl ZINC000420902267 192267692 /nfs/dbraw/zinc/26/76/92/192267692.db2.gz MGNCZYCGCLQQDP-UHFFFAOYSA-N 1 2 215.728 2.161 20 0 BEADLO CC(C)C[N@@H+](C)Cc1nn(C)cc1Cl ZINC000420902267 192267695 /nfs/dbraw/zinc/26/76/95/192267695.db2.gz MGNCZYCGCLQQDP-UHFFFAOYSA-N 1 2 215.728 2.161 20 0 BEADLO COCc1ccc([C@@H]2CCC[N@@H+]2CC(C)=O)o1 ZINC000639586232 356504973 /nfs/dbraw/zinc/50/49/73/356504973.db2.gz COACFSOQSDYETF-LBPRGKRZSA-N 1 2 237.299 2.152 20 0 BEADLO COCc1ccc([C@@H]2CCC[N@H+]2CC(C)=O)o1 ZINC000639586232 356504975 /nfs/dbraw/zinc/50/49/75/356504975.db2.gz COACFSOQSDYETF-LBPRGKRZSA-N 1 2 237.299 2.152 20 0 BEADLO CCC(F)(F)C[N@H+]1[C@H](C)C[C@@H](O)C[C@@H]1C ZINC000639601088 356520069 /nfs/dbraw/zinc/52/00/69/356520069.db2.gz NVGOZPOEKXLDKM-ILWJIGKKSA-N 1 2 221.291 2.265 20 0 BEADLO CCC(F)(F)C[N@@H+]1[C@H](C)C[C@@H](O)C[C@@H]1C ZINC000639601088 356520072 /nfs/dbraw/zinc/52/00/72/356520072.db2.gz NVGOZPOEKXLDKM-ILWJIGKKSA-N 1 2 221.291 2.265 20 0 BEADLO CCC(F)(F)C[N@@H+]1CC[C@H](O)C(C)(C)C1 ZINC000639603362 356523707 /nfs/dbraw/zinc/52/37/07/356523707.db2.gz ORKOJICHVXLKKG-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO CCC(F)(F)C[N@H+]1CC[C@H](O)C(C)(C)C1 ZINC000639603362 356523711 /nfs/dbraw/zinc/52/37/11/356523711.db2.gz ORKOJICHVXLKKG-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO C[C@@H]1CCCC[C@@H]1c1noc(C[NH+](C)C)n1 ZINC000336181442 134119671 /nfs/dbraw/zinc/11/96/71/134119671.db2.gz ALYRSNTTWYIQCP-ZJUUUORDSA-N 1 2 223.320 2.425 20 0 BEADLO CCOCCOCC[N@H+](C)CC(F)(F)CC ZINC000639605872 356527408 /nfs/dbraw/zinc/52/74/08/356527408.db2.gz HNKUNUCJJIIAEO-UHFFFAOYSA-N 1 2 239.306 2.017 20 0 BEADLO CCOCCOCC[N@@H+](C)CC(F)(F)CC ZINC000639605872 356527412 /nfs/dbraw/zinc/52/74/12/356527412.db2.gz HNKUNUCJJIIAEO-UHFFFAOYSA-N 1 2 239.306 2.017 20 0 BEADLO CC[C@H]1C[NH+](Cc2cc(C)ncn2)C[C@H](CC)O1 ZINC000420959663 192281394 /nfs/dbraw/zinc/28/13/94/192281394.db2.gz QLPSUXVDLLYDEP-KBPBESRZSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cnc(C)nc2)C[C@H](CC)O1 ZINC000420961408 192282130 /nfs/dbraw/zinc/28/21/30/192282130.db2.gz SHFIFLYELOZTID-OKILXGFUSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cnc(C)nc2)C[C@H](CC)O1 ZINC000420961408 192282132 /nfs/dbraw/zinc/28/21/32/192282132.db2.gz SHFIFLYELOZTID-OKILXGFUSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@H]1C[NH+](Cc2cc(C)no2)C[C@H](CC)O1 ZINC000420964303 192282967 /nfs/dbraw/zinc/28/29/67/192282967.db2.gz WQMJDBWHEARWGV-RYUDHWBXSA-N 1 2 238.331 2.372 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1CC(=O)c1ccccc1F ZINC000639618796 356535738 /nfs/dbraw/zinc/53/57/38/356535738.db2.gz RJMOYHINDHASNC-AOOOYVTPSA-N 1 2 221.275 2.491 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1CC(=O)c1ccccc1F ZINC000639618796 356535742 /nfs/dbraw/zinc/53/57/42/356535742.db2.gz RJMOYHINDHASNC-AOOOYVTPSA-N 1 2 221.275 2.491 20 0 BEADLO Cc1cc(N2CC[C@@H](F)C2)nc(C2CC2)[nH+]1 ZINC000336189134 134122610 /nfs/dbraw/zinc/12/26/10/134122610.db2.gz DRIMIJGQUCIGMO-SNVBAGLBSA-N 1 2 221.279 2.211 20 0 BEADLO Cc1ccsc1-c1noc(Cn2cc[nH+]c2)n1 ZINC000350464021 366280881 /nfs/dbraw/zinc/28/08/81/366280881.db2.gz CMDNBYDAGULTFW-UHFFFAOYSA-N 1 2 246.295 2.351 20 0 BEADLO CC(=O)C[N@@H+](C)Cc1cc(C)ccc1F ZINC000639627159 356548685 /nfs/dbraw/zinc/54/86/85/356548685.db2.gz OBDXHDPVSPQSMD-UHFFFAOYSA-N 1 2 209.264 2.155 20 0 BEADLO CC(=O)C[N@H+](C)Cc1cc(C)ccc1F ZINC000639627159 356548686 /nfs/dbraw/zinc/54/86/86/356548686.db2.gz OBDXHDPVSPQSMD-UHFFFAOYSA-N 1 2 209.264 2.155 20 0 BEADLO C[C@@H]1CC[C@H](O)C[N@@H+]1Cc1ncc(Cl)s1 ZINC000421009320 192300176 /nfs/dbraw/zinc/30/01/76/192300176.db2.gz IIIZMOCAZGBHOC-SFYZADRCSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@H]1CC[C@H](O)C[N@H+]1Cc1ncc(Cl)s1 ZINC000421009320 192300179 /nfs/dbraw/zinc/30/01/79/192300179.db2.gz IIIZMOCAZGBHOC-SFYZADRCSA-N 1 2 246.763 2.142 20 0 BEADLO CCN(Cc1ccccn1)c1cc(C)[nH+]cn1 ZINC000301580147 356550832 /nfs/dbraw/zinc/55/08/32/356550832.db2.gz SCENCIGRGRRWNX-UHFFFAOYSA-N 1 2 228.299 2.207 20 0 BEADLO CCC(F)(F)C[N@H+](C)[C@H]1CCCOC1 ZINC000639637871 356551492 /nfs/dbraw/zinc/55/14/92/356551492.db2.gz KFDZAQUBCZVTJQ-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO CCC(F)(F)C[N@@H+](C)[C@H]1CCCOC1 ZINC000639637871 356551494 /nfs/dbraw/zinc/55/14/94/356551494.db2.gz KFDZAQUBCZVTJQ-VIFPVBQESA-N 1 2 207.264 2.143 20 0 BEADLO COc1cc[nH+]cc1CSC[C@H]1C[C@@H](O)C1 ZINC000421213377 192312916 /nfs/dbraw/zinc/31/29/16/192312916.db2.gz AFLVWVZQJVWHHA-JGZJWPJOSA-N 1 2 239.340 2.094 20 0 BEADLO CC[N@H+](CC(F)(F)CC)[C@@H]1CCOC1 ZINC000639651092 356562072 /nfs/dbraw/zinc/56/20/72/356562072.db2.gz NLYIFKSSIYPCJC-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CC[N@@H+](CC(F)(F)CC)[C@@H]1CCOC1 ZINC000639651092 356562075 /nfs/dbraw/zinc/56/20/75/356562075.db2.gz NLYIFKSSIYPCJC-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO Cc1ccc(COc2cnn(C)c2)c(C)[nH+]1 ZINC000336214798 134136151 /nfs/dbraw/zinc/13/61/51/134136151.db2.gz XQLKDDBQCUZTNN-UHFFFAOYSA-N 1 2 217.272 2.011 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1nc(C2CCC2)no1 ZINC000639657459 356572672 /nfs/dbraw/zinc/57/26/72/356572672.db2.gz ZFNPBKCNOJXZRY-DTWKUNHWSA-N 1 2 221.304 2.177 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1nc(C2CCC2)no1 ZINC000639657459 356572675 /nfs/dbraw/zinc/57/26/75/356572675.db2.gz ZFNPBKCNOJXZRY-DTWKUNHWSA-N 1 2 221.304 2.177 20 0 BEADLO CCc1noc(C)c1C[N@@H+]1CCO[C@@H](CC)C1 ZINC000162732585 202051397 /nfs/dbraw/zinc/05/13/97/202051397.db2.gz MGRHXUZRSZBTSA-NSHDSACASA-N 1 2 238.331 2.156 20 0 BEADLO CCc1noc(C)c1C[N@H+]1CCO[C@@H](CC)C1 ZINC000162732585 202051401 /nfs/dbraw/zinc/05/14/01/202051401.db2.gz MGRHXUZRSZBTSA-NSHDSACASA-N 1 2 238.331 2.156 20 0 BEADLO O[C@H]1C[C@@H](COc2cccc(-n3cc[nH+]c3)c2)C1 ZINC000421221342 192315495 /nfs/dbraw/zinc/31/54/95/192315495.db2.gz YNTVAGAFGHOGAC-BJHJDKERSA-N 1 2 244.294 2.022 20 0 BEADLO CSCC[N@H+](C)Cc1nn(C)c(C)c1Cl ZINC000421318887 192317063 /nfs/dbraw/zinc/31/70/63/192317063.db2.gz ISWRAEIYXBKZRV-UHFFFAOYSA-N 1 2 247.795 2.177 20 0 BEADLO CSCC[N@@H+](C)Cc1nn(C)c(C)c1Cl ZINC000421318887 192317064 /nfs/dbraw/zinc/31/70/64/192317064.db2.gz ISWRAEIYXBKZRV-UHFFFAOYSA-N 1 2 247.795 2.177 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccnn2C2CCCC2)CCO1 ZINC000336217836 134137814 /nfs/dbraw/zinc/13/78/14/134137814.db2.gz VAFGVQIECCHEHQ-LBPRGKRZSA-N 1 2 249.358 2.219 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccnn2C2CCCC2)CCO1 ZINC000336217836 134137815 /nfs/dbraw/zinc/13/78/15/134137815.db2.gz VAFGVQIECCHEHQ-LBPRGKRZSA-N 1 2 249.358 2.219 20 0 BEADLO CCC(F)(F)C[N@H+](C[C@H]1CCC(=O)N1)C(C)C ZINC000639677357 356593588 /nfs/dbraw/zinc/59/35/88/356593588.db2.gz MQUIRLTYQMCYKS-SNVBAGLBSA-N 1 2 248.317 2.021 20 0 BEADLO CCC(F)(F)C[N@@H+](C[C@H]1CCC(=O)N1)C(C)C ZINC000639677357 356593589 /nfs/dbraw/zinc/59/35/89/356593589.db2.gz MQUIRLTYQMCYKS-SNVBAGLBSA-N 1 2 248.317 2.021 20 0 BEADLO CCC(F)(F)C[N@@H+]1CC[C@H](OC)[C@@H](C)C1 ZINC000639661907 356575133 /nfs/dbraw/zinc/57/51/33/356575133.db2.gz BPJZUCXINASALZ-UWVGGRQHSA-N 1 2 221.291 2.389 20 0 BEADLO CCC(F)(F)C[N@H+]1CC[C@H](OC)[C@@H](C)C1 ZINC000639661907 356575139 /nfs/dbraw/zinc/57/51/39/356575139.db2.gz BPJZUCXINASALZ-UWVGGRQHSA-N 1 2 221.291 2.389 20 0 BEADLO CCC(C)(C)CC(=O)N[C@H]1CCn2c[nH+]cc2C1 ZINC000623306708 356607753 /nfs/dbraw/zinc/60/77/53/356607753.db2.gz STUWPBYGBDASFD-NSHDSACASA-N 1 2 249.358 2.140 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)N(C)c1ccc[nH+]c1N(C)C ZINC000450120996 202082115 /nfs/dbraw/zinc/08/21/15/202082115.db2.gz SYWNKKQMPGDZJT-GHMZBOCLSA-N 1 2 247.342 2.157 20 0 BEADLO CC[C@@H](NC(=O)[C@H]1CCC1(C)C)c1[nH]cc[nH+]1 ZINC000613579213 363521632 /nfs/dbraw/zinc/52/16/32/363521632.db2.gz JCFARSKFPOPGQC-NXEZZACHSA-N 1 2 235.331 2.413 20 0 BEADLO C(c1noc(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)n1)C1CC1 ZINC000639749623 356644301 /nfs/dbraw/zinc/64/43/01/356644301.db2.gz IVLOZCLMTCKHLU-RYUDHWBXSA-N 1 2 247.342 2.397 20 0 BEADLO C(c1noc(C[N@H+]2C[C@@H]3CCCC[C@@H]32)n1)C1CC1 ZINC000639749623 356644304 /nfs/dbraw/zinc/64/43/04/356644304.db2.gz IVLOZCLMTCKHLU-RYUDHWBXSA-N 1 2 247.342 2.397 20 0 BEADLO CC(C)[C@H](Nc1cc(CO)cc[nH+]1)C1CC1 ZINC000630095067 363544767 /nfs/dbraw/zinc/54/47/67/363544767.db2.gz QTGIUYPRHYAVEU-ZDUSSCGKSA-N 1 2 220.316 2.420 20 0 BEADLO C[C@@H](c1csnn1)[N@H+](C)C[C@H]1CCCCO1 ZINC000450286142 202118078 /nfs/dbraw/zinc/11/80/78/202118078.db2.gz NGPPUBYXWVFDOU-VHSXEESVSA-N 1 2 241.360 2.100 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+](C)C[C@H]1CCCCO1 ZINC000450286142 202118081 /nfs/dbraw/zinc/11/80/81/202118081.db2.gz NGPPUBYXWVFDOU-VHSXEESVSA-N 1 2 241.360 2.100 20 0 BEADLO C[C@@H](c1noc(C[NH+](C)C)n1)C(C)(C)C ZINC000350641847 366312697 /nfs/dbraw/zinc/31/26/97/366312697.db2.gz CAKSGYIPIYLPHF-QMMMGPOBSA-N 1 2 211.309 2.281 20 0 BEADLO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1csnn1 ZINC000179799277 366309046 /nfs/dbraw/zinc/30/90/46/366309046.db2.gz HIDDLOUPRMNOSJ-DTWKUNHWSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1csnn1 ZINC000179799277 366309050 /nfs/dbraw/zinc/30/90/50/366309050.db2.gz HIDDLOUPRMNOSJ-DTWKUNHWSA-N 1 2 211.334 2.159 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NCc1ccoc1 ZINC000179866998 366325757 /nfs/dbraw/zinc/32/57/57/366325757.db2.gz VBDKJYMLVDOVFO-UHFFFAOYSA-N 1 2 231.255 2.305 20 0 BEADLO C[C@@H](Cc1noc(C[NH+](C)C)n1)c1ccccc1 ZINC000350646325 366316042 /nfs/dbraw/zinc/31/60/42/366316042.db2.gz NZYQVDJAWPCOOZ-NSHDSACASA-N 1 2 245.326 2.477 20 0 BEADLO COC(=O)[C@H]([NH2+]CC1=CCCCC1)C(C)C ZINC000583674743 356680651 /nfs/dbraw/zinc/68/06/51/356680651.db2.gz GTKGZGLXHPZRAT-GFCCVEGCSA-N 1 2 225.332 2.274 20 0 BEADLO c1c[nH]c(SCc2c[nH+]c3ccccn23)n1 ZINC000179891856 366330929 /nfs/dbraw/zinc/33/09/29/366330929.db2.gz DMFVTDAMXFHLMH-UHFFFAOYSA-N 1 2 230.296 2.350 20 0 BEADLO C[C@@H](SCc1c[nH+]c2ccccn12)[C@H](C)O ZINC000179900486 366330966 /nfs/dbraw/zinc/33/09/66/366330966.db2.gz NEMWJGAPOHJEOR-VHSXEESVSA-N 1 2 236.340 2.337 20 0 BEADLO Cc1nn(C)cc1[C@H](C)[NH2+][C@H](C)C(C)(F)F ZINC000389494198 356694600 /nfs/dbraw/zinc/69/46/00/356694600.db2.gz WODFLWPUHXDPLG-IONNQARKSA-N 1 2 231.290 2.423 20 0 BEADLO C=Cn1cc(C[NH2+][C@@H](C)C(C)(F)F)cn1 ZINC000389473574 356680995 /nfs/dbraw/zinc/68/09/95/356680995.db2.gz VQSSGKSRMYKCMZ-QMMMGPOBSA-N 1 2 215.247 2.117 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)C(C)(F)F)c1cnn(C)c1 ZINC000389474250 356681910 /nfs/dbraw/zinc/68/19/10/356681910.db2.gz WPCSBFKLLLVUPC-SFYZADRCSA-N 1 2 217.263 2.114 20 0 BEADLO CCN(C(=O)C[NH+]1CC(C)(C)C1)c1ccccc1 ZINC000582250539 356682924 /nfs/dbraw/zinc/68/29/24/356682924.db2.gz UZZIDPFUCDQQSH-UHFFFAOYSA-N 1 2 246.354 2.381 20 0 BEADLO CCn1nccc1C[NH2+][C@@H](C)C(C)(F)F ZINC000389471621 356683892 /nfs/dbraw/zinc/68/38/92/356683892.db2.gz RTRNNXVXQSUASU-QMMMGPOBSA-N 1 2 217.263 2.036 20 0 BEADLO CC(C)OCCC[N@H+](C)[C@@H](C)c1csnn1 ZINC000450426633 202162885 /nfs/dbraw/zinc/16/28/85/202162885.db2.gz CPDGWIFMFLQZQN-JTQLQIEISA-N 1 2 243.376 2.346 20 0 BEADLO CC(C)OCCC[N@@H+](C)[C@@H](C)c1csnn1 ZINC000450426633 202162889 /nfs/dbraw/zinc/16/28/89/202162889.db2.gz CPDGWIFMFLQZQN-JTQLQIEISA-N 1 2 243.376 2.346 20 0 BEADLO Fc1ccc(COCc2[nH]cc[nH+]2)cc1F ZINC000180043185 366363308 /nfs/dbraw/zinc/36/33/08/366363308.db2.gz FJCIDKFWTMMJHQ-UHFFFAOYSA-N 1 2 224.210 2.405 20 0 BEADLO COc1cc[nH+]c(CN(C)Cc2ccns2)c1 ZINC000639787696 356740264 /nfs/dbraw/zinc/74/02/64/356740264.db2.gz PRMFAGURKZRERK-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC[C@@H]2c2cn[nH]c2)o1 ZINC000639775929 356717308 /nfs/dbraw/zinc/71/73/08/356717308.db2.gz HVEKAZQBMTXQMQ-LLVKDONJSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1cnc(C[N@H+]2CCC[C@@H]2c2cn[nH]c2)o1 ZINC000639775929 356717311 /nfs/dbraw/zinc/71/73/11/356717311.db2.gz HVEKAZQBMTXQMQ-LLVKDONJSA-N 1 2 232.287 2.043 20 0 BEADLO CCCCCNC(=O)[C@H]1CCn2cc(C)[nH+]c2C1 ZINC000623346023 356753139 /nfs/dbraw/zinc/75/31/39/356753139.db2.gz BBOJHUFRACTYPX-LBPRGKRZSA-N 1 2 249.358 2.060 20 0 BEADLO CC[C@]1(Nc2cc[nH+]c(C3CC3)n2)CCOC1 ZINC000672276088 538641771 /nfs/dbraw/zinc/64/17/71/538641771.db2.gz QBJGJTZRHSCHJC-ZDUSSCGKSA-N 1 2 233.315 2.335 20 0 BEADLO C[N@H+](CC/C=C\c1ccccc1)Cc1nnc[nH]1 ZINC000450478788 202179271 /nfs/dbraw/zinc/17/92/71/202179271.db2.gz JBTIIPGQTVKQMQ-UITAMQMPSA-N 1 2 242.326 2.340 20 0 BEADLO C[N@@H+](CC/C=C\c1ccccc1)Cc1nnc[nH]1 ZINC000450478788 202179273 /nfs/dbraw/zinc/17/92/73/202179273.db2.gz JBTIIPGQTVKQMQ-UITAMQMPSA-N 1 2 242.326 2.340 20 0 BEADLO CO[C@@H]1C[N@H+](CCCCC(F)(F)F)CCO1 ZINC000639832890 356816229 /nfs/dbraw/zinc/81/62/29/356816229.db2.gz DWBSENWVHVAHCK-VIFPVBQESA-N 1 2 241.253 2.024 20 0 BEADLO CO[C@@H]1C[N@@H+](CCCCC(F)(F)F)CCO1 ZINC000639832890 356816234 /nfs/dbraw/zinc/81/62/34/356816234.db2.gz DWBSENWVHVAHCK-VIFPVBQESA-N 1 2 241.253 2.024 20 0 BEADLO CC(C)C[C@H]1CCC[N@H+](Cc2cnn[nH]2)C1 ZINC000450484846 202181769 /nfs/dbraw/zinc/18/17/69/202181769.db2.gz NHGGRRKVOBIYDF-LLVKDONJSA-N 1 2 222.336 2.063 20 0 BEADLO CC(C)C[C@H]1CCC[N@@H+](Cc2cnn[nH]2)C1 ZINC000450484846 202181773 /nfs/dbraw/zinc/18/17/73/202181773.db2.gz NHGGRRKVOBIYDF-LLVKDONJSA-N 1 2 222.336 2.063 20 0 BEADLO CC(C)C[C@H]1CCC[N@H+](Cc2cn[nH]n2)C1 ZINC000450484846 202181775 /nfs/dbraw/zinc/18/17/75/202181775.db2.gz NHGGRRKVOBIYDF-LLVKDONJSA-N 1 2 222.336 2.063 20 0 BEADLO CC(C)C[C@H]1CCC[N@@H+](Cc2cn[nH]n2)C1 ZINC000450484846 202181779 /nfs/dbraw/zinc/18/17/79/202181779.db2.gz NHGGRRKVOBIYDF-LLVKDONJSA-N 1 2 222.336 2.063 20 0 BEADLO CC[C@@H]1CCCC[C@@H]1C(=O)NCCc1[nH]cc[nH+]1 ZINC000355985352 356783858 /nfs/dbraw/zinc/78/38/58/356783858.db2.gz KPBCSAYBCCKGMS-NEPJUHHUSA-N 1 2 249.358 2.285 20 0 BEADLO Cc1cc[nH+]c(NCC[C@H](C)CCO)c1Cl ZINC000450559122 202197477 /nfs/dbraw/zinc/19/74/77/202197477.db2.gz GBZCRJWCSMJREL-VIFPVBQESA-N 1 2 242.750 2.286 20 0 BEADLO CC[N@@H+](Cc1nnc(C(C)C)o1)C[C@@H](C)OC ZINC000361568421 356933338 /nfs/dbraw/zinc/93/33/38/356933338.db2.gz ZAQLLFFRUJAZDU-SNVBAGLBSA-N 1 2 241.335 2.050 20 0 BEADLO CC[N@H+](Cc1nnc(C(C)C)o1)C[C@@H](C)OC ZINC000361568421 356933343 /nfs/dbraw/zinc/93/33/43/356933343.db2.gz ZAQLLFFRUJAZDU-SNVBAGLBSA-N 1 2 241.335 2.050 20 0 BEADLO CCC[C@H](CNc1cc[nH+]c(C(C)C)n1)OC ZINC000450581091 202203805 /nfs/dbraw/zinc/20/38/05/202203805.db2.gz HKMMJRODJMUNCA-LLVKDONJSA-N 1 2 237.347 2.249 20 0 BEADLO C[C@@H](c1csnn1)[N@H+](C)CCC1CC1 ZINC000450600470 202209480 /nfs/dbraw/zinc/20/94/80/202209480.db2.gz NUCHUVPYAZPQJN-QMMMGPOBSA-N 1 2 211.334 2.331 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+](C)CCC1CC1 ZINC000450600470 202209484 /nfs/dbraw/zinc/20/94/84/202209484.db2.gz NUCHUVPYAZPQJN-QMMMGPOBSA-N 1 2 211.334 2.331 20 0 BEADLO O=C(C[NH+]1Cc2ccccc2C1)N1CCCCC1 ZINC000001421442 356953548 /nfs/dbraw/zinc/95/35/48/356953548.db2.gz AZDLGKKIDAOGOM-UHFFFAOYSA-N 1 2 244.338 2.015 20 0 BEADLO CC1(C)CN(c2cc3ccccc3c[nH+]2)C[C@H]1O ZINC000631255508 357010383 /nfs/dbraw/zinc/01/03/83/357010383.db2.gz REJLTUQQOSABRJ-CYBMUJFWSA-N 1 2 242.322 2.442 20 0 BEADLO Fc1ccc(CNc2c[nH]c[nH+]2)c(F)c1 ZINC000389952916 357072338 /nfs/dbraw/zinc/07/23/38/357072338.db2.gz SSAWILDHUVJBDV-UHFFFAOYSA-N 1 2 209.199 2.300 20 0 BEADLO C[C@H]([NH2+]Cc1cc[nH]n1)c1ccc(Cl)cn1 ZINC000390413498 357092280 /nfs/dbraw/zinc/09/22/80/357092280.db2.gz GBNKVMZOECSFED-QMMMGPOBSA-N 1 2 236.706 2.309 20 0 BEADLO CCN(Cc1c[nH+]cn1C)c1cccc(O)c1 ZINC000355670271 538797730 /nfs/dbraw/zinc/79/77/30/538797730.db2.gz JPTDVWRIBRJSPL-UHFFFAOYSA-N 1 2 231.299 2.152 20 0 BEADLO CC[C@@H](C(=O)OC)[N@H+](C)Cc1cccs1 ZINC000041392544 357129073 /nfs/dbraw/zinc/12/90/73/357129073.db2.gz CTNNUUWJHRPBFV-JTQLQIEISA-N 1 2 227.329 2.132 20 0 BEADLO CC[C@@H](C(=O)OC)[N@@H+](C)Cc1cccs1 ZINC000041392544 357129077 /nfs/dbraw/zinc/12/90/77/357129077.db2.gz CTNNUUWJHRPBFV-JTQLQIEISA-N 1 2 227.329 2.132 20 0 BEADLO Cn1ccc(C[N@@H+]2Cc3ccc(O)cc3C2)c1 ZINC000628419116 357239827 /nfs/dbraw/zinc/23/98/27/357239827.db2.gz MQXCZVTWHMVZQC-UHFFFAOYSA-N 1 2 228.295 2.247 20 0 BEADLO Cn1ccc(C[N@H+]2Cc3ccc(O)cc3C2)c1 ZINC000628419116 357239829 /nfs/dbraw/zinc/23/98/29/357239829.db2.gz MQXCZVTWHMVZQC-UHFFFAOYSA-N 1 2 228.295 2.247 20 0 BEADLO CCC1(C(=O)NCc2c[nH+]cn2C)CCCCC1 ZINC000356752544 538815095 /nfs/dbraw/zinc/81/50/95/538815095.db2.gz CCDKMZNAUMMFBJ-UHFFFAOYSA-N 1 2 249.358 2.397 20 0 BEADLO C(c1nc(C2CCC2)no1)[NH+](C1CC1)C1CC1 ZINC000639893401 357227295 /nfs/dbraw/zinc/22/72/95/357227295.db2.gz RCDARMCEMKMUCY-UHFFFAOYSA-N 1 2 233.315 2.464 20 0 BEADLO Cc1cc(F)ccc1C[NH+]1CC2(C1)CCCO2 ZINC000628426663 357254904 /nfs/dbraw/zinc/25/49/04/357254904.db2.gz DYPUDLWANBTYOI-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1ccc(F)c(C[NH+]2CC3(C2)CCCO3)c1 ZINC000628427096 357255674 /nfs/dbraw/zinc/25/56/74/357255674.db2.gz FUFHDCJTXMKKPW-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1ccc(C[NH+]2CC3(C2)CCCO3)cc1F ZINC000628427255 357257215 /nfs/dbraw/zinc/25/72/15/357257215.db2.gz POOKDYMEAGWBLA-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO COc1ccc(C)cc1C[NH+]1CC2(C1)CCCO2 ZINC000628426910 357257786 /nfs/dbraw/zinc/25/77/86/357257786.db2.gz UHBDYOMOCQWSDQ-UHFFFAOYSA-N 1 2 247.338 2.368 20 0 BEADLO Cc1cc(C[NH+]2CC3(C2)CCCO3)cc(C)c1O ZINC000628427566 357258373 /nfs/dbraw/zinc/25/83/73/357258373.db2.gz KKZOBMLBIJNRJY-UHFFFAOYSA-N 1 2 247.338 2.374 20 0 BEADLO Cc1cc(C[NH+]2CC3(C2)CCCO3)cs1 ZINC000628427584 357258385 /nfs/dbraw/zinc/25/83/85/357258385.db2.gz LOKAGMNFZVEZRD-UHFFFAOYSA-N 1 2 223.341 2.421 20 0 BEADLO CN(C(=O)CCc1c[nH+]c[nH]1)[C@@H]1CCC(C)(C)C1 ZINC000357675466 538831647 /nfs/dbraw/zinc/83/16/47/538831647.db2.gz NCGADMHDWLCSGF-GFCCVEGCSA-N 1 2 249.358 2.379 20 0 BEADLO CN(C(=O)CCc1c[nH]c[nH+]1)[C@@H]1CCC(C)(C)C1 ZINC000357675466 538831655 /nfs/dbraw/zinc/83/16/55/538831655.db2.gz NCGADMHDWLCSGF-GFCCVEGCSA-N 1 2 249.358 2.379 20 0 BEADLO CC(C)[C@]1(C)C[C@H]1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000582735419 357376623 /nfs/dbraw/zinc/37/66/23/357376623.db2.gz GZYYUNMQETUXFN-NRUUGDAUSA-N 1 2 235.331 2.269 20 0 BEADLO Cc1ccc(NC(=O)C[C@@H](C)n2cc[nH+]c2)cn1 ZINC000582907998 357433378 /nfs/dbraw/zinc/43/33/78/357433378.db2.gz QEDKILIYGLXCOW-LLVKDONJSA-N 1 2 244.298 2.176 20 0 BEADLO CCC[C@@H](C)[C@H]1CCCN1C(=O)Cn1cc[nH+]c1 ZINC000582937993 357440346 /nfs/dbraw/zinc/44/03/46/357440346.db2.gz YOQURHRSOBDMCX-CHWSQXEVSA-N 1 2 249.358 2.310 20 0 BEADLO c1c[nH]c([C@@H]([NH2+][C@H]2CC23CC3)c2cccnc2)n1 ZINC000583019210 357450286 /nfs/dbraw/zinc/45/02/86/357450286.db2.gz XHSFBSPYGPWQTC-RYUDHWBXSA-N 1 2 240.310 2.036 20 0 BEADLO C[C@H](CC(=O)NC[C@@H]1CC=CCC1)n1cc[nH+]c1 ZINC000583028202 357463152 /nfs/dbraw/zinc/46/31/52/357463152.db2.gz KIWBJESBMUZRBX-CHWSQXEVSA-N 1 2 247.342 2.307 20 0 BEADLO C[C@@H]([NH2+][C@H]1CSC[C@@H]1C)C(=O)OC(C)(C)C ZINC000381557503 357470030 /nfs/dbraw/zinc/47/00/30/357470030.db2.gz PSOZXBFVFMZCNU-AEJSXWLSSA-N 1 2 245.388 2.058 20 0 BEADLO O=C(CCCn1cc[nH+]c1)N1CCC2(CCC2)C1 ZINC000158106269 538850178 /nfs/dbraw/zinc/85/01/78/538850178.db2.gz NFCSVOHTNHNFIK-UHFFFAOYSA-N 1 2 247.342 2.066 20 0 BEADLO Cc1coc(SCCCn2cc[nH+]c2)n1 ZINC000188443643 357554750 /nfs/dbraw/zinc/55/47/50/357554750.db2.gz QPAGIPVNLMNRRC-UHFFFAOYSA-N 1 2 223.301 2.362 20 0 BEADLO OCC(F)(F)C[NH2+][C@@H]1CCc2c1cccc2F ZINC000231792551 357630218 /nfs/dbraw/zinc/63/02/18/357630218.db2.gz IUUWLGWXGGBZBA-LLVKDONJSA-N 1 2 245.244 2.030 20 0 BEADLO CCn1nc(C)c(C[N@H+](C)Cc2ccno2)c1C ZINC000639920853 357650798 /nfs/dbraw/zinc/65/07/98/357650798.db2.gz QEBCWJGUTCIIQD-UHFFFAOYSA-N 1 2 248.330 2.140 20 0 BEADLO CCn1nc(C)c(C[N@@H+](C)Cc2ccno2)c1C ZINC000639920853 357650802 /nfs/dbraw/zinc/65/08/02/357650802.db2.gz QEBCWJGUTCIIQD-UHFFFAOYSA-N 1 2 248.330 2.140 20 0 BEADLO C[C@@H]1C[C@@H](Nc2nc[nH+]c(N)c2Cl)CS1 ZINC000397998561 357821534 /nfs/dbraw/zinc/82/15/34/357821534.db2.gz RKYNSLDUQJKVFL-PHDIDXHHSA-N 1 2 244.751 2.018 20 0 BEADLO C[C@@H]1C[C@@H](Nc2[nH+]cnc(N)c2Cl)CS1 ZINC000397998561 357821536 /nfs/dbraw/zinc/82/15/36/357821536.db2.gz RKYNSLDUQJKVFL-PHDIDXHHSA-N 1 2 244.751 2.018 20 0 BEADLO COCCNc1[nH+]ccc2c(OC)cccc21 ZINC000234695361 357822227 /nfs/dbraw/zinc/82/22/27/357822227.db2.gz NOEVHHNOMHSSIX-UHFFFAOYSA-N 1 2 232.283 2.302 20 0 BEADLO CCN(C)c1ccc(CNc2ccon2)c[nH+]1 ZINC000191518208 357782944 /nfs/dbraw/zinc/78/29/44/357782944.db2.gz VQKYYNDKJFMJJF-UHFFFAOYSA-N 1 2 232.287 2.138 20 0 BEADLO CCN(C)c1ccc(CNc2nocc2C)c[nH+]1 ZINC000191560001 357785455 /nfs/dbraw/zinc/78/54/55/357785455.db2.gz JJKFAYHOLSCPGE-UHFFFAOYSA-N 1 2 246.314 2.446 20 0 BEADLO COc1cccc2c1cc[nH+]c2N(C)[C@@H](C)CO ZINC000234905487 357836834 /nfs/dbraw/zinc/83/68/34/357836834.db2.gz FZUNNCGZQLYTOD-JTQLQIEISA-N 1 2 246.310 2.060 20 0 BEADLO COc1cccc2c1cc[nH+]c2NCCCCO ZINC000234910237 357836867 /nfs/dbraw/zinc/83/68/67/357836867.db2.gz IBECSQVMQIXGLK-UHFFFAOYSA-N 1 2 246.310 2.428 20 0 BEADLO CC(=O)C[N@@H+]1CC(C)(C)[C@H]1c1ccco1 ZINC000639929055 357880373 /nfs/dbraw/zinc/88/03/73/357880373.db2.gz KMJKWMBEDAFBHT-LLVKDONJSA-N 1 2 207.273 2.252 20 0 BEADLO CC(=O)C[N@H+]1CC(C)(C)[C@H]1c1ccco1 ZINC000639929055 357880376 /nfs/dbraw/zinc/88/03/76/357880376.db2.gz KMJKWMBEDAFBHT-LLVKDONJSA-N 1 2 207.273 2.252 20 0 BEADLO CC1(O)C[NH+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000089647386 491116991 /nfs/dbraw/zinc/11/69/91/491116991.db2.gz WBPPCFSWVUPTQP-UHFFFAOYSA-N 1 2 245.244 2.272 20 0 BEADLO CC(C)C1(NC(=O)[C@@H]2CCCc3[nH+]c[nH]c32)CC1 ZINC000584429519 357920271 /nfs/dbraw/zinc/92/02/71/357920271.db2.gz GJECITQVAXAKPK-SNVBAGLBSA-N 1 2 247.342 2.134 20 0 BEADLO CC(C)C1(NC(=O)[C@@H]2CCCc3[nH]c[nH+]c32)CC1 ZINC000584429519 357920275 /nfs/dbraw/zinc/92/02/75/357920275.db2.gz GJECITQVAXAKPK-SNVBAGLBSA-N 1 2 247.342 2.134 20 0 BEADLO CC[C@]1(C)CCCN(C(=O)Cc2c[nH+]cn2C)C1 ZINC000583771602 357940491 /nfs/dbraw/zinc/94/04/91/357940491.db2.gz HDZAJQDHJPSLNR-CQSZACIVSA-N 1 2 249.358 2.001 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)C[C@H]1CCC(C)(C)O1 ZINC000639970176 358022803 /nfs/dbraw/zinc/02/28/03/358022803.db2.gz DIOOSEJFLXFRGX-GFCCVEGCSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)C[C@H]1CCC(C)(C)O1 ZINC000639970176 358022805 /nfs/dbraw/zinc/02/28/05/358022805.db2.gz DIOOSEJFLXFRGX-GFCCVEGCSA-N 1 2 237.347 2.108 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)CCC1CCC1 ZINC000639971976 358031128 /nfs/dbraw/zinc/03/11/28/358031128.db2.gz LPRYMNXJQNEIRE-UHFFFAOYSA-N 1 2 207.321 2.340 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)CCC1CCC1 ZINC000639971976 358031130 /nfs/dbraw/zinc/03/11/30/358031130.db2.gz LPRYMNXJQNEIRE-UHFFFAOYSA-N 1 2 207.321 2.340 20 0 BEADLO Cc1ncc([C@H](C)[NH2+]CC(F)F)s1 ZINC000639995104 358033900 /nfs/dbraw/zinc/03/39/00/358033900.db2.gz QZPMOHSLGUAVKK-YFKPBYRVSA-N 1 2 206.261 2.367 20 0 BEADLO Cc1nc([C@H](C)[NH+]2C3CCC2CC3)no1 ZINC000584688661 358152192 /nfs/dbraw/zinc/15/21/92/358152192.db2.gz ATWORTUQCFMJAQ-WFRXLMHJSA-N 1 2 207.277 2.066 20 0 BEADLO CCCc1noc(C[NH+]2CCC(C)(F)CC2)n1 ZINC000640070227 358156064 /nfs/dbraw/zinc/15/60/64/358156064.db2.gz ZAUKQFQCSYBSMA-UHFFFAOYSA-N 1 2 241.310 2.346 20 0 BEADLO Cc1cnc(C[NH+]2CCC(C)(F)CC2)nc1 ZINC000640071464 358162035 /nfs/dbraw/zinc/16/20/35/358162035.db2.gz NWMKSNGJVKKJCX-UHFFFAOYSA-N 1 2 223.295 2.109 20 0 BEADLO CC(C)c1nnc(C[NH+]2CCC(C)(F)CC2)[nH]1 ZINC000640071682 358162643 /nfs/dbraw/zinc/16/26/43/358162643.db2.gz QOYPQEGXRALGPH-UHFFFAOYSA-N 1 2 240.326 2.252 20 0 BEADLO O[C@H]1C[C@@H](COc2ccccc2-n2cc[nH+]c2)C1 ZINC000584773712 358174809 /nfs/dbraw/zinc/17/48/09/358174809.db2.gz DRYUYOWZSDMKJV-TXEJJXNPSA-N 1 2 244.294 2.022 20 0 BEADLO CCc1nc(C[N@@H+]2CCOC[C@@H](C)C2)cs1 ZINC000335905038 491123602 /nfs/dbraw/zinc/12/36/02/491123602.db2.gz WMHQBQMKUJUQHB-JTQLQIEISA-N 1 2 240.372 2.174 20 0 BEADLO CCc1nc(C[N@H+]2CCOC[C@@H](C)C2)cs1 ZINC000335905038 491123603 /nfs/dbraw/zinc/12/36/03/491123603.db2.gz WMHQBQMKUJUQHB-JTQLQIEISA-N 1 2 240.372 2.174 20 0 BEADLO CCC1(Nc2nc(N(C)C)nc(C(C)C)[nH+]2)CC1 ZINC000450640260 202219763 /nfs/dbraw/zinc/21/97/63/202219763.db2.gz GJZCXQHWOFVJII-UHFFFAOYSA-N 1 2 249.362 2.416 20 0 BEADLO CCC1(Nc2nc(C(C)C)[nH+]c(N(C)C)n2)CC1 ZINC000450640260 202219764 /nfs/dbraw/zinc/21/97/64/202219764.db2.gz GJZCXQHWOFVJII-UHFFFAOYSA-N 1 2 249.362 2.416 20 0 BEADLO C[C@@H](CC(=O)N1CC[C@@H](C)[C@@H]1C)n1cc[nH+]c1 ZINC000584842646 358199858 /nfs/dbraw/zinc/19/98/58/358199858.db2.gz BKFHGWOMZFEMQP-WOPDTQHZSA-N 1 2 235.331 2.091 20 0 BEADLO CC[C@](C)([NH2+]CC1=CCCCC1)C(=O)OC ZINC000450657306 202228282 /nfs/dbraw/zinc/22/82/82/202228282.db2.gz LFGITNDELDZZBU-ZDUSSCGKSA-N 1 2 225.332 2.418 20 0 BEADLO O[C@@H]1CCC[C@H]1[C@H]1CCCN1c1cccc[nH+]1 ZINC000450706324 202240116 /nfs/dbraw/zinc/24/01/16/202240116.db2.gz OPKAWDNQBBSHKO-YNEHKIRRSA-N 1 2 232.327 2.211 20 0 BEADLO Cc1nc(NC[C@@H]2CCO[C@H](C(C)C)C2)cc[nH+]1 ZINC000450733835 202248381 /nfs/dbraw/zinc/24/83/81/202248381.db2.gz ANLFJWBCXMLOMR-OLZOCXBDSA-N 1 2 249.358 2.070 20 0 BEADLO Cc1nc(NC[C@H]2CCO[C@@H](C(C)C)C2)cc[nH+]1 ZINC000450733836 202248837 /nfs/dbraw/zinc/24/88/37/202248837.db2.gz ANLFJWBCXMLOMR-QWHCGFSZSA-N 1 2 249.358 2.070 20 0 BEADLO COc1ccnc(C[NH2+][C@H](C)c2ccc(C)o2)n1 ZINC000450727000 202246963 /nfs/dbraw/zinc/24/69/63/202246963.db2.gz XALLCSLIGZSBTI-SNVBAGLBSA-N 1 2 247.298 2.237 20 0 BEADLO CCOC1CC(Nc2[nH+]cccc2OC)C1 ZINC000225869719 358313332 /nfs/dbraw/zinc/31/33/32/358313332.db2.gz LPYFLSKBICHJFN-UHFFFAOYSA-N 1 2 222.288 2.070 20 0 BEADLO Cc1cc([NH2+]CC(C)(C)C)ccc1-n1cnnn1 ZINC000041120616 358301355 /nfs/dbraw/zinc/30/13/55/358301355.db2.gz CEMALCMIRPDTSY-UHFFFAOYSA-N 1 2 245.330 2.429 20 0 BEADLO COC(=O)[C@@H]([NH2+]C/C=C/c1ccccc1)C(C)C ZINC000043442147 358375219 /nfs/dbraw/zinc/37/52/19/358375219.db2.gz WZVAHTHYFHJSIE-RNVIBTMRSA-N 1 2 247.338 2.487 20 0 BEADLO CCc1cnc(C[NH2+][C@@H](C)c2cccnc2)o1 ZINC000228568837 358378546 /nfs/dbraw/zinc/37/85/46/358378546.db2.gz MGIGBPYUGDQKAB-JTQLQIEISA-N 1 2 231.299 2.483 20 0 BEADLO CCC[C@H](OC)c1noc(C[N@H+](C)CCC)n1 ZINC000351132681 366422879 /nfs/dbraw/zinc/42/28/79/366422879.db2.gz KRMHFTHTTOMZPB-JTQLQIEISA-N 1 2 241.335 2.399 20 0 BEADLO CCC[C@H](OC)c1noc(C[N@@H+](C)CCC)n1 ZINC000351132681 366422884 /nfs/dbraw/zinc/42/28/84/366422884.db2.gz KRMHFTHTTOMZPB-JTQLQIEISA-N 1 2 241.335 2.399 20 0 BEADLO OC1(C[NH2+]CC(F)(F)c2ccccc2)CCC1 ZINC000227904473 358365978 /nfs/dbraw/zinc/36/59/78/358365978.db2.gz DWBPKWGLSNLNRP-UHFFFAOYSA-N 1 2 241.281 2.283 20 0 BEADLO CC[C@@H](OC)c1nc(Cc2ccc[nH+]c2C)no1 ZINC000351236251 366456965 /nfs/dbraw/zinc/45/69/65/366456965.db2.gz PJHBIPATJKNPEO-LLVKDONJSA-N 1 2 247.298 2.461 20 0 BEADLO CCC[C@@H]1CCCN(C(=O)Cc2c[nH+]cn2C)C1 ZINC000580416364 358516141 /nfs/dbraw/zinc/51/61/41/358516141.db2.gz HDGAVNJTYWYHRP-GFCCVEGCSA-N 1 2 249.358 2.001 20 0 BEADLO COC(=O)[C@H](C)[NH2+]CCc1ccc(Cl)cc1 ZINC000043627692 358541140 /nfs/dbraw/zinc/54/11/40/358541140.db2.gz TYJGEFSRPLCLCF-VIFPVBQESA-N 1 2 241.718 2.034 20 0 BEADLO CC(=O)Cc1ccc(OCc2c[nH+]cn2C)cc1 ZINC000130792870 358644591 /nfs/dbraw/zinc/64/45/91/358644591.db2.gz ACGGARRJUGCSED-UHFFFAOYSA-N 1 2 244.294 2.131 20 0 BEADLO CC[C@@H](NC(=O)c1coc(C)c1)c1[nH]cc[nH+]1 ZINC000130669778 358639496 /nfs/dbraw/zinc/63/94/96/358639496.db2.gz HOOVYZNXTSRXGT-SNVBAGLBSA-N 1 2 233.271 2.192 20 0 BEADLO Cc1cc(NCc2ccn(C)n2)nc(C(C)C)[nH+]1 ZINC000212310858 358590631 /nfs/dbraw/zinc/59/06/31/358590631.db2.gz GTOAOOXZVYUQHZ-UHFFFAOYSA-N 1 2 245.330 2.254 20 0 BEADLO CCC[N@H+](CC(F)F)C[C@H]1CCCO1 ZINC000133323136 358751014 /nfs/dbraw/zinc/75/10/14/358751014.db2.gz YJAYCXJXJYTGFH-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO CCC[N@@H+](CC(F)F)C[C@H]1CCCO1 ZINC000133323136 358751018 /nfs/dbraw/zinc/75/10/18/358751018.db2.gz YJAYCXJXJYTGFH-SECBINFHSA-N 1 2 207.264 2.143 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H]1CCC[C@@H]1c1ccccc1 ZINC000133765771 358766710 /nfs/dbraw/zinc/76/67/10/358766710.db2.gz TXFCNABDHJUTLC-IACUBPJLSA-N 1 2 247.338 2.474 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1nncn1C)c1ccsc1 ZINC000050341748 358725018 /nfs/dbraw/zinc/72/50/18/358725018.db2.gz DDUIHKREWQQAOS-RKDXNWHRSA-N 1 2 236.344 2.288 20 0 BEADLO O=C(Nc1ccsc1)[C@@H]1CCn2c[nH+]cc2C1 ZINC000132600019 358728239 /nfs/dbraw/zinc/72/82/39/358728239.db2.gz RGDHKKPFYGSMKG-SECBINFHSA-N 1 2 247.323 2.146 20 0 BEADLO CCNc1ccc([NH+]2CCCCC2)cc1C(N)=O ZINC000132973073 358741433 /nfs/dbraw/zinc/74/14/33/358741433.db2.gz ULLUQGTZFFYHEN-UHFFFAOYSA-N 1 2 247.342 2.208 20 0 BEADLO CC(C)[N@H+](CC(F)F)C[C@H]1CCCO1 ZINC000135383462 358831038 /nfs/dbraw/zinc/83/10/38/358831038.db2.gz YWDQVAVTNNNRBZ-SECBINFHSA-N 1 2 207.264 2.141 20 0 BEADLO CC(C)[N@@H+](CC(F)F)C[C@H]1CCCO1 ZINC000135383462 358831043 /nfs/dbraw/zinc/83/10/43/358831043.db2.gz YWDQVAVTNNNRBZ-SECBINFHSA-N 1 2 207.264 2.141 20 0 BEADLO C[C@]1(C2CCCCC2)CC[N@@H+]1CCc1cnn[nH]1 ZINC000640220832 358889962 /nfs/dbraw/zinc/88/99/62/358889962.db2.gz YOIXWZSTVHZVER-CQSZACIVSA-N 1 2 248.374 2.392 20 0 BEADLO C[C@]1(C2CCCCC2)CC[N@H+]1CCc1cnn[nH]1 ZINC000640220832 358889966 /nfs/dbraw/zinc/88/99/66/358889966.db2.gz YOIXWZSTVHZVER-CQSZACIVSA-N 1 2 248.374 2.392 20 0 BEADLO CCCCOCC[N@H+](C)Cc1cc(C)on1 ZINC000056493247 358898162 /nfs/dbraw/zinc/89/81/62/358898162.db2.gz YSEATGUEKNOCIO-UHFFFAOYSA-N 1 2 226.320 2.232 20 0 BEADLO CCCCOCC[N@@H+](C)Cc1cc(C)on1 ZINC000056493247 358898164 /nfs/dbraw/zinc/89/81/64/358898164.db2.gz YSEATGUEKNOCIO-UHFFFAOYSA-N 1 2 226.320 2.232 20 0 BEADLO CCC(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000060868455 358930022 /nfs/dbraw/zinc/93/00/22/358930022.db2.gz XPSABAPTAFZIRP-UHFFFAOYSA-N 1 2 215.256 2.221 20 0 BEADLO CC(C)c1noc(C[C@@H](C)n2cc[nH+]c2)n1 ZINC000351405952 366523421 /nfs/dbraw/zinc/52/34/21/366523421.db2.gz NUGZKOWFNOYQDW-SECBINFHSA-N 1 2 220.276 2.193 20 0 BEADLO COc1cc[nH+]c(CN2OC3CCC2CC3)c1 ZINC000640228474 358939591 /nfs/dbraw/zinc/93/95/91/358939591.db2.gz GSTRVAFLOSNPNB-UHFFFAOYSA-N 1 2 234.299 2.149 20 0 BEADLO C[N@H+](Cc1ncccc1Br)C1CC1 ZINC000306168593 358977337 /nfs/dbraw/zinc/97/73/37/358977337.db2.gz XWOSCFOGUIGUTL-UHFFFAOYSA-N 1 2 241.132 2.438 20 0 BEADLO C[N@@H+](Cc1ncccc1Br)C1CC1 ZINC000306168593 358977338 /nfs/dbraw/zinc/97/73/38/358977338.db2.gz XWOSCFOGUIGUTL-UHFFFAOYSA-N 1 2 241.132 2.438 20 0 BEADLO C[C@@H]1C[C@@H](C[N@@H+]2OC3CCC2CC3)CCO1 ZINC000640230935 358944268 /nfs/dbraw/zinc/94/42/68/358944268.db2.gz WYEGJGNVFHYJOT-IALDZJHCSA-N 1 2 225.332 2.360 20 0 BEADLO C[C@@H]1C[C@@H](C[N@H+]2OC3CCC2CC3)CCO1 ZINC000640230935 358944269 /nfs/dbraw/zinc/94/42/69/358944269.db2.gz WYEGJGNVFHYJOT-IALDZJHCSA-N 1 2 225.332 2.360 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)c1ccccc1Cl ZINC000070978965 359067550 /nfs/dbraw/zinc/06/75/50/359067550.db2.gz XATQDOVVRHAUIU-UHFFFAOYSA-N 1 2 249.701 2.335 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)CC1=CCCCC1 ZINC000070980837 359068487 /nfs/dbraw/zinc/06/84/87/359068487.db2.gz FKQUEIHSCDGYOE-UHFFFAOYSA-N 1 2 233.315 2.259 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)c1cc2ccccc2o1 ZINC000070990850 359069937 /nfs/dbraw/zinc/06/99/37/359069937.db2.gz GLSNIHIDQINTFM-UHFFFAOYSA-N 1 2 241.250 2.086 20 0 BEADLO CCc1cc(C(=O)NCc2[nH]cc[nH+]2)sc1C ZINC000070990253 359070052 /nfs/dbraw/zinc/07/00/52/359070052.db2.gz PURCUBMJWFIMCY-UHFFFAOYSA-N 1 2 249.339 2.272 20 0 BEADLO Fc1ccc(SCC[NH+]2CCOCC2)cc1 ZINC000072790635 359090822 /nfs/dbraw/zinc/09/08/22/359090822.db2.gz TUNRQVOFONMZRM-UHFFFAOYSA-N 1 2 241.331 2.250 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ccccn1)c1cnccn1 ZINC000070477509 359056600 /nfs/dbraw/zinc/05/66/00/359056600.db2.gz YPWDTFOYACRBRN-WDEREUQCSA-N 1 2 228.299 2.283 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1cnccn1)c1ccccn1 ZINC000070477510 359056788 /nfs/dbraw/zinc/05/67/88/359056788.db2.gz YPWDTFOYACRBRN-GHMZBOCLSA-N 1 2 228.299 2.283 20 0 BEADLO C[C@@H]([NH2+]Cc1ccccc1F)c1cnccn1 ZINC000070477350 359056965 /nfs/dbraw/zinc/05/69/65/359056965.db2.gz RUSOKQKILDWSDF-SNVBAGLBSA-N 1 2 231.274 2.467 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1ccc2c(c1)CCC2 ZINC000070502001 359057575 /nfs/dbraw/zinc/05/75/75/359057575.db2.gz MBWSOTVFTDVXMU-UHFFFAOYSA-N 1 2 247.338 2.170 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1ccc2c(c1)CCC2 ZINC000070502001 359057578 /nfs/dbraw/zinc/05/75/78/359057578.db2.gz MBWSOTVFTDVXMU-UHFFFAOYSA-N 1 2 247.338 2.170 20 0 BEADLO Cc1cnc(C[N@H+]2CCS[C@@H](C)[C@H]2C)o1 ZINC000247476717 359223534 /nfs/dbraw/zinc/22/35/34/359223534.db2.gz JTTHPDBOZDSYHQ-ZJUUUORDSA-N 1 2 226.345 2.309 20 0 BEADLO Cc1cnc(C[N@@H+]2CCS[C@@H](C)[C@H]2C)o1 ZINC000247476717 359223540 /nfs/dbraw/zinc/22/35/40/359223540.db2.gz JTTHPDBOZDSYHQ-ZJUUUORDSA-N 1 2 226.345 2.309 20 0 BEADLO Cc1cc(NC(=O)[C@H]2[C@@H]3CCC[C@@H]32)cc[nH+]1 ZINC000248358864 359270078 /nfs/dbraw/zinc/27/00/78/359270078.db2.gz RGYZYNIJOHZBBQ-GDNZZTSVSA-N 1 2 216.284 2.375 20 0 BEADLO FC(F)C[NH2+][C@@H](c1cccnc1)C1CC1 ZINC000308910218 491140086 /nfs/dbraw/zinc/14/00/86/491140086.db2.gz UEOBCHBERTUBHC-LLVKDONJSA-N 1 2 212.243 2.387 20 0 BEADLO CCOC(=O)[C@H](CC)[N@@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000611502435 359385165 /nfs/dbraw/zinc/38/51/65/359385165.db2.gz SGPQOYNWENQQBC-DCAQKATOSA-N 1 2 231.311 2.008 20 0 BEADLO CCOC(=O)[C@H](CC)[N@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000611502435 359385169 /nfs/dbraw/zinc/38/51/69/359385169.db2.gz SGPQOYNWENQQBC-DCAQKATOSA-N 1 2 231.311 2.008 20 0 BEADLO COC(=O)[C@H](c1ccccc1)[N@H+]1CC=CCC1 ZINC000611517381 359388047 /nfs/dbraw/zinc/38/80/47/359388047.db2.gz WHCOOEUHVWVSBJ-ZDUSSCGKSA-N 1 2 231.295 2.163 20 0 BEADLO COC(=O)[C@H](c1ccccc1)[N@@H+]1CC=CCC1 ZINC000611517381 359388051 /nfs/dbraw/zinc/38/80/51/359388051.db2.gz WHCOOEUHVWVSBJ-ZDUSSCGKSA-N 1 2 231.295 2.163 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)[C@@H]1CCCC2(CC2)C1 ZINC000611796091 359452791 /nfs/dbraw/zinc/45/27/91/359452791.db2.gz WINWTDYRGBLKRB-LLVKDONJSA-N 1 2 247.342 2.305 20 0 BEADLO OC[C@H]([C@@H](Nc1cccc[nH+]1)C1CC1)C1CC1 ZINC000450778870 202263957 /nfs/dbraw/zinc/26/39/57/202263957.db2.gz NZFYQTBJVUZNSH-JSGCOSHPSA-N 1 2 232.327 2.291 20 0 BEADLO Cc1cnc(CNCc2[nH]c(C)c(C)[nH+]2)s1 ZINC000580451308 359559645 /nfs/dbraw/zinc/55/96/45/359559645.db2.gz CMYVCQAAPMYJRP-UHFFFAOYSA-N 1 2 236.344 2.081 20 0 BEADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1ncccn1 ZINC000580466755 359571109 /nfs/dbraw/zinc/57/11/09/359571109.db2.gz LXAZSBSEVIWJOI-LLVKDONJSA-N 1 2 242.326 2.285 20 0 BEADLO Nc1cc(Br)ccc1C[NH+]1CCC1 ZINC000306357531 359683433 /nfs/dbraw/zinc/68/34/33/359683433.db2.gz WUYCAUIWZOFQOB-UHFFFAOYSA-N 1 2 241.132 2.237 20 0 BEADLO CCc1cc(NC2CC(F)(F)C2)nc[nH+]1 ZINC000309054575 491143551 /nfs/dbraw/zinc/14/35/51/491143551.db2.gz SXJVUBZFFIQTTD-UHFFFAOYSA-N 1 2 213.231 2.249 20 0 BEADLO CO[C@@H]([C@H](C)Nc1cc[nH+]c(C2CC2)n1)C1CC1 ZINC000450855733 202289965 /nfs/dbraw/zinc/28/99/65/202289965.db2.gz GRHCISYBUZYMMM-ZANVPECISA-N 1 2 247.342 2.001 20 0 BEADLO C[C@H](c1csnn1)[N@H+](C)CC[C@H]1CCCO1 ZINC000450826217 202277591 /nfs/dbraw/zinc/27/75/91/202277591.db2.gz ZBSFOAFUZCFHRS-NXEZZACHSA-N 1 2 241.360 2.100 20 0 BEADLO C[C@H](c1csnn1)[N@@H+](C)CC[C@H]1CCCO1 ZINC000450826217 202277593 /nfs/dbraw/zinc/27/75/93/202277593.db2.gz ZBSFOAFUZCFHRS-NXEZZACHSA-N 1 2 241.360 2.100 20 0 BEADLO CC[C@@H](C)C[N@H+](C)Cc1nsc(N(C)C)n1 ZINC000163214305 202278660 /nfs/dbraw/zinc/27/86/60/202278660.db2.gz CRRFPCBRUGKQNG-SECBINFHSA-N 1 2 242.392 2.082 20 0 BEADLO CC[C@@H](C)C[N@@H+](C)Cc1nsc(N(C)C)n1 ZINC000163214305 202278662 /nfs/dbraw/zinc/27/86/62/202278662.db2.gz CRRFPCBRUGKQNG-SECBINFHSA-N 1 2 242.392 2.082 20 0 BEADLO Cc1ccsc1C[N@@H+](C)Cc1nccn1C ZINC000057620398 359723441 /nfs/dbraw/zinc/72/34/41/359723441.db2.gz YKETXLCAPOUBDS-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1ccsc1C[N@H+](C)Cc1nccn1C ZINC000057620398 359723448 /nfs/dbraw/zinc/72/34/48/359723448.db2.gz YKETXLCAPOUBDS-UHFFFAOYSA-N 1 2 235.356 2.422 20 0 BEADLO Cc1nc(N(C)[C@H](CO)CC(C)(C)C)cc[nH+]1 ZINC000450838016 202282880 /nfs/dbraw/zinc/28/28/80/202282880.db2.gz WWTITEKIWPSIOP-NSHDSACASA-N 1 2 237.347 2.018 20 0 BEADLO CCc1ncc(CNc2cccc[nH+]2)o1 ZINC000450842914 202285010 /nfs/dbraw/zinc/28/50/10/202285010.db2.gz CTZIPDCRZRRJPN-UHFFFAOYSA-N 1 2 203.245 2.244 20 0 BEADLO CCC[C@@H](O)C[N@@H+]1CC[C@H](C)C(F)(F)C1 ZINC000450842777 202286640 /nfs/dbraw/zinc/28/66/40/202286640.db2.gz CDPUHJWWTWGJEM-VHSXEESVSA-N 1 2 221.291 2.125 20 0 BEADLO CCC[C@@H](O)C[N@H+]1CC[C@H](C)C(F)(F)C1 ZINC000450842777 202286642 /nfs/dbraw/zinc/28/66/42/202286642.db2.gz CDPUHJWWTWGJEM-VHSXEESVSA-N 1 2 221.291 2.125 20 0 BEADLO CCC1(CNc2ccc3ccccc3[nH+]2)COC1 ZINC000450849188 202287880 /nfs/dbraw/zinc/28/78/80/202287880.db2.gz SRZSUCFUDMROND-UHFFFAOYSA-N 1 2 242.322 2.495 20 0 BEADLO c1cc(NCCC[C@@H]2CCOC2)nc(C2CC2)[nH+]1 ZINC000450885410 202296780 /nfs/dbraw/zinc/29/67/80/202296780.db2.gz BUGIEACPKJWWRS-LLVKDONJSA-N 1 2 247.342 2.005 20 0 BEADLO CC(C)c1nc(NC[C@@H]2C[C@H]2C2CC2)cc[nH+]1 ZINC000450929788 202311724 /nfs/dbraw/zinc/31/17/24/202311724.db2.gz VRYVOIJMSPYKNU-RYUDHWBXSA-N 1 2 231.343 2.480 20 0 BEADLO CCO[C@@H]1CCC[C@H]1Nc1cc(C)[nH+]cn1 ZINC000450934059 202312409 /nfs/dbraw/zinc/31/24/09/202312409.db2.gz DZEBMZIYMADHMQ-GHMZBOCLSA-N 1 2 221.304 2.155 20 0 BEADLO C[C@@H](NC(=O)[C@H](C)c1ccsc1)c1[nH]cc[nH+]1 ZINC000578452596 366568001 /nfs/dbraw/zinc/56/80/01/366568001.db2.gz OHJKFDVXBKWQEG-RKDXNWHRSA-N 1 2 249.339 2.452 20 0 BEADLO CC[C@H]1CC[N@@H+]1Cc1nnc(C2CC2)s1 ZINC000451066563 202343306 /nfs/dbraw/zinc/34/33/06/202343306.db2.gz NFYVTNMZPUBVDZ-VIFPVBQESA-N 1 2 223.345 2.400 20 0 BEADLO CC[C@H]1CC[N@H+]1Cc1nnc(C2CC2)s1 ZINC000451066563 202343307 /nfs/dbraw/zinc/34/33/07/202343307.db2.gz NFYVTNMZPUBVDZ-VIFPVBQESA-N 1 2 223.345 2.400 20 0 BEADLO COC(=O)c1ccc([C@@H](C)[N@@H+]2CC[C@H](F)C2)o1 ZINC000451192884 202376978 /nfs/dbraw/zinc/37/69/78/202376978.db2.gz UGCDPXULJZNGAC-BDAKNGLRSA-N 1 2 241.262 2.171 20 0 BEADLO COC(=O)c1ccc([C@@H](C)[N@H+]2CC[C@H](F)C2)o1 ZINC000451192884 202376981 /nfs/dbraw/zinc/37/69/81/202376981.db2.gz UGCDPXULJZNGAC-BDAKNGLRSA-N 1 2 241.262 2.171 20 0 BEADLO CCC(C)(C)CNC(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000613994256 363697164 /nfs/dbraw/zinc/69/71/64/363697164.db2.gz SCHLYPCXJWKDGX-GHMZBOCLSA-N 1 2 249.358 2.076 20 0 BEADLO Cc1cc(NCC2=CCCCC2)nc[nH+]1 ZINC000379761959 363699394 /nfs/dbraw/zinc/69/93/94/363699394.db2.gz FGVFGWVNPTXYOL-UHFFFAOYSA-N 1 2 203.289 2.119 20 0 BEADLO Cn1ccc(C[NH+]2CC(c3ccccc3F)C2)n1 ZINC000578814512 366650835 /nfs/dbraw/zinc/65/08/35/366650835.db2.gz CKIYJEKVWDAEIH-UHFFFAOYSA-N 1 2 245.301 2.159 20 0 BEADLO COc1ccc(C[NH2+]CC(C)(F)F)cc1OC ZINC000578888622 366668675 /nfs/dbraw/zinc/66/86/75/366668675.db2.gz IJHUTJDUEXJWBK-UHFFFAOYSA-N 1 2 245.269 2.449 20 0 BEADLO CC(C)n1ncnc1C[NH2+][C@H](C)c1ccccn1 ZINC000088589308 359968552 /nfs/dbraw/zinc/96/85/52/359968552.db2.gz ZSOLAUHKVJBSRK-LLVKDONJSA-N 1 2 245.330 2.105 20 0 BEADLO Cc1ccc(C(=O)NCc2c[nH+]c[nH]2)cc1Cl ZINC000088753449 359975537 /nfs/dbraw/zinc/97/55/37/359975537.db2.gz JSIQWVPOGCZADD-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO Cc1ccc(C(=O)NCc2c[nH]c[nH+]2)cc1Cl ZINC000088753449 359975539 /nfs/dbraw/zinc/97/55/39/359975539.db2.gz JSIQWVPOGCZADD-UHFFFAOYSA-N 1 2 249.701 2.302 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2CCC2(C)C)c(C)c[nH+]1 ZINC000612746659 360040278 /nfs/dbraw/zinc/04/02/78/360040278.db2.gz IAEFCCTXSCOQKI-NSHDSACASA-N 1 2 232.327 2.495 20 0 BEADLO CC(=O)c1cccc(OCc2c[nH+]cn2C)c1 ZINC000091278511 360110161 /nfs/dbraw/zinc/11/01/61/360110161.db2.gz YJRMPKYVVTVZNH-UHFFFAOYSA-N 1 2 230.267 2.202 20 0 BEADLO CC(C)c1ncc(C[N@@H+]2CCOC[C@@H]2C)s1 ZINC000091800698 360131867 /nfs/dbraw/zinc/13/18/67/360131867.db2.gz MFZCQURQWJKXCC-JTQLQIEISA-N 1 2 240.372 2.487 20 0 BEADLO CC(C)c1ncc(C[N@H+]2CCOC[C@@H]2C)s1 ZINC000091800698 360131868 /nfs/dbraw/zinc/13/18/68/360131868.db2.gz MFZCQURQWJKXCC-JTQLQIEISA-N 1 2 240.372 2.487 20 0 BEADLO Brc1cccnc1C[NH+]1CCC1 ZINC000237963615 360134117 /nfs/dbraw/zinc/13/41/17/360134117.db2.gz PYMBMSGKHPNXPP-UHFFFAOYSA-N 1 2 227.105 2.050 20 0 BEADLO Cc1cc(NC(=O)NC(C)(C)C(C)C)cc[nH+]1 ZINC000551906128 325573933 /nfs/dbraw/zinc/57/39/33/325573933.db2.gz RKKNFINEVZTIIO-UHFFFAOYSA-N 1 2 235.331 2.368 20 0 BEADLO CC[C@@H](C)CNc1ccc(N2CCOCC2)c[nH+]1 ZINC000093064027 360213711 /nfs/dbraw/zinc/21/37/11/360213711.db2.gz NMDALMSSMUIJMB-GFCCVEGCSA-N 1 2 249.358 2.376 20 0 BEADLO CCOCC[N@H+](C)[C@H](C)c1nc(C(C)C)no1 ZINC000093317608 360228462 /nfs/dbraw/zinc/22/84/62/360228462.db2.gz ZPVJWKWCMLQKCR-SNVBAGLBSA-N 1 2 241.335 2.222 20 0 BEADLO CCOCC[N@@H+](C)[C@H](C)c1nc(C(C)C)no1 ZINC000093317608 360228468 /nfs/dbraw/zinc/22/84/68/360228468.db2.gz ZPVJWKWCMLQKCR-SNVBAGLBSA-N 1 2 241.335 2.222 20 0 BEADLO Cc1[nH+]cccc1NCc1cc(C(N)=O)cs1 ZINC000093688478 360272658 /nfs/dbraw/zinc/27/26/58/360272658.db2.gz HTXNRLBGILNGKZ-UHFFFAOYSA-N 1 2 247.323 2.163 20 0 BEADLO Cn1cccc1C[N@@H+]1CCO[C@H](c2ccco2)C1 ZINC000093841841 360282303 /nfs/dbraw/zinc/28/23/03/360282303.db2.gz YLCLKQVPDLQOLF-AWEZNQCLSA-N 1 2 246.310 2.192 20 0 BEADLO Cn1cccc1C[N@H+]1CCO[C@H](c2ccco2)C1 ZINC000093841841 360282308 /nfs/dbraw/zinc/28/23/08/360282308.db2.gz YLCLKQVPDLQOLF-AWEZNQCLSA-N 1 2 246.310 2.192 20 0 BEADLO Cn1cccc1C[N@@H+]1CCO[C@@H](c2ccco2)C1 ZINC000093841842 360282508 /nfs/dbraw/zinc/28/25/08/360282508.db2.gz YLCLKQVPDLQOLF-CQSZACIVSA-N 1 2 246.310 2.192 20 0 BEADLO Cn1cccc1C[N@H+]1CCO[C@@H](c2ccco2)C1 ZINC000093841842 360282515 /nfs/dbraw/zinc/28/25/15/360282515.db2.gz YLCLKQVPDLQOLF-CQSZACIVSA-N 1 2 246.310 2.192 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCCC1(F)F)c1ccnn1C ZINC000309554455 491151343 /nfs/dbraw/zinc/15/13/43/491151343.db2.gz JGMXOHRLBTUAEK-SCZZXKLOSA-N 1 2 229.274 2.259 20 0 BEADLO CC(C)c1nc2[nH]ccc2c(NCC[C@@H](C)O)[nH+]1 ZINC000631120724 360778007 /nfs/dbraw/zinc/77/80/07/360778007.db2.gz WUOSNSRKTQQKHJ-SECBINFHSA-N 1 2 248.330 2.216 20 0 BEADLO C/C=C/CNC(=O)Cn1c(C)[nH+]c2ccccc21 ZINC000629038633 360827676 /nfs/dbraw/zinc/82/76/76/360827676.db2.gz QDRWYNCCKGZSIU-ONEGZZNKSA-N 1 2 243.310 2.037 20 0 BEADLO CCc1cc(N)nc(SC[C@H]2C[C@H]2C)[nH+]1 ZINC000629178767 360926847 /nfs/dbraw/zinc/92/68/47/360926847.db2.gz JHFBUXFYZRKASS-HTQZYQBOSA-N 1 2 223.345 2.200 20 0 BEADLO C1=CCC(Nc2[nH+]c(C3CC3)nc3[nH]ccc32)C1 ZINC000631166559 361070360 /nfs/dbraw/zinc/07/03/60/361070360.db2.gz WPMBIWUZNNXUPY-UHFFFAOYSA-N 1 2 240.310 2.388 20 0 BEADLO C[C@H](CCCCO)[NH2+][C@@H](C1CC1)C(F)(F)F ZINC000309734649 491155280 /nfs/dbraw/zinc/15/52/80/491155280.db2.gz GCDCWUMHCCPFED-SCZZXKLOSA-N 1 2 239.281 2.468 20 0 BEADLO CCC[C@@H]1C[N@@H+]([C@H](C)c2cnc(C)cn2)CCO1 ZINC000428296964 201007159 /nfs/dbraw/zinc/00/71/59/201007159.db2.gz ZDHAPUVJJNFAHT-CHWSQXEVSA-N 1 2 249.358 2.347 20 0 BEADLO CCC[C@@H]1C[N@H+]([C@H](C)c2cnc(C)cn2)CCO1 ZINC000428296964 201007162 /nfs/dbraw/zinc/00/71/62/201007162.db2.gz ZDHAPUVJJNFAHT-CHWSQXEVSA-N 1 2 249.358 2.347 20 0 BEADLO Cc1c[nH+]cc(NC[C@@H]2CCC=CO2)c1 ZINC000194524612 361319142 /nfs/dbraw/zinc/31/91/42/361319142.db2.gz WEUFFKWLZJFNQW-LBPRGKRZSA-N 1 2 204.273 2.495 20 0 BEADLO CC(C)(NC(=O)Cc1ccsc1)c1[nH]cc[nH+]1 ZINC000579240512 366744081 /nfs/dbraw/zinc/74/40/81/366744081.db2.gz RMFNFGBLZCFSQD-UHFFFAOYSA-N 1 2 249.339 2.065 20 0 BEADLO CC[C@@]1(C)C[N@@H+]([C@@H](C)c2cnc(C)cn2)CCO1 ZINC000428486423 201023678 /nfs/dbraw/zinc/02/36/78/201023678.db2.gz VXPSDHNQPCYCEZ-JSGCOSHPSA-N 1 2 249.358 2.347 20 0 BEADLO CC[C@@]1(C)C[N@H+]([C@@H](C)c2cnc(C)cn2)CCO1 ZINC000428486423 201023680 /nfs/dbraw/zinc/02/36/80/201023680.db2.gz VXPSDHNQPCYCEZ-JSGCOSHPSA-N 1 2 249.358 2.347 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cc(C)ncn2)o1 ZINC000428480056 201025384 /nfs/dbraw/zinc/02/53/84/201025384.db2.gz BDUOGDGVUSIRMG-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cc(C)ncn2)o1 ZINC000428480056 201025386 /nfs/dbraw/zinc/02/53/86/201025386.db2.gz BDUOGDGVUSIRMG-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1nc(C[NH2+][C@@H](C)c2c[nH]nc2C)cs1 ZINC000309796602 491156771 /nfs/dbraw/zinc/15/67/71/491156771.db2.gz QHYIZHNVCPIWPV-ZETCQYMHSA-N 1 2 236.344 2.334 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)C1CC2(CC2)C1 ZINC000614275710 363767115 /nfs/dbraw/zinc/76/71/15/363767115.db2.gz LGEBUBASMFVMTB-UHFFFAOYSA-N 1 2 241.294 2.463 20 0 BEADLO CCC[C@H]([NH2+]C[C@H]1CCCS1)C(=O)OCC ZINC000148047064 201078746 /nfs/dbraw/zinc/07/87/46/201078746.db2.gz BNLAOXWEQXQGMU-MNOVXSKESA-N 1 2 245.388 2.203 20 0 BEADLO C[N@H+](Cc1ncc(Cl)s1)C1(CO)CCC1 ZINC000429234408 201081249 /nfs/dbraw/zinc/08/12/49/201081249.db2.gz GSVKMNXEVQPLDD-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO C[N@@H+](Cc1ncc(Cl)s1)C1(CO)CCC1 ZINC000429234408 201081251 /nfs/dbraw/zinc/08/12/51/201081251.db2.gz GSVKMNXEVQPLDD-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO COCC(C)(C)[N@H+](C)Cc1nnc(C(C)C)o1 ZINC000429247201 201082969 /nfs/dbraw/zinc/08/29/69/201082969.db2.gz QLAVDCZBYZFMRQ-UHFFFAOYSA-N 1 2 241.335 2.050 20 0 BEADLO COCC(C)(C)[N@@H+](C)Cc1nnc(C(C)C)o1 ZINC000429247201 201082972 /nfs/dbraw/zinc/08/29/72/201082972.db2.gz QLAVDCZBYZFMRQ-UHFFFAOYSA-N 1 2 241.335 2.050 20 0 BEADLO CCOC(=O)[C@@H](C)[N@@H+]1CCc2cccc(C)c2C1 ZINC000429566902 201119000 /nfs/dbraw/zinc/11/90/00/201119000.db2.gz WFMKZKSWYWFXAN-GFCCVEGCSA-N 1 2 247.338 2.305 20 0 BEADLO CCOC(=O)[C@@H](C)[N@H+]1CCc2cccc(C)c2C1 ZINC000429566902 201119004 /nfs/dbraw/zinc/11/90/04/201119004.db2.gz WFMKZKSWYWFXAN-GFCCVEGCSA-N 1 2 247.338 2.305 20 0 BEADLO c1cnc(CNc2c[nH+]c3c(c2)CCCC3)cn1 ZINC000579444873 366801982 /nfs/dbraw/zinc/80/19/82/366801982.db2.gz ZJLRKOKVUMVASB-UHFFFAOYSA-N 1 2 240.310 2.363 20 0 BEADLO CC1(CC(=O)NCc2cn3ccccc3[nH+]2)CC1 ZINC000429728202 201129542 /nfs/dbraw/zinc/12/95/42/201129542.db2.gz DPPIQLWQJKVCLU-UHFFFAOYSA-N 1 2 243.310 2.141 20 0 BEADLO C[C@@H](Cn1cc[nH+]c1)NC(=O)CC1CC(C)(C)C1 ZINC000429836743 201132556 /nfs/dbraw/zinc/13/25/56/201132556.db2.gz CEMXOEXLLHYFGV-NSHDSACASA-N 1 2 249.358 2.214 20 0 BEADLO CC[C@H]1CC[N@@H+]1Cc1cc(C(F)(F)F)n[nH]1 ZINC000430199442 201154294 /nfs/dbraw/zinc/15/42/94/201154294.db2.gz UTKANWRPWRFZRH-QMMMGPOBSA-N 1 2 233.237 2.413 20 0 BEADLO CC[C@H]1CC[N@H+]1Cc1cc(C(F)(F)F)n[nH]1 ZINC000430199442 201154296 /nfs/dbraw/zinc/15/42/96/201154296.db2.gz UTKANWRPWRFZRH-QMMMGPOBSA-N 1 2 233.237 2.413 20 0 BEADLO CS[C@@H]1CC[N@H+](Cc2nc(C(C)C)no2)C1 ZINC000448545611 201198930 /nfs/dbraw/zinc/19/89/30/201198930.db2.gz HEPOTPSSYANINW-SECBINFHSA-N 1 2 241.360 2.130 20 0 BEADLO CS[C@@H]1CC[N@@H+](Cc2nc(C(C)C)no2)C1 ZINC000448545611 201198931 /nfs/dbraw/zinc/19/89/31/201198931.db2.gz HEPOTPSSYANINW-SECBINFHSA-N 1 2 241.360 2.130 20 0 BEADLO CS[C@H]1CC[N@H+](Cc2nc(C(C)C)no2)C1 ZINC000448545612 201199521 /nfs/dbraw/zinc/19/95/21/201199521.db2.gz HEPOTPSSYANINW-VIFPVBQESA-N 1 2 241.360 2.130 20 0 BEADLO CS[C@H]1CC[N@@H+](Cc2nc(C(C)C)no2)C1 ZINC000448545612 201199524 /nfs/dbraw/zinc/19/95/24/201199524.db2.gz HEPOTPSSYANINW-VIFPVBQESA-N 1 2 241.360 2.130 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N1CCCC2(CC2)CC1 ZINC000629645975 361534445 /nfs/dbraw/zinc/53/44/45/361534445.db2.gz GCPWOXRHFMMHSH-UHFFFAOYSA-N 1 2 247.342 2.135 20 0 BEADLO COC(=O)C(C)(C)[NH2+]CCCSCC(C)C ZINC000152329719 201195710 /nfs/dbraw/zinc/19/57/10/201195710.db2.gz ODZWQXITFVBQOQ-UHFFFAOYSA-N 1 2 247.404 2.307 20 0 BEADLO CCN(Cc1c[nH+]cn1C)c1ccccc1OC ZINC000434827930 201242961 /nfs/dbraw/zinc/24/29/61/201242961.db2.gz ATWYGWYSSNCDTI-UHFFFAOYSA-N 1 2 245.326 2.455 20 0 BEADLO Nc1[nH+]cccc1-c1ccc(N2CCCC2)nc1 ZINC000629708883 361644266 /nfs/dbraw/zinc/64/42/66/361644266.db2.gz DEFOQSKWBVLNIV-UHFFFAOYSA-N 1 2 240.310 2.326 20 0 BEADLO CCc1nc(C[N@H+](C)C2CC(C)(C)C2)no1 ZINC000448558032 201265293 /nfs/dbraw/zinc/26/52/93/201265293.db2.gz WXIGPPLRTSGODJ-UHFFFAOYSA-N 1 2 223.320 2.252 20 0 BEADLO CCc1nc(C[N@@H+](C)C2CC(C)(C)C2)no1 ZINC000448558032 201265297 /nfs/dbraw/zinc/26/52/97/201265297.db2.gz WXIGPPLRTSGODJ-UHFFFAOYSA-N 1 2 223.320 2.252 20 0 BEADLO CNc1ccc(-c2cccc(F)c2)c[nH+]1 ZINC000629710187 361651010 /nfs/dbraw/zinc/65/10/10/361651010.db2.gz BNLRRLCBHOGJII-UHFFFAOYSA-N 1 2 202.232 2.351 20 0 BEADLO C[C@@H]1CCC[C@]1(C)C(=O)NCCCn1cc[nH+]c1 ZINC000448564605 201288661 /nfs/dbraw/zinc/28/86/61/201288661.db2.gz HDXBXTWMOUQNQN-OCCSQVGLSA-N 1 2 249.358 2.216 20 0 BEADLO CCNc1ccc(-c2cc(C)ccc2CO)c[nH+]1 ZINC000629741229 361678181 /nfs/dbraw/zinc/67/81/81/361678181.db2.gz RKMWHDBHZPPRQP-UHFFFAOYSA-N 1 2 242.322 2.403 20 0 BEADLO Cc1c([C@H](C)[NH2+]CCF)nnn1-c1ccccc1 ZINC000436305267 201321548 /nfs/dbraw/zinc/32/15/48/201321548.db2.gz ZUTABMAGYFKYLZ-JTQLQIEISA-N 1 2 248.305 2.196 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)C2=CCCC2)[nH+]1 ZINC000579484533 366827743 /nfs/dbraw/zinc/82/77/43/366827743.db2.gz PLAYGSQPPFPWKA-UHFFFAOYSA-N 1 2 233.315 2.180 20 0 BEADLO Cc1nnsc1C[NH2+][C@H](C)c1cscn1 ZINC000389569361 541318194 /nfs/dbraw/zinc/31/81/94/541318194.db2.gz BBRNMSVAZWMFAS-ZCFIWIBFSA-N 1 2 240.357 2.154 20 0 BEADLO CCCCc1cc(NC[C@@H](CC)OC)nc[nH+]1 ZINC000631278683 364044333 /nfs/dbraw/zinc/04/43/33/364044333.db2.gz KEVDTWBOVKVKHA-GFCCVEGCSA-N 1 2 237.347 2.078 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)CCC(F)F ZINC000622083747 370699143 /nfs/dbraw/zinc/69/91/43/370699143.db2.gz LIJNGWBTFFNVGJ-MRVPVSSYSA-N 1 2 245.273 2.126 20 0 BEADLO CCc1cc(N2C[C@H](C)O[C@H](C)[C@@H]2C)nc(C)[nH+]1 ZINC000445670907 541349956 /nfs/dbraw/zinc/34/99/56/541349956.db2.gz YDRAXPHEJVSQBW-GARJFASQSA-N 1 2 249.358 2.350 20 0 BEADLO COc1cncc(/C=C/CCn2cc[nH+]c2)c1 ZINC001642068149 1172320127 /nfs/dbraw/zinc/32/01/27/1172320127.db2.gz MPTDKZAIKAWEKI-DUXPYHPUSA-N 1 2 229.283 2.390 20 0 BEADLO Cc1ccc(NC(=O)Cc2ccncc2)c(C)[nH+]1 ZINC000182096771 366865765 /nfs/dbraw/zinc/86/57/65/366865765.db2.gz JMXLBRQBGHRDLX-UHFFFAOYSA-N 1 2 241.294 2.275 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CCC[C@H]2C[C@H]21)c1[nH]cc[nH+]1 ZINC000615158870 364552418 /nfs/dbraw/zinc/55/24/18/364552418.db2.gz WERBTBNAQIUKPP-LMLFDSFASA-N 1 2 233.315 2.023 20 0 BEADLO CCc1nc(C)c(C[NH2+][C@@H](C)c2cnccn2)o1 ZINC000336817116 364794209 /nfs/dbraw/zinc/79/42/09/364794209.db2.gz OQYOILYLCIRDMO-VIFPVBQESA-N 1 2 246.314 2.186 20 0 BEADLO CC(C)C[C@H]1CCCCN1C(=O)Cn1cc[nH+]c1 ZINC000573501668 364849722 /nfs/dbraw/zinc/84/97/22/364849722.db2.gz KONKZABHYOEXKH-CYBMUJFWSA-N 1 2 249.358 2.310 20 0 BEADLO Cc1ccc(NC(=O)Cc2ccco2)c(C)[nH+]1 ZINC000335829719 541423418 /nfs/dbraw/zinc/42/34/18/541423418.db2.gz QAAHIVYCIMVLPQ-UHFFFAOYSA-N 1 2 230.267 2.473 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@H]1CCO[C@@H](C)C1 ZINC000574170082 365002685 /nfs/dbraw/zinc/00/26/85/365002685.db2.gz JPWGMCAHWYBXBR-ONGXEEELSA-N 1 2 221.304 2.073 20 0 BEADLO C[C@H]([NH2+]Cc1ncccn1)c1ccc(Cl)cn1 ZINC000574584551 365097993 /nfs/dbraw/zinc/09/79/93/365097993.db2.gz HJHPSYRDIXNJKC-VIFPVBQESA-N 1 2 248.717 2.376 20 0 BEADLO CC(C)C[C@]1(C)CCCN1C(=O)Cn1cc[nH+]c1 ZINC000574845185 365159090 /nfs/dbraw/zinc/15/90/90/365159090.db2.gz FBBAJUTWICWCND-AWEZNQCLSA-N 1 2 249.358 2.310 20 0 BEADLO CN(CCCOCc1[nH]cc[nH+]1)c1ccccc1 ZINC000575180806 365231437 /nfs/dbraw/zinc/23/14/37/365231437.db2.gz DEWRMGBHHOULHD-UHFFFAOYSA-N 1 2 245.326 2.453 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2CCC[C@@H](C)C2)n1 ZINC000334554819 365238493 /nfs/dbraw/zinc/23/84/93/365238493.db2.gz DGSOUBBAFSULBF-RKDXNWHRSA-N 1 2 209.293 2.083 20 0 BEADLO CCc1cnc(C[NH2+][C@H](C)CF)s1 ZINC000336666183 365346812 /nfs/dbraw/zinc/34/68/12/365346812.db2.gz YHWQPVFTHLMRBJ-SSDOTTSWSA-N 1 2 202.298 2.153 20 0 BEADLO Cc1o[nH]c(=NCc2c[nH+]cn2C(C)C)c1C ZINC000579582978 366888028 /nfs/dbraw/zinc/88/80/28/366888028.db2.gz WCJBRSHCSZUDSC-UHFFFAOYSA-N 1 2 234.303 2.103 20 0 BEADLO CC(C)N(CC1CC1)C(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000576050217 365464433 /nfs/dbraw/zinc/46/44/33/365464433.db2.gz ANHXUOZFQIBZMS-NSHDSACASA-N 1 2 249.358 2.235 20 0 BEADLO CC(C)N(CC1CC1)C(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000576050217 365464441 /nfs/dbraw/zinc/46/44/41/365464441.db2.gz ANHXUOZFQIBZMS-NSHDSACASA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NCC1=CCCCC1 ZINC000576002246 365443749 /nfs/dbraw/zinc/44/37/49/365443749.db2.gz UERLHUSURUDCRC-LLVKDONJSA-N 1 2 247.342 2.205 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NCC1=CCCCC1 ZINC000576002246 365443757 /nfs/dbraw/zinc/44/37/57/365443757.db2.gz UERLHUSURUDCRC-LLVKDONJSA-N 1 2 247.342 2.205 20 0 BEADLO CCc1cc(N[C@@H](C)[C@@H]2CCCCO2)nc[nH+]1 ZINC000383123679 541513792 /nfs/dbraw/zinc/51/37/92/541513792.db2.gz UBQNQBARBKBAGK-JQWIXIFHSA-N 1 2 235.331 2.409 20 0 BEADLO C[C@@H](CC(=O)N1CCCC12CCC2)n1cc[nH+]c1 ZINC000579723038 366992358 /nfs/dbraw/zinc/99/23/58/366992358.db2.gz VDSZEPVAQJHGOQ-LBPRGKRZSA-N 1 2 247.342 2.379 20 0 BEADLO COc1ccc([C@H](C)CN2CC[NH+](C)CC2)cc1 ZINC000183369064 367018203 /nfs/dbraw/zinc/01/82/03/367018203.db2.gz GXUARVXQFDWDRZ-CYBMUJFWSA-N 1 2 248.370 2.046 20 0 BEADLO Cc1cnc(C)c(NCCc2ccc(C)[nH+]c2)n1 ZINC000184114476 367064258 /nfs/dbraw/zinc/06/42/58/367064258.db2.gz FYPNJESQYVDZAI-UHFFFAOYSA-N 1 2 242.326 2.451 20 0 BEADLO CCCCOCC[NH2+][C@H]1CCCc2[nH]ncc21 ZINC000367625293 367087177 /nfs/dbraw/zinc/08/71/77/367087177.db2.gz KZXJZUOQVVBDBZ-LBPRGKRZSA-N 1 2 237.347 2.193 20 0 BEADLO CC(C)C[C@H](C)C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000579961372 367104500 /nfs/dbraw/zinc/10/45/00/367104500.db2.gz FYTUNBOKVARERR-JTQLQIEISA-N 1 2 237.347 2.443 20 0 BEADLO Cc1nc(NCC2CC(C)(C)C2)cc[nH+]1 ZINC000380295280 367172733 /nfs/dbraw/zinc/17/27/33/367172733.db2.gz CNQSBPRMUQQKIA-UHFFFAOYSA-N 1 2 205.305 2.055 20 0 BEADLO CC[C@@H]1CCCN(C(=O)[C@@H](C)Cc2c[nH+]c[nH]2)C1 ZINC000580842309 367184743 /nfs/dbraw/zinc/18/47/43/367184743.db2.gz CGZUHBQHIMUGOZ-NWDGAFQWSA-N 1 2 249.358 2.237 20 0 BEADLO CC[C@@H]1CCCN(C(=O)[C@@H](C)Cc2c[nH]c[nH+]2)C1 ZINC000580842309 367184751 /nfs/dbraw/zinc/18/47/51/367184751.db2.gz CGZUHBQHIMUGOZ-NWDGAFQWSA-N 1 2 249.358 2.237 20 0 BEADLO CC(C)c1ncc(C[N@H+](C)Cc2ccno2)cn1 ZINC000580931240 367208407 /nfs/dbraw/zinc/20/84/07/367208407.db2.gz BQJGSDPUCWZNDS-UHFFFAOYSA-N 1 2 246.314 2.220 20 0 BEADLO CC(C)c1ncc(C[N@@H+](C)Cc2ccno2)cn1 ZINC000580931240 367208411 /nfs/dbraw/zinc/20/84/11/367208411.db2.gz BQJGSDPUCWZNDS-UHFFFAOYSA-N 1 2 246.314 2.220 20 0 BEADLO CCOCC[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000194041686 367244163 /nfs/dbraw/zinc/24/41/63/367244163.db2.gz FTIWWUIPDQLXFM-VIFPVBQESA-N 1 2 241.335 2.054 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CC2(C1)CCCC2 ZINC000581083214 367260407 /nfs/dbraw/zinc/26/04/07/367260407.db2.gz VORHKNLEEQVXRE-UHFFFAOYSA-N 1 2 217.316 2.474 20 0 BEADLO CC(C)c1cc(C(=O)N[C@H](C)c2[nH]cc[nH+]2)no1 ZINC000581279350 367316413 /nfs/dbraw/zinc/31/64/13/367316413.db2.gz YXHUIXNLNIVJQO-MRVPVSSYSA-N 1 2 248.286 2.012 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCSC(C)C ZINC000581439640 367473166 /nfs/dbraw/zinc/47/31/66/367473166.db2.gz BYSCXJGXAQEYSV-UHFFFAOYSA-N 1 2 225.361 2.069 20 0 BEADLO CC(C)c1nc(NCC(C)(F)F)cc[nH+]1 ZINC000381978634 367475018 /nfs/dbraw/zinc/47/50/18/367475018.db2.gz AUUWKBGFOFRJJO-UHFFFAOYSA-N 1 2 215.247 2.089 20 0 BEADLO CCn1cc([C@@H](C)[NH2+]CC(C)(F)F)cn1 ZINC000382018667 367479684 /nfs/dbraw/zinc/47/96/84/367479684.db2.gz PITYKDNXFBISRJ-MRVPVSSYSA-N 1 2 217.263 2.209 20 0 BEADLO COCC1(C)C[NH+](Cc2ccc(F)cc2F)C1 ZINC000581653010 367654392 /nfs/dbraw/zinc/65/43/92/367654392.db2.gz YQBVQBDPAWHKOI-UHFFFAOYSA-N 1 2 241.281 2.433 20 0 BEADLO COc1ccc[nH+]c1NCCC1(OC)CCC1 ZINC000383814635 367654815 /nfs/dbraw/zinc/65/48/15/367654815.db2.gz GRVQOBIFQYFXAS-UHFFFAOYSA-N 1 2 236.315 2.461 20 0 BEADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N(C)CC1CCCC1 ZINC000581674934 367704952 /nfs/dbraw/zinc/70/49/52/367704952.db2.gz CVPVHTASPZWOKL-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N(C)CC1CCCC1 ZINC000581674934 367704957 /nfs/dbraw/zinc/70/49/57/367704957.db2.gz CVPVHTASPZWOKL-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO Cc1cc(NC(=O)c2cncc(Cl)c2)cc[nH+]1 ZINC000622368492 370873413 /nfs/dbraw/zinc/87/34/13/370873413.db2.gz ZBOKGAFXJVZEHC-UHFFFAOYSA-N 1 2 247.685 2.113 20 0 BEADLO CC(C)O[C@@H]1CC[N@H+](Cc2cscn2)C1 ZINC000581820688 367830947 /nfs/dbraw/zinc/83/09/47/367830947.db2.gz REEHGQCSPSNEGU-LLVKDONJSA-N 1 2 226.345 2.142 20 0 BEADLO CC(C)O[C@@H]1CC[N@@H+](Cc2cscn2)C1 ZINC000581820688 367830951 /nfs/dbraw/zinc/83/09/51/367830951.db2.gz REEHGQCSPSNEGU-LLVKDONJSA-N 1 2 226.345 2.142 20 0 BEADLO Cc1cc(N[C@H](CO)C2CCCCC2)nc[nH+]1 ZINC000386112745 367914453 /nfs/dbraw/zinc/91/44/53/367914453.db2.gz KQZXDTHWVZFCAS-GFCCVEGCSA-N 1 2 235.331 2.138 20 0 BEADLO Cc1ccc([C@H](C)NC(=O)Cn2cc[nH+]c2)cc1 ZINC000075681986 367942111 /nfs/dbraw/zinc/94/21/11/367942111.db2.gz CTGGPCITHDILRL-LBPRGKRZSA-N 1 2 243.310 2.069 20 0 BEADLO COc1c(N)[nH+]cnc1N[C@@H]1CC12CCCCC2 ZINC000386904300 368032924 /nfs/dbraw/zinc/03/29/24/368032924.db2.gz BSEOOZPPDKEIAH-SECBINFHSA-N 1 2 248.330 2.202 20 0 BEADLO COc1c(N)nc[nH+]c1N[C@@H]1CC12CCCCC2 ZINC000386904300 368032928 /nfs/dbraw/zinc/03/29/28/368032928.db2.gz BSEOOZPPDKEIAH-SECBINFHSA-N 1 2 248.330 2.202 20 0 BEADLO CC(C)Cn1cc(C[N@H+]2CCC[C@@H](F)C2)cn1 ZINC000566353908 326035924 /nfs/dbraw/zinc/03/59/24/326035924.db2.gz MTEKYSPFWGATMT-CYBMUJFWSA-N 1 2 239.338 2.473 20 0 BEADLO OCc1cc[nH+]c(N2CC[C@@H]3CCCC[C@@H]32)c1 ZINC000163064854 368139970 /nfs/dbraw/zinc/13/99/70/368139970.db2.gz ULNGKMVCYJIRIF-STQMWFEESA-N 1 2 232.327 2.343 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NCC1(C)CCCC1 ZINC000582011383 368152031 /nfs/dbraw/zinc/15/20/31/368152031.db2.gz AGENJBQLISZRGY-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NCC1(C)CCCC1 ZINC000582011383 368152037 /nfs/dbraw/zinc/15/20/37/368152037.db2.gz AGENJBQLISZRGY-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO Cc1nc(N2CC(C(F)F)C2)c(C)c(C)[nH+]1 ZINC001642434983 1172361038 /nfs/dbraw/zinc/36/10/38/1172361038.db2.gz GQPAVCWQERQNDX-UHFFFAOYSA-N 1 2 227.258 2.103 20 0 BEADLO CCCC(C)(C)NC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000566437354 326046778 /nfs/dbraw/zinc/04/67/78/326046778.db2.gz AMGKDWQBRXBRHY-SNVBAGLBSA-N 1 2 237.347 2.283 20 0 BEADLO CCCC(C)(C)NC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000566437354 326046780 /nfs/dbraw/zinc/04/67/80/326046780.db2.gz AMGKDWQBRXBRHY-SNVBAGLBSA-N 1 2 237.347 2.283 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2nc(C)no2)cc1 ZINC000042293697 368302633 /nfs/dbraw/zinc/30/26/33/368302633.db2.gz HIYJDZIBVRNMIC-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2nc(C)no2)cc1 ZINC000042293697 368302640 /nfs/dbraw/zinc/30/26/40/368302640.db2.gz HIYJDZIBVRNMIC-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO Cc1ccsc1C[N@H+](C)Cc1nnc(C)o1 ZINC000061798595 368569763 /nfs/dbraw/zinc/56/97/63/368569763.db2.gz GGPNLBNFNXMTCX-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1ccsc1C[N@@H+](C)Cc1nnc(C)o1 ZINC000061798595 368569766 /nfs/dbraw/zinc/56/97/66/368569766.db2.gz GGPNLBNFNXMTCX-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO CC1(C)COCC[N@@H+]1Cc1ccccc1F ZINC000064517750 368609147 /nfs/dbraw/zinc/60/91/47/368609147.db2.gz OJZQDXLSXISNEI-UHFFFAOYSA-N 1 2 223.291 2.437 20 0 BEADLO CC1(C)COCC[N@H+]1Cc1ccccc1F ZINC000064517750 368609150 /nfs/dbraw/zinc/60/91/50/368609150.db2.gz OJZQDXLSXISNEI-UHFFFAOYSA-N 1 2 223.291 2.437 20 0 BEADLO Cc1ncccc1NC(=O)C(C)(C)c1c[nH+]c[nH]1 ZINC000622405466 370901379 /nfs/dbraw/zinc/90/13/79/370901379.db2.gz VDPFEQXHZOLCGF-UHFFFAOYSA-N 1 2 244.298 2.029 20 0 BEADLO Cc1ncccc1NC(=O)C(C)(C)c1c[nH]c[nH+]1 ZINC000622405466 370901381 /nfs/dbraw/zinc/90/13/81/370901381.db2.gz VDPFEQXHZOLCGF-UHFFFAOYSA-N 1 2 244.298 2.029 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@]2(C)CCCC[C@@H]2C)c[nH+]1 ZINC000457258164 203030193 /nfs/dbraw/zinc/03/01/93/203030193.db2.gz MEZVLDYXTJBZEI-ZANVPECISA-N 1 2 235.331 2.417 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)[C@H]2C[C@H]3C[C@H]3C2)c2[nH+]ccn21 ZINC000615963989 368800944 /nfs/dbraw/zinc/80/09/44/368800944.db2.gz UVVSBCINGJJOQO-PREPNJAASA-N 1 2 245.326 2.051 20 0 BEADLO C[C@@H]1C[C@H](NC(=O)[C@H]2CCC2(C)C)c2[nH+]ccn21 ZINC000615963973 368801150 /nfs/dbraw/zinc/80/11/50/368801150.db2.gz UTWMJRCDCSKNRB-MXWKQRLJSA-N 1 2 247.342 2.441 20 0 BEADLO CC(C)[C@H]1CCC[C@@H](NC(=O)Cn2cc[nH+]c2)C1 ZINC000073387423 368803756 /nfs/dbraw/zinc/80/37/56/368803756.db2.gz LVUOJJRDPYZFOD-QWHCGFSZSA-N 1 2 249.358 2.214 20 0 BEADLO CCC(C)(C)CC(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000073019124 368789804 /nfs/dbraw/zinc/78/98/04/368789804.db2.gz DDIULUUOAYUFGV-LLVKDONJSA-N 1 2 237.347 2.214 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)[C@H]1C[C@H]2C[C@H]2C1 ZINC000615961338 368796808 /nfs/dbraw/zinc/79/68/08/368796808.db2.gz QEQVRLFJWDSDRG-WYUUTHIRSA-N 1 2 247.342 2.126 20 0 BEADLO COc1cccc(NCc2[nH]cc[nH+]2)c1C ZINC000623645613 368966442 /nfs/dbraw/zinc/96/64/42/368966442.db2.gz FZXGSOXEUFZLHN-UHFFFAOYSA-N 1 2 217.272 2.339 20 0 BEADLO C[C@H]1CCC(C)(C)N1C(=O)CCc1[nH]cc[nH+]1 ZINC000616164785 368999658 /nfs/dbraw/zinc/99/96/58/368999658.db2.gz IIPFFUNDYZMIOJ-JTQLQIEISA-N 1 2 235.331 2.132 20 0 BEADLO CC[C@H](CC(F)F)C(=O)Nc1cc[nH+]cc1C ZINC000457556404 203073676 /nfs/dbraw/zinc/07/36/76/203073676.db2.gz UOZJELXIHKZQAB-SECBINFHSA-N 1 2 242.269 2.432 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H](C)C1CCC1 ZINC000457557095 203074450 /nfs/dbraw/zinc/07/44/50/203074450.db2.gz AVMPUVTVKQTKPA-JTQLQIEISA-N 1 2 232.327 2.441 20 0 BEADLO CC(C)CCCCC(=O)NCCc1[nH]cc[nH+]1 ZINC000457550436 203074645 /nfs/dbraw/zinc/07/46/45/203074645.db2.gz DQOWPUDTVHHJCC-UHFFFAOYSA-N 1 2 237.347 2.285 20 0 BEADLO CCCC1(C(=O)NCCc2cn(C)c[nH+]2)CCC1 ZINC000457860577 203113466 /nfs/dbraw/zinc/11/34/66/203113466.db2.gz OOMYPOLEMHPWBC-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO C[C@H](CC(=O)NCCC(C)(C)F)n1cc[nH+]c1 ZINC000618413139 369139887 /nfs/dbraw/zinc/13/98/87/369139887.db2.gz OGGGGODGNYNDAP-SNVBAGLBSA-N 1 2 241.310 2.089 20 0 BEADLO Cc1cccn2c(NC(=O)[C@H]3C[C@H]3C)c[nH+]c12 ZINC000619011129 369257365 /nfs/dbraw/zinc/25/73/65/369257365.db2.gz PYNNQQILRPFYOK-ZJUUUORDSA-N 1 2 229.283 2.237 20 0 BEADLO CCOCCC(=O)Nc1c[nH+]c2c(C)cccn12 ZINC000619013761 369257661 /nfs/dbraw/zinc/25/76/61/369257661.db2.gz YDZWDRPJRFIITG-UHFFFAOYSA-N 1 2 247.298 2.008 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N(C(=O)CCc2c[nH+]c[nH]2)C1 ZINC000619133835 369293170 /nfs/dbraw/zinc/29/31/70/369293170.db2.gz QAFLDQDJABQLFD-VXGBXAGGSA-N 1 2 249.358 2.379 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N(C(=O)CCc2c[nH]c[nH+]2)C1 ZINC000619133835 369293172 /nfs/dbraw/zinc/29/31/72/369293172.db2.gz QAFLDQDJABQLFD-VXGBXAGGSA-N 1 2 249.358 2.379 20 0 BEADLO COCc1cc(C[N@H+](C)[C@@H]2CC2(C)C)no1 ZINC000459515988 203295198 /nfs/dbraw/zinc/29/51/98/203295198.db2.gz MQVIBWHTRXVEDF-LLVKDONJSA-N 1 2 224.304 2.051 20 0 BEADLO COCc1cc(C[N@@H+](C)[C@@H]2CC2(C)C)no1 ZINC000459515988 203295201 /nfs/dbraw/zinc/29/52/01/203295201.db2.gz MQVIBWHTRXVEDF-LLVKDONJSA-N 1 2 224.304 2.051 20 0 BEADLO OCCC1C[NH+](Cc2cc(F)cc(Cl)c2)C1 ZINC000459594141 203308904 /nfs/dbraw/zinc/30/89/04/203308904.db2.gz PNJXQWDDWUDHER-UHFFFAOYSA-N 1 2 243.709 2.293 20 0 BEADLO COC(=O)c1ccc2c(c1)C[N@@H+](CC1(F)CC1)C2 ZINC000619424299 369340179 /nfs/dbraw/zinc/34/01/79/369340179.db2.gz RYIRNCSUXVHRKR-UHFFFAOYSA-N 1 2 249.285 2.291 20 0 BEADLO COC(=O)c1ccc2c(c1)C[N@H+](CC1(F)CC1)C2 ZINC000619424299 369340182 /nfs/dbraw/zinc/34/01/82/369340182.db2.gz RYIRNCSUXVHRKR-UHFFFAOYSA-N 1 2 249.285 2.291 20 0 BEADLO CCOC1C[NH+](Cc2ccc(C)c(OC)c2)C1 ZINC000459605465 203309728 /nfs/dbraw/zinc/30/97/28/203309728.db2.gz LPECKDZNKSYGAI-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO OCCC1C[NH+](Cc2cc(Cl)ccc2F)C1 ZINC000459595616 203312266 /nfs/dbraw/zinc/31/22/66/203312266.db2.gz RJKBRUYWEAPJFM-UHFFFAOYSA-N 1 2 243.709 2.293 20 0 BEADLO OCCC1C[NH+](Cc2ccsc2Cl)C1 ZINC000459599390 203312559 /nfs/dbraw/zinc/31/25/59/203312559.db2.gz YMEPYBFZHXBNOS-UHFFFAOYSA-N 1 2 231.748 2.216 20 0 BEADLO CCC(CC)(CC)NC(=O)C[NH+]1CC(C)(C)C1 ZINC000567749360 326255056 /nfs/dbraw/zinc/25/50/56/326255056.db2.gz HXRWTXUIEVTKMR-UHFFFAOYSA-N 1 2 240.391 2.413 20 0 BEADLO COc1cc(C)ccc1C[NH2+]CC(F)F ZINC000459547194 203299517 /nfs/dbraw/zinc/29/95/17/203299517.db2.gz OPYGBWPVJYHTBP-UHFFFAOYSA-N 1 2 215.243 2.358 20 0 BEADLO C[C@@H]([NH2+]Cc1cnc(C2CC2)nc1)C(C)(F)F ZINC000459572994 203302820 /nfs/dbraw/zinc/30/28/20/203302820.db2.gz REWYTCGILHPBRZ-MRVPVSSYSA-N 1 2 241.285 2.487 20 0 BEADLO COC1C[NH+](C/C=C/c2ccc(F)cc2)C1 ZINC000459572361 203304986 /nfs/dbraw/zinc/30/49/86/203304986.db2.gz AHJDAKQNMPULJG-NSCUHMNNSA-N 1 2 221.275 2.170 20 0 BEADLO CCn1c[nH+]cc1CNCC(F)(F)CC ZINC000623679171 369378809 /nfs/dbraw/zinc/37/88/09/369378809.db2.gz KWTFGIJWNOUAPI-UHFFFAOYSA-N 1 2 217.263 2.038 20 0 BEADLO CCOC1C[NH+](Cc2cc(C)ccc2OC)C1 ZINC000459610238 203316680 /nfs/dbraw/zinc/31/66/80/203316680.db2.gz RCDUQHFMBULCCE-UHFFFAOYSA-N 1 2 235.327 2.224 20 0 BEADLO Cc1ccc(C[NH+]2CC(OC(F)F)C2)s1 ZINC000459620914 203318504 /nfs/dbraw/zinc/31/85/04/203318504.db2.gz BDASQTWJPZWOBD-UHFFFAOYSA-N 1 2 233.283 2.480 20 0 BEADLO CCOC1(C)C[NH+](Cc2cnc(C)s2)C1 ZINC000459621146 203318876 /nfs/dbraw/zinc/31/88/76/203318876.db2.gz MXEJLBJYSPPKMR-UHFFFAOYSA-N 1 2 226.345 2.062 20 0 BEADLO CCOC1(C)C[NH+](Cc2ccc(C)o2)C1 ZINC000459619841 203319265 /nfs/dbraw/zinc/31/92/65/203319265.db2.gz KRRCWBKCMPOSLP-UHFFFAOYSA-N 1 2 209.289 2.199 20 0 BEADLO C[N@H+](Cc1noc2c1CCCC2)C1CC1 ZINC000108852754 369413186 /nfs/dbraw/zinc/41/31/86/369413186.db2.gz NTZUWKKOLCNZDO-UHFFFAOYSA-N 1 2 206.289 2.148 20 0 BEADLO C[N@@H+](Cc1noc2c1CCCC2)C1CC1 ZINC000108852754 369413190 /nfs/dbraw/zinc/41/31/90/369413190.db2.gz NTZUWKKOLCNZDO-UHFFFAOYSA-N 1 2 206.289 2.148 20 0 BEADLO CCOC1(C)C[NH+](C/C=C/c2ccncc2)C1 ZINC000459626558 203322205 /nfs/dbraw/zinc/32/22/05/203322205.db2.gz VAWQGDLCOIYZEA-SNAWJCMRSA-N 1 2 232.327 2.206 20 0 BEADLO CCC1(C)C[NH+](Cc2ccoc2C(=O)OC)C1 ZINC000459629895 203323520 /nfs/dbraw/zinc/32/35/20/203323520.db2.gz FYXMCCJJKCISPF-UHFFFAOYSA-N 1 2 237.299 2.298 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@@H+]1C[C@@H](C)CC(C)C ZINC000619621710 369497751 /nfs/dbraw/zinc/49/77/51/369497751.db2.gz DYPXETFYFBCTJG-SRVKXCTJSA-N 1 2 245.338 2.254 20 0 BEADLO COC(=O)[C@@H]1C[C@H](F)C[N@H+]1C[C@@H](C)CC(C)C ZINC000619621710 369497753 /nfs/dbraw/zinc/49/77/53/369497753.db2.gz DYPXETFYFBCTJG-SRVKXCTJSA-N 1 2 245.338 2.254 20 0 BEADLO CCCCc1cc(N[C@@H](CC)CO)nc[nH+]1 ZINC000631032096 370969642 /nfs/dbraw/zinc/96/96/42/370969642.db2.gz SSMNALCUQXJWPB-JTQLQIEISA-N 1 2 223.320 2.002 20 0 BEADLO Cc1ccoc1C[NH2+][C@@H](C)c1ccn(C)n1 ZINC000459755494 203356078 /nfs/dbraw/zinc/35/60/78/203356078.db2.gz OVEXZNMRXQRPEZ-JTQLQIEISA-N 1 2 219.288 2.172 20 0 BEADLO CCNc1[nH+]c(C(C)C)nc2[nH]ccc21 ZINC000631031883 370968595 /nfs/dbraw/zinc/96/85/95/370968595.db2.gz MOHGLJCRSLJAQD-UHFFFAOYSA-N 1 2 204.277 2.465 20 0 BEADLO CCOCC[N@H+](CC)[C@@H](C)c1nc(CC)no1 ZINC000157485622 326277986 /nfs/dbraw/zinc/27/79/86/326277986.db2.gz PBLMOJUQGCCWQY-JTQLQIEISA-N 1 2 241.335 2.051 20 0 BEADLO CCOCC[N@@H+](CC)[C@@H](C)c1nc(CC)no1 ZINC000157485622 326277987 /nfs/dbraw/zinc/27/79/87/326277987.db2.gz PBLMOJUQGCCWQY-JTQLQIEISA-N 1 2 241.335 2.051 20 0 BEADLO CC[C@@H]1C[C@@H](C)CN1C(=O)CCCn1cc[nH+]c1 ZINC000073344121 369586356 /nfs/dbraw/zinc/58/63/56/369586356.db2.gz ZQUJLQWCOCVWOA-CHWSQXEVSA-N 1 2 249.358 2.310 20 0 BEADLO C[C@@H]1CCN1C(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000620213094 369772576 /nfs/dbraw/zinc/77/25/76/369772576.db2.gz PZBWOKYPFZSIKO-LLVKDONJSA-N 1 2 241.294 2.107 20 0 BEADLO CC1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1[nH]cc[nH+]1 ZINC000620429771 369872972 /nfs/dbraw/zinc/87/29/72/369872972.db2.gz XDUWCHKOSATGMS-YOGCLGLASA-N 1 2 247.342 2.132 20 0 BEADLO Cc1cscc1C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620603720 369951300 /nfs/dbraw/zinc/95/13/00/369951300.db2.gz MUHUUVOBLGXJSU-SECBINFHSA-N 1 2 249.339 2.281 20 0 BEADLO C[C@@H](NC(=O)[C@H]1CCC(C)(C)C1)c1[nH+]ccn1C ZINC000620604195 369952889 /nfs/dbraw/zinc/95/28/89/369952889.db2.gz PMZMSEFDBDYBAY-MNOVXSKESA-N 1 2 249.358 2.424 20 0 BEADLO Cc1cc(C(=O)N[C@@H](C)c2[nH+]ccn2C)oc1C ZINC000620604893 369953240 /nfs/dbraw/zinc/95/32/40/369953240.db2.gz YAFOMUGYQZFMIC-VIFPVBQESA-N 1 2 247.298 2.121 20 0 BEADLO CCCC[C@@H](C)C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620606491 369954774 /nfs/dbraw/zinc/95/47/74/369954774.db2.gz UQKZMVSXJPDUEJ-MNOVXSKESA-N 1 2 237.347 2.424 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)N[C@@H](C)c1[nH+]ccn1C ZINC000620607268 369956064 /nfs/dbraw/zinc/95/60/64/369956064.db2.gz FYACQDKJKOEBPM-HBNTYKKESA-N 1 2 235.331 2.034 20 0 BEADLO C[C@H](NC(=O)[C@H]1CCC1(C)C)c1[nH+]ccn1C ZINC000620612246 369958222 /nfs/dbraw/zinc/95/82/22/369958222.db2.gz SIHOPELHCRGUQD-VHSXEESVSA-N 1 2 235.331 2.034 20 0 BEADLO CCO[C@H](C)C(=O)Nc1ccn2cc(C)[nH+]c2c1 ZINC000620648890 369972554 /nfs/dbraw/zinc/97/25/54/369972554.db2.gz NUIZCDYRGQHNIB-SNVBAGLBSA-N 1 2 247.298 2.006 20 0 BEADLO CCC(C)(C)C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000620594882 369948060 /nfs/dbraw/zinc/94/80/60/369948060.db2.gz IARNKJQJXGIUFM-SECBINFHSA-N 1 2 223.320 2.034 20 0 BEADLO FC(F)(F)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000307306553 369999062 /nfs/dbraw/zinc/99/90/62/369999062.db2.gz YCQAUYAEALGKGN-NSHDSACASA-N 1 2 245.244 2.450 20 0 BEADLO FC(F)(F)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000307306553 369999064 /nfs/dbraw/zinc/99/90/64/369999064.db2.gz YCQAUYAEALGKGN-NSHDSACASA-N 1 2 245.244 2.450 20 0 BEADLO Cc1cc(N)nc(SC2CC(C)(C)C2)[nH+]1 ZINC000631005426 370124781 /nfs/dbraw/zinc/12/47/81/370124781.db2.gz JECINNSOQDBEID-UHFFFAOYSA-N 1 2 223.345 2.478 20 0 BEADLO Cc1cnc([C@@H](C)[NH2+]Cc2nccnc2C)s1 ZINC000621339920 370273665 /nfs/dbraw/zinc/27/36/65/370273665.db2.gz PSMCCTGYNFMZJJ-SNVBAGLBSA-N 1 2 248.355 2.401 20 0 BEADLO CCOCCCCNc1cc(CC)[nH+]cn1 ZINC000309971592 370282550 /nfs/dbraw/zinc/28/25/50/370282550.db2.gz PVBZOGBQNFJBMI-UHFFFAOYSA-N 1 2 223.320 2.268 20 0 BEADLO CC1(C)CC[C@H]1C(=O)NCCNc1cccc[nH+]1 ZINC000621424033 370348735 /nfs/dbraw/zinc/34/87/35/370348735.db2.gz KAVFWHLQGIJGEF-NSHDSACASA-N 1 2 247.342 2.046 20 0 BEADLO CC[N@H+](Cc1ccccn1)Cc1nccnc1C ZINC000621716064 370464835 /nfs/dbraw/zinc/46/48/35/370464835.db2.gz QCXGYQHXUOWKTE-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO CC[N@@H+](Cc1ccccn1)Cc1nccnc1C ZINC000621716064 370464838 /nfs/dbraw/zinc/46/48/38/370464838.db2.gz QCXGYQHXUOWKTE-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO Cn1ccc(C[NH+]2CC(Cc3ccsc3)C2)n1 ZINC000621741136 370501041 /nfs/dbraw/zinc/50/10/41/370501041.db2.gz CZXIYOYNENTWOF-UHFFFAOYSA-N 1 2 247.367 2.156 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nccnc2C)C[C@H](CC)O1 ZINC000621731487 370484086 /nfs/dbraw/zinc/48/40/86/370484086.db2.gz PSDXWNFCBBXFQC-BETUJISGSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nccnc2C)C[C@H](CC)O1 ZINC000621731487 370484091 /nfs/dbraw/zinc/48/40/91/370484091.db2.gz PSDXWNFCBBXFQC-BETUJISGSA-N 1 2 249.358 2.174 20 0 BEADLO Cn1ncc(Cl)c1C[NH+]1CC(CC2CC2)C1 ZINC000621740297 370499989 /nfs/dbraw/zinc/49/99/89/370499989.db2.gz ITXSCXWJDWRZIY-UHFFFAOYSA-N 1 2 239.750 2.305 20 0 BEADLO CCc1cc(NCc2cscn2)nc[nH+]1 ZINC000066738155 370606839 /nfs/dbraw/zinc/60/68/39/370606839.db2.gz PVJZZSHAGFFEKC-UHFFFAOYSA-N 1 2 220.301 2.108 20 0 BEADLO CCNC(=O)[C@H](C)Nc1cc2ccccc2c[nH+]1 ZINC000631040069 370997462 /nfs/dbraw/zinc/99/74/62/370997462.db2.gz APKAHANZZSOFSV-JTQLQIEISA-N 1 2 243.310 2.171 20 0 BEADLO CCOC(=O)C[C@H](C)Nc1cc(C2CC2)[nH+]cn1 ZINC000260553205 370998965 /nfs/dbraw/zinc/99/89/65/370998965.db2.gz VXEAEYKOPVRHMR-VIFPVBQESA-N 1 2 249.314 2.108 20 0 BEADLO C[C@@H]1CCN(C(=O)C(C)(C)c2c[nH+]c[nH]2)C[C@H]1C ZINC000621938464 370610190 /nfs/dbraw/zinc/61/01/90/370610190.db2.gz BQQLIFMIDCMNSQ-GHMZBOCLSA-N 1 2 249.358 2.192 20 0 BEADLO CCCNC(=O)CNc1cc2ccccc2c[nH+]1 ZINC000631041967 371003380 /nfs/dbraw/zinc/00/33/80/371003380.db2.gz MZBKPXQLTXOPCG-UHFFFAOYSA-N 1 2 243.310 2.173 20 0 BEADLO COc1cncc(C[NH2+]Cc2nccs2)c1C ZINC000631048154 371065394 /nfs/dbraw/zinc/06/53/94/371065394.db2.gz SXYNCQRIOYNIRZ-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO CC(C)(C)c1nc(NCC(F)(F)F)cc[nH+]1 ZINC000623892392 371142811 /nfs/dbraw/zinc/14/28/11/371142811.db2.gz MLIGZSMVSQDKPM-UHFFFAOYSA-N 1 2 233.237 2.170 20 0 BEADLO C[C@@H]([NH2+]C1(C(F)F)CC1)[C@@H]1CCCCO1 ZINC000623979133 371212943 /nfs/dbraw/zinc/21/29/43/371212943.db2.gz RECWLTWGYBTOBR-BDAKNGLRSA-N 1 2 219.275 2.331 20 0 BEADLO Cc1ccc(C[NH2+][C@@H](C)c2nncn2C)c(F)c1 ZINC000631063566 371237351 /nfs/dbraw/zinc/23/73/51/371237351.db2.gz MGPRZPQTHSTTCD-JTQLQIEISA-N 1 2 248.305 2.113 20 0 BEADLO COc1ccc[nH+]c1N1CCSC(C)(C)C1 ZINC000624025646 371256716 /nfs/dbraw/zinc/25/67/16/371256716.db2.gz HYJYNLYQSOXBIN-UHFFFAOYSA-N 1 2 238.356 2.422 20 0 BEADLO CCCCc1cc(NC[C@H]2CCCOC2)nc[nH+]1 ZINC000631067586 371280811 /nfs/dbraw/zinc/28/08/11/371280811.db2.gz CBQWANKVGWHKLA-GFCCVEGCSA-N 1 2 249.358 2.080 20 0 BEADLO Cc1ccc(C[NH2+]Cc2cc[nH]n2)c(F)c1 ZINC000631067461 371269417 /nfs/dbraw/zinc/26/94/17/371269417.db2.gz MMPOXPRZZZBCMN-UHFFFAOYSA-N 1 2 219.263 2.147 20 0 BEADLO C[C@@H](CO)CNc1cc2ccccc2c[nH+]1 ZINC000631072075 371337194 /nfs/dbraw/zinc/33/71/94/371337194.db2.gz UAIBPHGDSYGRRZ-SNVBAGLBSA-N 1 2 216.284 2.275 20 0 BEADLO CCC(F)(F)C[NH2+][C@@H]1CN(C2CC2)C[C@H]1C ZINC000624147624 371342039 /nfs/dbraw/zinc/34/20/39/371342039.db2.gz GMSLGFYXPVDDDF-MWLCHTKSSA-N 1 2 232.318 2.104 20 0 BEADLO C/C=C\CNC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000624223065 371411182 /nfs/dbraw/zinc/41/11/82/371411182.db2.gz NNSOQARYDPUULR-PLNGDYQASA-N 1 2 233.315 2.074 20 0 BEADLO C/C=C\CNC(=O)NCc1c[nH+]c(C)cc1C ZINC000624178699 371370751 /nfs/dbraw/zinc/37/07/51/371370751.db2.gz YNSMPFRNDAVIQN-PLNGDYQASA-N 1 2 233.315 2.074 20 0 BEADLO C/C=C/CNC(=O)NCc1c[nH+]c(C)cc1C ZINC000624178700 371370859 /nfs/dbraw/zinc/37/08/59/371370859.db2.gz YNSMPFRNDAVIQN-SNAWJCMRSA-N 1 2 233.315 2.074 20 0 BEADLO CC(C)c1nc(N[C@H](C)[C@H](C)CO)cc[nH+]1 ZINC000156660520 371483455 /nfs/dbraw/zinc/48/34/55/371483455.db2.gz YMCNBYWAAKSZFB-NXEZZACHSA-N 1 2 223.320 2.029 20 0 BEADLO Cc1nc([C@H](C)[NH2+]Cc2ccc[nH]c2=O)cs1 ZINC000624258719 371442062 /nfs/dbraw/zinc/44/20/62/371442062.db2.gz RHUBPQUXKPAQRZ-QMMMGPOBSA-N 1 2 249.339 2.403 20 0 BEADLO Cc1cc(C(=O)NCC(C)(C)C)c2[nH+]ccn2c1 ZINC000624563271 371541544 /nfs/dbraw/zinc/54/15/44/371541544.db2.gz DQQWMCKNILEYLG-UHFFFAOYSA-N 1 2 245.326 2.419 20 0 BEADLO CCC(CC)[C@@H](C)C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000627370203 371587362 /nfs/dbraw/zinc/58/73/62/371587362.db2.gz QQZBXXKDQWVGIG-SNVBAGLBSA-N 1 2 249.358 2.367 20 0 BEADLO CCC(CC)[C@@H](C)C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000627370203 371587366 /nfs/dbraw/zinc/58/73/66/371587366.db2.gz QQZBXXKDQWVGIG-SNVBAGLBSA-N 1 2 249.358 2.367 20 0 BEADLO C[C@]1(C(=O)N2CCc3[nH]c[nH+]c3C2)CC=CCC1 ZINC000627373315 371592908 /nfs/dbraw/zinc/59/29/08/371592908.db2.gz NVJKNFXTCKUTOX-AWEZNQCLSA-N 1 2 245.326 2.041 20 0 BEADLO C[C@]1(C(=O)N2CCc3[nH+]c[nH]c3C2)CC=CCC1 ZINC000627373315 371592913 /nfs/dbraw/zinc/59/29/13/371592913.db2.gz NVJKNFXTCKUTOX-AWEZNQCLSA-N 1 2 245.326 2.041 20 0 BEADLO CCc1cc(NC[C@H](O)C(CC)CC)nc[nH+]1 ZINC000226530636 371687800 /nfs/dbraw/zinc/68/78/00/371687800.db2.gz QEABCEILHBWRRG-LBPRGKRZSA-N 1 2 237.347 2.248 20 0 BEADLO O=C(C1CC=CC1)N1CCC(n2cc[nH+]c2)CC1 ZINC000151441971 181864518 /nfs/dbraw/zinc/86/45/18/181864518.db2.gz OZODCPUBJMXSMY-UHFFFAOYSA-N 1 2 245.326 2.013 20 0 BEADLO CCCCc1cc(NCC2(OC)CCC2)nc[nH+]1 ZINC000631199559 372229698 /nfs/dbraw/zinc/22/96/98/372229698.db2.gz CCMVMQPGBBECAA-UHFFFAOYSA-N 1 2 249.358 2.222 20 0 BEADLO Cc1[nH]c(CNc2cncc(N(C)C)c2)[nH+]c1C ZINC000631203363 372233465 /nfs/dbraw/zinc/23/34/65/372233465.db2.gz NGJXVVDWYHZADA-UHFFFAOYSA-N 1 2 245.330 2.100 20 0 BEADLO Cc1ccncc1CNc1c[nH+]cc(N(C)C)c1 ZINC000631203626 372233989 /nfs/dbraw/zinc/23/39/89/372233989.db2.gz QWOAOMMRUGJRBR-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO O=C(NC1CCC1)c1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000631138680 372206402 /nfs/dbraw/zinc/20/64/02/372206402.db2.gz ZCLBRQKJZNWSJN-UHFFFAOYSA-N 1 2 241.294 2.359 20 0 BEADLO CCn1cc[nH+]c1CNc1cnn2c1CCCC2 ZINC000631230935 372251716 /nfs/dbraw/zinc/25/17/16/372251716.db2.gz CZBLHVNJDICPRD-UHFFFAOYSA-N 1 2 245.330 2.048 20 0 BEADLO FC(F)(F)[C@@H]1C[C@H]1[NH2+]Cc1cscn1 ZINC000631263912 372269285 /nfs/dbraw/zinc/26/92/85/372269285.db2.gz WDLCSVRRGUIMGL-RNFRBKRXSA-N 1 2 222.235 2.184 20 0 BEADLO CC[C@H](Nc1cc2ccccc2c[nH+]1)C(=O)NC ZINC000631296977 372282213 /nfs/dbraw/zinc/28/22/13/372282213.db2.gz QZQVWRMKNKGVKT-LBPRGKRZSA-N 1 2 243.310 2.171 20 0 BEADLO CCCCc1cc(NCc2cnc(C)o2)nc[nH+]1 ZINC000631298327 372283272 /nfs/dbraw/zinc/28/32/72/372283272.db2.gz GFDOVJSKNPDXPN-UHFFFAOYSA-N 1 2 246.314 2.150 20 0 BEADLO Cc1nc(N(C)Cc2ccns2)c(C)c(C)[nH+]1 ZINC000631352801 372309258 /nfs/dbraw/zinc/30/92/58/372309258.db2.gz DCZMTFXXIWQOHL-UHFFFAOYSA-N 1 2 248.355 2.495 20 0 BEADLO Cc1cc(NCC(C)(C)F)nc(C2CC2)[nH+]1 ZINC000631408408 372343091 /nfs/dbraw/zinc/34/30/91/372343091.db2.gz QRGQXBGIMJGLIR-UHFFFAOYSA-N 1 2 223.295 2.244 20 0 BEADLO CCCc1ccc(C(=O)NCc2c[nH+]c[nH]2)s1 ZINC000631413869 372347124 /nfs/dbraw/zinc/34/71/24/372347124.db2.gz LVUNHPCLGBKDDV-UHFFFAOYSA-N 1 2 249.339 2.354 20 0 BEADLO CCCc1ccc(C(=O)NCc2c[nH]c[nH+]2)s1 ZINC000631413869 372347129 /nfs/dbraw/zinc/34/71/29/372347129.db2.gz LVUNHPCLGBKDDV-UHFFFAOYSA-N 1 2 249.339 2.354 20 0 BEADLO CCCCc1cc(N[C@H]2CCC[C@@H]2O)nc[nH+]1 ZINC000631522791 372408460 /nfs/dbraw/zinc/40/84/60/372408460.db2.gz SSDULDQGEWPKQG-RYUDHWBXSA-N 1 2 235.331 2.145 20 0 BEADLO C[C@H]1c2cccn2CC[N@H+]1CC(F)F ZINC000171668705 372725820 /nfs/dbraw/zinc/72/58/20/372725820.db2.gz MXNFKBOZCVBMMM-QMMMGPOBSA-N 1 2 200.232 2.130 20 0 BEADLO C[C@H]1c2cccn2CC[N@@H+]1CC(F)F ZINC000171668705 372725828 /nfs/dbraw/zinc/72/58/28/372725828.db2.gz MXNFKBOZCVBMMM-QMMMGPOBSA-N 1 2 200.232 2.130 20 0 BEADLO FC(F)CN1CC[C@@H](CNc2cccc[nH+]2)C1 ZINC000171991719 372849282 /nfs/dbraw/zinc/84/92/82/372849282.db2.gz MRHQLAFPVRQVQX-JTQLQIEISA-N 1 2 241.285 2.081 20 0 BEADLO O=C(Cc1ccc(F)cc1)Nc1cc[nH+]cc1O ZINC000109890437 182036547 /nfs/dbraw/zinc/03/65/47/182036547.db2.gz UYONEXVEFZRPFS-UHFFFAOYSA-N 1 2 246.241 2.108 20 0 BEADLO CCO[C@@H]1C[C@H]([N@H+](C)CC(F)F)C1(C)C ZINC000172665895 373039369 /nfs/dbraw/zinc/03/93/69/373039369.db2.gz RBFHVDOWPQPAAK-DTWKUNHWSA-N 1 2 221.291 2.387 20 0 BEADLO CCO[C@@H]1C[C@H]([N@@H+](C)CC(F)F)C1(C)C ZINC000172665895 373039377 /nfs/dbraw/zinc/03/93/77/373039377.db2.gz RBFHVDOWPQPAAK-DTWKUNHWSA-N 1 2 221.291 2.387 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[NH2+][C@H](C)CSC ZINC000180999603 205663879 /nfs/dbraw/zinc/66/38/79/205663879.db2.gz HNZWQJBYVINFBH-MNOVXSKESA-N 1 2 247.404 2.305 20 0 BEADLO O=C(NCCCn1cc[nH+]c1)C1=CCCCCC1 ZINC000274841139 182177382 /nfs/dbraw/zinc/17/73/82/182177382.db2.gz FICFCZCFIVFGRA-UHFFFAOYSA-N 1 2 247.342 2.280 20 0 BEADLO O=C(NCCCn1cc[nH+]c1)C1CCCCCC1 ZINC000101947761 182177676 /nfs/dbraw/zinc/17/76/76/182177676.db2.gz YNADJZUUOHFONU-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO CCCC[C@@H]([NH2+]CC(C)(C)OCC)C(=O)OC ZINC000187778601 205815079 /nfs/dbraw/zinc/81/50/79/205815079.db2.gz XZDAGAUQMXCHGH-LLVKDONJSA-N 1 2 245.363 2.123 20 0 BEADLO Cc1[nH]c(C(=O)NCc2csc(C)c2C)c[nH+]1 ZINC000633973379 373875259 /nfs/dbraw/zinc/87/52/59/373875259.db2.gz OWEZXYZPERRUFI-UHFFFAOYSA-N 1 2 249.339 2.326 20 0 BEADLO O=C(NCCn1cc[nH+]c1)C1CCCCCCC1 ZINC000172718115 182215075 /nfs/dbraw/zinc/21/50/75/182215075.db2.gz DNIZEWHKEGWVDJ-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO COc1cnccc1[C@H](C)[NH2+]Cc1cscn1 ZINC000189570120 205870092 /nfs/dbraw/zinc/87/00/92/205870092.db2.gz PBVASMNUWHKRRS-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO C[C@H](CC1CCC1)NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000634370697 374219731 /nfs/dbraw/zinc/21/97/31/374219731.db2.gz BURJIFAIDLSYGA-WDEREUQCSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](CC1CCC1)NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000634370697 374219740 /nfs/dbraw/zinc/21/97/40/374219740.db2.gz BURJIFAIDLSYGA-WDEREUQCSA-N 1 2 249.358 2.283 20 0 BEADLO CCCCCC[NH2+][C@@](CC)(COC)C(=O)OC ZINC001643329267 1172455770 /nfs/dbraw/zinc/45/57/70/1172455770.db2.gz FZQYQGDHJZRLIC-ZDUSSCGKSA-N 1 2 245.363 2.125 20 0 BEADLO O=C(N[C@@H]1CC=CCC1)c1ccc2[nH+]ccn2c1 ZINC000172484761 182291627 /nfs/dbraw/zinc/29/16/27/182291627.db2.gz VNLXVUNMECSKPZ-GFCCVEGCSA-N 1 2 241.294 2.173 20 0 BEADLO CC[C@@H](C)[N@@H+](CC(=O)OC)C[C@@H](F)CC ZINC000440488021 206080466 /nfs/dbraw/zinc/08/04/66/206080466.db2.gz CMZSNELSFPXWNO-ZJUUUORDSA-N 1 2 219.300 2.008 20 0 BEADLO CC[C@@H](C)[N@H+](CC(=O)OC)C[C@@H](F)CC ZINC000440488021 206080471 /nfs/dbraw/zinc/08/04/71/206080471.db2.gz CMZSNELSFPXWNO-ZJUUUORDSA-N 1 2 219.300 2.008 20 0 BEADLO C[C@@H]1CN(c2cccc[nH+]2)[C@@H](C)[C@H](C)O1 ZINC000445663524 206084810 /nfs/dbraw/zinc/08/48/10/206084810.db2.gz HOOHXNWBIIKYRQ-VWYCJHECSA-N 1 2 206.289 2.084 20 0 BEADLO COc1cc(C)c(C[NH2+]CC(F)F)c(C)n1 ZINC000459544311 206133634 /nfs/dbraw/zinc/13/36/34/206133634.db2.gz JZIWWIRDEBLJFH-UHFFFAOYSA-N 1 2 230.258 2.062 20 0 BEADLO COC1(C)C[NH+](Cc2cc(F)ccc2C)C1 ZINC000459581249 206135772 /nfs/dbraw/zinc/13/57/72/206135772.db2.gz KNECJKGQBYMGIT-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)C1(CCF)CC1 ZINC000290830894 182374583 /nfs/dbraw/zinc/37/45/83/182374583.db2.gz MVTYNHKWCYJULB-UHFFFAOYSA-N 1 2 247.273 2.413 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)C1CCC1 ZINC000266183339 182374956 /nfs/dbraw/zinc/37/49/56/182374956.db2.gz YTNNKPFCJRCFKC-UHFFFAOYSA-N 1 2 215.256 2.073 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)C1CCC1 ZINC000280800305 182384885 /nfs/dbraw/zinc/38/48/85/182384885.db2.gz QCZGUFBLGHQJAY-UHFFFAOYSA-N 1 2 215.256 2.073 20 0 BEADLO OCCCCN(c1[nH]c2ccccc2[nH+]1)C1CC1 ZINC000301891748 183048308 /nfs/dbraw/zinc/04/83/08/183048308.db2.gz RPBVSBICROQFOK-UHFFFAOYSA-N 1 2 245.326 2.304 20 0 BEADLO OCC(F)(F)C[NH2+]C/C=C\c1ccc(F)cc1 ZINC000341539509 183033050 /nfs/dbraw/zinc/03/30/50/183033050.db2.gz BWPDXELSAUDJAN-UPHRSURJSA-N 1 2 245.244 2.056 20 0 BEADLO OCC(F)(F)C[NH2+]Cc1ccc(Cl)cc1 ZINC000183888992 183033139 /nfs/dbraw/zinc/03/31/39/183033139.db2.gz YMTFXERTNRGVFO-UHFFFAOYSA-N 1 2 235.661 2.057 20 0 BEADLO OCC(F)(F)C[NH2+]Cc1cccc(Cl)c1 ZINC000183872599 183034163 /nfs/dbraw/zinc/03/41/63/183034163.db2.gz YHWVRMQVHWALTK-UHFFFAOYSA-N 1 2 235.661 2.057 20 0 BEADLO OCC(F)(F)C[NH2+][C@@H]1CCCc2ccccc21 ZINC000184697123 183035380 /nfs/dbraw/zinc/03/53/80/183035380.db2.gz LQZUAXSJKWIRQA-GFCCVEGCSA-N 1 2 241.281 2.281 20 0 BEADLO OCC(F)(F)C[NH2+][C@@H]1CCCc2sccc21 ZINC000231793008 183035412 /nfs/dbraw/zinc/03/54/12/183035412.db2.gz KCTBUZVAVYWAGS-SECBINFHSA-N 1 2 247.310 2.343 20 0 BEADLO OCC1(CNc2cc(C(F)(F)F)cc[nH+]2)CC1 ZINC000149435949 183036843 /nfs/dbraw/zinc/03/68/43/183036843.db2.gz TYSWRSPZILXLSK-UHFFFAOYSA-N 1 2 246.232 2.285 20 0 BEADLO OCCCC[N@@H+]1CCn2c(cc3ccccc32)C1 ZINC000361498552 183051180 /nfs/dbraw/zinc/05/11/80/183051180.db2.gz LINTUJPADGBEHF-UHFFFAOYSA-N 1 2 244.338 2.229 20 0 BEADLO OCCCC[N@H+]1CCn2c(cc3ccccc32)C1 ZINC000361498552 183051185 /nfs/dbraw/zinc/05/11/85/183051185.db2.gz LINTUJPADGBEHF-UHFFFAOYSA-N 1 2 244.338 2.229 20 0 BEADLO OCCCCNc1ccc2ccccc2[nH+]1 ZINC000141278075 183053194 /nfs/dbraw/zinc/05/31/94/183053194.db2.gz LZUMOJGETJSSAZ-UHFFFAOYSA-N 1 2 216.284 2.419 20 0 BEADLO OCC[N@H+](Cc1csc(Cl)n1)C1CCC1 ZINC000296160593 183069969 /nfs/dbraw/zinc/06/99/69/183069969.db2.gz YOPDJESRAYDXHD-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO OCC[N@@H+](Cc1csc(Cl)n1)C1CCC1 ZINC000296160593 183069971 /nfs/dbraw/zinc/06/99/71/183069971.db2.gz YOPDJESRAYDXHD-UHFFFAOYSA-N 1 2 246.763 2.143 20 0 BEADLO OCC[N@H+](Cc1cscn1)Cc1ccccc1 ZINC000049752841 183070316 /nfs/dbraw/zinc/07/03/16/183070316.db2.gz ZTBFITRSXPOXMT-UHFFFAOYSA-N 1 2 248.351 2.138 20 0 BEADLO OCC[N@@H+](Cc1cscn1)Cc1ccccc1 ZINC000049752841 183070317 /nfs/dbraw/zinc/07/03/17/183070317.db2.gz ZTBFITRSXPOXMT-UHFFFAOYSA-N 1 2 248.351 2.138 20 0 BEADLO CCCC[C@H](COC)Nc1cc(C)[nH+]cn1 ZINC000301273671 169005102 /nfs/dbraw/zinc/00/51/02/169005102.db2.gz KZLOKLUKGSAODY-LLVKDONJSA-N 1 2 223.320 2.402 20 0 BEADLO OC[C@@H]1CCCC[C@@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000266217587 183118421 /nfs/dbraw/zinc/11/84/21/183118421.db2.gz PNOVFBZBAKVAKE-RYUDHWBXSA-N 1 2 247.342 2.317 20 0 BEADLO CCCC[C@H]([NH2+][C@@H]1CSC[C@H]1C)C(=O)OC ZINC000310002927 169013447 /nfs/dbraw/zinc/01/34/47/169013447.db2.gz FMSJELPPXCBLEO-OUAUKWLOSA-N 1 2 245.388 2.059 20 0 BEADLO OC[C@@H]([NH2+]C/C=C/Cl)c1c(F)cccc1F ZINC000273131588 183107842 /nfs/dbraw/zinc/10/78/42/183107842.db2.gz RMPXECVIAPZQDX-JYBNPQIESA-N 1 2 247.672 2.340 20 0 BEADLO OC[C@H](CNc1cccc[nH+]1)Cc1ccccc1 ZINC000362743033 183139017 /nfs/dbraw/zinc/13/90/17/183139017.db2.gz VBXOFYNSTXSHPC-AWEZNQCLSA-N 1 2 242.322 2.345 20 0 BEADLO OC[C@@H]1CCC[C@@H](Nc2cc[nH+]c(C3CC3)n2)C1 ZINC000298160793 183122165 /nfs/dbraw/zinc/12/21/65/183122165.db2.gz DNRJUGNWOXOOFK-ZYHUDNBSSA-N 1 2 247.342 2.317 20 0 BEADLO OC[C@@H]1CCC[C@H](Nc2cc[nH+]c(C3CC3)n2)C1 ZINC000298160791 183123128 /nfs/dbraw/zinc/12/31/28/183123128.db2.gz DNRJUGNWOXOOFK-PWSUYJOCSA-N 1 2 247.342 2.317 20 0 BEADLO CCCCc1nc(C[N@@H+]2CC[C@H](O)C2)cs1 ZINC000152635822 169026495 /nfs/dbraw/zinc/02/64/95/169026495.db2.gz HJAWXDKYDGCGOD-NSHDSACASA-N 1 2 240.372 2.052 20 0 BEADLO CCCCc1nc(C[N@H+]2CC[C@H](O)C2)cs1 ZINC000152635822 169026497 /nfs/dbraw/zinc/02/64/97/169026497.db2.gz HJAWXDKYDGCGOD-NSHDSACASA-N 1 2 240.372 2.052 20 0 BEADLO CCCCc1noc(C[N@@H+]2C[C@H](C)[C@H]2C)n1 ZINC000339575910 169031675 /nfs/dbraw/zinc/03/16/75/169031675.db2.gz UPQFBEKAWQFDSU-VHSXEESVSA-N 1 2 223.320 2.252 20 0 BEADLO CCCCc1noc(C[N@H+]2C[C@H](C)[C@H]2C)n1 ZINC000339575910 169031678 /nfs/dbraw/zinc/03/16/78/169031678.db2.gz UPQFBEKAWQFDSU-VHSXEESVSA-N 1 2 223.320 2.252 20 0 BEADLO OC[C@H]1CCC[C@H](Nc2cc[nH+]c(C3CC3)n2)C1 ZINC000298160789 183152084 /nfs/dbraw/zinc/15/20/84/183152084.db2.gz DNRJUGNWOXOOFK-JQWIXIFHSA-N 1 2 247.342 2.317 20 0 BEADLO OCc1cccc(NCc2ccsc2)[nH+]1 ZINC000336739034 183168253 /nfs/dbraw/zinc/16/82/53/183168253.db2.gz SANSZDJGWPRJAK-UHFFFAOYSA-N 1 2 220.297 2.248 20 0 BEADLO O[C@@H]1CCCCC[C@H]1Nc1cccc[nH+]1 ZINC000130802336 183188202 /nfs/dbraw/zinc/18/82/02/183188202.db2.gz FNVWJECMDGZZNF-GHMZBOCLSA-N 1 2 206.289 2.187 20 0 BEADLO O[C@@H]1CCCC[C@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000112554873 183192507 /nfs/dbraw/zinc/19/25/07/183192507.db2.gz VHZWUVRBEDKISB-GHMZBOCLSA-N 1 2 233.315 2.069 20 0 BEADLO CCC[N@H+](CC(=O)OC)Cc1ccccc1F ZINC000050065752 169100441 /nfs/dbraw/zinc/10/04/41/169100441.db2.gz SLAYGOBRMKKDSO-UHFFFAOYSA-N 1 2 239.290 2.211 20 0 BEADLO CCC[N@@H+](CC(=O)OC)Cc1ccccc1F ZINC000050065752 169100443 /nfs/dbraw/zinc/10/04/43/169100443.db2.gz SLAYGOBRMKKDSO-UHFFFAOYSA-N 1 2 239.290 2.211 20 0 BEADLO CCCN(C)c1[nH+]c2ccccc2n1C ZINC000179286822 169089611 /nfs/dbraw/zinc/08/96/11/169089611.db2.gz QFNINODLBDZFSY-UHFFFAOYSA-N 1 2 203.289 2.420 20 0 BEADLO CCC[N@H+](C/C=C/Cl)CC(=O)OCC ZINC000049949271 169090589 /nfs/dbraw/zinc/09/05/89/169090589.db2.gz WWHDSIKAMMTDCS-AATRIKPKSA-N 1 2 219.712 2.014 20 0 BEADLO CCC[N@@H+](C/C=C/Cl)CC(=O)OCC ZINC000049949271 169090590 /nfs/dbraw/zinc/09/05/90/169090590.db2.gz WWHDSIKAMMTDCS-AATRIKPKSA-N 1 2 219.712 2.014 20 0 BEADLO CCC[N@H+](CC(=O)OCC)Cc1ccc(C)o1 ZINC000050052195 169101173 /nfs/dbraw/zinc/10/11/73/169101173.db2.gz WLOVZWNOOAGREV-UHFFFAOYSA-N 1 2 239.315 2.363 20 0 BEADLO CCC[N@@H+](CC(=O)OCC)Cc1ccc(C)o1 ZINC000050052195 169101175 /nfs/dbraw/zinc/10/11/75/169101175.db2.gz WLOVZWNOOAGREV-UHFFFAOYSA-N 1 2 239.315 2.363 20 0 BEADLO CCCN(CC(F)F)c1cc(C)[nH+]cn1 ZINC000301246257 169109329 /nfs/dbraw/zinc/10/93/29/169109329.db2.gz HRPGBYNPWPKWEO-UHFFFAOYSA-N 1 2 215.247 2.267 20 0 BEADLO O[C@H]1CCCC[C@@H]1Nc1cc[nH+]c2ccncc12 ZINC000267244556 183232664 /nfs/dbraw/zinc/23/26/64/183232664.db2.gz SMKKDJIEXFNQSP-KBPBESRZSA-N 1 2 243.310 2.345 20 0 BEADLO CCC[N@H+](CCCC(=O)OCC)CC(F)F ZINC000102400103 169153561 /nfs/dbraw/zinc/15/35/61/169153561.db2.gz HEPQWRYVTINVAM-UHFFFAOYSA-N 1 2 237.290 2.307 20 0 BEADLO CCC[N@@H+](CCCC(=O)OCC)CC(F)F ZINC000102400103 169153562 /nfs/dbraw/zinc/15/35/62/169153562.db2.gz HEPQWRYVTINVAM-UHFFFAOYSA-N 1 2 237.290 2.307 20 0 BEADLO c1cc(-c2noc([C@@H]3CSC[NH2+]3)n2)cs1 ZINC000229003256 183333728 /nfs/dbraw/zinc/33/37/28/183333728.db2.gz ATEKRFXZPKUQGJ-ZETCQYMHSA-N 1 2 239.325 2.133 20 0 BEADLO c1c[nH]c([C@@H]2CCC[N@H+]2Cc2cnns2)c1 ZINC000295631273 183327898 /nfs/dbraw/zinc/32/78/98/183327898.db2.gz BZWCIMGYCCXECZ-NSHDSACASA-N 1 2 234.328 2.203 20 0 BEADLO c1c[nH]c([C@@H]2CCC[N@@H+]2Cc2cnns2)c1 ZINC000295631273 183327901 /nfs/dbraw/zinc/32/79/01/183327901.db2.gz BZWCIMGYCCXECZ-NSHDSACASA-N 1 2 234.328 2.203 20 0 BEADLO CCCN1CC[N@H+](C)[C@H](Cc2ccccc2)C1 ZINC000284946499 169203064 /nfs/dbraw/zinc/20/30/64/169203064.db2.gz YZXMWWBYYJJSAZ-OAHLLOKOSA-N 1 2 232.371 2.255 20 0 BEADLO CCCN1CC[N@@H+](C)[C@H](Cc2ccccc2)C1 ZINC000284946499 169203066 /nfs/dbraw/zinc/20/30/66/169203066.db2.gz YZXMWWBYYJJSAZ-OAHLLOKOSA-N 1 2 232.371 2.255 20 0 BEADLO CCC[N@@H+]1CCOC[C@@H]1c1nc(C)cs1 ZINC000189271077 169205021 /nfs/dbraw/zinc/20/50/21/169205021.db2.gz RNGREBKUEFPRFL-SNVBAGLBSA-N 1 2 226.345 2.235 20 0 BEADLO CCC[N@H+]1CCOC[C@@H]1c1nc(C)cs1 ZINC000189271077 169205024 /nfs/dbraw/zinc/20/50/24/169205024.db2.gz RNGREBKUEFPRFL-SNVBAGLBSA-N 1 2 226.345 2.235 20 0 BEADLO c1cc(C[N@@H+]2CCO[C@H](C3CCCCC3)C2)n[nH]1 ZINC000336375012 183347316 /nfs/dbraw/zinc/34/73/16/183347316.db2.gz POKOOHYPCUKILO-AWEZNQCLSA-N 1 2 249.358 2.191 20 0 BEADLO c1cc(C[N@H+]2CCO[C@H](C3CCCCC3)C2)n[nH]1 ZINC000336375012 183347317 /nfs/dbraw/zinc/34/73/17/183347317.db2.gz POKOOHYPCUKILO-AWEZNQCLSA-N 1 2 249.358 2.191 20 0 BEADLO c1cc(NCC2CCOCC2)nc(C2CC2)[nH+]1 ZINC000171887321 183357634 /nfs/dbraw/zinc/35/76/34/183357634.db2.gz DYHNWTZRUOZLNQ-UHFFFAOYSA-N 1 2 233.315 2.193 20 0 BEADLO c1cnn(-c2cccc(NCc3[nH]cc[nH+]3)c2)c1 ZINC000049715354 183358604 /nfs/dbraw/zinc/35/86/04/183358604.db2.gz NVQPEUIXWSTEBK-UHFFFAOYSA-N 1 2 239.282 2.208 20 0 BEADLO c1cc2c(o1)CCC[C@@H]2[NH2+]Cc1csnn1 ZINC000036902152 183373210 /nfs/dbraw/zinc/37/32/10/183373210.db2.gz TXZMAGFQSYQJQS-JTQLQIEISA-N 1 2 235.312 2.298 20 0 BEADLO c1cc2cc(C[N@@H+]3CCO[C@H]4C[C@H]43)ccc2o1 ZINC000366560365 183374303 /nfs/dbraw/zinc/37/43/03/183374303.db2.gz POEAHOXYWMGDKQ-OCCSQVGLSA-N 1 2 229.279 2.406 20 0 BEADLO c1cc2cc(C[N@H+]3CCO[C@H]4C[C@H]43)ccc2o1 ZINC000366560365 183374306 /nfs/dbraw/zinc/37/43/06/183374306.db2.gz POEAHOXYWMGDKQ-OCCSQVGLSA-N 1 2 229.279 2.406 20 0 BEADLO c1cc2ccc(C[NH2+]Cc3cscn3)nc2[nH]1 ZINC000353234879 183376081 /nfs/dbraw/zinc/37/60/81/183376081.db2.gz YRPJYEYULOHDTI-UHFFFAOYSA-N 1 2 244.323 2.309 20 0 BEADLO c1cn(-c2ccnc(-c3ccccc3)n2)c[nH+]1 ZINC000352740672 183383379 /nfs/dbraw/zinc/38/33/79/183383379.db2.gz YVANXJUVZIZHFN-UHFFFAOYSA-N 1 2 222.251 2.329 20 0 BEADLO CCC[NH2+][C@H](Cc1ccccc1)C(=O)OCC ZINC000037513690 169290049 /nfs/dbraw/zinc/29/00/49/169290049.db2.gz KVVJYJGMSQBLSK-CYBMUJFWSA-N 1 2 235.327 2.160 20 0 BEADLO c1ccc(C[NH+]2CCN(C3CCC3)CC2)cc1 ZINC000172198882 183399073 /nfs/dbraw/zinc/39/90/73/183399073.db2.gz RHUWNTUPECWSDO-UHFFFAOYSA-N 1 2 230.355 2.357 20 0 BEADLO c1nc([C@@H]2CCC[N@H+]2Cc2ccccc2)no1 ZINC000377500698 183399307 /nfs/dbraw/zinc/39/93/07/183399307.db2.gz UPDQPMWFCMHBCD-LBPRGKRZSA-N 1 2 229.283 2.407 20 0 BEADLO c1nc([C@@H]2CCC[N@@H+]2Cc2ccccc2)no1 ZINC000377500698 183399310 /nfs/dbraw/zinc/39/93/10/183399310.db2.gz UPDQPMWFCMHBCD-LBPRGKRZSA-N 1 2 229.283 2.407 20 0 BEADLO CCC[NH2+][C@H](c1nnc[nH]1)c1ccc(F)cc1 ZINC000087880431 169280942 /nfs/dbraw/zinc/28/09/42/169280942.db2.gz SPERVBFXKHOJDT-NSHDSACASA-N 1 2 234.278 2.033 20 0 BEADLO CCC[C@@H](C)C(=O)NCc1c[nH+]ccc1OC ZINC000293249635 169351562 /nfs/dbraw/zinc/35/15/62/169351562.db2.gz DXVPGUPPBKQWDL-SNVBAGLBSA-N 1 2 236.315 2.143 20 0 BEADLO CCC[C@@H](C)CC(=O)Nc1ccc(N)[nH+]c1 ZINC000236855957 169356658 /nfs/dbraw/zinc/35/66/58/169356658.db2.gz LNKIIHCHXYRBED-SECBINFHSA-N 1 2 221.304 2.429 20 0 BEADLO CCC[C@@H](CCO)CNc1cccc[nH+]1 ZINC000231151207 169382825 /nfs/dbraw/zinc/38/28/25/169382825.db2.gz SUWCTXUGYARCMY-NSHDSACASA-N 1 2 208.305 2.292 20 0 BEADLO Cc1ncc(C(=O)Nc2cc[nH+]c(C)c2)s1 ZINC000195437776 259606122 /nfs/dbraw/zinc/60/61/22/259606122.db2.gz PZBXALYXKNQMSK-UHFFFAOYSA-N 1 2 233.296 2.407 20 0 BEADLO COc1nscc1C[N@@H+]1CCSC[C@H]1C ZINC001644681669 1172590785 /nfs/dbraw/zinc/59/07/85/1172590785.db2.gz ICLQPNBLHJHPPB-MRVPVSSYSA-N 1 2 244.385 2.089 20 0 BEADLO COc1nscc1C[N@H+]1CCSC[C@H]1C ZINC001644681669 1172590790 /nfs/dbraw/zinc/59/07/90/1172590790.db2.gz ICLQPNBLHJHPPB-MRVPVSSYSA-N 1 2 244.385 2.089 20 0 BEADLO Cc1[nH]c([C@H]2CCCN2C(=O)C2CCC2)[nH+]c1C ZINC001644727958 1172598413 /nfs/dbraw/zinc/59/84/13/1172598413.db2.gz RSAVIOXQRZJGCS-GFCCVEGCSA-N 1 2 247.342 2.490 20 0 BEADLO C[C@H]([NH2+]Cc1ncc(Cl)s1)c1cn[nH]c1 ZINC000225376290 134355056 /nfs/dbraw/zinc/35/50/56/134355056.db2.gz ZEBFLNRGQOPMGG-LURJTMIESA-N 1 2 242.735 2.370 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cnc(C)s2)C[C@H](C)O1 ZINC000111276759 383846308 /nfs/dbraw/zinc/84/63/08/383846308.db2.gz AFZNNZLOFJNBIE-ONGXEEELSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cnc(C)s2)C[C@H](C)O1 ZINC000111276759 383846315 /nfs/dbraw/zinc/84/63/15/383846315.db2.gz AFZNNZLOFJNBIE-ONGXEEELSA-N 1 2 240.372 2.451 20 0 BEADLO CC1(C)C[C@H](O)CCN(c2cccc[nH+]2)C1 ZINC000295847415 383859980 /nfs/dbraw/zinc/85/99/80/383859980.db2.gz AYVBYGYWFHPLPS-LLVKDONJSA-N 1 2 220.316 2.069 20 0 BEADLO C[C@@H](Nc1nc[nH+]c(N)c1Cl)C1CCC1 ZINC000235220419 383864995 /nfs/dbraw/zinc/86/49/95/383864995.db2.gz APANTFSRNINEFU-ZCFIWIBFSA-N 1 2 226.711 2.313 20 0 BEADLO C[C@@H](Nc1[nH+]cnc(N)c1Cl)C1CCC1 ZINC000235220419 383864999 /nfs/dbraw/zinc/86/49/99/383864999.db2.gz APANTFSRNINEFU-ZCFIWIBFSA-N 1 2 226.711 2.313 20 0 BEADLO Cc1c[nH+]cc(N[C@@H]2C[C@H](C)O[C@H]2C)c1 ZINC000295863670 383867424 /nfs/dbraw/zinc/86/74/24/383867424.db2.gz WYORFOFJIGZRDH-JBLDHEPKSA-N 1 2 206.289 2.368 20 0 BEADLO FC(F)(F)COCCNc1cccc[nH+]1 ZINC000070166627 383868373 /nfs/dbraw/zinc/86/83/73/383868373.db2.gz WUIHQXSBICDXCU-UHFFFAOYSA-N 1 2 220.194 2.072 20 0 BEADLO Cc1cc(Nc2cn(C)nc2C2CC2)nc(C)[nH+]1 ZINC000292365552 383920890 /nfs/dbraw/zinc/92/08/90/383920890.db2.gz PAFJTRUMMXVJAH-UHFFFAOYSA-N 1 2 243.314 2.448 20 0 BEADLO CC[C@@H]1C[C@H]1NC(=O)Nc1cc(C)[nH+]cc1C ZINC000518471503 383925866 /nfs/dbraw/zinc/92/58/66/383925866.db2.gz IKDOSDJCCJVXNK-ZYHUDNBSSA-N 1 2 233.315 2.040 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ccccc1F)c1nncn1C ZINC000037017270 383932093 /nfs/dbraw/zinc/93/20/93/383932093.db2.gz LTPWSPLAXJRVGG-UWVGGRQHSA-N 1 2 248.305 2.366 20 0 BEADLO CC(C)(NC(=O)Cc1ccccc1)c1[nH]cc[nH+]1 ZINC000518546195 383996512 /nfs/dbraw/zinc/99/65/12/383996512.db2.gz AHZYSVILFCFDAE-UHFFFAOYSA-N 1 2 243.310 2.004 20 0 BEADLO c1cn(-c2ccccc2OC[C@@H]2CCOC2)c[nH+]1 ZINC000530955676 383998051 /nfs/dbraw/zinc/99/80/51/383998051.db2.gz AKVBEYFOGZTACX-GFCCVEGCSA-N 1 2 244.294 2.288 20 0 BEADLO CC[C@@H](C)[C@@H](C)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000569412183 384000189 /nfs/dbraw/zinc/00/01/89/384000189.db2.gz OYRDPUPBZVFEMB-OPRDCNLKSA-N 1 2 223.320 2.269 20 0 BEADLO C[NH2+]Cc1noc(C[C@@H]2CCCC[C@H]2C)n1 ZINC000518490581 383954497 /nfs/dbraw/zinc/95/44/97/383954497.db2.gz JEJKWYKHCBLHLY-ZJUUUORDSA-N 1 2 223.320 2.158 20 0 BEADLO C[NH2+]Cc1noc(C[C@H]2CCCC[C@H]2C)n1 ZINC000518490578 383954964 /nfs/dbraw/zinc/95/49/64/383954964.db2.gz JEJKWYKHCBLHLY-NXEZZACHSA-N 1 2 223.320 2.158 20 0 BEADLO CC[C@H]([NH2+]Cc1ccnn1CC)C(F)F ZINC000449357089 383963018 /nfs/dbraw/zinc/96/30/18/383963018.db2.gz BLFFXJWVZJGGCX-VIFPVBQESA-N 1 2 217.263 2.036 20 0 BEADLO CC(C)Cn1nccc1C[NH2+]CC(C)(F)F ZINC000647212903 383963437 /nfs/dbraw/zinc/96/34/37/383963437.db2.gz CAMHCNFKOWJYCM-UHFFFAOYSA-N 1 2 231.290 2.284 20 0 BEADLO Fc1ccc(C[NH2+][C@H]2CCn3ccnc32)cc1F ZINC000293862519 383966259 /nfs/dbraw/zinc/96/62/59/383966259.db2.gz DKGAFBRLOSYJEO-LBPRGKRZSA-N 1 2 249.264 2.396 20 0 BEADLO Fc1ccc(NCc2[nH]cc[nH+]2)c(F)c1 ZINC000049714578 384024360 /nfs/dbraw/zinc/02/43/60/384024360.db2.gz JBAARDIKVMAUJG-UHFFFAOYSA-N 1 2 209.199 2.300 20 0 BEADLO Cc1ccoc1C[NH2+][C@@H](C)c1cnccn1 ZINC000293888357 384010977 /nfs/dbraw/zinc/01/09/77/384010977.db2.gz ZBAMMIVOMMAICL-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO Cc1c(Cl)c(C[NH2+]C2(CF)CCC2)nn1C ZINC000647254921 384011764 /nfs/dbraw/zinc/01/17/64/384011764.db2.gz ORZPMKHEPWOVIZ-UHFFFAOYSA-N 1 2 245.729 2.364 20 0 BEADLO Cc1nc(C[NH2+]Cc2cncc(C)c2)[nH]c1C ZINC000518564337 384012996 /nfs/dbraw/zinc/01/29/96/384012996.db2.gz LPAOABJDNZJOKK-UHFFFAOYSA-N 1 2 230.315 2.020 20 0 BEADLO Cc1[nH]c(CNCc2cncc(C)c2)[nH+]c1C ZINC000518564337 384012998 /nfs/dbraw/zinc/01/29/98/384012998.db2.gz LPAOABJDNZJOKK-UHFFFAOYSA-N 1 2 230.315 2.020 20 0 BEADLO c1cc(C[NH2+]CCSc2ccccc2)[nH]n1 ZINC000037904187 384040216 /nfs/dbraw/zinc/04/02/16/384040216.db2.gz HMRNFTWMNXOLLR-UHFFFAOYSA-N 1 2 233.340 2.292 20 0 BEADLO C[C@H]1C[C@@H](Nc2cccc(-n3cc[nH+]c3)c2)CO1 ZINC000401829284 384076529 /nfs/dbraw/zinc/07/65/29/384076529.db2.gz MNXVUXVFKZUKMI-WCQYABFASA-N 1 2 243.310 2.462 20 0 BEADLO C[C@@H]1C[C@H](Nc2cccc(-n3cc[nH+]c3)c2)CO1 ZINC000401829286 384076833 /nfs/dbraw/zinc/07/68/33/384076833.db2.gz MNXVUXVFKZUKMI-YPMHNXCESA-N 1 2 243.310 2.462 20 0 BEADLO Fc1ccc2c(c1F)C[N@H+]([C@@H]1CCOC1)CC2 ZINC000336553832 384126121 /nfs/dbraw/zinc/12/61/21/384126121.db2.gz MUTOIJRQLSORBI-SNVBAGLBSA-N 1 2 239.265 2.112 20 0 BEADLO Fc1ccc2c(c1F)C[N@@H+]([C@@H]1CCOC1)CC2 ZINC000336553832 384126125 /nfs/dbraw/zinc/12/61/25/384126125.db2.gz MUTOIJRQLSORBI-SNVBAGLBSA-N 1 2 239.265 2.112 20 0 BEADLO Cc1cc(C[N@H+]2CCOC[C@H]2C)ccc1F ZINC000091814850 384148318 /nfs/dbraw/zinc/14/83/18/384148318.db2.gz GZRKVYPMMDDJLI-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC[C@H]2C)ccc1F ZINC000091814850 384148327 /nfs/dbraw/zinc/14/83/27/384148327.db2.gz GZRKVYPMMDDJLI-LLVKDONJSA-N 1 2 223.291 2.355 20 0 BEADLO C[N@H+](CCOCc1ccccc1)Cc1cnc[nH]1 ZINC000091937023 384152847 /nfs/dbraw/zinc/15/28/47/384152847.db2.gz WZHIXTPUUNLHJY-UHFFFAOYSA-N 1 2 245.326 2.058 20 0 BEADLO C[N@@H+](CCOCc1ccccc1)Cc1cnc[nH]1 ZINC000091937023 384152853 /nfs/dbraw/zinc/15/28/53/384152853.db2.gz WZHIXTPUUNLHJY-UHFFFAOYSA-N 1 2 245.326 2.058 20 0 BEADLO C[N@H+](CCOCc1ccccc1)Cc1c[nH]cn1 ZINC000091937023 384152856 /nfs/dbraw/zinc/15/28/56/384152856.db2.gz WZHIXTPUUNLHJY-UHFFFAOYSA-N 1 2 245.326 2.058 20 0 BEADLO C[N@@H+](CCOCc1ccccc1)Cc1c[nH]cn1 ZINC000091937023 384152862 /nfs/dbraw/zinc/15/28/62/384152862.db2.gz WZHIXTPUUNLHJY-UHFFFAOYSA-N 1 2 245.326 2.058 20 0 BEADLO Cc1cc(N2CC[C@H]3CC[C@@H](C2)S3)nc[nH+]1 ZINC000624523506 384175405 /nfs/dbraw/zinc/17/54/05/384175405.db2.gz YAHAFVXWUJXQKT-MNOVXSKESA-N 1 2 235.356 2.259 20 0 BEADLO CCc1ccc(C[N@@H+]2C[C@@H](C)OC[C@@H]2C)o1 ZINC000092017682 384158832 /nfs/dbraw/zinc/15/88/32/384158832.db2.gz BTLKDFWOYMQXFY-WDEREUQCSA-N 1 2 223.316 2.451 20 0 BEADLO CCc1ccc(C[N@H+]2C[C@@H](C)OC[C@@H]2C)o1 ZINC000092017682 384158836 /nfs/dbraw/zinc/15/88/36/384158836.db2.gz BTLKDFWOYMQXFY-WDEREUQCSA-N 1 2 223.316 2.451 20 0 BEADLO CCOc1cccc(C[N@@H+]2CC[C@H](F)C2)n1 ZINC000449391844 384160556 /nfs/dbraw/zinc/16/05/56/384160556.db2.gz INECQBLQRIXFPA-JTQLQIEISA-N 1 2 224.279 2.024 20 0 BEADLO CCOc1cccc(C[N@H+]2CC[C@H](F)C2)n1 ZINC000449391844 384160561 /nfs/dbraw/zinc/16/05/61/384160561.db2.gz INECQBLQRIXFPA-JTQLQIEISA-N 1 2 224.279 2.024 20 0 BEADLO COC(=O)c1ccccc1C[N@@H+]1CC[C@@H](F)C1 ZINC000449393211 384162767 /nfs/dbraw/zinc/16/27/67/384162767.db2.gz LRSPODGIDDCWFI-LLVKDONJSA-N 1 2 237.274 2.017 20 0 BEADLO COC(=O)c1ccccc1C[N@H+]1CC[C@@H](F)C1 ZINC000449393211 384162769 /nfs/dbraw/zinc/16/27/69/384162769.db2.gz LRSPODGIDDCWFI-LLVKDONJSA-N 1 2 237.274 2.017 20 0 BEADLO Cc1cc(NC(=O)N2C[C@H](C)C[C@H]2C)cc[nH+]1 ZINC000336587492 384183688 /nfs/dbraw/zinc/18/36/88/384183688.db2.gz DMDDUPVAEPQSNY-MWLCHTKSSA-N 1 2 233.315 2.074 20 0 BEADLO Cc1noc(C)c1CN(C)c1cccc[nH+]1 ZINC000076678674 384201952 /nfs/dbraw/zinc/20/19/52/384201952.db2.gz WNNMQFWWQZLPNF-UHFFFAOYSA-N 1 2 217.272 2.323 20 0 BEADLO C[N@H+](Cc1ncn(-c2ccccc2)n1)C1CCC1 ZINC000092797962 384193814 /nfs/dbraw/zinc/19/38/14/384193814.db2.gz LRXWMGUYVRCOCW-UHFFFAOYSA-N 1 2 242.326 2.252 20 0 BEADLO C[N@@H+](Cc1ncn(-c2ccccc2)n1)C1CCC1 ZINC000092797962 384193819 /nfs/dbraw/zinc/19/38/19/384193819.db2.gz LRXWMGUYVRCOCW-UHFFFAOYSA-N 1 2 242.326 2.252 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2cnc(C)s2)CCO1 ZINC000132185733 384218905 /nfs/dbraw/zinc/21/89/05/384218905.db2.gz IZRVYFQCRPTOSS-NSHDSACASA-N 1 2 240.372 2.452 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2cnc(C)s2)CCO1 ZINC000132185733 384218911 /nfs/dbraw/zinc/21/89/11/384218911.db2.gz IZRVYFQCRPTOSS-NSHDSACASA-N 1 2 240.372 2.452 20 0 BEADLO Cc1ccc([C@@H]2COCC[N@@H+]2CCCF)o1 ZINC000132309610 384225731 /nfs/dbraw/zinc/22/57/31/384225731.db2.gz UQOMDLHWQFRKHX-NSHDSACASA-N 1 2 227.279 2.321 20 0 BEADLO Cc1ccc([C@@H]2COCC[N@H+]2CCCF)o1 ZINC000132309610 384225737 /nfs/dbraw/zinc/22/57/37/384225737.db2.gz UQOMDLHWQFRKHX-NSHDSACASA-N 1 2 227.279 2.321 20 0 BEADLO Cc1ccc(NC(=O)COC(C)(C)C)c(C)[nH+]1 ZINC000158573279 384260290 /nfs/dbraw/zinc/26/02/90/384260290.db2.gz IKPPYQSDKVCWNU-UHFFFAOYSA-N 1 2 236.315 2.452 20 0 BEADLO Cc1ccc(N[C@@H](C)CCn2cccn2)c[nH+]1 ZINC000159315492 384322236 /nfs/dbraw/zinc/32/22/36/384322236.db2.gz IPNFSJKZQIYEAX-LBPRGKRZSA-N 1 2 230.315 2.477 20 0 BEADLO c1cc(C[NH2+]Cc2cn3ccccc3n2)co1 ZINC000168767532 384309543 /nfs/dbraw/zinc/30/95/43/384309543.db2.gz CVXSANQMCXFGGZ-UHFFFAOYSA-N 1 2 227.267 2.217 20 0 BEADLO Cc1cc(NC(=O)C2=C(C)OCCC2)cc[nH+]1 ZINC000133797837 384315139 /nfs/dbraw/zinc/31/51/39/384315139.db2.gz WIOPSGJGSFYXKO-UHFFFAOYSA-N 1 2 232.283 2.413 20 0 BEADLO COC(=O)C[N@H+](C)CC(C)(C)c1ccc(C)cc1 ZINC000173964584 384293072 /nfs/dbraw/zinc/29/30/72/384293072.db2.gz AZWQLSFEQWATME-UHFFFAOYSA-N 1 2 249.354 2.377 20 0 BEADLO COC(=O)C[N@@H+](C)CC(C)(C)c1ccc(C)cc1 ZINC000173964584 384293080 /nfs/dbraw/zinc/29/30/80/384293080.db2.gz AZWQLSFEQWATME-UHFFFAOYSA-N 1 2 249.354 2.377 20 0 BEADLO COC1CC[NH+](Cc2csc(Cl)n2)CC1 ZINC000296661495 384293619 /nfs/dbraw/zinc/29/36/19/384293619.db2.gz YMUWBZCYOCKKIK-UHFFFAOYSA-N 1 2 246.763 2.407 20 0 BEADLO O=C(CC1CCCCCC1)NCCc1[nH]cc[nH+]1 ZINC000135810976 384373356 /nfs/dbraw/zinc/37/33/56/384373356.db2.gz AKYQPWXICYAMPV-UHFFFAOYSA-N 1 2 249.358 2.429 20 0 BEADLO C[C@H]1CCN(c2ccccn2)C[C@@H]1n1cc[nH+]c1 ZINC000134161063 384337735 /nfs/dbraw/zinc/33/77/35/384337735.db2.gz FNCKMIASIUHESB-STQMWFEESA-N 1 2 242.326 2.366 20 0 BEADLO CS[C@H](C)C(=O)Nc1cc[nH+]c(C)c1 ZINC000075936831 384346678 /nfs/dbraw/zinc/34/66/78/384346678.db2.gz HALMEBZKXMNBHH-MRVPVSSYSA-N 1 2 210.302 2.080 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N(C)C(C)C ZINC000120425403 384352969 /nfs/dbraw/zinc/35/29/69/384352969.db2.gz DOJBKZJOHYTXEI-UHFFFAOYSA-N 1 2 207.277 2.262 20 0 BEADLO CC[C@@](C)(CNc1ccc(N(C)C)[nH+]c1)OC ZINC000319690492 384357475 /nfs/dbraw/zinc/35/74/75/384357475.db2.gz QXJPQIZUZIQHEB-ZDUSSCGKSA-N 1 2 237.347 2.375 20 0 BEADLO Nc1[nH+]cnc(N[C@@H]2CCC[C@@H]3C[C@@H]32)c1Cl ZINC000560821188 384369569 /nfs/dbraw/zinc/36/95/69/384369569.db2.gz KQVLKQOJDRTBTP-GJMOJQLCSA-N 1 2 238.722 2.313 20 0 BEADLO Nc1nc[nH+]c(N[C@@H]2CCC[C@@H]3C[C@@H]32)c1Cl ZINC000560821188 384369575 /nfs/dbraw/zinc/36/95/75/384369575.db2.gz KQVLKQOJDRTBTP-GJMOJQLCSA-N 1 2 238.722 2.313 20 0 BEADLO C[C@@H]1OCC[C@H]1Nc1ccc(N2CCCC2)[nH+]c1 ZINC000134116798 384334671 /nfs/dbraw/zinc/33/46/71/384334671.db2.gz YQQCDSHMAXGTRP-WCQYABFASA-N 1 2 247.342 2.271 20 0 BEADLO C[C@H]1OCC[C@H]1Nc1ccc(N2CCCC2)[nH+]c1 ZINC000134116657 384334923 /nfs/dbraw/zinc/33/49/23/384334923.db2.gz YQQCDSHMAXGTRP-DGCLKSJQSA-N 1 2 247.342 2.271 20 0 BEADLO Cc1cc(NCCOCC2CCCC2)nc[nH+]1 ZINC000313464317 384402428 /nfs/dbraw/zinc/40/24/28/384402428.db2.gz VIMYBMXGDANMNI-UHFFFAOYSA-N 1 2 235.331 2.404 20 0 BEADLO CN(C[C@@H]1CCCOC1)c1[nH]c2ccccc2[nH+]1 ZINC000134967614 384404111 /nfs/dbraw/zinc/40/41/11/384404111.db2.gz GOFSPWKBTJKZBC-NSHDSACASA-N 1 2 245.326 2.426 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC[C@H]1CCCCO1 ZINC000121444455 384417228 /nfs/dbraw/zinc/41/72/28/384417228.db2.gz OJQQFRLOZJSION-LLVKDONJSA-N 1 2 249.314 2.081 20 0 BEADLO CCc1ccc(C[N@@H+]2CCC(=O)[C@H](C)C2)nc1 ZINC000334186511 384378083 /nfs/dbraw/zinc/37/80/83/384378083.db2.gz CHNFLNLALZIURH-LLVKDONJSA-N 1 2 232.327 2.055 20 0 BEADLO CCc1ccc(C[N@H+]2CCC(=O)[C@H](C)C2)nc1 ZINC000334186511 384378091 /nfs/dbraw/zinc/37/80/91/384378091.db2.gz CHNFLNLALZIURH-LLVKDONJSA-N 1 2 232.327 2.055 20 0 BEADLO Cc1nc(CN[C@H]2C[C@H](C)n3cc[nH+]c32)cs1 ZINC000334190546 384380430 /nfs/dbraw/zinc/38/04/30/384380430.db2.gz HILWBYJASABZGC-KWQFWETISA-N 1 2 248.355 2.444 20 0 BEADLO CCOc1ncccc1CNc1cccc[nH+]1 ZINC000076650256 384380891 /nfs/dbraw/zinc/38/08/91/384380891.db2.gz INPQTCPSTWATRQ-UHFFFAOYSA-N 1 2 229.283 2.487 20 0 BEADLO Cc1cc(C)c(NC(=O)[C@H]2CCCO2)c(C)[nH+]1 ZINC000097213752 384445856 /nfs/dbraw/zinc/44/58/56/384445856.db2.gz OQIVASZCKCQKLZ-LLVKDONJSA-N 1 2 234.299 2.124 20 0 BEADLO O=C(CC1CCCCC1)NCCCn1cc[nH+]c1 ZINC000047465685 384453042 /nfs/dbraw/zinc/45/30/42/384453042.db2.gz CPDPDTAFLAOYTE-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO CN(CC1CC1)c1cc(N(C)CC2CC2)[nH+]cn1 ZINC000121836759 384442096 /nfs/dbraw/zinc/44/20/96/384442096.db2.gz DKARNSUXQPCMFA-UHFFFAOYSA-N 1 2 246.358 2.169 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)C1=CCCC1 ZINC000121853161 384442270 /nfs/dbraw/zinc/44/22/70/384442270.db2.gz QGXNAMVCEKIPMU-UHFFFAOYSA-N 1 2 231.299 2.196 20 0 BEADLO C[C@H]([NH2+][C@H]1C[C@@H](C)[C@H]1C)C(=O)OC(C)(C)C ZINC000309888501 384461696 /nfs/dbraw/zinc/46/16/96/384461696.db2.gz ZKKPEVNVFFDLOY-ZNSHCXBVSA-N 1 2 227.348 2.351 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccnn2CC(C)C)no1 ZINC000647175283 384477461 /nfs/dbraw/zinc/47/74/61/384477461.db2.gz HNYQHAXLTWZLNQ-UHFFFAOYSA-N 1 2 248.330 2.125 20 0 BEADLO c1[nH+]c2c(cc1N[C@H]1CCOC1)CCCC2 ZINC000336475920 384477730 /nfs/dbraw/zinc/47/77/30/384477730.db2.gz VIIAGFKTMAMLIP-NSHDSACASA-N 1 2 218.300 2.161 20 0 BEADLO CCc1nocc1C[NH2+]Cc1ccn(C(C)C)n1 ZINC000561043236 384458864 /nfs/dbraw/zinc/45/88/64/384458864.db2.gz METXJOWKJNKYER-UHFFFAOYSA-N 1 2 248.330 2.304 20 0 BEADLO CC(C)CC[N@@H+]1CCOCC(F)(F)C1 ZINC000367357094 384487075 /nfs/dbraw/zinc/48/70/75/384487075.db2.gz UBTASRJEUVCCQP-UHFFFAOYSA-N 1 2 207.264 2.000 20 0 BEADLO CC(C)CC[N@H+]1CCOCC(F)(F)C1 ZINC000367357094 384487078 /nfs/dbraw/zinc/48/70/78/384487078.db2.gz UBTASRJEUVCCQP-UHFFFAOYSA-N 1 2 207.264 2.000 20 0 BEADLO CCCCC(=O)N1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000122862842 384515576 /nfs/dbraw/zinc/51/55/76/384515576.db2.gz ONEJQHPNRMZTAE-CHWSQXEVSA-N 1 2 249.358 2.483 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)[C@@H]1CC12CC2 ZINC000335059886 384521065 /nfs/dbraw/zinc/52/10/65/384521065.db2.gz JFTLEGAXHHRPHB-JTQLQIEISA-N 1 2 227.267 2.073 20 0 BEADLO COc1ccc(F)c(CNc2c[nH]c[nH+]2)c1 ZINC000556853776 384529242 /nfs/dbraw/zinc/52/92/42/384529242.db2.gz MUEUAZYWJKQKQH-UHFFFAOYSA-N 1 2 221.235 2.170 20 0 BEADLO c1csc(C[N@@H+]2CCOCC23CCCC3)n1 ZINC000270625990 384543629 /nfs/dbraw/zinc/54/36/29/384543629.db2.gz KUGVESXHPIXGRR-UHFFFAOYSA-N 1 2 238.356 2.288 20 0 BEADLO c1csc(C[N@H+]2CCOCC23CCCC3)n1 ZINC000270625990 384543634 /nfs/dbraw/zinc/54/36/34/384543634.db2.gz KUGVESXHPIXGRR-UHFFFAOYSA-N 1 2 238.356 2.288 20 0 BEADLO Cc1cc[nH+]cc1NCc1ccn(C)c1 ZINC000085604320 384544641 /nfs/dbraw/zinc/54/46/41/384544641.db2.gz SYYFZUJNLCEEMM-UHFFFAOYSA-N 1 2 201.273 2.341 20 0 BEADLO Cc1[nH+]cccc1NC[C@@H]1CCCOC1 ZINC000085726825 384553616 /nfs/dbraw/zinc/55/36/16/384553616.db2.gz TZUUNSPHBITRND-NSHDSACASA-N 1 2 206.289 2.229 20 0 BEADLO Clc1ccccc1C[NH2+]Cc1ncc[nH]1 ZINC000049714515 384557089 /nfs/dbraw/zinc/55/70/89/384557089.db2.gz KGCHJEPIKKCLKX-UHFFFAOYSA-N 1 2 221.691 2.353 20 0 BEADLO COC[C@H]([NH2+]Cc1c[nH]nc1C)c1ccc(C)o1 ZINC000080237744 384538331 /nfs/dbraw/zinc/53/83/31/384538331.db2.gz UOENJGUCBSEQIX-LBPRGKRZSA-N 1 2 249.314 2.097 20 0 BEADLO COC[C@H]([NH2+]Cc1ccccn1)c1ccco1 ZINC000080240160 384540196 /nfs/dbraw/zinc/54/01/96/384540196.db2.gz YCOVXDHXESDCPG-LBPRGKRZSA-N 1 2 232.283 2.152 20 0 BEADLO COC[C@@H]([NH2+]Cc1ccccn1)c1ccco1 ZINC000080240164 384540718 /nfs/dbraw/zinc/54/07/18/384540718.db2.gz YCOVXDHXESDCPG-GFCCVEGCSA-N 1 2 232.283 2.152 20 0 BEADLO CSCC[N@H+](C)CC(=O)c1cc(C)[nH]c1C ZINC000138256544 384568418 /nfs/dbraw/zinc/56/84/18/384568418.db2.gz JIIDCAYPSFCUHU-UHFFFAOYSA-N 1 2 240.372 2.109 20 0 BEADLO CSCC[N@@H+](C)CC(=O)c1cc(C)[nH]c1C ZINC000138256544 384568426 /nfs/dbraw/zinc/56/84/26/384568426.db2.gz JIIDCAYPSFCUHU-UHFFFAOYSA-N 1 2 240.372 2.109 20 0 BEADLO C[C@@H]1CSCCN1c1cc[nH+]c(C2CC2)n1 ZINC000172374830 384577320 /nfs/dbraw/zinc/57/73/20/384577320.db2.gz KGHWGRGGAWJADK-SECBINFHSA-N 1 2 235.356 2.296 20 0 BEADLO Cn1ncc2c1CCC[C@@H]2[NH2+]Cc1cscn1 ZINC000040504734 384577904 /nfs/dbraw/zinc/57/79/04/384577904.db2.gz DRISYPYYRBFWPW-NSHDSACASA-N 1 2 248.355 2.044 20 0 BEADLO COC(=O)C(C)(C)[NH2+]CCc1ccc(C)cc1 ZINC000124042696 384606630 /nfs/dbraw/zinc/60/66/30/384606630.db2.gz HOLRNMTUNOKZTR-UHFFFAOYSA-N 1 2 235.327 2.079 20 0 BEADLO Cc1nc(C[N@H+]2CCSC[C@@H]2C)cs1 ZINC000172590774 384607755 /nfs/dbraw/zinc/60/77/55/384607755.db2.gz SDYHUAZMVOMRRA-QMMMGPOBSA-N 1 2 228.386 2.389 20 0 BEADLO Cc1nc(C[N@@H+]2CCSC[C@@H]2C)cs1 ZINC000172590774 384607771 /nfs/dbraw/zinc/60/77/71/384607771.db2.gz SDYHUAZMVOMRRA-QMMMGPOBSA-N 1 2 228.386 2.389 20 0 BEADLO Cc1occc1C[N@H+](C)Cc1ccon1 ZINC000172652158 384615491 /nfs/dbraw/zinc/61/54/91/384615491.db2.gz BRMUNNGDEJTWME-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO Cc1occc1C[N@@H+](C)Cc1ccon1 ZINC000172652158 384615501 /nfs/dbraw/zinc/61/55/01/384615501.db2.gz BRMUNNGDEJTWME-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO Cc1ccc(NC(=O)Nc2ccn(C)n2)c(C)[nH+]1 ZINC000162243552 384594722 /nfs/dbraw/zinc/59/47/22/384594722.db2.gz FANKUBAZXVCGGO-UHFFFAOYSA-N 1 2 245.286 2.076 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1csc(C)c1C ZINC000271450661 384602191 /nfs/dbraw/zinc/60/21/91/384602191.db2.gz RUGRHCXXZOXQSR-UHFFFAOYSA-N 1 2 249.339 2.326 20 0 BEADLO CN(Cc1cn2ccccc2[nH+]1)CC(F)F ZINC000103488263 384634916 /nfs/dbraw/zinc/63/49/16/384634916.db2.gz MMSFHURMHBBXJD-UHFFFAOYSA-N 1 2 225.242 2.031 20 0 BEADLO COc1ccc[nH+]c1N[C@H](C)C1CCOCC1 ZINC000225869333 384652148 /nfs/dbraw/zinc/65/21/48/384652148.db2.gz UBDOCMQLIONAAA-SNVBAGLBSA-N 1 2 236.315 2.317 20 0 BEADLO CCc1cc(N[C@@H](C)C(F)F)nc[nH+]1 ZINC000306754154 384675654 /nfs/dbraw/zinc/67/56/54/384675654.db2.gz MQBVMYLXODYFTJ-LURJTMIESA-N 1 2 201.220 2.105 20 0 BEADLO COC1(CNc2cc[nH+]c(C)n2)CCC(C)CC1 ZINC000359942028 384654930 /nfs/dbraw/zinc/65/49/30/384654930.db2.gz LONHWLKLZWLUSR-UHFFFAOYSA-N 1 2 249.358 2.214 20 0 BEADLO Cc1cc(C[NH2+]Cc2cnn(C(C)(C)C)c2)no1 ZINC000044412187 384655818 /nfs/dbraw/zinc/65/58/18/384655818.db2.gz WAGKERHWZUDVFE-UHFFFAOYSA-N 1 2 248.330 2.224 20 0 BEADLO CC[C@H](C)C[N@H+](C)Cc1noc(C2CC2)n1 ZINC000171952009 384681082 /nfs/dbraw/zinc/68/10/82/384681082.db2.gz AJDVYOZEZICDHI-VIFPVBQESA-N 1 2 223.320 2.425 20 0 BEADLO CC[C@H](C)C[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000171952009 384681087 /nfs/dbraw/zinc/68/10/87/384681087.db2.gz AJDVYOZEZICDHI-VIFPVBQESA-N 1 2 223.320 2.425 20 0 BEADLO CC[C@@H](C)C[N@H+](C)Cc1noc(C2CC2)n1 ZINC000171952007 384681306 /nfs/dbraw/zinc/68/13/06/384681306.db2.gz AJDVYOZEZICDHI-SECBINFHSA-N 1 2 223.320 2.425 20 0 BEADLO CC[C@@H](C)C[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000171952007 384681312 /nfs/dbraw/zinc/68/13/12/384681312.db2.gz AJDVYOZEZICDHI-SECBINFHSA-N 1 2 223.320 2.425 20 0 BEADLO CSc1cccc(NCc2c[nH+]cn2C)n1 ZINC000309891174 384689131 /nfs/dbraw/zinc/68/91/31/384689131.db2.gz COSMLJGGJMFITA-UHFFFAOYSA-N 1 2 234.328 2.149 20 0 BEADLO CCC[C@H]1C[C@@H]1C(=O)NCCNc1cccc[nH+]1 ZINC000360000615 384704123 /nfs/dbraw/zinc/70/41/23/384704123.db2.gz LOLSHGMLJYAVBS-RYUDHWBXSA-N 1 2 247.342 2.046 20 0 BEADLO COC(=O)C[N@H+](Cc1cccc(C)c1)C1CC1 ZINC000052047188 384714167 /nfs/dbraw/zinc/71/41/67/384714167.db2.gz UYZVAPFSZKYPIT-UHFFFAOYSA-N 1 2 233.311 2.132 20 0 BEADLO COC(=O)C[N@@H+](Cc1cccc(C)c1)C1CC1 ZINC000052047188 384714174 /nfs/dbraw/zinc/71/41/74/384714174.db2.gz UYZVAPFSZKYPIT-UHFFFAOYSA-N 1 2 233.311 2.132 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2cccc(F)c2)o1 ZINC000102672887 384721177 /nfs/dbraw/zinc/72/11/77/384721177.db2.gz CKXACUPWOMMXFX-UHFFFAOYSA-N 1 2 235.262 2.149 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2cccc(F)c2)o1 ZINC000102672887 384721183 /nfs/dbraw/zinc/72/11/83/384721183.db2.gz CKXACUPWOMMXFX-UHFFFAOYSA-N 1 2 235.262 2.149 20 0 BEADLO CCc1cc(N)nc(SCCCF)[nH+]1 ZINC000279074335 384778575 /nfs/dbraw/zinc/77/85/75/384778575.db2.gz KRXVFUHTHQJBPP-UHFFFAOYSA-N 1 2 215.297 2.073 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@@H](CC)C2)o1 ZINC000125557218 384730682 /nfs/dbraw/zinc/73/06/82/384730682.db2.gz ZEBRKSCEBOTFRQ-LBPRGKRZSA-N 1 2 223.316 2.453 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@@H](CC)C2)o1 ZINC000125557218 384730685 /nfs/dbraw/zinc/73/06/85/384730685.db2.gz ZEBRKSCEBOTFRQ-LBPRGKRZSA-N 1 2 223.316 2.453 20 0 BEADLO COc1ncc(C[N@H+](C)Cc2ccncc2)s1 ZINC000643890654 384731966 /nfs/dbraw/zinc/73/19/66/384731966.db2.gz RZTBETIIJHQVIA-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1ncc(C[N@@H+](C)Cc2ccncc2)s1 ZINC000643890654 384731971 /nfs/dbraw/zinc/73/19/71/384731971.db2.gz RZTBETIIJHQVIA-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO c1ccc(NCCNc2cccc[nH+]2)nc1 ZINC000143696502 384742188 /nfs/dbraw/zinc/74/21/88/384742188.db2.gz WZNXJKCIJMLBAE-UHFFFAOYSA-N 1 2 214.272 2.001 20 0 BEADLO CC(C)C[C@H](C)C(=O)N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000358174725 384744384 /nfs/dbraw/zinc/74/43/84/384744384.db2.gz YWCBOARJHPDARY-QWRGUYRKSA-N 1 2 249.358 2.065 20 0 BEADLO CC(C)C[C@H](C)C(=O)N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000358174725 384744395 /nfs/dbraw/zinc/74/43/95/384744395.db2.gz YWCBOARJHPDARY-QWRGUYRKSA-N 1 2 249.358 2.065 20 0 BEADLO c1csc(CCNc2cccc[nH+]2)n1 ZINC000060229580 384752738 /nfs/dbraw/zinc/75/27/38/384752738.db2.gz AGXCHDBSNQZCLG-UHFFFAOYSA-N 1 2 205.286 2.193 20 0 BEADLO CC[C@@H](F)CSc1nc(N)cc(C)[nH+]1 ZINC000308576272 384823517 /nfs/dbraw/zinc/82/35/17/384823517.db2.gz MVYUYEBDYAXHLC-SSDOTTSWSA-N 1 2 215.297 2.207 20 0 BEADLO Nc1[nH+]cnc(N2CCC3(CCC3)C2)c1Cl ZINC000277861709 384832925 /nfs/dbraw/zinc/83/29/25/384832925.db2.gz RMFRRNCRCAQIPI-UHFFFAOYSA-N 1 2 238.722 2.093 20 0 BEADLO Nc1nc[nH+]c(N2CCC3(CCC3)C2)c1Cl ZINC000277861709 384832930 /nfs/dbraw/zinc/83/29/30/384832930.db2.gz RMFRRNCRCAQIPI-UHFFFAOYSA-N 1 2 238.722 2.093 20 0 BEADLO COc1cncc(C[N@@H+]2CCC[C@@H]2CF)c1 ZINC000292927045 384783156 /nfs/dbraw/zinc/78/31/56/384783156.db2.gz CGVVOAHXUQFARD-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO COc1cncc(C[N@H+]2CCC[C@@H]2CF)c1 ZINC000292927045 384783163 /nfs/dbraw/zinc/78/31/63/384783163.db2.gz CGVVOAHXUQFARD-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO Cc1csc(C[NH2+][C@H](CO)c2ccccc2)n1 ZINC000083704931 384794071 /nfs/dbraw/zinc/79/40/71/384794071.db2.gz PNCHTFDNCYDJIG-GFCCVEGCSA-N 1 2 248.351 2.275 20 0 BEADLO CC[C@@H]([NH2+]Cc1[nH]ncc1C)c1nccs1 ZINC000310015726 384796886 /nfs/dbraw/zinc/79/68/86/384796886.db2.gz KVJJMBXACVOILU-SECBINFHSA-N 1 2 236.344 2.416 20 0 BEADLO CC[C@@H]([NH2+]Cc1n[nH]cc1C)c1nccs1 ZINC000310015726 384796891 /nfs/dbraw/zinc/79/68/91/384796891.db2.gz KVJJMBXACVOILU-SECBINFHSA-N 1 2 236.344 2.416 20 0 BEADLO Cn1cc[nH+]c1CSCC(=O)C(C)(C)C ZINC000175143901 384870613 /nfs/dbraw/zinc/87/06/13/384870613.db2.gz FKWHSZNKMAARLL-UHFFFAOYSA-N 1 2 226.345 2.269 20 0 BEADLO CC(C)[C@H](NC(=O)OCCCF)c1[nH]cc[nH+]1 ZINC000497214747 384876436 /nfs/dbraw/zinc/87/64/36/384876436.db2.gz NTMFOTNVWXKKAH-VIFPVBQESA-N 1 2 243.282 2.193 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)Cc1ccoc1 ZINC000517246558 384876591 /nfs/dbraw/zinc/87/65/91/384876591.db2.gz ZOSIUODUJWIMCS-UHFFFAOYSA-N 1 2 217.272 2.323 20 0 BEADLO Cc1nc(NC[C@@H]2CC[C@@H]3C[C@@H]3C2)cc[nH+]1 ZINC000403593963 384886213 /nfs/dbraw/zinc/88/62/13/384886213.db2.gz DTVGUJDCKWPYEE-UTUOFQBUSA-N 1 2 217.316 2.055 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1CC12CC2 ZINC000335510511 384886860 /nfs/dbraw/zinc/88/68/60/384886860.db2.gz FUAQHCPGGGFCMX-SNVBAGLBSA-N 1 2 216.284 2.437 20 0 BEADLO C[N@H+](Cc1nnc[nH]1)[C@@H]1CCCc2ccccc21 ZINC000174806176 384839020 /nfs/dbraw/zinc/83/90/20/384839020.db2.gz OQNXCUUTOMWIMV-CYBMUJFWSA-N 1 2 242.326 2.314 20 0 BEADLO C[N@@H+](Cc1nnc[nH]1)[C@@H]1CCCc2ccccc21 ZINC000174806176 384839026 /nfs/dbraw/zinc/83/90/26/384839026.db2.gz OQNXCUUTOMWIMV-CYBMUJFWSA-N 1 2 242.326 2.314 20 0 BEADLO C[C@H]([NH2+]CCOC(C)(C)C)c1csnn1 ZINC000398227734 384858283 /nfs/dbraw/zinc/85/82/83/384858283.db2.gz HNSXBKQKBNJIQR-QMMMGPOBSA-N 1 2 229.349 2.004 20 0 BEADLO C[N@@H+](Cc1nccs1)C[C@H]1CCCCO1 ZINC000175090171 384865948 /nfs/dbraw/zinc/86/59/48/384865948.db2.gz DMBCWCPUHAQYBC-SNVBAGLBSA-N 1 2 226.345 2.144 20 0 BEADLO C[N@H+](Cc1nccs1)C[C@H]1CCCCO1 ZINC000175090171 384865955 /nfs/dbraw/zinc/86/59/55/384865955.db2.gz DMBCWCPUHAQYBC-SNVBAGLBSA-N 1 2 226.345 2.144 20 0 BEADLO O=C1OCC[C@@]12CCC[N@H+]2Cc1ccc(F)cc1 ZINC000186657546 384866387 /nfs/dbraw/zinc/86/63/87/384866387.db2.gz HBQISSQISPXCKS-AWEZNQCLSA-N 1 2 249.285 2.107 20 0 BEADLO O=C1OCC[C@@]12CCC[N@@H+]2Cc1ccc(F)cc1 ZINC000186657546 384866393 /nfs/dbraw/zinc/86/63/93/384866393.db2.gz HBQISSQISPXCKS-AWEZNQCLSA-N 1 2 249.285 2.107 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+]1CCc2c(C)cc(C)cc2C1 ZINC000186708752 384868006 /nfs/dbraw/zinc/86/80/06/384868006.db2.gz OXYWFOWQVBKODK-GFCCVEGCSA-N 1 2 247.338 2.223 20 0 BEADLO COC(=O)[C@@H](C)[N@H+]1CCc2c(C)cc(C)cc2C1 ZINC000186708752 384868011 /nfs/dbraw/zinc/86/80/11/384868011.db2.gz OXYWFOWQVBKODK-GFCCVEGCSA-N 1 2 247.338 2.223 20 0 BEADLO CO[C@H](CNc1cc(C)[nH+]c(C(C)C)n1)C1CC1 ZINC000338796615 384957507 /nfs/dbraw/zinc/95/75/07/384957507.db2.gz WBJAISNSVYYLNP-GFCCVEGCSA-N 1 2 249.358 2.167 20 0 BEADLO C[C@@H](C(=O)NCCCNc1cccc[nH+]1)C1CC1 ZINC000175346037 384896229 /nfs/dbraw/zinc/89/62/29/384896229.db2.gz INYNJGLDZHPEIU-LLVKDONJSA-N 1 2 247.342 2.046 20 0 BEADLO CCc1cnc(C[N@@H+]2CCC[C@@H]2CF)o1 ZINC000559410465 384898359 /nfs/dbraw/zinc/89/83/59/384898359.db2.gz SXUZTMKBZNJQGS-SECBINFHSA-N 1 2 212.268 2.171 20 0 BEADLO CCc1cnc(C[N@H+]2CCC[C@@H]2CF)o1 ZINC000559410465 384898364 /nfs/dbraw/zinc/89/83/64/384898364.db2.gz SXUZTMKBZNJQGS-SECBINFHSA-N 1 2 212.268 2.171 20 0 BEADLO Cn1ccnc1[C@@H]([NH2+]Cc1ccco1)C1CC1 ZINC000127509015 384909540 /nfs/dbraw/zinc/90/95/40/384909540.db2.gz WNLCSYSWFJGKHT-LBPRGKRZSA-N 1 2 231.299 2.254 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1cscn1)c1cn[nH]c1 ZINC000222510194 384916503 /nfs/dbraw/zinc/91/65/03/384916503.db2.gz RQYJSBKPMSZDPJ-YUMQZZPRSA-N 1 2 222.317 2.278 20 0 BEADLO Cc1ccc(F)cc1C[NH2+]CC(F)F ZINC000147718260 384921317 /nfs/dbraw/zinc/92/13/17/384921317.db2.gz QCRQOFAEWDFOEW-UHFFFAOYSA-N 1 2 203.207 2.489 20 0 BEADLO CC[C@H](Nc1cc(C)[nH+]cn1)[C@H]1CCCO1 ZINC000301824753 384924473 /nfs/dbraw/zinc/92/44/73/384924473.db2.gz IKAHUNPVUFIZDG-WDEREUQCSA-N 1 2 221.304 2.155 20 0 BEADLO C[N@H+](Cc1cc(-c2ccco2)on1)[C@@H]1CCOC1 ZINC000106886235 384940205 /nfs/dbraw/zinc/94/02/05/384940205.db2.gz QYRTZADNVXBAEH-LLVKDONJSA-N 1 2 248.282 2.155 20 0 BEADLO C[N@@H+](Cc1cc(-c2ccco2)on1)[C@@H]1CCOC1 ZINC000106886235 384940210 /nfs/dbraw/zinc/94/02/10/384940210.db2.gz QYRTZADNVXBAEH-LLVKDONJSA-N 1 2 248.282 2.155 20 0 BEADLO O=C(CC1=CCCCC1)NCCCn1cc[nH+]c1 ZINC000106901421 384941518 /nfs/dbraw/zinc/94/15/18/384941518.db2.gz RCCLZXFJKOCCCM-UHFFFAOYSA-N 1 2 247.342 2.280 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)c1cc(C)c(C)o1 ZINC000518315060 384948373 /nfs/dbraw/zinc/94/83/73/384948373.db2.gz PTWKMSKOWMRSHA-UHFFFAOYSA-N 1 2 247.298 2.043 20 0 BEADLO CSC[C@@H](O)Cn1c(C)[nH+]c2ccccc21 ZINC000187722007 384977362 /nfs/dbraw/zinc/97/73/62/384977362.db2.gz DVDXLESLZUICSU-JTQLQIEISA-N 1 2 236.340 2.069 20 0 BEADLO Cc1cnc(NCCCn2cc[nH+]c2)s1 ZINC000302182740 384979206 /nfs/dbraw/zinc/97/92/06/384979206.db2.gz SGFJJLBSAUBGNZ-UHFFFAOYSA-N 1 2 222.317 2.150 20 0 BEADLO COCc1nc(C[NH2+]Cc2ccco2)cs1 ZINC000164407916 384982168 /nfs/dbraw/zinc/98/21/68/384982168.db2.gz XSNAVPXOFMTOAE-UHFFFAOYSA-N 1 2 238.312 2.172 20 0 BEADLO COc1ccc[nH+]c1NCc1cc(C)ns1 ZINC000404423780 384992143 /nfs/dbraw/zinc/99/21/43/384992143.db2.gz KEURRQUKSSQGKW-UHFFFAOYSA-N 1 2 235.312 2.467 20 0 BEADLO CO[C@]1(C)C[C@@H](N(C)c2cc[nH+]c(C)n2)C1(C)C ZINC000086186939 384994121 /nfs/dbraw/zinc/99/41/21/384994121.db2.gz JOJQOOIWPMBIRE-BXUZGUMPSA-N 1 2 249.358 2.425 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)C1[C@@H]2CCC[C@H]12 ZINC000176122180 385012918 /nfs/dbraw/zinc/01/29/18/385012918.db2.gz BPWFPVPTFMPUON-DHHPTOIESA-N 1 2 245.326 2.132 20 0 BEADLO Cc1scc(C(=O)NCc2[nH]cc[nH+]2)c1C ZINC000336230116 385012935 /nfs/dbraw/zinc/01/29/35/385012935.db2.gz YOYIQVUTNDHRKS-UHFFFAOYSA-N 1 2 235.312 2.018 20 0 BEADLO FC1(F)CCC[C@@H]1[NH2+]Cc1ccns1 ZINC000404466174 385014243 /nfs/dbraw/zinc/01/42/43/385014243.db2.gz MJDQBJGLZPTFRW-QMMMGPOBSA-N 1 2 218.272 2.421 20 0 BEADLO CCC[C@H]([NH2+][C@@H]1CC[C@H](F)C1)C(=O)OCC ZINC000310007700 385018222 /nfs/dbraw/zinc/01/82/22/385018222.db2.gz HKHGAEGDENFGAD-AXFHLTTASA-N 1 2 231.311 2.198 20 0 BEADLO Cc1nc(C[N@H+]2C[C@H](C)OC[C@H]2C)c(C)s1 ZINC000336324078 385061614 /nfs/dbraw/zinc/06/16/14/385061614.db2.gz TYWPMXPJSXIWLO-BDAKNGLRSA-N 1 2 240.372 2.369 20 0 BEADLO Cc1nc(C[N@@H+]2C[C@H](C)OC[C@H]2C)c(C)s1 ZINC000336324078 385061624 /nfs/dbraw/zinc/06/16/24/385061624.db2.gz TYWPMXPJSXIWLO-BDAKNGLRSA-N 1 2 240.372 2.369 20 0 BEADLO CC[C@H]([NH2+][C@@H](C)c1cccs1)C(=O)OC ZINC000130906055 385063500 /nfs/dbraw/zinc/06/35/00/385063500.db2.gz FHAHAASGVKJEDP-IUCAKERBSA-N 1 2 227.329 2.350 20 0 BEADLO CC[C@H]([NH2+][C@H](C)c1cccs1)C(=O)OC ZINC000130906459 385063869 /nfs/dbraw/zinc/06/38/69/385063869.db2.gz FHAHAASGVKJEDP-BDAKNGLRSA-N 1 2 227.329 2.350 20 0 BEADLO COC[C@H]1CCCCN(c2cccc[nH+]2)C1 ZINC000364155879 385069553 /nfs/dbraw/zinc/06/95/53/385069553.db2.gz UJNZPRJOANHLDS-LBPRGKRZSA-N 1 2 220.316 2.335 20 0 BEADLO Cc1csc(C[N@H+]2CCSC[C@@H]2C)n1 ZINC000176379717 385075729 /nfs/dbraw/zinc/07/57/29/385075729.db2.gz OAQCJERRQJHRDR-VIFPVBQESA-N 1 2 228.386 2.389 20 0 BEADLO Cc1csc(C[N@@H+]2CCSC[C@@H]2C)n1 ZINC000176379717 385075741 /nfs/dbraw/zinc/07/57/41/385075741.db2.gz OAQCJERRQJHRDR-VIFPVBQESA-N 1 2 228.386 2.389 20 0 BEADLO Cc1ccc(NCc2cnn(C)c2)c(C)[nH+]1 ZINC000087151529 385080156 /nfs/dbraw/zinc/08/01/56/385080156.db2.gz DMQXTAQYIHHBHT-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO Cc1noc(C[N@@H+]2CCC[C@H]2c2ccccn2)n1 ZINC000530724149 385024402 /nfs/dbraw/zinc/02/44/02/385024402.db2.gz WZIQKCZIEAGSPH-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1noc(C[N@H+]2CCC[C@H]2c2ccccn2)n1 ZINC000530724149 385024413 /nfs/dbraw/zinc/02/44/13/385024413.db2.gz WZIQKCZIEAGSPH-LBPRGKRZSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1cc(C[NH2+][C@@H](C)c2csnn2)sn1 ZINC000404508835 385024973 /nfs/dbraw/zinc/02/49/73/385024973.db2.gz OKKVUHOLNYPLFC-ZETCQYMHSA-N 1 2 240.357 2.154 20 0 BEADLO CC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000648265084 385038118 /nfs/dbraw/zinc/03/81/18/385038118.db2.gz ARZDNXTZKOVCFP-JHJVBQTASA-N 1 2 247.342 2.093 20 0 BEADLO CCO[C@H]1C[C@H]1C(=O)Nc1ccc(C)[nH+]c1C ZINC000176208809 385039306 /nfs/dbraw/zinc/03/93/06/385039306.db2.gz ZIBLHXDRCBREDI-PWSUYJOCSA-N 1 2 234.299 2.062 20 0 BEADLO COC1(CCNc2cc(C)[nH+]cn2)CCC1 ZINC000310557891 385112893 /nfs/dbraw/zinc/11/28/93/385112893.db2.gz IWXOZHLQIYQKCJ-UHFFFAOYSA-N 1 2 221.304 2.156 20 0 BEADLO C[C@H](O)CCCn1c[nH+]c2cc(F)c(F)cc21 ZINC000310559340 385117237 /nfs/dbraw/zinc/11/72/37/385117237.db2.gz ZRHFIYBWAWRYPA-QMMMGPOBSA-N 1 2 240.253 2.476 20 0 BEADLO COc1cccnc1C[NH2+]Cc1occc1C ZINC000449745454 385123773 /nfs/dbraw/zinc/12/37/73/385123773.db2.gz CAOKCDILIFXGFF-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO COc1cc(C)[nH+]c(CN[C@@H](C)C(F)(F)F)c1 ZINC000342294555 385134388 /nfs/dbraw/zinc/13/43/88/385134388.db2.gz QETSOGKWQDRPQV-QMMMGPOBSA-N 1 2 248.248 2.439 20 0 BEADLO CC(C)n1cncc1C[NH2+]Cc1ncccc1F ZINC000643768886 385137035 /nfs/dbraw/zinc/13/70/35/385137035.db2.gz XLVVROQWWIHYRE-UHFFFAOYSA-N 1 2 248.305 2.288 20 0 BEADLO COC(=O)C[N@H+](C)Cc1ccc2ccccc2c1 ZINC000061800873 385138786 /nfs/dbraw/zinc/13/87/86/385138786.db2.gz YNEGQUMGEFQZJS-UHFFFAOYSA-N 1 2 243.306 2.445 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1ccc2ccccc2c1 ZINC000061800873 385138791 /nfs/dbraw/zinc/13/87/91/385138791.db2.gz YNEGQUMGEFQZJS-UHFFFAOYSA-N 1 2 243.306 2.445 20 0 BEADLO O=C(C=C1CCC1)NCc1cn2ccccc2[nH+]1 ZINC000151303192 385100315 /nfs/dbraw/zinc/10/03/15/385100315.db2.gz GRXFMUGCKIBVCL-UHFFFAOYSA-N 1 2 241.294 2.061 20 0 BEADLO Cc1cncc(CSc2nc(N)cc(C)[nH+]2)c1 ZINC000189809422 385187248 /nfs/dbraw/zinc/18/72/48/385187248.db2.gz LPEQPZUONUIBNT-UHFFFAOYSA-N 1 2 246.339 2.363 20 0 BEADLO Cc1noc(C[N@@H+](C)[C@@H](C)c2cccc(O)c2)n1 ZINC000109781492 385189479 /nfs/dbraw/zinc/18/94/79/385189479.db2.gz QFQMHKXWNSTIRM-VIFPVBQESA-N 1 2 247.298 2.277 20 0 BEADLO Cc1noc(C[N@H+](C)[C@@H](C)c2cccc(O)c2)n1 ZINC000109781492 385189483 /nfs/dbraw/zinc/18/94/83/385189483.db2.gz QFQMHKXWNSTIRM-VIFPVBQESA-N 1 2 247.298 2.277 20 0 BEADLO CN(Cc1c[nH+]cn1C)c1ccccc1 ZINC000177226271 385202130 /nfs/dbraw/zinc/20/21/30/385202130.db2.gz WWECVXVXHLOWMN-UHFFFAOYSA-N 1 2 201.273 2.057 20 0 BEADLO CCC(CC)N(CC)C(=O)CCc1c[nH+]c[nH]1 ZINC000292071934 385199655 /nfs/dbraw/zinc/19/96/55/385199655.db2.gz HMLKTWMAWSGQLO-UHFFFAOYSA-N 1 2 237.347 2.379 20 0 BEADLO CCC(CC)N(CC)C(=O)CCc1c[nH]c[nH+]1 ZINC000292071934 385199659 /nfs/dbraw/zinc/19/96/59/385199659.db2.gz HMLKTWMAWSGQLO-UHFFFAOYSA-N 1 2 237.347 2.379 20 0 BEADLO O=C(c1cc[nH]c1)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000109265077 385146838 /nfs/dbraw/zinc/14/68/38/385146838.db2.gz VFDJBMHZIUSSKL-LLVKDONJSA-N 1 2 244.298 2.105 20 0 BEADLO CC(C)[N@H+](Cc1ncnn1C)Cc1ccccc1 ZINC000157502332 385200884 /nfs/dbraw/zinc/20/08/84/385200884.db2.gz CXGVTZWKLIVGED-UHFFFAOYSA-N 1 2 244.342 2.226 20 0 BEADLO CC(C)[N@@H+](Cc1ncnn1C)Cc1ccccc1 ZINC000157502332 385200892 /nfs/dbraw/zinc/20/08/92/385200892.db2.gz CXGVTZWKLIVGED-UHFFFAOYSA-N 1 2 244.342 2.226 20 0 BEADLO Cn1ncc(Cl)c1C[N@H+](C)[C@@H]1CCSC1 ZINC000189649444 385173495 /nfs/dbraw/zinc/17/34/95/385173495.db2.gz ZFLQNGFCYNIUAT-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO Cn1ncc(Cl)c1C[N@@H+](C)[C@@H]1CCSC1 ZINC000189649444 385173501 /nfs/dbraw/zinc/17/35/01/385173501.db2.gz ZFLQNGFCYNIUAT-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO Fc1cc2[nH+]cn(CCn3cccn3)c2cc1F ZINC000067712186 385213426 /nfs/dbraw/zinc/21/34/26/385213426.db2.gz PIZAETOZVDJFBW-UHFFFAOYSA-N 1 2 248.236 2.211 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+]2CCOC(C)(C)C2)o1 ZINC000335742366 385213740 /nfs/dbraw/zinc/21/37/40/385213740.db2.gz ANQZVSCXDLSGHT-JTQLQIEISA-N 1 2 224.304 2.155 20 0 BEADLO Cc1cnc([C@H](C)[N@H+]2CCOC(C)(C)C2)o1 ZINC000335742366 385213744 /nfs/dbraw/zinc/21/37/44/385213744.db2.gz ANQZVSCXDLSGHT-JTQLQIEISA-N 1 2 224.304 2.155 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@@H](C)[C@@H](C)c1ccccc1 ZINC000177481276 385250053 /nfs/dbraw/zinc/25/00/53/385250053.db2.gz GLWJGVMAWUBBFY-WOPDTQHZSA-N 1 2 235.327 2.330 20 0 BEADLO CC1(C)C[C@@H]1NC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000290757271 385251967 /nfs/dbraw/zinc/25/19/67/385251967.db2.gz RGDWFPOQMFKJCY-JTQLQIEISA-N 1 2 244.298 2.254 20 0 BEADLO COC(=O)[C@@H](c1cccnc1)[N@@H+]1CCC(C)(C)C1 ZINC000154139300 385305726 /nfs/dbraw/zinc/30/57/26/385305726.db2.gz RLNLEBQMQMCEAH-GFCCVEGCSA-N 1 2 248.326 2.028 20 0 BEADLO COC(=O)[C@@H](c1cccnc1)[N@H+]1CCC(C)(C)C1 ZINC000154139300 385305736 /nfs/dbraw/zinc/30/57/36/385305736.db2.gz RLNLEBQMQMCEAH-GFCCVEGCSA-N 1 2 248.326 2.028 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCS[C@@H](C)CC1 ZINC000190699875 385258307 /nfs/dbraw/zinc/25/83/07/385258307.db2.gz OOEYNSNAVCTGFF-VIFPVBQESA-N 1 2 225.361 2.046 20 0 BEADLO CCCCNC(=O)Nc1cc[nH+]cc1C ZINC000120290648 385279084 /nfs/dbraw/zinc/27/90/84/385279084.db2.gz DWTFEAFZNARIOI-UHFFFAOYSA-N 1 2 207.277 2.312 20 0 BEADLO COc1cc(C[N@H+](C)Cc2cocn2)ccc1O ZINC000191925070 385333499 /nfs/dbraw/zinc/33/34/99/385333499.db2.gz UOMLHLMFNPKJRM-UHFFFAOYSA-N 1 2 248.282 2.021 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2cocn2)ccc1O ZINC000191925070 385333504 /nfs/dbraw/zinc/33/35/04/385333504.db2.gz UOMLHLMFNPKJRM-UHFFFAOYSA-N 1 2 248.282 2.021 20 0 BEADLO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1cocn1 ZINC000191922479 385333888 /nfs/dbraw/zinc/33/38/88/385333888.db2.gz MBHFPJFMCGERIS-CYBMUJFWSA-N 1 2 231.299 2.350 20 0 BEADLO Cn1cccc1[C@H]1CCC[N@H+]1Cc1cocn1 ZINC000191922479 385333893 /nfs/dbraw/zinc/33/38/93/385333893.db2.gz MBHFPJFMCGERIS-CYBMUJFWSA-N 1 2 231.299 2.350 20 0 BEADLO Cc1ccc(N[C@H](C)c2ccnn2C)c[nH+]1 ZINC000192252576 385349955 /nfs/dbraw/zinc/34/99/55/385349955.db2.gz CFPYINUXHDZNCJ-SNVBAGLBSA-N 1 2 216.288 2.297 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)c1ccccc1 ZINC000154785025 385356365 /nfs/dbraw/zinc/35/63/65/385356365.db2.gz PBHWPKSTYFBPIV-UHFFFAOYSA-N 1 2 243.310 2.045 20 0 BEADLO CCOc1ccccc1C[N@@H+]1CCO[C@H](C)C1 ZINC000192465758 385358774 /nfs/dbraw/zinc/35/87/74/385358774.db2.gz PJGPUCBOFIOIRA-GFCCVEGCSA-N 1 2 235.327 2.306 20 0 BEADLO CCOc1ccccc1C[N@H+]1CCO[C@H](C)C1 ZINC000192465758 385358778 /nfs/dbraw/zinc/35/87/78/385358778.db2.gz PJGPUCBOFIOIRA-GFCCVEGCSA-N 1 2 235.327 2.306 20 0 BEADLO Fc1cc(F)cc(C[NH2+]Cc2cocn2)c1 ZINC000179085610 385361860 /nfs/dbraw/zinc/36/18/60/385361860.db2.gz MTZIEIYAPGQPTL-UHFFFAOYSA-N 1 2 224.210 2.243 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)[C@@H]1CC=CCC1 ZINC000154859935 385361914 /nfs/dbraw/zinc/36/19/14/385361914.db2.gz MMPFJDONROOEOV-CYBMUJFWSA-N 1 2 247.342 2.088 20 0 BEADLO C[C@@H]1CCC[C@@H](C(=O)NCCCn2cc[nH+]c2)C1 ZINC000158190499 385362193 /nfs/dbraw/zinc/36/21/93/385362193.db2.gz FLCRTWCYYCZCNI-CHWSQXEVSA-N 1 2 249.358 2.216 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@H](C)CCc1ccc(C)cc1 ZINC000193098935 385384558 /nfs/dbraw/zinc/38/45/58/385384558.db2.gz RSVGOMYAHFLMFY-CHWSQXEVSA-N 1 2 249.354 2.467 20 0 BEADLO C[C@@H](NC(=O)CCc1c[nH+]cn1C)C1CCCC1 ZINC000193265296 385388393 /nfs/dbraw/zinc/38/83/93/385388393.db2.gz XNAXWHHCKUCRFB-LLVKDONJSA-N 1 2 249.358 2.048 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1csc(C)c1 ZINC000294945425 385325353 /nfs/dbraw/zinc/32/53/53/385325353.db2.gz VEWSTWIRZYNBTA-UHFFFAOYSA-N 1 2 227.329 2.051 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1csc(C)c1 ZINC000294945425 385325357 /nfs/dbraw/zinc/32/53/57/385325357.db2.gz VEWSTWIRZYNBTA-UHFFFAOYSA-N 1 2 227.329 2.051 20 0 BEADLO FC(F)(F)c1csc(Cn2cc[nH+]c2)n1 ZINC000155976687 385425139 /nfs/dbraw/zinc/42/51/39/385425139.db2.gz WUBCTOACCXTCRZ-UHFFFAOYSA-N 1 2 233.218 2.407 20 0 BEADLO CCC1(NC(=O)c2ccc3[nH+]ccn3c2)CCC1 ZINC000178593216 385396250 /nfs/dbraw/zinc/39/62/50/385396250.db2.gz VZCRDBHYBHQLDX-UHFFFAOYSA-N 1 2 243.310 2.397 20 0 BEADLO CCc1ccc([C@H](COC)[NH2+]CCF)o1 ZINC000309061545 385397356 /nfs/dbraw/zinc/39/73/56/385397356.db2.gz WZWHWUHEQWIZJT-JTQLQIEISA-N 1 2 215.268 2.089 20 0 BEADLO C[C@@H]1C[C@H]1CC(=O)Nc1cccc2[nH+]ccn21 ZINC000336016997 385397965 /nfs/dbraw/zinc/39/79/65/385397965.db2.gz WGABCLYIAHMDQB-ZJUUUORDSA-N 1 2 229.283 2.319 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[NH2+][C@@H](C)CSC ZINC000180999546 385401536 /nfs/dbraw/zinc/40/15/36/385401536.db2.gz HNZWQJBYVINFBH-WDEREUQCSA-N 1 2 247.404 2.305 20 0 BEADLO Cc1c[nH+]cc(NCC[C@@H]2CCOC2)c1 ZINC000309090576 385411785 /nfs/dbraw/zinc/41/17/85/385411785.db2.gz BZEZACSSJVWYNW-LLVKDONJSA-N 1 2 206.289 2.229 20 0 BEADLO CC(=O)c1ccc(-c2c[nH+]cn2C)cc1 ZINC000169495808 385414199 /nfs/dbraw/zinc/41/41/99/385414199.db2.gz VSYFGFHJECOEPU-UHFFFAOYSA-N 1 2 200.241 2.290 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C=Cc1ccsc1 ZINC000492825903 385442348 /nfs/dbraw/zinc/44/23/48/385442348.db2.gz UCDOFXYMQGARNG-IHWYPQMZSA-N 1 2 247.323 2.109 20 0 BEADLO COC[C@H](C)N(C)c1[nH]c2ccccc2[nH+]1 ZINC000179283919 385457832 /nfs/dbraw/zinc/45/78/32/385457832.db2.gz BAHIPKYOLOEEPM-VIFPVBQESA-N 1 2 219.288 2.034 20 0 BEADLO CCCOc1cccc2c(NCCO)cc[nH+]c12 ZINC000194693535 385445970 /nfs/dbraw/zinc/44/59/70/385445970.db2.gz SARNBIREQLFPGP-UHFFFAOYSA-N 1 2 246.310 2.428 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cccc(F)c2N)CCO1 ZINC000156343358 385446417 /nfs/dbraw/zinc/44/64/17/385446417.db2.gz MSVPLVUDTAAZNU-LLVKDONJSA-N 1 2 238.306 2.019 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cccc(F)c2N)CCO1 ZINC000156343358 385446420 /nfs/dbraw/zinc/44/64/20/385446420.db2.gz MSVPLVUDTAAZNU-LLVKDONJSA-N 1 2 238.306 2.019 20 0 BEADLO CC(C)N(C(=O)c1ccc2[nH+]ccn2c1)C1CC1 ZINC000170865415 385451788 /nfs/dbraw/zinc/45/17/88/385451788.db2.gz RGETXEWFGOXYSD-UHFFFAOYSA-N 1 2 243.310 2.347 20 0 BEADLO CC(C)[N@H+](CC(N)=O)Cc1sccc1Cl ZINC000194308705 385429733 /nfs/dbraw/zinc/42/97/33/385429733.db2.gz DCKVQQMIFNVXTF-UHFFFAOYSA-N 1 2 246.763 2.097 20 0 BEADLO CC(C)[N@@H+](CC(N)=O)Cc1sccc1Cl ZINC000194308705 385429735 /nfs/dbraw/zinc/42/97/35/385429735.db2.gz DCKVQQMIFNVXTF-UHFFFAOYSA-N 1 2 246.763 2.097 20 0 BEADLO C[C@H](Nc1cccc[nH+]1)[C@H]1CCCOC1 ZINC000309125812 385429740 /nfs/dbraw/zinc/42/97/40/385429740.db2.gz PMWXGZMNNKQNJJ-QWRGUYRKSA-N 1 2 206.289 2.309 20 0 BEADLO C=Cn1cc(C[NH2+]Cc2nc(C)cs2)cn1 ZINC000194350639 385431357 /nfs/dbraw/zinc/43/13/57/385431357.db2.gz SLTCOBSIQLBSQN-UHFFFAOYSA-N 1 2 234.328 2.038 20 0 BEADLO Cc1ccoc1C[NH2+][C@@H](C)c1ccon1 ZINC000309140783 385432531 /nfs/dbraw/zinc/43/25/31/385432531.db2.gz SYQCSTCGQOTHDS-VIFPVBQESA-N 1 2 206.245 2.427 20 0 BEADLO CN(C[C@H]1CCCO1)c1[nH+]c2ccccc2n1C ZINC000179289204 385457363 /nfs/dbraw/zinc/45/73/63/385457363.db2.gz YOYJZQRXRMHNNI-LLVKDONJSA-N 1 2 245.326 2.189 20 0 BEADLO COC(=O)c1coc(C[N@H+](C)Cc2ccco2)c1 ZINC000171029429 385464537 /nfs/dbraw/zinc/46/45/37/385464537.db2.gz LPEDCZGETSELOE-UHFFFAOYSA-N 1 2 249.266 2.291 20 0 BEADLO COC(=O)c1coc(C[N@@H+](C)Cc2ccco2)c1 ZINC000171029429 385464539 /nfs/dbraw/zinc/46/45/39/385464539.db2.gz LPEDCZGETSELOE-UHFFFAOYSA-N 1 2 249.266 2.291 20 0 BEADLO C[C@@H](O)C[C@H](C)CNc1cc[nH+]c(C2CC2)n1 ZINC000156699189 385465697 /nfs/dbraw/zinc/46/56/97/385465697.db2.gz CISZPGIRWQGADB-VHSXEESVSA-N 1 2 235.331 2.173 20 0 BEADLO C[C@H](O)C[C@H](C)CNc1cc[nH+]c(C2CC2)n1 ZINC000156699463 385465893 /nfs/dbraw/zinc/46/58/93/385465893.db2.gz CISZPGIRWQGADB-UWVGGRQHSA-N 1 2 235.331 2.173 20 0 BEADLO C[C@H](C1CC1)n1nccc1NCc1[nH]cc[nH+]1 ZINC000171377585 385480441 /nfs/dbraw/zinc/48/04/41/385480441.db2.gz WPZHZOREOWTGGC-SECBINFHSA-N 1 2 231.303 2.189 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2C[C@@H](C)[C@@H]2C)o1 ZINC000336375559 385486458 /nfs/dbraw/zinc/48/64/58/385486458.db2.gz YHYLANSLBXZRAQ-BDAKNGLRSA-N 1 2 209.293 2.033 20 0 BEADLO CC(C)c1nnc(C[N@H+]2C[C@@H](C)[C@@H]2C)o1 ZINC000336375559 385486464 /nfs/dbraw/zinc/48/64/64/385486464.db2.gz YHYLANSLBXZRAQ-BDAKNGLRSA-N 1 2 209.293 2.033 20 0 BEADLO CC[C@@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492896428 385460208 /nfs/dbraw/zinc/46/02/08/385460208.db2.gz JCXKRIUKNNIWRQ-MVIFTORASA-N 1 2 233.315 2.072 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)C(=O)[C@H]1CCCC1(C)C ZINC000616928121 385491630 /nfs/dbraw/zinc/49/16/30/385491630.db2.gz XJVAUZOJTHSTFH-LLVKDONJSA-N 1 2 235.331 2.194 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)C(=O)[C@H]1CCCC1(C)C ZINC000616928121 385491631 /nfs/dbraw/zinc/49/16/31/385491631.db2.gz XJVAUZOJTHSTFH-LLVKDONJSA-N 1 2 235.331 2.194 20 0 BEADLO Cc1cc(C)c(C[N@H+](C)Cc2nnc[nH]2)cc1C ZINC000179789855 385492581 /nfs/dbraw/zinc/49/25/81/385492581.db2.gz HYZCNJCOUHILKT-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO Cc1cc(C)c(C[N@@H+](C)Cc2nnc[nH]2)cc1C ZINC000179789855 385492585 /nfs/dbraw/zinc/49/25/85/385492585.db2.gz HYZCNJCOUHILKT-UHFFFAOYSA-N 1 2 244.342 2.362 20 0 BEADLO Cc1nc(C[N@@H+]2CCCc3ccccc3C2)no1 ZINC000171595495 385499768 /nfs/dbraw/zinc/49/97/68/385499768.db2.gz WYKYGSPKUNGSFZ-UHFFFAOYSA-N 1 2 243.310 2.326 20 0 BEADLO Cc1nc(C[N@H+]2CCCc3ccccc3C2)no1 ZINC000171595495 385499773 /nfs/dbraw/zinc/49/97/73/385499773.db2.gz WYKYGSPKUNGSFZ-UHFFFAOYSA-N 1 2 243.310 2.326 20 0 BEADLO C[C@@H](N[C@H]1C[C@@H](C)n2cc[nH+]c21)C(F)(F)F ZINC000295225095 385502551 /nfs/dbraw/zinc/50/25/51/385502551.db2.gz NDSFRHZLKQQPOE-PRJMDXOYSA-N 1 2 233.237 2.429 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](Cc1cc[nH]n1)C2 ZINC000336546567 385504546 /nfs/dbraw/zinc/50/45/46/385504546.db2.gz ZHMHDCJKHGCRLT-UHFFFAOYSA-N 1 2 213.284 2.234 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](Cc1cc[nH]n1)C2 ZINC000336546567 385504549 /nfs/dbraw/zinc/50/45/49/385504549.db2.gz ZHMHDCJKHGCRLT-UHFFFAOYSA-N 1 2 213.284 2.234 20 0 BEADLO CC[N@H+](CC1CC1)[C@H](C(=O)OC)c1cccnc1 ZINC000157926246 385535850 /nfs/dbraw/zinc/53/58/50/385535850.db2.gz WUEFSWCDSGAJBQ-ZDUSSCGKSA-N 1 2 248.326 2.028 20 0 BEADLO CC[N@@H+](CC1CC1)[C@H](C(=O)OC)c1cccnc1 ZINC000157926246 385535855 /nfs/dbraw/zinc/53/58/55/385535855.db2.gz WUEFSWCDSGAJBQ-ZDUSSCGKSA-N 1 2 248.326 2.028 20 0 BEADLO CC1(C)CCC(C(=O)NCCn2cc[nH+]c2)CC1 ZINC000157743111 385519948 /nfs/dbraw/zinc/51/99/48/385519948.db2.gz WXSPYFQMZXMOFY-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1cnc(C[NH+]2C[C@H](C)O[C@@H](C)C2)s1 ZINC000180409737 385521716 /nfs/dbraw/zinc/52/17/16/385521716.db2.gz SNPMTOWRDXMPRJ-IUCAKERBSA-N 1 2 226.345 2.061 20 0 BEADLO Cn1nc(C2CCCC2)cc1NCc1[nH]cc[nH+]1 ZINC000181022192 385560616 /nfs/dbraw/zinc/56/06/16/385560616.db2.gz ZGBDHRLBQCIRIV-UHFFFAOYSA-N 1 2 245.330 2.413 20 0 BEADLO Cc1ccc(C(=O)Nc2cc[nH+]cc2C)n1C ZINC000107294392 385560936 /nfs/dbraw/zinc/56/09/36/385560936.db2.gz BLNUYUPIAHMKTH-UHFFFAOYSA-N 1 2 229.283 2.289 20 0 BEADLO Cc1ncsc1C(=O)Nc1cc[nH+]cc1C ZINC000107289409 385561462 /nfs/dbraw/zinc/56/14/62/385561462.db2.gz KPPPDZQRHHDTRB-UHFFFAOYSA-N 1 2 233.296 2.407 20 0 BEADLO COC[C@H]([NH2+]Cc1ccon1)c1ccccc1 ZINC000181679712 385593640 /nfs/dbraw/zinc/59/36/40/385593640.db2.gz IXWSHFPORBOEBO-ZDUSSCGKSA-N 1 2 232.283 2.152 20 0 BEADLO CC(C)[C@H]1CCCN(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493698269 385597024 /nfs/dbraw/zinc/59/70/24/385597024.db2.gz SXIUQIGSASFPKN-FYJFLYSWSA-N 1 2 247.342 2.318 20 0 BEADLO C[C@@H]([NH2+][C@@H]1CCOC1=O)C(C)(C)c1ccccc1 ZINC000181770588 385602407 /nfs/dbraw/zinc/60/24/07/385602407.db2.gz LTEKMUJAVFRKIV-DGCLKSJQSA-N 1 2 247.338 2.258 20 0 BEADLO CC(C)COCC[N@@H+]1CCC=C(F)C1 ZINC000337293870 385586420 /nfs/dbraw/zinc/58/64/20/385586420.db2.gz HKPNXWGQWIOTPH-UHFFFAOYSA-N 1 2 201.285 2.218 20 0 BEADLO CC(C)COCC[N@H+]1CCC=C(F)C1 ZINC000337293870 385586424 /nfs/dbraw/zinc/58/64/24/385586424.db2.gz HKPNXWGQWIOTPH-UHFFFAOYSA-N 1 2 201.285 2.218 20 0 BEADLO CC[C@@H](C)C(=O)NC[C@H]1CCCn2cc(C)[nH+]c21 ZINC000337289432 385587175 /nfs/dbraw/zinc/58/71/75/385587175.db2.gz BUCVUBBEFPKTEI-ZYHUDNBSSA-N 1 2 249.358 2.231 20 0 BEADLO FC(F)O[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccn[nH]1 ZINC000337306551 385592715 /nfs/dbraw/zinc/59/27/15/385592715.db2.gz RVXHQVGBGCWYJM-VHSXEESVSA-N 1 2 245.273 2.050 20 0 BEADLO C[C@@H]1SCC[N@H+](Cc2nccs2)[C@H]1C ZINC000269672247 385622921 /nfs/dbraw/zinc/62/29/21/385622921.db2.gz AUFCBDMUTSTTKP-IUCAKERBSA-N 1 2 228.386 2.469 20 0 BEADLO C[C@@H]1SCC[N@@H+](Cc2nccs2)[C@H]1C ZINC000269672247 385622925 /nfs/dbraw/zinc/62/29/25/385622925.db2.gz AUFCBDMUTSTTKP-IUCAKERBSA-N 1 2 228.386 2.469 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)s1 ZINC000366562102 385633723 /nfs/dbraw/zinc/63/37/23/385633723.db2.gz VBJMQGBYTCMEJA-WDEREUQCSA-N 1 2 209.314 2.030 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@@H]3C[C@@H]32)s1 ZINC000366562102 385633728 /nfs/dbraw/zinc/63/37/28/385633728.db2.gz VBJMQGBYTCMEJA-WDEREUQCSA-N 1 2 209.314 2.030 20 0 BEADLO CCCn1ncnc1C[N@@H+]1CCC(C)=C(C)C1 ZINC000280826387 385609483 /nfs/dbraw/zinc/60/94/83/385609483.db2.gz VLVHDOUPDNYUKB-UHFFFAOYSA-N 1 2 234.347 2.230 20 0 BEADLO CCCn1ncnc1C[N@H+]1CCC(C)=C(C)C1 ZINC000280826387 385609489 /nfs/dbraw/zinc/60/94/89/385609489.db2.gz VLVHDOUPDNYUKB-UHFFFAOYSA-N 1 2 234.347 2.230 20 0 BEADLO Cc1ccncc1C[N@H+](C)Cc1nccs1 ZINC000269570413 385610228 /nfs/dbraw/zinc/61/02/28/385610228.db2.gz ATQHUIHYXGNOKN-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ccncc1C[N@@H+](C)Cc1nccs1 ZINC000269570413 385610230 /nfs/dbraw/zinc/61/02/30/385610230.db2.gz ATQHUIHYXGNOKN-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CC(C)(O)CC[N@@H+]1CCCC[C@H]1C(F)F ZINC000337389872 385639640 /nfs/dbraw/zinc/63/96/40/385639640.db2.gz GVSNFNHLCMTTSF-VIFPVBQESA-N 1 2 221.291 2.267 20 0 BEADLO CC(C)(O)CC[N@H+]1CCCC[C@H]1C(F)F ZINC000337389872 385639643 /nfs/dbraw/zinc/63/96/43/385639643.db2.gz GVSNFNHLCMTTSF-VIFPVBQESA-N 1 2 221.291 2.267 20 0 BEADLO Cc1[nH]c(C(=O)NCC2(C3CC3)CCC2)c[nH+]1 ZINC000269826299 385639920 /nfs/dbraw/zinc/63/99/20/385639920.db2.gz HWFJUWWKXOMKPF-UHFFFAOYSA-N 1 2 233.315 2.028 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)CC1(C)CCCCC1 ZINC000269916739 385648808 /nfs/dbraw/zinc/64/88/08/385648808.db2.gz FGCYDTHLXMBIJS-UHFFFAOYSA-N 1 2 249.358 2.397 20 0 BEADLO CC(C)c1cc(N2CC[C@H](O)C2)nc(C(C)C)[nH+]1 ZINC000269975268 385654394 /nfs/dbraw/zinc/65/43/94/385654394.db2.gz PJPWCQKHDIMYNZ-NSHDSACASA-N 1 2 249.358 2.294 20 0 BEADLO Cn1cc(CC[N@@H+]2CCCC[C@H]2C(F)F)cn1 ZINC000337423681 385655899 /nfs/dbraw/zinc/65/58/99/385655899.db2.gz VQXNQGAZXKPQRB-NSHDSACASA-N 1 2 243.301 2.082 20 0 BEADLO Cn1cc(CC[N@H+]2CCCC[C@H]2C(F)F)cn1 ZINC000337423681 385655904 /nfs/dbraw/zinc/65/59/04/385655904.db2.gz VQXNQGAZXKPQRB-NSHDSACASA-N 1 2 243.301 2.082 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+]Cc2nccc(N)n2)cc1 ZINC000182335954 385659298 /nfs/dbraw/zinc/65/92/98/385659298.db2.gz IVIFTUZOJSFFNV-LLVKDONJSA-N 1 2 242.326 2.218 20 0 BEADLO COc1cc(C)[nH+]c(CSc2nccn2C)c1 ZINC000270139268 385676418 /nfs/dbraw/zinc/67/64/18/385676418.db2.gz QOSOSJPSZKBVGS-UHFFFAOYSA-N 1 2 249.339 2.424 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC1(C)CCOCC1 ZINC000182642318 385692403 /nfs/dbraw/zinc/69/24/03/385692403.db2.gz PKAHRNYCHWAMLZ-UHFFFAOYSA-N 1 2 249.314 2.081 20 0 BEADLO CC[C@H](O)CNc1ccc2ccccc2[nH+]1 ZINC000229993807 385697911 /nfs/dbraw/zinc/69/79/11/385697911.db2.gz RDPPYKSUUPHRON-NSHDSACASA-N 1 2 216.284 2.418 20 0 BEADLO COC(=O)[C@H](C)[NH2+][C@H]1CS[C@H](C(C)(C)C)C1 ZINC000309578223 385712226 /nfs/dbraw/zinc/71/22/26/385712226.db2.gz POMAPUZLIXQZPH-AEJSXWLSSA-N 1 2 245.388 2.058 20 0 BEADLO CO[C@H]1CCCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000270588876 385718652 /nfs/dbraw/zinc/71/86/52/385718652.db2.gz SERRHDRANYYKLU-JTQLQIEISA-N 1 2 231.299 2.178 20 0 BEADLO CCN(CCOC)c1[nH]c2ccccc2[nH+]1 ZINC000270547557 385716795 /nfs/dbraw/zinc/71/67/95/385716795.db2.gz FEMOPLWDRFWWOE-UHFFFAOYSA-N 1 2 219.288 2.036 20 0 BEADLO CC[C@@H](C)[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000282185945 385737774 /nfs/dbraw/zinc/73/77/74/385737774.db2.gz WFGYZMBPOZERNE-PWSUYJOCSA-N 1 2 230.315 2.282 20 0 BEADLO C[C@H]([NH2+][C@@H]1C[C@H](C)[C@@H]1C)C(=O)OC(C)(C)C ZINC000309608896 385739038 /nfs/dbraw/zinc/73/90/38/385739038.db2.gz ZKKPEVNVFFDLOY-XWLWVQCSSA-N 1 2 227.348 2.351 20 0 BEADLO CC[C@H](Nc1ccc(OC)nc1)c1[nH+]ccn1C ZINC000183195463 385742606 /nfs/dbraw/zinc/74/26/06/385742606.db2.gz CBADYSLAFBAICA-NSHDSACASA-N 1 2 246.314 2.387 20 0 BEADLO CSCCC[N@H+](C)Cc1ncc(Cl)n1C ZINC000183264163 385746820 /nfs/dbraw/zinc/74/68/20/385746820.db2.gz ZGTGSYVCBYQQNU-UHFFFAOYSA-N 1 2 247.795 2.258 20 0 BEADLO CSCCC[N@@H+](C)Cc1ncc(Cl)n1C ZINC000183264163 385746828 /nfs/dbraw/zinc/74/68/28/385746828.db2.gz ZGTGSYVCBYQQNU-UHFFFAOYSA-N 1 2 247.795 2.258 20 0 BEADLO CCSCC[N@H+](C)Cc1ncc(Cl)n1C ZINC000183264462 385747742 /nfs/dbraw/zinc/74/77/42/385747742.db2.gz LLOJSALVHBOFRI-UHFFFAOYSA-N 1 2 247.795 2.258 20 0 BEADLO CCSCC[N@@H+](C)Cc1ncc(Cl)n1C ZINC000183264462 385747746 /nfs/dbraw/zinc/74/77/46/385747746.db2.gz LLOJSALVHBOFRI-UHFFFAOYSA-N 1 2 247.795 2.258 20 0 BEADLO CCc1cc(N)nc(SC[C@H](F)CC)[nH+]1 ZINC000336700034 385762629 /nfs/dbraw/zinc/76/26/29/385762629.db2.gz PELPBJRUJDBVJH-SSDOTTSWSA-N 1 2 229.324 2.292 20 0 BEADLO CC[C@H]1C[N@H+](Cc2scnc2C)CCO1 ZINC000271055229 385779242 /nfs/dbraw/zinc/77/92/42/385779242.db2.gz ZDPVXQFNZGIGIG-JTQLQIEISA-N 1 2 226.345 2.062 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2scnc2C)CCO1 ZINC000271055229 385779246 /nfs/dbraw/zinc/77/92/46/385779246.db2.gz ZDPVXQFNZGIGIG-JTQLQIEISA-N 1 2 226.345 2.062 20 0 BEADLO CN(CCOCC1CC1)c1[nH]c2ccccc2[nH+]1 ZINC000270566553 385720652 /nfs/dbraw/zinc/72/06/52/385720652.db2.gz LVFOJNJMQKORGS-UHFFFAOYSA-N 1 2 245.326 2.426 20 0 BEADLO COC[C@H]1CCCN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000270601430 385722827 /nfs/dbraw/zinc/72/28/27/385722827.db2.gz VXVYJILJXPZLIC-NSHDSACASA-N 1 2 245.326 2.426 20 0 BEADLO CN(C[C@@H]1CCC[C@@H]1O)c1[nH]c2ccccc2[nH+]1 ZINC000270595155 385723129 /nfs/dbraw/zinc/72/31/29/385723129.db2.gz UKNZJQRDLHSSRJ-GWCFXTLKSA-N 1 2 245.326 2.160 20 0 BEADLO Cn1ccc(C[N@H+]2CC=C(C(F)(F)F)CC2)n1 ZINC000271201826 385804092 /nfs/dbraw/zinc/80/40/92/385804092.db2.gz QFFRWSKZSRHMPS-UHFFFAOYSA-N 1 2 245.248 2.115 20 0 BEADLO Cn1ccc(C[N@@H+]2CC=C(C(F)(F)F)CC2)n1 ZINC000271201826 385804098 /nfs/dbraw/zinc/80/40/98/385804098.db2.gz QFFRWSKZSRHMPS-UHFFFAOYSA-N 1 2 245.248 2.115 20 0 BEADLO CC(C)c1nc(N(C)C)nc(NC2CCC2)[nH+]1 ZINC000271208400 385806970 /nfs/dbraw/zinc/80/69/70/385806970.db2.gz ROUOIJXERZBXJT-UHFFFAOYSA-N 1 2 235.335 2.025 20 0 BEADLO CC(C)c1nc(NC2CCC2)nc(N(C)C)[nH+]1 ZINC000271208400 385806974 /nfs/dbraw/zinc/80/69/74/385806974.db2.gz ROUOIJXERZBXJT-UHFFFAOYSA-N 1 2 235.335 2.025 20 0 BEADLO Cc1cc(C(=O)N[C@H](c2[nH]cc[nH+]2)C(C)C)co1 ZINC000283137601 385809885 /nfs/dbraw/zinc/80/98/85/385809885.db2.gz XOZYCYFIVROHFE-NSHDSACASA-N 1 2 247.298 2.438 20 0 BEADLO CC(C)(C)n1ncnc1C[NH+]1CCCCC1 ZINC000335645511 385830551 /nfs/dbraw/zinc/83/05/51/385830551.db2.gz MRCHWHUKTZEVRW-UHFFFAOYSA-N 1 2 222.336 2.019 20 0 BEADLO CC/C=C(\C)C(=O)NCc1c[nH+]ccc1OC ZINC000294494157 385858055 /nfs/dbraw/zinc/85/80/55/385858055.db2.gz JXJPVCQLXZNPLJ-BJMVGYQFSA-N 1 2 234.299 2.063 20 0 BEADLO C[C@H]([NH2+]Cc1c[nH]nn1)C(C)(C)c1ccccc1 ZINC000284210649 385858074 /nfs/dbraw/zinc/85/80/74/385858074.db2.gz ZEYMCMSUZNLTJM-NSHDSACASA-N 1 2 244.342 2.261 20 0 BEADLO C[C@H]([NH2+]Cc1cn[nH]n1)C(C)(C)c1ccccc1 ZINC000284210649 385858077 /nfs/dbraw/zinc/85/80/77/385858077.db2.gz ZEYMCMSUZNLTJM-NSHDSACASA-N 1 2 244.342 2.261 20 0 BEADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccn(C)n2)o1 ZINC000112341602 385839115 /nfs/dbraw/zinc/83/91/15/385839115.db2.gz QODNMBKDBMPAIU-MFKMUULPSA-N 1 2 245.326 2.426 20 0 BEADLO c1ccc2[nH+]c(N3CCO[C@@H]4CCC[C@H]43)[nH]c2c1 ZINC000271571067 385839217 /nfs/dbraw/zinc/83/92/17/385839217.db2.gz BTYOZWAZKOODNE-CHWSQXEVSA-N 1 2 243.310 2.321 20 0 BEADLO COC[C@H]([NH2+][C@H](C)c1cn[nH]c1)c1ccc(C)o1 ZINC000283953054 385840915 /nfs/dbraw/zinc/84/09/15/385840915.db2.gz FXDKDOPSOIVKEQ-PWSUYJOCSA-N 1 2 249.314 2.349 20 0 BEADLO Cc1cnc(C[NH2+][C@H](CCO)c2ccccc2)o1 ZINC000271737923 385848235 /nfs/dbraw/zinc/84/82/35/385848235.db2.gz ZXOLIAIDRJPEGK-CYBMUJFWSA-N 1 2 246.310 2.196 20 0 BEADLO CC/C(C)=C/C(=O)NCc1cn2ccccc2[nH+]1 ZINC000294459935 385853820 /nfs/dbraw/zinc/85/38/20/385853820.db2.gz UFSAMYMTDJVCJB-DHZHZOJOSA-N 1 2 243.310 2.307 20 0 BEADLO Cc1cn[nH]c1C[N@@H+](C)[C@@H](C)c1ccncc1 ZINC000284139503 385854275 /nfs/dbraw/zinc/85/42/75/385854275.db2.gz QAHSYLZPPRMNCP-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO Cc1cn[nH]c1C[N@H+](C)[C@@H](C)c1ccncc1 ZINC000284139503 385854278 /nfs/dbraw/zinc/85/42/78/385854278.db2.gz QAHSYLZPPRMNCP-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO Cc1c[nH]nc1C[N@@H+](C)[C@@H](C)c1ccncc1 ZINC000284139503 385854282 /nfs/dbraw/zinc/85/42/82/385854282.db2.gz QAHSYLZPPRMNCP-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO Cc1c[nH]nc1C[N@H+](C)[C@@H](C)c1ccncc1 ZINC000284139503 385854284 /nfs/dbraw/zinc/85/42/84/385854284.db2.gz QAHSYLZPPRMNCP-NSHDSACASA-N 1 2 230.315 2.306 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1cccc(C)c1C ZINC000271137123 385793263 /nfs/dbraw/zinc/79/32/63/385793263.db2.gz AEEMUUUSBOAPKO-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1cccc(C)c1C ZINC000271137123 385793276 /nfs/dbraw/zinc/79/32/76/385793276.db2.gz AEEMUUUSBOAPKO-UHFFFAOYSA-N 1 2 235.327 2.298 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N1CCC[C@H]1C1CCC1 ZINC000282901415 385794641 /nfs/dbraw/zinc/79/46/41/385794641.db2.gz AWBGAEFAQWAOJB-LBPRGKRZSA-N 1 2 247.342 2.133 20 0 BEADLO Cc1noc(C(C)(C)[NH2+]Cc2cccs2)n1 ZINC000283833391 385797137 /nfs/dbraw/zinc/79/71/37/385797137.db2.gz FGDRKJDWUGEUHI-UHFFFAOYSA-N 1 2 237.328 2.464 20 0 BEADLO CC1(C)C[C@H]1[NH2+][C@@H](c1cccs1)c1nnc[nH]1 ZINC000294697092 385884154 /nfs/dbraw/zinc/88/41/54/385884154.db2.gz IVIQRBJKLDKJPQ-ZJUUUORDSA-N 1 2 248.355 2.344 20 0 BEADLO Cc1nc(C[NH2+]Cc2ccns2)cs1 ZINC000404452986 385884271 /nfs/dbraw/zinc/88/42/71/385884271.db2.gz HODUPWBCBHMDSI-UHFFFAOYSA-N 1 2 225.342 2.198 20 0 BEADLO C[C@@H](NC(=O)CCn1cc[nH+]c1)c1cccs1 ZINC000338060859 385885110 /nfs/dbraw/zinc/88/51/10/385885110.db2.gz XATSPNCMDIUVFZ-SNVBAGLBSA-N 1 2 249.339 2.212 20 0 BEADLO C[NH+](C)Cc1nc([C@@H]2C[C@@H]2c2ccccc2)no1 ZINC000338066305 385885830 /nfs/dbraw/zinc/88/58/30/385885830.db2.gz AQXJQFXHJOKWEX-VXGBXAGGSA-N 1 2 243.310 2.402 20 0 BEADLO C[C@H]1CCCC[C@H]1Nc1nc[nH+]c2c1OCCN2 ZINC000647845911 385887739 /nfs/dbraw/zinc/88/77/39/385887739.db2.gz FKXIKBJBFCHEGQ-VHSXEESVSA-N 1 2 248.330 2.272 20 0 BEADLO C[C@H]1CCCC[C@H]1Nc1[nH+]cnc2c1OCCN2 ZINC000647845911 385887743 /nfs/dbraw/zinc/88/77/43/385887743.db2.gz FKXIKBJBFCHEGQ-VHSXEESVSA-N 1 2 248.330 2.272 20 0 BEADLO CC[C@@H]1CCCCN1c1nc[nH+]c2c1OCCN2 ZINC000647844591 385894612 /nfs/dbraw/zinc/89/46/12/385894612.db2.gz LRRLHRIECUZWDS-SNVBAGLBSA-N 1 2 248.330 2.050 20 0 BEADLO CC[C@@H]1CCCCN1c1[nH+]cnc2c1OCCN2 ZINC000647844591 385894615 /nfs/dbraw/zinc/89/46/15/385894615.db2.gz LRRLHRIECUZWDS-SNVBAGLBSA-N 1 2 248.330 2.050 20 0 BEADLO COC(=O)[C@H](CC(C)C)[N@H+](C)Cc1ccco1 ZINC000285069536 385896751 /nfs/dbraw/zinc/89/67/51/385896751.db2.gz FAODMYVFOXEHLL-LBPRGKRZSA-N 1 2 239.315 2.299 20 0 BEADLO COC(=O)[C@H](CC(C)C)[N@@H+](C)Cc1ccco1 ZINC000285069536 385896755 /nfs/dbraw/zinc/89/67/55/385896755.db2.gz FAODMYVFOXEHLL-LBPRGKRZSA-N 1 2 239.315 2.299 20 0 BEADLO Cc1cc(CNC(=O)N2CC=CCC2)cc(C)[nH+]1 ZINC000643241835 385904183 /nfs/dbraw/zinc/90/41/83/385904183.db2.gz WQZNYMWAVKHXJP-UHFFFAOYSA-N 1 2 245.326 2.170 20 0 BEADLO COC[C@@]1(C)CCN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000294861721 385905382 /nfs/dbraw/zinc/90/53/82/385905382.db2.gz CEOLTSFSZMNASZ-AWEZNQCLSA-N 1 2 247.342 2.217 20 0 BEADLO Cc1cnn(C)c1CNc1ccc[nH+]c1C ZINC000285191746 385905500 /nfs/dbraw/zinc/90/55/00/385905500.db2.gz RUFKEYDHMOBRSO-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO Cn1cc[nH+]c1CNC(=O)C1=CCC(C)(C)CC1 ZINC000335039362 385930334 /nfs/dbraw/zinc/93/03/34/385930334.db2.gz KENWISSNCSTXLQ-UHFFFAOYSA-N 1 2 247.342 2.173 20 0 BEADLO CS[C@@H]1CC[N@H+](Cc2nccn2C(F)F)C1 ZINC000294920788 385917040 /nfs/dbraw/zinc/91/70/40/385917040.db2.gz AVONLWBLRZFRMU-MRVPVSSYSA-N 1 2 247.314 2.216 20 0 BEADLO CS[C@@H]1CC[N@@H+](Cc2nccn2C(F)F)C1 ZINC000294920788 385917046 /nfs/dbraw/zinc/91/70/46/385917046.db2.gz AVONLWBLRZFRMU-MRVPVSSYSA-N 1 2 247.314 2.216 20 0 BEADLO Cc1ccoc1C[NH2+][C@H](c1nncn1C)C(C)C ZINC000285386421 385921560 /nfs/dbraw/zinc/92/15/60/385921560.db2.gz DEBOSJXUZHXTFY-LBPRGKRZSA-N 1 2 248.330 2.203 20 0 BEADLO NC(=O)[C@H]1CCC[N@@H+]1Cc1ccc(Cl)cn1 ZINC000335039417 385930172 /nfs/dbraw/zinc/93/01/72/385930172.db2.gz BILAGMFGGXKYMM-SNVBAGLBSA-N 1 2 239.706 2.235 20 0 BEADLO NC(=O)[C@H]1CCC[N@H+]1Cc1ccc(Cl)cn1 ZINC000335039417 385930180 /nfs/dbraw/zinc/93/01/80/385930180.db2.gz BILAGMFGGXKYMM-SNVBAGLBSA-N 1 2 239.706 2.235 20 0 BEADLO c1[nH]nnc1C[NH2+][C@H](c1ccccc1)C1CCC1 ZINC000294949247 385925306 /nfs/dbraw/zinc/92/53/06/385925306.db2.gz MKIFZBTWODLIDV-CQSZACIVSA-N 1 2 242.326 2.436 20 0 BEADLO c1n[nH]nc1C[NH2+][C@H](c1ccccc1)C1CCC1 ZINC000294949247 385925311 /nfs/dbraw/zinc/92/53/11/385925311.db2.gz MKIFZBTWODLIDV-CQSZACIVSA-N 1 2 242.326 2.436 20 0 BEADLO Cc1nocc1C[N@@H+]1CCn2cccc2[C@@H]1C ZINC000294953364 385925580 /nfs/dbraw/zinc/92/55/80/385925580.db2.gz QFQMHXFWQZMAAV-NSHDSACASA-N 1 2 231.299 2.361 20 0 BEADLO Cc1nocc1C[N@H+]1CCn2cccc2[C@@H]1C ZINC000294953364 385925587 /nfs/dbraw/zinc/92/55/87/385925587.db2.gz QFQMHXFWQZMAAV-NSHDSACASA-N 1 2 231.299 2.361 20 0 BEADLO c1ccc2c(C[N@@H+]3CCO[C@@H]4C[C@@H]43)ccnc2c1 ZINC000644839182 385860240 /nfs/dbraw/zinc/86/02/40/385860240.db2.gz WPNLCLAXPAEZTL-LSDHHAIUSA-N 1 2 240.306 2.208 20 0 BEADLO c1ccc2c(C[N@H+]3CCO[C@@H]4C[C@@H]43)ccnc2c1 ZINC000644839182 385860243 /nfs/dbraw/zinc/86/02/43/385860243.db2.gz WPNLCLAXPAEZTL-LSDHHAIUSA-N 1 2 240.306 2.208 20 0 BEADLO C[C@H](C[NH+]1CCOCC1)c1cc(F)cc(F)c1 ZINC000294556122 385867037 /nfs/dbraw/zinc/86/70/37/385867037.db2.gz LNRDWYYXZFBCGO-SNVBAGLBSA-N 1 2 241.281 2.401 20 0 BEADLO CCC[C@@H](OC)C(=O)Nc1cc[nH+]cc1C ZINC000294583996 385871364 /nfs/dbraw/zinc/87/13/64/385871364.db2.gz KZLFFYPQUSSQAZ-LLVKDONJSA-N 1 2 222.288 2.144 20 0 BEADLO CCC[C@H]1CCC[C@H]1C(=O)NCc1[nH]cc[nH+]1 ZINC000294617533 385875971 /nfs/dbraw/zinc/87/59/71/385875971.db2.gz NJPRFAXWDOXQEF-WDEREUQCSA-N 1 2 235.331 2.242 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ccncc1F)c1cnccn1 ZINC000338006945 385877228 /nfs/dbraw/zinc/87/72/28/385877228.db2.gz DSGJMVVHSVJPNA-UWVGGRQHSA-N 1 2 246.289 2.423 20 0 BEADLO CN(CC1CCCCC1)C(=O)CCn1cc[nH+]c1 ZINC000338040862 385882342 /nfs/dbraw/zinc/88/23/42/385882342.db2.gz STEHKPSQCIIQKD-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO CC(C)C[C@@H](C)OC(=O)NCc1[nH+]ccn1C ZINC000295212131 385989840 /nfs/dbraw/zinc/98/98/40/385989840.db2.gz UTFGBMGLBGJNME-SNVBAGLBSA-N 1 2 239.319 2.081 20 0 BEADLO CCOc1ncc(C)cc1NCc1[nH+]ccn1C ZINC000295202901 385990520 /nfs/dbraw/zinc/99/05/20/385990520.db2.gz YZHUEHFFAYSNJX-UHFFFAOYSA-N 1 2 246.314 2.134 20 0 BEADLO Cc1nc(N(C)[C@@H]2CCCOC2)c(C)c(C)[nH+]1 ZINC000343265213 385930503 /nfs/dbraw/zinc/93/05/03/385930503.db2.gz NFOWWDAHSNWAPY-GFCCVEGCSA-N 1 2 235.331 2.017 20 0 BEADLO C[C@@H](CCC1CC1)Nc1[nH+]cnc2c1cnn2C ZINC000337888339 385993051 /nfs/dbraw/zinc/99/30/51/385993051.db2.gz ZLKZJCZTNQWKKB-VIFPVBQESA-N 1 2 245.330 2.354 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ccco1)c1ccn(C)n1 ZINC000414063774 385938905 /nfs/dbraw/zinc/93/89/05/385938905.db2.gz MUQVEJAHXPIZDM-NXEZZACHSA-N 1 2 219.288 2.425 20 0 BEADLO C[C@H](CCCO)CNc1cc[nH+]c2ccncc12 ZINC000295016841 385944651 /nfs/dbraw/zinc/94/46/51/385944651.db2.gz UAZPTOJJXVHMET-LLVKDONJSA-N 1 2 245.326 2.450 20 0 BEADLO CO[C@H](C)CCC(=O)Nc1cccc2[nH+]ccn21 ZINC000272885925 385944863 /nfs/dbraw/zinc/94/48/63/385944863.db2.gz IHZFGQGDXZUURH-SNVBAGLBSA-N 1 2 247.298 2.088 20 0 BEADLO CC[C@H](O)CCNc1nc(C)[nH+]c2c1CCCC2 ZINC000272890312 385948039 /nfs/dbraw/zinc/94/80/39/385948039.db2.gz NSMYEAXPAYPMPT-NSHDSACASA-N 1 2 249.358 2.237 20 0 BEADLO C[C@H]1COCC[C@H]1[NH2+]c1ccc2c(c1)CCN2 ZINC000335051667 385948259 /nfs/dbraw/zinc/94/82/59/385948259.db2.gz CDOXZVLVWJLHSI-GXFFZTMASA-N 1 2 232.327 2.492 20 0 BEADLO C[C@H]1COCC[C@H]1Nc1ccc2c(c1)CC[NH2+]2 ZINC000335051667 385948260 /nfs/dbraw/zinc/94/82/60/385948260.db2.gz CDOXZVLVWJLHSI-GXFFZTMASA-N 1 2 232.327 2.492 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@]1(C)CCCOC1 ZINC000272920128 385948760 /nfs/dbraw/zinc/94/87/60/385948760.db2.gz GOKIEHPOYGBNRV-CYBMUJFWSA-N 1 2 234.299 2.145 20 0 BEADLO COC(=O)C(C)(C)[NH2+]CCCc1ccsc1 ZINC000336768629 385952180 /nfs/dbraw/zinc/95/21/80/385952180.db2.gz RCTVQWKHYBOPRV-UHFFFAOYSA-N 1 2 241.356 2.222 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCCC[C@H]1c1nnc(C)[nH]1 ZINC000338332702 385964698 /nfs/dbraw/zinc/96/46/98/385964698.db2.gz MHMAYPNWUBEKGX-MNOVXSKESA-N 1 2 240.326 2.388 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCCC[C@H]1c1nnc(C)[nH]1 ZINC000338332702 385964700 /nfs/dbraw/zinc/96/47/00/385964700.db2.gz MHMAYPNWUBEKGX-MNOVXSKESA-N 1 2 240.326 2.388 20 0 BEADLO COC1(C(=O)Nc2ccc(C)[nH+]c2C)CCC1 ZINC000273075099 385966001 /nfs/dbraw/zinc/96/60/01/385966001.db2.gz GHJNLWPXCCNVIS-UHFFFAOYSA-N 1 2 234.299 2.206 20 0 BEADLO Cc1cc(CNC(=O)N2[C@H](C)C[C@H]2C)cc(C)[nH+]1 ZINC000335015131 385971145 /nfs/dbraw/zinc/97/11/45/385971145.db2.gz UJJNABJBRVTOAY-VXGBXAGGSA-N 1 2 247.342 2.391 20 0 BEADLO CC[C@H]1CCC[C@@H]1CNC(=O)Cc1[nH]c[nH+]c1C ZINC000452992922 385998341 /nfs/dbraw/zinc/99/83/41/385998341.db2.gz CWHJCSZPMNASSP-NWDGAFQWSA-N 1 2 249.358 2.203 20 0 BEADLO CC[C@H]1CCC[C@@H]1CNC(=O)Cc1[nH+]c[nH]c1C ZINC000452992922 385998343 /nfs/dbraw/zinc/99/83/43/385998343.db2.gz CWHJCSZPMNASSP-NWDGAFQWSA-N 1 2 249.358 2.203 20 0 BEADLO CC[C@H]([NH2+][C@H]1CCO[C@@H](C)C1)C(F)(F)F ZINC000336750209 386001168 /nfs/dbraw/zinc/00/11/68/386001168.db2.gz DSRLRBVTOFGTCE-CIUDSAMLSA-N 1 2 225.254 2.484 20 0 BEADLO C[NH2+]Cc1noc([C@H]2C[C@]2(F)c2ccccc2)n1 ZINC000414645982 386055806 /nfs/dbraw/zinc/05/58/06/386055806.db2.gz RETBPNNXAWLGIZ-MFKMUULPSA-N 1 2 247.273 2.141 20 0 BEADLO Cc1[nH]ccc1C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000335067321 386010296 /nfs/dbraw/zinc/01/02/96/386010296.db2.gz IIDSFYDVHZKHPS-UHFFFAOYSA-N 1 2 243.310 2.265 20 0 BEADLO CCOC(=O)C[NH2+][C@H]1CCCC[C@@H]1SCC ZINC000189494828 386014403 /nfs/dbraw/zinc/01/44/03/386014403.db2.gz PCPCTRVVVGDUME-QWRGUYRKSA-N 1 2 245.388 2.203 20 0 BEADLO Cc1noc([C@@H](C)[NH2+]C/C=C\c2ccncc2)n1 ZINC000425997473 386016907 /nfs/dbraw/zinc/01/69/07/386016907.db2.gz BWUXLYBSPJKSDD-UMBAGQNISA-N 1 2 244.298 2.137 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2cc[nH]n2)on1 ZINC000286319995 386022288 /nfs/dbraw/zinc/02/22/88/386022288.db2.gz WNYFWPUXBXHPRE-GFCCVEGCSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2cc[nH]n2)on1 ZINC000286319995 386022294 /nfs/dbraw/zinc/02/22/94/386022294.db2.gz WNYFWPUXBXHPRE-GFCCVEGCSA-N 1 2 232.287 2.043 20 0 BEADLO CC[C@@H]1CCC[C@@]2(C1)NC(=O)C[N@@H+]2CC(C)C ZINC000414178823 386023059 /nfs/dbraw/zinc/02/30/59/386023059.db2.gz KHTWKASGGYZSOH-TZMCWYRMSA-N 1 2 238.375 2.371 20 0 BEADLO CC[C@@H]1CCC[C@@]2(C1)NC(=O)C[N@H+]2CC(C)C ZINC000414178823 386023068 /nfs/dbraw/zinc/02/30/68/386023068.db2.gz KHTWKASGGYZSOH-TZMCWYRMSA-N 1 2 238.375 2.371 20 0 BEADLO CCC[N@@H+]1CC(=O)NC12CCC(C)(C)CC2 ZINC000414190991 386029665 /nfs/dbraw/zinc/02/96/65/386029665.db2.gz UGSJTGGCYJOCJC-UHFFFAOYSA-N 1 2 224.348 2.125 20 0 BEADLO CCC[N@H+]1CC(=O)NC12CCC(C)(C)CC2 ZINC000414190991 386029671 /nfs/dbraw/zinc/02/96/71/386029671.db2.gz UGSJTGGCYJOCJC-UHFFFAOYSA-N 1 2 224.348 2.125 20 0 BEADLO CC(=O)c1cccc(C[N@H+](C2CC2)C2COC2)c1 ZINC000295422204 386030482 /nfs/dbraw/zinc/03/04/82/386030482.db2.gz NKZNBIGKGSHKJI-UHFFFAOYSA-N 1 2 245.322 2.252 20 0 BEADLO CC(=O)c1cccc(C[N@@H+](C2CC2)C2COC2)c1 ZINC000295422204 386030488 /nfs/dbraw/zinc/03/04/88/386030488.db2.gz NKZNBIGKGSHKJI-UHFFFAOYSA-N 1 2 245.322 2.252 20 0 BEADLO Cc1nc(F)ccc1C[N@@H+](C(C)C)C1COC1 ZINC000295600809 386056891 /nfs/dbraw/zinc/05/68/91/386056891.db2.gz CXSJMMQLRIBHNC-UHFFFAOYSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1nc(F)ccc1C[N@H+](C(C)C)C1COC1 ZINC000295600809 386056892 /nfs/dbraw/zinc/05/68/92/386056892.db2.gz CXSJMMQLRIBHNC-UHFFFAOYSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1ccc(Cc2nc([C@@H]3CCCO3)no2)c[nH+]1 ZINC000273765938 386032758 /nfs/dbraw/zinc/03/27/58/386032758.db2.gz BEFOQXXSBAQMLX-NSHDSACASA-N 1 2 245.282 2.215 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2C[C@@]2(F)c2ccccc2)n1 ZINC000414645981 386057058 /nfs/dbraw/zinc/05/70/58/386057058.db2.gz RETBPNNXAWLGIZ-GXFFZTMASA-N 1 2 247.273 2.141 20 0 BEADLO CC[C@@H](C)[C@@H](C)C(=O)NCc1[nH+]ccn1CC ZINC000295544881 386049477 /nfs/dbraw/zinc/04/94/77/386049477.db2.gz DAMSRFGHVNUIFK-GHMZBOCLSA-N 1 2 237.347 2.201 20 0 BEADLO COC(=O)[C@H](C)[N@@H+]1Cc2ccccc2C(C)(C)C1 ZINC000340234603 386057723 /nfs/dbraw/zinc/05/77/23/386057723.db2.gz ASBWOKCQYKITMB-NSHDSACASA-N 1 2 247.338 2.341 20 0 BEADLO COC(=O)[C@H](C)[N@H+]1Cc2ccccc2C(C)(C)C1 ZINC000340234603 386057729 /nfs/dbraw/zinc/05/77/29/386057729.db2.gz ASBWOKCQYKITMB-NSHDSACASA-N 1 2 247.338 2.341 20 0 BEADLO CCC1(NC(=O)C=Cc2c[nH]c[nH+]2)CCCC1 ZINC000295900338 386104106 /nfs/dbraw/zinc/10/41/06/386104106.db2.gz GOAJLDOACOBEEC-AATRIKPKSA-N 1 2 233.315 2.262 20 0 BEADLO Cc1cc(CNc2c[nH+]ccc2C)nn1C ZINC000414299646 386106208 /nfs/dbraw/zinc/10/62/08/386106208.db2.gz AFNRWTNFQUGEBQ-UHFFFAOYSA-N 1 2 216.288 2.044 20 0 BEADLO CC(C)CCCNc1[nH+]cnc2c1cnn2C ZINC000037984154 386107202 /nfs/dbraw/zinc/10/72/02/386107202.db2.gz PFUUGOWIPISBEI-UHFFFAOYSA-N 1 2 233.319 2.211 20 0 BEADLO CCc1ccc(/C=C/c2nc(C[NH2+]C)no2)o1 ZINC000414649049 386059875 /nfs/dbraw/zinc/05/98/75/386059875.db2.gz WDSVMZWHLHNDQP-VOTSOKGWSA-N 1 2 233.271 2.115 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@@]12CCC(C)(C)C2 ZINC000414211000 386064597 /nfs/dbraw/zinc/06/45/97/386064597.db2.gz VAKNHAKSYHDVJC-ZDUSSCGKSA-N 1 2 224.348 2.123 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)N(C)Cc1[nH+]ccn1C ZINC000274592963 386122116 /nfs/dbraw/zinc/12/21/16/386122116.db2.gz KFSXQKQWZIMCNB-PKNBQFBNSA-N 1 2 249.358 2.371 20 0 BEADLO CC(C)c1nnc(C[N@@H+]2CCC(C)(C)C2)[nH]1 ZINC000334449789 386086552 /nfs/dbraw/zinc/08/65/52/386086552.db2.gz QPZQNLUKJBHGPX-UHFFFAOYSA-N 1 2 222.336 2.160 20 0 BEADLO CC(C)c1nnc(C[N@H+]2CCC(C)(C)C2)[nH]1 ZINC000334449789 386086556 /nfs/dbraw/zinc/08/65/56/386086556.db2.gz QPZQNLUKJBHGPX-UHFFFAOYSA-N 1 2 222.336 2.160 20 0 BEADLO Cc1nc(NCC2CCC(F)CC2)cc[nH+]1 ZINC000645390099 386087119 /nfs/dbraw/zinc/08/71/19/386087119.db2.gz KTXGEUBZXNYHQE-UHFFFAOYSA-N 1 2 223.295 2.147 20 0 BEADLO C[N@H+](Cc1sccc1Cl)C(C)(C)C(N)=O ZINC000295808056 386087975 /nfs/dbraw/zinc/08/79/75/386087975.db2.gz WPVJOGWBTJWURU-UHFFFAOYSA-N 1 2 246.763 2.097 20 0 BEADLO C[N@@H+](Cc1sccc1Cl)C(C)(C)C(N)=O ZINC000295808056 386087979 /nfs/dbraw/zinc/08/79/79/386087979.db2.gz WPVJOGWBTJWURU-UHFFFAOYSA-N 1 2 246.763 2.097 20 0 BEADLO Cc1nc(C[N@H+](C)CCc2ccccc2C)no1 ZINC000295807986 386088019 /nfs/dbraw/zinc/08/80/19/386088019.db2.gz WOSBLFMVEDDLMJ-UHFFFAOYSA-N 1 2 245.326 2.361 20 0 BEADLO Cc1nc(C[N@@H+](C)CCc2ccccc2C)no1 ZINC000295807986 386088022 /nfs/dbraw/zinc/08/80/22/386088022.db2.gz WOSBLFMVEDDLMJ-UHFFFAOYSA-N 1 2 245.326 2.361 20 0 BEADLO CCC[C@@H](OC)C(=O)Nc1cc[nH+]cc1CC ZINC000295856157 386095530 /nfs/dbraw/zinc/09/55/30/386095530.db2.gz OBRIORAKBQLXHA-GFCCVEGCSA-N 1 2 236.315 2.398 20 0 BEADLO C[N@H+](Cc1ccco1)Cc1cncc(F)c1 ZINC000274399553 386099706 /nfs/dbraw/zinc/09/97/06/386099706.db2.gz XNNUFOWUYGXUNB-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO C[N@@H+](Cc1ccco1)Cc1cncc(F)c1 ZINC000274399553 386099709 /nfs/dbraw/zinc/09/97/09/386099709.db2.gz XNNUFOWUYGXUNB-UHFFFAOYSA-N 1 2 220.247 2.446 20 0 BEADLO Cc1sccc1C[N@H+](C1CC1)C1COC1 ZINC000296179783 386145203 /nfs/dbraw/zinc/14/52/03/386145203.db2.gz XSIOQDWFQPSSBB-UHFFFAOYSA-N 1 2 223.341 2.420 20 0 BEADLO Cc1sccc1C[N@@H+](C1CC1)C1COC1 ZINC000296179783 386145209 /nfs/dbraw/zinc/14/52/09/386145209.db2.gz XSIOQDWFQPSSBB-UHFFFAOYSA-N 1 2 223.341 2.420 20 0 BEADLO CC(=O)c1cccc(C[N@@H+]2CCO[C@H](C)C2)c1 ZINC000296184292 386146499 /nfs/dbraw/zinc/14/64/99/386146499.db2.gz BDDLLTMQQDUQQY-LLVKDONJSA-N 1 2 233.311 2.110 20 0 BEADLO CC(=O)c1cccc(C[N@H+]2CCO[C@H](C)C2)c1 ZINC000296184292 386146503 /nfs/dbraw/zinc/14/65/03/386146503.db2.gz BDDLLTMQQDUQQY-LLVKDONJSA-N 1 2 233.311 2.110 20 0 BEADLO CC(C)C[C@H](CO)N(C)c1[nH]c2ccccc2[nH+]1 ZINC000274748614 386147503 /nfs/dbraw/zinc/14/75/03/386147503.db2.gz OWYXDNMOVGRGHA-LLVKDONJSA-N 1 2 247.342 2.406 20 0 BEADLO CC(=O)c1ccc(C[N@@H+]2CCO[C@H](C)C2)cc1 ZINC000296229583 386150695 /nfs/dbraw/zinc/15/06/95/386150695.db2.gz DUJZROJEKZHOLW-LLVKDONJSA-N 1 2 233.311 2.110 20 0 BEADLO CC(=O)c1ccc(C[N@H+]2CCO[C@H](C)C2)cc1 ZINC000296229583 386150699 /nfs/dbraw/zinc/15/06/99/386150699.db2.gz DUJZROJEKZHOLW-LLVKDONJSA-N 1 2 233.311 2.110 20 0 BEADLO CC(=O)c1ccc(C[N@@H+]2CCO[C@@H](C)C2)cc1 ZINC000296229590 386151024 /nfs/dbraw/zinc/15/10/24/386151024.db2.gz DUJZROJEKZHOLW-NSHDSACASA-N 1 2 233.311 2.110 20 0 BEADLO CC(=O)c1ccc(C[N@H+]2CCO[C@@H](C)C2)cc1 ZINC000296229590 386151028 /nfs/dbraw/zinc/15/10/28/386151028.db2.gz DUJZROJEKZHOLW-NSHDSACASA-N 1 2 233.311 2.110 20 0 BEADLO CC[C@@H]1CCC[C@@H](Nc2nc(C)[nH+]c(N)n2)C1 ZINC000310214254 386165002 /nfs/dbraw/zinc/16/50/02/386165002.db2.gz FMRPRCKCABCLEO-NXEZZACHSA-N 1 2 235.335 2.143 20 0 BEADLO CC[C@@H]1CCC[C@@H](Nc2nc(N)nc(C)[nH+]2)C1 ZINC000310214254 386165008 /nfs/dbraw/zinc/16/50/08/386165008.db2.gz FMRPRCKCABCLEO-NXEZZACHSA-N 1 2 235.335 2.143 20 0 BEADLO Cc1cscc1NC(=O)CCc1[nH]cc[nH+]1 ZINC000288091174 386165504 /nfs/dbraw/zinc/16/55/04/386165504.db2.gz HZIVJLWFAXXIJM-UHFFFAOYSA-N 1 2 235.312 2.351 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@@H](C)OC[C@@H]2CC)cn1 ZINC000414372619 386175925 /nfs/dbraw/zinc/17/59/25/386175925.db2.gz PXTCMZBAWFEZRD-YPMHNXCESA-N 1 2 249.358 2.038 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@@H](C)OC[C@@H]2CC)cn1 ZINC000414372619 386175928 /nfs/dbraw/zinc/17/59/28/386175928.db2.gz PXTCMZBAWFEZRD-YPMHNXCESA-N 1 2 249.358 2.038 20 0 BEADLO CC/C=C/C[NH2+][C@@H](c1ncc[nH]1)c1cccnc1 ZINC000296508105 386178978 /nfs/dbraw/zinc/17/89/78/386178978.db2.gz PIWLHQODTZBDEU-ITDFMYJTSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C[C@@H]1C=CCCC1 ZINC000275206411 386191076 /nfs/dbraw/zinc/19/10/76/386191076.db2.gz ZGAUKJWJEKUKQT-LLVKDONJSA-N 1 2 233.315 2.081 20 0 BEADLO Cc1ccoc1CN(C)c1cc(CO)cc[nH+]1 ZINC000310443402 386181779 /nfs/dbraw/zinc/18/17/79/386181779.db2.gz TUPJOKYKOITJRL-UHFFFAOYSA-N 1 2 232.283 2.112 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)C[C@@H]1C=CCCC1 ZINC000275169347 386187025 /nfs/dbraw/zinc/18/70/25/386187025.db2.gz UFDTXCDTFAOIKE-CHWSQXEVSA-N 1 2 247.342 2.134 20 0 BEADLO COCCCCC[N@@H+]1CCC(F)(F)C1 ZINC000345809104 386131610 /nfs/dbraw/zinc/13/16/10/386131610.db2.gz RZEVBGKXWJJZRZ-UHFFFAOYSA-N 1 2 207.264 2.144 20 0 BEADLO COCCCCC[N@H+]1CCC(F)(F)C1 ZINC000345809104 386131614 /nfs/dbraw/zinc/13/16/14/386131614.db2.gz RZEVBGKXWJJZRZ-UHFFFAOYSA-N 1 2 207.264 2.144 20 0 BEADLO C[C@H](F)CC[NH+]=c1[nH]c2ccc(F)cc2n1C ZINC000338759521 386133016 /nfs/dbraw/zinc/13/30/16/386133016.db2.gz ZBGSLKAEMRNDQR-QMMMGPOBSA-N 1 2 239.269 2.294 20 0 BEADLO CC(C)(C(=O)Nc1ccccc1)c1c[nH+]c[nH]1 ZINC000335215142 386134168 /nfs/dbraw/zinc/13/41/68/386134168.db2.gz CUWHMZDBKRDNAP-UHFFFAOYSA-N 1 2 229.283 2.326 20 0 BEADLO CC(C)(C(=O)Nc1ccccc1)c1c[nH]c[nH+]1 ZINC000335215142 386134173 /nfs/dbraw/zinc/13/41/73/386134173.db2.gz CUWHMZDBKRDNAP-UHFFFAOYSA-N 1 2 229.283 2.326 20 0 BEADLO COC(=O)C1([NH2+]C/C=C/Cl)CCCCC1 ZINC000118004984 386141794 /nfs/dbraw/zinc/14/17/94/386141794.db2.gz VFWGWCMXFFVMFP-VMPITWQZSA-N 1 2 231.723 2.204 20 0 BEADLO Fc1cc(F)cc(C[N@H+](C2CC2)C2COC2)c1 ZINC000296156487 386143600 /nfs/dbraw/zinc/14/36/00/386143600.db2.gz WGKMFXMFSQGVKC-UHFFFAOYSA-N 1 2 239.265 2.328 20 0 BEADLO Fc1cc(F)cc(C[N@@H+](C2CC2)C2COC2)c1 ZINC000296156487 386143604 /nfs/dbraw/zinc/14/36/04/386143604.db2.gz WGKMFXMFSQGVKC-UHFFFAOYSA-N 1 2 239.265 2.328 20 0 BEADLO CCC1(C)CN(C(=O)[C@@H]2CCCc3[nH+]c[nH]c32)C1 ZINC000335237526 386200935 /nfs/dbraw/zinc/20/09/35/386200935.db2.gz GVXIJEVRHPUXCD-SNVBAGLBSA-N 1 2 247.342 2.088 20 0 BEADLO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1ncc[nH]1 ZINC000288470332 386203869 /nfs/dbraw/zinc/20/38/69/386203869.db2.gz FRYXJBYILFTCNU-TVQRCGJNSA-N 1 2 229.283 2.022 20 0 BEADLO CCc1ccc(C[N@H+](C)Cc2cnccn2)nc1 ZINC000339014721 386213018 /nfs/dbraw/zinc/21/30/18/386213018.db2.gz UVYMUNXSVXXLQC-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO CCc1ccc(C[N@@H+](C)Cc2cnccn2)nc1 ZINC000339014721 386213024 /nfs/dbraw/zinc/21/30/24/386213024.db2.gz UVYMUNXSVXXLQC-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO CCCC(=O)NCCCCNc1cccc[nH+]1 ZINC000264200583 386215098 /nfs/dbraw/zinc/21/50/98/386215098.db2.gz STZGOJNPFCXZET-UHFFFAOYSA-N 1 2 235.331 2.190 20 0 BEADLO CC(C)n1ccnc1C[NH+]1CCSCC1 ZINC000264245613 386220074 /nfs/dbraw/zinc/22/00/74/386220074.db2.gz WDEZCLKXXQUCKM-UHFFFAOYSA-N 1 2 225.361 2.013 20 0 BEADLO CC[C@@H](C)C[C@H](C)NC(=O)CCc1[nH]cc[nH+]1 ZINC000288621607 386223264 /nfs/dbraw/zinc/22/32/64/386223264.db2.gz DKUXMVVDRRJYMJ-MNOVXSKESA-N 1 2 237.347 2.283 20 0 BEADLO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1nccn1C ZINC000288625745 386223548 /nfs/dbraw/zinc/22/35/48/386223548.db2.gz SEJQCGMLZCYDGI-YGRLFVJLSA-N 1 2 243.310 2.032 20 0 BEADLO Cc1noc(C[N@@H+]2CCCc3ccccc3C2)n1 ZINC000264438115 386236415 /nfs/dbraw/zinc/23/64/15/386236415.db2.gz QBOCDJXYSAJLLT-UHFFFAOYSA-N 1 2 243.310 2.326 20 0 BEADLO Cc1noc(C[N@H+]2CCCc3ccccc3C2)n1 ZINC000264438115 386236417 /nfs/dbraw/zinc/23/64/17/386236417.db2.gz QBOCDJXYSAJLLT-UHFFFAOYSA-N 1 2 243.310 2.326 20 0 BEADLO CC[N@H+](Cc1ccccn1)Cc1ccc(C)nn1 ZINC000414385211 386239202 /nfs/dbraw/zinc/23/92/02/386239202.db2.gz DYJAKLBOHZDHNP-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO CC[N@@H+](Cc1ccccn1)Cc1ccc(C)nn1 ZINC000414385211 386239206 /nfs/dbraw/zinc/23/92/06/386239206.db2.gz DYJAKLBOHZDHNP-UHFFFAOYSA-N 1 2 242.326 2.202 20 0 BEADLO Cn1cc(Cl)c(C[N@@H+]2CCCC3(CC3)C2)n1 ZINC000335394510 386240902 /nfs/dbraw/zinc/24/09/02/386240902.db2.gz GWAJLTKHGNCLSU-UHFFFAOYSA-N 1 2 239.750 2.450 20 0 BEADLO Cn1cc(Cl)c(C[N@H+]2CCCC3(CC3)C2)n1 ZINC000335394510 386240908 /nfs/dbraw/zinc/24/09/08/386240908.db2.gz GWAJLTKHGNCLSU-UHFFFAOYSA-N 1 2 239.750 2.450 20 0 BEADLO Cc1nc(C[N@H+](C)Cc2ccc[nH]2)cs1 ZINC000336643962 386242485 /nfs/dbraw/zinc/24/24/85/386242485.db2.gz FDLAXNSETGTHDT-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1nc(C[N@@H+](C)Cc2ccc[nH]2)cs1 ZINC000336643962 386242489 /nfs/dbraw/zinc/24/24/89/386242489.db2.gz FDLAXNSETGTHDT-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1ccc(NC(=O)N[C@H](C)CF)c(C)[nH+]1 ZINC000288967732 386247043 /nfs/dbraw/zinc/24/70/43/386247043.db2.gz CJULZSXFMAFVAN-MRVPVSSYSA-N 1 2 225.267 2.178 20 0 BEADLO CCCC[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000275901409 386249614 /nfs/dbraw/zinc/24/96/14/386249614.db2.gz VDSWNHQCNDLOKP-GFCCVEGCSA-N 1 2 230.315 2.284 20 0 BEADLO Cc1cn2cc(NC(=O)N3CCCC3)ccc2[nH+]1 ZINC000264601029 386251341 /nfs/dbraw/zinc/25/13/41/386251341.db2.gz BQCHCCSMNNLETK-UHFFFAOYSA-N 1 2 244.298 2.270 20 0 BEADLO c1csc(C[N@H+](C2CC2)C2COC2)c1 ZINC000289021476 386251448 /nfs/dbraw/zinc/25/14/48/386251448.db2.gz AJBMJMPUFIRJSQ-UHFFFAOYSA-N 1 2 209.314 2.111 20 0 BEADLO c1csc(C[N@@H+](C2CC2)C2COC2)c1 ZINC000289021476 386251452 /nfs/dbraw/zinc/25/14/52/386251452.db2.gz AJBMJMPUFIRJSQ-UHFFFAOYSA-N 1 2 209.314 2.111 20 0 BEADLO CC[C@H](NC(=O)Cc1[nH]c[nH+]c1C)[C@H]1CC1(C)C ZINC000416279624 386255987 /nfs/dbraw/zinc/25/59/87/386255987.db2.gz URMHCOLBUNGUTA-MNOVXSKESA-N 1 2 249.358 2.202 20 0 BEADLO CC[C@H](NC(=O)Cc1[nH+]c[nH]c1C)[C@H]1CC1(C)C ZINC000416279624 386255993 /nfs/dbraw/zinc/25/59/93/386255993.db2.gz URMHCOLBUNGUTA-MNOVXSKESA-N 1 2 249.358 2.202 20 0 BEADLO CC[C@@H](NC(=O)c1c[nH+]c(C)[nH]1)[C@H]1CC1(C)C ZINC000416280767 386256589 /nfs/dbraw/zinc/25/65/89/386256589.db2.gz ZJWOVAVVIKKYIG-NXEZZACHSA-N 1 2 235.331 2.273 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccoc2)on1 ZINC000336648182 386257107 /nfs/dbraw/zinc/25/71/07/386257107.db2.gz NSMJTJIFKGBKND-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccoc2)on1 ZINC000336648182 386257110 /nfs/dbraw/zinc/25/71/10/386257110.db2.gz NSMJTJIFKGBKND-UHFFFAOYSA-N 1 2 206.245 2.208 20 0 BEADLO COCc1cc(C[NH+]2CCC(CF)CC2)no1 ZINC000297458195 386257216 /nfs/dbraw/zinc/25/72/16/386257216.db2.gz PUTGNSMABHGJBB-UHFFFAOYSA-N 1 2 242.294 2.003 20 0 BEADLO C[C@@H]1[C@H](C)CN(C(=O)C(C)(C)c2c[nH+]c[nH]2)[C@H]1C ZINC000416325339 386258996 /nfs/dbraw/zinc/25/89/96/386258996.db2.gz SNAXPRCHLSLOJR-MXWKQRLJSA-N 1 2 249.358 2.190 20 0 BEADLO Cc1cn2cc(NC(=O)NCC3CC3)ccc2[nH+]1 ZINC000263922563 386193603 /nfs/dbraw/zinc/19/36/03/386193603.db2.gz SVHMEWUFXWZIEU-UHFFFAOYSA-N 1 2 244.298 2.174 20 0 BEADLO COc1ncncc1C[N@H+](C)[C@H](C)c1ccco1 ZINC000648001276 386199399 /nfs/dbraw/zinc/19/93/99/386199399.db2.gz FLNKFELZYVPEAF-SNVBAGLBSA-N 1 2 247.298 2.271 20 0 BEADLO COc1ncncc1C[N@@H+](C)[C@H](C)c1ccco1 ZINC000648001276 386199403 /nfs/dbraw/zinc/19/94/03/386199403.db2.gz FLNKFELZYVPEAF-SNVBAGLBSA-N 1 2 247.298 2.271 20 0 BEADLO CCC(=O)N1CC[N@H+](Cc2ccccc2CC)C1 ZINC000425513436 386288065 /nfs/dbraw/zinc/28/80/65/386288065.db2.gz OVRYVZXXYLEBHF-UHFFFAOYSA-N 1 2 246.354 2.261 20 0 BEADLO CCC(=O)N1CC[N@@H+](Cc2ccccc2CC)C1 ZINC000425513436 386288069 /nfs/dbraw/zinc/28/80/69/386288069.db2.gz OVRYVZXXYLEBHF-UHFFFAOYSA-N 1 2 246.354 2.261 20 0 BEADLO Cc1[nH]c(C(=O)NCC2(C)CCCC2)c[nH+]1 ZINC000264954379 386289435 /nfs/dbraw/zinc/28/94/35/386289435.db2.gz VDFLROGSDWDLIU-UHFFFAOYSA-N 1 2 221.304 2.028 20 0 BEADLO c1nnsc1C[N@@H+]1CCc2ccccc2C1 ZINC000289355352 386290991 /nfs/dbraw/zinc/29/09/91/386290991.db2.gz NKEMEMLMGISDAT-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO c1nnsc1C[N@H+]1CCc2ccccc2C1 ZINC000289355352 386290995 /nfs/dbraw/zinc/29/09/95/386290995.db2.gz NKEMEMLMGISDAT-UHFFFAOYSA-N 1 2 231.324 2.096 20 0 BEADLO CN(CCCn1cc[nH+]c1)C(=O)C1=CCCCC1 ZINC000276275582 386295147 /nfs/dbraw/zinc/29/51/47/386295147.db2.gz RIIMNXIXCUWDMT-UHFFFAOYSA-N 1 2 247.342 2.232 20 0 BEADLO CCC[C@H]1C[N@H+](Cc2ccc(F)cn2)CCO1 ZINC000276282741 386296052 /nfs/dbraw/zinc/29/60/52/386296052.db2.gz UKUJABLRQCMILR-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO CCC[C@H]1C[N@@H+](Cc2ccc(F)cn2)CCO1 ZINC000276282741 386296058 /nfs/dbraw/zinc/29/60/58/386296058.db2.gz UKUJABLRQCMILR-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO Cc1nonc1C[N@@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000265017900 386297308 /nfs/dbraw/zinc/29/73/08/386297308.db2.gz IKNDKBUOKQYOEA-LBPRGKRZSA-N 1 2 232.287 2.043 20 0 BEADLO Cc1nonc1C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000265017900 386297313 /nfs/dbraw/zinc/29/73/13/386297313.db2.gz IKNDKBUOKQYOEA-LBPRGKRZSA-N 1 2 232.287 2.043 20 0 BEADLO C/C(=C\c1ccccc1)C[NH2+][C@@]1(C)CCOC1=O ZINC000289412445 386300032 /nfs/dbraw/zinc/30/00/32/386300032.db2.gz AJTKCDHVELDQSX-PABFRNLHSA-N 1 2 245.322 2.385 20 0 BEADLO C[C@H](C(=O)Nc1ccc(N)[nH+]c1)C(C)(C)C ZINC000262553321 386307063 /nfs/dbraw/zinc/30/70/63/386307063.db2.gz URWGYUARFTYGSL-MRVPVSSYSA-N 1 2 221.304 2.285 20 0 BEADLO Cc1nonc1C[NH2+]C1(c2ccccc2)CC1 ZINC000265133260 386310093 /nfs/dbraw/zinc/31/00/93/386310093.db2.gz NUAKDIVQNZKHEO-UHFFFAOYSA-N 1 2 229.283 2.157 20 0 BEADLO CCOc1nnc(C[N@H+](C)CC(C)(C)C)s1 ZINC000336668786 386310302 /nfs/dbraw/zinc/31/03/02/386310302.db2.gz HGFNNMYQXUHVRY-UHFFFAOYSA-N 1 2 243.376 2.415 20 0 BEADLO CCOc1nnc(C[N@@H+](C)CC(C)(C)C)s1 ZINC000336668786 386310305 /nfs/dbraw/zinc/31/03/05/386310305.db2.gz HGFNNMYQXUHVRY-UHFFFAOYSA-N 1 2 243.376 2.415 20 0 BEADLO COC[C@H](C)SCc1c[nH+]ccc1OC ZINC000289485122 386312613 /nfs/dbraw/zinc/31/26/13/386312613.db2.gz XRXUYUYPWFDYGQ-VIFPVBQESA-N 1 2 227.329 2.358 20 0 BEADLO C[C@@H](C(=O)N(C)Cc1[nH+]ccn1C)C(C)(C)C ZINC000265164512 386313466 /nfs/dbraw/zinc/31/34/66/386313466.db2.gz BVMSFLHINZJRJU-JTQLQIEISA-N 1 2 237.347 2.061 20 0 BEADLO CO[C@H](C)[C@H](C)Nc1cc[nH+]c2ccncc12 ZINC000276383768 386313837 /nfs/dbraw/zinc/31/38/37/386313837.db2.gz ZIMPCGQLTXZSNW-VHSXEESVSA-N 1 2 231.299 2.465 20 0 BEADLO C[C@H](C(=O)N(C)Cc1[nH+]ccn1C)C(C)(C)C ZINC000265164515 386313964 /nfs/dbraw/zinc/31/39/64/386313964.db2.gz BVMSFLHINZJRJU-SNVBAGLBSA-N 1 2 237.347 2.061 20 0 BEADLO CC(C)c1nc(COc2cc[nH+]cc2)no1 ZINC000276399470 386316537 /nfs/dbraw/zinc/31/65/37/386316537.db2.gz DBLADONUBAYCOR-UHFFFAOYSA-N 1 2 219.244 2.167 20 0 BEADLO C/C=C(\CC)C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000276418460 386318914 /nfs/dbraw/zinc/31/89/14/386318914.db2.gz GTYRRTIDNDUYBP-QDEBKDIKSA-N 1 2 247.342 2.472 20 0 BEADLO CC[C@H]1CCCN(C(=O)CCn2cc[nH+]c2)CC1 ZINC000265269447 386323706 /nfs/dbraw/zinc/32/37/06/386323706.db2.gz GFHFHNWGGLUKOL-ZDUSSCGKSA-N 1 2 249.358 2.312 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H]2CCCC[C@@H]2C)c[nH+]1 ZINC000264740531 386267529 /nfs/dbraw/zinc/26/75/29/386267529.db2.gz RFXNRLYAVOBCHB-WPRPVWTQSA-N 1 2 221.304 2.027 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cncc(F)c2)[C@@H](C)[C@H](C)O1 ZINC000347181070 386271638 /nfs/dbraw/zinc/27/16/38/386271638.db2.gz JTVDTSWPNZCXTD-VWYCJHECSA-N 1 2 238.306 2.218 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cncc(F)c2)[C@@H](C)[C@H](C)O1 ZINC000347181070 386271640 /nfs/dbraw/zinc/27/16/40/386271640.db2.gz JTVDTSWPNZCXTD-VWYCJHECSA-N 1 2 238.306 2.218 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H](C)Cc2cccs2)c[nH+]1 ZINC000264856597 386274943 /nfs/dbraw/zinc/27/49/43/386274943.db2.gz OEVYJGMFGPMBLD-MRVPVSSYSA-N 1 2 249.339 2.141 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CCc3ccccc32)c[nH+]1 ZINC000264869946 386277632 /nfs/dbraw/zinc/27/76/32/386277632.db2.gz QZTDTSYMZDGDIH-GFCCVEGCSA-N 1 2 241.294 2.135 20 0 BEADLO CCC[C@H](C(=O)OCC)[N@@H+]1CC[C@](C)(F)C1 ZINC000347345741 386341853 /nfs/dbraw/zinc/34/18/53/386341853.db2.gz FEIGSWMNQXEMPC-PWSUYJOCSA-N 1 2 231.311 2.152 20 0 BEADLO CCC[C@H](C(=O)OCC)[N@H+]1CC[C@](C)(F)C1 ZINC000347345741 386341859 /nfs/dbraw/zinc/34/18/59/386341859.db2.gz FEIGSWMNQXEMPC-PWSUYJOCSA-N 1 2 231.311 2.152 20 0 BEADLO COC[C@@H]([NH2+]Cc1conc1C)c1ccco1 ZINC000339291818 386347699 /nfs/dbraw/zinc/34/76/99/386347699.db2.gz YRNHKNLDSXSGLR-LLVKDONJSA-N 1 2 236.271 2.053 20 0 BEADLO Cc1coc(SCc2c[nH+]cn2C)n1 ZINC000276580632 386349673 /nfs/dbraw/zinc/34/96/73/386349673.db2.gz NERYVMVSSZGKRR-UHFFFAOYSA-N 1 2 209.274 2.009 20 0 BEADLO CCc1ccc(CC[NH2+][C@@]2(C)CCOC2=O)cc1 ZINC000289766029 386352514 /nfs/dbraw/zinc/35/25/14/386352514.db2.gz ZNWNLRUIAQBEAB-HNNXBMFYSA-N 1 2 247.338 2.087 20 0 BEADLO Cc1cn[nH]c1C[NH2+]Cc1ccc(F)cc1F ZINC000289786305 386355569 /nfs/dbraw/zinc/35/55/69/386355569.db2.gz HNDSBCOYFLWBBU-UHFFFAOYSA-N 1 2 237.253 2.286 20 0 BEADLO Cc1c[nH]nc1C[NH2+]Cc1ccc(F)cc1F ZINC000289786305 386355572 /nfs/dbraw/zinc/35/55/72/386355572.db2.gz HNDSBCOYFLWBBU-UHFFFAOYSA-N 1 2 237.253 2.286 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1c(Cl)cnn1C ZINC000335271808 386360520 /nfs/dbraw/zinc/36/05/20/386360520.db2.gz CKBPIANEMWKOIT-YUMQZZPRSA-N 1 2 213.712 2.056 20 0 BEADLO C[C@H]([NH2+][C@@H](c1nnc[nH]1)c1ccccc1)C1CC1 ZINC000276702618 386364495 /nfs/dbraw/zinc/36/44/95/386364495.db2.gz BPJTYKBPZILBKZ-GXFFZTMASA-N 1 2 242.326 2.282 20 0 BEADLO C[C@@H](CNC(=O)CC1CCCC1)Cn1cc[nH+]c1 ZINC000265747763 386365771 /nfs/dbraw/zinc/36/57/71/386365771.db2.gz IGUMLUZIGNTUCM-LBPRGKRZSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1noc([C@@H]2CCC[N@H+]2Cc2ccn(C)c2)n1 ZINC000289875137 386367864 /nfs/dbraw/zinc/36/78/64/386367864.db2.gz RQPXQFIQMQKNEO-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1noc([C@@H]2CCC[N@@H+]2Cc2ccn(C)c2)n1 ZINC000289875137 386367869 /nfs/dbraw/zinc/36/78/69/386367869.db2.gz RQPXQFIQMQKNEO-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO CC[C@H]1CCC[C@@H](NC(=O)c2c[nH+]c(C)[nH]2)C1 ZINC000265960942 386387202 /nfs/dbraw/zinc/38/72/02/386387202.db2.gz XMCDCCDXWUPJCG-WDEREUQCSA-N 1 2 235.331 2.417 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)CCOCC(F)F ZINC000276768610 386373859 /nfs/dbraw/zinc/37/38/59/386373859.db2.gz BJCAUMFZHYYFLC-UHFFFAOYSA-N 1 2 244.241 2.000 20 0 BEADLO O=C1OCC[C@@H]1[N@@H+]1CCC[C@@H]1c1ccsc1 ZINC000298737205 386379158 /nfs/dbraw/zinc/37/91/58/386379158.db2.gz IWGOMGDTFNTYNL-MNOVXSKESA-N 1 2 237.324 2.201 20 0 BEADLO O=C1OCC[C@@H]1[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000298737205 386379165 /nfs/dbraw/zinc/37/91/65/386379165.db2.gz IWGOMGDTFNTYNL-MNOVXSKESA-N 1 2 237.324 2.201 20 0 BEADLO O=C(C1CC=CC1)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000265929918 386383941 /nfs/dbraw/zinc/38/39/41/386383941.db2.gz RSZQTOPJCSFXFH-UHFFFAOYSA-N 1 2 245.326 2.082 20 0 BEADLO COC(=O)[C@H]([NH2+]C[C@@H]1C[C@@H]1C)c1cccs1 ZINC000336775420 386384213 /nfs/dbraw/zinc/38/42/13/386384213.db2.gz YYZGNEDTNVXLSK-ATZCPNFKSA-N 1 2 239.340 2.208 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)CC1(C)CCCC1 ZINC000289542280 386327385 /nfs/dbraw/zinc/32/73/85/386327385.db2.gz FNJGNSSZECSQKC-UHFFFAOYSA-N 1 2 249.358 2.349 20 0 BEADLO CCC[C@H](O)CNc1cc(C)[nH+]c(C2CC2)n1 ZINC000265320356 386328044 /nfs/dbraw/zinc/32/80/44/386328044.db2.gz DUUSRADDZAPFMQ-NSHDSACASA-N 1 2 235.331 2.235 20 0 BEADLO CCN(CCOC)c1cc(C)[nH+]c(C2CC2)n1 ZINC000265373283 386329456 /nfs/dbraw/zinc/32/94/56/386329456.db2.gz PACRXJWZPKVCCW-UHFFFAOYSA-N 1 2 235.331 2.135 20 0 BEADLO COCC[C@H]([NH2+]Cc1[nH]ncc1C)c1ccco1 ZINC000289593794 386331385 /nfs/dbraw/zinc/33/13/85/386331385.db2.gz UIIBRHQIXOSDPK-NSHDSACASA-N 1 2 249.314 2.179 20 0 BEADLO COCC[C@H]([NH2+]Cc1n[nH]cc1C)c1ccco1 ZINC000289593794 386331389 /nfs/dbraw/zinc/33/13/89/386331389.db2.gz UIIBRHQIXOSDPK-NSHDSACASA-N 1 2 249.314 2.179 20 0 BEADLO CC(C)[C@H]1CC[N@H+](Cc2noc(C3CC3)n2)C1 ZINC000336683383 386331631 /nfs/dbraw/zinc/33/16/31/386331631.db2.gz DRZHQYYPAZPZQE-NSHDSACASA-N 1 2 235.331 2.425 20 0 BEADLO CC(C)[C@H]1CC[N@@H+](Cc2noc(C3CC3)n2)C1 ZINC000336683383 386331634 /nfs/dbraw/zinc/33/16/34/386331634.db2.gz DRZHQYYPAZPZQE-NSHDSACASA-N 1 2 235.331 2.425 20 0 BEADLO C/C=C(\CC)C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000276490447 386332997 /nfs/dbraw/zinc/33/29/97/386332997.db2.gz URMLVBDGJAZXLJ-JPOQUURFSA-N 1 2 247.342 2.472 20 0 BEADLO CC[C@@H](C)[C@@H](O)CNc1cc(C)[nH+]c(C2CC2)n1 ZINC000265389751 386333740 /nfs/dbraw/zinc/33/37/40/386333740.db2.gz UCLGFOPIBVQEJU-SKDRFNHKSA-N 1 2 249.358 2.481 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+][C@@H](C)c1cc[nH]c(=O)c1 ZINC000645485613 386439316 /nfs/dbraw/zinc/43/93/16/386439316.db2.gz JHPYSICEEGGEBC-DTWKUNHWSA-N 1 2 246.314 2.231 20 0 BEADLO C[C@H]1SCC[C@H]1Nc1cc[nH+]c2ccncc12 ZINC000645402923 386439961 /nfs/dbraw/zinc/43/99/61/386439961.db2.gz VFRGOICKBPOHFN-MWLCHTKSSA-N 1 2 245.351 2.358 20 0 BEADLO C[C@@H]1SCC[C@H]1Nc1cc[nH+]c2ccncc12 ZINC000645402919 386440570 /nfs/dbraw/zinc/44/05/70/386440570.db2.gz VFRGOICKBPOHFN-GXSJLCMTSA-N 1 2 245.351 2.358 20 0 BEADLO COC(=O)[C@@H](C)[NH2+]C[C@H](C)c1ccc(F)cc1 ZINC000266502816 386442536 /nfs/dbraw/zinc/44/25/36/386442536.db2.gz VVPNQQWOXPHYHZ-VHSXEESVSA-N 1 2 239.290 2.080 20 0 BEADLO CC[N@H+](CC(=O)OC)Cc1cc(C)sc1C ZINC000299340185 386443043 /nfs/dbraw/zinc/44/30/43/386443043.db2.gz NVQQIVYURZMDJK-UHFFFAOYSA-N 1 2 241.356 2.360 20 0 BEADLO CC[N@@H+](CC(=O)OC)Cc1cc(C)sc1C ZINC000299340185 386443054 /nfs/dbraw/zinc/44/30/54/386443054.db2.gz NVQQIVYURZMDJK-UHFFFAOYSA-N 1 2 241.356 2.360 20 0 BEADLO Cc1cccc(C[N@@H+](C)Cc2cnc(C)cn2)n1 ZINC000336716796 386448724 /nfs/dbraw/zinc/44/87/24/386448724.db2.gz SPTRDXQUKHHMDU-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO Cc1cccc(C[N@H+](C)Cc2cnc(C)cn2)n1 ZINC000336716796 386448726 /nfs/dbraw/zinc/44/87/26/386448726.db2.gz SPTRDXQUKHHMDU-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO CN(C)c1ccccc1C[N@H+](C)Cc1cc[nH]n1 ZINC000266546381 386449711 /nfs/dbraw/zinc/44/97/11/386449711.db2.gz RYHCZMYNZAAQGL-UHFFFAOYSA-N 1 2 244.342 2.108 20 0 BEADLO CN(C)c1ccccc1C[N@@H+](C)Cc1cc[nH]n1 ZINC000266546381 386449716 /nfs/dbraw/zinc/44/97/16/386449716.db2.gz RYHCZMYNZAAQGL-UHFFFAOYSA-N 1 2 244.342 2.108 20 0 BEADLO COC(=O)c1ccoc1C[N@@H+]1CC[C@](C)(F)C1 ZINC000347406628 386389910 /nfs/dbraw/zinc/38/99/10/386389910.db2.gz JZGHPFBFPUOTGV-LBPRGKRZSA-N 1 2 241.262 2.000 20 0 BEADLO COC(=O)c1ccoc1C[N@H+]1CC[C@](C)(F)C1 ZINC000347406628 386389915 /nfs/dbraw/zinc/38/99/15/386389915.db2.gz JZGHPFBFPUOTGV-LBPRGKRZSA-N 1 2 241.262 2.000 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1ccc(F)cc1C ZINC000276971680 386397475 /nfs/dbraw/zinc/39/74/75/386397475.db2.gz YFVSRYJGMXLTRM-SNVBAGLBSA-N 1 2 239.290 2.127 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(F)cc1C ZINC000276971680 386397482 /nfs/dbraw/zinc/39/74/82/386397482.db2.gz YFVSRYJGMXLTRM-SNVBAGLBSA-N 1 2 239.290 2.127 20 0 BEADLO Cn1cc(C[N@H+](Cc2cccs2)C2CC2)nn1 ZINC000336701666 386404690 /nfs/dbraw/zinc/40/46/90/386404690.db2.gz TWYNZPCEGJYMPN-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO Cn1cc(C[N@@H+](Cc2cccs2)C2CC2)nn1 ZINC000336701666 386404696 /nfs/dbraw/zinc/40/46/96/386404696.db2.gz TWYNZPCEGJYMPN-UHFFFAOYSA-N 1 2 248.355 2.041 20 0 BEADLO c1cc(N[C@@H]2CC[C@@H]3C[C@@H]3C2)nc(C2CC2)[nH+]1 ZINC000645400367 386413924 /nfs/dbraw/zinc/41/39/24/386413924.db2.gz OUXXSCDZAWCEHS-IJLUTSLNSA-N 1 2 229.327 2.376 20 0 BEADLO Cc1cc(NC(=O)N2C[C@H](C)[C@H](C)[C@@H]2C)cc[nH+]1 ZINC000416947578 386418495 /nfs/dbraw/zinc/41/84/95/386418495.db2.gz JFHBCBODMWTBAE-DLOVCJGASA-N 1 2 247.342 2.320 20 0 BEADLO Cc1cnc(C[N@H+]2CC[C@@H](OCC(C)C)C2)nc1 ZINC000336708601 386419418 /nfs/dbraw/zinc/41/94/18/386419418.db2.gz LGONCMYBSCFJAC-CYBMUJFWSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1cnc(C[N@@H+]2CC[C@@H](OCC(C)C)C2)nc1 ZINC000336708601 386419424 /nfs/dbraw/zinc/41/94/24/386419424.db2.gz LGONCMYBSCFJAC-CYBMUJFWSA-N 1 2 249.358 2.032 20 0 BEADLO O=C(/C=C/C1CC1)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000266328400 386425021 /nfs/dbraw/zinc/42/50/21/386425021.db2.gz YEPBRXSYFOLLRM-BTDICHCPSA-N 1 2 245.326 2.082 20 0 BEADLO Cc1cnc(C[N@@H+](C)[C@@H](C)c2ccncc2)nc1 ZINC000336710243 386425403 /nfs/dbraw/zinc/42/54/03/386425403.db2.gz MSMILOJCGQTBOL-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO Cc1cnc(C[N@H+](C)[C@@H](C)c2ccncc2)nc1 ZINC000336710243 386425411 /nfs/dbraw/zinc/42/54/11/386425411.db2.gz MSMILOJCGQTBOL-LBPRGKRZSA-N 1 2 242.326 2.373 20 0 BEADLO CC[C@@H](C)C[C@@H](C)NC(=O)CCn1cc[nH+]c1 ZINC000266339607 386427875 /nfs/dbraw/zinc/42/78/75/386427875.db2.gz LWJVYTRLYBHRTQ-VXGBXAGGSA-N 1 2 237.347 2.214 20 0 BEADLO CC[C@H]1C[N@H+](Cc2[nH]ncc2C)CCS1 ZINC000290569417 386452243 /nfs/dbraw/zinc/45/22/43/386452243.db2.gz YKDQHYKIHIVXFW-JTQLQIEISA-N 1 2 225.361 2.046 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2[nH]ncc2C)CCS1 ZINC000290569417 386452248 /nfs/dbraw/zinc/45/22/48/386452248.db2.gz YKDQHYKIHIVXFW-JTQLQIEISA-N 1 2 225.361 2.046 20 0 BEADLO CCO[C@H](C)c1noc(C[N@H+](CC)C2CC2)n1 ZINC000336714387 386432274 /nfs/dbraw/zinc/43/22/74/386432274.db2.gz TUXJHGGARUAZLZ-SECBINFHSA-N 1 2 239.319 2.151 20 0 BEADLO CCO[C@H](C)c1noc(C[N@@H+](CC)C2CC2)n1 ZINC000336714387 386432276 /nfs/dbraw/zinc/43/22/76/386432276.db2.gz TUXJHGGARUAZLZ-SECBINFHSA-N 1 2 239.319 2.151 20 0 BEADLO C[NH+](C)Cc1nc(CC2(C)CCCC2)no1 ZINC000347475104 386432226 /nfs/dbraw/zinc/43/22/26/386432226.db2.gz GTQIFWBCTAUNCU-UHFFFAOYSA-N 1 2 223.320 2.254 20 0 BEADLO CCO[C@@H](C)c1noc(C[N@H+](CC)C2CC2)n1 ZINC000336714388 386432693 /nfs/dbraw/zinc/43/26/93/386432693.db2.gz TUXJHGGARUAZLZ-VIFPVBQESA-N 1 2 239.319 2.151 20 0 BEADLO CCO[C@@H](C)c1noc(C[N@@H+](CC)C2CC2)n1 ZINC000336714388 386432700 /nfs/dbraw/zinc/43/27/00/386432700.db2.gz TUXJHGGARUAZLZ-VIFPVBQESA-N 1 2 239.319 2.151 20 0 BEADLO CCc1ncc(C[N@@H+]2CC(C)(C)OC[C@@H]2C)cn1 ZINC000414433461 386434239 /nfs/dbraw/zinc/43/42/39/386434239.db2.gz KNYUYRNYUMCXHZ-NSHDSACASA-N 1 2 249.358 2.038 20 0 BEADLO CCc1ncc(C[N@H+]2CC(C)(C)OC[C@@H]2C)cn1 ZINC000414433461 386434250 /nfs/dbraw/zinc/43/42/50/386434250.db2.gz KNYUYRNYUMCXHZ-NSHDSACASA-N 1 2 249.358 2.038 20 0 BEADLO CCO[C@H](C)c1noc(C[N@@H+]2C[C@H](C)[C@@H]2C)n1 ZINC000339578651 386473531 /nfs/dbraw/zinc/47/35/31/386473531.db2.gz CLGXUAXPMUQEDI-LPEHRKFASA-N 1 2 239.319 2.007 20 0 BEADLO CCO[C@H](C)c1noc(C[N@H+]2C[C@H](C)[C@@H]2C)n1 ZINC000339578651 386473537 /nfs/dbraw/zinc/47/35/37/386473537.db2.gz CLGXUAXPMUQEDI-LPEHRKFASA-N 1 2 239.319 2.007 20 0 BEADLO Cc1[nH]c(C(=O)NC2CCC3(CC3)CC2)c[nH+]1 ZINC000277899618 386475455 /nfs/dbraw/zinc/47/54/55/386475455.db2.gz LULXXRHHLDDXJV-UHFFFAOYSA-N 1 2 233.315 2.171 20 0 BEADLO CCc1ccc(CC[N@H+](C)Cc2nnc[nH]2)cc1 ZINC000266861438 386476101 /nfs/dbraw/zinc/47/61/01/386476101.db2.gz JZCXNSFEDIJCIC-UHFFFAOYSA-N 1 2 244.342 2.042 20 0 BEADLO CCc1ccc(CC[N@@H+](C)Cc2nnc[nH]2)cc1 ZINC000266861438 386476109 /nfs/dbraw/zinc/47/61/09/386476109.db2.gz JZCXNSFEDIJCIC-UHFFFAOYSA-N 1 2 244.342 2.042 20 0 BEADLO CCC[C@H](C)CC(=O)NCc1[nH]c[nH+]c1C ZINC000266990638 386485005 /nfs/dbraw/zinc/48/50/05/386485005.db2.gz UYDVXOVQWYBBQE-VIFPVBQESA-N 1 2 223.320 2.161 20 0 BEADLO CO[C@](C)(C(=O)Nc1cc[nH+]c(C)c1)C1CC1 ZINC000290890833 386486743 /nfs/dbraw/zinc/48/67/43/386486743.db2.gz CWXZIEGWBDNZNB-ZDUSSCGKSA-N 1 2 234.299 2.144 20 0 BEADLO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2nccc(N)n2)o1 ZINC000647971133 386495146 /nfs/dbraw/zinc/49/51/46/386495146.db2.gz VDSACQVEYINQSO-ZJUUUORDSA-N 1 2 246.314 2.202 20 0 BEADLO Cc1cnc(C[NH+]2CC(C)(C)OC(C)(C)C2)cn1 ZINC000336783482 386507075 /nfs/dbraw/zinc/50/70/75/386507075.db2.gz VJJGZCVLSFADCW-UHFFFAOYSA-N 1 2 249.358 2.174 20 0 BEADLO Cc1ccnc(C[N@H+](C)Cc2ccccc2)n1 ZINC000339658573 386509004 /nfs/dbraw/zinc/50/90/04/386509004.db2.gz NUEFGZPBQGAZMO-UHFFFAOYSA-N 1 2 227.311 2.417 20 0 BEADLO Cc1ccnc(C[N@@H+](C)Cc2ccccc2)n1 ZINC000339658573 386509011 /nfs/dbraw/zinc/50/90/11/386509011.db2.gz NUEFGZPBQGAZMO-UHFFFAOYSA-N 1 2 227.311 2.417 20 0 BEADLO C[C@@H](CC1CC1)[NH2+]c1ccc(OCC(N)=O)cc1 ZINC000165062586 386509679 /nfs/dbraw/zinc/50/96/79/386509679.db2.gz NWBGQVKGSLTJLU-JTQLQIEISA-N 1 2 248.326 2.151 20 0 BEADLO C[C@@H]([NH2+]Cc1cccc(O)c1)c1ccon1 ZINC000336779721 386515359 /nfs/dbraw/zinc/51/53/59/386515359.db2.gz PIIZHZFZPADURV-SECBINFHSA-N 1 2 218.256 2.231 20 0 BEADLO Cc1nc(N2CC(C)(C)[C@@H]2[C@H]2CCCO2)cc[nH+]1 ZINC000291143030 386516671 /nfs/dbraw/zinc/51/66/71/386516671.db2.gz OANZEDYVNUMNDI-YPMHNXCESA-N 1 2 247.342 2.179 20 0 BEADLO CCn1cncc1C[N@@H+]1C[C@H](C)OC2(CCC2)C1 ZINC000335449228 386517085 /nfs/dbraw/zinc/51/70/85/386517085.db2.gz IRUSXAASIFBFQW-LBPRGKRZSA-N 1 2 249.358 2.046 20 0 BEADLO CCn1cncc1C[N@H+]1C[C@H](C)OC2(CCC2)C1 ZINC000335449228 386517089 /nfs/dbraw/zinc/51/70/89/386517089.db2.gz IRUSXAASIFBFQW-LBPRGKRZSA-N 1 2 249.358 2.046 20 0 BEADLO CCn1c[nH+]cc1CN1C[C@H](C)OC2(CCC2)C1 ZINC000335449228 386517094 /nfs/dbraw/zinc/51/70/94/386517094.db2.gz IRUSXAASIFBFQW-LBPRGKRZSA-N 1 2 249.358 2.046 20 0 BEADLO Cc1ncccc1NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000519661291 386521499 /nfs/dbraw/zinc/52/14/99/386521499.db2.gz YWVHWZUWOGWPIZ-SNVBAGLBSA-N 1 2 244.298 2.176 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CC(C)(C)OC(C)(C)C1 ZINC000519646367 386523581 /nfs/dbraw/zinc/52/35/81/386523581.db2.gz HVSBTYYZBKLQOF-UHFFFAOYSA-N 1 2 249.358 2.487 20 0 BEADLO CC(C)=CC[N@@H+](C)[C@@H](C)c1nc(C)no1 ZINC000519648780 386524997 /nfs/dbraw/zinc/52/49/97/386524997.db2.gz ORHSNRNFWAFUHN-VIFPVBQESA-N 1 2 209.293 2.337 20 0 BEADLO CC(C)=CC[N@H+](C)[C@@H](C)c1nc(C)no1 ZINC000519648780 386525004 /nfs/dbraw/zinc/52/50/04/386525004.db2.gz ORHSNRNFWAFUHN-VIFPVBQESA-N 1 2 209.293 2.337 20 0 BEADLO CC(C)=CC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000299470381 386454564 /nfs/dbraw/zinc/45/45/64/386454564.db2.gz XDEOWSJPFHCMFR-LLVKDONJSA-N 1 2 233.315 2.430 20 0 BEADLO c1ccc(NCCCOC[C@H]2CCCO2)[nH+]c1 ZINC000266592019 386455512 /nfs/dbraw/zinc/45/55/12/386455512.db2.gz RCIQQIUPCYNOKF-GFCCVEGCSA-N 1 2 236.315 2.079 20 0 BEADLO Cc1cnc(C[N@H+]2CCOC[C@H]2CC(C)C)cn1 ZINC000336722668 386463552 /nfs/dbraw/zinc/46/35/52/386463552.db2.gz YPFJXHORBZAIQN-CQSZACIVSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1cnc(C[N@@H+]2CCOC[C@H]2CC(C)C)cn1 ZINC000336722668 386463555 /nfs/dbraw/zinc/46/35/55/386463555.db2.gz YPFJXHORBZAIQN-CQSZACIVSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@H](C)c2ccccn2)nn1C ZINC000336722677 386465293 /nfs/dbraw/zinc/46/52/93/386465293.db2.gz YQIMLONQURDNDT-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cc(C[N@H+](C)[C@H](C)c2ccccn2)nn1C ZINC000336722677 386465300 /nfs/dbraw/zinc/46/53/00/386465300.db2.gz YQIMLONQURDNDT-GFCCVEGCSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1noc(C[NH2+]C(C)(C)c2ccccc2)n1 ZINC000299544697 386465343 /nfs/dbraw/zinc/46/53/43/386465343.db2.gz ATPBJMHOLDFGKE-UHFFFAOYSA-N 1 2 231.299 2.403 20 0 BEADLO CCCCN(C(=O)CCn1cc[nH+]c1)C1CC1 ZINC000299538627 386465429 /nfs/dbraw/zinc/46/54/29/386465429.db2.gz AJKLGLITKAVOFC-UHFFFAOYSA-N 1 2 235.331 2.064 20 0 BEADLO Cn1ncc2c1nc[nH+]c2NCC1(C)CCCC1 ZINC000066468072 386576877 /nfs/dbraw/zinc/57/68/77/386576877.db2.gz MOUYVFBEPPINBI-UHFFFAOYSA-N 1 2 245.330 2.356 20 0 BEADLO COC[C@H](C)N(C)c1cc[nH+]c2ccncc21 ZINC000267916377 386598514 /nfs/dbraw/zinc/59/85/14/386598514.db2.gz BOIUMABODCLRBI-JTQLQIEISA-N 1 2 231.299 2.101 20 0 BEADLO CCN(CC)C(=S)SCc1c[nH+]cn1C ZINC000267822392 386589924 /nfs/dbraw/zinc/58/99/24/386589924.db2.gz XYIJDNZGJYRMJC-UHFFFAOYSA-N 1 2 243.401 2.280 20 0 BEADLO C[C@H]([NH2+][C@H]1CCCc2occc21)c1ncnn1C ZINC000278810394 386590260 /nfs/dbraw/zinc/59/02/60/386590260.db2.gz RXDPYHBULHCCSW-ONGXEEELSA-N 1 2 246.314 2.136 20 0 BEADLO COC(=O)C[N@H+](CCc1ccc(C)cc1)C1CC1 ZINC000267860550 386591675 /nfs/dbraw/zinc/59/16/75/386591675.db2.gz YDYUEBZBHIIEMR-UHFFFAOYSA-N 1 2 247.338 2.175 20 0 BEADLO COC(=O)C[N@@H+](CCc1ccc(C)cc1)C1CC1 ZINC000267860550 386591678 /nfs/dbraw/zinc/59/16/78/386591678.db2.gz YDYUEBZBHIIEMR-UHFFFAOYSA-N 1 2 247.338 2.175 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C=C(C1CC1)C1CC1 ZINC000267863488 386592140 /nfs/dbraw/zinc/59/21/40/386592140.db2.gz HUUOKWSNIZRMBT-UHFFFAOYSA-N 1 2 245.326 2.081 20 0 BEADLO Cc1ccc(C[N@@H+]2CCO[C@H](C(C)(C)C)C2)nn1 ZINC000414451166 386537219 /nfs/dbraw/zinc/53/72/19/386537219.db2.gz ZTGBCUDLQIVEPV-ZDUSSCGKSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1ccc(C[N@H+]2CCO[C@H](C(C)(C)C)C2)nn1 ZINC000414451166 386537222 /nfs/dbraw/zinc/53/72/22/386537222.db2.gz ZTGBCUDLQIVEPV-ZDUSSCGKSA-N 1 2 249.358 2.032 20 0 BEADLO Cc1cc(C[N@H+]2C[C@H](C)OC3(CCC3)C2)no1 ZINC000335460657 386539819 /nfs/dbraw/zinc/53/98/19/386539819.db2.gz AWPKNUUUPCPHME-NSHDSACASA-N 1 2 236.315 2.126 20 0 BEADLO Cc1cc(C[N@@H+]2C[C@H](C)OC3(CCC3)C2)no1 ZINC000335460657 386539824 /nfs/dbraw/zinc/53/98/24/386539824.db2.gz AWPKNUUUPCPHME-NSHDSACASA-N 1 2 236.315 2.126 20 0 BEADLO CCc1ccc(NC(=O)Cc2[nH]c[nH+]c2C)cc1 ZINC000278526475 386541868 /nfs/dbraw/zinc/54/18/68/386541868.db2.gz DFQIIYIBYHITOQ-UHFFFAOYSA-N 1 2 243.310 2.462 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nccs2)CC2(CCC2)O1 ZINC000335462373 386546180 /nfs/dbraw/zinc/54/61/80/386546180.db2.gz FNIWPHGGGSICPR-SNVBAGLBSA-N 1 2 238.356 2.287 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nccs2)CC2(CCC2)O1 ZINC000335462373 386546181 /nfs/dbraw/zinc/54/61/81/386546181.db2.gz FNIWPHGGGSICPR-SNVBAGLBSA-N 1 2 238.356 2.287 20 0 BEADLO CC(C(=O)N[C@H](C)Cn1cc[nH+]c1)=C1CCCC1 ZINC000267901063 386599016 /nfs/dbraw/zinc/59/90/16/386599016.db2.gz ZUNCUIWWTBHYTF-LLVKDONJSA-N 1 2 247.342 2.278 20 0 BEADLO Cc1cc(NCc2ccc(C)c(C)n2)nc[nH+]1 ZINC000314328562 386550069 /nfs/dbraw/zinc/55/00/69/386550069.db2.gz SXKKZNHEFLGOFJ-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO Fc1ccc(CN2CCn3c[nH+]cc3C2)cc1 ZINC000291497297 386551717 /nfs/dbraw/zinc/55/17/17/386551717.db2.gz HDOUDAQRXZRGEP-UHFFFAOYSA-N 1 2 231.274 2.038 20 0 BEADLO C/C=C/C=C/C(=O)N1CCC[C@@H]1Cn1cc[nH+]c1 ZINC000267570249 386553481 /nfs/dbraw/zinc/55/34/81/386553481.db2.gz CSRFWDNZCIPFGV-YUQOPSFVSA-N 1 2 245.326 2.006 20 0 BEADLO CCCCN(C)c1cc(N2CCCC2)nc[nH+]1 ZINC000242973619 386556258 /nfs/dbraw/zinc/55/62/58/386556258.db2.gz HOLGFOXTZKIOGX-UHFFFAOYSA-N 1 2 234.347 2.313 20 0 BEADLO CCCCN(C)c1cc(N2CCCC2)[nH+]cn1 ZINC000242973619 386556264 /nfs/dbraw/zinc/55/62/64/386556264.db2.gz HOLGFOXTZKIOGX-UHFFFAOYSA-N 1 2 234.347 2.313 20 0 BEADLO Cc1ccc(C[N@@H+]2CCn3cncc3C2)cc1 ZINC000291594504 386558540 /nfs/dbraw/zinc/55/85/40/386558540.db2.gz QCDKIESKUWKFSE-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO Cc1ccc(C[N@H+]2CCn3cncc3C2)cc1 ZINC000291594504 386558544 /nfs/dbraw/zinc/55/85/44/386558544.db2.gz QCDKIESKUWKFSE-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO Cc1ccc(CN2CCn3c[nH+]cc3C2)cc1 ZINC000291594504 386558549 /nfs/dbraw/zinc/55/85/49/386558549.db2.gz QCDKIESKUWKFSE-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO Cc1nnsc1CNc1cc[nH+]c(C2CC2)n1 ZINC000291619360 386561783 /nfs/dbraw/zinc/56/17/83/386561783.db2.gz ASTYNWJTVYATJE-UHFFFAOYSA-N 1 2 247.327 2.126 20 0 BEADLO Cc1ccc2[nH+]cc(CN3CC[C@H](F)C3)n2c1 ZINC000335405562 386562404 /nfs/dbraw/zinc/56/24/04/386562404.db2.gz DWBSPNMLSXVGBM-NSHDSACASA-N 1 2 233.290 2.187 20 0 BEADLO Cc1ccc2ncc(C[N@@H+]3CC[C@H](F)C3)n2c1 ZINC000335405562 386562409 /nfs/dbraw/zinc/56/24/09/386562409.db2.gz DWBSPNMLSXVGBM-NSHDSACASA-N 1 2 233.290 2.187 20 0 BEADLO Cc1ccc2ncc(C[N@H+]3CC[C@H](F)C3)n2c1 ZINC000335405562 386562414 /nfs/dbraw/zinc/56/24/14/386562414.db2.gz DWBSPNMLSXVGBM-NSHDSACASA-N 1 2 233.290 2.187 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1CC[C@H](F)C1 ZINC000335406885 386565705 /nfs/dbraw/zinc/56/57/05/386565705.db2.gz QWPCNLSTHKCILE-JTQLQIEISA-N 1 2 211.284 2.008 20 0 BEADLO CC(C)n1nccc1C[N@H+]1CC[C@H](F)C1 ZINC000335406885 386565709 /nfs/dbraw/zinc/56/57/09/386565709.db2.gz QWPCNLSTHKCILE-JTQLQIEISA-N 1 2 211.284 2.008 20 0 BEADLO CC[C@H]1CC[C@H](C(=O)Nc2cc[nH+]c(C)c2)O1 ZINC000268137831 386623173 /nfs/dbraw/zinc/62/31/73/386623173.db2.gz NDVBCQRVGWGPFB-NWDGAFQWSA-N 1 2 234.299 2.286 20 0 BEADLO CC[C@H](C)C[C@H](CO)Nc1cccc[nH+]1 ZINC000645354668 386632739 /nfs/dbraw/zinc/63/27/39/386632739.db2.gz AVAXGFPUGMJFAI-WDEREUQCSA-N 1 2 208.305 2.291 20 0 BEADLO CC(C)CO[C@@H]1CCN(c2cccc[nH+]2)C1 ZINC000268256412 386633729 /nfs/dbraw/zinc/63/37/29/386633729.db2.gz IOVBIHDRKBCLHR-GFCCVEGCSA-N 1 2 220.316 2.333 20 0 BEADLO CCCCCCNC(=O)CCc1[nH]cc[nH+]1 ZINC000279114157 386633985 /nfs/dbraw/zinc/63/39/85/386633985.db2.gz CIHCYRYAHIHWCC-UHFFFAOYSA-N 1 2 223.320 2.039 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)C[C@@H]1CC[C@H](C)C1 ZINC000268301468 386638250 /nfs/dbraw/zinc/63/82/50/386638250.db2.gz YFCXYLDKHORQSN-GXSJLCMTSA-N 1 2 235.331 2.161 20 0 BEADLO CCN(C(=O)Cc1[nH]c[nH+]c1C)C1CCCCC1 ZINC000279147884 386640367 /nfs/dbraw/zinc/64/03/67/386640367.db2.gz DZCIKZNYCARQQN-UHFFFAOYSA-N 1 2 249.358 2.442 20 0 BEADLO C[C@@H]1CCC[C@@H](NC(=O)CCc2[nH]cc[nH+]2)[C@H]1C ZINC000279213484 386648366 /nfs/dbraw/zinc/64/83/66/386648366.db2.gz MSOATDINGRWLDZ-GRYCIOLGSA-N 1 2 249.358 2.283 20 0 BEADLO CC(C)n1nccc1C[NH2+][C@@H](C)c1ccon1 ZINC000337202571 386651138 /nfs/dbraw/zinc/65/11/38/386651138.db2.gz GZTVFFCKSRMHRA-JTQLQIEISA-N 1 2 234.303 2.303 20 0 BEADLO Cc1cc(N(C)C[C@H](C)O)c2cccc(F)c2[nH+]1 ZINC000292327223 386651289 /nfs/dbraw/zinc/65/12/89/386651289.db2.gz MTEFRUUALOZNOI-JTQLQIEISA-N 1 2 248.301 2.499 20 0 BEADLO CCc1cccc(N(C)C(=O)Cn2cc[nH+]c2)c1 ZINC000520352545 386652827 /nfs/dbraw/zinc/65/28/27/386652827.db2.gz IIYXCBIJZCGOFF-UHFFFAOYSA-N 1 2 243.310 2.109 20 0 BEADLO Cc1ccc(NC(=O)CC2CC2)c(C)[nH+]1 ZINC000268031238 386609989 /nfs/dbraw/zinc/60/99/89/386609989.db2.gz XYDVBGLOXXWQLJ-UHFFFAOYSA-N 1 2 204.273 2.437 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccc(C)c(C)n2)nn1C ZINC000414463303 386610410 /nfs/dbraw/zinc/61/04/10/386610410.db2.gz NQMLPKQESBSEID-UHFFFAOYSA-N 1 2 244.342 2.030 20 0 BEADLO C=Cc1ccc(CC[NH2+][C@H](CC)C(=O)OC)cc1 ZINC000292041485 386613100 /nfs/dbraw/zinc/61/31/00/386613100.db2.gz YJYCBJKLIFMKSS-CQSZACIVSA-N 1 2 247.338 2.413 20 0 BEADLO [NH3+]CC(F)(F)CN[C@H]1CCCC[C@@H]1C1CC1 ZINC000414923993 386613924 /nfs/dbraw/zinc/61/39/24/386613924.db2.gz FYPLNXIEQBIOIR-MNOVXSKESA-N 1 2 232.318 2.139 20 0 BEADLO Cc1ccc(NC(=O)NC[C@H]2C[C@H]2C)c(C)[nH+]1 ZINC000268038436 386614443 /nfs/dbraw/zinc/61/44/43/386614443.db2.gz RKQHWQZMGQNJHT-LDYMZIIASA-N 1 2 233.315 2.476 20 0 BEADLO O=C(Nc1ccc2[nH+]ccn2c1)N[C@H]1CC12CC2 ZINC000644999540 386661297 /nfs/dbraw/zinc/66/12/97/386661297.db2.gz JULRXVQHAHYIPL-JTQLQIEISA-N 1 2 242.282 2.008 20 0 BEADLO CC(C)n1cncc1C[N@@H+]1CCOC[C@@H]1C1CC1 ZINC000425330281 386661661 /nfs/dbraw/zinc/66/16/61/386661661.db2.gz BFMBGWSEBLZACS-CQSZACIVSA-N 1 2 249.358 2.075 20 0 BEADLO CC(C)n1cncc1C[N@H+]1CCOC[C@@H]1C1CC1 ZINC000425330281 386661668 /nfs/dbraw/zinc/66/16/68/386661668.db2.gz BFMBGWSEBLZACS-CQSZACIVSA-N 1 2 249.358 2.075 20 0 BEADLO C[N@H+](CCn1cccn1)C/C(Cl)=C/Cl ZINC000268689169 386682324 /nfs/dbraw/zinc/68/23/24/386682324.db2.gz QXKPYJROGIECMK-CLFYSBASSA-N 1 2 234.130 2.134 20 0 BEADLO C[N@@H+](CCn1cccn1)C/C(Cl)=C/Cl ZINC000268689169 386682332 /nfs/dbraw/zinc/68/23/32/386682332.db2.gz QXKPYJROGIECMK-CLFYSBASSA-N 1 2 234.130 2.134 20 0 BEADLO CC[C@H](c1ccccc1)[N@H+](C)Cc1nncn1C ZINC000340683184 386670205 /nfs/dbraw/zinc/67/02/05/386670205.db2.gz JFLOPZMLFJIELR-CYBMUJFWSA-N 1 2 244.342 2.398 20 0 BEADLO CC[C@H](c1ccccc1)[N@@H+](C)Cc1nncn1C ZINC000340683184 386670214 /nfs/dbraw/zinc/67/02/14/386670214.db2.gz JFLOPZMLFJIELR-CYBMUJFWSA-N 1 2 244.342 2.398 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N(CC(C)C)C(C)C ZINC000279353315 386671259 /nfs/dbraw/zinc/67/12/59/386671259.db2.gz FKIRSCOCKHACEK-UHFFFAOYSA-N 1 2 237.347 2.154 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1CCOC[C@@H]1C ZINC000335527082 386671728 /nfs/dbraw/zinc/67/17/28/386671728.db2.gz FQBQIDNRABCPNJ-CMPLNLGQSA-N 1 2 248.326 2.310 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CC[C@@H](C)[C@@H](C)C1 ZINC000520426554 386673163 /nfs/dbraw/zinc/67/31/63/386673163.db2.gz LRXYUYZMSNQBDT-UTUOFQBUSA-N 1 2 249.358 2.093 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CC[C@@H](C)[C@@H](C)C1 ZINC000520426554 386673169 /nfs/dbraw/zinc/67/31/69/386673169.db2.gz LRXYUYZMSNQBDT-UTUOFQBUSA-N 1 2 249.358 2.093 20 0 BEADLO CC(C)n1cnnc1C[N@H+](C)[C@H]1C=CCCC1 ZINC000292449217 386675047 /nfs/dbraw/zinc/67/50/47/386675047.db2.gz PFNTURPLHOJWNI-LBPRGKRZSA-N 1 2 234.347 2.400 20 0 BEADLO CC(C)n1cnnc1C[N@@H+](C)[C@H]1C=CCCC1 ZINC000292449217 386675049 /nfs/dbraw/zinc/67/50/49/386675049.db2.gz PFNTURPLHOJWNI-LBPRGKRZSA-N 1 2 234.347 2.400 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1CCO[C@H]1C ZINC000335531144 386680024 /nfs/dbraw/zinc/68/00/24/386680024.db2.gz WDLGSQLXNZBXNW-QWRGUYRKSA-N 1 2 234.299 2.062 20 0 BEADLO OC[C@H]1CCN(c2[nH+]ccc3cc(F)ccc32)C1 ZINC000335482311 386710056 /nfs/dbraw/zinc/71/00/56/386710056.db2.gz QHFFMNPQXJLODP-JTQLQIEISA-N 1 2 246.285 2.193 20 0 BEADLO COC(=O)C[N@H+](C)[C@H](C)c1cc(C)ccc1C ZINC000339830689 386684595 /nfs/dbraw/zinc/68/45/95/386684595.db2.gz SZGJBUJZGTWDJW-GFCCVEGCSA-N 1 2 235.327 2.469 20 0 BEADLO COC(=O)C[N@@H+](C)[C@H](C)c1cc(C)ccc1C ZINC000339830689 386684601 /nfs/dbraw/zinc/68/46/01/386684601.db2.gz SZGJBUJZGTWDJW-GFCCVEGCSA-N 1 2 235.327 2.469 20 0 BEADLO CC(C)(CC(=O)NCCCn1cc[nH+]c1)C1CC1 ZINC000292553323 386687613 /nfs/dbraw/zinc/68/76/13/386687613.db2.gz BBAPDGAJPDGFOD-UHFFFAOYSA-N 1 2 249.358 2.216 20 0 BEADLO CO[C@H](CNc1cc2cc[nH]c2c[nH+]1)C1CC1 ZINC000645054397 386696299 /nfs/dbraw/zinc/69/62/99/386696299.db2.gz TZDVFWPHQDCATD-GFCCVEGCSA-N 1 2 231.299 2.400 20 0 BEADLO CC[C@@H]([NH2+]CCCSCC(C)C)C(=O)OC ZINC000192861046 386696360 /nfs/dbraw/zinc/69/63/60/386696360.db2.gz PTJPAVVBHWYNCT-LLVKDONJSA-N 1 2 247.404 2.307 20 0 BEADLO Cc1ccc(C[NH2+][C@H]2CCCc3cn[nH]c32)o1 ZINC000268836421 386702626 /nfs/dbraw/zinc/70/26/26/386702626.db2.gz LZBNLFWAENDMAN-LBPRGKRZSA-N 1 2 231.299 2.478 20 0 BEADLO Cc1ccc(C[NH2+][C@H]2CCCc3c[nH]nc32)o1 ZINC000268836421 386702631 /nfs/dbraw/zinc/70/26/31/386702631.db2.gz LZBNLFWAENDMAN-LBPRGKRZSA-N 1 2 231.299 2.478 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CCC[C@@H](C)[C@H]2C)c[nH+]1 ZINC000264603339 386706592 /nfs/dbraw/zinc/70/65/92/386706592.db2.gz FKFPTQXFWFGMEL-FXPVBKGRSA-N 1 2 235.331 2.273 20 0 BEADLO C[C@]1(O)CCN(c2[nH+]ccc3cc(F)ccc32)C1 ZINC000335484096 386712683 /nfs/dbraw/zinc/71/26/83/386712683.db2.gz PTFWLEJGPQYLDQ-AWEZNQCLSA-N 1 2 246.285 2.335 20 0 BEADLO Cc1csc([C@H](C)[NH2+]Cc2cnc(C)nc2)n1 ZINC000340691108 386714025 /nfs/dbraw/zinc/71/40/25/386714025.db2.gz PEISCNCQZPCDGZ-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO O=C([C@H]1[C@@H]2CCC[C@@H]21)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000357130294 386722428 /nfs/dbraw/zinc/72/24/28/386722428.db2.gz QSQZZHKYXSGOOU-KXNHARMFSA-N 1 2 245.326 2.119 20 0 BEADLO COC(=O)[C@H](CC1CC1)[NH2+]Cc1ccccc1 ZINC000414492410 386725416 /nfs/dbraw/zinc/72/54/16/386725416.db2.gz RLXATRFOBZWENQ-ZDUSSCGKSA-N 1 2 233.311 2.118 20 0 BEADLO CC[C@@H](C)Sc1[nH+]cnc2c1cnn2C ZINC000248182990 386746740 /nfs/dbraw/zinc/74/67/40/386746740.db2.gz ZXCMQSRLHLNWAH-SSDOTTSWSA-N 1 2 222.317 2.254 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2CC[C@H](C)C2)cc[nH+]1 ZINC000408441660 386749694 /nfs/dbraw/zinc/74/96/94/386749694.db2.gz FWNICKSIPKKKFD-ONGXEEELSA-N 1 2 233.315 2.122 20 0 BEADLO c1cc2c(o1)CCC[C@@H]2[NH2+]Cc1cocn1 ZINC000192285157 386752650 /nfs/dbraw/zinc/75/26/50/386752650.db2.gz OVPRGDMABBDGQA-NSHDSACASA-N 1 2 218.256 2.435 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC(F)(F)[C@H](C)C2)s1 ZINC000334155968 386753952 /nfs/dbraw/zinc/75/39/52/386753952.db2.gz XBTCKLHWBGLYEG-SSDOTTSWSA-N 1 2 247.314 2.324 20 0 BEADLO Cc1nnc(C[N@H+]2CCC(F)(F)[C@H](C)C2)s1 ZINC000334155968 386753960 /nfs/dbraw/zinc/75/39/60/386753960.db2.gz XBTCKLHWBGLYEG-SSDOTTSWSA-N 1 2 247.314 2.324 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)s1 ZINC000334155969 386754482 /nfs/dbraw/zinc/75/44/82/386754482.db2.gz XBTCKLHWBGLYEG-ZETCQYMHSA-N 1 2 247.314 2.324 20 0 BEADLO Cc1nnc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)s1 ZINC000334155969 386754490 /nfs/dbraw/zinc/75/44/90/386754490.db2.gz XBTCKLHWBGLYEG-ZETCQYMHSA-N 1 2 247.314 2.324 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2ccc[nH]2)s1 ZINC000357301851 386756174 /nfs/dbraw/zinc/75/61/74/386756174.db2.gz CKKPPWGVEAYEMB-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2ccc[nH]2)s1 ZINC000357301851 386756178 /nfs/dbraw/zinc/75/61/78/386756178.db2.gz CKKPPWGVEAYEMB-UHFFFAOYSA-N 1 2 221.329 2.412 20 0 BEADLO C[C@@H]1C[C@H]1C[NH+]=c1[nH]c2cccc(F)c2n1C ZINC000357319029 386759886 /nfs/dbraw/zinc/75/98/86/386759886.db2.gz UDUHHMCKDGFUTH-BDAKNGLRSA-N 1 2 233.290 2.202 20 0 BEADLO COC1(CNc2cc[nH+]cc2F)CCCC1 ZINC000336760885 386760099 /nfs/dbraw/zinc/76/00/99/386760099.db2.gz KAOORACBOMQYNC-UHFFFAOYSA-N 1 2 224.279 2.014 20 0 BEADLO C[C@H]([NH2+]Cc1ncc(C2CC2)o1)c1cnn(C)c1 ZINC000329656537 386760405 /nfs/dbraw/zinc/76/04/05/386760405.db2.gz GIAVVGFXHFNADE-VIFPVBQESA-N 1 2 246.314 2.136 20 0 BEADLO Cn1cc(C[N@@H+]2CCC[C@H]2CF)c(C(F)F)n1 ZINC000292992007 386760623 /nfs/dbraw/zinc/76/06/23/386760623.db2.gz IJUPLPPGRNDJMO-VIFPVBQESA-N 1 2 247.264 2.292 20 0 BEADLO Cn1cc(C[N@H+]2CCC[C@H]2CF)c(C(F)F)n1 ZINC000292992007 386760629 /nfs/dbraw/zinc/76/06/29/386760629.db2.gz IJUPLPPGRNDJMO-VIFPVBQESA-N 1 2 247.264 2.292 20 0 BEADLO c1nc(C[N@@H+]2CCC[C@H]2c2cccnc2)co1 ZINC000348921772 386768864 /nfs/dbraw/zinc/76/88/64/386768864.db2.gz OJRCXNFTXJHZML-ZDUSSCGKSA-N 1 2 229.283 2.407 20 0 BEADLO c1nc(C[N@H+]2CCC[C@H]2c2cccnc2)co1 ZINC000348921772 386768872 /nfs/dbraw/zinc/76/88/72/386768872.db2.gz OJRCXNFTXJHZML-ZDUSSCGKSA-N 1 2 229.283 2.407 20 0 BEADLO COC(=O)[C@H](c1ccccc1)[N@@H+]1C[C@H](C)[C@@H]1C ZINC000292886112 386742086 /nfs/dbraw/zinc/74/20/86/386742086.db2.gz CMSLCXFQSPAARE-GVXVVHGQSA-N 1 2 233.311 2.241 20 0 BEADLO COC(=O)[C@H](c1ccccc1)[N@H+]1C[C@H](C)[C@@H]1C ZINC000292886112 386742093 /nfs/dbraw/zinc/74/20/93/386742093.db2.gz CMSLCXFQSPAARE-GVXVVHGQSA-N 1 2 233.311 2.241 20 0 BEADLO C[C@@H](N[C@@H](C)c1[nH+]ccn1C)C(F)(F)F ZINC000336760633 386743101 /nfs/dbraw/zinc/74/31/01/386743101.db2.gz MHFPHCRKIMMLMQ-NKWVEPMBSA-N 1 2 221.226 2.022 20 0 BEADLO Cc1ccc(NC(=O)CCc2[nH]cc[nH+]2)cc1F ZINC000344140156 386743499 /nfs/dbraw/zinc/74/34/99/386743499.db2.gz RULUJBUSPYBUNM-UHFFFAOYSA-N 1 2 247.273 2.429 20 0 BEADLO C[NH+](C)Cc1nc([C@@H]2CCCCS2)no1 ZINC000334143043 386743745 /nfs/dbraw/zinc/74/37/45/386743745.db2.gz CCOBKMBQGRAOFQ-QMMMGPOBSA-N 1 2 227.333 2.089 20 0 BEADLO Cc1ccc(CCC(=O)Nc2cc[nH+]cc2C)o1 ZINC000340861988 386789639 /nfs/dbraw/zinc/78/96/39/386789639.db2.gz GFNHEGFSZKSOHE-UHFFFAOYSA-N 1 2 244.294 2.285 20 0 BEADLO CCC[C@H](C)C(=O)NCc1c[nH+]ccc1OC ZINC000293249625 386794614 /nfs/dbraw/zinc/79/46/14/386794614.db2.gz DXVPGUPPBKQWDL-JTQLQIEISA-N 1 2 236.315 2.143 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nnc(-c3ccco3)o2)[C@H]1C ZINC000293043553 386770734 /nfs/dbraw/zinc/77/07/34/386770734.db2.gz QXOBHCAZMNJYKH-BDAKNGLRSA-N 1 2 233.271 2.170 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nnc(-c3ccco3)o2)[C@H]1C ZINC000293043553 386770738 /nfs/dbraw/zinc/77/07/38/386770738.db2.gz QXOBHCAZMNJYKH-BDAKNGLRSA-N 1 2 233.271 2.170 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)C[C@@H]1CCC(=O)[C@H]1C ZINC000280104809 386777695 /nfs/dbraw/zinc/77/76/95/386777695.db2.gz CGUBLMPTIJBZDF-QWRGUYRKSA-N 1 2 246.310 2.334 20 0 BEADLO Cc1cnc(C[NH+]2CC3(C2)CCCOC3)s1 ZINC000334638341 386779046 /nfs/dbraw/zinc/77/90/46/386779046.db2.gz WDLRLHHBYYPANO-UHFFFAOYSA-N 1 2 238.356 2.064 20 0 BEADLO C[C@@H]([NH2+]CC(F)(F)CN)[C@H](C)c1ccccc1 ZINC000414933424 386783026 /nfs/dbraw/zinc/78/30/26/386783026.db2.gz UDSUBCUZMOAQTQ-WDEREUQCSA-N 1 2 242.313 2.362 20 0 BEADLO C[N@@H+](Cc1csc(Cl)n1)C[C@@H]1CCCO1 ZINC000290130554 386783246 /nfs/dbraw/zinc/78/32/46/386783246.db2.gz UYWUKWQVGIXHFB-VIFPVBQESA-N 1 2 246.763 2.407 20 0 BEADLO C[N@H+](Cc1csc(Cl)n1)C[C@@H]1CCCO1 ZINC000290130554 386783254 /nfs/dbraw/zinc/78/32/54/386783254.db2.gz UYWUKWQVGIXHFB-VIFPVBQESA-N 1 2 246.763 2.407 20 0 BEADLO CC[C@H](OC1CCCC1)c1nc(C[NH2+]C)no1 ZINC000414506466 386786669 /nfs/dbraw/zinc/78/66/69/386786669.db2.gz WNZAUPZMQCZTLO-JTQLQIEISA-N 1 2 239.319 2.199 20 0 BEADLO Cn1ccc(C[N@H+](C)Cc2ccccc2)n1 ZINC000269406479 386788199 /nfs/dbraw/zinc/78/81/99/386788199.db2.gz VYJNYLRSGQLKGI-UHFFFAOYSA-N 1 2 215.300 2.052 20 0 BEADLO Cn1ccc(C[N@@H+](C)Cc2ccccc2)n1 ZINC000269406479 386788205 /nfs/dbraw/zinc/78/82/05/386788205.db2.gz VYJNYLRSGQLKGI-UHFFFAOYSA-N 1 2 215.300 2.052 20 0 BEADLO CC(C)[C@@H]1CCCC[C@@H]1[NH2+]Cc1c[nH]nn1 ZINC000398367674 386816326 /nfs/dbraw/zinc/81/63/26/386816326.db2.gz BVBKXFBKLQYUPJ-RYUDHWBXSA-N 1 2 222.336 2.109 20 0 BEADLO CC(C)[C@@H]1CCCC[C@@H]1[NH2+]Cc1cn[nH]n1 ZINC000398367674 386816331 /nfs/dbraw/zinc/81/63/31/386816331.db2.gz BVBKXFBKLQYUPJ-RYUDHWBXSA-N 1 2 222.336 2.109 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)c1conc1C(C)C ZINC000528465917 386816448 /nfs/dbraw/zinc/81/64/48/386816448.db2.gz LPGCLNAZKSAOFJ-UHFFFAOYSA-N 1 2 245.282 2.176 20 0 BEADLO CCC[C@](C)(CC)C(=O)NCc1[nH]cc[nH+]1 ZINC000280558620 386820734 /nfs/dbraw/zinc/82/07/34/386820734.db2.gz QCGMVVHLYDPVKR-LBPRGKRZSA-N 1 2 223.320 2.242 20 0 BEADLO CCC[C@H]([NH2+][C@@H]1CSC[C@@H]1C)C(=O)OCC ZINC000336672953 386820906 /nfs/dbraw/zinc/82/09/06/386820906.db2.gz AXCZHLFQYPAXRL-GARJFASQSA-N 1 2 245.388 2.059 20 0 BEADLO CC[C@@H](NC(=O)[C@@H](C)C(C)C)c1[nH]cc[nH+]1 ZINC000125334952 386797628 /nfs/dbraw/zinc/79/76/28/386797628.db2.gz SBEDEXCHEDKIOQ-VHSXEESVSA-N 1 2 223.320 2.269 20 0 BEADLO CC[C@H](NC(=O)[C@H](C)C(C)C)c1[nH]cc[nH+]1 ZINC000125335125 386797718 /nfs/dbraw/zinc/79/77/18/386797718.db2.gz SBEDEXCHEDKIOQ-ZJUUUORDSA-N 1 2 223.320 2.269 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@@H+]1C[C@H](C)[C@H]1C ZINC000293284206 386797883 /nfs/dbraw/zinc/79/78/83/386797883.db2.gz CRZZNQMPHDUCEK-NGZCFLSTSA-N 1 2 239.340 2.302 20 0 BEADLO COC(=O)[C@H](c1ccsc1)[N@H+]1C[C@H](C)[C@H]1C ZINC000293284206 386797885 /nfs/dbraw/zinc/79/78/85/386797885.db2.gz CRZZNQMPHDUCEK-NGZCFLSTSA-N 1 2 239.340 2.302 20 0 BEADLO CC(C)[C@@H]1C[C@H]1C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000357577769 386808732 /nfs/dbraw/zinc/80/87/32/386808732.db2.gz DUEAKSSIXDEMER-TUAOUCFPSA-N 1 2 247.342 2.365 20 0 BEADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2cccnc2)[nH]1 ZINC000293369894 386809748 /nfs/dbraw/zinc/80/97/48/386809748.db2.gz YZORIERAZIINIQ-JTQLQIEISA-N 1 2 245.330 2.174 20 0 BEADLO CC(C)c1nnc(C[NH2+][C@H](C)c2cccnc2)[nH]1 ZINC000293369901 386809786 /nfs/dbraw/zinc/80/97/86/386809786.db2.gz YZORIERAZIINIQ-SNVBAGLBSA-N 1 2 245.330 2.174 20 0 BEADLO CC(=O)CC[N@@H+](C)Cc1c(F)cccc1F ZINC000293409677 386811806 /nfs/dbraw/zinc/81/18/06/386811806.db2.gz MKHIFBJDPZDHAN-UHFFFAOYSA-N 1 2 227.254 2.376 20 0 BEADLO CC(=O)CC[N@H+](C)Cc1c(F)cccc1F ZINC000293409677 386811811 /nfs/dbraw/zinc/81/18/11/386811811.db2.gz MKHIFBJDPZDHAN-UHFFFAOYSA-N 1 2 227.254 2.376 20 0 BEADLO CC/C=C\C[NH2+][C@@H](CCCC)C(=O)OC ZINC000395047535 386813782 /nfs/dbraw/zinc/81/37/82/386813782.db2.gz LIYQLURCWQODMF-JYKYSHPRSA-N 1 2 213.321 2.274 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1cc(C)sc1C ZINC000280439013 386814211 /nfs/dbraw/zinc/81/42/11/386814211.db2.gz CLAKXEHUGHLUOO-VIFPVBQESA-N 1 2 241.356 2.358 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1cc(C)sc1C ZINC000280439013 386814216 /nfs/dbraw/zinc/81/42/16/386814216.db2.gz CLAKXEHUGHLUOO-VIFPVBQESA-N 1 2 241.356 2.358 20 0 BEADLO Cc1cc(-n2cc[nH+]c2)nc(-c2cccnc2)n1 ZINC000301075444 386815925 /nfs/dbraw/zinc/81/59/25/386815925.db2.gz BIMOCDABFGCZSV-UHFFFAOYSA-N 1 2 237.266 2.033 20 0 BEADLO C[C@@H](CC(C)(C)C)C(=O)Nc1cc[nH+]cc1O ZINC000357675242 386825216 /nfs/dbraw/zinc/82/52/16/386825216.db2.gz PWSZDKOXCQVGRX-VIFPVBQESA-N 1 2 236.315 2.220 20 0 BEADLO CSCCC[N@H+](C)[C@H](C)c1csnn1 ZINC000450902020 386826056 /nfs/dbraw/zinc/82/60/56/386826056.db2.gz KKDPWZHLUFWVEF-MRVPVSSYSA-N 1 2 231.390 2.284 20 0 BEADLO CSCCC[N@@H+](C)[C@H](C)c1csnn1 ZINC000450902020 386826061 /nfs/dbraw/zinc/82/60/61/386826061.db2.gz KKDPWZHLUFWVEF-MRVPVSSYSA-N 1 2 231.390 2.284 20 0 BEADLO CC(C)c1nc(NC[C@@H]2CCCOC2)cc[nH+]1 ZINC000301246393 386828565 /nfs/dbraw/zinc/82/85/65/386828565.db2.gz ODBAIDAJVSEEMS-NSHDSACASA-N 1 2 235.331 2.439 20 0 BEADLO COC[C@H]([NH2+]Cc1cnns1)c1ccccc1 ZINC000290145460 386829297 /nfs/dbraw/zinc/82/92/97/386829297.db2.gz WEUIADLKYOHATD-LBPRGKRZSA-N 1 2 249.339 2.015 20 0 BEADLO Cc1cc(CNC(=O)NC(C)(C)C)cc(C)[nH+]1 ZINC000334776639 386829317 /nfs/dbraw/zinc/82/93/17/386829317.db2.gz JKLOIBKCEYVXPP-UHFFFAOYSA-N 1 2 235.331 2.296 20 0 BEADLO FCC[NH2+]Cc1ncc(C(F)(F)F)s1 ZINC000280642193 386832403 /nfs/dbraw/zinc/83/24/03/386832403.db2.gz IPMCRTNGJKRFQV-UHFFFAOYSA-N 1 2 228.214 2.221 20 0 BEADLO COC[C@@H](C)Nc1nc(C)[nH+]c2c1CCCC2 ZINC000301553356 386853411 /nfs/dbraw/zinc/85/34/11/386853411.db2.gz HVTGNLACKQRSPU-SECBINFHSA-N 1 2 235.331 2.111 20 0 BEADLO CC(C)[C@H]1C[N@H+](Cc2ccc(F)cn2)CCO1 ZINC000334784373 386842433 /nfs/dbraw/zinc/84/24/33/386842433.db2.gz KFUYSQRQOBBFIF-CYBMUJFWSA-N 1 2 238.306 2.078 20 0 BEADLO CC(C)[C@H]1C[N@@H+](Cc2ccc(F)cn2)CCO1 ZINC000334784373 386842439 /nfs/dbraw/zinc/84/24/39/386842439.db2.gz KFUYSQRQOBBFIF-CYBMUJFWSA-N 1 2 238.306 2.078 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1c(F)cc(C)cc1F ZINC000425340925 386843238 /nfs/dbraw/zinc/84/32/38/386843238.db2.gz BXKRYKRXNGFEAK-SNVBAGLBSA-N 1 2 241.281 2.494 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1c(F)cc(C)cc1F ZINC000425340925 386843245 /nfs/dbraw/zinc/84/32/45/386843245.db2.gz BXKRYKRXNGFEAK-SNVBAGLBSA-N 1 2 241.281 2.494 20 0 BEADLO Cc1[nH]c2nc[nH+]c(S[C@@H](C)CO)c2c1C ZINC000645181566 386844317 /nfs/dbraw/zinc/84/43/17/386844317.db2.gz LCSVZLAWQHLRGT-LURJTMIESA-N 1 2 237.328 2.048 20 0 BEADLO C[C@@H](CO)[C@@H](C)Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000301556926 386855281 /nfs/dbraw/zinc/85/52/81/386855281.db2.gz HMVPZKMPTURRBG-VHSXEESVSA-N 1 2 237.347 2.203 20 0 BEADLO C[C@H](CCO)CNc1cc[nH+]c(C(C)(C)C)n1 ZINC000301564511 386855418 /nfs/dbraw/zinc/85/54/18/386855418.db2.gz JGAYSXGZSFCIPL-SNVBAGLBSA-N 1 2 237.347 2.205 20 0 BEADLO CCOC1(C)CN(c2[nH]c3ccccc3[nH+]2)C1 ZINC000334793776 386861016 /nfs/dbraw/zinc/86/10/16/386861016.db2.gz TWRJUOYDTNDBJN-UHFFFAOYSA-N 1 2 231.299 2.178 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1C[C@]1(C)CC ZINC000341264404 386870635 /nfs/dbraw/zinc/87/06/35/386870635.db2.gz ARIJOHAAWLMPIS-FZMZJTMJSA-N 1 2 232.327 2.441 20 0 BEADLO CCC1(CNC(=O)C(C)(C)c2c[nH]c[nH+]2)CCC1 ZINC000331614029 386875056 /nfs/dbraw/zinc/87/50/56/386875056.db2.gz PXMNOIOQNILKBF-UHFFFAOYSA-N 1 2 249.358 2.384 20 0 BEADLO CCc1ncc(C[N@@H+]2CCC[C@](C)(F)C2)cn1 ZINC000334835188 386875663 /nfs/dbraw/zinc/87/56/63/386875663.db2.gz GVOYYKJUBWWKIZ-ZDUSSCGKSA-N 1 2 237.322 2.363 20 0 BEADLO CCc1ncc(C[N@H+]2CCC[C@](C)(F)C2)cn1 ZINC000334835188 386875665 /nfs/dbraw/zinc/87/56/65/386875665.db2.gz GVOYYKJUBWWKIZ-ZDUSSCGKSA-N 1 2 237.322 2.363 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N1CC2(C1)CCCCC2 ZINC000293774457 386876776 /nfs/dbraw/zinc/87/67/76/386876776.db2.gz BDIPVTHXRVZDAK-UHFFFAOYSA-N 1 2 247.342 2.053 20 0 BEADLO CC[C@H](Cc1ccccc1)[NH2+]CC(F)(F)CN ZINC000414940370 386879602 /nfs/dbraw/zinc/87/96/02/386879602.db2.gz ZUULPMCRPLDCCG-GFCCVEGCSA-N 1 2 242.313 2.191 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)c1coc(C)c1 ZINC000456364961 386882381 /nfs/dbraw/zinc/88/23/81/386882381.db2.gz VNKIUQIUZIDMQS-SNVBAGLBSA-N 1 2 247.298 2.295 20 0 BEADLO Cc1cc(C[N@@H+](C)[C@@H](C)c2ccncc2)n(C)n1 ZINC000418009045 386885454 /nfs/dbraw/zinc/88/54/54/386885454.db2.gz RSIXMACKHBPUCY-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cc(C[N@H+](C)[C@@H](C)c2ccncc2)n(C)n1 ZINC000418009045 386885459 /nfs/dbraw/zinc/88/54/59/386885459.db2.gz RSIXMACKHBPUCY-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1cncc(NCCCNc2cccc[nH+]2)n1 ZINC000358249872 386918927 /nfs/dbraw/zinc/91/89/27/386918927.db2.gz WALBYOZSEYZLDH-UHFFFAOYSA-N 1 2 243.314 2.094 20 0 BEADLO CC(C)c1nc(N(C)C)nc(NCCC2CC2)[nH+]1 ZINC000302001104 386897200 /nfs/dbraw/zinc/89/72/00/386897200.db2.gz QHTLUCXQXLXSGX-UHFFFAOYSA-N 1 2 249.362 2.273 20 0 BEADLO CC(C)c1nc(NCCC2CC2)nc(N(C)C)[nH+]1 ZINC000302001104 386897207 /nfs/dbraw/zinc/89/72/07/386897207.db2.gz QHTLUCXQXLXSGX-UHFFFAOYSA-N 1 2 249.362 2.273 20 0 BEADLO Cc1cncc(NCc2[nH+]ccn2CC(C)C)n1 ZINC000302107541 386903832 /nfs/dbraw/zinc/90/38/32/386903832.db2.gz ODQIZQMJURNWQJ-UHFFFAOYSA-N 1 2 245.330 2.250 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)Nc1cccc(C)c1 ZINC000335765462 386906638 /nfs/dbraw/zinc/90/66/38/386906638.db2.gz RYVQHIHVNGTFLT-UHFFFAOYSA-N 1 2 229.283 2.208 20 0 BEADLO Cc1cccn2cc(C[S@@](=O)C3CCC3)[nH+]c12 ZINC000334855591 386907110 /nfs/dbraw/zinc/90/71/10/386907110.db2.gz JCYBQIJMHRMMCF-QGZVFWFLSA-N 1 2 248.351 2.444 20 0 BEADLO Cc1c[nH+]c(CNc2cn(C)nc2C(C)C)n1C ZINC000341408943 386908212 /nfs/dbraw/zinc/90/82/12/386908212.db2.gz RMHXHVLEQBHTAA-UHFFFAOYSA-N 1 2 247.346 2.198 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@H]1CC=CCC1 ZINC000456396415 386909175 /nfs/dbraw/zinc/90/91/75/386909175.db2.gz SISKDJORVULQDX-RYUDHWBXSA-N 1 2 247.342 2.437 20 0 BEADLO COc1cc(C)[nH+]c(CSc2cccnn2)c1 ZINC000358262417 386924231 /nfs/dbraw/zinc/92/42/31/386924231.db2.gz KYEZLNVOAIAVLB-UHFFFAOYSA-N 1 2 247.323 2.481 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC000335774388 386924390 /nfs/dbraw/zinc/92/43/90/386924390.db2.gz MGPXQDFRFOZYAO-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCC[C@H]1c1cccnc1 ZINC000335774388 386924394 /nfs/dbraw/zinc/92/43/94/386924394.db2.gz MGPXQDFRFOZYAO-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO CO[C@H]1CC[C@@H](Nc2cc[nH+]c(C3CC3)n2)C1 ZINC000302750100 386934327 /nfs/dbraw/zinc/93/43/27/386934327.db2.gz GRQGDPWUDBVZKK-MNOVXSKESA-N 1 2 233.315 2.333 20 0 BEADLO Cc1cn[nH]c1C[NH2+][C@@H]1COc2ccc(C)cc21 ZINC000368073067 386936150 /nfs/dbraw/zinc/93/61/50/386936150.db2.gz QQVDHJUWGIVMGU-CYBMUJFWSA-N 1 2 243.310 2.250 20 0 BEADLO Cc1c[nH]nc1C[NH2+][C@@H]1COc2ccc(C)cc21 ZINC000368073067 386936159 /nfs/dbraw/zinc/93/61/59/386936159.db2.gz QQVDHJUWGIVMGU-CYBMUJFWSA-N 1 2 243.310 2.250 20 0 BEADLO Cc1ccc([C@H](C)[N@H+](C)Cc2cn(C)nn2)cc1 ZINC000341616677 386936132 /nfs/dbraw/zinc/93/61/32/386936132.db2.gz NNDOOIVJOWCMPR-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2cn(C)nn2)cc1 ZINC000341616677 386936139 /nfs/dbraw/zinc/93/61/39/386936139.db2.gz NNDOOIVJOWCMPR-LBPRGKRZSA-N 1 2 244.342 2.317 20 0 BEADLO CC(C)Cn1nccc1C[N@H+](C)Cc1ccc[nH]1 ZINC000648012517 386943130 /nfs/dbraw/zinc/94/31/30/386943130.db2.gz IYRCDZCHMMYMKQ-UHFFFAOYSA-N 1 2 246.358 2.499 20 0 BEADLO CC(C)Cn1nccc1C[N@@H+](C)Cc1ccc[nH]1 ZINC000648012517 386943132 /nfs/dbraw/zinc/94/31/32/386943132.db2.gz IYRCDZCHMMYMKQ-UHFFFAOYSA-N 1 2 246.358 2.499 20 0 BEADLO C[C@@H](C(=O)N[C@@H](c1[nH+]ccn1C)C1CC1)C1CC1 ZINC000341702566 386953266 /nfs/dbraw/zinc/95/32/66/386953266.db2.gz DQMBBMUMBRGUSR-BXKDBHETSA-N 1 2 247.342 2.034 20 0 BEADLO C[C@H](C(=O)N[C@@H](c1[nH+]ccn1C)C1CC1)C1CC1 ZINC000341702571 386953345 /nfs/dbraw/zinc/95/33/45/386953345.db2.gz DQMBBMUMBRGUSR-JOYOIKCWSA-N 1 2 247.342 2.034 20 0 BEADLO C[C@@H](C(=O)N[C@H](c1[nH+]ccn1C)C1CC1)C1CC1 ZINC000341702573 386953489 /nfs/dbraw/zinc/95/34/89/386953489.db2.gz DQMBBMUMBRGUSR-SKDRFNHKSA-N 1 2 247.342 2.034 20 0 BEADLO CCn1cc(C[N@H+](C)C/C=C(\C)Cl)cn1 ZINC000528384856 386954248 /nfs/dbraw/zinc/95/42/48/386954248.db2.gz XWGXBAGGKFPNTM-BJMVGYQFSA-N 1 2 227.739 2.477 20 0 BEADLO CCn1cc(C[N@@H+](C)C/C=C(\C)Cl)cn1 ZINC000528384856 386954254 /nfs/dbraw/zinc/95/42/54/386954254.db2.gz XWGXBAGGKFPNTM-BJMVGYQFSA-N 1 2 227.739 2.477 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ccccc1F)c1ncnn1C ZINC000352900510 386954451 /nfs/dbraw/zinc/95/44/51/386954451.db2.gz JLYZANGILBGZOB-UWVGGRQHSA-N 1 2 248.305 2.366 20 0 BEADLO CCC[C@H](C)C(=O)N[C@H](c1[nH+]ccn1C)C1CC1 ZINC000341714878 386954455 /nfs/dbraw/zinc/95/44/55/386954455.db2.gz RRWOVZXPRFPYTE-JQWIXIFHSA-N 1 2 249.358 2.424 20 0 BEADLO CC[C@@H](C)C(=O)N[C@@H](c1[nH+]ccn1C)C1CC1 ZINC000341710104 386954699 /nfs/dbraw/zinc/95/46/99/386954699.db2.gz VVAPSQAHMWYSKZ-MWLCHTKSSA-N 1 2 235.331 2.034 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+][C@]12CC[C@H](C)[C@@H](C)C2 ZINC000639426714 386961510 /nfs/dbraw/zinc/96/15/10/386961510.db2.gz HRVRSMOYNMRFOT-COPLHBTASA-N 1 2 238.375 2.369 20 0 BEADLO CO[C@H](C(=O)Nc1c(C)cc[nH+]c1C)C1CC1 ZINC000332180527 386965830 /nfs/dbraw/zinc/96/58/30/386965830.db2.gz WKQFGEXQRCNYRC-LBPRGKRZSA-N 1 2 234.299 2.062 20 0 BEADLO Cc1nnc(C[N@@H+](C(C)C)C2CC2)s1 ZINC000358500276 386966002 /nfs/dbraw/zinc/96/60/02/386966002.db2.gz PVQMYHQAYKPFMR-UHFFFAOYSA-N 1 2 211.334 2.219 20 0 BEADLO Cc1nnc(C[N@H+](C(C)C)C2CC2)s1 ZINC000358500276 386966004 /nfs/dbraw/zinc/96/60/04/386966004.db2.gz PVQMYHQAYKPFMR-UHFFFAOYSA-N 1 2 211.334 2.219 20 0 BEADLO Cc1ccnc(C[NH2+][C@H](C)c2cccc(O)c2)n1 ZINC000341811931 386974854 /nfs/dbraw/zinc/97/48/54/386974854.db2.gz YOWAEYCCTGLWJI-LLVKDONJSA-N 1 2 243.310 2.341 20 0 BEADLO c1snnc1C[NH+]1CCC(C2CC2)CC1 ZINC000368638123 386995349 /nfs/dbraw/zinc/99/53/49/386995349.db2.gz MJTQEXQNFIYVBS-UHFFFAOYSA-N 1 2 223.345 2.160 20 0 BEADLO c1c2ccccc2oc1C[N@@H+]1CCO[C@H]2C[C@H]21 ZINC000368633695 386995804 /nfs/dbraw/zinc/99/58/04/386995804.db2.gz BUUZWAGHAAIWBG-OCCSQVGLSA-N 1 2 229.279 2.406 20 0 BEADLO c1c2ccccc2oc1C[N@H+]1CCO[C@H]2C[C@H]21 ZINC000368633695 386995809 /nfs/dbraw/zinc/99/58/09/386995809.db2.gz BUUZWAGHAAIWBG-OCCSQVGLSA-N 1 2 229.279 2.406 20 0 BEADLO c1c2ccccc2oc1C[N@@H+]1CCO[C@@H]2C[C@@H]21 ZINC000368633693 386996216 /nfs/dbraw/zinc/99/62/16/386996216.db2.gz BUUZWAGHAAIWBG-GXTWGEPZSA-N 1 2 229.279 2.406 20 0 BEADLO c1c2ccccc2oc1C[N@H+]1CCO[C@@H]2C[C@@H]21 ZINC000368633693 386996220 /nfs/dbraw/zinc/99/62/20/386996220.db2.gz BUUZWAGHAAIWBG-GXTWGEPZSA-N 1 2 229.279 2.406 20 0 BEADLO C[C@@H]1CN(C(=O)CCn2cc[nH+]c2)CC(C)(C)C1 ZINC000334929040 387004678 /nfs/dbraw/zinc/00/46/78/387004678.db2.gz FHWKXQXFELMGLO-LBPRGKRZSA-N 1 2 249.358 2.168 20 0 BEADLO CCc1cc(C[NH2+][C@H](C)c2nccnc2C)on1 ZINC000527348328 387050162 /nfs/dbraw/zinc/05/01/62/387050162.db2.gz VQOGMIPZTGDEJK-SNVBAGLBSA-N 1 2 246.314 2.186 20 0 BEADLO CC1(C)CC[C@H](C(=O)NCCCn2cc[nH+]c2)C1 ZINC000359067892 387051734 /nfs/dbraw/zinc/05/17/34/387051734.db2.gz VEMLVGHRQFKZTP-LBPRGKRZSA-N 1 2 249.358 2.216 20 0 BEADLO Cc1ccnc(N[C@H]2C[C@@H](C)n3cc[nH+]c32)n1 ZINC000333760606 387053682 /nfs/dbraw/zinc/05/36/82/387053682.db2.gz ZRMKPOKNXHJLFI-ZJUUUORDSA-N 1 2 229.287 2.099 20 0 BEADLO Cc1ccnc(N[C@H]2C[C@H](C)n3cc[nH+]c32)n1 ZINC000333760604 387054314 /nfs/dbraw/zinc/05/43/14/387054314.db2.gz ZRMKPOKNXHJLFI-UWVGGRQHSA-N 1 2 229.287 2.099 20 0 BEADLO Cc1c[nH+]cc(NCc2cccc(C(N)=O)c2)c1 ZINC000227603466 387055925 /nfs/dbraw/zinc/05/59/25/387055925.db2.gz CBLOSDPNVOLGDG-UHFFFAOYSA-N 1 2 241.294 2.101 20 0 BEADLO COC(=O)[C@H]([NH2+]C[C@@H](C)c1ccccc1)C1CC1 ZINC000227767550 387058710 /nfs/dbraw/zinc/05/87/10/387058710.db2.gz SDENMVSLCUULOD-BXUZGUMPSA-N 1 2 247.338 2.331 20 0 BEADLO Cc1cc(N(C)Cc2ccsc2)nc[nH+]1 ZINC000110117575 387060177 /nfs/dbraw/zinc/06/01/77/387060177.db2.gz SUNRJYXHNMVVQT-UHFFFAOYSA-N 1 2 219.313 2.483 20 0 BEADLO CCc1ccc(C[N@@H+]2CCOCC2(C)C)nc1 ZINC000334978783 387064476 /nfs/dbraw/zinc/06/44/76/387064476.db2.gz OLMWFUYFBSZIHE-UHFFFAOYSA-N 1 2 234.343 2.255 20 0 BEADLO CCc1ccc(C[N@H+]2CCOCC2(C)C)nc1 ZINC000334978783 387064480 /nfs/dbraw/zinc/06/44/80/387064480.db2.gz OLMWFUYFBSZIHE-UHFFFAOYSA-N 1 2 234.343 2.255 20 0 BEADLO Cc1ccc(N[C@H]2CCOC[C@H]2C)c[nH+]1 ZINC000192631515 387029818 /nfs/dbraw/zinc/02/98/18/387029818.db2.gz WUPINFZODLKAKR-SKDRFNHKSA-N 1 2 206.289 2.227 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CC[C@@H]1C(C)C ZINC000334981863 387070663 /nfs/dbraw/zinc/07/06/63/387070663.db2.gz RMCMOKUXNULWRG-GFCCVEGCSA-N 1 2 233.315 2.074 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)[C@@]1(C)CC=CCC1 ZINC000336236332 387073079 /nfs/dbraw/zinc/07/30/79/387073079.db2.gz DHBDNWWWZGUSEP-AWEZNQCLSA-N 1 2 247.342 2.125 20 0 BEADLO c1cn(-c2nc(C3CCCC3)ns2)c[nH+]1 ZINC000334986394 387074166 /nfs/dbraw/zinc/07/41/66/387074166.db2.gz PVJDDBGCDIPEBP-UHFFFAOYSA-N 1 2 220.301 2.381 20 0 BEADLO CCn1cncc1C[N@H+](C)Cc1cnccc1C ZINC000418048324 387075642 /nfs/dbraw/zinc/07/56/42/387075642.db2.gz RRWDKTKTWREDDX-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1cncc1C[N@@H+](C)Cc1cnccc1C ZINC000418048324 387075645 /nfs/dbraw/zinc/07/56/45/387075645.db2.gz RRWDKTKTWREDDX-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCn1c[nH+]cc1CN(C)Cc1cnccc1C ZINC000418048324 387075648 /nfs/dbraw/zinc/07/56/48/387075648.db2.gz RRWDKTKTWREDDX-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CCOc1ccccc1CN(C)Cc1[nH]cc[nH+]1 ZINC000114725033 387075631 /nfs/dbraw/zinc/07/56/31/387075631.db2.gz QJGKKIKJIUYKAE-UHFFFAOYSA-N 1 2 245.326 2.440 20 0 BEADLO Cc1sccc1C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000336245524 387080944 /nfs/dbraw/zinc/08/09/44/387080944.db2.gz KDZCMRXDAODVPJ-UHFFFAOYSA-N 1 2 235.312 2.052 20 0 BEADLO CCc1nc(C[NH+]2[C@H](C)CCC[C@H]2C)no1 ZINC000066665444 387088671 /nfs/dbraw/zinc/08/86/71/387088671.db2.gz DADBCUDNYMLVKZ-NXEZZACHSA-N 1 2 223.320 2.395 20 0 BEADLO F[C@H]1CC[N@H+](Cc2nc3ccccc3o2)C1 ZINC000336259453 387088880 /nfs/dbraw/zinc/08/88/80/387088880.db2.gz BWILOKCVENNFFW-VIFPVBQESA-N 1 2 220.247 2.372 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2nc3ccccc3o2)C1 ZINC000336259453 387088886 /nfs/dbraw/zinc/08/88/86/387088886.db2.gz BWILOKCVENNFFW-VIFPVBQESA-N 1 2 220.247 2.372 20 0 BEADLO C[C@H](C(=O)Nc1ccccc1)[N@@H+]1CC[C@@H](F)C1 ZINC000336259613 387089943 /nfs/dbraw/zinc/08/99/43/387089943.db2.gz OSJPRSWSKOCETO-GHMZBOCLSA-N 1 2 236.290 2.057 20 0 BEADLO C[C@H](C(=O)Nc1ccccc1)[N@H+]1CC[C@@H](F)C1 ZINC000336259613 387089947 /nfs/dbraw/zinc/08/99/47/387089947.db2.gz OSJPRSWSKOCETO-GHMZBOCLSA-N 1 2 236.290 2.057 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@@H]1CCCC[C@H]1C ZINC000424860793 387092961 /nfs/dbraw/zinc/09/29/61/387092961.db2.gz FLNPRJANFLZOIR-VXGBXAGGSA-N 1 2 249.358 2.346 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2ccc(Cl)cn2)C1 ZINC000336262893 387097822 /nfs/dbraw/zinc/09/78/22/387097822.db2.gz HTIDXGWIUKBFAC-SECBINFHSA-N 1 2 214.671 2.279 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2ccc(Cl)cn2)C1 ZINC000336262893 387097832 /nfs/dbraw/zinc/09/78/32/387097832.db2.gz HTIDXGWIUKBFAC-SECBINFHSA-N 1 2 214.671 2.279 20 0 BEADLO CCOC(=O)CSCc1ccc(C)[nH+]c1C ZINC000186360806 387100497 /nfs/dbraw/zinc/10/04/97/387100497.db2.gz YWPMXAPKYMWIAI-UHFFFAOYSA-N 1 2 239.340 2.495 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CCC[C@@](C)(F)C2)o1 ZINC000336268648 387101067 /nfs/dbraw/zinc/10/10/67/387101067.db2.gz ATPJPDMUZRBRDJ-LDYMZIIASA-N 1 2 227.283 2.263 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CCC[C@@](C)(F)C2)o1 ZINC000336268648 387101069 /nfs/dbraw/zinc/10/10/69/387101069.db2.gz ATPJPDMUZRBRDJ-LDYMZIIASA-N 1 2 227.283 2.263 20 0 BEADLO CC(C)c1nc(N2C[C@@H](F)[C@@H](F)C2)cc[nH+]1 ZINC000336267876 387101393 /nfs/dbraw/zinc/10/13/93/387101393.db2.gz BUMOTGWHFWQFMM-DTORHVGOSA-N 1 2 227.258 2.096 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@@H](C)CC2)no1 ZINC000068855686 387108092 /nfs/dbraw/zinc/10/80/92/387108092.db2.gz NRLNVUAFVCKXSO-SNVBAGLBSA-N 1 2 223.320 2.254 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@@H](C)CC2)no1 ZINC000068855686 387108097 /nfs/dbraw/zinc/10/80/97/387108097.db2.gz NRLNVUAFVCKXSO-SNVBAGLBSA-N 1 2 223.320 2.254 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)[C@@H]1CCCC1(C)C ZINC000228905949 387127220 /nfs/dbraw/zinc/12/72/20/387127220.db2.gz BSGNYVZTNSLSHH-JTQLQIEISA-N 1 2 235.331 2.194 20 0 BEADLO Fc1ccc(C[NH+]2CC3(C2)CCOC3)c(F)c1 ZINC000336316106 387141691 /nfs/dbraw/zinc/14/16/91/387141691.db2.gz LPZORSHVCLFZAM-UHFFFAOYSA-N 1 2 239.265 2.187 20 0 BEADLO OCC[N@H+](CCC1CCCC1)CC(F)F ZINC000193415717 387143017 /nfs/dbraw/zinc/14/30/17/387143017.db2.gz RZADTBJFJMMQAY-UHFFFAOYSA-N 1 2 221.291 2.126 20 0 BEADLO OCC[N@@H+](CCC1CCCC1)CC(F)F ZINC000193415717 387143024 /nfs/dbraw/zinc/14/30/24/387143024.db2.gz RZADTBJFJMMQAY-UHFFFAOYSA-N 1 2 221.291 2.126 20 0 BEADLO Cc1cnc(CN2CCC[C@H]2c2[nH]cc[nH+]2)o1 ZINC000336360140 387193367 /nfs/dbraw/zinc/19/33/67/387193367.db2.gz HSNPXFKVGBTFMQ-JTQLQIEISA-N 1 2 232.287 2.043 20 0 BEADLO CC[C@H](F)C[N@@H+]1CCOC[C@H]1CC(F)F ZINC000353289343 387172723 /nfs/dbraw/zinc/17/27/23/387172723.db2.gz UCACLARGKDWXCB-DTWKUNHWSA-N 1 2 225.254 2.091 20 0 BEADLO CC[C@H](F)C[N@H+]1CCOC[C@H]1CC(F)F ZINC000353289343 387172726 /nfs/dbraw/zinc/17/27/26/387172726.db2.gz UCACLARGKDWXCB-DTWKUNHWSA-N 1 2 225.254 2.091 20 0 BEADLO COC(=O)[C@H](c1cccnc1)[N@H+](C)CC1CCC1 ZINC000120017539 387175325 /nfs/dbraw/zinc/17/53/25/387175325.db2.gz ZMBFAPSPFPWKDW-ZDUSSCGKSA-N 1 2 248.326 2.028 20 0 BEADLO COC(=O)[C@H](c1cccnc1)[N@@H+](C)CC1CCC1 ZINC000120017539 387175329 /nfs/dbraw/zinc/17/53/29/387175329.db2.gz ZMBFAPSPFPWKDW-ZDUSSCGKSA-N 1 2 248.326 2.028 20 0 BEADLO Cc1cnc(C[NH+]2CCC(C(F)F)CC2)o1 ZINC000336349874 387178109 /nfs/dbraw/zinc/17/81/09/387178109.db2.gz OZBZHOHRXNYFCI-UHFFFAOYSA-N 1 2 230.258 2.460 20 0 BEADLO Cc1ccc(C[S@](=O)CC2CC2)c(C)[nH+]1 ZINC000187229149 387181678 /nfs/dbraw/zinc/18/16/78/387181678.db2.gz LDIUYXJUACHJMC-OAHLLOKOSA-N 1 2 223.341 2.357 20 0 BEADLO [NH3+]CC(F)(F)CNC(C1CCC1)C1CCC1 ZINC000423340365 387189530 /nfs/dbraw/zinc/18/95/30/387189530.db2.gz JKZPXWGSDBNIEL-UHFFFAOYSA-N 1 2 232.318 2.139 20 0 BEADLO [NH3+]CC(F)(F)CN[C@@H](C1CC1)C1CCCC1 ZINC000423343590 387191869 /nfs/dbraw/zinc/19/18/69/387191869.db2.gz MBDDRCSSAYCKKC-LLVKDONJSA-N 1 2 232.318 2.139 20 0 BEADLO Cc1ccc(F)c(NC(=O)NCc2[nH]cc[nH+]2)c1 ZINC000119498084 387134456 /nfs/dbraw/zinc/13/44/56/387134456.db2.gz KYWJAMIKNKIFFA-UHFFFAOYSA-N 1 2 248.261 2.179 20 0 BEADLO CCCC(=O)NCc1cccc(-n2cc[nH+]c2)c1 ZINC000359995152 387208901 /nfs/dbraw/zinc/20/89/01/387208901.db2.gz XVYGOXDCERPJAA-UHFFFAOYSA-N 1 2 243.310 2.289 20 0 BEADLO CC(C)(C)c1nnc(C[NH+]2C3CCC2CC3)[nH]1 ZINC000571979060 387211568 /nfs/dbraw/zinc/21/15/68/387211568.db2.gz JLIBDUCHFYSZOO-UHFFFAOYSA-N 1 2 234.347 2.229 20 0 BEADLO CCO[C@H]1C[C@@H]1Nc1nc(C)[nH+]c2c1CCCC2 ZINC000571982894 387214358 /nfs/dbraw/zinc/21/43/58/387214358.db2.gz GRXVNLVIIICRLB-STQMWFEESA-N 1 2 247.342 2.253 20 0 BEADLO Cc1cc(C(=O)NCC(C)C)c2[nH+]ccn2c1 ZINC000623379398 387223877 /nfs/dbraw/zinc/22/38/77/387223877.db2.gz NVFFVLSYFLZFIX-UHFFFAOYSA-N 1 2 231.299 2.029 20 0 BEADLO Cn1ccnc1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC000336398011 387226914 /nfs/dbraw/zinc/22/69/14/387226914.db2.gz QTDHNVHJHIYHAE-CYBMUJFWSA-N 1 2 242.326 2.152 20 0 BEADLO Cn1ccnc1C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC000336398011 387226918 /nfs/dbraw/zinc/22/69/18/387226918.db2.gz QTDHNVHJHIYHAE-CYBMUJFWSA-N 1 2 242.326 2.152 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCC[C@@H]1c1nc(C)no1 ZINC000353549295 387228412 /nfs/dbraw/zinc/22/84/12/387228412.db2.gz JPTPMPZRYFSPDG-NXEZZACHSA-N 1 2 227.283 2.263 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCC[C@@H]1c1nc(C)no1 ZINC000353549295 387228415 /nfs/dbraw/zinc/22/84/15/387228415.db2.gz JPTPMPZRYFSPDG-NXEZZACHSA-N 1 2 227.283 2.263 20 0 BEADLO Cc1cc(C(=O)Nc2cc(C)[nH+]cc2C)ccn1 ZINC000572088395 387230327 /nfs/dbraw/zinc/23/03/27/387230327.db2.gz BWCWETLZQIWWEW-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO C[C@@H]1CCCC[C@@]1(C)NC(=O)Cc1c[nH+]cn1C ZINC000572095622 387234603 /nfs/dbraw/zinc/23/46/03/387234603.db2.gz KSKPVUMLTIUOFR-BXUZGUMPSA-N 1 2 249.358 2.048 20 0 BEADLO CC(C)(C)C[N@@H+]1CCn2c(nnc2C2CC2)C1 ZINC000371380371 387200865 /nfs/dbraw/zinc/20/08/65/387200865.db2.gz APYOWYBCEHZAED-UHFFFAOYSA-N 1 2 234.347 2.017 20 0 BEADLO CC(C)(C)C[N@H+]1CCn2c(nnc2C2CC2)C1 ZINC000371380371 387200868 /nfs/dbraw/zinc/20/08/68/387200868.db2.gz APYOWYBCEHZAED-UHFFFAOYSA-N 1 2 234.347 2.017 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NCc1ccco1 ZINC000120768651 387269119 /nfs/dbraw/zinc/26/91/19/387269119.db2.gz QYOCAVKDXOTBJK-UHFFFAOYSA-N 1 2 231.255 2.305 20 0 BEADLO Cc1[nH]c(C(=O)NC2[C@@H](C)CCC[C@@H]2C)c[nH+]1 ZINC000267159260 387277925 /nfs/dbraw/zinc/27/79/25/387277925.db2.gz YOBSJUZVLCTKED-IUCAKERBSA-N 1 2 235.331 2.273 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2ccc(F)c(C)c2)[nH]1 ZINC000353856436 387284543 /nfs/dbraw/zinc/28/45/43/387284543.db2.gz BICDRGAPIHXVNZ-UHFFFAOYSA-N 1 2 248.305 2.193 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2ccc(F)c(C)c2)[nH]1 ZINC000353856436 387284550 /nfs/dbraw/zinc/28/45/50/387284550.db2.gz BICDRGAPIHXVNZ-UHFFFAOYSA-N 1 2 248.305 2.193 20 0 BEADLO CCC(=O)CCC[N@H+](C)[C@@H](C)c1nc(C)no1 ZINC000572254818 387287945 /nfs/dbraw/zinc/28/79/45/387287945.db2.gz ZYUJNEFCHSJPSE-VIFPVBQESA-N 1 2 239.319 2.130 20 0 BEADLO CCC(=O)CCC[N@@H+](C)[C@@H](C)c1nc(C)no1 ZINC000572254818 387287947 /nfs/dbraw/zinc/28/79/47/387287947.db2.gz ZYUJNEFCHSJPSE-VIFPVBQESA-N 1 2 239.319 2.130 20 0 BEADLO CC(C)c1nc(C[N@@H+]2CC[C@@H](C3CC3)C2)no1 ZINC000372338477 387291691 /nfs/dbraw/zinc/29/16/91/387291691.db2.gz IYSGYRSGADNCKV-LLVKDONJSA-N 1 2 235.331 2.425 20 0 BEADLO CC(C)c1nc(C[N@H+]2CC[C@@H](C3CC3)C2)no1 ZINC000372338477 387291693 /nfs/dbraw/zinc/29/16/93/387291693.db2.gz IYSGYRSGADNCKV-LLVKDONJSA-N 1 2 235.331 2.425 20 0 BEADLO C[C@@H]1CCC[C@H](CNC(=O)Cn2cc[nH+]c2)[C@H]1C ZINC000360470328 387292535 /nfs/dbraw/zinc/29/25/35/387292535.db2.gz SQEZKVKLWDUHED-FRRDWIJNSA-N 1 2 249.358 2.072 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CCO[C@@H](C2CC2)C1 ZINC000372471084 387305575 /nfs/dbraw/zinc/30/55/75/387305575.db2.gz HIAAXPRRNADVEH-CYBMUJFWSA-N 1 2 249.358 2.075 20 0 BEADLO CC(C)CC(=O)N1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000121171209 387307298 /nfs/dbraw/zinc/30/72/98/387307298.db2.gz FYNPZWSMCVTGMR-CYBMUJFWSA-N 1 2 248.326 2.107 20 0 BEADLO Cc1cccc(C[N@@H+]2CCO[C@H]3C[C@H]32)c1F ZINC000648592726 387363993 /nfs/dbraw/zinc/36/39/93/387363993.db2.gz WKTITKTYPCEBMF-NEPJUHHUSA-N 1 2 221.275 2.107 20 0 BEADLO Cc1cccc(C[N@H+]2CCO[C@H]3C[C@H]32)c1F ZINC000648592726 387363995 /nfs/dbraw/zinc/36/39/95/387363995.db2.gz WKTITKTYPCEBMF-NEPJUHHUSA-N 1 2 221.275 2.107 20 0 BEADLO c1coc([C@@H]2C[N@H+](Cc3ccccn3)CCO2)c1 ZINC000121525649 387375701 /nfs/dbraw/zinc/37/57/01/387375701.db2.gz ZKODQZMUTRHMBG-AWEZNQCLSA-N 1 2 244.294 2.248 20 0 BEADLO c1coc([C@@H]2C[N@@H+](Cc3ccccn3)CCO2)c1 ZINC000121525649 387375705 /nfs/dbraw/zinc/37/57/05/387375705.db2.gz ZKODQZMUTRHMBG-AWEZNQCLSA-N 1 2 244.294 2.248 20 0 BEADLO Cc1c(Nc2nc(C)[nH+]c(C)c2C)cnn1C ZINC000354469519 387381503 /nfs/dbraw/zinc/38/15/03/387381503.db2.gz SOLAORZUKXHANN-UHFFFAOYSA-N 1 2 231.303 2.187 20 0 BEADLO CCCC(C)(C)NC(=O)[C@H]1CCc2[nH+]ccn2C1 ZINC000372712985 387321833 /nfs/dbraw/zinc/32/18/33/387321833.db2.gz IFTZYNVFPDELAA-NSHDSACASA-N 1 2 249.358 2.140 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC000336557983 387382552 /nfs/dbraw/zinc/38/25/52/387382552.db2.gz UBEPSQGQFGVSLV-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC000336557983 387382555 /nfs/dbraw/zinc/38/25/55/387382555.db2.gz UBEPSQGQFGVSLV-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cn1cc(C[N@@H+]2CC[C@@](C)(F)C2)c(C(F)F)n1 ZINC000336506236 387332464 /nfs/dbraw/zinc/33/24/64/387332464.db2.gz FEHILEJKTQTQDR-LLVKDONJSA-N 1 2 247.264 2.292 20 0 BEADLO Cn1cc(C[N@H+]2CC[C@@](C)(F)C2)c(C(F)F)n1 ZINC000336506236 387332467 /nfs/dbraw/zinc/33/24/67/387332467.db2.gz FEHILEJKTQTQDR-LLVKDONJSA-N 1 2 247.264 2.292 20 0 BEADLO Cc1oncc1C[N@@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000336511400 387336557 /nfs/dbraw/zinc/33/65/57/387336557.db2.gz POBSXGUXSFOTNO-ZDUSSCGKSA-N 1 2 246.314 2.433 20 0 BEADLO Cc1oncc1C[N@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000336511400 387336562 /nfs/dbraw/zinc/33/65/62/387336562.db2.gz POBSXGUXSFOTNO-ZDUSSCGKSA-N 1 2 246.314 2.433 20 0 BEADLO F[C@H]1CC[C@@H](Nc2cc[nH+]c3ccncc23)C1 ZINC000336514195 387337357 /nfs/dbraw/zinc/33/73/57/387337357.db2.gz WMVCERWUKGHHEN-VHSXEESVSA-N 1 2 231.274 2.354 20 0 BEADLO Cc1nc(NC2C[C@H](C)O[C@@H](C)C2)cc[nH+]1 ZINC000162288647 387337416 /nfs/dbraw/zinc/33/74/16/387337416.db2.gz KZPYJNCSWMSGCO-IUCAKERBSA-N 1 2 221.304 2.153 20 0 BEADLO CN(Cc1cn2c([nH+]1)CCCC2)CC(F)(F)F ZINC000372997662 387338318 /nfs/dbraw/zinc/33/83/18/387338318.db2.gz ODWFNOLGQJUHCN-UHFFFAOYSA-N 1 2 247.264 2.214 20 0 BEADLO Cc1c[nH]nc1C[N@@H+]1CCOC[C@@H]1CC1CCC1 ZINC000354734604 387424415 /nfs/dbraw/zinc/42/44/15/387424415.db2.gz QYYJAYDAKJBRDW-ZDUSSCGKSA-N 1 2 249.358 2.109 20 0 BEADLO Cc1c[nH]nc1C[N@H+]1CCOC[C@@H]1CC1CCC1 ZINC000354734604 387424418 /nfs/dbraw/zinc/42/44/18/387424418.db2.gz QYYJAYDAKJBRDW-ZDUSSCGKSA-N 1 2 249.358 2.109 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCOC[C@@H]1CC1CCC1 ZINC000354734604 387424424 /nfs/dbraw/zinc/42/44/24/387424424.db2.gz QYYJAYDAKJBRDW-ZDUSSCGKSA-N 1 2 249.358 2.109 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCOC[C@@H]1CC1CCC1 ZINC000354734604 387424429 /nfs/dbraw/zinc/42/44/29/387424429.db2.gz QYYJAYDAKJBRDW-ZDUSSCGKSA-N 1 2 249.358 2.109 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NCc1ccn(C)c1 ZINC000121869882 387424773 /nfs/dbraw/zinc/42/47/73/387424773.db2.gz IBKYTNPFNXFOQN-UHFFFAOYSA-N 1 2 244.298 2.050 20 0 BEADLO Cn1nccc1C[N@@H+]1CCC[C@@H]1c1nccs1 ZINC000374301959 387441208 /nfs/dbraw/zinc/44/12/08/387441208.db2.gz LYIDKCXKNVSYRD-LLVKDONJSA-N 1 2 248.355 2.214 20 0 BEADLO Cn1nccc1C[N@H+]1CCC[C@@H]1c1nccs1 ZINC000374301959 387441211 /nfs/dbraw/zinc/44/12/11/387441211.db2.gz LYIDKCXKNVSYRD-LLVKDONJSA-N 1 2 248.355 2.214 20 0 BEADLO CC/C=C(\C)C(=O)N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000374381083 387447254 /nfs/dbraw/zinc/44/72/54/387447254.db2.gz QRMXUBNAHLNOJU-JXDHDYMSSA-N 1 2 247.342 2.092 20 0 BEADLO CC/C=C(\C)C(=O)N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000374381082 387447287 /nfs/dbraw/zinc/44/72/87/387447287.db2.gz QRMXUBNAHLNOJU-JVOXIWMLSA-N 1 2 247.342 2.092 20 0 BEADLO Cc1cc(NC(=O)N2CC[C@H](C3CC3)C2)cc[nH+]1 ZINC000336614318 387455611 /nfs/dbraw/zinc/45/56/11/387455611.db2.gz UOJSZRQQNPCTON-LBPRGKRZSA-N 1 2 245.326 2.076 20 0 BEADLO Cc1cnc(C[N@@H+](C)Cc2cnccc2C)o1 ZINC000361408891 387456887 /nfs/dbraw/zinc/45/68/87/387456887.db2.gz DIMDXEMSKAJHPL-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cnc(C[N@H+](C)Cc2cnccc2C)o1 ZINC000361408891 387456890 /nfs/dbraw/zinc/45/68/90/387456890.db2.gz DIMDXEMSKAJHPL-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CC(C)n1nccc1C[N@@H+]1C[C@@H](C)OC[C@H]1C ZINC000336617993 387458366 /nfs/dbraw/zinc/45/83/66/387458366.db2.gz PCEBOLIUXLOJLX-VXGBXAGGSA-N 1 2 237.347 2.073 20 0 BEADLO CC(C)n1nccc1C[N@H+]1C[C@@H](C)OC[C@H]1C ZINC000336617993 387458372 /nfs/dbraw/zinc/45/83/72/387458372.db2.gz PCEBOLIUXLOJLX-VXGBXAGGSA-N 1 2 237.347 2.073 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](C)c2cncc(F)c2)nc1 ZINC000361131031 387404097 /nfs/dbraw/zinc/40/40/97/387404097.db2.gz HVMHDZJRYJDBKM-JTQLQIEISA-N 1 2 246.289 2.170 20 0 BEADLO COC(=O)c1occc1C[NH2+][C@H]1CCC[C@@H]1F ZINC000354647698 387411087 /nfs/dbraw/zinc/41/10/87/387411087.db2.gz CSNGTBFNBYPTGW-UWVGGRQHSA-N 1 2 241.262 2.046 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1cc(C)ccc1C ZINC000361184059 387412372 /nfs/dbraw/zinc/41/23/72/387412372.db2.gz JRXYAZOGKSTHFS-LBPRGKRZSA-N 1 2 235.327 2.297 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1cc(C)ccc1C ZINC000361184059 387412376 /nfs/dbraw/zinc/41/23/76/387412376.db2.gz JRXYAZOGKSTHFS-LBPRGKRZSA-N 1 2 235.327 2.297 20 0 BEADLO CCOc1nnc(C[N@H+](C)[C@H](C)C2CC2)s1 ZINC000515684596 387412535 /nfs/dbraw/zinc/41/25/35/387412535.db2.gz XBVGGGIFUQWRGH-MRVPVSSYSA-N 1 2 241.360 2.167 20 0 BEADLO CCOc1nnc(C[N@@H+](C)[C@H](C)C2CC2)s1 ZINC000515684596 387412540 /nfs/dbraw/zinc/41/25/40/387412540.db2.gz XBVGGGIFUQWRGH-MRVPVSSYSA-N 1 2 241.360 2.167 20 0 BEADLO COC(=O)[C@@H](C)[N@H+](C)Cc1coc2ccccc12 ZINC000361182978 387412901 /nfs/dbraw/zinc/41/29/01/387412901.db2.gz LFFVZXFNJWGOKK-SNVBAGLBSA-N 1 2 247.294 2.426 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1coc2ccccc12 ZINC000361182978 387412903 /nfs/dbraw/zinc/41/29/03/387412903.db2.gz LFFVZXFNJWGOKK-SNVBAGLBSA-N 1 2 247.294 2.426 20 0 BEADLO COC(=O)[C@H](C)[N@H+](C)Cc1ccc(F)c(C)c1 ZINC000361194887 387414087 /nfs/dbraw/zinc/41/40/87/387414087.db2.gz WFNZQVUFERDFSU-JTQLQIEISA-N 1 2 239.290 2.127 20 0 BEADLO COC(=O)[C@H](C)[N@@H+](C)Cc1ccc(F)c(C)c1 ZINC000361194887 387414091 /nfs/dbraw/zinc/41/40/91/387414091.db2.gz WFNZQVUFERDFSU-JTQLQIEISA-N 1 2 239.290 2.127 20 0 BEADLO O=C(NCc1[nH]cc[nH+]1)c1cccc(C2CC2)c1 ZINC000515669447 387415928 /nfs/dbraw/zinc/41/59/28/387415928.db2.gz ZRBMBYOSCLHYJA-UHFFFAOYSA-N 1 2 241.294 2.217 20 0 BEADLO CC(C)c1nc(N[C@@H]2CCO[C@H](C)C2)cc[nH+]1 ZINC000354709655 387418648 /nfs/dbraw/zinc/41/86/48/387418648.db2.gz FUJBGCXTWUMLTG-GHMZBOCLSA-N 1 2 235.331 2.001 20 0 BEADLO Cc1cscc1NC(=O)NCc1[nH]cc[nH+]1 ZINC000121840200 387421468 /nfs/dbraw/zinc/42/14/68/387421468.db2.gz AUIAZDGTNKCDRK-UHFFFAOYSA-N 1 2 236.300 2.101 20 0 BEADLO Cl/C=C/C[N@@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000374858591 387494551 /nfs/dbraw/zinc/49/45/51/387494551.db2.gz RBFJYLUQPMCBGX-HDMKULJXSA-N 1 2 211.696 2.299 20 0 BEADLO Cl/C=C/C[N@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000374858591 387494554 /nfs/dbraw/zinc/49/45/54/387494554.db2.gz RBFJYLUQPMCBGX-HDMKULJXSA-N 1 2 211.696 2.299 20 0 BEADLO Cl/C=C/CN1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000374858591 387494561 /nfs/dbraw/zinc/49/45/61/387494561.db2.gz RBFJYLUQPMCBGX-HDMKULJXSA-N 1 2 211.696 2.299 20 0 BEADLO Cc1c[nH+]c(C)nc1NC1CCSCC1 ZINC000514679669 387543281 /nfs/dbraw/zinc/54/32/81/387543281.db2.gz PGQRWZSENDKEJB-UHFFFAOYSA-N 1 2 223.345 2.401 20 0 BEADLO O=C(/C=C/C1CC1)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000375067887 387508989 /nfs/dbraw/zinc/50/89/89/387508989.db2.gz ZWBKORUHHCTCSE-MVIFTORASA-N 1 2 231.299 2.039 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ncn(C)n1)c1ccsc1 ZINC000275705992 387512508 /nfs/dbraw/zinc/51/25/08/387512508.db2.gz LPDMAPUUGVQABY-BDAKNGLRSA-N 1 2 236.344 2.288 20 0 BEADLO Cc1cc(C)nc(NCc2c[nH+]c(C)cc2C)n1 ZINC000396966154 387523020 /nfs/dbraw/zinc/52/30/20/387523020.db2.gz BVDIRMYKOWRGNH-UHFFFAOYSA-N 1 2 242.326 2.139 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1[C@@H]2CCCO[C@H]12 ZINC000425596294 387526082 /nfs/dbraw/zinc/52/60/82/387526082.db2.gz MWNVFVYDLJEMPN-LOWVWBTDSA-N 1 2 246.310 2.062 20 0 BEADLO CCCCNC(=O)NCc1c[nH+]c(C)cc1C ZINC000397119248 387541519 /nfs/dbraw/zinc/54/15/19/387541519.db2.gz ZKOVPOIISUKZQP-UHFFFAOYSA-N 1 2 235.331 2.298 20 0 BEADLO CC(C)C[C@@H]1CCCN1C(=O)CCc1[nH]cc[nH+]1 ZINC000352735799 387464994 /nfs/dbraw/zinc/46/49/94/387464994.db2.gz ADZPHTYZUOJJQO-LBPRGKRZSA-N 1 2 249.358 2.379 20 0 BEADLO FC(F)CN(Cc1c[nH+]c[nH]1)CC1CCC1 ZINC000355128601 387482328 /nfs/dbraw/zinc/48/23/28/387482328.db2.gz CUXRXOYIANSZOQ-UHFFFAOYSA-N 1 2 229.274 2.277 20 0 BEADLO FC(F)CN(Cc1c[nH]c[nH+]1)CC1CCC1 ZINC000355128601 387482334 /nfs/dbraw/zinc/48/23/34/387482334.db2.gz CUXRXOYIANSZOQ-UHFFFAOYSA-N 1 2 229.274 2.277 20 0 BEADLO CO[C@@H]1CCC[C@H]1NC(=O)Nc1cc[nH+]cc1C ZINC000122112310 387484355 /nfs/dbraw/zinc/48/43/55/387484355.db2.gz XLBKAQVPODZSOE-VXGBXAGGSA-N 1 2 249.314 2.079 20 0 BEADLO CC[C@H](C[NH2+][C@H](C)C(=O)OC)c1ccccc1 ZINC000355133322 387485277 /nfs/dbraw/zinc/48/52/77/387485277.db2.gz NXBLNBIDUIULIW-VXGBXAGGSA-N 1 2 235.327 2.331 20 0 BEADLO CC[N@H+](C[C@H](C)OC)[C@@H](C)c1nnc(C)s1 ZINC000361559211 387491326 /nfs/dbraw/zinc/49/13/26/387491326.db2.gz NWKWBMOXIOXIKJ-IUCAKERBSA-N 1 2 243.376 2.264 20 0 BEADLO CC[N@@H+](C[C@H](C)OC)[C@@H](C)c1nnc(C)s1 ZINC000361559211 387491329 /nfs/dbraw/zinc/49/13/29/387491329.db2.gz NWKWBMOXIOXIKJ-IUCAKERBSA-N 1 2 243.376 2.264 20 0 BEADLO CN1CC[N@H+](CC2(F)CC2)[C@@H](c2ccccc2)C1 ZINC000527509612 387587955 /nfs/dbraw/zinc/58/79/55/387587955.db2.gz GHYIBGYRNZSNTM-CQSZACIVSA-N 1 2 248.345 2.477 20 0 BEADLO CN1CC[N@@H+](CC2(F)CC2)[C@@H](c2ccccc2)C1 ZINC000527509612 387587957 /nfs/dbraw/zinc/58/79/57/387587957.db2.gz GHYIBGYRNZSNTM-CQSZACIVSA-N 1 2 248.345 2.477 20 0 BEADLO Fc1cccc(COCc2[nH]cc[nH+]2)c1F ZINC000123820267 387596165 /nfs/dbraw/zinc/59/61/65/387596165.db2.gz COKWDRKTRMRDLM-UHFFFAOYSA-N 1 2 224.210 2.405 20 0 BEADLO CCCc1noc(C[N@H+]2CC(C)=C[C@@H](C)C2)n1 ZINC000430269863 387605098 /nfs/dbraw/zinc/60/50/98/387605098.db2.gz SNUROZRJTPHDTB-SNVBAGLBSA-N 1 2 235.331 2.420 20 0 BEADLO CCCc1noc(C[N@@H+]2CC(C)=C[C@@H](C)C2)n1 ZINC000430269863 387605101 /nfs/dbraw/zinc/60/51/01/387605101.db2.gz SNUROZRJTPHDTB-SNVBAGLBSA-N 1 2 235.331 2.420 20 0 BEADLO Cc1cnc(C(=O)Nc2c(C)cc[nH+]c2C)cn1 ZINC000362397101 387607491 /nfs/dbraw/zinc/60/74/91/387607491.db2.gz PPMUFASZCPUPRX-UHFFFAOYSA-N 1 2 242.282 2.049 20 0 BEADLO Cc1ccc(C(C)(C)[NH2+]Cc2csnn2)cn1 ZINC000355520642 387546062 /nfs/dbraw/zinc/54/60/62/387546062.db2.gz XSRPWTLLDOIICQ-UHFFFAOYSA-N 1 2 248.355 2.266 20 0 BEADLO C[C@@H](Nc1cc[nH+]c(C2CC2)n1)[C@H]1CCCOC1 ZINC000355568912 387552280 /nfs/dbraw/zinc/55/22/80/387552280.db2.gz SKELKIDFCAOJKO-PWSUYJOCSA-N 1 2 247.342 2.003 20 0 BEADLO Cc1c[nH+]c(CN2CCC(F)(F)[C@H](C)C2)n1C ZINC000356242036 387632026 /nfs/dbraw/zinc/63/20/26/387632026.db2.gz DWPUJXKNAWZJDS-SECBINFHSA-N 1 2 243.301 2.206 20 0 BEADLO Cc1cnc(C[N@@H+]2CCC(F)(F)[C@H](C)C2)n1C ZINC000356242036 387632027 /nfs/dbraw/zinc/63/20/27/387632027.db2.gz DWPUJXKNAWZJDS-SECBINFHSA-N 1 2 243.301 2.206 20 0 BEADLO Cc1cnc(C[N@H+]2CCC(F)(F)[C@H](C)C2)n1C ZINC000356242036 387632028 /nfs/dbraw/zinc/63/20/28/387632028.db2.gz DWPUJXKNAWZJDS-SECBINFHSA-N 1 2 243.301 2.206 20 0 BEADLO C[N@@H+](Cc1csnn1)CC1CCCC1 ZINC000123172134 387659828 /nfs/dbraw/zinc/65/98/28/387659828.db2.gz GATJOXMSVJDEIG-UHFFFAOYSA-N 1 2 211.334 2.160 20 0 BEADLO C[N@H+](Cc1csnn1)CC1CCCC1 ZINC000123172134 387659830 /nfs/dbraw/zinc/65/98/30/387659830.db2.gz GATJOXMSVJDEIG-UHFFFAOYSA-N 1 2 211.334 2.160 20 0 BEADLO CC(C)CC(=O)N1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000125578749 387660578 /nfs/dbraw/zinc/66/05/78/387660578.db2.gz SAHZZSJOYLQGIY-CHWSQXEVSA-N 1 2 249.358 2.339 20 0 BEADLO c1nc(C[N@@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)co1 ZINC000356516639 387667582 /nfs/dbraw/zinc/66/75/82/387667582.db2.gz FCVLCOHJTVVASC-OLZOCXBDSA-N 1 2 248.326 2.208 20 0 BEADLO c1nc(C[N@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)co1 ZINC000356516639 387667584 /nfs/dbraw/zinc/66/75/84/387667584.db2.gz FCVLCOHJTVVASC-OLZOCXBDSA-N 1 2 248.326 2.208 20 0 BEADLO CC[C@H](F)C[N@H+](C)C1(C(=O)OC)CCCC1 ZINC000440767380 387686272 /nfs/dbraw/zinc/68/62/72/387686272.db2.gz SGAHIASGLYDFOM-JTQLQIEISA-N 1 2 231.311 2.152 20 0 BEADLO CC[C@H](F)C[N@@H+](C)C1(C(=O)OC)CCCC1 ZINC000440767380 387686277 /nfs/dbraw/zinc/68/62/77/387686277.db2.gz SGAHIASGLYDFOM-JTQLQIEISA-N 1 2 231.311 2.152 20 0 BEADLO CCC[C@H]1C[N@H+](C[C@H](F)CC)CCO1 ZINC000440771600 387689063 /nfs/dbraw/zinc/68/90/63/387689063.db2.gz RLCONZCVPIFULB-MNOVXSKESA-N 1 2 203.301 2.235 20 0 BEADLO CCC[C@H]1C[N@@H+](C[C@H](F)CC)CCO1 ZINC000440771600 387689069 /nfs/dbraw/zinc/68/90/69/387689069.db2.gz RLCONZCVPIFULB-MNOVXSKESA-N 1 2 203.301 2.235 20 0 BEADLO CC(C)C(C)(C)[S@@](=O)Cc1[nH+]ccn1C ZINC000431198447 387689087 /nfs/dbraw/zinc/68/90/87/387689087.db2.gz OKJWVFZSOZBWSL-HNNXBMFYSA-N 1 2 228.361 2.103 20 0 BEADLO CC[C@H](F)C[N@@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000440776298 387694107 /nfs/dbraw/zinc/69/41/07/387694107.db2.gz BZUPFDGQGCTMGA-UWVGGRQHSA-N 1 2 211.284 2.295 20 0 BEADLO CC[C@H](F)C[N@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000440776298 387694112 /nfs/dbraw/zinc/69/41/12/387694112.db2.gz BZUPFDGQGCTMGA-UWVGGRQHSA-N 1 2 211.284 2.295 20 0 BEADLO CCCCN(CC)C(=O)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000377781539 387749435 /nfs/dbraw/zinc/74/94/35/387749435.db2.gz NJIXCJQDUFGKHA-NSHDSACASA-N 1 2 249.358 2.478 20 0 BEADLO CC[C@H](F)C[N@@H+]1CCO[C@H](c2ccco2)C1 ZINC000440790532 387699216 /nfs/dbraw/zinc/69/92/16/387699216.db2.gz LDHARWLJZBEWMY-JQWIXIFHSA-N 1 2 227.279 2.401 20 0 BEADLO CC[C@H](F)C[N@H+]1CCO[C@H](c2ccco2)C1 ZINC000440790532 387699220 /nfs/dbraw/zinc/69/92/20/387699220.db2.gz LDHARWLJZBEWMY-JQWIXIFHSA-N 1 2 227.279 2.401 20 0 BEADLO CCc1ccc(C[NH+]2C[C@H](C)O[C@@H](C)C2)o1 ZINC000126966147 387701348 /nfs/dbraw/zinc/70/13/48/387701348.db2.gz ZYPUGZXODPDWBO-QWRGUYRKSA-N 1 2 223.316 2.451 20 0 BEADLO CC[C@@H](F)CN1CC[N@H+](C[C@H](F)CC)C[C@H]1C ZINC000440798166 387704841 /nfs/dbraw/zinc/70/48/41/387704841.db2.gz ZXLIGMBOLTUARW-JHJVBQTASA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@@H](F)CN1CC[N@@H+](C[C@H](F)CC)C[C@H]1C ZINC000440798166 387704849 /nfs/dbraw/zinc/70/48/49/387704849.db2.gz ZXLIGMBOLTUARW-JHJVBQTASA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@@H](F)CN1CC[N@H+](C[C@H](F)CC)[C@H](C)C1 ZINC000440798166 387704853 /nfs/dbraw/zinc/70/48/53/387704853.db2.gz ZXLIGMBOLTUARW-JHJVBQTASA-N 1 2 248.361 2.489 20 0 BEADLO CC[C@@H](F)CN1CC[N@@H+](C[C@H](F)CC)[C@H](C)C1 ZINC000440798166 387704859 /nfs/dbraw/zinc/70/48/59/387704859.db2.gz ZXLIGMBOLTUARW-JHJVBQTASA-N 1 2 248.361 2.489 20 0 BEADLO CCCOc1cncc(NCc2c[nH+]cn2C)c1 ZINC000527782667 387709469 /nfs/dbraw/zinc/70/94/69/387709469.db2.gz YMTYNWREKWGGIN-UHFFFAOYSA-N 1 2 246.314 2.216 20 0 BEADLO COCc1nc(COc2cc[nH+]cc2)cs1 ZINC000431487729 387713805 /nfs/dbraw/zinc/71/38/05/387713805.db2.gz YYEFAFBHBPIKPR-UHFFFAOYSA-N 1 2 236.296 2.264 20 0 BEADLO CCCCN(CC)C(=O)COc1cc[nH+]cc1 ZINC000431505315 387714305 /nfs/dbraw/zinc/71/43/05/387714305.db2.gz BSSHBRREPCQFRV-UHFFFAOYSA-N 1 2 236.315 2.109 20 0 BEADLO CC(C)c1nc(NC[C@@H]2CCO[C@@H](C)C2)cc[nH+]1 ZINC000356802191 387724178 /nfs/dbraw/zinc/72/41/78/387724178.db2.gz YUEJGRORCDQOKP-NWDGAFQWSA-N 1 2 249.358 2.249 20 0 BEADLO Cn1ccc(C[NH2+]C2(c3ccc(F)cc3)CC2)n1 ZINC000356880826 387739413 /nfs/dbraw/zinc/73/94/13/387739413.db2.gz RWLUVWAGMMTRNN-UHFFFAOYSA-N 1 2 245.301 2.338 20 0 BEADLO CSc1ccc(NCc2c[nH+]cn2C)nc1 ZINC000150887289 387779358 /nfs/dbraw/zinc/77/93/58/387779358.db2.gz OXBDISSSIQINQB-UHFFFAOYSA-N 1 2 234.328 2.149 20 0 BEADLO COc1ccc[nH+]c1N1CC[C@@H](C2CC2)C1 ZINC000527942940 387780886 /nfs/dbraw/zinc/78/08/86/387780886.db2.gz HMCADJPOXTZTCV-LLVKDONJSA-N 1 2 218.300 2.327 20 0 BEADLO CC[C@@H]1CCN(c2[nH+]cccc2OC)C1 ZINC000527920892 387790332 /nfs/dbraw/zinc/79/03/32/387790332.db2.gz ZSFCWEXMZGTLGH-SNVBAGLBSA-N 1 2 206.289 2.327 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H]1C[C@]1(C)OC(C)C ZINC000527999748 387808275 /nfs/dbraw/zinc/80/82/75/387808275.db2.gz PJVBKAVMDGHGLO-BIMULSAOSA-N 1 2 237.347 2.325 20 0 BEADLO Cc1cc(F)c(C[NH2+]C[C@@H](C)N(C)C)c(F)c1 ZINC000424153725 387809060 /nfs/dbraw/zinc/80/90/60/387809060.db2.gz KXYCGLBHFJQINU-SNVBAGLBSA-N 1 2 242.313 2.313 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CCO[C@@H](C2CC2)C1 ZINC000527961071 387810116 /nfs/dbraw/zinc/81/01/16/387810116.db2.gz AUTIIUXXSLKLKA-WCQYABFASA-N 1 2 248.326 2.460 20 0 BEADLO CCC(F)(F)C[N@@H+]1CCCC[C@@H]1CNC(C)=O ZINC000639896207 387810305 /nfs/dbraw/zinc/81/03/05/387810305.db2.gz AQFKHPFCDGUTGV-LLVKDONJSA-N 1 2 248.317 2.022 20 0 BEADLO CCC(F)(F)C[N@H+]1CCCC[C@@H]1CNC(C)=O ZINC000639896207 387810312 /nfs/dbraw/zinc/81/03/12/387810312.db2.gz AQFKHPFCDGUTGV-LLVKDONJSA-N 1 2 248.317 2.022 20 0 BEADLO COc1ccc[nH+]c1N1CCCC2(CC2)C1 ZINC000527966680 387810947 /nfs/dbraw/zinc/81/09/47/387810947.db2.gz PIWBGZFAUNYVGK-UHFFFAOYSA-N 1 2 218.300 2.471 20 0 BEADLO COc1ccc[nH+]c1N(C)C[C@@H]1CCCCO1 ZINC000527858726 387758242 /nfs/dbraw/zinc/75/82/42/387758242.db2.gz VDBZWITWMQCSCI-NSHDSACASA-N 1 2 236.315 2.096 20 0 BEADLO COc1ccc[nH+]c1NC[C@H]1CCOC[C@@H]1C ZINC000528018740 387825817 /nfs/dbraw/zinc/82/58/17/387825817.db2.gz KJWGVVOXCMOTOB-WDEREUQCSA-N 1 2 236.315 2.175 20 0 BEADLO C[C@H]([NH2+]Cc1ncccn1)c1ccccc1 ZINC000054458763 387826805 /nfs/dbraw/zinc/82/68/05/387826805.db2.gz BOOQOGPOYLCZHP-NSHDSACASA-N 1 2 213.284 2.327 20 0 BEADLO Cc1ccc([C@H](C)[NH2+]Cc2ncccn2)o1 ZINC000054459372 387826931 /nfs/dbraw/zinc/82/69/31/387826931.db2.gz ORTGXDRDPWHVFF-JTQLQIEISA-N 1 2 217.272 2.229 20 0 BEADLO CN(CCC(=O)OC(C)(C)C)c1cccc[nH+]1 ZINC000418879460 387829241 /nfs/dbraw/zinc/82/92/41/387829241.db2.gz CEZRKAJEWAQDJK-UHFFFAOYSA-N 1 2 236.315 2.250 20 0 BEADLO C[N@H+](Cc1nnc(C(C)(C)C)[nH]1)C1CCC1 ZINC000432825917 387831236 /nfs/dbraw/zinc/83/12/36/387831236.db2.gz WGTGHCDBQPOETF-UHFFFAOYSA-N 1 2 222.336 2.087 20 0 BEADLO C[N@@H+](Cc1nnc(C(C)(C)C)[nH]1)C1CCC1 ZINC000432825917 387831241 /nfs/dbraw/zinc/83/12/41/387831241.db2.gz WGTGHCDBQPOETF-UHFFFAOYSA-N 1 2 222.336 2.087 20 0 BEADLO CCc1nocc1CN(C)c1[nH+]cccc1OC ZINC000528027316 387832602 /nfs/dbraw/zinc/83/26/02/387832602.db2.gz TYIYPXDCGXPYSR-UHFFFAOYSA-N 1 2 247.298 2.277 20 0 BEADLO COc1ccc[nH+]c1NCCc1ccc(C)cn1 ZINC000528033089 387833695 /nfs/dbraw/zinc/83/36/95/387833695.db2.gz SRAUNVGMXNJWJV-UHFFFAOYSA-N 1 2 243.310 2.448 20 0 BEADLO O[C@@H]1C[C@@H](F)CN(c2[nH+]ccc3ccccc32)C1 ZINC000528055520 387839144 /nfs/dbraw/zinc/83/91/44/387839144.db2.gz GMFBKLHPGSHUIV-VXGBXAGGSA-N 1 2 246.285 2.144 20 0 BEADLO CC[C@@H](NC(=O)CCc1ccoc1)c1[nH]cc[nH+]1 ZINC000442794099 387841275 /nfs/dbraw/zinc/84/12/75/387841275.db2.gz CLLAMMGZAKCJDO-LLVKDONJSA-N 1 2 247.298 2.203 20 0 BEADLO CC[NH+](CC)Cc1nn(C)cc1Br ZINC000292766676 387842705 /nfs/dbraw/zinc/84/27/05/387842705.db2.gz XXJDKDTZQPEJKI-UHFFFAOYSA-N 1 2 246.152 2.024 20 0 BEADLO CC[C@H](NC(=O)[C@H]1C[C@@H]1C(C)C)c1[nH]cc[nH+]1 ZINC000442814120 387846025 /nfs/dbraw/zinc/84/60/25/387846025.db2.gz UVJCBFRTVFHUSZ-VWYCJHECSA-N 1 2 235.331 2.269 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1CCC[C@@H]2OCC[C@H]21 ZINC000582576401 387850729 /nfs/dbraw/zinc/85/07/29/387850729.db2.gz LZGIGRZQNDTOLH-XQQFMLRXSA-N 1 2 247.342 2.463 20 0 BEADLO CCO[C@@]1(C)C[C@H]1Nc1cc[nH+]c2ccncc12 ZINC000528154615 387857102 /nfs/dbraw/zinc/85/71/02/387857102.db2.gz JUWXFGYBTFVTHR-KGLIPLIRSA-N 1 2 243.310 2.031 20 0 BEADLO CC(C)O[C@@]1(C)C[C@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000528203288 387869400 /nfs/dbraw/zinc/86/94/00/387869400.db2.gz OCWNEKUAESBVPS-RISCZKNCSA-N 1 2 247.342 2.144 20 0 BEADLO Cc1cc(N[C@@H]2[C@H](C)O[C@@H](C)[C@H]2C)nc[nH+]1 ZINC000528203648 387869732 /nfs/dbraw/zinc/86/97/32/387869732.db2.gz DMLUEEGUTSUEKP-WDCWCFNPSA-N 1 2 221.304 2.009 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1ncccc1F)c1cn[nH]c1 ZINC000528035302 387817174 /nfs/dbraw/zinc/81/71/74/387817174.db2.gz FWGJKIGBHOJZPR-BDAKNGLRSA-N 1 2 234.278 2.356 20 0 BEADLO FC[C@H]1CN(c2[nH+]ccc3ccccc32)CCO1 ZINC000528033338 387818404 /nfs/dbraw/zinc/81/84/04/387818404.db2.gz AUQUGOOKFCGKHL-LBPRGKRZSA-N 1 2 246.285 2.410 20 0 BEADLO O=C(CC1CCCCC1)N1CCc2[nH]c[nH+]c2C1 ZINC000065164077 387877674 /nfs/dbraw/zinc/87/76/74/387877674.db2.gz OCFMWYHYRTZXQY-UHFFFAOYSA-N 1 2 247.342 2.265 20 0 BEADLO O=C(CC1CCCCC1)N1CCc2[nH+]c[nH]c2C1 ZINC000065164077 387877678 /nfs/dbraw/zinc/87/76/78/387877678.db2.gz OCFMWYHYRTZXQY-UHFFFAOYSA-N 1 2 247.342 2.265 20 0 BEADLO CCC[N@H+](C)Cc1nc([C@H]2CC[C@H](C)O2)no1 ZINC000528227802 387884759 /nfs/dbraw/zinc/88/47/59/387884759.db2.gz AHIKVFVASRJRPF-VHSXEESVSA-N 1 2 239.319 2.151 20 0 BEADLO CCC[N@@H+](C)Cc1nc([C@H]2CC[C@H](C)O2)no1 ZINC000528227802 387884763 /nfs/dbraw/zinc/88/47/63/387884763.db2.gz AHIKVFVASRJRPF-VHSXEESVSA-N 1 2 239.319 2.151 20 0 BEADLO CC(C)n1cncc1C[NH2+][C@@H](C)c1ccn(C)n1 ZINC000424177110 387887308 /nfs/dbraw/zinc/88/73/08/387887308.db2.gz UCDDPDBMVHQDFQ-NSHDSACASA-N 1 2 247.346 2.048 20 0 BEADLO C[C@H](Cn1cc[nH+]c1)NC(=O)[C@@]1(C)CC=CCC1 ZINC000448706932 387888478 /nfs/dbraw/zinc/88/84/78/387888478.db2.gz BFYHHETVXAHUJG-OCCSQVGLSA-N 1 2 247.342 2.134 20 0 BEADLO CCCCc1nc(C[NH+](CC)CC)no1 ZINC000064931568 387900211 /nfs/dbraw/zinc/90/02/11/387900211.db2.gz MLETVLKVSIMKNU-UHFFFAOYSA-N 1 2 211.309 2.254 20 0 BEADLO CCCc1nc(C[N@H+](CC)C2CC2)no1 ZINC000054988941 387901652 /nfs/dbraw/zinc/90/16/52/387901652.db2.gz MDJUESBXTNDMHQ-UHFFFAOYSA-N 1 2 209.293 2.006 20 0 BEADLO CCCc1nc(C[N@@H+](CC)C2CC2)no1 ZINC000054988941 387901655 /nfs/dbraw/zinc/90/16/55/387901655.db2.gz MDJUESBXTNDMHQ-UHFFFAOYSA-N 1 2 209.293 2.006 20 0 BEADLO Nc1nc(NCC2CCCC2)[nH+]c2ccccc12 ZINC000532985525 387916217 /nfs/dbraw/zinc/91/62/17/387916217.db2.gz MQAZSFPIQIBOLI-UHFFFAOYSA-N 1 2 242.326 2.066 20 0 BEADLO COCCOC1C[NH+](C/C=C\c2ccccc2)C1 ZINC000459454641 387942550 /nfs/dbraw/zinc/94/25/50/387942550.db2.gz DSDTYPNZFPSBKL-YVMONPNESA-N 1 2 247.338 2.047 20 0 BEADLO C[C@H](CO)[N@H+](C)Cc1c(F)cccc1Cl ZINC000158882013 387968097 /nfs/dbraw/zinc/96/80/97/387968097.db2.gz SHKZBGZJWNLYGN-MRVPVSSYSA-N 1 2 231.698 2.292 20 0 BEADLO C[C@H](CO)[N@@H+](C)Cc1c(F)cccc1Cl ZINC000158882013 387968104 /nfs/dbraw/zinc/96/81/04/387968104.db2.gz SHKZBGZJWNLYGN-MRVPVSSYSA-N 1 2 231.698 2.292 20 0 BEADLO C[C@@H](N[C@H]1C[C@H](C)n2cc[nH+]c21)C(F)(F)F ZINC000424324609 387970699 /nfs/dbraw/zinc/97/06/99/387970699.db2.gz NDSFRHZLKQQPOE-RNJXMRFFSA-N 1 2 233.237 2.429 20 0 BEADLO CC(C)C[N@@H+]1CC(=O)NC12C[C@H](C)C[C@@H](C)C2 ZINC000439142006 387981753 /nfs/dbraw/zinc/98/17/53/387981753.db2.gz NGJMYPMVQNJPLJ-VXGBXAGGSA-N 1 2 238.375 2.227 20 0 BEADLO CC(C)C[N@H+]1CC(=O)NC12C[C@H](C)C[C@@H](C)C2 ZINC000439142006 387981757 /nfs/dbraw/zinc/98/17/57/387981757.db2.gz NGJMYPMVQNJPLJ-VXGBXAGGSA-N 1 2 238.375 2.227 20 0 BEADLO CC[C@H](N[C@@H]1CCn2cc[nH+]c21)C(F)(F)F ZINC000453208185 388010368 /nfs/dbraw/zinc/01/03/68/388010368.db2.gz BIUHAFBRPVUKMY-SFYZADRCSA-N 1 2 233.237 2.258 20 0 BEADLO CC[C@@H](Nc1ccnc(C2CC2)n1)c1[nH]cc[nH+]1 ZINC000439643051 388012813 /nfs/dbraw/zinc/01/28/13/388012813.db2.gz JBUBHALCIXUZIQ-SNVBAGLBSA-N 1 2 243.314 2.062 20 0 BEADLO Cc1ccnc(Nc2ccc3c(c2)[nH+]cn3C)n1 ZINC000439708281 388014644 /nfs/dbraw/zinc/01/46/44/388014644.db2.gz SCPBQLCVMNUFNW-UHFFFAOYSA-N 1 2 239.282 2.415 20 0 BEADLO CC(C)c1[nH]cc(CNC(=O)[C@@H](F)C(C)C)[nH+]1 ZINC001645476863 1172670855 /nfs/dbraw/zinc/67/08/55/1172670855.db2.gz XNSYQKOPRQTMPD-JTQLQIEISA-N 1 2 241.310 2.143 20 0 BEADLO CC(C)c1[nH]c(CNC(=O)[C@@H](F)C(C)C)c[nH+]1 ZINC001645476863 1172670860 /nfs/dbraw/zinc/67/08/60/1172670860.db2.gz XNSYQKOPRQTMPD-JTQLQIEISA-N 1 2 241.310 2.143 20 0 BEADLO CCC(CC)n1ccc(C[N@H+](C)CCOC)n1 ZINC000446762240 388037194 /nfs/dbraw/zinc/03/71/94/388037194.db2.gz OIMYOAFHAYRRBT-UHFFFAOYSA-N 1 2 239.363 2.322 20 0 BEADLO CCC(CC)n1ccc(C[N@@H+](C)CCOC)n1 ZINC000446762240 388037199 /nfs/dbraw/zinc/03/71/99/388037199.db2.gz OIMYOAFHAYRRBT-UHFFFAOYSA-N 1 2 239.363 2.322 20 0 BEADLO CC(C)CC(C)(C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000439961957 388026650 /nfs/dbraw/zinc/02/66/50/388026650.db2.gz PBLVDIUGQOZIJO-UHFFFAOYSA-N 1 2 237.347 2.440 20 0 BEADLO c1c[nH]c(C[NH2+][C@H]2CSc3ccccc32)n1 ZINC000083748664 388060628 /nfs/dbraw/zinc/06/06/28/388060628.db2.gz QRUSGNHDYNYVKA-JTQLQIEISA-N 1 2 231.324 2.346 20 0 BEADLO CCOC(=O)[C@H]1CCCC[N@@H+]1C[C@H](F)CC ZINC000440704070 388070488 /nfs/dbraw/zinc/07/04/88/388070488.db2.gz UQZXRAMLKONVMG-GHMZBOCLSA-N 1 2 231.311 2.152 20 0 BEADLO CCOC(=O)[C@H]1CCCC[N@H+]1C[C@H](F)CC ZINC000440704070 388070493 /nfs/dbraw/zinc/07/04/93/388070493.db2.gz UQZXRAMLKONVMG-GHMZBOCLSA-N 1 2 231.311 2.152 20 0 BEADLO Cc1ccoc1C[NH2+][C@H](C)c1nccn1C ZINC000336659221 388082851 /nfs/dbraw/zinc/08/28/51/388082851.db2.gz MVLDTMBTFFVHEM-SNVBAGLBSA-N 1 2 219.288 2.172 20 0 BEADLO Cn1c[nH+]cc1CNc1cc(F)cc(F)c1 ZINC000085167745 388084594 /nfs/dbraw/zinc/08/45/94/388084594.db2.gz IORJBZGVEXKUDS-UHFFFAOYSA-N 1 2 223.226 2.310 20 0 BEADLO CC[C@@]1(C(C)C)C[C@H]1[NH2+]Cc1ccn[nH]1 ZINC000453605565 388091641 /nfs/dbraw/zinc/09/16/41/388091641.db2.gz CXWQIAOQADIFEU-NEPJUHHUSA-N 1 2 207.321 2.324 20 0 BEADLO CC[C@@H]([NH2+]Cc1cc2ccccc2[nH]1)C(=O)OC ZINC000447796759 388092611 /nfs/dbraw/zinc/09/26/11/388092611.db2.gz YPNSKAVWEQSAJU-GFCCVEGCSA-N 1 2 246.310 2.209 20 0 BEADLO CC[C@@H]([NH2+][C@@H]1C[C@H]1C1CCCCC1)C(=O)OC ZINC000447798718 388093962 /nfs/dbraw/zinc/09/39/62/388093962.db2.gz AHHDUGRJVZPDPU-YNEHKIRRSA-N 1 2 239.359 2.496 20 0 BEADLO Cc1cc(N2CCO[C@H](C(C)(C)C)C2)nc[nH+]1 ZINC000447817510 388095719 /nfs/dbraw/zinc/09/57/19/388095719.db2.gz QUHOKBMLKVDLJI-NSHDSACASA-N 1 2 235.331 2.036 20 0 BEADLO CC/C=C\C[NH2+][C@@H](c1ncc[nH]1)c1cccnc1 ZINC000453322443 388047057 /nfs/dbraw/zinc/04/70/57/388047057.db2.gz PIWLHQODTZBDEU-DHCBQETCSA-N 1 2 242.326 2.450 20 0 BEADLO CCc1nocc1C[N@@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000646153347 388157245 /nfs/dbraw/zinc/15/72/45/388157245.db2.gz IRMSVPCHYQJJIP-ONGXEEELSA-N 1 2 226.295 2.417 20 0 BEADLO CCc1nocc1C[N@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000646153347 388157246 /nfs/dbraw/zinc/15/72/46/388157246.db2.gz IRMSVPCHYQJJIP-ONGXEEELSA-N 1 2 226.295 2.417 20 0 BEADLO Cc1cccc(CN(C)Cc2[nH+]ccn2C)c1F ZINC000449226715 388159606 /nfs/dbraw/zinc/15/96/06/388159606.db2.gz NNSABMYMMGKNDA-UHFFFAOYSA-N 1 2 247.317 2.500 20 0 BEADLO Cc1nocc1C[N@@H+](C)Cc1ccc(C)cn1 ZINC000646173298 388159711 /nfs/dbraw/zinc/15/97/11/388159711.db2.gz IKAAIZAUOMUESM-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1nocc1C[N@H+](C)Cc1ccc(C)cn1 ZINC000646173298 388159714 /nfs/dbraw/zinc/15/97/14/388159714.db2.gz IKAAIZAUOMUESM-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO CCC[C@H]([NH2+][C@@H](C)Cc1ccoc1)C(=O)OC ZINC000449258795 388163815 /nfs/dbraw/zinc/16/38/15/388163815.db2.gz RBXBZHKECNSXOF-JQWIXIFHSA-N 1 2 239.315 2.142 20 0 BEADLO C[C@@H](c1ccccc1)[N@H+](C)Cc1nncn1C ZINC000195513961 388165392 /nfs/dbraw/zinc/16/53/92/388165392.db2.gz JRXRUIICFKCABB-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1ccccc1)[N@@H+](C)Cc1nncn1C ZINC000195513961 388165394 /nfs/dbraw/zinc/16/53/94/388165394.db2.gz JRXRUIICFKCABB-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO Cc1ccnc([C@H](C)[NH2+]C(CF)CF)c1 ZINC000449378227 388188148 /nfs/dbraw/zinc/18/81/48/388188148.db2.gz DETWQBWAYBATPS-VIFPVBQESA-N 1 2 214.259 2.348 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cc3ccccc3[nH]2)CCO1 ZINC000646255569 388171076 /nfs/dbraw/zinc/17/10/76/388171076.db2.gz OFLXCZCVFNOLAZ-LLVKDONJSA-N 1 2 230.311 2.389 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cc3ccccc3[nH]2)CCO1 ZINC000646255569 388171077 /nfs/dbraw/zinc/17/10/77/388171077.db2.gz OFLXCZCVFNOLAZ-LLVKDONJSA-N 1 2 230.311 2.389 20 0 BEADLO CCCC[C@H](C)C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000646257987 388172037 /nfs/dbraw/zinc/17/20/37/388172037.db2.gz WKBZOJYPGDZPGG-JTQLQIEISA-N 1 2 235.331 2.121 20 0 BEADLO CCCC[C@H](C)C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000646257987 388172039 /nfs/dbraw/zinc/17/20/39/388172039.db2.gz WKBZOJYPGDZPGG-JTQLQIEISA-N 1 2 235.331 2.121 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C1=C(C)CCC1 ZINC000456075673 388174732 /nfs/dbraw/zinc/17/47/32/388174732.db2.gz CHNHLARSEOUJAZ-UHFFFAOYSA-N 1 2 233.315 2.020 20 0 BEADLO Cc1cc(C[NH2+]C(CF)CF)cc(C)c1O ZINC000449379989 388188367 /nfs/dbraw/zinc/18/83/67/388188367.db2.gz LKCNRTNIGVRQEI-UHFFFAOYSA-N 1 2 229.270 2.406 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@]1(C)CCC[C@H]1C ZINC000456112414 388178537 /nfs/dbraw/zinc/17/85/37/388178537.db2.gz PNBRUPXWOASXRP-BXUZGUMPSA-N 1 2 249.358 2.346 20 0 BEADLO CCc1ncc(C[N@H+](C2CC2)C2COC2)s1 ZINC000449351947 388179616 /nfs/dbraw/zinc/17/96/16/388179616.db2.gz SHKAZNNQEYUBPK-UHFFFAOYSA-N 1 2 238.356 2.069 20 0 BEADLO CCc1ncc(C[N@@H+](C2CC2)C2COC2)s1 ZINC000449351947 388179618 /nfs/dbraw/zinc/17/96/18/388179618.db2.gz SHKAZNNQEYUBPK-UHFFFAOYSA-N 1 2 238.356 2.069 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccc(OC)nc1)C(F)F ZINC000449365450 388183646 /nfs/dbraw/zinc/18/36/46/388183646.db2.gz VXOGYPAOEREMAH-SECBINFHSA-N 1 2 230.258 2.224 20 0 BEADLO COC(=O)[C@H](Cc1ccccc1)[NH2+]C[C@@H]1C[C@@H]1C ZINC000488526160 388184394 /nfs/dbraw/zinc/18/43/94/388184394.db2.gz FGPJWIBQVHUJAW-UBHSHLNASA-N 1 2 247.338 2.016 20 0 BEADLO COc1ccc(C[NH2+]C(CF)CF)cc1OC ZINC000449373343 388184849 /nfs/dbraw/zinc/18/48/49/388184849.db2.gz QIXKYGKPYMPASS-UHFFFAOYSA-N 1 2 245.269 2.101 20 0 BEADLO COc1cc(C[NH2+]C(CF)CF)cc(OC)c1 ZINC000449373088 388184952 /nfs/dbraw/zinc/18/49/52/388184952.db2.gz NSKDBAHZTIAFRF-UHFFFAOYSA-N 1 2 245.269 2.101 20 0 BEADLO FCC(CF)[NH2+]Cc1cccc(F)c1 ZINC000449372017 388185210 /nfs/dbraw/zinc/18/52/10/388185210.db2.gz BGSBPUVCXQMUKP-UHFFFAOYSA-N 1 2 203.207 2.223 20 0 BEADLO C[N@H+](Cc1ncn(-c2ccccc2)n1)C(C)(C)C ZINC000646088426 388140032 /nfs/dbraw/zinc/14/00/32/388140032.db2.gz DTJWMNLQKAWWMI-UHFFFAOYSA-N 1 2 244.342 2.498 20 0 BEADLO C[N@@H+](Cc1ncn(-c2ccccc2)n1)C(C)(C)C ZINC000646088426 388140034 /nfs/dbraw/zinc/14/00/34/388140034.db2.gz DTJWMNLQKAWWMI-UHFFFAOYSA-N 1 2 244.342 2.498 20 0 BEADLO Cc1ccc(NC(=O)NC(CF)CF)c(C)[nH+]1 ZINC000455044317 388146157 /nfs/dbraw/zinc/14/61/57/388146157.db2.gz LWRRXDWZFUSDIO-UHFFFAOYSA-N 1 2 243.257 2.128 20 0 BEADLO CSC1(C[NH2+][C@@H](C)C(=O)OC(C)C)CCC1 ZINC000449662380 388250800 /nfs/dbraw/zinc/25/08/00/388250800.db2.gz LEHUGTQZDNADGL-JTQLQIEISA-N 1 2 245.388 2.202 20 0 BEADLO CCOC(=O)c1ccc(C[N@@H+]2CC[C@@H](F)C2)o1 ZINC000449389264 388191985 /nfs/dbraw/zinc/19/19/85/388191985.db2.gz CKEHNQWYMCWJSI-SECBINFHSA-N 1 2 241.262 2.000 20 0 BEADLO CCOC(=O)c1ccc(C[N@H+]2CC[C@@H](F)C2)o1 ZINC000449389264 388191987 /nfs/dbraw/zinc/19/19/87/388191987.db2.gz CKEHNQWYMCWJSI-SECBINFHSA-N 1 2 241.262 2.000 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)C[C@H]1C[C@H]1C ZINC000456350479 388196845 /nfs/dbraw/zinc/19/68/45/388196845.db2.gz KBUQQABCTHJMNO-OUAUKWLOSA-N 1 2 235.331 2.126 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)C1(C)CCC1 ZINC000456361205 388196962 /nfs/dbraw/zinc/19/69/62/388196962.db2.gz RUKKHJSGHKJWHO-JTQLQIEISA-N 1 2 235.331 2.270 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)c1cc[nH]c1C ZINC000456358569 388196993 /nfs/dbraw/zinc/19/69/93/388196993.db2.gz QJBXVLYYACOCGH-JTQLQIEISA-N 1 2 246.314 2.031 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)C1CC=CC1 ZINC000456351807 388197091 /nfs/dbraw/zinc/19/70/91/388197091.db2.gz LFTXSVUQTGIQGF-JTQLQIEISA-N 1 2 233.315 2.046 20 0 BEADLO C[C@H]1C[C@H](NC(=O)CCC2CC2)c2[nH+]ccn21 ZINC000456361488 388197979 /nfs/dbraw/zinc/19/79/79/388197979.db2.gz DOJBZLPUBGYADK-ONGXEEELSA-N 1 2 233.315 2.195 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)c1ccc(C)o1 ZINC000456375364 388198538 /nfs/dbraw/zinc/19/85/38/388198538.db2.gz HANRXNZQOMGJJA-SNVBAGLBSA-N 1 2 247.298 2.295 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)NC(=O)c1occc1C ZINC000456399918 388199204 /nfs/dbraw/zinc/19/92/04/388199204.db2.gz USXSQGMMITWREP-JTQLQIEISA-N 1 2 247.298 2.295 20 0 BEADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)[C@H]1CC=CCC1 ZINC000456396411 388199469 /nfs/dbraw/zinc/19/94/69/388199469.db2.gz SISKDJORVULQDX-NEPJUHHUSA-N 1 2 247.342 2.437 20 0 BEADLO CC(C)[C@H](C)C(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456409272 388199616 /nfs/dbraw/zinc/19/96/16/388199616.db2.gz ZNATZOKCEXXILA-VWYCJHECSA-N 1 2 235.331 2.297 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456403309 388199701 /nfs/dbraw/zinc/19/97/01/388199701.db2.gz FNLBLUVQZNCQKK-QCNOEVLYSA-N 1 2 247.342 2.441 20 0 BEADLO CC[C@H](C)CC(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456417594 388200194 /nfs/dbraw/zinc/20/01/94/388200194.db2.gz KSEXIYMGPLMKGA-DCAQKATOSA-N 1 2 235.331 2.441 20 0 BEADLO CC[C@H](C)CC(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456417593 388200299 /nfs/dbraw/zinc/20/02/99/388200299.db2.gz KSEXIYMGPLMKGA-AXFHLTTASA-N 1 2 235.331 2.441 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)[C@H]2C[C@@H]2C2CC2)c2[nH+]ccn21 ZINC000456420425 388200361 /nfs/dbraw/zinc/20/03/61/388200361.db2.gz MNFSIMAFIOJZRY-ZDDJMSTPSA-N 1 2 245.326 2.051 20 0 BEADLO COCc1cnc(C[N@@H+]2CC[C@@H]2C2CC2)s1 ZINC000449427355 388202424 /nfs/dbraw/zinc/20/24/24/388202424.db2.gz NQSFRPBQHJCZNC-LLVKDONJSA-N 1 2 238.356 2.274 20 0 BEADLO COCc1cnc(C[N@H+]2CC[C@@H]2C2CC2)s1 ZINC000449427355 388202425 /nfs/dbraw/zinc/20/24/25/388202425.db2.gz NQSFRPBQHJCZNC-LLVKDONJSA-N 1 2 238.356 2.274 20 0 BEADLO CC[N@H+](Cc1cnc(C(C)C)s1)C1COC1 ZINC000449427698 388203064 /nfs/dbraw/zinc/20/30/64/388203064.db2.gz STUWFSSKNNTYKS-UHFFFAOYSA-N 1 2 240.372 2.487 20 0 BEADLO CC[N@@H+](Cc1cnc(C(C)C)s1)C1COC1 ZINC000449427698 388203067 /nfs/dbraw/zinc/20/30/67/388203067.db2.gz STUWFSSKNNTYKS-UHFFFAOYSA-N 1 2 240.372 2.487 20 0 BEADLO CC(C)n1cc(C[NH+]2CCC(CF)CC2)nn1 ZINC000449460303 388211172 /nfs/dbraw/zinc/21/11/72/388211172.db2.gz REZXQZHMIQXCIM-UHFFFAOYSA-N 1 2 240.326 2.041 20 0 BEADLO CCCc1noc(C[N@H+](C)[C@H]2CC2(C)C)n1 ZINC000489451705 388215170 /nfs/dbraw/zinc/21/51/70/388215170.db2.gz RXLCTZHOMFULEV-VIFPVBQESA-N 1 2 223.320 2.252 20 0 BEADLO CCCc1noc(C[N@@H+](C)[C@H]2CC2(C)C)n1 ZINC000489451705 388215172 /nfs/dbraw/zinc/21/51/72/388215172.db2.gz RXLCTZHOMFULEV-VIFPVBQESA-N 1 2 223.320 2.252 20 0 BEADLO CO[C@@](C)(C[NH2+]Cc1ccn[nH]1)c1ccccc1 ZINC000449485162 388215907 /nfs/dbraw/zinc/21/59/07/388215907.db2.gz PIKCUGRHRSNJFP-AWEZNQCLSA-N 1 2 245.326 2.061 20 0 BEADLO CC(C)Cc1noc(C[N@H+](C)[C@H]2CC2(C)C)n1 ZINC000489497328 388218148 /nfs/dbraw/zinc/21/81/48/388218148.db2.gz GXBYVRJWFJPKBT-JTQLQIEISA-N 1 2 237.347 2.498 20 0 BEADLO CC(C)Cc1noc(C[N@@H+](C)[C@H]2CC2(C)C)n1 ZINC000489497328 388218150 /nfs/dbraw/zinc/21/81/50/388218150.db2.gz GXBYVRJWFJPKBT-JTQLQIEISA-N 1 2 237.347 2.498 20 0 BEADLO CS[C@@H](C)C(=O)NCc1c[nH+]c(C)cc1C ZINC000456838630 388226514 /nfs/dbraw/zinc/22/65/14/388226514.db2.gz CGJUMJJROYZSKS-JTQLQIEISA-N 1 2 238.356 2.066 20 0 BEADLO CCCCN(c1nc(C)[nH+]c(N(C)C)n1)C1CC1 ZINC000490056211 388232147 /nfs/dbraw/zinc/23/21/47/388232147.db2.gz BGKSJKAZSRDZEZ-UHFFFAOYSA-N 1 2 249.362 2.015 20 0 BEADLO CCCCN(c1nc(N(C)C)nc(C)[nH+]1)C1CC1 ZINC000490056211 388232150 /nfs/dbraw/zinc/23/21/50/388232150.db2.gz BGKSJKAZSRDZEZ-UHFFFAOYSA-N 1 2 249.362 2.015 20 0 BEADLO C[C@@H](O)C[N@H+](CC(F)F)CC1(C)CCC1 ZINC000449627863 388245528 /nfs/dbraw/zinc/24/55/28/388245528.db2.gz HOWOYNOFTCTKLH-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO C[C@@H](O)C[N@@H+](CC(F)F)CC1(C)CCC1 ZINC000449627863 388245530 /nfs/dbraw/zinc/24/55/30/388245530.db2.gz HOWOYNOFTCTKLH-SECBINFHSA-N 1 2 221.291 2.125 20 0 BEADLO C[N@H+](Cc1cscn1)Cc1ccc(CO)cc1 ZINC000163423088 388287706 /nfs/dbraw/zinc/28/77/06/388287706.db2.gz BKECWNXMMZFRKC-UHFFFAOYSA-N 1 2 248.351 2.267 20 0 BEADLO C[N@@H+](Cc1cscn1)Cc1ccc(CO)cc1 ZINC000163423088 388287707 /nfs/dbraw/zinc/28/77/07/388287707.db2.gz BKECWNXMMZFRKC-UHFFFAOYSA-N 1 2 248.351 2.267 20 0 BEADLO C[C@@H](O)C[N@H+](CC(F)F)[C@H]1C=CCCC1 ZINC000451850084 388300793 /nfs/dbraw/zinc/30/07/93/388300793.db2.gz KFAMNMGRBYBUKD-ZJUUUORDSA-N 1 2 219.275 2.043 20 0 BEADLO C[C@@H](O)C[N@@H+](CC(F)F)[C@H]1C=CCCC1 ZINC000451850084 388300795 /nfs/dbraw/zinc/30/07/95/388300795.db2.gz KFAMNMGRBYBUKD-ZJUUUORDSA-N 1 2 219.275 2.043 20 0 BEADLO CC=CC=CC(=O)Nc1cc[nH+]cc1CC ZINC000491847282 388324614 /nfs/dbraw/zinc/32/46/14/388324614.db2.gz OIQUUYKOYHDJLP-WZWXSLMZSA-N 1 2 216.284 2.137 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)/C=C\C1CC1 ZINC000491965841 388329881 /nfs/dbraw/zinc/32/98/81/388329881.db2.gz RNVDJJUTRMAUQG-FPLPWBNLSA-N 1 2 231.299 2.052 20 0 BEADLO FC(F)(F)[C@H]1CCC[N@H+](Cc2ncccn2)C1 ZINC000191869922 388268364 /nfs/dbraw/zinc/26/83/64/388268364.db2.gz UZFPYRYQMGCDOL-VIFPVBQESA-N 1 2 245.248 2.251 20 0 BEADLO FC(F)(F)[C@H]1CCC[N@@H+](Cc2ncccn2)C1 ZINC000191869922 388268365 /nfs/dbraw/zinc/26/83/65/388268365.db2.gz UZFPYRYQMGCDOL-VIFPVBQESA-N 1 2 245.248 2.251 20 0 BEADLO CC[C@@H](C)N(C)C(=O)/C=C/c1[nH+]ccn1CC ZINC000492301015 388340768 /nfs/dbraw/zinc/34/07/68/388340768.db2.gz SNLHMSMBLUFPAD-WSKFYRRCSA-N 1 2 235.331 2.173 20 0 BEADLO CCCN(C(=O)/C=C\c1[nH+]ccn1CC)C1CC1 ZINC000492329676 388341617 /nfs/dbraw/zinc/34/16/17/388341617.db2.gz LLHROYWGDLXEOQ-FPLPWBNLSA-N 1 2 247.342 2.317 20 0 BEADLO CCn1cc[nH+]c1/C=C\C(=O)N1CC[C@H](C)[C@@H]1C ZINC000492410339 388343636 /nfs/dbraw/zinc/34/36/36/388343636.db2.gz RIZHQPLFFCHSNK-YGABWQLJSA-N 1 2 247.342 2.173 20 0 BEADLO CCc1ccccc1C[NH2+][C@H](C)c1ncn(C)n1 ZINC000275580744 388345003 /nfs/dbraw/zinc/34/50/03/388345003.db2.gz IANXZHDAHDAEDB-LLVKDONJSA-N 1 2 244.342 2.228 20 0 BEADLO C[C@H](N(C)c1nc[nH+]c(N)c1Cl)C1(C)CC1 ZINC000302916367 388346021 /nfs/dbraw/zinc/34/60/21/388346021.db2.gz WFPZKJGYPKVJGX-ZETCQYMHSA-N 1 2 240.738 2.337 20 0 BEADLO C[C@H](N(C)c1[nH+]cnc(N)c1Cl)C1(C)CC1 ZINC000302916367 388346024 /nfs/dbraw/zinc/34/60/24/388346024.db2.gz WFPZKJGYPKVJGX-ZETCQYMHSA-N 1 2 240.738 2.337 20 0 BEADLO CCC[C@H]([NH2+][C@H]1C[C@@H]1CC)C(=O)OCC ZINC000233358887 388346007 /nfs/dbraw/zinc/34/60/07/388346007.db2.gz DTIRMBCFMJCAEE-DCAQKATOSA-N 1 2 213.321 2.106 20 0 BEADLO CO[C@@H](C)CNc1cc[nH+]c2ccncc12 ZINC000276103408 388347093 /nfs/dbraw/zinc/34/70/93/388347093.db2.gz YMYJLLFDJVDMHB-VIFPVBQESA-N 1 2 217.272 2.077 20 0 BEADLO CC[C@@H](CO)Nc1[nH+]ccc2c(OC)cccc21 ZINC000233871872 388349236 /nfs/dbraw/zinc/34/92/36/388349236.db2.gz QDFUNWGLWSISLX-JTQLQIEISA-N 1 2 246.310 2.426 20 0 BEADLO Cc1n[nH]c(C)c1CNc1cc[nH+]cc1F ZINC000277099746 388352545 /nfs/dbraw/zinc/35/25/45/388352545.db2.gz VCIVCMNURXTIAG-UHFFFAOYSA-N 1 2 220.251 2.173 20 0 BEADLO CC[C@H]1CCCCN1c1nc[nH+]c(N)c1Cl ZINC000227840478 388371872 /nfs/dbraw/zinc/37/18/72/388371872.db2.gz VEYKDZDQQWIYJE-QMMMGPOBSA-N 1 2 240.738 2.481 20 0 BEADLO CC[C@H]1CCCCN1c1[nH+]cnc(N)c1Cl ZINC000227840478 388371876 /nfs/dbraw/zinc/37/18/76/388371876.db2.gz VEYKDZDQQWIYJE-QMMMGPOBSA-N 1 2 240.738 2.481 20 0 BEADLO C[C@H](CF)[NH2+]Cc1c(F)cccc1F ZINC000288381382 388374960 /nfs/dbraw/zinc/37/49/60/388374960.db2.gz GADRIDKXGACVCD-SSDOTTSWSA-N 1 2 203.207 2.412 20 0 BEADLO Nc1[nH+]cnc(NCCC(F)(F)F)c1Cl ZINC000236360919 388379724 /nfs/dbraw/zinc/37/97/24/388379724.db2.gz XJNVLDBSVKJSKB-UHFFFAOYSA-N 1 2 240.616 2.077 20 0 BEADLO Nc1nc[nH+]c(NCCC(F)(F)F)c1Cl ZINC000236360919 388379727 /nfs/dbraw/zinc/37/97/27/388379727.db2.gz XJNVLDBSVKJSKB-UHFFFAOYSA-N 1 2 240.616 2.077 20 0 BEADLO Cc1[nH]c(C(=O)NC[C@H]2CCC[C@@H]2C2CC2)c[nH+]1 ZINC000572847306 388380390 /nfs/dbraw/zinc/38/03/90/388380390.db2.gz GTTKIAGBQIRJPI-VXGBXAGGSA-N 1 2 247.342 2.274 20 0 BEADLO COc1c(N)[nH+]cnc1N[C@H](C1CC1)C1CCC1 ZINC000324967586 388392075 /nfs/dbraw/zinc/39/20/75/388392075.db2.gz KPTXOLUTVFKLAF-JTQLQIEISA-N 1 2 248.330 2.058 20 0 BEADLO COc1c(N)nc[nH+]c1N[C@H](C1CC1)C1CCC1 ZINC000324967586 388392078 /nfs/dbraw/zinc/39/20/78/388392078.db2.gz KPTXOLUTVFKLAF-JTQLQIEISA-N 1 2 248.330 2.058 20 0 BEADLO CC(C)[C@H]1CCCN1c1nc[nH+]c(N)c1Cl ZINC000232731491 388392083 /nfs/dbraw/zinc/39/20/83/388392083.db2.gz SMXPLLQTAKVXBT-MRVPVSSYSA-N 1 2 240.738 2.337 20 0 BEADLO CC(C)[C@H]1CCCN1c1[nH+]cnc(N)c1Cl ZINC000232731491 388392084 /nfs/dbraw/zinc/39/20/84/388392084.db2.gz SMXPLLQTAKVXBT-MRVPVSSYSA-N 1 2 240.738 2.337 20 0 BEADLO CC[C@H](CO)[N@H+](C)C/C(Cl)=C/Cl ZINC000294000316 388393675 /nfs/dbraw/zinc/39/36/75/388393675.db2.gz XFUJQMIDMBYVOK-RBMBQVQZSA-N 1 2 212.120 2.008 20 0 BEADLO CC[C@H](CO)[N@@H+](C)C/C(Cl)=C/Cl ZINC000294000316 388393679 /nfs/dbraw/zinc/39/36/79/388393679.db2.gz XFUJQMIDMBYVOK-RBMBQVQZSA-N 1 2 212.120 2.008 20 0 BEADLO CC(C)c1nc(C[NH+]2C3CCC2CC3)no1 ZINC000516617245 388395330 /nfs/dbraw/zinc/39/53/30/388395330.db2.gz FKUFHQFBFPSIGG-UHFFFAOYSA-N 1 2 221.304 2.320 20 0 BEADLO Cc1nc(C)c(C[NH2+]Cc2cocn2)s1 ZINC000237609381 388397279 /nfs/dbraw/zinc/39/72/79/388397279.db2.gz ILSRISUVRWCFEM-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO COC(=O)[C@H]1CCC[N@@H+]1Cc1csc(C)c1 ZINC000294553952 388402079 /nfs/dbraw/zinc/40/20/79/388402079.db2.gz LGTPFSJYIYCQNJ-LLVKDONJSA-N 1 2 239.340 2.194 20 0 BEADLO COC(=O)[C@H]1CCC[N@H+]1Cc1csc(C)c1 ZINC000294553952 388402081 /nfs/dbraw/zinc/40/20/81/388402081.db2.gz LGTPFSJYIYCQNJ-LLVKDONJSA-N 1 2 239.340 2.194 20 0 BEADLO C/C=C(/C=C/C(=O)N[C@H](C)Cn1cc[nH+]c1)CC ZINC000492137207 388336183 /nfs/dbraw/zinc/33/61/83/388336183.db2.gz OKCLEINQTCERDL-JDENHLHOSA-N 1 2 247.342 2.300 20 0 BEADLO C[C@H]([NH2+][C@@H]1C=CCCCCC1)c1ncn(C)n1 ZINC000294711280 388403924 /nfs/dbraw/zinc/40/39/24/388403924.db2.gz VDKZOMHBZJFHBX-NWDGAFQWSA-N 1 2 234.347 2.355 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)NCC1CCCC1 ZINC000492276817 388340212 /nfs/dbraw/zinc/34/02/12/388340212.db2.gz MYICOVCSCBBFFD-BQYQJAHWSA-N 1 2 247.342 2.223 20 0 BEADLO CCC(C)(C)OCCNc1cc[nH+]c(C)n1 ZINC000308515751 388441108 /nfs/dbraw/zinc/44/11/08/388441108.db2.gz XBDDBLLICKBJBY-UHFFFAOYSA-N 1 2 223.320 2.402 20 0 BEADLO CCOC(=O)[C@]1(C(C)C)CC[N@H+](CC(F)F)C1 ZINC000194874418 388453260 /nfs/dbraw/zinc/45/32/60/388453260.db2.gz HWSQPDGKVYXIOH-GFCCVEGCSA-N 1 2 249.301 2.163 20 0 BEADLO CCOC(=O)[C@]1(C(C)C)CC[N@@H+](CC(F)F)C1 ZINC000194874418 388453261 /nfs/dbraw/zinc/45/32/61/388453261.db2.gz HWSQPDGKVYXIOH-GFCCVEGCSA-N 1 2 249.301 2.163 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H]1CS[C@H](C(C)(C)C)C1 ZINC000309578234 388458303 /nfs/dbraw/zinc/45/83/03/388458303.db2.gz POMAPUZLIXQZPH-UTLUCORTSA-N 1 2 245.388 2.058 20 0 BEADLO Cc1nocc1C[NH2+]Cc1nc(C)c(C)s1 ZINC000339290438 388481381 /nfs/dbraw/zinc/48/13/81/388481381.db2.gz KGTHVBZUYIDJRF-UHFFFAOYSA-N 1 2 237.328 2.346 20 0 BEADLO CC(C)c1nc(N[C@H]2CCC[C@H]2F)cc[nH+]1 ZINC000338848022 388478281 /nfs/dbraw/zinc/47/82/81/388478281.db2.gz YXRNGIALQFKBIY-ZJUUUORDSA-N 1 2 223.295 2.324 20 0 BEADLO c1nc(N2CCCCC2)cc(NC2CC2)[nH+]1 ZINC000243253034 388478618 /nfs/dbraw/zinc/47/86/18/388478618.db2.gz KQUOGAYYNMYDDK-UHFFFAOYSA-N 1 2 218.304 2.041 20 0 BEADLO c1nc(NC2CC2)cc(N2CCCCC2)[nH+]1 ZINC000243253034 388478620 /nfs/dbraw/zinc/47/86/20/388478620.db2.gz KQUOGAYYNMYDDK-UHFFFAOYSA-N 1 2 218.304 2.041 20 0 BEADLO C[C@@H]1Cc2ncn(Cc3c[nH+]cn3C)c2C[C@H]1C ZINC000295082459 388407641 /nfs/dbraw/zinc/40/76/41/388407641.db2.gz DMTKQODXQGAPLA-GHMZBOCLSA-N 1 2 244.342 2.036 20 0 BEADLO CO[C@@H](C)C[N@H+](C)Cc1csc(Cl)n1 ZINC000295161621 388409828 /nfs/dbraw/zinc/40/98/28/388409828.db2.gz GYLZIOBZWJGHMQ-ZETCQYMHSA-N 1 2 234.752 2.263 20 0 BEADLO CO[C@@H](C)C[N@@H+](C)Cc1csc(Cl)n1 ZINC000295161621 388409830 /nfs/dbraw/zinc/40/98/30/388409830.db2.gz GYLZIOBZWJGHMQ-ZETCQYMHSA-N 1 2 234.752 2.263 20 0 BEADLO C[C@H](N[C@H]1C[C@@H](C)n2cc[nH+]c21)C(F)(F)F ZINC000295225091 388410157 /nfs/dbraw/zinc/41/01/57/388410157.db2.gz NDSFRHZLKQQPOE-CSMHCCOUSA-N 1 2 233.237 2.429 20 0 BEADLO CC[C@@H](CC(C)C)C(=O)NCc1[nH]cc[nH+]1 ZINC000308083331 388431417 /nfs/dbraw/zinc/43/14/17/388431417.db2.gz BNDJPPNIZPXSHG-JTQLQIEISA-N 1 2 223.320 2.098 20 0 BEADLO Cc1[nH]c(CN[C@H](C)c2cscn2)[nH+]c1C ZINC000573221777 388433906 /nfs/dbraw/zinc/43/39/06/388433906.db2.gz PGOMDQFTXXIOCM-SECBINFHSA-N 1 2 236.344 2.334 20 0 BEADLO CCC[C@H]([NH2+]C[C@@](C)(CC)OC)C(=O)OCC ZINC000322578548 388439150 /nfs/dbraw/zinc/43/91/50/388439150.db2.gz CFPJJWDSXBIDDA-WCQYABFASA-N 1 2 245.363 2.123 20 0 BEADLO CC[C@@H]1C[N@H+](C/C=C(\C)Cl)C[C@H](C)[S@]1=O ZINC000528506886 388537737 /nfs/dbraw/zinc/53/77/37/388537737.db2.gz MSRGTVWXETZQIH-OZEMPCBFSA-N 1 2 249.807 2.360 20 0 BEADLO CC[C@@H]1C[N@@H+](C/C=C(\C)Cl)C[C@H](C)[S@]1=O ZINC000528506886 388537739 /nfs/dbraw/zinc/53/77/39/388537739.db2.gz MSRGTVWXETZQIH-OZEMPCBFSA-N 1 2 249.807 2.360 20 0 BEADLO CCC1CCN(C(=O)[C@H](C)Cc2c[nH+]c[nH]2)CC1 ZINC000516489740 256776729 /nfs/dbraw/zinc/77/67/29/256776729.db2.gz FVYXGSYBQFFAMC-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO CCC1CCN(C(=O)[C@H](C)Cc2c[nH]c[nH+]2)CC1 ZINC000516489740 256776731 /nfs/dbraw/zinc/77/67/31/256776731.db2.gz FVYXGSYBQFFAMC-LLVKDONJSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@]1(CO)CCC[N@@H+]1Cc1ncc(Cl)s1 ZINC000548487380 388543492 /nfs/dbraw/zinc/54/34/92/388543492.db2.gz KGJGDOCLWHFPJI-SNVBAGLBSA-N 1 2 246.763 2.143 20 0 BEADLO C[C@]1(CO)CCC[N@H+]1Cc1ncc(Cl)s1 ZINC000548487380 388543495 /nfs/dbraw/zinc/54/34/95/388543495.db2.gz KGJGDOCLWHFPJI-SNVBAGLBSA-N 1 2 246.763 2.143 20 0 BEADLO CC[C@H]1CN(Cc2[nH+]ccn2C(C)C)CCO1 ZINC000195514404 256783572 /nfs/dbraw/zinc/78/35/72/256783572.db2.gz JQRJRGIWVBLWMQ-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO Cc1nc(C[N@@H+](C)[C@@H]2CCC[C@H](C)C2)no1 ZINC000079872529 388548410 /nfs/dbraw/zinc/54/84/10/388548410.db2.gz AFBHZJKCEYYVRU-GXSJLCMTSA-N 1 2 223.320 2.389 20 0 BEADLO Cc1nc(C[N@H+](C)[C@@H]2CCC[C@H](C)C2)no1 ZINC000079872529 388548412 /nfs/dbraw/zinc/54/84/12/388548412.db2.gz AFBHZJKCEYYVRU-GXSJLCMTSA-N 1 2 223.320 2.389 20 0 BEADLO COC(=O)[C@@H](c1cccnc1)[N@H+](C)CCC1CC1 ZINC000135265190 388488081 /nfs/dbraw/zinc/48/80/81/388488081.db2.gz NFGPUDDMUAOAPH-CYBMUJFWSA-N 1 2 248.326 2.028 20 0 BEADLO COC(=O)[C@@H](c1cccnc1)[N@@H+](C)CCC1CC1 ZINC000135265190 388488083 /nfs/dbraw/zinc/48/80/83/388488083.db2.gz NFGPUDDMUAOAPH-CYBMUJFWSA-N 1 2 248.326 2.028 20 0 BEADLO C[C@H]([NH2+]Cc1cnn[nH]1)c1cc2ccccc2o1 ZINC000340245801 388489081 /nfs/dbraw/zinc/48/90/81/388489081.db2.gz RLEHVFOFBAFYRW-VIFPVBQESA-N 1 2 242.282 2.402 20 0 BEADLO CC(C)c1nc(C[N@H+](C)CCC2CC2)no1 ZINC000135300625 388490373 /nfs/dbraw/zinc/49/03/73/388490373.db2.gz CHHKUZWYIDEOAX-UHFFFAOYSA-N 1 2 223.320 2.425 20 0 BEADLO CC(C)c1nc(C[N@@H+](C)CCC2CC2)no1 ZINC000135300625 388490375 /nfs/dbraw/zinc/49/03/75/388490375.db2.gz CHHKUZWYIDEOAX-UHFFFAOYSA-N 1 2 223.320 2.425 20 0 BEADLO Cc1csc(C[NH2+]Cc2cn[nH]c2C)c1 ZINC000344617220 388507867 /nfs/dbraw/zinc/50/78/67/388507867.db2.gz URAVXCJENUWHHU-UHFFFAOYSA-N 1 2 221.329 2.378 20 0 BEADLO COC(=O)[C@@H]([NH2+]Cc1cc(C)cs1)C1CC1 ZINC000344728114 388508423 /nfs/dbraw/zinc/50/84/23/388508423.db2.gz VCSVATOYYIGTCN-NSHDSACASA-N 1 2 239.340 2.098 20 0 BEADLO CCCCc1noc(C[N@H+]2[C@H](C)C[C@@H]2C)n1 ZINC000548097938 388510001 /nfs/dbraw/zinc/51/00/01/388510001.db2.gz STUFJLNMGPDYPH-AOOOYVTPSA-N 1 2 223.320 2.395 20 0 BEADLO CCCCc1noc(C[N@@H+]2[C@H](C)C[C@@H]2C)n1 ZINC000548097938 388510005 /nfs/dbraw/zinc/51/00/05/388510005.db2.gz STUFJLNMGPDYPH-AOOOYVTPSA-N 1 2 223.320 2.395 20 0 BEADLO CCO[C@H](C)c1noc(C[NH+]2[C@H](C)C[C@H]2C)n1 ZINC000548096225 388510302 /nfs/dbraw/zinc/51/03/02/388510302.db2.gz IRXCMXUIRFZVQC-OPRDCNLKSA-N 1 2 239.319 2.150 20 0 BEADLO CCC[C@H]([NH2+][C@@H]1CS[C@@H](C)C1)C(=O)OCC ZINC000397941782 388512805 /nfs/dbraw/zinc/51/28/05/388512805.db2.gz QMRKQSIRMDUPQF-DCAQKATOSA-N 1 2 245.388 2.202 20 0 BEADLO CC(C)[C@@H]1C[C@H]1C(=O)NCCCCn1cc[nH+]c1 ZINC000548121311 388514416 /nfs/dbraw/zinc/51/44/16/388514416.db2.gz GVNAAXDAYBJTKT-QWHCGFSZSA-N 1 2 249.358 2.072 20 0 BEADLO C[C@@H]1CCCC[C@H]1CC(=O)NCCn1cc[nH+]c1 ZINC000516840750 388519891 /nfs/dbraw/zinc/51/98/91/388519891.db2.gz DHBNOSSSVGWOSK-OLZOCXBDSA-N 1 2 249.358 2.216 20 0 BEADLO CCOC[C@H](C)Nc1[nH+]c2ccccc2n1C ZINC000079046414 388522355 /nfs/dbraw/zinc/52/23/55/388522355.db2.gz CHWJDIGKHAZXQC-JTQLQIEISA-N 1 2 233.315 2.410 20 0 BEADLO C[C@H]([NH2+]Cc1ncccc1Cl)c1cn[nH]c1 ZINC000528445367 388527505 /nfs/dbraw/zinc/52/75/05/388527505.db2.gz CJDCJVKGKBHDTG-QMMMGPOBSA-N 1 2 236.706 2.309 20 0 BEADLO C/C(Cl)=C\C[NH2+][C@H](C)c1nnc(C)o1 ZINC000528450362 388527986 /nfs/dbraw/zinc/52/79/86/388527986.db2.gz KTIBCAMXKPIAGB-PTYLAXBQSA-N 1 2 215.684 2.171 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N3C[C@@H](C)[C@@H]3C)ccn12 ZINC000516193667 256767175 /nfs/dbraw/zinc/76/71/75/256767175.db2.gz WFOGKAQFMUUCMT-KOLCDFICSA-N 1 2 243.310 2.123 20 0 BEADLO C/C(Cl)=C/C[N@@H+]1CCC(=O)[C@@H](C)C1 ZINC000528462352 388529550 /nfs/dbraw/zinc/52/95/50/388529550.db2.gz WQDNZYYQFAQEAW-CLJBBPMWSA-N 1 2 201.697 2.040 20 0 BEADLO C/C(Cl)=C/C[N@H+]1CCC(=O)[C@@H](C)C1 ZINC000528462352 388529552 /nfs/dbraw/zinc/52/95/52/388529552.db2.gz WQDNZYYQFAQEAW-CLJBBPMWSA-N 1 2 201.697 2.040 20 0 BEADLO CC[C@H]1C(=O)N(CC)CC[N@H+]1C/C=C(/C)Cl ZINC000528463213 388529656 /nfs/dbraw/zinc/52/96/56/388529656.db2.gz GTGUZZYMVJWBBQ-YAEJEKNGSA-N 1 2 244.766 2.072 20 0 BEADLO CC[C@H]1C(=O)N(CC)CC[N@@H+]1C/C=C(/C)Cl ZINC000528463213 388529658 /nfs/dbraw/zinc/52/96/58/388529658.db2.gz GTGUZZYMVJWBBQ-YAEJEKNGSA-N 1 2 244.766 2.072 20 0 BEADLO C/C(Cl)=C\C[N@@H+]1CCO[C@H](COC(C)C)C1 ZINC000528461062 388529773 /nfs/dbraw/zinc/52/97/73/388529773.db2.gz ZSAXHQNSOYABEE-QNCMIEPLSA-N 1 2 247.766 2.255 20 0 BEADLO C/C(Cl)=C\C[N@H+]1CCO[C@H](COC(C)C)C1 ZINC000528461062 388529776 /nfs/dbraw/zinc/52/97/76/388529776.db2.gz ZSAXHQNSOYABEE-QNCMIEPLSA-N 1 2 247.766 2.255 20 0 BEADLO CCC[C@@]1(C)C(=O)NCC[N@H+]1C/C=C(\C)Cl ZINC000528477446 388533156 /nfs/dbraw/zinc/53/31/56/388533156.db2.gz WBSIMKCJXKGOTJ-DJTWPOEFSA-N 1 2 244.766 2.120 20 0 BEADLO CCC[C@@]1(C)C(=O)NCC[N@@H+]1C/C=C(\C)Cl ZINC000528477446 388533158 /nfs/dbraw/zinc/53/31/58/388533158.db2.gz WBSIMKCJXKGOTJ-DJTWPOEFSA-N 1 2 244.766 2.120 20 0 BEADLO CC(C)c1nc(N[C@@H]2CCCC[C@@H]2O)cc[nH+]1 ZINC000106465299 388595679 /nfs/dbraw/zinc/59/56/79/388595679.db2.gz AQJCAIPIJUCESS-MNOVXSKESA-N 1 2 235.331 2.315 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2C[C@H]2c2ccsc2)c[nH+]1 ZINC000529997891 388602508 /nfs/dbraw/zinc/60/25/08/388602508.db2.gz XROFSXKYQLXWHV-VHSXEESVSA-N 1 2 247.323 2.066 20 0 BEADLO Cc1ccc(CN(C)c2cnn(C)c2)c(C)[nH+]1 ZINC000187119531 388605782 /nfs/dbraw/zinc/60/57/82/388605782.db2.gz DPNAINBCGPEVMQ-UHFFFAOYSA-N 1 2 230.315 2.068 20 0 BEADLO Cc1csc(C[N@@H+]2CCOC3(CCC3)C2)n1 ZINC000154365606 388612748 /nfs/dbraw/zinc/61/27/48/388612748.db2.gz CDCCYGSQUJKMHH-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO Cc1csc(C[N@H+]2CCOC3(CCC3)C2)n1 ZINC000154365606 388612752 /nfs/dbraw/zinc/61/27/52/388612752.db2.gz CDCCYGSQUJKMHH-UHFFFAOYSA-N 1 2 238.356 2.206 20 0 BEADLO CCC(F)(F)C[NH2+]Cc1ccnn1CC1CC1 ZINC000623679047 388613869 /nfs/dbraw/zinc/61/38/69/388613869.db2.gz GRLFBEVQWQEJIB-UHFFFAOYSA-N 1 2 243.301 2.428 20 0 BEADLO C=Cn1cc(C[NH2+]CC(F)(F)CC)cn1 ZINC000623678922 388614094 /nfs/dbraw/zinc/61/40/94/388614094.db2.gz BHNQOYMLGVMECI-UHFFFAOYSA-N 1 2 215.247 2.119 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CC2CC1(c1nc(C)no1)C2 ZINC000528619325 388551838 /nfs/dbraw/zinc/55/18/38/388551838.db2.gz VVVWXJLNRLEFKZ-SQLBVSGCSA-N 1 2 239.294 2.047 20 0 BEADLO CC[C@@H](F)C[N@H+]1CC2CC1(c1nc(C)no1)C2 ZINC000528619325 388551841 /nfs/dbraw/zinc/55/18/41/388551841.db2.gz VVVWXJLNRLEFKZ-SQLBVSGCSA-N 1 2 239.294 2.047 20 0 BEADLO COc1ccccc1NC(=O)C[NH+]1[C@@H](C)C[C@@H]1C ZINC000548754369 388557334 /nfs/dbraw/zinc/55/73/34/388557334.db2.gz BATDCUHZLDRFBF-QWRGUYRKSA-N 1 2 248.326 2.116 20 0 BEADLO Cc1c[nH+]c(C)nc1NC[C@@H]1CCC(F)(F)C1 ZINC000521068356 388561781 /nfs/dbraw/zinc/56/17/81/388561781.db2.gz VQRNTUNULKPPPS-SNVBAGLBSA-N 1 2 241.285 2.363 20 0 BEADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1cn(C)cn1 ZINC000528774750 388571304 /nfs/dbraw/zinc/57/13/04/388571304.db2.gz WDLCSDRXKHWLTO-VIFPVBQESA-N 1 2 229.274 2.040 20 0 BEADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1cn(C)cn1 ZINC000528774750 388571307 /nfs/dbraw/zinc/57/13/07/388571307.db2.gz WDLCSDRXKHWLTO-VIFPVBQESA-N 1 2 229.274 2.040 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2[C@H](C)C[C@@H]2C)s1 ZINC000549172706 388574925 /nfs/dbraw/zinc/57/49/25/388574925.db2.gz IATHUUFXUYHFIK-RNJXMRFFSA-N 1 2 211.334 2.390 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2[C@H](C)C[C@@H]2C)s1 ZINC000549172706 388574927 /nfs/dbraw/zinc/57/49/27/388574927.db2.gz IATHUUFXUYHFIK-RNJXMRFFSA-N 1 2 211.334 2.390 20 0 BEADLO Cc1csc(C[N@@H+]2CC[C@H](OC(F)F)C2)n1 ZINC000549415661 388577319 /nfs/dbraw/zinc/57/73/19/388577319.db2.gz LWDSNMVCNLAMJS-QMMMGPOBSA-N 1 2 248.298 2.265 20 0 BEADLO Cc1csc(C[N@H+]2CC[C@H](OC(F)F)C2)n1 ZINC000549415661 388577321 /nfs/dbraw/zinc/57/73/21/388577321.db2.gz LWDSNMVCNLAMJS-QMMMGPOBSA-N 1 2 248.298 2.265 20 0 BEADLO Cc1nc(C[N@H+](C)CC2CCCC2)no1 ZINC000064020842 388667296 /nfs/dbraw/zinc/66/72/96/388667296.db2.gz GXGHDQKRPYEBDY-UHFFFAOYSA-N 1 2 209.293 2.000 20 0 BEADLO Cc1nc(C[N@@H+](C)CC2CCCC2)no1 ZINC000064020842 388667297 /nfs/dbraw/zinc/66/72/97/388667297.db2.gz GXGHDQKRPYEBDY-UHFFFAOYSA-N 1 2 209.293 2.000 20 0 BEADLO Cc1cnc([C@H](C)[NH2+]Cc2cncn2C)s1 ZINC000125184605 388668993 /nfs/dbraw/zinc/66/89/93/388668993.db2.gz YQFBTUYTSBMXGZ-VIFPVBQESA-N 1 2 236.344 2.036 20 0 BEADLO CC(C)=CCNC(=O)c1ccc2[nH+]ccn2c1 ZINC000191755248 388669417 /nfs/dbraw/zinc/66/94/17/388669417.db2.gz FFDXXRLDQGHJHU-UHFFFAOYSA-N 1 2 229.283 2.030 20 0 BEADLO CCOCC[N@H+](C)Cc1csc(CC)n1 ZINC000064517041 388671308 /nfs/dbraw/zinc/67/13/08/388671308.db2.gz RQHTUQDUKVXOBS-UHFFFAOYSA-N 1 2 228.361 2.174 20 0 BEADLO CCOCC[N@@H+](C)Cc1csc(CC)n1 ZINC000064517041 388671309 /nfs/dbraw/zinc/67/13/09/388671309.db2.gz RQHTUQDUKVXOBS-UHFFFAOYSA-N 1 2 228.361 2.174 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)n[nH]1 ZINC000248547746 388683719 /nfs/dbraw/zinc/68/37/19/388683719.db2.gz FGMNRDGZAGCJEZ-WDEREUQCSA-N 1 2 234.347 2.132 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)n[nH]1 ZINC000248547746 388683721 /nfs/dbraw/zinc/68/37/21/388683721.db2.gz FGMNRDGZAGCJEZ-WDEREUQCSA-N 1 2 234.347 2.132 20 0 BEADLO CC(C)OCCC[N@@H+]1Cc2cccnc2C1 ZINC000551040436 388620410 /nfs/dbraw/zinc/62/04/10/388620410.db2.gz IABGNSBYFWNYRV-UHFFFAOYSA-N 1 2 220.316 2.212 20 0 BEADLO CC(C)OCCC[N@H+]1Cc2cccnc2C1 ZINC000551040436 388620413 /nfs/dbraw/zinc/62/04/13/388620413.db2.gz IABGNSBYFWNYRV-UHFFFAOYSA-N 1 2 220.316 2.212 20 0 BEADLO C[C@@H]1CCCC[C@H]1NC(=O)CCCn1cc[nH+]c1 ZINC000620409499 388646870 /nfs/dbraw/zinc/64/68/70/388646870.db2.gz QHWWFEHFZIMNIM-CHWSQXEVSA-N 1 2 249.358 2.358 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@H](C)[C@H]2C)no1 ZINC000246937478 388655038 /nfs/dbraw/zinc/65/50/38/388655038.db2.gz QQAXSGPRRHMYSW-VHSXEESVSA-N 1 2 223.320 2.252 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@H](C)[C@H]2C)no1 ZINC000246937478 388655040 /nfs/dbraw/zinc/65/50/40/388655040.db2.gz QQAXSGPRRHMYSW-VHSXEESVSA-N 1 2 223.320 2.252 20 0 BEADLO CSc1ccc(NCc2[nH]cc[nH+]2)nc1 ZINC000124559880 388663402 /nfs/dbraw/zinc/66/34/02/388663402.db2.gz WOWSSADKYAFCAR-UHFFFAOYSA-N 1 2 220.301 2.139 20 0 BEADLO CCC[C@H]([NH2+][C@@H](C)CSC)C(=O)OCC ZINC000128047227 388736655 /nfs/dbraw/zinc/73/66/55/388736655.db2.gz YPAJEHPQQSIEJP-UWVGGRQHSA-N 1 2 233.377 2.059 20 0 BEADLO CCc1nnc([C@H](C)[NH2+][C@H](C)c2ccoc2)[nH]1 ZINC000539063362 388746017 /nfs/dbraw/zinc/74/60/17/388746017.db2.gz BPZMXGVDYRDHQB-BDAKNGLRSA-N 1 2 234.303 2.372 20 0 BEADLO c1ccc(NCC[C@@H]2CCCCO2)[nH+]c1 ZINC000227315646 388748093 /nfs/dbraw/zinc/74/80/93/388748093.db2.gz JFFGRAKTMOXEGL-NSHDSACASA-N 1 2 206.289 2.453 20 0 BEADLO CSCCC(=O)Nc1cc[nH+]c(C)c1 ZINC000192968968 388690515 /nfs/dbraw/zinc/69/05/15/388690515.db2.gz UHXCVYKATWLDGN-UHFFFAOYSA-N 1 2 210.302 2.082 20 0 BEADLO Cc1nc(NC[C@@H]2CCCS2)cc[nH+]1 ZINC000087475376 388706926 /nfs/dbraw/zinc/70/69/26/388706926.db2.gz RIEQDNDLCFKZMC-VIFPVBQESA-N 1 2 209.318 2.093 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cnc(C)s2)CCO1 ZINC000066420622 388717678 /nfs/dbraw/zinc/71/76/78/388717678.db2.gz JWAQCZAPHVJOHE-SNVBAGLBSA-N 1 2 226.345 2.062 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cnc(C)s2)CCO1 ZINC000066420622 388717679 /nfs/dbraw/zinc/71/76/79/388717679.db2.gz JWAQCZAPHVJOHE-SNVBAGLBSA-N 1 2 226.345 2.062 20 0 BEADLO CC[C@@H](C)c1csc([C@@H]2COCC[NH2+]2)n1 ZINC000226468314 388719880 /nfs/dbraw/zinc/71/98/80/388719880.db2.gz MKLOQTVWJNKVDU-BDAKNGLRSA-N 1 2 226.345 2.318 20 0 BEADLO Cc1ccccc1[C@@H]1NC(=O)[C@H]2C[C@H](C)CC[N@H+]21 ZINC000249472941 388722908 /nfs/dbraw/zinc/72/29/08/388722908.db2.gz SOLISKPZZKGICU-LERXQTSPSA-N 1 2 244.338 2.224 20 0 BEADLO Cc1ccccc1[C@@H]1NC(=O)[C@H]2C[C@H](C)CC[N@@H+]21 ZINC000249472941 388722911 /nfs/dbraw/zinc/72/29/11/388722911.db2.gz SOLISKPZZKGICU-LERXQTSPSA-N 1 2 244.338 2.224 20 0 BEADLO COC(=O)[C@H]([NH2+]Cc1sccc1C)C1CC1 ZINC000227769402 388758527 /nfs/dbraw/zinc/75/85/27/388758527.db2.gz ZKSGVDPBBWTYLT-LLVKDONJSA-N 1 2 239.340 2.098 20 0 BEADLO Nc1[nH+]cnc(NCc2ccsc2)c1Cl ZINC000227848226 388759709 /nfs/dbraw/zinc/75/97/09/388759709.db2.gz FLKFUMCDUUSBFJ-UHFFFAOYSA-N 1 2 240.719 2.386 20 0 BEADLO Nc1nc[nH+]c(NCc2ccsc2)c1Cl ZINC000227848226 388759711 /nfs/dbraw/zinc/75/97/11/388759711.db2.gz FLKFUMCDUUSBFJ-UHFFFAOYSA-N 1 2 240.719 2.386 20 0 BEADLO CO[C@H]1C[C@@H](N(C)c2[nH+]c3ccccc3n2C)C1 ZINC000553603429 388783526 /nfs/dbraw/zinc/78/35/26/388783526.db2.gz DOYVOCGDBWMCOT-PHIMTYICSA-N 1 2 245.326 2.187 20 0 BEADLO Cc1c[nH+]c(C)nc1NCC(C1CC1)C1CC1 ZINC000564226319 388790982 /nfs/dbraw/zinc/79/09/82/388790982.db2.gz USATZXSYYURUPN-UHFFFAOYSA-N 1 2 231.343 2.363 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@H](OC(F)F)C2)cs1 ZINC000555070670 388838360 /nfs/dbraw/zinc/83/83/60/388838360.db2.gz GMDOFWCWTORYBC-VIFPVBQESA-N 1 2 248.298 2.265 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@H](OC(F)F)C2)cs1 ZINC000555070670 388838363 /nfs/dbraw/zinc/83/83/63/388838363.db2.gz GMDOFWCWTORYBC-VIFPVBQESA-N 1 2 248.298 2.265 20 0 BEADLO COC[C@@H](Nc1cc[nH+]c(C(C)C)n1)C1CC1 ZINC000129537656 388851431 /nfs/dbraw/zinc/85/14/31/388851431.db2.gz UBYIPJVOCXFGHY-LLVKDONJSA-N 1 2 235.331 2.437 20 0 BEADLO CCn1nccc1C[N@@H+]1CCOC2(CCCC2)C1 ZINC000129710086 388866908 /nfs/dbraw/zinc/86/69/08/388866908.db2.gz SUYXIRBTRIMGHH-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CCn1nccc1C[N@H+]1CCOC2(CCCC2)C1 ZINC000129710086 388866911 /nfs/dbraw/zinc/86/69/11/388866911.db2.gz SUYXIRBTRIMGHH-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CC(C)c1nc(N[C@@H]2C[C@@H](O)C2(C)C)cc[nH+]1 ZINC000302480899 388846019 /nfs/dbraw/zinc/84/60/19/388846019.db2.gz XPEFSOUOWOSJEE-NXEZZACHSA-N 1 2 235.331 2.171 20 0 BEADLO F[C@@H]1CCC[N@H+](Cc2cnc(C3CC3)nc2)C1 ZINC000564802532 388890308 /nfs/dbraw/zinc/89/03/08/388890308.db2.gz LRRUNCVWAZHIIM-GFCCVEGCSA-N 1 2 235.306 2.288 20 0 BEADLO F[C@@H]1CCC[N@@H+](Cc2cnc(C3CC3)nc2)C1 ZINC000564802532 388890312 /nfs/dbraw/zinc/89/03/12/388890312.db2.gz LRRUNCVWAZHIIM-GFCCVEGCSA-N 1 2 235.306 2.288 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCc1ccc(F)cc1 ZINC000564455807 388876623 /nfs/dbraw/zinc/87/66/23/388876623.db2.gz WNDMCMLQOUEVBR-UHFFFAOYSA-N 1 2 245.301 2.309 20 0 BEADLO CC(C)c1nc(C[NH+]2C[C@@H]3CCC[C@H]3C2)no1 ZINC000153281101 388958738 /nfs/dbraw/zinc/95/87/38/388958738.db2.gz JPKRWVJSQBXVBF-QWRGUYRKSA-N 1 2 235.331 2.425 20 0 BEADLO Cc1cnc([C@H](C)[N@H+](C)Cc2cnn(C)c2C)o1 ZINC000565755634 388967093 /nfs/dbraw/zinc/96/70/93/388967093.db2.gz NSBGQUUGIKSMQS-NSHDSACASA-N 1 2 248.330 2.218 20 0 BEADLO Cc1cnc([C@H](C)[N@@H+](C)Cc2cnn(C)c2C)o1 ZINC000565755634 388967095 /nfs/dbraw/zinc/96/70/95/388967095.db2.gz NSBGQUUGIKSMQS-NSHDSACASA-N 1 2 248.330 2.218 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2[C@@H]3CCC[C@@H]32)c(C)c[nH+]1 ZINC000565474137 388946995 /nfs/dbraw/zinc/94/69/95/388946995.db2.gz DPXOOAGVURNWEW-PJXYFTJBSA-N 1 2 245.326 2.040 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)OC(C)C)ccn12 ZINC000565905488 388977993 /nfs/dbraw/zinc/97/79/93/388977993.db2.gz RVFYVUXISHJGDY-UHFFFAOYSA-N 1 2 218.256 2.208 20 0 BEADLO Cc1nnsc1C[N@@H+](C)[C@@H](C)c1ccncc1 ZINC000565930228 388979787 /nfs/dbraw/zinc/97/97/87/388979787.db2.gz GXBKQAAETLJGTH-JTQLQIEISA-N 1 2 248.355 2.435 20 0 BEADLO Cc1nnsc1C[N@H+](C)[C@@H](C)c1ccncc1 ZINC000565930228 388979790 /nfs/dbraw/zinc/97/97/90/388979790.db2.gz GXBKQAAETLJGTH-JTQLQIEISA-N 1 2 248.355 2.435 20 0 BEADLO Cc1[nH+]c[nH]c1CNC(=O)c1cc(C)cc(C)c1 ZINC000266974715 388998232 /nfs/dbraw/zinc/99/82/32/388998232.db2.gz NEQGASHBRAAPNU-UHFFFAOYSA-N 1 2 243.310 2.265 20 0 BEADLO c1nc(C[NH2+][C@@H]2CCCc3cn[nH]c32)cs1 ZINC000268853577 389005901 /nfs/dbraw/zinc/00/59/01/389005901.db2.gz QHOLWBSWSOZQQE-SNVBAGLBSA-N 1 2 234.328 2.033 20 0 BEADLO c1nc(C[NH2+][C@@H]2CCCc3c[nH]nc32)cs1 ZINC000268853577 389005905 /nfs/dbraw/zinc/00/59/05/389005905.db2.gz QHOLWBSWSOZQQE-SNVBAGLBSA-N 1 2 234.328 2.033 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](C)c2cn[nH]c2)s1 ZINC000275132952 389050849 /nfs/dbraw/zinc/05/08/49/389050849.db2.gz CBMQPJWVHNCEIZ-QMMMGPOBSA-N 1 2 222.317 2.025 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+]Cc2cnccc2C)s1 ZINC000273611980 389043002 /nfs/dbraw/zinc/04/30/02/389043002.db2.gz OBTWIASEPJQEKK-SECBINFHSA-N 1 2 248.355 2.401 20 0 BEADLO CCSCCNc1ccc(N(C)C)c[nH+]1 ZINC000273680273 389043497 /nfs/dbraw/zinc/04/34/97/389043497.db2.gz GXNISYHJHPGTKV-UHFFFAOYSA-N 1 2 225.361 2.313 20 0 BEADLO COC(=O)C[N@H+](C)Cc1cc(C)cc(Cl)c1 ZINC000507284111 533479572 /nfs/dbraw/zinc/47/95/72/533479572.db2.gz MXFXDTUGTFQAJA-UHFFFAOYSA-N 1 2 241.718 2.253 20 0 BEADLO COC(=O)C[N@@H+](C)Cc1cc(C)cc(Cl)c1 ZINC000507284111 533479577 /nfs/dbraw/zinc/47/95/77/533479577.db2.gz MXFXDTUGTFQAJA-UHFFFAOYSA-N 1 2 241.718 2.253 20 0 BEADLO C[C@H]1CC[N@H+](CC2(C)COC2)CC1(F)F ZINC000494259821 533636555 /nfs/dbraw/zinc/63/65/55/533636555.db2.gz OPFJVNAMYHZVRX-VIFPVBQESA-N 1 2 219.275 2.000 20 0 BEADLO C[C@H]1CC[N@@H+](CC2(C)COC2)CC1(F)F ZINC000494259821 533636571 /nfs/dbraw/zinc/63/65/71/533636571.db2.gz OPFJVNAMYHZVRX-VIFPVBQESA-N 1 2 219.275 2.000 20 0 BEADLO Cc1nc(N2C[C@@H](C)C[C@H](C)C2)cc[nH+]1 ZINC000266146431 132184360 /nfs/dbraw/zinc/18/43/60/132184360.db2.gz RZBLRUVKQRJTAD-UWVGGRQHSA-N 1 2 205.305 2.267 20 0 BEADLO CCOC[C@@H]1CCCN(c2cc[nH+]c(C)n2)C1 ZINC000266361227 132186290 /nfs/dbraw/zinc/18/62/90/132186290.db2.gz KSGBEVHMCVMHSM-GFCCVEGCSA-N 1 2 235.331 2.038 20 0 BEADLO CC[C@H]1CO[C@@H](C)CN1c1cc[nH+]c(C2CC2)n1 ZINC000268024423 132190912 /nfs/dbraw/zinc/19/09/12/132190912.db2.gz IWAQJSXIXXIDMA-JQWIXIFHSA-N 1 2 247.342 2.358 20 0 BEADLO Cc1ccnc(N2CCCC[C@H]2c2[nH]cc[nH+]2)n1 ZINC000268063931 132191102 /nfs/dbraw/zinc/19/11/02/132191102.db2.gz ZUHLEBFIXQCSFP-NSHDSACASA-N 1 2 243.314 2.240 20 0 BEADLO c1csc(N2CCN(c3cccc[nH+]3)CC2)c1 ZINC000268205689 132191662 /nfs/dbraw/zinc/19/16/62/132191662.db2.gz YLDGUUOSYKCMBA-UHFFFAOYSA-N 1 2 245.351 2.470 20 0 BEADLO Cc1cc(N2CCO[C@@H](C)[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000268820555 132193725 /nfs/dbraw/zinc/19/37/25/132193725.db2.gz PBUVGKSKBSGEHZ-QWRGUYRKSA-N 1 2 247.342 2.276 20 0 BEADLO CCC1(CO)CCN(c2cccc[nH+]2)CC1 ZINC000270691350 132197163 /nfs/dbraw/zinc/19/71/63/132197163.db2.gz FURGCMMBRNQOQE-UHFFFAOYSA-N 1 2 220.316 2.071 20 0 BEADLO Cc1cc(NC(N)=O)c[nH+]c1N1CCCC[C@H]1C ZINC000272674190 132200601 /nfs/dbraw/zinc/20/06/01/132200601.db2.gz LPWFXAQUTNUCHB-SNVBAGLBSA-N 1 2 248.330 2.259 20 0 BEADLO C[C@@H]1CCN(c2nc[nH+]c(N)c2Cl)C[C@H]1C ZINC000277807016 132207369 /nfs/dbraw/zinc/20/73/69/132207369.db2.gz NXZCTWWDEYLYOR-HTQZYQBOSA-N 1 2 240.738 2.195 20 0 BEADLO C[C@@H]1CCN(c2[nH+]cnc(N)c2Cl)C[C@H]1C ZINC000277807016 132207370 /nfs/dbraw/zinc/20/73/70/132207370.db2.gz NXZCTWWDEYLYOR-HTQZYQBOSA-N 1 2 240.738 2.195 20 0 BEADLO FC1=CCCN(c2cc(NCC3CC3)[nH+]cn2)C1 ZINC000278683274 132208258 /nfs/dbraw/zinc/20/82/58/132208258.db2.gz GZZCTJUMNSNEDG-UHFFFAOYSA-N 1 2 248.305 2.362 20 0 BEADLO FC1=CCCN(c2cc(NCC3CC3)nc[nH+]2)C1 ZINC000278683274 132208259 /nfs/dbraw/zinc/20/82/59/132208259.db2.gz GZZCTJUMNSNEDG-UHFFFAOYSA-N 1 2 248.305 2.362 20 0 BEADLO CO[C@@]1(C)CCCN(c2cc[nH+]c(C3CC3)n2)C1 ZINC000280397322 132210291 /nfs/dbraw/zinc/21/02/91/132210291.db2.gz IBRKNXISFVRCAA-AWEZNQCLSA-N 1 2 247.342 2.359 20 0 BEADLO CCC[C@@H]1CN(c2cc(C)[nH+]c(CC)n2)CCO1 ZINC000286478472 132214746 /nfs/dbraw/zinc/21/47/46/132214746.db2.gz LJGHSQFFDIQHLB-GFCCVEGCSA-N 1 2 249.358 2.353 20 0 BEADLO CCc1nc(N2CCO[C@@H]3CCC[C@H]32)cc(C)[nH+]1 ZINC000288218685 132216334 /nfs/dbraw/zinc/21/63/34/132216334.db2.gz DNTCNSBJAVPHCQ-VXGBXAGGSA-N 1 2 247.342 2.105 20 0 BEADLO CO[C@@H]1CCN(c2cccc[nH+]2)CC1(C)C ZINC000295734421 132220853 /nfs/dbraw/zinc/22/08/53/132220853.db2.gz MGHBGUISLYHDGM-LLVKDONJSA-N 1 2 220.316 2.333 20 0 BEADLO Cc1cc(N2CCCC3(CC3)C2)nc[nH+]1 ZINC000302266030 132224694 /nfs/dbraw/zinc/22/46/94/132224694.db2.gz QVHKDTRESLYKGH-UHFFFAOYSA-N 1 2 203.289 2.165 20 0 BEADLO Cc1cc(N2C[C@H](C)C[C@@H](C)C2)nc[nH+]1 ZINC000097075511 132242515 /nfs/dbraw/zinc/24/25/15/132242515.db2.gz DECBAMWRGAMONK-NXEZZACHSA-N 1 2 205.305 2.267 20 0 BEADLO Cc1cc(N2CCSCC2)nc(C(C)C)[nH+]1 ZINC000301104014 132251163 /nfs/dbraw/zinc/25/11/63/132251163.db2.gz PCBJQIGVSKUIJD-UHFFFAOYSA-N 1 2 237.372 2.462 20 0 BEADLO c1cc([C@H]2CCCN(c3cccc[nH+]3)C2)n[nH]1 ZINC000301985868 132259489 /nfs/dbraw/zinc/25/94/89/132259489.db2.gz LVDADAWAINDRFW-NSHDSACASA-N 1 2 228.299 2.189 20 0 BEADLO CO[C@@H]1CN(c2cc[nH+]c(C(C)C)n2)CC[C@@H]1C ZINC000302587597 132264717 /nfs/dbraw/zinc/26/47/17/132264717.db2.gz VRGNBQNWRUPBBC-NWDGAFQWSA-N 1 2 249.358 2.461 20 0 BEADLO Cc1cc(N2C[C@H]3CC[C@@H](C2)O3)nc(C2CC2)[nH+]1 ZINC000374091190 132286979 /nfs/dbraw/zinc/28/69/79/132286979.db2.gz IJLKYPKUXBHTPI-TXEJJXNPSA-N 1 2 245.326 2.030 20 0 BEADLO CC(C)[NH2+]c1ccc2c(c1)N(C)CCO2 ZINC000179896786 132291615 /nfs/dbraw/zinc/29/16/15/132291615.db2.gz LZJRTTHQHPRGGG-UHFFFAOYSA-N 1 2 206.289 2.336 20 0 BEADLO Nc1[nH+]cnc(N2CC3CCC2CC3)c1Cl ZINC000365052868 132365714 /nfs/dbraw/zinc/36/57/14/132365714.db2.gz KOPSTLNXEGIBTP-UHFFFAOYSA-N 1 2 238.722 2.091 20 0 BEADLO Nc1nc[nH+]c(N2CC3CCC2CC3)c1Cl ZINC000365052868 132365715 /nfs/dbraw/zinc/36/57/15/132365715.db2.gz KOPSTLNXEGIBTP-UHFFFAOYSA-N 1 2 238.722 2.091 20 0 BEADLO Cc1nc(N2C[C@@H](C)CC[C@@H]2C)cc[nH+]1 ZINC000173783672 132445873 /nfs/dbraw/zinc/44/58/73/132445873.db2.gz OOARHCISJMQYCZ-UWVGGRQHSA-N 1 2 205.305 2.410 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CCO[C@H](C)C1 ZINC000225869286 322840375 /nfs/dbraw/zinc/84/03/75/322840375.db2.gz AECSODVLXSMCGU-ZJUUUORDSA-N 1 2 222.288 2.070 20 0 BEADLO C[C@@H](CC(=O)NCc1[nH+]ccn1C)C(C)(C)C ZINC000342857350 133602979 /nfs/dbraw/zinc/60/29/79/133602979.db2.gz YALJGLTUHLFIBB-JTQLQIEISA-N 1 2 237.347 2.109 20 0 BEADLO Cc1cc(NC(=O)CCn2cc[nH+]c2)ccc1F ZINC000343573032 133696885 /nfs/dbraw/zinc/69/68/85/133696885.db2.gz VCKVMBTXZUYSNJ-UHFFFAOYSA-N 1 2 247.273 2.359 20 0 BEADLO C[C@H]1CCCC[C@@H]1C(=O)N1CCn2c[nH+]cc2C1 ZINC000335111984 133777504 /nfs/dbraw/zinc/77/75/04/133777504.db2.gz AYEQNBIFERDTNK-AAEUAGOBSA-N 1 2 247.342 2.052 20 0 BEADLO Cc1nc(C[N@@H+]2CCC[C@H]2C(N)=O)c(C)s1 ZINC000335882875 133949940 /nfs/dbraw/zinc/94/99/40/133949940.db2.gz YVYUNOWMZDLKMP-JTQLQIEISA-N 1 2 239.344 2.260 20 0 BEADLO Cc1nc(C[N@H+]2CCC[C@H]2C(N)=O)c(C)s1 ZINC000335882875 133949941 /nfs/dbraw/zinc/94/99/41/133949941.db2.gz YVYUNOWMZDLKMP-JTQLQIEISA-N 1 2 239.344 2.260 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCOc2cc(O)ccc2C1 ZINC000335945364 134020080 /nfs/dbraw/zinc/02/00/80/134020080.db2.gz GLJKLAKIUSGGQC-LLVKDONJSA-N 1 2 239.290 2.335 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCOc2cc(O)ccc2C1 ZINC000335945364 134020081 /nfs/dbraw/zinc/02/00/81/134020081.db2.gz GLJKLAKIUSGGQC-LLVKDONJSA-N 1 2 239.290 2.335 20 0 BEADLO c1nc(C[N@@H+]2CCC[C@H]2c2cccnc2)c[nH]1 ZINC000335959333 134023923 /nfs/dbraw/zinc/02/39/23/134023923.db2.gz ZNJQCMDJTDOECK-ZDUSSCGKSA-N 1 2 228.299 2.142 20 0 BEADLO c1nc(C[N@H+]2CCC[C@H]2c2cccnc2)c[nH]1 ZINC000335959333 134023924 /nfs/dbraw/zinc/02/39/24/134023924.db2.gz ZNJQCMDJTDOECK-ZDUSSCGKSA-N 1 2 228.299 2.142 20 0 BEADLO c1ncc(C[N@@H+]2CCC[C@H]2c2cccnc2)[nH]1 ZINC000335959333 134023925 /nfs/dbraw/zinc/02/39/25/134023925.db2.gz ZNJQCMDJTDOECK-ZDUSSCGKSA-N 1 2 228.299 2.142 20 0 BEADLO c1ncc(C[N@H+]2CCC[C@H]2c2cccnc2)[nH]1 ZINC000335959333 134023926 /nfs/dbraw/zinc/02/39/26/134023926.db2.gz ZNJQCMDJTDOECK-ZDUSSCGKSA-N 1 2 228.299 2.142 20 0 BEADLO Cc1noc(C)c1C[N@@H+]1CCO[C@@H](C(C)C)C1 ZINC000335965553 134027938 /nfs/dbraw/zinc/02/79/38/134027938.db2.gz VQRGRAUGNXOEBB-CYBMUJFWSA-N 1 2 238.331 2.148 20 0 BEADLO Cc1noc(C)c1C[N@H+]1CCO[C@@H](C(C)C)C1 ZINC000335965553 134027939 /nfs/dbraw/zinc/02/79/39/134027939.db2.gz VQRGRAUGNXOEBB-CYBMUJFWSA-N 1 2 238.331 2.148 20 0 BEADLO CN(Cc1[nH+]ccn1C)C(=O)[C@H]1CCC(C)(C)C1 ZINC000335979807 134032758 /nfs/dbraw/zinc/03/27/58/134032758.db2.gz DVYJUKRZCCOERD-NSHDSACASA-N 1 2 249.358 2.205 20 0 BEADLO Cc1ncsc1C[N@@H+](C)Cc1cnc(C)nc1 ZINC000352012934 134036050 /nfs/dbraw/zinc/03/60/50/134036050.db2.gz HCZRMASVYXIOFJ-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO Cc1ncsc1C[N@H+](C)Cc1cnc(C)nc1 ZINC000352012934 134036051 /nfs/dbraw/zinc/03/60/51/134036051.db2.gz HCZRMASVYXIOFJ-UHFFFAOYSA-N 1 2 248.355 2.182 20 0 BEADLO C[C@@H]1C[N@H+](CC(=O)OC(C)(C)C)CCC1(F)F ZINC000352018311 134036902 /nfs/dbraw/zinc/03/69/02/134036902.db2.gz PKOANIQRHBMVSF-SECBINFHSA-N 1 2 249.301 2.305 20 0 BEADLO C[C@@H]1C[N@@H+](CC(=O)OC(C)(C)C)CCC1(F)F ZINC000352018311 134036903 /nfs/dbraw/zinc/03/69/03/134036903.db2.gz PKOANIQRHBMVSF-SECBINFHSA-N 1 2 249.301 2.305 20 0 BEADLO C[C@H]1c2ccccc2C[N@H+]1CC(=O)N1CCCC1 ZINC000335989621 134039961 /nfs/dbraw/zinc/03/99/61/134039961.db2.gz JDSZBTCGHNGXAM-LBPRGKRZSA-N 1 2 244.338 2.186 20 0 BEADLO C[C@H]1c2ccccc2C[N@@H+]1CC(=O)N1CCCC1 ZINC000335989621 134039962 /nfs/dbraw/zinc/03/99/62/134039962.db2.gz JDSZBTCGHNGXAM-LBPRGKRZSA-N 1 2 244.338 2.186 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2CC(C)=C[C@H](C)C2)no1 ZINC000336006839 134049263 /nfs/dbraw/zinc/04/92/63/134049263.db2.gz QLHBYTWWIFGTOZ-WCBMZHEXSA-N 1 2 221.304 2.337 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2CC(C)=C[C@H](C)C2)no1 ZINC000336006839 134049264 /nfs/dbraw/zinc/04/92/64/134049264.db2.gz QLHBYTWWIFGTOZ-WCBMZHEXSA-N 1 2 221.304 2.337 20 0 BEADLO Cc1ncsc1C[N@@H+]1CCO[C@H](C2CC2)C1 ZINC000336009266 134050529 /nfs/dbraw/zinc/05/05/29/134050529.db2.gz ZVXYNEGTWALEHF-NSHDSACASA-N 1 2 238.356 2.062 20 0 BEADLO Cc1ncsc1C[N@H+]1CCO[C@H](C2CC2)C1 ZINC000336009266 134050530 /nfs/dbraw/zinc/05/05/30/134050530.db2.gz ZVXYNEGTWALEHF-NSHDSACASA-N 1 2 238.356 2.062 20 0 BEADLO C[C@@H]1CCCC[C@H]1CNC(=O)CCc1[nH]cc[nH+]1 ZINC000352059244 134054372 /nfs/dbraw/zinc/05/43/72/134054372.db2.gz HJZRFUOKNXPQSC-NEPJUHHUSA-N 1 2 249.358 2.285 20 0 BEADLO CCC(C)(C)CC(=O)N1CCn2c[nH+]cc2C1 ZINC000336022175 134055873 /nfs/dbraw/zinc/05/58/73/134055873.db2.gz GGZFZTFBLAZVLL-UHFFFAOYSA-N 1 2 235.331 2.052 20 0 BEADLO C[C@@H](CC(C)(C)C)C(=O)N1CCn2c[nH+]cc2C1 ZINC000336022301 134055905 /nfs/dbraw/zinc/05/59/05/134055905.db2.gz MMBNUDQBCQWRAR-NSHDSACASA-N 1 2 249.358 2.298 20 0 BEADLO CC[C@@H]1C[C@@H](C)CN1c1cc(C)[nH+]cn1 ZINC000336039602 134060668 /nfs/dbraw/zinc/06/06/68/134060668.db2.gz HALZSQULZPNMEX-MWLCHTKSSA-N 1 2 205.305 2.410 20 0 BEADLO O=C(Nc1ccccc1)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000336044645 134063221 /nfs/dbraw/zinc/06/32/21/134063221.db2.gz KRFRYZAQEMZAQP-LLVKDONJSA-N 1 2 241.294 2.468 20 0 BEADLO O=C(Nc1cccc2[nH+]ccn21)[C@H]1CCSC1 ZINC000336058853 134067023 /nfs/dbraw/zinc/06/70/23/134067023.db2.gz PUNJQCZFABKBJM-VIFPVBQESA-N 1 2 247.323 2.026 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CCC(F)(F)C2)cc[nH+]1 ZINC000336080769 134075442 /nfs/dbraw/zinc/07/54/42/134075442.db2.gz AMANKEOXUVUDJK-VIFPVBQESA-N 1 2 240.253 2.186 20 0 BEADLO Cc1ccncc1C[N@@H+](C)Cc1ccnc(C)n1 ZINC000353267810 134097503 /nfs/dbraw/zinc/09/75/03/134097503.db2.gz OXIRCTQSAVHLNB-UHFFFAOYSA-N 1 2 242.326 2.120 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@@H]1CC[C@H](C)C1 ZINC000336143578 134101506 /nfs/dbraw/zinc/10/15/06/134101506.db2.gz VPOBCHJFLQIPRN-CMPLNLGQSA-N 1 2 232.327 2.441 20 0 BEADLO CCOC(=O)C[N@H+](Cc1occc1C)C(C)C ZINC000352229645 134110822 /nfs/dbraw/zinc/11/08/22/134110822.db2.gz FLYOHFALKZTHAS-UHFFFAOYSA-N 1 2 239.315 2.362 20 0 BEADLO CCOC(=O)C[N@@H+](Cc1occc1C)C(C)C ZINC000352229645 134110823 /nfs/dbraw/zinc/11/08/23/134110823.db2.gz FLYOHFALKZTHAS-UHFFFAOYSA-N 1 2 239.315 2.362 20 0 BEADLO Cc1cc(N2CCC[C@](C)(F)C2)nc[nH+]1 ZINC000336185247 134120972 /nfs/dbraw/zinc/12/09/72/134120972.db2.gz ZJHXHCLFLWYKSL-NSHDSACASA-N 1 2 209.268 2.113 20 0 BEADLO C[C@H](c1csnn1)[N@@H+]1CCS[C@H](C)C1 ZINC000336187622 134122251 /nfs/dbraw/zinc/12/22/51/134122251.db2.gz MZEPGJURNMYPIL-HTQZYQBOSA-N 1 2 229.374 2.036 20 0 BEADLO C[C@H](c1csnn1)[N@H+]1CCS[C@H](C)C1 ZINC000336187622 134122252 /nfs/dbraw/zinc/12/22/52/134122252.db2.gz MZEPGJURNMYPIL-HTQZYQBOSA-N 1 2 229.374 2.036 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+]1CCCSCC1 ZINC000336196557 134126351 /nfs/dbraw/zinc/12/63/51/134126351.db2.gz KTWCDSGEMCPEQX-QMMMGPOBSA-N 1 2 229.374 2.038 20 0 BEADLO C[C@@H](c1csnn1)[N@H+]1CCCSCC1 ZINC000336196557 134126352 /nfs/dbraw/zinc/12/63/52/134126352.db2.gz KTWCDSGEMCPEQX-QMMMGPOBSA-N 1 2 229.374 2.038 20 0 BEADLO C[C@H]1COCC[N@@H+]1Cc1ccnn1C1CCCC1 ZINC000336213755 134135438 /nfs/dbraw/zinc/13/54/38/134135438.db2.gz AOCOTSDRHNXXDN-LBPRGKRZSA-N 1 2 249.358 2.219 20 0 BEADLO C[C@H]1COCC[N@H+]1Cc1ccnn1C1CCCC1 ZINC000336213755 134135439 /nfs/dbraw/zinc/13/54/39/134135439.db2.gz AOCOTSDRHNXXDN-LBPRGKRZSA-N 1 2 249.358 2.219 20 0 BEADLO Cc1cccc(C[N@@H+]2CCOCC23CC3)c1F ZINC000336215731 134136702 /nfs/dbraw/zinc/13/67/02/134136702.db2.gz FMTAKGKMBRNKSG-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1cccc(C[N@H+]2CCOCC23CC3)c1F ZINC000336215731 134136703 /nfs/dbraw/zinc/13/67/03/134136703.db2.gz FMTAKGKMBRNKSG-UHFFFAOYSA-N 1 2 235.302 2.499 20 0 BEADLO Cc1nc(N(C)Cc2ccc(O)cc2)cc[nH+]1 ZINC000301867457 134156812 /nfs/dbraw/zinc/15/68/12/134156812.db2.gz IFTLRXNXRMBXFB-UHFFFAOYSA-N 1 2 229.283 2.127 20 0 BEADLO CCCN(CCC)C(=O)[C@H]1CCn2c[nH+]cc2C1 ZINC000170249912 134252390 /nfs/dbraw/zinc/25/23/90/134252390.db2.gz ARYHJPUHXTWIPO-LBPRGKRZSA-N 1 2 249.358 2.094 20 0 BEADLO COC[C@@H](C)N(C)c1cc[nH+]c(C(C)C)n1 ZINC000171987622 134263824 /nfs/dbraw/zinc/26/38/24/134263824.db2.gz JEWGVJMVYLELGM-SNVBAGLBSA-N 1 2 223.320 2.071 20 0 BEADLO Clc1ccc2[nH+]c(Cn3cccn3)cn2c1 ZINC000174164909 134279584 /nfs/dbraw/zinc/27/95/84/134279584.db2.gz CFYAWTIBADEDTL-UHFFFAOYSA-N 1 2 232.674 2.233 20 0 BEADLO CC(C)Cn1cc[nH+]c1CNC(=O)[C@H](C)C1CC1 ZINC000175359101 134285446 /nfs/dbraw/zinc/28/54/46/134285446.db2.gz HOBJNVQYXSNWGP-LLVKDONJSA-N 1 2 249.358 2.201 20 0 BEADLO CC(C)CC1(C(=O)NCCc2[nH]cc[nH+]2)CCC1 ZINC000176550528 134292893 /nfs/dbraw/zinc/29/28/93/134292893.db2.gz SGSWJLAULZYYEN-UHFFFAOYSA-N 1 2 249.358 2.285 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@H]1C[C@@H]1C1CC1 ZINC000176975345 134295259 /nfs/dbraw/zinc/29/52/59/134295259.db2.gz ITPPVSAIOBSWRQ-ZJUUUORDSA-N 1 2 232.283 2.075 20 0 BEADLO C[C@H]1CCC[C@H](CC[N@H+](C)Cc2nnc[nH]2)C1 ZINC000177102994 134295370 /nfs/dbraw/zinc/29/53/70/134295370.db2.gz LJCBYCWYQBWUJE-NWDGAFQWSA-N 1 2 236.363 2.453 20 0 BEADLO C[C@H]1CCC[C@H](CC[N@@H+](C)Cc2nnc[nH]2)C1 ZINC000177102994 134295371 /nfs/dbraw/zinc/29/53/71/134295371.db2.gz LJCBYCWYQBWUJE-NWDGAFQWSA-N 1 2 236.363 2.453 20 0 BEADLO C[C@@H]1CCC[C@H](CC[N@H+](C)Cc2nnc[nH]2)C1 ZINC000177102979 134295390 /nfs/dbraw/zinc/29/53/90/134295390.db2.gz LJCBYCWYQBWUJE-VXGBXAGGSA-N 1 2 236.363 2.453 20 0 BEADLO C[C@@H]1CCC[C@H](CC[N@@H+](C)Cc2nnc[nH]2)C1 ZINC000177102979 134295391 /nfs/dbraw/zinc/29/53/91/134295391.db2.gz LJCBYCWYQBWUJE-VXGBXAGGSA-N 1 2 236.363 2.453 20 0 BEADLO C[C@H]1CCC[C@H](C[N@H+](C)Cc2nnc[nH]2)C1 ZINC000179359563 134316587 /nfs/dbraw/zinc/31/65/87/134316587.db2.gz JOPSJYNUIQJZES-QWRGUYRKSA-N 1 2 222.336 2.063 20 0 BEADLO C[C@H]1CCC[C@H](C[N@@H+](C)Cc2nnc[nH]2)C1 ZINC000179359563 134316588 /nfs/dbraw/zinc/31/65/88/134316588.db2.gz JOPSJYNUIQJZES-QWRGUYRKSA-N 1 2 222.336 2.063 20 0 BEADLO CCCn1cc(C(=O)Nc2cc[nH+]c(C)c2)cn1 ZINC000181567817 134338067 /nfs/dbraw/zinc/33/80/67/134338067.db2.gz CDEDTHKOJVHJPI-UHFFFAOYSA-N 1 2 244.298 2.249 20 0 BEADLO CC[C@H](C)[C@H]([NH2+][C@@H]1C=CCCC1)C(=O)OC ZINC000183669857 134355781 /nfs/dbraw/zinc/35/57/81/134355781.db2.gz YYLOMFSMLSZTJJ-TUAOUCFPSA-N 1 2 225.332 2.272 20 0 BEADLO Cc1cc(NCC2(C)CCOCC2)nc[nH+]1 ZINC000227825067 134389652 /nfs/dbraw/zinc/38/96/52/134389652.db2.gz SSPCDUGOGZXGHB-UHFFFAOYSA-N 1 2 221.304 2.014 20 0 BEADLO COC(=O)[C@H]([NH2+][C@@H]1C[C@@H]1c1ccccc1)C1CC1 ZINC000227769297 134392789 /nfs/dbraw/zinc/39/27/89/134392789.db2.gz RSRPHSOCWFUFIN-MGPQQGTHSA-N 1 2 245.322 2.084 20 0 BEADLO Cc1cc(N[C@H]2CCCc3c2cnn3C)nc[nH+]1 ZINC000408124982 134398062 /nfs/dbraw/zinc/39/80/62/134398062.db2.gz XWPWXJVGEBGJBO-NSHDSACASA-N 1 2 243.314 2.008 20 0 BEADLO NC(=O)c1cccc(-c2cccc3[nH+]ccn32)c1 ZINC000061925830 1172718234 /nfs/dbraw/zinc/71/82/34/1172718234.db2.gz FPGOFIBFQYHYLJ-UHFFFAOYSA-N 1 2 237.262 2.100 20 0 BEADLO Cc1cc(OCc2c[nH+]cn2C)ccc1F ZINC000158875549 134753718 /nfs/dbraw/zinc/75/37/18/134753718.db2.gz GFVNIXYDQZTMTD-UHFFFAOYSA-N 1 2 220.247 2.447 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@H]1[C@@H]2CCCC[C@@H]21 ZINC000245417990 134853392 /nfs/dbraw/zinc/85/33/92/134853392.db2.gz ADVOTCPSOPXYOY-IWIIMEHWSA-N 1 2 246.310 2.465 20 0 BEADLO C[C@H]1CCC[N@@H+]1Cc1noc(C(C)(C)C)n1 ZINC000076114687 135010272 /nfs/dbraw/zinc/01/02/72/135010272.db2.gz NWNWQZZSQMCTQN-VIFPVBQESA-N 1 2 223.320 2.351 20 0 BEADLO C[C@H]1CCC[N@H+]1Cc1noc(C(C)(C)C)n1 ZINC000076114687 135010273 /nfs/dbraw/zinc/01/02/73/135010273.db2.gz NWNWQZZSQMCTQN-VIFPVBQESA-N 1 2 223.320 2.351 20 0 BEADLO CC(C)c1nc(C[N@@H+]2CCC[C@@H]2C)no1 ZINC000076116531 135010857 /nfs/dbraw/zinc/01/08/57/135010857.db2.gz KIWIEOUYKCARKJ-VIFPVBQESA-N 1 2 209.293 2.177 20 0 BEADLO CC(C)c1nc(C[N@H+]2CCC[C@@H]2C)no1 ZINC000076116531 135010858 /nfs/dbraw/zinc/01/08/58/135010858.db2.gz KIWIEOUYKCARKJ-VIFPVBQESA-N 1 2 209.293 2.177 20 0 BEADLO C[C@H](C(=O)OC(C)(C)C)[N@@H+]1CCS[C@H](C)C1 ZINC000252890092 135116267 /nfs/dbraw/zinc/11/62/67/135116267.db2.gz GQZRPGWXQZNPTJ-NXEZZACHSA-N 1 2 245.388 2.154 20 0 BEADLO C[C@H](C(=O)OC(C)(C)C)[N@H+]1CCS[C@H](C)C1 ZINC000252890092 135116268 /nfs/dbraw/zinc/11/62/68/135116268.db2.gz GQZRPGWXQZNPTJ-NXEZZACHSA-N 1 2 245.388 2.154 20 0 BEADLO C[C@H]1c2cccn2CC[N@H+]1Cc1ccccn1 ZINC000078471402 135125662 /nfs/dbraw/zinc/12/56/62/135125662.db2.gz WLYCAQFDGHBWJX-LBPRGKRZSA-N 1 2 227.311 2.460 20 0 BEADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1ccccn1 ZINC000078471402 135125663 /nfs/dbraw/zinc/12/56/63/135125663.db2.gz WLYCAQFDGHBWJX-LBPRGKRZSA-N 1 2 227.311 2.460 20 0 BEADLO C[NH2+]Cc1noc([C@@H]2CC3CCC2CC3)n1 ZINC000261542888 135183381 /nfs/dbraw/zinc/18/33/81/135183381.db2.gz HEEVOVMLSVTITC-UDNWOFFPSA-N 1 2 221.304 2.083 20 0 BEADLO C[NH2+]Cc1noc([C@@H](C)c2cccs2)n1 ZINC000261558157 135198603 /nfs/dbraw/zinc/19/86/03/135198603.db2.gz XXMCWOFBNIFGME-ZETCQYMHSA-N 1 2 223.301 2.002 20 0 BEADLO CC1(C)CCCC[C@H]1NC(=O)CCn1cc[nH+]c1 ZINC000342309752 135258880 /nfs/dbraw/zinc/25/88/80/135258880.db2.gz ZLWNCXGKUDQVPU-GFCCVEGCSA-N 1 2 249.358 2.358 20 0 BEADLO CCCC[N@@H+]1CC(=O)N[C@@H]1[C@@H]1CCCC[C@H]1C ZINC000342256384 135258970 /nfs/dbraw/zinc/25/89/70/135258970.db2.gz ZSEOFMNTTOGRNP-BZPMIXESSA-N 1 2 238.375 2.371 20 0 BEADLO CCCC[N@H+]1CC(=O)N[C@@H]1[C@@H]1CCCC[C@H]1C ZINC000342256384 135258971 /nfs/dbraw/zinc/25/89/71/135258971.db2.gz ZSEOFMNTTOGRNP-BZPMIXESSA-N 1 2 238.375 2.371 20 0 BEADLO CCCC[N@@H+]1CC(=O)N[C@]12CC[C@H](C)[C@@H](C)C2 ZINC000342453582 135276418 /nfs/dbraw/zinc/27/64/18/135276418.db2.gz NAXJAILDDZCEGY-SGMGOOAPSA-N 1 2 238.375 2.371 20 0 BEADLO CCCC[N@H+]1CC(=O)N[C@]12CC[C@H](C)[C@@H](C)C2 ZINC000342453582 135276419 /nfs/dbraw/zinc/27/64/19/135276419.db2.gz NAXJAILDDZCEGY-SGMGOOAPSA-N 1 2 238.375 2.371 20 0 BEADLO CCC(CC)[C@H](C)C(=O)Nc1cc[nH+]cc1O ZINC000342463380 135276861 /nfs/dbraw/zinc/27/68/61/135276861.db2.gz OZCKPDXMKSDUGU-VIFPVBQESA-N 1 2 236.315 2.220 20 0 BEADLO C[C@H]1CC[C@H](C)N1c1cc(N2CCCC2)[nH+]cn1 ZINC000342556538 135287960 /nfs/dbraw/zinc/28/79/60/135287960.db2.gz XSQDVSFMGFHZRE-RYUDHWBXSA-N 1 2 246.358 2.454 20 0 BEADLO C[C@H]1CC[C@H](C)N1c1cc(N2CCCC2)nc[nH+]1 ZINC000342556538 135287961 /nfs/dbraw/zinc/28/79/61/135287961.db2.gz XSQDVSFMGFHZRE-RYUDHWBXSA-N 1 2 246.358 2.454 20 0 BEADLO CCc1nc(N2CCOC(C)(C)[C@H]2C)cc(C)[nH+]1 ZINC000342706673 135312838 /nfs/dbraw/zinc/31/28/38/135312838.db2.gz RGKUMPLNEHXZBO-LLVKDONJSA-N 1 2 249.358 2.351 20 0 BEADLO CCN(Cc1[nH+]cc(C)n1C)Cc1ccccn1 ZINC000342789700 135318557 /nfs/dbraw/zinc/31/85/57/135318557.db2.gz LXLABICGQVJXHQ-UHFFFAOYSA-N 1 2 244.342 2.146 20 0 BEADLO CCc1ccc(C[N@@H+]2CCO[C@@H](C)[C@@H]2C)nc1 ZINC000334167302 135324222 /nfs/dbraw/zinc/32/42/22/135324222.db2.gz AMHKVRNULKCXKJ-RYUDHWBXSA-N 1 2 234.343 2.253 20 0 BEADLO CCc1ccc(C[N@H+]2CCO[C@@H](C)[C@@H]2C)nc1 ZINC000334167302 135324223 /nfs/dbraw/zinc/32/42/23/135324223.db2.gz AMHKVRNULKCXKJ-RYUDHWBXSA-N 1 2 234.343 2.253 20 0 BEADLO COC(=O)[C@@H](C)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000334278285 135333404 /nfs/dbraw/zinc/33/34/04/135333404.db2.gz DVSSENGBJWNDQB-VHSXEESVSA-N 1 2 219.284 2.125 20 0 BEADLO COC(=O)[C@@H](C)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000334278285 135333406 /nfs/dbraw/zinc/33/34/06/135333406.db2.gz DVSSENGBJWNDQB-VHSXEESVSA-N 1 2 219.284 2.125 20 0 BEADLO CC(C)c1ncc(C[N@@H+]2CCO[C@@H](C)C2)s1 ZINC000334301960 135346468 /nfs/dbraw/zinc/34/64/68/135346468.db2.gz ZBJDWWIPFRUDHA-JTQLQIEISA-N 1 2 240.372 2.487 20 0 BEADLO CC(C)c1ncc(C[N@H+]2CCO[C@@H](C)C2)s1 ZINC000334301960 135346470 /nfs/dbraw/zinc/34/64/70/135346470.db2.gz ZBJDWWIPFRUDHA-JTQLQIEISA-N 1 2 240.372 2.487 20 0 BEADLO C[C@@H]1CCCN(C(=O)C(C)(C)c2c[nH+]c[nH]2)CC1 ZINC000334313329 135351967 /nfs/dbraw/zinc/35/19/67/135351967.db2.gz NHRHMLKZYMDTJO-LLVKDONJSA-N 1 2 249.358 2.336 20 0 BEADLO C[C@H]1CC[N@@H+](CCC(C)(C)C)CC[S@@]1=O ZINC000334357764 135370139 /nfs/dbraw/zinc/37/01/39/135370139.db2.gz QTSLBQWKGDXDOS-NHYWBVRUSA-N 1 2 231.405 2.266 20 0 BEADLO C1CCC2(C1)CC[NH+]([C@@H]1CCOC1)CC2 ZINC000334357839 135370356 /nfs/dbraw/zinc/37/03/56/135370356.db2.gz RACARAXQIHTCHJ-GFCCVEGCSA-N 1 2 209.333 2.432 20 0 BEADLO COCCNc1[nH+]ccc(C)c1Cl ZINC000306705089 135376929 /nfs/dbraw/zinc/37/69/29/135376929.db2.gz KDJMCTLUIKFFQD-UHFFFAOYSA-N 1 2 200.669 2.102 20 0 BEADLO Cc1nc(N2CC[C@@H](CC3CC3)C2)cc[nH+]1 ZINC000334381366 135379521 /nfs/dbraw/zinc/37/95/21/135379521.db2.gz JLOOMOOVGSVTSM-LBPRGKRZSA-N 1 2 217.316 2.411 20 0 BEADLO Cc1ccc(F)c(C[N@@H+]2CC[C@@](F)(CO)C2)c1 ZINC000334388790 135385072 /nfs/dbraw/zinc/38/50/72/135385072.db2.gz RCRMZIJMJUHUJT-ZDUSSCGKSA-N 1 2 241.281 2.040 20 0 BEADLO Cc1ccc(F)c(C[N@H+]2CC[C@@](F)(CO)C2)c1 ZINC000334388790 135385074 /nfs/dbraw/zinc/38/50/74/135385074.db2.gz RCRMZIJMJUHUJT-ZDUSSCGKSA-N 1 2 241.281 2.040 20 0 BEADLO CC[C@@H](NC(=O)C[C@@H](C)CC)c1[nH]cc[nH+]1 ZINC000164503328 135386041 /nfs/dbraw/zinc/38/60/41/135386041.db2.gz HHGLVIWKRZIQRW-VHSXEESVSA-N 1 2 223.320 2.413 20 0 BEADLO Cc1ccc(NC(=O)C2=CCC2)c(C)[nH+]1 ZINC000334395822 135387127 /nfs/dbraw/zinc/38/71/27/135387127.db2.gz KGAXGNVJYSYXEI-UHFFFAOYSA-N 1 2 202.257 2.357 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)C1CC=CC1 ZINC000334398695 135388082 /nfs/dbraw/zinc/38/80/82/135388082.db2.gz MBSXSEYNXMVKHB-UHFFFAOYSA-N 1 2 227.267 2.239 20 0 BEADLO Cc1ccccc1CN1CCn2cc[nH+]c2C1 ZINC000334397946 135389796 /nfs/dbraw/zinc/38/97/96/135389796.db2.gz CZPWQDLLRMVUPI-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO Cc1ccccc1C[N@@H+]1CCn2ccnc2C1 ZINC000334397946 135389798 /nfs/dbraw/zinc/38/97/98/135389798.db2.gz CZPWQDLLRMVUPI-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO Cc1ccccc1C[N@H+]1CCn2ccnc2C1 ZINC000334397946 135389799 /nfs/dbraw/zinc/38/97/99/135389799.db2.gz CZPWQDLLRMVUPI-UHFFFAOYSA-N 1 2 227.311 2.207 20 0 BEADLO O[C@H]1CCC[C@H](CNc2cccc[nH+]2)C1 ZINC000078305048 135392762 /nfs/dbraw/zinc/39/27/62/135392762.db2.gz WWHSLRQDUWSZGY-QWRGUYRKSA-N 1 2 206.289 2.045 20 0 BEADLO Cc1noc(C[N@@H+]2CCc3cc(C)ccc3C2)n1 ZINC000334420103 135399232 /nfs/dbraw/zinc/39/92/32/135399232.db2.gz QOONYOKFAYQIPM-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1noc(C[N@H+]2CCc3cc(C)ccc3C2)n1 ZINC000334420103 135399233 /nfs/dbraw/zinc/39/92/33/135399233.db2.gz QOONYOKFAYQIPM-UHFFFAOYSA-N 1 2 243.310 2.245 20 0 BEADLO Cc1[nH+]cc(CN2CC(F)C2)n1-c1ccccc1 ZINC000334588488 135760174 /nfs/dbraw/zinc/76/01/74/135760174.db2.gz ZEMKYDFEBYBXJH-UHFFFAOYSA-N 1 2 245.301 2.334 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccn(C(F)F)n2)CCS1 ZINC000347710465 136002513 /nfs/dbraw/zinc/00/25/13/136002513.db2.gz VVXBIWNFKYLYGI-MRVPVSSYSA-N 1 2 247.314 2.216 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccn(C(F)F)n2)CCS1 ZINC000347710465 136002514 /nfs/dbraw/zinc/00/25/14/136002514.db2.gz VVXBIWNFKYLYGI-MRVPVSSYSA-N 1 2 247.314 2.216 20 0 BEADLO Cc1[nH]c(C(=O)N[C@H](C(C)C)C(F)(F)F)c[nH+]1 ZINC000348065165 136025586 /nfs/dbraw/zinc/02/55/86/136025586.db2.gz ZETBKWOBMYBXLW-MRVPVSSYSA-N 1 2 249.236 2.035 20 0 BEADLO CCN(C)C(=O)C[N@@H+]1Cc2ccccc2[C@H]1C ZINC000335311962 136030349 /nfs/dbraw/zinc/03/03/49/136030349.db2.gz YWFBREZFCSGYQT-LLVKDONJSA-N 1 2 232.327 2.042 20 0 BEADLO CCN(C)C(=O)C[N@H+]1Cc2ccccc2[C@H]1C ZINC000335311962 136030350 /nfs/dbraw/zinc/03/03/50/136030350.db2.gz YWFBREZFCSGYQT-LLVKDONJSA-N 1 2 232.327 2.042 20 0 BEADLO FC(F)[C@H]1CCC[N@@H+]1C[C@@H]1CCCCO1 ZINC000335314570 136031767 /nfs/dbraw/zinc/03/17/67/136031767.db2.gz HBEJQOOHXBMYQC-VHSXEESVSA-N 1 2 219.275 2.285 20 0 BEADLO FC(F)[C@H]1CCC[N@H+]1C[C@@H]1CCCCO1 ZINC000335314570 136031768 /nfs/dbraw/zinc/03/17/68/136031768.db2.gz HBEJQOOHXBMYQC-VHSXEESVSA-N 1 2 219.275 2.285 20 0 BEADLO CC(C)c1nc(N[C@@H]2C[C@@H]2C(F)F)cc[nH+]1 ZINC000348113307 136037474 /nfs/dbraw/zinc/03/74/74/136037474.db2.gz FWBXTBMFSPPLHZ-JGVFFNPUSA-N 1 2 227.258 2.087 20 0 BEADLO CC[C@@H](F)C[N@@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000348147608 136039518 /nfs/dbraw/zinc/03/95/18/136039518.db2.gz GTLAJBBCRNGMDN-MWLCHTKSSA-N 1 2 211.284 2.295 20 0 BEADLO CC[C@@H](F)C[N@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000348147608 136039519 /nfs/dbraw/zinc/03/95/19/136039519.db2.gz GTLAJBBCRNGMDN-MWLCHTKSSA-N 1 2 211.284 2.295 20 0 BEADLO Cc1[nH]c(C(=O)N[C@@H]2CC[C@@H](C)[C@@H](C)C2)c[nH+]1 ZINC000348197388 136051752 /nfs/dbraw/zinc/05/17/52/136051752.db2.gz CZBVENQGJDGERN-WCABBAIRSA-N 1 2 235.331 2.273 20 0 BEADLO Fc1cncc(C[NH+]2CC3(CCC3(F)F)C2)c1 ZINC000335329027 136053360 /nfs/dbraw/zinc/05/33/60/136053360.db2.gz LXJUQKRNFJONSO-UHFFFAOYSA-N 1 2 242.244 2.452 20 0 BEADLO C[C@H](c1cnccn1)[N@@H+]1C[C@@H](C)O[C@H](C2CC2)C1 ZINC000348206465 136054249 /nfs/dbraw/zinc/05/42/49/136054249.db2.gz PGJUOJNNQQJIEG-GYSYKLTISA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H](c1cnccn1)[N@H+]1C[C@@H](C)O[C@H](C2CC2)C1 ZINC000348206465 136054250 /nfs/dbraw/zinc/05/42/50/136054250.db2.gz PGJUOJNNQQJIEG-GYSYKLTISA-N 1 2 247.342 2.037 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)C1CC(F)(F)C1 ZINC000335347423 136066995 /nfs/dbraw/zinc/06/69/95/136066995.db2.gz MSWSRYJZZGPLSV-UHFFFAOYSA-N 1 2 240.253 2.050 20 0 BEADLO OC[C@@H]1CCN(c2[nH+]ccc3cc(F)ccc32)C1 ZINC000335359702 136075360 /nfs/dbraw/zinc/07/53/60/136075360.db2.gz QHFFMNPQXJLODP-SNVBAGLBSA-N 1 2 246.285 2.193 20 0 BEADLO c1ccc(N2CCC[C@H]2[C@H]2CCCOC2)[nH+]c1 ZINC000335379025 136086939 /nfs/dbraw/zinc/08/69/39/136086939.db2.gz VWLDGSALMVEUJG-STQMWFEESA-N 1 2 232.327 2.477 20 0 BEADLO c1ccc(N2CCC[C@@H]2[C@@H]2CCCOC2)[nH+]c1 ZINC000335379019 136086941 /nfs/dbraw/zinc/08/69/41/136086941.db2.gz VWLDGSALMVEUJG-CHWSQXEVSA-N 1 2 232.327 2.477 20 0 BEADLO c1ccc(N2CC[C@@H](c3cccnc3)C2)[nH+]c1 ZINC000335398915 136093259 /nfs/dbraw/zinc/09/32/59/136093259.db2.gz YQTHTBHZJPRCRO-CYBMUJFWSA-N 1 2 225.295 2.471 20 0 BEADLO C(c1nnc(C2CC2)s1)[NH+]1CCCCC1 ZINC000335584427 136101124 /nfs/dbraw/zinc/10/11/24/136101124.db2.gz NFUSMMVRXNBGCE-UHFFFAOYSA-N 1 2 223.345 2.401 20 0 BEADLO CC(C)n1ccnc1C[N@@H+]1C[C@@H]2C[C@H]1CS2 ZINC000335583323 136101175 /nfs/dbraw/zinc/10/11/75/136101175.db2.gz DGHUMJLZYJEGTQ-QWRGUYRKSA-N 1 2 237.372 2.154 20 0 BEADLO CC(C)n1ccnc1C[N@H+]1C[C@@H]2C[C@H]1CS2 ZINC000335583323 136101176 /nfs/dbraw/zinc/10/11/76/136101176.db2.gz DGHUMJLZYJEGTQ-QWRGUYRKSA-N 1 2 237.372 2.154 20 0 BEADLO Cc1cc(CNC(=O)[C@@H]2CC23CC3)cc(C)[nH+]1 ZINC000335593472 136103873 /nfs/dbraw/zinc/10/38/73/136103873.db2.gz CTGVRFKPTQKWFR-LBPRGKRZSA-N 1 2 230.311 2.115 20 0 BEADLO Cc1cccc2c1cc[nH+]c2N1CCOCC1 ZINC000335595387 136104596 /nfs/dbraw/zinc/10/45/96/136104596.db2.gz BYCGVDHSBGLMES-UHFFFAOYSA-N 1 2 228.295 2.380 20 0 BEADLO CN(C)c1[nH+]cccc1NC(=O)[C@@]12C[C@@H]1CCC2 ZINC000335568562 136108221 /nfs/dbraw/zinc/10/82/21/136108221.db2.gz NJYCMXRTAJHPQP-HZMBPMFUSA-N 1 2 245.326 2.276 20 0 BEADLO Cc1ccc2c(c1)CC[N@@H+](Cc1cnns1)C2 ZINC000335576816 136111073 /nfs/dbraw/zinc/11/10/73/136111073.db2.gz BFNOSCSVBUOHEU-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO Cc1ccc2c(c1)CC[N@H+](Cc1cnns1)C2 ZINC000335576816 136111074 /nfs/dbraw/zinc/11/10/74/136111074.db2.gz BFNOSCSVBUOHEU-UHFFFAOYSA-N 1 2 245.351 2.405 20 0 BEADLO C=C/C=C/CC(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001647827602 1172765748 /nfs/dbraw/zinc/76/57/48/1172765748.db2.gz GAFVNPQSORWPAW-AATRIKPKSA-N 1 2 233.315 2.282 20 0 BEADLO C=C/C=C/CC(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001647827602 1172765761 /nfs/dbraw/zinc/76/57/61/1172765761.db2.gz GAFVNPQSORWPAW-AATRIKPKSA-N 1 2 233.315 2.282 20 0 BEADLO C=C/C=C\CC(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001647827603 1172766074 /nfs/dbraw/zinc/76/60/74/1172766074.db2.gz GAFVNPQSORWPAW-WAYWQWQTSA-N 1 2 233.315 2.282 20 0 BEADLO C=C/C=C\CC(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001647827603 1172766078 /nfs/dbraw/zinc/76/60/78/1172766078.db2.gz GAFVNPQSORWPAW-WAYWQWQTSA-N 1 2 233.315 2.282 20 0 BEADLO C[N@H+](Cc1nccs1)Cc1cccc(O)c1 ZINC000178869406 397850324 /nfs/dbraw/zinc/85/03/24/397850324.db2.gz JLNWNHIYJSUGOP-UHFFFAOYSA-N 1 2 234.324 2.481 20 0 BEADLO C[N@@H+](Cc1nccs1)Cc1cccc(O)c1 ZINC000178869406 397850326 /nfs/dbraw/zinc/85/03/26/397850326.db2.gz JLNWNHIYJSUGOP-UHFFFAOYSA-N 1 2 234.324 2.481 20 0 BEADLO FC(F)(F)CN(CCCn1cc[nH+]c1)C1CC1 ZINC000183105792 397865474 /nfs/dbraw/zinc/86/54/74/397865474.db2.gz CLFNNAGRMOJECB-UHFFFAOYSA-N 1 2 247.264 2.300 20 0 BEADLO CC[C@H](F)C[N@H+](CCOC)Cc1cncs1 ZINC000440492787 397928440 /nfs/dbraw/zinc/92/84/40/397928440.db2.gz JRDVCEFASCVYRZ-JTQLQIEISA-N 1 2 246.351 2.340 20 0 BEADLO CC[C@H](F)C[N@@H+](CCOC)Cc1cncs1 ZINC000440492787 397928445 /nfs/dbraw/zinc/92/84/45/397928445.db2.gz JRDVCEFASCVYRZ-JTQLQIEISA-N 1 2 246.351 2.340 20 0 BEADLO COCc1cc[nH+]c(NCc2cnc(C)o2)c1 ZINC000628326670 397929585 /nfs/dbraw/zinc/92/95/85/397929585.db2.gz QTSCQJZVEFZYHT-UHFFFAOYSA-N 1 2 233.271 2.137 20 0 BEADLO CC[C@]1(C)CCCN(C(=O)CCn2cc[nH+]c2)C1 ZINC000266302886 397935763 /nfs/dbraw/zinc/93/57/63/397935763.db2.gz KNXINMZIRLLDBN-CQSZACIVSA-N 1 2 249.358 2.312 20 0 BEADLO CC(C)C[C@H]1CCN(C(=O)CCn2cc[nH+]c2)C1 ZINC000266681848 397938711 /nfs/dbraw/zinc/93/87/11/397938711.db2.gz LGJNPEQWSIWLIO-CYBMUJFWSA-N 1 2 249.358 2.168 20 0 BEADLO CC[C@@H](CC(=O)NCc1[nH]c[nH+]c1C)C(C)C ZINC000267241838 397943324 /nfs/dbraw/zinc/94/33/24/397943324.db2.gz QQJHMHVZEAFPNN-NSHDSACASA-N 1 2 237.347 2.407 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cc3n(n2)CCC3)C[C@@H]1F ZINC000649578051 397967388 /nfs/dbraw/zinc/96/73/88/397967388.db2.gz DNCPGUXZWNXQKO-MFKMUULPSA-N 1 2 237.322 2.009 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cc3n(n2)CCC3)C[C@@H]1F ZINC000649578051 397967390 /nfs/dbraw/zinc/96/73/90/397967390.db2.gz DNCPGUXZWNXQKO-MFKMUULPSA-N 1 2 237.322 2.009 20 0 BEADLO C[C@H]([NH2+]Cc1nnc2n1CCC2)c1ccsc1 ZINC000268771409 397954338 /nfs/dbraw/zinc/95/43/38/397954338.db2.gz QASYBTYXZLCNET-VIFPVBQESA-N 1 2 248.355 2.137 20 0 BEADLO CCc1cc(N[C@@H](C)[C@@H](OC)C2CC2)nc[nH+]1 ZINC000388245884 397954818 /nfs/dbraw/zinc/95/48/18/397954818.db2.gz SUJRXCUTCQENMX-TVQRCGJNSA-N 1 2 235.331 2.264 20 0 BEADLO Cc1cnc(NCCNc2cccc[nH+]2)nc1C ZINC000270663792 397962000 /nfs/dbraw/zinc/96/20/00/397962000.db2.gz DCKGBWCMSVOYNQ-UHFFFAOYSA-N 1 2 243.314 2.012 20 0 BEADLO O=C(CCC1CC1)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000371525412 397994459 /nfs/dbraw/zinc/99/44/59/397994459.db2.gz MOVAMZHBRIKQKH-LLVKDONJSA-N 1 2 233.315 2.263 20 0 BEADLO FC1(F)CCC[N@H+](CC[C@H]2CCOC2)C1 ZINC000649695955 398044738 /nfs/dbraw/zinc/04/47/38/398044738.db2.gz OVRIWODMJSPEBG-JTQLQIEISA-N 1 2 219.275 2.144 20 0 BEADLO FC1(F)CCC[N@@H+](CC[C@H]2CCOC2)C1 ZINC000649695955 398044739 /nfs/dbraw/zinc/04/47/39/398044739.db2.gz OVRIWODMJSPEBG-JTQLQIEISA-N 1 2 219.275 2.144 20 0 BEADLO CCc1ccncc1NCc1[nH+]ccn1CC ZINC000650242733 398004169 /nfs/dbraw/zinc/00/41/69/398004169.db2.gz WXCGVGBNCNCIQE-UHFFFAOYSA-N 1 2 230.315 2.473 20 0 BEADLO CCn1ccnc1CNc1cc(COC)cc[nH+]1 ZINC000650244649 398006150 /nfs/dbraw/zinc/00/61/50/398006150.db2.gz JCYGAXNWFVQUJU-UHFFFAOYSA-N 1 2 246.314 2.057 20 0 BEADLO CC1(C)CN(c2[nH]c3ccccc3[nH+]2)CC[C@H]1O ZINC000275493196 398021899 /nfs/dbraw/zinc/02/18/99/398021899.db2.gz RPDRMMWXQDCOLS-GFCCVEGCSA-N 1 2 245.326 2.160 20 0 BEADLO C[C@H]([NH2+]Cc1nccn1C)c1ccccc1F ZINC000042224963 398030863 /nfs/dbraw/zinc/03/08/63/398030863.db2.gz HMHFODSFVDMACF-JTQLQIEISA-N 1 2 233.290 2.410 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cc(C)on2)[C@@H](CC)CO1 ZINC000649722333 398065642 /nfs/dbraw/zinc/06/56/42/398065642.db2.gz LYSJBQJVWVVDLQ-QWHCGFSZSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cc(C)on2)[C@@H](CC)CO1 ZINC000649722333 398065645 /nfs/dbraw/zinc/06/56/45/398065645.db2.gz LYSJBQJVWVVDLQ-QWHCGFSZSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1Cc1cc(C)on1 ZINC000649722332 398066186 /nfs/dbraw/zinc/06/61/86/398066186.db2.gz LYSJBQJVWVVDLQ-OLZOCXBDSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1CO[C@@H](CC)C[N@H+]1Cc1cc(C)on1 ZINC000649722332 398066189 /nfs/dbraw/zinc/06/61/89/398066189.db2.gz LYSJBQJVWVVDLQ-OLZOCXBDSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cnc(C)s2)[C@H](C)CO1 ZINC000649731035 398069392 /nfs/dbraw/zinc/06/93/92/398069392.db2.gz BOPYDDSZFIZMIN-MWLCHTKSSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cnc(C)s2)[C@H](C)CO1 ZINC000649731035 398069394 /nfs/dbraw/zinc/06/93/94/398069394.db2.gz BOPYDDSZFIZMIN-MWLCHTKSSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cnc(C)s2)[C@H](C)CO1 ZINC000649731034 398069403 /nfs/dbraw/zinc/06/94/03/398069403.db2.gz BOPYDDSZFIZMIN-KOLCDFICSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cnc(C)s2)[C@H](C)CO1 ZINC000649731034 398069406 /nfs/dbraw/zinc/06/94/06/398069406.db2.gz BOPYDDSZFIZMIN-KOLCDFICSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nc(C)cs2)[C@H](C)CO1 ZINC000649734450 398074938 /nfs/dbraw/zinc/07/49/38/398074938.db2.gz WWGOVWJFBPSQMR-GHMZBOCLSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nc(C)cs2)[C@H](C)CO1 ZINC000649734450 398074940 /nfs/dbraw/zinc/07/49/40/398074940.db2.gz WWGOVWJFBPSQMR-GHMZBOCLSA-N 1 2 240.372 2.451 20 0 BEADLO Cc1cc(C[N@@H+]2CCOC[C@@H]2C2CC2)sn1 ZINC000638116588 398077198 /nfs/dbraw/zinc/07/71/98/398077198.db2.gz JSZXSTIMJRUFJL-GFCCVEGCSA-N 1 2 238.356 2.062 20 0 BEADLO Cc1cc(C[N@H+]2CCOC[C@@H]2C2CC2)sn1 ZINC000638116588 398077199 /nfs/dbraw/zinc/07/71/99/398077199.db2.gz JSZXSTIMJRUFJL-GFCCVEGCSA-N 1 2 238.356 2.062 20 0 BEADLO F[C@H]1CCC[C@H]1[NH2+]Cc1cscn1 ZINC000307567843 398052079 /nfs/dbraw/zinc/05/20/79/398052079.db2.gz UZQWEUJOOFMPCP-DTWKUNHWSA-N 1 2 200.282 2.123 20 0 BEADLO C[C@H](CC(=O)N1CCC2(CC2)CC1)n1cc[nH+]c1 ZINC000649715433 398056618 /nfs/dbraw/zinc/05/66/18/398056618.db2.gz BPIDQGRJGXPTDX-GFCCVEGCSA-N 1 2 247.342 2.237 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@@H+]1Cc1cnc(C)nc1 ZINC000649716909 398057622 /nfs/dbraw/zinc/05/76/22/398057622.db2.gz QLWRVOVTIKTDST-ZDUSSCGKSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@H]1COC(C)(C)C[N@H+]1Cc1cnc(C)nc1 ZINC000649716909 398057627 /nfs/dbraw/zinc/05/76/27/398057627.db2.gz QLWRVOVTIKTDST-ZDUSSCGKSA-N 1 2 249.358 2.174 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1C[C@H](C)O[C@@H]1C ZINC000385058098 398128440 /nfs/dbraw/zinc/12/84/40/398128440.db2.gz CMROLIVKRQHWBC-IVZWLZJFSA-N 1 2 222.288 2.068 20 0 BEADLO COc1ccc(N[C@@H]2C[C@H](C)O[C@@H]2C)[nH+]c1 ZINC000385083810 398132012 /nfs/dbraw/zinc/13/20/12/398132012.db2.gz FLMPZERTWSWYRN-IQJOONFLSA-N 1 2 222.288 2.068 20 0 BEADLO Cc1c[nH]nc1COCc1ccc(C)[nH+]c1C ZINC000650345504 398134873 /nfs/dbraw/zinc/13/48/73/398134873.db2.gz MGVIWVZVFYPOST-UHFFFAOYSA-N 1 2 231.299 2.447 20 0 BEADLO COc1cc[nH+]cc1Cn1cc(C2CC2)cn1 ZINC000650345204 398134903 /nfs/dbraw/zinc/13/49/03/398134903.db2.gz WLODWYDCTUEFCA-UHFFFAOYSA-N 1 2 229.283 2.212 20 0 BEADLO Cn1cc[nH+]c1CCNC(=O)CCC1CCCC1 ZINC000063487723 1172829976 /nfs/dbraw/zinc/82/99/76/1172829976.db2.gz MQLFOAZVXDIQGZ-UHFFFAOYSA-N 1 2 249.358 2.049 20 0 BEADLO FC1C[NH+](C[C@@H]2CCOc3ccccc32)C1 ZINC000680334239 487561047 /nfs/dbraw/zinc/56/10/47/487561047.db2.gz KTUZGZKZECDECV-JTQLQIEISA-N 1 2 221.275 2.206 20 0 BEADLO C/C=C/C(=O)N1CCC[C@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001649369513 1172873755 /nfs/dbraw/zinc/87/37/55/1172873755.db2.gz IGLOOAOBEKSMFL-MALLOTDXSA-N 1 2 233.315 2.266 20 0 BEADLO C=Cn1cc(C[NH2+][C@H](C)c2nccn2CC)cn1 ZINC001651073938 1172920097 /nfs/dbraw/zinc/92/00/97/1172920097.db2.gz SQQNYKHWWPPNPP-LLVKDONJSA-N 1 2 245.330 2.051 20 0 BEADLO Cc1cn[nH]c1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC000685833868 487581995 /nfs/dbraw/zinc/58/19/95/487581995.db2.gz NOWMQCCUZRSOHU-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cn[nH]c1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000685833868 487582000 /nfs/dbraw/zinc/58/20/00/487582000.db2.gz NOWMQCCUZRSOHU-AWEZNQCLSA-N 1 2 242.326 2.450 20 0 BEADLO CC(C)O[C@@H]1C[C@H]([NH2+]Cc2ccn[nH]2)C1(C)C ZINC000361238162 167281244 /nfs/dbraw/zinc/28/12/44/167281244.db2.gz SIOBFOVLFCHGQV-NWDGAFQWSA-N 1 2 237.347 2.091 20 0 BEADLO CC(C)OCC[NH2+]Cc1n[nH]c2ccccc21 ZINC000680485651 487605482 /nfs/dbraw/zinc/60/54/82/487605482.db2.gz MDNIBUWRLAXTBV-UHFFFAOYSA-N 1 2 233.315 2.078 20 0 BEADLO CCn1cc(C[N@H+](Cc2cocn2)C(C)C)cn1 ZINC000651960076 409765164 /nfs/dbraw/zinc/76/51/64/409765164.db2.gz PREAUYQMWDNAHR-UHFFFAOYSA-N 1 2 248.330 2.302 20 0 BEADLO CCn1cc(C[N@@H+](Cc2cocn2)C(C)C)cn1 ZINC000651960076 409765169 /nfs/dbraw/zinc/76/51/69/409765169.db2.gz PREAUYQMWDNAHR-UHFFFAOYSA-N 1 2 248.330 2.302 20 0 BEADLO Cc1ccccc1[C@@H](C)[N@H+](C)Cc1n[nH]c(=O)o1 ZINC000660848909 409861068 /nfs/dbraw/zinc/86/10/68/409861068.db2.gz RNNXFGGTCMOLFR-SNVBAGLBSA-N 1 2 247.298 2.277 20 0 BEADLO Cc1ccccc1[C@@H](C)[N@@H+](C)Cc1n[nH]c(=O)o1 ZINC000660848909 409861076 /nfs/dbraw/zinc/86/10/76/409861076.db2.gz RNNXFGGTCMOLFR-SNVBAGLBSA-N 1 2 247.298 2.277 20 0 BEADLO CSc1cccnc1NCc1c[nH+]cn1C ZINC000651970891 409940825 /nfs/dbraw/zinc/94/08/25/409940825.db2.gz OCXKXYXOXMYGND-UHFFFAOYSA-N 1 2 234.328 2.149 20 0 BEADLO CCc1cc[nH+]cc1N[C@@H](C)Cn1cccn1 ZINC000651979356 410112940 /nfs/dbraw/zinc/11/29/40/410112940.db2.gz LMPCYYIMKMILGG-NSHDSACASA-N 1 2 230.315 2.341 20 0 BEADLO CC[C@@H](O)C[NH2+]CC(F)(F)c1ccccc1C ZINC000663367312 410157161 /nfs/dbraw/zinc/15/71/61/410157161.db2.gz QBKXEZDBKXTGQJ-LLVKDONJSA-N 1 2 243.297 2.447 20 0 BEADLO Cc1cc(CNc2ccc(C)[nH+]c2)on1 ZINC000309039815 410204707 /nfs/dbraw/zinc/20/47/07/410204707.db2.gz JADKHHPEJJPBBS-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO C[C@@H](NC(=O)[C@H](C)C1CCC1)c1[nH]cc[nH+]1 ZINC000655401950 410206327 /nfs/dbraw/zinc/20/63/27/410206327.db2.gz HBWXKEJJJWZICJ-RKDXNWHRSA-N 1 2 221.304 2.023 20 0 BEADLO C[C@@H](NC(=O)[C@@H](C)C1CCCC1)c1[nH]cc[nH+]1 ZINC000655401808 410206455 /nfs/dbraw/zinc/20/64/55/410206455.db2.gz HEGICWLFXPZXAJ-VHSXEESVSA-N 1 2 235.331 2.413 20 0 BEADLO C[C@@H](NC(=O)[C@H]1C[C@H]1C1CCCC1)c1[nH]cc[nH+]1 ZINC000655402741 410208348 /nfs/dbraw/zinc/20/83/48/410208348.db2.gz PIWNMOXDFYZQCC-USWWRNFRSA-N 1 2 247.342 2.413 20 0 BEADLO C[C@]1(NC(=O)CCCn2cc[nH+]c2)CC=CCC1 ZINC000655454984 410450117 /nfs/dbraw/zinc/45/01/17/410450117.db2.gz IJZWXVUYBUIKTJ-AWEZNQCLSA-N 1 2 247.342 2.278 20 0 BEADLO CCc1cc(NC[C@H]2CCC[C@H](C)O2)nc[nH+]1 ZINC000664394110 410576378 /nfs/dbraw/zinc/57/63/78/410576378.db2.gz KURGMIXFMTUYDY-CMPLNLGQSA-N 1 2 235.331 2.409 20 0 BEADLO Cc1cc(N[C@@H](C)C2(CO)CC2)nc(C2CC2)[nH+]1 ZINC000664273890 410547770 /nfs/dbraw/zinc/54/77/70/410547770.db2.gz ZGCNHXUKDJOXPH-JTQLQIEISA-N 1 2 247.342 2.235 20 0 BEADLO CC/C=C\CC[N@@H+]1CC[C@H](O)C(F)(F)C1 ZINC000661405465 410617619 /nfs/dbraw/zinc/61/76/19/410617619.db2.gz DLTXCUBZUKAAMC-XOULXFPDSA-N 1 2 219.275 2.045 20 0 BEADLO CC/C=C\CC[N@H+]1CC[C@H](O)C(F)(F)C1 ZINC000661405465 410617623 /nfs/dbraw/zinc/61/76/23/410617623.db2.gz DLTXCUBZUKAAMC-XOULXFPDSA-N 1 2 219.275 2.045 20 0 BEADLO C[C@@H](CC(=O)N1CCC[C@H](C)C1)n1cc[nH+]c1 ZINC000650985526 410674749 /nfs/dbraw/zinc/67/47/49/410674749.db2.gz SSCNGPSGRXQJKQ-RYUDHWBXSA-N 1 2 235.331 2.093 20 0 BEADLO O[C@H]1CC[N@H+](CCCC2CCC2)CC1(F)F ZINC000661414766 410625926 /nfs/dbraw/zinc/62/59/26/410625926.db2.gz VSJXTUKJNOWLFC-NSHDSACASA-N 1 2 233.302 2.269 20 0 BEADLO O[C@H]1CC[N@@H+](CCCC2CCC2)CC1(F)F ZINC000661414766 410625929 /nfs/dbraw/zinc/62/59/29/410625929.db2.gz VSJXTUKJNOWLFC-NSHDSACASA-N 1 2 233.302 2.269 20 0 BEADLO C[C@H](C(N)=O)[N@@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000661437828 410658857 /nfs/dbraw/zinc/65/88/57/410658857.db2.gz PLQHDUZPRLFJGL-ZYHUDNBSSA-N 1 2 248.326 2.071 20 0 BEADLO C[C@H](C(N)=O)[N@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000661437828 410658861 /nfs/dbraw/zinc/65/88/61/410658861.db2.gz PLQHDUZPRLFJGL-ZYHUDNBSSA-N 1 2 248.326 2.071 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2nnc(C)o2)cs1 ZINC000661528778 410727638 /nfs/dbraw/zinc/72/76/38/410727638.db2.gz KXYFKUFHQSHAMJ-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2nnc(C)o2)cs1 ZINC000661528778 410727643 /nfs/dbraw/zinc/72/76/43/410727643.db2.gz KXYFKUFHQSHAMJ-UHFFFAOYSA-N 1 2 237.328 2.380 20 0 BEADLO COc1ccc[nH+]c1N[C@@H](C)[C@H]1CCCCO1 ZINC000393625027 410751209 /nfs/dbraw/zinc/75/12/09/410751209.db2.gz VRRCATJEFWKZKG-WDEREUQCSA-N 1 2 236.315 2.460 20 0 BEADLO COc1ccc[nH+]c1N[C@@H](C)[C@@H]1CCCCO1 ZINC000393625026 410749304 /nfs/dbraw/zinc/74/93/04/410749304.db2.gz VRRCATJEFWKZKG-QWRGUYRKSA-N 1 2 236.315 2.460 20 0 BEADLO CC(C)C[NH2+][C@H](c1cn[nH]n1)c1ccc(F)cc1 ZINC000340477033 167011696 /nfs/dbraw/zinc/01/16/96/167011696.db2.gz WHVQMMYNACVBIY-ZDUSSCGKSA-N 1 2 248.305 2.279 20 0 BEADLO CC(C)C[NH2+][C@H](c1c[nH]nn1)c1ccc(F)cc1 ZINC000340477033 167011697 /nfs/dbraw/zinc/01/16/97/167011697.db2.gz WHVQMMYNACVBIY-ZDUSSCGKSA-N 1 2 248.305 2.279 20 0 BEADLO CCCC(C)(C)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000651293058 410902909 /nfs/dbraw/zinc/90/29/09/410902909.db2.gz ZJSHIBXIURDQFX-UHFFFAOYSA-N 1 2 223.320 2.194 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1C[C@H](OC)C12CCC2 ZINC000651302510 410910424 /nfs/dbraw/zinc/91/04/24/410910424.db2.gz XGHADMAKMDUJHX-RYUDHWBXSA-N 1 2 248.326 2.460 20 0 BEADLO CC(C)OCCNc1nc(N)c2ccccc2[nH+]1 ZINC000302113796 167245841 /nfs/dbraw/zinc/24/58/41/167245841.db2.gz BRQAWWIQDUFJJE-UHFFFAOYSA-N 1 2 246.314 2.049 20 0 BEADLO Cc1cc(C)c(CNc2ncncc2Cl)c[nH+]1 ZINC000397027295 410911467 /nfs/dbraw/zinc/91/14/67/410911467.db2.gz VQBWAPCERBTNNM-UHFFFAOYSA-N 1 2 248.717 2.176 20 0 BEADLO COCCn1nc(C(F)(F)F)c2c[nH+]ccc21 ZINC000179932735 410912260 /nfs/dbraw/zinc/91/22/60/410912260.db2.gz NSQZJQYAYVYXIT-UHFFFAOYSA-N 1 2 245.204 2.097 20 0 BEADLO CC(C)[C@@H](C)C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000336537286 167347982 /nfs/dbraw/zinc/34/79/82/167347982.db2.gz OQVWNIKWWNAGBE-GHMZBOCLSA-N 1 2 235.331 2.365 20 0 BEADLO C[C@H]([NH2+][C@H]1CCCC1(F)F)c1cn[nH]c1 ZINC000398025857 410940253 /nfs/dbraw/zinc/94/02/53/410940253.db2.gz DTVMPMYXWDNFRS-CBAPKCEASA-N 1 2 215.247 2.248 20 0 BEADLO CCC[C@H](C)[C@@H](CO)Nc1cc(CC)[nH+]cn1 ZINC000651384259 410966379 /nfs/dbraw/zinc/96/63/79/410966379.db2.gz IIPRAEXDZPUKLU-CMPLNLGQSA-N 1 2 237.347 2.248 20 0 BEADLO Cc1nc(N2CCC[C@H](OC(C)C)C2)cc[nH+]1 ZINC000651386232 410971494 /nfs/dbraw/zinc/97/14/94/410971494.db2.gz HHSIESGLWPTTAT-LBPRGKRZSA-N 1 2 235.331 2.179 20 0 BEADLO Cc1cc(N[C@H](C2CC2)C2CCOCC2)nc[nH+]1 ZINC000651402714 410984594 /nfs/dbraw/zinc/98/45/94/410984594.db2.gz BWEUTZLGEUEJHW-CQSZACIVSA-N 1 2 247.342 2.402 20 0 BEADLO Cc1nc(N[C@H](C2CC2)C2CCOCC2)cc[nH+]1 ZINC000651402967 410985094 /nfs/dbraw/zinc/98/50/94/410985094.db2.gz ISPYXIOAJRVYAT-CQSZACIVSA-N 1 2 247.342 2.402 20 0 BEADLO c1nc(NC2CC3(CCC3)C2)c2c([nH+]1)NCCO2 ZINC000651473266 411055625 /nfs/dbraw/zinc/05/56/25/411055625.db2.gz GSYJVNUKAPFOTP-UHFFFAOYSA-N 1 2 246.314 2.026 20 0 BEADLO c1nc2c(c(NC3CC4(CCC4)C3)[nH+]1)OCCN2 ZINC000651473266 411055630 /nfs/dbraw/zinc/05/56/30/411055630.db2.gz GSYJVNUKAPFOTP-UHFFFAOYSA-N 1 2 246.314 2.026 20 0 BEADLO Cc1cc(N2CC[C@]3(CC3(F)F)C2)nc[nH+]1 ZINC000651488197 411071405 /nfs/dbraw/zinc/07/14/05/411071405.db2.gz RAIXSFSGNISGGF-JTQLQIEISA-N 1 2 225.242 2.021 20 0 BEADLO C[C@@H](NC(=O)[C@@H]1CCC(F)(F)C1)c1[nH]cc[nH+]1 ZINC000302518040 411137873 /nfs/dbraw/zinc/13/78/73/411137873.db2.gz VXYMCHMUBWQPTP-HTQZYQBOSA-N 1 2 243.257 2.022 20 0 BEADLO C[C@H](CC(=O)N1CC[C@H]2CCC[C@@H]21)n1cc[nH+]c1 ZINC000651781279 411143237 /nfs/dbraw/zinc/14/32/37/411143237.db2.gz GHJHNGRAYPTDSU-UPJWGTAASA-N 1 2 247.342 2.235 20 0 BEADLO COc1ccc(C[N@@H+]2CC[C@H](F)C2)c(F)c1 ZINC000651821073 411145784 /nfs/dbraw/zinc/14/57/84/411145784.db2.gz BNMRCDHOBZDYMZ-JTQLQIEISA-N 1 2 227.254 2.378 20 0 BEADLO COc1ccc(C[N@H+]2CC[C@H](F)C2)c(F)c1 ZINC000651821073 411145785 /nfs/dbraw/zinc/14/57/85/411145785.db2.gz BNMRCDHOBZDYMZ-JTQLQIEISA-N 1 2 227.254 2.378 20 0 BEADLO COCC(C)(C)C[N@@H+]1CCCC(F)(F)C1 ZINC000651895968 411149776 /nfs/dbraw/zinc/14/97/76/411149776.db2.gz CMUFIYFNVKREHD-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO COCC(C)(C)C[N@H+]1CCCC(F)(F)C1 ZINC000651895968 411149777 /nfs/dbraw/zinc/14/97/77/411149777.db2.gz CMUFIYFNVKREHD-UHFFFAOYSA-N 1 2 221.291 2.390 20 0 BEADLO Cc1ccc(C[N@@H+]2CCC[C@@H]2c2cc[nH]n2)cn1 ZINC000653648774 411155492 /nfs/dbraw/zinc/15/54/92/411155492.db2.gz ITCQWEBQKHXCIW-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1ccc(C[N@H+]2CCC[C@@H]2c2cc[nH]n2)cn1 ZINC000653648774 411155496 /nfs/dbraw/zinc/15/54/96/411155496.db2.gz ITCQWEBQKHXCIW-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2C[C@H](C)O[C@H]2C)c1 ZINC000652067704 411103010 /nfs/dbraw/zinc/10/30/10/411103010.db2.gz DHWBWRQVOWLFIJ-JBLDHEPKSA-N 1 2 236.315 2.206 20 0 BEADLO COCc1cc[nH+]c(N[C@H]2COC(C)(C)C2)c1 ZINC000652067709 411103260 /nfs/dbraw/zinc/10/32/60/411103260.db2.gz DKEVXAHOHUOGDV-LLVKDONJSA-N 1 2 236.315 2.207 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](C)COC(C)C)c1 ZINC000652068175 411104713 /nfs/dbraw/zinc/10/47/13/411104713.db2.gz VGUIPCAEIPOLHM-NSHDSACASA-N 1 2 238.331 2.453 20 0 BEADLO Fc1cnccc1C[N@H+]1CCC[C@H](F)C1 ZINC000652076127 411107824 /nfs/dbraw/zinc/10/78/24/411107824.db2.gz ONTUMYWJZDTNHO-JTQLQIEISA-N 1 2 212.243 2.155 20 0 BEADLO Fc1cnccc1C[N@@H+]1CCC[C@H](F)C1 ZINC000652076127 411107827 /nfs/dbraw/zinc/10/78/27/411107827.db2.gz ONTUMYWJZDTNHO-JTQLQIEISA-N 1 2 212.243 2.155 20 0 BEADLO F[C@@H]1CCC[N@H+](Cc2cncs2)C1 ZINC000652076864 411108810 /nfs/dbraw/zinc/10/88/10/411108810.db2.gz BQOSBAIYBNTIBF-MRVPVSSYSA-N 1 2 200.282 2.077 20 0 BEADLO F[C@@H]1CCC[N@@H+](Cc2cncs2)C1 ZINC000652076864 411108811 /nfs/dbraw/zinc/10/88/11/411108811.db2.gz BQOSBAIYBNTIBF-MRVPVSSYSA-N 1 2 200.282 2.077 20 0 BEADLO Fc1cccnc1C[NH2+][C@@H]1CCCn2nccc21 ZINC000657929226 411169301 /nfs/dbraw/zinc/16/93/01/411169301.db2.gz DKQOYSWNWDDHHE-LLVKDONJSA-N 1 2 246.289 2.042 20 0 BEADLO COc1c(C)[nH+]cnc1NCc1ccsc1 ZINC000656108798 411179402 /nfs/dbraw/zinc/17/94/02/411179402.db2.gz ZXFNASDHAWETLV-UHFFFAOYSA-N 1 2 235.312 2.467 20 0 BEADLO COc1c(C)[nH+]cnc1NCCC1CC1 ZINC000656128839 411184237 /nfs/dbraw/zinc/18/42/37/411184237.db2.gz DRMYLRKQKNMLQQ-UHFFFAOYSA-N 1 2 207.277 2.006 20 0 BEADLO CC[C@H]1CN(c2nc(C)[nH+]cc2C)CCS1 ZINC000656133115 411184926 /nfs/dbraw/zinc/18/49/26/411184926.db2.gz ZMBYHVJQELUKAP-NSHDSACASA-N 1 2 237.372 2.425 20 0 BEADLO C[C@H]([NH2+][C@@H]1C[C@@H](C)n2ncnc21)c1ccco1 ZINC000658097778 411244430 /nfs/dbraw/zinc/24/44/30/411244430.db2.gz JBXVZLPFJGZFHB-KXUCPTDWSA-N 1 2 232.287 2.228 20 0 BEADLO CCOCC[NH+]1Cc2cc(F)c(F)cc2C1 ZINC000653830523 411195749 /nfs/dbraw/zinc/19/57/49/411195749.db2.gz CGDSPINTXRRRTO-UHFFFAOYSA-N 1 2 227.254 2.317 20 0 BEADLO COCCC[NH+]1Cc2cc(F)c(F)cc2C1 ZINC000653830823 411195886 /nfs/dbraw/zinc/19/58/86/411195886.db2.gz LVAGENPPEIKHAD-UHFFFAOYSA-N 1 2 227.254 2.317 20 0 BEADLO Fc1cc2c(cc1F)C[NH+](CCn1cccn1)C2 ZINC000653831126 411196085 /nfs/dbraw/zinc/19/60/85/411196085.db2.gz VICLDQOODOUXFV-UHFFFAOYSA-N 1 2 249.264 2.177 20 0 BEADLO Cc1cc(CCNc2nc(C)[nH+]cc2C)on1 ZINC000656188164 411196630 /nfs/dbraw/zinc/19/66/30/411196630.db2.gz SQWBCFUMNGLUQF-UHFFFAOYSA-N 1 2 232.287 2.044 20 0 BEADLO COc1c(C)[nH+]cnc1N[C@H]1CC[C@H]1C ZINC000656188208 411196769 /nfs/dbraw/zinc/19/67/69/411196769.db2.gz ZRZUPVIJTNGIEP-APPZFPTMSA-N 1 2 207.277 2.004 20 0 BEADLO FC1(F)CCC[C@H]1[NH2+][C@H]1CCCn2nccc21 ZINC000658016344 411198376 /nfs/dbraw/zinc/19/83/76/411198376.db2.gz XAGIKRLIRNRDCX-GXSJLCMTSA-N 1 2 241.285 2.495 20 0 BEADLO CC[C@@H]([NH2+][C@H]1CCCn2nccc21)C(F)F ZINC000658024255 411201607 /nfs/dbraw/zinc/20/16/07/411201607.db2.gz ITBYZANBHFZUIC-BDAKNGLRSA-N 1 2 229.274 2.351 20 0 BEADLO CC[C@H]([NH2+][C@@H]1CCCn2nccc21)C(F)F ZINC000658024256 411201682 /nfs/dbraw/zinc/20/16/82/411201682.db2.gz ITBYZANBHFZUIC-DTWKUNHWSA-N 1 2 229.274 2.351 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](C)c2nccn2C)c1 ZINC000652330849 411202589 /nfs/dbraw/zinc/20/25/89/411202589.db2.gz QSSQVNMWYGSMOX-JTQLQIEISA-N 1 2 246.314 2.135 20 0 BEADLO COc1c(C)[nH+]cnc1N1CC[C@H](C2CCC2)C1 ZINC000656201662 411206099 /nfs/dbraw/zinc/20/60/99/411206099.db2.gz OSCNNVZYOVWSRL-LBPRGKRZSA-N 1 2 247.342 2.420 20 0 BEADLO COCC[C@H](C)CNc1nc(C)[nH+]cc1C ZINC000656202015 411206143 /nfs/dbraw/zinc/20/61/43/411206143.db2.gz NFOCXOKHTUCOLH-VIFPVBQESA-N 1 2 223.320 2.178 20 0 BEADLO FC(F)C1(N[C@H]2CCCn3cc[nH+]c32)CC1 ZINC000655763587 411207157 /nfs/dbraw/zinc/20/71/57/411207157.db2.gz QVXLJTCFBSAVPN-QMMMGPOBSA-N 1 2 227.258 2.105 20 0 BEADLO FC(F)C1(N[C@@H]2CCCn3cc[nH+]c32)CC1 ZINC000655763586 411207473 /nfs/dbraw/zinc/20/74/73/411207473.db2.gz QVXLJTCFBSAVPN-MRVPVSSYSA-N 1 2 227.258 2.105 20 0 BEADLO CC[C@@H]1C[C@H](Nc2nc(C)[nH+]cc2C)CCO1 ZINC000656204961 411207911 /nfs/dbraw/zinc/20/79/11/411207911.db2.gz RTNGGYIIRMLQJX-VXGBXAGGSA-N 1 2 235.331 2.463 20 0 BEADLO Cc1noc(C[N@H+](C)CCCOC(C)(C)C)n1 ZINC000653890620 411210139 /nfs/dbraw/zinc/21/01/39/411210139.db2.gz HKVDUVHNTJFVCE-UHFFFAOYSA-N 1 2 241.335 2.015 20 0 BEADLO Cc1noc(C[N@@H+](C)CCCOC(C)(C)C)n1 ZINC000653890620 411210141 /nfs/dbraw/zinc/21/01/41/411210141.db2.gz HKVDUVHNTJFVCE-UHFFFAOYSA-N 1 2 241.335 2.015 20 0 BEADLO COCC1(CNc2cc[nH+]c(C3CC3)n2)CC1 ZINC000656214052 411211654 /nfs/dbraw/zinc/21/16/54/411211654.db2.gz MRLVWJBLTLMRCB-UHFFFAOYSA-N 1 2 233.315 2.193 20 0 BEADLO Cc1nc(N[C@@H](C)Cc2ccccn2)cc[nH+]1 ZINC000656221912 411212276 /nfs/dbraw/zinc/21/22/76/411212276.db2.gz XAPXUBKEODLIDL-JTQLQIEISA-N 1 2 228.299 2.223 20 0 BEADLO Cc1cc(N2CCC[C@@H](OC3CCC3)C2)nc[nH+]1 ZINC000656217752 411212397 /nfs/dbraw/zinc/21/23/97/411212397.db2.gz SBTAWVRIPAYHOX-CYBMUJFWSA-N 1 2 247.342 2.323 20 0 BEADLO CCc1cc(N[C@H](C)Cc2ccccn2)nc[nH+]1 ZINC000656221951 411212867 /nfs/dbraw/zinc/21/28/67/411212867.db2.gz YHPSFDCTGDFREY-LLVKDONJSA-N 1 2 242.326 2.477 20 0 BEADLO C[C@H]([NH2+][C@@H]1C[C@@H](C)n2ncnc21)c1ccoc1 ZINC000658101936 411246391 /nfs/dbraw/zinc/24/63/91/411246391.db2.gz NOTLIARIOCWGLU-WCABBAIRSA-N 1 2 232.287 2.228 20 0 BEADLO CC[C@@H]1C[C@H](Nc2cc(COC)cc[nH+]2)CO1 ZINC000658043396 411216663 /nfs/dbraw/zinc/21/66/63/411216663.db2.gz HEUSCOCZLSKIHD-NWDGAFQWSA-N 1 2 236.315 2.207 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000656272562 411222925 /nfs/dbraw/zinc/22/29/25/411222925.db2.gz XUFMZJRLSBUHJC-CQSZACIVSA-N 1 2 249.358 2.252 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000656272562 411222929 /nfs/dbraw/zinc/22/29/29/411222929.db2.gz XUFMZJRLSBUHJC-CQSZACIVSA-N 1 2 249.358 2.252 20 0 BEADLO C[C@H]([NH2+][C@@H]1CCCn2ccnc21)c1ccccn1 ZINC000655684656 411226192 /nfs/dbraw/zinc/22/61/92/411226192.db2.gz UEQWWKZWNMWJPO-WCQYABFASA-N 1 2 242.326 2.464 20 0 BEADLO Cc1csc(C[NH2+][C@H]2CCCn3ccnc32)n1 ZINC000655685517 411227925 /nfs/dbraw/zinc/22/79/25/411227925.db2.gz GKMJGEOWHNFRTO-JTQLQIEISA-N 1 2 248.355 2.273 20 0 BEADLO CC(C)(NC(=O)C[C@@H]1CC[C@H]2C[C@H]21)c1[nH]cc[nH+]1 ZINC000652413507 411232964 /nfs/dbraw/zinc/23/29/64/411232964.db2.gz OGWQHOKCEBKGTR-GARJFASQSA-N 1 2 247.342 2.197 20 0 BEADLO CC(C)(NC(=O)[C@@H]1CC12CCCC2)c1[nH]cc[nH+]1 ZINC000652411801 411233764 /nfs/dbraw/zinc/23/37/64/411233764.db2.gz VZMMBMIWDMJJRC-JTQLQIEISA-N 1 2 247.342 2.341 20 0 BEADLO C[C@@H]1Cc2cc(-c3[nH+]ccn3C)ccc2O1 ZINC000656371566 411236250 /nfs/dbraw/zinc/23/62/50/411236250.db2.gz INTXCBWEWQKGIF-SECBINFHSA-N 1 2 214.268 2.411 20 0 BEADLO c1c(C[N@@H+]2CCOCC23CCC3)onc1C1CC1 ZINC000660117555 411237403 /nfs/dbraw/zinc/23/74/03/411237403.db2.gz OHIHTBDNZJKXKF-UHFFFAOYSA-N 1 2 248.326 2.307 20 0 BEADLO c1c(C[N@H+]2CCOCC23CCC3)onc1C1CC1 ZINC000660117555 411237406 /nfs/dbraw/zinc/23/74/06/411237406.db2.gz OHIHTBDNZJKXKF-UHFFFAOYSA-N 1 2 248.326 2.307 20 0 BEADLO c1c(C[N@@H+]2CCOC3(CCC3)C2)onc1C1CC1 ZINC000660155059 411267926 /nfs/dbraw/zinc/26/79/26/411267926.db2.gz KHOPTLBQDUEHJU-UHFFFAOYSA-N 1 2 248.326 2.307 20 0 BEADLO c1c(C[N@H+]2CCOC3(CCC3)C2)onc1C1CC1 ZINC000660155059 411267929 /nfs/dbraw/zinc/26/79/29/411267929.db2.gz KHOPTLBQDUEHJU-UHFFFAOYSA-N 1 2 248.326 2.307 20 0 BEADLO O=C(CCCn1cc[nH+]c1)N1CCC12CCCC2 ZINC000652575534 411280549 /nfs/dbraw/zinc/28/05/49/411280549.db2.gz DTTUWMCKTWUKMO-UHFFFAOYSA-N 1 2 247.342 2.208 20 0 BEADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cnccn2)o1 ZINC000656490074 411285769 /nfs/dbraw/zinc/28/57/69/411285769.db2.gz IFNMNRBXCUFDDL-MFKMUULPSA-N 1 2 243.310 2.483 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1cc(C)nc(C)n1 ZINC000659840911 411329152 /nfs/dbraw/zinc/32/91/52/411329152.db2.gz LPJCCLVTAVSDGQ-SMDDNHRTSA-N 1 2 249.358 2.093 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1cc(C)nc(C)n1 ZINC000659840911 411329155 /nfs/dbraw/zinc/32/91/55/411329155.db2.gz LPJCCLVTAVSDGQ-SMDDNHRTSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1cnc(C[NH2+][C@H]2CCCn3ccnc32)s1 ZINC000655720420 411288980 /nfs/dbraw/zinc/28/89/80/411288980.db2.gz WOLMBIQECFKNBT-JTQLQIEISA-N 1 2 248.355 2.273 20 0 BEADLO C=Cn1cc(C[NH+]2CC(CC(F)(F)F)C2)cn1 ZINC000656688113 411329356 /nfs/dbraw/zinc/32/93/56/411329356.db2.gz HMRLYADMIQUCRE-UHFFFAOYSA-N 1 2 245.248 2.368 20 0 BEADLO COc1ccc(C[NH+]2CC(C(F)F)C2)cc1O ZINC000656691415 411329880 /nfs/dbraw/zinc/32/98/80/411329880.db2.gz XABIEFVDOQBCIX-UHFFFAOYSA-N 1 2 243.253 2.098 20 0 BEADLO FC1CC2(C1)C[NH+](Cc1cscn1)C2 ZINC000656693747 411331324 /nfs/dbraw/zinc/33/13/24/411331324.db2.gz AEVAYFNGSKMFCI-UHFFFAOYSA-N 1 2 212.293 2.077 20 0 BEADLO C[C@@H](O)CC[NH2+]c1ccc(-n2cccn2)cc1 ZINC000656640200 411313924 /nfs/dbraw/zinc/31/39/24/411313924.db2.gz GVAJQETYDHBAHI-LLVKDONJSA-N 1 2 231.299 2.055 20 0 BEADLO Nc1ccc(NC(=O)[C@@H]2C[C@@H]3C=C[C@H]2CC3)c[nH+]1 ZINC000402835444 411318807 /nfs/dbraw/zinc/31/88/07/411318807.db2.gz UQIOMGNOFLQPGG-JFGNBEQYSA-N 1 2 243.310 2.035 20 0 BEADLO C[C@H]([NH2+][C@H]1C[C@@H](C)n2ncnc21)c1cccnc1 ZINC000656679788 411320885 /nfs/dbraw/zinc/32/08/85/411320885.db2.gz KLOYSSDFIQZNGD-SCVCMEIPSA-N 1 2 243.314 2.030 20 0 BEADLO c1cc([C@@H]2CCC[N@H+]2CCc2cnn[nH]2)cs1 ZINC000659839281 411321474 /nfs/dbraw/zinc/32/14/74/411321474.db2.gz PUWJIVYMHMIZGL-LBPRGKRZSA-N 1 2 248.355 2.246 20 0 BEADLO c1cc([C@@H]2CCC[N@@H+]2CCc2cnn[nH]2)cs1 ZINC000659839281 411321478 /nfs/dbraw/zinc/32/14/78/411321478.db2.gz PUWJIVYMHMIZGL-LBPRGKRZSA-N 1 2 248.355 2.246 20 0 BEADLO C[C@H](N[C@H]1CCCn2cc[nH+]c21)C(F)(F)F ZINC000655767500 411249850 /nfs/dbraw/zinc/24/98/50/411249850.db2.gz GMASQPCKJZLBNG-YUMQZZPRSA-N 1 2 233.237 2.258 20 0 BEADLO FC1(F)CCC[C@H]1N[C@@H]1CCCn2cc[nH+]c21 ZINC000655769296 411251313 /nfs/dbraw/zinc/25/13/13/411251313.db2.gz XIYIHTBYHRGFPL-NXEZZACHSA-N 1 2 241.285 2.495 20 0 BEADLO CC[C@@H](N[C@H]1CCCn2cc[nH+]c21)C(F)F ZINC000655771450 411253768 /nfs/dbraw/zinc/25/37/68/411253768.db2.gz LGGVOSWHBHXLIQ-BDAKNGLRSA-N 1 2 229.274 2.351 20 0 BEADLO c1coc(C[NH2+]Cc2cc3n(n2)CCCC3)c1 ZINC000655704260 411255367 /nfs/dbraw/zinc/25/53/67/411255367.db2.gz UZIQLYHXQKHTGJ-UHFFFAOYSA-N 1 2 231.299 2.102 20 0 BEADLO C[N@H+](CCOCC1CCCC1)Cc1ncc[nH]1 ZINC000660140786 411256129 /nfs/dbraw/zinc/25/61/29/411256129.db2.gz ACCKYDBLLROWTD-UHFFFAOYSA-N 1 2 237.347 2.048 20 0 BEADLO C[N@@H+](CCOCC1CCCC1)Cc1ncc[nH]1 ZINC000660140786 411256132 /nfs/dbraw/zinc/25/61/32/411256132.db2.gz ACCKYDBLLROWTD-UHFFFAOYSA-N 1 2 237.347 2.048 20 0 BEADLO CCc1ncc(C[NH2+][C@H]2CCCn3ccnc32)o1 ZINC000655773951 411256983 /nfs/dbraw/zinc/25/69/83/411256983.db2.gz LUZCRFYEWDAJMK-NSHDSACASA-N 1 2 246.314 2.058 20 0 BEADLO Cc1cc[nH+]cc1Cc1nc([C@H]2C[C@H]2C)no1 ZINC000656754603 411350818 /nfs/dbraw/zinc/35/08/18/411350818.db2.gz MOZQRIWBHAKNCH-KOLCDFICSA-N 1 2 229.283 2.487 20 0 BEADLO Cc1cc[nH+]cc1Cc1nc([C@@H]2C[C@@H]2C)no1 ZINC000656754602 411351370 /nfs/dbraw/zinc/35/13/70/411351370.db2.gz MOZQRIWBHAKNCH-GXSJLCMTSA-N 1 2 229.283 2.487 20 0 BEADLO CC[N@H+](Cc1ccoc1)Cc1cn(C)cn1 ZINC000659870928 411356592 /nfs/dbraw/zinc/35/65/92/411356592.db2.gz NUBXTUPJONUWGJ-UHFFFAOYSA-N 1 2 219.288 2.035 20 0 BEADLO CC[N@@H+](Cc1ccoc1)Cc1cn(C)cn1 ZINC000659870928 411356595 /nfs/dbraw/zinc/35/65/95/411356595.db2.gz NUBXTUPJONUWGJ-UHFFFAOYSA-N 1 2 219.288 2.035 20 0 BEADLO c1cc(CNc2c[nH+]cc3c2CCCC3)n[nH]1 ZINC000656776746 411356654 /nfs/dbraw/zinc/35/66/54/411356654.db2.gz RKCQZKOEIVRQSZ-UHFFFAOYSA-N 1 2 228.299 2.296 20 0 BEADLO CCc1cc[nH+]cc1NCc1cnn2c1CCC2 ZINC000656776257 411356858 /nfs/dbraw/zinc/35/68/58/411356858.db2.gz KYHZCDNHMHKZKQ-UHFFFAOYSA-N 1 2 242.326 2.399 20 0 BEADLO CCCC[N@H+](CC)Cc1nnn(C(C)(C)C)n1 ZINC000653481250 411357517 /nfs/dbraw/zinc/35/75/17/411357517.db2.gz CFNTXSCNTNAONA-UHFFFAOYSA-N 1 2 239.367 2.050 20 0 BEADLO CCCC[N@@H+](CC)Cc1nnn(C(C)(C)C)n1 ZINC000653481250 411357519 /nfs/dbraw/zinc/35/75/19/411357519.db2.gz CFNTXSCNTNAONA-UHFFFAOYSA-N 1 2 239.367 2.050 20 0 BEADLO CC(C)c1cccc(C[N@@H+]2CCNC(=O)[C@H]2C)c1 ZINC000659874163 411358580 /nfs/dbraw/zinc/35/85/80/411358580.db2.gz PTZKFTZYLPYKFW-GFCCVEGCSA-N 1 2 246.354 2.130 20 0 BEADLO CC(C)c1cccc(C[N@H+]2CCNC(=O)[C@H]2C)c1 ZINC000659874163 411358583 /nfs/dbraw/zinc/35/85/83/411358583.db2.gz PTZKFTZYLPYKFW-GFCCVEGCSA-N 1 2 246.354 2.130 20 0 BEADLO COCC1(C)C[NH+](Cc2n[nH]c3ccccc32)C1 ZINC000656779513 411358901 /nfs/dbraw/zinc/35/89/01/411358901.db2.gz VIGISHJDDXNADH-UHFFFAOYSA-N 1 2 245.326 2.031 20 0 BEADLO c1cc(CNc2cccc[nH+]2)n(CC2CC2)n1 ZINC000656768540 411363457 /nfs/dbraw/zinc/36/34/57/411363457.db2.gz YHOOFKKZHPGXLA-UHFFFAOYSA-N 1 2 228.299 2.300 20 0 BEADLO CC[C@H](O)C[NH2+]CC(F)(F)c1cccc(F)c1 ZINC000656705996 411334771 /nfs/dbraw/zinc/33/47/71/411334771.db2.gz XCHIZWBQKAZRBG-NSHDSACASA-N 1 2 247.260 2.278 20 0 BEADLO c1c(C[NH+]2CCSCC2)onc1C1CC1 ZINC000659842945 411335116 /nfs/dbraw/zinc/33/51/16/411335116.db2.gz IXAJXVAIFVKCBN-UHFFFAOYSA-N 1 2 224.329 2.101 20 0 BEADLO CCCCc1nc(C[N@@H+]2CC[C@H]3C[C@H]3C2)no1 ZINC000661969469 411337901 /nfs/dbraw/zinc/33/79/01/411337901.db2.gz CJMDBUHFJVPEFT-QWRGUYRKSA-N 1 2 235.331 2.254 20 0 BEADLO CCCCc1nc(C[N@H+]2CC[C@H]3C[C@H]3C2)no1 ZINC000661969469 411337903 /nfs/dbraw/zinc/33/79/03/411337903.db2.gz CJMDBUHFJVPEFT-QWRGUYRKSA-N 1 2 235.331 2.254 20 0 BEADLO CCOC1(C)C[NH+](Cc2[nH]nc3ccccc32)C1 ZINC000656736108 411340506 /nfs/dbraw/zinc/34/05/06/411340506.db2.gz GYYUGZOSDYVFRS-UHFFFAOYSA-N 1 2 245.326 2.174 20 0 BEADLO CC1(CNc2cccc[nH+]2)CCOCC1 ZINC000227825253 168049102 /nfs/dbraw/zinc/04/91/02/168049102.db2.gz MCMDQPLLBYCIDU-UHFFFAOYSA-N 1 2 206.289 2.310 20 0 BEADLO CC1(CO)C[NH+](Cc2c(F)cccc2Cl)C1 ZINC000334646874 168050822 /nfs/dbraw/zinc/05/08/22/168050822.db2.gz LVZFMBPCUKOVDM-UHFFFAOYSA-N 1 2 243.709 2.293 20 0 BEADLO CC1(Cn2c[nH+]c3cc(F)c(F)cc32)COC1 ZINC000360743778 168053095 /nfs/dbraw/zinc/05/30/95/168053095.db2.gz GBIVYXNQNZHXKR-UHFFFAOYSA-N 1 2 238.237 2.351 20 0 BEADLO CC1(NC(=O)CCc2[nH]cc[nH+]2)CCCCC1 ZINC000283105186 168054741 /nfs/dbraw/zinc/05/47/41/168054741.db2.gz RZPHDEQYQJWZIC-UHFFFAOYSA-N 1 2 235.331 2.181 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N1CCC(C)=C(C)C1 ZINC000334676103 168081555 /nfs/dbraw/zinc/08/15/55/168081555.db2.gz MGQDYRIBMZILQK-UHFFFAOYSA-N 1 2 245.326 2.386 20 0 BEADLO Cc1nnc(C[N@@H+]2CCC(C)=C(C)C2)s1 ZINC000280518015 168083982 /nfs/dbraw/zinc/08/39/82/168083982.db2.gz DQIVXIQXFFGPHS-UHFFFAOYSA-N 1 2 223.345 2.389 20 0 BEADLO Cc1nnc(C[N@H+]2CCC(C)=C(C)C2)s1 ZINC000280518015 168083984 /nfs/dbraw/zinc/08/39/84/168083984.db2.gz DQIVXIQXFFGPHS-UHFFFAOYSA-N 1 2 223.345 2.389 20 0 BEADLO CC1=CCCN(C(=O)c2ccc3[nH+]ccn3c2)C1 ZINC000281795433 168097553 /nfs/dbraw/zinc/09/75/53/168097553.db2.gz MAGDBGDXHKDFGV-UHFFFAOYSA-N 1 2 241.294 2.127 20 0 BEADLO CC1=CCC[C@@H](C)[C@@H]1C[N@H+](C)Cc1nnc[nH]1 ZINC000191074505 168102158 /nfs/dbraw/zinc/10/21/58/168102158.db2.gz VXBFXEZHMLBRDA-VXGBXAGGSA-N 1 2 234.347 2.229 20 0 BEADLO CC1=CCC[C@@H](C)[C@@H]1C[N@@H+](C)Cc1nnc[nH]1 ZINC000191074505 168102160 /nfs/dbraw/zinc/10/21/60/168102160.db2.gz VXBFXEZHMLBRDA-VXGBXAGGSA-N 1 2 234.347 2.229 20 0 BEADLO CC1=CC[N@H+](Cc2cn(C(C)(C)C)nn2)CC1 ZINC000276754019 168114367 /nfs/dbraw/zinc/11/43/67/168114367.db2.gz LOBBLWRNMUABRL-UHFFFAOYSA-N 1 2 234.347 2.185 20 0 BEADLO CC1=CC[N@@H+](Cc2cn(C(C)(C)C)nn2)CC1 ZINC000276754019 168114369 /nfs/dbraw/zinc/11/43/69/168114369.db2.gz LOBBLWRNMUABRL-UHFFFAOYSA-N 1 2 234.347 2.185 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CC=C(C)CC2)o1 ZINC000270335534 168116674 /nfs/dbraw/zinc/11/66/74/168116674.db2.gz MQYBHEYKKGRZOF-VIFPVBQESA-N 1 2 207.277 2.091 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CC=C(C)CC2)o1 ZINC000270335534 168116676 /nfs/dbraw/zinc/11/66/76/168116676.db2.gz MQYBHEYKKGRZOF-VIFPVBQESA-N 1 2 207.277 2.091 20 0 BEADLO CC1=CC[N@@H+]([C@@H](C(N)=O)c2ccc(F)cc2)CC1 ZINC000270360669 168117170 /nfs/dbraw/zinc/11/71/70/168117170.db2.gz ROWZZBIRXXVEOO-CYBMUJFWSA-N 1 2 248.301 2.004 20 0 BEADLO CC1=CC[N@H+]([C@@H](C(N)=O)c2ccc(F)cc2)CC1 ZINC000270360669 168117172 /nfs/dbraw/zinc/11/71/72/168117172.db2.gz ROWZZBIRXXVEOO-CYBMUJFWSA-N 1 2 248.301 2.004 20 0 BEADLO CC1=CC[N@@H+]([C@H](C(N)=O)c2ccc(F)cc2)CC1 ZINC000270360671 168117478 /nfs/dbraw/zinc/11/74/78/168117478.db2.gz ROWZZBIRXXVEOO-ZDUSSCGKSA-N 1 2 248.301 2.004 20 0 BEADLO CC1=CC[N@H+]([C@H](C(N)=O)c2ccc(F)cc2)CC1 ZINC000270360671 168117480 /nfs/dbraw/zinc/11/74/80/168117480.db2.gz ROWZZBIRXXVEOO-ZDUSSCGKSA-N 1 2 248.301 2.004 20 0 BEADLO Cc1[nH]ncc1C[N@@H+]1CC(C)=C[C@@H](C)C1 ZINC000336316703 168123960 /nfs/dbraw/zinc/12/39/60/168123960.db2.gz ZJNBSYDDVIXRPA-SECBINFHSA-N 1 2 205.305 2.116 20 0 BEADLO Cc1[nH]ncc1C[N@H+]1CC(C)=C[C@@H](C)C1 ZINC000336316703 168123963 /nfs/dbraw/zinc/12/39/63/168123963.db2.gz ZJNBSYDDVIXRPA-SECBINFHSA-N 1 2 205.305 2.116 20 0 BEADLO CC1=C[C@H](C)C[N@H+](Cc2nc(C3CC3)no2)C1 ZINC000334148678 168128428 /nfs/dbraw/zinc/12/84/28/168128428.db2.gz BYYMQVGSHRISQC-VIFPVBQESA-N 1 2 233.315 2.345 20 0 BEADLO CC1=C[C@H](C)C[N@@H+](Cc2nc(C3CC3)no2)C1 ZINC000334148678 168128429 /nfs/dbraw/zinc/12/84/29/168128429.db2.gz BYYMQVGSHRISQC-VIFPVBQESA-N 1 2 233.315 2.345 20 0 BEADLO Cc1[nH+]c[nH]c1CC(=O)N[C@@H](C)C1CCCCC1 ZINC000425011225 411381871 /nfs/dbraw/zinc/38/18/71/411381871.db2.gz ZOESDHDZFDLWCP-JTQLQIEISA-N 1 2 249.358 2.346 20 0 BEADLO Cc1[nH]c[nH+]c1CC(=O)N[C@@H](C)C1CCCCC1 ZINC000425011225 411381877 /nfs/dbraw/zinc/38/18/77/411381877.db2.gz ZOESDHDZFDLWCP-JTQLQIEISA-N 1 2 249.358 2.346 20 0 BEADLO CC1CCC(=CC(=O)NCc2[nH]cc[nH+]2)CC1 ZINC000114690453 168149314 /nfs/dbraw/zinc/14/93/14/168149314.db2.gz YOJCACGNIZKSAI-UHFFFAOYSA-N 1 2 233.315 2.162 20 0 BEADLO CC1CCC(CC(=O)NCc2[nH+]ccn2C)CC1 ZINC000359947151 168152429 /nfs/dbraw/zinc/15/24/29/168152429.db2.gz OPNPYVLBJXQXIM-UHFFFAOYSA-N 1 2 249.358 2.253 20 0 BEADLO CC1CCC(NC(=O)CCc2c[nH+]cn2C)CC1 ZINC000339167118 168161158 /nfs/dbraw/zinc/16/11/58/168161158.db2.gz BFEQZNLPJQKBCF-UHFFFAOYSA-N 1 2 249.358 2.048 20 0 BEADLO CCC(=O)CC[N@@H+]1CCC=C(Br)C1 ZINC000281717858 168202737 /nfs/dbraw/zinc/20/27/37/168202737.db2.gz VBTDMGFKMRWUGD-UHFFFAOYSA-N 1 2 246.148 2.340 20 0 BEADLO CCC(=O)CC[N@H+]1CCC=C(Br)C1 ZINC000281717858 168202741 /nfs/dbraw/zinc/20/27/41/168202741.db2.gz VBTDMGFKMRWUGD-UHFFFAOYSA-N 1 2 246.148 2.340 20 0 BEADLO CCC(=O)CC[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC000276931821 168203624 /nfs/dbraw/zinc/20/36/24/168203624.db2.gz TULKAKDPRQTAMQ-HNNXBMFYSA-N 1 2 247.338 2.429 20 0 BEADLO CCC(=O)CC[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC000276931821 168203626 /nfs/dbraw/zinc/20/36/26/168203626.db2.gz TULKAKDPRQTAMQ-HNNXBMFYSA-N 1 2 247.338 2.429 20 0 BEADLO CCC(=O)[C@@H](C)Sc1nc(N)cc(CC)[nH+]1 ZINC000279043380 168251969 /nfs/dbraw/zinc/25/19/69/168251969.db2.gz GEJDQSMUKHMFSY-SSDOTTSWSA-N 1 2 239.344 2.081 20 0 BEADLO CCC(C)(C)N(C)C(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000657028608 411395028 /nfs/dbraw/zinc/39/50/28/411395028.db2.gz XUVUKKXVBHHWNX-UHFFFAOYSA-N 1 2 238.335 2.082 20 0 BEADLO CCC(C)(C)N(C)C(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000657028608 411395032 /nfs/dbraw/zinc/39/50/32/411395032.db2.gz XUVUKKXVBHHWNX-UHFFFAOYSA-N 1 2 238.335 2.082 20 0 BEADLO Nc1ccc(NC(=O)[C@H]2C[C@@H]2C2CCCC2)c[nH+]1 ZINC000653048572 411403951 /nfs/dbraw/zinc/40/39/51/411403951.db2.gz JMFZDCPAGSIZNW-NEPJUHHUSA-N 1 2 245.326 2.259 20 0 BEADLO CSc1cccc(C[NH+]2CCOCC2)c1 ZINC000659814360 411461711 /nfs/dbraw/zinc/46/17/11/411461711.db2.gz QFJFELOWDSMISE-UHFFFAOYSA-N 1 2 223.341 2.241 20 0 BEADLO Cc1cc(N)nc(SCC2CC=CC2)[nH+]1 ZINC000657237719 411423736 /nfs/dbraw/zinc/42/37/36/411423736.db2.gz VMODKPKOGYWVHC-UHFFFAOYSA-N 1 2 221.329 2.426 20 0 BEADLO Cc1[nH]c(CNCc2cccc(C)n2)[nH+]c1C ZINC000657317653 411462977 /nfs/dbraw/zinc/46/29/77/411462977.db2.gz DUWSSQRCMIJUOI-UHFFFAOYSA-N 1 2 230.315 2.020 20 0 BEADLO Cc1nc(C[NH2+]Cc2cccc(C)n2)[nH]c1C ZINC000657317653 411462980 /nfs/dbraw/zinc/46/29/80/411462980.db2.gz DUWSSQRCMIJUOI-UHFFFAOYSA-N 1 2 230.315 2.020 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1nc(C)oc1C ZINC000659841328 411472008 /nfs/dbraw/zinc/47/20/08/411472008.db2.gz QIDTYIJOUHQPDR-JOYOIKCWSA-N 1 2 238.331 2.291 20 0 BEADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1nc(C)oc1C ZINC000659841328 411472010 /nfs/dbraw/zinc/47/20/10/411472010.db2.gz QIDTYIJOUHQPDR-JOYOIKCWSA-N 1 2 238.331 2.291 20 0 BEADLO C[C@@H](CCC1CC1)NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000655003740 411474624 /nfs/dbraw/zinc/47/46/24/411474624.db2.gz UHYPGICMXAQHMB-QWRGUYRKSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H](CCC1CC1)NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000655003740 411474626 /nfs/dbraw/zinc/47/46/26/411474626.db2.gz UHYPGICMXAQHMB-QWRGUYRKSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](CCC1CC1)NC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000655003738 411474691 /nfs/dbraw/zinc/47/46/91/411474691.db2.gz UHYPGICMXAQHMB-GHMZBOCLSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](CCC1CC1)NC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000655003738 411474695 /nfs/dbraw/zinc/47/46/95/411474695.db2.gz UHYPGICMXAQHMB-GHMZBOCLSA-N 1 2 249.358 2.283 20 0 BEADLO Cc1c[nH]c(C[NH2+]Cc2cc(F)ccc2F)n1 ZINC000657350190 411475841 /nfs/dbraw/zinc/47/58/41/411475841.db2.gz PXLHHRNDNGODDW-UHFFFAOYSA-N 1 2 237.253 2.286 20 0 BEADLO Clc1ccc(C[N@H+](C2CC2)C2COC2)cn1 ZINC000295995969 411479711 /nfs/dbraw/zinc/47/97/11/411479711.db2.gz KPNKEHAJTXHVHY-UHFFFAOYSA-N 1 2 238.718 2.098 20 0 BEADLO Clc1ccc(C[N@@H+](C2CC2)C2COC2)cn1 ZINC000295995969 411479714 /nfs/dbraw/zinc/47/97/14/411479714.db2.gz KPNKEHAJTXHVHY-UHFFFAOYSA-N 1 2 238.718 2.098 20 0 BEADLO CCOc1ccccc1C[NH+]1CC(OCC)C1 ZINC000297479693 411482566 /nfs/dbraw/zinc/48/25/66/411482566.db2.gz SCYLDEYRGDSFAN-UHFFFAOYSA-N 1 2 235.327 2.306 20 0 BEADLO COc1cc(C[NH+]2Cc3ccccc3C2)on1 ZINC000659903631 411492160 /nfs/dbraw/zinc/49/21/60/411492160.db2.gz IKJZGTMBIXJCKN-UHFFFAOYSA-N 1 2 230.267 2.199 20 0 BEADLO Cc1nc(C[N@H+]2CCOC[C@H]2CC(C)C)co1 ZINC000659927677 411500736 /nfs/dbraw/zinc/50/07/36/411500736.db2.gz HBBRWVMHIBJDDU-CYBMUJFWSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1nc(C[N@@H+]2CCOC[C@H]2CC(C)C)co1 ZINC000659927677 411500738 /nfs/dbraw/zinc/50/07/38/411500738.db2.gz HBBRWVMHIBJDDU-CYBMUJFWSA-N 1 2 238.331 2.230 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC1(C2(C)CC2)CC1 ZINC000655138184 411502525 /nfs/dbraw/zinc/50/25/25/411502525.db2.gz WUWWHWIDIQVZNZ-SNVBAGLBSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC1(C2(C)CC2)CC1 ZINC000655138184 411502527 /nfs/dbraw/zinc/50/25/27/411502527.db2.gz WUWWHWIDIQVZNZ-SNVBAGLBSA-N 1 2 247.342 2.037 20 0 BEADLO CC[C@H]1COCC[N@@H+]1Cc1cc(C2CC2)no1 ZINC000659935193 411503366 /nfs/dbraw/zinc/50/33/66/411503366.db2.gz WQPLHLWNVAPSHF-NSHDSACASA-N 1 2 236.315 2.163 20 0 BEADLO CC[C@H]1COCC[N@H+]1Cc1cc(C2CC2)no1 ZINC000659935193 411503369 /nfs/dbraw/zinc/50/33/69/411503369.db2.gz WQPLHLWNVAPSHF-NSHDSACASA-N 1 2 236.315 2.163 20 0 BEADLO COc1cc(C[N@H+](C)Cc2cccc(C)n2)on1 ZINC000660079827 411534813 /nfs/dbraw/zinc/53/48/13/411534813.db2.gz BGCUDWJHFUAOHK-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2cccc(C)n2)on1 ZINC000660079827 411534815 /nfs/dbraw/zinc/53/48/15/411534815.db2.gz BGCUDWJHFUAOHK-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1cc(C[N@H+](C)Cc2ccc[nH]2)sn1 ZINC000659981708 411518171 /nfs/dbraw/zinc/51/81/71/411518171.db2.gz UPERTTLBZXHPAU-UHFFFAOYSA-N 1 2 237.328 2.112 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2ccc[nH]2)sn1 ZINC000659981708 411518174 /nfs/dbraw/zinc/51/81/74/411518174.db2.gz UPERTTLBZXHPAU-UHFFFAOYSA-N 1 2 237.328 2.112 20 0 BEADLO CC(C)c1cccc(C[N@@H+]2CCO[C@@H](CO)C2)c1 ZINC000659999408 411524998 /nfs/dbraw/zinc/52/49/98/411524998.db2.gz QFEZSECSQANBHN-OAHLLOKOSA-N 1 2 249.354 2.003 20 0 BEADLO CC(C)c1cccc(C[N@H+]2CCO[C@@H](CO)C2)c1 ZINC000659999408 411525000 /nfs/dbraw/zinc/52/50/00/411525000.db2.gz QFEZSECSQANBHN-OAHLLOKOSA-N 1 2 249.354 2.003 20 0 BEADLO COc1c(C)cccc1C[NH2+]Cc1ncc[nH]1 ZINC000655831692 411528793 /nfs/dbraw/zinc/52/87/93/411528793.db2.gz LWYILGPOOPUHKA-UHFFFAOYSA-N 1 2 231.299 2.017 20 0 BEADLO CC[N@@H+]1CCSC[C@@H]1c1nccs1 ZINC000187043827 170006449 /nfs/dbraw/zinc/00/64/49/170006449.db2.gz TZJQGUKLFGBRFF-MRVPVSSYSA-N 1 2 214.359 2.253 20 0 BEADLO CC[N@H+]1CCSC[C@@H]1c1nccs1 ZINC000187043827 170006451 /nfs/dbraw/zinc/00/64/51/170006451.db2.gz TZJQGUKLFGBRFF-MRVPVSSYSA-N 1 2 214.359 2.253 20 0 BEADLO Cc1cnc(C)c(NCc2c[nH+]c3n2CCC3)c1 ZINC000657500726 411538629 /nfs/dbraw/zinc/53/86/29/411538629.db2.gz LRRYOKPXOWUBCY-UHFFFAOYSA-N 1 2 242.326 2.453 20 0 BEADLO COc1cc(C[N@H+](C)Cc2cccnc2)sn1 ZINC000660126693 411541615 /nfs/dbraw/zinc/54/16/15/411541615.db2.gz TWNPGTHNDKSXJL-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2cccnc2)sn1 ZINC000660126693 411541617 /nfs/dbraw/zinc/54/16/17/411541617.db2.gz TWNPGTHNDKSXJL-UHFFFAOYSA-N 1 2 249.339 2.179 20 0 BEADLO COc1cc(C[N@H+](C)[C@H](C)c2ccccn2)on1 ZINC000660139700 411543998 /nfs/dbraw/zinc/54/39/98/411543998.db2.gz DJJAWBRMTMBADH-SNVBAGLBSA-N 1 2 247.298 2.271 20 0 BEADLO COc1cc(C[N@@H+](C)[C@H](C)c2ccccn2)on1 ZINC000660139700 411544000 /nfs/dbraw/zinc/54/40/00/411544000.db2.gz DJJAWBRMTMBADH-SNVBAGLBSA-N 1 2 247.298 2.271 20 0 BEADLO CC[C@H](CC(F)F)C[N@H+](C)Cc1noc(C)n1 ZINC000660217425 411553984 /nfs/dbraw/zinc/55/39/84/411553984.db2.gz VZNAOLHJVQXJCJ-SECBINFHSA-N 1 2 247.289 2.491 20 0 BEADLO CC[C@H](CC(F)F)C[N@@H+](C)Cc1noc(C)n1 ZINC000660217425 411553985 /nfs/dbraw/zinc/55/39/85/411553985.db2.gz VZNAOLHJVQXJCJ-SECBINFHSA-N 1 2 247.289 2.491 20 0 BEADLO c1[nH+]cc(N[C@H]2CCOC2)c2c1CCCC2 ZINC000657532489 411545070 /nfs/dbraw/zinc/54/50/70/411545070.db2.gz AIZMERORNQITMZ-NSHDSACASA-N 1 2 218.300 2.161 20 0 BEADLO CCc1nnc([C@@H](C)[N@@H+]2CC[C@@H](C(F)F)C2)[nH]1 ZINC000660146272 411545510 /nfs/dbraw/zinc/54/55/10/411545510.db2.gz FPXHEKQVMPSPDT-HTQZYQBOSA-N 1 2 244.289 2.015 20 0 BEADLO CCc1nnc([C@@H](C)[N@H+]2CC[C@@H](C(F)F)C2)[nH]1 ZINC000660146272 411545511 /nfs/dbraw/zinc/54/55/11/411545511.db2.gz FPXHEKQVMPSPDT-HTQZYQBOSA-N 1 2 244.289 2.015 20 0 BEADLO c1c(C[N@@H+]2CCOC[C@@H]2C2CC2)onc1C1CC1 ZINC000660152095 411547042 /nfs/dbraw/zinc/54/70/42/411547042.db2.gz ZHZPMDICHOMOID-CQSZACIVSA-N 1 2 248.326 2.163 20 0 BEADLO c1c(C[N@H+]2CCOC[C@@H]2C2CC2)onc1C1CC1 ZINC000660152095 411547044 /nfs/dbraw/zinc/54/70/44/411547044.db2.gz ZHZPMDICHOMOID-CQSZACIVSA-N 1 2 248.326 2.163 20 0 BEADLO CCOC(=O)C(C)(C)[NH2+]CCSC(C)C ZINC000309053239 170187327 /nfs/dbraw/zinc/18/73/27/170187327.db2.gz SDXQRGUNDSEKRX-UHFFFAOYSA-N 1 2 233.377 2.059 20 0 BEADLO CCOC(=O)C(C)(C)[NH2+]Cc1ccc(C)cc1 ZINC000258980928 170187590 /nfs/dbraw/zinc/18/75/90/170187590.db2.gz OMBUUDDLPHEXOK-UHFFFAOYSA-N 1 2 235.327 2.426 20 0 BEADLO CCOC(=O)C[N@@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000081579112 170221113 /nfs/dbraw/zinc/22/11/13/170221113.db2.gz JBRBGILTPHFWDM-BXUZGUMPSA-N 1 2 233.311 2.243 20 0 BEADLO CCOC(=O)C[N@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000081579112 170221114 /nfs/dbraw/zinc/22/11/14/170221114.db2.gz JBRBGILTPHFWDM-BXUZGUMPSA-N 1 2 233.311 2.243 20 0 BEADLO CCOC(=O)C[NH2+][C@@H](CC(F)(F)F)C(C)C ZINC000336779962 170226405 /nfs/dbraw/zinc/22/64/05/170226405.db2.gz PXXXGYOAIUIXKX-QMMMGPOBSA-N 1 2 241.253 2.116 20 0 BEADLO CCOC(=O)C[NH2+][C@H]1CC[C@@H](c2ccccc2)C1 ZINC000370525635 170227224 /nfs/dbraw/zinc/22/72/24/170227224.db2.gz GMVKPNPPEOQCCP-KGLIPLIRSA-N 1 2 247.338 2.475 20 0 BEADLO Cc1nc(C[NH2+][C@@H](CO)c2ccccc2C)co1 ZINC000660239451 411557605 /nfs/dbraw/zinc/55/76/05/411557605.db2.gz RGYPYRSTKVUQAK-AWEZNQCLSA-N 1 2 246.310 2.115 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[N@@H+]1CC[C@](C)(F)C1 ZINC000360206571 170249454 /nfs/dbraw/zinc/24/94/54/170249454.db2.gz BERISQMKOXHONE-YPMHNXCESA-N 1 2 245.338 2.398 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[N@H+]1CC[C@](C)(F)C1 ZINC000360206571 170249456 /nfs/dbraw/zinc/24/94/56/170249456.db2.gz BERISQMKOXHONE-YPMHNXCESA-N 1 2 245.338 2.398 20 0 BEADLO CCn1cncc1C[NH2+][C@@H](C)c1cscn1 ZINC000657601067 411558705 /nfs/dbraw/zinc/55/87/05/411558705.db2.gz XQECCUMKEAHTHM-VIFPVBQESA-N 1 2 236.344 2.210 20 0 BEADLO CCOC(=O)[C@H](C)[N@H+](C)Cc1cccc(F)c1 ZINC000043638512 170265331 /nfs/dbraw/zinc/26/53/31/170265331.db2.gz WLKIILCGKHJHES-JTQLQIEISA-N 1 2 239.290 2.209 20 0 BEADLO CCOC(=O)[C@H](C)[N@@H+](C)Cc1cccc(F)c1 ZINC000043638512 170265332 /nfs/dbraw/zinc/26/53/32/170265332.db2.gz WLKIILCGKHJHES-JTQLQIEISA-N 1 2 239.290 2.209 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+]C[C@@H](C)c1ccccc1 ZINC000049370160 170267400 /nfs/dbraw/zinc/26/74/00/170267400.db2.gz RZZQPQXCTVDMBT-NEPJUHHUSA-N 1 2 235.327 2.331 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@H]1CCc2ccccc2C1 ZINC000049371574 170268118 /nfs/dbraw/zinc/26/81/18/170268118.db2.gz JFCMNFRBDVBLKX-FZMZJTMJSA-N 1 2 247.338 2.085 20 0 BEADLO CCOC(=O)[C@H](C)[NH2+][C@@H](CC)CC(F)(F)F ZINC000309978336 170268359 /nfs/dbraw/zinc/26/83/59/170268359.db2.gz UZKXPYMSIKSSNM-YUMQZZPRSA-N 1 2 241.253 2.259 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[N@@H+]1CC[C@](C)(F)C1 ZINC000360206568 170270785 /nfs/dbraw/zinc/27/07/85/170270785.db2.gz BERISQMKOXHONE-AAEUAGOBSA-N 1 2 245.338 2.398 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[N@H+]1CC[C@](C)(F)C1 ZINC000360206568 170270787 /nfs/dbraw/zinc/27/07/87/170270787.db2.gz BERISQMKOXHONE-AAEUAGOBSA-N 1 2 245.338 2.398 20 0 BEADLO CCOC(=O)[C@H](CC(C)C)[NH2+][C@@H]1CCSC1 ZINC000336776660 170270923 /nfs/dbraw/zinc/27/09/23/170270923.db2.gz GGGQDQHFYFLDMR-MNOVXSKESA-N 1 2 245.388 2.059 20 0 BEADLO CCOC(=O)[C@H]1CCC[N@@H+]1Cc1ccc(C)o1 ZINC000050064519 170280496 /nfs/dbraw/zinc/28/04/96/170280496.db2.gz ZLUFEQRZTDWLCG-GFCCVEGCSA-N 1 2 237.299 2.116 20 0 BEADLO CCOC(=O)[C@H]1CCC[N@H+]1Cc1ccc(C)o1 ZINC000050064519 170280497 /nfs/dbraw/zinc/28/04/97/170280497.db2.gz ZLUFEQRZTDWLCG-GFCCVEGCSA-N 1 2 237.299 2.116 20 0 BEADLO CCOC1C[NH+](Cc2cc(C)ccc2F)C1 ZINC000297497874 170336997 /nfs/dbraw/zinc/33/69/97/170336997.db2.gz UTKDIZNLPSGFRV-UHFFFAOYSA-N 1 2 223.291 2.355 20 0 BEADLO CCOC1C[NH+](Cc2ccc3ncccc3c2)C1 ZINC000297549147 170337302 /nfs/dbraw/zinc/33/73/02/170337302.db2.gz ZJAAPRBIONZWHS-UHFFFAOYSA-N 1 2 242.322 2.456 20 0 BEADLO CCOCC1(C(=O)Nc2cc[nH+]cc2CC)CC1 ZINC000281612051 170356519 /nfs/dbraw/zinc/35/65/19/170356519.db2.gz GUEXBDWBKKKQIM-UHFFFAOYSA-N 1 2 248.326 2.399 20 0 BEADLO CCOCCC(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000264007557 170362721 /nfs/dbraw/zinc/36/27/21/170362721.db2.gz VUIOJLMIAKYGIY-UHFFFAOYSA-N 1 2 247.298 2.008 20 0 BEADLO CCOCCCC(=O)Nc1cc[nH+]cc1C ZINC000107292766 170366366 /nfs/dbraw/zinc/36/63/66/170366366.db2.gz NGZXVXFIXIFCHA-UHFFFAOYSA-N 1 2 222.288 2.145 20 0 BEADLO c1cc(C[NH2+][C@@H]2C[C@@H](Oc3ccccc3)C2)[nH]n1 ZINC000657645678 411568802 /nfs/dbraw/zinc/56/88/02/411568802.db2.gz DYTAUZROKWMEJG-MQMHXKEQSA-N 1 2 243.310 2.109 20 0 BEADLO CCOCC[N@H+](C)Cc1csc(Cl)n1 ZINC000295899635 170391293 /nfs/dbraw/zinc/39/12/93/170391293.db2.gz CKBLTRGCFBVBKZ-UHFFFAOYSA-N 1 2 234.752 2.265 20 0 BEADLO CCOCC[N@@H+](C)Cc1csc(Cl)n1 ZINC000295899635 170391295 /nfs/dbraw/zinc/39/12/95/170391295.db2.gz CKBLTRGCFBVBKZ-UHFFFAOYSA-N 1 2 234.752 2.265 20 0 BEADLO CCOCCN(C)c1cc[nH+]c2ccncc21 ZINC000271416764 170391951 /nfs/dbraw/zinc/39/19/51/170391951.db2.gz KZMMQLMTUHDQNH-UHFFFAOYSA-N 1 2 231.299 2.103 20 0 BEADLO C[C@H]1CN(c2[nH+]ccc3c(N)cccc32)CCO1 ZINC000663363464 411637170 /nfs/dbraw/zinc/63/71/70/411637170.db2.gz COAFCRXMEOEZBA-JTQLQIEISA-N 1 2 243.310 2.042 20 0 BEADLO O[C@@H]1C[N@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC(F)(F)C1 ZINC000660391398 411578268 /nfs/dbraw/zinc/57/82/68/411578268.db2.gz HVIVIUSYYIETLF-KXNHARMFSA-N 1 2 245.313 2.125 20 0 BEADLO O[C@@H]1C[N@@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)CC(F)(F)C1 ZINC000660391398 411578269 /nfs/dbraw/zinc/57/82/69/411578269.db2.gz HVIVIUSYYIETLF-KXNHARMFSA-N 1 2 245.313 2.125 20 0 BEADLO CCn1ccc(C[N@H+](C)Cc2cc(OC)no2)c1 ZINC000660395476 411578994 /nfs/dbraw/zinc/57/89/94/411578994.db2.gz DWAJOAHQRKYUID-UHFFFAOYSA-N 1 2 249.314 2.137 20 0 BEADLO CCn1ccc(C[N@@H+](C)Cc2cc(OC)no2)c1 ZINC000660395476 411578995 /nfs/dbraw/zinc/57/89/95/411578995.db2.gz DWAJOAHQRKYUID-UHFFFAOYSA-N 1 2 249.314 2.137 20 0 BEADLO Cc1c[nH]c(CNc2ccc3c(c2)CCOC3)[nH+]1 ZINC000657680843 411580500 /nfs/dbraw/zinc/58/05/00/411580500.db2.gz MAMQKOZCDMJLHS-UHFFFAOYSA-N 1 2 243.310 2.403 20 0 BEADLO CCc1ccc(C[NH2+][C@H](C)c2nccn2C)o1 ZINC000657794072 411599147 /nfs/dbraw/zinc/59/91/47/411599147.db2.gz NUAVCYRCUHUQCV-SNVBAGLBSA-N 1 2 233.315 2.426 20 0 BEADLO CC(C)C[N@H+](C)[C@H](c1nnc[nH]1)c1ccccc1 ZINC000660761121 411621950 /nfs/dbraw/zinc/62/19/50/411621950.db2.gz OGZFUTMZRNTHIW-ZDUSSCGKSA-N 1 2 244.342 2.482 20 0 BEADLO CC(C)C[N@@H+](C)[C@H](c1nnc[nH]1)c1ccccc1 ZINC000660761121 411621952 /nfs/dbraw/zinc/62/19/52/411621952.db2.gz OGZFUTMZRNTHIW-ZDUSSCGKSA-N 1 2 244.342 2.482 20 0 BEADLO CC(C)C[N@H+](C)[C@H](c1nc[nH]n1)c1ccccc1 ZINC000660761121 411621953 /nfs/dbraw/zinc/62/19/53/411621953.db2.gz OGZFUTMZRNTHIW-ZDUSSCGKSA-N 1 2 244.342 2.482 20 0 BEADLO CC(C)C[N@@H+](C)[C@H](c1nc[nH]n1)c1ccccc1 ZINC000660761121 411621954 /nfs/dbraw/zinc/62/19/54/411621954.db2.gz OGZFUTMZRNTHIW-ZDUSSCGKSA-N 1 2 244.342 2.482 20 0 BEADLO CN(CC(C)(C)O)c1[nH+]ccc2c(N)cccc21 ZINC000663611862 411709801 /nfs/dbraw/zinc/70/98/01/411709801.db2.gz SCAWOWWXADJVHD-UHFFFAOYSA-N 1 2 245.326 2.024 20 0 BEADLO CC[C@H](C)[N@H+](CC)Cc1nsc(N(C)C)n1 ZINC000661107442 411711818 /nfs/dbraw/zinc/71/18/18/411711818.db2.gz MADBQVZYMHOVEI-VIFPVBQESA-N 1 2 242.392 2.225 20 0 BEADLO CC[C@H](C)[N@@H+](CC)Cc1nsc(N(C)C)n1 ZINC000661107442 411711819 /nfs/dbraw/zinc/71/18/19/411711819.db2.gz MADBQVZYMHOVEI-VIFPVBQESA-N 1 2 242.392 2.225 20 0 BEADLO CCCC(=O)NCCc1cn2c(cccc2C)[nH+]1 ZINC000071490782 411717541 /nfs/dbraw/zinc/71/75/41/411717541.db2.gz BAFXEMCQEYJJJJ-UHFFFAOYSA-N 1 2 245.326 2.102 20 0 BEADLO Cc1nnc(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)s1 ZINC000660933314 411685058 /nfs/dbraw/zinc/68/50/58/411685058.db2.gz OROYVHSEFAJURU-UWVGGRQHSA-N 1 2 223.345 2.221 20 0 BEADLO Cc1nnc(C[N@H+]2C[C@@H]3CCCC[C@@H]32)s1 ZINC000660933314 411685061 /nfs/dbraw/zinc/68/50/61/411685061.db2.gz OROYVHSEFAJURU-UWVGGRQHSA-N 1 2 223.345 2.221 20 0 BEADLO O=C(Nc1ccn2cc[nH+]c2c1)[C@@H]1CC12CCC2 ZINC000660955424 411687084 /nfs/dbraw/zinc/68/70/84/411687084.db2.gz VQLCLZRNQLTEQK-NSHDSACASA-N 1 2 241.294 2.463 20 0 BEADLO CN(Cc1csc(C2CC2)n1)Cc1c[nH+]c[nH]1 ZINC000661089268 411700424 /nfs/dbraw/zinc/70/04/24/411700424.db2.gz ZWRHZNQDEOGGJD-UHFFFAOYSA-N 1 2 248.355 2.376 20 0 BEADLO CN(Cc1csc(C2CC2)n1)Cc1c[nH]c[nH+]1 ZINC000661089268 411700429 /nfs/dbraw/zinc/70/04/29/411700429.db2.gz ZWRHZNQDEOGGJD-UHFFFAOYSA-N 1 2 248.355 2.376 20 0 BEADLO COc1cc(C[N@H+](C)Cc2cnc[nH]2)ccc1C ZINC000661091268 411702684 /nfs/dbraw/zinc/70/26/84/411702684.db2.gz XWKDHVCAQDSQQH-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2cnc[nH]2)ccc1C ZINC000661091268 411702686 /nfs/dbraw/zinc/70/26/86/411702686.db2.gz XWKDHVCAQDSQQH-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1cc(C[N@H+](C)Cc2c[nH]cn2)ccc1C ZINC000661091268 411702689 /nfs/dbraw/zinc/70/26/89/411702689.db2.gz XWKDHVCAQDSQQH-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO COc1cc(C[N@@H+](C)Cc2c[nH]cn2)ccc1C ZINC000661091268 411702692 /nfs/dbraw/zinc/70/26/92/411702692.db2.gz XWKDHVCAQDSQQH-UHFFFAOYSA-N 1 2 245.326 2.359 20 0 BEADLO Cc1cn2ccc(C(=O)N3CCCCC3)cc2[nH+]1 ZINC000071552024 411746079 /nfs/dbraw/zinc/74/60/79/411746079.db2.gz UEXYWPZVFRHNPD-UHFFFAOYSA-N 1 2 243.310 2.269 20 0 BEADLO CCN(CC)C(=O)c1ccn2cc(C)[nH+]c2c1 ZINC000071552005 411746158 /nfs/dbraw/zinc/74/61/58/411746158.db2.gz QJLAIYOUSHSKFM-UHFFFAOYSA-N 1 2 231.299 2.125 20 0 BEADLO Cc1ccc2c(c1)C[N@@H+](Cc1cc[nH]n1)CC2 ZINC000661372306 411756327 /nfs/dbraw/zinc/75/63/27/411756327.db2.gz KLUHDMUSBMDFEA-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO Cc1ccc2c(c1)C[N@H+](Cc1cc[nH]n1)CC2 ZINC000661372306 411756330 /nfs/dbraw/zinc/75/63/30/411756330.db2.gz KLUHDMUSBMDFEA-UHFFFAOYSA-N 1 2 227.311 2.276 20 0 BEADLO CC(C)C[C@H](C)[N@@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000661411778 411770654 /nfs/dbraw/zinc/77/06/54/411770654.db2.gz AQEYFLDBTRYJGF-VHSXEESVSA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)C[C@H](C)[N@H+]1CC[C@@H](O)C(F)(F)C1 ZINC000661411778 411770658 /nfs/dbraw/zinc/77/06/58/411770658.db2.gz AQEYFLDBTRYJGF-VHSXEESVSA-N 1 2 221.291 2.123 20 0 BEADLO CC(C)=CCC[N@@H+]1CC[C@H](O)C(F)(F)C1 ZINC000661413070 411771115 /nfs/dbraw/zinc/77/11/15/411771115.db2.gz LJUOJHMFGFXTEI-JTQLQIEISA-N 1 2 219.275 2.045 20 0 BEADLO CC(C)=CCC[N@H+]1CC[C@H](O)C(F)(F)C1 ZINC000661413070 411771118 /nfs/dbraw/zinc/77/11/18/411771118.db2.gz LJUOJHMFGFXTEI-JTQLQIEISA-N 1 2 219.275 2.045 20 0 BEADLO C[C@@H]1CN(c2cc[nH+]c(C3CC3)n2)[C@H]1C ZINC000663946692 411786066 /nfs/dbraw/zinc/78/60/66/411786066.db2.gz LNKQVORRGQQBQR-BDAKNGLRSA-N 1 2 203.289 2.199 20 0 BEADLO CN(c1cccc[nH+]1)[C@@H](CO)Cc1ccccc1 ZINC000664131646 411864479 /nfs/dbraw/zinc/86/44/79/411864479.db2.gz SHKGPNDGYYKHMG-CQSZACIVSA-N 1 2 242.322 2.121 20 0 BEADLO Fc1ccc([C@@H]2CC[N@@H+]2Cc2cc[nH]n2)cc1 ZINC000661514867 411794741 /nfs/dbraw/zinc/79/47/41/411794741.db2.gz SIIVHZPAABGALN-ZDUSSCGKSA-N 1 2 231.274 2.496 20 0 BEADLO Fc1ccc([C@@H]2CC[N@H+]2Cc2cc[nH]n2)cc1 ZINC000661514867 411794744 /nfs/dbraw/zinc/79/47/44/411794744.db2.gz SIIVHZPAABGALN-ZDUSSCGKSA-N 1 2 231.274 2.496 20 0 BEADLO Cc1ccc(N[C@H]2C[C@@H](C)n3cc[nH+]c32)nn1 ZINC000663973248 411796731 /nfs/dbraw/zinc/79/67/31/411796731.db2.gz DRYNQBFPTIAVCU-ZJUUUORDSA-N 1 2 229.287 2.099 20 0 BEADLO C[C@@H](c1ccncc1)[NH+]1C[C@@H](C)C(=O)[C@H](C)C1 ZINC000661551196 411801484 /nfs/dbraw/zinc/80/14/84/411801484.db2.gz OYAFOVYSVRGUFS-UTUOFQBUSA-N 1 2 232.327 2.300 20 0 BEADLO CO[C@H](COCc1[nH]cc[nH+]1)C1CCCC1 ZINC000664032014 411820527 /nfs/dbraw/zinc/82/05/27/411820527.db2.gz DPKKDTDVVMQWHD-LLVKDONJSA-N 1 2 224.304 2.132 20 0 BEADLO Cc1nc(C[N@@H+](C)CC2=CCCOC2)c(C)o1 ZINC000661652109 411829328 /nfs/dbraw/zinc/82/93/28/411829328.db2.gz JSSGGONWFRFULY-UHFFFAOYSA-N 1 2 236.315 2.070 20 0 BEADLO Cc1nc(C[N@H+](C)CC2=CCCOC2)c(C)o1 ZINC000661652109 411829333 /nfs/dbraw/zinc/82/93/33/411829333.db2.gz JSSGGONWFRFULY-UHFFFAOYSA-N 1 2 236.315 2.070 20 0 BEADLO Cc1[nH+]c2cc(OC[C@H]3CCOC3)ccc2n1C ZINC000664053184 411831452 /nfs/dbraw/zinc/83/14/52/411831452.db2.gz KIYGLDZWFFRRSG-NSHDSACASA-N 1 2 246.310 2.297 20 0 BEADLO CCC1(CC)CCC[N@H+](CCc2cnn[nH]2)C1 ZINC000661671339 411832175 /nfs/dbraw/zinc/83/21/75/411832175.db2.gz AWEUDKVJLDRHCL-UHFFFAOYSA-N 1 2 236.363 2.249 20 0 BEADLO CCC1(CC)CCC[N@@H+](CCc2cnn[nH]2)C1 ZINC000661671339 411832179 /nfs/dbraw/zinc/83/21/79/411832179.db2.gz AWEUDKVJLDRHCL-UHFFFAOYSA-N 1 2 236.363 2.249 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@H](CCF)C2)no1 ZINC000661693595 411843723 /nfs/dbraw/zinc/84/37/23/411843723.db2.gz PVVVYHYICXDWGN-SNVBAGLBSA-N 1 2 241.310 2.204 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@H](CCF)C2)no1 ZINC000661693595 411843728 /nfs/dbraw/zinc/84/37/28/411843728.db2.gz PVVVYHYICXDWGN-SNVBAGLBSA-N 1 2 241.310 2.204 20 0 BEADLO CC(C)c1ncn(Cc2[nH+]ccn2C(F)F)n1 ZINC000664106246 411856572 /nfs/dbraw/zinc/85/65/72/411856572.db2.gz FLAVYDYEKAGDIF-UHFFFAOYSA-N 1 2 241.245 2.041 20 0 BEADLO Cc1ccc(Cn2cnc(C(C)C)n2)c(C)[nH+]1 ZINC000664106488 411856819 /nfs/dbraw/zinc/85/68/19/411856819.db2.gz GRWDNOUOCHQEQC-UHFFFAOYSA-N 1 2 230.315 2.462 20 0 BEADLO Cc1cc(C[NH+]2CCC3(CCCC3=O)CC2)no1 ZINC000661953844 411918811 /nfs/dbraw/zinc/91/88/11/411918811.db2.gz RLEXHTGOXSSXDX-UHFFFAOYSA-N 1 2 248.326 2.318 20 0 BEADLO CN(c1ccccc1)[C@H]1CC[N@H+](CC(F)F)C1 ZINC000662023245 411943184 /nfs/dbraw/zinc/94/31/84/411943184.db2.gz XXHOIXMLSCCIOA-LBPRGKRZSA-N 1 2 240.297 2.462 20 0 BEADLO CN(c1ccccc1)[C@H]1CC[N@@H+](CC(F)F)C1 ZINC000662023245 411943186 /nfs/dbraw/zinc/94/31/86/411943186.db2.gz XXHOIXMLSCCIOA-LBPRGKRZSA-N 1 2 240.297 2.462 20 0 BEADLO C[C@@H]1COC2(CCCC2)C[N@@H+]1Cc1ccon1 ZINC000661978805 411933764 /nfs/dbraw/zinc/93/37/64/411933764.db2.gz PNQABCDYDWDXIM-LLVKDONJSA-N 1 2 236.315 2.208 20 0 BEADLO C[C@@H]1COC2(CCCC2)C[N@H+]1Cc1ccon1 ZINC000661978805 411933766 /nfs/dbraw/zinc/93/37/66/411933766.db2.gz PNQABCDYDWDXIM-LLVKDONJSA-N 1 2 236.315 2.208 20 0 BEADLO Cc1nc(NCCc2ccoc2)cc[nH+]1 ZINC000664381119 411935565 /nfs/dbraw/zinc/93/55/65/411935565.db2.gz OAWDSKFJSOLVJS-UHFFFAOYSA-N 1 2 203.245 2.033 20 0 BEADLO c1nc(N2CC[C@@H]3C[C@@H]3C2)cc(NCC2CC2)[nH+]1 ZINC000664526414 411977676 /nfs/dbraw/zinc/97/76/76/411977676.db2.gz VELNRYCZXWAUMH-VXGBXAGGSA-N 1 2 244.342 2.145 20 0 BEADLO c1nc(NCC2CC2)cc(N2CC[C@@H]3C[C@@H]3C2)[nH+]1 ZINC000664526414 411977678 /nfs/dbraw/zinc/97/76/78/411977678.db2.gz VELNRYCZXWAUMH-VXGBXAGGSA-N 1 2 244.342 2.145 20 0 BEADLO c1ccc2[nH+]c(N3CC[C@@H]4C[C@@H]4C3)[nH]c2c1 ZINC000664526146 411977980 /nfs/dbraw/zinc/97/79/80/411977980.db2.gz TWSKUHZNGPDESY-NXEZZACHSA-N 1 2 213.284 2.409 20 0 BEADLO Nc1[nH+]cnc(NCC2=CCCC2)c1Cl ZINC000664541806 411981960 /nfs/dbraw/zinc/98/19/60/411981960.db2.gz HPLRUDSFRFNPOP-UHFFFAOYSA-N 1 2 224.695 2.234 20 0 BEADLO Nc1nc[nH+]c(NCC2=CCCC2)c1Cl ZINC000664541806 411981962 /nfs/dbraw/zinc/98/19/62/411981962.db2.gz HPLRUDSFRFNPOP-UHFFFAOYSA-N 1 2 224.695 2.234 20 0 BEADLO CO[C@@H](CNc1cc[nH+]c(C)n1)C1CCCC1 ZINC000664561579 411988080 /nfs/dbraw/zinc/98/80/80/411988080.db2.gz WNCWSVAUGOKEPQ-LBPRGKRZSA-N 1 2 235.331 2.402 20 0 BEADLO CC[C@@H]([NH2+]C[C@@H]1CCCOC1)C(F)(F)F ZINC000336763244 170899850 /nfs/dbraw/zinc/89/98/50/170899850.db2.gz OTDWMZQJDWUADZ-DTWKUNHWSA-N 1 2 225.254 2.344 20 0 BEADLO CCc1nsc(N[C@H](C)c2[nH+]ccn2C)n1 ZINC000664608720 411998195 /nfs/dbraw/zinc/99/81/95/411998195.db2.gz KULAOCIXTMBOPN-SSDOTTSWSA-N 1 2 237.332 2.007 20 0 BEADLO COc1ccc2[nH+]c(N[C@H]3C[C@H](O)C3)ccc2c1 ZINC000664644383 412004469 /nfs/dbraw/zinc/00/44/69/412004469.db2.gz OHJKPJHFTJJLNN-XYPYZODXSA-N 1 2 244.294 2.179 20 0 BEADLO C[C@@H]1CN(c2cccc[nH+]2)C[C@@](C)(C(F)F)O1 ZINC000664691272 412010239 /nfs/dbraw/zinc/01/02/39/412010239.db2.gz WXWOVIOGUDQIMT-SKDRFNHKSA-N 1 2 242.269 2.331 20 0 BEADLO Cc1nc(N2CCC[C@H](CCF)C2)cc[nH+]1 ZINC000664412763 411946336 /nfs/dbraw/zinc/94/63/36/411946336.db2.gz HYFJAGRBSAVCAH-LLVKDONJSA-N 1 2 223.295 2.361 20 0 BEADLO Cc1nc([C@@H](C)[NH+]2CCC3(CCC3)CC2)n[nH]1 ZINC000664445615 411959834 /nfs/dbraw/zinc/95/98/34/411959834.db2.gz NYIDGKHHSGDNKB-SNVBAGLBSA-N 1 2 234.347 2.440 20 0 BEADLO CC[C@@H]1CCCN(C(=O)CCc2c[nH+]cn2C)C1 ZINC000339164542 170971663 /nfs/dbraw/zinc/97/16/63/170971663.db2.gz OLPXVQWTNQHCOE-GFCCVEGCSA-N 1 2 249.358 2.001 20 0 BEADLO C[N@H+](CC1=CCSC1)Cc1nccs1 ZINC000662268164 412059741 /nfs/dbraw/zinc/05/97/41/412059741.db2.gz RJZFZVDOHJEYPY-UHFFFAOYSA-N 1 2 226.370 2.248 20 0 BEADLO C[N@@H+](CC1=CCSC1)Cc1nccs1 ZINC000662268164 412059745 /nfs/dbraw/zinc/05/97/45/412059745.db2.gz RJZFZVDOHJEYPY-UHFFFAOYSA-N 1 2 226.370 2.248 20 0 BEADLO CCC(=O)CCC[N@H+](C)Cc1nnc(C)s1 ZINC000662257221 412052278 /nfs/dbraw/zinc/05/22/78/412052278.db2.gz RARRMOYFTXSNAC-UHFFFAOYSA-N 1 2 241.360 2.038 20 0 BEADLO CCC(=O)CCC[N@@H+](C)Cc1nnc(C)s1 ZINC000662257221 412052281 /nfs/dbraw/zinc/05/22/81/412052281.db2.gz RARRMOYFTXSNAC-UHFFFAOYSA-N 1 2 241.360 2.038 20 0 BEADLO Cc1nnc(C[N@@H+](C)[C@H]2C=CCCC2)s1 ZINC000662261078 412054834 /nfs/dbraw/zinc/05/48/34/412054834.db2.gz SKIHPVCGYSHFBW-JTQLQIEISA-N 1 2 223.345 2.387 20 0 BEADLO Cc1nnc(C[N@H+](C)[C@H]2C=CCCC2)s1 ZINC000662261078 412054837 /nfs/dbraw/zinc/05/48/37/412054837.db2.gz SKIHPVCGYSHFBW-JTQLQIEISA-N 1 2 223.345 2.387 20 0 BEADLO CC[C@@H]1CCN1C(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000333157698 171019377 /nfs/dbraw/zinc/01/93/77/171019377.db2.gz GRNQWLSLCTUSME-AXFHLTTASA-N 1 2 248.330 2.083 20 0 BEADLO CC[C@H]1CC[C@H](C(=O)NCCc2[nH]cc[nH+]2)CC1 ZINC000249770379 171030542 /nfs/dbraw/zinc/03/05/42/171030542.db2.gz JJJXYQKXIUHWPY-HAQNSBGRSA-N 1 2 249.358 2.285 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000284525057 171032537 /nfs/dbraw/zinc/03/25/37/171032537.db2.gz WKPQUNGEZAIZJE-NPNFKUNOSA-N 1 2 233.315 2.212 20 0 BEADLO CCO[C@@H](CC)c1noc(C[N@H+](C)C(C)C)n1 ZINC000665034624 412062737 /nfs/dbraw/zinc/06/27/37/412062737.db2.gz DQPMUVWHXCOKID-JTQLQIEISA-N 1 2 241.335 2.397 20 0 BEADLO CCO[C@@H](CC)c1noc(C[N@@H+](C)C(C)C)n1 ZINC000665034624 412062740 /nfs/dbraw/zinc/06/27/40/412062740.db2.gz DQPMUVWHXCOKID-JTQLQIEISA-N 1 2 241.335 2.397 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2csc(C)n2)C[C@H](C)O1 ZINC000076729575 171090992 /nfs/dbraw/zinc/09/09/92/171090992.db2.gz YSDBXIONNCANPA-JOYOIKCWSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2csc(C)n2)C[C@H](C)O1 ZINC000076729575 171090995 /nfs/dbraw/zinc/09/09/95/171090995.db2.gz YSDBXIONNCANPA-JOYOIKCWSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cnc(C)s2)C[C@H](C)O1 ZINC000111276757 171092895 /nfs/dbraw/zinc/09/28/95/171092895.db2.gz AFZNNZLOFJNBIE-GXSJLCMTSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cnc(C)s2)C[C@H](C)O1 ZINC000111276757 171092896 /nfs/dbraw/zinc/09/28/96/171092896.db2.gz AFZNNZLOFJNBIE-GXSJLCMTSA-N 1 2 240.372 2.451 20 0 BEADLO CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1cc[nH+]c(C)c1 ZINC000336528573 171117563 /nfs/dbraw/zinc/11/75/63/171117563.db2.gz VWUHWJMDMSLJIX-ZWNOBZJWSA-N 1 2 247.342 2.464 20 0 BEADLO CC[C@@](C)([NH2+]Cc1cccc(C)c1)C(=O)OC ZINC000271185045 171175221 /nfs/dbraw/zinc/17/52/21/171175221.db2.gz JHLLDXROVNDQEE-CQSZACIVSA-N 1 2 235.327 2.426 20 0 BEADLO CC[C@@]1(C)C[N@@H+]([C@@H](C)c2cnccn2)CCO1 ZINC000190111613 171203838 /nfs/dbraw/zinc/20/38/38/171203838.db2.gz VYLOUJBCLOCHJX-AAEUAGOBSA-N 1 2 235.331 2.039 20 0 BEADLO CC[C@@]1(C)C[N@H+]([C@@H](C)c2cnccn2)CCO1 ZINC000190111613 171203840 /nfs/dbraw/zinc/20/38/40/171203840.db2.gz VYLOUJBCLOCHJX-AAEUAGOBSA-N 1 2 235.331 2.039 20 0 BEADLO CC[C@@]1(C)C[N@H+](Cc2nc(C)cs2)CCO1 ZINC000190109507 171204454 /nfs/dbraw/zinc/20/44/54/171204454.db2.gz IGXRYHLHCPNNKC-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO CC[C@@]1(C)C[N@@H+](Cc2nc(C)cs2)CCO1 ZINC000190109507 171204456 /nfs/dbraw/zinc/20/44/56/171204456.db2.gz IGXRYHLHCPNNKC-LBPRGKRZSA-N 1 2 240.372 2.452 20 0 BEADLO CC[C@H](C(=O)OC)[N@@H+]1CCC=C(c2ccco2)C1 ZINC000285365031 171240902 /nfs/dbraw/zinc/24/09/02/171240902.db2.gz QNOHSSMTUHKQNP-GFCCVEGCSA-N 1 2 249.310 2.320 20 0 BEADLO CC[C@H](C(=O)OC)[N@H+]1CCC=C(c2ccco2)C1 ZINC000285365031 171240904 /nfs/dbraw/zinc/24/09/04/171240904.db2.gz QNOHSSMTUHKQNP-GFCCVEGCSA-N 1 2 249.310 2.320 20 0 BEADLO CC[C@H](C)C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000336342824 171248255 /nfs/dbraw/zinc/24/82/55/171248255.db2.gz KOYBOSVHNNRALI-VHSXEESVSA-N 1 2 221.304 2.119 20 0 BEADLO CC[C@H](C)C(=O)NC[C@@H]1CCCn2cc(C)[nH+]c21 ZINC000337289430 171250923 /nfs/dbraw/zinc/25/09/23/171250923.db2.gz BUCVUBBEFPKTEI-JQWIXIFHSA-N 1 2 249.358 2.231 20 0 BEADLO CC[C@H](C)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000280674398 171255687 /nfs/dbraw/zinc/25/56/87/171255687.db2.gz BSLYQAGUEHRGJB-VIFPVBQESA-N 1 2 217.272 2.319 20 0 BEADLO CC[C@H](C)CC(=O)NCc1ccc(N(C)C)[nH+]c1 ZINC000276578182 171261208 /nfs/dbraw/zinc/26/12/08/171261208.db2.gz MVDBNGAXLVEKQQ-NSHDSACASA-N 1 2 249.358 2.200 20 0 BEADLO CC[C@H](C)CCC(=O)NCc1[nH]c[nH+]c1C ZINC000353700377 171267654 /nfs/dbraw/zinc/26/76/54/171267654.db2.gz WNFGTVXOIFUKQD-VIFPVBQESA-N 1 2 223.320 2.161 20 0 BEADLO CC[C@H](C)CCC(=O)NCc1[nH+]ccn1CC ZINC000295448557 171267815 /nfs/dbraw/zinc/26/78/15/171267815.db2.gz ATPULSJZXUIMHG-NSHDSACASA-N 1 2 237.347 2.346 20 0 BEADLO CC[C@H](C)CN(CC)C(=O)C=Cc1c[nH]c[nH+]1 ZINC000284221399 171276318 /nfs/dbraw/zinc/27/63/18/171276318.db2.gz AYNUPDUVHHWVQV-MLRMMBSGSA-N 1 2 235.331 2.318 20 0 BEADLO CC[C@H](C)C[C@@H](C)NC(=O)CCn1cc[nH+]c1 ZINC000266339601 171294207 /nfs/dbraw/zinc/29/42/07/171294207.db2.gz LWJVYTRLYBHRTQ-NWDGAFQWSA-N 1 2 237.347 2.214 20 0 BEADLO CC[C@H](C)N(CCO)c1cc(C)[nH+]c(C2CC2)n1 ZINC000288511663 171314843 /nfs/dbraw/zinc/31/48/43/171314843.db2.gz NAPJCIKUTIZMMC-NSHDSACASA-N 1 2 249.358 2.260 20 0 BEADLO CC[C@H](C)NC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000281077153 171330808 /nfs/dbraw/zinc/33/08/08/171330808.db2.gz UCWDBYQLUHARGL-VIFPVBQESA-N 1 2 232.287 2.254 20 0 BEADLO CC[C@H](C)[NH2+][C@H](Cc1ccccc1)C(=O)OC ZINC000038066895 171348581 /nfs/dbraw/zinc/34/85/81/171348581.db2.gz YRSMFCKMTZFEFW-WCQYABFASA-N 1 2 235.327 2.159 20 0 BEADLO CC[C@H](C)Nc1nc(N)c2ccccc2[nH+]1 ZINC000301898152 171350912 /nfs/dbraw/zinc/35/09/12/171350912.db2.gz WNHPGPCTJAQZBF-QMMMGPOBSA-N 1 2 216.288 2.422 20 0 BEADLO Cn1c[nH+]cc1[C@@H]1C[C@H]1C(=O)Nc1ccccc1 ZINC000665075369 412082455 /nfs/dbraw/zinc/08/24/55/412082455.db2.gz CUOZYEZSMYLTPT-VXGBXAGGSA-N 1 2 241.294 2.162 20 0 BEADLO CC[C@H](C)[C@@H]([NH2+]CCC(F)(F)F)C(=O)OC ZINC000336732216 171374753 /nfs/dbraw/zinc/37/47/53/171374753.db2.gz JHBKWAXCDJIZGX-JGVFFNPUSA-N 1 2 241.253 2.116 20 0 BEADLO CC(C)(C)c1nnc(C[N@@H+]2CC3CC2(C)C3)[nH]1 ZINC000662385120 412137621 /nfs/dbraw/zinc/13/76/21/412137621.db2.gz KDQRISKWQQTENV-UHFFFAOYSA-N 1 2 234.347 2.087 20 0 BEADLO CC(C)(C)c1nnc(C[N@H+]2CC3CC2(C)C3)[nH]1 ZINC000662385120 412137625 /nfs/dbraw/zinc/13/76/25/412137625.db2.gz KDQRISKWQQTENV-UHFFFAOYSA-N 1 2 234.347 2.087 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)N(C)Cc1[nH+]ccn1C ZINC000272517049 171383332 /nfs/dbraw/zinc/38/33/32/171383332.db2.gz WXBLSUHBVQWHAP-QWRGUYRKSA-N 1 2 237.347 2.061 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)N1CCn2cc(C)[nH+]c2C1 ZINC000374673422 171384028 /nfs/dbraw/zinc/38/40/28/171384028.db2.gz AMPRRKSDWOIAFY-JQWIXIFHSA-N 1 2 249.358 2.216 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000356808150 171384641 /nfs/dbraw/zinc/38/46/41/171384641.db2.gz XJRFWGREDJTPFR-GARJFASQSA-N 1 2 249.358 2.065 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000356808150 171384643 /nfs/dbraw/zinc/38/46/43/171384643.db2.gz XJRFWGREDJTPFR-GARJFASQSA-N 1 2 249.358 2.065 20 0 BEADLO CC[C@H](C)[C@H](C)NC(=O)c1ccc2[nH+]ccn2c1 ZINC000171160231 171388149 /nfs/dbraw/zinc/38/81/49/171388149.db2.gz XHKLBVIGGNFQGR-QWRGUYRKSA-N 1 2 245.326 2.499 20 0 BEADLO Cn1cc(Cl)c(C[N@@H+]2CC3CC2(C)C3)n1 ZINC000662386145 412140719 /nfs/dbraw/zinc/14/07/19/412140719.db2.gz VFLNZDMUKUTDFT-UHFFFAOYSA-N 1 2 225.723 2.058 20 0 BEADLO Cn1cc(Cl)c(C[N@H+]2CC3CC2(C)C3)n1 ZINC000662386145 412140722 /nfs/dbraw/zinc/14/07/22/412140722.db2.gz VFLNZDMUKUTDFT-UHFFFAOYSA-N 1 2 225.723 2.058 20 0 BEADLO CCCOc1cncc(-c2c[nH+]cn2C)c1 ZINC000665187222 412123802 /nfs/dbraw/zinc/12/38/02/412123802.db2.gz AGERWBZCIRSQQR-UHFFFAOYSA-N 1 2 217.272 2.271 20 0 BEADLO CCCn1nc(C)c(-c2c[nH+]cn2C)c1C ZINC000665193914 412128203 /nfs/dbraw/zinc/12/82/03/412128203.db2.gz ONHVXLKXUYZGDJ-UHFFFAOYSA-N 1 2 218.304 2.310 20 0 BEADLO c1c[nH+]c(-c2cccc3c2OCCCO3)[nH]1 ZINC000665202781 412134709 /nfs/dbraw/zinc/13/47/09/412134709.db2.gz OJMXYAJQBXKAIH-UHFFFAOYSA-N 1 2 216.240 2.238 20 0 BEADLO CC[C@H](NC(=O)CCC(C)C)c1[nH]cc[nH+]1 ZINC000125346205 171496414 /nfs/dbraw/zinc/49/64/14/171496414.db2.gz WPOXBVMSSDDDTD-JTQLQIEISA-N 1 2 223.320 2.413 20 0 BEADLO CC[C@H]1CC[N@@H+]1Cc1c(Cl)cnn1C ZINC000292720246 171636906 /nfs/dbraw/zinc/63/69/06/171636906.db2.gz FEMDIHMPTJKHDS-QMMMGPOBSA-N 1 2 213.712 2.058 20 0 BEADLO CC[C@H]1CC[N@H+]1Cc1c(Cl)cnn1C ZINC000292720246 171636908 /nfs/dbraw/zinc/63/69/08/171636908.db2.gz FEMDIHMPTJKHDS-QMMMGPOBSA-N 1 2 213.712 2.058 20 0 BEADLO CCc1c[nH+]ccc1NC(=O)[C@H]1C[C@]1(C)CC ZINC000341264406 171746917 /nfs/dbraw/zinc/74/69/17/171746917.db2.gz ARIJOHAAWLMPIS-RISCZKNCSA-N 1 2 232.327 2.441 20 0 BEADLO Cn1c2ccccc2[nH+]c1N[C@@H]1C[C@H]2CC[C@@H]1O2 ZINC000133058599 412393324 /nfs/dbraw/zinc/39/33/24/412393324.db2.gz DRVZMCBOIJRYDG-XWIASGKRSA-N 1 2 243.310 2.305 20 0 BEADLO c1cn(Cc2nc([C@@H]3CCCOC3)cs2)c[nH+]1 ZINC000663219870 412394369 /nfs/dbraw/zinc/39/43/69/412394369.db2.gz LYBRVHHRMJWSPF-SNVBAGLBSA-N 1 2 249.339 2.282 20 0 BEADLO CCc1nc2sccc2c(-n2cc[nH+]c2)n1 ZINC000301839943 171940489 /nfs/dbraw/zinc/94/04/89/171940489.db2.gz XSXZDGRHAHLPAN-UHFFFAOYSA-N 1 2 230.296 2.439 20 0 BEADLO CCc1nc(C[N@@H+](CC)[C@H]2CCOC2)cs1 ZINC000361251720 171974683 /nfs/dbraw/zinc/97/46/83/171974683.db2.gz OJVVTELOPAVSNP-NSHDSACASA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nc(C[N@H+](CC)[C@H]2CCOC2)cs1 ZINC000361251720 171974684 /nfs/dbraw/zinc/97/46/84/171974684.db2.gz OJVVTELOPAVSNP-NSHDSACASA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nc(C[NH2+][C@@H](C)CF)cs1 ZINC000308471505 171985919 /nfs/dbraw/zinc/98/59/19/171985919.db2.gz KQTJUFGMSDVPFK-ZETCQYMHSA-N 1 2 202.298 2.153 20 0 BEADLO CCc1nc([C@H](C)NCc2[nH]cc[nH+]2)cs1 ZINC000111406685 172006043 /nfs/dbraw/zinc/00/60/43/172006043.db2.gz DSELQAYQTMJWHB-QMMMGPOBSA-N 1 2 236.344 2.279 20 0 BEADLO CCc1nc([C@H](C)[NH2+]CCF)cs1 ZINC000308488890 172006218 /nfs/dbraw/zinc/00/62/18/172006218.db2.gz QHRKSTLYLPHENC-ZETCQYMHSA-N 1 2 202.298 2.326 20 0 BEADLO CCc1nnc([C@H](C)[NH2+][C@H](C)c2cccnc2)[nH]1 ZINC000271492997 172007326 /nfs/dbraw/zinc/00/73/26/172007326.db2.gz LFBGOTWKUZQWRV-ZJUUUORDSA-N 1 2 245.330 2.174 20 0 BEADLO CCc1ncc(C[N@@H+]2CCOCC2(C)C)s1 ZINC000271112469 172017305 /nfs/dbraw/zinc/01/73/05/172017305.db2.gz AEHOTNLGLSLKQJ-UHFFFAOYSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1ncc(C[N@H+]2CCOCC2(C)C)s1 ZINC000271112469 172017307 /nfs/dbraw/zinc/01/73/07/172017307.db2.gz AEHOTNLGLSLKQJ-UHFFFAOYSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1nnc(C[N@@H+](CC)Cc2ccncc2)o1 ZINC000271019160 172048195 /nfs/dbraw/zinc/04/81/95/172048195.db2.gz NQVUKSBUSUIWLU-UHFFFAOYSA-N 1 2 246.314 2.049 20 0 BEADLO CCc1nnc(C[N@H+](CC)Cc2ccncc2)o1 ZINC000271019160 172048197 /nfs/dbraw/zinc/04/81/97/172048197.db2.gz NQVUKSBUSUIWLU-UHFFFAOYSA-N 1 2 246.314 2.049 20 0 BEADLO CCc1nnc(CNc2cccc[nH+]2)s1 ZINC000290594969 172052953 /nfs/dbraw/zinc/05/29/53/172052953.db2.gz DHZWGVHYLIZHLP-UHFFFAOYSA-N 1 2 220.301 2.108 20 0 BEADLO CCc1nnc(C[NH2+][C@H](C)c2cccc(O)c2)o1 ZINC000181485075 172053006 /nfs/dbraw/zinc/05/30/06/172053006.db2.gz KLFOHQUOQBFPLW-SECBINFHSA-N 1 2 247.298 2.188 20 0 BEADLO CCc1nnc(C[NH2+][C@@H](C)c2cccnc2)s1 ZINC000273183634 172053304 /nfs/dbraw/zinc/05/33/04/172053304.db2.gz QIPSAMSACPYUCK-VIFPVBQESA-N 1 2 248.355 2.346 20 0 BEADLO CCc1noc(C)c1C[NH2+][C@@H](C)c1ncc[nH]1 ZINC000293691791 172079136 /nfs/dbraw/zinc/07/91/36/172079136.db2.gz LERHCTDHGNRXMW-QMMMGPOBSA-N 1 2 234.303 2.119 20 0 BEADLO CCc1nocc1CNc1ccc(N(C)C)[nH+]c1 ZINC000339295385 172101022 /nfs/dbraw/zinc/10/10/22/172101022.db2.gz AYVPENZKXLUJQV-UHFFFAOYSA-N 1 2 246.314 2.310 20 0 BEADLO CCn1cc(NC(=O)Nc2cc[nH+]cc2C)cn1 ZINC000121792056 172181220 /nfs/dbraw/zinc/18/12/20/172181220.db2.gz ZFKZQHYEIPDOFP-UHFFFAOYSA-N 1 2 245.286 2.250 20 0 BEADLO CCn1cc([C@@H](C)Nc2cccc[nH+]2)cn1 ZINC000271951083 172195201 /nfs/dbraw/zinc/19/52/01/172195201.db2.gz ORTKPVZWFGKNDD-SNVBAGLBSA-N 1 2 216.288 2.471 20 0 BEADLO CCn1cc([C@H](C)[NH2+]Cc2cc(C)on2)cn1 ZINC000044693415 172197657 /nfs/dbraw/zinc/19/76/57/172197657.db2.gz QQBJPMJTTIXPFG-JTQLQIEISA-N 1 2 234.303 2.050 20 0 BEADLO CCn1cc[nH+]c1CN(C)Cc1ccoc1 ZINC000336691703 172217414 /nfs/dbraw/zinc/21/74/14/172217414.db2.gz BSWUGCWFJPEEAH-UHFFFAOYSA-N 1 2 219.288 2.128 20 0 BEADLO CCn1ccnc1C(=O)Nc1ccc(C)[nH+]c1C ZINC000292096722 172217469 /nfs/dbraw/zinc/21/74/69/172217469.db2.gz JAGGXLAVWIXLRX-UHFFFAOYSA-N 1 2 244.298 2.167 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)C[C@@H]1CC[C@H](C)C1 ZINC000295828826 172221766 /nfs/dbraw/zinc/22/17/66/172221766.db2.gz USSRLCZZDPJAGO-NWDGAFQWSA-N 1 2 249.358 2.346 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)CC1CCCC1 ZINC000295811262 172222111 /nfs/dbraw/zinc/22/21/11/172222111.db2.gz SQKGINNBPBKHMQ-UHFFFAOYSA-N 1 2 235.331 2.100 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)CCC(C)(C)C ZINC000295738061 172222514 /nfs/dbraw/zinc/22/25/14/172222514.db2.gz MCKFLWQLHNAFKZ-UHFFFAOYSA-N 1 2 237.347 2.346 20 0 BEADLO CCn1ccnc1C[NH2+][C@H](C)c1cncc(F)c1 ZINC000272788906 172223887 /nfs/dbraw/zinc/22/38/87/172223887.db2.gz SOHMGKZCTZFEBG-SNVBAGLBSA-N 1 2 248.305 2.288 20 0 BEADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1ccoc1 ZINC000295350328 172227675 /nfs/dbraw/zinc/22/76/75/172227675.db2.gz YUVAPDRKQFQNOM-SNVBAGLBSA-N 1 2 219.288 2.347 20 0 BEADLO CCn1c[nH+]cc1CNc1cncc(F)c1 ZINC000300881110 172233241 /nfs/dbraw/zinc/23/32/41/172233241.db2.gz ABCNTEQYJSJSIX-UHFFFAOYSA-N 1 2 220.251 2.049 20 0 BEADLO CCn1nc(C)c(NCc2[nH+]cc(C)n2C)c1C ZINC000341261517 172248371 /nfs/dbraw/zinc/24/83/71/172248371.db2.gz PUCJHWSJWGVTOR-UHFFFAOYSA-N 1 2 247.346 2.174 20 0 BEADLO CCn1ncnc1C[NH2+]Cc1cc(C)ccc1F ZINC000355589228 172282549 /nfs/dbraw/zinc/28/25/49/172282549.db2.gz XPXOXIPCRPRNCH-UHFFFAOYSA-N 1 2 248.305 2.035 20 0 BEADLO CCn1ncnc1C[NH2+][C@H](C)c1ccsc1 ZINC000083978130 172283408 /nfs/dbraw/zinc/28/34/08/172283408.db2.gz AFABEQMHRQSNMN-SECBINFHSA-N 1 2 236.344 2.210 20 0 BEADLO CN(C(=O)CNc1cccc[nH+]1)C1CCCCC1 ZINC000267101056 172310968 /nfs/dbraw/zinc/31/09/68/172310968.db2.gz OYLUZZKBWRDWDT-UHFFFAOYSA-N 1 2 247.342 2.285 20 0 BEADLO CN(C(=O)c1cccc(-n2cc[nH+]c2)c1)C1CC1 ZINC000117631665 172341256 /nfs/dbraw/zinc/34/12/56/172341256.db2.gz CDPVUPZAHSOFKE-UHFFFAOYSA-N 1 2 241.294 2.107 20 0 BEADLO CN(C(=O)c1ccc2[nH+]ccn2c1)C1CCCC1 ZINC000057827164 172341323 /nfs/dbraw/zinc/34/13/23/172341323.db2.gz SGLSVFXBJOWNRP-UHFFFAOYSA-N 1 2 243.310 2.349 20 0 BEADLO CN(C)C(=O)C1(CNc2cccc[nH+]2)CCCC1 ZINC000265004643 172354068 /nfs/dbraw/zinc/35/40/68/172354068.db2.gz VUIIHSLVGJTMBM-UHFFFAOYSA-N 1 2 247.342 2.142 20 0 BEADLO CN(C[C@@H]1CCCC[C@@H]1O)c1cccc[nH+]1 ZINC000272253253 172809600 /nfs/dbraw/zinc/80/96/00/172809600.db2.gz TWIAJNLGZNBKFW-RYUDHWBXSA-N 1 2 220.316 2.069 20 0 BEADLO Cn1ccnc1C[N@H+](C)Cc1cccc(F)c1 ZINC000153394149 172863709 /nfs/dbraw/zinc/86/37/09/172863709.db2.gz HQDRLEVDXZOMMQ-UHFFFAOYSA-N 1 2 233.290 2.191 20 0 BEADLO Cn1ccnc1C[N@@H+](C)Cc1cccc(F)c1 ZINC000153394149 172863710 /nfs/dbraw/zinc/86/37/10/172863710.db2.gz HQDRLEVDXZOMMQ-UHFFFAOYSA-N 1 2 233.290 2.191 20 0 BEADLO CN(Cc1[nH+]ccn1C)Cc1cccc(F)c1 ZINC000153394149 172863711 /nfs/dbraw/zinc/86/37/11/172863711.db2.gz HQDRLEVDXZOMMQ-UHFFFAOYSA-N 1 2 233.290 2.191 20 0 BEADLO CN(c1[nH]c2ccccc2[nH+]1)[C@@H]1CCCOC1 ZINC000336398352 172953435 /nfs/dbraw/zinc/95/34/35/172953435.db2.gz UAKIKEBOBYXAKP-SNVBAGLBSA-N 1 2 231.299 2.178 20 0 BEADLO CNC(=O)COc1ccc([NH2+][C@H](C)C2CC2)cc1 ZINC000179818170 173279136 /nfs/dbraw/zinc/27/91/36/173279136.db2.gz AZRBZMZPLKPMPG-SNVBAGLBSA-N 1 2 248.326 2.022 20 0 BEADLO C[NH2+]Cc1noc(C2=CCC(C)(C)CC2)n1 ZINC000333942418 173399598 /nfs/dbraw/zinc/39/95/98/173399598.db2.gz PXYBSNIEUYBFBE-UHFFFAOYSA-N 1 2 221.304 2.383 20 0 BEADLO C[NH2+]Cc1noc(C(C)(C)c2ccccc2)n1 ZINC000051848521 173399627 /nfs/dbraw/zinc/39/96/27/173399627.db2.gz QRIJGEZFCIBQQL-UHFFFAOYSA-N 1 2 231.299 2.115 20 0 BEADLO COC(=O)C1([NH2+]Cc2ccccc2)CCCC1 ZINC000037952504 173516112 /nfs/dbraw/zinc/51/61/12/173516112.db2.gz KYSPIAXMSPKXHX-UHFFFAOYSA-N 1 2 233.311 2.262 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H]1CC[C@H](c2ccccc2)C1 ZINC000280192178 173692687 /nfs/dbraw/zinc/69/26/87/173692687.db2.gz HKZUHFGFKZOVNM-KWCYVHTRSA-N 1 2 247.338 2.474 20 0 BEADLO COC(C)(C)c1noc(Cc2ccc(C)[nH+]c2)n1 ZINC000361173648 173957156 /nfs/dbraw/zinc/95/71/56/173957156.db2.gz KOCSFDXMSJCBHS-UHFFFAOYSA-N 1 2 247.298 2.245 20 0 BEADLO COC1(CC(=O)Nc2cc[nH+]cc2C)CCC1 ZINC000277291664 173983249 /nfs/dbraw/zinc/98/32/49/173983249.db2.gz QVOKWRYZSHMXSL-UHFFFAOYSA-N 1 2 234.299 2.288 20 0 BEADLO COC1CCC(N(C)c2cccc[nH+]2)CC1 ZINC000265235213 174023577 /nfs/dbraw/zinc/02/35/77/174023577.db2.gz RSAGFNBBGQCUND-UHFFFAOYSA-N 1 2 220.316 2.475 20 0 BEADLO COC1C[NH+](Cc2cc3ccccc3o2)C1 ZINC000336424774 174035740 /nfs/dbraw/zinc/03/57/40/174035740.db2.gz QEFMZSNZFVGTRA-UHFFFAOYSA-N 1 2 217.268 2.263 20 0 BEADLO COCC(C)(C)C(=O)Nc1cc[nH+]c(C)c1 ZINC000133799572 174067888 /nfs/dbraw/zinc/06/78/88/174067888.db2.gz VQXKBJMLDSHKBB-UHFFFAOYSA-N 1 2 222.288 2.001 20 0 BEADLO COCC1(NC(=O)Nc2cc[nH+]c(C)c2)CCC1 ZINC000284722337 174107522 /nfs/dbraw/zinc/10/75/22/174107522.db2.gz HTHPCHCHTCUPFW-UHFFFAOYSA-N 1 2 249.314 2.081 20 0 BEADLO COCCC(C)(C)C(=O)Nc1cc[nH+]cc1C ZINC000184754445 174141537 /nfs/dbraw/zinc/14/15/37/174141537.db2.gz KBXBPTRHWNWIDB-UHFFFAOYSA-N 1 2 236.315 2.391 20 0 BEADLO COCCC1(C(=O)Nc2cc[nH+]cc2C)CC1 ZINC000132990230 174151072 /nfs/dbraw/zinc/15/10/72/174151072.db2.gz URMWHFJJFJUWPP-UHFFFAOYSA-N 1 2 234.299 2.145 20 0 BEADLO COCCCCC(=O)Nc1c(C)cc[nH+]c1C ZINC000362396494 174173768 /nfs/dbraw/zinc/17/37/68/174173768.db2.gz NUXJDHVMBIZZBQ-UHFFFAOYSA-N 1 2 236.315 2.454 20 0 BEADLO COCCCC[N@@H+]1CCOC[C@H]1c1ccco1 ZINC000363500201 174191716 /nfs/dbraw/zinc/19/17/16/174191716.db2.gz OCYJYOAQUAXVAR-LBPRGKRZSA-N 1 2 239.315 2.080 20 0 BEADLO COCCCC[N@H+]1CCOC[C@H]1c1ccco1 ZINC000363500201 174191718 /nfs/dbraw/zinc/19/17/18/174191718.db2.gz OCYJYOAQUAXVAR-LBPRGKRZSA-N 1 2 239.315 2.080 20 0 BEADLO COCCCNc1cc[nH+]c(C(C)C)n1 ZINC000106461930 174251858 /nfs/dbraw/zinc/25/18/58/174251858.db2.gz BMTVJOJHWDXPGT-UHFFFAOYSA-N 1 2 209.293 2.048 20 0 BEADLO COCCN(C)c1[nH+]ccc2ccc(F)cc21 ZINC000354565858 174285032 /nfs/dbraw/zinc/28/50/32/174285032.db2.gz MFZNTRDWOQZPCE-UHFFFAOYSA-N 1 2 234.274 2.457 20 0 BEADLO COCCN(c1cc[nH+]c(C)n1)[C@H]1CC[C@H](C)C1 ZINC000357647193 174302034 /nfs/dbraw/zinc/30/20/34/174302034.db2.gz QGXMEGDASZVHLD-AAEUAGOBSA-N 1 2 249.358 2.426 20 0 BEADLO COCCN(c1cc[nH+]c(C)n1)[C@@H]1CC[C@H](C)C1 ZINC000357647195 174302440 /nfs/dbraw/zinc/30/24/40/174302440.db2.gz QGXMEGDASZVHLD-WCQYABFASA-N 1 2 249.358 2.426 20 0 BEADLO COCC[C@@H](C)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000265377523 174386089 /nfs/dbraw/zinc/38/60/89/174386089.db2.gz QDAWIKQIELDYHD-SECBINFHSA-N 1 2 235.331 2.499 20 0 BEADLO COCC[C@@H]([NH2+]Cc1ccno1)c1ccco1 ZINC000273237380 174394265 /nfs/dbraw/zinc/39/42/65/174394265.db2.gz GWGFSTYBZPEZSB-LLVKDONJSA-N 1 2 236.271 2.135 20 0 BEADLO COc1cc(NCc2[nH]cc[nH+]2)c(C)c(OC)c1 ZINC000337236112 175003102 /nfs/dbraw/zinc/00/31/02/175003102.db2.gz CANAJGVMOYZJPH-UHFFFAOYSA-N 1 2 247.298 2.347 20 0 BEADLO COc1ccc(CCn2cc[nH+]c2)cc1 ZINC000105999671 175094277 /nfs/dbraw/zinc/09/42/77/175094277.db2.gz XVQBSWGBOYNXPD-UHFFFAOYSA-N 1 2 202.257 2.134 20 0 BEADLO COc1ccc(F)c(C[N@@H+]2CCO[C@H](C)C2)c1 ZINC000294968832 175124636 /nfs/dbraw/zinc/12/46/36/175124636.db2.gz RJCDIIIWEMCMTG-SNVBAGLBSA-N 1 2 239.290 2.055 20 0 BEADLO COc1ccc(F)c(C[N@H+]2CCO[C@H](C)C2)c1 ZINC000294968832 175124639 /nfs/dbraw/zinc/12/46/39/175124639.db2.gz RJCDIIIWEMCMTG-SNVBAGLBSA-N 1 2 239.290 2.055 20 0 BEADLO COc1ccc(F)cc1-c1ccc[nH+]c1N ZINC000082729954 175127286 /nfs/dbraw/zinc/12/72/86/175127286.db2.gz XEBBQIIILDNFAK-UHFFFAOYSA-N 1 2 218.231 2.479 20 0 BEADLO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1cc[nH]n1 ZINC000037089995 175133575 /nfs/dbraw/zinc/13/35/75/175133575.db2.gz VKZKJAARRWKHLQ-VIFPVBQESA-N 1 2 249.289 2.408 20 0 BEADLO Cn1ncc(C2CC2)c1C[N@@H+]1CCC[C@H](F)C1 ZINC000668292996 487629996 /nfs/dbraw/zinc/62/99/96/487629996.db2.gz RQIXWVMQFPMLAX-NSHDSACASA-N 1 2 237.322 2.231 20 0 BEADLO Cn1ncc(C2CC2)c1C[N@H+]1CCC[C@H](F)C1 ZINC000668292996 487630001 /nfs/dbraw/zinc/63/00/01/487630001.db2.gz RQIXWVMQFPMLAX-NSHDSACASA-N 1 2 237.322 2.231 20 0 BEADLO COCc1cc[nH+]c(N[C@@H]2CO[C@H](C3CC3)C2)c1 ZINC000668293108 487630049 /nfs/dbraw/zinc/63/00/49/487630049.db2.gz UEQUNSKSXSJQAN-STQMWFEESA-N 1 2 248.326 2.207 20 0 BEADLO F[C@H]1CCC[N@H+](Cc2ccnn2CC2CC2)C1 ZINC000668292839 487630338 /nfs/dbraw/zinc/63/03/38/487630338.db2.gz POOCMBHASQIKJO-LBPRGKRZSA-N 1 2 237.322 2.227 20 0 BEADLO F[C@H]1CCC[N@@H+](Cc2ccnn2CC2CC2)C1 ZINC000668292839 487630342 /nfs/dbraw/zinc/63/03/42/487630342.db2.gz POOCMBHASQIKJO-LBPRGKRZSA-N 1 2 237.322 2.227 20 0 BEADLO COc1ccc2[nH+]c(NCCCCO)ccc2c1 ZINC000302826567 175229271 /nfs/dbraw/zinc/22/92/71/175229271.db2.gz ASVMIXUNUNTXQO-UHFFFAOYSA-N 1 2 246.310 2.428 20 0 BEADLO COc1ccc2[nH+]c(N[C@@H]3CCOC3)ccc2c1 ZINC000301780258 175229476 /nfs/dbraw/zinc/22/94/76/175229476.db2.gz RIQCEBTUCBDPBS-LLVKDONJSA-N 1 2 244.294 2.444 20 0 BEADLO COc1cccc(C(=O)Nc2cc[nH+]cc2O)c1 ZINC000109889281 175246318 /nfs/dbraw/zinc/24/63/18/175246318.db2.gz VHVLDSWJPVDUPJ-UHFFFAOYSA-N 1 2 244.250 2.048 20 0 BEADLO COc1cccc(C2([NH2+]Cc3ccon3)CC2)c1 ZINC000271668628 175248048 /nfs/dbraw/zinc/24/80/48/175248048.db2.gz CINFVQROMWMABI-UHFFFAOYSA-N 1 2 244.294 2.462 20 0 BEADLO COc1cccc(C2([NH2+]Cc3cocn3)CC2)c1 ZINC000277071133 175248227 /nfs/dbraw/zinc/24/82/27/175248227.db2.gz SLVKEWWZKOGFOB-UHFFFAOYSA-N 1 2 244.294 2.462 20 0 BEADLO COc1cccc(F)c1[C@H](C)[NH2+]CCF ZINC000336687277 175274146 /nfs/dbraw/zinc/27/41/46/175274146.db2.gz LIRYGPOULNFMNL-QMMMGPOBSA-N 1 2 215.243 2.454 20 0 BEADLO COc1cccc(OCc2c[nH+]cn2C)c1 ZINC000258337106 175284202 /nfs/dbraw/zinc/28/42/02/175284202.db2.gz XNBMVYUMBRGJBX-UHFFFAOYSA-N 1 2 218.256 2.008 20 0 BEADLO COc1cccc([C@H](C)[NH2+]Cc2nc(C)no2)c1 ZINC000038034381 175293251 /nfs/dbraw/zinc/29/32/51/175293251.db2.gz BDDVCDFWNBVNIN-VIFPVBQESA-N 1 2 247.298 2.237 20 0 BEADLO COc1cccc([C@H](C)[NH2+]Cc2nonc2C)c1 ZINC000148302565 175293307 /nfs/dbraw/zinc/29/33/07/175293307.db2.gz NNEHTZSJKLQTFP-VIFPVBQESA-N 1 2 247.298 2.237 20 0 BEADLO COc1ccccc1/C=C/C[N@@H+]1CCO[C@H](C)C1 ZINC000179864556 175313710 /nfs/dbraw/zinc/31/37/10/175313710.db2.gz WYQFVWNMHCKAIH-VUDGCMKMSA-N 1 2 247.338 2.429 20 0 BEADLO COc1ccccc1/C=C/C[N@H+]1CCO[C@H](C)C1 ZINC000179864556 175313711 /nfs/dbraw/zinc/31/37/11/175313711.db2.gz WYQFVWNMHCKAIH-VUDGCMKMSA-N 1 2 247.338 2.429 20 0 BEADLO COc1ccccc1/C=C/C[NH+]1CC(C)(OC)C1 ZINC000362313361 175313971 /nfs/dbraw/zinc/31/39/71/175313971.db2.gz SUERPWZCMJTNKY-SOFGYWHQSA-N 1 2 247.338 2.429 20 0 BEADLO COc1ccccc1CCNc1cc[nH+]c(C)n1 ZINC000230887434 175323806 /nfs/dbraw/zinc/32/38/06/175323806.db2.gz KXPZMSKEOSKNPB-UHFFFAOYSA-N 1 2 243.310 2.448 20 0 BEADLO COc1ccccc1C[NH2+]Cc1nc(C)c(C)[nH]1 ZINC000045205752 175330489 /nfs/dbraw/zinc/33/04/89/175330489.db2.gz YKQNEXKDKREIEB-UHFFFAOYSA-N 1 2 245.326 2.325 20 0 BEADLO COc1ccccc1CNCc1[nH]c(C)c(C)[nH+]1 ZINC000045205752 175330491 /nfs/dbraw/zinc/33/04/91/175330491.db2.gz YKQNEXKDKREIEB-UHFFFAOYSA-N 1 2 245.326 2.325 20 0 BEADLO COc1ccccc1[C@H](C)[NH2+]Cc1ccn(C)n1 ZINC000112338600 175351989 /nfs/dbraw/zinc/35/19/89/175351989.db2.gz VMVUISHTUNGEBM-NSHDSACASA-N 1 2 245.326 2.280 20 0 BEADLO COc1ccnc(C[N@H+](C)CCC(F)(F)F)c1 ZINC000106860136 175358875 /nfs/dbraw/zinc/35/88/75/175358875.db2.gz CBSNRNYVHHNVTF-UHFFFAOYSA-N 1 2 248.248 2.474 20 0 BEADLO COc1ccnc(C[N@@H+](C)CCC(F)(F)F)c1 ZINC000106860136 175358877 /nfs/dbraw/zinc/35/88/77/175358877.db2.gz CBSNRNYVHHNVTF-UHFFFAOYSA-N 1 2 248.248 2.474 20 0 BEADLO COc1cc[nH+]c(CN(C)CCC(F)(F)F)c1 ZINC000106860136 175358879 /nfs/dbraw/zinc/35/88/79/175358879.db2.gz CBSNRNYVHHNVTF-UHFFFAOYSA-N 1 2 248.248 2.474 20 0 BEADLO COc1cc[nH+]cc1CNC(=O)C1CCCCC1 ZINC000293212348 175369587 /nfs/dbraw/zinc/36/95/87/175369587.db2.gz BSRSZVVUTIYDKM-UHFFFAOYSA-N 1 2 248.326 2.287 20 0 BEADLO COc1cc[nH+]cc1CS[C@@H](C)[C@H](C)O ZINC000309035469 175373106 /nfs/dbraw/zinc/37/31/06/175373106.db2.gz FRODRNYCZOYSRA-IUCAKERBSA-N 1 2 227.329 2.093 20 0 BEADLO COc1cc[nH+]cc1COc1ccccc1CO ZINC000336793408 175373527 /nfs/dbraw/zinc/37/35/27/175373527.db2.gz WQAFUXKTPHRNMG-UHFFFAOYSA-N 1 2 245.278 2.162 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C(C)(C)C1CC1 ZINC000287934242 175374361 /nfs/dbraw/zinc/37/43/61/175374361.db2.gz FCJGXHQZSCSXBB-UHFFFAOYSA-N 1 2 234.299 2.465 20 0 BEADLO COc1cc[nH+]cc1NC(=O)C1[C@@H]2CCCC[C@H]12 ZINC000081023459 175375426 /nfs/dbraw/zinc/37/54/26/175375426.db2.gz ADVOTCPSOPXYOY-HWYHXSKPSA-N 1 2 246.310 2.465 20 0 BEADLO COc1cc[nH+]cc1NCc1ccn(C)c1 ZINC000127656186 175376272 /nfs/dbraw/zinc/37/62/72/175376272.db2.gz XNDHQNMAXKSOPP-UHFFFAOYSA-N 1 2 217.272 2.041 20 0 BEADLO COc1cncc(C[N@H+](C)Cc2ccccn2)c1 ZINC000295216822 175384643 /nfs/dbraw/zinc/38/46/43/175384643.db2.gz VGOYZZGMZAFPFF-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO COc1cncc(C[N@@H+](C)Cc2ccccn2)c1 ZINC000295216822 175384644 /nfs/dbraw/zinc/38/46/44/175384644.db2.gz VGOYZZGMZAFPFF-UHFFFAOYSA-N 1 2 243.310 2.117 20 0 BEADLO CS[C@H](C)C(=O)Nc1cccc2[nH+]ccn21 ZINC000266133483 175556986 /nfs/dbraw/zinc/55/69/86/175556986.db2.gz CZPKUPHBZKKMNI-MRVPVSSYSA-N 1 2 235.312 2.024 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CC2(CC2(F)F)C1 ZINC000668293679 487630808 /nfs/dbraw/zinc/63/08/08/487630808.db2.gz HEIUTZXXJCAZNE-UHFFFAOYSA-N 1 2 241.285 2.305 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CCC[C@H](F)C1 ZINC000668294370 487631235 /nfs/dbraw/zinc/63/12/35/487631235.db2.gz VVGREIYRLLZTDK-NSHDSACASA-N 1 2 225.311 2.398 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ccccc1)c1ncn(C)n1 ZINC000275598856 175922452 /nfs/dbraw/zinc/92/24/52/175922452.db2.gz IZRAHRFYFDTMTQ-GHMZBOCLSA-N 1 2 230.315 2.227 20 0 BEADLO C[C@@H](O)c1ncc(C[N@@H+]2CCC[C@@H]2CF)s1 ZINC000294197850 176000963 /nfs/dbraw/zinc/00/09/63/176000963.db2.gz XQMLQZSCDRHRAG-RKDXNWHRSA-N 1 2 244.335 2.130 20 0 BEADLO C[C@@H](O)c1ncc(C[N@H+]2CCC[C@@H]2CF)s1 ZINC000294197850 176000964 /nfs/dbraw/zinc/00/09/64/176000964.db2.gz XQMLQZSCDRHRAG-RKDXNWHRSA-N 1 2 244.335 2.130 20 0 BEADLO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1ncnn1C ZINC000157494438 176016226 /nfs/dbraw/zinc/01/62/26/176016226.db2.gz UNQXRSZZHHTGNJ-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1ncnn1C ZINC000157494438 176016227 /nfs/dbraw/zinc/01/62/27/176016227.db2.gz UNQXRSZZHHTGNJ-JTQLQIEISA-N 1 2 248.305 2.147 20 0 BEADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1ccn(C)n1 ZINC000270755029 176019292 /nfs/dbraw/zinc/01/92/92/176019292.db2.gz DDPICKCARBINTO-NSHDSACASA-N 1 2 245.326 2.319 20 0 BEADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1ccn(C)n1 ZINC000270755029 176019293 /nfs/dbraw/zinc/01/92/93/176019293.db2.gz DDPICKCARBINTO-NSHDSACASA-N 1 2 245.326 2.319 20 0 BEADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1ccnn1C ZINC000091079574 176029046 /nfs/dbraw/zinc/02/90/46/176029046.db2.gz UVDLCOQUHIIILN-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1ccnn1C ZINC000091079574 176029047 /nfs/dbraw/zinc/02/90/47/176029047.db2.gz UVDLCOQUHIIILN-NSHDSACASA-N 1 2 230.315 2.008 20 0 BEADLO C[C@@H]1CCCC[C@@H]1CNC(=O)CCc1c[nH+]c[nH]1 ZINC000192903252 176076393 /nfs/dbraw/zinc/07/63/93/176076393.db2.gz VYLZGZGKAOUJOP-VXGBXAGGSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1CCCC[C@@H]1CNC(=O)CCc1c[nH]c[nH+]1 ZINC000192903252 176076396 /nfs/dbraw/zinc/07/63/96/176076396.db2.gz VYLZGZGKAOUJOP-VXGBXAGGSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1CCCC[C@@H]1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000276506837 176079382 /nfs/dbraw/zinc/07/93/82/176079382.db2.gz INNNRDWNORWUFW-ZUOHBJSBSA-N 1 2 233.315 2.118 20 0 BEADLO C[C@@H]1CCCC[C@H]1NC(=O)CCc1c[nH+]cn1C ZINC000188422358 176086239 /nfs/dbraw/zinc/08/62/39/176086239.db2.gz SHYMUKBYTWFYJC-DGCLKSJQSA-N 1 2 249.358 2.048 20 0 BEADLO C[C@@H]1CCC[C@@H](C)C1NC(=O)CCn1cc[nH+]c1 ZINC000264606217 176113677 /nfs/dbraw/zinc/11/36/77/176113677.db2.gz ARAFNJUAYDNSKL-VXGBXAGGSA-N 1 2 249.358 2.214 20 0 BEADLO C[C@@H]1CCC[C@H](CC(=O)NCCc2[nH]cc[nH+]2)C1 ZINC000330895164 176136334 /nfs/dbraw/zinc/13/63/34/176136334.db2.gz KMHADLKHOOYDLM-NEPJUHHUSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H]1CCC[C@]1(O)CNc1cc[nH+]c(C2CC2)n1 ZINC000294278749 176153154 /nfs/dbraw/zinc/15/31/54/176153154.db2.gz XOOMYPRWDICUJZ-YGRLFVJLSA-N 1 2 247.342 2.317 20 0 BEADLO C[C@@H]1CCN(C(=O)CC2CC2)C[C@@H]1n1cc[nH+]c1 ZINC000123836488 176154364 /nfs/dbraw/zinc/15/43/64/176154364.db2.gz XBOURLSGNSOABT-YPMHNXCESA-N 1 2 247.342 2.093 20 0 BEADLO C[C@@H]1CCN(c2cc(N3CCCC3)[nH+]cn2)[C@@H]1C ZINC000277908381 176181427 /nfs/dbraw/zinc/18/14/27/176181427.db2.gz UVWSRDJMNMOXNY-VXGBXAGGSA-N 1 2 246.358 2.312 20 0 BEADLO C[C@@H]1CCN(c2cc(N3CCCC3)nc[nH+]2)[C@@H]1C ZINC000277908381 176181429 /nfs/dbraw/zinc/18/14/29/176181429.db2.gz UVWSRDJMNMOXNY-VXGBXAGGSA-N 1 2 246.358 2.312 20 0 BEADLO C[C@@H]1CC[C@@H](NC(=O)CCc2[nH]cc[nH+]2)C[C@H]1C ZINC000356005497 176210407 /nfs/dbraw/zinc/21/04/07/176210407.db2.gz FVWCNHJEYUUMOZ-IJLUTSLNSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CC[S@](=O)CC[N@@H+]1Cc1ccsc1 ZINC000336348264 176239360 /nfs/dbraw/zinc/23/93/60/176239360.db2.gz FSOAMWFTRSLZBN-BMIGLBTASA-N 1 2 243.397 2.091 20 0 BEADLO C[C@@H]1CC[S@](=O)CC[N@H+]1Cc1ccsc1 ZINC000336348264 176239361 /nfs/dbraw/zinc/23/93/61/176239361.db2.gz FSOAMWFTRSLZBN-BMIGLBTASA-N 1 2 243.397 2.091 20 0 BEADLO C[C@@H]1CCc2nc(C[NH2+]CCF)sc2C1 ZINC000336761853 176239899 /nfs/dbraw/zinc/23/98/99/176239899.db2.gz NRFOJMAWIRISKS-MRVPVSSYSA-N 1 2 228.336 2.327 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cocn2)CCC1(F)F ZINC000291574376 176310114 /nfs/dbraw/zinc/31/01/14/176310114.db2.gz OFAQBDRKCWUCED-MRVPVSSYSA-N 1 2 216.231 2.152 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cocn2)CCC1(F)F ZINC000291574376 176310116 /nfs/dbraw/zinc/31/01/16/176310116.db2.gz OFAQBDRKCWUCED-MRVPVSSYSA-N 1 2 216.231 2.152 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nccn2C(F)F)[C@@H]1C ZINC000292936461 176311660 /nfs/dbraw/zinc/31/16/60/176311660.db2.gz HLMNQDKIDZVXFL-HTQZYQBOSA-N 1 2 215.247 2.118 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nccn2C(F)F)[C@@H]1C ZINC000292936461 176311662 /nfs/dbraw/zinc/31/16/62/176311662.db2.gz HLMNQDKIDZVXFL-HTQZYQBOSA-N 1 2 215.247 2.118 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ncc(C3CC3)o2)[C@@H]1C ZINC000293522036 176311768 /nfs/dbraw/zinc/31/17/68/176311768.db2.gz WDFWBOSOUOHJJB-RKDXNWHRSA-N 1 2 206.289 2.392 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ncc(C3CC3)o2)[C@@H]1C ZINC000293522036 176311769 /nfs/dbraw/zinc/31/17/69/176311769.db2.gz WDFWBOSOUOHJJB-RKDXNWHRSA-N 1 2 206.289 2.392 20 0 BEADLO C[C@@H]1C[N@H+](Cc2nnc(-c3ccco3)o2)[C@@H]1C ZINC000293043564 176313405 /nfs/dbraw/zinc/31/34/05/176313405.db2.gz QXOBHCAZMNJYKH-RKDXNWHRSA-N 1 2 233.271 2.170 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2nnc(-c3ccco3)o2)[C@@H]1C ZINC000293043564 176313406 /nfs/dbraw/zinc/31/34/06/176313406.db2.gz QXOBHCAZMNJYKH-RKDXNWHRSA-N 1 2 233.271 2.170 20 0 BEADLO C[C@@H]1CN(c2nc(N)c3ccccc3[nH+]2)C[C@H]1C ZINC000301859973 176320680 /nfs/dbraw/zinc/32/06/80/176320680.db2.gz CACWUQQSTPYNHP-NXEZZACHSA-N 1 2 242.326 2.304 20 0 BEADLO C[C@@H]1C[C@H]1CNc1cc(NC[C@H]2C[C@H]2C)nc[nH+]1 ZINC000357314262 176392137 /nfs/dbraw/zinc/39/21/37/176392137.db2.gz LLNWTMGKRLUQJI-KKOKHZNYSA-N 1 2 246.358 2.034 20 0 BEADLO C[C@@H]1C[C@H]1CNc1cc(NC[C@H]2C[C@H]2C)[nH+]cn1 ZINC000357314262 176392139 /nfs/dbraw/zinc/39/21/39/176392139.db2.gz LLNWTMGKRLUQJI-KKOKHZNYSA-N 1 2 246.358 2.034 20 0 BEADLO C[C@H]([NH2+]Cc1cocn1)c1cncc(F)c1 ZINC000309818557 176882524 /nfs/dbraw/zinc/88/25/24/176882524.db2.gz VUUNFWHNHZAZFY-QMMMGPOBSA-N 1 2 221.235 2.060 20 0 BEADLO C[C@H](Nc1cc[nH+]c(C2CC2)n1)[C@@H]1CCOC1 ZINC000266187915 176937618 /nfs/dbraw/zinc/93/76/18/176937618.db2.gz AZWKEXAIPPCJFE-GXSJLCMTSA-N 1 2 233.315 2.191 20 0 BEADLO C[C@H](O)CCCNc1cc[nH+]c2ccncc12 ZINC000278557340 176955791 /nfs/dbraw/zinc/95/57/91/176955791.db2.gz ANOVFMYIZVAZHZ-JTQLQIEISA-N 1 2 231.299 2.203 20 0 BEADLO C[C@H](c1ccccn1)[N@H+](C)Cc1cnccn1 ZINC000177242628 177042395 /nfs/dbraw/zinc/04/23/95/177042395.db2.gz BCXVUIVXGPMMOP-LLVKDONJSA-N 1 2 228.299 2.065 20 0 BEADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1cnccn1 ZINC000177242628 177042396 /nfs/dbraw/zinc/04/23/96/177042396.db2.gz BCXVUIVXGPMMOP-LLVKDONJSA-N 1 2 228.299 2.065 20 0 BEADLO C[C@H](c1ccco1)N(C)C(=O)CCc1[nH]cc[nH+]1 ZINC000279299209 177046089 /nfs/dbraw/zinc/04/60/89/177046089.db2.gz ZQZFYFXVETVVCW-SNVBAGLBSA-N 1 2 247.298 2.155 20 0 BEADLO C[C@H](c1ccco1)[N@@H+](C)Cc1cocn1 ZINC000191926719 177047224 /nfs/dbraw/zinc/04/72/24/177047224.db2.gz LJQIAODBVDWCJR-SECBINFHSA-N 1 2 206.245 2.461 20 0 BEADLO C[C@H](c1ccco1)[N@H+](C)Cc1cocn1 ZINC000191926719 177047223 /nfs/dbraw/zinc/04/72/23/177047223.db2.gz LJQIAODBVDWCJR-SECBINFHSA-N 1 2 206.245 2.461 20 0 BEADLO C[C@H](c1cnccn1)[N@H+](C)Cc1ccco1 ZINC000184400124 177051807 /nfs/dbraw/zinc/05/18/07/177051807.db2.gz ROPUFICZRDJECX-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H](c1cnccn1)[N@@H+](C)Cc1ccco1 ZINC000184400124 177051808 /nfs/dbraw/zinc/05/18/08/177051808.db2.gz ROPUFICZRDJECX-SNVBAGLBSA-N 1 2 217.272 2.263 20 0 BEADLO C[C@H]1CCC[C@@H](NC(=O)CCn2cc[nH+]c2)CC1 ZINC000275965086 177121233 /nfs/dbraw/zinc/12/12/33/177121233.db2.gz IYIIZUMZWUJZQJ-QWHCGFSZSA-N 1 2 249.358 2.358 20 0 BEADLO C[C@H]1CCC[C@H](C)N1C(=O)CCn1cc[nH+]c1 ZINC000264654616 177129671 /nfs/dbraw/zinc/12/96/71/177129671.db2.gz QCSXSYQLNXUFTK-RYUDHWBXSA-N 1 2 235.331 2.063 20 0 BEADLO C[C@H]1CCN(C(=O)CC2CC2)C[C@H]1n1cc[nH+]c1 ZINC000123837047 177146397 /nfs/dbraw/zinc/14/63/97/177146397.db2.gz XBOURLSGNSOABT-WCQYABFASA-N 1 2 247.342 2.093 20 0 BEADLO C[C@@H]1[C@@H](C)CCN1c1nc(N)c2ccccc2[nH+]1 ZINC000301910278 177171688 /nfs/dbraw/zinc/17/16/88/177171688.db2.gz SBUVWBDMYMJTSR-VHSXEESVSA-N 1 2 242.326 2.447 20 0 BEADLO C[C@H]1CCc2nc(C[NH2+]CCF)sc2C1 ZINC000336761854 177210098 /nfs/dbraw/zinc/21/00/98/177210098.db2.gz NRFOJMAWIRISKS-QMMMGPOBSA-N 1 2 228.336 2.327 20 0 BEADLO C[C@H]1C[N@H+](C/C=C/c2ccccc2)CC[S@]1=O ZINC000336413373 177240623 /nfs/dbraw/zinc/24/06/23/177240623.db2.gz VLTUBPJDDGOVAV-KDQQEYKFSA-N 1 2 249.379 2.153 20 0 BEADLO C[C@H]1C[N@@H+](C/C=C/c2ccccc2)CC[S@]1=O ZINC000336413373 177240625 /nfs/dbraw/zinc/24/06/25/177240625.db2.gz VLTUBPJDDGOVAV-KDQQEYKFSA-N 1 2 249.379 2.153 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1cc(O)cc(F)c1 ZINC000184148068 177261159 /nfs/dbraw/zinc/26/11/59/177261159.db2.gz NHJXGDTVTDTMBL-ZJUUUORDSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1cc(O)cc(F)c1 ZINC000184148068 177261160 /nfs/dbraw/zinc/26/11/60/177261160.db2.gz NHJXGDTVTDTMBL-ZJUUUORDSA-N 1 2 239.290 2.141 20 0 BEADLO C[C@H]1C[N@H+](Cc2ccno2)Cc2ccccc2O1 ZINC000292407932 177268315 /nfs/dbraw/zinc/26/83/15/177268315.db2.gz LWOPVQHIBVINFN-NSHDSACASA-N 1 2 244.294 2.458 20 0 BEADLO C[C@H]1C[N@@H+](Cc2ccno2)Cc2ccccc2O1 ZINC000292407932 177268318 /nfs/dbraw/zinc/26/83/18/177268318.db2.gz LWOPVQHIBVINFN-NSHDSACASA-N 1 2 244.294 2.458 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1cn(-c2ccccc2)nn1 ZINC000336468799 177268971 /nfs/dbraw/zinc/26/89/71/177268971.db2.gz XOLHQVJNHHVQAX-NWDGAFQWSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1cn(-c2ccccc2)nn1 ZINC000336468799 177268972 /nfs/dbraw/zinc/26/89/72/177268972.db2.gz XOLHQVJNHHVQAX-NWDGAFQWSA-N 1 2 242.326 2.108 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1nc(CC(F)(F)F)no1 ZINC000339572615 177271087 /nfs/dbraw/zinc/27/10/87/177271087.db2.gz AQQCGXWFVYCIGK-NKWVEPMBSA-N 1 2 249.236 2.015 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1nc(CC(F)(F)F)no1 ZINC000339572615 177271088 /nfs/dbraw/zinc/27/10/88/177271088.db2.gz AQQCGXWFVYCIGK-NKWVEPMBSA-N 1 2 249.236 2.015 20 0 BEADLO C[C@@H](c1cnccn1)[N@@H+]1C[C@H](C)OC(C)(C)C1 ZINC000184473850 177273450 /nfs/dbraw/zinc/27/34/50/177273450.db2.gz XQKBGVJBRZUECV-QWRGUYRKSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H](c1cnccn1)[N@H+]1C[C@H](C)OC(C)(C)C1 ZINC000184473850 177273451 /nfs/dbraw/zinc/27/34/51/177273451.db2.gz XQKBGVJBRZUECV-QWRGUYRKSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@H]1COCC[C@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000277754719 177297401 /nfs/dbraw/zinc/29/74/01/177297401.db2.gz VDSKDRLTJNENMM-GXSJLCMTSA-N 1 2 233.315 2.191 20 0 BEADLO C[C@@H]1C[N@H+](Cc2ccccc2F)[C@@H](C)CO1 ZINC000253603090 177301609 /nfs/dbraw/zinc/30/16/09/177301609.db2.gz AADZLNBJILBKLJ-WDEREUQCSA-N 1 2 223.291 2.435 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2ccccc2F)[C@@H](C)CO1 ZINC000253603090 177301611 /nfs/dbraw/zinc/30/16/11/177301611.db2.gz AADZLNBJILBKLJ-WDEREUQCSA-N 1 2 223.291 2.435 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1cnn(C)c1C(F)(F)F ZINC000336582561 177319834 /nfs/dbraw/zinc/31/98/34/177319834.db2.gz HOJGQHSQIGDZQH-OCAPTIKFSA-N 1 2 247.264 2.422 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1cnn(C)c1C(F)(F)F ZINC000336582561 177319835 /nfs/dbraw/zinc/31/98/35/177319835.db2.gz HOJGQHSQIGDZQH-OCAPTIKFSA-N 1 2 247.264 2.422 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1ncn(-c2ccccc2)n1 ZINC000335756733 177360356 /nfs/dbraw/zinc/36/03/56/177360356.db2.gz BNNWQAGURUIWBT-RYUDHWBXSA-N 1 2 242.326 2.250 20 0 BEADLO C[C@H]1Cc2[nH+]cn(Cc3nccn3C)c2C[C@@H]1C ZINC000296142652 177391837 /nfs/dbraw/zinc/39/18/37/177391837.db2.gz ZVNNMBFXJHRDDP-QWRGUYRKSA-N 1 2 244.342 2.036 20 0 BEADLO CCC(CC)CNC(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000668305191 487638281 /nfs/dbraw/zinc/63/82/81/487638281.db2.gz HAGZEWRESQOBRT-LLVKDONJSA-N 1 2 249.358 2.067 20 0 BEADLO CCC(CC)CNC(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000668305191 487638285 /nfs/dbraw/zinc/63/82/85/487638285.db2.gz HAGZEWRESQOBRT-LLVKDONJSA-N 1 2 249.358 2.067 20 0 BEADLO C[C@@H]1C[C@@H](C)[C@H](C)N(C(=O)CCc2[nH]cc[nH+]2)C1 ZINC000357126874 177431878 /nfs/dbraw/zinc/43/18/78/177431878.db2.gz UDGQQUCSTLZEPR-UTUOFQBUSA-N 1 2 249.358 2.235 20 0 BEADLO CCc1[nH]c(CNC(=O)[C@H]2CC[C@H](C)C2)c[nH+]1 ZINC001652464171 1173086656 /nfs/dbraw/zinc/08/66/56/1173086656.db2.gz WRLFYKXNDJBIQS-UWVGGRQHSA-N 1 2 235.331 2.025 20 0 BEADLO CCc1[nH]cc(CNC(=O)[C@H]2CC[C@H](C)C2)[nH+]1 ZINC001652464171 1173086663 /nfs/dbraw/zinc/08/66/63/1173086663.db2.gz WRLFYKXNDJBIQS-UWVGGRQHSA-N 1 2 235.331 2.025 20 0 BEADLO Cc1ccsc1[C@H](CO)Nc1cc(C)[nH+]cn1 ZINC000487633042 225318611 /nfs/dbraw/zinc/31/86/11/225318611.db2.gz KWBMAMVMSZVKFZ-JTQLQIEISA-N 1 2 249.339 2.300 20 0 BEADLO Cc1cccc(O)c1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492812763 226058692 /nfs/dbraw/zinc/05/86/92/226058692.db2.gz NSPOTIPMJCXYII-WAYWQWQTSA-N 1 2 243.266 2.076 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)Nc1ccsc1 ZINC000492820081 226059775 /nfs/dbraw/zinc/05/97/75/226059775.db2.gz AIMCTSBGETUPIB-OWOJBTEDSA-N 1 2 219.269 2.123 20 0 BEADLO Cc1ccc(NC(=O)C=Cc2c[nH]c[nH+]2)cc1O ZINC000492861871 226070828 /nfs/dbraw/zinc/07/08/28/226070828.db2.gz KABLMYAMGWEAIC-SNAWJCMRSA-N 1 2 243.266 2.076 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)NCCC1=CCCCC1 ZINC000493067475 226117499 /nfs/dbraw/zinc/11/74/99/226117499.db2.gz AUFVXDHSPKOVMI-VOTSOKGWSA-N 1 2 245.326 2.430 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)NCC1(C2CC2)CCC1 ZINC000493159648 226142518 /nfs/dbraw/zinc/14/25/18/226142518.db2.gz RUJDJJRFFJFKCJ-SNAWJCMRSA-N 1 2 245.326 2.119 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)N1CCC[C@@H]2CCC[C@@H]21 ZINC000493273850 226172755 /nfs/dbraw/zinc/17/27/55/226172755.db2.gz ZAMDXAZERLRGFK-KZQRZKTQSA-N 1 2 245.326 2.214 20 0 BEADLO Cc1c[nH]c(C(C)(C)NC(=O)/C=C/C2CC2)[nH+]1 ZINC000493274303 226173185 /nfs/dbraw/zinc/17/31/85/226173185.db2.gz SLLUULLJYFTSIS-VOTSOKGWSA-N 1 2 233.315 2.036 20 0 BEADLO O=C(/C=C/c1[nH]cc[nH+]1)N1CC(C2CCCC2)C1 ZINC000493368805 226197859 /nfs/dbraw/zinc/19/78/59/226197859.db2.gz MSDNIOGDSBMKMU-AATRIKPKSA-N 1 2 245.326 2.072 20 0 BEADLO C[C@H]1CN(C(=O)/C=C/c2[nH]cc[nH+]2)C(C)(C)C1 ZINC000493393879 226204332 /nfs/dbraw/zinc/20/43/32/226204332.db2.gz WDBUIGJIVAFTKQ-ORAHPGNNSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@@H]1CCCCCN1C(=O)/C=C\c1[nH]cc[nH+]1 ZINC000493609627 226245816 /nfs/dbraw/zinc/24/58/16/226245816.db2.gz IBZBBZHQZAEQDZ-JMEBYUIHSA-N 1 2 233.315 2.214 20 0 BEADLO C[C@H](CC(C)(C)C)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493663642 226248282 /nfs/dbraw/zinc/24/82/82/226248282.db2.gz YFUSNQLCBGDKTG-WWQCOOJYSA-N 1 2 235.331 2.364 20 0 BEADLO C[C@@H]1C[C@H](C)[C@@H](C)N(C(=O)/C=C\c2[nH]cc[nH+]2)C1 ZINC000493697463 226249778 /nfs/dbraw/zinc/24/97/78/226249778.db2.gz VIXCIVUXZRBQOU-DKLPLTIYSA-N 1 2 247.342 2.316 20 0 BEADLO CN(C(=O)/C=C/c1[nH]cc[nH+]1)C1CC(C)(C)C1 ZINC000493812706 226255290 /nfs/dbraw/zinc/25/52/90/226255290.db2.gz CHZREXRWMMJVTF-SNAWJCMRSA-N 1 2 233.315 2.070 20 0 BEADLO C[C@H](C1CC1)n1cc(NCc2[nH+]ccn2C)cn1 ZINC000494477539 226265546 /nfs/dbraw/zinc/26/55/46/226265546.db2.gz QXWKOEXIGYCCBL-SNVBAGLBSA-N 1 2 245.330 2.200 20 0 BEADLO FC(F)C[N@H+](C[C@H]1CCSC1)C1CC1 ZINC000494946494 226272094 /nfs/dbraw/zinc/27/20/94/226272094.db2.gz IIBAWBPMLZGNFR-MRVPVSSYSA-N 1 2 221.316 2.469 20 0 BEADLO FC(F)C[N@@H+](C[C@H]1CCSC1)C1CC1 ZINC000494946494 226272095 /nfs/dbraw/zinc/27/20/95/226272095.db2.gz IIBAWBPMLZGNFR-MRVPVSSYSA-N 1 2 221.316 2.469 20 0 BEADLO COc1ccccc1C[NH2+][C@H](C)C(F)F ZINC000228478311 487655142 /nfs/dbraw/zinc/65/51/42/487655142.db2.gz PZLZFKASFOTTJZ-MRVPVSSYSA-N 1 2 215.243 2.438 20 0 BEADLO CCCC(C)(C)c1nc(Cc2c[nH+]cn2C)no1 ZINC000351421107 487660408 /nfs/dbraw/zinc/66/04/08/487660408.db2.gz GHUDYKUXTANOMX-UHFFFAOYSA-N 1 2 248.330 2.472 20 0 BEADLO Cn1cc[nH+]c1CSC1(CO)CCCCC1 ZINC000312979774 322939241 /nfs/dbraw/zinc/93/92/41/322939241.db2.gz GNJGYVYIKYVGBP-UHFFFAOYSA-N 1 2 240.372 2.349 20 0 BEADLO Cc1ccncc1C[NH2+][C@@H](C)C(F)F ZINC000228522767 487671091 /nfs/dbraw/zinc/67/10/91/487671091.db2.gz HLJUUFJSHOCAFU-QMMMGPOBSA-N 1 2 200.232 2.133 20 0 BEADLO O=C(Nc1ccsc1)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000668858928 487672861 /nfs/dbraw/zinc/67/28/61/487672861.db2.gz RWAXEALOADSLSM-MRVPVSSYSA-N 1 2 247.323 2.215 20 0 BEADLO O=C(Nc1ccsc1)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000668858928 487672865 /nfs/dbraw/zinc/67/28/65/487672865.db2.gz RWAXEALOADSLSM-MRVPVSSYSA-N 1 2 247.323 2.215 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]CCOCC1CCC1 ZINC000680938033 487675712 /nfs/dbraw/zinc/67/57/12/487675712.db2.gz IYLPVSBTQLXDHU-SNVBAGLBSA-N 1 2 237.347 2.185 20 0 BEADLO CC(C)CCCNC(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000666153476 487686502 /nfs/dbraw/zinc/68/65/02/487686502.db2.gz AEGJDLDOJCEMBZ-NSHDSACASA-N 1 2 249.358 2.067 20 0 BEADLO CC(C)CCCNC(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000666153476 487686505 /nfs/dbraw/zinc/68/65/05/487686505.db2.gz AEGJDLDOJCEMBZ-NSHDSACASA-N 1 2 249.358 2.067 20 0 BEADLO CCC(C)(CC)C(=O)N1CCn2cc(C)[nH+]c2C1 ZINC000681002083 487692462 /nfs/dbraw/zinc/69/24/62/487692462.db2.gz UWWHZAKHTLFLKM-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO COCc1cnc(C[N@H+]2[C@H](C)C[C@@H]2C)s1 ZINC000526989442 262801961 /nfs/dbraw/zinc/80/19/61/262801961.db2.gz CDUTXOZRXXGCGG-DTORHVGOSA-N 1 2 226.345 2.272 20 0 BEADLO COCc1cnc(C[N@@H+]2[C@H](C)C[C@@H]2C)s1 ZINC000526989442 262801962 /nfs/dbraw/zinc/80/19/62/262801962.db2.gz CDUTXOZRXXGCGG-DTORHVGOSA-N 1 2 226.345 2.272 20 0 BEADLO Cc1cc(NC[C@H](C)CC(F)(F)F)nc[nH+]1 ZINC000397024104 262832037 /nfs/dbraw/zinc/83/20/37/262832037.db2.gz UJRTVYZJFMIATN-SSDOTTSWSA-N 1 2 233.237 2.207 20 0 BEADLO c1cn2c([nH+]1)[C@H](Nc1cccc3c1OCC3)CC2 ZINC000527960271 262900207 /nfs/dbraw/zinc/90/02/07/262900207.db2.gz XQLNTPYUHYMQMU-GFCCVEGCSA-N 1 2 241.294 2.375 20 0 BEADLO COc1ccc(N[C@@H](C)c2cc(C)n(C)n2)[nH+]c1 ZINC000669702917 487699851 /nfs/dbraw/zinc/69/98/51/487699851.db2.gz WOMQIWKKWLHVRI-JTQLQIEISA-N 1 2 246.314 2.305 20 0 BEADLO CCC(C)(CC)C(=O)N(C)Cc1[nH]cc[nH+]1 ZINC000681043975 487704355 /nfs/dbraw/zinc/70/43/55/487704355.db2.gz FYIQFOIXKHETSZ-UHFFFAOYSA-N 1 2 223.320 2.194 20 0 BEADLO Cc1cc([C@@H](C)N[C@H](C)c2[nH+]ccn2C)no1 ZINC000669706426 487706175 /nfs/dbraw/zinc/70/61/75/487706175.db2.gz DOBFMRWUEPTSTL-NXEZZACHSA-N 1 2 234.303 2.128 20 0 BEADLO C[C@H](c1ccccn1)[N@H+](C)Cc1cn(C)cn1 ZINC000683900377 487710806 /nfs/dbraw/zinc/71/08/06/487710806.db2.gz VCBYIAQNKRVUAF-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1cn(C)cn1 ZINC000683900377 487710809 /nfs/dbraw/zinc/71/08/09/487710809.db2.gz VCBYIAQNKRVUAF-LLVKDONJSA-N 1 2 230.315 2.008 20 0 BEADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC=CCC1 ZINC000672760767 487712321 /nfs/dbraw/zinc/71/23/21/487712321.db2.gz LSQOHTYYJXEQKI-UHFFFAOYSA-N 1 2 231.299 2.492 20 0 BEADLO CCOC1CC2(C1)CC[N@H+](CC(F)F)C2 ZINC000671730802 487712235 /nfs/dbraw/zinc/71/22/35/487712235.db2.gz RHEUEDICQPCHNP-UHFFFAOYSA-N 1 2 219.275 2.143 20 0 BEADLO CCOC1CC2(C1)CC[N@@H+](CC(F)F)C2 ZINC000671730802 487712238 /nfs/dbraw/zinc/71/22/38/487712238.db2.gz RHEUEDICQPCHNP-UHFFFAOYSA-N 1 2 219.275 2.143 20 0 BEADLO COc1cccc(C[N@@H+]2CCOC[C@H]2C)c1F ZINC000669713464 487717010 /nfs/dbraw/zinc/71/70/10/487717010.db2.gz ZQBABJFCWQWTAJ-SNVBAGLBSA-N 1 2 239.290 2.055 20 0 BEADLO COc1cccc(C[N@H+]2CCOC[C@H]2C)c1F ZINC000669713464 487717015 /nfs/dbraw/zinc/71/70/15/487717015.db2.gz ZQBABJFCWQWTAJ-SNVBAGLBSA-N 1 2 239.290 2.055 20 0 BEADLO c1csc(C[N@@H+]2CCC[C@H](n3ccnc3)C2)n1 ZINC000676714723 487723993 /nfs/dbraw/zinc/72/39/93/487723993.db2.gz OQAUYOUZWLQTAT-NSHDSACASA-N 1 2 248.355 2.177 20 0 BEADLO c1csc(C[N@H+]2CCC[C@H](n3ccnc3)C2)n1 ZINC000676714723 487723995 /nfs/dbraw/zinc/72/39/95/487723995.db2.gz OQAUYOUZWLQTAT-NSHDSACASA-N 1 2 248.355 2.177 20 0 BEADLO CC1(C(=O)Nc2ccc3[nH+]ccn3c2)CC1 ZINC000675453453 487733601 /nfs/dbraw/zinc/73/36/01/487733601.db2.gz RULUIVRKTDCSEA-UHFFFAOYSA-N 1 2 215.256 2.073 20 0 BEADLO CC(C)n1ncnc1C[NH2+]Cc1ccc(F)cc1 ZINC000088588679 487737718 /nfs/dbraw/zinc/73/77/18/487737718.db2.gz XCEUVXGTTQUNSM-UHFFFAOYSA-N 1 2 248.305 2.288 20 0 BEADLO CCC(C)(C)N(C)C(=O)[C@H]1CCc2c[nH+]cn2C1 ZINC000668900535 487739267 /nfs/dbraw/zinc/73/92/67/487739267.db2.gz SUKSJLOWEHMHQQ-NSHDSACASA-N 1 2 249.358 2.093 20 0 BEADLO CCN(CC(C)C)C(=O)[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000666182727 487748775 /nfs/dbraw/zinc/74/87/75/487748775.db2.gz KBRSXVYJBFHBBY-NSHDSACASA-N 1 2 249.358 2.019 20 0 BEADLO CCN(CC(C)C)C(=O)[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000666182727 487748782 /nfs/dbraw/zinc/74/87/82/487748782.db2.gz KBRSXVYJBFHBBY-NSHDSACASA-N 1 2 249.358 2.019 20 0 BEADLO CCc1cc(N[C@H](CC)[C@@H](O)C(C)C)nc[nH+]1 ZINC000665749170 487754866 /nfs/dbraw/zinc/75/48/66/487754866.db2.gz TXOXHPZCEPVNAM-YPMHNXCESA-N 1 2 237.347 2.246 20 0 BEADLO CC[C@H]1[C@@H](C)CCN1C(=O)CCCn1cc[nH+]c1 ZINC000681264604 487763888 /nfs/dbraw/zinc/76/38/88/487763888.db2.gz ZFRZRFPFEKDJCE-STQMWFEESA-N 1 2 249.358 2.310 20 0 BEADLO Cc1csc([C@@H](C)[NH2+]Cc2[nH]ncc2C)n1 ZINC000336777281 487778875 /nfs/dbraw/zinc/77/88/75/487778875.db2.gz HYXGCPWNPLUIJD-SECBINFHSA-N 1 2 236.344 2.334 20 0 BEADLO Cc1csc([C@@H](C)[NH2+]Cc2n[nH]cc2C)n1 ZINC000336777281 487778883 /nfs/dbraw/zinc/77/88/83/487778883.db2.gz HYXGCPWNPLUIJD-SECBINFHSA-N 1 2 236.344 2.334 20 0 BEADLO CC(C)C[C@H](C)C(=O)Nc1cc[nH+]cc1N(C)C ZINC000681363692 487784966 /nfs/dbraw/zinc/78/49/66/487784966.db2.gz UXORLKRKSGFJBR-NSHDSACASA-N 1 2 249.358 2.190 20 0 BEADLO Cc1cc(CN2CCCC[C@@H]2c2[nH]cc[nH+]2)on1 ZINC000675893209 487788263 /nfs/dbraw/zinc/78/82/63/487788263.db2.gz AUMYUWXKZMWRAJ-GFCCVEGCSA-N 1 2 246.314 2.433 20 0 BEADLO Clc1cc(NCCCn2cc[nH+]c2)ccn1 ZINC000091424999 487792327 /nfs/dbraw/zinc/79/23/27/487792327.db2.gz LUFKDEAQJBHKJD-UHFFFAOYSA-N 1 2 236.706 2.434 20 0 BEADLO COc1cccc2c1CC[C@@H]2[NH2+]Cc1ccon1 ZINC000675926181 487792131 /nfs/dbraw/zinc/79/21/31/487792131.db2.gz SMZJMZSVGJKSDG-ZDUSSCGKSA-N 1 2 244.294 2.460 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N[C@]1(C)CC1(C)C ZINC000666493899 487821512 /nfs/dbraw/zinc/82/15/12/487821512.db2.gz NZUXRWZUMXBDHX-CYBMUJFWSA-N 1 2 233.315 2.122 20 0 BEADLO CC(C)C[C@H](C)C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819778063 586993028 /nfs/dbraw/zinc/99/30/28/586993028.db2.gz XYWJIUALNNZCOO-DTWKUNHWSA-N 1 2 228.361 2.276 20 0 BEADLO C[NH2+]Cc1noc([C@H]2[C@H](C=C(C)C)C2(C)C)n1 ZINC000666572905 487833226 /nfs/dbraw/zinc/83/32/26/487833226.db2.gz VCECYPSHNFZPHI-GXSJLCMTSA-N 1 2 235.331 2.495 20 0 BEADLO CCc1cc(NC[C@@H]2CCC(C)(C)O2)nc[nH+]1 ZINC000681675186 487839248 /nfs/dbraw/zinc/83/92/48/487839248.db2.gz YKSOLHXFKXLQIY-NSHDSACASA-N 1 2 235.331 2.409 20 0 BEADLO O=C(NCc1c[nH+]c[nH]1)C1[C@@H]2CCCCCC[C@@H]12 ZINC000668996334 487844873 /nfs/dbraw/zinc/84/48/73/487844873.db2.gz YUVUHDOLKNCKQA-VXGBXAGGSA-N 1 2 247.342 2.242 20 0 BEADLO O=C(NCc1c[nH]c[nH+]1)C1[C@@H]2CCCCCC[C@@H]12 ZINC000668996334 487844878 /nfs/dbraw/zinc/84/48/78/487844878.db2.gz YUVUHDOLKNCKQA-VXGBXAGGSA-N 1 2 247.342 2.242 20 0 BEADLO COc1cncc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)c1 ZINC000676437029 487851229 /nfs/dbraw/zinc/85/12/29/487851229.db2.gz YCQMUQZVYAFQCL-GXFFZTMASA-N 1 2 238.306 2.270 20 0 BEADLO COc1cncc(C[N@H+]2CC[C@H](C)[C@H](F)C2)c1 ZINC000676437029 487851237 /nfs/dbraw/zinc/85/12/37/487851237.db2.gz YCQMUQZVYAFQCL-GXFFZTMASA-N 1 2 238.306 2.270 20 0 BEADLO Cn1cc[nH+]c1[C@H]1CCCN(C(=O)C(C)(C)C)C1 ZINC000373071032 487857193 /nfs/dbraw/zinc/85/71/93/487857193.db2.gz QMQFJCAWCUPHLV-NSHDSACASA-N 1 2 249.358 2.172 20 0 BEADLO FCCCCC[N@@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000671241014 487873524 /nfs/dbraw/zinc/87/35/24/487873524.db2.gz PBVGJGDRAWBAPD-SECBINFHSA-N 1 2 243.244 2.389 20 0 BEADLO FCCCCC[N@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000671241014 487873527 /nfs/dbraw/zinc/87/35/27/487873527.db2.gz PBVGJGDRAWBAPD-SECBINFHSA-N 1 2 243.244 2.389 20 0 BEADLO CCNc1nc(C)[nH+]c(C)c1Br ZINC000085459363 487873170 /nfs/dbraw/zinc/87/31/70/487873170.db2.gz AECRRVDNCSIVBJ-UHFFFAOYSA-N 1 2 230.109 2.288 20 0 BEADLO Cn1ncc(C2CCC2)c1C[N@@H+]1CC[C@H](F)C1 ZINC000668213481 487877295 /nfs/dbraw/zinc/87/72/95/487877295.db2.gz BWWXZGXORMYQNN-NSHDSACASA-N 1 2 237.322 2.231 20 0 BEADLO Cn1ncc(C2CCC2)c1C[N@H+]1CC[C@H](F)C1 ZINC000668213481 487877301 /nfs/dbraw/zinc/87/73/01/487877301.db2.gz BWWXZGXORMYQNN-NSHDSACASA-N 1 2 237.322 2.231 20 0 BEADLO FC(F)c1csc(Cn2cc[nH+]c2)n1 ZINC000663220983 487877625 /nfs/dbraw/zinc/87/76/25/487877625.db2.gz XRUVIKDZPCRJNI-UHFFFAOYSA-N 1 2 215.228 2.326 20 0 BEADLO Cc1cc(NC(=O)[C@H]2CC23CCC3)c(C)c[nH+]1 ZINC000676588129 487877534 /nfs/dbraw/zinc/87/75/34/487877534.db2.gz PPKBWEDDJKSHEE-LLVKDONJSA-N 1 2 230.311 2.249 20 0 BEADLO CC/C=C\CC[N@@H+]1CC(F)(F)C[C@H]1CO ZINC000682032997 487885581 /nfs/dbraw/zinc/88/55/81/487885581.db2.gz KPWQWWHMKWZMIG-XOULXFPDSA-N 1 2 219.275 2.045 20 0 BEADLO CC/C=C\CC[N@H+]1CC(F)(F)C[C@H]1CO ZINC000682032997 487885584 /nfs/dbraw/zinc/88/55/84/487885584.db2.gz KPWQWWHMKWZMIG-XOULXFPDSA-N 1 2 219.275 2.045 20 0 BEADLO C[C@H](NC(=O)CCn1cc[nH+]c1)c1ccsc1 ZINC000669861910 487894150 /nfs/dbraw/zinc/89/41/50/487894150.db2.gz UEFHTCPVFPHFPF-JTQLQIEISA-N 1 2 249.339 2.212 20 0 BEADLO CC(C)n1ccnc1C[N@@H+]1CCCOC[C@@H]1C ZINC000676712672 487900352 /nfs/dbraw/zinc/90/03/52/487900352.db2.gz LLXHZFBWKNISSM-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO CC(C)n1ccnc1C[N@H+]1CCCOC[C@@H]1C ZINC000676712672 487900356 /nfs/dbraw/zinc/90/03/56/487900356.db2.gz LLXHZFBWKNISSM-LBPRGKRZSA-N 1 2 237.347 2.075 20 0 BEADLO Cc1nc(C[N@H+]2CCCOC[C@@H]2C)cs1 ZINC000676715126 487904239 /nfs/dbraw/zinc/90/42/39/487904239.db2.gz YWXUARHKSGIPHE-VIFPVBQESA-N 1 2 226.345 2.062 20 0 BEADLO Cc1nc(C[N@@H+]2CCCOC[C@@H]2C)cs1 ZINC000676715126 487904240 /nfs/dbraw/zinc/90/42/40/487904240.db2.gz YWXUARHKSGIPHE-VIFPVBQESA-N 1 2 226.345 2.062 20 0 BEADLO CC(C)n1ccc(C[N@H+]2CC=CCC2)n1 ZINC000679324504 487905506 /nfs/dbraw/zinc/90/55/06/487905506.db2.gz UVJFTANXQHDMMS-UHFFFAOYSA-N 1 2 205.305 2.226 20 0 BEADLO CC(C)n1ccc(C[N@@H+]2CC=CCC2)n1 ZINC000679324504 487905511 /nfs/dbraw/zinc/90/55/11/487905511.db2.gz UVJFTANXQHDMMS-UHFFFAOYSA-N 1 2 205.305 2.226 20 0 BEADLO CC(C)C(C)(C)NC(=O)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000652764817 487907445 /nfs/dbraw/zinc/90/74/45/487907445.db2.gz QBFSQMQUHXONEV-SNVBAGLBSA-N 1 2 249.358 2.380 20 0 BEADLO CC(C)C(C)(C)NC(=O)[C@@H]1CCCc2[nH]c[nH+]c21 ZINC000652764817 487907450 /nfs/dbraw/zinc/90/74/50/487907450.db2.gz QBFSQMQUHXONEV-SNVBAGLBSA-N 1 2 249.358 2.380 20 0 BEADLO CCc1ccc(C[N@H+](CC(=O)OC)C(C)C)o1 ZINC000093287137 487909828 /nfs/dbraw/zinc/90/98/28/487909828.db2.gz DPGNAWXYEWYDMX-UHFFFAOYSA-N 1 2 239.315 2.225 20 0 BEADLO CCc1ccc(C[N@@H+](CC(=O)OC)C(C)C)o1 ZINC000093287137 487909834 /nfs/dbraw/zinc/90/98/34/487909834.db2.gz DPGNAWXYEWYDMX-UHFFFAOYSA-N 1 2 239.315 2.225 20 0 BEADLO C[N@H+](Cc1ccon1)Cc1ccc(O)cc1 ZINC000682404421 487944654 /nfs/dbraw/zinc/94/46/54/487944654.db2.gz FTMJYFUCMLNPTH-UHFFFAOYSA-N 1 2 218.256 2.012 20 0 BEADLO C[N@@H+](Cc1ccon1)Cc1ccc(O)cc1 ZINC000682404421 487944659 /nfs/dbraw/zinc/94/46/59/487944659.db2.gz FTMJYFUCMLNPTH-UHFFFAOYSA-N 1 2 218.256 2.012 20 0 BEADLO CCC(C)(C)NC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000556687833 322919559 /nfs/dbraw/zinc/91/95/59/322919559.db2.gz FSSIERCDRYWHBA-JTQLQIEISA-N 1 2 223.320 2.139 20 0 BEADLO CSCc1cnc(CNc2c[nH]c[nH+]2)s1 ZINC000556853859 322929074 /nfs/dbraw/zinc/92/90/74/322929074.db2.gz XARFYMPFIGJSNY-UHFFFAOYSA-N 1 2 240.357 2.341 20 0 BEADLO CCc1nc(N2C3CCC2CC3)cc(C)[nH+]1 ZINC000557475438 322937911 /nfs/dbraw/zinc/93/79/11/322937911.db2.gz GMPPYQZQKQTZBA-UHFFFAOYSA-N 1 2 217.316 2.479 20 0 BEADLO C[NH2+]Cc1noc([C@H]2CCCC[C@H]2C2CC2)n1 ZINC000564958326 322981052 /nfs/dbraw/zinc/98/10/52/322981052.db2.gz ZXZMKJXPVZYGPL-QWRGUYRKSA-N 1 2 235.331 2.473 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)NC1(C2CCC2)CCC1 ZINC000560509956 322988918 /nfs/dbraw/zinc/98/89/18/322988918.db2.gz WFYHYMARBJAHCX-UHFFFAOYSA-N 1 2 247.342 2.181 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCSC[C@@H](C)C1 ZINC000566484773 323001489 /nfs/dbraw/zinc/00/14/89/323001489.db2.gz SGYNFVDAAOFDHU-VIFPVBQESA-N 1 2 237.372 2.283 20 0 BEADLO C[C@@H](C1CC1)[N@H+](C)Cc1nn(C)cc1Cl ZINC000561469394 323002267 /nfs/dbraw/zinc/00/22/67/323002267.db2.gz FVYJAZIDVGDERK-QMMMGPOBSA-N 1 2 227.739 2.304 20 0 BEADLO C[C@@H](C1CC1)[N@@H+](C)Cc1nn(C)cc1Cl ZINC000561469394 323002268 /nfs/dbraw/zinc/00/22/68/323002268.db2.gz FVYJAZIDVGDERK-QMMMGPOBSA-N 1 2 227.739 2.304 20 0 BEADLO COc1cc(C)ccc1C[NH2+]Cc1cc[nH]n1 ZINC000151043245 323006495 /nfs/dbraw/zinc/00/64/95/323006495.db2.gz OEJXCCVVLIORKJ-UHFFFAOYSA-N 1 2 231.299 2.017 20 0 BEADLO CCn1cc[nH+]c1CNc1cncc(F)c1 ZINC000300968721 323007167 /nfs/dbraw/zinc/00/71/67/323007167.db2.gz WNQHDELRWCQDFJ-UHFFFAOYSA-N 1 2 220.251 2.049 20 0 BEADLO CC(C)CN(C(=O)Cn1cc[nH+]c1)C1CCCC1 ZINC000561825670 323007594 /nfs/dbraw/zinc/00/75/94/323007594.db2.gz GIHOHDIBLCMEPZ-UHFFFAOYSA-N 1 2 249.358 2.310 20 0 BEADLO CCCc1occc1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000562027709 323010776 /nfs/dbraw/zinc/01/07/76/323010776.db2.gz UTQGFAMZSYHIEL-SECBINFHSA-N 1 2 247.298 2.446 20 0 BEADLO Cc1c[nH+]c(C)nc1N(C)CCc1ccncc1 ZINC000562126742 323012340 /nfs/dbraw/zinc/01/23/40/323012340.db2.gz UBJZWGOWXDYYBU-UHFFFAOYSA-N 1 2 242.326 2.167 20 0 BEADLO CC(C)(NC(=O)C1=CCCCC1)c1[nH]cc[nH+]1 ZINC000565106469 323021606 /nfs/dbraw/zinc/02/16/06/323021606.db2.gz PIWVPBRNMNUAQZ-UHFFFAOYSA-N 1 2 233.315 2.261 20 0 BEADLO CC1(C)CCCC[C@H]1C(=O)Nc1cc[nH+]cc1O ZINC000562495489 323021867 /nfs/dbraw/zinc/02/18/67/323021867.db2.gz NOKWYIRASNZRHY-JTQLQIEISA-N 1 2 248.326 2.364 20 0 BEADLO C[C@@H](c1csnn1)[NH+]1C[C@@H](C)S[C@H](C)C1 ZINC000562533372 323023099 /nfs/dbraw/zinc/02/30/99/323023099.db2.gz PSNKLLICJBYGDS-HLTSFMKQSA-N 1 2 243.401 2.425 20 0 BEADLO CCC[C@H](NC(=O)Cc1c[nH+]cn1C)C1CCC1 ZINC000562660873 323026716 /nfs/dbraw/zinc/02/67/16/323026716.db2.gz XWBSLGNXXZBMNJ-ZDUSSCGKSA-N 1 2 249.358 2.048 20 0 BEADLO c1csc(CNc2cc(NC3CC3)[nH+]cn2)n1 ZINC000562721846 323029100 /nfs/dbraw/zinc/02/91/00/323029100.db2.gz QRQJLIMNGVSAJG-UHFFFAOYSA-N 1 2 247.327 2.120 20 0 BEADLO c1csc(CNc2cc(NC3CC3)nc[nH+]2)n1 ZINC000562721846 323029101 /nfs/dbraw/zinc/02/91/01/323029101.db2.gz QRQJLIMNGVSAJG-UHFFFAOYSA-N 1 2 247.327 2.120 20 0 BEADLO Fc1ccc([C@H]([NH2+]C2CCC2)c2cnn[nH]2)cc1 ZINC000562779591 323030523 /nfs/dbraw/zinc/03/05/23/323030523.db2.gz DLNCNTRRTWFFAX-ZDUSSCGKSA-N 1 2 246.289 2.175 20 0 BEADLO Fc1ccc([C@H]([NH2+]C2CCC2)c2cn[nH]n2)cc1 ZINC000562779591 323030524 /nfs/dbraw/zinc/03/05/24/323030524.db2.gz DLNCNTRRTWFFAX-ZDUSSCGKSA-N 1 2 246.289 2.175 20 0 BEADLO CC[C@@]1(C(C)C)C[C@@H]1NC(=O)CCc1c[nH+]c[nH]1 ZINC000562962524 323036529 /nfs/dbraw/zinc/03/65/29/323036529.db2.gz UNOCZVPKVGMABD-JSGCOSHPSA-N 1 2 249.358 2.283 20 0 BEADLO CC[C@@]1(C(C)C)C[C@@H]1NC(=O)CCc1c[nH]c[nH+]1 ZINC000562962524 323036530 /nfs/dbraw/zinc/03/65/30/323036530.db2.gz UNOCZVPKVGMABD-JSGCOSHPSA-N 1 2 249.358 2.283 20 0 BEADLO Cc1c[nH+]c2cc(C(=O)N[C@H]3CC3(C)C)ccn12 ZINC000569987028 323046548 /nfs/dbraw/zinc/04/65/48/323046548.db2.gz NDJKVUWDEAJMIO-NSHDSACASA-N 1 2 243.310 2.171 20 0 BEADLO Cc1csc(C[N@@H+]2CCC[C@H](F)C2)n1 ZINC000570051668 323048842 /nfs/dbraw/zinc/04/88/42/323048842.db2.gz XANKHCVMOQAKTD-VIFPVBQESA-N 1 2 214.309 2.385 20 0 BEADLO Cc1csc(C[N@H+]2CCC[C@H](F)C2)n1 ZINC000570051668 323048843 /nfs/dbraw/zinc/04/88/43/323048843.db2.gz XANKHCVMOQAKTD-VIFPVBQESA-N 1 2 214.309 2.385 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000570051537 323048930 /nfs/dbraw/zinc/04/89/30/323048930.db2.gz ZOIBNECCFSNEGF-MBNYWOFBSA-N 1 2 249.358 2.385 20 0 BEADLO CCC[N@@H+]1CC(=O)N[C@@H]1[C@@H]1CCCC(C)(C)C1 ZINC000570301092 323055728 /nfs/dbraw/zinc/05/57/28/323055728.db2.gz ZKBGQDKLKSBXIA-YPMHNXCESA-N 1 2 238.375 2.371 20 0 BEADLO CCC[N@H+]1CC(=O)N[C@@H]1[C@@H]1CCCC(C)(C)C1 ZINC000570301092 323055729 /nfs/dbraw/zinc/05/57/29/323055729.db2.gz ZKBGQDKLKSBXIA-YPMHNXCESA-N 1 2 238.375 2.371 20 0 BEADLO CCc1ccc(C[N@H+]2CCN(C)C[C@@H]2CC)nc1 ZINC000570391567 323058214 /nfs/dbraw/zinc/05/82/14/323058214.db2.gz BCWOBADPOZKASD-HNNXBMFYSA-N 1 2 247.386 2.170 20 0 BEADLO CCc1ccc(C[N@@H+]2CCN(C)C[C@@H]2CC)nc1 ZINC000570391567 323058215 /nfs/dbraw/zinc/05/82/15/323058215.db2.gz BCWOBADPOZKASD-HNNXBMFYSA-N 1 2 247.386 2.170 20 0 BEADLO CC[C@H]1CN(c2nc(C)[nH+]cc2C)C[C@@H](C)O1 ZINC000570408948 323058841 /nfs/dbraw/zinc/05/88/41/323058841.db2.gz CMAFAGGRGQYNOD-PWSUYJOCSA-N 1 2 235.331 2.097 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)N(C)c1ccccc1 ZINC000570469419 323060516 /nfs/dbraw/zinc/06/05/16/323060516.db2.gz DFHQTJCFVMXEGL-UHFFFAOYSA-N 1 2 241.294 2.480 20 0 BEADLO Cc1c[nH+]c(C)nc1N1CCOCC2(CCC2)C1 ZINC000573020644 323061986 /nfs/dbraw/zinc/06/19/86/323061986.db2.gz RDGJQPOUUAJPTO-UHFFFAOYSA-N 1 2 247.342 2.100 20 0 BEADLO C[C@@H](CC(=O)NC[C@@H]1CC[C@@H](C)C1)n1cc[nH+]c1 ZINC000572648479 323062691 /nfs/dbraw/zinc/06/26/91/323062691.db2.gz FUUFZTORPGGHCC-FRRDWIJNSA-N 1 2 249.358 2.387 20 0 BEADLO Cc1cc2ccccc2[nH+]c1N1CC(C)(CO)C1 ZINC000570642022 323065763 /nfs/dbraw/zinc/06/57/63/323065763.db2.gz FDWUJEOXINEAMD-UHFFFAOYSA-N 1 2 242.322 2.362 20 0 BEADLO FC(F)(F)CC[NH+]1CC(C(F)(F)F)C1 ZINC000570668129 323066534 /nfs/dbraw/zinc/06/65/34/323066534.db2.gz NZMDJGKYDOQACL-UHFFFAOYSA-N 1 2 221.144 2.433 20 0 BEADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2cccc(O)c2)o1 ZINC000181542938 323079021 /nfs/dbraw/zinc/07/90/21/323079021.db2.gz HTLYEHQNZFDMBL-RKDXNWHRSA-N 1 2 247.298 2.495 20 0 BEADLO O=C(CCC1CCC1)NCCCCn1cc[nH+]c1 ZINC000531396655 323088683 /nfs/dbraw/zinc/08/86/83/323088683.db2.gz PYRWLWHGSJXOCM-UHFFFAOYSA-N 1 2 249.358 2.360 20 0 BEADLO C[C@@H](CC(=O)N(C)[C@@H](C)C1(C)CC1)n1cc[nH+]c1 ZINC000563216215 323103189 /nfs/dbraw/zinc/10/31/89/323103189.db2.gz GPEIEHRNEZAXGD-RYUDHWBXSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@H](CC(=O)N[C@H]1CCC1(C)C)n1cc[nH+]c1 ZINC000563220185 323104630 /nfs/dbraw/zinc/10/46/30/323104630.db2.gz GYFBEGPYYGBKNE-MNOVXSKESA-N 1 2 235.331 2.139 20 0 BEADLO C[C@H](CC(=O)N(C)C1CC(C)(C)C1)n1cc[nH+]c1 ZINC000563221880 323104756 /nfs/dbraw/zinc/10/47/56/323104756.db2.gz PDIBRWDKFGZPDH-LLVKDONJSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@H]1CCCC[C@H]1C ZINC000565434108 323107016 /nfs/dbraw/zinc/10/70/16/323107016.db2.gz SVSZOBQJUSYBQL-WZRBSPASSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@H]1CCCC[C@H]1C ZINC000565434108 323107017 /nfs/dbraw/zinc/10/70/17/323107017.db2.gz SVSZOBQJUSYBQL-WZRBSPASSA-N 1 2 249.358 2.283 20 0 BEADLO CCC[C@@H](CC)Nc1nc(N)c2ccccc2[nH+]1 ZINC000534272738 323115396 /nfs/dbraw/zinc/11/53/96/323115396.db2.gz OCHXFWFIZIIKPP-SNVBAGLBSA-N 1 2 244.342 2.455 20 0 BEADLO Cc1cc(NC(=O)c2cccnc2C)c(C)c[nH+]1 ZINC000534299872 323115832 /nfs/dbraw/zinc/11/58/32/323115832.db2.gz HDWPGKPEOJBYML-UHFFFAOYSA-N 1 2 241.294 2.076 20 0 BEADLO Cc1cc(NC(=O)Cc2cccs2)c(C)c[nH+]1 ZINC000534299875 323115932 /nfs/dbraw/zinc/11/59/32/323115932.db2.gz HHBBPAGLMPUZFZ-UHFFFAOYSA-N 1 2 246.335 2.363 20 0 BEADLO CC[C@H](C)NC(=O)Nc1cc(C)[nH+]cc1C ZINC000534323698 323116481 /nfs/dbraw/zinc/11/64/81/323116481.db2.gz AVROTJYQPIGYEN-VIFPVBQESA-N 1 2 221.304 2.040 20 0 BEADLO Cc1cc(NC(=O)NC2(C)CCC2)c(C)c[nH+]1 ZINC000534323658 323116490 /nfs/dbraw/zinc/11/64/90/323116490.db2.gz VRIMNEUUUYNMEC-UHFFFAOYSA-N 1 2 233.315 2.184 20 0 BEADLO CCCN(C(=O)[C@@H]1CCn2c[nH+]cc2C1)C(C)C ZINC000563407889 323122368 /nfs/dbraw/zinc/12/23/68/323122368.db2.gz LOEVBCASYBGOCS-GFCCVEGCSA-N 1 2 249.358 2.093 20 0 BEADLO Cc1c[nH+]c(C)nc1N[C@@H]1C[C@H]1C1CC1 ZINC000563425492 323126063 /nfs/dbraw/zinc/12/60/63/323126063.db2.gz CTVUNHJANQXOMX-WDEREUQCSA-N 1 2 203.289 2.304 20 0 BEADLO Cn1cc(C[N@@H+]2CCC[C@H](F)C2)c(C(F)F)n1 ZINC000571172179 323137552 /nfs/dbraw/zinc/13/75/52/323137552.db2.gz PFXKRKBHGGKJEJ-VIFPVBQESA-N 1 2 247.264 2.292 20 0 BEADLO Cn1cc(C[N@H+]2CCC[C@H](F)C2)c(C(F)F)n1 ZINC000571172179 323137553 /nfs/dbraw/zinc/13/75/53/323137553.db2.gz PFXKRKBHGGKJEJ-VIFPVBQESA-N 1 2 247.264 2.292 20 0 BEADLO O=C(Cn1cc[nH+]c1)N1CCCC2(CCCC2)C1 ZINC000571462988 323145382 /nfs/dbraw/zinc/14/53/82/323145382.db2.gz GSJUTMCAOBVEPN-UHFFFAOYSA-N 1 2 247.342 2.066 20 0 BEADLO CC[C@H](O)C[NH2+]CC(F)(F)c1ccccc1 ZINC000161177860 323150095 /nfs/dbraw/zinc/15/00/95/323150095.db2.gz ZVGRZWDUWLZUIW-NSHDSACASA-N 1 2 229.270 2.139 20 0 BEADLO CC[C@@H]1CCCC[C@H]1CNC(=O)Cn1cc[nH+]c1 ZINC000563861121 323181571 /nfs/dbraw/zinc/18/15/71/323181571.db2.gz LIFADLPDXDLQAR-OLZOCXBDSA-N 1 2 249.358 2.216 20 0 BEADLO C[C@H](CC(=O)N[C@@H]1CC=CCC1)n1cc[nH+]c1 ZINC000563888570 323183570 /nfs/dbraw/zinc/18/35/70/323183570.db2.gz BPBZQHSYNXYHQA-VXGBXAGGSA-N 1 2 233.315 2.059 20 0 BEADLO CCc1nc(C)c(C[NH2+]Cc2ccc(F)cn2)o1 ZINC000529587906 323184580 /nfs/dbraw/zinc/18/45/80/323184580.db2.gz WKGHXCCNMTYXBN-UHFFFAOYSA-N 1 2 249.289 2.369 20 0 BEADLO CCC(NC(=O)c1c[nH+]c(C)[nH]1)(C1CC1)C1CC1 ZINC000529796786 323189444 /nfs/dbraw/zinc/18/94/44/323189444.db2.gz UGNQYKHQCGQZAA-UHFFFAOYSA-N 1 2 247.342 2.417 20 0 BEADLO CC[C@@]1(C)C[C@H]1C(=O)Nc1cc(C)[nH+]cc1C ZINC000535748093 323190182 /nfs/dbraw/zinc/19/01/82/323190182.db2.gz VAMNQZSGZNPHIT-FZMZJTMJSA-N 1 2 232.327 2.495 20 0 BEADLO Cc1cc(NC(=O)NCc2ccco2)c(C)c[nH+]1 ZINC000535774751 323190995 /nfs/dbraw/zinc/19/09/95/323190995.db2.gz FGIKGBFSAOPHSO-UHFFFAOYSA-N 1 2 245.282 2.035 20 0 BEADLO CCC1(C)CN(C(=O)C[C@@H](C)n2cc[nH+]c2)C1 ZINC000563892669 323194676 /nfs/dbraw/zinc/19/46/76/323194676.db2.gz TYIQXPUOXNNVQM-LLVKDONJSA-N 1 2 235.331 2.093 20 0 BEADLO CC[C@H]1CC[C@H](C(=O)Nc2cc(C)[nH+]cc2C)O1 ZINC000536574375 323197914 /nfs/dbraw/zinc/19/79/14/323197914.db2.gz SCFYAGFISHQQGB-WCQYABFASA-N 1 2 248.326 2.016 20 0 BEADLO Cc1cc(NC(=O)COC2CCCC2)c(C)c[nH+]1 ZINC000536575455 323198113 /nfs/dbraw/zinc/19/81/13/323198113.db2.gz MQGMNEVLYQTLHU-UHFFFAOYSA-N 1 2 248.326 2.018 20 0 BEADLO Cc1cc(NC(=O)N(C)CCC2CC2)c(C)c[nH+]1 ZINC000536618487 323198646 /nfs/dbraw/zinc/19/86/46/323198646.db2.gz IIKFMUXVXJIZQJ-UHFFFAOYSA-N 1 2 247.342 2.384 20 0 BEADLO CCCC1(C(=O)N2CC(n3cc[nH+]c3)C2)CCC1 ZINC000532342508 323252966 /nfs/dbraw/zinc/25/29/66/323252966.db2.gz IQTWZERIZLJOMC-UHFFFAOYSA-N 1 2 247.342 2.237 20 0 BEADLO C[C@@H]([NH2+]Cc1ccn[nH]1)c1ccc2c(c1)COC2 ZINC000532513127 323272194 /nfs/dbraw/zinc/27/21/94/323272194.db2.gz PVKUITKXVULSAI-SNVBAGLBSA-N 1 2 243.310 2.291 20 0 BEADLO CC(C)=CCNc1nc(N(C)C)nc(C(C)C)[nH+]1 ZINC000302694488 323313563 /nfs/dbraw/zinc/31/35/63/323313563.db2.gz GCLIWXFUOIWOEE-UHFFFAOYSA-N 1 2 249.362 2.439 20 0 BEADLO CC(C)=CCNc1nc(C(C)C)[nH+]c(N(C)C)n1 ZINC000302694488 323313566 /nfs/dbraw/zinc/31/35/66/323313566.db2.gz GCLIWXFUOIWOEE-UHFFFAOYSA-N 1 2 249.362 2.439 20 0 BEADLO COc1ccc[nH+]c1NC[C@@H](O)c1ccc(C)o1 ZINC000527903149 323712899 /nfs/dbraw/zinc/71/28/99/323712899.db2.gz QUHHKLYKPSRUGL-SNVBAGLBSA-N 1 2 248.282 2.137 20 0 BEADLO COc1ccc[nH+]c1N(C)CCC1CC1 ZINC000527938605 323720926 /nfs/dbraw/zinc/72/09/26/323720926.db2.gz ZTIRUIOTGAZXSS-UHFFFAOYSA-N 1 2 206.289 2.327 20 0 BEADLO CCC[C@@H]1CN(c2[nH+]cccc2OC)CCO1 ZINC000527941097 323721911 /nfs/dbraw/zinc/72/19/11/323721911.db2.gz GOLDXBUNVVBEMV-LLVKDONJSA-N 1 2 236.315 2.096 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ncccc1F)c1ccnn1C ZINC000528036849 323745270 /nfs/dbraw/zinc/74/52/70/323745270.db2.gz YVEGYVZDXYCSIN-UWVGGRQHSA-N 1 2 248.305 2.366 20 0 BEADLO COc1ccc[nH+]c1NCC1(C)CCOCC1 ZINC000234948021 324150252 /nfs/dbraw/zinc/15/02/52/324150252.db2.gz YMEULQDMWCMNIJ-UHFFFAOYSA-N 1 2 236.315 2.319 20 0 BEADLO Cc1csc(C[NH2+]C2(CF)CCC2)n1 ZINC000572522028 324189134 /nfs/dbraw/zinc/18/91/34/324189134.db2.gz ZXHMOQULDXKQNM-UHFFFAOYSA-N 1 2 214.309 2.433 20 0 BEADLO CC(C)(NC(=O)[C@H]1CCCC12CC2)c1[nH]cc[nH+]1 ZINC000529455377 324303888 /nfs/dbraw/zinc/30/38/88/324303888.db2.gz AZJPKARRPCNLOP-SNVBAGLBSA-N 1 2 247.342 2.341 20 0 BEADLO C[C@H](CC(=O)N(C)Cc1c[nH+]c[nH]1)c1ccco1 ZINC000529523041 324323181 /nfs/dbraw/zinc/32/31/81/324323181.db2.gz WLDPQPVLIVVRFL-SNVBAGLBSA-N 1 2 247.298 2.155 20 0 BEADLO C[C@H](CC(=O)N(C)Cc1c[nH]c[nH+]1)c1ccco1 ZINC000529523041 324323184 /nfs/dbraw/zinc/32/31/84/324323184.db2.gz WLDPQPVLIVVRFL-SNVBAGLBSA-N 1 2 247.298 2.155 20 0 BEADLO Fc1cccnc1C[NH2+]Cc1ccco1 ZINC000125779236 324654130 /nfs/dbraw/zinc/65/41/30/324654130.db2.gz RGLXSPGJHHDGRK-UHFFFAOYSA-N 1 2 206.220 2.104 20 0 BEADLO C[C@H]([NH2+]Cc1nccs1)c1cncs1 ZINC000128155134 324810482 /nfs/dbraw/zinc/81/04/82/324810482.db2.gz PFBKGTYPHSIHGW-ZETCQYMHSA-N 1 2 225.342 2.450 20 0 BEADLO COc1ccc[nH+]c1NCc1c(C)noc1C ZINC000128178680 324811247 /nfs/dbraw/zinc/81/12/47/324811247.db2.gz YKCDOACOQVBFKR-UHFFFAOYSA-N 1 2 233.271 2.307 20 0 BEADLO COc1ccc[nH+]c1NCC1(CO)CCCC1 ZINC000128221593 324812553 /nfs/dbraw/zinc/81/25/53/324812553.db2.gz NFACDEZFPJBRDV-UHFFFAOYSA-N 1 2 236.315 2.055 20 0 BEADLO CCC(CC)[C@H](O)CNc1[nH+]cccc1OC ZINC000230646115 325043757 /nfs/dbraw/zinc/04/37/57/325043757.db2.gz KNNMGBAUNBLDNI-LLVKDONJSA-N 1 2 238.331 2.299 20 0 BEADLO COC[C@H]([NH2+]Cc1cnoc1C)c1ccco1 ZINC000130409718 325049799 /nfs/dbraw/zinc/04/97/99/325049799.db2.gz MOBULMXPEVYZJW-NSHDSACASA-N 1 2 236.271 2.053 20 0 BEADLO FC1(CNc2ccc(-c3cncnc3)c[nH+]2)CC1 ZINC000543070030 325069681 /nfs/dbraw/zinc/06/96/81/325069681.db2.gz VQQQGEBESPBUNB-UHFFFAOYSA-N 1 2 244.273 2.453 20 0 BEADLO CCc1cnc(C[NH2+][C@H](CO)c2ccccc2)o1 ZINC000543812529 325115192 /nfs/dbraw/zinc/11/51/92/325115192.db2.gz DCGMXZJEYLJWMK-CYBMUJFWSA-N 1 2 246.310 2.060 20 0 BEADLO Cc1cnc(C[NH2+][C@H](CO)c2ccccc2C)o1 ZINC000543838465 325117134 /nfs/dbraw/zinc/11/71/34/325117134.db2.gz ISWQLRSTCIDYGV-CYBMUJFWSA-N 1 2 246.310 2.115 20 0 BEADLO COC(=O)[C@@H]([NH2+]CCc1ccc(C)cc1)C(C)C ZINC000545885649 325241852 /nfs/dbraw/zinc/24/18/52/325241852.db2.gz URORYHHHMJGAKY-AWEZNQCLSA-N 1 2 249.354 2.325 20 0 BEADLO CC[N@H+](C)Cc1nc([C@H](C)OCC(C)C)no1 ZINC000074989958 325273286 /nfs/dbraw/zinc/27/32/86/325273286.db2.gz XNFMPQTWNCGNEF-JTQLQIEISA-N 1 2 241.335 2.255 20 0 BEADLO CC[N@@H+](C)Cc1nc([C@H](C)OCC(C)C)no1 ZINC000074989958 325273289 /nfs/dbraw/zinc/27/32/89/325273289.db2.gz XNFMPQTWNCGNEF-JTQLQIEISA-N 1 2 241.335 2.255 20 0 BEADLO CC[S@@](=O)CCNc1[nH+]ccc2ccccc21 ZINC000133228831 325278235 /nfs/dbraw/zinc/27/82/35/325278235.db2.gz OORXSWLGGHDLNN-KRWDZBQOSA-N 1 2 248.351 2.415 20 0 BEADLO Cc1cnc(C[N@H+]2CCOC[C@@H]2CC(C)C)o1 ZINC000075743857 325309864 /nfs/dbraw/zinc/30/98/64/325309864.db2.gz WSAGUYJIYVIXCO-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO Cc1cnc(C[N@@H+]2CCOC[C@@H]2CC(C)C)o1 ZINC000075743857 325309867 /nfs/dbraw/zinc/30/98/67/325309867.db2.gz WSAGUYJIYVIXCO-LBPRGKRZSA-N 1 2 238.331 2.230 20 0 BEADLO CCc1nc(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)no1 ZINC000075768773 325311193 /nfs/dbraw/zinc/31/11/93/325311193.db2.gz UEQJBNBYBVSFNZ-MNOVXSKESA-N 1 2 235.331 2.397 20 0 BEADLO CCc1nc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)no1 ZINC000075768773 325311195 /nfs/dbraw/zinc/31/11/95/325311195.db2.gz UEQJBNBYBVSFNZ-MNOVXSKESA-N 1 2 235.331 2.397 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nnsc2Cl)C[C@H]1C ZINC000076112064 325332082 /nfs/dbraw/zinc/33/20/82/325332082.db2.gz SMCDDKDBWKDGJC-KNVOCYPGSA-N 1 2 231.752 2.279 20 0 BEADLO C[C@H]1C[N@H+](Cc2nnsc2Cl)C[C@H]1C ZINC000076112064 325332080 /nfs/dbraw/zinc/33/20/80/325332080.db2.gz SMCDDKDBWKDGJC-KNVOCYPGSA-N 1 2 231.752 2.279 20 0 BEADLO CCc1nnc([C@H](C)[NH+]2[C@H](C)C[C@H]2C)o1 ZINC000547768462 325394398 /nfs/dbraw/zinc/39/43/98/325394398.db2.gz NPLPVPZDPCUEHH-HLTSFMKQSA-N 1 2 209.293 2.176 20 0 BEADLO C[C@@H](c1nc(C2CC2)no1)[NH+]1[C@H](C)C[C@H]1C ZINC000548425957 325456663 /nfs/dbraw/zinc/45/66/63/325456663.db2.gz XFBWHSWZLSZYCU-HLTSFMKQSA-N 1 2 221.304 2.491 20 0 BEADLO CC[C@@H](C)C(=O)N(C)c1ccc[nH+]c1N(C)C ZINC000079725949 325465238 /nfs/dbraw/zinc/46/52/38/325465238.db2.gz BAYMIDHKWZXCTI-SNVBAGLBSA-N 1 2 235.331 2.157 20 0 BEADLO Cc1cc(NC(=O)C(=O)c2ccccc2)cc[nH+]1 ZINC000088344569 325654805 /nfs/dbraw/zinc/65/48/05/325654805.db2.gz MXULPUTXUBEXHQ-UHFFFAOYSA-N 1 2 240.262 2.211 20 0 BEADLO CC1(C)C[NH+](CC(=O)Nc2ccc(F)cc2)C1 ZINC000552883358 325668674 /nfs/dbraw/zinc/66/86/74/325668674.db2.gz ZLNBMCFONKKEFO-UHFFFAOYSA-N 1 2 236.290 2.106 20 0 BEADLO Cc1ccnc(N[C@H](c2[nH+]ccn2C)C2CC2)n1 ZINC000553262373 325683994 /nfs/dbraw/zinc/68/39/94/325683994.db2.gz SEAYQVVMZKVXTM-NSHDSACASA-N 1 2 243.314 2.082 20 0 BEADLO CC[C@@H]([NH2+]Cc1cc[nH]c1)C(=O)OC(C)(C)C ZINC000554326818 325714202 /nfs/dbraw/zinc/71/42/02/325714202.db2.gz DUKRXIOOKFKTCY-LLVKDONJSA-N 1 2 238.331 2.225 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N[C@@H]1CC2CCC1CC2 ZINC000554508455 325722725 /nfs/dbraw/zinc/72/27/25/325722725.db2.gz AMBSXURUJZDJHG-HTAVTVPLSA-N 1 2 247.342 2.037 20 0 BEADLO CN(CC1CCCCC1)C(=O)Cc1c[nH+]cn1C ZINC000554519823 325724821 /nfs/dbraw/zinc/72/48/21/325724821.db2.gz OSBGFSKTDKPOMW-UHFFFAOYSA-N 1 2 249.358 2.001 20 0 BEADLO CCCCN(CC)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000564731758 325805488 /nfs/dbraw/zinc/80/54/88/325805488.db2.gz HOUPINUZAUDATI-GFCCVEGCSA-N 1 2 237.347 2.483 20 0 BEADLO CC(C)C[C@@H](C)C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000565213189 325876239 /nfs/dbraw/zinc/87/62/39/325876239.db2.gz LNQRGXAAPYJDMZ-NXEZZACHSA-N 1 2 223.320 2.269 20 0 BEADLO COc1cccc2c1[nH]c(=[NH+]CC1(C)CC1)n2C ZINC000565339533 325897729 /nfs/dbraw/zinc/89/77/29/325897729.db2.gz KQFKVBDGJNXCGG-UHFFFAOYSA-N 1 2 245.326 2.216 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NCC1CC(C)(C)C1 ZINC000565578116 325929512 /nfs/dbraw/zinc/92/95/12/325929512.db2.gz DJVZCQUSLRPRJV-UHFFFAOYSA-N 1 2 247.342 2.370 20 0 BEADLO CC(C)C1(NC(=O)C[C@H](C)n2cc[nH+]c2)CC1 ZINC000565778101 325956713 /nfs/dbraw/zinc/95/67/13/325956713.db2.gz NVDKEXUUBGTJSQ-NSHDSACASA-N 1 2 235.331 2.139 20 0 BEADLO CC1(C)CC[C@H](C[N@@H+]2Cc3cccnc3C2)O1 ZINC000566138512 326001976 /nfs/dbraw/zinc/00/19/76/326001976.db2.gz HJQWMEJNSZMDHP-GFCCVEGCSA-N 1 2 232.327 2.355 20 0 BEADLO CC1(C)CC[C@H](C[N@H+]2Cc3cccnc3C2)O1 ZINC000566138512 326001980 /nfs/dbraw/zinc/00/19/80/326001980.db2.gz HJQWMEJNSZMDHP-GFCCVEGCSA-N 1 2 232.327 2.355 20 0 BEADLO C[C@H](CC(=O)N(C)Cc1ccoc1)n1cc[nH+]c1 ZINC000566308553 326032139 /nfs/dbraw/zinc/03/21/39/326032139.db2.gz TWBVPJIGWDGESZ-LLVKDONJSA-N 1 2 247.298 2.086 20 0 BEADLO C[C@@H](CC(=O)N1CCCC(C)(C)C1)n1cc[nH+]c1 ZINC000566328346 326033749 /nfs/dbraw/zinc/03/37/49/326033749.db2.gz NJIIXTHMNIEKIL-LBPRGKRZSA-N 1 2 249.358 2.483 20 0 BEADLO CC(C)Cn1cc(C[N@@H+]2CCC[C@@H](F)C2)cn1 ZINC000566353908 326035923 /nfs/dbraw/zinc/03/59/23/326035923.db2.gz MTEKYSPFWGATMT-CYBMUJFWSA-N 1 2 239.338 2.473 20 0 BEADLO C[C@H](CC(=O)N1CC(C(C)(C)C)C1)n1cc[nH+]c1 ZINC000566364324 326037586 /nfs/dbraw/zinc/03/75/86/326037586.db2.gz MTKCRXQOZHCVAM-LLVKDONJSA-N 1 2 249.358 2.339 20 0 BEADLO Cc1ccccc1[C@@H](C)[N@@H+]1CCn2nncc2C1 ZINC000566430405 326045560 /nfs/dbraw/zinc/04/55/60/326045560.db2.gz RHHFKSONNZYGQR-GFCCVEGCSA-N 1 2 242.326 2.163 20 0 BEADLO Cc1ccccc1[C@@H](C)[N@H+]1CCn2nncc2C1 ZINC000566430405 326045561 /nfs/dbraw/zinc/04/55/61/326045561.db2.gz RHHFKSONNZYGQR-GFCCVEGCSA-N 1 2 242.326 2.163 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1C[C@H](C)CC[C@H]1C ZINC000566444564 326048243 /nfs/dbraw/zinc/04/82/43/326048243.db2.gz HXNRVTNMNSBVHW-IJLUTSLNSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1C[C@H](C)CC[C@H]1C ZINC000566444564 326048245 /nfs/dbraw/zinc/04/82/45/326048245.db2.gz HXNRVTNMNSBVHW-IJLUTSLNSA-N 1 2 249.358 2.235 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N(C)C1(C)CCCC1 ZINC000566453693 326050019 /nfs/dbraw/zinc/05/00/19/326050019.db2.gz UPMVYTFRNDFMMH-LLVKDONJSA-N 1 2 249.358 2.379 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N(C)C1(C)CCCC1 ZINC000566453693 326050020 /nfs/dbraw/zinc/05/00/20/326050020.db2.gz UPMVYTFRNDFMMH-LLVKDONJSA-N 1 2 249.358 2.379 20 0 BEADLO C=Cn1cc(C[NH2+][C@@H](C)c2cscn2)cn1 ZINC000566500669 326059739 /nfs/dbraw/zinc/05/97/39/326059739.db2.gz LAPRVBRAVRQYBR-VIFPVBQESA-N 1 2 234.328 2.291 20 0 BEADLO Cc1cc(N[C@H]2CCCc3nn(C)cc32)nc[nH+]1 ZINC000566690777 326075102 /nfs/dbraw/zinc/07/51/02/326075102.db2.gz IJUHUXUKSNMNIC-NSHDSACASA-N 1 2 243.314 2.008 20 0 BEADLO COc1c(N)[nH+]cnc1NC1CCC2(CC2)CC1 ZINC000566747448 326079703 /nfs/dbraw/zinc/07/97/03/326079703.db2.gz IQBKVWANLYSQTE-UHFFFAOYSA-N 1 2 248.330 2.202 20 0 BEADLO COc1c(N)nc[nH+]c1NC1CCC2(CC2)CC1 ZINC000566747448 326079705 /nfs/dbraw/zinc/07/97/05/326079705.db2.gz IQBKVWANLYSQTE-UHFFFAOYSA-N 1 2 248.330 2.202 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCOCC1CCCC1 ZINC000566927290 326095135 /nfs/dbraw/zinc/09/51/35/326095135.db2.gz WNNJGUJXTDCJRB-UHFFFAOYSA-N 1 2 249.358 2.134 20 0 BEADLO CC[C@@H]1COCC[N@@H+]1Cc1ccc(C)nc1 ZINC000153772394 326112531 /nfs/dbraw/zinc/11/25/31/326112531.db2.gz YPQOIFGZYBVSJT-CYBMUJFWSA-N 1 2 220.316 2.001 20 0 BEADLO CC[C@@H]1COCC[N@H+]1Cc1ccc(C)nc1 ZINC000153772394 326112534 /nfs/dbraw/zinc/11/25/34/326112534.db2.gz YPQOIFGZYBVSJT-CYBMUJFWSA-N 1 2 220.316 2.001 20 0 BEADLO CC(C)=CCCNC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000567170862 326128266 /nfs/dbraw/zinc/12/82/66/326128266.db2.gz OCXHLODDHMNFOV-GFCCVEGCSA-N 1 2 235.331 2.307 20 0 BEADLO COC(=O)[C@@H]([NH2+]CCSC)C1CCCCC1 ZINC000309585730 326162053 /nfs/dbraw/zinc/16/20/53/326162053.db2.gz RTGKOFRMOTZDJA-NSHDSACASA-N 1 2 245.388 2.061 20 0 BEADLO CC(C)n1cc[nH+]c1CN1CCO[C@H](C)[C@H]1C ZINC000155956890 326216113 /nfs/dbraw/zinc/21/61/13/326216113.db2.gz FZSDLRLXMSWISA-VXGBXAGGSA-N 1 2 237.347 2.073 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](C)c2cncnc2C)s1 ZINC000568238544 326332215 /nfs/dbraw/zinc/33/22/15/326332215.db2.gz XHGLUSBUYGZNAZ-VIFPVBQESA-N 1 2 248.355 2.401 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N1CCCC[C@@H]1C ZINC000158635686 326334374 /nfs/dbraw/zinc/33/43/74/326334374.db2.gz LVUUISKMXGIRFF-GUOLPTJISA-N 1 2 247.342 2.317 20 0 BEADLO Cc1c[nH+]c(C)nc1NCCCC1CCOCC1 ZINC000568249585 326334566 /nfs/dbraw/zinc/33/45/66/326334566.db2.gz VJILEJOIIKBOTI-UHFFFAOYSA-N 1 2 249.358 2.134 20 0 BEADLO Cc1nc(C[NH2+]Cc2cccc(O)c2)[nH]c1C ZINC000568269709 326338092 /nfs/dbraw/zinc/33/80/92/326338092.db2.gz UVCOFDSMUNELDN-UHFFFAOYSA-N 1 2 231.299 2.022 20 0 BEADLO Cc1[nH]c(CNCc2cccc(O)c2)[nH+]c1C ZINC000568269709 326338093 /nfs/dbraw/zinc/33/80/93/326338093.db2.gz UVCOFDSMUNELDN-UHFFFAOYSA-N 1 2 231.299 2.022 20 0 BEADLO CCn1cc[nH+]c1/C=C/C(=O)N[C@H](C)C(C)(C)C ZINC000158761159 326342994 /nfs/dbraw/zinc/34/29/94/326342994.db2.gz POYRSLWGHKHWEJ-WSKFYRRCSA-N 1 2 249.358 2.467 20 0 BEADLO CC(C)(C)OC(=O)CC[N@@H+]1Cc2cccnc2C1 ZINC000568755656 326375189 /nfs/dbraw/zinc/37/51/89/326375189.db2.gz ONFDSGKEFSBKDB-UHFFFAOYSA-N 1 2 248.326 2.129 20 0 BEADLO CC(C)(C)OC(=O)CC[N@H+]1Cc2cccnc2C1 ZINC000568755656 326375190 /nfs/dbraw/zinc/37/51/90/326375190.db2.gz ONFDSGKEFSBKDB-UHFFFAOYSA-N 1 2 248.326 2.129 20 0 BEADLO Cc1cc([NH2+][C@H](C)[C@H](C)O)cc(C)c1O ZINC000569096354 326389662 /nfs/dbraw/zinc/38/96/62/326389662.db2.gz ZRORLTALUAOKEU-ZJUUUORDSA-N 1 2 209.289 2.190 20 0 BEADLO CC[C@@H](C)[C@H]1CCCCN1C(=O)Cn1cc[nH+]c1 ZINC000573148812 326432214 /nfs/dbraw/zinc/43/22/14/326432214.db2.gz BEYMZNAKAFVLEY-CHWSQXEVSA-N 1 2 249.358 2.310 20 0 BEADLO O[C@H]1C[N@H+](C[C@@H]2CC=CCC2)CC(F)(F)C1 ZINC000682559382 487988675 /nfs/dbraw/zinc/98/86/75/487988675.db2.gz UYIJULDDOXHYMN-GHMZBOCLSA-N 1 2 231.286 2.045 20 0 BEADLO O[C@H]1C[N@@H+](C[C@@H]2CC=CCC2)CC(F)(F)C1 ZINC000682559382 487988681 /nfs/dbraw/zinc/98/86/81/487988681.db2.gz UYIJULDDOXHYMN-GHMZBOCLSA-N 1 2 231.286 2.045 20 0 BEADLO CCc1cc(N[C@@H]2COC(C)(C)C2)nc[nH+]1 ZINC000396650208 487992591 /nfs/dbraw/zinc/99/25/91/487992591.db2.gz KUBIIHTUNAGWDE-JTQLQIEISA-N 1 2 221.304 2.018 20 0 BEADLO Cc1cc(N)nc(SCC(F)(F)F)[nH+]1 ZINC000074251321 487996424 /nfs/dbraw/zinc/99/64/24/487996424.db2.gz PVHYGVMFRSAVAI-UHFFFAOYSA-N 1 2 223.223 2.022 20 0 BEADLO COc1ccc2c(c1)CC[N@@H+](Cc1cocn1)C2 ZINC000668603383 487996069 /nfs/dbraw/zinc/99/60/69/487996069.db2.gz DJBMMBYHCSPALC-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO COc1ccc2c(c1)CC[N@H+](Cc1cocn1)C2 ZINC000668603383 487996073 /nfs/dbraw/zinc/99/60/73/487996073.db2.gz DJBMMBYHCSPALC-UHFFFAOYSA-N 1 2 244.294 2.242 20 0 BEADLO CCc1cc(NCCC(O)(CC)CC)nc[nH+]1 ZINC000682618825 488002271 /nfs/dbraw/zinc/00/22/71/488002271.db2.gz RDEBUVBOPMWEGI-UHFFFAOYSA-N 1 2 237.347 2.392 20 0 BEADLO Cc1[nH]ncc1C[NH2+][C@H]1C[C@H](OC(C)(C)C)C1 ZINC000655844986 488013341 /nfs/dbraw/zinc/01/33/41/488013341.db2.gz CXLUUFVOPJNNBT-HAQNSBGRSA-N 1 2 237.347 2.154 20 0 BEADLO C[C@@H](NC(=O)c1ccc2[nH+]ccn2c1)C1CCC1 ZINC000677338833 488020549 /nfs/dbraw/zinc/02/05/49/488020549.db2.gz CKVDVUKAZVDFBZ-SNVBAGLBSA-N 1 2 243.310 2.253 20 0 BEADLO C[C@@H]1CCN(c2cc(CO)cc[nH+]2)C[C@@H]1C ZINC000135205992 488021129 /nfs/dbraw/zinc/02/11/29/488021129.db2.gz LGNFOJCWVYRSMF-MNOVXSKESA-N 1 2 220.316 2.056 20 0 BEADLO Cc1cc(-n2cccn2)ccc1[NH2+]C[C@H](C)CO ZINC000682709237 488024340 /nfs/dbraw/zinc/02/43/40/488024340.db2.gz FNISNWJWTDIEPT-NSHDSACASA-N 1 2 245.326 2.221 20 0 BEADLO CC[C@H](C)CCNC(=O)Nc1cc[nH+]c(C)c1 ZINC000666491812 488026487 /nfs/dbraw/zinc/02/64/87/488026487.db2.gz CQPZRLNLSZWXOF-JTQLQIEISA-N 1 2 235.331 2.370 20 0 BEADLO Cc1cc(C[NH2+]Cc2ccc(F)cc2F)ncn1 ZINC000677424798 488033925 /nfs/dbraw/zinc/03/39/25/488033925.db2.gz MBDKZOJDLQUPTN-UHFFFAOYSA-N 1 2 249.264 2.353 20 0 BEADLO C[C@H]1CC[C@H](C[N@@H+]2CCC[C@H]2C(F)F)O1 ZINC000682767571 488033760 /nfs/dbraw/zinc/03/37/60/488033760.db2.gz AXQVIPFQLMUBLQ-AEJSXWLSSA-N 1 2 219.275 2.283 20 0 BEADLO C[C@H]1CC[C@H](C[N@H+]2CCC[C@H]2C(F)F)O1 ZINC000682767571 488033766 /nfs/dbraw/zinc/03/37/66/488033766.db2.gz AXQVIPFQLMUBLQ-AEJSXWLSSA-N 1 2 219.275 2.283 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cncs2)nc1 ZINC000682787656 488041648 /nfs/dbraw/zinc/04/16/48/488041648.db2.gz CFZNWXTTZSYNRY-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cncs2)nc1 ZINC000682787656 488041652 /nfs/dbraw/zinc/04/16/52/488041652.db2.gz CFZNWXTTZSYNRY-UHFFFAOYSA-N 1 2 233.340 2.479 20 0 BEADLO CCn1cc[nH+]c1CN(C)Cc1ccc(C)cn1 ZINC000682788338 488042026 /nfs/dbraw/zinc/04/20/26/488042026.db2.gz LOTRBJLUCDBZEM-UHFFFAOYSA-N 1 2 244.342 2.238 20 0 BEADLO CC(C)(C)CNc1ccc(-n2cncn2)c[nH+]1 ZINC000682854933 488055043 /nfs/dbraw/zinc/05/50/43/488055043.db2.gz APPODUCJFRHREP-UHFFFAOYSA-N 1 2 231.303 2.120 20 0 BEADLO CC[C@H](C)CC(=O)N1CC(Oc2cc[nH+]cc2)C1 ZINC000682890719 488061515 /nfs/dbraw/zinc/06/15/15/488061515.db2.gz LUIRKOQVBUNZRM-NSHDSACASA-N 1 2 248.326 2.107 20 0 BEADLO CO[C@@H](C)CN(C)c1cc[nH+]c(C(C)(C)C)n1 ZINC000672337902 488063565 /nfs/dbraw/zinc/06/35/65/488063565.db2.gz JPTSKHRXWCJXMG-JTQLQIEISA-N 1 2 237.347 2.245 20 0 BEADLO CC[C@@H](C)CNc1ccc(-n2cncn2)c[nH+]1 ZINC000682951581 488070577 /nfs/dbraw/zinc/07/05/77/488070577.db2.gz LLGMCTMUXMJOEC-SNVBAGLBSA-N 1 2 231.303 2.120 20 0 BEADLO C[C@@H]1COCCC[N@@H+]1Cc1ncc(C2CC2)o1 ZINC000677695057 488094183 /nfs/dbraw/zinc/09/41/83/488094183.db2.gz BPWZRRRMNFKRLJ-SNVBAGLBSA-N 1 2 236.315 2.163 20 0 BEADLO C[C@@H]1COCCC[N@H+]1Cc1ncc(C2CC2)o1 ZINC000677695057 488094184 /nfs/dbraw/zinc/09/41/84/488094184.db2.gz BPWZRRRMNFKRLJ-SNVBAGLBSA-N 1 2 236.315 2.163 20 0 BEADLO Clc1ccc2c(c1)C[C@H]([NH+]1CCOCC1)C2 ZINC001172714618 974926755 /nfs/dbraw/zinc/92/67/55/974926755.db2.gz FSYFPYBEEVHECX-CYBMUJFWSA-N 1 2 237.730 2.139 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)Cc1cccc(F)c1F ZINC000677801922 488124724 /nfs/dbraw/zinc/12/47/24/488124724.db2.gz GVYYMCYAVRNZIL-UHFFFAOYSA-N 1 2 237.253 2.320 20 0 BEADLO FC1(F)CC([NH2+]Cc2n[nH]c3ccccc32)C1 ZINC000683206155 488130752 /nfs/dbraw/zinc/13/07/52/488130752.db2.gz GBQJGLPXCJUCGR-UHFFFAOYSA-N 1 2 237.253 2.450 20 0 BEADLO Cc1nc([C@@H](C)[N@@H+]2CC[C@@H](C(F)F)C2)no1 ZINC000685570158 487542602 /nfs/dbraw/zinc/54/26/02/487542602.db2.gz WRLXHGQKEBYBHI-HTRCEHHLSA-N 1 2 231.246 2.026 20 0 BEADLO Cc1nc([C@@H](C)[N@H+]2CC[C@@H](C(F)F)C2)no1 ZINC000685570158 487542605 /nfs/dbraw/zinc/54/26/05/487542605.db2.gz WRLXHGQKEBYBHI-HTRCEHHLSA-N 1 2 231.246 2.026 20 0 BEADLO Cc1[nH]ccc1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000674242590 487532553 /nfs/dbraw/zinc/53/25/53/487532553.db2.gz QMEGPYZRPBLESH-UHFFFAOYSA-N 1 2 240.266 2.223 20 0 BEADLO OC1CCC(CNc2cccc[nH+]2)CC1 ZINC000227701534 487471409 /nfs/dbraw/zinc/47/14/09/487471409.db2.gz HYDFGNWDHQMVIU-UHFFFAOYSA-N 1 2 206.289 2.045 20 0 BEADLO C[N@H+](Cc1cn[nH]c1)Cc1nc2ccccc2o1 ZINC000673928144 487481606 /nfs/dbraw/zinc/48/16/06/487481606.db2.gz ZEVRHISYCSFPTH-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO C[N@@H+](Cc1cn[nH]c1)Cc1nc2ccccc2o1 ZINC000673928144 487481613 /nfs/dbraw/zinc/48/16/13/487481613.db2.gz ZEVRHISYCSFPTH-UHFFFAOYSA-N 1 2 242.282 2.183 20 0 BEADLO C[C@H]1CCCC[C@@H]1CC(=O)NCc1c[nH+]c[nH]1 ZINC000673934853 487486118 /nfs/dbraw/zinc/48/61/18/487486118.db2.gz JGOIPAPTSOEOMH-WDEREUQCSA-N 1 2 235.331 2.242 20 0 BEADLO C[C@H]1CCCC[C@@H]1CC(=O)NCc1c[nH]c[nH+]1 ZINC000673934853 487486135 /nfs/dbraw/zinc/48/61/35/487486135.db2.gz JGOIPAPTSOEOMH-WDEREUQCSA-N 1 2 235.331 2.242 20 0 BEADLO Cc1noc(C[NH2+][C@H](C)c2ccsc2)n1 ZINC000050344214 487497189 /nfs/dbraw/zinc/49/71/89/487497189.db2.gz PCKFEERJPBCVFS-SSDOTTSWSA-N 1 2 223.301 2.290 20 0 BEADLO Cc1noc([C@@H](C)[NH2+][C@H](C)c2cnccc2C)n1 ZINC000679941055 487499332 /nfs/dbraw/zinc/49/93/32/487499332.db2.gz BTTSVSUGQUNXBX-NXEZZACHSA-N 1 2 246.314 2.493 20 0 BEADLO CCc1nnc(C[NH2+][C@H](C)c2cnccc2C)o1 ZINC000679944790 487499919 /nfs/dbraw/zinc/49/99/19/487499919.db2.gz PMFDNENWSFTRCC-SNVBAGLBSA-N 1 2 246.314 2.186 20 0 BEADLO CCc1cc(N[C@@H](C)C[C@H]2CCOC2)nc[nH+]1 ZINC000675291710 487503425 /nfs/dbraw/zinc/50/34/25/487503425.db2.gz XLBIIXFFXAUVRJ-WDEREUQCSA-N 1 2 235.331 2.266 20 0 BEADLO CC(C)(C)c1nc(NC[C@](C)(O)C2CC2)cc[nH+]1 ZINC000674065318 487507476 /nfs/dbraw/zinc/50/74/76/487507476.db2.gz BYXYRRGCHPFSCL-AWEZNQCLSA-N 1 2 249.358 2.347 20 0 BEADLO CCc1cc(N[C@@H](C)Cc2ccncc2)nc[nH+]1 ZINC000674068131 487508377 /nfs/dbraw/zinc/50/83/77/487508377.db2.gz SKTSMZFOCOEATF-NSHDSACASA-N 1 2 242.326 2.477 20 0 BEADLO Cc1nc(NC[C@H](C)c2ccncc2)cc[nH+]1 ZINC000674066434 487508912 /nfs/dbraw/zinc/50/89/12/487508912.db2.gz MEYWVUGMVARWSQ-JTQLQIEISA-N 1 2 228.299 2.396 20 0 BEADLO C[C@@H](C(=O)N(C)Cc1[nH]cc[nH+]1)C1CCCC1 ZINC000674089420 487516696 /nfs/dbraw/zinc/51/66/96/487516696.db2.gz FIPREPNNBZKMHZ-SNVBAGLBSA-N 1 2 235.331 2.194 20 0 BEADLO CCn1cc(C[NH2+][C@@H](C)c2ccsc2)nn1 ZINC000404436182 488159712 /nfs/dbraw/zinc/15/97/12/488159712.db2.gz RMXOFAAQTHNPEM-VIFPVBQESA-N 1 2 236.344 2.210 20 0 BEADLO c1cc2[nH+]ccc(NCC[C@H]3CCCO3)c2cn1 ZINC000674746069 487610766 /nfs/dbraw/zinc/61/07/66/487610766.db2.gz AJBUTHQFGDZBAN-LLVKDONJSA-N 1 2 243.310 2.033 20 0 BEADLO CCCn1nccc1C[NH2+]Cc1nccs1 ZINC000164836248 487901325 /nfs/dbraw/zinc/90/13/25/487901325.db2.gz FSJFQRFAWNOOPD-UHFFFAOYSA-N 1 2 236.344 2.039 20 0 BEADLO O=C(NCCCCn1cc[nH+]c1)C1=CCCCC1 ZINC000682159894 487919107 /nfs/dbraw/zinc/91/91/07/487919107.db2.gz SYMFTCDSIFILJE-UHFFFAOYSA-N 1 2 247.342 2.280 20 0 BEADLO C(=C\c1ccccc1)\C[N@@H+]1CCc2cn[nH]c2C1 ZINC000676795140 487931387 /nfs/dbraw/zinc/93/13/87/487931387.db2.gz YNQSLNMMFVOOAL-DAXSKMNVSA-N 1 2 239.322 2.481 20 0 BEADLO C(=C\c1ccccc1)\C[N@H+]1CCc2cn[nH]c2C1 ZINC000676795140 487931390 /nfs/dbraw/zinc/93/13/90/487931390.db2.gz YNQSLNMMFVOOAL-DAXSKMNVSA-N 1 2 239.322 2.481 20 0 BEADLO CCC[C@H](C)C[N@@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000682558781 487987671 /nfs/dbraw/zinc/98/76/71/487987671.db2.gz PEADHUCFNNWNLK-UWVGGRQHSA-N 1 2 221.291 2.125 20 0 BEADLO CCC[C@H](C)C[N@H+]1C[C@@H](O)CC(F)(F)C1 ZINC000682558781 487987674 /nfs/dbraw/zinc/98/76/74/487987674.db2.gz PEADHUCFNNWNLK-UWVGGRQHSA-N 1 2 221.291 2.125 20 0 BEADLO O=C(CCCF)Nc1ccc2[nH+]ccn2c1 ZINC000668637780 488035661 /nfs/dbraw/zinc/03/56/61/488035661.db2.gz STVUGIHPCZMAPV-UHFFFAOYSA-N 1 2 221.235 2.023 20 0 BEADLO CC1(CC(=O)N2CCC[C@@H](n3cc[nH+]c3)C2)CC1 ZINC000683240257 488136457 /nfs/dbraw/zinc/13/64/57/488136457.db2.gz BWAHVFSSPRMZCT-GFCCVEGCSA-N 1 2 247.342 2.237 20 0 BEADLO O=C(CCCn1cc[nH+]c1)N[C@@H]1CC12CCCC2 ZINC000683255678 488139493 /nfs/dbraw/zinc/13/94/93/488139493.db2.gz SGMQSQPNPGVFBA-GFCCVEGCSA-N 1 2 247.342 2.112 20 0 BEADLO CCC(C)(CC)NC(=O)[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000668706713 488146677 /nfs/dbraw/zinc/14/66/77/488146677.db2.gz WEGBKLJMNVSYMU-SNVBAGLBSA-N 1 2 249.358 2.210 20 0 BEADLO CCC(C)(CC)NC(=O)[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000668706713 488146681 /nfs/dbraw/zinc/14/66/81/488146681.db2.gz WEGBKLJMNVSYMU-SNVBAGLBSA-N 1 2 249.358 2.210 20 0 BEADLO CCc1cc(N[C@H]2CS[C@@H](C)C2)nc[nH+]1 ZINC000397794603 488149695 /nfs/dbraw/zinc/14/96/95/488149695.db2.gz FPTBJOZYZZDHJX-WCBMZHEXSA-N 1 2 223.345 2.345 20 0 BEADLO COc1ccc(N[C@H]2CO[C@H](C3CC3)C2)[nH+]c1 ZINC000667907506 488152454 /nfs/dbraw/zinc/15/24/54/488152454.db2.gz RTTQGUWMSZNWCO-PWSUYJOCSA-N 1 2 234.299 2.070 20 0 BEADLO COc1ccc[nH+]c1N[C@@H]1CO[C@H](C2CC2)C1 ZINC000667918944 488158325 /nfs/dbraw/zinc/15/83/25/488158325.db2.gz QDBNHYAUQRKFDN-JQWIXIFHSA-N 1 2 234.299 2.070 20 0 BEADLO Cn1nc(C(F)(F)F)cc1C[N@H+]1CC=CCC1 ZINC000667946730 488164152 /nfs/dbraw/zinc/16/41/52/488164152.db2.gz VFVCSEBKABVGLB-UHFFFAOYSA-N 1 2 245.248 2.201 20 0 BEADLO Cn1nc(C(F)(F)F)cc1C[N@@H+]1CC=CCC1 ZINC000667946730 488164153 /nfs/dbraw/zinc/16/41/53/488164153.db2.gz VFVCSEBKABVGLB-UHFFFAOYSA-N 1 2 245.248 2.201 20 0 BEADLO Cc1cnc(N2CCC[C@@H](n3cc[nH+]c3)C2)s1 ZINC000683457088 488166060 /nfs/dbraw/zinc/16/60/60/488166060.db2.gz IBWLVZPADIFDHM-LLVKDONJSA-N 1 2 248.355 2.490 20 0 BEADLO CCn1cc(C[NH2+][C@H](C)c2cc(C)oc2C)nn1 ZINC000404512605 488166161 /nfs/dbraw/zinc/16/61/61/488166161.db2.gz RQRUZTSVKLSDDX-SNVBAGLBSA-N 1 2 248.330 2.359 20 0 BEADLO COc1ccc(N[C@H]2CS[C@@H](C)C2)[nH+]c1 ZINC000397908523 488169250 /nfs/dbraw/zinc/16/92/50/488169250.db2.gz YQMRXBYYFBBYGD-DTWKUNHWSA-N 1 2 224.329 2.396 20 0 BEADLO CC[C@H](N[C@@H](C)c1[nH]cc[nH+]1)C(F)F ZINC000453247063 488186425 /nfs/dbraw/zinc/18/64/25/488186425.db2.gz NTFNYMGXFSINMA-BQBZGAKWSA-N 1 2 203.236 2.104 20 0 BEADLO Cc1cc(NC(=O)N[C@H](C)C2CCC2)c(C)c[nH+]1 ZINC000678097281 488197710 /nfs/dbraw/zinc/19/77/10/488197710.db2.gz WSUMIFADIDKXNM-LLVKDONJSA-N 1 2 247.342 2.430 20 0 BEADLO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1csnn1 ZINC000678120207 488199779 /nfs/dbraw/zinc/19/97/79/488199779.db2.gz BLRUEMZPIIAARI-RKDXNWHRSA-N 1 2 211.334 2.301 20 0 BEADLO CCOc1cccc(NCc2c[nH+]cn2CC)n1 ZINC000668154924 488210672 /nfs/dbraw/zinc/21/06/72/488210672.db2.gz HRIGQVWOPDNJKG-UHFFFAOYSA-N 1 2 246.314 2.309 20 0 BEADLO C=Cn1cc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)cn1 ZINC000683708262 488211585 /nfs/dbraw/zinc/21/15/85/488211585.db2.gz BMEIBERLJPQNFC-PWSUYJOCSA-N 1 2 223.295 2.164 20 0 BEADLO C=Cn1cc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)cn1 ZINC000683708262 488211590 /nfs/dbraw/zinc/21/15/90/488211590.db2.gz BMEIBERLJPQNFC-PWSUYJOCSA-N 1 2 223.295 2.164 20 0 BEADLO C=Cn1cc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)cn1 ZINC000683708263 488211831 /nfs/dbraw/zinc/21/18/31/488211831.db2.gz BMEIBERLJPQNFC-ZYHUDNBSSA-N 1 2 223.295 2.164 20 0 BEADLO C=Cn1cc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)cn1 ZINC000683708263 488211834 /nfs/dbraw/zinc/21/18/34/488211834.db2.gz BMEIBERLJPQNFC-ZYHUDNBSSA-N 1 2 223.295 2.164 20 0 BEADLO CC1(C)CC[C@@H](NC(=O)CCCn2cc[nH+]c2)C1 ZINC000678184174 488214661 /nfs/dbraw/zinc/21/46/61/488214661.db2.gz BQTMICKRFYPDBG-GFCCVEGCSA-N 1 2 249.358 2.358 20 0 BEADLO Cc1ccoc1CN(C)Cc1c[nH+]c2n1CCC2 ZINC000668187395 488217526 /nfs/dbraw/zinc/21/75/26/488217526.db2.gz DUDRMRDQLLKXTA-UHFFFAOYSA-N 1 2 245.326 2.363 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1ccc(F)c(F)c1F ZINC000668192833 488219654 /nfs/dbraw/zinc/21/96/54/488219654.db2.gz OLNLVPQKRUXHDU-SECBINFHSA-N 1 2 245.244 2.325 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1ccc(F)c(F)c1F ZINC000668192833 488219658 /nfs/dbraw/zinc/21/96/58/488219658.db2.gz OLNLVPQKRUXHDU-SECBINFHSA-N 1 2 245.244 2.325 20 0 BEADLO Cn1ncc(C2CCC2)c1C[N@@H+]1CC[C@@H](F)C1 ZINC000668213480 488228093 /nfs/dbraw/zinc/22/80/93/488228093.db2.gz BWWXZGXORMYQNN-LLVKDONJSA-N 1 2 237.322 2.231 20 0 BEADLO Cn1ncc(C2CCC2)c1C[N@H+]1CC[C@@H](F)C1 ZINC000668213480 488228095 /nfs/dbraw/zinc/22/80/95/488228095.db2.gz BWWXZGXORMYQNN-LLVKDONJSA-N 1 2 237.322 2.231 20 0 BEADLO COCc1ccc(C[N@H+](C)Cc2ncc[nH]2)cc1 ZINC000683889083 488237642 /nfs/dbraw/zinc/23/76/42/488237642.db2.gz KCPBOMGLCLZZRR-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO COCc1ccc(C[N@@H+](C)Cc2ncc[nH]2)cc1 ZINC000683889083 488237645 /nfs/dbraw/zinc/23/76/45/488237645.db2.gz KCPBOMGLCLZZRR-UHFFFAOYSA-N 1 2 245.326 2.188 20 0 BEADLO Cn1cnc(C[N@@H+]2CCc3sccc3C2)c1 ZINC000683897335 488239437 /nfs/dbraw/zinc/23/94/37/488239437.db2.gz YYKAQXZYEPTXTL-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO Cn1cnc(C[N@H+]2CCc3sccc3C2)c1 ZINC000683897335 488239439 /nfs/dbraw/zinc/23/94/39/488239439.db2.gz YYKAQXZYEPTXTL-UHFFFAOYSA-N 1 2 233.340 2.040 20 0 BEADLO Cc1nc(C(=O)Nc2ccc(C)[nH+]c2C)co1 ZINC000194828348 488240102 /nfs/dbraw/zinc/24/01/02/488240102.db2.gz SGGUQRITVBJOFH-UHFFFAOYSA-N 1 2 231.255 2.247 20 0 BEADLO CC(C)(C)CCC(=O)N[C@H]1CCc2c[nH+]cn2C1 ZINC000672145596 488240788 /nfs/dbraw/zinc/24/07/88/488240788.db2.gz MNJDFWKAFNYXKZ-NSHDSACASA-N 1 2 249.358 2.140 20 0 BEADLO CCc1cc(OCCO)c2ccccc2[nH+]1 ZINC000678356694 488246284 /nfs/dbraw/zinc/24/62/84/488246284.db2.gz WWCZYTSYXYBBDU-UHFFFAOYSA-N 1 2 217.268 2.168 20 0 BEADLO CCCCNc1cc(N2CC=CCC2)nc(N)[nH+]1 ZINC000672248667 488247673 /nfs/dbraw/zinc/24/76/73/488247673.db2.gz HWZAPEDSOFXUPY-UHFFFAOYSA-N 1 2 247.346 2.037 20 0 BEADLO CCCCNc1cc(N2CC=CCC2)[nH+]c(N)n1 ZINC000672248667 488247675 /nfs/dbraw/zinc/24/76/75/488247675.db2.gz HWZAPEDSOFXUPY-UHFFFAOYSA-N 1 2 247.346 2.037 20 0 BEADLO Cc1nn(C)cc1CNc1cc2cc[nH]c2c[nH+]1 ZINC000672250080 488247957 /nfs/dbraw/zinc/24/79/57/488247957.db2.gz UTDGTHZNYNZMNS-UHFFFAOYSA-N 1 2 241.298 2.217 20 0 BEADLO c1cc(N2CCC3(CC3)C2)nc(C2CC2)[nH+]1 ZINC000672275213 488249429 /nfs/dbraw/zinc/24/94/29/488249429.db2.gz JHGJPAMDEVPJRJ-UHFFFAOYSA-N 1 2 215.300 2.344 20 0 BEADLO C[C@@H](c1nncn1C)[N@H+](C)Cc1ccsc1 ZINC000672535650 488258320 /nfs/dbraw/zinc/25/83/20/488258320.db2.gz OZSHSEGOHZTDEO-VIFPVBQESA-N 1 2 236.344 2.070 20 0 BEADLO C[C@@H](c1nncn1C)[N@@H+](C)Cc1ccsc1 ZINC000672535650 488258323 /nfs/dbraw/zinc/25/83/23/488258323.db2.gz OZSHSEGOHZTDEO-VIFPVBQESA-N 1 2 236.344 2.070 20 0 BEADLO CC[C@@H]1CC[C@@H](C)N1C(=O)CCCn1cc[nH+]c1 ZINC000678485444 488261102 /nfs/dbraw/zinc/26/11/02/488261102.db2.gz DYUQPUWRBVQKFJ-CHWSQXEVSA-N 1 2 249.358 2.453 20 0 BEADLO CO[C@@]1(C)CCC[N@H+](CC(F)F)CC1 ZINC000684622933 488334658 /nfs/dbraw/zinc/33/46/58/488334658.db2.gz NDMJEGGQTHXRGT-JTQLQIEISA-N 1 2 207.264 2.143 20 0 BEADLO CO[C@@]1(C)CCC[N@@H+](CC(F)F)CC1 ZINC000684622933 488334660 /nfs/dbraw/zinc/33/46/60/488334660.db2.gz NDMJEGGQTHXRGT-JTQLQIEISA-N 1 2 207.264 2.143 20 0 BEADLO CCc1nnc(C[N@H+]2[C@H](C)C[C@@H]2C)s1 ZINC000684208055 488276477 /nfs/dbraw/zinc/27/64/77/488276477.db2.gz GOOQMEWGZRFVRF-OCAPTIKFSA-N 1 2 211.334 2.083 20 0 BEADLO CCc1nnc(C[N@@H+]2[C@H](C)C[C@@H]2C)s1 ZINC000684208055 488276479 /nfs/dbraw/zinc/27/64/79/488276479.db2.gz GOOQMEWGZRFVRF-OCAPTIKFSA-N 1 2 211.334 2.083 20 0 BEADLO CCc1nnc(C[NH+]2[C@H](C)C[C@H]2C)s1 ZINC000684208054 488276533 /nfs/dbraw/zinc/27/65/33/488276533.db2.gz GOOQMEWGZRFVRF-HTQZYQBOSA-N 1 2 211.334 2.083 20 0 BEADLO Cc1noc([C@H](C)[NH2+][C@H](C)c2cccc(O)c2)n1 ZINC000678761683 488280531 /nfs/dbraw/zinc/28/05/31/488280531.db2.gz YYUUPDZZIOBZGC-BDAKNGLRSA-N 1 2 247.298 2.495 20 0 BEADLO COc1ccc(C)cc1COCc1[nH]cc[nH+]1 ZINC000679008261 488302829 /nfs/dbraw/zinc/30/28/29/488302829.db2.gz FDAAIWUJQCAYKS-UHFFFAOYSA-N 1 2 232.283 2.444 20 0 BEADLO COc1ccc(N[C@@H]2CCC[C@@H](OC)C2)[nH+]c1 ZINC000684385300 488303554 /nfs/dbraw/zinc/30/35/54/488303554.db2.gz JKXSBXNBGWBMOE-GHMZBOCLSA-N 1 2 236.315 2.460 20 0 BEADLO CC[C@@H](Nc1ccc(OC)c[nH+]1)[C@@H]1CCOC1 ZINC000679068464 488305660 /nfs/dbraw/zinc/30/56/60/488305660.db2.gz DTGKRVIKRPNBEG-ZYHUDNBSSA-N 1 2 236.315 2.317 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)N1C2CCCC1CCC2 ZINC000684449540 488314527 /nfs/dbraw/zinc/31/45/27/488314527.db2.gz JAUFITYEYATILX-UHFFFAOYSA-N 1 2 247.342 2.276 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)N1C2CCCC1CCC2 ZINC000684449540 488314528 /nfs/dbraw/zinc/31/45/28/488314528.db2.gz JAUFITYEYATILX-UHFFFAOYSA-N 1 2 247.342 2.276 20 0 BEADLO Cc1nnc([C@H](C)[N@@H+]2CC[C@H](C)[C@H](F)C2)o1 ZINC000679219243 488318742 /nfs/dbraw/zinc/31/87/42/488318742.db2.gz FMQIKBQNHNWOPQ-OYNCUSHFSA-N 1 2 227.283 2.119 20 0 BEADLO Cc1nnc([C@H](C)[N@H+]2CC[C@H](C)[C@H](F)C2)o1 ZINC000679219243 488318744 /nfs/dbraw/zinc/31/87/44/488318744.db2.gz FMQIKBQNHNWOPQ-OYNCUSHFSA-N 1 2 227.283 2.119 20 0 BEADLO Cc1nc(C[N@H+]2CC[C@H](C)[C@H](F)C2)oc1C ZINC000679221426 488319880 /nfs/dbraw/zinc/31/98/80/488319880.db2.gz KUNUOYZQWMDKTQ-GZMMTYOYSA-N 1 2 226.295 2.471 20 0 BEADLO Cc1nc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)oc1C ZINC000679221426 488319881 /nfs/dbraw/zinc/31/98/81/488319881.db2.gz KUNUOYZQWMDKTQ-GZMMTYOYSA-N 1 2 226.295 2.471 20 0 BEADLO c1cc2c(s1)CCC[N@@H+](Cc1cnc[nH]1)C2 ZINC000684616166 488332245 /nfs/dbraw/zinc/33/22/45/488332245.db2.gz ANZMJVPXXLZLLO-UHFFFAOYSA-N 1 2 233.340 2.420 20 0 BEADLO c1cc2c(s1)CCC[N@H+](Cc1cnc[nH]1)C2 ZINC000684616166 488332246 /nfs/dbraw/zinc/33/22/46/488332246.db2.gz ANZMJVPXXLZLLO-UHFFFAOYSA-N 1 2 233.340 2.420 20 0 BEADLO CC(C)(C)c1noc(C[N@H+]2CC=CCC2)n1 ZINC000679323426 488337331 /nfs/dbraw/zinc/33/73/31/488337331.db2.gz IIZYMZHJITYXDO-UHFFFAOYSA-N 1 2 221.304 2.129 20 0 BEADLO CC(C)(C)c1noc(C[N@@H+]2CC=CCC2)n1 ZINC000679323426 488337333 /nfs/dbraw/zinc/33/73/33/488337333.db2.gz IIZYMZHJITYXDO-UHFFFAOYSA-N 1 2 221.304 2.129 20 0 BEADLO Cc1cc(C(=O)C[N@H+]2CC=CCC2)c(C)[nH]1 ZINC000679323352 488337375 /nfs/dbraw/zinc/33/73/75/488337375.db2.gz WBNKIGDXDKYCMK-UHFFFAOYSA-N 1 2 218.300 2.076 20 0 BEADLO Cc1cc(C(=O)C[N@@H+]2CC=CCC2)c(C)[nH]1 ZINC000679323352 488337377 /nfs/dbraw/zinc/33/73/77/488337377.db2.gz WBNKIGDXDKYCMK-UHFFFAOYSA-N 1 2 218.300 2.076 20 0 BEADLO Cc1ccc(F)cc1C[N@@H+]1CCc2c[nH]nc2C1 ZINC000679333021 488340681 /nfs/dbraw/zinc/34/06/81/488340681.db2.gz CFCNPSGIENBOOP-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO Cc1ccc(F)cc1C[N@H+]1CCc2c[nH]nc2C1 ZINC000679333021 488340684 /nfs/dbraw/zinc/34/06/84/488340684.db2.gz CFCNPSGIENBOOP-UHFFFAOYSA-N 1 2 245.301 2.416 20 0 BEADLO COc1ccc(N[C@H](C)CCn2cccn2)[nH+]c1 ZINC000679389973 488349472 /nfs/dbraw/zinc/34/94/72/488349472.db2.gz SFOUIVAVAFGPHH-LLVKDONJSA-N 1 2 246.314 2.177 20 0 BEADLO COCc1nc(C[N@H+](C)[C@@H](C)C(C)(C)C)no1 ZINC000679533350 488356653 /nfs/dbraw/zinc/35/66/53/488356653.db2.gz MRHDLVCJEAKFRU-VIFPVBQESA-N 1 2 241.335 2.082 20 0 BEADLO COCc1nc(C[N@@H+](C)[C@@H](C)C(C)(C)C)no1 ZINC000679533350 488356654 /nfs/dbraw/zinc/35/66/54/488356654.db2.gz MRHDLVCJEAKFRU-VIFPVBQESA-N 1 2 241.335 2.082 20 0 BEADLO Cc1nc(C[N@H+](C)CCCOC(C)(C)C)no1 ZINC000679822784 488366872 /nfs/dbraw/zinc/36/68/72/488366872.db2.gz FAQIAFWMWXAQFB-UHFFFAOYSA-N 1 2 241.335 2.015 20 0 BEADLO Cc1nc(C[N@@H+](C)CCCOC(C)(C)C)no1 ZINC000679822784 488366873 /nfs/dbraw/zinc/36/68/73/488366873.db2.gz FAQIAFWMWXAQFB-UHFFFAOYSA-N 1 2 241.335 2.015 20 0 BEADLO CCc1csc(N2CCn3cc(C)[nH+]c3C2)n1 ZINC000679845965 488368442 /nfs/dbraw/zinc/36/84/42/488368442.db2.gz NFAXQCUBWOGFPV-UHFFFAOYSA-N 1 2 248.355 2.231 20 0 BEADLO CC(C)=CC[N@@H+](C)Cc1nnc2ccccn21 ZINC000079441594 490058385 /nfs/dbraw/zinc/05/83/85/490058385.db2.gz UWSNCEGPLFKEMS-UHFFFAOYSA-N 1 2 230.315 2.127 20 0 BEADLO CC(C)=CC[N@H+](C)Cc1nnc2ccccn21 ZINC000079441594 490058387 /nfs/dbraw/zinc/05/83/87/490058387.db2.gz UWSNCEGPLFKEMS-UHFFFAOYSA-N 1 2 230.315 2.127 20 0 BEADLO COc1ccc(CNc2cc[nH+]c(C)n2)c(C)c1 ZINC000531706083 490258318 /nfs/dbraw/zinc/25/83/18/490258318.db2.gz VNHHRHDNZBHVJI-UHFFFAOYSA-N 1 2 243.310 2.136 20 0 BEADLO C[C@H]1C[C@H]([NH2+]Cc2ccsc2)c2ncnn21 ZINC000657571112 490285561 /nfs/dbraw/zinc/28/55/61/490285561.db2.gz WATUXQXACFSRGZ-WPRPVWTQSA-N 1 2 234.328 2.135 20 0 BEADLO CCCc1nsc(N[C@H](C)c2[nH]cc[nH+]2)n1 ZINC000125243219 490421662 /nfs/dbraw/zinc/42/16/62/490421662.db2.gz QRYSLGXPKYGMQF-SSDOTTSWSA-N 1 2 237.332 2.387 20 0 BEADLO C[C@@H]1CC[C@@H]1NC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000672668753 490615951 /nfs/dbraw/zinc/61/59/51/490615951.db2.gz PIYSPQRGLJOZJA-KOLCDFICSA-N 1 2 244.298 2.254 20 0 BEADLO CCC(CC)[C@H](O)C[NH2+][C@@H](C)c1cn[nH]c1C ZINC000305801375 490619866 /nfs/dbraw/zinc/61/98/66/490619866.db2.gz DWXXUEHYIPGVHI-TVQRCGJNSA-N 1 2 239.363 2.166 20 0 BEADLO CCC(CC)[C@@H](O)C[NH2+][C@H](C)c1cn[nH]c1C ZINC000305801373 490619877 /nfs/dbraw/zinc/61/98/77/490619877.db2.gz DWXXUEHYIPGVHI-RNCFNFMXSA-N 1 2 239.363 2.166 20 0 BEADLO CN(Cc1[nH]cc[nH+]1)C(=O)Nc1ccc(F)cc1 ZINC000080526771 490643316 /nfs/dbraw/zinc/64/33/16/490643316.db2.gz JTDKJCZYKPBKHI-UHFFFAOYSA-N 1 2 248.261 2.213 20 0 BEADLO CCc1cc(NC[C@@H]2CCCS2)nc[nH+]1 ZINC000087475450 491088923 /nfs/dbraw/zinc/08/89/23/491088923.db2.gz HFAYMIYAMKQXRZ-JTQLQIEISA-N 1 2 223.345 2.347 20 0 BEADLO CCc1cnc(C[NH2+][C@H](C)c2ccccn2)o1 ZINC000228577397 491095559 /nfs/dbraw/zinc/09/55/59/491095559.db2.gz ZKYWVMRLNIQARI-SNVBAGLBSA-N 1 2 231.299 2.483 20 0 BEADLO Cc1cn2ccc(NC(=O)NCC(C)C)cc2[nH+]1 ZINC000668150343 491117260 /nfs/dbraw/zinc/11/72/60/491117260.db2.gz WYVILQUBLWHNHS-UHFFFAOYSA-N 1 2 246.314 2.420 20 0 BEADLO CCc1cc(N[C@H](C)C2CCOCC2)nc[nH+]1 ZINC000230218028 491128703 /nfs/dbraw/zinc/12/87/03/491128703.db2.gz KESOXPXTUWBHLI-SNVBAGLBSA-N 1 2 235.331 2.266 20 0 BEADLO FC(F)(F)c1cc[nH+]c(NCc2cn[nH]c2)c1 ZINC000090802995 491129740 /nfs/dbraw/zinc/12/97/40/491129740.db2.gz HUVMCVFFPTYGJU-UHFFFAOYSA-N 1 2 242.204 2.436 20 0 BEADLO COc1ccc(NCc2ccc(OC)nc2)[nH+]c1 ZINC000231128977 491131634 /nfs/dbraw/zinc/13/16/34/491131634.db2.gz BIDFQNFDROXJPM-UHFFFAOYSA-N 1 2 245.282 2.106 20 0 BEADLO CC(C)(C)NC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000074904706 491132002 /nfs/dbraw/zinc/13/20/02/491132002.db2.gz NVDDIGVHRWZSFX-UHFFFAOYSA-N 1 2 232.287 2.254 20 0 BEADLO Cc1nc2[nH]ccc2c(NCC[C@H]2CCCO2)[nH+]1 ZINC000080945884 491133556 /nfs/dbraw/zinc/13/35/56/491133556.db2.gz HRQBZQBFWWNKIB-SNVBAGLBSA-N 1 2 246.314 2.247 20 0 BEADLO CCn1nc(C)c(C[NH2+][C@H](C)c2ncc[nH]2)c1C ZINC000307969698 491134902 /nfs/dbraw/zinc/13/49/02/491134902.db2.gz MATDEDIEEGOKKD-SNVBAGLBSA-N 1 2 247.346 2.094 20 0 BEADLO FC(F)C[NH2+][C@H](c1cccnc1)C1CC1 ZINC000308910220 491140065 /nfs/dbraw/zinc/14/00/65/491140065.db2.gz UEOBCHBERTUBHC-NSHDSACASA-N 1 2 212.243 2.387 20 0 BEADLO COc1ccc[nH+]c1N[C@H]1CCS[C@@H]1C ZINC000308963702 491141375 /nfs/dbraw/zinc/14/13/75/491141375.db2.gz TXEMZEYFERNBSS-BDAKNGLRSA-N 1 2 224.329 2.396 20 0 BEADLO CC(C)c1nc(N[C@@H](C)C[C@@H](C)O)cc[nH+]1 ZINC000309370818 491147652 /nfs/dbraw/zinc/14/76/52/491147652.db2.gz QKXYKWFOMBPVDH-VHSXEESVSA-N 1 2 223.320 2.171 20 0 BEADLO CC(C)c1nc(NC(C)(C)[C@H](C)O)cc[nH+]1 ZINC000309379951 491147684 /nfs/dbraw/zinc/14/76/84/491147684.db2.gz RVBWBIPHLQNTFF-VIFPVBQESA-N 1 2 223.320 2.171 20 0 BEADLO Cc1cc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)no1 ZINC000225249963 491162961 /nfs/dbraw/zinc/16/29/61/491162961.db2.gz IDXBDTCGFUIWRF-LDYMZIIASA-N 1 2 212.268 2.163 20 0 BEADLO Cc1cc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)no1 ZINC000225249963 491162962 /nfs/dbraw/zinc/16/29/62/491162962.db2.gz IDXBDTCGFUIWRF-LDYMZIIASA-N 1 2 212.268 2.163 20 0 BEADLO COC(=O)[C@@H]1CCC[C@H]([NH+]2CC(C)(F)C2)CC1 ZINC001172779044 974939820 /nfs/dbraw/zinc/93/98/20/974939820.db2.gz ADVJAYVPGJIHQJ-MNOVXSKESA-N 1 2 243.322 2.152 20 0 BEADLO C[C@@H]1C[C@H](C)[C@H](C)N(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492815370 533823342 /nfs/dbraw/zinc/82/33/42/533823342.db2.gz WVAIFADUWQGCTO-GQJJHNKNSA-N 1 2 247.342 2.316 20 0 BEADLO C[C@@H]1CCC[C@H](NC(=O)C=Cc2c[nH]c[nH+]2)[C@H]1C ZINC000493685787 533860163 /nfs/dbraw/zinc/86/01/63/533860163.db2.gz KUPIRCTWBQHRLC-AAQSVUAVSA-N 1 2 247.342 2.364 20 0 BEADLO CCOC(=O)[C@H](c1ccccc1)[N@H+](C)CC ZINC000171923614 535663296 /nfs/dbraw/zinc/66/32/96/535663296.db2.gz KQJMTWACTVDMJN-LBPRGKRZSA-N 1 2 221.300 2.243 20 0 BEADLO CCOC(=O)[C@H](c1ccccc1)[N@@H+](C)CC ZINC000171923614 535663301 /nfs/dbraw/zinc/66/33/01/535663301.db2.gz KQJMTWACTVDMJN-LBPRGKRZSA-N 1 2 221.300 2.243 20 0 BEADLO CC(C)OCCCNc1cccc([C@@H](C)O)[nH+]1 ZINC000891449176 582688319 /nfs/dbraw/zinc/68/83/19/582688319.db2.gz NHWAAQVYESOABH-LLVKDONJSA-N 1 2 238.331 2.362 20 0 BEADLO Cc1ccc(O)c(NC(=O)C=Cc2c[nH]c[nH+]2)c1 ZINC000492861054 534197850 /nfs/dbraw/zinc/19/78/50/534197850.db2.gz IZGNZIYZNONSJZ-HWKANZROSA-N 1 2 243.266 2.076 20 0 BEADLO C[C@@]1(NC(=O)/C=C/c2[nH]cc[nH+]2)CC=CCC1 ZINC000493592986 534272548 /nfs/dbraw/zinc/27/25/48/534272548.db2.gz XXZVNYVTFDEKFH-URWSZGRFSA-N 1 2 231.299 2.038 20 0 BEADLO C[C@@H](N(C)C(=O)C=Cc1c[nH]c[nH+]1)C1(C)CC1 ZINC000493380395 534280595 /nfs/dbraw/zinc/28/05/95/534280595.db2.gz FPUZUYSNYVKSFJ-UMCURTJPSA-N 1 2 233.315 2.070 20 0 BEADLO O=C(c1ccccc1)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000334322895 518202218 /nfs/dbraw/zinc/20/22/18/518202218.db2.gz IZFNLEQZTOHWGA-GFCCVEGCSA-N 1 2 241.294 2.387 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N[C@@H]1CC2CCC1CC2 ZINC000492774183 534802341 /nfs/dbraw/zinc/80/23/41/534802341.db2.gz WQVBKWYNJAZPQF-LKNPDKJVSA-N 1 2 245.326 2.118 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)N[C@H]1CC2CCC1CC2 ZINC000492774184 534804507 /nfs/dbraw/zinc/80/45/07/534804507.db2.gz WQVBKWYNJAZPQF-QAXQCIFRSA-N 1 2 245.326 2.118 20 0 BEADLO O=C(C=Cc1c[nH]c[nH+]1)Nc1ccsc1 ZINC000492820082 534805058 /nfs/dbraw/zinc/80/50/58/534805058.db2.gz AIMCTSBGETUPIB-UPHRSURJSA-N 1 2 219.269 2.123 20 0 BEADLO CC(C)(C)[C@H]1CCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000493161639 526729953 /nfs/dbraw/zinc/72/99/53/526729953.db2.gz TWPYABURWWGDHK-WYGGZMRJSA-N 1 2 247.342 2.318 20 0 BEADLO CC(C)(CCNC(=O)C=Cc1c[nH]c[nH+]1)C1CC1 ZINC000492991272 527032577 /nfs/dbraw/zinc/03/25/77/527032577.db2.gz HISVPWNIMLOYDR-WAYWQWQTSA-N 1 2 247.342 2.365 20 0 BEADLO CC(C)(C)/C=C/C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000493313243 527547928 /nfs/dbraw/zinc/54/79/28/527547928.db2.gz ADVTXORRBJOFOI-VOTSOKGWSA-N 1 2 235.331 2.363 20 0 BEADLO C/C=C/C=C\C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000493097622 527604959 /nfs/dbraw/zinc/60/49/59/527604959.db2.gz QPYVMZSGMNPVHT-DEQVHDEQSA-N 1 2 230.311 2.447 20 0 BEADLO CC(C)(C)C(C)(C)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000492901610 527617550 /nfs/dbraw/zinc/61/75/50/527617550.db2.gz ZDQNULOFGJNODJ-SREVYHEPSA-N 1 2 235.331 2.364 20 0 BEADLO CC(C)[C@H]1CCCCN1C(=O)/C=C\c1[nH]cc[nH+]1 ZINC000493716541 527758738 /nfs/dbraw/zinc/75/87/38/527758738.db2.gz CMIWLMGSTPEGLH-ZHRWSRJISA-N 1 2 247.342 2.460 20 0 BEADLO COCCC[N@H+](C)Cc1ncc(Cl)s1 ZINC000352011761 536513271 /nfs/dbraw/zinc/51/32/71/536513271.db2.gz UWXDRSMXZJSLKG-UHFFFAOYSA-N 1 2 234.752 2.265 20 0 BEADLO COCCC[N@@H+](C)Cc1ncc(Cl)s1 ZINC000352011761 536513274 /nfs/dbraw/zinc/51/32/74/536513274.db2.gz UWXDRSMXZJSLKG-UHFFFAOYSA-N 1 2 234.752 2.265 20 0 BEADLO CCCC1(C(=O)N(C)CCCn2cc[nH+]c2)CC1 ZINC000488309902 528021549 /nfs/dbraw/zinc/02/15/49/528021549.db2.gz FKDWZAXBIVUITF-UHFFFAOYSA-N 1 2 249.358 2.312 20 0 BEADLO CC(C)c1nc(N(C)[C@@H]2CCCC[C@H]2O)cc[nH+]1 ZINC000489988700 528365353 /nfs/dbraw/zinc/36/53/53/528365353.db2.gz UPWSNGJXNQSPNF-VXGBXAGGSA-N 1 2 249.358 2.340 20 0 BEADLO CCN(CCC1CC1)C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493123140 528407799 /nfs/dbraw/zinc/40/77/99/528407799.db2.gz UUYKNQFBKOUVAT-AATRIKPKSA-N 1 2 233.315 2.072 20 0 BEADLO CC(C)C[C@H]1CCCN1C(=O)C=Cc1c[nH]c[nH+]1 ZINC000493196959 528589356 /nfs/dbraw/zinc/58/93/56/528589356.db2.gz YCAYOPDEFXFKEQ-URWSZGRFSA-N 1 2 247.342 2.460 20 0 BEADLO CCN(C(=O)C=Cc1c[nH]c[nH+]1)C1CC(C)(C)C1 ZINC000493583632 528907682 /nfs/dbraw/zinc/90/76/82/528907682.db2.gz GLPTXPKVIVAFNO-AATRIKPKSA-N 1 2 247.342 2.460 20 0 BEADLO CCN(C(=O)/C=C/c1[nH]cc[nH+]1)[C@@H](C)C(C)C ZINC000493233694 528907810 /nfs/dbraw/zinc/90/78/10/528907810.db2.gz OAMJLBDNZKAGPQ-MLRMMBSGSA-N 1 2 235.331 2.316 20 0 BEADLO CC1(C)CCCCN(C(=O)C=Cc2c[nH]c[nH+]2)C1 ZINC000492864745 528909508 /nfs/dbraw/zinc/90/95/08/528909508.db2.gz NZOPUOBKOIJLII-AATRIKPKSA-N 1 2 247.342 2.462 20 0 BEADLO CCN(C(=O)/C=C\c1[nH]cc[nH+]1)[C@H](C)C(C)C ZINC000493233693 528911336 /nfs/dbraw/zinc/91/13/36/528911336.db2.gz OAMJLBDNZKAGPQ-JMEBYUIHSA-N 1 2 235.331 2.316 20 0 BEADLO CCN(C(=O)C=Cc1c[nH]c[nH+]1)[C@@H](C)C(C)C ZINC000493416301 528911626 /nfs/dbraw/zinc/91/16/26/528911626.db2.gz HMXGLHKMQAODCW-ZADCQDASSA-N 1 2 235.331 2.316 20 0 BEADLO CCC[C@@H](CC)NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493755028 528914829 /nfs/dbraw/zinc/91/48/29/528914829.db2.gz NRNPBCUPTHTYMM-VQCYPWCPSA-N 1 2 221.304 2.118 20 0 BEADLO CC1(C)CCC[C@@H]1CNC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493082369 528962900 /nfs/dbraw/zinc/96/29/00/528962900.db2.gz KQNVEMRDBFPEGU-MVIFTORASA-N 1 2 247.342 2.365 20 0 BEADLO CC(C)[C@H](NC(=O)OCC1CC1)c1[nH]cc[nH+]1 ZINC000496828822 529101261 /nfs/dbraw/zinc/10/12/61/529101261.db2.gz PHXUHPWGUGHIGD-JTQLQIEISA-N 1 2 237.303 2.243 20 0 BEADLO CC[C@@H]1CCCCN1C(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493391799 529267570 /nfs/dbraw/zinc/26/75/70/529267570.db2.gz AISQUFPRUFYAJY-XUIVZRPNSA-N 1 2 233.315 2.214 20 0 BEADLO CC[C@@H]1CCCN(C(=O)/C=C/c2[nH]cc[nH+]2)C1 ZINC000493821458 529291674 /nfs/dbraw/zinc/29/16/74/529291674.db2.gz LZKKAQLBSWGTLM-MVIFTORASA-N 1 2 233.315 2.072 20 0 BEADLO CC[C@@H]1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)CC1 ZINC000492768283 529291845 /nfs/dbraw/zinc/29/18/45/529291845.db2.gz OVDUTWWGMBIFIR-FOQNGQEVSA-N 1 2 247.342 2.462 20 0 BEADLO CC(C)[C@H](C)C(=O)NCc1ccc[nH+]c1N(C)C ZINC000171965888 534923322 /nfs/dbraw/zinc/92/33/22/534923322.db2.gz YSYINLNWYGSENG-NSHDSACASA-N 1 2 249.358 2.056 20 0 BEADLO CC(C)N(C)C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000335338211 534971838 /nfs/dbraw/zinc/97/18/38/534971838.db2.gz GYKPDLXTWBOBDY-JTQLQIEISA-N 1 2 236.319 2.007 20 0 BEADLO CCCc1nc(C[N@@H+]2CCC[C@@H]2C)no1 ZINC000076115237 535524339 /nfs/dbraw/zinc/52/43/39/535524339.db2.gz IEBFOEXBLAOWEG-VIFPVBQESA-N 1 2 209.293 2.006 20 0 BEADLO CCCc1nc(C[N@H+]2CCC[C@@H]2C)no1 ZINC000076115237 535524342 /nfs/dbraw/zinc/52/43/42/535524342.db2.gz IEBFOEXBLAOWEG-VIFPVBQESA-N 1 2 209.293 2.006 20 0 BEADLO CCc1nnc([C@@H](C)[N@@H+]2CC[C@@](C)(F)C2)o1 ZINC000335354774 535856872 /nfs/dbraw/zinc/85/68/72/535856872.db2.gz HFADDQWWQDUXCT-LDYMZIIASA-N 1 2 227.283 2.127 20 0 BEADLO CCc1nnc([C@@H](C)[N@H+]2CC[C@@](C)(F)C2)o1 ZINC000335354774 535856875 /nfs/dbraw/zinc/85/68/75/535856875.db2.gz HFADDQWWQDUXCT-LDYMZIIASA-N 1 2 227.283 2.127 20 0 BEADLO CC[C@H](C)[C@H](C)C(=O)NCCCn1cc[nH+]c1 ZINC000182891760 535928990 /nfs/dbraw/zinc/92/89/90/535928990.db2.gz FUTFOADMVSPDER-RYUDHWBXSA-N 1 2 237.347 2.072 20 0 BEADLO Cc1cncc([C@@H](C)[NH2+]Cc2cocn2)c1 ZINC000393792993 582925387 /nfs/dbraw/zinc/92/53/87/582925387.db2.gz GKOFTSIVYMHLOI-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO CCc1nc(C[N@@H+]2C[C@@H](C)CC[C@@H]2C)no1 ZINC000076149307 536139424 /nfs/dbraw/zinc/13/94/24/536139424.db2.gz QBPDSPHQNVMNDO-UWVGGRQHSA-N 1 2 223.320 2.252 20 0 BEADLO CCc1nc(C[N@H+]2C[C@@H](C)CC[C@@H]2C)no1 ZINC000076149307 536139427 /nfs/dbraw/zinc/13/94/27/536139427.db2.gz QBPDSPHQNVMNDO-UWVGGRQHSA-N 1 2 223.320 2.252 20 0 BEADLO CN(C)c1cc(N[C@@H]2CC=CCC2)[nH+]cn1 ZINC000892606027 582927276 /nfs/dbraw/zinc/92/72/76/582927276.db2.gz WEGOKIUQIHEKQT-SNVBAGLBSA-N 1 2 218.304 2.063 20 0 BEADLO CN(C)c1cc(N[C@@H]2CC=CCC2)nc[nH+]1 ZINC000892606027 582927279 /nfs/dbraw/zinc/92/72/79/582927279.db2.gz WEGOKIUQIHEKQT-SNVBAGLBSA-N 1 2 218.304 2.063 20 0 BEADLO COC(=O)C(C)(C)[N@H+](C)Cc1cccc(F)c1 ZINC000258666959 536427478 /nfs/dbraw/zinc/42/74/78/536427478.db2.gz BHUIBMVINKSBHS-UHFFFAOYSA-N 1 2 239.290 2.209 20 0 BEADLO COC(=O)C(C)(C)[N@@H+](C)Cc1cccc(F)c1 ZINC000258666959 536427479 /nfs/dbraw/zinc/42/74/79/536427479.db2.gz BHUIBMVINKSBHS-UHFFFAOYSA-N 1 2 239.290 2.209 20 0 BEADLO C[N@H+](Cc1cnns1)Cc1ccc(F)cc1 ZINC000347724101 536485645 /nfs/dbraw/zinc/48/56/45/536485645.db2.gz FKGDPKQYABGLTA-UHFFFAOYSA-N 1 2 237.303 2.309 20 0 BEADLO C[N@@H+](Cc1cnns1)Cc1ccc(F)cc1 ZINC000347724101 536485646 /nfs/dbraw/zinc/48/56/46/536485646.db2.gz FKGDPKQYABGLTA-UHFFFAOYSA-N 1 2 237.303 2.309 20 0 BEADLO COC(=O)[C@H]1CCCCC[N@@H+]1Cc1ccco1 ZINC000260313920 536765177 /nfs/dbraw/zinc/76/51/77/536765177.db2.gz ZSQABWZQQHJDPU-GFCCVEGCSA-N 1 2 237.299 2.197 20 0 BEADLO COC(=O)[C@H]1CCCCC[N@H+]1Cc1ccco1 ZINC000260313920 536765182 /nfs/dbraw/zinc/76/51/82/536765182.db2.gz ZSQABWZQQHJDPU-GFCCVEGCSA-N 1 2 237.299 2.197 20 0 BEADLO FC1(F)CC(C[N@@H+]2CCC(F)(F)C2)C1 ZINC000336270931 566306829 /nfs/dbraw/zinc/30/68/29/566306829.db2.gz KRQYLSWFWXDGDQ-UHFFFAOYSA-N 1 2 211.202 2.373 20 0 BEADLO FC1(F)CC(C[N@H+]2CCC(F)(F)C2)C1 ZINC000336270931 566306836 /nfs/dbraw/zinc/30/68/36/566306836.db2.gz KRQYLSWFWXDGDQ-UHFFFAOYSA-N 1 2 211.202 2.373 20 0 BEADLO c1cc(C[N@@H+]2CCO[C@@H](C3CCC3)C2)co1 ZINC000840955671 583184213 /nfs/dbraw/zinc/18/42/13/583184213.db2.gz XUUKJRPVLTWIEQ-CYBMUJFWSA-N 1 2 221.300 2.281 20 0 BEADLO c1cc(C[N@H+]2CCO[C@@H](C3CCC3)C2)co1 ZINC000840955671 583184215 /nfs/dbraw/zinc/18/42/15/583184215.db2.gz XUUKJRPVLTWIEQ-CYBMUJFWSA-N 1 2 221.300 2.281 20 0 BEADLO CC(C)c1c[nH]c(CN2CCOC(C)(C)C2)[nH+]1 ZINC000893962143 583258034 /nfs/dbraw/zinc/25/80/34/583258034.db2.gz INSUBKOCCGWQPZ-UHFFFAOYSA-N 1 2 237.347 2.144 20 0 BEADLO CCOC1CC[NH+](Cc2n[nH]c(C)c2C)CC1 ZINC000893954676 583261804 /nfs/dbraw/zinc/26/18/04/583261804.db2.gz OICZSBYZLPVVRU-UHFFFAOYSA-N 1 2 237.347 2.027 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2[nH]nc(C)c2C)C[C@H](C)O1 ZINC000893976052 583265436 /nfs/dbraw/zinc/26/54/36/583265436.db2.gz LYJGHEBDMDGVSL-JOYOIKCWSA-N 1 2 237.347 2.026 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2[nH]nc(C)c2C)C[C@H](C)O1 ZINC000893976052 583265437 /nfs/dbraw/zinc/26/54/37/583265437.db2.gz LYJGHEBDMDGVSL-JOYOIKCWSA-N 1 2 237.347 2.026 20 0 BEADLO COC(=O)Cc1cc[nH+]c(N(C)CC2CCC2)c1 ZINC000853316128 588732306 /nfs/dbraw/zinc/73/23/06/588732306.db2.gz IJJRENYVVJAEQM-UHFFFAOYSA-N 1 2 248.326 2.033 20 0 BEADLO Fc1cc(N2CCCC[C@H]2c2[nH]cc[nH+]2)ncn1 ZINC000853411626 588741668 /nfs/dbraw/zinc/74/16/68/588741668.db2.gz PEPCAJFVPXQKBK-VIFPVBQESA-N 1 2 247.277 2.070 20 0 BEADLO CO[C@@H](CO[NH+]=C(N)c1ccccc1)C1CCC1 ZINC000853637498 588751373 /nfs/dbraw/zinc/75/13/73/588751373.db2.gz UFDRYQCSDRZWQH-ZDUSSCGKSA-N 1 2 248.326 2.348 20 0 BEADLO Cc1nc(N[C@H](C)c2ncc[nH]2)c(C)c(C)[nH+]1 ZINC000853643626 588751871 /nfs/dbraw/zinc/75/18/71/588751871.db2.gz KWGICKWOIWNCSF-SECBINFHSA-N 1 2 231.303 2.298 20 0 BEADLO CC(C)=CCCO[NH+]=C(N)COC(C)C ZINC000853658489 588752933 /nfs/dbraw/zinc/75/29/33/588752933.db2.gz LVBZQKFEMFIDOT-UHFFFAOYSA-N 1 2 214.309 2.266 20 0 BEADLO C[C@@H]1CCCC[C@H]1CO[NH+]=C(N)[C@H]1CCCO1 ZINC000853698883 588757657 /nfs/dbraw/zinc/75/76/57/588757657.db2.gz URQNCCAUYDVGBB-GRYCIOLGSA-N 1 2 240.347 2.490 20 0 BEADLO C[C@H](O)CCSCc1cc[nH+]c(N(C)C)c1 ZINC000853772663 588762516 /nfs/dbraw/zinc/76/25/16/588762516.db2.gz WSHLKTNGEKOEIN-JTQLQIEISA-N 1 2 240.372 2.152 20 0 BEADLO C1=C[C@@H](Nc2cc(NC3CC3)[nH+]cn2)CC1 ZINC000853800620 588764087 /nfs/dbraw/zinc/76/40/87/588764087.db2.gz WUQNLTDVLCLBFZ-SECBINFHSA-N 1 2 216.288 2.181 20 0 BEADLO C1=C[C@@H](Nc2cc(NC3CC3)nc[nH+]2)CC1 ZINC000853800620 588764088 /nfs/dbraw/zinc/76/40/88/588764088.db2.gz WUQNLTDVLCLBFZ-SECBINFHSA-N 1 2 216.288 2.181 20 0 BEADLO Cc1nc(N[C@@H]2C[C@H](O)c3ccccc32)cc[nH+]1 ZINC000853837473 588765407 /nfs/dbraw/zinc/76/54/07/588765407.db2.gz GJCPMYOZYDLRQX-OLZOCXBDSA-N 1 2 241.294 2.375 20 0 BEADLO Cc1nc(N[C@H]2C[C@@H](O)c3ccccc32)cc[nH+]1 ZINC000853837475 588765441 /nfs/dbraw/zinc/76/54/41/588765441.db2.gz GJCPMYOZYDLRQX-QWHCGFSZSA-N 1 2 241.294 2.375 20 0 BEADLO FC1(F)[C@@H]2CCCO[C@@]21CNc1cccc[nH+]1 ZINC000853848044 588765886 /nfs/dbraw/zinc/76/58/86/588765886.db2.gz MNAGDSCYTQWYSZ-KOLCDFICSA-N 1 2 240.253 2.308 20 0 BEADLO CC(C)c1nc(N2C[C@H]3COC[C@@]3(C)C2)cc[nH+]1 ZINC000853858488 588766294 /nfs/dbraw/zinc/76/62/94/588766294.db2.gz MYFJOGWHVCZDSN-SMDDNHRTSA-N 1 2 247.342 2.073 20 0 BEADLO CC(C)c1nc(NC[C@H](CO)CC2CC2)cc[nH+]1 ZINC000853869468 588766735 /nfs/dbraw/zinc/76/67/35/588766735.db2.gz VWWYOEABXCBKBT-GFCCVEGCSA-N 1 2 249.358 2.421 20 0 BEADLO Cc1cc(N2CC[C@@H](O)C2(C)C)nc(C2CC2)[nH+]1 ZINC000853899129 588767917 /nfs/dbraw/zinc/76/79/17/588767917.db2.gz REOFJXUSYORQMG-LLVKDONJSA-N 1 2 247.342 2.012 20 0 BEADLO CC[NH2+]Cc1noc([C@H](C)Cc2ccco2)n1 ZINC000854132061 588775769 /nfs/dbraw/zinc/77/57/69/588775769.db2.gz JTVDDLZMVZIQOX-SECBINFHSA-N 1 2 235.287 2.118 20 0 BEADLO CC[C@H]1CC[C@H](NC(=O)Cc2[nH]cc[nH+]2)CC1 ZINC000854637454 588798573 /nfs/dbraw/zinc/79/85/73/588798573.db2.gz BRZZUZRWEQKDEW-XYPYZODXSA-N 1 2 235.331 2.037 20 0 BEADLO CC[C@H]1CCCC[C@H]1CNC(=O)Cc1[nH]cc[nH+]1 ZINC000854741179 588804897 /nfs/dbraw/zinc/80/48/97/588804897.db2.gz KEAYUZRFSQKQOM-RYUDHWBXSA-N 1 2 249.358 2.285 20 0 BEADLO CCC(F)(F)C(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000854845194 588813177 /nfs/dbraw/zinc/81/31/77/588813177.db2.gz KTHNYJNUVIFKCR-SFYZADRCSA-N 1 2 243.257 2.050 20 0 BEADLO CC[C@H](NC(=O)Cc1[nH]cc[nH+]1)C1CCCC1 ZINC000854854171 588813634 /nfs/dbraw/zinc/81/36/34/588813634.db2.gz OGRQCGCPMBDALE-NSHDSACASA-N 1 2 235.331 2.037 20 0 BEADLO CCCCCCC(=O)N[C@H]1CCn2cc[nH+]c2C1 ZINC000779095797 582659046 /nfs/dbraw/zinc/65/90/46/582659046.db2.gz MVRUAPGCZCXUPQ-LBPRGKRZSA-N 1 2 249.358 2.285 20 0 BEADLO C[C@H](O)c1cccc(NCCc2ccccn2)[nH+]1 ZINC000891427167 582682576 /nfs/dbraw/zinc/68/25/76/582682576.db2.gz RJBHNBGVINWRPV-NSHDSACASA-N 1 2 243.310 2.185 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnn(C3CCC3)c2)[C@H](C)CO1 ZINC000891672935 582708730 /nfs/dbraw/zinc/70/87/30/582708730.db2.gz ZIFZNLFCIKJHJQ-VXGBXAGGSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnn(C3CCC3)c2)[C@H](C)CO1 ZINC000891672935 582708732 /nfs/dbraw/zinc/70/87/32/582708732.db2.gz ZIFZNLFCIKJHJQ-VXGBXAGGSA-N 1 2 249.358 2.217 20 0 BEADLO COc1ccc2ccc(N[C@@H](C)CO)[nH+]c2c1 ZINC000891684350 582709966 /nfs/dbraw/zinc/70/99/66/582709966.db2.gz KKBXFKXODYXCAH-VIFPVBQESA-N 1 2 232.283 2.036 20 0 BEADLO CCOc1ccc(C[N@@H+]2CCOC[C@@H]2CC)o1 ZINC000891716569 582713125 /nfs/dbraw/zinc/71/31/25/582713125.db2.gz SPKZNCASFVSSFK-NSHDSACASA-N 1 2 239.315 2.289 20 0 BEADLO CCOc1ccc(C[N@H+]2CCOC[C@@H]2CC)o1 ZINC000891716569 582713126 /nfs/dbraw/zinc/71/31/26/582713126.db2.gz SPKZNCASFVSSFK-NSHDSACASA-N 1 2 239.315 2.289 20 0 BEADLO C[C@@H](Cc1ccco1)Nc1cc(N(C)C)nc[nH+]1 ZINC000891762245 582717326 /nfs/dbraw/zinc/71/73/26/582717326.db2.gz DNAOLZOYQKZBCG-JTQLQIEISA-N 1 2 246.314 2.179 20 0 BEADLO C[C@@H](Cc1ccco1)Nc1cc(N(C)C)[nH+]cn1 ZINC000891762245 582717329 /nfs/dbraw/zinc/71/73/29/582717329.db2.gz DNAOLZOYQKZBCG-JTQLQIEISA-N 1 2 246.314 2.179 20 0 BEADLO CC[C@@H]1CCCN(c2nccn3c[nH+]cc23)C1 ZINC000891784403 582721031 /nfs/dbraw/zinc/72/10/31/582721031.db2.gz WSLHFQIHNRETDG-LLVKDONJSA-N 1 2 230.315 2.356 20 0 BEADLO C[N@@H+](Cc1nccn1C1CC1)C[C@@H]1CCCCO1 ZINC000891787158 582721355 /nfs/dbraw/zinc/72/13/55/582721355.db2.gz QPILDJYANNQOLI-ZDUSSCGKSA-N 1 2 249.358 2.219 20 0 BEADLO C[N@H+](Cc1nccn1C1CC1)C[C@@H]1CCCCO1 ZINC000891787158 582721356 /nfs/dbraw/zinc/72/13/56/582721356.db2.gz QPILDJYANNQOLI-ZDUSSCGKSA-N 1 2 249.358 2.219 20 0 BEADLO CCc1cc(N2CCOC(C)(C)C2)nc(CC)[nH+]1 ZINC000891793329 582721856 /nfs/dbraw/zinc/72/18/56/582721856.db2.gz JNHNQFNVNBJVKG-UHFFFAOYSA-N 1 2 249.358 2.217 20 0 BEADLO CC[C@@H]1CN(Cc2[nH+]ccn2C2CC2)C[C@@H](C)O1 ZINC000891805452 582724674 /nfs/dbraw/zinc/72/46/74/582724674.db2.gz JGLURSIBERDGOX-DGCLKSJQSA-N 1 2 249.358 2.217 20 0 BEADLO CC[C@H]1CN(Cc2[nH+]ccn2C2CC2)C[C@@H](C)O1 ZINC000891805455 582724767 /nfs/dbraw/zinc/72/47/67/582724767.db2.gz JGLURSIBERDGOX-YPMHNXCESA-N 1 2 249.358 2.217 20 0 BEADLO Cc1ccc(CCNc2cc(N(C)C)nc[nH+]2)o1 ZINC000891811364 582725627 /nfs/dbraw/zinc/72/56/27/582725627.db2.gz CXGJWLYDURAJBG-UHFFFAOYSA-N 1 2 246.314 2.099 20 0 BEADLO Cc1ccc(CCNc2cc(N(C)C)[nH+]cn2)o1 ZINC000891811364 582725629 /nfs/dbraw/zinc/72/56/29/582725629.db2.gz CXGJWLYDURAJBG-UHFFFAOYSA-N 1 2 246.314 2.099 20 0 BEADLO CCC1CCN(c2nccn3c[nH+]cc23)CC1 ZINC000891919478 582738029 /nfs/dbraw/zinc/73/80/29/582738029.db2.gz XVURRQPLMFTYGV-UHFFFAOYSA-N 1 2 230.315 2.356 20 0 BEADLO COc1ccc2ccc(N(C)C[C@@H](C)O)[nH+]c2c1 ZINC000892004641 582759458 /nfs/dbraw/zinc/75/94/58/582759458.db2.gz KAUPWAKMJZLRMR-SNVBAGLBSA-N 1 2 246.310 2.060 20 0 BEADLO Cc1cc(CNc2cccc([C@H](C)O)[nH+]2)on1 ZINC000892019438 582762387 /nfs/dbraw/zinc/76/23/87/582762387.db2.gz SXFSWOCTHIAGKZ-VIFPVBQESA-N 1 2 233.271 2.043 20 0 BEADLO C[C@H]1CCC[N@@H+]1Cc1nc(Br)c[nH]1 ZINC000892018737 582762550 /nfs/dbraw/zinc/76/25/50/582762550.db2.gz FZBKNNNNXBJEEW-ZETCQYMHSA-N 1 2 244.136 2.157 20 0 BEADLO C[C@H]1CCC[N@H+]1Cc1nc(Br)c[nH]1 ZINC000892018737 582762551 /nfs/dbraw/zinc/76/25/51/582762551.db2.gz FZBKNNNNXBJEEW-ZETCQYMHSA-N 1 2 244.136 2.157 20 0 BEADLO Cc1cc(C[N@H+]2CCO[C@H](C)[C@@H]2C)cnc1F ZINC000892049262 582774488 /nfs/dbraw/zinc/77/44/88/582774488.db2.gz QKUUXBCNUZWNSM-WDEREUQCSA-N 1 2 238.306 2.138 20 0 BEADLO Cc1cc(C[N@@H+]2CCO[C@H](C)[C@@H]2C)cnc1F ZINC000892049262 582774491 /nfs/dbraw/zinc/77/44/91/582774491.db2.gz QKUUXBCNUZWNSM-WDEREUQCSA-N 1 2 238.306 2.138 20 0 BEADLO C[C@@H]1OCC[N@H+](Cc2ccnn2C2CCC2)[C@H]1C ZINC000892050517 582776191 /nfs/dbraw/zinc/77/61/91/582776191.db2.gz ZMJQQUKSARFGGG-RYUDHWBXSA-N 1 2 249.358 2.217 20 0 BEADLO C[C@@H]1OCC[N@@H+](Cc2ccnn2C2CCC2)[C@H]1C ZINC000892050517 582776195 /nfs/dbraw/zinc/77/61/95/582776195.db2.gz ZMJQQUKSARFGGG-RYUDHWBXSA-N 1 2 249.358 2.217 20 0 BEADLO CCOc1ccc(C[N@H+](C)Cc2cn[nH]c2)o1 ZINC000892050172 582776458 /nfs/dbraw/zinc/77/64/58/582776458.db2.gz RISNJPIAHOVTOM-UHFFFAOYSA-N 1 2 235.287 2.033 20 0 BEADLO CCOc1ccc(C[N@@H+](C)Cc2cn[nH]c2)o1 ZINC000892050172 582776461 /nfs/dbraw/zinc/77/64/61/582776461.db2.gz RISNJPIAHOVTOM-UHFFFAOYSA-N 1 2 235.287 2.033 20 0 BEADLO Cc1nn(C)c(C[N@@H+]2CCC2(C)C)c1Cl ZINC000892057421 582776679 /nfs/dbraw/zinc/77/66/79/582776679.db2.gz HJNLSSJPNIBQTF-UHFFFAOYSA-N 1 2 227.739 2.366 20 0 BEADLO Cc1nn(C)c(C[N@H+]2CCC2(C)C)c1Cl ZINC000892057421 582776682 /nfs/dbraw/zinc/77/66/82/582776682.db2.gz HJNLSSJPNIBQTF-UHFFFAOYSA-N 1 2 227.739 2.366 20 0 BEADLO CCCCC1(NC(=O)[C@@H](C)Cc2c[nH+]c[nH]2)CC1 ZINC000889526819 582817855 /nfs/dbraw/zinc/81/78/55/582817855.db2.gz TYJPFECHPSEOSL-NSHDSACASA-N 1 2 249.358 2.427 20 0 BEADLO CCCCC1(NC(=O)[C@@H](C)Cc2c[nH]c[nH+]2)CC1 ZINC000889526819 582817856 /nfs/dbraw/zinc/81/78/56/582817856.db2.gz TYJPFECHPSEOSL-NSHDSACASA-N 1 2 249.358 2.427 20 0 BEADLO Cc1nn(C[N@H+]2CC[C@H](C)C2)c(=S)s1 ZINC000725780353 582848316 /nfs/dbraw/zinc/84/83/16/582848316.db2.gz XXJDLUUJYOXFIP-ZETCQYMHSA-N 1 2 229.374 2.282 20 0 BEADLO Cc1nn(C[N@@H+]2CC[C@H](C)C2)c(=S)s1 ZINC000725780353 582848317 /nfs/dbraw/zinc/84/83/17/582848317.db2.gz XXJDLUUJYOXFIP-ZETCQYMHSA-N 1 2 229.374 2.282 20 0 BEADLO Cc1noc(C)c1[C@@H](C)[NH2+][C@@H](C)c1nccn1C ZINC000092326933 582855367 /nfs/dbraw/zinc/85/53/67/582855367.db2.gz VHPZNLYAJWNWCF-SCZZXKLOSA-N 1 2 248.330 2.437 20 0 BEADLO CCc1cc(C[NH2+]Cc2ccc(OC)o2)on1 ZINC000892398280 582875854 /nfs/dbraw/zinc/87/58/54/582875854.db2.gz ZCHYNNQWVURCDF-UHFFFAOYSA-N 1 2 236.271 2.128 20 0 BEADLO COc1nccc(C[NH2+]Cc2ccco2)c1F ZINC000892429519 582885980 /nfs/dbraw/zinc/88/59/80/582885980.db2.gz MYFZWFGNYGTCSS-UHFFFAOYSA-N 1 2 236.246 2.112 20 0 BEADLO CCC[C@H](O)CNc1cc(CC)[nH+]c(CC)n1 ZINC000892503206 582899609 /nfs/dbraw/zinc/89/96/09/582899609.db2.gz ZLFSEHMPRTYXNZ-NSHDSACASA-N 1 2 237.347 2.174 20 0 BEADLO COc1ccc(C[NH2+]Cc2csc(C)n2)nc1 ZINC000892512381 582903164 /nfs/dbraw/zinc/90/31/64/582903164.db2.gz RMXYJPBAGDLWHX-UHFFFAOYSA-N 1 2 249.339 2.145 20 0 BEADLO Cc1cc(N(C)CC(C)(C)O)nc(C2CCC2)[nH+]1 ZINC000892541145 582908904 /nfs/dbraw/zinc/90/89/04/582908904.db2.gz ZTEUIYBUTKFTFC-UHFFFAOYSA-N 1 2 249.358 2.260 20 0 BEADLO CC1(C)C[C@@]1(C)NC(=O)c1cccc2[nH+]ccn21 ZINC000856135777 588862408 /nfs/dbraw/zinc/86/24/08/588862408.db2.gz WYPNEOOFRBVMIQ-CQSZACIVSA-N 1 2 243.310 2.253 20 0 BEADLO CSC[C@H](C)Nc1cccc([C@H](C)O)[nH+]1 ZINC000892604073 582926360 /nfs/dbraw/zinc/92/63/60/582926360.db2.gz XPYNAQRGBPPVCG-IUCAKERBSA-N 1 2 226.345 2.298 20 0 BEADLO C[C@H](CCO)Nc1cc(C2CC2)[nH+]c(C2CC2)n1 ZINC000892617155 582931228 /nfs/dbraw/zinc/93/12/28/582931228.db2.gz SWKDFYBOCWAQBR-SECBINFHSA-N 1 2 247.342 2.414 20 0 BEADLO CNc1cc(N[C@H](C)CC(C)(C)OC)[nH+]cn1 ZINC000892678760 582951848 /nfs/dbraw/zinc/95/18/48/582951848.db2.gz HPZSFZXUEUFBEK-SECBINFHSA-N 1 2 238.335 2.134 20 0 BEADLO C[C@@H](CNC(=O)Cc1[nH]cc[nH+]1)C1CCCCC1 ZINC000856226324 588865014 /nfs/dbraw/zinc/86/50/14/588865014.db2.gz GNXHYCNJTALKTJ-NSHDSACASA-N 1 2 249.358 2.285 20 0 BEADLO C[C@@H](NC(=O)/C=C/C(C)(C)C)c1[nH+]ccn1C ZINC000856278041 588866502 /nfs/dbraw/zinc/86/65/02/588866502.db2.gz WFZRBGRTZUEXGN-VQCYPWCPSA-N 1 2 235.331 2.200 20 0 BEADLO C[C@H](NC(=O)/C=C\C1CCCC1)c1[nH+]ccn1C ZINC000856280912 588867080 /nfs/dbraw/zinc/86/70/80/588867080.db2.gz ZRFVIRHRWAYVEM-TVRMLOFPSA-N 1 2 247.342 2.344 20 0 BEADLO C[C@H](O)c1cccc(NCC2(C)CC2)[nH+]1 ZINC000892796256 582984198 /nfs/dbraw/zinc/98/41/98/582984198.db2.gz PNAXMZUSGGBUGS-VIFPVBQESA-N 1 2 206.289 2.347 20 0 BEADLO Cc1cc(N[C@H](CO)C(C)C)nc(C2CCC2)[nH+]1 ZINC000892846856 582995662 /nfs/dbraw/zinc/99/56/62/582995662.db2.gz UNTFYQCKKRMQLI-GFCCVEGCSA-N 1 2 249.358 2.481 20 0 BEADLO C[C@H](N(C)c1cc(N(C)C)[nH+]cn1)C1(C)CC1 ZINC000892873296 583000750 /nfs/dbraw/zinc/00/07/50/583000750.db2.gz MJQOSJVKIGWORO-JTQLQIEISA-N 1 2 234.347 2.167 20 0 BEADLO C[C@H](N(C)c1cc(N(C)C)nc[nH+]1)C1(C)CC1 ZINC000892873296 583000751 /nfs/dbraw/zinc/00/07/51/583000751.db2.gz MJQOSJVKIGWORO-JTQLQIEISA-N 1 2 234.347 2.167 20 0 BEADLO C[C@@H](N(C)c1cc(N(C)C)[nH+]cn1)C1(C)CC1 ZINC000892873297 583001251 /nfs/dbraw/zinc/00/12/51/583001251.db2.gz MJQOSJVKIGWORO-SNVBAGLBSA-N 1 2 234.347 2.167 20 0 BEADLO C[C@@H](N(C)c1cc(N(C)C)nc[nH+]1)C1(C)CC1 ZINC000892873297 583001253 /nfs/dbraw/zinc/00/12/53/583001253.db2.gz MJQOSJVKIGWORO-SNVBAGLBSA-N 1 2 234.347 2.167 20 0 BEADLO CC[C@@]1(C)CCN(c2cc(N(C)C)[nH+]cn2)C1 ZINC000892900347 583007586 /nfs/dbraw/zinc/00/75/86/583007586.db2.gz LARPQIGZRVTQBI-ZDUSSCGKSA-N 1 2 234.347 2.169 20 0 BEADLO CC[C@@]1(C)CCN(c2cc(N(C)C)nc[nH+]2)C1 ZINC000892900347 583007588 /nfs/dbraw/zinc/00/75/88/583007588.db2.gz LARPQIGZRVTQBI-ZDUSSCGKSA-N 1 2 234.347 2.169 20 0 BEADLO CC[C@H]1C[N@H+](Cc2cccc(F)n2)[C@@H](C)CO1 ZINC000852211419 583009663 /nfs/dbraw/zinc/00/96/63/583009663.db2.gz JZZSCWFKSMBECR-JQWIXIFHSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2cccc(F)n2)[C@@H](C)CO1 ZINC000852211419 583009665 /nfs/dbraw/zinc/00/96/65/583009665.db2.gz JZZSCWFKSMBECR-JQWIXIFHSA-N 1 2 238.306 2.220 20 0 BEADLO C[C@H](O)c1cccc(NCCc2ccncc2)[nH+]1 ZINC000892930108 583011516 /nfs/dbraw/zinc/01/15/16/583011516.db2.gz RJIDUGCYWNBRAP-NSHDSACASA-N 1 2 243.310 2.185 20 0 BEADLO CCc1cc(N2CCO[C@@H](C)[C@H]2C)nc(CC)[nH+]1 ZINC000892941662 583013418 /nfs/dbraw/zinc/01/34/18/583013418.db2.gz GJJGZHQASXVGQS-MNOVXSKESA-N 1 2 249.358 2.215 20 0 BEADLO COCC[N@H+](CCF)[C@H](C)c1ccccn1 ZINC000852481561 583014432 /nfs/dbraw/zinc/01/44/32/583014432.db2.gz MXWJSBOSVNXRQF-LLVKDONJSA-N 1 2 226.295 2.061 20 0 BEADLO COCC[N@@H+](CCF)[C@H](C)c1ccccn1 ZINC000852481561 583014433 /nfs/dbraw/zinc/01/44/33/583014433.db2.gz MXWJSBOSVNXRQF-LLVKDONJSA-N 1 2 226.295 2.061 20 0 BEADLO c1c(N[C@@H]2CCOC2)nc(C2CC2)[nH+]c1C1CC1 ZINC000892953768 583018621 /nfs/dbraw/zinc/01/86/21/583018621.db2.gz JCLBNJARHZWGHG-LLVKDONJSA-N 1 2 245.326 2.432 20 0 BEADLO C[C@H](Nc1cc(N(C)C)nc[nH+]1)C1CCC1 ZINC000892983890 583025496 /nfs/dbraw/zinc/02/54/96/583025496.db2.gz PGKMMSMPYNTYSS-VIFPVBQESA-N 1 2 220.320 2.143 20 0 BEADLO C[C@H](Nc1cc(N(C)C)[nH+]cn1)C1CCC1 ZINC000892983890 583025497 /nfs/dbraw/zinc/02/54/97/583025497.db2.gz PGKMMSMPYNTYSS-VIFPVBQESA-N 1 2 220.320 2.143 20 0 BEADLO CCCSC[C@H](C)[NH2+]Cc1cn[nH]c1C ZINC000892985781 583025666 /nfs/dbraw/zinc/02/56/66/583025666.db2.gz OCHKESHRXVZHSW-VIFPVBQESA-N 1 2 227.377 2.339 20 0 BEADLO C[C@@H](Nc1cc(N(C)C)nc[nH+]1)c1ccc[nH]1 ZINC000893020579 583031311 /nfs/dbraw/zinc/03/13/11/583031311.db2.gz ATFLTAITFVFUBJ-SECBINFHSA-N 1 2 231.303 2.044 20 0 BEADLO C[C@@H](Nc1cc(N(C)C)[nH+]cn1)c1ccc[nH]1 ZINC000893020579 583031313 /nfs/dbraw/zinc/03/13/13/583031313.db2.gz ATFLTAITFVFUBJ-SECBINFHSA-N 1 2 231.303 2.044 20 0 BEADLO Cc1cncc(CNc2cccc([C@@H](C)O)[nH+]2)c1 ZINC000893023510 583032060 /nfs/dbraw/zinc/03/20/60/583032060.db2.gz RUBAGURXKPUTNW-LLVKDONJSA-N 1 2 243.310 2.450 20 0 BEADLO Cc1nn(C(C)C)c(C)c1C[NH2+]Cc1ccon1 ZINC000893098953 583049139 /nfs/dbraw/zinc/04/91/39/583049139.db2.gz UCDLNUYZJBIBQI-UHFFFAOYSA-N 1 2 248.330 2.359 20 0 BEADLO Cc1cc(Br)cc(N2CC(F)C2)[nH+]1 ZINC000893136504 583055865 /nfs/dbraw/zinc/05/58/65/583055865.db2.gz UMWAHAHPWUWXAA-UHFFFAOYSA-N 1 2 245.095 2.311 20 0 BEADLO CCc1cc(N2CC(C)C2)nc(CC)[nH+]1 ZINC000893198751 583068954 /nfs/dbraw/zinc/06/89/54/583068954.db2.gz XNNLRRUSOIUNNQ-UHFFFAOYSA-N 1 2 205.305 2.058 20 0 BEADLO COc1ccc(CNc2c[nH+]ccc2OC)o1 ZINC000893197857 583069285 /nfs/dbraw/zinc/06/92/85/583069285.db2.gz QEKQJVNVESRQQJ-UHFFFAOYSA-N 1 2 234.255 2.304 20 0 BEADLO Cc1nnc(CNc2ccc[nH+]c2C)s1 ZINC000893199267 583069814 /nfs/dbraw/zinc/06/98/14/583069814.db2.gz UQFIOSBYFOXHNK-UHFFFAOYSA-N 1 2 220.301 2.162 20 0 BEADLO Cc1nc(C[NH+]2C[C@H](C)O[C@@H](C)C2)sc1C ZINC000081643086 583083297 /nfs/dbraw/zinc/08/32/97/583083297.db2.gz PUTIIVXAWNMMPJ-IUCAKERBSA-N 1 2 240.372 2.369 20 0 BEADLO CC1(C)CC(NC(=O)c2cccc3[nH+]ccn32)C1 ZINC000856337381 588867848 /nfs/dbraw/zinc/86/78/48/588867848.db2.gz MFEWWNYQWWAZSM-UHFFFAOYSA-N 1 2 243.310 2.253 20 0 BEADLO Cc1ccc(O)c(C[NH2+][C@H]2CCCC2(F)F)n1 ZINC000398013958 583116725 /nfs/dbraw/zinc/11/67/25/583116725.db2.gz UZWAFKJXZNWXPE-NSHDSACASA-N 1 2 242.269 2.373 20 0 BEADLO CC(C)c1nc(N2CC[C@@H](C)[C@@H](CO)C2)cc[nH+]1 ZINC000856780662 588877549 /nfs/dbraw/zinc/87/75/49/588877549.db2.gz NWNJPJGDYGMNCW-VXGBXAGGSA-N 1 2 249.358 2.055 20 0 BEADLO CC(C)c1nc(N2CC[C@H](C)[C@@H](CO)C2)cc[nH+]1 ZINC000856780660 588877604 /nfs/dbraw/zinc/87/76/04/588877604.db2.gz NWNJPJGDYGMNCW-NWDGAFQWSA-N 1 2 249.358 2.055 20 0 BEADLO CO[C@@H](C)CNc1cc(C)[nH+]c(C2CCC2)n1 ZINC000893397231 583136222 /nfs/dbraw/zinc/13/62/22/583136222.db2.gz PAGBJAKRYXJXKC-JTQLQIEISA-N 1 2 235.331 2.499 20 0 BEADLO CC1CCC(=CC(=O)NCCn2cc[nH+]c2)CC1 ZINC000114634965 588878950 /nfs/dbraw/zinc/87/89/50/588878950.db2.gz BPQVIJONPGODMW-UHFFFAOYSA-N 1 2 247.342 2.136 20 0 BEADLO FC(F)[C@@H]([NH2+]CC1OCCO1)C1CCCCC1 ZINC000856824057 588879113 /nfs/dbraw/zinc/87/91/13/588879113.db2.gz YOVPNIFTUSPLCN-NSHDSACASA-N 1 2 249.301 2.163 20 0 BEADLO CCOCC[N@H+](C)Cc1c(Cl)n[nH]c1CC ZINC000893426661 583141750 /nfs/dbraw/zinc/14/17/50/583141750.db2.gz HQUPQMGSERUXFF-UHFFFAOYSA-N 1 2 245.754 2.094 20 0 BEADLO CCOCC[N@@H+](C)Cc1c(Cl)n[nH]c1CC ZINC000893426661 583141752 /nfs/dbraw/zinc/14/17/52/583141752.db2.gz HQUPQMGSERUXFF-UHFFFAOYSA-N 1 2 245.754 2.094 20 0 BEADLO Cc1cc(N2C[C@@H](O)C[C@H]2C)nc(C2CCC2)[nH+]1 ZINC000893428097 583142267 /nfs/dbraw/zinc/14/22/67/583142267.db2.gz REZFRTOHBOOJSJ-PWSUYJOCSA-N 1 2 247.342 2.012 20 0 BEADLO C[C@@H]1CC2(CCC2)CN1c1nccn2c[nH+]cc12 ZINC000893499516 583154038 /nfs/dbraw/zinc/15/40/38/583154038.db2.gz STJPZNVETZIAKV-LLVKDONJSA-N 1 2 242.326 2.498 20 0 BEADLO CNc1cc(N2CC3(CCC3)C[C@@H]2C)nc[nH+]1 ZINC000893498941 583154080 /nfs/dbraw/zinc/15/40/80/583154080.db2.gz RFRZSZILTUCPSM-JTQLQIEISA-N 1 2 232.331 2.287 20 0 BEADLO CNc1cc(N2CC3(CCC3)C[C@@H]2C)[nH+]cn1 ZINC000893498941 583154082 /nfs/dbraw/zinc/15/40/82/583154082.db2.gz RFRZSZILTUCPSM-JTQLQIEISA-N 1 2 232.331 2.287 20 0 BEADLO CC[C@H](C)C(=O)O[C@H]1CCn2c(C)c[nH+]c21 ZINC000893519455 583156106 /nfs/dbraw/zinc/15/61/06/583156106.db2.gz QALUUQNSDOEYCW-WPRPVWTQSA-N 1 2 222.288 2.226 20 0 BEADLO COCCCC1(C[NH+]2CC(F)C2)CCC1 ZINC000893522314 583156949 /nfs/dbraw/zinc/15/69/49/583156949.db2.gz PPDZBVRSBIZXIT-UHFFFAOYSA-N 1 2 215.312 2.237 20 0 BEADLO C/C=C(/C)C(=O)O[C@H]1CCn2c(C)c[nH+]c21 ZINC000893524701 583157282 /nfs/dbraw/zinc/15/72/82/583157282.db2.gz KKCZJUGGYHHKOB-PENHIPQLSA-N 1 2 220.272 2.146 20 0 BEADLO COc1ccc2ccc(NCCCCO)[nH+]c2c1 ZINC000893545931 583161441 /nfs/dbraw/zinc/16/14/41/583161441.db2.gz YBBCCQSZUXSFHL-UHFFFAOYSA-N 1 2 246.310 2.428 20 0 BEADLO C[C@H]1CC[N@H+](Cc2cn(C)nc2Cl)C[C@@H]1F ZINC000857035768 588882763 /nfs/dbraw/zinc/88/27/63/588882763.db2.gz BIKAZCPMCJYEIR-WPRPVWTQSA-N 1 2 245.729 2.253 20 0 BEADLO C[C@H]1CC[N@@H+](Cc2cn(C)nc2Cl)C[C@@H]1F ZINC000857035768 588882764 /nfs/dbraw/zinc/88/27/64/588882764.db2.gz BIKAZCPMCJYEIR-WPRPVWTQSA-N 1 2 245.729 2.253 20 0 BEADLO CN(CCCO)c1cc(C2CC2)[nH+]c(C2CC2)n1 ZINC000893692105 583200175 /nfs/dbraw/zinc/20/01/75/583200175.db2.gz YYSNCVZOHLXBTJ-UHFFFAOYSA-N 1 2 247.342 2.050 20 0 BEADLO C[C@H](O)c1cccc(N[C@@H]2CSC[C@@H]2C)[nH+]1 ZINC000893829448 583227357 /nfs/dbraw/zinc/22/73/57/583227357.db2.gz YNDKXTZEJKPCCP-ATZCPNFKSA-N 1 2 238.356 2.298 20 0 BEADLO Fc1ccc2nc(N3CCCC[NH2+]3)oc2c1 ZINC000893832994 583228064 /nfs/dbraw/zinc/22/80/64/583228064.db2.gz MWZNEJQIHNZAEO-UHFFFAOYSA-N 1 2 221.235 2.072 20 0 BEADLO CC(C)SCCNc1cc(N(C)C)nc[nH+]1 ZINC000893850383 583232896 /nfs/dbraw/zinc/23/28/96/583232896.db2.gz XHRWLNKNDYSATG-UHFFFAOYSA-N 1 2 240.376 2.096 20 0 BEADLO CC(C)SCCNc1cc(N(C)C)[nH+]cn1 ZINC000893850383 583232897 /nfs/dbraw/zinc/23/28/97/583232897.db2.gz XHRWLNKNDYSATG-UHFFFAOYSA-N 1 2 240.376 2.096 20 0 BEADLO CCC[N@H+](CC)Cc1ncc(C(=O)OC)s1 ZINC000893864039 583234356 /nfs/dbraw/zinc/23/43/56/583234356.db2.gz QCVJKZIFSKNPQO-UHFFFAOYSA-N 1 2 242.344 2.162 20 0 BEADLO CCC[N@@H+](CC)Cc1ncc(C(=O)OC)s1 ZINC000893864039 583234358 /nfs/dbraw/zinc/23/43/58/583234358.db2.gz QCVJKZIFSKNPQO-UHFFFAOYSA-N 1 2 242.344 2.162 20 0 BEADLO Cc1n[nH]c(C[N@H+](C)Cc2ccco2)c1C ZINC000893905582 583242547 /nfs/dbraw/zinc/24/25/47/583242547.db2.gz QSNALBRVCYTILN-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO Cc1n[nH]c(C[N@@H+](C)Cc2ccco2)c1C ZINC000893905582 583242551 /nfs/dbraw/zinc/24/25/51/583242551.db2.gz QSNALBRVCYTILN-UHFFFAOYSA-N 1 2 219.288 2.252 20 0 BEADLO C[C@@H]1CN(Cc2[nH+]ccn2C2CC2)[C@@H](C)[C@@H](C)O1 ZINC000893888421 583244199 /nfs/dbraw/zinc/24/41/99/583244199.db2.gz IYDOIQJTMXRXML-GRYCIOLGSA-N 1 2 249.358 2.216 20 0 BEADLO CCCSC[C@H](C)[NH2+][C@H](C)C(=O)OCC ZINC000893951623 583260425 /nfs/dbraw/zinc/26/04/25/583260425.db2.gz XJRLKPZSIGZJJB-VHSXEESVSA-N 1 2 233.377 2.059 20 0 BEADLO CC(C)c1c[nH]c(CN2C[C@@H](C)OC[C@H]2C)[nH+]1 ZINC000893952809 583261457 /nfs/dbraw/zinc/26/14/57/583261457.db2.gz MAPCGOWJUHAIIG-GHMZBOCLSA-N 1 2 237.347 2.142 20 0 BEADLO CO[C@H]1CCC[N@H+](Cc2nc(C(C)C)c[nH]2)C1 ZINC000893960090 583262667 /nfs/dbraw/zinc/26/26/67/583262667.db2.gz RPZRPPOSECZERA-NSHDSACASA-N 1 2 237.347 2.144 20 0 BEADLO CO[C@H]1CCC[N@@H+](Cc2nc(C(C)C)c[nH]2)C1 ZINC000893960090 583262671 /nfs/dbraw/zinc/26/26/71/583262671.db2.gz RPZRPPOSECZERA-NSHDSACASA-N 1 2 237.347 2.144 20 0 BEADLO CC(C)c1c[nH]c(CN2CCOCC23CCC3)[nH+]1 ZINC000894035695 583279872 /nfs/dbraw/zinc/27/98/72/583279872.db2.gz KPZKFDHXAVAWKX-UHFFFAOYSA-N 1 2 249.358 2.288 20 0 BEADLO CC[C@](C)(CNc1cccc([C@H](C)O)[nH+]1)OC ZINC000894053117 583290312 /nfs/dbraw/zinc/29/03/12/583290312.db2.gz INIVBOCWYWWJHP-GXFFZTMASA-N 1 2 238.331 2.362 20 0 BEADLO CN(C)c1cc(N2C[C@@H]3CCCC[C@@H]3C2)nc[nH+]1 ZINC000894067002 583293463 /nfs/dbraw/zinc/29/34/63/583293463.db2.gz GHZICSJESJOYHC-TXEJJXNPSA-N 1 2 246.358 2.169 20 0 BEADLO CN(C)c1cc(N2C[C@@H]3CCCC[C@@H]3C2)[nH+]cn1 ZINC000894067002 583293464 /nfs/dbraw/zinc/29/34/64/583293464.db2.gz GHZICSJESJOYHC-TXEJJXNPSA-N 1 2 246.358 2.169 20 0 BEADLO Cc1coc(C[N@H+]2CCC[C@H]2c2nncn2C)c1 ZINC000894077331 583297184 /nfs/dbraw/zinc/29/71/84/583297184.db2.gz ZSJYXTJFMBOSKM-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1coc(C[N@@H+]2CCC[C@H]2c2nncn2C)c1 ZINC000894077331 583297186 /nfs/dbraw/zinc/29/71/86/583297186.db2.gz ZSJYXTJFMBOSKM-LBPRGKRZSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1[nH]nc(C[N@H+]2[C@H](C)CC[C@@H]2C)c1C ZINC000894095255 583301063 /nfs/dbraw/zinc/30/10/63/583301063.db2.gz QJVCYNOORILBJK-DTORHVGOSA-N 1 2 207.321 2.399 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2[C@H](C)CC[C@@H]2C)c1C ZINC000894095255 583301065 /nfs/dbraw/zinc/30/10/65/583301065.db2.gz QJVCYNOORILBJK-DTORHVGOSA-N 1 2 207.321 2.399 20 0 BEADLO O[C@H]1C[C@@H](Nc2cc(C3CC3)[nH+]c(C3CC3)n2)C1 ZINC000894117658 583310427 /nfs/dbraw/zinc/31/04/27/583310427.db2.gz DDDJNXDNRFLEIR-PHIMTYICSA-N 1 2 245.326 2.167 20 0 BEADLO CNc1cc(N[C@H]2CCC[C@@H]3C[C@@H]32)[nH+]cn1 ZINC000894168004 583324038 /nfs/dbraw/zinc/32/40/38/583324038.db2.gz PMQCLYXXXDMEMB-UTLUCORTSA-N 1 2 218.304 2.119 20 0 BEADLO COCC[C@H](C)CNc1cccc([C@H](C)O)[nH+]1 ZINC000894184761 583332430 /nfs/dbraw/zinc/33/24/30/583332430.db2.gz GADMCVBDHHZDBZ-QWRGUYRKSA-N 1 2 238.331 2.219 20 0 BEADLO C[C@@H](O)c1cccc(N[C@H]2CS[C@H](C)C2)[nH+]1 ZINC000894194063 583333325 /nfs/dbraw/zinc/33/33/25/583333325.db2.gz JHGZQVQWHSEPQL-OPRDCNLKSA-N 1 2 238.356 2.441 20 0 BEADLO CN(Cc1c[nH+]c[nH]1)Cc1nc(Cl)cs1 ZINC000877620815 583339528 /nfs/dbraw/zinc/33/95/28/583339528.db2.gz YLOHFMDYWWIPQY-UHFFFAOYSA-N 1 2 242.735 2.152 20 0 BEADLO CN(Cc1c[nH]c[nH+]1)Cc1nc(Cl)cs1 ZINC000877620815 583339531 /nfs/dbraw/zinc/33/95/31/583339531.db2.gz YLOHFMDYWWIPQY-UHFFFAOYSA-N 1 2 242.735 2.152 20 0 BEADLO Cc1cnnc(NCc2cc(C)[nH+]c(C)c2)c1 ZINC000894239544 583387191 /nfs/dbraw/zinc/38/71/91/583387191.db2.gz OJRTZJRJDSACCU-UHFFFAOYSA-N 1 2 228.299 2.409 20 0 BEADLO CCn1c[nH+]cc1CNc1ccnc(F)c1F ZINC000857226579 588896158 /nfs/dbraw/zinc/89/61/58/588896158.db2.gz RTXUDSNWSUYUJO-UHFFFAOYSA-N 1 2 238.241 2.188 20 0 BEADLO C[C@@H](O)c1cccc(N[C@@H]2C[C@H]3C[C@H]3C2)[nH+]1 ZINC000894281441 583408565 /nfs/dbraw/zinc/40/85/65/583408565.db2.gz QSVVRZNDSKWWKK-CHWFTXMASA-N 1 2 218.300 2.345 20 0 BEADLO CC1(C)C[N@H+](CN2CCC2=O)[C@@H]1c1ccccc1 ZINC000857231738 588896780 /nfs/dbraw/zinc/89/67/80/588896780.db2.gz QOVZUBNQJLFEKO-CQSZACIVSA-N 1 2 244.338 2.259 20 0 BEADLO CC1(C)C[N@@H+](CN2CCC2=O)[C@@H]1c1ccccc1 ZINC000857231738 588896781 /nfs/dbraw/zinc/89/67/81/588896781.db2.gz QOVZUBNQJLFEKO-CQSZACIVSA-N 1 2 244.338 2.259 20 0 BEADLO Cc1ncoc1CNc1c[nH+]cc(C)c1 ZINC000894358111 583437065 /nfs/dbraw/zinc/43/70/65/583437065.db2.gz CCFTUQAXFVJBSM-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO Cc1ncoc1C[NH2+][C@@H](C)c1nnc(C(C)C)[nH]1 ZINC000894365816 583438643 /nfs/dbraw/zinc/43/86/43/583438643.db2.gz AJLGDMCONHSUCV-VIFPVBQESA-N 1 2 249.318 2.075 20 0 BEADLO CCN(CCSC)c1cccc([C@@H](C)O)[nH+]1 ZINC000894365362 583439004 /nfs/dbraw/zinc/43/90/04/583439004.db2.gz AXNLCUQCPICZDE-SNVBAGLBSA-N 1 2 240.372 2.324 20 0 BEADLO CCC[C@H]([NH2+]Cc1sccc1C)C(=O)OC ZINC000336741493 583439604 /nfs/dbraw/zinc/43/96/04/583439604.db2.gz RGSAVKZUULXLPQ-JTQLQIEISA-N 1 2 241.356 2.488 20 0 BEADLO C/C(=C\c1ccccc1)C[N@H+](C)CN1CCC1=O ZINC000857234440 588899037 /nfs/dbraw/zinc/89/90/37/588899037.db2.gz KNLPEHAFIXXWIN-JLHYYAGUSA-N 1 2 244.338 2.212 20 0 BEADLO C/C(=C\c1ccccc1)C[N@@H+](C)CN1CCC1=O ZINC000857234440 588899038 /nfs/dbraw/zinc/89/90/38/588899038.db2.gz KNLPEHAFIXXWIN-JLHYYAGUSA-N 1 2 244.338 2.212 20 0 BEADLO CO[C@@H]1CCC[N@H+](Cc2n[nH]c(C)c2C)CC1 ZINC000894441578 583458147 /nfs/dbraw/zinc/45/81/47/583458147.db2.gz PGGKTCXKYMKVRJ-GFCCVEGCSA-N 1 2 237.347 2.027 20 0 BEADLO CO[C@@H]1CCC[N@@H+](Cc2n[nH]c(C)c2C)CC1 ZINC000894441578 583458149 /nfs/dbraw/zinc/45/81/49/583458149.db2.gz PGGKTCXKYMKVRJ-GFCCVEGCSA-N 1 2 237.347 2.027 20 0 BEADLO CCN(Cc1c(C)cc[nH+]c1N)CC(F)F ZINC000894456508 583464784 /nfs/dbraw/zinc/46/47/84/583464784.db2.gz RWGPKDFQQFIFEN-UHFFFAOYSA-N 1 2 229.274 2.059 20 0 BEADLO Cc1ccc2c(c1)OCCN2Cc1c[nH+]c[nH]1 ZINC000894470356 583468967 /nfs/dbraw/zinc/46/89/67/583468967.db2.gz MGHRMHYBXXRBDL-UHFFFAOYSA-N 1 2 229.283 2.117 20 0 BEADLO Cc1ccc2c(c1)OCCN2Cc1c[nH]c[nH+]1 ZINC000894470356 583468968 /nfs/dbraw/zinc/46/89/68/583468968.db2.gz MGHRMHYBXXRBDL-UHFFFAOYSA-N 1 2 229.283 2.117 20 0 BEADLO C[C@H]1CN(Cc2c[nH+]c[nH]2)c2ccccc2O1 ZINC000894471921 583469139 /nfs/dbraw/zinc/46/91/39/583469139.db2.gz UROVOBDFXCLLGP-JTQLQIEISA-N 1 2 229.283 2.197 20 0 BEADLO C[C@H]1CN(Cc2c[nH]c[nH+]2)c2ccccc2O1 ZINC000894471921 583469141 /nfs/dbraw/zinc/46/91/41/583469141.db2.gz UROVOBDFXCLLGP-JTQLQIEISA-N 1 2 229.283 2.197 20 0 BEADLO Fc1cccc2c1OCC[C@@H]2[NH2+]Cc1cnc[nH]1 ZINC000894534072 583479084 /nfs/dbraw/zinc/47/90/84/583479084.db2.gz XOAWWBQYMPRYIV-LBPRGKRZSA-N 1 2 247.273 2.162 20 0 BEADLO C[C@@H](O)c1cccc(N[C@@H]2COC3(CCC3)C2)[nH+]1 ZINC000894541096 583481265 /nfs/dbraw/zinc/48/12/65/583481265.db2.gz HDYOAKQWBNNHGY-MNOVXSKESA-N 1 2 248.326 2.258 20 0 BEADLO CC[C@@H](O)CNc1cc(C2CC2)[nH+]c(C2CC2)n1 ZINC000894549457 583482988 /nfs/dbraw/zinc/48/29/88/583482988.db2.gz DTIDOCCDQSQLBA-LLVKDONJSA-N 1 2 247.342 2.414 20 0 BEADLO Cc1nn(C)c(C[NH+]2CC(C3CC3)C2)c1Cl ZINC000894564475 583484148 /nfs/dbraw/zinc/48/41/48/583484148.db2.gz CDANABVNVPQVLL-UHFFFAOYSA-N 1 2 239.750 2.224 20 0 BEADLO CN(Cc1cnc(C2CC2)s1)Cc1[nH]cc[nH+]1 ZINC000894586357 583489305 /nfs/dbraw/zinc/48/93/05/583489305.db2.gz OCDNZNLLERCLBN-UHFFFAOYSA-N 1 2 248.355 2.376 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ncc[nH]2)cc(C)c1O ZINC000894585346 583489829 /nfs/dbraw/zinc/48/98/29/583489829.db2.gz FMKWLLZUYPGRHE-UHFFFAOYSA-N 1 2 245.326 2.364 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ncc[nH]2)cc(C)c1O ZINC000894585346 583489831 /nfs/dbraw/zinc/48/98/31/583489831.db2.gz FMKWLLZUYPGRHE-UHFFFAOYSA-N 1 2 245.326 2.364 20 0 BEADLO Cc1n[nH]c(C[N@H+]2C[C@@H](C)O[C@H](C3CC3)C2)c1C ZINC000894598236 583493602 /nfs/dbraw/zinc/49/36/02/583493602.db2.gz XKXPTDFUHKBCBZ-OTYXRUKQSA-N 1 2 249.358 2.026 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2C[C@@H](C)O[C@H](C3CC3)C2)c1C ZINC000894598236 583493605 /nfs/dbraw/zinc/49/36/05/583493605.db2.gz XKXPTDFUHKBCBZ-OTYXRUKQSA-N 1 2 249.358 2.026 20 0 BEADLO Cc1n[nH]c(C[N@H+]2C[C@@H](C)O[C@@H](C3CC3)C2)c1C ZINC000894598243 583493683 /nfs/dbraw/zinc/49/36/83/583493683.db2.gz XKXPTDFUHKBCBZ-YMTOWFKASA-N 1 2 249.358 2.026 20 0 BEADLO Cc1n[nH]c(C[N@@H+]2C[C@@H](C)O[C@@H](C3CC3)C2)c1C ZINC000894598243 583493685 /nfs/dbraw/zinc/49/36/85/583493685.db2.gz XKXPTDFUHKBCBZ-YMTOWFKASA-N 1 2 249.358 2.026 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1nc(C(C)(C)C)co1 ZINC000894613604 583494454 /nfs/dbraw/zinc/49/44/54/583494454.db2.gz ZVWGDOPEHDNWPL-JTQLQIEISA-N 1 2 238.331 2.193 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1nc(C(C)(C)C)co1 ZINC000894613604 583494455 /nfs/dbraw/zinc/49/44/55/583494455.db2.gz ZVWGDOPEHDNWPL-JTQLQIEISA-N 1 2 238.331 2.193 20 0 BEADLO COC[C@H]1CC[N@@H+]1Cc1cc(C)cnc1Cl ZINC000894613237 583494849 /nfs/dbraw/zinc/49/48/49/583494849.db2.gz UMJKJHHZBVSEST-LLVKDONJSA-N 1 2 240.734 2.264 20 0 BEADLO COC[C@H]1CC[N@H+]1Cc1cc(C)cnc1Cl ZINC000894613237 583494850 /nfs/dbraw/zinc/49/48/50/583494850.db2.gz UMJKJHHZBVSEST-LLVKDONJSA-N 1 2 240.734 2.264 20 0 BEADLO COc1nccc(C[N@@H+]2C[C@@H](C)[C@@H]2C)c1F ZINC000894628636 583496816 /nfs/dbraw/zinc/49/68/16/583496816.db2.gz QBYQSUWZUMGSIP-BDAKNGLRSA-N 1 2 224.279 2.070 20 0 BEADLO COc1nccc(C[N@H+]2C[C@@H](C)[C@@H]2C)c1F ZINC000894628636 583496818 /nfs/dbraw/zinc/49/68/18/583496818.db2.gz QBYQSUWZUMGSIP-BDAKNGLRSA-N 1 2 224.279 2.070 20 0 BEADLO COc1ccc2ccc(N[C@H]3C[C@H](O)C3)[nH+]c2c1 ZINC000894641222 583499123 /nfs/dbraw/zinc/49/91/23/583499123.db2.gz ODNNNOIZHNAQAD-XYPYZODXSA-N 1 2 244.294 2.179 20 0 BEADLO COC(=O)c1ccc(C[NH+]2CC3(CC3)C2)c(F)c1 ZINC000894663038 583501078 /nfs/dbraw/zinc/50/10/78/583501078.db2.gz FJUXNJAORNTIFD-UHFFFAOYSA-N 1 2 249.285 2.208 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2cnn(C3CCC3)c2)C1 ZINC000894669914 583502963 /nfs/dbraw/zinc/50/29/63/583502963.db2.gz ALNLWJSTHPOTJH-LLVKDONJSA-N 1 2 223.295 2.152 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2cnn(C3CCC3)c2)C1 ZINC000894669914 583502965 /nfs/dbraw/zinc/50/29/65/583502965.db2.gz ALNLWJSTHPOTJH-LLVKDONJSA-N 1 2 223.295 2.152 20 0 BEADLO F[C@@H]1CC[N@H+](Cc2cnn(CC3CCC3)c2)C1 ZINC000894670344 583503004 /nfs/dbraw/zinc/50/30/04/583503004.db2.gz FYHGOJGCAWYCSJ-CYBMUJFWSA-N 1 2 237.322 2.227 20 0 BEADLO F[C@@H]1CC[N@@H+](Cc2cnn(CC3CCC3)c2)C1 ZINC000894670344 583503005 /nfs/dbraw/zinc/50/30/05/583503005.db2.gz FYHGOJGCAWYCSJ-CYBMUJFWSA-N 1 2 237.322 2.227 20 0 BEADLO F[C@H]1CC[N@H+](Cc2cnn(CC3CCC3)c2)C1 ZINC000894670346 583503447 /nfs/dbraw/zinc/50/34/47/583503447.db2.gz FYHGOJGCAWYCSJ-ZDUSSCGKSA-N 1 2 237.322 2.227 20 0 BEADLO F[C@H]1CC[N@@H+](Cc2cnn(CC3CCC3)c2)C1 ZINC000894670346 583503448 /nfs/dbraw/zinc/50/34/48/583503448.db2.gz FYHGOJGCAWYCSJ-ZDUSSCGKSA-N 1 2 237.322 2.227 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CCC[C@@H]2[C@@H]2CCCO2)c1C ZINC000894691025 583508732 /nfs/dbraw/zinc/50/87/32/583508732.db2.gz UPRCWIOPDFLXSD-KGLIPLIRSA-N 1 2 249.358 2.170 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)c1C ZINC000894691025 583508735 /nfs/dbraw/zinc/50/87/35/583508735.db2.gz UPRCWIOPDFLXSD-KGLIPLIRSA-N 1 2 249.358 2.170 20 0 BEADLO Cc1cc(NC[C@H]2C[C@@H](O)C2)nc(C2CCC2)[nH+]1 ZINC000894775513 583518493 /nfs/dbraw/zinc/51/84/93/583518493.db2.gz MXCBCTVXYWQZSJ-KLPPZKSPSA-N 1 2 247.342 2.235 20 0 BEADLO Cc1c[nH]c(CNc2cc(CC(C)C)ncn2)[nH+]1 ZINC000894791443 583520652 /nfs/dbraw/zinc/52/06/52/583520652.db2.gz ZPKFOOKLFQFINT-UHFFFAOYSA-N 1 2 245.330 2.319 20 0 BEADLO CCC1C[NH+](Cc2nccn2C2CC2)C1 ZINC000894813547 583523672 /nfs/dbraw/zinc/52/36/72/583523672.db2.gz SPUSRFAWNTZVRV-UHFFFAOYSA-N 1 2 205.305 2.060 20 0 BEADLO Cc1cc(F)ncc1C[NH+]1CC(C(F)F)C1 ZINC000894828977 583527088 /nfs/dbraw/zinc/52/70/88/583527088.db2.gz WEWPGYXAKQDQCE-UHFFFAOYSA-N 1 2 230.233 2.226 20 0 BEADLO Cc1coc(C[N@@H+](C)[C@@H]2CC(C)(C)OC2=O)c1 ZINC000894851338 583531691 /nfs/dbraw/zinc/53/16/91/583531691.db2.gz MZNAVFOBVPHWTM-LLVKDONJSA-N 1 2 237.299 2.114 20 0 BEADLO Cc1coc(C[N@H+](C)[C@@H]2CC(C)(C)OC2=O)c1 ZINC000894851338 583531693 /nfs/dbraw/zinc/53/16/93/583531693.db2.gz MZNAVFOBVPHWTM-LLVKDONJSA-N 1 2 237.299 2.114 20 0 BEADLO Cc1c(Cl)c(C[N@H+]2C[C@@H](C)[C@H]2C)nn1C ZINC000894861241 583534168 /nfs/dbraw/zinc/53/41/68/583534168.db2.gz CJSASKNTBCCNFC-HTQZYQBOSA-N 1 2 227.739 2.222 20 0 BEADLO Cc1c(Cl)c(C[N@@H+]2C[C@@H](C)[C@H]2C)nn1C ZINC000894861241 583534169 /nfs/dbraw/zinc/53/41/69/583534169.db2.gz CJSASKNTBCCNFC-HTQZYQBOSA-N 1 2 227.739 2.222 20 0 BEADLO CCc1nocc1C[N@H+](C)Cc1ocnc1C ZINC000894863594 583535958 /nfs/dbraw/zinc/53/59/58/583535958.db2.gz LNRXBBVDUVGBRE-UHFFFAOYSA-N 1 2 235.287 2.165 20 0 BEADLO CCc1nocc1C[N@@H+](C)Cc1ocnc1C ZINC000894863594 583535959 /nfs/dbraw/zinc/53/59/59/583535959.db2.gz LNRXBBVDUVGBRE-UHFFFAOYSA-N 1 2 235.287 2.165 20 0 BEADLO FCCC1CCN(c2nccn3c[nH+]cc23)CC1 ZINC000894906517 583553821 /nfs/dbraw/zinc/55/38/21/583553821.db2.gz QFXLVEXETUISLA-UHFFFAOYSA-N 1 2 248.305 2.305 20 0 BEADLO Cc1n[nH]c(C[NH+]2CC(CC(F)(F)F)C2)c1C ZINC000894976942 583562623 /nfs/dbraw/zinc/56/26/23/583562623.db2.gz MXIJHACXUXYBTC-UHFFFAOYSA-N 1 2 247.264 2.411 20 0 BEADLO Cc1ccc(CNc2cc(N(C)C)nc[nH+]2)o1 ZINC000894977227 583563540 /nfs/dbraw/zinc/56/35/40/583563540.db2.gz INBBWTSKUWZPRP-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO Cc1ccc(CNc2cc(N(C)C)[nH+]cn2)o1 ZINC000894977227 583563541 /nfs/dbraw/zinc/56/35/41/583563541.db2.gz INBBWTSKUWZPRP-UHFFFAOYSA-N 1 2 232.287 2.056 20 0 BEADLO CC(C)c1c[nH]c(C[N@@H+]2C[C@@H]3C[C@H]2CS3)n1 ZINC000894986141 583564547 /nfs/dbraw/zinc/56/45/47/583564547.db2.gz UQVCOUJIBOUPAN-UWVGGRQHSA-N 1 2 237.372 2.223 20 0 BEADLO CC(C)c1c[nH]c(C[N@H+]2C[C@@H]3C[C@H]2CS3)n1 ZINC000894986141 583564548 /nfs/dbraw/zinc/56/45/48/583564548.db2.gz UQVCOUJIBOUPAN-UWVGGRQHSA-N 1 2 237.372 2.223 20 0 BEADLO F[C@@]1(c2ccccc2)C[C@@H]1[NH2+]Cc1cnc[nH]1 ZINC000895053584 583574330 /nfs/dbraw/zinc/57/43/30/583574330.db2.gz OIFFKTWROVEUGO-QWHCGFSZSA-N 1 2 231.274 2.137 20 0 BEADLO F[C@]1(c2ccccc2)C[C@@H]1[NH2+]Cc1cnc[nH]1 ZINC000895053585 583574503 /nfs/dbraw/zinc/57/45/03/583574503.db2.gz OIFFKTWROVEUGO-STQMWFEESA-N 1 2 231.274 2.137 20 0 BEADLO CCCC(=O)N1CCC(Nc2cccc[nH+]2)CC1 ZINC000726968405 583577094 /nfs/dbraw/zinc/57/70/94/583577094.db2.gz OYYUVYSISDUMFM-UHFFFAOYSA-N 1 2 247.342 2.285 20 0 BEADLO c1cc(C[N@@H+]2CCc3nc[nH]c3C23CCC3)co1 ZINC000895068043 583578769 /nfs/dbraw/zinc/57/87/69/583578769.db2.gz GFIXJPKYYQLRSX-UHFFFAOYSA-N 1 2 243.310 2.440 20 0 BEADLO c1cc(C[N@H+]2CCc3nc[nH]c3C23CCC3)co1 ZINC000895068043 583578771 /nfs/dbraw/zinc/57/87/71/583578771.db2.gz GFIXJPKYYQLRSX-UHFFFAOYSA-N 1 2 243.310 2.440 20 0 BEADLO Cn1c[nH+]c(CSC(=S)N2CCCC2)c1 ZINC000882053464 583590512 /nfs/dbraw/zinc/59/05/12/583590512.db2.gz BQIQFRAQASZXRQ-UHFFFAOYSA-N 1 2 241.385 2.034 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2CCC[C@H]2CCO)c1C ZINC000882214756 583598689 /nfs/dbraw/zinc/59/86/89/583598689.db2.gz ZAWNANSUNUUIMZ-RYUDHWBXSA-N 1 2 235.331 2.056 20 0 BEADLO C=C/C=C\CCNc1cc(N(C)C)nc[nH+]1 ZINC000895131781 583601255 /nfs/dbraw/zinc/60/12/55/583601255.db2.gz KSDCNHXEJFFWND-WAYWQWQTSA-N 1 2 218.304 2.087 20 0 BEADLO C=C/C=C\CCNc1cc(N(C)C)[nH+]cn1 ZINC000895131781 583601257 /nfs/dbraw/zinc/60/12/57/583601257.db2.gz KSDCNHXEJFFWND-WAYWQWQTSA-N 1 2 218.304 2.087 20 0 BEADLO Cc1cc(C)c2c(c1)N(Cc1c[nH+]c[nH]1)CCO2 ZINC000895140329 583602943 /nfs/dbraw/zinc/60/29/43/583602943.db2.gz QCALNMCKBFSWMZ-UHFFFAOYSA-N 1 2 243.310 2.426 20 0 BEADLO Cc1cc(C)c2c(c1)N(Cc1c[nH]c[nH+]1)CCO2 ZINC000895140329 583602946 /nfs/dbraw/zinc/60/29/46/583602946.db2.gz QCALNMCKBFSWMZ-UHFFFAOYSA-N 1 2 243.310 2.426 20 0 BEADLO CC[C@H]1CN(Cc2[nH+]ccn2C2CC2)[C@@H](C)CO1 ZINC000895148704 583605520 /nfs/dbraw/zinc/60/55/20/583605520.db2.gz XCAWQZIUFIBAQW-AAEUAGOBSA-N 1 2 249.358 2.217 20 0 BEADLO CCc1cc(N2C[C@@H]3C[C@@H]3C2)nc(CC)[nH+]1 ZINC000895181679 583617786 /nfs/dbraw/zinc/61/77/86/583617786.db2.gz LFGSFWDIGHLUEH-AOOOYVTPSA-N 1 2 217.316 2.058 20 0 BEADLO Cc1[nH]c([C@H]2CCCN2c2ncccn2)[nH+]c1C ZINC000895192853 583622160 /nfs/dbraw/zinc/62/21/60/583622160.db2.gz JXLLWSSXQHSHEK-LLVKDONJSA-N 1 2 243.314 2.158 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)c1C ZINC000895192814 583622451 /nfs/dbraw/zinc/62/24/51/583622451.db2.gz NIMUPOAQKWOWSK-AAEUAGOBSA-N 1 2 219.332 2.401 20 0 BEADLO Cc1[nH]nc(C[N@H+]2C[C@@H]3CCCC[C@@H]32)c1C ZINC000895192814 583622453 /nfs/dbraw/zinc/62/24/53/583622453.db2.gz NIMUPOAQKWOWSK-AAEUAGOBSA-N 1 2 219.332 2.401 20 0 BEADLO Cc1[nH]c([C@H]2CCCN2c2cnccn2)[nH+]c1C ZINC000895197768 583623379 /nfs/dbraw/zinc/62/33/79/583623379.db2.gz VELPYQTZDNNEIV-LLVKDONJSA-N 1 2 243.314 2.158 20 0 BEADLO COc1cccc(C[NH2+]Cc2c[nH]cn2)c1C ZINC000895353709 583657472 /nfs/dbraw/zinc/65/74/72/583657472.db2.gz UGUBYZIMOVLZSI-UHFFFAOYSA-N 1 2 231.299 2.017 20 0 BEADLO OCc1cc[nH+]c(NCC[C@@H]2C[C@H]2C2CC2)c1 ZINC000895427465 583667899 /nfs/dbraw/zinc/66/78/99/583667899.db2.gz ULGZTEZNPZHPSQ-OLZOCXBDSA-N 1 2 232.327 2.422 20 0 BEADLO CCOC1CC(C[N@@H+]2CC[C@H]2C(F)F)C1 ZINC000895430725 583670281 /nfs/dbraw/zinc/67/02/81/583670281.db2.gz HFCDNQUXZPMZLK-RTBKNWGFSA-N 1 2 219.275 2.141 20 0 BEADLO CCOC1CC(C[N@H+]2CC[C@H]2C(F)F)C1 ZINC000895430725 583670282 /nfs/dbraw/zinc/67/02/82/583670282.db2.gz HFCDNQUXZPMZLK-RTBKNWGFSA-N 1 2 219.275 2.141 20 0 BEADLO CO[C@@H](CC(C)C)C[N@@H+]1CC[C@H]1C(F)F ZINC000895432050 583670575 /nfs/dbraw/zinc/67/05/75/583670575.db2.gz TZQIPIOCLRYNGG-UWVGGRQHSA-N 1 2 221.291 2.387 20 0 BEADLO CO[C@@H](CC(C)C)C[N@H+]1CC[C@H]1C(F)F ZINC000895432050 583670576 /nfs/dbraw/zinc/67/05/76/583670576.db2.gz TZQIPIOCLRYNGG-UWVGGRQHSA-N 1 2 221.291 2.387 20 0 BEADLO CC(C)c1c[nH]c(CN2CC[C@@H]2C(F)F)[nH+]1 ZINC000895431951 583671051 /nfs/dbraw/zinc/67/10/51/583671051.db2.gz YFAQYNROKYLHLX-SECBINFHSA-N 1 2 229.274 2.373 20 0 BEADLO FC(F)[C@@H]1CC[N@@H+]1C[C@H]1CCSC1 ZINC000895432857 583671507 /nfs/dbraw/zinc/67/15/07/583671507.db2.gz QUFMLFSFXXXIBP-SFYZADRCSA-N 1 2 207.289 2.079 20 0 BEADLO FC(F)[C@@H]1CC[N@H+]1C[C@H]1CCSC1 ZINC000895432857 583671509 /nfs/dbraw/zinc/67/15/09/583671509.db2.gz QUFMLFSFXXXIBP-SFYZADRCSA-N 1 2 207.289 2.079 20 0 BEADLO Cc1ncoc1C[NH2+]Cc1ncc(Cl)s1 ZINC000895475165 583679219 /nfs/dbraw/zinc/67/92/19/583679219.db2.gz SRGOFFQQBUSFDZ-UHFFFAOYSA-N 1 2 243.719 2.383 20 0 BEADLO COC(=O)CC(C)(C)CNc1cccc[nH+]1 ZINC000895507090 583681412 /nfs/dbraw/zinc/68/14/12/583681412.db2.gz LPKPDWHEZCRJQW-UHFFFAOYSA-N 1 2 222.288 2.083 20 0 BEADLO FC(F)C[NH2+]C[C@@H]1CC1(Cl)Cl ZINC000147703129 583699844 /nfs/dbraw/zinc/69/98/44/583699844.db2.gz SEXVFCRKGGFHJD-BYPYZUCNSA-N 1 2 204.047 2.035 20 0 BEADLO COc1ccc(CNc2c[nH+]cc(N(C)C)c2)o1 ZINC000895700734 583709496 /nfs/dbraw/zinc/70/94/96/583709496.db2.gz UFPPGRCACVSSOI-UHFFFAOYSA-N 1 2 247.298 2.361 20 0 BEADLO CN(C)c1c[nH+]cc(N[C@H]2COC3(CCC3)C2)c1 ZINC000895699066 583710696 /nfs/dbraw/zinc/71/06/96/583710696.db2.gz HRBDBJZFRGDELF-GFCCVEGCSA-N 1 2 247.342 2.271 20 0 BEADLO FC(F)c1noc(C[NH2+]Cc2ccsc2)n1 ZINC000895730272 583713446 /nfs/dbraw/zinc/71/34/46/583713446.db2.gz WUIOFQRACSVUDT-UHFFFAOYSA-N 1 2 245.254 2.359 20 0 BEADLO Cc1nnc(C[NH2+][C@@H]2CCCC[C@@H]2F)s1 ZINC000895745380 583715912 /nfs/dbraw/zinc/71/59/12/583715912.db2.gz DDHHZIWOIJJFRL-DTWKUNHWSA-N 1 2 229.324 2.217 20 0 BEADLO C[C@H]1CCN(c2[nH+]c3ccccc3n2C)CCO1 ZINC000895759284 583721325 /nfs/dbraw/zinc/72/13/25/583721325.db2.gz BFZIGZRWMISLFQ-NSHDSACASA-N 1 2 245.326 2.189 20 0 BEADLO Cc1ccc([C@@H](C)C[NH2+][C@H]2CCOC2=O)cc1 ZINC000895808936 583729511 /nfs/dbraw/zinc/72/95/11/583729511.db2.gz XAXZESKYVLMMHR-AAEUAGOBSA-N 1 2 233.311 2.004 20 0 BEADLO CC[C@@H](Cc1ccc(C)cc1)[NH2+][C@H]1CCOC1=O ZINC000895803738 583731513 /nfs/dbraw/zinc/73/15/13/583731513.db2.gz JUBAQPBBRUAREE-KBPBESRZSA-N 1 2 247.338 2.221 20 0 BEADLO Cc1[nH]nc(C[N@@H+]2CC[C@H]([C@H]3CCCO3)C2)c1C ZINC000895845919 583735725 /nfs/dbraw/zinc/73/57/25/583735725.db2.gz RPLQDOHBDDAIDA-GXTWGEPZSA-N 1 2 249.358 2.027 20 0 BEADLO Cc1[nH]nc(C[N@H+]2CC[C@H]([C@H]3CCCO3)C2)c1C ZINC000895845919 583735726 /nfs/dbraw/zinc/73/57/26/583735726.db2.gz RPLQDOHBDDAIDA-GXTWGEPZSA-N 1 2 249.358 2.027 20 0 BEADLO Cc1cc(N[C@@H]2COC[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000895905238 583741789 /nfs/dbraw/zinc/74/17/89/583741789.db2.gz KLADSHTWUNAPEF-GZMMTYOYSA-N 1 2 233.315 2.109 20 0 BEADLO CCc1cc(N[C@@H]2COC[C@@H]2C)nc(CC)[nH+]1 ZINC000895909596 583745291 /nfs/dbraw/zinc/74/52/91/583745291.db2.gz PPIQGQRRHZOKFX-GXSJLCMTSA-N 1 2 235.331 2.048 20 0 BEADLO CCCCc1cc(N[C@H]2COC[C@@H]2C)nc[nH+]1 ZINC000895910773 583745951 /nfs/dbraw/zinc/74/59/51/583745951.db2.gz WBTOPSIOOULPHH-JQWIXIFHSA-N 1 2 235.331 2.266 20 0 BEADLO O=C(N[C@H]1CCn2c[nH+]cc21)[C@H]1CCCC12CC2 ZINC000857976057 588926218 /nfs/dbraw/zinc/92/62/18/588926218.db2.gz WPJBFWXUQOIRTL-MNOVXSKESA-N 1 2 245.326 2.024 20 0 BEADLO O=C(N[C@@H]1CCn2c[nH+]cc21)[C@@H]1CCCC12CC2 ZINC000857976059 588926236 /nfs/dbraw/zinc/92/62/36/588926236.db2.gz WPJBFWXUQOIRTL-WDEREUQCSA-N 1 2 245.326 2.024 20 0 BEADLO Cc1sccc1C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857976499 588926304 /nfs/dbraw/zinc/92/63/04/588926304.db2.gz FVJSIEQBRONMSV-JTQLQIEISA-N 1 2 247.323 2.128 20 0 BEADLO O=C(N[C@@H]1CCn2c[nH+]cc21)[C@H]1CCCC12CC2 ZINC000857976056 588926407 /nfs/dbraw/zinc/92/64/07/588926407.db2.gz WPJBFWXUQOIRTL-GHMZBOCLSA-N 1 2 245.326 2.024 20 0 BEADLO CO[C@H]1C[N@H+](Cc2coc3ccccc23)CCO1 ZINC000895968499 583755379 /nfs/dbraw/zinc/75/53/79/583755379.db2.gz OOYOYCPVKNXFCK-CQSZACIVSA-N 1 2 247.294 2.238 20 0 BEADLO CO[C@H]1C[N@@H+](Cc2coc3ccccc23)CCO1 ZINC000895968499 583755381 /nfs/dbraw/zinc/75/53/81/583755381.db2.gz OOYOYCPVKNXFCK-CQSZACIVSA-N 1 2 247.294 2.238 20 0 BEADLO O=C(CCCC1CC1)N[C@@H]1CCn2c[nH+]cc21 ZINC000857977329 588926805 /nfs/dbraw/zinc/92/68/05/588926805.db2.gz CLYGAHVWSGHHGY-LLVKDONJSA-N 1 2 233.315 2.024 20 0 BEADLO C[C@]1(C(=O)N[C@@H]2CCn3c[nH+]cc32)CC=CCC1 ZINC000857977777 588927003 /nfs/dbraw/zinc/92/70/03/588927003.db2.gz ZINFXCQWBOMTSD-RISCZKNCSA-N 1 2 245.326 2.191 20 0 BEADLO CC[C@@H](C)CCC(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857977147 588927032 /nfs/dbraw/zinc/92/70/32/588927032.db2.gz AUVDIKKSXUEGFC-GHMZBOCLSA-N 1 2 235.331 2.270 20 0 BEADLO Cc1nn(C)c(C[NH+]2CCC(F)CC2)c1Cl ZINC000895998882 583760093 /nfs/dbraw/zinc/76/00/93/583760093.db2.gz CSCVNNZMSUJIOH-UHFFFAOYSA-N 1 2 245.729 2.316 20 0 BEADLO COc1nccc(C[NH+]2CCC(F)CC2)c1F ZINC000896000286 583760383 /nfs/dbraw/zinc/76/03/83/583760383.db2.gz QGWMYCULYXQAQG-UHFFFAOYSA-N 1 2 242.269 2.163 20 0 BEADLO Cc1cc(NC2CCS(=O)CC2)c[nH+]c1C ZINC000896021084 583764155 /nfs/dbraw/zinc/76/41/55/583764155.db2.gz GCATWYKGBMDPFF-UHFFFAOYSA-N 1 2 238.356 2.021 20 0 BEADLO C[N@H+](CCCF)Cc1nccn1C1CC1 ZINC000896070050 583767809 /nfs/dbraw/zinc/76/78/09/583767809.db2.gz NWXPYRBVAIHPHZ-UHFFFAOYSA-N 1 2 211.284 2.009 20 0 BEADLO C[N@@H+](CCCF)Cc1nccn1C1CC1 ZINC000896070050 583767811 /nfs/dbraw/zinc/76/78/11/583767811.db2.gz NWXPYRBVAIHPHZ-UHFFFAOYSA-N 1 2 211.284 2.009 20 0 BEADLO CCC/C(C)=C/C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857982620 588927781 /nfs/dbraw/zinc/92/77/81/588927781.db2.gz KJOYHPGHVHMECZ-HUYFXPKMSA-N 1 2 233.315 2.191 20 0 BEADLO CC1(C)CC[C@@H](C(=O)N[C@@H]2CCn3c[nH+]cc32)C1 ZINC000857981956 588927852 /nfs/dbraw/zinc/92/78/52/588927852.db2.gz KIGNJDFOHFPPRB-GHMZBOCLSA-N 1 2 247.342 2.270 20 0 BEADLO Nc1nc(NCCC2CC=CC2)nc(C2CC2)[nH+]1 ZINC000896093710 583771392 /nfs/dbraw/zinc/77/13/92/583771392.db2.gz DYEPZZLYWHDIKJ-UHFFFAOYSA-N 1 2 245.330 2.099 20 0 BEADLO Nc1nc(NCCC2CC=CC2)[nH+]c(C2CC2)n1 ZINC000896093710 583771395 /nfs/dbraw/zinc/77/13/95/583771395.db2.gz DYEPZZLYWHDIKJ-UHFFFAOYSA-N 1 2 245.330 2.099 20 0 BEADLO CN(C)[C@H](CCNc1cccc[nH+]1)C(F)(F)F ZINC000896109948 583772870 /nfs/dbraw/zinc/77/28/70/583772870.db2.gz PSVQVZXSPHSEHZ-SECBINFHSA-N 1 2 247.264 2.376 20 0 BEADLO CCS[C@@H](C)c1noc(C2([NH+](C)C)CC2)n1 ZINC000896144183 583774370 /nfs/dbraw/zinc/77/43/70/583774370.db2.gz PZIUWOFRRZWXKS-QMMMGPOBSA-N 1 2 241.360 2.434 20 0 BEADLO CCC[N@H+](CC)Cn1nc(C)n(CC)c1=S ZINC000727821391 583777552 /nfs/dbraw/zinc/77/75/52/583777552.db2.gz ZAFBMTPIJMBNIO-UHFFFAOYSA-N 1 2 242.392 2.432 20 0 BEADLO CCC[N@@H+](CC)Cn1nc(C)n(CC)c1=S ZINC000727821391 583777554 /nfs/dbraw/zinc/77/75/54/583777554.db2.gz ZAFBMTPIJMBNIO-UHFFFAOYSA-N 1 2 242.392 2.432 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857983239 588928540 /nfs/dbraw/zinc/92/85/40/588928540.db2.gz YFXALINFHYNFTI-SUNKGSAMSA-N 1 2 247.342 2.126 20 0 BEADLO CCC[C@@H](O)CCNc1cccc([C@@H](C)O)[nH+]1 ZINC000896182329 583779202 /nfs/dbraw/zinc/77/92/02/583779202.db2.gz IQKFZGRDQAPBCR-GHMZBOCLSA-N 1 2 238.331 2.098 20 0 BEADLO CCCCCC[C@H](O)C[NH+]1CC(C)(F)C1 ZINC000795542477 583781605 /nfs/dbraw/zinc/78/16/05/583781605.db2.gz GTYLCQXJCAVTHJ-NSHDSACASA-N 1 2 217.328 2.362 20 0 BEADLO C/C=C(/C=C/C(=O)N[C@@H]1CCn2c[nH+]cc21)CC ZINC000857987628 588929106 /nfs/dbraw/zinc/92/91/06/588929106.db2.gz XDJLMNLFBHJOAT-SRLNBLRRSA-N 1 2 245.326 2.357 20 0 BEADLO C[C@@H]1C[C@@H](Nc2cc(CO)cc[nH+]2)CCS1 ZINC000896245073 583784761 /nfs/dbraw/zinc/78/47/61/583784761.db2.gz DBOLKGOJAJJYKY-KOLCDFICSA-N 1 2 238.356 2.270 20 0 BEADLO C[C@H]1C[C@@H](Nc2cc[nH+]cc2F)CCS1 ZINC000896250590 583786669 /nfs/dbraw/zinc/78/66/69/583786669.db2.gz SLWKRCQAXNUJHK-IUCAKERBSA-N 1 2 226.320 2.339 20 0 BEADLO CC(C)(C)CCC(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857986128 588929310 /nfs/dbraw/zinc/92/93/10/588929310.db2.gz MEBPBTAYYLTNGW-JTQLQIEISA-N 1 2 235.331 2.270 20 0 BEADLO CC(C)(C)CCC(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857986129 588929541 /nfs/dbraw/zinc/92/95/41/588929541.db2.gz MEBPBTAYYLTNGW-SNVBAGLBSA-N 1 2 235.331 2.270 20 0 BEADLO Cc1cn(C(C)(C)C(=O)NC[C@@H]2CC2(C)C)c[nH+]1 ZINC000896327422 583793902 /nfs/dbraw/zinc/79/39/02/583793902.db2.gz BFTVQJPZNHRJMG-NSHDSACASA-N 1 2 249.358 2.089 20 0 BEADLO Cc1cc([C@H](C)[NH2+][C@H](C)C(F)F)n(C)n1 ZINC000883400932 583794759 /nfs/dbraw/zinc/79/47/59/583794759.db2.gz YJGYYNKLZSMCQY-JGVFFNPUSA-N 1 2 217.263 2.033 20 0 BEADLO Cc1cccc(C(=O)N[C@H]2CCn3c[nH+]cc32)c1 ZINC000857990361 588930157 /nfs/dbraw/zinc/93/01/57/588930157.db2.gz OCSJATZDWMQHJM-LBPRGKRZSA-N 1 2 241.294 2.066 20 0 BEADLO CCO[C@H]1CCN(c2cc(C)[nH+]c(C3CC3)n2)C1 ZINC000896406385 583800822 /nfs/dbraw/zinc/80/08/22/583800822.db2.gz FGHDPSQGCIJOKQ-LBPRGKRZSA-N 1 2 247.342 2.278 20 0 BEADLO Cc1cc(N[C@H](c2cnn(C)c2)C(C)C)nc[nH+]1 ZINC000896422526 583801501 /nfs/dbraw/zinc/80/15/01/583801501.db2.gz KGPRCMUBVJNSBU-ZDUSSCGKSA-N 1 2 245.330 2.328 20 0 BEADLO Oc1cccc(C[N@@H+]2CCn3cccc3C2)c1 ZINC000896758786 583829645 /nfs/dbraw/zinc/82/96/45/583829645.db2.gz XXWLWBHDLKEDTF-UHFFFAOYSA-N 1 2 228.295 2.210 20 0 BEADLO Oc1cccc(C[N@H+]2CCn3cccc3C2)c1 ZINC000896758786 583829647 /nfs/dbraw/zinc/82/96/47/583829647.db2.gz XXWLWBHDLKEDTF-UHFFFAOYSA-N 1 2 228.295 2.210 20 0 BEADLO CC(C)(/C=C\Cl)[NH2+]Cc1csnn1 ZINC000896746304 583829766 /nfs/dbraw/zinc/82/97/66/583829766.db2.gz CBCNEANYMBAYTN-ARJAWSKDSA-N 1 2 217.725 2.159 20 0 BEADLO Cc1coc(C[N@@H+]2CCn3cccc3C2)c1 ZINC000896764392 583830995 /nfs/dbraw/zinc/83/09/95/583830995.db2.gz XAUYMHSLEVGQCM-UHFFFAOYSA-N 1 2 216.284 2.405 20 0 BEADLO Cc1coc(C[N@H+]2CCn3cccc3C2)c1 ZINC000896764392 583830997 /nfs/dbraw/zinc/83/09/97/583830997.db2.gz XAUYMHSLEVGQCM-UHFFFAOYSA-N 1 2 216.284 2.405 20 0 BEADLO c1cc2n(c1)CC[N@@H+](Cc1nccn1C1CC1)C2 ZINC000896762964 583831704 /nfs/dbraw/zinc/83/17/04/583831704.db2.gz IOUCLEXBXRSTDE-UHFFFAOYSA-N 1 2 242.326 2.035 20 0 BEADLO c1cc2n(c1)CC[N@H+](Cc1nccn1C1CC1)C2 ZINC000896762964 583831706 /nfs/dbraw/zinc/83/17/06/583831706.db2.gz IOUCLEXBXRSTDE-UHFFFAOYSA-N 1 2 242.326 2.035 20 0 BEADLO c1cc2n(c1)CCN(Cc1[nH+]ccn1C1CC1)C2 ZINC000896762964 583831709 /nfs/dbraw/zinc/83/17/09/583831709.db2.gz IOUCLEXBXRSTDE-UHFFFAOYSA-N 1 2 242.326 2.035 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N2CC[C@@H](C)[C@H]2C)c[nH+]1 ZINC000896837469 583838976 /nfs/dbraw/zinc/83/89/76/583838976.db2.gz DTAAZFNIBIEVRI-ZYHUDNBSSA-N 1 2 249.358 2.184 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@H]2CC[C@H](C)C2)[nH+]c1C ZINC000896913271 583854084 /nfs/dbraw/zinc/85/40/84/583854084.db2.gz QASYSNRRJCSNAX-KWQFWETISA-N 1 2 235.331 2.079 20 0 BEADLO Cc1[nH]c(CNC(=O)CCC2CCC2)[nH+]c1C ZINC000896915353 583854490 /nfs/dbraw/zinc/85/44/90/583854490.db2.gz JZJBRRMWLVNJQN-UHFFFAOYSA-N 1 2 235.331 2.223 20 0 BEADLO Cc1[nH]c(CNC(=O)C(C2CC2)C2CC2)[nH+]c1C ZINC000896916888 583855589 /nfs/dbraw/zinc/85/55/89/583855589.db2.gz SIOZOGCQMXMOOD-UHFFFAOYSA-N 1 2 247.342 2.079 20 0 BEADLO CCCCCC(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC000896928560 583859547 /nfs/dbraw/zinc/85/95/47/583859547.db2.gz XIPOBKSUNXANOM-UHFFFAOYSA-N 1 2 223.320 2.223 20 0 BEADLO Cc1[nH]c(CNC(=O)CC2CCCC2)[nH+]c1C ZINC000896929685 583860021 /nfs/dbraw/zinc/86/00/21/583860021.db2.gz MBEPBJFTJPIGRJ-UHFFFAOYSA-N 1 2 235.331 2.223 20 0 BEADLO CC(C)(C)c1nc(N[C@@H]2CC23CC(O)C3)cc[nH+]1 ZINC000897090949 583878901 /nfs/dbraw/zinc/87/89/01/583878901.db2.gz BFRVLCFLWDNSKG-OPASDULOSA-N 1 2 247.342 2.099 20 0 BEADLO C[C@@H](CCO)[NH2+]c1ccc2c(c1)C[C@@H](C)O2 ZINC000897107183 583880979 /nfs/dbraw/zinc/88/09/79/583880979.db2.gz BPVNAWQSSAIPOB-VHSXEESVSA-N 1 2 221.300 2.193 20 0 BEADLO CO[C@H]1CC[C@H]1N(C)c1cc[nH+]c2ccncc21 ZINC000897148061 583884305 /nfs/dbraw/zinc/88/43/05/583884305.db2.gz UNVNJZGTACYORD-KGLIPLIRSA-N 1 2 243.310 2.243 20 0 BEADLO CO[C@@H]1CC[C@H]1N(C)c1nc(C)[nH+]c(C)c1C ZINC000897146850 583885693 /nfs/dbraw/zinc/88/56/93/583885693.db2.gz CCRNIPDHUDEWDL-VXGBXAGGSA-N 1 2 235.331 2.015 20 0 BEADLO CO[C@H]1CC[C@H]1N(C)c1[nH+]c2ccccc2n1C ZINC000897147603 583886044 /nfs/dbraw/zinc/88/60/44/583886044.db2.gz OHWGFJQIIKASCD-OLZOCXBDSA-N 1 2 245.326 2.187 20 0 BEADLO CNc1cc(N[C@@H]2C[C@@H]3CCC[C@@H]23)[nH+]cn1 ZINC000897177002 583889820 /nfs/dbraw/zinc/88/98/20/583889820.db2.gz ILXQVLLNNWHXBF-IVZWLZJFSA-N 1 2 218.304 2.119 20 0 BEADLO CNc1cc(N[C@@H]2C[C@H]3CCC[C@@H]32)[nH+]cn1 ZINC000897177003 583890125 /nfs/dbraw/zinc/89/01/25/583890125.db2.gz ILXQVLLNNWHXBF-KXUCPTDWSA-N 1 2 218.304 2.119 20 0 BEADLO CNc1cc(N[C@@H]2C[C@@H]3CCC[C@H]23)[nH+]cn1 ZINC000897177004 583890180 /nfs/dbraw/zinc/89/01/80/583890180.db2.gz ILXQVLLNNWHXBF-LPEHRKFASA-N 1 2 218.304 2.119 20 0 BEADLO OCc1cc[nH+]c(N[C@@H]2C[C@@H]3CCC[C@H]23)c1 ZINC000897177632 583890753 /nfs/dbraw/zinc/89/07/53/583890753.db2.gz SKTPZDDISDVOML-SDDRHHMPSA-N 1 2 218.300 2.174 20 0 BEADLO Cc1nc(N[C@H](C)Cc2cccnc2)cc[nH+]1 ZINC000897194963 583893558 /nfs/dbraw/zinc/89/35/58/583893558.db2.gz NCIMSMQDFJQHKV-SNVBAGLBSA-N 1 2 228.299 2.223 20 0 BEADLO CC(C)=C(C)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000751376804 583898938 /nfs/dbraw/zinc/89/89/38/583898938.db2.gz OJTREAXMOKXXSK-ZDUSSCGKSA-N 1 2 247.342 2.403 20 0 BEADLO Cc1cc(NC2CC(CCO)C2)nc(C2CC2)[nH+]1 ZINC000897234799 583899597 /nfs/dbraw/zinc/89/95/97/583899597.db2.gz QBSDTASODBHIDN-UHFFFAOYSA-N 1 2 247.342 2.235 20 0 BEADLO CCC/C=C\C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000729369886 583995324 /nfs/dbraw/zinc/99/53/24/583995324.db2.gz BIEPNFGLWILBMY-KMSCOEIWSA-N 1 2 247.342 2.472 20 0 BEADLO Cc1cccc(Cl)c1CO[NH+]=C(N)CCO ZINC000842039934 584027624 /nfs/dbraw/zinc/02/76/24/584027624.db2.gz BNMQUHZYZJLYTD-UHFFFAOYSA-N 1 2 242.706 2.029 20 0 BEADLO CC(C)c1c[nH+]cc(N[C@@H]2CCCNC(=O)C2)c1 ZINC000897707407 584041372 /nfs/dbraw/zinc/04/13/72/584041372.db2.gz NFMPBGUZCOEXKP-GFCCVEGCSA-N 1 2 247.342 2.286 20 0 BEADLO CC(C)c1c[nH+]cc(N[C@@H](C)Cn2cncn2)c1 ZINC000897707716 584041987 /nfs/dbraw/zinc/04/19/87/584041987.db2.gz ZCZFNBKNNWLEQO-NSHDSACASA-N 1 2 245.330 2.297 20 0 BEADLO Cc1cn(C(C)(C)C(=O)N[C@H]2CCC2(C)C)c[nH+]1 ZINC000897758177 584044487 /nfs/dbraw/zinc/04/44/87/584044487.db2.gz KFPBYYDWDKUINX-NSHDSACASA-N 1 2 249.358 2.231 20 0 BEADLO CCC1(C)CN(C(=O)C(C)(C)n2c[nH+]c(C)c2)C1 ZINC000897807757 584049843 /nfs/dbraw/zinc/04/98/43/584049843.db2.gz FVSQAFGKTSZMST-UHFFFAOYSA-N 1 2 249.358 2.185 20 0 BEADLO Cc1cccc(C[N@@H+]2CC[C@H](O)[C@H](F)C2)c1F ZINC000898187520 584093953 /nfs/dbraw/zinc/09/39/53/584093953.db2.gz GIYZAMVAPXVIPW-NEPJUHHUSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cccc(C[N@H+]2CC[C@H](O)[C@H](F)C2)c1F ZINC000898187520 584093954 /nfs/dbraw/zinc/09/39/54/584093954.db2.gz GIYZAMVAPXVIPW-NEPJUHHUSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cccc(C[N@@H+]2CC[C@H](O)[C@@H](F)C2)c1F ZINC000898187522 584094264 /nfs/dbraw/zinc/09/42/64/584094264.db2.gz GIYZAMVAPXVIPW-RYUDHWBXSA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cccc(C[N@H+]2CC[C@H](O)[C@@H](F)C2)c1F ZINC000898187522 584094266 /nfs/dbraw/zinc/09/42/66/584094266.db2.gz GIYZAMVAPXVIPW-RYUDHWBXSA-N 1 2 241.281 2.039 20 0 BEADLO O=C(N[C@@H]1CCn2c[nH+]cc21)[C@]12C[C@H]1CCCC2 ZINC000898809991 584159993 /nfs/dbraw/zinc/15/99/93/584159993.db2.gz GOOFMYSMMKZMQQ-JTNHKYCSSA-N 1 2 245.326 2.024 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)NCC(C)(C)n2cc[nH+]c2)C1 ZINC000898905863 584165068 /nfs/dbraw/zinc/16/50/68/584165068.db2.gz HXSYLYBYRKTGOF-NEPJUHHUSA-N 1 2 249.358 2.171 20 0 BEADLO C/C(=C\C(=O)NCC(C)(C)n1cc[nH+]c1)C1CC1 ZINC000898901554 584165299 /nfs/dbraw/zinc/16/52/99/584165299.db2.gz JYNKAJMVZRDFLL-DHZHZOJOSA-N 1 2 247.342 2.091 20 0 BEADLO CCC1(C(=O)NCC(C)(C)n2cc[nH+]c2)CCC1 ZINC000898903895 584165491 /nfs/dbraw/zinc/16/54/91/584165491.db2.gz NIOANJHADJQVBD-UHFFFAOYSA-N 1 2 249.358 2.315 20 0 BEADLO CCn1c[nH+]c(/C=C(\C)c2cnccn2)c1 ZINC000899366104 584207602 /nfs/dbraw/zinc/20/76/02/584207602.db2.gz IISYGJHFOPTSAO-UXBLZVDNSA-N 1 2 214.272 2.254 20 0 BEADLO Cc1cccc(CCn2cc(C3CCC3)nn2)[nH+]1 ZINC000899733110 584234669 /nfs/dbraw/zinc/23/46/69/584234669.db2.gz PXAOIPQJUFNMCY-UHFFFAOYSA-N 1 2 242.326 2.492 20 0 BEADLO CCC(CC)N(C(=O)Cc1c[nH+]c[nH]1)C1CC1 ZINC000900498113 584316991 /nfs/dbraw/zinc/31/69/91/584316991.db2.gz UPOXPGLPIPLSEV-UHFFFAOYSA-N 1 2 235.331 2.132 20 0 BEADLO C[C@H]1CC[C@H](NC(=O)CNc2cccc[nH+]2)CC1 ZINC000900628399 584333696 /nfs/dbraw/zinc/33/36/96/584333696.db2.gz YHXQFXXCZSCPQU-HAQNSBGRSA-N 1 2 247.342 2.188 20 0 BEADLO C[C@@H]1CCCCCN1C(=O)CNc1cccc[nH+]1 ZINC000900720346 584344648 /nfs/dbraw/zinc/34/46/48/584344648.db2.gz TYUAAWAROPNFQL-GFCCVEGCSA-N 1 2 247.342 2.285 20 0 BEADLO CC(C)[C@H]1CCCN(C(=O)Cc2c[nH+]c[nH]2)CC1 ZINC000900721821 584345023 /nfs/dbraw/zinc/34/50/23/584345023.db2.gz OMBNMEDLTAGNAF-LBPRGKRZSA-N 1 2 249.358 2.237 20 0 BEADLO C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)Cc1c[nH+]c[nH]1 ZINC000900737193 584347624 /nfs/dbraw/zinc/34/76/24/584347624.db2.gz RUTFHTAIFMPNRC-WZRBSPASSA-N 1 2 247.342 2.132 20 0 BEADLO C/C=C/CNc1nc(C)[nH+]c(NC/C=C/C)n1 ZINC000858800556 588976589 /nfs/dbraw/zinc/97/65/89/588976589.db2.gz QLJFAOFGJNNPIN-YDFGWWAZSA-N 1 2 233.319 2.156 20 0 BEADLO CC[C@H]1CCCCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC000900791605 584352020 /nfs/dbraw/zinc/35/20/20/584352020.db2.gz GVZNSZUWMHAQQP-LBPRGKRZSA-N 1 2 235.331 2.133 20 0 BEADLO C[C@@H](CCC(C)(C)C)NC(=O)Cc1c[nH]c[nH+]1 ZINC000900765339 584353751 /nfs/dbraw/zinc/35/37/51/584353751.db2.gz VYCYOOWAQGSQBK-JTQLQIEISA-N 1 2 237.347 2.283 20 0 BEADLO C[C@@H](CCC(C)(C)C)NC(=O)Cc1c[nH+]c[nH]1 ZINC000900765339 584353752 /nfs/dbraw/zinc/35/37/52/584353752.db2.gz VYCYOOWAQGSQBK-JTQLQIEISA-N 1 2 237.347 2.283 20 0 BEADLO O=C(Cc1c[nH]c[nH+]1)N[C@@H]1C[C@H]1C1CCCCC1 ZINC000900836528 584359097 /nfs/dbraw/zinc/35/90/97/584359097.db2.gz ORWGTQOUHPRCCM-QWHCGFSZSA-N 1 2 247.342 2.037 20 0 BEADLO O=C(Cc1c[nH+]c[nH]1)N[C@@H]1C[C@H]1C1CCCCC1 ZINC000900836528 584359099 /nfs/dbraw/zinc/35/90/99/584359099.db2.gz ORWGTQOUHPRCCM-QWHCGFSZSA-N 1 2 247.342 2.037 20 0 BEADLO C[C@@H]1CC(C)(C)CC[C@H]1NC(=O)Cc1c[nH]c[nH+]1 ZINC000900953713 584366425 /nfs/dbraw/zinc/36/64/25/584366425.db2.gz FOGGHJCQVVIHGU-ZYHUDNBSSA-N 1 2 249.358 2.283 20 0 BEADLO C[C@@H]1CC(C)(C)CC[C@H]1NC(=O)Cc1c[nH+]c[nH]1 ZINC000900953713 584366428 /nfs/dbraw/zinc/36/64/28/584366428.db2.gz FOGGHJCQVVIHGU-ZYHUDNBSSA-N 1 2 249.358 2.283 20 0 BEADLO Cc1[nH]c(CNC(=O)/C=C\C(C)(C)C)[nH+]c1C ZINC000900997980 584375145 /nfs/dbraw/zinc/37/51/45/584375145.db2.gz QDMBYLYGLGBWNN-SREVYHEPSA-N 1 2 235.331 2.245 20 0 BEADLO Cc1[nH]c(CNC(=O)C=CC(C)(C)C)[nH+]c1C ZINC000900997980 584375146 /nfs/dbraw/zinc/37/51/46/584375146.db2.gz QDMBYLYGLGBWNN-SREVYHEPSA-N 1 2 235.331 2.245 20 0 BEADLO Cn1c[nH+]c(/C=C/C(=O)OC[C@H]2CC=CCC2)c1 ZINC000901162998 584394234 /nfs/dbraw/zinc/39/42/34/584394234.db2.gz GFDZFOHDHCRTPA-GUOLPTJISA-N 1 2 246.310 2.333 20 0 BEADLO Fc1ccc(-c2cc([C@H]3COCC[NH2+]3)on2)cc1 ZINC000901387841 584436658 /nfs/dbraw/zinc/43/66/58/584436658.db2.gz QCIKJWKMKRHYEK-GFCCVEGCSA-N 1 2 248.257 2.142 20 0 BEADLO Fc1cccc(-c2cc([C@@H]3COCC[NH2+]3)on2)c1 ZINC000901398998 584438900 /nfs/dbraw/zinc/43/89/00/584438900.db2.gz AKACTPQMJBCJNM-LBPRGKRZSA-N 1 2 248.257 2.142 20 0 BEADLO COC/C(C)=C/CSc1nc(N)cc(C)[nH+]1 ZINC000901415275 584441355 /nfs/dbraw/zinc/44/13/55/584441355.db2.gz IDUJPQCHUQAOAI-XBXARRHUSA-N 1 2 239.344 2.052 20 0 BEADLO CC(C)CCOC(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000858903655 588984171 /nfs/dbraw/zinc/98/41/71/588984171.db2.gz XZVRQBPWTCOJLJ-LLVKDONJSA-N 1 2 239.319 2.044 20 0 BEADLO C[C@H](O)CC[NH2+]c1ccc2c(c1)C[C@@H](C)O2 ZINC000901445412 584446685 /nfs/dbraw/zinc/44/66/85/584446685.db2.gz BBWBXLCTVYVSKX-VHSXEESVSA-N 1 2 221.300 2.193 20 0 BEADLO CC(C)n1c[nH+]cc1/C=C\c1cnccn1 ZINC000901462436 584450909 /nfs/dbraw/zinc/45/09/09/584450909.db2.gz UQFRRMDTXOIOBE-ARJAWSKDSA-N 1 2 214.272 2.424 20 0 BEADLO CC(C)n1c[nH+]cc1/C=C/c1ccncn1 ZINC000901490145 584452467 /nfs/dbraw/zinc/45/24/67/584452467.db2.gz RXJILGLOARQJIF-ONEGZZNKSA-N 1 2 214.272 2.424 20 0 BEADLO Cc1cc(=O)[nH]c(C=Cc2c[nH+]cn2C(C)C)n1 ZINC000901505549 584455802 /nfs/dbraw/zinc/45/58/02/584455802.db2.gz WKNYKMCSKQPRGT-SNAWJCMRSA-N 1 2 244.298 2.438 20 0 BEADLO CC(C)n1c[nH+]cc1C=Cc1c[nH]c(C=O)n1 ZINC000901555268 584462542 /nfs/dbraw/zinc/46/25/42/584462542.db2.gz RKMZZCUAMCOHBR-ONEGZZNKSA-N 1 2 230.271 2.170 20 0 BEADLO Cc1cccc2[nH+]c(CSC3COC3)cn21 ZINC000901642061 584473787 /nfs/dbraw/zinc/47/37/87/584473787.db2.gz LRWXTZCBBDWBHM-UHFFFAOYSA-N 1 2 234.324 2.275 20 0 BEADLO CCCCc1nnc(NCc2[nH]c(C)c(C)[nH+]2)o1 ZINC000902043702 584516158 /nfs/dbraw/zinc/51/61/58/584516158.db2.gz KEUIQQFINPKZGK-UHFFFAOYSA-N 1 2 249.318 2.364 20 0 BEADLO Cc1[nH]c(CNc2nc(C(C)C)no2)[nH+]c1C ZINC000902048815 584516715 /nfs/dbraw/zinc/51/67/15/584516715.db2.gz JECJPCSIIBHHMK-UHFFFAOYSA-N 1 2 235.291 2.145 20 0 BEADLO Fc1c[nH+]ccc1NCc1cnn(C2CCC2)c1 ZINC000902065445 584522684 /nfs/dbraw/zinc/52/26/84/584522684.db2.gz HIXPKRRTBLDROD-UHFFFAOYSA-N 1 2 246.289 2.176 20 0 BEADLO CCOc1ccc(CNc2cc[nH+]c(C)n2)o1 ZINC000902127503 584529332 /nfs/dbraw/zinc/52/93/32/584529332.db2.gz UBOXUCPLUPSUIO-UHFFFAOYSA-N 1 2 233.271 2.389 20 0 BEADLO CCn1cc(CNc2cc(F)cc[nH+]2)c(C)n1 ZINC000902156108 584532144 /nfs/dbraw/zinc/53/21/44/584532144.db2.gz HONHQMJXTGWSTL-UHFFFAOYSA-N 1 2 234.278 2.358 20 0 BEADLO Cc1cc(NCc2cnc(F)c(C)c2)nc[nH+]1 ZINC000902195389 584536962 /nfs/dbraw/zinc/53/69/62/584536962.db2.gz NJUMGIBVOBIAGV-UHFFFAOYSA-N 1 2 232.262 2.240 20 0 BEADLO Cc1cc(NCc2cnc(F)cc2C)nc[nH+]1 ZINC000902193700 584537029 /nfs/dbraw/zinc/53/70/29/584537029.db2.gz DACYUFBFUKKDLP-UHFFFAOYSA-N 1 2 232.262 2.240 20 0 BEADLO CC1=CC[N@H+](CN2Cc3ccccc3C2=O)CC1 ZINC000902199436 584537271 /nfs/dbraw/zinc/53/72/71/584537271.db2.gz SEMKAGZMDIAYOF-UHFFFAOYSA-N 1 2 242.322 2.252 20 0 BEADLO CC1=CC[N@@H+](CN2Cc3ccccc3C2=O)CC1 ZINC000902199436 584537272 /nfs/dbraw/zinc/53/72/72/584537272.db2.gz SEMKAGZMDIAYOF-UHFFFAOYSA-N 1 2 242.322 2.252 20 0 BEADLO NC(Cc1cccnc1)=[NH+]OC1CC2(CCC2)C1 ZINC000902298857 584553268 /nfs/dbraw/zinc/55/32/68/584553268.db2.gz VEKPCNAXVQEFMU-UHFFFAOYSA-N 1 2 245.326 2.455 20 0 BEADLO CCn1c[nH+]c(CNc2cc(C)cnc2OC)c1 ZINC000902407264 584574707 /nfs/dbraw/zinc/57/47/07/584574707.db2.gz QWAOTTLZLBEOOZ-UHFFFAOYSA-N 1 2 246.314 2.227 20 0 BEADLO CCn1c[nH+]c(CNc2ccc(OC)nc2C)c1 ZINC000902404107 584589124 /nfs/dbraw/zinc/58/91/24/584589124.db2.gz IAHASQXCZCTSIJ-UHFFFAOYSA-N 1 2 246.314 2.227 20 0 BEADLO C[C@H]1CCCC[N@@H+]1Cc1cc(Cl)n(C)n1 ZINC000859063952 588996400 /nfs/dbraw/zinc/99/64/00/588996400.db2.gz PIFDFVXLPNBPDG-VIFPVBQESA-N 1 2 227.739 2.448 20 0 BEADLO C[C@H]1CCCC[N@H+]1Cc1cc(Cl)n(C)n1 ZINC000859063952 588996402 /nfs/dbraw/zinc/99/64/02/588996402.db2.gz PIFDFVXLPNBPDG-VIFPVBQESA-N 1 2 227.739 2.448 20 0 BEADLO CCCOC(=O)NCc1cn2cccc(C)c2[nH+]1 ZINC000859089732 588999933 /nfs/dbraw/zinc/99/99/33/588999933.db2.gz JWIODYVKHFAMPA-UHFFFAOYSA-N 1 2 247.298 2.279 20 0 BEADLO Nc1nc(C[NH2+][C@H]2CCCc3occc32)cs1 ZINC000902499286 584620000 /nfs/dbraw/zinc/62/00/00/584620000.db2.gz MQGSRAQXGNXQRC-JTQLQIEISA-N 1 2 249.339 2.486 20 0 BEADLO c1cn(CCSC[C@@H]2C[C@]23CCOC3)c[nH+]1 ZINC000902547317 584635383 /nfs/dbraw/zinc/63/53/83/584635383.db2.gz OOHJVTJPCZPPJU-RYUDHWBXSA-N 1 2 238.356 2.043 20 0 BEADLO CC[C@@H]1C[C@H]1CO[NH+]=C(N)C1(OC)CCCC1 ZINC000902598354 584640289 /nfs/dbraw/zinc/64/02/89/584640289.db2.gz NYFLEZAWRJSTKY-MNOVXSKESA-N 1 2 240.347 2.490 20 0 BEADLO CCn1cnc(C[NH2+][C@@H](C)c2ccns2)c1 ZINC000902627625 584646604 /nfs/dbraw/zinc/64/66/04/584646604.db2.gz YXCPVNKEOBWBKR-VIFPVBQESA-N 1 2 236.344 2.210 20 0 BEADLO c1cc2cc(OC[C@H]3COCCO3)ccc2c[nH+]1 ZINC000902637456 584648990 /nfs/dbraw/zinc/64/89/90/584648990.db2.gz HNRWAQHFFJNLPP-CQSZACIVSA-N 1 2 245.278 2.029 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]O[C@@H](C)c1ccccc1 ZINC000902717196 584657787 /nfs/dbraw/zinc/65/77/87/584657787.db2.gz MMZMCRCJZYEURE-UWVGGRQHSA-N 1 2 222.288 2.281 20 0 BEADLO CO[C@H](C)C(N)=[NH+]O[C@@H](C)c1ccccc1 ZINC000902717197 584657977 /nfs/dbraw/zinc/65/79/77/584657977.db2.gz MMZMCRCJZYEURE-VHSXEESVSA-N 1 2 222.288 2.281 20 0 BEADLO CCOCCCOc1ccc2c(c1)[nH+]cn2C ZINC000902779786 584669475 /nfs/dbraw/zinc/66/94/75/584669475.db2.gz FMXMWJXQLKVLFA-UHFFFAOYSA-N 1 2 234.299 2.379 20 0 BEADLO Cc1nnsc1[C@@H](C)[N@@H+]1CCC[C@H](F)C1 ZINC000902991452 584710395 /nfs/dbraw/zinc/71/03/95/584710395.db2.gz RQWZBKRYGXUOPR-BDAKNGLRSA-N 1 2 229.324 2.341 20 0 BEADLO Cc1nnsc1[C@@H](C)[N@H+]1CCC[C@H](F)C1 ZINC000902991452 584710397 /nfs/dbraw/zinc/71/03/97/584710397.db2.gz RQWZBKRYGXUOPR-BDAKNGLRSA-N 1 2 229.324 2.341 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+]2CCC[C@@H](F)C2)cn1 ZINC000902992642 584710911 /nfs/dbraw/zinc/71/09/11/584710911.db2.gz MIGMTEQRYHGOEX-GHMZBOCLSA-N 1 2 223.295 2.280 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+]2CCC[C@@H](F)C2)cn1 ZINC000902992642 584710912 /nfs/dbraw/zinc/71/09/12/584710912.db2.gz MIGMTEQRYHGOEX-GHMZBOCLSA-N 1 2 223.295 2.280 20 0 BEADLO COc1cc(C[N@@H+]2CCC[C@@H](F)C2)ccn1 ZINC000902994604 584712518 /nfs/dbraw/zinc/71/25/18/584712518.db2.gz FZENONBZGLOMPQ-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO COc1cc(C[N@H+]2CCC[C@@H](F)C2)ccn1 ZINC000902994604 584712520 /nfs/dbraw/zinc/71/25/20/584712520.db2.gz FZENONBZGLOMPQ-LLVKDONJSA-N 1 2 224.279 2.024 20 0 BEADLO Cc1cnc([C@@H](C)[N@@H+]2CCC[C@H](F)C2)o1 ZINC000902996740 584714271 /nfs/dbraw/zinc/71/42/71/584714271.db2.gz WIZXTMFOBGIDHQ-ZJUUUORDSA-N 1 2 212.268 2.478 20 0 BEADLO Cc1cnc([C@@H](C)[N@H+]2CCC[C@H](F)C2)o1 ZINC000902996740 584714272 /nfs/dbraw/zinc/71/42/72/584714272.db2.gz WIZXTMFOBGIDHQ-ZJUUUORDSA-N 1 2 212.268 2.478 20 0 BEADLO CCCCCNC(=O)[C@@H](C)[N@@H+]1CCC[C@@H](F)C1 ZINC000902999560 584715153 /nfs/dbraw/zinc/71/51/53/584715153.db2.gz ABWUOWIYVYUHJF-VXGBXAGGSA-N 1 2 244.354 2.115 20 0 BEADLO CCCCCNC(=O)[C@@H](C)[N@H+]1CCC[C@@H](F)C1 ZINC000902999560 584715154 /nfs/dbraw/zinc/71/51/54/584715154.db2.gz ABWUOWIYVYUHJF-VXGBXAGGSA-N 1 2 244.354 2.115 20 0 BEADLO CCC[C@H](C)NC(=O)[C@@H](C)[N@@H+]1CCC[C@H](F)C1 ZINC000903002187 584716181 /nfs/dbraw/zinc/71/61/81/584716181.db2.gz XLQVWWRJZVADSR-TUAOUCFPSA-N 1 2 244.354 2.114 20 0 BEADLO CCC[C@H](C)NC(=O)[C@@H](C)[N@H+]1CCC[C@H](F)C1 ZINC000903002187 584716182 /nfs/dbraw/zinc/71/61/82/584716182.db2.gz XLQVWWRJZVADSR-TUAOUCFPSA-N 1 2 244.354 2.114 20 0 BEADLO CC(C)N(C(=O)/C=C\c1cn(C)c[nH+]1)C(C)C ZINC000903141862 584730675 /nfs/dbraw/zinc/73/06/75/584730675.db2.gz SLEVJOCVTJLEEW-SREVYHEPSA-N 1 2 235.331 2.079 20 0 BEADLO Cc1cc(N[C@@H]2CCO[C@]23CCOC3)c[nH+]c1C ZINC000903220597 584737802 /nfs/dbraw/zinc/73/78/02/584737802.db2.gz NARYVDVTPFMZOA-KGLIPLIRSA-N 1 2 248.326 2.058 20 0 BEADLO CCc1noc(C)c1[C@H](C)[NH2+]Cc1cn(C)cn1 ZINC000903351228 584755485 /nfs/dbraw/zinc/75/54/85/584755485.db2.gz IBSOFVZUJGUHSL-VIFPVBQESA-N 1 2 248.330 2.130 20 0 BEADLO C[C@@H]([NH2+]Cc1cn(C)cn1)c1cccc(O)c1F ZINC000903351355 584755549 /nfs/dbraw/zinc/75/55/49/584755549.db2.gz JZLSAYAATWNFOI-SECBINFHSA-N 1 2 249.289 2.116 20 0 BEADLO CC(C)CCOC(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000859172515 589013509 /nfs/dbraw/zinc/01/35/09/589013509.db2.gz GRBIXPJXCBYAKG-SNVBAGLBSA-N 1 2 237.303 2.100 20 0 BEADLO c1ccc2c(c1)CC[C@@H]2CCN1CC=CC[NH2+]1 ZINC000903490751 584780773 /nfs/dbraw/zinc/78/07/73/584780773.db2.gz GPIXOIYMJLEODE-CQSZACIVSA-N 1 2 228.339 2.483 20 0 BEADLO CC[C@@]1(C)CCC[N@H+](C[C@H]([NH3+])CC(F)F)C1 ZINC000903894987 584819560 /nfs/dbraw/zinc/81/95/60/584819560.db2.gz JBSAZXWBRUXVHG-PWSUYJOCSA-N 1 2 234.334 2.481 20 0 BEADLO CC[C@@]1(C)CCC[N@@H+](C[C@H]([NH3+])CC(F)F)C1 ZINC000903894987 584819562 /nfs/dbraw/zinc/81/95/62/584819562.db2.gz JBSAZXWBRUXVHG-PWSUYJOCSA-N 1 2 234.334 2.481 20 0 BEADLO Cc1cc(N)[nH+]cc1-c1noc([C@@H]2C[C@@H]2C)n1 ZINC000904272528 584858724 /nfs/dbraw/zinc/85/87/24/584858724.db2.gz FMLSWESRIDRHSS-POYBYMJQSA-N 1 2 230.271 2.146 20 0 BEADLO CC(C)=Cc1nc(-c2ccc(N)[nH+]c2C)no1 ZINC000904256485 584858995 /nfs/dbraw/zinc/85/89/95/584858995.db2.gz AOEKGBVFWVVELT-UHFFFAOYSA-N 1 2 230.271 2.445 20 0 BEADLO CC(C)=Cc1nc(-c2c[nH+]c(N)cc2C)no1 ZINC000904272893 584859030 /nfs/dbraw/zinc/85/90/30/584859030.db2.gz LDIJUERQDRUKBM-UHFFFAOYSA-N 1 2 230.271 2.445 20 0 BEADLO Cc1[nH+]c(N)ccc1-c1noc([C@H]2C[C@H]2C)n1 ZINC000904256566 584859088 /nfs/dbraw/zinc/85/90/88/584859088.db2.gz BWKYNPXARUBABL-MUWHJKNJSA-N 1 2 230.271 2.146 20 0 BEADLO Cc1[nH+]c(N)ccc1-c1noc(C(C)C)n1 ZINC000904257524 584859599 /nfs/dbraw/zinc/85/95/99/584859599.db2.gz ZUJPDOAOQVGPLR-UHFFFAOYSA-N 1 2 218.260 2.146 20 0 BEADLO Cc1cc(C(=O)OCc2cc[nH+]c(N)c2)cs1 ZINC000803758047 584889782 /nfs/dbraw/zinc/88/97/82/584889782.db2.gz GSTZHHJODCWBOO-UHFFFAOYSA-N 1 2 248.307 2.391 20 0 BEADLO Cn1c[nH+]cc1COC(=O)C(C)(C)C1CCC1 ZINC000835193901 584921033 /nfs/dbraw/zinc/92/10/33/584921033.db2.gz HXQQZPHKGSQJHF-UHFFFAOYSA-N 1 2 236.315 2.290 20 0 BEADLO Cc1noc(-c2ccc(-n3cc[nH+]c3)cc2)n1 ZINC000733740025 584953136 /nfs/dbraw/zinc/95/31/36/584953136.db2.gz IJNBSRCGJURWJF-UHFFFAOYSA-N 1 2 226.239 2.231 20 0 BEADLO CCC(=O)OCc1[nH+]cc(C)c(OC)c1C ZINC000736743991 585011323 /nfs/dbraw/zinc/01/13/23/585011323.db2.gz UKMJVPXCZQBVIY-UHFFFAOYSA-N 1 2 223.272 2.160 20 0 BEADLO Cc1ccc(CNc2ccc(N(C)C)c[nH+]2)cn1 ZINC000156279958 585021759 /nfs/dbraw/zinc/02/17/59/585021759.db2.gz XDZALPIMINBHJH-UHFFFAOYSA-N 1 2 242.326 2.463 20 0 BEADLO CC/C(C)=C/C(=O)OCCCn1cc[nH+]c1 ZINC000838045950 585043871 /nfs/dbraw/zinc/04/38/71/585043871.db2.gz VZGZRMMGSLBMRM-PKNBQFBNSA-N 1 2 222.288 2.173 20 0 BEADLO CC/C(C)=C\C(=O)OCCCn1cc[nH+]c1 ZINC000838045949 585043890 /nfs/dbraw/zinc/04/38/90/585043890.db2.gz VZGZRMMGSLBMRM-LUAWRHEFSA-N 1 2 222.288 2.173 20 0 BEADLO CC(C(=O)OCCCn1cc[nH+]c1)=C1CCC1 ZINC000838237230 585049870 /nfs/dbraw/zinc/04/98/70/585049870.db2.gz YJRALYYFTKOZEL-UHFFFAOYSA-N 1 2 234.299 2.317 20 0 BEADLO C[C@@H](C(=O)OCc1cc[nH+]c(N)c1)C1CCC1 ZINC000838389889 585055984 /nfs/dbraw/zinc/05/59/84/585055984.db2.gz UPIBXBNRKKXRNH-SECBINFHSA-N 1 2 234.299 2.143 20 0 BEADLO CCn1ncc(C[N@@H+]2CC[C@H]2c2ccccc2)n1 ZINC000838781458 585069847 /nfs/dbraw/zinc/06/98/47/585069847.db2.gz YJCRZQMSSAZULG-AWEZNQCLSA-N 1 2 242.326 2.245 20 0 BEADLO CCn1ncc(C[N@H+]2CC[C@H]2c2ccccc2)n1 ZINC000838781458 585069848 /nfs/dbraw/zinc/06/98/48/585069848.db2.gz YJCRZQMSSAZULG-AWEZNQCLSA-N 1 2 242.326 2.245 20 0 BEADLO CC[C@@H](CC(F)F)C(=O)OCc1c[nH+]cn1C ZINC000838809294 585070679 /nfs/dbraw/zinc/07/06/79/585070679.db2.gz DADHKRIQHYWREU-QMMMGPOBSA-N 1 2 246.257 2.145 20 0 BEADLO C/C=C(\C)C(=O)OCCc1cn2ccccc2[nH+]1 ZINC000838921129 585078275 /nfs/dbraw/zinc/07/82/75/585078275.db2.gz JVPMAKPWLMEVRH-QDEBKDIKSA-N 1 2 244.294 2.386 20 0 BEADLO CCn1ncc(C[NH2+][C@H](C)c2ccc(C)o2)n1 ZINC000838893045 585078724 /nfs/dbraw/zinc/07/87/24/585078724.db2.gz ZFRFWTCOLDKJMX-SNVBAGLBSA-N 1 2 234.303 2.050 20 0 BEADLO CCn1ncc(C[NH2+][C@@H]2CCCc3occc32)n1 ZINC000838899657 585079999 /nfs/dbraw/zinc/07/99/99/585079999.db2.gz XMUJUMKVUJLBDL-GFCCVEGCSA-N 1 2 246.314 2.058 20 0 BEADLO CN(C)c1[nH+]cccc1COC(=O)CC1CCC1 ZINC000838954777 585080650 /nfs/dbraw/zinc/08/06/50/585080650.db2.gz VLRWTZPYMBLRJL-UHFFFAOYSA-N 1 2 248.326 2.381 20 0 BEADLO CN(C)c1[nH+]cccc1COC(=O)/C=C\C1CC1 ZINC000838952302 585080774 /nfs/dbraw/zinc/08/07/74/585080774.db2.gz GWFWBDRTXPMVAG-FPLPWBNLSA-N 1 2 246.310 2.157 20 0 BEADLO Cc1ccc(C[NH+]2CC(O)(C(C)C)C2)cc1F ZINC000839133379 585093879 /nfs/dbraw/zinc/09/38/79/585093879.db2.gz QVTBNBAHUUIJMC-UHFFFAOYSA-N 1 2 237.318 2.337 20 0 BEADLO COc1cc(C)ccc1C[NH+]1CC(O)(C(C)C)C1 ZINC000839133923 585093929 /nfs/dbraw/zinc/09/39/29/585093929.db2.gz YRAVFXNOJLIFPG-UHFFFAOYSA-N 1 2 249.354 2.206 20 0 BEADLO CCn1ncc(C[NH+]2CC(C3CCCCC3)C2)n1 ZINC000839136458 585094472 /nfs/dbraw/zinc/09/44/72/585094472.db2.gz QEYBHNXEEYAKIZ-UHFFFAOYSA-N 1 2 248.374 2.310 20 0 BEADLO Fc1cc(C[N@@H+]2C[C@@H]3C[C@H]2CS3)c(F)cn1 ZINC000839191212 585097301 /nfs/dbraw/zinc/09/73/01/585097301.db2.gz GSEQLXORVCBVGN-IUCAKERBSA-N 1 2 242.294 2.050 20 0 BEADLO Fc1cc(C[N@H+]2C[C@@H]3C[C@H]2CS3)c(F)cn1 ZINC000839191212 585097302 /nfs/dbraw/zinc/09/73/02/585097302.db2.gz GSEQLXORVCBVGN-IUCAKERBSA-N 1 2 242.294 2.050 20 0 BEADLO C[S@](=O)CC[N@@H+]1Cc2ccc(Cl)cc2C1 ZINC000839194456 585097929 /nfs/dbraw/zinc/09/79/29/585097929.db2.gz QKWVGTSNHHQHCK-HNNXBMFYSA-N 1 2 243.759 2.034 20 0 BEADLO C[S@](=O)CC[N@H+]1Cc2ccc(Cl)cc2C1 ZINC000839194456 585097930 /nfs/dbraw/zinc/09/79/30/585097930.db2.gz QKWVGTSNHHQHCK-HNNXBMFYSA-N 1 2 243.759 2.034 20 0 BEADLO CC(C)[C@@H](F)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000839360242 585101872 /nfs/dbraw/zinc/10/18/72/585101872.db2.gz FAXKTBGIUQQCCT-LLVKDONJSA-N 1 2 235.262 2.267 20 0 BEADLO CC(C)C[C@H](C)OC(=O)NCc1[nH]cc[nH+]1 ZINC000867012655 585105501 /nfs/dbraw/zinc/10/55/01/585105501.db2.gz IDGNOTGNBXDJIA-VIFPVBQESA-N 1 2 225.292 2.071 20 0 BEADLO C[C@H]1C[C@H](C)[N@H+](Cn2ncsc2=S)C1 ZINC000740861314 585107703 /nfs/dbraw/zinc/10/77/03/585107703.db2.gz MWDCRJQHMLCLSC-YUMQZZPRSA-N 1 2 229.374 2.362 20 0 BEADLO C[C@H]1C[C@H](C)[N@@H+](Cn2ncsc2=S)C1 ZINC000740861314 585107704 /nfs/dbraw/zinc/10/77/04/585107704.db2.gz MWDCRJQHMLCLSC-YUMQZZPRSA-N 1 2 229.374 2.362 20 0 BEADLO Cc1cc(N[C@H](CCO)C2CC2)nc(C2CC2)[nH+]1 ZINC000741241670 585111367 /nfs/dbraw/zinc/11/13/67/585111367.db2.gz KBZCYXLYRJHLTE-GFCCVEGCSA-N 1 2 247.342 2.235 20 0 BEADLO CC1(C)[C@@H]2C[N@@H+](CC(F)(F)C(F)F)C[C@@H]21 ZINC000741807636 585119825 /nfs/dbraw/zinc/11/98/25/585119825.db2.gz JLSFDJGXEQTZGA-KNVOCYPGSA-N 1 2 225.229 2.475 20 0 BEADLO CC1(C)[C@@H]2C[N@H+](CC(F)(F)C(F)F)C[C@@H]21 ZINC000741807636 585119826 /nfs/dbraw/zinc/11/98/26/585119826.db2.gz JLSFDJGXEQTZGA-KNVOCYPGSA-N 1 2 225.229 2.475 20 0 BEADLO Cc1nc(NC[C@@H](O)c2ccc(F)cc2)cc[nH+]1 ZINC000742254471 585124504 /nfs/dbraw/zinc/12/45/04/585124504.db2.gz FTTKEZDNYQWDAO-GFCCVEGCSA-N 1 2 247.273 2.070 20 0 BEADLO CC(C)c1nc(NC[C@H]2CCC[C@H]2O)cc[nH+]1 ZINC000742421213 585126180 /nfs/dbraw/zinc/12/61/80/585126180.db2.gz KLIJGANQMCQHOH-GHMZBOCLSA-N 1 2 235.331 2.173 20 0 BEADLO C[C@H]1CCC[C@@]2(C1)[NH2+]C1(CCCC1)C(=O)N2C ZINC000742438489 585126343 /nfs/dbraw/zinc/12/63/43/585126343.db2.gz DAFKDOPZQUFJKS-SMDDNHRTSA-N 1 2 236.359 2.267 20 0 BEADLO O=C(/C=C\C1CC1)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000742633748 585129166 /nfs/dbraw/zinc/12/91/66/585129166.db2.gz HFEKGYFYXONLSA-SZZPACECSA-N 1 2 245.326 2.013 20 0 BEADLO CC(=O)c1cc(F)ccc1NCCn1cc[nH+]c1 ZINC000743097490 585133724 /nfs/dbraw/zinc/13/37/24/585133724.db2.gz JYBCFPDMIUQEQQ-UHFFFAOYSA-N 1 2 247.273 2.337 20 0 BEADLO FCC[NH+]1CCN(C/C=C\c2ccccc2)CC1 ZINC000746500479 585169284 /nfs/dbraw/zinc/16/92/84/585169284.db2.gz BINQWSGHIKCJII-DAXSKMNVSA-N 1 2 248.345 2.287 20 0 BEADLO C[C@@H]1C[N@H+](CCF)C[C@@H](c2ccccc2)O1 ZINC000746503911 585169384 /nfs/dbraw/zinc/16/93/84/585169384.db2.gz PMMSYVULLVRROE-YPMHNXCESA-N 1 2 223.291 2.418 20 0 BEADLO C[C@@H]1C[N@@H+](CCF)C[C@@H](c2ccccc2)O1 ZINC000746503911 585169385 /nfs/dbraw/zinc/16/93/85/585169385.db2.gz PMMSYVULLVRROE-YPMHNXCESA-N 1 2 223.291 2.418 20 0 BEADLO CCn1cnn(C[N@H+](C)CCC2CC2)c1=S ZINC000746639307 585171272 /nfs/dbraw/zinc/17/12/72/585171272.db2.gz XIOCOAQAMVZGON-UHFFFAOYSA-N 1 2 240.376 2.123 20 0 BEADLO CCn1cnn(C[N@@H+](C)CCC2CC2)c1=S ZINC000746639307 585171273 /nfs/dbraw/zinc/17/12/73/585171273.db2.gz XIOCOAQAMVZGON-UHFFFAOYSA-N 1 2 240.376 2.123 20 0 BEADLO C[C@H](CNC(=O)C=C1CCCC1)Cn1cc[nH+]c1 ZINC000747401301 585178767 /nfs/dbraw/zinc/17/87/67/585178767.db2.gz VOUDJFZRFZWIOJ-GFCCVEGCSA-N 1 2 247.342 2.136 20 0 BEADLO CC(C)CCOC(=O)N(C)Cc1c[nH+]c[nH]1 ZINC000859217231 589019837 /nfs/dbraw/zinc/01/98/37/589019837.db2.gz PXVWJINTBJTXIW-UHFFFAOYSA-N 1 2 225.292 2.024 20 0 BEADLO CC(C)CCOC(=O)N(C)Cc1c[nH]c[nH+]1 ZINC000859217231 589019839 /nfs/dbraw/zinc/01/98/39/589019839.db2.gz PXVWJINTBJTXIW-UHFFFAOYSA-N 1 2 225.292 2.024 20 0 BEADLO Cn1c[nH+]cc1COC(=O)/C=C\C(C)(C)C ZINC000747779042 585184252 /nfs/dbraw/zinc/18/42/52/585184252.db2.gz AULYGBJWQUSWNW-WAYWQWQTSA-N 1 2 222.288 2.066 20 0 BEADLO C[C@@H]1CCC[C@@H](C(=O)OCc2c[nH+]cn2C)C1 ZINC000747779909 585184256 /nfs/dbraw/zinc/18/42/56/585184256.db2.gz HGWZOWFTRGCHGS-GHMZBOCLSA-N 1 2 236.315 2.290 20 0 BEADLO Cn1nc(C[N@@H+]2CC[C@@H](C(F)F)C2)cc1Cl ZINC000859216670 589020030 /nfs/dbraw/zinc/02/00/30/589020030.db2.gz DWQAENYTPHNUSM-SSDOTTSWSA-N 1 2 249.692 2.161 20 0 BEADLO Cn1nc(C[N@H+]2CC[C@@H](C(F)F)C2)cc1Cl ZINC000859216670 589020031 /nfs/dbraw/zinc/02/00/31/589020031.db2.gz DWQAENYTPHNUSM-SSDOTTSWSA-N 1 2 249.692 2.161 20 0 BEADLO CC[C@H](C)NC(=S)Nc1c[nH+]ccc1OC ZINC000749768504 585205801 /nfs/dbraw/zinc/20/58/01/585205801.db2.gz MZZDNLCNFPIVJC-QMMMGPOBSA-N 1 2 239.344 2.175 20 0 BEADLO Cc1nc(-c2cccnc2)cc(-n2cc[nH+]c2)n1 ZINC000750530528 585216904 /nfs/dbraw/zinc/21/69/04/585216904.db2.gz MIEKCYOEGVXWJF-UHFFFAOYSA-N 1 2 237.266 2.033 20 0 BEADLO Clc1cc(C[N@@H+]2CCc3cn[nH]c3C2)ccn1 ZINC000750719702 585218858 /nfs/dbraw/zinc/21/88/58/585218858.db2.gz FIEHDJJDEMSQJQ-UHFFFAOYSA-N 1 2 248.717 2.016 20 0 BEADLO Clc1cc(C[N@H+]2CCc3cn[nH]c3C2)ccn1 ZINC000750719702 585218859 /nfs/dbraw/zinc/21/88/59/585218859.db2.gz FIEHDJJDEMSQJQ-UHFFFAOYSA-N 1 2 248.717 2.016 20 0 BEADLO C/C=C(\C)C(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000751360585 585227292 /nfs/dbraw/zinc/22/72/92/585227292.db2.gz MGYLYXRXIVIBPR-IGEMTJHASA-N 1 2 249.358 2.380 20 0 BEADLO C/C=C(/C)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000751377455 585228224 /nfs/dbraw/zinc/22/82/24/585228224.db2.gz UULFLGRXXQKTSS-LCKPPEIMSA-N 1 2 233.315 2.013 20 0 BEADLO CCC[C@H](C)OC(=O)CCc1ccc(N)[nH+]c1 ZINC000751454974 585230363 /nfs/dbraw/zinc/23/03/63/585230363.db2.gz FVUGRYBAPUFSED-JTQLQIEISA-N 1 2 236.315 2.328 20 0 BEADLO CCCCCOC(=O)CCc1ccc(N)[nH+]c1 ZINC000751441217 585230407 /nfs/dbraw/zinc/23/04/07/585230407.db2.gz ADINXAIBXFSUNO-UHFFFAOYSA-N 1 2 236.315 2.330 20 0 BEADLO COC[C@H]1CCCN1c1cc[nH+]c(C(C)C)n1 ZINC000751965352 585240003 /nfs/dbraw/zinc/24/00/03/585240003.db2.gz HLNJQPWBWYWBHV-LLVKDONJSA-N 1 2 235.331 2.215 20 0 BEADLO C[C@H]1C[NH+](CC(F)(F)C(F)F)C[C@@H]1C ZINC000752077295 585241689 /nfs/dbraw/zinc/24/16/89/585241689.db2.gz WWPYKHULTPOLST-BQBZGAKWSA-N 1 2 213.218 2.475 20 0 BEADLO Cn1c(Cl)nc(Cl)c1C[NH+]1CCCC1 ZINC000752261774 585244059 /nfs/dbraw/zinc/24/40/59/585244059.db2.gz UZKCYCYQRNAZAP-UHFFFAOYSA-N 1 2 234.130 2.323 20 0 BEADLO Cc1cc(C[N@H+](C)CCC(=O)C(C)(C)C)no1 ZINC000753706024 585266886 /nfs/dbraw/zinc/26/68/86/585266886.db2.gz XNZKLFHQQSWWJK-UHFFFAOYSA-N 1 2 238.331 2.420 20 0 BEADLO Cc1cc(C[N@@H+](C)CCC(=O)C(C)(C)C)no1 ZINC000753706024 585266887 /nfs/dbraw/zinc/26/68/87/585266887.db2.gz XNZKLFHQQSWWJK-UHFFFAOYSA-N 1 2 238.331 2.420 20 0 BEADLO C[N@H+](Cc1cn[nH]c1)Cc1cccc(Cl)n1 ZINC000754658868 585288973 /nfs/dbraw/zinc/28/89/73/585288973.db2.gz KOPRMYKLKFKASU-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO C[N@@H+](Cc1cn[nH]c1)Cc1cccc(Cl)n1 ZINC000754658868 585288974 /nfs/dbraw/zinc/28/89/74/585288974.db2.gz KOPRMYKLKFKASU-UHFFFAOYSA-N 1 2 236.706 2.090 20 0 BEADLO Cn1c[nH+]cc1COC(=O)c1ccc(Cl)o1 ZINC000754685316 585289493 /nfs/dbraw/zinc/28/94/93/585289493.db2.gz CBNLTRMZZCKDEB-UHFFFAOYSA-N 1 2 240.646 2.024 20 0 BEADLO CC(C)c1cnc(C[NH2+][C@H](C)c2cnn(C)c2)o1 ZINC000754776265 585290589 /nfs/dbraw/zinc/29/05/89/585290589.db2.gz ZTWLZHBNSZUYIH-SNVBAGLBSA-N 1 2 248.330 2.382 20 0 BEADLO CC(C)c1nc(N[C@H](CO)CC2CC2)cc[nH+]1 ZINC000754787964 585290998 /nfs/dbraw/zinc/29/09/98/585290998.db2.gz YFPYWCWVBZKJFM-NSHDSACASA-N 1 2 235.331 2.173 20 0 BEADLO CCC/C=C\C(=O)N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000756130415 585314778 /nfs/dbraw/zinc/31/47/78/585314778.db2.gz LWJADGLRBBOMCD-FJOGCWAESA-N 1 2 247.342 2.092 20 0 BEADLO Cc1cc(C[NH2+]Cc2cccnc2Cl)ncn1 ZINC000756991847 585326101 /nfs/dbraw/zinc/32/61/01/585326101.db2.gz ZEHYMVNUHYWNJB-UHFFFAOYSA-N 1 2 248.717 2.123 20 0 BEADLO C[C@H]1C[N@H+](C/C=C\c2ccccc2)CCN1C ZINC000839533955 585329064 /nfs/dbraw/zinc/32/90/64/585329064.db2.gz PTYKIVWMIVPZQA-PIZKADEWSA-N 1 2 230.355 2.336 20 0 BEADLO C[C@H]1C[N@@H+](C/C=C\c2ccccc2)CCN1C ZINC000839533955 585329065 /nfs/dbraw/zinc/32/90/65/585329065.db2.gz PTYKIVWMIVPZQA-PIZKADEWSA-N 1 2 230.355 2.336 20 0 BEADLO Cc1nnc([C@@H](C)[N@@H+]2CC[C@@H](C(F)(F)F)C2)[nH]1 ZINC000839534482 585329370 /nfs/dbraw/zinc/32/93/70/585329370.db2.gz STILTFHCQAWSGC-HTRCEHHLSA-N 1 2 248.252 2.058 20 0 BEADLO Cc1nnc([C@@H](C)[N@H+]2CC[C@@H](C(F)(F)F)C2)[nH]1 ZINC000839534482 585329371 /nfs/dbraw/zinc/32/93/71/585329371.db2.gz STILTFHCQAWSGC-HTRCEHHLSA-N 1 2 248.252 2.058 20 0 BEADLO O=C1C[C@]2(CC[N@@H+](CCF)C2)Oc2ccccc21 ZINC000839642190 585334978 /nfs/dbraw/zinc/33/49/78/585334978.db2.gz FKTPLKHEIABDHJ-AWEZNQCLSA-N 1 2 249.285 2.066 20 0 BEADLO O=C1C[C@]2(CC[N@H+](CCF)C2)Oc2ccccc21 ZINC000839642190 585334979 /nfs/dbraw/zinc/33/49/79/585334979.db2.gz FKTPLKHEIABDHJ-AWEZNQCLSA-N 1 2 249.285 2.066 20 0 BEADLO COC1(C)C[NH+](C[C@H](O)c2cc(C)cc(C)c2)C1 ZINC000759047923 585363998 /nfs/dbraw/zinc/36/39/98/585363998.db2.gz JNDVGDKQBGWMFS-AWEZNQCLSA-N 1 2 249.354 2.058 20 0 BEADLO C[C@@H]1CO[C@H](c2ccccc2)C[N@@H+]1CCF ZINC000759340173 585368832 /nfs/dbraw/zinc/36/88/32/585368832.db2.gz SHJBXFFHAFAUQG-YPMHNXCESA-N 1 2 223.291 2.418 20 0 BEADLO C[C@@H]1CO[C@H](c2ccccc2)C[N@H+]1CCF ZINC000759340173 585368833 /nfs/dbraw/zinc/36/88/33/585368833.db2.gz SHJBXFFHAFAUQG-YPMHNXCESA-N 1 2 223.291 2.418 20 0 BEADLO C[C@@H]1CC[C@@H](CC(=O)OCc2c[nH+]cn2C)C1 ZINC000759564096 585376327 /nfs/dbraw/zinc/37/63/27/585376327.db2.gz IRHUZQNUJRBSSZ-GHMZBOCLSA-N 1 2 236.315 2.290 20 0 BEADLO CCC[C@@H]([NH2+][C@@H](C)c1ccc[nH]1)C(=O)OCC ZINC000760249064 585387435 /nfs/dbraw/zinc/38/74/35/585387435.db2.gz KYJSXITTXOGXGX-CMPLNLGQSA-N 1 2 238.331 2.397 20 0 BEADLO Cc1ccc(NC(=O)C[N@@H+]2CC[C@H]3C[C@H]32)c(F)c1 ZINC000761091576 585408222 /nfs/dbraw/zinc/40/82/22/585408222.db2.gz VUJGQBDKGDZWLM-GXFFZTMASA-N 1 2 248.301 2.167 20 0 BEADLO Cc1ccc(NC(=O)C[N@H+]2CC[C@H]3C[C@H]32)c(F)c1 ZINC000761091576 585408223 /nfs/dbraw/zinc/40/82/23/585408223.db2.gz VUJGQBDKGDZWLM-GXFFZTMASA-N 1 2 248.301 2.167 20 0 BEADLO Clc1ccc(SCCn2cc[nH+]c2)nn1 ZINC000762194649 585428913 /nfs/dbraw/zinc/42/89/13/585428913.db2.gz NTAMDSWTGRFZGM-UHFFFAOYSA-N 1 2 240.719 2.119 20 0 BEADLO CC(=O)[C@H](C)SCc1cc[nH+]c(N(C)C)c1 ZINC000762481908 585432731 /nfs/dbraw/zinc/43/27/31/585432731.db2.gz VNRKIFAACMCUNV-JTQLQIEISA-N 1 2 238.356 2.358 20 0 BEADLO O=C(C(F)=C1CCCC1)N1CC(n2cc[nH+]c2)C1 ZINC000763048047 585442097 /nfs/dbraw/zinc/44/20/97/585442097.db2.gz MISJZXQTVCMPNB-UHFFFAOYSA-N 1 2 249.289 2.064 20 0 BEADLO CCc1ccc(C(=O)OCCn2cc[nH+]c2)cc1 ZINC000763114206 585443159 /nfs/dbraw/zinc/44/31/59/585443159.db2.gz FWANZOMDXOCKQE-UHFFFAOYSA-N 1 2 244.294 2.303 20 0 BEADLO O=C(CC1CCCCC1)OCCn1cc[nH+]c1 ZINC000763107926 585443354 /nfs/dbraw/zinc/44/33/54/585443354.db2.gz HCMZPVSFSCIJKP-UHFFFAOYSA-N 1 2 236.315 2.397 20 0 BEADLO Cc1ccoc1C(=O)OCCCn1cc[nH+]c1 ZINC000763288495 585446026 /nfs/dbraw/zinc/44/60/26/585446026.db2.gz WATBUOURVWFQRA-UHFFFAOYSA-N 1 2 234.255 2.032 20 0 BEADLO CCC[N@H+](CC(F)F)C[C@@H]1CC2(CC2)C(=O)O1 ZINC000763677327 585452248 /nfs/dbraw/zinc/45/22/48/585452248.db2.gz YEGABAPOJKBZMW-VIFPVBQESA-N 1 2 247.285 2.059 20 0 BEADLO CCC[N@@H+](CC(F)F)C[C@@H]1CC2(CC2)C(=O)O1 ZINC000763677327 585452249 /nfs/dbraw/zinc/45/22/49/585452249.db2.gz YEGABAPOJKBZMW-VIFPVBQESA-N 1 2 247.285 2.059 20 0 BEADLO O=c1ccnc(C=Cc2c[nH+]c3ccccn23)[nH]1 ZINC000764436386 585465604 /nfs/dbraw/zinc/46/56/04/585465604.db2.gz SYOUGSSRLACUFJ-PLNGDYQASA-N 1 2 238.250 2.000 20 0 BEADLO CC(C)(NC(=O)c1cccc2[nH+]ccn21)C1CC1 ZINC000766054721 585497097 /nfs/dbraw/zinc/49/70/97/585497097.db2.gz FKBPUVQYMUMZLZ-UHFFFAOYSA-N 1 2 243.310 2.253 20 0 BEADLO C/C=C/C=C/C(=O)OCc1c[nH+]ccc1OC ZINC000805340838 585513280 /nfs/dbraw/zinc/51/32/80/585513280.db2.gz ITDIOGAOSDOLDW-VNKDHWASSA-N 1 2 233.267 2.266 20 0 BEADLO CCC[N@H+](CC(=O)OC)Cc1cc(C)oc1C ZINC000768131267 585532373 /nfs/dbraw/zinc/53/23/73/585532373.db2.gz ZQIAAHLXLAGUFB-UHFFFAOYSA-N 1 2 239.315 2.281 20 0 BEADLO CCC[N@@H+](CC(=O)OC)Cc1cc(C)oc1C ZINC000768131267 585532374 /nfs/dbraw/zinc/53/23/74/585532374.db2.gz ZQIAAHLXLAGUFB-UHFFFAOYSA-N 1 2 239.315 2.281 20 0 BEADLO Cc1ccc2c(c1)CC[C@H]2[NH2+]CC(F)(F)CO ZINC000768286519 585535036 /nfs/dbraw/zinc/53/50/36/585535036.db2.gz MKPVEMPEZMYLOB-GFCCVEGCSA-N 1 2 241.281 2.200 20 0 BEADLO CC(C)(C)OCC(N)=[NH+]OCC1CCC1 ZINC000768934344 585546454 /nfs/dbraw/zinc/54/64/54/585546454.db2.gz OCBMIYPSRAZORP-UHFFFAOYSA-N 1 2 214.309 2.100 20 0 BEADLO Cc1cccn2cc(COC(=O)[C@H]3C[C@@H]3C)[nH+]c12 ZINC000769138228 585549861 /nfs/dbraw/zinc/54/98/61/585549861.db2.gz AWSYOKNKYXQFDO-JQWIXIFHSA-N 1 2 244.294 2.342 20 0 BEADLO C[C@@H]1C[N@H+](Cc2coc(C3CC3)n2)CCS1 ZINC000769320807 585553748 /nfs/dbraw/zinc/55/37/48/585553748.db2.gz XQDOUWDCAZDRBV-SECBINFHSA-N 1 2 238.356 2.489 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2coc(C3CC3)n2)CCS1 ZINC000769320807 585553749 /nfs/dbraw/zinc/55/37/49/585553749.db2.gz XQDOUWDCAZDRBV-SECBINFHSA-N 1 2 238.356 2.489 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)[C@@H](F)c1ccccc1 ZINC000769374831 585555077 /nfs/dbraw/zinc/55/50/77/585555077.db2.gz JRTOSDTVFIVMOR-ZDUSSCGKSA-N 1 2 244.269 2.461 20 0 BEADLO Cc1cc(C[N@@H+]2CCc3c[nH]nc3C2)c(C)o1 ZINC000769468176 585558027 /nfs/dbraw/zinc/55/80/27/585558027.db2.gz BESHKZOFAZSIBM-UHFFFAOYSA-N 1 2 231.299 2.178 20 0 BEADLO Cc1cc(C[N@H+]2CCc3c[nH]nc3C2)c(C)o1 ZINC000769468176 585558028 /nfs/dbraw/zinc/55/80/28/585558028.db2.gz BESHKZOFAZSIBM-UHFFFAOYSA-N 1 2 231.299 2.178 20 0 BEADLO CC(C)N(C(=O)c1cccc2[nH+]ccn21)C1CC1 ZINC000770077821 585570655 /nfs/dbraw/zinc/57/06/55/585570655.db2.gz LUWRDFGJRAVSPK-UHFFFAOYSA-N 1 2 243.310 2.347 20 0 BEADLO Cc1cc(NCc2cn[nH]c2)ccc1[NH+](C)C ZINC000770528021 585575511 /nfs/dbraw/zinc/57/55/11/585575511.db2.gz PNFCKILRIDKRKU-UHFFFAOYSA-N 1 2 230.315 2.396 20 0 BEADLO O=C(OCc1cccc2[nH+]ccn21)C1CCC1 ZINC000770732746 585580831 /nfs/dbraw/zinc/58/08/31/585580831.db2.gz GUOAICULDHFCAU-UHFFFAOYSA-N 1 2 230.267 2.178 20 0 BEADLO O=C(OCc1cccc2[nH+]ccn21)C1CC=CC1 ZINC000770735025 585580993 /nfs/dbraw/zinc/58/09/93/585580993.db2.gz ZEGHLBPHYSBXGU-UHFFFAOYSA-N 1 2 242.278 2.344 20 0 BEADLO O=C(OCc1cccc2[nH+]ccn21)C1=CCCC1 ZINC000770921996 585584010 /nfs/dbraw/zinc/58/40/10/585584010.db2.gz VRFOHNAXRWBMFB-UHFFFAOYSA-N 1 2 242.278 2.488 20 0 BEADLO CC(C)C(=O)OCc1cccc2[nH+]ccn21 ZINC000770922647 585584264 /nfs/dbraw/zinc/58/42/64/585584264.db2.gz OUBAWCRMBZXHGE-UHFFFAOYSA-N 1 2 218.256 2.034 20 0 BEADLO CC/C=C(/C)C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000771498860 585595566 /nfs/dbraw/zinc/59/55/66/585595566.db2.gz ILKUQJARDJBABJ-VQNWOSHQSA-N 1 2 233.315 2.430 20 0 BEADLO CCC[C@](C)(O)C(=O)Nc1ccc(C)[nH+]c1C ZINC000771550814 585596047 /nfs/dbraw/zinc/59/60/47/585596047.db2.gz IJGZCHUEYKCZAB-ZDUSSCGKSA-N 1 2 236.315 2.188 20 0 BEADLO O=C(/C=C\c1cccs1)OCCn1cc[nH+]c1 ZINC000771866856 585603021 /nfs/dbraw/zinc/60/30/21/585603021.db2.gz CBWWNRFKACBMHV-ARJAWSKDSA-N 1 2 248.307 2.201 20 0 BEADLO CCC/C(C)=C/C(=O)OCCn1cc[nH+]c1 ZINC000771935654 585605078 /nfs/dbraw/zinc/60/50/78/585605078.db2.gz BRLGGZJTAVASMP-PKNBQFBNSA-N 1 2 222.288 2.173 20 0 BEADLO CC[C@H](CC(=O)OCCn1cc[nH+]c1)C(C)C ZINC000771953532 585605460 /nfs/dbraw/zinc/60/54/60/585605460.db2.gz YQLUNTHQSRVJHZ-GFCCVEGCSA-N 1 2 238.331 2.499 20 0 BEADLO CCC1(C(=O)OCCn2cc[nH+]c2)CCCC1 ZINC000771990980 585606168 /nfs/dbraw/zinc/60/61/68/585606168.db2.gz AYHYJFABNBFRIE-UHFFFAOYSA-N 1 2 236.315 2.397 20 0 BEADLO C[C@@H]1CC/C(=C/C(=O)OCCn2cc[nH+]c2)C1 ZINC000771999730 585606649 /nfs/dbraw/zinc/60/66/49/585606649.db2.gz GWPYMGWSUUPZQQ-ZGSOTFDTSA-N 1 2 234.299 2.173 20 0 BEADLO CCC(CC)CC(=O)OCCn1cc[nH+]c1 ZINC000772005045 585606654 /nfs/dbraw/zinc/60/66/54/585606654.db2.gz RJVRJZOBCHTQIV-UHFFFAOYSA-N 1 2 224.304 2.253 20 0 BEADLO Cc1ccc(COC(=O)C2=COCCC2)c(C)[nH+]1 ZINC000772098596 585608487 /nfs/dbraw/zinc/60/84/87/585608487.db2.gz SJIYXYIYQGVSSZ-UHFFFAOYSA-N 1 2 247.294 2.436 20 0 BEADLO Cc1ocnc1C(=O)OCc1ccc(C)[nH+]c1C ZINC000772132933 585608869 /nfs/dbraw/zinc/60/88/69/585608869.db2.gz GASYUSWIVLTXQW-UHFFFAOYSA-N 1 2 246.266 2.352 20 0 BEADLO C/C(=C\C(C)(C)C)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000772994010 585629255 /nfs/dbraw/zinc/62/92/55/585629255.db2.gz KUSCRYADUJLXPP-YRNVUSSQSA-N 1 2 247.342 2.259 20 0 BEADLO C[C@@H](C(=O)OCc1c[nH+]cn1C)c1ccccc1 ZINC000774140110 585651607 /nfs/dbraw/zinc/65/16/07/585651607.db2.gz SEUWEKCRQOUNLX-LLVKDONJSA-N 1 2 244.294 2.267 20 0 BEADLO COc1cc[nH+]cc1COC(=O)/C=C/C(C)C ZINC000805540559 585674512 /nfs/dbraw/zinc/67/45/12/585674512.db2.gz UERZXKOYBMCKGS-SNAWJCMRSA-N 1 2 235.283 2.346 20 0 BEADLO CCOC(=O)C[NH2+][C@](C)(CC)c1ccccc1 ZINC000775387355 585677073 /nfs/dbraw/zinc/67/70/73/585677073.db2.gz LRLTYKRWZMIPFT-CQSZACIVSA-N 1 2 235.327 2.465 20 0 BEADLO CCCCC[C@@H](C)NC(=O)Cc1c[nH+]cn1C ZINC000776326040 585695787 /nfs/dbraw/zinc/69/57/87/585695787.db2.gz VRRLTLDZFFNWFR-LLVKDONJSA-N 1 2 237.347 2.048 20 0 BEADLO O=C(OC1CCCC1)c1cccc2[nH+]ccn21 ZINC000776728641 585703484 /nfs/dbraw/zinc/70/34/84/585703484.db2.gz QYZFAPAWWHDYRG-UHFFFAOYSA-N 1 2 230.267 2.434 20 0 BEADLO CCC/C=C/C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000777457967 585712959 /nfs/dbraw/zinc/71/29/59/585712959.db2.gz XIXJEOKUDWZXJO-TZOMUSMUSA-N 1 2 233.315 2.430 20 0 BEADLO Fc1ccc(C[NH2+]Cc2ncccc2F)cn1 ZINC000778171442 585726561 /nfs/dbraw/zinc/72/65/61/585726561.db2.gz HQERPODMSFKTKM-UHFFFAOYSA-N 1 2 235.237 2.045 20 0 BEADLO COc1ccc[nH+]c1NCc1ccc(F)nc1 ZINC000778171421 585726681 /nfs/dbraw/zinc/72/66/81/585726681.db2.gz HKEQBSKICWGKON-UHFFFAOYSA-N 1 2 233.246 2.236 20 0 BEADLO CCCOC(=O)[C@H](C)[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000778232524 585727984 /nfs/dbraw/zinc/72/79/84/585727984.db2.gz FXJIAZGMKSKNHQ-VWYCJHECSA-N 1 2 231.311 2.008 20 0 BEADLO CCCOC(=O)[C@H](C)[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000778232524 585727985 /nfs/dbraw/zinc/72/79/85/585727985.db2.gz FXJIAZGMKSKNHQ-VWYCJHECSA-N 1 2 231.311 2.008 20 0 BEADLO O=C(C[C@@H]1C=CCCC1)OCCn1cc[nH+]c1 ZINC000778394838 585733325 /nfs/dbraw/zinc/73/33/25/585733325.db2.gz HINUOCLKAOWLEU-GFCCVEGCSA-N 1 2 234.299 2.173 20 0 BEADLO CC[C@@]1(C)COCC[N@@H+]1Cc1ccc(F)nc1 ZINC000779170530 585746673 /nfs/dbraw/zinc/74/66/73/585746673.db2.gz AZAGIRYWWLRIKD-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO CC[C@@]1(C)COCC[N@H+]1Cc1ccc(F)nc1 ZINC000779170530 585746674 /nfs/dbraw/zinc/74/66/74/585746674.db2.gz AZAGIRYWWLRIKD-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO CC(C)[C@@H]1C[N@H+](Cc2ccc(F)nc2)CCO1 ZINC000779165976 585746802 /nfs/dbraw/zinc/74/68/02/585746802.db2.gz IHWGUPDPDRJGJM-LBPRGKRZSA-N 1 2 238.306 2.078 20 0 BEADLO CC(C)[C@@H]1C[N@@H+](Cc2ccc(F)nc2)CCO1 ZINC000779165976 585746803 /nfs/dbraw/zinc/74/68/03/585746803.db2.gz IHWGUPDPDRJGJM-LBPRGKRZSA-N 1 2 238.306 2.078 20 0 BEADLO Cc1cc([NH+](C)C)ccc1N[C@@H](C)CCO ZINC000779415177 585754091 /nfs/dbraw/zinc/75/40/91/585754091.db2.gz CQJFJNUTXAKFNR-NSHDSACASA-N 1 2 222.332 2.244 20 0 BEADLO Cc1cc(N(C)C)ccc1[NH2+][C@@H](C)CCO ZINC000779415177 585754092 /nfs/dbraw/zinc/75/40/92/585754092.db2.gz CQJFJNUTXAKFNR-NSHDSACASA-N 1 2 222.332 2.244 20 0 BEADLO C[C@@H](CCO)[NH2+]c1ccc2c(c1)CCCO2 ZINC000779422642 585754694 /nfs/dbraw/zinc/75/46/94/585754694.db2.gz KCEQDUCJGIVJJZ-JTQLQIEISA-N 1 2 221.300 2.194 20 0 BEADLO Cc1cc(N[C@H](C)CCO)ccc1[NH+](C)C ZINC000779424063 585754835 /nfs/dbraw/zinc/75/48/35/585754835.db2.gz YFGOBLBJJUNZTE-LLVKDONJSA-N 1 2 222.332 2.244 20 0 BEADLO Cc1cc([NH2+][C@H](C)CCO)ccc1N(C)C ZINC000779424063 585754836 /nfs/dbraw/zinc/75/48/36/585754836.db2.gz YFGOBLBJJUNZTE-LLVKDONJSA-N 1 2 222.332 2.244 20 0 BEADLO CC1CN(c2[nH+]cnc3c2cnn3C(C)(C)C)C1 ZINC000779710824 585759514 /nfs/dbraw/zinc/75/95/14/585759514.db2.gz MWBHLKQJCCQRJX-UHFFFAOYSA-N 1 2 245.330 2.037 20 0 BEADLO CC/C(C)=C(\C)C(=O)NC[C@@H](C)Cn1cc[nH+]c1 ZINC000780951376 585787085 /nfs/dbraw/zinc/78/70/85/585787085.db2.gz WUDOYGYNVGERPV-GXZRWPEMSA-N 1 2 249.358 2.382 20 0 BEADLO CC/C(C)=C(/C)C(=O)N(C)CCCn1cc[nH+]c1 ZINC000780986271 585787754 /nfs/dbraw/zinc/78/77/54/585787754.db2.gz XKDLJQGOXYUCFH-SEYXRHQNSA-N 1 2 249.358 2.478 20 0 BEADLO CC/C(C)=C(\C)C(=O)N(C)CCCn1cc[nH+]c1 ZINC000780986269 585787983 /nfs/dbraw/zinc/78/79/83/585787983.db2.gz XKDLJQGOXYUCFH-OUKQBFOZSA-N 1 2 249.358 2.478 20 0 BEADLO Cn1c[nH+]cc1COC(=O)C1(C)CCCCC1 ZINC000781495545 585797719 /nfs/dbraw/zinc/79/77/19/585797719.db2.gz FPCVROBUNYCKHB-UHFFFAOYSA-N 1 2 236.315 2.434 20 0 BEADLO COC(=O)[C@@H]1CCCCC[N@@H+]1Cc1ccoc1 ZINC000781526133 585798148 /nfs/dbraw/zinc/79/81/48/585798148.db2.gz CBBNAOBNSFWLIU-LBPRGKRZSA-N 1 2 237.299 2.197 20 0 BEADLO COC(=O)[C@@H]1CCCCC[N@H+]1Cc1ccoc1 ZINC000781526133 585798149 /nfs/dbraw/zinc/79/81/49/585798149.db2.gz CBBNAOBNSFWLIU-LBPRGKRZSA-N 1 2 237.299 2.197 20 0 BEADLO CC(C)(C(=O)OCCCn1cc[nH+]c1)C1CC1 ZINC000805702706 585802942 /nfs/dbraw/zinc/80/29/42/585802942.db2.gz ADZNIKRRMFEUGS-UHFFFAOYSA-N 1 2 236.315 2.253 20 0 BEADLO CN(C)c1cc(COC(=O)C2CCCC2)cc[nH+]1 ZINC000782147674 585808513 /nfs/dbraw/zinc/80/85/13/585808513.db2.gz VFYFOTAFYYRDLW-UHFFFAOYSA-N 1 2 248.326 2.381 20 0 BEADLO CO[C@@H]1CCC[N@H+](CC(F)(F)C(F)F)CC1 ZINC000783011608 585826811 /nfs/dbraw/zinc/82/68/11/585826811.db2.gz BLMAWZJURNMWGH-MRVPVSSYSA-N 1 2 243.244 2.388 20 0 BEADLO CO[C@@H]1CCC[N@@H+](CC(F)(F)C(F)F)CC1 ZINC000783011608 585826812 /nfs/dbraw/zinc/82/68/12/585826812.db2.gz BLMAWZJURNMWGH-MRVPVSSYSA-N 1 2 243.244 2.388 20 0 BEADLO CCc1cnccc1[C@@H](C)[NH2+]Cc1nonc1C ZINC000783015701 585826881 /nfs/dbraw/zinc/82/68/81/585826881.db2.gz GATIIHHJPIBRNZ-SECBINFHSA-N 1 2 246.314 2.186 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)[C@H]1CC12CCCC2 ZINC000783982398 585846603 /nfs/dbraw/zinc/84/66/03/585846603.db2.gz CXGOJZGMIKSYPB-GFCCVEGCSA-N 1 2 248.326 2.397 20 0 BEADLO COc1cc[nH+]cc1NC(=O)[C@@H](F)C(C)C ZINC000784079534 585848906 /nfs/dbraw/zinc/84/89/06/585848906.db2.gz PVZGBYLTVVYGLQ-JTQLQIEISA-N 1 2 226.251 2.023 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)[C@H]1CC12CCC2 ZINC000784138133 585851093 /nfs/dbraw/zinc/85/10/93/585851093.db2.gz IRZMKOUQVNTSQI-LLVKDONJSA-N 1 2 234.299 2.007 20 0 BEADLO CC(C)[C@@H](F)C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000784459518 585860753 /nfs/dbraw/zinc/86/07/53/585860753.db2.gz KBKYJGUDBIISDS-NXEZZACHSA-N 1 2 239.294 2.067 20 0 BEADLO CCC/C=C\C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000785421862 585873374 /nfs/dbraw/zinc/87/33/74/585873374.db2.gz VQZPZDVVMQBOBV-GFVADAIESA-N 1 2 221.304 2.333 20 0 BEADLO CCCC=CC(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000785421862 585873375 /nfs/dbraw/zinc/87/33/75/585873375.db2.gz VQZPZDVVMQBOBV-GFVADAIESA-N 1 2 221.304 2.333 20 0 BEADLO CC[N@@H+]1CCCC[C@@H]1C(=O)OCC(C)(C)F ZINC000785918851 585883258 /nfs/dbraw/zinc/88/32/58/585883258.db2.gz IEAAXWRPXATFLI-SNVBAGLBSA-N 1 2 231.311 2.152 20 0 BEADLO CC[N@H+]1CCCC[C@@H]1C(=O)OCC(C)(C)F ZINC000785918851 585883259 /nfs/dbraw/zinc/88/32/59/585883259.db2.gz IEAAXWRPXATFLI-SNVBAGLBSA-N 1 2 231.311 2.152 20 0 BEADLO CC[C@@]1(C)C[N@H+](Cc2ccc(F)nc2)CCO1 ZINC000785984020 585884465 /nfs/dbraw/zinc/88/44/65/585884465.db2.gz BSZZKPOTVIRZKO-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO CC[C@@]1(C)C[N@@H+](Cc2ccc(F)nc2)CCO1 ZINC000785984020 585884466 /nfs/dbraw/zinc/88/44/66/585884466.db2.gz BSZZKPOTVIRZKO-ZDUSSCGKSA-N 1 2 238.306 2.222 20 0 BEADLO Cc1ccc(C(=O)OCc2cc[nH+]c(N)c2)s1 ZINC000787577788 585912215 /nfs/dbraw/zinc/91/22/15/585912215.db2.gz DSWDIOQGMDMOMP-UHFFFAOYSA-N 1 2 248.307 2.391 20 0 BEADLO Nc1cc(COC(=O)CC2CCCC2)cc[nH+]1 ZINC000787577787 585912257 /nfs/dbraw/zinc/91/22/57/585912257.db2.gz DSUBUCHMZPIGBX-UHFFFAOYSA-N 1 2 234.299 2.287 20 0 BEADLO Nc1cc(COC(=O)c2ccccc2)cc[nH+]1 ZINC000787592547 585912663 /nfs/dbraw/zinc/91/26/63/585912663.db2.gz OUSGHJJPWDFTSK-UHFFFAOYSA-N 1 2 228.251 2.021 20 0 BEADLO CC1CCC(CO[NH+]=C(N)[C@H]2CCCO2)CC1 ZINC000789609267 585946455 /nfs/dbraw/zinc/94/64/55/585946455.db2.gz MPUKFXNMMVWXKX-HTAVTVPLSA-N 1 2 240.347 2.490 20 0 BEADLO CCC(CC)C(=O)OCCCc1[nH+]ccn1C ZINC000789787245 585949896 /nfs/dbraw/zinc/94/98/96/585949896.db2.gz ICRRGFBMODOLIO-UHFFFAOYSA-N 1 2 238.331 2.332 20 0 BEADLO CCCCC(=O)OCCCc1[nH+]ccn1C ZINC000789792771 585950280 /nfs/dbraw/zinc/95/02/80/585950280.db2.gz ZTSMBXBPMMJGEF-UHFFFAOYSA-N 1 2 224.304 2.086 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1CC(=O)OCc1ccccc1 ZINC000791566040 585984183 /nfs/dbraw/zinc/98/41/83/585984183.db2.gz LHURJIOYTWNJMT-TXEJJXNPSA-N 1 2 233.311 2.213 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1CC(=O)OCc1ccccc1 ZINC000791566040 585984184 /nfs/dbraw/zinc/98/41/84/585984184.db2.gz LHURJIOYTWNJMT-TXEJJXNPSA-N 1 2 233.311 2.213 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1cnn(-c2ccccc2)n1 ZINC000791568247 585984330 /nfs/dbraw/zinc/98/43/30/585984330.db2.gz MXQVCQGEMJGHHJ-TXEJJXNPSA-N 1 2 242.326 2.250 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1cnn(-c2ccccc2)n1 ZINC000791568247 585984331 /nfs/dbraw/zinc/98/43/31/585984331.db2.gz MXQVCQGEMJGHHJ-TXEJJXNPSA-N 1 2 242.326 2.250 20 0 BEADLO Cc1nonc1C[N@H+]1CC[C@@H](C(F)(F)F)[C@@H]1C ZINC000791583185 585984880 /nfs/dbraw/zinc/98/48/80/585984880.db2.gz MRCFNHIMXAPFLY-JGVFFNPUSA-N 1 2 249.236 2.151 20 0 BEADLO Cc1nonc1C[N@@H+]1CC[C@@H](C(F)(F)F)[C@@H]1C ZINC000791583185 585984881 /nfs/dbraw/zinc/98/48/81/585984881.db2.gz MRCFNHIMXAPFLY-JGVFFNPUSA-N 1 2 249.236 2.151 20 0 BEADLO CC(C)C[C@H](C)C(=O)OCc1cc[nH+]c(N)c1 ZINC000792130516 585996155 /nfs/dbraw/zinc/99/61/55/585996155.db2.gz CDXPJGRYETZUDN-JTQLQIEISA-N 1 2 236.315 2.389 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)[C@@H]1CC12CCCC2 ZINC000793251730 586015114 /nfs/dbraw/zinc/01/51/14/586015114.db2.gz VQIPWRNRWUCRIE-LBPRGKRZSA-N 1 2 248.326 2.086 20 0 BEADLO C[C@@H](C(=O)OCCc1c[nH+]cn1C)C(C)(C)C ZINC000793256864 586015400 /nfs/dbraw/zinc/01/54/00/586015400.db2.gz DVJVWLCJOFEKHV-JTQLQIEISA-N 1 2 238.331 2.188 20 0 BEADLO FC1(F)CC[NH+](Cc2cscn2)CC1 ZINC000793352322 586017148 /nfs/dbraw/zinc/01/71/48/586017148.db2.gz LFACKTZANTXMNI-UHFFFAOYSA-N 1 2 218.272 2.374 20 0 BEADLO CC1(C)CC(CC(=O)NC2=[NH+]CCS2)C1 ZINC000794211524 586035333 /nfs/dbraw/zinc/03/53/33/586035333.db2.gz UPUWPWOSNZLOPP-UHFFFAOYSA-N 1 2 226.345 2.032 20 0 BEADLO NC(=[NH+]OCCCCF)c1ccccc1 ZINC000795197128 586071172 /nfs/dbraw/zinc/07/11/72/586071172.db2.gz LXHRTSLRFLFPPR-UHFFFAOYSA-N 1 2 210.252 2.283 20 0 BEADLO CC(C)(C)OCC(N)=[NH+]OCCCCF ZINC000795216203 586072301 /nfs/dbraw/zinc/07/23/01/586072301.db2.gz HUQCLCZLDCKUJY-UHFFFAOYSA-N 1 2 220.288 2.050 20 0 BEADLO C[N@H+](Cc1cccs1)[C@@H]1CC(C)(C)OC1=O ZINC000795653197 586089861 /nfs/dbraw/zinc/08/98/61/586089861.db2.gz PNDQGRKJBXPVKZ-SNVBAGLBSA-N 1 2 239.340 2.274 20 0 BEADLO C[N@@H+](Cc1cccs1)[C@@H]1CC(C)(C)OC1=O ZINC000795653197 586089862 /nfs/dbraw/zinc/08/98/62/586089862.db2.gz PNDQGRKJBXPVKZ-SNVBAGLBSA-N 1 2 239.340 2.274 20 0 BEADLO CCC(=O)OCc1cn2cc(C)ccc2[nH+]1 ZINC000795915876 586093809 /nfs/dbraw/zinc/09/38/09/586093809.db2.gz FZBIRBMCPLJDET-UHFFFAOYSA-N 1 2 218.256 2.096 20 0 BEADLO Cc1noc([C@@H](C)[NH+]2CCC(F)(F)CC2)n1 ZINC000796540229 586106593 /nfs/dbraw/zinc/10/65/93/586106593.db2.gz HUGGQIUWTMYRAW-SSDOTTSWSA-N 1 2 231.246 2.170 20 0 BEADLO C[C@@H]([NH2+]Cc1ncccn1)c1ccnc(Cl)c1 ZINC000796592235 586108188 /nfs/dbraw/zinc/10/81/88/586108188.db2.gz CQNTYXYJKARJII-SECBINFHSA-N 1 2 248.717 2.376 20 0 BEADLO Cc1noc(C)c1[C@@H](C)[NH2+][C@@H](C)c1ncc[nH]1 ZINC000796764878 586111892 /nfs/dbraw/zinc/11/18/92/586111892.db2.gz VSRIAIXFWSMXPH-APPZFPTMSA-N 1 2 234.303 2.426 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCCc2[nH]ncc21)c1ccc[nH]1 ZINC000796845223 586114674 /nfs/dbraw/zinc/11/46/74/586114674.db2.gz HDHVGCNRDVHKPS-SKDRFNHKSA-N 1 2 230.315 2.466 20 0 BEADLO CC1=C[C@@H](C)C[N@H+](Cn2cc(Cl)cn2)C1 ZINC000797416043 586126740 /nfs/dbraw/zinc/12/67/40/586126740.db2.gz FYXMXGWGYWCXJX-SECBINFHSA-N 1 2 225.723 2.392 20 0 BEADLO CC1=C[C@@H](C)C[N@@H+](Cn2cc(Cl)cn2)C1 ZINC000797416043 586126741 /nfs/dbraw/zinc/12/67/41/586126741.db2.gz FYXMXGWGYWCXJX-SECBINFHSA-N 1 2 225.723 2.392 20 0 BEADLO CCn1cnn(C[N@@H+]2CCC=C(C)C2)c1=S ZINC000797823123 586132343 /nfs/dbraw/zinc/13/23/43/586132343.db2.gz YZZFBGMDGKQOPI-UHFFFAOYSA-N 1 2 238.360 2.043 20 0 BEADLO CCn1cnn(C[N@H+]2CCC=C(C)C2)c1=S ZINC000797823123 586132344 /nfs/dbraw/zinc/13/23/44/586132344.db2.gz YZZFBGMDGKQOPI-UHFFFAOYSA-N 1 2 238.360 2.043 20 0 BEADLO Cc1cc(C)c(CNC(=S)NC2CCC2)c[nH+]1 ZINC000840826717 586142639 /nfs/dbraw/zinc/14/26/39/586142639.db2.gz UAGKWROQVMRYNB-UHFFFAOYSA-N 1 2 249.383 2.215 20 0 BEADLO C[C@H]1C[C@H](C)[NH+]1Cc1cnc(Cl)cn1 ZINC000799167987 586161288 /nfs/dbraw/zinc/16/12/88/586161288.db2.gz KDPSXUDFLLYQRN-YUMQZZPRSA-N 1 2 211.696 2.113 20 0 BEADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1cnc(Cl)cn1 ZINC000799167986 586163817 /nfs/dbraw/zinc/16/38/17/586163817.db2.gz KDPSXUDFLLYQRN-OCAPTIKFSA-N 1 2 211.696 2.113 20 0 BEADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1cnc(Cl)cn1 ZINC000799167986 586163818 /nfs/dbraw/zinc/16/38/18/586163818.db2.gz KDPSXUDFLLYQRN-OCAPTIKFSA-N 1 2 211.696 2.113 20 0 BEADLO C[C@@H](c1ccccn1)[N@@H+]1CCO[C@@H](C(F)F)C1 ZINC000801559171 586262023 /nfs/dbraw/zinc/26/20/23/586262023.db2.gz FBCQQLRYLZMBER-GXSJLCMTSA-N 1 2 242.269 2.109 20 0 BEADLO C[C@@H](c1ccccn1)[N@H+]1CCO[C@@H](C(F)F)C1 ZINC000801559171 586262024 /nfs/dbraw/zinc/26/20/24/586262024.db2.gz FBCQQLRYLZMBER-GXSJLCMTSA-N 1 2 242.269 2.109 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)O[C@@H]2CC[N@@H+](CCF)C2)C1 ZINC000802234225 586298070 /nfs/dbraw/zinc/29/80/70/586298070.db2.gz BGDDNKMUCZSKNW-IJLUTSLNSA-N 1 2 243.322 2.010 20 0 BEADLO C[C@@H]1CC[C@@H](C(=O)O[C@@H]2CC[N@H+](CCF)C2)C1 ZINC000802234225 586298067 /nfs/dbraw/zinc/29/80/67/586298067.db2.gz BGDDNKMUCZSKNW-IJLUTSLNSA-N 1 2 243.322 2.010 20 0 BEADLO CCCC1(C(=O)O[C@H]2CC[N@H+](CCF)C2)CC1 ZINC000802232738 586298284 /nfs/dbraw/zinc/29/82/84/586298284.db2.gz TZTYKHVIYATYMS-NSHDSACASA-N 1 2 243.322 2.154 20 0 BEADLO CCCC1(C(=O)O[C@H]2CC[N@@H+](CCF)C2)CC1 ZINC000802232738 586298286 /nfs/dbraw/zinc/29/82/86/586298286.db2.gz TZTYKHVIYATYMS-NSHDSACASA-N 1 2 243.322 2.154 20 0 BEADLO Cc1ccoc1C(=O)OCCCc1[nH+]ccn1C ZINC000802785805 586313979 /nfs/dbraw/zinc/31/39/79/586313979.db2.gz HBGGUCAJYDNJKN-UHFFFAOYSA-N 1 2 248.282 2.111 20 0 BEADLO CCC/C=C/C(=O)OCCCc1[nH+]ccn1C ZINC000802785053 586314458 /nfs/dbraw/zinc/31/44/58/586314458.db2.gz ZGIHLHIYMBXCAM-VMPITWQZSA-N 1 2 236.315 2.252 20 0 BEADLO CC[C@H](C)CCC(=O)OCCn1cc[nH+]c1 ZINC000802815474 586316576 /nfs/dbraw/zinc/31/65/76/586316576.db2.gz ZUJQCVOLQPWUJN-NSHDSACASA-N 1 2 224.304 2.253 20 0 BEADLO C[C@H]1C[C@H]1COC(=O)c1ccc2[nH+]ccn2c1 ZINC000859551825 589044374 /nfs/dbraw/zinc/04/43/74/589044374.db2.gz HIXKBFIAVJISHI-ONGXEEELSA-N 1 2 230.267 2.147 20 0 BEADLO CC/C(C)=C(/C)C(=O)N[C@@H]1CCc2c[nH+]cn2C1 ZINC000804331886 586391740 /nfs/dbraw/zinc/39/17/40/586391740.db2.gz FEZHEBGVYMZGJW-NLYDNYMLSA-N 1 2 247.342 2.061 20 0 BEADLO Cc1nc(C)c(C[N@@H+]2CCO[C@@H]3CCC[C@@H]32)o1 ZINC000859639825 589051363 /nfs/dbraw/zinc/05/13/63/589051363.db2.gz CSCJXPPAHWTUJK-NWDGAFQWSA-N 1 2 236.315 2.045 20 0 BEADLO Cc1nc(C)c(C[N@H+]2CCO[C@@H]3CCC[C@@H]32)o1 ZINC000859639825 589051365 /nfs/dbraw/zinc/05/13/65/589051365.db2.gz CSCJXPPAHWTUJK-NWDGAFQWSA-N 1 2 236.315 2.045 20 0 BEADLO CC1(C)CC(=O)N(C[N@@H+]2CCC[C@](C)(F)C2)C1 ZINC000840099985 586445826 /nfs/dbraw/zinc/44/58/26/586445826.db2.gz RCTKYUNTWWUHEF-ZDUSSCGKSA-N 1 2 242.338 2.026 20 0 BEADLO CC1(C)CC(=O)N(C[N@H+]2CCC[C@](C)(F)C2)C1 ZINC000840099985 586445827 /nfs/dbraw/zinc/44/58/27/586445827.db2.gz RCTKYUNTWWUHEF-ZDUSSCGKSA-N 1 2 242.338 2.026 20 0 BEADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cn(C)cn2)o1 ZINC000808381237 586469984 /nfs/dbraw/zinc/46/99/84/586469984.db2.gz NFJHCVOCADDTIZ-GWCFXTLKSA-N 1 2 245.326 2.426 20 0 BEADLO C[C@H](C1CC1)n1cc(NCc2cn(C)c[nH+]2)cn1 ZINC000808407288 586471681 /nfs/dbraw/zinc/47/16/81/586471681.db2.gz SVHMTINJXUTNBU-SNVBAGLBSA-N 1 2 245.330 2.200 20 0 BEADLO Oc1ccc2c(c1)OCC[N@@H+](Cc1ccoc1)C2 ZINC000809705267 586513769 /nfs/dbraw/zinc/51/37/69/586513769.db2.gz ROPLILYVJNXRHV-UHFFFAOYSA-N 1 2 245.278 2.380 20 0 BEADLO Oc1ccc2c(c1)OCC[N@H+](Cc1ccoc1)C2 ZINC000809705267 586513770 /nfs/dbraw/zinc/51/37/70/586513770.db2.gz ROPLILYVJNXRHV-UHFFFAOYSA-N 1 2 245.278 2.380 20 0 BEADLO CCc1cccc(F)c1C[NH2+]Cc1nonc1C ZINC000809745532 586516291 /nfs/dbraw/zinc/51/62/91/586516291.db2.gz WRSCLSSPYRLSSR-UHFFFAOYSA-N 1 2 249.289 2.369 20 0 BEADLO CC(C)COC(=O)C[N@@H+]1CCC(F)(F)[C@H](C)C1 ZINC000810045123 586532532 /nfs/dbraw/zinc/53/25/32/586532532.db2.gz DJRJMLFWXMPMBQ-SNVBAGLBSA-N 1 2 249.301 2.163 20 0 BEADLO CC(C)COC(=O)C[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000810045123 586532533 /nfs/dbraw/zinc/53/25/33/586532533.db2.gz DJRJMLFWXMPMBQ-SNVBAGLBSA-N 1 2 249.301 2.163 20 0 BEADLO COc1ccc([C@H](C)[NH2+]Cc2ccon2)cc1O ZINC000810222258 586537438 /nfs/dbraw/zinc/53/74/38/586537438.db2.gz XQZAPODNCQALGM-VIFPVBQESA-N 1 2 248.282 2.240 20 0 BEADLO CC(C)C(=O)OCC1CC[NH+](CC(F)F)CC1 ZINC000810959652 586551789 /nfs/dbraw/zinc/55/17/89/586551789.db2.gz GVJIWPYAMZOKAC-UHFFFAOYSA-N 1 2 249.301 2.163 20 0 BEADLO Cc1nc(F)ccc1CNc1ccc(CO)c[nH+]1 ZINC000811501569 586559885 /nfs/dbraw/zinc/55/98/85/586559885.db2.gz OHEHFGGFFYGKEG-UHFFFAOYSA-N 1 2 247.273 2.029 20 0 BEADLO CCC(CC)(CC)C(=O)NCc1c[nH+]cn1C ZINC000811589111 586561810 /nfs/dbraw/zinc/56/18/10/586561810.db2.gz KEQCURBIDUUGRH-UHFFFAOYSA-N 1 2 237.347 2.253 20 0 BEADLO CC(=O)c1c(F)cccc1NCc1c[nH+]cn1C ZINC000811846820 586567848 /nfs/dbraw/zinc/56/78/48/586567848.db2.gz YREDIKOMFLIVIT-UHFFFAOYSA-N 1 2 247.273 2.374 20 0 BEADLO C[N@H+](Cc1ccsc1)[C@@H]1CC(C)(C)OC1=O ZINC000814179839 586615265 /nfs/dbraw/zinc/61/52/65/586615265.db2.gz HRDMKVFDRZYQNP-SNVBAGLBSA-N 1 2 239.340 2.274 20 0 BEADLO C[N@@H+](Cc1ccsc1)[C@@H]1CC(C)(C)OC1=O ZINC000814179839 586615266 /nfs/dbraw/zinc/61/52/66/586615266.db2.gz HRDMKVFDRZYQNP-SNVBAGLBSA-N 1 2 239.340 2.274 20 0 BEADLO C[C@]1(C(=O)OCc2cc[nH+]c(N)c2)C[C@H]2C[C@H]2C1 ZINC000815366158 586681191 /nfs/dbraw/zinc/68/11/91/586681191.db2.gz RPWQFJBYBAMRQF-YABSGUDNSA-N 1 2 246.310 2.143 20 0 BEADLO C[C@@H](C(=O)OCCCn1cc[nH+]c1)C(C)(F)F ZINC000815492467 586686458 /nfs/dbraw/zinc/68/64/58/586686458.db2.gz NRFHACPGRCBLMG-VIFPVBQESA-N 1 2 246.257 2.108 20 0 BEADLO Cn1c[nH+]cc1COC(=O)CC(C)(C)C1CC1 ZINC000815968059 586700508 /nfs/dbraw/zinc/70/05/08/586700508.db2.gz VDJWDNNTFAYOQI-UHFFFAOYSA-N 1 2 236.315 2.290 20 0 BEADLO Oc1ccc(F)c(C[N@H+]2CC=CCC2)c1F ZINC000816564856 586741063 /nfs/dbraw/zinc/74/10/63/586741063.db2.gz SLNOSCJJNHQXRQ-UHFFFAOYSA-N 1 2 225.238 2.432 20 0 BEADLO Oc1ccc(F)c(C[N@@H+]2CC=CCC2)c1F ZINC000816564856 586741066 /nfs/dbraw/zinc/74/10/66/586741066.db2.gz SLNOSCJJNHQXRQ-UHFFFAOYSA-N 1 2 225.238 2.432 20 0 BEADLO Cc1nonc1C[NH2+]Cc1ccsc1C ZINC000816611203 586744152 /nfs/dbraw/zinc/74/41/52/586744152.db2.gz KDAHRKQWXFCGAQ-UHFFFAOYSA-N 1 2 223.301 2.038 20 0 BEADLO Cc1nc2ccccn2c1C[N@H+](C)CCF ZINC000816639916 586746555 /nfs/dbraw/zinc/74/65/55/586746555.db2.gz LHYVKJDDOKUCFV-UHFFFAOYSA-N 1 2 221.279 2.044 20 0 BEADLO Cc1nc2ccccn2c1C[N@@H+](C)CCF ZINC000816639916 586746557 /nfs/dbraw/zinc/74/65/57/586746557.db2.gz LHYVKJDDOKUCFV-UHFFFAOYSA-N 1 2 221.279 2.044 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1coc(C2CC2)n1 ZINC000816648140 586750521 /nfs/dbraw/zinc/75/05/21/586750521.db2.gz FVHUZTWQXBTQMR-DTWKUNHWSA-N 1 2 206.289 2.392 20 0 BEADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1coc(C2CC2)n1 ZINC000816648140 586750522 /nfs/dbraw/zinc/75/05/22/586750522.db2.gz FVHUZTWQXBTQMR-DTWKUNHWSA-N 1 2 206.289 2.392 20 0 BEADLO CCCCC[C@@H](C)NC(=O)Cc1[nH]cc[nH+]1 ZINC000816839419 586767491 /nfs/dbraw/zinc/76/74/91/586767491.db2.gz FETDKYJEPNMWSV-SNVBAGLBSA-N 1 2 223.320 2.037 20 0 BEADLO CCCC[C@H](CC)CNC(=O)Cc1[nH]cc[nH+]1 ZINC000816843416 586767613 /nfs/dbraw/zinc/76/76/13/586767613.db2.gz BAIXPSUTJDATSP-NSHDSACASA-N 1 2 237.347 2.285 20 0 BEADLO C[C@H](c1cccs1)N(C)C(=O)Cc1[nH]cc[nH+]1 ZINC000816889334 586769525 /nfs/dbraw/zinc/76/95/25/586769525.db2.gz UUHJGBHKXLHMGJ-SECBINFHSA-N 1 2 249.339 2.233 20 0 BEADLO O=C(Cc1[nH]cc[nH+]1)N[C@H]1C[C@H]1C1CCCCC1 ZINC000816936056 586771730 /nfs/dbraw/zinc/77/17/30/586771730.db2.gz COWYKKHMCMPXTA-RYUDHWBXSA-N 1 2 247.342 2.037 20 0 BEADLO Cc1cc(CNC(=S)NC2(C)CC2)cc(C)[nH+]1 ZINC000817562942 586811441 /nfs/dbraw/zinc/81/14/41/586811441.db2.gz RCLNURNWPWSLLQ-UHFFFAOYSA-N 1 2 249.383 2.215 20 0 BEADLO C[C@H](CSC(C)(C)C)[NH2+]CC(F)(F)CN ZINC000817966942 586856939 /nfs/dbraw/zinc/85/69/39/586856939.db2.gz ZXQCIKUIZLIQSY-MRVPVSSYSA-N 1 2 240.363 2.090 20 0 BEADLO C[C@H]1CC/C(=C/C(=O)Nc2ccc(N)[nH+]c2)C1 ZINC000818541225 586899059 /nfs/dbraw/zinc/89/90/59/586899059.db2.gz QDMJGRXAMURPKF-CBFJXKFUSA-N 1 2 231.299 2.349 20 0 BEADLO C[C@H]([NH2+][C@@H](C)c1ccns1)c1csnn1 ZINC000860061543 589076947 /nfs/dbraw/zinc/07/69/47/589076947.db2.gz LCGNBFITVIWDDI-BQBZGAKWSA-N 1 2 240.357 2.406 20 0 BEADLO Cc1ccccc1[C@H](O)C[NH2+]CC(C)(F)F ZINC000819332070 586953236 /nfs/dbraw/zinc/95/32/36/586953236.db2.gz JEPDKNIGKLRPAU-LLVKDONJSA-N 1 2 229.270 2.273 20 0 BEADLO CC[C@H](NC(=O)C(F)=C1CCC1)c1[nH]cc[nH+]1 ZINC000819499336 586970332 /nfs/dbraw/zinc/97/03/32/586970332.db2.gz VITFXVRRVCALBJ-VIFPVBQESA-N 1 2 237.278 2.385 20 0 BEADLO C[C@H]1C[C@H](NC(=O)C(F)=C2CCC2)c2[nH+]ccn21 ZINC000819558297 586977069 /nfs/dbraw/zinc/97/70/69/586977069.db2.gz SLDNUKHNASXAHO-WPRPVWTQSA-N 1 2 249.289 2.413 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)C(F)=C2CCC2)c2[nH+]ccn21 ZINC000819558296 586977103 /nfs/dbraw/zinc/97/71/03/586977103.db2.gz SLDNUKHNASXAHO-WCBMZHEXSA-N 1 2 249.289 2.413 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)CCc2ccccc2)S1 ZINC000819760462 586990186 /nfs/dbraw/zinc/99/01/86/586990186.db2.gz OZLXJRKJKZQFIE-SNVBAGLBSA-N 1 2 248.351 2.227 20 0 BEADLO CCC/C(C)=C\C(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819764123 586991027 /nfs/dbraw/zinc/99/10/27/586991027.db2.gz BNKMXOVSMULVMI-XZLDQRQTSA-N 1 2 226.345 2.340 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)CC(C)(C)C)S1 ZINC000819767141 586991373 /nfs/dbraw/zinc/99/13/73/586991373.db2.gz DEEIQBTVYBEPOH-SSDOTTSWSA-N 1 2 214.334 2.030 20 0 BEADLO Cc1ccc(CC(=O)NC2=[NH+]C[C@@H](C)S2)cc1 ZINC000819768642 586991653 /nfs/dbraw/zinc/99/16/53/586991653.db2.gz SSHORVIUZFKYEG-SNVBAGLBSA-N 1 2 248.351 2.145 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)C2C(C)(C)C2(C)C)S1 ZINC000819770658 586991880 /nfs/dbraw/zinc/99/18/80/586991880.db2.gz AWUUDIJFHACFBT-SSDOTTSWSA-N 1 2 240.372 2.276 20 0 BEADLO C[C@@H]1CC[C@H](C(=O)NC2=[NH+]C[C@@H](C)S2)C1 ZINC000819775393 586992791 /nfs/dbraw/zinc/99/27/91/586992791.db2.gz FTVHIESABJHTJJ-HLTSFMKQSA-N 1 2 226.345 2.030 20 0 BEADLO CC[C@H](C)CCC(=O)NC1=[NH+]C[C@H](C)S1 ZINC000819777466 586993314 /nfs/dbraw/zinc/99/33/14/586993314.db2.gz JIBIOJOMHHUKKF-IUCAKERBSA-N 1 2 228.361 2.420 20 0 BEADLO CC[C@@H]1CCC[C@@H]1C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819781169 586993742 /nfs/dbraw/zinc/99/37/42/586993742.db2.gz MELZNAXVJFAHEZ-BBBLOLIVSA-N 1 2 240.372 2.420 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)C[C@@H]2CC[C@H]3C[C@H]32)S1 ZINC000819781429 586993819 /nfs/dbraw/zinc/99/38/19/586993819.db2.gz ODGWUQNMXUJNNW-XFWSIPNHSA-N 1 2 238.356 2.030 20 0 BEADLO CC(C)[C@@]1(C)C[C@@H]1C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819780655 586994102 /nfs/dbraw/zinc/99/41/02/586994102.db2.gz IGPYUPARJDVHLH-KBVBSXBZSA-N 1 2 240.372 2.276 20 0 BEADLO CCC[C@@H]1C[C@H]1C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000819782444 586994711 /nfs/dbraw/zinc/99/47/11/586994711.db2.gz VIDAMKHIVIZKCW-IWSPIJDZSA-N 1 2 226.345 2.030 20 0 BEADLO CN(C[C@](C)(O)c1ccccc1)c1cccc[nH+]1 ZINC000819951275 587005683 /nfs/dbraw/zinc/00/56/83/587005683.db2.gz UVPDBKJZWQSAEI-HNNXBMFYSA-N 1 2 242.322 2.426 20 0 BEADLO CCC(=CC(=O)N1CCc2[nH]c[nH+]c2C1)CC ZINC000819968789 587008448 /nfs/dbraw/zinc/00/84/48/587008448.db2.gz WQTVIRBRROBVHB-UHFFFAOYSA-N 1 2 233.315 2.041 20 0 BEADLO CCC(=CC(=O)N1CCc2[nH+]c[nH]c2C1)CC ZINC000819968789 587008451 /nfs/dbraw/zinc/00/84/51/587008451.db2.gz WQTVIRBRROBVHB-UHFFFAOYSA-N 1 2 233.315 2.041 20 0 BEADLO C[C@@H](NC(=O)CCC1(C)CC1)c1[nH]cc[nH+]1 ZINC000820192040 587033851 /nfs/dbraw/zinc/03/38/51/587033851.db2.gz VYIOWOWJAAQTCU-SECBINFHSA-N 1 2 221.304 2.167 20 0 BEADLO C[C@@H](NC(=O)C=C1CCCCC1)c1[nH]cc[nH+]1 ZINC000820268655 587039130 /nfs/dbraw/zinc/03/91/30/587039130.db2.gz VFSVVDPFNKTXAP-SNVBAGLBSA-N 1 2 233.315 2.477 20 0 BEADLO CC[C@@H](C)CONC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000820279682 587040630 /nfs/dbraw/zinc/04/06/30/587040630.db2.gz QHLNQEWWPFVQSM-SECBINFHSA-N 1 2 247.298 2.270 20 0 BEADLO CC(C)C1(NC(=O)c2cc3c[nH+]ccc3[nH]2)CC1 ZINC000820638044 587060534 /nfs/dbraw/zinc/06/05/34/587060534.db2.gz UTAVBOGQLYXDSP-UHFFFAOYSA-N 1 2 243.310 2.481 20 0 BEADLO Cc1cnc(N2CC[C@@H](C)[C@@H](n3cc[nH+]c3)C2)o1 ZINC000820676555 587065984 /nfs/dbraw/zinc/06/59/84/587065984.db2.gz QAYNSVXGIXXLFZ-PWSUYJOCSA-N 1 2 246.314 2.267 20 0 BEADLO CC[C@H](C)C(=O)OCCc1cn2ccccc2[nH+]1 ZINC000821594194 587131690 /nfs/dbraw/zinc/13/16/90/587131690.db2.gz CGEDLLFLJKYPTO-NSHDSACASA-N 1 2 246.310 2.466 20 0 BEADLO CC[C@H](C)C(=O)OCc1ccc[nH+]c1N(C)C ZINC000821608252 587132374 /nfs/dbraw/zinc/13/23/74/587132374.db2.gz ZFVZLXBGRWBASP-JTQLQIEISA-N 1 2 236.315 2.237 20 0 BEADLO Cc1cccc(F)c1NC(=O)C[NH+]1CCCC1 ZINC000821734791 587136145 /nfs/dbraw/zinc/13/61/45/587136145.db2.gz YJAHRSKMTOKVGA-UHFFFAOYSA-N 1 2 236.290 2.168 20 0 BEADLO C[C@@H]1C[C@@H](NC(=O)[C@]23C[C@H]2CCC3)c2[nH+]ccn21 ZINC000821787546 587137977 /nfs/dbraw/zinc/13/79/77/587137977.db2.gz VJDUMCKKPJUSPI-ZHSDAYTOSA-N 1 2 245.326 2.195 20 0 BEADLO C[C@H]1C[C@@H](NC(=O)[C@]23C[C@H]2CCC3)c2[nH+]ccn21 ZINC000821787544 587138063 /nfs/dbraw/zinc/13/80/63/587138063.db2.gz VJDUMCKKPJUSPI-ICUOPCATSA-N 1 2 245.326 2.195 20 0 BEADLO CCC[C@H](CC)C(=O)N[C@H]1CCn2cc[nH+]c2C1 ZINC000822131800 587155464 /nfs/dbraw/zinc/15/54/64/587155464.db2.gz FBUPQFODRMCYPR-RYUDHWBXSA-N 1 2 249.358 2.140 20 0 BEADLO C[C@H]1C[NH+]=C(NC(=O)CCC2(C)CC2)S1 ZINC000823307883 587215472 /nfs/dbraw/zinc/21/54/72/587215472.db2.gz XTMLRGSIGONMFX-QMMMGPOBSA-N 1 2 226.345 2.174 20 0 BEADLO C[N@H+](Cc1ccnc(Cl)c1F)[C@@H]1CCOC1 ZINC000823436844 587221618 /nfs/dbraw/zinc/22/16/18/587221618.db2.gz DGUZVOVTRRQBSD-SECBINFHSA-N 1 2 244.697 2.095 20 0 BEADLO C[N@@H+](Cc1ccnc(Cl)c1F)[C@@H]1CCOC1 ZINC000823436844 587221619 /nfs/dbraw/zinc/22/16/19/587221619.db2.gz DGUZVOVTRRQBSD-SECBINFHSA-N 1 2 244.697 2.095 20 0 BEADLO C[C@@H]1CCC[N@H+](CCF)[C@H]1C(=O)OC(C)(C)C ZINC000823509651 587228659 /nfs/dbraw/zinc/22/86/59/587228659.db2.gz PTDOZFWQFSTHBB-GHMZBOCLSA-N 1 2 245.338 2.398 20 0 BEADLO C[C@@H]1CCC[N@@H+](CCF)[C@H]1C(=O)OC(C)(C)C ZINC000823509651 587228660 /nfs/dbraw/zinc/22/86/60/587228660.db2.gz PTDOZFWQFSTHBB-GHMZBOCLSA-N 1 2 245.338 2.398 20 0 BEADLO CCn1nc(C)c(C[NH2+][C@H](C)c2ccco2)n1 ZINC000823596918 587232457 /nfs/dbraw/zinc/23/24/57/587232457.db2.gz YQWGSCNESBLSCJ-SNVBAGLBSA-N 1 2 234.303 2.050 20 0 BEADLO CC(C)=C(C)CC(=O)NC1=[NH+]C[C@H](C)S1 ZINC000823807054 587240401 /nfs/dbraw/zinc/24/04/01/587240401.db2.gz PLFVPAMQOIMDHS-VIFPVBQESA-N 1 2 226.345 2.340 20 0 BEADLO CCC[C@@H](CC)C(=O)NC1=[NH+]C[C@@H](C)S1 ZINC000823806767 587241106 /nfs/dbraw/zinc/24/11/06/587241106.db2.gz IIDPQYSQDMHHLH-RKDXNWHRSA-N 1 2 228.361 2.420 20 0 BEADLO CCOCC[N@H+](C)Cc1ccnc(Cl)c1F ZINC000824125371 587257159 /nfs/dbraw/zinc/25/71/59/587257159.db2.gz KRIHNWJXSOIQMJ-UHFFFAOYSA-N 1 2 246.713 2.342 20 0 BEADLO CCOCC[N@@H+](C)Cc1ccnc(Cl)c1F ZINC000824125371 587257160 /nfs/dbraw/zinc/25/71/60/587257160.db2.gz KRIHNWJXSOIQMJ-UHFFFAOYSA-N 1 2 246.713 2.342 20 0 BEADLO O=C(c1cc2c[nH+]ccc2[nH]1)N1CCC[C@@H](F)C1 ZINC000824145614 587257995 /nfs/dbraw/zinc/25/79/95/587257995.db2.gz IYAPEOUTYONBPC-SNVBAGLBSA-N 1 2 247.273 2.137 20 0 BEADLO O=C(c1cc2c[nH+]ccc2[nH]1)N1CCC[C@H](F)C1 ZINC000824145612 587258109 /nfs/dbraw/zinc/25/81/09/587258109.db2.gz IYAPEOUTYONBPC-JTQLQIEISA-N 1 2 247.273 2.137 20 0 BEADLO CCC[C@@H](CC)C(=O)N[C@H](C)c1[nH+]ccn1C ZINC000824625726 587279997 /nfs/dbraw/zinc/27/99/97/587279997.db2.gz JLYVZZUWVMKWEU-GHMZBOCLSA-N 1 2 237.347 2.424 20 0 BEADLO CC[C@H](NC(=O)Cc1[nH]cc[nH+]1)C1CCCCC1 ZINC000825240737 587310857 /nfs/dbraw/zinc/31/08/57/587310857.db2.gz IZZPYDCATWFWIT-LBPRGKRZSA-N 1 2 249.358 2.427 20 0 BEADLO CCC[C@H]1CCCC[C@@H]1NC(=O)Cc1[nH]cc[nH+]1 ZINC000825928117 587345804 /nfs/dbraw/zinc/34/58/04/587345804.db2.gz MUQDBYIKUWZOGB-RYUDHWBXSA-N 1 2 249.358 2.427 20 0 BEADLO CCCONC(=O)Nc1ccn2cc(C)[nH+]c2c1 ZINC000825928509 587345885 /nfs/dbraw/zinc/34/58/85/587345885.db2.gz XQKRMYDLEHJNJO-UHFFFAOYSA-N 1 2 248.286 2.106 20 0 BEADLO C[N@@H+]1Cc2ccccc2[C@H]1CNC(=O)C(C)(C)C ZINC000826731311 587360383 /nfs/dbraw/zinc/36/03/83/587360383.db2.gz USONTAPZLSEBNG-CYBMUJFWSA-N 1 2 246.354 2.335 20 0 BEADLO C[N@H+]1Cc2ccccc2[C@H]1CNC(=O)C(C)(C)C ZINC000826731311 587360384 /nfs/dbraw/zinc/36/03/84/587360384.db2.gz USONTAPZLSEBNG-CYBMUJFWSA-N 1 2 246.354 2.335 20 0 BEADLO CC(C)(NC(=O)Cc1[nH]cc[nH+]1)c1cccs1 ZINC000828035105 587417015 /nfs/dbraw/zinc/41/70/15/587417015.db2.gz AOVWTVRQWXPCLQ-UHFFFAOYSA-N 1 2 249.339 2.065 20 0 BEADLO C[C@@H](CCC(C)(C)C)NC(=O)Cc1[nH]cc[nH+]1 ZINC000828224952 587425590 /nfs/dbraw/zinc/42/55/90/587425590.db2.gz OSWYOJCLXHTVQR-JTQLQIEISA-N 1 2 237.347 2.283 20 0 BEADLO CC[C@@H](C)[C@H]1CCCCN1C(=O)Cc1[nH]cc[nH+]1 ZINC000828276428 587430711 /nfs/dbraw/zinc/43/07/11/587430711.db2.gz KLVRWFZPNQUCHD-VXGBXAGGSA-N 1 2 249.358 2.379 20 0 BEADLO OC1(c2ccc(F)cc2)C[NH+](CC2=CCCC2)C1 ZINC000828306246 587433467 /nfs/dbraw/zinc/43/34/67/587433467.db2.gz BYZMVPCKUFLZNB-UHFFFAOYSA-N 1 2 247.313 2.439 20 0 BEADLO Cc1nc(N[C@@H]2CCn3ccnc32)c(C)c(C)[nH+]1 ZINC000828358421 587438032 /nfs/dbraw/zinc/43/80/32/587438032.db2.gz QRSAGOYFMZSZJM-LLVKDONJSA-N 1 2 243.314 2.155 20 0 BEADLO C[C@@]1([NH2+]C[C@@H]2CCCCC2(F)F)CCOC1=O ZINC000829962839 587530284 /nfs/dbraw/zinc/53/02/84/587530284.db2.gz UULAUIQTRRHCOX-GXSJLCMTSA-N 1 2 247.285 2.107 20 0 BEADLO CCOc1ncc(C)cc1NCc1cn(C)c[nH+]1 ZINC000830436136 587551400 /nfs/dbraw/zinc/55/14/00/587551400.db2.gz YMMIGJXZWVGIKI-UHFFFAOYSA-N 1 2 246.314 2.134 20 0 BEADLO O[C@H](C[N@@H+]1CC[C@@H](F)C1)c1ccc(F)c(F)c1 ZINC000830467362 587552261 /nfs/dbraw/zinc/55/22/61/587552261.db2.gz KIAQXVVULFAHQW-BXKDBHETSA-N 1 2 245.244 2.042 20 0 BEADLO O[C@H](C[N@H+]1CC[C@@H](F)C1)c1ccc(F)c(F)c1 ZINC000830467362 587552262 /nfs/dbraw/zinc/55/22/62/587552262.db2.gz KIAQXVVULFAHQW-BXKDBHETSA-N 1 2 245.244 2.042 20 0 BEADLO O[C@@H](C[N@@H+]1CC[C@H](F)C1)c1ccc(F)cc1F ZINC000830467359 587552266 /nfs/dbraw/zinc/55/22/66/587552266.db2.gz KIAQOQBXKPKIQV-CABZTGNLSA-N 1 2 245.244 2.042 20 0 BEADLO O[C@@H](C[N@H+]1CC[C@H](F)C1)c1ccc(F)cc1F ZINC000830467359 587552267 /nfs/dbraw/zinc/55/22/67/587552267.db2.gz KIAQOQBXKPKIQV-CABZTGNLSA-N 1 2 245.244 2.042 20 0 BEADLO O[C@H](C[N@@H+]1CC[C@H](F)C1)c1cccc(Cl)c1 ZINC000830467839 587552518 /nfs/dbraw/zinc/55/25/18/587552518.db2.gz SHTUMZGBYXOFPC-NWDGAFQWSA-N 1 2 243.709 2.417 20 0 BEADLO O[C@H](C[N@H+]1CC[C@H](F)C1)c1cccc(Cl)c1 ZINC000830467839 587552519 /nfs/dbraw/zinc/55/25/19/587552519.db2.gz SHTUMZGBYXOFPC-NWDGAFQWSA-N 1 2 243.709 2.417 20 0 BEADLO O[C@H](C[N@@H+]1CC[C@@H](F)C1)c1cccc(Cl)c1 ZINC000830467842 587552567 /nfs/dbraw/zinc/55/25/67/587552567.db2.gz SHTUMZGBYXOFPC-VXGBXAGGSA-N 1 2 243.709 2.417 20 0 BEADLO O[C@H](C[N@H+]1CC[C@@H](F)C1)c1cccc(Cl)c1 ZINC000830467842 587552569 /nfs/dbraw/zinc/55/25/69/587552569.db2.gz SHTUMZGBYXOFPC-VXGBXAGGSA-N 1 2 243.709 2.417 20 0 BEADLO CCCCOC(=O)C[N@H+](CC)CCSC ZINC000830993732 587580472 /nfs/dbraw/zinc/58/04/72/587580472.db2.gz BBUNHQQGSGPFEB-UHFFFAOYSA-N 1 2 233.377 2.015 20 0 BEADLO CCCCOC(=O)C[N@@H+](CC)CCSC ZINC000830993732 587580474 /nfs/dbraw/zinc/58/04/74/587580474.db2.gz BBUNHQQGSGPFEB-UHFFFAOYSA-N 1 2 233.377 2.015 20 0 BEADLO CC[N@H+](CCSC)Cc1ncc(Cl)n1C ZINC000830994910 587581115 /nfs/dbraw/zinc/58/11/15/587581115.db2.gz ZTGCBCFLVHHALS-UHFFFAOYSA-N 1 2 247.795 2.258 20 0 BEADLO CC[N@@H+](CCSC)Cc1ncc(Cl)n1C ZINC000830994910 587581117 /nfs/dbraw/zinc/58/11/17/587581117.db2.gz ZTGCBCFLVHHALS-UHFFFAOYSA-N 1 2 247.795 2.258 20 0 BEADLO Cc1cn2c([nH+]1)CN(C(=O)OC1CCCC1)CC2 ZINC000831076138 587585414 /nfs/dbraw/zinc/58/54/14/587585414.db2.gz ZBYYXHIRUGAWDP-UHFFFAOYSA-N 1 2 249.314 2.086 20 0 BEADLO C[C@@H](O)C[N@H+](CCc1cccs1)CC(F)F ZINC000832196380 587649674 /nfs/dbraw/zinc/64/96/74/587649674.db2.gz UEWUZKOTHNNEMZ-SECBINFHSA-N 1 2 249.326 2.239 20 0 BEADLO C[C@@H](O)C[N@@H+](CCc1cccs1)CC(F)F ZINC000832196380 587649675 /nfs/dbraw/zinc/64/96/75/587649675.db2.gz UEWUZKOTHNNEMZ-SECBINFHSA-N 1 2 249.326 2.239 20 0 BEADLO CCCC[C@](C)(F)C(=O)NC1C[NH+](C(C)C)C1 ZINC000832486665 587663338 /nfs/dbraw/zinc/66/33/38/587663338.db2.gz XYAIIBQQZVRQAS-ZDUSSCGKSA-N 1 2 244.354 2.114 20 0 BEADLO CC1(CC(=O)N[C@@H]2CCn3cc[nH+]c32)CCCC1 ZINC000833272541 587703820 /nfs/dbraw/zinc/70/38/20/587703820.db2.gz PHWGITZVDLRWMI-LLVKDONJSA-N 1 2 247.342 2.415 20 0 BEADLO O=C(C[C@H]1C=CCCC1)N[C@H]1CCn2cc[nH+]c21 ZINC000833279435 587703861 /nfs/dbraw/zinc/70/38/61/587703861.db2.gz ZYWLENBUJVOHBM-RYUDHWBXSA-N 1 2 245.326 2.191 20 0 BEADLO CC(C)(C(=O)N[C@@H]1CCn2cc[nH+]c21)C1CCC1 ZINC000833272611 587703989 /nfs/dbraw/zinc/70/39/89/587703989.db2.gz QHYAKNXSWIESMI-LLVKDONJSA-N 1 2 247.342 2.270 20 0 BEADLO CC(C)[C@]1(C)C[C@@H]1C(=O)N[C@H]1CCn2cc[nH+]c21 ZINC000833278224 587704127 /nfs/dbraw/zinc/70/41/27/587704127.db2.gz PNQPSBMEQCZAAL-SUNKGSAMSA-N 1 2 247.342 2.126 20 0 BEADLO CCC1(C(=O)N[C@@H]2CCn3cc[nH+]c32)CCC1 ZINC000833283174 587704425 /nfs/dbraw/zinc/70/44/25/587704425.db2.gz AMUVUYXDIMWDAM-SNVBAGLBSA-N 1 2 233.315 2.024 20 0 BEADLO Cc1cscc1C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833284323 587704662 /nfs/dbraw/zinc/70/46/62/587704662.db2.gz HVSBPCMXOIZXKD-SNVBAGLBSA-N 1 2 247.323 2.128 20 0 BEADLO C[C@@H]1CC/C(=C/C(=O)N[C@@H]2CCn3cc[nH+]c32)C1 ZINC000833283321 587704670 /nfs/dbraw/zinc/70/46/70/587704670.db2.gz BGOFWBCFCXZKEZ-UPZHYSAYSA-N 1 2 245.326 2.191 20 0 BEADLO CCC/C(C)=C\C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833285312 587704701 /nfs/dbraw/zinc/70/47/01/587704701.db2.gz QHJDBHJZOADGLR-DWOQACPDSA-N 1 2 233.315 2.191 20 0 BEADLO Cc1ccccc1C(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833305395 587705058 /nfs/dbraw/zinc/70/50/58/587705058.db2.gz OEJKLPVXRRQJCS-GFCCVEGCSA-N 1 2 241.294 2.066 20 0 BEADLO CCC[C@@H](C)CC(=O)N[C@@H]1CCn2cc[nH+]c21 ZINC000833293367 587705497 /nfs/dbraw/zinc/70/54/97/587705497.db2.gz XIJZAFQQPBMWEC-GHMZBOCLSA-N 1 2 235.331 2.270 20 0 BEADLO O=C(CC1CCCCC1)N[C@H]1CCn2cc[nH+]c21 ZINC000833311634 587705501 /nfs/dbraw/zinc/70/55/01/587705501.db2.gz ZMLKOMGRIPEJLV-LBPRGKRZSA-N 1 2 247.342 2.415 20 0 BEADLO CC(C)[C@@H](C)[NH2+]c1ccc(O[C@H]2CC(=O)N2)cc1 ZINC000834892707 587769515 /nfs/dbraw/zinc/76/95/15/587769515.db2.gz CVSFRLJGAZLBML-YGRLFVJLSA-N 1 2 248.326 2.368 20 0 BEADLO CC[C@H]1CCC[C@H]1C(=O)OCc1c[nH+]cn1C ZINC000835193768 587788406 /nfs/dbraw/zinc/78/84/06/587788406.db2.gz NWARAAUACHEFHF-CMPLNLGQSA-N 1 2 236.315 2.290 20 0 BEADLO C[C@H]1CCC[C@@]1(C)C(=O)OCc1c[nH+]cn1C ZINC000835195738 587788583 /nfs/dbraw/zinc/78/85/83/587788583.db2.gz ZWNMYYTYHGHQRI-GXFFZTMASA-N 1 2 236.315 2.290 20 0 BEADLO C[C@H]1CCC[C@]1(C)C(=O)OCCn1cc[nH+]c1 ZINC000835349758 587797968 /nfs/dbraw/zinc/79/79/68/587797968.db2.gz KATXXTSQMNFGBC-AAEUAGOBSA-N 1 2 236.315 2.253 20 0 BEADLO C[C@]1(C(=O)OCCn2cc[nH+]c2)CC=CCC1 ZINC000835350078 587798051 /nfs/dbraw/zinc/79/80/51/587798051.db2.gz MKBFVFXJEKXDKY-ZDUSSCGKSA-N 1 2 234.299 2.173 20 0 BEADLO CC[N@@H+]1CCCC[C@@H]1C(=O)OC[C@@H](C)SC ZINC000835684079 587812609 /nfs/dbraw/zinc/81/26/09/587812609.db2.gz CZISQKRQHFRATN-GHMZBOCLSA-N 1 2 245.388 2.156 20 0 BEADLO CC[N@H+]1CCCC[C@@H]1C(=O)OC[C@@H](C)SC ZINC000835684079 587812610 /nfs/dbraw/zinc/81/26/10/587812610.db2.gz CZISQKRQHFRATN-GHMZBOCLSA-N 1 2 245.388 2.156 20 0 BEADLO C/C(=C/C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21)C1CC1 ZINC000836952609 587843429 /nfs/dbraw/zinc/84/34/29/587843429.db2.gz BUYPOFUFZMCPPD-POGDZBNZSA-N 1 2 245.326 2.361 20 0 BEADLO CC/C=C(/C)C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000836953680 587843817 /nfs/dbraw/zinc/84/38/17/587843817.db2.gz GWXGOBMAVZWVIE-XFDQCWFDSA-N 1 2 233.315 2.361 20 0 BEADLO Cc1cc(C)c(CNC(=O)C2=COCCC2)c[nH+]1 ZINC000837102963 587854004 /nfs/dbraw/zinc/85/40/04/587854004.db2.gz FKYMRYPNXQOCJH-UHFFFAOYSA-N 1 2 246.310 2.009 20 0 BEADLO C/C=C(\C)C(=O)NCc1c[nH+]c(C)cc1C ZINC000837106162 587854144 /nfs/dbraw/zinc/85/41/44/587854144.db2.gz WUVNGEVRHYYNDR-WEVVVXLNSA-N 1 2 218.300 2.281 20 0 BEADLO C/C(=C\C(=O)NCCc1cn(C)c[nH+]1)C(C)(C)C ZINC000837715102 587892181 /nfs/dbraw/zinc/89/21/81/587892181.db2.gz BGODHOPOQNZBGK-DHZHZOJOSA-N 1 2 249.358 2.071 20 0 BEADLO COc1ccc([NH2+]C[C@@H]2C[C@@H]2C)cc1N ZINC000841040388 587938350 /nfs/dbraw/zinc/93/83/50/587938350.db2.gz LPTVVUMIZXIFIA-IUCAKERBSA-N 1 2 206.289 2.345 20 0 BEADLO COc1ccc([NH2+]C[C@H]2C[C@@H]2C)cc1N ZINC000841040387 587938365 /nfs/dbraw/zinc/93/83/65/587938365.db2.gz LPTVVUMIZXIFIA-DTWKUNHWSA-N 1 2 206.289 2.345 20 0 BEADLO CC(C)C[C@@H](C)O[NH+]=C(N)[C@@H]1CCCO1 ZINC000842047836 587992960 /nfs/dbraw/zinc/99/29/60/587992960.db2.gz UWSOBOXCKVMWLK-ZJUUUORDSA-N 1 2 214.309 2.098 20 0 BEADLO O=C(N[C@H]1CCn2cc[nH+]c21)OC1CCCCC1 ZINC000867317195 588075691 /nfs/dbraw/zinc/07/56/91/588075691.db2.gz KQKAGVVJMXRNLU-NSHDSACASA-N 1 2 249.314 2.387 20 0 BEADLO CC[NH2+]Cc1noc(/C=C\c2cncc(C)c2)n1 ZINC000843144432 588086249 /nfs/dbraw/zinc/08/62/49/588086249.db2.gz BZCSQHCYUDEUPM-PLNGDYQASA-N 1 2 244.298 2.053 20 0 BEADLO CC1(C[N@@H+]2CCc3cc(Cl)nnc3C2)CC1 ZINC000843415043 588107219 /nfs/dbraw/zinc/10/72/19/588107219.db2.gz AQJOWRCOJHMQHA-UHFFFAOYSA-N 1 2 237.734 2.288 20 0 BEADLO CC1(C[N@H+]2CCc3cc(Cl)nnc3C2)CC1 ZINC000843415043 588107221 /nfs/dbraw/zinc/10/72/21/588107221.db2.gz AQJOWRCOJHMQHA-UHFFFAOYSA-N 1 2 237.734 2.288 20 0 BEADLO CC1=C(C)C[C@H](C(=O)NC2=[NH+]CCS2)CC1 ZINC000843525161 588119664 /nfs/dbraw/zinc/11/96/64/588119664.db2.gz OGPVRXNLVHMZEC-SNVBAGLBSA-N 1 2 238.356 2.342 20 0 BEADLO CC1=C(C)C[C@@H](C(=O)NC2=[NH+]CCS2)CC1 ZINC000843525159 588119797 /nfs/dbraw/zinc/11/97/97/588119797.db2.gz OGPVRXNLVHMZEC-JTQLQIEISA-N 1 2 238.356 2.342 20 0 BEADLO CC[C@@H]1C[N@H+](C/C=C/Cl)[C@@H](C)CO1 ZINC000844390471 588188788 /nfs/dbraw/zinc/18/87/88/588188788.db2.gz XOZPSIWHBRHXFT-OCIBVNFRSA-N 1 2 203.713 2.238 20 0 BEADLO CC[C@@H]1C[N@@H+](C/C=C/Cl)[C@@H](C)CO1 ZINC000844390471 588188789 /nfs/dbraw/zinc/18/87/89/588188789.db2.gz XOZPSIWHBRHXFT-OCIBVNFRSA-N 1 2 203.713 2.238 20 0 BEADLO CC[C@H]1C[N@H+](Cc2nccc(C)n2)[C@@H](CC)CO1 ZINC000844387382 588189052 /nfs/dbraw/zinc/18/90/52/588189052.db2.gz QWQAWEWEEROSFU-STQMWFEESA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@H]1C[N@@H+](Cc2nccc(C)n2)[C@@H](CC)CO1 ZINC000844387382 588189053 /nfs/dbraw/zinc/18/90/53/588189053.db2.gz QWQAWEWEEROSFU-STQMWFEESA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nccc(C)n2)[C@@H](CC)CO1 ZINC000844387381 588189194 /nfs/dbraw/zinc/18/91/94/588189194.db2.gz QWQAWEWEEROSFU-QWHCGFSZSA-N 1 2 249.358 2.174 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nccc(C)n2)[C@@H](CC)CO1 ZINC000844387381 588189195 /nfs/dbraw/zinc/18/91/95/588189195.db2.gz QWQAWEWEEROSFU-QWHCGFSZSA-N 1 2 249.358 2.174 20 0 BEADLO Cc1oncc1C[N@H+]1C[C@H](C)OCC12CCC2 ZINC000844421764 588191610 /nfs/dbraw/zinc/19/16/10/588191610.db2.gz JYOZLNIYJTZQLI-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO Cc1oncc1C[N@@H+]1C[C@H](C)OCC12CCC2 ZINC000844421764 588191611 /nfs/dbraw/zinc/19/16/11/588191611.db2.gz JYOZLNIYJTZQLI-JTQLQIEISA-N 1 2 236.315 2.126 20 0 BEADLO FC1(F)C[C@]12CCC[N@H+](Cc1csnn1)C2 ZINC000844439849 588193944 /nfs/dbraw/zinc/19/39/44/588193944.db2.gz AFENPIGRKNNPGP-VIFPVBQESA-N 1 2 245.298 2.159 20 0 BEADLO FC1(F)C[C@]12CCC[N@@H+](Cc1csnn1)C2 ZINC000844439849 588193945 /nfs/dbraw/zinc/19/39/45/588193945.db2.gz AFENPIGRKNNPGP-VIFPVBQESA-N 1 2 245.298 2.159 20 0 BEADLO FC1(F)[C@H]2C[N@H+](Cc3cn4ccccc4n3)C[C@H]21 ZINC000844453508 588195994 /nfs/dbraw/zinc/19/59/94/588195994.db2.gz PXEKQIYRMHKPEB-PHIMTYICSA-N 1 2 249.264 2.031 20 0 BEADLO FC1(F)[C@H]2C[N@@H+](Cc3cn4ccccc4n3)C[C@H]21 ZINC000844453508 588195996 /nfs/dbraw/zinc/19/59/96/588195996.db2.gz PXEKQIYRMHKPEB-PHIMTYICSA-N 1 2 249.264 2.031 20 0 BEADLO CCc1cc[nH+]cc1NCc1cc(C)nn1C ZINC000844707659 588214939 /nfs/dbraw/zinc/21/49/39/588214939.db2.gz GCXMWNTUHICCTD-UHFFFAOYSA-N 1 2 230.315 2.298 20 0 BEADLO CC[NH2+]Cc1noc([C@H]2C[C@@H]2C2CCCC2)n1 ZINC000844906065 588218840 /nfs/dbraw/zinc/21/88/40/588218840.db2.gz JJUNAGRWSZNIAG-MNOVXSKESA-N 1 2 235.331 2.473 20 0 BEADLO CCSCCOC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000845280332 588225420 /nfs/dbraw/zinc/22/54/20/588225420.db2.gz AJJCJWRNZBTKLA-JTQLQIEISA-N 1 2 242.344 2.131 20 0 BEADLO CC[C@H](C)COC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000845281468 588225506 /nfs/dbraw/zinc/22/55/06/588225506.db2.gz HXIKEPQHGLXVGZ-WDEREUQCSA-N 1 2 224.304 2.424 20 0 BEADLO C[C@@H](CC(=O)O[C@@H]1C=CCCC1)n1cc[nH+]c1 ZINC000845282336 588225539 /nfs/dbraw/zinc/22/55/39/588225539.db2.gz NZHIKTJMVSFOIK-NWDGAFQWSA-N 1 2 234.299 2.486 20 0 BEADLO C[C@@H](CC(=O)O[C@H]1C=CCCC1)n1cc[nH+]c1 ZINC000845282338 588225591 /nfs/dbraw/zinc/22/55/91/588225591.db2.gz NZHIKTJMVSFOIK-RYUDHWBXSA-N 1 2 234.299 2.486 20 0 BEADLO C[C@@H](CC(=O)OCC1=CCCC1)n1cc[nH+]c1 ZINC000845284711 588225717 /nfs/dbraw/zinc/22/57/17/588225717.db2.gz DJRGZFWGFFHEGI-NSHDSACASA-N 1 2 234.299 2.488 20 0 BEADLO CC[C@@H](C)OC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000845283409 588225751 /nfs/dbraw/zinc/22/57/51/588225751.db2.gz WPUTVJHHTIAWQK-NXEZZACHSA-N 1 2 210.277 2.176 20 0 BEADLO CC(C)=CCOC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000845285778 588225757 /nfs/dbraw/zinc/22/57/57/588225757.db2.gz SVSKDFOPCWLXAS-LLVKDONJSA-N 1 2 222.288 2.344 20 0 BEADLO CC(C)[C@@H](C)OC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000845497127 588230862 /nfs/dbraw/zinc/23/08/62/588230862.db2.gz YMXIZAVFTMYKEM-WDEREUQCSA-N 1 2 224.304 2.422 20 0 BEADLO C[C@H](CC(=O)O[C@H]1C=CCC1)n1cc[nH+]c1 ZINC000845508464 588231459 /nfs/dbraw/zinc/23/14/59/588231459.db2.gz HIOKWFMDQRFIBK-MNOVXSKESA-N 1 2 220.272 2.096 20 0 BEADLO C[C@@H](OC(=O)C[C@H](C)n1cc[nH+]c1)C(F)F ZINC000845526807 588232180 /nfs/dbraw/zinc/23/21/80/588232180.db2.gz MAYUOCOOTABYSK-JGVFFNPUSA-N 1 2 232.230 2.031 20 0 BEADLO C[C@@H](COC(=O)C[C@H](C)n1cc[nH+]c1)C1CC1 ZINC000845546608 588233066 /nfs/dbraw/zinc/23/30/66/588233066.db2.gz WMONMDLUADYNQE-QWRGUYRKSA-N 1 2 236.315 2.424 20 0 BEADLO Cc1ccc(COC(=O)C[C@H](C)n2cc[nH+]c2)o1 ZINC000845581192 588233765 /nfs/dbraw/zinc/23/37/65/588233765.db2.gz FXVGXBMGBYKVPA-JTQLQIEISA-N 1 2 248.282 2.479 20 0 BEADLO C/C=C(/C)COC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000845612270 588236076 /nfs/dbraw/zinc/23/60/76/588236076.db2.gz KMKTYDKIRKUTKU-NEOSZVFXSA-N 1 2 222.288 2.344 20 0 BEADLO CC(C)c1nc(N2C[C@H]3[C@@H](C2)C3(F)F)cc[nH+]1 ZINC000845751780 588243736 /nfs/dbraw/zinc/24/37/36/588243736.db2.gz CXPPOVIOMWLNKU-DTORHVGOSA-N 1 2 239.269 2.301 20 0 BEADLO FC1(F)CCC[N@H+](C[C@H]2CCC=CO2)C1 ZINC000846012828 588253569 /nfs/dbraw/zinc/25/35/69/588253569.db2.gz DYLAOJMBTWZGGO-SNVBAGLBSA-N 1 2 217.259 2.410 20 0 BEADLO FC1(F)CCC[N@@H+](C[C@H]2CCC=CO2)C1 ZINC000846012828 588253570 /nfs/dbraw/zinc/25/35/70/588253570.db2.gz DYLAOJMBTWZGGO-SNVBAGLBSA-N 1 2 217.259 2.410 20 0 BEADLO CCONC(=O)C[NH2+][C@@H](C)CCC1CCCC1 ZINC000846090511 588256426 /nfs/dbraw/zinc/25/64/26/588256426.db2.gz BPGWBGBRZUOGSA-NSHDSACASA-N 1 2 242.363 2.003 20 0 BEADLO CC/C=C(\C)C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000846245426 588262674 /nfs/dbraw/zinc/26/26/74/588262674.db2.gz GKESUUVVXKNFOY-RMKNXTFCSA-N 1 2 221.304 2.117 20 0 BEADLO CCC/C=C\C(=O)NC(C)(C)c1[nH]cc[nH+]1 ZINC000846245255 588262712 /nfs/dbraw/zinc/26/27/12/588262712.db2.gz ZLZQEMXZJNKFEQ-SREVYHEPSA-N 1 2 221.304 2.117 20 0 BEADLO C[C@@H]1Cc2cc(NCc3[nH+]ccn3C)ccc2O1 ZINC000846747184 588284452 /nfs/dbraw/zinc/28/44/52/588284452.db2.gz BMLJEDQSDYAZSZ-SNVBAGLBSA-N 1 2 243.310 2.356 20 0 BEADLO Fc1cc(C[NH+]2CCCC2)cnc1Cl ZINC000846768573 588286929 /nfs/dbraw/zinc/28/69/29/588286929.db2.gz OEMFAAOVMWYPGM-UHFFFAOYSA-N 1 2 214.671 2.470 20 0 BEADLO CCCC[N@H+](Cc1cnsn1)C1CC1 ZINC000846772586 588287415 /nfs/dbraw/zinc/28/74/15/588287415.db2.gz SMLSHQBJSVPKMV-UHFFFAOYSA-N 1 2 211.334 2.303 20 0 BEADLO CCCC[N@@H+](Cc1cnsn1)C1CC1 ZINC000846772586 588287416 /nfs/dbraw/zinc/28/74/16/588287416.db2.gz SMLSHQBJSVPKMV-UHFFFAOYSA-N 1 2 211.334 2.303 20 0 BEADLO C[C@@H]1CCC[N@H+](Cc2cnsn2)CC1 ZINC000846781267 588287869 /nfs/dbraw/zinc/28/78/69/588287869.db2.gz HFTBJRASJMUKPH-SECBINFHSA-N 1 2 211.334 2.160 20 0 BEADLO C[C@@H]1CCC[N@@H+](Cc2cnsn2)CC1 ZINC000846781267 588287870 /nfs/dbraw/zinc/28/78/70/588287870.db2.gz HFTBJRASJMUKPH-SECBINFHSA-N 1 2 211.334 2.160 20 0 BEADLO C[C@H]1CCC[N@H+](Cc2cnsn2)CC1 ZINC000846781268 588287876 /nfs/dbraw/zinc/28/78/76/588287876.db2.gz HFTBJRASJMUKPH-VIFPVBQESA-N 1 2 211.334 2.160 20 0 BEADLO C[C@H]1CCC[N@@H+](Cc2cnsn2)CC1 ZINC000846781268 588287877 /nfs/dbraw/zinc/28/78/77/588287877.db2.gz HFTBJRASJMUKPH-VIFPVBQESA-N 1 2 211.334 2.160 20 0 BEADLO c1nsnc1C[N@@H+]1CCC[C@H]2CCC[C@H]21 ZINC000846805763 588289740 /nfs/dbraw/zinc/28/97/40/588289740.db2.gz IGQFGLVYRYZGTC-MWLCHTKSSA-N 1 2 223.345 2.303 20 0 BEADLO c1nsnc1C[N@H+]1CCC[C@H]2CCC[C@H]21 ZINC000846805763 588289741 /nfs/dbraw/zinc/28/97/41/588289741.db2.gz IGQFGLVYRYZGTC-MWLCHTKSSA-N 1 2 223.345 2.303 20 0 BEADLO C[C@H]1CCC[C@H](C)[NH+]1Cc1cnsn1 ZINC000846804277 588289764 /nfs/dbraw/zinc/28/97/64/588289764.db2.gz YSBAFYNYTHPYKZ-IUCAKERBSA-N 1 2 211.334 2.301 20 0 BEADLO C[C@@H]1CC[C@H](C)[N@H+](Cc2cnsn2)C1 ZINC000846808116 588290175 /nfs/dbraw/zinc/29/01/75/588290175.db2.gz PZRGMVCSDNSQFD-BDAKNGLRSA-N 1 2 211.334 2.159 20 0 BEADLO C[C@@H]1CC[C@H](C)[N@@H+](Cc2cnsn2)C1 ZINC000846808116 588290176 /nfs/dbraw/zinc/29/01/76/588290176.db2.gz PZRGMVCSDNSQFD-BDAKNGLRSA-N 1 2 211.334 2.159 20 0 BEADLO CSCC[C@@H](C)[N@H+](C)Cc1cnsn1 ZINC000846825309 588291183 /nfs/dbraw/zinc/29/11/83/588291183.db2.gz JKPQSJGGLBSKSJ-MRVPVSSYSA-N 1 2 231.390 2.112 20 0 BEADLO CSCC[C@@H](C)[N@@H+](C)Cc1cnsn1 ZINC000846825309 588291184 /nfs/dbraw/zinc/29/11/84/588291184.db2.gz JKPQSJGGLBSKSJ-MRVPVSSYSA-N 1 2 231.390 2.112 20 0 BEADLO CSC[C@H]1CCC[N@H+](Cc2cnsn2)C1 ZINC000846918900 588296955 /nfs/dbraw/zinc/29/69/55/588296955.db2.gz NGIBUGHWGPHPOI-VIFPVBQESA-N 1 2 243.401 2.113 20 0 BEADLO CSC[C@H]1CCC[N@@H+](Cc2cnsn2)C1 ZINC000846918900 588296956 /nfs/dbraw/zinc/29/69/56/588296956.db2.gz NGIBUGHWGPHPOI-VIFPVBQESA-N 1 2 243.401 2.113 20 0 BEADLO COC[C@@H]1CC[N@@H+]1Cc1cnc(Cl)c(F)c1 ZINC000846926612 588297328 /nfs/dbraw/zinc/29/73/28/588297328.db2.gz XPYJKKUTEUSPNI-VIFPVBQESA-N 1 2 244.697 2.095 20 0 BEADLO COC[C@@H]1CC[N@H+]1Cc1cnc(Cl)c(F)c1 ZINC000846926612 588297329 /nfs/dbraw/zinc/29/73/29/588297329.db2.gz XPYJKKUTEUSPNI-VIFPVBQESA-N 1 2 244.697 2.095 20 0 BEADLO CC(=O)C1CC[NH+](Cc2ncc(C)s2)CC1 ZINC000846947477 588297964 /nfs/dbraw/zinc/29/79/64/588297964.db2.gz STZQSDQIDPFEPP-UHFFFAOYSA-N 1 2 238.356 2.253 20 0 BEADLO C[C@@H](NC(=O)C1(F)CCCCC1)c1[nH]cc[nH+]1 ZINC000848386940 588375634 /nfs/dbraw/zinc/37/56/34/588375634.db2.gz BJULDFTUNWQKAE-SECBINFHSA-N 1 2 239.294 2.259 20 0 BEADLO Fc1ncccc1C[NH2+][C@H]1CCCn2ccnc21 ZINC000848549973 588395906 /nfs/dbraw/zinc/39/59/06/588395906.db2.gz ZIFRAIMQBBYFEG-NSHDSACASA-N 1 2 246.289 2.042 20 0 BEADLO Fc1ncccc1C[NH2+][C@@H]1CCCn2ccnc21 ZINC000848549972 588396087 /nfs/dbraw/zinc/39/60/87/588396087.db2.gz ZIFRAIMQBBYFEG-LLVKDONJSA-N 1 2 246.289 2.042 20 0 BEADLO CCc1nc(C[NH2+][C@H](C)c2cncnc2C)co1 ZINC000848554516 588396631 /nfs/dbraw/zinc/39/66/31/588396631.db2.gz VTBGFIFERNJAHI-SECBINFHSA-N 1 2 246.314 2.186 20 0 BEADLO Cn1c(Cl)ncc1C[N@H+](C)Cc1ccco1 ZINC000848879971 588416058 /nfs/dbraw/zinc/41/60/58/588416058.db2.gz JOESJRMBCKJABL-UHFFFAOYSA-N 1 2 239.706 2.299 20 0 BEADLO Cn1c(Cl)ncc1C[N@@H+](C)Cc1ccco1 ZINC000848879971 588416060 /nfs/dbraw/zinc/41/60/60/588416060.db2.gz JOESJRMBCKJABL-UHFFFAOYSA-N 1 2 239.706 2.299 20 0 BEADLO CC1=CC[N@H+](Cc2cnc(Cl)n2C)CC1 ZINC000848886278 588416599 /nfs/dbraw/zinc/41/65/99/588416599.db2.gz CYWAMPGWYLFBPH-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO CC1=CC[N@@H+](Cc2cnc(Cl)n2C)CC1 ZINC000848886278 588416600 /nfs/dbraw/zinc/41/66/00/588416600.db2.gz CYWAMPGWYLFBPH-UHFFFAOYSA-N 1 2 225.723 2.226 20 0 BEADLO C[C@@H]1C[N@H+](Cc2cnc(Cl)n2C)CCS1 ZINC000848886827 588417184 /nfs/dbraw/zinc/41/71/84/588417184.db2.gz WWMURGNWCMQMOR-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO C[C@@H]1C[N@@H+](Cc2cnc(Cl)n2C)CCS1 ZINC000848886827 588417187 /nfs/dbraw/zinc/41/71/87/588417187.db2.gz WWMURGNWCMQMOR-MRVPVSSYSA-N 1 2 245.779 2.011 20 0 BEADLO Cn1c(C[NH+]2CC3(C2)CCCC3)cnc1Cl ZINC000848910896 588419369 /nfs/dbraw/zinc/41/93/69/588419369.db2.gz BNHFTKKONZFVAH-UHFFFAOYSA-N 1 2 239.750 2.450 20 0 BEADLO Nc1ccc(CCC(=O)OCCC2CCC2)c[nH+]1 ZINC000849747831 588492922 /nfs/dbraw/zinc/49/29/22/588492922.db2.gz WMXXTSDJGZTIIL-UHFFFAOYSA-N 1 2 248.326 2.330 20 0 BEADLO CC(C)[C@H](C)OC(=O)CCc1ccc(N)[nH+]c1 ZINC000849747397 588493099 /nfs/dbraw/zinc/49/30/99/588493099.db2.gz OJGSNJAXGOJTBF-JTQLQIEISA-N 1 2 236.315 2.184 20 0 BEADLO CCCC[C@@](C)(F)C(=O)OCCn1cc[nH+]c1 ZINC000849845614 588504390 /nfs/dbraw/zinc/50/43/90/588504390.db2.gz CZGSVXBUQAWXBM-GFCCVEGCSA-N 1 2 242.294 2.345 20 0 BEADLO Cc1cc(C[NH2+][C@H]2C[C@@H](C)n3ncnc32)c(C)o1 ZINC000850352418 588538119 /nfs/dbraw/zinc/53/81/19/588538119.db2.gz VMPRYBSKDVDDEN-PELKAZGASA-N 1 2 246.314 2.284 20 0 BEADLO Cc1cc(C[NH2+]CC(F)(F)C(C)(C)C)n(C)n1 ZINC000850410207 588544152 /nfs/dbraw/zinc/54/41/52/588544152.db2.gz PPNVUIJDFDFXBU-UHFFFAOYSA-N 1 2 245.317 2.500 20 0 BEADLO c1c[nH]c([C@@H]([NH2+][C@H]2C=CCC2)c2cccnc2)n1 ZINC000850510899 588555087 /nfs/dbraw/zinc/55/50/87/588555087.db2.gz XEZOMNMLGSRNMU-STQMWFEESA-N 1 2 240.310 2.202 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+][C@@H]1COC2(CCC2)C1 ZINC000850523907 588557009 /nfs/dbraw/zinc/55/70/09/588557009.db2.gz DQHYVDAYSGHCGX-KOLCDFICSA-N 1 2 235.331 2.080 20 0 BEADLO Cn1cc[nH+]c1CCCOC(=O)C1CC2(CC2)C1 ZINC000850969525 588580894 /nfs/dbraw/zinc/58/08/94/588580894.db2.gz CSIJVPDMCYQYGN-UHFFFAOYSA-N 1 2 248.326 2.086 20 0 BEADLO C[C@@H](CC(=O)OC[C@H]1C[C@H]2C[C@H]2C1)n1cc[nH+]c1 ZINC000851419173 588604353 /nfs/dbraw/zinc/60/43/53/588604353.db2.gz XYUXRBRMPYCRRT-ZDEQEGDKSA-N 1 2 248.326 2.424 20 0 BEADLO COc1ccc([C@@H](C)[N@H+](C)Cc2cnon2)cc1 ZINC000851712810 588615753 /nfs/dbraw/zinc/61/57/53/588615753.db2.gz UKIDBTXIJILGKL-SNVBAGLBSA-N 1 2 247.298 2.271 20 0 BEADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2cnon2)cc1 ZINC000851712810 588615754 /nfs/dbraw/zinc/61/57/54/588615754.db2.gz UKIDBTXIJILGKL-SNVBAGLBSA-N 1 2 247.298 2.271 20 0 BEADLO Cc1cc([C@H]2CCCN2Cc2cn(C)c[nH+]2)no1 ZINC000851715990 588616090 /nfs/dbraw/zinc/61/60/90/588616090.db2.gz GNGSTHXDJPINBX-CYBMUJFWSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1ccc(C[N@H+](C)Cc2cnon2)cc1 ZINC000851718672 588616777 /nfs/dbraw/zinc/61/67/77/588616777.db2.gz OKAJGWNPHCCLGS-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO Cc1ccc(C[N@@H+](C)Cc2cnon2)cc1 ZINC000851718672 588616778 /nfs/dbraw/zinc/61/67/78/588616778.db2.gz OKAJGWNPHCCLGS-UHFFFAOYSA-N 1 2 217.272 2.010 20 0 BEADLO C[C@H](c1cccs1)[N@H+](C)Cc1cnon1 ZINC000851727977 588618311 /nfs/dbraw/zinc/61/83/11/588618311.db2.gz CLVQPDGZNPOFPW-MRVPVSSYSA-N 1 2 223.301 2.324 20 0 BEADLO C[C@H](c1cccs1)[N@@H+](C)Cc1cnon1 ZINC000851727977 588618312 /nfs/dbraw/zinc/61/83/12/588618312.db2.gz CLVQPDGZNPOFPW-MRVPVSSYSA-N 1 2 223.301 2.324 20 0 BEADLO C[N@H+](CC=C(Cl)Cl)C[C@H]1CCCO1 ZINC000851730950 588619333 /nfs/dbraw/zinc/61/93/33/588619333.db2.gz VRDKEMZSRDGPPW-MRVPVSSYSA-N 1 2 224.131 2.416 20 0 BEADLO C[N@@H+](CC=C(Cl)Cl)C[C@H]1CCCO1 ZINC000851730950 588619334 /nfs/dbraw/zinc/61/93/34/588619334.db2.gz VRDKEMZSRDGPPW-MRVPVSSYSA-N 1 2 224.131 2.416 20 0 BEADLO COc1ccc(C[N@H+](C)Cc2cnon2)cc1C ZINC000851750944 588623318 /nfs/dbraw/zinc/62/33/18/588623318.db2.gz MHAYZXDUVRASSA-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO COc1ccc(C[N@@H+](C)Cc2cnon2)cc1C ZINC000851750944 588623319 /nfs/dbraw/zinc/62/33/19/588623319.db2.gz MHAYZXDUVRASSA-UHFFFAOYSA-N 1 2 247.298 2.019 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2cccc(F)n2)C[C@@H](C)O1 ZINC000851767632 588625153 /nfs/dbraw/zinc/62/51/53/588625153.db2.gz BMGMFSISEVADGI-ZYHUDNBSSA-N 1 2 238.306 2.220 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2cccc(F)n2)C[C@@H](C)O1 ZINC000851767632 588625154 /nfs/dbraw/zinc/62/51/54/588625154.db2.gz BMGMFSISEVADGI-ZYHUDNBSSA-N 1 2 238.306 2.220 20 0 BEADLO c1nn[nH]c1CC[NH+]1CCC2(CCCC2)CC1 ZINC000851779804 588627509 /nfs/dbraw/zinc/62/75/09/588627509.db2.gz XNLXCJUZNJSXQD-UHFFFAOYSA-N 1 2 234.347 2.003 20 0 BEADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cnon2)n1 ZINC000851812671 588632659 /nfs/dbraw/zinc/63/26/59/588632659.db2.gz JDWQDEAYADUFQU-CYBMUJFWSA-N 1 2 244.298 2.110 20 0 BEADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2cnon2)n1 ZINC000851812671 588632660 /nfs/dbraw/zinc/63/26/60/588632660.db2.gz JDWQDEAYADUFQU-CYBMUJFWSA-N 1 2 244.298 2.110 20 0 BEADLO ClC(Cl)=CC[N@@H+]1CCOC[C@H]1C1CC1 ZINC000851878597 588638773 /nfs/dbraw/zinc/63/87/73/588638773.db2.gz CZHXRRONOCJFJB-VIFPVBQESA-N 1 2 236.142 2.416 20 0 BEADLO ClC(Cl)=CC[N@H+]1CCOC[C@H]1C1CC1 ZINC000851878597 588638774 /nfs/dbraw/zinc/63/87/74/588638774.db2.gz CZHXRRONOCJFJB-VIFPVBQESA-N 1 2 236.142 2.416 20 0 BEADLO CC[C@]1(C)COCC[N@@H+]1Cc1cccc(F)n1 ZINC000851879285 588638947 /nfs/dbraw/zinc/63/89/47/588638947.db2.gz YZZXWEWZFCFJBQ-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO CC[C@]1(C)COCC[N@H+]1Cc1cccc(F)n1 ZINC000851879285 588638948 /nfs/dbraw/zinc/63/89/48/588638948.db2.gz YZZXWEWZFCFJBQ-CYBMUJFWSA-N 1 2 238.306 2.222 20 0 BEADLO CCc1ccc([C@@H](C)[NH2+]Cc2cnon2)cc1 ZINC000851893226 588641492 /nfs/dbraw/zinc/64/14/92/588641492.db2.gz UDQQYZBBRNWEIE-SNVBAGLBSA-N 1 2 231.299 2.483 20 0 BEADLO CC(C)[C@@H]1C[N@H+](Cc2cccc(F)n2)CCO1 ZINC000851911084 588642899 /nfs/dbraw/zinc/64/28/99/588642899.db2.gz UMNONXHNTYCOAI-LBPRGKRZSA-N 1 2 238.306 2.078 20 0 BEADLO CC(C)[C@@H]1C[N@@H+](Cc2cccc(F)n2)CCO1 ZINC000851911084 588642900 /nfs/dbraw/zinc/64/29/00/588642900.db2.gz UMNONXHNTYCOAI-LBPRGKRZSA-N 1 2 238.306 2.078 20 0 BEADLO C[C@@H](C[S@](C)=O)[N@H+](C)CC=C(Cl)Cl ZINC000851923484 588644262 /nfs/dbraw/zinc/64/42/62/588644262.db2.gz RESVRPRIFYFEIK-CPFSXVBKSA-N 1 2 244.187 2.004 20 0 BEADLO C[C@@H](C[S@](C)=O)[N@@H+](C)CC=C(Cl)Cl ZINC000851923484 588644263 /nfs/dbraw/zinc/64/42/63/588644263.db2.gz RESVRPRIFYFEIK-CPFSXVBKSA-N 1 2 244.187 2.004 20 0 BEADLO F[C@@]1(c2ccccc2)CC[N@H+](Cc2cnon2)C1 ZINC000852018138 588655911 /nfs/dbraw/zinc/65/59/11/588655911.db2.gz KJOMKYJFWCVRJO-ZDUSSCGKSA-N 1 2 247.273 2.140 20 0 BEADLO F[C@@]1(c2ccccc2)CC[N@@H+](Cc2cnon2)C1 ZINC000852018138 588655912 /nfs/dbraw/zinc/65/59/12/588655912.db2.gz KJOMKYJFWCVRJO-ZDUSSCGKSA-N 1 2 247.273 2.140 20 0 BEADLO CC(C)C[C@H](O)CNc1cc[nH+]c(C(C)C)n1 ZINC000110382404 588658787 /nfs/dbraw/zinc/65/87/87/588658787.db2.gz RRFPIOIZVXBVIC-NSHDSACASA-N 1 2 237.347 2.419 20 0 BEADLO COc1cc(C[N@@H+]2CCC[C@@](C)(F)C2)on1 ZINC000852096065 588661877 /nfs/dbraw/zinc/66/18/77/588661877.db2.gz HMWFTUDSBDVESJ-LLVKDONJSA-N 1 2 228.267 2.007 20 0 BEADLO COc1cc(C[N@H+]2CCC[C@@](C)(F)C2)on1 ZINC000852096065 588661878 /nfs/dbraw/zinc/66/18/78/588661878.db2.gz HMWFTUDSBDVESJ-LLVKDONJSA-N 1 2 228.267 2.007 20 0 BEADLO C[C@H]([NH2+]CC=C(Cl)Cl)c1ccn(C)n1 ZINC000852161326 588668631 /nfs/dbraw/zinc/66/86/31/588668631.db2.gz GTDQUOGKFZXOJZ-ZETCQYMHSA-N 1 2 234.130 2.390 20 0 BEADLO COC(=O)C1([N@H+](C/C=C/Cl)C2CC2)CCC1 ZINC000852177802 588669845 /nfs/dbraw/zinc/66/98/45/588669845.db2.gz SNPUOYVSLNVZRL-FPYGCLRLSA-N 1 2 243.734 2.299 20 0 BEADLO COC(=O)C1([N@@H+](C/C=C/Cl)C2CC2)CCC1 ZINC000852177802 588669846 /nfs/dbraw/zinc/66/98/46/588669846.db2.gz SNPUOYVSLNVZRL-FPYGCLRLSA-N 1 2 243.734 2.299 20 0 BEADLO CC[N@H+](CCC(C)=O)[C@@H](C)C(=O)OC(C)(C)C ZINC000852307040 588677218 /nfs/dbraw/zinc/67/72/18/588677218.db2.gz UCZRYTZZBGWQPY-NSHDSACASA-N 1 2 243.347 2.018 20 0 BEADLO CC[N@@H+](CCC(C)=O)[C@@H](C)C(=O)OC(C)(C)C ZINC000852307040 588677219 /nfs/dbraw/zinc/67/72/19/588677219.db2.gz UCZRYTZZBGWQPY-NSHDSACASA-N 1 2 243.347 2.018 20 0 BEADLO COc1ccc(C[NH2+][C@@H](C)c2cscn2)nc1 ZINC000852416201 588681839 /nfs/dbraw/zinc/68/18/39/588681839.db2.gz FZZVJHAFPCFTRT-VIFPVBQESA-N 1 2 249.339 2.398 20 0 BEADLO Cc1nnc(C[N@@H+](C)Cc2ccc(CF)cc2)o1 ZINC000852471602 588683310 /nfs/dbraw/zinc/68/33/10/588683310.db2.gz YMEBEORQJVOEIF-UHFFFAOYSA-N 1 2 249.289 2.480 20 0 BEADLO Cc1nnc(C[N@H+](C)Cc2ccc(CF)cc2)o1 ZINC000852471602 588683311 /nfs/dbraw/zinc/68/33/11/588683311.db2.gz YMEBEORQJVOEIF-UHFFFAOYSA-N 1 2 249.289 2.480 20 0 BEADLO C[C@H](O)[C@H]1CCC[N@@H+]1Cc1csc(Cl)n1 ZINC000852560186 588690500 /nfs/dbraw/zinc/69/05/00/588690500.db2.gz YUBSKSJITQIFAT-IONNQARKSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@H](O)[C@H]1CCC[N@H+]1Cc1csc(Cl)n1 ZINC000852560186 588690501 /nfs/dbraw/zinc/69/05/01/588690501.db2.gz YUBSKSJITQIFAT-IONNQARKSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@@]1(C(F)F)C[N@H+](C/C=C/Cl)CCO1 ZINC000852784553 588702352 /nfs/dbraw/zinc/70/23/52/588702352.db2.gz OFCHCDQXQPUSBL-HPOULIHZSA-N 1 2 225.666 2.095 20 0 BEADLO C[C@@]1(C(F)F)C[N@@H+](C/C=C/Cl)CCO1 ZINC000852784553 588702353 /nfs/dbraw/zinc/70/23/53/588702353.db2.gz OFCHCDQXQPUSBL-HPOULIHZSA-N 1 2 225.666 2.095 20 0 BEADLO CC[N@@H+]1CCCC[C@H]1C(=O)OCC(C)(F)F ZINC000861222908 589152128 /nfs/dbraw/zinc/15/21/28/589152128.db2.gz GFMYYXIAOFJHHD-VIFPVBQESA-N 1 2 235.274 2.059 20 0 BEADLO CC[N@H+]1CCCC[C@H]1C(=O)OCC(C)(F)F ZINC000861222908 589152129 /nfs/dbraw/zinc/15/21/29/589152129.db2.gz GFMYYXIAOFJHHD-VIFPVBQESA-N 1 2 235.274 2.059 20 0 BEADLO CC/C(C)=C(/C)C(=O)N1CCc2[nH]c[nH+]c2C1 ZINC000861761346 589176862 /nfs/dbraw/zinc/17/68/62/589176862.db2.gz DDCWPINVLUBENO-KTKRTIGZSA-N 1 2 233.315 2.041 20 0 BEADLO CC/C(C)=C(/C)C(=O)N1CCc2[nH+]c[nH]c2C1 ZINC000861761346 589176863 /nfs/dbraw/zinc/17/68/63/589176863.db2.gz DDCWPINVLUBENO-KTKRTIGZSA-N 1 2 233.315 2.041 20 0 BEADLO Cc1[nH]c(CN2CCC[C@](C)(F)C2)[nH+]c1C ZINC000862382613 589206992 /nfs/dbraw/zinc/20/69/92/589206992.db2.gz WMYSDEFQVLQUFJ-LBPRGKRZSA-N 1 2 225.311 2.351 20 0 BEADLO Cc1c(C[N@@H+]2CCC[C@@H](F)C2)ccnc1F ZINC000862403373 589209175 /nfs/dbraw/zinc/20/91/75/589209175.db2.gz ZETQMJMIHMZRGW-LLVKDONJSA-N 1 2 226.270 2.463 20 0 BEADLO Cc1c(C[N@H+]2CCC[C@@H](F)C2)ccnc1F ZINC000862403373 589209177 /nfs/dbraw/zinc/20/91/77/589209177.db2.gz ZETQMJMIHMZRGW-LLVKDONJSA-N 1 2 226.270 2.463 20 0 BEADLO Cc1nc(C)c(C[NH+]2CC3(C2)CCCO3)s1 ZINC000862484587 589216850 /nfs/dbraw/zinc/21/68/50/589216850.db2.gz VWAYZEZALBTSCZ-UHFFFAOYSA-N 1 2 238.356 2.125 20 0 BEADLO O=Cc1c[nH]nc1C=Cc1c[nH+]c2ccccn12 ZINC000119132943 589245147 /nfs/dbraw/zinc/24/51/47/589245147.db2.gz QYKFDDSCNBMLMU-SNAWJCMRSA-N 1 2 238.250 2.040 20 0 BEADLO C[C@@H]1C[C@H]1CO[NH+]=C(N)Cc1cccs1 ZINC000863457269 589289549 /nfs/dbraw/zinc/28/95/49/589289549.db2.gz RCZVUVBSXCAWIR-BDAKNGLRSA-N 1 2 224.329 2.445 20 0 BEADLO COc1cccc(C(N)=[NH+]OC[C@@H]2C[C@H]2C)c1 ZINC000863458267 589289871 /nfs/dbraw/zinc/28/98/71/589289871.db2.gz XUGPJQSWBCWRTP-KOLCDFICSA-N 1 2 234.299 2.198 20 0 BEADLO CC[NH2+]Cc1noc(C[C@@H](C)c2ccco2)n1 ZINC000863656256 589308313 /nfs/dbraw/zinc/30/83/13/589308313.db2.gz LQYCLCDNYDIRCA-SECBINFHSA-N 1 2 235.287 2.118 20 0 BEADLO C[C@H](CCO)Nc1ccc(-c2ccncc2)c[nH+]1 ZINC000863677495 589310432 /nfs/dbraw/zinc/31/04/32/589310432.db2.gz MMLUTCZRDDOVCV-LLVKDONJSA-N 1 2 243.310 2.326 20 0 BEADLO Cc1[nH+]cc(-c2cn(C)nc2C(C)C)n1C ZINC000863974322 589331086 /nfs/dbraw/zinc/33/10/86/589331086.db2.gz TVZLLVDIORVFBL-UHFFFAOYSA-N 1 2 218.304 2.252 20 0 BEADLO Cc1[nH+]cc(-c2cnn([C@H]3CCCCO3)c2)n1C ZINC000863976661 589331719 /nfs/dbraw/zinc/33/17/19/589331719.db2.gz JRJMMXNUIPSBRX-CYBMUJFWSA-N 1 2 246.314 2.291 20 0 BEADLO Cn1c[nH+]cc1-c1ccc(C2(O)CCC2)cc1 ZINC000863977914 589331850 /nfs/dbraw/zinc/33/18/50/589331850.db2.gz SWKDTISEPSCANI-UHFFFAOYSA-N 1 2 228.295 2.459 20 0 BEADLO FC(F)(F)C1C[NH+](Cc2ccco2)C1 ZINC000864087597 589342384 /nfs/dbraw/zinc/34/23/84/589342384.db2.gz WZDDMUKYQOUTGA-UHFFFAOYSA-N 1 2 205.179 2.274 20 0 BEADLO CS[C@H]1C[C@H](Nc2cccc([C@H](C)O)[nH+]2)C1 ZINC000864090932 589343481 /nfs/dbraw/zinc/34/34/81/589343481.db2.gz LSKGZXJBKWQBDV-GUBZILKMSA-N 1 2 238.356 2.441 20 0 BEADLO C[C@H](C[S@](=O)Cc1c[nH+]cn1C)C(C)(C)C ZINC000864472039 589373496 /nfs/dbraw/zinc/37/34/96/589373496.db2.gz HPKSBNLUXJVNSS-HWPZZCPQSA-N 1 2 242.388 2.351 20 0 BEADLO CC(C)(C)c1cn(CC2(C)COC2)c[nH+]1 ZINC000865375665 589428046 /nfs/dbraw/zinc/42/80/46/589428046.db2.gz KKATWNQJPIIOAX-UHFFFAOYSA-N 1 2 208.305 2.217 20 0 BEADLO C[C@@H]([NH2+]Cc1cn(C2CC2)cn1)c1ccccn1 ZINC000865400848 589432485 /nfs/dbraw/zinc/43/24/85/589432485.db2.gz AGGSDOGHCBISFO-LLVKDONJSA-N 1 2 242.326 2.464 20 0 BEADLO CCCCNc1nc(N)[nH+]c(C2CCCC2)n1 ZINC000865399767 589432547 /nfs/dbraw/zinc/43/25/47/589432547.db2.gz WTCYYYGYHCKWGC-UHFFFAOYSA-N 1 2 235.335 2.323 20 0 BEADLO CCCCNc1nc(N)nc(C2CCCC2)[nH+]1 ZINC000865399767 589432548 /nfs/dbraw/zinc/43/25/48/589432548.db2.gz WTCYYYGYHCKWGC-UHFFFAOYSA-N 1 2 235.335 2.323 20 0 BEADLO Cc1cc(C(F)(F)F)c[nH+]c1NC[C@H](C)O ZINC000865401574 589432819 /nfs/dbraw/zinc/43/28/19/589432819.db2.gz CPHIWORLGFBFIR-ZETCQYMHSA-N 1 2 234.221 2.202 20 0 BEADLO C[C@H](Nc1nc(N)[nH+]c(C2CCCC2)n1)C1CC1 ZINC000865431153 589435537 /nfs/dbraw/zinc/43/55/37/589435537.db2.gz FJIAMDSIRVFDLC-QMMMGPOBSA-N 1 2 247.346 2.322 20 0 BEADLO C[C@H](Nc1nc(N)nc(C2CCCC2)[nH+]1)C1CC1 ZINC000865431153 589435538 /nfs/dbraw/zinc/43/55/38/589435538.db2.gz FJIAMDSIRVFDLC-QMMMGPOBSA-N 1 2 247.346 2.322 20 0 BEADLO C[C@@H]1C[C@@H]1CNc1nc(N)[nH+]c(C2CCCC2)n1 ZINC000865443035 589436189 /nfs/dbraw/zinc/43/61/89/589436189.db2.gz WKSTXEDNYMYLHC-PSASIEDQSA-N 1 2 247.346 2.179 20 0 BEADLO C[C@@H]1C[C@@H]1CNc1nc(N)nc(C2CCCC2)[nH+]1 ZINC000865443035 589436190 /nfs/dbraw/zinc/43/61/90/589436190.db2.gz WKSTXEDNYMYLHC-PSASIEDQSA-N 1 2 247.346 2.179 20 0 BEADLO OCc1cccc(NCc2cn(C3CC3)c[nH+]2)c1 ZINC000865486635 589440378 /nfs/dbraw/zinc/44/03/78/589440378.db2.gz AQRWCSZREDDCKX-UHFFFAOYSA-N 1 2 243.310 2.322 20 0 BEADLO FC(F)C1(NCc2cn(C3CC3)c[nH+]2)CC1 ZINC000865558432 589446336 /nfs/dbraw/zinc/44/63/36/589446336.db2.gz NCAIFVYDRDDNJL-UHFFFAOYSA-N 1 2 227.258 2.105 20 0 BEADLO CC(C)Cc1cc(N[C@H]2C[C@@H](O)C2(C)C)nc[nH+]1 ZINC000865688928 589456156 /nfs/dbraw/zinc/45/61/56/589456156.db2.gz RJEWLXIUHNENSB-NWDGAFQWSA-N 1 2 249.358 2.246 20 0 BEADLO CC(C)Cc1cc(N[C@@H]2C[C@H](O)C2(C)C)nc[nH+]1 ZINC000865688927 589456219 /nfs/dbraw/zinc/45/62/19/589456219.db2.gz RJEWLXIUHNENSB-NEPJUHHUSA-N 1 2 249.358 2.246 20 0 BEADLO CO[C@H](C)CNc1cc(CC(C)C)[nH+]cn1 ZINC000865714143 589458015 /nfs/dbraw/zinc/45/80/15/589458015.db2.gz GYVQALZIZFMRII-SNVBAGLBSA-N 1 2 223.320 2.122 20 0 BEADLO CC(C)Cc1cc(NC[C@H]2CC[C@H](O)C2)nc[nH+]1 ZINC000865720753 589458307 /nfs/dbraw/zinc/45/83/07/589458307.db2.gz KGNUGKDPEKAJSD-AAEUAGOBSA-N 1 2 249.358 2.248 20 0 BEADLO CC(C)Cc1cc(NCCC[C@H](C)O)nc[nH+]1 ZINC000865737007 589459513 /nfs/dbraw/zinc/45/95/13/589459513.db2.gz YNFNMYKXVADQNK-NSHDSACASA-N 1 2 237.347 2.248 20 0 BEADLO Cc1cc(NC(=O)[C@@H]2C[C@@H]2[C@H]2C[C@@H]2C)cc[nH+]1 ZINC000865741581 589460244 /nfs/dbraw/zinc/46/02/44/589460244.db2.gz PYRILMGHWMLNBC-HWNAMQAFSA-N 1 2 230.311 2.043 20 0 BEADLO Cn1cc(C(F)F)c(C[NH2+]Cc2ccoc2)n1 ZINC000865809438 589462630 /nfs/dbraw/zinc/46/26/30/589462630.db2.gz SBJAJGMKXQHIHG-UHFFFAOYSA-N 1 2 241.241 2.241 20 0 BEADLO C[C@@H](O)c1ccc(N2CCC[C@](C)(F)C2)[nH+]c1 ZINC000865840089 589464524 /nfs/dbraw/zinc/46/45/24/589464524.db2.gz DDRFJISBXBPBJQ-MFKMUULPSA-N 1 2 238.306 2.463 20 0 BEADLO Clc1cc2c(nc[nH+]c2N2CC3(CC3)C2)[nH]1 ZINC000865842499 589464636 /nfs/dbraw/zinc/46/46/36/589464636.db2.gz SDKSBGCMUJPOJM-UHFFFAOYSA-N 1 2 234.690 2.163 20 0 BEADLO CCCNc1cc(NCC2=CCOCC2)nc[nH+]1 ZINC000865843482 589464796 /nfs/dbraw/zinc/46/47/96/589464796.db2.gz UDGQNPNPVYYOLG-UHFFFAOYSA-N 1 2 248.330 2.057 20 0 BEADLO CCCNc1cc(NCC2=CCOCC2)[nH+]cn1 ZINC000865843482 589464797 /nfs/dbraw/zinc/46/47/97/589464797.db2.gz UDGQNPNPVYYOLG-UHFFFAOYSA-N 1 2 248.330 2.057 20 0 BEADLO CC(C)Cc1cc(NCCC2(CO)CC2)nc[nH+]1 ZINC000865858270 589465192 /nfs/dbraw/zinc/46/51/92/589465192.db2.gz GOPJXOZRRKMFTL-UHFFFAOYSA-N 1 2 249.358 2.250 20 0 BEADLO CCc1nc(CNc2ccc([C@H](C)O)c[nH+]2)co1 ZINC000865859178 589465480 /nfs/dbraw/zinc/46/54/80/589465480.db2.gz MNMGQTWUVIHJTM-VIFPVBQESA-N 1 2 247.298 2.297 20 0 BEADLO CC[C@@H]1OCC[C@H]1Nc1ccc([C@@H](C)O)c[nH+]1 ZINC000865871025 589466178 /nfs/dbraw/zinc/46/61/78/589466178.db2.gz HTJDQWXUOMLHOQ-JLLWLGSASA-N 1 2 236.315 2.114 20 0 BEADLO COc1cccc2[nH+]c(NCC3(F)CC3)[nH]c21 ZINC000865891270 589467429 /nfs/dbraw/zinc/46/74/29/589467429.db2.gz OQLQLRSNNUGUPV-UHFFFAOYSA-N 1 2 235.262 2.486 20 0 BEADLO COc1cccc2[nH]c(NCC3(F)CC3)[nH+]c21 ZINC000865891270 589467430 /nfs/dbraw/zinc/46/74/30/589467430.db2.gz OQLQLRSNNUGUPV-UHFFFAOYSA-N 1 2 235.262 2.486 20 0 BEADLO Cc1nc(N2CCC=C(Cl)C2)cc[nH+]1 ZINC000865905657 589467935 /nfs/dbraw/zinc/46/79/35/589467935.db2.gz RKQOXIFCMAPWHI-UHFFFAOYSA-N 1 2 209.680 2.118 20 0 BEADLO Cc1c[nH+]c(CCNc2ccc(F)nn2)c(C)c1 ZINC000865916201 589468447 /nfs/dbraw/zinc/46/84/47/589468447.db2.gz LXRFQMQLLBLCCT-UHFFFAOYSA-N 1 2 246.289 2.282 20 0 BEADLO CCc1csc(N(C)Cc2c[nH+]c[nH]2)n1 ZINC000865929535 589468902 /nfs/dbraw/zinc/46/89/02/589468902.db2.gz NSDOCCSUUJCMEY-UHFFFAOYSA-N 1 2 222.317 2.065 20 0 BEADLO CCc1csc(N(C)Cc2c[nH]c[nH+]2)n1 ZINC000865929535 589468903 /nfs/dbraw/zinc/46/89/03/589468903.db2.gz NSDOCCSUUJCMEY-UHFFFAOYSA-N 1 2 222.317 2.065 20 0 BEADLO Cc1nc(NC[C@@H]2CCC23CCOCC3)cc[nH+]1 ZINC000866175145 589479059 /nfs/dbraw/zinc/47/90/59/589479059.db2.gz OWBNAMSBHGYACI-LBPRGKRZSA-N 1 2 247.342 2.404 20 0 BEADLO Cc1nc(NCC[C@H](O)C2CCCC2)cc[nH+]1 ZINC000866304223 589485286 /nfs/dbraw/zinc/48/52/86/589485286.db2.gz WBYITWVPTVCIHT-LBPRGKRZSA-N 1 2 235.331 2.138 20 0 BEADLO CCc1cc(NCC[C@H](O)C2CCCC2)nc[nH+]1 ZINC000866303778 589485411 /nfs/dbraw/zinc/48/54/11/589485411.db2.gz PUBFUKYHBCLFDZ-ZDUSSCGKSA-N 1 2 249.358 2.392 20 0 BEADLO FCC[NH2+][C@@H]1c2ccccc2OC[C@H]1F ZINC000866351595 589486804 /nfs/dbraw/zinc/48/68/04/589486804.db2.gz BYFHCPUALCYNKB-MWLCHTKSSA-N 1 2 213.227 2.017 20 0 BEADLO O=C(OC1CCCCC1)N1CCn2cc[nH+]c2C1 ZINC000866820010 589519540 /nfs/dbraw/zinc/51/95/40/589519540.db2.gz PCJJXBKWLGDQDJ-UHFFFAOYSA-N 1 2 249.314 2.168 20 0 BEADLO CCC=C(F)C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000867459797 589520427 /nfs/dbraw/zinc/52/04/27/589520427.db2.gz ZICJHNFQHZZEOL-RDOCRHDPSA-N 1 2 225.267 2.240 20 0 BEADLO CC/C=C(\F)C(=O)N[C@@H](CC)c1[nH]cc[nH+]1 ZINC000867459797 589520428 /nfs/dbraw/zinc/52/04/28/589520428.db2.gz ZICJHNFQHZZEOL-RDOCRHDPSA-N 1 2 225.267 2.240 20 0 BEADLO C[C@@H](NC(=O)[C@@]12C[C@@H]1CCCC2)c1[nH]cc[nH+]1 ZINC000868507254 589561527 /nfs/dbraw/zinc/56/15/27/589561527.db2.gz TVBHTDLHDXWDCU-NRUUGDAUSA-N 1 2 233.315 2.167 20 0 BEADLO CCn1cc[nH+]c1CNC(=O)[C@@H]1C[C@H]1C(C)(C)C ZINC000868662898 589571564 /nfs/dbraw/zinc/57/15/64/589571564.db2.gz VGUQJDFWLIGUEY-GHMZBOCLSA-N 1 2 249.358 2.201 20 0 BEADLO CC/C=C(/F)C(=O)N[C@H](C)c1[nH+]ccn1CC ZINC000868679873 589572648 /nfs/dbraw/zinc/57/26/48/589572648.db2.gz YIGHLMGLJBHKKB-ZFZMKPAXSA-N 1 2 239.294 2.344 20 0 BEADLO Cc1[nH]c(C(=O)NCC2CCC3(CC3)CC2)c[nH+]1 ZINC000871016020 589711835 /nfs/dbraw/zinc/71/18/35/589711835.db2.gz IHCDUQMFFVGMPR-UHFFFAOYSA-N 1 2 247.342 2.418 20 0 BEADLO CCSCc1[nH+]ccn1CC(F)F ZINC000871696063 589793243 /nfs/dbraw/zinc/79/32/43/589793243.db2.gz HLGQUJORQQBTNQ-UHFFFAOYSA-N 1 2 206.261 2.401 20 0 BEADLO CO[C@H]1C[C@@H](CSCCn2cc[nH+]c2)C1 ZINC000871713381 589796901 /nfs/dbraw/zinc/79/69/01/589796901.db2.gz WDENUPLMVHZWIR-PHIMTYICSA-N 1 2 226.345 2.041 20 0 BEADLO CO[C@H](C)C(N)=[NH+]OCC1CC2(CCC2)C1 ZINC000871735059 589800913 /nfs/dbraw/zinc/80/09/13/589800913.db2.gz MFRPSIUYGTXMQK-SECBINFHSA-N 1 2 226.320 2.100 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OCCCSC(C)(C)C ZINC000871735526 589801228 /nfs/dbraw/zinc/80/12/28/589801228.db2.gz SPXSTNWJNOHTEO-VIFPVBQESA-N 1 2 248.392 2.442 20 0 BEADLO CO[C@@H](C)C(N)=[NH+]OC[C@H](C)C(C)(C)C ZINC000871735570 589801382 /nfs/dbraw/zinc/80/13/82/589801382.db2.gz ULBYKKXCLBATNB-IUCAKERBSA-N 1 2 216.325 2.202 20 0 BEADLO C[C@H](CO[NH+]=C(N)[C@@H]1CCCO1)C(C)(C)C ZINC000871748650 589804433 /nfs/dbraw/zinc/80/44/33/589804433.db2.gz MJXATRXVUCNAPO-ZJUUUORDSA-N 1 2 228.336 2.346 20 0 BEADLO NC(=[NH+]OCC1CC2(CCC2)C1)[C@H]1CCCO1 ZINC000871748863 589804551 /nfs/dbraw/zinc/80/45/51/589804551.db2.gz OXOSOQCBKVWIPK-LLVKDONJSA-N 1 2 238.331 2.244 20 0 BEADLO NC(COC1CCC1)=[NH+]OCC1=CCCC1 ZINC000871778348 589813530 /nfs/dbraw/zinc/81/35/30/589813530.db2.gz DVSBHCSZLFYYDC-UHFFFAOYSA-N 1 2 224.304 2.164 20 0 BEADLO NC(COC1CCC1)=[NH+]OCc1ccccc1 ZINC000871777046 589813648 /nfs/dbraw/zinc/81/36/48/589813648.db2.gz YVMMPFCZCGFYOB-UHFFFAOYSA-N 1 2 234.299 2.254 20 0 BEADLO NC(COC1CCC1)=[NH+]OCCC1CCC1 ZINC000871778313 589813860 /nfs/dbraw/zinc/81/38/60/589813860.db2.gz CCGMVKGWIAZTEV-UHFFFAOYSA-N 1 2 226.320 2.244 20 0 BEADLO CC(C)[C@H](C)O[NH+]=C(N)COC1CCC1 ZINC000871778510 589813940 /nfs/dbraw/zinc/81/39/40/589813940.db2.gz KUMAZIKMUVUWAV-VIFPVBQESA-N 1 2 214.309 2.098 20 0 BEADLO NC(COC1CCC1)=[NH+]OC[C@@H]1C[C@H]2C[C@H]2C1 ZINC000871778293 589814246 /nfs/dbraw/zinc/81/42/46/589814246.db2.gz BFPVSCSBXAFTOQ-JGPRNRPPSA-N 1 2 238.331 2.100 20 0 BEADLO CCOC(=O)[C@@H](CC(C)C)[NH2+][C@@H]1CC12CCC2 ZINC000871937996 589834953 /nfs/dbraw/zinc/83/49/53/589834953.db2.gz KFRTWZREQONIAN-VXGBXAGGSA-N 1 2 239.359 2.496 20 0 BEADLO Clc1ccc(COCc2[nH]cc[nH+]2)cn1 ZINC000123897813 589849158 /nfs/dbraw/zinc/84/91/58/589849158.db2.gz YGBWBKAVSUVVIK-UHFFFAOYSA-N 1 2 223.663 2.175 20 0 BEADLO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@H]1CC(C)(C)CO1 ZINC000872107680 589873316 /nfs/dbraw/zinc/87/33/16/589873316.db2.gz QSPDOJVSQOYCMX-GXSJLCMTSA-N 1 2 237.347 2.184 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]C[C@@H]1CC(C)(C)CO1 ZINC000872107681 589873347 /nfs/dbraw/zinc/87/33/47/589873347.db2.gz QSPDOJVSQOYCMX-KOLCDFICSA-N 1 2 237.347 2.184 20 0 BEADLO CC[C@H]([NH2+]Cc1nonc1C)c1ccncc1 ZINC000872135521 589878887 /nfs/dbraw/zinc/87/88/87/589878887.db2.gz HYTXUVBHKDASNL-NSHDSACASA-N 1 2 232.287 2.014 20 0 BEADLO CCc1ccc([C@H](C)[NH2+]Cc2nonc2C)o1 ZINC000872135968 589879390 /nfs/dbraw/zinc/87/93/90/589879390.db2.gz JSWWOCSRLHAEQK-VIFPVBQESA-N 1 2 235.287 2.384 20 0 BEADLO CC(=O)C1CCN(c2cc[nH+]c(C3CC3)n2)CC1 ZINC000872668532 589959989 /nfs/dbraw/zinc/95/99/89/589959989.db2.gz NNSGCYBJPMXSEB-UHFFFAOYSA-N 1 2 245.326 2.159 20 0 BEADLO Cc1cc(NC[C@@H]2C[C@@H]3CCC[C@@H]3O2)nc[nH+]1 ZINC000872694763 589962337 /nfs/dbraw/zinc/96/23/37/589962337.db2.gz AZOXPCFENMZHPX-SRVKXCTJSA-N 1 2 233.315 2.155 20 0 BEADLO Clc1cc2c(nc[nH+]c2N[C@H]2CC23CCC3)[nH]1 ZINC000872775690 589968442 /nfs/dbraw/zinc/96/84/42/589968442.db2.gz XDEJTPYYDCEMLS-QMMMGPOBSA-N 1 2 248.717 2.388 20 0 BEADLO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccon1)CO2 ZINC000873077100 589983268 /nfs/dbraw/zinc/98/32/68/589983268.db2.gz JOBWGPJYHNRESY-LBPRGKRZSA-N 1 2 230.267 2.206 20 0 BEADLO CCn1cc[nH+]c1CNc1cnn(CC)c1C ZINC000873195194 589989531 /nfs/dbraw/zinc/98/95/31/589989531.db2.gz ADCZYVYMDMXIHY-UHFFFAOYSA-N 1 2 233.319 2.040 20 0 BEADLO CC[C@@H]([NH2+]Cc1ccn[nH]1)[C@H](O)c1ccccc1 ZINC000873195161 589991639 /nfs/dbraw/zinc/99/16/39/589991639.db2.gz YKBHYCVOQQFYLL-ZIAGYGMSSA-N 1 2 245.326 2.012 20 0 BEADLO Cc1[nH]ncc1[C@@H](C)[NH2+]Cc1cc(N)cc(F)c1 ZINC000873288490 590022148 /nfs/dbraw/zinc/02/21/48/590022148.db2.gz HBFZZTQBZONAMN-MRVPVSSYSA-N 1 2 248.305 2.290 20 0 BEADLO CCc1c[nH]c(CC(=O)N2CCCCCCC2)[nH+]1 ZINC000873885215 590076208 /nfs/dbraw/zinc/07/62/08/590076208.db2.gz IPTUFVIWFHGNRC-UHFFFAOYSA-N 1 2 249.358 2.307 20 0 BEADLO CC[C@@H](C)C[NH2+]c1ccc2c(c1)NC(=O)CO2 ZINC000020125635 590076602 /nfs/dbraw/zinc/07/66/02/590076602.db2.gz XZSUQFPKBAXIQL-SECBINFHSA-N 1 2 234.299 2.476 20 0 BEADLO CCC[C@@H](CC)C(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000874049589 590087928 /nfs/dbraw/zinc/08/79/28/590087928.db2.gz IRJXQQYFAQTVEE-NWDGAFQWSA-N 1 2 237.347 2.214 20 0 BEADLO c1csc(NCCc2cn3ccccc3[nH+]2)n1 ZINC000874240600 590097457 /nfs/dbraw/zinc/09/74/57/590097457.db2.gz NJBGMYWHJSEVJZ-UHFFFAOYSA-N 1 2 244.323 2.445 20 0 BEADLO O=C(CCc1[nH]cc[nH+]1)N[C@H]1CCCC2(CC2)C1 ZINC000888696280 590186071 /nfs/dbraw/zinc/18/60/71/590186071.db2.gz PVCBDBVTTMPALG-NSHDSACASA-N 1 2 247.342 2.181 20 0 BEADLO C[N@H+](Cc1cccnc1Br)C1CC1 ZINC000876580120 590218624 /nfs/dbraw/zinc/21/86/24/590218624.db2.gz GBEJTTORTCQMDR-UHFFFAOYSA-N 1 2 241.132 2.438 20 0 BEADLO C[N@@H+](Cc1cccnc1Br)C1CC1 ZINC000876580120 590218625 /nfs/dbraw/zinc/21/86/25/590218625.db2.gz GBEJTTORTCQMDR-UHFFFAOYSA-N 1 2 241.132 2.438 20 0 BEADLO COC[C@@H]1CC[N@H+](Cc2nc(Cl)cs2)C1 ZINC000876724868 590233119 /nfs/dbraw/zinc/23/31/19/590233119.db2.gz AUINKJDDWBEUTP-MRVPVSSYSA-N 1 2 246.763 2.265 20 0 BEADLO COC[C@@H]1CC[N@@H+](Cc2nc(Cl)cs2)C1 ZINC000876724868 590233121 /nfs/dbraw/zinc/23/31/21/590233121.db2.gz AUINKJDDWBEUTP-MRVPVSSYSA-N 1 2 246.763 2.265 20 0 BEADLO C[C@]1(O)CCC[N@H+](Cc2nc(Cl)cs2)C1 ZINC000876759078 590239009 /nfs/dbraw/zinc/23/90/09/590239009.db2.gz KIQFBUCURMMOBK-JTQLQIEISA-N 1 2 246.763 2.143 20 0 BEADLO C[C@]1(O)CCC[N@@H+](Cc2nc(Cl)cs2)C1 ZINC000876759078 590239010 /nfs/dbraw/zinc/23/90/10/590239010.db2.gz KIQFBUCURMMOBK-JTQLQIEISA-N 1 2 246.763 2.143 20 0 BEADLO c1nc(C[NH2+]Cc2cc(C3CC3)no2)cs1 ZINC000876991503 590266335 /nfs/dbraw/zinc/26/63/35/590266335.db2.gz PQQLBLYVINWOES-UHFFFAOYSA-N 1 2 235.312 2.298 20 0 BEADLO COc1cccc(C)c1C[NH2+]Cc1ccon1 ZINC000877076787 590278982 /nfs/dbraw/zinc/27/89/82/590278982.db2.gz VPANITAKJPKNEV-UHFFFAOYSA-N 1 2 232.283 2.281 20 0 BEADLO COc1cccc(C)c1C[NH2+]Cc1ccn(C)n1 ZINC000877125957 590289832 /nfs/dbraw/zinc/28/98/32/590289832.db2.gz XJHNWSUBLDUNHN-UHFFFAOYSA-N 1 2 245.326 2.027 20 0 BEADLO CCCCC[C@H]([NH2+][C@@H](C)[C@@H](C)OC)C(=O)OC ZINC000877469325 590333380 /nfs/dbraw/zinc/33/33/80/590333380.db2.gz MYIKGSDCSHPABD-TUAOUCFPSA-N 1 2 245.363 2.121 20 0 BEADLO CCCCC[C@H]([NH2+][C@H](C)[C@@H](C)OC)C(=O)OC ZINC000877469326 590334263 /nfs/dbraw/zinc/33/42/63/590334263.db2.gz MYIKGSDCSHPABD-UTUOFQBUSA-N 1 2 245.363 2.121 20 0 BEADLO CCCCC[C@H]([NH2+][C@@H](C)[C@H](C)OC)C(=O)OC ZINC000877469324 590334393 /nfs/dbraw/zinc/33/43/93/590334393.db2.gz MYIKGSDCSHPABD-SRVKXCTJSA-N 1 2 245.363 2.121 20 0 BEADLO COC(=O)[C@@H](C)[NH2+][C@@H](C)Cc1cccc(C)c1 ZINC000877492232 590339641 /nfs/dbraw/zinc/33/96/41/590339641.db2.gz HKDXRWGQQVHJPU-NWDGAFQWSA-N 1 2 235.327 2.077 20 0 BEADLO C[C@@H](CO)[N@H+](C)Cc1c(Cl)cncc1Cl ZINC000877527656 590348976 /nfs/dbraw/zinc/34/89/76/590348976.db2.gz UNAJACIXJQKXKN-ZETCQYMHSA-N 1 2 249.141 2.201 20 0 BEADLO C[C@@H](CO)[N@@H+](C)Cc1c(Cl)cncc1Cl ZINC000877527656 590348978 /nfs/dbraw/zinc/34/89/78/590348978.db2.gz UNAJACIXJQKXKN-ZETCQYMHSA-N 1 2 249.141 2.201 20 0 BEADLO CC[N@H+](Cc1nc(Cl)cs1)[C@H]1CCOC1 ZINC000877544383 590353332 /nfs/dbraw/zinc/35/33/32/590353332.db2.gz OYQSNCBMMSCURI-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO CC[N@@H+](Cc1nc(Cl)cs1)[C@H]1CCOC1 ZINC000877544383 590353334 /nfs/dbraw/zinc/35/33/34/590353334.db2.gz OYQSNCBMMSCURI-QMMMGPOBSA-N 1 2 246.763 2.407 20 0 BEADLO FCC(CF)[NH2+]C[C@H]1CC1(Cl)Cl ZINC000877555842 590356651 /nfs/dbraw/zinc/35/66/51/590356651.db2.gz DODLFWGIZBHLBR-RXMQYKEDSA-N 1 2 218.074 2.077 20 0 BEADLO C[C@H](O)C[N@H+](Cc1nc(Cl)cs1)C1CC1 ZINC000877621473 590375848 /nfs/dbraw/zinc/37/58/48/590375848.db2.gz RTZLKAXCFYILHB-ZETCQYMHSA-N 1 2 246.763 2.142 20 0 BEADLO C[C@H](O)C[N@@H+](Cc1nc(Cl)cs1)C1CC1 ZINC000877621473 590375850 /nfs/dbraw/zinc/37/58/50/590375850.db2.gz RTZLKAXCFYILHB-ZETCQYMHSA-N 1 2 246.763 2.142 20 0 BEADLO CC1(C[N@@H+]2CC[C@@H](O)C(F)(F)C2)CCCC1 ZINC000877624349 590376453 /nfs/dbraw/zinc/37/64/53/590376453.db2.gz NYBLGCMJARWBGG-SNVBAGLBSA-N 1 2 233.302 2.269 20 0 BEADLO CC1(C[N@H+]2CC[C@@H](O)C(F)(F)C2)CCCC1 ZINC000877624349 590376456 /nfs/dbraw/zinc/37/64/56/590376456.db2.gz NYBLGCMJARWBGG-SNVBAGLBSA-N 1 2 233.302 2.269 20 0 BEADLO Cn1c(Cl)cnc1C[NH+]1CCC(C)(F)CC1 ZINC000877700068 590394141 /nfs/dbraw/zinc/39/41/41/590394141.db2.gz BHPOYSRICPFBDX-UHFFFAOYSA-N 1 2 245.729 2.398 20 0 BEADLO Cc1ncccc1C[NH+]1CC(OC(C)(C)C)C1 ZINC000877769632 590421350 /nfs/dbraw/zinc/42/13/50/590421350.db2.gz GTNWHZFCQRJZCH-UHFFFAOYSA-N 1 2 234.343 2.389 20 0 BEADLO Cn1ccnc1C[N@@H+]1CC[C@@](C)(C(F)(F)F)C1 ZINC000877813104 590426771 /nfs/dbraw/zinc/42/67/71/590426771.db2.gz WKRBSOGUEXBVLI-SNVBAGLBSA-N 1 2 247.264 2.194 20 0 BEADLO Cn1ccnc1C[N@H+]1CC[C@@](C)(C(F)(F)F)C1 ZINC000877813104 590426774 /nfs/dbraw/zinc/42/67/74/590426774.db2.gz WKRBSOGUEXBVLI-SNVBAGLBSA-N 1 2 247.264 2.194 20 0 BEADLO FC(F)(F)[C@@H]1CC[N@H+](Cc2ccoc2)CCO1 ZINC000877820450 590427959 /nfs/dbraw/zinc/42/79/59/590427959.db2.gz PTCSDIFTZNFWSD-JTQLQIEISA-N 1 2 249.232 2.433 20 0 BEADLO FC(F)(F)[C@@H]1CC[N@@H+](Cc2ccoc2)CCO1 ZINC000877820450 590427960 /nfs/dbraw/zinc/42/79/60/590427960.db2.gz PTCSDIFTZNFWSD-JTQLQIEISA-N 1 2 249.232 2.433 20 0 BEADLO C[C@H]1CCC[N@H+](Cc2nccn2CC(F)F)C1 ZINC000877934083 590450834 /nfs/dbraw/zinc/45/08/34/590450834.db2.gz AUSKEDBTHXLJPJ-JTQLQIEISA-N 1 2 243.301 2.380 20 0 BEADLO C[C@H]1CCC[N@@H+](Cc2nccn2CC(F)F)C1 ZINC000877934083 590450836 /nfs/dbraw/zinc/45/08/36/590450836.db2.gz AUSKEDBTHXLJPJ-JTQLQIEISA-N 1 2 243.301 2.380 20 0 BEADLO Clc1ncsc1C[NH+]1CCSCC1 ZINC000877968350 590461332 /nfs/dbraw/zinc/46/13/32/590461332.db2.gz XARCBEVLCNRLQM-UHFFFAOYSA-N 1 2 234.777 2.345 20 0 BEADLO Cc1cc(NC(=O)C[C@@H]2C[C@H]2C2CC2)cc[nH+]1 ZINC000878008512 590471615 /nfs/dbraw/zinc/47/16/15/590471615.db2.gz LLRJNVGRBAOHGB-AAEUAGOBSA-N 1 2 230.311 2.187 20 0 BEADLO CO[C@H]1C[C@@H](C[N@@H+](CC(F)F)C2CC2)C1 ZINC000878083284 590488514 /nfs/dbraw/zinc/48/85/14/590488514.db2.gz SCFBEIKDHCXDLR-WAAGHKOSSA-N 1 2 219.275 2.141 20 0 BEADLO CO[C@H]1C[C@@H](C[N@H+](CC(F)F)C2CC2)C1 ZINC000878083284 590488511 /nfs/dbraw/zinc/48/85/11/590488511.db2.gz SCFBEIKDHCXDLR-WAAGHKOSSA-N 1 2 219.275 2.141 20 0 BEADLO CCC[C@H](CC)C(=O)NCCNc1cccc[nH+]1 ZINC000878081687 590489055 /nfs/dbraw/zinc/48/90/55/590489055.db2.gz PBIBYFNTMWHCPN-LBPRGKRZSA-N 1 2 249.358 2.436 20 0 BEADLO C[N@@H+](Cc1cc[nH]n1)C[C@H]1CCC(C)(C)CO1 ZINC000878097890 590492360 /nfs/dbraw/zinc/49/23/60/590492360.db2.gz PIDGFUTZEVXRMB-GFCCVEGCSA-N 1 2 237.347 2.047 20 0 BEADLO C[N@H+](Cc1cc[nH]n1)C[C@H]1CCC(C)(C)CO1 ZINC000878097890 590492364 /nfs/dbraw/zinc/49/23/64/590492364.db2.gz PIDGFUTZEVXRMB-GFCCVEGCSA-N 1 2 237.347 2.047 20 0 BEADLO FC(F)(F)[C@@H]1C[N@H+](CCCC2CC2)CCO1 ZINC000878123300 590500680 /nfs/dbraw/zinc/50/06/80/590500680.db2.gz WKGPMQDDTKODRP-JTQLQIEISA-N 1 2 237.265 2.440 20 0 BEADLO FC(F)(F)[C@@H]1C[N@@H+](CCCC2CC2)CCO1 ZINC000878123300 590500683 /nfs/dbraw/zinc/50/06/83/590500683.db2.gz WKGPMQDDTKODRP-JTQLQIEISA-N 1 2 237.265 2.440 20 0 BEADLO CO[C@@H]1CC[N@H+](Cc2scnc2Cl)C1 ZINC000878166641 590512320 /nfs/dbraw/zinc/51/23/20/590512320.db2.gz ZZPRMMMHTKDNIA-SSDOTTSWSA-N 1 2 232.736 2.017 20 0 BEADLO CO[C@@H]1CC[N@@H+](Cc2scnc2Cl)C1 ZINC000878166641 590512323 /nfs/dbraw/zinc/51/23/23/590512323.db2.gz ZZPRMMMHTKDNIA-SSDOTTSWSA-N 1 2 232.736 2.017 20 0 BEADLO Cc1conc1C[N@@H+](C)Cc1cccc(O)c1 ZINC000878165023 590512782 /nfs/dbraw/zinc/51/27/82/590512782.db2.gz RPUNHIQDDULOGI-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO Cc1conc1C[N@H+](C)Cc1cccc(O)c1 ZINC000878165023 590512784 /nfs/dbraw/zinc/51/27/84/590512784.db2.gz RPUNHIQDDULOGI-UHFFFAOYSA-N 1 2 232.283 2.321 20 0 BEADLO C[N@H+](CC[C@H]1CCCC1(F)F)Cc1nnc[nH]1 ZINC000878175889 590516004 /nfs/dbraw/zinc/51/60/04/590516004.db2.gz FJRXDJDDAFEICY-SECBINFHSA-N 1 2 244.289 2.062 20 0 BEADLO C[N@@H+](CC[C@H]1CCCC1(F)F)Cc1nnc[nH]1 ZINC000878175889 590516006 /nfs/dbraw/zinc/51/60/06/590516006.db2.gz FJRXDJDDAFEICY-SECBINFHSA-N 1 2 244.289 2.062 20 0 BEADLO Cc1conc1C[N@H+](C)CCOC(C)(C)C ZINC000878201033 590523454 /nfs/dbraw/zinc/52/34/54/590523454.db2.gz XGHGPAMHKLAXDA-UHFFFAOYSA-N 1 2 226.320 2.230 20 0 BEADLO Cc1conc1C[N@@H+](C)CCOC(C)(C)C ZINC000878201033 590523455 /nfs/dbraw/zinc/52/34/55/590523455.db2.gz XGHGPAMHKLAXDA-UHFFFAOYSA-N 1 2 226.320 2.230 20 0 BEADLO CC[C@H]1CCC[C@]1(C)C(=O)NCCn1cc[nH+]c1 ZINC000878223186 590526171 /nfs/dbraw/zinc/52/61/71/590526171.db2.gz LXZPRZNGRSZDRI-JSGCOSHPSA-N 1 2 249.358 2.216 20 0 BEADLO COCC1([N@H+](C)Cc2scnc2Cl)CC1 ZINC000878318555 590543557 /nfs/dbraw/zinc/54/35/57/590543557.db2.gz VDNZCTRHDNRUEY-UHFFFAOYSA-N 1 2 246.763 2.407 20 0 BEADLO COCC1([N@@H+](C)Cc2scnc2Cl)CC1 ZINC000878318555 590543559 /nfs/dbraw/zinc/54/35/59/590543559.db2.gz VDNZCTRHDNRUEY-UHFFFAOYSA-N 1 2 246.763 2.407 20 0 BEADLO Cc1conc1C[NH+]1CC2(C1)CC(F)(F)C2 ZINC000878322037 590544973 /nfs/dbraw/zinc/54/49/73/590544973.db2.gz VFZYJYLAJSWGAN-UHFFFAOYSA-N 1 2 228.242 2.214 20 0 BEADLO Cc1conc1C[N@@H+]1CCOCC12CCCC2 ZINC000878322888 590546389 /nfs/dbraw/zinc/54/63/89/590546389.db2.gz QZIRYKRTROWZSQ-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO Cc1conc1C[N@H+]1CCOCC12CCCC2 ZINC000878322888 590546392 /nfs/dbraw/zinc/54/63/92/590546392.db2.gz QZIRYKRTROWZSQ-UHFFFAOYSA-N 1 2 236.315 2.128 20 0 BEADLO Cc1conc1C[NH2+][C@H](CCO)c1ccccc1 ZINC000878350705 590553511 /nfs/dbraw/zinc/55/35/11/590553511.db2.gz RNKBGBKAWWPOJA-CYBMUJFWSA-N 1 2 246.310 2.196 20 0 BEADLO Cc1conc1C[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000878383826 590558260 /nfs/dbraw/zinc/55/82/60/590558260.db2.gz WKBAYTLEUKGBIO-SCZZXKLOSA-N 1 2 212.268 2.163 20 0 BEADLO Cc1conc1C[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000878383826 590558261 /nfs/dbraw/zinc/55/82/61/590558261.db2.gz WKBAYTLEUKGBIO-SCZZXKLOSA-N 1 2 212.268 2.163 20 0 BEADLO C=C/C=C\CC[NH+]1CC(O)(c2ccc(F)cc2)C1 ZINC000878453138 590569548 /nfs/dbraw/zinc/56/95/48/590569548.db2.gz QJGFOCXNMROLMF-ARJAWSKDSA-N 1 2 247.313 2.461 20 0 BEADLO CCn1ccc(C[N@H+](C)Cc2nocc2C)c1 ZINC000878499527 590580231 /nfs/dbraw/zinc/58/02/31/590580231.db2.gz WHBQEKWAFNITAL-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO CCn1ccc(C[N@@H+](C)Cc2nocc2C)c1 ZINC000878499527 590580234 /nfs/dbraw/zinc/58/02/34/590580234.db2.gz WHBQEKWAFNITAL-UHFFFAOYSA-N 1 2 233.315 2.436 20 0 BEADLO Cc1conc1C[N@@H+](C)Cc1cnccc1C ZINC000878540295 590588853 /nfs/dbraw/zinc/58/88/53/590588853.db2.gz LREBGNWUVGAOTA-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1conc1C[N@H+](C)Cc1cnccc1C ZINC000878540295 590588854 /nfs/dbraw/zinc/58/88/54/590588854.db2.gz LREBGNWUVGAOTA-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO C=C/C=C\CC[N@@H+]1CCC[C@@H](C2N=NC(=O)O2)C1 ZINC000878549356 590590610 /nfs/dbraw/zinc/59/06/10/590590610.db2.gz FHKQVBZNMROLGM-DLRQAJBASA-N 1 2 249.314 2.087 20 0 BEADLO C=C/C=C\CC[N@H+]1CCC[C@@H](C2N=NC(=O)O2)C1 ZINC000878549356 590590611 /nfs/dbraw/zinc/59/06/11/590590611.db2.gz FHKQVBZNMROLGM-DLRQAJBASA-N 1 2 249.314 2.087 20 0 BEADLO C[C@H]1C[N@H+](Cc2nc3c(o2)CCCC3)[C@H]1C ZINC000878652126 590602668 /nfs/dbraw/zinc/60/26/68/590602668.db2.gz MGPMEPAUPHIMJW-UWVGGRQHSA-N 1 2 220.316 2.394 20 0 BEADLO C[C@H]1C[N@@H+](Cc2nc3c(o2)CCCC3)[C@H]1C ZINC000878652126 590602669 /nfs/dbraw/zinc/60/26/69/590602669.db2.gz MGPMEPAUPHIMJW-UWVGGRQHSA-N 1 2 220.316 2.394 20 0 BEADLO C[C@H](O)C[N@H+](CCCC1CC1)CC(F)F ZINC000878684307 590609038 /nfs/dbraw/zinc/60/90/38/590609038.db2.gz RFXVMQAUMBSFNI-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO C[C@H](O)C[N@@H+](CCCC1CC1)CC(F)F ZINC000878684307 590609039 /nfs/dbraw/zinc/60/90/39/590609039.db2.gz RFXVMQAUMBSFNI-VIFPVBQESA-N 1 2 221.291 2.125 20 0 BEADLO CC[C@@H]1CCC[C@@]1(C)C(=O)NCc1[nH+]ccn1C ZINC000878722411 590616756 /nfs/dbraw/zinc/61/67/56/590616756.db2.gz UICOZOGBHJLEFK-BXUZGUMPSA-N 1 2 249.358 2.253 20 0 BEADLO CC[C@H]1CCC[C@@]1(C)C(=O)NCc1[nH+]ccn1C ZINC000878722414 590617127 /nfs/dbraw/zinc/61/71/27/590617127.db2.gz UICOZOGBHJLEFK-SMDDNHRTSA-N 1 2 249.358 2.253 20 0 BEADLO Cc1oncc1C[N@@H+]1CCC=C(Cl)C1 ZINC000878791875 590623586 /nfs/dbraw/zinc/62/35/86/590623586.db2.gz UKNUZYWLCIAZKU-UHFFFAOYSA-N 1 2 212.680 2.311 20 0 BEADLO Cc1oncc1C[N@H+]1CCC=C(Cl)C1 ZINC000878791875 590623588 /nfs/dbraw/zinc/62/35/88/590623588.db2.gz UKNUZYWLCIAZKU-UHFFFAOYSA-N 1 2 212.680 2.311 20 0 BEADLO CC[C@@H]1C[N@H+](Cc2nocc2C)[C@H](CC)CO1 ZINC000878803893 590625348 /nfs/dbraw/zinc/62/53/48/590625348.db2.gz NBINSCLRVGMSKJ-VXGBXAGGSA-N 1 2 238.331 2.372 20 0 BEADLO CC[C@@H]1C[N@@H+](Cc2nocc2C)[C@H](CC)CO1 ZINC000878803893 590625350 /nfs/dbraw/zinc/62/53/50/590625350.db2.gz NBINSCLRVGMSKJ-VXGBXAGGSA-N 1 2 238.331 2.372 20 0 BEADLO C[N@@H+](Cc1cnc[nH]1)C[C@H]1CCCC(C)(C)O1 ZINC000878884777 590639817 /nfs/dbraw/zinc/63/98/17/590639817.db2.gz LTWSIIZMEFBJPQ-GFCCVEGCSA-N 1 2 237.347 2.189 20 0 BEADLO C[N@H+](Cc1cnc[nH]1)C[C@H]1CCCC(C)(C)O1 ZINC000878884777 590639820 /nfs/dbraw/zinc/63/98/20/590639820.db2.gz LTWSIIZMEFBJPQ-GFCCVEGCSA-N 1 2 237.347 2.189 20 0 BEADLO C[N@@H+](Cc1c[nH]cn1)C[C@H]1CCCC(C)(C)O1 ZINC000878884777 590639822 /nfs/dbraw/zinc/63/98/22/590639822.db2.gz LTWSIIZMEFBJPQ-GFCCVEGCSA-N 1 2 237.347 2.189 20 0 BEADLO C[N@H+](Cc1c[nH]cn1)C[C@H]1CCCC(C)(C)O1 ZINC000878884777 590639824 /nfs/dbraw/zinc/63/98/24/590639824.db2.gz LTWSIIZMEFBJPQ-GFCCVEGCSA-N 1 2 237.347 2.189 20 0 BEADLO Cc1conc1C[N@H+]1CC2(CCC2)OC[C@H]1C ZINC000878918754 590651571 /nfs/dbraw/zinc/65/15/71/590651571.db2.gz WVDUCPACXRGOGB-LLVKDONJSA-N 1 2 236.315 2.126 20 0 BEADLO Cc1conc1C[N@@H+]1CC2(CCC2)OC[C@H]1C ZINC000878918754 590651576 /nfs/dbraw/zinc/65/15/76/590651576.db2.gz WVDUCPACXRGOGB-LLVKDONJSA-N 1 2 236.315 2.126 20 0 BEADLO C=C/C=C/CCNC(=O)Nc1cc(C)[nH+]cc1C ZINC000879074935 590692916 /nfs/dbraw/zinc/69/29/16/590692916.db2.gz CGEDAWBFJYEKPB-AATRIKPKSA-N 1 2 245.326 2.374 20 0 BEADLO Cc1c[nH+]ccc1NC(=O)NC[C@@]1(C)CC1(C)C ZINC000879073901 590693499 /nfs/dbraw/zinc/69/34/99/590693499.db2.gz ZXOZZSHHHUKAHX-CQSZACIVSA-N 1 2 247.342 2.370 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)C[C@@H]1C[C@H]2CCC[C@@H]2O1 ZINC000879188245 590710027 /nfs/dbraw/zinc/71/00/27/590710027.db2.gz IQWITVIXKCRGLG-XBFCOCLRSA-N 1 2 249.358 2.108 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)C[C@@H]1C[C@H]2CCC[C@@H]2O1 ZINC000879188245 590710029 /nfs/dbraw/zinc/71/00/29/590710029.db2.gz IQWITVIXKCRGLG-XBFCOCLRSA-N 1 2 249.358 2.108 20 0 BEADLO CC1(F)CC[NH+](Cc2cnc(Cl)cn2)CC1 ZINC000879382744 590758504 /nfs/dbraw/zinc/75/85/04/590758504.db2.gz OAROWLARQDHMMR-UHFFFAOYSA-N 1 2 243.713 2.454 20 0 BEADLO Cc1c[nH+]ccc1CCN(C)OCC(F)(F)F ZINC000879516776 590786739 /nfs/dbraw/zinc/78/67/39/590786739.db2.gz YWWRHQPJMKCIBZ-UHFFFAOYSA-N 1 2 248.248 2.358 20 0 BEADLO C[C@H]([NH2+]Cc1ncc(C2CC2)o1)c1ccnn1C ZINC000879684926 590846942 /nfs/dbraw/zinc/84/69/42/590846942.db2.gz BWCYHSAXUQVTIG-VIFPVBQESA-N 1 2 246.314 2.136 20 0 BEADLO C[C@@H]([NH2+]C/C(Cl)=C/Cl)c1ccnn1C ZINC000879686099 590848805 /nfs/dbraw/zinc/84/88/05/590848805.db2.gz SOPGEAVOUKMHDR-BESBCXERSA-N 1 2 234.130 2.390 20 0 BEADLO Cc1cncc([C@H]2CCC[N@@H+]2Cc2cc[nH]n2)c1 ZINC000879751112 590863465 /nfs/dbraw/zinc/86/34/65/590863465.db2.gz FJXAEMQDZBPXJB-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO Cc1cncc([C@H]2CCC[N@H+]2Cc2cc[nH]n2)c1 ZINC000879751112 590863466 /nfs/dbraw/zinc/86/34/66/590863466.db2.gz FJXAEMQDZBPXJB-CQSZACIVSA-N 1 2 242.326 2.450 20 0 BEADLO CO[C@H]1CC[C@H]([N@@H+]2OC3CCC2CC3)C1 ZINC000879799136 590877418 /nfs/dbraw/zinc/87/74/18/590877418.db2.gz GLYAKONWQAHMEA-ADPBJBESSA-N 1 2 211.305 2.112 20 0 BEADLO CO[C@H]1CC[C@H]([N@H+]2OC3CCC2CC3)C1 ZINC000879799136 590877422 /nfs/dbraw/zinc/87/74/22/590877422.db2.gz GLYAKONWQAHMEA-ADPBJBESSA-N 1 2 211.305 2.112 20 0 BEADLO CCOC(=O)[C@H](CC1CC1)[NH2+][C@H]1C=CCCC1 ZINC000879982566 590904338 /nfs/dbraw/zinc/90/43/38/590904338.db2.gz GYQSUFUBUXMFDX-STQMWFEESA-N 1 2 237.343 2.417 20 0 BEADLO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2ncccn2)C1 ZINC000880003740 590907323 /nfs/dbraw/zinc/90/73/23/590907323.db2.gz MULDRVFTZOJJIL-SNVBAGLBSA-N 1 2 245.248 2.251 20 0 BEADLO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ncccn2)C1 ZINC000880003740 590907325 /nfs/dbraw/zinc/90/73/25/590907325.db2.gz MULDRVFTZOJJIL-SNVBAGLBSA-N 1 2 245.248 2.251 20 0 BEADLO Cc1nonc1C[N@@H+]1CC[C@@](C)(C(F)(F)F)C1 ZINC000880002432 590907457 /nfs/dbraw/zinc/90/74/57/590907457.db2.gz KFOAXKRQAKDSHT-SECBINFHSA-N 1 2 249.236 2.152 20 0 BEADLO Cc1nonc1C[N@H+]1CC[C@@](C)(C(F)(F)F)C1 ZINC000880002432 590907458 /nfs/dbraw/zinc/90/74/58/590907458.db2.gz KFOAXKRQAKDSHT-SECBINFHSA-N 1 2 249.236 2.152 20 0 BEADLO CSC(C)(C)C[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000128180109 590918982 /nfs/dbraw/zinc/91/89/82/590918982.db2.gz CNRDSAPFWKVAKX-VIFPVBQESA-N 1 2 247.404 2.448 20 0 BEADLO Cn1c(Cl)cnc1C[N@@H+]1CCC[C@H](CF)C1 ZINC000880233768 590965322 /nfs/dbraw/zinc/96/53/22/590965322.db2.gz FUQHAXDVAKQTPV-SECBINFHSA-N 1 2 245.729 2.255 20 0 BEADLO Cn1c(Cl)cnc1C[N@H+]1CCC[C@H](CF)C1 ZINC000880233768 590965325 /nfs/dbraw/zinc/96/53/25/590965325.db2.gz FUQHAXDVAKQTPV-SECBINFHSA-N 1 2 245.729 2.255 20 0 BEADLO CC(C)n1ncnc1C[N@@H+]1CCC[C@@H](CF)C1 ZINC000880237177 590968097 /nfs/dbraw/zinc/96/80/97/590968097.db2.gz RZIGBXJDRDPIJI-NSHDSACASA-N 1 2 240.326 2.041 20 0 BEADLO CC(C)n1ncnc1C[N@H+]1CCC[C@@H](CF)C1 ZINC000880237177 590968100 /nfs/dbraw/zinc/96/81/00/590968100.db2.gz RZIGBXJDRDPIJI-NSHDSACASA-N 1 2 240.326 2.041 20 0 BEADLO CC(=O)c1cc(C[N@@H+]2CCC[C@H](CF)C2)on1 ZINC000880237459 590968690 /nfs/dbraw/zinc/96/86/90/590968690.db2.gz CLKWVFCVNNWRPH-SNVBAGLBSA-N 1 2 240.278 2.059 20 0 BEADLO CC(=O)c1cc(C[N@H+]2CCC[C@H](CF)C2)on1 ZINC000880237459 590968691 /nfs/dbraw/zinc/96/86/91/590968691.db2.gz CLKWVFCVNNWRPH-SNVBAGLBSA-N 1 2 240.278 2.059 20 0 BEADLO C[C@@H](c1csnn1)[N@@H+]1CCC[C@H](CF)C1 ZINC000880238901 590970691 /nfs/dbraw/zinc/97/06/91/590970691.db2.gz YWBJVAXPWBCMRQ-DTWKUNHWSA-N 1 2 229.324 2.281 20 0 BEADLO C[C@@H](c1csnn1)[N@H+]1CCC[C@H](CF)C1 ZINC000880238901 590970694 /nfs/dbraw/zinc/97/06/94/590970694.db2.gz YWBJVAXPWBCMRQ-DTWKUNHWSA-N 1 2 229.324 2.281 20 0 BEADLO CCCCOC(=O)[C@@H](C)[NH+]1CCC(F)CC1 ZINC000880242060 590975415 /nfs/dbraw/zinc/97/54/15/590975415.db2.gz NMXDKOKRORZELH-SNVBAGLBSA-N 1 2 231.311 2.152 20 0 BEADLO FC[C@@H]1CC[N@H+](Cc2nccn2C(F)F)C1 ZINC000880295075 590989849 /nfs/dbraw/zinc/98/98/49/590989849.db2.gz IJGRBTIOMOZYCL-QMMMGPOBSA-N 1 2 233.237 2.070 20 0 BEADLO FC[C@@H]1CC[N@@H+](Cc2nccn2C(F)F)C1 ZINC000880295075 590989853 /nfs/dbraw/zinc/98/98/53/590989853.db2.gz IJGRBTIOMOZYCL-QMMMGPOBSA-N 1 2 233.237 2.070 20 0 BEADLO C[C@@H]1C[NH+]=C(NC(=O)C[C@@H]2C[C@H]2C2CC2)S1 ZINC000880353467 591009630 /nfs/dbraw/zinc/00/96/30/591009630.db2.gz DKJDLCFDCHFFMW-JEZHCXPESA-N 1 2 238.356 2.030 20 0 BEADLO OC[C@H]1C=CC[N@@H+]1Cc1ccc(F)c(Cl)c1 ZINC000880489275 591066135 /nfs/dbraw/zinc/06/61/35/591066135.db2.gz RDVKMPSQLKKCDA-SNVBAGLBSA-N 1 2 241.693 2.212 20 0 BEADLO OC[C@H]1C=CC[N@H+]1Cc1ccc(F)c(Cl)c1 ZINC000880489275 591066138 /nfs/dbraw/zinc/06/61/38/591066138.db2.gz RDVKMPSQLKKCDA-SNVBAGLBSA-N 1 2 241.693 2.212 20 0 BEADLO Fc1cccc(C[N@@H+]2CCc3ncncc3C2)c1 ZINC000880593629 591104966 /nfs/dbraw/zinc/10/49/66/591104966.db2.gz GPYRDFXLENHRNU-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO Fc1cccc(C[N@H+]2CCc3ncncc3C2)c1 ZINC000880593629 591104968 /nfs/dbraw/zinc/10/49/68/591104968.db2.gz GPYRDFXLENHRNU-UHFFFAOYSA-N 1 2 243.285 2.174 20 0 BEADLO OCC1CC[NH+](C/C(Cl)=C\Cl)CC1 ZINC000211367596 591162670 /nfs/dbraw/zinc/16/26/70/591162670.db2.gz QKYSQDDTIIXMGB-WEVVVXLNSA-N 1 2 224.131 2.010 20 0 BEADLO CCCC(=O)c1cn(Cc2ccc[nH+]c2C)nn1 ZINC000881299003 591183145 /nfs/dbraw/zinc/18/31/45/591183145.db2.gz VWKNSWSTPCEMOQ-UHFFFAOYSA-N 1 2 244.298 2.013 20 0 BEADLO O=C(CCc1c[nH+]c[nH]1)NCC1(CC2CC2)CC1 ZINC000881519943 591227947 /nfs/dbraw/zinc/22/79/47/591227947.db2.gz FZEACZUXLKAFGB-UHFFFAOYSA-N 1 2 247.342 2.039 20 0 BEADLO O=C(CCc1c[nH]c[nH+]1)NCC1(CC2CC2)CC1 ZINC000881519943 591227950 /nfs/dbraw/zinc/22/79/50/591227950.db2.gz FZEACZUXLKAFGB-UHFFFAOYSA-N 1 2 247.342 2.039 20 0 BEADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC[C@]1(C)CC1(C)C ZINC000881545786 591237398 /nfs/dbraw/zinc/23/73/98/591237398.db2.gz OGIBFWQWTZEVPD-YGRLFVJLSA-N 1 2 249.358 2.141 20 0 BEADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC[C@]1(C)CC1(C)C ZINC000881545786 591237401 /nfs/dbraw/zinc/23/74/01/591237401.db2.gz OGIBFWQWTZEVPD-YGRLFVJLSA-N 1 2 249.358 2.141 20 0 BEADLO Cc1[nH+]cnc(NCCc2ccco2)c1C ZINC000881763250 591269285 /nfs/dbraw/zinc/26/92/85/591269285.db2.gz SFUIUGKQKJWAEG-UHFFFAOYSA-N 1 2 217.272 2.341 20 0 BEADLO Cc1[nH+]cnc(NCC[C@H]2CCCO2)c1C ZINC000881787222 591271288 /nfs/dbraw/zinc/27/12/88/591271288.db2.gz BOUHQHNZDAZFFD-LLVKDONJSA-N 1 2 221.304 2.074 20 0 BEADLO CCOCCCCNc1nc[nH+]c(C)c1C ZINC000881823945 591272980 /nfs/dbraw/zinc/27/29/80/591272980.db2.gz MGJDDHKGJMVNSO-UHFFFAOYSA-N 1 2 223.320 2.322 20 0 BEADLO Cc1[nH+]cnc(NCc2ccoc2)c1C ZINC000881844821 591274619 /nfs/dbraw/zinc/27/46/19/591274619.db2.gz VQDULYYLRGTWCQ-UHFFFAOYSA-N 1 2 203.245 2.299 20 0 BEADLO Cc1[nH+]cnc(NCCc2nccs2)c1C ZINC000881871918 591275905 /nfs/dbraw/zinc/27/59/05/591275905.db2.gz SXGVYIZELSAJRS-UHFFFAOYSA-N 1 2 234.328 2.205 20 0 BEADLO CCC[C@@](C)(O)CNc1nc[nH+]c(C)c1C ZINC000881977818 591284874 /nfs/dbraw/zinc/28/48/74/591284874.db2.gz SNFYYTMBRDCFPO-GFCCVEGCSA-N 1 2 223.320 2.056 20 0 BEADLO Cc1[nH+]cnc(NC[C@@]2(C)CCCC[C@H]2O)c1C ZINC000882052324 591292323 /nfs/dbraw/zinc/29/23/23/591292323.db2.gz CDDYAVVXTDUALH-TZMCWYRMSA-N 1 2 249.358 2.447 20 0 BEADLO Cc1[nH+]cnc(NCC2(C)CCOCC2)c1C ZINC000882073652 591293730 /nfs/dbraw/zinc/29/37/30/591293730.db2.gz WQZWWNMFRCOZLZ-UHFFFAOYSA-N 1 2 235.331 2.322 20 0 BEADLO Cc1[nH+]cnc(N(C)Cc2cccc(O)c2)c1C ZINC000882138684 591305095 /nfs/dbraw/zinc/30/50/95/591305095.db2.gz KTWLIBNGAURFDA-UHFFFAOYSA-N 1 2 243.310 2.435 20 0 BEADLO Cc1ncnc(NCCCCn2cc[nH+]c2)c1C ZINC000882160193 591308749 /nfs/dbraw/zinc/30/87/49/591308749.db2.gz KTHAOLIOWJFUIR-UHFFFAOYSA-N 1 2 245.330 2.182 20 0 BEADLO COC1(C)CCN(c2nc[nH+]c(C)c2C)CC1 ZINC000882159964 591309168 /nfs/dbraw/zinc/30/91/68/591309168.db2.gz HKCGMVBIVIGQGI-UHFFFAOYSA-N 1 2 235.331 2.099 20 0 BEADLO CC(=O)c1c(C)cc(NC(=O)C[NH+](C)C)cc1C ZINC000882175738 591310824 /nfs/dbraw/zinc/31/08/24/591310824.db2.gz XZFVUWOXWGWUPK-UHFFFAOYSA-N 1 2 248.326 2.006 20 0 BEADLO CCc1cnc(CNc2nc[nH+]c(C)c2C)o1 ZINC000882199022 591315352 /nfs/dbraw/zinc/31/53/52/591315352.db2.gz HZGPTRZRIYTYKU-UHFFFAOYSA-N 1 2 232.287 2.256 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2CSC2(C)C)c1C ZINC000882241136 591319782 /nfs/dbraw/zinc/31/97/82/591319782.db2.gz CAIHACSHMXZOTB-SECBINFHSA-N 1 2 223.345 2.399 20 0 BEADLO Cc1[nH+]cnc(N2CCSC[C@H](C)C2)c1C ZINC000882256041 591321990 /nfs/dbraw/zinc/32/19/90/591321990.db2.gz KVCQYGUBZMDMJB-SECBINFHSA-N 1 2 237.372 2.283 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2C[C@H]2C2CC2)c1C ZINC000882299718 591327553 /nfs/dbraw/zinc/32/75/53/591327553.db2.gz WAPNLBLBDSAGOD-WDEREUQCSA-N 1 2 203.289 2.304 20 0 BEADLO Cc1[nH+]cnc(N2CCC3(CCOC3)CC2)c1C ZINC000882311502 591328051 /nfs/dbraw/zinc/32/80/51/591328051.db2.gz OOFOSYUEDJYJJR-UHFFFAOYSA-N 1 2 247.342 2.100 20 0 BEADLO Cc1ncoc1CNc1nc[nH+]c(C)c1C ZINC000882389455 591340209 /nfs/dbraw/zinc/34/02/09/591340209.db2.gz AWZSBGAHYRHUQP-UHFFFAOYSA-N 1 2 218.260 2.002 20 0 BEADLO CO[C@](C)(CNc1nc[nH+]c(C)c1C)C1CC1 ZINC000882388898 591340952 /nfs/dbraw/zinc/34/09/52/591340952.db2.gz YWMRXSRJRFPLHC-CYBMUJFWSA-N 1 2 235.331 2.320 20 0 BEADLO CCC[C@@H](CNc1nc[nH+]c(C)c1C)OC ZINC000882407282 591344077 /nfs/dbraw/zinc/34/40/77/591344077.db2.gz LEWXTIXNLKBMMV-NSHDSACASA-N 1 2 223.320 2.320 20 0 BEADLO c1cn2c([nH+]1)[C@H](Nc1cc(C3CC3)ncn1)CC2 ZINC000882407211 591344416 /nfs/dbraw/zinc/34/44/16/591344416.db2.gz IGNHAIAKIBYSLY-SNVBAGLBSA-N 1 2 241.298 2.107 20 0 BEADLO Cc1[nH+]cnc(N[C@H](C)CC(C)(C)O)c1C ZINC000882413372 591344663 /nfs/dbraw/zinc/34/46/63/591344663.db2.gz KZFGBEHIOCEWKA-MRVPVSSYSA-N 1 2 223.320 2.055 20 0 BEADLO CCn1cc[nH+]c1[C@H](C)Nc1nc(C)cnc1C ZINC000882426822 591346737 /nfs/dbraw/zinc/34/67/37/591346737.db2.gz QMDRRZRMWBLZQW-NSHDSACASA-N 1 2 245.330 2.483 20 0 BEADLO Cc1[nH+]cnc(NCc2ccc(CO)cc2)c1C ZINC000882514079 591380961 /nfs/dbraw/zinc/38/09/61/591380961.db2.gz VSVBJXDAUJFJEV-UHFFFAOYSA-N 1 2 243.310 2.198 20 0 BEADLO Cc1[nH+]cnc(N[C@H](C)c2cnccn2)c1C ZINC000882530490 591383849 /nfs/dbraw/zinc/38/38/49/591383849.db2.gz GZAPAVIFQYPNIE-SNVBAGLBSA-N 1 2 229.287 2.057 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2COC(C)(C)C2)c1C ZINC000882577181 591393348 /nfs/dbraw/zinc/39/33/48/591393348.db2.gz FMQZIWROMPFVJE-JTQLQIEISA-N 1 2 221.304 2.073 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2COC(C)(C)C2)c1C ZINC000882577182 591394485 /nfs/dbraw/zinc/39/44/85/591394485.db2.gz FMQZIWROMPFVJE-SNVBAGLBSA-N 1 2 221.304 2.073 20 0 BEADLO CCO[C@H]1C[C@H](Nc2nc[nH+]c(C)c2C)C1 ZINC000882605056 591398793 /nfs/dbraw/zinc/39/87/93/591398793.db2.gz RKEXHCKWDSOZKG-XYPYZODXSA-N 1 2 221.304 2.073 20 0 BEADLO Cc1[nH+]cnc(NC[C@H]2CCOC2(C)C)c1C ZINC000882635406 591404810 /nfs/dbraw/zinc/40/48/10/591404810.db2.gz GDBLIMQAUJUVHR-LLVKDONJSA-N 1 2 235.331 2.320 20 0 BEADLO Cc1[nH+]cnc(NCC[C@H]2CCCOC2)c1C ZINC000882649225 591407203 /nfs/dbraw/zinc/40/72/03/591407203.db2.gz XBUWYKGCDDBRAC-GFCCVEGCSA-N 1 2 235.331 2.322 20 0 BEADLO Cc1[nH+]cnc(N[C@H]2CO[C@H](C3CC3)C2)c1C ZINC000882662903 591408087 /nfs/dbraw/zinc/40/80/87/591408087.db2.gz HERWBTOBRMRZSI-NEPJUHHUSA-N 1 2 233.315 2.073 20 0 BEADLO Cc1[nH+]cnc(N[C@@H]2C[C@H](C)O[C@H]2C)c1C ZINC000882682123 591411288 /nfs/dbraw/zinc/41/12/88/591411288.db2.gz VSQHNKAVGUAJBX-BKDNQFJXSA-N 1 2 221.304 2.071 20 0 BEADLO Cc1[nH+]cnc(N2CCC[C@@H](CF)C2)c1C ZINC000882804019 591444582 /nfs/dbraw/zinc/44/45/82/591444582.db2.gz OVUKOUQPVZPXHZ-NSHDSACASA-N 1 2 223.295 2.279 20 0 BEADLO Cc1nc(N2CCC3(CCCCO3)CC2)cc[nH+]1 ZINC000882949917 591482785 /nfs/dbraw/zinc/48/27/85/591482785.db2.gz NCOZSUQDSXRAHC-UHFFFAOYSA-N 1 2 247.342 2.325 20 0 BEADLO c1ccc(NC2CCC3(COC3)CC2)[nH+]c1 ZINC000882995585 591500497 /nfs/dbraw/zinc/50/04/97/591500497.db2.gz DLPRUTUJTYLCFF-UHFFFAOYSA-N 1 2 218.300 2.453 20 0 BEADLO C[C@@H]1CCC[C@@H](CC(=O)NC2=[NH+]CCS2)C1 ZINC000130765000 591517517 /nfs/dbraw/zinc/51/75/17/591517517.db2.gz CZJPYORGIISZCN-NXEZZACHSA-N 1 2 240.372 2.422 20 0 BEADLO C[C@H]1CCC[C@@H](CC(=O)NC2=[NH+]CCS2)C1 ZINC000130765201 591518347 /nfs/dbraw/zinc/51/83/47/591518347.db2.gz CZJPYORGIISZCN-VHSXEESVSA-N 1 2 240.372 2.422 20 0 BEADLO CC(C)c1c[nH]c(C[NH2+][C@@H](C)c2ccn(C)n2)n1 ZINC000883145062 591551647 /nfs/dbraw/zinc/55/16/47/591551647.db2.gz LPALGMDFOQBSMV-JTQLQIEISA-N 1 2 247.346 2.117 20 0 BEADLO Cc1ccc(NC(=O)c2cccc(F)n2)c(C)[nH+]1 ZINC000131323671 591595184 /nfs/dbraw/zinc/59/51/84/591595184.db2.gz ZMEZAKUXUWZLLI-UHFFFAOYSA-N 1 2 245.257 2.485 20 0 BEADLO Cc1cc(NCc2cn(C(C)C)nn2)c[nH+]c1C ZINC000883341813 591617089 /nfs/dbraw/zinc/61/70/89/591617089.db2.gz ZZNJVHZDVICQMB-UHFFFAOYSA-N 1 2 245.330 2.483 20 0 BEADLO COC(=O)[C@@H]1C[C@H]1[C@@H](C)Nc1c[nH+]c(C)c(C)c1 ZINC000883341451 591620714 /nfs/dbraw/zinc/62/07/14/591620714.db2.gz QGRYUXIFSIXMPH-KGYLQXTDSA-N 1 2 248.326 2.308 20 0 BEADLO Cc1ccc(C[NH2+]Cc2csnn2)cc1F ZINC000132567742 591720803 /nfs/dbraw/zinc/72/08/03/591720803.db2.gz RHIQXFODOVHMBK-UHFFFAOYSA-N 1 2 237.303 2.275 20 0 BEADLO C[C@@H](O)CC[NH2+]c1ccc(OC(F)F)cc1 ZINC000133556786 591823812 /nfs/dbraw/zinc/82/38/12/591823812.db2.gz IIEZHIQSIHTBKY-MRVPVSSYSA-N 1 2 231.242 2.471 20 0 BEADLO Cc1nc(N[C@H](C)C[C@@H](O)c2ccco2)cc[nH+]1 ZINC000133669728 591845260 /nfs/dbraw/zinc/84/52/60/591845260.db2.gz BUHQDFBAXHFZGU-MWLCHTKSSA-N 1 2 247.298 2.302 20 0 BEADLO Cc1nnc(C[NH2+]Cc2cccc(C)c2)s1 ZINC000134665521 591946180 /nfs/dbraw/zinc/94/61/80/591946180.db2.gz OJRKGOMCDQUROE-UHFFFAOYSA-N 1 2 233.340 2.445 20 0 BEADLO CCc1nc(N[C@H](CO)CC2CCC2)cc[nH+]1 ZINC000884493037 591956129 /nfs/dbraw/zinc/95/61/29/591956129.db2.gz KHWPZSJHNJIXFP-NSHDSACASA-N 1 2 235.331 2.002 20 0 BEADLO CCc1nc(N2C[C@@H](C)O[C@@H](C3CC3)C2)cc[nH+]1 ZINC000884492178 591956227 /nfs/dbraw/zinc/95/62/27/591956227.db2.gz OMBMYJBZRTWLHW-ZYHUDNBSSA-N 1 2 247.342 2.043 20 0 BEADLO CCc1nc(N2CC[C@@H](C(F)F)C2)cc[nH+]1 ZINC000884497244 591956979 /nfs/dbraw/zinc/95/69/79/591956979.db2.gz SXFPNPHFGSAKOH-MRVPVSSYSA-N 1 2 227.258 2.130 20 0 BEADLO CCOC1CC(N(C)c2cc[nH+]c(CC)n2)C1 ZINC000884508738 591961309 /nfs/dbraw/zinc/96/13/09/591961309.db2.gz NRSMNLRMUSZKLD-UHFFFAOYSA-N 1 2 235.331 2.043 20 0 BEADLO CCc1nc(N2CC[C@H]2C(C)C)cc[nH+]1 ZINC000884521842 591964914 /nfs/dbraw/zinc/96/49/14/591964914.db2.gz IECXRQHGHJWNSM-JTQLQIEISA-N 1 2 205.305 2.274 20 0 BEADLO CCc1nc(NC[C@@H]2CC[C@@H](C)O2)cc[nH+]1 ZINC000884527011 591966978 /nfs/dbraw/zinc/96/69/78/591966978.db2.gz HVCFJIHIHIHLQC-ZJUUUORDSA-N 1 2 221.304 2.018 20 0 BEADLO CCc1nc(N[C@H]2CS[C@H](C)C2)cc[nH+]1 ZINC000884530750 591969149 /nfs/dbraw/zinc/96/91/49/591969149.db2.gz SKVRNFRTHIOAGP-RKDXNWHRSA-N 1 2 223.345 2.345 20 0 BEADLO CCc1nc(N[C@@H]2CCO[C@@H](CC)C2)cc[nH+]1 ZINC000884533600 591969454 /nfs/dbraw/zinc/96/94/54/591969454.db2.gz NEHUSSPMQCMKMF-MNOVXSKESA-N 1 2 235.331 2.409 20 0 BEADLO CCc1nc(N[C@@H]2CCO[C@H](CC)C2)cc[nH+]1 ZINC000884533599 591969960 /nfs/dbraw/zinc/96/99/60/591969960.db2.gz NEHUSSPMQCMKMF-GHMZBOCLSA-N 1 2 235.331 2.409 20 0 BEADLO CCc1nc(N[C@H]2CCC[C@H](CO)C2)cc[nH+]1 ZINC000884532248 591969972 /nfs/dbraw/zinc/96/99/72/591969972.db2.gz FVHJEYBNQLTVAQ-QWRGUYRKSA-N 1 2 235.331 2.002 20 0 BEADLO CCO[C@H]1C[C@H](Nc2cc[nH+]c(CC)n2)C1 ZINC000884555588 591977061 /nfs/dbraw/zinc/97/70/61/591977061.db2.gz UYVNGEJUAXAGJC-MGCOHNPYSA-N 1 2 221.304 2.018 20 0 BEADLO CCc1nc(N[C@@H]2COC3(CCC3)C2)cc[nH+]1 ZINC000884555941 591978720 /nfs/dbraw/zinc/97/87/20/591978720.db2.gz DRXSPECHVQMODS-JTQLQIEISA-N 1 2 233.315 2.163 20 0 BEADLO CCc1nccc(NCC(C)(C)n2cc[nH+]c2)n1 ZINC000884559613 591979735 /nfs/dbraw/zinc/97/97/35/591979735.db2.gz ZONZQLWIYNHBTN-UHFFFAOYSA-N 1 2 245.330 2.083 20 0 BEADLO CCc1nc(NCC(F)(F)C(F)F)cc[nH+]1 ZINC000884562948 591981660 /nfs/dbraw/zinc/98/16/60/591981660.db2.gz PCACGMXRELKZCD-UHFFFAOYSA-N 1 2 237.200 2.351 20 0 BEADLO OCc1cc[nH+]c(NCc2cc(C3CC3)no2)c1 ZINC000884637132 591999500 /nfs/dbraw/zinc/99/95/00/591999500.db2.gz BOIAEYMGGCRARB-UHFFFAOYSA-N 1 2 245.282 2.051 20 0 BEADLO Nc1cc(COC(=O)C[C@@H]2C[C@H]2C2CC2)cc[nH+]1 ZINC000884641028 592001088 /nfs/dbraw/zinc/00/10/88/592001088.db2.gz XVRDTIQRPUPWOV-RYUDHWBXSA-N 1 2 246.310 2.143 20 0 BEADLO c1cc(N2C[C@@H]3CSC[C@@H]3C2)nc(C2CC2)[nH+]1 ZINC000884645567 592001826 /nfs/dbraw/zinc/00/18/26/592001826.db2.gz LQPWEWWUNQYERM-PHIMTYICSA-N 1 2 247.367 2.153 20 0 BEADLO C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1CNc1cc(CO)cc[nH+]1 ZINC000884649259 592002464 /nfs/dbraw/zinc/00/24/64/592002464.db2.gz XTTLZBVFZCSCPN-LPTSXCQYSA-N 1 2 232.327 2.278 20 0 BEADLO C[C@@H]1C[C@@H]1[C@H]1C[C@H]1CNc1cc(CO)cc[nH+]1 ZINC000884649258 592002677 /nfs/dbraw/zinc/00/26/77/592002677.db2.gz XTTLZBVFZCSCPN-IXOXFDKPSA-N 1 2 232.327 2.278 20 0 BEADLO C[C@@H]1C[C@@]2(CC[C@@H](CNc3cccc[nH+]3)O2)CO1 ZINC000884698295 592012455 /nfs/dbraw/zinc/01/24/55/592012455.db2.gz LWGMUFXFUICLLF-DYEKYZERSA-N 1 2 248.326 2.220 20 0 BEADLO CC(C)c1nc(NCC(C)(C)CO)cc[nH+]1 ZINC000135600515 592024530 /nfs/dbraw/zinc/02/45/30/592024530.db2.gz RBXLZSRJSGUZBA-UHFFFAOYSA-N 1 2 223.320 2.030 20 0 BEADLO Cc1nc(N(C)CCCF)c2c([nH+]1)CCCC2 ZINC000884856648 592025061 /nfs/dbraw/zinc/02/50/61/592025061.db2.gz IBFAQTDADKOKRH-UHFFFAOYSA-N 1 2 237.322 2.460 20 0 BEADLO C[C@@H]1C[N@H+](CCSC(F)(F)F)[C@H](C)CO1 ZINC000885940458 592111207 /nfs/dbraw/zinc/11/12/07/592111207.db2.gz KBCKFXDZXLCGBJ-HTQZYQBOSA-N 1 2 243.294 2.349 20 0 BEADLO C[C@@H]1C[N@@H+](CCSC(F)(F)F)[C@H](C)CO1 ZINC000885940458 592111208 /nfs/dbraw/zinc/11/12/08/592111208.db2.gz KBCKFXDZXLCGBJ-HTQZYQBOSA-N 1 2 243.294 2.349 20 0 BEADLO C[C@@H]1OCC[N@H+](CCSC(F)(F)F)[C@H]1C ZINC000886041167 592138748 /nfs/dbraw/zinc/13/87/48/592138748.db2.gz KWEBMDRVEGAUDZ-YUMQZZPRSA-N 1 2 243.294 2.349 20 0 BEADLO C[C@@H]1OCC[N@@H+](CCSC(F)(F)F)[C@H]1C ZINC000886041167 592138751 /nfs/dbraw/zinc/13/87/51/592138751.db2.gz KWEBMDRVEGAUDZ-YUMQZZPRSA-N 1 2 243.294 2.349 20 0 BEADLO Cc1n[nH]c(CNc2ccc(N(C)C)c[nH+]2)c1C ZINC000886025755 592134644 /nfs/dbraw/zinc/13/46/44/592134644.db2.gz JGGFHSLXIZMOQG-UHFFFAOYSA-N 1 2 245.330 2.100 20 0 BEADLO Cc1[nH]nc(CNc2ccc(N(C)C)c[nH+]2)c1C ZINC000886025755 592134645 /nfs/dbraw/zinc/13/46/45/592134645.db2.gz JGGFHSLXIZMOQG-UHFFFAOYSA-N 1 2 245.330 2.100 20 0 BEADLO Cc1n[nH]c(CNc2ccc[nH+]c2C)c1C ZINC000886039226 592139291 /nfs/dbraw/zinc/13/92/91/592139291.db2.gz IEYWKDDPOYPKNC-UHFFFAOYSA-N 1 2 216.288 2.342 20 0 BEADLO c1n[nH]c2c1CC[N@@H+](CCOC1CCCCC1)C2 ZINC000886080174 592144335 /nfs/dbraw/zinc/14/43/35/592144335.db2.gz AWRKACJIZGVEGJ-UHFFFAOYSA-N 1 2 249.358 2.117 20 0 BEADLO c1n[nH]c2c1CC[N@H+](CCOC1CCCCC1)C2 ZINC000886080174 592144336 /nfs/dbraw/zinc/14/43/36/592144336.db2.gz AWRKACJIZGVEGJ-UHFFFAOYSA-N 1 2 249.358 2.117 20 0 BEADLO c1[nH]nc2c1CC[N@@H+](CCOC1CCCCC1)C2 ZINC000886080174 592144337 /nfs/dbraw/zinc/14/43/37/592144337.db2.gz AWRKACJIZGVEGJ-UHFFFAOYSA-N 1 2 249.358 2.117 20 0 BEADLO c1[nH]nc2c1CC[N@H+](CCOC1CCCCC1)C2 ZINC000886080174 592144338 /nfs/dbraw/zinc/14/43/38/592144338.db2.gz AWRKACJIZGVEGJ-UHFFFAOYSA-N 1 2 249.358 2.117 20 0 BEADLO C[N@@H+](Cc1ncc[nH]1)C[C@H]1CCC2(CCC2)CO1 ZINC000886091484 592146907 /nfs/dbraw/zinc/14/69/07/592146907.db2.gz BAGVJIKIAWRVQR-GFCCVEGCSA-N 1 2 249.358 2.191 20 0 BEADLO C[N@H+](Cc1ncc[nH]1)C[C@H]1CCC2(CCC2)CO1 ZINC000886091484 592146910 /nfs/dbraw/zinc/14/69/10/592146910.db2.gz BAGVJIKIAWRVQR-GFCCVEGCSA-N 1 2 249.358 2.191 20 0 BEADLO Cc1coc(C[NH2+][C@@H]2CCn3ccnc32)c1 ZINC000886129842 592159527 /nfs/dbraw/zinc/15/95/27/592159527.db2.gz OZDYDPYEUMVMHO-LLVKDONJSA-N 1 2 217.272 2.019 20 0 BEADLO O[C@H]1C[N@H+](CC[C@@H]2C[C@H]2C2CC2)CC(F)(F)C1 ZINC000886166259 592167229 /nfs/dbraw/zinc/16/72/29/592167229.db2.gz CZUPRVDAMBKDRG-UTUOFQBUSA-N 1 2 245.313 2.125 20 0 BEADLO O[C@H]1C[N@@H+](CC[C@@H]2C[C@H]2C2CC2)CC(F)(F)C1 ZINC000886166259 592167231 /nfs/dbraw/zinc/16/72/31/592167231.db2.gz CZUPRVDAMBKDRG-UTUOFQBUSA-N 1 2 245.313 2.125 20 0 BEADLO CCc1nocc1C[NH2+]Cc1cc(C2CC2)no1 ZINC000886270787 592191700 /nfs/dbraw/zinc/19/17/00/592191700.db2.gz MZQJXKSTDXWRFB-UHFFFAOYSA-N 1 2 247.298 2.392 20 0 BEADLO Fc1cnccc1C[NH2+]Cc1cc(C2CC2)no1 ZINC000886269388 592191959 /nfs/dbraw/zinc/19/19/59/592191959.db2.gz UECKXYOGKTVQPY-UHFFFAOYSA-N 1 2 247.273 2.376 20 0 BEADLO C[C@H]([NH2+]Cc1ccc(CO)cc1)c1ncco1 ZINC000886272304 592192694 /nfs/dbraw/zinc/19/26/94/592192694.db2.gz MMWLVNJMWUXITK-JTQLQIEISA-N 1 2 232.283 2.018 20 0 BEADLO C[N@@H+](Cc1cnc[nH]1)C[C@H]1CCC2(CCC2)CO1 ZINC000886274468 592194680 /nfs/dbraw/zinc/19/46/80/592194680.db2.gz UFGUHNLKNXTCLT-CYBMUJFWSA-N 1 2 249.358 2.191 20 0 BEADLO C[N@H+](Cc1cnc[nH]1)C[C@H]1CCC2(CCC2)CO1 ZINC000886274468 592194682 /nfs/dbraw/zinc/19/46/82/592194682.db2.gz UFGUHNLKNXTCLT-CYBMUJFWSA-N 1 2 249.358 2.191 20 0 BEADLO C[N@@H+](Cc1c[nH]cn1)C[C@H]1CCC2(CCC2)CO1 ZINC000886274468 592194683 /nfs/dbraw/zinc/19/46/83/592194683.db2.gz UFGUHNLKNXTCLT-CYBMUJFWSA-N 1 2 249.358 2.191 20 0 BEADLO C[N@H+](Cc1c[nH]cn1)C[C@H]1CCC2(CCC2)CO1 ZINC000886274468 592194684 /nfs/dbraw/zinc/19/46/84/592194684.db2.gz UFGUHNLKNXTCLT-CYBMUJFWSA-N 1 2 249.358 2.191 20 0 BEADLO Cc1cncc(C[NH2+][C@H](C)c2ncco2)c1 ZINC000886538583 592252850 /nfs/dbraw/zinc/25/28/50/592252850.db2.gz KQRABNCDJDDBNZ-SNVBAGLBSA-N 1 2 217.272 2.229 20 0 BEADLO COC(=O)[C@H]1CC[C@H](Nc2ccc(C)[nH+]c2)C1 ZINC000886577107 592266654 /nfs/dbraw/zinc/26/66/54/592266654.db2.gz XDOCANKBYOFSSE-QWRGUYRKSA-N 1 2 234.299 2.144 20 0 BEADLO COC(=O)[C@@H]1CC[C@@H](Nc2ccc(C)[nH+]c2C)C1 ZINC000886578409 592267291 /nfs/dbraw/zinc/26/72/91/592267291.db2.gz VBBBYJVUJQVDBS-VXGBXAGGSA-N 1 2 248.326 2.452 20 0 BEADLO CCn1ccc(C[NH2+][C@H]2CCc3cccnc32)n1 ZINC000886625744 592281268 /nfs/dbraw/zinc/28/12/68/592281268.db2.gz ZAIIUJHTGJSNPL-ZDUSSCGKSA-N 1 2 242.326 2.075 20 0 BEADLO COC(=O)[C@H]1CC[C@@H](Nc2c[nH+]c(C)c(C)c2)C1 ZINC000886651769 592290294 /nfs/dbraw/zinc/29/02/94/592290294.db2.gz QOSNVBOFRAPQEO-NWDGAFQWSA-N 1 2 248.326 2.452 20 0 BEADLO O=C(N[C@]12C[C@H]1CCC2)c1cccc2[nH+]ccn21 ZINC000887036175 592428485 /nfs/dbraw/zinc/42/84/85/592428485.db2.gz VHBVCCHRGBPWRY-QMTHXVAHSA-N 1 2 241.294 2.007 20 0 BEADLO CCC[C@H](O)C[N@H+](CC(F)F)C1CCC1 ZINC000887102134 592442563 /nfs/dbraw/zinc/44/25/63/592442563.db2.gz DMPLNEGDCTXZIR-JTQLQIEISA-N 1 2 221.291 2.267 20 0 BEADLO CCC[C@H](O)C[N@@H+](CC(F)F)C1CCC1 ZINC000887102134 592442565 /nfs/dbraw/zinc/44/25/65/592442565.db2.gz DMPLNEGDCTXZIR-JTQLQIEISA-N 1 2 221.291 2.267 20 0 BEADLO Nc1cc(CN(CC(F)F)C2CCC2)cc[nH+]1 ZINC000887102074 592443144 /nfs/dbraw/zinc/44/31/44/592443144.db2.gz ATHHHDQVFSQGGC-UHFFFAOYSA-N 1 2 241.285 2.283 20 0 BEADLO Cn1nccc1CC[N@H+](CC(F)F)C1CCC1 ZINC000887102664 592443585 /nfs/dbraw/zinc/44/35/85/592443585.db2.gz ZXBFCERIRKVTTN-UHFFFAOYSA-N 1 2 243.301 2.082 20 0 BEADLO Cn1nccc1CC[N@@H+](CC(F)F)C1CCC1 ZINC000887102664 592443589 /nfs/dbraw/zinc/44/35/89/592443589.db2.gz ZXBFCERIRKVTTN-UHFFFAOYSA-N 1 2 243.301 2.082 20 0 BEADLO Cc1ncc(CC(=O)Nc2ccc(C)[nH+]c2C)o1 ZINC000889465029 592612847 /nfs/dbraw/zinc/61/28/47/592612847.db2.gz VFBINOCDYFMVAJ-UHFFFAOYSA-N 1 2 245.282 2.176 20 0 BEADLO C[C@H](CC(=O)N[C@@H]1C[C@H]2CCC[C@@H]21)n1cc[nH+]c1 ZINC000889613348 592629773 /nfs/dbraw/zinc/62/97/73/592629773.db2.gz YSXCZWGAVKISDX-FVCCEPFGSA-N 1 2 247.342 2.139 20 0 BEADLO CCCC(C)(C)CC(=O)NCc1cn(C)c[nH+]1 ZINC000890108251 592682528 /nfs/dbraw/zinc/68/25/28/592682528.db2.gz WVFZRFGHGRACBT-UHFFFAOYSA-N 1 2 237.347 2.253 20 0 BEADLO Cn1c[nH+]c(CNC(=O)CC2(C)CCCCC2)c1 ZINC000890109371 592683363 /nfs/dbraw/zinc/68/33/63/592683363.db2.gz MIGVXTQZVFGFRT-UHFFFAOYSA-N 1 2 249.358 2.397 20 0 BEADLO CC(C)c1occc1C(=O)NCc1cn(C)c[nH+]1 ZINC000890108165 592683426 /nfs/dbraw/zinc/68/34/26/592683426.db2.gz UVDNAWFKGHJNOZ-UHFFFAOYSA-N 1 2 247.298 2.067 20 0 BEADLO CCC1(C(=O)NCc2cn(C)c[nH+]2)CCCC1 ZINC000890110076 592684632 /nfs/dbraw/zinc/68/46/32/592684632.db2.gz JTZAETUTFKLQTF-UHFFFAOYSA-N 1 2 235.331 2.007 20 0 BEADLO Cc1nc(C[NH2+]Cc2cncs2)cs1 ZINC000054788314 634553002 /nfs/dbraw/zinc/55/30/02/634553002.db2.gz VBOFIJGZWPIVSM-UHFFFAOYSA-N 1 2 225.342 2.198 20 0 BEADLO CC1(C)CCC[C@@H](CNC(=O)Cc2c[nH]c[nH+]2)C1 ZINC000909398716 634613391 /nfs/dbraw/zinc/61/33/91/634613391.db2.gz MYQLFWOUWSMMOX-LLVKDONJSA-N 1 2 249.358 2.285 20 0 BEADLO Oc1ccc(Br)c(C[NH2+]CCF)c1 ZINC000308406250 631324517 /nfs/dbraw/zinc/32/45/17/631324517.db2.gz MAADRHXUVSJXKG-UHFFFAOYSA-N 1 2 248.095 2.214 20 0 BEADLO Cc1nc(C)c(C[N@@H+](C)Cc2cccc(=O)[nH]2)o1 ZINC000933400339 631364642 /nfs/dbraw/zinc/36/46/42/631364642.db2.gz OYSDFQOOBWJPJL-UHFFFAOYSA-N 1 2 247.298 2.024 20 0 BEADLO Cc1nc(C)c(C[N@H+](C)Cc2cccc(=O)[nH]2)o1 ZINC000933400339 631364646 /nfs/dbraw/zinc/36/46/46/631364646.db2.gz OYSDFQOOBWJPJL-UHFFFAOYSA-N 1 2 247.298 2.024 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1ccc(OC)o1 ZINC000891476980 631373473 /nfs/dbraw/zinc/37/34/73/631373473.db2.gz WPOKTJDWUZZMAS-MNOVXSKESA-N 1 2 239.315 2.288 20 0 BEADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1ccc(OC)o1 ZINC000891476980 631373478 /nfs/dbraw/zinc/37/34/78/631373478.db2.gz WPOKTJDWUZZMAS-MNOVXSKESA-N 1 2 239.315 2.288 20 0 BEADLO CCC(C)(C)OCCNc1cc(NC)nc[nH+]1 ZINC000308533193 631421429 /nfs/dbraw/zinc/42/14/29/631421429.db2.gz CNKGLFIKBBNTDO-UHFFFAOYSA-N 1 2 238.335 2.135 20 0 BEADLO C[C@@H]1CCCN1C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000933815529 631515239 /nfs/dbraw/zinc/51/52/39/631515239.db2.gz WPUYIEZIUQIQHS-SECBINFHSA-N 1 2 229.283 2.187 20 0 BEADLO CCSCCCc1noc([C@@H](C)[NH+](C)C)n1 ZINC000924035131 635627866 /nfs/dbraw/zinc/62/78/66/635627866.db2.gz HKDSVQJTWYOBHH-SECBINFHSA-N 1 2 243.376 2.378 20 0 BEADLO CC[C@H]([NH2+]CCSC(C)(C)C)C(=O)OC ZINC000308900710 631723507 /nfs/dbraw/zinc/72/35/07/631723507.db2.gz BSLDELIWNKRKEF-VIFPVBQESA-N 1 2 233.377 2.059 20 0 BEADLO CC[C@@H]1CCN(C(=O)c2cc3c[nH+]ccc3[nH]2)C1 ZINC000934462535 631853756 /nfs/dbraw/zinc/85/37/56/631853756.db2.gz XIUCQFZZWITFBS-SNVBAGLBSA-N 1 2 243.310 2.435 20 0 BEADLO Cc1cc(F)ccc1C[N@@H+]1CC[C@H](O)[C@@H](F)C1 ZINC000934570626 631945570 /nfs/dbraw/zinc/94/55/70/631945570.db2.gz GAXDPVRTGGUGCE-STQMWFEESA-N 1 2 241.281 2.039 20 0 BEADLO Cc1cc(F)ccc1C[N@H+]1CC[C@H](O)[C@@H](F)C1 ZINC000934570626 631945573 /nfs/dbraw/zinc/94/55/73/631945573.db2.gz GAXDPVRTGGUGCE-STQMWFEESA-N 1 2 241.281 2.039 20 0 BEADLO C[C@H](c1cccc(F)c1)[N@@H+]1CC[C@@H](O)[C@H](F)C1 ZINC000934579094 631949162 /nfs/dbraw/zinc/94/91/62/631949162.db2.gz GRXQJDFPNWQPOX-OASPWFOLSA-N 1 2 241.281 2.291 20 0 BEADLO C[C@H](c1cccc(F)c1)[N@H+]1CC[C@@H](O)[C@H](F)C1 ZINC000934579094 631949165 /nfs/dbraw/zinc/94/91/65/631949165.db2.gz GRXQJDFPNWQPOX-OASPWFOLSA-N 1 2 241.281 2.291 20 0 BEADLO CCSCC[NH2+]C(C)(C)C(=O)OC(C)C ZINC000934818145 632092181 /nfs/dbraw/zinc/09/21/81/632092181.db2.gz SYLVPRFXUFISCB-UHFFFAOYSA-N 1 2 233.377 2.059 20 0 BEADLO CNc1cc(N[C@H](C)c2ccccn2)nc[nH+]1 ZINC000129290694 632424122 /nfs/dbraw/zinc/42/41/22/632424122.db2.gz DFSBTRVUHIZLIK-SECBINFHSA-N 1 2 229.287 2.086 20 0 BEADLO CNc1cc(N[C@H](C)c2ccccn2)[nH+]cn1 ZINC000129290694 632424127 /nfs/dbraw/zinc/42/41/27/632424127.db2.gz DFSBTRVUHIZLIK-SECBINFHSA-N 1 2 229.287 2.086 20 0 BEADLO C[C@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2F)c2ncnn21 ZINC000926586558 632594961 /nfs/dbraw/zinc/59/49/61/632594961.db2.gz CHSAKCCRMSAKNH-ZDCRXTMVSA-N 1 2 238.310 2.154 20 0 BEADLO c1nc(C[NH2+][C@@H]2CCCc3n[nH]cc32)cs1 ZINC000309712646 632655427 /nfs/dbraw/zinc/65/54/27/632655427.db2.gz XPRDELUPFKOQEL-SNVBAGLBSA-N 1 2 234.328 2.033 20 0 BEADLO CCCNc1cc(NCC[C@H](C)OC)nc[nH+]1 ZINC000310355852 632725634 /nfs/dbraw/zinc/72/56/34/632725634.db2.gz RVPNGJNJCKEDHR-JTQLQIEISA-N 1 2 238.335 2.135 20 0 BEADLO CCCNc1cc(NCC[C@H](C)OC)[nH+]cn1 ZINC000310355852 632725639 /nfs/dbraw/zinc/72/56/39/632725639.db2.gz RVPNGJNJCKEDHR-JTQLQIEISA-N 1 2 238.335 2.135 20 0 BEADLO CC[C@H]1COC[C@@H]1Nc1cc(COC)cc[nH+]1 ZINC000926660524 632786516 /nfs/dbraw/zinc/78/65/16/632786516.db2.gz JOTHTHYQBJCXJU-RYUDHWBXSA-N 1 2 236.315 2.065 20 0 BEADLO Fc1cc(F)cc(C[NH2+]Cc2ccon2)c1 ZINC000162836843 633040906 /nfs/dbraw/zinc/04/09/06/633040906.db2.gz IZUWGIMLRRKNLA-UHFFFAOYSA-N 1 2 224.210 2.243 20 0 BEADLO CC(C)n1cc([C@H](C)[NH2+]CC(C)(C)F)nn1 ZINC000926781696 633057957 /nfs/dbraw/zinc/05/79/57/633057957.db2.gz YBHRVBGLSWTUKH-VIFPVBQESA-N 1 2 228.315 2.258 20 0 BEADLO CC[NH2+]Cc1noc(CC(C)(C)CC)n1 ZINC000309622339 633215393 /nfs/dbraw/zinc/21/53/93/633215393.db2.gz HXKZHFRCDXXUKY-UHFFFAOYSA-N 1 2 211.309 2.158 20 0 BEADLO CC[NH2+]Cc1noc([C@H]2CC=CCC2)n1 ZINC000309637757 633214482 /nfs/dbraw/zinc/21/44/82/633214482.db2.gz NHVQFOOGYOLRRA-VIFPVBQESA-N 1 2 207.277 2.003 20 0 BEADLO C[C@H](NC(=O)Cc1c[nH]c[nH+]1)[C@@H]1CCC[C@H](C)C1 ZINC000909412331 635956144 /nfs/dbraw/zinc/95/61/44/635956144.db2.gz AZNGDBSQLCJHJI-SDDRHHMPSA-N 1 2 249.358 2.283 20 0 BEADLO Cn1cnn(C[NH+]2CCC(C)(C)CC2)c1=S ZINC000726965026 636024624 /nfs/dbraw/zinc/02/46/24/636024624.db2.gz QAICRGGLBGVRBF-UHFFFAOYSA-N 1 2 240.376 2.031 20 0 BEADLO COC[C@H](C)[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000237241864 636084120 /nfs/dbraw/zinc/08/41/20/636084120.db2.gz KRKXZENLQVRHPF-DTWKUNHWSA-N 1 2 241.335 2.053 20 0 BEADLO C[N@@H+](C/C(Cl)=C\Cl)C[C@@H](O)C1CC1 ZINC000308500079 633735274 /nfs/dbraw/zinc/73/52/74/633735274.db2.gz WHBGRCGZNXTSPX-VGANXODHSA-N 1 2 224.131 2.008 20 0 BEADLO C[N@H+](C/C(Cl)=C\Cl)C[C@@H](O)C1CC1 ZINC000308500079 633735279 /nfs/dbraw/zinc/73/52/79/633735279.db2.gz WHBGRCGZNXTSPX-VGANXODHSA-N 1 2 224.131 2.008 20 0 BEADLO CC[C@@H]1CC[C@H](C)N1c1nccn2c[nH+]cc12 ZINC000893091354 633828664 /nfs/dbraw/zinc/82/86/64/633828664.db2.gz AFRJJUDBSHSMTF-WDEREUQCSA-N 1 2 230.315 2.497 20 0 BEADLO COC(=O)[C@H]([NH2+]CCSC(C)(C)C)C1CC1 ZINC000309588714 633960589 /nfs/dbraw/zinc/96/05/89/633960589.db2.gz TYDAADWGWSEEMA-SNVBAGLBSA-N 1 2 245.388 2.059 20 0 BEADLO CC[NH2+]Cc1noc(CC(CC)CC)n1 ZINC000309630806 633978768 /nfs/dbraw/zinc/97/87/68/633978768.db2.gz KJIZPSIKTHNAIB-UHFFFAOYSA-N 1 2 211.309 2.158 20 0 BEADLO O=C1c2cc(F)ccc2CN1C[NH+]1CCCCC1 ZINC000092879886 634314002 /nfs/dbraw/zinc/31/40/02/634314002.db2.gz AKJARQQPDISDCM-UHFFFAOYSA-N 1 2 248.301 2.225 20 0 BEADLO Cc1ccc(C[NH2+][C@H](C)c2cnccn2)nc1C ZINC000314346306 635170410 /nfs/dbraw/zinc/17/04/10/635170410.db2.gz VPTFPEQYEGWSMB-GFCCVEGCSA-N 1 2 242.326 2.339 20 0 BEADLO COCC1C[NH+](Cc2cnc(Cl)c(C)c2)C1 ZINC000895970285 636184981 /nfs/dbraw/zinc/18/49/81/636184981.db2.gz FKMBPLQQMLSZMS-UHFFFAOYSA-N 1 2 240.734 2.122 20 0 BEADLO CN(C)c1cc(NC[C@]23C[C@H]2CCC3)[nH+]cn1 ZINC000896545873 636202404 /nfs/dbraw/zinc/20/24/04/636202404.db2.gz QSYBIWCLASAOBS-MFKMUULPSA-N 1 2 232.331 2.145 20 0 BEADLO CN(C)c1cc(NC[C@]23C[C@H]2CCC3)nc[nH+]1 ZINC000896545873 636202408 /nfs/dbraw/zinc/20/24/08/636202408.db2.gz QSYBIWCLASAOBS-MFKMUULPSA-N 1 2 232.331 2.145 20 0 BEADLO Cc1[nH]c(CNC(=O)[C@@H]2CC[C@@H](C)C2)[nH+]c1C ZINC000896913278 636254538 /nfs/dbraw/zinc/25/45/38/636254538.db2.gz QASYSNRRJCSNAX-LDYMZIIASA-N 1 2 235.331 2.079 20 0 BEADLO CC(C)(CNC(=O)[C@@H]1CCC1(C)C)n1cc[nH+]c1 ZINC000898910559 637063007 /nfs/dbraw/zinc/06/30/07/637063007.db2.gz SPFSOVXHLXKDQJ-NSHDSACASA-N 1 2 249.358 2.171 20 0 BEADLO CCn1nc(C)c([C@@H](C)[NH2+]Cc2ccoc2)n1 ZINC000924747000 637071025 /nfs/dbraw/zinc/07/10/25/637071025.db2.gz HTPCRBWFRQNZGC-SECBINFHSA-N 1 2 234.303 2.050 20 0 BEADLO CC1(C)CCC(NC(=O)Cc2c[nH]c[nH+]2)CC1 ZINC000900828148 637194507 /nfs/dbraw/zinc/19/45/07/637194507.db2.gz KDZXNYDMCLRROW-UHFFFAOYSA-N 1 2 235.331 2.037 20 0 BEADLO C[C@@H]1CC[C@H](C)CN1C(=O)CNc1cccc[nH+]1 ZINC000900903422 637196885 /nfs/dbraw/zinc/19/68/85/637196885.db2.gz HWASMPOUHXZRRR-NWDGAFQWSA-N 1 2 247.342 2.141 20 0 BEADLO C[C@H]([NH2+]C1(c2ccccc2)CC1)c1cn(C)nn1 ZINC000902912783 637338576 /nfs/dbraw/zinc/33/85/76/637338576.db2.gz VYHSTDOXYNCQAL-NSHDSACASA-N 1 2 242.326 2.155 20 0 BEADLO CC[C@@H](C)C(=O)N1CCC[C@H](c2[nH+]ccn2C)C1 ZINC000347416139 637378146 /nfs/dbraw/zinc/37/81/46/637378146.db2.gz IYGUADNSJDDDOV-NEPJUHHUSA-N 1 2 249.358 2.172 20 0 BEADLO Cc1[nH+]c(N)ccc1-c1noc([C@@H]2CC23CC3)n1 ZINC000904262486 637392725 /nfs/dbraw/zinc/39/27/25/637392725.db2.gz HBJASOJYSNLXQS-VIFPVBQESA-N 1 2 242.282 2.290 20 0 BEADLO Cc1[nH+]c(N)ccc1-c1noc([C@H]2CC23CC3)n1 ZINC000904262485 637393070 /nfs/dbraw/zinc/39/30/70/637393070.db2.gz HBJASOJYSNLXQS-SECBINFHSA-N 1 2 242.282 2.290 20 0 BEADLO C/C=C(/C)c1nc(-c2c[nH+]c(N)cc2C)no1 ZINC000904269205 637395127 /nfs/dbraw/zinc/39/51/27/637395127.db2.gz XRMJHTLWUWULPC-DAXSKMNVSA-N 1 2 230.271 2.445 20 0 BEADLO CC[NH2+]Cc1noc([C@H]2CC[C@@H]3C[C@@H]3CC2)n1 ZINC000904494291 637423204 /nfs/dbraw/zinc/42/32/04/637423204.db2.gz JKCWOBMVHSUBAZ-JGPRNRPPSA-N 1 2 235.331 2.473 20 0 BEADLO Cc1[nH]cc(-c2cnn(C(F)(F)F)c2)[nH+]1 ZINC000904866029 637513657 /nfs/dbraw/zinc/51/36/57/637513657.db2.gz CWUOMGQKWJJHPE-UHFFFAOYSA-N 1 2 216.166 2.058 20 0 BEADLO CCN1C(=O)C(C)(C)[NH2+]C12C[C@@H]1CCC[C@H]1C2 ZINC000905026386 637575302 /nfs/dbraw/zinc/57/53/02/637575302.db2.gz CNWQJKMWFFHWQA-QWRGUYRKSA-N 1 2 236.359 2.123 20 0 BEADLO CCn1c[nH+]cc1/C=C(/C)c1ncccn1 ZINC000905077779 637580022 /nfs/dbraw/zinc/58/00/22/637580022.db2.gz DXGJRTQFTYKKLO-YFHOEESVSA-N 1 2 214.272 2.254 20 0 BEADLO C/C(=C\c1[nH]c(C)c(C)[nH+]1)c1ncccn1 ZINC000905076838 637606398 /nfs/dbraw/zinc/60/63/98/637606398.db2.gz LPCXGSOEHHMNHG-BQYQJAHWSA-N 1 2 214.272 2.377 20 0 BEADLO O=C(NCCn1cc[nH+]c1)[C@H]1CCC=CCCC1 ZINC000906130022 638056675 /nfs/dbraw/zinc/05/66/75/638056675.db2.gz KHDLPXHTRQVFNL-ZDUSSCGKSA-N 1 2 247.342 2.136 20 0 BEADLO Cc1cc(C)c(C(=O)N[C@@H](C)C(F)F)c(C)[nH+]1 ZINC000906135410 638071969 /nfs/dbraw/zinc/07/19/69/638071969.db2.gz YELDOMMWKJZDCS-VIFPVBQESA-N 1 2 242.269 2.390 20 0 BEADLO Cc1[nH]cc(-c2ccc([C@@H]3CCC(=O)N3)cc2)[nH+]1 ZINC000906204342 638106965 /nfs/dbraw/zinc/10/69/65/638106965.db2.gz IODHSVBJPQBIKJ-LBPRGKRZSA-N 1 2 241.294 2.336 20 0 BEADLO CC1=C(C)C[N@H+](Cc2cn(C3CC3)nn2)CC1 ZINC000906298170 638136482 /nfs/dbraw/zinc/13/64/82/638136482.db2.gz BSTHQFAPOSOYOD-UHFFFAOYSA-N 1 2 232.331 2.155 20 0 BEADLO CC1=C(C)C[N@@H+](Cc2cn(C3CC3)nn2)CC1 ZINC000906298170 638136486 /nfs/dbraw/zinc/13/64/86/638136486.db2.gz BSTHQFAPOSOYOD-UHFFFAOYSA-N 1 2 232.331 2.155 20 0 BEADLO COc1ncccc1-c1c[nH+]c2c(c1)CCCN2 ZINC000906538954 638205500 /nfs/dbraw/zinc/20/55/00/638205500.db2.gz NZZOHXJILOQBDL-UHFFFAOYSA-N 1 2 241.294 2.153 20 0 BEADLO C[C@H]1C[N@@H+]([C@@H]2C[C@@H]2c2cccc(F)c2)CCO1 ZINC000906590411 638213693 /nfs/dbraw/zinc/21/36/93/638213693.db2.gz QJECXBIHOVIFMF-ZLKJLUDKSA-N 1 2 235.302 2.402 20 0 BEADLO C[C@H]1C[N@H+]([C@@H]2C[C@@H]2c2cccc(F)c2)CCO1 ZINC000906590411 638213696 /nfs/dbraw/zinc/21/36/96/638213696.db2.gz QJECXBIHOVIFMF-ZLKJLUDKSA-N 1 2 235.302 2.402 20 0 BEADLO Cc1[nH]c(CNC(=O)C2(C3CC3)CCC2)[nH+]c1C ZINC000906946587 638282477 /nfs/dbraw/zinc/28/24/77/638282477.db2.gz WMWIPKFUHIUWKL-UHFFFAOYSA-N 1 2 247.342 2.223 20 0 BEADLO CC(C)C(C)(C)CNC(=O)CNc1cccc[nH+]1 ZINC000907611626 638416917 /nfs/dbraw/zinc/41/69/17/638416917.db2.gz NWIKOADAAJAIHZ-UHFFFAOYSA-N 1 2 249.358 2.292 20 0 BEADLO C[C@@H](C1CCCCC1)N(C)C(=O)Cc1c[nH+]c[nH]1 ZINC000907796731 638475184 /nfs/dbraw/zinc/47/51/84/638475184.db2.gz GFRDJHRYGCYKJT-NSHDSACASA-N 1 2 249.358 2.379 20 0 BEADLO Cc1cc(C)c(C(=O)N2CC(C)(C)C2)c(C)[nH+]1 ZINC000907843193 638495112 /nfs/dbraw/zinc/49/51/12/638495112.db2.gz DFRLSESTHNZFPB-UHFFFAOYSA-N 1 2 232.327 2.489 20 0 BEADLO C[C@H]1CC[C@H](CNC(=O)CNc2cccc[nH+]2)C1 ZINC000907914089 638511270 /nfs/dbraw/zinc/51/12/70/638511270.db2.gz SRSIKUQILRRYLF-RYUDHWBXSA-N 1 2 247.342 2.046 20 0 BEADLO CC(C)C[C@]1(C)CCCN1C(=O)Cc1c[nH+]c[nH]1 ZINC000908555557 639012136 /nfs/dbraw/zinc/01/21/36/639012136.db2.gz GOVAISOPXQYDNR-AWEZNQCLSA-N 1 2 249.358 2.379 20 0 BEADLO CCC[C@@H](NC(=O)Cc1c[nH]c[nH+]1)C(C)(C)C ZINC000908686458 639045099 /nfs/dbraw/zinc/04/50/99/639045099.db2.gz ASUFSLZCZGCHOR-LLVKDONJSA-N 1 2 237.347 2.283 20 0 BEADLO CC(C)(NC(=O)CNc1cccc[nH+]1)C1CCC1 ZINC000908999051 639118105 /nfs/dbraw/zinc/11/81/05/639118105.db2.gz WNGMZGYPEVXBPT-UHFFFAOYSA-N 1 2 247.342 2.188 20 0 BEADLO CCC[C@H](NC(=O)Cc1c[nH]c[nH+]1)C1CCC1 ZINC000909930693 639281822 /nfs/dbraw/zinc/28/18/22/639281822.db2.gz UBGSOUQMSDUHJY-LBPRGKRZSA-N 1 2 235.331 2.037 20 0 BEADLO Cn1c[nH+]cc1CCOC(=O)CCC1(C)CC1 ZINC000910037405 639345804 /nfs/dbraw/zinc/34/58/04/639345804.db2.gz BMDGGRPOCMXSIH-UHFFFAOYSA-N 1 2 236.315 2.086 20 0 BEADLO C[C@@H]1CC[N@H+](Cc2cnn(CCF)c2)C[C@@H]1F ZINC000930243553 639652452 /nfs/dbraw/zinc/65/24/52/639652452.db2.gz GGOAIOZPPMZWEX-PWSUYJOCSA-N 1 2 243.301 2.033 20 0 BEADLO C[C@@H]1CC[N@@H+](Cc2cnn(CCF)c2)C[C@@H]1F ZINC000930243553 639652458 /nfs/dbraw/zinc/65/24/58/639652458.db2.gz GGOAIOZPPMZWEX-PWSUYJOCSA-N 1 2 243.301 2.033 20 0 BEADLO CC(F)(F)CCC[N@@H+]1CCO[C@H](C(F)F)C1 ZINC000930341860 639716045 /nfs/dbraw/zinc/71/60/45/639716045.db2.gz FVFMZWAKZPEMPP-QMMMGPOBSA-N 1 2 243.244 2.388 20 0 BEADLO CC(F)(F)CCC[N@H+]1CCO[C@H](C(F)F)C1 ZINC000930341860 639716048 /nfs/dbraw/zinc/71/60/48/639716048.db2.gz FVFMZWAKZPEMPP-QMMMGPOBSA-N 1 2 243.244 2.388 20 0 BEADLO COCC(C)(C)[N@H+](C)Cc1c(F)cncc1F ZINC000930554038 639810243 /nfs/dbraw/zinc/81/02/43/639810243.db2.gz FSKYGBAGIRTFFZ-UHFFFAOYSA-N 1 2 244.285 2.217 20 0 BEADLO COCC(C)(C)[N@@H+](C)Cc1c(F)cncc1F ZINC000930554038 639810244 /nfs/dbraw/zinc/81/02/44/639810244.db2.gz FSKYGBAGIRTFFZ-UHFFFAOYSA-N 1 2 244.285 2.217 20 0 BEADLO C[C@H](O)C[N@H+](CCCC(C)(F)F)CC(F)F ZINC000930653526 639828977 /nfs/dbraw/zinc/82/89/77/639828977.db2.gz ACAOSBPGSSEVGN-QMMMGPOBSA-N 1 2 245.260 2.370 20 0 BEADLO C[C@H](O)C[N@@H+](CCCC(C)(F)F)CC(F)F ZINC000930653526 639828982 /nfs/dbraw/zinc/82/89/82/639828982.db2.gz ACAOSBPGSSEVGN-QMMMGPOBSA-N 1 2 245.260 2.370 20 0 BEADLO CC[C@H](C)N(CC)C(=O)CNc1cccc[nH+]1 ZINC000912277477 640020988 /nfs/dbraw/zinc/02/09/88/640020988.db2.gz BTIQTBULZKQDSJ-NSHDSACASA-N 1 2 235.331 2.141 20 0 BEADLO CC[C@@H](NC(=O)C(C)(C)n1c[nH+]c(C)c1)C1CC1 ZINC000912514712 640104288 /nfs/dbraw/zinc/10/42/88/640104288.db2.gz JEHSIAJAJOBMKZ-GFCCVEGCSA-N 1 2 249.358 2.231 20 0 BEADLO CC(C)(C)/C=C\C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC000912615018 640136520 /nfs/dbraw/zinc/13/65/20/640136520.db2.gz HVIACOLZVWSEDF-SREVYHEPSA-N 1 2 249.358 2.337 20 0 BEADLO CCC(=O)Oc1ccc(-n2cc[nH+]c2)cc1 ZINC000912668625 640158089 /nfs/dbraw/zinc/15/80/89/640158089.db2.gz UKYZJHQCQIJFEW-UHFFFAOYSA-N 1 2 216.240 2.188 20 0 BEADLO Cc1[nH]ncc1C[N@H+](C)CCCc1cccnc1 ZINC000931416128 640187484 /nfs/dbraw/zinc/18/74/84/640187484.db2.gz QTVKGSNBAFRLID-UHFFFAOYSA-N 1 2 244.342 2.178 20 0 BEADLO Cc1[nH]ncc1C[N@@H+](C)CCCc1cccnc1 ZINC000931416128 640187492 /nfs/dbraw/zinc/18/74/92/640187492.db2.gz QTVKGSNBAFRLID-UHFFFAOYSA-N 1 2 244.342 2.178 20 0 BEADLO Cc1ncc(C[N@@H+]2Cc3c[nH]nc3[C@H](C)C2)s1 ZINC000931458877 640217086 /nfs/dbraw/zinc/21/70/86/640217086.db2.gz KGUUVOVFSCDKCK-MRVPVSSYSA-N 1 2 248.355 2.294 20 0 BEADLO Cc1ncc(C[N@H+]2Cc3c[nH]nc3[C@H](C)C2)s1 ZINC000931458877 640217094 /nfs/dbraw/zinc/21/70/94/640217094.db2.gz KGUUVOVFSCDKCK-MRVPVSSYSA-N 1 2 248.355 2.294 20 0 BEADLO CCC(F)(F)C[N@H+]1Cc2c[nH]nc2[C@H](C)C1 ZINC000931467162 640225757 /nfs/dbraw/zinc/22/57/57/640225757.db2.gz MUSBLWWQRMUEBK-MRVPVSSYSA-N 1 2 229.274 2.374 20 0 BEADLO CCC(F)(F)C[N@@H+]1Cc2c[nH]nc2[C@H](C)C1 ZINC000931467162 640225764 /nfs/dbraw/zinc/22/57/64/640225764.db2.gz MUSBLWWQRMUEBK-MRVPVSSYSA-N 1 2 229.274 2.374 20 0 BEADLO CC(C)c1nsc(C[N@@H+]2C[C@@H]3C[C@@H]3C2)n1 ZINC000931710388 640332030 /nfs/dbraw/zinc/33/20/30/640332030.db2.gz QOCOQWWTHBQJGA-DTORHVGOSA-N 1 2 223.345 2.113 20 0 BEADLO CC(C)c1nsc(C[N@H+]2C[C@@H]3C[C@@H]3C2)n1 ZINC000931710388 640332032 /nfs/dbraw/zinc/33/20/32/640332032.db2.gz QOCOQWWTHBQJGA-DTORHVGOSA-N 1 2 223.345 2.113 20 0 BEADLO C[C@H]1CCC[C@@H]1NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000932058647 640419705 /nfs/dbraw/zinc/41/97/05/640419705.db2.gz RAYCRBHXYDZODI-ONGXEEELSA-N 1 2 243.310 2.481 20 0 BEADLO Cc1cc(C[N@H+]2CCC[C@H]2c2ccnn2C)on1 ZINC000932265736 640464904 /nfs/dbraw/zinc/46/49/04/640464904.db2.gz RVNRMRRHFBPKPW-ZDUSSCGKSA-N 1 2 246.314 2.054 20 0 BEADLO Cc1cc(C[N@@H+]2CCC[C@H]2c2ccnn2C)on1 ZINC000932265736 640464909 /nfs/dbraw/zinc/46/49/09/640464909.db2.gz RVNRMRRHFBPKPW-ZDUSSCGKSA-N 1 2 246.314 2.054 20 0 BEADLO CC[C@H]([NH2+]Cc1c[nH]cn1)c1ccncc1 ZINC000164690203 640499041 /nfs/dbraw/zinc/49/90/41/640499041.db2.gz ZTWVYNHJIIIHBM-LBPRGKRZSA-N 1 2 216.288 2.046 20 0 BEADLO CNc1cc(N(C)CCc2cccs2)nc[nH+]1 ZINC000156904151 640516034 /nfs/dbraw/zinc/51/60/34/640516034.db2.gz LANWBPQKGZRJMW-UHFFFAOYSA-N 1 2 248.355 2.259 20 0 BEADLO CNc1cc(N(C)CCc2cccs2)[nH+]cn1 ZINC000156904151 640516041 /nfs/dbraw/zinc/51/60/41/640516041.db2.gz LANWBPQKGZRJMW-UHFFFAOYSA-N 1 2 248.355 2.259 20 0 BEADLO CCN(CC1CC1)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000932590465 640580328 /nfs/dbraw/zinc/58/03/28/640580328.db2.gz MZWOGPUKIKAYJK-UHFFFAOYSA-N 1 2 243.310 2.435 20 0 BEADLO CC[C@@H](C[N@@H+]1CCn2nc(C3CC3)cc2C1)OC ZINC000932601777 640582413 /nfs/dbraw/zinc/58/24/13/640582413.db2.gz CVTSBVMIFAOKTN-ZDUSSCGKSA-N 1 2 249.358 2.001 20 0 BEADLO CC[C@@H](C[N@H+]1CCn2nc(C3CC3)cc2C1)OC ZINC000932601777 640582418 /nfs/dbraw/zinc/58/24/18/640582418.db2.gz CVTSBVMIFAOKTN-ZDUSSCGKSA-N 1 2 249.358 2.001 20 0 BEADLO CC[C@H](C[N@@H+]1CCn2nc(C3CC3)cc2C1)OC ZINC000932601776 640583267 /nfs/dbraw/zinc/58/32/67/640583267.db2.gz CVTSBVMIFAOKTN-CYBMUJFWSA-N 1 2 249.358 2.001 20 0 BEADLO CC[C@H](C[N@H+]1CCn2nc(C3CC3)cc2C1)OC ZINC000932601776 640583272 /nfs/dbraw/zinc/58/32/72/640583272.db2.gz CVTSBVMIFAOKTN-CYBMUJFWSA-N 1 2 249.358 2.001 20 0 BEADLO Cc1cc(NC(=O)C2(C)CC=CC2)cc[nH+]1 ZINC000932606724 640583713 /nfs/dbraw/zinc/58/37/13/640583713.db2.gz MQEBLIAXPCOWNI-UHFFFAOYSA-N 1 2 216.284 2.107 20 0 BEADLO C[C@H]1C(=O)CCC[N@H+]1CCc1cccs1 ZINC000932858190 640627012 /nfs/dbraw/zinc/62/70/12/640627012.db2.gz CDYMQTCZXUOGPR-JTQLQIEISA-N 1 2 223.341 2.344 20 0 BEADLO C[C@H]1C(=O)CCC[N@@H+]1CCc1cccs1 ZINC000932858190 640627016 /nfs/dbraw/zinc/62/70/16/640627016.db2.gz CDYMQTCZXUOGPR-JTQLQIEISA-N 1 2 223.341 2.344 20 0 BEADLO CO[C@@H](C[N@@H+]1CC(=O)CC[C@H]1C)C1CCCC1 ZINC000932875593 640634931 /nfs/dbraw/zinc/63/49/31/640634931.db2.gz ANIAWHOXGOLXIX-RISCZKNCSA-N 1 2 239.359 2.245 20 0 BEADLO CO[C@@H](C[N@H+]1CC(=O)CC[C@H]1C)C1CCCC1 ZINC000932875593 640634935 /nfs/dbraw/zinc/63/49/35/640634935.db2.gz ANIAWHOXGOLXIX-RISCZKNCSA-N 1 2 239.359 2.245 20 0 BEADLO CO[C@H](C[N@@H+]1CC(=O)CC[C@@H]1C)C1CCCC1 ZINC000932875594 640635021 /nfs/dbraw/zinc/63/50/21/640635021.db2.gz ANIAWHOXGOLXIX-SMDDNHRTSA-N 1 2 239.359 2.245 20 0 BEADLO CO[C@H](C[N@H+]1CC(=O)CC[C@@H]1C)C1CCCC1 ZINC000932875594 640635025 /nfs/dbraw/zinc/63/50/25/640635025.db2.gz ANIAWHOXGOLXIX-SMDDNHRTSA-N 1 2 239.359 2.245 20 0 BEADLO CCn1cnc2c1CC[N@H+](Cc1ccccc1)C2 ZINC000933264658 640692080 /nfs/dbraw/zinc/69/20/80/640692080.db2.gz YMFTWIFULNLWGZ-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO CCn1cnc2c1CC[N@@H+](Cc1ccccc1)C2 ZINC000933264658 640692085 /nfs/dbraw/zinc/69/20/85/640692085.db2.gz YMFTWIFULNLWGZ-UHFFFAOYSA-N 1 2 241.338 2.461 20 0 BEADLO c1cn(CCSCCC[C@@H]2CCOC2)c[nH+]1 ZINC000592458334 640711164 /nfs/dbraw/zinc/71/11/64/640711164.db2.gz LAMCJNKYRCYHAA-GFCCVEGCSA-N 1 2 240.372 2.433 20 0 BEADLO CCn1cncc1C[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000669550995 640806565 /nfs/dbraw/zinc/80/65/65/640806565.db2.gz JYYGGWXTQRKPLC-ZYHUDNBSSA-N 1 2 225.311 2.083 20 0 BEADLO CCn1cncc1C[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000669550995 640806568 /nfs/dbraw/zinc/80/65/68/640806568.db2.gz JYYGGWXTQRKPLC-ZYHUDNBSSA-N 1 2 225.311 2.083 20 0 BEADLO Cc1ccc2sc(C[N@@H+]3CC[C@@H]3CO)nc2c1 ZINC000934011653 640808479 /nfs/dbraw/zinc/80/84/79/640808479.db2.gz MESGYNLUDRKWTL-SNVBAGLBSA-N 1 2 248.351 2.171 20 0 BEADLO Cc1ccc2sc(C[N@H+]3CC[C@@H]3CO)nc2c1 ZINC000934011653 640808482 /nfs/dbraw/zinc/80/84/82/640808482.db2.gz MESGYNLUDRKWTL-SNVBAGLBSA-N 1 2 248.351 2.171 20 0 BEADLO Cc1ccc(NC2CCS(=O)CC2)c(C)[nH+]1 ZINC000087151650 640852293 /nfs/dbraw/zinc/85/22/93/640852293.db2.gz ZDZSPIZKYKBXGT-UHFFFAOYSA-N 1 2 238.356 2.021 20 0 BEADLO CC[NH+]1CC(NC(=O)C2CCCCCCC2)C1 ZINC001030655264 641061315 /nfs/dbraw/zinc/06/13/15/641061315.db2.gz QSOIOYKOQQWWJY-UHFFFAOYSA-N 1 2 238.375 2.167 20 0 BEADLO CO[C@H]1CC[C@@H]1[N@H+](C)Cc1ncc(C2CC2)o1 ZINC000934114639 641081419 /nfs/dbraw/zinc/08/14/19/641081419.db2.gz KTEOGPOZBKRJTO-QWRGUYRKSA-N 1 2 236.315 2.161 20 0 BEADLO CO[C@H]1CC[C@@H]1[N@@H+](C)Cc1ncc(C2CC2)o1 ZINC000934114639 641081422 /nfs/dbraw/zinc/08/14/22/641081422.db2.gz KTEOGPOZBKRJTO-QWRGUYRKSA-N 1 2 236.315 2.161 20 0 BEADLO C[C@H]1SCC[N@H+](Cn2cc[nH]c2=S)[C@@H]1C ZINC000173351551 641173035 /nfs/dbraw/zinc/17/30/35/641173035.db2.gz ZJWIGUAVCRLCCL-RKDXNWHRSA-N 1 2 243.401 2.329 20 0 BEADLO C[C@H]1SCC[N@@H+](Cn2cc[nH]c2=S)[C@@H]1C ZINC000173351551 641173041 /nfs/dbraw/zinc/17/30/41/641173041.db2.gz ZJWIGUAVCRLCCL-RKDXNWHRSA-N 1 2 243.401 2.329 20 0 BEADLO c1nsnc1C[NH+]1CCc2ccccc2CC1 ZINC000846809748 641175341 /nfs/dbraw/zinc/17/53/41/641175341.db2.gz VUABWZZNWULXOI-UHFFFAOYSA-N 1 2 245.351 2.139 20 0 BEADLO CCCCOC(=O)C[NH2+]C(C)(C)CSC ZINC000934676120 641244534 /nfs/dbraw/zinc/24/45/34/641244534.db2.gz JIIIYTMDYQLNSD-UHFFFAOYSA-N 1 2 233.377 2.061 20 0 BEADLO CCCCOC(=O)[C@@H](C)[NH2+]C(C)(C)CSC ZINC000934676198 641244592 /nfs/dbraw/zinc/24/45/92/641244592.db2.gz TWDVJFHJXQAMCB-SNVBAGLBSA-N 1 2 247.404 2.449 20 0 BEADLO CSCCC[NH2+]C(C)(C)C(=O)OC(C)C ZINC000934818203 641278860 /nfs/dbraw/zinc/27/88/60/641278860.db2.gz WLWCZVMWTBBXGX-UHFFFAOYSA-N 1 2 233.377 2.059 20 0 BEADLO CCc1ncc(C[N@@H+]2C[C@H](C)O[C@@H](CC)C2)o1 ZINC000929620151 641377747 /nfs/dbraw/zinc/37/77/47/641377747.db2.gz OBVJVJZVZRIMJL-QWRGUYRKSA-N 1 2 238.331 2.236 20 0 BEADLO CCc1ncc(C[N@H+]2C[C@H](C)O[C@@H](CC)C2)o1 ZINC000929620151 641377752 /nfs/dbraw/zinc/37/77/52/641377752.db2.gz OBVJVJZVZRIMJL-QWRGUYRKSA-N 1 2 238.331 2.236 20 0 BEADLO CC1(C)CC[C@H]1NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000935975702 641511776 /nfs/dbraw/zinc/51/17/76/641511776.db2.gz XLGWCTWNWRKUNB-GFCCVEGCSA-N 1 2 243.310 2.481 20 0 BEADLO CNc1cc(N[C@@H](C)c2nc(C)cs2)nc[nH+]1 ZINC000156174880 641599383 /nfs/dbraw/zinc/59/93/83/641599383.db2.gz TUAJHUOGEYFJQA-QMMMGPOBSA-N 1 2 249.343 2.456 20 0 BEADLO CNc1cc(N[C@@H](C)c2nc(C)cs2)[nH+]cn1 ZINC000156174880 641599386 /nfs/dbraw/zinc/59/93/86/641599386.db2.gz TUAJHUOGEYFJQA-QMMMGPOBSA-N 1 2 249.343 2.456 20 0 BEADLO Cc1ccc(NC(=O)[C@@H]2C[C@H]2C)c(N(C)C)[nH+]1 ZINC000152592786 641621057 /nfs/dbraw/zinc/62/10/57/641621057.db2.gz PCVSXBJUOOCOSA-PSASIEDQSA-N 1 2 233.315 2.051 20 0 BEADLO Cc1ccc(NC(=O)[C@H]2C[C@@H]2C)c(N(C)C)[nH+]1 ZINC000152592684 641621721 /nfs/dbraw/zinc/62/17/21/641621721.db2.gz PCVSXBJUOOCOSA-WPRPVWTQSA-N 1 2 233.315 2.051 20 0 BEADLO Cc1ccc(NC(=O)CC(C)C)c(N(C)C)[nH+]1 ZINC000152650801 641625600 /nfs/dbraw/zinc/62/56/00/641625600.db2.gz PNVXTKODNVZJFE-UHFFFAOYSA-N 1 2 235.331 2.441 20 0 BEADLO CCC[C@@H](OC)c1noc([C@H](C)[NH+](C)C)n1 ZINC000351136617 641681471 /nfs/dbraw/zinc/68/14/71/641681471.db2.gz TVSSZYVCHDQVNR-DTWKUNHWSA-N 1 2 227.308 2.180 20 0 BEADLO C[C@@H]([N@H+](C)Cn1ncn(C)c1=S)C(C)(C)C ZINC000914569203 641737342 /nfs/dbraw/zinc/73/73/42/641737342.db2.gz UUXPWCBTJUGODH-SECBINFHSA-N 1 2 242.392 2.275 20 0 BEADLO C[C@@H]([N@@H+](C)Cn1ncn(C)c1=S)C(C)(C)C ZINC000914569203 641737346 /nfs/dbraw/zinc/73/73/46/641737346.db2.gz UUXPWCBTJUGODH-SECBINFHSA-N 1 2 242.392 2.275 20 0 BEADLO CC[C@@H]1CCCC[C@H]1C(=O)NC1C[NH+](CC)C1 ZINC001031173186 641772242 /nfs/dbraw/zinc/77/22/42/641772242.db2.gz SCCWRMZREVLAOA-DGCLKSJQSA-N 1 2 238.375 2.023 20 0 BEADLO CCCC=CC(=O)Nc1cc[nH+]c(C)c1 ZINC000732765201 641866904 /nfs/dbraw/zinc/86/69/04/641866904.db2.gz DMJVNDOEBZMNMH-WAYWQWQTSA-N 1 2 204.273 2.107 20 0 BEADLO CCCC=CC(=O)Nc1cc[nH+]c(C)c1 ZINC000732765199 641868060 /nfs/dbraw/zinc/86/80/60/641868060.db2.gz DMJVNDOEBZMNMH-AATRIKPKSA-N 1 2 204.273 2.107 20 0 BEADLO CCCC(C)=CC(=O)Nc1cc[nH+]c(C)c1 ZINC000732766078 641869278 /nfs/dbraw/zinc/86/92/78/641869278.db2.gz NHDOQSRIYABTIB-CSKARUKUSA-N 1 2 218.300 2.497 20 0 BEADLO Cc1cc(N)nc(S[C@H](C)c2ncccn2)[nH+]1 ZINC000916177021 641916109 /nfs/dbraw/zinc/91/61/09/641916109.db2.gz QARUVXPPFYWXAC-MRVPVSSYSA-N 1 2 247.327 2.011 20 0 BEADLO CS[C@@H]1CC[C@H](Nc2cc[nH+]c(C)n2)C1 ZINC000078477658 641927025 /nfs/dbraw/zinc/92/70/25/641927025.db2.gz DWYAZYBNPNICAD-VHSXEESVSA-N 1 2 223.345 2.481 20 0 BEADLO COc1cccc(Cn2cc[nH+]c2)c1C ZINC000917359386 642050030 /nfs/dbraw/zinc/05/00/30/642050030.db2.gz PYCMQFKATQJYKR-UHFFFAOYSA-N 1 2 202.257 2.248 20 0 BEADLO COCCn1c[nH+]c(Cc2ccccc2)c1 ZINC000919135243 642300857 /nfs/dbraw/zinc/30/08/57/642300857.db2.gz CHFVMJUCMKOPCJ-UHFFFAOYSA-N 1 2 216.284 2.120 20 0 BEADLO c1ncc(C[N@H+]2CCOC[C@@H]2CC2CC2)s1 ZINC000933216081 642394804 /nfs/dbraw/zinc/39/48/04/642394804.db2.gz VXEDOGHGXKPZKO-NSHDSACASA-N 1 2 238.356 2.144 20 0 BEADLO c1ncc(C[N@@H+]2CCOC[C@@H]2CC2CC2)s1 ZINC000933216081 642394810 /nfs/dbraw/zinc/39/48/10/642394810.db2.gz VXEDOGHGXKPZKO-NSHDSACASA-N 1 2 238.356 2.144 20 0 BEADLO COCC[NH+](C/C=C\Cl)C/C=C\Cl ZINC000255355522 642444299 /nfs/dbraw/zinc/44/42/99/642444299.db2.gz WBAMPXLGOZCMHI-JVLMNHKTSA-N 1 2 224.131 2.440 20 0 BEADLO CCC[N@H+](CC)Cn1ncsc1=S ZINC000308214160 642507662 /nfs/dbraw/zinc/50/76/62/642507662.db2.gz IDPKWOSSBFSGCJ-UHFFFAOYSA-N 1 2 217.363 2.363 20 0 BEADLO CCC[N@@H+](CC)Cn1ncsc1=S ZINC000308214160 642507668 /nfs/dbraw/zinc/50/76/68/642507668.db2.gz IDPKWOSSBFSGCJ-UHFFFAOYSA-N 1 2 217.363 2.363 20 0 BEADLO C[C@H](CC(=O)NCCCCn1cc[nH+]c1)C1CC1 ZINC000068116180 642741977 /nfs/dbraw/zinc/74/19/77/642741977.db2.gz YSZWXBFEIYETJP-GFCCVEGCSA-N 1 2 249.358 2.216 20 0 BEADLO CC(C)COC(=O)C[N@@H+]1CCS[C@@H](C)[C@H]1C ZINC000181461195 642873044 /nfs/dbraw/zinc/87/30/44/642873044.db2.gz YEQPWAJMOSKYJX-MNOVXSKESA-N 1 2 245.388 2.011 20 0 BEADLO CC(C)COC(=O)C[N@H+]1CCS[C@@H](C)[C@H]1C ZINC000181461195 642873051 /nfs/dbraw/zinc/87/30/51/642873051.db2.gz YEQPWAJMOSKYJX-MNOVXSKESA-N 1 2 245.388 2.011 20 0 BEADLO Cc1nonc1C[NH2+][C@H](C)c1cccc(F)c1 ZINC000070261758 643007080 /nfs/dbraw/zinc/00/70/80/643007080.db2.gz RFYANHZWXKCOIB-MRVPVSSYSA-N 1 2 235.262 2.368 20 0 BEADLO CCOC(=O)[C@@H](C)[NH2+][C@H](C)Cc1cccs1 ZINC000070917148 643082493 /nfs/dbraw/zinc/08/24/93/643082493.db2.gz UBLJPZLZMSCWPC-NXEZZACHSA-N 1 2 241.356 2.220 20 0 BEADLO COC(=O)[C@@H](C)Nc1ccc([NH+](C)C)cc1C ZINC000090273370 643104818 /nfs/dbraw/zinc/10/48/18/643104818.db2.gz VOCOCTVTKJRWPJ-SNVBAGLBSA-N 1 2 236.315 2.034 20 0 BEADLO Cc1noc(C)c1C[N@@H+](C)[C@@H](C)c1cnccn1 ZINC000184439191 643211133 /nfs/dbraw/zinc/21/11/33/643211133.db2.gz OUXUUERDRXFLAI-JTQLQIEISA-N 1 2 246.314 2.274 20 0 BEADLO Cc1noc(C)c1C[N@H+](C)[C@@H](C)c1cnccn1 ZINC000184439191 643211134 /nfs/dbraw/zinc/21/11/34/643211134.db2.gz OUXUUERDRXFLAI-JTQLQIEISA-N 1 2 246.314 2.274 20 0 BEADLO C[C@@H](CSC(C)(C)C)[NH2+]CC(F)(F)CO ZINC000184688149 643229167 /nfs/dbraw/zinc/22/91/67/643229167.db2.gz CMZWZEZGHDVBFT-QMMMGPOBSA-N 1 2 241.347 2.124 20 0 BEADLO Clc1cnn(C[N@@H+]2CCCC3(CC3)C2)c1 ZINC000184864435 643244657 /nfs/dbraw/zinc/24/46/57/643244657.db2.gz PPGMOOGGQJSLLP-UHFFFAOYSA-N 1 2 225.723 2.370 20 0 BEADLO Clc1cnn(C[N@H+]2CCCC3(CC3)C2)c1 ZINC000184864435 643244662 /nfs/dbraw/zinc/24/46/62/643244662.db2.gz PPGMOOGGQJSLLP-UHFFFAOYSA-N 1 2 225.723 2.370 20 0 BEADLO CCOC(=O)C[N@@H+](Cc1ccoc1)CC(C)C ZINC000091789944 643333751 /nfs/dbraw/zinc/33/37/51/643333751.db2.gz LXPCNCGKDBJCCK-UHFFFAOYSA-N 1 2 239.315 2.301 20 0 BEADLO CCOC(=O)C[N@H+](Cc1ccoc1)CC(C)C ZINC000091789944 643333756 /nfs/dbraw/zinc/33/37/56/643333756.db2.gz LXPCNCGKDBJCCK-UHFFFAOYSA-N 1 2 239.315 2.301 20 0 BEADLO CCn1cc(C[N@H+](C)C/C=C/Cl)cn1 ZINC000073167442 643405178 /nfs/dbraw/zinc/40/51/78/643405178.db2.gz DLYDQJJLBGLYNH-SNAWJCMRSA-N 1 2 213.712 2.087 20 0 BEADLO CCn1cc(C[N@@H+](C)C/C=C/Cl)cn1 ZINC000073167442 643405182 /nfs/dbraw/zinc/40/51/82/643405182.db2.gz DLYDQJJLBGLYNH-SNAWJCMRSA-N 1 2 213.712 2.087 20 0 BEADLO Cn1c[nH+]cc1CNc1ncc(Cl)s1 ZINC000307125059 643411748 /nfs/dbraw/zinc/41/17/48/643411748.db2.gz ZJQROLCBNDBAFH-UHFFFAOYSA-N 1 2 228.708 2.142 20 0 BEADLO FC1(F)CC2(C[NH+](C/C=C/Cl)C2)C1 ZINC000307148363 643413016 /nfs/dbraw/zinc/41/30/16/643413016.db2.gz PEWNGIFXRRVBCK-OWOJBTEDSA-N 1 2 207.651 2.470 20 0 BEADLO Cc1cnc(C[N@@H+]2CC(C)(C)OCC2(C)C)cn1 ZINC000734485108 643499525 /nfs/dbraw/zinc/49/95/25/643499525.db2.gz AHLFGGJKTYJURO-UHFFFAOYSA-N 1 2 249.358 2.174 20 0 BEADLO Cc1cnc(C[N@H+]2CC(C)(C)OCC2(C)C)cn1 ZINC000734485108 643499526 /nfs/dbraw/zinc/49/95/26/643499526.db2.gz AHLFGGJKTYJURO-UHFFFAOYSA-N 1 2 249.358 2.174 20 0 BEADLO C[C@@H]1C(=O)CCC[N@H+]1C[C@H]1CCC(F)(F)C1 ZINC000932847130 643527760 /nfs/dbraw/zinc/52/77/60/643527760.db2.gz VVDZXVBMEKCIHU-ZJUUUORDSA-N 1 2 231.286 2.475 20 0 BEADLO C[C@@H]1C(=O)CCC[N@@H+]1C[C@H]1CCC(F)(F)C1 ZINC000932847130 643527774 /nfs/dbraw/zinc/52/77/74/643527774.db2.gz VVDZXVBMEKCIHU-ZJUUUORDSA-N 1 2 231.286 2.475 20 0 BEADLO CC(C)C1(O)C[NH+](Cc2ccc(F)cc2)C1 ZINC000084376845 643660521 /nfs/dbraw/zinc/66/05/21/643660521.db2.gz TZOMERMWPRAAEC-UHFFFAOYSA-N 1 2 223.291 2.028 20 0 BEADLO C/C(=C/C(=O)OCc1ccc(N)[nH+]c1)C1CC1 ZINC000922369228 643981435 /nfs/dbraw/zinc/98/14/35/643981435.db2.gz FLUSUKWDKOVMRQ-TWGQIWQCSA-N 1 2 232.283 2.063 20 0 BEADLO C[C@@H](C(=O)OCc1ccc[nH+]c1N)C(C)(C)C ZINC000922461315 643997945 /nfs/dbraw/zinc/99/79/45/643997945.db2.gz LTFJGJZENDXPMQ-VIFPVBQESA-N 1 2 236.315 2.389 20 0 BEADLO CC1(C)C(C(=O)OCc2ccc[nH+]c2N)C1(C)C ZINC000922501108 644006668 /nfs/dbraw/zinc/00/66/68/644006668.db2.gz GTDFDCIQWBLKAY-UHFFFAOYSA-N 1 2 248.326 2.389 20 0 BEADLO CCC1(C(=O)OCc2ccc[nH+]c2N)CCC1 ZINC000922515071 644010776 /nfs/dbraw/zinc/01/07/76/644010776.db2.gz VKTLUVLCHFTTAT-UHFFFAOYSA-N 1 2 234.299 2.287 20 0 BEADLO C[C@H]1CC[C@H](C(=O)OCc2ccc[nH+]c2N)C1 ZINC000922586781 644035862 /nfs/dbraw/zinc/03/58/62/644035862.db2.gz JOKUYEYINAQXFG-UWVGGRQHSA-N 1 2 234.299 2.143 20 0 BEADLO CC/C(C)=C(/C)C(=O)OCc1ccc[nH+]c1N ZINC000922593551 644038348 /nfs/dbraw/zinc/03/83/48/644038348.db2.gz LHRDYYJEZFNCOV-KTKRTIGZSA-N 1 2 234.299 2.453 20 0 BEADLO CC[C@@H](C)[C@@H](C)C(=O)OCc1ccc[nH+]c1N ZINC000922593641 644038440 /nfs/dbraw/zinc/03/84/40/644038440.db2.gz OUQWXKPNSLTROR-NXEZZACHSA-N 1 2 236.315 2.389 20 0 BEADLO CC[C@H](C)CC(=O)OCc1ccc[nH+]c1N ZINC000922639795 644046749 /nfs/dbraw/zinc/04/67/49/644046749.db2.gz AVLFYOCPPJWBNK-VIFPVBQESA-N 1 2 222.288 2.143 20 0 BEADLO CC(C)(/C=C\Cl)[NH2+]Cc1cocn1 ZINC000922648416 644053200 /nfs/dbraw/zinc/05/32/00/644053200.db2.gz IYZVQUDKSBCPKA-ARJAWSKDSA-N 1 2 200.669 2.295 20 0 BEADLO Nc1ccc(COC(=O)C(F)=C2CCC2)c[nH+]1 ZINC000922821808 644110068 /nfs/dbraw/zinc/11/00/68/644110068.db2.gz XNYHLDCEGNIIIU-UHFFFAOYSA-N 1 2 236.246 2.115 20 0 BEADLO Nc1[nH+]cccc1COC(=O)/C=C\C1CCCC1 ZINC000922837545 644115447 /nfs/dbraw/zinc/11/54/47/644115447.db2.gz ALNVPSCXELGZOW-FPLPWBNLSA-N 1 2 246.310 2.453 20 0 BEADLO CC[C@@H]1C[C@H]1COC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000922841895 644116005 /nfs/dbraw/zinc/11/60/05/644116005.db2.gz DYWQPSURWGLTOV-UTUOFQBUSA-N 1 2 236.315 2.424 20 0 BEADLO Cc1cnc(C[NH2+][C@@H](c2cnn(C)c2)C(C)C)o1 ZINC000922889348 644132003 /nfs/dbraw/zinc/13/20/03/644132003.db2.gz DQWLQTROGODVCG-CYBMUJFWSA-N 1 2 248.330 2.203 20 0 BEADLO Cc1cnc(C[NH2+][C@H](c2cnn(C)c2)C(C)C)o1 ZINC000922889349 644132964 /nfs/dbraw/zinc/13/29/64/644132964.db2.gz DQWLQTROGODVCG-ZDUSSCGKSA-N 1 2 248.330 2.203 20 0 BEADLO C[C@@H]([NH2+][C@H](C)c1ccnn1C)c1nccs1 ZINC000192251757 644141065 /nfs/dbraw/zinc/14/10/65/644141065.db2.gz HCHHDNRXAPFCKW-RKDXNWHRSA-N 1 2 236.344 2.288 20 0 BEADLO CCc1onc(C)c1C[NH2+]Cc1nccn1CC ZINC000922988114 644216901 /nfs/dbraw/zinc/21/69/01/644216901.db2.gz MPEAKPHOBXBZLW-UHFFFAOYSA-N 1 2 248.330 2.052 20 0 BEADLO COc1ccccc1[C@H](O)CNc1cccc[nH+]1 ZINC000193913236 644288249 /nfs/dbraw/zinc/28/82/49/644288249.db2.gz GQNTVPJMMHILGW-GFCCVEGCSA-N 1 2 244.294 2.236 20 0 BEADLO O=C(c1cccc2[nH+]ccn21)N1CCCCCC1 ZINC000082320167 644368816 /nfs/dbraw/zinc/36/88/16/644368816.db2.gz BNYJIHZIIFWIII-UHFFFAOYSA-N 1 2 243.310 2.351 20 0 BEADLO Cn1c[nH+]cc1COC(=O)CC1CCCCC1 ZINC000084503276 644426403 /nfs/dbraw/zinc/42/64/03/644426403.db2.gz VEZKULNVNBGJFS-UHFFFAOYSA-N 1 2 236.315 2.434 20 0 BEADLO CCOC(=O)CC[N@H+](C)C/C(Cl)=C/Cl ZINC000086001377 644453633 /nfs/dbraw/zinc/45/36/33/644453633.db2.gz TYXCYOPDIGJTJR-VURMDHGXSA-N 1 2 240.130 2.190 20 0 BEADLO CCOC(=O)CC[N@@H+](C)C/C(Cl)=C/Cl ZINC000086001377 644453636 /nfs/dbraw/zinc/45/36/36/644453636.db2.gz TYXCYOPDIGJTJR-VURMDHGXSA-N 1 2 240.130 2.190 20 0 BEADLO CC/C(C)=C(/C)C(=O)N[C@@H]1CCn2cc[nH+]c2C1 ZINC000779215000 644710433 /nfs/dbraw/zinc/71/04/33/644710433.db2.gz IVIQBVWMZXMDKA-NLYDNYMLSA-N 1 2 247.342 2.061 20 0 BEADLO Cc1cc(NC(=O)N[C@H]2CC[C@@H](C)C2)c(C)c[nH+]1 ZINC000782059443 644739991 /nfs/dbraw/zinc/73/99/91/644739991.db2.gz WYGYNHHYYTWDDO-SKDRFNHKSA-N 1 2 247.342 2.430 20 0 BEADLO C[C@@H]1CC[C@@H]1[NH2+]c1ccc(N(C)CCO)cc1 ZINC000783280321 644752281 /nfs/dbraw/zinc/75/22/81/644752281.db2.gz JLPKFTASLXWXPF-RISCZKNCSA-N 1 2 234.343 2.326 20 0 BEADLO CC[C@H](C)CCC(=O)OCc1c[nH+]cn1C ZINC000797107160 644817260 /nfs/dbraw/zinc/81/72/60/644817260.db2.gz ZRPPLBQFDHPEJP-JTQLQIEISA-N 1 2 224.304 2.290 20 0 BEADLO COC(=O)C[N@H+](CCSC(C)(C)C)C1CC1 ZINC000801925934 644845286 /nfs/dbraw/zinc/84/52/86/644845286.db2.gz LCSASSSANNINDY-UHFFFAOYSA-N 1 2 245.388 2.156 20 0 BEADLO COC(=O)C[N@@H+](CCSC(C)(C)C)C1CC1 ZINC000801925934 644845288 /nfs/dbraw/zinc/84/52/88/644845288.db2.gz LCSASSSANNINDY-UHFFFAOYSA-N 1 2 245.388 2.156 20 0 BEADLO CC1(CNC(=O)Cc2[nH]cc[nH+]2)CCCCC1 ZINC000830004772 645112894 /nfs/dbraw/zinc/11/28/94/645112894.db2.gz ORMLNJCAUXSGJW-UHFFFAOYSA-N 1 2 235.331 2.039 20 0 BEADLO C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2F)c2ncnn21 ZINC000926586549 645303224 /nfs/dbraw/zinc/30/32/24/645303224.db2.gz CHSAKCCRMSAKNH-DBIOUOCHSA-N 1 2 238.310 2.154 20 0 BEADLO CCC[C@@H](C)[C@@H](CO)[NH2+]CC(F)(F)C(F)F ZINC000844378793 645322093 /nfs/dbraw/zinc/32/20/93/645322093.db2.gz MLLOGDPUIYTKDT-HTQZYQBOSA-N 1 2 245.260 2.274 20 0 BEADLO FC1(F)C[C@]12CCC[N@H+](Cc1cnns1)C2 ZINC000844444661 645334561 /nfs/dbraw/zinc/33/45/61/645334561.db2.gz SHRVWYOYXZTLCN-VIFPVBQESA-N 1 2 245.298 2.159 20 0 BEADLO FC1(F)C[C@]12CCC[N@@H+](Cc1cnns1)C2 ZINC000844444661 645334563 /nfs/dbraw/zinc/33/45/63/645334563.db2.gz SHRVWYOYXZTLCN-VIFPVBQESA-N 1 2 245.298 2.159 20 0 BEADLO CC[C@H]1COC[C@H]1Nc1cc(COC)cc[nH+]1 ZINC000926660523 645341662 /nfs/dbraw/zinc/34/16/62/645341662.db2.gz JOTHTHYQBJCXJU-NWDGAFQWSA-N 1 2 236.315 2.065 20 0 BEADLO COCc1cc[nH+]c(N[C@@H](C)c2ccnnc2)c1 ZINC000926659167 645341982 /nfs/dbraw/zinc/34/19/82/645341982.db2.gz FLDBNOZSJFYLKW-JTQLQIEISA-N 1 2 244.298 2.191 20 0 BEADLO C[C@H](CC(=O)OCC(C)(C)C)n1cc[nH+]c1 ZINC000845463870 645364930 /nfs/dbraw/zinc/36/49/30/645364930.db2.gz SCIZIYZBRHLAKU-SNVBAGLBSA-N 1 2 224.304 2.424 20 0 BEADLO CCC(F)(F)C[NH2+][C@H](C)c1cc[nH]c(=O)c1 ZINC000926757123 645406185 /nfs/dbraw/zinc/40/61/85/645406185.db2.gz PESWJFOZLCHDKD-MRVPVSSYSA-N 1 2 230.258 2.483 20 0 BEADLO Cc1cc(N[C@@H](C)C[C@H]2CCC(=O)N2)c[nH+]c1C ZINC000926854660 645457143 /nfs/dbraw/zinc/45/71/43/645457143.db2.gz FJKRXFKZLAIWFR-CMPLNLGQSA-N 1 2 247.342 2.168 20 0 BEADLO CCc1onc(C)c1C[NH2+][C@@H](C)c1ccn(C)n1 ZINC000927133367 645564022 /nfs/dbraw/zinc/56/40/22/645564022.db2.gz CGZKKXVQFCUMRI-JTQLQIEISA-N 1 2 248.330 2.130 20 0 BEADLO Cc1c(F)cccc1NC(=O)Cc1[nH]cc[nH+]1 ZINC000857458979 645565060 /nfs/dbraw/zinc/56/50/60/645565060.db2.gz ZMKDVUCMSBRAHF-UHFFFAOYSA-N 1 2 233.246 2.038 20 0 BEADLO CCc1onc(C)c1C[NH2+][C@H](C)c1cnccn1 ZINC000927139395 645566579 /nfs/dbraw/zinc/56/65/79/645566579.db2.gz IIQBFJVYLGMIDB-SNVBAGLBSA-N 1 2 246.314 2.186 20 0 BEADLO CCCC(C)(C)C(=O)NCc1ccc(N)[nH+]c1 ZINC000927778454 645657027 /nfs/dbraw/zinc/65/70/27/645657027.db2.gz VQCXIWODZABUGM-UHFFFAOYSA-N 1 2 235.331 2.106 20 0 BEADLO CC[C@@H](CC(=O)NCc1ccc(N)[nH+]c1)C(C)C ZINC000927781036 645657724 /nfs/dbraw/zinc/65/77/24/645657724.db2.gz SKCNKDSVMUMBRO-LBPRGKRZSA-N 1 2 249.358 2.352 20 0 BEADLO CCn1cc(C[N@H+](CC)Cc2ccccc2)nn1 ZINC000883996004 645865292 /nfs/dbraw/zinc/86/52/92/645865292.db2.gz COXNDYBJGWMBIA-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CCn1cc(C[N@@H+](CC)Cc2ccccc2)nn1 ZINC000883996004 645865298 /nfs/dbraw/zinc/86/52/98/645865298.db2.gz COXNDYBJGWMBIA-UHFFFAOYSA-N 1 2 244.342 2.320 20 0 BEADLO CC[C@H](C)[C@H](C(=O)OC)[N@H+](C)Cc1ccco1 ZINC000929137690 645966352 /nfs/dbraw/zinc/96/63/52/645966352.db2.gz GXQQTZHUGPSKNX-CMPLNLGQSA-N 1 2 239.315 2.299 20 0 BEADLO CC[C@H](C)[C@H](C(=O)OC)[N@@H+](C)Cc1ccco1 ZINC000929137690 645966358 /nfs/dbraw/zinc/96/63/58/645966358.db2.gz GXQQTZHUGPSKNX-CMPLNLGQSA-N 1 2 239.315 2.299 20 0 BEADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccc(N)nc1 ZINC000929190035 645993515 /nfs/dbraw/zinc/99/35/15/645993515.db2.gz DVHYTSDRDKBWNN-LLVKDONJSA-N 1 2 242.326 2.042 20 0 BEADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1ccc(N)nc1 ZINC000929190035 645993519 /nfs/dbraw/zinc/99/35/19/645993519.db2.gz DVHYTSDRDKBWNN-LLVKDONJSA-N 1 2 242.326 2.042 20 0 BEADLO O=C(OCCCn1cc[nH+]c1)[C@]12C[C@H]1CCC2 ZINC000924433120 646037498 /nfs/dbraw/zinc/03/74/98/646037498.db2.gz RBHLBKFFFWRAQN-DGCLKSJQSA-N 1 2 234.299 2.007 20 0 BEADLO Cc1cc(C[N@H+](C)CCc2ccns2)no1 ZINC000929258069 646040114 /nfs/dbraw/zinc/04/01/14/646040114.db2.gz SNZRPOSDTKAZHL-UHFFFAOYSA-N 1 2 237.328 2.114 20 0 BEADLO Cc1cc(C[N@@H+](C)CCc2ccns2)no1 ZINC000929258069 646040119 /nfs/dbraw/zinc/04/01/19/646040119.db2.gz SNZRPOSDTKAZHL-UHFFFAOYSA-N 1 2 237.328 2.114 20 0 BEADLO Cc1cc(C[N@H+](C)Cc2ccoc2)c(C)nn1 ZINC000929328492 646081118 /nfs/dbraw/zinc/08/11/18/646081118.db2.gz SZVNVHNYUQLALD-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO Cc1cc(C[N@@H+](C)Cc2ccoc2)c(C)nn1 ZINC000929328492 646081121 /nfs/dbraw/zinc/08/11/21/646081121.db2.gz SZVNVHNYUQLALD-UHFFFAOYSA-N 1 2 231.299 2.318 20 0 BEADLO C[N@H+](Cc1ccoc1)Cc1cnn(CCF)c1 ZINC000929327799 646081690 /nfs/dbraw/zinc/08/16/90/646081690.db2.gz LZGMJPTVMUALJI-UHFFFAOYSA-N 1 2 237.278 2.078 20 0 BEADLO C[N@@H+](Cc1ccoc1)Cc1cnn(CCF)c1 ZINC000929327799 646081698 /nfs/dbraw/zinc/08/16/98/646081698.db2.gz LZGMJPTVMUALJI-UHFFFAOYSA-N 1 2 237.278 2.078 20 0 BEADLO CCc1ncc(C[N@H+](C)Cc2ccoc2)o1 ZINC000929327835 646082557 /nfs/dbraw/zinc/08/25/57/646082557.db2.gz NBNJRRUNNAGUDX-UHFFFAOYSA-N 1 2 220.272 2.462 20 0 BEADLO CCc1ncc(C[N@@H+](C)Cc2ccoc2)o1 ZINC000929327835 646082560 /nfs/dbraw/zinc/08/25/60/646082560.db2.gz NBNJRRUNNAGUDX-UHFFFAOYSA-N 1 2 220.272 2.462 20 0 BEADLO C[C@H]([NH2+][C@H]1CCCc2c1cnn2C)c1ncco1 ZINC000924650910 646086064 /nfs/dbraw/zinc/08/60/64/646086064.db2.gz MLOQQBZVSZCLFO-ONGXEEELSA-N 1 2 246.314 2.136 20 0 BEADLO C[C@@H]([NH2+][C@H]1CCCc2c1cnn2C)c1ncco1 ZINC000924650908 646086731 /nfs/dbraw/zinc/08/67/31/646086731.db2.gz MLOQQBZVSZCLFO-KOLCDFICSA-N 1 2 246.314 2.136 20 0 BEADLO COc1nnc(C[N@@H+]2CCC[C@@H](C)CC2)s1 ZINC000929362929 646095738 /nfs/dbraw/zinc/09/57/38/646095738.db2.gz BTXMRMVAXUZYJP-SECBINFHSA-N 1 2 241.360 2.169 20 0 BEADLO COc1nnc(C[N@H+]2CCC[C@@H](C)CC2)s1 ZINC000929362929 646095741 /nfs/dbraw/zinc/09/57/41/646095741.db2.gz BTXMRMVAXUZYJP-SECBINFHSA-N 1 2 241.360 2.169 20 0 BEADLO C[C@H](CO)[NH2+][C@H](C)C(F)(F)c1ccccc1 ZINC000924755141 646102081 /nfs/dbraw/zinc/10/20/81/646102081.db2.gz XFTHXICCRIYVKG-NXEZZACHSA-N 1 2 229.270 2.137 20 0 BEADLO COC[C@@H](C[N@H+](C)CC(F)F)C(C)C ZINC000929515483 646164322 /nfs/dbraw/zinc/16/43/22/646164322.db2.gz KTUJOHSWJLXBJY-SECBINFHSA-N 1 2 209.280 2.102 20 0 BEADLO COC[C@@H](C[N@@H+](C)CC(F)F)C(C)C ZINC000929515483 646164326 /nfs/dbraw/zinc/16/43/26/646164326.db2.gz KTUJOHSWJLXBJY-SECBINFHSA-N 1 2 209.280 2.102 20 0 BEADLO Cc1cc(C)nc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)c1 ZINC000929758691 646292564 /nfs/dbraw/zinc/29/25/64/646292564.db2.gz FZASHCIGSJAGQN-OKILXGFUSA-N 1 2 232.327 2.062 20 0 BEADLO Cc1cc(C)nc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c1 ZINC000929758691 646292569 /nfs/dbraw/zinc/29/25/69/646292569.db2.gz FZASHCIGSJAGQN-OKILXGFUSA-N 1 2 232.327 2.062 20 0 BEADLO CCc1cnc(C[N@H+](C)CCOC2CC2)s1 ZINC000929774638 646302319 /nfs/dbraw/zinc/30/23/19/646302319.db2.gz SXPFYMRTOBRDKX-UHFFFAOYSA-N 1 2 240.372 2.316 20 0 BEADLO CCc1cnc(C[N@@H+](C)CCOC2CC2)s1 ZINC000929774638 646302323 /nfs/dbraw/zinc/30/23/23/646302323.db2.gz SXPFYMRTOBRDKX-UHFFFAOYSA-N 1 2 240.372 2.316 20 0 BEADLO CC[C@]1(C)CC[N@H+](Cc2nnc(OC)s2)C1 ZINC000929827517 646343675 /nfs/dbraw/zinc/34/36/75/646343675.db2.gz CPVMKVPVBQYIJP-LLVKDONJSA-N 1 2 241.360 2.169 20 0 BEADLO CC[C@]1(C)CC[N@@H+](Cc2nnc(OC)s2)C1 ZINC000929827517 646343677 /nfs/dbraw/zinc/34/36/77/646343677.db2.gz CPVMKVPVBQYIJP-LLVKDONJSA-N 1 2 241.360 2.169 20 0 BEADLO CC[C@@]1(C)CC[N@H+](Cc2nnc(OC)s2)C1 ZINC000929827518 646344277 /nfs/dbraw/zinc/34/42/77/646344277.db2.gz CPVMKVPVBQYIJP-NSHDSACASA-N 1 2 241.360 2.169 20 0 BEADLO CC[C@@]1(C)CC[N@@H+](Cc2nnc(OC)s2)C1 ZINC000929827518 646344281 /nfs/dbraw/zinc/34/42/81/646344281.db2.gz CPVMKVPVBQYIJP-NSHDSACASA-N 1 2 241.360 2.169 20 0 BEADLO c1cn(C[C@@H]2CCCC3(CCC3)O2)c[nH+]1 ZINC000929865330 646365864 /nfs/dbraw/zinc/36/58/64/646365864.db2.gz BXLKZCCUNBPBPS-NSHDSACASA-N 1 2 206.289 2.375 20 0 BEADLO FC(F)(F)[C@@H]1CCC[C@H](Cn2cc[nH+]c2)O1 ZINC000929865360 646366800 /nfs/dbraw/zinc/36/68/00/646366800.db2.gz CWGUBLIJXVBSNR-BDAKNGLRSA-N 1 2 234.221 2.383 20 0 BEADLO Cc1cscc1C[NH2+][C@H](C)c1cnn(C)n1 ZINC000926304386 646614228 /nfs/dbraw/zinc/61/42/28/646614228.db2.gz SDJGJMVXEMBXCA-SECBINFHSA-N 1 2 236.344 2.036 20 0 BEADLO CCc1noc(C)c1C[NH2+][C@H](C)c1cn(C)cn1 ZINC000926482157 646655215 /nfs/dbraw/zinc/65/52/15/646655215.db2.gz OWYORRDULBIKCC-SECBINFHSA-N 1 2 248.330 2.130 20 0 BEADLO Cc1csc(C[NH2+]Cc2c[nH]cn2)c1 ZINC000382207172 711602263 /nfs/dbraw/zinc/60/22/63/711602263.db2.gz VDRNTUQSUGPJEP-UHFFFAOYSA-N 1 2 207.302 2.069 20 0 BEADLO Cc1ccc(NC(=O)C[C@@H]([NH3+])C(F)F)cc1F ZINC000724741158 711609873 /nfs/dbraw/zinc/60/98/73/711609873.db2.gz USWBXDOJRYNXTG-SECBINFHSA-N 1 2 246.232 2.055 20 0 BEADLO [NH3+][C@H](CC(=O)NCCCC1CCCC1)C(F)F ZINC000724759549 711610684 /nfs/dbraw/zinc/61/06/84/711610684.db2.gz QXZZWKIPYYWVEY-SNVBAGLBSA-N 1 2 248.317 2.056 20 0 BEADLO FC(F)[C@@H]1CC[N@H+](Cc2cnc(Cl)cn2)C1 ZINC000707166395 712165872 /nfs/dbraw/zinc/16/58/72/712165872.db2.gz DTYJLAPHHKJOGS-SSDOTTSWSA-N 1 2 247.676 2.217 20 0 BEADLO FC(F)[C@@H]1CC[N@@H+](Cc2cnc(Cl)cn2)C1 ZINC000707166395 712165874 /nfs/dbraw/zinc/16/58/74/712165874.db2.gz DTYJLAPHHKJOGS-SSDOTTSWSA-N 1 2 247.676 2.217 20 0 BEADLO C[C@@H]([NH2+][C@@H](C)c1cnccn1)c1ccns1 ZINC000716036231 712547554 /nfs/dbraw/zinc/54/75/54/712547554.db2.gz ZXYHEBNGTKPAMK-DTWKUNHWSA-N 1 2 234.328 2.345 20 0 BEADLO Cc1[nH]nc(CNc2[nH+]cccc2C)c1C ZINC000716446792 712561416 /nfs/dbraw/zinc/56/14/16/712561416.db2.gz LVHUMBZDOSDXPH-UHFFFAOYSA-N 1 2 216.288 2.342 20 0 BEADLO